smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](Cc1nccn1C)C1CC1 ZINC000076745489 185038722 /nfs/dbraw/zinc/03/87/22/185038722.db2.gz RGKPKYYYIUQMNI-GFCCVEGCSA-N 1 2 323.362 4.165 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](Cc1nccn1C)C1CC1 ZINC000076745489 185038723 /nfs/dbraw/zinc/03/87/23/185038723.db2.gz RGKPKYYYIUQMNI-GFCCVEGCSA-N 1 2 323.362 4.165 20 0 DIADLO COc1cccc(C[NH2+][C@H](C)c2csc(C(C)C)n2)c1OC ZINC000076900354 185052377 /nfs/dbraw/zinc/05/23/77/185052377.db2.gz UDIGOXCRBJPISH-GFCCVEGCSA-N 1 2 320.458 4.135 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCCC2)c1nc(C2CC2)no1 ZINC000079291122 185163498 /nfs/dbraw/zinc/16/34/98/185163498.db2.gz FYSHGRKMBKKTKO-QWHCGFSZSA-N 1 2 311.429 4.238 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2cnc(Cl)s2)s1 ZINC000079325528 185165031 /nfs/dbraw/zinc/16/50/31/185165031.db2.gz AAPGWBKWDXOVDK-VIFPVBQESA-N 1 2 315.895 4.317 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2cnc(Cl)s2)s1 ZINC000079325528 185165032 /nfs/dbraw/zinc/16/50/32/185165032.db2.gz AAPGWBKWDXOVDK-VIFPVBQESA-N 1 2 315.895 4.317 20 0 DIADLO Cn1cc[nH+]c1CNc1cc(Cl)ccc1Oc1ccccc1 ZINC000096970434 185394705 /nfs/dbraw/zinc/39/47/05/185394705.db2.gz BQOJLXRTVATUFX-UHFFFAOYSA-N 1 2 313.788 4.478 20 0 DIADLO CC(F)(F)C[NH2+][C@H]1CCCc2c(Br)cccc21 ZINC000550860236 341324782 /nfs/dbraw/zinc/32/47/82/341324782.db2.gz GSVREQPPFHTFMG-LBPRGKRZSA-N 1 2 304.178 4.071 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)[C@@H](c1ccccc1)C1CC1 ZINC000152323177 334973641 /nfs/dbraw/zinc/97/36/41/334973641.db2.gz YTKHGJPBGVHQCR-SFHVURJKSA-N 1 2 317.392 4.209 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000076120380 191582389 /nfs/dbraw/zinc/58/23/89/191582389.db2.gz QEEUDJVULKDLJE-JSGCOSHPSA-N 1 2 303.406 4.068 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000076120380 191582390 /nfs/dbraw/zinc/58/23/90/191582390.db2.gz QEEUDJVULKDLJE-JSGCOSHPSA-N 1 2 303.406 4.068 20 0 DIADLO COC[C@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1ccco1 ZINC000080240605 192015855 /nfs/dbraw/zinc/01/58/55/192015855.db2.gz MTUNNHYKVOHYOC-ZDUSSCGKSA-N 1 2 300.185 4.064 20 0 DIADLO C[C@@H]1CCN(c2nc(-c3ccccc3)cs2)C[C@@H]1n1cc[nH+]c1 ZINC000134124630 334985843 /nfs/dbraw/zinc/98/58/43/334985843.db2.gz FSTSETZBBINHQL-PBHICJAKSA-N 1 2 324.453 4.094 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)[C@@H]2CC[C@@H](C)O2)c1C(C)C ZINC000191321637 334988975 /nfs/dbraw/zinc/98/89/75/334988975.db2.gz LHRUSENVRPICPS-WBMJQRKESA-N 1 2 312.413 4.173 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2nc3ccccc3n2C)cs1 ZINC000091337250 193043543 /nfs/dbraw/zinc/04/35/43/193043543.db2.gz CXHJPIIYNONTAQ-RYUDHWBXSA-N 1 2 314.458 4.004 20 0 DIADLO CC(C)CCc1nc(C[N@H+](C)[C@@H](C)c2ccccn2)cs1 ZINC000091702306 193093735 /nfs/dbraw/zinc/09/37/35/193093735.db2.gz ILGDJMDMHFVSKH-AWEZNQCLSA-N 1 2 303.475 4.320 20 0 DIADLO CC(C)CCc1nc(C[N@@H+](C)[C@@H](C)c2ccccn2)cs1 ZINC000091702306 193093736 /nfs/dbraw/zinc/09/37/36/193093736.db2.gz ILGDJMDMHFVSKH-AWEZNQCLSA-N 1 2 303.475 4.320 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1nccs1 ZINC000091735975 193098775 /nfs/dbraw/zinc/09/87/75/193098775.db2.gz PEYOKMSMORLYIV-KGLIPLIRSA-N 1 2 304.459 4.480 20 0 DIADLO CC(C)c1csc(C[NH2+][C@@H](C)c2nc3c(s2)CCCC3)n1 ZINC000091738387 193099874 /nfs/dbraw/zinc/09/98/74/193099874.db2.gz IAQAWJIZHPHJLU-NSHDSACASA-N 1 2 321.515 4.453 20 0 DIADLO Cc1c2ccccc2oc1CNC(=O)Nc1ccc(C)[nH+]c1C ZINC000152358366 335012296 /nfs/dbraw/zinc/01/22/96/335012296.db2.gz PRLBFBFYRQVZPB-UHFFFAOYSA-N 1 2 309.369 4.075 20 0 DIADLO Cc1ncsc1C[N@H+]1C[C@@H](c2ccccc2Cl)OC[C@@H]1C ZINC000093364374 193239787 /nfs/dbraw/zinc/23/97/87/193239787.db2.gz FMELWGUAPQGXNP-NHYWBVRUSA-N 1 2 322.861 4.067 20 0 DIADLO Cc1ncsc1C[N@@H+]1C[C@@H](c2ccccc2Cl)OC[C@@H]1C ZINC000093364374 193239788 /nfs/dbraw/zinc/23/97/88/193239788.db2.gz FMELWGUAPQGXNP-NHYWBVRUSA-N 1 2 322.861 4.067 20 0 DIADLO Cc1ncsc1C[N@H+]1C[C@H](c2ccccc2Cl)OC[C@@H]1C ZINC000093364373 193240002 /nfs/dbraw/zinc/24/00/02/193240002.db2.gz FMELWGUAPQGXNP-XHDPSFHLSA-N 1 2 322.861 4.067 20 0 DIADLO Cc1ncsc1C[N@@H+]1C[C@H](c2ccccc2Cl)OC[C@@H]1C ZINC000093364373 193240003 /nfs/dbraw/zinc/24/00/03/193240003.db2.gz FMELWGUAPQGXNP-XHDPSFHLSA-N 1 2 322.861 4.067 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1OC1CCCC1)c1nccs1 ZINC000093399328 193245051 /nfs/dbraw/zinc/24/50/51/193245051.db2.gz QUYDRIIMNIYFOD-CYBMUJFWSA-N 1 2 302.443 4.315 20 0 DIADLO C[N@H+](Cc1nccs1)Cc1ccccc1OC1CCCC1 ZINC000093582129 193270062 /nfs/dbraw/zinc/27/00/62/193270062.db2.gz LYXRAZQUOFTBRA-UHFFFAOYSA-N 1 2 302.443 4.097 20 0 DIADLO C[N@@H+](Cc1nccs1)Cc1ccccc1OC1CCCC1 ZINC000093582129 193270064 /nfs/dbraw/zinc/27/00/64/193270064.db2.gz LYXRAZQUOFTBRA-UHFFFAOYSA-N 1 2 302.443 4.097 20 0 DIADLO Cc1cc(NC(=O)[C@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)cc[nH+]1 ZINC000010634839 181675237 /nfs/dbraw/zinc/67/52/37/181675237.db2.gz VLWXWFMMCBAIDF-GJZGRUSLSA-N 1 2 320.314 4.151 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2ccc(C(F)(F)F)cc2)c(C)[nH+]1 ZINC000097213973 193692843 /nfs/dbraw/zinc/69/28/43/193692843.db2.gz FGJMBWXJHMFJPG-UHFFFAOYSA-N 1 2 322.330 4.207 20 0 DIADLO COc1c(C)c[nH+]c(COc2ccc(Br)cc2)c1C ZINC000019844440 182156264 /nfs/dbraw/zinc/15/62/64/182156264.db2.gz IFYVWZHLEQGGPG-UHFFFAOYSA-N 1 2 322.202 4.049 20 0 DIADLO Cc1cc(NCc2nccn2CC(C)C)c2cccc(F)c2[nH+]1 ZINC000135304167 335029279 /nfs/dbraw/zinc/02/92/79/335029279.db2.gz DLQDTXASZODRAL-UHFFFAOYSA-N 1 2 312.392 4.147 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@@H+](Cc2ccnc3ccccc23)C1 ZINC000040465486 183072099 /nfs/dbraw/zinc/07/20/99/183072099.db2.gz VAUUNXJOJLSHMH-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@H+](Cc2ccnc3ccccc23)C1 ZINC000040465486 183072101 /nfs/dbraw/zinc/07/21/01/183072101.db2.gz VAUUNXJOJLSHMH-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccc(F)cc1)C1CCC1)c1nc(C2CC2)no1 ZINC000104706368 194029892 /nfs/dbraw/zinc/02/98/92/194029892.db2.gz FGHOJYMNMYNUCQ-ZBEGNZNMSA-N 1 2 315.392 4.278 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2nc(C(C)(C)C)cs2)o1 ZINC000105498625 194107547 /nfs/dbraw/zinc/10/75/47/194107547.db2.gz FIZLJEBMUKKFBA-AAEUAGOBSA-N 1 2 304.459 4.447 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)c1ccc(Cl)s1 ZINC000193114296 335042902 /nfs/dbraw/zinc/04/29/02/335042902.db2.gz HARFIRDNYVSUHJ-RKDXNWHRSA-N 1 2 313.854 4.494 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000152402469 335057497 /nfs/dbraw/zinc/05/74/97/335057497.db2.gz MLTMUNKCMKNKBJ-NSHDSACASA-N 1 2 303.793 4.235 20 0 DIADLO Fc1ccc([C@@H]2C[C@H](Nc3cc[nH+]c4ccncc34)CCO2)cc1 ZINC000273274538 130102563 /nfs/dbraw/zinc/10/25/63/130102563.db2.gz IBNOKSNBFAQWDL-BEFAXECRSA-N 1 2 323.371 4.101 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)s1 ZINC000273280497 130102736 /nfs/dbraw/zinc/10/27/36/130102736.db2.gz IPOFXVUPARGOTM-VIFPVBQESA-N 1 2 321.833 4.351 20 0 DIADLO CCc1ccc(-c2noc([C@@H](C)[NH2+][C@H](C)c3ccccn3)n2)cc1 ZINC000273319579 130106508 /nfs/dbraw/zinc/10/65/08/130106508.db2.gz PIRZOBZFKADWLH-ZIAGYGMSSA-N 1 2 322.412 4.106 20 0 DIADLO CCc1ccc(-c2noc([C@@H](C)[NH2+][C@@H](C)c3ccccn3)n2)cc1 ZINC000273319573 130107095 /nfs/dbraw/zinc/10/70/95/130107095.db2.gz PIRZOBZFKADWLH-UONOGXRCSA-N 1 2 322.412 4.106 20 0 DIADLO Cc1nnc([C@@H](C)Nc2cc(C(C)C)[nH+]c(C(C)C)n2)s1 ZINC000273530057 130132609 /nfs/dbraw/zinc/13/26/09/130132609.db2.gz UMABGEUIFIVEPO-SNVBAGLBSA-N 1 2 305.451 4.056 20 0 DIADLO CCc1nnc(C[NH2+][C@H](CC)c2ccc(Cl)s2)s1 ZINC000273546465 130135337 /nfs/dbraw/zinc/13/53/37/130135337.db2.gz WQMUYNAHYXKVRP-MRVPVSSYSA-N 1 2 301.868 4.056 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(Oc3ccccc3)o2)s1 ZINC000273609402 130143134 /nfs/dbraw/zinc/14/31/34/130143134.db2.gz NZSDUPRJPUAYPN-LLVKDONJSA-N 1 2 315.398 4.083 20 0 DIADLO C[C@H](CC1CCCC1)c1nc(-c2ccc(-n3cc[nH+]c3)nc2)no1 ZINC000273731792 130159900 /nfs/dbraw/zinc/15/99/00/130159900.db2.gz NTEGELJJXTZXDS-CYBMUJFWSA-N 1 2 323.400 4.001 20 0 DIADLO Cc1ccc(Cc2noc(CC[C@H](C)c3ccccc3)n2)c[nH+]1 ZINC000273884061 130182689 /nfs/dbraw/zinc/18/26/89/130182689.db2.gz HGYXSMYKBVQLAU-AWEZNQCLSA-N 1 2 307.397 4.100 20 0 DIADLO C[C@@H]([NH2+]Cc1cn(C)nc1C(F)F)c1c(F)cccc1Cl ZINC000274470523 130237992 /nfs/dbraw/zinc/23/79/92/130237992.db2.gz JRQCLLJIQDJAIW-MRVPVSSYSA-N 1 2 317.742 4.001 20 0 DIADLO CCn1nc(C[NH2+][C@H](C)c2cccc(F)c2F)c2ccccc21 ZINC000274462445 130238489 /nfs/dbraw/zinc/23/84/89/130238489.db2.gz SZGDUWBJQRPKAM-GFCCVEGCSA-N 1 2 315.367 4.185 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2occc21)c1nc(C(F)(F)F)cs1 ZINC000274634454 130250104 /nfs/dbraw/zinc/25/01/04/130250104.db2.gz RYQIJQHUPDQBAK-WCBMZHEXSA-N 1 2 316.348 4.483 20 0 DIADLO Cc1csc(C2([NH2+][C@H](C)c3ccc(Cl)cn3)CCC2)n1 ZINC000274737777 130257477 /nfs/dbraw/zinc/25/74/77/130257477.db2.gz DRURSXGUWQKNEY-LLVKDONJSA-N 1 2 307.850 4.230 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)N(C(=O)Nc3cc[nH+]cc3C)C2)cc1 ZINC000278862273 130722943 /nfs/dbraw/zinc/72/29/43/130722943.db2.gz NDLBJTUPJKSYCL-WBVHZDCISA-N 1 2 309.413 4.108 20 0 DIADLO CC[C@@H](C)Sc1ccc(NC(=O)C=Cc2c[nH]c[nH+]2)c(C)c1 ZINC000282575567 130930434 /nfs/dbraw/zinc/93/04/34/130930434.db2.gz AUJLDSFXQCZIAZ-OQHXTRMZSA-N 1 2 315.442 4.261 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c(C)s1 ZINC000340183821 131014219 /nfs/dbraw/zinc/01/42/19/131014219.db2.gz GXOOIPCAXSRCNK-QGZVFWFLSA-N 1 2 323.408 4.217 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c(C)s1 ZINC000340183821 131014221 /nfs/dbraw/zinc/01/42/21/131014221.db2.gz GXOOIPCAXSRCNK-QGZVFWFLSA-N 1 2 323.408 4.217 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccccc2OC2CCCC2)no1 ZINC000284212081 131059709 /nfs/dbraw/zinc/05/97/09/131059709.db2.gz SSUDKFVZEQDARP-AWEZNQCLSA-N 1 2 300.402 4.155 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2cc(-c3ccccc3)on2)n1 ZINC000284896493 131120218 /nfs/dbraw/zinc/12/02/18/131120218.db2.gz GJDMWUIMWDMWBS-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO Cc1cc([C@H](C)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)no1 ZINC000285165690 131144399 /nfs/dbraw/zinc/14/43/99/131144399.db2.gz MRQVLCVYVJQOEP-AWEZNQCLSA-N 1 2 322.412 4.356 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccccc1)c1ccncc1)c1ccncc1F ZINC000340206566 131172540 /nfs/dbraw/zinc/17/25/40/131172540.db2.gz OSSHXDMSRLTKFV-IFXJQAMLSA-N 1 2 307.372 4.056 20 0 DIADLO C[C@H]([NH2+][C@H]1CCSc2ccc(F)cc21)c1c(F)cncc1F ZINC000285497266 131173886 /nfs/dbraw/zinc/17/38/86/131173886.db2.gz ACUJREYDPHBJIX-XPTSAGLGSA-N 1 2 324.371 4.387 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1csc(Cl)c1 ZINC000285509298 131175575 /nfs/dbraw/zinc/17/55/75/131175575.db2.gz BAAHVLHUZDYSBB-HTQZYQBOSA-N 1 2 302.777 4.487 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1csc(Cl)c1)c1c(F)cncc1F ZINC000285509303 131175792 /nfs/dbraw/zinc/17/57/92/131175792.db2.gz BAAHVLHUZDYSBB-JGVFFNPUSA-N 1 2 302.777 4.487 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1csc(Cl)c1 ZINC000285509307 131176007 /nfs/dbraw/zinc/17/60/07/131176007.db2.gz BAAHVLHUZDYSBB-SFYZADRCSA-N 1 2 302.777 4.487 20 0 DIADLO Fc1ccc(F)c(C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)c1 ZINC000285933589 131211461 /nfs/dbraw/zinc/21/14/61/131211461.db2.gz FJSWYRUHYNGSQY-INIZCTEOSA-N 1 2 305.372 4.099 20 0 DIADLO CC(C)CC[C@@H](NCc1cn2c([nH+]1)CCCC2)c1ccoc1 ZINC000286000124 131214722 /nfs/dbraw/zinc/21/47/22/131214722.db2.gz IOQHOQRKXNAAJM-QGZVFWFLSA-N 1 2 301.434 4.080 20 0 DIADLO Cc1ccccc1[C@@H](NC(=O)Nc1c(C)cc[nH+]c1C)C1CC1 ZINC000286977140 131258641 /nfs/dbraw/zinc/25/86/41/131258641.db2.gz BQIRJJLLJHWJCK-SFHVURJKSA-N 1 2 309.413 4.280 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CCC[C@H]1c1ccccc1 ZINC000286982460 131259093 /nfs/dbraw/zinc/25/90/93/131259093.db2.gz BYWSRCIGIZJXKW-IRXDYDNUSA-N 1 2 309.413 4.156 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1C[C@H](C)CC[C@@H]1c1ccccc1 ZINC000287214662 131268873 /nfs/dbraw/zinc/26/88/73/131268873.db2.gz UYSOTTKURFUFSE-RDTXWAMCSA-N 1 2 309.413 4.395 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(Cc1cccc(F)c1)C1CC1 ZINC000287392597 131278119 /nfs/dbraw/zinc/27/81/19/131278119.db2.gz CZONSPRKFVSCOE-UHFFFAOYSA-N 1 2 313.376 4.034 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC(Cc2ccccc2)CC1 ZINC000287390416 131278134 /nfs/dbraw/zinc/27/81/34/131278134.db2.gz CUYKSAOTLYYEIU-UHFFFAOYSA-N 1 2 323.440 4.185 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)N(C(=O)Nc3c(C)cc[nH+]c3C)C2)cc1 ZINC000287399017 131278880 /nfs/dbraw/zinc/27/88/80/131278880.db2.gz DKYSFZZBHIKIKT-MAUKXSAKSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)CCCCc1ccccc1 ZINC000287455740 131281359 /nfs/dbraw/zinc/28/13/59/131281359.db2.gz IIWLNZQJZYMZSB-UHFFFAOYSA-N 1 2 311.429 4.185 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCCCC[C@H]1c1ccncc1 ZINC000287460155 131281812 /nfs/dbraw/zinc/28/18/12/131281812.db2.gz ISXJLSOYIDXPLK-KRWDZBQOSA-N 1 2 324.428 4.243 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@@]1(C)Cc1ccccc1 ZINC000287478000 131282434 /nfs/dbraw/zinc/28/24/34/131282434.db2.gz JYRQUDPCRQTCMK-FQEVSTJZSA-N 1 2 323.440 4.328 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CCc2c1cccc2Cl ZINC000287468647 131282510 /nfs/dbraw/zinc/28/25/10/131282510.db2.gz JJPFLVICJNURQK-HNNXBMFYSA-N 1 2 315.804 4.161 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)Cc1c(F)cccc1Cl ZINC000287468615 131282677 /nfs/dbraw/zinc/28/26/77/131282677.db2.gz JICGENJNKVUYGB-UHFFFAOYSA-N 1 2 321.783 4.155 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N([C@@H](C)c1ccccc1)C1CC1 ZINC000287494940 131282985 /nfs/dbraw/zinc/28/29/85/131282985.db2.gz LDJIZRCFKLLLID-HNNXBMFYSA-N 1 2 309.413 4.456 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@@H]1c1ccc(F)cc1 ZINC000287519936 131285285 /nfs/dbraw/zinc/28/52/85/131285285.db2.gz MSODFJWKRNJSAJ-MRXNPFEDSA-N 1 2 313.376 4.207 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](C)c1ccc(Cl)cc1 ZINC000287536285 131286269 /nfs/dbraw/zinc/28/62/69/131286269.db2.gz NYIVVKHPQAROMR-LLVKDONJSA-N 1 2 303.793 4.235 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCCc2ccc(F)cc21 ZINC000287557829 131287517 /nfs/dbraw/zinc/28/75/17/131287517.db2.gz PGJAJISANODXSY-MRXNPFEDSA-N 1 2 313.376 4.037 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)Nc1ccccc1OCC1CC1 ZINC000287649797 131292519 /nfs/dbraw/zinc/29/25/19/131292519.db2.gz WEQYNWCUSIDSFJ-UHFFFAOYSA-N 1 2 311.385 4.131 20 0 DIADLO Clc1ccc(Cl)c(C[NH2+]Cc2noc3c2CCCC3)c1 ZINC000288428805 131325021 /nfs/dbraw/zinc/32/50/21/131325021.db2.gz KPVVVFUPTBYVNB-UHFFFAOYSA-N 1 2 311.212 4.150 20 0 DIADLO CCOC(=O)Nc1ccc(NCCCc2c[nH+]ccc2C)cc1 ZINC000289056128 131354573 /nfs/dbraw/zinc/35/45/73/131354573.db2.gz BQWABPOKJSLJPO-UHFFFAOYSA-N 1 2 313.401 4.003 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccncc1F ZINC000340306216 131363417 /nfs/dbraw/zinc/36/34/17/131363417.db2.gz PJQPZVXDPPWNNR-LIRRHRJNSA-N 1 2 307.372 4.056 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)no1 ZINC000289305304 131372472 /nfs/dbraw/zinc/37/24/72/131372472.db2.gz BYMJOJGQMVCEIF-ANGCBRKESA-N 1 2 305.809 4.079 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)no1 ZINC000289305312 131372666 /nfs/dbraw/zinc/37/26/66/131372666.db2.gz BYMJOJGQMVCEIF-NBLIUIFLSA-N 1 2 305.809 4.079 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1cccc(OC(F)F)c1 ZINC000289393228 131382326 /nfs/dbraw/zinc/38/23/26/131382326.db2.gz RFQVXIPCLSJBNO-LLVKDONJSA-N 1 2 324.371 4.424 20 0 DIADLO Cc1cnc(C[NH2+]C(C)(C)c2ccc(Br)c(C)c2)o1 ZINC000289825464 131421676 /nfs/dbraw/zinc/42/16/76/131421676.db2.gz JKLCFLFKXNHJAF-UHFFFAOYSA-N 1 2 323.234 4.079 20 0 DIADLO CCOCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(C(C)C)cc2)no1 ZINC000290231340 131466511 /nfs/dbraw/zinc/46/65/11/131466511.db2.gz RSMMOTSYEFSWBP-ZIAGYGMSSA-N 1 2 317.433 4.141 20 0 DIADLO CC[C@@H](CC(=O)N(C)[C@@H](c1[nH]cc[nH+]1)c1ccccc1)C(C)C ZINC000293851605 131775818 /nfs/dbraw/zinc/77/58/18/131775818.db2.gz FXSWEMUPVATYJF-MAUKXSAKSA-N 1 2 313.445 4.030 20 0 DIADLO Cn1c2ccc(NC(=O)Nc3cccc(F)c3)cc2[nH+]c1C1CC1 ZINC000340569891 132014230 /nfs/dbraw/zinc/01/42/30/132014230.db2.gz ZHRNHGQTLZMXPL-UHFFFAOYSA-N 1 2 324.359 4.234 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@H]1CCC[C@H]1c1ccccc1 ZINC000297611619 132025408 /nfs/dbraw/zinc/02/54/08/132025408.db2.gz KQIAQMYMXNNTEH-WMZOPIPTSA-N 1 2 309.413 4.190 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2)c2cccc(F)c2)c2nccn21 ZINC000297794763 132034674 /nfs/dbraw/zinc/03/46/74/132034674.db2.gz QBUWZRZDFNRDPX-NIKGAXFTSA-N 1 2 321.399 4.407 20 0 DIADLO Fc1ccccc1[C@@H](Cc1ccccc1)[NH2+][C@@H]1CCn2ccnc21 ZINC000297967973 132042891 /nfs/dbraw/zinc/04/28/91/132042891.db2.gz ZRBVNDFKUCIRSL-RTBURBONSA-N 1 2 321.399 4.041 20 0 DIADLO Fc1ccccc1[C@H](Cc1ccccc1)[NH2+][C@H]1CCn2ccnc21 ZINC000297967958 132042987 /nfs/dbraw/zinc/04/29/87/132042987.db2.gz ZRBVNDFKUCIRSL-OALUTQOASA-N 1 2 321.399 4.041 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000298198412 132050283 /nfs/dbraw/zinc/05/02/83/132050283.db2.gz VQZPTCHZRQABLX-HNNXBMFYSA-N 1 2 305.809 4.087 20 0 DIADLO c1csc(C[N@@H+](Cc2nccn2Cc2ccccc2)C2CC2)c1 ZINC000298276334 132053577 /nfs/dbraw/zinc/05/35/77/132053577.db2.gz ASUQGLBVALGNSE-UHFFFAOYSA-N 1 2 323.465 4.158 20 0 DIADLO c1csc(C[N@H+](Cc2nccn2Cc2ccccc2)C2CC2)c1 ZINC000298276334 132053579 /nfs/dbraw/zinc/05/35/79/132053579.db2.gz ASUQGLBVALGNSE-UHFFFAOYSA-N 1 2 323.465 4.158 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2c(Cl)cccc2Cl)C2CC2)ncn1 ZINC000298292573 132054574 /nfs/dbraw/zinc/05/45/74/132054574.db2.gz PBDNEIDFKKQHJQ-MRXNPFEDSA-N 1 2 322.239 4.333 20 0 DIADLO CC(C)CC[C@H]1CCC[C@H]1[NH2+]Cc1nc(=O)c2sccc2[nH]1 ZINC000298480975 132065023 /nfs/dbraw/zinc/06/50/23/132065023.db2.gz JEIOWHIYUUAAHO-CHWSQXEVSA-N 1 2 319.474 4.091 20 0 DIADLO FC(c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1)=C1CCCC1 ZINC000340614736 132086950 /nfs/dbraw/zinc/08/69/50/132086950.db2.gz PJTFTUDSBJSIIG-UHFFFAOYSA-N 1 2 310.332 4.177 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](Cc1nc(C2CC2)no1)C1CC1 ZINC000299118735 132089933 /nfs/dbraw/zinc/08/99/33/132089933.db2.gz FEAGXVYKCPOPDI-NSHDSACASA-N 1 2 317.820 4.326 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](Cc1nc(C2CC2)no1)C1CC1 ZINC000299118735 132089935 /nfs/dbraw/zinc/08/99/35/132089935.db2.gz FEAGXVYKCPOPDI-NSHDSACASA-N 1 2 317.820 4.326 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2nc3c(s2)CCCC3)c(C)s1 ZINC000353607499 132097138 /nfs/dbraw/zinc/09/71/38/132097138.db2.gz AAFHCOCGUJCBKO-UHFFFAOYSA-N 1 2 306.500 4.332 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2nc3c(s2)CCCC3)c(C)s1 ZINC000353607499 132097139 /nfs/dbraw/zinc/09/71/39/132097139.db2.gz AAFHCOCGUJCBKO-UHFFFAOYSA-N 1 2 306.500 4.332 20 0 DIADLO CC[C@@H](c1ccccc1)[N@H+](CC)Cc1csc(NC(C)=O)n1 ZINC000299382439 132102678 /nfs/dbraw/zinc/10/26/78/132102678.db2.gz JSIKCBZNUIMHBS-INIZCTEOSA-N 1 2 317.458 4.075 20 0 DIADLO CC[C@@H](c1ccccc1)[N@@H+](CC)Cc1csc(NC(C)=O)n1 ZINC000299382439 132102680 /nfs/dbraw/zinc/10/26/80/132102680.db2.gz JSIKCBZNUIMHBS-INIZCTEOSA-N 1 2 317.458 4.075 20 0 DIADLO CCn1ccnc1C[NH2+][C@@H](c1ccccc1)c1ccc(C)cc1 ZINC000299585680 132111833 /nfs/dbraw/zinc/11/18/33/132111833.db2.gz JMEORQXUMPYCET-FQEVSTJZSA-N 1 2 305.425 4.091 20 0 DIADLO c1ccc(-c2cccc(CNc3cc[nH+]c(C4CC4)n3)c2)nc1 ZINC000164219018 132132758 /nfs/dbraw/zinc/13/27/58/132132758.db2.gz VCBSSEPVWYAEKG-UHFFFAOYSA-N 1 2 302.381 4.028 20 0 DIADLO CCSc1ccccc1[C@H](C)[NH2+]Cc1csc(COC)n1 ZINC000353632123 132141588 /nfs/dbraw/zinc/14/15/88/132141588.db2.gz RQAOYCXBGCCKKA-LBPRGKRZSA-N 1 2 322.499 4.252 20 0 DIADLO CC(=O)Nc1cccc(CNc2cc(C)[nH+]c3c(F)cccc23)c1 ZINC000121334838 132153743 /nfs/dbraw/zinc/15/37/43/132153743.db2.gz VNWOBRPGQLYUBY-UHFFFAOYSA-N 1 2 323.371 4.253 20 0 DIADLO CC[N@H+](Cc1ncc(C)cn1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000340688377 132154410 /nfs/dbraw/zinc/15/44/10/132154410.db2.gz UWKGRBWTOZJHJN-CYBMUJFWSA-N 1 2 323.362 4.387 20 0 DIADLO CC[N@@H+](Cc1ncc(C)cn1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000340688377 132154412 /nfs/dbraw/zinc/15/44/12/132154412.db2.gz UWKGRBWTOZJHJN-CYBMUJFWSA-N 1 2 323.362 4.387 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2n1C)c1ccc(F)cc1F ZINC000121494490 132156087 /nfs/dbraw/zinc/15/60/87/132156087.db2.gz QXGLIHKIQNAFHZ-NEPJUHHUSA-N 1 2 315.367 4.263 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1nc2ccccc2n1C ZINC000121494637 132156288 /nfs/dbraw/zinc/15/62/88/132156288.db2.gz QXGLIHKIQNAFHZ-NWDGAFQWSA-N 1 2 315.367 4.263 20 0 DIADLO Cc1cnc(C[N@@H+]2Cc3ccccc3C[C@H]2c2ccccc2)nc1 ZINC000340692631 132156609 /nfs/dbraw/zinc/15/66/09/132156609.db2.gz MLIQYXMTOKFWFZ-FQEVSTJZSA-N 1 2 315.420 4.085 20 0 DIADLO Cc1cnc(C[N@H+]2Cc3ccccc3C[C@H]2c2ccccc2)nc1 ZINC000340692631 132156610 /nfs/dbraw/zinc/15/66/10/132156610.db2.gz MLIQYXMTOKFWFZ-FQEVSTJZSA-N 1 2 315.420 4.085 20 0 DIADLO Cc1ccc(NCc2c(F)cccc2OC(F)(F)F)c[nH+]1 ZINC000340690603 132157531 /nfs/dbraw/zinc/15/75/31/132157531.db2.gz WWZOBOXVAPRELL-UHFFFAOYSA-N 1 2 300.255 4.040 20 0 DIADLO Cc1ccc(CSCc2nc(C3CCCC3)no2)c(C)[nH+]1 ZINC000184831716 335090137 /nfs/dbraw/zinc/09/01/37/335090137.db2.gz OQIPNDOJUAZVFT-UHFFFAOYSA-N 1 2 303.431 4.172 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCCc1c[nH]c2ncccc12 ZINC000533560819 435245832 /nfs/dbraw/zinc/24/58/32/435245832.db2.gz FRIYATUURKJYBJ-UHFFFAOYSA-N 1 2 302.381 4.074 20 0 DIADLO FC(F)(F)Cc1ccccc1CNc1cc[nH+]c(C2CC2)n1 ZINC000624752113 435385701 /nfs/dbraw/zinc/38/57/01/435385701.db2.gz FIQPCCXGYGKSHN-UHFFFAOYSA-N 1 2 307.319 4.071 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(OC(C)(C)C)cc2)c(C)[nH+]1 ZINC000175557884 332895479 /nfs/dbraw/zinc/89/54/79/332895479.db2.gz PICGOSCRYBNLMM-UHFFFAOYSA-N 1 2 312.413 4.436 20 0 DIADLO CCc1nc(C[NH2+][C@H](c2ccc(CC(C)C)cc2)C(C)C)no1 ZINC000533472032 331538804 /nfs/dbraw/zinc/53/88/04/331538804.db2.gz ZSSKRRWTTAWDOF-IBGZPJMESA-N 1 2 315.461 4.317 20 0 DIADLO C[C@H](C(=O)Nc1c(F)cccc1F)[NH+]1CCC(C(C)(C)C)CC1 ZINC000530519794 331553954 /nfs/dbraw/zinc/55/39/54/331553954.db2.gz HLCJXLDXWNAZAY-GFCCVEGCSA-N 1 2 324.415 4.050 20 0 DIADLO COc1ccc(F)cc1[C@H](C)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000530695122 331619655 /nfs/dbraw/zinc/61/96/55/331619655.db2.gz YOTPJIAYHCWZTO-VIFPVBQESA-N 1 2 314.282 4.421 20 0 DIADLO Cc1ccc(/C=C/CC(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)cc1 ZINC000530762964 331624446 /nfs/dbraw/zinc/62/44/46/331624446.db2.gz LANXBMDCQHCTFF-NSCUHMNNSA-N 1 2 317.392 4.427 20 0 DIADLO CCCC[C@H](CCC)NC(=O)c1ccc(Cn2cc[nH+]c2)cc1 ZINC000530898247 331633879 /nfs/dbraw/zinc/63/38/79/331633879.db2.gz XIEXKUMSMVPSGP-SFHVURJKSA-N 1 2 313.445 4.020 20 0 DIADLO Fc1ccc(C[C@H]2CCCCN2c2cc[nH+]c(C3CC3)n2)cc1 ZINC000530915507 331635462 /nfs/dbraw/zinc/63/54/62/331635462.db2.gz NHGDUFKDNJFZGW-QGZVFWFLSA-N 1 2 311.404 4.095 20 0 DIADLO COc1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)c(F)c1 ZINC000565485005 331700003 /nfs/dbraw/zinc/70/00/03/331700003.db2.gz MGIZDEJPTQOTSD-NSHDSACASA-N 1 2 322.449 4.439 20 0 DIADLO CCCCc1noc([C@H](C)[NH+]2CCC(CC(F)(F)F)CC2)n1 ZINC000556505039 331709118 /nfs/dbraw/zinc/70/91/18/331709118.db2.gz CNXHFOAKEBQTRH-NSHDSACASA-N 1 2 319.371 4.138 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)cc1O ZINC000564429198 331761299 /nfs/dbraw/zinc/76/12/99/331761299.db2.gz NPQVIIBCJKCYFK-VLIAUNLRSA-N 1 2 323.392 4.434 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2C[C@@H]2c2c(F)cccc2Cl)c(C)[nH+]1 ZINC000176185313 332926956 /nfs/dbraw/zinc/92/69/56/332926956.db2.gz LAAMWDWDPFZRCI-NWDGAFQWSA-N 1 2 318.779 4.233 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc2c(s1)C[C@H](C)CC2)c1nccs1 ZINC000152763387 331801497 /nfs/dbraw/zinc/80/14/97/331801497.db2.gz KMVHUGUKOCTXIF-BDJLRTHQSA-N 1 2 321.515 4.139 20 0 DIADLO Cc1sc(C[NH2+]Cc2ccnn2C2CCCC2)nc1C(C)C ZINC000449121069 331809088 /nfs/dbraw/zinc/80/90/88/331809088.db2.gz GQBAQYSCGQKCHT-UHFFFAOYSA-N 1 2 318.490 4.176 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc([C@@H]2CC23CCCC3)n1 ZINC000584152009 331844485 /nfs/dbraw/zinc/84/44/85/331844485.db2.gz WIJOPBQVGIHKOY-AWEZNQCLSA-N 1 2 322.412 4.018 20 0 DIADLO C[C@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000558505603 331914127 /nfs/dbraw/zinc/91/41/27/331914127.db2.gz LCJOMIHEYGGWJO-KBPBESRZSA-N 1 2 314.433 4.013 20 0 DIADLO CCN(C)c1ccc(CNc2cccc(CSC)c2)c[nH+]1 ZINC000558756931 331941533 /nfs/dbraw/zinc/94/15/33/331941533.db2.gz NGAFEYXXWMRFTR-UHFFFAOYSA-N 1 2 301.459 4.013 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NCc2ccnc3ccccc23)c1 ZINC000559146750 331982105 /nfs/dbraw/zinc/98/21/05/331982105.db2.gz LGRLNVRWEHAWTI-UHFFFAOYSA-N 1 2 303.287 4.261 20 0 DIADLO CC[C@H](C)Oc1cccc(NCc2c[nH+]c3cccc(C)n23)c1 ZINC000518223355 331997549 /nfs/dbraw/zinc/99/75/49/331997549.db2.gz FMOSLDBTNIDWHP-HNNXBMFYSA-N 1 2 309.413 4.432 20 0 DIADLO Cc1cnccc1C[N@@H+](C)[C@H](C)c1ccccc1Br ZINC000518306751 332011048 /nfs/dbraw/zinc/01/10/48/332011048.db2.gz ADWPYFZYJDQVFC-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cnccc1C[N@H+](C)[C@H](C)c1ccccc1Br ZINC000518306751 332011050 /nfs/dbraw/zinc/01/10/50/332011050.db2.gz ADWPYFZYJDQVFC-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO CC(C)c1nc(N2CCC[C@@H]2Cc2ccccc2Cl)cc[nH+]1 ZINC000518369181 332018637 /nfs/dbraw/zinc/01/86/37/332018637.db2.gz FVWSFZBLOIVOFO-OAHLLOKOSA-N 1 2 315.848 4.465 20 0 DIADLO CC(C)(CC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C1CC1 ZINC000559339563 332029936 /nfs/dbraw/zinc/02/99/36/332029936.db2.gz PBANJKXRGNTMST-UHFFFAOYSA-N 1 2 317.820 4.291 20 0 DIADLO COc1c(C)cnc(C[N@H+](C)Cc2ccc(Cl)s2)c1C ZINC000409446173 332030175 /nfs/dbraw/zinc/03/01/75/332030175.db2.gz BKGQGQNPCHSEGC-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COc1c(C)cnc(C[N@@H+](C)Cc2ccc(Cl)s2)c1C ZINC000409446173 332030176 /nfs/dbraw/zinc/03/01/76/332030176.db2.gz BKGQGQNPCHSEGC-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1sccc1C1CC1 ZINC000520043763 332030213 /nfs/dbraw/zinc/03/02/13/332030213.db2.gz IMIWDBGUMJICBS-UHFFFAOYSA-N 1 2 309.394 4.268 20 0 DIADLO COc1ccsc1C[N@@H+]1CCCn2c(cc3ccccc32)C1 ZINC000518441617 332041019 /nfs/dbraw/zinc/04/10/19/332041019.db2.gz MGZRQZDNTFJDDB-UHFFFAOYSA-N 1 2 312.438 4.117 20 0 DIADLO COc1ccsc1C[N@H+]1CCCn2c(cc3ccccc32)C1 ZINC000518441617 332041021 /nfs/dbraw/zinc/04/10/21/332041021.db2.gz MGZRQZDNTFJDDB-UHFFFAOYSA-N 1 2 312.438 4.117 20 0 DIADLO Cc1cc(F)cc2c1CN(c1cc(C(F)(F)F)cc[nH+]1)CC2 ZINC000409657877 332044173 /nfs/dbraw/zinc/04/41/73/332044173.db2.gz QCGDHCBWUDHBLZ-UHFFFAOYSA-N 1 2 310.294 4.111 20 0 DIADLO Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2F)c(C)[nH+]1 ZINC000176449872 332941433 /nfs/dbraw/zinc/94/14/33/332941433.db2.gz IUVASQUKAVQQSW-UHFFFAOYSA-N 1 2 312.266 4.109 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1ccn(C(C)C)n1 ZINC000569396373 332075351 /nfs/dbraw/zinc/07/53/51/332075351.db2.gz RDZLTHSGDDUFRS-QGZVFWFLSA-N 1 2 301.434 4.056 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1ccn(C(C)C)n1 ZINC000569396373 332075352 /nfs/dbraw/zinc/07/53/52/332075352.db2.gz RDZLTHSGDDUFRS-QGZVFWFLSA-N 1 2 301.434 4.056 20 0 DIADLO CCCc1ccc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000518612244 332094603 /nfs/dbraw/zinc/09/46/03/332094603.db2.gz MEFXSRWWVOBWQC-UHFFFAOYSA-N 1 2 305.381 4.077 20 0 DIADLO c1cc([C@@H]2CCC[N@H+]2Cc2nc(C3CCCC3)no2)cs1 ZINC000132179164 332107013 /nfs/dbraw/zinc/10/70/13/332107013.db2.gz YQESYSPABAYENP-AWEZNQCLSA-N 1 2 303.431 4.126 20 0 DIADLO c1cc([C@@H]2CCC[N@@H+]2Cc2nc(C3CCCC3)no2)cs1 ZINC000132179164 332107015 /nfs/dbraw/zinc/10/70/15/332107015.db2.gz YQESYSPABAYENP-AWEZNQCLSA-N 1 2 303.431 4.126 20 0 DIADLO CC(C)n1nccc1C[N@H+](C)Cc1cccc(Cl)c1Cl ZINC000410301697 332108759 /nfs/dbraw/zinc/10/87/59/332108759.db2.gz VBAKTZXOBIRRLC-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1nccc1C[N@@H+](C)Cc1cccc(Cl)c1Cl ZINC000410301697 332108761 /nfs/dbraw/zinc/10/87/61/332108761.db2.gz VBAKTZXOBIRRLC-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(C)n1)c1ccc(Cl)c(Cl)c1Cl ZINC000213135478 332111365 /nfs/dbraw/zinc/11/13/65/332111365.db2.gz BQYGUXKHPKFBRJ-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO CCc1cnc(C[N@@H+]2CCc3ccccc3[C@@H]2c2ccccc2)o1 ZINC000559368803 332134472 /nfs/dbraw/zinc/13/44/72/332134472.db2.gz UEOZCGYKJOXKJJ-NRFANRHFSA-N 1 2 318.420 4.385 20 0 DIADLO CCc1cnc(C[N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)o1 ZINC000559368803 332134474 /nfs/dbraw/zinc/13/44/74/332134474.db2.gz UEOZCGYKJOXKJJ-NRFANRHFSA-N 1 2 318.420 4.385 20 0 DIADLO Fc1ccc(C[N@@H+]2CCO[C@H](c3cccs3)C2)cc1Cl ZINC000092593774 332135155 /nfs/dbraw/zinc/13/51/55/332135155.db2.gz GMSXHLPNGCXVAK-AWEZNQCLSA-N 1 2 311.809 4.114 20 0 DIADLO Fc1ccc(C[N@H+]2CCO[C@H](c3cccs3)C2)cc1Cl ZINC000092593774 332135156 /nfs/dbraw/zinc/13/51/56/332135156.db2.gz GMSXHLPNGCXVAK-AWEZNQCLSA-N 1 2 311.809 4.114 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2cnc3ccc(C)cc3c2)cs1 ZINC000569553183 332136129 /nfs/dbraw/zinc/13/61/29/332136129.db2.gz JDGRPKVIMZHUBO-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2cnc3ccc(C)cc3c2)cs1 ZINC000569553183 332136131 /nfs/dbraw/zinc/13/61/31/332136131.db2.gz JDGRPKVIMZHUBO-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO CC[C@@H](C)Sc1ccc(NC(=O)Cc2[nH]c[nH+]c2C)c(C)c1 ZINC000569577993 332143054 /nfs/dbraw/zinc/14/30/54/332143054.db2.gz GLHOBMJSCMVRRR-GFCCVEGCSA-N 1 2 317.458 4.098 20 0 DIADLO Cn1cc[nH+]c1[C@H]1N(Cc2cccc(Cl)c2Cl)CC1(C)C ZINC000449416922 332159376 /nfs/dbraw/zinc/15/93/76/332159376.db2.gz WJRHYKPNPDYAPY-CQSZACIVSA-N 1 2 324.255 4.310 20 0 DIADLO CCC[C@H](CC1CCCCC1)C(=O)N(C)CCCn1cc[nH+]c1 ZINC000427105908 332167931 /nfs/dbraw/zinc/16/79/31/332167931.db2.gz BDZPTXXCNQWTIZ-GOSISDBHSA-N 1 2 319.493 4.118 20 0 DIADLO CCOc1cc(C)ccc1[NH2+][C@H]1CCC[C@@H](c2ccnn2C)C1 ZINC000448020624 332178842 /nfs/dbraw/zinc/17/88/42/332178842.db2.gz CZXLDUKAQIZLLK-CVEARBPZSA-N 1 2 313.445 4.266 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H](C)c2cccc(C)c2)[nH+]1 ZINC000427189700 332182674 /nfs/dbraw/zinc/18/26/74/332182674.db2.gz PHKFMRQMRVZLKP-OAHLLOKOSA-N 1 2 319.408 4.436 20 0 DIADLO COc1ccccc1SCc1ccc(-n2cc[nH+]c2)cc1C ZINC000427251170 332188414 /nfs/dbraw/zinc/18/84/14/332188414.db2.gz BITCFSXGPLQOHP-UHFFFAOYSA-N 1 2 310.422 4.482 20 0 DIADLO Cc1cnc(C[N@@H+](C)[C@@H](c2ccccc2Cl)C(C)C)nc1 ZINC000536367160 332233297 /nfs/dbraw/zinc/23/32/97/332233297.db2.gz QBMSBBLLTTURRH-QGZVFWFLSA-N 1 2 303.837 4.268 20 0 DIADLO Cc1cnc(C[N@H+](C)[C@@H](c2ccccc2Cl)C(C)C)nc1 ZINC000536367160 332233298 /nfs/dbraw/zinc/23/32/98/332233298.db2.gz QBMSBBLLTTURRH-QGZVFWFLSA-N 1 2 303.837 4.268 20 0 DIADLO CCOc1cccc(C[NH2+]Cc2cc(Cl)sc2Cl)n1 ZINC000536388256 332237127 /nfs/dbraw/zinc/23/71/27/332237127.db2.gz IHDGEPIRKKYEDK-UHFFFAOYSA-N 1 2 317.241 4.138 20 0 DIADLO CCSCc1cc[nH+]c(NCC2=Cc3ccccc3OC2)c1 ZINC000536414999 332240872 /nfs/dbraw/zinc/24/08/72/332240872.db2.gz UZHVPBIGMHJSSI-UHFFFAOYSA-N 1 2 312.438 4.223 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)N1CC2(C1)CCCC2 ZINC000363771859 332245139 /nfs/dbraw/zinc/24/51/39/332245139.db2.gz XBPKPZOCQJMIGG-UHFFFAOYSA-N 1 2 323.396 4.282 20 0 DIADLO C[C@@H]([NH2+]Cc1cccs1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000371053250 332263337 /nfs/dbraw/zinc/26/33/37/332263337.db2.gz KIRCUUCGICDFHP-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO C[C@H]([NH2+]Cc1cccs1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000371053243 332263378 /nfs/dbraw/zinc/26/33/78/332263378.db2.gz KIRCUUCGICDFHP-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO C[C@H](Nc1cccc([NH+]2CCCCCC2)c1)[C@]1(C)CCCO1 ZINC000559835884 332284300 /nfs/dbraw/zinc/28/43/00/332284300.db2.gz NZHLCURRQKYGKK-LPHOPBHVSA-N 1 2 302.462 4.437 20 0 DIADLO C[C@@H](Nc1cccc([NH+]2CCCCCC2)c1)[C@]1(C)CCCO1 ZINC000559835874 332284324 /nfs/dbraw/zinc/28/43/24/332284324.db2.gz NZHLCURRQKYGKK-APWZRJJASA-N 1 2 302.462 4.437 20 0 DIADLO CCCc1csc(C[N@H+](C)Cc2ccc(OCC)cc2)n1 ZINC000426064799 335099107 /nfs/dbraw/zinc/09/91/07/335099107.db2.gz WESCYFXQEUHODB-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO CCCc1csc(C[N@@H+](C)Cc2ccc(OCC)cc2)n1 ZINC000426064799 335099109 /nfs/dbraw/zinc/09/91/09/335099109.db2.gz WESCYFXQEUHODB-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO CSC[C@H]([NH2+]CC(C)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000559890834 332289959 /nfs/dbraw/zinc/28/99/59/332289959.db2.gz ISFLQCIKFKNAOH-NSHDSACASA-N 1 2 313.335 4.354 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@H](C)c2cn3ccccc3n2)on1 ZINC000559904093 332292063 /nfs/dbraw/zinc/29/20/63/332292063.db2.gz SRVWFARSCWQAID-CYBMUJFWSA-N 1 2 312.417 4.077 20 0 DIADLO Cc1ccc(Cc2noc(/C(F)=C/C3CCCCC3)n2)c[nH+]1 ZINC000559944088 332295429 /nfs/dbraw/zinc/29/54/29/332295429.db2.gz FHBGUPZJWVSIAH-DHDCSXOGSA-N 1 2 301.365 4.255 20 0 DIADLO C(=C/c1ccc(-n2cc[nH+]c2)cc1)\c1nc(CC2CCCC2)no1 ZINC000560034630 332304042 /nfs/dbraw/zinc/30/40/42/332304042.db2.gz MAYOFRIKLPWFPL-JXMROGBWSA-N 1 2 320.396 4.158 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cccc(OCC(C)C)c3)cn2c1 ZINC000560061044 332307663 /nfs/dbraw/zinc/30/76/63/332307663.db2.gz SVUWUVLWUJJCNS-UHFFFAOYSA-N 1 2 309.413 4.290 20 0 DIADLO CCOc1cc(NCc2ccc(N3CCCC3)[nH+]c2)ccc1C ZINC000560090795 332310264 /nfs/dbraw/zinc/31/02/64/332310264.db2.gz AYMVNURJVVWLGX-UHFFFAOYSA-N 1 2 311.429 4.001 20 0 DIADLO CC(C)C[N@H+](Cc1ccn(C)n1)[C@H](C)c1ccccc1Cl ZINC000560184592 332316985 /nfs/dbraw/zinc/31/69/85/332316985.db2.gz OMWMDRVZUJTAAI-CQSZACIVSA-N 1 2 305.853 4.293 20 0 DIADLO CC(C)C[N@@H+](Cc1ccn(C)n1)[C@H](C)c1ccccc1Cl ZINC000560184592 332316987 /nfs/dbraw/zinc/31/69/87/332316987.db2.gz OMWMDRVZUJTAAI-CQSZACIVSA-N 1 2 305.853 4.293 20 0 DIADLO C[C@H](C[N@@H+]1CCc2ccc(Br)cc2C1)C(F)(F)F ZINC000560199034 332318929 /nfs/dbraw/zinc/31/89/29/332318929.db2.gz LDULMNFIGXELRA-SECBINFHSA-N 1 2 322.168 4.006 20 0 DIADLO C[C@H](C[N@H+]1CCc2ccc(Br)cc2C1)C(F)(F)F ZINC000560199034 332318931 /nfs/dbraw/zinc/31/89/31/332318931.db2.gz LDULMNFIGXELRA-SECBINFHSA-N 1 2 322.168 4.006 20 0 DIADLO Fc1cc(F)c(C[NH+]2CCC(CC(F)(F)F)CC2)cc1F ZINC000560277737 332327203 /nfs/dbraw/zinc/32/72/03/332327203.db2.gz WDCXUEABXVTTHW-UHFFFAOYSA-N 1 2 311.269 4.268 20 0 DIADLO C[C@H](CC(=O)Nc1cccc(Nc2ccccc2)c1)n1cc[nH+]c1 ZINC000560338941 332331973 /nfs/dbraw/zinc/33/19/73/332331973.db2.gz XWRJPTCODQBRTI-OAHLLOKOSA-N 1 2 320.396 4.217 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2cccc(C)c2C)n1 ZINC000115602858 332333914 /nfs/dbraw/zinc/33/39/14/332333914.db2.gz VVPUOIHIALJYTJ-HUUCEWRRSA-N 1 2 301.434 4.441 20 0 DIADLO Cc1ccc[nH+]c1CCc1noc([C@H]2C[C@H]2C2CCCCC2)n1 ZINC000560354403 332334046 /nfs/dbraw/zinc/33/40/46/332334046.db2.gz RMCXAENOPJIETN-HOTGVXAUSA-N 1 2 311.429 4.242 20 0 DIADLO CCCC(CCC)C(=O)N[C@H]1CC[C@H](Nc2cccc[nH+]2)CC1 ZINC000560517159 332349153 /nfs/dbraw/zinc/34/91/53/332349153.db2.gz YRYMZIKRYPKWQY-QAQDUYKDSA-N 1 2 317.477 4.137 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1)c1nc(C(C)(C)C)no1 ZINC000237495990 332366947 /nfs/dbraw/zinc/36/69/47/332366947.db2.gz YRLLKGORYPTMLJ-SECBINFHSA-N 1 2 311.788 4.010 20 0 DIADLO Cc1cc[nH+]cc1CCCN1C[C@H]2CCCCN2c2ccccc21 ZINC000560619474 332369556 /nfs/dbraw/zinc/36/95/56/332369556.db2.gz VGNOWOHQNHXSPC-LJQANCHMSA-N 1 2 321.468 4.202 20 0 DIADLO Cc1cc[nH+]cc1CCCN1C[C@@H]2CCCCN2c2ccccc21 ZINC000560619473 332369583 /nfs/dbraw/zinc/36/95/83/332369583.db2.gz VGNOWOHQNHXSPC-IBGZPJMESA-N 1 2 321.468 4.202 20 0 DIADLO Clc1oc2ccccc2c1C[N@@H+]1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000560630347 332370857 /nfs/dbraw/zinc/37/08/57/332370857.db2.gz YQIWMHNRGVDEIC-SJLPKXTDSA-N 1 2 317.816 4.230 20 0 DIADLO Clc1oc2ccccc2c1C[N@H+]1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000560630347 332370858 /nfs/dbraw/zinc/37/08/58/332370858.db2.gz YQIWMHNRGVDEIC-SJLPKXTDSA-N 1 2 317.816 4.230 20 0 DIADLO Cc1ccc2[nH]cc(CCC(=O)Nc3c(C)cc[nH+]c3C)c2c1 ZINC000425586405 335107239 /nfs/dbraw/zinc/10/72/39/335107239.db2.gz KRWHUPPIBNPPHE-UHFFFAOYSA-N 1 2 307.397 4.059 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2nc3c(s2)C[C@H](C)CC3)n1 ZINC000152707701 332376156 /nfs/dbraw/zinc/37/61/56/332376156.db2.gz ANXIHAXQTQLGAK-SNVBAGLBSA-N 1 2 321.515 4.058 20 0 DIADLO COc1ccc(Cl)c(NCc2c[nH+]c3ccc(Cl)cn23)c1 ZINC000560711358 332379995 /nfs/dbraw/zinc/37/99/95/332379995.db2.gz QIWSBKHCMYOKPW-UHFFFAOYSA-N 1 2 322.195 4.262 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(-c3cccs3)s2)CC2(CCC2)O1 ZINC000564990710 332385526 /nfs/dbraw/zinc/38/55/26/332385526.db2.gz MUNQGFLWJRHXMN-GFCCVEGCSA-N 1 2 320.483 4.015 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(-c3cccs3)s2)CC2(CCC2)O1 ZINC000564990710 332385527 /nfs/dbraw/zinc/38/55/27/332385527.db2.gz MUNQGFLWJRHXMN-GFCCVEGCSA-N 1 2 320.483 4.015 20 0 DIADLO C/C=C\c1ccc(NC(=O)CCn2c(C)[nH+]c3ccccc32)cc1 ZINC000583402204 332388585 /nfs/dbraw/zinc/38/85/85/332388585.db2.gz UFYBLIBCSIJXFX-UTCJRWHESA-N 1 2 319.408 4.407 20 0 DIADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)[C@]12C[C@H]1CCC2 ZINC000425570736 335104535 /nfs/dbraw/zinc/10/45/35/335104535.db2.gz MFSJJZWMUHDEPI-JLTOFOAXSA-N 1 2 321.424 4.015 20 0 DIADLO C[C@@H]1CC[C@@H](C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)C1 ZINC000425571300 335104553 /nfs/dbraw/zinc/10/45/53/335104553.db2.gz MYUIGGYHNQQGNC-HUUCEWRRSA-N 1 2 323.440 4.261 20 0 DIADLO Cc1cc[nH+]c(NCc2cccc(OCC(F)F)c2)c1Cl ZINC000561182852 332420703 /nfs/dbraw/zinc/42/07/03/332420703.db2.gz APAHFXZEBKCQAY-UHFFFAOYSA-N 1 2 312.747 4.299 20 0 DIADLO Cc1cc(NCc2cn3ccccc3[nH+]2)ccc1-c1ccncc1 ZINC000427436647 332426664 /nfs/dbraw/zinc/42/66/64/332426664.db2.gz UMUVUXYCOLQTTQ-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO COc1cc(C)[nH+]c(CNc2cc(Cl)ccc2OC(C)C)c1 ZINC000562211045 332559406 /nfs/dbraw/zinc/55/94/06/332559406.db2.gz DUXLEEAOBUDUAY-UHFFFAOYSA-N 1 2 320.820 4.451 20 0 DIADLO CC[C@H]([NH2+]Cc1ccn(C(C)C)n1)c1cccc(Cl)c1F ZINC000562266224 332566109 /nfs/dbraw/zinc/56/61/09/332566109.db2.gz MBWMOVQTMJNKNR-HNNXBMFYSA-N 1 2 309.816 4.497 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@@H]2CCCc3ccccc32)c(C)[nH+]1 ZINC000170988440 332639766 /nfs/dbraw/zinc/63/97/66/332639766.db2.gz YIQPMTFBEGSTHO-KRWDZBQOSA-N 1 2 308.425 4.456 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NC(=O)[C@H]2CCCCC2(C)C)c1 ZINC000569671917 332657370 /nfs/dbraw/zinc/65/73/70/332657370.db2.gz SMAIOHTVPHRKPO-MRXNPFEDSA-N 1 2 311.429 4.242 20 0 DIADLO C[C@H]([NH2+]Cc1ccc2c(n1)CCC2)c1nc(C(C)(C)C)cs1 ZINC000572961809 332658406 /nfs/dbraw/zinc/65/84/06/332658406.db2.gz HKYPLCFVNCYYIP-LBPRGKRZSA-N 1 2 315.486 4.175 20 0 DIADLO Cc1ccc(OC(F)F)c([C@H](C)[NH2+][C@@H](C)c2cscn2)c1 ZINC000565247619 332715067 /nfs/dbraw/zinc/71/50/67/332715067.db2.gz UVWHQNYRQFBRHV-QWRGUYRKSA-N 1 2 312.385 4.465 20 0 DIADLO CCCC(CCC)[S@](=O)Cc1cn2cc(Cl)ccc2[nH+]1 ZINC000176640217 332951147 /nfs/dbraw/zinc/95/11/47/332951147.db2.gz VMNKGAJISGOKIP-HXUWFJFHSA-N 1 2 312.866 4.205 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@@H]2CCc2ccccc2)c(C)[nH+]1 ZINC000176731719 332954033 /nfs/dbraw/zinc/95/40/33/332954033.db2.gz FLWXZCNJRUKSHQ-GOSISDBHSA-N 1 2 323.440 4.328 20 0 DIADLO Cc1ccc(NC(=O)N[C@H](C)c2cccc(Cl)c2)c(C)[nH+]1 ZINC000176767356 332955997 /nfs/dbraw/zinc/95/59/97/332955997.db2.gz MQLRCZDRKSPKND-LLVKDONJSA-N 1 2 303.793 4.235 20 0 DIADLO CCOc1cc(CNc2c[nH+]ccc2C)ccc1OC(F)F ZINC000103856256 332974313 /nfs/dbraw/zinc/97/43/13/332974313.db2.gz NDTZUAJBGQEQSK-UHFFFAOYSA-N 1 2 308.328 4.002 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccc2c(n1)CCC2 ZINC000580285356 333060260 /nfs/dbraw/zinc/06/02/60/333060260.db2.gz BYHBKTZTVIXVLM-CYBMUJFWSA-N 1 2 323.465 4.373 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccc2c(n1)CCC2 ZINC000580285356 333060261 /nfs/dbraw/zinc/06/02/61/333060261.db2.gz BYHBKTZTVIXVLM-CYBMUJFWSA-N 1 2 323.465 4.373 20 0 DIADLO CC[C@@H](C)[C@@H]1CCCCN1c1cc(C)[nH+]c(-c2ccncc2)n1 ZINC000462695671 333082476 /nfs/dbraw/zinc/08/24/76/333082476.db2.gz IFXAVPXDJKAJSU-PBHICJAKSA-N 1 2 310.445 4.252 20 0 DIADLO CCCCCC(=O)N1CC[NH+]([C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000460517098 333100269 /nfs/dbraw/zinc/10/02/69/333100269.db2.gz FMVIRIXNEIOVJA-HNNXBMFYSA-N 1 2 322.880 4.126 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc([C@@H]2CCC[C@@H](C)C2)n1 ZINC000460747847 333133571 /nfs/dbraw/zinc/13/35/71/333133571.db2.gz JBZMCRHRPBIWRU-ZIAGYGMSSA-N 1 2 324.428 4.324 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)no2)cc1 ZINC000179531393 333151925 /nfs/dbraw/zinc/15/19/25/333151925.db2.gz URTYDFOCLBOAME-CYBMUJFWSA-N 1 2 317.433 4.005 20 0 DIADLO CCn1cc([C@@H](C)[NH2+][C@H](c2cccc(C)c2)c2ccccn2)cn1 ZINC000179535437 333152291 /nfs/dbraw/zinc/15/22/91/333152291.db2.gz GIWXKWZZMDTMGV-OXQOHEQNSA-N 1 2 320.440 4.047 20 0 DIADLO Cc1nc([C@H]([NH2+]CC2CCCCC2)c2ccc(Cl)cc2)no1 ZINC000180195390 333159275 /nfs/dbraw/zinc/15/92/75/333159275.db2.gz WFJJAJRIWVAEOY-MRXNPFEDSA-N 1 2 319.836 4.291 20 0 DIADLO CSc1ccc(C)c(NC(=O)c2cccc(-n3cc[nH+]c3)c2)c1 ZINC000343338211 335126223 /nfs/dbraw/zinc/12/62/23/335126223.db2.gz MRPPAXDBZGAJKV-UHFFFAOYSA-N 1 2 323.421 4.155 20 0 DIADLO CCCCc1ccc(NC(=O)c2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000522741941 333184037 /nfs/dbraw/zinc/18/40/37/333184037.db2.gz SNWSNVSMGXFPKW-UHFFFAOYSA-N 1 2 319.408 4.467 20 0 DIADLO CC(C)(Cc1ccccc1)C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000522744131 333185164 /nfs/dbraw/zinc/18/51/64/333185164.db2.gz BBMXZNDXQHBGQX-UHFFFAOYSA-N 1 2 319.408 4.080 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](c2ncc(C)s2)C2CC2)cs1 ZINC000185290545 333206892 /nfs/dbraw/zinc/20/68/92/333206892.db2.gz BFVDJVWRLIKEIA-OAHLLOKOSA-N 1 2 321.515 4.492 20 0 DIADLO Cc1cccc2c(CCC(=O)Nc3c(C)cc[nH+]c3C)c[nH]c21 ZINC000425591119 335123694 /nfs/dbraw/zinc/12/36/94/335123694.db2.gz YBYOVLQLXTUXDF-UHFFFAOYSA-N 1 2 307.397 4.059 20 0 DIADLO CC1(C)CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000497360770 333240454 /nfs/dbraw/zinc/24/04/54/333240454.db2.gz CGORXBKDLIIAQR-UHFFFAOYSA-N 1 2 315.244 4.054 20 0 DIADLO CC1(C)CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000497360770 333240455 /nfs/dbraw/zinc/24/04/55/333240455.db2.gz CGORXBKDLIIAQR-UHFFFAOYSA-N 1 2 315.244 4.054 20 0 DIADLO C/C=C\c1ccc(NC(=O)NCCCCNc2cccc[nH+]2)cc1 ZINC000497404445 333247082 /nfs/dbraw/zinc/24/70/82/333247082.db2.gz ABFOALZQAJLPTA-UQCOIBPSSA-N 1 2 324.428 4.129 20 0 DIADLO CCOCc1cc(-c2[nH]c3cc(C)c(C)cc3[nH+]2)ccc1OC ZINC000497504092 333256940 /nfs/dbraw/zinc/25/69/40/333256940.db2.gz BXYBIPZBBLSVTR-UHFFFAOYSA-N 1 2 310.397 4.392 20 0 DIADLO CCC(CC)(CC)[S@](=O)Cc1[nH+]ccn1Cc1ccccc1 ZINC000190588747 333272378 /nfs/dbraw/zinc/27/23/78/333272378.db2.gz HZDHXKOTULJXKU-JOCHJYFZSA-N 1 2 318.486 4.149 20 0 DIADLO CCC(CC)(CC)[S@@](=O)Cc1[nH+]ccn1Cc1ccccc1 ZINC000190588728 333272505 /nfs/dbraw/zinc/27/25/05/333272505.db2.gz HZDHXKOTULJXKU-QFIPXVFZSA-N 1 2 318.486 4.149 20 0 DIADLO CCC[C@@H](Nc1cc(C)[nH+]c(-c2ccncc2)n1)c1ccccc1 ZINC000498844070 333285162 /nfs/dbraw/zinc/28/51/62/333285162.db2.gz MOLFEYMBEJGUSR-GOSISDBHSA-N 1 2 318.424 4.222 20 0 DIADLO CN(C)c1ccccc1C[N@H+](C)Cc1c(F)cccc1Cl ZINC000525783375 333308988 /nfs/dbraw/zinc/30/89/88/333308988.db2.gz QCAXXEDGTXOGNX-UHFFFAOYSA-N 1 2 306.812 4.177 20 0 DIADLO CN(C)c1ccccc1C[N@@H+](C)Cc1c(F)cccc1Cl ZINC000525783375 333308990 /nfs/dbraw/zinc/30/89/90/333308990.db2.gz QCAXXEDGTXOGNX-UHFFFAOYSA-N 1 2 306.812 4.177 20 0 DIADLO c1coc(-c2nc(C[N@@H+]3CCC[C@@H]3c3ccccn3)cs2)c1 ZINC000531201495 333330518 /nfs/dbraw/zinc/33/05/18/333330518.db2.gz XXRAIMXTEHJBDS-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO c1coc(-c2nc(C[N@H+]3CCC[C@@H]3c3ccccn3)cs2)c1 ZINC000531201495 333330519 /nfs/dbraw/zinc/33/05/19/333330519.db2.gz XXRAIMXTEHJBDS-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)c(F)c(F)c1)c1c(F)cccc1F ZINC000062707942 333336060 /nfs/dbraw/zinc/33/60/60/333336060.db2.gz QBFJCSNXVMWKAF-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)c(F)c(F)c1)c1c(F)cccc1F ZINC000062707944 333336080 /nfs/dbraw/zinc/33/60/80/333336080.db2.gz QBFJCSNXVMWKAF-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO O=C(CSc1[nH+]cc2ccccn21)c1ccc(F)c(Cl)c1 ZINC000531242920 333337613 /nfs/dbraw/zinc/33/76/13/333337613.db2.gz OKHZGTMKSMOIRA-UHFFFAOYSA-N 1 2 320.776 4.102 20 0 DIADLO Clc1ccc(Br)cc1C[N@@H+]1CCC12CCC2 ZINC000531416966 333350409 /nfs/dbraw/zinc/35/04/09/333350409.db2.gz HLBKTIJNHATWGU-UHFFFAOYSA-N 1 2 300.627 4.231 20 0 DIADLO Clc1ccc(Br)cc1C[N@H+]1CCC12CCC2 ZINC000531416966 333350410 /nfs/dbraw/zinc/35/04/10/333350410.db2.gz HLBKTIJNHATWGU-UHFFFAOYSA-N 1 2 300.627 4.231 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCC[C@H]3c3ccccn3)co2)cc1 ZINC000531440756 333353459 /nfs/dbraw/zinc/35/34/59/333353459.db2.gz ZWWKPHNJYIADML-IBGZPJMESA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCC[C@H]3c3ccccn3)co2)cc1 ZINC000531440756 333353460 /nfs/dbraw/zinc/35/34/60/333353460.db2.gz ZWWKPHNJYIADML-IBGZPJMESA-N 1 2 319.408 4.382 20 0 DIADLO CC(C)(C)OC(=O)C1([NH2+]Cc2ccc(Cl)cc2)CCCC1 ZINC000583465308 333359443 /nfs/dbraw/zinc/35/94/43/333359443.db2.gz DTFGQMVHYKAVJM-UHFFFAOYSA-N 1 2 309.837 4.084 20 0 DIADLO CCOc1cccc(NCc2c[nH+]c(C)n2-c2ccccc2)c1 ZINC000320778979 335140034 /nfs/dbraw/zinc/14/00/34/335140034.db2.gz MCNPKMGCNZHESO-UHFFFAOYSA-N 1 2 307.397 4.192 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)s1 ZINC000274146432 333467069 /nfs/dbraw/zinc/46/70/69/333467069.db2.gz DUNHQOXVRSOKKH-DTWKUNHWSA-N 1 2 315.364 4.277 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)s1 ZINC000274146455 333467134 /nfs/dbraw/zinc/46/71/34/333467134.db2.gz DUNHQOXVRSOKKH-RKDXNWHRSA-N 1 2 315.364 4.277 20 0 DIADLO Cc1ccnc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)n1 ZINC000338593751 333492829 /nfs/dbraw/zinc/49/28/29/333492829.db2.gz MGCHYKOXEXVYIW-INIZCTEOSA-N 1 2 321.346 4.045 20 0 DIADLO Fc1ccc(Cl)cc1CNc1cccc(-n2cc[nH+]c2)c1 ZINC000125372758 333508336 /nfs/dbraw/zinc/50/83/36/333508336.db2.gz DJGHHDRGEAZSFX-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO CC(C)c1ccoc1-c1noc(-c2cccc(-n3cc[nH+]c3)c2)n1 ZINC000426213884 333528143 /nfs/dbraw/zinc/52/81/43/333528143.db2.gz NIUQQALTDWMPCB-UHFFFAOYSA-N 1 2 320.352 4.306 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+]Cc1cccc2c1OCO2 ZINC000040667030 333533976 /nfs/dbraw/zinc/53/39/76/333533976.db2.gz JEKZUEUBMNDWGC-UHFFFAOYSA-N 1 2 310.180 4.012 20 0 DIADLO Cn1ccnc1[C@H]([NH2+][C@H]1CCCc2sccc21)c1ccccc1 ZINC000531687552 333543868 /nfs/dbraw/zinc/54/38/68/333543868.db2.gz IUXYEBGXUSCNCH-FUHWJXTLSA-N 1 2 323.465 4.238 20 0 DIADLO Cc1nc(C[NH2+][C@H]2CCSc3ccccc32)nc2ccccc12 ZINC000531707168 333548545 /nfs/dbraw/zinc/54/85/45/333548545.db2.gz CODOXGGVMOMCOK-INIZCTEOSA-N 1 2 321.449 4.265 20 0 DIADLO CCc1oc2ccccc2c1C[NH2+]Cc1nnc(C(C)C)s1 ZINC000531820648 333567314 /nfs/dbraw/zinc/56/73/14/333567314.db2.gz VEYLDRRYSXAGTJ-UHFFFAOYSA-N 1 2 315.442 4.260 20 0 DIADLO COc1cc2cc[nH+]c(N3CC[C@H](c4ccccc4)C3)c2cc1F ZINC000563473808 333610066 /nfs/dbraw/zinc/61/00/66/333610066.db2.gz XYVLYGOJJSAVHE-INIZCTEOSA-N 1 2 322.383 4.376 20 0 DIADLO Cc1cc2[nH+]cn(Cc3ncc(-c4cccs4)o3)c2cc1C ZINC000152225332 333647759 /nfs/dbraw/zinc/64/77/59/333647759.db2.gz KHWOGEMCZCWMCC-UHFFFAOYSA-N 1 2 309.394 4.418 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nc(=O)c2sccc2[nH]1)C1CCCCC1 ZINC000411497785 333682539 /nfs/dbraw/zinc/68/25/39/333682539.db2.gz ZQEOXKPRIWAVGV-CYBMUJFWSA-N 1 2 319.474 4.236 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2c1cc(Cl)cc2Cl)c1csnn1 ZINC000412036498 333724979 /nfs/dbraw/zinc/72/49/79/333724979.db2.gz IHCJSEBEVPGDJH-JVXZTZIISA-N 1 2 314.241 4.183 20 0 DIADLO C[C@H]([NH2+]Cc1ccc([C@H](C)C(F)(F)F)cc1)c1csnn1 ZINC000412035903 333725131 /nfs/dbraw/zinc/72/51/31/333725131.db2.gz HPMPADIVZHAEIH-UWVGGRQHSA-N 1 2 315.364 4.055 20 0 DIADLO C[C@@H](CC(F)F)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000412109646 333727666 /nfs/dbraw/zinc/72/76/66/333727666.db2.gz PLZDCRXVPYYSSL-NSHDSACASA-N 1 2 306.312 4.104 20 0 DIADLO CC(C)(CC(F)F)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000412108451 333729895 /nfs/dbraw/zinc/72/98/95/333729895.db2.gz MUMFJVXTKAWRGG-UHFFFAOYSA-N 1 2 320.339 4.494 20 0 DIADLO Cn1c2ccc(NC(=O)C(C)(C)CC(F)F)cc2[nH+]c1C1CC1 ZINC000412227407 333740760 /nfs/dbraw/zinc/74/07/60/333740760.db2.gz ZLAHEYSOVDOQTP-UHFFFAOYSA-N 1 2 321.371 4.071 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1cc2n(n1)CCC2 ZINC000414097346 333895814 /nfs/dbraw/zinc/89/58/14/333895814.db2.gz RPZKOUOQGZKOAZ-MNOVXSKESA-N 1 2 307.800 4.034 20 0 DIADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1ccn(C)n1 ZINC000414124739 333898577 /nfs/dbraw/zinc/89/85/77/333898577.db2.gz CKLVGXYVGPDFOE-IUODEOHRSA-N 1 2 311.351 4.073 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@H](C)c2csnn2)c2ccccc12 ZINC000414308356 333937018 /nfs/dbraw/zinc/93/70/18/333937018.db2.gz SSRQUIXDTUOLMS-VXGBXAGGSA-N 1 2 313.426 4.112 20 0 DIADLO CC[C@H]([NH2+]Cc1ccoc1C)c1nc(C(F)(F)F)cs1 ZINC000414359803 333944948 /nfs/dbraw/zinc/94/49/48/333944948.db2.gz FLGRLPCQXLMSQS-JTQLQIEISA-N 1 2 304.337 4.304 20 0 DIADLO Cc1ncsc1C[N@H+](C)Cc1nc2cc(C)ccc2s1 ZINC000528380704 335167178 /nfs/dbraw/zinc/16/71/78/335167178.db2.gz LTRPZIGIOKGEID-UHFFFAOYSA-N 1 2 303.456 4.002 20 0 DIADLO Cc1ncsc1C[N@@H+](C)Cc1nc2cc(C)ccc2s1 ZINC000528380704 335167180 /nfs/dbraw/zinc/16/71/80/335167180.db2.gz LTRPZIGIOKGEID-UHFFFAOYSA-N 1 2 303.456 4.002 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+][C@H](C)c3csnn3)s2)cc1 ZINC000414533322 334009674 /nfs/dbraw/zinc/00/96/74/334009674.db2.gz BHLQQBGYZAMCRD-GFCCVEGCSA-N 1 2 315.467 4.426 20 0 DIADLO CC[N@H+](Cc1nc(C2CC2)cs1)[C@@H](C)c1cccc(O)c1 ZINC000343538785 335170748 /nfs/dbraw/zinc/17/07/48/335170748.db2.gz OIIJDDAJNKQHRN-LBPRGKRZSA-N 1 2 302.443 4.309 20 0 DIADLO CC[N@@H+](Cc1nc(C2CC2)cs1)[C@@H](C)c1cccc(O)c1 ZINC000343538785 335170749 /nfs/dbraw/zinc/17/07/49/335170749.db2.gz OIIJDDAJNKQHRN-LBPRGKRZSA-N 1 2 302.443 4.309 20 0 DIADLO Brc1ccccc1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000414844769 334114486 /nfs/dbraw/zinc/11/44/86/334114486.db2.gz FCYMAYULBSXXJK-UHFFFAOYSA-N 1 2 317.230 4.419 20 0 DIADLO Cc1ccccc1-n1nccc1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000414851284 334124602 /nfs/dbraw/zinc/12/46/02/334124602.db2.gz OGNHPIZNYYAZIP-UHFFFAOYSA-N 1 2 318.424 4.151 20 0 DIADLO CC[N@H+](Cc1cn(C(C)C)nc1C)Cc1ccccc1Cl ZINC000343611227 335177381 /nfs/dbraw/zinc/17/73/81/335177381.db2.gz QGICTPIIKIJVJI-UHFFFAOYSA-N 1 2 305.853 4.448 20 0 DIADLO CC[N@@H+](Cc1cn(C(C)C)nc1C)Cc1ccccc1Cl ZINC000343611227 335177382 /nfs/dbraw/zinc/17/73/82/335177382.db2.gz QGICTPIIKIJVJI-UHFFFAOYSA-N 1 2 305.853 4.448 20 0 DIADLO CCOc1ccc(CNc2ccc3c(c2)CCC[NH2+]3)cc1F ZINC000414851623 334125685 /nfs/dbraw/zinc/12/56/85/334125685.db2.gz OMJKHALMKDSAGE-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO Brc1cc(CNc2ccc3c(c2)CCC[NH2+]3)cs1 ZINC000414852960 334126992 /nfs/dbraw/zinc/12/69/92/334126992.db2.gz RASLCDMETNADDC-UHFFFAOYSA-N 1 2 323.259 4.481 20 0 DIADLO Cn1cc(CNc2ccc3c(c2)CCC[NH2+]3)c(-c2ccccc2)n1 ZINC000414855942 334128886 /nfs/dbraw/zinc/12/88/86/334128886.db2.gz XRGFLYCBOGGWFV-UHFFFAOYSA-N 1 2 318.424 4.057 20 0 DIADLO Fc1ccc(N[C@H](c2[nH]cc[nH+]2)c2cccnc2)cc1C1CC1 ZINC000343560743 335177957 /nfs/dbraw/zinc/17/79/57/335177957.db2.gz ZJPRSOZKYXTRHE-KRWDZBQOSA-N 1 2 308.360 4.023 20 0 DIADLO CC(C)(C)n1ncnc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000283709111 334141138 /nfs/dbraw/zinc/14/11/38/334141138.db2.gz ZGEBJFHUDQSYRV-OAHLLOKOSA-N 1 2 318.852 4.024 20 0 DIADLO CC(C)(C)n1ncnc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000283709111 334141139 /nfs/dbraw/zinc/14/11/39/334141139.db2.gz ZGEBJFHUDQSYRV-OAHLLOKOSA-N 1 2 318.852 4.024 20 0 DIADLO Cc1ccc(NC(=O)NCC2(Cc3ccccc3)CCC2)c(C)[nH+]1 ZINC000343570674 335178511 /nfs/dbraw/zinc/17/85/11/335178511.db2.gz OGYDFXXIKISTFB-UHFFFAOYSA-N 1 2 323.440 4.233 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000343577694 335178779 /nfs/dbraw/zinc/17/87/79/335178779.db2.gz SWLRIJPEYAMHKG-UHFFFAOYSA-N 1 2 319.399 4.215 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000343577694 335178780 /nfs/dbraw/zinc/17/87/80/335178780.db2.gz SWLRIJPEYAMHKG-UHFFFAOYSA-N 1 2 319.399 4.215 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)cc1O ZINC000289844038 334168329 /nfs/dbraw/zinc/16/83/29/334168329.db2.gz QUUQDTFTNZLFPG-MNOVXSKESA-N 1 2 307.340 4.091 20 0 DIADLO CSc1ccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000187828707 334274322 /nfs/dbraw/zinc/27/43/22/334274322.db2.gz YVBXRPOXFCFNJB-QGZVFWFLSA-N 1 2 309.438 4.011 20 0 DIADLO C[C@H]([NH2+]Cc1csc(Cl)n1)c1ccccc1OC(F)F ZINC000296391210 334233614 /nfs/dbraw/zinc/23/36/14/334233614.db2.gz UZOQUTYPTMASDM-QMMMGPOBSA-N 1 2 318.776 4.249 20 0 DIADLO CC(C)c1nc(C[NH+]2CCC(c3c[nH]c4ccccc43)CC2)no1 ZINC000299074683 334252809 /nfs/dbraw/zinc/25/28/09/334252809.db2.gz QEATVIRMGBZFOP-UHFFFAOYSA-N 1 2 324.428 4.054 20 0 DIADLO COc1cc(C)[nH+]c(CN(C)[C@H](C)c2ccc(Cl)cc2)c1 ZINC000534545180 334282538 /nfs/dbraw/zinc/28/25/38/334282538.db2.gz OSWAERZNWHIRNN-CYBMUJFWSA-N 1 2 304.821 4.245 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CCc3cccc(Cl)c3)cc2[nH+]1 ZINC000531930291 334291027 /nfs/dbraw/zinc/29/10/27/334291027.db2.gz DCXBIHSPEVSHMN-UHFFFAOYSA-N 1 2 313.788 4.096 20 0 DIADLO CC1(C)C[N@H+](Cc2nnc(-c3ccccc3)o2)Cc2ccccc21 ZINC000534668008 334319411 /nfs/dbraw/zinc/31/94/11/334319411.db2.gz DQKNTCHRENITAB-UHFFFAOYSA-N 1 2 319.408 4.030 20 0 DIADLO CC1(C)C[N@@H+](Cc2nnc(-c3ccccc3)o2)Cc2ccccc21 ZINC000534668008 334319412 /nfs/dbraw/zinc/31/94/12/334319412.db2.gz DQKNTCHRENITAB-UHFFFAOYSA-N 1 2 319.408 4.030 20 0 DIADLO COc1c(C)cc(C[N@H+](C)[C@H](C)c2nc(C(C)C)no2)cc1C ZINC000101566170 334327666 /nfs/dbraw/zinc/32/76/66/334327666.db2.gz KVEXCXYXTZMNMK-CQSZACIVSA-N 1 2 317.433 4.011 20 0 DIADLO COc1c(C)cc(C[N@@H+](C)[C@H](C)c2nc(C(C)C)no2)cc1C ZINC000101566170 334327667 /nfs/dbraw/zinc/32/76/67/334327667.db2.gz KVEXCXYXTZMNMK-CQSZACIVSA-N 1 2 317.433 4.011 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccccc2Cl)C[C@@H](c2ccc(F)cc2)O1 ZINC000303840372 334336221 /nfs/dbraw/zinc/33/62/21/334336221.db2.gz BNZHRFRDJRFSJB-UGSOOPFHSA-N 1 2 319.807 4.441 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccccc2Cl)C[C@@H](c2ccc(F)cc2)O1 ZINC000303840372 334336223 /nfs/dbraw/zinc/33/62/23/334336223.db2.gz BNZHRFRDJRFSJB-UGSOOPFHSA-N 1 2 319.807 4.441 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)cc1 ZINC000534797396 334337067 /nfs/dbraw/zinc/33/70/67/334337067.db2.gz ULWZPHOQNUAOIU-UHFFFAOYSA-N 1 2 320.396 4.403 20 0 DIADLO Cc1cnc(C[NH2+]C(C)(C)c2ccc(Cl)c(Cl)c2)nc1 ZINC000534841932 334339376 /nfs/dbraw/zinc/33/93/76/334339376.db2.gz JICPRDUBLZCWJQ-UHFFFAOYSA-N 1 2 310.228 4.117 20 0 DIADLO CC[C@H](Cc1ccccc1)c1nc(Cc2ccc[nH+]c2C)no1 ZINC000563677937 334341202 /nfs/dbraw/zinc/34/12/02/334341202.db2.gz CWPQUTNHEMXEDG-MRXNPFEDSA-N 1 2 307.397 4.100 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(F)c2F)C[C@H](c2ccc(F)cc2)O1 ZINC000303921404 334347177 /nfs/dbraw/zinc/34/71/77/334347177.db2.gz ORCBKWVFJZFXCD-SJKOYZFVSA-N 1 2 321.342 4.066 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(F)c2F)C[C@H](c2ccc(F)cc2)O1 ZINC000303921404 334347178 /nfs/dbraw/zinc/34/71/78/334347178.db2.gz ORCBKWVFJZFXCD-SJKOYZFVSA-N 1 2 321.342 4.066 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(F)c2F)C[C@@H](c2ccc(F)cc2)O1 ZINC000303921402 334347329 /nfs/dbraw/zinc/34/73/29/334347329.db2.gz ORCBKWVFJZFXCD-PXAZEXFGSA-N 1 2 321.342 4.066 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(F)c2F)C[C@@H](c2ccc(F)cc2)O1 ZINC000303921402 334347331 /nfs/dbraw/zinc/34/73/31/334347331.db2.gz ORCBKWVFJZFXCD-PXAZEXFGSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)cc(C)c1F ZINC000535012349 334356107 /nfs/dbraw/zinc/35/61/07/334356107.db2.gz CBDCJUGIGQCNAN-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO Cc1cc(NC(=O)c2ccc(OC3CCCCC3)cc2)c(C)c[nH+]1 ZINC000535036314 334359177 /nfs/dbraw/zinc/35/91/77/334359177.db2.gz UJDDWFYFITYMED-UHFFFAOYSA-N 1 2 324.424 4.084 20 0 DIADLO Cc1cc(NC(=O)N2CCCCC[C@@H]2c2ccccc2)c(C)c[nH+]1 ZINC000535062087 334361865 /nfs/dbraw/zinc/36/18/65/334361865.db2.gz PSLQQCGOTVSECU-LJQANCHMSA-N 1 2 323.440 4.270 20 0 DIADLO C[C@@H]([NH2+]Cc1ccnc(OC2CCCCC2)c1)c1cscn1 ZINC000535065427 334362765 /nfs/dbraw/zinc/36/27/65/334362765.db2.gz RMQCYTOEPRTFKL-CYBMUJFWSA-N 1 2 317.458 4.100 20 0 DIADLO CCCn1c2ccccc2nc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000535067597 334363148 /nfs/dbraw/zinc/36/31/48/334363148.db2.gz RGHUBZNZJKOTSS-GOSISDBHSA-N 1 2 320.440 4.178 20 0 DIADLO CCCn1c2ccccc2nc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000535067597 334363149 /nfs/dbraw/zinc/36/31/49/334363149.db2.gz RGHUBZNZJKOTSS-GOSISDBHSA-N 1 2 320.440 4.178 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2ccccc2OCC2CC2)cs1 ZINC000535085232 334366923 /nfs/dbraw/zinc/36/69/23/334366923.db2.gz BWOYMIIBXMJADS-UHFFFAOYSA-N 1 2 316.470 4.126 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2ccccc2OCC2CC2)cs1 ZINC000535085232 334366925 /nfs/dbraw/zinc/36/69/25/334366925.db2.gz BWOYMIIBXMJADS-UHFFFAOYSA-N 1 2 316.470 4.126 20 0 DIADLO CC[C@@H](NC(=O)C/C=C\c1ccc(C(C)C)cc1)c1[nH]cc[nH+]1 ZINC000443133129 338445278 /nfs/dbraw/zinc/44/52/78/338445278.db2.gz ULWFWBMTIVSJFB-KEGWNNHHSA-N 1 2 311.429 4.204 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(Cl)cc(Cl)cc3[C@@H]2C)on1 ZINC000532038714 334381746 /nfs/dbraw/zinc/38/17/46/334381746.db2.gz FGBDLDKDLJBPLR-JTQLQIEISA-N 1 2 311.212 4.409 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(Cl)cc(Cl)cc3[C@@H]2C)on1 ZINC000532038714 334381747 /nfs/dbraw/zinc/38/17/47/334381747.db2.gz FGBDLDKDLJBPLR-JTQLQIEISA-N 1 2 311.212 4.409 20 0 DIADLO Cc1ccc(NC(=O)C[C@H](c2[nH]cc[nH+]2)c2ccccc2)c(C)c1 ZINC000340799673 334386354 /nfs/dbraw/zinc/38/63/54/334386354.db2.gz NOKJHEYQJJZJAB-KRWDZBQOSA-N 1 2 319.408 4.187 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(C(C)(C)C)cc2)o1 ZINC000341097759 334408822 /nfs/dbraw/zinc/40/88/22/334408822.db2.gz IFUUFAFNPXHIRK-QWHCGFSZSA-N 1 2 301.434 4.341 20 0 DIADLO Cc1cc(N(C)[C@H](C)c2cc(F)ccc2F)nc(C2CC2)[nH+]1 ZINC000341483927 334447161 /nfs/dbraw/zinc/44/71/61/334447161.db2.gz KAVAJWOVTXRSIO-LLVKDONJSA-N 1 2 303.356 4.138 20 0 DIADLO COc1ccccc1[C@@H]1CCCN1c1cc(C)[nH+]c(C2CC2)n1 ZINC000341495313 334448401 /nfs/dbraw/zinc/44/84/01/334448401.db2.gz GVJZREASOHKGOI-INIZCTEOSA-N 1 2 309.413 4.013 20 0 DIADLO Cn1ncc2c1CCC[C@H]2Nc1cc[nH+]c2c(Cl)cccc12 ZINC000341742863 334475908 /nfs/dbraw/zinc/47/59/08/334475908.db2.gz IRLNFEVHVHZXCS-CQSZACIVSA-N 1 2 312.804 4.111 20 0 DIADLO CCc1cnccc1[C@H](C)[NH2+][C@@H](C)c1noc(-c2ccccc2)n1 ZINC000341908135 334490751 /nfs/dbraw/zinc/49/07/51/334490751.db2.gz JHUDFYBMEUDDGH-KBPBESRZSA-N 1 2 322.412 4.106 20 0 DIADLO CCO[C@@H](C)c1nc(CSCc2c[nH+]ccc2OC)cs1 ZINC000341935276 334494044 /nfs/dbraw/zinc/49/40/44/334494044.db2.gz VDKTZYTYOUYSGA-NSHDSACASA-N 1 2 324.471 4.078 20 0 DIADLO COc1cc[nH+]cc1CSCc1ccccc1OC(F)F ZINC000341969055 334498600 /nfs/dbraw/zinc/49/86/00/334498600.db2.gz SSFCVXMXXPZGKB-UHFFFAOYSA-N 1 2 311.353 4.125 20 0 DIADLO Cc1ccc(CNc2cccc(-c3ccc4c(c3)OCCO4)[nH+]2)o1 ZINC000341973893 334498848 /nfs/dbraw/zinc/49/88/48/334498848.db2.gz UZDMYBIPNXLLNK-UHFFFAOYSA-N 1 2 322.364 4.033 20 0 DIADLO CSc1cccc(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)c1C ZINC000342000638 334500164 /nfs/dbraw/zinc/50/01/64/334500164.db2.gz BVQLVYZPDGWDHL-UHFFFAOYSA-N 1 2 323.421 4.155 20 0 DIADLO COc1cc[nH+]cc1CSCc1coc(-c2ccccc2)n1 ZINC000342006608 334500659 /nfs/dbraw/zinc/50/06/59/334500659.db2.gz REDVZGNGVCOZKQ-UHFFFAOYSA-N 1 2 312.394 4.179 20 0 DIADLO FC(F)c1ccnc(C[NH2+]Cc2c(Cl)oc3ccccc32)n1 ZINC000342243363 334519989 /nfs/dbraw/zinc/51/99/89/334519989.db2.gz JCFDIPABTQOONF-UHFFFAOYSA-N 1 2 323.730 4.104 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000342223172 334522412 /nfs/dbraw/zinc/52/24/12/334522412.db2.gz FTAFYFGQDXSPAY-GJZGRUSLSA-N 1 2 307.397 4.457 20 0 DIADLO CNc1ccccc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000342297787 334526127 /nfs/dbraw/zinc/52/61/27/334526127.db2.gz YJIXHHGIYFPWJD-UHFFFAOYSA-N 1 2 319.364 4.168 20 0 DIADLO CC(C)Cn1ccnc1CNc1cc[nH+]c2c(Cl)cccc12 ZINC000342367945 334533909 /nfs/dbraw/zinc/53/39/09/334533909.db2.gz YVEUWBYRHZXEAI-UHFFFAOYSA-N 1 2 314.820 4.353 20 0 DIADLO CCc1ccc([C@H]2CCCN2c2[nH+]c3cccc(F)c3n2C)o1 ZINC000443519962 338453498 /nfs/dbraw/zinc/45/34/98/338453498.db2.gz PTUUYEMZTWRYME-OAHLLOKOSA-N 1 2 313.376 4.209 20 0 DIADLO CN(Cc1ccc(Cl)c(F)c1)c1cc[nH+]c2ccncc21 ZINC000342773022 334575292 /nfs/dbraw/zinc/57/52/92/334575292.db2.gz GGEZSZJVJHQGAC-UHFFFAOYSA-N 1 2 301.752 4.059 20 0 DIADLO Cc1c[nH+]c(CN(C)[C@H](C)c2ccc(Cl)cc2Cl)n1C ZINC000342775306 334575441 /nfs/dbraw/zinc/57/54/41/334575441.db2.gz FDEQEQYLTLNXOU-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO Cc1nc([C@@H]([NH2+]CCC(C)(C)C)c2ccc(Cl)cc2)no1 ZINC000188216668 334666483 /nfs/dbraw/zinc/66/64/83/334666483.db2.gz VNNARWHLKHARDD-AWEZNQCLSA-N 1 2 307.825 4.147 20 0 DIADLO Fc1ccc([C@H](Nc2ccc(Cl)cc2)c2[nH]cc[nH+]2)cc1 ZINC000188359434 334687959 /nfs/dbraw/zinc/68/79/59/334687959.db2.gz HECVYLRCDDYAPC-HNNXBMFYSA-N 1 2 301.752 4.404 20 0 DIADLO Fc1ccc([C@@H](Nc2ccc(Cl)cc2)c2[nH]cc[nH+]2)cc1 ZINC000188359457 334688069 /nfs/dbraw/zinc/68/80/69/334688069.db2.gz HECVYLRCDDYAPC-OAHLLOKOSA-N 1 2 301.752 4.404 20 0 DIADLO CCc1nc2sccc2c(NCCCc2cccc(C)[nH+]2)n1 ZINC000343221527 334689795 /nfs/dbraw/zinc/68/97/95/334689795.db2.gz BSFYOGDWJYIRAG-UHFFFAOYSA-N 1 2 312.442 4.002 20 0 DIADLO Fc1ccc(C2=CCN(c3cc[nH+]c4ccncc43)CC2)cc1 ZINC000444112930 338468531 /nfs/dbraw/zinc/46/85/31/338468531.db2.gz QRERTJWVBBXCEX-UHFFFAOYSA-N 1 2 305.356 4.063 20 0 DIADLO C[C@H]1[C@@H](Cc2ccccc2)CCN1c1cc[nH+]c2ccncc21 ZINC000444071848 338467935 /nfs/dbraw/zinc/46/79/35/338467935.db2.gz GWTXMBKPARNAPS-DOTOQJQBSA-N 1 2 303.409 4.087 20 0 DIADLO C[C@H](Nc1cc[nH+]c2ccncc12)c1cccc(C(F)(F)F)c1 ZINC000444116443 338468665 /nfs/dbraw/zinc/46/86/65/338468665.db2.gz VZOXUWJVOBKEIA-NSHDSACASA-N 1 2 317.314 4.244 20 0 DIADLO Clc1ccc([C@@H]2CCN(c3cc[nH+]c4ccncc43)C2)cc1 ZINC000444091075 338468166 /nfs/dbraw/zinc/46/81/66/338468166.db2.gz VDLAVSQBLIHCLC-CQSZACIVSA-N 1 2 309.800 4.277 20 0 DIADLO C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1c1cc[nH+]c2ccncc21 ZINC000444092250 338468193 /nfs/dbraw/zinc/46/81/93/338468193.db2.gz SKSJFVHQOMRNLE-UKRRQHHQSA-N 1 2 307.372 4.151 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1C ZINC000426008425 334900945 /nfs/dbraw/zinc/90/09/45/334900945.db2.gz BHFBKAYFCGJJAA-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(F)F)no1)c1cc2ccccc2s1 ZINC000425431353 334907199 /nfs/dbraw/zinc/90/71/99/334907199.db2.gz IAQWEVLLHYMFRN-QMMMGPOBSA-N 1 2 309.341 4.073 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nc(C(F)F)no1)c1ccccc1Cl ZINC000425454285 334911981 /nfs/dbraw/zinc/91/19/81/334911981.db2.gz GKOBDXXKPSWQJQ-GFCCVEGCSA-N 1 2 315.751 4.148 20 0 DIADLO FC(F)c1noc(C[NH2+][C@@H](CC2CCCC2)c2ccccc2)n1 ZINC000425451397 334913009 /nfs/dbraw/zinc/91/30/09/334913009.db2.gz BRDFUNXFICXIGM-AWEZNQCLSA-N 1 2 321.371 4.418 20 0 DIADLO Cc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nc(C(F)F)no1 ZINC000425462320 334913932 /nfs/dbraw/zinc/91/39/32/334913932.db2.gz UHGFAYBKXMUVQQ-CYBMUJFWSA-N 1 2 309.360 4.193 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1csc(C3CC3)n1)CCCO2 ZINC000343686623 335188357 /nfs/dbraw/zinc/18/83/57/335188357.db2.gz BWUBFAXVWWNSTK-OAHLLOKOSA-N 1 2 318.417 4.163 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](c2cc3ccccc3o2)C(C)C)s1 ZINC000343750971 335190473 /nfs/dbraw/zinc/19/04/73/335190473.db2.gz JPDPITHYXGELRB-QGZVFWFLSA-N 1 2 315.442 4.334 20 0 DIADLO Cc1ccc(-n2cc[nH+]c2)c(C(=O)Nc2ccc3ccoc3c2)c1 ZINC000343994464 335206361 /nfs/dbraw/zinc/20/63/61/335206361.db2.gz SXFODUVBRIUSFA-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO Cc1ccccc1[C@H](C)N(C)C(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000344217499 335229654 /nfs/dbraw/zinc/22/96/54/335229654.db2.gz VXMKNXPYHIOGKM-INIZCTEOSA-N 1 2 319.408 4.014 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+]1CCCc2occc2C1 ZINC000344293529 335237615 /nfs/dbraw/zinc/23/76/15/335237615.db2.gz OSCBPEPSWPJLEV-UHFFFAOYSA-N 1 2 314.410 4.253 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+]1CCCc2occc2C1 ZINC000344293529 335237617 /nfs/dbraw/zinc/23/76/17/335237617.db2.gz OSCBPEPSWPJLEV-UHFFFAOYSA-N 1 2 314.410 4.253 20 0 DIADLO O=C(c1cccc(-n2cc[nH+]c2)c1)N(CC1CC1)C1CCCCC1 ZINC000344414133 335246645 /nfs/dbraw/zinc/24/66/45/335246645.db2.gz CXCFGVIVNCRIJN-UHFFFAOYSA-N 1 2 323.440 4.057 20 0 DIADLO c1nc(C[NH2+][C@@H]2CCOc3c(-c4ccccc4)cccc32)cs1 ZINC000344423814 335247648 /nfs/dbraw/zinc/24/76/48/335247648.db2.gz PWDCHKHFXFQYKJ-GOSISDBHSA-N 1 2 322.433 4.424 20 0 DIADLO CC(C)[N@H+](Cc1ccco1)Cc1ncc(-c2cccs2)o1 ZINC000344449809 335249615 /nfs/dbraw/zinc/24/96/15/335249615.db2.gz OIZWOVKSADMWFP-UHFFFAOYSA-N 1 2 302.399 4.407 20 0 DIADLO CC(C)[N@@H+](Cc1ccco1)Cc1ncc(-c2cccs2)o1 ZINC000344449809 335249616 /nfs/dbraw/zinc/24/96/16/335249616.db2.gz OIZWOVKSADMWFP-UHFFFAOYSA-N 1 2 302.399 4.407 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cccc(C2CCC2)c1 ZINC000344529414 335255274 /nfs/dbraw/zinc/25/52/74/335255274.db2.gz IHNMYCWQWPZACG-UHFFFAOYSA-N 1 2 317.392 4.392 20 0 DIADLO Cc1[nH+]cc(CNc2cccc3c2OCCC3)n1-c1ccccc1 ZINC000344663196 335269869 /nfs/dbraw/zinc/26/98/69/335269869.db2.gz QZTDCUDNYNQNFD-UHFFFAOYSA-N 1 2 319.408 4.118 20 0 DIADLO CCn1c(C)nnc1C[N@H+](C)[C@@H](c1ccccc1Cl)C(C)C ZINC000113256680 335284106 /nfs/dbraw/zinc/28/41/06/335284106.db2.gz JPUSNUQDMMQWSL-QGZVFWFLSA-N 1 2 320.868 4.089 20 0 DIADLO CCn1c(C)nnc1C[N@@H+](C)[C@@H](c1ccccc1Cl)C(C)C ZINC000113256680 335284107 /nfs/dbraw/zinc/28/41/07/335284107.db2.gz JPUSNUQDMMQWSL-QGZVFWFLSA-N 1 2 320.868 4.089 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC[C@H]1c1cccnc1 ZINC000344932933 335286421 /nfs/dbraw/zinc/28/64/21/335286421.db2.gz GKAIMEJDYUOMCK-KRWDZBQOSA-N 1 2 319.408 4.288 20 0 DIADLO C[N@@H+](Cc1csc(C2CCCCC2)n1)C[C@H]1CCCCO1 ZINC000345310321 335316088 /nfs/dbraw/zinc/31/60/88/335316088.db2.gz WFYFKRDDSRHHSI-MRXNPFEDSA-N 1 2 308.491 4.192 20 0 DIADLO C[N@H+](Cc1csc(C2CCCCC2)n1)C[C@H]1CCCCO1 ZINC000345310321 335316089 /nfs/dbraw/zinc/31/60/89/335316089.db2.gz WFYFKRDDSRHHSI-MRXNPFEDSA-N 1 2 308.491 4.192 20 0 DIADLO CC(C)Cn1cc(C[NH2+]Cc2c(Cl)cccc2Cl)cn1 ZINC000541991808 335333941 /nfs/dbraw/zinc/33/39/41/335333941.db2.gz ADLBNMCDIOMGMM-UHFFFAOYSA-N 1 2 312.244 4.136 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC2(CCCC2)OC(C)(C)C1 ZINC000190965058 335352029 /nfs/dbraw/zinc/35/20/29/335352029.db2.gz YNLIZASTTRQODO-CQSZACIVSA-N 1 2 320.477 4.457 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC2(CCCC2)OC(C)(C)C1 ZINC000190965058 335352031 /nfs/dbraw/zinc/35/20/31/335352031.db2.gz YNLIZASTTRQODO-CQSZACIVSA-N 1 2 320.477 4.457 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC2(CCCC2)OC(C)(C)C1 ZINC000190965040 335352042 /nfs/dbraw/zinc/35/20/42/335352042.db2.gz YNLIZASTTRQODO-AWEZNQCLSA-N 1 2 320.477 4.457 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC2(CCCC2)OC(C)(C)C1 ZINC000190965040 335352044 /nfs/dbraw/zinc/35/20/44/335352044.db2.gz YNLIZASTTRQODO-AWEZNQCLSA-N 1 2 320.477 4.457 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2csc(Cl)c2)[nH+]1 ZINC000345891600 335358819 /nfs/dbraw/zinc/35/88/19/335358819.db2.gz RWRQTDSESBTHRX-UHFFFAOYSA-N 1 2 317.801 4.352 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)C[C@@H]1C[C@H](C(C)C)c2ccccc21 ZINC000345906754 335360000 /nfs/dbraw/zinc/36/00/00/335360000.db2.gz OOMXXTPNTAVQRX-MAUKXSAKSA-N 1 2 308.425 4.068 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2Cc3ccccc3OC[C@@H]2C)s1 ZINC000346296968 335393247 /nfs/dbraw/zinc/39/32/47/335393247.db2.gz NLCKDWFQJJWNGR-ZDUSSCGKSA-N 1 2 302.443 4.050 20 0 DIADLO CC(C)c1cnc(C[N@H+]2Cc3ccccc3OC[C@@H]2C)s1 ZINC000346296968 335393248 /nfs/dbraw/zinc/39/32/48/335393248.db2.gz NLCKDWFQJJWNGR-ZDUSSCGKSA-N 1 2 302.443 4.050 20 0 DIADLO c1cn(-c2cccc(-c3noc(-c4ccoc4C4CC4)n3)c2)c[nH+]1 ZINC000346377822 335402593 /nfs/dbraw/zinc/40/25/93/335402593.db2.gz WRPVTOSRYPPXDY-UHFFFAOYSA-N 1 2 318.336 4.060 20 0 DIADLO COc1ccc2cc(CN(C)c3cc[nH+]c(C4CC4)n3)ccc2c1 ZINC000346612562 335423862 /nfs/dbraw/zinc/42/38/62/335423862.db2.gz ZLZRLBYRULHMJV-UHFFFAOYSA-N 1 2 319.408 4.152 20 0 DIADLO CCc1cccnc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000346670739 335428230 /nfs/dbraw/zinc/42/82/30/335428230.db2.gz SHYOCWLKVSHRPV-UHFFFAOYSA-N 1 2 319.364 4.084 20 0 DIADLO CC[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1nc(C)cs1 ZINC000347612171 335510358 /nfs/dbraw/zinc/51/03/58/335510358.db2.gz HFDZFOPDMLRDFI-HNNXBMFYSA-N 1 2 304.463 4.004 20 0 DIADLO Cc1cc(-c2nnc(C[NH2+][C@@H](C)c3cc(C)oc3C)o2)c(C)o1 ZINC000348112247 335554478 /nfs/dbraw/zinc/55/44/78/335554478.db2.gz PABJOBKEUYIYPR-NSHDSACASA-N 1 2 315.373 4.007 20 0 DIADLO C[C@H](Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)c1cncs1 ZINC000348530295 335594726 /nfs/dbraw/zinc/59/47/26/335594726.db2.gz YWIDQXJRUKDKCB-JTQLQIEISA-N 1 2 304.806 4.155 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000191120929 335598709 /nfs/dbraw/zinc/59/87/09/335598709.db2.gz DFYGJJYSBNJTCF-HNNXBMFYSA-N 1 2 321.779 4.101 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+]Cc1nnc(C(C)(C)C)s1 ZINC000442858596 335641840 /nfs/dbraw/zinc/64/18/40/335641840.db2.gz PFBBFXHANPXIIF-LLVKDONJSA-N 1 2 321.515 4.408 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)o1 ZINC000430749754 335645757 /nfs/dbraw/zinc/64/57/57/335645757.db2.gz LJNNPAYNDQTDCG-MRVPVSSYSA-N 1 2 301.283 4.249 20 0 DIADLO Cc1ccc(C(C)(C)[NH2+]Cc2ncc(-c3ccccc3C)o2)cn1 ZINC000518843929 335652208 /nfs/dbraw/zinc/65/22/08/335652208.db2.gz FSWTXVSBYGAEJF-UHFFFAOYSA-N 1 2 321.424 4.378 20 0 DIADLO CC[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(F)cc1F ZINC000349563731 335680916 /nfs/dbraw/zinc/68/09/16/335680916.db2.gz HBUSDIXAMMQZTE-NSHDSACASA-N 1 2 302.777 4.316 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ncc(Cl)s1)c1nc2ccccc2[nH]1 ZINC000349609360 335684622 /nfs/dbraw/zinc/68/46/22/335684622.db2.gz JJWQTWHEMVVUMQ-CQSZACIVSA-N 1 2 320.849 4.160 20 0 DIADLO Cc1oc(C(C)C)cc1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000349988616 335714920 /nfs/dbraw/zinc/71/49/20/335714920.db2.gz GAHZBMWANQTJKZ-UHFFFAOYSA-N 1 2 309.369 4.149 20 0 DIADLO CCc1ccc(C[NH2+]Cc2cc(F)ccc2Br)o1 ZINC000051724602 335764397 /nfs/dbraw/zinc/76/43/97/335764397.db2.gz SLMCXHSXQAOOFP-UHFFFAOYSA-N 1 2 312.182 4.033 20 0 DIADLO CCC(C)(C)CC[S@@](=O)Cc1c[nH+]cn1Cc1ccccc1 ZINC000445540189 338499157 /nfs/dbraw/zinc/49/91/57/338499157.db2.gz OBQBUJWAXBGZON-JOCHJYFZSA-N 1 2 318.486 4.006 20 0 DIADLO Cc1cccc2cc(C(=O)Nc3cccc4[nH+]ccn43)sc21 ZINC000519558322 335877505 /nfs/dbraw/zinc/87/75/05/335877505.db2.gz NCNVHADYVIWTHU-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO CC(C)([NH2+]Cc1csc(-c2ccccc2)n1)c1nccs1 ZINC000116380314 335886900 /nfs/dbraw/zinc/88/69/00/335886900.db2.gz YMRAZGGOWQQQIM-UHFFFAOYSA-N 1 2 315.467 4.292 20 0 DIADLO C[NH+](C)[C@@H](c1nc(CCC(C)(C)C)no1)c1cccc(Cl)c1 ZINC000519673432 335887923 /nfs/dbraw/zinc/88/79/23/335887923.db2.gz XDAVRWIMYFVWQY-OAHLLOKOSA-N 1 2 321.852 4.353 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC(C)(C)[C@H]2c2cccnc2)c(C)[nH+]1 ZINC000519746768 335893975 /nfs/dbraw/zinc/89/39/75/335893975.db2.gz DRAATBUYUVQHHF-QGZVFWFLSA-N 1 2 324.428 4.017 20 0 DIADLO CCc1cc2c(ccn(Cc3ccc(C(C)C)[nH+]c3C)c2=O)o1 ZINC000519829639 335898688 /nfs/dbraw/zinc/89/86/88/335898688.db2.gz SJYWVDGPBMQUCT-UHFFFAOYSA-N 1 2 310.397 4.032 20 0 DIADLO CCCCCc1nc(Cn2c3ccccc3[nH+]c2C(C)C)no1 ZINC000445656536 338504759 /nfs/dbraw/zinc/50/47/59/338504759.db2.gz JNRADTBALWJVSD-UHFFFAOYSA-N 1 2 312.417 4.324 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc(-c2ccccc2)n1 ZINC000445658910 338504853 /nfs/dbraw/zinc/50/48/53/338504853.db2.gz TYNKXSOIUDKJFF-UHFFFAOYSA-N 1 2 318.380 4.258 20 0 DIADLO CCC[C@H](C)c1nc(Cn2c3ccccc3[nH+]c2C(C)C)no1 ZINC000445660436 338504919 /nfs/dbraw/zinc/50/49/19/338504919.db2.gz QZJOZTLOADDGSA-ZDUSSCGKSA-N 1 2 312.417 4.495 20 0 DIADLO Cc1ccc(SCC(=O)Nc2c(C)cc(C)[nH+]c2C)c(C)c1 ZINC000520507722 335984945 /nfs/dbraw/zinc/98/49/45/335984945.db2.gz UCHLPSHHFWILRH-UHFFFAOYSA-N 1 2 314.454 4.355 20 0 DIADLO Fc1cccc(C=C2CC[NH+](Cc3ncc(C4CC4)o3)CC2)c1 ZINC000520709943 336033238 /nfs/dbraw/zinc/03/32/38/336033238.db2.gz KWEOKWKDFFOZEK-UHFFFAOYSA-N 1 2 312.388 4.371 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1cc(F)ccc1Cl ZINC000445807412 338510589 /nfs/dbraw/zinc/51/05/89/338510589.db2.gz IWPZCKISCWAXBF-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO Cc1nocc1C[N@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000351453182 336036048 /nfs/dbraw/zinc/03/60/48/336036048.db2.gz PMQSEHDDFCBXFQ-UHFFFAOYSA-N 1 2 306.356 4.206 20 0 DIADLO Cc1nocc1C[N@@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000351453182 336036049 /nfs/dbraw/zinc/03/60/49/336036049.db2.gz PMQSEHDDFCBXFQ-UHFFFAOYSA-N 1 2 306.356 4.206 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(O)c2Cl)C[C@H](c2ccsc2)O1 ZINC000351686358 336058214 /nfs/dbraw/zinc/05/82/14/336058214.db2.gz QSNSDIHPZXDNFL-IAQYHMDHSA-N 1 2 323.845 4.069 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(O)c2Cl)C[C@H](c2ccsc2)O1 ZINC000351686358 336058215 /nfs/dbraw/zinc/05/82/15/336058215.db2.gz QSNSDIHPZXDNFL-IAQYHMDHSA-N 1 2 323.845 4.069 20 0 DIADLO Cc1ccc(-c2ccc(C(=O)Nc3cc[nH+]c(C)c3)c(F)c2)cc1 ZINC000520737096 336077169 /nfs/dbraw/zinc/07/71/69/336077169.db2.gz VHWITTNSOZELCA-UHFFFAOYSA-N 1 2 320.367 4.179 20 0 DIADLO CSCc1cccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000526106650 336120166 /nfs/dbraw/zinc/12/01/66/336120166.db2.gz VRZPGGCLKALWGJ-KRWDZBQOSA-N 1 2 309.438 4.474 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+]2CCC[C@@H]2c2ccc(C)o2)n1 ZINC000331375018 336134055 /nfs/dbraw/zinc/13/40/55/336134055.db2.gz CSXDMEULHFCPTN-ZIAGYGMSSA-N 1 2 303.406 4.212 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+]2CCC[C@@H]2c2ccc(C)o2)n1 ZINC000331375018 336134057 /nfs/dbraw/zinc/13/40/57/336134057.db2.gz CSXDMEULHFCPTN-ZIAGYGMSSA-N 1 2 303.406 4.212 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)[nH]1 ZINC000330297542 336137294 /nfs/dbraw/zinc/13/72/94/336137294.db2.gz GYFBRUAHZDNQKK-QGZVFWFLSA-N 1 2 323.444 4.137 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)[nH]1 ZINC000330297542 336137295 /nfs/dbraw/zinc/13/72/95/336137295.db2.gz GYFBRUAHZDNQKK-QGZVFWFLSA-N 1 2 323.444 4.137 20 0 DIADLO CC(C)C[C@H](C)CC(=O)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000445966271 338516401 /nfs/dbraw/zinc/51/64/01/338516401.db2.gz PRFGYBYCVZCAOX-AWEZNQCLSA-N 1 2 317.408 4.154 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1C[C@@H]1c1ccc(Cl)cc1 ZINC000351930620 336180449 /nfs/dbraw/zinc/18/04/49/336180449.db2.gz IMBKIVROQGOOHE-CABCVRRESA-N 1 2 315.804 4.029 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@@H](C)c1cc(F)ccc1F ZINC000351931365 336180557 /nfs/dbraw/zinc/18/05/57/336180557.db2.gz QDKROOXPZKHFEK-LBPRGKRZSA-N 1 2 319.355 4.202 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@H](C)c1c(F)cccc1F ZINC000351931934 336180831 /nfs/dbraw/zinc/18/08/31/336180831.db2.gz VTYGTGPOXQGULK-GFCCVEGCSA-N 1 2 319.355 4.202 20 0 DIADLO Cc1cccc(C)c1C[N@@H+]1CCSC[C@H]1c1nccs1 ZINC000351948095 336182109 /nfs/dbraw/zinc/18/21/09/336182109.db2.gz XXZGYHTUFPUVQU-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1cccc(C)c1C[N@H+]1CCSC[C@H]1c1nccs1 ZINC000351948095 336182110 /nfs/dbraw/zinc/18/21/10/336182110.db2.gz XXZGYHTUFPUVQU-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(C3CCCC3)n2)[C@H]1[C@H]1CCCO1 ZINC000351960155 336183267 /nfs/dbraw/zinc/18/32/67/336183267.db2.gz UTAYSXOWEHTPRF-CVEARBPZSA-N 1 2 320.502 4.190 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(C3CCCC3)n2)[C@H]1[C@H]1CCCO1 ZINC000351960155 336183269 /nfs/dbraw/zinc/18/32/69/336183269.db2.gz UTAYSXOWEHTPRF-CVEARBPZSA-N 1 2 320.502 4.190 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(C3CCCC3)n2)[C@@H]1[C@@H]1CCCO1 ZINC000351960158 336183511 /nfs/dbraw/zinc/18/35/11/336183511.db2.gz UTAYSXOWEHTPRF-JKSUJKDBSA-N 1 2 320.502 4.190 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(C3CCCC3)n2)[C@@H]1[C@@H]1CCCO1 ZINC000351960158 336183512 /nfs/dbraw/zinc/18/35/12/336183512.db2.gz UTAYSXOWEHTPRF-JKSUJKDBSA-N 1 2 320.502 4.190 20 0 DIADLO CCCCN(Cc1ccc(-n2cc[nH+]c2)cc1)CC(F)(F)F ZINC000351972432 336184471 /nfs/dbraw/zinc/18/44/71/336184471.db2.gz OJZIFRPBDIQVLH-UHFFFAOYSA-N 1 2 311.351 4.037 20 0 DIADLO CCc1ncc(C[N@H+]2CC=C(c3c(F)cccc3F)CC2)s1 ZINC000351981334 336185694 /nfs/dbraw/zinc/18/56/94/336185694.db2.gz JZGJQRLQIIAZAZ-UHFFFAOYSA-N 1 2 320.408 4.273 20 0 DIADLO CCc1ncc(C[N@@H+]2CC=C(c3c(F)cccc3F)CC2)s1 ZINC000351981334 336185696 /nfs/dbraw/zinc/18/56/96/336185696.db2.gz JZGJQRLQIIAZAZ-UHFFFAOYSA-N 1 2 320.408 4.273 20 0 DIADLO CC(C)n1cc(C[N@H+]2CC=C(c3c(F)cccc3F)CC2)cn1 ZINC000351983970 336185890 /nfs/dbraw/zinc/18/58/90/336185890.db2.gz VUBJWEKBUMLAOO-UHFFFAOYSA-N 1 2 317.383 4.032 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CC=C(c3c(F)cccc3F)CC2)cn1 ZINC000351983970 336185891 /nfs/dbraw/zinc/18/58/91/336185891.db2.gz VUBJWEKBUMLAOO-UHFFFAOYSA-N 1 2 317.383 4.032 20 0 DIADLO Fc1c(Cl)cccc1C[N@@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000352441202 336218871 /nfs/dbraw/zinc/21/88/71/336218871.db2.gz UBJNWSNFBDYTCH-HOCLYGCPSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1c(Cl)cccc1C[N@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000352441202 336218872 /nfs/dbraw/zinc/21/88/72/336218872.db2.gz UBJNWSNFBDYTCH-HOCLYGCPSA-N 1 2 309.812 4.013 20 0 DIADLO Cc1[nH+]c2ccccc2n1CC(=O)Nc1csc2ccccc12 ZINC000352597848 336226229 /nfs/dbraw/zinc/22/62/29/336226229.db2.gz LQUXAPJYHKGDNJ-UHFFFAOYSA-N 1 2 321.405 4.198 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)Cc2cc(F)ccc2C)cs1 ZINC000352619140 336227358 /nfs/dbraw/zinc/22/73/58/336227358.db2.gz ZJFUWHOAFZPZSG-CYBMUJFWSA-N 1 2 322.449 4.320 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)Cc2cc(F)ccc2C)cs1 ZINC000352619140 336227359 /nfs/dbraw/zinc/22/73/59/336227359.db2.gz ZJFUWHOAFZPZSG-CYBMUJFWSA-N 1 2 322.449 4.320 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)Cc2cc(F)ccc2C)cs1 ZINC000352619141 336227392 /nfs/dbraw/zinc/22/73/92/336227392.db2.gz ZJFUWHOAFZPZSG-ZDUSSCGKSA-N 1 2 322.449 4.320 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)Cc2cc(F)ccc2C)cs1 ZINC000352619141 336227393 /nfs/dbraw/zinc/22/73/93/336227393.db2.gz ZJFUWHOAFZPZSG-ZDUSSCGKSA-N 1 2 322.449 4.320 20 0 DIADLO COCc1nc(C[N@H+](Cc2ccc(C)s2)C(C)C)cs1 ZINC000352720826 336232348 /nfs/dbraw/zinc/23/23/48/336232348.db2.gz XHHQPEWVQRPNPE-UHFFFAOYSA-N 1 2 310.488 4.070 20 0 DIADLO COCc1nc(C[N@@H+](Cc2ccc(C)s2)C(C)C)cs1 ZINC000352720826 336232349 /nfs/dbraw/zinc/23/23/49/336232349.db2.gz XHHQPEWVQRPNPE-UHFFFAOYSA-N 1 2 310.488 4.070 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](c2cccc(F)c2)c2ccccn2)cn1 ZINC000352741953 336232606 /nfs/dbraw/zinc/23/26/06/336232606.db2.gz KJHDBZGUXYXZME-FQEVSTJZSA-N 1 2 321.399 4.057 20 0 DIADLO Cc1ccc(CNC(=O)c2cccc(Oc3cc[nH+]cc3)c2)s1 ZINC000352764247 336233683 /nfs/dbraw/zinc/23/36/83/336233683.db2.gz VZQSLQHDOZVGQN-UHFFFAOYSA-N 1 2 324.405 4.174 20 0 DIADLO O=C(Nc1cccc(F)c1)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000352767232 336234044 /nfs/dbraw/zinc/23/40/44/336234044.db2.gz FKNXQZZUZCDLEI-UHFFFAOYSA-N 1 2 308.312 4.265 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1csc(C(C)C)n1 ZINC000103171869 336238170 /nfs/dbraw/zinc/23/81/70/336238170.db2.gz WLHUNKYFQHFWAT-UHFFFAOYSA-N 1 2 304.459 4.300 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+]Cc2ccc(C(C)(C)C)cc2)s1 ZINC000532329069 336240748 /nfs/dbraw/zinc/24/07/48/336240748.db2.gz VKNQDEADTBNJHX-UHFFFAOYSA-N 1 2 317.502 4.423 20 0 DIADLO CCCc1nc(C[NH2+]C(CC)(CC)c2ccc(Cl)cc2)no1 ZINC000103480388 336241964 /nfs/dbraw/zinc/24/19/64/336241964.db2.gz OQASAUJRCRNJFS-UHFFFAOYSA-N 1 2 321.852 4.481 20 0 DIADLO CCCc1noc(C[NH+](Cc2ccccc2)Cc2ccccc2)n1 ZINC000042622991 336241970 /nfs/dbraw/zinc/24/19/70/336241970.db2.gz KVTYKDGQAKPVCX-UHFFFAOYSA-N 1 2 321.424 4.225 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)cc1C ZINC000580389131 336263239 /nfs/dbraw/zinc/26/32/39/336263239.db2.gz MBVOLDHFKFWOAQ-YLJYHZDGSA-N 1 2 319.452 4.477 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc2oc(CC(C)(C)C)nc2c1 ZINC000417970787 336263271 /nfs/dbraw/zinc/26/32/71/336263271.db2.gz QWZKGIKOVRBFTI-UHFFFAOYSA-N 1 2 312.417 4.245 20 0 DIADLO CC(C)(C)[N@H+](Cc1ccno1)Cc1ccccc1Br ZINC000532649092 336265833 /nfs/dbraw/zinc/26/58/33/336265833.db2.gz PPRABICACZPMSQ-UHFFFAOYSA-N 1 2 323.234 4.238 20 0 DIADLO CC(C)(C)[N@@H+](Cc1ccno1)Cc1ccccc1Br ZINC000532649092 336265834 /nfs/dbraw/zinc/26/58/34/336265834.db2.gz PPRABICACZPMSQ-UHFFFAOYSA-N 1 2 323.234 4.238 20 0 DIADLO CCc1cnc(C[N@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)o1 ZINC000532726738 336268607 /nfs/dbraw/zinc/26/86/07/336268607.db2.gz QPCHDCQLZAIKTM-UHFFFAOYSA-N 1 2 321.424 4.316 20 0 DIADLO CCc1cnc(C[N@@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)o1 ZINC000532726738 336268608 /nfs/dbraw/zinc/26/86/08/336268608.db2.gz QPCHDCQLZAIKTM-UHFFFAOYSA-N 1 2 321.424 4.316 20 0 DIADLO Brc1ccc(C[N@@H+]2CCc3sccc3C2)s1 ZINC000043680336 336270686 /nfs/dbraw/zinc/27/06/86/336270686.db2.gz MIASKUGQBLTTFB-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO Brc1ccc(C[N@H+]2CCc3sccc3C2)s1 ZINC000043680336 336270687 /nfs/dbraw/zinc/27/06/87/336270687.db2.gz MIASKUGQBLTTFB-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(O)cc(C(F)(F)F)c1)c1nccs1 ZINC000352838281 336273617 /nfs/dbraw/zinc/27/36/17/336273617.db2.gz LTEADRJZXITBLD-LBPRGKRZSA-N 1 2 316.348 4.108 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(O)cc(C(F)(F)F)c1)c1nccs1 ZINC000352838280 336273644 /nfs/dbraw/zinc/27/36/44/336273644.db2.gz LTEADRJZXITBLD-GFCCVEGCSA-N 1 2 316.348 4.108 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2cscc2C(F)(F)F)s1 ZINC000352848502 336278291 /nfs/dbraw/zinc/27/82/91/336278291.db2.gz VWZZMZNHOCFJTO-UHFFFAOYSA-N 1 2 321.393 4.032 20 0 DIADLO COc1ccc2c(c1)CCC[C@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000325066760 336278515 /nfs/dbraw/zinc/27/85/15/336278515.db2.gz VTYPTPWGRXUMLR-LJQANCHMSA-N 1 2 323.440 4.180 20 0 DIADLO CCc1nc(C[NH2+]Cc2cscc2C(F)(F)F)cs1 ZINC000352851679 336279647 /nfs/dbraw/zinc/27/96/47/336279647.db2.gz IRTMKGYBTVXGRN-UHFFFAOYSA-N 1 2 306.378 4.076 20 0 DIADLO CCOc1ccccc1N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000192900336 336282370 /nfs/dbraw/zinc/28/23/70/336282370.db2.gz PQOKPXYIOTTZBV-HNNXBMFYSA-N 1 2 307.397 4.444 20 0 DIADLO CC(C)c1nc2n(n1)CCC[C@@H]2[NH2+][C@@H](C)c1cc2ccccc2o1 ZINC000168037228 336285854 /nfs/dbraw/zinc/28/58/54/336285854.db2.gz OBSSVFVEXKTAJB-ZFWWWQNUSA-N 1 2 324.428 4.333 20 0 DIADLO CCOc1cc(CNc2ccc3ccccc3[nH+]2)ccc1OC ZINC000301088740 336289427 /nfs/dbraw/zinc/28/94/27/336289427.db2.gz LGQWNORABAKDRX-UHFFFAOYSA-N 1 2 308.381 4.254 20 0 DIADLO Cc1cc([C@@H](C)Nc2cc(C)[nH+]c(-c3cccnc3)n2)c(C)o1 ZINC000301108599 336290323 /nfs/dbraw/zinc/29/03/23/336290323.db2.gz QMYMSWKFCACATI-CYBMUJFWSA-N 1 2 308.385 4.230 20 0 DIADLO c1ccc2[nH+]c(NCc3cccc4c3OCCCO4)ccc2c1 ZINC000301114944 336290783 /nfs/dbraw/zinc/29/07/83/336290783.db2.gz VTBBWEOQBBQYLK-UHFFFAOYSA-N 1 2 306.365 4.008 20 0 DIADLO CCN(CC)c1ccc(CNc2nc3ccccc3s2)c[nH+]1 ZINC000301119355 336290898 /nfs/dbraw/zinc/29/08/98/336290898.db2.gz VRYGONKNUGGDKO-UHFFFAOYSA-N 1 2 312.442 4.150 20 0 DIADLO Cc1cc(NCc2cc3ccccc3o2)nc(-c2cccnc2)[nH+]1 ZINC000301122499 336291142 /nfs/dbraw/zinc/29/11/42/336291142.db2.gz SMANZNUUIFNOSP-UHFFFAOYSA-N 1 2 316.364 4.205 20 0 DIADLO Brc1cccc2c(NCc3ccccn3)cc[nH+]c12 ZINC000301154538 336292274 /nfs/dbraw/zinc/29/22/74/336292274.db2.gz FOKIMBNTOXYQRE-UHFFFAOYSA-N 1 2 314.186 4.004 20 0 DIADLO CCc1cc(N2CCC[C@@H]2C2CCCC2)nc(-c2ccncc2)[nH+]1 ZINC000301153968 336292330 /nfs/dbraw/zinc/29/23/30/336292330.db2.gz ABZJLUWWDNBDFQ-GOSISDBHSA-N 1 2 322.456 4.260 20 0 DIADLO Cc1cc(NCCc2csc(C(C)C)n2)nc(C(C)C)[nH+]1 ZINC000301164450 336292765 /nfs/dbraw/zinc/29/27/65/336292765.db2.gz IEYRVDOWUDTRAL-UHFFFAOYSA-N 1 2 304.463 4.143 20 0 DIADLO CCc1cc(NCc2ccc(C)cc2)nc(-c2ccncc2)[nH+]1 ZINC000301167002 336292844 /nfs/dbraw/zinc/29/28/44/336292844.db2.gz IDTZZRBTZRCCBV-UHFFFAOYSA-N 1 2 304.397 4.022 20 0 DIADLO Cc1ccc(CNc2nc(-c3ccncc3)[nH+]c(C)c2C)cc1 ZINC000301192712 336294285 /nfs/dbraw/zinc/29/42/85/336294285.db2.gz XJVORTXVJXEOQD-UHFFFAOYSA-N 1 2 304.397 4.076 20 0 DIADLO COc1ccc([C@@H](Nc2cc(C)[nH+]cn2)c2ccc(F)cc2)cc1 ZINC000301221699 336295435 /nfs/dbraw/zinc/29/54/35/336295435.db2.gz ARYCENVGLIPQNY-IBGZPJMESA-N 1 2 323.371 4.134 20 0 DIADLO CC(C)c1nc(NCc2ccc(F)cc2Br)cc[nH+]1 ZINC000301222532 336295561 /nfs/dbraw/zinc/29/55/61/336295561.db2.gz BHCNZQOBTZYIMR-UHFFFAOYSA-N 1 2 324.197 4.114 20 0 DIADLO CC(C)c1nc(N[C@@H]2CCOc3c(Cl)cccc32)cc[nH+]1 ZINC000301234868 336296130 /nfs/dbraw/zinc/29/61/30/336296130.db2.gz JUNYPAYHTNDJKP-CYBMUJFWSA-N 1 2 303.793 4.189 20 0 DIADLO CC1CC[NH+](c2ccc(Nc3ccc4nccnc4n3)cc2)CC1 ZINC000301300143 336299719 /nfs/dbraw/zinc/29/97/19/336299719.db2.gz ZOPXAJJYARDKEH-UHFFFAOYSA-N 1 2 319.412 4.005 20 0 DIADLO Cc1cc(N[C@H](Cc2ccccc2)c2ccccc2F)nc[nH+]1 ZINC000301373212 336303113 /nfs/dbraw/zinc/30/31/13/336303113.db2.gz USBPVNJDWYIXLR-GOSISDBHSA-N 1 2 307.372 4.320 20 0 DIADLO Cc1cc(NCc2coc(-c3ccccc3)n2)nc(C(C)C)[nH+]1 ZINC000301398423 336304428 /nfs/dbraw/zinc/30/44/28/336304428.db2.gz AQGWSPSQMPRTIC-UHFFFAOYSA-N 1 2 308.385 4.176 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CCC(c3ccccc3)CC2)c1 ZINC000301432832 336306444 /nfs/dbraw/zinc/30/64/44/336306444.db2.gz HSQYADOPAHEBMI-UHFFFAOYSA-N 1 2 306.331 4.484 20 0 DIADLO c1ccc([C@H]2OCC[C@@H]2CNc2ccc3ccccc3[nH+]2)cc1 ZINC000301442467 336307037 /nfs/dbraw/zinc/30/70/37/336307037.db2.gz UTUMMZZRAONZPW-YLJYHZDGSA-N 1 2 304.393 4.425 20 0 DIADLO Cc1nc(Nc2ccc(NC(=O)CC(C)C)cc2)c(C)c(C)[nH+]1 ZINC000301443129 336307089 /nfs/dbraw/zinc/30/70/89/336307089.db2.gz NZPVTKUBGYZOCF-UHFFFAOYSA-N 1 2 312.417 4.130 20 0 DIADLO Cc1cc([C@@H](C)Nc2cc(N3CCCCC3)nc[nH+]2)c(C)s1 ZINC000301504975 336311125 /nfs/dbraw/zinc/31/11/25/336311125.db2.gz GLWOSASFCVBKDJ-CYBMUJFWSA-N 1 2 316.474 4.318 20 0 DIADLO Cc1cc([C@@H](C)Nc2cc(N3CCCCC3)[nH+]cn2)c(C)s1 ZINC000301504975 336311126 /nfs/dbraw/zinc/31/11/26/336311126.db2.gz GLWOSASFCVBKDJ-CYBMUJFWSA-N 1 2 316.474 4.318 20 0 DIADLO CC(C)(C)c1nc(NC[C@H](O)c2ccc3ccccc3c2)cc[nH+]1 ZINC000301523220 336312266 /nfs/dbraw/zinc/31/22/66/336312266.db2.gz MFMASGBRFAVAKM-KRWDZBQOSA-N 1 2 321.424 4.073 20 0 DIADLO CC(C)(C)c1nc(NCc2coc(-c3cccs3)n2)cc[nH+]1 ZINC000301565740 336315279 /nfs/dbraw/zinc/31/52/79/336315279.db2.gz ZBKADOKUTAYLHQ-UHFFFAOYSA-N 1 2 314.414 4.103 20 0 DIADLO Cc1cccc([C@H]2CCCN2c2cc(N3CCCCC3)[nH+]cn2)c1 ZINC000301566777 336315448 /nfs/dbraw/zinc/31/54/48/336315448.db2.gz ZLTPITKKJFWPBB-GOSISDBHSA-N 1 2 322.456 4.117 20 0 DIADLO Cc1cccc([C@H]2CCCN2c2cc(N3CCCCC3)nc[nH+]2)c1 ZINC000301566777 336315449 /nfs/dbraw/zinc/31/54/49/336315449.db2.gz ZLTPITKKJFWPBB-GOSISDBHSA-N 1 2 322.456 4.117 20 0 DIADLO C[C@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1ccc(-n2cccn2)cc1 ZINC000301583758 336316357 /nfs/dbraw/zinc/31/63/57/336316357.db2.gz OGFIFWNELBZELZ-AWEZNQCLSA-N 1 2 321.428 4.133 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CC[C@@H](Nc2ccccc2)C1 ZINC000301581931 336316422 /nfs/dbraw/zinc/31/64/22/336316422.db2.gz SXOMNCAHRFMGMA-GOSISDBHSA-N 1 2 303.409 4.234 20 0 DIADLO Cc1cc(N[C@@H](COc2ccccc2F)c2ccccc2)nc[nH+]1 ZINC000301595050 336317086 /nfs/dbraw/zinc/31/70/86/336317086.db2.gz YVWJMSVHRSLXOE-KRWDZBQOSA-N 1 2 323.371 4.156 20 0 DIADLO Cc1cc(NCc2csc(C(C)(C)C)n2)nc(C(C)C)[nH+]1 ZINC000301620827 336318786 /nfs/dbraw/zinc/31/87/86/336318786.db2.gz FCAFXXRAHMJGBT-UHFFFAOYSA-N 1 2 304.463 4.275 20 0 DIADLO Cc1cc(N[C@H](c2cccc(Cl)c2)c2ccccn2)nc[nH+]1 ZINC000301642850 336320300 /nfs/dbraw/zinc/32/03/00/336320300.db2.gz HAOWSOCWMKRLLR-QGZVFWFLSA-N 1 2 310.788 4.035 20 0 DIADLO Cc1cc(N[C@@H]2CCC[C@H]3OCC[C@@H]32)c2cccc(F)c2[nH+]1 ZINC000301653749 336320973 /nfs/dbraw/zinc/32/09/73/336320973.db2.gz ABDDRIUSKYNAMX-SRCQZFHVSA-N 1 2 300.377 4.052 20 0 DIADLO Cc1ccn(-c2ccccc2CNc2cc(C)[nH+]c(C(C)C)n2)n1 ZINC000301678515 336322981 /nfs/dbraw/zinc/32/29/81/336322981.db2.gz DOENNWBUNSXVBC-UHFFFAOYSA-N 1 2 321.428 4.015 20 0 DIADLO CCc1noc(CC)c1CNc1cc(C)[nH+]c2c(F)cccc12 ZINC000301682278 336323106 /nfs/dbraw/zinc/32/31/06/336323106.db2.gz SGMBMBATQHCDNF-UHFFFAOYSA-N 1 2 313.376 4.407 20 0 DIADLO COC[C@@H](Nc1cc(C)[nH+]c2c(F)cccc12)c1ccc(C)o1 ZINC000301685015 336323368 /nfs/dbraw/zinc/32/33/68/336323368.db2.gz UECIQWSOXROKFS-MRXNPFEDSA-N 1 2 314.360 4.383 20 0 DIADLO Cc1nc(Nc2cccc(COCc3ccco3)c2)c(C)c(C)[nH+]1 ZINC000301696257 336324024 /nfs/dbraw/zinc/32/40/24/336324024.db2.gz PTXULXOXVIZGIZ-UHFFFAOYSA-N 1 2 323.396 4.455 20 0 DIADLO Cc1cc(N[C@H]2CCOC3(CCCCC3)C2)nc(C(C)C)[nH+]1 ZINC000301698358 336324099 /nfs/dbraw/zinc/32/40/99/336324099.db2.gz OJHRFXQUQZCJLM-HNNXBMFYSA-N 1 2 303.450 4.202 20 0 DIADLO Cc1cc(CN(C)c2cc(C(C)(C)C)[nH+]c(C(C)(C)C)n2)no1 ZINC000301712684 336325005 /nfs/dbraw/zinc/32/50/05/336325005.db2.gz FHJHPLNQNZULET-UHFFFAOYSA-N 1 2 316.449 4.004 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N[C@H]1CCO[C@@]2(CCSC2)C1 ZINC000301718181 336325393 /nfs/dbraw/zinc/32/53/93/336325393.db2.gz LHYCQEILEUYSBI-YJBOKZPZSA-N 1 2 314.454 4.010 20 0 DIADLO Cc1cc(N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c2cccc(F)c2[nH+]1 ZINC000301795961 336330445 /nfs/dbraw/zinc/33/04/45/336330445.db2.gz ACIZFMJWYQHCBL-VHSSKADRSA-N 1 2 312.388 4.052 20 0 DIADLO CC(C)c1cc(N[C@H](CCO)c2cccs2)nc(C(C)C)[nH+]1 ZINC000301816162 336331936 /nfs/dbraw/zinc/33/19/36/336331936.db2.gz JBZDLDMDQKMNMG-CYBMUJFWSA-N 1 2 319.474 4.321 20 0 DIADLO CC(C)c1cc(NC[C@@](C)(O)c2ccsc2)nc(C(C)C)[nH+]1 ZINC000301829644 336332859 /nfs/dbraw/zinc/33/28/59/336332859.db2.gz RFGDCVHHMNOXJP-QGZVFWFLSA-N 1 2 319.474 4.105 20 0 DIADLO CC(C)c1cc(N[C@@H](C)C[C@H](O)c2ccco2)nc(C(C)C)[nH+]1 ZINC000301846555 336333858 /nfs/dbraw/zinc/33/38/58/336333858.db2.gz BADGXVDYBFUJSD-ZFWWWQNUSA-N 1 2 317.433 4.241 20 0 DIADLO Nc1nc(N2CCC[C@@H]2c2ccccc2Cl)[nH+]c2ccccc12 ZINC000301858031 336334523 /nfs/dbraw/zinc/33/45/23/336334523.db2.gz DPALZYDAEUFWJS-MRXNPFEDSA-N 1 2 324.815 4.207 20 0 DIADLO CC(C)c1cc(N[C@@H]2[C@H]3CCO[C@H]3C23CCC3)nc(C(C)C)[nH+]1 ZINC000301875376 336335689 /nfs/dbraw/zinc/33/56/89/336335689.db2.gz RQOPFXAIXBHOMP-KBRIMQKVSA-N 1 2 315.461 4.093 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2N[C@@H](c1ccccc1)C1CC1 ZINC000301906709 336337536 /nfs/dbraw/zinc/33/75/36/336337536.db2.gz ZGRYNCQKERIPBV-INIZCTEOSA-N 1 2 321.428 4.145 20 0 DIADLO CC[C@H](Nc1nc(N)c2ccccc2[nH+]1)c1ccc(F)cc1F ZINC000301914647 336337794 /nfs/dbraw/zinc/33/77/94/336337794.db2.gz UZFRECQIFJSDMY-AWEZNQCLSA-N 1 2 314.339 4.053 20 0 DIADLO Clc1ccccc1C1=CCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000301917997 336338081 /nfs/dbraw/zinc/33/80/81/336338081.db2.gz HWODJGIEGUYKCN-UHFFFAOYSA-N 1 2 311.816 4.301 20 0 DIADLO Clc1ccc2ccc(NCCCn3cc[nH+]c3)nc2c1Cl ZINC000301974100 336340721 /nfs/dbraw/zinc/34/07/21/336340721.db2.gz AMQVOFBPGHUGAA-UHFFFAOYSA-N 1 2 321.211 4.240 20 0 DIADLO Cc1cc(NCCCOCC(F)(F)F)c2cccc(F)c2[nH+]1 ZINC000301982314 336341259 /nfs/dbraw/zinc/34/12/59/336341259.db2.gz JQHGXTDWCYSHAA-UHFFFAOYSA-N 1 2 316.298 4.063 20 0 DIADLO Cc1nc(NCc2nc(C(C)(C)C)cs2)c2c([nH+]1)CCCC2 ZINC000302047634 336345413 /nfs/dbraw/zinc/34/54/13/336345413.db2.gz LTLJAPASCIZGOP-UHFFFAOYSA-N 1 2 316.474 4.030 20 0 DIADLO COc1ccc2[nH+]c(NC[C@H](C)c3ncc(C)s3)ccc2c1 ZINC000302160923 336351500 /nfs/dbraw/zinc/35/15/00/336351500.db2.gz YHWGVJCIDTXDKL-NSHDSACASA-N 1 2 313.426 4.224 20 0 DIADLO Cc1cc(N2CC[C@H](c3c(F)cccc3F)C2)nc(C(C)C)[nH+]1 ZINC000302208943 336354004 /nfs/dbraw/zinc/35/40/04/336354004.db2.gz BNMOTIQAVBXCMO-ZDUSSCGKSA-N 1 2 317.383 4.181 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CC[C@@]2(C1)OCc1ccccc12 ZINC000302251900 336356239 /nfs/dbraw/zinc/35/62/39/336356239.db2.gz NFYDIAOBPGPHCN-NRFANRHFSA-N 1 2 316.404 4.179 20 0 DIADLO Fc1cccc([C@@H]2C[N@H+](Cc3cc4ccccc4o3)CCO2)c1 ZINC000514105727 336357696 /nfs/dbraw/zinc/35/76/96/336357696.db2.gz SWANOCOJKHMHKM-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO Fc1cccc([C@@H]2C[N@@H+](Cc3cc4ccccc4o3)CCO2)c1 ZINC000514105727 336357697 /nfs/dbraw/zinc/35/76/97/336357697.db2.gz SWANOCOJKHMHKM-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO COc1cccc2c(NC[C@@H](C)c3ncc(C)s3)cc[nH+]c12 ZINC000302494075 336360014 /nfs/dbraw/zinc/36/00/14/336360014.db2.gz AUZYQCIWCOFWFC-LLVKDONJSA-N 1 2 313.426 4.224 20 0 DIADLO CCCO[C@H]1CCCN(c2cc[nH+]c3c(OC)cccc23)CC1 ZINC000302499715 336360173 /nfs/dbraw/zinc/36/01/73/336360173.db2.gz CKUISYYDOXXMFE-HNNXBMFYSA-N 1 2 314.429 4.029 20 0 DIADLO CC(C)c1cc(N2CCC([C@@H]3CCCO3)CC2)nc(C(C)C)[nH+]1 ZINC000302556970 336361519 /nfs/dbraw/zinc/36/15/19/336361519.db2.gz LTZQXEFCCDKZKV-KRWDZBQOSA-N 1 2 317.477 4.119 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCNc1ccnc2c(F)cccc12 ZINC000302667156 336364066 /nfs/dbraw/zinc/36/40/66/336364066.db2.gz JRBUBLRPVNAXJL-UHFFFAOYSA-N 1 2 320.371 4.144 20 0 DIADLO COc1cc(Br)ccc1[C@@H](C)Nc1cccc[nH+]1 ZINC000302741401 336367407 /nfs/dbraw/zinc/36/74/07/336367407.db2.gz CXULVBQHVJMIRB-SNVBAGLBSA-N 1 2 307.191 4.026 20 0 DIADLO CC(C)c1nc(NC2C[C@@H](C)O[C@H](C)C2)cc(C(C)(C)C)[nH+]1 ZINC000302826874 336370913 /nfs/dbraw/zinc/37/09/13/336370913.db2.gz HMVULGNDNRJKAV-CHWSQXEVSA-N 1 2 305.466 4.265 20 0 DIADLO CC(C)c1nc(NC2C[C@H](C)O[C@@H](C)C2)cc(C(C)(C)C)[nH+]1 ZINC000302826875 336370935 /nfs/dbraw/zinc/37/09/35/336370935.db2.gz HMVULGNDNRJKAV-STQMWFEESA-N 1 2 305.466 4.265 20 0 DIADLO CC(C)c1nc(N[C@H]2CCO[C@@H](C3CC3)C2)cc(C(C)(C)C)[nH+]1 ZINC000302840298 336371615 /nfs/dbraw/zinc/37/16/15/336371615.db2.gz LKTYEVLKAPHISH-LSDHHAIUSA-N 1 2 317.477 4.267 20 0 DIADLO COC[C@H](Nc1cc(C(C)(C)C)[nH+]c(C(C)C)n1)c1ccco1 ZINC000302881469 336373091 /nfs/dbraw/zinc/37/30/91/336373091.db2.gz HZHQIMYVPVLUJE-ZDUSSCGKSA-N 1 2 317.433 4.290 20 0 DIADLO COc1ccc2c(c1)[C@H](Nc1ccc(N3CCCCC3)[nH+]c1)CC2 ZINC000392033237 336374595 /nfs/dbraw/zinc/37/45/95/336374595.db2.gz IJIVIKOTTAUSSD-LJQANCHMSA-N 1 2 323.440 4.180 20 0 DIADLO Fc1ccc(CNc2cc[nH+]c(C3CC3)n2)c(C(F)(F)F)c1 ZINC000110204170 336395976 /nfs/dbraw/zinc/39/59/76/336395976.db2.gz ANQHWCKQADSDFX-UHFFFAOYSA-N 1 2 311.282 4.124 20 0 DIADLO Cc1ccc(OC2CCN(c3cc[nH+]c(C4CC4)n3)CC2)cc1C ZINC000110230442 336396028 /nfs/dbraw/zinc/39/60/28/336396028.db2.gz MJKNNXQOWBKEEC-UHFFFAOYSA-N 1 2 323.440 4.019 20 0 DIADLO C/C=C\c1ccc(NC(=O)N2CCCC[C@@H]2c2[nH]cc[nH+]2)cc1 ZINC000353202426 336406433 /nfs/dbraw/zinc/40/64/33/336406433.db2.gz JGTBQBFZUFYKLR-SVERHTFXSA-N 1 2 310.401 4.202 20 0 DIADLO C[C@@H]([NH2+]Cc1nccn1C(F)F)c1cc2cccc(F)c2o1 ZINC000353241492 336407883 /nfs/dbraw/zinc/40/78/83/336407883.db2.gz WGBSFWRDGCAZRN-SECBINFHSA-N 1 2 309.291 4.014 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccc(Oc3ccccc3)nc2)no1 ZINC000353391424 336415047 /nfs/dbraw/zinc/41/50/47/336415047.db2.gz XHVPUARJORYTCV-CQSZACIVSA-N 1 2 309.369 4.021 20 0 DIADLO CCOCc1nc([C@H](C)[NH2+][C@H](CC)c2cccc(Cl)c2)no1 ZINC000353604806 336428152 /nfs/dbraw/zinc/42/81/52/336428152.db2.gz AJCVZVZDRNTKGY-SMDDNHRTSA-N 1 2 323.824 4.061 20 0 DIADLO OCCSCc1cc[nH+]c(NC2CCC3(CCCC3)CC2)c1 ZINC000353673902 336433959 /nfs/dbraw/zinc/43/39/59/336433959.db2.gz DMFJGOBPNVOKRV-UHFFFAOYSA-N 1 2 320.502 4.222 20 0 DIADLO COc1c(C)cc(CNc2ccc(-n3cc[nH+]c3)cc2)cc1C ZINC000353717323 336436394 /nfs/dbraw/zinc/43/63/94/336436394.db2.gz MQADVHJQFJMFNT-UHFFFAOYSA-N 1 2 307.397 4.110 20 0 DIADLO Cc1ccc(CCCNc2cccc(Oc3cnccn3)c2)c[nH+]1 ZINC000353792013 336440542 /nfs/dbraw/zinc/44/05/42/336440542.db2.gz MATCVAFEHOJDPT-UHFFFAOYSA-N 1 2 320.396 4.017 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccccc1OC ZINC000353924524 336448708 /nfs/dbraw/zinc/44/87/08/336448708.db2.gz SKWWTIBFZYNCKO-ABAIWWIYSA-N 1 2 306.356 4.170 20 0 DIADLO CCO[C@H]1C[C@@H](Nc2[nH+]ccc3ccc(F)cc32)C12CCC2 ZINC000354329979 336467075 /nfs/dbraw/zinc/46/70/75/336467075.db2.gz VDYJFXJOLIHBGO-CVEARBPZSA-N 1 2 300.377 4.134 20 0 DIADLO Fc1ccc2cc[nH+]c(N[C@H]3CCCC[C@@H]3n3cccn3)c2c1 ZINC000354533391 336473908 /nfs/dbraw/zinc/47/39/08/336473908.db2.gz DXPZLQFXYXEGAX-IRXDYDNUSA-N 1 2 310.376 4.166 20 0 DIADLO Fc1ccc2cc[nH+]c(NCc3cccc4c3OCCCO4)c2c1 ZINC000354855133 336485108 /nfs/dbraw/zinc/48/51/08/336485108.db2.gz UNXIIYHOQJAACK-UHFFFAOYSA-N 1 2 324.355 4.147 20 0 DIADLO Fc1ccc2cc[nH+]c(N3CCc4ccc(F)c(F)c4C3)c2c1 ZINC000354873970 336485854 /nfs/dbraw/zinc/48/58/54/336485854.db2.gz FPDCFVVIGSPWNI-UHFFFAOYSA-N 1 2 314.310 4.215 20 0 DIADLO Fc1ccc2cc[nH+]c(N[C@H]3CCOC4(CCCC4)C3)c2c1 ZINC000354881069 336486196 /nfs/dbraw/zinc/48/61/96/336486196.db2.gz PZOKPGMAOORNSC-HNNXBMFYSA-N 1 2 300.377 4.278 20 0 DIADLO c1ccc(N2Cc3cccc(N[C@H]4CCC[C@H]5C[C@H]54)c3C2)[nH+]c1 ZINC000367188946 336488386 /nfs/dbraw/zinc/48/83/86/336488386.db2.gz WUUNEMSXOVCVGW-LESCRADOSA-N 1 2 305.425 4.202 20 0 DIADLO CC(C)CN(CC(C)(C)C)C(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000355109804 336494915 /nfs/dbraw/zinc/49/49/15/336494915.db2.gz LFSZRLNVHXGOES-UHFFFAOYSA-N 1 2 313.445 4.017 20 0 DIADLO CCc1cnc(C[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)s1 ZINC000355332206 336504482 /nfs/dbraw/zinc/50/44/82/336504482.db2.gz HLYZNGXSEOEIAN-LJQANCHMSA-N 1 2 323.465 4.288 20 0 DIADLO Cc1occc1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000355400055 336507286 /nfs/dbraw/zinc/50/72/86/336507286.db2.gz OMUNMARJPNKUIK-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO C[C@@H]1C[C@@H](C)[C@@H](C)N(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000355935131 336528878 /nfs/dbraw/zinc/52/88/78/336528878.db2.gz QQLQZLMQBVXPFT-BZUAXINKSA-N 1 2 324.424 4.381 20 0 DIADLO Cc1ccc(Cc2noc(-c3cc4c(ccc(C)c4C)[nH]3)n2)c[nH+]1 ZINC000356115619 336536463 /nfs/dbraw/zinc/53/64/63/336536463.db2.gz SWNLCWTXNIZRSC-UHFFFAOYSA-N 1 2 318.380 4.129 20 0 DIADLO Cc1ccc(Cc2noc(-c3ccc(C(F)(F)F)cc3)n2)c[nH+]1 ZINC000356117346 336536527 /nfs/dbraw/zinc/53/65/27/336536527.db2.gz WIZKWSMWKVUOIP-UHFFFAOYSA-N 1 2 319.286 4.050 20 0 DIADLO Cc1c2ccccc2oc1-c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000356140646 336538057 /nfs/dbraw/zinc/53/80/57/336538057.db2.gz CHSJZOSFBNSPBT-UHFFFAOYSA-N 1 2 305.337 4.085 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1cccnc1)c1ccc(F)cn1 ZINC000356682611 336558083 /nfs/dbraw/zinc/55/80/83/336558083.db2.gz SERFTGIEUMUUSH-KUHUBIRLSA-N 1 2 307.372 4.056 20 0 DIADLO C[C@@H](c1noc(-c2[nH+]c(C3CC3)n3ccccc23)n1)C(C)(C)C ZINC000356880011 336564514 /nfs/dbraw/zinc/56/45/14/336564514.db2.gz LHUDVMGLATYCTO-NSHDSACASA-N 1 2 310.401 4.411 20 0 DIADLO COCc1cc(N2CCC(C)(C)CC2)c2cc(F)ccc2[nH+]1 ZINC000357266087 336578692 /nfs/dbraw/zinc/57/86/92/336578692.db2.gz UMAIMSHXWGNOSL-UHFFFAOYSA-N 1 2 302.393 4.147 20 0 DIADLO COCc1cc(N2Cc3ccc(C)cc3C2)c2cc(F)ccc2[nH+]1 ZINC000357662224 336593680 /nfs/dbraw/zinc/59/36/80/336593680.db2.gz OILXTIFCQWZESI-UHFFFAOYSA-N 1 2 322.383 4.349 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H]2CCSc3ccc(F)cc32)s1 ZINC000358295177 336622273 /nfs/dbraw/zinc/62/22/73/336622273.db2.gz ZCBJQEHOIVOIOK-GFCCVEGCSA-N 1 2 323.462 4.127 20 0 DIADLO Cc1ccc(-n2cnnc2SCc2ccc(C)[nH+]c2C)c(C)c1 ZINC000358608405 336636664 /nfs/dbraw/zinc/63/66/64/336636664.db2.gz FYZVXIHRRLGRIC-UHFFFAOYSA-N 1 2 324.453 4.188 20 0 DIADLO C[C@H](CSCc1ccc(-n2cc[nH+]c2)cc1)C(F)(F)F ZINC000359047126 336655156 /nfs/dbraw/zinc/65/51/56/336655156.db2.gz MZZYQCYVFAPDMH-LLVKDONJSA-N 1 2 300.349 4.304 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)s1 ZINC000359254147 336664580 /nfs/dbraw/zinc/66/45/80/336664580.db2.gz ZKBPRMPCNFQXSQ-CQSZACIVSA-N 1 2 313.829 4.126 20 0 DIADLO Cn1c2ccc(NC(=O)[C@@H]3CCC(C)(C)C3)cc2[nH+]c1C1CC1 ZINC000359426595 336672448 /nfs/dbraw/zinc/67/24/48/336672448.db2.gz VJACOWTUDBSWLV-CYBMUJFWSA-N 1 2 311.429 4.216 20 0 DIADLO CCN(C)c1ccc(CNc2cccc(-c3ncc(C)o3)c2)c[nH+]1 ZINC000359669657 336682578 /nfs/dbraw/zinc/68/25/78/336682578.db2.gz GLEQTOHNCWJRKH-UHFFFAOYSA-N 1 2 322.412 4.113 20 0 DIADLO CC[C@@H](C)n1ncc(NCc2c[nH+]c(C)n2-c2ccccc2)c1C ZINC000359794066 336687768 /nfs/dbraw/zinc/68/77/68/336687768.db2.gz GNBOJHNUBBCOKF-CQSZACIVSA-N 1 2 323.444 4.269 20 0 DIADLO Cc1ccncc1CN(C)c1[nH+]cccc1OCc1ccccc1 ZINC000360124223 336702330 /nfs/dbraw/zinc/70/23/30/336702330.db2.gz SFXJRXBLPPQUQN-UHFFFAOYSA-N 1 2 319.408 4.000 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCOc2c(F)ccc(F)c21)c1ccc(Cl)cn1 ZINC000361182332 336742773 /nfs/dbraw/zinc/74/27/73/336742773.db2.gz YSGZYLUNHMPGQM-LKFCYVNXSA-N 1 2 324.758 4.188 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSC[C@@H]1CCO[C@H](C)C1 ZINC000362457695 336798459 /nfs/dbraw/zinc/79/84/59/336798459.db2.gz QIZPEZGNVQFKEG-HZPDHXFCSA-N 1 2 316.470 4.229 20 0 DIADLO CC(C)n1ccnc1C[NH+]1CCC(c2c(F)cccc2F)CC1 ZINC000362592545 336805746 /nfs/dbraw/zinc/80/57/46/336805746.db2.gz UFFSEVQGFVZMST-UHFFFAOYSA-N 1 2 319.399 4.122 20 0 DIADLO Cc1cc2cc(C[NH2+]Cc3noc4c3CCCC4)oc2cc1C ZINC000367967110 336833295 /nfs/dbraw/zinc/83/32/95/336833295.db2.gz BJIZXIOABXTBRB-UHFFFAOYSA-N 1 2 310.397 4.206 20 0 DIADLO CCC1(C(=O)Nc2cccc3c2CN(c2cccc[nH+]2)C3)CCC1 ZINC000368580458 336848465 /nfs/dbraw/zinc/84/84/65/336848465.db2.gz NLUNFHGDBAWSKY-UHFFFAOYSA-N 1 2 321.424 4.121 20 0 DIADLO O=C(c1cccc(-n2cc[nH+]c2)c1)N1CCC[C@H]1C1CCCCC1 ZINC000117620486 336857110 /nfs/dbraw/zinc/85/71/10/336857110.db2.gz VAXZIZZVHGKIPF-IBGZPJMESA-N 1 2 323.440 4.057 20 0 DIADLO COc1ccccc1C[NH2+][C@H](c1ccc(C)cc1)c1ccccn1 ZINC000369545514 336866745 /nfs/dbraw/zinc/86/67/45/336866745.db2.gz HXHKMNZKKGMKSB-OAQYLSRUSA-N 1 2 318.420 4.278 20 0 DIADLO CC(C)(CC(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1)C1CCCCC1 ZINC000370043335 336876475 /nfs/dbraw/zinc/87/64/75/336876475.db2.gz QJVBJCJQIBKVQV-OAHLLOKOSA-N 1 2 317.477 4.112 20 0 DIADLO CCc1oc(C(=O)Nc2ccccc2-c2[nH]cc(C)[nH+]2)cc1C ZINC000370742820 336892585 /nfs/dbraw/zinc/89/25/85/336892585.db2.gz YTEIKFQCQMTSNL-UHFFFAOYSA-N 1 2 309.369 4.101 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cccc(C)c2C)[nH+]1 ZINC000371246625 336898532 /nfs/dbraw/zinc/89/85/32/336898532.db2.gz FWVNOROVYNUEIA-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO O=C(CCCC1CCCCC1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000120731950 336920381 /nfs/dbraw/zinc/92/03/81/336920381.db2.gz MCDXZABLJSJDLV-INIZCTEOSA-N 1 2 303.450 4.214 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000373063175 336946910 /nfs/dbraw/zinc/94/69/10/336946910.db2.gz KHTNPESGROYAEG-APWZRJJASA-N 1 2 319.493 4.123 20 0 DIADLO Cc1[nH+]cccc1Cc1nc(-c2ccccc2C(F)(F)F)no1 ZINC000582384863 336953147 /nfs/dbraw/zinc/95/31/47/336953147.db2.gz DALRNIRIEKKURW-UHFFFAOYSA-N 1 2 319.286 4.050 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](c2ccccc2)c2ccc(C)cc2C)s1 ZINC000391810641 336962689 /nfs/dbraw/zinc/96/26/89/336962689.db2.gz LPVDXCCHTZFRMY-IBGZPJMESA-N 1 2 323.465 4.343 20 0 DIADLO Cc1csc(-c2cccc(C(=O)Nc3cc[nH+]cc3C)c2)n1 ZINC000121671744 336970188 /nfs/dbraw/zinc/97/01/88/336970188.db2.gz PZCDOKUSRTUBMP-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO c1c[nH+]c([C@H]2CCCN2Cc2ccc(Oc3ccccc3)o2)[nH]1 ZINC000375351965 337008862 /nfs/dbraw/zinc/00/88/62/337008862.db2.gz GZWZYPXAYFISIM-MRXNPFEDSA-N 1 2 309.369 4.132 20 0 DIADLO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1csc(C(C)C)n1)CO2 ZINC000376317647 337031305 /nfs/dbraw/zinc/03/13/05/337031305.db2.gz AFRPUXQQKKCPFO-JSGCOSHPSA-N 1 2 302.443 4.359 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCC[C@H]2c2nccs2)c1 ZINC000376457544 337033852 /nfs/dbraw/zinc/03/38/52/337033852.db2.gz HRLCHNSLZCRUSB-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCC[C@H]2c2nccs2)c1 ZINC000376457544 337033853 /nfs/dbraw/zinc/03/38/53/337033853.db2.gz HRLCHNSLZCRUSB-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@@H]1CCc1ccccc1 ZINC000376596906 337037710 /nfs/dbraw/zinc/03/77/10/337037710.db2.gz GHFZQEQBZNGSHK-GOSISDBHSA-N 1 2 323.440 4.328 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@H](Cc2ccccc2)C1 ZINC000376619358 337038279 /nfs/dbraw/zinc/03/82/79/337038279.db2.gz VFMPVIVQYRREAP-GOSISDBHSA-N 1 2 323.440 4.185 20 0 DIADLO C[C@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1cncs1 ZINC000123171953 337038688 /nfs/dbraw/zinc/03/86/88/337038688.db2.gz KDZMFMZYTKDIBM-FZMZJTMJSA-N 1 2 301.440 4.040 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@H](c2ccccc2)C[C@H]1C ZINC000376638852 337038840 /nfs/dbraw/zinc/03/88/40/337038840.db2.gz CUVNBQYPVJVJFZ-QAPCUYQASA-N 1 2 323.440 4.498 20 0 DIADLO Cc1cc([C@H](C)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)no1 ZINC000377093966 337046720 /nfs/dbraw/zinc/04/67/20/337046720.db2.gz UMKAJANSGNKHRJ-AWEZNQCLSA-N 1 2 322.412 4.356 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)C1C[C@@H](C)C[C@H](C)C1 ZINC000377212882 337048838 /nfs/dbraw/zinc/04/88/38/337048838.db2.gz DJUPONXCEPFMPV-ZOBUZTSGSA-N 1 2 317.477 4.029 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)[C@H]1C[C@H](C)C[C@H](C)C1 ZINC000377212881 337048841 /nfs/dbraw/zinc/04/88/41/337048841.db2.gz DJUPONXCEPFMPV-LTIDMASMSA-N 1 2 317.477 4.029 20 0 DIADLO C[C@@H]1Oc2cc(F)ccc2[C@@H]1[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000377383995 337051410 /nfs/dbraw/zinc/05/14/10/337051410.db2.gz UBJSYKBAXKBTBX-KPZWWZAWSA-N 1 2 324.355 4.093 20 0 DIADLO Cc1cnc(-c2cccc(NCCCc3c[nH+]ccc3C)c2)o1 ZINC000377546165 337054773 /nfs/dbraw/zinc/05/47/73/337054773.db2.gz ZLGIZHHNYSCHLZ-UHFFFAOYSA-N 1 2 307.397 4.398 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2c1ccc(Cl)c2Cl)c1ccccn1 ZINC000378145482 337067108 /nfs/dbraw/zinc/06/71/08/337067108.db2.gz BLJAIZNRSKZPRX-RNCFNFMXSA-N 1 2 309.196 4.173 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ncoc2-c2ccccc2)o1 ZINC000378153534 337067272 /nfs/dbraw/zinc/06/72/72/337067272.db2.gz JMYPSWFIDUYMDN-CZUORRHYSA-N 1 2 308.381 4.348 20 0 DIADLO c1csc(CNc2cccc3c2CN(c2cccc[nH+]2)C3)c1 ZINC000378273727 337069111 /nfs/dbraw/zinc/06/91/11/337069111.db2.gz RUXCPBQGPBCCJJ-UHFFFAOYSA-N 1 2 307.422 4.275 20 0 DIADLO CCCCCC[C@@](C)(CC)C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000378269681 337069178 /nfs/dbraw/zinc/06/91/78/337069178.db2.gz YZCJRGSGUHQGOA-VQIMIIECSA-N 1 2 319.493 4.123 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1ccccn1 ZINC000378477934 337073741 /nfs/dbraw/zinc/07/37/41/337073741.db2.gz XLWQMPUVIANFLE-HNNXBMFYSA-N 1 2 316.408 4.170 20 0 DIADLO CCOc1cccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000193913643 337080582 /nfs/dbraw/zinc/08/05/82/337080582.db2.gz NTJNJXXHCQWEER-OAHLLOKOSA-N 1 2 307.397 4.444 20 0 DIADLO COc1cc(C)ccc1N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000193922233 337080658 /nfs/dbraw/zinc/08/06/58/337080658.db2.gz ZHQBSZKAEKSKQL-HNNXBMFYSA-N 1 2 307.397 4.362 20 0 DIADLO COc1cc(CNc2cccc(-c3[nH+]ccn3C)c2)ccc1C ZINC000194134492 337081719 /nfs/dbraw/zinc/08/17/19/337081719.db2.gz SBVNOKRZBCPGQL-UHFFFAOYSA-N 1 2 307.397 4.016 20 0 DIADLO C[C@H](NC(=O)c1cccc(Oc2cc[nH+]cc2)c1)c1cccs1 ZINC000172000698 337090774 /nfs/dbraw/zinc/09/07/74/337090774.db2.gz YVEVLMBPFXPPPR-ZDUSSCGKSA-N 1 2 324.405 4.426 20 0 DIADLO FC(F)C[C@@H]1COCC[N@@H+]1Cc1ccc(-c2ccccc2)s1 ZINC000582513449 337099671 /nfs/dbraw/zinc/09/96/71/337099671.db2.gz FKUBYOGNEPJOLI-CQSZACIVSA-N 1 2 323.408 4.271 20 0 DIADLO FC(F)C[C@@H]1COCC[N@H+]1Cc1ccc(-c2ccccc2)s1 ZINC000582513449 337099672 /nfs/dbraw/zinc/09/96/72/337099672.db2.gz FKUBYOGNEPJOLI-CQSZACIVSA-N 1 2 323.408 4.271 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+]1CCCn2c(cc3ccccc32)C1 ZINC000582573995 337107607 /nfs/dbraw/zinc/10/76/07/337107607.db2.gz YOOSMOFEHZOHKX-UHFFFAOYSA-N 1 2 322.456 4.133 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+]1CCCn2c(cc3ccccc32)C1 ZINC000582573995 337107608 /nfs/dbraw/zinc/10/76/08/337107608.db2.gz YOOSMOFEHZOHKX-UHFFFAOYSA-N 1 2 322.456 4.133 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2cc(C(C)(C)C)on2)cc1 ZINC000582575351 337107758 /nfs/dbraw/zinc/10/77/58/337107758.db2.gz WAGPXBCKZQTGOR-ZDUSSCGKSA-N 1 2 302.418 4.174 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2cc(C(C)(C)C)on2)cc1 ZINC000582575351 337107759 /nfs/dbraw/zinc/10/77/59/337107759.db2.gz WAGPXBCKZQTGOR-ZDUSSCGKSA-N 1 2 302.418 4.174 20 0 DIADLO Cc1ccsc1-c1noc(CCn2c(C)[nH+]c3ccccc32)n1 ZINC000582696312 337123411 /nfs/dbraw/zinc/12/34/11/337123411.db2.gz GJAXHWFPZIPURK-UHFFFAOYSA-N 1 2 324.409 4.007 20 0 DIADLO Cc1ccc(C(=O)N2CCC[C@H](C)[C@H]2C)cc1Oc1cc[nH+]cc1 ZINC000172650203 337129222 /nfs/dbraw/zinc/12/92/22/337129222.db2.gz IJZHIULGSZETOK-GOEBONIOSA-N 1 2 324.424 4.443 20 0 DIADLO CS[C@@H](C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccccc1 ZINC000172539632 337129923 /nfs/dbraw/zinc/12/99/23/337129923.db2.gz HODTXEGCLYWXNG-MRXNPFEDSA-N 1 2 323.421 4.120 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2cn3ccsc3n2)o1 ZINC000172868854 337131724 /nfs/dbraw/zinc/13/17/24/337131724.db2.gz XQBDBOSEHSOQAB-AWEZNQCLSA-N 1 2 301.415 4.024 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2cn3ccsc3n2)o1 ZINC000172868854 337131725 /nfs/dbraw/zinc/13/17/25/337131725.db2.gz XQBDBOSEHSOQAB-AWEZNQCLSA-N 1 2 301.415 4.024 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1C[C@@H](C)C[C@@H]1c1ccccc1F ZINC000173696838 337137369 /nfs/dbraw/zinc/13/73/69/337137369.db2.gz DGJBFYYJSCGFEU-WMLDXEAASA-N 1 2 301.409 4.186 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1F ZINC000173696838 337137370 /nfs/dbraw/zinc/13/73/70/337137370.db2.gz DGJBFYYJSCGFEU-WMLDXEAASA-N 1 2 301.409 4.186 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1C[C@H](C)C[C@H]1c1ccccc1F ZINC000173696852 337137381 /nfs/dbraw/zinc/13/73/81/337137381.db2.gz DGJBFYYJSCGFEU-PBHICJAKSA-N 1 2 301.409 4.186 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1C[C@H](C)C[C@H]1c1ccccc1F ZINC000173696852 337137382 /nfs/dbraw/zinc/13/73/82/337137382.db2.gz DGJBFYYJSCGFEU-PBHICJAKSA-N 1 2 301.409 4.186 20 0 DIADLO COc1cccc(C[NH2+][C@@H](C)c2ncc(-c3ccccc3)o2)c1 ZINC000173800731 337138297 /nfs/dbraw/zinc/13/82/97/337138297.db2.gz BSSABDKQBWCEEU-AWEZNQCLSA-N 1 2 308.381 4.201 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1ncc(-c2ccccc2)o1 ZINC000174059022 337139077 /nfs/dbraw/zinc/13/90/77/337139077.db2.gz CFIXYMCQNYFBBM-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO Cc1cccn2c(C[NH2+][C@@H](c3ccco3)c3ccccc3)cnc12 ZINC000174249367 337139977 /nfs/dbraw/zinc/13/99/77/337139977.db2.gz VRMHZMJUDTXOBA-LJQANCHMSA-N 1 2 317.392 4.115 20 0 DIADLO Cc1cccn2c(CN[C@@H](c3ccco3)c3ccccc3)c[nH+]c12 ZINC000174249367 337139978 /nfs/dbraw/zinc/13/99/78/337139978.db2.gz VRMHZMJUDTXOBA-LJQANCHMSA-N 1 2 317.392 4.115 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000175305194 337145250 /nfs/dbraw/zinc/14/52/50/337145250.db2.gz GKTRJLLDJKODRU-CQSZACIVSA-N 1 2 318.808 4.131 20 0 DIADLO CC[C@H](C)CN(CC)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000176633019 337152489 /nfs/dbraw/zinc/15/24/89/337152489.db2.gz DBLQCUVQMVIQCN-HNNXBMFYSA-N 1 2 312.413 4.382 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1cc(Br)ccc1F ZINC000177272994 337155456 /nfs/dbraw/zinc/15/54/56/337155456.db2.gz KXGIACZYPVGNOJ-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1cc(Br)ccc1F ZINC000177272994 337155457 /nfs/dbraw/zinc/15/54/57/337155457.db2.gz KXGIACZYPVGNOJ-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cc(F)cc3cccnc32)s1 ZINC000177764472 337157328 /nfs/dbraw/zinc/15/73/28/337157328.db2.gz PFUHJNORDBMFBY-UHFFFAOYSA-N 1 2 315.417 4.025 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cc(F)cc3cccnc32)s1 ZINC000177764472 337157329 /nfs/dbraw/zinc/15/73/29/337157329.db2.gz PFUHJNORDBMFBY-UHFFFAOYSA-N 1 2 315.417 4.025 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+](C)[C@H](C)c1ccccn1 ZINC000582793673 337170541 /nfs/dbraw/zinc/17/05/41/337170541.db2.gz LNSIZXBVARCASS-CYBMUJFWSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000582793673 337170542 /nfs/dbraw/zinc/17/05/42/337170542.db2.gz LNSIZXBVARCASS-CYBMUJFWSA-N 1 2 304.821 4.327 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1ncc(-c2ccccc2F)o1 ZINC000179664961 337170866 /nfs/dbraw/zinc/17/08/66/337170866.db2.gz XMVMEMWIDKEZIC-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1ncc(-c2ccccc2F)o1 ZINC000179664961 337170867 /nfs/dbraw/zinc/17/08/67/337170867.db2.gz XMVMEMWIDKEZIC-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO Cc1cc(Cn2nc(C(F)(F)F)c3c[nH+]ccc32)c(C)s1 ZINC000179928730 337172662 /nfs/dbraw/zinc/17/26/62/337172662.db2.gz ALZMLJTYYHKGBA-UHFFFAOYSA-N 1 2 311.332 4.177 20 0 DIADLO Cc1cnc(C[N@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)s1 ZINC000180501729 337175993 /nfs/dbraw/zinc/17/59/93/337175993.db2.gz NUZCRNCTMOLPLP-XJKSGUPXSA-N 1 2 304.484 4.130 20 0 DIADLO Cc1cnc(C[N@@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)s1 ZINC000180501729 337175994 /nfs/dbraw/zinc/17/59/94/337175994.db2.gz NUZCRNCTMOLPLP-XJKSGUPXSA-N 1 2 304.484 4.130 20 0 DIADLO CC[C@H]([NH2+][C@@H]1CCCn2nc(C(C)C)nc21)c1ccccc1F ZINC000180745139 337177659 /nfs/dbraw/zinc/17/76/59/337177659.db2.gz ATBWXTULGOGYDC-JKSUJKDBSA-N 1 2 316.424 4.116 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)n1 ZINC000180893188 337178405 /nfs/dbraw/zinc/17/84/05/337178405.db2.gz ICERJCRUMLQFCZ-AWEZNQCLSA-N 1 2 322.412 4.106 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)no1 ZINC000180911979 337178575 /nfs/dbraw/zinc/17/85/75/337178575.db2.gz NOMCBPWJFHMUOJ-AWEZNQCLSA-N 1 2 322.412 4.106 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1cn(-c2ccccc2)nn1)c1ccccc1F ZINC000180945860 337178786 /nfs/dbraw/zinc/17/87/86/337178786.db2.gz PAVFYXXQILFLJY-KSSFIOAISA-N 1 2 324.403 4.208 20 0 DIADLO COC[C@@H]([NH2+]Cc1ccc(Oc2ccccc2)o1)c1ccco1 ZINC000180991000 337179037 /nfs/dbraw/zinc/17/90/37/337179037.db2.gz GKZPQTJZIYWEGV-MRXNPFEDSA-N 1 2 313.353 4.142 20 0 DIADLO CC(=O)c1ccc(NCc2cn3c(cccc3C)[nH+]2)cc1Cl ZINC000181038261 337179433 /nfs/dbraw/zinc/17/94/33/337179433.db2.gz TZSASMAHHLCLAO-UHFFFAOYSA-N 1 2 313.788 4.111 20 0 DIADLO Clc1ccc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)nc1 ZINC000181153405 337182018 /nfs/dbraw/zinc/18/20/18/337182018.db2.gz XSKIQCNNEPLDPE-SFHVURJKSA-N 1 2 309.800 4.009 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(-c2cccc(F)c2)o1)c1cccc(O)c1 ZINC000181491495 337182586 /nfs/dbraw/zinc/18/25/86/337182586.db2.gz XAHNECHWIKXOBI-LBPRGKRZSA-N 1 2 312.344 4.037 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(-c2ccccc2F)o1)c1cccc(O)c1 ZINC000181518200 337182774 /nfs/dbraw/zinc/18/27/74/337182774.db2.gz DDSRLQCSEDGLBB-LBPRGKRZSA-N 1 2 312.344 4.037 20 0 DIADLO Cc1cc(-c2noc(C[NH2+][C@H](C)c3cccs3)n2)ccc1F ZINC000182541668 337188833 /nfs/dbraw/zinc/18/88/33/337188833.db2.gz HFMOUGQADBALLJ-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+]2CCc3sccc3C2)s1 ZINC000183564943 337192289 /nfs/dbraw/zinc/19/22/89/337192289.db2.gz UQTSTDRVXAFGEU-UHFFFAOYSA-N 1 2 318.389 4.090 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+]2CCc3sccc3C2)s1 ZINC000183564943 337192290 /nfs/dbraw/zinc/19/22/90/337192290.db2.gz UQTSTDRVXAFGEU-UHFFFAOYSA-N 1 2 318.389 4.090 20 0 DIADLO Cc1ccc(N[C@H]2CCc3c2cccc3Br)c[nH+]1 ZINC000225838861 337194439 /nfs/dbraw/zinc/19/44/39/337194439.db2.gz NWAVQKIXMDAYGY-HNNXBMFYSA-N 1 2 303.203 4.252 20 0 DIADLO Cc1cncc([C@H](C)[NH2+][C@@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000184426033 337197202 /nfs/dbraw/zinc/19/72/02/337197202.db2.gz GLSAAWROSIUMHL-YWZLYKJASA-N 1 2 321.399 4.364 20 0 DIADLO CC(=O)c1ccccc1OCCSCc1ccc(C)[nH+]c1C ZINC000184804960 337200314 /nfs/dbraw/zinc/20/03/14/337200314.db2.gz IOOAKGUPIJRUAZ-UHFFFAOYSA-N 1 2 315.438 4.213 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1N(C)C)c1ncc(-c2ccccc2)o1 ZINC000184857786 337200630 /nfs/dbraw/zinc/20/06/30/337200630.db2.gz XXXSNOHZVAPWSH-HNNXBMFYSA-N 1 2 321.424 4.258 20 0 DIADLO FC(F)(F)c1cnc(SCCCn2cc[nH+]c2)c(Cl)c1 ZINC000185344843 337204289 /nfs/dbraw/zinc/20/42/89/337204289.db2.gz MFZNACSMENKGMC-UHFFFAOYSA-N 1 2 321.755 4.133 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1C[NH+]1CC2(CCC2(F)F)C1 ZINC000582935932 337217812 /nfs/dbraw/zinc/21/78/12/337217812.db2.gz OHQCBMIPXGCDBR-UHFFFAOYSA-N 1 2 309.253 4.076 20 0 DIADLO Clc1ccccc1C[C@@H]([NH2+]Cc1ccn[nH]1)c1cccs1 ZINC000582957794 337218294 /nfs/dbraw/zinc/21/82/94/337218294.db2.gz PHGFEQQHXPHQRN-OAHLLOKOSA-N 1 2 317.845 4.198 20 0 DIADLO CC1(C)C[N@H+](C/C=C\c2ccc(F)cc2F)[C@H]1c1ccncc1 ZINC000582980438 337222482 /nfs/dbraw/zinc/22/24/82/337222482.db2.gz IFKVTLNMBAWJSF-JXCVUKRWSA-N 1 2 314.379 4.456 20 0 DIADLO CC1(C)C[N@@H+](C/C=C\c2ccc(F)cc2F)[C@H]1c1ccncc1 ZINC000582980438 337222483 /nfs/dbraw/zinc/22/24/83/337222483.db2.gz IFKVTLNMBAWJSF-JXCVUKRWSA-N 1 2 314.379 4.456 20 0 DIADLO CC(C)c1cccc(C(C)C)c1NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000582973272 337224904 /nfs/dbraw/zinc/22/49/04/337224904.db2.gz UCVJOGAXJWRCDU-AWEZNQCLSA-N 1 2 313.445 4.474 20 0 DIADLO CC(C)c1cccc(C(C)C)c1NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000582973272 337224905 /nfs/dbraw/zinc/22/49/05/337224905.db2.gz UCVJOGAXJWRCDU-AWEZNQCLSA-N 1 2 313.445 4.474 20 0 DIADLO CCC[C@@H]1CCCC[N@@H+]1Cc1noc(Cc2ccccc2C)n1 ZINC000583170826 337251075 /nfs/dbraw/zinc/25/10/75/337251075.db2.gz OOFVNYUQKPHPHT-QGZVFWFLSA-N 1 2 313.445 4.123 20 0 DIADLO CCC[C@@H]1CCCC[N@H+]1Cc1noc(Cc2ccccc2C)n1 ZINC000583170826 337251076 /nfs/dbraw/zinc/25/10/76/337251076.db2.gz OOFVNYUQKPHPHT-QGZVFWFLSA-N 1 2 313.445 4.123 20 0 DIADLO CSCCCCCNc1nc(-c2ccncc2)[nH+]c(C)c1C ZINC000186360475 337256819 /nfs/dbraw/zinc/25/68/19/337256819.db2.gz JYZHEDQXOOCLND-UHFFFAOYSA-N 1 2 316.474 4.101 20 0 DIADLO Cc1ccc(CSc2ncccc2Br)c(C)[nH+]1 ZINC000186621547 337258161 /nfs/dbraw/zinc/25/81/61/337258161.db2.gz SHJQUSORVGBWEB-UHFFFAOYSA-N 1 2 309.232 4.148 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@H]2c2nccs2)c(C)c1 ZINC000186656132 337258254 /nfs/dbraw/zinc/25/82/54/337258254.db2.gz DBAZQQCRZVJFAL-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@H]2c2nccs2)c(C)c1 ZINC000186656132 337258255 /nfs/dbraw/zinc/25/82/55/337258255.db2.gz DBAZQQCRZVJFAL-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO COc1cc(C(C)=O)ccc1SCc1ccc(C)[nH+]c1C ZINC000186648968 337258278 /nfs/dbraw/zinc/25/82/78/337258278.db2.gz NRHSNMPKDRQWCE-UHFFFAOYSA-N 1 2 301.411 4.202 20 0 DIADLO Cc1cccc(C[N@@H+]2CCSC[C@@H]2c2nccs2)c1C ZINC000186666730 337258358 /nfs/dbraw/zinc/25/83/58/337258358.db2.gz MGAUVFWIIIPJSS-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1cccc(C[N@H+]2CCSC[C@@H]2c2nccs2)c1C ZINC000186666730 337258359 /nfs/dbraw/zinc/25/83/59/337258359.db2.gz MGAUVFWIIIPJSS-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO CC[C@H]1COCC[N@@H+]1Cc1nc(-c2ccccc2Cl)cs1 ZINC000187046965 337261333 /nfs/dbraw/zinc/26/13/33/337261333.db2.gz WUNWTBJRIWCFOP-LBPRGKRZSA-N 1 2 322.861 4.074 20 0 DIADLO CC[C@H]1COCC[N@H+]1Cc1nc(-c2ccccc2Cl)cs1 ZINC000187046965 337261334 /nfs/dbraw/zinc/26/13/34/337261334.db2.gz WUNWTBJRIWCFOP-LBPRGKRZSA-N 1 2 322.861 4.074 20 0 DIADLO Clc1ccccc1CC[N@@H+]1CCSC[C@H]1c1nccs1 ZINC000187050284 337261408 /nfs/dbraw/zinc/26/14/08/337261408.db2.gz XBNDOIGKOKPREN-AWEZNQCLSA-N 1 2 324.902 4.129 20 0 DIADLO Clc1ccccc1CC[N@H+]1CCSC[C@H]1c1nccs1 ZINC000187050284 337261409 /nfs/dbraw/zinc/26/14/09/337261409.db2.gz XBNDOIGKOKPREN-AWEZNQCLSA-N 1 2 324.902 4.129 20 0 DIADLO Cc1ccc(C[S@](=O)[C@@H]2CCc3c2cccc3Cl)c(C)[nH+]1 ZINC000187174087 337263480 /nfs/dbraw/zinc/26/34/80/337263480.db2.gz VAJGCODRDQMAAV-UTKZUKDTSA-N 1 2 319.857 4.288 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccccc2)c[nH]1)c1ccc(F)cc1F ZINC000187409239 337265735 /nfs/dbraw/zinc/26/57/35/337265735.db2.gz NYEYNBWNFALBDE-LBPRGKRZSA-N 1 2 313.351 4.206 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@@H]2c2cccn2C)cs1 ZINC000063482885 337281830 /nfs/dbraw/zinc/28/18/30/337281830.db2.gz FUWZITCQLONAER-MRXNPFEDSA-N 1 2 303.475 4.161 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@@H]2c2cccn2C)cs1 ZINC000063482885 337281831 /nfs/dbraw/zinc/28/18/31/337281831.db2.gz FUWZITCQLONAER-MRXNPFEDSA-N 1 2 303.475 4.161 20 0 DIADLO Cc1ccc(NC(=O)N2CCc3c(cccc3C(C)C)C2)c(C)[nH+]1 ZINC000189742489 337282453 /nfs/dbraw/zinc/28/24/53/337282453.db2.gz WLWWSBHRWYCLIV-UHFFFAOYSA-N 1 2 323.440 4.412 20 0 DIADLO Cc1cncc(C[NH2+][C@@H](c2cccc(Cl)c2)c2ccccn2)c1 ZINC000189963409 337284021 /nfs/dbraw/zinc/28/40/21/337284021.db2.gz ZBJWKIMADWRUOX-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO Clc1ccc(-c2ccc(NCc3[nH]cc[nH+]3)cn2)c(Cl)c1 ZINC000190215340 337285553 /nfs/dbraw/zinc/28/55/53/337285553.db2.gz IWJZZBKIKNGEGE-UHFFFAOYSA-N 1 2 319.195 4.391 20 0 DIADLO Cc1nc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)oc1C ZINC000191238694 337295137 /nfs/dbraw/zinc/29/51/37/337295137.db2.gz JSXXUMHCVGTTIU-UHFFFAOYSA-N 1 2 312.335 4.246 20 0 DIADLO Cc1nc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)oc1C ZINC000191238694 337295138 /nfs/dbraw/zinc/29/51/38/337295138.db2.gz JSXXUMHCVGTTIU-UHFFFAOYSA-N 1 2 312.335 4.246 20 0 DIADLO CC[N@H+](Cc1nccn1-c1ccccc1)[C@@H](C)c1cccc(O)c1 ZINC000191253781 337295222 /nfs/dbraw/zinc/29/52/22/337295222.db2.gz IZRBOGDROIYWMJ-INIZCTEOSA-N 1 2 321.424 4.161 20 0 DIADLO CC[N@@H+](Cc1nccn1-c1ccccc1)[C@@H](C)c1cccc(O)c1 ZINC000191253781 337295223 /nfs/dbraw/zinc/29/52/23/337295223.db2.gz IZRBOGDROIYWMJ-INIZCTEOSA-N 1 2 321.424 4.161 20 0 DIADLO CC(C)c1cnc(NCc2ccc(N(C)C(C)C)[nH+]c2)s1 ZINC000191553336 337298940 /nfs/dbraw/zinc/29/89/40/337298940.db2.gz QRTUWMUBGBXADY-UHFFFAOYSA-N 1 2 304.463 4.118 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)c2ccncc2)c1C(C)C ZINC000191956000 337301423 /nfs/dbraw/zinc/30/14/23/337301423.db2.gz NXWZOTSRFBQVDD-UHFFFAOYSA-N 1 2 305.381 4.314 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)Cc1ncccn1 ZINC000192070834 337302360 /nfs/dbraw/zinc/30/23/60/337302360.db2.gz MHVCPGIQCBPMSX-AWEZNQCLSA-N 1 2 324.453 4.102 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)Cc1ncccn1 ZINC000192070834 337302361 /nfs/dbraw/zinc/30/23/61/337302361.db2.gz MHVCPGIQCBPMSX-AWEZNQCLSA-N 1 2 324.453 4.102 20 0 DIADLO COc1ccc(Cl)c(C[NH2+]C(C)(C)c2nc(C)cs2)c1 ZINC000192106872 337303030 /nfs/dbraw/zinc/30/30/30/337303030.db2.gz VFUBHZPOMVVPDK-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO Clc1ccccc1C[C@@H]([NH2+]Cc1ncccn1)c1ccccc1 ZINC000192154968 337303480 /nfs/dbraw/zinc/30/34/80/337303480.db2.gz ISPICLXBENPXCY-GOSISDBHSA-N 1 2 323.827 4.204 20 0 DIADLO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]Cc1ncccn1 ZINC000192182537 337303759 /nfs/dbraw/zinc/30/37/59/337303759.db2.gz QTHJRMBAULOJPF-CYBMUJFWSA-N 1 2 324.453 4.068 20 0 DIADLO CCCCOc1ccccc1NC(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000584478705 337348255 /nfs/dbraw/zinc/34/82/55/337348255.db2.gz ZMOMDWHCDJIKML-UHFFFAOYSA-N 1 2 323.396 4.074 20 0 DIADLO CC(C)c1nc(N[C@H](c2ccccc2)c2ccccn2)cc[nH+]1 ZINC000106462640 337387082 /nfs/dbraw/zinc/38/70/82/337387082.db2.gz KSCWUIJKSQQKPI-GOSISDBHSA-N 1 2 304.397 4.197 20 0 DIADLO CC(C)c1nc(N2CCC(c3nc4ccccc4o3)CC2)cc[nH+]1 ZINC000106462308 337387097 /nfs/dbraw/zinc/38/70/97/337387097.db2.gz JVCPAGSNYASLRY-UHFFFAOYSA-N 1 2 322.412 4.125 20 0 DIADLO c1c2ccccc2[nH]c1[C@@H]1CCCC[N@H+]1Cc1nc(C2CC2)no1 ZINC000108385396 337387938 /nfs/dbraw/zinc/38/79/38/337387938.db2.gz MUDKFBMKJXYQKG-KRWDZBQOSA-N 1 2 322.412 4.156 20 0 DIADLO c1c2ccccc2[nH]c1[C@@H]1CCCC[N@@H+]1Cc1nc(C2CC2)no1 ZINC000108385396 337387939 /nfs/dbraw/zinc/38/79/39/337387939.db2.gz MUDKFBMKJXYQKG-KRWDZBQOSA-N 1 2 322.412 4.156 20 0 DIADLO Cn1cc[nH+]c1CNc1ccccc1Oc1cc(F)cc(F)c1 ZINC000124636045 337406664 /nfs/dbraw/zinc/40/66/64/337406664.db2.gz WOBPZODWEPZPPX-UHFFFAOYSA-N 1 2 315.323 4.103 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+]Cc3nccn3C(F)F)o2)cc1 ZINC000237723894 337469257 /nfs/dbraw/zinc/46/92/57/337469257.db2.gz GRYJINOKFVPXBA-UHFFFAOYSA-N 1 2 317.339 4.136 20 0 DIADLO FC(F)(F)c1nn(CC2CCC(F)(F)CC2)c2cc[nH+]cc21 ZINC000418935701 337472123 /nfs/dbraw/zinc/47/21/23/337472123.db2.gz MMDOHGUVSKULNW-UHFFFAOYSA-N 1 2 319.277 4.276 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccoc2)no1)c1ccc(C2CC2)cc1 ZINC000419354748 337480729 /nfs/dbraw/zinc/48/07/29/337480729.db2.gz MKTYLYNQSDZZMS-LBPRGKRZSA-N 1 2 309.369 4.058 20 0 DIADLO CO[C@@H](C)c1noc(CSCc2ccc(C(C)C)[nH+]c2C)n1 ZINC000419418454 337483012 /nfs/dbraw/zinc/48/30/12/337483012.db2.gz LCXXLCHAQDAOBH-LBPRGKRZSA-N 1 2 321.446 4.037 20 0 DIADLO COc1ccnc(CSCc2ccc(C(C)C)[nH+]c2C)c1 ZINC000419451638 337485035 /nfs/dbraw/zinc/48/50/35/337485035.db2.gz NXDALXLDZDXILF-UHFFFAOYSA-N 1 2 302.443 4.350 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)o1 ZINC000245836711 337495116 /nfs/dbraw/zinc/49/51/16/337495116.db2.gz CSXABLUCWCKPEQ-FCIDVOKBSA-N 1 2 305.809 4.079 20 0 DIADLO Cc1cc(CNC(=O)N2CCC[C@H]2c2ccccc2C)cc(C)[nH+]1 ZINC000420851881 337511562 /nfs/dbraw/zinc/51/15/62/337511562.db2.gz RUJQEBJTIOSFPM-IBGZPJMESA-N 1 2 323.440 4.054 20 0 DIADLO Cc1cc(CNC(=O)N[C@@H](C)c2ccc(C3CC3)cc2)cc(C)[nH+]1 ZINC000420856467 337511720 /nfs/dbraw/zinc/51/17/20/337511720.db2.gz FUMDVPZUTLTTPJ-HNNXBMFYSA-N 1 2 323.440 4.136 20 0 DIADLO Cn1cc(Cl)c(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)n1 ZINC000420935541 337516928 /nfs/dbraw/zinc/51/69/28/337516928.db2.gz LYDUWHWITUHLBR-HNNXBMFYSA-N 1 2 309.816 4.090 20 0 DIADLO Cc1cc(CNC(=O)Nc2c(C)cccc2C(C)C)cc(C)[nH+]1 ZINC000421039263 337521105 /nfs/dbraw/zinc/52/11/05/337521105.db2.gz TXKWUBIQOYXMTF-UHFFFAOYSA-N 1 2 311.429 4.452 20 0 DIADLO Cc1ccc(C(=O)N[C@@H]2C[C@H]2C2CCC2)cc1Oc1cc[nH+]cc1 ZINC000520800381 337525393 /nfs/dbraw/zinc/52/53/93/337525393.db2.gz QJLRJLAMNQDXGF-ZWKOTPCHSA-N 1 2 322.408 4.101 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H]2CCC(C)(C)c3ccccc32)nn1C ZINC000421324012 337526368 /nfs/dbraw/zinc/52/63/68/337526368.db2.gz JCPMYSWEFXEQRR-OAHLLOKOSA-N 1 2 317.864 4.284 20 0 DIADLO Cc1cc(CNC(=O)c2ccc(C)c(Cl)c2Cl)cc(C)[nH+]1 ZINC000421576873 337540054 /nfs/dbraw/zinc/54/00/54/337540054.db2.gz NTCASLRJVKADRC-UHFFFAOYSA-N 1 2 323.223 4.244 20 0 DIADLO Cc1nc(C[NH+]2CCC(Oc3cc(C)ccc3C)CC2)cs1 ZINC000076722185 337573317 /nfs/dbraw/zinc/57/33/17/337573317.db2.gz PUOFUCHASHZWMK-UHFFFAOYSA-N 1 2 316.470 4.112 20 0 DIADLO CC(C)(C)OC(=O)CCCC[NH2+][C@@H](C(C)(C)C)C(F)(F)F ZINC000571822347 337578259 /nfs/dbraw/zinc/57/82/59/337578259.db2.gz DAJQEMJOPKNGNE-LBPRGKRZSA-N 1 2 311.388 4.065 20 0 DIADLO CC1(C)CCC[C@H](c2noc(-c3cc(-n4cc[nH+]c4)ccn3)n2)C1 ZINC000571932059 337582248 /nfs/dbraw/zinc/58/22/48/337582248.db2.gz VQDKIXMXJHAJML-ZDUSSCGKSA-N 1 2 323.400 4.001 20 0 DIADLO CC1(C)CCC[C@@H](c2noc(-c3cc(-n4cc[nH+]c4)ccn3)n2)C1 ZINC000571932057 337582254 /nfs/dbraw/zinc/58/22/54/337582254.db2.gz VQDKIXMXJHAJML-CYBMUJFWSA-N 1 2 323.400 4.001 20 0 DIADLO Oc1ccc(F)c(C[NH2+][C@H]2CCc3sc(Cl)cc32)c1F ZINC000571946558 337583851 /nfs/dbraw/zinc/58/38/51/337583851.db2.gz BSRHJGGRLUVEGS-JTQLQIEISA-N 1 2 315.772 4.162 20 0 DIADLO CCc1cc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)sc1C ZINC000161806667 337597464 /nfs/dbraw/zinc/59/74/64/337597464.db2.gz VPINWWNRACYNLE-UHFFFAOYSA-N 1 2 311.410 4.261 20 0 DIADLO CC(=O)Nc1ccccc1CNc1ccc(-c2ccccc2)c[nH+]1 ZINC000162224444 337611097 /nfs/dbraw/zinc/61/10/97/337611097.db2.gz XAILDZJQQNPAQJ-UHFFFAOYSA-N 1 2 317.392 4.319 20 0 DIADLO Cc1cccn2cc(-c3ccc(NC(=O)[C@H]4CC45CC5)cc3)[nH+]c12 ZINC000421752639 337641439 /nfs/dbraw/zinc/64/14/39/337641439.db2.gz UDNMDZMAWSKRFQ-MRXNPFEDSA-N 1 2 317.392 4.048 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1ccncc1Cl ZINC000421851724 337649863 /nfs/dbraw/zinc/64/98/63/337649863.db2.gz GDFYDGAEQPOLDX-ZJUUUORDSA-N 1 2 307.850 4.092 20 0 DIADLO FC(F)Oc1cccc(N[C@H]2CCc3ccc[nH+]c3CC2)c1 ZINC000421839273 337653028 /nfs/dbraw/zinc/65/30/28/337653028.db2.gz XEMRCFLBDSZSON-ZDUSSCGKSA-N 1 2 304.340 4.043 20 0 DIADLO FC(F)Oc1ccccc1N[C@H]1CCc2ccc[nH+]c2CC1 ZINC000421843870 337653899 /nfs/dbraw/zinc/65/38/99/337653899.db2.gz RROAZSPQVUIERU-ZDUSSCGKSA-N 1 2 304.340 4.043 20 0 DIADLO C[C@H]([NH2+][C@H]1c2ccc(F)cc2O[C@H]1C)c1ccncc1Cl ZINC000421861758 337655995 /nfs/dbraw/zinc/65/59/95/337655995.db2.gz WHBUZIWMJCWVMW-XQJJYNOISA-N 1 2 306.768 4.047 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1cccc(OC(F)F)c1 ZINC000423215187 337704700 /nfs/dbraw/zinc/70/47/00/337704700.db2.gz MHNHGGSMYOUYKJ-NSHDSACASA-N 1 2 304.340 4.429 20 0 DIADLO Fc1ccc2c(c1)[C@H](Nc1ccc3c(c1)CC[NH2+]3)CCS2 ZINC000423218947 337705148 /nfs/dbraw/zinc/70/51/48/337705148.db2.gz SPYCFBMTPKKLQB-MRXNPFEDSA-N 1 2 300.402 4.443 20 0 DIADLO Cc1cccc(-c2ccc(NCc3cn(C(C)(C)C)nn3)[nH+]c2)c1 ZINC000527743151 337760689 /nfs/dbraw/zinc/76/06/89/337760689.db2.gz FFOXPHVJYQEOPE-UHFFFAOYSA-N 1 2 321.428 4.016 20 0 DIADLO Cc1ccccc1[C@@H]1CN(c2[nH+]ccc3ccccc32)CCO1 ZINC000527904908 337770123 /nfs/dbraw/zinc/77/01/23/337770123.db2.gz MZHWGOWUGAXMNC-IBGZPJMESA-N 1 2 304.393 4.121 20 0 DIADLO COc1ccc(Cl)cc1[C@H](C)[NH2+][C@@H](C)c1ncccc1F ZINC000528036554 337782655 /nfs/dbraw/zinc/78/26/55/337782655.db2.gz SKGSAIZMFWYKIO-QWRGUYRKSA-N 1 2 308.784 4.295 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)[C@H]1CCCC12CC2 ZINC000528313969 337801501 /nfs/dbraw/zinc/80/15/01/337801501.db2.gz HAZOQAFTOBUMKK-QGZVFWFLSA-N 1 2 308.381 4.393 20 0 DIADLO CC(C)(C)CC(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000044567605 337811310 /nfs/dbraw/zinc/81/13/10/337811310.db2.gz JGCLWJLVMOTIAZ-UHFFFAOYSA-N 1 2 311.429 4.261 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@H]2COc3ccc(F)cc32)c(Cl)c1 ZINC000424286454 337815466 /nfs/dbraw/zinc/81/54/66/337815466.db2.gz WCDRGTHXWXOZIN-HWPZZCPQSA-N 1 2 321.779 4.272 20 0 DIADLO CCc1nnc([C@@H](C)[NH+]2CCC(=Cc3cccc(F)c3)CC2)o1 ZINC000533113539 337823847 /nfs/dbraw/zinc/82/38/47/337823847.db2.gz YKALFGNKYGCEFV-CYBMUJFWSA-N 1 2 315.392 4.012 20 0 DIADLO CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1cc[nH+]cc1C ZINC000107285063 337828256 /nfs/dbraw/zinc/82/82/56/337828256.db2.gz IIYQWDBHEGZPBX-QGZVFWFLSA-N 1 2 312.413 4.310 20 0 DIADLO O=C(Nc1ccc(Cl)cc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000082358370 337836814 /nfs/dbraw/zinc/83/68/14/337836814.db2.gz HYHQLPPSCKEDOS-UHFFFAOYSA-N 1 2 312.760 4.170 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2cc(Cl)ccc2F)o1 ZINC000119345477 337857012 /nfs/dbraw/zinc/85/70/12/337857012.db2.gz BOKLTJVSDGOQOO-HNNXBMFYSA-N 1 2 311.784 4.112 20 0 DIADLO C[C@@H](SCCn1cc[nH+]c1)c1cccc(Br)c1 ZINC000090202491 337879171 /nfs/dbraw/zinc/87/91/71/337879171.db2.gz PKWHQCPKJZSQEF-LLVKDONJSA-N 1 2 311.248 4.140 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N(C)Cc1ccc(Cl)c(Cl)c1 ZINC000121150102 337885082 /nfs/dbraw/zinc/88/50/82/337885082.db2.gz NGOHCCHBVILUOX-UHFFFAOYSA-N 1 2 324.211 4.361 20 0 DIADLO C[C@H]([NH2+][C@@H](c1cccc(F)c1)c1ccccn1)c1ccncc1 ZINC000090955967 337887467 /nfs/dbraw/zinc/88/74/67/337887467.db2.gz AQHUHEYKCRDHJW-LIRRHRJNSA-N 1 2 307.372 4.056 20 0 DIADLO Cc1ccc(C(C)(C)CN(C)C(=O)Nc2cc[nH+]cc2C)cc1 ZINC000121515048 337894522 /nfs/dbraw/zinc/89/45/22/337894522.db2.gz ZWVNGHACNRYBAH-UHFFFAOYSA-N 1 2 311.429 4.140 20 0 DIADLO Cc1ccc(F)c(CN(C)Cc2[nH+]ccn2Cc2ccccc2)c1 ZINC000093337080 337915337 /nfs/dbraw/zinc/91/53/37/337915337.db2.gz VWWWCZPGMAUQTJ-UHFFFAOYSA-N 1 2 323.415 4.011 20 0 DIADLO C[C@@H]1CC[C@H](C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C1 ZINC000537344082 337931670 /nfs/dbraw/zinc/93/16/70/337931670.db2.gz FZCDRGCRTKVCLU-ZBFHGGJFSA-N 1 2 323.440 4.261 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccccc1N(C)C ZINC000537426885 337935907 /nfs/dbraw/zinc/93/59/07/337935907.db2.gz UEYJIWMXXYJXQQ-MRXNPFEDSA-N 1 2 324.472 4.311 20 0 DIADLO CCc1cc(N2CC[C@H](C)C3(CCC3)C2)nc(-c2ccncc2)[nH+]1 ZINC000537826500 337962810 /nfs/dbraw/zinc/96/28/10/337962810.db2.gz JZBQPSLMUNJMCT-HNNXBMFYSA-N 1 2 322.456 4.118 20 0 DIADLO CCCN(C(=O)C[C@H](C)n1cc[nH+]c1)[C@H](CC)c1ccccc1 ZINC000514791676 337971514 /nfs/dbraw/zinc/97/15/14/337971514.db2.gz BOVZQPLUJIWNJQ-FUHWJXTLSA-N 1 2 313.445 4.224 20 0 DIADLO CC(C)c1cc(N2CC(C)(C)[C@H]2[C@H]2CCCO2)nc(C(C)C)[nH+]1 ZINC000514832668 337972600 /nfs/dbraw/zinc/97/26/00/337972600.db2.gz SHEQTSGYJDPSGM-NVXWUHKLSA-N 1 2 317.477 4.117 20 0 DIADLO COc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1cscn1)CCS2 ZINC000515357156 337986151 /nfs/dbraw/zinc/98/61/51/337986151.db2.gz WFXCZLRWIVWHSE-GXFFZTMASA-N 1 2 306.456 4.039 20 0 DIADLO COC(=O)c1cnc([C@@H](C)[NH2+][C@H](C)c2cc(C)sc2C)s1 ZINC000315438403 337987199 /nfs/dbraw/zinc/98/71/99/337987199.db2.gz WUXXAVLMOGXBCQ-NXEZZACHSA-N 1 2 324.471 4.020 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc(C[C@H]2C=CCC2)n1 ZINC000515977040 338001856 /nfs/dbraw/zinc/00/18/56/338001856.db2.gz QJMRPTNUXDBZMZ-AWEZNQCLSA-N 1 2 322.412 4.100 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NC(=O)CCC2CCCCC2)c1 ZINC000516533698 338014746 /nfs/dbraw/zinc/01/47/46/338014746.db2.gz CKZDLHXOTHYUAH-UHFFFAOYSA-N 1 2 311.429 4.386 20 0 DIADLO C[C@H](c1ccc(Oc2ccccc2)cc1)[N@H+](C)Cc1nccn1C ZINC000445454202 338017053 /nfs/dbraw/zinc/01/70/53/338017053.db2.gz YSMOOCBBVVGSAD-MRXNPFEDSA-N 1 2 321.424 4.405 20 0 DIADLO C[C@H](c1ccc(Oc2ccccc2)cc1)[N@@H+](C)Cc1nccn1C ZINC000445454202 338017054 /nfs/dbraw/zinc/01/70/54/338017054.db2.gz YSMOOCBBVVGSAD-MRXNPFEDSA-N 1 2 321.424 4.405 20 0 DIADLO Cc1ccc(F)c(-c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)c1 ZINC000445456022 338017395 /nfs/dbraw/zinc/01/73/95/338017395.db2.gz RUYMPYQJUZDVPQ-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CC(C)c1ccoc1-c1noc(C[N@H+](C)Cc2ccccc2)n1 ZINC000426200714 338022737 /nfs/dbraw/zinc/02/27/37/338022737.db2.gz JBEBNDCKTIEVLR-UHFFFAOYSA-N 1 2 311.385 4.085 20 0 DIADLO CC(C)c1ccoc1-c1noc(C[N@@H+](C)Cc2ccccc2)n1 ZINC000426200714 338022738 /nfs/dbraw/zinc/02/27/38/338022738.db2.gz JBEBNDCKTIEVLR-UHFFFAOYSA-N 1 2 311.385 4.085 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[NH+]1CCC(O)(C(F)F)CC1 ZINC000426229868 338023299 /nfs/dbraw/zinc/02/32/99/338023299.db2.gz AJPBSQWBFHHTFR-SECBINFHSA-N 1 2 324.198 4.146 20 0 DIADLO Cc1ccoc1C[NH2+][C@H](c1cccnc1)c1ccc(F)cc1F ZINC000426289834 338024836 /nfs/dbraw/zinc/02/48/36/338024836.db2.gz HSHSMRYFZODWQY-GOSISDBHSA-N 1 2 314.335 4.140 20 0 DIADLO FC(F)Oc1cccc(CSCc2cn3ccccc3[nH+]2)c1 ZINC000426545812 338034364 /nfs/dbraw/zinc/03/43/64/338034364.db2.gz SBZICIPLVDPZRN-UHFFFAOYSA-N 1 2 320.364 4.369 20 0 DIADLO Cc1ccn(C)c1C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(C)c1 ZINC000428198072 338042170 /nfs/dbraw/zinc/04/21/70/338042170.db2.gz BGMNIHDMEMVPBM-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO CC(C)c1nnc(C[N@@H+](C)[C@@H](c2ccccc2Cl)C(C)C)[nH]1 ZINC000428214013 338042615 /nfs/dbraw/zinc/04/26/15/338042615.db2.gz XIJDAMKJXDYOAZ-MRXNPFEDSA-N 1 2 320.868 4.411 20 0 DIADLO CC(C)c1nnc(C[N@H+](C)[C@@H](c2ccccc2Cl)C(C)C)[nH]1 ZINC000428214013 338042616 /nfs/dbraw/zinc/04/26/16/338042616.db2.gz XIJDAMKJXDYOAZ-MRXNPFEDSA-N 1 2 320.868 4.411 20 0 DIADLO Cc1cnc([C@H](C)[N@H+]2CC=C(c3ccccc3Cl)CC2)cn1 ZINC000428292802 338045906 /nfs/dbraw/zinc/04/59/06/338045906.db2.gz CZSNCHKTBKPMJU-AWEZNQCLSA-N 1 2 313.832 4.289 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+]2CC=C(c3ccccc3Cl)CC2)cn1 ZINC000428292802 338045907 /nfs/dbraw/zinc/04/59/07/338045907.db2.gz CZSNCHKTBKPMJU-AWEZNQCLSA-N 1 2 313.832 4.289 20 0 DIADLO CCCc1nc(C)c(C[NH2+][C@@](C)(CC)c2nc(C)cs2)o1 ZINC000428386460 338049855 /nfs/dbraw/zinc/04/98/55/338049855.db2.gz WZKZPIUZPHCVIO-INIZCTEOSA-N 1 2 307.463 4.115 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ccn(C(CC)CC)n2)cc1 ZINC000448450323 338061112 /nfs/dbraw/zinc/06/11/12/338061112.db2.gz URAUUQOJVKADGM-UHFFFAOYSA-N 1 2 315.461 4.275 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ccn(C(CC)CC)n2)cc1 ZINC000448450323 338061113 /nfs/dbraw/zinc/06/11/13/338061113.db2.gz URAUUQOJVKADGM-UHFFFAOYSA-N 1 2 315.461 4.275 20 0 DIADLO CC(C)[N@H+](Cc1ncn(-c2ccccc2)n1)[C@H](C)c1ccccc1 ZINC000428857763 338062737 /nfs/dbraw/zinc/06/27/37/338062737.db2.gz APQZYHJEBAGCMA-QGZVFWFLSA-N 1 2 320.440 4.239 20 0 DIADLO CC(C)[N@@H+](Cc1ncn(-c2ccccc2)n1)[C@H](C)c1ccccc1 ZINC000428857763 338062738 /nfs/dbraw/zinc/06/27/38/338062738.db2.gz APQZYHJEBAGCMA-QGZVFWFLSA-N 1 2 320.440 4.239 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccc(C(F)(F)F)s2)cs1 ZINC000428865931 338063230 /nfs/dbraw/zinc/06/32/30/338063230.db2.gz IADCAVQMNJTUIM-UHFFFAOYSA-N 1 2 306.378 4.076 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2ccc(C(F)(F)F)s2)s1 ZINC000428869623 338063595 /nfs/dbraw/zinc/06/35/95/338063595.db2.gz VTQWOZFFDQRDFY-UHFFFAOYSA-N 1 2 321.393 4.032 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2ccc(F)cc2s1)c1nccs1 ZINC000428869970 338063680 /nfs/dbraw/zinc/06/36/80/338063680.db2.gz DMBNDEXWYJVJKU-JTQLQIEISA-N 1 2 307.419 4.133 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2nc3ccc(F)cc3s2)s1 ZINC000428875833 338064178 /nfs/dbraw/zinc/06/41/78/338064178.db2.gz HTXZCIOMTTXLOV-UHFFFAOYSA-N 1 2 321.446 4.225 20 0 DIADLO CC(=O)Nc1nc(C[N@@H+](C(C)C)[C@H](C)c2ccccc2)cs1 ZINC000428878825 338064276 /nfs/dbraw/zinc/06/42/76/338064276.db2.gz FXTQPHJVAIBHJZ-CYBMUJFWSA-N 1 2 317.458 4.073 20 0 DIADLO CC(=O)Nc1nc(C[N@H+](C(C)C)[C@H](C)c2ccccc2)cs1 ZINC000428878825 338064277 /nfs/dbraw/zinc/06/42/77/338064277.db2.gz FXTQPHJVAIBHJZ-CYBMUJFWSA-N 1 2 317.458 4.073 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc2ccc(F)cc2s1)c1nccs1 ZINC000428888431 338064727 /nfs/dbraw/zinc/06/47/27/338064727.db2.gz NMVKEKBLBZMOOD-HNNXBMFYSA-N 1 2 321.446 4.307 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(C(F)F)c2)C[C@H](C(F)(F)F)O1 ZINC000428929372 338065292 /nfs/dbraw/zinc/06/52/92/338065292.db2.gz UDZLXGNKKPINGN-GFCCVEGCSA-N 1 2 323.305 4.166 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(C(F)F)c2)C[C@H](C(F)(F)F)O1 ZINC000428929372 338065293 /nfs/dbraw/zinc/06/52/93/338065293.db2.gz UDZLXGNKKPINGN-GFCCVEGCSA-N 1 2 323.305 4.166 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1CC[C@](F)(c2ccccc2F)C1 ZINC000428942639 338065997 /nfs/dbraw/zinc/06/59/97/338065997.db2.gz ZMNUPIFWLNJSDA-GOSISDBHSA-N 1 2 320.383 4.316 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1CC[C@](F)(c2ccccc2F)C1 ZINC000428942639 338065998 /nfs/dbraw/zinc/06/59/98/338065998.db2.gz ZMNUPIFWLNJSDA-GOSISDBHSA-N 1 2 320.383 4.316 20 0 DIADLO COC[C@H]([NH2+]Cc1oc(C(C)C)nc1C)c1cccc(Cl)c1 ZINC000428966771 338067083 /nfs/dbraw/zinc/06/70/83/338067083.db2.gz LCJQAKPNMFKYOZ-HNNXBMFYSA-N 1 2 322.836 4.237 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ncc(-c3ccccc3)o2)Cc2ccccc2O1 ZINC000429116858 338071094 /nfs/dbraw/zinc/07/10/94/338071094.db2.gz OMTZDTVGTMDVTF-OAHLLOKOSA-N 1 2 320.392 4.125 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ncc(-c3ccccc3)o2)Cc2ccccc2O1 ZINC000429116858 338071095 /nfs/dbraw/zinc/07/10/95/338071095.db2.gz OMTZDTVGTMDVTF-OAHLLOKOSA-N 1 2 320.392 4.125 20 0 DIADLO C[C@@H]1C[N@H+](Cc2coc(-c3ccccc3)n2)Cc2ccccc2O1 ZINC000429157323 338072241 /nfs/dbraw/zinc/07/22/41/338072241.db2.gz UWESJVFXWRPNSG-OAHLLOKOSA-N 1 2 320.392 4.125 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2coc(-c3ccccc3)n2)Cc2ccccc2O1 ZINC000429157323 338072242 /nfs/dbraw/zinc/07/22/42/338072242.db2.gz UWESJVFXWRPNSG-OAHLLOKOSA-N 1 2 320.392 4.125 20 0 DIADLO C[C@H]1CC[C@H](N(C)C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000429251955 338074863 /nfs/dbraw/zinc/07/48/63/338074863.db2.gz JPNCLLSAFONWOT-HOCLYGCPSA-N 1 2 310.397 4.135 20 0 DIADLO Cc1ccc(C(=O)N(C)[C@@H]2CC[C@H](C)C2)cc1Oc1cc[nH+]cc1 ZINC000429255824 338074965 /nfs/dbraw/zinc/07/49/65/338074965.db2.gz QSVPPSKXHXCELB-WMLDXEAASA-N 1 2 324.424 4.443 20 0 DIADLO Cc1ccc(C)c(C[N@@H+](C)[C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000429287365 338076647 /nfs/dbraw/zinc/07/66/47/338076647.db2.gz TZOGDNWGSDUJGM-CQSZACIVSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1ccc(C)c(C[N@H+](C)[C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000429287365 338076648 /nfs/dbraw/zinc/07/66/48/338076648.db2.gz TZOGDNWGSDUJGM-CQSZACIVSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000429367898 338078762 /nfs/dbraw/zinc/07/87/62/338078762.db2.gz WWAAXJKVOZWZMU-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000429367898 338078763 /nfs/dbraw/zinc/07/87/63/338078763.db2.gz WWAAXJKVOZWZMU-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1ncc(-c2ccccc2F)o1 ZINC000429378085 338078959 /nfs/dbraw/zinc/07/89/59/338078959.db2.gz LGZZEDPIMDQKAT-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1ncc(-c2ccccc2F)o1 ZINC000429378085 338078960 /nfs/dbraw/zinc/07/89/60/338078960.db2.gz LGZZEDPIMDQKAT-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1ccn(-c2ccc(Cl)cc2)n1 ZINC000429379773 338079140 /nfs/dbraw/zinc/07/91/40/338079140.db2.gz AUSQCRZUPUDIHJ-UHFFFAOYSA-N 1 2 315.804 4.059 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1ccn(-c2ccc(Cl)cc2)n1 ZINC000429379773 338079141 /nfs/dbraw/zinc/07/91/41/338079141.db2.gz AUSQCRZUPUDIHJ-UHFFFAOYSA-N 1 2 315.804 4.059 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)Cc3occc3C)cs2)o1 ZINC000429408116 338079850 /nfs/dbraw/zinc/07/98/50/338079850.db2.gz PJAGNDPVSUSCTJ-UHFFFAOYSA-N 1 2 302.399 4.245 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)Cc3occc3C)cs2)o1 ZINC000429408116 338079851 /nfs/dbraw/zinc/07/98/51/338079851.db2.gz PJAGNDPVSUSCTJ-UHFFFAOYSA-N 1 2 302.399 4.245 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000429410469 338080002 /nfs/dbraw/zinc/08/00/02/338080002.db2.gz QUZCDNLRRIBSMM-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000429410469 338080003 /nfs/dbraw/zinc/08/00/03/338080003.db2.gz QUZCDNLRRIBSMM-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2cc(C(C)(C)C)on2)cc1 ZINC000429712487 338087989 /nfs/dbraw/zinc/08/79/89/338087989.db2.gz BOBJDZZRWFNVDB-UHFFFAOYSA-N 1 2 302.418 4.003 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2cc(C(C)(C)C)on2)cc1 ZINC000429712487 338087990 /nfs/dbraw/zinc/08/79/90/338087990.db2.gz BOBJDZZRWFNVDB-UHFFFAOYSA-N 1 2 302.418 4.003 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1cccc(F)c1 ZINC000429780129 338089752 /nfs/dbraw/zinc/08/97/52/338089752.db2.gz CDMAQDKVELRLBY-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccc(F)c(F)c1 ZINC000429790285 338090018 /nfs/dbraw/zinc/09/00/18/338090018.db2.gz VQHVBBWEXJSQPX-ZETCQYMHSA-N 1 2 319.248 4.372 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccc(F)c(F)c1 ZINC000429790284 338090036 /nfs/dbraw/zinc/09/00/36/338090036.db2.gz VQHVBBWEXJSQPX-SSDOTTSWSA-N 1 2 319.248 4.372 20 0 DIADLO N#CN(Cc1cn2cc(Cl)ccc2[nH+]1)c1ccccc1Cl ZINC000429796644 338090174 /nfs/dbraw/zinc/09/01/74/338090174.db2.gz XGWDONRFBKGSQX-UHFFFAOYSA-N 1 2 317.179 4.129 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000430087574 338095546 /nfs/dbraw/zinc/09/55/46/338095546.db2.gz SPQLJBBUOSUHMU-IBGZPJMESA-N 1 2 310.441 4.452 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000430087574 338095547 /nfs/dbraw/zinc/09/55/47/338095547.db2.gz SPQLJBBUOSUHMU-IBGZPJMESA-N 1 2 310.441 4.452 20 0 DIADLO CC1(C)C[N@H+](C/C=C\c2ccc(F)cc2F)[C@H]1c1cccnc1 ZINC000430095570 338096263 /nfs/dbraw/zinc/09/62/63/338096263.db2.gz PUKCHTXEDQYOBO-SUZKBHRPSA-N 1 2 314.379 4.456 20 0 DIADLO CC1(C)C[N@@H+](C/C=C\c2ccc(F)cc2F)[C@H]1c1cccnc1 ZINC000430095570 338096264 /nfs/dbraw/zinc/09/62/64/338096264.db2.gz PUKCHTXEDQYOBO-SUZKBHRPSA-N 1 2 314.379 4.456 20 0 DIADLO CC1(C)C[N@H+](Cc2ccccc2OC(F)F)[C@@H]1c1cccnc1 ZINC000430100951 338096631 /nfs/dbraw/zinc/09/66/31/338096631.db2.gz BPTDSURRAIVKBR-MRXNPFEDSA-N 1 2 318.367 4.266 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccccc2OC(F)F)[C@@H]1c1cccnc1 ZINC000430100951 338096632 /nfs/dbraw/zinc/09/66/32/338096632.db2.gz BPTDSURRAIVKBR-MRXNPFEDSA-N 1 2 318.367 4.266 20 0 DIADLO CC1(C)C[N@H+](Cc2c[nH]nc2-c2ccsc2)[C@@H]1c1cccnc1 ZINC000430101804 338096688 /nfs/dbraw/zinc/09/66/88/338096688.db2.gz OHYBHCWGTKFIOA-QGZVFWFLSA-N 1 2 324.453 4.116 20 0 DIADLO CC1(C)C[N@@H+](Cc2c[nH]nc2-c2ccsc2)[C@@H]1c1cccnc1 ZINC000430101804 338096689 /nfs/dbraw/zinc/09/66/89/338096689.db2.gz OHYBHCWGTKFIOA-QGZVFWFLSA-N 1 2 324.453 4.116 20 0 DIADLO COc1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccnc2)c(Cl)c1 ZINC000430105018 338096811 /nfs/dbraw/zinc/09/68/11/338096811.db2.gz SGKYIFJEBMDJHD-KRWDZBQOSA-N 1 2 316.832 4.327 20 0 DIADLO COc1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)c(Cl)c1 ZINC000430105018 338096812 /nfs/dbraw/zinc/09/68/12/338096812.db2.gz SGKYIFJEBMDJHD-KRWDZBQOSA-N 1 2 316.832 4.327 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc3c2OC(C)(C)C3)[C@@H]1c1cccnc1 ZINC000430106015 338097064 /nfs/dbraw/zinc/09/70/64/338097064.db2.gz MNUGBAHCVWJBBL-LJQANCHMSA-N 1 2 322.452 4.378 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc3c2OC(C)(C)C3)[C@@H]1c1cccnc1 ZINC000430106015 338097065 /nfs/dbraw/zinc/09/70/65/338097065.db2.gz MNUGBAHCVWJBBL-LJQANCHMSA-N 1 2 322.452 4.378 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(Cl)c(F)c2)[C@H]1c1cccnc1 ZINC000430111799 338097501 /nfs/dbraw/zinc/09/75/01/338097501.db2.gz UTHAYURSGFBPQF-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(Cl)c(F)c2)[C@H]1c1cccnc1 ZINC000430111799 338097502 /nfs/dbraw/zinc/09/75/02/338097502.db2.gz UTHAYURSGFBPQF-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO CCOc1cccc(C[N@@H+]2CCCC[C@H]2c2nccn2CC)c1 ZINC000430881230 338117923 /nfs/dbraw/zinc/11/79/23/338117923.db2.gz ZHZOJDNJLHTMKO-SFHVURJKSA-N 1 2 313.445 4.029 20 0 DIADLO CCOc1cccc(C[N@H+]2CCCC[C@H]2c2nccn2CC)c1 ZINC000430881230 338117924 /nfs/dbraw/zinc/11/79/24/338117924.db2.gz ZHZOJDNJLHTMKO-SFHVURJKSA-N 1 2 313.445 4.029 20 0 DIADLO Cc1ccc(C)c2[nH+]c(-c3ccc(Oc4cnccn4)cc3)[nH]c21 ZINC000430939801 338119092 /nfs/dbraw/zinc/11/90/92/338119092.db2.gz MQNOQYNTRMTICZ-UHFFFAOYSA-N 1 2 316.364 4.429 20 0 DIADLO CCC(CC)(CC)[S@](=O)Cc1c[nH+]cn1Cc1ccccc1 ZINC000431192431 338125474 /nfs/dbraw/zinc/12/54/74/338125474.db2.gz MKKVSWYBTNHQPT-JOCHJYFZSA-N 1 2 318.486 4.149 20 0 DIADLO CCC(CC)(CC)[S@@](=O)Cc1c[nH+]cn1Cc1ccccc1 ZINC000431192432 338125520 /nfs/dbraw/zinc/12/55/20/338125520.db2.gz MKKVSWYBTNHQPT-QFIPXVFZSA-N 1 2 318.486 4.149 20 0 DIADLO CCc1ccc([C@H]2CCN(c3cc[nH+]c4ccncc43)C2)cc1 ZINC000431508888 338132851 /nfs/dbraw/zinc/13/28/51/338132851.db2.gz SLWPKPGZJDEIAF-KRWDZBQOSA-N 1 2 303.409 4.186 20 0 DIADLO Cc1ccc(COc2ccc(Oc3ccccc3)nc2)c(C)[nH+]1 ZINC000431876795 338140853 /nfs/dbraw/zinc/14/08/53/338140853.db2.gz DHDBTBPBIIRJQL-UHFFFAOYSA-N 1 2 306.365 4.465 20 0 DIADLO Cc1cccc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)n1 ZINC000432024481 338143912 /nfs/dbraw/zinc/14/39/12/338143912.db2.gz FRPBKRILCPAAMD-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1cccc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)n1 ZINC000432024481 338143913 /nfs/dbraw/zinc/14/39/13/338143913.db2.gz FRPBKRILCPAAMD-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO OC[C@@H]([NH2+]Cc1csc(Cl)c1Cl)c1ccc(F)cc1 ZINC000432249536 338150714 /nfs/dbraw/zinc/15/07/14/338150714.db2.gz FUIDORPNFJUOFM-LLVKDONJSA-N 1 2 320.216 4.017 20 0 DIADLO FC(F)Oc1ccc[nH+]c1NCc1ccc(C(F)(F)F)s1 ZINC000432404004 338154938 /nfs/dbraw/zinc/15/49/38/338154938.db2.gz CQGDXSOJRVCOQP-UHFFFAOYSA-N 1 2 324.274 4.375 20 0 DIADLO CCc1ccc(-c2ccc(CNc3cccc(CO)[nH+]3)o2)cc1 ZINC000432733430 338164635 /nfs/dbraw/zinc/16/46/35/338164635.db2.gz DYKOGTKBGHZOAE-UHFFFAOYSA-N 1 2 308.381 4.008 20 0 DIADLO CCn1nccc1CNc1ccc(-c2ccc(Cl)s2)c[nH+]1 ZINC000432733438 338164746 /nfs/dbraw/zinc/16/47/46/338164746.db2.gz FARCPNOKAGBCDY-UHFFFAOYSA-N 1 2 318.833 4.292 20 0 DIADLO OCc1cccc(NCc2ccc(-c3ccc(F)cc3)s2)[nH+]1 ZINC000432736735 338165042 /nfs/dbraw/zinc/16/50/42/338165042.db2.gz XYNXVBKIDFNHSF-UHFFFAOYSA-N 1 2 314.385 4.054 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2csc(Cl)c2Cl)s1 ZINC000432747189 338165982 /nfs/dbraw/zinc/16/59/82/338165982.db2.gz IJHOZPRVHATZGL-UHFFFAOYSA-N 1 2 307.271 4.452 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2csc(Cl)c2Cl)s1 ZINC000432747189 338165983 /nfs/dbraw/zinc/16/59/83/338165983.db2.gz IJHOZPRVHATZGL-UHFFFAOYSA-N 1 2 307.271 4.452 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CC=C(C(F)(F)F)CC3)sc2c1 ZINC000432753568 338166377 /nfs/dbraw/zinc/16/63/77/338166377.db2.gz DULVGUVRZHCMLH-UHFFFAOYSA-N 1 2 316.323 4.130 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CC=C(C(F)(F)F)CC3)sc2c1 ZINC000432753568 338166378 /nfs/dbraw/zinc/16/63/78/338166378.db2.gz DULVGUVRZHCMLH-UHFFFAOYSA-N 1 2 316.323 4.130 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ccc(F)c(Cl)c2Cl)n1 ZINC000432754484 338166772 /nfs/dbraw/zinc/16/67/72/338166772.db2.gz ZXSISJDZKQCIEH-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ccc(F)c(Cl)c2Cl)n1 ZINC000432754484 338166773 /nfs/dbraw/zinc/16/67/73/338166773.db2.gz ZXSISJDZKQCIEH-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2nnc(C(C)(C)C)[nH]2)o1 ZINC000432816383 338168869 /nfs/dbraw/zinc/16/88/69/338168869.db2.gz PJLAIAZZRZEHDW-CQSZACIVSA-N 1 2 316.449 4.121 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2nnc(C(C)(C)C)[nH]2)o1 ZINC000432816383 338168870 /nfs/dbraw/zinc/16/88/70/338168870.db2.gz PJLAIAZZRZEHDW-CQSZACIVSA-N 1 2 316.449 4.121 20 0 DIADLO Cc1ccc([C@]2(C)CCN(c3cc[nH+]c4ccncc43)C2)cc1 ZINC000432926527 338173602 /nfs/dbraw/zinc/17/36/02/338173602.db2.gz GWCKBDQSDJWKPV-HXUWFJFHSA-N 1 2 303.409 4.106 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nnc(C(C)(C)C)[nH]2)cc1C ZINC000432933265 338173992 /nfs/dbraw/zinc/17/39/92/338173992.db2.gz MPXFRZPXFMHAPS-INIZCTEOSA-N 1 2 312.461 4.056 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nnc(C(C)(C)C)[nH]2)cc1C ZINC000432933265 338173993 /nfs/dbraw/zinc/17/39/93/338173993.db2.gz MPXFRZPXFMHAPS-INIZCTEOSA-N 1 2 312.461 4.056 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nnc(C(C)(C)C)[nH]2)cc1C ZINC000432933266 338174016 /nfs/dbraw/zinc/17/40/16/338174016.db2.gz MPXFRZPXFMHAPS-MRXNPFEDSA-N 1 2 312.461 4.056 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2nnc(C(C)(C)C)[nH]2)cc1C ZINC000432933266 338174017 /nfs/dbraw/zinc/17/40/17/338174017.db2.gz MPXFRZPXFMHAPS-MRXNPFEDSA-N 1 2 312.461 4.056 20 0 DIADLO CCc1ccc([C@H]2CCN(C(=O)Nc3ccc(C)[nH+]c3C)C2)cc1 ZINC000433018594 338176492 /nfs/dbraw/zinc/17/64/92/338176492.db2.gz FGBHLPRZGBFMTA-SFHVURJKSA-N 1 2 323.440 4.282 20 0 DIADLO FC(F)[C@@H]([NH2+]CCCOCc1ccccc1)c1ccccc1 ZINC000433044947 338178038 /nfs/dbraw/zinc/17/80/38/338178038.db2.gz LCQXCWAOSBDXNM-KRWDZBQOSA-N 1 2 305.368 4.189 20 0 DIADLO FC(F)[C@H]([NH2+]CCCOCCc1ccccc1)c1ccccc1 ZINC000433049444 338178648 /nfs/dbraw/zinc/17/86/48/338178648.db2.gz UVSQYFRVNDKTOQ-GOSISDBHSA-N 1 2 319.395 4.232 20 0 DIADLO Fc1cc(C[NH2+]Cc2csc(C3CC3)n2)c(F)cc1Cl ZINC000433198970 338185384 /nfs/dbraw/zinc/18/53/84/338185384.db2.gz AQELLRSXZYDSLU-UHFFFAOYSA-N 1 2 314.788 4.242 20 0 DIADLO Cc1cc(F)ccc1C(=O)Nc1ccc2[nH+]c(N(C)C)ccc2c1 ZINC000433712869 338199954 /nfs/dbraw/zinc/19/99/54/338199954.db2.gz JBZGASGTPDVDRR-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000433782946 338201713 /nfs/dbraw/zinc/20/17/13/338201713.db2.gz LRFIOQOHPLINEH-XHDPSFHLSA-N 1 2 307.825 4.333 20 0 DIADLO Cc1nc2[nH]ccc2c(N(C)[C@@H](C)c2cc3ccccc3o2)[nH+]1 ZINC000433782932 338201761 /nfs/dbraw/zinc/20/17/61/338201761.db2.gz LNTMHZQVXGEPFY-NSHDSACASA-N 1 2 306.369 4.210 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)o1 ZINC000433788864 338201883 /nfs/dbraw/zinc/20/18/83/338201883.db2.gz JPKNNCJNANWVGB-ABAIWWIYSA-N 1 2 307.825 4.333 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2ncnn2C(C)C)c2ccccc2)cc1 ZINC000434473938 338216796 /nfs/dbraw/zinc/21/67/96/338216796.db2.gz JNKWZIYUHIQOFQ-FQEVSTJZSA-N 1 2 320.440 4.047 20 0 DIADLO CC(C)c1noc(C[N@@H+](C)[C@@H](c2ccc(F)cc2)C(C)C)n1 ZINC000434619020 338221300 /nfs/dbraw/zinc/22/13/00/338221300.db2.gz BRBMFUKQWAAETK-MRXNPFEDSA-N 1 2 305.397 4.161 20 0 DIADLO CC(C)c1noc(C[N@H+](C)[C@@H](c2ccc(F)cc2)C(C)C)n1 ZINC000434619020 338221301 /nfs/dbraw/zinc/22/13/01/338221301.db2.gz BRBMFUKQWAAETK-MRXNPFEDSA-N 1 2 305.397 4.161 20 0 DIADLO CCCCc1nc(C[N@H+](C)[C@@H](c2ccc(F)cc2)C(C)C)no1 ZINC000434622245 338221441 /nfs/dbraw/zinc/22/14/41/338221441.db2.gz CAFAJWUBMZZJSP-GOSISDBHSA-N 1 2 319.424 4.380 20 0 DIADLO CCCCc1nc(C[N@@H+](C)[C@@H](c2ccc(F)cc2)C(C)C)no1 ZINC000434622245 338221442 /nfs/dbraw/zinc/22/14/42/338221442.db2.gz CAFAJWUBMZZJSP-GOSISDBHSA-N 1 2 319.424 4.380 20 0 DIADLO Cc1cccc([C@@H](C)[S@@](=O)Cc2[nH+]ccn2-c2ccccc2)c1 ZINC000434629879 338221933 /nfs/dbraw/zinc/22/19/33/338221933.db2.gz ROXPTVAJUMIHIU-MWTRTKDXSA-N 1 2 324.449 4.191 20 0 DIADLO Cc1ccc2[nH+]cc(/C=C\c3ncc(Br)s3)n2c1 ZINC000434633104 338222092 /nfs/dbraw/zinc/22/20/92/338222092.db2.gz DQHXSSWUTXFYEY-HYXAFXHYSA-N 1 2 320.215 4.032 20 0 DIADLO CC1(C)CCC([S@](=O)Cc2[nH+]ccn2-c2ccccc2)CC1 ZINC000434635487 338222239 /nfs/dbraw/zinc/22/22/39/338222239.db2.gz GIAYNDSLTVLZCH-JOCHJYFZSA-N 1 2 316.470 4.090 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000434897131 338227147 /nfs/dbraw/zinc/22/71/47/338227147.db2.gz USOIFTRELJUZQO-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000434897131 338227148 /nfs/dbraw/zinc/22/71/48/338227148.db2.gz USOIFTRELJUZQO-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO CC(C)c1noc(C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)n1 ZINC000434907172 338227947 /nfs/dbraw/zinc/22/79/47/338227947.db2.gz PXMBJWJSDQAWIX-UHFFFAOYSA-N 1 2 317.820 4.136 20 0 DIADLO CC(C)c1noc(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)n1 ZINC000434907172 338227948 /nfs/dbraw/zinc/22/79/48/338227948.db2.gz PXMBJWJSDQAWIX-UHFFFAOYSA-N 1 2 317.820 4.136 20 0 DIADLO C[C@H]1CC[C@]2(CC[N@H+](Cc3ncc(C(F)(F)F)s3)C2)C1 ZINC000434980869 338228473 /nfs/dbraw/zinc/22/84/73/338228473.db2.gz HHHDIKJRCWEIHJ-GWCFXTLKSA-N 1 2 304.381 4.174 20 0 DIADLO C[C@H]1CC[C@]2(CC[N@@H+](Cc3ncc(C(F)(F)F)s3)C2)C1 ZINC000434980869 338228474 /nfs/dbraw/zinc/22/84/74/338228474.db2.gz HHHDIKJRCWEIHJ-GWCFXTLKSA-N 1 2 304.381 4.174 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c(OC(F)F)c1 ZINC000434990516 338229169 /nfs/dbraw/zinc/22/91/69/338229169.db2.gz IXQZBVFYCNJCMV-MRXNPFEDSA-N 1 2 319.351 4.244 20 0 DIADLO COc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)c(OC(F)F)c1 ZINC000434990516 338229170 /nfs/dbraw/zinc/22/91/70/338229170.db2.gz IXQZBVFYCNJCMV-MRXNPFEDSA-N 1 2 319.351 4.244 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+](C)Cc1ccc(-c2cc[nH]n2)o1 ZINC000435134422 338232925 /nfs/dbraw/zinc/23/29/25/338232925.db2.gz HPNCZUBHPIIDMF-LLVKDONJSA-N 1 2 317.339 4.141 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccc(-c2cc[nH]n2)o1 ZINC000435134422 338232926 /nfs/dbraw/zinc/23/29/26/338232926.db2.gz HPNCZUBHPIIDMF-LLVKDONJSA-N 1 2 317.339 4.141 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCC[C@@H]2c2ccccc2)s1 ZINC000435135173 338233025 /nfs/dbraw/zinc/23/30/25/338233025.db2.gz MUNLPMFMXMGVNS-GFCCVEGCSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCC[C@@H]2c2ccccc2)s1 ZINC000435135173 338233026 /nfs/dbraw/zinc/23/30/26/338233026.db2.gz MUNLPMFMXMGVNS-GFCCVEGCSA-N 1 2 312.360 4.499 20 0 DIADLO COc1ccc(C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1C1CC1 ZINC000435537887 338241774 /nfs/dbraw/zinc/24/17/74/338241774.db2.gz YIRWRDNYAAGPPW-UHFFFAOYSA-N 1 2 310.397 4.145 20 0 DIADLO CCc1ccnc(CNc2[nH+]cccc2OCc2ccccc2)c1 ZINC000435603810 338243380 /nfs/dbraw/zinc/24/33/80/338243380.db2.gz ADZJUPUDECPEII-UHFFFAOYSA-N 1 2 319.408 4.230 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)[C@@H](C)CCC(C)(C)C ZINC000435996577 338255379 /nfs/dbraw/zinc/25/53/79/338255379.db2.gz UJBZNKPLAXZJGK-JKSUJKDBSA-N 1 2 319.493 4.419 20 0 DIADLO C[C@@H]1CC[C@H](C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)C1 ZINC000436173082 338260608 /nfs/dbraw/zinc/26/06/08/338260608.db2.gz AJMGKRBMSZARMX-ZBFHGGJFSA-N 1 2 323.440 4.261 20 0 DIADLO CCC(CC)C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436179319 338260814 /nfs/dbraw/zinc/26/08/14/338260814.db2.gz VPJUCOVONBQVRV-UHFFFAOYSA-N 1 2 311.429 4.261 20 0 DIADLO COCc1cccc(CNc2cc[nH+]c3c(OC)cccc23)c1 ZINC000436181084 338260874 /nfs/dbraw/zinc/26/08/74/338260874.db2.gz NISBJIQHBSPZTP-UHFFFAOYSA-N 1 2 308.381 4.002 20 0 DIADLO Cc1cc[nH]c1C(=O)Nc1ccc2[nH]c(C3CCCCC3)[nH+]c2c1 ZINC000436216882 338262181 /nfs/dbraw/zinc/26/21/81/338262181.db2.gz GAUIVZRGQZSKDC-UHFFFAOYSA-N 1 2 322.412 4.499 20 0 DIADLO CC1=CCC[N@H+](CC(=O)Nc2ccccc2Oc2ccccc2)C1 ZINC000436263175 338264244 /nfs/dbraw/zinc/26/42/44/338264244.db2.gz SYYMQKSYZHCWMC-UHFFFAOYSA-N 1 2 322.408 4.069 20 0 DIADLO CC1=CCC[N@@H+](CC(=O)Nc2ccccc2Oc2ccccc2)C1 ZINC000436263175 338264245 /nfs/dbraw/zinc/26/42/45/338264245.db2.gz SYYMQKSYZHCWMC-UHFFFAOYSA-N 1 2 322.408 4.069 20 0 DIADLO COCCC1(CNc2cccc(-n3cc[nH+]c3)c2)CCCCC1 ZINC000436283080 338265738 /nfs/dbraw/zinc/26/57/38/338265738.db2.gz KQGWGVSIFHKROQ-UHFFFAOYSA-N 1 2 313.445 4.271 20 0 DIADLO CCOc1ccc([C@H]([NH2+]CCF)c2ccccc2Cl)cc1 ZINC000436295892 338267174 /nfs/dbraw/zinc/26/71/74/338267174.db2.gz SLAXZYUDZXLCRH-KRWDZBQOSA-N 1 2 307.796 4.387 20 0 DIADLO CCCCn1cc(CNc2cc[nH+]c3c(OC)cccc23)c(C)n1 ZINC000436456791 338272890 /nfs/dbraw/zinc/27/28/90/338272890.db2.gz UTIWDQBDTLESFR-UHFFFAOYSA-N 1 2 324.428 4.161 20 0 DIADLO COc1cc(C[NH+](Cc2ccco2)Cc2ccco2)ccc1C ZINC000436482105 338273624 /nfs/dbraw/zinc/27/36/24/338273624.db2.gz GQFMOKQXIRBDKV-UHFFFAOYSA-N 1 2 311.381 4.392 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@H](C)[C@H]3CCCC[C@@H]32)c(C)[nH+]1 ZINC000436488231 338274042 /nfs/dbraw/zinc/27/40/42/338274042.db2.gz DNHUESHJOCDYTI-MAZHCROVSA-N 1 2 301.434 4.049 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2ccc(Cl)c(C)c2)c(C)[nH+]1 ZINC000436497487 338274263 /nfs/dbraw/zinc/27/42/63/338274263.db2.gz SXIMYBPQEQEIGW-UHFFFAOYSA-N 1 2 317.820 4.290 20 0 DIADLO Cc1ccc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)c(O)c1 ZINC000436542606 338276333 /nfs/dbraw/zinc/27/63/33/338276333.db2.gz AHIXXPNFHGRILT-UHFFFAOYSA-N 1 2 320.348 4.140 20 0 DIADLO CCc1cccc(CC)c1NC(=O)[C@@H](C)[NH+]1Cc2ccccc2C1 ZINC000155464707 338282232 /nfs/dbraw/zinc/28/22/32/338282232.db2.gz MMZOXTVFHKOMEK-OAHLLOKOSA-N 1 2 322.452 4.154 20 0 DIADLO Cc1cc(-c2noc([C@H](C)[NH+]3Cc4ccccc4C3)n2)ccc1F ZINC000155545960 338289445 /nfs/dbraw/zinc/28/94/45/338289445.db2.gz JVVSVJNGTDMSFK-ZDUSSCGKSA-N 1 2 323.371 4.261 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@@H](C)c1cc(Cl)ccc1Cl ZINC000436863407 338290333 /nfs/dbraw/zinc/29/03/33/338290333.db2.gz KGKYUJJOOJLXTG-JTQLQIEISA-N 1 2 324.211 4.001 20 0 DIADLO CC(C)n1cc[nH+]c1CN1CCc2cc(Cl)cc(Cl)c2C1 ZINC000437515024 338312267 /nfs/dbraw/zinc/31/22/67/338312267.db2.gz LDRUNJUPGNZJQK-UHFFFAOYSA-N 1 2 324.255 4.329 20 0 DIADLO Cc1cccc(C[N@@H+]2CCc3cc(Cl)cc(Cl)c3C2)n1 ZINC000437533969 338312570 /nfs/dbraw/zinc/31/25/70/338312570.db2.gz GLBCOYUPCOWIQM-UHFFFAOYSA-N 1 2 307.224 4.255 20 0 DIADLO Cc1cccc(C[N@H+]2CCc3cc(Cl)cc(Cl)c3C2)n1 ZINC000437533969 338312571 /nfs/dbraw/zinc/31/25/71/338312571.db2.gz GLBCOYUPCOWIQM-UHFFFAOYSA-N 1 2 307.224 4.255 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000437604235 338315963 /nfs/dbraw/zinc/31/59/63/338315963.db2.gz NVHMXXFEADTJTP-JLTOFOAXSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000437604235 338315964 /nfs/dbraw/zinc/31/59/64/338315964.db2.gz NVHMXXFEADTJTP-JLTOFOAXSA-N 1 2 324.399 4.269 20 0 DIADLO Cc1cccc(Cl)c1OCc1c[nH+]cn1Cc1ccccc1 ZINC000437624412 338316429 /nfs/dbraw/zinc/31/64/29/338316429.db2.gz JEQBSOGDDBROOF-UHFFFAOYSA-N 1 2 312.800 4.472 20 0 DIADLO Fc1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]3c3ncc[nH]3)o2)cc1 ZINC000437955483 338326236 /nfs/dbraw/zinc/32/62/36/338326236.db2.gz MXXHJRPZIVQMKH-MRXNPFEDSA-N 1 2 311.360 4.146 20 0 DIADLO Fc1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3c3ncc[nH]3)o2)cc1 ZINC000437955483 338326237 /nfs/dbraw/zinc/32/62/37/338326237.db2.gz MXXHJRPZIVQMKH-MRXNPFEDSA-N 1 2 311.360 4.146 20 0 DIADLO CC[C@H](C)C[C@H](C)NC(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000437980001 338327185 /nfs/dbraw/zinc/32/71/85/338327185.db2.gz RYITZGCXDNMXNO-KBPBESRZSA-N 1 2 314.433 4.033 20 0 DIADLO C[N@H+](Cc1ccon1)Cc1ccc(Oc2ccccc2)c(F)c1 ZINC000438070975 338329830 /nfs/dbraw/zinc/32/98/30/338329830.db2.gz FVBDEJMEMRQCSZ-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO C[N@@H+](Cc1ccon1)Cc1ccc(Oc2ccccc2)c(F)c1 ZINC000438070975 338329831 /nfs/dbraw/zinc/32/98/31/338329831.db2.gz FVBDEJMEMRQCSZ-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000438135005 338333889 /nfs/dbraw/zinc/33/38/89/338333889.db2.gz UTSTWYYMDBRQNS-BBRMVZONSA-N 1 2 314.433 4.075 20 0 DIADLO CCC(CC)c1noc([C@H]2CCC[N@@H+]2Cc2ccc(F)cc2)n1 ZINC000438235573 338337495 /nfs/dbraw/zinc/33/74/95/338337495.db2.gz KRPARMBGAWHXON-MRXNPFEDSA-N 1 2 317.408 4.449 20 0 DIADLO CCC(CC)c1noc([C@H]2CCC[N@H+]2Cc2ccc(F)cc2)n1 ZINC000438235573 338337496 /nfs/dbraw/zinc/33/74/96/338337496.db2.gz KRPARMBGAWHXON-MRXNPFEDSA-N 1 2 317.408 4.449 20 0 DIADLO CCc1ccccc1CSCc1[nH+]ccn1CC(F)(F)F ZINC000438307452 338339079 /nfs/dbraw/zinc/33/90/79/338339079.db2.gz SEXHCXQGACYYIS-UHFFFAOYSA-N 1 2 314.376 4.441 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3C[C@H](C)O[C@H](C)[C@@H]3C)cs2)cc1 ZINC000438366080 338341511 /nfs/dbraw/zinc/34/15/11/338341511.db2.gz UNKXVJWWARSZEY-SOUVJXGZSA-N 1 2 316.470 4.116 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3C[C@H](C)O[C@H](C)[C@@H]3C)cs2)cc1 ZINC000438366080 338341512 /nfs/dbraw/zinc/34/15/12/338341512.db2.gz UNKXVJWWARSZEY-SOUVJXGZSA-N 1 2 316.470 4.116 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H](c3cccc(Cl)c3)OC[C@@H]2C)cn1 ZINC000438550807 338347689 /nfs/dbraw/zinc/34/76/89/338347689.db2.gz BPGONHZIGBDWLU-KSSFIOAISA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H](c3cccc(Cl)c3)OC[C@@H]2C)cn1 ZINC000438550807 338347690 /nfs/dbraw/zinc/34/76/90/338347690.db2.gz BPGONHZIGBDWLU-KSSFIOAISA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccoc1C[N@H+]1C[C@@H](c2cccc(Cl)c2)OC[C@H]1C ZINC000438553581 338347892 /nfs/dbraw/zinc/34/78/92/338347892.db2.gz LNHYMFMATWGCBC-DYVFJYSZSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccoc1C[N@@H+]1C[C@@H](c2cccc(Cl)c2)OC[C@H]1C ZINC000438553581 338347893 /nfs/dbraw/zinc/34/78/93/338347893.db2.gz LNHYMFMATWGCBC-DYVFJYSZSA-N 1 2 305.805 4.203 20 0 DIADLO CCCc1noc(C[N@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)n1 ZINC000438723870 338351283 /nfs/dbraw/zinc/35/12/83/338351283.db2.gz NYKCEONDSZUCCE-GFCCVEGCSA-N 1 2 319.836 4.401 20 0 DIADLO CCCc1noc(C[N@@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)n1 ZINC000438723870 338351284 /nfs/dbraw/zinc/35/12/84/338351284.db2.gz NYKCEONDSZUCCE-GFCCVEGCSA-N 1 2 319.836 4.401 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CCCCC[C@@H]2c2ccncc2)c1F ZINC000438856554 338354063 /nfs/dbraw/zinc/35/40/63/338354063.db2.gz XBURTMYYIOMIFI-MRXNPFEDSA-N 1 2 318.367 4.183 20 0 DIADLO Oc1ccc(F)c(C[N@H+]2CCCCC[C@@H]2c2ccncc2)c1F ZINC000438856554 338354064 /nfs/dbraw/zinc/35/40/64/338354064.db2.gz XBURTMYYIOMIFI-MRXNPFEDSA-N 1 2 318.367 4.183 20 0 DIADLO C[C@H](CSCc1[nH+]ccn1Cc1ccccc1)C(F)(F)F ZINC000439033652 338359110 /nfs/dbraw/zinc/35/91/10/338359110.db2.gz MYCDNLFKWVLTCL-GFCCVEGCSA-N 1 2 314.376 4.363 20 0 DIADLO C[C@@H](CSCc1[nH+]ccn1Cc1ccccc1)C(F)(F)F ZINC000439033653 338359144 /nfs/dbraw/zinc/35/91/44/338359144.db2.gz MYCDNLFKWVLTCL-LBPRGKRZSA-N 1 2 314.376 4.363 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+]3CCC[C@@H](C(F)(F)F)C3)o2)cc1 ZINC000439312543 338366803 /nfs/dbraw/zinc/36/68/03/338366803.db2.gz CRCCFOYQTTUPFQ-CQSZACIVSA-N 1 2 324.346 4.424 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+]3CCC[C@@H](C(F)(F)F)C3)o2)cc1 ZINC000439312543 338366804 /nfs/dbraw/zinc/36/68/04/338366804.db2.gz CRCCFOYQTTUPFQ-CQSZACIVSA-N 1 2 324.346 4.424 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+]1CCCc2c3cccc(F)c3[nH]c2C1 ZINC000439463402 338370307 /nfs/dbraw/zinc/37/03/07/338370307.db2.gz BLXUSQPRPGRDQM-CYBMUJFWSA-N 1 2 309.388 4.211 20 0 DIADLO C[C@H](c1ccccn1)[N@H+]1CCCc2c3cccc(F)c3[nH]c2C1 ZINC000439463402 338370308 /nfs/dbraw/zinc/37/03/08/338370308.db2.gz BLXUSQPRPGRDQM-CYBMUJFWSA-N 1 2 309.388 4.211 20 0 DIADLO CC(C)=CC[N@H+](Cc1ccc(Cl)cc1)Cc1ncc(C)cn1 ZINC000439481640 338371213 /nfs/dbraw/zinc/37/12/13/338371213.db2.gz KNVGHYSJNARPDL-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO CC(C)=CC[N@@H+](Cc1ccc(Cl)cc1)Cc1ncc(C)cn1 ZINC000439481640 338371214 /nfs/dbraw/zinc/37/12/14/338371214.db2.gz KNVGHYSJNARPDL-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO CC(C)=CC[N@H+](Cc1ccc(Cl)cc1)Cc1ncccn1 ZINC000439488235 338371519 /nfs/dbraw/zinc/37/15/19/338371519.db2.gz WKMPGEJCURBWAF-UHFFFAOYSA-N 1 2 301.821 4.098 20 0 DIADLO CC(C)=CC[N@@H+](Cc1ccc(Cl)cc1)Cc1ncccn1 ZINC000439488235 338371520 /nfs/dbraw/zinc/37/15/20/338371520.db2.gz WKMPGEJCURBWAF-UHFFFAOYSA-N 1 2 301.821 4.098 20 0 DIADLO COC(=O)[C@@H]([NH2+][C@@H](C)C1CCCCC1)c1cccc(Cl)c1 ZINC000439586887 338373923 /nfs/dbraw/zinc/37/39/23/338373923.db2.gz JXOZXXHKEGGFQW-LRDDRELGSA-N 1 2 309.837 4.113 20 0 DIADLO COC(=O)[C@H]([NH2+][C@@H]1CC[C@@H]2CCC[C@H]2C1)c1cccc(Cl)c1 ZINC000439616432 338374663 /nfs/dbraw/zinc/37/46/63/338374663.db2.gz JKSJMJWSIXIGEP-WRFANHODSA-N 1 2 321.848 4.113 20 0 DIADLO COc1ccc2occ(C(=O)Nc3c(C)cc(C)[nH+]c3C)c2c1 ZINC000440416657 338386967 /nfs/dbraw/zinc/38/69/67/338386967.db2.gz AWBCTQHOMLXQJY-UHFFFAOYSA-N 1 2 310.353 4.014 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+](C)Cc1cnc(C(C)C)nc1 ZINC000440466058 338387767 /nfs/dbraw/zinc/38/77/67/338387767.db2.gz FEOTVNVFENTVTE-UHFFFAOYSA-N 1 2 313.445 4.019 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+](C)Cc1cnc(C(C)C)nc1 ZINC000440466058 338387768 /nfs/dbraw/zinc/38/77/68/338387768.db2.gz FEOTVNVFENTVTE-UHFFFAOYSA-N 1 2 313.445 4.019 20 0 DIADLO CC(C)c1ncc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)cn1 ZINC000440475525 338388168 /nfs/dbraw/zinc/38/81/68/338388168.db2.gz DSGGJPRZYSDNLV-ZDUSSCGKSA-N 1 2 303.837 4.446 20 0 DIADLO CC(C)c1ncc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)cn1 ZINC000440475525 338388169 /nfs/dbraw/zinc/38/81/69/338388169.db2.gz DSGGJPRZYSDNLV-ZDUSSCGKSA-N 1 2 303.837 4.446 20 0 DIADLO COc1cccc2c(N[C@H]3CCCC[C@@H]3n3cccn3)cc[nH+]c12 ZINC000440661887 338394690 /nfs/dbraw/zinc/39/46/90/338394690.db2.gz RBUADLSPTFTLCR-IRXDYDNUSA-N 1 2 322.412 4.036 20 0 DIADLO COc1cccc2c(N[C@@H]3CCCC[C@@H]3n3cccn3)cc[nH+]c12 ZINC000440661888 338394703 /nfs/dbraw/zinc/39/47/03/338394703.db2.gz RBUADLSPTFTLCR-SJORKVTESA-N 1 2 322.412 4.036 20 0 DIADLO COc1ccc([C@H](C)Nc2cc[nH+]c3c(OC)cccc23)cc1 ZINC000440674418 338395019 /nfs/dbraw/zinc/39/50/19/338395019.db2.gz RDXVQWYGBZWSNU-ZDUSSCGKSA-N 1 2 308.381 4.425 20 0 DIADLO Cc1nc(N2CCC[C@H]2c2ccc(F)cc2)c2c([nH+]1)CCCC2 ZINC000440721581 338395969 /nfs/dbraw/zinc/39/59/69/338395969.db2.gz JIQIXESSDZMDHY-SFHVURJKSA-N 1 2 311.404 4.144 20 0 DIADLO CC[C@@H](F)C[N@@H+]1CCC[C@H]1c1nc(-c2cccc(C)c2)c[nH]1 ZINC000440778122 338397212 /nfs/dbraw/zinc/39/72/12/338397212.db2.gz AGRPMMGWPHKHJH-WBVHZDCISA-N 1 2 301.409 4.270 20 0 DIADLO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1nc(-c2cccc(C)c2)c[nH]1 ZINC000440778122 338397213 /nfs/dbraw/zinc/39/72/13/338397213.db2.gz AGRPMMGWPHKHJH-WBVHZDCISA-N 1 2 301.409 4.270 20 0 DIADLO CC[C@H](C)CC(=O)N(Cc1[nH]cc[nH+]1)c1cc(C)ccc1Cl ZINC000440870375 338398881 /nfs/dbraw/zinc/39/88/81/338398881.db2.gz CQJNHJPGMAVGRQ-LBPRGKRZSA-N 1 2 319.836 4.341 20 0 DIADLO Cc1ccc(Cl)c(N(Cc2[nH]cc[nH+]2)C(=O)CC2CCC2)c1 ZINC000440899181 338399485 /nfs/dbraw/zinc/39/94/85/338399485.db2.gz GQWMHJJTXBTWQD-UHFFFAOYSA-N 1 2 317.820 4.095 20 0 DIADLO Cc1ccc(Cl)c(N(Cc2[nH]cc[nH+]2)C(=O)CCC(C)C)c1 ZINC000440901014 338399641 /nfs/dbraw/zinc/39/96/41/338399641.db2.gz KWWYVRWPGLXIFV-UHFFFAOYSA-N 1 2 319.836 4.341 20 0 DIADLO CCSCc1cc[nH+]c(N[C@H]2Cc3[nH]c4ccccc4c3C2)c1 ZINC000442825242 338433658 /nfs/dbraw/zinc/43/36/58/338433658.db2.gz LCLRVBKXSQPBBL-CQSZACIVSA-N 1 2 323.465 4.395 20 0 DIADLO Cc1ccccc1C1CC[NH+](Cc2cc(C(F)(F)F)n[nH]2)CC1 ZINC000442849965 338434512 /nfs/dbraw/zinc/43/45/12/338434512.db2.gz HSFKYYOUJAGOFY-UHFFFAOYSA-N 1 2 323.362 4.117 20 0 DIADLO Cc1ccc(NC(=O)c2csc3c2CC[C@H](C)C3)c(C)[nH+]1 ZINC000446439516 338528102 /nfs/dbraw/zinc/52/81/02/338528102.db2.gz SHCCPZJLHRCSKH-JTQLQIEISA-N 1 2 300.427 4.137 20 0 DIADLO Cc1cc(N2CC[C@@H](C)[C@@H]2c2ccc(C(F)(F)F)cc2)nc[nH+]1 ZINC000446879848 338539191 /nfs/dbraw/zinc/53/91/91/338539191.db2.gz URXDYWWATYNQNL-BDJLRTHQSA-N 1 2 321.346 4.391 20 0 DIADLO CC(C)(c1ccccc1)[S@](=O)Cc1[nH+]ccn1-c1ccccc1 ZINC000447148658 338546401 /nfs/dbraw/zinc/54/64/01/338546401.db2.gz YKXABUVABDFDHW-HSZRJFAPSA-N 1 2 324.449 4.056 20 0 DIADLO Cc1ccc(NC(=O)N(C)Cc2ccc(C(C)C)cc2)c(C)[nH+]1 ZINC000447175279 338546870 /nfs/dbraw/zinc/54/68/70/338546870.db2.gz IWWDDASVGGTITM-UHFFFAOYSA-N 1 2 311.429 4.486 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H](C)C(C)(C)c2ccccc2)c(C)[nH+]1 ZINC000447183352 338547056 /nfs/dbraw/zinc/54/70/56/338547056.db2.gz SBEZPYAVYJPNQP-HNNXBMFYSA-N 1 2 311.429 4.186 20 0 DIADLO C[C@H]1CC(C)(C)C[C@H]1Nc1ccccc1OCCn1cc[nH+]c1 ZINC000447595405 338560941 /nfs/dbraw/zinc/56/09/41/338560941.db2.gz NISQJJDXGGZGEE-DOTOQJQBSA-N 1 2 313.445 4.199 20 0 DIADLO COc1cc(F)ccc1N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000194570101 338568527 /nfs/dbraw/zinc/56/85/27/338568527.db2.gz AGBIUNZULRHNJQ-ZDUSSCGKSA-N 1 2 311.360 4.193 20 0 DIADLO CC(C)CC(CC(C)C)C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000448834327 338576565 /nfs/dbraw/zinc/57/65/65/338576565.db2.gz ISAUPGZVNKPQPA-INIZCTEOSA-N 1 2 305.466 4.172 20 0 DIADLO CC[C@@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c21)c1nccs1 ZINC000449159814 338597952 /nfs/dbraw/zinc/59/79/52/338597952.db2.gz IWVCHDWOXAEHFK-MNOVXSKESA-N 1 2 312.360 4.289 20 0 DIADLO CC[C@H]([NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21)c1nccs1 ZINC000449159816 338597965 /nfs/dbraw/zinc/59/79/65/338597965.db2.gz IWVCHDWOXAEHFK-WDEREUQCSA-N 1 2 312.360 4.289 20 0 DIADLO Fc1ccc([C@H](CC(F)(F)F)[NH2+]Cc2ccncc2F)cc1 ZINC000449207680 338602516 /nfs/dbraw/zinc/60/25/16/338602516.db2.gz CMFIBYGCTOQEJG-AWEZNQCLSA-N 1 2 316.273 4.143 20 0 DIADLO Cn1cc[nH+]c1[C@@H]1N(Cc2cccc(Cl)c2Cl)CC1(C)C ZINC000449416921 338622787 /nfs/dbraw/zinc/62/27/87/338622787.db2.gz WJRHYKPNPDYAPY-AWEZNQCLSA-N 1 2 324.255 4.310 20 0 DIADLO FC1(Cc2ccc(Cl)cc2)CC[NH+](Cc2cscn2)CC1 ZINC000449500775 338632277 /nfs/dbraw/zinc/63/22/77/338632277.db2.gz NIMZFTOGGQHPLY-UHFFFAOYSA-N 1 2 324.852 4.343 20 0 DIADLO C[C@H]1C[C@H]([NH2+]Cc2csc(Cl)c2Cl)c2nccn21 ZINC000449568589 338638520 /nfs/dbraw/zinc/63/85/20/338638520.db2.gz BRNPTZSRPIZOTP-CBAPKCEASA-N 1 2 302.230 4.047 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H]3C[C@H](C)n4ccnc43)cs2)cc1 ZINC000449572825 338639136 /nfs/dbraw/zinc/63/91/36/338639136.db2.gz OFEWEVXSNFNBBV-XJKSGUPXSA-N 1 2 324.453 4.111 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccc(F)c(F)c1 ZINC000450684246 338698872 /nfs/dbraw/zinc/69/88/72/338698872.db2.gz RFRYKSZNQQNLDA-OAHLLOKOSA-N 1 2 323.412 4.181 20 0 DIADLO Fc1ccc2cc[nH+]c(NC[C@@H]3CCOC4(CCC4)C3)c2c1 ZINC000450711950 338700473 /nfs/dbraw/zinc/70/04/73/338700473.db2.gz DJOLPILZZQFBRX-CYBMUJFWSA-N 1 2 300.377 4.135 20 0 DIADLO COc1cccc2c1cc[nH+]c2NC[C@H]1CCOC2(CCC2)C1 ZINC000450721764 338701158 /nfs/dbraw/zinc/70/11/58/338701158.db2.gz YOBOHOMXIQCVCK-AWEZNQCLSA-N 1 2 312.413 4.005 20 0 DIADLO CCO[C@H]1CCN(c2cc[nH+]c3cc(F)c(Cl)cc32)C[C@@H]1C ZINC000450749157 338703328 /nfs/dbraw/zinc/70/33/28/338703328.db2.gz WZAQTELFEYUKIK-GTNSWQLSSA-N 1 2 322.811 4.279 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)ccc1F ZINC000451163155 338723781 /nfs/dbraw/zinc/72/37/81/338723781.db2.gz QQSVXZPZGLLPSZ-NEPJUHHUSA-N 1 2 305.397 4.226 20 0 DIADLO Fc1ccc(C2CC2)cc1C[NH2+]Cc1nc(-c2ccccc2)c[nH]1 ZINC000451189893 338725238 /nfs/dbraw/zinc/72/52/38/338725238.db2.gz SALRIYJMHLUPCT-UHFFFAOYSA-N 1 2 321.399 4.383 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)n1 ZINC000451359565 338731089 /nfs/dbraw/zinc/73/10/89/338731089.db2.gz WVPJYQWSCWHBOS-INIZCTEOSA-N 1 2 323.799 4.056 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000451398323 338732678 /nfs/dbraw/zinc/73/26/78/338732678.db2.gz WDOUWULSKSWRIR-TWMKSMIVSA-N 1 2 317.477 4.029 20 0 DIADLO CC(C)(C)c1csc(/C=C/c2[nH+]ccn2CC(F)(F)F)n1 ZINC000453018563 338786302 /nfs/dbraw/zinc/78/63/02/338786302.db2.gz AHEVUQFJHSIWEI-SNAWJCMRSA-N 1 2 315.364 4.370 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@H]2CCn3ccnc32)c2ccccc2)cc1 ZINC000453054608 338788029 /nfs/dbraw/zinc/78/80/29/338788029.db2.gz HTISBGQFVHAMAP-OALUTQOASA-N 1 2 303.409 4.016 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1nc2cc(Cl)ccc2s1 ZINC000453078848 338791243 /nfs/dbraw/zinc/79/12/43/338791243.db2.gz XRNXKJNJTHEBIZ-SNVBAGLBSA-N 1 2 320.849 4.017 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]C1c2ccccc2-c2ccccc21 ZINC000453083000 338791596 /nfs/dbraw/zinc/79/15/96/338791596.db2.gz LACYMLKUCQNERT-AWEZNQCLSA-N 1 2 303.409 4.324 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]C1c2ccccc2-c2ccccc21 ZINC000453083002 338791612 /nfs/dbraw/zinc/79/16/12/338791612.db2.gz LACYMLKUCQNERT-CQSZACIVSA-N 1 2 303.409 4.324 20 0 DIADLO CC(C)CCOc1ccccc1C[NH2+][C@@H]1C[C@H](C)n2ccnc21 ZINC000453096275 338793243 /nfs/dbraw/zinc/79/32/43/338793243.db2.gz QHCLVVGKPOTYCT-DOTOQJQBSA-N 1 2 313.445 4.104 20 0 DIADLO CCCCN1CCc2ccc(N[C@@H]3C[C@H](C)n4cc[nH+]c43)cc21 ZINC000453194403 338805736 /nfs/dbraw/zinc/80/57/36/338805736.db2.gz PFOLKKVPDDZEAY-WMLDXEAASA-N 1 2 310.445 4.164 20 0 DIADLO Fc1cccc2c1CCC[C@H]2[NH2+][C@H](c1ncc[nH]1)c1ccccc1 ZINC000453223883 338810347 /nfs/dbraw/zinc/81/03/47/338810347.db2.gz BQXIGJHPIKFJBQ-MOPGFXCFSA-N 1 2 321.399 4.305 20 0 DIADLO COc1cc(N[C@H]2C[C@@H](C)n3cc[nH+]c32)ccc1C(F)(F)F ZINC000453232377 338811586 /nfs/dbraw/zinc/81/15/86/338811586.db2.gz WXDXATVXBMGFOV-SKDRFNHKSA-N 1 2 311.307 4.028 20 0 DIADLO Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+][C@@H](C)C(C)(F)F ZINC000453283849 338818360 /nfs/dbraw/zinc/81/83/60/338818360.db2.gz IQFGRQLCPGICJC-ONGXEEELSA-N 1 2 311.401 4.208 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccccc1Cl ZINC000453333583 338826397 /nfs/dbraw/zinc/82/63/97/338826397.db2.gz ZYWCMWMTPWBERF-OAHLLOKOSA-N 1 2 312.244 4.214 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1cc(F)ccc1F ZINC000453347717 338828897 /nfs/dbraw/zinc/82/88/97/338828897.db2.gz KXZMUQHKYLIGJW-XZJROXQQSA-N 1 2 305.372 4.154 20 0 DIADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+][C@@H](C)c1nccn1CC ZINC000453379046 338834878 /nfs/dbraw/zinc/83/48/78/338834878.db2.gz ZYDAEGGFCKYSCN-OLZOCXBDSA-N 1 2 321.852 4.367 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@H](C)c2cc3ccccc3o2)c[nH+]1 ZINC000454507428 338865357 /nfs/dbraw/zinc/86/53/57/338865357.db2.gz AMXIYBFQPXKDEE-CQSZACIVSA-N 1 2 323.396 4.005 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCCc2c(F)cccc21 ZINC000455433891 338894291 /nfs/dbraw/zinc/89/42/91/338894291.db2.gz GHTWKHUYNYRLDW-MRXNPFEDSA-N 1 2 313.376 4.037 20 0 DIADLO CCSCC[C@H](C)N(C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455475689 338895698 /nfs/dbraw/zinc/89/56/98/338895698.db2.gz DQIQLQZWRKCBLG-ZDUSSCGKSA-N 1 2 309.479 4.002 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)NC(=O)c1ccc(C2CCCC2)cc1 ZINC000456365050 338927770 /nfs/dbraw/zinc/92/77/70/338927770.db2.gz VTFRPSZWIHUBSB-AWEZNQCLSA-N 1 2 311.429 4.052 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc(C)[nH+]c2)cc1Br ZINC000164606073 339008917 /nfs/dbraw/zinc/00/89/17/339008917.db2.gz JRSPCTPBVFZHAC-NSHDSACASA-N 1 2 321.218 4.334 20 0 DIADLO CCCCCN(CCCCC)C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000459097264 339013542 /nfs/dbraw/zinc/01/35/42/339013542.db2.gz DVGJKMNCMQIMPI-HOTGVXAUSA-N 1 2 320.481 4.281 20 0 DIADLO CCCCCN(C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21)[C@@H](C)CCC ZINC000459106227 339013769 /nfs/dbraw/zinc/01/37/69/339013769.db2.gz IVDXNBZQIWYTRM-HRCADAONSA-N 1 2 320.481 4.279 20 0 DIADLO CCOc1cc(C[N@H+]2CCc3ccsc3C2)cc(Cl)c1O ZINC000459353232 339023852 /nfs/dbraw/zinc/02/38/52/339023852.db2.gz REXRWTDOVCZFNO-UHFFFAOYSA-N 1 2 323.845 4.064 20 0 DIADLO COCc1cc(C[NH2+][C@H](c2ccccc2)c2ccc(C)cc2)no1 ZINC000459376577 339025477 /nfs/dbraw/zinc/02/54/77/339025477.db2.gz WORZLASJPXBTPQ-HXUWFJFHSA-N 1 2 322.408 4.009 20 0 DIADLO CCOc1ccc([C@@H]([NH2+]Cc2cc(C)on2)c2ccccc2)cc1 ZINC000459376805 339025548 /nfs/dbraw/zinc/02/55/48/339025548.db2.gz SLOUQJIYBULMCD-FQEVSTJZSA-N 1 2 322.408 4.261 20 0 DIADLO Cc1cc(C[NH2+][C@H]2CCOc3c(-c4ccccc4)cccc32)no1 ZINC000459406949 339027441 /nfs/dbraw/zinc/02/74/41/339027441.db2.gz DEQSFSVCJGBEJK-IBGZPJMESA-N 1 2 320.392 4.263 20 0 DIADLO Cc1cc(F)c(C[NH2+]Cc2nc(C3CC3)cs2)c(Cl)c1 ZINC000459428390 339028620 /nfs/dbraw/zinc/02/86/20/339028620.db2.gz GPXUSYRUHXUCAJ-UHFFFAOYSA-N 1 2 310.825 4.411 20 0 DIADLO Cc1ccc(NC(=O)N(C)[C@H]2CCC[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC000459433252 339029037 /nfs/dbraw/zinc/02/90/37/339029037.db2.gz LLYONBATGUXKJX-MJGOQNOKSA-N 1 2 323.440 4.498 20 0 DIADLO COCc1cc(C[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)no1 ZINC000459518623 339033879 /nfs/dbraw/zinc/03/38/79/339033879.db2.gz OUDQKZNYHBTLST-KRWDZBQOSA-N 1 2 320.820 4.202 20 0 DIADLO COCc1cc(C[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)no1 ZINC000459518623 339033880 /nfs/dbraw/zinc/03/38/80/339033880.db2.gz OUDQKZNYHBTLST-KRWDZBQOSA-N 1 2 320.820 4.202 20 0 DIADLO CCN(C(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccc(OC)cc1 ZINC000459580038 339037189 /nfs/dbraw/zinc/03/71/89/339037189.db2.gz JZIXIJCBVDLUCV-UHFFFAOYSA-N 1 2 313.401 4.074 20 0 DIADLO FC(F)(F)c1cnc(C[NH+]2CC(C3CCCCC3)C2)s1 ZINC000459586959 339037535 /nfs/dbraw/zinc/03/75/35/339037535.db2.gz DLRMIRDJFBZUMK-UHFFFAOYSA-N 1 2 304.381 4.174 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)cc1Cl)c1nc2c(s1)CCC2 ZINC000459632922 339039405 /nfs/dbraw/zinc/03/94/05/339039405.db2.gz OMGLRCRFMKQYTN-VIFPVBQESA-N 1 2 310.825 4.275 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1nc2c(s1)CCC2 ZINC000459649876 339040397 /nfs/dbraw/zinc/04/03/97/339040397.db2.gz MQSUBUALWUTJAP-JTQLQIEISA-N 1 2 321.515 4.237 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1c[nH]c(-c2ccccc2)n1 ZINC000459654474 339040727 /nfs/dbraw/zinc/04/07/27/339040727.db2.gz ZRUMYUHXWLUHES-OAHLLOKOSA-N 1 2 321.424 4.245 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1nc2cc(F)ccc2o1 ZINC000459663685 339041494 /nfs/dbraw/zinc/04/14/94/339041494.db2.gz FUXYDMWWDDNBGE-GFCCVEGCSA-N 1 2 314.360 4.135 20 0 DIADLO Cc1nnc(C[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)s1 ZINC000459744068 339045775 /nfs/dbraw/zinc/04/57/75/339045775.db2.gz LVWFFGZTDFPYER-QGZVFWFLSA-N 1 2 313.470 4.354 20 0 DIADLO Cc1nnc(C[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)s1 ZINC000459744068 339045776 /nfs/dbraw/zinc/04/57/76/339045776.db2.gz LVWFFGZTDFPYER-QGZVFWFLSA-N 1 2 313.470 4.354 20 0 DIADLO CCc1ccc([C@H](C)CC(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC000460339741 339055684 /nfs/dbraw/zinc/05/56/84/339055684.db2.gz QLYIWYVBJCKOIW-CQSZACIVSA-N 1 2 307.397 4.029 20 0 DIADLO O=C(CCc1ccc2ccccc2c1)Nc1cccc2[nH+]ccn21 ZINC000460341818 339055762 /nfs/dbraw/zinc/05/57/62/339055762.db2.gz XXBHOJYKHPBDGU-UHFFFAOYSA-N 1 2 315.376 4.059 20 0 DIADLO COC(=O)[C@@H]([NH2+][C@@H](C)c1ccc(Cl)c2ccccc21)C1CC1 ZINC000462352652 339076426 /nfs/dbraw/zinc/07/64/26/339076426.db2.gz AULHHLXYRSEDMU-GTNSWQLSSA-N 1 2 317.816 4.095 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccc(C)cc2OC(C)C)cs1 ZINC000462805908 339090295 /nfs/dbraw/zinc/09/02/95/339090295.db2.gz WBEXUUMJNKSBRZ-ZDUSSCGKSA-N 1 2 304.459 4.398 20 0 DIADLO FC(F)(F)[C@H](NCCCCNc1cccc[nH+]1)c1ccccc1 ZINC000462812124 339090982 /nfs/dbraw/zinc/09/09/82/339090982.db2.gz LRGOHIOGYFZYJX-MRXNPFEDSA-N 1 2 323.362 4.167 20 0 DIADLO C[C@@H]1CCc2nc(C[NH+]3CC(c4ccccc4F)C3)sc2C1 ZINC000462828036 339092652 /nfs/dbraw/zinc/09/26/52/339092652.db2.gz KJWAVSQIVOQXJH-GFCCVEGCSA-N 1 2 316.445 4.006 20 0 DIADLO CCc1cc(N2C[C@H](C)CCC[C@H]2C)nc(-c2ccncc2)[nH+]1 ZINC000462885530 339096144 /nfs/dbraw/zinc/09/61/44/339096144.db2.gz BRPYXSIWHWRXNC-HUUCEWRRSA-N 1 2 310.445 4.116 20 0 DIADLO Cc1cc(N2CC[C@H](c3ccccc3)[C@@H](C)C2)nc(C2CC2)[nH+]1 ZINC000462902530 339097083 /nfs/dbraw/zinc/09/70/83/339097083.db2.gz OAHJVHOAALMSAZ-KSSFIOAISA-N 1 2 307.441 4.292 20 0 DIADLO CC[C@@H](Nc1cc(C)[nH+]c(-c2ccncc2)n1)c1ccc(C)cc1 ZINC000462917209 339098034 /nfs/dbraw/zinc/09/80/34/339098034.db2.gz PLLJGBQWEUSMEU-GOSISDBHSA-N 1 2 318.424 4.141 20 0 DIADLO CC(C)c1nc(N2CC[C@H](CSc3ccccc3)C2)cc[nH+]1 ZINC000462936071 339098429 /nfs/dbraw/zinc/09/84/29/339098429.db2.gz NKJMGBKDKJRPNI-HNNXBMFYSA-N 1 2 313.470 4.219 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+][C@@H]2CCOc3c(F)ccc(F)c32)o1 ZINC000463028918 339101426 /nfs/dbraw/zinc/10/14/26/339101426.db2.gz MDLNNJJNBWFUAR-JVLSTEMRSA-N 1 2 319.351 4.295 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@H](C)CC3CCOCC3)cc2)c1C ZINC000463041812 339102632 /nfs/dbraw/zinc/10/26/32/339102632.db2.gz HOCXFDWXYPAXAH-CQSZACIVSA-N 1 2 313.445 4.106 20 0 DIADLO Cc1cc(N2C[C@@H](C)C[C@H]2c2cccc(F)c2)nc(C2CC2)[nH+]1 ZINC000463077351 339104718 /nfs/dbraw/zinc/10/47/18/339104718.db2.gz OOWJNAXKHBXWHA-SJCJKPOMSA-N 1 2 311.404 4.389 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463411375 339116959 /nfs/dbraw/zinc/11/69/59/339116959.db2.gz FPXJZSAOXPBWPE-LBPRGKRZSA-N 1 2 315.363 4.279 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463411375 339116960 /nfs/dbraw/zinc/11/69/60/339116960.db2.gz FPXJZSAOXPBWPE-LBPRGKRZSA-N 1 2 315.363 4.279 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463415848 339116979 /nfs/dbraw/zinc/11/69/79/339116979.db2.gz RJAFAMJZPUZMQQ-LBPRGKRZSA-N 1 2 315.363 4.279 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463415848 339116980 /nfs/dbraw/zinc/11/69/80/339116980.db2.gz RJAFAMJZPUZMQQ-LBPRGKRZSA-N 1 2 315.363 4.279 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1cccc(F)c1Cl ZINC000463488143 339119500 /nfs/dbraw/zinc/11/95/00/339119500.db2.gz DSJCZDMNCHFFNP-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)[C@@H](C)C(F)(F)F)cc2[nH+]1 ZINC000463501489 339119741 /nfs/dbraw/zinc/11/97/41/339119741.db2.gz BVMNBYRKPRKJOV-SECBINFHSA-N 1 2 313.323 4.042 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H](c3ccccc3)C(C)C)ccc2[nH+]1 ZINC000463614067 339122727 /nfs/dbraw/zinc/12/27/27/339122727.db2.gz RLFHFHVXLXWILI-GOSISDBHSA-N 1 2 307.397 4.021 20 0 DIADLO CC[C@H](C)C[C@H](C)NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000463912470 339128800 /nfs/dbraw/zinc/12/88/00/339128800.db2.gz AKAAIHVSPJKOHA-GJZGRUSLSA-N 1 2 312.413 4.428 20 0 DIADLO Cc1ccc(NC(=O)C2(c3ccccc3C)CCCC2)c(C)[nH+]1 ZINC000464262387 339138202 /nfs/dbraw/zinc/13/82/02/339138202.db2.gz CGTQEBHTNGLJKS-UHFFFAOYSA-N 1 2 308.425 4.457 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccn(-c3ccccc3)n2)[C@@H](c2ccco2)C1 ZINC000464847456 339157504 /nfs/dbraw/zinc/15/75/04/339157504.db2.gz FKVIBBGIPXOKBN-QFBILLFUSA-N 1 2 321.424 4.439 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccn(-c3ccccc3)n2)[C@@H](c2ccco2)C1 ZINC000464847456 339157505 /nfs/dbraw/zinc/15/75/05/339157505.db2.gz FKVIBBGIPXOKBN-QFBILLFUSA-N 1 2 321.424 4.439 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2noc(-c3ccccc3)n2)[C@@H](c2ccco2)C1 ZINC000464850416 339157708 /nfs/dbraw/zinc/15/77/08/339157708.db2.gz KCSPZICDXZUJTQ-GDBMZVCRSA-N 1 2 323.396 4.303 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2noc(-c3ccccc3)n2)[C@@H](c2ccco2)C1 ZINC000464850416 339157709 /nfs/dbraw/zinc/15/77/09/339157709.db2.gz KCSPZICDXZUJTQ-GDBMZVCRSA-N 1 2 323.396 4.303 20 0 DIADLO CCC(C)(C)CC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000465166764 339170525 /nfs/dbraw/zinc/17/05/25/339170525.db2.gz NQJFBQZYUGXRCB-UHFFFAOYSA-N 1 2 305.809 4.291 20 0 DIADLO OC[C@H]([NH2+]Cc1ccsc1Cl)c1cccc(Cl)c1F ZINC000466398981 339202442 /nfs/dbraw/zinc/20/24/42/339202442.db2.gz LCMPQKYPCGHXQY-NSHDSACASA-N 1 2 320.216 4.017 20 0 DIADLO CC[C@H](C)[C@H]([NH2+]Cc1cccc2cc[nH]c21)C(=O)OC(C)(C)C ZINC000466464632 339206186 /nfs/dbraw/zinc/20/61/86/339206186.db2.gz RTUYBRIAQVQRHK-BBRMVZONSA-N 1 2 316.445 4.014 20 0 DIADLO O=C(Nc1cc(Cl)c(Cl)cc1F)c1ccc2[nH+]ccn2c1 ZINC000466570033 339209491 /nfs/dbraw/zinc/20/94/91/339209491.db2.gz MKPQNCDGSMXYBW-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO c1cc(CNc2cccc(-c3ccc4c(c3)CCO4)[nH+]2)cs1 ZINC000466615716 339210591 /nfs/dbraw/zinc/21/05/91/339210591.db2.gz JFKUNYYYFLTLLS-UHFFFAOYSA-N 1 2 308.406 4.357 20 0 DIADLO COCC[C@@H]1CCCCN(c2cc(C)[nH+]c3c(F)cccc23)C1 ZINC000466632723 339211173 /nfs/dbraw/zinc/21/11/73/339211173.db2.gz BQTLCVCUQJOWGH-HNNXBMFYSA-N 1 2 316.420 4.325 20 0 DIADLO CCOc1cccc(CNc2[nH+]cccc2-c2ccccc2)n1 ZINC000466634729 339211189 /nfs/dbraw/zinc/21/11/89/339211189.db2.gz KZUGFTPASYCLCE-UHFFFAOYSA-N 1 2 305.381 4.154 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@@H](Nc2cccc(CCCO)c2)C1 ZINC000467350877 339233305 /nfs/dbraw/zinc/23/33/05/339233305.db2.gz VSABGADATCILAO-AZUAARDMSA-N 1 2 324.468 4.453 20 0 DIADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@@H](Nc2ccc3n[nH]cc3c2)C1 ZINC000467352933 339233458 /nfs/dbraw/zinc/23/34/58/339233458.db2.gz IQUBAAZBFQPJJY-GDBMZVCRSA-N 1 2 306.413 4.405 20 0 DIADLO Fc1ccc(NC2CCN(c3cccc[nH+]3)CC2)cc1C1CC1 ZINC000467442889 339238919 /nfs/dbraw/zinc/23/89/19/339238919.db2.gz IOBQZLJCYBTCFV-UHFFFAOYSA-N 1 2 311.404 4.179 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000467553401 339242206 /nfs/dbraw/zinc/24/22/06/339242206.db2.gz ZZECJEQFUJPSNV-PIIMJCKOSA-N 1 2 308.381 4.249 20 0 DIADLO C[C@H]1c2cc(F)cc(F)c2CC[N@H+]1Cc1nc2ccccc2o1 ZINC000468117391 339254626 /nfs/dbraw/zinc/25/46/26/339254626.db2.gz PXMSHXVZNGGNIJ-NSHDSACASA-N 1 2 314.335 4.225 20 0 DIADLO C[C@H]1c2cc(F)cc(F)c2CC[N@@H+]1Cc1nc2ccccc2o1 ZINC000468117391 339254627 /nfs/dbraw/zinc/25/46/27/339254627.db2.gz PXMSHXVZNGGNIJ-NSHDSACASA-N 1 2 314.335 4.225 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000468402489 339262125 /nfs/dbraw/zinc/26/21/25/339262125.db2.gz JXUPPFKOIKENEX-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000468402489 339262126 /nfs/dbraw/zinc/26/21/26/339262126.db2.gz JXUPPFKOIKENEX-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@H](c3cccc(Cl)c3)C2)s1 ZINC000468689614 339268631 /nfs/dbraw/zinc/26/86/31/339268631.db2.gz LFXQTUSYBNCIQM-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@H](c3cccc(Cl)c3)C2)s1 ZINC000468689614 339268632 /nfs/dbraw/zinc/26/86/32/339268632.db2.gz LFXQTUSYBNCIQM-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO Cn1nccc1C[N@@H+]1CCCC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000469514955 339292174 /nfs/dbraw/zinc/29/21/74/339292174.db2.gz FBMLZSAUZCGLDV-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1nccc1C[N@H+]1CCCC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000469514955 339292175 /nfs/dbraw/zinc/29/21/75/339292175.db2.gz FBMLZSAUZCGLDV-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO CCc1ccc([C@@H](CO)[NH2+][C@@H](C)c2csc(C(C)C)n2)cc1 ZINC000469784194 339299764 /nfs/dbraw/zinc/29/97/64/339299764.db2.gz VQZJHOPQUZUWQF-XJKSGUPXSA-N 1 2 318.486 4.213 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)CCCC1CCCC1 ZINC000469949121 339305577 /nfs/dbraw/zinc/30/55/77/339305577.db2.gz YCGXBUBLTAZBFE-UHFFFAOYSA-N 1 2 319.493 4.045 20 0 DIADLO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000470155626 339312080 /nfs/dbraw/zinc/31/20/80/339312080.db2.gz ANASSJBOCYWACF-LBPRGKRZSA-N 1 2 311.269 4.267 20 0 DIADLO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(F)c(F)cc1F ZINC000470155626 339312081 /nfs/dbraw/zinc/31/20/81/339312081.db2.gz ANASSJBOCYWACF-LBPRGKRZSA-N 1 2 311.269 4.267 20 0 DIADLO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000470155625 339312088 /nfs/dbraw/zinc/31/20/88/339312088.db2.gz ANASSJBOCYWACF-GFCCVEGCSA-N 1 2 311.269 4.267 20 0 DIADLO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(F)c(F)cc1F ZINC000470155625 339312089 /nfs/dbraw/zinc/31/20/89/339312089.db2.gz ANASSJBOCYWACF-GFCCVEGCSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470213304 339314385 /nfs/dbraw/zinc/31/43/85/339314385.db2.gz GLOSVKMHDGJQKE-IGCXYCKISA-N 1 2 305.418 4.410 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470213304 339314386 /nfs/dbraw/zinc/31/43/86/339314386.db2.gz GLOSVKMHDGJQKE-IGCXYCKISA-N 1 2 305.418 4.410 20 0 DIADLO CCc1c(NCc2cn3ccccc3[nH+]2)cnn1C(CC)CC ZINC000470250113 339315227 /nfs/dbraw/zinc/31/52/27/339315227.db2.gz GNPLPLWBOSJYOF-UHFFFAOYSA-N 1 2 311.433 4.066 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(C(F)F)c1)c1nc(C(C)(C)C)no1 ZINC000470788815 339328104 /nfs/dbraw/zinc/32/81/04/339328104.db2.gz HTGZJRBFAXLPMF-SNVBAGLBSA-N 1 2 309.360 4.156 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(C(F)F)c1)c1nc(C(C)(C)C)no1 ZINC000470788814 339328169 /nfs/dbraw/zinc/32/81/69/339328169.db2.gz HTGZJRBFAXLPMF-JTQLQIEISA-N 1 2 309.360 4.156 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000470944820 339332072 /nfs/dbraw/zinc/33/20/72/339332072.db2.gz LKNJGUCXMNWZAP-KOLCDFICSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000470944820 339332073 /nfs/dbraw/zinc/33/20/73/339332073.db2.gz LKNJGUCXMNWZAP-KOLCDFICSA-N 1 2 306.397 4.213 20 0 DIADLO Cn1c2ccc(NC(=O)C(C)(C)C(F)F)cc2[nH+]c1C(C)(C)C ZINC000471030422 339335042 /nfs/dbraw/zinc/33/50/42/339335042.db2.gz KCDVYINFFZQFLI-UHFFFAOYSA-N 1 2 323.387 4.101 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000471038768 339335314 /nfs/dbraw/zinc/33/53/14/339335314.db2.gz RJAMIJVHRPFXTR-VLIAUNLRSA-N 1 2 323.415 4.388 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000471038768 339335315 /nfs/dbraw/zinc/33/53/15/339335315.db2.gz RJAMIJVHRPFXTR-VLIAUNLRSA-N 1 2 323.415 4.388 20 0 DIADLO Cc1cccc(-c2noc(C[N@H+]3C[C@H](C)[C@H]3c3ccccc3)n2)c1 ZINC000471045302 339335473 /nfs/dbraw/zinc/33/54/73/339335473.db2.gz YLZFOQJXYVCAGD-KXBFYZLASA-N 1 2 319.408 4.238 20 0 DIADLO Cc1cccc(-c2noc(C[N@@H+]3C[C@H](C)[C@H]3c3ccccc3)n2)c1 ZINC000471045302 339335474 /nfs/dbraw/zinc/33/54/74/339335474.db2.gz YLZFOQJXYVCAGD-KXBFYZLASA-N 1 2 319.408 4.238 20 0 DIADLO CCc1cccc(CC)c1NC(=O)C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000471176207 339339519 /nfs/dbraw/zinc/33/95/19/339339519.db2.gz KAKANOQEZWZVPJ-IBGZPJMESA-N 1 2 322.452 4.197 20 0 DIADLO CCc1cccc(CC)c1NC(=O)C[N@H+]1CC[C@H]1c1ccccc1 ZINC000471176207 339339520 /nfs/dbraw/zinc/33/95/20/339339520.db2.gz KAKANOQEZWZVPJ-IBGZPJMESA-N 1 2 322.452 4.197 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+]2CC[C@@H]2c2ccccc2)o1 ZINC000471178576 339339725 /nfs/dbraw/zinc/33/97/25/339339725.db2.gz OLUSTJHSXFORFW-QGZVFWFLSA-N 1 2 308.356 4.428 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+]2CC[C@@H]2c2ccccc2)o1 ZINC000471178576 339339726 /nfs/dbraw/zinc/33/97/26/339339726.db2.gz OLUSTJHSXFORFW-QGZVFWFLSA-N 1 2 308.356 4.428 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+]2CC[C@@H]2c2ccccc2)cc1Cl ZINC000471176441 339339782 /nfs/dbraw/zinc/33/97/82/339339782.db2.gz KLLOTSVIHYGHJW-QGZVFWFLSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+]2CC[C@@H]2c2ccccc2)cc1Cl ZINC000471176441 339339783 /nfs/dbraw/zinc/33/97/83/339339783.db2.gz KLLOTSVIHYGHJW-QGZVFWFLSA-N 1 2 314.816 4.034 20 0 DIADLO CCCC1(C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)CC1 ZINC000471227140 339340485 /nfs/dbraw/zinc/34/04/85/339340485.db2.gz MRNIMEYYKARBSK-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO O=C(c1ccc2[nH+]ccn2c1)N(c1ccccc1F)C1CCCC1 ZINC000471413634 339344370 /nfs/dbraw/zinc/34/43/70/339344370.db2.gz ZJHASOLFAYZGHI-UHFFFAOYSA-N 1 2 323.371 4.063 20 0 DIADLO CCN(CC)c1ccc(N[C@@H](C)c2sccc2OC)c[nH+]1 ZINC000471614242 339349628 /nfs/dbraw/zinc/34/96/28/339349628.db2.gz TVKVGFBBSPXJQW-LBPRGKRZSA-N 1 2 305.447 4.171 20 0 DIADLO Cc1cc(N2CC(c3nc4ccccc4s3)C2)nc(C(C)C)[nH+]1 ZINC000471737801 339352819 /nfs/dbraw/zinc/35/28/19/339352819.db2.gz RGOBXOPHCTXAET-UHFFFAOYSA-N 1 2 324.453 4.122 20 0 DIADLO CCn1nc(CNc2c[nH+]ccc2OC(C)(C)C)c2ccccc21 ZINC000472041020 339360169 /nfs/dbraw/zinc/36/01/69/339360169.db2.gz BXNLMEBKKWJSFO-UHFFFAOYSA-N 1 2 324.428 4.241 20 0 DIADLO Clc1cnc(C[NH2+]Cc2ccc(-c3ccccc3)o2)s1 ZINC000472056989 339361282 /nfs/dbraw/zinc/36/12/82/339361282.db2.gz BXBSROBPFRTPTA-UHFFFAOYSA-N 1 2 304.802 4.346 20 0 DIADLO CC(C)COc1cccc(C[NH2+]Cc2ncc(Cl)s2)c1 ZINC000472075736 339362636 /nfs/dbraw/zinc/36/26/36/339362636.db2.gz SNXHXIDWGOKKTE-UHFFFAOYSA-N 1 2 310.850 4.121 20 0 DIADLO CCCc1nc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@H](CC)C2)no1 ZINC000472252841 339367769 /nfs/dbraw/zinc/36/77/69/339367769.db2.gz XPTLSADJJWEFJB-NVXWUHKLSA-N 1 2 313.445 4.038 20 0 DIADLO CCCc1nc(C[N@H+]2CC[C@@H](c3ccccc3)[C@H](CC)C2)no1 ZINC000472252841 339367770 /nfs/dbraw/zinc/36/77/70/339367770.db2.gz XPTLSADJJWEFJB-NVXWUHKLSA-N 1 2 313.445 4.038 20 0 DIADLO CCC[N@H+](Cc1noc(-c2ccccc2C)n1)Cc1ccccc1 ZINC000472763339 339377167 /nfs/dbraw/zinc/37/71/67/339377167.db2.gz AFJFRIDIWYWWGC-UHFFFAOYSA-N 1 2 321.424 4.457 20 0 DIADLO CCC[N@@H+](Cc1noc(-c2ccccc2C)n1)Cc1ccccc1 ZINC000472763339 339377168 /nfs/dbraw/zinc/37/71/68/339377168.db2.gz AFJFRIDIWYWWGC-UHFFFAOYSA-N 1 2 321.424 4.457 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCSC[C@H]2c2nccs2)cc1 ZINC000473070754 339380865 /nfs/dbraw/zinc/38/08/65/339380865.db2.gz FMKPRCOIWBHFMZ-INIZCTEOSA-N 1 2 318.511 4.386 20 0 DIADLO CCCc1ccc(C[N@H+]2CCSC[C@H]2c2nccs2)cc1 ZINC000473070754 339380866 /nfs/dbraw/zinc/38/08/66/339380866.db2.gz FMKPRCOIWBHFMZ-INIZCTEOSA-N 1 2 318.511 4.386 20 0 DIADLO Clc1cnc(C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)s1 ZINC000473119505 339381274 /nfs/dbraw/zinc/38/12/74/339381274.db2.gz CLQFCBCRAKEAMN-VFNNOXKTSA-N 1 2 304.846 4.474 20 0 DIADLO Clc1cnc(C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)s1 ZINC000473119505 339381275 /nfs/dbraw/zinc/38/12/75/339381275.db2.gz CLQFCBCRAKEAMN-VFNNOXKTSA-N 1 2 304.846 4.474 20 0 DIADLO Clc1cnc(C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)s1 ZINC000473119503 339381315 /nfs/dbraw/zinc/38/13/15/339381315.db2.gz CLQFCBCRAKEAMN-MYSGNRETSA-N 1 2 304.846 4.474 20 0 DIADLO Clc1cnc(C[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)s1 ZINC000473119503 339381316 /nfs/dbraw/zinc/38/13/16/339381316.db2.gz CLQFCBCRAKEAMN-MYSGNRETSA-N 1 2 304.846 4.474 20 0 DIADLO Clc1cnc(C[N@@H+]2CCC[C@H]2/C=C\c2ccccc2)s1 ZINC000473119498 339381434 /nfs/dbraw/zinc/38/14/34/339381434.db2.gz CLQFCBCRAKEAMN-CKXPSTMWSA-N 1 2 304.846 4.474 20 0 DIADLO Clc1cnc(C[N@H+]2CCC[C@H]2/C=C\c2ccccc2)s1 ZINC000473119498 339381435 /nfs/dbraw/zinc/38/14/35/339381435.db2.gz CLQFCBCRAKEAMN-CKXPSTMWSA-N 1 2 304.846 4.474 20 0 DIADLO Clc1cnc(C[NH+]2CCC(COc3ccccc3)CC2)s1 ZINC000473134236 339382051 /nfs/dbraw/zinc/38/20/51/339382051.db2.gz WSXSVJBDWQJOJR-UHFFFAOYSA-N 1 2 322.861 4.088 20 0 DIADLO COc1ccc(C2CC[NH+](Cc3ncc(Cl)s3)CC2)cc1 ZINC000473138979 339382138 /nfs/dbraw/zinc/38/21/38/339382138.db2.gz HQITZTJCPWANCS-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cc3c(ccc(C)c3C)[nH]2)s1 ZINC000473150893 339383071 /nfs/dbraw/zinc/38/30/71/339383071.db2.gz PRINEHBBYSQJIL-UHFFFAOYSA-N 1 2 313.470 4.436 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cc3c(ccc(C)c3C)[nH]2)s1 ZINC000473150893 339383072 /nfs/dbraw/zinc/38/30/72/339383072.db2.gz PRINEHBBYSQJIL-UHFFFAOYSA-N 1 2 313.470 4.436 20 0 DIADLO C[C@H]1C[N@H+](Cc2ncc(Cl)s2)CC[C@H]1c1ccccc1 ZINC000473149106 339383277 /nfs/dbraw/zinc/38/32/77/339383277.db2.gz SLYLPVAPPJMQDI-GXTWGEPZSA-N 1 2 306.862 4.422 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ncc(Cl)s2)CC[C@H]1c1ccccc1 ZINC000473149106 339383278 /nfs/dbraw/zinc/38/32/78/339383278.db2.gz SLYLPVAPPJMQDI-GXTWGEPZSA-N 1 2 306.862 4.422 20 0 DIADLO CCC[C@@H](CC1CCCCC1)C(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000473871930 339393923 /nfs/dbraw/zinc/39/39/23/339393923.db2.gz CIQZUFIFDSRGTA-WMZOPIPTSA-N 1 2 319.493 4.022 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000473999334 339396703 /nfs/dbraw/zinc/39/67/03/339396703.db2.gz HXUBRAUERTZDQM-IUODEOHRSA-N 1 2 311.381 4.448 20 0 DIADLO C[C@H]([NH2+]c1ccc(-n2cccn2)cc1)C1CCC(F)(F)CC1 ZINC000474037549 339398305 /nfs/dbraw/zinc/39/83/05/339398305.db2.gz YQZGINKOZOOLNG-ZDUSSCGKSA-N 1 2 305.372 4.498 20 0 DIADLO CC(C)(C)c1cnc(SCc2[nH+]ccn2CC(F)(F)F)o1 ZINC000474415708 339413636 /nfs/dbraw/zinc/41/36/36/339413636.db2.gz XHVCGUCZVUWCTC-UHFFFAOYSA-N 1 2 319.352 4.023 20 0 DIADLO CCc1cccc(F)c1C[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000474615876 339420205 /nfs/dbraw/zinc/42/02/05/339420205.db2.gz IAYJVKYMGOWSPR-UHFFFAOYSA-N 1 2 310.372 4.333 20 0 DIADLO Cc1ccc(CCCNc2ccc(F)cc2OCC(F)F)c[nH+]1 ZINC000474888538 339429991 /nfs/dbraw/zinc/42/99/91/339429991.db2.gz OWMBHVSEIGCGLZ-UHFFFAOYSA-N 1 2 324.346 4.218 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc(C)c(Cl)cc3C)ccc2[nH+]1 ZINC000475534405 339454381 /nfs/dbraw/zinc/45/43/81/339454381.db2.gz DTSHVOPXLFYGJU-UHFFFAOYSA-N 1 2 313.788 4.165 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](CO)c2c(Cl)cccc2Cl)cc1 ZINC000475629869 339457522 /nfs/dbraw/zinc/45/75/22/339457522.db2.gz WSKOZYSDYFWMMJ-HNNXBMFYSA-N 1 2 310.224 4.125 20 0 DIADLO CC(C)c1noc([C@@H](C)[NH2+][C@@H](C)c2cc3cccc(F)c3o2)n1 ZINC000475691263 339459668 /nfs/dbraw/zinc/45/96/68/339459668.db2.gz GHQMLLZDOXCMED-WDEREUQCSA-N 1 2 317.364 4.490 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](C)c2cc3cccc(F)c3o2)n1 ZINC000475705243 339460005 /nfs/dbraw/zinc/46/00/05/339460005.db2.gz JSCRRZVDPSQGPB-NSHDSACASA-N 1 2 317.364 4.148 20 0 DIADLO CN(C)c1[nH+]cccc1N(C)C(=O)CC(C)(C)C1CCCCC1 ZINC000476306440 339473954 /nfs/dbraw/zinc/47/39/54/339473954.db2.gz LTVYRGFBJMCLLF-UHFFFAOYSA-N 1 2 317.477 4.107 20 0 DIADLO CCCCN(C(=O)CCn1c(C)[nH+]c2ccccc21)[C@H](C)CC ZINC000476537119 339478176 /nfs/dbraw/zinc/47/81/76/339478176.db2.gz QGTZBWROXKGOHK-OAHLLOKOSA-N 1 2 315.461 4.162 20 0 DIADLO Cc1cc(Cl)cc(C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)c1 ZINC000477188413 339488764 /nfs/dbraw/zinc/48/87/64/339488764.db2.gz PBRVHSJGRDDMPB-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2ncc(C)o2)c2ccc(C)cc2)cc1 ZINC000477582606 339497606 /nfs/dbraw/zinc/49/76/06/339497606.db2.gz UFSITGJIOGCIOQ-HXUWFJFHSA-N 1 2 322.408 4.179 20 0 DIADLO COc1cccc(C2=CCN(c3cc(C)[nH+]c(C(C)C)n3)CC2)c1 ZINC000477646350 339498826 /nfs/dbraw/zinc/49/88/26/339498826.db2.gz SJMLHWLGHZDTLI-UHFFFAOYSA-N 1 2 323.440 4.211 20 0 DIADLO CSc1ccc(CSCc2c[nH+]c3ccccn23)cc1 ZINC000478740787 339521642 /nfs/dbraw/zinc/52/16/42/339521642.db2.gz AYOFQPKLMOERRM-UHFFFAOYSA-N 1 2 300.452 4.490 20 0 DIADLO COc1cc[nH+]cc1NC(=O)C1(c2cccc(C)c2)CCCCC1 ZINC000498402333 339523745 /nfs/dbraw/zinc/52/37/45/339523745.db2.gz CPPOBMOBFXOTMK-UHFFFAOYSA-N 1 2 324.424 4.239 20 0 DIADLO CC(C)=CC[NH2+][C@H](c1nc(-c2ccccc2)no1)c1ccccc1 ZINC000479466481 339536723 /nfs/dbraw/zinc/53/67/23/339536723.db2.gz UXYRJHOBHVOJHR-SFHVURJKSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(F)c4ccccc34)ccc2[nH+]1 ZINC000479934472 339553708 /nfs/dbraw/zinc/55/37/08/339553708.db2.gz SGSUBQUFJQBLMD-UHFFFAOYSA-N 1 2 319.339 4.187 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cn1 ZINC000480169244 339561785 /nfs/dbraw/zinc/56/17/85/339561785.db2.gz WVHJYZMZRGFBJG-WDEREUQCSA-N 1 2 308.784 4.295 20 0 DIADLO COC[C@H]([NH2+]Cc1ccsc1Cl)c1ccc(F)c(F)c1 ZINC000480286494 339567252 /nfs/dbraw/zinc/56/72/52/339567252.db2.gz UQMYCWIOZWEFOE-ZDUSSCGKSA-N 1 2 317.788 4.157 20 0 DIADLO FC(F)(F)c1ccc(CSc2[nH+]cnc3[nH]ccc32)cc1 ZINC000480372179 339571129 /nfs/dbraw/zinc/57/11/29/339571129.db2.gz XROVVQQIZZDVHV-UHFFFAOYSA-N 1 2 309.316 4.269 20 0 DIADLO Cc1ccc([C@@H]2CCN(c3cc[nH+]c4ccncc43)C2)c(C)c1 ZINC000480566902 339577969 /nfs/dbraw/zinc/57/79/69/339577969.db2.gz ZPDYIPNWTZGHCC-MRXNPFEDSA-N 1 2 303.409 4.241 20 0 DIADLO CCc1c[nH+]ccc1[C@@H](C)C1CCN(c2nc(C)cs2)CC1 ZINC000498418438 339578414 /nfs/dbraw/zinc/57/84/14/339578414.db2.gz ZCLYUGMPSUUDGQ-AWEZNQCLSA-N 1 2 315.486 4.429 20 0 DIADLO CCCC[C@@H](CC)C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000483737117 339673545 /nfs/dbraw/zinc/67/35/45/339673545.db2.gz ZCYWCOAZKZIGAZ-CQSZACIVSA-N 1 2 323.506 4.284 20 0 DIADLO Fc1cc([C@H]2CCCN2c2cccc[nH+]2)ccc1Br ZINC000485401277 339702723 /nfs/dbraw/zinc/70/27/23/339702723.db2.gz DKGJBJRNFNTSRC-CQSZACIVSA-N 1 2 321.193 4.325 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@]1(C)CCCc2ccccc21 ZINC000485455360 339703644 /nfs/dbraw/zinc/70/36/44/339703644.db2.gz YCCALOHZEWRZIW-IBGZPJMESA-N 1 2 309.413 4.072 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCC[C@H]1CCC(C)C ZINC000485472339 339704000 /nfs/dbraw/zinc/70/40/00/339704000.db2.gz DWCWCCJVSLUKHX-JKSUJKDBSA-N 1 2 303.450 4.425 20 0 DIADLO CCC[C@@H](Cc1ccccc1)NC(=O)Nc1c(C)cc[nH+]c1C ZINC000485476251 339704118 /nfs/dbraw/zinc/70/41/18/339704118.db2.gz AVZWLQFQBMUXQT-KRWDZBQOSA-N 1 2 311.429 4.231 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](C)c1ccc(Cl)s1 ZINC000485531467 339705061 /nfs/dbraw/zinc/70/50/61/339705061.db2.gz YXZKSZQXCXKJTP-SECBINFHSA-N 1 2 309.822 4.296 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(Cc1ccccc1)CC(C)C ZINC000485553575 339705579 /nfs/dbraw/zinc/70/55/79/339705579.db2.gz TVUOOTWDKOABNV-UHFFFAOYSA-N 1 2 311.429 4.389 20 0 DIADLO Cc1cccnc1C(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000485664914 339708687 /nfs/dbraw/zinc/70/86/87/339708687.db2.gz UXYIVLVEVPEKII-UHFFFAOYSA-N 1 2 319.408 4.044 20 0 DIADLO Cc1cc(OCc2nc(CCC(C)C)no2)c2ccccc2[nH+]1 ZINC000486201516 339723297 /nfs/dbraw/zinc/72/32/97/339723297.db2.gz ZSERUUCMDWDOMV-UHFFFAOYSA-N 1 2 311.385 4.094 20 0 DIADLO C[C@H](SCc1c[nH+]cn1C)c1cccc(Br)c1 ZINC000487868450 339764584 /nfs/dbraw/zinc/76/45/84/339764584.db2.gz JGRLHOXRPHTQSK-JTQLQIEISA-N 1 2 311.248 4.177 20 0 DIADLO COc1ncccc1C[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000488150126 339771801 /nfs/dbraw/zinc/77/18/01/339771801.db2.gz NAZMHXXTCPAXOQ-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO CC(C)O[C@H](Cn1c[nH+]c2cc(F)c(F)cc21)c1ccccc1 ZINC000488246176 339774329 /nfs/dbraw/zinc/77/43/29/339774329.db2.gz SQYCLAPXGLEREI-GOSISDBHSA-N 1 2 316.351 4.481 20 0 DIADLO CCOC1(C)CCN(c2cc(C(C)(C)C)[nH+]c(C(C)C)n2)CC1 ZINC000488455610 339783731 /nfs/dbraw/zinc/78/37/31/339783731.db2.gz FMOXFRUJSNIWMV-UHFFFAOYSA-N 1 2 319.493 4.293 20 0 DIADLO O=C(NCCC1CCCC1)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000492441230 339900715 /nfs/dbraw/zinc/90/07/15/339900715.db2.gz DRCYHFCLUQSSKQ-UHFFFAOYSA-N 1 2 310.397 4.184 20 0 DIADLO CCn1cc[nH+]c1/C=C/C(=O)Nc1cc(Cl)c(C)cc1Cl ZINC000492490840 339902081 /nfs/dbraw/zinc/90/20/81/339902081.db2.gz IVENZJHWRGQOHU-SNAWJCMRSA-N 1 2 324.211 4.170 20 0 DIADLO CCC(CC)[C@@H](C)C(=O)N(C)[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000492937996 339912915 /nfs/dbraw/zinc/91/29/15/339912915.db2.gz WMRLPTUNZQMJMY-PBHICJAKSA-N 1 2 313.445 4.030 20 0 DIADLO CCCC(C)(C)CC(=O)N(C)[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000493033200 339915509 /nfs/dbraw/zinc/91/55/09/339915509.db2.gz CPXXVPPCPHJQDZ-QGZVFWFLSA-N 1 2 313.445 4.174 20 0 DIADLO O=C(/C=C/c1ccc(C2CC2)cc1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000493090225 339917005 /nfs/dbraw/zinc/91/70/05/339917005.db2.gz UUEVKNZBURWUKA-PMQIGOLDSA-N 1 2 321.424 4.054 20 0 DIADLO CCCc1csc(C[NH2+]Cc2nc(C(C)C)c(C)s2)n1 ZINC000494087738 339940753 /nfs/dbraw/zinc/94/07/53/339940753.db2.gz HLJXLTYVDUHHLP-UHFFFAOYSA-N 1 2 309.504 4.274 20 0 DIADLO CCCN(c1cc[nH+]c(C2CC2)n1)[C@H](C)c1ccccc1OC ZINC000498982954 340027424 /nfs/dbraw/zinc/02/74/24/340027424.db2.gz POAXJOPZFABPPM-CQSZACIVSA-N 1 2 311.429 4.340 20 0 DIADLO CCc1cccnc1C(=O)Nc1ccc2[nH]c(C(C)(C)C)[nH+]c2c1 ZINC000499476750 340037515 /nfs/dbraw/zinc/03/75/15/340037515.db2.gz FLYDATGNHHQTKE-UHFFFAOYSA-N 1 2 322.412 4.070 20 0 DIADLO COc1ccc2c(c1)[nH+]ccc2OCc1cnc2ccccc2c1 ZINC000499980101 340048068 /nfs/dbraw/zinc/04/80/68/340048068.db2.gz QFKWOBOPGIPEHC-UHFFFAOYSA-N 1 2 316.360 4.371 20 0 DIADLO CCC[C@H](C)CC(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC000500004161 340048497 /nfs/dbraw/zinc/04/84/97/340048497.db2.gz HNAGDGMOYUDQSU-UONOGXRCSA-N 1 2 323.506 4.140 20 0 DIADLO CCC[C@H](C)CC(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000500004161 340048498 /nfs/dbraw/zinc/04/84/98/340048498.db2.gz HNAGDGMOYUDQSU-UONOGXRCSA-N 1 2 323.506 4.140 20 0 DIADLO CCCC[C@@H](CCC)NC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000500019881 340048718 /nfs/dbraw/zinc/04/87/18/340048718.db2.gz BEASZIXOAMUEOW-GOSISDBHSA-N 1 2 313.445 4.020 20 0 DIADLO CC(C)=CCSc1ccccc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000500307971 340055013 /nfs/dbraw/zinc/05/50/13/340055013.db2.gz VQQNVCOJSLJOBZ-UHFFFAOYSA-N 1 2 312.438 4.123 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@@H+]1Cc1cccc(C(F)(F)F)c1 ZINC000500415375 340057540 /nfs/dbraw/zinc/05/75/40/340057540.db2.gz KJEBLWSQIAGBPK-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@H+]1Cc1cccc(C(F)(F)F)c1 ZINC000500415375 340057541 /nfs/dbraw/zinc/05/75/41/340057541.db2.gz KJEBLWSQIAGBPK-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Fc1ccccc1COc1cccc(C[NH2+]C2(C(F)F)CC2)c1 ZINC000500531473 340061589 /nfs/dbraw/zinc/06/15/89/340061589.db2.gz QWKMGYKFDMHDJX-UHFFFAOYSA-N 1 2 321.342 4.292 20 0 DIADLO C[C@@H]1COC[C@@H](c2ccccc2)[N@@H+]1Cc1ccc2ccccc2n1 ZINC000501029937 340072711 /nfs/dbraw/zinc/07/27/11/340072711.db2.gz UYNWHYFQAZQIHZ-IERDGZPVSA-N 1 2 318.420 4.197 20 0 DIADLO C[C@@H]1COC[C@@H](c2ccccc2)[N@H+]1Cc1ccc2ccccc2n1 ZINC000501029937 340072712 /nfs/dbraw/zinc/07/27/12/340072712.db2.gz UYNWHYFQAZQIHZ-IERDGZPVSA-N 1 2 318.420 4.197 20 0 DIADLO C[C@H]1Cc2ccc(Br)cc2C[N@@H+]1CCC(F)(F)F ZINC000501415016 340080318 /nfs/dbraw/zinc/08/03/18/340080318.db2.gz CCQZWIFPEASTRY-VIFPVBQESA-N 1 2 322.168 4.148 20 0 DIADLO C[C@H]1Cc2ccc(Br)cc2C[N@H+]1CCC(F)(F)F ZINC000501415016 340080319 /nfs/dbraw/zinc/08/03/19/340080319.db2.gz CCQZWIFPEASTRY-VIFPVBQESA-N 1 2 322.168 4.148 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)C1 ZINC000501419327 340080575 /nfs/dbraw/zinc/08/05/75/340080575.db2.gz OBMCOSJHLIRTAJ-MRXNPFEDSA-N 1 2 324.852 4.321 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)C1 ZINC000501419327 340080576 /nfs/dbraw/zinc/08/05/76/340080576.db2.gz OBMCOSJHLIRTAJ-MRXNPFEDSA-N 1 2 324.852 4.321 20 0 DIADLO CCCOc1cccc2c(N[C@@H]3CCCOCC3)cc[nH+]c12 ZINC000502011865 340092885 /nfs/dbraw/zinc/09/28/85/340092885.db2.gz CIXBTAWVEJAYKW-CQSZACIVSA-N 1 2 300.402 4.005 20 0 DIADLO c1cncc([C@@H]2CCC[C@@H](Nc3ccc(N4CCCC4)[nH+]c3)C2)c1 ZINC000502402246 340101878 /nfs/dbraw/zinc/10/18/78/340101878.db2.gz CCFSCRAPCIXVGW-SJLPKXTDSA-N 1 2 322.456 4.215 20 0 DIADLO c1cncc([C@H]2CCC[C@@H](Nc3ccc(N4CCCC4)[nH+]c3)C2)c1 ZINC000502402245 340101973 /nfs/dbraw/zinc/10/19/73/340101973.db2.gz CCFSCRAPCIXVGW-FUHWJXTLSA-N 1 2 322.456 4.215 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)oc1C ZINC000502443815 340103733 /nfs/dbraw/zinc/10/37/33/340103733.db2.gz KNSMXRZNTCPRNP-QMMMGPOBSA-N 1 2 301.283 4.304 20 0 DIADLO COCC[C@H]1CCC[C@H]1Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000502463963 340104786 /nfs/dbraw/zinc/10/47/86/340104786.db2.gz QZRUWSOSKFBKLN-CZUORRHYSA-N 1 2 319.836 4.143 20 0 DIADLO Cc1cc(N2CCSCC2)ccc1[NH2+][C@H]1CCC12CCC2 ZINC000502478954 340105465 /nfs/dbraw/zinc/10/54/65/340105465.db2.gz XIZPRTCHBZOJCO-KRWDZBQOSA-N 1 2 302.487 4.293 20 0 DIADLO CC[C@H]1C[C@@]1([NH2+]Cc1nc(-c2ccoc2)no1)c1cccc(C)c1 ZINC000502483733 340105692 /nfs/dbraw/zinc/10/56/92/340105692.db2.gz JTIUTCZSGKRRDY-KXBFYZLASA-N 1 2 323.396 4.053 20 0 DIADLO CC[C@H]1C[C@@]1([NH2+]Cc1noc(C(C)(C)C)n1)c1cccc(C)c1 ZINC000502529410 340106901 /nfs/dbraw/zinc/10/69/01/340106901.db2.gz NAZJZXFPXRYCBL-LIRRHRJNSA-N 1 2 313.445 4.091 20 0 DIADLO CC[C@@H]1C[C@]1([NH2+]Cc1noc(C(C)(C)C)n1)c1cccc(C)c1 ZINC000502529407 340107018 /nfs/dbraw/zinc/10/70/18/340107018.db2.gz NAZJZXFPXRYCBL-AUUYWEPGSA-N 1 2 313.445 4.091 20 0 DIADLO CC[C@@H]1C[C@@]1([NH2+]Cc1nc(C(C)(C)C)no1)c1cccc(C)c1 ZINC000502544291 340107299 /nfs/dbraw/zinc/10/72/99/340107299.db2.gz SNHAUPRYVKPDTF-KUHUBIRLSA-N 1 2 313.445 4.091 20 0 DIADLO CC[C@@H]1C[C@]1([NH2+]Cc1nc(-c2ccco2)no1)c1cccc(C)c1 ZINC000502590844 340108609 /nfs/dbraw/zinc/10/86/09/340108609.db2.gz HVSKHBSDVQQSKU-AUUYWEPGSA-N 1 2 323.396 4.053 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](CN2CCCC2)c2ccccc2)oc1C ZINC000502694996 340111007 /nfs/dbraw/zinc/11/10/07/340111007.db2.gz CJGVIPWBRXOQPF-APWZRJJASA-N 1 2 312.457 4.384 20 0 DIADLO CC(C)(CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000502752059 340112941 /nfs/dbraw/zinc/11/29/41/340112941.db2.gz YLTSVKRTJYPZIQ-UHFFFAOYSA-N 1 2 319.408 4.383 20 0 DIADLO c1ccc2sc([C@H]3COCC[N@H+]3C[C@@H]3CC=CCC3)nc2c1 ZINC000503037878 340119323 /nfs/dbraw/zinc/11/93/23/340119323.db2.gz YPZOSSMGKWCBTO-GDBMZVCRSA-N 1 2 314.454 4.026 20 0 DIADLO c1ccc2sc([C@H]3COCC[N@@H+]3C[C@@H]3CC=CCC3)nc2c1 ZINC000503037878 340119324 /nfs/dbraw/zinc/11/93/24/340119324.db2.gz YPZOSSMGKWCBTO-GDBMZVCRSA-N 1 2 314.454 4.026 20 0 DIADLO CCCC[C@@H](C)C(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1 ZINC000503130248 340121595 /nfs/dbraw/zinc/12/15/95/340121595.db2.gz JPSWCTUMYSMTJP-CQSZACIVSA-N 1 2 323.506 4.140 20 0 DIADLO Fc1ccc2cc[nH+]c(N3CC[C@H](COc4ccccc4)C3)c2c1 ZINC000503306211 340125069 /nfs/dbraw/zinc/12/50/69/340125069.db2.gz YCVITWSGCCQSRS-HNNXBMFYSA-N 1 2 322.383 4.279 20 0 DIADLO C[C@H]1C[C@@]1([NH2+]Cc1nc(C(C)(C)C)no1)c1ccc(Cl)cc1 ZINC000503379256 340126852 /nfs/dbraw/zinc/12/68/52/340126852.db2.gz UVUSKQMDFLQHLI-GTNSWQLSSA-N 1 2 319.836 4.045 20 0 DIADLO CCn1c2ccccc2nc1SCc1cn2c(cccc2C)[nH+]1 ZINC000503684808 340133479 /nfs/dbraw/zinc/13/34/79/340133479.db2.gz KRBJAGUPQKXZDN-UHFFFAOYSA-N 1 2 322.437 4.305 20 0 DIADLO CCc1cc(NC(=O)CCn2c(C)[nH+]c3ccccc32)ccc1C ZINC000503854480 340135168 /nfs/dbraw/zinc/13/51/68/340135168.db2.gz AQUWZRBPSMWJCK-UHFFFAOYSA-N 1 2 321.424 4.244 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+]C2(C(F)F)CC2)cc1OC ZINC000503895426 340136020 /nfs/dbraw/zinc/13/60/20/340136020.db2.gz VNVAGUGEDRBPRN-GFCCVEGCSA-N 1 2 313.388 4.322 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N(Cc1ccc(C(C)C)cc1)C1CC1 ZINC000504131136 340141371 /nfs/dbraw/zinc/14/13/71/340141371.db2.gz LCOJZFBWGFWJIS-UHFFFAOYSA-N 1 2 323.440 4.132 20 0 DIADLO CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000504151805 340141721 /nfs/dbraw/zinc/14/17/21/340141721.db2.gz SAXRHOBQYRUPEN-MOPGFXCFSA-N 1 2 323.440 4.002 20 0 DIADLO CC[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000504151807 340141783 /nfs/dbraw/zinc/14/17/83/340141783.db2.gz SAXRHOBQYRUPEN-RBUKOAKNSA-N 1 2 323.440 4.002 20 0 DIADLO CC[C@H](CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1)c1ccccc1 ZINC000504918001 340156041 /nfs/dbraw/zinc/15/60/41/340156041.db2.gz FSGKCOMGLJPWAG-CQSZACIVSA-N 1 2 307.397 4.394 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2ccc(CCC)cc2)C(C)C)no1 ZINC000505576385 340171521 /nfs/dbraw/zinc/17/15/21/340171521.db2.gz IJCQNWSNUNYCIU-IBGZPJMESA-N 1 2 315.461 4.462 20 0 DIADLO COc1ccc2ccccc2c1C[N@@H+]1CCn2cccc2[C@H]1C ZINC000505654884 340174215 /nfs/dbraw/zinc/17/42/15/340174215.db2.gz BIJXFDTVZRTVNL-OAHLLOKOSA-N 1 2 306.409 4.227 20 0 DIADLO COc1ccc2ccccc2c1C[N@H+]1CCn2cccc2[C@H]1C ZINC000505654884 340174216 /nfs/dbraw/zinc/17/42/16/340174216.db2.gz BIJXFDTVZRTVNL-OAHLLOKOSA-N 1 2 306.409 4.227 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cnc(-c2ccccc2)s1 ZINC000505708105 340175331 /nfs/dbraw/zinc/17/53/31/340175331.db2.gz WOJNVQGLCHCMDX-AWEZNQCLSA-N 1 2 309.438 4.188 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cnc(-c2ccccc2)s1 ZINC000505708105 340175332 /nfs/dbraw/zinc/17/53/32/340175332.db2.gz WOJNVQGLCHCMDX-AWEZNQCLSA-N 1 2 309.438 4.188 20 0 DIADLO CCCn1c(C[N@H+](C)Cc2ccc(OC)cc2)nc2ccccc21 ZINC000505758358 340176964 /nfs/dbraw/zinc/17/69/64/340176964.db2.gz YRDAOHXFLHHQNT-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO CCCn1c(C[N@@H+](C)Cc2ccc(OC)cc2)nc2ccccc21 ZINC000505758358 340176965 /nfs/dbraw/zinc/17/69/65/340176965.db2.gz YRDAOHXFLHHQNT-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO C(=C\[C@@H]1CCC[N@H+]1Cc1nc(C2CCCC2)no1)\c1ccccc1 ZINC000505819235 340178784 /nfs/dbraw/zinc/17/87/84/340178784.db2.gz LXTWPCXSZSSXIJ-SQVRQVGWSA-N 1 2 323.440 4.405 20 0 DIADLO C(=C\[C@@H]1CCC[N@@H+]1Cc1nc(C2CCCC2)no1)\c1ccccc1 ZINC000505819235 340178785 /nfs/dbraw/zinc/17/87/85/340178785.db2.gz LXTWPCXSZSSXIJ-SQVRQVGWSA-N 1 2 323.440 4.405 20 0 DIADLO CCCCc1noc(C[N@@H+]2CCC[C@H]2/C=C\c2ccccc2)n1 ZINC000505830311 340179152 /nfs/dbraw/zinc/17/91/52/340179152.db2.gz FTWRCUISYVTXLL-QOHRORDFSA-N 1 2 311.429 4.090 20 0 DIADLO CCCCc1noc(C[N@H+]2CCC[C@H]2/C=C\c2ccccc2)n1 ZINC000505830311 340179153 /nfs/dbraw/zinc/17/91/53/340179153.db2.gz FTWRCUISYVTXLL-QOHRORDFSA-N 1 2 311.429 4.090 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1c[nH]nc1C(C)(C)C ZINC000506151791 340186854 /nfs/dbraw/zinc/18/68/54/340186854.db2.gz SXJHAMOSFADOGC-UHFFFAOYSA-N 1 2 321.852 4.001 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1c[nH]nc1C(C)(C)C ZINC000506151791 340186855 /nfs/dbraw/zinc/18/68/55/340186855.db2.gz SXJHAMOSFADOGC-UHFFFAOYSA-N 1 2 321.852 4.001 20 0 DIADLO CC[N@@H+](Cc1ccco1)Cc1cc(Br)ccc1F ZINC000507007684 340205305 /nfs/dbraw/zinc/20/53/05/340205305.db2.gz LKZHRJCABRQESB-UHFFFAOYSA-N 1 2 312.182 4.203 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000506736304 340200453 /nfs/dbraw/zinc/20/04/53/340200453.db2.gz PQZWVKFDUWWODD-ZDUSSCGKSA-N 1 2 309.438 4.258 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000506736304 340200454 /nfs/dbraw/zinc/20/04/54/340200454.db2.gz PQZWVKFDUWWODD-ZDUSSCGKSA-N 1 2 309.438 4.258 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1c[nH]c(-c2ccccc2)n1 ZINC000506736304 340200455 /nfs/dbraw/zinc/20/04/55/340200455.db2.gz PQZWVKFDUWWODD-ZDUSSCGKSA-N 1 2 309.438 4.258 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1c[nH]c(-c2ccccc2)n1 ZINC000506736304 340200456 /nfs/dbraw/zinc/20/04/56/340200456.db2.gz PQZWVKFDUWWODD-ZDUSSCGKSA-N 1 2 309.438 4.258 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1c[nH]c(-c2ccccc2)n1)C1CC1 ZINC000506734904 340200579 /nfs/dbraw/zinc/20/05/79/340200579.db2.gz LUUNWIFTHYSNFJ-UHFFFAOYSA-N 1 2 321.399 4.380 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1c[nH]c(-c2ccccc2)n1)C1CC1 ZINC000506734904 340200580 /nfs/dbraw/zinc/20/05/80/340200580.db2.gz LUUNWIFTHYSNFJ-UHFFFAOYSA-N 1 2 321.399 4.380 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)c(C)[nH+]1 ZINC000506782140 340201703 /nfs/dbraw/zinc/20/17/03/340201703.db2.gz VEIZDAJWHGWWTQ-IENJSVCTSA-N 1 2 321.424 4.408 20 0 DIADLO CCCCc1nc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2C)no1 ZINC000507002476 340205075 /nfs/dbraw/zinc/20/50/75/340205075.db2.gz PSIOJEOQYXEJLT-HNNXBMFYSA-N 1 2 301.434 4.222 20 0 DIADLO CCCCc1nc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2C)no1 ZINC000507002476 340205076 /nfs/dbraw/zinc/20/50/76/340205076.db2.gz PSIOJEOQYXEJLT-HNNXBMFYSA-N 1 2 301.434 4.222 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1ncc(C(C)(C)C)s1)CCO2 ZINC000516603247 340205280 /nfs/dbraw/zinc/20/52/80/340205280.db2.gz UESBURCSJGLKSP-UHFFFAOYSA-N 1 2 316.470 4.144 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1ncc(C(C)(C)C)s1)CCO2 ZINC000516603247 340205281 /nfs/dbraw/zinc/20/52/81/340205281.db2.gz UESBURCSJGLKSP-UHFFFAOYSA-N 1 2 316.470 4.144 20 0 DIADLO CC[N@H+](Cc1ccco1)Cc1cc(Br)ccc1F ZINC000507007684 340205304 /nfs/dbraw/zinc/20/53/04/340205304.db2.gz LKZHRJCABRQESB-UHFFFAOYSA-N 1 2 312.182 4.203 20 0 DIADLO COCc1ccccc1/C=C(\C)C[N@H+](C)Cc1csc(C)n1 ZINC000507089732 340207030 /nfs/dbraw/zinc/20/70/30/340207030.db2.gz VFCMCUFIXOBKOZ-NTEUORMPSA-N 1 2 316.470 4.133 20 0 DIADLO COCc1ccccc1/C=C(\C)C[N@@H+](C)Cc1csc(C)n1 ZINC000507089732 340207031 /nfs/dbraw/zinc/20/70/31/340207031.db2.gz VFCMCUFIXOBKOZ-NTEUORMPSA-N 1 2 316.470 4.133 20 0 DIADLO CCc1nocc1C[N@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000507159619 340209964 /nfs/dbraw/zinc/20/99/64/340209964.db2.gz JBFGNZQKUKGDKE-LRDDRELGSA-N 1 2 300.402 4.118 20 0 DIADLO CCc1nocc1C[N@@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000507159619 340209965 /nfs/dbraw/zinc/20/99/65/340209965.db2.gz JBFGNZQKUKGDKE-LRDDRELGSA-N 1 2 300.402 4.118 20 0 DIADLO COc1ccc(OC)c(C[N@H+](C)[C@@H](C)c2c(F)cccc2F)c1 ZINC000507190643 340212221 /nfs/dbraw/zinc/21/22/21/340212221.db2.gz FCHSVVXUNOTWMZ-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc(OC)c(C[N@@H+](C)[C@@H](C)c2c(F)cccc2F)c1 ZINC000507190643 340212222 /nfs/dbraw/zinc/21/22/22/340212222.db2.gz FCHSVVXUNOTWMZ-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1cc(Br)ccc1F ZINC000507190092 340212276 /nfs/dbraw/zinc/21/22/76/340212276.db2.gz KWLAVJSRGKQFMU-SNVBAGLBSA-N 1 2 312.182 4.374 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1cc(Br)ccc1F ZINC000507190092 340212277 /nfs/dbraw/zinc/21/22/77/340212277.db2.gz KWLAVJSRGKQFMU-SNVBAGLBSA-N 1 2 312.182 4.374 20 0 DIADLO Cc1[nH+]c2ccccn2c1CN(C)[C@@H](C)c1c(F)cccc1F ZINC000507202542 340212976 /nfs/dbraw/zinc/21/29/76/340212976.db2.gz JXKKLOOEXUENFT-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1nc2ccccn2c1C[N@@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000507202542 340212977 /nfs/dbraw/zinc/21/29/77/340212977.db2.gz JXKKLOOEXUENFT-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1nc2ccccn2c1C[N@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000507202542 340212978 /nfs/dbraw/zinc/21/29/78/340212978.db2.gz JXKKLOOEXUENFT-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1ccc(F)cc1Br ZINC000507208824 340213648 /nfs/dbraw/zinc/21/36/48/340213648.db2.gz GEMUVDSDLLAQNP-SNVBAGLBSA-N 1 2 312.182 4.374 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1ccc(F)cc1Br ZINC000507208824 340213649 /nfs/dbraw/zinc/21/36/49/340213649.db2.gz GEMUVDSDLLAQNP-SNVBAGLBSA-N 1 2 312.182 4.374 20 0 DIADLO CCc1nn(C)c(CC)c1C[N@H+](C)[C@H](C)c1c(F)cccc1F ZINC000507212828 340213891 /nfs/dbraw/zinc/21/38/91/340213891.db2.gz PANRLJCUQVNQKL-GFCCVEGCSA-N 1 2 321.415 4.016 20 0 DIADLO CCc1nn(C)c(CC)c1C[N@@H+](C)[C@H](C)c1c(F)cccc1F ZINC000507212828 340213892 /nfs/dbraw/zinc/21/38/92/340213892.db2.gz PANRLJCUQVNQKL-GFCCVEGCSA-N 1 2 321.415 4.016 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000507258439 340215866 /nfs/dbraw/zinc/21/58/66/340215866.db2.gz CAAPJKPUYRWVOT-UGSOOPFHSA-N 1 2 317.379 4.272 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000507258439 340215867 /nfs/dbraw/zinc/21/58/67/340215867.db2.gz CAAPJKPUYRWVOT-UGSOOPFHSA-N 1 2 317.379 4.272 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)C[C@H]1OCCc2ccccc21 ZINC000507258438 340215952 /nfs/dbraw/zinc/21/59/52/340215952.db2.gz CAAPJKPUYRWVOT-SCLBCKFNSA-N 1 2 317.379 4.272 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)C[C@H]1OCCc2ccccc21 ZINC000507258438 340215953 /nfs/dbraw/zinc/21/59/53/340215953.db2.gz CAAPJKPUYRWVOT-SCLBCKFNSA-N 1 2 317.379 4.272 20 0 DIADLO CC(C)c1nc(C[N@H+](C)CCc2cccc3ccccc32)no1 ZINC000507301037 340216740 /nfs/dbraw/zinc/21/67/40/340216740.db2.gz DESSQFWKJIGDDO-UHFFFAOYSA-N 1 2 309.413 4.021 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)CCc2cccc3ccccc32)no1 ZINC000507301037 340216741 /nfs/dbraw/zinc/21/67/41/340216741.db2.gz DESSQFWKJIGDDO-UHFFFAOYSA-N 1 2 309.413 4.021 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000507362393 340218094 /nfs/dbraw/zinc/21/80/94/340218094.db2.gz YQGPIDFJAOSDFW-VQSDEBNRSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000507362393 340218095 /nfs/dbraw/zinc/21/80/95/340218095.db2.gz YQGPIDFJAOSDFW-VQSDEBNRSA-N 1 2 315.363 4.052 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+]Cc1coc(-c2cccs2)n1 ZINC000507463425 340220823 /nfs/dbraw/zinc/22/08/23/340220823.db2.gz SWCUAAHQHOWYQZ-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+]Cc1coc(-c2ccc(C)cc2)n1 ZINC000507483984 340222071 /nfs/dbraw/zinc/22/20/71/340222071.db2.gz IQPQWPUGOJDLQA-HNNXBMFYSA-N 1 2 321.424 4.458 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+]Cc1ncoc1-c1ccccc1 ZINC000507511416 340223433 /nfs/dbraw/zinc/22/34/33/340223433.db2.gz ODMCEQOSJRTMTO-AWEZNQCLSA-N 1 2 307.397 4.150 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(O)c2Cl)C[C@@H](c2ccccc2)O1 ZINC000507783898 340231382 /nfs/dbraw/zinc/23/13/82/340231382.db2.gz HHTTZIOMMUZNHW-DYVFJYSZSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(O)c2Cl)C[C@@H](c2ccccc2)O1 ZINC000507783898 340231383 /nfs/dbraw/zinc/23/13/83/340231383.db2.gz HHTTZIOMMUZNHW-DYVFJYSZSA-N 1 2 317.816 4.008 20 0 DIADLO Cc1ccc(N[C@@H](c2[nH+]ccn2C)c2cccc(F)c2)c(F)c1 ZINC000507813622 340232799 /nfs/dbraw/zinc/23/27/99/340232799.db2.gz JZTNYVJUMBNGRP-QGZVFWFLSA-N 1 2 313.351 4.208 20 0 DIADLO Fc1ccc(F)c2c1CC[C@@H]2[NH2+][C@H]1COc2ccc(Cl)cc21 ZINC000507869508 340234772 /nfs/dbraw/zinc/23/47/72/340234772.db2.gz AIENWDNQWCFPIX-GJZGRUSLSA-N 1 2 321.754 4.329 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(-c3ccc(Cl)cc3)n2)[C@@H](C)CO1 ZINC000508057835 340238490 /nfs/dbraw/zinc/23/84/90/340238490.db2.gz PMDAKTWDHPHRKK-RYUDHWBXSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(-c3ccc(Cl)cc3)n2)[C@@H](C)CO1 ZINC000508057835 340238491 /nfs/dbraw/zinc/23/84/91/340238491.db2.gz PMDAKTWDHPHRKK-RYUDHWBXSA-N 1 2 322.861 4.073 20 0 DIADLO Cc1cnn(C)c1CNc1ccc(-c2ccc(Cl)s2)c[nH+]1 ZINC000508499951 340245016 /nfs/dbraw/zinc/24/50/16/340245016.db2.gz ATTFHPBDSMKKAP-UHFFFAOYSA-N 1 2 318.833 4.118 20 0 DIADLO CC[C@H](C)[C@@H](C(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000508520343 340245546 /nfs/dbraw/zinc/24/55/46/340245546.db2.gz GMVOACXBIWJMTH-IFXJQAMLSA-N 1 2 321.424 4.411 20 0 DIADLO Cc1cc(C)cc(-c2ccc(C[N@@H+](C)Cc3nccn3C)cc2)c1 ZINC000508661202 340249908 /nfs/dbraw/zinc/24/99/08/340249908.db2.gz ZAXCUPOOVWEGON-UHFFFAOYSA-N 1 2 319.452 4.336 20 0 DIADLO Cc1cc(C)cc(-c2ccc(C[N@H+](C)Cc3nccn3C)cc2)c1 ZINC000508661202 340249909 /nfs/dbraw/zinc/24/99/09/340249909.db2.gz ZAXCUPOOVWEGON-UHFFFAOYSA-N 1 2 319.452 4.336 20 0 DIADLO CCn1nccc1C[N@H+](Cc1ccccc1)Cc1ccccc1F ZINC000508774658 340252942 /nfs/dbraw/zinc/25/29/42/340252942.db2.gz NPNRSCAMLANDFT-UHFFFAOYSA-N 1 2 323.415 4.245 20 0 DIADLO CCn1nccc1C[N@@H+](Cc1ccccc1)Cc1ccccc1F ZINC000508774658 340252943 /nfs/dbraw/zinc/25/29/43/340252943.db2.gz NPNRSCAMLANDFT-UHFFFAOYSA-N 1 2 323.415 4.245 20 0 DIADLO CCC[C@@H]1C[N@H+](Cc2nc(-c3ccc(C)cc3)cs2)CCO1 ZINC000509023443 340258638 /nfs/dbraw/zinc/25/86/38/340258638.db2.gz QJHSEUPCUBYGLE-MRXNPFEDSA-N 1 2 316.470 4.119 20 0 DIADLO CCC[C@@H]1C[N@@H+](Cc2nc(-c3ccc(C)cc3)cs2)CCO1 ZINC000509023443 340258639 /nfs/dbraw/zinc/25/86/39/340258639.db2.gz QJHSEUPCUBYGLE-MRXNPFEDSA-N 1 2 316.470 4.119 20 0 DIADLO CC[C@]1(C)COCC[N@@H+]1Cc1nc(-c2ccc(C)cc2)cs1 ZINC000509023583 340258680 /nfs/dbraw/zinc/25/86/80/340258680.db2.gz RBXFZFILGWKZIT-GOSISDBHSA-N 1 2 316.470 4.119 20 0 DIADLO CC[C@]1(C)COCC[N@H+]1Cc1nc(-c2ccc(C)cc2)cs1 ZINC000509023583 340258681 /nfs/dbraw/zinc/25/86/81/340258681.db2.gz RBXFZFILGWKZIT-GOSISDBHSA-N 1 2 316.470 4.119 20 0 DIADLO C[N@H+](CCCCOc1ccccc1C(F)(F)F)CC(F)F ZINC000509114374 340261604 /nfs/dbraw/zinc/26/16/04/340261604.db2.gz WPOJXYQGQDFJQR-UHFFFAOYSA-N 1 2 311.294 4.061 20 0 DIADLO C[N@@H+](CCCCOc1ccccc1C(F)(F)F)CC(F)F ZINC000509114374 340261605 /nfs/dbraw/zinc/26/16/05/340261605.db2.gz WPOJXYQGQDFJQR-UHFFFAOYSA-N 1 2 311.294 4.061 20 0 DIADLO Cc1cccc(CNC(=O)c2ccccc2Oc2cc[nH+]cc2)c1 ZINC000509146927 340262394 /nfs/dbraw/zinc/26/23/94/340262394.db2.gz NUBQBDDCYPNUIU-UHFFFAOYSA-N 1 2 318.376 4.112 20 0 DIADLO COC(=O)c1cccc(Cl)c1C[N@H+](C)[C@H](C)c1cccs1 ZINC000509295841 340265646 /nfs/dbraw/zinc/26/56/46/340265646.db2.gz WDAGHKQAOMCWEA-LLVKDONJSA-N 1 2 323.845 4.381 20 0 DIADLO COC(=O)c1cccc(Cl)c1C[N@@H+](C)[C@H](C)c1cccs1 ZINC000509295841 340265647 /nfs/dbraw/zinc/26/56/47/340265647.db2.gz WDAGHKQAOMCWEA-LLVKDONJSA-N 1 2 323.845 4.381 20 0 DIADLO CC[C@H]1CCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509364640 340267422 /nfs/dbraw/zinc/26/74/22/340267422.db2.gz JXSNCNYCLHSLRI-HNNXBMFYSA-N 1 2 310.397 4.136 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+]1CCc2cc(F)ccc2C1 ZINC000509419018 340268802 /nfs/dbraw/zinc/26/88/02/340268802.db2.gz IUWUQILETDXUGP-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+]1CCc2cc(F)ccc2C1 ZINC000509419018 340268803 /nfs/dbraw/zinc/26/88/03/340268803.db2.gz IUWUQILETDXUGP-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO COc1cc2c(cc1F)CC[C@@H]2Nc1ccc2ccccc2[nH+]1 ZINC000509480268 340271022 /nfs/dbraw/zinc/27/10/22/340271022.db2.gz QAIDHJVUQCNWGO-KRWDZBQOSA-N 1 2 308.356 4.482 20 0 DIADLO Cc1cccc(N(C)C(=O)c2ccccc2Oc2cc[nH+]cc2)c1 ZINC000509498866 340271539 /nfs/dbraw/zinc/27/15/39/340271539.db2.gz DMHDMNHITABYLN-UHFFFAOYSA-N 1 2 318.376 4.459 20 0 DIADLO FCCCC[N@@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000509671351 340276375 /nfs/dbraw/zinc/27/63/75/340276375.db2.gz DTJZOKMUSXVRJE-CQSZACIVSA-N 1 2 306.208 4.116 20 0 DIADLO FCCCC[N@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000509671351 340276376 /nfs/dbraw/zinc/27/63/76/340276376.db2.gz DTJZOKMUSXVRJE-CQSZACIVSA-N 1 2 306.208 4.116 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)c1cc2c(s1)CCCCCC2 ZINC000509796815 340279400 /nfs/dbraw/zinc/27/94/00/340279400.db2.gz XSCMITHGJVDCRY-UHFFFAOYSA-N 1 2 314.454 4.039 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)c1ccc(Oc2ccccc2)cc1 ZINC000509805019 340279616 /nfs/dbraw/zinc/27/96/16/340279616.db2.gz IKVLKZCEUFXSIE-UHFFFAOYSA-N 1 2 318.376 4.111 20 0 DIADLO CC[C@@H](CC1CCCC1)C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000510041566 340286102 /nfs/dbraw/zinc/28/61/02/340286102.db2.gz NPCDATCCNKXOMI-INIZCTEOSA-N 1 2 311.429 4.417 20 0 DIADLO CC(C)CCC[C@@H](C)NC(=O)C[N@H+](C)[C@H](C)c1ccccc1F ZINC000510080827 340288014 /nfs/dbraw/zinc/28/80/14/340288014.db2.gz BFVAARSENBIZEE-HZPDHXFCSA-N 1 2 322.468 4.150 20 0 DIADLO CC(C)CCC[C@@H](C)NC(=O)C[N@@H+](C)[C@H](C)c1ccccc1F ZINC000510080827 340288015 /nfs/dbraw/zinc/28/80/15/340288015.db2.gz BFVAARSENBIZEE-HZPDHXFCSA-N 1 2 322.468 4.150 20 0 DIADLO CCCc1noc(C[N@@H+](Cc2ccccc2Cl)CC2CC2)n1 ZINC000510254733 340294248 /nfs/dbraw/zinc/29/42/48/340294248.db2.gz HQSROGOWPLFMKG-UHFFFAOYSA-N 1 2 319.836 4.088 20 0 DIADLO CCCc1noc(C[N@H+](Cc2ccccc2Cl)CC2CC2)n1 ZINC000510254733 340294249 /nfs/dbraw/zinc/29/42/49/340294249.db2.gz HQSROGOWPLFMKG-UHFFFAOYSA-N 1 2 319.836 4.088 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2c(F)ccc(O)c2F)cc1 ZINC000510344766 340296528 /nfs/dbraw/zinc/29/65/28/340296528.db2.gz DPPPUOBOSDCGTM-UHFFFAOYSA-N 1 2 305.368 4.258 20 0 DIADLO CCc1nc(C(C)(C)[NH2+]Cc2ccc(C(C)(C)CC)cc2)no1 ZINC000510789839 340311161 /nfs/dbraw/zinc/31/11/61/340311161.db2.gz CCOPCWBNZKLZKA-UHFFFAOYSA-N 1 2 315.461 4.345 20 0 DIADLO Clc1ccc(C[N@@H+]2CCO[C@]3(CCc4ccccc43)C2)s1 ZINC000510805939 340311552 /nfs/dbraw/zinc/31/15/52/340311552.db2.gz DGATXNLBXLAMEB-QGZVFWFLSA-N 1 2 319.857 4.075 20 0 DIADLO Clc1ccc(C[N@H+]2CCO[C@]3(CCc4ccccc43)C2)s1 ZINC000510805939 340311553 /nfs/dbraw/zinc/31/15/53/340311553.db2.gz DGATXNLBXLAMEB-QGZVFWFLSA-N 1 2 319.857 4.075 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000511115464 340321379 /nfs/dbraw/zinc/32/13/79/340321379.db2.gz MWWAFMKYJCTCIR-KRWDZBQOSA-N 1 2 317.429 4.121 20 0 DIADLO CSc1ccccc1C[N@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000511115464 340321380 /nfs/dbraw/zinc/32/13/80/340321380.db2.gz MWWAFMKYJCTCIR-KRWDZBQOSA-N 1 2 317.429 4.121 20 0 DIADLO C[C@@H]1C[C@@H](C)[C@H](C)N(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000511290564 340324844 /nfs/dbraw/zinc/32/48/44/340324844.db2.gz YEZYSBZVCJRZMJ-OAGGEKHMSA-N 1 2 324.424 4.381 20 0 DIADLO O=C(C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1)c1c[nH]c2ccccc12 ZINC000511627530 340332900 /nfs/dbraw/zinc/33/29/00/340332900.db2.gz WVAUIODOCSOQAN-GOSISDBHSA-N 1 2 324.811 4.451 20 0 DIADLO O=C(C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1)c1c[nH]c2ccccc12 ZINC000511627530 340332901 /nfs/dbraw/zinc/33/29/01/340332901.db2.gz WVAUIODOCSOQAN-GOSISDBHSA-N 1 2 324.811 4.451 20 0 DIADLO C[N@H+](Cc1cc(-c2ccco2)on1)Cc1ccc(F)c(Cl)c1 ZINC000511663250 340334328 /nfs/dbraw/zinc/33/43/28/340334328.db2.gz CQLBOLHEVQHFOR-UHFFFAOYSA-N 1 2 320.751 4.359 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccco2)on1)Cc1ccc(F)c(Cl)c1 ZINC000511663250 340334329 /nfs/dbraw/zinc/33/43/29/340334329.db2.gz CQLBOLHEVQHFOR-UHFFFAOYSA-N 1 2 320.751 4.359 20 0 DIADLO Fc1c(Cl)cccc1C[N@@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000511662107 340334357 /nfs/dbraw/zinc/33/43/57/340334357.db2.gz HGGFJAJJQQBJOJ-HNNXBMFYSA-N 1 2 323.795 4.253 20 0 DIADLO Fc1c(Cl)cccc1C[N@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000511662107 340334358 /nfs/dbraw/zinc/33/43/58/340334358.db2.gz HGGFJAJJQQBJOJ-HNNXBMFYSA-N 1 2 323.795 4.253 20 0 DIADLO Cc1ccc(C[NH2+]Cc2c(F)ccc(O)c2F)c(OC(C)C)c1 ZINC000511673673 340334876 /nfs/dbraw/zinc/33/48/76/340334876.db2.gz VPLGNDNJYYKAQF-UHFFFAOYSA-N 1 2 321.367 4.056 20 0 DIADLO CCc1cc(N(C)[C@@H]2CCCC[C@H]2C)nc(-c2ccncc2)[nH+]1 ZINC000303608774 340337110 /nfs/dbraw/zinc/33/71/10/340337110.db2.gz QVMAOWNYBZNTJI-RHSMWYFYSA-N 1 2 310.445 4.116 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)C(C)(C)CCCc1ccccc1 ZINC000511878413 340341548 /nfs/dbraw/zinc/34/15/48/340341548.db2.gz HQUHVGSFNSUJQX-UHFFFAOYSA-N 1 2 310.441 4.054 20 0 DIADLO C[N@H+](Cc1cc(F)c(F)c(F)c1)Cc1cccc(O)c1Cl ZINC000512005628 340345153 /nfs/dbraw/zinc/34/51/53/340345153.db2.gz HWMJGTZTMAFZTN-UHFFFAOYSA-N 1 2 315.722 4.095 20 0 DIADLO C[N@@H+](Cc1cc(F)c(F)c(F)c1)Cc1cccc(O)c1Cl ZINC000512005628 340345154 /nfs/dbraw/zinc/34/51/54/340345154.db2.gz HWMJGTZTMAFZTN-UHFFFAOYSA-N 1 2 315.722 4.095 20 0 DIADLO C[C@H]1CC[C@@H](c2ccccc2)[N@H+](Cc2noc(C(C)(C)C)n2)C1 ZINC000512188551 340351464 /nfs/dbraw/zinc/35/14/64/340351464.db2.gz ZYKWXLWWOHWDMY-HOCLYGCPSA-N 1 2 313.445 4.340 20 0 DIADLO C[C@H]1CC[C@@H](c2ccccc2)[N@@H+](Cc2noc(C(C)(C)C)n2)C1 ZINC000512188551 340351465 /nfs/dbraw/zinc/35/14/65/340351465.db2.gz ZYKWXLWWOHWDMY-HOCLYGCPSA-N 1 2 313.445 4.340 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+]1C[C@@H](CC)[S@@](=O)[C@@H](C)C1 ZINC000512426065 340361554 /nfs/dbraw/zinc/36/15/54/340361554.db2.gz DSPCLOLBPYVMKA-WJBZZZKMSA-N 1 2 313.894 4.023 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+]1C[C@@H](CC)[S@@](=O)[C@@H](C)C1 ZINC000512426065 340361555 /nfs/dbraw/zinc/36/15/55/340361555.db2.gz DSPCLOLBPYVMKA-WJBZZZKMSA-N 1 2 313.894 4.023 20 0 DIADLO CC(C)COc1ccc(C[N@@H+]2CCCC[C@@H]2c2ncc[nH]2)cc1 ZINC000512541663 340365994 /nfs/dbraw/zinc/36/59/94/340365994.db2.gz GZUDZBLAICGSOS-GOSISDBHSA-N 1 2 313.445 4.172 20 0 DIADLO CC(C)COc1ccc(C[N@H+]2CCCC[C@@H]2c2ncc[nH]2)cc1 ZINC000512541663 340365995 /nfs/dbraw/zinc/36/59/95/340365995.db2.gz GZUDZBLAICGSOS-GOSISDBHSA-N 1 2 313.445 4.172 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000173604014 340368576 /nfs/dbraw/zinc/36/85/76/340368576.db2.gz PAHXYXPDNCSHCD-KBPBESRZSA-N 1 2 321.207 4.439 20 0 DIADLO COc1cccc(C2([NH2+]Cc3ncc(C(C)C)s3)CC2)c1 ZINC000512893395 340383043 /nfs/dbraw/zinc/38/30/43/340383043.db2.gz CQWLGNFOJLNEDH-UHFFFAOYSA-N 1 2 302.443 4.054 20 0 DIADLO FC(F)C1([NH2+]Cc2cc(-c3ccccc3)n[nH]2)CCCCC1 ZINC000512898951 340383340 /nfs/dbraw/zinc/38/33/40/340383340.db2.gz MFPAJOPDKUZVAZ-UHFFFAOYSA-N 1 2 305.372 4.134 20 0 DIADLO CCc1ncc(C[NH2+]CC(F)(F)c2ccc(Cl)cc2)s1 ZINC000512992297 340387319 /nfs/dbraw/zinc/38/73/19/340387319.db2.gz KIALMAATYCOSFU-UHFFFAOYSA-N 1 2 316.804 4.241 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(Cl)c1F)c1c(F)cncc1F ZINC000513055638 340391294 /nfs/dbraw/zinc/39/12/94/340391294.db2.gz CZGAOPYVZQBZIW-MRVPVSSYSA-N 1 2 300.711 4.003 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)cc1F)c1c(F)cncc1F ZINC000513065840 340391734 /nfs/dbraw/zinc/39/17/34/340391734.db2.gz YFBMBEAQMDZSJV-QMMMGPOBSA-N 1 2 300.711 4.003 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)c(F)c1)c1c(F)cncc1F ZINC000513074594 340392224 /nfs/dbraw/zinc/39/22/24/340392224.db2.gz IGJKYSYDEKXLTP-QMMMGPOBSA-N 1 2 300.711 4.003 20 0 DIADLO CC(C)[C@@H](CNc1ccc(Cn2cc[nH+]c2)cn1)c1ccccc1 ZINC000513087478 340392701 /nfs/dbraw/zinc/39/27/01/340392701.db2.gz AQTQBAICFXABTC-LJQANCHMSA-N 1 2 320.440 4.178 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000513123737 340394337 /nfs/dbraw/zinc/39/43/37/340394337.db2.gz WJNBOCMCWQZEPV-GFCCVEGCSA-N 1 2 303.789 4.001 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+]1CCOc2cc(O)ccc2C1 ZINC000513123737 340394338 /nfs/dbraw/zinc/39/43/38/340394338.db2.gz WJNBOCMCWQZEPV-GFCCVEGCSA-N 1 2 303.789 4.001 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000513144500 340395002 /nfs/dbraw/zinc/39/50/02/340395002.db2.gz LISLWUNSXIHCNM-LBPRGKRZSA-N 1 2 303.789 4.001 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCOc2cc(O)ccc2C1 ZINC000513144500 340395003 /nfs/dbraw/zinc/39/50/03/340395003.db2.gz LISLWUNSXIHCNM-LBPRGKRZSA-N 1 2 303.789 4.001 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1ccncc1Cl)CCC2 ZINC000174858030 340397709 /nfs/dbraw/zinc/39/77/09/340397709.db2.gz NZEWRAHIQBVWGP-AWEZNQCLSA-N 1 2 307.850 4.009 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccncc1Cl)CCC2 ZINC000174858030 340397710 /nfs/dbraw/zinc/39/77/10/340397710.db2.gz NZEWRAHIQBVWGP-AWEZNQCLSA-N 1 2 307.850 4.009 20 0 DIADLO CCCCN(C(=O)CCn1cc[nH+]c1)[C@H](CC)c1ccccc1 ZINC000513228120 340398435 /nfs/dbraw/zinc/39/84/35/340398435.db2.gz UWQSEGMREHSDAV-GOSISDBHSA-N 1 2 313.445 4.053 20 0 DIADLO CC[C@H](CC1CCCC1)C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000513450513 340408375 /nfs/dbraw/zinc/40/83/75/340408375.db2.gz BDMFKIGCIYIUSZ-MRXNPFEDSA-N 1 2 311.429 4.417 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+]Cc1cccc2c1OCCO2 ZINC000517552568 340472088 /nfs/dbraw/zinc/47/20/88/340472088.db2.gz MRWKTWTXMOFCEZ-UHFFFAOYSA-N 1 2 324.207 4.054 20 0 DIADLO Cc1cc(C)c(NCc2[nH+]ccn2C(C)C)cc1Br ZINC000186022203 340507453 /nfs/dbraw/zinc/50/74/53/340507453.db2.gz MIPXQAQZDKBCFH-UHFFFAOYSA-N 1 2 322.250 4.455 20 0 DIADLO COc1ccsc1[C@@H](C)[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000186179290 340509131 /nfs/dbraw/zinc/50/91/31/340509131.db2.gz SVSWVTMFGLNRRL-GFCCVEGCSA-N 1 2 314.410 4.263 20 0 DIADLO Cc1ccc(-c2nnc(SCc3ccc(C)[nH+]c3C)n2C)cc1 ZINC000187309710 340519012 /nfs/dbraw/zinc/51/90/12/340519012.db2.gz ZOYMCYSRZZDOOB-UHFFFAOYSA-N 1 2 324.453 4.095 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(Cl)ccc(F)c1Cl)c1cn[nH]c1 ZINC000222506449 340537784 /nfs/dbraw/zinc/53/77/84/340537784.db2.gz BTKQTFBXSZZVHC-YUMQZZPRSA-N 1 2 302.180 4.267 20 0 DIADLO Cc1cccn2cc(-c3ccc(N[C@@H]4CCOC[C@@H]4C)cc3)[nH+]c12 ZINC000195084024 340573890 /nfs/dbraw/zinc/57/38/90/340573890.db2.gz IYYJKOYPFFEIPL-MAUKXSAKSA-N 1 2 321.424 4.147 20 0 DIADLO Cc1cccc(C(=O)Nc2ccc3[nH+]c(N(C)C)ccc3c2)c1C ZINC000195705190 340586029 /nfs/dbraw/zinc/58/60/29/340586029.db2.gz NWRIXKUGXQUVMB-UHFFFAOYSA-N 1 2 319.408 4.170 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000227600038 340601065 /nfs/dbraw/zinc/60/10/65/340601065.db2.gz OAKBUGVSABUAKU-DGCLKSJQSA-N 1 2 305.805 4.355 20 0 DIADLO Cc1cc(C)cc(NC(=O)Nc2cccc(-c3[nH+]ccn3C)c2)c1 ZINC000523023675 340613887 /nfs/dbraw/zinc/61/38/87/340613887.db2.gz XLRMUNFSIGBHNO-UHFFFAOYSA-N 1 2 320.396 4.348 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cnc(-c2ccccc2)nc1)c1nccs1 ZINC000523527618 340627901 /nfs/dbraw/zinc/62/79/01/340627901.db2.gz BRDQIGPQHKXSBE-GOSISDBHSA-N 1 2 324.453 4.015 20 0 DIADLO CCC[C@@H](C(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000524276460 340651554 /nfs/dbraw/zinc/65/15/54/340651554.db2.gz OVPSRRSNZJKYTH-QGZVFWFLSA-N 1 2 307.397 4.165 20 0 DIADLO CCc1cc(N(CC)Cc2ccccc2)nc(-c2ccncc2)[nH+]1 ZINC000524685738 340661062 /nfs/dbraw/zinc/66/10/62/340661062.db2.gz SOKZQIRLKJHAKA-UHFFFAOYSA-N 1 2 318.424 4.128 20 0 DIADLO FC(F)C(F)(F)C[NH2+]Cc1ccc(-c2ccccc2)s1 ZINC000236220196 340662554 /nfs/dbraw/zinc/66/25/54/340662554.db2.gz WOVQXXVZBNUOMH-UHFFFAOYSA-N 1 2 303.324 4.405 20 0 DIADLO FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]c2ccc(-n3cccn3)cc2)C1 ZINC000237782143 340673932 /nfs/dbraw/zinc/67/39/32/340673932.db2.gz GPXJJBHISXLIJM-TZMCWYRMSA-N 1 2 309.335 4.405 20 0 DIADLO Cc1cn2cc(NC(=O)[C@H](C)c3cccc(Cl)c3)ccc2[nH+]1 ZINC000525152676 340692737 /nfs/dbraw/zinc/69/27/37/340692737.db2.gz TUYLOINWVKTYNH-GFCCVEGCSA-N 1 2 313.788 4.038 20 0 DIADLO Clc1ccc(C[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)o1 ZINC000525182629 340693995 /nfs/dbraw/zinc/69/39/95/340693995.db2.gz DJJFACRDSZQKLP-JTQLQIEISA-N 1 2 318.587 4.463 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)C[C@@H](C)C1CCCCC1 ZINC000529096415 340744847 /nfs/dbraw/zinc/74/48/47/340744847.db2.gz ZZHGMYYKIDSARS-CQSZACIVSA-N 1 2 303.450 4.379 20 0 DIADLO COC[C@H]([NH2+]Cc1ccsc1C(F)(F)F)c1ccc(C)o1 ZINC000529546674 340762148 /nfs/dbraw/zinc/76/21/48/340762148.db2.gz URMVQUXCZDEYSU-NSHDSACASA-N 1 2 319.348 4.146 20 0 DIADLO Cc1cccc(-c2noc(C[NH2+]C3(c4ccccc4)CCC3)n2)c1 ZINC000064337726 340802853 /nfs/dbraw/zinc/80/28/53/340802853.db2.gz VNEWYVROOIAQTB-UHFFFAOYSA-N 1 2 319.408 4.214 20 0 DIADLO FC(F)(F)C1CCC(Nc2ccc(N3CCCC3)[nH+]c2)CC1 ZINC000125902631 340814876 /nfs/dbraw/zinc/81/48/76/340814876.db2.gz KSNLQQOWNFZCMC-UHFFFAOYSA-N 1 2 313.367 4.215 20 0 DIADLO Cc1csc(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)n1 ZINC000126010218 340819732 /nfs/dbraw/zinc/81/97/32/340819732.db2.gz QHCLGLFPGHBLHJ-SFHVURJKSA-N 1 2 312.413 4.470 20 0 DIADLO Fc1ccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)cc1Cl ZINC000126582300 340828874 /nfs/dbraw/zinc/82/88/74/340828874.db2.gz NQNUWEZYPZCMCJ-MRXNPFEDSA-N 1 2 315.779 4.081 20 0 DIADLO C[C@@H](Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1cc(F)ccc1F ZINC000538633776 340836165 /nfs/dbraw/zinc/83/61/65/340836165.db2.gz KJPPJTBYVQWDTA-LLVKDONJSA-N 1 2 317.314 4.463 20 0 DIADLO C[C@H]([NH2+][C@@H](c1cccs1)c1ccc(F)cc1)c1cnccn1 ZINC000539073050 340870592 /nfs/dbraw/zinc/87/05/92/340870592.db2.gz NFDUXBJKIIPSAD-YVEFUNNKSA-N 1 2 313.401 4.117 20 0 DIADLO Cc1cccc(NC(=O)C[NH2+][C@H](C)c2c(F)cccc2Cl)c1 ZINC000539378608 340883168 /nfs/dbraw/zinc/88/31/68/340883168.db2.gz BEXVNTNWCDCTHC-GFCCVEGCSA-N 1 2 320.795 4.077 20 0 DIADLO COc1c(C)c[nH+]c(COc2ccc(C(C)=O)cc2Cl)c1C ZINC000128508862 340891512 /nfs/dbraw/zinc/89/15/12/340891512.db2.gz YOTTUAGIXWPGDW-UHFFFAOYSA-N 1 2 319.788 4.142 20 0 DIADLO CCc1nc(CN(C)c2[nH+]ccc3ccc(F)cc32)cs1 ZINC000539889408 340908464 /nfs/dbraw/zinc/90/84/64/340908464.db2.gz HPMMMMLUKQBZDU-UHFFFAOYSA-N 1 2 301.390 4.029 20 0 DIADLO C[C@@H]([NH2+][C@@H](C(=O)Nc1ccccc1)c1ccccc1)c1ccco1 ZINC000540175561 340920693 /nfs/dbraw/zinc/92/06/93/340920693.db2.gz KBPDISHAFNLIGA-DNVCBOLYSA-N 1 2 320.392 4.310 20 0 DIADLO Cc1cc(C[NH2+][C@@H](COCc2ccccc2)c2ccccc2)on1 ZINC000540459886 340932195 /nfs/dbraw/zinc/93/21/95/340932195.db2.gz TUWULGMRQPAGPK-FQEVSTJZSA-N 1 2 322.408 4.031 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(Cl)cc1F ZINC000541061073 340958138 /nfs/dbraw/zinc/95/81/38/340958138.db2.gz ABIFUZAJPVBJIB-HNNXBMFYSA-N 1 2 323.799 4.226 20 0 DIADLO c1nc(-c2ccccn2)sc1CNc1c[nH+]c2c(c1)CCCC2 ZINC000541065884 340958314 /nfs/dbraw/zinc/95/83/14/340958314.db2.gz QDFOCLAPZVKJQW-UHFFFAOYSA-N 1 2 322.437 4.091 20 0 DIADLO Fc1ccc2c(c1)N(Cc1[nH+]ccn1Cc1ccccc1)CCC2 ZINC000541784813 340984280 /nfs/dbraw/zinc/98/42/80/340984280.db2.gz VSWQCOFLQKNKOA-UHFFFAOYSA-N 1 2 321.399 4.023 20 0 DIADLO Fc1cccc(CCSCc2cn3ccccc3[nH+]2)c1F ZINC000542222205 341000843 /nfs/dbraw/zinc/00/08/43/341000843.db2.gz KZQAICDQQSINAC-UHFFFAOYSA-N 1 2 304.365 4.088 20 0 DIADLO Brc1ccc([C@@H]2CCCN2c2cccc[nH+]2)s1 ZINC000542274289 341002926 /nfs/dbraw/zinc/00/29/26/341002926.db2.gz KOFUIOFOJSDZGA-JTQLQIEISA-N 1 2 309.232 4.247 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1cccs1 ZINC000542555889 341013412 /nfs/dbraw/zinc/01/34/12/341013412.db2.gz XNOHKRWBYSRDAS-GFCCVEGCSA-N 1 2 307.463 4.306 20 0 DIADLO CCc1cnc(C[N@H+](C)C/C=C\c2ccc(F)cc2F)s1 ZINC000542702677 341017912 /nfs/dbraw/zinc/01/79/12/341017912.db2.gz OJYWMPRDKFUDNM-PLNGDYQASA-N 1 2 308.397 4.129 20 0 DIADLO CCc1cnc(C[N@@H+](C)C/C=C\c2ccc(F)cc2F)s1 ZINC000542702677 341017913 /nfs/dbraw/zinc/01/79/13/341017913.db2.gz OJYWMPRDKFUDNM-PLNGDYQASA-N 1 2 308.397 4.129 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)c1ccon1 ZINC000542715742 341018767 /nfs/dbraw/zinc/01/87/67/341018767.db2.gz ZXMWYWKNEQGDIQ-MRVPVSSYSA-N 1 2 304.699 4.198 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3C)C2)s1 ZINC000564259711 341020801 /nfs/dbraw/zinc/02/08/01/341020801.db2.gz DYKWCCRACRSSSQ-INIZCTEOSA-N 1 2 319.495 4.352 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@H](c3ccccc3C)C2)s1 ZINC000564259711 341020802 /nfs/dbraw/zinc/02/08/02/341020802.db2.gz DYKWCCRACRSSSQ-INIZCTEOSA-N 1 2 319.495 4.352 20 0 DIADLO CC(C)Cc1ncc(CNc2c[nH+]c3c(c2)CCCC3)s1 ZINC000542922923 341026482 /nfs/dbraw/zinc/02/64/82/341026482.db2.gz AMBYYDZIYIWJJV-UHFFFAOYSA-N 1 2 301.459 4.228 20 0 DIADLO CC[N@H+](Cc1nc(C(F)(F)F)cs1)Cc1ccccc1 ZINC000130540553 341027239 /nfs/dbraw/zinc/02/72/39/341027239.db2.gz QMJDKJXZYJCJDG-UHFFFAOYSA-N 1 2 300.349 4.184 20 0 DIADLO CC[N@@H+](Cc1nc(C(F)(F)F)cs1)Cc1ccccc1 ZINC000130540553 341027240 /nfs/dbraw/zinc/02/72/40/341027240.db2.gz QMJDKJXZYJCJDG-UHFFFAOYSA-N 1 2 300.349 4.184 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CCOCC2(CC2)C1 ZINC000542986482 341027822 /nfs/dbraw/zinc/02/78/22/341027822.db2.gz WEMFBGOFZDJFLG-NSHDSACASA-N 1 2 300.229 4.167 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCOCC2(CC2)C1 ZINC000542986482 341027823 /nfs/dbraw/zinc/02/78/23/341027823.db2.gz WEMFBGOFZDJFLG-NSHDSACASA-N 1 2 300.229 4.167 20 0 DIADLO Cc1ccc2oc(N3CCC(CCCn4cc[nH+]c4)CC3)nc2c1 ZINC000543050145 341029488 /nfs/dbraw/zinc/02/94/88/341029488.db2.gz ABSISNVNZDYZLA-UHFFFAOYSA-N 1 2 324.428 4.030 20 0 DIADLO CCCC[C@@H](CC)C(=O)N1CCC(CCCn2cc[nH+]c2)CC1 ZINC000543096266 341031642 /nfs/dbraw/zinc/03/16/42/341031642.db2.gz ZHSPPYKIGMWYLU-GOSISDBHSA-N 1 2 319.493 4.118 20 0 DIADLO COc1ccc2oc([C@@H](C)[NH2+][C@H](C)c3ncc(C)o3)c(C)c2c1 ZINC000543510963 341048043 /nfs/dbraw/zinc/04/80/43/341048043.db2.gz XBHGCAQYRNYHJH-CHWSQXEVSA-N 1 2 314.385 4.458 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc(C2CCCC2)no1 ZINC000130846503 341048889 /nfs/dbraw/zinc/04/88/89/341048889.db2.gz XLGQMFVKZHDFTC-LLVKDONJSA-N 1 2 321.371 4.198 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc(C2CCCC2)no1 ZINC000130846503 341048890 /nfs/dbraw/zinc/04/88/90/341048890.db2.gz XLGQMFVKZHDFTC-LLVKDONJSA-N 1 2 321.371 4.198 20 0 DIADLO CCN(CC)c1ccc(CNC(=O)[C@H](C)CCC(C)(C)C)c[nH+]1 ZINC000543550219 341048902 /nfs/dbraw/zinc/04/89/02/341048902.db2.gz MUBRUKYKFRWNAJ-OAHLLOKOSA-N 1 2 319.493 4.006 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@@H](c2ccccc2)c2cncnc2)o1 ZINC000543600165 341050606 /nfs/dbraw/zinc/05/06/06/341050606.db2.gz CDCUMKLXDDXVNE-WNYOCNMUSA-N 1 2 319.408 4.072 20 0 DIADLO CC[C@@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1ccn(C)n1 ZINC000543625474 341051595 /nfs/dbraw/zinc/05/15/95/341051595.db2.gz MEGSWLGBSPTYLZ-CYBMUJFWSA-N 1 2 324.255 4.457 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCOC[C@H]2c2ccccc2)c(F)c1 ZINC000543631349 341052148 /nfs/dbraw/zinc/05/21/48/341052148.db2.gz KAYRZSIWJFRYQT-OCTSTCLRSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCOC[C@H]2c2ccccc2)c(F)c1 ZINC000543631349 341052149 /nfs/dbraw/zinc/05/21/49/341052149.db2.gz KAYRZSIWJFRYQT-OCTSTCLRSA-N 1 2 315.363 4.052 20 0 DIADLO Cc1ccc(Nc2nc(C[NH2+][C@@H](C)c3cccnc3)cs2)cc1 ZINC000543976291 341064866 /nfs/dbraw/zinc/06/48/66/341064866.db2.gz AUYAPUJXCBEBJY-AWEZNQCLSA-N 1 2 324.453 4.441 20 0 DIADLO CC[C@H](C)Oc1ccc(-c2nc(Cc3ccc(C)[nH+]c3)no2)cc1 ZINC000544188504 341073682 /nfs/dbraw/zinc/07/36/82/341073682.db2.gz AKNPVHLBZLMJKB-AWEZNQCLSA-N 1 2 323.396 4.208 20 0 DIADLO Cc1ccc(-c2noc([C@H](C)[NH2+]Cc3ccccc3)n2)cc1F ZINC000544515874 341084757 /nfs/dbraw/zinc/08/47/57/341084757.db2.gz QRJFBSKFIISIHX-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1ccccc1)c1cccc(F)c1)c1ccn(C)n1 ZINC000544566413 341085945 /nfs/dbraw/zinc/08/59/45/341085945.db2.gz GLYXTMFXYKLEPX-ICSRJNTNSA-N 1 2 323.415 4.390 20 0 DIADLO COc1ccc2oc([C@H](C)[NH2+][C@@H](C)c3ccon3)c(C)c2c1 ZINC000544605073 341088393 /nfs/dbraw/zinc/08/83/93/341088393.db2.gz XVSLBCWCSSIVAD-RYUDHWBXSA-N 1 2 300.358 4.150 20 0 DIADLO COc1ccccc1-c1ccc(C[NH2+][C@@H](C)c2ccon2)cc1 ZINC000544617571 341089487 /nfs/dbraw/zinc/08/94/87/341089487.db2.gz SOUWPBRLOJMWKY-AWEZNQCLSA-N 1 2 308.381 4.201 20 0 DIADLO CC(C)CCc1noc(CCn2c3ccccc3[nH+]c2C2CC2)n1 ZINC000544819419 341094693 /nfs/dbraw/zinc/09/46/93/341094693.db2.gz QVGVPLWYCDEDDL-UHFFFAOYSA-N 1 2 324.428 4.128 20 0 DIADLO Cc1cc(NC(=O)COc2ccccc2-c2ccccc2)cc[nH+]1 ZINC000072709841 341100529 /nfs/dbraw/zinc/10/05/29/341100529.db2.gz PJKRXLMHRDEXMY-UHFFFAOYSA-N 1 2 318.376 4.075 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1cnn(C(C)(C)C)c1 ZINC000131601442 341100951 /nfs/dbraw/zinc/10/09/51/341100951.db2.gz BKFJVHOALUWULD-LBPRGKRZSA-N 1 2 307.388 4.109 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cnn(C(C)(C)C)c1 ZINC000131601442 341100952 /nfs/dbraw/zinc/10/09/52/341100952.db2.gz BKFJVHOALUWULD-LBPRGKRZSA-N 1 2 307.388 4.109 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@H](c1ccccc1)C1CC1 ZINC000131662030 341107035 /nfs/dbraw/zinc/10/70/35/341107035.db2.gz IXTGZPXUSXJBQB-GOSISDBHSA-N 1 2 317.392 4.209 20 0 DIADLO CSc1ccc(C(=O)Nc2c[nH+]ccc2OC(C)(C)C)cc1 ZINC000131672938 341107636 /nfs/dbraw/zinc/10/76/36/341107636.db2.gz CBVWJKKSEKLGOT-UHFFFAOYSA-N 1 2 316.426 4.233 20 0 DIADLO c1csc(-c2cnc(COc3cccc(-n4cc[nH+]c4)c3)o2)c1 ZINC000131694000 341108992 /nfs/dbraw/zinc/10/89/92/341108992.db2.gz UKPQHCCEUAEFGA-UHFFFAOYSA-N 1 2 323.377 4.168 20 0 DIADLO CCCCS[C@@H](C)C(=O)Nc1c[nH+]ccc1OC(C)(C)C ZINC000131818795 341112147 /nfs/dbraw/zinc/11/21/47/341112147.db2.gz BELJOBCLOGPKKS-LBPRGKRZSA-N 1 2 310.463 4.119 20 0 DIADLO Oc1cc(F)cc(C[NH2+]Cc2c(Cl)cccc2Cl)c1 ZINC000545315745 341120910 /nfs/dbraw/zinc/12/09/10/341120910.db2.gz RNOMWSJQVNNHQR-UHFFFAOYSA-N 1 2 300.160 4.128 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@@H](C)c2c(C)cccc2C)n1 ZINC000545519212 341128256 /nfs/dbraw/zinc/12/82/56/341128256.db2.gz GHKRHMVGFJANRB-KBPBESRZSA-N 1 2 319.474 4.351 20 0 DIADLO c1cn(Cc2cccc(-c3noc(CC4CCCCC4)n3)c2)c[nH+]1 ZINC000545569509 341130870 /nfs/dbraw/zinc/13/08/70/341130870.db2.gz IRHMRLRAJNQWTE-UHFFFAOYSA-N 1 2 322.412 4.104 20 0 DIADLO CC(C)(C)/C=C/c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000545573424 341131091 /nfs/dbraw/zinc/13/10/91/341131091.db2.gz OXMQBYWMIOMSLW-BQYQJAHWSA-N 1 2 308.385 4.041 20 0 DIADLO Cc1ccc(Cc2noc(-c3cc4cc(C)c(C)cc4o3)n2)c[nH+]1 ZINC000545641578 341134530 /nfs/dbraw/zinc/13/45/30/341134530.db2.gz FPPFCQKIKDEZNZ-UHFFFAOYSA-N 1 2 319.364 4.394 20 0 DIADLO Cc1cccc(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)c1F ZINC000545691025 341136554 /nfs/dbraw/zinc/13/65/54/341136554.db2.gz JPSYHPTVZVCLST-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CC[C@H](C)c1ccc([C@@H]([NH2+]Cc2noc(C)n2)C(C)C)cc1 ZINC000132712504 341143212 /nfs/dbraw/zinc/14/32/12/341143212.db2.gz PXTSQPLYCWPIFJ-UGSOOPFHSA-N 1 2 301.434 4.378 20 0 DIADLO Fc1cccc(-c2nc(C[N@@H+]3CCc4ccsc4C3)co2)c1 ZINC000132940882 341150197 /nfs/dbraw/zinc/15/01/97/341150197.db2.gz CHFIVJUEOPNAQG-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1cccc(-c2nc(C[N@H+]3CCc4ccsc4C3)co2)c1 ZINC000132940882 341150198 /nfs/dbraw/zinc/15/01/98/341150198.db2.gz CHFIVJUEOPNAQG-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO c1coc(-c2nc(C[N@@H+]3CCc4ccsc4C3)cs2)c1 ZINC000132973676 341150954 /nfs/dbraw/zinc/15/09/54/341150954.db2.gz XQWOSGFMRAMHNF-UHFFFAOYSA-N 1 2 302.424 4.023 20 0 DIADLO c1coc(-c2nc(C[N@H+]3CCc4ccsc4C3)cs2)c1 ZINC000132973676 341150955 /nfs/dbraw/zinc/15/09/55/341150955.db2.gz XQWOSGFMRAMHNF-UHFFFAOYSA-N 1 2 302.424 4.023 20 0 DIADLO Cc1cn2cc(NC(=O)N[C@H](C)c3c(C)cccc3C)ccc2[nH+]1 ZINC000546222882 341157687 /nfs/dbraw/zinc/15/76/87/341157687.db2.gz NWVZZFAABUKTHC-OAHLLOKOSA-N 1 2 322.412 4.142 20 0 DIADLO CCCC[C@H](CC)Cc1nc(Cc2cn3ccccc3[nH+]2)no1 ZINC000546335510 341164044 /nfs/dbraw/zinc/16/40/44/341164044.db2.gz SWNVQZSHZFDCDA-AWEZNQCLSA-N 1 2 312.417 4.067 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000133512304 341177100 /nfs/dbraw/zinc/17/71/00/341177100.db2.gz GJUDLQXOVFSRHZ-LLVKDONJSA-N 1 2 322.449 4.439 20 0 DIADLO CCn1nc(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)c2ccccc21 ZINC000546728431 341180654 /nfs/dbraw/zinc/18/06/54/341180654.db2.gz WYMQWEZHQMKODS-CZUORRHYSA-N 1 2 309.413 4.062 20 0 DIADLO CCn1nc(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)c2ccccc21 ZINC000546728432 341180672 /nfs/dbraw/zinc/18/06/72/341180672.db2.gz WYMQWEZHQMKODS-XJKSGUPXSA-N 1 2 309.413 4.062 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2nc(C(C)(C)C)no2)C1 ZINC000075842986 341185901 /nfs/dbraw/zinc/18/59/01/341185901.db2.gz JSKHVJAEMYBDLW-DOMZBBRYSA-N 1 2 317.408 4.089 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2nc(C(C)(C)C)no2)C1 ZINC000075842986 341185902 /nfs/dbraw/zinc/18/59/02/341185902.db2.gz JSKHVJAEMYBDLW-DOMZBBRYSA-N 1 2 317.408 4.089 20 0 DIADLO Cc1ccc(Cc2noc(Cc3csc4ccccc34)n2)c[nH+]1 ZINC000547045736 341193304 /nfs/dbraw/zinc/19/33/04/341193304.db2.gz HCWIAVPCOVXBMT-UHFFFAOYSA-N 1 2 321.405 4.169 20 0 DIADLO Cc1ccc2c(Cc3nc(Cc4ccc(C)[nH+]c4)no3)coc2c1 ZINC000547047059 341193498 /nfs/dbraw/zinc/19/34/98/341193498.db2.gz NKAIXPQIXFLMPW-UHFFFAOYSA-N 1 2 319.364 4.009 20 0 DIADLO Cc1ccc(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)cc1F ZINC000547106835 341196167 /nfs/dbraw/zinc/19/61/67/341196167.db2.gz BHHPJVYHPNCACB-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CCc2ccc(F)cc2C1 ZINC000133898534 341198178 /nfs/dbraw/zinc/19/81/78/341198178.db2.gz TXMIVEGQRBQVCB-GFCCVEGCSA-N 1 2 302.393 4.231 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCc2ccc(F)cc2C1 ZINC000133898534 341198179 /nfs/dbraw/zinc/19/81/79/341198179.db2.gz TXMIVEGQRBQVCB-GFCCVEGCSA-N 1 2 302.393 4.231 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc3ccccc3n2)[C@H](c2ccccc2)CO1 ZINC000076148348 341202930 /nfs/dbraw/zinc/20/29/30/341202930.db2.gz LXMIKARNWYLISI-IERDGZPVSA-N 1 2 318.420 4.197 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc3ccccc3n2)[C@H](c2ccccc2)CO1 ZINC000076148348 341202931 /nfs/dbraw/zinc/20/29/31/341202931.db2.gz LXMIKARNWYLISI-IERDGZPVSA-N 1 2 318.420 4.197 20 0 DIADLO CCCCc1nc(C[NH2+]C2(c3ccccc3)CCCCC2)no1 ZINC000134040768 341205101 /nfs/dbraw/zinc/20/51/01/341205101.db2.gz FHVPGRVUOUNBGX-UHFFFAOYSA-N 1 2 313.445 4.361 20 0 DIADLO C[C@H]([NH2+]Cc1nc2c(s1)C[C@H](C)CC2)c1ccc(F)cc1F ZINC000134195993 341209114 /nfs/dbraw/zinc/20/91/14/341209114.db2.gz IDCDODPMQMHNEJ-MNOVXSKESA-N 1 2 322.424 4.397 20 0 DIADLO C[C@@H]([NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1)c1nccn1C ZINC000547395647 341210781 /nfs/dbraw/zinc/21/07/81/341210781.db2.gz YTNFLQJZNNOQCU-SNVBAGLBSA-N 1 2 310.228 4.067 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)nc2ccccc12 ZINC000547517967 341219764 /nfs/dbraw/zinc/21/97/64/341219764.db2.gz KAMVIORZSRORDG-GXTWGEPZSA-N 1 2 323.362 4.101 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)nc2ccccc12 ZINC000547517967 341219765 /nfs/dbraw/zinc/21/97/65/341219765.db2.gz KAMVIORZSRORDG-GXTWGEPZSA-N 1 2 323.362 4.101 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)nc2ccccc12 ZINC000547517970 341219828 /nfs/dbraw/zinc/21/98/28/341219828.db2.gz KAMVIORZSRORDG-TZMCWYRMSA-N 1 2 323.362 4.101 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)nc2ccccc12 ZINC000547517970 341219829 /nfs/dbraw/zinc/21/98/29/341219829.db2.gz KAMVIORZSRORDG-TZMCWYRMSA-N 1 2 323.362 4.101 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](C/C=C\c3ccccc3)CCO2)c(F)c1 ZINC000547647692 341224975 /nfs/dbraw/zinc/22/49/75/341224975.db2.gz DDQBZKQNEQGNBV-BQHGXPCASA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](C/C=C\c3ccccc3)CCO2)c(F)c1 ZINC000547647692 341224976 /nfs/dbraw/zinc/22/49/76/341224976.db2.gz DDQBZKQNEQGNBV-BQHGXPCASA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](C/C=C\c3ccccc3)CCO2)c(F)c1 ZINC000547647693 341225020 /nfs/dbraw/zinc/22/50/20/341225020.db2.gz DDQBZKQNEQGNBV-OCTSTCLRSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](C/C=C\c3ccccc3)CCO2)c(F)c1 ZINC000547647693 341225021 /nfs/dbraw/zinc/22/50/21/341225021.db2.gz DDQBZKQNEQGNBV-OCTSTCLRSA-N 1 2 315.363 4.052 20 0 DIADLO C[C@H]([NH2+]Cc1csc(C(C)(C)C)n1)c1nc2c(s1)CCC2 ZINC000134856657 341225360 /nfs/dbraw/zinc/22/53/60/341225360.db2.gz XUBIHCHESHUDQM-JTQLQIEISA-N 1 2 321.515 4.237 20 0 DIADLO Cn1nccc1C[NH+]1CCC(c2c(Cl)cccc2Cl)CC1 ZINC000564337920 341243621 /nfs/dbraw/zinc/24/36/21/341243621.db2.gz QMGPCLPPKYZVDL-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO Cc1ccc(OCc2nc(C[NH+]3[C@H](C)C[C@H]3C)cs2)cc1 ZINC000548097792 341246941 /nfs/dbraw/zinc/24/69/41/341246941.db2.gz YQIUKRNSYHMWET-ZIAGYGMSSA-N 1 2 302.443 4.013 20 0 DIADLO CC(C)(C)C1CCC([NH2+][C@@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000548176137 341251675 /nfs/dbraw/zinc/25/16/75/341251675.db2.gz PRIQIQHOVFZPNN-OFLPRAFFSA-N 1 2 312.461 4.089 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+]Cc2ccc(F)cc2Cl)o1 ZINC000136215937 341255087 /nfs/dbraw/zinc/25/50/87/341255087.db2.gz MSJLVDNSCRJODH-OAHLLOKOSA-N 1 2 311.784 4.112 20 0 DIADLO C[C@H](Cc1ccsc1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000548317828 341255860 /nfs/dbraw/zinc/25/58/60/341255860.db2.gz ZHTOWYGBWAIHDX-SJKOYZFVSA-N 1 2 323.408 4.031 20 0 DIADLO C[C@H](Cc1ccsc1)[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000548317828 341255861 /nfs/dbraw/zinc/25/58/61/341255861.db2.gz ZHTOWYGBWAIHDX-SJKOYZFVSA-N 1 2 323.408 4.031 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)oc1C ZINC000136377928 341257805 /nfs/dbraw/zinc/25/78/05/341257805.db2.gz SQZAVBNERJAPIT-UHFFFAOYSA-N 1 2 308.337 4.336 20 0 DIADLO Cc1c(N[C@@H](C)c2cn3ccccc3[nH+]2)cnn1-c1ccccc1 ZINC000548384160 341258118 /nfs/dbraw/zinc/25/81/18/341258118.db2.gz KGVWVUNROSKZOT-AWEZNQCLSA-N 1 2 317.396 4.002 20 0 DIADLO Cc1ccc(-c2ccc(C)c(NC(=O)[C@@H](C)Cc3c[nH+]c[nH]3)c2)o1 ZINC000564350272 341259821 /nfs/dbraw/zinc/25/98/21/341259821.db2.gz LQPOTZFCYYRAGI-ZDUSSCGKSA-N 1 2 323.396 4.104 20 0 DIADLO Cc1ccc(-c2ccc(C)c(NC(=O)[C@@H](C)Cc3c[nH]c[nH+]3)c2)o1 ZINC000564350272 341259822 /nfs/dbraw/zinc/25/98/22/341259822.db2.gz LQPOTZFCYYRAGI-ZDUSSCGKSA-N 1 2 323.396 4.104 20 0 DIADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1cccc(Br)c1OC(F)F ZINC000548426231 341260037 /nfs/dbraw/zinc/26/00/37/341260037.db2.gz CPCCAPVHNNDYGX-DTORHVGOSA-N 1 2 320.177 4.033 20 0 DIADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cccc(Br)c1OC(F)F ZINC000548426231 341260038 /nfs/dbraw/zinc/26/00/38/341260038.db2.gz CPCCAPVHNNDYGX-DTORHVGOSA-N 1 2 320.177 4.033 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+]1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000548425629 341260086 /nfs/dbraw/zinc/26/00/86/341260086.db2.gz WDBOLFJIYWOMHD-BFQNTYOBSA-N 1 2 324.262 4.009 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+]1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000548425629 341260087 /nfs/dbraw/zinc/26/00/87/341260087.db2.gz WDBOLFJIYWOMHD-BFQNTYOBSA-N 1 2 324.262 4.009 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+]1C[C@@H](C)O[C@H](C2CC2)C1 ZINC000548425630 341260118 /nfs/dbraw/zinc/26/01/18/341260118.db2.gz WDBOLFJIYWOMHD-HSMVNMDESA-N 1 2 324.262 4.009 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+]1C[C@@H](C)O[C@H](C2CC2)C1 ZINC000548425630 341260119 /nfs/dbraw/zinc/26/01/19/341260119.db2.gz WDBOLFJIYWOMHD-HSMVNMDESA-N 1 2 324.262 4.009 20 0 DIADLO COC[C@H](CC(C)C)[NH2+]c1ccc(N2CCSCC2)cc1C ZINC000548522235 341265640 /nfs/dbraw/zinc/26/56/40/341265640.db2.gz OTYILBSQQZJNEX-INIZCTEOSA-N 1 2 322.518 4.021 20 0 DIADLO CC(C)N(CC1CC1)C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000548871067 341279000 /nfs/dbraw/zinc/27/90/00/341279000.db2.gz MXNZQZHKUXAAJR-UHFFFAOYSA-N 1 2 310.397 4.135 20 0 DIADLO CC(C)(C)C[N@H+](Cc1ncnn1C(C)(C)C)Cc1ccccc1 ZINC000548918908 341281085 /nfs/dbraw/zinc/28/10/85/341281085.db2.gz CMSOHBMPKHWQTF-UHFFFAOYSA-N 1 2 314.477 4.081 20 0 DIADLO CC(C)(C)C[N@@H+](Cc1ncnn1C(C)(C)C)Cc1ccccc1 ZINC000548918908 341281086 /nfs/dbraw/zinc/28/10/86/341281086.db2.gz CMSOHBMPKHWQTF-UHFFFAOYSA-N 1 2 314.477 4.081 20 0 DIADLO CC(C)C1(CNC(=O)c2ccccc2Oc2cc[nH+]cc2)CC1 ZINC000549016445 341283641 /nfs/dbraw/zinc/28/36/41/341283641.db2.gz AFXOOCVKJQGIOY-UHFFFAOYSA-N 1 2 310.397 4.040 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1COc1ccc2c(c1F)CCC2=O ZINC000549067520 341285309 /nfs/dbraw/zinc/28/53/09/341285309.db2.gz XKQWBCSDRMPEFJ-UHFFFAOYSA-N 1 2 313.372 4.360 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nc(C(C)(C)C)no2)[C@H]1c1cccc(F)c1 ZINC000245409847 341291725 /nfs/dbraw/zinc/29/17/25/341291725.db2.gz OGDVOHSNIFZWCN-BLLLJJGKSA-N 1 2 317.408 4.089 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nc(C(C)(C)C)no2)[C@H]1c1cccc(F)c1 ZINC000245409847 341291726 /nfs/dbraw/zinc/29/17/26/341291726.db2.gz OGDVOHSNIFZWCN-BLLLJJGKSA-N 1 2 317.408 4.089 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC000549463994 341295168 /nfs/dbraw/zinc/29/51/68/341295168.db2.gz BJAVNDIGPUZXFB-HRAATJIYSA-N 1 2 324.468 4.475 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC000549463994 341295169 /nfs/dbraw/zinc/29/51/69/341295169.db2.gz BJAVNDIGPUZXFB-HRAATJIYSA-N 1 2 324.468 4.475 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nccn2Cc2ccccc2)[C@@H]1c1ccccc1 ZINC000081574816 341297297 /nfs/dbraw/zinc/29/72/97/341297297.db2.gz QQYRLQXCUXUZPU-UTKZUKDTSA-N 1 2 317.436 4.124 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nccn2Cc2ccccc2)[C@@H]1c1ccccc1 ZINC000081574816 341297298 /nfs/dbraw/zinc/29/72/98/341297298.db2.gz QQYRLQXCUXUZPU-UTKZUKDTSA-N 1 2 317.436 4.124 20 0 DIADLO CC(C)c1ccc(C(=O)N[C@H](c2[nH]cc[nH+]2)C(C)C)cc1Cl ZINC000549754116 341302084 /nfs/dbraw/zinc/30/20/84/341302084.db2.gz YKXZYLNZQJERLJ-HNNXBMFYSA-N 1 2 319.836 4.314 20 0 DIADLO Fc1cccc([C@H]2CCN(c3cc(C(F)(F)F)cc[nH+]3)C2)c1 ZINC000549921202 341306739 /nfs/dbraw/zinc/30/67/39/341306739.db2.gz RVUNCIPAOPCZII-LBPRGKRZSA-N 1 2 310.294 4.233 20 0 DIADLO CC(C)Oc1cccc(CNc2cc(C(F)(F)F)cc[nH+]2)c1 ZINC000549925832 341306894 /nfs/dbraw/zinc/30/68/94/341306894.db2.gz ZATNFNLIGLWCED-UHFFFAOYSA-N 1 2 310.319 4.500 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)[C@H]1C ZINC000549924333 341306978 /nfs/dbraw/zinc/30/69/78/341306978.db2.gz WQRUNRBIUGCJBF-RYUDHWBXSA-N 1 2 306.862 4.228 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)[C@H]1C ZINC000549924333 341306979 /nfs/dbraw/zinc/30/69/79/341306979.db2.gz WQRUNRBIUGCJBF-RYUDHWBXSA-N 1 2 306.862 4.228 20 0 DIADLO CC[C@H](C)C[C@H](CC)[NH2+][C@@H](c1noc(C)n1)c1ccccc1F ZINC000245652564 341308071 /nfs/dbraw/zinc/30/80/71/341308071.db2.gz BNUOIFCXEIRGHU-RVSPLBMKSA-N 1 2 319.424 4.411 20 0 DIADLO FC[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1Br ZINC000550029765 341308980 /nfs/dbraw/zinc/30/89/80/341308980.db2.gz WKABOJAKJJJSFU-NSHDSACASA-N 1 2 306.606 4.036 20 0 DIADLO FC[C@@H]1CCC[N@H+]1Cc1ccc(Cl)cc1Br ZINC000550029765 341308981 /nfs/dbraw/zinc/30/89/81/341308981.db2.gz WKABOJAKJJJSFU-NSHDSACASA-N 1 2 306.606 4.036 20 0 DIADLO Cc1cc(Cl)cc(C[NH2+]Cc2nc(C(F)(F)F)cs2)c1 ZINC000550157035 341311322 /nfs/dbraw/zinc/31/13/22/341311322.db2.gz RKJGSIXFIFKSEY-UHFFFAOYSA-N 1 2 320.767 4.414 20 0 DIADLO Cc1cc(Cl)cc(C[NH2+]Cc2nnc(C(C)(C)C)s2)c1 ZINC000550172221 341311751 /nfs/dbraw/zinc/31/17/51/341311751.db2.gz VLWANETUZFXGJD-UHFFFAOYSA-N 1 2 309.866 4.087 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)[C@@H](C)C(C)(F)F)cc2[nH+]1 ZINC000550198432 341312183 /nfs/dbraw/zinc/31/21/83/341312183.db2.gz ZKPKDTKOYYRZCF-SNVBAGLBSA-N 1 2 309.360 4.135 20 0 DIADLO Cc1cc(Cl)cc(C[NH2+]Cc2cc(COC(C)(C)C)on2)c1 ZINC000550199786 341312281 /nfs/dbraw/zinc/31/22/81/341312281.db2.gz LYXDLSISGHGHON-UHFFFAOYSA-N 1 2 322.836 4.241 20 0 DIADLO Cc1nc(C[N@@H+]2CCCCC[C@H]2Cc2ccccc2Cl)no1 ZINC000550264797 341313740 /nfs/dbraw/zinc/31/37/40/341313740.db2.gz KFJICVJEZKBTKF-HNNXBMFYSA-N 1 2 319.836 4.019 20 0 DIADLO Cc1nc(C[N@H+]2CCCCC[C@H]2Cc2ccccc2Cl)no1 ZINC000550264797 341313741 /nfs/dbraw/zinc/31/37/41/341313741.db2.gz KFJICVJEZKBTKF-HNNXBMFYSA-N 1 2 319.836 4.019 20 0 DIADLO C[C@@H]1C[C@@H]1[C@@H]([NH2+]Cc1noc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000245908547 341317974 /nfs/dbraw/zinc/31/79/74/341317974.db2.gz OZUKFESVGBIESG-OOVXXXAESA-N 1 2 317.820 4.087 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)n1 ZINC000245920919 341318350 /nfs/dbraw/zinc/31/83/50/341318350.db2.gz QRUHQRMCBXRDMU-KFYUAXIPSA-N 1 2 319.836 4.333 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)n1 ZINC000245920924 341318373 /nfs/dbraw/zinc/31/83/73/341318373.db2.gz QRUHQRMCBXRDMU-PSHZPRKYSA-N 1 2 319.836 4.333 20 0 DIADLO Cc1nc([C@H]([NH2+][C@@H]2CCC[C@@H](C)C2)c2ccc(Cl)cc2)no1 ZINC000245968020 341320284 /nfs/dbraw/zinc/32/02/84/341320284.db2.gz ZHGSHRHCMGDEHA-HFBAOOFYSA-N 1 2 319.836 4.289 20 0 DIADLO CCc1c(NCc2cc(OC)cc(C)[nH+]2)cnn1C(CC)CC ZINC000551359920 341339376 /nfs/dbraw/zinc/33/93/76/341339376.db2.gz CKPAFTYLQPLPDZ-UHFFFAOYSA-N 1 2 316.449 4.131 20 0 DIADLO Cc1ccc2nc(C[N@@H+](C)Cc3ccc(F)c(Cl)c3)cn2c1 ZINC000551582943 341346536 /nfs/dbraw/zinc/34/65/36/341346536.db2.gz FNXVKRCOMSNWJO-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1ccc2nc(C[N@H+](C)Cc3ccc(F)c(Cl)c3)cn2c1 ZINC000551582943 341346537 /nfs/dbraw/zinc/34/65/37/341346537.db2.gz FNXVKRCOMSNWJO-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1nc([C@H]([NH2+][C@H](C)CCC(C)(C)C)c2ccccc2F)no1 ZINC000551788232 341351503 /nfs/dbraw/zinc/35/15/03/341351503.db2.gz ACPZATPJXCURMM-MLGOLLRUSA-N 1 2 319.424 4.411 20 0 DIADLO Cc1c[nH+]c(C)nc1N[C@@H]1CCCc2cc(OC(F)F)ccc21 ZINC000564383214 341351941 /nfs/dbraw/zinc/35/19/41/341351941.db2.gz WCYPHMUEMXPXBK-OAHLLOKOSA-N 1 2 319.355 4.184 20 0 DIADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000246971073 341359313 /nfs/dbraw/zinc/35/93/13/341359313.db2.gz PDKVYKYSNMVICP-MEDUHNTESA-N 1 2 309.768 4.207 20 0 DIADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000246971073 341359314 /nfs/dbraw/zinc/35/93/14/341359314.db2.gz PDKVYKYSNMVICP-MEDUHNTESA-N 1 2 309.768 4.207 20 0 DIADLO C[C@H]1CCC[N@H+](CC(=O)Nc2c(Cl)cccc2Cl)[C@H]1C ZINC000247012268 341359958 /nfs/dbraw/zinc/35/99/58/341359958.db2.gz UGCBGRFUMCJKSE-QWRGUYRKSA-N 1 2 315.244 4.052 20 0 DIADLO C[C@H]1CCC[N@@H+](CC(=O)Nc2c(Cl)cccc2Cl)[C@H]1C ZINC000247012268 341359959 /nfs/dbraw/zinc/35/99/59/341359959.db2.gz UGCBGRFUMCJKSE-QWRGUYRKSA-N 1 2 315.244 4.052 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+]2CCO[C@H](c3cccc(F)c3)C2)o1 ZINC000552033129 341363290 /nfs/dbraw/zinc/36/32/90/341363290.db2.gz NPUXNIWMRCKTIM-XVSDVWIESA-N 1 2 315.388 4.116 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+]2CCO[C@H](c3cccc(F)c3)C2)o1 ZINC000552033129 341363291 /nfs/dbraw/zinc/36/32/91/341363291.db2.gz NPUXNIWMRCKTIM-XVSDVWIESA-N 1 2 315.388 4.116 20 0 DIADLO Cc1ccccc1-c1nc(C[N@H+]2C[C@@H](C)[C@H]2c2ccccc2)no1 ZINC000247388185 341364006 /nfs/dbraw/zinc/36/40/06/341364006.db2.gz LLWADSPMJWGRSD-BEFAXECRSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccccc1-c1nc(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)no1 ZINC000247388185 341364007 /nfs/dbraw/zinc/36/40/07/341364007.db2.gz LLWADSPMJWGRSD-BEFAXECRSA-N 1 2 319.408 4.238 20 0 DIADLO C[C@H](Nc1ccc2nc(C(C)(C)C)sc2c1)c1[nH]cc[nH+]1 ZINC000552065826 341366856 /nfs/dbraw/zinc/36/68/56/341366856.db2.gz PABKELUWFKAUQE-JTQLQIEISA-N 1 2 300.431 4.490 20 0 DIADLO CC(C)(C)n1cc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)cn1 ZINC000552067515 341366923 /nfs/dbraw/zinc/36/69/23/341366923.db2.gz NGJMMLWNQLSWHO-HNNXBMFYSA-N 1 2 301.438 4.095 20 0 DIADLO CC1(C)C[N@H+](Cc2cc3ccc(F)cc3[nH]2)[C@H]1c1ccncc1 ZINC000552068967 341367233 /nfs/dbraw/zinc/36/72/33/341367233.db2.gz XBTZEYTTZTZHIK-SFHVURJKSA-N 1 2 309.388 4.285 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc3ccc(F)cc3[nH]2)[C@H]1c1ccncc1 ZINC000552068967 341367234 /nfs/dbraw/zinc/36/72/34/341367234.db2.gz XBTZEYTTZTZHIK-SFHVURJKSA-N 1 2 309.388 4.285 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247563120 341367569 /nfs/dbraw/zinc/36/75/69/341367569.db2.gz RVNXTYCXQYVFRL-SMDDNHRTSA-N 1 2 309.381 4.161 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247563120 341367570 /nfs/dbraw/zinc/36/75/70/341367570.db2.gz RVNXTYCXQYVFRL-SMDDNHRTSA-N 1 2 309.381 4.161 20 0 DIADLO CCc1ccc(NC2CCN(c3cccc[nH+]3)CC2)cc1Cl ZINC000552100443 341369886 /nfs/dbraw/zinc/36/98/86/341369886.db2.gz IWOCEBHKGIZONV-UHFFFAOYSA-N 1 2 315.848 4.378 20 0 DIADLO CC1=CC[C@@H](Nc2ccc(Cl)c(C[NH+]3CCOCC3)c2)CC1 ZINC000552215498 341378768 /nfs/dbraw/zinc/37/87/68/341378768.db2.gz HVHFJGPCKYJHQZ-MRXNPFEDSA-N 1 2 320.864 4.083 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)s1 ZINC000248509254 341379033 /nfs/dbraw/zinc/37/90/33/341379033.db2.gz YUZSRFZKNDFRBO-ZBFHGGJFSA-N 1 2 316.470 4.229 20 0 DIADLO CC(C)c1cnc(C[N@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)s1 ZINC000248509254 341379034 /nfs/dbraw/zinc/37/90/34/341379034.db2.gz YUZSRFZKNDFRBO-ZBFHGGJFSA-N 1 2 316.470 4.229 20 0 DIADLO C[C@H]1C[N@H+](Cc2nnc(-c3ccccc3)s2)[C@H]1c1ccccc1 ZINC000248639913 341382379 /nfs/dbraw/zinc/38/23/79/341382379.db2.gz WWEYFILDEVPHEE-KBXCAEBGSA-N 1 2 321.449 4.398 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nnc(-c3ccccc3)s2)[C@H]1c1ccccc1 ZINC000248639913 341382380 /nfs/dbraw/zinc/38/23/80/341382380.db2.gz WWEYFILDEVPHEE-KBXCAEBGSA-N 1 2 321.449 4.398 20 0 DIADLO COc1ccc(F)c(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000552284015 341384022 /nfs/dbraw/zinc/38/40/22/341384022.db2.gz PEFVYBNAOVKSHG-MRXNPFEDSA-N 1 2 303.381 4.291 20 0 DIADLO CSc1cc(Br)ccc1C[N@@H+]1CCC[C@H]1CF ZINC000552390748 341390802 /nfs/dbraw/zinc/39/08/02/341390802.db2.gz KSMCXNOHSVMKCR-LBPRGKRZSA-N 1 2 318.255 4.105 20 0 DIADLO CSc1cc(Br)ccc1C[N@H+]1CCC[C@H]1CF ZINC000552390748 341390803 /nfs/dbraw/zinc/39/08/03/341390803.db2.gz KSMCXNOHSVMKCR-LBPRGKRZSA-N 1 2 318.255 4.105 20 0 DIADLO Cc1ccc(SCCC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000552768705 341403768 /nfs/dbraw/zinc/40/37/68/341403768.db2.gz ROWKYQPZBNCULN-UHFFFAOYSA-N 1 2 314.454 4.436 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1cc(F)c(F)c(F)c1 ZINC000090572510 341417240 /nfs/dbraw/zinc/41/72/40/341417240.db2.gz YCHWOYDZKUGVDN-NSHDSACASA-N 1 2 323.362 4.266 20 0 DIADLO COc1cc(C)cc(CNc2[nH+]ccc(C)c2Br)c1 ZINC000553168632 341418566 /nfs/dbraw/zinc/41/85/66/341418566.db2.gz PAFPTOYNCSRAKZ-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO Cc1cc[nH+]c(N[C@@H]2CSc3ccccc32)c1Br ZINC000553436017 341428984 /nfs/dbraw/zinc/42/89/84/341428984.db2.gz XOFXKJPHJSLACU-LLVKDONJSA-N 1 2 321.243 4.411 20 0 DIADLO Clc1cccc2c(N3CCC[C@H]([C@H]4CCOC4)C3)cc[nH+]c12 ZINC000553494870 341430485 /nfs/dbraw/zinc/43/04/85/341430485.db2.gz QROXUXGYHJVIRI-KBPBESRZSA-N 1 2 316.832 4.141 20 0 DIADLO COC[C@@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1ccccc1 ZINC000554050602 341441824 /nfs/dbraw/zinc/44/18/24/341441824.db2.gz DBLHUUVBTQBODX-QZTJIDSGSA-N 1 2 324.449 4.210 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCC1(Cc2ccccc2)CCC1 ZINC000554386107 341452823 /nfs/dbraw/zinc/45/28/23/341452823.db2.gz KWZPGGDVEAKGAL-UHFFFAOYSA-N 1 2 323.440 4.233 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2cccc(F)c2Cl)C2CC2)n1 ZINC000555422208 341482489 /nfs/dbraw/zinc/48/24/89/341482489.db2.gz NJEYKIGWGBDVMK-CQSZACIVSA-N 1 2 310.825 4.485 20 0 DIADLO COc1cccc2c1cc[nH+]c2NC[C@@H](C)c1c(C)noc1C ZINC000556211566 341497449 /nfs/dbraw/zinc/49/74/49/341497449.db2.gz CTBOZIPMXXBFLG-LLVKDONJSA-N 1 2 311.385 4.064 20 0 DIADLO c1sc(-c2ccccc2)nc1C[NH2+][C@@H]1COCc2ccccc21 ZINC000556260103 341499799 /nfs/dbraw/zinc/49/97/99/341499799.db2.gz BYJGWHAWGKXWAX-GOSISDBHSA-N 1 2 322.433 4.171 20 0 DIADLO CCSCCOc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000556287164 341500747 /nfs/dbraw/zinc/50/07/47/341500747.db2.gz IYLGLYKPSRVHJP-UHFFFAOYSA-N 1 2 302.443 4.018 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2nc3c(s2)C[C@H](C)CC3)s1 ZINC000152916772 341511492 /nfs/dbraw/zinc/51/14/92/341511492.db2.gz SKIKPDZNBSDQPG-SNVBAGLBSA-N 1 2 321.515 4.058 20 0 DIADLO Cc1c[nH]c(C(C)(C)NC(=O)c2ccc(C(C)C)c(Cl)c2)[nH+]1 ZINC000565780410 341537958 /nfs/dbraw/zinc/53/79/58/341537958.db2.gz ULRHYKYKAGHVKV-UHFFFAOYSA-N 1 2 319.836 4.160 20 0 DIADLO CC(C)CC1(C)CCN(C(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC000565862687 341540412 /nfs/dbraw/zinc/54/04/12/341540412.db2.gz BVHWYSKGTMXAFB-UHFFFAOYSA-N 1 2 314.433 4.014 20 0 DIADLO Cc1[nH]c(CNc2ccccc2COCc2ccccc2)[nH+]c1C ZINC000565904245 341542059 /nfs/dbraw/zinc/54/20/59/341542059.db2.gz PUOKCHNODXXFTK-UHFFFAOYSA-N 1 2 321.424 4.355 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1c1noc([C@@H](c2ccccc2)[NH+](C)C)n1 ZINC000566013211 341545425 /nfs/dbraw/zinc/54/54/25/341545425.db2.gz IXQJKCCPZWFODU-HYVNUMGLSA-N 1 2 313.445 4.404 20 0 DIADLO Cc1ccc([C@H]2C[C@@H]2c2nc(CCc3[nH+]cccc3C)no2)cc1 ZINC000566097232 341547603 /nfs/dbraw/zinc/54/76/03/341547603.db2.gz GOALDLXTNITQTH-SJORKVTESA-N 1 2 319.408 4.138 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nnc(C)o1)c1ccc(Cl)cc1Cl ZINC000566837513 341569612 /nfs/dbraw/zinc/56/96/12/341569612.db2.gz FDNQCDWWHCDBAI-OQPBUACISA-N 1 2 314.216 4.487 20 0 DIADLO CCc1ccc(C[NH2+][C@H](c2cccc(F)c2)c2ccccn2)o1 ZINC000154109034 341584845 /nfs/dbraw/zinc/58/48/45/341584845.db2.gz LQOVSJYDIBOGGB-LJQANCHMSA-N 1 2 310.372 4.255 20 0 DIADLO O[C@@H](CNc1ccc(Oc2cc[nH+]cc2)cc1)CC1CCCC1 ZINC000567701540 341628582 /nfs/dbraw/zinc/62/85/82/341628582.db2.gz FABRBWSVBXQGKV-QGZVFWFLSA-N 1 2 312.413 4.227 20 0 DIADLO CCc1cccc(C[NH2+][C@@H](c2nccn2C)c2ccc(F)cc2)c1 ZINC000567741126 341630825 /nfs/dbraw/zinc/63/08/25/341630825.db2.gz LHZDYZBBMKYSET-LJQANCHMSA-N 1 2 323.415 4.001 20 0 DIADLO COc1cc(C)[nH+]c(CNc2ccnc(Oc3ccccc3)c2)c1 ZINC000569283812 341696632 /nfs/dbraw/zinc/69/66/32/341696632.db2.gz PYKJMIQOQZSOAE-UHFFFAOYSA-N 1 2 321.380 4.198 20 0 DIADLO COc1cccc2cc([C@@H](C)[NH2+][C@H](C)c3cscn3)oc21 ZINC000573466729 341729223 /nfs/dbraw/zinc/72/92/23/341729223.db2.gz CLYGBOSYNDLNPC-GHMZBOCLSA-N 1 2 302.399 4.310 20 0 DIADLO Cc1cc(N2CC[C@H](c3cccnc3)C2)c2cccc(F)c2[nH+]1 ZINC000573840154 341740770 /nfs/dbraw/zinc/74/07/70/341740770.db2.gz NCCWTDNCUGIWKU-HNNXBMFYSA-N 1 2 307.372 4.071 20 0 DIADLO C[C@@H]1[C@@H](C(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)[C@H]1c1ccccc1 ZINC000573880032 341742031 /nfs/dbraw/zinc/74/20/31/341742031.db2.gz VVFKDPWSLZHEPA-MJXNMMHHSA-N 1 2 317.392 4.065 20 0 DIADLO Cc1ccc([C@@H](c2noc(Cc3ccc(C)[nH+]c3)n2)C(C)C)cc1 ZINC000575217224 341786787 /nfs/dbraw/zinc/78/67/87/341786787.db2.gz AVRRVYLJOZPOAF-IBGZPJMESA-N 1 2 321.424 4.460 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1OC(F)F)c1cscn1 ZINC000576242409 341835848 /nfs/dbraw/zinc/83/58/48/341835848.db2.gz YKWVRBIZHHRPTE-IUCAKERBSA-N 1 2 316.348 4.295 20 0 DIADLO Cc1ccc(NC(=O)N[C@H](c2cccs2)C2CC2)c(C)[nH+]1 ZINC000576425832 341845767 /nfs/dbraw/zinc/84/57/67/341845767.db2.gz JNHOYHIMFBENMT-HNNXBMFYSA-N 1 2 301.415 4.033 20 0 DIADLO CC(C)[C@]1(CO)CCCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000576602211 341854763 /nfs/dbraw/zinc/85/47/63/341854763.db2.gz ZVMGLCDOALGHLU-GOSISDBHSA-N 1 2 318.848 4.123 20 0 DIADLO Cc1cc(N[C@@H](CO)c2ccccc2C)c2cccc(F)c2[nH+]1 ZINC000577006135 341875345 /nfs/dbraw/zinc/87/53/45/341875345.db2.gz VNQBDFBSSSYVHV-SFHVURJKSA-N 1 2 310.372 4.136 20 0 DIADLO CCc1oc2ccccc2c1C[NH2+]Cc1nnc(C2CC2)s1 ZINC000577078426 341884224 /nfs/dbraw/zinc/88/42/24/341884224.db2.gz RWJLKSBPYVPPCU-UHFFFAOYSA-N 1 2 313.426 4.014 20 0 DIADLO C[C@@H]1C[C@@H](Nc2nc3cc(Cl)cc(Cl)c3o2)c2[nH+]ccn21 ZINC000580619050 341887646 /nfs/dbraw/zinc/88/76/46/341887646.db2.gz HLKOCJMKTUVUON-RDDDGLTNSA-N 1 2 323.183 4.449 20 0 DIADLO CCCC(CCC)[NH2+][C@@H](c1noc(C)n1)c1ccccc1F ZINC000177341017 341918781 /nfs/dbraw/zinc/91/87/81/341918781.db2.gz ZDXAJAGXHFMJCO-MRXNPFEDSA-N 1 2 305.397 4.165 20 0 DIADLO C[C@H]([NH2+]Cc1cn2ccsc2n1)c1ccc(F)cc1Cl ZINC000177759213 341937637 /nfs/dbraw/zinc/93/76/37/341937637.db2.gz QMSRGKWBHBMBQF-VIFPVBQESA-N 1 2 309.797 4.039 20 0 DIADLO C[C@H]([NH2+]Cc1ccon1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000178262139 341950258 /nfs/dbraw/zinc/95/02/58/341950258.db2.gz KMWQWTNODNIANJ-ZDUSSCGKSA-N 1 2 312.344 4.457 20 0 DIADLO CC[C@H](c1ccccc1)N(CC)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000577989843 341964082 /nfs/dbraw/zinc/96/40/82/341964082.db2.gz WBCISKARBPZVNF-QGZVFWFLSA-N 1 2 322.412 4.339 20 0 DIADLO CC(C)OCCCC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000182680061 519758668 /nfs/dbraw/zinc/75/86/68/519758668.db2.gz YMKOUSNABDZNMB-UHFFFAOYSA-N 1 2 314.385 4.018 20 0 DIADLO CC(C)c1nc(C[NH2+]C2(c3cccc(Cl)c3)CCCC2)no1 ZINC000181462131 519863542 /nfs/dbraw/zinc/86/35/42/519863542.db2.gz JAOIFPSKAFBHQW-UHFFFAOYSA-N 1 2 319.836 4.406 20 0 DIADLO CC(C)c1nc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccnc2)cs1 ZINC000363812416 519863810 /nfs/dbraw/zinc/86/38/10/519863810.db2.gz DAFPQAVYVDJHHS-CZUORRHYSA-N 1 2 301.459 4.245 20 0 DIADLO CC(C)c1nc(C[N@H+]2C[C@H](C)C[C@@H]2c2cccnc2)cs1 ZINC000363812416 519863811 /nfs/dbraw/zinc/86/38/11/519863811.db2.gz DAFPQAVYVDJHHS-CZUORRHYSA-N 1 2 301.459 4.245 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@@H]2CN(C)Cc3ccccc32)cs1 ZINC000364248450 519867734 /nfs/dbraw/zinc/86/77/34/519867734.db2.gz GVHNWPXKPYANHY-XJKSGUPXSA-N 1 2 315.486 4.104 20 0 DIADLO CC(C)c1ncc(CNc2c[nH+]ccc2OC(C)(C)C)s1 ZINC000338329196 519874681 /nfs/dbraw/zinc/87/46/81/519874681.db2.gz KBAAGEGVOJYWSY-UHFFFAOYSA-N 1 2 305.447 4.451 20 0 DIADLO CC(C)c1nnc(C[NH2+]C2(c3ccc(F)cc3F)CCCC2)o1 ZINC000181250805 519887452 /nfs/dbraw/zinc/88/74/52/519887452.db2.gz DFKUHWSMVWTZPJ-UHFFFAOYSA-N 1 2 321.371 4.030 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)o1 ZINC000182590780 519887813 /nfs/dbraw/zinc/88/78/13/519887813.db2.gz GGBYNZYXCICUNS-MRXNPFEDSA-N 1 2 319.836 4.477 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)o1 ZINC000180017940 519888017 /nfs/dbraw/zinc/88/80/17/519888017.db2.gz DWTCTGBCWQADRY-HZUKXOBISA-N 1 2 319.836 4.333 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)n1 ZINC000181617999 519904949 /nfs/dbraw/zinc/90/49/49/519904949.db2.gz CYBBYFFHQSBSED-OAHLLOKOSA-N 1 2 323.387 4.348 20 0 DIADLO CC(C)n1cc[nH+]c1CN1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000338368497 520029723 /nfs/dbraw/zinc/02/97/23/520029723.db2.gz DIIDUZOXEJZIJB-KRWDZBQOSA-N 1 2 321.827 4.188 20 0 DIADLO CC(C)n1ccnc1C[NH2+][C@H](c1ccccc1)c1cccc(F)c1 ZINC000124775583 520030348 /nfs/dbraw/zinc/03/03/48/520030348.db2.gz YYGVOATXZHKQMY-HXUWFJFHSA-N 1 2 323.415 4.482 20 0 DIADLO CCN(C(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1)C1CC1 ZINC000265111905 520091330 /nfs/dbraw/zinc/09/13/30/520091330.db2.gz XLKROJXNBYWIEI-UHFFFAOYSA-N 1 2 316.788 4.152 20 0 DIADLO CCCCC[C@@H]([NH2+]Cc1nc([C@H](C)OC)no1)c1ccccc1 ZINC000181744818 520293931 /nfs/dbraw/zinc/29/39/31/520293931.db2.gz GAGPJKLBJGXRQA-GOEBONIOSA-N 1 2 317.433 4.188 20 0 DIADLO CCCCC[C@@H]([NH2+]Cc1nc([C@@H](C)OC)no1)c1ccccc1 ZINC000181744783 520294213 /nfs/dbraw/zinc/29/42/13/520294213.db2.gz GAGPJKLBJGXRQA-GDBMZVCRSA-N 1 2 317.433 4.188 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)[C@@H]2C[C@H]2c2ccccc2)cs1 ZINC000336854243 520475049 /nfs/dbraw/zinc/47/50/49/520475049.db2.gz DFWPNCRVOOWQJV-XOKHGSTOSA-N 1 2 316.470 4.229 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)[C@@H]2C[C@H]2c2ccccc2)cs1 ZINC000336854243 520475058 /nfs/dbraw/zinc/47/50/58/520475058.db2.gz DFWPNCRVOOWQJV-XOKHGSTOSA-N 1 2 316.470 4.229 20 0 DIADLO CCC[C@@H](C)CC(=O)NCc1ccc2c(c1)[nH+]c(C)n2C1CC1 ZINC000339294467 520624746 /nfs/dbraw/zinc/62/47/46/520624746.db2.gz VIDWTHFQZNDGOR-CYBMUJFWSA-N 1 2 313.445 4.122 20 0 DIADLO CC[N@H+](Cc1cc(C(=O)OC)c(C)o1)Cc1ccccc1Cl ZINC000338381779 521286766 /nfs/dbraw/zinc/28/67/66/521286766.db2.gz DENXWFSLTPCHOZ-UHFFFAOYSA-N 1 2 321.804 4.050 20 0 DIADLO CC[N@@H+](Cc1cc(C(=O)OC)c(C)o1)Cc1ccccc1Cl ZINC000338381779 521286777 /nfs/dbraw/zinc/28/67/77/521286777.db2.gz DENXWFSLTPCHOZ-UHFFFAOYSA-N 1 2 321.804 4.050 20 0 DIADLO CC[N@H+](Cc1csc(C2CC2)n1)[C@@H](C)c1cccc(O)c1 ZINC000161969087 521442736 /nfs/dbraw/zinc/44/27/36/521442736.db2.gz NLTSCQVXMHUQRS-LBPRGKRZSA-N 1 2 302.443 4.309 20 0 DIADLO CC[N@@H+](Cc1csc(C2CC2)n1)[C@@H](C)c1cccc(O)c1 ZINC000161969087 521442745 /nfs/dbraw/zinc/44/27/45/521442745.db2.gz NLTSCQVXMHUQRS-LBPRGKRZSA-N 1 2 302.443 4.309 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](c2cccc(C)c2)C(C)(C)C)no1 ZINC000180792154 521517972 /nfs/dbraw/zinc/51/79/72/521517972.db2.gz MXYNMTLRRWZEFT-KRWDZBQOSA-N 1 2 301.434 4.208 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)n1 ZINC000182564991 521585561 /nfs/dbraw/zinc/58/55/61/521585561.db2.gz SCPXUZJHGLVIJF-QGZVFWFLSA-N 1 2 319.836 4.307 20 0 DIADLO CCCn1nc(C)c(C[N@@H+]2CCC[C@@H]2c2csc(C)n2)c1C ZINC000189927485 521667956 /nfs/dbraw/zinc/66/79/56/521667956.db2.gz VKNBQKZGFTVJRM-QGZVFWFLSA-N 1 2 318.490 4.012 20 0 DIADLO CCCn1nc(C)c(C[N@H+]2CCC[C@@H]2c2csc(C)n2)c1C ZINC000189927485 521667959 /nfs/dbraw/zinc/66/79/59/521667959.db2.gz VKNBQKZGFTVJRM-QGZVFWFLSA-N 1 2 318.490 4.012 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+][C@@H](C)c2nnc(C)s2)cc1 ZINC000338290159 521750614 /nfs/dbraw/zinc/75/06/14/521750614.db2.gz WAPXMEPMEBMVQG-QWRGUYRKSA-N 1 2 307.488 4.370 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1csc(C(C)C)n1)c1ccc(C)o1 ZINC000186370595 522374725 /nfs/dbraw/zinc/37/47/25/522374725.db2.gz XSGUVXLAULDZKS-QWHCGFSZSA-N 1 2 308.447 4.206 20 0 DIADLO COC(=O)c1oc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2F)cc1C ZINC000181577163 522406237 /nfs/dbraw/zinc/40/62/37/522406237.db2.gz USAALIDTCDJGDL-WDEREUQCSA-N 1 2 323.339 4.065 20 0 DIADLO COC(=O)c1oc([C@@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)cc1C ZINC000181954098 522407761 /nfs/dbraw/zinc/40/77/61/522407761.db2.gz SCBRHBCRLGBWMM-WDEREUQCSA-N 1 2 323.339 4.065 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2cccc(NC(C)=O)c2)cs1 ZINC000162267294 522454043 /nfs/dbraw/zinc/45/40/43/522454043.db2.gz MBYJDSVSYPTJEI-RYUDHWBXSA-N 1 2 317.458 4.076 20 0 DIADLO CCc1[nH+]c2cc(CNC(=O)C3=CCCCC3)ccc2n1C1CC1 ZINC000338499402 522481832 /nfs/dbraw/zinc/48/18/32/522481832.db2.gz MOXLFLXPBDXKNX-UHFFFAOYSA-N 1 2 323.440 4.050 20 0 DIADLO CC[C@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1cc(F)ccc1F ZINC000156412136 522709216 /nfs/dbraw/zinc/70/92/16/522709216.db2.gz JWHDZDRHBOAVRF-HOTGVXAUSA-N 1 2 309.356 4.295 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](c2cccc(Cl)c2)C2CCCC2)o1 ZINC000181033615 522745870 /nfs/dbraw/zinc/74/58/70/522745870.db2.gz GHWHHVBQXBINMO-QGZVFWFLSA-N 1 2 319.836 4.307 20 0 DIADLO CC[C@@H]([NH2+][C@@H](c1nccn1C)c1cccc(F)c1)c1ccccc1 ZINC000128366388 522920934 /nfs/dbraw/zinc/92/09/34/522920934.db2.gz IWMVZTFSBIRIRC-RTBURBONSA-N 1 2 323.415 4.390 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1cccc(Cl)c1 ZINC000182587123 522940122 /nfs/dbraw/zinc/94/01/22/522940122.db2.gz PQVJDHIJCCBDKL-QMTHXVAHSA-N 1 2 305.809 4.402 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ncc(C(C)(C)C)o2)o1 ZINC000130830377 523023384 /nfs/dbraw/zinc/02/33/84/523023384.db2.gz CPTIIAUXQOXXRX-CQSZACIVSA-N 1 2 318.417 4.049 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2ncc(C(C)(C)C)o2)o1 ZINC000130830377 523023388 /nfs/dbraw/zinc/02/33/88/523023388.db2.gz CPTIIAUXQOXXRX-CQSZACIVSA-N 1 2 318.417 4.049 20 0 DIADLO COCc1cccc(CNc2c[nH+]ccc2OC(C)(C)C)c1 ZINC000338334557 523061085 /nfs/dbraw/zinc/06/10/85/523061085.db2.gz SCZQHHGNEICHRE-UHFFFAOYSA-N 1 2 300.402 4.017 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1ccccc1Cl ZINC000339154229 523552406 /nfs/dbraw/zinc/55/24/06/523552406.db2.gz UBWLJLPTDFPHNT-INIZCTEOSA-N 1 2 303.837 4.284 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1ccccc1Cl ZINC000339154229 523552417 /nfs/dbraw/zinc/55/24/17/523552417.db2.gz UBWLJLPTDFPHNT-INIZCTEOSA-N 1 2 303.837 4.284 20 0 DIADLO CCc1ccc([C@H]2CCC[N@@H+]2[C@H](C)c2nc(C(C)C)no2)o1 ZINC000265383655 524055151 /nfs/dbraw/zinc/05/51/51/524055151.db2.gz DFDRGMIFFSYENS-TZMCWYRMSA-N 1 2 303.406 4.247 20 0 DIADLO CCc1ccc([C@H]2CCC[N@H+]2[C@H](C)c2nc(C(C)C)no2)o1 ZINC000265383655 524055152 /nfs/dbraw/zinc/05/51/52/524055152.db2.gz DFDRGMIFFSYENS-TZMCWYRMSA-N 1 2 303.406 4.247 20 0 DIADLO CCc1cccc(C[NH2+][C@@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000189970046 524070354 /nfs/dbraw/zinc/07/03/54/524070354.db2.gz HATHEBYXOQHXOA-HNNXBMFYSA-N 1 2 321.424 4.074 20 0 DIADLO COc1ccc(CNc2c[nH+]ccc2OC(C)(C)C)cc1F ZINC000338316379 524103221 /nfs/dbraw/zinc/10/32/21/524103221.db2.gz UKMTZKGANSTIOZ-UHFFFAOYSA-N 1 2 304.365 4.019 20 0 DIADLO COc1cccc([C@H](C)[NH2+][C@@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000267017533 524156240 /nfs/dbraw/zinc/15/62/40/524156240.db2.gz IMALZZDJPCXDJM-STQMWFEESA-N 1 2 302.418 4.393 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+][C@H](C)c1nc2ccccc2o1 ZINC000182066709 524335026 /nfs/dbraw/zinc/33/50/26/524335026.db2.gz WBRYTOGAYATHIU-NWDGAFQWSA-N 1 2 314.360 4.387 20 0 DIADLO Cc1ccc(CN(C)C(=O)c2ccccc2Oc2cc[nH+]cc2)o1 ZINC000338131084 524383081 /nfs/dbraw/zinc/38/30/81/524383081.db2.gz FMJPKYGVLPWPEU-UHFFFAOYSA-N 1 2 322.364 4.048 20 0 DIADLO Cc1cccc(C[NH2+][C@H](C)c2nc(Cc3ccccc3)no2)c1C ZINC000191603842 524439193 /nfs/dbraw/zinc/43/91/93/524439193.db2.gz BXTWZAXEIBNGDH-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO C[C@@H](CCC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1)c1ccccc1 ZINC000158341838 524439719 /nfs/dbraw/zinc/43/97/19/524439719.db2.gz BQPSFAOSMFXSPZ-RDJZCZTQSA-N 1 2 311.429 4.047 20 0 DIADLO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2noc(-c3ccsc3)n2)c1 ZINC000182941411 524462107 /nfs/dbraw/zinc/46/21/07/524462107.db2.gz PZUIUGASQNEZGR-CYBMUJFWSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@H]1C[C@H]1[C@H]([NH2+]Cc1noc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000180029220 524965707 /nfs/dbraw/zinc/96/57/07/524965707.db2.gz OZUKFESVGBIESG-DRZCJDIDSA-N 1 2 317.820 4.087 20 0 DIADLO Cc1ccc(NC(=O)N(Cc2cccs2)C(C)C)c(C)[nH+]1 ZINC000268021816 525115596 /nfs/dbraw/zinc/11/55/96/525115596.db2.gz KJOLYKQHUHZAML-UHFFFAOYSA-N 1 2 303.431 4.202 20 0 DIADLO Cc1ccc(NC(=O)N2CCCC[C@H]2c2[nH]cc[nH+]2)cc1Cl ZINC000170709285 525123450 /nfs/dbraw/zinc/12/34/50/525123450.db2.gz IJDFWVBIXSJGEQ-AWEZNQCLSA-N 1 2 318.808 4.131 20 0 DIADLO Cc1ccc(NC(=O)NCC2CC(c3ccccc3)C2)c(C)[nH+]1 ZINC000338426645 525154679 /nfs/dbraw/zinc/15/46/79/525154679.db2.gz LERMHYAEQZXINF-UHFFFAOYSA-N 1 2 309.413 4.014 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)c(C)[nH+]1 ZINC000268031081 525201450 /nfs/dbraw/zinc/20/14/50/525201450.db2.gz XRSMWGISQCTQAV-VXGBXAGGSA-N 1 2 300.324 4.006 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2nc(C(C)C)cs2)c(OC)c1 ZINC000128668627 525326831 /nfs/dbraw/zinc/32/68/31/525326831.db2.gz SQCDEJQLKPXBGY-LBPRGKRZSA-N 1 2 320.458 4.135 20 0 DIADLO C[C@@H]1C[C@@H]1[C@H]([NH2+]Cc1noc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000180029173 525333248 /nfs/dbraw/zinc/33/32/48/525333248.db2.gz OZUKFESVGBIESG-FUEDEBDSSA-N 1 2 317.820 4.087 20 0 DIADLO C[C@@H]([NH2+]C1(c2ccccc2F)CC1)c1nc2ccccc2n1C ZINC000182234023 525395079 /nfs/dbraw/zinc/39/50/79/525395079.db2.gz BBQPBNHURFEMHN-CYBMUJFWSA-N 1 2 309.388 4.052 20 0 DIADLO Cc1ccccc1[C@H](C)[NH2+][C@H](c1nccn1C)c1cccc(F)c1 ZINC000128479263 525416614 /nfs/dbraw/zinc/41/66/14/525416614.db2.gz XJJAYBCIBGWXTA-KXBFYZLASA-N 1 2 323.415 4.308 20 0 DIADLO Cc1ccccc1[C@H]([NH2+]Cc1nc(C(C)C)no1)C(C)(C)C ZINC000180086009 525430024 /nfs/dbraw/zinc/43/00/24/525430024.db2.gz BRFQJYYUZDHCKP-INIZCTEOSA-N 1 2 301.434 4.378 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nc(-c3ccccc3)no2)c(C)s1 ZINC000182980378 525522707 /nfs/dbraw/zinc/52/27/07/525522707.db2.gz UQFLRTZPLGNPFK-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1cccnc1C[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000154657457 525524360 /nfs/dbraw/zinc/52/43/60/525524360.db2.gz OFFOCRMTZNMIRX-AWEZNQCLSA-N 1 2 309.438 4.364 20 0 DIADLO C[C@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1ccccc1Cl ZINC000267289540 525543737 /nfs/dbraw/zinc/54/37/37/525543737.db2.gz XICBRPOXVBRESM-BONVTDFDSA-N 1 2 311.759 4.002 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccncc1F)c1nc(C(F)(F)F)cs1 ZINC000338012528 525620400 /nfs/dbraw/zinc/62/04/00/525620400.db2.gz ROPLMEJSNNYYCA-JGVFFNPUSA-N 1 2 319.327 4.108 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2ccccc21)c1noc(-c2ccccc2)n1 ZINC000124303966 525633905 /nfs/dbraw/zinc/63/39/05/525633905.db2.gz VRECXTYUURBZLK-GUYCJALGSA-N 1 2 305.381 4.075 20 0 DIADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1ncc(-c2ccccc2)o1 ZINC000131659888 525721235 /nfs/dbraw/zinc/72/12/35/525721235.db2.gz GHCUISOSARZHNW-GFCCVEGCSA-N 1 2 306.369 4.182 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000124491155 525942466 /nfs/dbraw/zinc/94/24/66/525942466.db2.gz AEPZZPATXKTQAF-LSDHHAIUSA-N 1 2 307.397 4.457 20 0 DIADLO Cc1cnc(C(=O)Nc2c3ccccc3[nH+]c(C)c2C(C)C)cn1 ZINC000191318951 525975012 /nfs/dbraw/zinc/97/50/12/525975012.db2.gz OAGKRVYBEYINON-UHFFFAOYSA-N 1 2 320.396 4.017 20 0 DIADLO Cc1cnc(C[NH2+][C@H](CC(F)(F)F)c2ccc(F)cc2)s1 ZINC000180558136 526049239 /nfs/dbraw/zinc/04/92/39/526049239.db2.gz JDZCONROCAYYAM-GFCCVEGCSA-N 1 2 318.339 4.374 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000127839168 526122091 /nfs/dbraw/zinc/12/20/91/526122091.db2.gz NOWBOYBEVQXMQU-LBPRGKRZSA-N 1 2 316.355 4.019 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000127839168 526122097 /nfs/dbraw/zinc/12/20/97/526122097.db2.gz NOWBOYBEVQXMQU-LBPRGKRZSA-N 1 2 316.355 4.019 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1ccccc1Br ZINC000267085554 526124900 /nfs/dbraw/zinc/12/49/00/526124900.db2.gz SGNWCBKFINLNRX-GFCCVEGCSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccccc1Br ZINC000267085554 526124910 /nfs/dbraw/zinc/12/49/10/526124910.db2.gz SGNWCBKFINLNRX-GFCCVEGCSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000103227239 526147520 /nfs/dbraw/zinc/14/75/20/526147520.db2.gz FCDRBJGNYJHBBD-LLVKDONJSA-N 1 2 318.323 4.406 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000103227239 526147528 /nfs/dbraw/zinc/14/75/28/526147528.db2.gz FCDRBJGNYJHBBD-LLVKDONJSA-N 1 2 318.323 4.406 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1nc(-c2ccccc2F)no1 ZINC000188967425 526153317 /nfs/dbraw/zinc/15/33/17/526153317.db2.gz LCASZKLFRMFSHL-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1nc(-c2ccccc2F)no1 ZINC000188967425 526153325 /nfs/dbraw/zinc/15/33/25/526153325.db2.gz LCASZKLFRMFSHL-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)cc1 ZINC000338394375 526219674 /nfs/dbraw/zinc/21/96/74/526219674.db2.gz MXIXEBYKXDROIC-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO C[C@@H]1CC2(CCC2)CN1C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000338031442 526233817 /nfs/dbraw/zinc/23/38/17/526233817.db2.gz MEOJDYRHUGGFOW-OAHLLOKOSA-N 1 2 322.408 4.279 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccc(-c2ccccc2)nc1C ZINC000107289753 526241893 /nfs/dbraw/zinc/24/18/93/526241893.db2.gz FFKATHYIRRYYBZ-UHFFFAOYSA-N 1 2 303.365 4.013 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@@H+](Cc1cnc3ccccc3c1)CC2 ZINC000337145436 526306093 /nfs/dbraw/zinc/30/60/93/526306093.db2.gz DRDBJQOOEDSRAE-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@H+](Cc1cnc3ccccc3c1)CC2 ZINC000337145436 526306104 /nfs/dbraw/zinc/30/61/04/526306104.db2.gz DRDBJQOOEDSRAE-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cc(Cl)ccc3F)CCC2)n1 ZINC000269903044 526326617 /nfs/dbraw/zinc/32/66/17/526326617.db2.gz ZVUMFIBLAQXQGK-UHFFFAOYSA-N 1 2 310.825 4.413 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](c2cccc(Cl)c2)C2CCCC2)o1 ZINC000181043634 526344017 /nfs/dbraw/zinc/34/40/17/526344017.db2.gz SYAYQWWCFQNIOV-MRXNPFEDSA-N 1 2 305.809 4.053 20 0 DIADLO Cc1nnc(C[NH2+][C@H](CCC(C)C)c2ccc(Cl)cc2)o1 ZINC000180030839 526345362 /nfs/dbraw/zinc/34/53/62/526345362.db2.gz HHFSVHATQYSFCC-OAHLLOKOSA-N 1 2 307.825 4.299 20 0 DIADLO Fc1cccc(C[N@@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c1Cl ZINC000339202746 526385688 /nfs/dbraw/zinc/38/56/88/526385688.db2.gz QFHRARSGUNIXAY-GOEBONIOSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cccc(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c1Cl ZINC000339202746 526385690 /nfs/dbraw/zinc/38/56/90/526385690.db2.gz QFHRARSGUNIXAY-GOEBONIOSA-N 1 2 309.812 4.013 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CCc3c(cccc3C(C)C)C2)s1 ZINC000338359421 526396452 /nfs/dbraw/zinc/39/64/52/526396452.db2.gz MRXRBSMAEAAWHV-GFCCVEGCSA-N 1 2 301.459 4.089 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CCc3c(cccc3C(C)C)C2)s1 ZINC000338359421 526396458 /nfs/dbraw/zinc/39/64/58/526396458.db2.gz MRXRBSMAEAAWHV-GFCCVEGCSA-N 1 2 301.459 4.089 20 0 DIADLO O=C(CCC1CCCC1)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000267197615 526401271 /nfs/dbraw/zinc/40/12/71/526401271.db2.gz MKQQMWYDDNBYID-UHFFFAOYSA-N 1 2 315.392 4.052 20 0 DIADLO c1c[nH]c([C@H]([NH2+][C@H]2CCCc3sccc32)c2ccccc2)n1 ZINC000129723537 526409432 /nfs/dbraw/zinc/40/94/32/526409432.db2.gz LHRHBTRMLUWZDT-DOTOQJQBSA-N 1 2 309.438 4.228 20 0 DIADLO c1ccc([C@H](CC2CCCC2)[NH2+]Cc2noc(C3CC3)n2)cc1 ZINC000181939817 526496270 /nfs/dbraw/zinc/49/62/70/526496270.db2.gz AGMUIZSLLHXTKA-KRWDZBQOSA-N 1 2 311.429 4.358 20 0 DIADLO O=C(c1cccs1)C1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000363646421 526834869 /nfs/dbraw/zinc/83/48/69/526834869.db2.gz WSJABMHPMJERFS-UHFFFAOYSA-N 1 2 321.392 4.121 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ncc(-c3ccccc3)o2)sc1C ZINC000184858238 526891963 /nfs/dbraw/zinc/89/19/63/526891963.db2.gz CSYGQLAJYMQIOD-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO Clc1ccc(C[NH2+]Cc2ccsc2Br)o1 ZINC000336739411 526948475 /nfs/dbraw/zinc/94/84/75/526948475.db2.gz SMPPUINUACFEAC-UHFFFAOYSA-N 1 2 306.612 4.047 20 0 DIADLO Cc1[nH]c(C(=O)N[C@@H](C)c2ccccc2Oc2ccccc2)c[nH+]1 ZINC000339225311 527237853 /nfs/dbraw/zinc/23/78/53/527237853.db2.gz GYHNVAZYEYIAQT-ZDUSSCGKSA-N 1 2 321.380 4.001 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1cccc(C2CCC2)c1 ZINC000336949748 527320507 /nfs/dbraw/zinc/32/05/07/527320507.db2.gz SBQRUPAPHNCYBW-UHFFFAOYSA-N 1 2 317.392 4.392 20 0 DIADLO CC(C)n1ccnc1SCc1[nH+]ccn1Cc1ccccc1 ZINC000298318003 535096368 /nfs/dbraw/zinc/09/63/68/535096368.db2.gz RIDPSWWEDKGLGZ-UHFFFAOYSA-N 1 2 312.442 4.001 20 0 DIADLO CCSc1cccc(C[NH2+]Cc2nnc(C(C)(C)C)s2)c1 ZINC000274443577 535742874 /nfs/dbraw/zinc/74/28/74/535742874.db2.gz PEZYLBLYTZJYLB-UHFFFAOYSA-N 1 2 321.515 4.237 20 0 DIADLO CC[C@@H]([NH2+]Cc1csc([C@H](C)OC)n1)c1ccccc1F ZINC000272353613 535806453 /nfs/dbraw/zinc/80/64/53/535806453.db2.gz DMMYKLHRBKBNDX-XHDPSFHLSA-N 1 2 308.422 4.231 20 0 DIADLO Oc1ccc(Cl)c(C[NH2+]Cc2ccc(F)cc2Cl)c1 ZINC001203496518 1048913386 /nfs/dbraw/zinc/91/33/86/1048913386.db2.gz IAGFGDFWIJQAKG-UHFFFAOYSA-N 1 2 300.160 4.128 20 0 DIADLO CCC1CC[NH+](Cc2cnc(Cl)cc2Br)CC1 ZINC001232682751 1054097008 /nfs/dbraw/zinc/09/70/08/1054097008.db2.gz HWOAVPKRMZTXGX-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO Cc1cc(Br)sc1C[N@@H+]1CCC[C@](C)(F)C1 ZINC001236823497 1055274868 /nfs/dbraw/zinc/27/48/68/1055274868.db2.gz ARPWLIGKJILQBU-LBPRGKRZSA-N 1 2 306.244 4.143 20 0 DIADLO Cc1cc(Br)sc1C[N@H+]1CCC[C@](C)(F)C1 ZINC001236823497 1055274880 /nfs/dbraw/zinc/27/48/80/1055274880.db2.gz ARPWLIGKJILQBU-LBPRGKRZSA-N 1 2 306.244 4.143 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccccc2C(F)(F)F)no1 ZINC000044590535 1035510225 /nfs/dbraw/zinc/51/02/25/1035510225.db2.gz WBHQXSOKSIIHKX-HNNXBMFYSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccccc2C(F)(F)F)no1 ZINC000044590535 1035510228 /nfs/dbraw/zinc/51/02/28/1035510228.db2.gz WBHQXSOKSIIHKX-HNNXBMFYSA-N 1 2 310.319 4.339 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(-c3ccco3)on2)Cc2ccccc2O1 ZINC000579697793 1035516184 /nfs/dbraw/zinc/51/61/84/1035516184.db2.gz YCQZYMBAIQUMTA-UHFFFAOYSA-N 1 2 324.380 4.108 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(-c3ccco3)on2)Cc2ccccc2O1 ZINC000579697793 1035516192 /nfs/dbraw/zinc/51/61/92/1035516192.db2.gz YCQZYMBAIQUMTA-UHFFFAOYSA-N 1 2 324.380 4.108 20 0 DIADLO Cc1cc(NC(=O)[C@H](C)Sc2ccc(Cl)cc2)cc[nH+]1 ZINC000010165245 1035548696 /nfs/dbraw/zinc/54/86/96/1035548696.db2.gz XZRMXKNVBDWBPX-NSHDSACASA-N 1 2 306.818 4.163 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@@H]2c2ccncc2)cs1 ZINC000153895332 1035598006 /nfs/dbraw/zinc/59/80/06/1035598006.db2.gz VVKVUSFMLSFEGR-OAHLLOKOSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@@H]2c2ccncc2)cs1 ZINC000153895332 1035598015 /nfs/dbraw/zinc/59/80/15/1035598015.db2.gz VVKVUSFMLSFEGR-OAHLLOKOSA-N 1 2 301.459 4.173 20 0 DIADLO c1cn(-c2ccccc2-c2noc(C3(CC4CCC4)CC3)n2)c[nH+]1 ZINC001211490835 1035604847 /nfs/dbraw/zinc/60/48/47/1035604847.db2.gz SEWBJZQYVFOEBA-UHFFFAOYSA-N 1 2 320.396 4.144 20 0 DIADLO Cc1cnccc1C[N@H+]1C[C@H](c2ccccc2Cl)OC[C@@H]1C ZINC000579797027 1035622861 /nfs/dbraw/zinc/62/28/61/1035622861.db2.gz WTLJSIQUQZXVOE-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cnccc1C[N@@H+]1C[C@H](c2ccccc2Cl)OC[C@@H]1C ZINC000579797027 1035622865 /nfs/dbraw/zinc/62/28/65/1035622865.db2.gz WTLJSIQUQZXVOE-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc2[nH+]cc(CN(C)Cc3ccc(F)cc3Cl)n2c1 ZINC000538734577 1035657550 /nfs/dbraw/zinc/65/75/50/1035657550.db2.gz MWUFXUKADWIPFI-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC001167063071 1035690027 /nfs/dbraw/zinc/69/00/27/1035690027.db2.gz QOLNIIXKYDWVSG-ZDUSSCGKSA-N 1 2 309.837 4.036 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC001167063071 1035690033 /nfs/dbraw/zinc/69/00/33/1035690033.db2.gz QOLNIIXKYDWVSG-ZDUSSCGKSA-N 1 2 309.837 4.036 20 0 DIADLO Fc1ccc2c[nH+]c(NCc3ccc(-c4ncon4)cc3)cc2c1 ZINC001167066677 1035716883 /nfs/dbraw/zinc/71/68/83/1035716883.db2.gz WJSOGJCNCIGLJY-UHFFFAOYSA-N 1 2 320.327 4.036 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2nc3ccc(F)cc3s2)o1 ZINC000683200509 1035720469 /nfs/dbraw/zinc/72/04/69/1035720469.db2.gz APVUIOUCGVNXFB-GWCFXTLKSA-N 1 2 316.401 4.442 20 0 DIADLO S=c1oc(-c2cccs2)nn1C[N@@H+]1CCC[C@H]1C1CCC1 ZINC000728199948 1035726841 /nfs/dbraw/zinc/72/68/41/1035726841.db2.gz OKMMNJHFAZSHES-LBPRGKRZSA-N 1 2 321.471 4.156 20 0 DIADLO S=c1oc(-c2cccs2)nn1C[N@H+]1CCC[C@H]1C1CCC1 ZINC000728199948 1035726853 /nfs/dbraw/zinc/72/68/53/1035726853.db2.gz OKMMNJHFAZSHES-LBPRGKRZSA-N 1 2 321.471 4.156 20 0 DIADLO CC(C)CC[C@H]1CCCCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000579821362 1035735948 /nfs/dbraw/zinc/73/59/48/1035735948.db2.gz RGKBTOWXGLMJSC-MRXNPFEDSA-N 1 2 314.433 4.157 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)c(Cl)c1)[C@H](C)c1nnc(C)o1 ZINC000154428210 1035892225 /nfs/dbraw/zinc/89/22/25/1035892225.db2.gz DNWYYLZFMLJJSF-SECBINFHSA-N 1 2 314.216 4.268 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@H](C)c1nnc(C)o1 ZINC000154428210 1035892241 /nfs/dbraw/zinc/89/22/41/1035892241.db2.gz DNWYYLZFMLJJSF-SECBINFHSA-N 1 2 314.216 4.268 20 0 DIADLO Cc1ccnc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)n1 ZINC000339652167 1035899562 /nfs/dbraw/zinc/89/95/62/1035899562.db2.gz VPJOLIBBWCXBNS-UHFFFAOYSA-N 1 2 303.409 4.103 20 0 DIADLO Cc1ccnc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)n1 ZINC000339652167 1035899587 /nfs/dbraw/zinc/89/95/87/1035899587.db2.gz VPJOLIBBWCXBNS-UHFFFAOYSA-N 1 2 303.409 4.103 20 0 DIADLO CCCn1cc(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)cn1 ZINC000179733627 1035926821 /nfs/dbraw/zinc/92/68/21/1035926821.db2.gz ROLVXZQHBQLTPQ-CYBMUJFWSA-N 1 2 314.458 4.096 20 0 DIADLO CCCn1cc(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)cn1 ZINC000179733627 1035926830 /nfs/dbraw/zinc/92/68/30/1035926830.db2.gz ROLVXZQHBQLTPQ-CYBMUJFWSA-N 1 2 314.458 4.096 20 0 DIADLO c1ccc(C[N@@H+](Cc2noc(C3CCC3)n2)CC2CCC2)cc1 ZINC000625103716 1035927843 /nfs/dbraw/zinc/92/78/43/1035927843.db2.gz MOOGZHSOVAFBDA-UHFFFAOYSA-N 1 2 311.429 4.139 20 0 DIADLO c1ccc(C[N@H+](Cc2noc(C3CCC3)n2)CC2CCC2)cc1 ZINC000625103716 1035927853 /nfs/dbraw/zinc/92/78/53/1035927853.db2.gz MOOGZHSOVAFBDA-UHFFFAOYSA-N 1 2 311.429 4.139 20 0 DIADLO CCc1cccc(NC(=O)C[N@H+]([C@@H](C)c2ccco2)C2CC2)c1 ZINC000440907080 1035950941 /nfs/dbraw/zinc/95/09/41/1035950941.db2.gz VRJWAUHVMAMPJF-AWEZNQCLSA-N 1 2 312.413 4.006 20 0 DIADLO CCc1cccc(NC(=O)C[N@@H+]([C@@H](C)c2ccco2)C2CC2)c1 ZINC000440907080 1035950957 /nfs/dbraw/zinc/95/09/57/1035950957.db2.gz VRJWAUHVMAMPJF-AWEZNQCLSA-N 1 2 312.413 4.006 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[NH2+]Cc1nnc(C(C)C)s1 ZINC000339794856 1035965074 /nfs/dbraw/zinc/96/50/74/1035965074.db2.gz MDOGBUKKNLTCOL-UHFFFAOYSA-N 1 2 309.866 4.222 20 0 DIADLO c1csc(C[N@@H+](Cc2cnc(-c3ccccc3)[nH]2)C2CC2)c1 ZINC000180035336 1036028640 /nfs/dbraw/zinc/02/86/40/1036028640.db2.gz LJRQALHNDKOWLM-UHFFFAOYSA-N 1 2 309.438 4.303 20 0 DIADLO c1csc(C[N@H+](Cc2cnc(-c3ccccc3)[nH]2)C2CC2)c1 ZINC000180035336 1036028661 /nfs/dbraw/zinc/02/86/61/1036028661.db2.gz LJRQALHNDKOWLM-UHFFFAOYSA-N 1 2 309.438 4.303 20 0 DIADLO Cc1ncc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000339923463 1036058545 /nfs/dbraw/zinc/05/85/45/1036058545.db2.gz WUNMYHMKNHGADW-LBPRGKRZSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1ncc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000339923463 1036058564 /nfs/dbraw/zinc/05/85/64/1036058564.db2.gz WUNMYHMKNHGADW-LBPRGKRZSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1ncc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000339923462 1036059063 /nfs/dbraw/zinc/05/90/63/1036059063.db2.gz WUNMYHMKNHGADW-GFCCVEGCSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1ncc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000339923462 1036059079 /nfs/dbraw/zinc/05/90/79/1036059079.db2.gz WUNMYHMKNHGADW-GFCCVEGCSA-N 1 2 301.821 4.164 20 0 DIADLO CCSc1cc[nH+]c(N(C)[C@H](C)c2ccccc2OC)c1 ZINC001167106894 1036090430 /nfs/dbraw/zinc/09/04/30/1036090430.db2.gz LGIWREHVUJAUOG-CYBMUJFWSA-N 1 2 302.443 4.400 20 0 DIADLO CCc1nc(C[NH2+]Cc2c(Cl)oc3ccccc32)cs1 ZINC000328218750 1036099155 /nfs/dbraw/zinc/09/91/55/1036099155.db2.gz KVBYOXOTNFQELR-UHFFFAOYSA-N 1 2 306.818 4.395 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]Cc2coc(-c3cccs3)n2)cn1 ZINC000155049530 1036105750 /nfs/dbraw/zinc/10/57/50/1036105750.db2.gz IEZQGWZBTUAGNW-LBPRGKRZSA-N 1 2 316.430 4.031 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C#N)ccc1F)c1nc2ccccc2s1 ZINC000090117901 1036185305 /nfs/dbraw/zinc/18/53/05/1036185305.db2.gz PUYWAHCPDGBBAH-LLVKDONJSA-N 1 2 311.385 4.158 20 0 DIADLO Cc1csc(C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)n1 ZINC000037988469 1036198727 /nfs/dbraw/zinc/19/87/27/1036198727.db2.gz NEHNKUYHRIDDSI-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO C[N@H+](Cc1nc2c(s1)CCC2)Cc1ccc(F)c(Cl)c1 ZINC000683360878 1036216302 /nfs/dbraw/zinc/21/63/02/1036216302.db2.gz JNRPEGFGTUSTQP-UHFFFAOYSA-N 1 2 310.825 4.056 20 0 DIADLO C[N@@H+](Cc1nc2c(s1)CCC2)Cc1ccc(F)c(Cl)c1 ZINC000683360878 1036216315 /nfs/dbraw/zinc/21/63/15/1036216315.db2.gz JNRPEGFGTUSTQP-UHFFFAOYSA-N 1 2 310.825 4.056 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2ccc(Cl)c3cccnc23)cs1 ZINC000065300980 1036232397 /nfs/dbraw/zinc/23/23/97/1036232397.db2.gz UYVUJIGRQNFFQU-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2ccc(Cl)c3cccnc23)cs1 ZINC000065300980 1036232410 /nfs/dbraw/zinc/23/24/10/1036232410.db2.gz UYVUJIGRQNFFQU-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO COc1c(F)ccc(Nc2cccn3cc(C)[nH+]c23)c1Cl ZINC001209802066 1036257318 /nfs/dbraw/zinc/25/73/18/1036257318.db2.gz YBSKVVZCBOTJAY-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO C[N@@H+](Cc1c(Cl)cccc1Cl)C[C@H]1CC(C)(C)CO1 ZINC001167199455 1036263159 /nfs/dbraw/zinc/26/31/59/1036263159.db2.gz NMGAWHBQYNESRO-LLVKDONJSA-N 1 2 302.245 4.240 20 0 DIADLO C[N@H+](Cc1c(Cl)cccc1Cl)C[C@H]1CC(C)(C)CO1 ZINC001167199455 1036263170 /nfs/dbraw/zinc/26/31/70/1036263170.db2.gz NMGAWHBQYNESRO-LLVKDONJSA-N 1 2 302.245 4.240 20 0 DIADLO FC[C@H]1[C@@H]2CN(c3cc(SCc4ccccc4)cc[nH+]3)C[C@H]12 ZINC001167225823 1036290143 /nfs/dbraw/zinc/29/01/43/1036290143.db2.gz YWANWTNCKNHFPX-OSYLJGHBSA-N 1 2 314.429 4.026 20 0 DIADLO Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@@H](C)c1csnn1 ZINC000398265305 1036300924 /nfs/dbraw/zinc/30/09/24/1036300924.db2.gz CATFKTDAJJAQCB-IUCAKERBSA-N 1 2 310.492 4.012 20 0 DIADLO Cc1cc(NC(=O)CCC(=O)c2csc3ccccc23)cc[nH+]1 ZINC000087355240 1036306345 /nfs/dbraw/zinc/30/63/45/1036306345.db2.gz GRVKMQDUZAHIIJ-UHFFFAOYSA-N 1 2 324.405 4.206 20 0 DIADLO C[N@H+](Cc1ccn(-c2ccccc2)n1)Cc1ccccc1C1CC1 ZINC001167270805 1036352199 /nfs/dbraw/zinc/35/21/99/1036352199.db2.gz OSGNEHCCXSQINS-UHFFFAOYSA-N 1 2 317.436 4.382 20 0 DIADLO C[N@@H+](Cc1ccn(-c2ccccc2)n1)Cc1ccccc1C1CC1 ZINC001167270805 1036352220 /nfs/dbraw/zinc/35/22/20/1036352220.db2.gz OSGNEHCCXSQINS-UHFFFAOYSA-N 1 2 317.436 4.382 20 0 DIADLO CCCCOc1ncccc1C[NH2+][C@@H](C)c1cccc(F)c1F ZINC000538446061 1036371652 /nfs/dbraw/zinc/37/16/52/1036371652.db2.gz CITYYBOOACOSSQ-ZDUSSCGKSA-N 1 2 320.383 4.390 20 0 DIADLO Cc1ccc(C[NH2+]Cc2c(F)c(F)cc(F)c2F)cc1Cl ZINC000683470173 1036423095 /nfs/dbraw/zinc/42/30/95/1036423095.db2.gz GWQJKJFGTZHFKH-UHFFFAOYSA-N 1 2 317.713 4.495 20 0 DIADLO COCC[C@@H]([NH2+]Cc1nc2cc(C)ccc2s1)c1ccco1 ZINC000625318669 1036502869 /nfs/dbraw/zinc/50/28/69/1036502869.db2.gz JBNOTLDZTGZIGU-CYBMUJFWSA-N 1 2 316.426 4.065 20 0 DIADLO C[C@H]([NH2+]Cc1ccc2[nH]ccc2c1)c1nc(C2CCCCC2)no1 ZINC000655742870 1036514045 /nfs/dbraw/zinc/51/40/45/1036514045.db2.gz NBQLPIAEGSRLAY-ZDUSSCGKSA-N 1 2 324.428 4.449 20 0 DIADLO Cc1nc2scc(C3CC3)n2c1CNc1cc2cc[nH]c2c[nH+]1 ZINC000655806049 1036553907 /nfs/dbraw/zinc/55/39/07/1036553907.db2.gz YADRSMXUTPPROE-UHFFFAOYSA-N 1 2 323.425 4.070 20 0 DIADLO COc1cccc(-c2cccc(Nc3c[nH+]c(C)c(N)c3)c2)c1 ZINC001210287759 1036589789 /nfs/dbraw/zinc/58/97/89/1036589789.db2.gz DHFCHJCJLLAGEE-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@H](c2ccccc2)C(C)C)n1 ZINC000063483233 1036637966 /nfs/dbraw/zinc/63/79/66/1036637966.db2.gz JJCICMNAFVJNEG-SFHVURJKSA-N 1 2 301.434 4.145 20 0 DIADLO Cc1cc(CNc2ccc3c(c2)OCCCO3)c2c([nH+]1)CCCC2 ZINC001648859086 1036656069 /nfs/dbraw/zinc/65/60/69/1036656069.db2.gz BJLZOWHWRBOKQR-UHFFFAOYSA-N 1 2 324.424 4.042 20 0 DIADLO Fc1ccc(CNc2ccc(N3CCCCC3)c[nH+]2)c(Cl)c1 ZINC001648873728 1036665605 /nfs/dbraw/zinc/66/56/05/1036665605.db2.gz ARQZIDKMQNCNHT-UHFFFAOYSA-N 1 2 319.811 4.477 20 0 DIADLO FCC(CF)[NH2+]Cc1csc2c1cccc2Br ZINC000579978952 1036673412 /nfs/dbraw/zinc/67/34/12/1036673412.db2.gz KVCLSKXKTKUGQL-UHFFFAOYSA-N 1 2 320.202 4.061 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(CSC(F)F)o1)c1nccs1 ZINC000078004332 1036709952 /nfs/dbraw/zinc/70/99/52/1036709952.db2.gz DMMNZCLXWUETPS-NSHDSACASA-N 1 2 318.414 4.433 20 0 DIADLO CCCCn1c(SCC2=CCCC2)nnc1[C@H](CC)[NH+](C)C ZINC000647114095 1036844883 /nfs/dbraw/zinc/84/48/83/1036844883.db2.gz JKNPNEOZYFYHIW-HNNXBMFYSA-N 1 2 322.522 4.293 20 0 DIADLO CC(C)CCc1noc(C[N@H+](Cc2ccco2)C2CCCC2)n1 ZINC000064508516 1036845897 /nfs/dbraw/zinc/84/58/97/1036845897.db2.gz XMHMRSPYNRQPIP-UHFFFAOYSA-N 1 2 317.433 4.196 20 0 DIADLO CC(C)CCc1noc(C[N@@H+](Cc2ccco2)C2CCCC2)n1 ZINC000064508516 1036845923 /nfs/dbraw/zinc/84/59/23/1036845923.db2.gz XMHMRSPYNRQPIP-UHFFFAOYSA-N 1 2 317.433 4.196 20 0 DIADLO C[C@@H]1C[N@H+](CCCCC(F)(F)F)C[C@H](c2ccsc2)O1 ZINC000155579979 1036861133 /nfs/dbraw/zinc/86/11/33/1036861133.db2.gz LQMIQVOJEXBCJU-DGCLKSJQSA-N 1 2 307.381 4.243 20 0 DIADLO C[C@@H]1C[N@@H+](CCCCC(F)(F)F)C[C@H](c2ccsc2)O1 ZINC000155579979 1036861154 /nfs/dbraw/zinc/86/11/54/1036861154.db2.gz LQMIQVOJEXBCJU-DGCLKSJQSA-N 1 2 307.381 4.243 20 0 DIADLO Brc1ccc(C[N@@H+]2CCc3ccccc3C2)s1 ZINC000043677581 1036876393 /nfs/dbraw/zinc/87/63/93/1036876393.db2.gz CJTXTPXLCNLPBD-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1ccc(C[N@H+]2CCc3ccccc3C2)s1 ZINC000043677581 1036876413 /nfs/dbraw/zinc/87/64/13/1036876413.db2.gz CJTXTPXLCNLPBD-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Fc1cc(F)c(F)c(C[NH2+]Cc2ccc3cnccc3c2)c1F ZINC000683772143 1036888173 /nfs/dbraw/zinc/88/81/73/1036888173.db2.gz NZFOVGMQHSDQII-UHFFFAOYSA-N 1 2 320.289 4.081 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)s1 ZINC000683822086 1036970798 /nfs/dbraw/zinc/97/07/98/1036970798.db2.gz KRIRYJNFASSVAJ-RNFRBKRXSA-N 1 2 321.393 4.339 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@H+](Cc1scnc1C1CC1)CC3 ZINC000683826912 1036981484 /nfs/dbraw/zinc/98/14/84/1036981484.db2.gz YAGUCTBYEUIXMF-UHFFFAOYSA-N 1 2 323.465 4.369 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](Cc1scnc1C1CC1)CC3 ZINC000683826912 1036981497 /nfs/dbraw/zinc/98/14/97/1036981497.db2.gz YAGUCTBYEUIXMF-UHFFFAOYSA-N 1 2 323.465 4.369 20 0 DIADLO Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]Cc1cn[nH]c1C ZINC000124718874 1037025289 /nfs/dbraw/zinc/02/52/89/1037025289.db2.gz PLPOMRFNYWLSAX-KRWDZBQOSA-N 1 2 311.454 4.162 20 0 DIADLO Cc1cn2cccc(Nc3cc(Cl)c(O)c(Cl)c3)c2[nH+]1 ZINC001210924882 1037055268 /nfs/dbraw/zinc/05/52/68/1037055268.db2.gz VSHWBOLGQTZUIP-UHFFFAOYSA-N 1 2 308.168 4.399 20 0 DIADLO Cc1c(Cl)cccc1-n1ccn(C[N@@H+](C)C2CC2)c1=S ZINC000049227383 1037064690 /nfs/dbraw/zinc/06/46/90/1037064690.db2.gz NQXLPCPYZZWTTE-UHFFFAOYSA-N 1 2 307.850 4.022 20 0 DIADLO Cc1c(Cl)cccc1-n1ccn(C[N@H+](C)C2CC2)c1=S ZINC000049227383 1037064710 /nfs/dbraw/zinc/06/47/10/1037064710.db2.gz NQXLPCPYZZWTTE-UHFFFAOYSA-N 1 2 307.850 4.022 20 0 DIADLO Cc1nc(C)c(C[N@H+](Cc2ccco2)Cc2cccs2)o1 ZINC000683897224 1037075561 /nfs/dbraw/zinc/07/55/61/1037075561.db2.gz TWZRPKHLBDXALE-UHFFFAOYSA-N 1 2 302.399 4.148 20 0 DIADLO Cc1nc(C)c(C[N@@H+](Cc2ccco2)Cc2cccs2)o1 ZINC000683897224 1037075580 /nfs/dbraw/zinc/07/55/80/1037075580.db2.gz TWZRPKHLBDXALE-UHFFFAOYSA-N 1 2 302.399 4.148 20 0 DIADLO COc1cccc2c(NC[C@@H](C)c3c(C)noc3C)cc[nH+]c12 ZINC000275870695 1037080784 /nfs/dbraw/zinc/08/07/84/1037080784.db2.gz VJFYOLJCEHUKSC-LLVKDONJSA-N 1 2 311.385 4.064 20 0 DIADLO CC(=O)Nc1nc(-c2cccc(Nc3ccc(C)c[nH+]3)c2)cs1 ZINC001211012260 1037091146 /nfs/dbraw/zinc/09/11/46/1037091146.db2.gz DFDUOSFXZKINSA-UHFFFAOYSA-N 1 2 324.409 4.216 20 0 DIADLO C[C@H](CC(=O)NC(C)(C)CC1CCCCCC1)n1cc[nH+]c1 ZINC000580556997 1037200802 /nfs/dbraw/zinc/20/08/02/1037200802.db2.gz CDUDHLRPHKKHSZ-OAHLLOKOSA-N 1 2 305.466 4.090 20 0 DIADLO Cc1nc(C2([NH2+]C/C=C\c3ccc(Cl)cc3)CCCC2)no1 ZINC000255623551 1037215645 /nfs/dbraw/zinc/21/56/45/1037215645.db2.gz ZYDNSGGBCUWNSF-PLNGDYQASA-N 1 2 317.820 4.104 20 0 DIADLO Cc1ccc2c(Nc3cnccc3Br)cccc2[nH+]1 ZINC001211235168 1037221312 /nfs/dbraw/zinc/22/13/12/1037221312.db2.gz HTXSSIRJDHVAIA-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO c1ccc2c(c1)cccc2OCCC[N@@H+]1Cc2cccnc2C1 ZINC000580642358 1037236832 /nfs/dbraw/zinc/23/68/32/1037236832.db2.gz YVDANECJYFYVLH-UHFFFAOYSA-N 1 2 304.393 4.020 20 0 DIADLO c1ccc2c(c1)cccc2OCCC[N@H+]1Cc2cccnc2C1 ZINC000580642358 1037236842 /nfs/dbraw/zinc/23/68/42/1037236842.db2.gz YVDANECJYFYVLH-UHFFFAOYSA-N 1 2 304.393 4.020 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)Sc2ccc(F)cc2)c(C)[nH+]1 ZINC001125473788 1037301887 /nfs/dbraw/zinc/30/18/87/1037301887.db2.gz MPWXLHQSOGYBLV-ZDUSSCGKSA-N 1 2 318.417 4.265 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)cs1)c1csnn1 ZINC000398265611 1037316302 /nfs/dbraw/zinc/31/63/02/1037316302.db2.gz GRFCQKJSWXITBZ-LLVKDONJSA-N 1 2 301.440 4.117 20 0 DIADLO CCc1nc(CN(C)c2[nH+]ccc3cc(F)ccc32)cs1 ZINC000580831039 1037324280 /nfs/dbraw/zinc/32/42/80/1037324280.db2.gz YDQHNYALYVFNNI-UHFFFAOYSA-N 1 2 301.390 4.029 20 0 DIADLO CC/C=C(/C)C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000255270996 1037446134 /nfs/dbraw/zinc/44/61/34/1037446134.db2.gz VBLXTVPPBBNEFX-NSIKDUERSA-N 1 2 309.413 4.181 20 0 DIADLO CCCC[N@H+](Cc1cc(COC)on1)[C@@H](C)c1ccc(C)o1 ZINC000656417103 1037451542 /nfs/dbraw/zinc/45/15/42/1037451542.db2.gz WNPHYBLOYHKZLT-AWEZNQCLSA-N 1 2 306.406 4.086 20 0 DIADLO CCCC[N@@H+](Cc1cc(COC)on1)[C@@H](C)c1ccc(C)o1 ZINC000656417103 1037451548 /nfs/dbraw/zinc/45/15/48/1037451548.db2.gz WNPHYBLOYHKZLT-AWEZNQCLSA-N 1 2 306.406 4.086 20 0 DIADLO CN(C)C[C@H]([NH2+]Cc1ccc(Cl)cc1F)c1ccc(F)cc1 ZINC000581155333 1037456586 /nfs/dbraw/zinc/45/65/86/1037456586.db2.gz XGQLOHAKFNGFHC-KRWDZBQOSA-N 1 2 324.802 4.011 20 0 DIADLO COc1cccc2c(N[C@H](C)c3cnn(C(C)C)c3)cc[nH+]c12 ZINC000581170092 1037460016 /nfs/dbraw/zinc/46/00/16/1037460016.db2.gz IUFPBQBLFYVGIN-CYBMUJFWSA-N 1 2 310.401 4.194 20 0 DIADLO c1cn(-c2cccc(OCc3cc(-c4ccccc4)on3)c2)c[nH+]1 ZINC000156929585 1037487716 /nfs/dbraw/zinc/48/77/16/1037487716.db2.gz YODQTTHWSXGPCQ-UHFFFAOYSA-N 1 2 317.348 4.106 20 0 DIADLO C[N@H+](Cc1coc(-c2cccs2)n1)Cc1ccc(F)cc1 ZINC000066562468 1037490669 /nfs/dbraw/zinc/49/06/69/1037490669.db2.gz QMROHSQBOVTLKO-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1coc(-c2cccs2)n1)Cc1ccc(F)cc1 ZINC000066562468 1037490679 /nfs/dbraw/zinc/49/06/79/1037490679.db2.gz QMROHSQBOVTLKO-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO CCCc1ccc([C@H]([NH2+]Cc2ncc[nH]2)c2cccs2)cc1 ZINC000067667152 1037518772 /nfs/dbraw/zinc/51/87/72/1037518772.db2.gz WCPKNFJFWQOHRX-SFHVURJKSA-N 1 2 311.454 4.303 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000565968916 1037582855 /nfs/dbraw/zinc/58/28/55/1037582855.db2.gz RYJDOPAOFFLMTC-CZUORRHYSA-N 1 2 314.454 4.158 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000565968916 1037582869 /nfs/dbraw/zinc/58/28/69/1037582869.db2.gz RYJDOPAOFFLMTC-CZUORRHYSA-N 1 2 314.454 4.158 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1CCO[C@@H](c2ccccc2)C1 ZINC000581426362 1037637313 /nfs/dbraw/zinc/63/73/13/1037637313.db2.gz POIPUSSNLIOJDS-LJQANCHMSA-N 1 2 304.393 4.121 20 0 DIADLO Cc1cc2c(s1)N(c1ccc(F)cn1)c1ccccc1NC2=[NH2+] ZINC001167463585 1037643593 /nfs/dbraw/zinc/64/35/93/1037643593.db2.gz WLTASLPKXSSPJP-UHFFFAOYSA-N 1 2 324.384 4.411 20 0 DIADLO Cc1c[nH+]c(CN[C@H](C)c2cc(F)c(Cl)cc2Cl)n1C ZINC000341058935 1037659870 /nfs/dbraw/zinc/65/98/70/1037659870.db2.gz WJVLAHBMVSCAEC-SECBINFHSA-N 1 2 316.207 4.025 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1csc(-c2ccoc2)n1 ZINC000341065596 1037662962 /nfs/dbraw/zinc/66/29/62/1037662962.db2.gz ISRJGPFMOWHHBH-GFCCVEGCSA-N 1 2 314.410 4.263 20 0 DIADLO CC(C)([NH2+]Cc1nnc(-c2ccco2)o1)c1ccc(Cl)cc1 ZINC000072603348 1037691631 /nfs/dbraw/zinc/69/16/31/1037691631.db2.gz CQWPFUDUDJFNOO-UHFFFAOYSA-N 1 2 317.776 4.008 20 0 DIADLO Cc1ccccc1[C@@H](C)CC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000341184374 1037717010 /nfs/dbraw/zinc/71/70/10/1037717010.db2.gz XCENJVDMDIQSMV-INIZCTEOSA-N 1 2 319.408 4.313 20 0 DIADLO CCCc1noc(C[NH2+][C@H](C)c2ccc(F)c3ccccc32)n1 ZINC000581571362 1037743418 /nfs/dbraw/zinc/74/34/18/1037743418.db2.gz JSHLZPOUNKGBAL-GFCCVEGCSA-N 1 2 313.376 4.165 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(Cc2ccccc2C)o1)c1ccccc1 ZINC000341208855 1037744787 /nfs/dbraw/zinc/74/47/87/1037744787.db2.gz FOESJPNEFLSKHZ-GOSISDBHSA-N 1 2 321.424 4.210 20 0 DIADLO CSc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(C)n1 ZINC001215909358 1037749896 /nfs/dbraw/zinc/74/98/96/1037749896.db2.gz QORBGFOHZWHOQV-UHFFFAOYSA-N 1 2 310.426 4.100 20 0 DIADLO CCO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2cccc(OC)c2)cs1 ZINC000341218734 1037758069 /nfs/dbraw/zinc/75/80/69/1037758069.db2.gz KYKPQKODBZTXOE-STQMWFEESA-N 1 2 320.458 4.100 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1cccc(F)c1 ZINC000090229053 1037761337 /nfs/dbraw/zinc/76/13/37/1037761337.db2.gz WEANAHIWMXLBCI-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)o1 ZINC000341220648 1037762901 /nfs/dbraw/zinc/76/29/01/1037762901.db2.gz NXZSUPMWZVHWGB-UWVGGRQHSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc(SC4CC4)cc3)cc2[nH+]1 ZINC000341251618 1037806941 /nfs/dbraw/zinc/80/69/41/1037806941.db2.gz VJZCZNIMODKYDP-UHFFFAOYSA-N 1 2 323.421 4.378 20 0 DIADLO Cc1c[nH+]c(CNc2ccccc2SC2CCCC2)n1C ZINC000341267744 1037826748 /nfs/dbraw/zinc/82/67/48/1037826748.db2.gz YNZVWBOCJYTDTC-UHFFFAOYSA-N 1 2 301.459 4.375 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@@H](C)c3ccccc3C)cc2[nH+]1 ZINC000341282198 1037845979 /nfs/dbraw/zinc/84/59/79/1037845979.db2.gz PETSHERBKCYCNE-CYBMUJFWSA-N 1 2 307.397 4.312 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2csc(C(F)(F)F)c2)s1 ZINC000926163344 1037881259 /nfs/dbraw/zinc/88/12/59/1037881259.db2.gz HCCFSDWHPRBGIJ-RNFRBKRXSA-N 1 2 321.393 4.339 20 0 DIADLO C[C@]1([NH2+]Cc2c(Cl)cncc2Cl)CCOc2ccccc21 ZINC000933371776 1037910012 /nfs/dbraw/zinc/91/00/12/1037910012.db2.gz VMRSWZGHGCYINE-INIZCTEOSA-N 1 2 323.223 4.176 20 0 DIADLO C[C@H](Nc1cc[nH+]c(OCc2ccccc2)c1)c1ccc(F)cn1 ZINC001167479259 1037927050 /nfs/dbraw/zinc/92/70/50/1037927050.db2.gz JZZKICPIZUGZNF-AWEZNQCLSA-N 1 2 323.371 4.368 20 0 DIADLO CCc1noc(C[NH2+][C@H](c2ccc(C(C)(C)C)cc2)C(C)C)n1 ZINC000078645403 1037934253 /nfs/dbraw/zinc/93/42/53/1037934253.db2.gz AZHMCUCUZLTAPQ-SFHVURJKSA-N 1 2 315.461 4.416 20 0 DIADLO Cc1ccc(OCc2nc(C[NH+]3CC(C(C)C)C3)cs2)cc1 ZINC000684408331 1037952879 /nfs/dbraw/zinc/95/28/79/1037952879.db2.gz IFGZDHWFZVVDLR-UHFFFAOYSA-N 1 2 316.470 4.118 20 0 DIADLO Oc1cccnc1C[NH2+]Cc1c(Cl)ccc(Cl)c1Cl ZINC000684415955 1037968265 /nfs/dbraw/zinc/96/82/65/1037968265.db2.gz QREKGBBPFUCDOH-UHFFFAOYSA-N 1 2 317.603 4.037 20 0 DIADLO Cn1cc(C[N@H+](Cc2ccco2)Cc2ccccc2)c(C2CC2)n1 ZINC000891487665 1037985600 /nfs/dbraw/zinc/98/56/00/1037985600.db2.gz MULJGQPQJVWHIG-UHFFFAOYSA-N 1 2 321.424 4.093 20 0 DIADLO Cn1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2)c(C2CC2)n1 ZINC000891487665 1037985607 /nfs/dbraw/zinc/98/56/07/1037985607.db2.gz MULJGQPQJVWHIG-UHFFFAOYSA-N 1 2 321.424 4.093 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)cnc1F ZINC000891516348 1038004997 /nfs/dbraw/zinc/00/49/97/1038004997.db2.gz MZAPGYVGOBDHMD-LBPRGKRZSA-N 1 2 315.417 4.332 20 0 DIADLO Cc1cc(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)cnc1F ZINC000891516348 1038005012 /nfs/dbraw/zinc/00/50/12/1038005012.db2.gz MZAPGYVGOBDHMD-LBPRGKRZSA-N 1 2 315.417 4.332 20 0 DIADLO COc1cccc(/C=[NH+]/CCCSc2ccccc2)c1O ZINC000060804345 1038028868 /nfs/dbraw/zinc/02/88/68/1038028868.db2.gz JDSZZSCZJIIFED-QGOAFFKASA-N 1 2 301.411 4.002 20 0 DIADLO CC[N@H+](Cc1c(Cl)n(C)nc1C(F)F)Cc1ccccc1 ZINC001232050799 1038037833 /nfs/dbraw/zinc/03/78/33/1038037833.db2.gz FZLIIMDVZJUVFP-UHFFFAOYSA-N 1 2 313.779 4.033 20 0 DIADLO CC[N@@H+](Cc1c(Cl)n(C)nc1C(F)F)Cc1ccccc1 ZINC001232050799 1038037850 /nfs/dbraw/zinc/03/78/50/1038037850.db2.gz FZLIIMDVZJUVFP-UHFFFAOYSA-N 1 2 313.779 4.033 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000602572524 1038042399 /nfs/dbraw/zinc/04/23/99/1038042399.db2.gz ORJBNMSTRYMSGF-MNOVXSKESA-N 1 2 323.305 4.069 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000602572524 1038042419 /nfs/dbraw/zinc/04/24/19/1038042419.db2.gz ORJBNMSTRYMSGF-MNOVXSKESA-N 1 2 323.305 4.069 20 0 DIADLO Cc1cc(N2CCC[C@H]2Cc2cccc(F)c2)nc(C2CC2)[nH+]1 ZINC000341478816 1038055037 /nfs/dbraw/zinc/05/50/37/1038055037.db2.gz GXUKFVUNFILDDH-KRWDZBQOSA-N 1 2 311.404 4.013 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](C)Cc1nccn1C1CC1 ZINC000891604956 1038070544 /nfs/dbraw/zinc/07/05/44/1038070544.db2.gz UQHXUFMMTSNQKM-LBPRGKRZSA-N 1 2 323.362 4.430 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)Cc1nccn1C1CC1 ZINC000891604956 1038070562 /nfs/dbraw/zinc/07/05/62/1038070562.db2.gz UQHXUFMMTSNQKM-LBPRGKRZSA-N 1 2 323.362 4.430 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](C)Cc1nccn1C1CC1 ZINC000891604955 1038070794 /nfs/dbraw/zinc/07/07/94/1038070794.db2.gz UQHXUFMMTSNQKM-GFCCVEGCSA-N 1 2 323.362 4.430 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)Cc1nccn1C1CC1 ZINC000891604955 1038070809 /nfs/dbraw/zinc/07/08/09/1038070809.db2.gz UQHXUFMMTSNQKM-GFCCVEGCSA-N 1 2 323.362 4.430 20 0 DIADLO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)Cc1nccn1C1CC1 ZINC000891647281 1038099746 /nfs/dbraw/zinc/09/97/46/1038099746.db2.gz DUFYKQOFZMFCGG-LBPRGKRZSA-N 1 2 323.362 4.430 20 0 DIADLO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)Cc1nccn1C1CC1 ZINC000891647281 1038099767 /nfs/dbraw/zinc/09/97/67/1038099767.db2.gz DUFYKQOFZMFCGG-LBPRGKRZSA-N 1 2 323.362 4.430 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1nc2cccnc2s1 ZINC000341607940 1038174476 /nfs/dbraw/zinc/17/44/76/1038174476.db2.gz RDCPTDSFDVOGRM-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1nc2cccnc2s1 ZINC000341607940 1038174482 /nfs/dbraw/zinc/17/44/82/1038174482.db2.gz RDCPTDSFDVOGRM-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)CCc1ccccc1F ZINC000684509130 1038195946 /nfs/dbraw/zinc/19/59/46/1038195946.db2.gz MNQNCNVLXKSHHK-UHFFFAOYSA-N 1 2 323.371 4.096 20 0 DIADLO CCOc1ccc([C@H]([NH2+]CC(F)F)C(C)C)cc1OCC ZINC000603408210 1038202286 /nfs/dbraw/zinc/20/22/86/1038202286.db2.gz PRNGEIIHPXCKJW-MRXNPFEDSA-N 1 2 301.377 4.036 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(C(=O)OC(C)(C)C)s1)c1cscn1 ZINC000598983543 1038207627 /nfs/dbraw/zinc/20/76/27/1038207627.db2.gz OVHSINYAJUXSLP-SNVBAGLBSA-N 1 2 324.471 4.011 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000603469753 1038214796 /nfs/dbraw/zinc/21/47/96/1038214796.db2.gz HYJFLXAVZRYSPM-QZTJIDSGSA-N 1 2 317.477 4.043 20 0 DIADLO Clc1ccc([C@H]2C[N@@H+](C3CCCC3)CCO2)cc1Cl ZINC000535655720 1038221217 /nfs/dbraw/zinc/22/12/17/1038221217.db2.gz UXVBAJLDQIAQRV-OAHLLOKOSA-N 1 2 300.229 4.309 20 0 DIADLO Clc1ccc([C@H]2C[N@H+](C3CCCC3)CCO2)cc1Cl ZINC000535655720 1038221231 /nfs/dbraw/zinc/22/12/31/1038221231.db2.gz UXVBAJLDQIAQRV-OAHLLOKOSA-N 1 2 300.229 4.309 20 0 DIADLO COc1cccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)c1F ZINC000669684937 1038232486 /nfs/dbraw/zinc/23/24/86/1038232486.db2.gz OTZTYXOUYDNJMP-UHFFFAOYSA-N 1 2 315.722 4.056 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001143412116 1038252558 /nfs/dbraw/zinc/25/25/58/1038252558.db2.gz HWQMCQZJUUBHOV-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001143412116 1038252566 /nfs/dbraw/zinc/25/25/66/1038252566.db2.gz HWQMCQZJUUBHOV-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+](C)C/C=C/c1ccccc1 ZINC001143413048 1038258485 /nfs/dbraw/zinc/25/84/85/1038258485.db2.gz LNRRGVLFPVOGBG-RMKNXTFCSA-N 1 2 303.352 4.119 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+](C)C/C=C/c1ccccc1 ZINC001143413048 1038258495 /nfs/dbraw/zinc/25/84/95/1038258495.db2.gz LNRRGVLFPVOGBG-RMKNXTFCSA-N 1 2 303.352 4.119 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2c(F)c(F)ccc2OC)cc1 ZINC001143414131 1038273287 /nfs/dbraw/zinc/27/32/87/1038273287.db2.gz YYLOJPVGWBVUNX-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2c(F)c(F)ccc2OC)cc1 ZINC001143414131 1038273299 /nfs/dbraw/zinc/27/32/99/1038273299.db2.gz YYLOJPVGWBVUNX-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1c(C)c[nH+]c(CN2CCCSc3ccccc32)c1C ZINC000599382604 1038277081 /nfs/dbraw/zinc/27/70/81/1038277081.db2.gz PIOVEYVDGOJKFI-UHFFFAOYSA-N 1 2 314.454 4.209 20 0 DIADLO CC(C)CCOc1ccc(C(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC000603785393 1038281391 /nfs/dbraw/zinc/28/13/91/1038281391.db2.gz MQUUMPJTVHMGKS-UHFFFAOYSA-N 1 2 323.396 4.012 20 0 DIADLO CCn1ccnc1C[N@H+](Cc1ccccc1)Cc1ccccc1C ZINC000341844292 1038293909 /nfs/dbraw/zinc/29/39/09/1038293909.db2.gz UZJKDOIJXYSLSW-UHFFFAOYSA-N 1 2 319.452 4.414 20 0 DIADLO CCn1ccnc1C[N@@H+](Cc1ccccc1)Cc1ccccc1C ZINC000341844292 1038293914 /nfs/dbraw/zinc/29/39/14/1038293914.db2.gz UZJKDOIJXYSLSW-UHFFFAOYSA-N 1 2 319.452 4.414 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000133514863 1038302366 /nfs/dbraw/zinc/30/23/66/1038302366.db2.gz XDYNYXVERBMKPQ-GFCCVEGCSA-N 1 2 304.459 4.300 20 0 DIADLO CC(C)c1ccc(CNc2cc(N3CCCCC3)nc[nH+]2)cc1 ZINC000599553963 1038312669 /nfs/dbraw/zinc/31/26/69/1038312669.db2.gz KUUJTNGAEFLMMP-UHFFFAOYSA-N 1 2 310.445 4.202 20 0 DIADLO CC(C)c1ccc(CNc2cc(N3CCCCC3)[nH+]cn2)cc1 ZINC000599553963 1038312688 /nfs/dbraw/zinc/31/26/88/1038312688.db2.gz KUUJTNGAEFLMMP-UHFFFAOYSA-N 1 2 310.445 4.202 20 0 DIADLO COc1cccc(C[N@H+](Cc2ccccc2F)C2CC2)c1F ZINC000669707094 1038343608 /nfs/dbraw/zinc/34/36/08/1038343608.db2.gz BDBVYLDTANIEFC-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO COc1cccc(C[N@@H+](Cc2ccccc2F)C2CC2)c1F ZINC000669707094 1038343622 /nfs/dbraw/zinc/34/36/22/1038343622.db2.gz BDBVYLDTANIEFC-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO COc1ccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)c(C)c1 ZINC000171147917 1038343977 /nfs/dbraw/zinc/34/39/77/1038343977.db2.gz OANMZRPZNGJQKS-OAHLLOKOSA-N 1 2 307.397 4.362 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2cc(C)ccc2OC)[nH]1 ZINC000277075735 1038364751 /nfs/dbraw/zinc/36/47/51/1038364751.db2.gz FIMDODTXRUGDOY-MELADBBJSA-N 1 2 316.449 4.047 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+]C1CC(F)(c2cccc(Cl)c2)C1 ZINC000684613322 1038384862 /nfs/dbraw/zinc/38/48/62/1038384862.db2.gz OKCKLOLXPATREX-MYYNNNGASA-N 1 2 307.800 4.050 20 0 DIADLO FC(F)(F)Oc1ccccc1C[NH2+]Cc1nc2ccccc2o1 ZINC000684614613 1038387943 /nfs/dbraw/zinc/38/79/43/1038387943.db2.gz WARBGYQYFKKPSI-UHFFFAOYSA-N 1 2 322.286 4.016 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)n1 ZINC000097120367 1038412229 /nfs/dbraw/zinc/41/22/29/1038412229.db2.gz JNTCGABUXKSFTC-NEPJUHHUSA-N 1 2 307.825 4.477 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)n1 ZINC000657199461 1038432726 /nfs/dbraw/zinc/43/27/26/1038432726.db2.gz ZKYRCAMGNNCSDZ-PBHICJAKSA-N 1 2 311.429 4.446 20 0 DIADLO Cc1noc([C@@H](C)[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)n1 ZINC000657199461 1038432731 /nfs/dbraw/zinc/43/27/31/1038432731.db2.gz ZKYRCAMGNNCSDZ-PBHICJAKSA-N 1 2 311.429 4.446 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1ccc(F)cc1)c1ccco1 ZINC000151135114 1038433013 /nfs/dbraw/zinc/43/30/13/1038433013.db2.gz FGFDYUOKKKNHOV-LJQANCHMSA-N 1 2 311.356 4.307 20 0 DIADLO CCC(CC)c1cc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)on1 ZINC000151349622 1038437134 /nfs/dbraw/zinc/43/71/34/1038437134.db2.gz IRERUKYRKCQIGB-UHFFFAOYSA-N 1 2 324.384 4.016 20 0 DIADLO CCc1csc(C[N@H+](C)Cc2ccccc2C(F)(F)F)n1 ZINC001232473719 1038443471 /nfs/dbraw/zinc/44/34/71/1038443471.db2.gz BYXXMGTXOCMAJA-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO CCc1csc(C[N@@H+](C)Cc2ccccc2C(F)(F)F)n1 ZINC001232473719 1038443478 /nfs/dbraw/zinc/44/34/78/1038443478.db2.gz BYXXMGTXOCMAJA-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(F)c(F)c2)[nH]1 ZINC000277207862 1038453006 /nfs/dbraw/zinc/45/30/06/1038453006.db2.gz KAXGSDSDYFSBNF-DCAQKATOSA-N 1 2 308.376 4.008 20 0 DIADLO CC(C)COC[C@@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccco1 ZINC000101597118 1038470496 /nfs/dbraw/zinc/47/04/96/1038470496.db2.gz VPTVFOLBMBRXQL-MRXNPFEDSA-N 1 2 309.356 4.061 20 0 DIADLO CCc1nc(C)c([C@H](C)[NH2+][C@@H](C)c2nnc([C@H](C)CC)[nH]2)s1 ZINC000277266034 1038474148 /nfs/dbraw/zinc/47/41/48/1038474148.db2.gz PHGZDONTPHHCQP-SCVCMEIPSA-N 1 2 321.494 4.057 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000342223173 1038486159 /nfs/dbraw/zinc/48/61/59/1038486159.db2.gz FTAFYFGQDXSPAY-HUUCEWRRSA-N 1 2 307.397 4.457 20 0 DIADLO FC1CC[NH+](Cc2ccc(Cl)cc2OC(F)(F)F)CC1 ZINC001143428948 1038500619 /nfs/dbraw/zinc/50/06/19/1038500619.db2.gz PMRBSXKFJNXGHW-UHFFFAOYSA-N 1 2 311.706 4.173 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2cc(F)cc(F)c2)[nH]1 ZINC000277311756 1038500770 /nfs/dbraw/zinc/50/07/70/1038500770.db2.gz SOSQEOLEBOGIKC-AXFHLTTASA-N 1 2 308.376 4.008 20 0 DIADLO Cc1ccc(CN(C(=O)Nc2c(C)cc(C)[nH+]c2C)C2CC2)o1 ZINC000653177587 1038503949 /nfs/dbraw/zinc/50/39/49/1038503949.db2.gz YKWYOBGYOZRDAH-UHFFFAOYSA-N 1 2 313.401 4.105 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2csc(Cc3ccccc3)n2)[C@@H]1C ZINC000605317128 1038509944 /nfs/dbraw/zinc/50/99/44/1038509944.db2.gz TUXVBEOLYMLKRE-ZIAGYGMSSA-N 1 2 318.511 4.060 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2csc(Cc3ccccc3)n2)[C@@H]1C ZINC000605317128 1038509950 /nfs/dbraw/zinc/50/99/50/1038509950.db2.gz TUXVBEOLYMLKRE-ZIAGYGMSSA-N 1 2 318.511 4.060 20 0 DIADLO C[C@@H](Nc1cc(NCC2CC2)[nH+]cn1)c1cc2ccccc2o1 ZINC000605432963 1038516541 /nfs/dbraw/zinc/51/65/41/1038516541.db2.gz SDPDMFHCRLYTSJ-GFCCVEGCSA-N 1 2 308.385 4.218 20 0 DIADLO C[C@@H](Nc1cc(NCC2CC2)nc[nH+]1)c1cc2ccccc2o1 ZINC000605432963 1038516546 /nfs/dbraw/zinc/51/65/46/1038516546.db2.gz SDPDMFHCRLYTSJ-GFCCVEGCSA-N 1 2 308.385 4.218 20 0 DIADLO Clc1cc(C[N@@H+]2CCSC[C@H]2c2ccccc2)ccn1 ZINC000172010795 1038523952 /nfs/dbraw/zinc/52/39/52/1038523952.db2.gz BFGUEKSHLJMTOR-HNNXBMFYSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cc(C[N@H+]2CCSC[C@H]2c2ccccc2)ccn1 ZINC000172010795 1038523955 /nfs/dbraw/zinc/52/39/55/1038523955.db2.gz BFGUEKSHLJMTOR-HNNXBMFYSA-N 1 2 304.846 4.025 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC[C@H](C)C[C@H]1c1ccc(CC)o1 ZINC001167509770 1038524176 /nfs/dbraw/zinc/52/41/76/1038524176.db2.gz PVIDDMXOAHARIQ-ZOBUZTSGSA-N 1 2 321.461 4.347 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CC[C@H](C)C[C@H]1c1ccc(CC)o1 ZINC001167509770 1038524179 /nfs/dbraw/zinc/52/41/79/1038524179.db2.gz PVIDDMXOAHARIQ-ZOBUZTSGSA-N 1 2 321.461 4.347 20 0 DIADLO Cc1cc(C)c(NC(=O)CCc2cc(Cl)cs2)c(C)[nH+]1 ZINC000605616747 1038542248 /nfs/dbraw/zinc/54/22/48/1038542248.db2.gz JBAYYQGQPISAJQ-UHFFFAOYSA-N 1 2 308.834 4.293 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2ccc3ccccc3n2)[nH]1 ZINC000277402851 1038542475 /nfs/dbraw/zinc/54/24/75/1038542475.db2.gz YZTSJVFKXPEDFP-IHRRRGAJSA-N 1 2 323.444 4.278 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1)[N@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000605732442 1038548823 /nfs/dbraw/zinc/54/88/23/1038548823.db2.gz FKCGKFIKZGVGTH-GFCCVEGCSA-N 1 2 321.852 4.084 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000605732442 1038548832 /nfs/dbraw/zinc/54/88/32/1038548832.db2.gz FKCGKFIKZGVGTH-GFCCVEGCSA-N 1 2 321.852 4.084 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+](C)[C@H](C)c2ccccn2)s1 ZINC000183634891 1038554967 /nfs/dbraw/zinc/55/49/67/1038554967.db2.gz MBQHYISXNJIDCK-SECBINFHSA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+](C)[C@H](C)c2ccccn2)s1 ZINC000183634891 1038554971 /nfs/dbraw/zinc/55/49/71/1038554971.db2.gz MBQHYISXNJIDCK-SECBINFHSA-N 1 2 315.364 4.058 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3o2)o1 ZINC000892162304 1038562031 /nfs/dbraw/zinc/56/20/31/1038562031.db2.gz XFDPWRKSRXXGQY-HNNXBMFYSA-N 1 2 312.369 4.157 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3o2)o1 ZINC000892162304 1038562042 /nfs/dbraw/zinc/56/20/42/1038562042.db2.gz XFDPWRKSRXXGQY-HNNXBMFYSA-N 1 2 312.369 4.157 20 0 DIADLO CC[C@H](CC(=O)Nc1ccc2[nH+]ccn2c1)c1ccc(C)cc1 ZINC000606198494 1038584838 /nfs/dbraw/zinc/58/48/38/1038584838.db2.gz GPGAQCLTNCJYLV-OAHLLOKOSA-N 1 2 307.397 4.165 20 0 DIADLO C[C@@H]1c2c(F)cccc2CC[N@H+]1Cc1cnn(-c2ccccc2)c1 ZINC000606450834 1038603344 /nfs/dbraw/zinc/60/33/44/1038603344.db2.gz SXTHHBVEQHQKTJ-OAHLLOKOSA-N 1 2 321.399 4.131 20 0 DIADLO C[C@@H]1c2c(F)cccc2CC[N@@H+]1Cc1cnn(-c2ccccc2)c1 ZINC000606450834 1038603350 /nfs/dbraw/zinc/60/33/50/1038603350.db2.gz SXTHHBVEQHQKTJ-OAHLLOKOSA-N 1 2 321.399 4.131 20 0 DIADLO CCCc1nc(C[N@@H+]2CCC[C@H](C)[C@@H]2c2ccc(C)cc2)no1 ZINC000606452251 1038605036 /nfs/dbraw/zinc/60/50/36/1038605036.db2.gz QBYGSSRPBRVIJE-HNAYVOBHSA-N 1 2 313.445 4.304 20 0 DIADLO CCCc1nc(C[N@H+]2CCC[C@H](C)[C@@H]2c2ccc(C)cc2)no1 ZINC000606452251 1038605039 /nfs/dbraw/zinc/60/50/39/1038605039.db2.gz QBYGSSRPBRVIJE-HNAYVOBHSA-N 1 2 313.445 4.304 20 0 DIADLO CCCc1nc(C[N@@H+]2CCC[C@@H](C)[C@H]2c2ccc(C)cc2)no1 ZINC000606452249 1038605074 /nfs/dbraw/zinc/60/50/74/1038605074.db2.gz QBYGSSRPBRVIJE-BEFAXECRSA-N 1 2 313.445 4.304 20 0 DIADLO CCCc1nc(C[N@H+]2CCC[C@@H](C)[C@H]2c2ccc(C)cc2)no1 ZINC000606452249 1038605077 /nfs/dbraw/zinc/60/50/77/1038605077.db2.gz QBYGSSRPBRVIJE-BEFAXECRSA-N 1 2 313.445 4.304 20 0 DIADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccc(OC(F)(F)F)c(Cl)c1 ZINC001140556208 1038613478 /nfs/dbraw/zinc/61/34/78/1038613478.db2.gz OSBYFMTVGPMPJD-PSASIEDQSA-N 1 2 311.706 4.171 20 0 DIADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccc(OC(F)(F)F)c(Cl)c1 ZINC001140556208 1038613479 /nfs/dbraw/zinc/61/34/79/1038613479.db2.gz OSBYFMTVGPMPJD-PSASIEDQSA-N 1 2 311.706 4.171 20 0 DIADLO c1ccc([C@@H]2CCCC[N@H+]2Cc2nc(C3CCCC3)no2)cc1 ZINC000582213901 1038614493 /nfs/dbraw/zinc/61/44/93/1038614493.db2.gz JISCSGSZZVHHFO-KRWDZBQOSA-N 1 2 311.429 4.454 20 0 DIADLO c1ccc([C@@H]2CCCC[N@@H+]2Cc2nc(C3CCCC3)no2)cc1 ZINC000582213901 1038614495 /nfs/dbraw/zinc/61/44/95/1038614495.db2.gz JISCSGSZZVHHFO-KRWDZBQOSA-N 1 2 311.429 4.454 20 0 DIADLO Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606584371 1038616238 /nfs/dbraw/zinc/61/62/38/1038616238.db2.gz QXGFQEMQZZXVDZ-KRWDZBQOSA-N 1 2 320.396 4.012 20 0 DIADLO CC[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1nccs1 ZINC000657371133 1038617465 /nfs/dbraw/zinc/61/74/65/1038617465.db2.gz NZOGJUMNGGSIPV-ZDUSSCGKSA-N 1 2 306.406 4.064 20 0 DIADLO COc1cncc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)c1 ZINC000582264414 1038620926 /nfs/dbraw/zinc/62/09/26/1038620926.db2.gz JUPDNQOOUOYUQM-ZDUSSCGKSA-N 1 2 316.832 4.469 20 0 DIADLO COc1cncc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)c1 ZINC000582264414 1038620929 /nfs/dbraw/zinc/62/09/29/1038620929.db2.gz JUPDNQOOUOYUQM-ZDUSSCGKSA-N 1 2 316.832 4.469 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2ccc(F)c(F)c2F)C2CC2)n1 ZINC000657380594 1038622549 /nfs/dbraw/zinc/62/25/49/1038622549.db2.gz KYTADSURDKRCIN-CQSZACIVSA-N 1 2 312.360 4.110 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@H](c3cccs3)C2)s1 ZINC000582273123 1038624730 /nfs/dbraw/zinc/62/47/30/1038624730.db2.gz ZVDBDYBNRPKPGG-LBPRGKRZSA-N 1 2 311.497 4.105 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@H](c3cccs3)C2)s1 ZINC000582273123 1038624736 /nfs/dbraw/zinc/62/47/36/1038624736.db2.gz ZVDBDYBNRPKPGG-LBPRGKRZSA-N 1 2 311.497 4.105 20 0 DIADLO Cc1ccc(C[NH2+]Cc2nccn2C(C)C)c(OC(C)(C)C)c1 ZINC000657389959 1038632121 /nfs/dbraw/zinc/63/21/21/1038632121.db2.gz PSMORZPXYJMMCW-UHFFFAOYSA-N 1 2 315.461 4.240 20 0 DIADLO C[C@H](c1ccc2ccccc2c1)[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000606904638 1038639408 /nfs/dbraw/zinc/63/94/08/1038639408.db2.gz OBYCQMDHVAVYRC-WBMJQRKESA-N 1 2 309.331 4.164 20 0 DIADLO C[C@H](c1ccc2ccccc2c1)[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000606904638 1038639412 /nfs/dbraw/zinc/63/94/12/1038639412.db2.gz OBYCQMDHVAVYRC-WBMJQRKESA-N 1 2 309.331 4.164 20 0 DIADLO FC(F)(F)Oc1ccc(CNc2cc3cc[nH]c3c[nH+]2)cc1 ZINC000684839577 1038647184 /nfs/dbraw/zinc/64/71/84/1038647184.db2.gz ZQGULBDEGINCBD-UHFFFAOYSA-N 1 2 307.275 4.074 20 0 DIADLO Cc1cn2cc(NC(=O)[C@H](CC(C)C)c3ccccc3)ccc2[nH+]1 ZINC000607062005 1038655231 /nfs/dbraw/zinc/65/52/31/1038655231.db2.gz MABOUFCMMNXVEM-GOSISDBHSA-N 1 2 321.424 4.411 20 0 DIADLO CC1(C)CC[C@H](c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)C1 ZINC001211545144 1038668149 /nfs/dbraw/zinc/66/81/49/1038668149.db2.gz NUJNRKIUWOIWTK-AWEZNQCLSA-N 1 2 308.385 4.216 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2cccc(C(F)(F)F)c2)c(C)[nH+]1 ZINC000097039960 1038684315 /nfs/dbraw/zinc/68/43/15/1038684315.db2.gz LJDAFYCFBLRSNS-UHFFFAOYSA-N 1 2 322.330 4.207 20 0 DIADLO CCCC[C@@H](C)[NH2+][C@@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000133076943 1038726343 /nfs/dbraw/zinc/72/63/43/1038726343.db2.gz LZALKVKWZRNXDF-IAQYHMDHSA-N 1 2 307.825 4.289 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2nc(C3CC3)cs2)c1 ZINC000342701379 1038727065 /nfs/dbraw/zinc/72/70/65/1038727065.db2.gz YIGYDGJQNKULLQ-INIZCTEOSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2nc(C3CC3)cs2)c1 ZINC000342701379 1038727071 /nfs/dbraw/zinc/72/70/71/1038727071.db2.gz YIGYDGJQNKULLQ-INIZCTEOSA-N 1 2 302.418 4.497 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)c2cccc(Cl)c2)c(C)[nH+]1 ZINC000607779238 1038734288 /nfs/dbraw/zinc/73/42/88/1038734288.db2.gz YTKMLBDSRDQHDR-LBPRGKRZSA-N 1 2 302.805 4.402 20 0 DIADLO COCOc1ccccc1Nc1cc[nH+]c2ccc(Cl)cc12 ZINC001211552146 1038734566 /nfs/dbraw/zinc/73/45/66/1038734566.db2.gz GVOIFUVCEDBJTK-UHFFFAOYSA-N 1 2 314.772 4.036 20 0 DIADLO Cc1cc(C)cc(OCCC(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000097214161 1038736671 /nfs/dbraw/zinc/73/66/71/1038736671.db2.gz WKNYHEZZNVHDBP-UHFFFAOYSA-N 1 2 312.413 4.031 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H]3CCCc4cccnc43)co2)cc1 ZINC000684957020 1038740203 /nfs/dbraw/zinc/74/02/03/1038740203.db2.gz FWGIBBIPDIEWKK-GOSISDBHSA-N 1 2 319.408 4.212 20 0 DIADLO c1ccc([C@H]([NH2+][C@H]2CCCc3cccnc32)c2ccccn2)cc1 ZINC000684954299 1038740641 /nfs/dbraw/zinc/74/06/41/1038740641.db2.gz YIAYMITVEOXURN-FPOVZHCZSA-N 1 2 315.420 4.233 20 0 DIADLO Cc1[nH]c(CNc2cccc(COC3CCCCC3)c2)[nH+]c1C ZINC000563439039 1038762559 /nfs/dbraw/zinc/76/25/59/1038762559.db2.gz IENZFCGKCCYJME-UHFFFAOYSA-N 1 2 313.445 4.488 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc(C2CC2)cs1 ZINC000342766877 1038764246 /nfs/dbraw/zinc/76/42/46/1038764246.db2.gz YMOVQVRPPUCARO-SNVBAGLBSA-N 1 2 308.397 4.492 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc(C2CC2)cs1 ZINC000342766877 1038764254 /nfs/dbraw/zinc/76/42/54/1038764254.db2.gz YMOVQVRPPUCARO-SNVBAGLBSA-N 1 2 308.397 4.492 20 0 DIADLO Cc1nc(NC(Cc2ccccc2)Cc2ccccc2)cc[nH+]1 ZINC000608081103 1038765665 /nfs/dbraw/zinc/76/56/65/1038765665.db2.gz ADYBTFFZZIPFFM-UHFFFAOYSA-N 1 2 303.409 4.051 20 0 DIADLO Cc1c[nH+]c(CN(C)[C@H](c2ccccc2Cl)C(C)C)n1C ZINC000342772520 1038768106 /nfs/dbraw/zinc/76/81/06/1038768106.db2.gz AYXSBBCKYVOIKJ-KRWDZBQOSA-N 1 2 305.853 4.211 20 0 DIADLO Cc1c[nH+]c(CN(C)[C@@H](c2ccccc2Cl)C(C)C)n1C ZINC000342772522 1038768307 /nfs/dbraw/zinc/76/83/07/1038768307.db2.gz AYXSBBCKYVOIKJ-QGZVFWFLSA-N 1 2 305.853 4.211 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ncc(-c3ccccc3C)o2)on1 ZINC000075640532 1038807715 /nfs/dbraw/zinc/80/77/15/1038807715.db2.gz NCBRFJCNALCHPY-INIZCTEOSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ncc(-c3ccccc3C)o2)on1 ZINC000075640532 1038807738 /nfs/dbraw/zinc/80/77/38/1038807738.db2.gz NCBRFJCNALCHPY-INIZCTEOSA-N 1 2 323.396 4.284 20 0 DIADLO S=c1sc(C2CC2)nn1C[NH2+]C1(c2ccccc2)CCC1 ZINC000173889256 1038808662 /nfs/dbraw/zinc/80/86/62/1038808662.db2.gz HFLFUGGVHZQSRR-UHFFFAOYSA-N 1 2 317.483 4.178 20 0 DIADLO Cc1noc(C[N@@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC000075955990 1038817491 /nfs/dbraw/zinc/81/74/91/1038817491.db2.gz ICSGZVGVWLPIDI-CQSZACIVSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1noc(C[N@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC000075955990 1038817516 /nfs/dbraw/zinc/81/75/16/1038817516.db2.gz ICSGZVGVWLPIDI-CQSZACIVSA-N 1 2 307.397 4.238 20 0 DIADLO COCc1nc(C[N@@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000075900325 1038819638 /nfs/dbraw/zinc/81/96/38/1038819638.db2.gz SMPRXOKJBHPWIJ-MLGOLLRUSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000075900325 1038819660 /nfs/dbraw/zinc/81/96/60/1038819660.db2.gz SMPRXOKJBHPWIJ-MLGOLLRUSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccc(F)c2)cs1 ZINC000075842845 1038826620 /nfs/dbraw/zinc/82/66/20/1038826620.db2.gz GZSZPTDPMOBKMY-BLLLJJGKSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccc(F)c2)cs1 ZINC000075842845 1038826646 /nfs/dbraw/zinc/82/66/46/1038826646.db2.gz GZSZPTDPMOBKMY-BLLLJJGKSA-N 1 2 320.433 4.012 20 0 DIADLO COc1cc([C@H](C)Nc2cccc[nH+]2)ccc1OCC(C)C ZINC000076683315 1038846283 /nfs/dbraw/zinc/84/62/83/1038846283.db2.gz QDTQRTQXVWHCFO-AWEZNQCLSA-N 1 2 300.402 4.298 20 0 DIADLO CCCOc1c(C[NH2+][C@H](C)c2cscn2)cccc1OCC ZINC000657599599 1038901240 /nfs/dbraw/zinc/90/12/40/1038901240.db2.gz NQKSTHSMOGJGOT-CYBMUJFWSA-N 1 2 320.458 4.181 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(O)cccc3C2)cc(C(F)(F)F)c1 ZINC001143447377 1038917146 /nfs/dbraw/zinc/91/71/46/1038917146.db2.gz CWYPTOZQNVTEMH-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(O)cccc3C2)cc(C(F)(F)F)c1 ZINC001143447377 1038917152 /nfs/dbraw/zinc/91/71/52/1038917152.db2.gz CWYPTOZQNVTEMH-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO Fc1ccc(C[NH+]2CCC(C(F)(F)F)CC2)c(Cl)c1F ZINC001232874643 1038949310 /nfs/dbraw/zinc/94/93/10/1038949310.db2.gz YTGADOPABWBGAG-UHFFFAOYSA-N 1 2 313.697 4.393 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1nccs1 ZINC000153363974 1038936482 /nfs/dbraw/zinc/93/64/82/1038936482.db2.gz VPWSUCIUVZXBOP-ZWNOBZJWSA-N 1 2 306.406 4.235 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ncc(C(C)(C)C)o2)c1 ZINC000078387596 1038939887 /nfs/dbraw/zinc/93/98/87/1038939887.db2.gz QDQFDHZTKYECLW-INIZCTEOSA-N 1 2 314.429 4.318 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2ncc(C(C)(C)C)o2)c1 ZINC000078387596 1038939921 /nfs/dbraw/zinc/93/99/21/1038939921.db2.gz QDQFDHZTKYECLW-INIZCTEOSA-N 1 2 314.429 4.318 20 0 DIADLO CCn1nccc1C[NH+](Cc1cccs1)Cc1cccs1 ZINC000120086415 1038964348 /nfs/dbraw/zinc/96/43/48/1038964348.db2.gz XXCMNHBAYRVUQU-UHFFFAOYSA-N 1 2 317.483 4.228 20 0 DIADLO FC(F)(F)c1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)ccn1 ZINC001213085853 1038977432 /nfs/dbraw/zinc/97/74/32/1038977432.db2.gz ZZSMSQLLSGXLOY-UHFFFAOYSA-N 1 2 304.275 4.234 20 0 DIADLO COCOc1ccccc1Nc1c[nH+]c(CC(C)C)cc1C ZINC001211560813 1038992261 /nfs/dbraw/zinc/99/22/61/1038992261.db2.gz MVZQJGGRKALTDB-UHFFFAOYSA-N 1 2 300.402 4.315 20 0 DIADLO Cc1cc(NC(=O)N[C@@H](CC(C)C)c2cccs2)c(C)c[nH+]1 ZINC000534325552 1039026291 /nfs/dbraw/zinc/02/62/91/1039026291.db2.gz XVGHDODCYJRECA-HNNXBMFYSA-N 1 2 317.458 4.091 20 0 DIADLO Cc1cc(NC(=O)N(C)[C@@H](C)c2cc3ccccc3o2)c(C)c[nH+]1 ZINC000534325308 1039027742 /nfs/dbraw/zinc/02/77/42/1039027742.db2.gz MBRNDOUSOYQIGS-AWEZNQCLSA-N 1 2 323.396 4.091 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(OC2CCCCC2)nc1)c1cscn1 ZINC000534329600 1039032088 /nfs/dbraw/zinc/03/20/88/1039032088.db2.gz OHSZQWSWEUIVJJ-ZDUSSCGKSA-N 1 2 317.458 4.100 20 0 DIADLO COC[C@@H]([NH2+]Cc1c(F)cccc1F)c1cccc(Cl)c1 ZINC000685059400 1039056644 /nfs/dbraw/zinc/05/66/44/1039056644.db2.gz FMACNFJWYNLNBW-MRXNPFEDSA-N 1 2 311.759 4.096 20 0 DIADLO O=C(C[C@@H]1CCC[N@H+]1Cc1cccc(Cl)n1)c1cccs1 ZINC000121771243 1039067481 /nfs/dbraw/zinc/06/74/81/1039067481.db2.gz OZMYICGMEOIFQN-ZDUSSCGKSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@@H]1CCC[N@@H+]1Cc1cccc(Cl)n1)c1cccs1 ZINC000121771243 1039067496 /nfs/dbraw/zinc/06/74/96/1039067496.db2.gz OZMYICGMEOIFQN-ZDUSSCGKSA-N 1 2 320.845 4.034 20 0 DIADLO COc1cccc(C=C2CC[NH+](CC=C(Cl)Cl)CC2)c1 ZINC001167646809 1039078871 /nfs/dbraw/zinc/07/88/71/1039078871.db2.gz GWYFNHPTCSELDD-UHFFFAOYSA-N 1 2 312.240 4.493 20 0 DIADLO CC[C@H](CC(=O)NCc1c[nH+]c(C)cc1C)c1ccc(C)cc1 ZINC000456844615 1039082989 /nfs/dbraw/zinc/08/29/89/1039082989.db2.gz RBIBEYIVIDXVLP-QGZVFWFLSA-N 1 2 310.441 4.207 20 0 DIADLO Cc1cc(C)c(CNC(=O)CCCCCc2cccs2)c[nH+]1 ZINC000456831785 1039083662 /nfs/dbraw/zinc/08/36/62/1039083662.db2.gz FAMCKJICUPWOTF-UHFFFAOYSA-N 1 2 316.470 4.179 20 0 DIADLO CC[C@H](C)[C@@H](C(=O)NCc1c[nH+]c(C)cc1C)c1ccccc1 ZINC000456826203 1039084468 /nfs/dbraw/zinc/08/44/68/1039084468.db2.gz AGWCNUNPNDBBRE-IFXJQAMLSA-N 1 2 310.441 4.145 20 0 DIADLO CC[C@@H]1CCC[N@H+](Cc2cc(Cl)cnc2Br)C1 ZINC001232963190 1039088856 /nfs/dbraw/zinc/08/88/56/1039088856.db2.gz PQOOGLCPOFKQHT-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@@H]1CCC[N@@H+](Cc2cc(Cl)cnc2Br)C1 ZINC001232963190 1039088873 /nfs/dbraw/zinc/08/88/73/1039088873.db2.gz PQOOGLCPOFKQHT-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO CC(C)(CNc1cc(C(F)(F)F)cc[nH+]1)[C@@H]1CCCCO1 ZINC000675154221 1039113404 /nfs/dbraw/zinc/11/34/04/1039113404.db2.gz PKXBREYIIMJICZ-LBPRGKRZSA-N 1 2 302.340 4.108 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc2[nH]c(=O)oc2c1 ZINC000672621895 1039130545 /nfs/dbraw/zinc/13/05/45/1039130545.db2.gz NDFDUZKGIZZNQI-KGLIPLIRSA-N 1 2 310.344 4.008 20 0 DIADLO Cc1ccccc1C[N@@H+]1CCC[C@H]1c1nnc(-c2ccccc2)[nH]1 ZINC000535316511 1039187540 /nfs/dbraw/zinc/18/75/40/1039187540.db2.gz ITLZZJFGSUYURP-SFHVURJKSA-N 1 2 318.424 4.117 20 0 DIADLO Cc1ccccc1C[N@H+]1CCC[C@H]1c1nnc(-c2ccccc2)[nH]1 ZINC000535316511 1039187548 /nfs/dbraw/zinc/18/75/48/1039187548.db2.gz ITLZZJFGSUYURP-SFHVURJKSA-N 1 2 318.424 4.117 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1Cl)[N@H+]1CC=C(C(C)(C)C)CC1 ZINC000535405776 1039204108 /nfs/dbraw/zinc/20/41/08/1039204108.db2.gz JMBFHZBMEQHXCL-ZDUSSCGKSA-N 1 2 320.864 4.345 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1Cl)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000535405776 1039204125 /nfs/dbraw/zinc/20/41/25/1039204125.db2.gz JMBFHZBMEQHXCL-ZDUSSCGKSA-N 1 2 320.864 4.345 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1nc2cc(C(F)(F)F)ccc2o1 ZINC000126413466 1039218800 /nfs/dbraw/zinc/21/88/00/1039218800.db2.gz UVIRMJNVMDSTHH-UHFFFAOYSA-N 1 2 324.302 4.462 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1nc2cc(C(F)(F)F)ccc2o1 ZINC000126413466 1039218817 /nfs/dbraw/zinc/21/88/17/1039218817.db2.gz UVIRMJNVMDSTHH-UHFFFAOYSA-N 1 2 324.302 4.462 20 0 DIADLO CCCCN(C(=O)CCCn1cc[nH+]c1)[C@@H](C)c1ccccc1 ZINC000122190096 1039237657 /nfs/dbraw/zinc/23/76/57/1039237657.db2.gz MOHJNEFPBNXGQS-KRWDZBQOSA-N 1 2 313.445 4.053 20 0 DIADLO Cc1ccccc1[C@H]([NH2+]Cc1nc(C2CCCC2)no1)C1CC1 ZINC000539491712 1039270584 /nfs/dbraw/zinc/27/05/84/1039270584.db2.gz AUQYGHWPJRIUOA-GOSISDBHSA-N 1 2 311.429 4.277 20 0 DIADLO Cc1ccccc1-c1nn(C[N@@H+]2CCC[C@H]2C2CC2)c(=S)o1 ZINC000728561901 1039279008 /nfs/dbraw/zinc/27/90/08/1039279008.db2.gz CQHOILZCOLCUGQ-HNNXBMFYSA-N 1 2 315.442 4.013 20 0 DIADLO Cc1ccccc1-c1nn(C[N@H+]2CCC[C@H]2C2CC2)c(=S)o1 ZINC000728561901 1039279018 /nfs/dbraw/zinc/27/90/18/1039279018.db2.gz CQHOILZCOLCUGQ-HNNXBMFYSA-N 1 2 315.442 4.013 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc3ccccc32)o1 ZINC000007974978 1039298392 /nfs/dbraw/zinc/29/83/92/1039298392.db2.gz WOAFZRZJVVTQPZ-HNNXBMFYSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc3ccccc32)o1 ZINC000007974978 1039298404 /nfs/dbraw/zinc/29/84/04/1039298404.db2.gz WOAFZRZJVVTQPZ-HNNXBMFYSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1csc(C2([NH2+][C@@H](C)c3ccc(F)cc3F)CCC2)n1 ZINC000539635222 1039302447 /nfs/dbraw/zinc/30/24/47/1039302447.db2.gz OIKCBNKOXDLWGJ-NSHDSACASA-N 1 2 308.397 4.460 20 0 DIADLO CCCCc1noc([C@H](C)SCc2cc(OC)cc(C)[nH+]2)n1 ZINC000539625811 1039304815 /nfs/dbraw/zinc/30/48/15/1039304815.db2.gz HWHCBNNXAYDZGF-LBPRGKRZSA-N 1 2 321.446 4.119 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1Cl)c1cc2n(n1)CCCC2 ZINC000647289843 1039310902 /nfs/dbraw/zinc/31/09/02/1039310902.db2.gz LIYTYXSPGIBVCQ-VXGBXAGGSA-N 1 2 321.827 4.424 20 0 DIADLO COC[C@H](C)C[NH2+]c1ccc(N2CCc3sccc3C2)cc1 ZINC000187587415 1039319094 /nfs/dbraw/zinc/31/90/94/1039319094.db2.gz DOKVMMBGEZWCGY-CQSZACIVSA-N 1 2 316.470 4.005 20 0 DIADLO FC(F)(F)C1=CC[N@H+](Cc2ccc(Br)cc2)CC1 ZINC000536038379 1039336930 /nfs/dbraw/zinc/33/69/30/1039336930.db2.gz FELZVGKWQIFVDU-UHFFFAOYSA-N 1 2 320.152 4.144 20 0 DIADLO FC(F)(F)C1=CC[N@@H+](Cc2ccc(Br)cc2)CC1 ZINC000536038379 1039336948 /nfs/dbraw/zinc/33/69/48/1039336948.db2.gz FELZVGKWQIFVDU-UHFFFAOYSA-N 1 2 320.152 4.144 20 0 DIADLO Cc1ccc(-c2cccc(C[N@@H+]3CCC[C@@H]3c3ncon3)c2)cc1 ZINC000539816227 1039345242 /nfs/dbraw/zinc/34/52/42/1039345242.db2.gz BDPQWMBCYDAANC-LJQANCHMSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccc(-c2cccc(C[N@H+]3CCC[C@@H]3c3ncon3)c2)cc1 ZINC000539816227 1039345251 /nfs/dbraw/zinc/34/52/51/1039345251.db2.gz BDPQWMBCYDAANC-LJQANCHMSA-N 1 2 319.408 4.382 20 0 DIADLO COc1cc(C)ccc1C[NH2+]Cc1csc(-c2ccco2)n1 ZINC000151011103 1039347453 /nfs/dbraw/zinc/34/74/53/1039347453.db2.gz HMJAMEKAEJAKGZ-UHFFFAOYSA-N 1 2 314.410 4.010 20 0 DIADLO Cc1csc(C[N@H+](Cc2ccccc2)[C@H]2COC(C)(C)C2)n1 ZINC000661193649 1039349613 /nfs/dbraw/zinc/34/96/13/1039349613.db2.gz IIEDVIQFWPXNSF-MRXNPFEDSA-N 1 2 316.470 4.021 20 0 DIADLO Cc1csc(C[N@@H+](Cc2ccccc2)[C@H]2COC(C)(C)C2)n1 ZINC000661193649 1039349625 /nfs/dbraw/zinc/34/96/25/1039349625.db2.gz IIEDVIQFWPXNSF-MRXNPFEDSA-N 1 2 316.470 4.021 20 0 DIADLO C[N@@H+](Cc1ccon1)Cc1ccc(-c2cccc(F)c2)s1 ZINC000539819548 1039350866 /nfs/dbraw/zinc/35/08/66/1039350866.db2.gz HICWXSVMSQMYEM-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@H+](Cc1ccon1)Cc1ccc(-c2cccc(F)c2)s1 ZINC000539819548 1039350881 /nfs/dbraw/zinc/35/08/81/1039350881.db2.gz HICWXSVMSQMYEM-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO Cc1cc(C[N@@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)ccc1F ZINC000539850541 1039366977 /nfs/dbraw/zinc/36/69/77/1039366977.db2.gz TZVHAHJRLOYTFI-GUYCJALGSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1cc(C[N@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)ccc1F ZINC000539850541 1039366996 /nfs/dbraw/zinc/36/69/96/1039366996.db2.gz TZVHAHJRLOYTFI-GUYCJALGSA-N 1 2 305.418 4.158 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1ccc(Cl)s1 ZINC000539838990 1039370954 /nfs/dbraw/zinc/37/09/54/1039370954.db2.gz CERVRBGRPQANDW-WFASDCNBSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1ccc(Cl)s1 ZINC000539838990 1039370969 /nfs/dbraw/zinc/37/09/69/1039370969.db2.gz CERVRBGRPQANDW-WFASDCNBSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)cc1F ZINC000539851006 1039374984 /nfs/dbraw/zinc/37/49/84/1039374984.db2.gz WHUDBEGTZFOYPG-CXAGYDPISA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)cc1F ZINC000539851006 1039374992 /nfs/dbraw/zinc/37/49/92/1039374992.db2.gz WHUDBEGTZFOYPG-CXAGYDPISA-N 1 2 305.418 4.158 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1cnc(C3CC3)s1)CC2 ZINC000539862263 1039376059 /nfs/dbraw/zinc/37/60/59/1039376059.db2.gz QRFIRHYDCGCRNZ-UHFFFAOYSA-N 1 2 304.846 4.232 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1cnc(C3CC3)s1)CC2 ZINC000539862263 1039376067 /nfs/dbraw/zinc/37/60/67/1039376067.db2.gz QRFIRHYDCGCRNZ-UHFFFAOYSA-N 1 2 304.846 4.232 20 0 DIADLO FC(F)(F)c1ccccc1C1=CC[N@H+](Cc2cscn2)CC1 ZINC000539904657 1039386616 /nfs/dbraw/zinc/38/66/16/1039386616.db2.gz IJWMEEYAWXCQSV-UHFFFAOYSA-N 1 2 324.371 4.451 20 0 DIADLO FC(F)(F)c1ccccc1C1=CC[N@@H+](Cc2cscn2)CC1 ZINC000539904657 1039386624 /nfs/dbraw/zinc/38/66/24/1039386624.db2.gz IJWMEEYAWXCQSV-UHFFFAOYSA-N 1 2 324.371 4.451 20 0 DIADLO COc1cc(C[N@H+](C)[C@@H](C)c2ccccc2F)c(Cl)cc1O ZINC001205077782 1039432670 /nfs/dbraw/zinc/43/26/70/1039432670.db2.gz SJVRETPBTNOWDV-NSHDSACASA-N 1 2 323.795 4.386 20 0 DIADLO COc1cc(C[N@@H+](C)[C@@H](C)c2ccccc2F)c(Cl)cc1O ZINC001205077782 1039432677 /nfs/dbraw/zinc/43/26/77/1039432677.db2.gz SJVRETPBTNOWDV-NSHDSACASA-N 1 2 323.795 4.386 20 0 DIADLO CC(C)Sc1cccc(Cl)c1C[NH2+][C@H](C)c1nccn1C ZINC000657794792 1039463729 /nfs/dbraw/zinc/46/37/29/1039463729.db2.gz WPLWBALYQYLAIQ-GFCCVEGCSA-N 1 2 323.893 4.425 20 0 DIADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1csc(C(F)(F)F)c1 ZINC000926530625 1039471336 /nfs/dbraw/zinc/47/13/36/1039471336.db2.gz BPNMLKZZNGNBOD-WCABBAIRSA-N 1 2 315.364 4.320 20 0 DIADLO CC[C@H](C)[C@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000540386189 1039484322 /nfs/dbraw/zinc/48/43/22/1039484322.db2.gz PBXIVIXFGXADND-ZBEGNZNMSA-N 1 2 319.836 4.477 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC000540438976 1039493110 /nfs/dbraw/zinc/49/31/10/1039493110.db2.gz BMVMEBRKORZAPN-CQSZACIVSA-N 1 2 307.397 4.150 20 0 DIADLO CC(C)c1nc(C[NH2+]C2(c3ccccc3)CC2)c2ccccn21 ZINC000583998647 1039539017 /nfs/dbraw/zinc/53/90/17/1039539017.db2.gz DIVBOTLLIZTTBU-UHFFFAOYSA-N 1 2 305.425 4.237 20 0 DIADLO COc1cc(C)[nH+]c(CSCCCOc2ccccc2)c1 ZINC000540724323 1039550527 /nfs/dbraw/zinc/55/05/27/1039550527.db2.gz GRFJJDYCKITXNJ-UHFFFAOYSA-N 1 2 303.427 4.101 20 0 DIADLO C[C@H](Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1cc(F)cc(F)c1 ZINC000540834718 1039575463 /nfs/dbraw/zinc/57/54/63/1039575463.db2.gz ZFZPOJKIFSHCDQ-NSHDSACASA-N 1 2 317.314 4.463 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1ccc(Cl)nc1Cl ZINC000278638641 1039607937 /nfs/dbraw/zinc/60/79/37/1039607937.db2.gz OSHGBGTZHYSMLV-CYBMUJFWSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(Cl)nc1Cl ZINC000278638641 1039607947 /nfs/dbraw/zinc/60/79/47/1039607947.db2.gz OSHGBGTZHYSMLV-CYBMUJFWSA-N 1 2 310.228 4.367 20 0 DIADLO CCCOc1cccc2c(N3CCCO[C@H](CC)C3)cc[nH+]c12 ZINC000541217699 1039640196 /nfs/dbraw/zinc/64/01/96/1039640196.db2.gz ZYNYWDSKUMBSTA-OAHLLOKOSA-N 1 2 314.429 4.029 20 0 DIADLO C[C@H]1C[C@H]([NH2+]Cc2cnc(C3CCCCC3)s2)c2nccn21 ZINC000584212727 1039641930 /nfs/dbraw/zinc/64/19/30/1039641930.db2.gz PBZPPHXLZLNEPB-WFASDCNBSA-N 1 2 316.474 4.183 20 0 DIADLO Oc1cccc2ccc(/C=C/c3cc(-n4cc[nH+]c4)cs3)nc12 ZINC000541259755 1039646998 /nfs/dbraw/zinc/64/69/98/1039646998.db2.gz RTVDERWWFGFZJJ-VOTSOKGWSA-N 1 2 319.389 4.358 20 0 DIADLO CCc1nc(C[N@H+](C)[C@H]2CCc3ccc(Cl)cc32)cs1 ZINC000541281521 1039658533 /nfs/dbraw/zinc/65/85/33/1039658533.db2.gz BJWGSSWFDKLTEJ-HNNXBMFYSA-N 1 2 306.862 4.478 20 0 DIADLO CCc1nc(C[N@@H+](C)[C@H]2CCc3ccc(Cl)cc32)cs1 ZINC000541281521 1039658535 /nfs/dbraw/zinc/65/85/35/1039658535.db2.gz BJWGSSWFDKLTEJ-HNNXBMFYSA-N 1 2 306.862 4.478 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccsc1)c1ncc(Br)s1 ZINC000381318337 1039670693 /nfs/dbraw/zinc/67/06/93/1039670693.db2.gz NWIXNYSAAKSINO-JGVFFNPUSA-N 1 2 317.277 4.379 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+](C)Cc1cccc(O)c1 ZINC000080923974 1039688766 /nfs/dbraw/zinc/68/87/66/1039688766.db2.gz ARERHQQOIJGCJY-AWEZNQCLSA-N 1 2 308.381 4.240 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+](C)Cc1cccc(O)c1 ZINC000080923974 1039688776 /nfs/dbraw/zinc/68/87/76/1039688776.db2.gz ARERHQQOIJGCJY-AWEZNQCLSA-N 1 2 308.381 4.240 20 0 DIADLO O=C(C/C=C/c1ccc(F)cc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000081523149 1039716263 /nfs/dbraw/zinc/71/62/63/1039716263.db2.gz MMVDJHLHVGYGIM-OWOJBTEDSA-N 1 2 321.355 4.053 20 0 DIADLO CCC[C@@]1(C)CCC[N@H+](Cc2noc(Cc3ccccc3)n2)C1 ZINC000464845712 1039769462 /nfs/dbraw/zinc/76/94/62/1039769462.db2.gz OUZVPDCYFVHSQB-IBGZPJMESA-N 1 2 313.445 4.063 20 0 DIADLO CCC[C@@]1(C)CCC[N@@H+](Cc2noc(Cc3ccccc3)n2)C1 ZINC000464845712 1039769485 /nfs/dbraw/zinc/76/94/85/1039769485.db2.gz OUZVPDCYFVHSQB-IBGZPJMESA-N 1 2 313.445 4.063 20 0 DIADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1coc(-c2ccccc2)n1 ZINC000542015060 1039781017 /nfs/dbraw/zinc/78/10/17/1039781017.db2.gz DXZYWXHFFMZGIQ-HNNXBMFYSA-N 1 2 320.392 4.125 20 0 DIADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1coc(-c2ccccc2)n1 ZINC000542015060 1039781033 /nfs/dbraw/zinc/78/10/33/1039781033.db2.gz DXZYWXHFFMZGIQ-HNNXBMFYSA-N 1 2 320.392 4.125 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1coc(-c2ccccc2)n1 ZINC000542015062 1039781692 /nfs/dbraw/zinc/78/16/92/1039781692.db2.gz DXZYWXHFFMZGIQ-OAHLLOKOSA-N 1 2 320.392 4.125 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1coc(-c2ccccc2)n1 ZINC000542015062 1039781712 /nfs/dbraw/zinc/78/17/12/1039781712.db2.gz DXZYWXHFFMZGIQ-OAHLLOKOSA-N 1 2 320.392 4.125 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@H](C)c2cnn(C(C)C)c2)cs1 ZINC000090049915 1039787817 /nfs/dbraw/zinc/78/78/17/1039787817.db2.gz TZXFBQCZDWVPTH-CHWSQXEVSA-N 1 2 306.479 4.456 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccn1)c1nc(-c2ccncc2)cs1 ZINC000090045761 1039788340 /nfs/dbraw/zinc/78/83/40/1039788340.db2.gz FSHJEKYXQLANJL-STQMWFEESA-N 1 2 310.426 4.012 20 0 DIADLO CCn1nc(C)c(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)c1C ZINC000090089692 1039799644 /nfs/dbraw/zinc/79/96/44/1039799644.db2.gz PJJBCKKYGQENAF-UHFFFAOYSA-N 1 2 315.465 4.169 20 0 DIADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1cnc(C(C)(C)C)s1 ZINC000542187033 1039808838 /nfs/dbraw/zinc/80/88/38/1039808838.db2.gz WUOSJOMJBCNSLU-ZDUSSCGKSA-N 1 2 316.470 4.224 20 0 DIADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1cnc(C(C)(C)C)s1 ZINC000542187033 1039808872 /nfs/dbraw/zinc/80/88/72/1039808872.db2.gz WUOSJOMJBCNSLU-ZDUSSCGKSA-N 1 2 316.470 4.224 20 0 DIADLO Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]Cc1ncccc1F)CCCO2 ZINC000090722003 1039815988 /nfs/dbraw/zinc/81/59/88/1039815988.db2.gz FCQYLWQTGZVQIO-HNNXBMFYSA-N 1 2 320.795 4.186 20 0 DIADLO Cc1cc(-c2noc(C[NH2+][C@H](C)c3ccsc3)n2)ccc1F ZINC000669937173 1039867810 /nfs/dbraw/zinc/86/78/10/1039867810.db2.gz QAAGKARFMMJAOL-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO COc1ccc(-c2cnc(C[NH2+][C@H](C)c3ccsc3)o2)cc1 ZINC000669939716 1039878820 /nfs/dbraw/zinc/87/88/20/1039878820.db2.gz IPGHLSFUPXHVNF-GFCCVEGCSA-N 1 2 314.410 4.263 20 0 DIADLO FC(F)(F)CCCCn1nc(C(F)(F)F)c2c[nH+]ccc21 ZINC000092919145 1039887896 /nfs/dbraw/zinc/88/78/96/1039887896.db2.gz FAHRIQLGQRKTDD-UHFFFAOYSA-N 1 2 311.229 4.183 20 0 DIADLO Cc1nc2ccc(CNc3ccc(N4CCCC4)[nH+]c3)cc2s1 ZINC000491868405 1039888213 /nfs/dbraw/zinc/88/82/13/1039888213.db2.gz KLWPGHQLZZVBHC-UHFFFAOYSA-N 1 2 324.453 4.212 20 0 DIADLO CC(=O)Nc1ccccc1C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000093686292 1039901005 /nfs/dbraw/zinc/90/10/05/1039901005.db2.gz QZXPQCVVNBVFRO-GOSISDBHSA-N 1 2 314.816 4.245 20 0 DIADLO CC(=O)Nc1ccccc1C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000093686292 1039901026 /nfs/dbraw/zinc/90/10/26/1039901026.db2.gz QZXPQCVVNBVFRO-GOSISDBHSA-N 1 2 314.816 4.245 20 0 DIADLO CCC[C@H]([NH2+]Cc1ccc(C)c(C)n1)c1ncccc1Cl ZINC000926570683 1039906123 /nfs/dbraw/zinc/90/61/23/1039906123.db2.gz YBNWVGLFKVLALQ-INIZCTEOSA-N 1 2 303.837 4.378 20 0 DIADLO COc1ccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)c(C)c1 ZINC000171147913 1039958677 /nfs/dbraw/zinc/95/86/77/1039958677.db2.gz OANMZRPZNGJQKS-HNNXBMFYSA-N 1 2 307.397 4.362 20 0 DIADLO Cc1cccc2cc(C(=O)Nc3ccc(-n4cc[nH+]c4)cc3)oc21 ZINC000148884749 1039963746 /nfs/dbraw/zinc/96/37/46/1039963746.db2.gz DZXIQUJSCVNKIA-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc(Cl)cc(Cl)c1F)c1ccn(C)n1 ZINC000926577642 1039989095 /nfs/dbraw/zinc/98/90/95/1039989095.db2.gz RZKOWPQVBKTFNS-RKDXNWHRSA-N 1 2 316.207 4.278 20 0 DIADLO c1ccc(N2CCC(Nc3ccc4c(c3)CCCC4)CC2)[nH+]c1 ZINC000404748010 1040033814 /nfs/dbraw/zinc/03/38/14/1040033814.db2.gz HTDOKBABYFFGKN-UHFFFAOYSA-N 1 2 307.441 4.041 20 0 DIADLO Cc1noc([C@H]2CCC[N@@H+]2Cc2ccc(C(C)(C)C)s2)n1 ZINC000685448290 1040057874 /nfs/dbraw/zinc/05/78/74/1040057874.db2.gz ZWJJDYANGVJJSG-CYBMUJFWSA-N 1 2 305.447 4.074 20 0 DIADLO Cc1noc([C@H]2CCC[N@H+]2Cc2ccc(C(C)(C)C)s2)n1 ZINC000685448290 1040057887 /nfs/dbraw/zinc/05/78/87/1040057887.db2.gz ZWJJDYANGVJJSG-CYBMUJFWSA-N 1 2 305.447 4.074 20 0 DIADLO O=C(C/C=C/c1ccccc1F)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000175972267 1040060694 /nfs/dbraw/zinc/06/06/94/1040060694.db2.gz DVELXCSJLLXRRL-HWKANZROSA-N 1 2 321.355 4.258 20 0 DIADLO Cc1csc(C[NH2+]Cc2ccc(-c3ccc(F)cc3C)o2)n1 ZINC000115611227 1040107110 /nfs/dbraw/zinc/10/71/10/1040107110.db2.gz CHVGHBKTBPCYTC-UHFFFAOYSA-N 1 2 316.401 4.449 20 0 DIADLO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1ccccc1Br ZINC000294267362 1040118530 /nfs/dbraw/zinc/11/85/30/1040118530.db2.gz XTDFTPCYHOMLGA-SUNKGSAMSA-N 1 2 320.234 4.002 20 0 DIADLO Cc1nc(C)c(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)o1 ZINC000685568825 1040134564 /nfs/dbraw/zinc/13/45/64/1040134564.db2.gz MCLDBOXAIRCCCW-INIZCTEOSA-N 1 2 306.356 4.297 20 0 DIADLO Cc1nc(C)c(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)o1 ZINC000685568825 1040134574 /nfs/dbraw/zinc/13/45/74/1040134574.db2.gz MCLDBOXAIRCCCW-INIZCTEOSA-N 1 2 306.356 4.297 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cc(C(C)(C)C)on1 ZINC000685571942 1040135428 /nfs/dbraw/zinc/13/54/28/1040135428.db2.gz BZZOQMWBDCZSOZ-GHMZBOCLSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cc(C(C)(C)C)on1 ZINC000685571942 1040135437 /nfs/dbraw/zinc/13/54/37/1040135437.db2.gz BZZOQMWBDCZSOZ-GHMZBOCLSA-N 1 2 304.356 4.135 20 0 DIADLO CCC1(Cc2ccccc2)CC[NH+]([C@@H](C)c2noc(C)n2)CC1 ZINC000685580453 1040142109 /nfs/dbraw/zinc/14/21/09/1040142109.db2.gz ZRSGJFOYJPHLAI-HNNXBMFYSA-N 1 2 313.445 4.174 20 0 DIADLO CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+][C@@H]1C[C@@H](C)n2ncnc21 ZINC000658104123 1040313486 /nfs/dbraw/zinc/31/34/86/1040313486.db2.gz ZUSHNLYVMZDULF-DVOMOZLQSA-N 1 2 324.428 4.252 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2cccc(OC3CC3)c2F)c(C)s1 ZINC000658171916 1040341465 /nfs/dbraw/zinc/34/14/65/1040341465.db2.gz NDOWWULHPMVUJK-SNVBAGLBSA-N 1 2 320.433 4.291 20 0 DIADLO COc1ccnc(C[NH2+][C@H]2C[C@H](C)Sc3sccc32)c1F ZINC000658228083 1040370104 /nfs/dbraw/zinc/37/01/04/1040370104.db2.gz NZYQXJZZGDCDIX-ONGXEEELSA-N 1 2 324.446 4.006 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000780896332 1040506470 /nfs/dbraw/zinc/50/64/70/1040506470.db2.gz AUCVJQNWXGNTAR-AOIWGVFYSA-N 1 2 319.493 4.289 20 0 DIADLO CCSc1ccccc1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000023890512 1040525146 /nfs/dbraw/zinc/52/51/46/1040525146.db2.gz SNRUUPLXHJBRGC-UHFFFAOYSA-N 1 2 323.421 4.237 20 0 DIADLO CC(C)C[N@H+](C)Cn1nc(-c2ccccc2Cl)oc1=S ZINC000065943743 1040608980 /nfs/dbraw/zinc/60/89/80/1040608980.db2.gz ZWTIJLSYJKVTGY-UHFFFAOYSA-N 1 2 311.838 4.071 20 0 DIADLO CC(C)C[N@@H+](C)Cn1nc(-c2ccccc2Cl)oc1=S ZINC000065943743 1040608988 /nfs/dbraw/zinc/60/89/88/1040608988.db2.gz ZWTIJLSYJKVTGY-UHFFFAOYSA-N 1 2 311.838 4.071 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cn1cc(-c2ccccc2)cn1 ZINC000065940874 1040609047 /nfs/dbraw/zinc/60/90/47/1040609047.db2.gz JGZVEHYIROODDT-UHFFFAOYSA-N 1 2 317.845 4.355 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cn1cc(-c2ccccc2)cn1 ZINC000065940874 1040609054 /nfs/dbraw/zinc/60/90/54/1040609054.db2.gz JGZVEHYIROODDT-UHFFFAOYSA-N 1 2 317.845 4.355 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cn1ccc(C(F)(F)F)n1 ZINC000065941780 1040611151 /nfs/dbraw/zinc/61/11/51/1040611151.db2.gz IRZMEVIRDZAICH-AWEZNQCLSA-N 1 2 309.335 4.005 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@H+]1Cn1ccc(C(F)(F)F)n1 ZINC000065941780 1040611155 /nfs/dbraw/zinc/61/11/55/1040611155.db2.gz IRZMEVIRDZAICH-AWEZNQCLSA-N 1 2 309.335 4.005 20 0 DIADLO CC(C)c1nc(C[NH+]2CCC(c3cc4ccccc4[nH]3)CC2)no1 ZINC000065966057 1040631894 /nfs/dbraw/zinc/63/18/94/1040631894.db2.gz NWULCILVYCKNDB-UHFFFAOYSA-N 1 2 324.428 4.054 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc(Br)s1 ZINC000309551241 1040712737 /nfs/dbraw/zinc/71/27/37/1040712737.db2.gz IGYBDWRWZBKRBB-VXNVDRBHSA-N 1 2 310.207 4.349 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc(Br)s1 ZINC000309551239 1040713325 /nfs/dbraw/zinc/71/33/25/1040713325.db2.gz IGYBDWRWZBKRBB-IONNQARKSA-N 1 2 310.207 4.349 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+][C@@H]1COCc2cccc(Cl)c21 ZINC000924560524 1040731539 /nfs/dbraw/zinc/73/15/39/1040731539.db2.gz XOOQOOSERDXIAC-MLGOLLRUSA-N 1 2 317.816 4.271 20 0 DIADLO Cc1cn[nH]c1C[N@@H+]([C@@H](C)c1cccc(C(F)(F)F)c1)C1CC1 ZINC000685833549 1040768211 /nfs/dbraw/zinc/76/82/11/1040768211.db2.gz KDZUEUHUCHXFSV-LBPRGKRZSA-N 1 2 323.362 4.463 20 0 DIADLO Cc1cn[nH]c1C[N@H+]([C@@H](C)c1cccc(C(F)(F)F)c1)C1CC1 ZINC000685833549 1040768228 /nfs/dbraw/zinc/76/82/28/1040768228.db2.gz KDZUEUHUCHXFSV-LBPRGKRZSA-N 1 2 323.362 4.463 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)s1 ZINC000685838040 1040774736 /nfs/dbraw/zinc/77/47/36/1040774736.db2.gz WTUDDURZUXIEFJ-XJKSGUPXSA-N 1 2 319.495 4.432 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)s1 ZINC000685838040 1040774745 /nfs/dbraw/zinc/77/47/45/1040774745.db2.gz WTUDDURZUXIEFJ-XJKSGUPXSA-N 1 2 319.495 4.432 20 0 DIADLO Cc1c[nH]nc1C[N@@H+]1CCCC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000685843802 1040785621 /nfs/dbraw/zinc/78/56/21/1040785621.db2.gz AFLXKAMDXFUGRS-INIZCTEOSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1c[nH]nc1C[N@H+]1CCCC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000685843802 1040785637 /nfs/dbraw/zinc/78/56/37/1040785637.db2.gz AFLXKAMDXFUGRS-INIZCTEOSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1cc(-c2noc([C@@H](CC(C)C)n3cc[nH+]c3)n2)ccc1F ZINC000923783375 1040795812 /nfs/dbraw/zinc/79/58/12/1040795812.db2.gz GDEUFXQRFPBUQB-OAHLLOKOSA-N 1 2 314.364 4.016 20 0 DIADLO COc1ccc(C[N@H+](C)[C@H](C)c2c(F)cccc2F)cc1F ZINC000613418175 1040937979 /nfs/dbraw/zinc/93/79/79/1040937979.db2.gz NXRDEXRAFVTVFE-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@H](C)c2c(F)cccc2F)cc1F ZINC000613418175 1040937998 /nfs/dbraw/zinc/93/79/98/1040937998.db2.gz NXRDEXRAFVTVFE-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO Cc1cnc(C[N@@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)o1 ZINC000174037048 1040939263 /nfs/dbraw/zinc/93/92/63/1040939263.db2.gz SJVIFEVDXZSTQF-LJQANCHMSA-N 1 2 304.393 4.283 20 0 DIADLO Cc1cnc(C[N@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)o1 ZINC000174037048 1040939275 /nfs/dbraw/zinc/93/92/75/1040939275.db2.gz SJVIFEVDXZSTQF-LJQANCHMSA-N 1 2 304.393 4.283 20 0 DIADLO Cc1cc(C[NH+]2CCC(Oc3ccc(C(C)C)cc3)CC2)no1 ZINC000613446868 1040957437 /nfs/dbraw/zinc/95/74/37/1040957437.db2.gz NFRJVRVPDMBCMY-UHFFFAOYSA-N 1 2 314.429 4.150 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)CC(=O)NC1CCC(C)CC1 ZINC000613485524 1040998061 /nfs/dbraw/zinc/99/80/61/1040998061.db2.gz ZFEOEHVTGCNNBI-SHARSMKWSA-N 1 2 322.880 4.028 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)CC(=O)NC1CCC(C)CC1 ZINC000613485524 1040998082 /nfs/dbraw/zinc/99/80/82/1040998082.db2.gz ZFEOEHVTGCNNBI-SHARSMKWSA-N 1 2 322.880 4.028 20 0 DIADLO Clc1ccccc1[C@H]1CCC[N@@H+]1Cc1cn2ccccc2n1 ZINC000613492515 1041006423 /nfs/dbraw/zinc/00/64/23/1041006423.db2.gz QOPJLUIMUJQOPR-QGZVFWFLSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1ccccc1[C@H]1CCC[N@H+]1Cc1cn2ccccc2n1 ZINC000613492515 1041006437 /nfs/dbraw/zinc/00/64/37/1041006437.db2.gz QOPJLUIMUJQOPR-QGZVFWFLSA-N 1 2 311.816 4.325 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cccc3c2OCO3)c(Cl)c1 ZINC001140799900 1041029592 /nfs/dbraw/zinc/02/95/92/1041029592.db2.gz PQYUPYKNLDLZBM-UHFFFAOYSA-N 1 2 303.789 4.009 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cccc3c2OCO3)c(Cl)c1 ZINC001140799900 1041029608 /nfs/dbraw/zinc/02/96/08/1041029608.db2.gz PQYUPYKNLDLZBM-UHFFFAOYSA-N 1 2 303.789 4.009 20 0 DIADLO Cc1cccc(-c2nnc([C@H](C)[N@@H+]3CCCc4occc4C3)o2)c1 ZINC000808797380 1041031733 /nfs/dbraw/zinc/03/17/33/1041031733.db2.gz ONJUTEZBLZRFGT-AWEZNQCLSA-N 1 2 323.396 4.147 20 0 DIADLO Cc1cccc(-c2nnc([C@H](C)[N@H+]3CCCc4occc4C3)o2)c1 ZINC000808797380 1041031743 /nfs/dbraw/zinc/03/17/43/1041031743.db2.gz ONJUTEZBLZRFGT-AWEZNQCLSA-N 1 2 323.396 4.147 20 0 DIADLO CC(C)c1ccc([C@H](C)[NH2+]Cc2nccc(C(F)(F)F)n2)cc1 ZINC000414236685 1041036594 /nfs/dbraw/zinc/03/65/94/1041036594.db2.gz IHIFXLDTODHDLI-LBPRGKRZSA-N 1 2 323.362 4.470 20 0 DIADLO Cc1ccc(Br)c(C[NH2+][C@H](C)c2nccs2)c1 ZINC000414273369 1041070076 /nfs/dbraw/zinc/07/00/76/1041070076.db2.gz ZCNFPEYKEWAZAW-SNVBAGLBSA-N 1 2 311.248 4.065 20 0 DIADLO COc1ccc([C@H](C)CC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000175726966 1041096153 /nfs/dbraw/zinc/09/61/53/1041096153.db2.gz DZYMJHRRZFBIPS-GFCCVEGCSA-N 1 2 312.413 4.148 20 0 DIADLO Cc1cccc(-c2ccc(C[NH2+]Cc3ncnn3C(C)C)cc2)c1 ZINC000685904548 1041101431 /nfs/dbraw/zinc/10/14/31/1041101431.db2.gz BZULNWIWZFSOFL-UHFFFAOYSA-N 1 2 320.440 4.124 20 0 DIADLO COc1cccc2c(NCc3ccc4ccccc4n3)cc[nH+]c12 ZINC000685905180 1041105692 /nfs/dbraw/zinc/10/56/92/1041105692.db2.gz VLVRMNMSLBUBEE-UHFFFAOYSA-N 1 2 315.376 4.404 20 0 DIADLO Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]Cc1nnc(C2CC2)s1 ZINC000892607871 1041108147 /nfs/dbraw/zinc/10/81/47/1041108147.db2.gz MYJSLQCEWXYCCH-ZDUSSCGKSA-N 1 2 317.458 4.120 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nnc(C2CC2)s1)c1cc(F)ccc1F ZINC000414320138 1041125704 /nfs/dbraw/zinc/12/57/04/1041125704.db2.gz BETHCGFFMUTMNF-OAHLLOKOSA-N 1 2 323.412 4.181 20 0 DIADLO COc1cccc([C@H](C)[NH2+]Cc2csc(C(F)(F)F)n2)c1 ZINC000892634146 1041169206 /nfs/dbraw/zinc/16/92/06/1041169206.db2.gz NTFNHBUJNLIJQX-VIFPVBQESA-N 1 2 316.348 4.021 20 0 DIADLO COc1ccc2cc(NCc3nccc4ccccc43)[nH+]cc2c1 ZINC001167700235 1041171809 /nfs/dbraw/zinc/17/18/09/1041171809.db2.gz HBAKPKWOLLFLPD-UHFFFAOYSA-N 1 2 315.376 4.404 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1ccc(-c2ncco2)cc1F ZINC001170581936 1041182428 /nfs/dbraw/zinc/18/24/28/1041182428.db2.gz IEPLPRUSWJFSJB-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1ccc(-c2ncco2)cc1F ZINC001170581936 1041182439 /nfs/dbraw/zinc/18/24/39/1041182439.db2.gz IEPLPRUSWJFSJB-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO CC[N@H+](Cc1csc(Cl)n1)[C@@H](C)c1cccc(OC)c1 ZINC000809572484 1041187055 /nfs/dbraw/zinc/18/70/55/1041187055.db2.gz OAZZQKLGGGCLDZ-NSHDSACASA-N 1 2 310.850 4.388 20 0 DIADLO CC[N@@H+](Cc1csc(Cl)n1)[C@@H](C)c1cccc(OC)c1 ZINC000809572484 1041187063 /nfs/dbraw/zinc/18/70/63/1041187063.db2.gz OAZZQKLGGGCLDZ-NSHDSACASA-N 1 2 310.850 4.388 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2C/C=C\c2ccc(F)c(F)c2)no1 ZINC000809546645 1041190028 /nfs/dbraw/zinc/19/00/28/1041190028.db2.gz BYMADGFKMQSOQX-MMTGSJLXSA-N 1 2 304.340 4.112 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2C/C=C\c2ccc(F)c(F)c2)no1 ZINC000809546645 1041190033 /nfs/dbraw/zinc/19/00/33/1041190033.db2.gz BYMADGFKMQSOQX-MMTGSJLXSA-N 1 2 304.340 4.112 20 0 DIADLO Cc1cnc(C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)s1 ZINC000177380032 1041259929 /nfs/dbraw/zinc/25/99/29/1041259929.db2.gz RKFGKHUETKDARF-GOSISDBHSA-N 1 2 312.413 4.470 20 0 DIADLO C[C@H]([NH2+]Cc1nn(C)c2ccccc12)c1ccc(F)cc1Cl ZINC000605592281 1041262168 /nfs/dbraw/zinc/26/21/68/1041262168.db2.gz JZHAFTOESQJGLQ-NSHDSACASA-N 1 2 317.795 4.217 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000177637335 1041285992 /nfs/dbraw/zinc/28/59/92/1041285992.db2.gz WOAPGJMIOWAWNU-QWRGUYRKSA-N 1 2 310.850 4.355 20 0 DIADLO Cc1cc(NCc2cc(O)cc(C(F)(F)F)c2)ccc1[NH+](C)C ZINC000810150066 1041324121 /nfs/dbraw/zinc/32/41/21/1041324121.db2.gz YTRGNCKXJKNYBE-UHFFFAOYSA-N 1 2 324.346 4.398 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@H](c3cc[nH]n3)C2)c(Cl)s1 ZINC000648361123 1041341908 /nfs/dbraw/zinc/34/19/08/1041341908.db2.gz TWGNCCRYRDAYPX-VIFPVBQESA-N 1 2 316.257 4.158 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)c(Cl)s1 ZINC000648361123 1041341915 /nfs/dbraw/zinc/34/19/15/1041341915.db2.gz TWGNCCRYRDAYPX-VIFPVBQESA-N 1 2 316.257 4.158 20 0 DIADLO CCCCCC[C@H](CC)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001170602150 1041360717 /nfs/dbraw/zinc/36/07/17/1041360717.db2.gz WTWJVGHGVHPPTE-ZDUSSCGKSA-N 1 2 317.399 4.467 20 0 DIADLO CCCCCC[C@H](CC)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001170602150 1041360731 /nfs/dbraw/zinc/36/07/31/1041360731.db2.gz WTWJVGHGVHPPTE-ZDUSSCGKSA-N 1 2 317.399 4.467 20 0 DIADLO C[C@@H]([NH2+]CCN1C[C@@H](C)C[C@H](C)C1)c1ccc(F)cc1Cl ZINC001170603803 1041377895 /nfs/dbraw/zinc/37/78/95/1041377895.db2.gz DUNNUJDVOWJQFU-MELADBBJSA-N 1 2 312.860 4.108 20 0 DIADLO CCc1onc(C)c1C[NH2+]Cc1nc2cc(Cl)ccc2s1 ZINC000892721340 1041384467 /nfs/dbraw/zinc/38/44/67/1041384467.db2.gz KYFZAVNOMPSYDA-UHFFFAOYSA-N 1 2 321.833 4.098 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1noc2c1CCCC2)c1ccccc1F ZINC000661484459 1041395456 /nfs/dbraw/zinc/39/54/56/1041395456.db2.gz HGSHBNMVXKPPKF-GOSISDBHSA-N 1 2 302.393 4.179 20 0 DIADLO Oc1ccc(Cl)c(C[NH2+][C@H]2CCCc3c(Cl)ccnc32)c1 ZINC000926854357 1041411584 /nfs/dbraw/zinc/41/15/84/1041411584.db2.gz HJKUJEWZSOBNIV-HNNXBMFYSA-N 1 2 323.223 4.261 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1csc(C(F)(F)F)n1)CC2 ZINC000892921518 1041420773 /nfs/dbraw/zinc/42/07/73/1041420773.db2.gz UWWHTURJTFZLHP-LBPRGKRZSA-N 1 2 316.323 4.078 20 0 DIADLO C[C@H]([NH2+]Cc1coc(C2CC2)n1)c1ccc(-c2cccnc2)cc1 ZINC000747621923 1041421870 /nfs/dbraw/zinc/42/18/70/1041421870.db2.gz APEBNHXFJBASCY-AWEZNQCLSA-N 1 2 319.408 4.465 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)NC[C@@H]1c2ccccc2C[N@H+]1C ZINC001132405729 1041426335 /nfs/dbraw/zinc/42/63/35/1041426335.db2.gz XEVQWAVVAPWVIJ-QUCCMNQESA-N 1 2 316.489 4.286 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)NC[C@@H]1c2ccccc2C[N@@H+]1C ZINC001132405729 1041426338 /nfs/dbraw/zinc/42/63/38/1041426338.db2.gz XEVQWAVVAPWVIJ-QUCCMNQESA-N 1 2 316.489 4.286 20 0 DIADLO Oc1ccc([C@H]2CCC[N@@H+]2Cc2nccc(Cl)c2Cl)cc1 ZINC001167716822 1041431198 /nfs/dbraw/zinc/43/11/98/1041431198.db2.gz JISBGRBDXLSBPU-OAHLLOKOSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@H]2CCC[N@H+]2Cc2nccc(Cl)c2Cl)cc1 ZINC001167716822 1041431200 /nfs/dbraw/zinc/43/12/00/1041431200.db2.gz JISBGRBDXLSBPU-OAHLLOKOSA-N 1 2 323.223 4.431 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ncc(Cl)n2C)cc1C ZINC000122507150 1041437480 /nfs/dbraw/zinc/43/74/80/1041437480.db2.gz SXNKRNHVDVDALW-HNNXBMFYSA-N 1 2 303.837 4.027 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)n2C)cc1C ZINC000122507150 1041437485 /nfs/dbraw/zinc/43/74/85/1041437485.db2.gz SXNKRNHVDVDALW-HNNXBMFYSA-N 1 2 303.837 4.027 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2C(F)(F)F)C2CC2)c(C)o1 ZINC000659847592 1041441302 /nfs/dbraw/zinc/44/13/02/1041441302.db2.gz YLTABKMIGIENEU-UHFFFAOYSA-N 1 2 324.346 4.475 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2C(F)(F)F)C2CC2)c(C)o1 ZINC000659847592 1041441307 /nfs/dbraw/zinc/44/13/07/1041441307.db2.gz YLTABKMIGIENEU-UHFFFAOYSA-N 1 2 324.346 4.475 20 0 DIADLO CC(C)CCN(C(=O)[C@@H](CC(C)C)n1cc[nH+]c1)C1CCCC1 ZINC001625890747 1041458819 /nfs/dbraw/zinc/45/88/19/1041458819.db2.gz PYVIEESOKIBBPH-GOSISDBHSA-N 1 2 319.493 4.288 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](Cc1cn(C)cn1)Cc1ccccc1 ZINC000659859893 1041464192 /nfs/dbraw/zinc/46/41/92/1041464192.db2.gz PLMSGCPCXIMFJX-HNNXBMFYSA-N 1 2 311.454 4.245 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](Cc1cn(C)cn1)Cc1ccccc1 ZINC000659859893 1041464202 /nfs/dbraw/zinc/46/42/02/1041464202.db2.gz PLMSGCPCXIMFJX-HNNXBMFYSA-N 1 2 311.454 4.245 20 0 DIADLO Fc1cc(F)c(F)c(C[NH2+][C@@H](c2ccccn2)C2CCC2)c1F ZINC000925502799 1041482010 /nfs/dbraw/zinc/48/20/10/1041482010.db2.gz HTMAXBGESMVPMB-QGZVFWFLSA-N 1 2 324.321 4.269 20 0 DIADLO Cc1ccc(-c2ccc(Cl)c(OC(F)(F)F)c2)[nH+]c1N ZINC001244675427 1041488641 /nfs/dbraw/zinc/48/86/41/1041488641.db2.gz RJELKWZCUFSZKY-UHFFFAOYSA-N 1 2 302.683 4.191 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1cscn1 ZINC000271024124 1041491392 /nfs/dbraw/zinc/49/13/92/1041491392.db2.gz AVKCPPADSKRZTL-KBPBESRZSA-N 1 2 304.459 4.480 20 0 DIADLO Cc1cc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)nc(C)n1 ZINC000659875539 1041499797 /nfs/dbraw/zinc/49/97/97/1041499797.db2.gz ZKNMHYPBKQLWPY-ZDUSSCGKSA-N 1 2 315.848 4.472 20 0 DIADLO Cc1cc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)nc(C)n1 ZINC000659875539 1041499805 /nfs/dbraw/zinc/49/98/05/1041499805.db2.gz ZKNMHYPBKQLWPY-ZDUSSCGKSA-N 1 2 315.848 4.472 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1ccnc(Cl)c1Cl ZINC000811491926 1041524643 /nfs/dbraw/zinc/52/46/43/1041524643.db2.gz RRWTZLFHUNZWLO-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO Clc1nccc(C[N@@H+]2CCC=C(c3ccco3)C2)c1Cl ZINC000811505977 1041533098 /nfs/dbraw/zinc/53/30/98/1041533098.db2.gz VHGRDSXDUDEOND-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Clc1nccc(C[N@H+]2CCC=C(c3ccco3)C2)c1Cl ZINC000811505977 1041533102 /nfs/dbraw/zinc/53/31/02/1041533102.db2.gz VHGRDSXDUDEOND-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Cc1nocc1C[NH2+]Cc1c(Cl)ccc(Cl)c1Cl ZINC000397979486 1041547562 /nfs/dbraw/zinc/54/75/62/1041547562.db2.gz FWIJNMHRGZGKJN-UHFFFAOYSA-N 1 2 305.592 4.233 20 0 DIADLO Cc1nc2c(s1)[C@H](Nc1ccc([NH+](C)C)c(C)c1)CCC2 ZINC000182851520 1041574652 /nfs/dbraw/zinc/57/46/52/1041574652.db2.gz DESSNSFBMVPQIR-OAHLLOKOSA-N 1 2 301.459 4.315 20 0 DIADLO O=C(OCc1ccccc1)c1ccc(CNc2cccc[nH+]2)cc1 ZINC000811852625 1041574834 /nfs/dbraw/zinc/57/48/34/1041574834.db2.gz DQAQYJOZCHJJTB-UHFFFAOYSA-N 1 2 318.376 4.051 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2cccc(O)c2)c1Br ZINC001141088972 1041579575 /nfs/dbraw/zinc/57/95/75/1041579575.db2.gz CFESAGNRQJNXDS-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2cccc(O)c2)c1Br ZINC001141088972 1041579582 /nfs/dbraw/zinc/57/95/82/1041579582.db2.gz CFESAGNRQJNXDS-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO CC(C)=C[C@@H]1[C@H](C(=O)Nc2ccccc2-n2cc[nH+]c2)C1(C)C ZINC000613709506 1041585405 /nfs/dbraw/zinc/58/54/05/1041585405.db2.gz BESGCRMUJAPHGU-RHSMWYFYSA-N 1 2 309.413 4.049 20 0 DIADLO CC[C@](C)([NH2+]Cc1cccc(OC)c1Cl)c1nccs1 ZINC000660079354 1041602658 /nfs/dbraw/zinc/60/26/58/1041602658.db2.gz HSHLIHCINYTUIR-HNNXBMFYSA-N 1 2 310.850 4.220 20 0 DIADLO Cc1nc(C[N@H+]2CC=C(c3ccccc3C(F)(F)F)CC2)co1 ZINC000660100722 1041613564 /nfs/dbraw/zinc/61/35/64/1041613564.db2.gz UWXMUWUDZGUIER-UHFFFAOYSA-N 1 2 322.330 4.291 20 0 DIADLO Cc1nc(C[N@@H+]2CC=C(c3ccccc3C(F)(F)F)CC2)co1 ZINC000660100722 1041613569 /nfs/dbraw/zinc/61/35/69/1041613569.db2.gz UWXMUWUDZGUIER-UHFFFAOYSA-N 1 2 322.330 4.291 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)co1 ZINC000930751075 1041640001 /nfs/dbraw/zinc/64/00/01/1041640001.db2.gz XMBATISQOAAHCB-NSHDSACASA-N 1 2 304.356 4.137 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)co1 ZINC000930751075 1041640005 /nfs/dbraw/zinc/64/00/05/1041640005.db2.gz XMBATISQOAAHCB-NSHDSACASA-N 1 2 304.356 4.137 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccc1F)c1csc(C(F)(F)F)c1 ZINC000925595805 1041660247 /nfs/dbraw/zinc/66/02/47/1041660247.db2.gz CAQZLIVYWDRUBY-MRVPVSSYSA-N 1 2 304.312 4.152 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1ccc(-c2ccccc2)s1 ZINC001133682334 1041689837 /nfs/dbraw/zinc/68/98/37/1041689837.db2.gz UPHULRWXVNCWAK-UHFFFAOYSA-N 1 2 308.406 4.101 20 0 DIADLO COc1ccc(-c2nc(C[N@H+](C)Cc3ccsc3)co2)cc1 ZINC000042753885 1041711802 /nfs/dbraw/zinc/71/18/02/1041711802.db2.gz FJVOUBCFTVFSAE-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1ccc(-c2nc(C[N@@H+](C)Cc3ccsc3)co2)cc1 ZINC000042753885 1041711810 /nfs/dbraw/zinc/71/18/10/1041711810.db2.gz FJVOUBCFTVFSAE-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO CC[C@H](CC(F)F)C[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000660331779 1041718799 /nfs/dbraw/zinc/71/87/99/1041718799.db2.gz XRGLFPFUZCGZPM-IAQYHMDHSA-N 1 2 319.342 4.020 20 0 DIADLO CC[C@H](CC(F)F)C[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000660331779 1041718806 /nfs/dbraw/zinc/71/88/06/1041718806.db2.gz XRGLFPFUZCGZPM-IAQYHMDHSA-N 1 2 319.342 4.020 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1c[nH]c3ccc(Cl)cc13)C2 ZINC001137714285 1041756798 /nfs/dbraw/zinc/75/67/98/1041756798.db2.gz KYIZMDKJXWMGPO-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1c[nH]c3ccc(Cl)cc13)C2 ZINC001137714285 1041756803 /nfs/dbraw/zinc/75/68/03/1041756803.db2.gz KYIZMDKJXWMGPO-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1 ZINC001137996538 1041759943 /nfs/dbraw/zinc/75/99/43/1041759943.db2.gz WDKOXMWAYPUWRS-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1 ZINC001137996538 1041759946 /nfs/dbraw/zinc/75/99/46/1041759946.db2.gz WDKOXMWAYPUWRS-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1nc2cc(CNc3cccc(-c4c[nH+]cn4C)c3)ccc2o1 ZINC001167758757 1041769413 /nfs/dbraw/zinc/76/94/13/1041769413.db2.gz RTWUNOWGHYBWQR-UHFFFAOYSA-N 1 2 318.380 4.149 20 0 DIADLO Fc1ccc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c(Cl)c1Cl ZINC000652064333 1041771267 /nfs/dbraw/zinc/77/12/67/1041771267.db2.gz LKXAWVCNQBRLHK-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1ccc(C[N@H+]2CC[C@]3(CC3(F)F)C2)c(Cl)c1Cl ZINC000652064333 1041771268 /nfs/dbraw/zinc/77/12/68/1041771268.db2.gz LKXAWVCNQBRLHK-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1ccc(Cl)nc1)[C@@H]2C ZINC000781928228 1041773095 /nfs/dbraw/zinc/77/30/95/1041773095.db2.gz VFXWFFDSHUEHAJ-QWHCGFSZSA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1ccc(Cl)nc1)[C@@H]2C ZINC000781928228 1041773099 /nfs/dbraw/zinc/77/30/99/1041773099.db2.gz VFXWFFDSHUEHAJ-QWHCGFSZSA-N 1 2 316.832 4.251 20 0 DIADLO CCCC1CCC([N@H+](C)Cc2nnc(C(F)(F)F)s2)CC1 ZINC000660401899 1041776645 /nfs/dbraw/zinc/77/66/45/1041776645.db2.gz ZYPNSNYZJMCUJV-UHFFFAOYSA-N 1 2 321.412 4.348 20 0 DIADLO CCCC1CCC([N@@H+](C)Cc2nnc(C(F)(F)F)s2)CC1 ZINC000660401899 1041776651 /nfs/dbraw/zinc/77/66/51/1041776651.db2.gz ZYPNSNYZJMCUJV-UHFFFAOYSA-N 1 2 321.412 4.348 20 0 DIADLO C[C@H](Nc1cc[nH+]c2[nH]cc(C(F)(F)F)c21)c1cccc(N)c1 ZINC001170734039 1041792047 /nfs/dbraw/zinc/79/20/47/1041792047.db2.gz YYYHPLLQKKAVQM-VIFPVBQESA-N 1 2 320.318 4.337 20 0 DIADLO C[C@H](Nc1cc[nH+]c(OCc2ccccc2)c1)c1cccc(N)c1 ZINC001170734130 1041792611 /nfs/dbraw/zinc/79/26/11/1041792611.db2.gz PVTHLEMIQXXVJH-HNNXBMFYSA-N 1 2 319.408 4.416 20 0 DIADLO C[C@H](Nc1[nH+]cnc2[nH]cc(F)c21)c1ccccc1C(F)(F)F ZINC001170735616 1041796827 /nfs/dbraw/zinc/79/68/27/1041796827.db2.gz KRXKCYDXEMHFJV-QMMMGPOBSA-N 1 2 324.281 4.289 20 0 DIADLO C[C@H](Nc1ccc2c([nH+]1)CCOC2)c1ccccc1C(F)(F)F ZINC001170737794 1041802887 /nfs/dbraw/zinc/80/28/87/1041802887.db2.gz PJHJXZPKMYEMJT-NSHDSACASA-N 1 2 322.330 4.346 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1coc(-c2cccs2)n1 ZINC000109784363 1041811757 /nfs/dbraw/zinc/81/17/57/1041811757.db2.gz PIMVTNQGLZMTJM-GFCCVEGCSA-N 1 2 314.410 4.302 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1coc(-c2cccs2)n1 ZINC000109784363 1041811762 /nfs/dbraw/zinc/81/17/62/1041811762.db2.gz PIMVTNQGLZMTJM-GFCCVEGCSA-N 1 2 314.410 4.302 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1ncc(-c2cccs2)o1 ZINC000109785588 1041811932 /nfs/dbraw/zinc/81/19/32/1041811932.db2.gz FAWXWHHBRVRNBD-GFCCVEGCSA-N 1 2 314.410 4.302 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ncc(-c2cccs2)o1 ZINC000109785588 1041811939 /nfs/dbraw/zinc/81/19/39/1041811939.db2.gz FAWXWHHBRVRNBD-GFCCVEGCSA-N 1 2 314.410 4.302 20 0 DIADLO C[C@H](OCc1c[nH+]cn1C)c1c(Cl)ccc(F)c1Cl ZINC001222585366 1041822838 /nfs/dbraw/zinc/82/28/38/1041822838.db2.gz HOLXJAKJFPAKTM-QMMMGPOBSA-N 1 2 303.164 4.144 20 0 DIADLO Fc1ccc(SCC[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)c(F)c1 ZINC000660534640 1041828662 /nfs/dbraw/zinc/82/86/62/1041828662.db2.gz GEETUCRNIZCEIM-OAHLLOKOSA-N 1 2 323.412 4.007 20 0 DIADLO Fc1ccc(SCC[N@H+]2CCCC[C@@H]2c2cc[nH]n2)c(F)c1 ZINC000660534640 1041828666 /nfs/dbraw/zinc/82/86/66/1041828666.db2.gz GEETUCRNIZCEIM-OAHLLOKOSA-N 1 2 323.412 4.007 20 0 DIADLO CC/C=C(\C)C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000194645945 1041828747 /nfs/dbraw/zinc/82/87/47/1041828747.db2.gz VBLXTVPPBBNEFX-MKMNVTDBSA-N 1 2 309.413 4.181 20 0 DIADLO Cc1nn(C[N@@H+](C)[C@H](C)C(C)(C)C)c(=S)n1-c1ccccc1 ZINC000026629915 1041842117 /nfs/dbraw/zinc/84/21/17/1041842117.db2.gz MHXCJLMNIKHBJG-CYBMUJFWSA-N 1 2 318.490 4.036 20 0 DIADLO Cc1nn(C[N@H+](C)[C@H](C)C(C)(C)C)c(=S)n1-c1ccccc1 ZINC000026629915 1041842123 /nfs/dbraw/zinc/84/21/23/1041842123.db2.gz MHXCJLMNIKHBJG-CYBMUJFWSA-N 1 2 318.490 4.036 20 0 DIADLO CC(C)CC[N@H+](Cn1nc(-c2ccccc2)[nH]c1=S)C1CC1 ZINC000026626172 1041842721 /nfs/dbraw/zinc/84/27/21/1041842721.db2.gz BJOVBNKEMITONF-UHFFFAOYSA-N 1 2 316.474 4.076 20 0 DIADLO CC(C)CC[N@@H+](Cn1nc(-c2ccccc2)[nH]c1=S)C1CC1 ZINC000026626172 1041842725 /nfs/dbraw/zinc/84/27/25/1041842725.db2.gz BJOVBNKEMITONF-UHFFFAOYSA-N 1 2 316.474 4.076 20 0 DIADLO c1ccc2oc(C[NH2+]Cc3ccccc3OC3CCCC3)nc2c1 ZINC000613755992 1041848498 /nfs/dbraw/zinc/84/84/98/1041848498.db2.gz FOACOBLFFYAAKE-UHFFFAOYSA-N 1 2 322.408 4.439 20 0 DIADLO Cc1cccnc1C[N@@H+](C)[C@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660708249 1041855681 /nfs/dbraw/zinc/85/56/81/1041855681.db2.gz OGKDZKYKAPMHOM-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1cccnc1C[N@H+](C)[C@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660708249 1041855687 /nfs/dbraw/zinc/85/56/87/1041855687.db2.gz OGKDZKYKAPMHOM-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO C[C@H](C[N@H+](C)[C@H](c1nnc[nH]1)c1ccccc1)C1CCCCC1 ZINC000660767894 1041860347 /nfs/dbraw/zinc/86/03/47/1041860347.db2.gz OQHIFVHWHGXBHS-QAPCUYQASA-N 1 2 312.461 4.042 20 0 DIADLO C[C@H](C[N@@H+](C)[C@H](c1nnc[nH]1)c1ccccc1)C1CCCCC1 ZINC000660767894 1041860353 /nfs/dbraw/zinc/86/03/53/1041860353.db2.gz OQHIFVHWHGXBHS-QAPCUYQASA-N 1 2 312.461 4.042 20 0 DIADLO C[C@@H](C[N@H+](C)[C@H](c1nnc[nH]1)c1ccccc1)C1CCCCC1 ZINC000660767896 1041861047 /nfs/dbraw/zinc/86/10/47/1041861047.db2.gz OQHIFVHWHGXBHS-YJBOKZPZSA-N 1 2 312.461 4.042 20 0 DIADLO C[C@@H](C[N@@H+](C)[C@H](c1nnc[nH]1)c1ccccc1)C1CCCCC1 ZINC000660767896 1041861051 /nfs/dbraw/zinc/86/10/51/1041861051.db2.gz OQHIFVHWHGXBHS-YJBOKZPZSA-N 1 2 312.461 4.042 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H]1CCc2c1nccc2Cl ZINC000925719573 1041865403 /nfs/dbraw/zinc/86/54/03/1041865403.db2.gz AHQIRJKBTDHZTC-MRXNPFEDSA-N 1 2 301.821 4.209 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)c(C)o1 ZINC000660923879 1041872476 /nfs/dbraw/zinc/87/24/76/1041872476.db2.gz WKLQVGULNITDAL-UHFFFAOYSA-N 1 2 310.319 4.089 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C3(c4ccc(F)cc4)CCC3)cc2[nH+]1 ZINC000044685901 1041897633 /nfs/dbraw/zinc/89/76/33/1041897633.db2.gz CWCBWUKXEKVCDF-UHFFFAOYSA-N 1 2 323.371 4.071 20 0 DIADLO CCc1nc(C(C)C)ccc1C[N@@H+]1CCC[C@H]1c1cc(C)on1 ZINC000815011649 1041904534 /nfs/dbraw/zinc/90/45/34/1041904534.db2.gz VNBALJOXXUTFBQ-IBGZPJMESA-N 1 2 313.445 4.401 20 0 DIADLO CCc1nc(C(C)C)ccc1C[N@H+]1CCC[C@H]1c1cc(C)on1 ZINC000815011649 1041904537 /nfs/dbraw/zinc/90/45/37/1041904537.db2.gz VNBALJOXXUTFBQ-IBGZPJMESA-N 1 2 313.445 4.401 20 0 DIADLO CCCCCCOc1ccc(C[NH2+]Cc2cc(C)on2)cc1 ZINC000066875426 1041913214 /nfs/dbraw/zinc/91/32/14/1041913214.db2.gz DMSGEDABZKJEPO-UHFFFAOYSA-N 1 2 302.418 4.232 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1sccc1OC ZINC001141329390 1041913574 /nfs/dbraw/zinc/91/35/74/1041913574.db2.gz UVYIFLGQOVEYDH-OAHLLOKOSA-N 1 2 317.454 4.240 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1sccc1OC ZINC001141329390 1041913576 /nfs/dbraw/zinc/91/35/76/1041913576.db2.gz UVYIFLGQOVEYDH-OAHLLOKOSA-N 1 2 317.454 4.240 20 0 DIADLO Fc1ccc(C[NH2+]Cc2c(F)cc(F)cc2F)c(Cl)c1 ZINC000815152556 1041919248 /nfs/dbraw/zinc/91/92/48/1041919248.db2.gz QOJQNGOHDHWBOV-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@H]1CCc2ccc(F)c(Cl)c21 ZINC000651822951 1041925311 /nfs/dbraw/zinc/92/53/11/1041925311.db2.gz PZJSOPAUFLNNDL-MFKMUULPSA-N 1 2 307.800 4.034 20 0 DIADLO Cc1cc(C[NH2+]CC(C)(F)F)cc(C)c1OCc1ccccn1 ZINC000815146511 1041926291 /nfs/dbraw/zinc/92/62/91/1041926291.db2.gz FDQWZWDQFOEOLW-UHFFFAOYSA-N 1 2 320.383 4.022 20 0 DIADLO Clc1ccc(C[N@@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)s1 ZINC000661559617 1041953080 /nfs/dbraw/zinc/95/30/80/1041953080.db2.gz ADSSCLAVENIRPN-HNNXBMFYSA-N 1 2 323.845 4.348 20 0 DIADLO Clc1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)s1 ZINC000661559617 1041953084 /nfs/dbraw/zinc/95/30/84/1041953084.db2.gz ADSSCLAVENIRPN-HNNXBMFYSA-N 1 2 323.845 4.348 20 0 DIADLO Fc1cccc2c1C[N@H+](CCc1ccccc1Br)C2 ZINC001207529933 1041955318 /nfs/dbraw/zinc/95/53/18/1041955318.db2.gz BUJPCIPSYVCJIF-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO Fc1cccc2c1C[N@@H+](CCc1ccccc1Br)C2 ZINC001207529933 1041955323 /nfs/dbraw/zinc/95/53/23/1041955323.db2.gz BUJPCIPSYVCJIF-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1cc(F)ccc1F ZINC000815650207 1041985405 /nfs/dbraw/zinc/98/54/05/1041985405.db2.gz LJYYUZGDBDYOHW-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccc(F)c(F)c1 ZINC000815650319 1041985532 /nfs/dbraw/zinc/98/55/32/1041985532.db2.gz OHPMMKASRXBDFV-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccc(F)cc1F ZINC000815650445 1041985819 /nfs/dbraw/zinc/98/58/19/1041985819.db2.gz RLBKBUGKFOOIOS-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1cc(F)cc(F)c1 ZINC000815650111 1041985878 /nfs/dbraw/zinc/98/58/78/1041985878.db2.gz IUXPDNNZKYACIG-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@H](c1ccccc1)C1CC1 ZINC000124016705 1041998309 /nfs/dbraw/zinc/99/83/09/1041998309.db2.gz OTYQYZHQTKSPPY-LJQANCHMSA-N 1 2 317.392 4.005 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2cccc(OC(F)F)c2)c1 ZINC000652330475 1042009647 /nfs/dbraw/zinc/00/96/47/1042009647.db2.gz HOTRYQAUSYBBGS-LLVKDONJSA-N 1 2 308.328 4.003 20 0 DIADLO CC[C@H](Nc1cc(COC)cc[nH+]1)c1ccc2c(c1)CCCO2 ZINC000652330638 1042009986 /nfs/dbraw/zinc/00/99/86/1042009986.db2.gz LKJDBGHLVWZLRV-KRWDZBQOSA-N 1 2 312.413 4.116 20 0 DIADLO CC[C@@H](Nc1cc(COC)cc[nH+]1)c1cc(C)ccc1OC ZINC000652330443 1042010270 /nfs/dbraw/zinc/01/02/70/1042010270.db2.gz GIBZFZLXCMRBOU-MRXNPFEDSA-N 1 2 300.402 4.108 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CCCOc3c(Cl)cccc32)c1 ZINC000652331111 1042010601 /nfs/dbraw/zinc/01/06/01/1042010601.db2.gz YPNIOFJKLMHQRY-OAHLLOKOSA-N 1 2 318.804 4.207 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CCCOc3c(Cl)cccc32)c1 ZINC000652331110 1042011028 /nfs/dbraw/zinc/01/10/28/1042011028.db2.gz YPNIOFJKLMHQRY-HNNXBMFYSA-N 1 2 318.804 4.207 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CCCOc3cc(Cl)ccc32)c1 ZINC000652331068 1042011367 /nfs/dbraw/zinc/01/13/67/1042011367.db2.gz XCTUJTCNRBSKCG-HNNXBMFYSA-N 1 2 318.804 4.207 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2sc(C(C)C)nc2C)c1 ZINC000652331109 1042011435 /nfs/dbraw/zinc/01/14/35/1042011435.db2.gz YMTCLLOSBCTICX-NSHDSACASA-N 1 2 305.447 4.289 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2sc(C(C)C)nc2C)c1 ZINC000652331108 1042011579 /nfs/dbraw/zinc/01/15/79/1042011579.db2.gz YMTCLLOSBCTICX-LLVKDONJSA-N 1 2 305.447 4.289 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2cc(C)c(OC)c(Cl)c2)c1 ZINC000652330944 1042011691 /nfs/dbraw/zinc/01/16/91/1042011691.db2.gz TUOBXAAXDOFWPI-GFCCVEGCSA-N 1 2 320.820 4.372 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](c2cccnc2)C2CCCCC2)c1 ZINC000652331906 1042013265 /nfs/dbraw/zinc/01/32/65/1042013265.db2.gz XZHVCICLLZNWDD-LJQANCHMSA-N 1 2 311.429 4.357 20 0 DIADLO Cn1ncc(C[N@H+]2CC=C(c3cccc(Cl)c3)CC2)c1Cl ZINC000816595236 1042070182 /nfs/dbraw/zinc/07/01/82/1042070182.db2.gz GDNQONMXIPOLTN-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1ncc(C[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)c1Cl ZINC000816595236 1042070184 /nfs/dbraw/zinc/07/01/84/1042070184.db2.gz GDNQONMXIPOLTN-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cc1ccc(Nc2cc[nH+]c(NC(=O)OC(C)(C)C)c2)cc1O ZINC001211688812 1042070266 /nfs/dbraw/zinc/07/02/66/1042070266.db2.gz YDSIDFCOSGCINC-UHFFFAOYSA-N 1 2 315.373 4.186 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2)[C@@H](C)Cc2ccccc2)no1 ZINC000662154515 1042072818 /nfs/dbraw/zinc/07/28/18/1042072818.db2.gz JQQUGIDCVMCBIW-INIZCTEOSA-N 1 2 321.424 4.011 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2)[C@@H](C)Cc2ccccc2)no1 ZINC000662154515 1042072821 /nfs/dbraw/zinc/07/28/21/1042072821.db2.gz JQQUGIDCVMCBIW-INIZCTEOSA-N 1 2 321.424 4.011 20 0 DIADLO C[C@@H]([NH2+][C@@H](CO)c1ccc(F)cc1F)c1ccccc1Cl ZINC000662163051 1042076539 /nfs/dbraw/zinc/07/65/39/1042076539.db2.gz UMCFZOTYDLMSMY-HWPZZCPQSA-N 1 2 311.759 4.002 20 0 DIADLO CCCCC[C@@H](C)NC(=O)C[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000816840031 1042083748 /nfs/dbraw/zinc/08/37/48/1042083748.db2.gz XSDYJNXDXNYPCC-WBVHZDCISA-N 1 2 313.445 4.017 20 0 DIADLO CCCCC[C@H](C)NC(=O)C[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000816840030 1042084185 /nfs/dbraw/zinc/08/41/85/1042084185.db2.gz XSDYJNXDXNYPCC-RDJZCZTQSA-N 1 2 313.445 4.017 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(Cl)s2)cs1 ZINC000165222996 1042115962 /nfs/dbraw/zinc/11/59/62/1042115962.db2.gz VWFHIAVZYWINSF-DTWKUNHWSA-N 1 2 316.879 4.416 20 0 DIADLO CC(C)[N@H+](Cc1nnc(C(C)(C)C)o1)[C@H](C)c1ccsc1 ZINC000817285695 1042100616 /nfs/dbraw/zinc/10/06/16/1042100616.db2.gz BIMJQPDUUHDVDL-GFCCVEGCSA-N 1 2 307.463 4.400 20 0 DIADLO CC(C)[N@@H+](Cc1nnc(C(C)(C)C)o1)[C@H](C)c1ccsc1 ZINC000817285695 1042100620 /nfs/dbraw/zinc/10/06/20/1042100620.db2.gz BIMJQPDUUHDVDL-GFCCVEGCSA-N 1 2 307.463 4.400 20 0 DIADLO Cc1cc(Cl)cc(Cl)c1CNc1ccc2c([nH+]1)CCOC2 ZINC001167795290 1042102785 /nfs/dbraw/zinc/10/27/85/1042102785.db2.gz CLNNQSVETAXDDD-UHFFFAOYSA-N 1 2 323.223 4.382 20 0 DIADLO OC1CC[NH+](c2ccc(NCc3cccc(C4CC4)c3)cc2)CC1 ZINC000817405967 1042107293 /nfs/dbraw/zinc/10/72/93/1042107293.db2.gz HAYMLJONAXIEPC-UHFFFAOYSA-N 1 2 322.452 4.137 20 0 DIADLO Oc1cccc(C[N@@H+](Cc2csc(C3CC3)n2)CC2CC2)c1 ZINC000161515898 1042110073 /nfs/dbraw/zinc/11/00/73/1042110073.db2.gz SSYBCUDZYWUEQM-UHFFFAOYSA-N 1 2 314.454 4.138 20 0 DIADLO Oc1cccc(C[N@H+](Cc2csc(C3CC3)n2)CC2CC2)c1 ZINC000161515898 1042110076 /nfs/dbraw/zinc/11/00/76/1042110076.db2.gz SSYBCUDZYWUEQM-UHFFFAOYSA-N 1 2 314.454 4.138 20 0 DIADLO O=C(CCCc1cccs1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000161807291 1042116138 /nfs/dbraw/zinc/11/61/38/1042116138.db2.gz LWEAJKHOYMGXBS-UHFFFAOYSA-N 1 2 311.410 4.100 20 0 DIADLO c1cnc2c(c1)CC[C@@H](Nc1ccc([NH+]3CCCC3)cc1)CC2 ZINC000817581619 1042117640 /nfs/dbraw/zinc/11/76/40/1042117640.db2.gz UXXRZOQDPAWDND-QGZVFWFLSA-N 1 2 307.441 4.041 20 0 DIADLO Brc1cnc(C[N@@H+]2CCC[C@@H]3CCCC[C@@H]32)s1 ZINC000662374678 1042118432 /nfs/dbraw/zinc/11/84/32/1042118432.db2.gz LYAYASSVSVDIFD-QWRGUYRKSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1cnc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)s1 ZINC000662374678 1042118435 /nfs/dbraw/zinc/11/84/35/1042118435.db2.gz LYAYASSVSVDIFD-QWRGUYRKSA-N 1 2 315.280 4.060 20 0 DIADLO COc1c[nH+]c(N[C@@H](c2ccccc2)C(F)(F)F)c2[nH]ccc21 ZINC001170883408 1042132662 /nfs/dbraw/zinc/13/26/62/1042132662.db2.gz QXFYHCULIDPYEB-AWEZNQCLSA-N 1 2 321.302 4.287 20 0 DIADLO Cc1oc(-c2ccccc2)nc1CO[NH+]=C(N)c1ccccc1C ZINC000818207859 1042143400 /nfs/dbraw/zinc/14/34/00/1042143400.db2.gz FAVXKEOKLCPBFF-UHFFFAOYSA-N 1 2 321.380 4.005 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2cc(C(C)C)no2)c(Cl)c1 ZINC000818331338 1042148707 /nfs/dbraw/zinc/14/87/07/1042148707.db2.gz FVMXFUURXIJUEE-NSHDSACASA-N 1 2 308.809 4.311 20 0 DIADLO CC(C)c1cc(NCC(F)(F)c2ccccn2)nc(C(C)C)[nH+]1 ZINC001170906450 1042157099 /nfs/dbraw/zinc/15/70/99/1042157099.db2.gz JUZBSENDNLIHEB-UHFFFAOYSA-N 1 2 320.387 4.322 20 0 DIADLO CCCCN(C(=O)c1cccc2[nH+]ccn21)[C@H]1CCC[C@@H](C)C1 ZINC000818809048 1042160410 /nfs/dbraw/zinc/16/04/10/1042160410.db2.gz HWNKTPMFFHQNMC-CVEARBPZSA-N 1 2 313.445 4.155 20 0 DIADLO CCCC[C@H](C)N(CCCC)C(=O)c1cccc2[nH+]ccn21 ZINC000818923801 1042163932 /nfs/dbraw/zinc/16/39/32/1042163932.db2.gz FQFYZYSGLMZLFY-HNNXBMFYSA-N 1 2 301.434 4.155 20 0 DIADLO C[C@H](c1nc2ccccc2n1C(F)F)[N@@H+]1CC[C@H](C(F)F)C1 ZINC000663463834 1042177095 /nfs/dbraw/zinc/17/70/95/1042177095.db2.gz KQXLOVPBBMOQRJ-ZJUUUORDSA-N 1 2 315.314 4.079 20 0 DIADLO C[C@H](c1nc2ccccc2n1C(F)F)[N@H+]1CC[C@H](C(F)F)C1 ZINC000663463834 1042177097 /nfs/dbraw/zinc/17/70/97/1042177097.db2.gz KQXLOVPBBMOQRJ-ZJUUUORDSA-N 1 2 315.314 4.079 20 0 DIADLO COc1cc(OC)cc([C@H](C)Nc2cc(C)c3[nH]ccc3[nH+]2)c1 ZINC001170936057 1042193659 /nfs/dbraw/zinc/19/36/59/1042193659.db2.gz LCFOHSDIEANUFW-LBPRGKRZSA-N 1 2 311.385 4.062 20 0 DIADLO COc1cc(OC)cc([C@H](C)Nc2ccc([NH+](C)C)c(C)c2)c1 ZINC001170936568 1042194920 /nfs/dbraw/zinc/19/49/20/1042194920.db2.gz XJPGPXPVMIYDIJ-AWEZNQCLSA-N 1 2 314.429 4.251 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1nc(C)cs1 ZINC000278910828 1042198251 /nfs/dbraw/zinc/19/82/51/1042198251.db2.gz VXDKAKKLYTWRSN-GFCCVEGCSA-N 1 2 315.364 4.106 20 0 DIADLO CCCc1nc(C[N@H+](Cc2ccc(OC)cc2)C2CC2)cs1 ZINC000043998998 1042209320 /nfs/dbraw/zinc/20/93/20/1042209320.db2.gz OLDJHXUYMMXGOQ-UHFFFAOYSA-N 1 2 316.470 4.269 20 0 DIADLO CCCc1nc(C[N@@H+](Cc2ccc(OC)cc2)C2CC2)cs1 ZINC000043998998 1042209328 /nfs/dbraw/zinc/20/93/28/1042209328.db2.gz OLDJHXUYMMXGOQ-UHFFFAOYSA-N 1 2 316.470 4.269 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](c2ccccc2)[C@@H]2CCCO2)cs1 ZINC001648933404 1042221595 /nfs/dbraw/zinc/22/15/95/1042221595.db2.gz UBCVPMBOETWBMU-IRXDYDNUSA-N 1 2 316.470 4.276 20 0 DIADLO COc1ccc(OC)c([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c1 ZINC000319723002 1042228419 /nfs/dbraw/zinc/22/84/19/1042228419.db2.gz BEKWWFAGEWAZTC-RYUDHWBXSA-N 1 2 321.367 4.394 20 0 DIADLO O=C(Nc1ccc(C2CCC2)cc1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000279006746 1042258326 /nfs/dbraw/zinc/25/83/26/1042258326.db2.gz ULBCLUCOLRBQKA-UHFFFAOYSA-N 1 2 324.428 4.089 20 0 DIADLO FC(F)(F)c1nc(C[NH2+][C@H]2CCCc3sccc32)cs1 ZINC000893640462 1042274575 /nfs/dbraw/zinc/27/45/75/1042274575.db2.gz MECQHQRXJLLIHJ-JTQLQIEISA-N 1 2 318.389 4.391 20 0 DIADLO CC(C)COC(=O)C[N@@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC001170981436 1042277929 /nfs/dbraw/zinc/27/79/29/1042277929.db2.gz RUDYNDRKRSCHEB-LJQANCHMSA-N 1 2 315.457 4.193 20 0 DIADLO CC(C)COC(=O)C[N@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC001170981436 1042277937 /nfs/dbraw/zinc/27/79/37/1042277937.db2.gz RUDYNDRKRSCHEB-LJQANCHMSA-N 1 2 315.457 4.193 20 0 DIADLO C[C@@H]1C[N@H+](CC[C@@H]2CC2(Cl)Cl)C[C@@H](c2ccsc2)O1 ZINC000822686093 1042298105 /nfs/dbraw/zinc/29/81/05/1042298105.db2.gz OCNCMXAOYLRVHS-RTXFEEFZSA-N 1 2 320.285 4.094 20 0 DIADLO C[C@@H]1C[N@@H+](CC[C@@H]2CC2(Cl)Cl)C[C@@H](c2ccsc2)O1 ZINC000822686093 1042298106 /nfs/dbraw/zinc/29/81/06/1042298106.db2.gz OCNCMXAOYLRVHS-RTXFEEFZSA-N 1 2 320.285 4.094 20 0 DIADLO CCCCC[C@H]([NH2+]Cc1nc(C(F)F)no1)c1ccccc1 ZINC000822818093 1042301798 /nfs/dbraw/zinc/30/17/98/1042301798.db2.gz JPUPJIISZCTIEO-ZDUSSCGKSA-N 1 2 309.360 4.418 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1cnc(C(C)(C)C)s1 ZINC000059181058 1042303919 /nfs/dbraw/zinc/30/39/19/1042303919.db2.gz BSYDUPGBNBXODN-UHFFFAOYSA-N 1 2 303.475 4.427 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)cn1 ZINC000163214691 1042308972 /nfs/dbraw/zinc/30/89/72/1042308972.db2.gz GBMOMXWAYFTIOE-BEFAXECRSA-N 1 2 309.413 4.497 20 0 DIADLO Cc1cc(NC(=O)c2ccc(Oc3ccccc3)cc2)cc[nH+]1 ZINC000010163045 1042318619 /nfs/dbraw/zinc/31/86/19/1042318619.db2.gz DARVTYQHJSOIRO-UHFFFAOYSA-N 1 2 304.349 4.435 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H](C)Cc3ccco3)c2)[nH+]c1C ZINC000823352078 1042322608 /nfs/dbraw/zinc/32/26/08/1042322608.db2.gz DMRHSLSOUPBNHL-GFCCVEGCSA-N 1 2 323.396 4.104 20 0 DIADLO Fc1c(C[N@@H+]2CCCCC[C@H]2c2ccncc2)ccnc1Cl ZINC000823375327 1042322790 /nfs/dbraw/zinc/32/27/90/1042322790.db2.gz LSCASNGDIYQFAS-HNNXBMFYSA-N 1 2 319.811 4.386 20 0 DIADLO Fc1c(C[N@H+]2CCCCC[C@H]2c2ccncc2)ccnc1Cl ZINC000823375327 1042322798 /nfs/dbraw/zinc/32/27/98/1042322798.db2.gz LSCASNGDIYQFAS-HNNXBMFYSA-N 1 2 319.811 4.386 20 0 DIADLO C[N@H+](Cc1ccc(C(F)(F)F)cc1)Cc1cc(F)ncc1F ZINC000823371878 1042323113 /nfs/dbraw/zinc/32/31/13/1042323113.db2.gz OQZSMVDMYCGDEL-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cc1cc(F)ncc1F ZINC000823371878 1042323120 /nfs/dbraw/zinc/32/31/20/1042323120.db2.gz OQZSMVDMYCGDEL-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc3cc(Cl)cnc3o2)no1 ZINC000823404124 1042323305 /nfs/dbraw/zinc/32/33/05/1042323305.db2.gz MFYRQOULRWNLDB-HNNXBMFYSA-N 1 2 317.776 4.115 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc3cc(Cl)cnc3o2)no1 ZINC000823404124 1042323310 /nfs/dbraw/zinc/32/33/10/1042323310.db2.gz MFYRQOULRWNLDB-HNNXBMFYSA-N 1 2 317.776 4.115 20 0 DIADLO Cc1cccc2nc(C[N@H+](Cc3ccccc3F)C(C)C)cn21 ZINC000337492171 1042323482 /nfs/dbraw/zinc/32/34/82/1042323482.db2.gz ARIBIPHJKPNMQO-UHFFFAOYSA-N 1 2 311.404 4.192 20 0 DIADLO Cc1cccc2nc(C[N@@H+](Cc3ccccc3F)C(C)C)cn21 ZINC000337492171 1042323487 /nfs/dbraw/zinc/32/34/87/1042323487.db2.gz ARIBIPHJKPNMQO-UHFFFAOYSA-N 1 2 311.404 4.192 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccnc(Cl)c1F ZINC000823432347 1042325656 /nfs/dbraw/zinc/32/56/56/1042325656.db2.gz FZUUOEAOORRZFN-CQSZACIVSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1ccnc(Cl)c1F ZINC000823432347 1042325662 /nfs/dbraw/zinc/32/56/62/1042325662.db2.gz FZUUOEAOORRZFN-CQSZACIVSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2ccnn2C(C)C)c2ccccn2)cc1 ZINC000279604604 1042325745 /nfs/dbraw/zinc/32/57/45/1042325745.db2.gz DXDYWEXZYQKMAD-HXUWFJFHSA-N 1 2 320.440 4.047 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2cc(F)ncc2F)C1 ZINC000823459175 1042326715 /nfs/dbraw/zinc/32/67/15/1042326715.db2.gz RCTIHAIUJFEMNR-ZBEGNZNMSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2cc(F)ncc2F)C1 ZINC000823459175 1042326723 /nfs/dbraw/zinc/32/67/23/1042326723.db2.gz RCTIHAIUJFEMNR-ZBEGNZNMSA-N 1 2 306.331 4.082 20 0 DIADLO Clc1cc(C[NH+]2CCC(n3cccn3)CC2)c(Cl)s1 ZINC000823423663 1042327795 /nfs/dbraw/zinc/32/77/95/1042327795.db2.gz MZPHDQNFAWOBBS-UHFFFAOYSA-N 1 2 316.257 4.089 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccc(Cl)cc2Cl)s1 ZINC000230706918 1042329873 /nfs/dbraw/zinc/32/98/73/1042329873.db2.gz QAMQZUORHXFGJM-UHFFFAOYSA-N 1 2 301.242 4.302 20 0 DIADLO CC(C)n1ncnc1C[NH2+][C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000279662599 1042330231 /nfs/dbraw/zinc/33/02/31/1042330231.db2.gz DBMMJMPXDCALOA-INIZCTEOSA-N 1 2 322.403 4.014 20 0 DIADLO C[NH+](C)c1ccc(NC2CCC(OC3CCCC3)CC2)cc1 ZINC000823529168 1042330273 /nfs/dbraw/zinc/33/02/73/1042330273.db2.gz GANVNNFARYWELX-UHFFFAOYSA-N 1 2 302.462 4.435 20 0 DIADLO CN(C)c1ccc([NH2+]C2CCC(OC3CCCC3)CC2)cc1 ZINC000823529168 1042330275 /nfs/dbraw/zinc/33/02/75/1042330275.db2.gz GANVNNFARYWELX-UHFFFAOYSA-N 1 2 302.462 4.435 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1ccc2sccc2c1 ZINC000348574206 1042333209 /nfs/dbraw/zinc/33/32/09/1042333209.db2.gz GDQZAFOKTDSAJU-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1csc(C)n1)c1ccc(Cl)cc1 ZINC000279823523 1042344447 /nfs/dbraw/zinc/34/44/47/1042344447.db2.gz YJPBCXBCCAYXTJ-IINYFYTJSA-N 1 2 310.850 4.143 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1csc(C)n1)c1ccc(Cl)cc1 ZINC000279823528 1042345105 /nfs/dbraw/zinc/34/51/05/1042345105.db2.gz YJPBCXBCCAYXTJ-YGRLFVJLSA-N 1 2 310.850 4.143 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C1CCC(F)(F)CC1 ZINC000279884287 1042348976 /nfs/dbraw/zinc/34/89/76/1042348976.db2.gz DRKGIHZQSWEWDB-UHFFFAOYSA-N 1 2 319.355 4.149 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(OC(C)C)cc2)s1 ZINC000274275195 1042351728 /nfs/dbraw/zinc/35/17/28/1042351728.db2.gz XLPSDFAAGXZTJG-VXGBXAGGSA-N 1 2 305.447 4.046 20 0 DIADLO Brc1cnc(C[N@@H+]2CCCC[C@@H]2C2CCC2)s1 ZINC000646139853 1042352766 /nfs/dbraw/zinc/35/27/66/1042352766.db2.gz DXPIXSYTUKQAHO-LLVKDONJSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1cnc(C[N@H+]2CCCC[C@@H]2C2CCC2)s1 ZINC000646139853 1042352768 /nfs/dbraw/zinc/35/27/68/1042352768.db2.gz DXPIXSYTUKQAHO-LLVKDONJSA-N 1 2 315.280 4.060 20 0 DIADLO FC(F)(F)c1nn(C[C@@H]2CCCCC2(F)F)c2cc[nH+]cc21 ZINC000418941023 1042365960 /nfs/dbraw/zinc/36/59/60/1042365960.db2.gz UPJHKMIPSMRTKQ-VIFPVBQESA-N 1 2 319.277 4.276 20 0 DIADLO Fc1ccc(OC(F)(F)F)cc1C[N@H+]1CCCC[C@@H](F)C1 ZINC001143538882 1042391929 /nfs/dbraw/zinc/39/19/29/1042391929.db2.gz VNNDDAFXVZUMEU-LLVKDONJSA-N 1 2 309.278 4.048 20 0 DIADLO Fc1ccc(OC(F)(F)F)cc1C[N@@H+]1CCCC[C@@H](F)C1 ZINC001143538882 1042391931 /nfs/dbraw/zinc/39/19/31/1042391931.db2.gz VNNDDAFXVZUMEU-LLVKDONJSA-N 1 2 309.278 4.048 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)n1 ZINC000893940284 1042396693 /nfs/dbraw/zinc/39/66/93/1042396693.db2.gz HFPWSILOWHDWFV-JTQLQIEISA-N 1 2 304.356 4.135 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)n1 ZINC000893940284 1042396699 /nfs/dbraw/zinc/39/66/99/1042396699.db2.gz HFPWSILOWHDWFV-JTQLQIEISA-N 1 2 304.356 4.135 20 0 DIADLO Cc1coc(C[NH+]2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 ZINC000893969017 1042399375 /nfs/dbraw/zinc/39/93/75/1042399375.db2.gz HTLFSBVBJHCSQX-UWVGGRQHSA-N 1 2 315.257 4.151 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2ocnc2C)s1 ZINC000893977576 1042399834 /nfs/dbraw/zinc/39/98/34/1042399834.db2.gz FZZQAWYXACBMKN-UHFFFAOYSA-N 1 2 302.399 4.148 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2ocnc2C)s1 ZINC000893977576 1042399837 /nfs/dbraw/zinc/39/98/37/1042399837.db2.gz FZZQAWYXACBMKN-UHFFFAOYSA-N 1 2 302.399 4.148 20 0 DIADLO Cc1coc(C[N@H+]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 ZINC000893969015 1042399887 /nfs/dbraw/zinc/39/98/87/1042399887.db2.gz HTLFSBVBJHCSQX-AOOOYVTPSA-N 1 2 315.257 4.151 20 0 DIADLO Cc1coc(C[N@@H+]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 ZINC000893969015 1042399889 /nfs/dbraw/zinc/39/98/89/1042399889.db2.gz HTLFSBVBJHCSQX-AOOOYVTPSA-N 1 2 315.257 4.151 20 0 DIADLO Cc1cc(N2CC(C)(C)[C@H]2c2ccncc2)nc(C2CCC2)[nH+]1 ZINC000893971621 1042399928 /nfs/dbraw/zinc/39/99/28/1042399928.db2.gz VSGKJPCJEDIQPQ-QGZVFWFLSA-N 1 2 308.429 4.035 20 0 DIADLO CCc1nnc([C@H](C)[NH2+]Cc2ccc(-c3ccc(CC)cc3)o2)[nH]1 ZINC000534236331 1042399980 /nfs/dbraw/zinc/39/99/80/1042399980.db2.gz SUFNGIHPECRQIA-ZDUSSCGKSA-N 1 2 324.428 4.040 20 0 DIADLO Oc1cccc2sc(C[N@@H+]3CCCC[C@H]3c3ncc[nH]3)cc21 ZINC000893986802 1042400691 /nfs/dbraw/zinc/40/06/91/1042400691.db2.gz MQABREUALCDPBU-AWEZNQCLSA-N 1 2 313.426 4.057 20 0 DIADLO Oc1cccc2sc(C[N@H+]3CCCC[C@H]3c3ncc[nH]3)cc21 ZINC000893986802 1042400695 /nfs/dbraw/zinc/40/06/95/1042400695.db2.gz MQABREUALCDPBU-AWEZNQCLSA-N 1 2 313.426 4.057 20 0 DIADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+]Cc1nccn1C1CC1 ZINC000894062362 1042405947 /nfs/dbraw/zinc/40/59/47/1042405947.db2.gz WCEXYHKFEGIABD-OAHLLOKOSA-N 1 2 323.362 4.310 20 0 DIADLO COc1ccc(Nc2cc[nH+]c3cc(Cl)ccc23)c(CO)c1 ZINC001211739814 1042411698 /nfs/dbraw/zinc/41/16/98/1042411698.db2.gz CSGHNMIMKNDBRB-UHFFFAOYSA-N 1 2 314.772 4.133 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@H](C)c2csc(C(C)C)n2)c1 ZINC000645158706 1042447731 /nfs/dbraw/zinc/44/77/31/1042447731.db2.gz PJQWYIYMJHHBCX-LLVKDONJSA-N 1 2 308.422 4.265 20 0 DIADLO CCOc1cc(F)c(F)cc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001211801013 1042454233 /nfs/dbraw/zinc/45/42/33/1042454233.db2.gz PIIYSKAOKGGVPS-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO c1sc(C2CCCC2)nc1C[NH+]1CCC(OC2CCC2)CC1 ZINC000419284209 1042460839 /nfs/dbraw/zinc/46/08/39/1042460839.db2.gz KRIHHHZNDIWLNA-UHFFFAOYSA-N 1 2 320.502 4.334 20 0 DIADLO CC[N@H+](Cc1csc(C(C)C)n1)Cc1ccc(OC)cc1 ZINC000052039731 1042462787 /nfs/dbraw/zinc/46/27/87/1042462787.db2.gz XEMOVYVFWOMUJI-UHFFFAOYSA-N 1 2 304.459 4.297 20 0 DIADLO CC[N@@H+](Cc1csc(C(C)C)n1)Cc1ccc(OC)cc1 ZINC000052039731 1042462790 /nfs/dbraw/zinc/46/27/90/1042462790.db2.gz XEMOVYVFWOMUJI-UHFFFAOYSA-N 1 2 304.459 4.297 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc([C@@H](C)C(F)(F)F)cc1)c1csnn1 ZINC000412035900 1042465537 /nfs/dbraw/zinc/46/55/37/1042465537.db2.gz HPMPADIVZHAEIH-NXEZZACHSA-N 1 2 315.364 4.055 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+](C)[C@H](C)c2ccccc2F)c(C)c1 ZINC000052074436 1042467218 /nfs/dbraw/zinc/46/72/18/1042467218.db2.gz AVWASAZUMDZPMC-OAHLLOKOSA-N 1 2 314.404 4.074 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+](C)[C@H](C)c2ccccc2F)c(C)c1 ZINC000052074436 1042467222 /nfs/dbraw/zinc/46/72/22/1042467222.db2.gz AVWASAZUMDZPMC-OAHLLOKOSA-N 1 2 314.404 4.074 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc(C3CC3)cc2)s1 ZINC000419325260 1042469159 /nfs/dbraw/zinc/46/91/59/1042469159.db2.gz AYMODACBLHGHSP-LBPRGKRZSA-N 1 2 301.459 4.390 20 0 DIADLO S=c1oc(-c2ccccc2)nn1C[N@H+](C1CC1)C1CCCC1 ZINC000024656145 1042480308 /nfs/dbraw/zinc/48/03/08/1042480308.db2.gz VYRSJTMAYYZCEX-UHFFFAOYSA-N 1 2 315.442 4.237 20 0 DIADLO S=c1oc(-c2ccccc2)nn1C[N@@H+](C1CC1)C1CCCC1 ZINC000024656145 1042480310 /nfs/dbraw/zinc/48/03/10/1042480310.db2.gz VYRSJTMAYYZCEX-UHFFFAOYSA-N 1 2 315.442 4.237 20 0 DIADLO c1ccc(C2(c3noc([C@H]4CC[N@@H+]4C4CCCC4)n3)CCC2)cc1 ZINC000923971660 1042499626 /nfs/dbraw/zinc/49/96/26/1042499626.db2.gz QYPFQLOTYNRTME-QGZVFWFLSA-N 1 2 323.440 4.229 20 0 DIADLO c1ccc(C2(c3noc([C@H]4CC[N@H+]4C4CCCC4)n3)CCC2)cc1 ZINC000923971660 1042499628 /nfs/dbraw/zinc/49/96/28/1042499628.db2.gz QYPFQLOTYNRTME-QGZVFWFLSA-N 1 2 323.440 4.229 20 0 DIADLO CCOc1ccc([C@H]([NH2+]Cc2ocnc2C)c2ccccc2)cc1 ZINC000894196854 1042500117 /nfs/dbraw/zinc/50/01/17/1042500117.db2.gz FYMZPKBXYYUREJ-HXUWFJFHSA-N 1 2 322.408 4.261 20 0 DIADLO CCCCc1ccc([C@H]([NH2+]Cc2noc(C)n2)C(C)C)cc1 ZINC000120646856 1042501012 /nfs/dbraw/zinc/50/10/12/1042501012.db2.gz PELVZWMWIJFJGU-GOSISDBHSA-N 1 2 301.434 4.208 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1ccccc1OC(F)F ZINC000237100717 1042524391 /nfs/dbraw/zinc/52/43/91/1042524391.db2.gz UOBKQCVEDXOUME-UHFFFAOYSA-N 1 2 306.356 4.275 20 0 DIADLO CCn1c(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)nc2ccccc21 ZINC000071006114 1042536295 /nfs/dbraw/zinc/53/62/95/1042536295.db2.gz XOEBKIFSUWJYII-ZFWWWQNUSA-N 1 2 309.413 4.062 20 0 DIADLO Fc1ccc(/C=C/C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000513387225 1042537367 /nfs/dbraw/zinc/53/73/67/1042537367.db2.gz XKMIYHCHZGGJRF-QPJJXVBHSA-N 1 2 321.399 4.264 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000513387225 1042537370 /nfs/dbraw/zinc/53/73/70/1042537370.db2.gz XKMIYHCHZGGJRF-QPJJXVBHSA-N 1 2 321.399 4.264 20 0 DIADLO CCOc1cccc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)c1 ZINC000513414040 1042540506 /nfs/dbraw/zinc/54/05/06/1042540506.db2.gz BWOACRMCXMWIEQ-UHFFFAOYSA-N 1 2 321.424 4.011 20 0 DIADLO CCOc1cccc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)c1 ZINC000513414040 1042540511 /nfs/dbraw/zinc/54/05/11/1042540511.db2.gz BWOACRMCXMWIEQ-UHFFFAOYSA-N 1 2 321.424 4.011 20 0 DIADLO Cc1cnc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)cn1 ZINC000513478212 1042545816 /nfs/dbraw/zinc/54/58/16/1042545816.db2.gz BYEUWWSFKLXLET-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)cn1 ZINC000513478212 1042545821 /nfs/dbraw/zinc/54/58/21/1042545821.db2.gz BYEUWWSFKLXLET-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO Cc1ccc2nc(C[NH2+]Cc3cc(Cl)ccc3Cl)cn2c1 ZINC000513540182 1042551593 /nfs/dbraw/zinc/55/15/93/1042551593.db2.gz VGEBAAMBKHVKTM-UHFFFAOYSA-N 1 2 320.223 4.239 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2ccsc2Br)s1 ZINC000388742513 1042554793 /nfs/dbraw/zinc/55/47/93/1042554793.db2.gz KNOCSEOCFCFNIZ-QMMMGPOBSA-N 1 2 317.277 4.126 20 0 DIADLO COC1(CCSCc2ccc(-n3cc[nH+]c3)cc2)CCC1 ZINC000419466883 1042584821 /nfs/dbraw/zinc/58/48/21/1042584821.db2.gz RNCIDHNYHFWFGZ-UHFFFAOYSA-N 1 2 302.443 4.065 20 0 DIADLO CCc1nc(C2([NH2+]Cc3cc(C)c(C)cc3C)CCCC2)no1 ZINC000237026164 1042590975 /nfs/dbraw/zinc/59/09/75/1042590975.db2.gz GYADNUBPSZDQHT-UHFFFAOYSA-N 1 2 313.445 4.116 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)no1 ZINC000420947920 1042616464 /nfs/dbraw/zinc/61/64/64/1042616464.db2.gz NKDLOBBXVVZNLZ-LLVKDONJSA-N 1 2 304.356 4.137 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)no1 ZINC000420947920 1042616471 /nfs/dbraw/zinc/61/64/71/1042616471.db2.gz NKDLOBBXVVZNLZ-LLVKDONJSA-N 1 2 304.356 4.137 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)n1 ZINC000420956424 1042617858 /nfs/dbraw/zinc/61/78/58/1042617858.db2.gz YEQWPJDNDJFURZ-RYUDHWBXSA-N 1 2 319.371 4.138 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+]2CCC[C@@H](CC(F)(F)F)C2)n1 ZINC000420956424 1042617860 /nfs/dbraw/zinc/61/78/60/1042617860.db2.gz YEQWPJDNDJFURZ-RYUDHWBXSA-N 1 2 319.371 4.138 20 0 DIADLO CC(C)(C)c1cc(C[NH2+][C@@H](CC(F)F)c2ccccc2)no1 ZINC000420998918 1042620483 /nfs/dbraw/zinc/62/04/83/1042620483.db2.gz UPZCDUXRPFKLMH-AWEZNQCLSA-N 1 2 308.372 4.458 20 0 DIADLO CCO[C@@H](C)c1noc(C[N@H+](C(C)C)[C@H](C)c2ccsc2)n1 ZINC000421004878 1042620646 /nfs/dbraw/zinc/62/06/46/1042620646.db2.gz ITJNAJYDWCNFNB-OLZOCXBDSA-N 1 2 323.462 4.200 20 0 DIADLO CCO[C@@H](C)c1noc(C[N@@H+](C(C)C)[C@H](C)c2ccsc2)n1 ZINC000421004878 1042620648 /nfs/dbraw/zinc/62/06/48/1042620648.db2.gz ITJNAJYDWCNFNB-OLZOCXBDSA-N 1 2 323.462 4.200 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc(C(F)(F)F)cc2)cc(C)[nH+]1 ZINC000421032632 1042622093 /nfs/dbraw/zinc/62/20/93/1042622093.db2.gz HTPXHQKTYXDICW-UHFFFAOYSA-N 1 2 323.318 4.039 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H](C)c2ccc3c(c2)CCCC3)nn1C ZINC000421335532 1042631678 /nfs/dbraw/zinc/63/16/78/1042631678.db2.gz SRDISTOWXKIZRD-LBPRGKRZSA-N 1 2 317.864 4.112 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H](c2ccc(F)cc2)C(C)C)nn1C ZINC000421335238 1042631808 /nfs/dbraw/zinc/63/18/08/1042631808.db2.gz RXKCURHYATVWSM-MRXNPFEDSA-N 1 2 309.816 4.008 20 0 DIADLO CC(C)[N@H+](Cc1cn(C(C)(C)C)nn1)[C@H](C)c1ccsc1 ZINC000421369612 1042633115 /nfs/dbraw/zinc/63/31/15/1042633115.db2.gz IKYZWCATGGTDEA-CYBMUJFWSA-N 1 2 306.479 4.066 20 0 DIADLO CC(C)[N@@H+](Cc1cn(C(C)(C)C)nn1)[C@H](C)c1ccsc1 ZINC000421369612 1042633116 /nfs/dbraw/zinc/63/31/16/1042633116.db2.gz IKYZWCATGGTDEA-CYBMUJFWSA-N 1 2 306.479 4.066 20 0 DIADLO Cc1cc(C[NH2+][C@@H](CCc2ccccc2)C(F)F)cc(C)n1 ZINC000421385553 1042635409 /nfs/dbraw/zinc/63/54/09/1042635409.db2.gz QELSUOZPBOEIJU-KRWDZBQOSA-N 1 2 304.384 4.055 20 0 DIADLO O[C@H]1CC[N@H+](Cc2ccc(F)c(Cl)c2Cl)C2(CCC2)C1 ZINC000421410917 1042637160 /nfs/dbraw/zinc/63/71/60/1042637160.db2.gz PTPGLHQJTHKHCB-NSHDSACASA-N 1 2 318.219 4.012 20 0 DIADLO O[C@H]1CC[N@@H+](Cc2ccc(F)c(Cl)c2Cl)C2(CCC2)C1 ZINC000421410917 1042637162 /nfs/dbraw/zinc/63/71/62/1042637162.db2.gz PTPGLHQJTHKHCB-NSHDSACASA-N 1 2 318.219 4.012 20 0 DIADLO CC(C)n1cc(C(C)(C)[NH2+]Cc2ccc(-c3ccccc3)o2)nn1 ZINC000421406153 1042637491 /nfs/dbraw/zinc/63/74/91/1042637491.db2.gz SRYAWMAFUIJAOL-UHFFFAOYSA-N 1 2 324.428 4.144 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@@H](C)c1ccc(SC(C)C)cc1 ZINC000924938660 1042653424 /nfs/dbraw/zinc/65/34/24/1042653424.db2.gz NRRMMLRYYAACBJ-RYUDHWBXSA-N 1 2 305.447 4.290 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@@H](C)c1ccc(SC(C)C)cc1 ZINC000924938659 1042653372 /nfs/dbraw/zinc/65/33/72/1042653372.db2.gz NRRMMLRYYAACBJ-NWDGAFQWSA-N 1 2 305.447 4.290 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@H](C)c1ccc(SC(C)C)cc1 ZINC000924938661 1042653946 /nfs/dbraw/zinc/65/39/46/1042653946.db2.gz NRRMMLRYYAACBJ-VXGBXAGGSA-N 1 2 305.447 4.290 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2ccc(Cl)cc2OC)s1 ZINC000421832355 1042655088 /nfs/dbraw/zinc/65/50/88/1042655088.db2.gz MKOWCZLYFKLXDG-JTQLQIEISA-N 1 2 310.850 4.218 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccncc1Cl ZINC000421834682 1042655410 /nfs/dbraw/zinc/65/54/10/1042655410.db2.gz CRLMHFNFZOCCOL-CYBMUJFWSA-N 1 2 316.836 4.293 20 0 DIADLO CCCc1ncc(C[NH2+][C@H](C)c2ccc(Cl)cc2OC)o1 ZINC000421860872 1042658066 /nfs/dbraw/zinc/65/80/66/1042658066.db2.gz UPIDWLIEYNHMOV-LLVKDONJSA-N 1 2 308.809 4.140 20 0 DIADLO CCCc1ncc(C[NH2+][C@@H](C)c2ccc(Cl)cc2OC)o1 ZINC000421860873 1042658253 /nfs/dbraw/zinc/65/82/53/1042658253.db2.gz UPIDWLIEYNHMOV-NSHDSACASA-N 1 2 308.809 4.140 20 0 DIADLO CC[C@H]([NH2+]Cc1nc([C@H](C)OCC(C)C)no1)c1ccccc1 ZINC000271701108 1042666153 /nfs/dbraw/zinc/66/61/53/1042666153.db2.gz SNGJKOSZXYIBDV-HOCLYGCPSA-N 1 2 317.433 4.044 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1cccc(-n2cccn2)c1 ZINC000271751915 1042666975 /nfs/dbraw/zinc/66/69/75/1042666975.db2.gz GAAPFXXENFHJBH-CQSZACIVSA-N 1 2 324.428 4.009 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(OC(F)F)cc1 ZINC000271750386 1042667391 /nfs/dbraw/zinc/66/73/91/1042667391.db2.gz KMZKDWGCUIYVQQ-LLVKDONJSA-N 1 2 324.371 4.424 20 0 DIADLO c1cn2c(cccc2CNc2ccc(COC3CCCC3)cc2)[nH+]1 ZINC000271809053 1042668857 /nfs/dbraw/zinc/66/88/57/1042668857.db2.gz IYDLSTXFVDAOCW-UHFFFAOYSA-N 1 2 321.424 4.406 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(Br)cc1 ZINC000271838903 1042670366 /nfs/dbraw/zinc/67/03/66/1042670366.db2.gz UEVDJINGKDIUQD-JTQLQIEISA-N 1 2 321.218 4.165 20 0 DIADLO Cc1noc(C[NH2+][C@H](c2cccc(Cl)c2)C2CCCC2)n1 ZINC000271841311 1042670402 /nfs/dbraw/zinc/67/04/02/1042670402.db2.gz ZCWSUDVLLZNQFA-INIZCTEOSA-N 1 2 305.809 4.053 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)[nH]1 ZINC000271881145 1042671772 /nfs/dbraw/zinc/67/17/72/1042671772.db2.gz PMHBREMCNUMRCN-ZJUUUORDSA-N 1 2 318.808 4.179 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2oc3ccccc3c2CC)[nH]1 ZINC000271896544 1042672144 /nfs/dbraw/zinc/67/21/44/1042672144.db2.gz UKTQUNWCIODADU-VXGBXAGGSA-N 1 2 312.417 4.088 20 0 DIADLO CCC[C@@H]([NH2+][C@@H]1COCc2cccc(Cl)c21)c1ccccn1 ZINC000924946113 1042677731 /nfs/dbraw/zinc/67/77/31/1042677731.db2.gz LKPVLZYIBUTFIN-IAGOWNOFSA-N 1 2 316.832 4.437 20 0 DIADLO CCC[C@H]([NH2+][C@H]1COCc2cccc(Cl)c21)c1ccccn1 ZINC000924946114 1042678026 /nfs/dbraw/zinc/67/80/26/1042678026.db2.gz LKPVLZYIBUTFIN-IRXDYDNUSA-N 1 2 316.832 4.437 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc2oc(C(F)(F)F)nc2c1 ZINC000424139096 1042727032 /nfs/dbraw/zinc/72/70/32/1042727032.db2.gz DDMVMWJBKFZERI-UHFFFAOYSA-N 1 2 324.306 4.236 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cc(F)ccc1OCC1CC1 ZINC000424169701 1042728271 /nfs/dbraw/zinc/72/82/71/1042728271.db2.gz ALJGDFVSWVXBGT-UHFFFAOYSA-N 1 2 303.381 4.004 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2cncn2C(C)C)c2ccccn2)c1 ZINC000424162852 1042728407 /nfs/dbraw/zinc/72/84/07/1042728407.db2.gz UJFOZNGGYQYOIH-HXUWFJFHSA-N 1 2 320.440 4.047 20 0 DIADLO CC[C@H]([NH2+]Cc1occc1C)c1nc(C(F)(F)F)cs1 ZINC000072926814 1042741475 /nfs/dbraw/zinc/74/14/75/1042741475.db2.gz LRCJVPFDKFNWOQ-VIFPVBQESA-N 1 2 304.337 4.304 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cccc(OC)n1 ZINC000924971079 1042741998 /nfs/dbraw/zinc/74/19/98/1042741998.db2.gz WMDACMLCCILWLG-GFCCVEGCSA-N 1 2 319.474 4.085 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cccc(OC)n1 ZINC000924971085 1042742237 /nfs/dbraw/zinc/74/22/37/1042742237.db2.gz WMDACMLCCILWLG-LBPRGKRZSA-N 1 2 319.474 4.085 20 0 DIADLO Cc1cn[nH]c1C[NH+]1CCC(c2ccc(Cl)cc2Cl)CC1 ZINC000430080217 1042779667 /nfs/dbraw/zinc/77/96/67/1042779667.db2.gz BGYFDGVIYBPZPT-UHFFFAOYSA-N 1 2 324.255 4.405 20 0 DIADLO COc1ccc2oc([C@@H](C)[NH2+][C@H](C)c3ncco3)c(C)c2c1 ZINC000924985874 1042782750 /nfs/dbraw/zinc/78/27/50/1042782750.db2.gz GGFFUIPQZDCCCX-VXGBXAGGSA-N 1 2 300.358 4.150 20 0 DIADLO CC(C)c1ccc(-n2ccnc2SCc2cc[nH+]c(N)c2)cc1 ZINC000430135541 1042788221 /nfs/dbraw/zinc/78/82/21/1042788221.db2.gz QXKZMCOCZQOKMI-UHFFFAOYSA-N 1 2 324.453 4.265 20 0 DIADLO CCCN(C(=O)C[C@H](C)n1cc[nH+]c1)[C@@H](CC)c1ccccc1 ZINC000514791678 1042791397 /nfs/dbraw/zinc/79/13/97/1042791397.db2.gz BOVZQPLUJIWNJQ-WMZOPIPTSA-N 1 2 313.445 4.224 20 0 DIADLO CC(C)n1c[nH+]cc1CN(C)[C@@H](c1ccccc1)C(F)(F)F ZINC000425330454 1042791761 /nfs/dbraw/zinc/79/17/61/1042791761.db2.gz VSUCVJRMYCBYMR-HNNXBMFYSA-N 1 2 311.351 4.199 20 0 DIADLO Cc1cccc([C@@H]2CCCCC[N@@H+]2Cc2nc(C(F)F)no2)c1 ZINC000425407384 1042814317 /nfs/dbraw/zinc/81/43/17/1042814317.db2.gz RGICNLWAWNSQQQ-AWEZNQCLSA-N 1 2 321.371 4.433 20 0 DIADLO Cc1cccc([C@@H]2CCCCC[N@H+]2Cc2nc(C(F)F)no2)c1 ZINC000425407384 1042814323 /nfs/dbraw/zinc/81/43/23/1042814323.db2.gz RGICNLWAWNSQQQ-AWEZNQCLSA-N 1 2 321.371 4.433 20 0 DIADLO COc1cc(C)ccc1[C@@H](C)[NH2+][C@H](C)c1c(F)cncc1F ZINC000515390589 1042816874 /nfs/dbraw/zinc/81/68/74/1042816874.db2.gz HBQJDAIMNGWQOT-VXGBXAGGSA-N 1 2 306.356 4.089 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](Cc1noc(C2CC2)n1)C1CCCC1 ZINC000425464514 1042827118 /nfs/dbraw/zinc/82/71/18/1042827118.db2.gz ZKYHHWMWLXDEHK-AWEZNQCLSA-N 1 2 311.429 4.453 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](Cc1noc(C2CC2)n1)C1CCCC1 ZINC000425464514 1042827125 /nfs/dbraw/zinc/82/71/25/1042827125.db2.gz ZKYHHWMWLXDEHK-AWEZNQCLSA-N 1 2 311.429 4.453 20 0 DIADLO COc1ccc([C@@H]([NH2+]CCF)c2ccccc2Cl)cc1OC ZINC000436307077 1042833485 /nfs/dbraw/zinc/83/34/85/1042833485.db2.gz JRUFGHGRRAVKET-QGZVFWFLSA-N 1 2 323.795 4.006 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC(C)(C)[C@H]2c2ccncc2)c(C)[nH+]1 ZINC000515782471 1042835202 /nfs/dbraw/zinc/83/52/02/1042835202.db2.gz GDXIINBFWZDOLC-QGZVFWFLSA-N 1 2 324.428 4.017 20 0 DIADLO COc1c(F)cc(F)cc1C[N@@H+]1CCC[C@@H]1c1ccccc1F ZINC001143561692 1042842570 /nfs/dbraw/zinc/84/25/70/1042842570.db2.gz XOGKDCYUVXERCV-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cc(F)cc1C[N@H+]1CCC[C@@H]1c1ccccc1F ZINC001143561692 1042842574 /nfs/dbraw/zinc/84/25/74/1042842574.db2.gz XOGKDCYUVXERCV-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccccc1 ZINC000516700171 1042852100 /nfs/dbraw/zinc/85/21/00/1042852100.db2.gz UBNKIVCGJMHWAR-AWEZNQCLSA-N 1 2 323.371 4.144 20 0 DIADLO COc1c(F)cc(F)cc1C[N@@H+]1CCC[C@@H]1c1ccc(C)nc1 ZINC001143563065 1042857019 /nfs/dbraw/zinc/85/70/19/1042857019.db2.gz LFDXAOKPIMJHIG-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1c(F)cc(F)cc1C[N@H+]1CCC[C@@H]1c1ccc(C)nc1 ZINC001143563065 1042857024 /nfs/dbraw/zinc/85/70/24/1042857024.db2.gz LFDXAOKPIMJHIG-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO CCCCCNC(=O)C[N@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000517125182 1042868582 /nfs/dbraw/zinc/86/85/82/1042868582.db2.gz JSOUTCOWODAHNF-AWEZNQCLSA-N 1 2 322.880 4.172 20 0 DIADLO CCCCCNC(=O)C[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000517125182 1042868589 /nfs/dbraw/zinc/86/85/89/1042868589.db2.gz JSOUTCOWODAHNF-AWEZNQCLSA-N 1 2 322.880 4.172 20 0 DIADLO Clc1ccc(OCC[NH+]2Cc3ccccc3C2)c(Cl)c1 ZINC000517325254 1042876463 /nfs/dbraw/zinc/87/64/63/1042876463.db2.gz KZCOASCHJZQWAR-UHFFFAOYSA-N 1 2 308.208 4.388 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)CCO1 ZINC000517403436 1042879156 /nfs/dbraw/zinc/87/91/56/1042879156.db2.gz QZEQCXQZYLYNBX-CQSZACIVSA-N 1 2 322.861 4.074 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)CCO1 ZINC000517403436 1042879161 /nfs/dbraw/zinc/87/91/61/1042879161.db2.gz QZEQCXQZYLYNBX-CQSZACIVSA-N 1 2 322.861 4.074 20 0 DIADLO Cc1cc(C)c(CNc2cc(N3CCCCC3)nc[nH+]2)c(C)c1 ZINC000517657491 1042891621 /nfs/dbraw/zinc/89/16/21/1042891621.db2.gz ZDXKZEZAMCXLNT-UHFFFAOYSA-N 1 2 310.445 4.004 20 0 DIADLO Cc1cc(C)c(CNc2cc(N3CCCCC3)[nH+]cn2)c(C)c1 ZINC000517657491 1042891624 /nfs/dbraw/zinc/89/16/24/1042891624.db2.gz ZDXKZEZAMCXLNT-UHFFFAOYSA-N 1 2 310.445 4.004 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H]2CCCc3c(Cl)ccnc32)cs1 ZINC000925033675 1042900076 /nfs/dbraw/zinc/90/00/76/1042900076.db2.gz NASLTWGGXSMGFV-GXFFZTMASA-N 1 2 321.877 4.482 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cnn(C3CCC3)c2)cs1 ZINC000925034482 1042901246 /nfs/dbraw/zinc/90/12/46/1042901246.db2.gz SAVBRJGSNWGVLL-VXGBXAGGSA-N 1 2 304.463 4.039 20 0 DIADLO Cc1ccc(NC(=O)[C@H](c2cccc(Cl)c2)[NH+](C)C)c(F)c1 ZINC000518891130 1042923990 /nfs/dbraw/zinc/92/39/90/1042923990.db2.gz LHYOAENSHGFAKN-INIZCTEOSA-N 1 2 320.795 4.029 20 0 DIADLO COc1ccnc([C@@H](C)[NH2+][C@@H](C)c2nc3ccccc3s2)c1 ZINC000925068353 1042946116 /nfs/dbraw/zinc/94/61/16/1042946116.db2.gz DWOWGWDUZRWBSO-NEPJUHHUSA-N 1 2 313.426 4.112 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000664832376 1042969150 /nfs/dbraw/zinc/96/91/50/1042969150.db2.gz JMBINZLLPQEIFW-SUMWQHHRSA-N 1 2 307.397 4.367 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000664832376 1042969152 /nfs/dbraw/zinc/96/91/52/1042969152.db2.gz JMBINZLLPQEIFW-SUMWQHHRSA-N 1 2 307.397 4.367 20 0 DIADLO Cn1cc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccnc2)c(C2CCCC2)n1 ZINC000894584735 1042970007 /nfs/dbraw/zinc/97/00/07/1042970007.db2.gz LODFWSHIFZAEOO-IBGZPJMESA-N 1 2 324.472 4.056 20 0 DIADLO Cn1cc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)c(C2CCCC2)n1 ZINC000894584735 1042970013 /nfs/dbraw/zinc/97/00/13/1042970013.db2.gz LODFWSHIFZAEOO-IBGZPJMESA-N 1 2 324.472 4.056 20 0 DIADLO Fc1cncc([C@H]([NH2+]Cc2cc(-c3ccccc3)on2)C2CC2)c1 ZINC000519737555 1043000866 /nfs/dbraw/zinc/00/08/66/1043000866.db2.gz SPUNBAIBOVIOPA-LJQANCHMSA-N 1 2 323.371 4.117 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2noc(C(C)C)n2)CC(C)C)c1 ZINC000519907972 1043008034 /nfs/dbraw/zinc/00/80/34/1043008034.db2.gz YMQKWLBWXXPPOM-UHFFFAOYSA-N 1 2 301.434 4.160 20 0 DIADLO Cc1cccc(C[N@H+](Cc2noc(C(C)C)n2)CC(C)C)c1 ZINC000519907972 1043008040 /nfs/dbraw/zinc/00/80/40/1043008040.db2.gz YMQKWLBWXXPPOM-UHFFFAOYSA-N 1 2 301.434 4.160 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1cn2c(n1)CCCC2 ZINC000925095255 1043014547 /nfs/dbraw/zinc/01/45/47/1043014547.db2.gz SRFWQZVEMGMSQS-RYUDHWBXSA-N 1 2 321.827 4.424 20 0 DIADLO CCc1nc(C[N@@H+]2CCCCC[C@@H]2/C=C/c2ccccc2)no1 ZINC000441171799 1043024788 /nfs/dbraw/zinc/02/47/88/1043024788.db2.gz SINSDRQKBIVKQS-GZKZCVOOSA-N 1 2 311.429 4.090 20 0 DIADLO CCc1nc(C[N@H+]2CCCCC[C@@H]2/C=C/c2ccccc2)no1 ZINC000441171799 1043024790 /nfs/dbraw/zinc/02/47/90/1043024790.db2.gz SINSDRQKBIVKQS-GZKZCVOOSA-N 1 2 311.429 4.090 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000441174515 1043024873 /nfs/dbraw/zinc/02/48/73/1043024873.db2.gz SGVFNZPSSHKTBQ-NVXWUHKLSA-N 1 2 305.805 4.458 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000441174515 1043024878 /nfs/dbraw/zinc/02/48/78/1043024878.db2.gz SGVFNZPSSHKTBQ-NVXWUHKLSA-N 1 2 305.805 4.458 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000441174518 1043025376 /nfs/dbraw/zinc/02/53/76/1043025376.db2.gz SGVFNZPSSHKTBQ-RDJZCZTQSA-N 1 2 305.805 4.458 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000441174518 1043025379 /nfs/dbraw/zinc/02/53/79/1043025379.db2.gz SGVFNZPSSHKTBQ-RDJZCZTQSA-N 1 2 305.805 4.458 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+]3CCc4sccc4C3)o2)cc1 ZINC000441265947 1043032781 /nfs/dbraw/zinc/03/27/81/1043032781.db2.gz MZWNZDVWAIXHHW-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+]3CCc4sccc4C3)o2)cc1 ZINC000441265947 1043032783 /nfs/dbraw/zinc/03/27/83/1043032783.db2.gz MZWNZDVWAIXHHW-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO CC(C)CCc1noc(C[N@H+](C)[C@@H]2CCCc3ccccc32)n1 ZINC000520386911 1043041077 /nfs/dbraw/zinc/04/10/77/1043041077.db2.gz IWDFIJRVBORUKM-QGZVFWFLSA-N 1 2 313.445 4.168 20 0 DIADLO CC(C)CCc1noc(C[N@@H+](C)[C@@H]2CCCc3ccccc32)n1 ZINC000520386911 1043041081 /nfs/dbraw/zinc/04/10/81/1043041081.db2.gz IWDFIJRVBORUKM-QGZVFWFLSA-N 1 2 313.445 4.168 20 0 DIADLO C[C@H](Cc1nc(C2CC(C)(C)CC(C)(C)C2)no1)n1cc[nH+]c1 ZINC000664976632 1043057136 /nfs/dbraw/zinc/05/71/36/1043057136.db2.gz BPNTVHBBHIZRCU-CYBMUJFWSA-N 1 2 316.449 4.390 20 0 DIADLO Cc1noc([C@@H]2CCCC[N@@H+]2C/C=C/c2ccc(Cl)cc2)n1 ZINC000579268566 1043061920 /nfs/dbraw/zinc/06/19/20/1043061920.db2.gz HWVPFJGOGONYHD-APHBUQMISA-N 1 2 317.820 4.272 20 0 DIADLO Cc1noc([C@@H]2CCCC[N@H+]2C/C=C/c2ccc(Cl)cc2)n1 ZINC000579268566 1043061929 /nfs/dbraw/zinc/06/19/29/1043061929.db2.gz HWVPFJGOGONYHD-APHBUQMISA-N 1 2 317.820 4.272 20 0 DIADLO Cc1ccc(C)c(NC(=O)Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001202768258 1043070407 /nfs/dbraw/zinc/07/04/07/1043070407.db2.gz XJPDVAGYOCGVIM-UHFFFAOYSA-N 1 2 320.396 4.192 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](Cc2ccco2)C2CCCC2)cs1 ZINC000175104743 1043075280 /nfs/dbraw/zinc/07/52/80/1043075280.db2.gz SYPSCPUIDAWESB-CYBMUJFWSA-N 1 2 320.458 4.388 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](Cc2ccco2)C2CCCC2)cs1 ZINC000175104743 1043075291 /nfs/dbraw/zinc/07/52/91/1043075291.db2.gz SYPSCPUIDAWESB-CYBMUJFWSA-N 1 2 320.458 4.388 20 0 DIADLO C[C@H]([NH2+]Cc1cccnc1F)c1cc(Cl)sc1Cl ZINC000794837283 1043086177 /nfs/dbraw/zinc/08/61/77/1043086177.db2.gz XRVJCDXOKIVSOQ-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO C[C@@H]([NH2+]Cc1cccnc1F)c1cc(Cl)sc1Cl ZINC000794837280 1043086212 /nfs/dbraw/zinc/08/62/12/1043086212.db2.gz XRVJCDXOKIVSOQ-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO CC(C)(C)c1cn(Cc2csc(-c3ccsc3)n2)c[nH+]1 ZINC000865375347 1043087824 /nfs/dbraw/zinc/08/78/24/1043087824.db2.gz IZCRSGMUGHGOQJ-UHFFFAOYSA-N 1 2 303.456 4.414 20 0 DIADLO CC(C)(C)c1cn(Cc2cccc(OCc3ccccn3)c2)c[nH+]1 ZINC000865376196 1043088555 /nfs/dbraw/zinc/08/85/55/1043088555.db2.gz DFRVWSAUCVNZAZ-UHFFFAOYSA-N 1 2 321.424 4.203 20 0 DIADLO c1csc(C2([NH2+]Cc3cnc(-c4ccccc4)[nH]3)CCCC2)n1 ZINC000175996454 1043092736 /nfs/dbraw/zinc/09/27/36/1043092736.db2.gz MEYAMAGMNWILOV-UHFFFAOYSA-N 1 2 324.453 4.092 20 0 DIADLO CC[C@@H](c1ccccc1)[S@](=O)Cc1cn2cccc(C)c2[nH+]1 ZINC000176517376 1043096436 /nfs/dbraw/zinc/09/64/36/1043096436.db2.gz KXXCSAHETIDZIL-HTAPYJJXSA-N 1 2 312.438 4.043 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2ccc(F)c(F)c2)[C@H](C)CO1 ZINC000441437882 1043103275 /nfs/dbraw/zinc/10/32/75/1043103275.db2.gz IHQMYSLOLALBCJ-KUHUBIRLSA-N 1 2 317.379 4.235 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2ccc(F)c(F)c2)[C@H](C)CO1 ZINC000441437882 1043103281 /nfs/dbraw/zinc/10/32/81/1043103281.db2.gz IHQMYSLOLALBCJ-KUHUBIRLSA-N 1 2 317.379 4.235 20 0 DIADLO Fc1cccc([C@@H]([NH2+]Cc2cn(C3CC3)cn2)c2ccccc2)c1 ZINC000865488050 1043104666 /nfs/dbraw/zinc/10/46/66/1043104666.db2.gz ASJZVCMCUHHPSJ-FQEVSTJZSA-N 1 2 321.399 4.236 20 0 DIADLO COc1ccc(C[N@H+](C)[C@@H](C)c2ncc(C(C)(C)C)o2)cc1 ZINC000177633246 1043109885 /nfs/dbraw/zinc/10/98/85/1043109885.db2.gz PWZCRBKWITWZQN-ZDUSSCGKSA-N 1 2 302.418 4.174 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@@H](C)c2ncc(C(C)(C)C)o2)cc1 ZINC000177633246 1043109891 /nfs/dbraw/zinc/10/98/91/1043109891.db2.gz PWZCRBKWITWZQN-ZDUSSCGKSA-N 1 2 302.418 4.174 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1nc(C)c(C)s1)CCC2 ZINC000177747183 1043112250 /nfs/dbraw/zinc/11/22/50/1043112250.db2.gz GVKMABAGFJOQPA-CYBMUJFWSA-N 1 2 307.488 4.034 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1nc(C)c(C)s1)CCC2 ZINC000177747183 1043112257 /nfs/dbraw/zinc/11/22/57/1043112257.db2.gz GVKMABAGFJOQPA-CYBMUJFWSA-N 1 2 307.488 4.034 20 0 DIADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000865572263 1043115393 /nfs/dbraw/zinc/11/53/93/1043115393.db2.gz MEJBIHGTXPEURD-BZNIZROVSA-N 1 2 302.443 4.052 20 0 DIADLO COC[C@H]([NH2+]Cc1cc(Cl)ccc1Cl)c1ccco1 ZINC000179012195 1043139365 /nfs/dbraw/zinc/13/93/65/1043139365.db2.gz XBFMEVJVYYVBSD-ZDUSSCGKSA-N 1 2 300.185 4.064 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@@H](C)c1ccc(Cl)nc1)c1ccco1 ZINC000179117568 1043141008 /nfs/dbraw/zinc/14/10/08/1043141008.db2.gz UKDUWKZKMDTGAN-ZFWWWQNUSA-N 1 2 322.836 4.393 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]C(C)(C)c2cccc(F)c2)cs1 ZINC000179571795 1043146537 /nfs/dbraw/zinc/14/65/37/1043146537.db2.gz IFTQTZJTODCKLO-LLVKDONJSA-N 1 2 308.422 4.015 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2cccc(F)c2F)o1 ZINC000183271519 1043158584 /nfs/dbraw/zinc/15/85/84/1043158584.db2.gz FUTDDSBBJZSITL-XHDPSFHLSA-N 1 2 309.356 4.159 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2cccc(SC(F)(F)F)c2)no1 ZINC000866241423 1043164237 /nfs/dbraw/zinc/16/42/37/1043164237.db2.gz CDYAEVOVDAGKHT-SNVBAGLBSA-N 1 2 316.348 4.446 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+]Cc2noc(-c3ccccc3)n2)c1C ZINC000183732189 1043170022 /nfs/dbraw/zinc/17/00/22/1043170022.db2.gz FYBJGTTWHHDYID-OAHLLOKOSA-N 1 2 307.397 4.204 20 0 DIADLO Cc1cccc([C@H](C)[NH2+]Cc2noc(-c3ccccc3)n2)c1C ZINC000183732209 1043170123 /nfs/dbraw/zinc/17/01/23/1043170123.db2.gz FYBJGTTWHHDYID-HNNXBMFYSA-N 1 2 307.397 4.204 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@@H](C)c2cccc(C)c2C)n1 ZINC000183707343 1043170387 /nfs/dbraw/zinc/17/03/87/1043170387.db2.gz KQOAYPHFRYNANO-UONOGXRCSA-N 1 2 319.474 4.351 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2sc(-c3ccccc3)nc2C)o1 ZINC000183743639 1043170915 /nfs/dbraw/zinc/17/09/15/1043170915.db2.gz RHNZBEMGXLNFHD-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ccc(C(F)F)cc1)c1nc(C2CC2)no1 ZINC000183993420 1043177188 /nfs/dbraw/zinc/17/71/88/1043177188.db2.gz WDYGRDHAUOBCTE-AWEZNQCLSA-N 1 2 321.371 4.372 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ccc(C(F)F)cc1)c1nc(C2CC2)no1 ZINC000183993441 1043177342 /nfs/dbraw/zinc/17/73/42/1043177342.db2.gz WDYGRDHAUOBCTE-CQSZACIVSA-N 1 2 321.371 4.372 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1cncc(C)c1)c1ccco1 ZINC000184416802 1043184056 /nfs/dbraw/zinc/18/40/56/1043184056.db2.gz XGWXKQQJBZTJDQ-FOIQADDNSA-N 1 2 322.408 4.432 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@@H](C)c1cncc(C)c1)c1ccco1 ZINC000184416819 1043185185 /nfs/dbraw/zinc/18/51/85/1043185185.db2.gz XGWXKQQJBZTJDQ-MGPUTAFESA-N 1 2 322.408 4.432 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2cc3ccccc3s2)o1 ZINC000184375985 1043185486 /nfs/dbraw/zinc/18/54/86/1043185486.db2.gz FOZUPMYFLJAAQK-NSHDSACASA-N 1 2 301.415 4.259 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccccn1 ZINC000866351238 1043186000 /nfs/dbraw/zinc/18/60/00/1043186000.db2.gz IBXNURGLYFITPG-MRXNPFEDSA-N 1 2 312.310 4.125 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1ccc(Cl)cc1 ZINC000186061115 1043213218 /nfs/dbraw/zinc/21/32/18/1043213218.db2.gz VSDOYBPEJZNGCN-GFCCVEGCSA-N 1 2 322.836 4.494 20 0 DIADLO C[C@H]1CCN(c2nc(-c3ccccc3)cs2)C[C@@H]1n1cc[nH+]c1 ZINC000134124795 1043214690 /nfs/dbraw/zinc/21/46/90/1043214690.db2.gz FSTSETZBBINHQL-YOEHRIQHSA-N 1 2 324.453 4.094 20 0 DIADLO C/C(=C\c1ccccc1)CNc1ccc(-c2cnn(C)c2)c(C)[nH+]1 ZINC001202521494 1043216891 /nfs/dbraw/zinc/21/68/91/1043216891.db2.gz WAJREFYOFUGIHP-RVDMUPIBSA-N 1 2 318.424 4.306 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1nn(C)cc1C(F)F ZINC000866563321 1043223496 /nfs/dbraw/zinc/22/34/96/1043223496.db2.gz JPJMMYBDINSDEB-NSHDSACASA-N 1 2 319.355 4.263 20 0 DIADLO COc1cc(F)cc(C[NH2+][C@@H](C)c2csc(C(C)C)n2)c1 ZINC000186440573 1043224902 /nfs/dbraw/zinc/22/49/02/1043224902.db2.gz GZIZTAXZIDZJRJ-NSHDSACASA-N 1 2 308.422 4.265 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(C(C)(C)C)o1)c1nc2ccccc2n1C ZINC000866574736 1043226080 /nfs/dbraw/zinc/22/60/80/1043226080.db2.gz XXICXAWBKOFGHA-ZDUSSCGKSA-N 1 2 311.429 4.315 20 0 DIADLO Cc1nccnc1[C@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1F ZINC000866577141 1043226603 /nfs/dbraw/zinc/22/66/03/1043226603.db2.gz KJPUARXOWQBFIU-VIFPVBQESA-N 1 2 314.191 4.082 20 0 DIADLO COCc1ccc(CNc2ccc([N@@H+]3C[C@H]4CC[C@@H]3C4)cc2)cc1 ZINC000192216916 1043267099 /nfs/dbraw/zinc/26/70/99/1043267099.db2.gz DXHPGDDPRZKYEZ-GHTZIAJQSA-N 1 2 322.452 4.434 20 0 DIADLO COCc1ccc(CNc2ccc([N@H+]3C[C@H]4CC[C@@H]3C4)cc2)cc1 ZINC000192216916 1043267102 /nfs/dbraw/zinc/26/71/02/1043267102.db2.gz DXHPGDDPRZKYEZ-GHTZIAJQSA-N 1 2 322.452 4.434 20 0 DIADLO CC(C)Cn1cc(CNc2ccc([N@@H+]3C[C@H]4CC[C@@H]3C4)cc2)cn1 ZINC000192217885 1043267616 /nfs/dbraw/zinc/26/76/16/1043267616.db2.gz GTRFZFVYXWWWIZ-OXJNMPFZSA-N 1 2 324.472 4.140 20 0 DIADLO CC(C)Cn1cc(CNc2ccc([N@H+]3C[C@H]4CC[C@@H]3C4)cc2)cn1 ZINC000192217885 1043267632 /nfs/dbraw/zinc/26/76/32/1043267632.db2.gz GTRFZFVYXWWWIZ-OXJNMPFZSA-N 1 2 324.472 4.140 20 0 DIADLO CCn1ncnc1C[N@H+]([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000193334645 1043285034 /nfs/dbraw/zinc/28/50/34/1043285034.db2.gz VKCIBWJMKWVFRR-OAHLLOKOSA-N 1 2 320.440 4.177 20 0 DIADLO CCn1ncnc1C[N@@H+]([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000193334645 1043285044 /nfs/dbraw/zinc/28/50/44/1043285044.db2.gz VKCIBWJMKWVFRR-OAHLLOKOSA-N 1 2 320.440 4.177 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](COC)c2ccc(Cl)cc2)cs1 ZINC000193690726 1043287088 /nfs/dbraw/zinc/28/70/88/1043287088.db2.gz FYQVGJMBHYGSHQ-HNNXBMFYSA-N 1 2 324.877 4.226 20 0 DIADLO C[C@@H](CC[NH2+]c1ccc(N2CCC(O)CC2)cc1)c1ccccc1 ZINC000194094843 1043288455 /nfs/dbraw/zinc/28/84/55/1043288455.db2.gz WLDACCSVRLIJCL-KRWDZBQOSA-N 1 2 324.468 4.253 20 0 DIADLO Cc1nc([C@@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)c(C)s1 ZINC000777492316 1043295563 /nfs/dbraw/zinc/29/55/63/1043295563.db2.gz HZFZJRHOYWRYGL-LLVKDONJSA-N 1 2 301.459 4.315 20 0 DIADLO Cc1nc([C@@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)c(C)s1 ZINC000777492316 1043295574 /nfs/dbraw/zinc/29/55/74/1043295574.db2.gz HZFZJRHOYWRYGL-LLVKDONJSA-N 1 2 301.459 4.315 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cccc(F)c3Cl)CCC2)n1 ZINC000339084591 1043297607 /nfs/dbraw/zinc/29/76/07/1043297607.db2.gz MRYDEGNEVQOJTG-UHFFFAOYSA-N 1 2 310.825 4.413 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+][C@@H](C)c1cccnc1Cl ZINC000122432785 1043303797 /nfs/dbraw/zinc/30/37/97/1043303797.db2.gz LDRDICZHGOULLM-QWRGUYRKSA-N 1 2 308.784 4.295 20 0 DIADLO CO[C@@H](CSCc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000339092603 1043322639 /nfs/dbraw/zinc/32/26/39/1043322639.db2.gz WHPPJFKEXJBPIO-IBGZPJMESA-N 1 2 324.449 4.493 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccn(C3CCCC3)n2)s1 ZINC000268735650 1043326858 /nfs/dbraw/zinc/32/68/58/1043326858.db2.gz YEEQOGSHWKVCLC-ZDUSSCGKSA-N 1 2 318.490 4.265 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccn(C3CCCC3)n2)s1 ZINC000268735650 1043326862 /nfs/dbraw/zinc/32/68/62/1043326862.db2.gz YEEQOGSHWKVCLC-ZDUSSCGKSA-N 1 2 318.490 4.265 20 0 DIADLO CC[C@H]([NH2+][C@H](c1nccn1C)c1ccc(F)cc1)c1ccccc1 ZINC000268777624 1043328771 /nfs/dbraw/zinc/32/87/71/1043328771.db2.gz SCVMEBWJEXJSBH-OALUTQOASA-N 1 2 323.415 4.390 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCc2c(Cl)cccc2C1 ZINC000428233171 1043330288 /nfs/dbraw/zinc/33/02/88/1043330288.db2.gz QVSBDZCCUPHUIX-UHFFFAOYSA-N 1 2 304.821 4.318 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1CCc2c(Cl)cccc2C1 ZINC000428233171 1043330294 /nfs/dbraw/zinc/33/02/94/1043330294.db2.gz QVSBDZCCUPHUIX-UHFFFAOYSA-N 1 2 304.821 4.318 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H]2CCOc3c(Cl)cccc32)cs1 ZINC000268870937 1043338495 /nfs/dbraw/zinc/33/84/95/1043338495.db2.gz GDBIUOXAIHGYNI-ZANVPECISA-N 1 2 308.834 4.279 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2cn(C(C)(C)C)nc2C)cs1 ZINC000268962057 1043347401 /nfs/dbraw/zinc/34/74/01/1043347401.db2.gz XOBDTAMOXQHAPW-ZYHUDNBSSA-N 1 2 306.479 4.123 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+]Cc1csc([C@@H](C)OC)n1 ZINC000269044239 1043353157 /nfs/dbraw/zinc/35/31/57/1043353157.db2.gz HDEZTPPVQQSCRK-QWHCGFSZSA-N 1 2 320.458 4.100 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc2ccccc2c1 ZINC000795161298 1043365902 /nfs/dbraw/zinc/36/59/02/1043365902.db2.gz MFYZPEIGNMKHIE-HNNXBMFYSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@@H](C)C(=O)Nc1ccc2ccccc2c1 ZINC000795161298 1043365912 /nfs/dbraw/zinc/36/59/12/1043365912.db2.gz MFYZPEIGNMKHIE-HNNXBMFYSA-N 1 2 322.408 4.200 20 0 DIADLO CCC(CC)n1ccc(C[N@H+](C)[C@H](C)c2cccc(O)c2)n1 ZINC000269615115 1043371821 /nfs/dbraw/zinc/37/18/21/1043371821.db2.gz GODGGAYWOWVURB-CQSZACIVSA-N 1 2 301.434 4.143 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)n1 ZINC000269615115 1043371830 /nfs/dbraw/zinc/37/18/30/1043371830.db2.gz GODGGAYWOWVURB-CQSZACIVSA-N 1 2 301.434 4.143 20 0 DIADLO Fc1ccc([C@@H]2CCCC[N@@H+]2Cc2ncc(C3CC3)o2)cc1 ZINC000270530909 1043389136 /nfs/dbraw/zinc/38/91/36/1043389136.db2.gz FNSBQTKNFRGBDP-INIZCTEOSA-N 1 2 300.377 4.418 20 0 DIADLO Fc1ccc([C@@H]2CCCC[N@H+]2Cc2ncc(C3CC3)o2)cc1 ZINC000270530909 1043389143 /nfs/dbraw/zinc/38/91/43/1043389143.db2.gz FNSBQTKNFRGBDP-INIZCTEOSA-N 1 2 300.377 4.418 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)c(C)[nH+]1 ZINC000521344176 1043389284 /nfs/dbraw/zinc/38/92/84/1043389284.db2.gz LCUDWNYGXINAPO-STQMWFEESA-N 1 2 314.351 4.314 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1ncc(C3CC3)o1)CCC2 ZINC000270546253 1043390127 /nfs/dbraw/zinc/39/01/27/1043390127.db2.gz STKQTZNKXZRZBK-CYBMUJFWSA-N 1 2 317.458 4.080 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1ncc(C3CC3)o1)CCC2 ZINC000270546253 1043390138 /nfs/dbraw/zinc/39/01/38/1043390138.db2.gz STKQTZNKXZRZBK-CYBMUJFWSA-N 1 2 317.458 4.080 20 0 DIADLO COC[C@H]([NH2+]Cc1c(Cl)oc2ccccc21)c1ccco1 ZINC000270544214 1043390480 /nfs/dbraw/zinc/39/04/80/1043390480.db2.gz YYOWQPQQFVTEJG-ZDUSSCGKSA-N 1 2 305.761 4.157 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270663525 1043392977 /nfs/dbraw/zinc/39/29/77/1043392977.db2.gz WBGAOEWXYBRMSX-BLLLJJGKSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270663525 1043392990 /nfs/dbraw/zinc/39/29/90/1043392990.db2.gz WBGAOEWXYBRMSX-BLLLJJGKSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270663539 1043393466 /nfs/dbraw/zinc/39/34/66/1043393466.db2.gz WBGAOEWXYBRMSX-WBMJQRKESA-N 1 2 300.377 4.274 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270663539 1043393474 /nfs/dbraw/zinc/39/34/74/1043393474.db2.gz WBGAOEWXYBRMSX-WBMJQRKESA-N 1 2 300.377 4.274 20 0 DIADLO CC[N@H+](Cc1ccncc1)[C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000271054858 1043399190 /nfs/dbraw/zinc/39/91/90/1043399190.db2.gz YTQZSRBDHRAAOM-HNNXBMFYSA-N 1 2 307.397 4.320 20 0 DIADLO CC[N@@H+](Cc1ccncc1)[C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000271054858 1043399200 /nfs/dbraw/zinc/39/92/00/1043399200.db2.gz YTQZSRBDHRAAOM-HNNXBMFYSA-N 1 2 307.397 4.320 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(OCC2CC2)c(F)c1)c1cscn1 ZINC000271195487 1043406563 /nfs/dbraw/zinc/40/65/63/1043406563.db2.gz YIKZOAQSVPQONO-RYUDHWBXSA-N 1 2 320.433 4.483 20 0 DIADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000271472398 1043423047 /nfs/dbraw/zinc/42/30/47/1043423047.db2.gz HPVAUNVLZYQPSI-IAQYHMDHSA-N 1 2 319.836 4.190 20 0 DIADLO C[C@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1ccc(Cl)cc1 ZINC000271485398 1043423207 /nfs/dbraw/zinc/42/32/07/1043423207.db2.gz OERUKIQJFDTMFR-ZUZCIYMTSA-N 1 2 311.759 4.002 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+][C@H](C)c1cccc(O)c1F ZINC000872024391 1043424813 /nfs/dbraw/zinc/42/48/13/1043424813.db2.gz AGCHUWBHGZQBRZ-GHMZBOCLSA-N 1 2 307.340 4.091 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nnc(C(C)C)[nH]1)c1cc(F)ccc1F ZINC000271535644 1043431154 /nfs/dbraw/zinc/43/11/54/1043431154.db2.gz QGHUXQJDIRDASP-HZMBPMFUSA-N 1 2 308.376 4.008 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nnc(C(C)C)[nH]1)c1ccc(F)cc1F ZINC000271535732 1043431753 /nfs/dbraw/zinc/43/17/53/1043431753.db2.gz QGVBOXZDXSMQHU-IINYFYTJSA-N 1 2 308.376 4.008 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nnc(C(C)C)[nH]1)c1ccc(F)cc1F ZINC000271535728 1043432673 /nfs/dbraw/zinc/43/26/73/1043432673.db2.gz QGVBOXZDXSMQHU-HZMBPMFUSA-N 1 2 308.376 4.008 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)[nH]n1 ZINC000442840578 1043434366 /nfs/dbraw/zinc/43/43/66/1043434366.db2.gz LVPJVTCMEVGTHV-WHLNPGIBSA-N 1 2 321.346 4.106 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC[C@@H]2/C=C\c2ccccc2)[nH]n1 ZINC000442840578 1043434373 /nfs/dbraw/zinc/43/43/73/1043434373.db2.gz LVPJVTCMEVGTHV-WHLNPGIBSA-N 1 2 321.346 4.106 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC[C@H]2/C=C\c2ccccc2)[nH]n1 ZINC000442840576 1043434604 /nfs/dbraw/zinc/43/46/04/1043434604.db2.gz LVPJVTCMEVGTHV-CDNLZTBQSA-N 1 2 321.346 4.106 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC[C@H]2/C=C\c2ccccc2)[nH]n1 ZINC000442840576 1043434606 /nfs/dbraw/zinc/43/46/06/1043434606.db2.gz LVPJVTCMEVGTHV-CDNLZTBQSA-N 1 2 321.346 4.106 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nnc(C(C)C)[nH]1)c1cc(C)ccc1OC ZINC000271557327 1043437031 /nfs/dbraw/zinc/43/70/31/1043437031.db2.gz SWLDZBYDMQUIAX-ZFWWWQNUSA-N 1 2 316.449 4.047 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2F)ncn1 ZINC000925630637 1043440766 /nfs/dbraw/zinc/44/07/66/1043440766.db2.gz VGGPVXRCWZGTFT-VIFPVBQESA-N 1 2 314.191 4.082 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+]Cc1ncc(C2CC2)o1 ZINC000271640870 1043443154 /nfs/dbraw/zinc/44/31/54/1043443154.db2.gz CPAGFLIUPYAWPI-HNNXBMFYSA-N 1 2 300.402 4.192 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1ncc(C2CC2)o1 ZINC000271640873 1043443302 /nfs/dbraw/zinc/44/33/02/1043443302.db2.gz CPAGFLIUPYAWPI-OAHLLOKOSA-N 1 2 300.402 4.192 20 0 DIADLO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1ncc(Cl)s1 ZINC000442886586 1043448387 /nfs/dbraw/zinc/44/83/87/1043448387.db2.gz QILBBOQMWOJFIX-UHFFFAOYSA-N 1 2 305.834 4.300 20 0 DIADLO CC[N@H+](Cc1c[nH]c2ccccc12)Cc1ncc(Cl)s1 ZINC000442886586 1043448393 /nfs/dbraw/zinc/44/83/93/1043448393.db2.gz QILBBOQMWOJFIX-UHFFFAOYSA-N 1 2 305.834 4.300 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1ccncc1Cl ZINC000558183005 1043453313 /nfs/dbraw/zinc/45/33/13/1043453313.db2.gz XYBDMFCVKYWRTR-MRXNPFEDSA-N 1 2 304.821 4.327 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1ccncc1Cl ZINC000558183005 1043453317 /nfs/dbraw/zinc/45/33/17/1043453317.db2.gz XYBDMFCVKYWRTR-MRXNPFEDSA-N 1 2 304.821 4.327 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1cccc(O)c1F ZINC000872085943 1043453916 /nfs/dbraw/zinc/45/39/16/1043453916.db2.gz QVONXHIKRBHWRU-NSHDSACASA-N 1 2 319.351 4.062 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1cc(O)ccc1F ZINC000872086405 1043454494 /nfs/dbraw/zinc/45/44/94/1043454494.db2.gz WBQDBMYLZNSLMJ-LLVKDONJSA-N 1 2 319.351 4.062 20 0 DIADLO c1cc2c(nc[nH+]c2Nc2ccc3nc(C4CC4)sc3c2)[nH]1 ZINC000339134991 1043455072 /nfs/dbraw/zinc/45/50/72/1043455072.db2.gz CGOYTUSDBSGTHJ-UHFFFAOYSA-N 1 2 307.382 4.189 20 0 DIADLO C[C@@H](Nc1ccc([NH+]2CCCC2)cc1)c1cnn(C2CCC2)c1 ZINC000925726725 1043457527 /nfs/dbraw/zinc/45/75/27/1043457527.db2.gz KRUWOOHNVSQYTI-OAHLLOKOSA-N 1 2 310.445 4.381 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nc(-c3ccncc3)cs2)oc1C ZINC000872122624 1043467203 /nfs/dbraw/zinc/46/72/03/1043467203.db2.gz XKQADKJNMGEVGJ-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@H]([NH2+]C1(c2ccc(Br)cc2)CCC1)c1ncco1 ZINC000925780464 1043471920 /nfs/dbraw/zinc/47/19/20/1043471920.db2.gz QWPLSVQXOLDNDI-NSHDSACASA-N 1 2 321.218 4.167 20 0 DIADLO Cc1csc(C2([NH2+][C@@H]3CCc4c3nccc4Cl)CCC2)n1 ZINC000925804559 1043476440 /nfs/dbraw/zinc/47/64/40/1043476440.db2.gz JRIOWZGDZKZRDH-CYBMUJFWSA-N 1 2 319.861 4.156 20 0 DIADLO Cc1nonc1C[NH2+][C@@H](C)c1ccc(SC2CCCC2)cc1 ZINC000872136000 1043476783 /nfs/dbraw/zinc/47/67/83/1043476783.db2.gz JXZHNIYPRIGLNL-LBPRGKRZSA-N 1 2 317.458 4.264 20 0 DIADLO C[C@@H]1CCc2nc(C[N@@H+]3CCC[C@H]3c3cccnc3)sc2C1 ZINC000348894691 1043478247 /nfs/dbraw/zinc/47/82/47/1043478247.db2.gz OTJMEGKOFVVQLC-CJNGLKHVSA-N 1 2 313.470 4.000 20 0 DIADLO C[C@@H]1CCc2nc(C[N@H+]3CCC[C@H]3c3cccnc3)sc2C1 ZINC000348894691 1043478251 /nfs/dbraw/zinc/47/82/51/1043478251.db2.gz OTJMEGKOFVVQLC-CJNGLKHVSA-N 1 2 313.470 4.000 20 0 DIADLO Brc1cscc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000348918885 1043479943 /nfs/dbraw/zinc/47/99/43/1043479943.db2.gz DETHPPFLGWCIBP-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cscc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000348918885 1043479950 /nfs/dbraw/zinc/47/99/50/1043479950.db2.gz DETHPPFLGWCIBP-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO CCCn1c2ccccc2nc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000348920153 1043480315 /nfs/dbraw/zinc/48/03/15/1043480315.db2.gz IOILGYWKRRPPGV-GOSISDBHSA-N 1 2 320.440 4.178 20 0 DIADLO CCCn1c2ccccc2nc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000348920153 1043480326 /nfs/dbraw/zinc/48/03/26/1043480326.db2.gz IOILGYWKRRPPGV-GOSISDBHSA-N 1 2 320.440 4.178 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@H]2c2cccnc2)s1 ZINC000348921898 1043480742 /nfs/dbraw/zinc/48/07/42/1043480742.db2.gz PHYYVHLVFGDERL-AWEZNQCLSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@H]2c2cccnc2)s1 ZINC000348921898 1043480751 /nfs/dbraw/zinc/48/07/51/1043480751.db2.gz PHYYVHLVFGDERL-AWEZNQCLSA-N 1 2 301.459 4.173 20 0 DIADLO Fc1ccc(C2([NH2+][C@H]3COCc4cccc(Cl)c43)CC2)cc1 ZINC000925848044 1043482211 /nfs/dbraw/zinc/48/22/11/1043482211.db2.gz ZAVCXKMFCCAHSJ-INIZCTEOSA-N 1 2 317.791 4.329 20 0 DIADLO CCC(CC)c1noc([C@@H]([NH3+])c2ccc(C(F)(F)F)cc2)n1 ZINC000872175069 1043485464 /nfs/dbraw/zinc/48/54/64/1043485464.db2.gz NOJMIOKWHOEWSY-LBPRGKRZSA-N 1 2 313.323 4.040 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nnc(-c2ccccc2)[nH]1)c1ccccc1 ZINC000777579175 1043487033 /nfs/dbraw/zinc/48/70/33/1043487033.db2.gz SEMIDQVPORGGBU-QGZVFWFLSA-N 1 2 306.413 4.103 20 0 DIADLO c1ccc(-c2nnc(C[NH2+][C@@H](CC3CC3)c3ccccc3)[nH]2)cc1 ZINC000777578863 1043489405 /nfs/dbraw/zinc/48/94/05/1043489405.db2.gz OICAVJGJTKDAGQ-SFHVURJKSA-N 1 2 318.424 4.103 20 0 DIADLO Cc1ccc(C)c([C@@H]2CCC[N@@H+]2Cn2ncsc2=S)c1 ZINC000124079100 1043495332 /nfs/dbraw/zinc/49/53/32/1043495332.db2.gz CLHWLPSNTBHFPW-AWEZNQCLSA-N 1 2 305.472 4.086 20 0 DIADLO Cc1ccc(C)c([C@@H]2CCC[N@H+]2Cn2ncsc2=S)c1 ZINC000124079100 1043495340 /nfs/dbraw/zinc/49/53/40/1043495340.db2.gz CLHWLPSNTBHFPW-AWEZNQCLSA-N 1 2 305.472 4.086 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC000558405110 1043501767 /nfs/dbraw/zinc/50/17/67/1043501767.db2.gz PCDHWCDYHODMFW-LLVKDONJSA-N 1 2 322.449 4.439 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1ccc(N3CCCC3)o1)CC2 ZINC001137060719 1043504154 /nfs/dbraw/zinc/50/41/54/1043504154.db2.gz CBTAUIRCLMHFGW-UHFFFAOYSA-N 1 2 316.832 4.092 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1ccc(N3CCCC3)o1)CC2 ZINC001137060719 1043504163 /nfs/dbraw/zinc/50/41/63/1043504163.db2.gz CBTAUIRCLMHFGW-UHFFFAOYSA-N 1 2 316.832 4.092 20 0 DIADLO CC[C@@H](NC(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccc(C)cc1 ZINC000349456103 1043507476 /nfs/dbraw/zinc/50/74/76/1043507476.db2.gz RKSQNODSMLQEFJ-QGZVFWFLSA-N 1 2 322.412 4.224 20 0 DIADLO C[C@@H](Nc1[nH+]c2ccccc2n1C)c1ccc(C(F)(F)F)nc1 ZINC000872766698 1043507706 /nfs/dbraw/zinc/50/77/06/1043507706.db2.gz RMFRPBMZBGHXFG-SNVBAGLBSA-N 1 2 320.318 4.160 20 0 DIADLO C[N@H+](Cc1ccc(N2CCCC2)o1)Cc1ccccc1Cl ZINC001137066669 1043514319 /nfs/dbraw/zinc/51/43/19/1043514319.db2.gz ZUZFUVHVBFWBRU-UHFFFAOYSA-N 1 2 304.821 4.165 20 0 DIADLO C[N@@H+](Cc1ccc(N2CCCC2)o1)Cc1ccccc1Cl ZINC001137066669 1043514330 /nfs/dbraw/zinc/51/43/30/1043514330.db2.gz ZUZFUVHVBFWBRU-UHFFFAOYSA-N 1 2 304.821 4.165 20 0 DIADLO CC1(C)CCc2onc(C[NH2+]Cc3cc4ccccc4o3)c2C1 ZINC000873175482 1043522796 /nfs/dbraw/zinc/52/27/96/1043522796.db2.gz KIYMOEAQBQAKPO-UHFFFAOYSA-N 1 2 310.397 4.226 20 0 DIADLO Cc1nccnc1[C@@H](C)[NH2+]Cc1csc(Cl)c1Cl ZINC000873186483 1043527131 /nfs/dbraw/zinc/52/71/31/1043527131.db2.gz BOIHYWSAKGJGDT-MRVPVSSYSA-N 1 2 302.230 4.004 20 0 DIADLO C[C@H](N[C@H](CC(C)(C)C)C(F)(F)F)c1cn2c([nH+]1)CCCC2 ZINC000926109546 1043530624 /nfs/dbraw/zinc/53/06/24/1043530624.db2.gz LTHZGAUZISMFNW-WCQYABFASA-N 1 2 317.399 4.237 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@H]1CCCOc2c(F)cccc21 ZINC000926111838 1043530967 /nfs/dbraw/zinc/53/09/67/1043530967.db2.gz KIGIEEYKUHTZAG-LSDHHAIUSA-N 1 2 316.376 4.003 20 0 DIADLO Cc1nocc1C[N@@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000350557396 1043547514 /nfs/dbraw/zinc/54/75/14/1043547514.db2.gz LTVYFUQCHILOPR-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1nocc1C[N@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000350557396 1043547516 /nfs/dbraw/zinc/54/75/16/1043547516.db2.gz LTVYFUQCHILOPR-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO CCCCOc1ccc(C[NH2+][C@H](C)c2nonc2C)cc1Cl ZINC000926254298 1043552925 /nfs/dbraw/zinc/55/29/25/1043552925.db2.gz XJWPSKJBELDRQF-LLVKDONJSA-N 1 2 323.824 4.061 20 0 DIADLO C[N@H+](Cc1nccn1Cc1ccccc1)Cc1ccc(CF)cc1 ZINC000777590955 1043553119 /nfs/dbraw/zinc/55/31/19/1043553119.db2.gz PULQPXHZKTZJDK-UHFFFAOYSA-N 1 2 323.415 4.033 20 0 DIADLO C[N@@H+](Cc1nccn1Cc1ccccc1)Cc1ccc(CF)cc1 ZINC000777590955 1043553122 /nfs/dbraw/zinc/55/31/22/1043553122.db2.gz PULQPXHZKTZJDK-UHFFFAOYSA-N 1 2 323.415 4.033 20 0 DIADLO CCn1ccc(C(=O)Nc2cccc(-c3[nH]c(C)c(C)[nH+]3)c2)c1C ZINC000874161082 1043572042 /nfs/dbraw/zinc/57/20/42/1043572042.db2.gz MTPOWVZUHIWZMH-UHFFFAOYSA-N 1 2 322.412 4.076 20 0 DIADLO Cc1cc(N2CCSCC2)ccc1[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000558698450 1043576031 /nfs/dbraw/zinc/57/60/31/1043576031.db2.gz YASVEBOBUNVILV-YXJHDRRASA-N 1 2 302.487 4.149 20 0 DIADLO CC(C)(C)Sc1ccc(NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)cc1 ZINC000874285937 1043576797 /nfs/dbraw/zinc/57/67/97/1043576797.db2.gz DBQPKRBWIPGJGV-ZIAGYGMSSA-N 1 2 315.442 4.043 20 0 DIADLO CC(C)(C)Sc1ccc(NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)cc1 ZINC000874285937 1043576808 /nfs/dbraw/zinc/57/68/08/1043576808.db2.gz DBQPKRBWIPGJGV-ZIAGYGMSSA-N 1 2 315.442 4.043 20 0 DIADLO CC(C)n1cc(C[N@H+](Cc2ccccc2)Cc2cccnc2)cn1 ZINC001137077835 1043577370 /nfs/dbraw/zinc/57/73/70/1043577370.db2.gz LNXOXIHYKIOQLN-UHFFFAOYSA-N 1 2 320.440 4.061 20 0 DIADLO CC(C)n1cc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)cn1 ZINC001137077835 1043577381 /nfs/dbraw/zinc/57/73/81/1043577381.db2.gz LNXOXIHYKIOQLN-UHFFFAOYSA-N 1 2 320.440 4.061 20 0 DIADLO CCC[C@H]([NH2+]Cc1oc(CC)nc1C)c1ncccc1Cl ZINC000926478438 1043582011 /nfs/dbraw/zinc/58/20/11/1043582011.db2.gz BWTIKAVFOQNGFU-ZDUSSCGKSA-N 1 2 307.825 4.225 20 0 DIADLO CCC[C@H]([NH2+]Cc1c(C)onc1CC)c1ncccc1Cl ZINC000926482855 1043585177 /nfs/dbraw/zinc/58/51/77/1043585177.db2.gz RLVIUNAOBQOGAY-HNNXBMFYSA-N 1 2 307.825 4.225 20 0 DIADLO CSCc1cnc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)s1 ZINC000353143098 1043587485 /nfs/dbraw/zinc/58/74/85/1043587485.db2.gz STUJPKQQDJEQGN-SNVBAGLBSA-N 1 2 324.437 4.169 20 0 DIADLO CSCc1cnc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)s1 ZINC000353143098 1043587492 /nfs/dbraw/zinc/58/74/92/1043587492.db2.gz STUJPKQQDJEQGN-SNVBAGLBSA-N 1 2 324.437 4.169 20 0 DIADLO FC(F)(F)c1cccc(Nc2ccc(N3CCCCC3)[nH+]c2)n1 ZINC000522248396 1043588371 /nfs/dbraw/zinc/58/83/71/1043588371.db2.gz CCAAQPRGSXTZQW-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO CSCc1cnc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)s1 ZINC000353143097 1043588510 /nfs/dbraw/zinc/58/85/10/1043588510.db2.gz STUJPKQQDJEQGN-JTQLQIEISA-N 1 2 324.437 4.169 20 0 DIADLO CSCc1cnc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)s1 ZINC000353143097 1043588521 /nfs/dbraw/zinc/58/85/21/1043588521.db2.gz STUJPKQQDJEQGN-JTQLQIEISA-N 1 2 324.437 4.169 20 0 DIADLO Cc1nn(-c2ccc(F)cc2)c(C)c1CNc1ccc(C)[nH+]c1C ZINC000353217053 1043591458 /nfs/dbraw/zinc/59/14/58/1043591458.db2.gz HGURLDTWJMJBMX-UHFFFAOYSA-N 1 2 324.403 4.252 20 0 DIADLO Cc1ccccc1C[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1ccco1 ZINC000926532343 1043595427 /nfs/dbraw/zinc/59/54/27/1043595427.db2.gz LJHBVOLXRSRZGH-RYQLBKOJSA-N 1 2 321.424 4.364 20 0 DIADLO CCCc1ncc(C[NH2+][C@H](C)c2cc(-c3ccccc3)no2)o1 ZINC000926536627 1043596527 /nfs/dbraw/zinc/59/65/27/1043596527.db2.gz GAPGBYYTWKTHTI-CYBMUJFWSA-N 1 2 311.385 4.133 20 0 DIADLO CCCc1ncc(C[NH2+][C@@H](CCC)c2ncccc2Cl)o1 ZINC000926539916 1043597439 /nfs/dbraw/zinc/59/74/39/1043597439.db2.gz XXFWFANTUKSYRF-AWEZNQCLSA-N 1 2 307.825 4.307 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccc(F)cc1N(C)C ZINC000777602340 1043602184 /nfs/dbraw/zinc/60/21/84/1043602184.db2.gz LIWXXZWENQMNTE-CYBMUJFWSA-N 1 2 301.409 4.131 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H](C)c2csnn2)cc2ccccc21 ZINC000926590018 1043604203 /nfs/dbraw/zinc/60/42/03/1043604203.db2.gz JCBCZPFEYHSKIY-NEPJUHHUSA-N 1 2 313.426 4.112 20 0 DIADLO CCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(C)on2)cc1OC ZINC000353427019 1043606632 /nfs/dbraw/zinc/60/66/32/1043606632.db2.gz OBRYJTLNLWFXOR-KBPBESRZSA-N 1 2 318.417 4.192 20 0 DIADLO C[C@H]([NH2+]C1(c2ccccc2F)CCC1)c1cn2c(n1)CCCC2 ZINC000926632985 1043609720 /nfs/dbraw/zinc/60/97/20/1043609720.db2.gz JAZBQPWHPKDMAX-AWEZNQCLSA-N 1 2 313.420 4.089 20 0 DIADLO CCc1nocc1C[N@H+](Cc1cccnc1)Cc1ccccc1C ZINC000353499831 1043611427 /nfs/dbraw/zinc/61/14/27/1043611427.db2.gz DLNCWYXDLHYJPF-UHFFFAOYSA-N 1 2 321.424 4.143 20 0 DIADLO CCc1nocc1C[N@@H+](Cc1cccnc1)Cc1ccccc1C ZINC000353499831 1043611432 /nfs/dbraw/zinc/61/14/32/1043611432.db2.gz DLNCWYXDLHYJPF-UHFFFAOYSA-N 1 2 321.424 4.143 20 0 DIADLO COc1c(C)cccc1C[NH2+][C@@H]1COCc2cccc(Cl)c21 ZINC000926664972 1043614628 /nfs/dbraw/zinc/61/46/28/1043614628.db2.gz AEBZYMADWDRUMV-MRXNPFEDSA-N 1 2 317.816 4.018 20 0 DIADLO Cc1noc([C@@H]2CCC[N@H+]2Cc2ccc(SC(C)C)cc2)n1 ZINC000353540780 1043615811 /nfs/dbraw/zinc/61/58/11/1043615811.db2.gz FVFXVFYDXPNCOV-INIZCTEOSA-N 1 2 317.458 4.216 20 0 DIADLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2ccc(SC(C)C)cc2)n1 ZINC000353540780 1043615822 /nfs/dbraw/zinc/61/58/22/1043615822.db2.gz FVFXVFYDXPNCOV-INIZCTEOSA-N 1 2 317.458 4.216 20 0 DIADLO CCc1nnc(C[NH2+][C@H](c2ccc(C)o2)C2CCCC2)s1 ZINC000353563641 1043617648 /nfs/dbraw/zinc/61/76/48/1043617648.db2.gz UMNGQXVUJLKQOU-INIZCTEOSA-N 1 2 305.447 4.023 20 0 DIADLO CSCc1cnc(C[N@H+](C)Cc2cccc(C)c2C)s1 ZINC000353584542 1043620002 /nfs/dbraw/zinc/62/00/02/1043620002.db2.gz HZRXDRRVWWPQME-UHFFFAOYSA-N 1 2 306.500 4.255 20 0 DIADLO CSCc1cnc(C[N@@H+](C)Cc2cccc(C)c2C)s1 ZINC000353584542 1043620021 /nfs/dbraw/zinc/62/00/21/1043620021.db2.gz HZRXDRRVWWPQME-UHFFFAOYSA-N 1 2 306.500 4.255 20 0 DIADLO Cc1nc(C[N@@H+]2CCSC[C@H]2c2ccc(C)cc2)c(C)s1 ZINC000443625363 1043624902 /nfs/dbraw/zinc/62/49/02/1043624902.db2.gz JWSDDDFQRTVNQQ-KRWDZBQOSA-N 1 2 318.511 4.358 20 0 DIADLO Cc1nc(C[N@H+]2CCSC[C@H]2c2ccc(C)cc2)c(C)s1 ZINC000443625363 1043624908 /nfs/dbraw/zinc/62/49/08/1043624908.db2.gz JWSDDDFQRTVNQQ-KRWDZBQOSA-N 1 2 318.511 4.358 20 0 DIADLO CC(C)Cc1ncc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)s1 ZINC000353698734 1043634522 /nfs/dbraw/zinc/63/45/22/1043634522.db2.gz PDMACKZNACQOSZ-KRWDZBQOSA-N 1 2 315.486 4.320 20 0 DIADLO CC(C)Cc1ncc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)s1 ZINC000353698734 1043634527 /nfs/dbraw/zinc/63/45/27/1043634527.db2.gz PDMACKZNACQOSZ-KRWDZBQOSA-N 1 2 315.486 4.320 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(-c3ccccc3)n[nH]2)[C@@H]1c1ccncc1 ZINC000353725249 1043635629 /nfs/dbraw/zinc/63/56/29/1043635629.db2.gz WKWHKIUALIOUBT-LJQANCHMSA-N 1 2 318.424 4.055 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(-c3ccccc3)n[nH]2)[C@@H]1c1ccncc1 ZINC000353725249 1043635637 /nfs/dbraw/zinc/63/56/37/1043635637.db2.gz WKWHKIUALIOUBT-LJQANCHMSA-N 1 2 318.424 4.055 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc(CF)cc3)CCCCCC2)no1 ZINC000777606720 1043640387 /nfs/dbraw/zinc/64/03/87/1043640387.db2.gz GEMKNFHXHZTFTR-UHFFFAOYSA-N 1 2 317.408 4.187 20 0 DIADLO CCCCC[C@H](C(=O)N1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1)C(C)C ZINC000125644855 1043646376 /nfs/dbraw/zinc/64/63/76/1043646376.db2.gz KDURGXDOLPKHOO-FGTMMUONSA-N 1 2 319.493 4.145 20 0 DIADLO Clc1cscc1C[NH2+][C@H]1COCc2cccc(Cl)c21 ZINC000926868476 1043646825 /nfs/dbraw/zinc/64/68/25/1043646825.db2.gz OTCPXLNZEYXWCE-ZDUSSCGKSA-N 1 2 314.237 4.416 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@H](Oc3ccccc3Cl)C2)c(C)s1 ZINC000443662847 1043651560 /nfs/dbraw/zinc/65/15/60/1043651560.db2.gz VXCGWYXLMKGZFL-ZDUSSCGKSA-N 1 2 322.861 4.067 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@H](Oc3ccccc3Cl)C2)c(C)s1 ZINC000443662847 1043651571 /nfs/dbraw/zinc/65/15/71/1043651571.db2.gz VXCGWYXLMKGZFL-ZDUSSCGKSA-N 1 2 322.861 4.067 20 0 DIADLO CC[N@H+](Cc1nc(C(F)(F)F)cs1)Cc1ccccc1C ZINC000443675122 1043657459 /nfs/dbraw/zinc/65/74/59/1043657459.db2.gz QTBIRHAWJLZZNQ-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CC[N@@H+](Cc1nc(C(F)(F)F)cs1)Cc1ccccc1C ZINC000443675122 1043657470 /nfs/dbraw/zinc/65/74/70/1043657470.db2.gz QTBIRHAWJLZZNQ-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CCc1cccc(F)c1C[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000474156376 1043671126 /nfs/dbraw/zinc/67/11/26/1043671126.db2.gz UTALBYGZACDJOE-MRXNPFEDSA-N 1 2 305.418 4.023 20 0 DIADLO CCc1cccc(F)c1C[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000474156376 1043671136 /nfs/dbraw/zinc/67/11/36/1043671136.db2.gz UTALBYGZACDJOE-MRXNPFEDSA-N 1 2 305.418 4.023 20 0 DIADLO CC[C@@H]1CCCC[C@H]1Nc1nc(C)[nH+]c(C)c1Br ZINC000322762554 1043679953 /nfs/dbraw/zinc/67/99/53/1043679953.db2.gz CQSRVTDRYATBAL-VXGBXAGGSA-N 1 2 312.255 4.237 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@H](C)c2cnn(C3CCC3)c2)c(F)c1 ZINC000927092774 1043683970 /nfs/dbraw/zinc/68/39/70/1043683970.db2.gz LVDMNFHHOYCMIY-GFCCVEGCSA-N 1 2 305.372 4.046 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1ccc(F)cc1F ZINC000927106543 1043686835 /nfs/dbraw/zinc/68/68/35/1043686835.db2.gz CRTILSIBJQQFDF-GOSISDBHSA-N 1 2 319.399 4.063 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1cc(Cl)ccc1Cl ZINC000927110820 1043688262 /nfs/dbraw/zinc/68/82/62/1043688262.db2.gz CPXGNAMVNOJDBO-SNVBAGLBSA-N 1 2 324.255 4.455 20 0 DIADLO Cn1nc(C[NH2+]C(c2ccccc2)c2ccccc2)cc1C1CC1 ZINC000927112907 1043688511 /nfs/dbraw/zinc/68/85/11/1043688511.db2.gz SVSMSWUZNRRIHZ-UHFFFAOYSA-N 1 2 317.436 4.177 20 0 DIADLO CCO[P@@](C)(=O)CC[C@@H](C)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000876518806 1043691767 /nfs/dbraw/zinc/69/17/67/1043691767.db2.gz KATDTAAHPGCOBS-JLCFBVMHSA-N 1 2 321.361 4.007 20 0 DIADLO CCO[P@@](C)(=O)CC[C@H](C)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000876518808 1043691910 /nfs/dbraw/zinc/69/19/10/1043691910.db2.gz KATDTAAHPGCOBS-RCDICMHDSA-N 1 2 321.361 4.007 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000876518805 1043692260 /nfs/dbraw/zinc/69/22/60/1043692260.db2.gz KATDTAAHPGCOBS-FPTDNZKUSA-N 1 2 321.361 4.007 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2ccc(Cl)nn2)C2CC2)o1 ZINC000876570203 1043695753 /nfs/dbraw/zinc/69/57/53/1043695753.db2.gz WMAHIWFAIOFOQR-NHYWBVRUSA-N 1 2 317.820 4.011 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2ccc(Cl)nn2)C2CC2)o1 ZINC000876570203 1043695761 /nfs/dbraw/zinc/69/57/61/1043695761.db2.gz WMAHIWFAIOFOQR-NHYWBVRUSA-N 1 2 317.820 4.011 20 0 DIADLO Fc1ccccc1-c1noc([C@H]2CCC[C@H](c3ccccc3)[NH2+]2)n1 ZINC001211883779 1043696735 /nfs/dbraw/zinc/69/67/35/1043696735.db2.gz BXDKFIVKIWZDOA-IAGOWNOFSA-N 1 2 323.371 4.432 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)cc3c2OCC3)n1 ZINC000927140393 1043697824 /nfs/dbraw/zinc/69/78/24/1043697824.db2.gz NQXGEQYKGZYZEB-GHMZBOCLSA-N 1 2 322.861 4.452 20 0 DIADLO CC(C)(C)OC1CC[NH+](Cc2c(Cl)cncc2Cl)CC1 ZINC000876636394 1043704254 /nfs/dbraw/zinc/70/42/54/1043704254.db2.gz WOVAFNOLZGTBKV-UHFFFAOYSA-N 1 2 317.260 4.168 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCc3sc(C)nc3C)c2c1 ZINC000354537747 1043706048 /nfs/dbraw/zinc/70/60/48/1043706048.db2.gz DDSAOTUGPWRINB-UHFFFAOYSA-N 1 2 314.410 4.204 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1coc2cc(F)ccc12 ZINC000354596366 1043709496 /nfs/dbraw/zinc/70/94/96/1043709496.db2.gz MXPAKHVRMQMULF-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO c1ccc(COc2ccc[nH+]c2NCCCc2ccccn2)cc1 ZINC000354576945 1043709647 /nfs/dbraw/zinc/70/96/47/1043709647.db2.gz OHBPDOAKEMCUHY-UHFFFAOYSA-N 1 2 319.408 4.100 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2ccc(Cl)nn2)o1 ZINC000876797489 1043709846 /nfs/dbraw/zinc/70/98/46/1043709846.db2.gz RDJKEVOIPDVPTN-BXUZGUMPSA-N 1 2 305.809 4.005 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2ccc(Cl)nn2)o1 ZINC000876797489 1043709859 /nfs/dbraw/zinc/70/98/59/1043709859.db2.gz RDJKEVOIPDVPTN-BXUZGUMPSA-N 1 2 305.809 4.005 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[N@H+](C)Cc1ccc(Cl)nn1 ZINC000876790133 1043710054 /nfs/dbraw/zinc/71/00/54/1043710054.db2.gz UDZZZASFFMEBJF-NSHDSACASA-N 1 2 324.881 4.211 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)Cc1ccc(Cl)nn1 ZINC000876790133 1043710063 /nfs/dbraw/zinc/71/00/63/1043710063.db2.gz UDZZZASFFMEBJF-NSHDSACASA-N 1 2 324.881 4.211 20 0 DIADLO COc1c(C)c[nH+]c(CNc2cccc([C@@H](C)OC)c2)c1C ZINC000876857220 1043719166 /nfs/dbraw/zinc/71/91/66/1043719166.db2.gz OCHLFPYEAUMHSZ-CQSZACIVSA-N 1 2 300.402 4.027 20 0 DIADLO Cc1cc(N[C@@H](C)c2cnn(-c3ccccc3)c2)ccc1[NH+](C)C ZINC000777641808 1043723697 /nfs/dbraw/zinc/72/36/97/1043723697.db2.gz VSNVCJLTUOPEQM-INIZCTEOSA-N 1 2 320.440 4.420 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)ccc1[NH+](C)C ZINC000777643625 1043725932 /nfs/dbraw/zinc/72/59/32/1043725932.db2.gz RYYXRDMNYUUUKJ-AWEZNQCLSA-N 1 2 323.440 4.119 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc(-n3cccn3)cc2)ccc1[NH+](C)C ZINC000777644052 1043726425 /nfs/dbraw/zinc/72/64/25/1043726425.db2.gz YJKXTGRWXDQFQL-INIZCTEOSA-N 1 2 320.440 4.420 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)c(F)c1 ZINC000777657003 1043727759 /nfs/dbraw/zinc/72/77/59/1043727759.db2.gz NPXXWTDYMMHDQG-CYBMUJFWSA-N 1 2 314.404 4.390 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)c(F)c1 ZINC000777657003 1043727773 /nfs/dbraw/zinc/72/77/73/1043727773.db2.gz NPXXWTDYMMHDQG-CYBMUJFWSA-N 1 2 314.404 4.390 20 0 DIADLO Clc1csc(C[NH2+][C@@H]2CCOc3c(Cl)cccc32)n1 ZINC000876964935 1043728950 /nfs/dbraw/zinc/72/89/50/1043728950.db2.gz VRYNBQCTFSSWDE-SNVBAGLBSA-N 1 2 315.225 4.063 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccc2c(c1)OCCO2 ZINC000777656816 1043729775 /nfs/dbraw/zinc/72/97/75/1043729775.db2.gz LLAYZDVCTLMDCR-CQSZACIVSA-N 1 2 324.424 4.013 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccc2c(c1)OCCO2 ZINC000777656816 1043729791 /nfs/dbraw/zinc/72/97/91/1043729791.db2.gz LLAYZDVCTLMDCR-CQSZACIVSA-N 1 2 324.424 4.013 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1nc(Cl)cs1 ZINC000876994529 1043731413 /nfs/dbraw/zinc/73/14/13/1043731413.db2.gz KSLCMTDVTFSCLT-GFCCVEGCSA-N 1 2 310.850 4.436 20 0 DIADLO Cc1nc2ccccc2nc1C[NH2+][C@H]1c2ccccc2CC[C@@H]1F ZINC000895692690 1043732113 /nfs/dbraw/zinc/73/21/13/1043732113.db2.gz VUEFNSHRFJRPRV-JXFKEZNVSA-N 1 2 321.399 4.053 20 0 DIADLO Cc1nc2ccccc2nc1C[NH2+][C@@H]1c2ccccc2CC[C@@H]1F ZINC000895692691 1043732669 /nfs/dbraw/zinc/73/26/69/1043732669.db2.gz VUEFNSHRFJRPRV-OXJNMPFZSA-N 1 2 321.399 4.053 20 0 DIADLO c1ccc2oc(C[NH2+][C@H]3CC4(CCC4)Oc4ccccc43)nc2c1 ZINC000877095255 1043741906 /nfs/dbraw/zinc/74/19/06/1043741906.db2.gz QDVLGUWUSZUENT-INIZCTEOSA-N 1 2 320.392 4.364 20 0 DIADLO c1ccc(-c2noc([C@@H]3CCC[C@H](c4ccccc4)[NH2+]3)n2)cc1 ZINC001211885414 1043748415 /nfs/dbraw/zinc/74/84/15/1043748415.db2.gz OLZGJRSRWDMUCD-SJORKVTESA-N 1 2 305.381 4.293 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1ccc(OC(F)F)cc1F ZINC000877170371 1043750594 /nfs/dbraw/zinc/75/05/94/1043750594.db2.gz MQYMSGGPPUETMG-LLVKDONJSA-N 1 2 310.319 4.015 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccc(OC(F)F)cc1F ZINC000877170371 1043750604 /nfs/dbraw/zinc/75/06/04/1043750604.db2.gz MQYMSGGPPUETMG-LLVKDONJSA-N 1 2 310.319 4.015 20 0 DIADLO c1ccc(-c2noc([C@H]3CCC[C@H](c4ccccc4)[NH2+]3)n2)cc1 ZINC001211885412 1043752167 /nfs/dbraw/zinc/75/21/67/1043752167.db2.gz OLZGJRSRWDMUCD-IAGOWNOFSA-N 1 2 305.381 4.293 20 0 DIADLO Clc1ccc2sc(C[N@@H+]3CCC[C@@H]3c3ncc[nH]3)cc2n1 ZINC000877344022 1043757387 /nfs/dbraw/zinc/75/73/87/1043757387.db2.gz CHNOJXBDSIDUQK-GFCCVEGCSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1ccc2sc(C[N@H+]3CCC[C@@H]3c3ncc[nH]3)cc2n1 ZINC000877344022 1043757400 /nfs/dbraw/zinc/75/74/00/1043757400.db2.gz CHNOJXBDSIDUQK-GFCCVEGCSA-N 1 2 318.833 4.010 20 0 DIADLO CCc1ncc(C[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)s1 ZINC000355298696 1043759707 /nfs/dbraw/zinc/75/97/07/1043759707.db2.gz XDAFPWCGHSKPAT-LJQANCHMSA-N 1 2 323.465 4.288 20 0 DIADLO FC(F)(F)c1ncc(C[N@@H+]2CCCc3ccccc3C2)s1 ZINC000355424398 1043765672 /nfs/dbraw/zinc/76/56/72/1043765672.db2.gz TYWCHRRLTPVZQY-UHFFFAOYSA-N 1 2 312.360 4.110 20 0 DIADLO FC(F)(F)c1ncc(C[N@H+]2CCCc3ccccc3C2)s1 ZINC000355424398 1043765682 /nfs/dbraw/zinc/76/56/82/1043765682.db2.gz TYWCHRRLTPVZQY-UHFFFAOYSA-N 1 2 312.360 4.110 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccc(Cl)nc1 ZINC000777702837 1043766026 /nfs/dbraw/zinc/76/60/26/1043766026.db2.gz AXABKKFTSSAWFR-CYBMUJFWSA-N 1 2 316.836 4.293 20 0 DIADLO CC(C)([NH2+]Cc1ccnc(Cl)c1F)c1ccc(F)cc1F ZINC000895856613 1043769072 /nfs/dbraw/zinc/76/90/72/1043769072.db2.gz ZTYHYZOJTVQZFE-UHFFFAOYSA-N 1 2 314.738 4.177 20 0 DIADLO CCCCc1noc(C[N@H+](CC)[C@H](C)c2ccc(F)cc2)n1 ZINC000053088680 1043770029 /nfs/dbraw/zinc/77/00/29/1043770029.db2.gz SEJKVJLCCAUDQD-CYBMUJFWSA-N 1 2 305.397 4.134 20 0 DIADLO CCCCc1noc(C[N@@H+](CC)[C@H](C)c2ccc(F)cc2)n1 ZINC000053088680 1043770043 /nfs/dbraw/zinc/77/00/43/1043770043.db2.gz SEJKVJLCCAUDQD-CYBMUJFWSA-N 1 2 305.397 4.134 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc3c(F)cccc3c2)[C@H]1c1cccnc1 ZINC000877545203 1043772060 /nfs/dbraw/zinc/77/20/60/1043772060.db2.gz GRZDAACWGHTYBZ-IBGZPJMESA-N 1 2 321.399 4.352 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc3c(F)cccc3c2)[C@H]1c1cccnc1 ZINC000877545203 1043772070 /nfs/dbraw/zinc/77/20/70/1043772070.db2.gz GRZDAACWGHTYBZ-IBGZPJMESA-N 1 2 321.399 4.352 20 0 DIADLO C[C@H]([NH2+]Cc1ccns1)c1ccc(C(F)(F)F)nc1Cl ZINC000877551272 1043775270 /nfs/dbraw/zinc/77/52/70/1043775270.db2.gz XZTPTCPFVGRSCO-ZETCQYMHSA-N 1 2 321.755 4.061 20 0 DIADLO Cc1cccc(CSCC(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000097040188 1043780862 /nfs/dbraw/zinc/78/08/62/1043780862.db2.gz LYBMCSAFKNOUTE-UHFFFAOYSA-N 1 2 314.454 4.187 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CCC[C@@H]2c2ccc(C)cc2)cs1 ZINC000355666767 1043783439 /nfs/dbraw/zinc/78/34/39/1043783439.db2.gz XOYGJGVJDCAUJW-RHSMWYFYSA-N 1 2 316.470 4.496 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CCC[C@@H]2c2ccc(C)cc2)cs1 ZINC000355666767 1043783451 /nfs/dbraw/zinc/78/34/51/1043783451.db2.gz XOYGJGVJDCAUJW-RHSMWYFYSA-N 1 2 316.470 4.496 20 0 DIADLO CC(C)([NH2+]Cc1cncc(F)c1)c1nc2cc(Cl)ccc2o1 ZINC000877668885 1043787354 /nfs/dbraw/zinc/78/73/54/1043787354.db2.gz PZXAYXOBLHIQAA-UHFFFAOYSA-N 1 2 319.767 4.040 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2coc(C(C)(C)C)n2)cc1 ZINC000929113185 1043790473 /nfs/dbraw/zinc/79/04/73/1043790473.db2.gz ZZTJZHBPUGOTGI-ZDUSSCGKSA-N 1 2 302.418 4.174 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2coc(C(C)(C)C)n2)cc1 ZINC000929113185 1043790484 /nfs/dbraw/zinc/79/04/84/1043790484.db2.gz ZZTJZHBPUGOTGI-ZDUSSCGKSA-N 1 2 302.418 4.174 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1nc2c(o1)CCCC2 ZINC000877891828 1043815835 /nfs/dbraw/zinc/81/58/35/1043815835.db2.gz HCWVUBUMUCSMSQ-CYBMUJFWSA-N 1 2 310.397 4.493 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nc2c(o1)CCCC2 ZINC000877891828 1043815859 /nfs/dbraw/zinc/81/58/59/1043815859.db2.gz HCWVUBUMUCSMSQ-CYBMUJFWSA-N 1 2 310.397 4.493 20 0 DIADLO Cc1cc(C)c2cc(NCc3nnc(C4CC4)s3)ccc2[nH+]1 ZINC000896065766 1043817728 /nfs/dbraw/zinc/81/77/28/1043817728.db2.gz RPPQVPXTFHFCOH-UHFFFAOYSA-N 1 2 310.426 4.193 20 0 DIADLO COC[C@H]([NH2+]Cc1cscc1C(F)(F)F)c1ccc(C)o1 ZINC000356197895 1043821340 /nfs/dbraw/zinc/82/13/40/1043821340.db2.gz WUGPUPXSBOHLAT-LBPRGKRZSA-N 1 2 319.348 4.146 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)[C@H](C)[N@H+](C)Cc1ccsc1 ZINC000877921136 1043825040 /nfs/dbraw/zinc/82/50/40/1043825040.db2.gz DYQXHJMPPNLAKC-LBPRGKRZSA-N 1 2 322.861 4.169 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)[C@H](C)[N@@H+](C)Cc1ccsc1 ZINC000877921136 1043825053 /nfs/dbraw/zinc/82/50/53/1043825053.db2.gz DYQXHJMPPNLAKC-LBPRGKRZSA-N 1 2 322.861 4.169 20 0 DIADLO Clc1cccc(-c2nc(C[NH+]3C4CCC3CC4)no2)c1Cl ZINC000877950805 1043829691 /nfs/dbraw/zinc/82/96/91/1043829691.db2.gz FUKGDAVCETZIHP-UHFFFAOYSA-N 1 2 324.211 4.170 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)co1 ZINC000929672537 1043832639 /nfs/dbraw/zinc/83/26/39/1043832639.db2.gz MGHRVGORPFMNJS-MRXNPFEDSA-N 1 2 316.470 4.262 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)co1 ZINC000929672537 1043832654 /nfs/dbraw/zinc/83/26/54/1043832654.db2.gz MGHRVGORPFMNJS-MRXNPFEDSA-N 1 2 316.470 4.262 20 0 DIADLO Cc1c[nH+]c(CN2C[C@@H](C)CSc3ccc(Cl)cc32)n1C ZINC000356335422 1043833961 /nfs/dbraw/zinc/83/39/61/1043833961.db2.gz DNRSOUCSCPPAIV-LLVKDONJSA-N 1 2 321.877 4.130 20 0 DIADLO CC(C)(C)SCCC[N@@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000877981258 1043835551 /nfs/dbraw/zinc/83/55/51/1043835551.db2.gz RNRJAHLHYZRDHS-AWEZNQCLSA-N 1 2 323.506 4.396 20 0 DIADLO CC(C)(C)SCCC[N@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000877981258 1043835574 /nfs/dbraw/zinc/83/55/74/1043835574.db2.gz RNRJAHLHYZRDHS-AWEZNQCLSA-N 1 2 323.506 4.396 20 0 DIADLO C[N@H+](Cc1nccn1Cc1ccccc1)Cc1ccccc1CF ZINC000929723318 1043835730 /nfs/dbraw/zinc/83/57/30/1043835730.db2.gz TYDLBGQRIHCLOY-UHFFFAOYSA-N 1 2 323.415 4.033 20 0 DIADLO C[N@@H+](Cc1nccn1Cc1ccccc1)Cc1ccccc1CF ZINC000929723318 1043835741 /nfs/dbraw/zinc/83/57/41/1043835741.db2.gz TYDLBGQRIHCLOY-UHFFFAOYSA-N 1 2 323.415 4.033 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1coc(C(C)(C)C)n1 ZINC000929766005 1043838343 /nfs/dbraw/zinc/83/83/43/1043838343.db2.gz HEDXHQIJMGJHMO-MRXNPFEDSA-N 1 2 301.434 4.038 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1coc(C(C)(C)C)n1 ZINC000929766005 1043838361 /nfs/dbraw/zinc/83/83/61/1043838361.db2.gz HEDXHQIJMGJHMO-MRXNPFEDSA-N 1 2 301.434 4.038 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(C(F)(F)F)co2)n1 ZINC000878197358 1043857422 /nfs/dbraw/zinc/85/74/22/1043857422.db2.gz DLLHVRCYZUVANJ-HNNXBMFYSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc(C(F)(F)F)co2)n1 ZINC000878197358 1043857439 /nfs/dbraw/zinc/85/74/39/1043857439.db2.gz DLLHVRCYZUVANJ-HNNXBMFYSA-N 1 2 310.319 4.339 20 0 DIADLO CC(C)(C)c1nc(C[NH2+]C2(c3ccc(F)cc3)CCC2)co1 ZINC000929956075 1043858933 /nfs/dbraw/zinc/85/89/33/1043858933.db2.gz QWKZCCINJVOSAG-UHFFFAOYSA-N 1 2 302.393 4.280 20 0 DIADLO CC(C)([NH2+]Cc1nc2c(o1)CCCC2)c1ccc(Cl)cc1 ZINC000878234148 1043859561 /nfs/dbraw/zinc/85/95/61/1043859561.db2.gz LNPYYGKXHXDTON-UHFFFAOYSA-N 1 2 304.821 4.232 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1noc2c1CC(C)(C)CC2 ZINC000878316230 1043869059 /nfs/dbraw/zinc/86/90/59/1043869059.db2.gz HICFMGJXHZPAHM-QGZVFWFLSA-N 1 2 313.445 4.168 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1noc2c1CC(C)(C)CC2 ZINC000878316230 1043869080 /nfs/dbraw/zinc/86/90/80/1043869080.db2.gz HICFMGJXHZPAHM-QGZVFWFLSA-N 1 2 313.445 4.168 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)s1 ZINC000289747417 1043871734 /nfs/dbraw/zinc/87/17/34/1043871734.db2.gz IXLQTSKSSYSQQY-OAHLLOKOSA-N 1 2 317.458 4.434 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)s1 ZINC000289747417 1043871752 /nfs/dbraw/zinc/87/17/52/1043871752.db2.gz IXLQTSKSSYSQQY-OAHLLOKOSA-N 1 2 317.458 4.434 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1noc2c1CC(C)(C)CC2 ZINC000878345573 1043872597 /nfs/dbraw/zinc/87/25/97/1043872597.db2.gz TWBYARFGNSUVBR-ZDUSSCGKSA-N 1 2 314.429 4.049 20 0 DIADLO C[C@H]([NH2+]Cc1nc2c(o1)CCCC2)c1cccc(C(F)(F)F)c1 ZINC000878346433 1043872775 /nfs/dbraw/zinc/87/27/75/1043872775.db2.gz ZKJIICWQJKIIRG-NSHDSACASA-N 1 2 324.346 4.423 20 0 DIADLO CC[C@@H]([NH2+]Cc1scnc1Cl)c1cc(F)ccc1F ZINC000878367058 1043878529 /nfs/dbraw/zinc/87/85/29/1043878529.db2.gz JAWWNGIOTLBNGF-LLVKDONJSA-N 1 2 302.777 4.316 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@H](C)c2cccnc2)sc1C(C)(C)C ZINC000930120188 1043879256 /nfs/dbraw/zinc/87/92/56/1043879256.db2.gz YNNVBLRPEOAKSW-CYBMUJFWSA-N 1 2 303.475 4.337 20 0 DIADLO Cc1nc(C[N@H+](C)[C@H](C)c2cccnc2)sc1C(C)(C)C ZINC000930120188 1043879280 /nfs/dbraw/zinc/87/92/80/1043879280.db2.gz YNNVBLRPEOAKSW-CYBMUJFWSA-N 1 2 303.475 4.337 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@H](C)c2ccncc2)sc1C(C)(C)C ZINC000930118350 1043880384 /nfs/dbraw/zinc/88/03/84/1043880384.db2.gz DHOQXHGTVADUMO-CYBMUJFWSA-N 1 2 303.475 4.337 20 0 DIADLO Cc1nc(C[N@H+](C)[C@H](C)c2ccncc2)sc1C(C)(C)C ZINC000930118350 1043880402 /nfs/dbraw/zinc/88/04/02/1043880402.db2.gz DHOQXHGTVADUMO-CYBMUJFWSA-N 1 2 303.475 4.337 20 0 DIADLO CC[C@H]([NH2+]Cc1scnc1Cl)c1cc(F)ccc1F ZINC000878367059 1043881135 /nfs/dbraw/zinc/88/11/35/1043881135.db2.gz JAWWNGIOTLBNGF-NSHDSACASA-N 1 2 302.777 4.316 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl ZINC000289810284 1043882119 /nfs/dbraw/zinc/88/21/19/1043882119.db2.gz IUFMUYMTTANHOA-QMMMGPOBSA-N 1 2 302.180 4.015 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl ZINC000289810284 1043882130 /nfs/dbraw/zinc/88/21/30/1043882130.db2.gz IUFMUYMTTANHOA-QMMMGPOBSA-N 1 2 302.180 4.015 20 0 DIADLO FC(F)(F)c1nc(C[N@@H+]2CC[C@H]3CCCC[C@@H]3C2)cs1 ZINC001141886151 1043884742 /nfs/dbraw/zinc/88/47/42/1043884742.db2.gz NNPSXBWWUXRVAL-GHMZBOCLSA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1nc(C[N@H+]2CC[C@H]3CCCC[C@@H]3C2)cs1 ZINC001141886151 1043884761 /nfs/dbraw/zinc/88/47/61/1043884761.db2.gz NNPSXBWWUXRVAL-GHMZBOCLSA-N 1 2 304.381 4.174 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](COCC(C)C)c2ccco2)nc1Cl ZINC000878408070 1043884786 /nfs/dbraw/zinc/88/47/86/1043884786.db2.gz IYQXQDYTFJJRTD-HNNXBMFYSA-N 1 2 322.836 4.140 20 0 DIADLO C[C@H]([NH2+]Cc1ncccc1N(C)C)c1cccc(Cl)c1Cl ZINC000289877618 1043889401 /nfs/dbraw/zinc/88/94/01/1043889401.db2.gz RWGXZQFRVLAQOS-NSHDSACASA-N 1 2 324.255 4.305 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(C(C)(C)C)n1)c1cccc(OC(F)F)c1 ZINC000930196599 1043889692 /nfs/dbraw/zinc/88/96/92/1043889692.db2.gz FIWBGYDNINAHJR-LLVKDONJSA-N 1 2 324.371 4.424 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]Cc2c(Cl)cncc2Cl)cn1 ZINC000878417413 1043890101 /nfs/dbraw/zinc/89/01/01/1043890101.db2.gz AEVYKSULTAVVEY-JTQLQIEISA-N 1 2 313.232 4.017 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2cc(C(F)(F)F)co2)C1 ZINC000878429154 1043891705 /nfs/dbraw/zinc/89/17/05/1043891705.db2.gz WAPHZKBWVVZJAS-XHDPSFHLSA-N 1 2 310.319 4.277 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cc(C(F)(F)F)co2)C1 ZINC000878429154 1043891723 /nfs/dbraw/zinc/89/17/23/1043891723.db2.gz WAPHZKBWVVZJAS-XHDPSFHLSA-N 1 2 310.319 4.277 20 0 DIADLO CCc1nnc(C[NH2+]Cc2cccc(-c3ccccc3C)c2)s1 ZINC000289909891 1043892108 /nfs/dbraw/zinc/89/21/08/1043892108.db2.gz UQKXWPGTWASXOH-UHFFFAOYSA-N 1 2 323.465 4.366 20 0 DIADLO CC[C@@H]([NH2+]Cc1coc(C(C)(C)C)n1)c1ccccc1OC ZINC000930202998 1043894192 /nfs/dbraw/zinc/89/41/92/1043894192.db2.gz YALJJILBSLRHTG-OAHLLOKOSA-N 1 2 302.418 4.222 20 0 DIADLO CC(C)n1cc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)cn1 ZINC000356940452 1043895589 /nfs/dbraw/zinc/89/55/89/1043895589.db2.gz XZMFZNPRGDJGAG-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)cn1 ZINC000356940452 1043895603 /nfs/dbraw/zinc/89/56/03/1043895603.db2.gz XZMFZNPRGDJGAG-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO C[C@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccc2ncsc2c1 ZINC000878458819 1043897079 /nfs/dbraw/zinc/89/70/79/1043897079.db2.gz XMYXKVZJIBZBGG-NSHDSACASA-N 1 2 313.426 4.014 20 0 DIADLO CC(C)(C)c1nc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)co1 ZINC000930223898 1043898669 /nfs/dbraw/zinc/89/86/69/1043898669.db2.gz YQKOOTFKZVTWTR-UHFFFAOYSA-N 1 2 304.821 4.404 20 0 DIADLO CC(C)c1nsc(C[NH2+]C(C)(C)c2cccc(Cl)c2)n1 ZINC000930224063 1043899843 /nfs/dbraw/zinc/89/98/43/1043899843.db2.gz ZOIAQKYPNCZZHG-UHFFFAOYSA-N 1 2 309.866 4.340 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(C(F)(F)F)co1 ZINC000878534221 1043901176 /nfs/dbraw/zinc/90/11/76/1043901176.db2.gz MDYJPQMNXLOODN-XVKPBYJWSA-N 1 2 301.230 4.071 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(C(F)(F)F)co1 ZINC000878534221 1043901187 /nfs/dbraw/zinc/90/11/87/1043901187.db2.gz MDYJPQMNXLOODN-XVKPBYJWSA-N 1 2 301.230 4.071 20 0 DIADLO C[C@H](c1cc2ccccc2o1)N(C)c1cc(N2CCCC2)[nH+]cn1 ZINC000561142134 1043901452 /nfs/dbraw/zinc/90/14/52/1043901452.db2.gz HPTZVTAIJFSAFW-CQSZACIVSA-N 1 2 322.412 4.020 20 0 DIADLO C[C@H](c1cc2ccccc2o1)N(C)c1cc(N2CCCC2)nc[nH+]1 ZINC000561142134 1043901461 /nfs/dbraw/zinc/90/14/61/1043901461.db2.gz HPTZVTAIJFSAFW-CQSZACIVSA-N 1 2 322.412 4.020 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1c(Cl)cncc1Cl ZINC000878613655 1043904986 /nfs/dbraw/zinc/90/49/86/1043904986.db2.gz TZLIORVOLMPHLF-UHFFFAOYSA-N 1 2 314.216 4.018 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2ccc(Cl)cc2)n1)c1ccccn1 ZINC000357093732 1043916276 /nfs/dbraw/zinc/91/62/76/1043916276.db2.gz LXXJYTKXUYKTDQ-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO COc1ccc([C@@H](Cc2ccccc2)[NH2+]Cc2ncc(C)o2)cc1 ZINC000290090891 1043919003 /nfs/dbraw/zinc/91/90/03/1043919003.db2.gz HWGAKWXJJOGAEY-LJQANCHMSA-N 1 2 322.408 4.065 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCC[C@H]1c1nccs1 ZINC001137139600 1043932710 /nfs/dbraw/zinc/93/27/10/1043932710.db2.gz KNJZAQBCJQVFAS-HNNXBMFYSA-N 1 2 302.443 4.267 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCC[C@H]1c1nccs1 ZINC001137139600 1043932718 /nfs/dbraw/zinc/93/27/18/1043932718.db2.gz KNJZAQBCJQVFAS-HNNXBMFYSA-N 1 2 302.443 4.267 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+](C)Cc1nc(-c2ccoc2)no1 ZINC000357266378 1043933554 /nfs/dbraw/zinc/93/35/54/1043933554.db2.gz HOEYAXCNQNJNMD-LLVKDONJSA-N 1 2 317.776 4.176 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1nc(-c2ccoc2)no1 ZINC000357266378 1043933557 /nfs/dbraw/zinc/93/35/57/1043933557.db2.gz HOEYAXCNQNJNMD-LLVKDONJSA-N 1 2 317.776 4.176 20 0 DIADLO Cc1cn(C)nc1C[NH2+][C@@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000930507487 1043936274 /nfs/dbraw/zinc/93/62/74/1043936274.db2.gz GZQSTWZSGCWSQO-MRXNPFEDSA-N 1 2 324.255 4.276 20 0 DIADLO CC(C)[C@@H]1CC[C@H](Nc2ccc(Cn3cc[nH+]c3)cn2)C[C@H]1C ZINC000561398237 1043943752 /nfs/dbraw/zinc/94/37/52/1043943752.db2.gz RPSPANMUSJUGPU-NJAFHUGGSA-N 1 2 312.461 4.199 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccc(F)c(Cl)c1)C1CC1)c1ncccn1 ZINC000930610717 1043947256 /nfs/dbraw/zinc/94/72/56/1043947256.db2.gz DUIQDUAZNQALFE-ZUZCIYMTSA-N 1 2 305.784 4.071 20 0 DIADLO Cc1noc(C)c1C[NH2+]C(C)(C)c1nc2cc(Cl)ccc2o1 ZINC000879158864 1043948196 /nfs/dbraw/zinc/94/81/96/1043948196.db2.gz YTTSVMHFMVCXEX-UHFFFAOYSA-N 1 2 319.792 4.111 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1cc2ccccc2nc1Cl ZINC000127571828 1043950486 /nfs/dbraw/zinc/95/04/86/1043950486.db2.gz NBKRSLXCEMRIFP-ZDUSSCGKSA-N 1 2 311.816 4.476 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1cc2ccccc2nc1Cl ZINC000127571828 1043950500 /nfs/dbraw/zinc/95/05/00/1043950500.db2.gz NBKRSLXCEMRIFP-ZDUSSCGKSA-N 1 2 311.816 4.476 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1ccc(Cl)c(F)c1 ZINC000127677374 1043957465 /nfs/dbraw/zinc/95/74/65/1043957465.db2.gz SUMPWKQNXDQWPV-UHFFFAOYSA-N 1 2 305.205 4.221 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1ccc(Cl)c(F)c1 ZINC000127677374 1043957475 /nfs/dbraw/zinc/95/74/75/1043957475.db2.gz SUMPWKQNXDQWPV-UHFFFAOYSA-N 1 2 305.205 4.221 20 0 DIADLO Cc1cc([C@H](C)[NH2+]C2(c3cccc(Br)c3)CC2)no1 ZINC000290606512 1043967001 /nfs/dbraw/zinc/96/70/01/1043967001.db2.gz HQELETDJZFUSTI-NSHDSACASA-N 1 2 321.218 4.085 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](Cc3cccnc3)C(C)C)co2)cc1 ZINC000357613455 1043969418 /nfs/dbraw/zinc/96/94/18/1043969418.db2.gz NBVGLXQAWFCSED-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](Cc3cccnc3)C(C)C)co2)cc1 ZINC000357613455 1043969425 /nfs/dbraw/zinc/96/94/25/1043969425.db2.gz NBVGLXQAWFCSED-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)[C@H](C)c3cccnc3)co2)cc1 ZINC000357612252 1043970007 /nfs/dbraw/zinc/97/00/07/1043970007.db2.gz JISCQDLUKCGDCQ-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)[C@H](C)c3cccnc3)co2)cc1 ZINC000357612252 1043970016 /nfs/dbraw/zinc/97/00/16/1043970016.db2.gz JISCQDLUKCGDCQ-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1nc(C[N@@H+]2CCSC[C@H]2c2ccc(C)cc2)sc1C ZINC000357704323 1043975402 /nfs/dbraw/zinc/97/54/02/1043975402.db2.gz GUEFBLAJRGBHHJ-INIZCTEOSA-N 1 2 318.511 4.358 20 0 DIADLO Cc1nc(C[N@H+]2CCSC[C@H]2c2ccc(C)cc2)sc1C ZINC000357704323 1043975411 /nfs/dbraw/zinc/97/54/11/1043975411.db2.gz GUEFBLAJRGBHHJ-INIZCTEOSA-N 1 2 318.511 4.358 20 0 DIADLO Cc1cncc([C@H]2CCC[N@@H+]2Cc2cccnc2C(F)(F)F)c1 ZINC000879752917 1043989978 /nfs/dbraw/zinc/98/99/78/1043989978.db2.gz WEVXJMSHFMUBSF-OAHLLOKOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cncc([C@H]2CCC[N@H+]2Cc2cccnc2C(F)(F)F)c1 ZINC000879752917 1043989986 /nfs/dbraw/zinc/98/99/86/1043989986.db2.gz WEVXJMSHFMUBSF-OAHLLOKOSA-N 1 2 321.346 4.141 20 0 DIADLO CC[C@H]1CCC[N@H+]1Cc1cc(F)c(Br)cc1F ZINC001141915690 1044015034 /nfs/dbraw/zinc/01/50/34/1044015034.db2.gz MTUBBYRLLBXHKT-JTQLQIEISA-N 1 2 304.178 4.102 20 0 DIADLO CC(C)c1cc([C@H]2CCC[N@H+](Cc3cnc(Cl)s3)C2)n[nH]1 ZINC000879919726 1044001974 /nfs/dbraw/zinc/00/19/74/1044001974.db2.gz SSCGQHKRYXZLHT-NSHDSACASA-N 1 2 324.881 4.023 20 0 DIADLO CC(C)c1cc([C@H]2CCC[N@@H+](Cc3cnc(Cl)s3)C2)n[nH]1 ZINC000879919726 1044001991 /nfs/dbraw/zinc/00/19/91/1044001991.db2.gz SSCGQHKRYXZLHT-NSHDSACASA-N 1 2 324.881 4.023 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2ccnc(Cl)c2Cl)s1 ZINC000290955257 1044002960 /nfs/dbraw/zinc/00/29/60/1044002960.db2.gz VPUHQXGATUFXGK-UHFFFAOYSA-N 1 2 316.257 4.178 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2coc(-c3cccs3)n2)C1 ZINC000880001071 1044003398 /nfs/dbraw/zinc/00/33/98/1044003398.db2.gz PLMPAFOLODCJTE-CYBMUJFWSA-N 1 2 316.348 4.177 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2coc(-c3cccs3)n2)C1 ZINC000880001071 1044003406 /nfs/dbraw/zinc/00/34/06/1044003406.db2.gz PLMPAFOLODCJTE-CYBMUJFWSA-N 1 2 316.348 4.177 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CC[C@@](C)(C(F)(F)F)C2)n1 ZINC000880002459 1044003508 /nfs/dbraw/zinc/00/35/08/1044003508.db2.gz KTIMHSKGWSOBDH-CQSZACIVSA-N 1 2 303.372 4.019 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CC[C@@](C)(C(F)(F)F)C2)n1 ZINC000880002459 1044003522 /nfs/dbraw/zinc/00/35/22/1044003522.db2.gz KTIMHSKGWSOBDH-CQSZACIVSA-N 1 2 303.372 4.019 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2ncc(-c3cccs3)o2)C1 ZINC000880000125 1044003703 /nfs/dbraw/zinc/00/37/03/1044003703.db2.gz FNOADVFGZJULTQ-CYBMUJFWSA-N 1 2 316.348 4.177 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ncc(-c3cccs3)o2)C1 ZINC000880000125 1044003716 /nfs/dbraw/zinc/00/37/16/1044003716.db2.gz FNOADVFGZJULTQ-CYBMUJFWSA-N 1 2 316.348 4.177 20 0 DIADLO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1csc(C(F)(F)F)n1 ZINC000896803522 1044010457 /nfs/dbraw/zinc/01/04/57/1044010457.db2.gz JALNEJQPJZEYQB-VIFPVBQESA-N 1 2 318.339 4.460 20 0 DIADLO CC[C@H]1CCC[N@@H+]1Cc1cc(F)c(Br)cc1F ZINC001141915690 1044015018 /nfs/dbraw/zinc/01/50/18/1044015018.db2.gz MTUBBYRLLBXHKT-JTQLQIEISA-N 1 2 304.178 4.102 20 0 DIADLO FC(F)[C@@H]([NH2+]CCC[C@H]1CCOC1)c1cccc(Cl)c1 ZINC000880534675 1044046969 /nfs/dbraw/zinc/04/69/69/1044046969.db2.gz UHXWOGOWRCXZGT-FZMZJTMJSA-N 1 2 303.780 4.053 20 0 DIADLO CCc1nnc(C[NH2+]Cc2ccc(C3CCCC3)cc2)s1 ZINC000291088277 1044022596 /nfs/dbraw/zinc/02/25/96/1044022596.db2.gz WUICMFAKWGMSML-UHFFFAOYSA-N 1 2 301.459 4.048 20 0 DIADLO Cc1ccc(C[S@](=O)CCC2C[C@H](C)C[C@@H](C)C2)c(C)[nH+]1 ZINC000358159108 1044025333 /nfs/dbraw/zinc/02/53/33/1044025333.db2.gz YBAVRQDIHGBEFB-ZMOMAAQPSA-N 1 2 307.503 4.410 20 0 DIADLO CCC(C)(C)c1ccc(C[NH2+]C2(c3ncccn3)CCC2)cc1 ZINC000880366748 1044031217 /nfs/dbraw/zinc/03/12/17/1044031217.db2.gz STLWPHYADIJJMJ-UHFFFAOYSA-N 1 2 309.457 4.333 20 0 DIADLO c1cc(-c2ccc(C[NH2+]C3(c4ncccn4)CCC3)cc2)cs1 ZINC000880366321 1044031648 /nfs/dbraw/zinc/03/16/48/1044031648.db2.gz GDXRUKUGLZZNPH-UHFFFAOYSA-N 1 2 321.449 4.374 20 0 DIADLO c1csc(-c2ccc(C[NH2+]C3(c4ncccn4)CCC3)cc2)c1 ZINC000880366373 1044032304 /nfs/dbraw/zinc/03/23/04/1044032304.db2.gz IBDRPKZLMJVPLE-UHFFFAOYSA-N 1 2 321.449 4.374 20 0 DIADLO Cc1cccc(NC(=O)C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)c1 ZINC000561962527 1044037809 /nfs/dbraw/zinc/03/78/09/1044037809.db2.gz ANTCXNNOTJVURK-QGZVFWFLSA-N 1 2 314.454 4.078 20 0 DIADLO Cc1cccc(NC(=O)C[N@H+]2CC(C)(C)[C@H]2c2cccs2)c1 ZINC000561962527 1044037823 /nfs/dbraw/zinc/03/78/23/1044037823.db2.gz ANTCXNNOTJVURK-QGZVFWFLSA-N 1 2 314.454 4.078 20 0 DIADLO Clc1ccccc1O[C@H]1CC[N@H+](Cc2cccnc2Cl)C1 ZINC000128470783 1044044006 /nfs/dbraw/zinc/04/40/06/1044044006.db2.gz QDPFHKVNEXPULR-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccccc1O[C@H]1CC[N@@H+](Cc2cccnc2Cl)C1 ZINC000128470783 1044044021 /nfs/dbraw/zinc/04/40/21/1044044021.db2.gz QDPFHKVNEXPULR-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO C[C@@H]1C[C@@H](C[NH2+][C@H](c2cccc(Cl)c2)C(F)F)CCO1 ZINC000880533968 1044045441 /nfs/dbraw/zinc/04/54/41/1044045441.db2.gz JRARTSRRTNOYIM-UHIISALHSA-N 1 2 303.780 4.051 20 0 DIADLO C[C@@H]1C[C@H](C[NH2+][C@H](c2cccc(Cl)c2)C(F)F)CCO1 ZINC000880533966 1044047104 /nfs/dbraw/zinc/04/71/04/1044047104.db2.gz JRARTSRRTNOYIM-JTNHKYCSSA-N 1 2 303.780 4.051 20 0 DIADLO Cc1ccc([C@H]2COCC[N@@H+]2Cc2cccc3ccccc32)o1 ZINC000522659089 1044063967 /nfs/dbraw/zinc/06/39/67/1044063967.db2.gz DQEXHYAQMYNUNZ-LJQANCHMSA-N 1 2 307.393 4.315 20 0 DIADLO Cc1ccc([C@H]2COCC[N@H+]2Cc2cccc3ccccc32)o1 ZINC000522659089 1044063980 /nfs/dbraw/zinc/06/39/80/1044063980.db2.gz DQEXHYAQMYNUNZ-LJQANCHMSA-N 1 2 307.393 4.315 20 0 DIADLO Cc1ccc(CSc2nncn2[C@H](C)c2ccccc2)c(C)[nH+]1 ZINC000358590917 1044086747 /nfs/dbraw/zinc/08/67/47/1044086747.db2.gz LIPKXVGQVMLTFR-OAHLLOKOSA-N 1 2 324.453 4.192 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@H]2CCc3sc(Cl)cc32)[nH+]1 ZINC000562237494 1044088814 /nfs/dbraw/zinc/08/88/14/1044088814.db2.gz ZWRQIPWWPJTXHP-JTQLQIEISA-N 1 2 304.806 4.081 20 0 DIADLO C[C@@H]1CCSCC[N@@H+]1Cc1c(F)cccc1OC(F)(F)F ZINC001308687137 1044089059 /nfs/dbraw/zinc/08/90/59/1044089059.db2.gz HRFZIMUUCVKDEX-SNVBAGLBSA-N 1 2 323.355 4.052 20 0 DIADLO C[C@@H]1CCSCC[N@H+]1Cc1c(F)cccc1OC(F)(F)F ZINC001308687137 1044089073 /nfs/dbraw/zinc/08/90/73/1044089073.db2.gz HRFZIMUUCVKDEX-SNVBAGLBSA-N 1 2 323.355 4.052 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1ccc(Oc2ccccc2)nn1 ZINC000346335148 1044093346 /nfs/dbraw/zinc/09/33/46/1044093346.db2.gz YKAPPYQETKSWKT-AWEZNQCLSA-N 1 2 309.369 4.055 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccc(Oc2ccccc2)nn1 ZINC000346335148 1044093360 /nfs/dbraw/zinc/09/33/60/1044093360.db2.gz YKAPPYQETKSWKT-AWEZNQCLSA-N 1 2 309.369 4.055 20 0 DIADLO CC(C)([NH2+]Cc1nccn1Cc1ccccc1)c1ccccc1F ZINC000291698603 1044096293 /nfs/dbraw/zinc/09/62/93/1044096293.db2.gz JZDQCGLNGAQOIW-UHFFFAOYSA-N 1 2 323.415 4.095 20 0 DIADLO CCC[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1cccnc1 ZINC000281109039 1044097113 /nfs/dbraw/zinc/09/71/13/1044097113.db2.gz LRGVYMYPYMNVNJ-AWEZNQCLSA-N 1 2 312.310 4.269 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+]1CCC(F)(F)[C@@H](CO)C1 ZINC000291768589 1044101674 /nfs/dbraw/zinc/10/16/74/1044101674.db2.gz LPBUSXRQLMATHJ-VHSXEESVSA-N 1 2 324.198 4.004 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+]1CCC(F)(F)[C@@H](CO)C1 ZINC000291768589 1044101679 /nfs/dbraw/zinc/10/16/79/1044101679.db2.gz LPBUSXRQLMATHJ-VHSXEESVSA-N 1 2 324.198 4.004 20 0 DIADLO Cc1cccc([C@@H](C)C[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)c1 ZINC000562340580 1044102824 /nfs/dbraw/zinc/10/28/24/1044102824.db2.gz KZFLUDRCUOMVSR-YJBOKZPZSA-N 1 2 312.461 4.128 20 0 DIADLO c1cc2c(s1)CCC[C@@H]2[NH2+][C@H](c1nnc[nH]1)C1CCCCC1 ZINC000562340375 1044103020 /nfs/dbraw/zinc/10/30/20/1044103020.db2.gz FIUYKRZNCRZMME-HOCLYGCPSA-N 1 2 316.474 4.155 20 0 DIADLO c1cc2c(s1)CCC[C@H]2[NH2+][C@H](c1nnc[nH]1)C1CCCCC1 ZINC000562340376 1044103487 /nfs/dbraw/zinc/10/34/87/1044103487.db2.gz FIUYKRZNCRZMME-ZBFHGGJFSA-N 1 2 316.474 4.155 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1cnc2ccccc2c1 ZINC000281238873 1044108235 /nfs/dbraw/zinc/10/82/35/1044108235.db2.gz WGDQEJZIMYKRSL-IBGZPJMESA-N 1 2 320.440 4.178 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1cnc2ccccc2c1 ZINC000281238873 1044108243 /nfs/dbraw/zinc/10/82/43/1044108243.db2.gz WGDQEJZIMYKRSL-IBGZPJMESA-N 1 2 320.440 4.178 20 0 DIADLO c1ccc2c(c1)OC1(CCC1)C[C@H]2[NH2+]Cc1nc2c(o1)CCCC2 ZINC000932213571 1044110368 /nfs/dbraw/zinc/11/03/68/1044110368.db2.gz XPLGJLOEMUFNRK-MRXNPFEDSA-N 1 2 324.424 4.090 20 0 DIADLO Cc1nnsc1C[N@@H+](Cc1ccc(C(C)C)cc1)C1CC1 ZINC000562478872 1044118129 /nfs/dbraw/zinc/11/81/29/1044118129.db2.gz QCYCCJFYGCQGDB-UHFFFAOYSA-N 1 2 301.459 4.135 20 0 DIADLO Cc1nnsc1C[N@H+](Cc1ccc(C(C)C)cc1)C1CC1 ZINC000562478872 1044118137 /nfs/dbraw/zinc/11/81/37/1044118137.db2.gz QCYCCJFYGCQGDB-UHFFFAOYSA-N 1 2 301.459 4.135 20 0 DIADLO CC(C)CCc1nc(C[NH2+][C@@H](c2ccccn2)C2CC2)cs1 ZINC000932381285 1044121306 /nfs/dbraw/zinc/12/13/06/1044121306.db2.gz MGOGYKZGUNZIFE-GOSISDBHSA-N 1 2 315.486 4.368 20 0 DIADLO Fc1ccc(-c2nc(C[NH2+][C@@H](c3ccccn3)C3CC3)co2)cc1 ZINC000932382098 1044121346 /nfs/dbraw/zinc/12/13/46/1044121346.db2.gz SEAULPYOHLSGDJ-GOSISDBHSA-N 1 2 323.371 4.117 20 0 DIADLO c1csc(-c2cc(C[NH2+][C@H](c3ccccn3)C3CC3)no2)c1 ZINC000932375802 1044121903 /nfs/dbraw/zinc/12/19/03/1044121903.db2.gz YQIUBOANIACXDZ-KRWDZBQOSA-N 1 2 311.410 4.039 20 0 DIADLO Fc1ccccc1-c1nc(C[NH2+][C@H](c2ccccn2)C2CC2)co1 ZINC000932381656 1044122360 /nfs/dbraw/zinc/12/23/60/1044122360.db2.gz AXJYIIGBNIWBOR-SFHVURJKSA-N 1 2 323.371 4.117 20 0 DIADLO c1sc(C2CCCC2)nc1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC000932381963 1044122379 /nfs/dbraw/zinc/12/23/79/1044122379.db2.gz OEKXFZUPOBQLJE-KRWDZBQOSA-N 1 2 313.470 4.437 20 0 DIADLO c1csc(-c2cnc(C[NH2+][C@@H](c3ccccn3)C3CC3)o2)c1 ZINC000932382484 1044123609 /nfs/dbraw/zinc/12/36/09/1044123609.db2.gz UDQFHDRZHLYJHP-QGZVFWFLSA-N 1 2 311.410 4.039 20 0 DIADLO COC(C)(C)CCSCc1ccc(-n2cc[nH+]c2)cc1C ZINC000359073768 1044126491 /nfs/dbraw/zinc/12/64/91/1044126491.db2.gz WAHOGZDLNRBLID-UHFFFAOYSA-N 1 2 304.459 4.229 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cnc(-c3ccccc3)nc2)c1 ZINC000562542048 1044127941 /nfs/dbraw/zinc/12/79/41/1044127941.db2.gz CAAAPFXLOFSMDO-UHFFFAOYSA-N 1 2 321.399 4.223 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cnc(-c3ccccc3)nc2)c1 ZINC000562542048 1044127947 /nfs/dbraw/zinc/12/79/47/1044127947.db2.gz CAAAPFXLOFSMDO-UHFFFAOYSA-N 1 2 321.399 4.223 20 0 DIADLO CC(C)C[N@H+](Cc1ncc(C(C)(C)C)o1)Cc1ccccn1 ZINC000932442887 1044130570 /nfs/dbraw/zinc/13/05/70/1044130570.db2.gz YAJSADRBYOIIBX-UHFFFAOYSA-N 1 2 301.434 4.025 20 0 DIADLO CC(C)C[N@@H+](Cc1ncc(C(C)(C)C)o1)Cc1ccccn1 ZINC000932442887 1044130579 /nfs/dbraw/zinc/13/05/79/1044130579.db2.gz YAJSADRBYOIIBX-UHFFFAOYSA-N 1 2 301.434 4.025 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1cncc(Cl)c1Cl ZINC001308745965 1044143443 /nfs/dbraw/zinc/14/34/43/1044143443.db2.gz JMURROCWSURBAB-CQSZACIVSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cncc(Cl)c1Cl ZINC001308745965 1044143447 /nfs/dbraw/zinc/14/34/47/1044143447.db2.gz JMURROCWSURBAB-CQSZACIVSA-N 1 2 310.228 4.367 20 0 DIADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+]Cc1cscn1 ZINC000444013060 1044154191 /nfs/dbraw/zinc/15/41/91/1044154191.db2.gz UMWKZJWHYQSNPK-CYBMUJFWSA-N 1 2 300.349 4.235 20 0 DIADLO CCc1nc(C)c(CNc2cc[nH+]c3c(Cl)cccc23)o1 ZINC000292396830 1044168642 /nfs/dbraw/zinc/16/86/42/1044168642.db2.gz UOIOASAJDOKUPS-UHFFFAOYSA-N 1 2 301.777 4.359 20 0 DIADLO C[C@H]1CC[C@]2(CC[N@H+](Cc3nc(C(F)(F)F)cs3)C2)C1 ZINC000359568936 1044179049 /nfs/dbraw/zinc/17/90/49/1044179049.db2.gz YMIHFYUOGYBNQS-GWCFXTLKSA-N 1 2 304.381 4.174 20 0 DIADLO C[C@H]1CC[C@]2(CC[N@@H+](Cc3nc(C(F)(F)F)cs3)C2)C1 ZINC000359568936 1044179051 /nfs/dbraw/zinc/17/90/51/1044179051.db2.gz YMIHFYUOGYBNQS-GWCFXTLKSA-N 1 2 304.381 4.174 20 0 DIADLO C[C@@H]1CC[C@]2(CC[N@H+](Cc3nc(C(F)(F)F)cs3)C2)C1 ZINC000359568938 1044179460 /nfs/dbraw/zinc/17/94/60/1044179460.db2.gz YMIHFYUOGYBNQS-MFKMUULPSA-N 1 2 304.381 4.174 20 0 DIADLO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3nc(C(F)(F)F)cs3)C2)C1 ZINC000359568938 1044179463 /nfs/dbraw/zinc/17/94/63/1044179463.db2.gz YMIHFYUOGYBNQS-MFKMUULPSA-N 1 2 304.381 4.174 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ccco2)Cc2cncc(F)c2)c1 ZINC000346982802 1044179884 /nfs/dbraw/zinc/17/98/84/1044179884.db2.gz MXKMEFXJBLQAOJ-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ccco2)Cc2cncc(F)c2)c1 ZINC000346982802 1044179890 /nfs/dbraw/zinc/17/98/90/1044179890.db2.gz MXKMEFXJBLQAOJ-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Fc1ccc(-c2nc(C[N@@H+]3CCC[C@H]3c3cccnc3)co2)cc1 ZINC000346994264 1044182314 /nfs/dbraw/zinc/18/23/14/1044182314.db2.gz ZYWKMFTXDCUNNX-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(-c2nc(C[N@H+]3CCC[C@H]3c3cccnc3)co2)cc1 ZINC000346994264 1044182321 /nfs/dbraw/zinc/18/23/21/1044182321.db2.gz ZYWKMFTXDCUNNX-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO Cc1cccc(C[N@H+](Cc2cncc(F)c2)Cc2ccccn2)c1 ZINC000346996373 1044182990 /nfs/dbraw/zinc/18/29/90/1044182990.db2.gz LXTOXPGBXSIEGX-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2cncc(F)c2)Cc2ccccn2)c1 ZINC000346996373 1044182999 /nfs/dbraw/zinc/18/29/99/1044182999.db2.gz LXTOXPGBXSIEGX-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1ncc(C3CC3)o1)[C@@H]2C ZINC000359637487 1044184742 /nfs/dbraw/zinc/18/47/42/1044184742.db2.gz QEGVRUWXPFQAGC-CHWSQXEVSA-N 1 2 312.413 4.068 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1ncc(C3CC3)o1)[C@@H]2C ZINC000359637487 1044184750 /nfs/dbraw/zinc/18/47/50/1044184750.db2.gz QEGVRUWXPFQAGC-CHWSQXEVSA-N 1 2 312.413 4.068 20 0 DIADLO Fc1cncc([C@H]([NH2+]Cc2coc(-c3ccccc3)n2)C2CC2)c1 ZINC000281747936 1044186475 /nfs/dbraw/zinc/18/64/75/1044186475.db2.gz VWDHEDWHEYHHHS-GOSISDBHSA-N 1 2 323.371 4.117 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nccn1C)c1ccc(F)cc1)c1cccs1 ZINC000359729124 1044194267 /nfs/dbraw/zinc/19/42/67/1044194267.db2.gz JPLVFJWQBQUUOE-MLGOLLRUSA-N 1 2 315.417 4.061 20 0 DIADLO CCC[C@@H]1C[N@H+](Cc2ccc(SC(F)F)cc2)CCO1 ZINC000759419485 1044196219 /nfs/dbraw/zinc/19/62/19/1044196219.db2.gz ICQJNMRUHFXBKF-CYBMUJFWSA-N 1 2 301.402 4.002 20 0 DIADLO CCC[C@@H]1C[N@@H+](Cc2ccc(SC(F)F)cc2)CCO1 ZINC000759419485 1044196229 /nfs/dbraw/zinc/19/62/29/1044196229.db2.gz ICQJNMRUHFXBKF-CYBMUJFWSA-N 1 2 301.402 4.002 20 0 DIADLO CC(C)c1cc(N2CC[C@@H](c3nccs3)C2)nc(C(C)C)[nH+]1 ZINC000882858476 1044198633 /nfs/dbraw/zinc/19/86/33/1044198633.db2.gz IEBXYZTUNZVFHR-CYBMUJFWSA-N 1 2 316.474 4.174 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2ccc(OC)c(C)c2)n1 ZINC000933490062 1044199241 /nfs/dbraw/zinc/19/92/41/1044199241.db2.gz QFPKEOSHHVPZDC-KGLIPLIRSA-N 1 2 317.433 4.141 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1nc(C(C)C)c[nH]1 ZINC000882895346 1044203052 /nfs/dbraw/zinc/20/30/52/1044203052.db2.gz KOPQPODKEHFXQJ-CQSZACIVSA-N 1 2 301.434 4.171 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1nc(C(C)C)c[nH]1 ZINC000882895345 1044203994 /nfs/dbraw/zinc/20/39/94/1044203994.db2.gz KOPQPODKEHFXQJ-AWEZNQCLSA-N 1 2 301.434 4.171 20 0 DIADLO CCSCc1cc[nH+]c(N[C@@H](COC)Cc2ccccc2)c1 ZINC000347196960 1044208215 /nfs/dbraw/zinc/20/82/15/1044208215.db2.gz CGWAQUUWMWAEKX-QGZVFWFLSA-N 1 2 316.470 4.004 20 0 DIADLO CCC[C@H]([NH2+]Cc1nc(C(C)C)c[nH]1)c1ccc(F)cc1F ZINC000883040994 1044216945 /nfs/dbraw/zinc/21/69/45/1044216945.db2.gz VERRDKAKDSXOGZ-HNNXBMFYSA-N 1 2 307.388 4.442 20 0 DIADLO CCC[C@@H]([NH2+][C@@H](C)c1cc(C)n(C)n1)c1ccc(F)cc1F ZINC000281957365 1044222512 /nfs/dbraw/zinc/22/25/12/1044222512.db2.gz AVFDTDOUMKJQAI-BLLLJJGKSA-N 1 2 307.388 4.199 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+][C@H]2CC(C)(C)Oc3ccc(F)cc32)n1 ZINC000883158134 1044224656 /nfs/dbraw/zinc/22/46/56/1044224656.db2.gz VKHGRUVLINRIOU-AWEZNQCLSA-N 1 2 317.408 4.064 20 0 DIADLO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1nc(C(C)C)c[nH]1 ZINC000883150528 1044225667 /nfs/dbraw/zinc/22/56/67/1044225667.db2.gz KWZHFCQFRJVBRM-UHFFFAOYSA-N 1 2 321.852 4.220 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C1CC2(CCC2)C1 ZINC000563170949 1044227442 /nfs/dbraw/zinc/22/74/42/1044227442.db2.gz WAHKGSJZKCRDOB-UHFFFAOYSA-N 1 2 315.804 4.045 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[NH2+][C@@H](C)c1cncs1 ZINC000934199011 1044231519 /nfs/dbraw/zinc/23/15/19/1044231519.db2.gz RRHHSIVBXSGQHG-VIFPVBQESA-N 1 2 305.428 4.019 20 0 DIADLO CCc1nc(C[NH2+][C@H](c2ncccc2C)C(C)(C)C)cs1 ZINC000934292082 1044235980 /nfs/dbraw/zinc/23/59/80/1044235980.db2.gz GQOYNLWLTSFBAL-MRXNPFEDSA-N 1 2 303.475 4.286 20 0 DIADLO CC(C)(C)[C@H]([NH2+]Cc1nc(C2CCC2)no1)c1ccc(F)cc1 ZINC000639533113 1044242368 /nfs/dbraw/zinc/24/23/68/1044242368.db2.gz CBRSFTNGRUNNBX-MRXNPFEDSA-N 1 2 317.408 4.353 20 0 DIADLO Cc1ccccc1C(C)(C)[NH2+]Cc1noc(-c2ccccc2)n1 ZINC000293054413 1044243526 /nfs/dbraw/zinc/24/35/26/1044243526.db2.gz RUSWJJFKXVWZDT-UHFFFAOYSA-N 1 2 307.397 4.070 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+]C(C)(C)c2ccccc2C)n1 ZINC000293067083 1044243669 /nfs/dbraw/zinc/24/36/69/1044243669.db2.gz VCXCBRZNPDYNGI-CYBMUJFWSA-N 1 2 319.474 4.217 20 0 DIADLO COc1ccc(C2CC2)cc1C[NH2+]Cc1c(F)cccc1F ZINC000883258918 1044251340 /nfs/dbraw/zinc/25/13/40/1044251340.db2.gz UWXVCCUJBGPXQQ-UHFFFAOYSA-N 1 2 303.352 4.141 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+][C@H](C)c1nccs1 ZINC000883266898 1044254663 /nfs/dbraw/zinc/25/46/63/1044254663.db2.gz NKCFJWIZWMDJFD-LLVKDONJSA-N 1 2 310.850 4.435 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCn2ccnc21)c1cc(Cl)ccc1Cl ZINC000655704146 1044257917 /nfs/dbraw/zinc/25/79/17/1044257917.db2.gz QSOXPULAMUTYEV-YGRLFVJLSA-N 1 2 310.228 4.376 20 0 DIADLO C/C=C/c1ccc(NC(=O)c2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000360314721 1044258571 /nfs/dbraw/zinc/25/85/71/1044258571.db2.gz BOYHONZQGKSTHH-DUXPYHPUSA-N 1 2 303.365 4.158 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H](C)c2ncccn2)cc2ccccc21 ZINC000934629636 1044264068 /nfs/dbraw/zinc/26/40/68/1044264068.db2.gz FROLAHSJJDXTLQ-ZIAGYGMSSA-N 1 2 307.397 4.050 20 0 DIADLO c1sc(C[NH2+]C2(c3ncccn3)CCC2)cc1-c1ccccc1 ZINC000883307747 1044264099 /nfs/dbraw/zinc/26/40/99/1044264099.db2.gz AGRAJWYSZVGLME-UHFFFAOYSA-N 1 2 321.449 4.374 20 0 DIADLO CC[C@H]([NH2+]C1(c2ncccn2)CCC1)c1ccc(Cl)s1 ZINC000883312781 1044266490 /nfs/dbraw/zinc/26/64/90/1044266490.db2.gz MUQUYEOLGVWHON-NSHDSACASA-N 1 2 307.850 4.312 20 0 DIADLO CC[C@@H](Cc1ccccc1)N(CC)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000934648476 1044266764 /nfs/dbraw/zinc/26/67/64/1044266764.db2.gz QNYSIELDRAEBIU-KRWDZBQOSA-N 1 2 321.424 4.046 20 0 DIADLO CCC[C@](C)(CC)C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000475106630 1044276535 /nfs/dbraw/zinc/27/65/35/1044276535.db2.gz CDFQYRXXAZHEFG-KRWDZBQOSA-N 1 2 323.506 4.284 20 0 DIADLO COc1nc(C)cc(C)c1C[N@H+](C)[C@@H](C)c1ccccc1F ZINC000563557064 1044281619 /nfs/dbraw/zinc/28/16/19/1044281619.db2.gz ICHNWYLIHLMAJF-AWEZNQCLSA-N 1 2 302.393 4.039 20 0 DIADLO COc1nc(C)cc(C)c1C[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000563557064 1044281635 /nfs/dbraw/zinc/28/16/35/1044281635.db2.gz ICHNWYLIHLMAJF-AWEZNQCLSA-N 1 2 302.393 4.039 20 0 DIADLO Cc1ccccc1O[C@H]1CC[N@H+](Cc2cc(F)c(F)cc2F)C1 ZINC001137891208 1044284114 /nfs/dbraw/zinc/28/41/14/1044284114.db2.gz CVRWCQCJFCTIQS-AWEZNQCLSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1ccccc1O[C@H]1CC[N@@H+](Cc2cc(F)c(F)cc2F)C1 ZINC001137891208 1044284130 /nfs/dbraw/zinc/28/41/30/1044284130.db2.gz CVRWCQCJFCTIQS-AWEZNQCLSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CC=C(c3cccc(C)c3C)CC2)s1 ZINC000934841581 1044285288 /nfs/dbraw/zinc/28/52/88/1044285288.db2.gz RICWLBNOUQTBMJ-AWEZNQCLSA-N 1 2 313.470 4.314 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CC=C(c3cccc(C)c3C)CC2)s1 ZINC000934841581 1044285300 /nfs/dbraw/zinc/28/53/00/1044285300.db2.gz RICWLBNOUQTBMJ-AWEZNQCLSA-N 1 2 313.470 4.314 20 0 DIADLO C[C@H]([NH2+][C@@H]1c2ccccc2CC[C@H]1F)c1cccnc1Cl ZINC000883375950 1044287409 /nfs/dbraw/zinc/28/74/09/1044287409.db2.gz CJCWHRTTXOQQRY-IUIKQTSFSA-N 1 2 304.796 4.411 20 0 DIADLO C[C@H]([NH2+][C@@H]1c2ccccc2CC[C@@H]1F)c1cccnc1Cl ZINC000883375951 1044287932 /nfs/dbraw/zinc/28/79/32/1044287932.db2.gz CJCWHRTTXOQQRY-KNXALSJPSA-N 1 2 304.796 4.411 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cc(COC)cs1 ZINC000883377198 1044288939 /nfs/dbraw/zinc/28/89/39/1044288939.db2.gz BBWNWOFFCVKZFA-UHFFFAOYSA-N 1 2 308.472 4.155 20 0 DIADLO C[C@H]([NH2+][C@@H]1c2ccccc2CC[C@@H]1F)c1ccncc1Cl ZINC000883377538 1044289738 /nfs/dbraw/zinc/28/97/38/1044289738.db2.gz KIGVBGNJUCKVKR-MZPVMMEZSA-N 1 2 304.796 4.411 20 0 DIADLO Cc1sccc1C[NH2+][C@@H](C)c1nc(-c2cccc(F)c2)no1 ZINC000293528157 1044294469 /nfs/dbraw/zinc/29/44/69/1044294469.db2.gz JFFMLURVPHMOLL-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000360725705 1044303851 /nfs/dbraw/zinc/30/38/51/1044303851.db2.gz MQLXHNXCGJXGGK-CABZTGNLSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1csc(C2CC2)n1 ZINC000360725705 1044303869 /nfs/dbraw/zinc/30/38/69/1044303869.db2.gz MQLXHNXCGJXGGK-CABZTGNLSA-N 1 2 304.381 4.183 20 0 DIADLO Cc1ccc2c(Nc3c4ccccc4oc3C(N)=O)cccc2[nH+]1 ZINC001212795271 1044315650 /nfs/dbraw/zinc/31/56/50/1044315650.db2.gz YLPFTAFJZHQMBT-UHFFFAOYSA-N 1 2 317.348 4.132 20 0 DIADLO c1cc(Oc2ccccc2)c(C[N@@H+]2CCOCC23CCC3)s1 ZINC001142001474 1044318266 /nfs/dbraw/zinc/31/82/66/1044318266.db2.gz ROEWLPKNLGLHQV-UHFFFAOYSA-N 1 2 315.438 4.295 20 0 DIADLO c1cc(Oc2ccccc2)c(C[N@H+]2CCOCC23CCC3)s1 ZINC001142001474 1044318275 /nfs/dbraw/zinc/31/82/75/1044318275.db2.gz ROEWLPKNLGLHQV-UHFFFAOYSA-N 1 2 315.438 4.295 20 0 DIADLO CCC[NH+](CCC)Cn1ncn(-c2ccc(C)cc2C)c1=S ZINC000935193360 1044319251 /nfs/dbraw/zinc/31/92/51/1044319251.db2.gz RSJGETOLYJZRPT-UHFFFAOYSA-N 1 2 318.490 4.100 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2cc(F)c(F)cc2F)c1 ZINC001137892576 1044328003 /nfs/dbraw/zinc/32/80/03/1044328003.db2.gz ZAPWAICOXNILEP-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2cc(F)c(F)cc2F)c1 ZINC001137892576 1044328015 /nfs/dbraw/zinc/32/80/15/1044328015.db2.gz ZAPWAICOXNILEP-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cc(Nc2cccc3[nH+]c(C)ccc23)n(-c2cccnc2)n1 ZINC001212796438 1044328937 /nfs/dbraw/zinc/32/89/37/1044328937.db2.gz ZQPDRCMGFSXUBS-UHFFFAOYSA-N 1 2 315.380 4.176 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+](C)Cc1nc2ccccc2o1 ZINC000293819624 1044334866 /nfs/dbraw/zinc/33/48/66/1044334866.db2.gz OXPPJKFELDPYHA-UHFFFAOYSA-N 1 2 309.413 4.287 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+](C)Cc1nc2ccccc2o1 ZINC000293819624 1044334879 /nfs/dbraw/zinc/33/48/79/1044334879.db2.gz OXPPJKFELDPYHA-UHFFFAOYSA-N 1 2 309.413 4.287 20 0 DIADLO Cc1ccc2c(Nc3ccc(N4CCCC4=O)cc3)cccc2[nH+]1 ZINC001212796828 1044342533 /nfs/dbraw/zinc/34/25/33/1044342533.db2.gz GHDOACPPLXWTGR-UHFFFAOYSA-N 1 2 317.392 4.414 20 0 DIADLO Cc1cccc(C)c1NC(=O)[C@@H](C)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000361058001 1044353461 /nfs/dbraw/zinc/35/34/61/1044353461.db2.gz AWNOJVOTIGPALW-JKSUJKDBSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1cccc(C)c1NC(=O)[C@@H](C)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000361058001 1044353475 /nfs/dbraw/zinc/35/34/75/1044353475.db2.gz AWNOJVOTIGPALW-JKSUJKDBSA-N 1 2 308.425 4.207 20 0 DIADLO Fc1cnc(Cl)c(C[NH2+]Cc2ccc(Cl)cc2Cl)c1 ZINC001202602448 1044366764 /nfs/dbraw/zinc/36/67/64/1044366764.db2.gz BRMUHGUFAYMIGG-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2cc(-c3ccco3)on2)s1 ZINC000106879096 1044373452 /nfs/dbraw/zinc/37/34/52/1044373452.db2.gz WDXWMDJKAZPSNI-LLVKDONJSA-N 1 2 317.414 4.201 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cc(-c3ccco3)on2)s1 ZINC000106879096 1044373461 /nfs/dbraw/zinc/37/34/61/1044373461.db2.gz WDXWMDJKAZPSNI-LLVKDONJSA-N 1 2 317.414 4.201 20 0 DIADLO CC[C@@H](C)N(Cc1ccccc1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000564422800 1044376749 /nfs/dbraw/zinc/37/67/49/1044376749.db2.gz AGSJTLJWZNRLEO-OAHLLOKOSA-N 1 2 322.412 4.167 20 0 DIADLO Cc1ccc2c(Nc3ccc(C4OCCO4)cc3)cccc2[nH+]1 ZINC001212797895 1044376927 /nfs/dbraw/zinc/37/69/27/1044376927.db2.gz QQEYBRHBYTXVKH-UHFFFAOYSA-N 1 2 306.365 4.332 20 0 DIADLO Fc1ccc(F)c2c1OCC[C@@H]2[NH2+]Cc1cc2ccccc2o1 ZINC000361237027 1044380244 /nfs/dbraw/zinc/38/02/44/1044380244.db2.gz MIHRWAUGJDOPFT-HNNXBMFYSA-N 1 2 315.319 4.324 20 0 DIADLO Cc1ccsc1-c1noc(-c2cc(C)ccc2-n2cc[nH+]c2)n1 ZINC000564456062 1044382755 /nfs/dbraw/zinc/38/27/55/1044382755.db2.gz QSEAKUKXSRYDLY-UHFFFAOYSA-N 1 2 322.393 4.268 20 0 DIADLO Cc1ccc2c(Nc3ccccc3OC3COC3)cccc2[nH+]1 ZINC001212797952 1044383381 /nfs/dbraw/zinc/38/33/81/1044383381.db2.gz UONLMUPCJKXVET-UHFFFAOYSA-N 1 2 306.365 4.064 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1cncc(C(F)(F)F)c1 ZINC000361291368 1044384964 /nfs/dbraw/zinc/38/49/64/1044384964.db2.gz WZBPFHSFYDMAPZ-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cncc(C(F)(F)F)c1 ZINC000361291368 1044384979 /nfs/dbraw/zinc/38/49/79/1044384979.db2.gz WZBPFHSFYDMAPZ-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO Cc1ccc2c(Nc3ccc4[nH]c(=O)ccc4c3)cccc2[nH+]1 ZINC001212798024 1044387814 /nfs/dbraw/zinc/38/78/14/1044387814.db2.gz ZIJWANUGRMBOQZ-UHFFFAOYSA-N 1 2 301.349 4.128 20 0 DIADLO Cc1c2ccc(Nc3cccc4[nH+]c(C)ccc34)cc2nn1C ZINC001212798023 1044389353 /nfs/dbraw/zinc/38/93/53/1044389353.db2.gz ZHQZSFBTRWWQFN-UHFFFAOYSA-N 1 2 302.381 4.482 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cncc(C(F)(F)F)c2)C1 ZINC000361339810 1044394091 /nfs/dbraw/zinc/39/40/91/1044394091.db2.gz UXFZFPOYQSHXKO-WBMJQRKESA-N 1 2 321.346 4.079 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cncc(C(F)(F)F)c2)C1 ZINC000361339810 1044394101 /nfs/dbraw/zinc/39/41/01/1044394101.db2.gz UXFZFPOYQSHXKO-WBMJQRKESA-N 1 2 321.346 4.079 20 0 DIADLO CC[C@H]([NH2+]Cc1ncnn1C(C)(C)C)c1cccc(Cl)c1F ZINC000282874247 1044395054 /nfs/dbraw/zinc/39/50/54/1044395054.db2.gz VIWLGSDIESWBFZ-ZDUSSCGKSA-N 1 2 324.831 4.067 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CCCC[C@H]1c1ccc(F)cc1 ZINC000361372193 1044398511 /nfs/dbraw/zinc/39/85/11/1044398511.db2.gz LQSVBGKHOYHUQE-KRWDZBQOSA-N 1 2 301.409 4.330 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CCCC[C@H]1c1ccc(F)cc1 ZINC000361372193 1044398517 /nfs/dbraw/zinc/39/85/17/1044398517.db2.gz LQSVBGKHOYHUQE-KRWDZBQOSA-N 1 2 301.409 4.330 20 0 DIADLO CCCOc1cccc2c(NCc3cc(C)ccn3)cc[nH+]c12 ZINC000564741631 1044398929 /nfs/dbraw/zinc/39/89/29/1044398929.db2.gz MDMNHONFQJVYRA-UHFFFAOYSA-N 1 2 307.397 4.339 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2ccc(OCC3CC3)cc2)cs1 ZINC000564824248 1044406039 /nfs/dbraw/zinc/40/60/39/1044406039.db2.gz HCGJSQUGJMWUNB-UHFFFAOYSA-N 1 2 316.470 4.126 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2ccc(OCC3CC3)cc2)cs1 ZINC000564824248 1044406048 /nfs/dbraw/zinc/40/60/48/1044406048.db2.gz HCGJSQUGJMWUNB-UHFFFAOYSA-N 1 2 316.470 4.126 20 0 DIADLO CC[N@H+](Cc1nccn1-c1ccccc1)Cc1cccc(F)c1 ZINC000361496501 1044409703 /nfs/dbraw/zinc/40/97/03/1044409703.db2.gz LMSCVNLNBOPFGC-UHFFFAOYSA-N 1 2 309.388 4.034 20 0 DIADLO CC[N@@H+](Cc1nccn1-c1ccccc1)Cc1cccc(F)c1 ZINC000361496501 1044409713 /nfs/dbraw/zinc/40/97/13/1044409713.db2.gz LMSCVNLNBOPFGC-UHFFFAOYSA-N 1 2 309.388 4.034 20 0 DIADLO CC1(C)COCC[N@@H+]1Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000565092486 1044412420 /nfs/dbraw/zinc/41/24/20/1044412420.db2.gz KYOILAFEABLCCK-UHFFFAOYSA-N 1 2 322.861 4.074 20 0 DIADLO CC1(C)COCC[N@H+]1Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000565092486 1044412425 /nfs/dbraw/zinc/41/24/25/1044412425.db2.gz KYOILAFEABLCCK-UHFFFAOYSA-N 1 2 322.861 4.074 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@@H](c2ccccc2)C2CCCC2)no1 ZINC000109800714 1044412645 /nfs/dbraw/zinc/41/26/45/1044412645.db2.gz YYUKBBAAWXKNGM-KRWDZBQOSA-N 1 2 313.445 4.388 20 0 DIADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2nccn2-c2ccccc2)c1 ZINC000361509527 1044412749 /nfs/dbraw/zinc/41/27/49/1044412749.db2.gz VNTQXTKWPFQFLH-LJQANCHMSA-N 1 2 321.399 4.349 20 0 DIADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2nccn2-c2ccccc2)c1 ZINC000361509527 1044412760 /nfs/dbraw/zinc/41/27/60/1044412760.db2.gz VNTQXTKWPFQFLH-LJQANCHMSA-N 1 2 321.399 4.349 20 0 DIADLO Clc1sccc1C[NH2+]Cc1nc2ccccc2n1C1CC1 ZINC000361585397 1044422615 /nfs/dbraw/zinc/42/26/15/1044422615.db2.gz IEJBFGNICHHQPV-UHFFFAOYSA-N 1 2 317.845 4.376 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3ncccn3)CC2)cc1Cl ZINC000361754192 1044440830 /nfs/dbraw/zinc/44/08/30/1044440830.db2.gz MTPAPAZKFOYEOZ-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3ncccn3)CC2)cc1Cl ZINC000361754192 1044440842 /nfs/dbraw/zinc/44/08/42/1044440842.db2.gz MTPAPAZKFOYEOZ-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO C[C@H](c1ccc(-c2ccccc2)cc1)[N@H+](C)Cc1ncccn1 ZINC000361834067 1044449968 /nfs/dbraw/zinc/44/99/68/1044449968.db2.gz ROTRJVOVAKIXGJ-MRXNPFEDSA-N 1 2 303.409 4.337 20 0 DIADLO C[C@H](c1ccc(-c2ccccc2)cc1)[N@@H+](C)Cc1ncccn1 ZINC000361834067 1044449974 /nfs/dbraw/zinc/44/99/74/1044449974.db2.gz ROTRJVOVAKIXGJ-MRXNPFEDSA-N 1 2 303.409 4.337 20 0 DIADLO Cc1ccc2c(Nc3ccccc3C3=NCCO3)cccc2[nH+]1 ZINC001212798781 1044451936 /nfs/dbraw/zinc/45/19/36/1044451936.db2.gz SEFUDBQIDROBTL-UHFFFAOYSA-N 1 2 303.365 4.064 20 0 DIADLO COc1ccccc1-c1ccc([C@@H](C)[NH2+]Cc2ncccn2)cc1 ZINC000361859165 1044452774 /nfs/dbraw/zinc/45/27/74/1044452774.db2.gz APKXCFWFAJTJPH-OAHLLOKOSA-N 1 2 319.408 4.003 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2cccc(Oc3ccccc3)c2)[nH]1 ZINC000294782617 1044459112 /nfs/dbraw/zinc/45/91/12/1044459112.db2.gz LEIAQKPHCGONSU-UHFFFAOYSA-N 1 2 322.412 4.010 20 0 DIADLO Cc1cc(N2CCC(CC(F)(F)F)CC2)nc(C(C)C)[nH+]1 ZINC000565909993 1044463855 /nfs/dbraw/zinc/46/38/55/1044463855.db2.gz JCFZAUIYCPKZTK-UHFFFAOYSA-N 1 2 301.356 4.077 20 0 DIADLO CC(C)C[C@@H](c1nc([C@@H](C)c2cccs2)no1)n1cc[nH+]c1 ZINC000923907063 1044466811 /nfs/dbraw/zinc/46/68/11/1044466811.db2.gz LOWHFNKAYXGXKF-STQMWFEESA-N 1 2 316.430 4.115 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc(Cc2ccc(C)cc2)no1)c1ccccc1 ZINC000566034377 1044470930 /nfs/dbraw/zinc/47/09/30/1044470930.db2.gz IQPWXTXBCULYAJ-LJQANCHMSA-N 1 2 321.424 4.010 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc(Cc2ccc(C)cc2)no1)c1ccccc1 ZINC000566034377 1044470939 /nfs/dbraw/zinc/47/09/39/1044470939.db2.gz IQPWXTXBCULYAJ-LJQANCHMSA-N 1 2 321.424 4.010 20 0 DIADLO CC(C)CCOc1ccccc1C[NH2+]Cc1cc(F)ncc1F ZINC000294941007 1044476248 /nfs/dbraw/zinc/47/62/48/1044476248.db2.gz DTKKTLIXOUTSCF-UHFFFAOYSA-N 1 2 320.383 4.075 20 0 DIADLO CC(=O)Nc1cccc(CSCCc2[nH+]cc(C)cc2C)c1 ZINC000566238650 1044478432 /nfs/dbraw/zinc/47/84/32/1044478432.db2.gz QJKQOJGQGNLSAY-UHFFFAOYSA-N 1 2 314.454 4.133 20 0 DIADLO C[C@@H](c1nnc(-c2cccs2)o1)[N@@H+]1CC[C@H]1c1ccccc1 ZINC000362178258 1044485861 /nfs/dbraw/zinc/48/58/61/1044485861.db2.gz BULFJOCPQFXIIF-JSGCOSHPSA-N 1 2 311.410 4.306 20 0 DIADLO C[C@@H](c1nnc(-c2cccs2)o1)[N@H+]1CC[C@H]1c1ccccc1 ZINC000362178258 1044485866 /nfs/dbraw/zinc/48/58/66/1044485866.db2.gz BULFJOCPQFXIIF-JSGCOSHPSA-N 1 2 311.410 4.306 20 0 DIADLO c1n[nH]c([C@@H]([NH2+]C[C@H](c2ccccc2)C2CC2)C2CCCCC2)n1 ZINC000566350736 1044485849 /nfs/dbraw/zinc/48/58/49/1044485849.db2.gz ODUIEDHOOIWFSB-MOPGFXCFSA-N 1 2 324.472 4.210 20 0 DIADLO CCC[C@@H](CC(C)C)C(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC001625946476 1044486941 /nfs/dbraw/zinc/48/69/41/1044486941.db2.gz GRTLFHLSNYRKAT-INIZCTEOSA-N 1 2 320.477 4.128 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)cc1OC ZINC000566393728 1044487514 /nfs/dbraw/zinc/48/75/14/1044487514.db2.gz DMIGXIPUSDBROK-MRXNPFEDSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)cc1OC ZINC000566393728 1044487518 /nfs/dbraw/zinc/48/75/18/1044487518.db2.gz DMIGXIPUSDBROK-MRXNPFEDSA-N 1 2 317.816 4.304 20 0 DIADLO C[C@H]1C[C@H]([NH2+]Cc2ccccc2OC2CCCC2)c2nccn21 ZINC000295184386 1044497862 /nfs/dbraw/zinc/49/78/62/1044497862.db2.gz HZYZYLDLSQSHQF-YOEHRIQHSA-N 1 2 311.429 4.000 20 0 DIADLO CCOc1cccc(C[N@H+](C)Cc2nc(-c3ccccc3)c[nH]2)c1 ZINC000362325417 1044500407 /nfs/dbraw/zinc/50/04/07/1044500407.db2.gz SMADEBKPZVNVLZ-UHFFFAOYSA-N 1 2 321.424 4.107 20 0 DIADLO CCOc1cccc(C[N@@H+](C)Cc2nc(-c3ccccc3)c[nH]2)c1 ZINC000362325417 1044500420 /nfs/dbraw/zinc/50/04/20/1044500420.db2.gz SMADEBKPZVNVLZ-UHFFFAOYSA-N 1 2 321.424 4.107 20 0 DIADLO CC[C@@H](c1ccccc1)N(CC)C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000566923802 1044528238 /nfs/dbraw/zinc/52/82/38/1044528238.db2.gz OPDMTZPOCLSBFB-SFHVURJKSA-N 1 2 321.424 4.256 20 0 DIADLO Cc1ccc2nc(C[N@H+](C)Cc3cnc(Cl)s3)ccc2c1 ZINC001137211176 1044533779 /nfs/dbraw/zinc/53/37/79/1044533779.db2.gz MBGGQYBGOJUFDJ-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO Cc1ccc2nc(C[N@@H+](C)Cc3cnc(Cl)s3)ccc2c1 ZINC001137211176 1044533795 /nfs/dbraw/zinc/53/37/95/1044533795.db2.gz MBGGQYBGOJUFDJ-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)[N@H+]1Cc1csc(Cl)n1 ZINC000295598222 1044544369 /nfs/dbraw/zinc/54/43/69/1044544369.db2.gz CCCUTYXSKKGLRF-YIZRAAEISA-N 1 2 312.788 4.348 20 0 DIADLO C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)[N@@H+]1Cc1csc(Cl)n1 ZINC000295598222 1044544384 /nfs/dbraw/zinc/54/43/84/1044544384.db2.gz CCCUTYXSKKGLRF-YIZRAAEISA-N 1 2 312.788 4.348 20 0 DIADLO CCCC[C@@H](CCC)C[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000567142185 1044546541 /nfs/dbraw/zinc/54/65/41/1044546541.db2.gz HVHUUNWULCFCSQ-NVXWUHKLSA-N 1 2 300.450 4.090 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]Cc1ncc(C(F)(F)F)cn1 ZINC000295833117 1044562888 /nfs/dbraw/zinc/56/28/88/1044562888.db2.gz AABNGUWVLUCANM-RISCZKNCSA-N 1 2 321.346 4.142 20 0 DIADLO O=C(C/C=C/c1cccc(F)c1)Nc1ccccc1-n1cc[nH+]c1 ZINC000362962863 1044569199 /nfs/dbraw/zinc/56/91/99/1044569199.db2.gz GPZJFCOXRWMNDN-GQCTYLIASA-N 1 2 321.355 4.053 20 0 DIADLO FC(F)(F)C[C@@H]1CC[N@H+](Cc2ncc(Cl)cc2Cl)C1 ZINC000444700913 1044605588 /nfs/dbraw/zinc/60/55/88/1044605588.db2.gz GOXNYBXFBJNFDK-QMMMGPOBSA-N 1 2 313.150 4.163 20 0 DIADLO FC(F)(F)C[C@@H]1CC[N@@H+](Cc2ncc(Cl)cc2Cl)C1 ZINC000444700913 1044605593 /nfs/dbraw/zinc/60/55/93/1044605593.db2.gz GOXNYBXFBJNFDK-QMMMGPOBSA-N 1 2 313.150 4.163 20 0 DIADLO COc1c(O)cccc1C[NH2+][C@@H](C)c1ccc(F)cc1Cl ZINC000296026169 1044584879 /nfs/dbraw/zinc/58/48/79/1044584879.db2.gz MWKGGPBZLNOAHM-JTQLQIEISA-N 1 2 309.768 4.044 20 0 DIADLO C[N@H+](CCOCC1CC1)Cc1nc(C2CCCCC2)cs1 ZINC000444654187 1044585855 /nfs/dbraw/zinc/58/58/55/1044585855.db2.gz OINVCZJGPVBMMY-UHFFFAOYSA-N 1 2 308.491 4.049 20 0 DIADLO C[N@@H+](CCOCC1CC1)Cc1nc(C2CCCCC2)cs1 ZINC000444654187 1044585871 /nfs/dbraw/zinc/58/58/71/1044585871.db2.gz OINVCZJGPVBMMY-UHFFFAOYSA-N 1 2 308.491 4.049 20 0 DIADLO COc1cc(C)cc(C[NH2+][C@@H](C)c2c(F)cccc2F)c1OC ZINC000885927393 1044592733 /nfs/dbraw/zinc/59/27/33/1044592733.db2.gz RPZOEKMHYASNCX-LBPRGKRZSA-N 1 2 321.367 4.141 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]C(c1ccccc1)c1ccccc1 ZINC000296152556 1044594599 /nfs/dbraw/zinc/59/45/99/1044594599.db2.gz WVJSKTIUQLVTIV-MRXNPFEDSA-N 1 2 305.425 4.343 20 0 DIADLO CSCCCCC(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC000363244945 1044597211 /nfs/dbraw/zinc/59/72/11/1044597211.db2.gz QKLCMJDHMFBGOH-UHFFFAOYSA-N 1 2 317.458 4.165 20 0 DIADLO CSC[C@H]1CCCN(Cc2[nH+]c(C(C)C)n3ccccc23)C1 ZINC000568033444 1044599251 /nfs/dbraw/zinc/59/92/51/1044599251.db2.gz NFTNGCQOBHAXNH-HNNXBMFYSA-N 1 2 317.502 4.033 20 0 DIADLO Cc1cnc(C[NH+]2CCC(c3nc(C(C)(C)C)cs3)CC2)o1 ZINC000363286545 1044600988 /nfs/dbraw/zinc/60/09/88/1044600988.db2.gz MFCNFIFQSDEFCZ-UHFFFAOYSA-N 1 2 319.474 4.117 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@H](C)c2ccnn2C2CCC2)on1 ZINC000925158527 1044603377 /nfs/dbraw/zinc/60/33/77/1044603377.db2.gz VCSDABLBFZAQKI-CYBMUJFWSA-N 1 2 316.449 4.351 20 0 DIADLO Brc1cccc([C@H]2C[N@H+](CC3CCCC3)CCO2)c1 ZINC000523329522 1044608697 /nfs/dbraw/zinc/60/86/97/1044608697.db2.gz VJYNRFLVOAUFCQ-MRXNPFEDSA-N 1 2 324.262 4.013 20 0 DIADLO Brc1cccc([C@H]2C[N@@H+](CC3CCCC3)CCO2)c1 ZINC000523329522 1044608705 /nfs/dbraw/zinc/60/87/05/1044608705.db2.gz VJYNRFLVOAUFCQ-MRXNPFEDSA-N 1 2 324.262 4.013 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2ccc(C3CC3)cc2)c(C)[nH+]1 ZINC000568196332 1044608688 /nfs/dbraw/zinc/60/86/88/1044608688.db2.gz YUGDMCRCOLAMEM-UHFFFAOYSA-N 1 2 309.413 4.206 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(Cl)c2)C[N@@H+]1C[C@H]1CCC(C)(C)O1 ZINC000444712657 1044611776 /nfs/dbraw/zinc/61/17/76/1044611776.db2.gz WPHHOZMJOJGIAZ-XYPHTWIQSA-N 1 2 323.864 4.059 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(Cl)c2)C[N@H+]1C[C@H]1CCC(C)(C)O1 ZINC000444712657 1044611781 /nfs/dbraw/zinc/61/17/81/1044611781.db2.gz WPHHOZMJOJGIAZ-XYPHTWIQSA-N 1 2 323.864 4.059 20 0 DIADLO Cc1cc2cc([C@H](C)[NH2+]Cc3nnc(C(C)C)[nH]3)oc2cc1C ZINC000296367462 1044612495 /nfs/dbraw/zinc/61/24/95/1044612495.db2.gz JAXWPZLALVVFBI-ZDUSSCGKSA-N 1 2 312.417 4.142 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2csc(Cl)n2)c1 ZINC000296366183 1044612516 /nfs/dbraw/zinc/61/25/16/1044612516.db2.gz SGOLYWGHIQSVQI-NSHDSACASA-N 1 2 310.850 4.435 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1nnc(C(C)C)s1 ZINC000296398529 1044614997 /nfs/dbraw/zinc/61/49/97/1044614997.db2.gz VNVGCNHYBCDWSO-CQSZACIVSA-N 1 2 319.474 4.301 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1ccn(-c2ccccc2)n1 ZINC000523347820 1044615871 /nfs/dbraw/zinc/61/58/71/1044615871.db2.gz LKOOQLUANFHFGE-OAHLLOKOSA-N 1 2 309.388 4.204 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccn(-c2ccccc2)n1 ZINC000523347820 1044615876 /nfs/dbraw/zinc/61/58/76/1044615876.db2.gz LKOOQLUANFHFGE-OAHLLOKOSA-N 1 2 309.388 4.204 20 0 DIADLO CCC(CC)n1ccc(C[N@H+](C)Cc2ccc(F)c(C)c2)n1 ZINC000444743148 1044618205 /nfs/dbraw/zinc/61/82/05/1044618205.db2.gz HUBDYGMXCTVNMS-UHFFFAOYSA-N 1 2 303.425 4.324 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+](C)Cc2ccc(F)c(C)c2)n1 ZINC000444743148 1044618217 /nfs/dbraw/zinc/61/82/17/1044618217.db2.gz HUBDYGMXCTVNMS-UHFFFAOYSA-N 1 2 303.425 4.324 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2nnc(C(C)C)s2)c1 ZINC000296652848 1044640139 /nfs/dbraw/zinc/64/01/39/1044640139.db2.gz XNOKUFKZVODOTG-HNNXBMFYSA-N 1 2 317.458 4.007 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2nnc(C(C)C)s2)c1 ZINC000296652848 1044640146 /nfs/dbraw/zinc/64/01/46/1044640146.db2.gz XNOKUFKZVODOTG-HNNXBMFYSA-N 1 2 317.458 4.007 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2nnc(C(C)C)s2)cc1 ZINC000296663992 1044640918 /nfs/dbraw/zinc/64/09/18/1044640918.db2.gz YQTOZERLBITXCN-HNNXBMFYSA-N 1 2 317.458 4.007 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2nnc(C(C)C)s2)cc1 ZINC000296663992 1044640922 /nfs/dbraw/zinc/64/09/22/1044640922.db2.gz YQTOZERLBITXCN-HNNXBMFYSA-N 1 2 317.458 4.007 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1sccc1Br ZINC000568783141 1044648821 /nfs/dbraw/zinc/64/88/21/1044648821.db2.gz NWEAILQBIZWHFW-JGVFFNPUSA-N 1 2 317.277 4.379 20 0 DIADLO C[C@H](c1ccc2ccccc2c1)[N@H+](Cc1cnns1)C1CC1 ZINC000296940056 1044653335 /nfs/dbraw/zinc/65/33/35/1044653335.db2.gz BOPWICAYVMKYLE-CYBMUJFWSA-N 1 2 309.438 4.417 20 0 DIADLO C[C@H](c1ccc2ccccc2c1)[N@@H+](Cc1cnns1)C1CC1 ZINC000296940056 1044653340 /nfs/dbraw/zinc/65/33/40/1044653340.db2.gz BOPWICAYVMKYLE-CYBMUJFWSA-N 1 2 309.438 4.417 20 0 DIADLO CCCN(Cc1ccc(C)cc1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000568920305 1044659053 /nfs/dbraw/zinc/65/90/53/1044659053.db2.gz AFPNXKOJOJLPJS-UHFFFAOYSA-N 1 2 322.412 4.087 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2oc(C(C)C)nc2C)sc1C ZINC000428384687 1044660850 /nfs/dbraw/zinc/66/08/50/1044660850.db2.gz XCAGPNBGEILCKH-UHFFFAOYSA-N 1 2 307.463 4.205 20 0 DIADLO CCn1cc(C[N@H+](C)Cc2sc3ccccc3c2Cl)cn1 ZINC000523671150 1044673080 /nfs/dbraw/zinc/67/30/80/1044673080.db2.gz HIMJWLSOWAAZCD-UHFFFAOYSA-N 1 2 319.861 4.403 20 0 DIADLO CCn1cc(C[N@@H+](C)Cc2sc3ccccc3c2Cl)cn1 ZINC000523671150 1044673086 /nfs/dbraw/zinc/67/30/86/1044673086.db2.gz HIMJWLSOWAAZCD-UHFFFAOYSA-N 1 2 319.861 4.403 20 0 DIADLO Cc1[nH]c(CN[C@@H](C)c2nc(-c3ccccc3)cs2)[nH+]c1C ZINC000569120990 1044675958 /nfs/dbraw/zinc/67/59/58/1044675958.db2.gz YEHUMKLHZDSISA-ZDUSSCGKSA-N 1 2 312.442 4.001 20 0 DIADLO COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1cc(C2CC2)no1 ZINC000886682643 1044677257 /nfs/dbraw/zinc/67/72/57/1044677257.db2.gz MIEFHEPIOGIION-JTQLQIEISA-N 1 2 306.793 4.065 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C2CC2)no1)c1ccc(-c2ccccc2)cn1 ZINC000886684375 1044679234 /nfs/dbraw/zinc/67/92/34/1044679234.db2.gz KFFRWSJKMDOWSI-AWEZNQCLSA-N 1 2 319.408 4.465 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(C(C)(C)C)on1 ZINC000569173108 1044681999 /nfs/dbraw/zinc/68/19/99/1044681999.db2.gz HBHGOWQCOSGTLA-INIZCTEOSA-N 1 2 314.429 4.318 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc(C(C)(C)C)on1 ZINC000569173108 1044682001 /nfs/dbraw/zinc/68/20/01/1044682001.db2.gz HBHGOWQCOSGTLA-INIZCTEOSA-N 1 2 314.429 4.318 20 0 DIADLO Cc1cc(N2CCC[C@@H]2CCc2ccccc2)nc(C2CC2)[nH+]1 ZINC000523872620 1044699038 /nfs/dbraw/zinc/69/90/38/1044699038.db2.gz MYIAUMFTTJOEPA-GOSISDBHSA-N 1 2 307.441 4.264 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2c1cccc2F)c1ncc(C(C)(C)C)o1 ZINC000886922123 1044719629 /nfs/dbraw/zinc/71/96/29/1044719629.db2.gz STSKGKSPLOJBJN-ABAIWWIYSA-N 1 2 302.393 4.449 20 0 DIADLO Cc1coc(C)c1C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC000367352497 1044740410 /nfs/dbraw/zinc/74/04/10/1044740410.db2.gz DLFAAQJCDDJSMP-UHFFFAOYSA-N 1 2 309.369 4.156 20 0 DIADLO CCCc1nc(C)c(C[N@@H+]2CCc3cccc(F)c3[C@@H]2C)o1 ZINC000570231159 1044743056 /nfs/dbraw/zinc/74/30/56/1044743056.db2.gz QLQYIKROPDKMSM-ZDUSSCGKSA-N 1 2 302.393 4.194 20 0 DIADLO CCCc1nc(C)c(C[N@H+]2CCc3cccc(F)c3[C@@H]2C)o1 ZINC000570231159 1044743060 /nfs/dbraw/zinc/74/30/60/1044743060.db2.gz QLQYIKROPDKMSM-ZDUSSCGKSA-N 1 2 302.393 4.194 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2cn3ccccc3n2)C2CC2)o1 ZINC000524143093 1044747146 /nfs/dbraw/zinc/74/71/46/1044747146.db2.gz HPNFDGIPUDAXNV-RDTXWAMCSA-N 1 2 321.424 4.215 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cn3ccccc3n2)C2CC2)o1 ZINC000524143093 1044747156 /nfs/dbraw/zinc/74/71/56/1044747156.db2.gz HPNFDGIPUDAXNV-RDTXWAMCSA-N 1 2 321.424 4.215 20 0 DIADLO C[C@H]([NH2+]Cc1sccc1Cl)c1nccn1-c1ccccc1 ZINC000367969707 1044760618 /nfs/dbraw/zinc/76/06/18/1044760618.db2.gz DEHGXQNJYBGQHP-LBPRGKRZSA-N 1 2 317.845 4.438 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000524179629 1044760571 /nfs/dbraw/zinc/76/05/71/1044760571.db2.gz ZBNWTONZVRVBHV-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000524179629 1044760581 /nfs/dbraw/zinc/76/05/81/1044760581.db2.gz ZBNWTONZVRVBHV-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO Clc1ccc(N2CCCN(c3cccc[nH+]3)CC2)cc1Cl ZINC000445590008 1044763300 /nfs/dbraw/zinc/76/33/00/1044763300.db2.gz AHUDBEKPBCEQEC-UHFFFAOYSA-N 1 2 322.239 4.105 20 0 DIADLO CSc1ccc(C[N@@H+](C)Cc2cc(C(C)(C)C)n[nH]2)s1 ZINC000570622358 1044769171 /nfs/dbraw/zinc/76/91/71/1044769171.db2.gz FBJKSHQENOKQGV-UHFFFAOYSA-N 1 2 309.504 4.123 20 0 DIADLO CSc1ccc(C[N@H+](C)Cc2cc(C(C)(C)C)n[nH]2)s1 ZINC000570622358 1044769157 /nfs/dbraw/zinc/76/91/57/1044769157.db2.gz FBJKSHQENOKQGV-UHFFFAOYSA-N 1 2 309.504 4.123 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1cccc(Cl)c1Cl ZINC000368423179 1044775756 /nfs/dbraw/zinc/77/57/56/1044775756.db2.gz BJIBXELQNODDNY-ZANVPECISA-N 1 2 310.228 4.445 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1Cl ZINC000368423179 1044775768 /nfs/dbraw/zinc/77/57/68/1044775768.db2.gz BJIBXELQNODDNY-ZANVPECISA-N 1 2 310.228 4.445 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+]2CCC[C@H]2c2ccncc2)n1 ZINC000125466361 1044803978 /nfs/dbraw/zinc/80/39/78/1044803978.db2.gz MVXSIPPHNGMQKS-AWEZNQCLSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1csc(C[N@H+]2CCC[C@H]2c2ccncc2)n1 ZINC000125466361 1044803985 /nfs/dbraw/zinc/80/39/85/1044803985.db2.gz MVXSIPPHNGMQKS-AWEZNQCLSA-N 1 2 301.459 4.173 20 0 DIADLO C[N@H+](Cc1nc(C2CC2)no1)Cc1ccccc1-c1ccccc1 ZINC000263734960 1044821148 /nfs/dbraw/zinc/82/11/48/1044821148.db2.gz QMJQPPDXSAIBEH-UHFFFAOYSA-N 1 2 319.408 4.246 20 0 DIADLO C[N@@H+](Cc1nc(C2CC2)no1)Cc1ccccc1-c1ccccc1 ZINC000263734960 1044821167 /nfs/dbraw/zinc/82/11/67/1044821167.db2.gz QMJQPPDXSAIBEH-UHFFFAOYSA-N 1 2 319.408 4.246 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)Cc2ccccc2CC)cs1 ZINC000445822336 1044830628 /nfs/dbraw/zinc/83/06/28/1044830628.db2.gz QXKGBTVAMJDJJH-AWEZNQCLSA-N 1 2 318.486 4.435 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)Cc2ccccc2CC)cs1 ZINC000445822336 1044830652 /nfs/dbraw/zinc/83/06/52/1044830652.db2.gz QXKGBTVAMJDJJH-AWEZNQCLSA-N 1 2 318.486 4.435 20 0 DIADLO CCC[C@@H](CC1CCCC1)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000370242660 1044831383 /nfs/dbraw/zinc/83/13/83/1044831383.db2.gz KKTXSJIUGQBJFA-KRWDZBQOSA-N 1 2 317.477 4.112 20 0 DIADLO CCC[C@@H](CC1CCCC1)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000370242660 1044831399 /nfs/dbraw/zinc/83/13/99/1044831399.db2.gz KKTXSJIUGQBJFA-KRWDZBQOSA-N 1 2 317.477 4.112 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ccccc3OC(C)C)CCC2)n1 ZINC000263888839 1044833753 /nfs/dbraw/zinc/83/37/53/1044833753.db2.gz KPUFZBGIZVRZQB-UHFFFAOYSA-N 1 2 316.470 4.408 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)o1 ZINC000263952577 1044836478 /nfs/dbraw/zinc/83/64/78/1044836478.db2.gz KBUKMIWNNVFBPR-HNNXBMFYSA-N 1 2 307.825 4.333 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CCCC3(CCCC3)C2)n1 ZINC000445860128 1044837218 /nfs/dbraw/zinc/83/72/18/1044837218.db2.gz WNSGUEPFPXZJGW-UHFFFAOYSA-N 1 2 304.381 4.318 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CCCC3(CCCC3)C2)n1 ZINC000445860128 1044837235 /nfs/dbraw/zinc/83/72/35/1044837235.db2.gz WNSGUEPFPXZJGW-UHFFFAOYSA-N 1 2 304.381 4.318 20 0 DIADLO CCOc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1csc(C)n1)CCO2 ZINC000370625019 1044846479 /nfs/dbraw/zinc/84/64/79/1044846479.db2.gz SZMMIKOIJMQTBQ-NHYWBVRUSA-N 1 2 318.442 4.025 20 0 DIADLO CC[C@H](C)[C@@H](C(=O)Nc1ccn2cc[nH+]c2c1)c1ccccc1 ZINC000572549202 1044863761 /nfs/dbraw/zinc/86/37/61/1044863761.db2.gz LTNCXZYLUCIVED-KBXCAEBGSA-N 1 2 307.397 4.103 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1ccncc1 ZINC000371484278 1044880625 /nfs/dbraw/zinc/88/06/25/1044880625.db2.gz BOUSNGZSYLXRSJ-OAHLLOKOSA-N 1 2 316.408 4.170 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@@H+](C)Cc2nc(CCC(C)C)no2)c1 ZINC000524595493 1044880795 /nfs/dbraw/zinc/88/07/95/1044880795.db2.gz MROJLOVJRGJDCD-MRXNPFEDSA-N 1 2 315.461 4.468 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2nc(CCC(C)C)no2)c1 ZINC000524595493 1044880812 /nfs/dbraw/zinc/88/08/12/1044880812.db2.gz MROJLOVJRGJDCD-MRXNPFEDSA-N 1 2 315.461 4.468 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2nc(CC(C)C)no2)c1 ZINC000524594217 1044881779 /nfs/dbraw/zinc/88/17/79/1044881779.db2.gz HUBSBVXDYSCMLF-HNNXBMFYSA-N 1 2 301.434 4.078 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2nc(CC(C)C)no2)c1 ZINC000524594217 1044881794 /nfs/dbraw/zinc/88/17/94/1044881794.db2.gz HUBSBVXDYSCMLF-HNNXBMFYSA-N 1 2 301.434 4.078 20 0 DIADLO Brc1ccc([C@H]2CCC[N@@H+]2Cc2cccnc2)s1 ZINC000371751710 1044889813 /nfs/dbraw/zinc/88/98/13/1044889813.db2.gz AYMVVGVPHBUGSX-GFCCVEGCSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc([C@H]2CCC[N@H+]2Cc2cccnc2)s1 ZINC000371751710 1044889836 /nfs/dbraw/zinc/88/98/36/1044889836.db2.gz AYMVVGVPHBUGSX-GFCCVEGCSA-N 1 2 323.259 4.243 20 0 DIADLO O=C(Nc1cccc2ccsc21)c1cccc(-n2cc[nH+]c2)c1 ZINC000337422663 1044896557 /nfs/dbraw/zinc/89/65/57/1044896557.db2.gz VGRNOQIZWWTPPE-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@@](F)(c3ccccc3C)C2)c(C)s1 ZINC000337416130 1044897444 /nfs/dbraw/zinc/89/74/44/1044897444.db2.gz RKXWTFJRTLLEEE-KRWDZBQOSA-N 1 2 304.434 4.139 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@@](F)(c3ccccc3C)C2)c(C)s1 ZINC000337416130 1044897462 /nfs/dbraw/zinc/89/74/62/1044897462.db2.gz RKXWTFJRTLLEEE-KRWDZBQOSA-N 1 2 304.434 4.139 20 0 DIADLO CC(C)N(Cc1ccc(-n2cc[nH+]c2)cc1)c1ccc(F)cc1 ZINC001168086445 1044899848 /nfs/dbraw/zinc/89/98/48/1044899848.db2.gz QGOJKLTYFRXNAS-UHFFFAOYSA-N 1 2 309.388 4.426 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1cnn(C2CCCC2)c1 ZINC000337494764 1044910215 /nfs/dbraw/zinc/91/02/15/1044910215.db2.gz XVQQXNFFULRKDG-GFCCVEGCSA-N 1 2 316.474 4.183 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@H](c1ccccc1)c1cccnc1 ZINC000372414480 1044913370 /nfs/dbraw/zinc/91/33/70/1044913370.db2.gz BHJZMWBIQKKWKM-HXUWFJFHSA-N 1 2 322.383 4.109 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](CC(F)(F)F)c2ccccc2)nn1C ZINC000337532093 1044914443 /nfs/dbraw/zinc/91/44/43/1044914443.db2.gz VVRXOPKGZZVDKW-IUODEOHRSA-N 1 2 311.351 4.073 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H]2CC(C)(C)Oc3cc(F)ccc32)no1 ZINC000337560238 1044919744 /nfs/dbraw/zinc/91/97/44/1044919744.db2.gz URMXDMSDBCVHIN-IAQYHMDHSA-N 1 2 304.365 4.075 20 0 DIADLO CC(C)COC1CCN(c2[nH+]ccc3cc(F)ccc32)CC1 ZINC000573838820 1044924369 /nfs/dbraw/zinc/92/43/69/1044924369.db2.gz DFDSAKODWXZIPE-UHFFFAOYSA-N 1 2 302.393 4.015 20 0 DIADLO CC(=O)Nc1cccc(C[N@@H+](C)[C@@H](C)c2c(F)cccc2F)c1 ZINC000337663473 1044936790 /nfs/dbraw/zinc/93/67/90/1044936790.db2.gz NUQANSFWLBZEOY-LBPRGKRZSA-N 1 2 318.367 4.116 20 0 DIADLO CC(=O)Nc1cccc(C[N@H+](C)[C@@H](C)c2c(F)cccc2F)c1 ZINC000337663473 1044936798 /nfs/dbraw/zinc/93/67/98/1044936798.db2.gz NUQANSFWLBZEOY-LBPRGKRZSA-N 1 2 318.367 4.116 20 0 DIADLO CC[NH+](CC)[C@H](C(=O)OC(C)C)c1cccc(C(F)(F)F)c1 ZINC000524894939 1044944077 /nfs/dbraw/zinc/94/40/77/1044944077.db2.gz CPROGBIISKTUTD-AWEZNQCLSA-N 1 2 317.351 4.040 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cc(-c3ccc(F)cc3)no2)s1 ZINC000348501374 1044999643 /nfs/dbraw/zinc/99/96/43/1044999643.db2.gz YXZOZUVYGKYTBF-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO CCOc1ccccc1C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000373665955 1045000245 /nfs/dbraw/zinc/00/02/45/1045000245.db2.gz JYTNDJMOECTHFZ-UHFFFAOYSA-N 1 2 321.380 4.036 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)CSc1ccccc1 ZINC000373693127 1045002035 /nfs/dbraw/zinc/00/20/35/1045002035.db2.gz DUMIATBZVDUMOS-UHFFFAOYSA-N 1 2 323.421 4.116 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H](C)c3cccc(Cl)c3)ccc2[nH+]1 ZINC000525152677 1045002097 /nfs/dbraw/zinc/00/20/97/1045002097.db2.gz TUYLOINWVKTYNH-LBPRGKRZSA-N 1 2 313.788 4.038 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cc(F)ccc1C ZINC000373705768 1045002151 /nfs/dbraw/zinc/00/21/51/1045002151.db2.gz MZDRHZMPKKTMMP-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO CCOc1ccc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)cc1 ZINC000373707891 1045002936 /nfs/dbraw/zinc/00/29/36/1045002936.db2.gz SXFRMECIJFGYGP-UHFFFAOYSA-N 1 2 321.380 4.036 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(CC)no2)cc1 ZINC000114751790 1045009402 /nfs/dbraw/zinc/00/94/02/1045009402.db2.gz FFHKGVHMILTNNA-RYUDHWBXSA-N 1 2 305.447 4.156 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2ccc(-c3ccccn3)nc2)cs1 ZINC000575863511 1045013727 /nfs/dbraw/zinc/01/37/27/1045013727.db2.gz OJKNAZIQWNXLDA-CYBMUJFWSA-N 1 2 324.453 4.013 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)nc1 ZINC000411534334 1045015500 /nfs/dbraw/zinc/01/55/00/1045015500.db2.gz PGDRIQATJDXFNS-LBPRGKRZSA-N 1 2 303.475 4.249 20 0 DIADLO CCCc1occc1C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000374104642 1045029593 /nfs/dbraw/zinc/02/95/93/1045029593.db2.gz FNHRDOZYXQLLSL-UHFFFAOYSA-N 1 2 309.369 4.183 20 0 DIADLO CCc1cnc(C[N@H+](C)[C@@H](C)c2cccc(C(F)(F)F)c2)o1 ZINC000525270019 1045029499 /nfs/dbraw/zinc/02/94/99/1045029499.db2.gz OQMJHJYRMFVYIS-NSHDSACASA-N 1 2 312.335 4.449 20 0 DIADLO CCc1cnc(C[N@@H+](C)[C@@H](C)c2cccc(C(F)(F)F)c2)o1 ZINC000525270019 1045029505 /nfs/dbraw/zinc/02/95/05/1045029505.db2.gz OQMJHJYRMFVYIS-NSHDSACASA-N 1 2 312.335 4.449 20 0 DIADLO COc1cc(CNc2ccc(N3CCCCC3)[nH+]c2)ccc1C ZINC000446815075 1045042798 /nfs/dbraw/zinc/04/27/98/1045042798.db2.gz PVEMPPHUOHAPAP-UHFFFAOYSA-N 1 2 311.429 4.001 20 0 DIADLO CCc1nnc(C[NH2+][C@H](c2ccc(CC(C)C)cc2)C2CC2)o1 ZINC000152635972 1045044986 /nfs/dbraw/zinc/04/49/86/1045044986.db2.gz ZSMMRSUACKYCRW-LJQANCHMSA-N 1 2 313.445 4.071 20 0 DIADLO CCc1nc(C[N@H+](C)[C@@H]2CCCc3nc(CC)sc32)cs1 ZINC000152724196 1045046580 /nfs/dbraw/zinc/04/65/80/1045046580.db2.gz ADVYHIZRKJQCSW-CYBMUJFWSA-N 1 2 321.515 4.234 20 0 DIADLO CCc1nc(C[N@@H+](C)[C@@H]2CCCc3nc(CC)sc32)cs1 ZINC000152724196 1045046592 /nfs/dbraw/zinc/04/65/92/1045046592.db2.gz ADVYHIZRKJQCSW-CYBMUJFWSA-N 1 2 321.515 4.234 20 0 DIADLO C[C@@H](C[N@H+](C)Cc1noc(C2CCCCC2)n1)c1ccccc1 ZINC000446828935 1045048160 /nfs/dbraw/zinc/04/81/60/1045048160.db2.gz BDBIMSRCUKDYCO-HNNXBMFYSA-N 1 2 313.445 4.353 20 0 DIADLO C[C@@H](C[N@@H+](C)Cc1noc(C2CCCCC2)n1)c1ccccc1 ZINC000446828935 1045048170 /nfs/dbraw/zinc/04/81/70/1045048170.db2.gz BDBIMSRCUKDYCO-HNNXBMFYSA-N 1 2 313.445 4.353 20 0 DIADLO CC[N@H+](Cc1occc1C)Cc1nc2ccccc2n1C(F)F ZINC000412040682 1045052066 /nfs/dbraw/zinc/05/20/66/1045052066.db2.gz MAIOBUOIJNAGII-UHFFFAOYSA-N 1 2 319.355 4.355 20 0 DIADLO CC[N@@H+](Cc1occc1C)Cc1nc2ccccc2n1C(F)F ZINC000412040682 1045052078 /nfs/dbraw/zinc/05/20/78/1045052078.db2.gz MAIOBUOIJNAGII-UHFFFAOYSA-N 1 2 319.355 4.355 20 0 DIADLO CC[N@H+](Cc1occc1C)[C@H](C)c1nc(-c2ccccc2)no1 ZINC000412044548 1045052490 /nfs/dbraw/zinc/05/24/90/1045052490.db2.gz QRTWYBDJCMJLBD-CQSZACIVSA-N 1 2 311.385 4.221 20 0 DIADLO CC[N@@H+](Cc1occc1C)[C@H](C)c1nc(-c2ccccc2)no1 ZINC000412044548 1045052507 /nfs/dbraw/zinc/05/25/07/1045052507.db2.gz QRTWYBDJCMJLBD-CQSZACIVSA-N 1 2 311.385 4.221 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)n1 ZINC000374505885 1045065260 /nfs/dbraw/zinc/06/52/60/1045065260.db2.gz OBCRKTRGHJOCFV-AWEZNQCLSA-N 1 2 315.383 4.019 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)n1 ZINC000374505885 1045065273 /nfs/dbraw/zinc/06/52/73/1045065273.db2.gz OBCRKTRGHJOCFV-AWEZNQCLSA-N 1 2 315.383 4.019 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+](Cc1ccccc1F)C1CC1 ZINC000428456989 1045065996 /nfs/dbraw/zinc/06/59/96/1045065996.db2.gz GSTJSXATRCXNFH-UHFFFAOYSA-N 1 2 302.393 4.410 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+](Cc1ccccc1F)C1CC1 ZINC000428456989 1045066003 /nfs/dbraw/zinc/06/60/03/1045066003.db2.gz GSTJSXATRCXNFH-UHFFFAOYSA-N 1 2 302.393 4.410 20 0 DIADLO C[N@H+](Cc1nc2ccc(F)cc2s1)Cc1cc(F)cc(F)c1 ZINC000446977992 1045079396 /nfs/dbraw/zinc/07/93/96/1045079396.db2.gz UMXYEOSOJGAMLO-UHFFFAOYSA-N 1 2 322.355 4.346 20 0 DIADLO C[N@@H+](Cc1nc2ccc(F)cc2s1)Cc1cc(F)cc(F)c1 ZINC000446977992 1045079408 /nfs/dbraw/zinc/07/94/08/1045079408.db2.gz UMXYEOSOJGAMLO-UHFFFAOYSA-N 1 2 322.355 4.346 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000447076107 1045093792 /nfs/dbraw/zinc/09/37/92/1045093792.db2.gz MEAHRQMKORFZGL-UHFFFAOYSA-N 1 2 315.461 4.126 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000447076107 1045093803 /nfs/dbraw/zinc/09/38/03/1045093803.db2.gz MEAHRQMKORFZGL-UHFFFAOYSA-N 1 2 315.461 4.126 20 0 DIADLO Cc1ccc(C[S@](=O)Cc2ccc(C3CCC3)cc2)c(C)[nH+]1 ZINC000447111004 1045096704 /nfs/dbraw/zinc/09/67/04/1045096704.db2.gz CWMUSLLSXWLRPC-JOCHJYFZSA-N 1 2 313.466 4.415 20 0 DIADLO C[N@H+](Cc1cc(C(C)(C)C)n[nH]1)Cc1ccc(Cl)c(F)c1 ZINC000447093266 1045098276 /nfs/dbraw/zinc/09/82/76/1045098276.db2.gz IETWZHVGARBCBI-UHFFFAOYSA-N 1 2 309.816 4.132 20 0 DIADLO C[N@@H+](Cc1cc(C(C)(C)C)n[nH]1)Cc1ccc(Cl)c(F)c1 ZINC000447093266 1045098287 /nfs/dbraw/zinc/09/82/87/1045098287.db2.gz IETWZHVGARBCBI-UHFFFAOYSA-N 1 2 309.816 4.132 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(C)cc2OC)[nH]1 ZINC000577129236 1045102422 /nfs/dbraw/zinc/10/24/22/1045102422.db2.gz BXTQUPUJJWJGAL-BFHYXJOUSA-N 1 2 316.449 4.047 20 0 DIADLO Cc1ccc2ccccc2c1C[N@@H+](C)Cc1ncc(Cl)n1C ZINC000778988248 1045103161 /nfs/dbraw/zinc/10/31/61/1045103161.db2.gz BXFUVBIVJBGRTJ-UHFFFAOYSA-N 1 2 313.832 4.167 20 0 DIADLO Cc1ccc2ccccc2c1C[N@H+](C)Cc1ncc(Cl)n1C ZINC000778988248 1045103169 /nfs/dbraw/zinc/10/31/69/1045103169.db2.gz BXFUVBIVJBGRTJ-UHFFFAOYSA-N 1 2 313.832 4.167 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2nc3ccc(C)cc3[nH]2)C2CCC2)o1 ZINC000577247737 1045111608 /nfs/dbraw/zinc/11/16/08/1045111608.db2.gz MPUXKZBVMSMJIE-LJQANCHMSA-N 1 2 309.413 4.404 20 0 DIADLO CC[C@H]1c2ccccc2CN1c1[nH+]cnc2c1cnn2C(C)(C)C ZINC000897353743 1045125004 /nfs/dbraw/zinc/12/50/04/1045125004.db2.gz DWFOIBAQIWIBMP-INIZCTEOSA-N 1 2 321.428 4.053 20 0 DIADLO COC(=O)c1sccc1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000447383079 1045125799 /nfs/dbraw/zinc/12/57/99/1045125799.db2.gz RDXGEUHYLCLXOM-OAHLLOKOSA-N 1 2 319.401 4.011 20 0 DIADLO COC(=O)c1sccc1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000447383079 1045125802 /nfs/dbraw/zinc/12/58/02/1045125802.db2.gz RDXGEUHYLCLXOM-OAHLLOKOSA-N 1 2 319.401 4.011 20 0 DIADLO CC[C@@H]1c2ccccc2CN1c1[nH+]cnc2c1cnn2C(C)(C)C ZINC000897353745 1045126001 /nfs/dbraw/zinc/12/60/01/1045126001.db2.gz DWFOIBAQIWIBMP-MRXNPFEDSA-N 1 2 321.428 4.053 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC(c3ccncc3)CC2)c1 ZINC000577488317 1045127023 /nfs/dbraw/zinc/12/70/23/1045127023.db2.gz SMGMMJOGBGOUPD-UHFFFAOYSA-N 1 2 307.372 4.153 20 0 DIADLO Clc1ccc2cc3n(c2c1)CC[N@@H+](CC[C@H]1CCCCO1)C3 ZINC000447400962 1045130144 /nfs/dbraw/zinc/13/01/44/1045130144.db2.gz UDOZPUBNDKZVHZ-QGZVFWFLSA-N 1 2 318.848 4.070 20 0 DIADLO Clc1ccc2cc3n(c2c1)CC[N@H+](CC[C@H]1CCCCO1)C3 ZINC000447400962 1045130148 /nfs/dbraw/zinc/13/01/48/1045130148.db2.gz UDOZPUBNDKZVHZ-QGZVFWFLSA-N 1 2 318.848 4.070 20 0 DIADLO Cc1ccccc1[C@H](C)c1noc([C@H](CC(C)C)n2cc[nH+]c2)n1 ZINC000923955727 1045143891 /nfs/dbraw/zinc/14/38/91/1045143891.db2.gz INLHLTAZMJZBGS-RDJZCZTQSA-N 1 2 324.428 4.362 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+]CCN2CCCC(C)(C)C2)cs1 ZINC000447549824 1045145526 /nfs/dbraw/zinc/14/55/26/1045145526.db2.gz GBCAHYSYTGALGP-AWEZNQCLSA-N 1 2 309.523 4.039 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+]CC[C@@H](C)c1ccccc1 ZINC000447731742 1045170246 /nfs/dbraw/zinc/17/02/46/1045170246.db2.gz UIGDDPSFUCBNMD-QGZVFWFLSA-N 1 2 324.468 4.437 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2nc(C)cs2)c2cccnc2)cc1 ZINC000924612655 1045183767 /nfs/dbraw/zinc/18/37/67/1045183767.db2.gz ALWHGVMGHWMYRK-IBGZPJMESA-N 1 2 323.465 4.288 20 0 DIADLO CC(C)(C)c1cnc(CNc2cccc(-n3cc[nH+]c3)c2)s1 ZINC000447891356 1045185617 /nfs/dbraw/zinc/18/56/17/1045185617.db2.gz BFPZLAUUYQOTNM-UHFFFAOYSA-N 1 2 312.442 4.238 20 0 DIADLO C[C@H](Nc1cc(N2CCCC2)nc[nH+]1)c1cccc2ccccc21 ZINC000557477654 1045187291 /nfs/dbraw/zinc/18/72/91/1045187291.db2.gz HQJDZWULKDUTRQ-HNNXBMFYSA-N 1 2 318.424 4.403 20 0 DIADLO C[C@H](Nc1cc(N2CCCC2)[nH+]cn1)c1cccc2ccccc21 ZINC000557477654 1045187302 /nfs/dbraw/zinc/18/73/02/1045187302.db2.gz HQJDZWULKDUTRQ-HNNXBMFYSA-N 1 2 318.424 4.403 20 0 DIADLO CC[C@H]([NH2+][C@H]1CCCc2oc(C)nc21)c1ccccc1OC ZINC000924646064 1045187702 /nfs/dbraw/zinc/18/77/02/1045187702.db2.gz JRPAKZYJEPGPMS-GJZGRUSLSA-N 1 2 300.402 4.110 20 0 DIADLO Cc1ccc2c(c1C)OC[C@@H]2[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000447942462 1045189688 /nfs/dbraw/zinc/18/96/88/1045189688.db2.gz VBCGVALCACBVPB-AWEZNQCLSA-N 1 2 316.470 4.281 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2csc(C(F)(F)F)c2)cs1 ZINC000924723639 1045194415 /nfs/dbraw/zinc/19/44/15/1045194415.db2.gz SVOBGWSZASSDBV-SSDOTTSWSA-N 1 2 306.378 4.383 20 0 DIADLO C[C@@H]([NH2+]Cc1ccoc1)c1ncc(C(F)(F)F)cc1Cl ZINC000924749239 1045196242 /nfs/dbraw/zinc/19/62/42/1045196242.db2.gz YKHCHDCHUFUBJN-MRVPVSSYSA-N 1 2 304.699 4.198 20 0 DIADLO C[C@H]([NH2+]Cc1ccoc1)c1ncc(C(F)(F)F)cc1Cl ZINC000924749240 1045196943 /nfs/dbraw/zinc/19/69/43/1045196943.db2.gz YKHCHDCHUFUBJN-QMMMGPOBSA-N 1 2 304.699 4.198 20 0 DIADLO CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000577989842 1045197297 /nfs/dbraw/zinc/19/72/97/1045197297.db2.gz WBCISKARBPZVNF-KRWDZBQOSA-N 1 2 322.412 4.339 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@H](c1nc2ccccc2[nH]1)C(C)C ZINC000924784096 1045198495 /nfs/dbraw/zinc/19/84/95/1045198495.db2.gz ACIZGHPYIJVFSX-RDJZCZTQSA-N 1 2 324.428 4.224 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2c(C)noc2C)c2cccnc2)cc1 ZINC000924782692 1045198621 /nfs/dbraw/zinc/19/86/21/1045198621.db2.gz QXRIMAAWDLRDOZ-HXUWFJFHSA-N 1 2 321.424 4.128 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2ccc3c(c2)CCO3)cc1)c1ncco1 ZINC000924872326 1045207932 /nfs/dbraw/zinc/20/79/32/1045207932.db2.gz ZKDXUTQLSOOQTP-CQSZACIVSA-N 1 2 320.392 4.127 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1Oc1ccccc1)c1cnn(C)n1 ZINC000924899347 1045210240 /nfs/dbraw/zinc/21/02/40/1045210240.db2.gz DKOLAIQYTURGJN-GJZGRUSLSA-N 1 2 322.412 4.019 20 0 DIADLO COc1ccc2oc([C@@H](C)[NH2+][C@@H](C)c3ncco3)c(C)c2c1 ZINC000924985869 1045216976 /nfs/dbraw/zinc/21/69/76/1045216976.db2.gz GGFFUIPQZDCCCX-NEPJUHHUSA-N 1 2 300.358 4.150 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1csc(-c2ccccc2)n1 ZINC000578169023 1045217637 /nfs/dbraw/zinc/21/76/37/1045217637.db2.gz JYXTYHTZQROERD-UGSOOPFHSA-N 1 2 322.433 4.422 20 0 DIADLO CC(C)c1ccc(NC(=O)[C@@H](C)Cc2c[nH]c[nH+]2)c(C(C)C)c1 ZINC000578204724 1045219565 /nfs/dbraw/zinc/21/95/65/1045219565.db2.gz ZFOSVIQSOCIXFP-AWEZNQCLSA-N 1 2 313.445 4.474 20 0 DIADLO CC(C)c1ccc(NC(=O)[C@@H](C)Cc2c[nH+]c[nH]2)c(C(C)C)c1 ZINC000578204724 1045219576 /nfs/dbraw/zinc/21/95/76/1045219576.db2.gz ZFOSVIQSOCIXFP-AWEZNQCLSA-N 1 2 313.445 4.474 20 0 DIADLO CC(C)c1cccc([C@H](C)[NH2+]Cc2n[nH]cc2Br)c1 ZINC000527862821 1045269930 /nfs/dbraw/zinc/26/99/30/1045269930.db2.gz IGAYEXDCSJQYQT-NSHDSACASA-N 1 2 322.250 4.146 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H]2CCc3c2nccc3Cl)cs1 ZINC000925034765 1045220235 /nfs/dbraw/zinc/22/02/35/1045220235.db2.gz UKZXHRODBPCCEX-JOYOIKCWSA-N 1 2 307.850 4.092 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccn1)c1ccc(SC2CCCC2)cc1 ZINC000578207382 1045221667 /nfs/dbraw/zinc/22/16/67/1045221667.db2.gz VNOVMGJRSDGFKP-CQSZACIVSA-N 1 2 313.470 4.362 20 0 DIADLO CC(C)c1cc(C[NH2+][C@@H]2CCCc3c(Cl)ccnc32)on1 ZINC000925069834 1045222583 /nfs/dbraw/zinc/22/25/83/1045222583.db2.gz XAKTVVWESMSMPH-CQSZACIVSA-N 1 2 305.809 4.014 20 0 DIADLO CCCCCC(CCCCC)NC(=O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000779057071 1045224385 /nfs/dbraw/zinc/22/43/85/1045224385.db2.gz DKHAOGKWGYPKHP-MRXNPFEDSA-N 1 2 319.493 4.091 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2Cl)on1 ZINC000925093861 1045225929 /nfs/dbraw/zinc/22/59/29/1045225929.db2.gz TWDYICRPBIJTLF-DTWKUNHWSA-N 1 2 315.200 4.402 20 0 DIADLO CCc1cc(C[NH2+][C@@H](Cc2ccccc2C)c2ccco2)on1 ZINC000925127871 1045229632 /nfs/dbraw/zinc/22/96/32/1045229632.db2.gz IKPPVLMGDIJLJR-SFHVURJKSA-N 1 2 310.397 4.212 20 0 DIADLO Cc1ccc2oc(C[NH2+]Cc3ccn(-c4ccccc4)n3)cc2c1 ZINC000557759987 1045229950 /nfs/dbraw/zinc/22/99/50/1045229950.db2.gz ZABHZSOMZJCUEB-UHFFFAOYSA-N 1 2 317.392 4.217 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccnn1C1CCC1 ZINC000925154951 1045230696 /nfs/dbraw/zinc/23/06/96/1045230696.db2.gz SQDKCZPMEIHTQP-AWEZNQCLSA-N 1 2 322.412 4.114 20 0 DIADLO C[N@H+](CCOCc1ccccc1)Cc1ncc(C(C)(C)C)s1 ZINC000448337705 1045231576 /nfs/dbraw/zinc/23/15/76/1045231576.db2.gz SPDZUCAOUKYDPN-UHFFFAOYSA-N 1 2 318.486 4.089 20 0 DIADLO C[N@@H+](CCOCc1ccccc1)Cc1ncc(C(C)(C)C)s1 ZINC000448337705 1045231584 /nfs/dbraw/zinc/23/15/84/1045231584.db2.gz SPDZUCAOUKYDPN-UHFFFAOYSA-N 1 2 318.486 4.089 20 0 DIADLO C[N@H+](Cc1ccc(Br)cc1Cl)CC1(F)CC1 ZINC000527528364 1045234273 /nfs/dbraw/zinc/23/42/73/1045234273.db2.gz FRAIBZCGKXDMDV-UHFFFAOYSA-N 1 2 306.606 4.036 20 0 DIADLO C[N@@H+](Cc1ccc(Br)cc1Cl)CC1(F)CC1 ZINC000527528364 1045234284 /nfs/dbraw/zinc/23/42/84/1045234284.db2.gz FRAIBZCGKXDMDV-UHFFFAOYSA-N 1 2 306.606 4.036 20 0 DIADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ccsc1Br ZINC000527708392 1045251293 /nfs/dbraw/zinc/25/12/93/1045251293.db2.gz GVXMPHHHGGTPKF-NOZJJQNGSA-N 1 2 324.243 4.122 20 0 DIADLO Cc1cc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)ccn1 ZINC000527699834 1045251976 /nfs/dbraw/zinc/25/19/76/1045251976.db2.gz JODBPEQVILLPAC-UHFFFAOYSA-N 1 2 318.424 4.202 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@H]2c2cccnc2)c2ccccn21 ZINC000578540156 1045252145 /nfs/dbraw/zinc/25/21/45/1045252145.db2.gz OMDCCXKXBYCWBF-SFHVURJKSA-N 1 2 320.440 4.190 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@H]2c2cccnc2)c2ccccn21 ZINC000578540156 1045252156 /nfs/dbraw/zinc/25/21/56/1045252156.db2.gz OMDCCXKXBYCWBF-SFHVURJKSA-N 1 2 320.440 4.190 20 0 DIADLO COc1cc(C[NH2+][C@@H](C)c2cscn2)cc(C(F)(F)F)c1 ZINC000527723875 1045252965 /nfs/dbraw/zinc/25/29/65/1045252965.db2.gz FLDVCSQQSDATQS-VIFPVBQESA-N 1 2 316.348 4.021 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](c2ccccn2)C2CCC2)cs1 ZINC000527773839 1045262664 /nfs/dbraw/zinc/26/26/64/1045262664.db2.gz RZXHCUQMOSNFAL-INIZCTEOSA-N 1 2 301.459 4.293 20 0 DIADLO Cc1[nH]c(CNc2cc(C(C)(C)C)cc3cccnc32)[nH+]c1C ZINC000527797640 1045263796 /nfs/dbraw/zinc/26/37/96/1045263796.db2.gz CQSYAVSCGYAXMO-UHFFFAOYSA-N 1 2 308.429 4.484 20 0 DIADLO O[C@H](c1ccccc1)C1CCN(c2[nH+]ccc3ccccc32)CC1 ZINC000527835091 1045266662 /nfs/dbraw/zinc/26/66/62/1045266662.db2.gz ITADSQHDFHSZED-HXUWFJFHSA-N 1 2 318.420 4.185 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2ncn(-c3ccccc3)n2)C(C)C)c1 ZINC000527903831 1045279672 /nfs/dbraw/zinc/27/96/72/1045279672.db2.gz TUSJCBJQIKRKGY-HXUWFJFHSA-N 1 2 320.440 4.063 20 0 DIADLO Cc1ccc([C@@H](C)N(C)C(=O)c2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000117598319 1045308111 /nfs/dbraw/zinc/30/81/11/1045308111.db2.gz HUFCGHKZTUEDMC-MRXNPFEDSA-N 1 2 319.408 4.014 20 0 DIADLO FC1(F)CCC12C[NH+](Cc1cnc(-c3cccs3)s1)C2 ZINC000579538708 1045321964 /nfs/dbraw/zinc/32/19/64/1045321964.db2.gz SKIHYZDPAQEBDY-UHFFFAOYSA-N 1 2 312.410 4.103 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ccco2)Cc2ccc(F)nc2)c1 ZINC000779154379 1045328279 /nfs/dbraw/zinc/32/82/79/1045328279.db2.gz STFLWVYFIZXRJA-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ccco2)Cc2ccc(F)nc2)c1 ZINC000779154379 1045328284 /nfs/dbraw/zinc/32/82/84/1045328284.db2.gz STFLWVYFIZXRJA-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@@H]2c2ncc[nH]2)cc2ccccc21 ZINC000449014645 1045331053 /nfs/dbraw/zinc/33/10/53/1045331053.db2.gz BDBKELDPMNYJBB-GOSISDBHSA-N 1 2 321.424 4.299 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@@H]2c2ncc[nH]2)cc2ccccc21 ZINC000449014645 1045331057 /nfs/dbraw/zinc/33/10/57/1045331057.db2.gz BDBKELDPMNYJBB-GOSISDBHSA-N 1 2 321.424 4.299 20 0 DIADLO Clc1cc(CN2CCC(n3cc[nH+]c3)CC2)c(Cl)s1 ZINC000449016241 1045331525 /nfs/dbraw/zinc/33/15/25/1045331525.db2.gz FHRBAODGOCNJII-UHFFFAOYSA-N 1 2 316.257 4.089 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)c1ccc(-c2ccccc2)cc1 ZINC000074859460 1045332117 /nfs/dbraw/zinc/33/21/17/1045332117.db2.gz KFTAUJZZXDMKKF-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO C[N@@H+](Cc1ccoc1)Cc1cnc(CCc2ccccc2)s1 ZINC000449019715 1045332736 /nfs/dbraw/zinc/33/27/36/1045332736.db2.gz XAPZOVAFFLRDPL-UHFFFAOYSA-N 1 2 312.438 4.153 20 0 DIADLO C[N@H+](Cc1ccoc1)Cc1cnc(CCc2ccccc2)s1 ZINC000449019715 1045332743 /nfs/dbraw/zinc/33/27/43/1045332743.db2.gz XAPZOVAFFLRDPL-UHFFFAOYSA-N 1 2 312.438 4.153 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1cccc(Br)c1F ZINC000449031649 1045335195 /nfs/dbraw/zinc/33/51/95/1045335195.db2.gz XDGINZLKJPIFHF-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1cccc(Br)c1F ZINC000449031649 1045335203 /nfs/dbraw/zinc/33/52/03/1045335203.db2.gz XDGINZLKJPIFHF-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC1(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)CCC(F)(F)CC1 ZINC000528323711 1045336762 /nfs/dbraw/zinc/33/67/62/1045336762.db2.gz QYUGVIRXTHPRAQ-UHFFFAOYSA-N 1 2 319.355 4.231 20 0 DIADLO CC[C@@H](C)C[N@H+](CC)Cn1nc(C(F)(F)F)sc1=S ZINC000188694039 1045338128 /nfs/dbraw/zinc/33/81/28/1045338128.db2.gz HDHRUAATPHYGAP-MRVPVSSYSA-N 1 2 313.414 4.018 20 0 DIADLO CC[C@@H](C)C[N@@H+](CC)Cn1nc(C(F)(F)F)sc1=S ZINC000188694039 1045338130 /nfs/dbraw/zinc/33/81/30/1045338130.db2.gz HDHRUAATPHYGAP-MRVPVSSYSA-N 1 2 313.414 4.018 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2nnc(C(C)(C)C)o2)C1 ZINC000075843130 1045340334 /nfs/dbraw/zinc/34/03/34/1045340334.db2.gz PHDRYHWKXAJCKR-DOMZBBRYSA-N 1 2 317.408 4.089 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2nnc(C(C)(C)C)o2)C1 ZINC000075843130 1045340339 /nfs/dbraw/zinc/34/03/39/1045340339.db2.gz PHDRYHWKXAJCKR-DOMZBBRYSA-N 1 2 317.408 4.089 20 0 DIADLO C[C@H]([NH2+]Cc1ccnn1C1CCCC1)c1c(F)cccc1F ZINC000449087292 1045342741 /nfs/dbraw/zinc/34/27/41/1045342741.db2.gz FOVQOOHKZHKHIV-LBPRGKRZSA-N 1 2 305.372 4.127 20 0 DIADLO C[N@H+](Cc1cccc(C(F)(F)F)c1)Cc1ncccc1Cl ZINC000528359352 1045345481 /nfs/dbraw/zinc/34/54/81/1045345481.db2.gz SFOJJDABVDKCPR-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1cccc(C(F)(F)F)c1)Cc1ncccc1Cl ZINC000528359352 1045345485 /nfs/dbraw/zinc/34/54/85/1045345485.db2.gz SFOJJDABVDKCPR-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2ncccc2Cl)s1 ZINC000528386599 1045348484 /nfs/dbraw/zinc/34/84/84/1045348484.db2.gz JPLVPYQAFONESJ-NSHDSACASA-N 1 2 309.866 4.255 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2ncccc2Cl)s1 ZINC000528386599 1045348492 /nfs/dbraw/zinc/34/84/92/1045348492.db2.gz JPLVPYQAFONESJ-NSHDSACASA-N 1 2 309.866 4.255 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2ncccc2Cl)s1 ZINC000528386591 1045349072 /nfs/dbraw/zinc/34/90/72/1045349072.db2.gz JPLVPYQAFONESJ-LLVKDONJSA-N 1 2 309.866 4.255 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ncccc2Cl)s1 ZINC000528386591 1045349077 /nfs/dbraw/zinc/34/90/77/1045349077.db2.gz JPLVPYQAFONESJ-LLVKDONJSA-N 1 2 309.866 4.255 20 0 DIADLO COc1cc(C)ccc1C[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000449132718 1045350257 /nfs/dbraw/zinc/35/02/57/1045350257.db2.gz VYCRTWDHSARCLW-UHFFFAOYSA-N 1 2 304.459 4.047 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1ncccc1Cl)CCC2 ZINC000528415097 1045352202 /nfs/dbraw/zinc/35/22/02/1045352202.db2.gz DSYJTYXAYXUDLL-AWEZNQCLSA-N 1 2 307.850 4.009 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ncccc1Cl)CCC2 ZINC000528415097 1045352208 /nfs/dbraw/zinc/35/22/08/1045352208.db2.gz DSYJTYXAYXUDLL-AWEZNQCLSA-N 1 2 307.850 4.009 20 0 DIADLO Fc1cccc(F)c1C[N@H+](Cc1cc2cccnc2o1)C1CC1 ZINC000449276958 1045369636 /nfs/dbraw/zinc/36/96/36/1045369636.db2.gz DLZIDIXRFVHUGH-UHFFFAOYSA-N 1 2 314.335 4.271 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](Cc1cc2cccnc2o1)C1CC1 ZINC000449276958 1045369639 /nfs/dbraw/zinc/36/96/39/1045369639.db2.gz DLZIDIXRFVHUGH-UHFFFAOYSA-N 1 2 314.335 4.271 20 0 DIADLO c1csc([C@H]2CSCC[N@H+]2Cc2cccc3ccoc32)n1 ZINC000449248342 1045370313 /nfs/dbraw/zinc/37/03/13/1045370313.db2.gz JIOGJXVBLZZLDN-CQSZACIVSA-N 1 2 316.451 4.179 20 0 DIADLO c1csc([C@H]2CSCC[N@@H+]2Cc2cccc3ccoc32)n1 ZINC000449248342 1045370318 /nfs/dbraw/zinc/37/03/18/1045370318.db2.gz JIOGJXVBLZZLDN-CQSZACIVSA-N 1 2 316.451 4.179 20 0 DIADLO FC(F)OC[C@H]1CC[N@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449318698 1045376615 /nfs/dbraw/zinc/37/66/15/1045376615.db2.gz DMQNSZAJLPKWSJ-ZETCQYMHSA-N 1 2 316.200 4.116 20 0 DIADLO FC(F)OC[C@H]1CC[N@@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449318698 1045376621 /nfs/dbraw/zinc/37/66/21/1045376621.db2.gz DMQNSZAJLPKWSJ-ZETCQYMHSA-N 1 2 316.200 4.116 20 0 DIADLO COCC1CCC(Nc2ccc(-n3c[nH+]c(C)c3C)cc2)CC1 ZINC000449334758 1045380710 /nfs/dbraw/zinc/38/07/10/1045380710.db2.gz GODOAQYXGLPJOX-UHFFFAOYSA-N 1 2 313.445 4.106 20 0 DIADLO C[C@@H](C[N@@H+]1CC(C)(C)[C@H]1c1nccn1C)c1cccc(Cl)c1 ZINC000449414159 1045388152 /nfs/dbraw/zinc/38/81/52/1045388152.db2.gz LJOVMVDPULYWFS-XJKSGUPXSA-N 1 2 317.864 4.260 20 0 DIADLO C[C@@H](C[N@H+]1CC(C)(C)[C@H]1c1nccn1C)c1cccc(Cl)c1 ZINC000449414159 1045388157 /nfs/dbraw/zinc/38/81/57/1045388157.db2.gz LJOVMVDPULYWFS-XJKSGUPXSA-N 1 2 317.864 4.260 20 0 DIADLO Cc1noc(C23CC(C2)C[N@@H+]3Cc2ccc(C3CCCC3)cc2)n1 ZINC000528618272 1045388809 /nfs/dbraw/zinc/38/88/09/1045388809.db2.gz SBGHGNHPFFHOHC-UHFFFAOYSA-N 1 2 323.440 4.157 20 0 DIADLO Cc1noc(C23CC(C2)C[N@H+]3Cc2ccc(C3CCCC3)cc2)n1 ZINC000528618272 1045388813 /nfs/dbraw/zinc/38/88/13/1045388813.db2.gz SBGHGNHPFFHOHC-UHFFFAOYSA-N 1 2 323.440 4.157 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2c[nH]c(-c3ccccc3)n2)c2ccccc2O1 ZINC000449424632 1045391725 /nfs/dbraw/zinc/39/17/25/1045391725.db2.gz KUNKWEGFSYUQIZ-RDTXWAMCSA-N 1 2 319.408 4.079 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000449456532 1045395926 /nfs/dbraw/zinc/39/59/26/1045395926.db2.gz CZVMJWLKQAVGGP-GXTWGEPZSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000449456532 1045395933 /nfs/dbraw/zinc/39/59/33/1045395933.db2.gz CZVMJWLKQAVGGP-GXTWGEPZSA-N 1 2 323.362 4.240 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)cs1 ZINC000449462003 1045400079 /nfs/dbraw/zinc/40/00/79/1045400079.db2.gz RLSGRHRRIYPCBZ-QWRGUYRKSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)cs1 ZINC000449462003 1045400080 /nfs/dbraw/zinc/40/00/80/1045400080.db2.gz RLSGRHRRIYPCBZ-QWRGUYRKSA-N 1 2 306.397 4.429 20 0 DIADLO CCO[C@H]1CC[N@H+](Cc2cc(Cl)sc2Cl)C[C@@H]1C ZINC000449504523 1045404653 /nfs/dbraw/zinc/40/46/53/1045404653.db2.gz QLCACCOMJFOEDY-ONGXEEELSA-N 1 2 308.274 4.302 20 0 DIADLO CCO[C@H]1CC[N@@H+](Cc2cc(Cl)sc2Cl)C[C@@H]1C ZINC000449504523 1045404656 /nfs/dbraw/zinc/40/46/56/1045404656.db2.gz QLCACCOMJFOEDY-ONGXEEELSA-N 1 2 308.274 4.302 20 0 DIADLO c1csc(-c2nc(C[N@@H+]3CCSC[C@H]3C3CC3)cs2)c1 ZINC000449527808 1045408099 /nfs/dbraw/zinc/40/80/99/1045408099.db2.gz LCUQARFSEABCBD-ZDUSSCGKSA-N 1 2 322.524 4.199 20 0 DIADLO c1csc(-c2nc(C[N@H+]3CCSC[C@H]3C3CC3)cs2)c1 ZINC000449527808 1045408103 /nfs/dbraw/zinc/40/81/03/1045408103.db2.gz LCUQARFSEABCBD-ZDUSSCGKSA-N 1 2 322.524 4.199 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCC(F)(F)C[C@H]3C)co2)cc1 ZINC000528768710 1045411193 /nfs/dbraw/zinc/41/11/93/1045411193.db2.gz OFHIWVOVIBHKHN-CYBMUJFWSA-N 1 2 306.356 4.270 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCC(F)(F)C[C@H]3C)co2)cc1 ZINC000528768710 1045411196 /nfs/dbraw/zinc/41/11/96/1045411196.db2.gz OFHIWVOVIBHKHN-CYBMUJFWSA-N 1 2 306.356 4.270 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1csc(Cc2ccccc2)n1 ZINC000528765010 1045411322 /nfs/dbraw/zinc/41/13/22/1045411322.db2.gz FHNMPSRVKZPPBD-CYBMUJFWSA-N 1 2 322.424 4.354 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1csc(Cc2ccccc2)n1 ZINC000528765010 1045411326 /nfs/dbraw/zinc/41/13/26/1045411326.db2.gz FHNMPSRVKZPPBD-CYBMUJFWSA-N 1 2 322.424 4.354 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC(F)(F)C[C@@H]2C)cs1 ZINC000528765262 1045411573 /nfs/dbraw/zinc/41/15/73/1045411573.db2.gz ICBOEZRIZPFHPO-LBPRGKRZSA-N 1 2 302.434 4.351 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC(F)(F)C[C@@H]2C)cs1 ZINC000528765262 1045411576 /nfs/dbraw/zinc/41/15/76/1045411576.db2.gz ICBOEZRIZPFHPO-LBPRGKRZSA-N 1 2 302.434 4.351 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1csc(C2CCCC2)n1 ZINC000528766060 1045411816 /nfs/dbraw/zinc/41/18/16/1045411816.db2.gz JHFFPPASSLOUFT-NSHDSACASA-N 1 2 300.418 4.420 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1csc(C2CCCC2)n1 ZINC000528766060 1045411819 /nfs/dbraw/zinc/41/18/19/1045411819.db2.gz JHFFPPASSLOUFT-NSHDSACASA-N 1 2 300.418 4.420 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1c(Cl)oc2ccccc21 ZINC000449562317 1045414731 /nfs/dbraw/zinc/41/47/31/1045414731.db2.gz JEXLROVNAVQWNM-LLVKDONJSA-N 1 2 303.793 4.153 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2c(Cl)oc3ccccc32)c2nccn21 ZINC000449575929 1045415589 /nfs/dbraw/zinc/41/55/89/1045415589.db2.gz ZAOFMLUXZPCXIT-ZWNOBZJWSA-N 1 2 301.777 4.078 20 0 DIADLO c1coc([C@@H]2[N@H+](Cc3cnn(-c4ccccc4)c3)CC23CCC3)c1 ZINC000449629084 1045421780 /nfs/dbraw/zinc/42/17/80/1045421780.db2.gz DWDLXWUDHSKOPJ-IBGZPJMESA-N 1 2 319.408 4.193 20 0 DIADLO c1coc([C@@H]2[N@@H+](Cc3cnn(-c4ccccc4)c3)CC23CCC3)c1 ZINC000449629084 1045421781 /nfs/dbraw/zinc/42/17/81/1045421781.db2.gz DWDLXWUDHSKOPJ-IBGZPJMESA-N 1 2 319.408 4.193 20 0 DIADLO Cc1ccc(-c2n[nH]cc2C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)o1 ZINC000449630967 1045422269 /nfs/dbraw/zinc/42/22/69/1045422269.db2.gz JIFYZJSFZJJYSP-SFHVURJKSA-N 1 2 323.396 4.298 20 0 DIADLO Cc1ccc(-c2n[nH]cc2C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)o1 ZINC000449630967 1045422274 /nfs/dbraw/zinc/42/22/74/1045422274.db2.gz JIFYZJSFZJJYSP-SFHVURJKSA-N 1 2 323.396 4.298 20 0 DIADLO c1coc([C@@H]2[N@H+](Cc3ccc(N4CCCC4)nc3)CC23CCC3)c1 ZINC000449638061 1045424605 /nfs/dbraw/zinc/42/46/05/1045424605.db2.gz JDEWUCWIHPXNHB-IBGZPJMESA-N 1 2 323.440 4.002 20 0 DIADLO c1coc([C@@H]2[N@@H+](Cc3ccc(N4CCCC4)nc3)CC23CCC3)c1 ZINC000449638061 1045424607 /nfs/dbraw/zinc/42/46/07/1045424607.db2.gz JDEWUCWIHPXNHB-IBGZPJMESA-N 1 2 323.440 4.002 20 0 DIADLO Cc1cnc(C[NH+]2CC(c3cccc(C(F)(F)F)c3)C2)s1 ZINC000449664787 1045425653 /nfs/dbraw/zinc/42/56/53/1045425653.db2.gz BSCARHBSUWMFQK-UHFFFAOYSA-N 1 2 312.360 4.070 20 0 DIADLO Clc1cccc(Cl)c1CC[N@@H+]1CCC[C@H]1c1ncccn1 ZINC000639870015 1045428308 /nfs/dbraw/zinc/42/83/08/1045428308.db2.gz NYUKORDQGJNVIA-HNNXBMFYSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1cccc(Cl)c1CC[N@H+]1CCC[C@H]1c1ncccn1 ZINC000639870015 1045428310 /nfs/dbraw/zinc/42/83/10/1045428310.db2.gz NYUKORDQGJNVIA-HNNXBMFYSA-N 1 2 322.239 4.163 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)cc1O ZINC000449729857 1045430262 /nfs/dbraw/zinc/43/02/62/1045430262.db2.gz BWVNJZYRDXVWHA-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)cc1O ZINC000449729857 1045430266 /nfs/dbraw/zinc/43/02/66/1045430266.db2.gz BWVNJZYRDXVWHA-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)cn1 ZINC000449730703 1045430786 /nfs/dbraw/zinc/43/07/86/1045430786.db2.gz GGKHHEFGQVOXPI-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)cn1 ZINC000449730703 1045430789 /nfs/dbraw/zinc/43/07/89/1045430789.db2.gz GGKHHEFGQVOXPI-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CCc1ccc(C[NH2+][C@H](c2ccco2)c2ccc(OC)cc2)cn1 ZINC000449781257 1045437671 /nfs/dbraw/zinc/43/76/71/1045437671.db2.gz WQDUFHNYZNDJTD-FQEVSTJZSA-N 1 2 322.408 4.125 20 0 DIADLO CCO[C@@H](C)c1noc(C[NH2+][C@@H](CC)c2ccc(Cl)cc2)n1 ZINC000120416670 1045472791 /nfs/dbraw/zinc/47/27/91/1045472791.db2.gz IDFZWHYLCODXQA-FZMZJTMJSA-N 1 2 323.824 4.061 20 0 DIADLO CC[C@@H](C)[N@H+](Cc1nnc(C2CC2)s1)Cc1ccccc1 ZINC000450240936 1045477151 /nfs/dbraw/zinc/47/71/51/1045477151.db2.gz FJLMMMCXIISIPE-CYBMUJFWSA-N 1 2 301.459 4.216 20 0 DIADLO CC[C@@H](C)[N@@H+](Cc1nnc(C2CC2)s1)Cc1ccccc1 ZINC000450240936 1045477152 /nfs/dbraw/zinc/47/71/52/1045477152.db2.gz FJLMMMCXIISIPE-CYBMUJFWSA-N 1 2 301.459 4.216 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@@H+](C)Cc2nnc(C(C)C)s2)c1 ZINC000450299431 1045485005 /nfs/dbraw/zinc/48/50/05/1045485005.db2.gz PAIAPVKXFOHLCI-CQSZACIVSA-N 1 2 303.475 4.471 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2nnc(C(C)C)s2)c1 ZINC000450299431 1045485008 /nfs/dbraw/zinc/48/50/08/1045485008.db2.gz PAIAPVKXFOHLCI-CQSZACIVSA-N 1 2 303.475 4.471 20 0 DIADLO CC(C)Oc1cc(Cl)c(C[NH2+]Cc2ccno2)cc1Cl ZINC000529542666 1045492184 /nfs/dbraw/zinc/49/21/84/1045492184.db2.gz QTCBWMVECGVEKS-UHFFFAOYSA-N 1 2 315.200 4.058 20 0 DIADLO FC(F)(F)c1ccc2c(cc[nH+]c2N2CCO[C@H]3CCC[C@@H]32)c1 ZINC000450368706 1045497422 /nfs/dbraw/zinc/49/74/22/1045497422.db2.gz JHRHMJSGMKQPPA-GJZGRUSLSA-N 1 2 322.330 4.011 20 0 DIADLO FC(F)(F)c1sccc1C[N@H+](Cc1ccccn1)C1CC1 ZINC000529564995 1045497517 /nfs/dbraw/zinc/49/75/17/1045497517.db2.gz AUOMYYXYTMHLDM-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO FC(F)(F)c1sccc1C[N@@H+](Cc1ccccn1)C1CC1 ZINC000529564995 1045497521 /nfs/dbraw/zinc/49/75/21/1045497521.db2.gz AUOMYYXYTMHLDM-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO FC(F)(F)c1sccc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000529565435 1045497970 /nfs/dbraw/zinc/49/79/70/1045497970.db2.gz KORJUBIAHLGQFA-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1sccc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000529565435 1045497975 /nfs/dbraw/zinc/49/79/75/1045497975.db2.gz KORJUBIAHLGQFA-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2Cl)C[N@@H+]1CC1CC(F)(F)C1 ZINC000450387953 1045499504 /nfs/dbraw/zinc/49/95/04/1045499504.db2.gz HDLKJBPJBWFEPS-XHDPSFHLSA-N 1 2 315.791 4.147 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2Cl)C[N@H+]1CC1CC(F)(F)C1 ZINC000450387953 1045499506 /nfs/dbraw/zinc/49/95/06/1045499506.db2.gz HDLKJBPJBWFEPS-XHDPSFHLSA-N 1 2 315.791 4.147 20 0 DIADLO Cc1cccc(NC(=O)[C@@H](C)[N@H+](C)Cc2ccc(Cl)s2)c1 ZINC000016343324 1045502170 /nfs/dbraw/zinc/50/21/70/1045502170.db2.gz ASSMZZSURKIMII-GFCCVEGCSA-N 1 2 322.861 4.169 20 0 DIADLO Cc1cccc(NC(=O)[C@@H](C)[N@@H+](C)Cc2ccc(Cl)s2)c1 ZINC000016343324 1045502174 /nfs/dbraw/zinc/50/21/74/1045502174.db2.gz ASSMZZSURKIMII-GFCCVEGCSA-N 1 2 322.861 4.169 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nnc(C3CC3)s2)s1 ZINC000450414697 1045503547 /nfs/dbraw/zinc/50/35/47/1045503547.db2.gz ZGYLMGVGYZGMNP-LBPRGKRZSA-N 1 2 305.472 4.123 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nnc(C3CC3)s2)s1 ZINC000450414697 1045503553 /nfs/dbraw/zinc/50/35/53/1045503553.db2.gz ZGYLMGVGYZGMNP-LBPRGKRZSA-N 1 2 305.472 4.123 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccc(F)c2)s1 ZINC000450433664 1045504428 /nfs/dbraw/zinc/50/44/28/1045504428.db2.gz BKOAIHZYFUJQFQ-WFASDCNBSA-N 1 2 319.449 4.384 20 0 DIADLO CC(C)c1nnc(C[N@H+]2C[C@@H](C)C[C@H]2c2cccc(F)c2)s1 ZINC000450433664 1045504433 /nfs/dbraw/zinc/50/44/33/1045504433.db2.gz BKOAIHZYFUJQFQ-WFASDCNBSA-N 1 2 319.449 4.384 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2nnc(C3CC3)s2)C1 ZINC000450437188 1045504507 /nfs/dbraw/zinc/50/45/07/1045504507.db2.gz HXJDGTVBRPUVCG-IAQYHMDHSA-N 1 2 317.433 4.138 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2nnc(C3CC3)s2)C1 ZINC000450437188 1045504512 /nfs/dbraw/zinc/50/45/12/1045504512.db2.gz HXJDGTVBRPUVCG-IAQYHMDHSA-N 1 2 317.433 4.138 20 0 DIADLO CC(=O)c1cccc(C[N@H+]2C[C@@H](c3ccccc3C)OC[C@@H]2C)c1 ZINC000450435360 1045505032 /nfs/dbraw/zinc/50/50/32/1045505032.db2.gz HVBUVOUAOKDZAJ-KKSFZXQISA-N 1 2 323.436 4.160 20 0 DIADLO CC(=O)c1cccc(C[N@@H+]2C[C@@H](c3ccccc3C)OC[C@@H]2C)c1 ZINC000450435360 1045505038 /nfs/dbraw/zinc/50/50/38/1045505038.db2.gz HVBUVOUAOKDZAJ-KKSFZXQISA-N 1 2 323.436 4.160 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Nc1cccc(C2CCCCC2)c1 ZINC000529649415 1045507753 /nfs/dbraw/zinc/50/77/53/1045507753.db2.gz NGXNBTLJKSCUDX-UHFFFAOYSA-N 1 2 311.429 4.350 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CC[C@H](C)[C@H]2c2cccc(F)c2)s1 ZINC000450455927 1045508386 /nfs/dbraw/zinc/50/83/86/1045508386.db2.gz RONPFUHNEZDIJB-LRDDRELGSA-N 1 2 319.449 4.384 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CC[C@H](C)[C@H]2c2cccc(F)c2)s1 ZINC000450455927 1045508392 /nfs/dbraw/zinc/50/83/92/1045508392.db2.gz RONPFUHNEZDIJB-LRDDRELGSA-N 1 2 319.449 4.384 20 0 DIADLO CC[C@H]1CN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)CCCO1 ZINC000450499487 1045514908 /nfs/dbraw/zinc/51/49/08/1045514908.db2.gz KDJZGFSROISGQD-AWEZNQCLSA-N 1 2 324.346 4.259 20 0 DIADLO CC(C)C[C@H](c1nc(-c2cc3ccccc3o2)no1)n1cc[nH+]c1 ZINC001119684365 1045520533 /nfs/dbraw/zinc/52/05/33/1045520533.db2.gz USSKADGRNDOXQG-CQSZACIVSA-N 1 2 322.368 4.315 20 0 DIADLO CCOc1cccc2cc([C@H](C)[NH2+][C@H](C)c3ncccn3)oc21 ZINC001119732913 1045523118 /nfs/dbraw/zinc/52/31/18/1045523118.db2.gz RUPMMPQYZNSGKH-QWHCGFSZSA-N 1 2 311.385 4.033 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2cc(Cl)cc3ccccc32)n1 ZINC001119732521 1045523153 /nfs/dbraw/zinc/52/31/53/1045523153.db2.gz LSXVQVYQTIMBCV-JTQLQIEISA-N 1 2 301.777 4.035 20 0 DIADLO Cc1ncc(C[N@@H+]2CCC[C@H]2c2ccc(Br)cc2)o1 ZINC000628150563 1045530296 /nfs/dbraw/zinc/53/02/96/1045530296.db2.gz XXVREBZPLOOHOG-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ncc(C[N@H+]2CCC[C@H]2c2ccc(Br)cc2)o1 ZINC000628150563 1045530310 /nfs/dbraw/zinc/53/03/10/1045530310.db2.gz XXVREBZPLOOHOG-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO CCC[N@H+](CC)Cn1nc(-c2ccc(Cl)cc2)oc1=S ZINC000750603837 1045537664 /nfs/dbraw/zinc/53/76/64/1045537664.db2.gz QHXVROITXWAOHY-UHFFFAOYSA-N 1 2 311.838 4.215 20 0 DIADLO CCC[N@@H+](CC)Cn1nc(-c2ccc(Cl)cc2)oc1=S ZINC000750603837 1045537677 /nfs/dbraw/zinc/53/76/77/1045537677.db2.gz QHXVROITXWAOHY-UHFFFAOYSA-N 1 2 311.838 4.215 20 0 DIADLO Cc1[nH]c(CN2CCCC[C@H]2c2ccc(F)cc2F)[nH+]c1C ZINC000628190403 1045537895 /nfs/dbraw/zinc/53/78/95/1045537895.db2.gz FHBMRUSMDYBATH-INIZCTEOSA-N 1 2 305.372 4.032 20 0 DIADLO Cc1[nH]c(CN2CCCC[C@H]2c2cccc(Cl)c2)[nH+]c1C ZINC000628252654 1045555584 /nfs/dbraw/zinc/55/55/84/1045555584.db2.gz BTUMYBUWSBNJAX-INIZCTEOSA-N 1 2 303.837 4.407 20 0 DIADLO C[C@@H]([NH2+][C@@H](Cc1ccccc1)c1cccs1)c1csnn1 ZINC000450725585 1045556362 /nfs/dbraw/zinc/55/63/62/1045556362.db2.gz ITNCNQMOKWWRJK-OCCSQVGLSA-N 1 2 315.467 4.234 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccsc2C(F)(F)F)nc1 ZINC000628249574 1045556696 /nfs/dbraw/zinc/55/66/96/1045556696.db2.gz JARMFDXVQZGKRO-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccsc2C(F)(F)F)nc1 ZINC000628249574 1045556706 /nfs/dbraw/zinc/55/67/06/1045556706.db2.gz JARMFDXVQZGKRO-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC[C@H]2c2cccnc2)cs1 ZINC000628277246 1045562400 /nfs/dbraw/zinc/56/24/00/1045562400.db2.gz KSCBKXADCNXQMH-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC[C@H]2c2cccnc2)cs1 ZINC000628277246 1045562408 /nfs/dbraw/zinc/56/24/08/1045562408.db2.gz KSCBKXADCNXQMH-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cc(C[N@H+](Cc2cccnc2)C2CC2)cs1 ZINC000628281040 1045562888 /nfs/dbraw/zinc/56/28/88/1045562888.db2.gz WXCBXYATRHRDKV-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+](Cc2cccnc2)C2CC2)cs1 ZINC000628281040 1045562902 /nfs/dbraw/zinc/56/29/02/1045562902.db2.gz WXCBXYATRHRDKV-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO FC(F)(F)c1cc(C[N@H+](Cc2ccccn2)C2CC2)cs1 ZINC000628281015 1045563282 /nfs/dbraw/zinc/56/32/82/1045563282.db2.gz VSDIFNDOPAKIFH-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+](Cc2ccccn2)C2CC2)cs1 ZINC000628281015 1045563297 /nfs/dbraw/zinc/56/32/97/1045563297.db2.gz VSDIFNDOPAKIFH-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO Cc1[nH]c(CN2CC[C@@H](C(F)(F)F)c3ccccc32)[nH+]c1C ZINC000628294379 1045565470 /nfs/dbraw/zinc/56/54/70/1045565470.db2.gz PHTPUCZHZGFZBE-CYBMUJFWSA-N 1 2 309.335 4.083 20 0 DIADLO C[C@H](c1csnn1)[NH+]1CCC(c2ccc(Cl)cc2)CC1 ZINC000450778301 1045567708 /nfs/dbraw/zinc/56/77/08/1045567708.db2.gz ZGBLHMSKEFYAFB-LLVKDONJSA-N 1 2 307.850 4.132 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(Cl)c2)C[N@@H+]1CC1CC(F)(F)C1 ZINC000450813216 1045569029 /nfs/dbraw/zinc/56/90/29/1045569029.db2.gz VINUGPAOMPWNAR-ABAIWWIYSA-N 1 2 315.791 4.147 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(Cl)c2)C[N@H+]1CC1CC(F)(F)C1 ZINC000450813216 1045569038 /nfs/dbraw/zinc/56/90/38/1045569038.db2.gz VINUGPAOMPWNAR-ABAIWWIYSA-N 1 2 315.791 4.147 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2ccc(Cl)nc2Cl)CC1 ZINC000283258395 1045579435 /nfs/dbraw/zinc/57/94/35/1045579435.db2.gz VWEXMYANJDGIRP-UHFFFAOYSA-N 1 2 311.187 4.306 20 0 DIADLO FC(F)(F)C1CCC(Sc2[nH+]cnc3[nH]ccc32)CC1 ZINC000450870339 1045582951 /nfs/dbraw/zinc/58/29/51/1045582951.db2.gz LHBRETDUAKILAQ-UHFFFAOYSA-N 1 2 301.337 4.171 20 0 DIADLO Oc1cccc2c1CC[N@H+](Cc1cnc(C3CCCC3)s1)C2 ZINC000628463536 1045586795 /nfs/dbraw/zinc/58/67/95/1045586795.db2.gz KLDWJDQHPBLRME-UHFFFAOYSA-N 1 2 314.454 4.065 20 0 DIADLO Oc1cccc2c1CC[N@@H+](Cc1cnc(C3CCCC3)s1)C2 ZINC000628463536 1045586806 /nfs/dbraw/zinc/58/68/06/1045586806.db2.gz KLDWJDQHPBLRME-UHFFFAOYSA-N 1 2 314.454 4.065 20 0 DIADLO CC(C)CO[C@H]1CC[N@H+](Cc2cc(Cl)sc2Cl)C1 ZINC001168126218 1045598537 /nfs/dbraw/zinc/59/85/37/1045598537.db2.gz ORYLXLQECARVSC-NSHDSACASA-N 1 2 308.274 4.302 20 0 DIADLO CC(C)CO[C@H]1CC[N@@H+](Cc2cc(Cl)sc2Cl)C1 ZINC001168126218 1045598545 /nfs/dbraw/zinc/59/85/45/1045598545.db2.gz ORYLXLQECARVSC-NSHDSACASA-N 1 2 308.274 4.302 20 0 DIADLO Cc1ccc2[nH]c([C@H]3CCC[N@@H+]3Cc3ccc(C)nc3C)nc2c1 ZINC000451016707 1045610500 /nfs/dbraw/zinc/61/05/00/1045610500.db2.gz OKPXJDWZXLPWCA-LJQANCHMSA-N 1 2 320.440 4.220 20 0 DIADLO Cc1ccc2[nH]c([C@H]3CCC[N@H+]3Cc3ccc(C)nc3C)nc2c1 ZINC000451016707 1045610504 /nfs/dbraw/zinc/61/05/04/1045610504.db2.gz OKPXJDWZXLPWCA-LJQANCHMSA-N 1 2 320.440 4.220 20 0 DIADLO Cc1ccc2nc([C@H]3CCC[N@@H+]3Cc3ccc(C)nc3C)[nH]c2c1 ZINC000451016707 1045610507 /nfs/dbraw/zinc/61/05/07/1045610507.db2.gz OKPXJDWZXLPWCA-LJQANCHMSA-N 1 2 320.440 4.220 20 0 DIADLO Cc1ccc2nc([C@H]3CCC[N@H+]3Cc3ccc(C)nc3C)[nH]c2c1 ZINC000451016707 1045610514 /nfs/dbraw/zinc/61/05/14/1045610514.db2.gz OKPXJDWZXLPWCA-LJQANCHMSA-N 1 2 320.440 4.220 20 0 DIADLO CCOC(=O)C1CCC(SCc2ccc(C)[nH+]c2C)CC1 ZINC000451014699 1045611360 /nfs/dbraw/zinc/61/13/60/1045611360.db2.gz JVVFDLNRUMSZEE-UHFFFAOYSA-N 1 2 307.459 4.054 20 0 DIADLO CC(C)[N@H+](Cc1nnc(C2CC2)s1)[C@H](C)c1ccccc1 ZINC000451060214 1045619250 /nfs/dbraw/zinc/61/92/50/1045619250.db2.gz PDMBHUKXOVZNGL-CYBMUJFWSA-N 1 2 301.459 4.387 20 0 DIADLO CC(C)[N@@H+](Cc1nnc(C2CC2)s1)[C@H](C)c1ccccc1 ZINC000451060214 1045619252 /nfs/dbraw/zinc/61/92/52/1045619252.db2.gz PDMBHUKXOVZNGL-CYBMUJFWSA-N 1 2 301.459 4.387 20 0 DIADLO CCc1c2ccccc2oc1[C@H](C)[NH2+]Cc1nnc(C)s1 ZINC000391844448 1045621410 /nfs/dbraw/zinc/62/14/10/1045621410.db2.gz GPTBJGVSRRZKHN-JTQLQIEISA-N 1 2 301.415 4.006 20 0 DIADLO COc1cccc(OC)c1C[NH2+]Cc1cc(C2CC2)ccc1F ZINC000451183155 1045642468 /nfs/dbraw/zinc/64/24/68/1045642468.db2.gz JXSYUNDZFYBWED-UHFFFAOYSA-N 1 2 315.388 4.010 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccc(C(C)(C)C)cc3)ccn12 ZINC001124317009 1045650204 /nfs/dbraw/zinc/65/02/04/1045650204.db2.gz XANNVZZOKZBGJD-UHFFFAOYSA-N 1 2 307.397 4.193 20 0 DIADLO CC[N@@H+](c1ccc(Nc2nc([C@@H](C)OC)ns2)cc1)C(C)C ZINC000800844758 1045657488 /nfs/dbraw/zinc/65/74/88/1045657488.db2.gz KCUULSCJBTVVNR-GFCCVEGCSA-N 1 2 320.462 4.224 20 0 DIADLO CC[N@H+](c1ccc(Nc2nc([C@@H](C)OC)ns2)cc1)C(C)C ZINC000800844758 1045657489 /nfs/dbraw/zinc/65/74/89/1045657489.db2.gz KCUULSCJBTVVNR-GFCCVEGCSA-N 1 2 320.462 4.224 20 0 DIADLO CCCOc1ccc(CNc2ccc([NH2+]C)cc2)cc1OC ZINC000629388983 1045664304 /nfs/dbraw/zinc/66/43/04/1045664304.db2.gz HIXQLTDNBAXEBY-UHFFFAOYSA-N 1 2 300.402 4.138 20 0 DIADLO C[NH2+]c1ccc(NCc2c(C)nn(Cc3ccccc3)c2C)cc1 ZINC000629389774 1045665148 /nfs/dbraw/zinc/66/51/48/1045665148.db2.gz VOOIBYWGXBGLAM-UHFFFAOYSA-N 1 2 320.440 4.202 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2coc3ccccc23)cs1 ZINC000925234554 1045684377 /nfs/dbraw/zinc/68/43/77/1045684377.db2.gz ANILKMINSZUDMA-VXGBXAGGSA-N 1 2 316.426 4.448 20 0 DIADLO NC(=[NH+]OCCCCC(F)(F)F)c1cccc2ccccc21 ZINC000752772737 1045702387 /nfs/dbraw/zinc/70/23/87/1045702387.db2.gz JZGJAYUPWAGCIT-UHFFFAOYSA-N 1 2 310.319 4.419 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000191493155 1045716149 /nfs/dbraw/zinc/71/61/49/1045716149.db2.gz IZXJGTHESDNNLP-XHDPSFHLSA-N 1 2 320.795 4.163 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000191493155 1045716169 /nfs/dbraw/zinc/71/61/69/1045716169.db2.gz IZXJGTHESDNNLP-XHDPSFHLSA-N 1 2 320.795 4.163 20 0 DIADLO Cc1nc(N[C@H]2CCOc3c(Cl)c(Cl)ccc32)cc[nH+]1 ZINC000752972431 1045716808 /nfs/dbraw/zinc/71/68/08/1045716808.db2.gz BMYUVCRPJSTWNV-NSHDSACASA-N 1 2 310.184 4.028 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[S@](=O)C(C)(C)CC1 ZINC000451755441 1045722523 /nfs/dbraw/zinc/72/25/23/1045722523.db2.gz KLWFSSJHQGNRPI-QRWLVFNGSA-N 1 2 313.894 4.024 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[S@](=O)C(C)(C)CC1 ZINC000451755441 1045722538 /nfs/dbraw/zinc/72/25/38/1045722538.db2.gz KLWFSSJHQGNRPI-QRWLVFNGSA-N 1 2 313.894 4.024 20 0 DIADLO CC[C@@H]([NH2+]Cc1cscc1Br)c1nccs1 ZINC000304532527 1045725279 /nfs/dbraw/zinc/72/52/79/1045725279.db2.gz HCCZXNOHIUHTSV-SNVBAGLBSA-N 1 2 317.277 4.208 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@H+](C)Cc2ccsc2)c(Cl)c1 ZINC000629942766 1045725450 /nfs/dbraw/zinc/72/54/50/1045725450.db2.gz XFLKALFCAOJZTJ-GFCCVEGCSA-N 1 2 322.861 4.169 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@@H+](C)Cc2ccsc2)c(Cl)c1 ZINC000629942766 1045725460 /nfs/dbraw/zinc/72/54/60/1045725460.db2.gz XFLKALFCAOJZTJ-GFCCVEGCSA-N 1 2 322.861 4.169 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(Br)n2)[C@H]1c1ccccc1 ZINC000779436140 1045727685 /nfs/dbraw/zinc/72/76/85/1045727685.db2.gz BXYQDDLVAXZQAU-BLLLJJGKSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(Br)n2)[C@H]1c1ccccc1 ZINC000779436140 1045727697 /nfs/dbraw/zinc/72/76/97/1045727697.db2.gz BXYQDDLVAXZQAU-BLLLJJGKSA-N 1 2 317.230 4.037 20 0 DIADLO FC(F)[C@@H]1C[N@H+](Cc2ccc3oc4ccccc4c3c2)CCO1 ZINC000801562508 1045742541 /nfs/dbraw/zinc/74/25/41/1045742541.db2.gz AMRLOPSOWRPWSA-KRWDZBQOSA-N 1 2 317.335 4.052 20 0 DIADLO FC(F)[C@@H]1C[N@@H+](Cc2ccc3oc4ccccc4c3c2)CCO1 ZINC000801562508 1045742553 /nfs/dbraw/zinc/74/25/53/1045742553.db2.gz AMRLOPSOWRPWSA-KRWDZBQOSA-N 1 2 317.335 4.052 20 0 DIADLO CCn1c2cccc(F)c2nc1/C(Cl)=C\c1[nH]c(C)c(C)[nH+]1 ZINC000901472594 1045742959 /nfs/dbraw/zinc/74/29/59/1045742959.db2.gz MQSMFCMQJNKPCS-DHZHZOJOSA-N 1 2 318.783 4.272 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)/C=C3/CC[C@H](C)C3)c2)[nH+]c1C ZINC000753590801 1045769285 /nfs/dbraw/zinc/76/92/85/1045769285.db2.gz DSUACHZVWKXUAO-GQVHDAKQSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C=C3CC[C@H](C)C3)c2)[nH+]c1C ZINC000753590801 1045769301 /nfs/dbraw/zinc/76/93/01/1045769301.db2.gz DSUACHZVWKXUAO-GQVHDAKQSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)/C=C3\CC[C@@H](C)C3)c2)[nH+]c1C ZINC000753590803 1045770514 /nfs/dbraw/zinc/77/05/14/1045770514.db2.gz DSUACHZVWKXUAO-JXCQQFQQSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C=C3CC[C@@H](C)C3)c2)[nH+]c1C ZINC000753590803 1045770525 /nfs/dbraw/zinc/77/05/25/1045770525.db2.gz DSUACHZVWKXUAO-JXCQQFQQSA-N 1 2 309.413 4.378 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@@H](C)c2cccc(C)c2)n1 ZINC000452088423 1045772293 /nfs/dbraw/zinc/77/22/93/1045772293.db2.gz OXDMNHSJHUNGIT-STQMWFEESA-N 1 2 305.447 4.043 20 0 DIADLO COc1ccc(Cl)c(C[N@H+](C)Cc2ccc(Cl)nc2)c1 ZINC000192057561 1045777747 /nfs/dbraw/zinc/77/77/47/1045777747.db2.gz COQAXTDVYMSBJC-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+](C)Cc2ccc(Cl)nc2)c1 ZINC000192057561 1045777758 /nfs/dbraw/zinc/77/77/58/1045777758.db2.gz COQAXTDVYMSBJC-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Fc1cccc(C[NH2+]Cc2cc(C(F)(F)F)ccc2Cl)n1 ZINC000753850907 1045809142 /nfs/dbraw/zinc/80/91/42/1045809142.db2.gz PZRADWUHGZAYPT-UHFFFAOYSA-N 1 2 318.701 4.183 20 0 DIADLO Cc1noc(C2CCC(Nc3cc4ccccc4c[nH+]3)CC2)n1 ZINC000631155561 1045823557 /nfs/dbraw/zinc/82/35/57/1045823557.db2.gz FUAFLIILDMTZAE-UHFFFAOYSA-N 1 2 308.385 4.065 20 0 DIADLO C[C@@H](C[NH2+]c1ccc(N2CCOC[C@@H]2C)cc1)Cc1ccccc1 ZINC000753969400 1045825998 /nfs/dbraw/zinc/82/59/98/1045825998.db2.gz SOEUGWZQTKVCTH-MSOLQXFVSA-N 1 2 324.468 4.202 20 0 DIADLO COc1cc([C@@H](C)[NH2+]Cc2ccc(C)cc2OC(C)(C)C)on1 ZINC000925244795 1045838379 /nfs/dbraw/zinc/83/83/79/1045838379.db2.gz YLKIAKDDKLZYIM-CYBMUJFWSA-N 1 2 318.417 4.020 20 0 DIADLO O[C@]1(CNc2cc3ccccc3c[nH+]2)CCC[C@H](C(F)(F)F)C1 ZINC000631232812 1045840256 /nfs/dbraw/zinc/84/02/56/1045840256.db2.gz IBCXYVOHSOJQJK-GOEBONIOSA-N 1 2 324.346 4.130 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2csc(-c3ccsc3)n2)s1 ZINC000631223747 1045840306 /nfs/dbraw/zinc/84/03/06/1045840306.db2.gz GDODWRQGXLBNMO-VIFPVBQESA-N 1 2 321.496 4.487 20 0 DIADLO CCOc1ccc(C[NH2+][C@H](CF)c2ccc(F)cc2)cc1F ZINC000631283060 1045845948 /nfs/dbraw/zinc/84/59/48/1045845948.db2.gz GUJYELFGVNMHJO-MRXNPFEDSA-N 1 2 309.331 4.164 20 0 DIADLO C[N@@H+](Cc1csc(Br)n1)[C@H]1CCc2ccccc21 ZINC001137586832 1045899170 /nfs/dbraw/zinc/89/91/70/1045899170.db2.gz GBANXEJWQWRKIK-ZDUSSCGKSA-N 1 2 323.259 4.025 20 0 DIADLO c1csc([C@H]([NH2+][C@H]2CCCc3ncccc32)c2ccccc2)n1 ZINC000631577616 1045873281 /nfs/dbraw/zinc/87/32/81/1045873281.db2.gz RHGFRXHRARDWHK-ZWKOTPCHSA-N 1 2 321.449 4.295 20 0 DIADLO CC1=CC[C@@](C)(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)CC1 ZINC001125233394 1045879420 /nfs/dbraw/zinc/87/94/20/1045879420.db2.gz RYDJZYUDMATTGC-GOSISDBHSA-N 1 2 313.376 4.086 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)cc1 ZINC000531687486 1045892733 /nfs/dbraw/zinc/89/27/33/1045892733.db2.gz AWHAWVIFDBQSHV-OXJNMPFZSA-N 1 2 319.452 4.423 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)c1 ZINC000531688394 1045892842 /nfs/dbraw/zinc/89/28/42/1045892842.db2.gz SDFNEMVRJITFPK-LPHOPBHVSA-N 1 2 305.425 4.169 20 0 DIADLO Cc1cccc([C@H](C)C(=O)OCc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000754499713 1045895109 /nfs/dbraw/zinc/89/51/09/1045895109.db2.gz PONVFRIWCONEAC-INIZCTEOSA-N 1 2 320.392 4.028 20 0 DIADLO C[N@H+](Cc1csc(Br)n1)[C@H]1CCc2ccccc21 ZINC001137586832 1045899149 /nfs/dbraw/zinc/89/91/49/1045899149.db2.gz GBANXEJWQWRKIK-ZDUSSCGKSA-N 1 2 323.259 4.025 20 0 DIADLO Clc1ncc(C[NH+]2CCC(OC3CCCCC3)CC2)s1 ZINC000079318479 1045904588 /nfs/dbraw/zinc/90/45/88/1045904588.db2.gz YBNFFJASCUYVSQ-UHFFFAOYSA-N 1 2 314.882 4.110 20 0 DIADLO Cc1[nH]c(CNc2ncccc2O[C@H](C)c2ccccc2)[nH+]c1C ZINC000902066715 1045905105 /nfs/dbraw/zinc/90/51/05/1045905105.db2.gz RRAAFMSSOWNTJR-OAHLLOKOSA-N 1 2 322.412 4.174 20 0 DIADLO FC(F)C1CC[NH+](Cc2csc(-c3cccs3)n2)CC1 ZINC000531726042 1045906634 /nfs/dbraw/zinc/90/66/34/1045906634.db2.gz ICFXAXBBAZXDPK-UHFFFAOYSA-N 1 2 314.426 4.349 20 0 DIADLO C[N@H+](Cc1nc(-c2ccccc2)c[nH]1)C[C@]1(C)CC1(Cl)Cl ZINC000828392313 1045906651 /nfs/dbraw/zinc/90/66/51/1045906651.db2.gz SLZXVLWGPQQAOK-HNNXBMFYSA-N 1 2 324.255 4.092 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccccc2)c[nH]1)C[C@]1(C)CC1(Cl)Cl ZINC000828392313 1045906657 /nfs/dbraw/zinc/90/66/57/1045906657.db2.gz SLZXVLWGPQQAOK-HNNXBMFYSA-N 1 2 324.255 4.092 20 0 DIADLO Fc1cccc(C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)c1F ZINC000631725896 1045909900 /nfs/dbraw/zinc/90/99/00/1045909900.db2.gz KMMGHBOSGBNYCO-MRXNPFEDSA-N 1 2 305.372 4.099 20 0 DIADLO Clc1ccc(Br)cc1C[N@@H+]1CCC[C@H]2C[C@H]21 ZINC001137830434 1045977624 /nfs/dbraw/zinc/97/76/24/1045977624.db2.gz BYWUAZLDHDJWKN-TVQRCGJNSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1ccc(Br)cc1C[N@H+]1CCC[C@H]2C[C@H]21 ZINC001137830434 1045977635 /nfs/dbraw/zinc/97/76/35/1045977635.db2.gz BYWUAZLDHDJWKN-TVQRCGJNSA-N 1 2 300.627 4.087 20 0 DIADLO C[C@@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1ccccc1N(C)C ZINC000631797464 1045919344 /nfs/dbraw/zinc/91/93/44/1045919344.db2.gz BAABWIZPPNAUPR-DYVFJYSZSA-N 1 2 304.384 4.253 20 0 DIADLO C[C@@H]1C[C@H]([NH2+][C@H](CC(F)(F)F)c2ccccc2)c2nccn21 ZINC000453057129 1045919750 /nfs/dbraw/zinc/91/97/50/1045919750.db2.gz GZCMMKLEXUMNSU-KWCYVHTRSA-N 1 2 309.335 4.172 20 0 DIADLO C[C@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1ccccc1N(C)C ZINC000631797465 1045919762 /nfs/dbraw/zinc/91/97/62/1045919762.db2.gz BAABWIZPPNAUPR-GUYCJALGSA-N 1 2 304.384 4.253 20 0 DIADLO Cc1c([C@@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)cnn1C(C)(C)C ZINC000631797919 1045920337 /nfs/dbraw/zinc/92/03/37/1045920337.db2.gz JYLXSAOESIVDOB-PXAZEXFGSA-N 1 2 321.415 4.447 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)cc1OC ZINC000631795313 1045920713 /nfs/dbraw/zinc/92/07/13/1045920713.db2.gz HZTZHNTZZNYLTO-BLLLJJGKSA-N 1 2 321.367 4.204 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1csc2ccccc12 ZINC000754738566 1045923519 /nfs/dbraw/zinc/92/35/19/1045923519.db2.gz NMOVPBIKJFYTGV-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO C[C@H]([NH2+]Cc1csc(Cl)n1)c1cccc(OC(F)F)c1 ZINC000828639399 1045926059 /nfs/dbraw/zinc/92/60/59/1045926059.db2.gz WEKCTHXPWNWDOM-QMMMGPOBSA-N 1 2 318.776 4.249 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1c[nH]c3ccc(Cl)cc13)C2 ZINC001137712457 1045942810 /nfs/dbraw/zinc/94/28/10/1045942810.db2.gz DILKQOOVYXECKC-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1c[nH]c3ccc(Cl)cc13)C2 ZINC001137712457 1045942830 /nfs/dbraw/zinc/94/28/30/1045942830.db2.gz DILKQOOVYXECKC-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)c(OC)c1 ZINC000192900076 1045952406 /nfs/dbraw/zinc/95/24/06/1045952406.db2.gz VMQCEKUUZDUGFH-CQSZACIVSA-N 1 2 323.396 4.063 20 0 DIADLO Clc1cc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)cc(Cl)n1 ZINC000829086805 1045954769 /nfs/dbraw/zinc/95/47/69/1045954769.db2.gz OBTAWKNGDPLLRC-AWEZNQCLSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cc(C[N@H+]2CC[C@H](Oc3ccccc3)C2)cc(Cl)n1 ZINC000829086805 1045954780 /nfs/dbraw/zinc/95/47/80/1045954780.db2.gz OBTAWKNGDPLLRC-AWEZNQCLSA-N 1 2 323.223 4.042 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CCCC[C@H]1c1ccccc1F ZINC001137749083 1045956773 /nfs/dbraw/zinc/95/67/73/1045956773.db2.gz CMIRTBGQRZMHPJ-INIZCTEOSA-N 1 2 321.827 4.248 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CCCC[C@H]1c1ccccc1F ZINC001137749083 1045956781 /nfs/dbraw/zinc/95/67/81/1045956781.db2.gz CMIRTBGQRZMHPJ-INIZCTEOSA-N 1 2 321.827 4.248 20 0 DIADLO OCCCCCCC[N@@H+]1CCn2c(cc3cc(Cl)ccc32)C1 ZINC000755192960 1045963230 /nfs/dbraw/zinc/96/32/30/1045963230.db2.gz AJGFAJRLACLZOM-UHFFFAOYSA-N 1 2 320.864 4.053 20 0 DIADLO OCCCCCCC[N@H+]1CCn2c(cc3cc(Cl)ccc32)C1 ZINC000755192960 1045963244 /nfs/dbraw/zinc/96/32/44/1045963244.db2.gz AJGFAJRLACLZOM-UHFFFAOYSA-N 1 2 320.864 4.053 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1cccc(-c3cncnc3)c1)C2 ZINC001137771580 1045964350 /nfs/dbraw/zinc/96/43/50/1045964350.db2.gz KUDGDCQFIZNDNU-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1cccc(-c3cncnc3)c1)C2 ZINC001137771580 1045964354 /nfs/dbraw/zinc/96/43/54/1045964354.db2.gz KUDGDCQFIZNDNU-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO COCC1CCC(Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CC1 ZINC000453191005 1045972965 /nfs/dbraw/zinc/97/29/65/1045972965.db2.gz XFRJBOUEYLNVGD-UHFFFAOYSA-N 1 2 319.836 4.143 20 0 DIADLO CCn1c2cc(F)ccc2nc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC000779712161 1045994024 /nfs/dbraw/zinc/99/40/24/1045994024.db2.gz CNUKAWQMPFMMFZ-UHFFFAOYSA-N 1 2 306.344 4.048 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(F)c(F)cc1F ZINC001137891563 1045999263 /nfs/dbraw/zinc/99/92/63/1045999263.db2.gz ZRPWINDIKPYELH-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1cc(F)c(F)cc1F ZINC001137891563 1045999267 /nfs/dbraw/zinc/99/92/67/1045999267.db2.gz ZRPWINDIKPYELH-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO CCn1c(-c2cccs2)nn(C[N@H+](CC)CC(C)C)c1=S ZINC000193396198 1046005010 /nfs/dbraw/zinc/00/50/10/1046005010.db2.gz YIOUERRAZRVVSK-UHFFFAOYSA-N 1 2 324.519 4.098 20 0 DIADLO CCn1c(-c2cccs2)nn(C[N@@H+](CC)CC(C)C)c1=S ZINC000193396198 1046005026 /nfs/dbraw/zinc/00/50/26/1046005026.db2.gz YIOUERRAZRVVSK-UHFFFAOYSA-N 1 2 324.519 4.098 20 0 DIADLO CC[C@@H]([NH2+]Cc1csc(N)n1)c1ccc(Cl)cc1Cl ZINC000902489962 1046006485 /nfs/dbraw/zinc/00/64/85/1046006485.db2.gz SYWUWOZKTMVRRB-GFCCVEGCSA-N 1 2 316.257 4.273 20 0 DIADLO Cc1ccc2[nH]c([C@@H]3CCC[N@@H+]3C[C@H]3CC3(Cl)Cl)nc2c1 ZINC000829859430 1046021121 /nfs/dbraw/zinc/02/11/21/1046021121.db2.gz RBBSUWXSIGJBTR-RISCZKNCSA-N 1 2 324.255 4.202 20 0 DIADLO Cc1ccc2[nH]c([C@@H]3CCC[N@H+]3C[C@H]3CC3(Cl)Cl)nc2c1 ZINC000829859430 1046021134 /nfs/dbraw/zinc/02/11/34/1046021134.db2.gz RBBSUWXSIGJBTR-RISCZKNCSA-N 1 2 324.255 4.202 20 0 DIADLO Cc1ccc2nc([C@@H]3CCC[N@@H+]3C[C@H]3CC3(Cl)Cl)[nH]c2c1 ZINC000829859430 1046021148 /nfs/dbraw/zinc/02/11/48/1046021148.db2.gz RBBSUWXSIGJBTR-RISCZKNCSA-N 1 2 324.255 4.202 20 0 DIADLO Cc1ccc2nc([C@@H]3CCC[N@H+]3C[C@H]3CC3(Cl)Cl)[nH]c2c1 ZINC000829859430 1046021158 /nfs/dbraw/zinc/02/11/58/1046021158.db2.gz RBBSUWXSIGJBTR-RISCZKNCSA-N 1 2 324.255 4.202 20 0 DIADLO C[N@H+](Cc1cccc2cccnc21)Cc1c(F)ccc(F)c1F ZINC001137930182 1046023939 /nfs/dbraw/zinc/02/39/39/1046023939.db2.gz FTJKTLZYSPWMEB-UHFFFAOYSA-N 1 2 316.326 4.284 20 0 DIADLO C[N@@H+](Cc1cccc2cccnc21)Cc1c(F)ccc(F)c1F ZINC001137930182 1046023953 /nfs/dbraw/zinc/02/39/53/1046023953.db2.gz FTJKTLZYSPWMEB-UHFFFAOYSA-N 1 2 316.326 4.284 20 0 DIADLO Cc1ccc(OC(F)F)c([C@H](C)[NH2+][C@H]2C[C@@H](C)n3ccnc32)c1 ZINC000453332504 1046025426 /nfs/dbraw/zinc/02/54/26/1046025426.db2.gz AURFMUJBLPFTJM-DYEKYZERSA-N 1 2 321.371 4.150 20 0 DIADLO CC[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1cccc(Cl)c1F ZINC000453332483 1046026102 /nfs/dbraw/zinc/02/61/02/1046026102.db2.gz AQUFIGRBNIUNOL-SWHYSGLUSA-N 1 2 307.800 4.422 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc(F)c(F)c1F)CCC2 ZINC001137941514 1046028017 /nfs/dbraw/zinc/02/80/17/1046028017.db2.gz UJQFYSIZCURTNP-UHFFFAOYSA-N 1 2 321.342 4.061 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc(F)c(F)c1F)CCC2 ZINC001137941514 1046028030 /nfs/dbraw/zinc/02/80/30/1046028030.db2.gz UJQFYSIZCURTNP-UHFFFAOYSA-N 1 2 321.342 4.061 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)cc(Cl)n1 ZINC000802656190 1046028074 /nfs/dbraw/zinc/02/80/74/1046028074.db2.gz GQKADVRLWIDPHK-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@](F)(c3ccccc3)C2)cc(Cl)n1 ZINC000802656190 1046028088 /nfs/dbraw/zinc/02/80/88/1046028088.db2.gz GQKADVRLWIDPHK-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)nc1 ZINC000755945706 1046030861 /nfs/dbraw/zinc/03/08/61/1046030861.db2.gz SEJFWFRXLJNITL-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)nc1 ZINC000755945706 1046030870 /nfs/dbraw/zinc/03/08/70/1046030870.db2.gz SEJFWFRXLJNITL-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO CC(C)Cc1cccc([C@@H](C)[NH2+]Cc2nn(C)cc2Cl)c1 ZINC000453319005 1046035238 /nfs/dbraw/zinc/03/52/38/1046035238.db2.gz MUZQOWUNFCSGAQ-CYBMUJFWSA-N 1 2 305.853 4.123 20 0 DIADLO Clc1nc2ccccc2cc1C[N@@H+]1CCC[C@H]1c1cnccn1 ZINC001137977378 1046042801 /nfs/dbraw/zinc/04/28/01/1046042801.db2.gz LZMMJBMMIFXKEV-KRWDZBQOSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1nc2ccccc2cc1C[N@H+]1CCC[C@H]1c1cnccn1 ZINC001137977378 1046042818 /nfs/dbraw/zinc/04/28/18/1046042818.db2.gz LZMMJBMMIFXKEV-KRWDZBQOSA-N 1 2 324.815 4.015 20 0 DIADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1ccc(-c2ccccc2)o1 ZINC000453339320 1046043314 /nfs/dbraw/zinc/04/33/14/1046043314.db2.gz GLHFPMIJFPYUAZ-OFQRWUPVSA-N 1 2 307.397 4.500 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1 ZINC001137997498 1046048426 /nfs/dbraw/zinc/04/84/26/1046048426.db2.gz MFJFMQOBLALZNS-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1 ZINC001137997498 1046048440 /nfs/dbraw/zinc/04/84/40/1046048440.db2.gz MFJFMQOBLALZNS-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO CCCn1cc([C@@H](C)[NH2+]C(c2ccccc2)c2ccccc2)nn1 ZINC000902720705 1046048830 /nfs/dbraw/zinc/04/88/30/1046048830.db2.gz MXBFZVRDWZHNTG-MRXNPFEDSA-N 1 2 320.440 4.128 20 0 DIADLO C[N@H+](Cc1cccc(O)c1)Cc1cccc(C(F)(F)F)c1F ZINC001138006915 1046053259 /nfs/dbraw/zinc/05/32/59/1046053259.db2.gz NKLMCKATNPZFMV-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO C[N@@H+](Cc1cccc(O)c1)Cc1cccc(C(F)(F)F)c1F ZINC001138006915 1046053275 /nfs/dbraw/zinc/05/32/75/1046053275.db2.gz NKLMCKATNPZFMV-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO Fc1c(C[N@H+]2CCC[C@H](C(F)F)C2)cccc1C(F)(F)F ZINC001138011481 1046055483 /nfs/dbraw/zinc/05/54/83/1046055483.db2.gz VUWQNHKLKQUFQN-JTQLQIEISA-N 1 2 311.269 4.322 20 0 DIADLO Fc1c(C[N@@H+]2CCC[C@H](C(F)F)C2)cccc1C(F)(F)F ZINC001138011481 1046055496 /nfs/dbraw/zinc/05/54/96/1046055496.db2.gz VUWQNHKLKQUFQN-JTQLQIEISA-N 1 2 311.269 4.322 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1OC(F)F ZINC000453358784 1046057438 /nfs/dbraw/zinc/05/74/38/1046057438.db2.gz QANIXZMVDCRWMZ-STQMWFEESA-N 1 2 323.387 4.225 20 0 DIADLO Cc1ccc(Cl)c(C[N@@H+]2CCc3cc(O)ccc3C2)c1F ZINC001138031678 1046064797 /nfs/dbraw/zinc/06/47/97/1046064797.db2.gz BYTVCFXMLCMCQS-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Cc1ccc(Cl)c(C[N@H+]2CCc3cc(O)ccc3C2)c1F ZINC001138031678 1046064812 /nfs/dbraw/zinc/06/48/12/1046064812.db2.gz BYTVCFXMLCMCQS-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO CCCn1cc([C@H](C)[NH2+][C@@H](C)c2oc3ccccc3c2C)nn1 ZINC000902765628 1046065168 /nfs/dbraw/zinc/06/51/68/1046065168.db2.gz REUVPLNSHFPTGD-KBPBESRZSA-N 1 2 312.417 4.155 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)cn2)n1 ZINC000902789809 1046070341 /nfs/dbraw/zinc/07/03/41/1046070341.db2.gz NKNLDNKTXMWTKF-VHSXEESVSA-N 1 2 315.364 4.277 20 0 DIADLO COc1cccnc1C[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000453374652 1046070713 /nfs/dbraw/zinc/07/07/13/1046070713.db2.gz SMDMOHWZQAFKBX-JTQLQIEISA-N 1 2 311.212 4.248 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+][C@@H]1C[C@@H](C)n2ccnc21 ZINC000453378648 1046074062 /nfs/dbraw/zinc/07/40/62/1046074062.db2.gz ZIIMFHDYXNXHOU-TYNCELHUSA-N 1 2 319.836 4.292 20 0 DIADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1cnc(CC)o1 ZINC000453378575 1046074173 /nfs/dbraw/zinc/07/41/73/1046074173.db2.gz KHKIYKNCWMFWMB-LLVKDONJSA-N 1 2 308.809 4.140 20 0 DIADLO CCC[C@H]([NH2+][C@@H](C)c1cn(CCC)nn1)c1ccc(F)cc1F ZINC000902841252 1046082594 /nfs/dbraw/zinc/08/25/94/1046082594.db2.gz NIMKUHFUFLPOCP-LRDDRELGSA-N 1 2 322.403 4.158 20 0 DIADLO CCC[C@@H]([NH2+][C@@H](C)c1cn(CCC)nn1)c1ccc(F)cc1F ZINC000902841251 1046082822 /nfs/dbraw/zinc/08/28/22/1046082822.db2.gz NIMKUHFUFLPOCP-BLLLJJGKSA-N 1 2 322.403 4.158 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3ccccc3c(Cl)n2)CC2(CCC2)O1 ZINC000830734202 1046093437 /nfs/dbraw/zinc/09/34/37/1046093437.db2.gz HYLAEUQNNZUWHH-ZDUSSCGKSA-N 1 2 316.832 4.032 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3ccccc3c(Cl)n2)CC2(CCC2)O1 ZINC000830734202 1046093453 /nfs/dbraw/zinc/09/34/53/1046093453.db2.gz HYLAEUQNNZUWHH-ZDUSSCGKSA-N 1 2 316.832 4.032 20 0 DIADLO CCC1C[NH+](Cc2csc(COc3ccc(Cl)cc3)n2)C1 ZINC000453609300 1046097349 /nfs/dbraw/zinc/09/73/49/1046097349.db2.gz VSZCZAUDYLELMM-UHFFFAOYSA-N 1 2 322.861 4.217 20 0 DIADLO Cc1csc(SCc2ccc(-n3cc[nH+]c3)cc2C)n1 ZINC000756659613 1046117401 /nfs/dbraw/zinc/11/74/01/1046117401.db2.gz SHTSHPRANITFTI-UHFFFAOYSA-N 1 2 301.440 4.238 20 0 DIADLO Fc1cc(F)c(F)c(C[N@@H+]2CCC[C@H](c3ccccn3)C2)c1F ZINC001138236352 1046125763 /nfs/dbraw/zinc/12/57/63/1046125763.db2.gz WKGACSQHVJWIKI-NSHDSACASA-N 1 2 324.321 4.018 20 0 DIADLO Fc1cc(F)c(F)c(C[N@H+]2CCC[C@H](c3ccccn3)C2)c1F ZINC001138236352 1046125772 /nfs/dbraw/zinc/12/57/72/1046125772.db2.gz WKGACSQHVJWIKI-NSHDSACASA-N 1 2 324.321 4.018 20 0 DIADLO Clc1cc2c(cc1C[N@@H+]1CC[C@@H]1c1ccccc1)OCO2 ZINC001138245202 1046127954 /nfs/dbraw/zinc/12/79/54/1046127954.db2.gz UMWWRMQFXGGGDB-OAHLLOKOSA-N 1 2 301.773 4.016 20 0 DIADLO Clc1cc2c(cc1C[N@H+]1CC[C@@H]1c1ccccc1)OCO2 ZINC001138245202 1046127964 /nfs/dbraw/zinc/12/79/64/1046127964.db2.gz UMWWRMQFXGGGDB-OAHLLOKOSA-N 1 2 301.773 4.016 20 0 DIADLO C[C@@H](Nc1cnn([C@H](C)C2CC2)c1)c1cccc(-n2cc[nH+]c2)c1 ZINC000902962581 1046130735 /nfs/dbraw/zinc/13/07/35/1046130735.db2.gz HJRODWGMVPLESE-HUUCEWRRSA-N 1 2 321.428 4.213 20 0 DIADLO O=C(Nc1cc(Cl)c(F)c(Cl)c1)c1cccc2[nH+]ccn21 ZINC000756783687 1046134006 /nfs/dbraw/zinc/13/40/06/1046134006.db2.gz NIMDDUFKYWIYPW-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CCC[C@H](C(F)F)C2)c(Cl)c1 ZINC001142293739 1046146893 /nfs/dbraw/zinc/14/68/93/1046146893.db2.gz ZKPUCBVLRCQUOZ-VIFPVBQESA-N 1 2 324.198 4.479 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CCC[C@H](C(F)F)C2)c(Cl)c1 ZINC001142293739 1046146897 /nfs/dbraw/zinc/14/68/97/1046146897.db2.gz ZKPUCBVLRCQUOZ-VIFPVBQESA-N 1 2 324.198 4.479 20 0 DIADLO CC(C)OC(=O)[C@@H](C)[N@H+](C)Cc1ccc(-c2cccs2)cc1 ZINC001168145726 1046149306 /nfs/dbraw/zinc/14/93/06/1046149306.db2.gz ORKYRTPYKNMGIB-CQSZACIVSA-N 1 2 317.454 4.187 20 0 DIADLO CC(C)OC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(-c2cccs2)cc1 ZINC001168145726 1046149309 /nfs/dbraw/zinc/14/93/09/1046149309.db2.gz ORKYRTPYKNMGIB-CQSZACIVSA-N 1 2 317.454 4.187 20 0 DIADLO CC(C)[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2)o1)c1nncn1C ZINC000903062355 1046153293 /nfs/dbraw/zinc/15/32/93/1046153293.db2.gz ULPAMIDQFAVQDS-KBXCAEBGSA-N 1 2 324.428 4.123 20 0 DIADLO COc1ccc2c(c1Cl)[C@@H]([NH2+]Cc1nc(C)cs1)CCC2 ZINC000903067206 1046154552 /nfs/dbraw/zinc/15/45/52/1046154552.db2.gz OHRCOGJLZIGSFA-LBPRGKRZSA-N 1 2 322.861 4.281 20 0 DIADLO COc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001138375256 1046159298 /nfs/dbraw/zinc/15/92/98/1046159298.db2.gz BDUHRQHNISQFIH-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)cc1C[N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001138375256 1046159304 /nfs/dbraw/zinc/15/93/04/1046159304.db2.gz BDUHRQHNISQFIH-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO CCn1c[nH+]cc1CNc1ccccc1SCC(F)(F)F ZINC000090170738 1046160423 /nfs/dbraw/zinc/16/04/23/1046160423.db2.gz WKYODEAUKWFTKJ-UHFFFAOYSA-N 1 2 315.364 4.170 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(Cl)c(C(F)(F)F)c1 ZINC000090170144 1046161488 /nfs/dbraw/zinc/16/14/88/1046161488.db2.gz MMPUYJLAFYGUDH-UHFFFAOYSA-N 1 2 303.715 4.187 20 0 DIADLO COc1cccc(F)c1C[N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001138388172 1046162563 /nfs/dbraw/zinc/16/25/63/1046162563.db2.gz RKELNPGKANZTDO-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(F)c1C[N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001138388172 1046162572 /nfs/dbraw/zinc/16/25/72/1046162572.db2.gz RKELNPGKANZTDO-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)s2)s1 ZINC000717963504 1046163575 /nfs/dbraw/zinc/16/35/75/1046163575.db2.gz UOQGPYMMACIIMB-BQBZGAKWSA-N 1 2 321.393 4.339 20 0 DIADLO COc1ccc2c(c1Cl)[C@H]([NH2+]Cc1ncc(C)s1)CCC2 ZINC000903102730 1046164018 /nfs/dbraw/zinc/16/40/18/1046164018.db2.gz BLGRXVPLMFSUQP-GFCCVEGCSA-N 1 2 322.861 4.281 20 0 DIADLO Cc1c2ccccc2[nH]c1C[N@H+](C)Cc1cn2ccc(C)cc2n1 ZINC001138401993 1046165008 /nfs/dbraw/zinc/16/50/08/1046165008.db2.gz ZYOMEPKICBUWHD-UHFFFAOYSA-N 1 2 318.424 4.064 20 0 DIADLO Cc1c2ccccc2[nH]c1C[N@@H+](C)Cc1cn2ccc(C)cc2n1 ZINC001138401993 1046165017 /nfs/dbraw/zinc/16/50/17/1046165017.db2.gz ZYOMEPKICBUWHD-UHFFFAOYSA-N 1 2 318.424 4.064 20 0 DIADLO c1csc([C@@H]([NH2+]Cc2ccon2)c2ccc3c(c2)CCCC3)c1 ZINC000634950868 1046165309 /nfs/dbraw/zinc/16/53/09/1046165309.db2.gz FWKFYDGCESMQFA-IBGZPJMESA-N 1 2 324.449 4.494 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[NH2+]Cc1ncc(C)s1 ZINC000903103611 1046166086 /nfs/dbraw/zinc/16/60/86/1046166086.db2.gz LBENAEVJTSLSMC-ZDUSSCGKSA-N 1 2 322.861 4.281 20 0 DIADLO COc1ccc2c(c1Cl)[C@@H]([NH2+]Cc1ncccc1F)CCC2 ZINC000903127822 1046170010 /nfs/dbraw/zinc/17/00/10/1046170010.db2.gz MDIYBSKRYMBKMJ-ZDUSSCGKSA-N 1 2 320.795 4.050 20 0 DIADLO Cc1c2cc(F)ccc2[nH]c1C[N@@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001138409644 1046170497 /nfs/dbraw/zinc/17/04/97/1046170497.db2.gz CKGCGASIFPLMJX-HNNXBMFYSA-N 1 2 314.326 4.185 20 0 DIADLO Cc1c2cc(F)ccc2[nH]c1C[N@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001138409644 1046170504 /nfs/dbraw/zinc/17/05/04/1046170504.db2.gz CKGCGASIFPLMJX-HNNXBMFYSA-N 1 2 314.326 4.185 20 0 DIADLO C[C@@H](Nc1ccc([NH+]2CCCC2)cc1)c1cnn(CC2CCC2)c1 ZINC000903133845 1046172509 /nfs/dbraw/zinc/17/25/09/1046172509.db2.gz XXKDUOOKERFDGH-MRXNPFEDSA-N 1 2 324.472 4.457 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1cc3cc(C)ccc3[nH]1)CC2 ZINC001138417113 1046173344 /nfs/dbraw/zinc/17/33/44/1046173344.db2.gz GOHRZVWJCSVXOA-UHFFFAOYSA-N 1 2 318.420 4.237 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1cc3cc(C)ccc3[nH]1)CC2 ZINC001138417113 1046173353 /nfs/dbraw/zinc/17/33/53/1046173353.db2.gz GOHRZVWJCSVXOA-UHFFFAOYSA-N 1 2 318.420 4.237 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CCOC[C@@H]3c3ccccc3)cc2c1 ZINC001138419747 1046175352 /nfs/dbraw/zinc/17/53/52/1046175352.db2.gz YJZWJSUBPJORGP-HXUWFJFHSA-N 1 2 306.409 4.050 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CCOC[C@@H]3c3ccccc3)cc2c1 ZINC001138419747 1046175357 /nfs/dbraw/zinc/17/53/57/1046175357.db2.gz YJZWJSUBPJORGP-HXUWFJFHSA-N 1 2 306.409 4.050 20 0 DIADLO CCOc1ccc2ccccc2c1C[N@@H+]1Cc2cnc(C)cc2C1 ZINC001138444021 1046184872 /nfs/dbraw/zinc/18/48/72/1046184872.db2.gz NXRSOQOXOXTTDO-UHFFFAOYSA-N 1 2 318.420 4.458 20 0 DIADLO CCOc1ccc2ccccc2c1C[N@H+]1Cc2cnc(C)cc2C1 ZINC001138444021 1046184877 /nfs/dbraw/zinc/18/48/77/1046184877.db2.gz NXRSOQOXOXTTDO-UHFFFAOYSA-N 1 2 318.420 4.458 20 0 DIADLO CCCc1nc(C[N@H+](C)[C@@H](C)[C@H](C)c2ccc(Cl)cc2)no1 ZINC000475743770 1046192704 /nfs/dbraw/zinc/19/27/04/1046192704.db2.gz LDEUBSXZDAXUHU-STQMWFEESA-N 1 2 321.852 4.300 20 0 DIADLO CCCc1nc(C[N@@H+](C)[C@@H](C)[C@H](C)c2ccc(Cl)cc2)no1 ZINC000475743770 1046192711 /nfs/dbraw/zinc/19/27/11/1046192711.db2.gz LDEUBSXZDAXUHU-STQMWFEESA-N 1 2 321.852 4.300 20 0 DIADLO CCC/C(C)=C/C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000757604891 1046193385 /nfs/dbraw/zinc/19/33/85/1046193385.db2.gz XEMLXGJOANQQRX-NTCAYCPXSA-N 1 2 321.424 4.287 20 0 DIADLO COc1ccc(C[N@@H+]2CCC(=O)[C@H](C)C23CCCC3)cc1Cl ZINC001138473260 1046194704 /nfs/dbraw/zinc/19/47/04/1046194704.db2.gz SAFIGRIZENVCBF-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO COc1ccc(C[N@H+]2CCC(=O)[C@H](C)C23CCCC3)cc1Cl ZINC001138473260 1046194711 /nfs/dbraw/zinc/19/47/11/1046194711.db2.gz SAFIGRIZENVCBF-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO CCCCCCOc1cccc(C[NH2+]Cc2nnc(C)s2)c1 ZINC000780007005 1046194649 /nfs/dbraw/zinc/19/46/49/1046194649.db2.gz LRLDMHPWTUFTGZ-UHFFFAOYSA-N 1 2 319.474 4.095 20 0 DIADLO CCCCC[C@H]1CCC[N@@H+]1Cc1csc(-c2ccn(C)n2)n1 ZINC001168154440 1046195128 /nfs/dbraw/zinc/19/51/28/1046195128.db2.gz MIVOXHQXHIEXEY-HNNXBMFYSA-N 1 2 318.490 4.088 20 0 DIADLO CCCCC[C@H]1CCC[N@H+]1Cc1csc(-c2ccn(C)n2)n1 ZINC001168154440 1046195137 /nfs/dbraw/zinc/19/51/37/1046195137.db2.gz MIVOXHQXHIEXEY-HNNXBMFYSA-N 1 2 318.490 4.088 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1C[C@H]1c1ccccc1 ZINC000803286522 1046196080 /nfs/dbraw/zinc/19/60/80/1046196080.db2.gz TXQVCEUJOABIOR-DLBZAZTESA-N 1 2 317.392 4.127 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1CCc2c(F)cccc2C1 ZINC001138482526 1046196847 /nfs/dbraw/zinc/19/68/47/1046196847.db2.gz CKEYDZAKEDDSLH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1CCc2c(F)cccc2C1 ZINC001138482526 1046196853 /nfs/dbraw/zinc/19/68/53/1046196853.db2.gz CKEYDZAKEDDSLH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CC(C)c1nc(C[N@H+](C)Cc2ccc(N(C)C)s2)cs1 ZINC001138493765 1046199955 /nfs/dbraw/zinc/19/99/55/1046199955.db2.gz WTNJNOOHBUNRFO-UHFFFAOYSA-N 1 2 309.504 4.026 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)Cc2ccc(N(C)C)s2)cs1 ZINC001138493765 1046199958 /nfs/dbraw/zinc/19/99/58/1046199958.db2.gz WTNJNOOHBUNRFO-UHFFFAOYSA-N 1 2 309.504 4.026 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1ccc(Cl)nc1Cl ZINC000689120640 1046200613 /nfs/dbraw/zinc/20/06/13/1046200613.db2.gz BDSIUAOVUNVYQG-UHFFFAOYSA-N 1 2 301.139 4.163 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1ccc(Cl)nc1Cl ZINC000689120640 1046200626 /nfs/dbraw/zinc/20/06/26/1046200626.db2.gz BDSIUAOVUNVYQG-UHFFFAOYSA-N 1 2 301.139 4.163 20 0 DIADLO CSc1ccc(C)c(NC(=O)[C@@H](CC(C)C)n2cc[nH+]c2)c1 ZINC000635769031 1046204977 /nfs/dbraw/zinc/20/49/77/1046204977.db2.gz CUHIWIVOPZKMQO-MRXNPFEDSA-N 1 2 317.458 4.139 20 0 DIADLO COc1ccc(-c2ccc(C[N@@H+]3Cc4ccncc4C3)cc2)cc1 ZINC001138516677 1046208637 /nfs/dbraw/zinc/20/86/37/1046208637.db2.gz OXYIABKVJZYNNR-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccc(-c2ccc(C[N@H+]3Cc4ccncc4C3)cc2)cc1 ZINC001138516677 1046208646 /nfs/dbraw/zinc/20/86/46/1046208646.db2.gz OXYIABKVJZYNNR-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1ccccc1C(C)(F)F)n1cc[nH+]c1 ZINC000635982468 1046214015 /nfs/dbraw/zinc/21/40/15/1046214015.db2.gz DUOVIICXMLPKDG-HNNXBMFYSA-N 1 2 321.371 4.221 20 0 DIADLO FC(F)(F)OCCNc1[nH+]ccc2cccc(C(F)(F)F)c21 ZINC001168166359 1046226991 /nfs/dbraw/zinc/22/69/91/1046226991.db2.gz FDSRLTPWTNALLM-UHFFFAOYSA-N 1 2 324.224 4.202 20 0 DIADLO CC[N@H+](Cc1cncn1Cc1ccccc1)Cc1ccccc1F ZINC001138564153 1046227965 /nfs/dbraw/zinc/22/79/65/1046227965.db2.gz FBTKOKGFAYHMLP-UHFFFAOYSA-N 1 2 323.415 4.093 20 0 DIADLO CC[N@@H+](Cc1cncn1Cc1ccccc1)Cc1ccccc1F ZINC001138564153 1046227975 /nfs/dbraw/zinc/22/79/75/1046227975.db2.gz FBTKOKGFAYHMLP-UHFFFAOYSA-N 1 2 323.415 4.093 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(C3CCOCC3)cc2)c(C)[nH+]1 ZINC000636581714 1046230425 /nfs/dbraw/zinc/23/04/25/1046230425.db2.gz JJWBGPVVXAQOGN-UHFFFAOYSA-N 1 2 324.424 4.153 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc(C3CC3)[nH]c2C2CC2)c(C)[nH+]1 ZINC000636581475 1046230573 /nfs/dbraw/zinc/23/05/73/1046230573.db2.gz CICLEAWORRNHLZ-UHFFFAOYSA-N 1 2 309.413 4.342 20 0 DIADLO CCc1nc2c(s1)[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)CCC2 ZINC000903313557 1046235053 /nfs/dbraw/zinc/23/50/53/1046235053.db2.gz SZGHMWVIBOGGHM-LLVKDONJSA-N 1 2 319.474 4.158 20 0 DIADLO Cc1cccc(C[N@@H+](C)[C@H](C)c2ccccc2Br)n1 ZINC000347365991 1046235952 /nfs/dbraw/zinc/23/59/52/1046235952.db2.gz QNFLBDAJYYPFNU-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cccc(C[N@H+](C)[C@H](C)c2ccccc2Br)n1 ZINC000347365991 1046235967 /nfs/dbraw/zinc/23/59/67/1046235967.db2.gz QNFLBDAJYYPFNU-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO COc1ccc2c(C[N@@H+]3Cc4cccc(Cl)c4C3)c[nH]c2c1 ZINC001138590595 1046236180 /nfs/dbraw/zinc/23/61/80/1046236180.db2.gz UGXRGUNLWPPPHQ-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccc2c(C[N@H+]3Cc4cccc(Cl)c4C3)c[nH]c2c1 ZINC001138590595 1046236190 /nfs/dbraw/zinc/23/61/90/1046236190.db2.gz UGXRGUNLWPPPHQ-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO CCC[C@@H]([NH2+][C@@H](C)c1cn(C(C)C)nn1)c1ccc(F)cc1F ZINC000925265485 1046237579 /nfs/dbraw/zinc/23/75/79/1046237579.db2.gz UKRSJDVVSWZWQO-BLLLJJGKSA-N 1 2 322.403 4.329 20 0 DIADLO C[C@H]1C[C@H]([NH2+][C@@H](c2ncccn2)C2CC2)c2ccsc2S1 ZINC000903327610 1046241594 /nfs/dbraw/zinc/24/15/94/1046241594.db2.gz WRRSZXIHXLRNCC-LEWSCRJBSA-N 1 2 317.483 4.204 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccc(Cl)nc1 ZINC000179113489 1046243319 /nfs/dbraw/zinc/24/33/19/1046243319.db2.gz YSINFQJKSINEPN-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@H](c2ccccn2)C2CC2)cs1 ZINC000903334955 1046245395 /nfs/dbraw/zinc/24/53/95/1046245395.db2.gz JDBXOTXFHONGJG-WBMJQRKESA-N 1 2 301.459 4.463 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C(F)(F)F)n(C)n1)c1csc(Cl)c1 ZINC000903340220 1046251489 /nfs/dbraw/zinc/25/14/89/1046251489.db2.gz HCORXMCDRVBNCA-SSDOTTSWSA-N 1 2 323.771 4.005 20 0 DIADLO C[C@@H]([NH2+]Cc1cn(C)cn1)c1ccc(Cl)c(Cl)c1Cl ZINC000903351663 1046255750 /nfs/dbraw/zinc/25/57/50/1046255750.db2.gz OBLFHLRYCJSMED-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cc(F)ccc2Cl)c(OC)c1 ZINC001138673836 1046263152 /nfs/dbraw/zinc/26/31/52/1046263152.db2.gz DYNGTKGTWRPVJP-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cc(F)ccc2Cl)c(OC)c1 ZINC001138673836 1046263162 /nfs/dbraw/zinc/26/31/62/1046263162.db2.gz DYNGTKGTWRPVJP-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO Fc1ccc(-c2ccc(C[N@@H+]3Cc4ccncc4C3)cc2)cc1 ZINC001138683920 1046266852 /nfs/dbraw/zinc/26/68/52/1046266852.db2.gz YRFHLESSMRHHGH-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Fc1ccc(-c2ccc(C[N@H+]3Cc4ccncc4C3)cc2)cc1 ZINC001138683920 1046266859 /nfs/dbraw/zinc/26/68/59/1046266859.db2.gz YRFHLESSMRHHGH-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H]2CCCc3[nH]ncc32)cc2ccccc21 ZINC000903413300 1046269218 /nfs/dbraw/zinc/26/92/18/1046269218.db2.gz KGFVAWNKDYIYFG-ACJLOTCBSA-N 1 2 321.424 4.300 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001138719954 1046276996 /nfs/dbraw/zinc/27/69/96/1046276996.db2.gz KVGSTKVIDULITH-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001138719954 1046277003 /nfs/dbraw/zinc/27/70/03/1046277003.db2.gz KVGSTKVIDULITH-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO CCc1cccc2cc(C[N@@H+]3C[C@@H](F)C[C@H]3C)c(Cl)nc21 ZINC001138726847 1046279237 /nfs/dbraw/zinc/27/92/37/1046279237.db2.gz PHXIBBRNVBLKPK-ABAIWWIYSA-N 1 2 306.812 4.383 20 0 DIADLO CCc1cccc2cc(C[N@H+]3C[C@@H](F)C[C@H]3C)c(Cl)nc21 ZINC001138726847 1046279249 /nfs/dbraw/zinc/27/92/49/1046279249.db2.gz PHXIBBRNVBLKPK-ABAIWWIYSA-N 1 2 306.812 4.383 20 0 DIADLO c1cc(C[N@@H+]2CCC[C@H]2c2nc3ccccc3s2)sn1 ZINC000637850363 1046281811 /nfs/dbraw/zinc/28/18/11/1046281811.db2.gz AMSWAAGXGDVMFC-ZDUSSCGKSA-N 1 2 301.440 4.090 20 0 DIADLO c1cc(C[N@H+]2CCC[C@H]2c2nc3ccccc3s2)sn1 ZINC000637850363 1046281823 /nfs/dbraw/zinc/28/18/23/1046281823.db2.gz AMSWAAGXGDVMFC-ZDUSSCGKSA-N 1 2 301.440 4.090 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)[C@H](c1nccn1C)C1CC1 ZINC000637900734 1046283981 /nfs/dbraw/zinc/28/39/81/1046283981.db2.gz FRIBIVOYKGAZEQ-WBMJQRKESA-N 1 2 303.837 4.218 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)[C@H](c1nccn1C)C1CC1 ZINC000637900734 1046283990 /nfs/dbraw/zinc/28/39/90/1046283990.db2.gz FRIBIVOYKGAZEQ-WBMJQRKESA-N 1 2 303.837 4.218 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1coc(-c2cccs2)n1 ZINC000170751869 1046287133 /nfs/dbraw/zinc/28/71/33/1046287133.db2.gz HJWVRDRQOCLUBI-HNNXBMFYSA-N 1 2 313.426 4.079 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1coc(-c2cccs2)n1 ZINC000170751869 1046287144 /nfs/dbraw/zinc/28/71/44/1046287144.db2.gz HJWVRDRQOCLUBI-HNNXBMFYSA-N 1 2 313.426 4.079 20 0 DIADLO CSCc1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000795344943 1046287147 /nfs/dbraw/zinc/28/71/47/1046287147.db2.gz LIVMNJXIMYLDPV-GFCCVEGCSA-N 1 2 319.474 4.081 20 0 DIADLO CC[N@H+](Cc1ccc(Br)o1)Cc1ccccc1F ZINC001138906132 1046324729 /nfs/dbraw/zinc/32/47/29/1046324729.db2.gz GLTXAKGZQZXTDX-UHFFFAOYSA-N 1 2 312.182 4.203 20 0 DIADLO CC[N@@H+](Cc1ccc(Br)o1)Cc1ccccc1F ZINC001138906132 1046324743 /nfs/dbraw/zinc/32/47/43/1046324743.db2.gz GLTXAKGZQZXTDX-UHFFFAOYSA-N 1 2 312.182 4.203 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CCc3c(Cl)cccc3C2)cn1 ZINC000638062824 1046292260 /nfs/dbraw/zinc/29/22/60/1046292260.db2.gz ILUPCTPQABTRDA-UHFFFAOYSA-N 1 2 308.759 4.231 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CCc3c(Cl)cccc3C2)cn1 ZINC000638062824 1046292274 /nfs/dbraw/zinc/29/22/74/1046292274.db2.gz ILUPCTPQABTRDA-UHFFFAOYSA-N 1 2 308.759 4.231 20 0 DIADLO O=C1CC[N@@H+](Cc2c[nH]c3c2cccc3Cl)[C@H]2CCCC[C@@H]12 ZINC001138830416 1046304963 /nfs/dbraw/zinc/30/49/63/1046304963.db2.gz LQUFSLYYXKQNGV-ZBFHGGJFSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c[nH]c3c2cccc3Cl)[C@H]2CCCC[C@@H]12 ZINC001138830416 1046304979 /nfs/dbraw/zinc/30/49/79/1046304979.db2.gz LQUFSLYYXKQNGV-ZBFHGGJFSA-N 1 2 316.832 4.155 20 0 DIADLO COc1cc(OC(F)(F)F)ccc1C[NH+]1Cc2ccccc2C1 ZINC001138847854 1046310733 /nfs/dbraw/zinc/31/07/33/1046310733.db2.gz LVVXOKDOXHIRBC-UHFFFAOYSA-N 1 2 323.314 4.110 20 0 DIADLO C[C@H]([NH2+][C@H](c1nnc[nH]1)C1CCCCC1)c1ccc(F)c(F)c1 ZINC000638302325 1046311310 /nfs/dbraw/zinc/31/13/10/1046311310.db2.gz SPQOHIJLQVESLB-ZBEGNZNMSA-N 1 2 320.387 4.055 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@H](Oc3ccc(F)cc3)C2)cs1 ZINC001138886703 1046319730 /nfs/dbraw/zinc/31/97/30/1046319730.db2.gz BBYBMLYNFUYILA-INIZCTEOSA-N 1 2 320.433 4.059 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@H](Oc3ccc(F)cc3)C2)cs1 ZINC001138886703 1046319744 /nfs/dbraw/zinc/31/97/44/1046319744.db2.gz BBYBMLYNFUYILA-INIZCTEOSA-N 1 2 320.433 4.059 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Br)o2)Cc2ccccc21 ZINC001138902256 1046324092 /nfs/dbraw/zinc/32/40/92/1046324092.db2.gz NLMPITIGLNITGD-NSHDSACASA-N 1 2 306.203 4.161 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Br)o2)Cc2ccccc21 ZINC001138902256 1046324101 /nfs/dbraw/zinc/32/41/01/1046324101.db2.gz NLMPITIGLNITGD-NSHDSACASA-N 1 2 306.203 4.161 20 0 DIADLO C[N@@H+](Cc1cccc(F)c1F)Cc1ccccc1OC(F)F ZINC001138911567 1046325398 /nfs/dbraw/zinc/32/53/98/1046325398.db2.gz BASFXFFBMLLRFA-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO C[N@H+](Cc1cccc(F)c1F)Cc1ccccc1OC(F)F ZINC001138911567 1046325411 /nfs/dbraw/zinc/32/54/11/1046325411.db2.gz BASFXFFBMLLRFA-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO Cn1c2ccccc2c2cc(C[N@H+](C)Cc3nccs3)ccc21 ZINC001138918948 1046328915 /nfs/dbraw/zinc/32/89/15/1046328915.db2.gz UTCSOFMXCQYRBA-UHFFFAOYSA-N 1 2 321.449 4.420 20 0 DIADLO Cn1c2ccccc2c2cc(C[N@@H+](C)Cc3nccs3)ccc21 ZINC001138918948 1046328920 /nfs/dbraw/zinc/32/89/20/1046328920.db2.gz UTCSOFMXCQYRBA-UHFFFAOYSA-N 1 2 321.449 4.420 20 0 DIADLO Cc1cccc2c1CC[C@H]2[NH2+][C@@H](c1nnc[nH]1)C1CCCCC1 ZINC000638544812 1046329630 /nfs/dbraw/zinc/32/96/30/1046329630.db2.gz LEDSQFVPFWCSGI-QZTJIDSGSA-N 1 2 310.445 4.012 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)c1C ZINC000638599612 1046330409 /nfs/dbraw/zinc/33/04/09/1046330409.db2.gz LQEXSTGOQWKPBT-QAPCUYQASA-N 1 2 312.461 4.394 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1nc(Cl)cs1)CCS2 ZINC000759184175 1046331030 /nfs/dbraw/zinc/33/10/30/1046331030.db2.gz IMHJWXDBZDWJHN-JTQLQIEISA-N 1 2 314.838 4.262 20 0 DIADLO CCc1cccc2c1OCC[C@@H]2[NH2+]Cc1nc2ccccc2o1 ZINC000638574960 1046331983 /nfs/dbraw/zinc/33/19/83/1046331983.db2.gz AJCOOZDHKPIOFH-HNNXBMFYSA-N 1 2 308.381 4.004 20 0 DIADLO CC(C)([NH2+][C@H](c1nnc[nH]1)C1CCCCC1)c1cccc(F)c1 ZINC000638629039 1046333143 /nfs/dbraw/zinc/33/31/43/1046333143.db2.gz MUXPQWUNNVHUHH-INIZCTEOSA-N 1 2 316.424 4.090 20 0 DIADLO C[N@H+](Cc1ccccc1Cl)Cc1c2cc[nH]c2ncc1Cl ZINC001138951219 1046336153 /nfs/dbraw/zinc/33/61/53/1046336153.db2.gz SBDAUWGKHCTRHG-UHFFFAOYSA-N 1 2 320.223 4.453 20 0 DIADLO C[N@@H+](Cc1ccccc1Cl)Cc1c2cc[nH]c2ncc1Cl ZINC001138951219 1046336166 /nfs/dbraw/zinc/33/61/66/1046336166.db2.gz SBDAUWGKHCTRHG-UHFFFAOYSA-N 1 2 320.223 4.453 20 0 DIADLO CC(C)Oc1ccc(Cl)cc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC001138958149 1046337758 /nfs/dbraw/zinc/33/77/58/1046337758.db2.gz WMGVDIAXODXVBJ-UHFFFAOYSA-N 1 2 315.791 4.358 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cc(Cl)cc(Cl)c2N)s1 ZINC000638726975 1046339187 /nfs/dbraw/zinc/33/91/87/1046339187.db2.gz ZFFQTJLXQZOYAS-QMMMGPOBSA-N 1 2 316.257 4.191 20 0 DIADLO CC(C)Oc1ccc(Cl)cc1C[N@H+](C)Cc1cncs1 ZINC001138961252 1046341609 /nfs/dbraw/zinc/34/16/09/1046341609.db2.gz AHVXZDLOCJNHBV-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO CC(C)Oc1ccc(Cl)cc1C[N@@H+](C)Cc1cncs1 ZINC001138961252 1046341619 /nfs/dbraw/zinc/34/16/19/1046341619.db2.gz AHVXZDLOCJNHBV-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO COc1ccc([C@H]([NH2+][C@H](C)c2nc(C(C)C)no2)C2CC2)cc1 ZINC000170874216 1046348936 /nfs/dbraw/zinc/34/89/36/1046348936.db2.gz ARTNYNYIZWDVRS-MLGOLLRUSA-N 1 2 315.417 4.004 20 0 DIADLO Clc1ccc(Cl)c(-c2ccc(C[NH+]3CCOCC3)o2)c1 ZINC001139161896 1046349499 /nfs/dbraw/zinc/34/94/99/1046349499.db2.gz ADAGQEASNNTSEC-UHFFFAOYSA-N 1 2 312.196 4.086 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cn1cc(-c2ccc(C)cc2)cn1 ZINC000748290807 1046363845 /nfs/dbraw/zinc/36/38/45/1046363845.db2.gz CQUNWUJXMILYRV-UHFFFAOYSA-N 1 2 311.351 4.090 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cn1cc(-c2ccc(C)cc2)cn1 ZINC000748290807 1046363858 /nfs/dbraw/zinc/36/38/58/1046363858.db2.gz CQUNWUJXMILYRV-UHFFFAOYSA-N 1 2 311.351 4.090 20 0 DIADLO CC(C)OC1CC[NH+](Cc2c(F)cc(Cl)cc2F)CC1 ZINC001139050741 1046370335 /nfs/dbraw/zinc/37/03/35/1046370335.db2.gz BYTOXZZAOXYSJF-UHFFFAOYSA-N 1 2 303.780 4.008 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001139064568 1046372363 /nfs/dbraw/zinc/37/23/63/1046372363.db2.gz BTWUKVPZGSOEGE-ROUUACIJSA-N 1 2 305.343 4.375 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001139064568 1046372376 /nfs/dbraw/zinc/37/23/76/1046372376.db2.gz BTWUKVPZGSOEGE-ROUUACIJSA-N 1 2 305.343 4.375 20 0 DIADLO Fc1ccc(-c2cccc(C[N@@H+]3Cc4cccnc4C3)c2)cc1 ZINC001139064733 1046372547 /nfs/dbraw/zinc/37/25/47/1046372547.db2.gz GATLKLSRANIGIB-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Fc1ccc(-c2cccc(C[N@H+]3Cc4cccnc4C3)c2)cc1 ZINC001139064733 1046372558 /nfs/dbraw/zinc/37/25/58/1046372558.db2.gz GATLKLSRANIGIB-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc2ccccc2o1 ZINC001139066538 1046375451 /nfs/dbraw/zinc/37/54/51/1046375451.db2.gz WLDNQQXZSBIFCT-INIZCTEOSA-N 1 2 315.413 4.129 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1CCCC[N@H+]1Cc1cc2ccccc2o1 ZINC001139066538 1046375463 /nfs/dbraw/zinc/37/54/63/1046375463.db2.gz WLDNQQXZSBIFCT-INIZCTEOSA-N 1 2 315.413 4.129 20 0 DIADLO Cc1ccc(C2([NH2+][C@H](c3nnc[nH]3)C3CCCCC3)CCC2)cc1 ZINC000639286580 1046375794 /nfs/dbraw/zinc/37/57/94/1046375794.db2.gz DBAOOWKUNXDHFX-SFHVURJKSA-N 1 2 324.472 4.404 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CCc3cccc(Cl)c3C2)cn1 ZINC000639273044 1046376233 /nfs/dbraw/zinc/37/62/33/1046376233.db2.gz KDTOSRTUDHLRQP-UHFFFAOYSA-N 1 2 308.759 4.231 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CCc3cccc(Cl)c3C2)cn1 ZINC000639273044 1046376248 /nfs/dbraw/zinc/37/62/48/1046376248.db2.gz KDTOSRTUDHLRQP-UHFFFAOYSA-N 1 2 308.759 4.231 20 0 DIADLO Cc1cccc(C2([NH2+][C@H](c3nnc[nH]3)C3CCCCC3)CCC2)c1 ZINC000639283018 1046377950 /nfs/dbraw/zinc/37/79/50/1046377950.db2.gz IADFGWUICUPLDP-SFHVURJKSA-N 1 2 324.472 4.404 20 0 DIADLO C[C@@H]1CCCC[N@H+](Cc2ccc(Br)nc2Cl)C1 ZINC001139108549 1046386680 /nfs/dbraw/zinc/38/66/80/1046386680.db2.gz VENJEJILIJIHKZ-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1CCCC[N@@H+](Cc2ccc(Br)nc2Cl)C1 ZINC001139108549 1046386690 /nfs/dbraw/zinc/38/66/90/1046386690.db2.gz VENJEJILIJIHKZ-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO Cc1cc(-c2ccccc2)ccc1NC(=O)CCCn1cc[nH+]c1 ZINC000748617916 1046389056 /nfs/dbraw/zinc/38/90/56/1046389056.db2.gz OIGFAZAACWIIGQ-UHFFFAOYSA-N 1 2 319.408 4.277 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3c[nH]nc3-c3ccsc3)ccc21 ZINC000780539076 1046392080 /nfs/dbraw/zinc/39/20/80/1046392080.db2.gz VBRULDALKZXBGH-UHFFFAOYSA-N 1 2 324.453 4.133 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3c[nH]nc3-c3ccsc3)ccc21 ZINC000780539076 1046392093 /nfs/dbraw/zinc/39/20/93/1046392093.db2.gz VBRULDALKZXBGH-UHFFFAOYSA-N 1 2 324.453 4.133 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nc(C2CCC2)no1)c1ccc(Cl)cc1 ZINC000639442017 1046401499 /nfs/dbraw/zinc/40/14/99/1046401499.db2.gz ZSBKHRIBZXYFQU-INIZCTEOSA-N 1 2 319.836 4.477 20 0 DIADLO CC[N@H+](Cc1nc(C2CCC2)no1)[C@@H](C)c1ccc(F)cc1 ZINC000639460265 1046403405 /nfs/dbraw/zinc/40/34/05/1046403405.db2.gz SLIIHEQDGHVVNX-LBPRGKRZSA-N 1 2 303.381 4.059 20 0 DIADLO CC[N@@H+](Cc1nc(C2CCC2)no1)[C@@H](C)c1ccc(F)cc1 ZINC000639460265 1046403409 /nfs/dbraw/zinc/40/34/09/1046403409.db2.gz SLIIHEQDGHVVNX-LBPRGKRZSA-N 1 2 303.381 4.059 20 0 DIADLO CCCCc1nc(Cl)c(C[N@H+](C)Cc2ccccc2C)[nH]1 ZINC001139180657 1046404140 /nfs/dbraw/zinc/40/41/40/1046404140.db2.gz BPDURJDCJFKXAR-UHFFFAOYSA-N 1 2 305.853 4.346 20 0 DIADLO CCCCc1nc(Cl)c(C[N@@H+](C)Cc2ccccc2C)[nH]1 ZINC001139180657 1046404146 /nfs/dbraw/zinc/40/41/46/1046404146.db2.gz BPDURJDCJFKXAR-UHFFFAOYSA-N 1 2 305.853 4.346 20 0 DIADLO O[C@H](C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1)c1cc(F)ccc1F ZINC000748825819 1046408805 /nfs/dbraw/zinc/40/88/05/1046408805.db2.gz ZGJJLLBVCBCXSF-DLBZAZTESA-N 1 2 323.770 4.099 20 0 DIADLO O[C@H](C[N@H+]1CC[C@H]1c1ccc(Cl)cc1)c1cc(F)ccc1F ZINC000748825819 1046408811 /nfs/dbraw/zinc/40/88/11/1046408811.db2.gz ZGJJLLBVCBCXSF-DLBZAZTESA-N 1 2 323.770 4.099 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2cscc2Br)C1 ZINC001139348182 1046434365 /nfs/dbraw/zinc/43/43/65/1046434365.db2.gz XDYMAJFKTYSBRA-GFCCVEGCSA-N 1 2 306.244 4.225 20 0 DIADLO CC(C)c1ccc(C(C)(C)[NH2+]Cc2nc(C3CCC3)no2)cc1 ZINC000639530267 1046409254 /nfs/dbraw/zinc/40/92/54/1046409254.db2.gz RNAGNMRQZMJCAT-UHFFFAOYSA-N 1 2 313.445 4.485 20 0 DIADLO Cc1nc(-c2ccccc2)oc1C[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000639639231 1046417965 /nfs/dbraw/zinc/41/79/65/1046417965.db2.gz TWQQJDRROJUHKE-KRWDZBQOSA-N 1 2 322.412 4.100 20 0 DIADLO Cc1nc(-c2ccccc2)oc1C[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000639639231 1046417970 /nfs/dbraw/zinc/41/79/70/1046417970.db2.gz TWQQJDRROJUHKE-KRWDZBQOSA-N 1 2 322.412 4.100 20 0 DIADLO c1ccc(Oc2ccc(C[NH+]3Cc4ccccc4C3)cn2)cc1 ZINC001139245161 1046418848 /nfs/dbraw/zinc/41/88/48/1046418848.db2.gz QHSGQQBRYLJFCZ-UHFFFAOYSA-N 1 2 302.377 4.390 20 0 DIADLO CC(C)(C)[N@@H+](Cc1ccsc1)Cc1nc(C2CCC2)no1 ZINC000639783735 1046427579 /nfs/dbraw/zinc/42/75/79/1046427579.db2.gz CJUKJPYJRCPWGW-UHFFFAOYSA-N 1 2 305.447 4.199 20 0 DIADLO CC(C)(C)[N@H+](Cc1ccsc1)Cc1nc(C2CCC2)no1 ZINC000639783735 1046427583 /nfs/dbraw/zinc/42/75/83/1046427583.db2.gz CJUKJPYJRCPWGW-UHFFFAOYSA-N 1 2 305.447 4.199 20 0 DIADLO Oc1ccc2cc(C[N@@H+]3CCc4nc(Cl)ccc4C3)ccc2c1 ZINC001139339260 1046431068 /nfs/dbraw/zinc/43/10/68/1046431068.db2.gz RUWUGNPZUDUZPF-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1ccc2cc(C[N@H+]3CCc4nc(Cl)ccc4C3)ccc2c1 ZINC001139339260 1046431071 /nfs/dbraw/zinc/43/10/71/1046431071.db2.gz RUWUGNPZUDUZPF-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Clc1ccc(C[N@@H+]2CCC[C@H]2c2ncccn2)c2ncccc12 ZINC000639843332 1046431748 /nfs/dbraw/zinc/43/17/48/1046431748.db2.gz PUKXPMPCZQHBRN-INIZCTEOSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1ccc(C[N@H+]2CCC[C@H]2c2ncccn2)c2ncccc12 ZINC000639843332 1046431750 /nfs/dbraw/zinc/43/17/50/1046431750.db2.gz PUKXPMPCZQHBRN-INIZCTEOSA-N 1 2 324.815 4.015 20 0 DIADLO Oc1ccc2cc(C[N@@H+]3CCc4ncc(Cl)cc4C3)ccc2c1 ZINC001139342611 1046432827 /nfs/dbraw/zinc/43/28/27/1046432827.db2.gz SJRZTKLIALMONE-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1ccc2cc(C[N@H+]3CCc4ncc(Cl)cc4C3)ccc2c1 ZINC001139342611 1046432831 /nfs/dbraw/zinc/43/28/31/1046432831.db2.gz SJRZTKLIALMONE-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2cscc2Br)C1 ZINC001139348182 1046434369 /nfs/dbraw/zinc/43/43/69/1046434369.db2.gz XDYMAJFKTYSBRA-GFCCVEGCSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(Br)c2F)CCC1(F)F ZINC001139531590 1046464802 /nfs/dbraw/zinc/46/48/02/1046464802.db2.gz IZQCRNWCOOSHCQ-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(Br)c2F)CCC1(F)F ZINC001139531590 1046464810 /nfs/dbraw/zinc/46/48/10/1046464810.db2.gz IZQCRNWCOOSHCQ-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO Clc1cnc(Cl)c(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c1 ZINC001139353630 1046436899 /nfs/dbraw/zinc/43/68/99/1046436899.db2.gz VPAIXYRTJUHOBJ-HNNXBMFYSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cnc(Cl)c(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c1 ZINC001139353630 1046436902 /nfs/dbraw/zinc/43/69/02/1046436902.db2.gz VPAIXYRTJUHOBJ-HNNXBMFYSA-N 1 2 323.223 4.042 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2coc(-c3ccc(F)cc3)n2)s1 ZINC000639994911 1046440961 /nfs/dbraw/zinc/44/09/61/1046440961.db2.gz OVPFGDPBCFGHKU-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2ncc(-c3ccc(C)cc3)o2)s1 ZINC000639994708 1046441382 /nfs/dbraw/zinc/44/13/82/1046441382.db2.gz MHKNMWGHKOKZIK-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO COc1ccc(Cl)c(C[N@H+](C)CCC(=O)c2cccs2)c1 ZINC001137265479 1046441796 /nfs/dbraw/zinc/44/17/96/1046441796.db2.gz GYFREUVKJRDWIE-UHFFFAOYSA-N 1 2 323.845 4.115 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+](C)CCC(=O)c2cccs2)c1 ZINC001137265479 1046441802 /nfs/dbraw/zinc/44/18/02/1046441802.db2.gz GYFREUVKJRDWIE-UHFFFAOYSA-N 1 2 323.845 4.115 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3cnc(C)s3)cs2)o1 ZINC000639993714 1046442102 /nfs/dbraw/zinc/44/21/02/1046442102.db2.gz CTOBWVVTVADIGC-SNVBAGLBSA-N 1 2 319.455 4.327 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2csc(C3CCCC3)n2)s1 ZINC000639995698 1046442178 /nfs/dbraw/zinc/44/21/78/1046442178.db2.gz XUJCSTLXZGYPHH-SNVBAGLBSA-N 1 2 307.488 4.416 20 0 DIADLO C[N@H+](Cc1nc(C2CCCC2)no1)[C@H]1CCCc2ccccc21 ZINC000676879763 1046442721 /nfs/dbraw/zinc/44/27/21/1046442721.db2.gz AWXOQGOELIAAKO-KRWDZBQOSA-N 1 2 311.429 4.237 20 0 DIADLO C[N@@H+](Cc1nc(C2CCCC2)no1)[C@H]1CCCc2ccccc21 ZINC000676879763 1046442726 /nfs/dbraw/zinc/44/27/26/1046442726.db2.gz AWXOQGOELIAAKO-KRWDZBQOSA-N 1 2 311.429 4.237 20 0 DIADLO C[C@H](c1nc2ccccc2n1C(F)F)[NH+]1CCC(C)(F)CC1 ZINC000640071133 1046446437 /nfs/dbraw/zinc/44/64/37/1046446437.db2.gz XZWKJKIIJIYLNU-LLVKDONJSA-N 1 2 311.351 4.316 20 0 DIADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC001139415079 1046447091 /nfs/dbraw/zinc/44/70/91/1046447091.db2.gz KVQMAPZXCRQUPU-LBPRGKRZSA-N 1 2 303.789 4.153 20 0 DIADLO C[C@H]1CC(=O)CC[N@H+]1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC001139415079 1046447093 /nfs/dbraw/zinc/44/70/93/1046447093.db2.gz KVQMAPZXCRQUPU-LBPRGKRZSA-N 1 2 303.789 4.153 20 0 DIADLO Clc1ccc(-c2ccc(C[N@@H+]3CCn4cccc4C3)o2)cc1 ZINC001139418798 1046448890 /nfs/dbraw/zinc/44/88/90/1046448890.db2.gz XHQOCYPSCSGCKR-UHFFFAOYSA-N 1 2 312.800 4.417 20 0 DIADLO Clc1ccc(-c2ccc(C[N@H+]3CCn4cccc4C3)o2)cc1 ZINC001139418798 1046448896 /nfs/dbraw/zinc/44/88/96/1046448896.db2.gz XHQOCYPSCSGCKR-UHFFFAOYSA-N 1 2 312.800 4.417 20 0 DIADLO C[N@H+](CCCc1ccccc1)Cc1c(Cl)ccnc1Cl ZINC001139478204 1046454002 /nfs/dbraw/zinc/45/40/02/1046454002.db2.gz HYCUIKDZWLCJEF-UHFFFAOYSA-N 1 2 309.240 4.453 20 0 DIADLO C[N@@H+](CCCc1ccccc1)Cc1c(Cl)ccnc1Cl ZINC001139478204 1046454010 /nfs/dbraw/zinc/45/40/10/1046454010.db2.gz HYCUIKDZWLCJEF-UHFFFAOYSA-N 1 2 309.240 4.453 20 0 DIADLO COc1cccc(C[N@@H+]2CCc3cc(F)ccc3C2)c1Cl ZINC001168252464 1046456294 /nfs/dbraw/zinc/45/62/94/1046456294.db2.gz MQRNWGLVHSTNIV-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc(C[N@H+]2CCc3cc(F)ccc3C2)c1Cl ZINC001168252464 1046456297 /nfs/dbraw/zinc/45/62/97/1046456297.db2.gz MQRNWGLVHSTNIV-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Fc1ccc(F)c2c1CC[C@H]2[NH2+][C@@H]1COc2c1cccc2Cl ZINC000677042304 1046456352 /nfs/dbraw/zinc/45/63/52/1046456352.db2.gz FYKHRUVIRSPSTO-HUUCEWRRSA-N 1 2 321.754 4.329 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc(-c2ccsc2)nc1 ZINC001139505010 1046458401 /nfs/dbraw/zinc/45/84/01/1046458401.db2.gz MOJNYTALLGPGDQ-AWEZNQCLSA-N 1 2 309.438 4.188 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccc(-c2ccsc2)nc1 ZINC001139505010 1046458407 /nfs/dbraw/zinc/45/84/07/1046458407.db2.gz MOJNYTALLGPGDQ-AWEZNQCLSA-N 1 2 309.438 4.188 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc(-c3ccccc3)nc2)no1 ZINC001139520245 1046461546 /nfs/dbraw/zinc/46/15/46/1046461546.db2.gz DAZXDRKVOFERLY-HXUWFJFHSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc(-c3ccccc3)nc2)no1 ZINC001139520245 1046461551 /nfs/dbraw/zinc/46/15/51/1046461551.db2.gz DAZXDRKVOFERLY-HXUWFJFHSA-N 1 2 319.408 4.382 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2ccc(-c3ccccc3)nc2)C[C@H]1F ZINC001139520735 1046461859 /nfs/dbraw/zinc/46/18/59/1046461859.db2.gz PNXNFCUVSORYOG-MSOLQXFVSA-N 1 2 302.368 4.021 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2ccc(-c3ccccc3)nc2)C[C@H]1F ZINC001139520735 1046461863 /nfs/dbraw/zinc/46/18/63/1046461863.db2.gz PNXNFCUVSORYOG-MSOLQXFVSA-N 1 2 302.368 4.021 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cnc(-c3ccccc3)[nH]2)cn1 ZINC001139556886 1046470162 /nfs/dbraw/zinc/47/01/62/1046470162.db2.gz SFEVKNJHKMNHBV-LJQANCHMSA-N 1 2 318.424 4.117 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cnc(-c3ccccc3)[nH]2)cn1 ZINC001139556886 1046470168 /nfs/dbraw/zinc/47/01/68/1046470168.db2.gz SFEVKNJHKMNHBV-LJQANCHMSA-N 1 2 318.424 4.117 20 0 DIADLO CC(C)c1noc([C@@H](C)[NH+]2CCC(OC3CCCCC3)CC2)n1 ZINC000125633778 1046470508 /nfs/dbraw/zinc/47/05/08/1046470508.db2.gz QXVIUSSZUWMFOT-CQSZACIVSA-N 1 2 321.465 4.068 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cccc(Cl)n1 ZINC001139552697 1046470996 /nfs/dbraw/zinc/47/09/96/1046470996.db2.gz RLUXAOAFBOUPDR-INIZCTEOSA-N 1 2 316.832 4.218 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cccc(Cl)n1 ZINC001139552697 1046471002 /nfs/dbraw/zinc/47/10/02/1046471002.db2.gz RLUXAOAFBOUPDR-INIZCTEOSA-N 1 2 316.832 4.218 20 0 DIADLO Clc1ccnc(C[N@H+](Cc2ccccc2)Cc2ccncc2)c1 ZINC001139559485 1046473261 /nfs/dbraw/zinc/47/32/61/1046473261.db2.gz HLASDVKRAATEOH-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1ccnc(C[N@@H+](Cc2ccccc2)Cc2ccncc2)c1 ZINC001139559485 1046473264 /nfs/dbraw/zinc/47/32/64/1046473264.db2.gz HLASDVKRAATEOH-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO CC(C)[N@H+](Cc1noc(-c2ccsc2)n1)Cc1ccccc1 ZINC000126380731 1046476667 /nfs/dbraw/zinc/47/66/67/1046476667.db2.gz RAQJEOPHZGNHSI-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)[N@@H+](Cc1noc(-c2ccsc2)n1)Cc1ccccc1 ZINC000126380731 1046476673 /nfs/dbraw/zinc/47/66/73/1046476673.db2.gz RAQJEOPHZGNHSI-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO Clc1ccccc1-c1ccccc1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001139575331 1046476701 /nfs/dbraw/zinc/47/67/01/1046476701.db2.gz BEBSKAQINFDZFR-HZPDHXFCSA-N 1 2 313.828 4.370 20 0 DIADLO Clc1ccccc1-c1ccccc1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001139575331 1046476703 /nfs/dbraw/zinc/47/67/03/1046476703.db2.gz BEBSKAQINFDZFR-HZPDHXFCSA-N 1 2 313.828 4.370 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCOc3ccccc3C2)cc1Cl ZINC001139595658 1046480270 /nfs/dbraw/zinc/48/02/70/1046480270.db2.gz LAIRXLQLQLPLLU-UHFFFAOYSA-N 1 2 317.816 4.133 20 0 DIADLO CCOc1ccc(C[N@H+]2CCOc3ccccc3C2)cc1Cl ZINC001139595658 1046480274 /nfs/dbraw/zinc/48/02/74/1046480274.db2.gz LAIRXLQLQLPLLU-UHFFFAOYSA-N 1 2 317.816 4.133 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3sccc3C2)cc1Cl ZINC001139594421 1046480818 /nfs/dbraw/zinc/48/08/18/1046480818.db2.gz FHLFOCKIAMXBSA-UHFFFAOYSA-N 1 2 307.846 4.359 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3sccc3C2)cc1Cl ZINC001139594421 1046480824 /nfs/dbraw/zinc/48/08/24/1046480824.db2.gz FHLFOCKIAMXBSA-UHFFFAOYSA-N 1 2 307.846 4.359 20 0 DIADLO OCc1ccc(Nc2cc[nH+]c3ccc(Cl)cc23)cc1Cl ZINC001212889095 1046482109 /nfs/dbraw/zinc/48/21/09/1046482109.db2.gz IAXUOVGXQAOGQC-UHFFFAOYSA-N 1 2 319.191 4.199 20 0 DIADLO Fc1ccccc1COC1CC[NH+](C/C(Cl)=C/Cl)CC1 ZINC000091868863 1046485278 /nfs/dbraw/zinc/48/52/78/1046485278.db2.gz FDEIXICXTRTEBP-LCYFTJDESA-N 1 2 318.219 4.126 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1cccnc1Cl)[C@H]2C ZINC000781928193 1046487897 /nfs/dbraw/zinc/48/78/97/1046487897.db2.gz UQGICAOKFASTST-OLZOCXBDSA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1cccnc1Cl)[C@H]2C ZINC000781928193 1046487900 /nfs/dbraw/zinc/48/79/00/1046487900.db2.gz UQGICAOKFASTST-OLZOCXBDSA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1coc(C3CC3)n1)[C@H]2C ZINC000781928235 1046488022 /nfs/dbraw/zinc/48/80/22/1046488022.db2.gz VIWZTUWAWNEZOA-STQMWFEESA-N 1 2 312.413 4.068 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1coc(C3CC3)n1)[C@H]2C ZINC000781928235 1046488025 /nfs/dbraw/zinc/48/80/25/1046488025.db2.gz VIWZTUWAWNEZOA-STQMWFEESA-N 1 2 312.413 4.068 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nccn1C)c1cccc(F)c1)c1cccs1 ZINC000128403684 1046492945 /nfs/dbraw/zinc/49/29/45/1046492945.db2.gz NIQGUYIWOSQKQG-BLLLJJGKSA-N 1 2 315.417 4.061 20 0 DIADLO FC1(F)CCCC[N@H+](Cc2ccc(-c3cccnc3)cc2)C1 ZINC001139640669 1046493504 /nfs/dbraw/zinc/49/35/04/1046493504.db2.gz YEEIOZRLLMCVTL-UHFFFAOYSA-N 1 2 302.368 4.370 20 0 DIADLO FC1(F)CCCC[N@@H+](Cc2ccc(-c3cccnc3)cc2)C1 ZINC001139640669 1046493507 /nfs/dbraw/zinc/49/35/07/1046493507.db2.gz YEEIOZRLLMCVTL-UHFFFAOYSA-N 1 2 302.368 4.370 20 0 DIADLO Cc1cc(NC(=O)[C@H]2C[C@H]2c2cccc3ccccc32)c(C)c[nH+]1 ZINC000536575311 1046496628 /nfs/dbraw/zinc/49/66/28/1046496628.db2.gz JRUUTOAQUQDGKS-OALUTQOASA-N 1 2 316.404 4.016 20 0 DIADLO Fc1cccc([C@H]2CC[N@@H+]2Cc2cnn(Cc3ccccc3)c2)c1 ZINC000677441208 1046496622 /nfs/dbraw/zinc/49/66/22/1046496622.db2.gz IXCDLTZVMMTPAP-HXUWFJFHSA-N 1 2 321.399 4.018 20 0 DIADLO Fc1cccc([C@H]2CC[N@H+]2Cc2cnn(Cc3ccccc3)c2)c1 ZINC000677441208 1046496624 /nfs/dbraw/zinc/49/66/24/1046496624.db2.gz IXCDLTZVMMTPAP-HXUWFJFHSA-N 1 2 321.399 4.018 20 0 DIADLO Clc1ccc2c(c1)CC[C@H]2[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000782191578 1046499508 /nfs/dbraw/zinc/49/95/08/1046499508.db2.gz XRAWNRVRLPTOBA-IAGOWNOFSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)CC[C@H]2[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000782191578 1046499510 /nfs/dbraw/zinc/49/95/10/1046499510.db2.gz XRAWNRVRLPTOBA-IAGOWNOFSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)CC[C@@H]2[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000782191579 1046499908 /nfs/dbraw/zinc/49/99/08/1046499908.db2.gz XRAWNRVRLPTOBA-IRXDYDNUSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)CC[C@@H]2[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000782191579 1046499920 /nfs/dbraw/zinc/49/99/20/1046499920.db2.gz XRAWNRVRLPTOBA-IRXDYDNUSA-N 1 2 319.857 4.462 20 0 DIADLO Cc1cc(C(=O)Nc2c(C)cc(C)[nH+]c2C)c2ccc(F)cc2n1 ZINC000097214111 1046500888 /nfs/dbraw/zinc/50/08/88/1046500888.db2.gz MBNJVBVHXIXCDG-UHFFFAOYSA-N 1 2 323.371 4.255 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nc(-c2cccc(C)c2)no1 ZINC000130269688 1046510064 /nfs/dbraw/zinc/51/00/64/1046510064.db2.gz QIWXCQQCGYMQFZ-KRWDZBQOSA-N 1 2 322.412 4.023 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nc(-c2cccc(C)c2)no1 ZINC000130269688 1046510072 /nfs/dbraw/zinc/51/00/72/1046510072.db2.gz QIWXCQQCGYMQFZ-KRWDZBQOSA-N 1 2 322.412 4.023 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@@H+]1Cc1ncc(C2CC2)o1 ZINC000677683672 1046511318 /nfs/dbraw/zinc/51/13/18/1046511318.db2.gz ORQYVJFKZHDYLA-MRXNPFEDSA-N 1 2 312.413 4.288 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1ncc(C2CC2)o1 ZINC000677683672 1046511330 /nfs/dbraw/zinc/51/13/30/1046511330.db2.gz ORQYVJFKZHDYLA-MRXNPFEDSA-N 1 2 312.413 4.288 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cccc(NCC(F)(F)F)c1 ZINC000641763681 1046512027 /nfs/dbraw/zinc/51/20/27/1046512027.db2.gz FLJYYDZZPTVUNT-UHFFFAOYSA-N 1 2 312.339 4.050 20 0 DIADLO CSc1ccc(C[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)o1 ZINC000641758044 1046512415 /nfs/dbraw/zinc/51/24/15/1046512415.db2.gz HDUOTBLJBWAOAT-NSHDSACASA-N 1 2 313.344 4.196 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@H](C)c1ccncc1)c1ccco1 ZINC000130729273 1046513512 /nfs/dbraw/zinc/51/35/12/1046513512.db2.gz UFEGSDBKVAJUCM-KUHUBIRLSA-N 1 2 308.381 4.123 20 0 DIADLO CC(C)(C)c1nc(C[NH+]2CC(Cc3ccccc3)C2)cs1 ZINC000677716924 1046516314 /nfs/dbraw/zinc/51/63/14/1046516314.db2.gz JJMSUNDQULZIQY-UHFFFAOYSA-N 1 2 300.471 4.115 20 0 DIADLO CCn1cc(Nc2ccc(Oc3cc[nH+]c(C)c3)cc2)ccc1=O ZINC001212915422 1046517974 /nfs/dbraw/zinc/51/79/74/1046517974.db2.gz HZFUQVCBZRPANU-UHFFFAOYSA-N 1 2 321.380 4.108 20 0 DIADLO CC(C)c1cc(N2CC(CC(F)(F)F)C2)nc(C(C)C)[nH+]1 ZINC000677746235 1046520663 /nfs/dbraw/zinc/52/06/63/1046520663.db2.gz TYKBGDQBVCVRKC-UHFFFAOYSA-N 1 2 301.356 4.112 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Cl)ncc2Br)[C@@H](C)C1 ZINC001139807187 1046520971 /nfs/dbraw/zinc/52/09/71/1046520971.db2.gz SXYQNZXCFJLAOB-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Cl)ncc2Br)[C@@H](C)C1 ZINC001139807187 1046520985 /nfs/dbraw/zinc/52/09/85/1046520985.db2.gz SXYQNZXCFJLAOB-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)s1 ZINC001139817238 1046524195 /nfs/dbraw/zinc/52/41/95/1046524195.db2.gz DGCZIJCPUOCRIU-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)s1 ZINC001139817238 1046524199 /nfs/dbraw/zinc/52/41/99/1046524199.db2.gz DGCZIJCPUOCRIU-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1ccc(F)cc1Br ZINC000049595650 1046524573 /nfs/dbraw/zinc/52/45/73/1046524573.db2.gz BJQIACKBUCZDFF-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1ccc(F)cc1Br ZINC000049595650 1046524588 /nfs/dbraw/zinc/52/45/88/1046524588.db2.gz BJQIACKBUCZDFF-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CCCc1nc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccnc2)cs1 ZINC000359873991 1046528139 /nfs/dbraw/zinc/52/81/39/1046528139.db2.gz MHKWAVUZNAYMLA-CJNGLKHVSA-N 1 2 301.459 4.074 20 0 DIADLO CCCc1nc(C[N@H+]2C[C@H](C)C[C@H]2c2cccnc2)cs1 ZINC000359873991 1046528146 /nfs/dbraw/zinc/52/81/46/1046528146.db2.gz MHKWAVUZNAYMLA-CJNGLKHVSA-N 1 2 301.459 4.074 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cc(Cl)nc2ccccc12 ZINC000782473667 1046528625 /nfs/dbraw/zinc/52/86/25/1046528625.db2.gz FHGZEKFWBWIITR-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cc(Cl)nc2ccccc12 ZINC000782473667 1046528633 /nfs/dbraw/zinc/52/86/33/1046528633.db2.gz FHGZEKFWBWIITR-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO Cc1c(Cl)nc(CC(C)C)nc1NCc1c[nH+]cn1C(C)C ZINC001161569396 1046528994 /nfs/dbraw/zinc/52/89/94/1046528994.db2.gz JMARHBRRLHNVAW-UHFFFAOYSA-N 1 2 321.856 4.026 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cc(Cl)nc2ccccc12 ZINC000782473662 1046529141 /nfs/dbraw/zinc/52/91/41/1046529141.db2.gz FHGZEKFWBWIITR-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cc(Cl)nc2ccccc12 ZINC000782473662 1046529152 /nfs/dbraw/zinc/52/91/52/1046529152.db2.gz FHGZEKFWBWIITR-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO Cn1ncc2c1C[N@H+](Cc1cccc3c4ccccc4sc31)C2 ZINC001139843798 1046531743 /nfs/dbraw/zinc/53/17/43/1046531743.db2.gz HTKNBWGMLWHMSV-UHFFFAOYSA-N 1 2 319.433 4.304 20 0 DIADLO Cn1ncc2c1C[N@@H+](Cc1cccc3c4ccccc4sc31)C2 ZINC001139843798 1046531750 /nfs/dbraw/zinc/53/17/50/1046531750.db2.gz HTKNBWGMLWHMSV-UHFFFAOYSA-N 1 2 319.433 4.304 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)cc1Cl ZINC000677891724 1046535114 /nfs/dbraw/zinc/53/51/14/1046535114.db2.gz DZACVYQULDRIRS-MRXNPFEDSA-N 1 2 305.780 4.435 20 0 DIADLO COc1ccc(C[N@H+]2CC[C@@H]2c2cccc(F)c2)cc1Cl ZINC000677891724 1046535125 /nfs/dbraw/zinc/53/51/25/1046535125.db2.gz DZACVYQULDRIRS-MRXNPFEDSA-N 1 2 305.780 4.435 20 0 DIADLO Cn1c(C[N@H+](C)Cc2ccc(F)cc2F)cc2ccccc21 ZINC001139872082 1046536251 /nfs/dbraw/zinc/53/62/51/1046536251.db2.gz DTDNQSCEGCLQPW-UHFFFAOYSA-N 1 2 300.352 4.089 20 0 DIADLO Cn1c(C[N@@H+](C)Cc2ccc(F)cc2F)cc2ccccc21 ZINC001139872082 1046536267 /nfs/dbraw/zinc/53/62/67/1046536267.db2.gz DTDNQSCEGCLQPW-UHFFFAOYSA-N 1 2 300.352 4.089 20 0 DIADLO Cn1c(C[N@H+](C)Cc2nc3ccccc3s2)cc2ccccc21 ZINC001139868704 1046536658 /nfs/dbraw/zinc/53/66/58/1046536658.db2.gz WKLIUTNKWSCVPA-UHFFFAOYSA-N 1 2 321.449 4.420 20 0 DIADLO Cn1c(C[N@@H+](C)Cc2nc3ccccc3s2)cc2ccccc21 ZINC001139868704 1046536670 /nfs/dbraw/zinc/53/66/70/1046536670.db2.gz WKLIUTNKWSCVPA-UHFFFAOYSA-N 1 2 321.449 4.420 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ncccc2C(F)(F)F)o1 ZINC000677964773 1046538165 /nfs/dbraw/zinc/53/81/65/1046538165.db2.gz PAEJQBYOFVUEJK-ZYHUDNBSSA-N 1 2 310.319 4.107 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cccc(O)c2)c(Br)c1 ZINC000536626491 1046538409 /nfs/dbraw/zinc/53/84/09/1046538409.db2.gz ZZTQCEODPPFMFU-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cccc(O)c2)c(Br)c1 ZINC000536626491 1046538420 /nfs/dbraw/zinc/53/84/20/1046538420.db2.gz ZZTQCEODPPFMFU-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO FC(F)(F)c1n[nH]c2c1CC[N@H+](Cc1cc3ccccc3[nH]1)C2 ZINC001137320986 1046546402 /nfs/dbraw/zinc/54/64/02/1046546402.db2.gz WIYPGEFJEUAYEE-HNNXBMFYSA-N 1 2 320.318 4.024 20 0 DIADLO FC(F)(F)c1n[nH]c2c1CC[N@@H+](Cc1cc3ccccc3[nH]1)C2 ZINC001137320986 1046546414 /nfs/dbraw/zinc/54/64/14/1046546414.db2.gz WIYPGEFJEUAYEE-HNNXBMFYSA-N 1 2 320.318 4.024 20 0 DIADLO CC[C@H](O)C[N@H+](Cc1csc(C(C)C)n1)Cc1ccccc1 ZINC000134491808 1046547580 /nfs/dbraw/zinc/54/75/80/1046547580.db2.gz WXCHVJBUXAGVEA-KRWDZBQOSA-N 1 2 318.486 4.040 20 0 DIADLO CC[C@H](O)C[N@@H+](Cc1csc(C(C)C)n1)Cc1ccccc1 ZINC000134491808 1046547594 /nfs/dbraw/zinc/54/75/94/1046547594.db2.gz WXCHVJBUXAGVEA-KRWDZBQOSA-N 1 2 318.486 4.040 20 0 DIADLO CCOCOc1ccc(CNc2ccc([NH+](C)C)c(C)c2)cc1 ZINC000782964829 1046548691 /nfs/dbraw/zinc/54/86/91/1046548691.db2.gz MSLJKWNZLPYXKS-UHFFFAOYSA-N 1 2 314.429 4.046 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2sc(Cl)nc2Cl)CCC1(F)F ZINC001139954278 1046556985 /nfs/dbraw/zinc/55/69/85/1046556985.db2.gz ZXMLBRRCFIJUFQ-ZETCQYMHSA-N 1 2 315.216 4.317 20 0 DIADLO CCO[C@H]1CCC[N@@H+](Cc2cc(Cl)c(OC)cc2Cl)C1 ZINC000678118338 1046556500 /nfs/dbraw/zinc/55/65/00/1046556500.db2.gz QLYCMKVPNTZXCK-LBPRGKRZSA-N 1 2 318.244 4.003 20 0 DIADLO CCO[C@H]1CCC[N@H+](Cc2cc(Cl)c(OC)cc2Cl)C1 ZINC000678118338 1046556485 /nfs/dbraw/zinc/55/64/85/1046556485.db2.gz QLYCMKVPNTZXCK-LBPRGKRZSA-N 1 2 318.244 4.003 20 0 DIADLO C[C@H]1CC[N@H+](Cc2sc(Cl)nc2Cl)CCC1(F)F ZINC001139954278 1046556976 /nfs/dbraw/zinc/55/69/76/1046556976.db2.gz ZXMLBRRCFIJUFQ-ZETCQYMHSA-N 1 2 315.216 4.317 20 0 DIADLO COc1c(Cl)cccc1C[NH2+][C@H](C)c1nc(C)sc1C ZINC000897482836 1046559587 /nfs/dbraw/zinc/55/95/87/1046559587.db2.gz GJYAAMJOPYDHMS-SECBINFHSA-N 1 2 310.850 4.273 20 0 DIADLO NC(Cc1cccc(F)c1)=[NH+]O[C@@H]1CCCc2ccc(F)cc21 ZINC000783148992 1046559574 /nfs/dbraw/zinc/55/95/74/1046559574.db2.gz MVWXSZLZBKFPAF-QGZVFWFLSA-N 1 2 316.351 4.083 20 0 DIADLO COC1CC[NH+](Cc2c(Cl)ccc(Cl)c2Cl)CC1 ZINC000678128539 1046559995 /nfs/dbraw/zinc/55/99/95/1046559995.db2.gz ZWRDDFMQPWRMSU-UHFFFAOYSA-N 1 2 308.636 4.258 20 0 DIADLO NC(Cc1cccc(F)c1)=[NH+]O[C@H]1CCCc2ccc(F)cc21 ZINC000783148987 1046559903 /nfs/dbraw/zinc/55/99/03/1046559903.db2.gz MVWXSZLZBKFPAF-KRWDZBQOSA-N 1 2 316.351 4.083 20 0 DIADLO Clc1nc(C[N@@H+]2CCC[C@@H](Cc3ccccc3)C2)cs1 ZINC001139977247 1046560145 /nfs/dbraw/zinc/56/01/45/1046560145.db2.gz ROOMVPLFWKEHJT-AWEZNQCLSA-N 1 2 306.862 4.251 20 0 DIADLO Clc1nc(C[N@H+]2CCC[C@@H](Cc3ccccc3)C2)cs1 ZINC001139977247 1046560160 /nfs/dbraw/zinc/56/01/60/1046560160.db2.gz ROOMVPLFWKEHJT-AWEZNQCLSA-N 1 2 306.862 4.251 20 0 DIADLO CC(C)Oc1cccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)c1 ZINC000783225915 1046563974 /nfs/dbraw/zinc/56/39/74/1046563974.db2.gz ZCPZSQLMHUTNMS-LJQANCHMSA-N 1 2 321.424 4.076 20 0 DIADLO CC(=O)Nc1nc2ccc(Nc3ccc(C)[nH+]c3C)cc2s1 ZINC001212937690 1046563987 /nfs/dbraw/zinc/56/39/87/1046563987.db2.gz RQRBESDUTJPRBG-UHFFFAOYSA-N 1 2 312.398 4.010 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cnc(C3CCC3)s2)C2CC2)o1 ZINC000678135156 1046564938 /nfs/dbraw/zinc/56/49/38/1046564938.db2.gz HIHZLFHNQRLCOL-UHFFFAOYSA-N 1 2 302.443 4.477 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cnc(C3CCC3)s2)C2CC2)o1 ZINC000678135156 1046564954 /nfs/dbraw/zinc/56/49/54/1046564954.db2.gz HIHZLFHNQRLCOL-UHFFFAOYSA-N 1 2 302.443 4.477 20 0 DIADLO C[N@H+](Cc1nc2ccccc2o1)Cc1cc2ccccc2cn1 ZINC001140001555 1046565424 /nfs/dbraw/zinc/56/54/24/1046565424.db2.gz RWBPUUVWNYKLCG-UHFFFAOYSA-N 1 2 303.365 4.008 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2o1)Cc1cc2ccccc2cn1 ZINC001140001555 1046565442 /nfs/dbraw/zinc/56/54/42/1046565442.db2.gz RWBPUUVWNYKLCG-UHFFFAOYSA-N 1 2 303.365 4.008 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cnc(C)n2-c2ccccc2)C2CC2)o1 ZINC000678135355 1046565794 /nfs/dbraw/zinc/56/57/94/1046565794.db2.gz MLYLYFORKCVGKQ-UHFFFAOYSA-N 1 2 321.424 4.247 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cnc(C)n2-c2ccccc2)C2CC2)o1 ZINC000678135355 1046565800 /nfs/dbraw/zinc/56/58/00/1046565800.db2.gz MLYLYFORKCVGKQ-UHFFFAOYSA-N 1 2 321.424 4.247 20 0 DIADLO CCC[N@H+](CCc1ccccn1)Cc1c(Cl)ccnc1Cl ZINC001139481140 1046570346 /nfs/dbraw/zinc/57/03/46/1046570346.db2.gz RFNDCPVEQOSQGC-UHFFFAOYSA-N 1 2 324.255 4.238 20 0 DIADLO CCC[N@@H+](CCc1ccccn1)Cc1c(Cl)ccnc1Cl ZINC001139481140 1046570361 /nfs/dbraw/zinc/57/03/61/1046570361.db2.gz RFNDCPVEQOSQGC-UHFFFAOYSA-N 1 2 324.255 4.238 20 0 DIADLO CN(CCO)c1ccc([NH2+][C@@H]2CC[C@](C)(c3ccccc3)C2)cc1 ZINC000783280088 1046573985 /nfs/dbraw/zinc/57/39/85/1046573985.db2.gz IXFIJSBXHDFBFV-CTNGQTDRSA-N 1 2 324.468 4.037 20 0 DIADLO Fc1ccc2c(c1)[nH]c1nc[nH+]c(NCCCC(F)(F)F)c21 ZINC000642197733 1046579380 /nfs/dbraw/zinc/57/93/80/1046579380.db2.gz TVSBQQNHZADGPK-UHFFFAOYSA-N 1 2 312.270 4.005 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1n[nH]c2ccc(OC)cc21 ZINC001140069371 1046581546 /nfs/dbraw/zinc/58/15/46/1046581546.db2.gz TZCFPNWGPLWNAT-FQEVSTJZSA-N 1 2 321.424 4.081 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1n[nH]c2ccc(OC)cc21 ZINC001140069371 1046581548 /nfs/dbraw/zinc/58/15/48/1046581548.db2.gz TZCFPNWGPLWNAT-FQEVSTJZSA-N 1 2 321.424 4.081 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cnc(Br)cc1Cl ZINC001140073556 1046582092 /nfs/dbraw/zinc/58/20/92/1046582092.db2.gz BIBIAXYJYFDCFY-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cnc(Br)cc1Cl ZINC001140073556 1046582104 /nfs/dbraw/zinc/58/21/04/1046582104.db2.gz BIBIAXYJYFDCFY-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(C(F)(F)F)ccn1 ZINC001140104364 1046588183 /nfs/dbraw/zinc/58/81/83/1046588183.db2.gz LZYPRDXBEJWKGZ-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc(C(F)(F)F)ccn1 ZINC001140104364 1046588198 /nfs/dbraw/zinc/58/81/98/1046588198.db2.gz LZYPRDXBEJWKGZ-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO CCCCCCOc1ccc(C[NH2+][C@H](C)c2nc(C)no2)cc1 ZINC000729684762 1046588491 /nfs/dbraw/zinc/58/84/91/1046588491.db2.gz VTQFFLAJOGIROK-CQSZACIVSA-N 1 2 317.433 4.188 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1c(F)cccc1N1CCCC1 ZINC000678234043 1046592553 /nfs/dbraw/zinc/59/25/53/1046592553.db2.gz PXQREFJNUCSJDG-UHFFFAOYSA-N 1 2 302.393 4.041 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1c(F)cccc1N1CCCC1 ZINC000678234043 1046592563 /nfs/dbraw/zinc/59/25/63/1046592563.db2.gz PXQREFJNUCSJDG-UHFFFAOYSA-N 1 2 302.393 4.041 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1cc(OC)ccc1Br ZINC000678233666 1046593443 /nfs/dbraw/zinc/59/34/43/1046593443.db2.gz PJVNQZATDOUBSW-UHFFFAOYSA-N 1 2 324.218 4.073 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1cc(OC)ccc1Br ZINC000678233666 1046593455 /nfs/dbraw/zinc/59/34/55/1046593455.db2.gz PJVNQZATDOUBSW-UHFFFAOYSA-N 1 2 324.218 4.073 20 0 DIADLO C[C@@H](Nc1cc[nH+]c2c(Br)cccc12)c1ccc[nH]1 ZINC000760275434 1046593930 /nfs/dbraw/zinc/59/39/30/1046593930.db2.gz YPXPZHKEXXBPNN-SNVBAGLBSA-N 1 2 316.202 4.499 20 0 DIADLO COc1ccc(Br)c(C[N@H+](C)[C@H](C)c2ccco2)c1 ZINC000536638588 1046598638 /nfs/dbraw/zinc/59/86/38/1046598638.db2.gz TVXIKKUMJVZZOR-LLVKDONJSA-N 1 2 324.218 4.244 20 0 DIADLO COc1ccc(Br)c(C[N@@H+](C)[C@H](C)c2ccco2)c1 ZINC000536638588 1046598651 /nfs/dbraw/zinc/59/86/51/1046598651.db2.gz TVXIKKUMJVZZOR-LLVKDONJSA-N 1 2 324.218 4.244 20 0 DIADLO CCCc1ccc(C[NH2+][C@H](c2nccn2C)c2ccccc2)cc1 ZINC000642339778 1046599020 /nfs/dbraw/zinc/59/90/20/1046599020.db2.gz RWTLMALIBSWMGR-FQEVSTJZSA-N 1 2 319.452 4.252 20 0 DIADLO COc1ccc(OC)c(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)c1 ZINC000536637875 1046602021 /nfs/dbraw/zinc/60/20/21/1046602021.db2.gz YTKYHIVRPAIDLZ-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc(OC)c(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)c1 ZINC000536637875 1046602022 /nfs/dbraw/zinc/60/20/22/1046602022.db2.gz YTKYHIVRPAIDLZ-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2)cs1 ZINC000245458800 1046605367 /nfs/dbraw/zinc/60/53/67/1046605367.db2.gz DCYXOZPORMXAPB-KBPBESRZSA-N 1 2 304.459 4.352 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2)cs1 ZINC000245458800 1046605374 /nfs/dbraw/zinc/60/53/74/1046605374.db2.gz DCYXOZPORMXAPB-KBPBESRZSA-N 1 2 304.459 4.352 20 0 DIADLO Fc1cccc([C@@H]2CC[N@@H+]2Cc2cnc(C3CCC3)s2)c1 ZINC000678283647 1046610615 /nfs/dbraw/zinc/61/06/15/1046610615.db2.gz PPNBXEOWYMUMPV-INIZCTEOSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1cccc([C@@H]2CC[N@H+]2Cc2cnc(C3CCC3)s2)c1 ZINC000678283647 1046610620 /nfs/dbraw/zinc/61/06/20/1046610620.db2.gz PPNBXEOWYMUMPV-INIZCTEOSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1cccc([C@H]2CC[N@@H+]2Cc2cnc(C3CCC3)s2)c1 ZINC000678283648 1046611324 /nfs/dbraw/zinc/61/13/24/1046611324.db2.gz PPNBXEOWYMUMPV-MRXNPFEDSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1cccc([C@H]2CC[N@H+]2Cc2cnc(C3CCC3)s2)c1 ZINC000678283648 1046611336 /nfs/dbraw/zinc/61/13/36/1046611336.db2.gz PPNBXEOWYMUMPV-MRXNPFEDSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1cccc([C@H]2CC[N@@H+]2Cc2cc(-c3ccccc3)n[nH]2)c1 ZINC000678283237 1046611948 /nfs/dbraw/zinc/61/19/48/1046611948.db2.gz GBWQKUNOKLGCSM-LJQANCHMSA-N 1 2 307.372 4.163 20 0 DIADLO Fc1cccc([C@H]2CC[N@H+]2Cc2cc(-c3ccccc3)n[nH]2)c1 ZINC000678283237 1046611956 /nfs/dbraw/zinc/61/19/56/1046611956.db2.gz GBWQKUNOKLGCSM-LJQANCHMSA-N 1 2 307.372 4.163 20 0 DIADLO CCCCOc1ccc(C[N@@H+]2CCO[C@H](c3ccco3)C2)cc1 ZINC000678294939 1046616167 /nfs/dbraw/zinc/61/61/67/1046616167.db2.gz SHXWAIMIJSTMOJ-IBGZPJMESA-N 1 2 315.413 4.032 20 0 DIADLO CCCCOc1ccc(C[N@H+]2CCO[C@H](c3ccco3)C2)cc1 ZINC000678294939 1046616173 /nfs/dbraw/zinc/61/61/73/1046616173.db2.gz SHXWAIMIJSTMOJ-IBGZPJMESA-N 1 2 315.413 4.032 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2n[nH]c3ccccc32)s1 ZINC000678314638 1046618016 /nfs/dbraw/zinc/61/80/16/1046618016.db2.gz MZELKHGJVPFSLQ-GFCCVEGCSA-N 1 2 314.458 4.083 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2n[nH]c3ccccc32)s1 ZINC000678314638 1046618022 /nfs/dbraw/zinc/61/80/22/1046618022.db2.gz MZELKHGJVPFSLQ-GFCCVEGCSA-N 1 2 314.458 4.083 20 0 DIADLO C[C@H](CCC1CCCCC1)Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000514693565 1046621828 /nfs/dbraw/zinc/62/18/28/1046621828.db2.gz RBRHGRSMFRBOEV-MRXNPFEDSA-N 1 2 312.461 4.487 20 0 DIADLO COc1ccc(Nc2cc[nH+]c(SC)c2)cc1OC(C)C ZINC001203017562 1046624843 /nfs/dbraw/zinc/62/48/43/1046624843.db2.gz HISHLQXPFZKZBX-UHFFFAOYSA-N 1 2 304.415 4.343 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cc3cccc(OC)c3o2)s1 ZINC000093807537 1046636542 /nfs/dbraw/zinc/63/65/42/1046636542.db2.gz LXAAFTJTCYKGLK-UHFFFAOYSA-N 1 2 316.426 4.092 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cc3cccc(OC)c3o2)s1 ZINC000093807537 1046636549 /nfs/dbraw/zinc/63/65/49/1046636549.db2.gz LXAAFTJTCYKGLK-UHFFFAOYSA-N 1 2 316.426 4.092 20 0 DIADLO C[N@H+](Cc1ccno1)Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC001140297351 1046645181 /nfs/dbraw/zinc/64/51/81/1046645181.db2.gz ZFCYRBRRFXKLQX-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO C[N@@H+](Cc1ccno1)Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC001140297351 1046645184 /nfs/dbraw/zinc/64/51/84/1046645184.db2.gz ZFCYRBRRFXKLQX-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO CC[C@H](C)CCCCC(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000783943037 1046647886 /nfs/dbraw/zinc/64/78/86/1046647886.db2.gz YKSWHDGJUWMVDJ-INIZCTEOSA-N 1 2 313.445 4.095 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3ccc(C4CC4)cc3)ccc2[nH+]1 ZINC000678531831 1046651948 /nfs/dbraw/zinc/65/19/48/1046651948.db2.gz MHTCHOVJQNHJEV-UHFFFAOYSA-N 1 2 306.369 4.164 20 0 DIADLO O=C(Nc1ccc(C2CC2)cc1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000678540636 1046654067 /nfs/dbraw/zinc/65/40/67/1046654067.db2.gz OHUGTESYEJKDMI-UHFFFAOYSA-N 1 2 303.365 4.002 20 0 DIADLO Clc1cccc(Cl)c1C1CC[NH+](Cc2ccncn2)CC1 ZINC001140347049 1046668136 /nfs/dbraw/zinc/66/81/36/1046668136.db2.gz WWDLFZPJUIIQIB-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO O=C(Nc1cccc(C2CCC2)c1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000643511093 1046669324 /nfs/dbraw/zinc/66/93/24/1046669324.db2.gz GTJCQVBSLPKZHB-GOSISDBHSA-N 1 2 324.428 4.020 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)c(C)s1 ZINC000678597946 1046670654 /nfs/dbraw/zinc/67/06/54/1046670654.db2.gz NFKNNVYKRRBOIF-OQPBUACISA-N 1 2 308.834 4.198 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nnc(-c3ccccc3)s2)c(C)n1 ZINC000678597931 1046670877 /nfs/dbraw/zinc/67/08/77/1046670877.db2.gz MWICNLMVYAIBPU-ZDUSSCGKSA-N 1 2 324.453 4.068 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@@H]2CCn3ccnc32)c2cccc(F)c2)c1 ZINC000834830930 1046678347 /nfs/dbraw/zinc/67/83/47/1046678347.db2.gz HJHMHFHPAZZQQE-RTBURBONSA-N 1 2 321.399 4.155 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2c1cccc2Cl)c1cccc(F)c1F ZINC000678609982 1046678697 /nfs/dbraw/zinc/67/86/97/1046678697.db2.gz BMPYMWHJBOEZKX-OTYXRUKQSA-N 1 2 309.743 4.403 20 0 DIADLO CC[C@H]([NH2+][C@@H]1CCn2ccnc21)c1ccc(Cl)cc1Cl ZINC000834835707 1046680213 /nfs/dbraw/zinc/68/02/13/1046680213.db2.gz IPQSSTALYOKRJF-UONOGXRCSA-N 1 2 310.228 4.376 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+](Cc1ccc(F)cc1)C1CC1 ZINC000533255679 1046681267 /nfs/dbraw/zinc/68/12/67/1046681267.db2.gz KZOFXXVJIYJDBV-UHFFFAOYSA-N 1 2 323.415 4.360 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000533255679 1046681273 /nfs/dbraw/zinc/68/12/73/1046681273.db2.gz KZOFXXVJIYJDBV-UHFFFAOYSA-N 1 2 323.415 4.360 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)c(Br)c1 ZINC000533263737 1046684471 /nfs/dbraw/zinc/68/44/71/1046684471.db2.gz XCFOHBSHZDNZOH-HNNXBMFYSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c(Br)c1 ZINC000533263737 1046684479 /nfs/dbraw/zinc/68/44/79/1046684479.db2.gz XCFOHBSHZDNZOH-HNNXBMFYSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1c(Cl)cccc1Nc1ccccc1C[NH+]1CCOCC1 ZINC001203033617 1046693216 /nfs/dbraw/zinc/69/32/16/1046693216.db2.gz IQWUQTUXTBYCNY-UHFFFAOYSA-N 1 2 320.795 4.055 20 0 DIADLO Cl/C=C/C[N@@H+]1CCC[C@@H]1c1ccc(Br)s1 ZINC000784525421 1046695079 /nfs/dbraw/zinc/69/50/79/1046695079.db2.gz DRFVCNWARWOKSR-YUWISIADSA-N 1 2 306.656 4.400 20 0 DIADLO Cl/C=C/C[N@H+]1CCC[C@@H]1c1ccc(Br)s1 ZINC000784525421 1046695083 /nfs/dbraw/zinc/69/50/83/1046695083.db2.gz DRFVCNWARWOKSR-YUWISIADSA-N 1 2 306.656 4.400 20 0 DIADLO CCc1noc(C[NH2+][C@H](c2oc3ccccc3c2C)C(C)C)n1 ZINC000678772688 1046698223 /nfs/dbraw/zinc/69/82/23/1046698223.db2.gz DNISRSBNCBORSQ-KRWDZBQOSA-N 1 2 313.401 4.174 20 0 DIADLO Fc1c(Cl)cccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001203033907 1046698702 /nfs/dbraw/zinc/69/87/02/1046698702.db2.gz TXSFVJXFKNWYDF-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO CCc1nc(C[NH2+][C@@H](c2ccccc2F)C2CCCC2)co1 ZINC000834899154 1046708723 /nfs/dbraw/zinc/70/87/23/1046708723.db2.gz OWZSMHDQRHUDQA-GOSISDBHSA-N 1 2 302.393 4.397 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CCCOc3c(C(C)C)cccc32)co1 ZINC000834896921 1046709740 /nfs/dbraw/zinc/70/97/40/1046709740.db2.gz DMJZHVBJBKPTMG-KRWDZBQOSA-N 1 2 314.429 4.364 20 0 DIADLO Fc1cccc(-c2ncc(C[N@@H+]3CCc4occc4C3)s2)c1 ZINC001140421273 1046710269 /nfs/dbraw/zinc/71/02/69/1046710269.db2.gz SFVIMDXMQCKSJQ-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1cccc(-c2ncc(C[N@H+]3CCc4occc4C3)s2)c1 ZINC001140421273 1046710282 /nfs/dbraw/zinc/71/02/82/1046710282.db2.gz SFVIMDXMQCKSJQ-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1cc(C2CC2)ccc1C[NH2+]Cc1nc2c(s1)CCCC2 ZINC000644406556 1046712196 /nfs/dbraw/zinc/71/21/96/1046712196.db2.gz HBAVBHPRRJOXDL-UHFFFAOYSA-N 1 2 316.445 4.328 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2c[nH]c3cccc(Cl)c23)no1 ZINC001140433049 1046719774 /nfs/dbraw/zinc/71/97/74/1046719774.db2.gz OASKRVAKAVXHIE-INIZCTEOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2c[nH]c3cccc(Cl)c23)no1 ZINC001140433049 1046719786 /nfs/dbraw/zinc/71/97/86/1046719786.db2.gz OASKRVAKAVXHIE-INIZCTEOSA-N 1 2 315.804 4.455 20 0 DIADLO COC[C@H]1CCCC[N@@H+]1Cc1c(Cl)ccc(F)c1Cl ZINC001137353558 1046720934 /nfs/dbraw/zinc/72/09/34/1046720934.db2.gz QTPUIZQVZYPQBY-SNVBAGLBSA-N 1 2 306.208 4.133 20 0 DIADLO COC[C@H]1CCCC[N@H+]1Cc1c(Cl)ccc(F)c1Cl ZINC001137353558 1046720945 /nfs/dbraw/zinc/72/09/45/1046720945.db2.gz QTPUIZQVZYPQBY-SNVBAGLBSA-N 1 2 306.208 4.133 20 0 DIADLO FC(F)(F)c1ccc(Cl)c(C[N@@H+]2CCC[C@]3(CCO3)C2)c1 ZINC001138085425 1046723903 /nfs/dbraw/zinc/72/39/03/1046723903.db2.gz DULFHCRUNYTATD-AWEZNQCLSA-N 1 2 319.754 4.114 20 0 DIADLO FC(F)(F)c1ccc(Cl)c(C[N@H+]2CCC[C@]3(CCO3)C2)c1 ZINC001138085425 1046723915 /nfs/dbraw/zinc/72/39/15/1046723915.db2.gz DULFHCRUNYTATD-AWEZNQCLSA-N 1 2 319.754 4.114 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC[C@@]3(C2)CCCCO3)c1Cl ZINC001137354433 1046725992 /nfs/dbraw/zinc/72/59/92/1046725992.db2.gz CYCOJPZHRQZJIS-OAHLLOKOSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC[C@@]3(C2)CCCCO3)c1Cl ZINC001137354433 1046726007 /nfs/dbraw/zinc/72/60/07/1046726007.db2.gz CYCOJPZHRQZJIS-OAHLLOKOSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC[C@@H]3CCCO[C@@H]3C2)c1Cl ZINC001137354809 1046730468 /nfs/dbraw/zinc/73/04/68/1046730468.db2.gz RPNXOJGEDCZNDI-IINYFYTJSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC[C@@H]3CCCO[C@@H]3C2)c1Cl ZINC001137354809 1046730479 /nfs/dbraw/zinc/73/04/79/1046730479.db2.gz RPNXOJGEDCZNDI-IINYFYTJSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1ccccc1-c1nccs1)C2 ZINC001140454091 1046731170 /nfs/dbraw/zinc/73/11/70/1046731170.db2.gz VCCPGIGAQJFFCC-UHFFFAOYSA-N 1 2 310.397 4.465 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1ccccc1-c1nccs1)C2 ZINC001140454091 1046731184 /nfs/dbraw/zinc/73/11/84/1046731184.db2.gz VCCPGIGAQJFFCC-UHFFFAOYSA-N 1 2 310.397 4.465 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccc1C(F)(F)F)c1cccc(F)c1F ZINC000678938394 1046738272 /nfs/dbraw/zinc/73/82/72/1046738272.db2.gz DMEUSSVKHGKRJF-SECBINFHSA-N 1 2 316.273 4.229 20 0 DIADLO CC(C)(C)C[C@@H]([NH2+]Cc1csnn1)c1ccc(Cl)cc1 ZINC000678936509 1046739555 /nfs/dbraw/zinc/73/95/55/1046739555.db2.gz MUORWWFWFSEIQI-CQSZACIVSA-N 1 2 309.866 4.459 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2nc3c(s2)CCCC3)o1 ZINC000678945147 1046740954 /nfs/dbraw/zinc/74/09/54/1046740954.db2.gz CMQSTIASXKTBAI-DGCLKSJQSA-N 1 2 302.443 4.028 20 0 DIADLO COc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1 ZINC001140481753 1046742806 /nfs/dbraw/zinc/74/28/06/1046742806.db2.gz DAUBJEANJBSMTJ-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)cc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1 ZINC001140481753 1046742821 /nfs/dbraw/zinc/74/28/21/1046742821.db2.gz DAUBJEANJBSMTJ-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO CCOCC1CC[NH+](Cc2c(Cl)ccc(F)c2Cl)CC1 ZINC001137358390 1046746799 /nfs/dbraw/zinc/74/67/99/1046746799.db2.gz LIVSFUKLCICRLI-UHFFFAOYSA-N 1 2 320.235 4.381 20 0 DIADLO CCCc1ccc([C@@H]([NH2+]Cc2noc(CC)n2)C(C)C)cc1 ZINC000533547805 1046751403 /nfs/dbraw/zinc/75/14/03/1046751403.db2.gz CPAJNKZKYYPFRO-SFHVURJKSA-N 1 2 301.434 4.071 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc([NH+](C)C)cc2)c(C)c1OC ZINC000796901506 1046755670 /nfs/dbraw/zinc/75/56/70/1046755670.db2.gz YIOQTTQJGHUIAY-CQSZACIVSA-N 1 2 314.429 4.251 20 0 DIADLO CC(C)[C@@H]1CC[C@H]1[NH2+]c1ccc(N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000796916812 1046759128 /nfs/dbraw/zinc/75/91/28/1046759128.db2.gz IGDSNQHDZRHJEN-QGWWYQLQSA-N 1 2 302.462 4.147 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1ccnn1-c1ccccc1)CC2 ZINC001140524345 1046764067 /nfs/dbraw/zinc/76/40/67/1046764067.db2.gz GHKJHSCXYZNXDT-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1ccnn1-c1ccccc1)CC2 ZINC001140524345 1046764085 /nfs/dbraw/zinc/76/40/85/1046764085.db2.gz GHKJHSCXYZNXDT-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Oc1cccc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)c1Cl ZINC000645155161 1046769471 /nfs/dbraw/zinc/76/94/71/1046769471.db2.gz GFSOWPWCRAWGKX-UHFFFAOYSA-N 1 2 308.208 4.478 20 0 DIADLO Oc1cccc(C[NH2+]Cc2ccccc2OC2CCC2)c1Cl ZINC000645156582 1046769950 /nfs/dbraw/zinc/76/99/50/1046769950.db2.gz QHFSTTWTIHCJQS-UHFFFAOYSA-N 1 2 317.816 4.267 20 0 DIADLO Cc1cc(Cl)cc(C[NH2+]Cc2c(F)c(F)cc(F)c2F)c1 ZINC000645161075 1046772029 /nfs/dbraw/zinc/77/20/29/1046772029.db2.gz KWDPLBWNFZYRAQ-UHFFFAOYSA-N 1 2 317.713 4.495 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1cccc(O)c1Cl ZINC000645170978 1046773115 /nfs/dbraw/zinc/77/31/15/1046773115.db2.gz QKRVHJWGCWHNDA-UHFFFAOYSA-N 1 2 306.793 4.230 20 0 DIADLO Cc1cc(Cl)cc(C[NH2+][C@@H]2COc3cc(F)cc(F)c32)c1 ZINC000645171712 1046775428 /nfs/dbraw/zinc/77/54/28/1046775428.db2.gz BNNPKSANNBTEBN-CQSZACIVSA-N 1 2 309.743 4.150 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)CCC2CCCCC2)c(C)[nH+]1 ZINC000455490169 1046775406 /nfs/dbraw/zinc/77/54/06/1046775406.db2.gz WHQQWRBBKMQQQD-UHFFFAOYSA-N 1 2 303.450 4.441 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)c(C)[nH+]1 ZINC000455490754 1046775649 /nfs/dbraw/zinc/77/56/49/1046775649.db2.gz XQDZDZPOEGMDSC-MAUKXSAKSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1ccccc1C[N@@H+](C)Cc1cccc(O)c1Br ZINC001140548896 1046776450 /nfs/dbraw/zinc/77/64/50/1046776450.db2.gz XKFJPRXVRJRGJU-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1ccccc1C[N@H+](C)Cc1cccc(O)c1Br ZINC001140548896 1046776458 /nfs/dbraw/zinc/77/64/58/1046776458.db2.gz XKFJPRXVRJRGJU-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC[C@H](C[C@H]3CCOC3)C2)c1 ZINC000645205265 1046778752 /nfs/dbraw/zinc/77/87/52/1046778752.db2.gz DHOVBVNKVDJGTQ-HUUCEWRRSA-N 1 2 314.404 4.017 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC(C)(C)[C@@H]3CCC[C@@H]32)c(C)[nH+]1 ZINC000455513578 1046779505 /nfs/dbraw/zinc/77/95/05/1046779505.db2.gz JCHFVQHHYCVOPR-CABCVRRESA-N 1 2 301.434 4.049 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC(C)(C)[C@H]3CCC[C@H]32)c(C)[nH+]1 ZINC000455513581 1046779943 /nfs/dbraw/zinc/77/99/43/1046779943.db2.gz JCHFVQHHYCVOPR-LSDHHAIUSA-N 1 2 301.434 4.049 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC(C)(C(C)C)CC2)c(C)[nH+]1 ZINC000455536473 1046781769 /nfs/dbraw/zinc/78/17/69/1046781769.db2.gz WEEIBYRKXFNKGC-UHFFFAOYSA-N 1 2 303.450 4.297 20 0 DIADLO Cc1cc(C)c(NC(=O)NC(C)(C)c2ccccc2F)c(C)[nH+]1 ZINC000455529641 1046782495 /nfs/dbraw/zinc/78/24/95/1046782495.db2.gz RIYPXCRLTGKYHV-UHFFFAOYSA-N 1 2 315.392 4.203 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC3(CCC3)c3ccccc32)c(C)[nH+]1 ZINC000455539880 1046784226 /nfs/dbraw/zinc/78/42/26/1046784226.db2.gz YKSLMZPBWVLWTR-UHFFFAOYSA-N 1 2 321.424 4.481 20 0 DIADLO C[C@H]1CC2(CN1c1cc[nH+]c3c(Cl)cccc13)CCOCC2 ZINC000645383940 1046787622 /nfs/dbraw/zinc/78/76/22/1046787622.db2.gz AIJCMQKSBJDLSV-ZDUSSCGKSA-N 1 2 316.832 4.284 20 0 DIADLO Cc1cc(C)c(CNC(=O)N2CCC[C@H]2c2ccccc2C)c[nH+]1 ZINC000455552714 1046791257 /nfs/dbraw/zinc/79/12/57/1046791257.db2.gz GWNFPVKQFMOEEF-IBGZPJMESA-N 1 2 323.440 4.054 20 0 DIADLO Cc1cc(NC(=O)[C@H]2C[C@H]2c2ccccc2C(F)(F)F)cc[nH+]1 ZINC000073409134 1046800413 /nfs/dbraw/zinc/80/04/13/1046800413.db2.gz OZOUYRSSNOUDDD-KBPBESRZSA-N 1 2 320.314 4.151 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)ncc2F)c1 ZINC001140610944 1046807956 /nfs/dbraw/zinc/80/79/56/1046807956.db2.gz PSWYJXJRYXQZNI-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2cc(Cl)ncc2F)c1 ZINC001140610944 1046807969 /nfs/dbraw/zinc/80/79/69/1046807969.db2.gz PSWYJXJRYXQZNI-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cc(Cl)ncc1F ZINC001140609241 1046809650 /nfs/dbraw/zinc/80/96/50/1046809650.db2.gz QLKDHXCRTKDLRI-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(Cl)ncc1F ZINC001140609241 1046809665 /nfs/dbraw/zinc/80/96/65/1046809665.db2.gz QLKDHXCRTKDLRI-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(s1)CCC2)c1ccc(F)cc1Cl ZINC000093075904 1046814667 /nfs/dbraw/zinc/81/46/67/1046814667.db2.gz OUOLUTXFACBDJX-SECBINFHSA-N 1 2 310.825 4.275 20 0 DIADLO CCc1cc(C)cc(CC)c1NC(=O)c1cccc2[nH+]ccn21 ZINC000797359924 1046826587 /nfs/dbraw/zinc/82/65/87/1046826587.db2.gz DDIZATAVQKVQMY-UHFFFAOYSA-N 1 2 307.397 4.020 20 0 DIADLO COCC[C@@H]([NH2+][C@@H](C)c1nc(C)sc1C)c1ccc(C)o1 ZINC000679359919 1046827943 /nfs/dbraw/zinc/82/79/43/1046827943.db2.gz GDJKAIFGPSUWLX-SMDDNHRTSA-N 1 2 308.447 4.090 20 0 DIADLO CC(C)c1nc(C[N@H+](C)Cc2cccc3ccncc32)cs1 ZINC001140644310 1046832381 /nfs/dbraw/zinc/83/23/81/1046832381.db2.gz IFRYZTLRUJISLJ-UHFFFAOYSA-N 1 2 311.454 4.447 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)Cc2cccc3ccncc32)cs1 ZINC001140644310 1046832411 /nfs/dbraw/zinc/83/24/11/1046832411.db2.gz IFRYZTLRUJISLJ-UHFFFAOYSA-N 1 2 311.454 4.447 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2nc3ccccc3s2)cc1F ZINC000247874500 1046834188 /nfs/dbraw/zinc/83/41/88/1046834188.db2.gz GKYMZZCHTVOCDC-UHFFFAOYSA-N 1 2 316.401 4.076 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2nc3ccccc3s2)cc1F ZINC000247874500 1046834202 /nfs/dbraw/zinc/83/42/02/1046834202.db2.gz GKYMZZCHTVOCDC-UHFFFAOYSA-N 1 2 316.401 4.076 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2Cl)C[N@@H+]1Cc1ccc(O)cc1 ZINC000679391920 1046834538 /nfs/dbraw/zinc/83/45/38/1046834538.db2.gz BYKLUUAFIMJHSI-SCLBCKFNSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2Cl)C[N@H+]1Cc1ccc(O)cc1 ZINC000679391920 1046834560 /nfs/dbraw/zinc/83/45/60/1046834560.db2.gz BYKLUUAFIMJHSI-SCLBCKFNSA-N 1 2 317.816 4.008 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2ncc(Cl)cc2Cl)CC1 ZINC000645980773 1046838255 /nfs/dbraw/zinc/83/82/55/1046838255.db2.gz JPZSIAMDCWYNJK-UHFFFAOYSA-N 1 2 307.224 4.476 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2nc3ccccc3s2)CC1 ZINC000645999344 1046841599 /nfs/dbraw/zinc/84/15/99/1046841599.db2.gz UCQWDXRPCHAMMK-UHFFFAOYSA-N 1 2 310.422 4.084 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nnc(-c3ccccc3)o2)[C@H](c2ccco2)C1 ZINC000076184250 1046843812 /nfs/dbraw/zinc/84/38/12/1046843812.db2.gz ZGJBBDCYLIUSMV-HOCLYGCPSA-N 1 2 323.396 4.303 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccccc3)o2)[C@H](c2ccco2)C1 ZINC000076184250 1046843829 /nfs/dbraw/zinc/84/38/29/1046843829.db2.gz ZGJBBDCYLIUSMV-HOCLYGCPSA-N 1 2 323.396 4.303 20 0 DIADLO CC1=C(Br)C[N@H+](Cc2cccc(C(F)F)c2)CC1 ZINC000797529355 1046844134 /nfs/dbraw/zinc/84/41/34/1046844134.db2.gz RGWOHPKPRHCPRH-UHFFFAOYSA-N 1 2 316.189 4.499 20 0 DIADLO CC1=C(Br)C[N@@H+](Cc2cccc(C(F)F)c2)CC1 ZINC000797529355 1046844149 /nfs/dbraw/zinc/84/41/49/1046844149.db2.gz RGWOHPKPRHCPRH-UHFFFAOYSA-N 1 2 316.189 4.499 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2nc(C)c(C)o2)o1 ZINC000076145157 1046844621 /nfs/dbraw/zinc/84/46/21/1046844621.db2.gz QEZHNPOKZBFHJI-BLLLJJGKSA-N 1 2 302.418 4.420 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2nc(C)c(C)o2)o1 ZINC000076145157 1046844644 /nfs/dbraw/zinc/84/46/44/1046844644.db2.gz QEZHNPOKZBFHJI-BLLLJJGKSA-N 1 2 302.418 4.420 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3c4ccccc4oc3C2)c(C)c1 ZINC001140677445 1046844893 /nfs/dbraw/zinc/84/48/93/1046844893.db2.gz OAIDCWSQUAMRCE-UHFFFAOYSA-N 1 2 307.393 4.308 20 0 DIADLO COc1ccc(C[N@H+]2CCc3c4ccccc4oc3C2)c(C)c1 ZINC001140677445 1046844910 /nfs/dbraw/zinc/84/49/10/1046844910.db2.gz OAIDCWSQUAMRCE-UHFFFAOYSA-N 1 2 307.393 4.308 20 0 DIADLO FC(F)Oc1cccc(Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001212060683 1046858949 /nfs/dbraw/zinc/85/89/49/1046858949.db2.gz FTWRONQALZEINO-UHFFFAOYSA-N 1 2 301.296 4.217 20 0 DIADLO CCc1noc([C@H](C)[N@@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)n1 ZINC000646117415 1046859752 /nfs/dbraw/zinc/85/97/52/1046859752.db2.gz ZDPSRRGYWTVJMJ-YOEHRIQHSA-N 1 2 309.413 4.086 20 0 DIADLO CCc1noc([C@H](C)[N@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)n1 ZINC000646117415 1046859772 /nfs/dbraw/zinc/85/97/72/1046859772.db2.gz ZDPSRRGYWTVJMJ-YOEHRIQHSA-N 1 2 309.413 4.086 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1csc(C2CC2)n1 ZINC000679540839 1046861694 /nfs/dbraw/zinc/86/16/94/1046861694.db2.gz HFCKKRDWYVMPNC-GXSJLCMTSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1csc(C2CC2)n1 ZINC000679540839 1046861713 /nfs/dbraw/zinc/86/17/13/1046861713.db2.gz HFCKKRDWYVMPNC-GXSJLCMTSA-N 1 2 304.381 4.183 20 0 DIADLO C1=CCC2(C[N@@H+](Cc3noc4c3CCCC4)[C@@H]2c2ccccc2)C1 ZINC000646117176 1046861759 /nfs/dbraw/zinc/86/17/59/1046861759.db2.gz ROGYJGAISJHMQR-HXUWFJFHSA-N 1 2 320.436 4.447 20 0 DIADLO C1=CCC2(C[N@H+](Cc3noc4c3CCCC4)[C@@H]2c2ccccc2)C1 ZINC000646117176 1046861779 /nfs/dbraw/zinc/86/17/79/1046861779.db2.gz ROGYJGAISJHMQR-HXUWFJFHSA-N 1 2 320.436 4.447 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2cc(F)c(Cl)cc2F)c1 ZINC001140701639 1046864546 /nfs/dbraw/zinc/86/45/46/1046864546.db2.gz UQJIQBALNMNAAC-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2cc(F)c(Cl)cc2F)c1 ZINC001140701639 1046864571 /nfs/dbraw/zinc/86/45/71/1046864571.db2.gz UQJIQBALNMNAAC-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)CCc2ccccc2F)cs1 ZINC000076729293 1046866240 /nfs/dbraw/zinc/86/62/40/1046866240.db2.gz JIZYOLWNMAOPBM-CYBMUJFWSA-N 1 2 322.449 4.054 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)CCc2ccccc2F)cs1 ZINC000076729293 1046866260 /nfs/dbraw/zinc/86/62/60/1046866260.db2.gz JIZYOLWNMAOPBM-CYBMUJFWSA-N 1 2 322.449 4.054 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000679546302 1046867005 /nfs/dbraw/zinc/86/70/05/1046867005.db2.gz OOHYZROFSLAGAN-QWRGUYRKSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000679546302 1046867021 /nfs/dbraw/zinc/86/70/21/1046867021.db2.gz OOHYZROFSLAGAN-QWRGUYRKSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000679547999 1046868258 /nfs/dbraw/zinc/86/82/58/1046868258.db2.gz SUZGCTGHIIVHOY-VXGBXAGGSA-N 1 2 324.346 4.013 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000679547999 1046868273 /nfs/dbraw/zinc/86/82/73/1046868273.db2.gz SUZGCTGHIIVHOY-VXGBXAGGSA-N 1 2 324.346 4.013 20 0 DIADLO CCCc1nc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)cs1 ZINC000679545029 1046868307 /nfs/dbraw/zinc/86/83/07/1046868307.db2.gz UWVFQEVLQMFVBE-MNOVXSKESA-N 1 2 306.397 4.258 20 0 DIADLO CCCc1nc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)cs1 ZINC000679545029 1046868314 /nfs/dbraw/zinc/86/83/14/1046868314.db2.gz UWVFQEVLQMFVBE-MNOVXSKESA-N 1 2 306.397 4.258 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(Sc3ccccn3)o2)C[C@@H]1F ZINC000646153400 1046868442 /nfs/dbraw/zinc/86/84/42/1046868442.db2.gz XBBYZRNWEAOJSV-OCCSQVGLSA-N 1 2 306.406 4.006 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(Sc3ccccn3)o2)C[C@@H]1F ZINC000646153400 1046868462 /nfs/dbraw/zinc/86/84/62/1046868462.db2.gz XBBYZRNWEAOJSV-OCCSQVGLSA-N 1 2 306.406 4.006 20 0 DIADLO CC1(C)C[NH+](Cc2ccc(C(F)(F)F)cc2Br)C1 ZINC001140709759 1046868685 /nfs/dbraw/zinc/86/86/85/1046868685.db2.gz JYRCCFWXJRUTKI-UHFFFAOYSA-N 1 2 322.168 4.310 20 0 DIADLO Cc1nc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)nc2ccccc12 ZINC000679549700 1046869728 /nfs/dbraw/zinc/86/97/28/1046869728.db2.gz YPHVJQJZHZZQEO-AAEUAGOBSA-N 1 2 323.362 4.101 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)nc2ccccc12 ZINC000679549700 1046869743 /nfs/dbraw/zinc/86/97/43/1046869743.db2.gz YPHVJQJZHZZQEO-AAEUAGOBSA-N 1 2 323.362 4.101 20 0 DIADLO Nc1ccc(Cl)cc1C[N@@H+]1CCc2cc(Cl)ccc2C1 ZINC001140717978 1046870096 /nfs/dbraw/zinc/87/00/96/1046870096.db2.gz QAQQWJXMCATUHO-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1ccc(Cl)cc1C[N@H+]1CCc2cc(Cl)ccc2C1 ZINC001140717978 1046870114 /nfs/dbraw/zinc/87/01/14/1046870114.db2.gz QAQQWJXMCATUHO-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000679584132 1046876369 /nfs/dbraw/zinc/87/63/69/1046876369.db2.gz LLPWNKZQVJVUSW-PSASIEDQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cc(F)c(F)cc1F ZINC000679584132 1046876384 /nfs/dbraw/zinc/87/63/84/1046876384.db2.gz LLPWNKZQVJVUSW-PSASIEDQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000679583743 1046878147 /nfs/dbraw/zinc/87/81/47/1046878147.db2.gz HCUXNCLUWJMUKM-JSGCOSHPSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000679583743 1046878163 /nfs/dbraw/zinc/87/81/63/1046878163.db2.gz HCUXNCLUWJMUKM-JSGCOSHPSA-N 1 2 323.362 4.240 20 0 DIADLO COc1ccccc1[C@H]([NH2+]C1CSC1)c1ccccc1Cl ZINC000679626424 1046887701 /nfs/dbraw/zinc/88/77/01/1046887701.db2.gz ZOQDHIYAYUBTOD-QGZVFWFLSA-N 1 2 319.857 4.143 20 0 DIADLO FC(F)O[C@H]1CCC[N@H+](Cc2c(Cl)cccc2Cl)C1 ZINC000679680636 1046891620 /nfs/dbraw/zinc/89/16/20/1046891620.db2.gz KHFOUOGAPXZZSJ-VIFPVBQESA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@H]1CCC[N@@H+](Cc2c(Cl)cccc2Cl)C1 ZINC000679680636 1046891632 /nfs/dbraw/zinc/89/16/32/1046891632.db2.gz KHFOUOGAPXZZSJ-VIFPVBQESA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2Cl)C1 ZINC000679676699 1046892364 /nfs/dbraw/zinc/89/23/64/1046892364.db2.gz MQQVOXGMCOXAJQ-LLVKDONJSA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2Cl)C1 ZINC000679676699 1046892343 /nfs/dbraw/zinc/89/23/43/1046892343.db2.gz MQQVOXGMCOXAJQ-LLVKDONJSA-N 1 2 310.171 4.197 20 0 DIADLO Oc1cc(Cl)cc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC001140794247 1046902375 /nfs/dbraw/zinc/90/23/75/1046902375.db2.gz FOUCGQKFJYMPSO-KRWDZBQOSA-N 1 2 319.857 4.336 20 0 DIADLO Oc1cc(Cl)cc(C[N@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC001140794247 1046902386 /nfs/dbraw/zinc/90/23/86/1046902386.db2.gz FOUCGQKFJYMPSO-KRWDZBQOSA-N 1 2 319.857 4.336 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+](C)CC(=O)OCc1ccccc1 ZINC000303290909 1046908064 /nfs/dbraw/zinc/90/80/64/1046908064.db2.gz AUNWLQFTLFRLKW-CQSZACIVSA-N 1 2 317.816 4.076 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+](C)CC(=O)OCc1ccccc1 ZINC000303290909 1046908068 /nfs/dbraw/zinc/90/80/68/1046908068.db2.gz AUNWLQFTLFRLKW-CQSZACIVSA-N 1 2 317.816 4.076 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c(C)c1 ZINC000237435506 1046912092 /nfs/dbraw/zinc/91/20/92/1046912092.db2.gz KDIRHHBAOJCEGP-CQSZACIVSA-N 1 2 301.434 4.143 20 0 DIADLO Fc1ccc(C[NH2+]Cc2cc(-c3ccccc3)on2)cc1Cl ZINC000161673771 1046912243 /nfs/dbraw/zinc/91/22/43/1046912243.db2.gz YWFWGYHHTSQHRZ-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c(F)c1 ZINC001140824251 1046916232 /nfs/dbraw/zinc/91/62/32/1046916232.db2.gz BNAFOEPSKVCRHK-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c(F)c1 ZINC001140824251 1046916237 /nfs/dbraw/zinc/91/62/37/1046916237.db2.gz BNAFOEPSKVCRHK-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+]Cc1ncc(-c2ccccc2F)o1 ZINC000679942769 1046917024 /nfs/dbraw/zinc/91/70/24/1046917024.db2.gz OYTOQLDCKQRUQC-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO COc1cc(F)c(C[N@H+]2CC=C(c3ccccc3)CC2)c(F)c1 ZINC001140827652 1046919312 /nfs/dbraw/zinc/91/93/12/1046919312.db2.gz GYTZSYWJANLCBO-UHFFFAOYSA-N 1 2 315.363 4.263 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CC=C(c3ccccc3)CC2)c(F)c1 ZINC001140827652 1046919323 /nfs/dbraw/zinc/91/93/23/1046919323.db2.gz GYTZSYWJANLCBO-UHFFFAOYSA-N 1 2 315.363 4.263 20 0 DIADLO C[N@H+](Cc1cccc(F)c1)Cc1cc(Cl)c(O)c(Cl)c1 ZINC001140835008 1046924722 /nfs/dbraw/zinc/92/47/22/1046924722.db2.gz IXYWZYMEBUBLKS-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO C[N@@H+](Cc1cccc(F)c1)Cc1cc(Cl)c(O)c(Cl)c1 ZINC001140835008 1046924735 /nfs/dbraw/zinc/92/47/35/1046924735.db2.gz IXYWZYMEBUBLKS-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1CCCCC[C@@H]1/C=C/c1cccs1 ZINC000680003022 1046927532 /nfs/dbraw/zinc/92/75/32/1046927532.db2.gz KRSQLMXWSQQNSC-ROJDOSBLSA-N 1 2 301.459 4.238 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)c1C ZINC001140862135 1046934747 /nfs/dbraw/zinc/93/47/47/1046934747.db2.gz WUASDPWHBDHHSC-UHFFFAOYSA-N 1 2 308.347 4.209 20 0 DIADLO Cc1c[nH]c(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)c1C ZINC001140862135 1046934756 /nfs/dbraw/zinc/93/47/56/1046934756.db2.gz WUASDPWHBDHHSC-UHFFFAOYSA-N 1 2 308.347 4.209 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1ccccc1Cl ZINC000680040806 1046938137 /nfs/dbraw/zinc/93/81/37/1046938137.db2.gz AVQMLRIPINVYIS-YMTOWFKASA-N 1 2 309.743 4.403 20 0 DIADLO Fc1cc(C[N@H+]2CCCC[C@@H](F)C2)cc(F)c1C(F)(F)F ZINC001140878596 1046938377 /nfs/dbraw/zinc/93/83/77/1046938377.db2.gz DHBQALOXAINHBE-SNVBAGLBSA-N 1 2 311.269 4.308 20 0 DIADLO Fc1cc(C[N@@H+]2CCCC[C@@H](F)C2)cc(F)c1C(F)(F)F ZINC001140878596 1046938382 /nfs/dbraw/zinc/93/83/82/1046938382.db2.gz DHBQALOXAINHBE-SNVBAGLBSA-N 1 2 311.269 4.308 20 0 DIADLO CC[N@H+](Cc1cccc(Cl)c1)Cc1ccc(O)c(F)c1F ZINC001140892202 1046944751 /nfs/dbraw/zinc/94/47/51/1046944751.db2.gz FHEOSZVONPXCCA-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC(C)Cn1nccc1C[NH2+][C@H](C)c1c(F)cccc1Cl ZINC000647189480 1046952207 /nfs/dbraw/zinc/95/22/07/1046952207.db2.gz XQXBQBWBYNYYAT-GFCCVEGCSA-N 1 2 309.816 4.182 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccc(Cl)cc2Cl)C(C)C)[nH]n1 ZINC001203081658 1046960362 /nfs/dbraw/zinc/96/03/62/1046960362.db2.gz ZDRAVQUEKQXEID-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccc(Cl)cc2Cl)C(C)C)[nH]n1 ZINC001203081658 1046960370 /nfs/dbraw/zinc/96/03/70/1046960370.db2.gz ZDRAVQUEKQXEID-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1Cl)c1cc2n(n1)CCCC2 ZINC000647279995 1046963824 /nfs/dbraw/zinc/96/38/24/1046963824.db2.gz LSUJDDODQWKNHK-STQMWFEESA-N 1 2 303.837 4.285 20 0 DIADLO Oc1c(F)cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cc1F ZINC001140987764 1046970615 /nfs/dbraw/zinc/97/06/15/1046970615.db2.gz CNKIOVHRIMOTKR-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cc1F ZINC001140987764 1046970618 /nfs/dbraw/zinc/97/06/18/1046970618.db2.gz CNKIOVHRIMOTKR-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1cc2ccccc2o1 ZINC000680354914 1046971276 /nfs/dbraw/zinc/97/12/76/1046971276.db2.gz KNEQNECKCLYHIV-YGRLFVJLSA-N 1 2 315.319 4.495 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+][C@H]1COc2cc(F)cc(F)c21 ZINC000680354869 1046972037 /nfs/dbraw/zinc/97/20/37/1046972037.db2.gz JNEZORZGWKDHJS-NHYWBVRUSA-N 1 2 319.351 4.066 20 0 DIADLO CC1(C)Cc2occc2[C@H]([NH2+][C@H]2COc3cc(F)cc(F)c32)C1 ZINC000680355377 1046973785 /nfs/dbraw/zinc/97/37/85/1046973785.db2.gz OPLJPSHIVSCINS-KGLIPLIRSA-N 1 2 319.351 4.295 20 0 DIADLO CC(C)[N@H+](CCC(=O)c1ccc2ccccc2c1)Cc1ncco1 ZINC001141010034 1046977590 /nfs/dbraw/zinc/97/75/90/1046977590.db2.gz AZFLWHPSPYGWFE-UHFFFAOYSA-N 1 2 322.408 4.311 20 0 DIADLO CC(C)[N@@H+](CCC(=O)c1ccc2ccccc2c1)Cc1ncco1 ZINC001141010034 1046977596 /nfs/dbraw/zinc/97/75/96/1046977596.db2.gz AZFLWHPSPYGWFE-UHFFFAOYSA-N 1 2 322.408 4.311 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1nc(-c2ccsc2)oc1C ZINC000680381076 1046977854 /nfs/dbraw/zinc/97/78/54/1046977854.db2.gz LQXFJWOCJUVFBQ-VIFPVBQESA-N 1 2 317.414 4.167 20 0 DIADLO Oc1cccc2ccc(C[N@@H+]3CCc4c(Cl)cccc4C3)nc12 ZINC001141022428 1046981202 /nfs/dbraw/zinc/98/12/02/1046981202.db2.gz UTCRJYIENBEYJN-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1cccc2ccc(C[N@H+]3CCc4c(Cl)cccc4C3)nc12 ZINC001141022428 1046981213 /nfs/dbraw/zinc/98/12/13/1046981213.db2.gz UTCRJYIENBEYJN-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO CCCc1occc1C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC000798927464 1046987415 /nfs/dbraw/zinc/98/74/15/1046987415.db2.gz STMNAZSAFHIOPX-UHFFFAOYSA-N 1 2 323.396 4.491 20 0 DIADLO COc1cc2c(cc1F)CC[C@@H]2Nc1ccc([NH+](C)C)c(C)c1 ZINC000798932939 1046988454 /nfs/dbraw/zinc/98/84/54/1046988454.db2.gz KZOHBSUZOIURBQ-KRWDZBQOSA-N 1 2 314.404 4.308 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000798930860 1046989274 /nfs/dbraw/zinc/98/92/74/1046989274.db2.gz BHQBIEKKDMAPMO-ZIFCJYIRSA-N 1 2 314.473 4.294 20 0 DIADLO c1cc(N2CCCC2)ccc1[NH2+][C@@H]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000798930860 1046989292 /nfs/dbraw/zinc/98/92/92/1046989292.db2.gz BHQBIEKKDMAPMO-ZIFCJYIRSA-N 1 2 314.473 4.294 20 0 DIADLO CC(C)(C)Nc1ccccc1NC1CCN(c2cccc[nH+]2)CC1 ZINC000798934431 1046989806 /nfs/dbraw/zinc/98/98/06/1046989806.db2.gz BOPAHJFDNFLXQC-UHFFFAOYSA-N 1 2 324.472 4.373 20 0 DIADLO C[N@H+](Cc1ccn2ccnc2c1)Cc1cccc(Cl)c1Cl ZINC001141046271 1046991284 /nfs/dbraw/zinc/99/12/84/1046991284.db2.gz SGCHVIITCKVMQU-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1ccn2ccnc2c1)Cc1cccc(Cl)c1Cl ZINC001141046271 1046991288 /nfs/dbraw/zinc/99/12/88/1046991288.db2.gz SGCHVIITCKVMQU-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO CCCCC[N@H+](Cc1nnc(C2CC2)[nH]1)Cc1ccc(F)cc1 ZINC000347396985 1046997758 /nfs/dbraw/zinc/99/77/58/1046997758.db2.gz XNIPFXCHSYFQNR-UHFFFAOYSA-N 1 2 316.424 4.014 20 0 DIADLO CCCCC[N@@H+](Cc1nnc(C2CC2)[nH]1)Cc1ccc(F)cc1 ZINC000347396985 1046997766 /nfs/dbraw/zinc/99/77/66/1046997766.db2.gz XNIPFXCHSYFQNR-UHFFFAOYSA-N 1 2 316.424 4.014 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124916 1047004430 /nfs/dbraw/zinc/00/44/30/1047004430.db2.gz BFNFYSMMBXTYEU-SMDDNHRTSA-N 1 2 305.809 4.005 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124916 1047004447 /nfs/dbraw/zinc/00/44/47/1047004447.db2.gz BFNFYSMMBXTYEU-SMDDNHRTSA-N 1 2 305.809 4.005 20 0 DIADLO CC(C)=CC[N@@H+](Cc1ccc(Cl)cc1)Cn1cc[nH]c1=S ZINC000799165673 1047005119 /nfs/dbraw/zinc/00/51/19/1047005119.db2.gz JXBNBTCDXKSAID-UHFFFAOYSA-N 1 2 321.877 4.251 20 0 DIADLO CC(C)=CC[N@H+](Cc1ccc(Cl)cc1)Cn1cc[nH]c1=S ZINC000799165673 1047005132 /nfs/dbraw/zinc/00/51/32/1047005132.db2.gz JXBNBTCDXKSAID-UHFFFAOYSA-N 1 2 321.877 4.251 20 0 DIADLO C[C@@H](c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1)C1CCCC1 ZINC000680695611 1047011875 /nfs/dbraw/zinc/01/18/75/1047011875.db2.gz HYTVHINPLJHJEF-CQSZACIVSA-N 1 2 322.412 4.275 20 0 DIADLO CC(C)(C)C1CC[NH+](Cc2ncc(Cl)nc2Cl)CC1 ZINC001141133322 1047023377 /nfs/dbraw/zinc/02/33/77/1047023377.db2.gz OUZSYPDQRQWDRI-UHFFFAOYSA-N 1 2 302.249 4.042 20 0 DIADLO C[C@@H]1CCCC[C@@H]1c1noc(-c2cccc(Cn3cc[nH+]c3)c2)n1 ZINC000680740273 1047023869 /nfs/dbraw/zinc/02/38/69/1047023869.db2.gz LSBQQAIOTQLSJF-PBHICJAKSA-N 1 2 322.412 4.275 20 0 DIADLO Cc1nc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)co1 ZINC000647970330 1047025731 /nfs/dbraw/zinc/02/57/31/1047025731.db2.gz MMTKQIGXQUQYSE-UHFFFAOYSA-N 1 2 310.319 4.171 20 0 DIADLO C[C@@H](Sc1ccccc1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000162720083 1047027075 /nfs/dbraw/zinc/02/70/75/1047027075.db2.gz ABBNDBGOOLVHDR-CYBMUJFWSA-N 1 2 323.421 4.196 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cccc(O)c2Cl)CC2CC2)cn1 ZINC000648058062 1047031814 /nfs/dbraw/zinc/03/18/14/1047031814.db2.gz MECFZPLEOXHRGE-UHFFFAOYSA-N 1 2 316.832 4.161 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cccc(O)c2Cl)CC2CC2)cn1 ZINC000648058062 1047031830 /nfs/dbraw/zinc/03/18/30/1047031830.db2.gz MECFZPLEOXHRGE-UHFFFAOYSA-N 1 2 316.832 4.161 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1ccc(-c3ncccn3)cc1)C2 ZINC001141190835 1047040328 /nfs/dbraw/zinc/04/03/28/1047040328.db2.gz WSHFUMYNIJCGSA-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1ccc(-c3ncccn3)cc1)C2 ZINC001141190835 1047040341 /nfs/dbraw/zinc/04/03/41/1047040341.db2.gz WSHFUMYNIJCGSA-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO COc1cccc(C[N@@H+]2CCc3ccc(Cl)cc3C2)c1F ZINC001141218224 1047049938 /nfs/dbraw/zinc/04/99/38/1047049938.db2.gz DVVGNEQBGLCDQV-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc(C[N@H+]2CCc3ccc(Cl)cc3C2)c1F ZINC001141218224 1047049954 /nfs/dbraw/zinc/04/99/54/1047049954.db2.gz DVVGNEQBGLCDQV-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(CNc2[nH+]c3ccccc3n2C2CC2)cc1F ZINC000680852687 1047055476 /nfs/dbraw/zinc/05/54/76/1047055476.db2.gz OZVQEFAYJYAOPY-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO Cc1cc(N[C@H]2Cc3[nH]c4ccccc4c3C2)ccc1[NH+](C)C ZINC000799724850 1047057991 /nfs/dbraw/zinc/05/79/91/1047057991.db2.gz SNFZZQCHFMTNOG-OAHLLOKOSA-N 1 2 305.425 4.122 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)ccc1Cl ZINC001141237386 1047058587 /nfs/dbraw/zinc/05/85/87/1047058587.db2.gz QRNMGSSUZFHNGB-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)ccc1Cl ZINC001141237386 1047058599 /nfs/dbraw/zinc/05/85/99/1047058599.db2.gz QRNMGSSUZFHNGB-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO CCc1noc(C[NH2+][C@@H](C)c2ccc(Cl)c3ccccc32)n1 ZINC000680897566 1047065737 /nfs/dbraw/zinc/06/57/37/1047065737.db2.gz BGOBBRCNQTXDFT-NSHDSACASA-N 1 2 315.804 4.289 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@@H+]2Cc2csc3ccccc23)o1 ZINC000536679960 1047069291 /nfs/dbraw/zinc/06/92/91/1047069291.db2.gz YTKIMEVHIPWSOG-INIZCTEOSA-N 1 2 313.422 4.376 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@H+]2Cc2csc3ccccc23)o1 ZINC000536679960 1047069296 /nfs/dbraw/zinc/06/92/96/1047069296.db2.gz YTKIMEVHIPWSOG-INIZCTEOSA-N 1 2 313.422 4.376 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@@H](c3cccc(F)c3)C2)s1 ZINC000536683659 1047069581 /nfs/dbraw/zinc/06/95/81/1047069581.db2.gz RBBKJAYREIHMNZ-QGZVFWFLSA-N 1 2 305.418 4.023 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@@H](c3cccc(F)c3)C2)s1 ZINC000536683659 1047069595 /nfs/dbraw/zinc/06/95/95/1047069595.db2.gz RBBKJAYREIHMNZ-QGZVFWFLSA-N 1 2 305.418 4.023 20 0 DIADLO C[C@@H](O)[C@@H]1CCC[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC000681082742 1047091381 /nfs/dbraw/zinc/09/13/81/1047091381.db2.gz OQAFHGJDAVQRPH-NXEZZACHSA-N 1 2 322.663 4.240 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@H](c3cccc(F)c3)C2)s1 ZINC000536683657 1047069852 /nfs/dbraw/zinc/06/98/52/1047069852.db2.gz RBBKJAYREIHMNZ-KRWDZBQOSA-N 1 2 305.418 4.023 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@H](c3cccc(F)c3)C2)s1 ZINC000536683657 1047069871 /nfs/dbraw/zinc/06/98/71/1047069871.db2.gz RBBKJAYREIHMNZ-KRWDZBQOSA-N 1 2 305.418 4.023 20 0 DIADLO C[C@@H](O)[C@@H]1CCC[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC000681082742 1047091393 /nfs/dbraw/zinc/09/13/93/1047091393.db2.gz OQAFHGJDAVQRPH-NXEZZACHSA-N 1 2 322.663 4.240 20 0 DIADLO CC[C@@H](C)Oc1cc(C[NH2+][C@@H](CC)C(F)F)ccc1OC ZINC000648619217 1047072814 /nfs/dbraw/zinc/07/28/14/1047072814.db2.gz DTALWRLTGZFBDK-YPMHNXCESA-N 1 2 301.377 4.006 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)o1 ZINC000536698022 1047075331 /nfs/dbraw/zinc/07/53/31/1047075331.db2.gz MONQHZVVDROILG-TVFIUFHYSA-N 1 2 317.454 4.427 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)o1 ZINC000536698022 1047075350 /nfs/dbraw/zinc/07/53/50/1047075350.db2.gz MONQHZVVDROILG-TVFIUFHYSA-N 1 2 317.454 4.427 20 0 DIADLO Fc1ccc(C2CC2)cc1C[NH2+]Cc1nc2c(s1)CCCC2 ZINC000648635450 1047076996 /nfs/dbraw/zinc/07/69/96/1047076996.db2.gz NGWHEPXWTJYBKE-UHFFFAOYSA-N 1 2 316.445 4.328 20 0 DIADLO Cn1c(NCc2nccc3ccccc32)[nH+]c2cccc(Cl)c21 ZINC000681013974 1047083671 /nfs/dbraw/zinc/08/36/71/1047083671.db2.gz DTASMJBRXBIQTN-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1ccc(Oc2ccc(F)cc2)cc1 ZINC001141315109 1047087279 /nfs/dbraw/zinc/08/72/79/1047087279.db2.gz QMSCUSWXQKNIJS-AWEZNQCLSA-N 1 2 313.372 4.171 20 0 DIADLO C[C@H]1CC(=O)CC[N@H+]1Cc1ccc(Oc2ccc(F)cc2)cc1 ZINC001141315109 1047087293 /nfs/dbraw/zinc/08/72/93/1047087293.db2.gz QMSCUSWXQKNIJS-AWEZNQCLSA-N 1 2 313.372 4.171 20 0 DIADLO c1coc([C@@H]2[N@H+](Cc3cnc(C4CC4)s3)CC23CCC3)c1 ZINC000648801754 1047091368 /nfs/dbraw/zinc/09/13/68/1047091368.db2.gz ZHAUPFBGKRWHBO-HNNXBMFYSA-N 1 2 300.427 4.341 20 0 DIADLO c1coc([C@@H]2[N@@H+](Cc3cnc(C4CC4)s3)CC23CCC3)c1 ZINC000648801754 1047091379 /nfs/dbraw/zinc/09/13/79/1047091379.db2.gz ZHAUPFBGKRWHBO-HNNXBMFYSA-N 1 2 300.427 4.341 20 0 DIADLO COc1c(C)cnc(CNc2cc(C)c3ccccc3[nH+]2)c1C ZINC001115923292 1047092815 /nfs/dbraw/zinc/09/28/15/1047092815.db2.gz XSFRJSSVSIXCCN-UHFFFAOYSA-N 1 2 307.397 4.176 20 0 DIADLO Fc1ccc(C(F)(F)F)c(C[N@@H+]2CCc3ccsc3C2)c1 ZINC001138092741 1047093412 /nfs/dbraw/zinc/09/34/12/1047093412.db2.gz VTPDTQNICOLRMC-UHFFFAOYSA-N 1 2 315.335 4.464 20 0 DIADLO Fc1ccc(C(F)(F)F)c(C[N@H+]2CCc3ccsc3C2)c1 ZINC001138092741 1047093424 /nfs/dbraw/zinc/09/34/24/1047093424.db2.gz VTPDTQNICOLRMC-UHFFFAOYSA-N 1 2 315.335 4.464 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1n[nH]c2ccc(Br)cc21 ZINC001139654637 1047094734 /nfs/dbraw/zinc/09/47/34/1047094734.db2.gz HJNIUZKVOXUCKB-QWRGUYRKSA-N 1 2 322.250 4.088 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1n[nH]c2ccc(Br)cc21 ZINC001139654634 1047094916 /nfs/dbraw/zinc/09/49/16/1047094916.db2.gz HJNIUZKVOXUCKB-PHIMTYICSA-N 1 2 322.250 4.088 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1n[nH]c2ccc(Br)cc21 ZINC001139654634 1047094931 /nfs/dbraw/zinc/09/49/31/1047094931.db2.gz HJNIUZKVOXUCKB-PHIMTYICSA-N 1 2 322.250 4.088 20 0 DIADLO COc1nc(C)cc(C)c1C[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000681108747 1047098567 /nfs/dbraw/zinc/09/85/67/1047098567.db2.gz UVSJGBSVJQQKSS-ZDUSSCGKSA-N 1 2 319.474 4.138 20 0 DIADLO COc1cc(Cl)ncc1C[N@H+](C)Cc1ccc(Cl)cc1 ZINC001141341380 1047100819 /nfs/dbraw/zinc/10/08/19/1047100819.db2.gz AFXYQAISIXFVPM-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cc(Cl)ncc1C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001141341380 1047100822 /nfs/dbraw/zinc/10/08/22/1047100822.db2.gz AFXYQAISIXFVPM-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO CCn1nc(C[N@@H+]2CCOc3ccccc3[C@H]2C)c2ccccc21 ZINC000681164274 1047104071 /nfs/dbraw/zinc/10/40/71/1047104071.db2.gz OFCMIQYUYIWDOV-OAHLLOKOSA-N 1 2 321.424 4.012 20 0 DIADLO CCn1nc(C[N@H+]2CCOc3ccccc3[C@H]2C)c2ccccc21 ZINC000681164274 1047104076 /nfs/dbraw/zinc/10/40/76/1047104076.db2.gz OFCMIQYUYIWDOV-OAHLLOKOSA-N 1 2 321.424 4.012 20 0 DIADLO C[N@H+](CC(=O)OC(C)(C)C)Cc1cccc(-c2ccsc2)c1 ZINC001141379749 1047109953 /nfs/dbraw/zinc/10/99/53/1047109953.db2.gz UQUWNOWHFWUSOV-UHFFFAOYSA-N 1 2 317.454 4.189 20 0 DIADLO C[N@@H+](CC(=O)OC(C)(C)C)Cc1cccc(-c2ccsc2)c1 ZINC001141379749 1047109960 /nfs/dbraw/zinc/10/99/60/1047109960.db2.gz UQUWNOWHFWUSOV-UHFFFAOYSA-N 1 2 317.454 4.189 20 0 DIADLO C[C@H](c1cccc(Cl)c1F)[N@@H+]1CCC[C@@H](OC(F)F)C1 ZINC000681410737 1047123197 /nfs/dbraw/zinc/12/31/97/1047123197.db2.gz XTEAEBOBOLODKT-NXEZZACHSA-N 1 2 307.743 4.244 20 0 DIADLO C[C@H](c1cccc(Cl)c1F)[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000681410737 1047123200 /nfs/dbraw/zinc/12/32/00/1047123200.db2.gz XTEAEBOBOLODKT-NXEZZACHSA-N 1 2 307.743 4.244 20 0 DIADLO CCN(C[C@H]1CCOC1)c1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000649307038 1047122067 /nfs/dbraw/zinc/12/20/67/1047122067.db2.gz KYJQCJIDQHOFEN-GFCCVEGCSA-N 1 2 324.346 4.116 20 0 DIADLO COc1ccc(C[N@H+](C)[C@@H](C)c2cccc(Cl)c2F)cn1 ZINC000681407110 1047122225 /nfs/dbraw/zinc/12/22/25/1047122225.db2.gz KYTVIEZSBZVXQI-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@@H](C)c2cccc(Cl)c2F)cn1 ZINC000681407110 1047122229 /nfs/dbraw/zinc/12/22/29/1047122229.db2.gz KYTVIEZSBZVXQI-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO Clc1cnc(N[C@H]2CC[C@H](Nc3cccc[nH+]3)CC2)s1 ZINC000649367496 1047123351 /nfs/dbraw/zinc/12/33/51/1047123351.db2.gz PKHVBEWDFKWHIY-XYPYZODXSA-N 1 2 308.838 4.027 20 0 DIADLO CCC(CC)[C@H]([NH2+]Cc1noc(C2CC2)n1)c1cccs1 ZINC000537078355 1047137019 /nfs/dbraw/zinc/13/70/19/1047137019.db2.gz BVSSIMLMEOSUQQ-HNNXBMFYSA-N 1 2 305.447 4.276 20 0 DIADLO CC(C)c1ccc2c(c1)[C@@H]([NH2+]Cc1n[nH]c3ccccc31)CC2 ZINC000681699991 1047141259 /nfs/dbraw/zinc/14/12/59/1047141259.db2.gz CVQUDWVOMOAJGO-SFHVURJKSA-N 1 2 305.425 4.463 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001116444279 1047141784 /nfs/dbraw/zinc/14/17/84/1047141784.db2.gz VQUWSPIMPCXQJB-CHWSQXEVSA-N 1 2 316.470 4.167 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001116444279 1047141787 /nfs/dbraw/zinc/14/17/87/1047141787.db2.gz VQUWSPIMPCXQJB-CHWSQXEVSA-N 1 2 316.470 4.167 20 0 DIADLO CCCCN(C(=O)C[C@H](C)n1cc[nH+]c1)[C@H](C)c1ccccc1 ZINC000649590199 1047150532 /nfs/dbraw/zinc/15/05/32/1047150532.db2.gz PEGCNLLNQIRODC-DLBZAZTESA-N 1 2 313.445 4.224 20 0 DIADLO COc1ccc(-c2ccccc2)cc1C[NH2+]Cc1nc(C)cs1 ZINC000537210979 1047150818 /nfs/dbraw/zinc/15/08/18/1047150818.db2.gz FTRUEXGZPFPIIG-UHFFFAOYSA-N 1 2 324.449 4.417 20 0 DIADLO CCC[C@]1(C(F)(F)F)CCCN1Cc1cccc2[nH+]ccn21 ZINC000537204982 1047152508 /nfs/dbraw/zinc/15/25/08/1047152508.db2.gz OETJYLHCLSGRPO-OAHLLOKOSA-N 1 2 311.351 4.031 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2nc(CCC(C)C)no2)CCC1 ZINC000649645200 1047157563 /nfs/dbraw/zinc/15/75/63/1047157563.db2.gz JBUKHBVYGBMJKO-UHFFFAOYSA-N 1 2 313.445 4.136 20 0 DIADLO COc1cccc2c(N3CCC(c4ccccn4)CC3)cc[nH+]c12 ZINC000681983221 1047159203 /nfs/dbraw/zinc/15/92/03/1047159203.db2.gz KDLGSKVMVTYYQG-UHFFFAOYSA-N 1 2 319.408 4.022 20 0 DIADLO CCC[C@@H]([NH2+]Cc1csnn1)c1ccc(Cl)c(Cl)c1 ZINC000537299742 1047161715 /nfs/dbraw/zinc/16/17/15/1047161715.db2.gz MTTRILIDSOPYOA-CYBMUJFWSA-N 1 2 316.257 4.476 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC001141525878 1047162817 /nfs/dbraw/zinc/16/28/17/1047162817.db2.gz QSLUXTKFZMPYQD-BRWVUGGUSA-N 1 2 323.440 4.417 20 0 DIADLO CC(C)c1ccc(C(C)(C)NC(=O)C[C@@H](C)n2cc[nH+]c2)cc1 ZINC000649693509 1047165265 /nfs/dbraw/zinc/16/52/65/1047165265.db2.gz GMDRYDUNJGEPRQ-OAHLLOKOSA-N 1 2 313.445 4.009 20 0 DIADLO CCc1cnc(C[N@@H+](C)[C@@H](CC)c2ccccc2OC)s1 ZINC000682070258 1047168710 /nfs/dbraw/zinc/16/87/10/1047168710.db2.gz CFJINAAZORGJIU-HNNXBMFYSA-N 1 2 304.459 4.297 20 0 DIADLO CCc1cnc(C[N@H+](C)[C@@H](CC)c2ccccc2OC)s1 ZINC000682070258 1047168711 /nfs/dbraw/zinc/16/87/11/1047168711.db2.gz CFJINAAZORGJIU-HNNXBMFYSA-N 1 2 304.459 4.297 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cc(F)ccc2Cl)cc1OC ZINC000682083517 1047169945 /nfs/dbraw/zinc/16/99/45/1047169945.db2.gz QYAAZGQCPBUIBS-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cc(F)ccc2Cl)cc1OC ZINC000682083517 1047169950 /nfs/dbraw/zinc/16/99/50/1047169950.db2.gz QYAAZGQCPBUIBS-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO CCc1nc(CNc2[nH+]c3ccccc3n2C(C)(C)C)cs1 ZINC001116709421 1047169964 /nfs/dbraw/zinc/16/99/64/1047169964.db2.gz PBPFITUEFGOSPV-UHFFFAOYSA-N 1 2 314.458 4.422 20 0 DIADLO CC[C@](C)([NH2+]Cc1ccc(C)nc1Cl)c1nc(C)cs1 ZINC000838898545 1047171618 /nfs/dbraw/zinc/17/16/18/1047171618.db2.gz AWTBAJWJBLXJLY-HNNXBMFYSA-N 1 2 309.866 4.223 20 0 DIADLO Cc1ccc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)c(Cl)n1 ZINC000838917466 1047173568 /nfs/dbraw/zinc/17/35/68/1047173568.db2.gz NNJXNSGJUYETLF-UHFFFAOYSA-N 1 2 322.786 4.491 20 0 DIADLO Cc1cc(N[C@H](C)[C@@H](O)c2ccc(F)cc2)[nH+]c2ccccc12 ZINC001116736233 1047173582 /nfs/dbraw/zinc/17/35/82/1047173582.db2.gz NILNTUNKHOMJOZ-BFUOFWGJSA-N 1 2 310.372 4.216 20 0 DIADLO Cc1cnc([C@H](C)SCc2ccc(-n3cc[nH+]c3)cc2C)o1 ZINC001116761339 1047176322 /nfs/dbraw/zinc/17/63/22/1047176322.db2.gz ABAOCFFDKQLDFZ-AWEZNQCLSA-N 1 2 313.426 4.472 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nc3c(s2)CCCC3)c(Cl)n1 ZINC000838938664 1047177296 /nfs/dbraw/zinc/17/72/96/1047177296.db2.gz NSSVKQWTZRPASF-NSHDSACASA-N 1 2 321.877 4.230 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2ncc(-c3ccccc3)o2)nc1 ZINC000649900772 1047186463 /nfs/dbraw/zinc/18/64/63/1047186463.db2.gz WDYQVBQZNACHNP-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)c2ncc(-c3ccccc3)o2)nc1 ZINC000649900772 1047186471 /nfs/dbraw/zinc/18/64/71/1047186471.db2.gz WDYQVBQZNACHNP-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO c1nc(C[N@@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)oc1C1CC1 ZINC000649917675 1047190760 /nfs/dbraw/zinc/19/07/60/1047190760.db2.gz XLJVWVGZPPIONT-BZSNNMDCSA-N 1 2 324.424 4.047 20 0 DIADLO c1nc(C[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)oc1C1CC1 ZINC000649917675 1047190767 /nfs/dbraw/zinc/19/07/67/1047190767.db2.gz XLJVWVGZPPIONT-BZSNNMDCSA-N 1 2 324.424 4.047 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(Cl)c2)C[N@@H+]1Cc1ccc(O)cc1 ZINC000682407306 1047192289 /nfs/dbraw/zinc/19/22/89/1047192289.db2.gz WZRIJGAJFBUDIZ-FZKQIMNGSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(Cl)c2)C[N@H+]1Cc1ccc(O)cc1 ZINC000682407306 1047192295 /nfs/dbraw/zinc/19/22/95/1047192295.db2.gz WZRIJGAJFBUDIZ-FZKQIMNGSA-N 1 2 317.816 4.008 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1n[nH]c2ccc(Br)cc21 ZINC001139658713 1047192366 /nfs/dbraw/zinc/19/23/66/1047192366.db2.gz OPTXBDVINMGRRS-GFCCVEGCSA-N 1 2 322.250 4.090 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1n[nH]c2ccc(Br)cc21 ZINC001139658713 1047192371 /nfs/dbraw/zinc/19/23/71/1047192371.db2.gz OPTXBDVINMGRRS-GFCCVEGCSA-N 1 2 322.250 4.090 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1csc(Cl)c1 ZINC000682497389 1047200936 /nfs/dbraw/zinc/20/09/36/1047200936.db2.gz BGZJEPNCRDYUCS-CPCISQLKSA-N 1 2 315.772 4.464 20 0 DIADLO FC(F)[C@@H]1CC[N@H+](Cc2ccc(Br)c(Cl)c2)C1 ZINC000682531584 1047202525 /nfs/dbraw/zinc/20/25/25/1047202525.db2.gz PIGLOWILCMZMHC-SECBINFHSA-N 1 2 324.596 4.190 20 0 DIADLO FC(F)[C@@H]1CC[N@@H+](Cc2ccc(Br)c(Cl)c2)C1 ZINC000682531584 1047202533 /nfs/dbraw/zinc/20/25/33/1047202533.db2.gz PIGLOWILCMZMHC-SECBINFHSA-N 1 2 324.596 4.190 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1c[nH]c3cc(Cl)ccc13)C2 ZINC001141586028 1047204112 /nfs/dbraw/zinc/20/41/12/1047204112.db2.gz OFRQHMBGWOFCNF-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1c[nH]c3cc(Cl)ccc13)C2 ZINC001141586028 1047204128 /nfs/dbraw/zinc/20/41/28/1047204128.db2.gz OFRQHMBGWOFCNF-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO Cc1cc(F)c2[nH]ccc2c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001212973893 1047208274 /nfs/dbraw/zinc/20/82/74/1047208274.db2.gz LHBUOMBHIYHBCB-UHFFFAOYSA-N 1 2 310.376 4.354 20 0 DIADLO C[C@@H]1C[N@H+](C[C@]2(C)CC2(Cl)Cl)C[C@@H](c2ccsc2)O1 ZINC000828047168 1047220193 /nfs/dbraw/zinc/22/01/93/1047220193.db2.gz HIPKUFLQXAGOKM-WXHSDQCUSA-N 1 2 320.285 4.094 20 0 DIADLO C[C@@H]1C[N@@H+](C[C@]2(C)CC2(Cl)Cl)C[C@@H](c2ccsc2)O1 ZINC000828047168 1047220203 /nfs/dbraw/zinc/22/02/03/1047220203.db2.gz HIPKUFLQXAGOKM-WXHSDQCUSA-N 1 2 320.285 4.094 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCc3ccccc3[C@@H](C)C2)c(C)[nH+]1 ZINC000650210441 1047222839 /nfs/dbraw/zinc/22/28/39/1047222839.db2.gz MEOBLZNLUKQCTI-AWEZNQCLSA-N 1 2 323.440 4.201 20 0 DIADLO CCc1cccc(Cl)c1C[N@@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000682777464 1047223025 /nfs/dbraw/zinc/22/30/25/1047223025.db2.gz AFLYOVCTTMTUHU-AWEZNQCLSA-N 1 2 303.837 4.005 20 0 DIADLO CCc1cccc(Cl)c1C[N@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000682777464 1047223035 /nfs/dbraw/zinc/22/30/35/1047223035.db2.gz AFLYOVCTTMTUHU-AWEZNQCLSA-N 1 2 303.837 4.005 20 0 DIADLO C[N@H+](Cc1cnc(C2CC2)s1)Cc1cc(F)c(F)c(F)c1 ZINC000537465583 1047223985 /nfs/dbraw/zinc/22/39/85/1047223985.db2.gz MEIBZIIBMSNIRF-UHFFFAOYSA-N 1 2 312.360 4.070 20 0 DIADLO C[N@@H+](Cc1cnc(C2CC2)s1)Cc1cc(F)c(F)c(F)c1 ZINC000537465583 1047223993 /nfs/dbraw/zinc/22/39/93/1047223993.db2.gz MEIBZIIBMSNIRF-UHFFFAOYSA-N 1 2 312.360 4.070 20 0 DIADLO C[N@H+](Cc1ccc(Cl)nc1)Cc1cc2cccnc2cc1F ZINC001141631771 1047238926 /nfs/dbraw/zinc/23/89/26/1047238926.db2.gz XDMFOSRFHDRFGP-UHFFFAOYSA-N 1 2 315.779 4.054 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)nc1)Cc1cc2cccnc2cc1F ZINC001141631771 1047238938 /nfs/dbraw/zinc/23/89/38/1047238938.db2.gz XDMFOSRFHDRFGP-UHFFFAOYSA-N 1 2 315.779 4.054 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1cc3cccnc3cc1F)CC2 ZINC001141631049 1047239644 /nfs/dbraw/zinc/23/96/44/1047239644.db2.gz JAGBNLMRENEWMQ-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1cc3cccnc3cc1F)CC2 ZINC001141631049 1047239654 /nfs/dbraw/zinc/23/96/54/1047239654.db2.gz JAGBNLMRENEWMQ-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO CCCCCCO[C@H](C)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000839612645 1047250879 /nfs/dbraw/zinc/25/08/79/1047250879.db2.gz BKELEDBKCAVTOU-CQSZACIVSA-N 1 2 315.417 4.001 20 0 DIADLO CCCC[C@@H](CCC)NC(=O)[C@@H]1CCc2[nH+]c(C(C)C)[nH]c2C1 ZINC000476250948 1047263510 /nfs/dbraw/zinc/26/35/10/1047263510.db2.gz STMADXRKROQMRL-HUUCEWRRSA-N 1 2 319.493 4.113 20 0 DIADLO CCCC[C@@H](CCC)NC(=O)[C@@H]1CCc2[nH]c(C(C)C)[nH+]c2C1 ZINC000476250948 1047263561 /nfs/dbraw/zinc/26/35/61/1047263561.db2.gz STMADXRKROQMRL-HUUCEWRRSA-N 1 2 319.493 4.113 20 0 DIADLO C[C@H](CC(C)(C)C)C(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000476254332 1047264185 /nfs/dbraw/zinc/26/41/85/1047264185.db2.gz KEQKDXROMVWBPY-HUUCEWRRSA-N 1 2 322.518 4.026 20 0 DIADLO Fc1c(Br)ccc(C[N@H+]2CCC[C@H](F)CC2)c1F ZINC001141743484 1047283686 /nfs/dbraw/zinc/28/36/86/1047283686.db2.gz XZFVMANLIDSOFM-JTQLQIEISA-N 1 2 322.168 4.051 20 0 DIADLO Fc1c(Br)ccc(C[N@@H+]2CCC[C@H](F)CC2)c1F ZINC001141743484 1047283698 /nfs/dbraw/zinc/28/36/98/1047283698.db2.gz XZFVMANLIDSOFM-JTQLQIEISA-N 1 2 322.168 4.051 20 0 DIADLO CCn1c(C2CC2)nn(C[N@@H+]2CC[C@H](CC(C)(C)C)C2)c1=S ZINC000840149671 1047291050 /nfs/dbraw/zinc/29/10/50/1047291050.db2.gz JJFNQRRIRVUCRQ-CYBMUJFWSA-N 1 2 322.522 4.027 20 0 DIADLO CCn1c(C2CC2)nn(C[N@H+]2CC[C@H](CC(C)(C)C)C2)c1=S ZINC000840149671 1047291054 /nfs/dbraw/zinc/29/10/54/1047291054.db2.gz JJFNQRRIRVUCRQ-CYBMUJFWSA-N 1 2 322.522 4.027 20 0 DIADLO COc1ccc(F)cc1CNc1ccc([NH+]2CCCC2)cc1 ZINC000390690706 1047299495 /nfs/dbraw/zinc/29/94/95/1047299495.db2.gz AGMODCSIXZFZPQ-UHFFFAOYSA-N 1 2 300.377 4.047 20 0 DIADLO COc1ccc2cc(NCc3c[nH+]c4c(C)cccn34)ccc2c1 ZINC000796457358 1047299859 /nfs/dbraw/zinc/29/98/59/1047299859.db2.gz DUTDRBDQCJDVTE-UHFFFAOYSA-N 1 2 317.392 4.417 20 0 DIADLO FC(F)(F)c1nc(C[N@@H+]2CC[C@H](c3ccccc3)C2)cs1 ZINC001141870000 1047302340 /nfs/dbraw/zinc/30/23/40/1047302340.db2.gz HHQXVIBPYTVYRC-LBPRGKRZSA-N 1 2 312.360 4.151 20 0 DIADLO FC(F)(F)c1nc(C[N@H+]2CC[C@H](c3ccccc3)C2)cs1 ZINC001141870000 1047302353 /nfs/dbraw/zinc/30/23/53/1047302353.db2.gz HHQXVIBPYTVYRC-LBPRGKRZSA-N 1 2 312.360 4.151 20 0 DIADLO Cc1cc(NCc2cccnc2N2CCCC2)[nH+]c2ccccc12 ZINC001118596389 1047303299 /nfs/dbraw/zinc/30/32/99/1047303299.db2.gz BYQJOKBJJDQOLO-UHFFFAOYSA-N 1 2 318.424 4.151 20 0 DIADLO COc1cc(C)c([C@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)cc1C ZINC000897942977 1047304820 /nfs/dbraw/zinc/30/48/20/1047304820.db2.gz VOVVRMVNKXHFLP-AWEZNQCLSA-N 1 2 316.445 4.448 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1nc(Cl)cs1)C(C)(C)C ZINC000897995519 1047306723 /nfs/dbraw/zinc/30/67/23/1047306723.db2.gz OMBNCPRGJBVZQI-AWEZNQCLSA-N 1 2 309.866 4.377 20 0 DIADLO Fc1cccc(F)c1[C@H]1CCC[N@@H+]1Cc1cccc2c1OCO2 ZINC001141960351 1047316233 /nfs/dbraw/zinc/31/62/33/1047316233.db2.gz KHQFXSVOSNOVGE-OAHLLOKOSA-N 1 2 317.335 4.031 20 0 DIADLO Fc1cccc(F)c1[C@H]1CCC[N@H+]1Cc1cccc2c1OCO2 ZINC001141960351 1047316249 /nfs/dbraw/zinc/31/62/49/1047316249.db2.gz KHQFXSVOSNOVGE-OAHLLOKOSA-N 1 2 317.335 4.031 20 0 DIADLO c1cc(CC2C[NH+](Cc3csc(-c4ccsc4)n3)C2)co1 ZINC000898160714 1047321681 /nfs/dbraw/zinc/32/16/81/1047321681.db2.gz QKASSXCLXUZSGR-UHFFFAOYSA-N 1 2 316.451 4.139 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1cccc(O)c1F)CCC2 ZINC001119067026 1047322265 /nfs/dbraw/zinc/32/22/65/1047322265.db2.gz ZKIAAASWEBXLIC-WFASDCNBSA-N 1 2 317.408 4.037 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(SC(F)(F)F)cc1)c1csnn1 ZINC000398316775 1047327873 /nfs/dbraw/zinc/32/78/73/1047327873.db2.gz UFXUFAPDFWFODU-MRVPVSSYSA-N 1 2 319.377 4.001 20 0 DIADLO C[C@H]1C[NH+](Cc2sccc2Oc2ccccc2)C[C@H](C)O1 ZINC001141994613 1047335346 /nfs/dbraw/zinc/33/53/46/1047335346.db2.gz SKFYUHFBTZCVKZ-KBPBESRZSA-N 1 2 303.427 4.150 20 0 DIADLO CC(C)c1ccc(C[N@H+](C)Cc2nc(-c3ccoc3)no2)cc1 ZINC000105607414 1047343043 /nfs/dbraw/zinc/34/30/43/1047343043.db2.gz SNFDTTDLTXRCSL-UHFFFAOYSA-N 1 2 311.385 4.085 20 0 DIADLO CC(C)c1ccc(C[N@@H+](C)Cc2nc(-c3ccoc3)no2)cc1 ZINC000105607414 1047343053 /nfs/dbraw/zinc/34/30/53/1047343053.db2.gz SNFDTTDLTXRCSL-UHFFFAOYSA-N 1 2 311.385 4.085 20 0 DIADLO O=C(Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1ccccc1 ZINC000044567494 1047347120 /nfs/dbraw/zinc/34/71/20/1047347120.db2.gz LYMHSOIZANVGKV-UHFFFAOYSA-N 1 2 317.392 4.139 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]C2(c3ccccc3Cl)CCC2)c2nccn21 ZINC000652216947 1047347719 /nfs/dbraw/zinc/34/77/19/1047347719.db2.gz KGWAHVVRXJRPPL-IUODEOHRSA-N 1 2 301.821 4.211 20 0 DIADLO C[C@H]([NH2+][C@@H]1CC(C)(C)Oc2ccc(F)cc21)c1nccs1 ZINC000652267675 1047350678 /nfs/dbraw/zinc/35/06/78/1047350678.db2.gz ZCWDPQRTEQFWOZ-GXFFZTMASA-N 1 2 306.406 4.235 20 0 DIADLO C[C@H]([NH2+][C@H]1CC(C)(C)Oc2ccc(F)cc21)c1nccs1 ZINC000652267674 1047351210 /nfs/dbraw/zinc/35/12/10/1047351210.db2.gz ZCWDPQRTEQFWOZ-GWCFXTLKSA-N 1 2 306.406 4.235 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2cc(C)ccc2OC(F)F)c1 ZINC000652330434 1047355587 /nfs/dbraw/zinc/35/55/87/1047355587.db2.gz GCGMUTQFOLPBLY-GFCCVEGCSA-N 1 2 322.355 4.311 20 0 DIADLO FC1(F)CC[NH+](Cc2ncc(-c3cccc(Cl)c3)o2)CC1 ZINC000796537489 1047383934 /nfs/dbraw/zinc/38/39/34/1047383934.db2.gz AZMMTQWMDBLDCF-UHFFFAOYSA-N 1 2 312.747 4.226 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC2(c3ccccc3C)CC2)c(C)[nH+]1 ZINC000653179234 1047384699 /nfs/dbraw/zinc/38/46/99/1047384699.db2.gz VABNOELYDJRHHF-UHFFFAOYSA-N 1 2 323.440 4.169 20 0 DIADLO C[C@@H](CC(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000046105396 1047384854 /nfs/dbraw/zinc/38/48/54/1047384854.db2.gz UNHLYTYMZCYEEJ-HNNXBMFYSA-N 1 2 305.381 4.005 20 0 DIADLO Cc1cc(C)c(NC(=O)NC2(C)CCC(F)(F)CC2)c(C)[nH+]1 ZINC000653184364 1047385529 /nfs/dbraw/zinc/38/55/29/1047385529.db2.gz AWGBIOCLCWWPFJ-UHFFFAOYSA-N 1 2 311.376 4.096 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@H]2c2cccc(F)c2)c(C)[nH+]1 ZINC000653183068 1047385575 /nfs/dbraw/zinc/38/55/75/1047385575.db2.gz KUQDHRVZBFDFJK-MRXNPFEDSA-N 1 2 313.376 4.125 20 0 DIADLO Cc1cccc(CC2CN(C(=O)Nc3c(C)cc(C)[nH+]c3C)C2)c1 ZINC000653180974 1047386146 /nfs/dbraw/zinc/38/61/46/1047386146.db2.gz MTOZIOKTNQGCJB-UHFFFAOYSA-N 1 2 323.440 4.022 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1ccc(C)nc1Cl ZINC001142140301 1047387687 /nfs/dbraw/zinc/38/76/87/1047387687.db2.gz WJUBIPNHICZPBP-CYBMUJFWSA-N 1 2 304.821 4.245 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1ccc(C)nc1Cl ZINC001142140301 1047387695 /nfs/dbraw/zinc/38/76/95/1047387695.db2.gz WJUBIPNHICZPBP-CYBMUJFWSA-N 1 2 304.821 4.245 20 0 DIADLO CCCC[N@H+](Cc1cc(C(C)=O)no1)[C@H](C)c1ccc(C)o1 ZINC000653522933 1047395667 /nfs/dbraw/zinc/39/56/67/1047395667.db2.gz XBGWWVOIXBRAHC-CYBMUJFWSA-N 1 2 304.390 4.142 20 0 DIADLO CCCC[N@@H+](Cc1cc(C(C)=O)no1)[C@H](C)c1ccc(C)o1 ZINC000653522933 1047395676 /nfs/dbraw/zinc/39/56/76/1047395676.db2.gz XBGWWVOIXBRAHC-CYBMUJFWSA-N 1 2 304.390 4.142 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3cccc(F)c3C)c2)[nH+]c1C ZINC001142246889 1047415532 /nfs/dbraw/zinc/41/55/32/1047415532.db2.gz BDZLKTIUKKKMCP-UHFFFAOYSA-N 1 2 323.371 4.393 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1cc(C(C)C)ccc1OC ZINC000653705185 1047416046 /nfs/dbraw/zinc/41/60/46/1047416046.db2.gz VYDIWKNKNZCKEM-UHFFFAOYSA-N 1 2 302.418 4.001 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1cc(C(C)C)ccc1OC ZINC000653705185 1047416053 /nfs/dbraw/zinc/41/60/53/1047416053.db2.gz VYDIWKNKNZCKEM-UHFFFAOYSA-N 1 2 302.418 4.001 20 0 DIADLO C[N@@H+](Cc1ccc[nH]1)Cc1ccc(Br)cc1Cl ZINC000537622981 1047475584 /nfs/dbraw/zinc/47/55/84/1047475584.db2.gz QJFLAJOAQINFOB-UHFFFAOYSA-N 1 2 313.626 4.063 20 0 DIADLO CC[N@H+](Cc1nccs1)Cc1ccc(C(F)(F)F)cc1 ZINC000749513182 1047424739 /nfs/dbraw/zinc/42/47/39/1047424739.db2.gz AOBZROHQPXSVKJ-UHFFFAOYSA-N 1 2 300.349 4.184 20 0 DIADLO CC[N@@H+](Cc1nccs1)Cc1ccc(C(F)(F)F)cc1 ZINC000749513182 1047424743 /nfs/dbraw/zinc/42/47/43/1047424743.db2.gz AOBZROHQPXSVKJ-UHFFFAOYSA-N 1 2 300.349 4.184 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3cc(F)ccc3C)c2)[nH+]c1C ZINC000749582852 1047427400 /nfs/dbraw/zinc/42/74/00/1047427400.db2.gz NXRJBAASCRLOBX-UHFFFAOYSA-N 1 2 323.371 4.393 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+][C@@H](Cc1ccccc1)c1ncco1)CC2 ZINC000653911685 1047432757 /nfs/dbraw/zinc/43/27/57/1047432757.db2.gz JHSPHLZJBZYJSP-OALUTQOASA-N 1 2 322.383 4.375 20 0 DIADLO CSc1ncc(C[N@H+](Cc2ccccc2)C(C)C)c(Cl)n1 ZINC001142408539 1047442483 /nfs/dbraw/zinc/44/24/83/1047442483.db2.gz QBTUCDKYUPNNKB-UHFFFAOYSA-N 1 2 321.877 4.263 20 0 DIADLO CSc1ncc(C[N@@H+](Cc2ccccc2)C(C)C)c(Cl)n1 ZINC001142408539 1047442489 /nfs/dbraw/zinc/44/24/89/1047442489.db2.gz QBTUCDKYUPNNKB-UHFFFAOYSA-N 1 2 321.877 4.263 20 0 DIADLO CC[N@H+](Cc1ccc(C)cc1)Cc1cnc(SC)nc1Cl ZINC001142435498 1047448603 /nfs/dbraw/zinc/44/86/03/1047448603.db2.gz LWPKDGZJAMCNGN-UHFFFAOYSA-N 1 2 321.877 4.182 20 0 DIADLO CC[N@@H+](Cc1ccc(C)cc1)Cc1cnc(SC)nc1Cl ZINC001142435498 1047448604 /nfs/dbraw/zinc/44/86/04/1047448604.db2.gz LWPKDGZJAMCNGN-UHFFFAOYSA-N 1 2 321.877 4.182 20 0 DIADLO CC1(C)C(=O)N(C[N@@H+]2CC[C@H]2c2ccccc2)[C@H]1c1ccccc1 ZINC000749940229 1047450982 /nfs/dbraw/zinc/45/09/82/1047450982.db2.gz YCTMCDTYOUSHLY-OALUTQOASA-N 1 2 320.436 4.001 20 0 DIADLO CC1(C)C(=O)N(C[N@H+]2CC[C@H]2c2ccccc2)[C@H]1c1ccccc1 ZINC000749940229 1047450985 /nfs/dbraw/zinc/45/09/85/1047450985.db2.gz YCTMCDTYOUSHLY-OALUTQOASA-N 1 2 320.436 4.001 20 0 DIADLO C[N@H+](Cc1ccc[nH]1)Cc1ccc(Br)cc1Cl ZINC000537622981 1047475580 /nfs/dbraw/zinc/47/55/80/1047475580.db2.gz QJFLAJOAQINFOB-UHFFFAOYSA-N 1 2 313.626 4.063 20 0 DIADLO CC1(C)CC[N@@H+]1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000537633416 1047507562 /nfs/dbraw/zinc/50/75/62/1047507562.db2.gz ORDSXDXYZWXOIY-UHFFFAOYSA-N 1 2 322.861 4.360 20 0 DIADLO CC1(C)CC[N@H+]1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000537633416 1047507575 /nfs/dbraw/zinc/50/75/75/1047507575.db2.gz ORDSXDXYZWXOIY-UHFFFAOYSA-N 1 2 322.861 4.360 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C3CCC(F)(F)CC3)cc2)C[C@@H](C)O1 ZINC000842862543 1047509906 /nfs/dbraw/zinc/50/99/06/1047509906.db2.gz RZYCMLYXYKWCHY-ZIAGYGMSSA-N 1 2 324.415 4.290 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@@H](C)c2cncc(F)c2)c2ccccn2)c1 ZINC000090945790 1047514055 /nfs/dbraw/zinc/51/40/55/1047514055.db2.gz PISMLWXJDPBLEY-YWZLYKJASA-N 1 2 321.399 4.364 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1csc(-c2ccsc2)n1 ZINC000091990592 1047527161 /nfs/dbraw/zinc/52/71/61/1047527161.db2.gz OYFKQTSSVXWXCX-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1csc(-c2ccsc2)n1 ZINC000091990592 1047527169 /nfs/dbraw/zinc/52/71/69/1047527169.db2.gz OYFKQTSSVXWXCX-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO CC[C@@H](NC(=O)[C@H](CC(C)C)n1cc[nH+]c1)c1ccc(C)cc1 ZINC001143084290 1047529662 /nfs/dbraw/zinc/52/96/62/1047529662.db2.gz TZPKPYZGXQWGDN-MSOLQXFVSA-N 1 2 313.445 4.046 20 0 DIADLO Cc1nc([C@@H]([NH2+]C[C@H]2CC=CCC2)c2ccc(Cl)cc2)no1 ZINC000092441403 1047533630 /nfs/dbraw/zinc/53/36/30/1047533630.db2.gz IJFODXIQWWKVEH-BBRMVZONSA-N 1 2 317.820 4.067 20 0 DIADLO C[N@H+](CCC(F)(F)F)Cc1nc(-c2ccccc2)cs1 ZINC000092478904 1047534147 /nfs/dbraw/zinc/53/41/47/1047534147.db2.gz XXJHUVSFBVSMTO-UHFFFAOYSA-N 1 2 300.349 4.194 20 0 DIADLO C[N@@H+](CCC(F)(F)F)Cc1nc(-c2ccccc2)cs1 ZINC000092478904 1047534150 /nfs/dbraw/zinc/53/41/50/1047534150.db2.gz XXJHUVSFBVSMTO-UHFFFAOYSA-N 1 2 300.349 4.194 20 0 DIADLO FC(F)c1ccc(C[NH+]2CC(OCc3ccccc3)C2)cc1 ZINC001143251314 1047544389 /nfs/dbraw/zinc/54/43/89/1047544389.db2.gz OUPIRDNRKAVVCI-UHFFFAOYSA-N 1 2 303.352 4.025 20 0 DIADLO COc1c(F)ccc(C[N@H+]2Cc3ccccc3[C@H](C)C2)c1F ZINC001143320211 1047553091 /nfs/dbraw/zinc/55/30/91/1047553091.db2.gz GIHRLATXRJKBQB-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(F)ccc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c1F ZINC001143320211 1047553094 /nfs/dbraw/zinc/55/30/94/1047553094.db2.gz GIHRLATXRJKBQB-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1ccc(F)c(OC)c1F ZINC001143321387 1047553166 /nfs/dbraw/zinc/55/31/66/1047553166.db2.gz FJNMOHBODIPFOH-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1ccc(F)c(OC)c1F ZINC001143321387 1047553172 /nfs/dbraw/zinc/55/31/72/1047553172.db2.gz FJNMOHBODIPFOH-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO COc1cc(C[N@@H+]2CCn3cccc3[C@H]2C)ccc1C(F)(F)F ZINC001143349630 1047553877 /nfs/dbraw/zinc/55/38/77/1047553877.db2.gz MKYVZPQOFDHQRN-GFCCVEGCSA-N 1 2 324.346 4.092 20 0 DIADLO COc1cc(C[N@H+]2CCn3cccc3[C@H]2C)ccc1C(F)(F)F ZINC001143349630 1047553884 /nfs/dbraw/zinc/55/38/84/1047553884.db2.gz MKYVZPQOFDHQRN-GFCCVEGCSA-N 1 2 324.346 4.092 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[N@H+](C)[C@H](C)c1ccco1 ZINC000122983689 1047566534 /nfs/dbraw/zinc/56/65/34/1047566534.db2.gz CQEAMEXPORZEPE-CQSZACIVSA-N 1 2 300.402 4.035 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[N@@H+](C)[C@H](C)c1ccco1 ZINC000122983689 1047566540 /nfs/dbraw/zinc/56/65/40/1047566540.db2.gz CQEAMEXPORZEPE-CQSZACIVSA-N 1 2 300.402 4.035 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2cccc(O)c2Br)c(C)o1 ZINC000315048129 1047595997 /nfs/dbraw/zinc/59/59/97/1047595997.db2.gz RNHQHNNAOBELMT-JTQLQIEISA-N 1 2 324.218 4.215 20 0 DIADLO Clc1ccc(N2CC[C@@H](Nc3cccc[nH+]3)C2)cc1Cl ZINC000477136218 1047596520 /nfs/dbraw/zinc/59/65/20/1047596520.db2.gz KKROLZORHJGKSK-LLVKDONJSA-N 1 2 308.212 4.079 20 0 DIADLO CC[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1ccc(C)cc1C ZINC001151980105 1047605383 /nfs/dbraw/zinc/60/53/83/1047605383.db2.gz ZOCJJFJVWMQLTQ-MRXNPFEDSA-N 1 2 307.397 4.061 20 0 DIADLO Cc1ccc(Nc2ccc(N3CCSCC3)c(F)c2)c(C)[nH+]1 ZINC001203375829 1047609898 /nfs/dbraw/zinc/60/98/98/1047609898.db2.gz CQGHROMALFBVFS-UHFFFAOYSA-N 1 2 317.433 4.134 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3CCCC3(C)C)cc2)[nH+]c1C ZINC001153556986 1047627793 /nfs/dbraw/zinc/62/77/93/1047627793.db2.gz SRCVVHJYLWKETE-INIZCTEOSA-N 1 2 311.429 4.458 20 0 DIADLO CC(C)c1cccc2cc(C(=O)Nc3ccn4cc[nH+]c4c3)[nH]c21 ZINC001154099014 1047639679 /nfs/dbraw/zinc/63/96/79/1047639679.db2.gz CYBZSTANTDRJBB-UHFFFAOYSA-N 1 2 318.380 4.191 20 0 DIADLO CO[C@H](c1ccc(Br)cc1)[C@@H](C)Nc1cccc[nH+]1 ZINC000538004528 1047652946 /nfs/dbraw/zinc/65/29/46/1047652946.db2.gz PNQQMWZWTDKCCG-ABAIWWIYSA-N 1 2 321.218 4.032 20 0 DIADLO CO[C@H](c1ccc(Br)cc1)[C@H](C)Nc1cccc[nH+]1 ZINC000538004533 1047652987 /nfs/dbraw/zinc/65/29/87/1047652987.db2.gz PNQQMWZWTDKCCG-NHYWBVRUSA-N 1 2 321.218 4.032 20 0 DIADLO CSCc1cc[nH+]c(NCc2cccc(OC(F)F)c2)c1 ZINC001154670965 1047654101 /nfs/dbraw/zinc/65/41/01/1047654101.db2.gz XKWRPMLSCIEHRB-UHFFFAOYSA-N 1 2 310.369 4.158 20 0 DIADLO FC1=CCC[N@H+](CCOC(c2ccccc2)c2ccccc2)C1 ZINC000538094815 1047657018 /nfs/dbraw/zinc/65/70/18/1047657018.db2.gz NRTHCNLPSZEBFB-UHFFFAOYSA-N 1 2 311.400 4.352 20 0 DIADLO FC1=CCC[N@@H+](CCOC(c2ccccc2)c2ccccc2)C1 ZINC000538094815 1047657019 /nfs/dbraw/zinc/65/70/19/1047657019.db2.gz NRTHCNLPSZEBFB-UHFFFAOYSA-N 1 2 311.400 4.352 20 0 DIADLO Clc1cc(-c2cc[nH+]c(NCCC3CCOCC3)c2)ccn1 ZINC001154843274 1047658893 /nfs/dbraw/zinc/65/88/93/1047658893.db2.gz OZSWPCMLHCIEHM-UHFFFAOYSA-N 1 2 317.820 4.026 20 0 DIADLO CCSc1cc[nH+]c(NCc2cnccc2C(F)(F)F)c1 ZINC001154905400 1047661524 /nfs/dbraw/zinc/66/15/24/1047661524.db2.gz HHIAYTWNKHFNEN-UHFFFAOYSA-N 1 2 313.348 4.220 20 0 DIADLO CC(=O)c1ccc2c(c1)CN(c1[nH+]c(C)cc(Cl)c1C)CC2 ZINC001155079066 1047667511 /nfs/dbraw/zinc/66/75/11/1047667511.db2.gz CVTJPDKKAKHHKB-UHFFFAOYSA-N 1 2 314.816 4.117 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(COCc2ccccc2)c1)c1ncco1 ZINC000924660241 1047668589 /nfs/dbraw/zinc/66/85/89/1047668589.db2.gz JMXWSSUCYXXBOD-MRXNPFEDSA-N 1 2 322.408 4.242 20 0 DIADLO Cc1cc(C)c(CNc2cc(C)c3cccc(C)c3[nH+]2)c(=O)[nH]1 ZINC001155131612 1047668777 /nfs/dbraw/zinc/66/87/77/1047668777.db2.gz ZXANEZUOQFKWNV-UHFFFAOYSA-N 1 2 307.397 4.181 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1nc(-c2ccccn2)nc2sccc21 ZINC001155181678 1047670811 /nfs/dbraw/zinc/67/08/11/1047670811.db2.gz ODWWEKBSNHQDFE-UHFFFAOYSA-N 1 2 311.414 4.189 20 0 DIADLO COc1ccc(C)[nH+]c1N1CCC(n2ccc3ccccc32)CC1 ZINC001155252928 1047673585 /nfs/dbraw/zinc/67/35/85/1047673585.db2.gz DKXIEIVCIXFOEP-UHFFFAOYSA-N 1 2 321.424 4.195 20 0 DIADLO COc1cc(C)c[nH+]c1N1CCC(n2ccc3ccccc32)CC1 ZINC001155262574 1047674287 /nfs/dbraw/zinc/67/42/87/1047674287.db2.gz DGKXIQDNKLRZRN-UHFFFAOYSA-N 1 2 321.424 4.195 20 0 DIADLO Cc1c(F)cc[nH+]c1NCc1ccc(C(=O)OC(C)(C)C)cc1 ZINC001155296497 1047675679 /nfs/dbraw/zinc/67/56/79/1047675679.db2.gz UBSYRMQHCKOZBH-UHFFFAOYSA-N 1 2 316.376 4.097 20 0 DIADLO COc1ccc(CCNc2cc(-c3ccccc3)cc[nH+]2)cc1O ZINC001155882750 1047690584 /nfs/dbraw/zinc/69/05/84/1047690584.db2.gz XDFZGVXUFGJAQB-UHFFFAOYSA-N 1 2 320.392 4.117 20 0 DIADLO [NH2+]=C(Nc1ncnc2ccccc21)C12CC3CC(CC(C3)C1)C2 ZINC001155955658 1047692960 /nfs/dbraw/zinc/69/29/60/1047692960.db2.gz AMDSUQXMJYGONH-UHFFFAOYSA-N 1 2 306.413 4.235 20 0 DIADLO COc1cc(Cl)cnc1NC(=[NH2+])C12CC3CC(CC(C3)C1)C2 ZINC001155956165 1047692967 /nfs/dbraw/zinc/69/29/67/1047692967.db2.gz LUOSONQGBHGTLN-UHFFFAOYSA-N 1 2 319.836 4.349 20 0 DIADLO Clc1ccc2c(cc[nH+]c2NC[C@@H]2Cc3ccccc3O2)c1 ZINC001155971546 1047694321 /nfs/dbraw/zinc/69/43/21/1047694321.db2.gz WELIPQSHOZSALZ-HNNXBMFYSA-N 1 2 310.784 4.304 20 0 DIADLO Cc1cc(N(C)CC/C=C/c2cccnc2)[nH+]c2ccccc12 ZINC001155971206 1047694387 /nfs/dbraw/zinc/69/43/87/1047694387.db2.gz PQUYSJWTMWNJSJ-VMPITWQZSA-N 1 2 303.409 4.478 20 0 DIADLO c1ccc(-c2cc[nH+]c(NC[C@@H]3Cc4ccccc4O3)c2)cc1 ZINC001155969390 1047694421 /nfs/dbraw/zinc/69/44/21/1047694421.db2.gz BHTRUJQQCBPQLQ-SFHVURJKSA-N 1 2 302.377 4.164 20 0 DIADLO Cc1cc(N(C)CC/C=C/c2cccnc2)nc(C(C)(C)C)[nH+]1 ZINC001155977601 1047695200 /nfs/dbraw/zinc/69/52/00/1047695200.db2.gz WDPSIBLTTLZHEW-RMKNXTFCSA-N 1 2 310.445 4.017 20 0 DIADLO Cc1cc(N[C@H](c2ccccc2)c2ccncc2)nc(C2CC2)[nH+]1 ZINC001156094915 1047699967 /nfs/dbraw/zinc/69/99/67/1047699967.db2.gz GUFOIIBLSVTILR-LJQANCHMSA-N 1 2 316.408 4.259 20 0 DIADLO c1ccn(CCNc2cc(SCc3ccccc3)cc[nH+]2)c1 ZINC001156303440 1047706743 /nfs/dbraw/zinc/70/67/43/1047706743.db2.gz XMFFZCOXLBVRGB-UHFFFAOYSA-N 1 2 309.438 4.288 20 0 DIADLO COCC(C)(C)Nc1cc(SCc2ccccc2)cc[nH+]1 ZINC001156462229 1047712898 /nfs/dbraw/zinc/71/28/98/1047712898.db2.gz AHXGZVXKGLIQKZ-UHFFFAOYSA-N 1 2 302.443 4.211 20 0 DIADLO CC1(C)CN(c2[nH+]ccc3cc(Cl)ccc32)CC(C)(C)O1 ZINC001156454058 1047712939 /nfs/dbraw/zinc/71/29/39/1047712939.db2.gz WTDPDAWWEWNYAV-UHFFFAOYSA-N 1 2 304.821 4.282 20 0 DIADLO COC(C)(C)CNc1cc(SCc2ccccc2)cc[nH+]1 ZINC001156439637 1047713090 /nfs/dbraw/zinc/71/30/90/1047713090.db2.gz FFSASTUGNXJJNI-UHFFFAOYSA-N 1 2 302.443 4.211 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H](C)c3ccc(F)cn3)cc(C)c2c1 ZINC001156679070 1047719833 /nfs/dbraw/zinc/71/98/33/1047719833.db2.gz GENRQLQWNANESE-LBPRGKRZSA-N 1 2 311.360 4.259 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NC1CC(C)(C)N(O)C(C)(C)C1 ZINC001156887687 1047726791 /nfs/dbraw/zinc/72/67/91/1047726791.db2.gz YPRKVZFMFNVBKI-UHFFFAOYSA-N 1 2 313.445 4.366 20 0 DIADLO COc1ccc2[nH+]c(NC3(c4ccccn4)CC3)c(C)cc2c1 ZINC001157373381 1047741216 /nfs/dbraw/zinc/74/12/16/1047741216.db2.gz UGNRXZQVAIBQLI-UHFFFAOYSA-N 1 2 305.381 4.048 20 0 DIADLO Cn1cc2cccc(CNc3cc(-c4ccccc4)cc[nH+]3)c2n1 ZINC001157415467 1047743279 /nfs/dbraw/zinc/74/32/79/1047743279.db2.gz KXTSKASQXOHGLO-UHFFFAOYSA-N 1 2 314.392 4.247 20 0 DIADLO Nc1ccc(C2CCN(c3cc4ccccc4c[nH+]3)CC2)cc1 ZINC001157698226 1047750194 /nfs/dbraw/zinc/75/01/94/1047750194.db2.gz BVMOXGKSGGEXBS-UHFFFAOYSA-N 1 2 303.409 4.201 20 0 DIADLO COc1c[nH+]c(NCc2cccc(C(F)(F)F)c2C)c(C)c1 ZINC001157737461 1047751763 /nfs/dbraw/zinc/75/17/63/1047751763.db2.gz ZACLDVMLPMSGFG-UHFFFAOYSA-N 1 2 310.319 4.338 20 0 DIADLO CCCc1ccc(CNc2[nH+]cc(C)cc2/C=C/C(=O)OC)cc1 ZINC001157829370 1047756446 /nfs/dbraw/zinc/75/64/46/1047756446.db2.gz MMRDXBZSGIPZQR-ZHACJKMWSA-N 1 2 324.424 4.141 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@H]3CC[C@H](C)SC3)cc2)c1C ZINC000655776815 1047762143 /nfs/dbraw/zinc/76/21/43/1047762143.db2.gz PICLZIUGNZFTQW-LRDDRELGSA-N 1 2 301.459 4.185 20 0 DIADLO Cc1ccc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)cc1C ZINC000478006541 1047763275 /nfs/dbraw/zinc/76/32/75/1047763275.db2.gz ZVNJGECWZRGRJJ-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H](C)c3ccc(C)cn3)c(C)cc2c1 ZINC001158012225 1047767528 /nfs/dbraw/zinc/76/75/28/1047767528.db2.gz JQRUGQWHRPYDNT-AWEZNQCLSA-N 1 2 307.397 4.428 20 0 DIADLO CSc1cc[nH+]c(NCCOc2cccc3ccccc32)c1 ZINC001158151835 1047769687 /nfs/dbraw/zinc/76/96/87/1047769687.db2.gz FZTKCXWUHFEQOD-UHFFFAOYSA-N 1 2 310.422 4.448 20 0 DIADLO COc1ccc2oc(CNc3ccc(N4CCCC4)c[nH+]3)cc2c1 ZINC000478190855 1047772539 /nfs/dbraw/zinc/77/25/39/1047772539.db2.gz PXFYGOBZGXLINB-UHFFFAOYSA-N 1 2 323.396 4.049 20 0 DIADLO CCOC(=O)/C=C/c1ccc[nH+]c1N[C@H]1C[C@H](C)c2ccccc21 ZINC001158469218 1047781704 /nfs/dbraw/zinc/78/17/04/1047781704.db2.gz RTBHKMFVLFVHIE-QUMLYMBLSA-N 1 2 322.408 4.318 20 0 DIADLO COC(OC)c1cc(C)c[nH+]c1N[C@H]1C[C@@H](C)c2ccccc21 ZINC001158471783 1047783113 /nfs/dbraw/zinc/78/31/13/1047783113.db2.gz JACVJKSPCOAENJ-DYVFJYSZSA-N 1 2 312.413 4.342 20 0 DIADLO COC(OC)c1cc(C)c[nH+]c1N[C@H]1C[C@H](C)c2ccccc21 ZINC001158471784 1047783276 /nfs/dbraw/zinc/78/32/76/1047783276.db2.gz JACVJKSPCOAENJ-GUYCJALGSA-N 1 2 312.413 4.342 20 0 DIADLO CC(C)N(Cc1c[nH+]cn1C)Cc1c(Cl)cccc1Cl ZINC001204385097 1047786004 /nfs/dbraw/zinc/78/60/04/1047786004.db2.gz BTBVKAUAKXARFT-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO COC(=O)c1ccc([C@@H]2CCCN2c2cccc(C3CC3)[nH+]2)cc1 ZINC001158598321 1047789917 /nfs/dbraw/zinc/78/99/17/1047789917.db2.gz NOUQRLURLAARJE-SFHVURJKSA-N 1 2 322.408 4.087 20 0 DIADLO O[C@@H]1c2ccccc2CC[C@@H]1Nc1[nH+]ccc2cc(Cl)ccc21 ZINC001158686859 1047794246 /nfs/dbraw/zinc/79/42/46/1047794246.db2.gz YXRDTRDFCSZPDA-ZWKOTPCHSA-N 1 2 324.811 4.349 20 0 DIADLO COCc1cc[nH+]c(NC2(c3ccccc3C(F)(F)F)CC2)c1 ZINC001158689103 1047795024 /nfs/dbraw/zinc/79/50/24/1047795024.db2.gz UDTAREJJWRHKAQ-UHFFFAOYSA-N 1 2 322.330 4.348 20 0 DIADLO Cc1cccc2c(C)cc(N3Cc4cnc(Cl)cc4C3)[nH+]c12 ZINC001158753834 1047797136 /nfs/dbraw/zinc/79/71/36/1047797136.db2.gz LGZUXKNDUAVQPR-UHFFFAOYSA-N 1 2 309.800 4.420 20 0 DIADLO CSCc1cc[nH+]c(N[C@@H]2CCO[C@@H](c3ccccc3)C2)c1 ZINC001158795358 1047799297 /nfs/dbraw/zinc/79/92/97/1047799297.db2.gz GDRWGXCQOVXLHY-IAGOWNOFSA-N 1 2 314.454 4.277 20 0 DIADLO CCOc1ccccc1OCCNc1cc2ccccc2c[nH+]1 ZINC001158820387 1047800852 /nfs/dbraw/zinc/80/08/52/1047800852.db2.gz BVCDMZRPWRWSKY-UHFFFAOYSA-N 1 2 308.381 4.124 20 0 DIADLO CC[N@H+](Cc1nnc(C)s1)C(c1ccccc1)c1ccccc1 ZINC000552963444 1047811181 /nfs/dbraw/zinc/81/11/81/1047811181.db2.gz IQUCTHJFKSUTPW-UHFFFAOYSA-N 1 2 323.465 4.458 20 0 DIADLO CC[N@@H+](Cc1nnc(C)s1)C(c1ccccc1)c1ccccc1 ZINC000552963444 1047811188 /nfs/dbraw/zinc/81/11/88/1047811188.db2.gz IQUCTHJFKSUTPW-UHFFFAOYSA-N 1 2 323.465 4.458 20 0 DIADLO CN(c1ccc(NCc2ccccc2)cc1)c1[nH+]cccc1N ZINC001159117963 1047814242 /nfs/dbraw/zinc/81/42/42/1047814242.db2.gz QGIYJIPYBKMJOT-UHFFFAOYSA-N 1 2 304.397 4.044 20 0 DIADLO Cc1cc(O)c[nH+]c1Nc1ccc(NCc2ccccc2)cc1 ZINC001159124118 1047814764 /nfs/dbraw/zinc/81/47/64/1047814764.db2.gz QRJOXDRQHSVKRY-UHFFFAOYSA-N 1 2 305.381 4.451 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCc3ncc(Cl)s3)c2c1 ZINC000478928857 1047824782 /nfs/dbraw/zinc/82/47/82/1047824782.db2.gz OFAGMUGBUBGDBY-UHFFFAOYSA-N 1 2 320.801 4.241 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000479069700 1047835442 /nfs/dbraw/zinc/83/54/42/1047835442.db2.gz OJFSHUCTKAOXOI-CQSZACIVSA-N 1 2 309.388 4.409 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000479069700 1047835449 /nfs/dbraw/zinc/83/54/49/1047835449.db2.gz OJFSHUCTKAOXOI-CQSZACIVSA-N 1 2 309.388 4.409 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@@H]2CCc3ccc(Cl)nc32)c(F)c1 ZINC000927092838 1047840429 /nfs/dbraw/zinc/84/04/29/1047840429.db2.gz FSPJITFYOXKIDB-CQSZACIVSA-N 1 2 308.759 4.099 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC000924719033 1047854199 /nfs/dbraw/zinc/85/41/99/1047854199.db2.gz WZVUCNBUMAYXFM-INIZCTEOSA-N 1 2 308.381 4.410 20 0 DIADLO Cc1ccc(Nc2ccc(OC[C@H]3CCCO3)c(F)c2)c(C)[nH+]1 ZINC001203374044 1047858335 /nfs/dbraw/zinc/85/83/35/1047858335.db2.gz RIRZUMFWJYRVOT-OAHLLOKOSA-N 1 2 316.376 4.139 20 0 DIADLO O=C1CCCc2cc(Nc3ccc([NH+]4CCCC4)cc3)ccc2N1 ZINC001174529078 1047859185 /nfs/dbraw/zinc/85/91/85/1047859185.db2.gz CPZJNCOGZBCSTC-UHFFFAOYSA-N 1 2 321.424 4.305 20 0 DIADLO Cc1c(Br)cncc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000667463954 1047866653 /nfs/dbraw/zinc/86/66/53/1047866653.db2.gz DFMSJTVYUQHDRP-INIZCTEOSA-N 1 2 317.230 4.100 20 0 DIADLO Cc1c(Br)cncc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000667463954 1047866670 /nfs/dbraw/zinc/86/66/70/1047866670.db2.gz DFMSJTVYUQHDRP-INIZCTEOSA-N 1 2 317.230 4.100 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@H+]2C[C@H](C)O[C@@](C)(C(F)F)C2)cc1C ZINC001182970252 1047871146 /nfs/dbraw/zinc/87/11/46/1047871146.db2.gz LZCLVIOFGOQJLL-CIHFUWIRSA-N 1 2 323.427 4.370 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@@H+]2C[C@H](C)O[C@@](C)(C(F)F)C2)cc1C ZINC001182970252 1047871152 /nfs/dbraw/zinc/87/11/52/1047871152.db2.gz LZCLVIOFGOQJLL-CIHFUWIRSA-N 1 2 323.427 4.370 20 0 DIADLO Cc1ccc(C[N@@H+](CCCC(C)C)Cc2cc3n(n2)CCC3)o1 ZINC001197778539 1047880156 /nfs/dbraw/zinc/88/01/56/1047880156.db2.gz WLPAQTRFPHQQLW-UHFFFAOYSA-N 1 2 315.461 4.169 20 0 DIADLO Cc1ccc(C[N@H+](CCCC(C)C)Cc2cc3n(n2)CCC3)o1 ZINC001197778539 1047880170 /nfs/dbraw/zinc/88/01/70/1047880170.db2.gz WLPAQTRFPHQQLW-UHFFFAOYSA-N 1 2 315.461 4.169 20 0 DIADLO CCNC(=O)Nc1ccc(Nc2c(C)cc[nH+]c2C(C)C)cc1 ZINC001174519575 1047880863 /nfs/dbraw/zinc/88/08/63/1047880863.db2.gz NZBSBEDEVXGQNU-UHFFFAOYSA-N 1 2 312.417 4.398 20 0 DIADLO CC(=O)c1ccsc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174521810 1047882159 /nfs/dbraw/zinc/88/21/59/1047882159.db2.gz AFRSRFPBSARQSG-UHFFFAOYSA-N 1 2 301.415 4.080 20 0 DIADLO Fc1ccc(F)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1F ZINC001174522965 1047885215 /nfs/dbraw/zinc/88/52/15/1047885215.db2.gz ZWWJKGVRGCAZHX-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO c1nc(C2CC2)c(Nc2ccc(N3CCCCC3)[nH+]c2)s1 ZINC001174522015 1047885329 /nfs/dbraw/zinc/88/53/29/1047885329.db2.gz GTKIVJSHTRSSBE-UHFFFAOYSA-N 1 2 300.431 4.149 20 0 DIADLO CC(=O)c1cc(Nc2ccc(N3CCCCC3)[nH+]c2)ccc1F ZINC001174524148 1047886656 /nfs/dbraw/zinc/88/66/56/1047886656.db2.gz GRAUDNUYDDAVHD-UHFFFAOYSA-N 1 2 313.376 4.157 20 0 DIADLO CCn1ncc2cc(Nc3ccc(N4CCCCC4)[nH+]c3)ccc21 ZINC001174523893 1047886719 /nfs/dbraw/zinc/88/67/19/1047886719.db2.gz XGJRVZPNULCGMU-UHFFFAOYSA-N 1 2 321.428 4.185 20 0 DIADLO COc1cccc(Nc2ccc(N3CCCCC3)[nH+]c2)c1Cl ZINC001174524126 1047887730 /nfs/dbraw/zinc/88/77/30/1047887730.db2.gz FTQPUZQPZNKNLV-UHFFFAOYSA-N 1 2 317.820 4.478 20 0 DIADLO Oc1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)cc1Cl ZINC001174524205 1047888175 /nfs/dbraw/zinc/88/81/75/1047888175.db2.gz IRJRXXNYBBOZCL-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO c1ncc(-c2cccc(Nc3ccc(N4CCCCC4)[nH+]c3)c2)o1 ZINC001174525215 1047888840 /nfs/dbraw/zinc/88/88/40/1047888840.db2.gz ZUAPOLCPUXUEDL-UHFFFAOYSA-N 1 2 320.396 4.471 20 0 DIADLO FC(F)(F)[C@H]1C[N@@H+]([C@H]2CCc3cc(Cl)ccc32)CCS1 ZINC001197817647 1047889606 /nfs/dbraw/zinc/88/96/06/1047889606.db2.gz DNECAIIPURLIQB-QWHCGFSZSA-N 1 2 321.795 4.307 20 0 DIADLO FC(F)(F)[C@H]1C[N@H+]([C@H]2CCc3cc(Cl)ccc32)CCS1 ZINC001197817647 1047889621 /nfs/dbraw/zinc/88/96/21/1047889621.db2.gz DNECAIIPURLIQB-QWHCGFSZSA-N 1 2 321.795 4.307 20 0 DIADLO FC(F)(F)[C@@H]1C[N@@H+]([C@H]2CCc3cc(Cl)ccc32)CCS1 ZINC001197817648 1047889757 /nfs/dbraw/zinc/88/97/57/1047889757.db2.gz DNECAIIPURLIQB-STQMWFEESA-N 1 2 321.795 4.307 20 0 DIADLO FC(F)(F)[C@@H]1C[N@H+]([C@H]2CCc3cc(Cl)ccc32)CCS1 ZINC001197817648 1047889774 /nfs/dbraw/zinc/88/97/74/1047889774.db2.gz DNECAIIPURLIQB-STQMWFEESA-N 1 2 321.795 4.307 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1cc(F)ccc1F ZINC000927106687 1047897498 /nfs/dbraw/zinc/89/74/98/1047897498.db2.gz BXJAHMXPNRMCOU-SFHVURJKSA-N 1 2 319.399 4.063 20 0 DIADLO Cc1[nH+]cc(CN([C@@H](C)c2ccc(Cl)cc2)C2CC2)n1C ZINC000667497713 1047908104 /nfs/dbraw/zinc/90/81/04/1047908104.db2.gz LZKCZSBSFLZFOZ-LBPRGKRZSA-N 1 2 303.837 4.108 20 0 DIADLO CC(C)C(=O)Nc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC001197961520 1047908338 /nfs/dbraw/zinc/90/83/38/1047908338.db2.gz BSZPMTMKBCRNLC-UHFFFAOYSA-N 1 2 324.428 4.020 20 0 DIADLO Cc1c2ccccc2sc1CC(=O)Nc1cccc2[nH+]ccn21 ZINC001183241311 1047910089 /nfs/dbraw/zinc/91/00/89/1047910089.db2.gz LMPLNGNKJXUMFG-UHFFFAOYSA-N 1 2 321.405 4.039 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2cc(F)ccc2O)cc[nH+]1 ZINC001174627157 1047914112 /nfs/dbraw/zinc/91/41/12/1047914112.db2.gz PODGMZXESKWSEI-UHFFFAOYSA-N 1 2 319.336 4.017 20 0 DIADLO Cc1csc2sc(C[N@@H+]3C[C@H](C)CC[C@H]3C[NH3+])c(C)c12 ZINC001205827265 1047928027 /nfs/dbraw/zinc/92/80/27/1047928027.db2.gz GDPNZMBPDORKPO-MFKMUULPSA-N 1 2 308.516 4.139 20 0 DIADLO Cc1csc2sc(C[N@H+]3C[C@H](C)CC[C@H]3C[NH3+])c(C)c12 ZINC001205827265 1047928033 /nfs/dbraw/zinc/92/80/33/1047928033.db2.gz GDPNZMBPDORKPO-MFKMUULPSA-N 1 2 308.516 4.139 20 0 DIADLO COc1cccc(C[N@@H+]2CCCC[C@H]2c2cc(C)n[nH]2)c1Cl ZINC001198129943 1047928352 /nfs/dbraw/zinc/92/83/52/1047928352.db2.gz BPGVXGDEWIQMBX-HNNXBMFYSA-N 1 2 319.836 4.107 20 0 DIADLO COc1cccc(C[N@H+]2CCCC[C@H]2c2cc(C)n[nH]2)c1Cl ZINC001198129943 1047928367 /nfs/dbraw/zinc/92/83/67/1047928367.db2.gz BPGVXGDEWIQMBX-HNNXBMFYSA-N 1 2 319.836 4.107 20 0 DIADLO CCSCc1ccc[nH+]c1N[C@@H](C)CCc1ccc(O)cc1 ZINC001183491068 1047930239 /nfs/dbraw/zinc/93/02/39/1047930239.db2.gz MXMYIPFMAJCOFU-AWEZNQCLSA-N 1 2 316.470 4.474 20 0 DIADLO COc1c(F)ccc(F)c1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001174661575 1047938603 /nfs/dbraw/zinc/93/86/03/1047938603.db2.gz LDKMKZCIODBPEX-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO Cc1c(F)cc[nH+]c1NCc1cc(-c2cccc(Cl)c2)no1 ZINC001159884134 1047941671 /nfs/dbraw/zinc/94/16/71/1047941671.db2.gz BBGUSJUFSSYSKL-UHFFFAOYSA-N 1 2 317.751 4.450 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N[C@@H]1CCc2ccc(O)cc2C1 ZINC001159893303 1047943553 /nfs/dbraw/zinc/94/35/53/1047943553.db2.gz XZRIXFNUOUWWMB-QGZVFWFLSA-N 1 2 304.393 4.218 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3ncc(-c4cccs4)o3)CC2)cc1 ZINC000553824837 1047950443 /nfs/dbraw/zinc/95/04/43/1047950443.db2.gz JCKZNHQVYVWMLC-UHFFFAOYSA-N 1 2 314.385 4.321 20 0 DIADLO COc1cc(Nc2ccc3c(c2)CCCO3)[nH+]cc1C(F)(F)F ZINC001174720678 1047953029 /nfs/dbraw/zinc/95/30/29/1047953029.db2.gz HWWPCQTXXUXVAH-UHFFFAOYSA-N 1 2 324.302 4.178 20 0 DIADLO Cc1[nH+]c2c(NC(=S)Nc3ccccc3C)cccn2c1C ZINC001198405389 1047954325 /nfs/dbraw/zinc/95/43/25/1047954325.db2.gz WLAVYPMBYPSTET-UHFFFAOYSA-N 1 2 310.426 4.068 20 0 DIADLO COC(=O)c1cccc([C@H](C)Nc2cc3ccccc3c[nH+]2)c1 ZINC001159954244 1047957180 /nfs/dbraw/zinc/95/71/80/1047957180.db2.gz IMIWARCARDYMFF-ZDUSSCGKSA-N 1 2 306.365 4.195 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)[C@@H]2CC[N@@H+]2Cc2ccccc2)cc1 ZINC001183745272 1047962817 /nfs/dbraw/zinc/96/28/17/1047962817.db2.gz QZCWTAIVCNTODM-JXFKEZNVSA-N 1 2 322.452 4.413 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)[C@@H]2CC[N@H+]2Cc2ccccc2)cc1 ZINC001183745272 1047962826 /nfs/dbraw/zinc/96/28/26/1047962826.db2.gz QZCWTAIVCNTODM-JXFKEZNVSA-N 1 2 322.452 4.413 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCOC[C@]2(C)C2CC2)cc1Cl ZINC001198497817 1047965664 /nfs/dbraw/zinc/96/56/64/1047965664.db2.gz AIKQUTKDGCYSOZ-GOSISDBHSA-N 1 2 323.864 4.128 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCOC[C@]2(C)C2CC2)cc1Cl ZINC001198497817 1047965669 /nfs/dbraw/zinc/96/56/69/1047965669.db2.gz AIKQUTKDGCYSOZ-GOSISDBHSA-N 1 2 323.864 4.128 20 0 DIADLO FC(F)(F)c1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC001174773110 1047966493 /nfs/dbraw/zinc/96/64/93/1047966493.db2.gz ORXCEMMUJDFWTD-UHFFFAOYSA-N 1 2 307.319 4.444 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(F)c(F)c2F)cc1 ZINC000667554846 1047969920 /nfs/dbraw/zinc/96/99/20/1047969920.db2.gz GYGGVSRLJXKWCH-HNNXBMFYSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(F)c(F)c2F)cc1 ZINC000667554846 1047969926 /nfs/dbraw/zinc/96/99/26/1047969926.db2.gz GYGGVSRLJXKWCH-HNNXBMFYSA-N 1 2 307.315 4.147 20 0 DIADLO CCOC(=O)Cc1ccc[nH+]c1N[C@H](CC)c1ccccc1C ZINC001160033242 1047975748 /nfs/dbraw/zinc/97/57/48/1047975748.db2.gz LWPVUMMWNNPEQF-QGZVFWFLSA-N 1 2 312.413 4.059 20 0 DIADLO CCOC(=O)Cc1cc[nH+]c(N[C@H](CC)c2ccccc2C)c1 ZINC001160038347 1047976785 /nfs/dbraw/zinc/97/67/85/1047976785.db2.gz PGNWIIVBMJKFDE-QGZVFWFLSA-N 1 2 312.413 4.059 20 0 DIADLO CCc1nc(C[N@@H+](C)[C@@H](CC)c2ccccc2OC)cs1 ZINC000553993326 1047978786 /nfs/dbraw/zinc/97/87/86/1047978786.db2.gz UVDOBKIWIKABCF-HNNXBMFYSA-N 1 2 304.459 4.297 20 0 DIADLO CCc1nc(C[N@H+](C)[C@@H](CC)c2ccccc2OC)cs1 ZINC000553993326 1047978794 /nfs/dbraw/zinc/97/87/94/1047978794.db2.gz UVDOBKIWIKABCF-HNNXBMFYSA-N 1 2 304.459 4.297 20 0 DIADLO Cc1cncc(Nc2cc[nH+]c3cc(Br)ccc23)c1 ZINC001174753876 1047979064 /nfs/dbraw/zinc/97/90/64/1047979064.db2.gz XONLQEHCXBTYEP-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO C[C@H]1CC(C)(C)c2cccc(NC(=O)CCc3ccc(N)[nH+]c3)c21 ZINC001183933887 1047979388 /nfs/dbraw/zinc/97/93/88/1047979388.db2.gz AOCROZOHSAAUIY-ZDUSSCGKSA-N 1 2 323.440 4.020 20 0 DIADLO c1ccc(-c2cc[nH+]c(N[C@@H]3COCc4ccccc43)c2)cc1 ZINC001160115970 1047981621 /nfs/dbraw/zinc/98/16/21/1047981621.db2.gz FIHYHNLZQHCZQW-LJQANCHMSA-N 1 2 302.377 4.432 20 0 DIADLO C[C@H]1C[C@@H](C(C)(C)C)CC[N@@H+]1CC(=O)Nc1c(F)cccc1F ZINC000553987975 1047983704 /nfs/dbraw/zinc/98/37/04/1047983704.db2.gz UUPXNRRITUCWLM-STQMWFEESA-N 1 2 324.415 4.050 20 0 DIADLO C[C@H]1C[C@@H](C(C)(C)C)CC[N@H+]1CC(=O)Nc1c(F)cccc1F ZINC000553987975 1047983710 /nfs/dbraw/zinc/98/37/10/1047983710.db2.gz UUPXNRRITUCWLM-STQMWFEESA-N 1 2 324.415 4.050 20 0 DIADLO Brc1ccc([C@H]2CC[N@@H+]2CCOCC2CCC2)cc1 ZINC001174797156 1047988781 /nfs/dbraw/zinc/98/87/81/1047988781.db2.gz FQFRLSBZCOKFAL-MRXNPFEDSA-N 1 2 324.262 4.013 20 0 DIADLO Brc1ccc([C@H]2CC[N@H+]2CCOCC2CCC2)cc1 ZINC001174797156 1047988788 /nfs/dbraw/zinc/98/87/88/1047988788.db2.gz FQFRLSBZCOKFAL-MRXNPFEDSA-N 1 2 324.262 4.013 20 0 DIADLO Cc1[nH+]c2c(NC(=S)Nc3cccc(C)c3)cccn2c1C ZINC001198661567 1047993144 /nfs/dbraw/zinc/99/31/44/1047993144.db2.gz DQKQBTUFSPEOIZ-UHFFFAOYSA-N 1 2 310.426 4.068 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1ncc(Cl)s1 ZINC000774713257 1047995014 /nfs/dbraw/zinc/99/50/14/1047995014.db2.gz AOANEUDRGHDXMW-UHFFFAOYSA-N 1 2 320.849 4.407 20 0 DIADLO C(c1noc(C2CCC2)n1)[N@@H+]1CCC[C@@H](C2CCCCC2)C1 ZINC001174862552 1048005069 /nfs/dbraw/zinc/00/50/69/1048005069.db2.gz BEYWQSYTNFUZIW-MRXNPFEDSA-N 1 2 303.450 4.129 20 0 DIADLO C(c1noc(C2CCC2)n1)[N@H+]1CCC[C@@H](C2CCCCC2)C1 ZINC001174862552 1048005079 /nfs/dbraw/zinc/00/50/79/1048005079.db2.gz BEYWQSYTNFUZIW-MRXNPFEDSA-N 1 2 303.450 4.129 20 0 DIADLO CC[C@H](N[C@@H](C[NH+](C)C)c1ccc(F)cc1)c1ccc(C)cc1 ZINC000554086865 1048005254 /nfs/dbraw/zinc/00/52/54/1048005254.db2.gz RLJDZXNKWYFFCC-PMACEKPBSA-N 1 2 314.448 4.478 20 0 DIADLO c1ccc2cc(Nc3ccccc3C[NH+]3CCOCC3)ccc2c1 ZINC001174876940 1048011142 /nfs/dbraw/zinc/01/11/42/1048011142.db2.gz YWWXTFRRYRYNCF-UHFFFAOYSA-N 1 2 318.420 4.416 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@@H+](Cc1nc3ccccc3[nH]1)C2 ZINC001198852470 1048011143 /nfs/dbraw/zinc/01/11/43/1048011143.db2.gz RCXKOLOONFYRQT-UHFFFAOYSA-N 1 2 305.425 4.245 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@H+](Cc1nc3ccccc3[nH]1)C2 ZINC001198852470 1048011155 /nfs/dbraw/zinc/01/11/55/1048011155.db2.gz RCXKOLOONFYRQT-UHFFFAOYSA-N 1 2 305.425 4.245 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCc3cc(C)cc(C)c3C2)n1 ZINC001198851901 1048012173 /nfs/dbraw/zinc/01/21/73/1048012173.db2.gz MJAFWZMWIALSGZ-UHFFFAOYSA-N 1 2 311.473 4.419 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCc3cc(C)cc(C)c3C2)n1 ZINC001198851901 1048012186 /nfs/dbraw/zinc/01/21/86/1048012186.db2.gz MJAFWZMWIALSGZ-UHFFFAOYSA-N 1 2 311.473 4.419 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2nccn2C)c2cccc(F)c2)cc1 ZINC001198899539 1048013414 /nfs/dbraw/zinc/01/34/14/1048013414.db2.gz BWMXAVQWPDXCRT-HXUWFJFHSA-N 1 2 323.415 4.001 20 0 DIADLO Cc1cc(NC2CCN(c3cccnc3)CC2)[nH+]c2ccccc12 ZINC001160270776 1048019524 /nfs/dbraw/zinc/01/95/24/1048019524.db2.gz XJVOUOBJLSAARD-UHFFFAOYSA-N 1 2 318.424 4.019 20 0 DIADLO COc1ccc2[nH+]c(NC(C)(C)c3ccncc3)c(C)cc2c1 ZINC001160307547 1048028596 /nfs/dbraw/zinc/02/85/96/1048028596.db2.gz SSTMFJFWQDFPFZ-UHFFFAOYSA-N 1 2 307.397 4.294 20 0 DIADLO CN(C)c1ccc(Nc2cc(-c3cccs3)ccc2N)c[nH+]1 ZINC001160318047 1048030332 /nfs/dbraw/zinc/03/03/32/1048030332.db2.gz ZWENWMWZKLQSFF-UHFFFAOYSA-N 1 2 310.426 4.202 20 0 DIADLO Cc1ccc(N)c(Nc2ccc(N(C)Cc3ccccc3)[nH+]c2)c1 ZINC001160335784 1048035524 /nfs/dbraw/zinc/03/55/24/1048035524.db2.gz GPULFTLXPIKNEU-UHFFFAOYSA-N 1 2 318.424 4.352 20 0 DIADLO Cc1nc([C@H](C)[NH2+]C2(c3ccc(F)cc3F)CCC2)cs1 ZINC000554265622 1048050182 /nfs/dbraw/zinc/05/01/82/1048050182.db2.gz PFFDYRKAKZVROL-JTQLQIEISA-N 1 2 308.397 4.460 20 0 DIADLO Fc1ccc(Nc2ccc[nH+]c2N2CCCCC2)c(F)c1F ZINC001174969748 1048056593 /nfs/dbraw/zinc/05/65/93/1048056593.db2.gz RWIAEMAGWXUMSJ-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO C[C@H](C[N@@H+]1CCn2c(C3CCCC3)nnc2[C@@H]1C)c1ccccc1 ZINC000554288548 1048057019 /nfs/dbraw/zinc/05/70/19/1048057019.db2.gz YFLBKJLXXVSENZ-CVEARBPZSA-N 1 2 324.472 4.116 20 0 DIADLO C[C@H](C[N@H+]1CCn2c(C3CCCC3)nnc2[C@@H]1C)c1ccccc1 ZINC000554288548 1048057030 /nfs/dbraw/zinc/05/70/30/1048057030.db2.gz YFLBKJLXXVSENZ-CVEARBPZSA-N 1 2 324.472 4.116 20 0 DIADLO Cc1nc(N[C@@H](c2ccccc2)c2ccc(O)cc2)c(C)c(C)[nH+]1 ZINC001160497667 1048059702 /nfs/dbraw/zinc/05/97/02/1048059702.db2.gz KUNPYGMQOFZWOM-IBGZPJMESA-N 1 2 319.408 4.309 20 0 DIADLO [NH2+]=C(Nc1nc2ccc(Cl)nc2[nH]1)c1cccc2ccccc21 ZINC001160504690 1048061238 /nfs/dbraw/zinc/06/12/38/1048061238.db2.gz PIHNTLXZYUIUOV-UHFFFAOYSA-N 1 2 321.771 4.202 20 0 DIADLO C[C@@H]1C[C@@H](C(C)(C)C)CC[N@@H+]1Cc1nccn1CC(F)(F)F ZINC000554308851 1048062730 /nfs/dbraw/zinc/06/27/30/1048062730.db2.gz HBCXGUZEDYAKBV-OLZOCXBDSA-N 1 2 317.399 4.092 20 0 DIADLO C[C@@H]1C[C@@H](C(C)(C)C)CC[N@H+]1Cc1nccn1CC(F)(F)F ZINC000554308851 1048062745 /nfs/dbraw/zinc/06/27/45/1048062745.db2.gz HBCXGUZEDYAKBV-OLZOCXBDSA-N 1 2 317.399 4.092 20 0 DIADLO Cc1cc(N(Cc2ccc(F)cc2)C2CC2)nc(C2CCC2)[nH+]1 ZINC001184650633 1048073470 /nfs/dbraw/zinc/07/34/70/1048073470.db2.gz LBUBBGYTWUHRMH-UHFFFAOYSA-N 1 2 311.404 4.361 20 0 DIADLO COc1ccc(CNc2ccc(N3CCCCC3)c[nH+]2)c(C)c1 ZINC001199554722 1048076571 /nfs/dbraw/zinc/07/65/71/1048076571.db2.gz XZVGNRYIWQHMDB-UHFFFAOYSA-N 1 2 311.429 4.001 20 0 DIADLO Cc1cc(N[C@@H](C)c2cnc3c(C)cccn23)nc(C(C)(C)C)[nH+]1 ZINC001160687979 1048076708 /nfs/dbraw/zinc/07/67/08/1048076708.db2.gz LFWASLWVPNMNBM-AWEZNQCLSA-N 1 2 323.444 4.212 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3cc(Cl)ncc3F)c[nH+]c12 ZINC001160683326 1048076971 /nfs/dbraw/zinc/07/69/71/1048076971.db2.gz LKYVOZIJZSCFDV-JTQLQIEISA-N 1 2 304.756 4.003 20 0 DIADLO CCOc1ccc(Nc2ccc[nH+]c2N2CCCCC2)cc1F ZINC001175065853 1048091028 /nfs/dbraw/zinc/09/10/28/1048091028.db2.gz DDJOMEPWJWZXML-UHFFFAOYSA-N 1 2 315.392 4.353 20 0 DIADLO c1nn(C2CCC2)cc1CNc1ccc(Nc2ccccc2)c[nH+]1 ZINC001203195064 1048091341 /nfs/dbraw/zinc/09/13/41/1048091341.db2.gz XITALSBODOOMGL-UHFFFAOYSA-N 1 2 319.412 4.359 20 0 DIADLO Fc1ccc(F)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1F ZINC001175029122 1048096395 /nfs/dbraw/zinc/09/63/95/1048096395.db2.gz RLPWZGDUVIEMRW-UHFFFAOYSA-N 1 2 303.287 4.092 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(Nc3ccc(OC(C)C)cc3C)c12 ZINC001184935862 1048099893 /nfs/dbraw/zinc/09/98/93/1048099893.db2.gz AKEFZYYLKHHCCH-UHFFFAOYSA-N 1 2 310.401 4.360 20 0 DIADLO CCCC[C@@H](NC(=O)Nc1ccc2[nH+]c(C)cn2c1)C1CCC1 ZINC001199768003 1048099897 /nfs/dbraw/zinc/09/98/97/1048099897.db2.gz PVKSIDZJMSEUMI-MRXNPFEDSA-N 1 2 314.433 4.123 20 0 DIADLO CSCc1cc[nH+]c(NCc2nccc(Cl)c2Cl)c1 ZINC001160931717 1048100123 /nfs/dbraw/zinc/10/01/23/1048100123.db2.gz GNBFYNSZQFQEQN-UHFFFAOYSA-N 1 2 314.241 4.259 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(NC(=O)C(C)C)cc2)cc1 ZINC001199800975 1048103427 /nfs/dbraw/zinc/10/34/27/1048103427.db2.gz LXFBVPPVYPWWLP-UHFFFAOYSA-N 1 2 311.429 4.481 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(NC(=O)C(C)C)cc2)cc1 ZINC001199800975 1048103431 /nfs/dbraw/zinc/10/34/31/1048103431.db2.gz LXFBVPPVYPWWLP-UHFFFAOYSA-N 1 2 311.429 4.481 20 0 DIADLO c1[nH]c2c(cccc2Nc2cncc(OCc3ccccc3)c2)[nH+]1 ZINC001213028958 1048105214 /nfs/dbraw/zinc/10/52/14/1048105214.db2.gz APIKQSYJMGTFCK-UHFFFAOYSA-N 1 2 316.364 4.281 20 0 DIADLO Fc1cnc2c(cccc2Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001184964289 1048105984 /nfs/dbraw/zinc/10/59/84/1048105984.db2.gz KWFGVKLZRPKSOI-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO CC[C@@H](Nc1cc(N(C)C)nc[nH+]1)c1cccc(C(F)(F)F)c1 ZINC001161071075 1048107222 /nfs/dbraw/zinc/10/72/22/1048107222.db2.gz JWUANHAEXZYCEA-CYBMUJFWSA-N 1 2 324.350 4.125 20 0 DIADLO CC[C@@H](Nc1cc(N(C)C)[nH+]cn1)c1cccc(C(F)(F)F)c1 ZINC001161071075 1048107231 /nfs/dbraw/zinc/10/72/31/1048107231.db2.gz JWUANHAEXZYCEA-CYBMUJFWSA-N 1 2 324.350 4.125 20 0 DIADLO Cc1ccc2c(cccc2Nc2ccc[nH+]c2N2CCCC2)n1 ZINC001184967331 1048107893 /nfs/dbraw/zinc/10/78/93/1048107893.db2.gz AIUXAKBOVAJBHG-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO Cc1cnn(-c2ccc(C)cc2)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213030617 1048112025 /nfs/dbraw/zinc/11/20/25/1048112025.db2.gz JCWXYUOLJDTSNZ-UHFFFAOYSA-N 1 2 303.369 4.109 20 0 DIADLO COc1cc(NCc2c[nH+]cn2Cc2ccccc2)c(C)cc1C ZINC000480281360 1048112275 /nfs/dbraw/zinc/11/22/75/1048112275.db2.gz WJVOTNJYUUOGMO-UHFFFAOYSA-N 1 2 321.424 4.169 20 0 DIADLO C/C=C\C[C@@H]1CCC[N@@H+]([C@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001175054492 1048112588 /nfs/dbraw/zinc/11/25/88/1048112588.db2.gz SBNOYSFOXMCRCA-UIRUKZSUSA-N 1 2 321.848 4.232 20 0 DIADLO C/C=C\C[C@@H]1CCC[N@H+]([C@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001175054492 1048112597 /nfs/dbraw/zinc/11/25/97/1048112597.db2.gz SBNOYSFOXMCRCA-UIRUKZSUSA-N 1 2 321.848 4.232 20 0 DIADLO COc1ccc(Br)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213030763 1048113189 /nfs/dbraw/zinc/11/31/89/1048113189.db2.gz QBHIXJSSOBVVGT-UHFFFAOYSA-N 1 2 318.174 4.078 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@@H+]2Cc2ccc(Cl)cn2)cc1 ZINC000554496299 1048114913 /nfs/dbraw/zinc/11/49/13/1048114913.db2.gz QHYJUAIAJVHSKW-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@H+]2Cc2ccc(Cl)cn2)cc1 ZINC000554496299 1048114920 /nfs/dbraw/zinc/11/49/20/1048114920.db2.gz QHYJUAIAJVHSKW-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2ccc(Cl)cn2)[C@@H]1c1ccccc1 ZINC000554496252 1048115055 /nfs/dbraw/zinc/11/50/55/1048115055.db2.gz HSUUFFXUIQXSEG-DYVFJYSZSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2ccc(Cl)cn2)[C@@H]1c1ccccc1 ZINC000554496252 1048115060 /nfs/dbraw/zinc/11/50/60/1048115060.db2.gz HSUUFFXUIQXSEG-DYVFJYSZSA-N 1 2 318.873 4.414 20 0 DIADLO COc1ccc(C2(Nc3[nH+]c(C)cc(Cl)c3C)CC2)cc1 ZINC001161262337 1048118596 /nfs/dbraw/zinc/11/85/96/1048118596.db2.gz NOJGSNLVUKCXBP-UHFFFAOYSA-N 1 2 302.805 4.462 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2cn(C3CCC3)nn2)o1 ZINC000667657945 1048118801 /nfs/dbraw/zinc/11/88/01/1048118801.db2.gz UOOBLBKGCIXKQW-KRWDZBQOSA-N 1 2 314.433 4.022 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2cn(C3CCC3)nn2)o1 ZINC000667657945 1048118810 /nfs/dbraw/zinc/11/88/10/1048118810.db2.gz UOOBLBKGCIXKQW-KRWDZBQOSA-N 1 2 314.433 4.022 20 0 DIADLO CCSc1cc[nH+]c(NC2(c3ccc(OC)cc3)CC2)c1 ZINC001161264434 1048119050 /nfs/dbraw/zinc/11/90/50/1048119050.db2.gz QHHRCJHYNMRXEQ-UHFFFAOYSA-N 1 2 300.427 4.303 20 0 DIADLO c1[nH]c2c(cccc2Nc2ccc(Oc3cccnc3)cc2)[nH+]1 ZINC001213031593 1048119587 /nfs/dbraw/zinc/11/95/87/1048119587.db2.gz IDRAZEOZGWYECC-UHFFFAOYSA-N 1 2 302.337 4.494 20 0 DIADLO CC(C)c1cc(Br)cc(NCCCn2cc[nH+]c2)c1 ZINC001161688269 1048155092 /nfs/dbraw/zinc/15/50/92/1048155092.db2.gz NMZIXYGANWTGIW-UHFFFAOYSA-N 1 2 322.250 4.271 20 0 DIADLO Cc1cccc2c(C)cc(N[C@@H]3CCCc4nccnc43)[nH+]c12 ZINC001161404091 1048126977 /nfs/dbraw/zinc/12/69/77/1048126977.db2.gz XGJZHFHTBVKDHB-MRXNPFEDSA-N 1 2 304.397 4.131 20 0 DIADLO COc1c(Nc2cccc3[nH+]c[nH]c32)cccc1C(F)(F)F ZINC001213032545 1048127394 /nfs/dbraw/zinc/12/73/94/1048127394.db2.gz LAIHPORZCXCDAO-UHFFFAOYSA-N 1 2 307.275 4.334 20 0 DIADLO Fc1ccc(OC(F)(F)F)c(Nc2cccc3[nH+]c[nH]c32)c1 ZINC001213032356 1048127426 /nfs/dbraw/zinc/12/74/26/1048127426.db2.gz BBNBVQOCFGWXAM-UHFFFAOYSA-N 1 2 311.238 4.344 20 0 DIADLO c1[nH]c2c(cccc2Nc2ccc(Cc3ccccn3)cc2)[nH+]1 ZINC001213032626 1048128722 /nfs/dbraw/zinc/12/87/22/1048128722.db2.gz PJDIIVOAKNUHNE-UHFFFAOYSA-N 1 2 300.365 4.292 20 0 DIADLO Cc1nc(N(CCC(C)C)C2CCCC2)c2c([nH+]1)CCCC2 ZINC001185073087 1048131827 /nfs/dbraw/zinc/13/18/27/1048131827.db2.gz JDAVRLHBUCKFPT-UHFFFAOYSA-N 1 2 301.478 4.459 20 0 DIADLO c1ncn(CC2CCC2)c1CNc1cc(-c2ccccc2)cc[nH+]1 ZINC001161531151 1048137029 /nfs/dbraw/zinc/13/70/29/1048137029.db2.gz KQGHXCHZKKTLNR-UHFFFAOYSA-N 1 2 318.424 4.357 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cc(Cl)nc2sccc21 ZINC001161563124 1048139053 /nfs/dbraw/zinc/13/90/53/1048139053.db2.gz OHLJQSJBAFIJOQ-UHFFFAOYSA-N 1 2 306.822 4.339 20 0 DIADLO Fc1cccc2nc(Nc3ccc(NC4CCCC4)[nH+]c3)oc21 ZINC001185170847 1048141207 /nfs/dbraw/zinc/14/12/07/1048141207.db2.gz OJFJDJXSVYNWIU-UHFFFAOYSA-N 1 2 312.348 4.460 20 0 DIADLO CCOc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c(F)c1F ZINC001175152519 1048145885 /nfs/dbraw/zinc/14/58/85/1048145885.db2.gz OMFWPYDJIZFYSJ-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO COc1ccc(C2(CNc3cc(C)c4ccccc4[nH+]3)CC2)nc1 ZINC001161632691 1048149655 /nfs/dbraw/zinc/14/96/55/1048149655.db2.gz WZMGJWPLDRDXEW-UHFFFAOYSA-N 1 2 319.408 4.091 20 0 DIADLO CC(C)c1cc(N[C@H](C)CC(=O)OC(C)(C)C)nc(C(C)C)[nH+]1 ZINC001185298113 1048160174 /nfs/dbraw/zinc/16/01/74/1048160174.db2.gz GSHGGNPQXOJTJV-CYBMUJFWSA-N 1 2 321.465 4.256 20 0 DIADLO CCCn1nccc1C[N@H+](C)[C@H](C)c1sc(C(C)C)nc1C ZINC000667685887 1048161222 /nfs/dbraw/zinc/16/12/22/1048161222.db2.gz NHJKOADRAMCHPC-CQSZACIVSA-N 1 2 320.506 4.374 20 0 DIADLO CCCn1nccc1C[N@@H+](C)[C@H](C)c1sc(C(C)C)nc1C ZINC000667685887 1048161226 /nfs/dbraw/zinc/16/12/26/1048161226.db2.gz NHJKOADRAMCHPC-CQSZACIVSA-N 1 2 320.506 4.374 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2Cl)C[N@@H+]1C[C@H]1CCC(C)(C)O1 ZINC000480522507 1048161344 /nfs/dbraw/zinc/16/13/44/1048161344.db2.gz DAGPRBJQKUTIFD-CPUCHLNUSA-N 1 2 323.864 4.059 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2Cl)C[N@H+]1C[C@H]1CCC(C)(C)O1 ZINC000480522507 1048161347 /nfs/dbraw/zinc/16/13/47/1048161347.db2.gz DAGPRBJQKUTIFD-CPUCHLNUSA-N 1 2 323.864 4.059 20 0 DIADLO CCOc1cc(Nc2c[nH+]ccc2OC)cc(C(F)(F)F)c1 ZINC001175138773 1048162313 /nfs/dbraw/zinc/16/23/13/1048162313.db2.gz KFTNKLZMDQTIIZ-UHFFFAOYSA-N 1 2 312.291 4.251 20 0 DIADLO Fc1cc(F)c(Nc2cccc(Cn3cc[nH+]c3)c2)c(F)c1 ZINC001175144695 1048166427 /nfs/dbraw/zinc/16/64/27/1048166427.db2.gz HTXHVWRTPKBAHP-UHFFFAOYSA-N 1 2 303.287 4.092 20 0 DIADLO FC(F)CNc1cc(-c2ccc(OC(F)(F)F)cc2)cc[nH+]1 ZINC001161809115 1048174862 /nfs/dbraw/zinc/17/48/62/1048174862.db2.gz DXHHIQNHZVFWSJ-UHFFFAOYSA-N 1 2 318.245 4.324 20 0 DIADLO Fc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)ccc1Cl ZINC001175205318 1048175973 /nfs/dbraw/zinc/17/59/73/1048175973.db2.gz JWGSKQYKTVURSF-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000480564299 1048181102 /nfs/dbraw/zinc/18/11/02/1048181102.db2.gz RVMFLCYXUGSATQ-WCQYABFASA-N 1 2 324.346 4.329 20 0 DIADLO CSc1cc(Nc2cccc(O[C@@H]3CCCCO3)c2)cc[nH+]1 ZINC001175187966 1048192482 /nfs/dbraw/zinc/19/24/82/1048192482.db2.gz PBRDBNCGVZKQAE-QGZVFWFLSA-N 1 2 316.426 4.453 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CCN2c2cc(CC)[nH+]c(C)n2)o1 ZINC001185526383 1048192610 /nfs/dbraw/zinc/19/26/10/1048192610.db2.gz AKAMQJXLHLOTRN-SUMWQHHRSA-N 1 2 313.445 4.480 20 0 DIADLO CCOC(=O)CCc1ccc[nH+]c1N[C@@H](c1ccccc1)C1CC1 ZINC001161958011 1048199737 /nfs/dbraw/zinc/19/97/37/1048199737.db2.gz HTNZYZRJHIMTEA-IBGZPJMESA-N 1 2 324.424 4.141 20 0 DIADLO CCO[C@@H]1C[C@H](Nc2nc(C)[nH+]c3c2CCCC3)C1(CC)CC ZINC001185545141 1048200242 /nfs/dbraw/zinc/20/02/42/1048200242.db2.gz XIQMGAVNFYOXDE-DLBZAZTESA-N 1 2 317.477 4.060 20 0 DIADLO CCc1cc(NCc2cnc(-c3ccccc3)s2)nc(CC)[nH+]1 ZINC001185592499 1048203161 /nfs/dbraw/zinc/20/31/61/1048203161.db2.gz DTACPZVDXIPGPE-UHFFFAOYSA-N 1 2 324.453 4.337 20 0 DIADLO CCOc1cccc(F)c1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001175224405 1048203403 /nfs/dbraw/zinc/20/34/03/1048203403.db2.gz BGCFNYVUTNXEDT-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO CC(C)c1nsc(Nc2ccc([NH+]3CCCCC3)cc2)n1 ZINC001161980094 1048205828 /nfs/dbraw/zinc/20/58/28/1048205828.db2.gz XWJKQBRPVPKCHR-UHFFFAOYSA-N 1 2 302.447 4.395 20 0 DIADLO CCO[C@@H](CCNc1cc(C)[nH+]c(C2CCC2)n1)C1CCCC1 ZINC001185649106 1048208236 /nfs/dbraw/zinc/20/82/36/1048208236.db2.gz FVYLBFZDIYCBSI-KRWDZBQOSA-N 1 2 317.477 4.450 20 0 DIADLO C[C@@H](CCc1ccccc1)Nc1nc2ccccc2n2c[nH+]cc12 ZINC001161984920 1048208780 /nfs/dbraw/zinc/20/87/80/1048208780.db2.gz VWHHIRTVAANVPQ-HNNXBMFYSA-N 1 2 316.408 4.316 20 0 DIADLO CCc1cc(NCCc2ccc(OC(C)C)cc2)nc(CC)[nH+]1 ZINC001162009805 1048214412 /nfs/dbraw/zinc/21/44/12/1048214412.db2.gz GJBJLKGJOUQSHB-UHFFFAOYSA-N 1 2 313.445 4.043 20 0 DIADLO Cc1cc(C)cc(NC(=S)Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001201194589 1048215152 /nfs/dbraw/zinc/21/51/52/1048215152.db2.gz FHEMVMBWJRBRSB-UHFFFAOYSA-N 1 2 322.437 4.298 20 0 DIADLO CCOc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)c(C)c1 ZINC001175243710 1048218326 /nfs/dbraw/zinc/21/83/26/1048218326.db2.gz FOFHSCROUQESNV-UHFFFAOYSA-N 1 2 307.397 4.382 20 0 DIADLO C[C@@H]([C@H](C)Nc1ccc(Cn2cc[nH+]c2)cn1)C1CCCCC1 ZINC000554878250 1048218598 /nfs/dbraw/zinc/21/85/98/1048218598.db2.gz HFELXUPSQQOFFO-HOTGVXAUSA-N 1 2 312.461 4.343 20 0 DIADLO CC(=O)c1ccc(F)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001175274377 1048222823 /nfs/dbraw/zinc/22/28/23/1048222823.db2.gz BMMXNAAZOWOLIC-UHFFFAOYSA-N 1 2 309.344 4.017 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)o1 ZINC000774925598 1048223822 /nfs/dbraw/zinc/22/38/22/1048223822.db2.gz MARZDBAICPOLNL-NSHDSACASA-N 1 2 310.344 4.250 20 0 DIADLO CC1(C)CC[C@H](C[N@@H+]2CCc3[nH]c4ccc(Cl)cc4c3C2)O1 ZINC000480704965 1048224874 /nfs/dbraw/zinc/22/48/74/1048224874.db2.gz FBIFEYSFIDWAJD-CYBMUJFWSA-N 1 2 318.848 4.137 20 0 DIADLO CC1(C)CC[C@H](C[N@H+]2CCc3[nH]c4ccc(Cl)cc4c3C2)O1 ZINC000480704965 1048224885 /nfs/dbraw/zinc/22/48/85/1048224885.db2.gz FBIFEYSFIDWAJD-CYBMUJFWSA-N 1 2 318.848 4.137 20 0 DIADLO CC(C)(c1ccc(N)cc1)c1ccc(Nc2ccc(N)[nH+]c2)cc1 ZINC001201285882 1048225373 /nfs/dbraw/zinc/22/53/73/1048225373.db2.gz RNYGGOAPCFSXKU-UHFFFAOYSA-N 1 2 318.424 4.316 20 0 DIADLO COc1ccnc(C(C)(C)CNc2cc(C)c3ccccc3[nH+]2)c1 ZINC001162129927 1048228581 /nfs/dbraw/zinc/22/85/81/1048228581.db2.gz RXSWFPYIPUODLN-UHFFFAOYSA-N 1 2 321.424 4.337 20 0 DIADLO Cc1cc(Nc2ccc(N)[nH+]c2)ccc1NC(=O)OC(C)(C)C ZINC001201295193 1048233302 /nfs/dbraw/zinc/23/33/02/1048233302.db2.gz LUHUXNHWYREDIU-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO C[C@@H](C[NH2+]c1ccc(N2CCOC[C@H]2C)cc1)c1ccccc1 ZINC000774936597 1048235467 /nfs/dbraw/zinc/23/54/67/1048235467.db2.gz AEOMBJVQFBHABJ-DLBZAZTESA-N 1 2 310.441 4.127 20 0 DIADLO Cc1ccc(-c2nc(CNc3ccc(N(C)C)[nH+]c3)cs2)cc1 ZINC001201365814 1048240434 /nfs/dbraw/zinc/24/04/34/1048240434.db2.gz VJHUVSSSXNGCOL-UHFFFAOYSA-N 1 2 324.453 4.192 20 0 DIADLO Cc1c(Nc2cccc(-n3cc[nH+]c3)c2)cnn1-c1ccccc1 ZINC001201370483 1048241056 /nfs/dbraw/zinc/24/10/56/1048241056.db2.gz LFDCUUPPTSHLLT-UHFFFAOYSA-N 1 2 315.380 4.110 20 0 DIADLO ClC1(Cl)C[C@@H]1CSc1nc2ccccc2n2c[nH+]cc12 ZINC001162211033 1048242423 /nfs/dbraw/zinc/24/24/23/1048242423.db2.gz OUYMTIZTJAAQOV-SECBINFHSA-N 1 2 324.236 4.168 20 0 DIADLO CSc1cc[nH+]c(NCc2coc(-c3ccc(F)cc3)n2)c1 ZINC001162213056 1048243833 /nfs/dbraw/zinc/24/38/33/1048243833.db2.gz PHJXCLAUEQNFNH-UHFFFAOYSA-N 1 2 315.373 4.210 20 0 DIADLO Cc1cc(N2CCc3ccc(Cl)cc3C2)nc(C2CCC2)[nH+]1 ZINC001185987343 1048246825 /nfs/dbraw/zinc/24/68/25/1048246825.db2.gz LPPUIGJLWLMEJA-UHFFFAOYSA-N 1 2 313.832 4.269 20 0 DIADLO CC(C)c1cc(NCc2cccc3c2OCO3)nc(C(C)C)[nH+]1 ZINC001162232515 1048247958 /nfs/dbraw/zinc/24/79/58/1048247958.db2.gz ZLLICKRIFZSXQX-UHFFFAOYSA-N 1 2 313.401 4.064 20 0 DIADLO CN(C)c1ccc(Nc2cc(-c3ccccc3Cl)no2)c[nH+]1 ZINC001175341410 1048249362 /nfs/dbraw/zinc/24/93/62/1048249362.db2.gz PZCZXOYHJXCXQV-UHFFFAOYSA-N 1 2 314.776 4.200 20 0 DIADLO CN(C)c1ccc(Nc2c(Cl)cnc(Cl)c2Cl)c[nH+]1 ZINC001175341905 1048249742 /nfs/dbraw/zinc/24/97/42/1048249742.db2.gz WSOGMWOSTPRSJW-UHFFFAOYSA-N 1 2 317.607 4.246 20 0 DIADLO CC(C)n1nc(-c2ccccc2)cc1Nc1ccc(N(C)C)[nH+]c1 ZINC001175341364 1048250510 /nfs/dbraw/zinc/25/05/10/1048250510.db2.gz HXJSKQRQQMLQDG-UHFFFAOYSA-N 1 2 321.428 4.336 20 0 DIADLO CN(C)c1ccc(Nc2ccccc2Oc2ccccc2N)c[nH+]1 ZINC001175346148 1048251839 /nfs/dbraw/zinc/25/18/39/1048251839.db2.gz ORCFGLHGCHVWON-UHFFFAOYSA-N 1 2 320.396 4.266 20 0 DIADLO Clc1cc(Cl)c(Nc2ccc(N3CCCC3)[nH+]c2)cn1 ZINC001175348581 1048252785 /nfs/dbraw/zinc/25/27/85/1048252785.db2.gz HHPZRIGXQXZYRP-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(Nc3ccc(O[C@H](C)CC)cc3)c12 ZINC001162258575 1048254323 /nfs/dbraw/zinc/25/43/23/1048254323.db2.gz NSMMKUQPRSZSAL-GFCCVEGCSA-N 1 2 310.401 4.441 20 0 DIADLO Cc1ccc(C(=O)CC[N@H+]2[C@H](c3ccccc3)COC[C@@H]2C)cc1 ZINC000480842670 1048255650 /nfs/dbraw/zinc/25/56/50/1048255650.db2.gz KPHUGXOASHWWSJ-PXNSSMCTSA-N 1 2 323.436 4.030 20 0 DIADLO Cc1ccc(C(=O)CC[N@@H+]2[C@H](c3ccccc3)COC[C@@H]2C)cc1 ZINC000480842670 1048255661 /nfs/dbraw/zinc/25/56/61/1048255661.db2.gz KPHUGXOASHWWSJ-PXNSSMCTSA-N 1 2 323.436 4.030 20 0 DIADLO Cc1ccc(C(=O)CC[N@@H+]2[C@H](C)COC[C@@H]2c2ccccc2)cc1 ZINC000480842672 1048256362 /nfs/dbraw/zinc/25/63/62/1048256362.db2.gz KPHUGXOASHWWSJ-YLJYHZDGSA-N 1 2 323.436 4.030 20 0 DIADLO Cc1ccc(C(=O)CC[N@H+]2[C@H](C)COC[C@@H]2c2ccccc2)cc1 ZINC000480842672 1048256369 /nfs/dbraw/zinc/25/63/69/1048256369.db2.gz KPHUGXOASHWWSJ-YLJYHZDGSA-N 1 2 323.436 4.030 20 0 DIADLO Nc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c(C(F)(F)F)c1 ZINC001175350780 1048271756 /nfs/dbraw/zinc/27/17/56/1048271756.db2.gz CAYQRKXWNCDBHA-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO Cc1nc2ccc(Nc3ccc(N4CCCC4)[nH+]c3)cc2s1 ZINC001175349793 1048272586 /nfs/dbraw/zinc/27/25/86/1048272586.db2.gz DSUJGRIOAKMVOO-UHFFFAOYSA-N 1 2 310.426 4.344 20 0 DIADLO Fc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c2ncccc12 ZINC001175352594 1048273511 /nfs/dbraw/zinc/27/35/11/1048273511.db2.gz XHCGCSRJAIJFLB-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO Oc1ccc2ccccc2c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175352299 1048274060 /nfs/dbraw/zinc/27/40/60/1048274060.db2.gz MSWGFXWIOWHQHH-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO CC(C)(C)c1ccc(O)c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175352042 1048274393 /nfs/dbraw/zinc/27/43/93/1048274393.db2.gz PZFJMUVBYAIWPC-UHFFFAOYSA-N 1 2 311.429 4.429 20 0 DIADLO CSCc1cc[nH+]c(N[C@@H]2CCOc3c(F)cc(F)cc32)c1 ZINC001162406916 1048275714 /nfs/dbraw/zinc/27/57/14/1048275714.db2.gz OERZRXRFJRKLJF-CQSZACIVSA-N 1 2 322.380 4.159 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cnc(C(F)(F)F)cc2N)cc1 ZINC001201489471 1048279833 /nfs/dbraw/zinc/27/98/33/1048279833.db2.gz PKQPGVMZTSLSNJ-UHFFFAOYSA-N 1 2 310.323 4.247 20 0 DIADLO c1cnn(-c2ccc(Nc3ccc[nH+]c3N3CCCCC3)cc2)c1 ZINC001175368747 1048282038 /nfs/dbraw/zinc/28/20/38/1048282038.db2.gz INTDLOVDJKLFOK-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO COc1cccc(-n2nccc2Nc2ccc([NH2+]C(C)C)cc2)c1 ZINC001201490591 1048282358 /nfs/dbraw/zinc/28/23/58/1048282358.db2.gz HMZNAMUNVHLVOO-UHFFFAOYSA-N 1 2 322.412 4.445 20 0 DIADLO Cc1ccc2c(Nc3ccc(-n4cccn4)cc3)cccc2[nH+]1 ZINC001175371106 1048282983 /nfs/dbraw/zinc/28/29/83/1048282983.db2.gz PNGBFGXIIGLVHC-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO CC[C@@H](Nc1[nH+]ccc(C)c1NC(C)=O)c1ccc(F)c(F)c1 ZINC001162463398 1048283978 /nfs/dbraw/zinc/28/39/78/1048283978.db2.gz RYUXAVSYBDPNQR-OAHLLOKOSA-N 1 2 319.355 4.190 20 0 DIADLO CC[C@@H](Nc1cc(N(CC)CC)nc[nH+]1)c1ccc(F)c(F)c1 ZINC001162462573 1048284064 /nfs/dbraw/zinc/28/40/64/1048284064.db2.gz CDAPQSUEKAGQCR-OAHLLOKOSA-N 1 2 320.387 4.164 20 0 DIADLO CC[C@@H](Nc1cc(N(CC)CC)[nH+]cn1)c1ccc(F)c(F)c1 ZINC001162462573 1048284076 /nfs/dbraw/zinc/28/40/76/1048284076.db2.gz CDAPQSUEKAGQCR-OAHLLOKOSA-N 1 2 320.387 4.164 20 0 DIADLO CCS[C@H]1CCCCN(c2cc(C)[nH+]c(C3CCC3)n2)C1 ZINC001162476400 1048286076 /nfs/dbraw/zinc/28/60/76/1048286076.db2.gz OQSXCVHMRSHJRY-HNNXBMFYSA-N 1 2 305.491 4.165 20 0 DIADLO CC[C@H](C)C[N@@H+]1CCOC[C@H]1c1csc(-c2ccccc2)n1 ZINC001201503000 1048288486 /nfs/dbraw/zinc/28/84/86/1048288486.db2.gz MVKWGHPYRYVYBB-YOEHRIQHSA-N 1 2 316.470 4.230 20 0 DIADLO CC[C@H](C)C[N@H+]1CCOC[C@H]1c1csc(-c2ccccc2)n1 ZINC001201503000 1048288501 /nfs/dbraw/zinc/28/85/01/1048288501.db2.gz MVKWGHPYRYVYBB-YOEHRIQHSA-N 1 2 316.470 4.230 20 0 DIADLO CC[C@H](C)C[N@@H+]1CCOC[C@@H]1c1csc(-c2ccccc2)n1 ZINC001201502998 1048290251 /nfs/dbraw/zinc/29/02/51/1048290251.db2.gz MVKWGHPYRYVYBB-WMLDXEAASA-N 1 2 316.470 4.230 20 0 DIADLO CC[C@H](C)C[N@H+]1CCOC[C@@H]1c1csc(-c2ccccc2)n1 ZINC001201502998 1048290262 /nfs/dbraw/zinc/29/02/62/1048290262.db2.gz MVKWGHPYRYVYBB-WMLDXEAASA-N 1 2 316.470 4.230 20 0 DIADLO Cc1c2c[nH]nc2ccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001175467646 1048314215 /nfs/dbraw/zinc/31/42/15/1048314215.db2.gz ARUCKUPLWKJPJV-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO Cc1nc(NC2CC(C(C)(C)C)C2)c(Br)c(C)[nH+]1 ZINC001186578135 1048319789 /nfs/dbraw/zinc/31/97/89/1048319789.db2.gz HUPPJRIVJYZFEI-UHFFFAOYSA-N 1 2 312.255 4.093 20 0 DIADLO Cc1nn(-c2cccc(C)c2)cc1CNc1ccc(C)[nH+]c1C ZINC001201573094 1048321911 /nfs/dbraw/zinc/32/19/11/1048321911.db2.gz NGWZYZRFJFIIEG-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO Fc1cc(F)cc(C[N@@H+]2CCC[C@@](F)(c3ccccc3)C2)c1 ZINC001175490668 1048327077 /nfs/dbraw/zinc/32/70/77/1048327077.db2.gz GRECCFFYKCZQRC-SFHVURJKSA-N 1 2 305.343 4.426 20 0 DIADLO Fc1cc(F)cc(C[N@H+]2CCC[C@@](F)(c3ccccc3)C2)c1 ZINC001175490668 1048327090 /nfs/dbraw/zinc/32/70/90/1048327090.db2.gz GRECCFFYKCZQRC-SFHVURJKSA-N 1 2 305.343 4.426 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NC[C@@H](O)c1cc2ccccc2o1 ZINC001162696008 1048336339 /nfs/dbraw/zinc/33/63/39/1048336339.db2.gz SLATUNAJUHUBGE-QGZVFWFLSA-N 1 2 318.376 4.435 20 0 DIADLO CCc1ccc(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)nc1 ZINC000555404274 1048337134 /nfs/dbraw/zinc/33/71/34/1048337134.db2.gz DJINUTGDHJWZSS-OAQYLSRUSA-N 1 2 317.436 4.051 20 0 DIADLO CCc1ccc(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)nc1 ZINC000555404274 1048337151 /nfs/dbraw/zinc/33/71/51/1048337151.db2.gz DJINUTGDHJWZSS-OAQYLSRUSA-N 1 2 317.436 4.051 20 0 DIADLO CCc1cc(NCc2ccc(F)cc2CSC)nc(CC)[nH+]1 ZINC001162743184 1048346899 /nfs/dbraw/zinc/34/68/99/1048346899.db2.gz RAGMNMTWHYNKMV-UHFFFAOYSA-N 1 2 319.449 4.216 20 0 DIADLO Cc1cc(Oc2ccc(Nc3cccc(CO)c3)cc2)cc[nH+]1 ZINC001175519167 1048350769 /nfs/dbraw/zinc/35/07/69/1048350769.db2.gz VWQQDADRULZYSZ-UHFFFAOYSA-N 1 2 306.365 4.418 20 0 DIADLO Cc1[nH+]ccn1-c1ccc(Nc2c3cn[nH]c3ccc2C)cc1 ZINC001175526602 1048355332 /nfs/dbraw/zinc/35/53/32/1048355332.db2.gz UTDZDLNJZIJPEM-UHFFFAOYSA-N 1 2 303.369 4.109 20 0 DIADLO Cc1cccc2nc(NCCc3cn4c(cccc4C)[nH+]3)sc21 ZINC001186905457 1048357965 /nfs/dbraw/zinc/35/79/65/1048357965.db2.gz GHHSWAARVHKEHB-UHFFFAOYSA-N 1 2 322.437 4.215 20 0 DIADLO Cn1cc2c(cccc2Nc2ccc([NH+]3CCCCC3)cc2)n1 ZINC001175592861 1048363531 /nfs/dbraw/zinc/36/35/31/1048363531.db2.gz BOCUPGBDFUKVST-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(NCc2cnc3cc(C)ccn23)c1 ZINC001162824543 1048367194 /nfs/dbraw/zinc/36/71/94/1048367194.db2.gz ARYHRBRLJROQNE-UHFFFAOYSA-N 1 2 322.456 4.409 20 0 DIADLO CCc1cc(NCC(F)(F)c2ccccc2C)nc(CC)[nH+]1 ZINC001187162469 1048376267 /nfs/dbraw/zinc/37/62/67/1048376267.db2.gz SXYQVEYXOIBDOB-UHFFFAOYSA-N 1 2 305.372 4.114 20 0 DIADLO CCC1(CC)[C@H](OC)C[C@@H]1Nc1cc(C)[nH+]c(C2CCC2)n1 ZINC001162891732 1048376769 /nfs/dbraw/zinc/37/67/69/1048376769.db2.gz JPCQEDVCUGAGGX-LSDHHAIUSA-N 1 2 303.450 4.058 20 0 DIADLO Clc1ccc2nc([C@H]3CCC[N@@H+]3C[C@@H]3CCC=CO3)[nH]c2c1 ZINC000775097833 1048381226 /nfs/dbraw/zinc/38/12/26/1048381226.db2.gz VYGRWRAAZJVYDH-XJKSGUPXSA-N 1 2 317.820 4.046 20 0 DIADLO Clc1ccc2nc([C@H]3CCC[N@H+]3C[C@@H]3CCC=CO3)[nH]c2c1 ZINC000775097833 1048381237 /nfs/dbraw/zinc/38/12/37/1048381237.db2.gz VYGRWRAAZJVYDH-XJKSGUPXSA-N 1 2 317.820 4.046 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cc(-c3ccc(F)c(F)c3)no2)c1 ZINC001203655240 1048382290 /nfs/dbraw/zinc/38/22/90/1048382290.db2.gz ZEHKHUHKZZMTGT-UHFFFAOYSA-N 1 2 301.296 4.375 20 0 DIADLO Cc1cc(N[C@H]2CCc3c2c(F)ccc3F)nc(C(C)(C)C)[nH+]1 ZINC001162938146 1048391816 /nfs/dbraw/zinc/39/18/16/1048391816.db2.gz IUOANNTWASTFIK-AWEZNQCLSA-N 1 2 317.383 4.460 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1ccc(C(=O)NC2CC2)cc1 ZINC001175606103 1048392122 /nfs/dbraw/zinc/39/21/22/1048392122.db2.gz FYDPZTFHLSGUNF-UHFFFAOYSA-N 1 2 309.413 4.149 20 0 DIADLO COC(=O)C12CCC(Nc3cc(-c4ccccc4)cc[nH+]3)(CC1)C2 ZINC001162976331 1048398663 /nfs/dbraw/zinc/39/86/63/1048398663.db2.gz XASIRMAMDOORCF-UHFFFAOYSA-N 1 2 322.408 4.036 20 0 DIADLO CCC[C@@H](C)CCNc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC001187479497 1048399318 /nfs/dbraw/zinc/39/93/18/1048399318.db2.gz SKYNSNHFLKLBAH-CQSZACIVSA-N 1 2 309.417 4.054 20 0 DIADLO CCC[N@H+](Cc1ncc(Cl)s1)[C@H]1CCCc2cccnc21 ZINC000481430742 1048399175 /nfs/dbraw/zinc/39/91/75/1048399175.db2.gz CFXKPBKABZLQJW-ZDUSSCGKSA-N 1 2 321.877 4.481 20 0 DIADLO CCC[N@@H+](Cc1ncc(Cl)s1)[C@H]1CCCc2cccnc21 ZINC000481430742 1048399185 /nfs/dbraw/zinc/39/91/85/1048399185.db2.gz CFXKPBKABZLQJW-ZDUSSCGKSA-N 1 2 321.877 4.481 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2cccc(OC3CCCC3)c2)s1 ZINC001201920124 1048401054 /nfs/dbraw/zinc/40/10/54/1048401054.db2.gz LWHFSYUHMAQSTC-GFCCVEGCSA-N 1 2 317.458 4.019 20 0 DIADLO Cc1nc(NCCC[C@@H]2C=CCC2)c(Br)c(C)[nH+]1 ZINC001187503804 1048401256 /nfs/dbraw/zinc/40/12/56/1048401256.db2.gz REIJSAIXCYPIKS-GFCCVEGCSA-N 1 2 310.239 4.014 20 0 DIADLO CC[C@H]1Cc2ccccc2CN1c1nc(C)[nH+]c2c1CCCC2 ZINC001163001242 1048401519 /nfs/dbraw/zinc/40/15/19/1048401519.db2.gz WBTSIPYLUOXTDK-KRWDZBQOSA-N 1 2 307.441 4.005 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cccc(C(=O)N3CCCCC3)c2)c1 ZINC001203663435 1048403257 /nfs/dbraw/zinc/40/32/57/1048403257.db2.gz QSKVPMQEUVTKSE-UHFFFAOYSA-N 1 2 309.413 4.068 20 0 DIADLO CCCCCN(CCCOC)c1cc(C)[nH+]c(C2CCC2)n1 ZINC001163026322 1048406350 /nfs/dbraw/zinc/40/63/50/1048406350.db2.gz UNRDRLUNHNHWBA-UHFFFAOYSA-N 1 2 305.466 4.086 20 0 DIADLO CC(C)(C)C1CCN(c2nc3ccccc3n3c[nH+]cc23)CC1 ZINC001163062189 1048411409 /nfs/dbraw/zinc/41/14/09/1048411409.db2.gz OKTGXSIZYLPPTK-UHFFFAOYSA-N 1 2 308.429 4.145 20 0 DIADLO CCC1(CC)CCN(c2nc3ccccc3n3c[nH+]cc23)CC1 ZINC001163083935 1048415705 /nfs/dbraw/zinc/41/57/05/1048415705.db2.gz NVWARPQMVUDMCZ-UHFFFAOYSA-N 1 2 308.429 4.289 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H]2CCOc3ccc(F)cc32)s1 ZINC001202009887 1048416466 /nfs/dbraw/zinc/41/64/66/1048416466.db2.gz LRUOLRVLRFQJGQ-CYBMUJFWSA-N 1 2 306.406 4.019 20 0 DIADLO CC(C)(C)c1ccc(N[C@@H](c2ccccc2)c2cccnn2)[nH+]c1 ZINC001163110047 1048417075 /nfs/dbraw/zinc/41/70/75/1048417075.db2.gz SXZSWOZDNDRZIK-IBGZPJMESA-N 1 2 318.424 4.371 20 0 DIADLO CC(C)(C)c1ccc(N[C@H](c2ccccc2)c2cccnn2)[nH+]c1 ZINC001163110048 1048417380 /nfs/dbraw/zinc/41/73/80/1048417380.db2.gz SXZSWOZDNDRZIK-LJQANCHMSA-N 1 2 318.424 4.371 20 0 DIADLO CC(C)c1ccc(N[C@H](c2ccccc2)c2cccnn2)[nH+]c1 ZINC001163104241 1048417782 /nfs/dbraw/zinc/41/77/82/1048417782.db2.gz LWAQLJNLNKEYHZ-LJQANCHMSA-N 1 2 304.397 4.197 20 0 DIADLO Cc1ccc(Nc2c[nH+]c(N)cc2C(F)(F)F)c2cccnc12 ZINC001175712894 1048418671 /nfs/dbraw/zinc/41/86/71/1048418671.db2.gz LRKFPPMBNLQEMR-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc3ccc(O)cc3c2)c[nH+]1 ZINC001175713134 1048419917 /nfs/dbraw/zinc/41/99/17/1048419917.db2.gz RLTGZTIBKPPMSG-UHFFFAOYSA-N 1 2 319.286 4.285 20 0 DIADLO Cc1cccc2cc(Cl)nc(NCc3ccc4[nH+]ccn4c3)c12 ZINC001163140820 1048420571 /nfs/dbraw/zinc/42/05/71/1048420571.db2.gz MUAZOGSFKINDBC-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO Cc1cc(Nc2c[nH+]c(N)cc2C(F)(F)F)cc(F)c1F ZINC001175717170 1048422542 /nfs/dbraw/zinc/42/25/42/1048422542.db2.gz PYTAGWJHVWLSAN-UHFFFAOYSA-N 1 2 303.234 4.013 20 0 DIADLO Cc1cc(Cl)cc(Nc2c[nH+]c(N)cc2C(F)(F)F)c1 ZINC001175717956 1048423337 /nfs/dbraw/zinc/42/33/37/1048423337.db2.gz ZJCKUYAWLUXIFA-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc3c2CCCC3)c[nH+]1 ZINC001175717852 1048423675 /nfs/dbraw/zinc/42/36/75/1048423675.db2.gz UBEJRFJGCUAVQW-UHFFFAOYSA-N 1 2 307.319 4.305 20 0 DIADLO COc1cc(F)c(Nc2cc(Cl)c3[nH+]ccn3c2)c(F)c1 ZINC001175721515 1048424622 /nfs/dbraw/zinc/42/46/22/1048424622.db2.gz LPJSOTVWSYKMJO-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO Nc1ccc(C2(Nc3cc(-c4ccccc4)cc[nH+]3)CC2)cc1 ZINC001163198084 1048434932 /nfs/dbraw/zinc/43/49/32/1048434932.db2.gz BTSMKQRDJFQGDH-UHFFFAOYSA-N 1 2 301.393 4.432 20 0 DIADLO COc1cccc2c1OC[C@@H]2Nc1cc(C)c2cccc(C)c2[nH+]1 ZINC001163222810 1048438955 /nfs/dbraw/zinc/43/89/55/1048438955.db2.gz HRFQIAUCTLPGTA-INIZCTEOSA-N 1 2 320.392 4.406 20 0 DIADLO Cc1nc(N2CCC(C)(C)[C@@H](c3ccccc3)C2)c(C)c(C)[nH+]1 ZINC001187753051 1048440248 /nfs/dbraw/zinc/44/02/48/1048440248.db2.gz ZENYRXBQRYYNER-GOSISDBHSA-N 1 2 309.457 4.422 20 0 DIADLO COc1c(Cl)cccc1CNc1cc(C)[nH+]c(C2CCC2)n1 ZINC001187758480 1048441590 /nfs/dbraw/zinc/44/15/90/1048441590.db2.gz YKLPWBXSSOUUAH-UHFFFAOYSA-N 1 2 317.820 4.327 20 0 DIADLO COC1(CNc2cc(C)[nH+]c(C3CCC3)n2)CCCCCC1 ZINC001187842140 1048445297 /nfs/dbraw/zinc/44/52/97/1048445297.db2.gz OPSKZNUTHMFDJV-UHFFFAOYSA-N 1 2 303.450 4.204 20 0 DIADLO Clc1ccc2c(cc[nH+]c2NCc2cnn3ccccc23)c1 ZINC001163277092 1048447077 /nfs/dbraw/zinc/44/70/77/1048447077.db2.gz GPNZBHVTNUCBEQ-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO CCC[C@@H](Nc1nc(C)[nH+]c(C)c1Br)C(C)(C)C ZINC001163326110 1048452085 /nfs/dbraw/zinc/45/20/85/1048452085.db2.gz AROZUMDFAVSZON-LLVKDONJSA-N 1 2 314.271 4.483 20 0 DIADLO COc1cc(F)c(C(C)C)cc1-n1c(C)[nH+]c2ccc(N)cc21 ZINC001175830781 1048458225 /nfs/dbraw/zinc/45/82/25/1048458225.db2.gz RVYOWNLKSRMGLD-UHFFFAOYSA-N 1 2 313.376 4.187 20 0 DIADLO c1nn(C2CCCCC2)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001175881004 1048471105 /nfs/dbraw/zinc/47/11/05/1048471105.db2.gz MVXPIWJOXCZOQL-UHFFFAOYSA-N 1 2 311.433 4.127 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[NH+]1CC(O)(c2ccc(F)cc2)C1 ZINC001175890605 1048474770 /nfs/dbraw/zinc/47/47/70/1048474770.db2.gz GBPOLFRZIHNRAZ-KRWDZBQOSA-N 1 2 319.807 4.134 20 0 DIADLO CSc1ccc(NC(=O)Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC001188085347 1048474807 /nfs/dbraw/zinc/47/48/07/1048474807.db2.gz LCMYNMJFPHCDEF-UHFFFAOYSA-N 1 2 312.398 4.009 20 0 DIADLO c1cn(CCSc2nc3ccccc3n2-c2ccccc2)c[nH+]1 ZINC001188108367 1048476604 /nfs/dbraw/zinc/47/66/04/1048476604.db2.gz QQBOFHLZFACYLV-UHFFFAOYSA-N 1 2 320.421 4.014 20 0 DIADLO COc1cccc(Nc2cc(Cl)c3[nH+]ccn3c2)c1Cl ZINC001175895030 1048476633 /nfs/dbraw/zinc/47/66/33/1048476633.db2.gz WEHPPTXEGWLKFE-UHFFFAOYSA-N 1 2 308.168 4.393 20 0 DIADLO COc1cccc([C@@H]2C[C@H]2CNc2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC001163507667 1048481217 /nfs/dbraw/zinc/48/12/17/1048481217.db2.gz PUCPUCRDHBYHNY-WMZOPIPTSA-N 1 2 323.440 4.277 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)cs1 ZINC000481763096 1048482152 /nfs/dbraw/zinc/48/21/52/1048482152.db2.gz CVTZJLBFNZLCPR-ZYHUDNBSSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)cs1 ZINC000481763096 1048482160 /nfs/dbraw/zinc/48/21/60/1048482160.db2.gz CVTZJLBFNZLCPR-ZYHUDNBSSA-N 1 2 306.397 4.429 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000481770594 1048482283 /nfs/dbraw/zinc/48/22/83/1048482283.db2.gz YEWWGZIDNMZZNQ-BBRMVZONSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000481770594 1048482291 /nfs/dbraw/zinc/48/22/91/1048482291.db2.gz YEWWGZIDNMZZNQ-BBRMVZONSA-N 1 2 323.362 4.035 20 0 DIADLO O=C(Nc1ccc(Cl)c(Cl)c1)Nc1ccc2[nH+]ccn2c1 ZINC001202257138 1048493461 /nfs/dbraw/zinc/49/34/61/1048493461.db2.gz LGQYTGBUFUIJII-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO COC(=O)C1(c2ccc(Nc3c(C)cc[nH+]c3C(C)C)cc2)CC1 ZINC001175920061 1048500019 /nfs/dbraw/zinc/50/00/19/1048500019.db2.gz ZOUATAQHRHWQBF-UHFFFAOYSA-N 1 2 324.424 4.462 20 0 DIADLO Cc1ccc(-c2cc[nH+]c(NCCc3cccc(O)c3)c2)cc1 ZINC001163698284 1048506932 /nfs/dbraw/zinc/50/69/32/1048506932.db2.gz GIVHLROOPCADNC-UHFFFAOYSA-N 1 2 304.393 4.417 20 0 DIADLO Oc1cccc(CCNc2ccc(C3(C(F)(F)F)CC3)c[nH+]2)c1 ZINC001163698923 1048507323 /nfs/dbraw/zinc/50/73/23/1048507323.db2.gz YYWROCPXYLGJSD-UHFFFAOYSA-N 1 2 322.330 4.036 20 0 DIADLO Cc1cc(Oc2ccc(Nc3cnn(C4CC4)c3)cc2)cc[nH+]1 ZINC001175962175 1048508545 /nfs/dbraw/zinc/50/85/45/1048508545.db2.gz JOMXULSSAGMOQR-UHFFFAOYSA-N 1 2 306.369 4.457 20 0 DIADLO CCOc1cc[nH+]cc1Nc1ccc(OC)cc1C(F)(F)F ZINC001213047508 1048514667 /nfs/dbraw/zinc/51/46/67/1048514667.db2.gz NATOGOXILLTXIM-UHFFFAOYSA-N 1 2 312.291 4.251 20 0 DIADLO F[C@H]1CCN(c2cc(-c3ccccc3)cc[nH+]2)CCC1(F)F ZINC001163779241 1048524047 /nfs/dbraw/zinc/52/40/47/1048524047.db2.gz BQYNDJYUGBKCEB-HNNXBMFYSA-N 1 2 306.331 4.322 20 0 DIADLO F[C@@H]1CCN(c2cc(-c3ccccc3)cc[nH+]2)CCC1(F)F ZINC001163779242 1048525059 /nfs/dbraw/zinc/52/50/59/1048525059.db2.gz BQYNDJYUGBKCEB-OAHLLOKOSA-N 1 2 306.331 4.322 20 0 DIADLO FC(F)Oc1ccccc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001176009702 1048531177 /nfs/dbraw/zinc/53/11/77/1048531177.db2.gz MIPKJRDKCRSJNZ-UHFFFAOYSA-N 1 2 319.355 4.417 20 0 DIADLO Cc1ccccc1[C@@H](C)Nc1nc2ccccc2n2c[nH+]cc12 ZINC001163826358 1048532295 /nfs/dbraw/zinc/53/22/95/1048532295.db2.gz SWCWYAOXDGXOHR-CQSZACIVSA-N 1 2 302.381 4.364 20 0 DIADLO CCN(c1cc(SC)cc[nH+]1)[C@H](C)Cc1ccc(OC)cc1 ZINC001163834560 1048533408 /nfs/dbraw/zinc/53/34/08/1048533408.db2.gz SJRKVPPRPHNREP-CQSZACIVSA-N 1 2 316.470 4.270 20 0 DIADLO CSCCCNc1[nH+]ccc2cccc(C(F)(F)F)c21 ZINC001163869442 1048542742 /nfs/dbraw/zinc/54/27/42/1048542742.db2.gz UIXWSRLXVGFAAI-UHFFFAOYSA-N 1 2 300.349 4.419 20 0 DIADLO COc1cc(CN2CCC[C@@H]2c2[nH]c(C)c(C)[nH+]2)ccc1Cl ZINC001176079260 1048547945 /nfs/dbraw/zinc/54/79/45/1048547945.db2.gz XHEHNHAFMVSSCZ-OAHLLOKOSA-N 1 2 319.836 4.026 20 0 DIADLO Cc1nc(N(C)Cc2ccccc2OCc2ccccc2)cc[nH+]1 ZINC001163907065 1048548172 /nfs/dbraw/zinc/54/81/72/1048548172.db2.gz XRCWMHUJVCDCOI-UHFFFAOYSA-N 1 2 319.408 4.000 20 0 DIADLO COc1ccc2cc(NCc3cc4ccccc4n3C)[nH+]cc2c1 ZINC001163931710 1048551340 /nfs/dbraw/zinc/55/13/40/1048551340.db2.gz JKSUBAHKPZLXDL-UHFFFAOYSA-N 1 2 317.392 4.347 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)Nc1cccc2ccccc21 ZINC001188918205 1048565548 /nfs/dbraw/zinc/56/55/48/1048565548.db2.gz XDNHQZUHIQERSD-UHFFFAOYSA-N 1 2 302.337 4.132 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(Br)c(Cl)c1 ZINC001176121465 1048576435 /nfs/dbraw/zinc/57/64/35/1048576435.db2.gz VJNYSNOIPIJQOP-UHFFFAOYSA-N 1 2 313.582 4.250 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc2c(c1)C(=O)c1ccccc1-2 ZINC001176124100 1048575374 /nfs/dbraw/zinc/57/53/74/1048575374.db2.gz HXHAOFPERJEVPZ-UHFFFAOYSA-N 1 2 302.333 4.045 20 0 DIADLO Cc1cc2cc(N[C@@H](c3ccccc3)c3ccncc3)[nH+]cc2[nH]1 ZINC001164069003 1048575550 /nfs/dbraw/zinc/57/55/50/1048575550.db2.gz QTNCSJBXYMVGGX-FQEVSTJZSA-N 1 2 314.392 4.468 20 0 DIADLO COc1cc[nH+]cc1Nc1ccccc1C(=O)Nc1ccccc1 ZINC001176122013 1048575704 /nfs/dbraw/zinc/57/57/04/1048575704.db2.gz YWVNRXNJMHSRDZ-UHFFFAOYSA-N 1 2 319.364 4.086 20 0 DIADLO COc1cc[nH+]cc1Nc1c(Cl)cc(C(C)=O)cc1Cl ZINC001176122550 1048576758 /nfs/dbraw/zinc/57/67/58/1048576758.db2.gz ABTRGJIXXXTZJG-UHFFFAOYSA-N 1 2 311.168 4.343 20 0 DIADLO COc1cc[nH+]cc1-n1c(-c2ccccc2N)cc2ccccc21 ZINC001176124508 1048576815 /nfs/dbraw/zinc/57/68/15/1048576815.db2.gz PPMJWMMJMKJBOO-UHFFFAOYSA-N 1 2 315.376 4.283 20 0 DIADLO Cc1cc(N[C@H](c2ccccc2)c2ccncc2)[nH+]c2cc[nH]c21 ZINC001164083037 1048579253 /nfs/dbraw/zinc/57/92/53/1048579253.db2.gz WUPCVODVVAGMRG-HXUWFJFHSA-N 1 2 314.392 4.468 20 0 DIADLO CC(C)C[C@@H](C(=O)N1CCC[C@@H]1CC1CCCC1)n1cc[nH+]c1 ZINC001164104815 1048582937 /nfs/dbraw/zinc/58/29/37/1048582937.db2.gz KHXCTBWMLWEJMK-MSOLQXFVSA-N 1 2 317.477 4.042 20 0 DIADLO CCCc1cc[nH+]c(Nc2ccc(Cl)c(C(=O)N(C)C)c2)c1 ZINC001176151709 1048593972 /nfs/dbraw/zinc/59/39/72/1048593972.db2.gz MGDMOYGQCYJLMD-UHFFFAOYSA-N 1 2 317.820 4.133 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1ccc(Cl)c(C(=O)N(C)C)c1 ZINC001176152045 1048594680 /nfs/dbraw/zinc/59/46/80/1048594680.db2.gz UJJKYJHNOUKTEB-UHFFFAOYSA-N 1 2 317.820 4.051 20 0 DIADLO O=C(Nc1cccc(Cl)c1Cl)Nc1cccc2[nH+]ccn21 ZINC001189189232 1048598320 /nfs/dbraw/zinc/59/83/20/1048598320.db2.gz HFRZFUHZVKULNF-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO Cc1cc(N[C@H](c2cccnc2)C(F)(F)F)ccc1[NH+](C)C ZINC001164184242 1048601342 /nfs/dbraw/zinc/60/13/42/1048601342.db2.gz URDVRARNNLXOBI-OAHLLOKOSA-N 1 2 309.335 4.172 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cnn(Cc3cccs3)c2)cc1 ZINC001176164238 1048601486 /nfs/dbraw/zinc/60/14/86/1048601486.db2.gz ZABKJXBTFWUJOT-UHFFFAOYSA-N 1 2 312.442 4.193 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cnn(Cc3cccs3)c2)cc1 ZINC001176164238 1048601500 /nfs/dbraw/zinc/60/15/00/1048601500.db2.gz ZABKJXBTFWUJOT-UHFFFAOYSA-N 1 2 312.442 4.193 20 0 DIADLO Cc1ccc2c(Nc3ccc(C(=O)N(C)C)cc3F)cccc2[nH+]1 ZINC001176205173 1048602999 /nfs/dbraw/zinc/60/29/99/1048602999.db2.gz DGIQSDCYWZFNOY-UHFFFAOYSA-N 1 2 323.371 4.128 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C[C@@H]3CC[C@H]4C[C@H]43)cc2)[nH+]c1C ZINC001176209868 1048606336 /nfs/dbraw/zinc/60/63/36/1048606336.db2.gz BZIAYBLNOFYNSR-YQQAZPJKSA-N 1 2 309.413 4.068 20 0 DIADLO CC(C)COc1cc(NCc2cnc3ccccc3c2)cc[nH+]1 ZINC001164206600 1048608156 /nfs/dbraw/zinc/60/81/56/1048608156.db2.gz UAROQQFJAPGMTH-UHFFFAOYSA-N 1 2 307.397 4.277 20 0 DIADLO COCc1csc(CNc2ccc([NH+]3CCCC3)cc2)c1 ZINC000850044628 1048613153 /nfs/dbraw/zinc/61/31/53/1048613153.db2.gz RTNLORABKIZLHU-UHFFFAOYSA-N 1 2 302.443 4.107 20 0 DIADLO C[C@@H](CCC1CCCCC1)[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000482500541 1048618173 /nfs/dbraw/zinc/61/81/73/1048618173.db2.gz ILJJRXSYQMGVOU-MAUKXSAKSA-N 1 2 312.461 4.233 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)s1 ZINC000482500661 1048618966 /nfs/dbraw/zinc/61/89/66/1048618966.db2.gz AZYBLAHBIMENDQ-MNOVXSKESA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)s1 ZINC000482500661 1048618974 /nfs/dbraw/zinc/61/89/74/1048618974.db2.gz AZYBLAHBIMENDQ-MNOVXSKESA-N 1 2 306.397 4.429 20 0 DIADLO CCCCCCOc1cc(C)ccc1C[NH2+]Cc1nc(C)c[nH]1 ZINC000850182719 1048621879 /nfs/dbraw/zinc/62/18/79/1048621879.db2.gz IJUFTFURCJMKJS-UHFFFAOYSA-N 1 2 315.461 4.275 20 0 DIADLO Cc1[nH]c(CNc2ccc(OCC(C)C)c(Cl)c2)[nH+]c1C ZINC000850207195 1048621979 /nfs/dbraw/zinc/62/19/79/1048621979.db2.gz UQVQQCSROMVNMG-UHFFFAOYSA-N 1 2 307.825 4.327 20 0 DIADLO Cc1[nH]c(CNc2ccc(N3CCCCC3)c(Cl)c2)[nH+]c1C ZINC000850208468 1048624537 /nfs/dbraw/zinc/62/45/37/1048624537.db2.gz OHJYRTLOTQNQAK-UHFFFAOYSA-N 1 2 318.852 4.282 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(O)cc2C(F)(F)F)[nH+]1 ZINC001176337795 1048630314 /nfs/dbraw/zinc/63/03/14/1048630314.db2.gz FRYWJZIQKGWXDN-UHFFFAOYSA-N 1 2 307.275 4.111 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2c(C)cccc2COC(C)=O)cc1 ZINC001212774154 1048641094 /nfs/dbraw/zinc/64/10/94/1048641094.db2.gz KDRUAYUTTQEBDQ-UHFFFAOYSA-N 1 2 312.413 4.258 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2c(C)cccc2COC(C)=O)cc1 ZINC001212774154 1048641099 /nfs/dbraw/zinc/64/10/99/1048641099.db2.gz KDRUAYUTTQEBDQ-UHFFFAOYSA-N 1 2 312.413 4.258 20 0 DIADLO CC(=O)c1cc(Nc2ccc(C)[nH+]c2C)ccc1Br ZINC001203381464 1048651008 /nfs/dbraw/zinc/65/10/08/1048651008.db2.gz YYTXFZLMARSVIA-UHFFFAOYSA-N 1 2 319.202 4.407 20 0 DIADLO FC(F)(F)c1cccc2cc[nH+]c(NC[C@@H]3CCCCO3)c21 ZINC001164670774 1048652377 /nfs/dbraw/zinc/65/23/77/1048652377.db2.gz AKHRVYAHCFUWNR-LBPRGKRZSA-N 1 2 310.319 4.235 20 0 DIADLO Clc1ccnc(C[NH2+][C@H](c2ccccn2)C2CC2)c1Cl ZINC001176364406 1048660296 /nfs/dbraw/zinc/66/02/96/1048660296.db2.gz CNGLSHDBVNLVRD-HNNXBMFYSA-N 1 2 308.212 4.024 20 0 DIADLO COc1cc2cc[nH+]c(N3CCC(F)(F)C(C)(C)C3)c2cc1F ZINC001165219964 1048668402 /nfs/dbraw/zinc/66/84/02/1048668402.db2.gz XYCGBYJWBILHFO-UHFFFAOYSA-N 1 2 324.346 4.254 20 0 DIADLO c1ccc(-c2[nH]c3ccc(NC[C@H]4CCCCO4)cc3[nH+]2)cc1 ZINC001165239121 1048671265 /nfs/dbraw/zinc/67/12/65/1048671265.db2.gz AGEMNEOWBAKXLT-MRXNPFEDSA-N 1 2 307.397 4.211 20 0 DIADLO CC(C)(C)c1cn(Cc2c(F)cccc2Br)c[nH+]1 ZINC001189875949 1048672562 /nfs/dbraw/zinc/67/25/62/1048672562.db2.gz JDJNDNSUPJTPLG-UHFFFAOYSA-N 1 2 311.198 4.131 20 0 DIADLO Cc1cn2c(cccc2Nc2cc(F)cc(N3CCCC3)c2)[nH+]1 ZINC001176416655 1048680086 /nfs/dbraw/zinc/68/00/86/1048680086.db2.gz BPEBLVOMAXPSMT-UHFFFAOYSA-N 1 2 310.376 4.126 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@@H]2C[C@@H](O)c3ccccc32)cs1 ZINC000850527612 1048680974 /nfs/dbraw/zinc/68/09/74/1048680974.db2.gz HBQWKXAQOIHCQZ-SGIREYDYSA-N 1 2 302.443 4.096 20 0 DIADLO CCN(C)C(=O)c1cccc(Nc2ccc3c(C)cc[nH+]c3c2)c1 ZINC001176466969 1048691630 /nfs/dbraw/zinc/69/16/30/1048691630.db2.gz QWUYZYWTHWBTJB-UHFFFAOYSA-N 1 2 319.408 4.379 20 0 DIADLO Cc1ccc(C=O)c(OCc2c[nH+]c(N(C)C)c3ccccc23)c1 ZINC001190045391 1048693704 /nfs/dbraw/zinc/69/37/04/1048693704.db2.gz JTYFYOUDAINGDM-UHFFFAOYSA-N 1 2 320.392 4.001 20 0 DIADLO O=C(Nc1ccccc1C(F)F)c1ccccc1-n1cc[nH+]c1 ZINC001190097136 1048695027 /nfs/dbraw/zinc/69/50/27/1048695027.db2.gz JWENKBRWVJAWPR-UHFFFAOYSA-N 1 2 313.307 4.062 20 0 DIADLO c1cc(Nc2ccc(N3CCCC3)[nH+]c2)cc(OCC2CC2)c1 ZINC001176493701 1048698573 /nfs/dbraw/zinc/69/85/73/1048698573.db2.gz VRMLWAFEDVSVFX-UHFFFAOYSA-N 1 2 309.413 4.214 20 0 DIADLO CSc1cc(NC2CCC(C(F)(F)F)CC2)nc(C)[nH+]1 ZINC001165592244 1048700037 /nfs/dbraw/zinc/70/00/37/1048700037.db2.gz ZMEOBTWFLOTQPD-UHFFFAOYSA-N 1 2 305.369 4.040 20 0 DIADLO CCc1cccc2cc(C[N@@H+]3CCC[C@@H]3c3nc(C)no3)oc21 ZINC000668151844 1048701237 /nfs/dbraw/zinc/70/12/37/1048701237.db2.gz PWNAWEFWENUOTA-MRXNPFEDSA-N 1 2 311.385 4.024 20 0 DIADLO CCc1cccc2cc(C[N@H+]3CCC[C@@H]3c3nc(C)no3)oc21 ZINC000668151844 1048701248 /nfs/dbraw/zinc/70/12/48/1048701248.db2.gz PWNAWEFWENUOTA-MRXNPFEDSA-N 1 2 311.385 4.024 20 0 DIADLO COc1c[nH+]c(NC2CCC(C(F)(F)F)CC2)c2[nH]ccc21 ZINC001165599163 1048701650 /nfs/dbraw/zinc/70/16/50/1048701650.db2.gz DLMQVGHLLUFQRA-UHFFFAOYSA-N 1 2 313.323 4.105 20 0 DIADLO CCN(CC)C(=O)c1cc(Nc2ccc(C)[nH+]c2C)ccc1F ZINC001176513373 1048703837 /nfs/dbraw/zinc/70/38/37/1048703837.db2.gz AQGQNDQWVXHODA-UHFFFAOYSA-N 1 2 315.392 4.063 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000482966299 1048713741 /nfs/dbraw/zinc/71/37/41/1048713741.db2.gz VWOYPXQHGYSOLJ-LJQANCHMSA-N 1 2 308.425 4.196 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000482966299 1048713755 /nfs/dbraw/zinc/71/37/55/1048713755.db2.gz VWOYPXQHGYSOLJ-LJQANCHMSA-N 1 2 308.425 4.196 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cccc(OC)c2Cl)cc1F ZINC001190317798 1048714801 /nfs/dbraw/zinc/71/48/01/1048714801.db2.gz JAOKZXXBKKMGHS-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cccc(OC)c2Cl)cc1F ZINC001190317798 1048714810 /nfs/dbraw/zinc/71/48/10/1048714810.db2.gz JAOKZXXBKKMGHS-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C)cc1CSCc1[nH+]cc(C)c(OC)c1C ZINC001165852121 1048720688 /nfs/dbraw/zinc/72/06/88/1048720688.db2.gz ZMOLNDUWDCWPBE-UHFFFAOYSA-N 1 2 317.454 4.457 20 0 DIADLO Fc1cccn2ncc(Nc3ccc([NH+]4CCCCC4)cc3)c12 ZINC001203719382 1048728459 /nfs/dbraw/zinc/72/84/59/1048728459.db2.gz UKZSMLUZMYNRRX-UHFFFAOYSA-N 1 2 310.376 4.207 20 0 DIADLO CC[C@@](C)([NH2+]Cc1noc(-c2ccccc2)n1)c1ccccc1 ZINC000775396389 1048753027 /nfs/dbraw/zinc/75/30/27/1048753027.db2.gz SWOIONAYSDDFAX-LJQANCHMSA-N 1 2 307.397 4.152 20 0 DIADLO CC(C)CCOCC[N@H+](C)Cc1c(Cl)cccc1Cl ZINC001190560456 1048755544 /nfs/dbraw/zinc/75/55/44/1048755544.db2.gz JTNFJDTXISSETE-UHFFFAOYSA-N 1 2 304.261 4.488 20 0 DIADLO CC(C)CCOCC[N@@H+](C)Cc1c(Cl)cccc1Cl ZINC001190560456 1048755558 /nfs/dbraw/zinc/75/55/58/1048755558.db2.gz JTNFJDTXISSETE-UHFFFAOYSA-N 1 2 304.261 4.488 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+]([C@H](C)c1cc(F)ccc1F)CC2 ZINC001190572280 1048757488 /nfs/dbraw/zinc/75/74/88/1048757488.db2.gz SYMTZHMINLPQCB-CYBMUJFWSA-N 1 2 317.379 4.483 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+]([C@H](C)c1cc(F)ccc1F)CC2 ZINC001190572280 1048757501 /nfs/dbraw/zinc/75/75/01/1048757501.db2.gz SYMTZHMINLPQCB-CYBMUJFWSA-N 1 2 317.379 4.483 20 0 DIADLO CCC[C@]1(C)CCC[N@H+](Cc2nc([C@@H](C)SCC)no2)C1 ZINC000483214331 1048759732 /nfs/dbraw/zinc/75/97/32/1048759732.db2.gz DKINZVWUAQCYIG-CZUORRHYSA-N 1 2 311.495 4.286 20 0 DIADLO CCC[C@]1(C)CCC[N@@H+](Cc2nc([C@@H](C)SCC)no2)C1 ZINC000483214331 1048759742 /nfs/dbraw/zinc/75/97/42/1048759742.db2.gz DKINZVWUAQCYIG-CZUORRHYSA-N 1 2 311.495 4.286 20 0 DIADLO Cn1ncc(C2CCC2)c1C[N@@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000668225580 1048760277 /nfs/dbraw/zinc/76/02/77/1048760277.db2.gz QJFLATCBMIZEQW-SFHVURJKSA-N 1 2 311.429 4.008 20 0 DIADLO Cn1ncc(C2CCC2)c1C[N@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000668225580 1048760288 /nfs/dbraw/zinc/76/02/88/1048760288.db2.gz QJFLATCBMIZEQW-SFHVURJKSA-N 1 2 311.429 4.008 20 0 DIADLO CSCc1cc[nH+]c(N2CCC[C@@H](Cc3ccccc3)C2)c1 ZINC001166563458 1048761593 /nfs/dbraw/zinc/76/15/93/1048761593.db2.gz HSUPBWRMTSOFAQ-KRWDZBQOSA-N 1 2 312.482 4.404 20 0 DIADLO COCOc1ccc(F)cc1Nc1ccc2c(C)cc[nH+]c2c1 ZINC001176721714 1048769622 /nfs/dbraw/zinc/76/96/22/1048769622.db2.gz ASCVVYMOUMBAGK-UHFFFAOYSA-N 1 2 312.344 4.409 20 0 DIADLO c1ccc([C@@H]2COCC[N@H+]2Cc2ccc(OCC3CC3)cc2)cc1 ZINC000483286247 1048773015 /nfs/dbraw/zinc/77/30/15/1048773015.db2.gz PVCSQPYYZNBHQU-NRFANRHFSA-N 1 2 323.436 4.049 20 0 DIADLO c1ccc([C@@H]2COCC[N@@H+]2Cc2ccc(OCC3CC3)cc2)cc1 ZINC000483286247 1048773028 /nfs/dbraw/zinc/77/30/28/1048773028.db2.gz PVCSQPYYZNBHQU-NRFANRHFSA-N 1 2 323.436 4.049 20 0 DIADLO Clc1ccc2c(cc[nH+]c2N2CC(OCc3ccccc3)C2)c1 ZINC001166631057 1048774183 /nfs/dbraw/zinc/77/41/83/1048774183.db2.gz OLPNEQBSSPXFSB-UHFFFAOYSA-N 1 2 324.811 4.294 20 0 DIADLO Cc1cc(Nc2ccc[nH+]c2N2CCCC2)nc2ccccc12 ZINC001176743248 1048776338 /nfs/dbraw/zinc/77/63/38/1048776338.db2.gz HQNPYWYCKVWVAJ-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO Cc1nc(C[N@H+](C)CCOc2ccccc2C(C)(C)C)oc1C ZINC000483306083 1048776257 /nfs/dbraw/zinc/77/62/57/1048776257.db2.gz CPUVCSOUPRPXPJ-UHFFFAOYSA-N 1 2 316.445 4.100 20 0 DIADLO Cc1nc(C[N@@H+](C)CCOc2ccccc2C(C)(C)C)oc1C ZINC000483306083 1048776269 /nfs/dbraw/zinc/77/62/69/1048776269.db2.gz CPUVCSOUPRPXPJ-UHFFFAOYSA-N 1 2 316.445 4.100 20 0 DIADLO CCC[C@@H](C)c1cc(Nc2ccc[nH+]c2N2CCCC2)on1 ZINC001176743333 1048779263 /nfs/dbraw/zinc/77/92/63/1048779263.db2.gz IMSFDJXTVIRLAJ-CYBMUJFWSA-N 1 2 300.406 4.317 20 0 DIADLO COc1cccc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)n1 ZINC000483417725 1048791065 /nfs/dbraw/zinc/79/10/65/1048791065.db2.gz NDPNMVDXEUXJEY-UHFFFAOYSA-N 1 2 324.346 4.045 20 0 DIADLO COc1cccc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)n1 ZINC000483417725 1048791076 /nfs/dbraw/zinc/79/10/76/1048791076.db2.gz NDPNMVDXEUXJEY-UHFFFAOYSA-N 1 2 324.346 4.045 20 0 DIADLO Cc1ccc(C(=O)C2CC[NH+](CC=C(Cl)Cl)CC2)cc1 ZINC000851733366 1048794483 /nfs/dbraw/zinc/79/44/83/1048794483.db2.gz SMEWXSVCQIJTBT-UHFFFAOYSA-N 1 2 312.240 4.209 20 0 DIADLO COC(C)(C)[C@@H]1CCCN1c1cc(C2CCCCC2)[nH+]c(C)n1 ZINC001166795794 1048795553 /nfs/dbraw/zinc/79/55/53/1048795553.db2.gz LJRGDQXIFNAKPE-KRWDZBQOSA-N 1 2 317.477 4.227 20 0 DIADLO Cc1ccccc1Oc1ccccc1NC(=O)CCn1cc[nH+]c1 ZINC001176878588 1048796946 /nfs/dbraw/zinc/79/69/46/1048796946.db2.gz ZMVLMMGKAZOMTF-UHFFFAOYSA-N 1 2 321.380 4.013 20 0 DIADLO COc1cc(C[N@H+](C)CC=C(Cl)Cl)ccc1SC ZINC000851739954 1048797451 /nfs/dbraw/zinc/79/74/51/1048797451.db2.gz JDKGMQARJQENAC-UHFFFAOYSA-N 1 2 306.258 4.168 20 0 DIADLO COc1cc(C[N@@H+](C)CC=C(Cl)Cl)ccc1SC ZINC000851739954 1048797460 /nfs/dbraw/zinc/79/74/60/1048797460.db2.gz JDKGMQARJQENAC-UHFFFAOYSA-N 1 2 306.258 4.168 20 0 DIADLO CCc1cnc(C[N@@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)s1 ZINC000483434036 1048797984 /nfs/dbraw/zinc/79/79/84/1048797984.db2.gz OEMLAULTLLFDKO-LLVKDONJSA-N 1 2 306.397 4.116 20 0 DIADLO CCc1cnc(C[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)s1 ZINC000483434036 1048797993 /nfs/dbraw/zinc/79/79/93/1048797993.db2.gz OEMLAULTLLFDKO-LLVKDONJSA-N 1 2 306.397 4.116 20 0 DIADLO Fc1ccc([C@H](CC(F)(F)F)[NH2+]Cc2cccc(F)n2)cc1 ZINC000851898232 1048810272 /nfs/dbraw/zinc/81/02/72/1048810272.db2.gz UHWPOYVUTSLGMP-ZDUSSCGKSA-N 1 2 316.273 4.143 20 0 DIADLO ClC(Cl)=CC[N@@H+]1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000852173720 1048825968 /nfs/dbraw/zinc/82/59/68/1048825968.db2.gz YCNMOOGPKFVCAA-HNNXBMFYSA-N 1 2 312.240 4.159 20 0 DIADLO ClC(Cl)=CC[N@H+]1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000852173720 1048826001 /nfs/dbraw/zinc/82/60/01/1048826001.db2.gz YCNMOOGPKFVCAA-HNNXBMFYSA-N 1 2 312.240 4.159 20 0 DIADLO CCCCCCO[C@@H]1CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC001224670512 1048828471 /nfs/dbraw/zinc/82/84/71/1048828471.db2.gz UTRJYAFTSZXSDI-CYBMUJFWSA-N 1 2 316.898 4.358 20 0 DIADLO CCCCCCO[C@@H]1CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC001224670512 1048828490 /nfs/dbraw/zinc/82/84/90/1048828490.db2.gz UTRJYAFTSZXSDI-CYBMUJFWSA-N 1 2 316.898 4.358 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001167016326 1048830816 /nfs/dbraw/zinc/83/08/16/1048830816.db2.gz LETWGAUODWNFAQ-ABAIWWIYSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001167016326 1048830842 /nfs/dbraw/zinc/83/08/42/1048830842.db2.gz LETWGAUODWNFAQ-ABAIWWIYSA-N 1 2 302.245 4.035 20 0 DIADLO COc1ccc(CN(C)c2[nH+]c(C)cc(Cl)c2C)c(OC)c1 ZINC001167021498 1048833107 /nfs/dbraw/zinc/83/31/07/1048833107.db2.gz QNUGJURCDSAHTJ-UHFFFAOYSA-N 1 2 320.820 4.005 20 0 DIADLO Cc1cc(C[N@H+]2C[C@H](C)O[C@@H](c3ccccc3)C2)cc(Cl)n1 ZINC000797590038 1048833413 /nfs/dbraw/zinc/83/34/13/1048833413.db2.gz JEAFEUUGFXJKSU-WMLDXEAASA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cc(C[N@@H+]2C[C@H](C)O[C@@H](c3ccccc3)C2)cc(Cl)n1 ZINC000797590038 1048833432 /nfs/dbraw/zinc/83/34/32/1048833432.db2.gz JEAFEUUGFXJKSU-WMLDXEAASA-N 1 2 316.832 4.005 20 0 DIADLO C[C@@H]1COC2(CCC2)C[N@@H+]1Cc1cc2ccccc2nc1Cl ZINC000852440956 1048839862 /nfs/dbraw/zinc/83/98/62/1048839862.db2.gz IUJKBBFCYRROCO-CYBMUJFWSA-N 1 2 316.832 4.032 20 0 DIADLO C[C@@H]1COC2(CCC2)C[N@H+]1Cc1cc2ccccc2nc1Cl ZINC000852440956 1048839871 /nfs/dbraw/zinc/83/98/71/1048839871.db2.gz IUJKBBFCYRROCO-CYBMUJFWSA-N 1 2 316.832 4.032 20 0 DIADLO C[C@@H]1COC2(CCC2)C[N@@H+]1Cc1cc2ccccc2c(Cl)n1 ZINC000852443617 1048841603 /nfs/dbraw/zinc/84/16/03/1048841603.db2.gz LFDCKXGAVLAPLJ-CYBMUJFWSA-N 1 2 316.832 4.032 20 0 DIADLO C[C@@H]1COC2(CCC2)C[N@H+]1Cc1cc2ccccc2c(Cl)n1 ZINC000852443617 1048841611 /nfs/dbraw/zinc/84/16/11/1048841611.db2.gz LFDCKXGAVLAPLJ-CYBMUJFWSA-N 1 2 316.832 4.032 20 0 DIADLO CCC[C@](C)([NH2+]Cc1c(CC)ccc2ccccc21)C(=O)OC ZINC001191099881 1048848828 /nfs/dbraw/zinc/84/88/28/1048848828.db2.gz QGCRDKXWRAMVGJ-FQEVSTJZSA-N 1 2 313.441 4.224 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@@H+]2CC(=O)OC(C)(C)C)o1 ZINC001191113527 1048854028 /nfs/dbraw/zinc/85/40/28/1048854028.db2.gz YLCVFUDLLAIJPR-OAHLLOKOSA-N 1 2 307.434 4.101 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@H+]2CC(=O)OC(C)(C)C)o1 ZINC001191113527 1048854044 /nfs/dbraw/zinc/85/40/44/1048854044.db2.gz YLCVFUDLLAIJPR-OAHLLOKOSA-N 1 2 307.434 4.101 20 0 DIADLO Fc1ccc([C@H]2CSCC[N@@H+]2Cc2ccccc2F)cc1 ZINC001203353869 1048859692 /nfs/dbraw/zinc/85/96/92/1048859692.db2.gz QFRXUYGMSXKQHM-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1ccc([C@H]2CSCC[N@H+]2Cc2ccccc2F)cc1 ZINC001203353869 1048859713 /nfs/dbraw/zinc/85/97/13/1048859713.db2.gz QFRXUYGMSXKQHM-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO CC(C)(C)c1ccc(NC(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001191126974 1048861684 /nfs/dbraw/zinc/86/16/84/1048861684.db2.gz QFYAPYXDEZDRMH-UHFFFAOYSA-N 1 2 308.385 4.276 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2ccsc2)n1)c1ccns1 ZINC001203307199 1048863197 /nfs/dbraw/zinc/86/31/97/1048863197.db2.gz NEJJMCWXRPUOSL-VIFPVBQESA-N 1 2 307.469 4.179 20 0 DIADLO CC(C)Oc1ncc(Cl)cc1Nc1ccc2c(c1)[nH+]cn2C ZINC001203315576 1048867660 /nfs/dbraw/zinc/86/76/60/1048867660.db2.gz SLPWKKWMRFFDLR-UHFFFAOYSA-N 1 2 316.792 4.153 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1ccccc1Br)C2 ZINC001203320098 1048868477 /nfs/dbraw/zinc/86/84/77/1048868477.db2.gz ITWHJFGZJTZTOB-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1ccccc1Br)C2 ZINC001203320098 1048868489 /nfs/dbraw/zinc/86/84/89/1048868489.db2.gz ITWHJFGZJTZTOB-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@H](C)c3cc4ccccc4o3)[nH]c2c1 ZINC000483839632 1048869700 /nfs/dbraw/zinc/86/97/00/1048869700.db2.gz KCOSJLIYVGFTDY-CYBMUJFWSA-N 1 2 305.381 4.468 20 0 DIADLO Cc1cc(Br)c(CNc2cccc[nH+]2)cc1Cl ZINC001177370554 1048874752 /nfs/dbraw/zinc/87/47/52/1048874752.db2.gz ISZBZOGZOWUKQX-UHFFFAOYSA-N 1 2 311.610 4.418 20 0 DIADLO c1cnc2cccc(CNc3ccc(N4CCCCC4)c[nH+]3)c2c1 ZINC001177404194 1048882501 /nfs/dbraw/zinc/88/25/01/1048882501.db2.gz ZLATXYFNHTWANF-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO Cc1ccc(Nc2cc(-c3ccc(F)c(F)c3)no2)c(C)[nH+]1 ZINC001203363789 1048884167 /nfs/dbraw/zinc/88/41/67/1048884167.db2.gz XGQDQWSQCGVMPP-UHFFFAOYSA-N 1 2 301.296 4.375 20 0 DIADLO CC(C)(CNc1ccc(N2CCCCC2)c[nH+]1)c1ccccc1 ZINC001177404072 1048884489 /nfs/dbraw/zinc/88/44/89/1048884489.db2.gz SBZOOAPCYFDCML-UHFFFAOYSA-N 1 2 309.457 4.462 20 0 DIADLO Cc1ccc(Nc2cc(F)ccc2OC[C@@H]2CCCO2)c(C)[nH+]1 ZINC001203373150 1048885054 /nfs/dbraw/zinc/88/50/54/1048885054.db2.gz IHDWPITXCZDHSP-HNNXBMFYSA-N 1 2 316.376 4.139 20 0 DIADLO C[C@]1(c2ccc(F)cc2)C[N@H+](Cc2ccccc2Cl)CCO1 ZINC001203385172 1048886642 /nfs/dbraw/zinc/88/66/42/1048886642.db2.gz MMPPFTRXTDUZQW-GOSISDBHSA-N 1 2 319.807 4.227 20 0 DIADLO C[C@]1(c2ccc(F)cc2)C[N@@H+](Cc2ccccc2Cl)CCO1 ZINC001203385172 1048886660 /nfs/dbraw/zinc/88/66/60/1048886660.db2.gz MMPPFTRXTDUZQW-GOSISDBHSA-N 1 2 319.807 4.227 20 0 DIADLO COc1ccc(Nc2ccc(C)[nH+]c2C)cc1Br ZINC001203373876 1048887338 /nfs/dbraw/zinc/88/73/38/1048887338.db2.gz PDKRWQDMHRDAOL-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(Cl)c2)C[N@@H+]1Cc1cccs1 ZINC000483975574 1048890356 /nfs/dbraw/zinc/89/03/56/1048890356.db2.gz GZDPKILUUSRVMO-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(Cl)c2)C[N@H+]1Cc1cccs1 ZINC000483975574 1048890369 /nfs/dbraw/zinc/89/03/69/1048890369.db2.gz GZDPKILUUSRVMO-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1ncc(-c3cccs3)o1)C2 ZINC000483980290 1048890878 /nfs/dbraw/zinc/89/08/78/1048890878.db2.gz SBRHYNJNGBJIOU-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1ncc(-c3cccs3)o1)C2 ZINC000483980290 1048890886 /nfs/dbraw/zinc/89/08/86/1048890886.db2.gz SBRHYNJNGBJIOU-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2csnc2OC)o1 ZINC001191259037 1048900974 /nfs/dbraw/zinc/90/09/74/1048900974.db2.gz RUTVQLGETRLZMX-IUODEOHRSA-N 1 2 320.458 4.280 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2csnc2OC)o1 ZINC001191259037 1048900988 /nfs/dbraw/zinc/90/09/88/1048900988.db2.gz RUTVQLGETRLZMX-IUODEOHRSA-N 1 2 320.458 4.280 20 0 DIADLO CNc1ccc(Nc2cccc(Cc3cccc(N)c3)c2)c[nH+]1 ZINC001203459703 1048905524 /nfs/dbraw/zinc/90/55/24/1048905524.db2.gz PFUATXASZJWNEA-UHFFFAOYSA-N 1 2 304.397 4.040 20 0 DIADLO CNc1ccc(Nc2cccc(C(=O)c3ccccc3)c2)c[nH+]1 ZINC001203456692 1048906333 /nfs/dbraw/zinc/90/63/33/1048906333.db2.gz QVJGZGCNUBMRHC-UHFFFAOYSA-N 1 2 303.365 4.098 20 0 DIADLO CNc1ccc(Nc2ccc3nc(C(F)(F)F)ccc3c2)c[nH+]1 ZINC001203459196 1048907439 /nfs/dbraw/zinc/90/74/39/1048907439.db2.gz ZRXRMQRJWHPFFC-UHFFFAOYSA-N 1 2 318.302 4.434 20 0 DIADLO Cc1cccc(C)c1[C@@H]1CCC[N@@H+]1Cn1ncsc1=S ZINC000853522248 1048908615 /nfs/dbraw/zinc/90/86/15/1048908615.db2.gz LRXOYXIATGNCBQ-ZDUSSCGKSA-N 1 2 305.472 4.086 20 0 DIADLO Cc1cccc(C)c1[C@@H]1CCC[N@H+]1Cn1ncsc1=S ZINC000853522248 1048908625 /nfs/dbraw/zinc/90/86/25/1048908625.db2.gz LRXOYXIATGNCBQ-ZDUSSCGKSA-N 1 2 305.472 4.086 20 0 DIADLO Clc1ccc(/C=C/C[N@@H+]2CCOC[C@@H]2c2ccccc2)cc1 ZINC001191243066 1048910044 /nfs/dbraw/zinc/91/00/44/1048910044.db2.gz BKBHWCVLPZMZOT-VZSQWMKGSA-N 1 2 313.828 4.427 20 0 DIADLO Clc1ccc(/C=C/C[N@H+]2CCOC[C@@H]2c2ccccc2)cc1 ZINC001191243066 1048910056 /nfs/dbraw/zinc/91/00/56/1048910056.db2.gz BKBHWCVLPZMZOT-VZSQWMKGSA-N 1 2 313.828 4.427 20 0 DIADLO Cc1ccc[nH+]c1Nc1ccc(N(C)Cc2ccccc2)nc1 ZINC001203512920 1048916078 /nfs/dbraw/zinc/91/60/78/1048916078.db2.gz GXRQQTHSDDXQFJ-UHFFFAOYSA-N 1 2 304.397 4.165 20 0 DIADLO CN(Cc1ccccc1)c1ccc(N(C)c2cccc(N)c2)c[nH+]1 ZINC001203518331 1048917186 /nfs/dbraw/zinc/91/71/86/1048917186.db2.gz DDVRZIBZJPITPW-UHFFFAOYSA-N 1 2 318.424 4.068 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2c(Cl)c(F)nc(F)c2Cl)c1 ZINC001203654460 1048950473 /nfs/dbraw/zinc/95/04/73/1048950473.db2.gz KIBXTGYVIZKGDZ-UHFFFAOYSA-N 1 2 304.127 4.422 20 0 DIADLO Brc1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)cc1 ZINC001191390374 1048929538 /nfs/dbraw/zinc/92/95/38/1048929538.db2.gz LHOBZFVFHOPJLI-INIZCTEOSA-N 1 2 302.215 4.396 20 0 DIADLO Brc1ccc(C[N@H+]2CC[C@H]2c2ccccc2)cc1 ZINC001191390374 1048929553 /nfs/dbraw/zinc/92/95/53/1048929553.db2.gz LHOBZFVFHOPJLI-INIZCTEOSA-N 1 2 302.215 4.396 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1cncc(Oc2ccccc2)c1 ZINC001203561604 1048931222 /nfs/dbraw/zinc/93/12/22/1048931222.db2.gz XHGCZVMKTMMHEL-UHFFFAOYSA-N 1 2 316.364 4.103 20 0 DIADLO CC(C)(C)Oc1cccc(C[NH2+]C2(c3ccccc3F)CC2)n1 ZINC000775452510 1048936935 /nfs/dbraw/zinc/93/69/35/1048936935.db2.gz YAAYKNUMTRVKQA-UHFFFAOYSA-N 1 2 314.404 4.177 20 0 DIADLO CC(C)c1cc(C[NH2+]Cc2c(Cl)ccc3cccnc32)on1 ZINC001177821715 1048942893 /nfs/dbraw/zinc/94/28/93/1048942893.db2.gz CTDCVMSMBSGCBM-UHFFFAOYSA-N 1 2 315.804 4.289 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc3nnc(-c4ccccc4)n3c2)c1 ZINC001203657682 1048951734 /nfs/dbraw/zinc/95/17/34/1048951734.db2.gz UBTWEXXLZYMSPP-UHFFFAOYSA-N 1 2 315.380 4.152 20 0 DIADLO CNc1cccc(Br)c1Nc1cc(C)c[nH+]c1C ZINC001203664044 1048953146 /nfs/dbraw/zinc/95/31/46/1048953146.db2.gz VMBBJAADJAVZOG-UHFFFAOYSA-N 1 2 306.207 4.246 20 0 DIADLO FC(F)(F)CCc1ccc(NCc2cccc3[nH+]ccn32)cc1 ZINC001177931982 1048964891 /nfs/dbraw/zinc/96/48/91/1048964891.db2.gz FVSLFPBWSXTBTP-UHFFFAOYSA-N 1 2 319.330 4.441 20 0 DIADLO CCCOc1ccc(Nc2cccc3[nH+]ccn32)c(F)c1F ZINC001203692331 1048965736 /nfs/dbraw/zinc/96/57/36/1048965736.db2.gz XEFBJEOEGUHOIG-UHFFFAOYSA-N 1 2 303.312 4.145 20 0 DIADLO Clc1cscc1C[NH2+]Cc1csc(-c2ccco2)n1 ZINC001177999194 1048970963 /nfs/dbraw/zinc/97/09/63/1048970963.db2.gz AFULNPCYJOFWIA-UHFFFAOYSA-N 1 2 310.831 4.408 20 0 DIADLO Fc1cnc(F)c(F)c1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203712710 1048973517 /nfs/dbraw/zinc/97/35/17/1048973517.db2.gz MYOUKUBBRVWFDW-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO COC(=O)Cc1cccc(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001203718859 1048975024 /nfs/dbraw/zinc/97/50/24/1048975024.db2.gz FFZPTGHFTAYECF-UHFFFAOYSA-N 1 2 324.424 4.136 20 0 DIADLO FC(F)(F)Cn1cnc(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001203719328 1048975201 /nfs/dbraw/zinc/97/52/01/1048975201.db2.gz RZZVKGOLZXUYKB-UHFFFAOYSA-N 1 2 324.350 4.179 20 0 DIADLO c1cc(Nc2ccc([NH+]3CCCCC3)cc2)c2c(c1)OCCO2 ZINC001203718799 1048975367 /nfs/dbraw/zinc/97/53/67/1048975367.db2.gz AMQPXSYCYYMUCF-UHFFFAOYSA-N 1 2 310.397 4.192 20 0 DIADLO CCc1ncc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)o1 ZINC001191645307 1048976414 /nfs/dbraw/zinc/97/64/14/1048976414.db2.gz CCLVIEQCUTULRF-UHFFFAOYSA-N 1 2 310.397 4.341 20 0 DIADLO CCc1ncc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)o1 ZINC001191645307 1048976430 /nfs/dbraw/zinc/97/64/30/1048976430.db2.gz CCLVIEQCUTULRF-UHFFFAOYSA-N 1 2 310.397 4.341 20 0 DIADLO Nc1cc(Cl)ncc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718281 1048976731 /nfs/dbraw/zinc/97/67/31/1048976731.db2.gz ZUYCRJWRIBIDQT-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO Cn1cc(Nc2ccc([NH+]3CCCCC3)cc2)c(C(F)(F)F)n1 ZINC001203718175 1048977209 /nfs/dbraw/zinc/97/72/09/1048977209.db2.gz UPHIZBXARCZHPD-UHFFFAOYSA-N 1 2 324.350 4.173 20 0 DIADLO c1nnc(-c2cccc(Nc3ccc([NH+]4CCCCC4)cc3)c2)o1 ZINC001203719587 1048978807 /nfs/dbraw/zinc/97/88/07/1048978807.db2.gz QRXXLJMBZCJGPG-UHFFFAOYSA-N 1 2 320.396 4.471 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1NCc1cccc2[nH+]ccn21 ZINC001178046085 1048979102 /nfs/dbraw/zinc/97/91/02/1048979102.db2.gz ITDSLTJURZRCPB-UHFFFAOYSA-N 1 2 305.303 4.274 20 0 DIADLO c1cc(C2OCCO2)ccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203719824 1048979635 /nfs/dbraw/zinc/97/96/35/1048979635.db2.gz UNEZGOVMTOPZSY-UHFFFAOYSA-N 1 2 324.424 4.466 20 0 DIADLO c1cnn(-c2cccc(Nc3ccc([NH+]4CCCCC4)cc3)c2)n1 ZINC001203724623 1048981650 /nfs/dbraw/zinc/98/16/50/1048981650.db2.gz SVBYXYNRVNNBJJ-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO Cc1csc(-c2ccc(NCc3cccc4[nH+]ccn43)cc2)n1 ZINC001178025163 1048983231 /nfs/dbraw/zinc/98/32/31/1048983231.db2.gz GQCIACCUZBXNCN-UHFFFAOYSA-N 1 2 320.421 4.378 20 0 DIADLO CC(C)c1cnc(CNc2ccc3c(c2)CCC[N@H+]3C)s1 ZINC001178114207 1048986286 /nfs/dbraw/zinc/98/62/86/1048986286.db2.gz FDHBGWDIYJKENM-UHFFFAOYSA-N 1 2 301.459 4.261 20 0 DIADLO CC(C)c1cnc(CNc2ccc3c(c2)CCC[N@@H+]3C)s1 ZINC001178114207 1048986304 /nfs/dbraw/zinc/98/63/04/1048986304.db2.gz FDHBGWDIYJKENM-UHFFFAOYSA-N 1 2 301.459 4.261 20 0 DIADLO Cc1cc(NCc2ncc(C(C)C)s2)ccc1-n1cc[nH+]c1 ZINC001178138237 1048990315 /nfs/dbraw/zinc/99/03/15/1048990315.db2.gz BOLVTRCNEXMZIX-UHFFFAOYSA-N 1 2 312.442 4.373 20 0 DIADLO Cc1cc(NCc2cccc3cccnc32)ccc1-n1cc[nH+]c1 ZINC001178139345 1048990628 /nfs/dbraw/zinc/99/06/28/1048990628.db2.gz SGZKFVIDDIFHSF-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Cc1cc(CNC(=O)c2ccccc2-c2ccccc2)cc(C)[nH+]1 ZINC001276417957 1048991079 /nfs/dbraw/zinc/99/10/79/1048991079.db2.gz GUNPRBYZPVNUFO-UHFFFAOYSA-N 1 2 316.404 4.295 20 0 DIADLO C[C@H](N[C@@H](C)c1c(F)cccc1Cl)c1cn2c([nH+]1)CCCC2 ZINC000925488520 1048994175 /nfs/dbraw/zinc/99/41/75/1048994175.db2.gz KEZVAJFJLYGMLJ-RYUDHWBXSA-N 1 2 321.827 4.424 20 0 DIADLO CCn1ccnc1C[NH2+][C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC001178180642 1048994978 /nfs/dbraw/zinc/99/49/78/1048994978.db2.gz BROFRRCYJRBSEL-INIZCTEOSA-N 1 2 307.388 4.058 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1noc([C@H]2CCC[C@H]2c2ccccc2)n1 ZINC000904268626 1049009138 /nfs/dbraw/zinc/00/91/38/1049009138.db2.gz XJSMHQRLGSEYHO-GJZGRUSLSA-N 1 2 320.396 4.074 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1noc([C@@H](F)CC2CCCCC2)n1 ZINC000904269259 1049010147 /nfs/dbraw/zinc/01/01/47/1049010147.db2.gz ZFCNJLWLVFZQDF-ZDUSSCGKSA-N 1 2 304.369 4.003 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)cc1O ZINC001203870556 1049019318 /nfs/dbraw/zinc/01/93/18/1049019318.db2.gz IIEDCBLWPGFMEF-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)cc1O ZINC001203870556 1049019335 /nfs/dbraw/zinc/01/93/35/1049019335.db2.gz IIEDCBLWPGFMEF-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO CN(C(=O)c1cccc2[nH+]ccn21)C1CCC(C(C)(C)C)CC1 ZINC000776800221 1049021077 /nfs/dbraw/zinc/02/10/77/1049021077.db2.gz NSKSWYUPIQQTOU-UHFFFAOYSA-N 1 2 313.445 4.011 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(s1)CCC2)c1cc(Cl)ccc1F ZINC001178361641 1049027236 /nfs/dbraw/zinc/02/72/36/1049027236.db2.gz XTMIXFHAEUKWRR-SECBINFHSA-N 1 2 310.825 4.275 20 0 DIADLO Cc1cc(NCc2cc(Cl)cc3c2OCC3)ccc1[NH+](C)C ZINC001178360302 1049028104 /nfs/dbraw/zinc/02/81/04/1049028104.db2.gz LYFHLJBRAADTEG-UHFFFAOYSA-N 1 2 316.832 4.261 20 0 DIADLO COc1cc(C)[nH+]c(CN2CC(C)(C)c3c2cccc3Cl)c1 ZINC001192040895 1049033720 /nfs/dbraw/zinc/03/37/20/1049033720.db2.gz DAOVESRVUIITLW-UHFFFAOYSA-N 1 2 316.832 4.350 20 0 DIADLO CC[C@@H]1CCC[N@@H+](Cc2cncc(Br)c2Cl)C1 ZINC001250470300 1049097566 /nfs/dbraw/zinc/09/75/66/1049097566.db2.gz KNVMYUQMYBJSPQ-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO COc1ccnc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2Cl)c1 ZINC000925489117 1049045532 /nfs/dbraw/zinc/04/55/32/1049045532.db2.gz NOMCNUPDGUSWDD-WDEREUQCSA-N 1 2 308.784 4.295 20 0 DIADLO Cc1ccsc1C[N@H+]1Cc2cccc(Br)c2C1 ZINC001204021710 1049063184 /nfs/dbraw/zinc/06/31/84/1049063184.db2.gz MUWLNUQZCQKOPX-UHFFFAOYSA-N 1 2 308.244 4.335 20 0 DIADLO Cc1coc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)c1 ZINC001178583902 1049057448 /nfs/dbraw/zinc/05/74/48/1049057448.db2.gz AEYRIGBSXJYGFO-UHFFFAOYSA-N 1 2 307.397 4.400 20 0 DIADLO COC(=O)c1cccc2c1C[N@H+](Cc1ccc3ccccc3c1)C2 ZINC001204000858 1049057887 /nfs/dbraw/zinc/05/78/87/1049057887.db2.gz RHVMJTAIVRBWSR-UHFFFAOYSA-N 1 2 317.388 4.142 20 0 DIADLO COC(=O)c1cccc2c1C[N@@H+](Cc1ccc3ccccc3c1)C2 ZINC001204000858 1049057903 /nfs/dbraw/zinc/05/79/03/1049057903.db2.gz RHVMJTAIVRBWSR-UHFFFAOYSA-N 1 2 317.388 4.142 20 0 DIADLO Cc1ccsc1C[N@@H+]1Cc2cccc(Br)c2C1 ZINC001204021710 1049063178 /nfs/dbraw/zinc/06/31/78/1049063178.db2.gz MUWLNUQZCQKOPX-UHFFFAOYSA-N 1 2 308.244 4.335 20 0 DIADLO O=C(c1cccc2[nH+]ccn21)N(c1ccccc1)C1CCCCC1 ZINC000776842706 1049068380 /nfs/dbraw/zinc/06/83/80/1049068380.db2.gz FEPQODXRRXYSNH-UHFFFAOYSA-N 1 2 319.408 4.314 20 0 DIADLO COC(=O)c1ccoc1C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000338986201 1049075922 /nfs/dbraw/zinc/07/59/22/1049075922.db2.gz NEMCQUUYTKJMJS-OAHLLOKOSA-N 1 2 319.788 4.057 20 0 DIADLO COC(=O)c1ccoc1C[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000338986201 1049075935 /nfs/dbraw/zinc/07/59/35/1049075935.db2.gz NEMCQUUYTKJMJS-OAHLLOKOSA-N 1 2 319.788 4.057 20 0 DIADLO Clc1cccc([C@H]2CSCC[N@@H+]2Cc2cccnc2)c1 ZINC001204075713 1049077866 /nfs/dbraw/zinc/07/78/66/1049077866.db2.gz RBYMNPDCWQYRKV-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cccc([C@H]2CSCC[N@H+]2Cc2cccnc2)c1 ZINC001204075713 1049077877 /nfs/dbraw/zinc/07/78/77/1049077877.db2.gz RBYMNPDCWQYRKV-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cccc2[nH]ccc21 ZINC001204079024 1049079448 /nfs/dbraw/zinc/07/94/48/1049079448.db2.gz GHPIHSGJHIDWMJ-UHFFFAOYSA-N 1 2 308.360 4.289 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1cncc(Cl)c1 ZINC001192301869 1049081169 /nfs/dbraw/zinc/08/11/69/1049081169.db2.gz CWGOTUBBVXYXTD-NEPJUHHUSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1cncc(Cl)c1 ZINC001192301869 1049081184 /nfs/dbraw/zinc/08/11/84/1049081184.db2.gz CWGOTUBBVXYXTD-NEPJUHHUSA-N 1 2 304.796 4.382 20 0 DIADLO CC(C)Oc1cccc(NCc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001178769867 1049086681 /nfs/dbraw/zinc/08/66/81/1049086681.db2.gz SEEFCVZHUWRKJO-UHFFFAOYSA-N 1 2 307.397 4.272 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccccc2Br)cs1 ZINC000034996242 1049090703 /nfs/dbraw/zinc/09/07/03/1049090703.db2.gz WOHAFUCQOXABND-SECBINFHSA-N 1 2 311.248 4.065 20 0 DIADLO CSc1ccc(C[N@@H+]2CCc3cc(F)c(F)cc3C2)cc1 ZINC001204147119 1049096610 /nfs/dbraw/zinc/09/66/10/1049096610.db2.gz VWSDOHHQUXGFDB-UHFFFAOYSA-N 1 2 305.393 4.245 20 0 DIADLO CSc1ccc(C[N@H+]2CCc3cc(F)c(F)cc3C2)cc1 ZINC001204147119 1049096622 /nfs/dbraw/zinc/09/66/22/1049096622.db2.gz VWSDOHHQUXGFDB-UHFFFAOYSA-N 1 2 305.393 4.245 20 0 DIADLO CC[C@@H]1CCC[N@H+](Cc2cncc(Br)c2Cl)C1 ZINC001250470300 1049097557 /nfs/dbraw/zinc/09/75/57/1049097557.db2.gz KNVMYUQMYBJSPQ-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO CC(C)n1c[nH+]cc1CNC(=O)Nc1ccc2sccc2c1 ZINC001192469769 1049102650 /nfs/dbraw/zinc/10/26/50/1049102650.db2.gz GGHSHTASIBLACB-UHFFFAOYSA-N 1 2 314.414 4.000 20 0 DIADLO C[C@@H](NC(=O)c1cccc2[nH+]ccn21)c1cc2ccccc2s1 ZINC000776902246 1049110692 /nfs/dbraw/zinc/11/06/92/1049110692.db2.gz RKDUCVYUXCBHIN-GFCCVEGCSA-N 1 2 321.405 4.040 20 0 DIADLO Cc1ccc(-c2cccc(C[NH2+][C@@H](C)c3csnn3)c2)cc1 ZINC001178971697 1049115882 /nfs/dbraw/zinc/11/58/82/1049115882.db2.gz LSFPXSIZHQPVTJ-AWEZNQCLSA-N 1 2 309.438 4.364 20 0 DIADLO Fc1ccccc1COc1ccc(C[N@H+]2CCC=C(F)C2)cc1 ZINC001192536178 1049116122 /nfs/dbraw/zinc/11/61/22/1049116122.db2.gz KVZUTTVDUZLKSR-UHFFFAOYSA-N 1 2 315.363 4.464 20 0 DIADLO Fc1ccccc1COc1ccc(C[N@@H+]2CCC=C(F)C2)cc1 ZINC001192536178 1049116125 /nfs/dbraw/zinc/11/61/25/1049116125.db2.gz KVZUTTVDUZLKSR-UHFFFAOYSA-N 1 2 315.363 4.464 20 0 DIADLO c1cc2cc(NCc3ccc(Sc4ccccn4)o3)[nH+]cc2[nH]1 ZINC001179044811 1049123316 /nfs/dbraw/zinc/12/33/16/1049123316.db2.gz QWNFSYSOXGLBHY-UHFFFAOYSA-N 1 2 322.393 4.314 20 0 DIADLO CCCCCCOc1ccccc1C[N@@H+]1CCCC(=O)CC1 ZINC001204297684 1049131802 /nfs/dbraw/zinc/13/18/02/1049131802.db2.gz LLDVFIYCKRSXSW-UHFFFAOYSA-N 1 2 303.446 4.201 20 0 DIADLO CCCCCCOc1ccccc1C[N@H+]1CCCC(=O)CC1 ZINC001204297684 1049131809 /nfs/dbraw/zinc/13/18/09/1049131809.db2.gz LLDVFIYCKRSXSW-UHFFFAOYSA-N 1 2 303.446 4.201 20 0 DIADLO CCCCCCOc1ccccc1C[N@H+](C)Cc1ccncn1 ZINC001204294154 1049132677 /nfs/dbraw/zinc/13/26/77/1049132677.db2.gz NCFLIECNYYPMPH-UHFFFAOYSA-N 1 2 313.445 4.068 20 0 DIADLO CCCCCCOc1ccccc1C[N@@H+](C)Cc1ccncn1 ZINC001204294154 1049132680 /nfs/dbraw/zinc/13/26/80/1049132680.db2.gz NCFLIECNYYPMPH-UHFFFAOYSA-N 1 2 313.445 4.068 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1CCCCC[C@H]1c1ccco1 ZINC001204299136 1049135041 /nfs/dbraw/zinc/13/50/41/1049135041.db2.gz QBQYWLCQCHXREM-ZDUSSCGKSA-N 1 2 307.825 4.267 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1CCCCC[C@H]1c1ccco1 ZINC001204299136 1049135047 /nfs/dbraw/zinc/13/50/47/1049135047.db2.gz QBQYWLCQCHXREM-ZDUSSCGKSA-N 1 2 307.825 4.267 20 0 DIADLO CCCOc1ccc(C[N@H+](C)Cc2cnc(Cl)s2)cc1 ZINC001204306377 1049136306 /nfs/dbraw/zinc/13/63/06/1049136306.db2.gz QOSVTOUFZCEWDD-UHFFFAOYSA-N 1 2 310.850 4.217 20 0 DIADLO CCCOc1ccc(C[N@@H+](C)Cc2cnc(Cl)s2)cc1 ZINC001204306377 1049136313 /nfs/dbraw/zinc/13/63/13/1049136313.db2.gz QOSVTOUFZCEWDD-UHFFFAOYSA-N 1 2 310.850 4.217 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccc(Br)c(F)c2F)C[C@H]1C ZINC000701278917 1049136708 /nfs/dbraw/zinc/13/67/08/1049136708.db2.gz CKXNGZNSABFPDK-VHSXEESVSA-N 1 2 318.205 4.205 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccc(Br)c(F)c2F)C[C@H]1C ZINC000701278917 1049136715 /nfs/dbraw/zinc/13/67/15/1049136715.db2.gz CKXNGZNSABFPDK-VHSXEESVSA-N 1 2 318.205 4.205 20 0 DIADLO c1ccc(Nc2ccc(NCc3nc4c(s3)CCC4)[nH+]c2)cc1 ZINC001179205066 1049141114 /nfs/dbraw/zinc/14/11/14/1049141114.db2.gz ITGOGFOFXHYFBQ-UHFFFAOYSA-N 1 2 322.437 4.383 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(CCC(C)C)no1)c1ccc(C)c(F)c1 ZINC001192909177 1049147180 /nfs/dbraw/zinc/14/71/80/1049147180.db2.gz GFWDUTRJOCSWNQ-MRXNPFEDSA-N 1 2 319.424 4.347 20 0 DIADLO CCCCCCOc1ccc(C[N@@H+]2CCOCC23CC3)cc1 ZINC001204366995 1049151402 /nfs/dbraw/zinc/15/14/02/1049151402.db2.gz TZNIWTQYIGWSSQ-UHFFFAOYSA-N 1 2 303.446 4.011 20 0 DIADLO CCCCCCOc1ccc(C[N@H+]2CCOCC23CC3)cc1 ZINC001204366995 1049151408 /nfs/dbraw/zinc/15/14/08/1049151408.db2.gz TZNIWTQYIGWSSQ-UHFFFAOYSA-N 1 2 303.446 4.011 20 0 DIADLO Cc1ccc([C@@]2(C)C[N@H+](Cc3ccc(Cl)s3)CCO2)cc1 ZINC001204442123 1049163865 /nfs/dbraw/zinc/16/38/65/1049163865.db2.gz IGWWYFBIUJTJPT-QGZVFWFLSA-N 1 2 321.873 4.458 20 0 DIADLO Cc1ccc([C@@]2(C)C[N@@H+](Cc3ccc(Cl)s3)CCO2)cc1 ZINC001204442123 1049163869 /nfs/dbraw/zinc/16/38/69/1049163869.db2.gz IGWWYFBIUJTJPT-QGZVFWFLSA-N 1 2 321.873 4.458 20 0 DIADLO Cc1ccc([C@]2(C)C[N@H+](Cc3ccc(Cl)s3)CCO2)cc1 ZINC001204442122 1049164171 /nfs/dbraw/zinc/16/41/71/1049164171.db2.gz IGWWYFBIUJTJPT-KRWDZBQOSA-N 1 2 321.873 4.458 20 0 DIADLO Cc1ccc([C@]2(C)C[N@@H+](Cc3ccc(Cl)s3)CCO2)cc1 ZINC001204442122 1049164175 /nfs/dbraw/zinc/16/41/75/1049164175.db2.gz IGWWYFBIUJTJPT-KRWDZBQOSA-N 1 2 321.873 4.458 20 0 DIADLO Cc1cc(NCc2cc(Cl)c3c(c2)OCCCO3)c[nH+]c1C ZINC001179448143 1049165889 /nfs/dbraw/zinc/16/58/89/1049165889.db2.gz XJTWJWAOOAOFJY-UHFFFAOYSA-N 1 2 318.804 4.125 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@H+]1CC=C(C(C)(C)C)CC1 ZINC001193021642 1049167453 /nfs/dbraw/zinc/16/74/53/1049167453.db2.gz LALJGKVTYSITDR-UHFFFAOYSA-N 1 2 315.436 4.374 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC001193021642 1049167461 /nfs/dbraw/zinc/16/74/61/1049167461.db2.gz LALJGKVTYSITDR-UHFFFAOYSA-N 1 2 315.436 4.374 20 0 DIADLO Cc1nc(CNc2[nH+]c3ccccc3n2CCC(C)C)cs1 ZINC001179489337 1049170677 /nfs/dbraw/zinc/17/06/77/1049170677.db2.gz KBPSLFQLARUOBK-UHFFFAOYSA-N 1 2 314.458 4.459 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1ccc(C(F)(F)F)cc1F ZINC001204470801 1049171106 /nfs/dbraw/zinc/17/11/06/1049171106.db2.gz CKEZCNFKZUEANR-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1ccc(C(F)(F)F)cc1F ZINC001204470801 1049171115 /nfs/dbraw/zinc/17/11/15/1049171115.db2.gz CKEZCNFKZUEANR-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CCc1ncc(C[NH2+][C@@H](CC(F)(F)F)c2ccc(C)cc2)o1 ZINC001193070247 1049171251 /nfs/dbraw/zinc/17/12/51/1049171251.db2.gz PDFMQPZOMAVHCC-AWEZNQCLSA-N 1 2 312.335 4.329 20 0 DIADLO Fc1ccc(Br)cc1C[N@@H+]1CCCC(F)(F)CC1 ZINC001204496503 1049176683 /nfs/dbraw/zinc/17/66/83/1049176683.db2.gz VMUWRLZZQBGXID-UHFFFAOYSA-N 1 2 322.168 4.209 20 0 DIADLO Fc1ccc(Br)cc1C[N@H+]1CCCC(F)(F)CC1 ZINC001204496503 1049176689 /nfs/dbraw/zinc/17/66/89/1049176689.db2.gz VMUWRLZZQBGXID-UHFFFAOYSA-N 1 2 322.168 4.209 20 0 DIADLO Fc1cc2c(cc1F)C[N@H+](Cc1ccc3ccccc3n1)CC2 ZINC001204507430 1049178177 /nfs/dbraw/zinc/17/81/77/1049178177.db2.gz YNZSAMQNCREXMU-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1cc2c(cc1F)C[N@@H+](Cc1ccc3ccccc3n1)CC2 ZINC001204507430 1049178180 /nfs/dbraw/zinc/17/81/80/1049178180.db2.gz YNZSAMQNCREXMU-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Cc1c(F)cccc1C[NH+](Cc1ccccn1)Cc1ccccn1 ZINC001204506902 1049178393 /nfs/dbraw/zinc/17/83/93/1049178393.db2.gz OEIAVYPYPIWMRU-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)nc1)c1ncc(-c2ccccc2)o1 ZINC001193103620 1049179121 /nfs/dbraw/zinc/17/91/21/1049179121.db2.gz JZECCRDGIMZBQZ-QWHCGFSZSA-N 1 2 311.360 4.288 20 0 DIADLO CC(C)([NH2+]Cc1nc2c(s1)CCCC2)c1ccc(F)cc1F ZINC001179592638 1049182127 /nfs/dbraw/zinc/18/21/27/1049182127.db2.gz GUOAEZRQGWIDJE-UHFFFAOYSA-N 1 2 322.424 4.325 20 0 DIADLO Clc1cscc1C[NH2+]Cc1nc(-c2ccccc2)c[nH]1 ZINC001179602559 1049184373 /nfs/dbraw/zinc/18/43/73/1049184373.db2.gz ARHDJDMGGCNOFI-UHFFFAOYSA-N 1 2 303.818 4.081 20 0 DIADLO CCc1cccc(Cl)c1C[N@H+](CCOC)Cc1ccc(C)o1 ZINC001204565477 1049189755 /nfs/dbraw/zinc/18/97/55/1049189755.db2.gz NSSXHYULKHKMFN-UHFFFAOYSA-N 1 2 321.848 4.452 20 0 DIADLO CCc1cccc(Cl)c1C[N@@H+](CCOC)Cc1ccc(C)o1 ZINC001204565477 1049189763 /nfs/dbraw/zinc/18/97/63/1049189763.db2.gz NSSXHYULKHKMFN-UHFFFAOYSA-N 1 2 321.848 4.452 20 0 DIADLO Fc1cc(Br)cc([C@@H]2CCC[N@@H+]2C/C=C/Cl)c1 ZINC001193189173 1049190233 /nfs/dbraw/zinc/19/02/33/1049190233.db2.gz XARZUIRZVNYCEC-OHVSUOQFSA-N 1 2 318.617 4.478 20 0 DIADLO Fc1cc(Br)cc([C@@H]2CCC[N@H+]2C/C=C/Cl)c1 ZINC001193189173 1049190236 /nfs/dbraw/zinc/19/02/36/1049190236.db2.gz XARZUIRZVNYCEC-OHVSUOQFSA-N 1 2 318.617 4.478 20 0 DIADLO CCOc1ccccc1CNc1[nH+]c2ccccc2n1CC1CC1 ZINC001179630330 1049190764 /nfs/dbraw/zinc/19/07/64/1049190764.db2.gz AFKGJMBCSBRVCJ-UHFFFAOYSA-N 1 2 321.424 4.457 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1scnc1Cl)[C@@H]2C ZINC001193271760 1049192532 /nfs/dbraw/zinc/19/25/32/1049192532.db2.gz BWTASLIJELQRGE-GHMZBOCLSA-N 1 2 322.861 4.313 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1scnc1Cl)[C@@H]2C ZINC001193271760 1049192535 /nfs/dbraw/zinc/19/25/35/1049192535.db2.gz BWTASLIJELQRGE-GHMZBOCLSA-N 1 2 322.861 4.313 20 0 DIADLO COc1cccc(C[N@@H+]2Cc3ccccc3OC[C@@H]2C)c1Cl ZINC001193311595 1049196366 /nfs/dbraw/zinc/19/63/66/1049196366.db2.gz RVTZCIUPWHGFDJ-ZDUSSCGKSA-N 1 2 317.816 4.132 20 0 DIADLO COc1cccc(C[N@H+]2Cc3ccccc3OC[C@@H]2C)c1Cl ZINC001193311595 1049196369 /nfs/dbraw/zinc/19/63/69/1049196369.db2.gz RVTZCIUPWHGFDJ-ZDUSSCGKSA-N 1 2 317.816 4.132 20 0 DIADLO Fc1ccc2[nH]ccc2c1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001204255086 1049202170 /nfs/dbraw/zinc/20/21/70/1049202170.db2.gz XAZHCTVYOBGAAV-UHFFFAOYSA-N 1 2 300.724 4.352 20 0 DIADLO c1ccc2cc(OCCC[N@@H+]3Cc4ccncc4C3)ccc2c1 ZINC000857876256 1049204652 /nfs/dbraw/zinc/20/46/52/1049204652.db2.gz AVFQKKAUQQXCDX-UHFFFAOYSA-N 1 2 304.393 4.020 20 0 DIADLO c1ccc2cc(OCCC[N@H+]3Cc4ccncc4C3)ccc2c1 ZINC000857876256 1049204665 /nfs/dbraw/zinc/20/46/65/1049204665.db2.gz AVFQKKAUQQXCDX-UHFFFAOYSA-N 1 2 304.393 4.020 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1ccc(F)cc1C ZINC001179817662 1049211340 /nfs/dbraw/zinc/21/13/40/1049211340.db2.gz RDWMTSAHBYDENI-UHFFFAOYSA-N 1 2 301.340 4.255 20 0 DIADLO CCC[C@@H]1CCCC[C@@H]1CNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001204649151 1049211618 /nfs/dbraw/zinc/21/16/18/1049211618.db2.gz RSIGTXGJAHPYNJ-HUUCEWRRSA-N 1 2 314.433 4.062 20 0 DIADLO Clc1cccc([C@@H]2CCC[N@@H+]2Cc2cn(C3CC3)cn2)c1 ZINC001204658006 1049213268 /nfs/dbraw/zinc/21/32/68/1049213268.db2.gz OJTBWHCPVLSAGX-KRWDZBQOSA-N 1 2 301.821 4.209 20 0 DIADLO Clc1cccc([C@@H]2CCC[N@H+]2Cc2cn(C3CC3)cn2)c1 ZINC001204658006 1049213275 /nfs/dbraw/zinc/21/32/75/1049213275.db2.gz OJTBWHCPVLSAGX-KRWDZBQOSA-N 1 2 301.821 4.209 20 0 DIADLO C[N@H+](C/C=C\c1ccc(F)cc1)Cc1nc(-c2ccccc2)c[nH]1 ZINC000485328610 1049222187 /nfs/dbraw/zinc/22/21/87/1049222187.db2.gz HQVFBWYLPYGCPL-WAYWQWQTSA-N 1 2 321.399 4.361 20 0 DIADLO C[N@@H+](C/C=C\c1ccc(F)cc1)Cc1nc(-c2ccccc2)c[nH]1 ZINC000485328610 1049222197 /nfs/dbraw/zinc/22/21/97/1049222197.db2.gz HQVFBWYLPYGCPL-WAYWQWQTSA-N 1 2 321.399 4.361 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCc3c(C)cc(C)cc3C2)n1 ZINC001193528583 1049222866 /nfs/dbraw/zinc/22/28/66/1049222866.db2.gz SVUZGMPFTIYTPY-UHFFFAOYSA-N 1 2 311.473 4.419 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCc3c(C)cc(C)cc3C2)n1 ZINC001193528583 1049222877 /nfs/dbraw/zinc/22/28/77/1049222877.db2.gz SVUZGMPFTIYTPY-UHFFFAOYSA-N 1 2 311.473 4.419 20 0 DIADLO Fc1cc([C@@H]2CCCN2c2cccc[nH+]2)ccc1Br ZINC000485401276 1049236450 /nfs/dbraw/zinc/23/64/50/1049236450.db2.gz DKGJBJRNFNTSRC-AWEZNQCLSA-N 1 2 321.193 4.325 20 0 DIADLO C[C@@H]1c2cc(Cl)cc(Cl)c2CC[N@H+]1Cc1ccn(C)c1 ZINC001179978824 1049243206 /nfs/dbraw/zinc/24/32/06/1049243206.db2.gz AFPHPDIIQLSGNN-LLVKDONJSA-N 1 2 309.240 4.451 20 0 DIADLO C[C@@H]1c2cc(Cl)cc(Cl)c2CC[N@@H+]1Cc1ccn(C)c1 ZINC001179978824 1049243214 /nfs/dbraw/zinc/24/32/14/1049243214.db2.gz AFPHPDIIQLSGNN-LLVKDONJSA-N 1 2 309.240 4.451 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+]3C[C@H](C)OC[C@H]3C)s2)cc1C ZINC001179993527 1049246015 /nfs/dbraw/zinc/24/60/15/1049246015.db2.gz LYAKQUNXWCMMDW-CABCVRRESA-N 1 2 316.470 4.036 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+]3C[C@H](C)OC[C@H]3C)s2)cc1C ZINC001179993527 1049246025 /nfs/dbraw/zinc/24/60/25/1049246025.db2.gz LYAKQUNXWCMMDW-CABCVRRESA-N 1 2 316.470 4.036 20 0 DIADLO CCc1cccc(F)c1C[N@@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC001204737164 1049247511 /nfs/dbraw/zinc/24/75/11/1049247511.db2.gz UPEKJAVQHLBIAQ-KRWDZBQOSA-N 1 2 317.404 4.162 20 0 DIADLO CCc1cccc(F)c1C[N@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC001204737164 1049247524 /nfs/dbraw/zinc/24/75/24/1049247524.db2.gz UPEKJAVQHLBIAQ-KRWDZBQOSA-N 1 2 317.404 4.162 20 0 DIADLO CCc1cccc2cc(C[N@@H+]3CCO[C@H](c4ccco4)C3)oc21 ZINC001204804036 1049269514 /nfs/dbraw/zinc/26/95/14/1049269514.db2.gz VPXQYVRLOQGOQC-SFHVURJKSA-N 1 2 311.381 4.162 20 0 DIADLO CCc1cccc2cc(C[N@H+]3CCO[C@H](c4ccco4)C3)oc21 ZINC001204804036 1049269529 /nfs/dbraw/zinc/26/95/29/1049269529.db2.gz VPXQYVRLOQGOQC-SFHVURJKSA-N 1 2 311.381 4.162 20 0 DIADLO CC(C)c1ccc(Cl)c(C(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC001193845845 1049272595 /nfs/dbraw/zinc/27/25/95/1049272595.db2.gz DNTCDFMMPYRKQZ-UHFFFAOYSA-N 1 2 313.788 4.363 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1nc2ccccc2n1C(F)F)c1ccns1 ZINC000858575567 1049278142 /nfs/dbraw/zinc/27/81/42/1049278142.db2.gz BDZCRTSEZSAPNO-NXEZZACHSA-N 1 2 322.384 4.300 20 0 DIADLO Fc1cc(C[NH+]2CC3(C2)CC(F)(F)C3)ccc1C(F)(F)F ZINC001204855725 1049286288 /nfs/dbraw/zinc/28/62/88/1049286288.db2.gz CFNUMCLUPIIWMQ-UHFFFAOYSA-N 1 2 309.253 4.076 20 0 DIADLO COc1cc(C)ccc1C[N@@H+]1CCc2c(F)cc(F)cc2[C@H]1C ZINC001180112117 1049287865 /nfs/dbraw/zinc/28/78/65/1049287865.db2.gz GZNOUSFQCWWYAK-CYBMUJFWSA-N 1 2 317.379 4.401 20 0 DIADLO COc1cc(C)ccc1C[N@H+]1CCc2c(F)cc(F)cc2[C@H]1C ZINC001180112117 1049287878 /nfs/dbraw/zinc/28/78/78/1049287878.db2.gz GZNOUSFQCWWYAK-CYBMUJFWSA-N 1 2 317.379 4.401 20 0 DIADLO Cc1cc(Cl)c(NC(=O)c2cccc3[nH+]ccn32)cc1Cl ZINC000777051184 1049291091 /nfs/dbraw/zinc/29/10/91/1049291091.db2.gz GZEMWKCWHFTVJB-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](C/C=C\c2cccc(F)c2)CCO1 ZINC001180121324 1049292216 /nfs/dbraw/zinc/29/22/16/1049292216.db2.gz QNPKIDYPGBSUSM-DASIIQCKSA-N 1 2 311.400 4.221 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](C/C=C\c2cccc(F)c2)CCO1 ZINC001180121324 1049292227 /nfs/dbraw/zinc/29/22/27/1049292227.db2.gz QNPKIDYPGBSUSM-DASIIQCKSA-N 1 2 311.400 4.221 20 0 DIADLO Nc1cccc2c1cc[nH+]c2N1C[C@@H]2C[C@@H](c3ccccc3)[C@@H]2C1 ZINC000858805466 1049294931 /nfs/dbraw/zinc/29/49/31/1049294931.db2.gz NDXDLOSHGRHICD-ZYSHUDEJSA-N 1 2 315.420 4.057 20 0 DIADLO c1cn2cc(-c3cccc4c3cnn4[C@H]3CCCCO3)ccc2[nH+]1 ZINC001204882425 1049297496 /nfs/dbraw/zinc/29/74/96/1049297496.db2.gz PHZQAKBDRDLWOR-LJQANCHMSA-N 1 2 318.380 4.050 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)Oc1ccc(Cl)cc1 ZINC001194024586 1049302557 /nfs/dbraw/zinc/30/25/57/1049302557.db2.gz LPYLSMLHTRBATK-UHFFFAOYSA-N 1 2 313.744 4.137 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2ccnc(F)c2)C2CC2)o1 ZINC000859053271 1049307527 /nfs/dbraw/zinc/30/75/27/1049307527.db2.gz ZXVTZBRLPDDBHN-LRDDRELGSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2ccnc(F)c2)C2CC2)o1 ZINC000859053271 1049307538 /nfs/dbraw/zinc/30/75/38/1049307538.db2.gz ZXVTZBRLPDDBHN-LRDDRELGSA-N 1 2 300.377 4.102 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)ccn1 ZINC000859062969 1049310608 /nfs/dbraw/zinc/31/06/08/1049310608.db2.gz MCDWNNLIVGPHNH-CQSZACIVSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)ccn1 ZINC000859062969 1049310612 /nfs/dbraw/zinc/31/06/12/1049310612.db2.gz MCDWNNLIVGPHNH-CQSZACIVSA-N 1 2 313.401 4.168 20 0 DIADLO Cc1ccc(C[C@H](C)[NH2+]c2ccc(N3CCOCC3)c(C)c2)cc1 ZINC001204937506 1049315225 /nfs/dbraw/zinc/31/52/25/1049315225.db2.gz MFPUHPSGAVTFHF-SFHVURJKSA-N 1 2 324.468 4.183 20 0 DIADLO Cc1cc(Nc2ccn3cc[nH+]c3c2)n(-c2cccc(Cl)c2)n1 ZINC001204951282 1049319477 /nfs/dbraw/zinc/31/94/77/1049319477.db2.gz QJCMXKSIKADPCQ-UHFFFAOYSA-N 1 2 323.787 4.225 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)n(C)n1)c1cc(Cl)ccc1Cl ZINC000859227517 1049321547 /nfs/dbraw/zinc/32/15/47/1049321547.db2.gz HVJOTBGBEWREAV-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO Fc1ccccc1Oc1ncccc1Nc1ccn2cc[nH+]c2c1 ZINC001204959195 1049321858 /nfs/dbraw/zinc/32/18/58/1049321858.db2.gz HXPNJBDUWSCQTL-UHFFFAOYSA-N 1 2 320.327 4.404 20 0 DIADLO Fc1cc(Cl)cc(C[NH2+]Cc2coc(-c3ccccc3)n2)c1 ZINC000485697530 1049322116 /nfs/dbraw/zinc/32/21/16/1049322116.db2.gz QDMRCLYQGXTJML-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO CC[C@H](Cc1ccccc1)[NH2+]c1ccc(N2CCOCC2)c(C)c1 ZINC001180301712 1049326365 /nfs/dbraw/zinc/32/63/65/1049326365.db2.gz QQMITADOGKLOPS-LJQANCHMSA-N 1 2 324.468 4.265 20 0 DIADLO Fc1cc(C[NH+]2CCC(=Cc3ccc(F)c(F)c3)CC2)ccn1 ZINC000859255538 1049326761 /nfs/dbraw/zinc/32/67/61/1049326761.db2.gz PANZJAFYPPLLEW-UHFFFAOYSA-N 1 2 318.342 4.178 20 0 DIADLO Fc1cc(F)c(Nc2ccn3cc[nH+]c3c2)cc1Br ZINC001204978226 1049328228 /nfs/dbraw/zinc/32/82/28/1049328228.db2.gz QLVSWSKALSLYMU-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Nc1ccc(SC(F)(F)F)cc1Nc1ccn2cc[nH+]c2c1 ZINC001204983473 1049331724 /nfs/dbraw/zinc/33/17/24/1049331724.db2.gz WGLOWLDIGHLUSF-UHFFFAOYSA-N 1 2 324.331 4.272 20 0 DIADLO Clc1ccc(Nc2ccn3cc[nH+]c3c2)cc1Br ZINC001204991066 1049333313 /nfs/dbraw/zinc/33/33/13/1049333313.db2.gz KRKPNTCQCLCMLB-UHFFFAOYSA-N 1 2 322.593 4.494 20 0 DIADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(Cl)nc(Cl)c1 ZINC000859435553 1049334124 /nfs/dbraw/zinc/33/41/24/1049334124.db2.gz WNMUGTRSQKHYGS-AOOOYVTPSA-N 1 2 307.171 4.151 20 0 DIADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(Cl)nc(Cl)c1 ZINC000859435553 1049334133 /nfs/dbraw/zinc/33/41/33/1049334133.db2.gz WNMUGTRSQKHYGS-AOOOYVTPSA-N 1 2 307.171 4.151 20 0 DIADLO Nc1ccccc1Oc1ccccc1Nc1ccn2cc[nH+]c2c1 ZINC001204996986 1049334731 /nfs/dbraw/zinc/33/47/31/1049334731.db2.gz FBYQQJUMTCJAKL-UHFFFAOYSA-N 1 2 316.364 4.452 20 0 DIADLO Fc1c(F)c(C(F)(F)F)ccc1Nc1ccn2cc[nH+]c2c1 ZINC001204996968 1049335625 /nfs/dbraw/zinc/33/56/25/1049335625.db2.gz DEJQDENCWBDMPS-UHFFFAOYSA-N 1 2 313.229 4.375 20 0 DIADLO C[N@H+](CCc1ccc(Cl)cc1)Cc1c(Cl)ccnc1F ZINC001180350111 1049342566 /nfs/dbraw/zinc/34/25/66/1049342566.db2.gz VJYWORXAKICKEC-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1ccc(Cl)cc1)Cc1c(Cl)ccnc1F ZINC001180350111 1049342580 /nfs/dbraw/zinc/34/25/80/1049342580.db2.gz VJYWORXAKICKEC-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@H+](Cc1ccccn1)Cc1cccc(C(F)(F)F)c1Cl ZINC001205030673 1049345323 /nfs/dbraw/zinc/34/53/23/1049345323.db2.gz LWINBARWOSJBLG-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccccn1)Cc1cccc(C(F)(F)F)c1Cl ZINC001205030673 1049345334 /nfs/dbraw/zinc/34/53/34/1049345334.db2.gz LWINBARWOSJBLG-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO CC(=O)[C@H]1CCC[N@H+](Cc2cccc(C(F)(F)F)c2Cl)C1 ZINC001205055384 1049356245 /nfs/dbraw/zinc/35/62/45/1049356245.db2.gz IVNVNCVEGFLXJQ-NSHDSACASA-N 1 2 319.754 4.160 20 0 DIADLO CC(=O)[C@H]1CCC[N@@H+](Cc2cccc(C(F)(F)F)c2Cl)C1 ZINC001205055384 1049356257 /nfs/dbraw/zinc/35/62/57/1049356257.db2.gz IVNVNCVEGFLXJQ-NSHDSACASA-N 1 2 319.754 4.160 20 0 DIADLO CCOC(=O)C[N@H+](C)Cc1cccc(-c2ccc(Cl)cc2)c1 ZINC001205059696 1049359766 /nfs/dbraw/zinc/35/97/66/1049359766.db2.gz BALRQLHFHCERSD-UHFFFAOYSA-N 1 2 317.816 4.002 20 0 DIADLO CCOC(=O)C[N@@H+](C)Cc1cccc(-c2ccc(Cl)cc2)c1 ZINC001205059696 1049359776 /nfs/dbraw/zinc/35/97/76/1049359776.db2.gz BALRQLHFHCERSD-UHFFFAOYSA-N 1 2 317.816 4.002 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)cc1F ZINC001203794005 1049360164 /nfs/dbraw/zinc/36/01/64/1049360164.db2.gz UYQUZXGKDFREKU-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)cc1F ZINC001203794005 1049360173 /nfs/dbraw/zinc/36/01/73/1049360173.db2.gz UYQUZXGKDFREKU-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@H]1CCC[C@H](c2nc(-c3ccccc3-n3cc[nH+]c3)no2)C1 ZINC001205075380 1049364857 /nfs/dbraw/zinc/36/48/57/1049364857.db2.gz OCMWBMIHSLYZTH-KBPBESRZSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1c2c(nn1C)CCCC2 ZINC001205078007 1049365955 /nfs/dbraw/zinc/36/59/55/1049365955.db2.gz XHTKRGPWJCAZST-ZDUSSCGKSA-N 1 2 317.864 4.145 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1c2c(nn1C)CCCC2 ZINC001205078007 1049365961 /nfs/dbraw/zinc/36/59/61/1049365961.db2.gz XHTKRGPWJCAZST-ZDUSSCGKSA-N 1 2 317.864 4.145 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1ccc(O)c(F)c1F ZINC001180523229 1049371761 /nfs/dbraw/zinc/37/17/61/1049371761.db2.gz QWISGJVFHKUCIC-SECBINFHSA-N 1 2 313.294 4.142 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccc(O)c(F)c1F ZINC001180523229 1049371771 /nfs/dbraw/zinc/37/17/71/1049371771.db2.gz QWISGJVFHKUCIC-SECBINFHSA-N 1 2 313.294 4.142 20 0 DIADLO Cn1cc(C[N@H+](C)Cc2ccc(C(C)(C)C)cc2)c(Cl)n1 ZINC001180497039 1049376419 /nfs/dbraw/zinc/37/64/19/1049376419.db2.gz BQQVVOWSISGPCY-UHFFFAOYSA-N 1 2 305.853 4.003 20 0 DIADLO Cn1cc(C[N@@H+](C)Cc2ccc(C(C)(C)C)cc2)c(Cl)n1 ZINC001180497039 1049376430 /nfs/dbraw/zinc/37/64/30/1049376430.db2.gz BQQVVOWSISGPCY-UHFFFAOYSA-N 1 2 305.853 4.003 20 0 DIADLO Cc1cccc2c1CC(C)(C)[N@H+](CC(=O)c1ccccc1F)C2 ZINC001194551708 1049390422 /nfs/dbraw/zinc/39/04/22/1049390422.db2.gz LEWPJMGQZVBDBG-UHFFFAOYSA-N 1 2 311.400 4.154 20 0 DIADLO Cc1cccc2c1CC(C)(C)[N@@H+](CC(=O)c1ccccc1F)C2 ZINC001194551708 1049390432 /nfs/dbraw/zinc/39/04/32/1049390432.db2.gz LEWPJMGQZVBDBG-UHFFFAOYSA-N 1 2 311.400 4.154 20 0 DIADLO Clc1cccc(C[NH+](Cc2ccccn2)Cc2ccccn2)c1 ZINC001203796943 1049391171 /nfs/dbraw/zinc/39/11/71/1049391171.db2.gz VXCTVFTVGTWKBV-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO CC(C)c1cccc(C[N@@H+]2C[C@@H](C(F)(F)F)OC(C)(C)C2)c1 ZINC001194589239 1049395268 /nfs/dbraw/zinc/39/52/68/1049395268.db2.gz NQFSORXCWNBSNC-HNNXBMFYSA-N 1 2 315.379 4.352 20 0 DIADLO CC(C)c1cccc(C[N@H+]2C[C@@H](C(F)(F)F)OC(C)(C)C2)c1 ZINC001194589239 1049395281 /nfs/dbraw/zinc/39/52/81/1049395281.db2.gz NQFSORXCWNBSNC-HNNXBMFYSA-N 1 2 315.379 4.352 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)Oc1ccc2ccccc2c1 ZINC001194632549 1049400015 /nfs/dbraw/zinc/40/00/15/1049400015.db2.gz CKSGBJSPLGCADG-UHFFFAOYSA-N 1 2 303.321 4.098 20 0 DIADLO CC1(C)C[N@H+](Cc2ccccc2CF)C[C@@](C)(C(F)(F)F)O1 ZINC001194647656 1049403552 /nfs/dbraw/zinc/40/35/52/1049403552.db2.gz BJKMTPHKZFUYKW-HNNXBMFYSA-N 1 2 319.342 4.088 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccccc2CF)C[C@@](C)(C(F)(F)F)O1 ZINC001194647656 1049403556 /nfs/dbraw/zinc/40/35/56/1049403556.db2.gz BJKMTPHKZFUYKW-HNNXBMFYSA-N 1 2 319.342 4.088 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c1 ZINC001205193764 1049408923 /nfs/dbraw/zinc/40/89/23/1049408923.db2.gz YBGSBGGRTYMALO-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)c1 ZINC001205193764 1049408930 /nfs/dbraw/zinc/40/89/30/1049408930.db2.gz YBGSBGGRTYMALO-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO CCc1ccc([C@@H]2C[N@H+](Cc3ccc(C)cc3F)CCO2)cc1 ZINC001180884554 1049410556 /nfs/dbraw/zinc/41/05/56/1049410556.db2.gz LTADPQYBDLIJEU-FQEVSTJZSA-N 1 2 313.416 4.270 20 0 DIADLO CCc1ccc([C@@H]2C[N@@H+](Cc3ccc(C)cc3F)CCO2)cc1 ZINC001180884554 1049410561 /nfs/dbraw/zinc/41/05/61/1049410561.db2.gz LTADPQYBDLIJEU-FQEVSTJZSA-N 1 2 313.416 4.270 20 0 DIADLO C[C@H]1Cc2cc(C[N@H+](C)Cc3c(F)cccc3Cl)ccc2O1 ZINC001205209860 1049410869 /nfs/dbraw/zinc/41/08/69/1049410869.db2.gz YWGLINNWXQANTI-LBPRGKRZSA-N 1 2 319.807 4.435 20 0 DIADLO C[C@H]1Cc2cc(C[N@@H+](C)Cc3c(F)cccc3Cl)ccc2O1 ZINC001205209860 1049410873 /nfs/dbraw/zinc/41/08/73/1049410873.db2.gz YWGLINNWXQANTI-LBPRGKRZSA-N 1 2 319.807 4.435 20 0 DIADLO CCCCC[C@@H]([NH2+][C@@H](C)Cc1ccccc1SC)C(=O)OC ZINC001180954124 1049422586 /nfs/dbraw/zinc/42/25/86/1049422586.db2.gz VKDCHMDEHOMGSF-GOEBONIOSA-N 1 2 323.502 4.051 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001194764533 1049427902 /nfs/dbraw/zinc/42/79/02/1049427902.db2.gz MFEIVBGKMCHYJO-QWHCGFSZSA-N 1 2 303.352 4.309 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001194764533 1049427906 /nfs/dbraw/zinc/42/79/06/1049427906.db2.gz MFEIVBGKMCHYJO-QWHCGFSZSA-N 1 2 303.352 4.309 20 0 DIADLO COc1cccc(C[N@H+]2Cc3ccccc3O[C@H](C)C2)c1Cl ZINC001194764834 1049428074 /nfs/dbraw/zinc/42/80/74/1049428074.db2.gz NSXUTDZGQWQPPQ-CYBMUJFWSA-N 1 2 317.816 4.132 20 0 DIADLO COc1cccc(C[N@@H+]2Cc3ccccc3O[C@H](C)C2)c1Cl ZINC001194764834 1049428081 /nfs/dbraw/zinc/42/80/81/1049428081.db2.gz NSXUTDZGQWQPPQ-CYBMUJFWSA-N 1 2 317.816 4.132 20 0 DIADLO Fc1ccc2[nH]ccc2c1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001204288945 1049433592 /nfs/dbraw/zinc/43/35/92/1049433592.db2.gz DAGFDYRFIPSCQR-UHFFFAOYSA-N 1 2 306.344 4.295 20 0 DIADLO Cc1ccc(CC2CC[NH+]([C@@H](C)c3csnn3)CC2)cc1C ZINC001194853707 1049437115 /nfs/dbraw/zinc/43/71/15/1049437115.db2.gz DEMUNSJUODTXBV-HNNXBMFYSA-N 1 2 315.486 4.171 20 0 DIADLO CC[C@@H](CC(C)C)c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001205322406 1049437417 /nfs/dbraw/zinc/43/74/17/1049437417.db2.gz WBIQQMRTLIOTKP-AWEZNQCLSA-N 1 2 310.401 4.462 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC001194890878 1049451195 /nfs/dbraw/zinc/45/11/95/1049451195.db2.gz NEDYZDOPCNZVJG-OCCSQVGLSA-N 1 2 309.475 4.251 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC001194890878 1049451197 /nfs/dbraw/zinc/45/11/97/1049451197.db2.gz NEDYZDOPCNZVJG-OCCSQVGLSA-N 1 2 309.475 4.251 20 0 DIADLO Cc1ccccc1-c1noc([C@H](C)[N@H+](C)Cc2ccsc2)n1 ZINC000152926868 1049451506 /nfs/dbraw/zinc/45/15/06/1049451506.db2.gz FLUHEYRCKCHBJG-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccccc1-c1noc([C@H](C)[N@@H+](C)Cc2ccsc2)n1 ZINC000152926868 1049451513 /nfs/dbraw/zinc/45/15/13/1049451513.db2.gz FLUHEYRCKCHBJG-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CC[C@@](F)(c4ccccc4C)C3)cn2c1 ZINC001181196614 1049451652 /nfs/dbraw/zinc/45/16/52/1049451652.db2.gz SOHZXNRRGQNGQA-FQEVSTJZSA-N 1 2 323.415 4.022 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CC[C@@](F)(c4ccccc4C)C3)cn2c1 ZINC001181196614 1049451659 /nfs/dbraw/zinc/45/16/59/1049451659.db2.gz SOHZXNRRGQNGQA-FQEVSTJZSA-N 1 2 323.415 4.022 20 0 DIADLO CCc1ccc(C2=CC[N@H+](Cc3cc(F)ncc3F)CC2)cc1 ZINC001205367393 1049452949 /nfs/dbraw/zinc/45/29/49/1049452949.db2.gz SLYJIVQNSUFPDE-UHFFFAOYSA-N 1 2 314.379 4.212 20 0 DIADLO CCc1ccc(C2=CC[N@@H+](Cc3cc(F)ncc3F)CC2)cc1 ZINC001205367393 1049452955 /nfs/dbraw/zinc/45/29/55/1049452955.db2.gz SLYJIVQNSUFPDE-UHFFFAOYSA-N 1 2 314.379 4.212 20 0 DIADLO C[C@@]1(C[N@@H+]2CCn3c(cc4ccc(Cl)cc43)C2)CCCS1 ZINC001181336662 1049463463 /nfs/dbraw/zinc/46/34/63/1049463463.db2.gz KNWBMPDQXSCTAN-KRWDZBQOSA-N 1 2 320.889 4.396 20 0 DIADLO C[C@@]1(C[N@H+]2CCn3c(cc4ccc(Cl)cc43)C2)CCCS1 ZINC001181336662 1049463469 /nfs/dbraw/zinc/46/34/69/1049463469.db2.gz KNWBMPDQXSCTAN-KRWDZBQOSA-N 1 2 320.889 4.396 20 0 DIADLO C[C@H](CC1CCC1)[NH2+]c1ccc(N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC001181383423 1049469755 /nfs/dbraw/zinc/46/97/55/1049469755.db2.gz UHEFBDJASTXFCE-OAGGEKHMSA-N 1 2 302.462 4.291 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CCCC[C@@H]3C)cc2)C[C@H](C)O1 ZINC001181383404 1049469843 /nfs/dbraw/zinc/46/98/43/1049469843.db2.gz TVOULYXLVYFXMX-GGXPGOJBSA-N 1 2 302.462 4.291 20 0 DIADLO COc1ncccc1C[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000486812532 1049476439 /nfs/dbraw/zinc/47/64/39/1049476439.db2.gz APVXJZYOTFTQPC-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ncccc1C[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000486812532 1049476446 /nfs/dbraw/zinc/47/64/46/1049476446.db2.gz APVXJZYOTFTQPC-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1c(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)ccnc1F ZINC000862214037 1049479460 /nfs/dbraw/zinc/47/94/60/1049479460.db2.gz CDDSJJYVGKWRKG-GFCCVEGCSA-N 1 2 315.417 4.332 20 0 DIADLO Cc1c(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)ccnc1F ZINC000862214037 1049479465 /nfs/dbraw/zinc/47/94/65/1049479465.db2.gz CDDSJJYVGKWRKG-GFCCVEGCSA-N 1 2 315.417 4.332 20 0 DIADLO C[C@@H]([NH2+]c1ccc(N2C[C@@H](C)O[C@@H](C)C2)cc1)C1CC(F)(F)C1 ZINC000862260638 1049483205 /nfs/dbraw/zinc/48/32/05/1049483205.db2.gz ANOVZXBATSSCEQ-HZSPNIEDSA-N 1 2 324.415 4.146 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(C)cc2OCOC)cc1 ZINC001205536689 1049495156 /nfs/dbraw/zinc/49/51/56/1049495156.db2.gz CRTADQKFUIORLU-UHFFFAOYSA-N 1 2 300.402 4.177 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(C)cc2OCOC)cc1 ZINC001205536689 1049495161 /nfs/dbraw/zinc/49/51/61/1049495161.db2.gz CRTADQKFUIORLU-UHFFFAOYSA-N 1 2 300.402 4.177 20 0 DIADLO CCn1c[nH+]cc1CN1C[C@H](c2ccccc2)c2ccccc21 ZINC001205568206 1049499117 /nfs/dbraw/zinc/49/91/17/1049499117.db2.gz GOZSDPRPNGWMRY-LJQANCHMSA-N 1 2 303.409 4.055 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2ccsc2)cc1)c1csnn1 ZINC001195241565 1049499249 /nfs/dbraw/zinc/49/92/49/1049499249.db2.gz FWBCQHFPPYGXRG-NSHDSACASA-N 1 2 301.440 4.117 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+][C@H](C)c2ncco2)cc1OC ZINC000924820623 1049506149 /nfs/dbraw/zinc/50/61/49/1049506149.db2.gz QQOVHPXAPPZUNV-UONOGXRCSA-N 1 2 318.417 4.274 20 0 DIADLO Cc1ccc(C[N@@H+]2[C@H](C)CCC[C@@H]2C(=O)OC(C)(C)C)cc1F ZINC001195412417 1049522876 /nfs/dbraw/zinc/52/28/76/1049522876.db2.gz DIYQNACMNVQHQG-RHSMWYFYSA-N 1 2 321.436 4.219 20 0 DIADLO Cc1ccc(C[N@H+]2[C@H](C)CCC[C@@H]2C(=O)OC(C)(C)C)cc1F ZINC001195412417 1049522890 /nfs/dbraw/zinc/52/28/90/1049522890.db2.gz DIYQNACMNVQHQG-RHSMWYFYSA-N 1 2 321.436 4.219 20 0 DIADLO Clc1ccc(C2C[NH+](Cc3nccn3-c3ccccc3)C2)cc1 ZINC001181828859 1049527335 /nfs/dbraw/zinc/52/73/35/1049527335.db2.gz VWRVFOQWFNKBDE-UHFFFAOYSA-N 1 2 323.827 4.125 20 0 DIADLO Cc1cc(F)c(C[N@H+](C)C[C@@H]2OCCc3ccccc32)c(F)c1 ZINC001181891591 1049540283 /nfs/dbraw/zinc/54/02/83/1049540283.db2.gz CTLKJBLQTXENEB-IBGZPJMESA-N 1 2 317.379 4.019 20 0 DIADLO Cc1cc(F)c(C[N@@H+](C)C[C@@H]2OCCc3ccccc32)c(F)c1 ZINC001181891591 1049540290 /nfs/dbraw/zinc/54/02/90/1049540290.db2.gz CTLKJBLQTXENEB-IBGZPJMESA-N 1 2 317.379 4.019 20 0 DIADLO Cc1cc(F)c(C[N@H+](C)C[C@H]2OCCc3ccccc32)c(F)c1 ZINC001181891592 1049541855 /nfs/dbraw/zinc/54/18/55/1049541855.db2.gz CTLKJBLQTXENEB-LJQANCHMSA-N 1 2 317.379 4.019 20 0 DIADLO Cc1cc(F)c(C[N@@H+](C)C[C@H]2OCCc3ccccc32)c(F)c1 ZINC001181891592 1049541870 /nfs/dbraw/zinc/54/18/70/1049541870.db2.gz CTLKJBLQTXENEB-LJQANCHMSA-N 1 2 317.379 4.019 20 0 DIADLO C[N@H+](Cc1cnoc1)Cc1cc(F)ccc1Oc1ccccc1 ZINC001205724135 1049542641 /nfs/dbraw/zinc/54/26/41/1049542641.db2.gz GLEPTNNRCJFCMD-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO C[N@@H+](Cc1cnoc1)Cc1cc(F)ccc1Oc1ccccc1 ZINC001205724135 1049542650 /nfs/dbraw/zinc/54/26/50/1049542650.db2.gz GLEPTNNRCJFCMD-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO CCOc1c(Cl)cccc1C[NH2+]Cc1nc(C)c(C)s1 ZINC000487292135 1049546135 /nfs/dbraw/zinc/54/61/35/1049546135.db2.gz XKCMTCBXEDJFMK-UHFFFAOYSA-N 1 2 310.850 4.102 20 0 DIADLO CC[C@H](C)[C@@H](C[NH2+]CC(F)(F)c1ccc(Cl)cc1)OC ZINC001205735361 1049547066 /nfs/dbraw/zinc/54/70/66/1049547066.db2.gz JNTRBEDIOBSVAA-SMDDNHRTSA-N 1 2 305.796 4.083 20 0 DIADLO Cc1cc(C[N@H+](CC(=O)OC(C)(C)C)C2CCC2)c(C)s1 ZINC001195631430 1049547887 /nfs/dbraw/zinc/54/78/87/1049547887.db2.gz WXTUNVBSYBMDRH-UHFFFAOYSA-N 1 2 309.475 4.061 20 0 DIADLO Cc1cc(C[N@@H+](CC(=O)OC(C)(C)C)C2CCC2)c(C)s1 ZINC001195631430 1049547903 /nfs/dbraw/zinc/54/79/03/1049547903.db2.gz WXTUNVBSYBMDRH-UHFFFAOYSA-N 1 2 309.475 4.061 20 0 DIADLO Cc1ccc(Nc2ccc3nc(-c4ccccc4)nn3c2)c(C)[nH+]1 ZINC001203369253 1049562211 /nfs/dbraw/zinc/56/22/11/1049562211.db2.gz NCBWPSXCFATQNU-UHFFFAOYSA-N 1 2 315.380 4.152 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(O)c(F)c1F)c1ccc(F)cc1Cl ZINC001182007857 1049563117 /nfs/dbraw/zinc/56/31/17/1049563117.db2.gz MBFSHSIOWWHNRW-QMMMGPOBSA-N 1 2 315.722 4.314 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(OC(C)C)c(Cl)c2)[C@@H](C)CO1 ZINC001195748550 1049566969 /nfs/dbraw/zinc/56/69/69/1049566969.db2.gz LMGATJCYXHDDEZ-DZGCQCFKSA-N 1 2 311.853 4.127 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(OC(C)C)c(Cl)c2)[C@@H](C)CO1 ZINC001195748550 1049566983 /nfs/dbraw/zinc/56/69/83/1049566983.db2.gz LMGATJCYXHDDEZ-DZGCQCFKSA-N 1 2 311.853 4.127 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@@H](C)CCc3cccnc3)cc2)c1C ZINC001182108544 1049571148 /nfs/dbraw/zinc/57/11/48/1049571148.db2.gz DOEZGFGCNGMUOB-HNNXBMFYSA-N 1 2 320.440 4.317 20 0 DIADLO CC(C)Cn1cc(Nc2cc[nH+]c3cc(Cl)ccc23)cn1 ZINC001205850356 1049581659 /nfs/dbraw/zinc/58/16/59/1049581659.db2.gz JROFTFFSPVUCMZ-UHFFFAOYSA-N 1 2 300.793 4.484 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2CC=C(Cl)Cl)cc1F ZINC001195939031 1049585764 /nfs/dbraw/zinc/58/57/64/1049585764.db2.gz WAJGYWPQLYLRMG-GFCCVEGCSA-N 1 2 304.192 4.290 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2CC=C(Cl)Cl)cc1F ZINC001195939031 1049585772 /nfs/dbraw/zinc/58/57/72/1049585772.db2.gz WAJGYWPQLYLRMG-GFCCVEGCSA-N 1 2 304.192 4.290 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000487961270 1049588024 /nfs/dbraw/zinc/58/80/24/1049588024.db2.gz VXRSGBMNARUMFR-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000487961270 1049588036 /nfs/dbraw/zinc/58/80/36/1049588036.db2.gz VXRSGBMNARUMFR-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1ccc(Nc2ccc3nnc(-c4ccccc4)n3c2)c(C)[nH+]1 ZINC001203370892 1049593985 /nfs/dbraw/zinc/59/39/85/1049593985.db2.gz ZNGJVBQJUFIRJK-UHFFFAOYSA-N 1 2 315.380 4.152 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CCC[C@H]2C(C)(C)C)c(C)[nH+]1 ZINC001205899530 1049593825 /nfs/dbraw/zinc/59/38/25/1049593825.db2.gz KNEZVYZMRGRULC-HUUCEWRRSA-N 1 2 303.450 4.343 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2CCC[C@@H]2C(C)(C)C)c(C)[nH+]1 ZINC001205899528 1049594658 /nfs/dbraw/zinc/59/46/58/1049594658.db2.gz KNEZVYZMRGRULC-GJZGRUSLSA-N 1 2 303.450 4.343 20 0 DIADLO CC[N@H+](C/C=C\c1ccc(Cl)cc1)[C@H](C)C(=O)OC(C)(C)C ZINC001196058184 1049608204 /nfs/dbraw/zinc/60/82/04/1049608204.db2.gz YDUZNUVLYFZDQE-WBTMPAOCSA-N 1 2 323.864 4.405 20 0 DIADLO CC[N@@H+](C/C=C\c1ccc(Cl)cc1)[C@H](C)C(=O)OC(C)(C)C ZINC001196058184 1049608210 /nfs/dbraw/zinc/60/82/10/1049608210.db2.gz YDUZNUVLYFZDQE-WBTMPAOCSA-N 1 2 323.864 4.405 20 0 DIADLO Cc1sc(C[N@@H+]2CCC[C@@](C)(F)C2)cc1Br ZINC001205960137 1049611195 /nfs/dbraw/zinc/61/11/95/1049611195.db2.gz KIEVHMRPCHJTSG-GFCCVEGCSA-N 1 2 306.244 4.143 20 0 DIADLO Cc1sc(C[N@H+]2CCC[C@@](C)(F)C2)cc1Br ZINC001205960137 1049611198 /nfs/dbraw/zinc/61/11/98/1049611198.db2.gz KIEVHMRPCHJTSG-GFCCVEGCSA-N 1 2 306.244 4.143 20 0 DIADLO C[C@]1(F)CCC[N@H+](Cc2ccc(Oc3ccc(F)cc3)nc2)C1 ZINC001205959434 1049611279 /nfs/dbraw/zinc/61/12/79/1049611279.db2.gz DYFIMYUSGGAJOV-SFHVURJKSA-N 1 2 318.367 4.337 20 0 DIADLO C[C@]1(F)CCC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)nc2)C1 ZINC001205959434 1049611281 /nfs/dbraw/zinc/61/12/81/1049611281.db2.gz DYFIMYUSGGAJOV-SFHVURJKSA-N 1 2 318.367 4.337 20 0 DIADLO CC(C)(CC1CC1)c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001205968284 1049613125 /nfs/dbraw/zinc/61/31/25/1049613125.db2.gz FDJGXWVNRCWMMX-UHFFFAOYSA-N 1 2 308.385 4.000 20 0 DIADLO COc1cccc2c1CN(c1cc[nH+]c3c(Cl)cccc13)C2 ZINC000864022057 1049626815 /nfs/dbraw/zinc/62/68/15/1049626815.db2.gz KZDMWYAYSWETGF-UHFFFAOYSA-N 1 2 310.784 4.417 20 0 DIADLO Clc1cccc2c(NCc3cccc4c3OCC4)cc[nH+]c12 ZINC000864023819 1049627810 /nfs/dbraw/zinc/62/78/10/1049627810.db2.gz PFSSPICIYHFYKO-UHFFFAOYSA-N 1 2 310.784 4.435 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2nc3c(s2)CCC3)cc1F ZINC000775697061 1049629708 /nfs/dbraw/zinc/62/97/08/1049629708.db2.gz SWWAMSXHWPZUJC-OAHLLOKOSA-N 1 2 320.408 4.247 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2nc3c(s2)CCC3)cc1F ZINC000775697061 1049629717 /nfs/dbraw/zinc/62/97/17/1049629717.db2.gz SWWAMSXHWPZUJC-OAHLLOKOSA-N 1 2 320.408 4.247 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3ccc(F)cc3[nH]2)[C@H](c2ccccc2)CO1 ZINC000488339760 1049637743 /nfs/dbraw/zinc/63/77/43/1049637743.db2.gz XOJBKPHIVKNGOW-XOBRGWDASA-N 1 2 324.399 4.269 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3ccc(F)cc3[nH]2)[C@H](c2ccccc2)CO1 ZINC000488339760 1049637746 /nfs/dbraw/zinc/63/77/46/1049637746.db2.gz XOJBKPHIVKNGOW-XOBRGWDASA-N 1 2 324.399 4.269 20 0 DIADLO CC(C)(C)c1cccc(C[N@@H+]2CCO[C@@H](CC(F)(F)F)C2)c1 ZINC001196324106 1049641673 /nfs/dbraw/zinc/64/16/73/1049641673.db2.gz ZUPIRDMBAPHJBZ-HNNXBMFYSA-N 1 2 315.379 4.137 20 0 DIADLO CC(C)(C)c1cccc(C[N@H+]2CCO[C@@H](CC(F)(F)F)C2)c1 ZINC001196324106 1049641677 /nfs/dbraw/zinc/64/16/77/1049641677.db2.gz ZUPIRDMBAPHJBZ-HNNXBMFYSA-N 1 2 315.379 4.137 20 0 DIADLO Cc1csc(C2([NH2+]Cc3scnc3Cl)CCCC2)n1 ZINC000864095797 1049642721 /nfs/dbraw/zinc/64/27/21/1049642721.db2.gz CUWYVCNPEBNDTM-UHFFFAOYSA-N 1 2 313.879 4.121 20 0 DIADLO CC(C)n1c[nH+]cc1CN1C[C@H](C)CSc2ccccc21 ZINC001206099002 1049653719 /nfs/dbraw/zinc/65/37/19/1049653719.db2.gz LDYNLGCXKYDUEJ-AWEZNQCLSA-N 1 2 301.459 4.212 20 0 DIADLO CC(C)[C@@H]1C[C@@H](Nc2ccc(N3CCCCC3)c[nH+]2)CS1 ZINC000488446564 1049656416 /nfs/dbraw/zinc/65/64/16/1049656416.db2.gz UISCIYYTHOQXIN-ZBFHGGJFSA-N 1 2 305.491 4.014 20 0 DIADLO CC(C)c1cc(N2CC[C@@]3(C)[C@@H](C2)C3(F)F)nc(C(C)C)[nH+]1 ZINC000488467469 1049659489 /nfs/dbraw/zinc/65/94/89/1049659489.db2.gz NHBLHVHXSRVWGT-CJNGLKHVSA-N 1 2 309.404 4.205 20 0 DIADLO CCCOc1ccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c(F)c1 ZINC001206130969 1049661740 /nfs/dbraw/zinc/66/17/40/1049661740.db2.gz BIEQWLKDBXSUBY-UHFFFAOYSA-N 1 2 314.282 4.278 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+][C@H](C)c1nnc([C@@H](C)CC)[nH]1 ZINC000488501991 1049664370 /nfs/dbraw/zinc/66/43/70/1049664370.db2.gz MCNFAAKVSNXJGN-MELADBBJSA-N 1 2 316.449 4.129 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC000488543345 1049673321 /nfs/dbraw/zinc/67/33/21/1049673321.db2.gz JMYPFJQTUPQMBX-UHFFFAOYSA-N 1 2 309.388 4.156 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC000488543345 1049673326 /nfs/dbraw/zinc/67/33/26/1049673326.db2.gz JMYPFJQTUPQMBX-UHFFFAOYSA-N 1 2 309.388 4.156 20 0 DIADLO Cc1cccc(C[C@]2(C)CCC[N@@H+]2CC(F)(F)C(F)F)c1 ZINC001196594926 1049673433 /nfs/dbraw/zinc/67/34/33/1049673433.db2.gz QAKGJZLVRUZZBS-HNNXBMFYSA-N 1 2 303.343 4.292 20 0 DIADLO Cc1cccc(C[C@]2(C)CCC[N@H+]2CC(F)(F)C(F)F)c1 ZINC001196594926 1049673436 /nfs/dbraw/zinc/67/34/36/1049673436.db2.gz QAKGJZLVRUZZBS-HNNXBMFYSA-N 1 2 303.343 4.292 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2cc3ccc(F)cc3[nH]2)cs1 ZINC000488554962 1049674072 /nfs/dbraw/zinc/67/40/72/1049674072.db2.gz GWLVZGRCXQSXPL-QGZVFWFLSA-N 1 2 315.417 4.409 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2cc3ccc(F)cc3[nH]2)cs1 ZINC000488554962 1049674082 /nfs/dbraw/zinc/67/40/82/1049674082.db2.gz GWLVZGRCXQSXPL-QGZVFWFLSA-N 1 2 315.417 4.409 20 0 DIADLO O=C(Nc1ccc(C2CCC2)cc1)c1cccc(-n2cc[nH+]c2)c1 ZINC000488631951 1049684141 /nfs/dbraw/zinc/68/41/41/1049684141.db2.gz TWOYHZHMNBHJQA-UHFFFAOYSA-N 1 2 317.392 4.392 20 0 DIADLO CC(C)C[C@H](C)C[NH2+][C@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001196736843 1049685475 /nfs/dbraw/zinc/68/54/75/1049685475.db2.gz PQDXSCDRMNIPRO-FUHWJXTLSA-N 1 2 319.489 4.211 20 0 DIADLO CCOc1nnc(C[N@H+](C)[C@@H](c2ccccc2C)C(C)C)s1 ZINC000488712371 1049690628 /nfs/dbraw/zinc/69/06/28/1049690628.db2.gz ZAZWWQBMRKETTO-MRXNPFEDSA-N 1 2 319.474 4.074 20 0 DIADLO CCOc1nnc(C[N@@H+](C)[C@@H](c2ccccc2C)C(C)C)s1 ZINC000488712371 1049690632 /nfs/dbraw/zinc/69/06/32/1049690632.db2.gz ZAZWWQBMRKETTO-MRXNPFEDSA-N 1 2 319.474 4.074 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)cc1C ZINC001204355305 1049706763 /nfs/dbraw/zinc/70/67/63/1049706763.db2.gz IVNACIVXTBOKGJ-IBGZPJMESA-N 1 2 317.379 4.155 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)cc1C ZINC001204355305 1049706770 /nfs/dbraw/zinc/70/67/70/1049706770.db2.gz IVNACIVXTBOKGJ-IBGZPJMESA-N 1 2 317.379 4.155 20 0 DIADLO COc1cc(C[N@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)on1 ZINC000659859994 1049712217 /nfs/dbraw/zinc/71/22/17/1049712217.db2.gz RJBMQHGTSNOAJM-VIFPVBQESA-N 1 2 315.200 4.183 20 0 DIADLO COc1cc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)on1 ZINC000659859994 1049712223 /nfs/dbraw/zinc/71/22/23/1049712223.db2.gz RJBMQHGTSNOAJM-VIFPVBQESA-N 1 2 315.200 4.183 20 0 DIADLO Clc1ccc(Cl)c(CC[N@@H+]2CCc3ncsc3C2)c1 ZINC000488996047 1049717526 /nfs/dbraw/zinc/71/75/26/1049717526.db2.gz KMGBBMONUFZBPU-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO Clc1ccc(Cl)c(CC[N@H+]2CCc3ncsc3C2)c1 ZINC000488996047 1049717538 /nfs/dbraw/zinc/71/75/38/1049717538.db2.gz KMGBBMONUFZBPU-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO CCCCO[C@@H]1C[C@H](Nc2ccc(N3CCCC3)c[nH+]2)C1(C)C ZINC001206376394 1049723884 /nfs/dbraw/zinc/72/38/84/1049723884.db2.gz GBWCQIILZBAWIS-DLBZAZTESA-N 1 2 317.477 4.078 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc2cnccc2o1)c1nc2ccccc2o1 ZINC001197229101 1049730324 /nfs/dbraw/zinc/73/03/24/1049730324.db2.gz BLJKZGCMWKEEDW-NWDGAFQWSA-N 1 2 307.353 4.381 20 0 DIADLO COC(=O)[C@@H](CC(C)(C)C)[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC001206419824 1049731700 /nfs/dbraw/zinc/73/17/00/1049731700.db2.gz NBNATHACRGRPGO-AVVWSFFYSA-N 1 2 323.864 4.153 20 0 DIADLO CCOc1ccc(Cl)cc1C[NH+]1CC(C)(CC(F)F)C1 ZINC001206419238 1049731891 /nfs/dbraw/zinc/73/18/91/1049731891.db2.gz KXMINYPKEKLWBE-UHFFFAOYSA-N 1 2 303.780 4.216 20 0 DIADLO O=c1[nH]cccc1Nc1cc[nH+]c2cc(C(F)(F)F)ccc12 ZINC001206422539 1049732717 /nfs/dbraw/zinc/73/27/17/1049732717.db2.gz DFVJNJANSWXBHJ-UHFFFAOYSA-N 1 2 305.259 4.098 20 0 DIADLO COc1ccc(C[NH+]2CCOCC2)cc1-c1ccc(C2CC2)cc1 ZINC001206520702 1049749829 /nfs/dbraw/zinc/74/98/29/1049749829.db2.gz URHUNAIELZTOLS-UHFFFAOYSA-N 1 2 323.436 4.072 20 0 DIADLO COc1cnc(F)c(C[N@@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)c1 ZINC001206538459 1049754248 /nfs/dbraw/zinc/75/42/48/1049754248.db2.gz ZDJSIVYASNVPEA-SFHVURJKSA-N 1 2 324.399 4.123 20 0 DIADLO COc1cnc(F)c(C[N@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)c1 ZINC001206538459 1049754260 /nfs/dbraw/zinc/75/42/60/1049754260.db2.gz ZDJSIVYASNVPEA-SFHVURJKSA-N 1 2 324.399 4.123 20 0 DIADLO CCc1ncc(C[NH2+][C@@H](CC(F)(F)F)c2ccc(F)cc2)o1 ZINC000930207466 1049757432 /nfs/dbraw/zinc/75/74/32/1049757432.db2.gz NZJVMIAEZIOYPI-ZDUSSCGKSA-N 1 2 316.298 4.159 20 0 DIADLO C[C@]1(c2cccc(F)c2)CC[N@H+](Cc2c(Cl)ccnc2F)C1 ZINC001206568690 1049758983 /nfs/dbraw/zinc/75/89/83/1049758983.db2.gz OGFBPXAPUSEHNC-KRWDZBQOSA-N 1 2 322.786 4.177 20 0 DIADLO C[C@]1(c2cccc(F)c2)CC[N@@H+](Cc2c(Cl)ccnc2F)C1 ZINC001206568690 1049758990 /nfs/dbraw/zinc/75/89/90/1049758990.db2.gz OGFBPXAPUSEHNC-KRWDZBQOSA-N 1 2 322.786 4.177 20 0 DIADLO CC(C)[C@H]1C[C@H]([NH2+]CC(F)(F)c2cccc(F)c2)CS1 ZINC001206591877 1049764278 /nfs/dbraw/zinc/76/42/78/1049764278.db2.gz WFNGISLVXRHUOH-UONOGXRCSA-N 1 2 303.393 4.037 20 0 DIADLO c1cn2ccc(-c3ccc4cnn([C@@H]5CCCCO5)c4c3)cc2[nH+]1 ZINC001206642776 1049774674 /nfs/dbraw/zinc/77/46/74/1049774674.db2.gz JYAZOKWNCOBTJR-IBGZPJMESA-N 1 2 318.380 4.050 20 0 DIADLO Cc1cc[nH+]c(C)c1-c1ccc2cnn([C@@H]3CCCCO3)c2c1 ZINC001206665856 1049777419 /nfs/dbraw/zinc/77/74/19/1049777419.db2.gz JRYNOKFTWBRUOW-SFHVURJKSA-N 1 2 307.397 4.414 20 0 DIADLO CC[N@H+](Cc1cnn(C)c1)[C@H](C)c1cc(Cl)ccc1Cl ZINC000489682303 1049777633 /nfs/dbraw/zinc/77/76/33/1049777633.db2.gz WANOIMOCPIPBNU-LLVKDONJSA-N 1 2 312.244 4.310 20 0 DIADLO CC[N@@H+](Cc1cnn(C)c1)[C@H](C)c1cc(Cl)ccc1Cl ZINC000489682303 1049777639 /nfs/dbraw/zinc/77/76/39/1049777639.db2.gz WANOIMOCPIPBNU-LLVKDONJSA-N 1 2 312.244 4.310 20 0 DIADLO CCC[N@H+](Cc1ccccc1F)Cc1ccc(O)c(F)c1F ZINC001206689360 1049779693 /nfs/dbraw/zinc/77/96/93/1049779693.db2.gz WXVVSYATIOFJLQ-UHFFFAOYSA-N 1 2 309.331 4.222 20 0 DIADLO CCC[N@@H+](Cc1ccccc1F)Cc1ccc(O)c(F)c1F ZINC001206689360 1049779701 /nfs/dbraw/zinc/77/97/01/1049779701.db2.gz WXVVSYATIOFJLQ-UHFFFAOYSA-N 1 2 309.331 4.222 20 0 DIADLO Cc1c[nH]c2cc(-c3ccc(C[NH+]4CCOCC4)cc3F)ccc12 ZINC001206712673 1049781692 /nfs/dbraw/zinc/78/16/92/1049781692.db2.gz ZBKXLRGCZBGJOQ-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Cc1c[nH]c2c1cccc2-c1ccc(C[NH+]2CCOCC2)cc1F ZINC001206712450 1049782232 /nfs/dbraw/zinc/78/22/32/1049782232.db2.gz ODXXNKOOFNIWRR-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Fc1cc(C[NH+]2CCOCC2)ccc1-c1cccc(C2CC2)c1 ZINC001206712506 1049782377 /nfs/dbraw/zinc/78/23/77/1049782377.db2.gz QSAAAXRQQPYLIW-UHFFFAOYSA-N 1 2 311.400 4.202 20 0 DIADLO Fc1cc(C[NH+]2CCOCC2)ccc1-c1cccc2occc21 ZINC001206719663 1049784085 /nfs/dbraw/zinc/78/40/85/1049784085.db2.gz MXXTXHLNJNHIKZ-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO CCCOc1ccc(F)c(-c2cn3cc[nH+]c3cc2C)c1F ZINC001206738766 1049788075 /nfs/dbraw/zinc/78/80/75/1049788075.db2.gz HDBRKMLWXZZZTG-UHFFFAOYSA-N 1 2 302.324 4.377 20 0 DIADLO Clc1sc(C[NH+]2CC(CC3CC3)C2)cc1Br ZINC001206779958 1049798017 /nfs/dbraw/zinc/79/80/17/1049798017.db2.gz LLXZNCBOCDUAED-UHFFFAOYSA-N 1 2 320.683 4.396 20 0 DIADLO Cc1nc(C[NH+]2CCC(Oc3ccc(Cl)cc3)CC2)cs1 ZINC001206798858 1049802116 /nfs/dbraw/zinc/80/21/16/1049802116.db2.gz JRQBGWDBOXGYTN-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO COc1ccc(-c2cc(C[N@H+](C)Cc3ccsc3)no2)cc1 ZINC001206827884 1049807531 /nfs/dbraw/zinc/80/75/31/1049807531.db2.gz RJQCNGHYDMFJPV-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1ccc(-c2cc(C[N@@H+](C)Cc3ccsc3)no2)cc1 ZINC001206827884 1049807538 /nfs/dbraw/zinc/80/75/38/1049807538.db2.gz RJQCNGHYDMFJPV-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO Fc1ccc(-c2cc(C[N@@H+]3CCc4ccsc4C3)no2)cc1 ZINC001206835317 1049811184 /nfs/dbraw/zinc/81/11/84/1049811184.db2.gz YCTBZAPJOJNMQS-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1ccc(-c2cc(C[N@H+]3CCc4ccsc4C3)no2)cc1 ZINC001206835317 1049811188 /nfs/dbraw/zinc/81/11/88/1049811188.db2.gz YCTBZAPJOJNMQS-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Cc1ncsc1C[N@H+](Cc1ccccc1)Cc1ccccn1 ZINC001206863436 1049814995 /nfs/dbraw/zinc/81/49/95/1049814995.db2.gz GYFSIXPIGJACKU-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1ncsc1C[N@@H+](Cc1ccccc1)Cc1ccccn1 ZINC001206863436 1049815003 /nfs/dbraw/zinc/81/50/03/1049815003.db2.gz GYFSIXPIGJACKU-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+](C)Cc2ccc(OCC)cc2)n1 ZINC000490295806 1049819565 /nfs/dbraw/zinc/81/95/65/1049819565.db2.gz APDRDWSVSDWLBF-CQSZACIVSA-N 1 2 317.433 4.004 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+](C)Cc2ccc(OCC)cc2)n1 ZINC000490295806 1049819576 /nfs/dbraw/zinc/81/95/76/1049819576.db2.gz APDRDWSVSDWLBF-CQSZACIVSA-N 1 2 317.433 4.004 20 0 DIADLO Cc1ncc(C[N@H+](Cc2ccccc2)Cc2cccnc2)s1 ZINC001207060490 1049828639 /nfs/dbraw/zinc/82/86/39/1049828639.db2.gz NKRJJURLJJHXII-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)s1 ZINC001207060490 1049828647 /nfs/dbraw/zinc/82/86/47/1049828647.db2.gz NKRJJURLJJHXII-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO CC[N@H+](Cc1cccc(=O)[nH]1)Cc1ccc(Cl)cc1Cl ZINC001207070345 1049830553 /nfs/dbraw/zinc/83/05/53/1049830553.db2.gz PYEIDOLAOATUCH-UHFFFAOYSA-N 1 2 311.212 4.116 20 0 DIADLO CC[N@@H+](Cc1cccc(=O)[nH]1)Cc1ccc(Cl)cc1Cl ZINC001207070345 1049830563 /nfs/dbraw/zinc/83/05/63/1049830563.db2.gz PYEIDOLAOATUCH-UHFFFAOYSA-N 1 2 311.212 4.116 20 0 DIADLO FC1(F)CCC[N@H+](CCCc2ccc(Br)cc2)C1 ZINC001207319024 1049879320 /nfs/dbraw/zinc/87/93/20/1049879320.db2.gz XTEUUBGQOQLTEZ-UHFFFAOYSA-N 1 2 318.205 4.113 20 0 DIADLO FC1(F)CCC[N@@H+](CCCc2ccc(Br)cc2)C1 ZINC001207319024 1049879324 /nfs/dbraw/zinc/87/93/24/1049879324.db2.gz XTEUUBGQOQLTEZ-UHFFFAOYSA-N 1 2 318.205 4.113 20 0 DIADLO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2ncc(F)cc2F)cc1 ZINC001207097261 1049833841 /nfs/dbraw/zinc/83/38/41/1049833841.db2.gz PKNXZDZLSGWAFY-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc([C@H]2CCC[N@H+]2Cc2ncc(F)cc2F)cc1 ZINC001207097261 1049833846 /nfs/dbraw/zinc/83/38/46/1049833846.db2.gz PKNXZDZLSGWAFY-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CCC[NH+](CCC)Cn1[nH]c(/C=C\c2ccc(C)o2)nc1=S ZINC000913059966 1049834210 /nfs/dbraw/zinc/83/42/10/1049834210.db2.gz SFXOJPWFELQYEL-HJWRWDBZSA-N 1 2 320.462 4.092 20 0 DIADLO CSc1ccccc1[C@H]1CCC[N@@H+]1Cc1ncc(F)cc1F ZINC001207098881 1049834596 /nfs/dbraw/zinc/83/45/96/1049834596.db2.gz LFWCNOFVSJPWHI-MRXNPFEDSA-N 1 2 320.408 4.419 20 0 DIADLO CSc1ccccc1[C@H]1CCC[N@H+]1Cc1ncc(F)cc1F ZINC001207098881 1049834608 /nfs/dbraw/zinc/83/46/08/1049834608.db2.gz LFWCNOFVSJPWHI-MRXNPFEDSA-N 1 2 320.408 4.419 20 0 DIADLO CCCOc1ccc(C[N@@H+]2Cc3cccc(OC)c3C2)cc1C ZINC001207143482 1049845848 /nfs/dbraw/zinc/84/58/48/1049845848.db2.gz VVOAKJKOOIQDDT-UHFFFAOYSA-N 1 2 311.425 4.308 20 0 DIADLO CCCOc1ccc(C[N@H+]2Cc3cccc(OC)c3C2)cc1C ZINC001207143482 1049845856 /nfs/dbraw/zinc/84/58/56/1049845856.db2.gz VVOAKJKOOIQDDT-UHFFFAOYSA-N 1 2 311.425 4.308 20 0 DIADLO C[N@H+](Cc1ccns1)Cc1cnc(-c2ccccc2F)s1 ZINC001207166572 1049847575 /nfs/dbraw/zinc/84/75/75/1049847575.db2.gz DKXPHLLRHGAPLS-UHFFFAOYSA-N 1 2 319.430 4.038 20 0 DIADLO C[N@@H+](Cc1ccns1)Cc1cnc(-c2ccccc2F)s1 ZINC001207166572 1049847587 /nfs/dbraw/zinc/84/75/87/1049847587.db2.gz DKXPHLLRHGAPLS-UHFFFAOYSA-N 1 2 319.430 4.038 20 0 DIADLO FC(F)n1cccc1C[N@@H+]1CCC[C@](F)(c2ccccc2)C1 ZINC001207209865 1049863724 /nfs/dbraw/zinc/86/37/24/1049863724.db2.gz ROZUEPWTJHPIEA-QGZVFWFLSA-N 1 2 308.347 4.344 20 0 DIADLO FC(F)n1cccc1C[N@H+]1CCC[C@](F)(c2ccccc2)C1 ZINC001207209865 1049863728 /nfs/dbraw/zinc/86/37/28/1049863728.db2.gz ROZUEPWTJHPIEA-QGZVFWFLSA-N 1 2 308.347 4.344 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccc(F)c(C(F)F)c2)c1C ZINC001207218190 1049865118 /nfs/dbraw/zinc/86/51/18/1049865118.db2.gz ICKHSWHWKCTVRV-UHFFFAOYSA-N 1 2 310.319 4.396 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCOC[C@@H]2c2ccccc2Cl)cc1 ZINC001207518122 1049902750 /nfs/dbraw/zinc/90/27/50/1049902750.db2.gz KUNXXCUZHTURDR-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc(CC[N@H+]2CCOC[C@@H]2c2ccccc2Cl)cc1 ZINC001207518122 1049902757 /nfs/dbraw/zinc/90/27/57/1049902757.db2.gz KUNXXCUZHTURDR-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCOC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC001207517452 1049902808 /nfs/dbraw/zinc/90/28/08/1049902808.db2.gz RICVUANSPSXKHN-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc(CC[N@H+]2CCOC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC001207517452 1049902815 /nfs/dbraw/zinc/90/28/15/1049902815.db2.gz RICVUANSPSXKHN-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Cc1cc(C[NH2+][C@@H](COCC(C)C)c2ccco2)cnc1Cl ZINC000760664233 1049924381 /nfs/dbraw/zinc/92/43/81/1049924381.db2.gz QHBJQXVOEOVOSR-HNNXBMFYSA-N 1 2 322.836 4.140 20 0 DIADLO COc1ccc2c(c1)C[C@@H]([NH2+][C@@H](c1ccccc1)C(F)F)CC2 ZINC001207872282 1049948377 /nfs/dbraw/zinc/94/83/77/1049948377.db2.gz BANAVGJVJIYWCT-WMZOPIPTSA-N 1 2 317.379 4.149 20 0 DIADLO COc1ccc(CNc2[nH+]c3ccccc3n2C2CCCC2)nc1 ZINC001207872330 1049949094 /nfs/dbraw/zinc/94/90/94/1049949094.db2.gz BOORCKSESZEWPV-UHFFFAOYSA-N 1 2 322.412 4.167 20 0 DIADLO CC(C)=CCCC1=CC[C@@H](C[N@@H+](C)Cc2noc(C)n2)CC1 ZINC001207940646 1049963731 /nfs/dbraw/zinc/96/37/31/1049963731.db2.gz MVZQHAWLLMHZTF-QGZVFWFLSA-N 1 2 303.450 4.283 20 0 DIADLO CC(C)=CCCC1=CC[C@@H](C[N@H+](C)Cc2noc(C)n2)CC1 ZINC001207940646 1049963738 /nfs/dbraw/zinc/96/37/38/1049963738.db2.gz MVZQHAWLLMHZTF-QGZVFWFLSA-N 1 2 303.450 4.283 20 0 DIADLO Cc1cc(Cl)cc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)c1 ZINC000571823978 1049967067 /nfs/dbraw/zinc/96/70/67/1049967067.db2.gz CERBIYJDMADBSQ-UHFFFAOYSA-N 1 2 317.713 4.495 20 0 DIADLO Cc1ccc([C@@H](C)CC[N@@H+]2CCCC[C@@H]2c2noc(C)n2)o1 ZINC001208154280 1049978774 /nfs/dbraw/zinc/97/87/74/1049978774.db2.gz FCNJOCBMQWCECX-SWLSCSKDSA-N 1 2 303.406 4.000 20 0 DIADLO Cc1ccc([C@@H](C)CC[N@H+]2CCCC[C@@H]2c2noc(C)n2)o1 ZINC001208154280 1049978778 /nfs/dbraw/zinc/97/87/78/1049978778.db2.gz FCNJOCBMQWCECX-SWLSCSKDSA-N 1 2 303.406 4.000 20 0 DIADLO Cc1ccc([C@@H](C)CC[N@@H+]2CCOC[C@H]2c2ccc(F)cc2)o1 ZINC001208166921 1049979640 /nfs/dbraw/zinc/97/96/40/1049979640.db2.gz YPVVOFFOXKVPNA-KSSFIOAISA-N 1 2 317.404 4.294 20 0 DIADLO Cc1ccc([C@@H](C)CC[N@H+]2CCOC[C@H]2c2ccc(F)cc2)o1 ZINC001208166921 1049979645 /nfs/dbraw/zinc/97/96/45/1049979645.db2.gz YPVVOFFOXKVPNA-KSSFIOAISA-N 1 2 317.404 4.294 20 0 DIADLO Cc1cc(C[NH+](Cc2ccco2)Cc2ccco2)cc(C)c1O ZINC000572323746 1049999837 /nfs/dbraw/zinc/99/98/37/1049999837.db2.gz XDPMRTUFXUVKIF-UHFFFAOYSA-N 1 2 311.381 4.397 20 0 DIADLO FC[C@H]1CC[N@H+](CC2(c3ccccc3)CCCC2)CC1(F)F ZINC001208770405 1050009343 /nfs/dbraw/zinc/00/93/43/1050009343.db2.gz AUAKGBSXZMOGLH-MRXNPFEDSA-N 1 2 311.391 4.425 20 0 DIADLO FC[C@H]1CC[N@@H+](CC2(c3ccccc3)CCCC2)CC1(F)F ZINC001208770405 1050009347 /nfs/dbraw/zinc/00/93/47/1050009347.db2.gz AUAKGBSXZMOGLH-MRXNPFEDSA-N 1 2 311.391 4.425 20 0 DIADLO c1cc2c(nc[nH+]c2Nc2cccc(Nc3ccccc3)c2)[nH]1 ZINC000588894994 1050011474 /nfs/dbraw/zinc/01/14/74/1050011474.db2.gz MCWSMCZHFVNARV-UHFFFAOYSA-N 1 2 301.353 4.445 20 0 DIADLO c1cn(-c2ccccc2NC2=CCN(c3ccccc3)CC2)c[nH+]1 ZINC001209057814 1050032095 /nfs/dbraw/zinc/03/20/95/1050032095.db2.gz VHDSHJSANLGXRO-UHFFFAOYSA-N 1 2 316.408 4.078 20 0 DIADLO CCOC(C)(C)C[N@@H+]1CC[C@H](Cc2ccccc2)C(F)(F)C1 ZINC001209078527 1050033619 /nfs/dbraw/zinc/03/36/19/1050033619.db2.gz JEZNHBUYLWJFKK-MRXNPFEDSA-N 1 2 311.416 4.001 20 0 DIADLO CCOC(C)(C)C[N@H+]1CC[C@H](Cc2ccccc2)C(F)(F)C1 ZINC001209078527 1050033624 /nfs/dbraw/zinc/03/36/24/1050033624.db2.gz JEZNHBUYLWJFKK-MRXNPFEDSA-N 1 2 311.416 4.001 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCCC(F)(F)[C@H](F)C2)c(Cl)c1 ZINC001209109874 1050036492 /nfs/dbraw/zinc/03/64/92/1050036492.db2.gz YHYGSLNSDMUTGP-CYBMUJFWSA-N 1 2 309.734 4.091 20 0 DIADLO Fc1ccc(CC[N@H+]2CCCC(F)(F)[C@H](F)C2)c(Cl)c1 ZINC001209109874 1050036497 /nfs/dbraw/zinc/03/64/97/1050036497.db2.gz YHYGSLNSDMUTGP-CYBMUJFWSA-N 1 2 309.734 4.091 20 0 DIADLO F[C@@H]1CSC2(C[NH+](CCc3c(Cl)cccc3Cl)C2)C1 ZINC001209108152 1050036634 /nfs/dbraw/zinc/03/66/34/1050036634.db2.gz BARSFXGLWGBBTA-JTQLQIEISA-N 1 2 320.260 4.065 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1ccccc1Cl ZINC000589605166 1050048633 /nfs/dbraw/zinc/04/86/33/1050048633.db2.gz QXFYWKZXGSPMRR-KBXCAEBGSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1ccccc1Cl ZINC000589605166 1050048640 /nfs/dbraw/zinc/04/86/40/1050048640.db2.gz QXFYWKZXGSPMRR-KBXCAEBGSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000589598649 1050050282 /nfs/dbraw/zinc/05/02/82/1050050282.db2.gz UWIQUAOKWOXXOS-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000589598649 1050050287 /nfs/dbraw/zinc/05/02/87/1050050287.db2.gz UWIQUAOKWOXXOS-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000589598650 1050050443 /nfs/dbraw/zinc/05/04/43/1050050443.db2.gz UWIQUAOKWOXXOS-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000589598650 1050050447 /nfs/dbraw/zinc/05/04/47/1050050447.db2.gz UWIQUAOKWOXXOS-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO c1coc([C@@H]([NH2+]Cc2[nH]nc3ccccc32)c2ccccc2)c1 ZINC000589638156 1050051609 /nfs/dbraw/zinc/05/16/09/1050051609.db2.gz MGAMIFGEZLKBKU-IBGZPJMESA-N 1 2 303.365 4.035 20 0 DIADLO Clc1ccc(C2([NH2+]Cc3n[nH]c4ccccc43)CCC2)cc1 ZINC000589647436 1050053665 /nfs/dbraw/zinc/05/36/65/1050053665.db2.gz ZBMJHZQPCPBBAZ-UHFFFAOYSA-N 1 2 311.816 4.385 20 0 DIADLO Cc1n[nH]cc1C[N@H+](C)Cc1sc2ccccc2c1Cl ZINC001209557280 1050067973 /nfs/dbraw/zinc/06/79/73/1050067973.db2.gz PYZXIBVBRZIVFG-UHFFFAOYSA-N 1 2 305.834 4.218 20 0 DIADLO Cc1n[nH]cc1C[N@@H+](C)Cc1sc2ccccc2c1Cl ZINC001209557280 1050067974 /nfs/dbraw/zinc/06/79/74/1050067974.db2.gz PYZXIBVBRZIVFG-UHFFFAOYSA-N 1 2 305.834 4.218 20 0 DIADLO Cc1[nH]ncc1C[NH+]1CCC(c2cccc(C(F)(F)F)c2)CC1 ZINC001209555968 1050068669 /nfs/dbraw/zinc/06/86/69/1050068669.db2.gz OFDCHKNSLAJTHW-UHFFFAOYSA-N 1 2 323.362 4.117 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1cccc3[nH]cc(Cl)c31)C2 ZINC001209654925 1050073487 /nfs/dbraw/zinc/07/34/87/1050073487.db2.gz ONNNMXCYFNZFCO-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1cccc3[nH]cc(Cl)c31)C2 ZINC001209654925 1050073493 /nfs/dbraw/zinc/07/34/93/1050073493.db2.gz ONNNMXCYFNZFCO-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO Clc1c[nH]c2cccc(C[NH+]3CC(Oc4ccccc4)C3)c12 ZINC001209655649 1050074361 /nfs/dbraw/zinc/07/43/61/1050074361.db2.gz XKLIHSJLQIMUDM-UHFFFAOYSA-N 1 2 312.800 4.085 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1cccc3[nH]cc(Cl)c31)C2 ZINC001209659623 1050074571 /nfs/dbraw/zinc/07/45/71/1050074571.db2.gz QXEOJSBHWPBDLM-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1cccc3[nH]cc(Cl)c31)C2 ZINC001209659623 1050074574 /nfs/dbraw/zinc/07/45/74/1050074574.db2.gz QXEOJSBHWPBDLM-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccc2oc(C[N@H+](C)Cc3cnc(Cl)s3)cc2c1 ZINC001209768933 1050082676 /nfs/dbraw/zinc/08/26/76/1050082676.db2.gz AYLJLAWTLZUZHY-UHFFFAOYSA-N 1 2 322.817 4.183 20 0 DIADLO COc1ccc2oc(C[N@@H+](C)Cc3cnc(Cl)s3)cc2c1 ZINC001209768933 1050082681 /nfs/dbraw/zinc/08/26/81/1050082681.db2.gz AYLJLAWTLZUZHY-UHFFFAOYSA-N 1 2 322.817 4.183 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccn(-c3cccc(F)c3)n2)s1 ZINC000590295461 1050085867 /nfs/dbraw/zinc/08/58/67/1050085867.db2.gz PBXGRUWTRFPAEB-UHFFFAOYSA-N 1 2 315.417 4.013 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccn(-c3cccc(F)c3)n2)s1 ZINC000590295461 1050085871 /nfs/dbraw/zinc/08/58/71/1050085871.db2.gz PBXGRUWTRFPAEB-UHFFFAOYSA-N 1 2 315.417 4.013 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(F)c(OC)c2Cl)c[nH+]1 ZINC001209802150 1050086733 /nfs/dbraw/zinc/08/67/33/1050086733.db2.gz XGTWVJHWRDXINP-UHFFFAOYSA-N 1 2 309.772 4.082 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)s1 ZINC000590346162 1050088287 /nfs/dbraw/zinc/08/82/87/1050088287.db2.gz WHZKUEUFKZDFQJ-OAHLLOKOSA-N 1 2 320.483 4.049 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)s1 ZINC000590346162 1050088293 /nfs/dbraw/zinc/08/82/93/1050088293.db2.gz WHZKUEUFKZDFQJ-OAHLLOKOSA-N 1 2 320.483 4.049 20 0 DIADLO Clc1cnc(Nc2ccc3[nH]c[nH+]c3c2)c(Br)c1 ZINC001209841634 1050093709 /nfs/dbraw/zinc/09/37/09/1050093709.db2.gz YWIXPEPAUAYGBO-UHFFFAOYSA-N 1 2 323.581 4.117 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cccc(OCC(F)(F)F)c1 ZINC001212164586 1050094076 /nfs/dbraw/zinc/09/40/76/1050094076.db2.gz XQTNXVHBBZQUFV-UHFFFAOYSA-N 1 2 312.291 4.165 20 0 DIADLO Cc1cn2cccc(Nc3cccc(OCC(F)(F)F)c3)c2[nH+]1 ZINC001212164445 1050094242 /nfs/dbraw/zinc/09/42/42/1050094242.db2.gz PPDFDDXVXZFHEV-UHFFFAOYSA-N 1 2 321.302 4.327 20 0 DIADLO CCCOc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001209864385 1050097232 /nfs/dbraw/zinc/09/72/32/1050097232.db2.gz JUWQRDXOHPVPNZ-UHFFFAOYSA-N 1 2 307.397 4.464 20 0 DIADLO COc1cc(C(F)(F)F)ccc1Nc1cccc2[nH+]ccn21 ZINC001209881157 1050099313 /nfs/dbraw/zinc/09/93/13/1050099313.db2.gz WLCJXKUZBQWEBV-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(C(F)(F)F)c(F)c1 ZINC001209913886 1050105394 /nfs/dbraw/zinc/10/53/94/1050105394.db2.gz ZOQIZUKVWFBCAD-UHFFFAOYSA-N 1 2 309.266 4.074 20 0 DIADLO c1ccc(Nc2ccc3c(c2)CCCC3)c(C[NH+]2CCOCC2)c1 ZINC001209932399 1050108239 /nfs/dbraw/zinc/10/82/39/1050108239.db2.gz NIFQPZVWYJNOJA-UHFFFAOYSA-N 1 2 322.452 4.141 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2cccc(OCC)c2)n1 ZINC000068839569 1050111464 /nfs/dbraw/zinc/11/14/64/1050111464.db2.gz FPHWDMSWZWGGIY-ZIAGYGMSSA-N 1 2 317.433 4.223 20 0 DIADLO Cc1cc(Nc2cc[nH+]c(NC(=O)OC(C)(C)C)c2)ccc1O ZINC001209971872 1050114326 /nfs/dbraw/zinc/11/43/26/1050114326.db2.gz CMPJIOZMHDKELG-UHFFFAOYSA-N 1 2 315.373 4.186 20 0 DIADLO Cc1noc([C@@H](C)[NH2+][C@H](C)c2ccc(SC(C)C)cc2)n1 ZINC000590948852 1050115125 /nfs/dbraw/zinc/11/51/25/1050115125.db2.gz AZAQMILPLMZWGU-VXGBXAGGSA-N 1 2 305.447 4.290 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2ccc(F)cc2O)cc[nH+]1 ZINC001210014784 1050122618 /nfs/dbraw/zinc/12/26/18/1050122618.db2.gz MVUVTBDJDGLIHX-UHFFFAOYSA-N 1 2 319.336 4.017 20 0 DIADLO Cc1cc(=O)oc2cc(Nc3ccc([NH+](C)C)c(C)c3)ccc12 ZINC001210041120 1050127500 /nfs/dbraw/zinc/12/75/00/1050127500.db2.gz INAXAKQGYMISOZ-UHFFFAOYSA-N 1 2 308.381 4.219 20 0 DIADLO Cc1cc(Nc2ccc3c(c2)NC(=O)C3(C)C)ccc1[NH+](C)C ZINC001210043027 1050127688 /nfs/dbraw/zinc/12/76/88/1050127688.db2.gz JMSPOIMQJXKWSD-UHFFFAOYSA-N 1 2 309.413 4.034 20 0 DIADLO CC(=O)N1CCCc2ccc(Nc3ccc([NH+](C)C)c(C)c3)cc21 ZINC001210042886 1050127889 /nfs/dbraw/zinc/12/78/89/1050127889.db2.gz FCHVFQUDXBCKFF-UHFFFAOYSA-N 1 2 323.440 4.104 20 0 DIADLO c1sc(Nc2ccc3c[nH+]ccc3c2)nc1-c1ccncc1 ZINC001210044435 1050128287 /nfs/dbraw/zinc/12/82/87/1050128287.db2.gz POUMLHPAVRJSKH-UHFFFAOYSA-N 1 2 304.378 4.497 20 0 DIADLO CC(=O)c1cc(Nc2ccc([NH+](C)C)c(C)c2)cc(C(C)=O)c1 ZINC001210045750 1050128457 /nfs/dbraw/zinc/12/84/57/1050128457.db2.gz XKBKVRILNJZSFN-UHFFFAOYSA-N 1 2 310.397 4.210 20 0 DIADLO COc1cc(Nc2ccc([NH+](C)C)c(C)c2)c(Cl)c(OC)c1 ZINC001210043986 1050128737 /nfs/dbraw/zinc/12/87/37/1050128737.db2.gz IWTAYJWQPCRWMH-UHFFFAOYSA-N 1 2 320.820 4.475 20 0 DIADLO c1sc(-c2ccncc2)nc1Nc1ccc2c[nH+]ccc2c1 ZINC001210047267 1050129331 /nfs/dbraw/zinc/12/93/31/1050129331.db2.gz UYNCRTDEENAUAO-UHFFFAOYSA-N 1 2 304.378 4.497 20 0 DIADLO Cc1cc2[nH]ncc2cc1Nc1cccc2c1OCC[C@@H]2[NH+](C)C ZINC001210107201 1050137687 /nfs/dbraw/zinc/13/76/87/1050137687.db2.gz WGEXAYWIQVGFNU-SFHVURJKSA-N 1 2 322.412 4.000 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1cc(F)ccc1Br ZINC000591372772 1050142590 /nfs/dbraw/zinc/14/25/90/1050142590.db2.gz AOMDXSOBMANDFD-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1cc(F)ccc1Br ZINC000591372772 1050142592 /nfs/dbraw/zinc/14/25/92/1050142592.db2.gz AOMDXSOBMANDFD-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2F)C2CCCCC2)no1 ZINC000591377960 1050143694 /nfs/dbraw/zinc/14/36/94/1050143694.db2.gz IIEFPSXWGXVDIW-UHFFFAOYSA-N 1 2 302.393 4.457 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2F)C2CCCCC2)no1 ZINC000591377960 1050143696 /nfs/dbraw/zinc/14/36/96/1050143696.db2.gz IIEFPSXWGXVDIW-UHFFFAOYSA-N 1 2 302.393 4.457 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCC[N@@H+]1Cc1ccco1 ZINC000770337072 1050152870 /nfs/dbraw/zinc/15/28/70/1050152870.db2.gz QDWPYVUVXIUXBH-OAHLLOKOSA-N 1 2 321.852 4.431 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCC[N@H+]1Cc1ccco1 ZINC000770337072 1050152875 /nfs/dbraw/zinc/15/28/75/1050152875.db2.gz QDWPYVUVXIUXBH-OAHLLOKOSA-N 1 2 321.852 4.431 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1cccnc1Cl ZINC000805835713 1050153367 /nfs/dbraw/zinc/15/33/67/1050153367.db2.gz QVUSGMJZYULRDL-OAHLLOKOSA-N 1 2 304.821 4.327 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1cccnc1Cl ZINC000805835713 1050153369 /nfs/dbraw/zinc/15/33/69/1050153369.db2.gz QVUSGMJZYULRDL-OAHLLOKOSA-N 1 2 304.821 4.327 20 0 DIADLO CC(C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2)=C1CCC1 ZINC000823769623 1050155195 /nfs/dbraw/zinc/15/51/95/1050155195.db2.gz FZSTTWAAJIYUBS-UHFFFAOYSA-N 1 2 321.424 4.325 20 0 DIADLO CCCC[C@@H](C)N(CCCC)C(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000573259388 1050155356 /nfs/dbraw/zinc/15/53/56/1050155356.db2.gz VOIAQURKQJTKDU-CABCVRRESA-N 1 2 305.466 4.037 20 0 DIADLO O=c1[nH]cc(-c2ccccn2)cc1Nc1cccc2cc[nH+]cc21 ZINC001210224411 1050165045 /nfs/dbraw/zinc/16/50/45/1050165045.db2.gz LHNRCFMWLAIWID-UHFFFAOYSA-N 1 2 314.348 4.141 20 0 DIADLO Fc1ccccc1Cn1nccc1Nc1cccc2cc[nH+]cc21 ZINC001210224316 1050165089 /nfs/dbraw/zinc/16/50/89/1050165089.db2.gz WYDAETKAFPOUMF-UHFFFAOYSA-N 1 2 318.355 4.362 20 0 DIADLO CCSCc1cc[nH+]c(N[C@H]2CCc3cccnc3CC2)c1 ZINC000591531649 1050167311 /nfs/dbraw/zinc/16/73/11/1050167311.db2.gz MAEFBDVMUWGFCR-INIZCTEOSA-N 1 2 313.470 4.089 20 0 DIADLO Fc1cc(Nc2cccc3cc[nH+]cc32)cnc1Br ZINC001210225879 1050167449 /nfs/dbraw/zinc/16/74/49/1050167449.db2.gz MZODSRSQZSKNTF-UHFFFAOYSA-N 1 2 318.149 4.275 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]Cc1ncc(C)cn1 ZINC000347995893 1050167790 /nfs/dbraw/zinc/16/77/90/1050167790.db2.gz DYPHDPHRPJQMFD-ZDUSSCGKSA-N 1 2 324.453 4.068 20 0 DIADLO COc1cccc(-n2nccc2Nc2cccc3cc[nH+]cc32)c1 ZINC001210224999 1050167840 /nfs/dbraw/zinc/16/78/40/1050167840.db2.gz AEMDEVRYANOBDS-UHFFFAOYSA-N 1 2 316.364 4.173 20 0 DIADLO FC(F)(F)c1ncccc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001210234335 1050172620 /nfs/dbraw/zinc/17/26/20/1050172620.db2.gz OTNYHWSXKHVRDL-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO COc1ccc2oc([C@@H](C)[NH2+][C@@H](C)c3cc(C)on3)c(C)c2c1 ZINC000282654658 1050174300 /nfs/dbraw/zinc/17/43/00/1050174300.db2.gz IFRSCHRRJKFZJG-QWHCGFSZSA-N 1 2 314.385 4.458 20 0 DIADLO COc1ccc2oc([C@H](C)[NH2+][C@@H](C)c3cc(C)on3)c(C)c2c1 ZINC000282654661 1050175523 /nfs/dbraw/zinc/17/55/23/1050175523.db2.gz IFRSCHRRJKFZJG-STQMWFEESA-N 1 2 314.385 4.458 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)c(F)cc1F)c1c(F)cccc1F ZINC000225258529 1050184034 /nfs/dbraw/zinc/18/40/34/1050184034.db2.gz UUXVIOFFWSLHGL-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)c(F)cn1 ZINC000824136039 1050184248 /nfs/dbraw/zinc/18/42/48/1050184248.db2.gz SUVWAOAVZFIYHC-FDMDGMSGSA-N 1 2 300.352 4.038 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)c(F)cn1 ZINC000824136039 1050184255 /nfs/dbraw/zinc/18/42/55/1050184255.db2.gz SUVWAOAVZFIYHC-FDMDGMSGSA-N 1 2 300.352 4.038 20 0 DIADLO Cc1[nH+]cc(Nc2cc(-c3ccc(Cl)cc3)no2)cc1N ZINC001210287231 1050189690 /nfs/dbraw/zinc/18/96/90/1050189690.db2.gz PBXATVREZLGMHV-UHFFFAOYSA-N 1 2 300.749 4.024 20 0 DIADLO CCCCOc1c(Nc2c[nH+]c(C)c(N)c2)ccc(F)c1F ZINC001210289499 1050191267 /nfs/dbraw/zinc/19/12/67/1050191267.db2.gz OGTVFOZLBZNIHF-UHFFFAOYSA-N 1 2 307.344 4.173 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(Cl)c(Br)c2)cc1N ZINC001210290207 1050191510 /nfs/dbraw/zinc/19/15/10/1050191510.db2.gz GJOVJTUBZFEXRR-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO Cc1[nH+]cc(Nc2cccc(F)c2OCC(C)(C)C)cc1N ZINC001210292041 1050191802 /nfs/dbraw/zinc/19/18/02/1050191802.db2.gz ZEUZNIBJGLCKAN-UHFFFAOYSA-N 1 2 303.381 4.280 20 0 DIADLO Cc1[nH+]cc(Nc2ccccc2Oc2ccccc2N)cc1N ZINC001210290995 1050192585 /nfs/dbraw/zinc/19/25/85/1050192585.db2.gz IPFOHDQJUUYHNB-UHFFFAOYSA-N 1 2 306.369 4.090 20 0 DIADLO CC(=O)c1cc(Cl)c(Nc2c[nH+]c(C)c(N)c2)c(Cl)c1 ZINC001210290844 1050192722 /nfs/dbraw/zinc/19/27/22/1050192722.db2.gz QQJSEEFBKYVDDE-UHFFFAOYSA-N 1 2 310.184 4.225 20 0 DIADLO Cc1[nH+]cc(Nc2cc(Br)ccc2Cl)cc1N ZINC001210290368 1050192786 /nfs/dbraw/zinc/19/27/86/1050192786.db2.gz KQCBFOOQPXWQKA-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO Fc1cc(F)c(C[NH+]2CCC3(CC3)CC2)cc1Br ZINC001136851281 1050197779 /nfs/dbraw/zinc/19/77/79/1050197779.db2.gz YLAKQUOCKBPTDX-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO CC1(C)CC[C@@H]([NH2+]Cc2n[nH]c3ccccc32)c2ccccc21 ZINC000591713002 1050200871 /nfs/dbraw/zinc/20/08/71/1050200871.db2.gz FDCBRVLMXHKKCI-QGZVFWFLSA-N 1 2 305.425 4.465 20 0 DIADLO CC(C)CN(C(=O)C[C@@H](C)n1cc[nH+]c1)c1cccc(Cl)c1 ZINC000573497583 1050204922 /nfs/dbraw/zinc/20/49/22/1050204922.db2.gz ZLCHPIVJKLAOFY-CQSZACIVSA-N 1 2 319.836 4.177 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1ccnc(Cl)c1F ZINC000824402719 1050207965 /nfs/dbraw/zinc/20/79/65/1050207965.db2.gz NONJIDCMZKJUBF-CQSZACIVSA-N 1 2 322.811 4.466 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1ccnc(Cl)c1F ZINC000824402719 1050207975 /nfs/dbraw/zinc/20/79/75/1050207975.db2.gz NONJIDCMZKJUBF-CQSZACIVSA-N 1 2 322.811 4.466 20 0 DIADLO CCc1cccc(Nc2ccc3c(cnn3[C@H]3CCCCO3)c2)[nH+]1 ZINC001210333685 1050208526 /nfs/dbraw/zinc/20/85/26/1050208526.db2.gz KLSLXIWSKWYWQQ-LJQANCHMSA-N 1 2 322.412 4.436 20 0 DIADLO CC(=O)c1ccc([C@H](C)Nc2cc[nH+]c(OCC(C)C)c2)cc1 ZINC001171056655 1050215804 /nfs/dbraw/zinc/21/58/04/1050215804.db2.gz YJMZGEQFTCOBGH-AWEZNQCLSA-N 1 2 312.413 4.492 20 0 DIADLO CC[C@H](CC1CCCC1)C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000734092651 1050219335 /nfs/dbraw/zinc/21/93/35/1050219335.db2.gz WSLWQEMAIKHARB-IAGOWNOFSA-N 1 2 319.493 4.021 20 0 DIADLO CC[C@@H]1C[N@H+](Cn2ncsc2=S)CC[C@H]1c1ccccc1 ZINC000746379875 1050223606 /nfs/dbraw/zinc/22/36/06/1050223606.db2.gz BAGXVMDUPMCHFR-UKRRQHHQSA-N 1 2 319.499 4.147 20 0 DIADLO CC[C@@H]1C[N@@H+](Cn2ncsc2=S)CC[C@H]1c1ccccc1 ZINC000746379875 1050223623 /nfs/dbraw/zinc/22/36/23/1050223623.db2.gz BAGXVMDUPMCHFR-UKRRQHHQSA-N 1 2 319.499 4.147 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc(OCC2CC2)c1 ZINC001210380208 1050225799 /nfs/dbraw/zinc/22/57/99/1050225799.db2.gz UJHOXXKWHPULQV-UHFFFAOYSA-N 1 2 320.392 4.337 20 0 DIADLO CCCCc1oc2ccccc2c1C[N@H+](C)Cc1nonc1C ZINC000734148495 1050231984 /nfs/dbraw/zinc/23/19/84/1050231984.db2.gz WIAHFTHNOWVRTP-UHFFFAOYSA-N 1 2 313.401 4.099 20 0 DIADLO CCCCc1oc2ccccc2c1C[N@@H+](C)Cc1nonc1C ZINC000734148495 1050231991 /nfs/dbraw/zinc/23/19/91/1050231991.db2.gz WIAHFTHNOWVRTP-UHFFFAOYSA-N 1 2 313.401 4.099 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@H](C)c2csc3ccccc23)n1 ZINC000734160642 1050233270 /nfs/dbraw/zinc/23/32/70/1050233270.db2.gz YLYIHHQOPOHVFH-GHMZBOCLSA-N 1 2 301.415 4.259 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(Cl)cn1 ZINC001136932322 1050235462 /nfs/dbraw/zinc/23/54/62/1050235462.db2.gz DDBPAYIDZSAVOD-QGZVFWFLSA-N 1 2 316.832 4.218 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(Cl)cn1 ZINC001136932322 1050235477 /nfs/dbraw/zinc/23/54/77/1050235477.db2.gz DDBPAYIDZSAVOD-QGZVFWFLSA-N 1 2 316.832 4.218 20 0 DIADLO OCc1ccc(Nc2cc[nH+]c3cc(Cl)ccc23)cc1F ZINC001210485442 1050261574 /nfs/dbraw/zinc/26/15/74/1050261574.db2.gz WCJQGJYYQYSGGT-UHFFFAOYSA-N 1 2 302.736 4.263 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000069085139 1050274249 /nfs/dbraw/zinc/27/42/49/1050274249.db2.gz HIMLNDHHEGVLNQ-OAHLLOKOSA-N 1 2 314.429 4.318 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000069085139 1050274262 /nfs/dbraw/zinc/27/42/62/1050274262.db2.gz HIMLNDHHEGVLNQ-OAHLLOKOSA-N 1 2 314.429 4.318 20 0 DIADLO Cc1c[nH+]cc(NC[C@@H](O)c2c(Cl)cccc2Cl)c1C ZINC001170034259 1050288228 /nfs/dbraw/zinc/28/82/28/1050288228.db2.gz SZBCILZGYQHKQA-CQSZACIVSA-N 1 2 311.212 4.151 20 0 DIADLO Fc1cccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1Cl ZINC001210541945 1050288795 /nfs/dbraw/zinc/28/87/95/1050288795.db2.gz XYBWDXBTKDMVRC-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)c1Cl ZINC001143369324 1050319056 /nfs/dbraw/zinc/31/90/56/1050319056.db2.gz PDKAYUKLMQYYFM-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2ccncc2)c1Cl ZINC001143369324 1050319065 /nfs/dbraw/zinc/31/90/65/1050319065.db2.gz PDKAYUKLMQYYFM-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@](C)(F)[C@H](F)C2)c1 ZINC001143672622 1050334503 /nfs/dbraw/zinc/33/45/03/1050334503.db2.gz NSWVHVRTCANQTQ-KGLIPLIRSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1ccc(C(F)(F)F)c(C[N@H+]2CC[C@](C)(F)[C@H](F)C2)c1 ZINC001143672622 1050334515 /nfs/dbraw/zinc/33/45/15/1050334515.db2.gz NSWVHVRTCANQTQ-KGLIPLIRSA-N 1 2 307.306 4.286 20 0 DIADLO C[N@H+](Cc1ccccn1)Cc1ccc(C(F)(F)F)cc1Cl ZINC001143706615 1050341436 /nfs/dbraw/zinc/34/14/36/1050341436.db2.gz FIACJNKJBRIELY-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccccn1)Cc1ccc(C(F)(F)F)cc1Cl ZINC001143706615 1050341444 /nfs/dbraw/zinc/34/14/44/1050341444.db2.gz FIACJNKJBRIELY-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO F[C@@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2Cl)C[C@@H]2C[C@@H]21 ZINC001143710558 1050343844 /nfs/dbraw/zinc/34/38/44/1050343844.db2.gz VJMBSFPPRNDAJS-XHVZSJERSA-N 1 2 307.718 4.149 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2ccc(C(F)(F)F)cc2Cl)C[C@@H]2C[C@@H]21 ZINC001143710558 1050343854 /nfs/dbraw/zinc/34/38/54/1050343854.db2.gz VJMBSFPPRNDAJS-XHVZSJERSA-N 1 2 307.718 4.149 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3CCCC3(C)C)c2)[nH+]c1C ZINC000772363941 1050356121 /nfs/dbraw/zinc/35/61/21/1050356121.db2.gz CERCZUUCMFBHIL-MRXNPFEDSA-N 1 2 311.429 4.458 20 0 DIADLO COC(=O)c1cccc([C@H](C)Nc2cc3cc(F)ccc3c[nH+]2)c1 ZINC001171103701 1050359403 /nfs/dbraw/zinc/35/94/03/1050359403.db2.gz UIRMVMRKSAEHPE-LBPRGKRZSA-N 1 2 324.355 4.334 20 0 DIADLO CCCC[C@@H](CC)CC(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000735271466 1050362889 /nfs/dbraw/zinc/36/28/89/1050362889.db2.gz HMZOSGCJDABTKH-CVEARBPZSA-N 1 2 307.482 4.021 20 0 DIADLO C[N@H+](Cc1c(Cl)cc(Cl)cc1Cl)[C@@H]1CCCOC1 ZINC001143799831 1050362850 /nfs/dbraw/zinc/36/28/50/1050362850.db2.gz AGXCOINSMMFYHI-SNVBAGLBSA-N 1 2 308.636 4.258 20 0 DIADLO C[N@@H+](Cc1c(Cl)cc(Cl)cc1Cl)[C@@H]1CCCOC1 ZINC001143799831 1050362861 /nfs/dbraw/zinc/36/28/61/1050362861.db2.gz AGXCOINSMMFYHI-SNVBAGLBSA-N 1 2 308.636 4.258 20 0 DIADLO C[C@@H]1CC[C@@H](CO)C[N@@H+]1Cc1c(Cl)cc(Cl)cc1Cl ZINC001143797676 1050363329 /nfs/dbraw/zinc/36/33/29/1050363329.db2.gz OSYCXILOYGHZHE-NXEZZACHSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[C@@H](CO)C[N@H+]1Cc1c(Cl)cc(Cl)cc1Cl ZINC001143797676 1050363341 /nfs/dbraw/zinc/36/33/41/1050363341.db2.gz OSYCXILOYGHZHE-NXEZZACHSA-N 1 2 322.663 4.240 20 0 DIADLO COc1cc(Nc2ccc(C(F)(F)F)nc2Cl)cc(C)[nH+]1 ZINC001210777117 1050368329 /nfs/dbraw/zinc/36/83/29/1050368329.db2.gz VTVDSIAIFVTXKA-UHFFFAOYSA-N 1 2 317.698 4.209 20 0 DIADLO COc1cc(Nc2ccc(Cc3cccnc3)cc2)cc(C)[nH+]1 ZINC001210780746 1050369595 /nfs/dbraw/zinc/36/95/95/1050369595.db2.gz PKNNHETYOKXBOQ-UHFFFAOYSA-N 1 2 305.381 4.128 20 0 DIADLO COc1cc(Nc2ccc(OCc3ccncc3)cc2)cc(C)[nH+]1 ZINC001210780093 1050369771 /nfs/dbraw/zinc/36/97/71/1050369771.db2.gz AFMABAZTTGEVDU-UHFFFAOYSA-N 1 2 321.380 4.116 20 0 DIADLO Cc1c2ccccc2oc1C[NH2+]Cc1occc1Br ZINC000735321600 1050370139 /nfs/dbraw/zinc/37/01/39/1050370139.db2.gz YRMAHBBFSCWNAD-UHFFFAOYSA-N 1 2 320.186 4.387 20 0 DIADLO CC(C)[C@H]1COCC[N@@H+]1Cc1ccc(C(F)(F)F)c(Cl)c1 ZINC001143810622 1050370433 /nfs/dbraw/zinc/37/04/33/1050370433.db2.gz UKXBTVJFJKTUKZ-CQSZACIVSA-N 1 2 321.770 4.216 20 0 DIADLO CC(C)[C@H]1COCC[N@H+]1Cc1ccc(C(F)(F)F)c(Cl)c1 ZINC001143810622 1050370448 /nfs/dbraw/zinc/37/04/48/1050370448.db2.gz UKXBTVJFJKTUKZ-CQSZACIVSA-N 1 2 321.770 4.216 20 0 DIADLO CCOc1c(Cl)ccc(C[N@@H+]2CCC[C@H](C(F)F)C2)c1F ZINC001143831452 1050376475 /nfs/dbraw/zinc/37/64/75/1050376475.db2.gz NRHYADZICSAMLP-NSHDSACASA-N 1 2 321.770 4.355 20 0 DIADLO CCOc1c(Cl)ccc(C[N@H+]2CCC[C@H](C(F)F)C2)c1F ZINC001143831452 1050376485 /nfs/dbraw/zinc/37/64/85/1050376485.db2.gz NRHYADZICSAMLP-NSHDSACASA-N 1 2 321.770 4.355 20 0 DIADLO CCOc1c(Cl)ccc(C[N@H+](CC)Cc2cccnc2)c1F ZINC001143830978 1050376538 /nfs/dbraw/zinc/37/65/38/1050376538.db2.gz CDLLQLLBIRZFQB-UHFFFAOYSA-N 1 2 322.811 4.295 20 0 DIADLO CCOc1c(Cl)ccc(C[N@@H+](CC)Cc2cccnc2)c1F ZINC001143830978 1050376548 /nfs/dbraw/zinc/37/65/48/1050376548.db2.gz CDLLQLLBIRZFQB-UHFFFAOYSA-N 1 2 322.811 4.295 20 0 DIADLO CC(C)(C)C[C@H]1CN(C[N@@H+]2CCC[C@@H]2c2ccsc2)C(=O)O1 ZINC000785498798 1050383812 /nfs/dbraw/zinc/38/38/12/1050383812.db2.gz IKCLLIYILBKEMG-LSDHHAIUSA-N 1 2 322.474 4.100 20 0 DIADLO CC(C)(C)C[C@H]1CN(C[N@H+]2CCC[C@@H]2c2ccsc2)C(=O)O1 ZINC000785498798 1050383818 /nfs/dbraw/zinc/38/38/18/1050383818.db2.gz IKCLLIYILBKEMG-LSDHHAIUSA-N 1 2 322.474 4.100 20 0 DIADLO Oc1cccc(Nc2cc[nH+]c3ccc(Cl)cc23)c1Cl ZINC001210844859 1050390438 /nfs/dbraw/zinc/39/04/38/1050390438.db2.gz OBWXSPSFNGFNDC-UHFFFAOYSA-N 1 2 305.164 4.413 20 0 DIADLO CCCCCOc1ccc(OC(=O)C[C@@H](C)n2cc[nH+]c2)cc1 ZINC000844279753 1050392289 /nfs/dbraw/zinc/39/22/89/1050392289.db2.gz VAOKZPZGNVTVQN-OAHLLOKOSA-N 1 2 316.401 4.009 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c(F)c1F ZINC001143903562 1050399335 /nfs/dbraw/zinc/39/93/35/1050399335.db2.gz ZNQHFOJMSUKXRT-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(C[N@H+]2CCc3ccccc3[C@@H]2C)c(F)c1F ZINC001143903562 1050399347 /nfs/dbraw/zinc/39/93/47/1050399347.db2.gz ZNQHFOJMSUKXRT-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(Cl)c(C[N@H+](C)Cc2ccccc2C)c1F ZINC001143895835 1050400723 /nfs/dbraw/zinc/40/07/23/1050400723.db2.gz JCTDTVVONIAJBK-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+](C)Cc2ccccc2C)c1F ZINC001143895835 1050400728 /nfs/dbraw/zinc/40/07/28/1050400728.db2.gz JCTDTVVONIAJBK-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccccc2F)c(F)c1F ZINC001143910805 1050403656 /nfs/dbraw/zinc/40/36/56/1050403656.db2.gz MZGDCRGNWRBFBG-HNNXBMFYSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2ccccc2F)c(F)c1F ZINC001143910805 1050403669 /nfs/dbraw/zinc/40/36/69/1050403669.db2.gz MZGDCRGNWRBFBG-HNNXBMFYSA-N 1 2 321.342 4.450 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)o1 ZINC000735494953 1050403907 /nfs/dbraw/zinc/40/39/07/1050403907.db2.gz LKFLSMNZEXNMLC-MRXNPFEDSA-N 1 2 302.443 4.088 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)o1 ZINC000735494953 1050403917 /nfs/dbraw/zinc/40/39/17/1050403917.db2.gz LKFLSMNZEXNMLC-MRXNPFEDSA-N 1 2 302.443 4.088 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(C)nc2)c(F)c1F ZINC001143916649 1050405738 /nfs/dbraw/zinc/40/57/38/1050405738.db2.gz QXXSSOUUCYTLML-HNNXBMFYSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(C)nc2)c(F)c1F ZINC001143916649 1050405743 /nfs/dbraw/zinc/40/57/43/1050405743.db2.gz QXXSSOUUCYTLML-HNNXBMFYSA-N 1 2 318.367 4.014 20 0 DIADLO C[C@H](CSc1ccccc1)[N@H+](C)Cc1csc(Cl)n1 ZINC000844359436 1050405817 /nfs/dbraw/zinc/40/58/17/1050405817.db2.gz JXVLDVRVNDJAJR-LLVKDONJSA-N 1 2 312.891 4.409 20 0 DIADLO C[C@H](CSc1ccccc1)[N@@H+](C)Cc1csc(Cl)n1 ZINC000844359436 1050405821 /nfs/dbraw/zinc/40/58/21/1050405821.db2.gz JXVLDVRVNDJAJR-LLVKDONJSA-N 1 2 312.891 4.409 20 0 DIADLO CCCCC[C@@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)c1ccccc1 ZINC000844376948 1050415205 /nfs/dbraw/zinc/41/52/05/1050415205.db2.gz URBFSPMJABGWOO-SJLPKXTDSA-N 1 2 313.445 4.272 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c1F ZINC001143971257 1050415567 /nfs/dbraw/zinc/41/55/67/1050415567.db2.gz RABMQJLJNIVRRM-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c1F ZINC001143971257 1050415573 /nfs/dbraw/zinc/41/55/73/1050415573.db2.gz RABMQJLJNIVRRM-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO Cn1c2ccccc2[nH+]c1Nc1cc(Cl)c(O)c(Cl)c1 ZINC001210923707 1050416075 /nfs/dbraw/zinc/41/60/75/1050416075.db2.gz YSSALFCVAMGSIJ-UHFFFAOYSA-N 1 2 308.168 4.329 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c1F ZINC001143958219 1050416912 /nfs/dbraw/zinc/41/69/12/1050416912.db2.gz ZHEVOJDOWVOFOD-CYBMUJFWSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c1F ZINC001143958219 1050416917 /nfs/dbraw/zinc/41/69/17/1050416917.db2.gz ZHEVOJDOWVOFOD-CYBMUJFWSA-N 1 2 323.770 4.272 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CC=C(c3ccccc3)CC2)c1F ZINC001143980267 1050426872 /nfs/dbraw/zinc/42/68/72/1050426872.db2.gz HSNVAVRXSVLRIH-UHFFFAOYSA-N 1 2 315.363 4.263 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CC=C(c3ccccc3)CC2)c1F ZINC001143980267 1050426876 /nfs/dbraw/zinc/42/68/76/1050426876.db2.gz HSNVAVRXSVLRIH-UHFFFAOYSA-N 1 2 315.363 4.263 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1)Cc1c(F)ccc(OC)c1F ZINC001143980577 1050427129 /nfs/dbraw/zinc/42/71/29/1050427129.db2.gz PTDQUQWLXIMBAG-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1)Cc1c(F)ccc(OC)c1F ZINC001143980577 1050427136 /nfs/dbraw/zinc/42/71/36/1050427136.db2.gz PTDQUQWLXIMBAG-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO FC(F)(F)c1cc(Cl)cc(C[N@@H+]2CCC[C@]3(CCO3)C2)c1 ZINC001143990770 1050433274 /nfs/dbraw/zinc/43/32/74/1050433274.db2.gz JUUCELZRXPHMQG-AWEZNQCLSA-N 1 2 319.754 4.114 20 0 DIADLO FC(F)(F)c1cc(Cl)cc(C[N@H+]2CCC[C@]3(CCO3)C2)c1 ZINC001143990770 1050433280 /nfs/dbraw/zinc/43/32/80/1050433280.db2.gz JUUCELZRXPHMQG-AWEZNQCLSA-N 1 2 319.754 4.114 20 0 DIADLO CC(=O)C1CC[NH+](Cc2cc(Cl)cc(C(F)(F)F)c2)CC1 ZINC001143991097 1050433336 /nfs/dbraw/zinc/43/33/36/1050433336.db2.gz KYTXEONDAJWXIF-UHFFFAOYSA-N 1 2 319.754 4.160 20 0 DIADLO c1nc(C2CC2)c(CNc2ccc(N3CCCCC3)c[nH+]2)s1 ZINC000362636815 1050446052 /nfs/dbraw/zinc/44/60/52/1050446052.db2.gz WSCSVGSNTWWHPV-UHFFFAOYSA-N 1 2 314.458 4.018 20 0 DIADLO COc1c(F)cc(Nc2ccc(C)c[nH+]2)cc1Br ZINC001211013018 1050447124 /nfs/dbraw/zinc/44/71/24/1050447124.db2.gz WWQOYIOMERQFCK-UHFFFAOYSA-N 1 2 311.154 4.044 20 0 DIADLO CCOc1ccc(F)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001211052675 1050459240 /nfs/dbraw/zinc/45/92/40/1050459240.db2.gz YRYUZLJWXMPHEA-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO CSc1cncc(Nc2cc[nH+]c3ccc(Cl)cc23)c1 ZINC001211067729 1050463780 /nfs/dbraw/zinc/46/37/80/1050463780.db2.gz PDOZISRAARJECV-UHFFFAOYSA-N 1 2 301.802 4.171 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1cc(O)cc(OC(F)(F)F)c1 ZINC001211124166 1050486183 /nfs/dbraw/zinc/48/61/83/1050486183.db2.gz IQHNGCDIGTZABH-UHFFFAOYSA-N 1 2 312.291 4.300 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@H+](Cc2csc(C3CCCC3)n2)C1 ZINC000761052508 1050487898 /nfs/dbraw/zinc/48/78/98/1050487898.db2.gz GKNGDHQOSIUXPL-LLVKDONJSA-N 1 2 304.381 4.185 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@@H+](Cc2csc(C3CCCC3)n2)C1 ZINC000761052508 1050487904 /nfs/dbraw/zinc/48/79/04/1050487904.db2.gz GKNGDHQOSIUXPL-LLVKDONJSA-N 1 2 304.381 4.185 20 0 DIADLO C[N@H+](Cc1n[nH]c2ccc(F)cc21)Cc1cccc2ccccc21 ZINC001144196430 1050490150 /nfs/dbraw/zinc/49/01/50/1050490150.db2.gz GVHZECQBCNCOHE-UHFFFAOYSA-N 1 2 319.383 4.487 20 0 DIADLO C[N@@H+](Cc1n[nH]c2ccc(F)cc21)Cc1cccc2ccccc21 ZINC001144196430 1050490156 /nfs/dbraw/zinc/49/01/56/1050490156.db2.gz GVHZECQBCNCOHE-UHFFFAOYSA-N 1 2 319.383 4.487 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2n[nH]c3ccc(F)cc32)cc1 ZINC001144196518 1050491452 /nfs/dbraw/zinc/49/14/52/1050491452.db2.gz JYUVCKKCEDDAJM-LJQANCHMSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2n[nH]c3ccc(F)cc32)cc1 ZINC001144196518 1050491457 /nfs/dbraw/zinc/49/14/57/1050491457.db2.gz JYUVCKKCEDDAJM-LJQANCHMSA-N 1 2 309.388 4.348 20 0 DIADLO Fc1ccc2[nH]nc(C[N@H+](Cc3ccccc3)C3CCC3)c2c1 ZINC001144201132 1050493236 /nfs/dbraw/zinc/49/32/36/1050493236.db2.gz VVNTYBHGMTUWCW-UHFFFAOYSA-N 1 2 309.388 4.257 20 0 DIADLO Fc1ccc2[nH]nc(C[N@@H+](Cc3ccccc3)C3CCC3)c2c1 ZINC001144201132 1050493242 /nfs/dbraw/zinc/49/32/42/1050493242.db2.gz VVNTYBHGMTUWCW-UHFFFAOYSA-N 1 2 309.388 4.257 20 0 DIADLO Cc1cn2cccc(Nc3cccc(-c4cccnc4)c3)c2[nH+]1 ZINC001211143605 1050495484 /nfs/dbraw/zinc/49/54/84/1050495484.db2.gz RGTQROLIPWSRBP-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO Oc1ccc(Cl)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1F ZINC001214554435 1050517322 /nfs/dbraw/zinc/51/73/22/1050517322.db2.gz RGOXRPXULOYVBA-UHFFFAOYSA-N 1 2 321.783 4.314 20 0 DIADLO C[N@H+](Cc1sc2ccccc2c1Cl)Cc1ccc(O)cn1 ZINC001144265724 1050522379 /nfs/dbraw/zinc/52/23/79/1050522379.db2.gz YAAOCXQPTHNLRD-UHFFFAOYSA-N 1 2 318.829 4.287 20 0 DIADLO C[N@@H+](Cc1sc2ccccc2c1Cl)Cc1ccc(O)cn1 ZINC001144265724 1050522392 /nfs/dbraw/zinc/52/23/92/1050522392.db2.gz YAAOCXQPTHNLRD-UHFFFAOYSA-N 1 2 318.829 4.287 20 0 DIADLO CO[C@@H](c1ccccc1)[C@H](C)Nc1ccc2c(c1)CCC[N@H+]2C ZINC000786903600 1050525720 /nfs/dbraw/zinc/52/57/20/1050525720.db2.gz YMNJOGFJCLMELP-MGPUTAFESA-N 1 2 310.441 4.257 20 0 DIADLO CO[C@@H](c1ccccc1)[C@H](C)Nc1ccc2c(c1)CCC[N@@H+]2C ZINC000786903600 1050525731 /nfs/dbraw/zinc/52/57/31/1050525731.db2.gz YMNJOGFJCLMELP-MGPUTAFESA-N 1 2 310.441 4.257 20 0 DIADLO C[C@@H]1CCCCC[N@@H+]1Cn1nc(Cc2cccs2)oc1=S ZINC000738226157 1050528369 /nfs/dbraw/zinc/52/83/69/1050528369.db2.gz VIMNCKIXEWIGLU-GFCCVEGCSA-N 1 2 323.487 4.080 20 0 DIADLO C[C@@H]1CCCCC[N@H+]1Cn1nc(Cc2cccs2)oc1=S ZINC000738226157 1050528378 /nfs/dbraw/zinc/52/83/78/1050528378.db2.gz VIMNCKIXEWIGLU-GFCCVEGCSA-N 1 2 323.487 4.080 20 0 DIADLO CCn1c(=S)n(C[N@@H+]2CCC[C@H](C(C)C)CC2)nc1C1CC1 ZINC000738241940 1050528969 /nfs/dbraw/zinc/52/89/69/1050528969.db2.gz VEHHOQSXGWFPAL-AWEZNQCLSA-N 1 2 322.522 4.027 20 0 DIADLO CCn1c(=S)n(C[N@H+]2CCC[C@H](C(C)C)CC2)nc1C1CC1 ZINC000738241940 1050528975 /nfs/dbraw/zinc/52/89/75/1050528975.db2.gz VEHHOQSXGWFPAL-AWEZNQCLSA-N 1 2 322.522 4.027 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cn1sc2ccccc2c1=O ZINC000738243555 1050532305 /nfs/dbraw/zinc/53/23/05/1050532305.db2.gz QHNWYMGNJQDARE-QGZVFWFLSA-N 1 2 324.449 4.030 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cn1sc2ccccc2c1=O ZINC000738243555 1050532312 /nfs/dbraw/zinc/53/23/12/1050532312.db2.gz QHNWYMGNJQDARE-QGZVFWFLSA-N 1 2 324.449 4.030 20 0 DIADLO CCc1cccc(C[N@@H+]2CCc3ncc(C(F)(F)F)cc3C2)c1 ZINC001144324074 1050541419 /nfs/dbraw/zinc/54/14/19/1050541419.db2.gz WPCRFVKYULLHHU-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO CCc1cccc(C[N@H+]2CCc3ncc(C(F)(F)F)cc3C2)c1 ZINC001144324074 1050541429 /nfs/dbraw/zinc/54/14/29/1050541429.db2.gz WPCRFVKYULLHHU-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)sc1C ZINC001144377994 1050552622 /nfs/dbraw/zinc/55/26/22/1050552622.db2.gz OBERUORSDSEVDY-OAHLLOKOSA-N 1 2 308.397 4.375 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)sc1C ZINC001144377994 1050552634 /nfs/dbraw/zinc/55/26/34/1050552634.db2.gz OBERUORSDSEVDY-OAHLLOKOSA-N 1 2 308.397 4.375 20 0 DIADLO CCCCCC[C@@H](C)NC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000738920956 1050556465 /nfs/dbraw/zinc/55/64/65/1050556465.db2.gz YOYRPAFMOBFWEW-CYBMUJFWSA-N 1 2 302.422 4.123 20 0 DIADLO CCCCCC[C@H](C)NC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000738920957 1050556787 /nfs/dbraw/zinc/55/67/87/1050556787.db2.gz YOYRPAFMOBFWEW-ZDUSSCGKSA-N 1 2 302.422 4.123 20 0 DIADLO C[C@@H](SCCn1cc[nH+]c1)c1cccc(C(F)(F)F)c1 ZINC000594909079 1050559033 /nfs/dbraw/zinc/55/90/33/1050559033.db2.gz AGNUWKWEZAEMOH-LLVKDONJSA-N 1 2 300.349 4.396 20 0 DIADLO C[C@H](CC(=O)O[C@@H](C)c1cccc2ccccc21)n1cc[nH+]c1 ZINC000845280011 1050559565 /nfs/dbraw/zinc/55/95/65/1050559565.db2.gz ANILKHYSNWVWPA-CABCVRRESA-N 1 2 308.381 4.292 20 0 DIADLO CN(c1ccc(Nc2ccc(CO)cc2)c[nH+]1)C1CCCCC1 ZINC001212613994 1050574486 /nfs/dbraw/zinc/57/44/86/1050574486.db2.gz ARZFERKAZYYJBA-UHFFFAOYSA-N 1 2 311.429 4.086 20 0 DIADLO CN(c1ccc(Nc2cnccc2F)c[nH+]1)C1CCCCC1 ZINC001212613996 1050575045 /nfs/dbraw/zinc/57/50/45/1050575045.db2.gz ASVFVTFOSQSDCT-UHFFFAOYSA-N 1 2 300.381 4.128 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+](C)Cc2cnc(Cl)s2)c1 ZINC001144479541 1050593991 /nfs/dbraw/zinc/59/39/91/1050593991.db2.gz YAFMZNJOZYKZGY-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO FC(F)(F)Oc1cccnc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213086847 1050583999 /nfs/dbraw/zinc/58/39/99/1050583999.db2.gz CNTJUDKHBGCICL-UHFFFAOYSA-N 1 2 320.274 4.114 20 0 DIADLO COc1cc(F)c(F)cc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213089711 1050585077 /nfs/dbraw/zinc/58/50/77/1050585077.db2.gz ABVDFLQDTMAKOQ-UHFFFAOYSA-N 1 2 301.296 4.107 20 0 DIADLO Nc1cc(Cl)cc2ccn(-c3ccc(-c4[nH]cc[nH+]4)cc3)c21 ZINC001213091964 1050585857 /nfs/dbraw/zinc/58/58/57/1050585857.db2.gz UKOMLGKBKPQNJK-UHFFFAOYSA-N 1 2 308.772 4.256 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3ccc(-c4ccncn4)cc3)cc2)[nH]1 ZINC001213089785 1050586196 /nfs/dbraw/zinc/58/61/96/1050586196.db2.gz DPUIZBHBIGFVAV-UHFFFAOYSA-N 1 2 313.364 4.277 20 0 DIADLO COC(=O)c1cc(C)c(C)c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213091725 1050586620 /nfs/dbraw/zinc/58/66/20/1050586620.db2.gz ICRQGUKLPXMZJK-UHFFFAOYSA-N 1 2 321.380 4.224 20 0 DIADLO Cc1c(C)n(-c2ccc(-c3[nH]cc[nH+]3)cc2)c2c1cccc2N ZINC001213091822 1050586780 /nfs/dbraw/zinc/58/67/80/1050586780.db2.gz MTSMYBGZGIMDML-UHFFFAOYSA-N 1 2 302.381 4.220 20 0 DIADLO Cc1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc2snnc21 ZINC001213091052 1050587162 /nfs/dbraw/zinc/58/71/62/1050587162.db2.gz UALFYXPRXIIITG-UHFFFAOYSA-N 1 2 307.382 4.133 20 0 DIADLO O=C1CCCc2cc(Nc3cccc(-n4cc[nH+]c4)c3)ccc21 ZINC001213103959 1050590929 /nfs/dbraw/zinc/59/09/29/1050590929.db2.gz HEFBVTHGPHIGDH-UHFFFAOYSA-N 1 2 303.365 4.135 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)cc1F ZINC001144466575 1050592406 /nfs/dbraw/zinc/59/24/06/1050592406.db2.gz PBMROSSXVFLKJY-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)cc1F ZINC001144466575 1050592423 /nfs/dbraw/zinc/59/24/23/1050592423.db2.gz PBMROSSXVFLKJY-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(Cl)cc(C[N@H+](C)Cc2cnc(Cl)s2)c1 ZINC001144479541 1050593974 /nfs/dbraw/zinc/59/39/74/1050593974.db2.gz YAFMZNJOZYKZGY-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2cc(C(C)=O)no2)o1 ZINC000574886957 1050601455 /nfs/dbraw/zinc/60/14/55/1050601455.db2.gz AXNDBEBRCDGMTJ-SJCJKPOMSA-N 1 2 316.401 4.006 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2cc(C(C)=O)no2)o1 ZINC000574886957 1050601467 /nfs/dbraw/zinc/60/14/67/1050601467.db2.gz AXNDBEBRCDGMTJ-SJCJKPOMSA-N 1 2 316.401 4.006 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+]2CCC(=O)[C@H](C)C23CCCC3)c1 ZINC001144495193 1050602182 /nfs/dbraw/zinc/60/21/82/1050602182.db2.gz SCFJCGOYKMAMSV-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO COc1cc(Cl)cc(C[N@H+]2CCC(=O)[C@H](C)C23CCCC3)c1 ZINC001144495193 1050602194 /nfs/dbraw/zinc/60/21/94/1050602194.db2.gz SCFJCGOYKMAMSV-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2cc(C(C)=O)no2)o1 ZINC000574886956 1050602828 /nfs/dbraw/zinc/60/28/28/1050602828.db2.gz AXNDBEBRCDGMTJ-PXAZEXFGSA-N 1 2 316.401 4.006 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2cc(C(C)=O)no2)o1 ZINC000574886956 1050602834 /nfs/dbraw/zinc/60/28/34/1050602834.db2.gz AXNDBEBRCDGMTJ-PXAZEXFGSA-N 1 2 316.401 4.006 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c(F)cc(O)cc1F ZINC001144545104 1050609099 /nfs/dbraw/zinc/60/90/99/1050609099.db2.gz SCPTXTPKAIWKNX-SFHVURJKSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1c(F)cc(O)cc1F ZINC001144545104 1050609107 /nfs/dbraw/zinc/60/91/07/1050609107.db2.gz SCPTXTPKAIWKNX-SFHVURJKSA-N 1 2 303.352 4.316 20 0 DIADLO CCOc1ccc(Nc2c[nH+]ccc2OC)c(C(F)(F)F)c1 ZINC001213231950 1050613714 /nfs/dbraw/zinc/61/37/14/1050613714.db2.gz MGCWFMUUVQPGBB-UHFFFAOYSA-N 1 2 312.291 4.251 20 0 DIADLO FC(F)COc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1 ZINC001213301316 1050623965 /nfs/dbraw/zinc/62/39/65/1050623965.db2.gz HXDMPSNNNPHDRB-UHFFFAOYSA-N 1 2 319.355 4.069 20 0 DIADLO FC(F)COc1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)cc1 ZINC001213303048 1050624237 /nfs/dbraw/zinc/62/42/37/1050624237.db2.gz MZUNGVYQYHICDQ-UHFFFAOYSA-N 1 2 323.730 4.375 20 0 DIADLO C[C@@H]1C[C@H](C)[N@H+](Cn2nc(-c3ccccc3)sc2=S)C1 ZINC000740859022 1050631984 /nfs/dbraw/zinc/63/19/84/1050631984.db2.gz IHFRJNVGMIGQAH-NEPJUHHUSA-N 1 2 305.472 4.029 20 0 DIADLO C[C@@H]1C[C@H](C)[N@@H+](Cn2nc(-c3ccccc3)sc2=S)C1 ZINC000740859022 1050631993 /nfs/dbraw/zinc/63/19/93/1050631993.db2.gz IHFRJNVGMIGQAH-NEPJUHHUSA-N 1 2 305.472 4.029 20 0 DIADLO C[C@@H]1C[C@@H](C)[N@H+](Cn2nc(-c3ccccc3)sc2=S)C1 ZINC000740859025 1050632567 /nfs/dbraw/zinc/63/25/67/1050632567.db2.gz IHFRJNVGMIGQAH-VXGBXAGGSA-N 1 2 305.472 4.029 20 0 DIADLO C[C@@H]1C[C@@H](C)[N@@H+](Cn2nc(-c3ccccc3)sc2=S)C1 ZINC000740859025 1050632572 /nfs/dbraw/zinc/63/25/72/1050632572.db2.gz IHFRJNVGMIGQAH-VXGBXAGGSA-N 1 2 305.472 4.029 20 0 DIADLO Fc1ccccc1[C@H]1CCCC[N@@H+]1Cc1ncn2ccccc12 ZINC001144623523 1050632984 /nfs/dbraw/zinc/63/29/84/1050632984.db2.gz YGPPFGKNWRGIPE-GOSISDBHSA-N 1 2 309.388 4.201 20 0 DIADLO Fc1ccccc1[C@H]1CCCC[N@H+]1Cc1ncn2ccccc12 ZINC001144623523 1050632991 /nfs/dbraw/zinc/63/29/91/1050632991.db2.gz YGPPFGKNWRGIPE-GOSISDBHSA-N 1 2 309.388 4.201 20 0 DIADLO COc1cccc(C(F)(F)F)c1Nc1cc(OC)c(C)c[nH+]1 ZINC001213343201 1050635772 /nfs/dbraw/zinc/63/57/72/1050635772.db2.gz MBQALZFRVIZQAC-UHFFFAOYSA-N 1 2 312.291 4.170 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2cc(F)c(O)cc2F)c1 ZINC001144657901 1050641499 /nfs/dbraw/zinc/64/14/99/1050641499.db2.gz MLMUYYXJTSXKPJ-QGZVFWFLSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2cc(F)c(O)cc2F)c1 ZINC001144657901 1050641508 /nfs/dbraw/zinc/64/15/08/1050641508.db2.gz MLMUYYXJTSXKPJ-QGZVFWFLSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(F)c(O)cc1F ZINC001144667074 1050646928 /nfs/dbraw/zinc/64/69/28/1050646928.db2.gz RDJIUHIHZLAKKB-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1cc(F)c(O)cc1F ZINC001144667074 1050646938 /nfs/dbraw/zinc/64/69/38/1050646938.db2.gz RDJIUHIHZLAKKB-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)cc1F ZINC001144658198 1050648598 /nfs/dbraw/zinc/64/85/98/1050648598.db2.gz UIFBNWJREKBMDA-LLVKDONJSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@@H](c3ccccc3Cl)C2)cc1F ZINC001144658198 1050648614 /nfs/dbraw/zinc/64/86/14/1050648614.db2.gz UIFBNWJREKBMDA-LLVKDONJSA-N 1 2 323.770 4.313 20 0 DIADLO FC1CC[NH+](Cc2cc(Cl)cc(Br)c2)CC1 ZINC001144684732 1050658019 /nfs/dbraw/zinc/65/80/19/1050658019.db2.gz DBHWQJOFFKLGSS-UHFFFAOYSA-N 1 2 306.606 4.036 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)OCc1ccccc1Cl)c1ccccc1 ZINC000741149928 1050663240 /nfs/dbraw/zinc/66/32/40/1050663240.db2.gz WLTMIMNNYWWGPE-QGZVFWFLSA-N 1 2 317.816 4.076 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)OCc1ccccc1Cl)c1ccccc1 ZINC000741149928 1050663244 /nfs/dbraw/zinc/66/32/44/1050663244.db2.gz WLTMIMNNYWWGPE-QGZVFWFLSA-N 1 2 317.816 4.076 20 0 DIADLO FC(F)(F)c1ccc(C2([NH2+]Cc3coc(C4CC4)n3)CC2)cc1 ZINC000846107858 1050663385 /nfs/dbraw/zinc/66/33/85/1050663385.db2.gz TUHFNRABCRUUQN-UHFFFAOYSA-N 1 2 322.330 4.350 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnc(-c2ccc(O)cc2)nc1 ZINC001213494663 1050669276 /nfs/dbraw/zinc/66/92/76/1050669276.db2.gz DRQCHTXFJXUGBB-UHFFFAOYSA-N 1 2 318.380 4.174 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+]Cc1noc2c1CCCC2 ZINC000179744552 1050669725 /nfs/dbraw/zinc/66/97/25/1050669725.db2.gz JZFFJXDZRVMGKB-INIZCTEOSA-N 1 2 314.429 4.193 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(-c2cnn(C)c2)cc1 ZINC001213496928 1050672401 /nfs/dbraw/zinc/67/24/01/1050672401.db2.gz FFLDIOULWVOSCP-UHFFFAOYSA-N 1 2 304.397 4.412 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cccc(Cn2cccn2)c1 ZINC001213499044 1050672423 /nfs/dbraw/zinc/67/24/23/1050672423.db2.gz ABCPSBJAXVZXHP-UHFFFAOYSA-N 1 2 304.397 4.256 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(C(=O)NC(C)C)cc1 ZINC001213499636 1050672657 /nfs/dbraw/zinc/67/26/57/1050672657.db2.gz TVHOLYLBJVRFNM-UHFFFAOYSA-N 1 2 309.413 4.149 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1c(O)cccc1Br ZINC001213499487 1050672665 /nfs/dbraw/zinc/67/26/65/1050672665.db2.gz LHPJVCKEYYNLDG-UHFFFAOYSA-N 1 2 319.202 4.479 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2c(c1)NC(=O)CCC2 ZINC001213501357 1050673703 /nfs/dbraw/zinc/67/37/03/1050673703.db2.gz UQFSNPKUGSHFOM-UHFFFAOYSA-N 1 2 307.397 4.286 20 0 DIADLO COCCNc1cccc(F)c1Nc1cc(C2CC2)c[nH+]c1C ZINC001213503725 1050673724 /nfs/dbraw/zinc/67/37/24/1050673724.db2.gz UXSRPWNXMYDYNB-UHFFFAOYSA-N 1 2 315.392 4.208 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(-n2ccccc2=O)cc1 ZINC001213501280 1050673911 /nfs/dbraw/zinc/67/39/11/1050673911.db2.gz QMIUASYSKDURAA-UHFFFAOYSA-N 1 2 317.392 4.162 20 0 DIADLO CC(=O)c1cc(Nc2cc(C3CC3)c[nH+]c2C)cc(C(C)=O)c1 ZINC001213501134 1050674820 /nfs/dbraw/zinc/67/48/20/1050674820.db2.gz JMFZPDBMUAQFSE-UHFFFAOYSA-N 1 2 308.381 4.416 20 0 DIADLO COC(=O)[C@H](C)c1ccc(Nc2cc(C3CC3)c[nH+]c2C)cc1 ZINC001213503787 1050674890 /nfs/dbraw/zinc/67/48/90/1050674890.db2.gz YFUOBSZDYQNLMF-GFCCVEGCSA-N 1 2 310.397 4.288 20 0 DIADLO COCCOc1c(F)cccc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213503683 1050675080 /nfs/dbraw/zinc/67/50/80/1050675080.db2.gz SJCFYWLLGTZTRZ-UHFFFAOYSA-N 1 2 316.376 4.175 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cccc2c1CN(C1CC1)C2=O ZINC001213503541 1050675271 /nfs/dbraw/zinc/67/52/71/1050675271.db2.gz LNKUUCCRYODYPM-UHFFFAOYSA-N 1 2 319.408 4.129 20 0 DIADLO Cc1cc(C)c(Nc2cc(F)ccc2OC[C@@H]2CCCO2)c[nH+]1 ZINC001213513617 1050676269 /nfs/dbraw/zinc/67/62/69/1050676269.db2.gz ZMGCOTFQEQYJMV-HNNXBMFYSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1cc(C)c(Nc2ccc(OC[C@H]3CCCO3)c(F)c2)c[nH+]1 ZINC001213513298 1050677523 /nfs/dbraw/zinc/67/75/23/1050677523.db2.gz AEYNOGOWXYKFKJ-OAHLLOKOSA-N 1 2 316.376 4.139 20 0 DIADLO COc1ccccc1Cn1ncc(C)c1Nc1c[nH+]c(C)cc1C ZINC001213510965 1050677594 /nfs/dbraw/zinc/67/75/94/1050677594.db2.gz OQQARUUIPMONCN-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(Br)nc2Cl)c1C ZINC001213523605 1050678560 /nfs/dbraw/zinc/67/85/60/1050678560.db2.gz WEFJDQNQQQTPMS-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO COc1ccccc1Cn1nc(C)cc1Nc1c[nH+]cc(C)c1C ZINC001213523621 1050679339 /nfs/dbraw/zinc/67/93/39/1050679339.db2.gz XJIIOWDFWGLBME-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1c[nH+]cc(Nc2cnc(Cl)c(Br)c2)c1C ZINC001213523486 1050680508 /nfs/dbraw/zinc/68/05/08/1050680508.db2.gz UBTQJMYHFLBFNI-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO CNc1ccc(Br)cc1Nc1c[nH+]c(C)cc1C ZINC001213521142 1050680177 /nfs/dbraw/zinc/68/01/77/1050680177.db2.gz VYQPVXVDKIMJKK-UHFFFAOYSA-N 1 2 306.207 4.246 20 0 DIADLO Cc1c[nH+]cc(Nc2nc3cc(Br)ccc3o2)c1C ZINC001213523633 1050680362 /nfs/dbraw/zinc/68/03/62/1050680362.db2.gz YAAOHJCQIBOMFH-UHFFFAOYSA-N 1 2 318.174 4.346 20 0 DIADLO COc1cccc(C(=O)C(F)(F)F)c1Nc1c[nH+]cc(C)c1C ZINC001213536898 1050681559 /nfs/dbraw/zinc/68/15/59/1050681559.db2.gz RBIKADYROPOABL-UHFFFAOYSA-N 1 2 324.302 4.196 20 0 DIADLO COc1ccc(OC(F)(F)F)cc1Nc1c[nH+]cc(C)c1C ZINC001213532336 1050682005 /nfs/dbraw/zinc/68/20/05/1050682005.db2.gz CFTREUQJIXEQIX-UHFFFAOYSA-N 1 2 312.291 4.349 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(F)c(Br)c2O)c1C ZINC001213533996 1050682191 /nfs/dbraw/zinc/68/21/91/1050682191.db2.gz HETRJVGZKFQNKN-UHFFFAOYSA-N 1 2 311.154 4.049 20 0 DIADLO COc1cc(Br)cc(Nc2c[nH+]cc(C)c2C)c1 ZINC001213532349 1050682274 /nfs/dbraw/zinc/68/22/74/1050682274.db2.gz DDYRXCOYHSLDMZ-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO CC(=O)Nc1ccc(Nc2c[nH+]cc(C)c2C)cc1C(F)(F)F ZINC001213531086 1050682304 /nfs/dbraw/zinc/68/23/04/1050682304.db2.gz VCUKOZNXNVIEEB-UHFFFAOYSA-N 1 2 323.318 4.419 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(OC3CCOCC3)c(F)c2)c1C ZINC001213534312 1050682619 /nfs/dbraw/zinc/68/26/19/1050682619.db2.gz WMFLMHCNZCNDKG-UHFFFAOYSA-N 1 2 316.376 4.139 20 0 DIADLO COC(=O)c1cc(Nc2c[nH+]cc(C)c2C)c(F)cc1Cl ZINC001213534265 1050682717 /nfs/dbraw/zinc/68/27/17/1050682717.db2.gz UODXNWBTKMWGFC-UHFFFAOYSA-N 1 2 308.740 4.021 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1Nc1[nH+]cccc1C(C)C ZINC001213560700 1050684285 /nfs/dbraw/zinc/68/42/85/1050684285.db2.gz WAVXFNGSWLVYPR-UHFFFAOYSA-N 1 2 311.429 4.094 20 0 DIADLO COCc1ccc(C)c(Nc2cc(OC(F)(F)F)cc[nH+]2)c1 ZINC001213573996 1050686802 /nfs/dbraw/zinc/68/68/02/1050686802.db2.gz PPUYUIHVSMDKRH-UHFFFAOYSA-N 1 2 312.291 4.179 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2cnc(Cl)cn2)o1 ZINC000788480054 1050688422 /nfs/dbraw/zinc/68/84/22/1050688422.db2.gz GYBLEKVGVBNXOG-AWEZNQCLSA-N 1 2 305.809 4.149 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2cnc(Cl)cn2)o1 ZINC000788480054 1050688429 /nfs/dbraw/zinc/68/84/29/1050688429.db2.gz GYBLEKVGVBNXOG-AWEZNQCLSA-N 1 2 305.809 4.149 20 0 DIADLO c1cn(-c2ccc(Nc3ccccc3N3CCCC3)cc2)c[nH+]1 ZINC001213605798 1050692729 /nfs/dbraw/zinc/69/27/29/1050692729.db2.gz QJYKTFPWHBIUHD-UHFFFAOYSA-N 1 2 304.397 4.216 20 0 DIADLO c1ccc(N2CCCC2)c(Nc2[nH+]cccc2N2CCCC2)c1 ZINC001213605650 1050693358 /nfs/dbraw/zinc/69/33/58/1050693358.db2.gz JEBXMKRGSZFJKM-UHFFFAOYSA-N 1 2 308.429 4.026 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2ccc(OC)cc2Cl)c1 ZINC000846216841 1050696290 /nfs/dbraw/zinc/69/62/90/1050696290.db2.gz VZQDKHNTZLAADC-LLVKDONJSA-N 1 2 306.793 4.063 20 0 DIADLO c1csc([C@@H]2CCC[N@H+]2Cc2ccc3scnc3c2)n1 ZINC001144743286 1050700021 /nfs/dbraw/zinc/70/00/21/1050700021.db2.gz IBOQFWAIDNGKEJ-ZDUSSCGKSA-N 1 2 301.440 4.090 20 0 DIADLO c1csc([C@@H]2CCC[N@@H+]2Cc2ccc3scnc3c2)n1 ZINC001144743286 1050700030 /nfs/dbraw/zinc/70/00/30/1050700030.db2.gz IBOQFWAIDNGKEJ-ZDUSSCGKSA-N 1 2 301.440 4.090 20 0 DIADLO CCCN(CCC)C(=O)c1cccc(Nc2cccc(C)[nH+]2)c1 ZINC001213694886 1050721217 /nfs/dbraw/zinc/72/12/17/1050721217.db2.gz VISABOUATDMLFA-UHFFFAOYSA-N 1 2 311.429 4.396 20 0 DIADLO COC(=O)Cc1cccc(Nc2ccc3c(C)cc[nH+]c3c2)c1 ZINC001213718621 1050724302 /nfs/dbraw/zinc/72/43/02/1050724302.db2.gz PAIJHSTYNWMJHU-UHFFFAOYSA-N 1 2 306.365 4.002 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@@H+]1CC[C@@H](CC(C)(C)C)C1 ZINC001171229966 1050726474 /nfs/dbraw/zinc/72/64/74/1050726474.db2.gz LPLKZTXJICOTDK-BBRMVZONSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@H+]1CC[C@@H](CC(C)(C)C)C1 ZINC001171229966 1050726489 /nfs/dbraw/zinc/72/64/89/1050726489.db2.gz LPLKZTXJICOTDK-BBRMVZONSA-N 1 2 323.864 4.312 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H]1CCc2ccc(Cl)nc21 ZINC000788693041 1050727101 /nfs/dbraw/zinc/72/71/01/1050727101.db2.gz UJLOSRKBIRECRN-OAHLLOKOSA-N 1 2 301.821 4.209 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000741783896 1050738986 /nfs/dbraw/zinc/73/89/86/1050738986.db2.gz DHNWKQHIENWLQS-KDOFPFPSSA-N 1 2 314.429 4.037 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000741783896 1050738996 /nfs/dbraw/zinc/73/89/96/1050738996.db2.gz DHNWKQHIENWLQS-KDOFPFPSSA-N 1 2 314.429 4.037 20 0 DIADLO COc1ccc(C(C)C)cc1C[N@@H+]1CCC[C@@H]1c1cc(C)on1 ZINC000846765824 1050744262 /nfs/dbraw/zinc/74/42/62/1050744262.db2.gz DZYRANVIPIESFF-GOSISDBHSA-N 1 2 314.429 4.452 20 0 DIADLO COc1ccc(C(C)C)cc1C[N@H+]1CCC[C@@H]1c1cc(C)on1 ZINC000846765824 1050744270 /nfs/dbraw/zinc/74/42/70/1050744270.db2.gz DZYRANVIPIESFF-GOSISDBHSA-N 1 2 314.429 4.452 20 0 DIADLO Clc1ccc(/C=C/C[N@@H+]2CCO[C@H](c3ccco3)C2)cc1 ZINC000180165170 1050752103 /nfs/dbraw/zinc/75/21/03/1050752103.db2.gz PEYFCJAKEXIYLH-DUXHTMCSSA-N 1 2 303.789 4.020 20 0 DIADLO Clc1ccc(/C=C/C[N@H+]2CCO[C@H](c3ccco3)C2)cc1 ZINC000180165170 1050752119 /nfs/dbraw/zinc/75/21/19/1050752119.db2.gz PEYFCJAKEXIYLH-DUXHTMCSSA-N 1 2 303.789 4.020 20 0 DIADLO Fc1cc(C[N@@H+]2CCCCC[C@H]2c2ccncc2)cnc1Cl ZINC000846773482 1050754389 /nfs/dbraw/zinc/75/43/89/1050754389.db2.gz ZNZYLBNMUSPKHM-INIZCTEOSA-N 1 2 319.811 4.386 20 0 DIADLO Fc1cc(C[N@H+]2CCCCC[C@H]2c2ccncc2)cnc1Cl ZINC000846773482 1050754405 /nfs/dbraw/zinc/75/44/05/1050754405.db2.gz ZNZYLBNMUSPKHM-INIZCTEOSA-N 1 2 319.811 4.386 20 0 DIADLO Fc1cc(N2CCCCC2)ccc1Nc1cccc2[nH+]ccn21 ZINC001213835344 1050759632 /nfs/dbraw/zinc/75/96/32/1050759632.db2.gz RQGBOVANXMAGEH-UHFFFAOYSA-N 1 2 310.376 4.207 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(N4CCCCC4)cc3F)ccc21 ZINC001213841415 1050760922 /nfs/dbraw/zinc/76/09/22/1050760922.db2.gz JXDKRFSMLXNLPS-UHFFFAOYSA-N 1 2 324.403 4.446 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cnsn1)c1ccc(C(C)(C)C)cc1 ZINC000846815949 1050762964 /nfs/dbraw/zinc/76/29/64/1050762964.db2.gz BYMCWLMLBYBKOR-MRXNPFEDSA-N 1 2 303.475 4.323 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(Cl)c(F)c2)CC[C@@H]1C(F)(F)F ZINC000846870094 1050768403 /nfs/dbraw/zinc/76/84/03/1050768403.db2.gz AXECERDTWVHTHT-NSHDSACASA-N 1 2 324.749 4.285 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(Cl)c(F)c2)CC[C@@H]1C(F)(F)F ZINC000846870094 1050768415 /nfs/dbraw/zinc/76/84/15/1050768415.db2.gz AXECERDTWVHTHT-NSHDSACASA-N 1 2 324.749 4.285 20 0 DIADLO c1cc(N2CCCC2)ccc1[NH2+][C@@H]1CCCC[C@H]1[C@@H]1CCOC1 ZINC000788986671 1050771902 /nfs/dbraw/zinc/77/19/02/1050771902.db2.gz YPTBAIIFKSVNES-LSTHTHJFSA-N 1 2 314.473 4.294 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CCCC[C@H]1[C@@H]1CCOC1 ZINC000788986671 1050771921 /nfs/dbraw/zinc/77/19/21/1050771921.db2.gz YPTBAIIFKSVNES-LSTHTHJFSA-N 1 2 314.473 4.294 20 0 DIADLO CCOc1cc(Nc2ccc(CC(F)(F)F)nc2)cc(C)[nH+]1 ZINC001213911123 1050777658 /nfs/dbraw/zinc/77/76/58/1050777658.db2.gz FFLOXXHMARHWES-UHFFFAOYSA-N 1 2 311.307 4.032 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(CC(F)(F)F)nc2)cc1 ZINC001213922429 1050781125 /nfs/dbraw/zinc/78/11/25/1050781125.db2.gz GJTWMWUSZKKCRQ-UHFFFAOYSA-N 1 2 309.335 4.386 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(CC(F)(F)F)nc2)cc1 ZINC001213922429 1050781138 /nfs/dbraw/zinc/78/11/38/1050781138.db2.gz GJTWMWUSZKKCRQ-UHFFFAOYSA-N 1 2 309.335 4.386 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846936785 1050782563 /nfs/dbraw/zinc/78/25/63/1050782563.db2.gz NFKHTUJBUIMHCB-WCBMZHEXSA-N 1 2 310.722 4.037 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846936785 1050782578 /nfs/dbraw/zinc/78/25/78/1050782578.db2.gz NFKHTUJBUIMHCB-WCBMZHEXSA-N 1 2 310.722 4.037 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846936784 1050782711 /nfs/dbraw/zinc/78/27/11/1050782711.db2.gz NFKHTUJBUIMHCB-SCZZXKLOSA-N 1 2 310.722 4.037 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846936784 1050782723 /nfs/dbraw/zinc/78/27/23/1050782723.db2.gz NFKHTUJBUIMHCB-SCZZXKLOSA-N 1 2 310.722 4.037 20 0 DIADLO Cc1ccc(-c2ccc(Nc3[nH+]cccc3CCO)cc2)cc1 ZINC001213924920 1050783261 /nfs/dbraw/zinc/78/32/61/1050783261.db2.gz XOVYJIGJVNFYRU-UHFFFAOYSA-N 1 2 304.393 4.335 20 0 DIADLO Cl/C=C(\Cl)C[NH+]1CCC(c2ccc3cccnc3n2)CC1 ZINC000847034170 1050797319 /nfs/dbraw/zinc/79/73/19/1050797319.db2.gz LVAQYLSTQZEVEX-UVTDQMKNSA-N 1 2 322.239 4.128 20 0 DIADLO OCc1c(F)cc(Nc2cc[nH+]c3cc(Cl)ccc23)cc1F ZINC001214026954 1050800319 /nfs/dbraw/zinc/80/03/19/1050800319.db2.gz WJCUXJKTBGOZHO-UHFFFAOYSA-N 1 2 320.726 4.402 20 0 DIADLO Cc1ccc2c(Nc3cc(F)c(CO)c(F)c3)cccc2[nH+]1 ZINC001214037193 1050801757 /nfs/dbraw/zinc/80/17/57/1050801757.db2.gz OFHHMTFVHSIZDV-UHFFFAOYSA-N 1 2 300.308 4.057 20 0 DIADLO Cc1noc([C@@H](C)[N@H+](C)Cc2ccc3oc4ccccc4c3c2)n1 ZINC000847054325 1050806500 /nfs/dbraw/zinc/80/65/00/1050806500.db2.gz PXYASVWDLXRZHX-GFCCVEGCSA-N 1 2 321.380 4.470 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2ccc3oc4ccccc4c3c2)n1 ZINC000847054325 1050806504 /nfs/dbraw/zinc/80/65/04/1050806504.db2.gz PXYASVWDLXRZHX-GFCCVEGCSA-N 1 2 321.380 4.470 20 0 DIADLO CC[C@H](Cc1ccc(C)cc1)[N@H+](CC)Cn1ncsc1=S ZINC000742178658 1050811408 /nfs/dbraw/zinc/81/14/08/1050811408.db2.gz YQBQDLUSAQBWJD-OAHLLOKOSA-N 1 2 321.515 4.283 20 0 DIADLO CC[C@H](Cc1ccc(C)cc1)[N@@H+](CC)Cn1ncsc1=S ZINC000742178658 1050811422 /nfs/dbraw/zinc/81/14/22/1050811422.db2.gz YQBQDLUSAQBWJD-OAHLLOKOSA-N 1 2 321.515 4.283 20 0 DIADLO Clc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c(Cl)n1 ZINC001243083001 1050833219 /nfs/dbraw/zinc/83/32/19/1050833219.db2.gz CFEHQEQZGKKIPE-UHFFFAOYSA-N 1 2 304.180 4.300 20 0 DIADLO CCCC[C@@H]([NH2+][C@@H](C)c1cn[nH]c1C)c1ccc(OC)cc1 ZINC000180424643 1050834105 /nfs/dbraw/zinc/83/41/05/1050834105.db2.gz HJEGYCKPCVICIT-SCLBCKFNSA-N 1 2 301.434 4.309 20 0 DIADLO CC[C@@H](Cc1ccccc1)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000601945349 1050878446 /nfs/dbraw/zinc/87/84/46/1050878446.db2.gz JVAZGNIRWCNHSP-KRWDZBQOSA-N 1 2 319.408 4.080 20 0 DIADLO CCCc1ccc(-c2ccc(NC(=O)Cc3c[nH]c[nH+]3)cc2)cc1 ZINC001147594144 1050894006 /nfs/dbraw/zinc/89/40/06/1050894006.db2.gz SPBSFXLJKYTKKP-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)[C@H]2CCCCC2(C)C)n1 ZINC000789904095 1050896334 /nfs/dbraw/zinc/89/63/34/1050896334.db2.gz JNGXKPIDVXCWTE-CQSZACIVSA-N 1 2 323.506 4.140 20 0 DIADLO COCOc1cccc(F)c1Nc1ccc2c(C)cc[nH+]c2c1 ZINC001214443694 1050904819 /nfs/dbraw/zinc/90/48/19/1050904819.db2.gz ARJDFJHFDNQNCD-UHFFFAOYSA-N 1 2 312.344 4.409 20 0 DIADLO CCCCCC[C@@](C)(CCC)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000742675371 1050913493 /nfs/dbraw/zinc/91/34/93/1050913493.db2.gz BXIVYOVDGLNTJP-GOSISDBHSA-N 1 2 305.466 4.043 20 0 DIADLO CC(C)c1nnc(C[NH+]2CCC(c3cccc(F)c3)CC2)s1 ZINC000827990072 1050917515 /nfs/dbraw/zinc/91/75/15/1050917515.db2.gz BFTIUUZZLKJTDV-UHFFFAOYSA-N 1 2 319.449 4.180 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1C1CC1 ZINC001148470051 1050943667 /nfs/dbraw/zinc/94/36/67/1050943667.db2.gz HOCLHFBQZFHBPP-UHFFFAOYSA-N 1 2 303.365 4.002 20 0 DIADLO Oc1ccc(Cl)c(Nc2cccc(Cn3cc[nH+]c3)c2)c1F ZINC001214561376 1050944518 /nfs/dbraw/zinc/94/45/18/1050944518.db2.gz JATUUGFHDCTYSU-UHFFFAOYSA-N 1 2 317.751 4.173 20 0 DIADLO CC(C)Cc1ccccc1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000790343848 1050955681 /nfs/dbraw/zinc/95/56/81/1050955681.db2.gz FUQRLLQWEWXNQS-UHFFFAOYSA-N 1 2 319.408 4.323 20 0 DIADLO Cc1cc(NCc2ncc(C(C)(C)C)s2)ccc1[NH+](C)C ZINC000790473941 1050961136 /nfs/dbraw/zinc/96/11/36/1050961136.db2.gz ZAXQHZZYNNXMER-UHFFFAOYSA-N 1 2 303.475 4.427 20 0 DIADLO CCCC1CCC([N@H+](C)Cn2nc(C)n(C3CC3)c2=S)CC1 ZINC000790480350 1050963788 /nfs/dbraw/zinc/96/37/88/1050963788.db2.gz JVRZUQPLGZFVPE-UHFFFAOYSA-N 1 2 322.522 4.306 20 0 DIADLO CCCC1CCC([N@@H+](C)Cn2nc(C)n(C3CC3)c2=S)CC1 ZINC000790480350 1050963801 /nfs/dbraw/zinc/96/38/01/1050963801.db2.gz JVRZUQPLGZFVPE-UHFFFAOYSA-N 1 2 322.522 4.306 20 0 DIADLO OCc1c(Cl)cccc1Nc1cc[nH+]c2ccc(Cl)cc12 ZINC001214642867 1050969918 /nfs/dbraw/zinc/96/99/18/1050969918.db2.gz SUXLKSOSYDUSHT-UHFFFAOYSA-N 1 2 319.191 4.199 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccccc3CC(C)C)ccc2[nH+]1 ZINC000790561960 1050972737 /nfs/dbraw/zinc/97/27/37/1050972737.db2.gz SQUXCJBDOLDCKD-UHFFFAOYSA-N 1 2 307.397 4.094 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C ZINC000180921133 1051019929 /nfs/dbraw/zinc/01/99/29/1051019929.db2.gz ZAQYQBPFESIUMF-PNCBDVDHSA-N 1 2 303.837 4.419 20 0 DIADLO CCC[C@@]1(C)CCC[N@@H+](Cn2nc3n(c2=S)CCCCC3)C1 ZINC000743404952 1051025903 /nfs/dbraw/zinc/02/59/03/1051025903.db2.gz ZNDQSEZZSGJRQO-KRWDZBQOSA-N 1 2 322.522 4.000 20 0 DIADLO CCC[C@@]1(C)CCC[N@H+](Cn2nc(C3CC3)n(CC)c2=S)C1 ZINC000743404975 1051025763 /nfs/dbraw/zinc/02/57/63/1051025763.db2.gz ZSAWYUYFRGSBMP-KRWDZBQOSA-N 1 2 322.522 4.171 20 0 DIADLO CCC[C@@]1(C)CCC[N@@H+](Cn2nc(C3CC3)n(CC)c2=S)C1 ZINC000743404975 1051025768 /nfs/dbraw/zinc/02/57/68/1051025768.db2.gz ZSAWYUYFRGSBMP-KRWDZBQOSA-N 1 2 322.522 4.171 20 0 DIADLO CCC[C@@]1(C)CCC[N@H+](Cn2nc3n(c2=S)CCCCC3)C1 ZINC000743404952 1051025894 /nfs/dbraw/zinc/02/58/94/1051025894.db2.gz ZNDQSEZZSGJRQO-KRWDZBQOSA-N 1 2 322.522 4.000 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](c2cccc(F)c2)C(C)(C)C)n1 ZINC000181059689 1051049376 /nfs/dbraw/zinc/04/93/76/1051049376.db2.gz GGHHWAFNTFRABG-OAHLLOKOSA-N 1 2 305.397 4.209 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1COC(=O)[C@H](C)c1ccccc1 ZINC000791443610 1051049933 /nfs/dbraw/zinc/04/99/33/1051049933.db2.gz YIUMYSBUGLUGCZ-MRXNPFEDSA-N 1 2 320.392 4.028 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)nc(Cl)c1 ZINC000791583144 1051060188 /nfs/dbraw/zinc/06/01/88/1051060188.db2.gz LKWZZRANETYELB-IONNQARKSA-N 1 2 313.150 4.161 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(Cl)nc(Cl)c1 ZINC000791583144 1051060190 /nfs/dbraw/zinc/06/01/90/1051060190.db2.gz LKWZZRANETYELB-IONNQARKSA-N 1 2 313.150 4.161 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2ccnc(Cl)c2)c2ccccn2)cc1 ZINC000791641734 1051068171 /nfs/dbraw/zinc/06/81/71/1051068171.db2.gz WQQJIXKXHHEAIQ-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2cccc(Cl)n2)[C@@H]1c1ccccc1 ZINC000743850213 1051074631 /nfs/dbraw/zinc/07/46/31/1051074631.db2.gz PSSURGIRZWKHGA-GUYCJALGSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2cccc(Cl)n2)[C@@H]1c1ccccc1 ZINC000743850213 1051074643 /nfs/dbraw/zinc/07/46/43/1051074643.db2.gz PSSURGIRZWKHGA-GUYCJALGSA-N 1 2 318.873 4.414 20 0 DIADLO CC(C)Oc1ccc(F)c(Nc2cccc3[nH+]ccn32)c1F ZINC001215170162 1051098628 /nfs/dbraw/zinc/09/86/28/1051098628.db2.gz GZTJGDZAUBVWDI-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO Cc1ccc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)cc1C ZINC001215190632 1051109529 /nfs/dbraw/zinc/10/95/29/1051109529.db2.gz XMLMMQNJRPWDKV-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](C[C@@H]1CC1(Cl)Cl)C1CC1 ZINC000792322751 1051135130 /nfs/dbraw/zinc/13/51/30/1051135130.db2.gz KESHJLPQWHAPCD-VIFPVBQESA-N 1 2 306.183 4.123 20 0 DIADLO Fc1cccc(F)c1C[N@H+](C[C@@H]1CC1(Cl)Cl)C1CC1 ZINC000792322751 1051135125 /nfs/dbraw/zinc/13/51/25/1051135125.db2.gz KESHJLPQWHAPCD-VIFPVBQESA-N 1 2 306.183 4.123 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)nc1Cl ZINC001170232920 1051157428 /nfs/dbraw/zinc/15/74/28/1051157428.db2.gz PQGZIUGRLVCVKM-YPMHNXCESA-N 1 2 319.663 4.059 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)nc1Cl ZINC001170232920 1051157439 /nfs/dbraw/zinc/15/74/39/1051157439.db2.gz PQGZIUGRLVCVKM-YPMHNXCESA-N 1 2 319.663 4.059 20 0 DIADLO c1cn2ccc(NCc3nc(-c4ccccc4)cs3)cc2[nH+]1 ZINC001170245631 1051161925 /nfs/dbraw/zinc/16/19/25/1051161925.db2.gz NASFJXFBBHBFMR-UHFFFAOYSA-N 1 2 306.394 4.070 20 0 DIADLO CC(C)c1nnc(C[NH2+]C2(c3cccc(Cl)c3)CCCC2)o1 ZINC000181459107 1051163115 /nfs/dbraw/zinc/16/31/15/1051163115.db2.gz XNXDZSBKITVASA-UHFFFAOYSA-N 1 2 319.836 4.406 20 0 DIADLO ClC1=CCC[N@H+](Cc2ccccc2Oc2cccnc2)C1 ZINC001171659376 1051185632 /nfs/dbraw/zinc/18/56/32/1051185632.db2.gz PPRFEZIUZKNFDC-UHFFFAOYSA-N 1 2 300.789 4.202 20 0 DIADLO ClC1=CCC[N@@H+](Cc2ccccc2Oc2cccnc2)C1 ZINC001171659376 1051185642 /nfs/dbraw/zinc/18/56/42/1051185642.db2.gz PPRFEZIUZKNFDC-UHFFFAOYSA-N 1 2 300.789 4.202 20 0 DIADLO COc1ccc2cc(NC3CC(C)(C)OC(C)(C)C3)[nH+]cc2c1 ZINC001170359655 1051188960 /nfs/dbraw/zinc/18/89/60/1051188960.db2.gz LOXHRLJVGPDGHM-UHFFFAOYSA-N 1 2 314.429 4.392 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(Cl)n2)CCc2ccc(F)cc21 ZINC001171671391 1051191857 /nfs/dbraw/zinc/19/18/57/1051191857.db2.gz UVAFQZVNDFFUDQ-JTQLQIEISA-N 1 2 310.825 4.097 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(Cl)n2)CCc2ccc(F)cc21 ZINC001171671391 1051191865 /nfs/dbraw/zinc/19/18/65/1051191865.db2.gz UVAFQZVNDFFUDQ-JTQLQIEISA-N 1 2 310.825 4.097 20 0 DIADLO C[C@@H](c1noc(-c2ccccc2)n1)[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000792862166 1051217531 /nfs/dbraw/zinc/21/75/31/1051217531.db2.gz KKERTOZHCPJBFY-GJZGRUSLSA-N 1 2 319.408 4.417 20 0 DIADLO C[C@@H](c1noc(-c2ccccc2)n1)[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000792862166 1051217547 /nfs/dbraw/zinc/21/75/47/1051217547.db2.gz KKERTOZHCPJBFY-GJZGRUSLSA-N 1 2 319.408 4.417 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)OCc1cc(C)sc1C)c1ccccc1 ZINC000745097463 1051221599 /nfs/dbraw/zinc/22/15/99/1051221599.db2.gz DAZWBWSVMRIZCN-KRWDZBQOSA-N 1 2 317.454 4.101 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)OCc1cc(C)sc1C)c1ccccc1 ZINC000745097463 1051221610 /nfs/dbraw/zinc/22/16/10/1051221610.db2.gz DAZWBWSVMRIZCN-KRWDZBQOSA-N 1 2 317.454 4.101 20 0 DIADLO C[C@@H](OC(=O)[C@@H]1CCCC[N@@H+]1C)c1ccc(Cl)cc1Cl ZINC000745079694 1051222546 /nfs/dbraw/zinc/22/25/46/1051222546.db2.gz MOETZSPCGQSHQK-YGRLFVJLSA-N 1 2 316.228 4.082 20 0 DIADLO C[C@@H](OC(=O)[C@@H]1CCCC[N@H+]1C)c1ccc(Cl)cc1Cl ZINC000745079694 1051222558 /nfs/dbraw/zinc/22/25/58/1051222558.db2.gz MOETZSPCGQSHQK-YGRLFVJLSA-N 1 2 316.228 4.082 20 0 DIADLO CC(C)Oc1cc(Nc2ccc(N3CCCC3)[nH+]c2)ccc1F ZINC001215498191 1051222369 /nfs/dbraw/zinc/22/23/69/1051222369.db2.gz JQOFFDJIWLDFBC-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO C[C@H](OC(=O)[C@H]1CCCC[N@@H+]1C)c1ccc(Cl)cc1Cl ZINC000745079692 1051223117 /nfs/dbraw/zinc/22/31/17/1051223117.db2.gz MOETZSPCGQSHQK-IINYFYTJSA-N 1 2 316.228 4.082 20 0 DIADLO C[C@H](OC(=O)[C@H]1CCCC[N@H+]1C)c1ccc(Cl)cc1Cl ZINC000745079692 1051223127 /nfs/dbraw/zinc/22/31/27/1051223127.db2.gz MOETZSPCGQSHQK-IINYFYTJSA-N 1 2 316.228 4.082 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)O[C@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000745097880 1051223305 /nfs/dbraw/zinc/22/33/05/1051223305.db2.gz MJWREENURNAHOF-KDOFPFPSSA-N 1 2 315.388 4.123 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)O[C@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000745097880 1051223316 /nfs/dbraw/zinc/22/33/16/1051223316.db2.gz MJWREENURNAHOF-KDOFPFPSSA-N 1 2 315.388 4.123 20 0 DIADLO C[C@@]12CC[N@H+](Cc3csc(C4CC4)n3)C[C@@H]1C2(Cl)Cl ZINC000792899315 1051224724 /nfs/dbraw/zinc/22/47/24/1051224724.db2.gz DQFWQCKNWIAROW-WCQYABFASA-N 1 2 317.285 4.036 20 0 DIADLO C[C@@]12CC[N@@H+](Cc3csc(C4CC4)n3)C[C@@H]1C2(Cl)Cl ZINC000792899315 1051224731 /nfs/dbraw/zinc/22/47/31/1051224731.db2.gz DQFWQCKNWIAROW-WCQYABFASA-N 1 2 317.285 4.036 20 0 DIADLO Cc1cc(F)ccc1-c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001215516149 1051227568 /nfs/dbraw/zinc/22/75/68/1051227568.db2.gz SOPLFZUYTPUQMQ-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO COC(=O)[C@H](c1ccccc1F)[NH+]1CCC2(CCCCC2)CC1 ZINC001171834341 1051231359 /nfs/dbraw/zinc/23/13/59/1051231359.db2.gz NFGUVKNHBJFKCB-KRWDZBQOSA-N 1 2 319.420 4.086 20 0 DIADLO COCc1cc(C)c(Nc2ccc[nH+]c2N2CCCC2)c(C)c1 ZINC001215529581 1051232707 /nfs/dbraw/zinc/23/27/07/1051232707.db2.gz VTVUSOUOHGVNBQ-UHFFFAOYSA-N 1 2 311.429 4.189 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(C(F)(F)F)cc2O)[nH+]1 ZINC001212629151 1051232944 /nfs/dbraw/zinc/23/29/44/1051232944.db2.gz NJJLOVUBYGZFAV-UHFFFAOYSA-N 1 2 307.275 4.111 20 0 DIADLO CC[C@@H]1CCCC[C@H]1C(=O)Nc1nc(C[NH+](CC)CC)cs1 ZINC000793154766 1051254439 /nfs/dbraw/zinc/25/44/39/1051254439.db2.gz SPLYDZIZITXGGZ-UKRRQHHQSA-N 1 2 323.506 4.140 20 0 DIADLO Oc1cc(C(F)(F)F)ccc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001212632647 1051259157 /nfs/dbraw/zinc/25/91/57/1051259157.db2.gz NUDIHZSWPYTTNB-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO COCc1ccc(Cl)c(Nc2cccc3[nH+]c(C)cn32)c1 ZINC001215594619 1051262861 /nfs/dbraw/zinc/26/28/61/1051262861.db2.gz XKLZRWNCDOCODF-UHFFFAOYSA-N 1 2 301.777 4.186 20 0 DIADLO COc1c(Nc2ccc[nH+]c2N2CCCCC2)ccc(C)c1F ZINC001215599962 1051268974 /nfs/dbraw/zinc/26/89/74/1051268974.db2.gz QDECPYAZWYVCFC-UHFFFAOYSA-N 1 2 315.392 4.272 20 0 DIADLO OCc1c(F)ccc(Nc2cc[nH+]c3cc(Cl)ccc23)c1F ZINC001215649560 1051286659 /nfs/dbraw/zinc/28/66/59/1051286659.db2.gz IRVVORWOFBVARC-UHFFFAOYSA-N 1 2 320.726 4.402 20 0 DIADLO CSc1cc(Nc2cc(C(F)(F)F)ccc2CO)cc[nH+]1 ZINC001215683465 1051297441 /nfs/dbraw/zinc/29/74/41/1051297441.db2.gz IFSAUZDGZQSTSP-UHFFFAOYSA-N 1 2 314.332 4.058 20 0 DIADLO C[C@H](C(=O)Nc1ccc(C(C)(C)C)cc1)[N@H+](C)Cc1ccoc1 ZINC000745983479 1051303162 /nfs/dbraw/zinc/30/31/62/1051303162.db2.gz QXTFIFCIDVVCSW-CQSZACIVSA-N 1 2 314.429 4.036 20 0 DIADLO C[C@H](C(=O)Nc1ccc(C(C)(C)C)cc1)[N@@H+](C)Cc1ccoc1 ZINC000745983479 1051303171 /nfs/dbraw/zinc/30/31/71/1051303171.db2.gz QXTFIFCIDVVCSW-CQSZACIVSA-N 1 2 314.429 4.036 20 0 DIADLO C[C@@H](CCC(C)(C)C)[NH2+]c1ccc(N2CCC(O)CC2)cc1 ZINC000793546977 1051316053 /nfs/dbraw/zinc/31/60/53/1051316053.db2.gz PHLIDBFXDQUVQT-HNNXBMFYSA-N 1 2 304.478 4.274 20 0 DIADLO CC[N@H+](Cc1nc(C)c(C)o1)Cc1ccc(C(F)(F)F)cc1 ZINC000746137305 1051325746 /nfs/dbraw/zinc/32/57/46/1051325746.db2.gz CMRVUYXDWLVWOI-UHFFFAOYSA-N 1 2 312.335 4.332 20 0 DIADLO CC[N@@H+](Cc1nc(C)c(C)o1)Cc1ccc(C(F)(F)F)cc1 ZINC000746137305 1051325755 /nfs/dbraw/zinc/32/57/55/1051325755.db2.gz CMRVUYXDWLVWOI-UHFFFAOYSA-N 1 2 312.335 4.332 20 0 DIADLO Cc1cn2cccc(Nc3ccc(C4CCOCC4)cc3)c2[nH+]1 ZINC001212650321 1051337275 /nfs/dbraw/zinc/33/72/75/1051337275.db2.gz AHAFZERXUNMLLP-UHFFFAOYSA-N 1 2 307.397 4.280 20 0 DIADLO Cc1cccc(Oc2ccccc2NC(=O)CCc2c[nH]c[nH+]2)c1 ZINC000188432527 1051353526 /nfs/dbraw/zinc/35/35/26/1051353526.db2.gz SKCNYYDAFUGQBV-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1cccc(Oc2ccccc2NC(=O)CCc2c[nH+]c[nH]2)c1 ZINC000188432527 1051353531 /nfs/dbraw/zinc/35/35/31/1051353531.db2.gz SKCNYYDAFUGQBV-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1cccc(Oc2ccc(NC(=O)CCc3c[nH]c[nH+]3)cc2)c1 ZINC000188928097 1051357028 /nfs/dbraw/zinc/35/70/28/1051357028.db2.gz OYEVFJQTVWDMCM-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1cccc(Oc2ccc(NC(=O)CCc3c[nH+]c[nH]3)cc2)c1 ZINC000188928097 1051357042 /nfs/dbraw/zinc/35/70/42/1051357042.db2.gz OYEVFJQTVWDMCM-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1ccc(Oc2ccc(NC(=O)CCc3c[nH]c[nH+]3)cc2)cc1 ZINC000195007720 1051379686 /nfs/dbraw/zinc/37/96/86/1051379686.db2.gz HCRASPMVXIQBHA-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1ccc(Oc2ccc(NC(=O)CCc3c[nH+]c[nH]3)cc2)cc1 ZINC000195007720 1051379697 /nfs/dbraw/zinc/37/96/97/1051379697.db2.gz HCRASPMVXIQBHA-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO S=c1sc(C2CC2)nn1C[N@@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000746378944 1051387999 /nfs/dbraw/zinc/38/79/99/1051387999.db2.gz XRQYSECTDNWCSX-INIZCTEOSA-N 1 2 321.515 4.331 20 0 DIADLO S=c1sc(C2CC2)nn1C[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000746378944 1051388007 /nfs/dbraw/zinc/38/80/07/1051388007.db2.gz XRQYSECTDNWCSX-INIZCTEOSA-N 1 2 321.515 4.331 20 0 DIADLO Cc1nc([C@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)c(C)s1 ZINC000387275621 1051392149 /nfs/dbraw/zinc/39/21/49/1051392149.db2.gz ICUFMHIVLZMFMA-LBPRGKRZSA-N 1 2 316.474 4.318 20 0 DIADLO C[C@H](Nc1cc(N2CCCC2)nc[nH+]1)c1csc2ccccc12 ZINC000804439626 1051411106 /nfs/dbraw/zinc/41/11/06/1051411106.db2.gz YFWGTOOFXCHXQF-ZDUSSCGKSA-N 1 2 324.453 4.465 20 0 DIADLO C[C@H](Nc1cc(N2CCCC2)[nH+]cn1)c1csc2ccccc12 ZINC000804439626 1051411110 /nfs/dbraw/zinc/41/11/10/1051411110.db2.gz YFWGTOOFXCHXQF-ZDUSSCGKSA-N 1 2 324.453 4.465 20 0 DIADLO COC(=O)c1cc(Nc2c(C)cc[nH+]c2C(C)C)ccc1F ZINC001215853595 1051413802 /nfs/dbraw/zinc/41/38/02/1051413802.db2.gz IFFGVMPCKQHUHO-UHFFFAOYSA-N 1 2 302.349 4.183 20 0 DIADLO COC(=O)c1cc(Nc2ccc3c(C)cc[nH+]c3c2)ccc1F ZINC001215855589 1051416386 /nfs/dbraw/zinc/41/63/86/1051416386.db2.gz ZPPRFVUKJZZKIJ-UHFFFAOYSA-N 1 2 310.328 4.213 20 0 DIADLO Cc1ccccc1COc1ccc([C@@H](C)[NH2+]Cc2ccon2)cc1 ZINC000766420529 1051418274 /nfs/dbraw/zinc/41/82/74/1051418274.db2.gz RGVAEIFRFJDIPZ-MRXNPFEDSA-N 1 2 322.408 4.413 20 0 DIADLO C[C@H]([NH2+]Cc1ccon1)c1ccccc1OCc1ccccc1 ZINC000766418571 1051418561 /nfs/dbraw/zinc/41/85/61/1051418561.db2.gz HCAKHZADPSXCFR-HNNXBMFYSA-N 1 2 308.381 4.104 20 0 DIADLO Cc1nc(-c2cc([C@@H](C)[NH2+]Cc3ccon3)cs2)cs1 ZINC000766418713 1051418918 /nfs/dbraw/zinc/41/89/18/1051418918.db2.gz JYVLMDWDIYGCQM-SECBINFHSA-N 1 2 305.428 4.019 20 0 DIADLO C[N@H+](Cc1cccc(O)c1)Cc1cc2ccccc2nc1Cl ZINC000746457168 1051420596 /nfs/dbraw/zinc/42/05/96/1051420596.db2.gz JUPAPVYROYXEGE-UHFFFAOYSA-N 1 2 312.800 4.226 20 0 DIADLO C[N@@H+](Cc1cccc(O)c1)Cc1cc2ccccc2nc1Cl ZINC000746457168 1051420603 /nfs/dbraw/zinc/42/06/03/1051420603.db2.gz JUPAPVYROYXEGE-UHFFFAOYSA-N 1 2 312.800 4.226 20 0 DIADLO CNC(=O)c1ccc(Nc2c(C)cc[nH+]c2C(C)C)c(Cl)c1 ZINC001215882790 1051436692 /nfs/dbraw/zinc/43/66/92/1051436692.db2.gz UDVBNTKZIUJPSW-UHFFFAOYSA-N 1 2 317.820 4.270 20 0 DIADLO Cc1ccc(C(C)(C)Nc2cc(N)cc(C(F)(F)F)[nH+]2)cc1 ZINC001168799787 1051439758 /nfs/dbraw/zinc/43/97/58/1051439758.db2.gz FGUGVUXYVSLOIT-UHFFFAOYSA-N 1 2 309.335 4.338 20 0 DIADLO CSc1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)c(C)n1 ZINC001215908165 1051446132 /nfs/dbraw/zinc/44/61/32/1051446132.db2.gz HQXFSDVACBWUFU-UHFFFAOYSA-N 1 2 314.458 4.241 20 0 DIADLO Clc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c2c[nH]nc21 ZINC001215943702 1051473747 /nfs/dbraw/zinc/47/37/47/1051473747.db2.gz VQYDRAYXULYEMD-UHFFFAOYSA-N 1 2 323.787 4.205 20 0 DIADLO Fc1ncc(C2CC2)cc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001215955132 1051480421 /nfs/dbraw/zinc/48/04/21/1051480421.db2.gz MQVXURXHONZGIC-UHFFFAOYSA-N 1 2 312.392 4.227 20 0 DIADLO COc1ccc(NCCc2cn3ccccc3[nH+]2)c2ccccc12 ZINC001169003905 1051484668 /nfs/dbraw/zinc/48/46/68/1051484668.db2.gz KEKDYMKWKAZDES-UHFFFAOYSA-N 1 2 317.392 4.151 20 0 DIADLO c1c(CCNc2cccc(-c3cccnc3)c2)[nH+]c2ccccn12 ZINC001169003811 1051485551 /nfs/dbraw/zinc/48/55/51/1051485551.db2.gz HNAXFMSIMHYCLT-UHFFFAOYSA-N 1 2 314.392 4.051 20 0 DIADLO COCc1cc(OC)ccc1Nc1ccc2c(C)cc[nH+]c2c1 ZINC001215980907 1051500804 /nfs/dbraw/zinc/50/08/04/1051500804.db2.gz TZTADFPFEBZKJH-UHFFFAOYSA-N 1 2 308.381 4.442 20 0 DIADLO Cc1ccc(-c2ccccc2)cc1[N@H+]1C(=N)C=CC(Cl)=C1N ZINC001215987816 1051505495 /nfs/dbraw/zinc/50/54/95/1051505495.db2.gz IWLFKJLXDJYNJZ-UHFFFAOYSA-N 1 2 309.800 4.168 20 0 DIADLO Cc1ccc(-c2ccccc2)cc1[N@@H+]1C(=N)C=CC(Cl)=C1N ZINC001215987816 1051505506 /nfs/dbraw/zinc/50/55/06/1051505506.db2.gz IWLFKJLXDJYNJZ-UHFFFAOYSA-N 1 2 309.800 4.168 20 0 DIADLO COc1c(Cl)ccc(Nc2cccc(-n3cc[nH+]c3)c2)c1F ZINC001212584884 1051518308 /nfs/dbraw/zinc/51/83/08/1051518308.db2.gz FMCXVVGSCVVUER-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001172846081 1051533541 /nfs/dbraw/zinc/53/35/41/1051533541.db2.gz BLTOBGKCMNGRJH-VCTAVGKDSA-N 1 2 305.771 4.182 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001172846081 1051533555 /nfs/dbraw/zinc/53/35/55/1051533555.db2.gz BLTOBGKCMNGRJH-VCTAVGKDSA-N 1 2 305.771 4.182 20 0 DIADLO CSc1ncc(Nc2ccc(N3CCCC3)[nH+]c2)cc1Cl ZINC001216028378 1051533787 /nfs/dbraw/zinc/53/37/87/1051533787.db2.gz UXMAWNZDAYKXJS-UHFFFAOYSA-N 1 2 320.849 4.196 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001172846082 1051535183 /nfs/dbraw/zinc/53/51/83/1051535183.db2.gz BLTOBGKCMNGRJH-WKPIXPDZSA-N 1 2 305.771 4.182 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001172846082 1051535197 /nfs/dbraw/zinc/53/51/97/1051535197.db2.gz BLTOBGKCMNGRJH-WKPIXPDZSA-N 1 2 305.771 4.182 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1ccc(N)c(OC(F)(F)F)c1 ZINC001216031844 1051536780 /nfs/dbraw/zinc/53/67/80/1051536780.db2.gz KGIJODJSLCRKMW-UHFFFAOYSA-N 1 2 311.307 4.177 20 0 DIADLO Cc1cc(C)c(CNC(=O)C[C@H]2C[C@H](C)CC(C)(C)C2)c[nH+]1 ZINC001129842227 1051537286 /nfs/dbraw/zinc/53/72/86/1051537286.db2.gz VSCADMONJOZGOM-XJKSGUPXSA-N 1 2 302.462 4.167 20 0 DIADLO Cc1cc(C)c(CNC(=O)/C=C/c2ccc(C(C)(C)C)cc2)c[nH+]1 ZINC001129842198 1051537463 /nfs/dbraw/zinc/53/74/63/1051537463.db2.gz UVJROQNCFCNVBZ-DHZHZOJOSA-N 1 2 322.452 4.326 20 0 DIADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1ccccc1OC(F)F ZINC001169187603 1051541696 /nfs/dbraw/zinc/54/16/96/1051541696.db2.gz IWOMQBAPNJUPTF-ZDUSSCGKSA-N 1 2 319.351 4.071 20 0 DIADLO Cc1cc(CNC(=O)C[C@@H]2C[C@@H](C)c3c2cccc3C)cc(C)[nH+]1 ZINC001129858170 1051541667 /nfs/dbraw/zinc/54/16/67/1051541667.db2.gz IUIBFTONXYTDHK-KDOFPFPSSA-N 1 2 322.452 4.304 20 0 DIADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1ccccc1OC(F)F ZINC001169187603 1051541704 /nfs/dbraw/zinc/54/17/04/1051541704.db2.gz IWOMQBAPNJUPTF-ZDUSSCGKSA-N 1 2 319.351 4.071 20 0 DIADLO Cc1cc(CNC(=O)c2ccc(-c3ccccc3)s2)cc(C)[nH+]1 ZINC001129858741 1051542688 /nfs/dbraw/zinc/54/26/88/1051542688.db2.gz RIUXXVQMSLRUDN-UHFFFAOYSA-N 1 2 322.433 4.357 20 0 DIADLO Cc1cc(CNC(=O)C[C@H]2C[C@H](C)c3c2cccc3C)cc(C)[nH+]1 ZINC001129858169 1051542843 /nfs/dbraw/zinc/54/28/43/1051542843.db2.gz IUIBFTONXYTDHK-KBXCAEBGSA-N 1 2 322.452 4.304 20 0 DIADLO C/C(=C/c1ccc(Cl)cc1)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001129859170 1051542947 /nfs/dbraw/zinc/54/29/47/1051542947.db2.gz YLYMEIPCAZTIIF-WQLSENKSSA-N 1 2 314.816 4.072 20 0 DIADLO Clc1cccc2c(N3CC[C@H](c4ccccn4)C3)cc[nH+]c12 ZINC000804685422 1051547355 /nfs/dbraw/zinc/54/73/55/1051547355.db2.gz IHUZMLHVSIAEOW-ZDUSSCGKSA-N 1 2 309.800 4.277 20 0 DIADLO FC1(F)CCC[C@H](Nc2cccc(Cc3ccncc3)[nH+]2)C1 ZINC001169213513 1051550251 /nfs/dbraw/zinc/55/02/51/1051550251.db2.gz JTKGNLVQWOINDZ-HNNXBMFYSA-N 1 2 303.356 4.057 20 0 DIADLO FC1(F)CCC[C@H](Nc2cc[nH+]c(OCc3ccccn3)c2)C1 ZINC001169220977 1051556768 /nfs/dbraw/zinc/55/67/68/1051556768.db2.gz ZOWZVSZDMAWPGQ-AWEZNQCLSA-N 1 2 319.355 4.045 20 0 DIADLO Cc1ccccc1-c1nc(C[N@@H+](C)[C@@H]2CCc3ccccc32)no1 ZINC000178044431 1051557619 /nfs/dbraw/zinc/55/76/19/1051557619.db2.gz JKLWSPYYIXTYRT-GOSISDBHSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1ccccc1-c1nc(C[N@H+](C)[C@@H]2CCc3ccccc32)no1 ZINC000178044431 1051557629 /nfs/dbraw/zinc/55/76/29/1051557629.db2.gz JKLWSPYYIXTYRT-GOSISDBHSA-N 1 2 319.408 4.164 20 0 DIADLO COc1cc(Nc2cc(-c3ccccc3)cnc2F)[nH+]cc1C ZINC001216071179 1051561793 /nfs/dbraw/zinc/56/17/93/1051561793.db2.gz ANMIBNWPQYTIAL-UHFFFAOYSA-N 1 2 309.344 4.343 20 0 DIADLO CCCc1nc(C[N@H+](CC)[C@H](C)c2cccc(O)c2)cs1 ZINC000178373842 1051568649 /nfs/dbraw/zinc/56/86/49/1051568649.db2.gz KMGLPCKBAMZXSC-CYBMUJFWSA-N 1 2 304.459 4.384 20 0 DIADLO CCCc1nc(C[N@@H+](CC)[C@H](C)c2cccc(O)c2)cs1 ZINC000178373842 1051568663 /nfs/dbraw/zinc/56/86/63/1051568663.db2.gz KMGLPCKBAMZXSC-CYBMUJFWSA-N 1 2 304.459 4.384 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(N[C@@H](C2CCC2)C(F)(F)F)c1 ZINC001169286892 1051572948 /nfs/dbraw/zinc/57/29/48/1051572948.db2.gz ZOFIGCWDDYDKJH-HNNXBMFYSA-N 1 2 309.335 4.230 20 0 DIADLO Cc1cc(Nc2ccc(N3CCCC3)[nH+]c2)cc(Cl)c1O ZINC001216087079 1051573199 /nfs/dbraw/zinc/57/31/99/1051573199.db2.gz NHXJOPJYRFUIOE-UHFFFAOYSA-N 1 2 303.793 4.093 20 0 DIADLO FC(F)(F)c1cccc(Nc2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC001212693299 1051574180 /nfs/dbraw/zinc/57/41/80/1051574180.db2.gz NYZHORVYZUZNOL-UHFFFAOYSA-N 1 2 318.302 4.089 20 0 DIADLO CC1(C)C[C@H](CNc2[nH+]ccc3cccc(C(F)(F)F)c32)O1 ZINC001168451426 1051574095 /nfs/dbraw/zinc/57/40/95/1051574095.db2.gz MRGDTDBHZDMBSW-LLVKDONJSA-N 1 2 310.319 4.233 20 0 DIADLO CC(C)(C)Cc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)on1 ZINC001212692121 1051579785 /nfs/dbraw/zinc/57/97/85/1051579785.db2.gz BPHBMGPIGUOZGW-UHFFFAOYSA-N 1 2 310.401 4.252 20 0 DIADLO Fc1ccc2ncc(Nc3ccc(Cn4cc[nH+]c4)cc3)cc2c1 ZINC001212695216 1051582205 /nfs/dbraw/zinc/58/22/05/1051582205.db2.gz UDUNHYNXRFBKMN-UHFFFAOYSA-N 1 2 318.355 4.362 20 0 DIADLO S=c1[nH]ccn1C[N@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000766662629 1051582548 /nfs/dbraw/zinc/58/25/48/1051582548.db2.gz DPXWDIGINUEPOR-AWEZNQCLSA-N 1 2 307.850 4.010 20 0 DIADLO S=c1[nH]ccn1C[N@@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000766662629 1051582560 /nfs/dbraw/zinc/58/25/60/1051582560.db2.gz DPXWDIGINUEPOR-AWEZNQCLSA-N 1 2 307.850 4.010 20 0 DIADLO Cc1cc(C)nc(C[N@@H+](C)[C@@]2(c3ccccc3)CCCCC2=O)c1 ZINC001169331714 1051583123 /nfs/dbraw/zinc/58/31/23/1051583123.db2.gz LZBZRNYJYSEHHY-OAQYLSRUSA-N 1 2 322.452 4.169 20 0 DIADLO Cc1cc(C)nc(C[N@H+](C)[C@@]2(c3ccccc3)CCCCC2=O)c1 ZINC001169331714 1051583129 /nfs/dbraw/zinc/58/31/29/1051583129.db2.gz LZBZRNYJYSEHHY-OAQYLSRUSA-N 1 2 322.452 4.169 20 0 DIADLO Cc1cc(C)nc(C[N@@H+](C)[C@]2(c3ccccc3)CCCCC2=O)c1 ZINC001169331713 1051583966 /nfs/dbraw/zinc/58/39/66/1051583966.db2.gz LZBZRNYJYSEHHY-NRFANRHFSA-N 1 2 322.452 4.169 20 0 DIADLO Cc1cc(C)nc(C[N@H+](C)[C@]2(c3ccccc3)CCCCC2=O)c1 ZINC001169331713 1051583978 /nfs/dbraw/zinc/58/39/78/1051583978.db2.gz LZBZRNYJYSEHHY-NRFANRHFSA-N 1 2 322.452 4.169 20 0 DIADLO Nc1cc(Cl)cc2ccn(-c3ccc(Cn4cc[nH+]c4)cc3)c21 ZINC001212699915 1051589004 /nfs/dbraw/zinc/58/90/04/1051589004.db2.gz JSEDHSAXYJKQBV-UHFFFAOYSA-N 1 2 322.799 4.111 20 0 DIADLO CC1(C)C[C@H](CNc2ccc3c(c2)[nH+]cn3-c2ccccc2)O1 ZINC001168454854 1051588862 /nfs/dbraw/zinc/58/88/62/1051588862.db2.gz BVWKLQWJJJXXSI-MRXNPFEDSA-N 1 2 307.397 4.005 20 0 DIADLO Nc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)c(C(F)(F)F)c1 ZINC001216132144 1051595113 /nfs/dbraw/zinc/59/51/13/1051595113.db2.gz NDNKIPAXASTEFF-UHFFFAOYSA-N 1 2 318.302 4.217 20 0 DIADLO COc1c(C)[nH+]c(C2CC2)nc1N[C@H]1C[C@@H](C)c2ccccc21 ZINC001169374303 1051595584 /nfs/dbraw/zinc/59/55/84/1051595584.db2.gz JGBXPMKLOFMJPZ-BZNIZROVSA-N 1 2 309.413 4.331 20 0 DIADLO C[C@@H]([NH2+]C/C=C/c1ccc(Cl)cc1)c1nc(C(C)(C)C)no1 ZINC000179011573 1051597874 /nfs/dbraw/zinc/59/78/74/1051597874.db2.gz ATBYBKRTXCZPPJ-BTDICHCPSA-N 1 2 319.836 4.385 20 0 DIADLO COCCOc1cc(NCc2ccc(C)c3ccccc23)cc[nH+]1 ZINC001169417422 1051607275 /nfs/dbraw/zinc/60/72/75/1051607275.db2.gz LVGBBRBJLMISPP-UHFFFAOYSA-N 1 2 322.408 4.181 20 0 DIADLO Cc1ccc(CNc2ccc3c([nH+]2)CCOC3)c2ccccc12 ZINC001169414364 1051607333 /nfs/dbraw/zinc/60/73/33/1051607333.db2.gz VWFYFEKXQRHPFT-UHFFFAOYSA-N 1 2 304.393 4.228 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1cc(F)cc(N2CCCCC2)c1 ZINC001216180315 1051615967 /nfs/dbraw/zinc/61/59/67/1051615967.db2.gz IMCOJUFANNYCRS-UHFFFAOYSA-N 1 2 324.403 4.046 20 0 DIADLO COc1ncc(Nc2ccc(Oc3cc[nH+]c(C)c3)cc2)cc1O ZINC001216211069 1051628284 /nfs/dbraw/zinc/62/82/84/1051628284.db2.gz VFTXROBLDGTQMD-UHFFFAOYSA-N 1 2 323.352 4.035 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nnc(-c3ccccc3)s2)Cc2ccccc21 ZINC000766753206 1051645247 /nfs/dbraw/zinc/64/52/47/1051645247.db2.gz VTHPWKHKRWPBOH-CQSZACIVSA-N 1 2 321.449 4.324 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccccc3)s2)Cc2ccccc21 ZINC000766753206 1051645252 /nfs/dbraw/zinc/64/52/52/1051645252.db2.gz VTHPWKHKRWPBOH-CQSZACIVSA-N 1 2 321.449 4.324 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1ccc(OC(C)C)c(OC)c1 ZINC001216246446 1051651578 /nfs/dbraw/zinc/65/15/78/1051651578.db2.gz IFJROHILDNHRSX-UHFFFAOYSA-N 1 2 300.402 4.492 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(Cl)cc2Cl)c(N(C)C)[nH+]1 ZINC000152718833 1051652385 /nfs/dbraw/zinc/65/23/85/1051652385.db2.gz WFBWDUIZFICYLM-UHFFFAOYSA-N 1 2 324.211 4.015 20 0 DIADLO COc1cc(Nc2ccc(N3CCCC3)[nH+]c2)ccc1C1CC1 ZINC001216251139 1051656786 /nfs/dbraw/zinc/65/67/86/1051656786.db2.gz FWLLSJGKIWFPQK-UHFFFAOYSA-N 1 2 309.413 4.311 20 0 DIADLO CN(C)c1ccc(NC2(c3ccccc3C(F)(F)F)CC2)[nH+]c1 ZINC001169637462 1051663728 /nfs/dbraw/zinc/66/37/28/1051663728.db2.gz YKPVTIOILCCADT-UHFFFAOYSA-N 1 2 321.346 4.268 20 0 DIADLO CCCC[C@@H](CC(C)C)[N@@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001173262089 1051663769 /nfs/dbraw/zinc/66/37/69/1051663769.db2.gz RZDCCTMRPDIEKS-CVEARBPZSA-N 1 2 307.482 4.011 20 0 DIADLO CCCC[C@@H](CC(C)C)[N@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001173262089 1051663773 /nfs/dbraw/zinc/66/37/73/1051663773.db2.gz RZDCCTMRPDIEKS-CVEARBPZSA-N 1 2 307.482 4.011 20 0 DIADLO Clc1ccnc(Cl)c1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001216302649 1051685004 /nfs/dbraw/zinc/68/50/04/1051685004.db2.gz VXCDWLNHNHMLES-UHFFFAOYSA-N 1 2 305.168 4.318 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+](C)Cc2cccc3[nH]ccc32)n1 ZINC000494059007 1051685295 /nfs/dbraw/zinc/68/52/95/1051685295.db2.gz HJUQEQDRHYOYME-ZDUSSCGKSA-N 1 2 312.417 4.087 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+](C)Cc2cccc3[nH]ccc32)n1 ZINC000494059007 1051685307 /nfs/dbraw/zinc/68/53/07/1051685307.db2.gz HJUQEQDRHYOYME-ZDUSSCGKSA-N 1 2 312.417 4.087 20 0 DIADLO CC(C)c1nnc2n1CC[N@H+]([C@H]1CCCC3(CCCCC3)C1)C2 ZINC001173344329 1051704230 /nfs/dbraw/zinc/70/42/30/1051704230.db2.gz VESSATIILYZKKS-INIZCTEOSA-N 1 2 316.493 4.110 20 0 DIADLO CC(C)c1nnc2n1CC[N@@H+]([C@H]1CCCC3(CCCCC3)C1)C2 ZINC001173344329 1051704242 /nfs/dbraw/zinc/70/42/42/1051704242.db2.gz VESSATIILYZKKS-INIZCTEOSA-N 1 2 316.493 4.110 20 0 DIADLO CC(C)Cn1ncnc1C[NH2+][C@H](c1ccccc1Cl)C(C)C ZINC000183107198 1051708694 /nfs/dbraw/zinc/70/86/94/1051708694.db2.gz ONUOFEBPDBIOJP-KRWDZBQOSA-N 1 2 320.868 4.074 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]Cc2nc(Cl)ccc2Cl)cn1 ZINC000766890959 1051739033 /nfs/dbraw/zinc/73/90/33/1051739033.db2.gz ZNEWLGYMMCXJLS-JTQLQIEISA-N 1 2 313.232 4.017 20 0 DIADLO COc1c(F)ccc(Nc2ccc3c(C)cc[nH+]c3c2)c1OC ZINC001216395352 1051744372 /nfs/dbraw/zinc/74/43/72/1051744372.db2.gz RHCBDIMUVFEGRL-UHFFFAOYSA-N 1 2 312.344 4.443 20 0 DIADLO C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001173548351 1051748088 /nfs/dbraw/zinc/74/80/88/1051748088.db2.gz CGSUWJLFSLZOBV-FZQKWOKYSA-N 1 2 308.199 4.306 20 0 DIADLO C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001173548351 1051748101 /nfs/dbraw/zinc/74/81/01/1051748101.db2.gz CGSUWJLFSLZOBV-FZQKWOKYSA-N 1 2 308.199 4.306 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H]1CCc2nc(Cl)ccc21 ZINC000806151560 1051756969 /nfs/dbraw/zinc/75/69/69/1051756969.db2.gz IJLGXJAIHHJEPC-HNNXBMFYSA-N 1 2 301.821 4.209 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+][C@@H]2CC[C@@H]2C(C)(C)C)cc1 ZINC000806156462 1051758796 /nfs/dbraw/zinc/75/87/96/1051758796.db2.gz DDUSKZIKUCASRW-FHLIZLRMSA-N 1 2 302.462 4.148 20 0 DIADLO Cc1cc(NC[C@H](O)C(F)(F)F)[nH+]c2c1cccc2C(C)C ZINC000065202382 1051769084 /nfs/dbraw/zinc/76/90/84/1051769084.db2.gz UWJOMBKZGSGEOL-ZDUSSCGKSA-N 1 2 312.335 4.002 20 0 DIADLO CCSc1cccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000185560203 1051774578 /nfs/dbraw/zinc/77/45/78/1051774578.db2.gz NKPFMYKDXIANAR-LBPRGKRZSA-N 1 2 319.474 4.330 20 0 DIADLO CCOC(=O)/C=C/c1ccc(Nc2[nH+]cccc2C2CC2)cc1 ZINC001216475134 1051780123 /nfs/dbraw/zinc/78/01/23/1051780123.db2.gz IIEXTQOEKUVXFW-KPKJPENVSA-N 1 2 308.381 4.279 20 0 DIADLO CC(C)c1nn(C)c(Cl)c1C[NH2+]Cc1cscc1Cl ZINC000886199329 1051781907 /nfs/dbraw/zinc/78/19/07/1051781907.db2.gz RXEQJXFUOKIDPD-UHFFFAOYSA-N 1 2 318.273 4.202 20 0 DIADLO Cc1ccc(Nc2cc(Br)cn3cc[nH+]c23)cc1 ZINC001173802154 1051808937 /nfs/dbraw/zinc/80/89/37/1051808937.db2.gz MRFSAYFSTMYYJE-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1ccc(-c2ccn(C)n2)nc1 ZINC001216558927 1051818849 /nfs/dbraw/zinc/81/88/49/1051818849.db2.gz IFDRAZRDCSWGDA-UHFFFAOYSA-N 1 2 321.428 4.128 20 0 DIADLO COc1cc(Nc2cc(SC)cc(F)c2OC)cc(C)[nH+]1 ZINC001216581977 1051824270 /nfs/dbraw/zinc/82/42/70/1051824270.db2.gz SIXIPYGVYFAYSR-UHFFFAOYSA-N 1 2 308.378 4.012 20 0 DIADLO Fc1ccc(Nc2cc(Br)cn3cc[nH+]c23)cc1F ZINC001173864692 1051835570 /nfs/dbraw/zinc/83/55/70/1051835570.db2.gz SQTRQEOQSVDVGH-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO CC(C)Oc1ncc(Nc2cc[nH+]c3cc(Cl)ccc23)cn1 ZINC001216617343 1051839125 /nfs/dbraw/zinc/83/91/25/1051839125.db2.gz NCSGBDXGRPGXEH-UHFFFAOYSA-N 1 2 314.776 4.209 20 0 DIADLO Cc1ccc(CSc2nnc(-c3ccccc3C)n2C)c(C)[nH+]1 ZINC000187319611 1051842571 /nfs/dbraw/zinc/84/25/71/1051842571.db2.gz ATRLTZKCQIOOGU-UHFFFAOYSA-N 1 2 324.453 4.095 20 0 DIADLO Cc1cccc(C)c1-c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001216657527 1051853662 /nfs/dbraw/zinc/85/36/62/1051853662.db2.gz CMWLAPIXCFGXFV-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Cc1cccc(-c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)c1C ZINC001216658135 1051854450 /nfs/dbraw/zinc/85/44/50/1051854450.db2.gz SJWFMEWITZVZCE-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1ccn(C(=O)OC(C)(C)C)n1 ZINC001216673271 1051858924 /nfs/dbraw/zinc/85/89/24/1051858924.db2.gz VAFVWDMQLBHIJC-UHFFFAOYSA-N 1 2 316.405 4.237 20 0 DIADLO CN(C)c1cc(CSCc2ccccc2OC(F)F)cc[nH+]1 ZINC000767871164 1051860783 /nfs/dbraw/zinc/86/07/83/1051860783.db2.gz YMPURLMUXYARIT-UHFFFAOYSA-N 1 2 324.396 4.182 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccn(C(=O)OC(C)(C)C)n3)ccc12 ZINC001216678224 1051861484 /nfs/dbraw/zinc/86/14/84/1051861484.db2.gz SSCDWTCJLQMWLO-UHFFFAOYSA-N 1 2 324.384 4.267 20 0 DIADLO Fc1ccc(C[N@H+]2CC=C(c3ccccc3)CC2)c(F)c1F ZINC001137940343 1051872876 /nfs/dbraw/zinc/87/28/76/1051872876.db2.gz SVHLFXAMHZGMOM-UHFFFAOYSA-N 1 2 303.327 4.393 20 0 DIADLO Fc1ccc(C[N@@H+]2CC=C(c3ccccc3)CC2)c(F)c1F ZINC001137940343 1051872883 /nfs/dbraw/zinc/87/28/83/1051872883.db2.gz SVHLFXAMHZGMOM-UHFFFAOYSA-N 1 2 303.327 4.393 20 0 DIADLO Cc1nc2ccc(CNc3ccc(-n4cc[nH+]c4)cc3)cc2s1 ZINC000494365284 1051878197 /nfs/dbraw/zinc/87/81/97/1051878197.db2.gz FVICUROHFUARHH-UHFFFAOYSA-N 1 2 320.421 4.403 20 0 DIADLO COc1cccc(OC)c1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001173921551 1051880138 /nfs/dbraw/zinc/88/01/38/1051880138.db2.gz ILORAZNUGHYRCB-UHFFFAOYSA-N 1 2 312.413 4.438 20 0 DIADLO CCCc1csc(C[NH2+][C@H](C)c2cc(F)ccc2OC)n1 ZINC000494374209 1051885613 /nfs/dbraw/zinc/88/56/13/1051885613.db2.gz IWQWSIJRFHGKBY-LLVKDONJSA-N 1 2 308.422 4.094 20 0 DIADLO O[C@@H](C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1)c1c(F)cccc1F ZINC000746494847 1051885914 /nfs/dbraw/zinc/88/59/14/1051885914.db2.gz LWYHGCPITHWQNJ-HOTGVXAUSA-N 1 2 323.770 4.099 20 0 DIADLO O[C@@H](C[N@H+]1CC[C@H]1c1ccc(Cl)cc1)c1c(F)cccc1F ZINC000746494847 1051885919 /nfs/dbraw/zinc/88/59/19/1051885919.db2.gz LWYHGCPITHWQNJ-HOTGVXAUSA-N 1 2 323.770 4.099 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CC(C)(C)OC[C@@H]2C)cc1Cl ZINC001169986381 1051887682 /nfs/dbraw/zinc/88/76/82/1051887682.db2.gz SETYXQJYHODLKJ-ZDUSSCGKSA-N 1 2 311.853 4.127 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CC(C)(C)OC[C@@H]2C)cc1Cl ZINC001169986381 1051887694 /nfs/dbraw/zinc/88/76/94/1051887694.db2.gz SETYXQJYHODLKJ-ZDUSSCGKSA-N 1 2 311.853 4.127 20 0 DIADLO c1ccc(N2CCC(Nc3ccc(C4CCC4)cc3)CC2)[nH+]c1 ZINC000494500324 1051904965 /nfs/dbraw/zinc/90/49/65/1051904965.db2.gz DBPWWWKXMVUCQD-UHFFFAOYSA-N 1 2 307.441 4.430 20 0 DIADLO CCc1nn(C)c(Cl)c1C[N@H+](Cc1cccc(F)c1)C(C)C ZINC000768330039 1051917783 /nfs/dbraw/zinc/91/77/83/1051917783.db2.gz MOYXUWONBQUYNA-UHFFFAOYSA-N 1 2 323.843 4.186 20 0 DIADLO CCc1nn(C)c(Cl)c1C[N@@H+](Cc1cccc(F)c1)C(C)C ZINC000768330039 1051917794 /nfs/dbraw/zinc/91/77/94/1051917794.db2.gz MOYXUWONBQUYNA-UHFFFAOYSA-N 1 2 323.843 4.186 20 0 DIADLO CC(C)[N@H+](Cc1cccs1)Cc1c(Cl)nc(Cl)n1C ZINC000768334178 1051918891 /nfs/dbraw/zinc/91/88/91/1051918891.db2.gz MLAJHFFZJBPXDH-UHFFFAOYSA-N 1 2 318.273 4.199 20 0 DIADLO CC(C)[N@@H+](Cc1cccs1)Cc1c(Cl)nc(Cl)n1C ZINC000768334178 1051918893 /nfs/dbraw/zinc/91/88/93/1051918893.db2.gz MLAJHFFZJBPXDH-UHFFFAOYSA-N 1 2 318.273 4.199 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc3cc(F)ccc3o2)no1 ZINC000768428192 1051929627 /nfs/dbraw/zinc/92/96/27/1051929627.db2.gz FAIGVSHPVOSGCL-INIZCTEOSA-N 1 2 300.333 4.205 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc3cc(F)ccc3o2)no1 ZINC000768428192 1051929641 /nfs/dbraw/zinc/92/96/41/1051929641.db2.gz FAIGVSHPVOSGCL-INIZCTEOSA-N 1 2 300.333 4.205 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)n1 ZINC000190210340 1051940592 /nfs/dbraw/zinc/94/05/92/1051940592.db2.gz NOKORCHLQKSVKS-MNOVXSKESA-N 1 2 319.371 4.164 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)n1 ZINC000190210340 1051940600 /nfs/dbraw/zinc/94/06/00/1051940600.db2.gz NOKORCHLQKSVKS-MNOVXSKESA-N 1 2 319.371 4.164 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cnc(Cl)c(C)c2)o1 ZINC000768541252 1051940736 /nfs/dbraw/zinc/94/07/36/1051940736.db2.gz MANJQRVGPRQICK-HNNXBMFYSA-N 1 2 320.820 4.120 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cnc(Cl)c(C)c2)o1 ZINC000768541252 1051940740 /nfs/dbraw/zinc/94/07/40/1051940740.db2.gz MANJQRVGPRQICK-HNNXBMFYSA-N 1 2 320.820 4.120 20 0 DIADLO CC[N@H+](Cc1coc(C2CC2)n1)[C@@H](C)c1cccc(OC)c1 ZINC000768520129 1051943030 /nfs/dbraw/zinc/94/30/30/1051943030.db2.gz YZDZUTOSECBYAA-ZDUSSCGKSA-N 1 2 300.402 4.144 20 0 DIADLO CC[N@@H+](Cc1coc(C2CC2)n1)[C@@H](C)c1cccc(OC)c1 ZINC000768520129 1051943037 /nfs/dbraw/zinc/94/30/37/1051943037.db2.gz YZDZUTOSECBYAA-ZDUSSCGKSA-N 1 2 300.402 4.144 20 0 DIADLO COc1ncccc1Nc1ccc(Oc2cc[nH+]c(C)c2)cc1 ZINC001174043051 1051963761 /nfs/dbraw/zinc/96/37/61/1051963761.db2.gz LZOSPNYUNITJDB-UHFFFAOYSA-N 1 2 307.353 4.330 20 0 DIADLO Fc1ccc(COC2CC[NH+](C/C(Cl)=C\Cl)CC2)cc1 ZINC000768814123 1051968120 /nfs/dbraw/zinc/96/81/20/1051968120.db2.gz FKORGRRHDKQTPH-UKTHLTGXSA-N 1 2 318.219 4.126 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2cnn(C(C)(C)C)c2C)cs1 ZINC000191280911 1051968807 /nfs/dbraw/zinc/96/88/07/1051968807.db2.gz FNFCTSSMUZGGTA-NEPJUHHUSA-N 1 2 320.506 4.377 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cnn(C(C)(C)C)c2C)cs1 ZINC000191280893 1051968920 /nfs/dbraw/zinc/96/89/20/1051968920.db2.gz FNFCTSSMUZGGTA-VXGBXAGGSA-N 1 2 320.506 4.377 20 0 DIADLO CC(C)c1cc(N[C@@H](C)[C@H](O)c2ccccc2)nc(C(C)C)[nH+]1 ZINC000808129927 1051975885 /nfs/dbraw/zinc/97/58/85/1051975885.db2.gz HQXHJFSPTVWDFF-KSSFIOAISA-N 1 2 313.445 4.257 20 0 DIADLO CC[C@]1(C)CC(=O)N(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)C1 ZINC000808142664 1051980098 /nfs/dbraw/zinc/98/00/98/1051980098.db2.gz XQYDWZWKUWLYSO-FUHWJXTLSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@]1(C)CC(=O)N(C[N@H+]2CCC[C@H]2c2ccccc2Cl)C1 ZINC000808142664 1051980106 /nfs/dbraw/zinc/98/01/06/1051980106.db2.gz XQYDWZWKUWLYSO-FUHWJXTLSA-N 1 2 320.864 4.083 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(C3CC3)n2)CC[C@H]1C(F)(F)F ZINC000191662698 1051980369 /nfs/dbraw/zinc/98/03/69/1051980369.db2.gz GTNOZVLTFDDKTB-GFCCVEGCSA-N 1 2 318.408 4.431 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(C3CC3)n2)CC[C@H]1C(F)(F)F ZINC000191662698 1051980386 /nfs/dbraw/zinc/98/03/86/1051980386.db2.gz GTNOZVLTFDDKTB-GFCCVEGCSA-N 1 2 318.408 4.431 20 0 DIADLO CC[C@@]1(C)CC(=O)N(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC000808137751 1051980565 /nfs/dbraw/zinc/98/05/65/1051980565.db2.gz ARWVSSQCUSSTSE-AEFFLSMTSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@@]1(C)CC(=O)N(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC000808137751 1051980577 /nfs/dbraw/zinc/98/05/77/1051980577.db2.gz ARWVSSQCUSSTSE-AEFFLSMTSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@]1(C)CC(=O)N(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC000808137752 1051980686 /nfs/dbraw/zinc/98/06/86/1051980686.db2.gz ARWVSSQCUSSTSE-FUHWJXTLSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@]1(C)CC(=O)N(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC000808137752 1051980688 /nfs/dbraw/zinc/98/06/88/1051980688.db2.gz ARWVSSQCUSSTSE-FUHWJXTLSA-N 1 2 320.864 4.083 20 0 DIADLO Cc1ccc[nH+]c1Nc1ccc(C(=O)NCc2ccccc2)cc1 ZINC001174074662 1051995379 /nfs/dbraw/zinc/99/53/79/1051995379.db2.gz YTFZHMOPDMZWLV-UHFFFAOYSA-N 1 2 317.392 4.064 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)cs1 ZINC000494706540 1052000889 /nfs/dbraw/zinc/00/08/89/1052000889.db2.gz FSCFDIKZQPSWFK-QGZVFWFLSA-N 1 2 322.518 4.123 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC[C@@H](OCC3CC3)C2)cs1 ZINC000494706540 1052000902 /nfs/dbraw/zinc/00/09/02/1052000902.db2.gz FSCFDIKZQPSWFK-QGZVFWFLSA-N 1 2 322.518 4.123 20 0 DIADLO CCCCNC(=O)c1ccc(Nc2cc[nH+]c(SC)c2)cc1 ZINC001174122686 1052001802 /nfs/dbraw/zinc/00/18/02/1052001802.db2.gz QDNNUFAGBWNXIR-UHFFFAOYSA-N 1 2 315.442 4.077 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2cc(OC)ccc2Cl)cs1 ZINC000192182648 1052003857 /nfs/dbraw/zinc/00/38/57/1052003857.db2.gz WUCGCNIKFFUBOB-SNVBAGLBSA-N 1 2 310.850 4.218 20 0 DIADLO Cc1cc(OCc2nc(-c3ccsc3)no2)c2ccccc2[nH+]1 ZINC000192192467 1052006123 /nfs/dbraw/zinc/00/61/23/1052006123.db2.gz QGGLMCBPSNVFPZ-UHFFFAOYSA-N 1 2 323.377 4.234 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1ccc(C(=O)NC(C)C)cc1 ZINC001174148954 1052019885 /nfs/dbraw/zinc/01/98/85/1052019885.db2.gz PKQNVOROGUMMBX-UHFFFAOYSA-N 1 2 311.429 4.395 20 0 DIADLO CC[N@H+](Cc1ccc2c(c1)COC2)Cc1c(F)cccc1F ZINC000769300026 1052020367 /nfs/dbraw/zinc/02/03/67/1052020367.db2.gz URBJFNQTAMONSU-UHFFFAOYSA-N 1 2 303.352 4.017 20 0 DIADLO CC[N@@H+](Cc1ccc2c(c1)COC2)Cc1c(F)cccc1F ZINC000769300026 1052020377 /nfs/dbraw/zinc/02/03/77/1052020377.db2.gz URBJFNQTAMONSU-UHFFFAOYSA-N 1 2 303.352 4.017 20 0 DIADLO Cc1cc(C)c(NC(=O)CSc2ccccc2Cl)c(C)[nH+]1 ZINC000192837282 1052021057 /nfs/dbraw/zinc/02/10/57/1052021057.db2.gz DABQDWRDFXQGST-UHFFFAOYSA-N 1 2 320.845 4.391 20 0 DIADLO Cc1nc(-c2ccccc2)c(C(=O)Nc2cc[nH+]c(C)c2)s1 ZINC000192969070 1052024920 /nfs/dbraw/zinc/02/49/20/1052024920.db2.gz FQSXRHIMSAWKIW-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@@H+]1Cc1nc2ccccc2[nH]1 ZINC000769332419 1052026920 /nfs/dbraw/zinc/02/69/20/1052026920.db2.gz DEIBEVIRRBTICV-GOSISDBHSA-N 1 2 321.424 4.299 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1nc2ccccc2[nH]1 ZINC000769332419 1052026932 /nfs/dbraw/zinc/02/69/32/1052026932.db2.gz DEIBEVIRRBTICV-GOSISDBHSA-N 1 2 321.424 4.299 20 0 DIADLO CC(C)CCOC1CC[NH+](Cc2csc(C(C)(C)C)n2)CC1 ZINC000193116657 1052030063 /nfs/dbraw/zinc/03/00/63/1052030063.db2.gz QRXMTZLGNNNPDJ-UHFFFAOYSA-N 1 2 324.534 4.468 20 0 DIADLO Cc1cc[nH+]c(Nc2cccc(C(=O)NCc3ccccc3)c2)c1 ZINC001174181298 1052034837 /nfs/dbraw/zinc/03/48/37/1052034837.db2.gz GWUDYPILMSBDJB-UHFFFAOYSA-N 1 2 317.392 4.064 20 0 DIADLO Cc1ccc2c(Nc3cccc(C(=O)NC(C)C)c3)cccc2[nH+]1 ZINC001174187557 1052037797 /nfs/dbraw/zinc/03/77/97/1052037797.db2.gz DADBRWMSPHUHPE-UHFFFAOYSA-N 1 2 319.408 4.425 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1cccc(C(=O)NCC(C)C)c1 ZINC001174192347 1052042414 /nfs/dbraw/zinc/04/24/14/1052042414.db2.gz FFDWVEPPBBGUDD-UHFFFAOYSA-N 1 2 311.429 4.082 20 0 DIADLO Cc1ccc(Nc2cccc(C(=O)NC3CCCC3)c2)c(C)[nH+]1 ZINC001174195388 1052044316 /nfs/dbraw/zinc/04/43/16/1052044316.db2.gz NKFDVYAPTZITLJ-UHFFFAOYSA-N 1 2 309.413 4.114 20 0 DIADLO Cc1cc(C)c(Nc2cccc(C(=O)NC3CCCC3)c2)c[nH+]1 ZINC001174196095 1052044454 /nfs/dbraw/zinc/04/44/54/1052044454.db2.gz VHDJGQHUEHEZKE-UHFFFAOYSA-N 1 2 309.413 4.114 20 0 DIADLO CCc1cccc(Nc2cccc(C(=O)N3CCC(C)CC3)c2)[nH+]1 ZINC001174204352 1052046957 /nfs/dbraw/zinc/04/69/57/1052046957.db2.gz RKRVEENIYQJBMC-UHFFFAOYSA-N 1 2 323.440 4.260 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(Cl)nc3ccccn32)[C@H]1c1ccccc1 ZINC000769540385 1052066053 /nfs/dbraw/zinc/06/60/53/1052066053.db2.gz OEPGEKCPWCVWEQ-CXAGYDPISA-N 1 2 311.816 4.181 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(Cl)nc3ccccn32)[C@H]1c1ccccc1 ZINC000769540385 1052066061 /nfs/dbraw/zinc/06/60/61/1052066061.db2.gz OEPGEKCPWCVWEQ-CXAGYDPISA-N 1 2 311.816 4.181 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ccc(CSC(F)F)o2)n1 ZINC000769479243 1052066611 /nfs/dbraw/zinc/06/66/11/1052066611.db2.gz GJHQMXWZUVJAIF-UHFFFAOYSA-N 1 2 312.385 4.071 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ccc(CSC(F)F)o2)n1 ZINC000769479243 1052066624 /nfs/dbraw/zinc/06/66/24/1052066624.db2.gz GJHQMXWZUVJAIF-UHFFFAOYSA-N 1 2 312.385 4.071 20 0 DIADLO COc1cccc2cc(C[N@@H+]3CCOC[C@@H]3c3ccccc3)oc21 ZINC000769502894 1052070045 /nfs/dbraw/zinc/07/00/45/1052070045.db2.gz DVZVHZKJPFNWFS-GOSISDBHSA-N 1 2 323.392 4.015 20 0 DIADLO COc1cccc2cc(C[N@H+]3CCOC[C@@H]3c3ccccc3)oc21 ZINC000769502894 1052070059 /nfs/dbraw/zinc/07/00/59/1052070059.db2.gz DVZVHZKJPFNWFS-GOSISDBHSA-N 1 2 323.392 4.015 20 0 DIADLO COc1ccc2c(c1F)CC[C@H]2Nc1ccc([NH+](C)C)cc1C ZINC000808710212 1052070996 /nfs/dbraw/zinc/07/09/96/1052070996.db2.gz MVDXKYIYUWYDNE-QGZVFWFLSA-N 1 2 314.404 4.308 20 0 DIADLO COc1ccc2c(c1F)CC[C@@H]2Nc1ccc([NH+](C)C)c(C)c1 ZINC000808712334 1052073554 /nfs/dbraw/zinc/07/35/54/1052073554.db2.gz CUKIXYDTVCJZRN-INIZCTEOSA-N 1 2 314.404 4.308 20 0 DIADLO C[C@@H]1C[N@H+](Cc2occc2Br)[C@@H]1c1ccccc1 ZINC000769541951 1052078858 /nfs/dbraw/zinc/07/88/58/1052078858.db2.gz XIODTTMOZXBDLI-ABAIWWIYSA-N 1 2 306.203 4.235 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2occc2Br)[C@@H]1c1ccccc1 ZINC000769541951 1052078866 /nfs/dbraw/zinc/07/88/66/1052078866.db2.gz XIODTTMOZXBDLI-ABAIWWIYSA-N 1 2 306.203 4.235 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](COC)c2ccc(Cl)cc2)cs1 ZINC000194037207 1052091325 /nfs/dbraw/zinc/09/13/25/1052091325.db2.gz AZGDGAIXVBBPSB-RISCZKNCSA-N 1 2 324.877 4.397 20 0 DIADLO FC(F)(F)c1ccc(Nc2ccc[nH+]c2N2CCCCC2)cn1 ZINC001174310818 1052092321 /nfs/dbraw/zinc/09/23/21/1052092321.db2.gz HIJKUOPAGLBSMK-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO Nc1ccc[nH+]c1Nc1ccc(OCc2ccc(F)cc2)cc1 ZINC001174317302 1052097300 /nfs/dbraw/zinc/09/73/00/1052097300.db2.gz OBSAZRVEZQNDNB-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO CCN(C)C(=O)c1ccc(Nc2c(C)cc[nH+]c2C(C)C)cc1 ZINC001174320957 1052098530 /nfs/dbraw/zinc/09/85/30/1052098530.db2.gz RWDUXMAUQKGLPW-UHFFFAOYSA-N 1 2 311.429 4.349 20 0 DIADLO NC(Cc1cccs1)=[NH+]OCC1CCC(C(F)(F)F)CC1 ZINC000769830520 1052116129 /nfs/dbraw/zinc/11/61/29/1052116129.db2.gz PKNIRAZADXXXDK-UHFFFAOYSA-N 1 2 320.380 4.158 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1C[C@@H](C)OC2(CCCCC2)C1 ZINC000653905835 1052119257 /nfs/dbraw/zinc/11/92/57/1052119257.db2.gz JIHZYZCDFPAGEO-HUUCEWRRSA-N 1 2 320.477 4.457 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1C[C@@H](C)OC2(CCCCC2)C1 ZINC000653905835 1052119262 /nfs/dbraw/zinc/11/92/62/1052119262.db2.gz JIHZYZCDFPAGEO-HUUCEWRRSA-N 1 2 320.477 4.457 20 0 DIADLO COc1cccc2cc([C@H](C)[NH2+]Cc3ncc(Cl)s3)oc21 ZINC000769908073 1052120567 /nfs/dbraw/zinc/12/05/67/1052120567.db2.gz IDGXBUOFSKZMJW-VIFPVBQESA-N 1 2 322.817 4.402 20 0 DIADLO CC(C)c1ccc(-c2nnc([C@H]3[NH2+]CCc4ccccc43)o2)cc1 ZINC001217724566 1052126772 /nfs/dbraw/zinc/12/67/72/1052126772.db2.gz RFUVVPQGVRAMFS-SFHVURJKSA-N 1 2 319.408 4.095 20 0 DIADLO Cc1cc(NCCC(=O)c2ccccc2)nc(-c2ccccc2)[nH+]1 ZINC001170011933 1052133914 /nfs/dbraw/zinc/13/39/14/1052133914.db2.gz KZHOCMUSMQAHHD-UHFFFAOYSA-N 1 2 317.392 4.137 20 0 DIADLO COc1cccc(OC)c1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174380967 1052138530 /nfs/dbraw/zinc/13/85/30/1052138530.db2.gz CMNGDESYOQJZQN-UHFFFAOYSA-N 1 2 311.385 4.378 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3c(Cl)cncc3Cl)ccc21 ZINC001174380364 1052138776 /nfs/dbraw/zinc/13/87/76/1052138776.db2.gz CGBGFNXWIFHJAY-UHFFFAOYSA-N 1 2 321.211 4.485 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ncc(Cl)nc3Cl)ccc21 ZINC001174380394 1052139114 /nfs/dbraw/zinc/13/91/14/1052139114.db2.gz FCTRMOVZAXCRJP-UHFFFAOYSA-N 1 2 322.199 4.458 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cnc(Cl)nc3Cl)ccc21 ZINC001174381445 1052140400 /nfs/dbraw/zinc/14/04/00/1052140400.db2.gz HBIVNMHSLNYQJT-UHFFFAOYSA-N 1 2 322.199 4.458 20 0 DIADLO COC(=O)c1cscc1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174381552 1052140608 /nfs/dbraw/zinc/14/06/08/1052140608.db2.gz KEOVIXDYWMZCQU-UHFFFAOYSA-N 1 2 315.398 4.209 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(c3)NC(=O)CC4)ccc21 ZINC001174381933 1052140688 /nfs/dbraw/zinc/14/06/88/1052140688.db2.gz WSSZHXPNGXDVEX-UHFFFAOYSA-N 1 2 320.396 4.246 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(Cl)c[nH]c3=O)ccc21 ZINC001174381823 1052141101 /nfs/dbraw/zinc/14/11/01/1052141101.db2.gz PVXRINQNLKSTOP-UHFFFAOYSA-N 1 2 302.765 4.115 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cncc(C(F)(F)F)n3)ccc21 ZINC001174381828 1052141323 /nfs/dbraw/zinc/14/13/23/1052141323.db2.gz PZGZZBRCQULPGF-UHFFFAOYSA-N 1 2 321.306 4.170 20 0 DIADLO COc1ncc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cc1Cl ZINC001174381517 1052141397 /nfs/dbraw/zinc/14/13/97/1052141397.db2.gz JGJZSLIUELKTBP-UHFFFAOYSA-N 1 2 316.792 4.418 20 0 DIADLO CC(C)n1c[nH+]c2cc(N(c3ccc(N)cn3)C3CCC3)ccc21 ZINC001174382172 1052141621 /nfs/dbraw/zinc/14/16/21/1052141621.db2.gz CBCLHCKYNPNWHN-UHFFFAOYSA-N 1 2 321.428 4.285 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4cncnc4c3)ccc21 ZINC001174384403 1052142743 /nfs/dbraw/zinc/14/27/43/1052142743.db2.gz VQRWXIUWRDJLAF-UHFFFAOYSA-N 1 2 303.369 4.304 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4snnc43)ccc21 ZINC001174384026 1052142950 /nfs/dbraw/zinc/14/29/50/1052142950.db2.gz CVPAIVTZOMWUNP-UHFFFAOYSA-N 1 2 309.398 4.366 20 0 DIADLO CC(=O)c1cc(Nc2ccc3c(c2)[nH+]cn3C(C)C)ccc1O ZINC001174382974 1052143043 /nfs/dbraw/zinc/14/30/43/1052143043.db2.gz GIVJANWCHFABTC-UHFFFAOYSA-N 1 2 309.369 4.269 20 0 DIADLO COc1cc(Cl)cnc1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174382355 1052143778 /nfs/dbraw/zinc/14/37/78/1052143778.db2.gz LPDIOYNAJBTHIT-UHFFFAOYSA-N 1 2 316.792 4.418 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4nnsc43)ccc21 ZINC001174385678 1052145177 /nfs/dbraw/zinc/14/51/77/1052145177.db2.gz TZGAAWSJKHEKMB-UHFFFAOYSA-N 1 2 309.398 4.366 20 0 DIADLO Cc1ccccc1[C@H](O[C@@H]1C[NH2+]CC(F)(F)C1)c1ccccc1 ZINC001217855174 1052156662 /nfs/dbraw/zinc/15/66/62/1052156662.db2.gz KRLZNRPEUNTHJW-FUHWJXTLSA-N 1 2 317.379 4.098 20 0 DIADLO c1n[nH]c([C@H]([NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)C2CCCCC2)n1 ZINC000494885563 1052160609 /nfs/dbraw/zinc/16/06/09/1052160609.db2.gz HYDYNZMDDNAEQJ-VDHUWJSZSA-N 1 2 316.493 4.375 20 0 DIADLO c1cc2c([nH]1)[nH+]ccc2Nc1ccc(Oc2cccnc2)cc1 ZINC001174411099 1052164185 /nfs/dbraw/zinc/16/41/85/1052164185.db2.gz JHJIRXKDCKIGNW-UHFFFAOYSA-N 1 2 302.337 4.445 20 0 DIADLO Fc1cc(Nc2cc[nH+]c3[nH]ccc32)ccc1Br ZINC001174411206 1052164298 /nfs/dbraw/zinc/16/42/98/1052164298.db2.gz OXKMEJJUUMIINC-UHFFFAOYSA-N 1 2 306.138 4.160 20 0 DIADLO CC(C)(C)OC(=O)c1cccc(Nc2cc[nH+]c3[nH]ccc32)c1 ZINC001174412618 1052165286 /nfs/dbraw/zinc/16/52/86/1052165286.db2.gz WPZHNJXLZYZSQX-UHFFFAOYSA-N 1 2 309.369 4.213 20 0 DIADLO CCSc1nn(C[N@H+](C)[C@H](C)C(C)(C)C)c(=S)s1 ZINC000914568994 1052169580 /nfs/dbraw/zinc/16/95/80/1052169580.db2.gz RAXXWNLPDIJMMI-SECBINFHSA-N 1 2 305.538 4.110 20 0 DIADLO CCSc1nn(C[N@@H+](C)[C@H](C)C(C)(C)C)c(=S)s1 ZINC000914568994 1052169584 /nfs/dbraw/zinc/16/95/84/1052169584.db2.gz RAXXWNLPDIJMMI-SECBINFHSA-N 1 2 305.538 4.110 20 0 DIADLO C[C@H]([N@H+](C)Cn1nc(-c2ccccc2)oc1=S)C(C)(C)C ZINC000914568406 1052169810 /nfs/dbraw/zinc/16/98/10/1052169810.db2.gz HNDKSYHGWYUZNL-LBPRGKRZSA-N 1 2 305.447 4.196 20 0 DIADLO C[C@H]([N@@H+](C)Cn1nc(-c2ccccc2)oc1=S)C(C)(C)C ZINC000914568406 1052169816 /nfs/dbraw/zinc/16/98/16/1052169816.db2.gz HNDKSYHGWYUZNL-LBPRGKRZSA-N 1 2 305.447 4.196 20 0 DIADLO c1n[nH]c([C@@H]([NH2+]CC2(Cc3ccccc3)CC2)C2CCCCC2)n1 ZINC000495081096 1052212876 /nfs/dbraw/zinc/21/28/76/1052212876.db2.gz SQHFSOMYHXPAGF-SFHVURJKSA-N 1 2 324.472 4.039 20 0 DIADLO Oc1cccc(C[NH2+][C@@H](c2cccc(Cl)c2)c2ccccn2)c1 ZINC000153306743 1052214090 /nfs/dbraw/zinc/21/40/90/1052214090.db2.gz BDRSLPMVJMMXOY-IBGZPJMESA-N 1 2 324.811 4.320 20 0 DIADLO Cc1cc(-c2ccccc2)ccc1O[C@H]1C[NH2+]CC(F)(F)C1 ZINC001218277294 1052216246 /nfs/dbraw/zinc/21/62/46/1052216246.db2.gz FJODMJDMFMDPPQ-MRXNPFEDSA-N 1 2 303.352 4.038 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@H](C)Cc2cccs2)c(C)[nH+]1 ZINC001219009598 1052267569 /nfs/dbraw/zinc/26/75/69/1052267569.db2.gz GSUKBXWQDJFSDL-CYBMUJFWSA-N 1 2 317.458 4.163 20 0 DIADLO CCC1CCC(CNC(=O)Nc2c(C)cc(C)[nH+]c2C)CC1 ZINC001219010063 1052267704 /nfs/dbraw/zinc/26/77/04/1052267704.db2.gz YNWQKDITWASPIY-UHFFFAOYSA-N 1 2 303.450 4.345 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC2CCC3(CC3)CC2)c(C)[nH+]1 ZINC001219010079 1052267792 /nfs/dbraw/zinc/26/77/92/1052267792.db2.gz YWXKRLJTTVZRMM-UHFFFAOYSA-N 1 2 301.434 4.099 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1ccc(-n3ccnc3)cc1)C2 ZINC000347442599 1052282824 /nfs/dbraw/zinc/28/28/24/1052282824.db2.gz HQFGHNAWTLWARJ-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1ccc(-n3ccnc3)cc1)C2 ZINC000347442599 1052282834 /nfs/dbraw/zinc/28/28/34/1052282834.db2.gz HQFGHNAWTLWARJ-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO CC1(C)CCCN(C(=O)c2cccc3[nH+]ccn32)c2ccccc21 ZINC000762196695 1052334743 /nfs/dbraw/zinc/33/47/43/1052334743.db2.gz RGYCTDXLWNFFOX-UHFFFAOYSA-N 1 2 319.408 4.053 20 0 DIADLO CNc1ccc(Nc2cc(-c3ccccc3)nn2CC2CC2)c[nH+]1 ZINC001203451692 1052356045 /nfs/dbraw/zinc/35/60/45/1052356045.db2.gz ADFRGHMHNWJFRI-UHFFFAOYSA-N 1 2 319.412 4.140 20 0 DIADLO CC(C)[C@@H](C)[N@H+](C)Cn1[nH]c(/C=C/c2ccccc2)nc1=S ZINC000915208113 1052366674 /nfs/dbraw/zinc/36/66/74/1052366674.db2.gz CGHRHNWUHWUNCP-PLSXKVAHSA-N 1 2 316.474 4.045 20 0 DIADLO CC(C)[C@@H](C)[N@@H+](C)Cn1[nH]c(/C=C/c2ccccc2)nc1=S ZINC000915208113 1052366679 /nfs/dbraw/zinc/36/66/79/1052366679.db2.gz CGHRHNWUHWUNCP-PLSXKVAHSA-N 1 2 316.474 4.045 20 0 DIADLO CC(C)[C@H](C)[N@H+](C)Cn1[nH]c(-c2ccc(Cl)cc2)nc1=S ZINC000915208000 1052367037 /nfs/dbraw/zinc/36/70/37/1052367037.db2.gz AVGKWGAYVNITHS-NSHDSACASA-N 1 2 324.881 4.195 20 0 DIADLO CC(C)[C@H](C)[N@@H+](C)Cn1[nH]c(-c2ccc(Cl)cc2)nc1=S ZINC000915208000 1052367045 /nfs/dbraw/zinc/36/70/45/1052367045.db2.gz AVGKWGAYVNITHS-NSHDSACASA-N 1 2 324.881 4.195 20 0 DIADLO Cc1ccc(-c2nn(C[N@@H+](C)[C@H](C)C(C)C)c(=S)o2)cc1 ZINC000915208524 1052367304 /nfs/dbraw/zinc/36/73/04/1052367304.db2.gz FMQYBISQJNNVTF-CYBMUJFWSA-N 1 2 305.447 4.115 20 0 DIADLO Cc1ccc(-c2nn(C[N@H+](C)[C@H](C)C(C)C)c(=S)o2)cc1 ZINC000915208524 1052367311 /nfs/dbraw/zinc/36/73/11/1052367311.db2.gz FMQYBISQJNNVTF-CYBMUJFWSA-N 1 2 305.447 4.115 20 0 DIADLO CCCCCC[C@](C)(CCC)c1nc(Cc2c[nH+]cn2C)no1 ZINC000762412561 1052378301 /nfs/dbraw/zinc/37/83/01/1052378301.db2.gz VFRRJQNLWREXAF-SFHVURJKSA-N 1 2 318.465 4.422 20 0 DIADLO CN(C)c1cc(CSc2nc3cc(Cl)ccc3o2)cc[nH+]1 ZINC000762468266 1052389214 /nfs/dbraw/zinc/38/92/14/1052389214.db2.gz HPWKHGFOGWBIEQ-UHFFFAOYSA-N 1 2 319.817 4.235 20 0 DIADLO Cc1ccc(NC(=O)CCCC2CCCCC2)c(N(C)C)[nH+]1 ZINC001127364256 1052409668 /nfs/dbraw/zinc/40/96/68/1052409668.db2.gz DDRVYAIISPSLDA-UHFFFAOYSA-N 1 2 303.450 4.145 20 0 DIADLO c1cn(-c2ccc(CNc3cnc4ccccc4c3)cc2)c[nH+]1 ZINC000236616010 1052427675 /nfs/dbraw/zinc/42/76/75/1052427675.db2.gz WVJSOGFJEAORMZ-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO Clc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cn2ccccc2n1 ZINC000613492514 1052434284 /nfs/dbraw/zinc/43/42/84/1052434284.db2.gz QOPJLUIMUJQOPR-KRWDZBQOSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1ccccc1[C@@H]1CCC[N@H+]1Cc1cn2ccccc2n1 ZINC000613492514 1052434285 /nfs/dbraw/zinc/43/42/85/1052434285.db2.gz QOPJLUIMUJQOPR-KRWDZBQOSA-N 1 2 311.816 4.325 20 0 DIADLO Cc1ccc(NC2CCN(c3cccc[nH+]3)CC2)c2cccnc12 ZINC000237731328 1052444655 /nfs/dbraw/zinc/44/46/55/1052444655.db2.gz IHESISBKFBRJNE-UHFFFAOYSA-N 1 2 318.424 4.019 20 0 DIADLO Fc1ccccc1C1CC(Nc2ccc(N3CCCC3)[nH+]c2)C1 ZINC000237815060 1052445625 /nfs/dbraw/zinc/44/56/25/1052445625.db2.gz ZTDWXQRGYIYWTJ-UHFFFAOYSA-N 1 2 311.404 4.179 20 0 DIADLO Cc1ccc(C(OCCn2cc[nH+]c2)c2ccc(C)cc2)cc1 ZINC001222135429 1052448832 /nfs/dbraw/zinc/44/88/32/1052448832.db2.gz YMSPJQATQNMKAG-UHFFFAOYSA-N 1 2 306.409 4.306 20 0 DIADLO Cc1cc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c(F)cc1Cl ZINC001222221000 1052463721 /nfs/dbraw/zinc/46/37/21/1052463721.db2.gz QCROHSVFFVIIGE-UHFFFAOYSA-N 1 2 304.674 4.451 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1)Cc1nccc(C)c1Cl ZINC001235587372 1052485277 /nfs/dbraw/zinc/48/52/77/1052485277.db2.gz BPYZLOQXGULIGL-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1)Cc1nccc(C)c1Cl ZINC001235587372 1052485280 /nfs/dbraw/zinc/48/52/80/1052485280.db2.gz BPYZLOQXGULIGL-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)[C@H]1CO ZINC001235594211 1052486605 /nfs/dbraw/zinc/48/66/05/1052486605.db2.gz XRDUTXABBPRWSA-ZANVPECISA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)[C@H]1CO ZINC001235594211 1052486607 /nfs/dbraw/zinc/48/66/07/1052486607.db2.gz XRDUTXABBPRWSA-ZANVPECISA-N 1 2 322.663 4.240 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(Cl)c(CO)c2F)c1 ZINC001222362045 1052491715 /nfs/dbraw/zinc/49/17/15/1052491715.db2.gz JONWRCKWDKJMSM-UHFFFAOYSA-N 1 2 316.763 4.039 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[N@@H+]1CC[C@@]2(C1)CCCCO2 ZINC001235740363 1052498348 /nfs/dbraw/zinc/49/83/48/1052498348.db2.gz MSFUPOWDRLGTAY-OAHLLOKOSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[N@H+]1CC[C@@]2(C1)CCCCO2 ZINC001235740363 1052498352 /nfs/dbraw/zinc/49/83/52/1052498352.db2.gz MSFUPOWDRLGTAY-OAHLLOKOSA-N 1 2 318.219 4.278 20 0 DIADLO COc1ccc2c(c1)[C@H](Nc1ccc(N3CCCC3)[nH+]c1)CCC2 ZINC000325895749 1052501961 /nfs/dbraw/zinc/50/19/61/1052501961.db2.gz SPOAWXURSRZTNL-LJQANCHMSA-N 1 2 323.440 4.180 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1cc(C)n(C)n1 ZINC000282121659 1052527489 /nfs/dbraw/zinc/52/74/89/1052527489.db2.gz JONYAOQYOHZHAW-HZPDHXFCSA-N 1 2 315.461 4.065 20 0 DIADLO C[C@H]([NH2+]C1CC(c2ccc(Cl)cc2)C1)C(=O)OC1CCCC1 ZINC000763288431 1052556691 /nfs/dbraw/zinc/55/66/91/1052556691.db2.gz QPNVVAMJUSZXPN-YGONEPDPSA-N 1 2 321.848 4.050 20 0 DIADLO CC(C)(C)c1ncc(C[NH2+][C@@H](c2ccco2)c2ccccc2)cn1 ZINC000326592003 1052565587 /nfs/dbraw/zinc/56/55/87/1052565587.db2.gz DGQYGMFEMKJZHV-GOSISDBHSA-N 1 2 321.424 4.246 20 0 DIADLO Cc1ccccc1N1CC[NH+](Cc2ccc(Cl)s2)CC1 ZINC000916150233 1052594255 /nfs/dbraw/zinc/59/42/55/1052594255.db2.gz WJVWUZOSZIPJPY-UHFFFAOYSA-N 1 2 306.862 4.032 20 0 DIADLO Cc1cc(CO[C@@H](C)c2cccc(Br)n2)cc(C)[nH+]1 ZINC001223420026 1052598916 /nfs/dbraw/zinc/59/89/16/1052598916.db2.gz GWCDUCXVYDEYIH-LBPRGKRZSA-N 1 2 321.218 4.134 20 0 DIADLO Cc1cc(CO[C@@H]2CC[C@H](OCc3ccccc3)C2)cc(C)[nH+]1 ZINC001223425794 1052599986 /nfs/dbraw/zinc/59/99/86/1052599986.db2.gz VCUWFIONJKKNSJ-VQTJNVASSA-N 1 2 311.425 4.353 20 0 DIADLO CC[C@H](C)Oc1cccc(NCc2[nH+]cc(C)c(OC)c2C)c1 ZINC000321093834 1052627615 /nfs/dbraw/zinc/62/76/15/1052627615.db2.gz KSIXUQVBNMZZTC-AWEZNQCLSA-N 1 2 314.429 4.496 20 0 DIADLO Cc1cccc2c1CC[C@H]2[NH2+][C@@H](C)c1noc(-c2ccccc2)n1 ZINC000124281820 1052639002 /nfs/dbraw/zinc/63/90/02/1052639002.db2.gz YVSXEBXOXTTXCU-KBXCAEBGSA-N 1 2 319.408 4.383 20 0 DIADLO CC(C)(C)c1cnc(C[NH+]2CCC(OC3CCCCC3)CC2)o1 ZINC000125461098 1052649116 /nfs/dbraw/zinc/64/91/16/1052649116.db2.gz URMOUQBHZYGPOR-UHFFFAOYSA-N 1 2 320.477 4.286 20 0 DIADLO CCCc1ccc(CNc2ccc([NH+]3CCC(O)CC3)cc2)cc1 ZINC000916842970 1052659038 /nfs/dbraw/zinc/65/90/38/1052659038.db2.gz GLSLJEGRPAOUIK-UHFFFAOYSA-N 1 2 324.468 4.212 20 0 DIADLO COc1cccc2cc(CNc3ccc(-n4cc[nH+]c4)cc3)oc21 ZINC000916840906 1052659379 /nfs/dbraw/zinc/65/93/79/1052659379.db2.gz KWTRLQRQGKATJK-UHFFFAOYSA-N 1 2 319.364 4.239 20 0 DIADLO Cn1c(Cl)cnc1C[N@@H+]1CCCCC[C@H]1c1ccccc1 ZINC000917064873 1052689101 /nfs/dbraw/zinc/68/91/01/1052689101.db2.gz PLTZASDGKFLYOI-HNNXBMFYSA-N 1 2 303.837 4.191 20 0 DIADLO Cn1c(Cl)cnc1C[N@H+]1CCCCC[C@H]1c1ccccc1 ZINC000917064873 1052689106 /nfs/dbraw/zinc/68/91/06/1052689106.db2.gz PLTZASDGKFLYOI-HNNXBMFYSA-N 1 2 303.837 4.191 20 0 DIADLO Cn1ncc2c1nc[nH+]c2N[C@H](c1ccccc1)C1CCCCC1 ZINC000917067363 1052689713 /nfs/dbraw/zinc/68/97/13/1052689713.db2.gz CCAUUQKCVQXJEH-QGZVFWFLSA-N 1 2 321.428 4.097 20 0 DIADLO CCCCCCNC(=O)C[N@H+](C)[C@H](C)c1ccccc1Cl ZINC000917066865 1052690058 /nfs/dbraw/zinc/69/00/58/1052690058.db2.gz VYZHOHFSCDNPKT-CQSZACIVSA-N 1 2 310.869 4.029 20 0 DIADLO CCCCCCNC(=O)C[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC000917066865 1052690059 /nfs/dbraw/zinc/69/00/59/1052690059.db2.gz VYZHOHFSCDNPKT-CQSZACIVSA-N 1 2 310.869 4.029 20 0 DIADLO Cc1ncsc1C[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC000066563729 1052692061 /nfs/dbraw/zinc/69/20/61/1052692061.db2.gz DSBDSGDOJNWQEF-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1ncsc1C[N@H+](C)Cc1ccc(Cl)cc1Cl ZINC000066563729 1052692066 /nfs/dbraw/zinc/69/20/66/1052692066.db2.gz DSBDSGDOJNWQEF-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO CC(C)C[C@@H](c1nc(-c2c[nH]c3ccccc32)no1)n1cc[nH+]c1 ZINC000924008061 1052703911 /nfs/dbraw/zinc/70/39/11/1052703911.db2.gz MFWRQOLICFUVDY-INIZCTEOSA-N 1 2 321.384 4.050 20 0 DIADLO CCSc1cccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC000128157878 1052710781 /nfs/dbraw/zinc/71/07/81/1052710781.db2.gz LEWBGQRRIPSBOD-UHFFFAOYSA-N 1 2 323.421 4.441 20 0 DIADLO Cc1ccc(F)c(-c2noc([C@@H](CC(C)C)n3cc[nH+]c3)n2)c1 ZINC000924009898 1052716857 /nfs/dbraw/zinc/71/68/57/1052716857.db2.gz VESHYJSULMPOPK-OAHLLOKOSA-N 1 2 314.364 4.016 20 0 DIADLO CC(C)=CCCO[C@H]1CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC001224716744 1052719650 /nfs/dbraw/zinc/71/96/50/1052719650.db2.gz QIQNJYLTYRPLNI-ZDUSSCGKSA-N 1 2 314.882 4.134 20 0 DIADLO CC(C)=CCCO[C@H]1CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC001224716744 1052719653 /nfs/dbraw/zinc/71/96/53/1052719653.db2.gz QIQNJYLTYRPLNI-ZDUSSCGKSA-N 1 2 314.882 4.134 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-c2ccccc2)cc1)n1cc[nH+]c1 ZINC000917360172 1052723466 /nfs/dbraw/zinc/72/34/66/1052723466.db2.gz CKYAYUJOMNSPRX-OAHLLOKOSA-N 1 2 305.381 4.140 20 0 DIADLO CCC[NH+](CCC)Cn1ncn([C@@H](C)c2ccccc2)c1=S ZINC000917423636 1052728722 /nfs/dbraw/zinc/72/87/22/1052728722.db2.gz XQWQRNXRQZOMQK-HNNXBMFYSA-N 1 2 318.490 4.103 20 0 DIADLO CC[N@H+](CC(C)C)Cn1nc2sc3ccccc3n2c1=S ZINC000917454594 1052729106 /nfs/dbraw/zinc/72/91/06/1052729106.db2.gz UWJAHBNXWLROSK-UHFFFAOYSA-N 1 2 320.487 4.015 20 0 DIADLO CC[N@@H+](CC(C)C)Cn1nc2sc3ccccc3n2c1=S ZINC000917454594 1052729115 /nfs/dbraw/zinc/72/91/15/1052729115.db2.gz UWJAHBNXWLROSK-UHFFFAOYSA-N 1 2 320.487 4.015 20 0 DIADLO CCn1c(-c2ccccc2)nn(C[N@H+](CC)CC(C)C)c1=S ZINC000917454253 1052729246 /nfs/dbraw/zinc/72/92/46/1052729246.db2.gz MKANGNWSUDDSPC-UHFFFAOYSA-N 1 2 318.490 4.036 20 0 DIADLO CCn1c(-c2ccccc2)nn(C[N@@H+](CC)CC(C)C)c1=S ZINC000917454253 1052729248 /nfs/dbraw/zinc/72/92/48/1052729248.db2.gz MKANGNWSUDDSPC-UHFFFAOYSA-N 1 2 318.490 4.036 20 0 DIADLO CC1CCC([N@H+](C)Cn2[nH]c(-c3ccccc3)nc2=S)CC1 ZINC000917456298 1052729667 /nfs/dbraw/zinc/72/96/67/1052729667.db2.gz NMPSBBLMVFBCOV-UHFFFAOYSA-N 1 2 316.474 4.076 20 0 DIADLO CC1CCC([N@@H+](C)Cn2[nH]c(-c3ccccc3)nc2=S)CC1 ZINC000917456298 1052729672 /nfs/dbraw/zinc/72/96/72/1052729672.db2.gz NMPSBBLMVFBCOV-UHFFFAOYSA-N 1 2 316.474 4.076 20 0 DIADLO Clc1cc(Nc2ccnc(Cl)c2Cl)cn2cc[nH+]c12 ZINC001212234786 1052813093 /nfs/dbraw/zinc/81/30/93/1052813093.db2.gz VGPWSKPLINVAPC-UHFFFAOYSA-N 1 2 313.575 4.433 20 0 DIADLO CCn1cc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000129883841 1052813439 /nfs/dbraw/zinc/81/34/39/1052813439.db2.gz AURLZQNUGFIFTI-CYBMUJFWSA-N 1 2 303.837 4.282 20 0 DIADLO CCn1cc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000129883841 1052813444 /nfs/dbraw/zinc/81/34/44/1052813444.db2.gz AURLZQNUGFIFTI-CYBMUJFWSA-N 1 2 303.837 4.282 20 0 DIADLO C[C@@H](CC[NH2+][C@H](c1nnc[nH]1)c1ccc(F)cc1)CC(C)(C)C ZINC000556178682 1052817243 /nfs/dbraw/zinc/81/72/43/1052817243.db2.gz LKHOURISVKAQQQ-BBRMVZONSA-N 1 2 318.440 4.085 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3)cc2F)nn1C ZINC000556198123 1052818767 /nfs/dbraw/zinc/81/87/67/1052818767.db2.gz IVBANBQAFAUSIE-HNNXBMFYSA-N 1 2 323.415 4.385 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000170762014 1052865974 /nfs/dbraw/zinc/86/59/74/1052865974.db2.gz JVJNJZKWMHFYSN-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000170762014 1052865979 /nfs/dbraw/zinc/86/59/79/1052865979.db2.gz JVJNJZKWMHFYSN-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO Clc1nccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1Cl ZINC001212240416 1052869486 /nfs/dbraw/zinc/86/94/86/1052869486.db2.gz WCZROLRYSOEXQS-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cnc(C(C)(C)C)nc1 ZINC000556598710 1052870264 /nfs/dbraw/zinc/87/02/64/1052870264.db2.gz SPTYGTHLIGWVQQ-ZDUSSCGKSA-N 1 2 301.409 4.106 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cnc(C(C)(C)C)nc1 ZINC000556598710 1052870271 /nfs/dbraw/zinc/87/02/71/1052870271.db2.gz SPTYGTHLIGWVQQ-ZDUSSCGKSA-N 1 2 301.409 4.106 20 0 DIADLO FC(F)[C@H](CCc1ccccc1)[NH2+]CC1(C(F)(F)F)CC1 ZINC000556920309 1052900135 /nfs/dbraw/zinc/90/01/35/1052900135.db2.gz GKMFOIKWMXQMGX-LBPRGKRZSA-N 1 2 307.306 4.185 20 0 DIADLO CCC(CC)C[N@H+](CC)Cn1nc(OC(C)C)sc1=S ZINC000919939430 1052905921 /nfs/dbraw/zinc/90/59/21/1052905921.db2.gz TVECWJWIPWFOSE-UHFFFAOYSA-N 1 2 317.524 4.177 20 0 DIADLO CCC(CC)C[N@@H+](CC)Cn1nc(OC(C)C)sc1=S ZINC000919939430 1052905923 /nfs/dbraw/zinc/90/59/23/1052905923.db2.gz TVECWJWIPWFOSE-UHFFFAOYSA-N 1 2 317.524 4.177 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ccc(C)c(F)c3)c2)[nH+]c1C ZINC000920252593 1052930619 /nfs/dbraw/zinc/93/06/19/1052930619.db2.gz VUQIILCKWLIDDZ-UHFFFAOYSA-N 1 2 323.371 4.393 20 0 DIADLO CCC/C=C/C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000920472854 1052943167 /nfs/dbraw/zinc/94/31/67/1052943167.db2.gz GSMOXLJGOMYCIJ-XBXARRHUSA-N 1 2 309.413 4.181 20 0 DIADLO CC[C@H]1CCC[C@@H](Nc2nc(C)[nH+]c(C)c2Br)C1 ZINC000322905159 1052974381 /nfs/dbraw/zinc/97/43/81/1052974381.db2.gz QVNTZILCUINZIQ-NWDGAFQWSA-N 1 2 312.255 4.237 20 0 DIADLO CCCC[C@@H](CC)CNc1nc(C)[nH+]c(C)c1Br ZINC000322978865 1052982952 /nfs/dbraw/zinc/98/29/52/1052982952.db2.gz VBPULXIMYVMSJF-GFCCVEGCSA-N 1 2 314.271 4.484 20 0 DIADLO Fc1ccc(F)c(C[N@H+](Cn2cc[nH]c2=S)C2CCCC2)c1 ZINC000175271604 1052987956 /nfs/dbraw/zinc/98/79/56/1052987956.db2.gz DWXAAMQBNPDBSG-UHFFFAOYSA-N 1 2 323.412 4.226 20 0 DIADLO Fc1ccc(F)c(C[N@@H+](Cn2cc[nH]c2=S)C2CCCC2)c1 ZINC000175271604 1052987957 /nfs/dbraw/zinc/98/79/57/1052987957.db2.gz DWXAAMQBNPDBSG-UHFFFAOYSA-N 1 2 323.412 4.226 20 0 DIADLO C[N@H+](Cc1nc2ccccc2s1)Cc1cccc(Cl)c1O ZINC000179610736 1053018528 /nfs/dbraw/zinc/01/85/28/1053018528.db2.gz NANDVRIMYYYYRX-UHFFFAOYSA-N 1 2 318.829 4.287 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2s1)Cc1cccc(Cl)c1O ZINC000179610736 1053018530 /nfs/dbraw/zinc/01/85/30/1053018530.db2.gz NANDVRIMYYYYRX-UHFFFAOYSA-N 1 2 318.829 4.287 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(Cl)c2O)C[C@H](c2ccccc2)O1 ZINC000179854719 1053030873 /nfs/dbraw/zinc/03/08/73/1053030873.db2.gz XBIHJDHHIHXHJB-SUMWQHHRSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(Cl)c2O)C[C@H](c2ccccc2)O1 ZINC000179854719 1053030875 /nfs/dbraw/zinc/03/08/75/1053030875.db2.gz XBIHJDHHIHXHJB-SUMWQHHRSA-N 1 2 317.816 4.008 20 0 DIADLO COc1cc2c(cc1O[C@H](c1ccccc1)C1CC1)C=[NH+]CC2 ZINC001228086876 1053042768 /nfs/dbraw/zinc/04/27/68/1053042768.db2.gz ITEPUVVRGABONI-HXUWFJFHSA-N 1 2 307.393 4.200 20 0 DIADLO C[C@H](Oc1cccc(C(=O)C[N@H+](C)Cc2ccccc2)c1)C1CC1 ZINC001228105503 1053044510 /nfs/dbraw/zinc/04/45/10/1053044510.db2.gz XLVIEFIZGXKTMS-INIZCTEOSA-N 1 2 323.436 4.179 20 0 DIADLO C[C@H](Oc1cccc(C(=O)C[N@@H+](C)Cc2ccccc2)c1)C1CC1 ZINC001228105503 1053044515 /nfs/dbraw/zinc/04/45/15/1053044515.db2.gz XLVIEFIZGXKTMS-INIZCTEOSA-N 1 2 323.436 4.179 20 0 DIADLO C[N@H+](CC(=O)c1cccc(OC2CC=CC2)c1)Cc1ccccc1 ZINC001228104340 1053044637 /nfs/dbraw/zinc/04/46/37/1053044637.db2.gz PEOCJBOTLKQZCR-UHFFFAOYSA-N 1 2 321.420 4.099 20 0 DIADLO C[N@@H+](CC(=O)c1cccc(OC2CC=CC2)c1)Cc1ccccc1 ZINC001228104340 1053044639 /nfs/dbraw/zinc/04/46/39/1053044639.db2.gz PEOCJBOTLKQZCR-UHFFFAOYSA-N 1 2 321.420 4.099 20 0 DIADLO Cc1ccc(F)c(NC(=O)[C@@H](c2ccc(Cl)cc2)[NH+](C)C)c1 ZINC001350467144 1053066113 /nfs/dbraw/zinc/06/61/13/1053066113.db2.gz DNFXGCHXZIANLN-MRXNPFEDSA-N 1 2 320.795 4.029 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1O ZINC000180638491 1053076257 /nfs/dbraw/zinc/07/62/57/1053076257.db2.gz PAPRGCUTUUHXEP-MRXNPFEDSA-N 1 2 304.821 4.111 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1cccc(Cl)c1O ZINC000180638491 1053076270 /nfs/dbraw/zinc/07/62/70/1053076270.db2.gz PAPRGCUTUUHXEP-MRXNPFEDSA-N 1 2 304.821 4.111 20 0 DIADLO COc1ccc(OC)c([C@@H](C)Oc2ccc3[nH]c(C)[nH+]c3c2)c1 ZINC001228330163 1053076775 /nfs/dbraw/zinc/07/67/75/1053076775.db2.gz VYDYAZJAVMKKHU-LLVKDONJSA-N 1 2 312.369 4.029 20 0 DIADLO Fc1ccc([C@@H]([NH2+][C@@H]2CCCc3[nH]ncc32)C2CCCC2)cc1 ZINC000353383909 1053078252 /nfs/dbraw/zinc/07/82/52/1053078252.db2.gz HKALQQXXHQVUBV-MJGOQNOKSA-N 1 2 313.420 4.447 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1cnc(C2CC2)s1 ZINC000538609470 1053079659 /nfs/dbraw/zinc/07/96/59/1053079659.db2.gz FHFAWPCUGIYJIU-UHFFFAOYSA-N 1 2 312.442 4.392 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1c(F)cccc1F ZINC000849323735 1053086546 /nfs/dbraw/zinc/08/65/46/1053086546.db2.gz RYHLVMBZRCQQAH-NSHDSACASA-N 1 2 321.342 4.496 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@@H]1CCCC[C@@H]1C1CC1 ZINC001350618013 1053088565 /nfs/dbraw/zinc/08/85/65/1053088565.db2.gz SPSOTUCQLMQQOA-QZTJIDSGSA-N 1 2 309.413 4.027 20 0 DIADLO CCCCn1cc(CNc2[nH+]c3ccccc3cc2C)c(C)n1 ZINC000540207181 1053096699 /nfs/dbraw/zinc/09/66/99/1053096699.db2.gz AFDAMOZDZLEPOH-UHFFFAOYSA-N 1 2 308.429 4.460 20 0 DIADLO CCCCC[C@@H](C(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1)C(C)C ZINC001350826853 1053110034 /nfs/dbraw/zinc/11/00/34/1053110034.db2.gz LSEDCDVMXWPNLI-GOSISDBHSA-N 1 2 319.493 4.043 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)CC(C)(C)C ZINC000617230454 1053111868 /nfs/dbraw/zinc/11/18/68/1053111868.db2.gz LCQDALIGQUNPLU-ZDUSSCGKSA-N 1 2 317.408 4.412 20 0 DIADLO CC(C)[C@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc(Cl)cc1 ZINC000353440469 1053141904 /nfs/dbraw/zinc/14/19/04/1053141904.db2.gz KINFXRSPHKDQCV-RDJZCZTQSA-N 1 2 303.837 4.427 20 0 DIADLO CC(C)[C@@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc(Cl)cc1 ZINC000353440463 1053142605 /nfs/dbraw/zinc/14/26/05/1053142605.db2.gz KINFXRSPHKDQCV-DOTOQJQBSA-N 1 2 303.837 4.427 20 0 DIADLO Cc1cccc(Oc2ccccc2NC(=O)[C@@H](C)n2cc[nH+]c2)c1 ZINC001318034498 1053146316 /nfs/dbraw/zinc/14/63/16/1053146316.db2.gz IYBVCPHCZAIEBX-OAHLLOKOSA-N 1 2 321.380 4.184 20 0 DIADLO CCC[C@H](Cc1ccccc1)NC(=O)c1c(C)cc(C)[nH+]c1C ZINC001359849761 1053156260 /nfs/dbraw/zinc/15/62/60/1053156260.db2.gz WKHZDGCTHNPNPJ-GOSISDBHSA-N 1 2 310.441 4.148 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H](C)c1ncccn1 ZINC001351283624 1053161579 /nfs/dbraw/zinc/16/15/79/1053161579.db2.gz NYRVBDMUKSBCJE-GXTWGEPZSA-N 1 2 324.453 4.320 20 0 DIADLO CCc1ccc(-c2nc(=S)n(C[N@H+]3CCC[C@@H]3CC)[nH]2)cc1 ZINC001318396647 1053167450 /nfs/dbraw/zinc/16/74/50/1053167450.db2.gz VGROQPPTSNTCHH-HNNXBMFYSA-N 1 2 316.474 4.002 20 0 DIADLO CCc1ccc(-c2nc(=S)n(C[N@@H+]3CCC[C@@H]3CC)[nH]2)cc1 ZINC001318396647 1053167454 /nfs/dbraw/zinc/16/74/54/1053167454.db2.gz VGROQPPTSNTCHH-HNNXBMFYSA-N 1 2 316.474 4.002 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)c(C)s1 ZINC001319426038 1053242889 /nfs/dbraw/zinc/24/28/89/1053242889.db2.gz SDNKMTALRKOLFR-MRXNPFEDSA-N 1 2 308.397 4.375 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)c(C)s1 ZINC001319426038 1053242893 /nfs/dbraw/zinc/24/28/93/1053242893.db2.gz SDNKMTALRKOLFR-MRXNPFEDSA-N 1 2 308.397 4.375 20 0 DIADLO FC(F)(F)CCCNc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC001351926952 1053244449 /nfs/dbraw/zinc/24/44/49/1053244449.db2.gz KPPBWABQCBZJIT-UHFFFAOYSA-N 1 2 321.346 4.356 20 0 DIADLO C[N@H+](Cc1cc2ccccc2[nH]1)Cc1ncc(-c2ccccc2)o1 ZINC001319493665 1053247026 /nfs/dbraw/zinc/24/70/26/1053247026.db2.gz XBRZHPZRDFPKPV-UHFFFAOYSA-N 1 2 317.392 4.455 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2[nH]1)Cc1ncc(-c2ccccc2)o1 ZINC001319493665 1053247034 /nfs/dbraw/zinc/24/70/34/1053247034.db2.gz XBRZHPZRDFPKPV-UHFFFAOYSA-N 1 2 317.392 4.455 20 0 DIADLO Cc1ccc(C2=CCN(C(=O)c3c(C)cc(C)[nH+]c3C)CC2)cc1 ZINC001351961537 1053252119 /nfs/dbraw/zinc/25/21/19/1053252119.db2.gz DQOJYNNVWFKJOU-UHFFFAOYSA-N 1 2 320.436 4.245 20 0 DIADLO C[S@](=O)c1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2ccccc2)cc1 ZINC001319706129 1053263518 /nfs/dbraw/zinc/26/35/18/1053263518.db2.gz VTCAIVKJDQPJHM-GCJKJVERSA-N 1 2 313.466 4.007 20 0 DIADLO C[S@](=O)c1ccc(C[N@H+]2CC(C)(C)[C@H]2c2ccccc2)cc1 ZINC001319706129 1053263525 /nfs/dbraw/zinc/26/35/25/1053263525.db2.gz VTCAIVKJDQPJHM-GCJKJVERSA-N 1 2 313.466 4.007 20 0 DIADLO CCc1oc2ccccc2c1C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001319718569 1053266475 /nfs/dbraw/zinc/26/64/75/1053266475.db2.gz FPAXPGPJESHBDO-UHFFFAOYSA-N 1 2 323.396 4.017 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@H](C)c1cc(O)ccc1F)CCC2 ZINC001352083955 1053276766 /nfs/dbraw/zinc/27/67/66/1053276766.db2.gz IAKPQUBMMDIZBR-PXAZEXFGSA-N 1 2 317.408 4.037 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2c(Cl)cccc2N(C)C)no1 ZINC001319825825 1053277242 /nfs/dbraw/zinc/27/72/42/1053277242.db2.gz GDASMRDVJDQMLG-KRWDZBQOSA-N 1 2 319.836 4.040 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2c(Cl)cccc2N(C)C)no1 ZINC001319825825 1053277251 /nfs/dbraw/zinc/27/72/51/1053277251.db2.gz GDASMRDVJDQMLG-KRWDZBQOSA-N 1 2 319.836 4.040 20 0 DIADLO Cc1cc(NC(=O)C=Cc2ccc(C(C)(C)C)cc2)c(C)c[nH+]1 ZINC001127647126 1053280711 /nfs/dbraw/zinc/28/07/11/1053280711.db2.gz JEYCTRAKMKCKTN-FLIBITNWSA-N 1 2 308.425 4.070 20 0 DIADLO Cc1cc(NC(=O)c2cc(Cl)cc3ccccc32)c(C)c[nH+]1 ZINC001127646870 1053281396 /nfs/dbraw/zinc/28/13/96/1053281396.db2.gz XBCIXGYRBLYGMB-UHFFFAOYSA-N 1 2 310.784 4.179 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2ccc(Cl)cn2)c1C ZINC001319994496 1053292740 /nfs/dbraw/zinc/29/27/40/1053292740.db2.gz LFEKJGKIHVDZAA-UHFFFAOYSA-N 1 2 308.834 4.189 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@H+]([C@@H](C)c3nc(C4CC4)no3)CC2)c1 ZINC000092428141 1053321090 /nfs/dbraw/zinc/32/10/90/1053321090.db2.gz KTXXAVIEPAVIIN-HNNXBMFYSA-N 1 2 323.440 4.414 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@@H+]([C@@H](C)c3nc(C4CC4)no3)CC2)c1 ZINC000092428141 1053321107 /nfs/dbraw/zinc/32/11/07/1053321107.db2.gz KTXXAVIEPAVIIN-HNNXBMFYSA-N 1 2 323.440 4.414 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1cn(C)nc1C(F)F ZINC001320464717 1053335083 /nfs/dbraw/zinc/33/50/83/1053335083.db2.gz YUQOXLHHNZWBOH-QWRGUYRKSA-N 1 2 323.362 4.005 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1cn(C)nc1C(F)F ZINC001320464717 1053335097 /nfs/dbraw/zinc/33/50/97/1053335097.db2.gz YUQOXLHHNZWBOH-QWRGUYRKSA-N 1 2 323.362 4.005 20 0 DIADLO COc1cc(C)[nH+]c(CSCCC(Cl)(Cl)Cl)c1 ZINC001320567678 1053346413 /nfs/dbraw/zinc/34/64/13/1053346413.db2.gz YAKRWQVHPBFDRR-UHFFFAOYSA-N 1 2 314.665 4.392 20 0 DIADLO CC(C)CSCCCn1nc(C(F)(F)F)c2c[nH+]ccc21 ZINC000092918353 1053353510 /nfs/dbraw/zinc/35/35/10/1053353510.db2.gz LQBVRCRQROLPQE-UHFFFAOYSA-N 1 2 317.380 4.229 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)C(C)(C)C2CCCC2)n1 ZINC001300053098 1053353909 /nfs/dbraw/zinc/35/39/09/1053353909.db2.gz JEONOTAPKIFKGE-UHFFFAOYSA-N 1 2 323.506 4.140 20 0 DIADLO CC(=O)c1cccc(-c2ccccc2)c1OC1C[NH+](C(C)C)C1 ZINC001229566985 1053356239 /nfs/dbraw/zinc/35/62/39/1053356239.db2.gz RRRRYVCNYNLHPD-UHFFFAOYSA-N 1 2 309.409 4.028 20 0 DIADLO CCc1ccc(C2=CC[N@@H+]([C@H](C)c3nc(C4CC4)no3)CC2)cc1 ZINC000093263560 1053376252 /nfs/dbraw/zinc/37/62/52/1053376252.db2.gz UFOIRBWDEUEFOE-CQSZACIVSA-N 1 2 323.440 4.360 20 0 DIADLO CCc1ccc(C2=CC[N@H+]([C@H](C)c3nc(C4CC4)no3)CC2)cc1 ZINC000093263560 1053376265 /nfs/dbraw/zinc/37/62/65/1053376265.db2.gz UFOIRBWDEUEFOE-CQSZACIVSA-N 1 2 323.440 4.360 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C(F)=C1CCCC1 ZINC001434921915 1053387932 /nfs/dbraw/zinc/38/79/32/1053387932.db2.gz ZDACDWJBZKHLAH-UHFFFAOYSA-N 1 2 319.767 4.262 20 0 DIADLO Cc1cccc(C(C)(C)CNC(=O)c2c(C)cc(C)[nH+]c2C)c1 ZINC001434923560 1053388760 /nfs/dbraw/zinc/38/87/60/1053388760.db2.gz GCNLHTBMJVWRCN-UHFFFAOYSA-N 1 2 310.441 4.023 20 0 DIADLO CC[C@H](C)[C@H](C(=O)Nc1ccn2cc[nH+]c2c1)c1ccccc1 ZINC000572549204 1053397751 /nfs/dbraw/zinc/39/77/51/1053397751.db2.gz LTNCXZYLUCIVED-KSSFIOAISA-N 1 2 307.397 4.103 20 0 DIADLO COc1cccc(C2CC[NH+](C/C(Cl)=C\Cl)CC2)c1 ZINC000763519170 1053414577 /nfs/dbraw/zinc/41/45/77/1053414577.db2.gz RGMNSRLJDPCJKV-GXDHUFHOSA-N 1 2 300.229 4.194 20 0 DIADLO CC(C)CCOc1ccc(C[N@H+](C)Cc2nccs2)cc1 ZINC000093582583 1053425548 /nfs/dbraw/zinc/42/55/48/1053425548.db2.gz KHEJXDOECDPWIX-UHFFFAOYSA-N 1 2 304.459 4.200 20 0 DIADLO CC(C)CCOc1ccc(C[N@@H+](C)Cc2nccs2)cc1 ZINC000093582583 1053425553 /nfs/dbraw/zinc/42/55/53/1053425553.db2.gz KHEJXDOECDPWIX-UHFFFAOYSA-N 1 2 304.459 4.200 20 0 DIADLO Cc1cc(N2CCO[C@@H](c3ccc(F)cc3)C2)[nH+]c2ccccc12 ZINC001321646284 1053426264 /nfs/dbraw/zinc/42/62/64/1053426264.db2.gz PWZQESGVDFGSLL-LJQANCHMSA-N 1 2 322.383 4.260 20 0 DIADLO Cc1ccccc1OC[C@H](C)Oc1ccc(-n2cc[nH+]c2)cc1 ZINC001229954264 1053437777 /nfs/dbraw/zinc/43/77/77/1053437777.db2.gz LSFIHRCYNXEHIF-INIZCTEOSA-N 1 2 308.381 4.027 20 0 DIADLO C[C@H](Oc1ccc(-n2cc[nH+]c2)cc1)c1ccc(F)c(F)c1 ZINC001229954163 1053438442 /nfs/dbraw/zinc/43/84/42/1053438442.db2.gz KDOXKZNVJOJYAK-LBPRGKRZSA-N 1 2 300.308 4.291 20 0 DIADLO C[C@H](Oc1ccc(-n2cc[nH+]c2)cc1)c1c(F)cccc1F ZINC001229950140 1053438504 /nfs/dbraw/zinc/43/85/04/1053438504.db2.gz HXJUFLIXKLRPDB-LBPRGKRZSA-N 1 2 300.308 4.291 20 0 DIADLO Cl/C=C(\Cl)C[NH+]1CCC(OCC2CCCCC2)CC1 ZINC000763559738 1053472829 /nfs/dbraw/zinc/47/28/29/1053472829.db2.gz RSTPISZUUBCQQR-UVTDQMKNSA-N 1 2 306.277 4.367 20 0 DIADLO Cc1c[nH]c(C[NH2+]Cc2ccccc2Oc2cccc(C)c2)n1 ZINC001200223417 1053481101 /nfs/dbraw/zinc/48/11/01/1053481101.db2.gz JMZBWIDJMNMDCG-UHFFFAOYSA-N 1 2 307.397 4.109 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+][C@@H](C)CSC(C)(C)C ZINC000182609377 1053488218 /nfs/dbraw/zinc/48/82/18/1053488218.db2.gz ZZTZWKHAOQZDLR-HNNXBMFYSA-N 1 2 322.518 4.164 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2nc3c(s2)C[C@@H](C)CC3)n1 ZINC000152707821 1053516326 /nfs/dbraw/zinc/51/63/26/1053516326.db2.gz ANXIHAXQTQLGAK-JTQLQIEISA-N 1 2 321.515 4.058 20 0 DIADLO CC(C)Oc1ccc[nH+]c1N[C@H]1CCC[C@H](c2cccnc2)C1 ZINC001322653034 1053533518 /nfs/dbraw/zinc/53/35/18/1053533518.db2.gz SRUBTURERBHFGD-RDJZCZTQSA-N 1 2 311.429 4.402 20 0 DIADLO Cc1nc2c(s1)[C@@H](Nc1ccc3c(c1)CCC[N@H+]3C)CCC2 ZINC000182956610 1053562199 /nfs/dbraw/zinc/56/21/99/1053562199.db2.gz VNYVUPAXPBBPHD-INIZCTEOSA-N 1 2 313.470 4.323 20 0 DIADLO Cc1nc2c(s1)[C@@H](Nc1ccc3c(c1)CCC[N@@H+]3C)CCC2 ZINC000182956610 1053562211 /nfs/dbraw/zinc/56/22/11/1053562211.db2.gz VNYVUPAXPBBPHD-INIZCTEOSA-N 1 2 313.470 4.323 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N[C@H](C)CCC3CCCCC3)ccn12 ZINC001353441681 1053573779 /nfs/dbraw/zinc/57/37/79/1053573779.db2.gz GGMGSZZHUDMFGR-CQSZACIVSA-N 1 2 313.445 4.122 20 0 DIADLO CN(C)c1cc(CSCc2ccc3ncccc3c2)cc[nH+]1 ZINC001324045675 1053618956 /nfs/dbraw/zinc/61/89/56/1053618956.db2.gz JKIRNGGPWDAJSB-UHFFFAOYSA-N 1 2 309.438 4.129 20 0 DIADLO CCCCC(=O)[C@H](CCCC)Oc1cc2c(cc1O)C=[NH+]CC2 ZINC001230921296 1053624888 /nfs/dbraw/zinc/62/48/88/1053624888.db2.gz KLJBWBJAWLSMLG-SFHVURJKSA-N 1 2 317.429 4.064 20 0 DIADLO Oc1cc2c(cc1O[C@@H]1Cc3cccc4cccc1c34)CC[NH+]=C2 ZINC001230920906 1053625351 /nfs/dbraw/zinc/62/53/51/1053625351.db2.gz XJJZVCFDHMFRII-LJQANCHMSA-N 1 2 315.372 4.197 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)c(N(C)C)[nH+]1 ZINC001435641620 1053626058 /nfs/dbraw/zinc/62/60/58/1053626058.db2.gz CDFQWXMMGDLVMS-UHFFFAOYSA-N 1 2 311.429 4.006 20 0 DIADLO Cc1ncsc1CSCc1ccc(-n2cc[nH+]c2)cc1C ZINC001324222656 1053636752 /nfs/dbraw/zinc/63/67/52/1053636752.db2.gz VDXCJFCXIGMNBL-UHFFFAOYSA-N 1 2 315.467 4.379 20 0 DIADLO CC[N@H+](Cc1cncc(C(F)(F)F)c1)Cc1ccccc1F ZINC001324270819 1053639572 /nfs/dbraw/zinc/63/95/72/1053639572.db2.gz XACNOPCMZPNDKQ-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1cncc(C(F)(F)F)c1)Cc1ccccc1F ZINC001324270819 1053639588 /nfs/dbraw/zinc/63/95/88/1053639588.db2.gz XACNOPCMZPNDKQ-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO C[C@@H]([NH2+]Cc1cccnc1Cl)c1nc(C(C)(C)C)cs1 ZINC001324383285 1053650857 /nfs/dbraw/zinc/65/08/57/1053650857.db2.gz FKZCKOWNEQQHLC-SNVBAGLBSA-N 1 2 309.866 4.340 20 0 DIADLO Cc1cc(N2CCC(c3ccncc3)CC2)[nH+]c2ccccc12 ZINC001324589472 1053665600 /nfs/dbraw/zinc/66/56/00/1053665600.db2.gz OOFLWSRFWNXFRZ-UHFFFAOYSA-N 1 2 303.409 4.322 20 0 DIADLO C[C@H](CCc1ccccc1)Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231078818 1053668754 /nfs/dbraw/zinc/66/87/54/1053668754.db2.gz FIAJCHHROGOYJW-MRXNPFEDSA-N 1 2 306.409 4.487 20 0 DIADLO c1c[nH+]c(-c2ccc(OC3CC(OCc4ccccc4)C3)cc2)[nH]1 ZINC001231080614 1053668859 /nfs/dbraw/zinc/66/88/59/1053668859.db2.gz FXOALIDLUQYOEJ-UHFFFAOYSA-N 1 2 320.392 4.203 20 0 DIADLO Cc1ccc(OC[C@H](C)Oc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001231080978 1053669024 /nfs/dbraw/zinc/66/90/24/1053669024.db2.gz JPYXDYXYFONQSC-HNNXBMFYSA-N 1 2 308.381 4.231 20 0 DIADLO C[C@@H](CCc1ccccc1)Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231078817 1053669183 /nfs/dbraw/zinc/66/91/83/1053669183.db2.gz FIAJCHHROGOYJW-INIZCTEOSA-N 1 2 306.409 4.487 20 0 DIADLO COc1cccc([C@H](C)Oc2ccc(-c3c[nH+]cn3C)cc2)c1 ZINC001231082944 1053671427 /nfs/dbraw/zinc/67/14/27/1053671427.db2.gz XUYNYSQDNPNZBH-AWEZNQCLSA-N 1 2 308.381 4.236 20 0 DIADLO C[C@H]1CCc2nc(C[N@@H+]3CCC[C@@H]3c3ccccn3)sc2C1 ZINC001324716178 1053675384 /nfs/dbraw/zinc/67/53/84/1053675384.db2.gz HMXCRJSVIOYQLB-XJKSGUPXSA-N 1 2 313.470 4.000 20 0 DIADLO C[C@H]1CCc2nc(C[N@H+]3CCC[C@@H]3c3ccccn3)sc2C1 ZINC001324716178 1053675394 /nfs/dbraw/zinc/67/53/94/1053675394.db2.gz HMXCRJSVIOYQLB-XJKSGUPXSA-N 1 2 313.470 4.000 20 0 DIADLO CC[C@H](C)NC(=S)Nc1ccc(Oc2cc[nH+]c(C)c2)cc1 ZINC001200491290 1053700676 /nfs/dbraw/zinc/70/06/76/1053700676.db2.gz XVBVIOMICDIFJT-LBPRGKRZSA-N 1 2 315.442 4.267 20 0 DIADLO Cc1cc(N2CC[C@]3(C2)OCc2ccccc23)[nH+]c2ccccc12 ZINC001325673361 1053727165 /nfs/dbraw/zinc/72/71/65/1053727165.db2.gz OEFQEFLQDXTCIJ-OAQYLSRUSA-N 1 2 316.404 4.179 20 0 DIADLO CC(C)n1cncc1CNc1[nH+]c2ccccc2n1C(C)(C)C ZINC001325843746 1053738107 /nfs/dbraw/zinc/73/81/07/1053738107.db2.gz GPJPQJDTIIKXNM-UHFFFAOYSA-N 1 2 311.433 4.181 20 0 DIADLO Cc1ccc([C@@H]2CCC[C@@H]2OC(=O)c2cccc3[nH+]ccn32)cc1 ZINC001435985494 1053744938 /nfs/dbraw/zinc/74/49/38/1053744938.db2.gz UZURNTKTAMCJAQ-WMZOPIPTSA-N 1 2 320.392 4.136 20 0 DIADLO CSc1ccc([C@@H](C)NC(=O)c2c(C)cc(C)[nH+]c2C)cc1 ZINC001436013552 1053753779 /nfs/dbraw/zinc/75/37/79/1053753779.db2.gz JOZNLHOMUKDGMU-CYBMUJFWSA-N 1 2 314.454 4.220 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CC[C@@]3(CCCO3)C2)c1Cl ZINC001231478486 1053760391 /nfs/dbraw/zinc/76/03/91/1053760391.db2.gz DDPKFHFPCYKDAA-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CC[C@@]3(CCCO3)C2)c1Cl ZINC001231478486 1053760399 /nfs/dbraw/zinc/76/03/99/1053760399.db2.gz DDPKFHFPCYKDAA-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nnc(-c3ccccc3)s2)cc1 ZINC000155087884 1053761784 /nfs/dbraw/zinc/76/17/84/1053761784.db2.gz HDNKTOYIAZYRBR-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nnc(-c3ccccc3)s2)cc1 ZINC000155087884 1053761797 /nfs/dbraw/zinc/76/17/97/1053761797.db2.gz HDNKTOYIAZYRBR-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1nnc(-c2ccccc2)s1 ZINC000155208051 1053770494 /nfs/dbraw/zinc/77/04/94/1053770494.db2.gz DAXWYWLTZNMRQW-AWEZNQCLSA-N 1 2 321.449 4.324 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1nnc(-c2ccccc2)s1 ZINC000155208051 1053770510 /nfs/dbraw/zinc/77/05/10/1053770510.db2.gz DAXWYWLTZNMRQW-AWEZNQCLSA-N 1 2 321.449 4.324 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3CCC[C@@H](F)C3)cc2)[nH+]c1C ZINC001354160131 1053783992 /nfs/dbraw/zinc/78/39/92/1053783992.db2.gz KLWUCYGCHMASAT-LSDHHAIUSA-N 1 2 315.392 4.160 20 0 DIADLO Clc1ccc(C[N@H+]2CCC[C@H]3C[C@H]32)cc1Br ZINC001231570014 1053785415 /nfs/dbraw/zinc/78/54/15/1053785415.db2.gz SSLWYKWZDUPQGD-GXFFZTMASA-N 1 2 300.627 4.087 20 0 DIADLO Clc1ccc(C[N@@H+]2CCC[C@H]3C[C@H]32)cc1Br ZINC001231570014 1053785407 /nfs/dbraw/zinc/78/54/07/1053785407.db2.gz SSLWYKWZDUPQGD-GXFFZTMASA-N 1 2 300.627 4.087 20 0 DIADLO CC1(F)CC[NH+](Cc2ccc(Cl)c(Br)c2)CC1 ZINC001231567437 1053787401 /nfs/dbraw/zinc/78/74/01/1053787401.db2.gz GEWHTGBYNODXFV-UHFFFAOYSA-N 1 2 320.633 4.427 20 0 DIADLO Fc1cc2cccnc2c(CNc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000155948791 1053791857 /nfs/dbraw/zinc/79/18/57/1053791857.db2.gz RJJUZTIMJCOCIZ-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO C[C@@H]1CC[C@H](CO)C[N@@H+]1Cc1cc(Cl)cc(Cl)c1Cl ZINC001231597614 1053796734 /nfs/dbraw/zinc/79/67/34/1053796734.db2.gz FEWAHDZLGUJJAW-ZJUUUORDSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[C@H](CO)C[N@H+]1Cc1cc(Cl)cc(Cl)c1Cl ZINC001231597614 1053796745 /nfs/dbraw/zinc/79/67/45/1053796745.db2.gz FEWAHDZLGUJJAW-ZJUUUORDSA-N 1 2 322.663 4.240 20 0 DIADLO Clc1cc(Cl)c(Cl)c(C[N@@H+]2CCC[C@@]23CCOC3)c1 ZINC001231604505 1053801118 /nfs/dbraw/zinc/80/11/18/1053801118.db2.gz NOLHPVSXVHDAFY-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1cc(Cl)c(Cl)c(C[N@H+]2CCC[C@@]23CCOC3)c1 ZINC001231604505 1053801133 /nfs/dbraw/zinc/80/11/33/1053801133.db2.gz NOLHPVSXVHDAFY-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO COc1cc(F)ccc1C[N@@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001231608693 1053801254 /nfs/dbraw/zinc/80/12/54/1053801254.db2.gz PWNOPDAQKKSSSF-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)ccc1C[N@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001231608693 1053801271 /nfs/dbraw/zinc/80/12/71/1053801271.db2.gz PWNOPDAQKKSSSF-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2ccc(SC)c(F)c2)cs1 ZINC000156426028 1053807377 /nfs/dbraw/zinc/80/73/77/1053807377.db2.gz DIRFNOJUEBHMKQ-JTQLQIEISA-N 1 2 310.463 4.417 20 0 DIADLO Cc1cccc2cc(C[N@H+]3CCOC[C@@H]3C(C)C)c(Cl)nc12 ZINC001231649865 1053816230 /nfs/dbraw/zinc/81/62/30/1053816230.db2.gz QREBLGMFXBKSAM-MRXNPFEDSA-N 1 2 318.848 4.053 20 0 DIADLO Cc1cccc2cc(C[N@@H+]3CCOC[C@@H]3C(C)C)c(Cl)nc12 ZINC001231649865 1053816245 /nfs/dbraw/zinc/81/62/45/1053816245.db2.gz QREBLGMFXBKSAM-MRXNPFEDSA-N 1 2 318.848 4.053 20 0 DIADLO CC(=O)[C@@H]1CCC[N@H+](Cc2ccc(C)c(Cl)c2Cl)C1 ZINC001231667041 1053826617 /nfs/dbraw/zinc/82/66/17/1053826617.db2.gz BTZSDWYDPRDCTL-GFCCVEGCSA-N 1 2 300.229 4.103 20 0 DIADLO CC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(C)c(Cl)c2Cl)C1 ZINC001231667041 1053826627 /nfs/dbraw/zinc/82/66/27/1053826627.db2.gz BTZSDWYDPRDCTL-GFCCVEGCSA-N 1 2 300.229 4.103 20 0 DIADLO c1csc(-c2cc(COc3cccc(-n4cc[nH+]c4)c3)no2)c1 ZINC000156923478 1053830129 /nfs/dbraw/zinc/83/01/29/1053830129.db2.gz BFHXVIFXGDHXOF-UHFFFAOYSA-N 1 2 323.377 4.168 20 0 DIADLO COCc1ccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)o1 ZINC001231695754 1053836636 /nfs/dbraw/zinc/83/66/36/1053836636.db2.gz ZLPCZDGQQKJHMZ-MRXNPFEDSA-N 1 2 307.340 4.041 20 0 DIADLO COCc1ccc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)o1 ZINC001231695754 1053836645 /nfs/dbraw/zinc/83/66/45/1053836645.db2.gz ZLPCZDGQQKJHMZ-MRXNPFEDSA-N 1 2 307.340 4.041 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1nc(C)c2ccccc2n1 ZINC000157186598 1053845007 /nfs/dbraw/zinc/84/50/07/1053845007.db2.gz SGZJUUSFYUSSFY-AWEZNQCLSA-N 1 2 321.424 4.106 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[N@@H+]1CCn2cccc2C1 ZINC001231737586 1053845005 /nfs/dbraw/zinc/84/50/05/1053845005.db2.gz POQPEDQIXJJQPG-UHFFFAOYSA-N 1 2 320.436 4.444 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[N@H+]1CCn2cccc2C1 ZINC001231737586 1053845015 /nfs/dbraw/zinc/84/50/15/1053845015.db2.gz POQPEDQIXJJQPG-UHFFFAOYSA-N 1 2 320.436 4.444 20 0 DIADLO c1ccc(NCc2cc3ccccc3nc2N2CCCCC2)[nH+]c1 ZINC000157422841 1053852977 /nfs/dbraw/zinc/85/29/77/1053852977.db2.gz QEOLVIDZKBNLAN-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO Cc1nn(-c2ccc(C)cc2)c(Cl)c1C[NH+]1CC2(CCC2)C1 ZINC001231771786 1053854892 /nfs/dbraw/zinc/85/48/92/1053854892.db2.gz CVRXXERRSCUVBE-UHFFFAOYSA-N 1 2 315.848 4.128 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(OCC(C)C)cc2)s1 ZINC000274175427 1053859265 /nfs/dbraw/zinc/85/92/65/1053859265.db2.gz IBNGKYIDNBBAPH-STQMWFEESA-N 1 2 319.474 4.293 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2oc3ccccc3c2C)s1 ZINC000274157345 1053859931 /nfs/dbraw/zinc/85/99/31/1053859931.db2.gz FXYCRYNHXGDKPA-WDEREUQCSA-N 1 2 301.415 4.313 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(OCC(C)C)cc2)s1 ZINC000274175421 1053860611 /nfs/dbraw/zinc/86/06/11/1053860611.db2.gz IBNGKYIDNBBAPH-OLZOCXBDSA-N 1 2 319.474 4.293 20 0 DIADLO c1nnc(C[NH2+][C@H](CCCCc2ccccc2)c2ccccc2)[nH]1 ZINC001327520347 1053862050 /nfs/dbraw/zinc/86/20/50/1053862050.db2.gz RXMMDQIOTLOIEJ-LJQANCHMSA-N 1 2 320.440 4.049 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C)c2ccc(F)cc2Cl)c(C)[nH+]1 ZINC001436478105 1053873452 /nfs/dbraw/zinc/87/34/52/1053873452.db2.gz NWNQFVFRZLQYFF-NSHDSACASA-N 1 2 320.795 4.290 20 0 DIADLO CC[C@H](C)CNc1cccc(C[N@H+](C)Cc2cscn2)c1 ZINC000157875233 1053874341 /nfs/dbraw/zinc/87/43/41/1053874341.db2.gz CXGSQZUOJJVDTK-AWEZNQCLSA-N 1 2 303.475 4.233 20 0 DIADLO CC[C@H](C)CNc1cccc(C[N@@H+](C)Cc2cscn2)c1 ZINC000157875233 1053874350 /nfs/dbraw/zinc/87/43/50/1053874350.db2.gz CXGSQZUOJJVDTK-AWEZNQCLSA-N 1 2 303.475 4.233 20 0 DIADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2ccc(C(F)(F)F)c(F)c2F)C1 ZINC001231856991 1053889901 /nfs/dbraw/zinc/88/99/01/1053889901.db2.gz UHFJGXLLCSFRMP-WPRPVWTQSA-N 1 2 311.269 4.164 20 0 DIADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2ccc(C(F)(F)F)c(F)c2F)C1 ZINC001231856991 1053889913 /nfs/dbraw/zinc/88/99/13/1053889913.db2.gz UHFJGXLLCSFRMP-WPRPVWTQSA-N 1 2 311.269 4.164 20 0 DIADLO Cn1cc(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccco2)c(C(F)F)n1 ZINC001327897765 1053891045 /nfs/dbraw/zinc/89/10/45/1053891045.db2.gz MWJUWVXZKGRLDX-OAHLLOKOSA-N 1 2 321.371 4.068 20 0 DIADLO Cn1cc(C[N@H+]2CC3(CCCC3)[C@H]2c2ccco2)c(C(F)F)n1 ZINC001327897765 1053891061 /nfs/dbraw/zinc/89/10/61/1053891061.db2.gz MWJUWVXZKGRLDX-OAHLLOKOSA-N 1 2 321.371 4.068 20 0 DIADLO CCCOc1ncccc1C[N@H+](CC)Cc1ccccc1F ZINC001231864833 1053893973 /nfs/dbraw/zinc/89/39/73/1053893973.db2.gz XFRXMWHDZVEEKV-UHFFFAOYSA-N 1 2 302.393 4.032 20 0 DIADLO CCCOc1ncccc1C[N@@H+](CC)Cc1ccccc1F ZINC001231864833 1053893984 /nfs/dbraw/zinc/89/39/84/1053893984.db2.gz XFRXMWHDZVEEKV-UHFFFAOYSA-N 1 2 302.393 4.032 20 0 DIADLO CC(C)c1cc(N2CCc3ccccc3CC2)nc(C(C)C)[nH+]1 ZINC001472698366 1053895594 /nfs/dbraw/zinc/89/55/94/1053895594.db2.gz OVHMQOJPBOKCPC-UHFFFAOYSA-N 1 2 309.457 4.329 20 0 DIADLO Cc1cc(N(C)C[C@H]2OCCc3ccccc32)[nH+]c2ccccc12 ZINC001327954732 1053898308 /nfs/dbraw/zinc/89/83/08/1053898308.db2.gz ZDWXEPXZTGCLCE-HXUWFJFHSA-N 1 2 318.420 4.293 20 0 DIADLO FC(F)c1cc(C[N@@H+]2CCSC[C@H]2c2ccccc2)ccn1 ZINC001231890092 1053906739 /nfs/dbraw/zinc/90/67/39/1053906739.db2.gz UAENDDGZXHDPSL-INIZCTEOSA-N 1 2 320.408 4.309 20 0 DIADLO FC(F)c1cc(C[N@H+]2CCSC[C@H]2c2ccccc2)ccn1 ZINC001231890092 1053906752 /nfs/dbraw/zinc/90/67/52/1053906752.db2.gz UAENDDGZXHDPSL-INIZCTEOSA-N 1 2 320.408 4.309 20 0 DIADLO CCc1cc(NC[C@H](OC)c2cccc(Cl)c2)nc(CC)[nH+]1 ZINC001472707679 1053909693 /nfs/dbraw/zinc/90/96/93/1053909693.db2.gz WSLIOZYWUCEPJK-HNNXBMFYSA-N 1 2 319.836 4.054 20 0 DIADLO C/C(=C\C(=O)Nc1ccn2cc[nH+]c2c1)c1ccccc1Cl ZINC001436594794 1053914708 /nfs/dbraw/zinc/91/47/08/1053914708.db2.gz AQOUJGJRUSGXJS-ZRDIBKRKSA-N 1 2 311.772 4.030 20 0 DIADLO Cc1cnc2c(c1)C[N@@H+](Cc1ccc3ccnc(Cl)c3c1)CC2 ZINC001231979352 1053927459 /nfs/dbraw/zinc/92/74/59/1053927459.db2.gz SRCWCKOEMSEZLX-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1cnc2c(c1)C[N@H+](Cc1ccc3ccnc(Cl)c3c1)CC2 ZINC001231979352 1053927471 /nfs/dbraw/zinc/92/74/71/1053927471.db2.gz SRCWCKOEMSEZLX-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001231983811 1053929750 /nfs/dbraw/zinc/92/97/50/1053929750.db2.gz DWMWSDQQWXPYHV-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(F)ncc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001231983811 1053929766 /nfs/dbraw/zinc/92/97/66/1053929766.db2.gz DWMWSDQQWXPYHV-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cc(C(F)(F)F)cnc2Cl)[C@@H]1C ZINC001232009198 1053941187 /nfs/dbraw/zinc/94/11/87/1053941187.db2.gz RAAOPYHIHHBTEY-NXEZZACHSA-N 1 2 306.759 4.374 20 0 DIADLO F[C@H]1CCC[N@H+](Cc2cc(C(F)(F)F)cnc2Cl)CC1 ZINC001232005897 1053935253 /nfs/dbraw/zinc/93/52/53/1053935253.db2.gz OZPUVSXKLKTKHH-NSHDSACASA-N 1 2 310.722 4.078 20 0 DIADLO F[C@H]1CCC[N@@H+](Cc2cc(C(F)(F)F)cnc2Cl)CC1 ZINC001232005897 1053935260 /nfs/dbraw/zinc/93/52/60/1053935260.db2.gz OZPUVSXKLKTKHH-NSHDSACASA-N 1 2 310.722 4.078 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cc(C(F)(F)F)cnc2Cl)[C@@H]1C ZINC001232009198 1053941175 /nfs/dbraw/zinc/94/11/75/1053941175.db2.gz RAAOPYHIHHBTEY-NXEZZACHSA-N 1 2 306.759 4.374 20 0 DIADLO CCOc1cncc(C[NH2+][C@H](C)c2c(F)cccc2Cl)c1 ZINC000621339143 1053951166 /nfs/dbraw/zinc/95/11/66/1053951166.db2.gz WXSNDIJZRHLVPP-LLVKDONJSA-N 1 2 308.784 4.124 20 0 DIADLO CC1(C)CCCC[C@@H]1CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001354722197 1053951861 /nfs/dbraw/zinc/95/18/61/1053951861.db2.gz OEONFEAMCOFPBW-OAHLLOKOSA-N 1 2 311.429 4.417 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1c(Cl)n(C)nc1C(F)F ZINC001232056784 1053952642 /nfs/dbraw/zinc/95/26/42/1053952642.db2.gz WMRGNRADRWTAQY-UHFFFAOYSA-N 1 2 319.808 4.095 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1c(Cl)n(C)nc1C(F)F ZINC001232056784 1053952650 /nfs/dbraw/zinc/95/26/50/1053952650.db2.gz WMRGNRADRWTAQY-UHFFFAOYSA-N 1 2 319.808 4.095 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)co1 ZINC000621351315 1053953647 /nfs/dbraw/zinc/95/36/47/1053953647.db2.gz NDKVAVXCXMDVSK-UHFFFAOYSA-N 1 2 310.319 4.171 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2nc(Cl)ccc2F)cc1 ZINC001232159162 1053974774 /nfs/dbraw/zinc/97/47/74/1053974774.db2.gz PZVHZTXMAKGLQP-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2nc(Cl)ccc2F)cc1 ZINC001232159162 1053974788 /nfs/dbraw/zinc/97/47/88/1053974788.db2.gz PZVHZTXMAKGLQP-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CC[N@H+](Cc1ccc(C)c(C)c1)Cc1c(Cl)nccc1OC ZINC001232160201 1053974944 /nfs/dbraw/zinc/97/49/44/1053974944.db2.gz WHQAHUUPFXJMDW-UHFFFAOYSA-N 1 2 318.848 4.383 20 0 DIADLO CC[N@@H+](Cc1ccc(C)c(C)c1)Cc1c(Cl)nccc1OC ZINC001232160201 1053974949 /nfs/dbraw/zinc/97/49/49/1053974949.db2.gz WHQAHUUPFXJMDW-UHFFFAOYSA-N 1 2 318.848 4.383 20 0 DIADLO COc1ccnc(Cl)c1C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC001232153296 1053975593 /nfs/dbraw/zinc/97/55/93/1053975593.db2.gz LKDWHYGSTVBMHR-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccnc(Cl)c1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC001232153296 1053975603 /nfs/dbraw/zinc/97/56/03/1053975603.db2.gz LKDWHYGSTVBMHR-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO FC(F)c1cccc(C[NH2+][C@H]2c3ccccc3OC[C@H]2F)c1 ZINC001329376173 1053986573 /nfs/dbraw/zinc/98/65/73/1053986573.db2.gz RZJUGVJIXUBPMA-ZBFHGGJFSA-N 1 2 307.315 4.186 20 0 DIADLO FC(F)c1cccc(C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)c1 ZINC001329376165 1053987516 /nfs/dbraw/zinc/98/75/16/1053987516.db2.gz RZJUGVJIXUBPMA-GDBMZVCRSA-N 1 2 307.315 4.186 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CCC[C@H]2c2nccs2)ccn1 ZINC001232217725 1053993627 /nfs/dbraw/zinc/99/36/27/1053993627.db2.gz OHBGYHFFTKOYCG-AWEZNQCLSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CCC[C@H]2c2nccs2)ccn1 ZINC001232217725 1053993635 /nfs/dbraw/zinc/99/36/35/1053993635.db2.gz OHBGYHFFTKOYCG-AWEZNQCLSA-N 1 2 301.459 4.173 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001329521159 1053993746 /nfs/dbraw/zinc/99/37/46/1053993746.db2.gz GRYZFGGJBDJLDU-JSGCOSHPSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001329521159 1053993757 /nfs/dbraw/zinc/99/37/57/1053993757.db2.gz GRYZFGGJBDJLDU-JSGCOSHPSA-N 1 2 323.362 4.240 20 0 DIADLO C[N@H+](Cc1ccnc(C(C)(C)C)c1)Cc1cccc(F)c1F ZINC001232220575 1053997140 /nfs/dbraw/zinc/99/71/40/1053997140.db2.gz NWSGYALXKGBLHQ-UHFFFAOYSA-N 1 2 304.384 4.289 20 0 DIADLO C[N@@H+](Cc1ccnc(C(C)(C)C)c1)Cc1cccc(F)c1F ZINC001232220575 1053997150 /nfs/dbraw/zinc/99/71/50/1053997150.db2.gz NWSGYALXKGBLHQ-UHFFFAOYSA-N 1 2 304.384 4.289 20 0 DIADLO Brc1cccc([C@@H]2CCC[N@@H+]2Cc2cnsc2)c1 ZINC001232230839 1053998594 /nfs/dbraw/zinc/99/85/94/1053998594.db2.gz VXXFEPVIHYUUMC-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cccc([C@@H]2CCC[N@H+]2Cc2cnsc2)c1 ZINC001232230839 1053998605 /nfs/dbraw/zinc/99/86/05/1053998605.db2.gz VXXFEPVIHYUUMC-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1ccnc(C(F)(F)F)c1 ZINC001232237485 1053999922 /nfs/dbraw/zinc/99/99/22/1053999922.db2.gz RFLLHDJSVHTAQQ-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1ccnc(C(F)(F)F)c1 ZINC001232237485 1053999939 /nfs/dbraw/zinc/99/99/39/1053999939.db2.gz RFLLHDJSVHTAQQ-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO Cc1cc(Cl)cc(C)c1NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001329846405 1054009543 /nfs/dbraw/zinc/00/95/43/1054009543.db2.gz GBKDSHKLPDCZCU-OAHLLOKOSA-N 1 2 319.836 4.379 20 0 DIADLO Oc1ccc(C[N@@H+]2Cc3cccc(Cl)c3C2)c2cccnc12 ZINC001232277769 1054009962 /nfs/dbraw/zinc/00/99/62/1054009962.db2.gz RRWYXIMIKOISBD-UHFFFAOYSA-N 1 2 310.784 4.110 20 0 DIADLO Oc1ccc(C[N@H+]2Cc3cccc(Cl)c3C2)c2cccnc12 ZINC001232277769 1054009971 /nfs/dbraw/zinc/00/99/71/1054009971.db2.gz RRWYXIMIKOISBD-UHFFFAOYSA-N 1 2 310.784 4.110 20 0 DIADLO CC(C)Oc1cccc([C@@H]([NH2+]CC[C@@H]2CC2(F)F)C(F)F)c1 ZINC000621767313 1054013797 /nfs/dbraw/zinc/01/37/97/1054013797.db2.gz BMWJCXUCXQQTOV-TZMCWYRMSA-N 1 2 319.342 4.415 20 0 DIADLO Cc1cc(N2C[C@@H](C)O[C@@H](CC(F)(F)F)C2)[nH+]c2ccccc12 ZINC001330088541 1054022390 /nfs/dbraw/zinc/02/23/90/1054022390.db2.gz QQQUSMXLLCTTCD-OLZOCXBDSA-N 1 2 324.346 4.089 20 0 DIADLO CSc1cc(C)c(C[N@H+](C)Cc2cccc(F)c2F)cn1 ZINC001232349212 1054026322 /nfs/dbraw/zinc/02/63/22/1054026322.db2.gz BBYANNLHPSVVAS-UHFFFAOYSA-N 1 2 308.397 4.022 20 0 DIADLO CSc1cc(C)c(C[N@@H+](C)Cc2cccc(F)c2F)cn1 ZINC001232349212 1054026335 /nfs/dbraw/zinc/02/63/35/1054026335.db2.gz BBYANNLHPSVVAS-UHFFFAOYSA-N 1 2 308.397 4.022 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cccc(C)c2OC(C)C)no1 ZINC001232388935 1054033336 /nfs/dbraw/zinc/03/33/36/1054033336.db2.gz CBJHIAIHVDHLDQ-GOSISDBHSA-N 1 2 314.429 4.416 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cccc(C)c2OC(C)C)no1 ZINC001232388935 1054033350 /nfs/dbraw/zinc/03/33/50/1054033350.db2.gz CBJHIAIHVDHLDQ-GOSISDBHSA-N 1 2 314.429 4.416 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cccc(CF)n1 ZINC001232540599 1054065197 /nfs/dbraw/zinc/06/51/97/1054065197.db2.gz ITAZXLORLKBBQG-SFHVURJKSA-N 1 2 314.404 4.035 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cccc(CF)n1 ZINC001232540599 1054065211 /nfs/dbraw/zinc/06/52/11/1054065211.db2.gz ITAZXLORLKBBQG-SFHVURJKSA-N 1 2 314.404 4.035 20 0 DIADLO CC(C)(C)c1ncc(CNc2[nH+]c3ccccc3n2C2CC2)cn1 ZINC000671158874 1054065524 /nfs/dbraw/zinc/06/55/24/1054065524.db2.gz PDCCJDLKJYNOLN-UHFFFAOYSA-N 1 2 321.428 4.071 20 0 DIADLO FCc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)n1 ZINC001232539041 1054066791 /nfs/dbraw/zinc/06/67/91/1054066791.db2.gz WWJVUCGQIIBCSO-KRWDZBQOSA-N 1 2 306.331 4.166 20 0 DIADLO FCc1cccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)n1 ZINC001232539041 1054066796 /nfs/dbraw/zinc/06/67/96/1054066796.db2.gz WWJVUCGQIIBCSO-KRWDZBQOSA-N 1 2 306.331 4.166 20 0 DIADLO Cc1nnsc1C[NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl ZINC000293712211 1054069926 /nfs/dbraw/zinc/06/99/26/1054069926.db2.gz PATBJRMHUDGCQH-LURJTMIESA-N 1 2 320.220 4.143 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2cc(F)ccc2F)o1 ZINC000165215797 1054070876 /nfs/dbraw/zinc/07/08/76/1054070876.db2.gz KHMRJZODDKAEPS-MEDUHNTESA-N 1 2 309.356 4.159 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2cc(F)ccc2F)o1 ZINC000165215921 1054071194 /nfs/dbraw/zinc/07/11/94/1054071194.db2.gz KHMRJZODDKAEPS-ZBEGNZNMSA-N 1 2 309.356 4.159 20 0 DIADLO CC1(C)C[N@H+](Cc2ncc(Cl)cc2Cl)CCC1(F)F ZINC001232570146 1054074059 /nfs/dbraw/zinc/07/40/59/1054074059.db2.gz FQXLQSLIUSHIPZ-UHFFFAOYSA-N 1 2 309.187 4.256 20 0 DIADLO CC1(C)C[N@@H+](Cc2ncc(Cl)cc2Cl)CCC1(F)F ZINC001232570146 1054074068 /nfs/dbraw/zinc/07/40/68/1054074068.db2.gz FQXLQSLIUSHIPZ-UHFFFAOYSA-N 1 2 309.187 4.256 20 0 DIADLO Cc1cccc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c1Cl ZINC000165485507 1054079146 /nfs/dbraw/zinc/07/91/46/1054079146.db2.gz GOTYXLXGVXCCKN-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO CCOC(=O)c1ccc(C[N@H+](C)Cc2ccsc2)c(Cl)c1 ZINC001232594912 1054080444 /nfs/dbraw/zinc/08/04/44/1054080444.db2.gz HIFQAJBGYOOAGT-UHFFFAOYSA-N 1 2 323.845 4.210 20 0 DIADLO CCOC(=O)c1ccc(C[N@@H+](C)Cc2ccsc2)c(Cl)c1 ZINC001232594912 1054080456 /nfs/dbraw/zinc/08/04/56/1054080456.db2.gz HIFQAJBGYOOAGT-UHFFFAOYSA-N 1 2 323.845 4.210 20 0 DIADLO C[C@H](c1nc([C@H]2CCC(C)(C)c3ccccc32)no1)n1cc[nH+]c1 ZINC001331515890 1054080562 /nfs/dbraw/zinc/08/05/62/1054080562.db2.gz TZANMSVKPXLOMR-HIFRSBDPSA-N 1 2 322.412 4.079 20 0 DIADLO Fc1nccc(Cl)c1C[NH+]1CCC(Cc2ccccc2)CC1 ZINC001232614423 1054081441 /nfs/dbraw/zinc/08/14/41/1054081441.db2.gz JTNPOZUTHGUANF-UHFFFAOYSA-N 1 2 318.823 4.329 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001331675838 1054086029 /nfs/dbraw/zinc/08/60/29/1054086029.db2.gz LEBWYUNFYFNWSV-GXTWGEPZSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001331675838 1054086043 /nfs/dbraw/zinc/08/60/43/1054086043.db2.gz LEBWYUNFYFNWSV-GXTWGEPZSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cc(F)c(O)c(Br)c1 ZINC001232630189 1054088701 /nfs/dbraw/zinc/08/87/01/1054088701.db2.gz LOCOHEJBRZRPHC-NXEZZACHSA-N 1 2 316.214 4.057 20 0 DIADLO Cc1cccc([C@@H](NC(=O)c2cccc3[nH+]ccn32)C(C)(C)C)c1 ZINC001355237856 1054091668 /nfs/dbraw/zinc/09/16/68/1054091668.db2.gz BIRONTNRRMBAGJ-GOSISDBHSA-N 1 2 321.424 4.160 20 0 DIADLO Oc1c(F)cc(C[NH+]2CCCCCCC2)cc1Br ZINC001232633285 1054092263 /nfs/dbraw/zinc/09/22/63/1054092263.db2.gz IZVWAHQLMQPKRN-UHFFFAOYSA-N 1 2 316.214 4.060 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccc4c(c3)C=CCCC4)ccn12 ZINC001437772547 1054093125 /nfs/dbraw/zinc/09/31/25/1054093125.db2.gz YWFXTUZZAXRWNT-UHFFFAOYSA-N 1 2 317.392 4.245 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cnc(Cl)cc2Br)[C@@H](C)C1 ZINC001232682555 1054098971 /nfs/dbraw/zinc/09/89/71/1054098971.db2.gz DFEGQTWEEHHQOJ-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cnc(Cl)cc2Br)[C@@H](C)C1 ZINC001232682555 1054098963 /nfs/dbraw/zinc/09/89/63/1054098963.db2.gz DFEGQTWEEHHQOJ-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(F)ccc(Cl)c2Br)C1 ZINC001232690248 1054101717 /nfs/dbraw/zinc/10/17/17/1054101717.db2.gz FQRODGLNFJHTGK-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(F)ccc(Cl)c2Br)C1 ZINC001232690248 1054101710 /nfs/dbraw/zinc/10/17/10/1054101710.db2.gz FQRODGLNFJHTGK-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO CC[N@H+](Cc1c(F)ccc(Cl)c1Br)C(C)C ZINC001232692173 1054103020 /nfs/dbraw/zinc/10/30/20/1054103020.db2.gz RDHUWIFNFLMUIU-UHFFFAOYSA-N 1 2 308.622 4.472 20 0 DIADLO CC[N@@H+](Cc1c(F)ccc(Cl)c1Br)C(C)C ZINC001232692173 1054103031 /nfs/dbraw/zinc/10/30/31/1054103031.db2.gz RDHUWIFNFLMUIU-UHFFFAOYSA-N 1 2 308.622 4.472 20 0 DIADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(Br)[nH]2)c1 ZINC001232688347 1054103154 /nfs/dbraw/zinc/10/31/54/1054103154.db2.gz RDMVVMANQXKALC-CQSZACIVSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2ccc(Br)[nH]2)c1 ZINC001232688347 1054103160 /nfs/dbraw/zinc/10/31/60/1054103160.db2.gz RDMVVMANQXKALC-CQSZACIVSA-N 1 2 323.209 4.253 20 0 DIADLO F[C@@H]1C[N@H+](Cc2cc3ccc(Cl)cc3[nH]2)CCCC1(F)F ZINC001232727588 1054106901 /nfs/dbraw/zinc/10/69/01/1054106901.db2.gz DXRTUAFVRZELOH-CQSZACIVSA-N 1 2 316.754 4.391 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2cc3ccc(Cl)cc3[nH]2)CCCC1(F)F ZINC001232727588 1054106903 /nfs/dbraw/zinc/10/69/03/1054106903.db2.gz DXRTUAFVRZELOH-CQSZACIVSA-N 1 2 316.754 4.391 20 0 DIADLO O=C1CC[N@@H+](Cc2cc3ccc(Cl)cc3[nH]2)[C@@H]2CCCC[C@@H]12 ZINC001232726723 1054108376 /nfs/dbraw/zinc/10/83/76/1054108376.db2.gz JOENYJCSFCBINC-NVXWUHKLSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2cc3ccc(Cl)cc3[nH]2)[C@@H]2CCCC[C@@H]12 ZINC001232726723 1054108385 /nfs/dbraw/zinc/10/83/85/1054108385.db2.gz JOENYJCSFCBINC-NVXWUHKLSA-N 1 2 316.832 4.155 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1cccc3ncsc31)C2 ZINC001232735789 1054110991 /nfs/dbraw/zinc/11/09/91/1054110991.db2.gz DAYBVXGBLNYGSH-UHFFFAOYSA-N 1 2 300.814 4.466 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1cccc3ncsc31)C2 ZINC001232735789 1054110993 /nfs/dbraw/zinc/11/09/93/1054110993.db2.gz DAYBVXGBLNYGSH-UHFFFAOYSA-N 1 2 300.814 4.466 20 0 DIADLO CC(C)Cn1nccc1C[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC001332325269 1054114339 /nfs/dbraw/zinc/11/43/39/1054114339.db2.gz OPOIGPDNMZIZKC-CYBMUJFWSA-N 1 2 320.506 4.144 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)[nH]1 ZINC000660238191 1054116600 /nfs/dbraw/zinc/11/66/00/1054116600.db2.gz HYJMDWYLHBBDAW-MEBBXXQBSA-N 1 2 324.831 4.208 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)c(F)c2)nn1 ZINC001332419961 1054119120 /nfs/dbraw/zinc/11/91/20/1054119120.db2.gz HXPLKUQSGOYRCA-GHMZBOCLSA-N 1 2 310.804 4.063 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2ccc(C(F)(F)F)nc2Cl)C1 ZINC001232790872 1054122196 /nfs/dbraw/zinc/12/21/96/1054122196.db2.gz HEHBPKMFAOZZFZ-ZDUSSCGKSA-N 1 2 324.749 4.468 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2ccc(C(F)(F)F)nc2Cl)C1 ZINC001232790872 1054122203 /nfs/dbraw/zinc/12/22/03/1054122203.db2.gz HEHBPKMFAOZZFZ-ZDUSSCGKSA-N 1 2 324.749 4.468 20 0 DIADLO FC(F)(F)c1ccc(C[NH+]2CC3(C2)CCCC3)c(Cl)n1 ZINC001232791604 1054122487 /nfs/dbraw/zinc/12/24/87/1054122487.db2.gz UKPQRWFNHHGYGB-UHFFFAOYSA-N 1 2 304.743 4.130 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3c(F)cncc3F)CCCC2)c(F)c1 ZINC001332727036 1054125425 /nfs/dbraw/zinc/12/54/25/1054125425.db2.gz QXEOXVYADXGAJX-UHFFFAOYSA-N 1 2 324.321 4.197 20 0 DIADLO CCCn1cnc(C[N@H+](C)Cc2cc(Cl)cc(Cl)c2)c1 ZINC001232801923 1054125342 /nfs/dbraw/zinc/12/53/42/1054125342.db2.gz NYMPMLMCQYUMOV-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO CCCn1cnc(C[N@@H+](C)Cc2cc(Cl)cc(Cl)c2)c1 ZINC001232801923 1054125351 /nfs/dbraw/zinc/12/53/51/1054125351.db2.gz NYMPMLMCQYUMOV-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO Cc1ccc(CC[N@@H+]2CCO[C@@H](c3ccc(Cl)s3)C2)cc1 ZINC001332959408 1054133002 /nfs/dbraw/zinc/13/30/02/1054133002.db2.gz WWFWMKQRKHPJIE-OAHLLOKOSA-N 1 2 321.873 4.326 20 0 DIADLO Cc1ccc(CC[N@H+]2CCO[C@@H](c3ccc(Cl)s3)C2)cc1 ZINC001332959408 1054133009 /nfs/dbraw/zinc/13/30/09/1054133009.db2.gz WWFWMKQRKHPJIE-OAHLLOKOSA-N 1 2 321.873 4.326 20 0 DIADLO CC(C)c1ccccc1C[NH2+]Cc1nnc(C(C)(C)C)s1 ZINC000848539355 1054134671 /nfs/dbraw/zinc/13/46/71/1054134671.db2.gz KCBXOAUKFHPELR-UHFFFAOYSA-N 1 2 303.475 4.249 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2ccc(-c3cccc(F)c3)nc2)C[C@H]1F ZINC001232884374 1054138275 /nfs/dbraw/zinc/13/82/75/1054138275.db2.gz FVLMCUOSKYPRGE-QZTJIDSGSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2ccc(-c3cccc(F)c3)nc2)C[C@H]1F ZINC001232884374 1054138280 /nfs/dbraw/zinc/13/82/80/1054138280.db2.gz FVLMCUOSKYPRGE-QZTJIDSGSA-N 1 2 320.358 4.160 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cncc(-c3ccccc3)c2)no1 ZINC001232897817 1054144234 /nfs/dbraw/zinc/14/42/34/1054144234.db2.gz UXVMBMBIYAKHLX-HXUWFJFHSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cncc(-c3ccccc3)c2)no1 ZINC001232897817 1054144238 /nfs/dbraw/zinc/14/42/38/1054144238.db2.gz UXVMBMBIYAKHLX-HXUWFJFHSA-N 1 2 319.408 4.382 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2cncc(-c3ccccc3)c2)C[C@H]1F ZINC001232899793 1054144290 /nfs/dbraw/zinc/14/42/90/1054144290.db2.gz UIQZDLOQZZXHCD-QZTJIDSGSA-N 1 2 302.368 4.021 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2cncc(-c3ccccc3)c2)C[C@H]1F ZINC001232899793 1054144296 /nfs/dbraw/zinc/14/42/96/1054144296.db2.gz UIQZDLOQZZXHCD-QZTJIDSGSA-N 1 2 302.368 4.021 20 0 DIADLO O=C(CC(C1CCC1)C1CCC1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001355481803 1054149281 /nfs/dbraw/zinc/14/92/81/1054149281.db2.gz FXWASSULRILYOE-UHFFFAOYSA-N 1 2 323.440 4.417 20 0 DIADLO Oc1c(F)ccc(C[N@H+](Cc2ccccc2)C2CCC2)c1F ZINC001232941078 1054152341 /nfs/dbraw/zinc/15/23/41/1054152341.db2.gz URBWQMJKCBNMIT-UHFFFAOYSA-N 1 2 303.352 4.225 20 0 DIADLO Oc1c(F)ccc(C[N@@H+](Cc2ccccc2)C2CCC2)c1F ZINC001232941078 1054152349 /nfs/dbraw/zinc/15/23/49/1054152349.db2.gz URBWQMJKCBNMIT-UHFFFAOYSA-N 1 2 303.352 4.225 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1ccccc1OCC(C)C ZINC001333555593 1054158643 /nfs/dbraw/zinc/15/86/43/1054158643.db2.gz OPFXFXHSXCVNSJ-INIZCTEOSA-N 1 2 314.429 4.185 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(O)c(F)c(F)c2)cc1 ZINC001232970524 1054163906 /nfs/dbraw/zinc/16/39/06/1054163906.db2.gz FSBJXIBICROZBI-INIZCTEOSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc(O)c(F)c(F)c2)cc1 ZINC001232970524 1054163913 /nfs/dbraw/zinc/16/39/13/1054163913.db2.gz FSBJXIBICROZBI-INIZCTEOSA-N 1 2 303.352 4.316 20 0 DIADLO CCC1CC[NH+](Cc2ccc(Cl)c(Br)n2)CC1 ZINC001233087870 1054184143 /nfs/dbraw/zinc/18/41/43/1054184143.db2.gz BLITVFBSHVXOFY-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]CCCC(F)(F)F)cc2)C[C@H](C)O1 ZINC001333697405 1054168382 /nfs/dbraw/zinc/16/83/82/1054168382.db2.gz OGEZRQICRRFUTB-BETUJISGSA-N 1 2 316.367 4.055 20 0 DIADLO Cc1ncc(F)cc1C[N@@H+]1CCc2cc(C(F)(F)F)ccc2C1 ZINC001232990741 1054169129 /nfs/dbraw/zinc/16/91/29/1054169129.db2.gz PAZMAWMBNMFVCP-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1ncc(F)cc1C[N@H+]1CCc2cc(C(F)(F)F)ccc2C1 ZINC001232990741 1054169135 /nfs/dbraw/zinc/16/91/35/1054169135.db2.gz PAZMAWMBNMFVCP-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Oc1cnc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001233038740 1054172984 /nfs/dbraw/zinc/17/29/84/1054172984.db2.gz GUWCKHICPXZIAM-CQSZACIVSA-N 1 2 324.758 4.056 20 0 DIADLO Oc1cnc(Cl)cc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001233038740 1054172989 /nfs/dbraw/zinc/17/29/89/1054172989.db2.gz GUWCKHICPXZIAM-CQSZACIVSA-N 1 2 324.758 4.056 20 0 DIADLO CCOC(=O)c1ccsc1C[N@H+](CC)Cc1ccc(F)cc1 ZINC001233021691 1054173338 /nfs/dbraw/zinc/17/33/38/1054173338.db2.gz QMCWINCEHJPVGM-UHFFFAOYSA-N 1 2 321.417 4.086 20 0 DIADLO CCOC(=O)c1ccsc1C[N@@H+](CC)Cc1ccc(F)cc1 ZINC001233021691 1054173342 /nfs/dbraw/zinc/17/33/42/1054173342.db2.gz QMCWINCEHJPVGM-UHFFFAOYSA-N 1 2 321.417 4.086 20 0 DIADLO Oc1cnc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001233035216 1054173607 /nfs/dbraw/zinc/17/36/07/1054173607.db2.gz ZUEHPFUKXNTYAM-CQSZACIVSA-N 1 2 324.758 4.056 20 0 DIADLO Oc1cnc(Cl)cc1C[N@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001233035216 1054173616 /nfs/dbraw/zinc/17/36/16/1054173616.db2.gz ZUEHPFUKXNTYAM-CQSZACIVSA-N 1 2 324.758 4.056 20 0 DIADLO Oc1cccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)c1F ZINC001233052086 1054177758 /nfs/dbraw/zinc/17/77/58/1054177758.db2.gz FVRXVVHGFIOETG-MRXNPFEDSA-N 1 2 303.352 4.398 20 0 DIADLO Oc1cccc(C[N@H+]2CCCC[C@@H]2c2ccccc2F)c1F ZINC001233052086 1054177760 /nfs/dbraw/zinc/17/77/60/1054177760.db2.gz FVRXVVHGFIOETG-MRXNPFEDSA-N 1 2 303.352 4.398 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccc(Cl)c(Br)n1 ZINC001233090008 1054183462 /nfs/dbraw/zinc/18/34/62/1054183462.db2.gz DOALFCRXWUYFKG-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCCCC[N@@H+]1Cc1ccc(Cl)c(Br)n1 ZINC001233091127 1054183937 /nfs/dbraw/zinc/18/39/37/1054183937.db2.gz HBCYGHSABQXOFX-SNVBAGLBSA-N 1 2 317.658 4.262 20 0 DIADLO C[C@@H]1CCCCC[N@H+]1Cc1ccc(Cl)c(Br)n1 ZINC001233091127 1054183942 /nfs/dbraw/zinc/18/39/42/1054183942.db2.gz HBCYGHSABQXOFX-SNVBAGLBSA-N 1 2 317.658 4.262 20 0 DIADLO Fc1ccc2c(c1)[nH]nc2C[N@@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC001233123828 1054188067 /nfs/dbraw/zinc/18/80/67/1054188067.db2.gz CWSPRKCDWXAHSS-MRXNPFEDSA-N 1 2 323.415 4.157 20 0 DIADLO Fc1ccc2c(c1)[nH]nc2C[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC001233123828 1054188069 /nfs/dbraw/zinc/18/80/69/1054188069.db2.gz CWSPRKCDWXAHSS-MRXNPFEDSA-N 1 2 323.415 4.157 20 0 DIADLO Fc1ccc2c(c1)[nH]nc2C[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC001233124326 1054188485 /nfs/dbraw/zinc/18/84/85/1054188485.db2.gz ILWPTWYAFLEICD-OAHLLOKOSA-N 1 2 309.388 4.082 20 0 DIADLO Fc1ccc2c(c1)[nH]nc2C[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC001233124326 1054188492 /nfs/dbraw/zinc/18/84/92/1054188492.db2.gz ILWPTWYAFLEICD-OAHLLOKOSA-N 1 2 309.388 4.082 20 0 DIADLO CCC[C@@H]([NH2+]Cc1cccnc1OCC)c1ncccc1Cl ZINC001334354997 1054188838 /nfs/dbraw/zinc/18/88/38/1054188838.db2.gz CNZWYACFTAVYKM-OAHLLOKOSA-N 1 2 319.836 4.160 20 0 DIADLO Cc1nc(C[NH+]2CCC(C(C)C)CC2)c(Br)s1 ZINC001233160049 1054190902 /nfs/dbraw/zinc/19/09/02/1054190902.db2.gz RCKXKLVFNQAHLT-UHFFFAOYSA-N 1 2 317.296 4.082 20 0 DIADLO Cc1c[nH]c(=O)c(C[N@@H+](C)Cc2c(Cl)cccc2Cl)c1 ZINC001233192449 1054198437 /nfs/dbraw/zinc/19/84/37/1054198437.db2.gz GISGPNZGBNDJTL-UHFFFAOYSA-N 1 2 311.212 4.034 20 0 DIADLO Cc1c[nH]c(=O)c(C[N@H+](C)Cc2c(Cl)cccc2Cl)c1 ZINC001233192449 1054198443 /nfs/dbraw/zinc/19/84/43/1054198443.db2.gz GISGPNZGBNDJTL-UHFFFAOYSA-N 1 2 311.212 4.034 20 0 DIADLO CC(C)c1nsc(C[NH2+][C@@H](C)c2ccc3ncsc3c2)n1 ZINC001334797829 1054199839 /nfs/dbraw/zinc/19/98/39/1054199839.db2.gz GRCSHGXUWVYXDU-JTQLQIEISA-N 1 2 318.471 4.122 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(Cl)c(F)c2F)CCC1(F)F ZINC001233207990 1054200266 /nfs/dbraw/zinc/20/02/66/1054200266.db2.gz SVDBUESJRXCGES-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)c(F)c2F)CCC1(F)F ZINC001233207990 1054200276 /nfs/dbraw/zinc/20/02/76/1054200276.db2.gz SVDBUESJRXCGES-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO Fc1c(Cl)ccc(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c1F ZINC001233210630 1054201025 /nfs/dbraw/zinc/20/10/25/1054201025.db2.gz JPZTWEZLOWJIMX-CQSZACIVSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1c(Cl)ccc(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c1F ZINC001233210630 1054201036 /nfs/dbraw/zinc/20/10/36/1054201036.db2.gz JPZTWEZLOWJIMX-CQSZACIVSA-N 1 2 323.770 4.272 20 0 DIADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC001233218460 1054203667 /nfs/dbraw/zinc/20/36/67/1054203667.db2.gz AKWALHZGJFAIJM-ZDUSSCGKSA-N 1 2 317.816 4.000 20 0 DIADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC001233218460 1054203677 /nfs/dbraw/zinc/20/36/77/1054203677.db2.gz AKWALHZGJFAIJM-ZDUSSCGKSA-N 1 2 317.816 4.000 20 0 DIADLO COc1ccccc1C1([NH2+][C@H]2CCCc3scnc32)CCC1 ZINC001334908382 1054204854 /nfs/dbraw/zinc/20/48/54/1054204854.db2.gz WSWSPNHXCOVJJS-AWEZNQCLSA-N 1 2 314.454 4.198 20 0 DIADLO CCc1nnc(C[N@@H+]2C[C@H]3CCCC[C@@]32c2ccccc2)s1 ZINC001334885413 1054204983 /nfs/dbraw/zinc/20/49/83/1054204983.db2.gz ODLFRLCJAJZQNC-CRAIPNDOSA-N 1 2 313.470 4.002 20 0 DIADLO CCc1nnc(C[N@H+]2C[C@H]3CCCC[C@@]32c2ccccc2)s1 ZINC001334885413 1054204998 /nfs/dbraw/zinc/20/49/98/1054204998.db2.gz ODLFRLCJAJZQNC-CRAIPNDOSA-N 1 2 313.470 4.002 20 0 DIADLO C[N@H+](Cc1cnn2ccccc12)Cc1ccc(Cl)cc1Cl ZINC001233235905 1054213796 /nfs/dbraw/zinc/21/37/96/1054213796.db2.gz HMSZGQRAPMFTAB-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1cnn2ccccc12)Cc1ccc(Cl)cc1Cl ZINC001233235905 1054213808 /nfs/dbraw/zinc/21/38/08/1054213808.db2.gz HMSZGQRAPMFTAB-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO CC[C@H]([NH2+]Cc1cnc(-c2ccccc2)o1)c1nc(C)cs1 ZINC001335765815 1054224669 /nfs/dbraw/zinc/22/46/69/1054224669.db2.gz UROLAEUZFDOKRO-HNNXBMFYSA-N 1 2 313.426 4.347 20 0 DIADLO Cc1cc(N)nc(S[C@H](C)CCSc2ccccc2)[nH+]1 ZINC000473686487 1054227838 /nfs/dbraw/zinc/22/78/38/1054227838.db2.gz KIZCQIYLNBSJHH-GFCCVEGCSA-N 1 2 305.472 4.030 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(Cc2ccccc2)cc1 ZINC001233329666 1054232686 /nfs/dbraw/zinc/23/26/86/1054232686.db2.gz GXDNZQKKLALDQV-OALUTQOASA-N 1 2 301.380 4.159 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(Cc2ccccc2)cc1 ZINC001233329666 1054232699 /nfs/dbraw/zinc/23/26/99/1054232699.db2.gz GXDNZQKKLALDQV-OALUTQOASA-N 1 2 301.380 4.159 20 0 DIADLO COc1cc(F)c(C[N@H+]2Cc3ccccc3[C@H](C)C2)cc1F ZINC001233340997 1054237284 /nfs/dbraw/zinc/23/72/84/1054237284.db2.gz ZAAPFYUVHLLHOP-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(C[N@@H+]2Cc3ccccc3[C@H](C)C2)cc1F ZINC001233340997 1054237291 /nfs/dbraw/zinc/23/72/91/1054237291.db2.gz ZAAPFYUVHLLHOP-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2cc(Br)ncc2Cl)[C@H]1C ZINC001233427151 1054271895 /nfs/dbraw/zinc/27/18/95/1054271895.db2.gz LGYDZSPKJAAWIY-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cc1F ZINC001233340938 1054239609 /nfs/dbraw/zinc/23/96/09/1054239609.db2.gz WZIWMYGASXCAEA-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cc1F ZINC001233340938 1054239624 /nfs/dbraw/zinc/23/96/24/1054239624.db2.gz WZIWMYGASXCAEA-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2cc(Br)ncc2Cl)[C@H]1C ZINC001233427151 1054271902 /nfs/dbraw/zinc/27/19/02/1054271902.db2.gz LGYDZSPKJAAWIY-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO Fc1ccc2[nH]c3c(c2c1)C[N@H+](CCCC(F)(F)F)CC3 ZINC001336655986 1054241318 /nfs/dbraw/zinc/24/13/18/1054241318.db2.gz PVPSIZXUZLLHNX-UHFFFAOYSA-N 1 2 300.299 4.008 20 0 DIADLO Fc1ccc2[nH]c3c(c2c1)C[N@@H+](CCCC(F)(F)F)CC3 ZINC001336655986 1054241322 /nfs/dbraw/zinc/24/13/22/1054241322.db2.gz PVPSIZXUZLLHNX-UHFFFAOYSA-N 1 2 300.299 4.008 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1c(Cl)cccc1SC ZINC001233350572 1054244732 /nfs/dbraw/zinc/24/47/32/1054244732.db2.gz LPVOQLUROCLAES-UHFFFAOYSA-N 1 2 306.862 4.479 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1c(Cl)cccc1SC ZINC001233350572 1054244747 /nfs/dbraw/zinc/24/47/47/1054244747.db2.gz LPVOQLUROCLAES-UHFFFAOYSA-N 1 2 306.862 4.479 20 0 DIADLO CSCc1cnc(C[N@@H+](Cc2ccccn2)CC(C)C)s1 ZINC001336854778 1054248098 /nfs/dbraw/zinc/24/80/98/1054248098.db2.gz PKUXYEPABDVTKK-UHFFFAOYSA-N 1 2 321.515 4.059 20 0 DIADLO CSCc1cnc(C[N@H+](Cc2ccccn2)CC(C)C)s1 ZINC001336854778 1054248113 /nfs/dbraw/zinc/24/81/13/1054248113.db2.gz PKUXYEPABDVTKK-UHFFFAOYSA-N 1 2 321.515 4.059 20 0 DIADLO c1ccc(OC2CCN(c3[nH+]ccc4ccccc43)CC2)cc1 ZINC001336917035 1054251028 /nfs/dbraw/zinc/25/10/28/1054251028.db2.gz XGFSIVGMQHJPMM-UHFFFAOYSA-N 1 2 304.393 4.283 20 0 DIADLO Oc1ccc(F)c(C[N@H+](Cc2ccccc2)C2CCC2)c1F ZINC001233397290 1054260524 /nfs/dbraw/zinc/26/05/24/1054260524.db2.gz SEIRSMGHZMTJGI-UHFFFAOYSA-N 1 2 303.352 4.225 20 0 DIADLO CC(C)(C)[N@H+](Cc1ccccc1)Cc1c(F)ccc(O)c1F ZINC001233393107 1054261277 /nfs/dbraw/zinc/26/12/77/1054261277.db2.gz BKLGCVMLCALYCQ-UHFFFAOYSA-N 1 2 305.368 4.471 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(Br)ncc1Cl ZINC001233427152 1054269561 /nfs/dbraw/zinc/26/95/61/1054269561.db2.gz LGYDZSPKJAAWIY-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc(Br)ncc1Cl ZINC001233427152 1054269566 /nfs/dbraw/zinc/26/95/66/1054269566.db2.gz LGYDZSPKJAAWIY-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1ccn(C(=O)OC(C)(C)C)c1)C2 ZINC001233429518 1054270689 /nfs/dbraw/zinc/27/06/89/1054270689.db2.gz DMXOJCLDXWDTDC-UHFFFAOYSA-N 1 2 312.413 4.096 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1ccn(C(=O)OC(C)(C)C)c1)C2 ZINC001233429518 1054270698 /nfs/dbraw/zinc/27/06/98/1054270698.db2.gz DMXOJCLDXWDTDC-UHFFFAOYSA-N 1 2 312.413 4.096 20 0 DIADLO COc1ccc(C(C)(C)C)cc1NCc1c[nH+]cn1C(C)C ZINC000387458249 1054275064 /nfs/dbraw/zinc/27/50/64/1054275064.db2.gz SMJRVQXTIYKHCX-UHFFFAOYSA-N 1 2 301.434 4.382 20 0 DIADLO CC[C@@H]1c2ccsc2CCN1C(=O)c1c(C)cc(C)[nH+]c1C ZINC001356110835 1054282207 /nfs/dbraw/zinc/28/22/07/1054282207.db2.gz FFWPTERSTXSPBZ-OAHLLOKOSA-N 1 2 314.454 4.218 20 0 DIADLO Cc1cc(NCc2ccc(-n3ccnc3)cc2)[nH+]c2ccccc12 ZINC001337883186 1054292045 /nfs/dbraw/zinc/29/20/45/1054292045.db2.gz KZBSNPBXDHZGFR-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Cn1c(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)cnc1Cl ZINC000848915426 1054296153 /nfs/dbraw/zinc/29/61/53/1054296153.db2.gz VZEPQQHLQOPLKH-MRXNPFEDSA-N 1 2 315.848 4.191 20 0 DIADLO Cn1c(C[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)cnc1Cl ZINC000848915426 1054296165 /nfs/dbraw/zinc/29/61/65/1054296165.db2.gz VZEPQQHLQOPLKH-MRXNPFEDSA-N 1 2 315.848 4.191 20 0 DIADLO CCn1nc(C[NH2+]Cc2cccc(Cl)c2F)c2ccccc21 ZINC001338187063 1054299088 /nfs/dbraw/zinc/29/90/88/1054299088.db2.gz RSCFUWJTBXFBOH-UHFFFAOYSA-N 1 2 317.795 4.139 20 0 DIADLO COc1nc(C)cc(C)c1CNc1cc(C)c2ccccc2[nH+]1 ZINC001338396058 1054304171 /nfs/dbraw/zinc/30/41/71/1054304171.db2.gz MQDBJAMLNIXOES-UHFFFAOYSA-N 1 2 307.397 4.176 20 0 DIADLO Cc1cc(C[N@H+](Cc2cccnc2)Cc2ccccn2)sc1C ZINC001233684006 1054331911 /nfs/dbraw/zinc/33/19/11/1054331911.db2.gz CXNIZAUCBCKLBE-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO Cc1cc(C[N@@H+](Cc2cccnc2)Cc2ccccn2)sc1C ZINC001233684006 1054331922 /nfs/dbraw/zinc/33/19/22/1054331922.db2.gz CXNIZAUCBCKLBE-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@H+](Cc2ncc(-c3cccs3)o2)C1 ZINC000171757743 1054386596 /nfs/dbraw/zinc/38/65/96/1054386596.db2.gz VQNPLTJBHFOHFS-JTQLQIEISA-N 1 2 316.348 4.177 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@@H+](Cc2ncc(-c3cccs3)o2)C1 ZINC000171757743 1054386606 /nfs/dbraw/zinc/38/66/06/1054386606.db2.gz VQNPLTJBHFOHFS-JTQLQIEISA-N 1 2 316.348 4.177 20 0 DIADLO COc1cccc(CNc2[nH+]c3ccccc3n2C2CCCC2)n1 ZINC000478559489 1054386791 /nfs/dbraw/zinc/38/67/91/1054386791.db2.gz NGLUMFFAFUOUCV-UHFFFAOYSA-N 1 2 322.412 4.167 20 0 DIADLO Cc1cccc2nc(NCc3cc[nH+]c(N4CCCC4)c3)sc21 ZINC000479929821 1054391869 /nfs/dbraw/zinc/39/18/69/1054391869.db2.gz WNVDWJZIDVSEQI-UHFFFAOYSA-N 1 2 324.453 4.212 20 0 DIADLO COc1cccc2cc(CNc3nc(C)[nH+]c4c3CCCC4)oc21 ZINC001342117751 1054416970 /nfs/dbraw/zinc/41/69/70/1054416970.db2.gz DVRKVVCRSKSAJR-UHFFFAOYSA-N 1 2 323.396 4.031 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(CCC(C)C)no1)c1ccc(F)cc1 ZINC001342228563 1054419102 /nfs/dbraw/zinc/41/91/02/1054419102.db2.gz KTBMDXMRZQCSNX-HNNXBMFYSA-N 1 2 305.397 4.038 20 0 DIADLO C[Si](C)(C)CCCC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001442515789 1054422754 /nfs/dbraw/zinc/42/27/54/1054422754.db2.gz HMRHSZCCARSDHP-UHFFFAOYSA-N 1 2 301.466 4.134 20 0 DIADLO Cc1cc(NCc2ccc(C(C)(C)O)cc2)[nH+]c2ccccc12 ZINC001342877690 1054432002 /nfs/dbraw/zinc/43/20/02/1054432002.db2.gz WUWZQWAEROJKMD-UHFFFAOYSA-N 1 2 306.409 4.383 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2c(Cl)nccc2N(C)C)cc1C ZINC001234150877 1054441513 /nfs/dbraw/zinc/44/15/13/1054441513.db2.gz MIPLIQLXTSNBNA-UHFFFAOYSA-N 1 2 317.864 4.050 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2c(Cl)nccc2N(C)C)cc1C ZINC001234150877 1054441525 /nfs/dbraw/zinc/44/15/25/1054441525.db2.gz MIPLIQLXTSNBNA-UHFFFAOYSA-N 1 2 317.864 4.050 20 0 DIADLO Cc1cc(NC(=O)C[C@@H](C)c2ccccc2)ccc1-n1cc[nH+]c1 ZINC001443310645 1054444357 /nfs/dbraw/zinc/44/43/57/1054444357.db2.gz IEUCBAHMYNGPJU-OAHLLOKOSA-N 1 2 319.408 4.313 20 0 DIADLO Cc1cc(NC(=O)[C@H]2CCC(C)=C(C)C2)ccc1-n1cc[nH+]c1 ZINC001443310704 1054445563 /nfs/dbraw/zinc/44/55/63/1054445563.db2.gz KQXCUFGZQJPABS-INIZCTEOSA-N 1 2 309.413 4.256 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@@H]1CCC[C@H]2CCCC[C@@H]21 ZINC001357288497 1054451889 /nfs/dbraw/zinc/45/18/89/1054451889.db2.gz AWUIVCRVPHBQPT-AYOQOUSVSA-N 1 2 323.440 4.417 20 0 DIADLO FCCCCC[N@@H+]1CCc2cc(Br)cc(F)c2C1 ZINC000671242667 1054452061 /nfs/dbraw/zinc/45/20/61/1054452061.db2.gz CXIBNSPMMUWAIN-UHFFFAOYSA-N 1 2 318.205 4.086 20 0 DIADLO FCCCCC[N@H+]1CCc2cc(Br)cc(F)c2C1 ZINC000671242667 1054452064 /nfs/dbraw/zinc/45/20/64/1054452064.db2.gz CXIBNSPMMUWAIN-UHFFFAOYSA-N 1 2 318.205 4.086 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@@H](F)CC1CCCCC1 ZINC001357289633 1054453708 /nfs/dbraw/zinc/45/37/08/1054453708.db2.gz MYPQVCFCQHNOPR-KRWDZBQOSA-N 1 2 315.392 4.119 20 0 DIADLO CC(C)C[C@@H](C(=O)N[C@@H](C)CCC1CCCCC1)n1cc[nH+]c1 ZINC001443972896 1054464584 /nfs/dbraw/zinc/46/45/84/1054464584.db2.gz ILDBZUZEEURJDD-WMZOPIPTSA-N 1 2 319.493 4.336 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(SC(C)(C)C)c(F)c1)n1cc[nH+]c1 ZINC001344389353 1054466761 /nfs/dbraw/zinc/46/67/61/1054466761.db2.gz BBOUSJZWJWVNBH-NSHDSACASA-N 1 2 321.421 4.113 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(C(C)(C)C)s2)c(N(C)C)[nH+]1 ZINC001357393855 1054470963 /nfs/dbraw/zinc/47/09/63/1054470963.db2.gz DJWNWXNYSLYQBN-UHFFFAOYSA-N 1 2 317.458 4.067 20 0 DIADLO c1ccc(C[NH+]2CC(Oc3cncc(-c4ccccc4)c3)C2)cc1 ZINC001234267144 1054480090 /nfs/dbraw/zinc/48/00/90/1054480090.db2.gz FLBRWTAONHWTGW-UHFFFAOYSA-N 1 2 316.404 4.012 20 0 DIADLO CC[C@@H](c1ccccc1)N(C(=O)CCCn1cc[nH+]c1)C(C)C ZINC000622975644 1054496467 /nfs/dbraw/zinc/49/64/67/1054496467.db2.gz QCOXCRVLDNDZIE-SFHVURJKSA-N 1 2 313.445 4.052 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccc(-c3ccc(F)cc3C)o2)s1 ZINC000174572985 1054512411 /nfs/dbraw/zinc/51/24/11/1054512411.db2.gz NKTYZOHPVFIXAV-UHFFFAOYSA-N 1 2 316.401 4.449 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@H]2CCC(=O)c3ccccc32)cc1 ZINC001234588015 1054551665 /nfs/dbraw/zinc/55/16/65/1054551665.db2.gz HXGQVLXBGRCMOC-SFHVURJKSA-N 1 2 309.365 4.145 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@H](C)COc2ccc(C)cc2)cc1 ZINC001234588687 1054551943 /nfs/dbraw/zinc/55/19/43/1054551943.db2.gz PVITWHGACSGHAY-OAHLLOKOSA-N 1 2 313.397 4.203 20 0 DIADLO C[N@H+](CCc1ccccc1Cl)Cc1c(F)ccnc1Cl ZINC001238229641 1054552694 /nfs/dbraw/zinc/55/26/94/1054552694.db2.gz JFEPGEYNCQKFKT-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1ccccc1Cl)Cc1c(F)ccnc1Cl ZINC001238229641 1054552704 /nfs/dbraw/zinc/55/27/04/1054552704.db2.gz JFEPGEYNCQKFKT-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001358056033 1054588861 /nfs/dbraw/zinc/58/88/61/1054588861.db2.gz KLJLCFPQZTYXGY-CXAGYDPISA-N 1 2 317.820 4.146 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(F)cc(F)cc2Br)C2(CC2)C1 ZINC001234771403 1054588906 /nfs/dbraw/zinc/58/89/06/1054588906.db2.gz PIFODMIJQYWTBF-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(F)cc(F)cc2Br)C2(CC2)C1 ZINC001234771403 1054588919 /nfs/dbraw/zinc/58/89/19/1054588919.db2.gz PIFODMIJQYWTBF-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO CC[N@H+](CC(=O)NC1(CC)CCCC1)Cc1ccccc1Cl ZINC001449910739 1054633606 /nfs/dbraw/zinc/63/36/06/1054633606.db2.gz LMRIODQHOWZBKK-UHFFFAOYSA-N 1 2 322.880 4.001 20 0 DIADLO CC[N@@H+](CC(=O)NC1(CC)CCCC1)Cc1ccccc1Cl ZINC001449910739 1054633617 /nfs/dbraw/zinc/63/36/17/1054633617.db2.gz LMRIODQHOWZBKK-UHFFFAOYSA-N 1 2 322.880 4.001 20 0 DIADLO C[C@@H]([NH2+]Cc1cn2ccsc2n1)c1ccc(F)cc1Cl ZINC000177759227 1054633547 /nfs/dbraw/zinc/63/35/47/1054633547.db2.gz QMSRGKWBHBMBQF-SECBINFHSA-N 1 2 309.797 4.039 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1cc(F)cc(F)c1 ZINC000177970583 1054638216 /nfs/dbraw/zinc/63/82/16/1054638216.db2.gz FBVBIQBPRQZVIB-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO CCC(CC)N(CC)C(=O)C[N@H+](CC)Cc1ccccc1Cl ZINC001450551193 1054651014 /nfs/dbraw/zinc/65/10/14/1054651014.db2.gz CCLSDDNWXJOYIH-UHFFFAOYSA-N 1 2 324.896 4.199 20 0 DIADLO CCC(CC)N(CC)C(=O)C[N@@H+](CC)Cc1ccccc1Cl ZINC001450551193 1054651022 /nfs/dbraw/zinc/65/10/22/1054651022.db2.gz CCLSDDNWXJOYIH-UHFFFAOYSA-N 1 2 324.896 4.199 20 0 DIADLO c1ccc([C@H]2CCN(c3[nH+]ccc4ccccc43)CCO2)cc1 ZINC001348519275 1054652755 /nfs/dbraw/zinc/65/27/55/1054652755.db2.gz HUVYBCQCKAXIEL-LJQANCHMSA-N 1 2 304.393 4.203 20 0 DIADLO C[N@H+](Cc1nc(C(F)(F)F)cs1)[C@H]1CCc2ccccc21 ZINC000178588169 1054654130 /nfs/dbraw/zinc/65/41/30/1054654130.db2.gz MWZCMXSXVXILHW-LBPRGKRZSA-N 1 2 312.360 4.281 20 0 DIADLO C[N@@H+](Cc1nc(C(F)(F)F)cs1)[C@H]1CCc2ccccc21 ZINC000178588169 1054654135 /nfs/dbraw/zinc/65/41/35/1054654135.db2.gz MWZCMXSXVXILHW-LBPRGKRZSA-N 1 2 312.360 4.281 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1cccc(N3CCCC3)c1)C2 ZINC001235098939 1054656089 /nfs/dbraw/zinc/65/60/89/1054656089.db2.gz NMPPBIJASRVJTQ-UHFFFAOYSA-N 1 2 312.844 4.456 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1cccc(N3CCCC3)c1)C2 ZINC001235098939 1054656100 /nfs/dbraw/zinc/65/61/00/1054656100.db2.gz NMPPBIJASRVJTQ-UHFFFAOYSA-N 1 2 312.844 4.456 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@H](C)C(C)(C)C2)sc1Br ZINC001473365933 1054659118 /nfs/dbraw/zinc/65/91/18/1054659118.db2.gz XMSJPKKHOWZDBI-VIFPVBQESA-N 1 2 317.296 4.082 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@H](C)C(C)(C)C2)sc1Br ZINC001473365933 1054659120 /nfs/dbraw/zinc/65/91/20/1054659120.db2.gz XMSJPKKHOWZDBI-VIFPVBQESA-N 1 2 317.296 4.082 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H]2C[C@@H](C(C)C)c3ccccc32)nn1C ZINC000623706967 1054662668 /nfs/dbraw/zinc/66/26/68/1054662668.db2.gz UUHFJEZWTAQHRP-HOTGVXAUSA-N 1 2 317.864 4.356 20 0 DIADLO COC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc(-c2ccsc2)cs1 ZINC001235176689 1054673845 /nfs/dbraw/zinc/67/38/45/1054673845.db2.gz NAAYHAFNUXXYRE-HNNXBMFYSA-N 1 2 321.467 4.004 20 0 DIADLO COC(=O)[C@@H]1CCCC[N@H+]1Cc1cc(-c2ccsc2)cs1 ZINC001235176689 1054673850 /nfs/dbraw/zinc/67/38/50/1054673850.db2.gz NAAYHAFNUXXYRE-HNNXBMFYSA-N 1 2 321.467 4.004 20 0 DIADLO CC1(F)CC[NH+](Cc2nc(Cl)ccc2C(F)(F)F)CC1 ZINC001235226337 1054686532 /nfs/dbraw/zinc/68/65/32/1054686532.db2.gz DTOLKIQZKGAKTE-UHFFFAOYSA-N 1 2 310.722 4.078 20 0 DIADLO CCc1cccc(C[N@@H+]2CCSC[C@@H]2c2ccc(F)cc2)n1 ZINC001235261394 1054694767 /nfs/dbraw/zinc/69/47/67/1054694767.db2.gz RYFIDAYKSHFTII-GOSISDBHSA-N 1 2 316.445 4.073 20 0 DIADLO CCc1cccc(C[N@H+]2CCSC[C@@H]2c2ccc(F)cc2)n1 ZINC001235261394 1054694775 /nfs/dbraw/zinc/69/47/75/1054694775.db2.gz RYFIDAYKSHFTII-GOSISDBHSA-N 1 2 316.445 4.073 20 0 DIADLO CCCCc1nc(C[NH2+]C2(c3cccc(F)c3)CC2)cs1 ZINC000179690373 1054696343 /nfs/dbraw/zinc/69/63/43/1054696343.db2.gz IVYJBNHJZUCNOW-UHFFFAOYSA-N 1 2 304.434 4.404 20 0 DIADLO Cc1cnc(F)c(C[N@H+](C)Cc2cccc(C(F)(F)F)c2)c1 ZINC001235334694 1054701590 /nfs/dbraw/zinc/70/15/90/1054701590.db2.gz NEQXUCSLGKBGPX-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1cnc(F)c(C[N@@H+](C)Cc2cccc(C(F)(F)F)c2)c1 ZINC001235334694 1054701607 /nfs/dbraw/zinc/70/16/07/1054701607.db2.gz NEQXUCSLGKBGPX-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1)Cc1cc(F)c(F)c(F)c1F ZINC001235347390 1054702499 /nfs/dbraw/zinc/70/24/99/1054702499.db2.gz CAPABKAVLMOTSZ-UHFFFAOYSA-N 1 2 315.285 4.404 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1)Cc1cc(F)c(F)c(F)c1F ZINC001235347390 1054702513 /nfs/dbraw/zinc/70/25/13/1054702513.db2.gz CAPABKAVLMOTSZ-UHFFFAOYSA-N 1 2 315.285 4.404 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)C2(CC)CCCCC2)n1 ZINC001452545272 1054706385 /nfs/dbraw/zinc/70/63/85/1054706385.db2.gz ZPYZPPRMYXZGIL-UHFFFAOYSA-N 1 2 323.506 4.284 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1cccc2ccsc21)n1cc[nH+]c1 ZINC001546040337 1054706516 /nfs/dbraw/zinc/70/65/16/1054706516.db2.gz CCRVXOBTMJWSDA-OAHLLOKOSA-N 1 2 313.426 4.324 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](Cc1csc(N)n1)Cc1ccccc1 ZINC001235350976 1054706903 /nfs/dbraw/zinc/70/69/03/1054706903.db2.gz WPAPHTJCSWUVHN-HNNXBMFYSA-N 1 2 323.465 4.489 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](Cc1csc(N)n1)Cc1ccccc1 ZINC001235350976 1054706919 /nfs/dbraw/zinc/70/69/19/1054706919.db2.gz WPAPHTJCSWUVHN-HNNXBMFYSA-N 1 2 323.465 4.489 20 0 DIADLO Cc1cc(Nc2ccc(NC3CCCC3)[nH+]c2)nc(C2CC2)n1 ZINC000604756839 1054708130 /nfs/dbraw/zinc/70/81/30/1054708130.db2.gz JAXQOEYJIXADMF-UHFFFAOYSA-N 1 2 309.417 4.156 20 0 DIADLO C[C@@H](CC(=O)Nc1ccccc1Nc1ccccc1)n1cc[nH+]c1 ZINC001546042690 1054714007 /nfs/dbraw/zinc/71/40/07/1054714007.db2.gz UKXPPCXGIXYOEO-HNNXBMFYSA-N 1 2 320.396 4.217 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1nc2ccccc2s1 ZINC000179916022 1054715495 /nfs/dbraw/zinc/71/54/95/1054715495.db2.gz LDJDLXQYFLCWBD-LLVKDONJSA-N 1 2 316.401 4.295 20 0 DIADLO Cc1cc(NCc2ccc(-c3ccncc3)cc2)nc(C2CC2)[nH+]1 ZINC000606894788 1054724041 /nfs/dbraw/zinc/72/40/41/1054724041.db2.gz CZCIJSZBHRPVDW-UHFFFAOYSA-N 1 2 316.408 4.337 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cncc(F)c2Cl)cc1 ZINC001235497630 1054733460 /nfs/dbraw/zinc/73/34/60/1054733460.db2.gz WPVHDVJBZRSKLL-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cncc(F)c2Cl)cc1 ZINC001235497630 1054733474 /nfs/dbraw/zinc/73/34/74/1054733474.db2.gz WPVHDVJBZRSKLL-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccc(Cl)c(Cl)c3)ccn12 ZINC001349284889 1054734392 /nfs/dbraw/zinc/73/43/92/1054734392.db2.gz DYJOFPWGJYSLII-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO Cc1ncn(C)c1C[N@H+](C)Cc1sc2ccccc2c1Cl ZINC001235551055 1054742287 /nfs/dbraw/zinc/74/22/87/1054742287.db2.gz CAZAQJDWRIKANY-UHFFFAOYSA-N 1 2 319.861 4.229 20 0 DIADLO Cc1ncn(C)c1C[N@@H+](C)Cc1sc2ccccc2c1Cl ZINC001235551055 1054742299 /nfs/dbraw/zinc/74/22/99/1054742299.db2.gz CAZAQJDWRIKANY-UHFFFAOYSA-N 1 2 319.861 4.229 20 0 DIADLO c1ccc2cc(CNc3ccc(N4CCCC4)c[nH+]3)ccc2c1 ZINC000513058931 1054743010 /nfs/dbraw/zinc/74/30/10/1054743010.db2.gz PPMWVLZJSOUCQP-UHFFFAOYSA-N 1 2 303.409 4.447 20 0 DIADLO CCCC[C@@H](CC)CCCN(C)C(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC001453695064 1054746528 /nfs/dbraw/zinc/74/65/28/1054746528.db2.gz OOWDCJKPKUWFHG-QGZVFWFLSA-N 1 2 321.509 4.382 20 0 DIADLO Cc1ccnc(C[N@@H+]2CCSc3ccccc3C2)c1Cl ZINC001235591124 1054748417 /nfs/dbraw/zinc/74/84/17/1054748417.db2.gz GVEPZFZDRFRQJV-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO Cc1ccnc(C[N@H+]2CCSc3ccccc3C2)c1Cl ZINC001235591124 1054748429 /nfs/dbraw/zinc/74/84/29/1054748429.db2.gz GVEPZFZDRFRQJV-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2Cl)cc[nH+]1 ZINC000180271805 1054749020 /nfs/dbraw/zinc/74/90/20/1054749020.db2.gz AQNXPBMKRUKYOQ-UHFFFAOYSA-N 1 2 314.694 4.315 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CC[C@]1(C)O ZINC001235592617 1054749297 /nfs/dbraw/zinc/74/92/97/1054749297.db2.gz SHPJMEUWIXAGLY-OTYXRUKQSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CC[C@]1(C)O ZINC001235592617 1054749304 /nfs/dbraw/zinc/74/93/04/1054749304.db2.gz SHPJMEUWIXAGLY-OTYXRUKQSA-N 1 2 322.663 4.240 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N[C@@H]1CCO[C@@H](c2ccccn2)C1 ZINC000520967616 1054771899 /nfs/dbraw/zinc/77/18/99/1054771899.db2.gz QWFWNIGVWHUXJC-VQIMIIECSA-N 1 2 319.408 4.270 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001349614913 1054774966 /nfs/dbraw/zinc/77/49/66/1054774966.db2.gz JMGUOCNRJFYWRV-UHFFFAOYSA-N 1 2 323.396 4.324 20 0 DIADLO COc1ccc([C@H](Nc2cc(C)[nH+]c(C3CC3)n2)C(C)C)cc1 ZINC000522567326 1054776204 /nfs/dbraw/zinc/77/62/04/1054776204.db2.gz CYIZAQWGFCRRGE-GOSISDBHSA-N 1 2 311.429 4.480 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2cc(Cl)cc(Cl)c2)s1 ZINC000351591090 1054776188 /nfs/dbraw/zinc/77/61/88/1054776188.db2.gz BMNJPIPPQHMZPC-SSDOTTSWSA-N 1 2 302.230 4.004 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2nc(CC(C)C)no2)C(C)(C)C)c1 ZINC000180796765 1054777880 /nfs/dbraw/zinc/77/78/80/1054777880.db2.gz GGRQIHRCJKSFNR-GOSISDBHSA-N 1 2 315.461 4.454 20 0 DIADLO CC(C)Oc1ccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000623810467 1054778256 /nfs/dbraw/zinc/77/82/56/1054778256.db2.gz IDTDEYORIFOKSK-UHFFFAOYSA-N 1 2 321.380 4.116 20 0 DIADLO Nc1nc(Cl)ccc1C[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC001235693646 1054780674 /nfs/dbraw/zinc/78/06/74/1054780674.db2.gz FPDBSQCTAWQAML-AWEZNQCLSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nc(Cl)ccc1C[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC001235693646 1054780690 /nfs/dbraw/zinc/78/06/90/1054780690.db2.gz FPDBSQCTAWQAML-AWEZNQCLSA-N 1 2 322.239 4.308 20 0 DIADLO CC(C)(C)n1cc(C[NH2+]C2(c3c(F)cccc3F)CCC2)cn1 ZINC000623843310 1054788665 /nfs/dbraw/zinc/78/86/65/1054788665.db2.gz HKRRHBMGTAUIIL-UHFFFAOYSA-N 1 2 319.399 4.085 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2scnc21)c1ccccc1OC(F)F ZINC000623856319 1054790090 /nfs/dbraw/zinc/79/00/90/1054790090.db2.gz RVZMYCUONQKFRF-JQWIXIFHSA-N 1 2 324.396 4.473 20 0 DIADLO C[C@@H]([NH2+]C1(c2c(F)cccc2F)CCC1)c1cncc(F)c1 ZINC000623844516 1054790471 /nfs/dbraw/zinc/79/04/71/1054790471.db2.gz ZONGTLCEAMNWDL-LLVKDONJSA-N 1 2 306.331 4.229 20 0 DIADLO C[N@H+](CCc1ccccn1)Cc1c(F)cc(Cl)cc1Cl ZINC001235743445 1054793942 /nfs/dbraw/zinc/79/39/42/1054793942.db2.gz GCKNZWIEUVIANY-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1ccccn1)Cc1c(F)cc(Cl)cc1Cl ZINC001235743445 1054793957 /nfs/dbraw/zinc/79/39/57/1054793957.db2.gz GCKNZWIEUVIANY-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO CCCO[C@H]1CC[N@H+](Cc2c(F)cc(Cl)cc2Cl)C1 ZINC001235747024 1054794110 /nfs/dbraw/zinc/79/41/10/1054794110.db2.gz OGCBUZGWICNWEM-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@H]1CC[N@@H+](Cc2c(F)cc(Cl)cc2Cl)C1 ZINC001235747024 1054794125 /nfs/dbraw/zinc/79/41/25/1054794125.db2.gz OGCBUZGWICNWEM-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@@H](c2nc3ccccc3[nH]2)C(C)C)n1 ZINC000623873725 1054796145 /nfs/dbraw/zinc/79/61/45/1054796145.db2.gz PTVZPEGQUPLXHH-IUODEOHRSA-N 1 2 314.458 4.376 20 0 DIADLO Brc1ccccc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000623879986 1054799309 /nfs/dbraw/zinc/79/93/09/1054799309.db2.gz VQIZWWIINOCZMH-GFCCVEGCSA-N 1 2 323.259 4.073 20 0 DIADLO Cc1ccc(F)c(C[NH+]2CC3(C2)CCCC3)c1Br ZINC001235758873 1054801336 /nfs/dbraw/zinc/80/13/36/1054801336.db2.gz HPMBKCYCUKQWSW-UHFFFAOYSA-N 1 2 312.226 4.273 20 0 DIADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(OCc2ccccc2)c(F)c1 ZINC001235765802 1054804737 /nfs/dbraw/zinc/80/47/37/1054804737.db2.gz RKAQHKIQLCVKAW-PBHICJAKSA-N 1 2 317.379 4.337 20 0 DIADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(OCc2ccccc2)c(F)c1 ZINC001235765802 1054804745 /nfs/dbraw/zinc/80/47/45/1054804745.db2.gz RKAQHKIQLCVKAW-PBHICJAKSA-N 1 2 317.379 4.337 20 0 DIADLO CCOc1cc(C[N@H+](C)Cc2ccc(F)cc2F)ccc1F ZINC001235804146 1054808829 /nfs/dbraw/zinc/80/88/29/1054808829.db2.gz CNEUEJVVILOOHE-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CCOc1cc(C[N@@H+](C)Cc2ccc(F)cc2F)ccc1F ZINC001235804146 1054808844 /nfs/dbraw/zinc/80/88/44/1054808844.db2.gz CNEUEJVVILOOHE-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO COc1ccc(F)cc1[C@H](C)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000532369562 1054809473 /nfs/dbraw/zinc/80/94/73/1054809473.db2.gz ZGFWBSLOSCRELJ-LBPRGKRZSA-N 1 2 303.381 4.229 20 0 DIADLO Cc1cc(NCc2ccccc2COC(C)C)nc(C(C)C)[nH+]1 ZINC000532368959 1054809606 /nfs/dbraw/zinc/80/96/06/1054809606.db2.gz NOCPPVKJNQZDSU-UHFFFAOYSA-N 1 2 313.445 4.446 20 0 DIADLO C[C@@H](Nc1[nH+]c2ccccc2n1C)c1cccc(N2CCCC2)c1 ZINC000534977451 1054817767 /nfs/dbraw/zinc/81/77/67/1054817767.db2.gz UGOXYOOPHMJEEA-OAHLLOKOSA-N 1 2 320.440 4.347 20 0 DIADLO Cc1nc2cc(C[N@@H+]3CCCC(F)(F)[C@@H](F)C3)ccc2s1 ZINC001235851345 1054822373 /nfs/dbraw/zinc/82/23/73/1054822373.db2.gz WMIAILFJTDVWMT-AWEZNQCLSA-N 1 2 314.376 4.174 20 0 DIADLO Cc1nc2cc(C[N@H+]3CCCC(F)(F)[C@@H](F)C3)ccc2s1 ZINC001235851345 1054822385 /nfs/dbraw/zinc/82/23/85/1054822385.db2.gz WMIAILFJTDVWMT-AWEZNQCLSA-N 1 2 314.376 4.174 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CC[C@@H]3[C@H](C2)C3(F)F)cc1Cl ZINC001474572076 1054824816 /nfs/dbraw/zinc/82/48/16/1054824816.db2.gz RRHUKLYWYFKGIU-ZJUUUORDSA-N 1 2 322.182 4.089 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CC[C@@H]3[C@H](C2)C3(F)F)cc1Cl ZINC001474572076 1054824824 /nfs/dbraw/zinc/82/48/24/1054824824.db2.gz RRHUKLYWYFKGIU-ZJUUUORDSA-N 1 2 322.182 4.089 20 0 DIADLO C[C@H]([NH2+][C@H]1CC[C@@H](c2cccc(Cl)c2)C1)C(=O)OC(C)(C)C ZINC001474575506 1054825620 /nfs/dbraw/zinc/82/56/20/1054825620.db2.gz KOCBMTJSUUCBLI-BJJXKVORSA-N 1 2 323.864 4.296 20 0 DIADLO C[C@H]([NH2+][C@@H]1CC[C@@H](c2cccc(Cl)c2)C1)C(=O)OC(C)(C)C ZINC001474575508 1054826166 /nfs/dbraw/zinc/82/61/66/1054826166.db2.gz KOCBMTJSUUCBLI-JGGQBBKZSA-N 1 2 323.864 4.296 20 0 DIADLO CCOc1cc(Cl)ccc1C[NH2+][C@@H](C)c1nc(C)cs1 ZINC000623923906 1054827316 /nfs/dbraw/zinc/82/73/16/1054827316.db2.gz NZZNKSIEMGTOMD-NSHDSACASA-N 1 2 310.850 4.354 20 0 DIADLO CCOc1cc(Cl)ccc1C[NH2+][C@H]1CCCc2scnc21 ZINC000623923989 1054827655 /nfs/dbraw/zinc/82/76/55/1054827655.db2.gz QNRJLZOLZVGUJT-ZDUSSCGKSA-N 1 2 322.861 4.362 20 0 DIADLO Cc1c(Cl)ccc2ccc(NCCCCn3cc[nH+]c3)nc12 ZINC000537604009 1054841407 /nfs/dbraw/zinc/84/14/07/1054841407.db2.gz JFJGHKLTAWZFDT-UHFFFAOYSA-N 1 2 314.820 4.285 20 0 DIADLO Fc1ccc(C2CC2)cc1C[NH2+][C@H]1CCCc2scnc21 ZINC000623991292 1054849214 /nfs/dbraw/zinc/84/92/14/1054849214.db2.gz CVJARSCMTVMPCG-HNNXBMFYSA-N 1 2 302.418 4.327 20 0 DIADLO Cc1cc(C)c(C(=O)NCCc2ccc(C(C)C)cc2)c(C)[nH+]1 ZINC001350072200 1054864213 /nfs/dbraw/zinc/86/42/13/1054864213.db2.gz MJOKMGMXWIYKKI-UHFFFAOYSA-N 1 2 310.441 4.103 20 0 DIADLO CC[C@@H]([NH2+]Cc1c(Cl)oc2ccccc21)c1ccn(C)n1 ZINC000624108775 1054878601 /nfs/dbraw/zinc/87/86/01/1054878601.db2.gz FAORQMAQIGEXJM-CYBMUJFWSA-N 1 2 303.793 4.061 20 0 DIADLO Cc1cncc([C@@H](C)[NH2+][C@@H](CCc2ccccc2)C(F)F)c1 ZINC000624125088 1054884168 /nfs/dbraw/zinc/88/41/68/1054884168.db2.gz SHUYJDZEHCADMM-PBHICJAKSA-N 1 2 304.384 4.307 20 0 DIADLO CC[C@H]([NH2+][C@@H](CCc1ccccc1)C(F)F)c1ccncc1 ZINC000624124629 1054887892 /nfs/dbraw/zinc/88/78/92/1054887892.db2.gz HYKJANIQAJCZCC-IRXDYDNUSA-N 1 2 304.384 4.389 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(-c4ccncc4)cc3)nc2)c[nH+]1 ZINC001236036199 1054905079 /nfs/dbraw/zinc/90/50/79/1054905079.db2.gz HCPFGGZJMHZBLX-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(-c2ccncc2)cc1 ZINC001236040885 1054908825 /nfs/dbraw/zinc/90/88/25/1054908825.db2.gz DYBXXIAABSAKSH-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)c1ccc(C)cc1 ZINC000181684634 1054929102 /nfs/dbraw/zinc/92/91/02/1054929102.db2.gz DMLKHPZPCSRLGU-HIFRSBDPSA-N 1 2 301.434 4.477 20 0 DIADLO COc1c(C)c[nH+]c(CN[C@@H](C)c2c(F)cccc2Cl)c1C ZINC000181743183 1054934760 /nfs/dbraw/zinc/93/47/60/1054934760.db2.gz GWIVSMXTAZWLHE-LBPRGKRZSA-N 1 2 322.811 4.350 20 0 DIADLO COc1c(C)cnc(C[NH2+][C@@H](C)c2c(F)cccc2Cl)c1C ZINC000181743183 1054934771 /nfs/dbraw/zinc/93/47/71/1054934771.db2.gz GWIVSMXTAZWLHE-LBPRGKRZSA-N 1 2 322.811 4.350 20 0 DIADLO FC(F)(F)c1ccc(Cl)c(-c2c[nH+]c3c(c2)CCCN3)c1 ZINC001236107461 1054952325 /nfs/dbraw/zinc/95/23/25/1054952325.db2.gz XJBBGEJBVZRHEY-UHFFFAOYSA-N 1 2 312.722 4.422 20 0 DIADLO CC(C)Sc1ccc([C@@H](C)[NH2+]Cc2nc(C3CC3)no2)cc1 ZINC000182100143 1054960682 /nfs/dbraw/zinc/96/06/82/1054960682.db2.gz MKFJQWSWSOZHKQ-GFCCVEGCSA-N 1 2 317.458 4.298 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nnc(Cc3ccccc3C)o2)cc1 ZINC000182319034 1054980797 /nfs/dbraw/zinc/98/07/97/1054980797.db2.gz OWIHYZSVNOIWLL-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nc(CCc3ccccc3)no2)cc1 ZINC000182349171 1054983146 /nfs/dbraw/zinc/98/31/46/1054983146.db2.gz SRNYXVBJHHPWCZ-INIZCTEOSA-N 1 2 321.424 4.014 20 0 DIADLO CC[C@H](C)c1ccc(C(=O)NC[C@@H]2c3ccccc3C[N@H+]2C)cc1 ZINC001535620602 1054991810 /nfs/dbraw/zinc/99/18/10/1054991810.db2.gz TVWGKSMAPVHLKB-MGPUTAFESA-N 1 2 322.452 4.117 20 0 DIADLO CC[C@H](C)c1ccc(C(=O)NC[C@@H]2c3ccccc3C[N@@H+]2C)cc1 ZINC001535620602 1054991824 /nfs/dbraw/zinc/99/18/24/1054991824.db2.gz TVWGKSMAPVHLKB-MGPUTAFESA-N 1 2 322.452 4.117 20 0 DIADLO O=C(/C=C\C1CCCC1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001535691733 1055001520 /nfs/dbraw/zinc/00/15/20/1055001520.db2.gz GOVBJWAEIFUFKC-YVMONPNESA-N 1 2 315.804 4.211 20 0 DIADLO CCC[C@H](C)C[NH2+][C@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000182681331 1055003081 /nfs/dbraw/zinc/00/30/81/1055003081.db2.gz FYAIFMOFFNVYTB-NHYWBVRUSA-N 1 2 307.825 4.147 20 0 DIADLO CC(C)Oc1c(F)c(F)c(-c2ccn3cc[nH+]c3c2)c(F)c1F ZINC001236223661 1055013973 /nfs/dbraw/zinc/01/39/73/1055013973.db2.gz OWTNFYXBWKLSBV-UHFFFAOYSA-N 1 2 324.277 4.345 20 0 DIADLO CC(C)Oc1c(F)c(F)c(-c2ccc3[nH+]ccn3c2)c(F)c1F ZINC001236225363 1055016944 /nfs/dbraw/zinc/01/69/44/1055016944.db2.gz DMHUHUVDZPBJBB-UHFFFAOYSA-N 1 2 324.277 4.345 20 0 DIADLO CCC(CC)n1nc(C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1C ZINC000182991140 1055023043 /nfs/dbraw/zinc/02/30/43/1055023043.db2.gz RYZMDMUCABASJK-UHFFFAOYSA-N 1 2 314.433 4.125 20 0 DIADLO Cc1cccc(C([NH2+][C@@H](C)c2nccn2C)c2cccc(C)c2)c1 ZINC000183091068 1055029018 /nfs/dbraw/zinc/02/90/18/1055029018.db2.gz FVPARAIPEUGXQP-KRWDZBQOSA-N 1 2 319.452 4.477 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccc(CCC(C)C)cc3)ccn12 ZINC001535943979 1055033411 /nfs/dbraw/zinc/03/34/11/1055033411.db2.gz CKUJBTZXVJMDFD-UHFFFAOYSA-N 1 2 321.424 4.484 20 0 DIADLO Cc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nc(CC(C)C)no1 ZINC000183246867 1055037419 /nfs/dbraw/zinc/03/74/19/1055037419.db2.gz JHMIJIVZVXBCSA-QGZVFWFLSA-N 1 2 315.461 4.454 20 0 DIADLO Nc1ccc(-c2ccc(-c3noc(C4CCCCC4)n3)cc2)c[nH+]1 ZINC001236313445 1055053763 /nfs/dbraw/zinc/05/37/63/1055053763.db2.gz OUXOOHFQSXDTOA-UHFFFAOYSA-N 1 2 320.396 4.429 20 0 DIADLO Cc1nnc(C[NH2+][C@H](c2ccccc2Cl)C(C)C)n1C1CC1 ZINC000183692321 1055054189 /nfs/dbraw/zinc/05/41/89/1055054189.db2.gz GRJQFURYJQUITE-KRWDZBQOSA-N 1 2 318.852 4.062 20 0 DIADLO Nc1ccc(-c2ccc(C(F)(F)F)c(C(F)(F)F)c2)c[nH+]1 ZINC001236317790 1055054394 /nfs/dbraw/zinc/05/43/94/1055054394.db2.gz PTDMRYIGGRWWOK-UHFFFAOYSA-N 1 2 306.209 4.368 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1cccc(C(F)(F)F)c1 ZINC000367617457 1055080004 /nfs/dbraw/zinc/08/00/04/1055080004.db2.gz NITDJDBGZBXJOD-YGRLFVJLSA-N 1 2 309.335 4.157 20 0 DIADLO Clc1ccccc1C[NH2+]Cc1nc2ccccc2n1C1CC1 ZINC000184772724 1055081934 /nfs/dbraw/zinc/08/19/34/1055081934.db2.gz RXHCSFMZEKAREV-UHFFFAOYSA-N 1 2 311.816 4.314 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2c(F)cccc2Cl)C2CC2)s1 ZINC000185351837 1055091687 /nfs/dbraw/zinc/09/16/87/1055091687.db2.gz NTHJSAMVMPIBJE-AWEZNQCLSA-N 1 2 310.825 4.485 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2c(F)cccc2Cl)C2CC2)s1 ZINC000185351818 1055091954 /nfs/dbraw/zinc/09/19/54/1055091954.db2.gz NTHJSAMVMPIBJE-CQSZACIVSA-N 1 2 310.825 4.485 20 0 DIADLO Cc1c(-c2ccc(-c3c[nH+]cn3C)cc2)cnn1-c1ccccc1 ZINC001236402584 1055096137 /nfs/dbraw/zinc/09/61/37/1055096137.db2.gz DLWIUHCXQHSSJE-UHFFFAOYSA-N 1 2 314.392 4.248 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nc(-c3ccsc3)no2)c(C)s1 ZINC000193131743 1055099098 /nfs/dbraw/zinc/09/90/98/1055099098.db2.gz VJXPFVBLIFBVTQ-JTQLQIEISA-N 1 2 319.455 4.327 20 0 DIADLO COc1nc(C(C)C)ccc1-c1ccccc1Cn1cc[nH+]c1 ZINC001236444842 1055116240 /nfs/dbraw/zinc/11/62/40/1055116240.db2.gz PGCHSCSIRIGFDU-UHFFFAOYSA-N 1 2 307.397 4.125 20 0 DIADLO C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+](C)Cc1cscn1 ZINC000194425032 1055123957 /nfs/dbraw/zinc/12/39/57/1055123957.db2.gz VHEQHCYQXPEPHE-SNVBAGLBSA-N 1 2 316.348 4.235 20 0 DIADLO C[C@H](c1ccc(OC(F)(F)F)cc1)[N@@H+](C)Cc1cscn1 ZINC000194425032 1055123959 /nfs/dbraw/zinc/12/39/59/1055123959.db2.gz VHEQHCYQXPEPHE-SNVBAGLBSA-N 1 2 316.348 4.235 20 0 DIADLO C[C@H]1CCN(C(=O)c2ccc(-n3cc[nH+]c3)cc2)c2ccccc21 ZINC000194604184 1055129842 /nfs/dbraw/zinc/12/98/42/1055129842.db2.gz RCEUJCJBRJVRHI-HNNXBMFYSA-N 1 2 317.392 4.026 20 0 DIADLO Cc1cc(C)c(C(=O)NCC(C)(C)c2ccccc2C)c(C)[nH+]1 ZINC001536580650 1055132346 /nfs/dbraw/zinc/13/23/46/1055132346.db2.gz IIEATQKKCPSCFW-UHFFFAOYSA-N 1 2 310.441 4.023 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1SC1CCCC1)[NH+]1CC(C)C1 ZINC000654481164 1055136546 /nfs/dbraw/zinc/13/65/46/1055136546.db2.gz IGRMDBBJRUIQPT-AWEZNQCLSA-N 1 2 318.486 4.000 20 0 DIADLO Cc1cc(-c2cncc(OCc3ccccc3)c2)c2[nH+]ccn2c1 ZINC001236573108 1055195013 /nfs/dbraw/zinc/19/50/13/1055195013.db2.gz HIWKWLFIJMZGES-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(Br)ccnc2Cl)[C@@H](C)C1 ZINC001236598383 1055201096 /nfs/dbraw/zinc/20/10/96/1055201096.db2.gz QHCDUIQJTUNOLW-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(Br)ccnc2Cl)[C@@H](C)C1 ZINC001236598383 1055201106 /nfs/dbraw/zinc/20/11/06/1055201106.db2.gz QHCDUIQJTUNOLW-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC001236608594 1055204176 /nfs/dbraw/zinc/20/41/76/1055204176.db2.gz SIEDNPGANAQCGK-NSHDSACASA-N 1 2 310.228 4.075 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@H+]1CCn2cccc2[C@@H]1C ZINC001236608594 1055204185 /nfs/dbraw/zinc/20/41/85/1055204185.db2.gz SIEDNPGANAQCGK-NSHDSACASA-N 1 2 310.228 4.075 20 0 DIADLO CSc1ccccc1[C@H]1CCC[N@@H+]1Cc1nccnc1Cl ZINC001236624917 1055206075 /nfs/dbraw/zinc/20/60/75/1055206075.db2.gz NXHMKVZKKATDRB-CQSZACIVSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1ccccc1[C@H]1CCC[N@H+]1Cc1nccnc1Cl ZINC001236624917 1055206081 /nfs/dbraw/zinc/20/60/81/1055206081.db2.gz NXHMKVZKKATDRB-CQSZACIVSA-N 1 2 319.861 4.189 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2c2cccnc2)n1 ZINC001236639458 1055209437 /nfs/dbraw/zinc/20/94/37/1055209437.db2.gz PQWUHBZHDHHIGF-KRWDZBQOSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCCC[C@H]2c2cccnc2)n1 ZINC001236639458 1055209442 /nfs/dbraw/zinc/20/94/42/1055209442.db2.gz PQWUHBZHDHHIGF-KRWDZBQOSA-N 1 2 301.821 4.166 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)C2(CC2)C1 ZINC001236631208 1055210221 /nfs/dbraw/zinc/21/02/21/1055210221.db2.gz IEZIMXCXVKJFQB-VIFPVBQESA-N 1 2 304.743 4.128 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)C2(CC2)C1 ZINC001236631208 1055210236 /nfs/dbraw/zinc/21/02/36/1055210236.db2.gz IEZIMXCXVKJFQB-VIFPVBQESA-N 1 2 304.743 4.128 20 0 DIADLO COc1ccc2sc(C[N@@H+]3CCC(F)(F)[C@H](F)C3)cc2c1 ZINC001236656714 1055216062 /nfs/dbraw/zinc/21/60/62/1055216062.db2.gz WBFITWOXOWXVBE-CQSZACIVSA-N 1 2 315.360 4.089 20 0 DIADLO COc1ccc2sc(C[N@H+]3CCC(F)(F)[C@H](F)C3)cc2c1 ZINC001236656714 1055216070 /nfs/dbraw/zinc/21/60/70/1055216070.db2.gz WBFITWOXOWXVBE-CQSZACIVSA-N 1 2 315.360 4.089 20 0 DIADLO C[N@H+](Cc1c(F)cc(OCc2ccccc2)cc1F)C1CC1 ZINC001236702396 1055232280 /nfs/dbraw/zinc/23/22/80/1055232280.db2.gz MOIXAQDSAWLHHE-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO C[N@@H+](Cc1c(F)cc(OCc2ccccc2)cc1F)C1CC1 ZINC001236702396 1055232293 /nfs/dbraw/zinc/23/22/93/1055232293.db2.gz MOIXAQDSAWLHHE-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2cccnc2Br)cc1 ZINC001137800531 1055245109 /nfs/dbraw/zinc/24/51/09/1055245109.db2.gz OCEIGBXYDITPCV-UHFFFAOYSA-N 1 2 319.246 4.039 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2cccnc2Br)cc1 ZINC001137800531 1055245122 /nfs/dbraw/zinc/24/51/22/1055245122.db2.gz OCEIGBXYDITPCV-UHFFFAOYSA-N 1 2 319.246 4.039 20 0 DIADLO COc1cc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c(F)cc1F ZINC001236818202 1055272376 /nfs/dbraw/zinc/27/23/76/1055272376.db2.gz RDGMWEPTYRZXDR-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c(F)cc1F ZINC001236818202 1055272390 /nfs/dbraw/zinc/27/23/90/1055272390.db2.gz RDGMWEPTYRZXDR-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c(F)cc1F ZINC001236816250 1055272831 /nfs/dbraw/zinc/27/28/31/1055272831.db2.gz FHZRAMULOOHYEJ-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c(F)cc1F ZINC001236816250 1055272838 /nfs/dbraw/zinc/27/28/38/1055272838.db2.gz FHZRAMULOOHYEJ-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2Cc3ccccc3[C@H](C)C2)c(F)cc1F ZINC001236818200 1055272973 /nfs/dbraw/zinc/27/29/73/1055272973.db2.gz RDGMWEPTYRZXDR-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c(F)cc1F ZINC001236818200 1055272978 /nfs/dbraw/zinc/27/29/78/1055272978.db2.gz RDGMWEPTYRZXDR-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO Fc1cc(C[N@@H+]2CCCCC23CC3)cc(Br)c1F ZINC001236860071 1055296835 /nfs/dbraw/zinc/29/68/35/1055296835.db2.gz NVDXFJSFMZVNRQ-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1cc(C[N@H+]2CCCCC23CC3)cc(Br)c1F ZINC001236860071 1055296839 /nfs/dbraw/zinc/29/68/39/1055296839.db2.gz NVDXFJSFMZVNRQ-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Clc1cc(-n2ccnc2)ccc1C[NH+]1Cc2ccccc2C1 ZINC001236913284 1055310559 /nfs/dbraw/zinc/31/05/59/1055310559.db2.gz KXMMNISOKZHFBL-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2cncc(-c3ccc(F)cc3)c2)C[C@@H]1F ZINC001236998331 1055332201 /nfs/dbraw/zinc/33/22/01/1055332201.db2.gz WNOXZBSKGJBGQX-ROUUACIJSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2cncc(-c3ccc(F)cc3)c2)C[C@@H]1F ZINC001236998331 1055332218 /nfs/dbraw/zinc/33/22/18/1055332218.db2.gz WNOXZBSKGJBGQX-ROUUACIJSA-N 1 2 320.358 4.160 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H](C)c1cnn(-c2ccccc2)c1 ZINC000325420772 1055335305 /nfs/dbraw/zinc/33/53/05/1055335305.db2.gz WUYYIVVZIKNWTK-MRXNPFEDSA-N 1 2 320.440 4.420 20 0 DIADLO C[N@H+](Cc1ccno1)Cc1ccc(-c2ccccc2Cl)nc1 ZINC001237027973 1055347550 /nfs/dbraw/zinc/34/75/50/1055347550.db2.gz XOLVYDXTBYYDFQ-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1ccno1)Cc1ccc(-c2ccccc2Cl)nc1 ZINC001237027973 1055347562 /nfs/dbraw/zinc/34/75/62/1055347562.db2.gz XOLVYDXTBYYDFQ-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO Cc1cc(C(=O)Nc2cc(C)[nH+]cc2C)sc1-c1ccccc1 ZINC001537540557 1055354248 /nfs/dbraw/zinc/35/42/48/1055354248.db2.gz SXVJBCXHQWTQID-UHFFFAOYSA-N 1 2 322.433 4.410 20 0 DIADLO C/C=C(/C=C/C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)CC ZINC000765352269 1055372832 /nfs/dbraw/zinc/37/28/32/1055372832.db2.gz WSAMCYODKFGOIP-OZIKREMFSA-N 1 2 315.804 4.377 20 0 DIADLO c1[nH+]cn2c1CN(Cc1ccc3sc4ccccc4c3c1)CC2 ZINC001237199806 1055404093 /nfs/dbraw/zinc/40/40/93/1055404093.db2.gz LYXUHFATMNFDBV-UHFFFAOYSA-N 1 2 319.433 4.267 20 0 DIADLO Cc1cc(C[N@H+]2C[C@@H]([NH3+])C[C@H]2C)cc(C)c1-c1ccc(F)cc1 ZINC001237203578 1055404538 /nfs/dbraw/zinc/40/45/38/1055404538.db2.gz FZFMMHQPXYLEGE-BEFAXECRSA-N 1 2 312.432 4.031 20 0 DIADLO Cc1cc(C[N@@H+]2C[C@@H]([NH3+])C[C@H]2C)cc(C)c1-c1ccc(F)cc1 ZINC001237203578 1055404548 /nfs/dbraw/zinc/40/45/48/1055404548.db2.gz FZFMMHQPXYLEGE-BEFAXECRSA-N 1 2 312.432 4.031 20 0 DIADLO COc1nc(Cl)ccc1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001237245772 1055406996 /nfs/dbraw/zinc/40/69/96/1055406996.db2.gz XZLKARWXZJMYGF-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nc(Cl)ccc1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001237245772 1055406999 /nfs/dbraw/zinc/40/69/99/1055406999.db2.gz XZLKARWXZJMYGF-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nc(Cl)ccc1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001237246396 1055410348 /nfs/dbraw/zinc/41/03/48/1055410348.db2.gz BBWOMHHTOWFFPH-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1nc(Cl)ccc1C[N@@H+]1CC=C(c2ccccc2)CC1 ZINC001237246396 1055410353 /nfs/dbraw/zinc/41/03/53/1055410353.db2.gz BBWOMHHTOWFFPH-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc(C(F)F)c(OC)c1)C2 ZINC001237273252 1055412127 /nfs/dbraw/zinc/41/21/27/1055412127.db2.gz PZMPPVDMPBRDTQ-UHFFFAOYSA-N 1 2 319.351 4.157 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc(C(F)F)c(OC)c1)C2 ZINC001237273252 1055412132 /nfs/dbraw/zinc/41/21/32/1055412132.db2.gz PZMPPVDMPBRDTQ-UHFFFAOYSA-N 1 2 319.351 4.157 20 0 DIADLO COc1ccc(-c2ccccc2)c(C[N@H+](C)Cc2nccs2)c1 ZINC001237309719 1055424439 /nfs/dbraw/zinc/42/44/39/1055424439.db2.gz GNLSSWPVVBILCY-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1ccc(-c2ccccc2)c(C[N@@H+](C)Cc2nccs2)c1 ZINC001237309719 1055424444 /nfs/dbraw/zinc/42/44/44/1055424444.db2.gz GNLSSWPVVBILCY-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO Cc1cc(F)cc(C)c1C[N@@H+]1CCc2ncc(Cl)cc2C1 ZINC001237324267 1055425856 /nfs/dbraw/zinc/42/58/56/1055425856.db2.gz BXNUDDRLNWGRJI-UHFFFAOYSA-N 1 2 304.796 4.049 20 0 DIADLO Cc1cc(F)cc(C)c1C[N@H+]1CCc2ncc(Cl)cc2C1 ZINC001237324267 1055425863 /nfs/dbraw/zinc/42/58/63/1055425863.db2.gz BXNUDDRLNWGRJI-UHFFFAOYSA-N 1 2 304.796 4.049 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@@H+]1CCC[C@H]1c1ncccn1 ZINC001237353050 1055436365 /nfs/dbraw/zinc/43/63/65/1055436365.db2.gz MBPOWNKHIOLQOY-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@H]1c1ncccn1 ZINC001237353050 1055436374 /nfs/dbraw/zinc/43/63/74/1055436374.db2.gz MBPOWNKHIOLQOY-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO CCCCCCC(=O)NCc1c(Cl)cccc1-n1cc[nH+]c1 ZINC001588207310 1055450914 /nfs/dbraw/zinc/45/09/14/1055450914.db2.gz SXOLTNSGAZHFJD-UHFFFAOYSA-N 1 2 319.836 4.112 20 0 DIADLO C[N@H+](Cc1cc2ccccn2n1)Cc1ccc(Cl)c(Cl)c1 ZINC001237446976 1055453552 /nfs/dbraw/zinc/45/35/52/1055453552.db2.gz OMEOVTOKZDQIQR-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1cc2ccccn2n1)Cc1ccc(Cl)c(Cl)c1 ZINC001237446976 1055453559 /nfs/dbraw/zinc/45/35/59/1055453559.db2.gz OMEOVTOKZDQIQR-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO CCC1CC[NH+](Cc2cc(Cl)nc(C(F)(F)F)c2)CC1 ZINC001237490498 1055462104 /nfs/dbraw/zinc/46/21/04/1055462104.db2.gz GACOYEVWHVHOBX-UHFFFAOYSA-N 1 2 306.759 4.376 20 0 DIADLO CCCCC[C@H](C)NC(=O)C[N@H+](CC)Cc1ccccc1Cl ZINC001588283175 1055464486 /nfs/dbraw/zinc/46/44/86/1055464486.db2.gz PSHYCSHSQFXTFQ-HNNXBMFYSA-N 1 2 324.896 4.247 20 0 DIADLO CCCCC[C@H](C)NC(=O)C[N@@H+](CC)Cc1ccccc1Cl ZINC001588283175 1055464493 /nfs/dbraw/zinc/46/44/93/1055464493.db2.gz PSHYCSHSQFXTFQ-HNNXBMFYSA-N 1 2 324.896 4.247 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1cc(Cl)nc(Cl)c1O ZINC001237523957 1055466527 /nfs/dbraw/zinc/46/65/27/1055466527.db2.gz XEWJJPQEXDIHAV-UHFFFAOYSA-N 1 2 317.241 4.178 20 0 DIADLO Oc1c(C[N@H+]2CC[C@H](c3ccccc3)C2)cc(Cl)nc1Cl ZINC001237527362 1055467450 /nfs/dbraw/zinc/46/74/50/1055467450.db2.gz XPFMAZJTEFZAHO-LBPRGKRZSA-N 1 2 323.223 4.084 20 0 DIADLO Oc1c(C[N@@H+]2CC[C@H](c3ccccc3)C2)cc(Cl)nc1Cl ZINC001237527362 1055467446 /nfs/dbraw/zinc/46/74/46/1055467446.db2.gz XPFMAZJTEFZAHO-LBPRGKRZSA-N 1 2 323.223 4.084 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1ccc(C(C)C)c(Cl)c1 ZINC001537892104 1055468858 /nfs/dbraw/zinc/46/88/58/1055468858.db2.gz SVAFQVGBWHNJLE-UHFFFAOYSA-N 1 2 302.805 4.149 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)Cc1ccc(C2CCCCC2)cc1 ZINC001537891306 1055469019 /nfs/dbraw/zinc/46/90/19/1055469019.db2.gz FPHILELIXWRXGS-UHFFFAOYSA-N 1 2 322.452 4.349 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccc(-c2nc(C)c(C)o2)cc1 ZINC001620850725 1055479382 /nfs/dbraw/zinc/47/93/82/1055479382.db2.gz LAGFNPVOLFGZDN-UHFFFAOYSA-N 1 2 310.401 4.177 20 0 DIADLO CCOc1ccc(Cl)cc1CNc1ccc([NH+](C)C)cc1 ZINC001620852910 1055481219 /nfs/dbraw/zinc/48/12/19/1055481219.db2.gz WKRWSPRSKBIUOC-UHFFFAOYSA-N 1 2 304.821 4.417 20 0 DIADLO CSCc1ccc(CNc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC001620853403 1055481523 /nfs/dbraw/zinc/48/15/23/1055481523.db2.gz CDQOACNZHCCSNC-UHFFFAOYSA-N 1 2 309.438 4.347 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc2c(c1)CCC2)c1noc(-c2ccccc2)n1 ZINC001620859601 1055487077 /nfs/dbraw/zinc/48/70/77/1055487077.db2.gz RWKCVQDHZZDKIT-CQSZACIVSA-N 1 2 319.408 4.076 20 0 DIADLO CC[C@H](C)Oc1cc(CNc2ccc(C)[nH+]c2C)ccc1OC ZINC001620869620 1055495599 /nfs/dbraw/zinc/49/55/99/1055495599.db2.gz KJDIPVYLRUKTMA-AWEZNQCLSA-N 1 2 314.429 4.496 20 0 DIADLO CCc1cccc(F)c1CNc1ccc(N(CC)CC)[nH+]c1 ZINC001620869192 1055496870 /nfs/dbraw/zinc/49/68/70/1055496870.db2.gz JCMRDQVJQRDUJN-UHFFFAOYSA-N 1 2 301.409 4.241 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)Nc1cccc2[nH+]ccn21 ZINC001538058686 1055515877 /nfs/dbraw/zinc/51/58/77/1055515877.db2.gz SWAQOHVWBFPIEJ-HUUCEWRRSA-N 1 2 319.408 4.262 20 0 DIADLO Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)Nc1cccc2[nH+]ccn21 ZINC001538058685 1055515924 /nfs/dbraw/zinc/51/59/24/1055515924.db2.gz SWAQOHVWBFPIEJ-GJZGRUSLSA-N 1 2 319.408 4.262 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc(OC(C)C)c(C)c1)C2 ZINC001237727889 1055516344 /nfs/dbraw/zinc/51/63/44/1055516344.db2.gz PNOKWWXRBOOHKN-UHFFFAOYSA-N 1 2 311.425 4.307 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc(OC(C)C)c(C)c1)C2 ZINC001237727889 1055516353 /nfs/dbraw/zinc/51/63/53/1055516353.db2.gz PNOKWWXRBOOHKN-UHFFFAOYSA-N 1 2 311.425 4.307 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ncc(Cl)cc1Br ZINC001237752571 1055522094 /nfs/dbraw/zinc/52/20/94/1055522094.db2.gz HTSQUNFTSQKDGL-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ncc(Cl)cc2Br)[C@@H](C)C1 ZINC001237761475 1055526055 /nfs/dbraw/zinc/52/60/55/1055526055.db2.gz VTFQDJYTTMIHQK-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ncc(Cl)cc2Br)[C@@H](C)C1 ZINC001237761475 1055526069 /nfs/dbraw/zinc/52/60/69/1055526069.db2.gz VTFQDJYTTMIHQK-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2)Cc2cccnc2)ccc1F ZINC001237814630 1055536767 /nfs/dbraw/zinc/53/67/67/1055536767.db2.gz AXUXEWDSKPCSFQ-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)ccc1F ZINC001237814630 1055536780 /nfs/dbraw/zinc/53/67/80/1055536780.db2.gz AXUXEWDSKPCSFQ-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)ccc1F ZINC001237818887 1055536802 /nfs/dbraw/zinc/53/68/02/1055536802.db2.gz WUANJCFHHQJCOL-KRWDZBQOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)ccc1F ZINC001237818887 1055536811 /nfs/dbraw/zinc/53/68/11/1055536811.db2.gz WUANJCFHHQJCOL-KRWDZBQOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)ccc1F ZINC001237829329 1055541406 /nfs/dbraw/zinc/54/14/06/1055541406.db2.gz YMTUDELJIPENEG-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1nc(C[N@H+]2CCc3cc(C(F)(F)F)ccc3C2)ccc1F ZINC001237829329 1055541420 /nfs/dbraw/zinc/54/14/20/1055541420.db2.gz YMTUDELJIPENEG-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccc(Br)c(Cl)c2F)C1 ZINC001237890456 1055550995 /nfs/dbraw/zinc/55/09/95/1055550995.db2.gz ZWBYBXAKLQWXKI-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccc(Br)c(Cl)c2F)C1 ZINC001237890456 1055551005 /nfs/dbraw/zinc/55/10/05/1055551005.db2.gz ZWBYBXAKLQWXKI-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cnc(C(F)(F)F)s2)CCC1(F)F ZINC001237942186 1055563963 /nfs/dbraw/zinc/56/39/63/1055563963.db2.gz DGRIYBPSPBAZTP-QMMMGPOBSA-N 1 2 314.323 4.029 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cnc(C(F)(F)F)s2)CCC1(F)F ZINC001237942186 1055563968 /nfs/dbraw/zinc/56/39/68/1055563968.db2.gz DGRIYBPSPBAZTP-QMMMGPOBSA-N 1 2 314.323 4.029 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cnc(C(F)(F)F)s2)CCC1(F)F ZINC001237942185 1055564326 /nfs/dbraw/zinc/56/43/26/1055564326.db2.gz DGRIYBPSPBAZTP-MRVPVSSYSA-N 1 2 314.323 4.029 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cnc(C(F)(F)F)s2)CCC1(F)F ZINC001237942185 1055564333 /nfs/dbraw/zinc/56/43/33/1055564333.db2.gz DGRIYBPSPBAZTP-MRVPVSSYSA-N 1 2 314.323 4.029 20 0 DIADLO Clc1cc(C[NH+]2CCC(c3cn[nH]c3)CC2)c(Cl)s1 ZINC000449019865 1055573212 /nfs/dbraw/zinc/57/32/12/1055573212.db2.gz NWRRTAIBNXDCSL-UHFFFAOYSA-N 1 2 316.257 4.158 20 0 DIADLO C[N@H+](Cc1cc(F)c(O)c(Cl)c1)[C@@H]1CCc2ccccc21 ZINC001237991636 1055576249 /nfs/dbraw/zinc/57/62/49/1055576249.db2.gz CYFWPRYUGNELPM-MRXNPFEDSA-N 1 2 305.780 4.304 20 0 DIADLO C[N@@H+](Cc1cc(F)c(O)c(Cl)c1)[C@@H]1CCc2ccccc21 ZINC001237991636 1055576262 /nfs/dbraw/zinc/57/62/62/1055576262.db2.gz CYFWPRYUGNELPM-MRXNPFEDSA-N 1 2 305.780 4.304 20 0 DIADLO Clc1ccc2c(c1)n[nH]c2C[N@@H+]1CCC[C@H]1c1nccs1 ZINC001238000761 1055582043 /nfs/dbraw/zinc/58/20/43/1055582043.db2.gz NYWQXTQTGJMCRZ-AWEZNQCLSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1ccc2c(c1)n[nH]c2C[N@H+]1CCC[C@H]1c1nccs1 ZINC001238000761 1055582051 /nfs/dbraw/zinc/58/20/51/1055582051.db2.gz NYWQXTQTGJMCRZ-AWEZNQCLSA-N 1 2 318.833 4.010 20 0 DIADLO CC(C)CCN(CCC(C)C)C(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001595308717 1055583493 /nfs/dbraw/zinc/58/34/93/1055583493.db2.gz QGCITJJGZSDNES-SFHVURJKSA-N 1 2 321.509 4.391 20 0 DIADLO Fc1cc(Cl)c(C[N@H+]2CC=C(c3ccccc3)CC2)cn1 ZINC001238026842 1055586387 /nfs/dbraw/zinc/58/63/87/1055586387.db2.gz BNACGXRHUCITGT-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Fc1cc(Cl)c(C[N@@H+]2CC=C(c3ccccc3)CC2)cn1 ZINC001238026842 1055586394 /nfs/dbraw/zinc/58/63/94/1055586394.db2.gz BNACGXRHUCITGT-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2cnc(F)cc2Cl)cc1 ZINC001238021561 1055588893 /nfs/dbraw/zinc/58/88/93/1055588893.db2.gz XUMOPLYSYVPMSA-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2cnc(F)cc2Cl)cc1 ZINC001238021561 1055588906 /nfs/dbraw/zinc/58/89/06/1055588906.db2.gz XUMOPLYSYVPMSA-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1C[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC001238063455 1055597277 /nfs/dbraw/zinc/59/72/77/1055597277.db2.gz SIMYOYHAHVLPOT-INIZCTEOSA-N 1 2 309.409 4.198 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1C[N@H+]1CCC(=O)[C@@H](C)C1 ZINC001238063455 1055597290 /nfs/dbraw/zinc/59/72/90/1055597290.db2.gz SIMYOYHAHVLPOT-INIZCTEOSA-N 1 2 309.409 4.198 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@@H]2CCCCC23CCCC3)c[nH+]1 ZINC001564807944 1055602298 /nfs/dbraw/zinc/60/22/98/1055602298.db2.gz ICUBDWNOWCDSOK-QGZVFWFLSA-N 1 2 315.461 4.001 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@H](F)CC2)c(F)c1Br ZINC001238079028 1055603809 /nfs/dbraw/zinc/60/38/09/1055603809.db2.gz UCFDPTAZKCUCBF-JTQLQIEISA-N 1 2 322.168 4.051 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@H](F)CC2)c(F)c1Br ZINC001238079028 1055603817 /nfs/dbraw/zinc/60/38/17/1055603817.db2.gz UCFDPTAZKCUCBF-JTQLQIEISA-N 1 2 322.168 4.051 20 0 DIADLO C[N@H+](Cc1cc(Cl)c(O)cc1F)[C@@H]1CCc2ccccc21 ZINC001238151257 1055611889 /nfs/dbraw/zinc/61/18/89/1055611889.db2.gz AKTFQCUOMWSNRX-MRXNPFEDSA-N 1 2 305.780 4.304 20 0 DIADLO C[N@@H+](Cc1cc(Cl)c(O)cc1F)[C@@H]1CCc2ccccc21 ZINC001238151257 1055611892 /nfs/dbraw/zinc/61/18/92/1055611892.db2.gz AKTFQCUOMWSNRX-MRXNPFEDSA-N 1 2 305.780 4.304 20 0 DIADLO C[N@H+](Cc1nc2ccccc2s1)Cc1cncc(C2CC2)c1 ZINC001238181233 1055614555 /nfs/dbraw/zinc/61/45/55/1055614555.db2.gz FXGSHZCHLBYABX-UHFFFAOYSA-N 1 2 309.438 4.201 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2s1)Cc1cncc(C2CC2)c1 ZINC001238181233 1055614562 /nfs/dbraw/zinc/61/45/62/1055614562.db2.gz FXGSHZCHLBYABX-UHFFFAOYSA-N 1 2 309.438 4.201 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1cccc(-c3cc[nH]n3)c1)C2 ZINC001238204964 1055619924 /nfs/dbraw/zinc/61/99/24/1055619924.db2.gz XBCXKNISSFMKNW-UHFFFAOYSA-N 1 2 309.800 4.246 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1cccc(-c3cc[nH]n3)c1)C2 ZINC001238204964 1055619929 /nfs/dbraw/zinc/61/99/29/1055619929.db2.gz XBCXKNISSFMKNW-UHFFFAOYSA-N 1 2 309.800 4.246 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1cccc(-c3cc[nH]n3)c1)C2 ZINC001238204277 1055620399 /nfs/dbraw/zinc/62/03/99/1055620399.db2.gz RDSWNLWHAGLKSW-UHFFFAOYSA-N 1 2 309.800 4.246 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1cccc(-c3cc[nH]n3)c1)C2 ZINC001238204277 1055620402 /nfs/dbraw/zinc/62/04/02/1055620402.db2.gz RDSWNLWHAGLKSW-UHFFFAOYSA-N 1 2 309.800 4.246 20 0 DIADLO Cc1c(Cl)ccc(C[N@@H+]2CCC[C@H]2c2ncccn2)c1C ZINC001238221923 1055625004 /nfs/dbraw/zinc/62/50/04/1055625004.db2.gz GZSZVEYOJQAYSD-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1c(Cl)ccc(C[N@H+]2CCC[C@H]2c2ncccn2)c1C ZINC001238221923 1055625006 /nfs/dbraw/zinc/62/50/06/1055625006.db2.gz GZSZVEYOJQAYSD-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1c(Cl)ccc(C[N@@H+]2CCC[C@@H]2c2ncccn2)c1C ZINC001238221930 1055625066 /nfs/dbraw/zinc/62/50/66/1055625066.db2.gz GZSZVEYOJQAYSD-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1c(Cl)ccc(C[N@H+]2CCC[C@@H]2c2ncccn2)c1C ZINC001238221930 1055625070 /nfs/dbraw/zinc/62/50/70/1055625070.db2.gz GZSZVEYOJQAYSD-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO C[C@@]1(CF)CC[N@H+](Cc2ccc(F)c(C(F)(F)F)c2F)C1 ZINC001238242526 1055627426 /nfs/dbraw/zinc/62/74/26/1055627426.db2.gz IIDJBEGBEDQLPO-ZDUSSCGKSA-N 1 2 311.269 4.165 20 0 DIADLO C[C@@]1(CF)CC[N@@H+](Cc2ccc(F)c(C(F)(F)F)c2F)C1 ZINC001238242526 1055627430 /nfs/dbraw/zinc/62/74/30/1055627430.db2.gz IIDJBEGBEDQLPO-ZDUSSCGKSA-N 1 2 311.269 4.165 20 0 DIADLO CC1(F)CC[NH+](Cc2ccc(F)c(C(F)(F)F)c2F)CC1 ZINC001238242694 1055629078 /nfs/dbraw/zinc/62/90/78/1055629078.db2.gz KRHZGGOUOFRWOP-UHFFFAOYSA-N 1 2 311.269 4.308 20 0 DIADLO CC(C)c1ccc(C[NH+]2CC(C(F)F)C2)c(Br)c1 ZINC001238264090 1055631307 /nfs/dbraw/zinc/63/13/07/1055631307.db2.gz OKNFUVKNSCNLRO-UHFFFAOYSA-N 1 2 318.205 4.269 20 0 DIADLO Cc1cc(Cl)c(Cl)cc1C[NH+]1CC2(C1)C[C@H](F)CS2 ZINC001238265724 1055634480 /nfs/dbraw/zinc/63/44/80/1055634480.db2.gz DWRKPQKAMMGZSB-NSHDSACASA-N 1 2 320.260 4.331 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(Cl)nc2)c(F)cc1Cl ZINC001238303716 1055636638 /nfs/dbraw/zinc/63/66/38/1055636638.db2.gz VWPCFKVUWXAKGB-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(Cl)nc2)c(F)cc1Cl ZINC001238303716 1055636647 /nfs/dbraw/zinc/63/66/47/1055636647.db2.gz VWPCFKVUWXAKGB-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO CC(C)Oc1c(F)cccc1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC001238322039 1055639055 /nfs/dbraw/zinc/63/90/55/1055639055.db2.gz HEJBRCPROCYDAR-UHFFFAOYSA-N 1 2 321.436 4.148 20 0 DIADLO CC(C)Oc1c(F)cccc1C[N@H+]1CCOC2(CCCCC2)C1 ZINC001238322039 1055639062 /nfs/dbraw/zinc/63/90/62/1055639062.db2.gz HEJBRCPROCYDAR-UHFFFAOYSA-N 1 2 321.436 4.148 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@H+](C)Cc1cccc(C)c1 ZINC001238335751 1055641102 /nfs/dbraw/zinc/64/11/02/1055641102.db2.gz WCHSAVDZAAEUHB-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@@H+](C)Cc1cccc(C)c1 ZINC001238335751 1055641105 /nfs/dbraw/zinc/64/11/05/1055641105.db2.gz WCHSAVDZAAEUHB-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c(F)c1O ZINC001238358693 1055644218 /nfs/dbraw/zinc/64/42/18/1055644218.db2.gz RUWNPVGKHHGCJG-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c(F)c1O ZINC001238358693 1055644227 /nfs/dbraw/zinc/64/42/27/1055644227.db2.gz RUWNPVGKHHGCJG-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+]Cc1ccnn1C1CCC1 ZINC000921619576 1055651254 /nfs/dbraw/zinc/65/12/54/1055651254.db2.gz CJMYAMOWFHWBMQ-UHFFFAOYSA-N 1 2 310.228 4.205 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3sccc3C2)c(Cl)c1 ZINC001238394405 1055651444 /nfs/dbraw/zinc/65/14/44/1055651444.db2.gz IXVUYMUWHFMJAJ-UHFFFAOYSA-N 1 2 307.846 4.359 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3sccc3C2)c(Cl)c1 ZINC001238394405 1055651446 /nfs/dbraw/zinc/65/14/46/1055651446.db2.gz IXVUYMUWHFMJAJ-UHFFFAOYSA-N 1 2 307.846 4.359 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(C)c(Cl)cn2)cn1 ZINC001238424043 1055656040 /nfs/dbraw/zinc/65/60/40/1055656040.db2.gz VCTKVLUIKHQICG-QGZVFWFLSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc(C)c(Cl)cn2)cn1 ZINC001238424043 1055656045 /nfs/dbraw/zinc/65/60/45/1055656045.db2.gz VCTKVLUIKHQICG-QGZVFWFLSA-N 1 2 301.821 4.084 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)cnc1F ZINC001238462204 1055666694 /nfs/dbraw/zinc/66/66/94/1055666694.db2.gz IWJZOBLNSHYUOE-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)cnc1F ZINC001238462204 1055666700 /nfs/dbraw/zinc/66/67/00/1055666700.db2.gz IWJZOBLNSHYUOE-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO CCCCc1noc(C[NH2+]C2(c3ccc(F)cc3)CCCC2)n1 ZINC000104076393 1055667095 /nfs/dbraw/zinc/66/70/95/1055667095.db2.gz RZGKHWSMQAHBFH-UHFFFAOYSA-N 1 2 317.408 4.110 20 0 DIADLO Cc1ccc(OC(C)C)cc1C[N@H+](C)CC(=O)c1ccccc1 ZINC001238479769 1055669426 /nfs/dbraw/zinc/66/94/26/1055669426.db2.gz HJUODVAXECXITJ-UHFFFAOYSA-N 1 2 311.425 4.097 20 0 DIADLO Cc1ccc(OC(C)C)cc1C[N@@H+](C)CC(=O)c1ccccc1 ZINC001238479769 1055669430 /nfs/dbraw/zinc/66/94/30/1055669430.db2.gz HJUODVAXECXITJ-UHFFFAOYSA-N 1 2 311.425 4.097 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccc(F)c(C3CC3)c1)CC2 ZINC001238518260 1055677912 /nfs/dbraw/zinc/67/79/12/1055677912.db2.gz ZXKBQANMKFWWPF-UHFFFAOYSA-N 1 2 323.411 4.464 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1ccc(F)c(C3CC3)c1)CC2 ZINC001238518260 1055677919 /nfs/dbraw/zinc/67/79/19/1055677919.db2.gz ZXKBQANMKFWWPF-UHFFFAOYSA-N 1 2 323.411 4.464 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@@H+]2CCc3ccsc3C2)c1F ZINC001238534052 1055680000 /nfs/dbraw/zinc/68/00/00/1055680000.db2.gz ZYUNGLUIDBRMDM-UHFFFAOYSA-N 1 2 323.408 4.372 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@H+]2CCc3ccsc3C2)c1F ZINC001238534052 1055680005 /nfs/dbraw/zinc/68/00/05/1055680005.db2.gz ZYUNGLUIDBRMDM-UHFFFAOYSA-N 1 2 323.408 4.372 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2cc(C)ccc2Cl)c1OC ZINC001238568489 1055689257 /nfs/dbraw/zinc/68/92/57/1055689257.db2.gz HLXZSCDLXWQQFL-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2cc(C)ccc2Cl)c1OC ZINC001238568489 1055689260 /nfs/dbraw/zinc/68/92/60/1055689260.db2.gz HLXZSCDLXWQQFL-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1ccc(C(F)F)cc1 ZINC000338621029 1055695641 /nfs/dbraw/zinc/69/56/41/1055695641.db2.gz NORHYGXPJPDGST-UHFFFAOYSA-N 1 2 313.307 4.062 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3cccc(Cl)c3C2)cnc1C1CC1 ZINC001238625546 1055703362 /nfs/dbraw/zinc/70/33/62/1055703362.db2.gz QWNCNGCDSCTIED-UHFFFAOYSA-N 1 2 312.844 4.479 20 0 DIADLO Cc1cc(C[N@H+]2CCc3cccc(Cl)c3C2)cnc1C1CC1 ZINC001238625546 1055703374 /nfs/dbraw/zinc/70/33/74/1055703374.db2.gz QWNCNGCDSCTIED-UHFFFAOYSA-N 1 2 312.844 4.479 20 0 DIADLO Cc1ccc(-c2csc(C[NH+]3CCC(F)(F)CC3)n2)cc1 ZINC000671692590 1055703999 /nfs/dbraw/zinc/70/39/99/1055703999.db2.gz FCBOPGMNKQMOKM-UHFFFAOYSA-N 1 2 308.397 4.350 20 0 DIADLO Clc1ccc(-c2cccc(C[N@@H+]3Cc4ccncc4C3)c2)nc1 ZINC001238642683 1055707808 /nfs/dbraw/zinc/70/78/08/1055707808.db2.gz WEDLUNLRVYRQCM-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1ccc(-c2cccc(C[N@H+]3Cc4ccncc4C3)c2)nc1 ZINC001238642683 1055707819 /nfs/dbraw/zinc/70/78/19/1055707819.db2.gz WEDLUNLRVYRQCM-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC001238654496 1055708613 /nfs/dbraw/zinc/70/86/13/1055708613.db2.gz XMSSLHSXDHJJOL-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC001238654496 1055708629 /nfs/dbraw/zinc/70/86/29/1055708629.db2.gz XMSSLHSXDHJJOL-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1cc(-c2ccccc2)cnc1F ZINC001238659065 1055710980 /nfs/dbraw/zinc/71/09/80/1055710980.db2.gz QJZIAPBCQHIBHP-UHFFFAOYSA-N 1 2 321.399 4.305 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1cc(-c2ccccc2)cnc1F ZINC001238659065 1055710989 /nfs/dbraw/zinc/71/09/89/1055710989.db2.gz QJZIAPBCQHIBHP-UHFFFAOYSA-N 1 2 321.399 4.305 20 0 DIADLO Cc1ccccc1[C@@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001565582223 1055711231 /nfs/dbraw/zinc/71/12/31/1055711231.db2.gz MMQJZAXALQGPQX-MRXNPFEDSA-N 1 2 319.408 4.231 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+](Cc1c(C)cc(OC(C)C)cc1C)C2 ZINC001238664911 1055714084 /nfs/dbraw/zinc/71/40/84/1055714084.db2.gz SJCBNUSMIZVBRN-UHFFFAOYSA-N 1 2 310.441 4.310 20 0 DIADLO Cc1cc2c(cn1)C[N@H+](Cc1c(C)cc(OC(C)C)cc1C)C2 ZINC001238664911 1055714097 /nfs/dbraw/zinc/71/40/97/1055714097.db2.gz SJCBNUSMIZVBRN-UHFFFAOYSA-N 1 2 310.441 4.310 20 0 DIADLO CSc1ccc(Cl)cc1C[N@@H+]1CCc2cnccc2C1 ZINC001238673152 1055717542 /nfs/dbraw/zinc/71/75/42/1055717542.db2.gz UJNLDROQHVPDKG-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CSc1ccc(Cl)cc1C[N@H+]1CCc2cnccc2C1 ZINC001238673152 1055717553 /nfs/dbraw/zinc/71/75/53/1055717553.db2.gz UJNLDROQHVPDKG-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CC(C)C[C@@H](C(=O)N1CC[C@H](C)c2ccccc21)n1cc[nH+]c1 ZINC001596529489 1055719795 /nfs/dbraw/zinc/71/97/95/1055719795.db2.gz ZOMIWDOIMKUIHA-YJBOKZPZSA-N 1 2 311.429 4.011 20 0 DIADLO CSc1cc(C)cc(C[N@@H+]2CCC[C@H]2C(=O)OC(C)(C)C)c1 ZINC001238686144 1055721112 /nfs/dbraw/zinc/72/11/12/1055721112.db2.gz VAXMOVBGUQWELZ-INIZCTEOSA-N 1 2 321.486 4.023 20 0 DIADLO CSc1cc(C)cc(C[N@H+]2CCC[C@H]2C(=O)OC(C)(C)C)c1 ZINC001238686144 1055721124 /nfs/dbraw/zinc/72/11/24/1055721124.db2.gz VAXMOVBGUQWELZ-INIZCTEOSA-N 1 2 321.486 4.023 20 0 DIADLO Cc1ccccc1[C@H](CC(C)C)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001565728758 1055722185 /nfs/dbraw/zinc/72/21/85/1055722185.db2.gz DSKTWWUYHXTFHX-SFHVURJKSA-N 1 2 321.424 4.389 20 0 DIADLO Clc1ccc(-c2ccc(C[N@@H+]3Cc4cccnc4C3)cc2)nc1 ZINC001238687808 1055723486 /nfs/dbraw/zinc/72/34/86/1055723486.db2.gz GNSDYBOCPCPWMY-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1ccc(-c2ccc(C[N@H+]3Cc4cccnc4C3)cc2)nc1 ZINC001238687808 1055723498 /nfs/dbraw/zinc/72/34/98/1055723498.db2.gz GNSDYBOCPCPWMY-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO CC(C)Oc1cc(F)ccc1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC001238701106 1055725869 /nfs/dbraw/zinc/72/58/69/1055725869.db2.gz WOQJZWYAYXVZHG-UHFFFAOYSA-N 1 2 321.436 4.148 20 0 DIADLO CC(C)Oc1cc(F)ccc1C[N@H+]1CCOC2(CCCCC2)C1 ZINC001238701106 1055725880 /nfs/dbraw/zinc/72/58/80/1055725880.db2.gz WOQJZWYAYXVZHG-UHFFFAOYSA-N 1 2 321.436 4.148 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc(C(F)F)cc3)cc2[nH+]1 ZINC000338641445 1055729924 /nfs/dbraw/zinc/72/99/24/1055729924.db2.gz YVVKYDUUZPMNJZ-UHFFFAOYSA-N 1 2 301.296 4.061 20 0 DIADLO CSc1ncc(C)cc1C[N@H+](C)Cc1ccccc1Cl ZINC001238715911 1055730841 /nfs/dbraw/zinc/73/08/41/1055730841.db2.gz KGUMUEYETODUDY-UHFFFAOYSA-N 1 2 306.862 4.397 20 0 DIADLO CSc1ncc(C)cc1C[N@@H+](C)Cc1ccccc1Cl ZINC001238715911 1055730851 /nfs/dbraw/zinc/73/08/51/1055730851.db2.gz KGUMUEYETODUDY-UHFFFAOYSA-N 1 2 306.862 4.397 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1ccc(C(C)C)nc1Cl ZINC001238726613 1055735353 /nfs/dbraw/zinc/73/53/53/1055735353.db2.gz ZEFNTVSTYZIFFG-UHFFFAOYSA-N 1 2 303.837 4.276 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1ccc(C(C)C)nc1Cl ZINC001238726613 1055735364 /nfs/dbraw/zinc/73/53/64/1055735364.db2.gz ZEFNTVSTYZIFFG-UHFFFAOYSA-N 1 2 303.837 4.276 20 0 DIADLO Cc1cc(F)cc(Cl)c1C[N@H+](C)Cc1ccc(Cl)nc1 ZINC001238784178 1055750339 /nfs/dbraw/zinc/75/03/39/1055750339.db2.gz FFMJLIBWDZSFEY-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(F)cc(Cl)c1C[N@@H+](C)Cc1ccc(Cl)nc1 ZINC001238784178 1055750351 /nfs/dbraw/zinc/75/03/51/1055750351.db2.gz FFMJLIBWDZSFEY-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cccc(Cn3cc[nH+]c3)c2)c(C)c1 ZINC000047239345 1055753940 /nfs/dbraw/zinc/75/39/40/1055753940.db2.gz JAUJSVRCPPYIAB-UHFFFAOYSA-N 1 2 319.408 4.109 20 0 DIADLO CC(C)c1ccc(NC(=O)c2cccc(Cn3cc[nH+]c3)c2)cc1 ZINC000047240117 1055755139 /nfs/dbraw/zinc/75/51/39/1055755139.db2.gz VRPYWYLGDUWEQN-UHFFFAOYSA-N 1 2 319.408 4.307 20 0 DIADLO CC(C)(C)C1CCC(CNC(=O)c2cc3c[nH+]ccc3[nH]2)CC1 ZINC001566291226 1055757792 /nfs/dbraw/zinc/75/77/92/1055757792.db2.gz FGCRTTUZVZAXJG-UHFFFAOYSA-N 1 2 313.445 4.145 20 0 DIADLO Cc1nc(C)c(C[N@@H+]2CCCn3c(cc4ccccc43)C2)s1 ZINC000347505596 1055766182 /nfs/dbraw/zinc/76/61/82/1055766182.db2.gz VXWLURPDNDKNEN-UHFFFAOYSA-N 1 2 311.454 4.121 20 0 DIADLO Cc1nc(C)c(C[N@H+]2CCCn3c(cc4ccccc43)C2)s1 ZINC000347505596 1055766196 /nfs/dbraw/zinc/76/61/96/1055766196.db2.gz VXWLURPDNDKNEN-UHFFFAOYSA-N 1 2 311.454 4.121 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3csc4ccccc34)nn2)c1C ZINC001238886044 1055780685 /nfs/dbraw/zinc/78/06/85/1055780685.db2.gz AYTQSDITEYUDCR-UHFFFAOYSA-N 1 2 306.394 4.161 20 0 DIADLO COc1ccc(-c2cc[nH+]c(N3CCCC3)c2)cc1OC(C)C ZINC001238930016 1055793938 /nfs/dbraw/zinc/79/39/38/1055793938.db2.gz LMDDYACCHVDQHB-UHFFFAOYSA-N 1 2 312.413 4.145 20 0 DIADLO CC1(C)CC(C)(C)c2cc(NC(=O)[C@@H]3C[C@H]3c3c[nH]c[nH+]3)ccc21 ZINC001567105163 1055794773 /nfs/dbraw/zinc/79/47/73/1055794773.db2.gz JSHSLIJSACDNEM-ZIAGYGMSSA-N 1 2 323.440 4.111 20 0 DIADLO CC1(C)CC(C)(C)c2cc(NC(=O)[C@@H]3C[C@H]3c3c[nH+]c[nH]3)ccc21 ZINC001567105163 1055794789 /nfs/dbraw/zinc/79/47/89/1055794789.db2.gz JSHSLIJSACDNEM-ZIAGYGMSSA-N 1 2 323.440 4.111 20 0 DIADLO CC(C)Sc1nnc([C@@H](C)[NH+](C)C)n1-c1ccc(Cl)cc1 ZINC000058165641 1055796765 /nfs/dbraw/zinc/79/67/65/1055796765.db2.gz MCZOMUZRUNRWQZ-LLVKDONJSA-N 1 2 324.881 4.044 20 0 DIADLO CSc1ccc(C)c(C(=O)Nc2ccccc2-n2cc[nH+]c2)c1 ZINC000058979561 1055822024 /nfs/dbraw/zinc/82/20/24/1055822024.db2.gz NYYZMMVEOQSYRF-UHFFFAOYSA-N 1 2 323.421 4.155 20 0 DIADLO Cc1nc(C[N@H+](Cc2cccc(F)c2)C2CC2)nc2ccccc12 ZINC000107896471 1055822081 /nfs/dbraw/zinc/82/20/81/1055822081.db2.gz LTGRQSKUILPZHH-UHFFFAOYSA-N 1 2 321.399 4.242 20 0 DIADLO Cc1nc(C[N@@H+](Cc2cccc(F)c2)C2CC2)nc2ccccc12 ZINC000107896471 1055822089 /nfs/dbraw/zinc/82/20/89/1055822089.db2.gz LTGRQSKUILPZHH-UHFFFAOYSA-N 1 2 321.399 4.242 20 0 DIADLO Cc1cc(C)c(CNC(=O)[C@H](C)c2ccc3ccccc3c2)c[nH+]1 ZINC001597402397 1055824708 /nfs/dbraw/zinc/82/47/08/1055824708.db2.gz FAGMQKZOTHDBRI-MRXNPFEDSA-N 1 2 318.420 4.272 20 0 DIADLO Cc1cc(C)c(CNC(=O)/C=C/[C@]2(C)CC[C@H](C)C2(C)C)c[nH+]1 ZINC001597403829 1055826766 /nfs/dbraw/zinc/82/67/66/1055826766.db2.gz YUGXUPPJZJOHFD-FAVSSPFPSA-N 1 2 314.473 4.333 20 0 DIADLO c1cn(Cc2ccccc2CNc2nc3ccccc3s2)c[nH+]1 ZINC000060446095 1055836748 /nfs/dbraw/zinc/83/67/48/1055836748.db2.gz HZKAWOHVGREDLO-UHFFFAOYSA-N 1 2 320.421 4.153 20 0 DIADLO CCN(CC)[C@H](C[NH2+]Cc1c(F)cccc1F)c1ccccc1 ZINC000060832359 1055851570 /nfs/dbraw/zinc/85/15/70/1055851570.db2.gz ARGPJPRCLFWGLM-LJQANCHMSA-N 1 2 318.411 4.138 20 0 DIADLO CC(C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1)=C1CCCC1 ZINC001569263192 1055857440 /nfs/dbraw/zinc/85/74/40/1055857440.db2.gz XSQJQBZHEZKOHE-UHFFFAOYSA-N 1 2 309.413 4.130 20 0 DIADLO Cc1cn2cc(-c3cc(Cl)cnc3OC(C)C)ccc2[nH+]1 ZINC001239322730 1055870070 /nfs/dbraw/zinc/87/00/70/1055870070.db2.gz NQIAPYQJKZREMD-UHFFFAOYSA-N 1 2 301.777 4.145 20 0 DIADLO CCC(CC)N(CC)C(=O)[C@H]1CC[C@@H](Nc2cccc[nH+]2)CC1 ZINC001569892944 1055876351 /nfs/dbraw/zinc/87/63/51/1055876351.db2.gz ADSGUFAJNGDTFX-IYBDPMFKSA-N 1 2 317.477 4.089 20 0 DIADLO C[N@H+](Cc1noc(C2CCCCC2)n1)C1CCC(F)(F)CC1 ZINC000347619782 1055894882 /nfs/dbraw/zinc/89/48/82/1055894882.db2.gz QVBJAKYGNQLOAU-UHFFFAOYSA-N 1 2 313.392 4.127 20 0 DIADLO C[N@@H+](Cc1noc(C2CCCCC2)n1)C1CCC(F)(F)CC1 ZINC000347619782 1055894894 /nfs/dbraw/zinc/89/48/94/1055894894.db2.gz QVBJAKYGNQLOAU-UHFFFAOYSA-N 1 2 313.392 4.127 20 0 DIADLO Cc1cc(CNC(=O)[C@H](C)c2cccc(CC(C)C)c2)cc(C)[nH+]1 ZINC001597955457 1055897164 /nfs/dbraw/zinc/89/71/64/1055897164.db2.gz BLBQYFRZEGDWGG-QGZVFWFLSA-N 1 2 324.468 4.317 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2ccc(-c3ccccc3)cc2)cc1 ZINC001239493393 1055907858 /nfs/dbraw/zinc/90/78/58/1055907858.db2.gz LKAIINHLJVDOCU-FQEVSTJZSA-N 1 2 317.388 4.193 20 0 DIADLO Cc1ccccc1-c1ccc(-c2ccc(-n3cc[nH+]c3)cc2)nn1 ZINC001239501777 1055914432 /nfs/dbraw/zinc/91/44/32/1055914432.db2.gz LFQXUQGEYUUKPA-UHFFFAOYSA-N 1 2 312.376 4.305 20 0 DIADLO CC[N@H+](Cc1nc(C2CC2)no1)[C@H](C)c1cc2ccccc2o1 ZINC000064348751 1055915386 /nfs/dbraw/zinc/91/53/86/1055915386.db2.gz DOIWOLSRLGKULG-GFCCVEGCSA-N 1 2 311.385 4.276 20 0 DIADLO CC[N@@H+](Cc1nc(C2CC2)no1)[C@H](C)c1cc2ccccc2o1 ZINC000064348751 1055915395 /nfs/dbraw/zinc/91/53/95/1055915395.db2.gz DOIWOLSRLGKULG-GFCCVEGCSA-N 1 2 311.385 4.276 20 0 DIADLO CS[C@@H]1CC[C@H]1[NH2+][C@@H](CCC(C)(C)C)C(=O)OC(C)(C)C ZINC001621343528 1055929029 /nfs/dbraw/zinc/92/90/29/1055929029.db2.gz RKRJREDZMCTVKO-HZSPNIEDSA-N 1 2 315.523 4.007 20 0 DIADLO Fc1ccc(C[NH2+][C@@H](c2ccccc2)c2cccnc2)c(F)c1 ZINC001649083898 1055937962 /nfs/dbraw/zinc/93/79/62/1055937962.db2.gz JATUDJOMFANSMV-IBGZPJMESA-N 1 2 310.347 4.239 20 0 DIADLO Cc1ccc(C)c(C[NH2+][C@H](c2nccn2C)c2ccc(F)cc2)c1 ZINC000030644360 1055941137 /nfs/dbraw/zinc/94/11/37/1055941137.db2.gz GHZNYVBPFVSFAJ-IBGZPJMESA-N 1 2 323.415 4.055 20 0 DIADLO Nc1cc(-c2ccccc2C(F)(F)F)[nH+]cc1C(F)(F)F ZINC001239543103 1055941806 /nfs/dbraw/zinc/94/18/06/1055941806.db2.gz LJRQCSVQFBATSC-UHFFFAOYSA-N 1 2 306.209 4.368 20 0 DIADLO Fc1ccccc1-c1ccc(-c2ccc(-n3cc[nH+]c3)cc2)nn1 ZINC001239552772 1055951070 /nfs/dbraw/zinc/95/10/70/1055951070.db2.gz HOQZVAWKOJTVOL-UHFFFAOYSA-N 1 2 316.339 4.135 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@@H+]([C@H](C)c1ccccc1)C3 ZINC001620539597 1055964445 /nfs/dbraw/zinc/96/44/45/1055964445.db2.gz OEGVSHWDCMNKIC-CQSZACIVSA-N 1 2 306.409 4.296 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@H+]([C@H](C)c1ccccc1)C3 ZINC001620539597 1055964457 /nfs/dbraw/zinc/96/44/57/1055964457.db2.gz OEGVSHWDCMNKIC-CQSZACIVSA-N 1 2 306.409 4.296 20 0 DIADLO C(=C/c1ccc(-c2ccc(-n3cc[nH+]c3)cc2)nn1)\c1ccccc1 ZINC001239592526 1055969645 /nfs/dbraw/zinc/96/96/45/1055969645.db2.gz UYKSPNOSJFZRAH-RMKNXTFCSA-N 1 2 324.387 4.500 20 0 DIADLO CN(C(=O)c1cc2c[nH+]ccc2[nH]1)C1CCC(C(C)(C)C)CC1 ZINC001540128885 1055975645 /nfs/dbraw/zinc/97/56/45/1055975645.db2.gz FICYWRIRTSKVKW-UHFFFAOYSA-N 1 2 313.445 4.240 20 0 DIADLO Cc1cc(C[NH2+]Cc2ccc(OCc3ccc(C)cc3)cc2)no1 ZINC000066875434 1055984293 /nfs/dbraw/zinc/98/42/93/1055984293.db2.gz SBCJDHHNZMJSNJ-UHFFFAOYSA-N 1 2 322.408 4.160 20 0 DIADLO CCc1ccc(C[NH2+]Cc2c(Cl)cccc2OC(F)F)o1 ZINC001621034692 1055997055 /nfs/dbraw/zinc/99/70/55/1055997055.db2.gz KPMAVKGPODTWTG-UHFFFAOYSA-N 1 2 315.747 4.387 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1ccc2c(c1)C[C@H](C)O2 ZINC001621043631 1056003428 /nfs/dbraw/zinc/00/34/28/1056003428.db2.gz MNYLOLPGJCTBFO-ZDUSSCGKSA-N 1 2 314.454 4.270 20 0 DIADLO COc1ccc(C[NH2+][C@@H]2c3ccccc3CC[C@H]2F)c(Cl)c1 ZINC001621043366 1056003985 /nfs/dbraw/zinc/00/39/85/1056003985.db2.gz DENNTHWHBQCJAZ-QZTJIDSGSA-N 1 2 319.807 4.464 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cccc2ncccc12 ZINC001621043386 1056004871 /nfs/dbraw/zinc/00/48/71/1056004871.db2.gz FHQDIDXCNKTUHS-UHFFFAOYSA-N 1 2 309.438 4.495 20 0 DIADLO Cc1ccc2[nH+]c(NCc3cnc(C(C)(C)C)s3)[nH]c2c1 ZINC001621046257 1056005965 /nfs/dbraw/zinc/00/59/65/1056005965.db2.gz ZRLKLEITKVBYDW-UHFFFAOYSA-N 1 2 300.431 4.237 20 0 DIADLO COc1c(Br)cccc1CNc1c[nH+]c(C)c(C)c1 ZINC001621047266 1056006135 /nfs/dbraw/zinc/00/61/35/1056006135.db2.gz MODRPLPYAYKMOL-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO Cc1nn(-c2cccc(C)c2)cc1CNc1c[nH+]c(C)c(C)c1 ZINC001621047492 1056006220 /nfs/dbraw/zinc/00/62/20/1056006220.db2.gz UGYJJJKOPUXXGB-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1cnn(CC2CCC2)c1 ZINC001621051355 1056010147 /nfs/dbraw/zinc/01/01/47/1056010147.db2.gz AZMZBSTXRNEBTJ-UHFFFAOYSA-N 1 2 323.444 4.226 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1nc(C)c(C)s1 ZINC001621052031 1056010412 /nfs/dbraw/zinc/01/04/12/1056010412.db2.gz DMQJKUVKGDEVTH-UHFFFAOYSA-N 1 2 320.849 4.395 20 0 DIADLO COc1ccc2c(c1)nccc2-c1cccc(-c2c[nH+]cn2C)c1 ZINC001239684652 1056026584 /nfs/dbraw/zinc/02/65/84/1056026584.db2.gz YAUGDTKWFQXMSU-UHFFFAOYSA-N 1 2 315.376 4.311 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccnc3cc(OC)ccc32)c1 ZINC001239684130 1056026934 /nfs/dbraw/zinc/02/69/34/1056026934.db2.gz SBAHPNFSXOBETF-UHFFFAOYSA-N 1 2 306.365 4.272 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@H](c2ccc(F)cc2)C(C)C)n1 ZINC000072558003 1056030040 /nfs/dbraw/zinc/03/00/40/1056030040.db2.gz CXIJKXGMECEKBP-SFHVURJKSA-N 1 2 319.424 4.284 20 0 DIADLO Cc1cccc([C@@H](C)[N@H+](C)Cc2nccn2Cc2ccccc2)c1 ZINC000072774459 1056033423 /nfs/dbraw/zinc/03/34/23/1056033423.db2.gz RQQWNPADEODLKW-GOSISDBHSA-N 1 2 319.452 4.433 20 0 DIADLO Cc1cccc([C@@H](C)[N@@H+](C)Cc2nccn2Cc2ccccc2)c1 ZINC000072774459 1056033438 /nfs/dbraw/zinc/03/34/38/1056033438.db2.gz RQQWNPADEODLKW-GOSISDBHSA-N 1 2 319.452 4.433 20 0 DIADLO CCC[C@](C)(NC(=O)c1cc2c[nH+]ccc2[nH]1)c1ccccc1 ZINC001607230582 1056044505 /nfs/dbraw/zinc/04/45/05/1056044505.db2.gz OEQSPBCYSZCSRF-IBGZPJMESA-N 1 2 307.397 4.008 20 0 DIADLO Cc1cccc(NC(=O)C[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1C ZINC001540600745 1056050635 /nfs/dbraw/zinc/05/06/35/1056050635.db2.gz ZSHDKEFHBGHICM-QGZVFWFLSA-N 1 2 319.408 4.187 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)c(F)c1 ZINC001583400740 1056076564 /nfs/dbraw/zinc/07/65/64/1056076564.db2.gz ZFFAUOSQTYZMHV-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)/C=C\C=C(Cl)Cl ZINC001611244622 1056130071 /nfs/dbraw/zinc/13/00/71/1056130071.db2.gz JXUUXIQOPKBQBY-RQOWECAXSA-N 1 2 322.195 4.199 20 0 DIADLO CC(C)O[C@@H]1C[C@@H](Nc2ccc([NH+]3CCCC3)cc2)C1(C)C ZINC000765811332 1056153085 /nfs/dbraw/zinc/15/30/85/1056153085.db2.gz QAPCBEHOFDUFSE-QZTJIDSGSA-N 1 2 302.462 4.291 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@H](C)c1cccnc1Cl)CCC2 ZINC000765812449 1056157920 /nfs/dbraw/zinc/15/79/20/1056157920.db2.gz AXYBMZCQHZBJRQ-IUODEOHRSA-N 1 2 318.852 4.241 20 0 DIADLO CCc1ccc(C[NH2+][C@H](c2nccn2C)c2ccc(F)cc2)cc1 ZINC000030644395 1056172875 /nfs/dbraw/zinc/17/28/75/1056172875.db2.gz HCPXMJXINMAKNI-IBGZPJMESA-N 1 2 323.415 4.001 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)CSC(C)(C)C)cc2)[nH+]c1C ZINC000921667060 1056178767 /nfs/dbraw/zinc/17/87/67/1056178767.db2.gz LGLFAQYNNYJSFW-UHFFFAOYSA-N 1 2 317.458 4.164 20 0 DIADLO CNc1ccc(Nc2ccc(C(C)=O)cc2C(F)(F)F)c[nH+]1 ZINC001203462431 1056187881 /nfs/dbraw/zinc/18/78/81/1056187881.db2.gz RDOZOAMBDOVZFK-UHFFFAOYSA-N 1 2 309.291 4.088 20 0 DIADLO CCC[C@H]1CCCC[C@@H]1CNC(=O)c1c(C)cc(C)[nH+]c1C ZINC001583876226 1056191831 /nfs/dbraw/zinc/19/18/31/1056191831.db2.gz DICSXWQWIPBCEL-DLBZAZTESA-N 1 2 302.462 4.343 20 0 DIADLO CCc1cc(N[C@@H](C)Cc2ccccc2Cl)nc(CC)[nH+]1 ZINC001611809155 1056194251 /nfs/dbraw/zinc/19/42/51/1056194251.db2.gz BLGMJLPZENPICW-LBPRGKRZSA-N 1 2 303.837 4.298 20 0 DIADLO CC(=O)n1ncc2ccc(Nc3c(C)cc[nH+]c3C(C)C)cc21 ZINC001212416711 1056221045 /nfs/dbraw/zinc/22/10/45/1056221045.db2.gz GCABDEVEKKUQBN-UHFFFAOYSA-N 1 2 308.385 4.267 20 0 DIADLO CCCCc1ccc(OC(=O)c2ccn3c(C)c[nH+]c3c2)cc1 ZINC001583977747 1056226138 /nfs/dbraw/zinc/22/61/38/1056226138.db2.gz DQNHABIORVPPOP-UHFFFAOYSA-N 1 2 308.381 4.205 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(C(=O)NC(C)(C)C)cc2)c1 ZINC001239992451 1056230942 /nfs/dbraw/zinc/23/09/42/1056230942.db2.gz FWDVBIJBMHBLHY-UHFFFAOYSA-N 1 2 324.424 4.244 20 0 DIADLO Cc1cc(N[C@H]2CCOC3(CCCCC3)C2)nc(C2CCC2)[nH+]1 ZINC001612135486 1056243266 /nfs/dbraw/zinc/24/32/66/1056243266.db2.gz GUHQVJBNQHMJSN-INIZCTEOSA-N 1 2 315.461 4.346 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc2cnccc21 ZINC001240010987 1056250089 /nfs/dbraw/zinc/25/00/89/1056250089.db2.gz NYAGWUDXGMOEAU-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO CC[C@H]([NH2+]CC(=O)c1ccccc1F)c1cc(F)ccc1F ZINC001168633048 1056258537 /nfs/dbraw/zinc/25/85/37/1056258537.db2.gz KZNNSBXCLBODNA-INIZCTEOSA-N 1 2 307.315 4.028 20 0 DIADLO CC(C)c1cc(NC[C@H](CO)CC2CCCC2)nc(C(C)C)[nH+]1 ZINC001612311047 1056269402 /nfs/dbraw/zinc/26/94/02/1056269402.db2.gz UNYWVTURKPYSNL-MRXNPFEDSA-N 1 2 319.493 4.324 20 0 DIADLO O=C(Nc1ccccc1)c1ccc(-c2ccn3cc[nH+]c3c2)cc1 ZINC001240044324 1056278282 /nfs/dbraw/zinc/27/82/82/1056278282.db2.gz MONXKKCGFDDWQE-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO Cc1cc(CNC(=O)/C=C/[C@]2(C)CC[C@@H](C)C2(C)C)cc(C)[nH+]1 ZINC001584183452 1056279082 /nfs/dbraw/zinc/27/90/82/1056279082.db2.gz GPBMNVFYUAMREO-MSAJCJOTSA-N 1 2 314.473 4.333 20 0 DIADLO O=C(Nc1ccccc1)c1ccc(-c2cccc3[nH+]ccn32)cc1 ZINC001240047029 1056282572 /nfs/dbraw/zinc/28/25/72/1056282572.db2.gz IYWLKRNYOCEUOE-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO CN(C)c1cc(-c2ccc(C(=O)Nc3ccccc3)cc2)cc[nH+]1 ZINC001240047934 1056284412 /nfs/dbraw/zinc/28/44/12/1056284412.db2.gz WYKFHVFZSVYNTQ-UHFFFAOYSA-N 1 2 317.392 4.067 20 0 DIADLO Cc1cc(N2CC[C@@H](c3ccccc3F)C2)nc(C2CCC2)[nH+]1 ZINC001612416338 1056284431 /nfs/dbraw/zinc/28/44/31/1056284431.db2.gz LGZHOTLBJUPOMX-OAHLLOKOSA-N 1 2 311.404 4.186 20 0 DIADLO CCN(CC)C(=O)c1cccc(-c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001240052477 1056287356 /nfs/dbraw/zinc/28/73/56/1056287356.db2.gz SHOPWZDLZDWCNF-UHFFFAOYSA-N 1 2 319.408 4.021 20 0 DIADLO Cc1ccc(C2(CNc3nc(C)[nH+]c4c3CCCC4)CC2)c(C)c1 ZINC001612428809 1056287501 /nfs/dbraw/zinc/28/75/01/1056287501.db2.gz LCEDUPJDFOXNJY-UHFFFAOYSA-N 1 2 321.468 4.424 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2cccc(C(=O)N(CC)CC)c2)c1 ZINC001240057474 1056291527 /nfs/dbraw/zinc/29/15/27/1056291527.db2.gz XLUFICRSCUQMSZ-UHFFFAOYSA-N 1 2 324.424 4.197 20 0 DIADLO Cc1cc(C)c(CNc2ccnc(-c3cccc(Cl)c3)n2)c[nH+]1 ZINC001612487911 1056297535 /nfs/dbraw/zinc/29/75/35/1056297535.db2.gz MKWMDPFMZIIWII-UHFFFAOYSA-N 1 2 324.815 4.421 20 0 DIADLO CCc1nc(N2CCC[C@]2(C)Cc2cccc(F)c2)cc(C)[nH+]1 ZINC001612519093 1056300976 /nfs/dbraw/zinc/30/09/76/1056300976.db2.gz HGBIPVXLYLEVQJ-LJQANCHMSA-N 1 2 313.420 4.088 20 0 DIADLO CC(C)c1cc(N[C@@H](c2ccccc2)[C@@H](C)O)nc(C(C)C)[nH+]1 ZINC001612656532 1056317084 /nfs/dbraw/zinc/31/70/84/1056317084.db2.gz DHXLOLKMVDXGJR-RDTXWAMCSA-N 1 2 313.445 4.257 20 0 DIADLO C/C=C\C[C@H]1CCCN(c2nc3ccccc3n3c[nH+]cc23)C1 ZINC001612685301 1056318467 /nfs/dbraw/zinc/31/84/67/1056318467.db2.gz PYZBOEBVZNNXCA-GWQWAINWSA-N 1 2 306.413 4.065 20 0 DIADLO Cc1nc(N[C@@H]2c3ccccc3CC[C@H]2F)c2c([nH+]1)CCCC2 ZINC001612807343 1056329960 /nfs/dbraw/zinc/32/99/60/1056329960.db2.gz SOXYSEPBXMSMJJ-SJLPKXTDSA-N 1 2 311.404 4.101 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2c2nc3c(cccc3C)s2)[nH+]c1C ZINC001612903239 1056339769 /nfs/dbraw/zinc/33/97/69/1056339769.db2.gz JONCLCUQKIMTSL-CYBMUJFWSA-N 1 2 312.442 4.286 20 0 DIADLO CCc1nc(N2CCC[C@]2(C)Cc2cccs2)cc(C)[nH+]1 ZINC001613008689 1056344984 /nfs/dbraw/zinc/34/49/84/1056344984.db2.gz FAFXEBNUEURBPE-QGZVFWFLSA-N 1 2 301.459 4.011 20 0 DIADLO CCc1nc(N2CCC[C@@]2(C)Cc2cccs2)cc(C)[nH+]1 ZINC001613008688 1056345233 /nfs/dbraw/zinc/34/52/33/1056345233.db2.gz FAFXEBNUEURBPE-KRWDZBQOSA-N 1 2 301.459 4.011 20 0 DIADLO CC(C)c1cc(N[C@H]2CCOC23CCCC3)nc(C(C)C)[nH+]1 ZINC001613042410 1056346490 /nfs/dbraw/zinc/34/64/90/1056346490.db2.gz OCORUBBLEITNIJ-HNNXBMFYSA-N 1 2 303.450 4.237 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2NC[C@H]1CCC=CCCC1 ZINC001613052524 1056346929 /nfs/dbraw/zinc/34/69/29/1056346929.db2.gz SLRKDDSYEHQQLQ-AWEZNQCLSA-N 1 2 313.449 4.130 20 0 DIADLO Cc1cc(N[C@@H]2CCCc3cccnc32)[nH+]cc1C(F)(F)F ZINC001168649128 1056359342 /nfs/dbraw/zinc/35/93/42/1056359342.db2.gz CXIRGQHDQZTLBA-CYBMUJFWSA-N 1 2 307.319 4.293 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2cscn2)c2ccccc2)cc1 ZINC000057621452 1056365976 /nfs/dbraw/zinc/36/59/76/1056365976.db2.gz NVLHNZWNWFCVOP-SFHVURJKSA-N 1 2 310.422 4.031 20 0 DIADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+]1CCOc2ccccc2C1 ZINC000108721081 1056371494 /nfs/dbraw/zinc/37/14/94/1056371494.db2.gz XONYLAIXQVKBMW-LBPRGKRZSA-N 1 2 305.780 4.435 20 0 DIADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@H+]1CCOc2ccccc2C1 ZINC000108721081 1056371507 /nfs/dbraw/zinc/37/15/07/1056371507.db2.gz XONYLAIXQVKBMW-LBPRGKRZSA-N 1 2 305.780 4.435 20 0 DIADLO CSc1cnc(-c2ccc3[nH+]ccn3c2)c(C(F)(F)F)c1 ZINC001240216018 1056373763 /nfs/dbraw/zinc/37/37/63/1056373763.db2.gz ASOBWEKZRXPMNH-UHFFFAOYSA-N 1 2 309.316 4.137 20 0 DIADLO COC(=O)c1cc2ccc(-c3ccc4[nH+]ccn4c3)cc2s1 ZINC001240217407 1056374960 /nfs/dbraw/zinc/37/49/60/1056374960.db2.gz BMCJWTFDSVCEMZ-UHFFFAOYSA-N 1 2 308.362 4.003 20 0 DIADLO CN(C)c1ccc(-c2ccc3[nH+]ccn3c2)c(C(F)(F)F)c1 ZINC001240219608 1056376439 /nfs/dbraw/zinc/37/64/39/1056376439.db2.gz QBPSUWVCGINEMH-UHFFFAOYSA-N 1 2 305.303 4.086 20 0 DIADLO c1cn2cc(-c3ccc4c(c3)ncn4-c3ccccc3)ccc2[nH+]1 ZINC001240219537 1056376795 /nfs/dbraw/zinc/37/67/95/1056376795.db2.gz MKQMVRRXNYKZPO-UHFFFAOYSA-N 1 2 310.360 4.340 20 0 DIADLO COc1c(F)cc(-c2ccc3[nH+]ccn3c2)cc1C(F)(F)F ZINC001240221580 1056378125 /nfs/dbraw/zinc/37/81/25/1056378125.db2.gz NCYNIIVGEWWZCB-UHFFFAOYSA-N 1 2 310.250 4.168 20 0 DIADLO CCOC(=O)c1csc2cc(-c3ccc4[nH+]ccn4c3)ccc12 ZINC001240220670 1056378343 /nfs/dbraw/zinc/37/83/43/1056378343.db2.gz KUIMUAXOCFKOSE-UHFFFAOYSA-N 1 2 322.389 4.393 20 0 DIADLO CN(C)c1[nH+]cc(CSc2nccn2C2CC2)c2ccccc21 ZINC001613448359 1056380479 /nfs/dbraw/zinc/38/04/79/1056380479.db2.gz INJCFTIPAFKFGE-UHFFFAOYSA-N 1 2 324.453 4.125 20 0 DIADLO COc1cc(C)[nH+]c(CS[C@H]2CCOc3ccccc32)c1 ZINC001613618535 1056392661 /nfs/dbraw/zinc/39/26/61/1056392661.db2.gz VNBWSNIRKHCKPJ-KRWDZBQOSA-N 1 2 301.411 4.156 20 0 DIADLO Cc1ccc(-c2cccc(OCc3ccccc3F)c2)[nH+]c1N ZINC001240263266 1056395383 /nfs/dbraw/zinc/39/53/83/1056395383.db2.gz ICQQQAZWMFLSQG-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(C(F)(F)F)nc2)c1 ZINC001240269306 1056402986 /nfs/dbraw/zinc/40/29/86/1056402986.db2.gz FBCXCBPVGFXLKC-UHFFFAOYSA-N 1 2 303.287 4.168 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccnc(C(F)(F)F)c2)cc1F ZINC001240341858 1056435519 /nfs/dbraw/zinc/43/55/19/1056435519.db2.gz VIOQHYSKEYKICP-UHFFFAOYSA-N 1 2 316.273 4.107 20 0 DIADLO Cc1cc(NC(=O)C2[C@@H]3CCCCCC[C@@H]23)ccc1-n1cc[nH+]c1 ZINC001584952853 1056450083 /nfs/dbraw/zinc/45/00/83/1056450083.db2.gz LEHCEHWXJAEZJC-IAGOWNOFSA-N 1 2 323.440 4.336 20 0 DIADLO c1cnc2c(c1)CCC[C@@H]2Nc1cc2c3c(c1)CCC[NH+]3CCC2 ZINC001168660580 1056456722 /nfs/dbraw/zinc/45/67/22/1056456722.db2.gz GJLFNZCMORZKSX-IBGZPJMESA-N 1 2 319.452 4.270 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2cc(Cl)cc3ccccc32)c[nH+]1 ZINC001585011570 1056462279 /nfs/dbraw/zinc/46/22/79/1056462279.db2.gz JNCHTSRVVOFIEP-UHFFFAOYSA-N 1 2 324.811 4.435 20 0 DIADLO CCCc1ccc(Cn2c[nH+]c(Cc3ccccc3OC)c2)cc1 ZINC001615064705 1056468446 /nfs/dbraw/zinc/46/84/46/1056468446.db2.gz QFLJSSOAVXFRKN-UHFFFAOYSA-N 1 2 320.436 4.483 20 0 DIADLO COc1nscc1C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001615188326 1056472353 /nfs/dbraw/zinc/47/23/53/1056472353.db2.gz VZTHGCJCKVJEOG-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COc1nscc1C[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001615188326 1056472358 /nfs/dbraw/zinc/47/23/58/1056472358.db2.gz VZTHGCJCKVJEOG-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO C[C@H]([NH2+]Cc1cnn(C2CCC2)c1)c1c(F)cccc1Cl ZINC000921808615 1056510100 /nfs/dbraw/zinc/51/01/00/1056510100.db2.gz CEPNRBHXFWVOFL-NSHDSACASA-N 1 2 307.800 4.251 20 0 DIADLO C[C@H]([NH2+]Cc1ccnn1C1CCC1)c1c(F)cccc1Cl ZINC000921808704 1056510671 /nfs/dbraw/zinc/51/06/71/1056510671.db2.gz CSBWZAPXNLHNBY-NSHDSACASA-N 1 2 307.800 4.251 20 0 DIADLO C[C@@H]([NH2+]Cc1cnn(CC2CCC2)c1)c1c(F)cccc1Cl ZINC000921809468 1056510865 /nfs/dbraw/zinc/51/08/65/1056510865.db2.gz JNIUGTQQLDYDLZ-GFCCVEGCSA-N 1 2 321.827 4.327 20 0 DIADLO C[C@H]1Cc2ccccc2N(Cc2ccc(-n3cc[nH+]c3)cc2)C1 ZINC001615458120 1056512509 /nfs/dbraw/zinc/51/25/09/1056512509.db2.gz QOYUOAKNLZDNDH-INIZCTEOSA-N 1 2 303.409 4.071 20 0 DIADLO CC[N@@H+](Cc1cn2ccccc2n1)Cc1ccc(Cl)s1 ZINC000061783030 1056520026 /nfs/dbraw/zinc/52/00/26/1056520026.db2.gz NBIPPSRZWNUNAF-UHFFFAOYSA-N 1 2 305.834 4.071 20 0 DIADLO CC[N@H+](Cc1cn2ccccc2n1)Cc1ccc(Cl)s1 ZINC000061783030 1056520040 /nfs/dbraw/zinc/52/00/40/1056520040.db2.gz NBIPPSRZWNUNAF-UHFFFAOYSA-N 1 2 305.834 4.071 20 0 DIADLO CSc1ccc(C(F)(F)F)nc1-c1ccn2cc[nH+]c2c1 ZINC001240497170 1056538645 /nfs/dbraw/zinc/53/86/45/1056538645.db2.gz LEQLBPJNMJYCTB-UHFFFAOYSA-N 1 2 309.316 4.137 20 0 DIADLO c1cn2ccc(-c3ccnc(CSc4ccccc4)n3)cc2[nH+]1 ZINC001240503344 1056540104 /nfs/dbraw/zinc/54/01/04/1056540104.db2.gz LZJOWGVNIXYHET-UHFFFAOYSA-N 1 2 318.405 4.084 20 0 DIADLO CCC[C@](C)([NH2+]Cc1c(C)ccc2cc(C)ccc21)C(=O)OC ZINC001615577005 1056540823 /nfs/dbraw/zinc/54/08/23/1056540823.db2.gz CUARVMHQGKRUJU-FQEVSTJZSA-N 1 2 313.441 4.278 20 0 DIADLO CCC[C@@](C)([NH2+]Cc1c(C)ccc2cc(C)ccc21)C(=O)OC ZINC001615577007 1056541375 /nfs/dbraw/zinc/54/13/75/1056541375.db2.gz CUARVMHQGKRUJU-HXUWFJFHSA-N 1 2 313.441 4.278 20 0 DIADLO c1cn2ccc(-c3nc(-c4cccnc4)nc4ccccc43)cc2[nH+]1 ZINC001240503522 1056541314 /nfs/dbraw/zinc/54/13/14/1056541314.db2.gz CXZOFWMGASZVNJ-UHFFFAOYSA-N 1 2 323.359 4.007 20 0 DIADLO COc1ccc(-c2cncc(-c3ccn4cc[nH+]c4c3)c2)cc1 ZINC001240508870 1056543584 /nfs/dbraw/zinc/54/35/84/1056543584.db2.gz NLGZCOOBSWLMLP-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2cc(Cl)n(C)n2)o1 ZINC001615630626 1056548438 /nfs/dbraw/zinc/54/84/38/1056548438.db2.gz NVMBWMHGMBJLPB-AWEZNQCLSA-N 1 2 307.825 4.092 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2cc(Cl)n(C)n2)o1 ZINC001615630626 1056548449 /nfs/dbraw/zinc/54/84/49/1056548449.db2.gz NVMBWMHGMBJLPB-AWEZNQCLSA-N 1 2 307.825 4.092 20 0 DIADLO CCOC(=O)c1csc2cc(-c3ccn4cc[nH+]c4c3)ccc12 ZINC001240517822 1056549310 /nfs/dbraw/zinc/54/93/10/1056549310.db2.gz HQPMSBBBLGQZBT-UHFFFAOYSA-N 1 2 322.389 4.393 20 0 DIADLO Cc1ccccc1[C@H](CO)Nc1cc[nH+]c2c(Cl)cccc12 ZINC000672229626 1056575065 /nfs/dbraw/zinc/57/50/65/1056575065.db2.gz BCVPBAHNTUXRGP-KRWDZBQOSA-N 1 2 312.800 4.342 20 0 DIADLO Fc1ccc(-c2cccc(-c3cc[nH]n3)c2)cc1-n1cc[nH+]c1 ZINC001240565113 1056581467 /nfs/dbraw/zinc/58/14/67/1056581467.db2.gz WWXCAYGHIALTMP-UHFFFAOYSA-N 1 2 304.328 4.069 20 0 DIADLO Clc1cccc2c(N[C@H]3CCO[C@H](C4CC4)C3)cc[nH+]c12 ZINC000672251215 1056593157 /nfs/dbraw/zinc/59/31/57/1056593157.db2.gz LWZJRSCHFNTPEI-LRDDRELGSA-N 1 2 302.805 4.258 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+](Cc1cc(Cl)n(C)n1)C1CC1 ZINC001615906702 1056596294 /nfs/dbraw/zinc/59/62/94/1056596294.db2.gz DDTDDSBGONURFC-LLVKDONJSA-N 1 2 324.255 4.453 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](Cc1cc(Cl)n(C)n1)C1CC1 ZINC001615906702 1056596305 /nfs/dbraw/zinc/59/63/05/1056596305.db2.gz DDTDDSBGONURFC-LLVKDONJSA-N 1 2 324.255 4.453 20 0 DIADLO C[C@@H]1CSc2ccccc2N1Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001615995747 1056603175 /nfs/dbraw/zinc/60/31/75/1056603175.db2.gz XCEIXBLGFWSMEV-OAHLLOKOSA-N 1 2 321.449 4.373 20 0 DIADLO CCCN(Cc1cc(OC)cc(C)[nH+]1)c1ccc(Cl)cc1 ZINC001616026446 1056607363 /nfs/dbraw/zinc/60/73/63/1056607363.db2.gz OUCFLLVIYNIMLU-UHFFFAOYSA-N 1 2 304.821 4.469 20 0 DIADLO CC(C)N(Cc1cc[nH+]c(N(C)C)c1)c1ccc(Cl)cc1 ZINC001616051007 1056608581 /nfs/dbraw/zinc/60/85/81/1056608581.db2.gz JJWZIAPLSOXWLE-UHFFFAOYSA-N 1 2 303.837 4.216 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@]2(C)CC[C@H](C)C2(C)C)c(C)[nH+]1 ZINC001585774360 1056619886 /nfs/dbraw/zinc/61/98/86/1056619886.db2.gz FSWFBLJAENEOLT-DJJJIMSYSA-N 1 2 302.462 4.199 20 0 DIADLO COc1cc(-c2c[nH+]c(N3CCCCC3)cc2C)cc(F)c1F ZINC001240661738 1056629714 /nfs/dbraw/zinc/62/97/14/1056629714.db2.gz MRIBVXADIMYABF-UHFFFAOYSA-N 1 2 318.367 4.334 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)cc1-c1cccc(C(F)F)c1 ZINC001240692506 1056644410 /nfs/dbraw/zinc/64/44/10/1056644410.db2.gz BKCLDTPOQKMLCA-UHFFFAOYSA-N 1 2 321.342 4.263 20 0 DIADLO CCO[C@@H](C)n1cc(-c2cc([NH+](CC)CC)ccc2C)cn1 ZINC001240759306 1056684265 /nfs/dbraw/zinc/68/42/65/1056684265.db2.gz MHABSOCENCMTST-HNNXBMFYSA-N 1 2 301.434 4.260 20 0 DIADLO COCOc1cc(C)ccc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001240762656 1056685980 /nfs/dbraw/zinc/68/59/80/1056685980.db2.gz CKGXSWMDECFCRW-UHFFFAOYSA-N 1 2 308.381 4.045 20 0 DIADLO CC1(CCC(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)CC1 ZINC001586212580 1056693661 /nfs/dbraw/zinc/69/36/61/1056693661.db2.gz YWGOKENNBHHKOJ-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2coc(C3CC3)n2)C2CC2)c(F)c1 ZINC001616654216 1056695393 /nfs/dbraw/zinc/69/53/93/1056695393.db2.gz PVIMAEUZHGAPMB-INIZCTEOSA-N 1 2 304.340 4.071 20 0 DIADLO CC(C)N1CCCC[C@H]1C[NH2+][C@H](C)c1c(F)cccc1Cl ZINC001616662912 1056696816 /nfs/dbraw/zinc/69/68/16/1056696816.db2.gz VDLNNAINUNUPJG-KGLIPLIRSA-N 1 2 312.860 4.393 20 0 DIADLO FC(F)(F)c1cncc(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001240791569 1056702062 /nfs/dbraw/zinc/70/20/62/1056702062.db2.gz CBRRTVFDBHHUDP-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cncc(C(F)(F)F)c2)cc1 ZINC001240792663 1056702915 /nfs/dbraw/zinc/70/29/15/1056702915.db2.gz HNUUKTBALVPTHO-UHFFFAOYSA-N 1 2 303.287 4.168 20 0 DIADLO CCC[C@](C)(NC(=O)c1ccn2c(C)c[nH+]c2c1)c1ccccc1 ZINC001586348808 1056718672 /nfs/dbraw/zinc/71/86/72/1056718672.db2.gz VXWDHZFICVIWBF-FQEVSTJZSA-N 1 2 321.424 4.088 20 0 DIADLO CCOc1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)nc1 ZINC000672578845 1056726968 /nfs/dbraw/zinc/72/69/68/1056726968.db2.gz UYXNWUIZIKXPST-INIZCTEOSA-N 1 2 302.443 4.125 20 0 DIADLO CCOc1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)nc1 ZINC000672578845 1056726982 /nfs/dbraw/zinc/72/69/82/1056726982.db2.gz UYXNWUIZIKXPST-INIZCTEOSA-N 1 2 302.443 4.125 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCCC2(F)F)cc1OCC ZINC000672621750 1056740557 /nfs/dbraw/zinc/74/05/57/1056740557.db2.gz HYAHFVOPYISMAE-WBMJQRKESA-N 1 2 313.388 4.322 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc2cccnc21 ZINC001240894818 1056749121 /nfs/dbraw/zinc/74/91/21/1056749121.db2.gz DRUDBPMUPLMMKG-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO CSc1ccccc1CN(C)C(=O)c1c(C)cc(C)[nH+]c1C ZINC001586526417 1056753633 /nfs/dbraw/zinc/75/36/33/1056753633.db2.gz XXMYWPFTPRNESS-UHFFFAOYSA-N 1 2 314.454 4.001 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2sc3ccccc3c2C)no1 ZINC001617030842 1056764209 /nfs/dbraw/zinc/76/42/09/1056764209.db2.gz KTAQSKANQSFYCK-LLVKDONJSA-N 1 2 301.415 4.006 20 0 DIADLO CC(C)OC(=O)c1cccc(-c2cccc(-c3c[nH+]cn3C)c2)c1 ZINC001240948333 1056776089 /nfs/dbraw/zinc/77/60/89/1056776089.db2.gz XVPNJNYYLDABPC-UHFFFAOYSA-N 1 2 320.392 4.319 20 0 DIADLO CC(C)c1ccc2c(c1)[C@H](NC(=O)c1cc3c[nH+]ccc3[nH]1)CC2 ZINC001617186946 1056789846 /nfs/dbraw/zinc/78/98/46/1056789846.db2.gz PRPUGQYLWKJPAB-GOSISDBHSA-N 1 2 319.408 4.104 20 0 DIADLO CC[C@@H](CC(C)C)C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC001128329958 1056795569 /nfs/dbraw/zinc/79/55/69/1056795569.db2.gz UVPFTGVCQUHWJI-HOTGVXAUSA-N 1 2 322.518 4.026 20 0 DIADLO CCC1(CC)CCC[N@H+](Cc2nnc(C(F)(F)F)s2)CC1 ZINC001617230962 1056798331 /nfs/dbraw/zinc/79/83/31/1056798331.db2.gz BXMHJKBQPNXGTL-UHFFFAOYSA-N 1 2 321.412 4.349 20 0 DIADLO CCC1(CC)CCC[N@@H+](Cc2nnc(C(F)(F)F)s2)CC1 ZINC001617230962 1056798343 /nfs/dbraw/zinc/79/83/43/1056798343.db2.gz BXMHJKBQPNXGTL-UHFFFAOYSA-N 1 2 321.412 4.349 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@@H](C(C)C)C1 ZINC001617285375 1056808081 /nfs/dbraw/zinc/80/80/81/1056808081.db2.gz VHLSDJILTZTXGN-NVXWUHKLSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H](C(C)C)C1 ZINC001617285375 1056808088 /nfs/dbraw/zinc/80/80/88/1056808088.db2.gz VHLSDJILTZTXGN-NVXWUHKLSA-N 1 2 323.864 4.312 20 0 DIADLO Cc1ccc(-c2c[nH+]c(N3CCOCC3)c(C)c2)c2ccccc12 ZINC001241004553 1056808424 /nfs/dbraw/zinc/80/84/24/1056808424.db2.gz LGJKHCPXZGWLEZ-UHFFFAOYSA-N 1 2 318.420 4.355 20 0 DIADLO Cc1cc(C)cc(C[NH2+][C@H](c2nccn2C)c2cccc(F)c2)c1 ZINC000065890029 1056811017 /nfs/dbraw/zinc/81/10/17/1056811017.db2.gz DJYRSPPMJNNVHC-IBGZPJMESA-N 1 2 323.415 4.055 20 0 DIADLO CCC1(CC)CC[NH+]([C@H](C(=O)OC)c2cccc(Cl)c2)CC1 ZINC001617316585 1056811340 /nfs/dbraw/zinc/81/13/40/1056811340.db2.gz AQGHGJQHWJXRFX-INIZCTEOSA-N 1 2 323.864 4.456 20 0 DIADLO CC(C)CCC[C@H](C)N(CCC(C)C)C(=O)Cc1c[nH+]cn1C ZINC000672940413 1056818571 /nfs/dbraw/zinc/81/85/71/1056818571.db2.gz CNCAAFVBGUHSTC-KRWDZBQOSA-N 1 2 321.509 4.052 20 0 DIADLO CCc1nc(C)c(C[NH2+]Cc2ccc(Cl)c(C)c2Cl)o1 ZINC000922143221 1056843626 /nfs/dbraw/zinc/84/36/26/1056843626.db2.gz HSRHBHONOIEVMG-UHFFFAOYSA-N 1 2 313.228 4.450 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)on1 ZINC001617590606 1056852475 /nfs/dbraw/zinc/85/24/75/1056852475.db2.gz ORVHTVJUHWSCTJ-HNNXBMFYSA-N 1 2 306.793 4.064 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)on1 ZINC001617590606 1056852483 /nfs/dbraw/zinc/85/24/83/1056852483.db2.gz ORVHTVJUHWSCTJ-HNNXBMFYSA-N 1 2 306.793 4.064 20 0 DIADLO COc1ccc(-c2ccc3[nH+]ccn3c2C)cc1C(F)(F)F ZINC001241092059 1056883644 /nfs/dbraw/zinc/88/36/44/1056883644.db2.gz KKAVBKCSACUFOX-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO C[C@@H](C[N@@H+]1CCOC[C@H]1c1ccco1)c1cccc(Cl)c1 ZINC000682155326 1056891399 /nfs/dbraw/zinc/89/13/99/1056891399.db2.gz ULWDIJUDQITHFC-BBRMVZONSA-N 1 2 305.805 4.110 20 0 DIADLO C[C@@H](C[N@H+]1CCOC[C@H]1c1ccco1)c1cccc(Cl)c1 ZINC000682155326 1056891401 /nfs/dbraw/zinc/89/14/01/1056891401.db2.gz ULWDIJUDQITHFC-BBRMVZONSA-N 1 2 305.805 4.110 20 0 DIADLO Nc1[nH+]cccc1-c1ccc(OCc2ccccc2)c(F)c1F ZINC001241107052 1056897260 /nfs/dbraw/zinc/89/72/60/1056897260.db2.gz BZMCLSFBPHQDCN-UHFFFAOYSA-N 1 2 312.319 4.188 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1c(F)cc(O)cc1F ZINC001241122499 1056907604 /nfs/dbraw/zinc/90/76/04/1056907604.db2.gz QAZQEJRSXHBDNR-UHFFFAOYSA-N 1 2 304.340 4.031 20 0 DIADLO COc1cc(C)c(-c2cc(F)c(C[NH+](C)C)c(F)c2)cc1C ZINC001241138808 1056919444 /nfs/dbraw/zinc/91/94/44/1056919444.db2.gz SRZPPVCQBPEWMA-UHFFFAOYSA-N 1 2 305.368 4.319 20 0 DIADLO CC(C)(C)Oc1ncccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001241143498 1056924304 /nfs/dbraw/zinc/92/43/04/1056924304.db2.gz UEFJSTIFWAZRJY-UHFFFAOYSA-N 1 2 307.397 4.171 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+]1CCC[C@](C)(F)C1 ZINC001618122391 1056925265 /nfs/dbraw/zinc/92/52/65/1056925265.db2.gz KXXWFHJJHKPZSZ-FZMZJTMJSA-N 1 2 300.215 4.334 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+]1CCC[C@](C)(F)C1 ZINC001618122391 1056925273 /nfs/dbraw/zinc/92/52/73/1056925273.db2.gz KXXWFHJJHKPZSZ-FZMZJTMJSA-N 1 2 300.215 4.334 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+]1CCC[C@@](C)(F)C1 ZINC001618122393 1056925355 /nfs/dbraw/zinc/92/53/55/1056925355.db2.gz KXXWFHJJHKPZSZ-SMDDNHRTSA-N 1 2 300.215 4.334 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+]1CCC[C@@](C)(F)C1 ZINC001618122393 1056925363 /nfs/dbraw/zinc/92/53/63/1056925363.db2.gz KXXWFHJJHKPZSZ-SMDDNHRTSA-N 1 2 300.215 4.334 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+]1CCC[C@@](C)(F)C1 ZINC001618122390 1056925540 /nfs/dbraw/zinc/92/55/40/1056925540.db2.gz KXXWFHJJHKPZSZ-BXUZGUMPSA-N 1 2 300.215 4.334 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+]1CCC[C@@](C)(F)C1 ZINC001618122390 1056925551 /nfs/dbraw/zinc/92/55/51/1056925551.db2.gz KXXWFHJJHKPZSZ-BXUZGUMPSA-N 1 2 300.215 4.334 20 0 DIADLO Cc1cc(NC2(CCOCc3ccccc3)CC2)nc(C2CC2)[nH+]1 ZINC000357562130 1056941176 /nfs/dbraw/zinc/94/11/76/1056941176.db2.gz YEEREUHHKJSJPZ-UHFFFAOYSA-N 1 2 323.440 4.214 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)CC(=O)c1ccccc1F ZINC001618273046 1056943103 /nfs/dbraw/zinc/94/31/03/1056943103.db2.gz FEASHTUHVZZJDF-QGZVFWFLSA-N 1 2 315.388 4.100 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)CC(=O)c1ccccc1F ZINC001618273046 1056943105 /nfs/dbraw/zinc/94/31/05/1056943105.db2.gz FEASHTUHVZZJDF-QGZVFWFLSA-N 1 2 315.388 4.100 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1ccc(C(C)(C)C)cc1)n1cc[nH+]c1 ZINC001618299277 1056946575 /nfs/dbraw/zinc/94/65/75/1056946575.db2.gz NRJKYGUAJGYPGB-KRWDZBQOSA-N 1 2 313.445 4.407 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@H]2c2c(F)cccc2F)c(C)[nH+]1 ZINC000115984629 1056959461 /nfs/dbraw/zinc/95/94/61/1056959461.db2.gz DSRKKVCFVMKBFU-OLZOCXBDSA-N 1 2 316.351 4.027 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@@H](C)c2cccc(F)c2)c(C)[nH+]1 ZINC000115984605 1056959798 /nfs/dbraw/zinc/95/97/98/1056959798.db2.gz ARFPLFLSWFMWLX-LLVKDONJSA-N 1 2 300.377 4.278 20 0 DIADLO Cc1c(-c2cccc(O[C@@H]3CCCCO3)c2)ccc2[nH+]ccn21 ZINC001241217042 1056965050 /nfs/dbraw/zinc/96/50/50/1056965050.db2.gz JMQRVORBANECJG-LJQANCHMSA-N 1 2 308.381 4.215 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2occc2Br)cc1C ZINC001143136459 1056966098 /nfs/dbraw/zinc/96/60/98/1056966098.db2.gz XOMONLFZWCSLGO-UHFFFAOYSA-N 1 2 308.219 4.291 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2occc2Br)cc1C ZINC001143136459 1056966103 /nfs/dbraw/zinc/96/61/03/1056966103.db2.gz XOMONLFZWCSLGO-UHFFFAOYSA-N 1 2 308.219 4.291 20 0 DIADLO CC[N@H+](Cc1occc1Br)Cc1ccc(C)cc1 ZINC001143136394 1056966389 /nfs/dbraw/zinc/96/63/89/1056966389.db2.gz WOYWBVFUSQKKOU-UHFFFAOYSA-N 1 2 308.219 4.373 20 0 DIADLO CC[N@@H+](Cc1occc1Br)Cc1ccc(C)cc1 ZINC001143136394 1056966395 /nfs/dbraw/zinc/96/63/95/1056966395.db2.gz WOYWBVFUSQKKOU-UHFFFAOYSA-N 1 2 308.219 4.373 20 0 DIADLO Cc1sc2nc(C)nc(-c3c[nH+]c(N(C)C)cc3C)c2c1C ZINC001241232935 1056971767 /nfs/dbraw/zinc/97/17/67/1056971767.db2.gz ALMHSLLWPNNSDD-UHFFFAOYSA-N 1 2 312.442 4.053 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc2c(n1)[nH]cc2C(F)(F)F ZINC001241233744 1056972501 /nfs/dbraw/zinc/97/25/01/1056972501.db2.gz TUMCOBYOPDMUBB-UHFFFAOYSA-N 1 2 320.318 4.018 20 0 DIADLO CCOc1ccc(OC)cc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001241239824 1056975562 /nfs/dbraw/zinc/97/55/62/1056975562.db2.gz HCRYSCJCADCGRH-UHFFFAOYSA-N 1 2 308.381 4.161 20 0 DIADLO COc1cccc(C(F)(F)F)c1-c1c[nH+]c(N(C)C)cc1C ZINC001241248114 1056978943 /nfs/dbraw/zinc/97/89/43/1056978943.db2.gz CDRDLSPYAWDJBA-UHFFFAOYSA-N 1 2 310.319 4.150 20 0 DIADLO Cc1cc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)ccc1F ZINC001241282853 1056995241 /nfs/dbraw/zinc/99/52/41/1056995241.db2.gz SDHLJRHJZODNRY-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO Cc1cc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)ccc1F ZINC001241282853 1056995245 /nfs/dbraw/zinc/99/52/45/1056995245.db2.gz SDHLJRHJZODNRY-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO CNc1cc(-c2ccc(C(=O)OCc3ccccc3)cc2)cc[nH+]1 ZINC001241296074 1057002069 /nfs/dbraw/zinc/00/20/69/1057002069.db2.gz HHIKCNJKQYNTID-UHFFFAOYSA-N 1 2 318.376 4.147 20 0 DIADLO CC(C)c1cccc(N(C)C(=O)c2cccc(-n3cc[nH+]c3)c2)c1 ZINC000117630316 1057003995 /nfs/dbraw/zinc/00/39/95/1057003995.db2.gz YSQAAJSTYBGVTC-UHFFFAOYSA-N 1 2 319.408 4.272 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1cccc(C(C)(C)C)c1 ZINC001241301606 1057004302 /nfs/dbraw/zinc/00/43/02/1057004302.db2.gz CVRYJFQJDCAEEU-UHFFFAOYSA-N 1 2 310.441 4.191 20 0 DIADLO CC(C)(C)Oc1cccc(C[NH2+]Cc2nc(C(C)(C)C)co2)c1 ZINC000922325326 1057008315 /nfs/dbraw/zinc/00/83/15/1057008315.db2.gz BKNADBOWACRVDV-UHFFFAOYSA-N 1 2 316.445 4.439 20 0 DIADLO Cc1noc2ncc(CNc3[nH+]c4ccccc4n3C(C)C)cc12 ZINC000922330108 1057008905 /nfs/dbraw/zinc/00/89/05/1057008905.db2.gz YDUYWXVPTGQCJM-UHFFFAOYSA-N 1 2 321.384 4.074 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1nc(C(C)(C)C)co1 ZINC000922336852 1057011060 /nfs/dbraw/zinc/01/10/60/1057011060.db2.gz DVIPMSLYWJMXAP-UHFFFAOYSA-N 1 2 305.447 4.232 20 0 DIADLO Cc1ccc(-c2cc(F)cc(C)c2C[NH+]2CCOCC2)c(F)c1 ZINC001241355603 1057025806 /nfs/dbraw/zinc/02/58/06/1057025806.db2.gz BRZWSXSBMUALML-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO Cc1cc(C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)cc2cccnc12 ZINC000922520392 1057030610 /nfs/dbraw/zinc/03/06/10/1057030610.db2.gz MCFFETWLYPDURS-FXAWDEMLSA-N 1 2 322.383 4.105 20 0 DIADLO Cc1ccc2cc(C[NH2+][C@@H]3c4ccccc4OC[C@@H]3F)[nH]c2c1 ZINC000922521983 1057030675 /nfs/dbraw/zinc/03/06/75/1057030675.db2.gz OXELBRZJQPIPQO-QFBILLFUSA-N 1 2 310.372 4.038 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+][C@H](c3ncccn3)C3CC3)o2)cc1 ZINC000922579882 1057034915 /nfs/dbraw/zinc/03/49/15/1057034915.db2.gz LTHOZXQCFZJFGO-IBGZPJMESA-N 1 2 319.408 4.286 20 0 DIADLO Clc1ccc(C[NH2+][C@H](c2ncccn2)C2CC2)cc1Cl ZINC000922582468 1057034960 /nfs/dbraw/zinc/03/49/60/1057034960.db2.gz NLJZIDWMUBHSCX-AWEZNQCLSA-N 1 2 308.212 4.024 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](c3ccccn3)C3CC3)co2)cc1 ZINC000922586885 1057037722 /nfs/dbraw/zinc/03/77/22/1057037722.db2.gz SRTRWPNIDUMWNG-LJQANCHMSA-N 1 2 319.408 4.286 20 0 DIADLO CCc1cnc(C[NH2+][C@H](CC)c2cc(F)ccc2OC)s1 ZINC000922620549 1057040696 /nfs/dbraw/zinc/04/06/96/1057040696.db2.gz BZNCKJOSGYYIQK-CQSZACIVSA-N 1 2 308.422 4.094 20 0 DIADLO Cc1ncoc1C[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1F ZINC000922669437 1057046757 /nfs/dbraw/zinc/04/67/57/1057046757.db2.gz BVMBWZFBDOWJJH-SSDOTTSWSA-N 1 2 303.164 4.280 20 0 DIADLO Cc1[nH]c(CN[C@@H](C)c2cc(Cl)cc(Cl)c2F)[nH+]c1C ZINC000922669903 1057046913 /nfs/dbraw/zinc/04/69/13/1057046913.db2.gz FDBXLVDHANAVSH-VIFPVBQESA-N 1 2 316.207 4.323 20 0 DIADLO Cc1scc(C[NH2+][C@H](c2nc(C3CC3)no2)C(C)C)c1C ZINC000631071542 1057065234 /nfs/dbraw/zinc/06/52/34/1057065234.db2.gz PNEFSADPZKIZHY-AWEZNQCLSA-N 1 2 305.447 4.112 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+][C@@H]2CCCc3cccnc32)s1 ZINC000922878408 1057072578 /nfs/dbraw/zinc/07/25/78/1057072578.db2.gz LNSQHAHAMZPAKF-CYBMUJFWSA-N 1 2 301.459 4.003 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@H]2CCCc3cccnc32)cs1 ZINC000922880147 1057073451 /nfs/dbraw/zinc/07/34/51/1057073451.db2.gz PXBXOPCTXSZPCL-AWEZNQCLSA-N 1 2 301.459 4.003 20 0 DIADLO COc1c(F)ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c1Cl ZINC001241510001 1057078248 /nfs/dbraw/zinc/07/82/48/1057078248.db2.gz GKEMZTVOKRIDIZ-UHFFFAOYSA-N 1 2 316.763 4.400 20 0 DIADLO C[C@H](C1CC1)[N@H+](Cc1noc(C2CCC2)n1)Cc1ccccc1 ZINC000625081810 1057085945 /nfs/dbraw/zinc/08/59/45/1057085945.db2.gz STSCJTWOHKIXJC-CQSZACIVSA-N 1 2 311.429 4.138 20 0 DIADLO C[C@H](C1CC1)[N@@H+](Cc1noc(C2CCC2)n1)Cc1ccccc1 ZINC000625081810 1057085950 /nfs/dbraw/zinc/08/59/50/1057085950.db2.gz STSCJTWOHKIXJC-CQSZACIVSA-N 1 2 311.429 4.138 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1nc2cc(C)ccc2s1 ZINC000625131374 1057091783 /nfs/dbraw/zinc/09/17/83/1057091783.db2.gz PFCFRCPUVKDTKZ-UHFFFAOYSA-N 1 2 302.365 4.379 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1nc2cc(C)ccc2s1 ZINC000625131374 1057091785 /nfs/dbraw/zinc/09/17/85/1057091785.db2.gz PFCFRCPUVKDTKZ-UHFFFAOYSA-N 1 2 302.365 4.379 20 0 DIADLO Cc1cc(/C=C/c2ccc(Cl)cc2)c[nH+]c1N1CCOCC1 ZINC001241587130 1057100672 /nfs/dbraw/zinc/10/06/72/1057100672.db2.gz CYQODBKUGGVZJA-NSCUHMNNSA-N 1 2 314.816 4.050 20 0 DIADLO Oc1ccc(Cl)c(C[NH2+]C2(c3nccs3)CCCC2)c1 ZINC000625257523 1057109115 /nfs/dbraw/zinc/10/91/15/1057109115.db2.gz QZKKEAIOWMLYCG-UHFFFAOYSA-N 1 2 308.834 4.061 20 0 DIADLO Cc1nc(N(C)Cc2ccc(C(F)(F)F)cc2)c(C)c(C)[nH+]1 ZINC000673709823 1057118976 /nfs/dbraw/zinc/11/89/76/1057118976.db2.gz MTADREDLMHFASP-UHFFFAOYSA-N 1 2 309.335 4.057 20 0 DIADLO CC[N@H+](Cc1coc(-c2ccccc2F)n1)Cc1occc1C ZINC000625473674 1057144949 /nfs/dbraw/zinc/14/49/49/1057144949.db2.gz YERYGEWVXHBSLH-UHFFFAOYSA-N 1 2 314.360 4.404 20 0 DIADLO CC[N@@H+](Cc1coc(-c2ccccc2F)n1)Cc1occc1C ZINC000625473674 1057144950 /nfs/dbraw/zinc/14/49/50/1057144950.db2.gz YERYGEWVXHBSLH-UHFFFAOYSA-N 1 2 314.360 4.404 20 0 DIADLO c1cn(-c2ccc(-c3ccc(C4=CCCCC4)nn3)cc2)c[nH+]1 ZINC001241716000 1057146137 /nfs/dbraw/zinc/14/61/37/1057146137.db2.gz SBWYFFGHGVGZFW-UHFFFAOYSA-N 1 2 302.381 4.287 20 0 DIADLO C[C@H]([NH2+]Cc1[nH]nc2ccccc21)c1c(F)cccc1Cl ZINC000673930623 1057152287 /nfs/dbraw/zinc/15/22/87/1057152287.db2.gz ZICOSQXJQBTNQL-JTQLQIEISA-N 1 2 303.768 4.206 20 0 DIADLO COc1cc(F)c(C(C)C)cc1-c1c[nH+]c2c(c1)CCCN2 ZINC001241791334 1057165479 /nfs/dbraw/zinc/16/54/79/1057165479.db2.gz XIZXGJQYHQZVIZ-UHFFFAOYSA-N 1 2 300.377 4.021 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(-c2ccccc2)nc1 ZINC001241792579 1057166249 /nfs/dbraw/zinc/16/62/49/1057166249.db2.gz CRMWITJGHSJUKU-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO Fc1cccc([C@H]2CC[N@@H+]2Cc2cc(-c3ccccc3)no2)c1 ZINC000674009779 1057176803 /nfs/dbraw/zinc/17/68/03/1057176803.db2.gz LOEPUFUAUHRAEV-LJQANCHMSA-N 1 2 308.356 4.428 20 0 DIADLO Fc1cccc([C@H]2CC[N@H+]2Cc2cc(-c3ccccc3)no2)c1 ZINC000674009779 1057176806 /nfs/dbraw/zinc/17/68/06/1057176806.db2.gz LOEPUFUAUHRAEV-LJQANCHMSA-N 1 2 308.356 4.428 20 0 DIADLO COC(=[NH2+])c1cccc(-c2cccnc2OCc2ccccc2)c1 ZINC001241831123 1057180353 /nfs/dbraw/zinc/18/03/53/1057180353.db2.gz JXINDGMKJXZDEF-UHFFFAOYSA-N 1 2 318.376 4.299 20 0 DIADLO COc1cccc(-c2ccc(-n3cc[nH+]c3)cc2OC)c1Cl ZINC001241860358 1057193987 /nfs/dbraw/zinc/19/39/87/1057193987.db2.gz RBNIJKXDZGCVIK-UHFFFAOYSA-N 1 2 314.772 4.210 20 0 DIADLO Fc1cc(C[NH2+]C2(C(F)F)CCCC2)ccc1OC(F)F ZINC000674135193 1057211831 /nfs/dbraw/zinc/21/18/31/1057211831.db2.gz FGOWWXWDCUYRCZ-UHFFFAOYSA-N 1 2 309.278 4.095 20 0 DIADLO c1ccc(-c2ccc(-c3cc[nH+]c(N4CCCC4)c3)cc2)nc1 ZINC001241973048 1057227187 /nfs/dbraw/zinc/22/71/87/1057227187.db2.gz VLQPXNHOOPDDJN-UHFFFAOYSA-N 1 2 301.393 4.411 20 0 DIADLO CCOC(=O)c1cc2cc(-c3cc(C)[nH+]c(C)c3)ccc2cn1 ZINC001241992657 1057232728 /nfs/dbraw/zinc/23/27/28/1057232728.db2.gz PQIXJUKUQUFHNC-UHFFFAOYSA-N 1 2 306.365 4.090 20 0 DIADLO COC(=O)c1cc(C)nc2ccc(-c3cc(C)[nH+]c(C)c3)cc21 ZINC001241996652 1057234823 /nfs/dbraw/zinc/23/48/23/1057234823.db2.gz XYHBIJSZSFWKIA-UHFFFAOYSA-N 1 2 306.365 4.009 20 0 DIADLO Cc1ccc(-c2ccc(C)c(F)c2F)c(C[NH+]2CCOCC2)c1 ZINC001242032269 1057244272 /nfs/dbraw/zinc/24/42/72/1057244272.db2.gz WBIUQDVUPUQNAA-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO Oc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1C(F)(F)F ZINC001242163097 1057286100 /nfs/dbraw/zinc/28/61/00/1057286100.db2.gz XHZYVWJLOABJDM-UHFFFAOYSA-N 1 2 318.298 4.323 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccc(F)cc1F ZINC000675088809 1057314569 /nfs/dbraw/zinc/31/45/69/1057314569.db2.gz AIUHXKZBSDFUCB-RFAUZJTJSA-N 1 2 309.743 4.403 20 0 DIADLO COc1ccc(C[NH2+][C@@H]2COc3c2cccc3Cl)c(Cl)c1 ZINC000675103453 1057315870 /nfs/dbraw/zinc/31/58/70/1057315870.db2.gz SVOHWOJKRZLSRW-OAHLLOKOSA-N 1 2 324.207 4.225 20 0 DIADLO Fc1cccc(C(F)(F)F)c1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001242302231 1057327519 /nfs/dbraw/zinc/32/75/19/1057327519.db2.gz MKTKLKXSGMNOQC-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO COc1ccc(OC(F)(F)F)cc1-c1cccc2[nH+]c(C)cn21 ZINC001242318994 1057333527 /nfs/dbraw/zinc/33/35/27/1057333527.db2.gz UBLKHMQAPWUFGW-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1Cl ZINC000675250038 1057333540 /nfs/dbraw/zinc/33/35/40/1057333540.db2.gz FBUNUGJCRVMZCE-INIZCTEOSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1ccc(Cl)cc1Cl ZINC000675250038 1057333545 /nfs/dbraw/zinc/33/35/45/1057333545.db2.gz FBUNUGJCRVMZCE-INIZCTEOSA-N 1 2 324.255 4.372 20 0 DIADLO COc1ccc(OC(F)(F)F)cc1-c1ccc2[nH+]ccn2c1C ZINC001242322081 1057334667 /nfs/dbraw/zinc/33/46/67/1057334667.db2.gz KAUNEYSZKPSBIQ-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO Oc1c(Cl)cccc1-c1ccc(C[NH+]2CCCCC2)cn1 ZINC001242367118 1057349109 /nfs/dbraw/zinc/34/91/09/1057349109.db2.gz HCTKUDFRQLIRSD-UHFFFAOYSA-N 1 2 302.805 4.094 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(OC(F)F)nc1 ZINC001242419780 1057361729 /nfs/dbraw/zinc/36/17/29/1057361729.db2.gz QAPJPOLCTGMCIZ-UHFFFAOYSA-N 1 2 319.355 4.044 20 0 DIADLO Cc1cc(-c2ccc3c(cnn3[C@H]3CCCCO3)c2)cc(C)[nH+]1 ZINC001242447868 1057371665 /nfs/dbraw/zinc/37/16/65/1057371665.db2.gz TWDHVRPJUYXIOR-LJQANCHMSA-N 1 2 307.397 4.414 20 0 DIADLO CCc1ccc(C[NH2+][C@H](CN2CCCCC2)c2ccccc2)o1 ZINC000675473033 1057379094 /nfs/dbraw/zinc/37/90/94/1057379094.db2.gz MTWMBSCQXWSFPO-HXUWFJFHSA-N 1 2 312.457 4.159 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(Oc2ccccc2)cn1)c1nccn1C ZINC000658340194 1057380068 /nfs/dbraw/zinc/38/00/68/1057380068.db2.gz ZDONLKGQFDCMMO-HUUCEWRRSA-N 1 2 322.412 4.019 20 0 DIADLO CSc1ccc(Br)c(NC(=[NH2+])C(C)(C)C)n1 ZINC001162665585 1057388979 /nfs/dbraw/zinc/38/89/79/1057388979.db2.gz JFJQAJIIBMQFML-UHFFFAOYSA-N 1 2 302.241 4.001 20 0 DIADLO CC(C)[C@H]1c2ccccc2CC[N@H+]1Cc1nc(C(C)(C)C)no1 ZINC000675642742 1057391825 /nfs/dbraw/zinc/39/18/25/1057391825.db2.gz MIVPJVBKLQZHRQ-KRWDZBQOSA-N 1 2 313.445 4.123 20 0 DIADLO CC(C)[C@H]1c2ccccc2CC[N@@H+]1Cc1nc(C(C)(C)C)no1 ZINC000675642742 1057391832 /nfs/dbraw/zinc/39/18/32/1057391832.db2.gz MIVPJVBKLQZHRQ-KRWDZBQOSA-N 1 2 313.445 4.123 20 0 DIADLO COCOc1ccc(-c2ccc(-c3c[nH+]cn3C)cc2)c(C)c1 ZINC001242537452 1057397464 /nfs/dbraw/zinc/39/74/64/1057397464.db2.gz ABKPFZZDAIWWKD-UHFFFAOYSA-N 1 2 308.381 4.045 20 0 DIADLO CCC[C@@H](C)C[N@@H+]1CCOC[C@H]1c1nc2ccccc2s1 ZINC000503064744 1057399658 /nfs/dbraw/zinc/39/96/58/1057399658.db2.gz UVITYEYDBVILHO-HIFRSBDPSA-N 1 2 304.459 4.106 20 0 DIADLO CCC[C@@H](C)C[N@H+]1CCOC[C@H]1c1nc2ccccc2s1 ZINC000503064744 1057399665 /nfs/dbraw/zinc/39/96/65/1057399665.db2.gz UVITYEYDBVILHO-HIFRSBDPSA-N 1 2 304.459 4.106 20 0 DIADLO CC1CCC(=CC(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)CC1 ZINC001129120950 1057430849 /nfs/dbraw/zinc/43/08/49/1057430849.db2.gz XBQMNTBKIPNMSO-UHFFFAOYSA-N 1 2 323.440 4.376 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cnc3sccc3c2)cc1F ZINC001242682374 1057446412 /nfs/dbraw/zinc/44/64/12/1057446412.db2.gz MVZNODODSOWWGZ-UHFFFAOYSA-N 1 2 304.365 4.303 20 0 DIADLO O=C(CCCn1cc[nH+]c1)N1CCC[C@H]1CCC1CCCCC1 ZINC000676064754 1057447026 /nfs/dbraw/zinc/44/70/26/1057447026.db2.gz ZVTMIDZZCLIZCX-SFHVURJKSA-N 1 2 317.477 4.015 20 0 DIADLO CCOc1cc(C)ccc1C[NH2+][C@@H](C)c1nc(C)sc1C ZINC000676493252 1057477414 /nfs/dbraw/zinc/47/74/14/1057477414.db2.gz UMBQBAFWVQDKAB-LBPRGKRZSA-N 1 2 304.459 4.318 20 0 DIADLO CCOc1cc(C)ccc1C[NH2+][C@H](C)c1nc(C)sc1C ZINC000676493251 1057477635 /nfs/dbraw/zinc/47/76/35/1057477635.db2.gz UMBQBAFWVQDKAB-GFCCVEGCSA-N 1 2 304.459 4.318 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+][C@H](C)c1nc(C)sc1C ZINC000676489178 1057478270 /nfs/dbraw/zinc/47/82/70/1057478270.db2.gz IKCNPBIXMKJLAC-SECBINFHSA-N 1 2 310.850 4.273 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2nc(Cl)ccc2Cl)C1 ZINC000708707731 1057501431 /nfs/dbraw/zinc/50/14/31/1057501431.db2.gz TUYZRFRPPCCOST-LLVKDONJSA-N 1 2 313.150 4.163 20 0 DIADLO Cc1cccc(C(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)c1C ZINC001129231020 1057484248 /nfs/dbraw/zinc/48/42/48/1057484248.db2.gz MNRCNVMYMIVPFX-UHFFFAOYSA-N 1 2 319.408 4.170 20 0 DIADLO COc1c(F)cc(F)cc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001242811144 1057487303 /nfs/dbraw/zinc/48/73/03/1057487303.db2.gz QPQBOHXRFBKYGD-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO C[N@H+](CCOC(C)(C)C)Cc1ncc(-c2ccccc2)s1 ZINC000676632630 1057490067 /nfs/dbraw/zinc/49/00/67/1057490067.db2.gz JZFCWXXORCBOPZ-UHFFFAOYSA-N 1 2 304.459 4.057 20 0 DIADLO C[N@@H+](CCOC(C)(C)C)Cc1ncc(-c2ccccc2)s1 ZINC000676632630 1057490069 /nfs/dbraw/zinc/49/00/69/1057490069.db2.gz JZFCWXXORCBOPZ-UHFFFAOYSA-N 1 2 304.459 4.057 20 0 DIADLO Cc1ccc(-c2ccc(OC(F)F)c(OC3CCC3)c2)[nH+]c1N ZINC001242818862 1057490528 /nfs/dbraw/zinc/49/05/28/1057490528.db2.gz KBWOWVPNFKDNAN-UHFFFAOYSA-N 1 2 320.339 4.172 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2nc(Cl)ccc2Cl)C1 ZINC000708707731 1057501428 /nfs/dbraw/zinc/50/14/28/1057501428.db2.gz TUYZRFRPPCCOST-LLVKDONJSA-N 1 2 313.150 4.163 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc(Cl)cc(Cl)c1F)c1cn(C)cn1 ZINC000710070026 1057502561 /nfs/dbraw/zinc/50/25/61/1057502561.db2.gz FBQLLVXCWPFPAA-RKDXNWHRSA-N 1 2 316.207 4.278 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2ccc(OCC)cc2)n1 ZINC000073637377 1057509378 /nfs/dbraw/zinc/50/93/78/1057509378.db2.gz DGWLPDBAPBPUFB-KGLIPLIRSA-N 1 2 317.433 4.223 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3c(C)ccc4ccccc43)nn2)c1C ZINC001242982052 1057534883 /nfs/dbraw/zinc/53/48/83/1057534883.db2.gz WYWGBXKXVOOHOG-UHFFFAOYSA-N 1 2 314.392 4.408 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(C)cc1Cl ZINC000429375733 1057538237 /nfs/dbraw/zinc/53/82/37/1057538237.db2.gz CAGUVHHAUPBURF-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@@H](C)C(=O)Nc1ccc(C)cc1Cl ZINC000429375733 1057538241 /nfs/dbraw/zinc/53/82/41/1057538241.db2.gz CAGUVHHAUPBURF-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1nc(-c2ccsc2)oc1C ZINC000429387768 1057540208 /nfs/dbraw/zinc/54/02/08/1057540208.db2.gz MINPRPUIXGODJV-UHFFFAOYSA-N 1 2 302.399 4.245 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1nc(-c2ccsc2)oc1C ZINC000429387768 1057540217 /nfs/dbraw/zinc/54/02/17/1057540217.db2.gz MINPRPUIXGODJV-UHFFFAOYSA-N 1 2 302.399 4.245 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1cc(F)ccc1OC(F)F ZINC000625981612 1057544998 /nfs/dbraw/zinc/54/49/98/1057544998.db2.gz YZQYHCQXFSRSHP-VIFPVBQESA-N 1 2 309.278 4.047 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1cc(F)ccc1OC(F)F ZINC000625981612 1057545002 /nfs/dbraw/zinc/54/50/02/1057545002.db2.gz YZQYHCQXFSRSHP-VIFPVBQESA-N 1 2 309.278 4.047 20 0 DIADLO Nc1[nH+]cccc1-c1cc(C(F)(F)F)ccc1C(F)(F)F ZINC001243033479 1057552046 /nfs/dbraw/zinc/55/20/46/1057552046.db2.gz VTHPQAJFSNYSIH-UHFFFAOYSA-N 1 2 306.209 4.368 20 0 DIADLO CCc1ccc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@H]2C)cn1 ZINC000347923553 1057553237 /nfs/dbraw/zinc/55/32/37/1057553237.db2.gz VBOBSTQQUJHGDW-GFCCVEGCSA-N 1 2 302.368 4.042 20 0 DIADLO CCc1ccc(C[N@H+]2CCc3c(F)cc(F)cc3[C@H]2C)cn1 ZINC000347923553 1057553240 /nfs/dbraw/zinc/55/32/40/1057553240.db2.gz VBOBSTQQUJHGDW-GFCCVEGCSA-N 1 2 302.368 4.042 20 0 DIADLO CCc1ccc(C2CC[NH+]([C@H](C)c3csnn3)CC2)cc1 ZINC000626086462 1057555992 /nfs/dbraw/zinc/55/59/92/1057555992.db2.gz BUWDOIYIVXBIEN-CYBMUJFWSA-N 1 2 301.459 4.041 20 0 DIADLO CCCC[N@H+](Cc1noc2c1COCC2)[C@H](C)c1ccc(C)o1 ZINC000929402488 1057556050 /nfs/dbraw/zinc/55/60/50/1057556050.db2.gz JERRTDVRZPMTST-CQSZACIVSA-N 1 2 318.417 4.012 20 0 DIADLO CCCC[N@@H+](Cc1noc2c1COCC2)[C@H](C)c1ccc(C)o1 ZINC000929402488 1057556055 /nfs/dbraw/zinc/55/60/55/1057556055.db2.gz JERRTDVRZPMTST-CQSZACIVSA-N 1 2 318.417 4.012 20 0 DIADLO Cc1c[nH]c2cc(-c3cc(F)ccc3C[NH+]3CCOCC3)ccc12 ZINC001243088117 1057567720 /nfs/dbraw/zinc/56/77/20/1057567720.db2.gz UFHTWZNRQUQUJS-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Cc1nc(N[C@H](C)c2ccsc2)c(Br)c(C)[nH+]1 ZINC000322850435 1057567863 /nfs/dbraw/zinc/56/78/63/1057567863.db2.gz VSRXWMLVOFXSKU-SSDOTTSWSA-N 1 2 312.236 4.091 20 0 DIADLO Cc1ccccc1-c1noc(C[N@@H+](C)[C@@H](C)c2cccs2)n1 ZINC000016434904 1057569603 /nfs/dbraw/zinc/56/96/03/1057569603.db2.gz IXKHPKMAMLVSII-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccccc1-c1noc(C[N@H+](C)[C@@H](C)c2cccs2)n1 ZINC000016434904 1057569610 /nfs/dbraw/zinc/56/96/10/1057569610.db2.gz IXKHPKMAMLVSII-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1scnc1C1CC1)c1ccco1 ZINC000486956353 1057570604 /nfs/dbraw/zinc/57/06/04/1057570604.db2.gz NJBHTVNPYCWPKQ-AWEZNQCLSA-N 1 2 320.458 4.117 20 0 DIADLO CC(C)COC[C@@H]([NH2+]Cc1scnc1C1CC1)c1ccco1 ZINC000486956359 1057571217 /nfs/dbraw/zinc/57/12/17/1057571217.db2.gz NJBHTVNPYCWPKQ-CQSZACIVSA-N 1 2 320.458 4.117 20 0 DIADLO CC(C)CSCCC[N@@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000611032061 1057580688 /nfs/dbraw/zinc/58/06/88/1057580688.db2.gz MBERQXUWFWNGGY-OAHLLOKOSA-N 1 2 323.506 4.253 20 0 DIADLO CC(C)CSCCC[N@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000611032061 1057580692 /nfs/dbraw/zinc/58/06/92/1057580692.db2.gz MBERQXUWFWNGGY-OAHLLOKOSA-N 1 2 323.506 4.253 20 0 DIADLO CSc1ncc(-c2cc(F)c(C[NH+](C)C)c(F)c2)cc1C ZINC001243160175 1057590040 /nfs/dbraw/zinc/59/00/40/1057590040.db2.gz SBKVMRARKUHSRP-UHFFFAOYSA-N 1 2 308.397 4.119 20 0 DIADLO COC(=O)c1oc([C@H](C)[N@@H+]2CC[C@H]2c2cccc(F)c2)cc1C ZINC000611372048 1057593223 /nfs/dbraw/zinc/59/32/23/1057593223.db2.gz OYJWFDSEYDYOHB-WFASDCNBSA-N 1 2 317.360 4.022 20 0 DIADLO COC(=O)c1oc([C@H](C)[N@H+]2CC[C@H]2c2cccc(F)c2)cc1C ZINC000611372048 1057593228 /nfs/dbraw/zinc/59/32/28/1057593228.db2.gz OYJWFDSEYDYOHB-WFASDCNBSA-N 1 2 317.360 4.022 20 0 DIADLO COC(=O)c1oc([C@@H](C)[N@@H+]2CC[C@@H]2c2cccc(F)c2)cc1C ZINC000611372046 1057593713 /nfs/dbraw/zinc/59/37/13/1057593713.db2.gz OYJWFDSEYDYOHB-IUODEOHRSA-N 1 2 317.360 4.022 20 0 DIADLO COC(=O)c1oc([C@@H](C)[N@H+]2CC[C@@H]2c2cccc(F)c2)cc1C ZINC000611372046 1057593715 /nfs/dbraw/zinc/59/37/15/1057593715.db2.gz OYJWFDSEYDYOHB-IUODEOHRSA-N 1 2 317.360 4.022 20 0 DIADLO CCCOc1ccc(-c2cc[nH+]c(N3CCCC3)c2)cc1F ZINC001243220345 1057610405 /nfs/dbraw/zinc/61/04/05/1057610405.db2.gz XYOKABSQASEGKD-UHFFFAOYSA-N 1 2 300.377 4.277 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2cnn(C(C)(C)C)c2)c1C ZINC001118537150 1057615860 /nfs/dbraw/zinc/61/58/60/1057615860.db2.gz OBOMWOGUCYFCEU-UHFFFAOYSA-N 1 2 319.474 4.092 20 0 DIADLO C[C@@H]1c2cc(F)cc(F)c2CC[N@H+]1Cc1scnc1C1CC1 ZINC000494927645 1057618197 /nfs/dbraw/zinc/61/81/97/1057618197.db2.gz CELWSYUKEPPFQS-SNVBAGLBSA-N 1 2 320.408 4.418 20 0 DIADLO C[C@@H]1c2cc(F)cc(F)c2CC[N@@H+]1Cc1scnc1C1CC1 ZINC000494927645 1057618202 /nfs/dbraw/zinc/61/82/02/1057618202.db2.gz CELWSYUKEPPFQS-SNVBAGLBSA-N 1 2 320.408 4.418 20 0 DIADLO C[C@H]1C[N@H+](Cc2scnc2C2CC2)C[C@@H](c2ccsc2)O1 ZINC000494929988 1057619856 /nfs/dbraw/zinc/61/98/56/1057619856.db2.gz MRXPWLINQXWNDC-FZMZJTMJSA-N 1 2 320.483 4.044 20 0 DIADLO C[C@H]1C[N@@H+](Cc2scnc2C2CC2)C[C@@H](c2ccsc2)O1 ZINC000494929988 1057619861 /nfs/dbraw/zinc/61/98/61/1057619861.db2.gz MRXPWLINQXWNDC-FZMZJTMJSA-N 1 2 320.483 4.044 20 0 DIADLO CCOc1cc(F)c(F)cc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243276998 1057632478 /nfs/dbraw/zinc/63/24/78/1057632478.db2.gz VTSRDCNPAFGKEI-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO CCOc1cc(F)c(F)cc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001243278261 1057633472 /nfs/dbraw/zinc/63/34/72/1057633472.db2.gz MGWOZSJZZOMZDW-UHFFFAOYSA-N 1 2 318.298 4.355 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(OC(C)C)cc3C)nn2)c1C ZINC001243281639 1057634504 /nfs/dbraw/zinc/63/45/04/1057634504.db2.gz QLXLOSJVFPXMHD-UHFFFAOYSA-N 1 2 322.412 4.042 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(C)c(F)c2)cs1 ZINC000165230107 1057640052 /nfs/dbraw/zinc/64/00/52/1057640052.db2.gz JPQOCXDTCYDURW-RYUDHWBXSA-N 1 2 308.422 4.149 20 0 DIADLO COc1cccc(OC)c1-c1ccccc1-c1c[nH+]c(N)c(C)c1 ZINC001243335002 1057650613 /nfs/dbraw/zinc/65/06/13/1057650613.db2.gz QBLLUJCSORCTOQ-UHFFFAOYSA-N 1 2 320.392 4.323 20 0 DIADLO C[C@H]([NH2+]Cc1coc(C2CC2)n1)c1ccc(Br)cc1 ZINC000727463191 1057654730 /nfs/dbraw/zinc/65/47/30/1057654730.db2.gz GEPWUBOQOKCQNC-JTQLQIEISA-N 1 2 321.218 4.165 20 0 DIADLO Cn1c(-c2cc(F)c(C[NH+](C)C)c(F)c2)cc2ccccc21 ZINC001243355694 1057656726 /nfs/dbraw/zinc/65/67/26/1057656726.db2.gz JPAZSOUXEJAROF-UHFFFAOYSA-N 1 2 300.352 4.185 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cccc(OC(F)F)c2)cc1F ZINC001243360327 1057659249 /nfs/dbraw/zinc/65/92/49/1057659249.db2.gz XCYJYWUGMPROLU-UHFFFAOYSA-N 1 2 313.294 4.295 20 0 DIADLO Cc1cc[nH+]c(C)c1-c1cc(F)cc(C(=O)N2CCCCC2)c1 ZINC001243406742 1057673147 /nfs/dbraw/zinc/67/31/47/1057673147.db2.gz IXUMIHMKNQTBQB-UHFFFAOYSA-N 1 2 312.388 4.131 20 0 DIADLO Cc1c(-c2cc(F)c(F)cc2OC(C)C)ccc2[nH+]ccn21 ZINC001243411869 1057674626 /nfs/dbraw/zinc/67/46/26/1057674626.db2.gz DRLOXPIPKUYSNM-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(Cc2ccccc2F)oc1=S ZINC000727816923 1057674942 /nfs/dbraw/zinc/67/49/42/1057674942.db2.gz LNXZCDHLEZKTSQ-UHFFFAOYSA-N 1 2 323.437 4.015 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(Cc2ccccc2F)oc1=S ZINC000727816923 1057674944 /nfs/dbraw/zinc/67/49/44/1057674944.db2.gz LNXZCDHLEZKTSQ-UHFFFAOYSA-N 1 2 323.437 4.015 20 0 DIADLO Cc1cn2c(cccc2-c2cc(F)c(F)cc2OC(C)C)[nH+]1 ZINC001243411998 1057675061 /nfs/dbraw/zinc/67/50/61/1057675061.db2.gz YZUYNROQMZDONB-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO CCC[NH+](CCC)Cn1nc(Cc2cccc(F)c2)oc1=S ZINC000727816343 1057675522 /nfs/dbraw/zinc/67/55/22/1057675522.db2.gz GCTNTVSGJIIWSE-UHFFFAOYSA-N 1 2 323.437 4.015 20 0 DIADLO CCC1CCC([N@H+](C)Cn2ncn(C(C)(C)C)c2=S)CC1 ZINC000727820008 1057676582 /nfs/dbraw/zinc/67/65/82/1057676582.db2.gz SXXBKTYVSRICMD-UHFFFAOYSA-N 1 2 310.511 4.027 20 0 DIADLO CCC1CCC([N@@H+](C)Cn2ncn(C(C)(C)C)c2=S)CC1 ZINC000727820008 1057676586 /nfs/dbraw/zinc/67/65/86/1057676586.db2.gz SXXBKTYVSRICMD-UHFFFAOYSA-N 1 2 310.511 4.027 20 0 DIADLO CCC[N@H+](CC)Cn1nc(-c2cccc(Cl)c2)oc1=S ZINC000727820863 1057676988 /nfs/dbraw/zinc/67/69/88/1057676988.db2.gz OZFBDFPQEPIOSH-UHFFFAOYSA-N 1 2 311.838 4.215 20 0 DIADLO CCC[N@@H+](CC)Cn1nc(-c2cccc(Cl)c2)oc1=S ZINC000727820863 1057676991 /nfs/dbraw/zinc/67/69/91/1057676991.db2.gz OZFBDFPQEPIOSH-UHFFFAOYSA-N 1 2 311.838 4.215 20 0 DIADLO CC[C@@H]1CCC[N@@H+]1Cn1[nH]c(-c2ccc(Cl)cc2)nc1=S ZINC000727823846 1057677848 /nfs/dbraw/zinc/67/78/48/1057677848.db2.gz LQLPHPJTUVUBGX-CYBMUJFWSA-N 1 2 322.865 4.093 20 0 DIADLO CC[C@@H]1CCC[N@H+]1Cn1[nH]c(-c2ccc(Cl)cc2)nc1=S ZINC000727823846 1057677849 /nfs/dbraw/zinc/67/78/49/1057677849.db2.gz LQLPHPJTUVUBGX-CYBMUJFWSA-N 1 2 322.865 4.093 20 0 DIADLO CCCCC[C@@H](NC(=O)CCCn1cc[nH+]c1)c1ccccc1 ZINC000728007210 1057683258 /nfs/dbraw/zinc/68/32/58/1057683258.db2.gz FQZAASOKPKJWPH-GOSISDBHSA-N 1 2 313.445 4.101 20 0 DIADLO CCCCC[C@@H](Nc1[nH+]cnc2c1cnn2C)c1ccccc1 ZINC000728052939 1057684918 /nfs/dbraw/zinc/68/49/18/1057684918.db2.gz WJAUMPAXRLCRGQ-MRXNPFEDSA-N 1 2 309.417 4.097 20 0 DIADLO Cc1[nH+]c(-c2cc(F)c(OC(F)F)c(F)c2)cc2[nH]ccc21 ZINC001243492464 1057694715 /nfs/dbraw/zinc/69/47/15/1057694715.db2.gz ISGCRVKIOKHUGQ-UHFFFAOYSA-N 1 2 310.250 4.418 20 0 DIADLO CCOc1ccc(Cl)c(-c2ccc(Cn3cc[nH+]c3)cn2)c1 ZINC001243566511 1057715954 /nfs/dbraw/zinc/71/59/54/1057715954.db2.gz KIRCOHPNGAPURT-UHFFFAOYSA-N 1 2 313.788 4.046 20 0 DIADLO COc1c(Cl)ccc(-c2ccccc2Cn2cc[nH+]c2)c1F ZINC001243574489 1057720216 /nfs/dbraw/zinc/72/02/16/1057720216.db2.gz ALHROJQLVYVFAY-UHFFFAOYSA-N 1 2 316.763 4.400 20 0 DIADLO COc1c(Cl)ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1F ZINC001243579060 1057722158 /nfs/dbraw/zinc/72/21/58/1057722158.db2.gz HGQKWPMEZWYKDV-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO CSc1ccc(-c2c[nH+]c(N3CCCCC3)cc2C)c(C)n1 ZINC001243583807 1057724206 /nfs/dbraw/zinc/72/42/06/1057724206.db2.gz VXBDRWIDVFQURP-UHFFFAOYSA-N 1 2 313.470 4.473 20 0 DIADLO CNc1ccc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)cn1 ZINC001203449043 1057725784 /nfs/dbraw/zinc/72/57/84/1057725784.db2.gz XEPSBFPTUAXTSY-UHFFFAOYSA-N 1 2 318.302 4.434 20 0 DIADLO COc1cccc2c1ccnc2-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243655990 1057745642 /nfs/dbraw/zinc/74/56/42/1057745642.db2.gz JPCAHTVCGCSCOT-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO c1cn(Cc2ccc(-c3cccc(-c4ccccn4)n3)cc2)c[nH+]1 ZINC001243656004 1057745792 /nfs/dbraw/zinc/74/57/92/1057745792.db2.gz FUBJAVTYBSOFAQ-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO COc1ccc2c(ccnc2-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243658438 1057746161 /nfs/dbraw/zinc/74/61/61/1057746161.db2.gz YEVNQVFBAGDVNG-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Fc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c(OC(F)F)c1 ZINC001243659000 1057746243 /nfs/dbraw/zinc/74/62/43/1057746243.db2.gz XLVPJSMMOVSFHX-UHFFFAOYSA-N 1 2 318.298 4.339 20 0 DIADLO Cc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)nc1C(F)(F)F ZINC001243658779 1057746534 /nfs/dbraw/zinc/74/65/34/1057746534.db2.gz ZNOZEWFGLWDQTP-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(-c4csnn4)cc3)cc2)c[nH+]1 ZINC001243659009 1057746722 /nfs/dbraw/zinc/74/67/22/1057746722.db2.gz XVWBRCGTZOCNBZ-UHFFFAOYSA-N 1 2 318.405 4.117 20 0 DIADLO Fc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c2ccncc12 ZINC001243657452 1057746739 /nfs/dbraw/zinc/74/67/39/1057746739.db2.gz LWEQAYMCMZESGA-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO FC(F)(F)c1cnccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243659685 1057746996 /nfs/dbraw/zinc/74/69/96/1057746996.db2.gz ZUZMGOUREOLUGI-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO CC1(C)Oc2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)cc2O1 ZINC001243659125 1057747171 /nfs/dbraw/zinc/74/71/71/1057747171.db2.gz LNMMVJYPLRYBOU-UHFFFAOYSA-N 1 2 306.365 4.106 20 0 DIADLO CC(=O)Nc1cc(F)c(-c2ccc(Cn3cc[nH+]c3)cc2)cc1C ZINC001243659376 1057747541 /nfs/dbraw/zinc/74/75/41/1057747541.db2.gz QQLYSWIWKQALDH-UHFFFAOYSA-N 1 2 323.371 4.004 20 0 DIADLO CCOc1c(F)cc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1F ZINC001243661958 1057748041 /nfs/dbraw/zinc/74/80/41/1057748041.db2.gz HIWMTMAFSVNXNM-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO COc1cnc2cc(-c3ccc(Cn4cc[nH+]c4)cc3)ccc2c1 ZINC001243662445 1057748503 /nfs/dbraw/zinc/74/85/03/1057748503.db2.gz QBHUWGNEQOWAPT-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ccc(Cl)nc2)C2CC2)c(F)c1 ZINC000731752290 1057753429 /nfs/dbraw/zinc/75/34/29/1057753429.db2.gz ZWIRXABJGLNEPA-UHFFFAOYSA-N 1 2 308.759 4.178 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ccc(Cl)nc2)C2CC2)c(F)c1 ZINC000731752290 1057753431 /nfs/dbraw/zinc/75/34/31/1057753431.db2.gz ZWIRXABJGLNEPA-UHFFFAOYSA-N 1 2 308.759 4.178 20 0 DIADLO CC[C@@H](C)C[N@H+](C)Cn1nc(-c2ccccc2C)oc1=S ZINC000732183929 1057769264 /nfs/dbraw/zinc/76/92/64/1057769264.db2.gz VPQRKXVBZAQURL-GFCCVEGCSA-N 1 2 305.447 4.116 20 0 DIADLO CC[C@@H](C)C[N@@H+](C)Cn1nc(-c2ccccc2C)oc1=S ZINC000732183929 1057769268 /nfs/dbraw/zinc/76/92/68/1057769268.db2.gz VPQRKXVBZAQURL-GFCCVEGCSA-N 1 2 305.447 4.116 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1cc(F)ccc1F ZINC000732210240 1057769524 /nfs/dbraw/zinc/76/95/24/1057769524.db2.gz RBZUGEANODBPIU-PJIJBLCYSA-N 1 2 317.379 4.315 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1cc(F)ccc1F ZINC000732210240 1057769526 /nfs/dbraw/zinc/76/95/26/1057769526.db2.gz RBZUGEANODBPIU-PJIJBLCYSA-N 1 2 317.379 4.315 20 0 DIADLO COc1ccc(-c2cc[nH+]c(N3CCCC3)c2)cc1SC ZINC001243750672 1057770453 /nfs/dbraw/zinc/77/04/53/1057770453.db2.gz SEVTZVUVPDLEQT-UHFFFAOYSA-N 1 2 300.427 4.079 20 0 DIADLO Fc1ccc(-c2ccc(Cl)c3n[nH]cc32)cc1-n1cc[nH+]c1 ZINC001243786513 1057778990 /nfs/dbraw/zinc/77/89/90/1057778990.db2.gz GSZXTIRUVPDGGY-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO CC[N@H+](CC1CC1)Cn1nc(-c2cccc(Cl)c2)oc1=S ZINC000732663512 1057782507 /nfs/dbraw/zinc/78/25/07/1057782507.db2.gz VXLYOYRWSABYRM-UHFFFAOYSA-N 1 2 323.849 4.215 20 0 DIADLO CC[N@@H+](CC1CC1)Cn1nc(-c2cccc(Cl)c2)oc1=S ZINC000732663512 1057782509 /nfs/dbraw/zinc/78/25/09/1057782509.db2.gz VXLYOYRWSABYRM-UHFFFAOYSA-N 1 2 323.849 4.215 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(Br)cc1F ZINC001243802829 1057783210 /nfs/dbraw/zinc/78/32/10/1057783210.db2.gz UFUQHBZFOAXILD-UHFFFAOYSA-N 1 2 309.182 4.025 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(F)cc(F)c1Cl ZINC001243845369 1057791489 /nfs/dbraw/zinc/79/14/89/1057791489.db2.gz HGTWBELDMMATMF-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1ncc(C(C)C)o1 ZINC000733303840 1057811256 /nfs/dbraw/zinc/81/12/56/1057811256.db2.gz DIXSCXCVWJPGMG-UHFFFAOYSA-N 1 2 312.417 4.408 20 0 DIADLO Fc1ccc(-c2cc3ncnc(C4=C[NH2+]CCC4)c3s2)cc1 ZINC001243949619 1057817348 /nfs/dbraw/zinc/81/73/48/1057817348.db2.gz WCTBFSMHFCAHAX-UHFFFAOYSA-N 1 2 311.385 4.222 20 0 DIADLO Cc1ccc(-c2nnc(C3=C[NH2+]CCC3)c3ccccc32)cc1 ZINC001243949719 1057817778 /nfs/dbraw/zinc/81/77/78/1057817778.db2.gz XMCNSWCQSVGZHJ-UHFFFAOYSA-N 1 2 301.393 4.330 20 0 DIADLO Fc1ccc(-c2nnc(C3=C[NH2+]CCC3)c3ccccc32)cc1 ZINC001243948444 1057817916 /nfs/dbraw/zinc/81/79/16/1057817916.db2.gz FONMNYHYFDLZHH-UHFFFAOYSA-N 1 2 305.356 4.160 20 0 DIADLO Cc1c(-c2ccccc2)sc2ncnc(C3=C[NH2+]CCC3)c12 ZINC001243948994 1057818015 /nfs/dbraw/zinc/81/80/15/1057818015.db2.gz IOBAMKSSJKOMBW-UHFFFAOYSA-N 1 2 307.422 4.391 20 0 DIADLO CCOC(=O)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c(C)c1 ZINC001243975608 1057825679 /nfs/dbraw/zinc/82/56/79/1057825679.db2.gz QYTJJFPHNIYCAO-UHFFFAOYSA-N 1 2 306.365 4.229 20 0 DIADLO S=C1N=NC(c2ccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)cc2)O1 ZINC001243976680 1057826414 /nfs/dbraw/zinc/82/64/14/1057826414.db2.gz UJWOZZNGDDRPIZ-UHFFFAOYSA-N 1 2 320.377 4.082 20 0 DIADLO COC(=O)c1cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc2cc[nH]c21 ZINC001243976323 1057826672 /nfs/dbraw/zinc/82/66/72/1057826672.db2.gz MRBJNFSIKYPXKO-UHFFFAOYSA-N 1 2 317.348 4.012 20 0 DIADLO CC1(C)Cc2ccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)cc2NC1=O ZINC001243978518 1057827528 /nfs/dbraw/zinc/82/75/28/1057827528.db2.gz CZALNONVGJUXGM-UHFFFAOYSA-N 1 2 317.392 4.265 20 0 DIADLO Cc1noc(-c2ccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)cc2)c1N ZINC001243978834 1057827574 /nfs/dbraw/zinc/82/75/74/1057827574.db2.gz OFNCQCBCOPDOTO-UHFFFAOYSA-N 1 2 316.364 4.289 20 0 DIADLO COC(=O)c1ccc(C)c(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1C ZINC001243980127 1057828164 /nfs/dbraw/zinc/82/81/64/1057828164.db2.gz LKYPKQUSJCTWPB-UHFFFAOYSA-N 1 2 306.365 4.147 20 0 DIADLO CCc1cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)ccc1C(=O)OC ZINC001243981020 1057828355 /nfs/dbraw/zinc/82/83/55/1057828355.db2.gz PPHBQYXTSVXRFV-UHFFFAOYSA-N 1 2 306.365 4.093 20 0 DIADLO Nc1cn2ccc(-c3ccc(C(F)(F)F)cc3Cl)cc2[nH+]1 ZINC001243983673 1057828961 /nfs/dbraw/zinc/82/89/61/1057828961.db2.gz OXOLRJPOVGTYGR-UHFFFAOYSA-N 1 2 311.694 4.256 20 0 DIADLO COC(=O)c1cc(Cl)cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001244078994 1057861320 /nfs/dbraw/zinc/86/13/20/1057861320.db2.gz DUKPQCMWGMGIBO-UHFFFAOYSA-N 1 2 312.756 4.184 20 0 DIADLO COc1cccc(C(F)(F)F)c1-c1ccc2[nH+]c(C)cn2c1 ZINC001244081728 1057862704 /nfs/dbraw/zinc/86/27/04/1057862704.db2.gz UORHEFBWONRLBZ-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO CC(C)(c1ccc(-c2nc3[nH]ccc3c[nH+]2)cc1)C(F)(F)F ZINC001244098384 1057868536 /nfs/dbraw/zinc/86/85/36/1057868536.db2.gz GRTOCQLSJSSLDG-UHFFFAOYSA-N 1 2 305.303 4.416 20 0 DIADLO Cc1c(-c2cc(F)c(OC(C)C)c(F)c2)ccc2[nH+]ccn21 ZINC001244110022 1057871523 /nfs/dbraw/zinc/87/15/23/1057871523.db2.gz WYKCXPMTFDOWNA-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO c1cn(Cc2ccccc2-c2ccccc2N2CCCC2)c[nH+]1 ZINC001244183817 1057893795 /nfs/dbraw/zinc/89/37/95/1057893795.db2.gz XPGFRFYZVQPZFU-UHFFFAOYSA-N 1 2 303.409 4.199 20 0 DIADLO CNc1cc(-c2ccc(OC)c(OCc3ccccc3)c2)cc[nH+]1 ZINC001244206958 1057900003 /nfs/dbraw/zinc/90/00/03/1057900003.db2.gz PHLHUVBMLJVENC-UHFFFAOYSA-N 1 2 320.392 4.378 20 0 DIADLO Cc1cc(-c2ccc(Cn3cc[nH+]c3)cn2)cc(C)c1OC(C)C ZINC001244210159 1057901091 /nfs/dbraw/zinc/90/10/91/1057901091.db2.gz OCPNHQLOTAACJU-UHFFFAOYSA-N 1 2 321.424 4.397 20 0 DIADLO CC(C)c1ccc(N)c(-c2cc(F)c(C[NH+](C)C)c(F)c2)c1 ZINC001244228507 1057903954 /nfs/dbraw/zinc/90/39/54/1057903954.db2.gz FECNLGHDULHKTO-UHFFFAOYSA-N 1 2 304.384 4.399 20 0 DIADLO Cc1cc2cc(-c3cc(F)c(C[NH+](C)C)c(F)c3)ccc2[nH]1 ZINC001244243819 1057907741 /nfs/dbraw/zinc/90/77/41/1057907741.db2.gz AVMUJNYMDNBQKO-UHFFFAOYSA-N 1 2 300.352 4.483 20 0 DIADLO COc1cccc(C2CC2)c1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001244254454 1057912575 /nfs/dbraw/zinc/91/25/75/1057912575.db2.gz CGLWIVXIJKRICL-UHFFFAOYSA-N 1 2 304.393 4.484 20 0 DIADLO Fc1cc(N2CCCC2)ccc1-c1ccccc1Cn1cc[nH+]c1 ZINC001244269917 1057918807 /nfs/dbraw/zinc/91/88/07/1057918807.db2.gz NQEXEUQCEACJBX-UHFFFAOYSA-N 1 2 321.399 4.338 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(N3CCCC3)cc2F)cc1 ZINC001244273510 1057919949 /nfs/dbraw/zinc/91/99/49/1057919949.db2.gz YZPVVKBECDEAMH-UHFFFAOYSA-N 1 2 321.399 4.493 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(C4CC4)cc3C)nn2)c1C ZINC001244276847 1057921481 /nfs/dbraw/zinc/92/14/81/1057921481.db2.gz ANNPRNZKRYHELY-UHFFFAOYSA-N 1 2 304.397 4.132 20 0 DIADLO Nc1cccc(C[N@@H+]2CCc3cc(Cl)cc(Cl)c3C2)c1 ZINC000340575675 1057922516 /nfs/dbraw/zinc/92/25/16/1057922516.db2.gz OGRBDKNBAXWFLO-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1cccc(C[N@H+]2CCc3cc(Cl)cc(Cl)c3C2)c1 ZINC000340575675 1057922520 /nfs/dbraw/zinc/92/25/20/1057922520.db2.gz OGRBDKNBAXWFLO-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO FC(F)(F)Cc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cn1 ZINC001244291870 1057923997 /nfs/dbraw/zinc/92/39/97/1057923997.db2.gz BVXICHPEGUZNSL-UHFFFAOYSA-N 1 2 303.287 4.039 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc4sccc4c3)nn2)c1C ZINC001244301992 1057927699 /nfs/dbraw/zinc/92/76/99/1057927699.db2.gz VTBJRPOQDKKUTI-UHFFFAOYSA-N 1 2 306.394 4.161 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(N)c(C(F)(F)F)c2)c1 ZINC001244368914 1057945922 /nfs/dbraw/zinc/94/59/22/1057945922.db2.gz YZYLSGQJKHHBEF-UHFFFAOYSA-N 1 2 317.314 4.355 20 0 DIADLO Cc1cc(-c2cc(Cl)ccc2NC(=O)C(C)(C)C)c[nH+]c1N ZINC001244374670 1057946611 /nfs/dbraw/zinc/94/66/11/1057946611.db2.gz PNALROAPQBGDJH-UHFFFAOYSA-N 1 2 317.820 4.277 20 0 DIADLO Clc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c2n[nH]cc21 ZINC001244389710 1057949075 /nfs/dbraw/zinc/94/90/75/1057949075.db2.gz OWXZAHIGCLZFAZ-UHFFFAOYSA-N 1 2 308.772 4.128 20 0 DIADLO Cc1ccc(O)cc1-c1ccc(-c2nc3c(o2)CC[N@@H+](C)C3)cc1 ZINC001244451939 1057961876 /nfs/dbraw/zinc/96/18/76/1057961876.db2.gz LRTJVIPIGYWAJN-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO Cc1ccc(O)cc1-c1ccc(-c2nc3c(o2)CC[N@H+](C)C3)cc1 ZINC001244451939 1057961879 /nfs/dbraw/zinc/96/18/79/1057961879.db2.gz LRTJVIPIGYWAJN-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2c(Cl)cc(C)cc2Cl)cc1 ZINC001244508179 1057981223 /nfs/dbraw/zinc/98/12/23/1057981223.db2.gz XGKHQFJPEDRRHJ-HNNXBMFYSA-N 1 2 324.207 4.142 20 0 DIADLO COc1c(F)cc(-c2cccn3cc[nH+]c23)cc1C(F)(F)F ZINC001244571584 1057999043 /nfs/dbraw/zinc/99/90/43/1057999043.db2.gz LJDIAVDNIMKGDP-UHFFFAOYSA-N 1 2 310.250 4.168 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(C)cc(Cl)c1N ZINC001244589877 1058003948 /nfs/dbraw/zinc/00/39/48/1058003948.db2.gz PAHRRVFMNWNCEO-UHFFFAOYSA-N 1 2 313.788 4.092 20 0 DIADLO CC(=O)c1ccc(F)c(-c2ccc(Cn3cc[nH+]c3)cc2)c1F ZINC001244618903 1058011091 /nfs/dbraw/zinc/01/10/91/1058011091.db2.gz APFSOHLPNSWKIT-UHFFFAOYSA-N 1 2 312.319 4.079 20 0 DIADLO CC(=O)c1ccc(F)c(-c2ccccc2Cn2cc[nH+]c2)c1F ZINC001244621050 1058011646 /nfs/dbraw/zinc/01/16/46/1058011646.db2.gz DGDXRBPJSSYILP-UHFFFAOYSA-N 1 2 312.319 4.079 20 0 DIADLO COCOc1ccc(C(F)(F)F)cc1-c1ccc2[nH+]ccn2c1 ZINC001244635814 1058017012 /nfs/dbraw/zinc/01/70/12/1058017012.db2.gz DHDPPWKUQAJRBI-UHFFFAOYSA-N 1 2 322.286 4.003 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2cc(C)c(Cl)cc2Cl)cc1 ZINC001244748164 1058041087 /nfs/dbraw/zinc/04/10/87/1058041087.db2.gz IBIDBMCCTOWPOE-OAHLLOKOSA-N 1 2 324.207 4.142 20 0 DIADLO COC(=[NH2+])c1cccc(-c2cc(F)cc(N3CCCCC3)c2)c1 ZINC001244820740 1058053017 /nfs/dbraw/zinc/05/30/17/1058053017.db2.gz OWIXHPGIKUCAGB-UHFFFAOYSA-N 1 2 312.388 4.455 20 0 DIADLO CCN(CC)c1cc(F)cc(-c2cccc(C(=[NH2+])OC)c2)c1 ZINC001244824415 1058053912 /nfs/dbraw/zinc/05/39/12/1058053912.db2.gz WTFJTFOCCJRLLI-UHFFFAOYSA-N 1 2 300.377 4.311 20 0 DIADLO Cc1ccc(-c2cccc(C[NH+]3CCOCC3)c2F)c2[nH]ccc21 ZINC001244853833 1058059024 /nfs/dbraw/zinc/05/90/24/1058059024.db2.gz LIFDWMYAOGYKKM-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO COc1cc(-c2ccccc2Cn2cc[nH+]c2)ccc1C1CC1 ZINC001244890472 1058066542 /nfs/dbraw/zinc/06/65/42/1058066542.db2.gz BARBINFNXHCRLM-UHFFFAOYSA-N 1 2 304.393 4.484 20 0 DIADLO CNc1cc(-c2ccc3nc(-c4ccccc4)cn3c2)cc[nH+]1 ZINC001244975869 1058084275 /nfs/dbraw/zinc/08/42/75/1058084275.db2.gz DUTRPNNHDZSGIX-UHFFFAOYSA-N 1 2 300.365 4.105 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cccc(C4CCC4)c3)nn2)c1C ZINC001244979876 1058085234 /nfs/dbraw/zinc/08/52/34/1058085234.db2.gz MHMJAYHHIJRAIC-UHFFFAOYSA-N 1 2 304.397 4.214 20 0 DIADLO Nc1cc(-c2cc(F)c(F)cc2Cl)[nH+]cc1C(F)(F)F ZINC001245014682 1058093534 /nfs/dbraw/zinc/09/35/34/1058093534.db2.gz VBWGKUUNXYWTAE-UHFFFAOYSA-N 1 2 308.637 4.281 20 0 DIADLO Clc1cccc(-c2ccc(Cn3cc[nH+]c3)cn2)c1Cl ZINC001245096984 1058112214 /nfs/dbraw/zinc/11/22/14/1058112214.db2.gz AOIYXTYYLSBYOA-UHFFFAOYSA-N 1 2 304.180 4.300 20 0 DIADLO Fc1ccc2nccc(-c3c[nH+]cn3Cc3ccccc3)c2c1 ZINC001245196459 1058125745 /nfs/dbraw/zinc/12/57/45/1058125745.db2.gz BIQHHZJJQADPTI-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO c1coc(-c2ccc(-c3c[nH+]cn3Cc3ccccc3)cc2)n1 ZINC001245196443 1058125819 /nfs/dbraw/zinc/12/58/19/1058125819.db2.gz FFAIRNYFMJOGGB-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO Fc1cc(-c2c[nH+]cn2Cc2ccccc2)cc2cccnc12 ZINC001245197194 1058126232 /nfs/dbraw/zinc/12/62/32/1058126232.db2.gz QSFLTAKEDCOLQH-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO COC(=O)c1c(C)cc(-c2c[nH+]cn2Cc2ccccc2)cc1C ZINC001245196607 1058126294 /nfs/dbraw/zinc/12/62/94/1058126294.db2.gz IJOTURSQTJJZOI-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO Fc1ccc(-c2c[nH+]cn2Cc2ccccc2)c2ccncc12 ZINC001245196875 1058126428 /nfs/dbraw/zinc/12/64/28/1058126428.db2.gz LGQQFRCDJSOQTP-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO FC(F)(F)Oc1ccc(-c2c[nH+]cn2Cc2ccccc2)cc1 ZINC001245198013 1058126507 /nfs/dbraw/zinc/12/65/07/1058126507.db2.gz LFSDLLZSFFOZCB-UHFFFAOYSA-N 1 2 318.298 4.497 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1-c1ccc(C2CCOCC2)cc1 ZINC001245198632 1058126783 /nfs/dbraw/zinc/12/67/83/1058126783.db2.gz KVYIFWRLWIIQSK-UHFFFAOYSA-N 1 2 318.420 4.492 20 0 DIADLO Cc1nc(OCC(C)C)ccc1-c1c[nH+]cn1Cc1ccccc1 ZINC001245200238 1058126841 /nfs/dbraw/zinc/12/68/41/1058126841.db2.gz HQRNKQQYLHRWRE-UHFFFAOYSA-N 1 2 321.424 4.337 20 0 DIADLO Fc1cccc2c(-c3c[nH+]cn3Cc3ccccc3)ccnc12 ZINC001245198350 1058127006 /nfs/dbraw/zinc/12/70/06/1058127006.db2.gz BMSNKMMZRRIUJO-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2ccnc(OCC3CCC3)c2)cc1 ZINC001245243072 1058134001 /nfs/dbraw/zinc/13/40/01/1058134001.db2.gz YMLYLSKGEDZKCS-UHFFFAOYSA-N 1 2 310.397 4.289 20 0 DIADLO COc1c(-c2cccc3[nH+]c(C)cn32)cccc1C(F)(F)F ZINC001245276493 1058138432 /nfs/dbraw/zinc/13/84/32/1058138432.db2.gz IXWPQNARHCYVBP-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Nc1cn2ccc(-c3cccc(SCC(F)(F)F)c3)cc2[nH+]1 ZINC001245408545 1058161320 /nfs/dbraw/zinc/16/13/20/1058161320.db2.gz DDVMETBDFNCXNA-UHFFFAOYSA-N 1 2 323.343 4.238 20 0 DIADLO Cc1cn2cc(-c3cccc(Br)c3F)ccc2[nH+]1 ZINC001245484830 1058178374 /nfs/dbraw/zinc/17/83/74/1058178374.db2.gz VAZGTWPWVOEILO-UHFFFAOYSA-N 1 2 305.150 4.211 20 0 DIADLO CC(C)C[C@@H](C(=O)N(C)c1ccc(C(C)C)cc1)n1cc[nH+]c1 ZINC001545474371 1058203052 /nfs/dbraw/zinc/20/30/52/1058203052.db2.gz IHKZQXDJTDUIPY-SFHVURJKSA-N 1 2 313.445 4.257 20 0 DIADLO CC[C@@H](Cc1ccccc1C)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC001545563446 1058209767 /nfs/dbraw/zinc/20/97/67/1058209767.db2.gz RYTJSLGYWBMGNB-HNNXBMFYSA-N 1 2 321.424 4.387 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc(C(F)F)c(F)c3)cc2[nH+]1 ZINC001545563045 1058210195 /nfs/dbraw/zinc/21/01/95/1058210195.db2.gz HSBSKVKXXHXQKM-UHFFFAOYSA-N 1 2 319.286 4.200 20 0 DIADLO Cc1cc(-c2nccc3cc(-c4ccc(F)cc4)[nH]c32)c[nH+]c1N ZINC001245537845 1058215802 /nfs/dbraw/zinc/21/58/02/1058215802.db2.gz JJUVSIDOWXUFRO-UHFFFAOYSA-N 1 2 318.355 4.322 20 0 DIADLO Cc1cc(-c2nc(C)nc3sc4c(c32)CC[C@H](C)C4)c[nH+]c1N ZINC001245537778 1058215949 /nfs/dbraw/zinc/21/59/49/1058215949.db2.gz IGDRCJOGAQKUOH-VIFPVBQESA-N 1 2 324.453 4.077 20 0 DIADLO Cc1cc(-c2nccc3c2cccc3C(F)(F)F)c[nH+]c1N ZINC001245537735 1058216168 /nfs/dbraw/zinc/21/61/68/1058216168.db2.gz HBFAAHUUBGDHAD-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1c(-c2cnc(OCC(C)C)c(Cl)c2)ccc2[nH+]ccn21 ZINC001245534276 1058216928 /nfs/dbraw/zinc/21/69/28/1058216928.db2.gz XGWDGWSHYRSMMP-UHFFFAOYSA-N 1 2 315.804 4.393 20 0 DIADLO Cc1cc(-c2ccc(NC(=O)Oc3ccccc3)cc2)c[nH+]c1N ZINC001245540472 1058218440 /nfs/dbraw/zinc/21/84/40/1058218440.db2.gz DZJFAVLWJCLCPD-UHFFFAOYSA-N 1 2 319.364 4.250 20 0 DIADLO Cc1cc(-c2ccnc3c2cccc3C(F)(F)F)c[nH+]c1N ZINC001245538558 1058218861 /nfs/dbraw/zinc/21/88/61/1058218861.db2.gz OBKSEBIJIMNUKX-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1cc(-c2ccnc3ccc(C(F)(F)F)cc32)c[nH+]c1N ZINC001245539161 1058219189 /nfs/dbraw/zinc/21/91/89/1058219189.db2.gz SBUIRHDZEQFTEY-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1cc(-c2ccc(OC(F)(F)F)c3ncccc23)c[nH+]c1N ZINC001245540101 1058220336 /nfs/dbraw/zinc/22/03/36/1058220336.db2.gz QSSIKICSZFNHJG-UHFFFAOYSA-N 1 2 319.286 4.086 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc2cc(F)ccc2[nH]1 ZINC001245578350 1058247804 /nfs/dbraw/zinc/24/78/04/1058247804.db2.gz NIUSTBXKVJZUOF-UHFFFAOYSA-N 1 2 307.328 4.168 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cc4c(cccc4Cl)[nH]3)nn2)c1C ZINC001245580870 1058250535 /nfs/dbraw/zinc/25/05/35/1058250535.db2.gz RFVMQZXCEHPJLF-UHFFFAOYSA-N 1 2 323.787 4.081 20 0 DIADLO CCn1c[nH+]cc1[C@@H]1CCCCN1C(=O)[C@@H]1C[C@@H]1CC(C)(C)C ZINC001549059466 1058280271 /nfs/dbraw/zinc/28/02/71/1058280271.db2.gz FFTZOMHBCLJHNA-OAGGEKHMSA-N 1 2 317.477 4.029 20 0 DIADLO CCn1c[nH+]cc1[C@@H]1CCCCN1C(=O)[C@H]1C[C@@H]1CC(C)(C)C ZINC001549059468 1058282229 /nfs/dbraw/zinc/28/22/29/1058282229.db2.gz FFTZOMHBCLJHNA-PMPSAXMXSA-N 1 2 317.477 4.029 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2Cc2cnc(C3CC3)o2)sc1C ZINC001549631655 1058300496 /nfs/dbraw/zinc/30/04/96/1058300496.db2.gz IOLPPFXOHZCMOX-OAHLLOKOSA-N 1 2 317.458 4.353 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2Cc2cnc(C3CC3)o2)sc1C ZINC001549631655 1058300506 /nfs/dbraw/zinc/30/05/06/1058300506.db2.gz IOLPPFXOHZCMOX-OAHLLOKOSA-N 1 2 317.458 4.353 20 0 DIADLO C[N@@H+]1CCCC[C@H]1c1ccc(-c2cc(Cl)c(O)cc2F)nc1 ZINC001245670678 1058324287 /nfs/dbraw/zinc/32/42/87/1058324287.db2.gz VKMREFLYWZUPTJ-INIZCTEOSA-N 1 2 320.795 4.404 20 0 DIADLO C[N@H+]1CCCC[C@H]1c1ccc(-c2cc(Cl)c(O)cc2F)nc1 ZINC001245670678 1058324303 /nfs/dbraw/zinc/32/43/03/1058324303.db2.gz VKMREFLYWZUPTJ-INIZCTEOSA-N 1 2 320.795 4.404 20 0 DIADLO c1c(C[N@@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)noc1C1CC1 ZINC001550641059 1058352018 /nfs/dbraw/zinc/35/20/18/1058352018.db2.gz BDOJUWLFNIGYNW-FHWLQOOXSA-N 1 2 324.424 4.047 20 0 DIADLO c1c(C[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)noc1C1CC1 ZINC001550641059 1058352033 /nfs/dbraw/zinc/35/20/33/1058352033.db2.gz BDOJUWLFNIGYNW-FHWLQOOXSA-N 1 2 324.424 4.047 20 0 DIADLO Cc1cc(-c2ccc(Cl)c(C)c2C)c[nH+]c1N1CCOCC1 ZINC001245688355 1058353738 /nfs/dbraw/zinc/35/37/38/1058353738.db2.gz QKWURWOLYWMSIU-UHFFFAOYSA-N 1 2 316.832 4.164 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@H]3CCCC[C@H]3C2)c(C)[nH+]1 ZINC001562900627 1058357104 /nfs/dbraw/zinc/35/71/04/1058357104.db2.gz MAPYJXIRRKCYJU-CVEARBPZSA-N 1 2 301.434 4.051 20 0 DIADLO CCC[C@@H](NC(=O)Nc1c(C)cc(C)[nH+]c1C)C1CCCC1 ZINC001562900721 1058357312 /nfs/dbraw/zinc/35/73/12/1058357312.db2.gz PEMOWNOLXOJCFU-MRXNPFEDSA-N 1 2 303.450 4.487 20 0 DIADLO Cc1cc(N2CC[C@H](c3ccccc3)O[C@@H](C)C2)nc(C2CC2)[nH+]1 ZINC001551229495 1058381800 /nfs/dbraw/zinc/38/18/00/1058381800.db2.gz UWAWYIDCBKOPAH-MAUKXSAKSA-N 1 2 323.440 4.019 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(Cl)s2)CC[C@H](c2ccccc2)O1 ZINC001551397123 1058395683 /nfs/dbraw/zinc/39/56/83/1058395683.db2.gz UKQOMTCADXCYSG-IUODEOHRSA-N 1 2 322.861 4.149 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(Cl)s2)CC[C@H](c2ccccc2)O1 ZINC001551397123 1058395701 /nfs/dbraw/zinc/39/57/01/1058395701.db2.gz UKQOMTCADXCYSG-IUODEOHRSA-N 1 2 322.861 4.149 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@@H]2CC(C)C)[nH+]c1C ZINC001551738008 1058408213 /nfs/dbraw/zinc/40/82/13/1058408213.db2.gz GDOVZSRUFWGOQZ-GOEBONIOSA-N 1 2 311.429 4.314 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2CCCC[C@H]2F)[nH+]c1C ZINC001551740840 1058409299 /nfs/dbraw/zinc/40/92/99/1058409299.db2.gz OGRYSWKNFJJZHI-UKRRQHHQSA-N 1 2 315.392 4.160 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)[nH+]c1C ZINC001551738719 1058409673 /nfs/dbraw/zinc/40/96/73/1058409673.db2.gz JABOZTMGGIJDFT-HALDLXJZSA-N 1 2 309.413 4.068 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C[C@H]2CC[C@@H](C)C2)[nH+]c1C ZINC001551743537 1058410507 /nfs/dbraw/zinc/41/05/07/1058410507.db2.gz WMYYSRIZXPNUGX-DOMZBBRYSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1cn2cc(NC(=O)Cc3ccc(C4CCC4)cc3)ccc2[nH+]1 ZINC001519734184 1058468255 /nfs/dbraw/zinc/46/82/55/1058468255.db2.gz ZMBGWLQYDFALHG-UHFFFAOYSA-N 1 2 319.408 4.091 20 0 DIADLO CCOC(=O)c1ccc(CC)cc1-c1cccc(C(=[NH2+])OC)c1 ZINC001245786325 1058470162 /nfs/dbraw/zinc/47/01/62/1058470162.db2.gz IVXHQVBAEIZHLJ-UHFFFAOYSA-N 1 2 311.381 4.064 20 0 DIADLO COc1ccc(Cl)cc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001245813185 1058499008 /nfs/dbraw/zinc/49/90/08/1058499008.db2.gz BGTQKBBNPKIPKU-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO C/C(=C\C=C\[NH3+])c1cc(Br)ccc1OC(F)(F)F ZINC001245839414 1058546741 /nfs/dbraw/zinc/54/67/41/1058546741.db2.gz ODKKAIVJNZYSQT-YALUOGEHSA-N 1 2 322.124 4.223 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@H]2c2ccco2)[nH+]c1C ZINC001553986727 1058511172 /nfs/dbraw/zinc/51/11/72/1058511172.db2.gz GGPYUPZLKFWUTR-CABCVRRESA-N 1 2 321.380 4.029 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@H]2c2ccco2)[nH+]c1C ZINC001553986747 1058512063 /nfs/dbraw/zinc/51/20/63/1058512063.db2.gz GGPYUPZLKFWUTR-HUUCEWRRSA-N 1 2 321.380 4.029 20 0 DIADLO Cc1ccc([C@H](C)C(=O)Nc2ccccc2-c2[nH]c(C)c(C)[nH+]2)o1 ZINC001553986719 1058512353 /nfs/dbraw/zinc/51/23/53/1058512353.db2.gz GDYYEJGFKHCSRO-LBPRGKRZSA-N 1 2 323.396 4.337 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1noc([C@H]2CC[C@H](c3ccccc3)C2)n1 ZINC001554098284 1058518183 /nfs/dbraw/zinc/51/81/83/1058518183.db2.gz BHWVKQUGCYCHBW-GJZGRUSLSA-N 1 2 320.396 4.074 20 0 DIADLO Oc1ccc(F)c(-c2ccc(Cn3cc[nH+]c3)cc2)c1Cl ZINC001245833022 1058537512 /nfs/dbraw/zinc/53/75/12/1058537512.db2.gz XBXIXUFVWGSHSN-UHFFFAOYSA-N 1 2 302.736 4.097 20 0 DIADLO CC/C(=C/C(=O)NCc1c[nH+]c(C)cc1C)c1ccc(C)cc1 ZINC001528920624 1058552464 /nfs/dbraw/zinc/55/24/64/1058552464.db2.gz VGFALCXZTSJJPF-BOPFTXTBSA-N 1 2 308.425 4.117 20 0 DIADLO CC/C(=C\C(=O)NCc1c[nH+]c(C)cc1C)c1ccc(C)cc1 ZINC001528920626 1058553003 /nfs/dbraw/zinc/55/30/03/1058553003.db2.gz VGFALCXZTSJJPF-GZTJUZNOSA-N 1 2 308.425 4.117 20 0 DIADLO CC(C)=CCC[C@H](C)CC(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001520247955 1058568331 /nfs/dbraw/zinc/56/83/31/1058568331.db2.gz IYKONGDAOZJZBF-AWEZNQCLSA-N 1 2 303.450 4.167 20 0 DIADLO CC(C)C[C@H](C(=O)N(C)c1ccccc1C(C)C)n1cc[nH+]c1 ZINC001556888130 1058665112 /nfs/dbraw/zinc/66/51/12/1058665112.db2.gz MEUXHPLOQWVTSL-GOSISDBHSA-N 1 2 313.445 4.257 20 0 DIADLO CC(C)C[C@@H](C(=O)N[C@H](C)c1ccc(Cl)cc1)n1cc[nH+]c1 ZINC001556942375 1058671900 /nfs/dbraw/zinc/67/19/00/1058671900.db2.gz YVQJDHIWXUAJGT-CJNGLKHVSA-N 1 2 319.836 4.001 20 0 DIADLO CCC[C@H](CC)C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001520868339 1058703663 /nfs/dbraw/zinc/70/36/63/1058703663.db2.gz SKHIGGYUNMKPQQ-JKSUJKDBSA-N 1 2 319.493 4.170 20 0 DIADLO O=C(N[C@H](C1CCC1)C1CCCCC1)c1cc2c[nH+]ccc2[nH]1 ZINC001557174743 1058711313 /nfs/dbraw/zinc/71/13/13/1058711313.db2.gz JNGNFPKZYYMCDK-SFHVURJKSA-N 1 2 311.429 4.042 20 0 DIADLO Cc1cccc(Oc2cccc(NC(=O)CCc3c[nH]c[nH+]3)c2)c1 ZINC001558027009 1058830188 /nfs/dbraw/zinc/83/01/88/1058830188.db2.gz IMFMGHCIYVJFGI-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1cccc(Oc2cccc(NC(=O)CCc3c[nH+]c[nH]3)c2)c1 ZINC001558027009 1058830212 /nfs/dbraw/zinc/83/02/12/1058830212.db2.gz IMFMGHCIYVJFGI-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3CCCC[C@@H]3C)cc2)[nH+]c1C ZINC001558135427 1058841087 /nfs/dbraw/zinc/84/10/87/1058841087.db2.gz QQBONBVESZSASA-SJCJKPOMSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3cccc(C)c3)cc2)[nH+]c1C ZINC001558132977 1058841363 /nfs/dbraw/zinc/84/13/63/1058841363.db2.gz OIFVVRPWZRVMJR-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)CCCC2CCCC2)[nH+]c1C ZINC001558351898 1058860190 /nfs/dbraw/zinc/86/01/90/1058860190.db2.gz OBCOTBQFCZCXMZ-INIZCTEOSA-N 1 2 303.450 4.051 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)C[C@@H](C)C2CCCCC2)[nH+]c1C ZINC001558350993 1058860411 /nfs/dbraw/zinc/86/04/11/1058860411.db2.gz DPEOOJCFCOMILT-DYVFJYSZSA-N 1 2 317.477 4.297 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)[C@@H](C)[C@H](C)C(C)(C)C)[nH+]c1C ZINC001558353223 1058864113 /nfs/dbraw/zinc/86/41/13/1058864113.db2.gz PMTDNIBMYSYGOT-HUBLWGQQSA-N 1 2 305.466 4.008 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@H](C)c3cc(C)ccc3C)ccn12 ZINC001521471825 1058880842 /nfs/dbraw/zinc/88/08/42/1058880842.db2.gz IHAWGPMXWAEKGT-OAHLLOKOSA-N 1 2 308.381 4.178 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3ccc(C(C)(C)C)cc3C)ccn12 ZINC001529928814 1058886334 /nfs/dbraw/zinc/88/63/34/1058886334.db2.gz RLXQLHXUADIDDA-UHFFFAOYSA-N 1 2 322.408 4.468 20 0 DIADLO CC[N@@H+](c1ccc(Nc2nc(C3CC3)ns2)cc1)C(C)C ZINC001559063468 1058958260 /nfs/dbraw/zinc/95/82/60/1058958260.db2.gz VCTWKIYZGDCLRM-UHFFFAOYSA-N 1 2 302.447 4.394 20 0 DIADLO CC[N@H+](c1ccc(Nc2nc(C3CC3)ns2)cc1)C(C)C ZINC001559063468 1058958278 /nfs/dbraw/zinc/95/82/78/1058958278.db2.gz VCTWKIYZGDCLRM-UHFFFAOYSA-N 1 2 302.447 4.394 20 0 DIADLO CCc1nc(N(Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)cc(C)[nH+]1 ZINC001559067003 1058962958 /nfs/dbraw/zinc/96/29/58/1058962958.db2.gz SMARECDWHQMHEK-LRDDRELGSA-N 1 2 311.429 4.233 20 0 DIADLO Cc1cc(N(Cc2cccc(F)c2)C2CC2)nc(C2CCC2)[nH+]1 ZINC001559075152 1058969240 /nfs/dbraw/zinc/96/92/40/1058969240.db2.gz DJDBNHKOPXBIMI-UHFFFAOYSA-N 1 2 311.404 4.361 20 0 DIADLO CCc1cc(N2C[C@H](c3ccccc3C)C[C@H]2C)nc(CC)[nH+]1 ZINC001559114327 1059000027 /nfs/dbraw/zinc/00/00/27/1059000027.db2.gz PMUAODXQETZRHY-HZPDHXFCSA-N 1 2 309.457 4.292 20 0 DIADLO CO[C@H]1C[C@@H](N(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)C12CCC2 ZINC001559189893 1059074076 /nfs/dbraw/zinc/07/40/76/1059074076.db2.gz FFOHJMAROPUDHW-CVEARBPZSA-N 1 2 317.477 4.117 20 0 DIADLO Cc1nc(N2CC[C@@H]([C@H]3CCCC3(C)C)C2)c2c([nH+]1)CCCC2 ZINC001559220242 1059098471 /nfs/dbraw/zinc/09/84/71/1059098471.db2.gz SXJBKUDUXCTGFC-NVXWUHKLSA-N 1 2 313.489 4.316 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3cccc(C(C)(C)C)c3)ccn12 ZINC001530678930 1059113472 /nfs/dbraw/zinc/11/34/72/1059113472.db2.gz XNADHPMATUBWOT-UHFFFAOYSA-N 1 2 308.381 4.159 20 0 DIADLO CC(C)c1cc(NC[C@@H]2CCC(C)(C)CO2)nc(C(C)C)[nH+]1 ZINC001559268092 1059131406 /nfs/dbraw/zinc/13/14/06/1059131406.db2.gz QPKRAIOXDHBCSD-AWEZNQCLSA-N 1 2 305.466 4.341 20 0 DIADLO CC(C)c1cc(N[C@@H]2[C@H]3Cc4ccccc4[C@@H]23)nc(C(C)C)[nH+]1 ZINC001559283316 1059140166 /nfs/dbraw/zinc/14/01/66/1059140166.db2.gz FBHNIDBFEZHTMQ-KFKAGJAMSA-N 1 2 307.441 4.474 20 0 DIADLO CC(C)c1ccc2occ(C(=O)Nc3cccc4[nH+]ccn43)c2c1 ZINC001531287314 1059269697 /nfs/dbraw/zinc/26/96/97/1059269697.db2.gz YINKLUPFNRGZPE-UHFFFAOYSA-N 1 2 319.364 4.456 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CCc2cc(C(C)(C)C)ccc2C1 ZINC001559513261 1059305240 /nfs/dbraw/zinc/30/52/40/1059305240.db2.gz MATORNAPXQQYKU-HNNXBMFYSA-N 1 2 317.473 4.074 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CCc2cc(C(C)(C)C)ccc2C1 ZINC001559513261 1059305246 /nfs/dbraw/zinc/30/52/46/1059305246.db2.gz MATORNAPXQQYKU-HNNXBMFYSA-N 1 2 317.473 4.074 20 0 DIADLO COc1cccc(C[NH+]2Cc3ccccc3-c3ccccc3C2)n1 ZINC001559514432 1059310203 /nfs/dbraw/zinc/31/02/03/1059310203.db2.gz CIFDCSBJOGDOLE-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO CCCCc1ccc(-c2noc(CN(C)c3cccc[nH+]3)n2)cc1 ZINC001247197420 1059335037 /nfs/dbraw/zinc/33/50/37/1059335037.db2.gz NIXBSIDIFDBNKP-UHFFFAOYSA-N 1 2 322.412 4.111 20 0 DIADLO CC(C)c1nsc(C[N@@H+](C)[C@@H](c2ccccc2)C(C)C)n1 ZINC001559535391 1059335963 /nfs/dbraw/zinc/33/59/63/1059335963.db2.gz OMSDUEQBDXQQTR-MRXNPFEDSA-N 1 2 303.475 4.491 20 0 DIADLO CC(C)c1nsc(C[N@H+](C)[C@@H](c2ccccc2)C(C)C)n1 ZINC001559535391 1059335982 /nfs/dbraw/zinc/33/59/82/1059335982.db2.gz OMSDUEQBDXQQTR-MRXNPFEDSA-N 1 2 303.475 4.491 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@H](C)c2cccc(Br)c2)C[C@@H](C)O1 ZINC001559544789 1059348160 /nfs/dbraw/zinc/34/81/60/1059348160.db2.gz HMVNQVMUZURIAP-LALPHHSUSA-N 1 2 312.251 4.009 20 0 DIADLO CC[C@@H]1C[N@H+]([C@H](C)c2cccc(Br)c2)C[C@@H](C)O1 ZINC001559544789 1059348181 /nfs/dbraw/zinc/34/81/81/1059348181.db2.gz HMVNQVMUZURIAP-LALPHHSUSA-N 1 2 312.251 4.009 20 0 DIADLO CCCCc1ccc(-c2noc([C@H]3CCCc4[nH]c[nH+]c43)n2)cc1 ZINC001247272754 1059364356 /nfs/dbraw/zinc/36/43/56/1059364356.db2.gz NUFZVMFWXJMGCL-HNNXBMFYSA-N 1 2 322.412 4.271 20 0 DIADLO CC(C)c1ccc(-c2noc([C@H]3CCCc4[nH]c[nH+]c43)n2)cc1 ZINC001247273066 1059366926 /nfs/dbraw/zinc/36/69/26/1059366926.db2.gz RFLMZRQCJRHEBO-AWEZNQCLSA-N 1 2 308.385 4.051 20 0 DIADLO CCc1ccc(NC(=S)Nc2cccn3c(C)c(C)[nH+]c23)cc1 ZINC001247294804 1059373041 /nfs/dbraw/zinc/37/30/41/1059373041.db2.gz ZEYKLFNPRZLKKG-UHFFFAOYSA-N 1 2 324.453 4.322 20 0 DIADLO COc1cc(C)[nH+]c(CN2CC[C@@H](C)C[C@H]2c2ccc(C)o2)c1 ZINC001559569549 1059402331 /nfs/dbraw/zinc/40/23/31/1059402331.db2.gz BFIPYMHWNJVSAV-ACJLOTCBSA-N 1 2 314.429 4.273 20 0 DIADLO CC(C)C[C@@H]1CC[N@H+](Cc2c(F)c(F)c(F)c(F)c2F)C1 ZINC001559575538 1059408109 /nfs/dbraw/zinc/40/81/09/1059408109.db2.gz GRXZPTIOGCOPTB-VIFPVBQESA-N 1 2 307.306 4.250 20 0 DIADLO CC(C)C[C@@H]1CC[N@@H+](Cc2c(F)c(F)c(F)c(F)c2F)C1 ZINC001559575538 1059408126 /nfs/dbraw/zinc/40/81/26/1059408126.db2.gz GRXZPTIOGCOPTB-VIFPVBQESA-N 1 2 307.306 4.250 20 0 DIADLO CCC1(CC)CC[N@@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001559595333 1059429506 /nfs/dbraw/zinc/42/95/06/1059429506.db2.gz BUTVJWIQMFVRRD-OAHLLOKOSA-N 1 2 309.837 4.066 20 0 DIADLO CCC1(CC)CC[N@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001559595333 1059429526 /nfs/dbraw/zinc/42/95/26/1059429526.db2.gz BUTVJWIQMFVRRD-OAHLLOKOSA-N 1 2 309.837 4.066 20 0 DIADLO c1cn(-c2ccc(-c3noc(CCC4CCCCC4)n3)cc2)c[nH+]1 ZINC001247383440 1059429561 /nfs/dbraw/zinc/42/95/61/1059429561.db2.gz WZTGDQWNBZQXRM-UHFFFAOYSA-N 1 2 322.412 4.435 20 0 DIADLO c1cn(-c2ccccc2-c2noc(CC3CCCCC3)n2)c[nH+]1 ZINC001247384578 1059431739 /nfs/dbraw/zinc/43/17/39/1059431739.db2.gz UNOTWEDIDKVPIW-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO C[C@@H]1CCN(Cc2cc[nH+]c(N(C)C)c2)c2ccccc2S1 ZINC001559605777 1059440603 /nfs/dbraw/zinc/44/06/03/1059440603.db2.gz DJAAXPONFAAFFQ-CQSZACIVSA-N 1 2 313.470 4.039 20 0 DIADLO CC[C@@H](C)[C@H](C(=O)OC)[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001559659798 1059490839 /nfs/dbraw/zinc/49/08/39/1059490839.db2.gz AINNTENNTMHETQ-CXAGYDPISA-N 1 2 321.848 4.017 20 0 DIADLO CC[C@@H](C)[C@H](C(=O)OC)[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001559659798 1059490846 /nfs/dbraw/zinc/49/08/46/1059490846.db2.gz AINNTENNTMHETQ-CXAGYDPISA-N 1 2 321.848 4.017 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@H+]1Cc1ccnc(Cl)c1 ZINC001559658821 1059490894 /nfs/dbraw/zinc/49/08/94/1059490894.db2.gz SKVBENBWFCDCQM-NWDGAFQWSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@@H+]1Cc1ccnc(Cl)c1 ZINC001559658821 1059490900 /nfs/dbraw/zinc/49/09/00/1059490900.db2.gz SKVBENBWFCDCQM-NWDGAFQWSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@H]1COCCC[N@@H+]1Cc1nc2c(s1)C(C)(C)CC(C)(C)C2 ZINC001559662995 1059494201 /nfs/dbraw/zinc/49/42/01/1059494201.db2.gz PGHKMYSILJJOLP-ZDUSSCGKSA-N 1 2 322.518 4.004 20 0 DIADLO C[C@H]1COCCC[N@H+]1Cc1nc2c(s1)C(C)(C)CC(C)(C)C2 ZINC001559662995 1059494210 /nfs/dbraw/zinc/49/42/10/1059494210.db2.gz PGHKMYSILJJOLP-ZDUSSCGKSA-N 1 2 322.518 4.004 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC001559682860 1059511660 /nfs/dbraw/zinc/51/16/60/1059511660.db2.gz RVGDZWKPTSQFIK-CZUORRHYSA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC001559682860 1059511677 /nfs/dbraw/zinc/51/16/77/1059511677.db2.gz RVGDZWKPTSQFIK-CZUORRHYSA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)[C@H]([NH2+]Cc1cccc2ccccc21)C1CCCCC1 ZINC001559730293 1059561616 /nfs/dbraw/zinc/56/16/16/1059561616.db2.gz CNASCLBYKYIULX-LJQANCHMSA-N 1 2 311.425 4.051 20 0 DIADLO FCc1ccccc1C[N@@H+]1CCO[C@H](c2cccc(Cl)c2)C1 ZINC001559728940 1059563161 /nfs/dbraw/zinc/56/31/61/1059563161.db2.gz GXAWKEAQIOGBOK-SFHVURJKSA-N 1 2 319.807 4.383 20 0 DIADLO FCc1ccccc1C[N@H+]1CCO[C@H](c2cccc(Cl)c2)C1 ZINC001559728940 1059563178 /nfs/dbraw/zinc/56/31/78/1059563178.db2.gz GXAWKEAQIOGBOK-SFHVURJKSA-N 1 2 319.807 4.383 20 0 DIADLO CCCCc1ccc(-c2noc([C@H]([NH3+])c3ccccc3)n2)cc1 ZINC001247651097 1059585653 /nfs/dbraw/zinc/58/56/53/1059585653.db2.gz KSNWXOGVNMYOFZ-QGZVFWFLSA-N 1 2 307.397 4.127 20 0 DIADLO CCC1(CC)CC[NH+]([C@H](C(=O)OC)c2ccccc2Cl)CC1 ZINC001559763470 1059599624 /nfs/dbraw/zinc/59/96/24/1059599624.db2.gz KVHFOTMJRQLGJH-INIZCTEOSA-N 1 2 323.864 4.456 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@H]1CCCC[C@H]1C1CC1 ZINC001532353893 1059600648 /nfs/dbraw/zinc/60/06/48/1059600648.db2.gz VBVRVNQKALYYKS-ROUUACIJSA-N 1 2 309.413 4.027 20 0 DIADLO CCC1(CC)CC[NH+]([C@@H](C(=O)OC)c2ccccc2Cl)CC1 ZINC001559763471 1059600885 /nfs/dbraw/zinc/60/08/85/1059600885.db2.gz KVHFOTMJRQLGJH-MRXNPFEDSA-N 1 2 323.864 4.456 20 0 DIADLO C[C@@H]1CCCC[C@H]1c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001247733941 1059604944 /nfs/dbraw/zinc/60/49/44/1059604944.db2.gz HJMLQYSSWNJAON-CZUORRHYSA-N 1 2 308.385 4.216 20 0 DIADLO CCCC[C@H]([NH2+][C@@H]1CC(C)(C)CCc2ccccc21)C(=O)OC ZINC001559782367 1059619408 /nfs/dbraw/zinc/61/94/08/1059619408.db2.gz MFDDYJYMQLDJIX-ZWKOTPCHSA-N 1 2 317.473 4.412 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@@](F)(c3ccccc3C)C2)nc1Cl ZINC001559787053 1059622362 /nfs/dbraw/zinc/62/23/62/1059622362.db2.gz RORAHUQDCFTJEW-SFHVURJKSA-N 1 2 318.823 4.423 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@@](F)(c3ccccc3C)C2)nc1Cl ZINC001559787053 1059622371 /nfs/dbraw/zinc/62/23/71/1059622371.db2.gz RORAHUQDCFTJEW-SFHVURJKSA-N 1 2 318.823 4.423 20 0 DIADLO C[C@H]1C[N@H+](CCc2cccc(Cl)c2Cl)C[C@@H](C2CC2)O1 ZINC001559802217 1059638293 /nfs/dbraw/zinc/63/82/93/1059638293.db2.gz ULQZTRLHZLYRQL-NHYWBVRUSA-N 1 2 314.256 4.035 20 0 DIADLO C[C@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)C[C@@H](C2CC2)O1 ZINC001559802217 1059638302 /nfs/dbraw/zinc/63/83/02/1059638302.db2.gz ULQZTRLHZLYRQL-NHYWBVRUSA-N 1 2 314.256 4.035 20 0 DIADLO CC(C)c1cccc2c1CC[N@H+](Cc1nc3ccccc3[nH]1)C2 ZINC001559807747 1059644459 /nfs/dbraw/zinc/64/44/59/1059644459.db2.gz OOQRHEQHNJKVGG-UHFFFAOYSA-N 1 2 305.425 4.245 20 0 DIADLO CC(C)c1cccc2c1CC[N@@H+](Cc1nc3ccccc3[nH]1)C2 ZINC001559807747 1059644469 /nfs/dbraw/zinc/64/44/69/1059644469.db2.gz OOQRHEQHNJKVGG-UHFFFAOYSA-N 1 2 305.425 4.245 20 0 DIADLO Cc1ccc2c(c1)C[N@H+]([C@@H](C)c1cc(F)ccc1F)CCO2 ZINC001559826582 1059660541 /nfs/dbraw/zinc/66/05/41/1059660541.db2.gz QQMFQOKYHYMCJN-ZDUSSCGKSA-N 1 2 303.352 4.229 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+]([C@@H](C)c1cc(F)ccc1F)CCO2 ZINC001559826582 1059660566 /nfs/dbraw/zinc/66/05/66/1059660566.db2.gz QQMFQOKYHYMCJN-ZDUSSCGKSA-N 1 2 303.352 4.229 20 0 DIADLO CC1(C)C(c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)C1(C)C ZINC001247983992 1059667358 /nfs/dbraw/zinc/66/73/58/1059667358.db2.gz HXGDRADWIFZGBA-UHFFFAOYSA-N 1 2 308.385 4.072 20 0 DIADLO C[C@@H](c1nc2ccc(Cl)cc2[nH]1)[N@H+](C)CCOCC1CCC1 ZINC001559846479 1059673812 /nfs/dbraw/zinc/67/38/12/1059673812.db2.gz IBIWOGRTGNRPSE-LBPRGKRZSA-N 1 2 321.852 4.026 20 0 DIADLO C[C@@H](c1nc2ccc(Cl)cc2[nH]1)[N@@H+](C)CCOCC1CCC1 ZINC001559846479 1059673824 /nfs/dbraw/zinc/67/38/24/1059673824.db2.gz IBIWOGRTGNRPSE-LBPRGKRZSA-N 1 2 321.852 4.026 20 0 DIADLO Clc1cc(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)c(Cl)s1 ZINC001559862148 1059682976 /nfs/dbraw/zinc/68/29/76/1059682976.db2.gz HHOGEVXLMBXWBU-LBPRGKRZSA-N 1 2 320.285 4.303 20 0 DIADLO Clc1cc(C[N@H+]2CCOC[C@@H](C3CCC3)C2)c(Cl)s1 ZINC001559862148 1059682984 /nfs/dbraw/zinc/68/29/84/1059682984.db2.gz HHOGEVXLMBXWBU-LBPRGKRZSA-N 1 2 320.285 4.303 20 0 DIADLO C[C@H]1CC(C)(C)C[N@@H+]1Cc1c(F)ccc(Br)c1F ZINC001559913144 1059729120 /nfs/dbraw/zinc/72/91/20/1059729120.db2.gz HEFWOAFBTVVWIY-VIFPVBQESA-N 1 2 318.205 4.348 20 0 DIADLO C[C@H]1CC(C)(C)C[N@H+]1Cc1c(F)ccc(Br)c1F ZINC001559913144 1059729134 /nfs/dbraw/zinc/72/91/34/1059729134.db2.gz HEFWOAFBTVVWIY-VIFPVBQESA-N 1 2 318.205 4.348 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2)[C@H]1C(=O)OC(C)(C)C ZINC001559929603 1059741219 /nfs/dbraw/zinc/74/12/19/1059741219.db2.gz OJHSKCWCSGZEDN-XJKSGUPXSA-N 1 2 323.864 4.282 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2)[C@H]1C(=O)OC(C)(C)C ZINC001559929603 1059741232 /nfs/dbraw/zinc/74/12/32/1059741232.db2.gz OJHSKCWCSGZEDN-XJKSGUPXSA-N 1 2 323.864 4.282 20 0 DIADLO CC[C@@H]1C[N@H+](CCc2c(Cl)cccc2Cl)[C@@H](CC)CO1 ZINC001559973024 1059779178 /nfs/dbraw/zinc/77/91/78/1059779178.db2.gz CFEBKHAMPAVKKQ-QWHCGFSZSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)[C@@H](CC)CO1 ZINC001559973024 1059779198 /nfs/dbraw/zinc/77/91/98/1059779198.db2.gz CFEBKHAMPAVKKQ-QWHCGFSZSA-N 1 2 316.272 4.425 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@@H+](Cc1ccc(Cl)cn1)CC2 ZINC001559979923 1059784281 /nfs/dbraw/zinc/78/42/81/1059784281.db2.gz OQTWDCDVSROINJ-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@H+](Cc1ccc(Cl)cn1)CC2 ZINC001559979923 1059784298 /nfs/dbraw/zinc/78/42/98/1059784298.db2.gz OQTWDCDVSROINJ-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC001560013818 1059820928 /nfs/dbraw/zinc/82/09/28/1059820928.db2.gz DISLOWNSAVQTLJ-UEKVPHQBSA-N 1 2 303.780 4.146 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC001560013818 1059820950 /nfs/dbraw/zinc/82/09/50/1059820950.db2.gz DISLOWNSAVQTLJ-UEKVPHQBSA-N 1 2 303.780 4.146 20 0 DIADLO Cc1cccc2[nH]c(Nc3cccc(Cn4cc[nH+]c4)c3)cc21 ZINC001248437846 1059831582 /nfs/dbraw/zinc/83/15/82/1059831582.db2.gz YGQBDKRWGVOUDM-UHFFFAOYSA-N 1 2 302.381 4.465 20 0 DIADLO Fc1ccc2c(c1)OCC[N@@H+](C/C=C/c1ccc(Cl)cc1)C2 ZINC001560041859 1059857441 /nfs/dbraw/zinc/85/74/41/1059857441.db2.gz YEACVQCSLLCACU-OWOJBTEDSA-N 1 2 317.791 4.387 20 0 DIADLO Fc1ccc2c(c1)OCC[N@H+](C/C=C/c1ccc(Cl)cc1)C2 ZINC001560041859 1059857463 /nfs/dbraw/zinc/85/74/63/1059857463.db2.gz YEACVQCSLLCACU-OWOJBTEDSA-N 1 2 317.791 4.387 20 0 DIADLO CCC(C)(C)c1ccc(NC(=O)c2cccc3[nH+]ccn32)cc1 ZINC001525382617 1059860128 /nfs/dbraw/zinc/86/01/28/1059860128.db2.gz GIVYLOFVCVMMGC-UHFFFAOYSA-N 1 2 307.397 4.274 20 0 DIADLO Cc1conc1C[N@H+]1CC=C(c2ccc(Cl)cc2C)CC1 ZINC001560049688 1059860557 /nfs/dbraw/zinc/86/05/57/1059860557.db2.gz NPZZJOUQLZLYDR-UHFFFAOYSA-N 1 2 302.805 4.234 20 0 DIADLO Cc1conc1C[N@@H+]1CC=C(c2ccc(Cl)cc2C)CC1 ZINC001560049688 1059860582 /nfs/dbraw/zinc/86/05/82/1059860582.db2.gz NPZZJOUQLZLYDR-UHFFFAOYSA-N 1 2 302.805 4.234 20 0 DIADLO C[N@H+](Cc1ccno1)Cc1cccc(-c2ccc(Cl)cc2)n1 ZINC001248520216 1059862379 /nfs/dbraw/zinc/86/23/79/1059862379.db2.gz MFBZFFAFTJJDLD-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1ccno1)Cc1cccc(-c2ccc(Cl)cc2)n1 ZINC001248520216 1059862407 /nfs/dbraw/zinc/86/24/07/1059862407.db2.gz MFBZFFAFTJJDLD-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO Fc1ccc2occc2c1C[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001248539697 1059873563 /nfs/dbraw/zinc/87/35/63/1059873563.db2.gz UCTXXPPQPMCEGZ-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccc2occc2c1C[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001248539697 1059873587 /nfs/dbraw/zinc/87/35/87/1059873587.db2.gz UCTXXPPQPMCEGZ-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@H+]([C@H](C)c1ccc(F)nc1)CC2 ZINC001560089575 1059900157 /nfs/dbraw/zinc/90/01/57/1059900157.db2.gz OVDITIJGINYKPR-GFCCVEGCSA-N 1 2 304.796 4.302 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@@H+]([C@H](C)c1ccc(F)nc1)CC2 ZINC001560089575 1059900173 /nfs/dbraw/zinc/90/01/73/1059900173.db2.gz OVDITIJGINYKPR-GFCCVEGCSA-N 1 2 304.796 4.302 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(Cl)cc1Cl)c1cc2cnccc2o1 ZINC001560094248 1059904063 /nfs/dbraw/zinc/90/40/63/1059904063.db2.gz QGDHPTSXKARPSW-VIFPVBQESA-N 1 2 322.195 4.380 20 0 DIADLO Cc1cccc(Br)c1C[N@H+](C)Cc1cccnc1C ZINC001248624303 1059917460 /nfs/dbraw/zinc/91/74/60/1059917460.db2.gz MYBRRTSNZQGNSB-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cccc(Br)c1C[N@@H+](C)Cc1cccnc1C ZINC001248624303 1059917480 /nfs/dbraw/zinc/91/74/80/1059917480.db2.gz MYBRRTSNZQGNSB-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO CCCO[C@H]1CC[N@H+](Cc2ccc(Cl)c(Cl)c2OC)C1 ZINC001248637702 1059920598 /nfs/dbraw/zinc/92/05/98/1059920598.db2.gz WNQPVAQOPZXRTP-LBPRGKRZSA-N 1 2 318.244 4.003 20 0 DIADLO CCCO[C@H]1CC[N@@H+](Cc2ccc(Cl)c(Cl)c2OC)C1 ZINC001248637702 1059920614 /nfs/dbraw/zinc/92/06/14/1059920614.db2.gz WNQPVAQOPZXRTP-LBPRGKRZSA-N 1 2 318.244 4.003 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3ccsc3[C@H]2C)nc2ccccc12 ZINC001560113013 1059922263 /nfs/dbraw/zinc/92/22/63/1059922263.db2.gz VSXXUFRYZMHQCM-CYBMUJFWSA-N 1 2 309.438 4.119 20 0 DIADLO Cc1nc(C[N@H+]2CCc3ccsc3[C@H]2C)nc2ccccc12 ZINC001560113013 1059922286 /nfs/dbraw/zinc/92/22/86/1059922286.db2.gz VSXXUFRYZMHQCM-CYBMUJFWSA-N 1 2 309.438 4.119 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@H+]1Cc2c[nH]nc2C[C@H](C)C1 ZINC001560143440 1059944525 /nfs/dbraw/zinc/94/45/25/1059944525.db2.gz BAIDKMZZUXKMOV-WDEREUQCSA-N 1 2 324.255 4.472 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@@H+]1Cc2c[nH]nc2C[C@H](C)C1 ZINC001560143440 1059944541 /nfs/dbraw/zinc/94/45/41/1059944541.db2.gz BAIDKMZZUXKMOV-WDEREUQCSA-N 1 2 324.255 4.472 20 0 DIADLO C/C(=C/c1cccc(Cl)c1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001533645831 1059957013 /nfs/dbraw/zinc/95/70/13/1059957013.db2.gz RLDLENLZKPXVHV-XFXZXTDPSA-N 1 2 311.772 4.030 20 0 DIADLO C[C@H]1C[N@H+](Cc2ncc(C(F)(F)F)cc2F)Cc2ccccc21 ZINC001248786772 1059974824 /nfs/dbraw/zinc/97/48/24/1059974824.db2.gz DNUKHGLJRDDCOB-NSHDSACASA-N 1 2 324.321 4.359 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ncc(C(F)(F)F)cc2F)Cc2ccccc21 ZINC001248786772 1059974842 /nfs/dbraw/zinc/97/48/42/1059974842.db2.gz DNUKHGLJRDDCOB-NSHDSACASA-N 1 2 324.321 4.359 20 0 DIADLO COc1nccc(Cl)c1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001248795204 1059979070 /nfs/dbraw/zinc/97/90/70/1059979070.db2.gz UQGMPBMYDMBIFY-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1nccc(Cl)c1C[N@@H+]1CC=C(c2ccccc2)CC1 ZINC001248795204 1059979094 /nfs/dbraw/zinc/97/90/94/1059979094.db2.gz UQGMPBMYDMBIFY-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1nccc(Cl)c1C[N@H+](Cc1ccccc1)C(C)C ZINC001248791436 1059979611 /nfs/dbraw/zinc/97/96/11/1059979611.db2.gz FQTIOELNIHEULC-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO COc1nccc(Cl)c1C[N@@H+](Cc1ccccc1)C(C)C ZINC001248791436 1059979624 /nfs/dbraw/zinc/97/96/24/1059979624.db2.gz FQTIOELNIHEULC-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO CC1(C)C[NH+](Cc2cnc3ccccc3c2Cl)CC(C)(C)O1 ZINC001248813912 1059992906 /nfs/dbraw/zinc/99/29/06/1059992906.db2.gz QIQTYYJOKWRPKI-UHFFFAOYSA-N 1 2 318.848 4.278 20 0 DIADLO Cc1ncccc1C[N@@H+](C)Cc1cnc2ccccc2c1Cl ZINC001248813680 1059993412 /nfs/dbraw/zinc/99/34/12/1059993412.db2.gz HWPIXQCLBJDUSK-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO Cc1ncccc1C[N@H+](C)Cc1cnc2ccccc2c1Cl ZINC001248813680 1059993444 /nfs/dbraw/zinc/99/34/44/1059993444.db2.gz HWPIXQCLBJDUSK-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO C[N@H+](Cc1ccc2n1CCC2)Cc1cccc(Cl)c1Cl ZINC001248823893 1060002159 /nfs/dbraw/zinc/00/21/59/1060002159.db2.gz PIXWETGQKAAVGM-UHFFFAOYSA-N 1 2 309.240 4.373 20 0 DIADLO C[N@@H+](Cc1ccc2n1CCC2)Cc1cccc(Cl)c1Cl ZINC001248823893 1060002181 /nfs/dbraw/zinc/00/21/81/1060002181.db2.gz PIXWETGQKAAVGM-UHFFFAOYSA-N 1 2 309.240 4.373 20 0 DIADLO CC(C)(C)[C@@H]1CC[N@H+](Cc2ncc(-c3cccs3)o2)CCO1 ZINC001560235704 1060005393 /nfs/dbraw/zinc/00/53/93/1060005393.db2.gz SUWFPTNLEQWATH-HNNXBMFYSA-N 1 2 320.458 4.040 20 0 DIADLO CC(C)(C)[C@@H]1CC[N@@H+](Cc2ncc(-c3cccs3)o2)CCO1 ZINC001560235704 1060005410 /nfs/dbraw/zinc/00/54/10/1060005410.db2.gz SUWFPTNLEQWATH-HNNXBMFYSA-N 1 2 320.458 4.040 20 0 DIADLO CC[N@H+](Cc1ccnc(SC(C)C)n1)Cc1ccccc1F ZINC001248833289 1060009862 /nfs/dbraw/zinc/00/98/62/1060009862.db2.gz ZAKRNMXYGDRKCN-UHFFFAOYSA-N 1 2 319.449 4.138 20 0 DIADLO CC[N@@H+](Cc1ccnc(SC(C)C)n1)Cc1ccccc1F ZINC001248833289 1060009882 /nfs/dbraw/zinc/00/98/82/1060009882.db2.gz ZAKRNMXYGDRKCN-UHFFFAOYSA-N 1 2 319.449 4.138 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1nc2cc(C)ccc2[nH]1 ZINC001248842555 1060017391 /nfs/dbraw/zinc/01/73/91/1060017391.db2.gz ZMXJCTMCNJKXTB-SFHVURJKSA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1nc2cc(C)ccc2[nH]1 ZINC001248842555 1060017414 /nfs/dbraw/zinc/01/74/14/1060017414.db2.gz ZMXJCTMCNJKXTB-SFHVURJKSA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1nc2ccc(C)cc2[nH]1 ZINC001248842555 1060017432 /nfs/dbraw/zinc/01/74/32/1060017432.db2.gz ZMXJCTMCNJKXTB-SFHVURJKSA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1nc2ccc(C)cc2[nH]1 ZINC001248842555 1060017457 /nfs/dbraw/zinc/01/74/57/1060017457.db2.gz ZMXJCTMCNJKXTB-SFHVURJKSA-N 1 2 321.424 4.217 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2coc(-c3ccc(F)cc3)n2)C1 ZINC001248853166 1060020401 /nfs/dbraw/zinc/02/04/01/1060020401.db2.gz OAZUXIQBCQPPHY-KRWDZBQOSA-N 1 2 306.356 4.195 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2coc(-c3ccc(F)cc3)n2)C1 ZINC001248853166 1060020417 /nfs/dbraw/zinc/02/04/17/1060020417.db2.gz OAZUXIQBCQPPHY-KRWDZBQOSA-N 1 2 306.356 4.195 20 0 DIADLO CCC1CC[NH+](Cc2nc3cccc(Br)c3o2)CC1 ZINC001248848837 1060024003 /nfs/dbraw/zinc/02/40/03/1060024003.db2.gz QIMYXVPERZXGMY-UHFFFAOYSA-N 1 2 323.234 4.212 20 0 DIADLO CCC[C@@H](C)C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001525783100 1060029841 /nfs/dbraw/zinc/02/98/41/1060029841.db2.gz INBISGXKGAMJLB-CQSZACIVSA-N 1 2 312.413 4.228 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)c(C)n2)cn1 ZINC001248877023 1060033165 /nfs/dbraw/zinc/03/31/65/1060033165.db2.gz ZQVVMFDJBRYMDK-QGZVFWFLSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)c(C)n2)cn1 ZINC001248877023 1060033186 /nfs/dbraw/zinc/03/31/86/1060033186.db2.gz ZQVVMFDJBRYMDK-QGZVFWFLSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NC/C=C/c1ccc(F)c(F)c1 ZINC001560277307 1060053986 /nfs/dbraw/zinc/05/39/86/1060053986.db2.gz OXXLLLNMUHTMRO-SNAWJCMRSA-N 1 2 302.368 4.465 20 0 DIADLO CC[C@@H](C(=O)NCc1cc(C)[nH+]c(C)c1)C1CCC(C)CC1 ZINC001525865248 1060058799 /nfs/dbraw/zinc/05/87/99/1060058799.db2.gz PPMPRCKFODEBOS-ZTUNLMCQSA-N 1 2 302.462 4.167 20 0 DIADLO CCC1(CC)C[C@H]1c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001248946483 1060074285 /nfs/dbraw/zinc/07/42/85/1060074285.db2.gz BLPRGUIDPBHJKU-HNNXBMFYSA-N 1 2 308.385 4.216 20 0 DIADLO CC1(C)CCCC[C@@H]1CC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001533989006 1060097461 /nfs/dbraw/zinc/09/74/61/1060097461.db2.gz XTAFSLQXEPOAAA-OAHLLOKOSA-N 1 2 311.429 4.417 20 0 DIADLO [NH3+][C@@H](c1nc(-c2ccc(Cl)cc2)no1)c1ccc(Cl)cc1 ZINC001248997382 1060102744 /nfs/dbraw/zinc/10/27/44/1060102744.db2.gz GOLZLUGKLNWOGK-CYBMUJFWSA-N 1 2 320.179 4.092 20 0 DIADLO [NH3+][C@H](c1nc(-c2cccc(Cl)c2)no1)c1ccc(Cl)cc1 ZINC001248997953 1060102802 /nfs/dbraw/zinc/10/28/02/1060102802.db2.gz FGICYRZJEKTCCK-ZDUSSCGKSA-N 1 2 320.179 4.092 20 0 DIADLO CCc1cccc(-c2noc([C@@H]([NH3+])c3ccc(Cl)cc3)n2)c1 ZINC001248998003 1060103195 /nfs/dbraw/zinc/10/31/95/1060103195.db2.gz GYNJFFPOENTGBB-HNNXBMFYSA-N 1 2 313.788 4.001 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c(Cl)nc1C ZINC001249020216 1060111426 /nfs/dbraw/zinc/11/14/26/1060111426.db2.gz UWNBTWVIMVVUAA-LBPRGKRZSA-N 1 2 306.759 4.126 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)c(Cl)nc1C ZINC001249020216 1060111437 /nfs/dbraw/zinc/11/14/37/1060111437.db2.gz UWNBTWVIMVVUAA-LBPRGKRZSA-N 1 2 306.759 4.126 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1cc(C)co1)c1ccccc1 ZINC001560325906 1060112147 /nfs/dbraw/zinc/11/21/47/1060112147.db2.gz COZCSURHLHTQFT-HXUWFJFHSA-N 1 2 307.393 4.476 20 0 DIADLO C[C@H]1CC[N@H+](Cc2sc(Cl)c3ccccc32)CCC1=O ZINC001249051307 1060130832 /nfs/dbraw/zinc/13/08/32/1060130832.db2.gz PLVYCQUVUFSHSB-NSHDSACASA-N 1 2 307.846 4.356 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2sc(Cl)c3ccccc32)CCC1=O ZINC001249051307 1060130843 /nfs/dbraw/zinc/13/08/43/1060130843.db2.gz PLVYCQUVUFSHSB-NSHDSACASA-N 1 2 307.846 4.356 20 0 DIADLO CC1(C)C[N@H+](Cc2sc(Cl)c3ccccc32)CCC1=O ZINC001249067151 1060143655 /nfs/dbraw/zinc/14/36/55/1060143655.db2.gz JDOTVKJKDYZVKY-UHFFFAOYSA-N 1 2 307.846 4.356 20 0 DIADLO CC1(C)C[N@@H+](Cc2sc(Cl)c3ccccc32)CCC1=O ZINC001249067151 1060143666 /nfs/dbraw/zinc/14/36/66/1060143666.db2.gz JDOTVKJKDYZVKY-UHFFFAOYSA-N 1 2 307.846 4.356 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1cccc(C2CC2)c1 ZINC001526168725 1060151046 /nfs/dbraw/zinc/15/10/46/1060151046.db2.gz RLZKDGPPMKXEIQ-UHFFFAOYSA-N 1 2 321.355 4.141 20 0 DIADLO CC(C)c1ccc(-c2noc([C@H]3[NH2+]Cc4ccccc43)n2)cc1 ZINC001249133626 1060168762 /nfs/dbraw/zinc/16/87/62/1060168762.db2.gz UGIPCKBCELAMDA-KRWDZBQOSA-N 1 2 305.381 4.053 20 0 DIADLO CCCCc1ccc(-c2noc([C@@H]3[NH2+]Cc4ccccc43)n2)cc1 ZINC001249132815 1060169090 /nfs/dbraw/zinc/16/90/90/1060169090.db2.gz LEWXKYZJPVTXNL-GOSISDBHSA-N 1 2 319.408 4.272 20 0 DIADLO c1cc2cc(-c3noc([C@H]4[NH2+]Cc5ccccc54)n3)ccc2s1 ZINC001249131412 1060169454 /nfs/dbraw/zinc/16/94/54/1060169454.db2.gz BMATUSLOYWYZTQ-INIZCTEOSA-N 1 2 319.389 4.144 20 0 DIADLO C[C@H](CCc1ccccc1)C[NH2+]c1ccc2c(c1)N(C)CCO2 ZINC001560389859 1060177311 /nfs/dbraw/zinc/17/73/11/1060177311.db2.gz SCXXWWNPVCFUHJ-MRXNPFEDSA-N 1 2 310.441 4.196 20 0 DIADLO C[C@H]1Cc2cc(CNc3ccc(N4CCCCC4)[nH+]c3)ccc2O1 ZINC001560407229 1060192257 /nfs/dbraw/zinc/19/22/57/1060192257.db2.gz NNPJXMJMTUFJQN-HNNXBMFYSA-N 1 2 323.440 4.007 20 0 DIADLO C[C@@H]1Cc2cc(CNc3ccc(N4CCCCC4)[nH+]c3)ccc2O1 ZINC001560407230 1060192799 /nfs/dbraw/zinc/19/27/99/1060192799.db2.gz NNPJXMJMTUFJQN-OAHLLOKOSA-N 1 2 323.440 4.007 20 0 DIADLO Cc1ccc(F)cc1-c1noc([C@@H]2CC[N@@H+]2Cc2ccccc2)n1 ZINC001249256195 1060205538 /nfs/dbraw/zinc/20/55/38/1060205538.db2.gz PMCQTXBYVWCDCC-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc(F)cc1-c1noc([C@@H]2CC[N@H+]2Cc2ccccc2)n1 ZINC001249256195 1060205553 /nfs/dbraw/zinc/20/55/53/1060205553.db2.gz PMCQTXBYVWCDCC-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1csc(-c3ccncc3)n1)CC2 ZINC001249263553 1060206959 /nfs/dbraw/zinc/20/69/59/1060206959.db2.gz NJXAXSJZFPRQCQ-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1csc(-c3ccncc3)n1)CC2 ZINC001249263553 1060206969 /nfs/dbraw/zinc/20/69/69/1060206969.db2.gz NJXAXSJZFPRQCQ-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO C[N@H+](Cc1coc(-c2ccc(Cl)cc2)n1)C1CC(F)(F)C1 ZINC001249365825 1060225204 /nfs/dbraw/zinc/22/52/04/1060225204.db2.gz XXMNFDYLQSJALY-UHFFFAOYSA-N 1 2 312.747 4.225 20 0 DIADLO C[N@@H+](Cc1coc(-c2ccc(Cl)cc2)n1)C1CC(F)(F)C1 ZINC001249365825 1060225225 /nfs/dbraw/zinc/22/52/25/1060225225.db2.gz XXMNFDYLQSJALY-UHFFFAOYSA-N 1 2 312.747 4.225 20 0 DIADLO Cc1ccc(C[NH2+][C@@H]2COc3cc(F)cc(F)c32)c(Cl)c1 ZINC001560437220 1060225659 /nfs/dbraw/zinc/22/56/59/1060225659.db2.gz HVZUVVVAVXCKPV-CQSZACIVSA-N 1 2 309.743 4.150 20 0 DIADLO CC(C)(C)OC(=O)Nc1cccc(F)c1C[NH+]1CC(C)(C)C1 ZINC001249382570 1060231638 /nfs/dbraw/zinc/23/16/38/1060231638.db2.gz UNKDDUHEQRBIEX-UHFFFAOYSA-N 1 2 308.397 4.015 20 0 DIADLO COc1ccc2nc(C[N@@H+]3CCC[C@@H]3c3ccccc3C)[nH]c2c1 ZINC001249412335 1060242639 /nfs/dbraw/zinc/24/26/39/1060242639.db2.gz DLSPQDJKBMZPCP-LJQANCHMSA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccc2nc(C[N@H+]3CCC[C@@H]3c3ccccc3C)[nH]c2c1 ZINC001249412335 1060242660 /nfs/dbraw/zinc/24/26/60/1060242660.db2.gz DLSPQDJKBMZPCP-LJQANCHMSA-N 1 2 321.424 4.217 20 0 DIADLO CC(C)c1nc(C[N@H+](C)Cc2cccc3c2CCC3)cs1 ZINC001249458605 1060257828 /nfs/dbraw/zinc/25/78/28/1060257828.db2.gz FTPXIVDVLCUJJU-UHFFFAOYSA-N 1 2 300.471 4.387 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)Cc2cccc3c2CCC3)cs1 ZINC001249458605 1060257849 /nfs/dbraw/zinc/25/78/49/1060257849.db2.gz FTPXIVDVLCUJJU-UHFFFAOYSA-N 1 2 300.471 4.387 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+]2CC[C@H]2c2ccccc2)cn1 ZINC001249514999 1060272174 /nfs/dbraw/zinc/27/21/74/1060272174.db2.gz IHDWOPLJELZBQX-INIZCTEOSA-N 1 2 306.331 4.356 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+]2CC[C@H]2c2ccccc2)cn1 ZINC001249514999 1060272191 /nfs/dbraw/zinc/27/21/91/1060272191.db2.gz IHDWOPLJELZBQX-INIZCTEOSA-N 1 2 306.331 4.356 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1cnc(C)cc1C(F)(F)F)C2 ZINC001249516554 1060273211 /nfs/dbraw/zinc/27/32/11/1060273211.db2.gz WCEWJIIXOZVXAT-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1cnc(C)cc1C(F)(F)F)C2 ZINC001249516554 1060273234 /nfs/dbraw/zinc/27/32/34/1060273234.db2.gz WCEWJIIXOZVXAT-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO C/C(=C/C1CCC(C)CC1)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001534566190 1060303633 /nfs/dbraw/zinc/30/36/33/1060303633.db2.gz UTYONNVVRMLYFX-OWBHPGMISA-N 1 2 315.461 4.167 20 0 DIADLO Cc1ccc(NC(=O)c2cccc(C3CCCC3)c2)c(N(C)C)[nH+]1 ZINC001534566322 1060304583 /nfs/dbraw/zinc/30/45/83/1060304583.db2.gz WTFQEKIHTMFVHK-UHFFFAOYSA-N 1 2 323.440 4.366 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccc2ccnc(Cl)c2c1 ZINC001560510069 1060305920 /nfs/dbraw/zinc/30/59/20/1060305920.db2.gz CZORSKFSFBDLOO-UHFFFAOYSA-N 1 2 300.793 4.107 20 0 DIADLO CCOc1ccc(NCc2cc(-n3cc[nH+]c3)cs2)c(F)c1 ZINC001560509200 1060306522 /nfs/dbraw/zinc/30/65/22/1060306522.db2.gz ULKNKSZWZQLZNI-UHFFFAOYSA-N 1 2 317.389 4.084 20 0 DIADLO Oc1ccc(Cl)c(Nc2cc[nH+]cc2C(F)(F)F)c1Cl ZINC001249594101 1060309834 /nfs/dbraw/zinc/30/98/34/1060309834.db2.gz WLWLISHBOLBPKV-UHFFFAOYSA-N 1 2 323.101 4.278 20 0 DIADLO CC[C@@H](Oc1cccc(C)c1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001526806590 1060343511 /nfs/dbraw/zinc/34/35/11/1060343511.db2.gz ZJGMFAWIXCXZBP-QGZVFWFLSA-N 1 2 312.413 4.111 20 0 DIADLO Cc1cn2c(cccc2Nc2cccc(Br)c2F)[nH+]1 ZINC001249686111 1060347694 /nfs/dbraw/zinc/34/76/94/1060347694.db2.gz SXVXOENDTQHZLW-UHFFFAOYSA-N 1 2 320.165 4.288 20 0 DIADLO CCCN(C)c1ccccc1NCc1c[nH+]c2c(C)cccn12 ZINC001560550812 1060361040 /nfs/dbraw/zinc/36/10/40/1060361040.db2.gz JOEQWANTBYRVNT-UHFFFAOYSA-N 1 2 308.429 4.101 20 0 DIADLO Nc1ccc(Nc2ccc[nH+]c2N2CCCCC2)c(Cl)c1 ZINC001249729479 1060376219 /nfs/dbraw/zinc/37/62/19/1060376219.db2.gz LWRZIEJWRMLXEI-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO Cc1ccc2[nH+]c(NCc3cnc(-c4ccncc4)s3)[nH]c2c1 ZINC001560569913 1060381544 /nfs/dbraw/zinc/38/15/44/1060381544.db2.gz NNZHWLWBHBSKHH-UHFFFAOYSA-N 1 2 321.409 4.002 20 0 DIADLO Cc1ccc2[nH+]c(NCc3c(Cl)cncc3Cl)[nH]c2c1 ZINC001560569948 1060381990 /nfs/dbraw/zinc/38/19/90/1060381990.db2.gz PCXNERJLSVZJSE-UHFFFAOYSA-N 1 2 307.184 4.185 20 0 DIADLO Cc1cc(NCc2c(Cl)nc3cc(Cl)ccn32)c[nH+]c1C ZINC001560571197 1060385496 /nfs/dbraw/zinc/38/54/96/1060385496.db2.gz JWOUEPKWVLCXSH-UHFFFAOYSA-N 1 2 321.211 4.265 20 0 DIADLO COc1cccc2[nH]c(NCc3cccc4ccccc43)[nH+]c21 ZINC001560576881 1060391023 /nfs/dbraw/zinc/39/10/23/1060391023.db2.gz NGXUCIHLPZDMAD-UHFFFAOYSA-N 1 2 303.365 4.337 20 0 DIADLO Cc1cc(C)c2cc(NCc3cc4c(cc[nH]c4=O)o3)ccc2[nH+]1 ZINC001560589978 1060402426 /nfs/dbraw/zinc/40/24/26/1060402426.db2.gz JVDCJJNGMLEOKB-UHFFFAOYSA-N 1 2 319.364 4.311 20 0 DIADLO COc1cc(C[N@@H+]2CCCCC23CC3)c(F)c(F)c1Cl ZINC001249800683 1060407053 /nfs/dbraw/zinc/40/70/53/1060407053.db2.gz BKBYYRBEWYTCHJ-UHFFFAOYSA-N 1 2 301.764 4.145 20 0 DIADLO COc1cc(C[N@H+]2CCCCC23CC3)c(F)c(F)c1Cl ZINC001249800683 1060407058 /nfs/dbraw/zinc/40/70/58/1060407058.db2.gz BKBYYRBEWYTCHJ-UHFFFAOYSA-N 1 2 301.764 4.145 20 0 DIADLO Fc1ccc2[nH]c(Nc3ccc(N4CCCCC4)[nH+]c3)cc2c1 ZINC001249850182 1060420456 /nfs/dbraw/zinc/42/04/56/1060420456.db2.gz TXBUPDWOTZZVCZ-UHFFFAOYSA-N 1 2 310.376 4.436 20 0 DIADLO Cc1cccnc1[C@H](C)[NH2+]Cc1ccsc1Br ZINC001560618877 1060432515 /nfs/dbraw/zinc/43/25/15/1060432515.db2.gz ZIGNLPBRCVTWAQ-JTQLQIEISA-N 1 2 311.248 4.065 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1ccc(F)cc1F ZINC001560621594 1060433102 /nfs/dbraw/zinc/43/31/02/1060433102.db2.gz SAXDMYZCZRNMRN-UHFFFAOYSA-N 1 2 307.731 4.117 20 0 DIADLO COC(=O)c1ccc2[nH]c(Nc3cccc4cc[nH+]cc43)cc2c1 ZINC001249869206 1060434176 /nfs/dbraw/zinc/43/41/76/1060434176.db2.gz HKBMADWGCUIHPL-UHFFFAOYSA-N 1 2 317.348 4.246 20 0 DIADLO CCOc1ccccc1CNc1[nH+]c2cc(F)ccc2n1CC ZINC001560623511 1060434332 /nfs/dbraw/zinc/43/43/32/1060434332.db2.gz ZNAYQBQIUHXROI-UHFFFAOYSA-N 1 2 313.376 4.206 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@@H]2CCC[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC001527119018 1060440718 /nfs/dbraw/zinc/44/07/18/1060440718.db2.gz UXRKPBPZQWPBQR-RBUKOAKNSA-N 1 2 322.452 4.321 20 0 DIADLO Cn1cc(C[N@H+](C)C2c3ccccc3-c3ccccc32)c(Cl)n1 ZINC001560638085 1060454727 /nfs/dbraw/zinc/45/47/27/1060454727.db2.gz ZITAFLYJXJJUGP-UHFFFAOYSA-N 1 2 323.827 4.275 20 0 DIADLO Cn1cc(C[N@@H+](C)C2c3ccccc3-c3ccccc32)c(Cl)n1 ZINC001560638085 1060454743 /nfs/dbraw/zinc/45/47/43/1060454743.db2.gz ZITAFLYJXJJUGP-UHFFFAOYSA-N 1 2 323.827 4.275 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001535108035 1060462960 /nfs/dbraw/zinc/46/29/60/1060462960.db2.gz JARHDJZMBZKWIN-CABCVRRESA-N 1 2 319.408 4.262 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc3c(o2)c(F)ccc3C)c(C)[nH+]1 ZINC001535173946 1060479332 /nfs/dbraw/zinc/47/93/32/1060479332.db2.gz MXGCTIOQRNGHHA-UHFFFAOYSA-N 1 2 312.344 4.453 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cnc1Cl ZINC001249916184 1060479549 /nfs/dbraw/zinc/47/95/49/1060479549.db2.gz BLJDXKGHTUPDMP-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cnc1Cl ZINC001249916184 1060479553 /nfs/dbraw/zinc/47/95/53/1060479553.db2.gz BLJDXKGHTUPDMP-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO c1coc(-c2ccc(Nc3ccccc3-n3cc[nH+]c3)cc2)n1 ZINC001249928553 1060485695 /nfs/dbraw/zinc/48/56/95/1060485695.db2.gz IVVDKRZERIFTBJ-UHFFFAOYSA-N 1 2 302.337 4.271 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCOC[C@H]2c2ccccc2)c(Cl)c1 ZINC001560661799 1060486168 /nfs/dbraw/zinc/48/61/68/1060486168.db2.gz IVSPXBCOFLNGFJ-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc(CC[N@H+]2CCOC[C@H]2c2ccccc2)c(Cl)c1 ZINC001560661799 1060486176 /nfs/dbraw/zinc/48/61/76/1060486176.db2.gz IVSPXBCOFLNGFJ-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO c1coc(-c2ccc(Nc3ccc(-n4cc[nH+]c4)cc3)cc2)n1 ZINC001249928624 1060487017 /nfs/dbraw/zinc/48/70/17/1060487017.db2.gz LMRRTLLIOMKVAS-UHFFFAOYSA-N 1 2 302.337 4.271 20 0 DIADLO Clc1cc(Nc2ccc(-c3ncco3)cc2)cn2cc[nH+]c12 ZINC001249928726 1060487092 /nfs/dbraw/zinc/48/70/92/1060487092.db2.gz IGBWZBOYUQAPHH-UHFFFAOYSA-N 1 2 310.744 4.386 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2F)[C@@H](C)C1 ZINC001249944392 1060494966 /nfs/dbraw/zinc/49/49/66/1060494966.db2.gz XPKMNUFQUXCGMI-JOYOIKCWSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)[C@@H](C)C1 ZINC001249944392 1060494980 /nfs/dbraw/zinc/49/49/80/1060494980.db2.gz XPKMNUFQUXCGMI-JOYOIKCWSA-N 1 2 306.208 4.132 20 0 DIADLO CC[C@H](Cc1ccccc1C)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001527357740 1060498548 /nfs/dbraw/zinc/49/85/48/1060498548.db2.gz YJCXRTKIYTXONH-MRXNPFEDSA-N 1 2 321.424 4.159 20 0 DIADLO Cc1ccc2c(Nc3cc(O)c(F)c(F)c3F)cccc2[nH+]1 ZINC001249965113 1060507138 /nfs/dbraw/zinc/50/71/38/1060507138.db2.gz VWGGFDRBXMSOPX-UHFFFAOYSA-N 1 2 304.271 4.410 20 0 DIADLO COc1nccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1F ZINC001560673925 1060507461 /nfs/dbraw/zinc/50/74/61/1060507461.db2.gz GRCQZQQUHCFXBW-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1F ZINC001560673925 1060507479 /nfs/dbraw/zinc/50/74/79/1060507479.db2.gz GRCQZQQUHCFXBW-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO c1ccc(COc2cc(C[NH+]3Cc4ccccc4C3)ccn2)cc1 ZINC001249962426 1060508955 /nfs/dbraw/zinc/50/89/55/1060508955.db2.gz KMZBLVNUAPDBBI-UHFFFAOYSA-N 1 2 316.404 4.176 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](Cc1cn(C)nc1Cl)C1CC1 ZINC001560679913 1060519813 /nfs/dbraw/zinc/51/98/13/1060519813.db2.gz CXEGAFMULHDUSY-NSHDSACASA-N 1 2 324.255 4.453 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](Cc1cn(C)nc1Cl)C1CC1 ZINC001560679913 1060519833 /nfs/dbraw/zinc/51/98/33/1060519833.db2.gz CXEGAFMULHDUSY-NSHDSACASA-N 1 2 324.255 4.453 20 0 DIADLO Nc1cc(C(F)(F)F)c(Cc2cccc(C(F)(F)F)c2)c[nH+]1 ZINC001249994744 1060526379 /nfs/dbraw/zinc/52/63/79/1060526379.db2.gz YNKDSXRFJQHRQT-UHFFFAOYSA-N 1 2 320.236 4.292 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(F)c2OC(F)(F)F)C1(C)C ZINC001560688103 1060539007 /nfs/dbraw/zinc/53/90/07/1060539007.db2.gz XQHHMSOBJNCWHH-UHFFFAOYSA-N 1 2 305.315 4.345 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(F)c2OC(F)(F)F)C1(C)C ZINC001560688103 1060539020 /nfs/dbraw/zinc/53/90/20/1060539020.db2.gz XQHHMSOBJNCWHH-UHFFFAOYSA-N 1 2 305.315 4.345 20 0 DIADLO Oc1cc(F)c(Nc2ccc(N3CCCCC3)[nH+]c2)cc1Cl ZINC001250020847 1060543152 /nfs/dbraw/zinc/54/31/52/1060543152.db2.gz TVEPQTCHCQTMKH-UHFFFAOYSA-N 1 2 321.783 4.314 20 0 DIADLO CO[C@@H]1CCC[N@H+](Cc2cnc(Cl)c(Cl)c2Cl)CC1 ZINC001250034744 1060559365 /nfs/dbraw/zinc/55/93/65/1060559365.db2.gz ZQWRFKFJVSCNNS-SNVBAGLBSA-N 1 2 323.651 4.043 20 0 DIADLO CO[C@@H]1CCC[N@@H+](Cc2cnc(Cl)c(Cl)c2Cl)CC1 ZINC001250034744 1060559382 /nfs/dbraw/zinc/55/93/82/1060559382.db2.gz ZQWRFKFJVSCNNS-SNVBAGLBSA-N 1 2 323.651 4.043 20 0 DIADLO CCOc1cc(F)c(Nc2ccn3cc[nH+]c3c2)cc1Cl ZINC001250067840 1060581500 /nfs/dbraw/zinc/58/15/00/1060581500.db2.gz URAFLRURUIEGIY-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO Cc1cc(CNc2c[nH]nc2-c2ccccc2)c2c([nH+]1)CCCC2 ZINC001560738351 1060606489 /nfs/dbraw/zinc/60/64/89/1060606489.db2.gz OVUZDZYSDUHNFP-UHFFFAOYSA-N 1 2 318.424 4.271 20 0 DIADLO COc1c(Cl)ccc(F)c1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001250102773 1060611405 /nfs/dbraw/zinc/61/14/05/1060611405.db2.gz OLIJOACQRJUDIB-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO COc1c(Cl)ccc(F)c1Nc1ccc2c(c1)[nH+]cn2C ZINC001250105889 1060613975 /nfs/dbraw/zinc/61/39/75/1060613975.db2.gz NONYAKCRZBEKJO-UHFFFAOYSA-N 1 2 305.740 4.118 20 0 DIADLO C[C@H](Cc1cc(F)ccc1C[NH+]1CCOCC1)c1ccccc1 ZINC001250111058 1060618142 /nfs/dbraw/zinc/61/81/42/1060618142.db2.gz QOZDBFRELIIBIW-MRXNPFEDSA-N 1 2 313.416 4.004 20 0 DIADLO Fc1ccc(OCCCc2ccc(N3CCCCC3)[nH+]c2)cc1 ZINC001250114970 1060620734 /nfs/dbraw/zinc/62/07/34/1060620734.db2.gz QEAQEHFSPCDTMB-UHFFFAOYSA-N 1 2 314.404 4.223 20 0 DIADLO C[C@H](CC[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1)CC(C)(C)C ZINC001560759239 1060624736 /nfs/dbraw/zinc/62/47/36/1060624736.db2.gz WHPHIGZXXUTQFX-GDBMZVCRSA-N 1 2 306.498 4.478 20 0 DIADLO C[C@@H](CC[NH2+][C@H](c1ncn[nH]1)C1CCCCC1)CC(C)(C)C ZINC001560759241 1060625869 /nfs/dbraw/zinc/62/58/69/1060625869.db2.gz WHPHIGZXXUTQFX-HOCLYGCPSA-N 1 2 306.498 4.478 20 0 DIADLO COc1ccc(SCCNc2[nH+]cccc2OC(C)C)cc1 ZINC001560764968 1060629579 /nfs/dbraw/zinc/62/95/79/1060629579.db2.gz WDISWGNRMGIGMV-UHFFFAOYSA-N 1 2 318.442 4.082 20 0 DIADLO CC(C)Oc1cc(F)c(C[NH+]2CC(c3ccccc3)C2)c(F)c1 ZINC001250148234 1060645230 /nfs/dbraw/zinc/64/52/30/1060645230.db2.gz RMAKYMWCVGKHQO-UHFFFAOYSA-N 1 2 317.379 4.351 20 0 DIADLO CCc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)ccc1OC ZINC001250176445 1060660457 /nfs/dbraw/zinc/66/04/57/1060660457.db2.gz UIRIBGOKQBJXNJ-UHFFFAOYSA-N 1 2 307.397 4.246 20 0 DIADLO CCOc1cc(C)ccc1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC001250180875 1060662324 /nfs/dbraw/zinc/66/23/24/1060662324.db2.gz ULZGPQXTCDMXJN-OAHLLOKOSA-N 1 2 302.443 4.187 20 0 DIADLO CCOc1cc(C)ccc1C[N@H+]1CCC[C@@H]1c1nccs1 ZINC001250180875 1060662332 /nfs/dbraw/zinc/66/23/32/1060662332.db2.gz ULZGPQXTCDMXJN-OAHLLOKOSA-N 1 2 302.443 4.187 20 0 DIADLO CC1CCC(C)(C[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)CC1 ZINC001560804510 1060665724 /nfs/dbraw/zinc/66/57/24/1060665724.db2.gz FUIKQACVUFKCTO-BFHRDPOASA-N 1 2 304.482 4.232 20 0 DIADLO COc1c(F)c(Cl)ccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001250189670 1060667599 /nfs/dbraw/zinc/66/75/99/1060667599.db2.gz YRKVKPBAMABBRW-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO CNc1ccc(C)cc1C[N@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC001560815135 1060674198 /nfs/dbraw/zinc/67/41/98/1060674198.db2.gz ROUSIZUVFKYLGT-UHFFFAOYSA-N 1 2 320.440 4.059 20 0 DIADLO CNc1ccc(C)cc1C[N@@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC001560815135 1060674209 /nfs/dbraw/zinc/67/42/09/1060674209.db2.gz ROUSIZUVFKYLGT-UHFFFAOYSA-N 1 2 320.440 4.059 20 0 DIADLO Fc1cc(C[NH+]2CCC2)cc(Cl)c1OCc1ccccc1 ZINC001250207010 1060686847 /nfs/dbraw/zinc/68/68/47/1060686847.db2.gz SFYMXACDKIVRQZ-UHFFFAOYSA-N 1 2 305.780 4.264 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccnc2)cn1 ZINC001560847149 1060703087 /nfs/dbraw/zinc/70/30/87/1060703087.db2.gz RUXCBPBIKPWOPS-IBGZPJMESA-N 1 2 309.457 4.258 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)cn1 ZINC001560847149 1060703100 /nfs/dbraw/zinc/70/31/00/1060703100.db2.gz RUXCBPBIKPWOPS-IBGZPJMESA-N 1 2 309.457 4.258 20 0 DIADLO Oc1ccc(F)c(Nc2ccccc2-n2cc[nH+]c2)c1Cl ZINC001250233979 1060713043 /nfs/dbraw/zinc/71/30/43/1060713043.db2.gz HWIHVPUDSOIBHV-UHFFFAOYSA-N 1 2 303.724 4.114 20 0 DIADLO COc1ccc(SCC[NH2+]CC(F)(F)c2ccccc2)cc1 ZINC001560870278 1060730762 /nfs/dbraw/zinc/73/07/62/1060730762.db2.gz CYRDYAZQDKZFOM-UHFFFAOYSA-N 1 2 323.408 4.169 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1c(Cl)n[nH]c1C1CC1 ZINC001560871127 1060732429 /nfs/dbraw/zinc/73/24/29/1060732429.db2.gz YXNKDAWPHKDCFY-SECBINFHSA-N 1 2 307.850 4.121 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1c(Cl)n[nH]c1C1CC1 ZINC001560871127 1060732437 /nfs/dbraw/zinc/73/24/37/1060732437.db2.gz YXNKDAWPHKDCFY-SECBINFHSA-N 1 2 307.850 4.121 20 0 DIADLO Fc1cccc(F)c1CC1C[NH+](Cc2cscc2Cl)C1 ZINC001560875537 1060734437 /nfs/dbraw/zinc/73/44/37/1060734437.db2.gz URLVKOVMYDTGAZ-UHFFFAOYSA-N 1 2 313.800 4.354 20 0 DIADLO Cc1scc(C[N@@H+]([C@H](C)C(=O)OC(C)(C)C)C2CC2)c1C ZINC001560881612 1060743375 /nfs/dbraw/zinc/74/33/75/1060743375.db2.gz OBTLCWMBCAKUNP-GFCCVEGCSA-N 1 2 309.475 4.060 20 0 DIADLO Cc1scc(C[N@H+]([C@H](C)C(=O)OC(C)(C)C)C2CC2)c1C ZINC001560881612 1060743384 /nfs/dbraw/zinc/74/33/84/1060743384.db2.gz OBTLCWMBCAKUNP-GFCCVEGCSA-N 1 2 309.475 4.060 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)cc1F ZINC001560885141 1060746678 /nfs/dbraw/zinc/74/66/78/1060746678.db2.gz TVPUYGJTQCHAJJ-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)cc1F ZINC001560885141 1060746699 /nfs/dbraw/zinc/74/66/99/1060746699.db2.gz TVPUYGJTQCHAJJ-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO COc1cccnc1C[NH2+][C@H](C)c1ccc(-c2ccccc2)cn1 ZINC001560888114 1060750468 /nfs/dbraw/zinc/75/04/68/1060750468.db2.gz UPOVJNPBGOCKNX-OAHLLOKOSA-N 1 2 319.408 4.003 20 0 DIADLO CCCCCCOc1ccc(CCn2cc[nH+]c2)c(F)c1F ZINC001250316084 1060775014 /nfs/dbraw/zinc/77/50/14/1060775014.db2.gz AIRDKDMVBBSFTP-UHFFFAOYSA-N 1 2 308.372 4.363 20 0 DIADLO COc1cccc(C2CC(Nc3c[nH+]cc4c3CCCC4)C2)c1 ZINC001560927383 1060790816 /nfs/dbraw/zinc/79/08/16/1060790816.db2.gz PIHQROAARDCYFU-UHFFFAOYSA-N 1 2 308.425 4.327 20 0 DIADLO C[C@@H]([NH2+][C@H](C)[C@@H](C)c1ccc(Cl)cc1)C(=O)OC(C)(C)C ZINC001560926181 1060791293 /nfs/dbraw/zinc/79/12/93/1060791293.db2.gz GTNZINUPFKQWNY-JHJVBQTASA-N 1 2 311.853 4.152 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cncc(Br)c1Cl ZINC001250457691 1060816742 /nfs/dbraw/zinc/81/67/42/1060816742.db2.gz DXAUTUNSFCTTJZ-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO Cc1ccc(CC2C[NH+](Cc3c(Cl)ccnc3Cl)C2)cc1 ZINC001560935047 1060797607 /nfs/dbraw/zinc/79/76/07/1060797607.db2.gz IUOHYPZDNCJRDE-UHFFFAOYSA-N 1 2 321.251 4.371 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cncc(Br)c1Cl ZINC001250457691 1060816759 /nfs/dbraw/zinc/81/67/59/1060816759.db2.gz DXAUTUNSFCTTJZ-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO CO[C@H](CNc1ccc(Nc2ccccc2)c[nH+]1)C1CCCC1 ZINC001560939654 1060803211 /nfs/dbraw/zinc/80/32/11/1060803211.db2.gz MUQGZITVWRZBFV-GOSISDBHSA-N 1 2 311.429 4.442 20 0 DIADLO CCc1cccc(F)c1C[N@H+](C)Cc1c(C)cc(C)nc1OC ZINC001560948170 1060813382 /nfs/dbraw/zinc/81/33/82/1060813382.db2.gz PRQZVIWIDKUOBP-UHFFFAOYSA-N 1 2 316.420 4.041 20 0 DIADLO CCc1cccc(F)c1C[N@@H+](C)Cc1c(C)cc(C)nc1OC ZINC001560948170 1060813391 /nfs/dbraw/zinc/81/33/91/1060813391.db2.gz PRQZVIWIDKUOBP-UHFFFAOYSA-N 1 2 316.420 4.041 20 0 DIADLO CCc1ccc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)cc1 ZINC001250480042 1060835508 /nfs/dbraw/zinc/83/55/08/1060835508.db2.gz AKCRUJWPDLAIBZ-UHFFFAOYSA-N 1 2 306.344 4.117 20 0 DIADLO CCSCc1ccc[nH+]c1N[C@@H]1C[C@@H](OC(C)C)C1(C)C ZINC001560982088 1060845667 /nfs/dbraw/zinc/84/56/67/1060845667.db2.gz POKSMSNRRDPLBB-HUUCEWRRSA-N 1 2 308.491 4.339 20 0 DIADLO Cc1ccc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)cc1F ZINC001250500916 1060854242 /nfs/dbraw/zinc/85/42/42/1060854242.db2.gz DVXKBSSSLBPTJQ-UHFFFAOYSA-N 1 2 310.307 4.002 20 0 DIADLO C[C@@H](CCc1ccco1)[NH2+]CC(F)(F)c1ccc(F)cc1F ZINC001560998371 1060857859 /nfs/dbraw/zinc/85/78/59/1060857859.db2.gz WGECXZHXBRVYTL-NSHDSACASA-N 1 2 315.310 4.261 20 0 DIADLO Fc1cc2[nH]c(-c3cccc4[nH]ccc43)nc2cc1-n1cc[nH+]c1 ZINC001250504920 1060859344 /nfs/dbraw/zinc/85/93/44/1060859344.db2.gz IDOSYYCCIUZLCE-UHFFFAOYSA-N 1 2 317.327 4.036 20 0 DIADLO Clc1ccc([C@@H]2C[C@@H]2c2[nH]c3cc4c(cc3[nH+]2)OCO4)cc1 ZINC001250536891 1060881491 /nfs/dbraw/zinc/88/14/91/1060881491.db2.gz DUGOCFXTXJKKOT-RYUDHWBXSA-N 1 2 312.756 4.216 20 0 DIADLO Clc1ccc([C@H]2C[C@@H]2c2[nH]c3cc4c(cc3[nH+]2)OCC4)cc1 ZINC001250537184 1060883577 /nfs/dbraw/zinc/88/35/77/1060883577.db2.gz HPNDIQOGRCCZLD-KGLIPLIRSA-N 1 2 310.784 4.422 20 0 DIADLO Cc1cc2[nH]c(Cc3c(Cl)nc(C)nc3Cl)[nH+]c2cc1C ZINC001250543621 1060885554 /nfs/dbraw/zinc/88/55/54/1060885554.db2.gz IZYYQCKTKCJSMH-UHFFFAOYSA-N 1 2 321.211 4.176 20 0 DIADLO COCOc1ccc2[nH]c(C[C@H]3CC=C(C)C3(C)C)[nH+]c2c1 ZINC001250542438 1060885571 /nfs/dbraw/zinc/88/55/71/1060885571.db2.gz YUHWUPCNQGDQNM-CYBMUJFWSA-N 1 2 300.402 4.081 20 0 DIADLO CCn1c(C[C@@H](C)CCCC(C)(C)O)[nH+]c2ccc(F)c(F)c21 ZINC001250557012 1060896603 /nfs/dbraw/zinc/89/66/03/1060896603.db2.gz WWTZJMLWYOJHMA-LBPRGKRZSA-N 1 2 324.415 4.454 20 0 DIADLO CCn1c(CCc2cccc(F)c2)[nH+]c2ccc(F)c(F)c21 ZINC001250556360 1060896708 /nfs/dbraw/zinc/89/67/08/1060896708.db2.gz MGOPLHOXCZPCBG-UHFFFAOYSA-N 1 2 304.315 4.259 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NCCC1CCCCCC1 ZINC001561044803 1060896955 /nfs/dbraw/zinc/89/69/55/1060896955.db2.gz OIKRVERQQIVZOF-UHFFFAOYSA-N 1 2 315.461 4.455 20 0 DIADLO COc1ccc2[nH]c(CCc3cccc(C(F)(F)F)c3)[nH+]c2c1 ZINC001250560200 1060899097 /nfs/dbraw/zinc/89/90/97/1060899097.db2.gz PKCYETRILUISNR-UHFFFAOYSA-N 1 2 320.314 4.376 20 0 DIADLO Cc1cc2[nH]c([C@@H](C)Cc3ccc4c(c3)OCO4)[nH+]c2cc1F ZINC001250567460 1060904302 /nfs/dbraw/zinc/90/43/02/1060904302.db2.gz JXRLZIMAVCKJJJ-NSHDSACASA-N 1 2 312.344 4.085 20 0 DIADLO COc1ccc2c(c1)[nH+]c(C[C@@H](C)CCCC(C)(C)OC)n2C ZINC001250568426 1060904629 /nfs/dbraw/zinc/90/46/29/1060904629.db2.gz XFOXWGANSCGXJT-AWEZNQCLSA-N 1 2 318.461 4.356 20 0 DIADLO COc1ccc2[nH]c(C[C@@H](C)CCCC(C)(C)OC)[nH+]c2c1 ZINC001250566718 1060904921 /nfs/dbraw/zinc/90/49/21/1060904921.db2.gz BJVHMDXWQDNPOR-ZDUSSCGKSA-N 1 2 304.434 4.345 20 0 DIADLO Cc1c2[nH+]c([C@H](C)Cc3ccc4c(c3)OCO4)[nH]c2ccc1F ZINC001250567915 1060905089 /nfs/dbraw/zinc/90/50/89/1060905089.db2.gz OKDUBJKXTDHGSW-SNVBAGLBSA-N 1 2 312.344 4.085 20 0 DIADLO CCC[C@H](CNc1[nH+]c2ccccc2n1CCC(C)C)OC ZINC001561058913 1060907951 /nfs/dbraw/zinc/90/79/51/1060907951.db2.gz HVYWNUNMCKYZMG-OAHLLOKOSA-N 1 2 303.450 4.309 20 0 DIADLO COc1ccc(CNc2[nH+]c3ccccc3n2CCC(C)C)nc1 ZINC001561059164 1060908177 /nfs/dbraw/zinc/90/81/77/1060908177.db2.gz RGEHLCOABNDMEU-UHFFFAOYSA-N 1 2 324.428 4.098 20 0 DIADLO CCOC(=O)[C@H]1CC[C@H](c2[nH]c3ccc(C)c(C)c3[nH+]2)CC1 ZINC001250590948 1060926198 /nfs/dbraw/zinc/92/61/98/1060926198.db2.gz XTVNHTZYAYXNGS-HDJSIYSDSA-N 1 2 300.402 4.017 20 0 DIADLO CCOC(=O)[C@H]1CC[C@H](c2[nH]c3c(ccc(C)c3C)[nH+]2)CC1 ZINC001250590948 1060926209 /nfs/dbraw/zinc/92/62/09/1060926209.db2.gz XTVNHTZYAYXNGS-HDJSIYSDSA-N 1 2 300.402 4.017 20 0 DIADLO Cc1ccc2[nH]c(CCCCCNC(=O)OC(C)(C)C)[nH+]c2c1 ZINC001250611448 1060938573 /nfs/dbraw/zinc/93/85/73/1060938573.db2.gz KZIFAKZLDJRYIR-UHFFFAOYSA-N 1 2 317.433 4.109 20 0 DIADLO CN(C)c1cc(CN(C)c2ccc(-c3ccccc3)cc2)cc[nH+]1 ZINC001473199293 1060959991 /nfs/dbraw/zinc/95/99/91/1060959991.db2.gz HOHDPYYURJJOPB-UHFFFAOYSA-N 1 2 317.436 4.451 20 0 DIADLO CCc1cccc(Cl)c1C[N@@H+]1CCC=C(Br)C1 ZINC001462152476 1060975526 /nfs/dbraw/zinc/97/55/26/1060975526.db2.gz VBJAQYPLDOBAEJ-UHFFFAOYSA-N 1 2 314.654 4.387 20 0 DIADLO CCc1cccc(Cl)c1C[N@H+]1CCC=C(Br)C1 ZINC001462152476 1060975548 /nfs/dbraw/zinc/97/55/48/1060975548.db2.gz VBJAQYPLDOBAEJ-UHFFFAOYSA-N 1 2 314.654 4.387 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1ccc(O)c(F)c1F ZINC001462173997 1060993611 /nfs/dbraw/zinc/99/36/11/1060993611.db2.gz FSYDYHYCKKBPSY-UHFFFAOYSA-N 1 2 309.381 4.024 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1ccc(O)c(F)c1F ZINC001462173997 1060993626 /nfs/dbraw/zinc/99/36/26/1060993626.db2.gz FSYDYHYCKKBPSY-UHFFFAOYSA-N 1 2 309.381 4.024 20 0 DIADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc(-c2ccccc2)c(Cl)c1 ZINC001462176768 1060995576 /nfs/dbraw/zinc/99/55/76/1060995576.db2.gz QUKZNHWCJFSSET-CYBMUJFWSA-N 1 2 317.816 4.000 20 0 DIADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(-c2ccccc2)c(Cl)c1 ZINC001462176768 1060995601 /nfs/dbraw/zinc/99/56/01/1060995601.db2.gz QUKZNHWCJFSSET-CYBMUJFWSA-N 1 2 317.816 4.000 20 0 DIADLO CCOc1cccc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c1 ZINC001250680648 1061012799 /nfs/dbraw/zinc/01/27/99/1061012799.db2.gz CWNDGYYYZJIQKF-UHFFFAOYSA-N 1 2 307.397 4.229 20 0 DIADLO Cc1cn2cc(NC(=O)N3CCCCC[C@@H]3C(C)C)ccc2[nH+]1 ZINC001562322703 1061029352 /nfs/dbraw/zinc/02/93/52/1061029352.db2.gz HADPVZLOFBWEPA-MRXNPFEDSA-N 1 2 314.433 4.075 20 0 DIADLO CCCn1cc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c(C)n1 ZINC001462229228 1061043589 /nfs/dbraw/zinc/04/35/89/1061043589.db2.gz ZCWGGUVZMAQTCO-KRWDZBQOSA-N 1 2 303.837 4.202 20 0 DIADLO CCCn1cc(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)c(C)n1 ZINC001462229228 1061043603 /nfs/dbraw/zinc/04/36/03/1061043603.db2.gz ZCWGGUVZMAQTCO-KRWDZBQOSA-N 1 2 303.837 4.202 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+]2CCc3ccc(F)c(F)c3C2)c1 ZINC001473278092 1061048309 /nfs/dbraw/zinc/04/83/09/1061048309.db2.gz CUGPUSFRHGWBDN-UHFFFAOYSA-N 1 2 317.379 4.310 20 0 DIADLO CC(C)Oc1cccc(C[N@H+]2CCc3ccc(F)c(F)c3C2)c1 ZINC001473278092 1061048321 /nfs/dbraw/zinc/04/83/21/1061048321.db2.gz CUGPUSFRHGWBDN-UHFFFAOYSA-N 1 2 317.379 4.310 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCc3ccc(F)c(F)c3C2)cc1 ZINC001473278064 1061049650 /nfs/dbraw/zinc/04/96/50/1061049650.db2.gz BVMGBTHKKSQZLW-UHFFFAOYSA-N 1 2 301.380 4.476 20 0 DIADLO CCCc1ccc(C[N@H+]2CCc3ccc(F)c(F)c3C2)cc1 ZINC001473278064 1061049661 /nfs/dbraw/zinc/04/96/61/1061049661.db2.gz BVMGBTHKKSQZLW-UHFFFAOYSA-N 1 2 301.380 4.476 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+](C)CCOCc1ccccc1 ZINC001473280901 1061051108 /nfs/dbraw/zinc/05/11/08/1061051108.db2.gz XPYVUCMGGSLJAX-CQSZACIVSA-N 1 2 305.368 4.174 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)CCOCc1ccccc1 ZINC001473280901 1061051117 /nfs/dbraw/zinc/05/11/17/1061051117.db2.gz XPYVUCMGGSLJAX-CQSZACIVSA-N 1 2 305.368 4.174 20 0 DIADLO CCn1c2ccc(F)cc2nc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001250772225 1061063281 /nfs/dbraw/zinc/06/32/81/1061063281.db2.gz SHJGHCVRPMTGJY-UHFFFAOYSA-N 1 2 306.344 4.048 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(C3CC3)cc2)C[C@H](C(F)(F)F)O1 ZINC001462269843 1061064888 /nfs/dbraw/zinc/06/48/88/1061064888.db2.gz IKKKNIAJWBXUSN-OAHLLOKOSA-N 1 2 313.363 4.106 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(C3CC3)cc2)C[C@H](C(F)(F)F)O1 ZINC001462269843 1061064897 /nfs/dbraw/zinc/06/48/97/1061064897.db2.gz IKKKNIAJWBXUSN-OAHLLOKOSA-N 1 2 313.363 4.106 20 0 DIADLO Cc1[nH]c(CN2CCc3cc(Cl)c(Cl)cc3[C@@H]2C)[nH+]c1C ZINC001473306496 1061070295 /nfs/dbraw/zinc/07/02/95/1061070295.db2.gz ZFJZHSITVIQFCI-NSHDSACASA-N 1 2 324.255 4.453 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(C3CC3)c2)C[C@H](C(F)(F)F)O1 ZINC001462277532 1061070528 /nfs/dbraw/zinc/07/05/28/1061070528.db2.gz ZETUUTWNRXJUFH-OAHLLOKOSA-N 1 2 313.363 4.106 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(C3CC3)c2)C[C@H](C(F)(F)F)O1 ZINC001462277532 1061070541 /nfs/dbraw/zinc/07/05/41/1061070541.db2.gz ZETUUTWNRXJUFH-OAHLLOKOSA-N 1 2 313.363 4.106 20 0 DIADLO CO[C@H]1CCC[C@@H](Nc2ccc(-n3c[nH+]c(C)c3C)cc2)CC1 ZINC001462290154 1061080328 /nfs/dbraw/zinc/08/03/28/1061080328.db2.gz FSPPUBWHOIAXJI-APWZRJJASA-N 1 2 313.445 4.249 20 0 DIADLO COc1ccc(C2([NH2+]Cc3nccc(Cl)c3Cl)CC2)cc1 ZINC001473332380 1061092992 /nfs/dbraw/zinc/09/29/92/1061092992.db2.gz FPBXVPJOFCGKCZ-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO CCc1ccc(C[NH+]2CC(OCCCc3ccccc3)C2)cc1 ZINC001462323556 1061104140 /nfs/dbraw/zinc/10/41/40/1061104140.db2.gz RCXWYDMAHCHTMV-UHFFFAOYSA-N 1 2 309.453 4.083 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nccc(Cl)c1Cl ZINC001473348809 1061105124 /nfs/dbraw/zinc/10/51/24/1061105124.db2.gz DIGKLFTUANHGSF-AWEZNQCLSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nccc(Cl)c1Cl ZINC001473348809 1061105129 /nfs/dbraw/zinc/10/51/29/1061105129.db2.gz DIGKLFTUANHGSF-AWEZNQCLSA-N 1 2 310.228 4.367 20 0 DIADLO CCC1(C)C[NH+](Cc2cc(C)c(F)cc2Br)C1 ZINC001462331556 1061108789 /nfs/dbraw/zinc/10/87/89/1061108789.db2.gz JWRSXGHYHZTZIV-UHFFFAOYSA-N 1 2 300.215 4.129 20 0 DIADLO c1cc2ccncc2c(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c1 ZINC001250891806 1061112098 /nfs/dbraw/zinc/11/20/98/1061112098.db2.gz MHQHIFQELRAVJQ-UHFFFAOYSA-N 1 2 314.392 4.378 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1c(F)cccc1F)[C@@H]2C ZINC001473370742 1061118190 /nfs/dbraw/zinc/11/81/90/1061118190.db2.gz ANOOJXBFBFUJPT-QWHCGFSZSA-N 1 2 317.379 4.481 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1c(F)cccc1F)[C@@H]2C ZINC001473370742 1061118195 /nfs/dbraw/zinc/11/81/95/1061118195.db2.gz ANOOJXBFBFUJPT-QWHCGFSZSA-N 1 2 317.379 4.481 20 0 DIADLO Cc1cc(F)ccc1-c1nc2cc(-n3cc[nH+]c3)c(F)cc2[nH]1 ZINC001250906432 1061119079 /nfs/dbraw/zinc/11/90/79/1061119079.db2.gz ONUJDTAUMCSAFC-UHFFFAOYSA-N 1 2 310.307 4.002 20 0 DIADLO FC(F)(F)c1ccc2nc(-c3c[nH]c4cc[nH+]cc34)[nH]c2c1 ZINC001250907829 1061120525 /nfs/dbraw/zinc/12/05/25/1061120525.db2.gz CNZJTZWREONYPT-UHFFFAOYSA-N 1 2 302.259 4.125 20 0 DIADLO CCc1ccc([C@H]2C[N@H+](Cc3ccc(Cl)cc3)CCO2)cc1 ZINC001473384192 1061127330 /nfs/dbraw/zinc/12/73/30/1061127330.db2.gz KFIAIMMLWVJVSN-LJQANCHMSA-N 1 2 315.844 4.476 20 0 DIADLO CCc1ccc([C@H]2C[N@@H+](Cc3ccc(Cl)cc3)CCO2)cc1 ZINC001473384192 1061127336 /nfs/dbraw/zinc/12/73/36/1061127336.db2.gz KFIAIMMLWVJVSN-LJQANCHMSA-N 1 2 315.844 4.476 20 0 DIADLO Cc1ccc2nc(-c3ccn4cc[nH+]c4c3)n(CC(C)C)c2c1 ZINC001250928122 1061129010 /nfs/dbraw/zinc/12/90/10/1061129010.db2.gz XHBBMDBZIWAYMB-UHFFFAOYSA-N 1 2 304.397 4.315 20 0 DIADLO Fc1ccc(/C=C/CNc2ccc(N3CCCC3)c[nH+]2)cc1F ZINC001462363747 1061130415 /nfs/dbraw/zinc/13/04/15/1061130415.db2.gz KAUXPLHUYHXUQF-ONEGZZNKSA-N 1 2 315.367 4.085 20 0 DIADLO CC[C@]1(C)C[N@@H+]([C@H](C)c2ccccc2Br)CCO1 ZINC001473389177 1061130553 /nfs/dbraw/zinc/13/05/53/1061130553.db2.gz KLHGGWJDXWFYOK-IUODEOHRSA-N 1 2 312.251 4.011 20 0 DIADLO CC[C@]1(C)C[N@H+]([C@H](C)c2ccccc2Br)CCO1 ZINC001473389177 1061130561 /nfs/dbraw/zinc/13/05/61/1061130561.db2.gz KLHGGWJDXWFYOK-IUODEOHRSA-N 1 2 312.251 4.011 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1ncsc1Br ZINC001473387641 1061130661 /nfs/dbraw/zinc/13/06/61/1061130661.db2.gz AUCIMQOSKKYFCV-PWSUYJOCSA-N 1 2 317.296 4.306 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ncsc1Br ZINC001473387641 1061130668 /nfs/dbraw/zinc/13/06/68/1061130668.db2.gz AUCIMQOSKKYFCV-PWSUYJOCSA-N 1 2 317.296 4.306 20 0 DIADLO CSc1ccc2[nH]c(-c3cccc(-n4cc[nH+]c4)c3)nc2c1 ZINC001250939951 1061136198 /nfs/dbraw/zinc/13/61/98/1061136198.db2.gz BHNNIBWLANHPGL-UHFFFAOYSA-N 1 2 306.394 4.138 20 0 DIADLO Cc1ccc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)c(F)c1 ZINC001250938189 1061136782 /nfs/dbraw/zinc/13/67/82/1061136782.db2.gz YAXZFUCGHUMCOT-UHFFFAOYSA-N 1 2 310.307 4.002 20 0 DIADLO Cc1nc(C(F)(F)F)ccc1-c1[nH]c2ccc(N(C)C)cc2[nH+]1 ZINC001250943226 1061139389 /nfs/dbraw/zinc/13/93/89/1061139389.db2.gz HFRXUBZXLZIEQE-UHFFFAOYSA-N 1 2 320.318 4.018 20 0 DIADLO COc1ccc(C[C@H](C)CNc2cc3cc[nH]c3c[nH+]2)cc1F ZINC001462387899 1061144494 /nfs/dbraw/zinc/14/44/94/1061144494.db2.gz NIVCMXYAOQTIRP-LBPRGKRZSA-N 1 2 313.376 4.001 20 0 DIADLO Oc1ccc(C[NH2+]C2(c3ccccc3Cl)CCC2)c(F)c1F ZINC001462394352 1061145786 /nfs/dbraw/zinc/14/57/86/1061145786.db2.gz KGGZHDJSAOLUAK-UHFFFAOYSA-N 1 2 323.770 4.493 20 0 DIADLO Cc1ccc2nc(-c3ccc4[nH+]ccn4c3)n(CC(C)C)c2c1 ZINC001250977251 1061155561 /nfs/dbraw/zinc/15/55/61/1061155561.db2.gz ACMSEUYSWKLNGJ-UHFFFAOYSA-N 1 2 304.397 4.315 20 0 DIADLO COc1cc(C)cc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c1 ZINC001250979685 1061157407 /nfs/dbraw/zinc/15/74/07/1061157407.db2.gz MXDWQIFOELOMLX-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO CCCCn1c2cc(F)ccc2nc1-c1ccc2[nH+]ccn2c1 ZINC001250979095 1061158206 /nfs/dbraw/zinc/15/82/06/1061158206.db2.gz SYVVBIDKCBNCGV-UHFFFAOYSA-N 1 2 308.360 4.290 20 0 DIADLO CC(C)(C)n1c2ccc(F)cc2nc1-c1ccc2[nH+]ccn2c1 ZINC001250978351 1061158578 /nfs/dbraw/zinc/15/85/78/1061158578.db2.gz IMBLUUPCILIDEW-UHFFFAOYSA-N 1 2 308.360 4.245 20 0 DIADLO CCCCn1c(-c2ccc(C)[nH+]c2N)nc2ccc(F)c(F)c21 ZINC001250982036 1061159605 /nfs/dbraw/zinc/15/96/05/1061159605.db2.gz NSHSNHPYYITJJE-UHFFFAOYSA-N 1 2 316.355 4.067 20 0 DIADLO Cc1ccc(-c2nc3cc(-c4cccs4)ccc3[nH]2)c(N)[nH+]1 ZINC001250982210 1061160093 /nfs/dbraw/zinc/16/00/93/1061160093.db2.gz RTIPZEAUQFAJTM-UHFFFAOYSA-N 1 2 306.394 4.244 20 0 DIADLO Cc1ccc(-c2nc3ccc(-c4cccs4)cc3[nH]2)c(N)[nH+]1 ZINC001250982210 1061160106 /nfs/dbraw/zinc/16/01/06/1061160106.db2.gz RTIPZEAUQFAJTM-UHFFFAOYSA-N 1 2 306.394 4.244 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@@H+]1CCc2c(cccc2C(C)C)C1 ZINC001473442651 1061160268 /nfs/dbraw/zinc/16/02/68/1061160268.db2.gz DOEMXIRFPNHRQT-GOSISDBHSA-N 1 2 317.473 4.288 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@H+]1CCc2c(cccc2C(C)C)C1 ZINC001473442651 1061160281 /nfs/dbraw/zinc/16/02/81/1061160281.db2.gz DOEMXIRFPNHRQT-GOSISDBHSA-N 1 2 317.473 4.288 20 0 DIADLO CCc1ccc(C[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)nc1 ZINC001473443298 1061160615 /nfs/dbraw/zinc/16/06/15/1061160615.db2.gz DJBJDISPXQXDNR-OAQYLSRUSA-N 1 2 317.436 4.227 20 0 DIADLO CCSc1ccccc1C[C@@H](C)[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC001462430577 1061169609 /nfs/dbraw/zinc/16/96/09/1061169609.db2.gz ZDJPOGYBEQLHPK-ZIAGYGMSSA-N 1 2 323.502 4.049 20 0 DIADLO C[C@H]1CO[C@@H](C(F)(F)F)C[N@@H+]1CCc1ccc2ccccc2c1 ZINC001473460963 1061172010 /nfs/dbraw/zinc/17/20/10/1061172010.db2.gz JKRFWECWLYDBBZ-SUMWQHHRSA-N 1 2 323.358 4.034 20 0 DIADLO C[C@H]1CO[C@@H](C(F)(F)F)C[N@H+]1CCc1ccc2ccccc2c1 ZINC001473460963 1061172017 /nfs/dbraw/zinc/17/20/17/1061172017.db2.gz JKRFWECWLYDBBZ-SUMWQHHRSA-N 1 2 323.358 4.034 20 0 DIADLO COc1nc(CNc2ccc(Nc3ccccc3)c[nH+]2)ccc1C ZINC001462448492 1061179201 /nfs/dbraw/zinc/17/92/01/1061179201.db2.gz SYQUAHLFOVTPMW-UHFFFAOYSA-N 1 2 320.396 4.149 20 0 DIADLO CC1(C)CCC[C@@H]1CC[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1 ZINC001462454665 1061183717 /nfs/dbraw/zinc/18/37/17/1061183717.db2.gz HQBMCGFSXCGNGS-HZPDHXFCSA-N 1 2 304.482 4.232 20 0 DIADLO CCCc1cccc(C[N@@H+]2C[C@@H](C)O[C@@H](CC(F)(F)F)C2)c1 ZINC001462458876 1061186425 /nfs/dbraw/zinc/18/64/25/1061186425.db2.gz WLEQPVYMLXUDKA-CJNGLKHVSA-N 1 2 315.379 4.181 20 0 DIADLO CCCc1cccc(C[N@H+]2C[C@@H](C)O[C@@H](CC(F)(F)F)C2)c1 ZINC001462458876 1061186430 /nfs/dbraw/zinc/18/64/30/1061186430.db2.gz WLEQPVYMLXUDKA-CJNGLKHVSA-N 1 2 315.379 4.181 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[NH+]1CCC2(CCCC2)CC1 ZINC001473497919 1061192442 /nfs/dbraw/zinc/19/24/42/1061192442.db2.gz PIELMZXOCQGQHU-MRXNPFEDSA-N 1 2 321.848 4.210 20 0 DIADLO CCNc1nc(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)cs1 ZINC001473499821 1061193660 /nfs/dbraw/zinc/19/36/60/1061193660.db2.gz LXJYUEJUYCBODW-VIFPVBQESA-N 1 2 313.829 4.218 20 0 DIADLO CC(C)C[C@@H](C)[NH2+]c1ccc(N2CCOC[C@H]2C)c(Cl)c1 ZINC001462483006 1061203186 /nfs/dbraw/zinc/20/31/86/1061203186.db2.gz UBQFWYRWNRNKMQ-ZIAGYGMSSA-N 1 2 310.869 4.412 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)/C=C3/CC[C@H](C)C3)cc2)[nH+]c1C ZINC001455244734 1061214722 /nfs/dbraw/zinc/21/47/22/1061214722.db2.gz ALIYUMROTZTJBQ-CMHHUMAZSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C=C3CC[C@H](C)C3)cc2)[nH+]c1C ZINC001455244734 1061214745 /nfs/dbraw/zinc/21/47/45/1061214745.db2.gz ALIYUMROTZTJBQ-CMHHUMAZSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)Cc3ccccc3F)cc2)[nH+]c1C ZINC001455251294 1061215436 /nfs/dbraw/zinc/21/54/36/1061215436.db2.gz POFHURBGHUBDCF-UHFFFAOYSA-N 1 2 323.371 4.014 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)cc1-c1ccsc1 ZINC001455465962 1061221015 /nfs/dbraw/zinc/22/10/15/1061221015.db2.gz WJJVTIJRXYDGAH-HZPDHXFCSA-N 1 2 323.421 4.189 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)cc1-c1ccsc1 ZINC001455465962 1061221037 /nfs/dbraw/zinc/22/10/37/1061221037.db2.gz WJJVTIJRXYDGAH-HZPDHXFCSA-N 1 2 323.421 4.189 20 0 DIADLO CCCC1(CCC)CCCN1C(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001455444829 1061221524 /nfs/dbraw/zinc/22/15/24/1061221524.db2.gz DODZLDJKAHRSRJ-QGZVFWFLSA-N 1 2 319.493 4.432 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)n2cc[nH+]c2)cc1-c1ccsc1 ZINC001455465858 1061222534 /nfs/dbraw/zinc/22/25/34/1061222534.db2.gz VEYNTMOTKQAHJN-ZDUSSCGKSA-N 1 2 311.410 4.120 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1nc2ccccc2n1C1CCCCC1 ZINC001251091188 1061232220 /nfs/dbraw/zinc/23/22/20/1061232220.db2.gz AHGCFAJIOCRANV-UHFFFAOYSA-N 1 2 306.413 4.494 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)/C=C\C2CCCCCC2)[nH+]c1C ZINC001455773791 1061233234 /nfs/dbraw/zinc/23/32/34/1061233234.db2.gz SAKRPCMDPUFORV-CPFIRTDXSA-N 1 2 315.461 4.217 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](CCCc1ccccc1Cl)C2 ZINC001473542324 1061233854 /nfs/dbraw/zinc/23/38/54/1061233854.db2.gz RCDDPQLFIXJFRJ-UHFFFAOYSA-N 1 2 313.828 4.491 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](CCCc1ccccc1Cl)C2 ZINC001473542324 1061233879 /nfs/dbraw/zinc/23/38/79/1061233879.db2.gz RCDDPQLFIXJFRJ-UHFFFAOYSA-N 1 2 313.828 4.491 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)/C=C/C2CCCCCC2)[nH+]c1C ZINC001455773799 1061233815 /nfs/dbraw/zinc/23/38/15/1061233815.db2.gz SAKRPCMDPUFORV-FMQWLBJXSA-N 1 2 315.461 4.217 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@H](C)[C@@H]2C(=O)OC(C)(C)C)cc1F ZINC001473571287 1061258542 /nfs/dbraw/zinc/25/85/42/1061258542.db2.gz FEYVNZZRULIPCM-WMLDXEAASA-N 1 2 321.436 4.076 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@H](C)[C@@H]2C(=O)OC(C)(C)C)cc1F ZINC001473571287 1061258556 /nfs/dbraw/zinc/25/85/56/1061258556.db2.gz FEYVNZZRULIPCM-WMLDXEAASA-N 1 2 321.436 4.076 20 0 DIADLO CCN(Cc1cc[nH+]c(N(C)C)c1)c1cccc(C(F)(F)F)c1 ZINC001473576249 1061266510 /nfs/dbraw/zinc/26/65/10/1061266510.db2.gz WSIINCJZWDASKS-UHFFFAOYSA-N 1 2 323.362 4.193 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@H+](CCSC(F)(F)F)CC3 ZINC001473625682 1061300554 /nfs/dbraw/zinc/30/05/54/1061300554.db2.gz UAEIYFWBGDAMAF-UHFFFAOYSA-N 1 2 314.376 4.087 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](CCSC(F)(F)F)CC3 ZINC001473625682 1061300570 /nfs/dbraw/zinc/30/05/70/1061300570.db2.gz UAEIYFWBGDAMAF-UHFFFAOYSA-N 1 2 314.376 4.087 20 0 DIADLO CCCOc1ccc2nc(-c3cccc4[nH+]ccn43)n(CC)c2c1 ZINC001251326774 1061315222 /nfs/dbraw/zinc/31/52/22/1061315222.db2.gz XEXBRISRKYKUBO-UHFFFAOYSA-N 1 2 320.396 4.160 20 0 DIADLO CCCn1c2cc(OCC)ccc2nc1-c1cccc2[nH+]ccn21 ZINC001251326386 1061315939 /nfs/dbraw/zinc/31/59/39/1061315939.db2.gz GZQFCCJEWVVHMM-UHFFFAOYSA-N 1 2 320.396 4.160 20 0 DIADLO C[C@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1Cc2ccc(O)cc2C1 ZINC001473657544 1061321045 /nfs/dbraw/zinc/32/10/45/1061321045.db2.gz ITEGZYMCPVZOSS-LLVKDONJSA-N 1 2 323.314 4.368 20 0 DIADLO C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1Cc2ccc(O)cc2C1 ZINC001473657544 1061321063 /nfs/dbraw/zinc/32/10/63/1061321063.db2.gz ITEGZYMCPVZOSS-LLVKDONJSA-N 1 2 323.314 4.368 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@@H+]1C[C@H](C)O[C@@H](CC(F)(F)F)C1 ZINC001473661660 1061325199 /nfs/dbraw/zinc/32/51/99/1061325199.db2.gz UGOLIHHXUDTKHJ-TUKIKUTGSA-N 1 2 319.342 4.319 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@H+]1C[C@H](C)O[C@@H](CC(F)(F)F)C1 ZINC001473661660 1061325215 /nfs/dbraw/zinc/32/52/15/1061325215.db2.gz UGOLIHHXUDTKHJ-TUKIKUTGSA-N 1 2 319.342 4.319 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@H+]1C[C@@H](CC(F)(F)F)O[C@@H](C)C1 ZINC001473661659 1061325608 /nfs/dbraw/zinc/32/56/08/1061325608.db2.gz UGOLIHHXUDTKHJ-NILFDRSVSA-N 1 2 319.342 4.319 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@@H+]1C[C@@H](CC(F)(F)F)O[C@@H](C)C1 ZINC001473661659 1061325621 /nfs/dbraw/zinc/32/56/21/1061325621.db2.gz UGOLIHHXUDTKHJ-NILFDRSVSA-N 1 2 319.342 4.319 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@](C)(C(F)F)C1 ZINC001473661943 1061325981 /nfs/dbraw/zinc/32/59/81/1061325981.db2.gz ANFRXPNPENKZFU-ZFWWWQNUSA-N 1 2 303.780 4.147 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@](C)(C(F)F)C1 ZINC001473661943 1061326000 /nfs/dbraw/zinc/32/60/00/1061326000.db2.gz ANFRXPNPENKZFU-ZFWWWQNUSA-N 1 2 303.780 4.147 20 0 DIADLO CC(C)c1ccc(C[N@@H+]2CCC[C@H]2c2nnc[nH]2)c(C(C)C)c1 ZINC001473672446 1061331414 /nfs/dbraw/zinc/33/14/14/1061331414.db2.gz XBTQYNDRZLFBOH-SFHVURJKSA-N 1 2 312.461 4.389 20 0 DIADLO CC(C)c1ccc(C[N@H+]2CCC[C@H]2c2nnc[nH]2)c(C(C)C)c1 ZINC001473672446 1061331429 /nfs/dbraw/zinc/33/14/29/1061331429.db2.gz XBTQYNDRZLFBOH-SFHVURJKSA-N 1 2 312.461 4.389 20 0 DIADLO CCc1ccc2c(c1)C[N@@H+](Cc1c(Cl)n[nH]c1C1CC1)CC2 ZINC001462679856 1061333579 /nfs/dbraw/zinc/33/35/79/1061333579.db2.gz AYQXIQOZAXGOTO-UHFFFAOYSA-N 1 2 315.848 4.061 20 0 DIADLO CCc1ccc2c(c1)C[N@H+](Cc1c(Cl)n[nH]c1C1CC1)CC2 ZINC001462679856 1061333599 /nfs/dbraw/zinc/33/35/99/1061333599.db2.gz AYQXIQOZAXGOTO-UHFFFAOYSA-N 1 2 315.848 4.061 20 0 DIADLO Cc1cc(C(F)(F)F)ccc1C[NH+]1CC(Oc2ccccc2)C1 ZINC001462686726 1061338207 /nfs/dbraw/zinc/33/82/07/1061338207.db2.gz SBXNURKBZZUAGL-UHFFFAOYSA-N 1 2 321.342 4.277 20 0 DIADLO C[C@@H](c1cccc(Cl)c1F)[N@@H+]1Cc2c[nH]nc2CC(C)(C)C1 ZINC001473680816 1061340544 /nfs/dbraw/zinc/34/05/44/1061340544.db2.gz AHWOKOYXPXBDAG-NSHDSACASA-N 1 2 321.827 4.348 20 0 DIADLO C[C@@H](c1cccc(Cl)c1F)[N@H+]1Cc2c[nH]nc2CC(C)(C)C1 ZINC001473680816 1061340564 /nfs/dbraw/zinc/34/05/64/1061340564.db2.gz AHWOKOYXPXBDAG-NSHDSACASA-N 1 2 321.827 4.348 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H](C)c1ccc2ccccc2c1 ZINC001462734480 1061346856 /nfs/dbraw/zinc/34/68/56/1061346856.db2.gz XBPWKRZPCJFGHR-OAHLLOKOSA-N 1 2 304.393 4.016 20 0 DIADLO C=C/C=C/CC[NH2+][C@@H](Cc1cccc2ccccc21)C(=O)OCC ZINC001473699124 1061355403 /nfs/dbraw/zinc/35/54/03/1061355403.db2.gz BRHUHYYIQQRGNQ-XJDXJNMNSA-N 1 2 323.436 4.036 20 0 DIADLO Cn1c2ccccc2nc1-c1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001251507843 1061383829 /nfs/dbraw/zinc/38/38/29/1061383829.db2.gz VFFIZQOOHSPZHZ-UHFFFAOYSA-N 1 2 308.772 4.079 20 0 DIADLO Fc1cccc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3Cl)nc21 ZINC001251507801 1061383911 /nfs/dbraw/zinc/38/39/11/1061383911.db2.gz SUAMLTFHDDQGOJ-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO C[C@H]([NH2+]Cc1nccc(Cl)c1Cl)c1cc2cnccc2o1 ZINC001473743223 1061384790 /nfs/dbraw/zinc/38/47/90/1061384790.db2.gz FEPAUOFZHGTYEO-VIFPVBQESA-N 1 2 322.195 4.380 20 0 DIADLO CC[N@H+](Cc1c(F)cccc1Cl)[C@H](CO)c1ccccc1 ZINC001473746336 1061385677 /nfs/dbraw/zinc/38/56/77/1061385677.db2.gz GSHYAGHGTDFMES-QGZVFWFLSA-N 1 2 307.796 4.035 20 0 DIADLO CC[N@@H+](Cc1c(F)cccc1Cl)[C@H](CO)c1ccccc1 ZINC001473746336 1061385691 /nfs/dbraw/zinc/38/56/91/1061385691.db2.gz GSHYAGHGTDFMES-QGZVFWFLSA-N 1 2 307.796 4.035 20 0 DIADLO C[C@@H](C[N@H+](C)Cc1ncsc1Br)C(C)(C)C ZINC001473779536 1061405657 /nfs/dbraw/zinc/40/56/57/1061405657.db2.gz PNTOATDQCXAORC-VIFPVBQESA-N 1 2 305.285 4.020 20 0 DIADLO C[C@@H](C[N@@H+](C)Cc1ncsc1Br)C(C)(C)C ZINC001473779536 1061405662 /nfs/dbraw/zinc/40/56/62/1061405662.db2.gz PNTOATDQCXAORC-VIFPVBQESA-N 1 2 305.285 4.020 20 0 DIADLO Cc1cc(C)c(C(=O)N(C)Cc2cc3ccccc3o2)c(C)[nH+]1 ZINC001457434269 1061455183 /nfs/dbraw/zinc/45/51/83/1061455183.db2.gz JDUJBWKXWAFAGA-UHFFFAOYSA-N 1 2 308.381 4.025 20 0 DIADLO c1cn(-c2csc(CNc3cccc4cnccc43)c2)c[nH+]1 ZINC001473944805 1061488731 /nfs/dbraw/zinc/48/87/31/1061488731.db2.gz JWMBJIMWPHFQBB-UHFFFAOYSA-N 1 2 306.394 4.094 20 0 DIADLO Cc1cn(C(C)(C)C(=O)Nc2ccc(-c3ccccc3)cc2)c[nH+]1 ZINC001463617436 1061503427 /nfs/dbraw/zinc/50/34/27/1061503427.db2.gz UGNDWQSBCUWUSA-UHFFFAOYSA-N 1 2 319.408 4.232 20 0 DIADLO CCCc1nsc(Nc2ccc([NH+]3CCCCC3)cc2)n1 ZINC001458062045 1061550971 /nfs/dbraw/zinc/55/09/71/1061550971.db2.gz NLBATOUHUPKBNM-UHFFFAOYSA-N 1 2 302.447 4.225 20 0 DIADLO CCn1ccc(C[NH2+][C@H](Cc2ccccc2)c2ccccc2F)n1 ZINC001474012230 1061551218 /nfs/dbraw/zinc/55/12/18/1061551218.db2.gz GAUPOHMXWQEJLI-HXUWFJFHSA-N 1 2 323.415 4.116 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[NH2+]Cc1ccn(C2CCCC2)n1 ZINC001474051356 1061597431 /nfs/dbraw/zinc/59/74/31/1061597431.db2.gz YEZTZMQBFQECGM-UHFFFAOYSA-N 1 2 315.461 4.487 20 0 DIADLO COc1ccc(Cl)cc1NCc1cc(-n2cc[nH+]c2)cs1 ZINC001474062202 1061608321 /nfs/dbraw/zinc/60/83/21/1061608321.db2.gz MPNNCBNVIMVGRH-UHFFFAOYSA-N 1 2 319.817 4.208 20 0 DIADLO CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001464603588 1061610485 /nfs/dbraw/zinc/61/04/85/1061610485.db2.gz HCEKHSPVBDZCTL-FMKPAKJESA-N 1 2 313.445 4.001 20 0 DIADLO Fc1ccc(C[NH2+][C@H]2COc3ccc(Cl)cc32)c(Cl)c1 ZINC001474065758 1061612937 /nfs/dbraw/zinc/61/29/37/1061612937.db2.gz UJZXRFKESHITLJ-AWEZNQCLSA-N 1 2 312.171 4.356 20 0 DIADLO CCOc1cc(C)ccc1C[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC001474066738 1061613391 /nfs/dbraw/zinc/61/33/91/1061613391.db2.gz KCOIWWSOLDXJJG-UHFFFAOYSA-N 1 2 318.486 4.438 20 0 DIADLO Cc1cc(N(C)[C@@H](C)Cc2ccc(Cl)cc2)nc(C2CC2)[nH+]1 ZINC001458177779 1061613638 /nfs/dbraw/zinc/61/36/38/1061613638.db2.gz GPCXTKNWAIANCW-ZDUSSCGKSA-N 1 2 315.848 4.383 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)c(F)c1F)c1cccc(F)c1F ZINC001474077119 1061623375 /nfs/dbraw/zinc/62/33/75/1061623375.db2.gz QELSNVZLVBXTAZ-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO Cn1c(CNc2ccc(N3CCCCC3)[nH+]c2)cc2ccccc21 ZINC001474078389 1061624897 /nfs/dbraw/zinc/62/48/97/1061624897.db2.gz KTDMKQAZNRHHSB-UHFFFAOYSA-N 1 2 320.440 4.176 20 0 DIADLO CSc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)cc1 ZINC001464826133 1061637079 /nfs/dbraw/zinc/63/70/79/1061637079.db2.gz NCTKESSHLOGOOV-UHFFFAOYSA-N 1 2 323.421 4.155 20 0 DIADLO Cc1cc(NC(=O)C2CCC(C3CC3)CC2)ccc1-n1cc[nH+]c1 ZINC001464829515 1061639644 /nfs/dbraw/zinc/63/96/44/1061639644.db2.gz MDMWBHFXDDJYQH-UHFFFAOYSA-N 1 2 323.440 4.336 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2CC[C@H](C)[C@H](C)C2)ccc1-n1cc[nH+]c1 ZINC001464832403 1061640442 /nfs/dbraw/zinc/64/04/42/1061640442.db2.gz XMWJHRUZHVPEBE-SQWLQELKSA-N 1 2 311.429 4.192 20 0 DIADLO CC[C@H]1CCCC[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001464831394 1061640816 /nfs/dbraw/zinc/64/08/16/1061640816.db2.gz RRLJRKKZZQYVLO-DOTOQJQBSA-N 1 2 311.429 4.336 20 0 DIADLO CCc1cc(N2C[C@@H](C)C[C@H]2c2ccccc2F)nc(CC)[nH+]1 ZINC001458223217 1061642574 /nfs/dbraw/zinc/64/25/74/1061642574.db2.gz BZUPFYLPXYIMAJ-GUYCJALGSA-N 1 2 313.420 4.328 20 0 DIADLO Cc1cc([N@H+]2CCCC[C@H]2C)ccc1Nc1cnc(F)cn1 ZINC001458257308 1061663274 /nfs/dbraw/zinc/66/32/74/1061663274.db2.gz AMBRTSNTYOTWJE-CYBMUJFWSA-N 1 2 300.381 4.047 20 0 DIADLO Cc1cc([N@@H+]2CCCC[C@H]2C)ccc1Nc1cnc(F)cn1 ZINC001458257308 1061663286 /nfs/dbraw/zinc/66/32/86/1061663286.db2.gz AMBRTSNTYOTWJE-CYBMUJFWSA-N 1 2 300.381 4.047 20 0 DIADLO CCCCC[C@@H]1CCCN1c1nc2ccccc2n2c[nH+]cc12 ZINC001458268731 1061670204 /nfs/dbraw/zinc/67/02/04/1061670204.db2.gz XJUZUOCJGZDBOA-OAHLLOKOSA-N 1 2 308.429 4.432 20 0 DIADLO CCc1cc(NCC2(c3ccccc3Cl)CC2)nc(CC)[nH+]1 ZINC001458304344 1061685791 /nfs/dbraw/zinc/68/57/91/1061685791.db2.gz WHLDZWZRZXJZLA-UHFFFAOYSA-N 1 2 315.848 4.399 20 0 DIADLO Cc1nc(NC2CC(C)(c3ccccc3)C2)c2c([nH+]1)CCCC2 ZINC001458349386 1061714763 /nfs/dbraw/zinc/71/47/63/1061714763.db2.gz ZZSFRUZKHGDKFN-UHFFFAOYSA-N 1 2 307.441 4.196 20 0 DIADLO Cc1nc(N[C@H]2CCCc3ccc(F)cc32)c2c([nH+]1)CCCC2 ZINC001458370967 1061728004 /nfs/dbraw/zinc/72/80/04/1061728004.db2.gz VJZKMJOHTZDXKL-SFHVURJKSA-N 1 2 311.404 4.292 20 0 DIADLO CC[C@H](c1ccccc1OC)N(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC001458407481 1061745438 /nfs/dbraw/zinc/74/54/38/1061745438.db2.gz VASNDFAALNPPRJ-MRXNPFEDSA-N 1 2 311.429 4.259 20 0 DIADLO CC[C@@H](c1ccccc1OC)N(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC001458407476 1061746396 /nfs/dbraw/zinc/74/63/96/1061746396.db2.gz VASNDFAALNPPRJ-INIZCTEOSA-N 1 2 311.429 4.259 20 0 DIADLO CC[C@H](CNc1cc(C)[nH+]c(C2CCC2)n1)CC(F)(F)F ZINC001458435021 1061761901 /nfs/dbraw/zinc/76/19/01/1061761901.db2.gz ZJHDSGKFLTXEIA-NSHDSACASA-N 1 2 301.356 4.443 20 0 DIADLO COc1ccc(CC[C@@H](C)Nc2c[nH+]cc3c2CCCC3)cc1 ZINC001474208399 1061762519 /nfs/dbraw/zinc/76/25/19/1061762519.db2.gz CVKPJXMXHZBXFK-OAHLLOKOSA-N 1 2 310.441 4.402 20 0 DIADLO Cc1cc(C[NH2+][C@@H](CCc2ccccc2)C(F)F)ccc1F ZINC001474209560 1061767059 /nfs/dbraw/zinc/76/70/59/1061767059.db2.gz FJRDGKPYEGJSSO-KRWDZBQOSA-N 1 2 307.359 4.490 20 0 DIADLO FC[C@H]([NH2+]Cc1cnc(-c2ccco2)s1)c1ccc(F)cc1 ZINC001474242694 1061806166 /nfs/dbraw/zinc/80/61/66/1061806166.db2.gz QSAJNDNBHAVLPH-AWEZNQCLSA-N 1 2 320.364 4.343 20 0 DIADLO CCc1cc(N2CCC[C@]2(C)Cc2ccc(C)cc2)nc(C)[nH+]1 ZINC001458514021 1061812700 /nfs/dbraw/zinc/81/27/00/1061812700.db2.gz HVYALWQHKBQHEV-HXUWFJFHSA-N 1 2 309.457 4.257 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cc(OC)ccc1F ZINC001474246113 1061812783 /nfs/dbraw/zinc/81/27/83/1061812783.db2.gz ZLEKOGBARVDVTL-UHFFFAOYSA-N 1 2 306.406 4.095 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(Cl)cc2OC(C)C)sc1C ZINC001474251126 1061819363 /nfs/dbraw/zinc/81/93/63/1061819363.db2.gz KKWJIUWRLUTNHY-UHFFFAOYSA-N 1 2 324.877 4.490 20 0 DIADLO CCOc1cccc(F)c1CNc1[nH]c2ccc(Cl)cc2[nH+]1 ZINC001474257280 1061825132 /nfs/dbraw/zinc/82/51/32/1061825132.db2.gz IVIVRKTYACSLGK-UHFFFAOYSA-N 1 2 319.767 4.366 20 0 DIADLO CCOc1cccc(F)c1CNc1[nH]c2cc(Cl)ccc2[nH+]1 ZINC001474257280 1061825148 /nfs/dbraw/zinc/82/51/48/1061825148.db2.gz IVIVRKTYACSLGK-UHFFFAOYSA-N 1 2 319.767 4.366 20 0 DIADLO Fc1ccc(/C=C\CNc2[nH]c3ccc(Cl)cc3[nH+]2)cc1 ZINC001474257011 1061826198 /nfs/dbraw/zinc/82/61/98/1061826198.db2.gz DFEWPNQJWNOJSS-UPHRSURJSA-N 1 2 301.752 4.481 20 0 DIADLO Fc1ccc(/C=C/CNc2[nH]c3ccc(Cl)cc3[nH+]2)cc1 ZINC001474257010 1061826291 /nfs/dbraw/zinc/82/62/91/1061826291.db2.gz DFEWPNQJWNOJSS-OWOJBTEDSA-N 1 2 301.752 4.481 20 0 DIADLO CCc1cc(N2CC[C@@H](c3ccccc3F)C2(C)C)nc(C)[nH+]1 ZINC001458547905 1061831179 /nfs/dbraw/zinc/83/11/79/1061831179.db2.gz PMIKUKFHEFRUMM-INIZCTEOSA-N 1 2 313.420 4.259 20 0 DIADLO CC(C)Oc1ccc(C[NH2+][C@H]2c3ccccc3OC[C@@H]2F)cc1 ZINC001474266066 1061831791 /nfs/dbraw/zinc/83/17/91/1061831791.db2.gz LOEZIYVGIJTWGV-HKUYNNGSSA-N 1 2 315.388 4.035 20 0 DIADLO CCc1[nH]nc(Cl)c1CNc1ccc2[nH+]c(C)cc(C)c2c1 ZINC001474268110 1061836026 /nfs/dbraw/zinc/83/60/26/1061836026.db2.gz TUFANGDYGRBINS-UHFFFAOYSA-N 1 2 314.820 4.403 20 0 DIADLO Cc1ccc2sc(CNc3cc(C)[nH+]c(C4CC4)n3)nc2c1 ZINC001458558499 1061836219 /nfs/dbraw/zinc/83/62/19/1061836219.db2.gz XJLANOWLKDBZCT-UHFFFAOYSA-N 1 2 310.426 4.193 20 0 DIADLO Cc1ncoc1-c1ccc(NCc2c[nH+]c3c(C)cccn23)cc1 ZINC001474275169 1061841840 /nfs/dbraw/zinc/84/18/40/1061841840.db2.gz NNNHPBREOZDJMD-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO Cc1[nH]c(CNc2nc3c(cc(Cl)cc3F)s2)[nH+]c1C ZINC001458616396 1061853629 /nfs/dbraw/zinc/85/36/29/1061853629.db2.gz HLBVOXONEJSMFT-UHFFFAOYSA-N 1 2 310.785 4.041 20 0 DIADLO Cc1cc(NC(=O)C[C@@H](C)n2cc[nH+]c2)ccc1-c1ccccc1 ZINC001458630808 1061861273 /nfs/dbraw/zinc/86/12/73/1061861273.db2.gz MVHZCFZHWMXNQY-MRXNPFEDSA-N 1 2 319.408 4.448 20 0 DIADLO CC[N@H+](Cc1cnc(-c2ccccc2)nc1)Cc1ccccc1F ZINC001253303940 1061869428 /nfs/dbraw/zinc/86/94/28/1061869428.db2.gz LKSQGCCNGGVJMT-UHFFFAOYSA-N 1 2 321.399 4.305 20 0 DIADLO CC[N@@H+](Cc1cnc(-c2ccccc2)nc1)Cc1ccccc1F ZINC001253303940 1061869447 /nfs/dbraw/zinc/86/94/47/1061869447.db2.gz LKSQGCCNGGVJMT-UHFFFAOYSA-N 1 2 321.399 4.305 20 0 DIADLO CCc1cccc2cc(C[NH2+][C@H](c3nc(C)no3)C(C)C)oc21 ZINC001474306523 1061874034 /nfs/dbraw/zinc/87/40/34/1061874034.db2.gz DUVYHADEHMTPMS-INIZCTEOSA-N 1 2 313.401 4.174 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1ccccc1CC(F)(F)F)CC2 ZINC001474327785 1061915177 /nfs/dbraw/zinc/91/51/77/1061915177.db2.gz IMLVQLZKHYDBIH-UHFFFAOYSA-N 1 2 323.333 4.489 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1ccccc1CC(F)(F)F)CC2 ZINC001474327785 1061915195 /nfs/dbraw/zinc/91/51/95/1061915195.db2.gz IMLVQLZKHYDBIH-UHFFFAOYSA-N 1 2 323.333 4.489 20 0 DIADLO CC1(C[N@@H+]2CCc3[nH]c4c(cccc4Br)c3C2)CC1 ZINC001474340990 1061940444 /nfs/dbraw/zinc/94/04/44/1061940444.db2.gz FQRFXNGIJJPGTG-UHFFFAOYSA-N 1 2 319.246 4.089 20 0 DIADLO CC1(C[N@H+]2CCc3[nH]c4c(cccc4Br)c3C2)CC1 ZINC001474340990 1061940459 /nfs/dbraw/zinc/94/04/59/1061940459.db2.gz FQRFXNGIJJPGTG-UHFFFAOYSA-N 1 2 319.246 4.089 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3C[C@@H](C)OC[C@H]3c3ccccc3)cc21 ZINC001474349974 1061957661 /nfs/dbraw/zinc/95/76/61/1061957661.db2.gz BXJCPIPENGOQMR-IERDGZPVSA-N 1 2 320.436 4.438 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3C[C@@H](C)OC[C@H]3c3ccccc3)cc21 ZINC001474349974 1061957680 /nfs/dbraw/zinc/95/76/80/1061957680.db2.gz BXJCPIPENGOQMR-IERDGZPVSA-N 1 2 320.436 4.438 20 0 DIADLO CON(C[C@@H]1CCC[C@H](C)C1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001466755254 1061998646 /nfs/dbraw/zinc/99/86/46/1061998646.db2.gz NYRSUJVHFSOETE-BLLLJJGKSA-N 1 2 319.449 4.228 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@@H](C)Cc2ccsc2)c(C)[nH+]1 ZINC001466754845 1062000180 /nfs/dbraw/zinc/00/01/80/1062000180.db2.gz IJVREDBADPTSRE-ZDUSSCGKSA-N 1 2 317.458 4.163 20 0 DIADLO CCCc1nnc([C@H](c2ccccc2)[N@H+](C)Cc2ccccc2)o1 ZINC001253976307 1062008980 /nfs/dbraw/zinc/00/89/80/1062008980.db2.gz AJUYAPMHVOULLT-IBGZPJMESA-N 1 2 321.424 4.244 20 0 DIADLO CCCc1nnc([C@H](c2ccccc2)[N@@H+](C)Cc2ccccc2)o1 ZINC001253976307 1062009001 /nfs/dbraw/zinc/00/90/01/1062009001.db2.gz AJUYAPMHVOULLT-IBGZPJMESA-N 1 2 321.424 4.244 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CCO[C@H](c4ccc(F)cc4)C3)[nH]c2c1 ZINC001474377935 1062018226 /nfs/dbraw/zinc/01/82/26/1062018226.db2.gz ZUEKJABMTDLANF-FQEVSTJZSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CCO[C@H](c4ccc(F)cc4)C3)[nH]c2c1 ZINC001474377935 1062018242 /nfs/dbraw/zinc/01/82/42/1062018242.db2.gz ZUEKJABMTDLANF-FQEVSTJZSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@@H](Cc3ccccc3)C2)ccc1Cl ZINC001474397073 1062052895 /nfs/dbraw/zinc/05/28/95/1062052895.db2.gz ROTXIBKMOLSTKV-SFHVURJKSA-N 1 2 315.844 4.092 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@@H](Cc3ccccc3)C2)ccc1Cl ZINC001474397073 1062052915 /nfs/dbraw/zinc/05/29/15/1062052915.db2.gz ROTXIBKMOLSTKV-SFHVURJKSA-N 1 2 315.844 4.092 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC001474396160 1062053104 /nfs/dbraw/zinc/05/31/04/1062053104.db2.gz GTNZINUPFKQWNY-AVGNSLFASA-N 1 2 311.853 4.152 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@H](Cc3ccccc3)C2)ccc1Cl ZINC001474397072 1062054017 /nfs/dbraw/zinc/05/40/17/1062054017.db2.gz ROTXIBKMOLSTKV-GOSISDBHSA-N 1 2 315.844 4.092 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@H](Cc3ccccc3)C2)ccc1Cl ZINC001474397072 1062054031 /nfs/dbraw/zinc/05/40/31/1062054031.db2.gz ROTXIBKMOLSTKV-GOSISDBHSA-N 1 2 315.844 4.092 20 0 DIADLO FC1(F)CCC([N@@H+]2CCOC[C@@H]2c2ccccc2Cl)CC1 ZINC001254225611 1062056772 /nfs/dbraw/zinc/05/67/72/1062056772.db2.gz AAZXRIKTKYZKFI-OAHLLOKOSA-N 1 2 315.791 4.291 20 0 DIADLO FC1(F)CCC([N@H+]2CCOC[C@@H]2c2ccccc2Cl)CC1 ZINC001254225611 1062056789 /nfs/dbraw/zinc/05/67/89/1062056789.db2.gz AAZXRIKTKYZKFI-OAHLLOKOSA-N 1 2 315.791 4.291 20 0 DIADLO CCCCC[C@H](NC(=O)Nc1ccc2[nH+]ccn2c1)C(C)(C)C ZINC001467065312 1062061834 /nfs/dbraw/zinc/06/18/34/1062061834.db2.gz KOQVUNMUTVICKS-HNNXBMFYSA-N 1 2 316.449 4.451 20 0 DIADLO CC(C)C[C@@H]([NH2+]C[C@@H](C)c1ccc(F)cc1)C(=O)OC(C)(C)C ZINC001474408069 1062066873 /nfs/dbraw/zinc/06/68/73/1062066873.db2.gz KVTRTDRKXPFQIF-RHSMWYFYSA-N 1 2 323.452 4.275 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](C)Cc1cccc(O)c1Br ZINC001474410296 1062074145 /nfs/dbraw/zinc/07/41/45/1062074145.db2.gz PKIKFKOUYNCJJH-GFCCVEGCSA-N 1 2 320.230 4.348 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1cccc(O)c1Br ZINC001474410296 1062074168 /nfs/dbraw/zinc/07/41/68/1062074168.db2.gz PKIKFKOUYNCJJH-GFCCVEGCSA-N 1 2 320.230 4.348 20 0 DIADLO C[N@H+](Cc1ccnn1CC1CC1)Cc1ccc(Cl)c(Cl)c1 ZINC001474415613 1062085498 /nfs/dbraw/zinc/08/54/98/1062085498.db2.gz YTAPMBCUTRUFKY-UHFFFAOYSA-N 1 2 324.255 4.232 20 0 DIADLO C[N@@H+](Cc1ccnn1CC1CC1)Cc1ccc(Cl)c(Cl)c1 ZINC001474415613 1062085513 /nfs/dbraw/zinc/08/55/13/1062085513.db2.gz YTAPMBCUTRUFKY-UHFFFAOYSA-N 1 2 324.255 4.232 20 0 DIADLO Cc1[nH]nc(C[N@@H+]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)c1C ZINC001474419263 1062091773 /nfs/dbraw/zinc/09/17/73/1062091773.db2.gz YWYSKTVVTMEHEA-AWEZNQCLSA-N 1 2 323.362 4.035 20 0 DIADLO Cc1[nH]nc(C[N@H+]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)c1C ZINC001474419263 1062091798 /nfs/dbraw/zinc/09/17/98/1062091798.db2.gz YWYSKTVVTMEHEA-AWEZNQCLSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccc(F)c(F)c1F ZINC001474437549 1062114426 /nfs/dbraw/zinc/11/44/26/1062114426.db2.gz ZYIPJUBQKBQDRK-WCBMZHEXSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccc(F)c(F)c1F ZINC001474437549 1062114440 /nfs/dbraw/zinc/11/44/40/1062114440.db2.gz ZYIPJUBQKBQDRK-WCBMZHEXSA-N 1 2 311.269 4.267 20 0 DIADLO CCc1ccc([C@H]2C[N@H+](Cc3cccc(C)c3F)CCO2)cc1 ZINC001474444592 1062124357 /nfs/dbraw/zinc/12/43/57/1062124357.db2.gz QCPIWVXLGNATNX-LJQANCHMSA-N 1 2 313.416 4.270 20 0 DIADLO CCc1ccc([C@H]2C[N@@H+](Cc3cccc(C)c3F)CCO2)cc1 ZINC001474444592 1062124368 /nfs/dbraw/zinc/12/43/68/1062124368.db2.gz QCPIWVXLGNATNX-LJQANCHMSA-N 1 2 313.416 4.270 20 0 DIADLO CCO[C@@H]1C[C@@H](Nc2[nH+]cccc2OC(C)C)C12CCCCC2 ZINC001474451257 1062128737 /nfs/dbraw/zinc/12/87/37/1062128737.db2.gz GZPAJYGMSGAMCZ-IAGOWNOFSA-N 1 2 318.461 4.409 20 0 DIADLO CCOC(=O)C[N@H+](Cc1ccc(Cl)c2ccccc12)C1CC1 ZINC001459407173 1062131434 /nfs/dbraw/zinc/13/14/34/1062131434.db2.gz STZWHHPGJFMGFH-UHFFFAOYSA-N 1 2 317.816 4.021 20 0 DIADLO CCOC(=O)C[N@@H+](Cc1ccc(Cl)c2ccccc12)C1CC1 ZINC001459407173 1062131443 /nfs/dbraw/zinc/13/14/43/1062131443.db2.gz STZWHHPGJFMGFH-UHFFFAOYSA-N 1 2 317.816 4.021 20 0 DIADLO Cc1cccc2c1CCCN2Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001459478016 1062162664 /nfs/dbraw/zinc/16/26/64/1062162664.db2.gz MPUNLMJJOLECHX-UHFFFAOYSA-N 1 2 303.409 4.134 20 0 DIADLO Clc1ccnc(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)c1Cl ZINC001459602339 1062240140 /nfs/dbraw/zinc/24/01/40/1062240140.db2.gz LRXLDJJBYVDXMI-CHWSQXEVSA-N 1 2 317.285 4.248 20 0 DIADLO Clc1ccnc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c1Cl ZINC001459602339 1062240166 /nfs/dbraw/zinc/24/01/66/1062240166.db2.gz LRXLDJJBYVDXMI-CHWSQXEVSA-N 1 2 317.285 4.248 20 0 DIADLO C[C@H]1CC[C@H](c2ccccc2)[N@H+](Cc2cc(C(F)(F)F)n[nH]2)C1 ZINC001474518539 1062202961 /nfs/dbraw/zinc/20/29/61/1062202961.db2.gz ZIVLZUWOBMKXQG-SWLSCSKDSA-N 1 2 323.362 4.402 20 0 DIADLO C[C@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2cc(C(F)(F)F)n[nH]2)C1 ZINC001474518539 1062202981 /nfs/dbraw/zinc/20/29/81/1062202981.db2.gz ZIVLZUWOBMKXQG-SWLSCSKDSA-N 1 2 323.362 4.402 20 0 DIADLO CC(C)(C)c1coc(C[NH+]2CC(c3ccc(Cl)cc3)C2)n1 ZINC001474528599 1062212240 /nfs/dbraw/zinc/21/22/40/1062212240.db2.gz RCTDNRXCGFTSNO-UHFFFAOYSA-N 1 2 304.821 4.225 20 0 DIADLO Fc1cc2[nH]c(C[N@@H+]3CC[C@H]3C3CC3)cc2c(Br)c1 ZINC001474535970 1062221894 /nfs/dbraw/zinc/22/18/94/1062221894.db2.gz AZXJUWSAHPCMJH-HNNXBMFYSA-N 1 2 323.209 4.054 20 0 DIADLO Fc1cc2[nH]c(C[N@H+]3CC[C@H]3C3CC3)cc2c(Br)c1 ZINC001474535970 1062221906 /nfs/dbraw/zinc/22/19/06/1062221906.db2.gz AZXJUWSAHPCMJH-HNNXBMFYSA-N 1 2 323.209 4.054 20 0 DIADLO Cc1ccccc1CC[N@@H+](C)Cc1csc(C(F)(F)F)n1 ZINC001474544761 1062239489 /nfs/dbraw/zinc/23/94/89/1062239489.db2.gz VNBXCFGJZVBAHU-UHFFFAOYSA-N 1 2 314.376 4.145 20 0 DIADLO Cc1ccccc1CC[N@H+](C)Cc1csc(C(F)(F)F)n1 ZINC001474544761 1062239500 /nfs/dbraw/zinc/23/95/00/1062239500.db2.gz VNBXCFGJZVBAHU-UHFFFAOYSA-N 1 2 314.376 4.145 20 0 DIADLO Brc1ccc([C@H]2CCC[N@@H+]2Cc2ccns2)cc1 ZINC001459618575 1062253242 /nfs/dbraw/zinc/25/32/42/1062253242.db2.gz UEXJKJCKVRVZJD-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc([C@H]2CCC[N@H+]2Cc2ccns2)cc1 ZINC001459618575 1062253261 /nfs/dbraw/zinc/25/32/61/1062253261.db2.gz UEXJKJCKVRVZJD-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO CCCCCOC1C[NH+](Cc2ccccc2N2CCCCC2)C1 ZINC001474567697 1062270589 /nfs/dbraw/zinc/27/05/89/1062270589.db2.gz KRBDANPEMOCDDU-UHFFFAOYSA-N 1 2 316.489 4.068 20 0 DIADLO Fc1cncc(F)c1C[N@@H+]1C[C@@H]2CCCC[C@]21c1ccccc1 ZINC001459677112 1062299408 /nfs/dbraw/zinc/29/94/08/1062299408.db2.gz OBNIWBUQEJACES-KXBFYZLASA-N 1 2 314.379 4.261 20 0 DIADLO Fc1cncc(F)c1C[N@H+]1C[C@@H]2CCCC[C@]21c1ccccc1 ZINC001459677112 1062299428 /nfs/dbraw/zinc/29/94/28/1062299428.db2.gz OBNIWBUQEJACES-KXBFYZLASA-N 1 2 314.379 4.261 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ccc(O)c(F)c1F)c1ccccc1F ZINC001474619567 1062342967 /nfs/dbraw/zinc/34/29/67/1062342967.db2.gz YNGFBDDPUNTZCP-KRWDZBQOSA-N 1 2 309.331 4.296 20 0 DIADLO Clc1ccc([C@@H](c2nnc(C3CCC3)o2)[NH+]2CCCC2)cc1 ZINC001255202524 1062354918 /nfs/dbraw/zinc/35/49/18/1062354918.db2.gz VBJIGDQYPJCBCS-HNNXBMFYSA-N 1 2 317.820 4.176 20 0 DIADLO CCc1cccc2cc(C[N@@H+]3C[C@@H](C)O[C@](C)(C(F)F)C3)oc21 ZINC001474636606 1062361732 /nfs/dbraw/zinc/36/17/32/1062361732.db2.gz QWFNQTNSPPQSMT-XIKOKIGWSA-N 1 2 323.383 4.240 20 0 DIADLO CCc1cccc2cc(C[N@H+]3C[C@@H](C)O[C@](C)(C(F)F)C3)oc21 ZINC001474636606 1062361754 /nfs/dbraw/zinc/36/17/54/1062361754.db2.gz QWFNQTNSPPQSMT-XIKOKIGWSA-N 1 2 323.383 4.240 20 0 DIADLO CC(C)[N@H+](CCc1cccc(OC(F)(F)F)c1)CC(F)F ZINC001459764183 1062374218 /nfs/dbraw/zinc/37/42/18/1062374218.db2.gz OYTJSQREOIFNNB-UHFFFAOYSA-N 1 2 311.294 4.103 20 0 DIADLO CC(C)[N@@H+](CCc1cccc(OC(F)(F)F)c1)CC(F)F ZINC001459764183 1062374236 /nfs/dbraw/zinc/37/42/36/1062374236.db2.gz OYTJSQREOIFNNB-UHFFFAOYSA-N 1 2 311.294 4.103 20 0 DIADLO CCCOc1ccc(NCc2[nH+]cc(C)c(OC)c2C)cc1F ZINC001474653265 1062381523 /nfs/dbraw/zinc/38/15/23/1062381523.db2.gz QVUULDBAIABCFP-UHFFFAOYSA-N 1 2 318.392 4.247 20 0 DIADLO Cc1cc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)sn1 ZINC001459783374 1062395907 /nfs/dbraw/zinc/39/59/07/1062395907.db2.gz AHVPHHQUQDCZMX-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO Cc1cc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)sn1 ZINC001459783374 1062395925 /nfs/dbraw/zinc/39/59/25/1062395925.db2.gz AHVPHHQUQDCZMX-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@@H+]1CCC[C@@](F)(c2ccccc2)C1 ZINC001474673769 1062405282 /nfs/dbraw/zinc/40/52/82/1062405282.db2.gz OFQZFQKHTZFQHT-KRWDZBQOSA-N 1 2 321.827 4.086 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@H+]1CCC[C@@](F)(c2ccccc2)C1 ZINC001474673769 1062405290 /nfs/dbraw/zinc/40/52/90/1062405290.db2.gz OFQZFQKHTZFQHT-KRWDZBQOSA-N 1 2 321.827 4.086 20 0 DIADLO Cc1ccc(N2CC[NH+](Cc3cc(F)ccc3Cl)CC2)cc1 ZINC001459799855 1062408729 /nfs/dbraw/zinc/40/87/29/1062408729.db2.gz UEAQYHLJZHANQX-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO COc1cc(F)cc(C[N@@H+]2CCc3ccc(Cl)c(C)c3C2)c1 ZINC001474677649 1062409058 /nfs/dbraw/zinc/40/90/58/1062409058.db2.gz RZWMFRFWXCJAHS-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO COc1cc(F)cc(C[N@H+]2CCc3ccc(Cl)c(C)c3C2)c1 ZINC001474677649 1062409068 /nfs/dbraw/zinc/40/90/68/1062409068.db2.gz RZWMFRFWXCJAHS-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO Cc1cc(NC2CCN(c3ccc(F)cc3F)CC2)c[nH+]c1C ZINC001474684087 1062416101 /nfs/dbraw/zinc/41/61/01/1062416101.db2.gz GXFVRSMEGYOYET-UHFFFAOYSA-N 1 2 317.383 4.058 20 0 DIADLO Fc1cccc(C2CC[NH+](Cc3c(Cl)ccnc3F)CC2)c1 ZINC001474694423 1062423776 /nfs/dbraw/zinc/42/37/76/1062423776.db2.gz CVCQPGIVQSSINS-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO COC1CCC([NH2+][C@@H](c2cccc(Cl)c2)C(F)F)CC1 ZINC001474707024 1062434264 /nfs/dbraw/zinc/43/42/64/1062434264.db2.gz OJOKBOWPYGUBPL-RUXDESIVSA-N 1 2 303.780 4.193 20 0 DIADLO Cc1nn(C)c(Cl)c1C[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC001459834030 1062436141 /nfs/dbraw/zinc/43/61/41/1062436141.db2.gz HKTGGVCTUKWHLD-VIFPVBQESA-N 1 2 316.207 4.025 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1nsc2ccccc12 ZINC001459842582 1062444496 /nfs/dbraw/zinc/44/44/96/1062444496.db2.gz NUPOLAKANULEDI-NSHDSACASA-N 1 2 316.401 4.295 20 0 DIADLO COc1c(C)c[nH+]c(CNc2cccc(OC(C)(C)C)c2)c1C ZINC001474726798 1062450087 /nfs/dbraw/zinc/45/00/87/1062450087.db2.gz UKIKLJKCJRJVLS-UHFFFAOYSA-N 1 2 314.429 4.496 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@@H+](Cc1cc3ccncc3s1)C2 ZINC001474759191 1062465013 /nfs/dbraw/zinc/46/50/13/1062465013.db2.gz DLJHDTGKURGBNG-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@H+](Cc1cc3ccncc3s1)C2 ZINC001474759191 1062465017 /nfs/dbraw/zinc/46/50/17/1062465017.db2.gz DLJHDTGKURGBNG-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)[NH2+][C@@H](c1ccccc1)C(F)F ZINC001474764216 1062469315 /nfs/dbraw/zinc/46/93/15/1062469315.db2.gz UVNMQKWRFOVFMS-YLGBZRSBSA-N 1 2 319.332 4.305 20 0 DIADLO FC(F)(F)C1CCC([N@@H+]2Cc3cnc(Cl)cc3C2)CC1 ZINC001255522833 1062472097 /nfs/dbraw/zinc/47/20/97/1062472097.db2.gz YEYMWWIDMNVMOY-UHFFFAOYSA-N 1 2 304.743 4.172 20 0 DIADLO FC(F)(F)C1CCC([N@H+]2Cc3cnc(Cl)cc3C2)CC1 ZINC001255522833 1062472105 /nfs/dbraw/zinc/47/21/05/1062472105.db2.gz YEYMWWIDMNVMOY-UHFFFAOYSA-N 1 2 304.743 4.172 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2C2CCC(C(F)(F)F)CC2)no1 ZINC001255520628 1062472431 /nfs/dbraw/zinc/47/24/31/1062472431.db2.gz SIBUVONXKWRIOV-BPCQOVAHSA-N 1 2 317.355 4.026 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2C2CCC(C(F)(F)F)CC2)no1 ZINC001255520628 1062472436 /nfs/dbraw/zinc/47/24/36/1062472436.db2.gz SIBUVONXKWRIOV-BPCQOVAHSA-N 1 2 317.355 4.026 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCOCC23CCCC3)cc1Cl ZINC001459891724 1062477260 /nfs/dbraw/zinc/47/72/60/1062477260.db2.gz ZUBDJIGAUKLFCX-UHFFFAOYSA-N 1 2 323.864 4.272 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCOCC23CCCC3)cc1Cl ZINC001459891724 1062477271 /nfs/dbraw/zinc/47/72/71/1062477271.db2.gz ZUBDJIGAUKLFCX-UHFFFAOYSA-N 1 2 323.864 4.272 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@H](c3cccc(Cl)c3)C2)cc1 ZINC001459911618 1062491625 /nfs/dbraw/zinc/49/16/25/1062491625.db2.gz HKJRQHOKDVJMBU-IBGZPJMESA-N 1 2 315.844 4.476 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@H](c3cccc(Cl)c3)C2)cc1 ZINC001459911618 1062491638 /nfs/dbraw/zinc/49/16/38/1062491638.db2.gz HKJRQHOKDVJMBU-IBGZPJMESA-N 1 2 315.844 4.476 20 0 DIADLO C[C@H](CC(F)(F)F)[N@@H+]1CCc2cc(Br)ccc2C1 ZINC001255646577 1062498861 /nfs/dbraw/zinc/49/88/61/1062498861.db2.gz OYYVZYJZGGKITG-SECBINFHSA-N 1 2 322.168 4.148 20 0 DIADLO C[C@H](CC(F)(F)F)[N@H+]1CCc2cc(Br)ccc2C1 ZINC001255646577 1062498865 /nfs/dbraw/zinc/49/88/65/1062498865.db2.gz OYYVZYJZGGKITG-SECBINFHSA-N 1 2 322.168 4.148 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)[C@H](C)CC(F)(F)F ZINC001255665481 1062507561 /nfs/dbraw/zinc/50/75/61/1062507561.db2.gz YJHUZSOJBGRTOK-TZMCWYRMSA-N 1 2 301.352 4.311 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)[C@H](C)CC(F)(F)F ZINC001255665481 1062507564 /nfs/dbraw/zinc/50/75/64/1062507564.db2.gz YJHUZSOJBGRTOK-TZMCWYRMSA-N 1 2 301.352 4.311 20 0 DIADLO CCCCCC(C)(C)CNC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001469263769 1062512778 /nfs/dbraw/zinc/51/27/78/1062512778.db2.gz LPVBZZMDMQCIMD-UHFFFAOYSA-N 1 2 305.466 4.104 20 0 DIADLO CCc1[nH]c(CNC(=O)N(c2ccccc2)c2ccccc2)c[nH+]1 ZINC001475752087 1062520257 /nfs/dbraw/zinc/52/02/57/1062520257.db2.gz OIYVKCMDJLXXFA-UHFFFAOYSA-N 1 2 320.396 4.020 20 0 DIADLO CCc1[nH]cc(CNC(=O)N(c2ccccc2)c2ccccc2)[nH+]1 ZINC001475752087 1062520278 /nfs/dbraw/zinc/52/02/78/1062520278.db2.gz OIYVKCMDJLXXFA-UHFFFAOYSA-N 1 2 320.396 4.020 20 0 DIADLO Fc1ccccc1OC1C[NH+]([C@@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC001255717418 1062539514 /nfs/dbraw/zinc/53/95/14/1062539514.db2.gz MEYFFMARYCCMAH-NWDGAFQWSA-N 1 2 317.326 4.010 20 0 DIADLO CC1=CCC[N@H+](Cc2cc(Cl)ccc2Br)C1 ZINC001460016487 1062570668 /nfs/dbraw/zinc/57/06/68/1062570668.db2.gz KBDFWCKYSKZVPO-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO CC1=CCC[N@@H+](Cc2cc(Cl)ccc2Br)C1 ZINC001460016487 1062570686 /nfs/dbraw/zinc/57/06/86/1062570686.db2.gz KBDFWCKYSKZVPO-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO C[C@@H]1CC[C@H](C(=O)Oc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C1 ZINC001460019276 1062575035 /nfs/dbraw/zinc/57/50/35/1062575035.db2.gz ZFHFKSLBXIXSSG-ZBFHGGJFSA-N 1 2 324.424 4.228 20 0 DIADLO Cc1ccc(SC[C@H](C)[NH2+]CC(F)(F)c2ccccn2)cc1 ZINC001255758770 1062579372 /nfs/dbraw/zinc/57/93/72/1062579372.db2.gz IQMQHCLFQQMHRD-AWEZNQCLSA-N 1 2 322.424 4.252 20 0 DIADLO Cc1ccc(SC[C@@H](C)[N@H+](C)CC(=O)c2ccccc2)cc1 ZINC001255771360 1062592743 /nfs/dbraw/zinc/59/27/43/1062592743.db2.gz RPLTTWVSGNGLRU-MRXNPFEDSA-N 1 2 313.466 4.290 20 0 DIADLO Cc1ccc(SC[C@@H](C)[N@@H+](C)CC(=O)c2ccccc2)cc1 ZINC001255771360 1062592767 /nfs/dbraw/zinc/59/27/67/1062592767.db2.gz RPLTTWVSGNGLRU-MRXNPFEDSA-N 1 2 313.466 4.290 20 0 DIADLO C(=C\c1ccccc1)\CC[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC001460180557 1062682821 /nfs/dbraw/zinc/68/28/21/1062682821.db2.gz UGKOITCJNMXRMO-XFFZJAGNSA-N 1 2 315.420 4.291 20 0 DIADLO C(=C\c1ccccc1)\CC[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC001460180557 1062682825 /nfs/dbraw/zinc/68/28/25/1062682825.db2.gz UGKOITCJNMXRMO-XFFZJAGNSA-N 1 2 315.420 4.291 20 0 DIADLO Cc1nc(C[N@@H+]2CC(C)(C)[C@@H]2[C@@H]2CCCO2)sc1C(C)(C)C ZINC001460195860 1062692621 /nfs/dbraw/zinc/69/26/21/1062692621.db2.gz LIWXCQZDGQVJMU-ZFWWWQNUSA-N 1 2 322.518 4.138 20 0 DIADLO Cc1nc(C[N@H+]2CC(C)(C)[C@@H]2[C@@H]2CCCO2)sc1C(C)(C)C ZINC001460195860 1062692636 /nfs/dbraw/zinc/69/26/36/1062692636.db2.gz LIWXCQZDGQVJMU-ZFWWWQNUSA-N 1 2 322.518 4.138 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCC[C@H](c2ccccc2)C1)C(=O)OC(C)(C)C ZINC001256106191 1062703544 /nfs/dbraw/zinc/70/35/44/1062703544.db2.gz NXSLZTNBCDCKCN-BHYGNILZSA-N 1 2 303.446 4.033 20 0 DIADLO C[C@H]1CCC(C)(C)[N@@H+]1Cc1ncc(Br)cc1Cl ZINC001460233114 1062715599 /nfs/dbraw/zinc/71/55/99/1062715599.db2.gz ZPBOLQZLKZEKSY-VIFPVBQESA-N 1 2 317.658 4.260 20 0 DIADLO C[C@H]1CCC(C)(C)[N@H+]1Cc1ncc(Br)cc1Cl ZINC001460233114 1062715609 /nfs/dbraw/zinc/71/56/09/1062715609.db2.gz ZPBOLQZLKZEKSY-VIFPVBQESA-N 1 2 317.658 4.260 20 0 DIADLO Cc1ccc(C[NH2+]C2(c3ccccc3Cl)CC2)nc1Cl ZINC001460291496 1062760970 /nfs/dbraw/zinc/76/09/70/1062760970.db2.gz JPNJIKGRNKJKRJ-UHFFFAOYSA-N 1 2 307.224 4.476 20 0 DIADLO CC[C@@H]1C[N@H+](CCc2c(Cl)cccc2Cl)[C@@H](C)CO1 ZINC001460338812 1062793936 /nfs/dbraw/zinc/79/39/36/1062793936.db2.gz MRVDMYQGZWXZTJ-NWDGAFQWSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)[C@@H](C)CO1 ZINC001460338812 1062793954 /nfs/dbraw/zinc/79/39/54/1062793954.db2.gz MRVDMYQGZWXZTJ-NWDGAFQWSA-N 1 2 302.245 4.035 20 0 DIADLO CCCCCCc1nnc(-c2ccc(Cn3cc[nH+]c3)cc2)o1 ZINC001256390388 1062800803 /nfs/dbraw/zinc/80/08/03/1062800803.db2.gz BKAJCSWKBYTSGG-UHFFFAOYSA-N 1 2 310.401 4.104 20 0 DIADLO CC(C)c1cccc(C[N@H+]2C[C@@H](CC(F)(F)F)O[C@@H](C)C2)c1 ZINC001460487666 1062877209 /nfs/dbraw/zinc/87/72/09/1062877209.db2.gz WZFAINBKUUGODZ-XJKSGUPXSA-N 1 2 315.379 4.352 20 0 DIADLO CC(C)c1cccc(C[N@@H+]2C[C@@H](CC(F)(F)F)O[C@@H](C)C2)c1 ZINC001460487666 1062877225 /nfs/dbraw/zinc/87/72/25/1062877225.db2.gz WZFAINBKUUGODZ-XJKSGUPXSA-N 1 2 315.379 4.352 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCOc2ccc(O)cc2C1 ZINC001460495424 1062883603 /nfs/dbraw/zinc/88/36/03/1062883603.db2.gz PWHAELVTHVMDGU-GFCCVEGCSA-N 1 2 303.789 4.001 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCOc2ccc(O)cc2C1 ZINC001460495424 1062883626 /nfs/dbraw/zinc/88/36/26/1062883626.db2.gz PWHAELVTHVMDGU-GFCCVEGCSA-N 1 2 303.789 4.001 20 0 DIADLO Cc1ccc(-c2nnc(-c3ccccc3-n3cc[nH+]c3)o2)cc1C ZINC001256599573 1062910388 /nfs/dbraw/zinc/91/03/88/1062910388.db2.gz VXEXUDWVOQNPPY-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO C[C@@H]1C[C@@H]1c1nnc([C@H](c2ccc(Cl)cc2)[NH+]2CCCC2)o1 ZINC001256681774 1062943421 /nfs/dbraw/zinc/94/34/21/1062943421.db2.gz DJVGLJRZRIKWIX-UGFHNGPFSA-N 1 2 317.820 4.032 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@H+](Cc2ccc(Cl)cn2)C1 ZINC001460650489 1062962253 /nfs/dbraw/zinc/96/22/53/1062962253.db2.gz FWSYRJFAYWPTHX-QGZVFWFLSA-N 1 2 304.796 4.196 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@@H+](Cc2ccc(Cl)cn2)C1 ZINC001460650489 1062962278 /nfs/dbraw/zinc/96/22/78/1062962278.db2.gz FWSYRJFAYWPTHX-QGZVFWFLSA-N 1 2 304.796 4.196 20 0 DIADLO Cc1cc(CNC(=O)N[C@H]2CCC[C@H]2CCC(C)C)cc(C)[nH+]1 ZINC001477774427 1062970456 /nfs/dbraw/zinc/97/04/56/1062970456.db2.gz YVBDYGMWYKTQRM-ROUUACIJSA-N 1 2 317.477 4.103 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3C[C@H]3C3CCCC3)cc2)[nH+]c1C ZINC001471593760 1063007168 /nfs/dbraw/zinc/00/71/68/1063007168.db2.gz RCCHONBFILCWSJ-ZWKOTPCHSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1ccccc1Oc1cccc(NC(=O)CCc2c[nH]c[nH+]2)c1 ZINC001472167609 1063055627 /nfs/dbraw/zinc/05/56/27/1063055627.db2.gz YOARDCIVNFIOHZ-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1ccccc1Oc1cccc(NC(=O)CCc2c[nH+]c[nH]2)c1 ZINC001472167609 1063055646 /nfs/dbraw/zinc/05/56/46/1063055646.db2.gz YOARDCIVNFIOHZ-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO CCC[C@H](C)CCC[N@@H+]1CCOC[C@H]1c1ccc(COC)o1 ZINC001460819977 1063080193 /nfs/dbraw/zinc/08/01/93/1063080193.db2.gz RTRRMODKVWMLTD-RDJZCZTQSA-N 1 2 309.450 4.016 20 0 DIADLO CCC[C@H](C)CCC[N@H+]1CCOC[C@H]1c1ccc(COC)o1 ZINC001460819977 1063080213 /nfs/dbraw/zinc/08/02/13/1063080213.db2.gz RTRRMODKVWMLTD-RDJZCZTQSA-N 1 2 309.450 4.016 20 0 DIADLO CC(C)c1occc1C(=O)N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC001472532953 1063097693 /nfs/dbraw/zinc/09/76/93/1063097693.db2.gz NQPHBEWADQJLKI-CQSZACIVSA-N 1 2 323.396 4.080 20 0 DIADLO C/C(=C\C1CCC(C)CC1)C(=O)NCc1c[nH+]c(C)cc1C ZINC001460887634 1063117990 /nfs/dbraw/zinc/11/79/90/1063117990.db2.gz BUJPIDCCOUZSRP-XNTDXEJSSA-N 1 2 300.446 4.087 20 0 DIADLO Cc1cc(N2CCC(Oc3ccccc3)CC2)nc(C2CCC2)[nH+]1 ZINC001472654828 1063124318 /nfs/dbraw/zinc/12/43/18/1063124318.db2.gz NAVDRZFDFDBLJV-UHFFFAOYSA-N 1 2 323.440 4.100 20 0 DIADLO CC(C)Cc1cc(Nc2ccc(NC3CCCC3)[nH+]c2)ncn1 ZINC001472679594 1063144094 /nfs/dbraw/zinc/14/40/94/1063144094.db2.gz XHBUHFQMBFUGMN-UHFFFAOYSA-N 1 2 311.433 4.168 20 0 DIADLO CCc1cc(N[C@H](COCC(C)C)c2ccco2)nc(CC)[nH+]1 ZINC001472681112 1063144921 /nfs/dbraw/zinc/14/49/21/1063144921.db2.gz ZXZFOTBFPQZRKB-OAHLLOKOSA-N 1 2 317.433 4.020 20 0 DIADLO Cc1cccnc1[C@H](C)[NH2+]Cc1csc(C2CCCC2)n1 ZINC001460935347 1063145145 /nfs/dbraw/zinc/14/51/45/1063145145.db2.gz LSITXXMKYJHABM-ZDUSSCGKSA-N 1 2 301.459 4.355 20 0 DIADLO CC(C)(C)c1cc(Nc2ccc(NC3CCCC3)[nH+]c2)ncn1 ZINC001472679285 1063145265 /nfs/dbraw/zinc/14/52/65/1063145265.db2.gz JJEWEQYNDIAEDY-UHFFFAOYSA-N 1 2 311.433 4.267 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(F)c(Cl)c2)nc1 ZINC001460935412 1063146077 /nfs/dbraw/zinc/14/60/77/1063146077.db2.gz XNJMBTBTMSSLLW-KRWDZBQOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(F)c(Cl)c2)nc1 ZINC001460935412 1063146083 /nfs/dbraw/zinc/14/60/83/1063146083.db2.gz XNJMBTBTMSSLLW-KRWDZBQOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1cc(NCCCOc2ccccc2C)nc(C2CCC2)[nH+]1 ZINC001472689422 1063153813 /nfs/dbraw/zinc/15/38/13/1063153813.db2.gz KIYHUXGTGVSOQE-UHFFFAOYSA-N 1 2 311.429 4.242 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Cl)cc(Cl)c2F)[C@H](C)CCO1 ZINC001460962512 1063158255 /nfs/dbraw/zinc/15/82/55/1063158255.db2.gz GQEJUXMXTGRKDM-NXEZZACHSA-N 1 2 306.208 4.132 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2F)[C@H](C)CCO1 ZINC001460962512 1063158260 /nfs/dbraw/zinc/15/82/60/1063158260.db2.gz GQEJUXMXTGRKDM-NXEZZACHSA-N 1 2 306.208 4.132 20 0 DIADLO Cc1cccc(O[C@H](C)CNc2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC001472700311 1063160380 /nfs/dbraw/zinc/16/03/80/1063160380.db2.gz NILZNRFPPYSJQO-OAHLLOKOSA-N 1 2 311.429 4.240 20 0 DIADLO CCC[C@@H](CC)[NH2+][C@@H](Cc1ccc2ccccc2c1)C(=O)OC ZINC001257253000 1063160521 /nfs/dbraw/zinc/16/05/21/1063160521.db2.gz JCESFYGVQKFFNG-MOPGFXCFSA-N 1 2 313.441 4.092 20 0 DIADLO CCc1ccc2c(c1)CC[N@@H+](Cc1cncc(C(F)(F)F)c1)C2 ZINC001460975032 1063166679 /nfs/dbraw/zinc/16/66/79/1063166679.db2.gz NGOHIDGGVPLOEV-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO CCc1ccc2c(c1)CC[N@H+](Cc1cncc(C(F)(F)F)c1)C2 ZINC001460975032 1063166696 /nfs/dbraw/zinc/16/66/96/1063166696.db2.gz NGOHIDGGVPLOEV-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO COc1ccc2cc(CC[C@@H](C)[NH+]3CC(C)(F)C3)ccc2c1 ZINC001257275244 1063176571 /nfs/dbraw/zinc/17/65/71/1063176571.db2.gz HCOBEJALFSOPEM-CQSZACIVSA-N 1 2 301.405 4.213 20 0 DIADLO CC(C)(C)CC(C)(C)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001472720066 1063181100 /nfs/dbraw/zinc/18/11/00/1063181100.db2.gz CQDAJLRCYIVKJA-UHFFFAOYSA-N 1 2 303.454 4.208 20 0 DIADLO CCc1cc(N2CCC(C)(c3ccccc3)CC2)nc(CC)[nH+]1 ZINC001472732369 1063192676 /nfs/dbraw/zinc/19/26/76/1063192676.db2.gz AMQFIGUCWIWYQN-UHFFFAOYSA-N 1 2 309.457 4.160 20 0 DIADLO Cc1cc(Nc2cc(C3CC3)ncn2)c[nH+]c1N1CCCC[C@@H]1C ZINC001472740259 1063196720 /nfs/dbraw/zinc/19/67/20/1063196720.db2.gz DQCRCFSNYHXTOF-AWEZNQCLSA-N 1 2 323.444 4.180 20 0 DIADLO CC(C)CN(CC(C)(C)C)c1nc2ccccc2n2c[nH+]cc12 ZINC001472738859 1063197051 /nfs/dbraw/zinc/19/70/51/1063197051.db2.gz HCXGNYJXLKCWBN-UHFFFAOYSA-N 1 2 310.445 4.391 20 0 DIADLO CCc1cc(NCC2(CCOC)CCCCC2)nc(CC)[nH+]1 ZINC001472764585 1063215658 /nfs/dbraw/zinc/21/56/58/1063215658.db2.gz LKWFBYJQPBPNPU-UHFFFAOYSA-N 1 2 305.466 4.000 20 0 DIADLO Cc1ccc([C@@H]2CCN(c3cc(C)[nH+]c(C4CC4)n3)C2)c(C)c1 ZINC001472776250 1063226341 /nfs/dbraw/zinc/22/63/41/1063226341.db2.gz RKEAAVSYNBQJEO-QGZVFWFLSA-N 1 2 307.441 4.273 20 0 DIADLO Cc1ccc([C@H]2CCN(c3cc(C)[nH+]c(C4CC4)n3)C2)c(C)c1 ZINC001472776249 1063226633 /nfs/dbraw/zinc/22/66/33/1063226633.db2.gz RKEAAVSYNBQJEO-KRWDZBQOSA-N 1 2 307.441 4.273 20 0 DIADLO Fc1ccc(/C=C/CNc2ccc(N3CCCCC3)c[nH+]2)cc1 ZINC001461079937 1063237872 /nfs/dbraw/zinc/23/78/72/1063237872.db2.gz VQFBZFOPRLUWEU-SNAWJCMRSA-N 1 2 311.404 4.336 20 0 DIADLO Cc1nc(-c2cccc(NCc3cccc4[nH+]ccn43)c2)cs1 ZINC001461082368 1063240557 /nfs/dbraw/zinc/24/05/57/1063240557.db2.gz RFBLNSCIMPHBFO-UHFFFAOYSA-N 1 2 320.421 4.378 20 0 DIADLO CCCCCC[C@@H](C)[N@H+]1Cc2nnc(C(F)(F)F)n2[C@@H](C)C1 ZINC001257373983 1063242853 /nfs/dbraw/zinc/24/28/53/1063242853.db2.gz XVKDIRVIUJHBBH-NEPJUHHUSA-N 1 2 318.387 4.032 20 0 DIADLO CCCCCC[C@@H](C)[N@@H+]1Cc2nnc(C(F)(F)F)n2[C@@H](C)C1 ZINC001257373983 1063242869 /nfs/dbraw/zinc/24/28/69/1063242869.db2.gz XVKDIRVIUJHBBH-NEPJUHHUSA-N 1 2 318.387 4.032 20 0 DIADLO CC[C@H](CNc1nc2ccccc2n2c[nH+]cc12)CC(F)(F)F ZINC001472807717 1063255347 /nfs/dbraw/zinc/25/53/47/1063255347.db2.gz RYWZIOFKUQXLTK-NSHDSACASA-N 1 2 322.334 4.273 20 0 DIADLO Cc1cc(NCCc2cn(C)c3ccccc23)nc(C2CCC2)[nH+]1 ZINC001472834498 1063272086 /nfs/dbraw/zinc/27/20/86/1063272086.db2.gz GDNYWEPGMHQNJE-UHFFFAOYSA-N 1 2 320.440 4.199 20 0 DIADLO Cc1nc(N2CCC(CCc3ccccc3)CC2)c(C)c(C)[nH+]1 ZINC001472880573 1063298492 /nfs/dbraw/zinc/29/84/92/1063298492.db2.gz XPWFMLGWJGKAJN-UHFFFAOYSA-N 1 2 309.457 4.251 20 0 DIADLO CCC[C@H](C)CC[C@H](C)[N@@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001257480107 1063301597 /nfs/dbraw/zinc/30/15/97/1063301597.db2.gz TZSMGWVAIZIDTR-JYJNAYRXSA-N 1 2 307.482 4.011 20 0 DIADLO CCC[C@H](C)CC[C@H](C)[N@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001257480107 1063301614 /nfs/dbraw/zinc/30/16/14/1063301614.db2.gz TZSMGWVAIZIDTR-JYJNAYRXSA-N 1 2 307.482 4.011 20 0 DIADLO Cc1cc(N[C@@H]2CCSC3(CCC3)C2)nc(C2CCC2)[nH+]1 ZINC001472894601 1063302627 /nfs/dbraw/zinc/30/26/27/1063302627.db2.gz HAFBXGINQOUBIC-CQSZACIVSA-N 1 2 303.475 4.283 20 0 DIADLO CCC[C@H](C)CC[C@H](C)[N@@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001257484871 1063302841 /nfs/dbraw/zinc/30/28/41/1063302841.db2.gz FXJGNQDMCXIRQY-HOTGVXAUSA-N 1 2 319.493 4.155 20 0 DIADLO CCC[C@H](C)CC[C@H](C)[N@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001257484871 1063302859 /nfs/dbraw/zinc/30/28/59/1063302859.db2.gz FXJGNQDMCXIRQY-HOTGVXAUSA-N 1 2 319.493 4.155 20 0 DIADLO CCC[C@H](C)CC[C@@H](C)[N@@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001257480817 1063305423 /nfs/dbraw/zinc/30/54/23/1063305423.db2.gz ZADCUGFUDAPJJU-GVDBMIGSSA-N 1 2 321.509 4.401 20 0 DIADLO CCC[C@H](C)CC[C@@H](C)[N@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001257480817 1063305445 /nfs/dbraw/zinc/30/54/45/1063305445.db2.gz ZADCUGFUDAPJJU-GVDBMIGSSA-N 1 2 321.509 4.401 20 0 DIADLO CC(C)c1cc(NC2([C@H]3CCCO3)CCC2)nc(C(C)C)[nH+]1 ZINC001472901952 1063310245 /nfs/dbraw/zinc/31/02/45/1063310245.db2.gz BHXXPLHCAOHATJ-OAHLLOKOSA-N 1 2 303.450 4.237 20 0 DIADLO CCCCC[C@@H](C)[N@@H+]1CCc2nc(Br)sc2C1 ZINC001257517380 1063326676 /nfs/dbraw/zinc/32/66/76/1063326676.db2.gz WNXMXIMAEQZJEA-SNVBAGLBSA-N 1 2 317.296 4.233 20 0 DIADLO CCCCC[C@@H](C)[N@H+]1CCc2nc(Br)sc2C1 ZINC001257517380 1063326692 /nfs/dbraw/zinc/32/66/92/1063326692.db2.gz WNXMXIMAEQZJEA-SNVBAGLBSA-N 1 2 317.296 4.233 20 0 DIADLO COc1ccccc1CSCc1ccc(-n2cc[nH+]c2)cc1 ZINC001472993517 1063346648 /nfs/dbraw/zinc/34/66/48/1063346648.db2.gz ZGTDBJLAZIOTPU-UHFFFAOYSA-N 1 2 310.422 4.314 20 0 DIADLO C[N@@H+]1CCCC[C@@H]1c1nnc([C@@H]2C[C@@H]2c2ccc(Cl)cc2)o1 ZINC001257647398 1063355330 /nfs/dbraw/zinc/35/53/30/1063355330.db2.gz FCJLNHBRGPQMPG-RBSFLKMASA-N 1 2 317.820 4.151 20 0 DIADLO C[N@H+]1CCCC[C@@H]1c1nnc([C@@H]2C[C@@H]2c2ccc(Cl)cc2)o1 ZINC001257647398 1063355349 /nfs/dbraw/zinc/35/53/49/1063355349.db2.gz FCJLNHBRGPQMPG-RBSFLKMASA-N 1 2 317.820 4.151 20 0 DIADLO CC(C)[N@@H+]1CC[C@H]1c1nnc([C@@H]2C[C@H]2c2ccc(Cl)cc2)o1 ZINC001257685257 1063368392 /nfs/dbraw/zinc/36/83/92/1063368392.db2.gz WWAOSYBWTPTWIQ-ZNMIVQPWSA-N 1 2 317.820 4.149 20 0 DIADLO CC(C)[N@H+]1CC[C@H]1c1nnc([C@@H]2C[C@H]2c2ccc(Cl)cc2)o1 ZINC001257685257 1063368412 /nfs/dbraw/zinc/36/84/12/1063368412.db2.gz WWAOSYBWTPTWIQ-ZNMIVQPWSA-N 1 2 317.820 4.149 20 0 DIADLO CC(C)[N@@H+]1CC[C@H]1c1nnc([C@H]2C[C@H]2c2ccc(Cl)cc2)o1 ZINC001257685256 1063370007 /nfs/dbraw/zinc/37/00/07/1063370007.db2.gz WWAOSYBWTPTWIQ-KKUMJFAQSA-N 1 2 317.820 4.149 20 0 DIADLO CC(C)[N@H+]1CC[C@H]1c1nnc([C@H]2C[C@H]2c2ccc(Cl)cc2)o1 ZINC001257685256 1063370025 /nfs/dbraw/zinc/37/00/25/1063370025.db2.gz WWAOSYBWTPTWIQ-KKUMJFAQSA-N 1 2 317.820 4.149 20 0 DIADLO Fc1cc(NCc2cccc3c2CCC3)ccc1-n1cc[nH+]c1 ZINC001461321215 1063416151 /nfs/dbraw/zinc/41/61/51/1063416151.db2.gz SUAUHQPIHVCFRS-UHFFFAOYSA-N 1 2 307.372 4.112 20 0 DIADLO CC[N@H+](Cc1csnc1OC)Cc1ccc2ccccc2c1 ZINC001473120773 1063422478 /nfs/dbraw/zinc/42/24/78/1063422478.db2.gz ARZUISADJIACJM-UHFFFAOYSA-N 1 2 312.438 4.327 20 0 DIADLO CC[N@@H+](Cc1csnc1OC)Cc1ccc2ccccc2c1 ZINC001473120773 1063422487 /nfs/dbraw/zinc/42/24/87/1063422487.db2.gz ARZUISADJIACJM-UHFFFAOYSA-N 1 2 312.438 4.327 20 0 DIADLO COc1ccc(C[NH2+]Cc2c(F)ccc(F)c2Cl)c(F)c1 ZINC001461339085 1063428087 /nfs/dbraw/zinc/42/80/87/1063428087.db2.gz FIQSRRXZSQSTAC-UHFFFAOYSA-N 1 2 315.722 4.056 20 0 DIADLO Brc1ccccc1[C@@H]1C[N@H+](CCCC2CC2)CCO1 ZINC001473135167 1063444005 /nfs/dbraw/zinc/44/40/05/1063444005.db2.gz NPPWPUFRSXJSQM-INIZCTEOSA-N 1 2 324.262 4.013 20 0 DIADLO Brc1ccccc1[C@@H]1C[N@@H+](CCCC2CC2)CCO1 ZINC001473135167 1063444009 /nfs/dbraw/zinc/44/40/09/1063444009.db2.gz NPPWPUFRSXJSQM-INIZCTEOSA-N 1 2 324.262 4.013 20 0 DIADLO CCN(CC)c1ccc(NCc2cc3ccccc3n2C)c[nH+]1 ZINC001461366998 1063450300 /nfs/dbraw/zinc/45/03/00/1063450300.db2.gz NVFXCRWDNZXIJE-UHFFFAOYSA-N 1 2 308.429 4.032 20 0 DIADLO c1coc(-c2cccc(NCc3cc(-n4cc[nH+]c4)cs3)c2)n1 ZINC001461403009 1063474283 /nfs/dbraw/zinc/47/42/83/1063474283.db2.gz PIIBBXPBFRXUJD-UHFFFAOYSA-N 1 2 322.393 4.201 20 0 DIADLO COCCC1(CNc2c[nH+]c3c(c2)CCCC3)CCCCC1 ZINC001461428327 1063496599 /nfs/dbraw/zinc/49/65/99/1063496599.db2.gz NWEOKVHKKJHAQJ-UHFFFAOYSA-N 1 2 302.462 4.359 20 0 DIADLO CC(C)(C)C1CCC(C[NH2+]CC(F)(F)Br)CC1 ZINC001461498113 1063538051 /nfs/dbraw/zinc/53/80/51/1063538051.db2.gz UCSYDFMVFYJAKP-UHFFFAOYSA-N 1 2 312.242 4.416 20 0 DIADLO Cn1cc(Cl)c(C[NH2+]Cc2ccccc2-c2ccccc2)n1 ZINC001461515759 1063550624 /nfs/dbraw/zinc/55/06/24/1063550624.db2.gz ZTWSRFYBWBIIMQ-UHFFFAOYSA-N 1 2 311.816 4.030 20 0 DIADLO C[C@@H](Cc1ccco1)[N@@H+]1CC[C@@H](c2ccccc2)C(F)(F)C1 ZINC001258197767 1063557618 /nfs/dbraw/zinc/55/76/18/1063557618.db2.gz QXAPKUIPBJFQJF-YOEHRIQHSA-N 1 2 305.368 4.335 20 0 DIADLO C[C@@H](Cc1ccco1)[N@H+]1CC[C@@H](c2ccccc2)C(F)(F)C1 ZINC001258197767 1063557633 /nfs/dbraw/zinc/55/76/33/1063557633.db2.gz QXAPKUIPBJFQJF-YOEHRIQHSA-N 1 2 305.368 4.335 20 0 DIADLO Cc1ccccc1-c1cccc(CNc2cc(CO)cc[nH+]2)c1 ZINC001461596914 1063603881 /nfs/dbraw/zinc/60/38/81/1063603881.db2.gz YNENFMBSHSOSOU-UHFFFAOYSA-N 1 2 304.393 4.161 20 0 DIADLO Oc1cccc(C[NH2+]Cc2csc(C(F)(F)F)c2)c1Cl ZINC001461677648 1063652920 /nfs/dbraw/zinc/65/29/20/1063652920.db2.gz TZFGCVWGMYNTEX-UHFFFAOYSA-N 1 2 321.751 4.416 20 0 DIADLO CCCCC[C@@H](CC)[N@H+]1Cc2nnc(C(F)(F)F)n2[C@@H](C)C1 ZINC001258443869 1063657208 /nfs/dbraw/zinc/65/72/08/1063657208.db2.gz PCWUTNZSMOSNEN-NWDGAFQWSA-N 1 2 318.387 4.032 20 0 DIADLO CCCCC[C@@H](CC)[N@@H+]1Cc2nnc(C(F)(F)F)n2[C@@H](C)C1 ZINC001258443869 1063657214 /nfs/dbraw/zinc/65/72/14/1063657214.db2.gz PCWUTNZSMOSNEN-NWDGAFQWSA-N 1 2 318.387 4.032 20 0 DIADLO Cc1cccn2c(CNc3ccc(F)c(C(F)F)c3)c[nH+]c12 ZINC001461707010 1063670090 /nfs/dbraw/zinc/67/00/90/1063670090.db2.gz NPWNIOGMVBIWLI-UHFFFAOYSA-N 1 2 305.303 4.332 20 0 DIADLO Cc1ccc2[nH+]c(NCc3c[nH]nc3-c3cccc(C)c3)[nH]c2c1 ZINC001461707435 1063671221 /nfs/dbraw/zinc/67/12/21/1063671221.db2.gz CGHZUGVCSTWBRF-UHFFFAOYSA-N 1 2 317.396 4.182 20 0 DIADLO Cc1ccc2[nH+]c(NCc3cc(Br)cs3)[nH]c2c1 ZINC001461707482 1063671799 /nfs/dbraw/zinc/67/17/99/1063671799.db2.gz CSZAQGYNEHBMIL-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2csc3ccccc23)c(C)[nH+]1 ZINC001515366935 1063672430 /nfs/dbraw/zinc/67/24/30/1063672430.db2.gz ZPDCESXLOCOPPB-UHFFFAOYSA-N 1 2 310.422 4.152 20 0 DIADLO Cc1cc(NCc2ccc(Br)cc2F)c[nH+]c1C ZINC001461717000 1063675793 /nfs/dbraw/zinc/67/57/93/1063675793.db2.gz RRJDCMUIWWHUMD-UHFFFAOYSA-N 1 2 309.182 4.212 20 0 DIADLO CC[C@H](C)CNc1[nH+]c2ccccc2n1CCc1ccccn1 ZINC001461727941 1063682109 /nfs/dbraw/zinc/68/21/09/1063682109.db2.gz GVIJEZZOBXPNJM-HNNXBMFYSA-N 1 2 308.429 4.132 20 0 DIADLO Clc1ccc2[nH]c(NCc3c[nH]nc3-c3ccccc3)[nH+]c2c1 ZINC001461733117 1063686440 /nfs/dbraw/zinc/68/64/40/1063686440.db2.gz ZAIXSQLOVUCRQZ-UHFFFAOYSA-N 1 2 323.787 4.219 20 0 DIADLO Clc1ccc2[nH]c(NCc3cccc4cnccc43)[nH+]c2c1 ZINC001461733042 1063686852 /nfs/dbraw/zinc/68/68/52/1063686852.db2.gz VXZUXODEMDKSCK-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO CC(C)n1c(C[NH2+]Cc2noc3ccccc23)nc2ccccc21 ZINC001461749150 1063694207 /nfs/dbraw/zinc/69/42/07/1063694207.db2.gz DHMRUGCGOZDYJY-UHFFFAOYSA-N 1 2 320.396 4.048 20 0 DIADLO Cc1cc(C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)ccc1Cl ZINC001461755229 1063698278 /nfs/dbraw/zinc/69/82/78/1063698278.db2.gz RITAKNHPSOOJEJ-NVXWUHKLSA-N 1 2 305.780 4.210 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1C(F)F ZINC001515865120 1063704343 /nfs/dbraw/zinc/70/43/43/1063704343.db2.gz IEORTPQYMXBVAN-UHFFFAOYSA-N 1 2 313.307 4.062 20 0 DIADLO CCCCC[C@H](CCC)[NH2+][C@H](C(=O)OC)[C@@H](C)OC(C)(C)C ZINC001258664448 1063732689 /nfs/dbraw/zinc/73/26/89/1063732689.db2.gz KITFBPFNWXMWKE-PMPSAXMXSA-N 1 2 315.498 4.070 20 0 DIADLO CCOc1cc(F)cc(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)c1 ZINC001461841629 1063745594 /nfs/dbraw/zinc/74/55/94/1063745594.db2.gz GYSHGAOZJKDKLH-GOSISDBHSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1cc(F)cc(C[N@H+]2CC[C@@H]2c2cccc(F)c2)c1 ZINC001461841629 1063745598 /nfs/dbraw/zinc/74/55/98/1063745598.db2.gz GYSHGAOZJKDKLH-GOSISDBHSA-N 1 2 303.352 4.311 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1Cl)[N@@H+]1Cc2ccncc2C1 ZINC001258682105 1063750225 /nfs/dbraw/zinc/75/02/25/1063750225.db2.gz KHGCPKZELHBYIN-NSHDSACASA-N 1 2 307.224 4.335 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1Cl)[N@H+]1Cc2ccncc2C1 ZINC001258682105 1063750236 /nfs/dbraw/zinc/75/02/36/1063750236.db2.gz KHGCPKZELHBYIN-NSHDSACASA-N 1 2 307.224 4.335 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ncccc2F)C2CCCC2)c(F)c1 ZINC001461887995 1063777286 /nfs/dbraw/zinc/77/72/86/1063777286.db2.gz LDTTXRJCTIQQJX-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ncccc2F)C2CCCC2)c(F)c1 ZINC001461887995 1063777302 /nfs/dbraw/zinc/77/73/02/1063777302.db2.gz LDTTXRJCTIQQJX-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2[C@H](C)Cc2cccc(Cl)c2)no1 ZINC001258750171 1063797216 /nfs/dbraw/zinc/79/72/16/1063797216.db2.gz PYHGDCALJYBRTG-WBMJQRKESA-N 1 2 319.836 4.190 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2[C@H](C)Cc2cccc(Cl)c2)no1 ZINC001258750171 1063797228 /nfs/dbraw/zinc/79/72/28/1063797228.db2.gz PYHGDCALJYBRTG-WBMJQRKESA-N 1 2 319.836 4.190 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2C[C@H](C)OC[C@H]2c2ccccc2)cn1 ZINC001461920972 1063803548 /nfs/dbraw/zinc/80/35/48/1063803548.db2.gz HAQFGETZMFGZIP-UWJYYQICSA-N 1 2 324.468 4.242 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2C[C@H](C)OC[C@H]2c2ccccc2)cn1 ZINC001461920972 1063803565 /nfs/dbraw/zinc/80/35/65/1063803565.db2.gz HAQFGETZMFGZIP-UWJYYQICSA-N 1 2 324.468 4.242 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)cn1 ZINC001461920967 1063806605 /nfs/dbraw/zinc/80/66/05/1063806605.db2.gz HAQFGETZMFGZIP-LAUBAEHRSA-N 1 2 324.468 4.242 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)cn1 ZINC001461920967 1063806615 /nfs/dbraw/zinc/80/66/15/1063806615.db2.gz HAQFGETZMFGZIP-LAUBAEHRSA-N 1 2 324.468 4.242 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@H+](C)Cc1cccc(OC(C)C)c1 ZINC001461926759 1063810823 /nfs/dbraw/zinc/81/08/23/1063810823.db2.gz MCGOINKGWRBQLF-UHFFFAOYSA-N 1 2 321.852 4.045 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@@H+](C)Cc1cccc(OC(C)C)c1 ZINC001461926759 1063810828 /nfs/dbraw/zinc/81/08/28/1063810828.db2.gz MCGOINKGWRBQLF-UHFFFAOYSA-N 1 2 321.852 4.045 20 0 DIADLO CCCC[C@@H](CCC)[N@H+]1Cc2nnc(C(F)(F)F)n2[C@H](C)C1 ZINC001258767684 1063812674 /nfs/dbraw/zinc/81/26/74/1063812674.db2.gz XBUVUROTNRTLAF-VXGBXAGGSA-N 1 2 318.387 4.032 20 0 DIADLO CCCC[C@@H](CCC)[N@@H+]1Cc2nnc(C(F)(F)F)n2[C@H](C)C1 ZINC001258767684 1063812686 /nfs/dbraw/zinc/81/26/86/1063812686.db2.gz XBUVUROTNRTLAF-VXGBXAGGSA-N 1 2 318.387 4.032 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2cc(Cl)c(OC(C)C)cc2Cl)C1 ZINC001461957902 1063839092 /nfs/dbraw/zinc/83/90/92/1063839092.db2.gz ZZSUOAHUXBDTFT-LBPRGKRZSA-N 1 2 318.244 4.001 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2cc(Cl)c(OC(C)C)cc2Cl)C1 ZINC001461957902 1063839097 /nfs/dbraw/zinc/83/90/97/1063839097.db2.gz ZZSUOAHUXBDTFT-LBPRGKRZSA-N 1 2 318.244 4.001 20 0 DIADLO COc1cccc(C[N@@H+]2CCc3cccc(F)c3[C@H]2C)c1F ZINC001461959811 1063843276 /nfs/dbraw/zinc/84/32/76/1063843276.db2.gz JCSGBPUHGXSLII-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cccc(C[N@H+]2CCc3cccc(F)c3[C@H]2C)c1F ZINC001461959811 1063843289 /nfs/dbraw/zinc/84/32/89/1063843289.db2.gz JCSGBPUHGXSLII-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO C[C@@H]1CCC[C@H]([N@@H+]2CCCC[C@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258824763 1063851446 /nfs/dbraw/zinc/85/14/46/1063851446.db2.gz XAWJXVJYQXAQJJ-WOPDTQHZSA-N 1 2 317.355 4.194 20 0 DIADLO C[C@@H]1CCC[C@H]([N@H+]2CCCC[C@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258824763 1063851464 /nfs/dbraw/zinc/85/14/64/1063851464.db2.gz XAWJXVJYQXAQJJ-WOPDTQHZSA-N 1 2 317.355 4.194 20 0 DIADLO CCOc1cccc(F)c1C[N@H+](C)[C@H](C)c1sc(C)nc1C ZINC001461973594 1063851871 /nfs/dbraw/zinc/85/18/71/1063851871.db2.gz GGJHUSGTWRTENC-GFCCVEGCSA-N 1 2 322.449 4.491 20 0 DIADLO CCOc1cccc(F)c1C[N@@H+](C)[C@H](C)c1sc(C)nc1C ZINC001461973594 1063851890 /nfs/dbraw/zinc/85/18/90/1063851890.db2.gz GGJHUSGTWRTENC-GFCCVEGCSA-N 1 2 322.449 4.491 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2cc(Br)c(Cl)s2)C1 ZINC001462007627 1063875264 /nfs/dbraw/zinc/87/52/64/1063875264.db2.gz NVUXAWYHZXFYIW-QMMMGPOBSA-N 1 2 308.672 4.396 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2cc(Br)c(Cl)s2)C1 ZINC001462007627 1063875272 /nfs/dbraw/zinc/87/52/72/1063875272.db2.gz NVUXAWYHZXFYIW-QMMMGPOBSA-N 1 2 308.672 4.396 20 0 DIADLO C[C@H]([NH2+][C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1)C(=O)OC(C)(C)C ZINC001462016178 1063879656 /nfs/dbraw/zinc/87/96/56/1063879656.db2.gz ZAZOYCGNIBGQAB-JGGQBBKZSA-N 1 2 323.864 4.296 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)o1 ZINC001462021251 1063882592 /nfs/dbraw/zinc/88/25/92/1063882592.db2.gz WTEVMWHDCSOCSZ-MLGOLLRUSA-N 1 2 301.386 4.169 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)o1 ZINC001462021251 1063882599 /nfs/dbraw/zinc/88/25/99/1063882599.db2.gz WTEVMWHDCSOCSZ-MLGOLLRUSA-N 1 2 301.386 4.169 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(F)c(F)c1F ZINC001462055184 1063905978 /nfs/dbraw/zinc/90/59/78/1063905978.db2.gz VMHNYRSZHXDUKG-HNNXBMFYSA-N 1 2 305.343 4.441 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1ccc(F)c(F)c1F ZINC001462055184 1063905989 /nfs/dbraw/zinc/90/59/89/1063905989.db2.gz VMHNYRSZHXDUKG-HNNXBMFYSA-N 1 2 305.343 4.441 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(F)c(F)c1F ZINC001462055185 1063906105 /nfs/dbraw/zinc/90/61/05/1063906105.db2.gz VMHNYRSZHXDUKG-OAHLLOKOSA-N 1 2 305.343 4.441 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccc(F)c(F)c1F ZINC001462055185 1063906115 /nfs/dbraw/zinc/90/61/15/1063906115.db2.gz VMHNYRSZHXDUKG-OAHLLOKOSA-N 1 2 305.343 4.441 20 0 DIADLO Cc1cc(NCCn2cnc3ccccc32)[nH+]c2ccccc12 ZINC001261208221 1063912000 /nfs/dbraw/zinc/91/20/00/1063912000.db2.gz LFKUBXRIDLUFNX-UHFFFAOYSA-N 1 2 302.381 4.005 20 0 DIADLO C[C@H](CCc1n[nH]c2ccccc21)Nc1c[nH+]c2c(c1)CCCC2 ZINC001462084764 1063919981 /nfs/dbraw/zinc/91/99/81/1063919981.db2.gz GZOYIEFFBGWCNK-CQSZACIVSA-N 1 2 320.440 4.270 20 0 DIADLO Cc1ccc2cc(C[N@H+](C)Cc3cc(C(C)(C)C)n[nH]3)[nH]c2c1 ZINC001261677177 1063942306 /nfs/dbraw/zinc/94/23/06/1063942306.db2.gz ISWNPVINOWPCLO-UHFFFAOYSA-N 1 2 310.445 4.129 20 0 DIADLO Cc1ccc2cc(C[N@@H+](C)Cc3cc(C(C)(C)C)n[nH]3)[nH]c2c1 ZINC001261677177 1063942320 /nfs/dbraw/zinc/94/23/20/1063942320.db2.gz ISWNPVINOWPCLO-UHFFFAOYSA-N 1 2 310.445 4.129 20 0 DIADLO FCC1(CF)CC(SCc2ccc(-n3cc[nH+]c3)cc2)C1 ZINC001261889111 1063951531 /nfs/dbraw/zinc/95/15/31/1063951531.db2.gz NOFGZWCDHLCWDU-UHFFFAOYSA-N 1 2 308.397 4.193 20 0 DIADLO c1cn(-c2cccc(NCc3cncc4ccccc43)c2)c[nH+]1 ZINC000378879083 1063977895 /nfs/dbraw/zinc/97/78/95/1063977895.db2.gz CFQHCCIWRRPJNK-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC001264340259 1064078869 /nfs/dbraw/zinc/07/88/69/1064078869.db2.gz NXTVIVADEYXQKT-BRWVUGGUSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ccsc2Br)c1 ZINC000389000249 1064120285 /nfs/dbraw/zinc/12/02/85/1064120285.db2.gz PLYGVZFKPXOZQK-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ccsc2Br)c1 ZINC000389000249 1064120292 /nfs/dbraw/zinc/12/02/92/1064120292.db2.gz PLYGVZFKPXOZQK-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO C[C@@H]1CCC[C@@H]1CC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001264831748 1064144995 /nfs/dbraw/zinc/14/49/95/1064144995.db2.gz KEILMFAYUOIJOV-CHWSQXEVSA-N 1 2 317.820 4.291 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)c1cccc(C2CCCC2)c1 ZINC001265165149 1064198647 /nfs/dbraw/zinc/19/86/47/1064198647.db2.gz JIZRQHQOTWFRRL-UHFFFAOYSA-N 1 2 305.381 4.244 20 0 DIADLO Fc1c(Br)ccc(C[NH+]2CCCCCC2)c1F ZINC000700996174 1064234819 /nfs/dbraw/zinc/23/48/19/1064234819.db2.gz VYODJXFTAHNKBE-UHFFFAOYSA-N 1 2 304.178 4.103 20 0 DIADLO Fc1c(Br)ccc(C[N@@H+]2CC3CCC2CC3)c1F ZINC000701279057 1064244566 /nfs/dbraw/zinc/24/45/66/1064244566.db2.gz DRMOVNFXGICVNH-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1c(Br)ccc(C[N@H+]2CC3CCC2CC3)c1F ZINC000701279057 1064244572 /nfs/dbraw/zinc/24/45/72/1064244572.db2.gz DRMOVNFXGICVNH-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(Br)c(F)c2F)C[C@H]1C ZINC000701278914 1064245346 /nfs/dbraw/zinc/24/53/46/1064245346.db2.gz CKXNGZNSABFPDK-NXEZZACHSA-N 1 2 318.205 4.205 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(Br)c(F)c2F)C[C@H]1C ZINC000701278914 1064245350 /nfs/dbraw/zinc/24/53/50/1064245350.db2.gz CKXNGZNSABFPDK-NXEZZACHSA-N 1 2 318.205 4.205 20 0 DIADLO Fc1c(Br)ccc(C[NH+]2CCC3(CC3)CC2)c1F ZINC000701326119 1064247909 /nfs/dbraw/zinc/24/79/09/1064247909.db2.gz GPZMKGWYJRAUIW-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO C/C(=C/C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1C ZINC001290587565 1064701541 /nfs/dbraw/zinc/70/15/41/1064701541.db2.gz QIQYQASKDKHCNU-SSZFMOIBSA-N 1 2 317.392 4.223 20 0 DIADLO C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001290756211 1064711445 /nfs/dbraw/zinc/71/14/45/1064711445.db2.gz CKWRIYBHJLIXDJ-LLVKDONJSA-N 1 2 313.788 4.050 20 0 DIADLO O=C(c1cc2c[nH+]ccc2[nH]1)N(Cc1ccccc1)CC1CCC1 ZINC001292006211 1064754484 /nfs/dbraw/zinc/75/44/84/1064754484.db2.gz LKLIYBJESBBFRE-UHFFFAOYSA-N 1 2 319.408 4.005 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C3=CC[C@@H](C)CC3)c2)[nH+]c1C ZINC001292072961 1064757967 /nfs/dbraw/zinc/75/79/67/1064757967.db2.gz NSJCYHQXRIVTAQ-GFCCVEGCSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC[C@@H](Cc3ccccc3)C2)c(C)[nH+]1 ZINC001292882126 1064791145 /nfs/dbraw/zinc/79/11/45/1064791145.db2.gz LVXGZBXBTVLBSN-IBGZPJMESA-N 1 2 322.452 4.102 20 0 DIADLO Cc1cccc(C)c1NC(=O)C[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC001294166161 1064853394 /nfs/dbraw/zinc/85/33/94/1064853394.db2.gz GYUKJKQAUZVGRQ-KRWDZBQOSA-N 1 2 319.408 4.187 20 0 DIADLO Cc1cc(NC[C@]2(O)CCCC(C)(C)CC2)nc(C2CCC2)[nH+]1 ZINC001307184194 1064900982 /nfs/dbraw/zinc/90/09/82/1064900982.db2.gz IGLYRRMAPRAAFQ-IBGZPJMESA-N 1 2 317.477 4.186 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)C[C@@H](CC)C(C)(C)C ZINC001296345450 1064943153 /nfs/dbraw/zinc/94/31/53/1064943153.db2.gz AMTDQHOWSXAEMF-MRXNPFEDSA-N 1 2 321.509 4.147 20 0 DIADLO CCCCN(C(=O)c1cc2c[nH+]ccc2[nH]1)[C@H]1CCC[C@@H](C)C1 ZINC001298620111 1065012281 /nfs/dbraw/zinc/01/22/81/1065012281.db2.gz VPRPNAFAONFROA-ZBFHGGJFSA-N 1 2 313.445 4.384 20 0 DIADLO CC(C)C[C@H](C(=O)N[C@H]1CCCCC12CCCC2)n1cc[nH+]c1 ZINC001298651864 1065013727 /nfs/dbraw/zinc/01/37/27/1065013727.db2.gz NLAOBTRTQLGBIK-SJORKVTESA-N 1 2 317.477 4.090 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C[C@H]3CCC[C@@H]3C)cc2)[nH+]c1C ZINC001303121479 1065108574 /nfs/dbraw/zinc/10/85/74/1065108574.db2.gz ADXZPVRPUVRFET-BLLLJJGKSA-N 1 2 311.429 4.458 20 0 DIADLO CCCC[C@H](C(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1)C(C)C ZINC001303607715 1065118965 /nfs/dbraw/zinc/11/89/65/1065118965.db2.gz BDAAXXYJAFHBSW-HOTGVXAUSA-N 1 2 305.466 4.152 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)c2cc3c(cccc3C)o2)[nH+]c1C ZINC001303608656 1065119608 /nfs/dbraw/zinc/11/96/08/1065119608.db2.gz JTSVXDRAQJDFFC-HNNXBMFYSA-N 1 2 323.396 4.058 20 0 DIADLO CC(C)=CCC[C@H](C)CC(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001303609342 1065119621 /nfs/dbraw/zinc/11/96/21/1065119621.db2.gz SIELJEWVQHWBJQ-WMLDXEAASA-N 1 2 317.477 4.463 20 0 DIADLO CC(C)=CCC[C@@H](C)CC(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001303609341 1065119871 /nfs/dbraw/zinc/11/98/71/1065119871.db2.gz SIELJEWVQHWBJQ-RHSMWYFYSA-N 1 2 317.477 4.463 20 0 DIADLO C[C@H](NC(=O)[C@H]1CCCC2(CC2)C1)c1ccc(-n2cc[nH+]c2)cc1 ZINC001306753940 1065192538 /nfs/dbraw/zinc/19/25/38/1065192538.db2.gz GTAHWQXUHWNWBD-RDJZCZTQSA-N 1 2 323.440 4.020 20 0 DIADLO CCOc1ccc(CN(C)c2cc(C)[nH+]c(C3CCC3)n2)cc1 ZINC001306913329 1065202154 /nfs/dbraw/zinc/20/21/54/1065202154.db2.gz JBFBCXRBTWXNEM-UHFFFAOYSA-N 1 2 311.429 4.088 20 0 DIADLO CC[C@H](Nc1nc2ccccc2n2c[nH+]cc12)c1nc(C)cs1 ZINC001306962411 1065223670 /nfs/dbraw/zinc/22/36/70/1065223670.db2.gz PCUZBSCYDWRTKC-LBPRGKRZSA-N 1 2 323.425 4.211 20 0 DIADLO CCc1cc(N[C@@H]2CCC[C@H]2Cc2ccccc2)nc(CC)[nH+]1 ZINC001306976472 1065230837 /nfs/dbraw/zinc/23/08/37/1065230837.db2.gz XYGAGHSIGNYWFF-FUHWJXTLSA-N 1 2 309.457 4.425 20 0 DIADLO CCc1cc(N[C@H]2CCC[C@@H]2Cc2ccccc2)nc(CC)[nH+]1 ZINC001306976470 1065231293 /nfs/dbraw/zinc/23/12/93/1065231293.db2.gz XYGAGHSIGNYWFF-AEFFLSMTSA-N 1 2 309.457 4.425 20 0 DIADLO CCc1cc(N[C@@H]2CCC[C@@H]2Cc2ccccc2)nc(CC)[nH+]1 ZINC001306976474 1065231401 /nfs/dbraw/zinc/23/14/01/1065231401.db2.gz XYGAGHSIGNYWFF-SJLPKXTDSA-N 1 2 309.457 4.425 20 0 DIADLO CCO[C@@H]1C[C@H](Nc2cc(C)[nH+]c(C3CC3)n2)C1(CC)CC ZINC001306982689 1065233546 /nfs/dbraw/zinc/23/35/46/1065233546.db2.gz NQXHVCOIZAGLEH-LSDHHAIUSA-N 1 2 303.450 4.058 20 0 DIADLO CCCCO[C@@H]1C[C@@H](Nc2cc(C)[nH+]c(C3CCC3)n2)C1(C)C ZINC001306989131 1065238653 /nfs/dbraw/zinc/23/86/53/1065238653.db2.gz AUQCYYBIDMPRAI-HZPDHXFCSA-N 1 2 317.477 4.448 20 0 DIADLO CC[C@H]1CN(c2nc(C)[nH+]c(C)c2C)CC[C@H]1c1ccccc1 ZINC001306989454 1065238669 /nfs/dbraw/zinc/23/86/69/1065238669.db2.gz LFWFSLVMXPDAPT-PKOBYXMFSA-N 1 2 309.457 4.422 20 0 DIADLO CCc1cc(NCc2ccc(C)cc2OC(C)C)nc(CC)[nH+]1 ZINC001306994402 1065241439 /nfs/dbraw/zinc/24/14/39/1065241439.db2.gz BHKBZIVTMDLPGM-UHFFFAOYSA-N 1 2 313.445 4.309 20 0 DIADLO CCc1cc(N2CC3(CCCCC3)[C@@H]2C(C)C)nc(CC)[nH+]1 ZINC001307140280 1065281371 /nfs/dbraw/zinc/28/13/71/1065281371.db2.gz XTDBNKMDKFSCBV-SFHVURJKSA-N 1 2 301.478 4.397 20 0 DIADLO CC(C)c1cc(NC[C@@H]2C[C@H]3CCC[C@@H]3O2)nc(C(C)C)[nH+]1 ZINC001307201734 1065301337 /nfs/dbraw/zinc/30/13/37/1065301337.db2.gz SIDDUWWNUDADAT-YCPHGPKFSA-N 1 2 303.450 4.093 20 0 DIADLO CC(C)c1cc(NC[C@@H]2C[C@@H]3CCC[C@H]3O2)nc(C(C)C)[nH+]1 ZINC001307201733 1065301752 /nfs/dbraw/zinc/30/17/52/1065301752.db2.gz SIDDUWWNUDADAT-OFQRWUPVSA-N 1 2 303.450 4.093 20 0 DIADLO Cc1cc(NCc2cccc(OC(C)(C)C)c2)nc(C2CC2)[nH+]1 ZINC001307202936 1065301909 /nfs/dbraw/zinc/30/19/09/1065301909.db2.gz LTWDWSRASHDJMF-UHFFFAOYSA-N 1 2 311.429 4.452 20 0 DIADLO CC(C)c1cc(NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)nc(C(C)C)[nH+]1 ZINC001307201731 1065302245 /nfs/dbraw/zinc/30/22/45/1065302245.db2.gz SIDDUWWNUDADAT-DZKIICNBSA-N 1 2 303.450 4.093 20 0 DIADLO COc1c(C)c[nH+]c(CS[C@@H]2CCOc3ccccc32)c1C ZINC001307316916 1065337915 /nfs/dbraw/zinc/33/79/15/1065337915.db2.gz TXQSFBMVMLKEJL-QGZVFWFLSA-N 1 2 315.438 4.464 20 0 DIADLO c1cn(-c2ccc(CSc3nc4cnccc4s3)cc2)c[nH+]1 ZINC001307370704 1065359678 /nfs/dbraw/zinc/35/96/78/1065359678.db2.gz WFVMMRQFFISZFJ-UHFFFAOYSA-N 1 2 324.434 4.169 20 0 DIADLO CCC(CC)C[N@H+](CC)[C@@H](C(=O)OC)c1ccccc1Cl ZINC001307413741 1065374330 /nfs/dbraw/zinc/37/43/30/1065374330.db2.gz RWHGYRBBCYRNAN-MRXNPFEDSA-N 1 2 311.853 4.312 20 0 DIADLO CCC(CC)C[N@@H+](CC)[C@@H](C(=O)OC)c1ccccc1Cl ZINC001307413741 1065374335 /nfs/dbraw/zinc/37/43/35/1065374335.db2.gz RWHGYRBBCYRNAN-MRXNPFEDSA-N 1 2 311.853 4.312 20 0 DIADLO Clc1ccc2nc(Cl)c(C[NH+]3CCSCC3)cc2c1 ZINC001307416229 1065376630 /nfs/dbraw/zinc/37/66/30/1065376630.db2.gz FGPRTOCORSJFFY-UHFFFAOYSA-N 1 2 313.253 4.090 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nsc3ccccc32)C[C@@H](c2ccccc2)O1 ZINC001307428227 1065389261 /nfs/dbraw/zinc/38/92/61/1065389261.db2.gz OTEJQUSQSRVHFQ-KDOFPFPSSA-N 1 2 324.449 4.258 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nsc3ccccc32)C[C@@H](c2ccccc2)O1 ZINC001307428227 1065389269 /nfs/dbraw/zinc/38/92/69/1065389269.db2.gz OTEJQUSQSRVHFQ-KDOFPFPSSA-N 1 2 324.449 4.258 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nsc3ccccc32)C[C@H](c2ccccc2)O1 ZINC001307428233 1065389292 /nfs/dbraw/zinc/38/92/92/1065389292.db2.gz OTEJQUSQSRVHFQ-RDTXWAMCSA-N 1 2 324.449 4.258 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nsc3ccccc32)C[C@H](c2ccccc2)O1 ZINC001307428233 1065389299 /nfs/dbraw/zinc/38/92/99/1065389299.db2.gz OTEJQUSQSRVHFQ-RDTXWAMCSA-N 1 2 324.449 4.258 20 0 DIADLO COC(=O)C[N@H+](CCCC1CCCC1)Cc1ccc(Cl)cc1 ZINC001307432572 1065393218 /nfs/dbraw/zinc/39/32/18/1065393218.db2.gz UTBLZQKUBZTQRP-UHFFFAOYSA-N 1 2 323.864 4.285 20 0 DIADLO COC(=O)C[N@@H+](CCCC1CCCC1)Cc1ccc(Cl)cc1 ZINC001307432572 1065393224 /nfs/dbraw/zinc/39/32/24/1065393224.db2.gz UTBLZQKUBZTQRP-UHFFFAOYSA-N 1 2 323.864 4.285 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@@H](C)CC1 ZINC001307441228 1065402458 /nfs/dbraw/zinc/40/24/58/1065402458.db2.gz YKGJXLWHZZLBES-CJNGLKHVSA-N 1 2 309.837 4.066 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H](C)CC1 ZINC001307441228 1065402463 /nfs/dbraw/zinc/40/24/63/1065402463.db2.gz YKGJXLWHZZLBES-CJNGLKHVSA-N 1 2 309.837 4.066 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@H+]2Cc2ccccc2CC(C)C)o1 ZINC001307472947 1065422050 /nfs/dbraw/zinc/42/20/50/1065422050.db2.gz OMNYTRSGYCWEKI-IBGZPJMESA-N 1 2 313.441 4.360 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@@H+]2Cc2ccccc2CC(C)C)o1 ZINC001307472947 1065422056 /nfs/dbraw/zinc/42/20/56/1065422056.db2.gz OMNYTRSGYCWEKI-IBGZPJMESA-N 1 2 313.441 4.360 20 0 DIADLO Cc1nc(C[N@H+]2CCCC[C@H]2C(C)C)sc1Br ZINC001307474805 1065424273 /nfs/dbraw/zinc/42/42/73/1065424273.db2.gz ZAWDARIHZNTAKR-NSHDSACASA-N 1 2 317.296 4.225 20 0 DIADLO Cc1nc(C[N@@H+]2CCCC[C@H]2C(C)C)sc1Br ZINC001307474805 1065424279 /nfs/dbraw/zinc/42/42/79/1065424279.db2.gz ZAWDARIHZNTAKR-NSHDSACASA-N 1 2 317.296 4.225 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2CC(=O)c2ccccc2F)o1 ZINC001307498581 1065442355 /nfs/dbraw/zinc/44/23/55/1065442355.db2.gz YRSDYYJCGZWLCK-DYVFJYSZSA-N 1 2 315.388 4.383 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2CC(=O)c2ccccc2F)o1 ZINC001307498581 1065442360 /nfs/dbraw/zinc/44/23/60/1065442360.db2.gz YRSDYYJCGZWLCK-DYVFJYSZSA-N 1 2 315.388 4.383 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2F)[N@H+](Cc2nc3c(o2)CCCC3)C1 ZINC001307502969 1065446804 /nfs/dbraw/zinc/44/68/04/1065446804.db2.gz ASCLCBZCPVIAOK-CXAGYDPISA-N 1 2 314.404 4.276 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2nc3c(o2)CCCC3)C1 ZINC001307502969 1065446811 /nfs/dbraw/zinc/44/68/11/1065446811.db2.gz ASCLCBZCPVIAOK-CXAGYDPISA-N 1 2 314.404 4.276 20 0 DIADLO COc1ccc(Cl)c(C[N@H+](C)Cc2cc3ccccc3[nH]2)c1 ZINC001307512038 1065453859 /nfs/dbraw/zinc/45/38/59/1065453859.db2.gz ALSWFKYWYNWSEJ-UHFFFAOYSA-N 1 2 314.816 4.462 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+](C)Cc2cc3ccccc3[nH]2)c1 ZINC001307512038 1065453866 /nfs/dbraw/zinc/45/38/66/1065453866.db2.gz ALSWFKYWYNWSEJ-UHFFFAOYSA-N 1 2 314.816 4.462 20 0 DIADLO C[C@@H]1c2c(Cl)cc(Cl)cc2CC[N@H+]1CCOCC1CC1 ZINC001307519394 1065460438 /nfs/dbraw/zinc/46/04/38/1065460438.db2.gz DWWYRFGDNMXFQY-LLVKDONJSA-N 1 2 314.256 4.339 20 0 DIADLO C[C@@H]1c2c(Cl)cc(Cl)cc2CC[N@@H+]1CCOCC1CC1 ZINC001307519394 1065460443 /nfs/dbraw/zinc/46/04/43/1065460443.db2.gz DWWYRFGDNMXFQY-LLVKDONJSA-N 1 2 314.256 4.339 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2CCOC3(C2)CCCCCC3)c1F ZINC001307529681 1065466297 /nfs/dbraw/zinc/46/62/97/1065466297.db2.gz KAXDLJITXCUZNU-UHFFFAOYSA-N 1 2 309.400 4.198 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2CCOC3(C2)CCCCCC3)c1F ZINC001307529681 1065466303 /nfs/dbraw/zinc/46/63/03/1065466303.db2.gz KAXDLJITXCUZNU-UHFFFAOYSA-N 1 2 309.400 4.198 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCOC3(C2)CCCCCC3)c1 ZINC001307528695 1065466347 /nfs/dbraw/zinc/46/63/47/1065466347.db2.gz FOZCMJLYZBZKHV-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCOC3(C2)CCCCCC3)c1 ZINC001307528695 1065466353 /nfs/dbraw/zinc/46/63/53/1065466353.db2.gz FOZCMJLYZBZKHV-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1c[nH]nn1)c1ccc(C2CCCCC2)cc1 ZINC001307538113 1065472304 /nfs/dbraw/zinc/47/23/04/1065472304.db2.gz BZQWPLNYZRXCLB-IBGZPJMESA-N 1 2 312.461 4.339 20 0 DIADLO OC[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc(Cl)cc1Cl ZINC001307556246 1065480413 /nfs/dbraw/zinc/48/04/13/1065480413.db2.gz MWSQVLULPHNHSB-QGZVFWFLSA-N 1 2 322.235 4.085 20 0 DIADLO OC[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc(Cl)cc1Cl ZINC001307556246 1065480415 /nfs/dbraw/zinc/48/04/15/1065480415.db2.gz MWSQVLULPHNHSB-QGZVFWFLSA-N 1 2 322.235 4.085 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1ccccc1C(F)(F)F)CC2 ZINC001307595177 1065504676 /nfs/dbraw/zinc/50/46/76/1065504676.db2.gz MWJJJXVZQMXAGN-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1ccccc1C(F)(F)F)CC2 ZINC001307595177 1065504688 /nfs/dbraw/zinc/50/46/88/1065504688.db2.gz MWJJJXVZQMXAGN-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO CC(C)(C)c1ccc(C2([NH2+]Cc3cnsn3)CCCC2)cc1 ZINC001307612775 1065517745 /nfs/dbraw/zinc/51/77/45/1065517745.db2.gz CRLGWPJZYFXEJP-UHFFFAOYSA-N 1 2 315.486 4.395 20 0 DIADLO CC1=CC[N@H+](Cc2cc(Cl)cc(Br)c2)CC1 ZINC001307652234 1065541455 /nfs/dbraw/zinc/54/14/55/1065541455.db2.gz RBXZVBGFSDEYEN-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO CC1=CC[N@@H+](Cc2cc(Cl)cc(Br)c2)CC1 ZINC001307652234 1065541469 /nfs/dbraw/zinc/54/14/69/1065541469.db2.gz RBXZVBGFSDEYEN-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO Fc1cccc(F)c1C[N@H+](CCSc1ccncc1)C1CC1 ZINC001307677590 1065556756 /nfs/dbraw/zinc/55/67/56/1065556756.db2.gz VTQPJXZHMIOWJZ-UHFFFAOYSA-N 1 2 320.408 4.117 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](CCSc1ccncc1)C1CC1 ZINC001307677590 1065556767 /nfs/dbraw/zinc/55/67/67/1065556767.db2.gz VTQPJXZHMIOWJZ-UHFFFAOYSA-N 1 2 320.408 4.117 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+]([C@H]3C=CCCCCC3)CCO2)c(F)c1 ZINC001307699777 1065570247 /nfs/dbraw/zinc/57/02/47/1065570247.db2.gz HKHICPLJSOQAHY-YJBOKZPZSA-N 1 2 307.384 4.227 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+]([C@H]3C=CCCCCC3)CCO2)c(F)c1 ZINC001307699777 1065570258 /nfs/dbraw/zinc/57/02/58/1065570258.db2.gz HKHICPLJSOQAHY-YJBOKZPZSA-N 1 2 307.384 4.227 20 0 DIADLO CCC1(c2ccc(Cl)cc2)CC[NH+](Cc2cnsn2)CC1 ZINC001307739539 1065595563 /nfs/dbraw/zinc/59/55/63/1065595563.db2.gz BOHUDIRBZUEPQH-UHFFFAOYSA-N 1 2 321.877 4.135 20 0 DIADLO C[C@@]12CC[N@H+](Cc3ccc(Cl)cc3F)C[C@@H]1C2(Cl)Cl ZINC001307767194 1065611154 /nfs/dbraw/zinc/61/11/54/1065611154.db2.gz RPZKOKDMXFIVAZ-QWHCGFSZSA-N 1 2 322.638 4.495 20 0 DIADLO C[C@@]12CC[N@@H+](Cc3ccc(Cl)cc3F)C[C@@H]1C2(Cl)Cl ZINC001307767194 1065611158 /nfs/dbraw/zinc/61/11/58/1065611158.db2.gz RPZKOKDMXFIVAZ-QWHCGFSZSA-N 1 2 322.638 4.495 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(F)c2Cl)Cc2ccccc2O1 ZINC001307811146 1065634340 /nfs/dbraw/zinc/63/43/40/1065634340.db2.gz SLSKAJHDVJQKSZ-LBPRGKRZSA-N 1 2 305.780 4.262 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(F)c2Cl)Cc2ccccc2O1 ZINC001307811146 1065634342 /nfs/dbraw/zinc/63/43/42/1065634342.db2.gz SLSKAJHDVJQKSZ-LBPRGKRZSA-N 1 2 305.780 4.262 20 0 DIADLO CC[C@@H]1C[N@H+]([C@@H](C)c2ncc(-c3ccccc3)o2)C[C@H](CC)O1 ZINC001307856521 1065656565 /nfs/dbraw/zinc/65/65/65/1065656565.db2.gz LPGHJAHJYGYWDS-BHYGNILZSA-N 1 2 314.429 4.292 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2ncc(-c3ccccc3)o2)C[C@H](CC)O1 ZINC001307856521 1065656569 /nfs/dbraw/zinc/65/65/69/1065656569.db2.gz LPGHJAHJYGYWDS-BHYGNILZSA-N 1 2 314.429 4.292 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC(C)(C)C[C@H]2c2ccccc2)no1 ZINC001307862509 1065658354 /nfs/dbraw/zinc/65/83/54/1065658354.db2.gz BIECAXGPVLDKTC-INIZCTEOSA-N 1 2 313.445 4.385 20 0 DIADLO CCCCc1nc(C[N@H+]2CC(C)(C)C[C@H]2c2ccccc2)no1 ZINC001307862509 1065658362 /nfs/dbraw/zinc/65/83/62/1065658362.db2.gz BIECAXGPVLDKTC-INIZCTEOSA-N 1 2 313.445 4.385 20 0 DIADLO Cc1noc(CCC[N@@H+](CC(C)C)c2ccc(C)cc2C)n1 ZINC001307902980 1065674350 /nfs/dbraw/zinc/67/43/50/1065674350.db2.gz JFOXPVXTCIPBES-UHFFFAOYSA-N 1 2 301.434 4.090 20 0 DIADLO Cc1noc(CCC[N@H+](CC(C)C)c2ccc(C)cc2C)n1 ZINC001307902980 1065674358 /nfs/dbraw/zinc/67/43/58/1065674358.db2.gz JFOXPVXTCIPBES-UHFFFAOYSA-N 1 2 301.434 4.090 20 0 DIADLO CC1(C)CO[C@@H](c2cccc(F)c2)C[N@@H+]1Cc1ccccc1F ZINC001307933401 1065687992 /nfs/dbraw/zinc/68/79/92/1065687992.db2.gz CSSRMHSJCVKAOH-GOSISDBHSA-N 1 2 317.379 4.317 20 0 DIADLO CC1(C)CO[C@@H](c2cccc(F)c2)C[N@H+]1Cc1ccccc1F ZINC001307933401 1065687998 /nfs/dbraw/zinc/68/79/98/1065687998.db2.gz CSSRMHSJCVKAOH-GOSISDBHSA-N 1 2 317.379 4.317 20 0 DIADLO Cc1ccc2c(c1Br)C[N@H+](C[C@H]1CCC(C)(C)O1)C2 ZINC001307956048 1065699622 /nfs/dbraw/zinc/69/96/22/1065699622.db2.gz YGTMBOIIFNEKMH-CYBMUJFWSA-N 1 2 324.262 4.031 20 0 DIADLO FC(F)[C@H]([NH2+]Cc1ccc(-n2ccnc2)cc1)C1CCCCC1 ZINC001307944931 1065692381 /nfs/dbraw/zinc/69/23/81/1065692381.db2.gz MVVACGVXCXRTSP-QGZVFWFLSA-N 1 2 319.399 4.176 20 0 DIADLO Cc1ccc2c(c1Br)C[N@@H+](C[C@H]1CCC(C)(C)O1)C2 ZINC001307956048 1065699613 /nfs/dbraw/zinc/69/96/13/1065699613.db2.gz YGTMBOIIFNEKMH-CYBMUJFWSA-N 1 2 324.262 4.031 20 0 DIADLO COC(=O)c1ccc(C[N@@H+]2Cc3ccccc3[C@@H]2C)cc1Cl ZINC001307964685 1065702357 /nfs/dbraw/zinc/70/23/57/1065702357.db2.gz KJVRCNZLHLMZBI-LBPRGKRZSA-N 1 2 315.800 4.203 20 0 DIADLO COC(=O)c1ccc(C[N@H+]2Cc3ccccc3[C@@H]2C)cc1Cl ZINC001307964685 1065702362 /nfs/dbraw/zinc/70/23/62/1065702362.db2.gz KJVRCNZLHLMZBI-LBPRGKRZSA-N 1 2 315.800 4.203 20 0 DIADLO Cc1oncc1C[N@@H+](C)Cc1ccccc1OCc1ccccc1 ZINC001307995788 1065717432 /nfs/dbraw/zinc/71/74/32/1065717432.db2.gz DEVAPYPGAWSLKG-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1oncc1C[N@H+](C)Cc1ccccc1OCc1ccccc1 ZINC001307995788 1065717443 /nfs/dbraw/zinc/71/74/43/1065717443.db2.gz DEVAPYPGAWSLKG-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO CC(C)COC(=O)C[NH2+][C@H]1CCC(C)(C)C[C@H]1c1ccccc1 ZINC001308024262 1065727957 /nfs/dbraw/zinc/72/79/57/1065727957.db2.gz SUHUIKZUBALQGW-ROUUACIJSA-N 1 2 317.473 4.138 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2Cc2cnc(-c3ccccc3)o2)[nH+]c1C ZINC001308071187 1065749843 /nfs/dbraw/zinc/74/98/43/1065749843.db2.gz QLUYIVFTMWIURN-KRWDZBQOSA-N 1 2 322.412 4.019 20 0 DIADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2cnc(-c3ccccc3)o2)[nH]c1C ZINC001308071187 1065749854 /nfs/dbraw/zinc/74/98/54/1065749854.db2.gz QLUYIVFTMWIURN-KRWDZBQOSA-N 1 2 322.412 4.019 20 0 DIADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2cnc(-c3ccccc3)o2)[nH]c1C ZINC001308071187 1065749868 /nfs/dbraw/zinc/74/98/68/1065749868.db2.gz QLUYIVFTMWIURN-KRWDZBQOSA-N 1 2 322.412 4.019 20 0 DIADLO CC[C@@H](C)[C@@H]([NH2+][C@@H](CC)c1cccc2ccccc21)C(=O)OC ZINC001308084222 1065754594 /nfs/dbraw/zinc/75/45/94/1065754594.db2.gz DPXFMSKPJGLSMC-MDASCCDHSA-N 1 2 313.441 4.468 20 0 DIADLO COC(=O)[C@H](CC(C)C)[NH2+][C@H]1CCc2cccc3cccc1c32 ZINC001308092794 1065759979 /nfs/dbraw/zinc/75/99/79/1065759979.db2.gz NAGLXYQVGUKWSI-ROUUACIJSA-N 1 2 311.425 4.004 20 0 DIADLO Cc1cc([C@H]2CCCC[N@@H+]2Cc2cc(-c3ccccc3)no2)[nH]n1 ZINC001308109715 1065767861 /nfs/dbraw/zinc/76/78/61/1065767861.db2.gz SFQBBHVXMOOGRW-LJQANCHMSA-N 1 2 322.412 4.100 20 0 DIADLO Cc1cc([C@H]2CCCC[N@H+]2Cc2cc(-c3ccccc3)no2)[nH]n1 ZINC001308109715 1065767876 /nfs/dbraw/zinc/76/78/76/1065767876.db2.gz SFQBBHVXMOOGRW-LJQANCHMSA-N 1 2 322.412 4.100 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccsc2Cl)nc1 ZINC001308150973 1065782041 /nfs/dbraw/zinc/78/20/41/1065782041.db2.gz ZZOASCGKFVQGID-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccsc2Cl)nc1 ZINC001308150973 1065782048 /nfs/dbraw/zinc/78/20/48/1065782048.db2.gz ZZOASCGKFVQGID-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2F)nc1 ZINC001308149060 1065782522 /nfs/dbraw/zinc/78/25/22/1065782522.db2.gz MINXDYYUSQCJLK-QGZVFWFLSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)cc2F)nc1 ZINC001308149060 1065782529 /nfs/dbraw/zinc/78/25/29/1065782529.db2.gz MINXDYYUSQCJLK-QGZVFWFLSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1cc(CNc2cccc(OC(F)F)c2)c2c([nH+]1)CCCC2 ZINC001308213685 1065822151 /nfs/dbraw/zinc/82/21/51/1065822151.db2.gz ODCWYAVEJJFHMG-UHFFFAOYSA-N 1 2 318.367 4.482 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1cc(F)c(F)c(F)c1 ZINC001308232624 1065838569 /nfs/dbraw/zinc/83/85/69/1065838569.db2.gz ZCTXOHOZGZLYQU-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO CC(C)n1ccc(C[NH2+]Cc2ccc(-c3ccccc3F)o2)n1 ZINC001308275636 1065875033 /nfs/dbraw/zinc/87/50/33/1065875033.db2.gz HXYKZOSGZIJGIK-UHFFFAOYSA-N 1 2 313.376 4.153 20 0 DIADLO Cc1ccc(C[NH2+]Cc2c(F)cccc2F)c(OCC2CC2)c1 ZINC001308307947 1065902785 /nfs/dbraw/zinc/90/27/85/1065902785.db2.gz URZDWBIVJDDZJG-UHFFFAOYSA-N 1 2 317.379 4.352 20 0 DIADLO CC[C@@H]1CCC[C@H](CNc2ccccc2C[NH+]2CCOCC2)C1 ZINC001308318226 1065909145 /nfs/dbraw/zinc/90/91/45/1065909145.db2.gz RMILRYFBOOFUPT-MSOLQXFVSA-N 1 2 316.489 4.147 20 0 DIADLO CCCCOc1ccc(OC)cc1NCc1c[nH+]cn1CCC ZINC001308319546 1065910809 /nfs/dbraw/zinc/91/08/09/1065910809.db2.gz GSEBZTGNMUFYTR-UHFFFAOYSA-N 1 2 317.433 4.093 20 0 DIADLO Cc1ccc(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)nc1 ZINC001308319292 1065911637 /nfs/dbraw/zinc/91/16/37/1065911637.db2.gz UZFGYWCHLRDLEY-UHFFFAOYSA-N 1 2 318.424 4.202 20 0 DIADLO CCSCc1cc[nH+]c(NCc2nc3c(s2)CCCC3)c1 ZINC001308332484 1065920246 /nfs/dbraw/zinc/92/02/46/1065920246.db2.gz VDSQPLVJBZOOSZ-UHFFFAOYSA-N 1 2 319.499 4.282 20 0 DIADLO Cc1nn(C)c2cc(NCc3cc(C)[nH+]c4c3CCCC4)ccc12 ZINC001308412748 1065971868 /nfs/dbraw/zinc/97/18/68/1065971868.db2.gz KCXKLDDVSBONKH-UHFFFAOYSA-N 1 2 320.440 4.076 20 0 DIADLO CCCn1ncc(NCc2cc(C)[nH+]c3c2CCCC3)c1C1CC1 ZINC001308411995 1065972247 /nfs/dbraw/zinc/97/22/47/1065972247.db2.gz LELNFTYLLRLSJV-UHFFFAOYSA-N 1 2 324.472 4.365 20 0 DIADLO COc1cc(CNc2cc3cc[nH]c3c[nH+]2)cc2ccccc21 ZINC001308449708 1065995656 /nfs/dbraw/zinc/99/56/56/1065995656.db2.gz DZIRUOPRHUKVJU-UHFFFAOYSA-N 1 2 303.365 4.337 20 0 DIADLO CCCCOc1ccc(C[NH2+]CC(F)(F)CC)cc1OC ZINC001308464052 1066004853 /nfs/dbraw/zinc/00/48/53/1066004853.db2.gz FCUUJHFLRHBFER-UHFFFAOYSA-N 1 2 301.377 4.009 20 0 DIADLO CCOc1ccc(CNc2c[nH+]cc3c2CCCC3)cc1F ZINC001308464269 1066004959 /nfs/dbraw/zinc/00/49/59/1066004959.db2.gz RQXVCGPSVPBKIH-UHFFFAOYSA-N 1 2 300.377 4.110 20 0 DIADLO FC(F)Oc1cccc(CNc2c[nH+]cc3c2CCCC3)c1 ZINC001308464245 1066005123 /nfs/dbraw/zinc/00/51/23/1066005123.db2.gz RGWMGPXDTRMFNW-UHFFFAOYSA-N 1 2 304.340 4.174 20 0 DIADLO CCC(F)(F)C[NH2+]Cc1ccc(OC)c(OCCC(C)C)c1 ZINC001308464317 1066005782 /nfs/dbraw/zinc/00/57/82/1066005782.db2.gz BCXNVCNDZAYEPE-UHFFFAOYSA-N 1 2 315.404 4.255 20 0 DIADLO FC(F)(F)c1cc(C[NH2+]Cc2nc3ccccc3o2)cs1 ZINC001308481935 1066019807 /nfs/dbraw/zinc/01/98/07/1066019807.db2.gz DEUGCNJELYFULR-UHFFFAOYSA-N 1 2 312.316 4.198 20 0 DIADLO Fc1cccc(F)c1C[NH2+]Cc1csc(C(F)(F)F)c1 ZINC001308481957 1066020529 /nfs/dbraw/zinc/02/05/29/1066020529.db2.gz FKTACWGHCRRNQY-UHFFFAOYSA-N 1 2 307.287 4.335 20 0 DIADLO COc1cccc2[nH]c(NCc3ccc(C4CCC4)cc3)[nH+]c21 ZINC001308507690 1066035923 /nfs/dbraw/zinc/03/59/23/1066035923.db2.gz IJDQAHJZAMORPV-UHFFFAOYSA-N 1 2 307.397 4.451 20 0 DIADLO CSCc1cnc(CNc2[nH]c3ccc(Cl)cc3[nH+]2)s1 ZINC001308510046 1066037748 /nfs/dbraw/zinc/03/77/48/1066037748.db2.gz KWKXAPSCPVZZIM-UHFFFAOYSA-N 1 2 324.862 4.148 20 0 DIADLO CSCc1cnc(CNc2[nH]c3cc(Cl)ccc3[nH+]2)s1 ZINC001308510046 1066037758 /nfs/dbraw/zinc/03/77/58/1066037758.db2.gz KWKXAPSCPVZZIM-UHFFFAOYSA-N 1 2 324.862 4.148 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(C2CC2)n1)c1cc(F)ccc1N(C)C ZINC001308556176 1066066819 /nfs/dbraw/zinc/06/68/19/1066066819.db2.gz XBJIILREIXYKFO-LLVKDONJSA-N 1 2 319.449 4.076 20 0 DIADLO Fc1cc(C[N@H+]2CC=C(C(F)(F)F)CC2)ccc1C(F)F ZINC001308569213 1066078769 /nfs/dbraw/zinc/07/87/69/1066078769.db2.gz WDHQBRSPCVVUKW-UHFFFAOYSA-N 1 2 309.253 4.458 20 0 DIADLO Fc1cc(C[N@@H+]2CC=C(C(F)(F)F)CC2)ccc1C(F)F ZINC001308569213 1066078781 /nfs/dbraw/zinc/07/87/81/1066078781.db2.gz WDHQBRSPCVVUKW-UHFFFAOYSA-N 1 2 309.253 4.458 20 0 DIADLO Cc1ccccc1N1CC[NH+](Cc2cc(F)cc(Cl)c2)CC1 ZINC001308578761 1066092853 /nfs/dbraw/zinc/09/28/53/1066092853.db2.gz XCWVVDHKPNVSMZ-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO CCn1ccc(C[N@H+](CC)Cc2ccc(Cl)c(Cl)c2)n1 ZINC001308580742 1066095703 /nfs/dbraw/zinc/09/57/03/1066095703.db2.gz ZFFGIKNVGYAMIK-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO CCn1ccc(C[N@@H+](CC)Cc2ccc(Cl)c(Cl)c2)n1 ZINC001308580742 1066095710 /nfs/dbraw/zinc/09/57/10/1066095710.db2.gz ZFFGIKNVGYAMIK-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO COc1cnc(F)c(C[N@@H+](Cc2ccccc2F)CC(C)C)c1 ZINC001308582545 1066098752 /nfs/dbraw/zinc/09/87/52/1066098752.db2.gz TZQSPRQEVRDYSC-UHFFFAOYSA-N 1 2 320.383 4.027 20 0 DIADLO COc1cnc(F)c(C[N@H+](Cc2ccccc2F)CC(C)C)c1 ZINC001308582545 1066098762 /nfs/dbraw/zinc/09/87/62/1066098762.db2.gz TZQSPRQEVRDYSC-UHFFFAOYSA-N 1 2 320.383 4.027 20 0 DIADLO C[C@H](Cc1ccsc1)[N@H+](C)Cc1csc(C(F)(F)F)n1 ZINC001308595983 1066107006 /nfs/dbraw/zinc/10/70/06/1066107006.db2.gz YBVAKZQMAZPHDC-SECBINFHSA-N 1 2 320.405 4.286 20 0 DIADLO C[C@H](Cc1ccsc1)[N@@H+](C)Cc1csc(C(F)(F)F)n1 ZINC001308595983 1066107010 /nfs/dbraw/zinc/10/70/10/1066107010.db2.gz YBVAKZQMAZPHDC-SECBINFHSA-N 1 2 320.405 4.286 20 0 DIADLO CC[C@]1(C)CC[N@H+](Cc2cc(Br)cnc2Cl)C1 ZINC001308598065 1066108329 /nfs/dbraw/zinc/10/83/29/1066108329.db2.gz HXMSPCGSGJROOQ-CYBMUJFWSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@]1(C)CC[N@@H+](Cc2cc(Br)cnc2Cl)C1 ZINC001308598065 1066108333 /nfs/dbraw/zinc/10/83/33/1066108333.db2.gz HXMSPCGSGJROOQ-CYBMUJFWSA-N 1 2 317.658 4.120 20 0 DIADLO COC(=O)c1cnc([C@@H](C)[NH+]2CCC(CCC(C)C)CC2)s1 ZINC001308604856 1066113011 /nfs/dbraw/zinc/11/30/11/1066113011.db2.gz XRSJJNMRHLWWQR-CYBMUJFWSA-N 1 2 324.490 4.139 20 0 DIADLO C[N@H+](Cc1cc(Cl)cc2c1OCC2)Cc1ccccc1F ZINC001308612787 1066117614 /nfs/dbraw/zinc/11/76/14/1066117614.db2.gz UCDDJGTXTPPPIM-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO C[N@@H+](Cc1cc(Cl)cc2c1OCC2)Cc1ccccc1F ZINC001308612787 1066117619 /nfs/dbraw/zinc/11/76/19/1066117619.db2.gz UCDDJGTXTPPPIM-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Cc1ccccc1OCCC[N@@H+](C)Cc1nc(Cl)cs1 ZINC001308612644 1066118276 /nfs/dbraw/zinc/11/82/76/1066118276.db2.gz QINMMBLCLOFJFF-UHFFFAOYSA-N 1 2 310.850 4.006 20 0 DIADLO Cc1ccccc1OCCC[N@H+](C)Cc1nc(Cl)cs1 ZINC001308612644 1066118281 /nfs/dbraw/zinc/11/82/81/1066118281.db2.gz QINMMBLCLOFJFF-UHFFFAOYSA-N 1 2 310.850 4.006 20 0 DIADLO CCCn1c[nH+]cc1CN(C)[C@@H](c1ccccc1)C(F)(F)F ZINC001308619141 1066122353 /nfs/dbraw/zinc/12/23/53/1066122353.db2.gz KCBHKOPOKZKPBZ-HNNXBMFYSA-N 1 2 311.351 4.029 20 0 DIADLO CC[C@H]1c2ccsc2CC[N@H+]1Cc1ccc(O)c(F)c1F ZINC001308628083 1066124918 /nfs/dbraw/zinc/12/49/18/1066124918.db2.gz PLXCXLFYDMLIJW-LBPRGKRZSA-N 1 2 309.381 4.241 20 0 DIADLO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1ccc(O)c(F)c1F ZINC001308628083 1066124920 /nfs/dbraw/zinc/12/49/20/1066124920.db2.gz PLXCXLFYDMLIJW-LBPRGKRZSA-N 1 2 309.381 4.241 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cccc(OC3CC3)c2F)C2CC2)o1 ZINC001308651090 1066138170 /nfs/dbraw/zinc/13/81/70/1066138170.db2.gz RMCPLTAFRIQRID-UHFFFAOYSA-N 1 2 315.388 4.433 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cccc(OC3CC3)c2F)C2CC2)o1 ZINC001308651090 1066138173 /nfs/dbraw/zinc/13/81/73/1066138173.db2.gz RMCPLTAFRIQRID-UHFFFAOYSA-N 1 2 315.388 4.433 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC001308659805 1066142358 /nfs/dbraw/zinc/14/23/58/1066142358.db2.gz CYQYUWZHNDBERX-SFHVURJKSA-N 1 2 313.441 4.459 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC001308659805 1066142361 /nfs/dbraw/zinc/14/23/61/1066142361.db2.gz CYQYUWZHNDBERX-SFHVURJKSA-N 1 2 313.441 4.459 20 0 DIADLO Nc1[nH+]cccc1CN1CCCc2cc(-c3ccccc3)ccc21 ZINC001308679503 1066152927 /nfs/dbraw/zinc/15/29/27/1066152927.db2.gz XQJSCWQDTLRLIW-UHFFFAOYSA-N 1 2 315.420 4.284 20 0 DIADLO CCCCOc1ccccc1C[N@@H+]1CCC=C(Br)C1 ZINC001308719249 1066197650 /nfs/dbraw/zinc/19/76/50/1066197650.db2.gz YODLYBSVRFZDRC-UHFFFAOYSA-N 1 2 324.262 4.350 20 0 DIADLO CCCCOc1ccccc1C[N@H+]1CCC=C(Br)C1 ZINC001308719249 1066197651 /nfs/dbraw/zinc/19/76/51/1066197651.db2.gz YODLYBSVRFZDRC-UHFFFAOYSA-N 1 2 324.262 4.350 20 0 DIADLO C[N@H+](CCOc1ccccc1C(C)(C)C)Cc1ncccc1F ZINC001308722682 1066198550 /nfs/dbraw/zinc/19/85/50/1066198550.db2.gz BSOOXJLLHLYOFQ-UHFFFAOYSA-N 1 2 316.420 4.029 20 0 DIADLO C[N@@H+](CCOc1ccccc1C(C)(C)C)Cc1ncccc1F ZINC001308722682 1066198556 /nfs/dbraw/zinc/19/85/56/1066198556.db2.gz BSOOXJLLHLYOFQ-UHFFFAOYSA-N 1 2 316.420 4.029 20 0 DIADLO CC[C@](C)(CNc1cccc(-c2[nH+]cc3n2CCCC3)c1)OC ZINC001308720768 1066199372 /nfs/dbraw/zinc/19/93/72/1066199372.db2.gz BFFJQVTZLNLJPC-LJQANCHMSA-N 1 2 313.445 4.113 20 0 DIADLO C[C@@H]1CN(c2ccccc2F)CC[N@@H+]1Cc1cscc1Cl ZINC001308731647 1066207198 /nfs/dbraw/zinc/20/71/98/1066207198.db2.gz BZQZLTVJVFQOOV-GFCCVEGCSA-N 1 2 324.852 4.251 20 0 DIADLO C[C@@H]1CN(c2ccccc2F)CC[N@H+]1Cc1cscc1Cl ZINC001308731647 1066207212 /nfs/dbraw/zinc/20/72/12/1066207212.db2.gz BZQZLTVJVFQOOV-GFCCVEGCSA-N 1 2 324.852 4.251 20 0 DIADLO C[C@@H]1CSc2ccc(Cl)cc2N(Cc2ccc[nH+]c2N)C1 ZINC001308795789 1066271584 /nfs/dbraw/zinc/27/15/84/1066271584.db2.gz AFFISCHCBBAVAL-NSHDSACASA-N 1 2 319.861 4.066 20 0 DIADLO CCOc1ccc(C[NH2+]Cc2nc(-c3ccccc3)cs2)o1 ZINC001308797612 1066273527 /nfs/dbraw/zinc/27/35/27/1066273527.db2.gz UFKRTFKOPFPIBN-UHFFFAOYSA-N 1 2 314.410 4.092 20 0 DIADLO CCc1cc(OC)ccc1C[N@@H+]1Cc2ccc(Cl)cc2C1 ZINC001308813683 1066288571 /nfs/dbraw/zinc/28/85/71/1066288571.db2.gz WGDWNPXOPCNHFK-UHFFFAOYSA-N 1 2 301.817 4.427 20 0 DIADLO CCc1cc(OC)ccc1C[N@H+]1Cc2ccc(Cl)cc2C1 ZINC001308813683 1066288577 /nfs/dbraw/zinc/28/85/77/1066288577.db2.gz WGDWNPXOPCNHFK-UHFFFAOYSA-N 1 2 301.817 4.427 20 0 DIADLO Cc1c(Cl)cccc1C[N@@H+]([C@H](C)C(=O)OC(C)(C)C)C1CC1 ZINC001308814077 1066289209 /nfs/dbraw/zinc/28/92/09/1066289209.db2.gz XREYCMYPMJDLJX-CYBMUJFWSA-N 1 2 323.864 4.343 20 0 DIADLO Cc1c(Cl)cccc1C[N@H+]([C@H](C)C(=O)OC(C)(C)C)C1CC1 ZINC001308814077 1066289222 /nfs/dbraw/zinc/28/92/22/1066289222.db2.gz XREYCMYPMJDLJX-CYBMUJFWSA-N 1 2 323.864 4.343 20 0 DIADLO COc1cccc(C2CC(Nc3ccc(N4CCCC4)c[nH+]3)C2)c1 ZINC001308829642 1066303493 /nfs/dbraw/zinc/30/34/93/1066303493.db2.gz CSWGGNBJANQDJK-UHFFFAOYSA-N 1 2 323.440 4.049 20 0 DIADLO C[C@@]1(C(F)F)C[N@H+](Cc2ccc(C3CC3)c(C3CC3)c2)CCO1 ZINC001308871431 1066351558 /nfs/dbraw/zinc/35/15/58/1066351558.db2.gz JAMSEJLCPPGBQS-IBGZPJMESA-N 1 2 321.411 4.297 20 0 DIADLO C[C@@]1(C(F)F)C[N@@H+](Cc2ccc(C3CC3)c(C3CC3)c2)CCO1 ZINC001308871431 1066351566 /nfs/dbraw/zinc/35/15/66/1066351566.db2.gz JAMSEJLCPPGBQS-IBGZPJMESA-N 1 2 321.411 4.297 20 0 DIADLO C/C=C/C[C@@H]1CCC[N@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC001308885569 1066367118 /nfs/dbraw/zinc/36/71/18/1066367118.db2.gz HXXWRIZPQDIPQZ-KXMPLOMGSA-N 1 2 304.381 4.340 20 0 DIADLO C/C=C/C[C@@H]1CCC[N@@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC001308885569 1066367133 /nfs/dbraw/zinc/36/71/33/1066367133.db2.gz HXXWRIZPQDIPQZ-KXMPLOMGSA-N 1 2 304.381 4.340 20 0 DIADLO CC(C)COC(=O)[C@H](C)[NH2+][C@@H]1C[C@H](C)C[C@H](c2ccccc2)C1 ZINC001308908087 1066385434 /nfs/dbraw/zinc/38/54/34/1066385434.db2.gz WGLWLOBMDSRIBT-KCITZHQASA-N 1 2 317.473 4.136 20 0 DIADLO COC(=O)CCC[C@H]1CCC[C@H](Nc2c[nH+]c(C)c(C)c2)C1 ZINC001308917985 1066397914 /nfs/dbraw/zinc/39/79/14/1066397914.db2.gz IHEVTXDZXAQJOI-CVEARBPZSA-N 1 2 304.434 4.012 20 0 DIADLO C[C@]12C[N@H+](Cc3csc(C(F)(F)F)n3)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC001308960451 1066422176 /nfs/dbraw/zinc/42/21/76/1066422176.db2.gz KSUCLPHZPMHLBJ-HEQLZXTPSA-N 1 2 316.392 4.030 20 0 DIADLO C[C@]12C[N@@H+](Cc3csc(C(F)(F)F)n3)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC001308960451 1066422183 /nfs/dbraw/zinc/42/21/83/1066422183.db2.gz KSUCLPHZPMHLBJ-HEQLZXTPSA-N 1 2 316.392 4.030 20 0 DIADLO CC[C@@H](C)[C@H](CNc1[nH+]c2ccccc2n1C(C)(C)C)OC ZINC001308989815 1066435178 /nfs/dbraw/zinc/43/51/78/1066435178.db2.gz LSNUUZSMTBMMEM-CJNGLKHVSA-N 1 2 303.450 4.264 20 0 DIADLO CCCCC[C@H](NC(=O)Nc1cc(C)[nH+]cc1C)C(C)(C)C ZINC001310450340 1066525991 /nfs/dbraw/zinc/52/59/91/1066525991.db2.gz DTBMMZDFIZQDDL-INIZCTEOSA-N 1 2 305.466 4.237 20 0 DIADLO CSC1CCC(CNC(=O)Nc2c(C)cc(C)[nH+]c2C)CC1 ZINC001310834846 1066566573 /nfs/dbraw/zinc/56/65/73/1066566573.db2.gz ORCMKBHELCDWOD-UHFFFAOYSA-N 1 2 321.490 4.050 20 0 DIADLO CC(C)CC1(CNC(=O)Nc2ccc3[nH+]ccn3c2)CCCC1 ZINC001311025518 1066588643 /nfs/dbraw/zinc/58/86/43/1066588643.db2.gz DFYXFTZSGNHMIB-UHFFFAOYSA-N 1 2 314.433 4.062 20 0 DIADLO COCc1cc(C[N@H+](C)C2c3ccccc3-c3ccccc32)no1 ZINC000297847095 536707114 /nfs/dbraw/zinc/70/71/14/536707114.db2.gz OHSXLKXREINCBK-UHFFFAOYSA-N 1 2 320.392 4.023 20 0 DIADLO COCc1cc(C[N@@H+](C)C2c3ccccc3-c3ccccc32)no1 ZINC000297847095 536707119 /nfs/dbraw/zinc/70/71/19/536707119.db2.gz OHSXLKXREINCBK-UHFFFAOYSA-N 1 2 320.392 4.023 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@H+](Cc2nc(Cl)ccc2Cl)C1 ZINC000088420026 185249412 /nfs/dbraw/zinc/24/94/12/185249412.db2.gz VMBCKIACSIVAFO-QMMMGPOBSA-N 1 2 313.150 4.163 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@@H+](Cc2nc(Cl)ccc2Cl)C1 ZINC000088420026 185249413 /nfs/dbraw/zinc/24/94/13/185249413.db2.gz VMBCKIACSIVAFO-QMMMGPOBSA-N 1 2 313.150 4.163 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N[C@@H]2CCOC3(CCCCC3)C2)c1 ZINC000133480367 334960199 /nfs/dbraw/zinc/96/01/99/334960199.db2.gz GCWMBZPXUXTULX-CYBMUJFWSA-N 1 2 314.351 4.394 20 0 DIADLO CC(C)CCc1nc(C[N@H+](C)[C@H](C)c2ccncc2)cs1 ZINC000091987400 193137168 /nfs/dbraw/zinc/13/71/68/193137168.db2.gz KRYSJYFRISTUQA-CQSZACIVSA-N 1 2 303.475 4.320 20 0 DIADLO CC(C)CCc1nc(C[N@@H+](C)[C@H](C)c2ccncc2)cs1 ZINC000091987400 193137169 /nfs/dbraw/zinc/13/71/69/193137169.db2.gz KRYSJYFRISTUQA-CQSZACIVSA-N 1 2 303.475 4.320 20 0 DIADLO Cc1cc(NC(=O)CCSc2ccc(Cl)cc2)cc[nH+]1 ZINC000215619027 335010507 /nfs/dbraw/zinc/01/05/07/335010507.db2.gz ZRBWNODSMZGNAD-UHFFFAOYSA-N 1 2 306.818 4.164 20 0 DIADLO Cc1ncsc1C[N@H+](Cc1cccc(C)c1)Cc1ccccn1 ZINC000093086677 193201945 /nfs/dbraw/zinc/20/19/45/193201945.db2.gz KNFWBCYUAYBEDI-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO Cc1ncsc1C[N@@H+](Cc1cccc(C)c1)Cc1ccccn1 ZINC000093086677 193201947 /nfs/dbraw/zinc/20/19/47/193201947.db2.gz KNFWBCYUAYBEDI-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO CC(C)CCOc1ccccc1C[NH2+][C@@H](C)c1nccs1 ZINC000093404081 193244089 /nfs/dbraw/zinc/24/40/89/193244089.db2.gz GJKZQPLLHKJUIJ-AWEZNQCLSA-N 1 2 304.459 4.419 20 0 DIADLO C[N@H+](Cc1nccs1)Cc1ccc(OC(F)F)c(Cl)c1 ZINC000093582873 193269034 /nfs/dbraw/zinc/26/90/34/193269034.db2.gz GKTMUFLXIGZCSG-UHFFFAOYSA-N 1 2 318.776 4.030 20 0 DIADLO C[N@@H+](Cc1nccs1)Cc1ccc(OC(F)F)c(Cl)c1 ZINC000093582873 193269038 /nfs/dbraw/zinc/26/90/38/193269038.db2.gz GKTMUFLXIGZCSG-UHFFFAOYSA-N 1 2 318.776 4.030 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)[C@@H]2CCCCO2)c1C(C)C ZINC000191955689 335018279 /nfs/dbraw/zinc/01/82/79/335018279.db2.gz OQHQHTINWJZGPE-INIZCTEOSA-N 1 2 312.413 4.174 20 0 DIADLO Cc1c2cccc(Cl)c2oc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000017820783 182085958 /nfs/dbraw/zinc/08/59/58/182085958.db2.gz GTLOOCJXKMLEFK-UHFFFAOYSA-N 1 2 300.745 4.350 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccccc2OCC2CC2)c(C)[nH+]1 ZINC000152361182 335021082 /nfs/dbraw/zinc/02/10/82/335021082.db2.gz SDPFPEDPNCPEJF-UHFFFAOYSA-N 1 2 311.385 4.131 20 0 DIADLO Cc1ccc(NC(=O)N(C)Cc2cc3ccccc3o2)c(C)[nH+]1 ZINC000152366470 335021302 /nfs/dbraw/zinc/02/13/02/335021302.db2.gz YSVSHWWWJRNZSY-UHFFFAOYSA-N 1 2 309.369 4.109 20 0 DIADLO Cc1ccc(NC(=O)NC[C@@H](C)Sc2ccccc2)c(C)[nH+]1 ZINC000152363623 335023389 /nfs/dbraw/zinc/02/33/89/335023389.db2.gz KYZCXGKQHBEDFH-CYBMUJFWSA-N 1 2 315.442 4.001 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccc(F)cc1)C1CCC1)c1nc(C2CC2)no1 ZINC000104706365 194029973 /nfs/dbraw/zinc/02/99/73/194029973.db2.gz FGHOJYMNMYNUCQ-BDJLRTHQSA-N 1 2 315.392 4.278 20 0 DIADLO COc1ccc(CNc2ccc([NH+](C)C)cc2)c(Cl)c1OC ZINC000106366682 194202637 /nfs/dbraw/zinc/20/26/37/194202637.db2.gz ROUBVXBRKWBGGA-UHFFFAOYSA-N 1 2 320.820 4.035 20 0 DIADLO FC(F)(F)c1ccc(SCc2cn3ccccc3[nH+]2)nc1 ZINC000060715467 184154927 /nfs/dbraw/zinc/15/49/27/184154927.db2.gz QANCVVMTYDYNOZ-UHFFFAOYSA-N 1 2 309.316 4.040 20 0 DIADLO Clc1ccc2oc(SCc3cn4ccccc4[nH+]3)nc2c1 ZINC000061419990 184170819 /nfs/dbraw/zinc/17/08/19/184170819.db2.gz LKPQCHFZHRYPSZ-UHFFFAOYSA-N 1 2 315.785 4.421 20 0 DIADLO CCn1cncc1C[NH+](Cc1cccs1)Cc1cccs1 ZINC000417683160 335045449 /nfs/dbraw/zinc/04/54/49/335045449.db2.gz MTXHWYXWQASAPM-UHFFFAOYSA-N 1 2 317.483 4.228 20 0 DIADLO C[C@@H]1CC[C@H](C)N1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000135815982 335047453 /nfs/dbraw/zinc/04/74/53/335047453.db2.gz VKMIKOUYWFERLK-OKILXGFUSA-N 1 2 311.385 4.279 20 0 DIADLO Brc1cscc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000289378324 532981662 /nfs/dbraw/zinc/98/16/62/532981662.db2.gz BORHVRALDHLRRN-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cscc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000289378324 532981664 /nfs/dbraw/zinc/98/16/64/532981664.db2.gz BORHVRALDHLRRN-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)n(C)n1 ZINC000417699797 335064076 /nfs/dbraw/zinc/06/40/76/335064076.db2.gz GFESFSJYDBYFHF-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO Cc1cc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)n(C)n1 ZINC000417699797 335064077 /nfs/dbraw/zinc/06/40/77/335064077.db2.gz GFESFSJYDBYFHF-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2Cl)[nH]1 ZINC000271441751 129914302 /nfs/dbraw/zinc/91/43/02/129914302.db2.gz FFKZOOKHNAFMCG-DTWKUNHWSA-N 1 2 313.232 4.086 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+]C2(c3cccc(Cl)c3)CC2)o1 ZINC000271814380 129964556 /nfs/dbraw/zinc/96/45/56/129964556.db2.gz RIYHUABXSNSMTJ-UHFFFAOYSA-N 1 2 304.821 4.404 20 0 DIADLO C[C@@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1cnn(C)c1 ZINC000272182794 130004704 /nfs/dbraw/zinc/00/47/04/130004704.db2.gz GDHFBONDOMRSCE-SNVBAGLBSA-N 1 2 310.228 4.067 20 0 DIADLO CC[C@H]([NH2+]Cc1csc([C@H](C)OC)n1)c1ccccc1F ZINC000272353612 130022527 /nfs/dbraw/zinc/02/25/27/130022527.db2.gz DMMYKLHRBKBNDX-NHYWBVRUSA-N 1 2 308.422 4.231 20 0 DIADLO CC[C@H]([NH2+]Cc1csc([C@@H](C)OC)n1)c1ccccc1F ZINC000272353610 130022777 /nfs/dbraw/zinc/02/27/77/130022777.db2.gz DMMYKLHRBKBNDX-ABAIWWIYSA-N 1 2 308.422 4.231 20 0 DIADLO CCn1ccnc1C[NH2+][C@@H](c1ccc(Cl)cc1F)C(C)C ZINC000272751029 130060135 /nfs/dbraw/zinc/06/01/35/130060135.db2.gz NMARRWJVRKIESA-MRXNPFEDSA-N 1 2 309.816 4.182 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(CC(C)C)no1)c1ccc(Cl)s1 ZINC000273221916 130099047 /nfs/dbraw/zinc/09/90/47/130099047.db2.gz AZJUTWSJHZCNOX-JTQLQIEISA-N 1 2 313.854 4.224 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)s1 ZINC000273280495 130102288 /nfs/dbraw/zinc/10/22/88/130102288.db2.gz IPOFXVUPARGOTM-SECBINFHSA-N 1 2 321.833 4.351 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1ccc(Cl)s1 ZINC000273480308 130126139 /nfs/dbraw/zinc/12/61/39/130126139.db2.gz HZGJBKHRGKTHES-WPRPVWTQSA-N 1 2 311.838 4.464 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nnc(C)s1)c1cccc(Cl)c1F ZINC000274029135 130199585 /nfs/dbraw/zinc/19/95/85/130199585.db2.gz GWDBQAYEIRAYLD-UFBFGSQYSA-N 1 2 313.829 4.441 20 0 DIADLO c1cc2c(s1)CCC[C@H]2[NH2+]Cc1ncc(-c2ccccc2)cn1 ZINC000274095085 130205257 /nfs/dbraw/zinc/20/52/57/130205257.db2.gz VDVMHKZYPGUFMG-QGZVFWFLSA-N 1 2 321.449 4.372 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(OC(C)(C)C)cc2)s1 ZINC000274280271 130223048 /nfs/dbraw/zinc/22/30/48/130223048.db2.gz JPUPIDQTGHHZKN-NEPJUHHUSA-N 1 2 319.474 4.436 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1F)c1nc(C(F)(F)F)cs1 ZINC000274337329 130227300 /nfs/dbraw/zinc/22/73/00/130227300.db2.gz AATKZMGESHXHJL-QMMMGPOBSA-N 1 2 304.312 4.152 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]Cc2ccc(Cl)cc2C)cs1 ZINC000274331160 130227320 /nfs/dbraw/zinc/22/73/20/130227320.db2.gz WHVRQZREZVPKIH-NSHDSACASA-N 1 2 310.850 4.102 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1nc(C(F)(F)F)cs1 ZINC000274671173 130253254 /nfs/dbraw/zinc/25/32/54/130253254.db2.gz YFHAZIUIWFCAMD-ZETCQYMHSA-N 1 2 322.302 4.291 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1nc(C(F)(F)F)cs1 ZINC000274671171 130253342 /nfs/dbraw/zinc/25/33/42/130253342.db2.gz YFHAZIUIWFCAMD-SSDOTTSWSA-N 1 2 322.302 4.291 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)cc1F)c1nc(C(F)(F)F)cs1 ZINC000274663924 130253674 /nfs/dbraw/zinc/25/36/74/130253674.db2.gz WUKRMXZQEFMENJ-ZETCQYMHSA-N 1 2 322.302 4.291 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)c1ccco1 ZINC000274957163 130277918 /nfs/dbraw/zinc/27/79/18/130277918.db2.gz WCIGNAYXLGQVDD-BBRMVZONSA-N 1 2 322.836 4.393 20 0 DIADLO C[C@@H]([NH2+]C/C(Cl)=C/Cl)c1nc2ccccc2n1C(F)F ZINC000275463184 130322826 /nfs/dbraw/zinc/32/28/26/130322826.db2.gz NDJYSSNRUQMRQJ-WSQKDGNHSA-N 1 2 320.170 4.401 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(C2CCCCC2)cc1)c1ncn(C)n1 ZINC000275802867 130389107 /nfs/dbraw/zinc/38/91/07/130389107.db2.gz YSTSHZGNNCTABF-HUUCEWRRSA-N 1 2 312.461 4.275 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1nc(C(C)C)no1 ZINC000283525745 131000159 /nfs/dbraw/zinc/00/01/59/131000159.db2.gz NJXPHWJJSIQCCU-NEPJUHHUSA-N 1 2 305.447 4.327 20 0 DIADLO CCCN(C(=O)C=Cc1c[nH]c[nH+]1)[C@@H](C)c1cc2ccccc2o1 ZINC000283526956 131000482 /nfs/dbraw/zinc/00/04/82/131000482.db2.gz RBUQUMIWBVRYEN-VFNNOXKTSA-N 1 2 323.396 4.169 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(OCC3CC3)c(F)c2)no1 ZINC000284023605 131042115 /nfs/dbraw/zinc/04/21/15/131042115.db2.gz IWSCGOIWCWNECI-CHWSQXEVSA-N 1 2 318.392 4.323 20 0 DIADLO Cc1noc(C(C)(C)[NH2+]Cc2ccc(-c3cccs3)cc2)n1 ZINC000284689151 131103742 /nfs/dbraw/zinc/10/37/42/131103742.db2.gz HTWSXOFHDVMQME-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](COc2ccccc2)c2ccccc2)no1 ZINC000284963138 131126874 /nfs/dbraw/zinc/12/68/74/131126874.db2.gz FMPGLABKYFEMDR-OXQOHEQNSA-N 1 2 322.408 4.454 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+]3CCC[C@H]3c3cc[nH]n3)n2)cc1 ZINC000285343992 131158706 /nfs/dbraw/zinc/15/87/06/131158706.db2.gz PJUOVBPYAHWLKL-KRWDZBQOSA-N 1 2 324.453 4.179 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+]3CCC[C@H]3c3cc[nH]n3)n2)cc1 ZINC000285343992 131158707 /nfs/dbraw/zinc/15/87/07/131158707.db2.gz PJUOVBPYAHWLKL-KRWDZBQOSA-N 1 2 324.453 4.179 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)[C@H](C)CC1CCCC1 ZINC000366641386 131165408 /nfs/dbraw/zinc/16/54/08/131165408.db2.gz BQZBTEJPHSCXDI-WBVHZDCISA-N 1 2 317.477 4.173 20 0 DIADLO Cc1cc([C@H](C)Nc2cccc3c2CN(c2cccc[nH+]2)C3)no1 ZINC000285407145 131165749 /nfs/dbraw/zinc/16/57/49/131165749.db2.gz XMEMMHBNOOKWPK-AWEZNQCLSA-N 1 2 320.396 4.071 20 0 DIADLO Cc1noc([C@H]2CCCC[N@@H+]2Cc2ccc(C(F)F)cc2)n1 ZINC000285820399 131204179 /nfs/dbraw/zinc/20/41/79/131204179.db2.gz WICOQDHSCAOKHE-CQSZACIVSA-N 1 2 307.344 4.043 20 0 DIADLO Cc1noc([C@H]2CCCC[N@H+]2Cc2ccc(C(F)F)cc2)n1 ZINC000285820399 131204180 /nfs/dbraw/zinc/20/41/80/131204180.db2.gz WICOQDHSCAOKHE-CQSZACIVSA-N 1 2 307.344 4.043 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+][C@H](C)c1c(F)cncc1F ZINC000285836031 131204918 /nfs/dbraw/zinc/20/49/18/131204918.db2.gz YCMXMUTWNIZAMZ-VXGBXAGGSA-N 1 2 306.356 4.089 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@H](C)c1cc(C)ccn1)c1ccco1 ZINC000286223070 131224703 /nfs/dbraw/zinc/22/47/03/131224703.db2.gz SJVFAXMIIKMACE-QRWLVFNGSA-N 1 2 322.408 4.432 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2csc(-c3ccccc3)n2)n1 ZINC000340237001 131244385 /nfs/dbraw/zinc/24/43/85/131244385.db2.gz MPNHCOVYLFHQNC-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2csc(-c3ccccc3)n2)n1 ZINC000340237001 131244386 /nfs/dbraw/zinc/24/43/86/131244386.db2.gz MPNHCOVYLFHQNC-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000286681172 131246712 /nfs/dbraw/zinc/24/67/12/131246712.db2.gz CHKWIVPDNPIAMW-GXFFZTMASA-N 1 2 303.431 4.153 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000286681172 131246714 /nfs/dbraw/zinc/24/67/14/131246714.db2.gz CHKWIVPDNPIAMW-GXFFZTMASA-N 1 2 303.431 4.153 20 0 DIADLO Cc1ccccc1[C@H](NC(=O)Nc1c(C)cc[nH+]c1C)C1CC1 ZINC000286977136 131258652 /nfs/dbraw/zinc/25/86/52/131258652.db2.gz BQIRJJLLJHWJCK-GOSISDBHSA-N 1 2 309.413 4.280 20 0 DIADLO Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)Nc2c(C)cc[nH+]c2C)C1 ZINC000286979866 131258756 /nfs/dbraw/zinc/25/87/56/131258756.db2.gz BTPQDVXIPUMPCS-RDJZCZTQSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CCC[C@@H]1c1ccccc1 ZINC000286982463 131258968 /nfs/dbraw/zinc/25/89/68/131258968.db2.gz BYWSRCIGIZJXKW-SJORKVTESA-N 1 2 309.413 4.156 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@@H](C)c2nccn2-c2ccccc2)o1 ZINC000287053915 131261259 /nfs/dbraw/zinc/26/12/59/131261259.db2.gz NBZXZBMXKMQPFG-CABCVRRESA-N 1 2 309.413 4.440 20 0 DIADLO Cc1ccccc1NC(=O)C[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000287052796 131261419 /nfs/dbraw/zinc/26/14/19/131261419.db2.gz UNAIWSKLTQMZGK-QGZVFWFLSA-N 1 2 314.454 4.078 20 0 DIADLO Cc1ccccc1NC(=O)C[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000287052796 131261420 /nfs/dbraw/zinc/26/14/20/131261420.db2.gz UNAIWSKLTQMZGK-QGZVFWFLSA-N 1 2 314.454 4.078 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2nccn2-c2ccccc2)oc1C ZINC000287188730 131268229 /nfs/dbraw/zinc/26/82/29/131268229.db2.gz VPUUWZIHWNSEJS-GJZGRUSLSA-N 1 2 309.413 4.494 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1C[C@@H](C)CC[C@@H]1c1ccccc1 ZINC000287214655 131268834 /nfs/dbraw/zinc/26/88/34/131268834.db2.gz UYSOTTKURFUFSE-KBXCAEBGSA-N 1 2 309.413 4.395 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)Cc1ccc(Cl)s1 ZINC000287407503 131279114 /nfs/dbraw/zinc/27/91/14/131279114.db2.gz DYIJWLUCANMANW-UHFFFAOYSA-N 1 2 309.822 4.077 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1C[C@H](c2ccccc2)C[C@H]1C ZINC000287462170 131281877 /nfs/dbraw/zinc/28/18/77/131281877.db2.gz ITNWLQIJJUBRFA-RHSMWYFYSA-N 1 2 309.413 4.108 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000287462173 131281958 /nfs/dbraw/zinc/28/19/58/131281958.db2.gz ITNWLQIJJUBRFA-YOEHRIQHSA-N 1 2 309.413 4.108 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@H]1c1ccc(F)cc1 ZINC000287519935 131284443 /nfs/dbraw/zinc/28/44/43/131284443.db2.gz MSODFJWKRNJSAJ-INIZCTEOSA-N 1 2 313.376 4.207 20 0 DIADLO Fc1ccc2cc[nH+]c(NC[C@@H]3CCN(c4ccccc4)C3)c2c1 ZINC000340257126 131285199 /nfs/dbraw/zinc/28/51/99/131285199.db2.gz DPYSDHCWWFTNDY-HNNXBMFYSA-N 1 2 321.399 4.312 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)Cc1cccc(Cl)c1 ZINC000287531792 131285217 /nfs/dbraw/zinc/28/52/17/131285217.db2.gz NMHIXBPQZDEBIE-UHFFFAOYSA-N 1 2 303.793 4.016 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)Cc1ccc(C(C)C)cc1 ZINC000287645066 131292059 /nfs/dbraw/zinc/29/20/59/131292059.db2.gz VWWROACLBDVXGI-UHFFFAOYSA-N 1 2 311.429 4.486 20 0 DIADLO Cc1cccc([C@@H]2CCCN2C(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000287645116 131292540 /nfs/dbraw/zinc/29/25/40/131292540.db2.gz VXUZARNNMDTZQL-KRWDZBQOSA-N 1 2 309.413 4.376 20 0 DIADLO CCN(C(=O)Nc1c(C)cc[nH+]c1C)[C@@H](C)Cc1ccsc1 ZINC000287702119 131295327 /nfs/dbraw/zinc/29/53/27/131295327.db2.gz ZPDGYQCJTBHRTQ-ZDUSSCGKSA-N 1 2 317.458 4.245 20 0 DIADLO COc1ccncc1C[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000287780006 131300114 /nfs/dbraw/zinc/30/01/14/131300114.db2.gz NJSMNXMUGGVZSV-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO C[C@H]1CN(c2[nH+]ccc3ccc(F)cc32)C[C@H](c2ccccc2)O1 ZINC000340261705 131300345 /nfs/dbraw/zinc/30/03/45/131300345.db2.gz VYAYHEPEPGUPBF-IFXJQAMLSA-N 1 2 322.383 4.340 20 0 DIADLO COC[C@H]([NH2+]Cc1csc(C2CC2)n1)c1cccc(Cl)c1 ZINC000288521689 131329323 /nfs/dbraw/zinc/32/93/23/131329323.db2.gz JLXJKYLFIUOYJS-HNNXBMFYSA-N 1 2 322.861 4.151 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000288572908 131330645 /nfs/dbraw/zinc/33/06/45/131330645.db2.gz NENXGTNZZLHSTC-MEDUHNTESA-N 1 2 302.443 4.052 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+](C)Cc1ccccc1N(C)C ZINC000288582452 131331987 /nfs/dbraw/zinc/33/19/87/131331987.db2.gz CKRHMOGTNFHSJC-CQSZACIVSA-N 1 2 315.461 4.231 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)Cc1ccccc1N(C)C ZINC000288582452 131331988 /nfs/dbraw/zinc/33/19/88/131331988.db2.gz CKRHMOGTNFHSJC-CQSZACIVSA-N 1 2 315.461 4.231 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)no1 ZINC000289348492 131377177 /nfs/dbraw/zinc/37/71/77/131377177.db2.gz KOPKCZSUEIJJCQ-UONOGXRCSA-N 1 2 307.397 4.457 20 0 DIADLO Cc1cc[nH+]cc1CCCNc1cc(NC(=O)C2CC2)ccc1C ZINC000289369890 131379801 /nfs/dbraw/zinc/37/98/01/131379801.db2.gz ZQIWFKYERCYXQV-UHFFFAOYSA-N 1 2 323.440 4.092 20 0 DIADLO c1csc([C@@H]2CSCC[N@H+]2Cc2ccc3occc3c2)n1 ZINC000289493418 131390953 /nfs/dbraw/zinc/39/09/53/131390953.db2.gz BSLXCQMCHXFBGK-AWEZNQCLSA-N 1 2 316.451 4.179 20 0 DIADLO c1csc([C@@H]2CSCC[N@@H+]2Cc2ccc3occc3c2)n1 ZINC000289493418 131390954 /nfs/dbraw/zinc/39/09/54/131390954.db2.gz BSLXCQMCHXFBGK-AWEZNQCLSA-N 1 2 316.451 4.179 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2Cl)cc1O ZINC000289510569 131392721 /nfs/dbraw/zinc/39/27/21/131392721.db2.gz AISATOJEIITLFM-SNVBAGLBSA-N 1 2 309.768 4.044 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ccccc3OC3CC3)CCC2)n1 ZINC000289586716 131398790 /nfs/dbraw/zinc/39/87/90/131398790.db2.gz HRJOAWNBBWEZER-UHFFFAOYSA-N 1 2 314.454 4.162 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)s1 ZINC000290103209 131453849 /nfs/dbraw/zinc/45/38/49/131453849.db2.gz IDFSFIJJQQJVCM-QMMMGPOBSA-N 1 2 316.257 4.258 20 0 DIADLO Cc1cc(Cl)c(NCc2[nH+]ccn2CC(F)(F)F)cc1C ZINC000294819830 131863611 /nfs/dbraw/zinc/86/36/11/131863611.db2.gz OSMYLZBKTBFZLP-UHFFFAOYSA-N 1 2 317.742 4.328 20 0 DIADLO Cn1c2ccc(NC(=O)Nc3ccc(F)cc3)cc2[nH+]c1C1CC1 ZINC000340564950 132005162 /nfs/dbraw/zinc/00/51/62/132005162.db2.gz DBNURRSSPASQLJ-UHFFFAOYSA-N 1 2 324.359 4.234 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(F)cnc1Cl)c1cc(F)ccc1F ZINC000297309462 132008519 /nfs/dbraw/zinc/00/85/19/132008519.db2.gz MUIIJKKQIANTNE-AWEZNQCLSA-N 1 2 314.738 4.393 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000297552320 132022799 /nfs/dbraw/zinc/02/27/99/132022799.db2.gz ZSPYVMLHLWDBKP-QZTJIDSGSA-N 1 2 323.440 4.498 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CNc1ccccc1C[S@](C)=O ZINC000297573477 132023548 /nfs/dbraw/zinc/02/35/48/132023548.db2.gz GUVGRQOYIWJLSX-QFIPXVFZSA-N 1 2 316.470 4.004 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@H](c1ccccc1)c1cccc(F)c1 ZINC000297725671 132030556 /nfs/dbraw/zinc/03/05/56/132030556.db2.gz NKIIVIHKCZFARG-HNAYVOBHSA-N 1 2 323.415 4.482 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](c1ccccc1)c1cccc(F)c1 ZINC000297725665 132030843 /nfs/dbraw/zinc/03/08/43/132030843.db2.gz NKIIVIHKCZFARG-BEFAXECRSA-N 1 2 323.415 4.482 20 0 DIADLO Cc1cccc(C([NH2+][C@H]2CCn3ccnc32)c2cccc(C)c2)c1 ZINC000297719300 132031160 /nfs/dbraw/zinc/03/11/60/132031160.db2.gz NDEPWIMASHOALM-IBGZPJMESA-N 1 2 317.436 4.324 20 0 DIADLO Cc1cccc(C([NH2+][C@@H]2CCn3ccnc32)c2cccc(C)c2)c1 ZINC000297719301 132031174 /nfs/dbraw/zinc/03/11/74/132031174.db2.gz NDEPWIMASHOALM-LJQANCHMSA-N 1 2 317.436 4.324 20 0 DIADLO COCc1cc(C[N@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)no1 ZINC000297970426 132042859 /nfs/dbraw/zinc/04/28/59/132042859.db2.gz XFBUXRDTSYZGGW-LBPRGKRZSA-N 1 2 320.820 4.200 20 0 DIADLO COCc1cc(C[N@@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)no1 ZINC000297970426 132042861 /nfs/dbraw/zinc/04/28/61/132042861.db2.gz XFBUXRDTSYZGGW-LBPRGKRZSA-N 1 2 320.820 4.200 20 0 DIADLO Cc1cc(F)ccc1C1CC[NH+](Cc2nccn2C(F)F)CC1 ZINC000298248219 132052151 /nfs/dbraw/zinc/05/21/51/132052151.db2.gz KBTPXKQVJGWZHI-UHFFFAOYSA-N 1 2 323.362 4.105 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2c(Cl)cccc2Cl)C2CC2)ncn1 ZINC000298292569 132054466 /nfs/dbraw/zinc/05/44/66/132054466.db2.gz PBDNEIDFKKQHJQ-INIZCTEOSA-N 1 2 322.239 4.333 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCC[C@H]3c3ccsc3)no2)cs1 ZINC000298470862 132064308 /nfs/dbraw/zinc/06/43/08/132064308.db2.gz CCCIMNCWUMBLJD-ZDUSSCGKSA-N 1 2 317.439 4.197 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCC[C@H]3c3ccsc3)no2)cs1 ZINC000298470862 132064309 /nfs/dbraw/zinc/06/43/09/132064309.db2.gz CCCIMNCWUMBLJD-ZDUSSCGKSA-N 1 2 317.439 4.197 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cn3cc(Cl)cc(Cl)c3n2)o1 ZINC000340617441 132090450 /nfs/dbraw/zinc/09/04/50/132090450.db2.gz URQDRHJXEAWYKT-UHFFFAOYSA-N 1 2 324.211 4.175 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cn3cc(Cl)cc(Cl)c3n2)o1 ZINC000340617441 132090452 /nfs/dbraw/zinc/09/04/52/132090452.db2.gz URQDRHJXEAWYKT-UHFFFAOYSA-N 1 2 324.211 4.175 20 0 DIADLO Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000164141576 132130550 /nfs/dbraw/zinc/13/05/50/132130550.db2.gz WQZLFQRVJZHWEY-HUUCEWRRSA-N 1 2 323.421 4.189 20 0 DIADLO COc1cccc(CNc2ccc(C)[nH+]c2C)c1OC(C)C ZINC000353216032 132140839 /nfs/dbraw/zinc/14/08/39/132140839.db2.gz GFXDWSDJKOVQES-UHFFFAOYSA-N 1 2 300.402 4.106 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2ncc(C3CC3)o2)o1 ZINC000340691035 132157544 /nfs/dbraw/zinc/15/75/44/132157544.db2.gz NXORZOMOCMXREB-IUODEOHRSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2ncc(C3CC3)o2)o1 ZINC000340691035 132157546 /nfs/dbraw/zinc/15/75/46/132157546.db2.gz NXORZOMOCMXREB-IUODEOHRSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2ncc(C3CC3)o2)o1 ZINC000340691033 132158064 /nfs/dbraw/zinc/15/80/64/132158064.db2.gz NXORZOMOCMXREB-DOMZBBRYSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2ncc(C3CC3)o2)o1 ZINC000340691033 132158065 /nfs/dbraw/zinc/15/80/65/132158065.db2.gz NXORZOMOCMXREB-DOMZBBRYSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2ncc(C3CC3)o2)o1 ZINC000340691040 132158339 /nfs/dbraw/zinc/15/83/39/132158339.db2.gz NXORZOMOCMXREB-WFASDCNBSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2ncc(C3CC3)o2)o1 ZINC000340691040 132158341 /nfs/dbraw/zinc/15/83/41/132158341.db2.gz NXORZOMOCMXREB-WFASDCNBSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1nc(C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)cs1 ZINC000340700374 132163894 /nfs/dbraw/zinc/16/38/94/132163894.db2.gz HIOMKMQBFQOJFC-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO Cc1nc(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)cs1 ZINC000340700374 132163896 /nfs/dbraw/zinc/16/38/96/132163896.db2.gz HIOMKMQBFQOJFC-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc(Oc3cccnc3)cc2)nc[nH+]1 ZINC000340775564 132186883 /nfs/dbraw/zinc/18/68/83/132186883.db2.gz IXPRNAXTWMBDRW-CQSZACIVSA-N 1 2 306.369 4.145 20 0 DIADLO CCn1c[nH+]cc1CN(C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000417705541 335065293 /nfs/dbraw/zinc/06/52/93/335065293.db2.gz MCYKUDVNRKLSHC-NSHDSACASA-N 1 2 312.244 4.403 20 0 DIADLO CCn1c[nH+]cc1CN(Cc1ccco1)Cc1cccc(C)c1 ZINC000417719177 335069712 /nfs/dbraw/zinc/06/97/12/335069712.db2.gz WMMVHPCCFHKSKU-UHFFFAOYSA-N 1 2 309.413 4.007 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCC(OC2CCCC2)CC1 ZINC000150992548 196614028 /nfs/dbraw/zinc/61/40/28/196614028.db2.gz DSFLVFZRZXGNSN-UHFFFAOYSA-N 1 2 310.441 4.471 20 0 DIADLO CC(C)c1nc2[nH]ccc2c(N[C@@H](C)c2cnn(C(C)C)c2)[nH+]1 ZINC000631116495 435401192 /nfs/dbraw/zinc/40/11/92/435401192.db2.gz BLHPFNKZXIIWHK-LBPRGKRZSA-N 1 2 312.421 4.032 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1c(F)ccc(O)c1F ZINC000519593301 435691269 /nfs/dbraw/zinc/69/12/69/435691269.db2.gz QBRMSIMPVBZSPM-UHFFFAOYSA-N 1 2 317.339 4.042 20 0 DIADLO Cc1cc(C(=O)Nc2c3ccccc3[nH+]c(C)c2C(C)C)ccn1 ZINC000448395398 332807425 /nfs/dbraw/zinc/80/74/25/332807425.db2.gz MFCSQBWLIOUFKL-UHFFFAOYSA-N 1 2 319.408 4.044 20 0 DIADLO CC(C)n1ccc(C[NH2+]C2c3ccccc3-c3ccccc32)n1 ZINC000570837845 332826993 /nfs/dbraw/zinc/82/69/93/332826993.db2.gz TUKBTMMTQLWKSJ-UHFFFAOYSA-N 1 2 303.409 4.324 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1coc(-c2cccs2)n1 ZINC000171115322 332890278 /nfs/dbraw/zinc/89/02/78/332890278.db2.gz XODIJDBKJDELJI-GFCCVEGCSA-N 1 2 314.410 4.263 20 0 DIADLO CC[C@H](C)Oc1ccc(C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000175726878 332905113 /nfs/dbraw/zinc/90/51/13/332905113.db2.gz DCNGOUTUIOBIHC-AWEZNQCLSA-N 1 2 312.413 4.436 20 0 DIADLO Cn1ccc(C[NH2+][C@H](c2cc3ccccc3o2)c2ccccc2)n1 ZINC000370773022 331524335 /nfs/dbraw/zinc/52/43/35/331524335.db2.gz LYHRKDUDGLSEAQ-FQEVSTJZSA-N 1 2 317.392 4.046 20 0 DIADLO O=C(c1ccccc1)C1CC[NH+](Cc2cc(F)cc(F)c2)CC1 ZINC000179877939 331547942 /nfs/dbraw/zinc/54/79/42/331547942.db2.gz FFGCNECNWOFBQX-UHFFFAOYSA-N 1 2 315.363 4.060 20 0 DIADLO Cc1nc([C@H]([NH2+]CC2CCCCCC2)c2ccccc2F)no1 ZINC000530773905 331625245 /nfs/dbraw/zinc/62/52/45/331625245.db2.gz CSDYQUUIZUWENJ-QGZVFWFLSA-N 1 2 317.408 4.167 20 0 DIADLO CC1(C)CC[NH+](CC(=O)Nc2cccc(Cl)c2Cl)CC1 ZINC000530867661 331630917 /nfs/dbraw/zinc/63/09/17/331630917.db2.gz WATGFHXXYYPSIU-UHFFFAOYSA-N 1 2 315.244 4.054 20 0 DIADLO CCC[C@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1cccnc1 ZINC000186281034 332920893 /nfs/dbraw/zinc/92/08/93/332920893.db2.gz UPJYSDQANUIJGZ-SFHVURJKSA-N 1 2 310.445 4.420 20 0 DIADLO c1nc(C[NH2+]C(c2ccccc2)c2ccccc2)oc1C1CC1 ZINC000536301576 331695536 /nfs/dbraw/zinc/69/55/36/331695536.db2.gz DSUNXKUZDXFPSJ-UHFFFAOYSA-N 1 2 304.393 4.431 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2ccc(Cl)cc2)n1)c1cn[nH]c1 ZINC000533801722 331698613 /nfs/dbraw/zinc/69/86/13/331698613.db2.gz IVODTEUPBFCHIB-JTQLQIEISA-N 1 2 318.833 4.037 20 0 DIADLO FC(F)(CN[C@H](c1[nH]cc[nH+]1)C1CCCCC1)c1ccccc1 ZINC000556890929 331749142 /nfs/dbraw/zinc/74/91/42/331749142.db2.gz UJAKDVTVNYHLDR-INIZCTEOSA-N 1 2 319.399 4.413 20 0 DIADLO CC(C)CCC(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000557031981 331764159 /nfs/dbraw/zinc/76/41/59/331764159.db2.gz SLNGTNTYSPKWET-UHFFFAOYSA-N 1 2 311.429 4.261 20 0 DIADLO Clc1cccc2c(N3CCC[C@@H]3[C@@H]3CCCO3)cc[nH+]c12 ZINC000557672114 331807658 /nfs/dbraw/zinc/80/76/58/331807658.db2.gz FREFFUOLYGHDKM-CVEARBPZSA-N 1 2 302.805 4.036 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1nc(-c2ccccc2)cs1 ZINC000584136183 331838774 /nfs/dbraw/zinc/83/87/74/331838774.db2.gz OPMHFDDILBEGQZ-ORAYPTAESA-N 1 2 322.433 4.422 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc([C@@H]2CCCC2(C)C)n1 ZINC000558375904 331900454 /nfs/dbraw/zinc/90/04/54/331900454.db2.gz LNVIYSHADSNGOL-ZDUSSCGKSA-N 1 2 324.428 4.324 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000558405111 331903263 /nfs/dbraw/zinc/90/32/63/331903263.db2.gz PCDHWCDYHODMFW-NSHDSACASA-N 1 2 322.449 4.439 20 0 DIADLO Cc1cc[nH+]c(NC[C@]2(C)OCCc3sccc32)c1Cl ZINC000558599753 331927026 /nfs/dbraw/zinc/92/70/26/331927026.db2.gz YNJSUZDNJCZOSY-HNNXBMFYSA-N 1 2 308.834 4.005 20 0 DIADLO CC1(C)CC[C@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000558682612 331934740 /nfs/dbraw/zinc/93/47/40/331934740.db2.gz CDISIBOWARUPMW-AWEZNQCLSA-N 1 2 310.397 4.182 20 0 DIADLO CCSCC[C@@H](C)Nc1[nH+]ccc(C)c1Br ZINC000233833107 331977214 /nfs/dbraw/zinc/97/72/14/331977214.db2.gz GRBLGLNTNQAZRZ-SNVBAGLBSA-N 1 2 303.269 4.096 20 0 DIADLO CC(C)[C@@H](CC(=O)Nc1ccn2cc[nH+]c2c1)c1ccccc1 ZINC000559249342 332004259 /nfs/dbraw/zinc/00/42/59/332004259.db2.gz OKYWDYOTALBWQU-QGZVFWFLSA-N 1 2 307.397 4.103 20 0 DIADLO Cc1cnccc1C[N@@H+](C)[C@@H](C)c1ccccc1Br ZINC000518306752 332011156 /nfs/dbraw/zinc/01/11/56/332011156.db2.gz ADWPYFZYJDQVFC-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cnccc1C[N@H+](C)[C@@H](C)c1ccccc1Br ZINC000518306752 332011158 /nfs/dbraw/zinc/01/11/58/332011158.db2.gz ADWPYFZYJDQVFC-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1nnsc1C[N@@H+](C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000518381147 332022324 /nfs/dbraw/zinc/02/23/24/332022324.db2.gz INBCTHCNDFRVJP-JTQLQIEISA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nnsc1C[N@H+](C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000518381147 332022326 /nfs/dbraw/zinc/02/23/26/332022326.db2.gz INBCTHCNDFRVJP-JTQLQIEISA-N 1 2 315.364 4.058 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+]2CC=C(C(C)(C)C)CC2)cs1 ZINC000409446796 332032066 /nfs/dbraw/zinc/03/20/66/332032066.db2.gz SRFMOFBKKLBICB-ZDUSSCGKSA-N 1 2 308.491 4.419 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+]2CC=C(C(C)(C)C)CC2)cs1 ZINC000409446796 332032068 /nfs/dbraw/zinc/03/20/68/332032068.db2.gz SRFMOFBKKLBICB-ZDUSSCGKSA-N 1 2 308.491 4.419 20 0 DIADLO COc1c(C)c[nH+]c(CN(Cc2cccs2)C(C)C)c1C ZINC000409446740 332032240 /nfs/dbraw/zinc/03/22/40/332032240.db2.gz FZHIGEAAYBVMBP-UHFFFAOYSA-N 1 2 304.459 4.179 20 0 DIADLO Cc1ccccc1[C@@]1(F)CCN(c2cc[nH+]c3ccncc32)C1 ZINC000409664344 332044768 /nfs/dbraw/zinc/04/47/68/332044768.db2.gz WSOPYWXSIOTFKP-LJQANCHMSA-N 1 2 307.372 4.013 20 0 DIADLO Cc1cc(N[C@@H]2CCCC23CCOCC3)c2cccc(F)c2[nH+]1 ZINC000409666258 332044875 /nfs/dbraw/zinc/04/48/75/332044875.db2.gz OEGDNAZCJFUXGC-QGZVFWFLSA-N 1 2 314.404 4.444 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3cccc(F)c3)cc2[nH+]1 ZINC000409723947 332051270 /nfs/dbraw/zinc/05/12/70/332051270.db2.gz YWVTUKJGUROEMM-UHFFFAOYSA-N 1 2 311.360 4.297 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1ccn(C(C)C)n1 ZINC000569396372 332075357 /nfs/dbraw/zinc/07/53/57/332075357.db2.gz RDZLTHSGDDUFRS-KRWDZBQOSA-N 1 2 301.434 4.056 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1ccn(C(C)C)n1 ZINC000569396372 332075358 /nfs/dbraw/zinc/07/53/58/332075358.db2.gz RDZLTHSGDDUFRS-KRWDZBQOSA-N 1 2 301.434 4.056 20 0 DIADLO CC[C@H]([NH2+]Cc1cnc(-c2c(F)cccc2F)s1)C(F)F ZINC000449363602 332075602 /nfs/dbraw/zinc/07/56/02/332075602.db2.gz PULLIWLGQFRQEC-NSHDSACASA-N 1 2 318.339 4.222 20 0 DIADLO COc1cc[nH+]c(CN(C)Cc2c(Cl)cccc2Cl)c1 ZINC000518582209 332085120 /nfs/dbraw/zinc/08/51/20/332085120.db2.gz JDMIJLBIEOLYAS-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1c([C@@H](C)[NH2+]CC(F)(F)c2ccccc2)cnn1C(C)(C)C ZINC000569512142 332116780 /nfs/dbraw/zinc/11/67/80/332116780.db2.gz BOLXXJJDWKXLKI-CYBMUJFWSA-N 1 2 321.415 4.389 20 0 DIADLO COc1ccccc1-c1ccc(C[N@H+](C)Cc2cc(C)on2)cc1 ZINC000092254438 332123144 /nfs/dbraw/zinc/12/31/44/332123144.db2.gz IPEOINGPZJMZCH-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO COc1ccccc1-c1ccc(C[N@@H+](C)Cc2cc(C)on2)cc1 ZINC000092254438 332123145 /nfs/dbraw/zinc/12/31/45/332123145.db2.gz IPEOINGPZJMZCH-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO C[N@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)Cc1cnccn1 ZINC000092591744 332128764 /nfs/dbraw/zinc/12/87/64/332128764.db2.gz LIIHSGPXVYBFLI-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)Cc1cnccn1 ZINC000092591744 332128765 /nfs/dbraw/zinc/12/87/65/332128765.db2.gz LIIHSGPXVYBFLI-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO COc1c(C)c[nH+]c(CSCCCC2CCOCC2)c1C ZINC000569554913 332137240 /nfs/dbraw/zinc/13/72/40/332137240.db2.gz VVKAYUVIHMIROL-UHFFFAOYSA-N 1 2 309.475 4.147 20 0 DIADLO CCCc1csc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)n1 ZINC000426421454 332149740 /nfs/dbraw/zinc/14/97/40/332149740.db2.gz QBFKOUWPODHROJ-MRXNPFEDSA-N 1 2 303.475 4.161 20 0 DIADLO CCCc1csc(C[N@H+]2CCCC[C@@H]2c2cccn2C)n1 ZINC000426421454 332149741 /nfs/dbraw/zinc/14/97/41/332149741.db2.gz QBFKOUWPODHROJ-MRXNPFEDSA-N 1 2 303.475 4.161 20 0 DIADLO Cc1c[nH+]cc(CCc2nc(-c3ccc4sccc4c3)no2)c1 ZINC000426426050 332151532 /nfs/dbraw/zinc/15/15/32/332151532.db2.gz FFIAPHZYFRYGEK-UHFFFAOYSA-N 1 2 321.405 4.440 20 0 DIADLO CCOc1ccccc1C[N@H+](C)[C@H](C)c1nc2ccccc2o1 ZINC000180979877 332171283 /nfs/dbraw/zinc/17/12/83/332171283.db2.gz JSLVJNQSKBVOCE-CQSZACIVSA-N 1 2 310.397 4.420 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)[C@H](C)c1nc2ccccc2o1 ZINC000180979877 332171284 /nfs/dbraw/zinc/17/12/84/332171284.db2.gz JSLVJNQSKBVOCE-CQSZACIVSA-N 1 2 310.397 4.420 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)ccc1Cl ZINC000180984560 332172663 /nfs/dbraw/zinc/17/26/63/332172663.db2.gz FLFKVAXUXHMSPQ-LLVKDONJSA-N 1 2 307.825 4.180 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H](C)c2cccc(C)c2)[nH+]1 ZINC000427189699 332182773 /nfs/dbraw/zinc/18/27/73/332182773.db2.gz PHKFMRQMRVZLKP-HNNXBMFYSA-N 1 2 319.408 4.436 20 0 DIADLO CC1(C)CN(C(=O)c2ccccc2Oc2cc[nH+]cc2)[C@H]1C1CC1 ZINC000427244934 332187655 /nfs/dbraw/zinc/18/76/55/332187655.db2.gz XONRRXFBFFKNFP-SFHVURJKSA-N 1 2 322.408 4.135 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(-c2ccco2)cc1F)c1ccn(C)n1 ZINC000448024321 332190259 /nfs/dbraw/zinc/19/02/59/332190259.db2.gz XQTKYSLCIIHZOO-MRXNPFEDSA-N 1 2 313.376 4.060 20 0 DIADLO CC(C)([NH2+]Cc1ccc(Cl)cn1)c1nc2ccccc2s1 ZINC000528604680 332199908 /nfs/dbraw/zinc/19/99/08/332199908.db2.gz UDKHAECHSQAAHJ-UHFFFAOYSA-N 1 2 317.845 4.370 20 0 DIADLO CC[C@@H]1C[NH+](Cc2ncc(-c3ccccc3C)o2)C[C@@H](CC)O1 ZINC000584285055 332212001 /nfs/dbraw/zinc/21/20/01/332212001.db2.gz SEWWABBOKFYFCI-HZPDHXFCSA-N 1 2 314.429 4.039 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1Cl)c1csnn1 ZINC000398318693 332230989 /nfs/dbraw/zinc/23/09/89/332230989.db2.gz GYHRQTWXKXNULG-HTQZYQBOSA-N 1 2 302.230 4.257 20 0 DIADLO Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(C)[nH+]c2C)s1 ZINC000152421116 335095953 /nfs/dbraw/zinc/09/59/53/335095953.db2.gz FMDBBWDKNGVNJC-OAHLLOKOSA-N 1 2 315.442 4.437 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccccc1C(F)(F)F ZINC000367518892 332233851 /nfs/dbraw/zinc/23/38/51/332233851.db2.gz KUCANGCIKXDNEW-HZMBPMFUSA-N 1 2 309.335 4.157 20 0 DIADLO CCc1cc(OCCCOCC(F)(F)F)c2ccccc2[nH+]1 ZINC000536419622 332241348 /nfs/dbraw/zinc/24/13/48/332241348.db2.gz MJSXOBHVUAKGJH-UHFFFAOYSA-N 1 2 313.319 4.145 20 0 DIADLO CCC(CC)[C@H](C)C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000536425344 332242563 /nfs/dbraw/zinc/24/25/63/332242563.db2.gz ZPAOCBXHKUEVES-ZDUSSCGKSA-N 1 2 323.506 4.140 20 0 DIADLO COc1cc(Br)cc(NCc2ccc(C)[nH+]c2C)c1 ZINC000358215563 332243268 /nfs/dbraw/zinc/24/32/68/332243268.db2.gz AQIBWUZFRAHKEX-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@H+](Cc2cnc(Cl)s2)CC12CCC2 ZINC000374624073 332244573 /nfs/dbraw/zinc/24/45/73/332244573.db2.gz XYBQJRAFGJGJAZ-SNVBAGLBSA-N 1 2 324.799 4.351 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@@H+](Cc2cnc(Cl)s2)CC12CCC2 ZINC000374624073 332244575 /nfs/dbraw/zinc/24/45/75/332244575.db2.gz XYBQJRAFGJGJAZ-SNVBAGLBSA-N 1 2 324.799 4.351 20 0 DIADLO Cn1c2ccccc2[nH+]c1N1CC=C(c2ccc(F)cc2)CC1 ZINC000536500374 332253437 /nfs/dbraw/zinc/25/34/37/332253437.db2.gz NAOBDOJVFJHQMF-UHFFFAOYSA-N 1 2 307.372 4.006 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)[C@H]1CC12CCCC2 ZINC000531092519 332256481 /nfs/dbraw/zinc/25/64/81/332256481.db2.gz QEIRNOKEBJGODU-QGZVFWFLSA-N 1 2 308.381 4.393 20 0 DIADLO CC(F)(F)C[NH2+][C@@H]1CCCc2ccc(Br)cc21 ZINC000559886002 332289284 /nfs/dbraw/zinc/28/92/84/332289284.db2.gz JNKHOQBSXPRRMZ-GFCCVEGCSA-N 1 2 304.178 4.071 20 0 DIADLO COc1ccc([C@@H](Cc2ccccc2)[NH2+]CC(C)(F)F)cc1 ZINC000559886526 332289375 /nfs/dbraw/zinc/28/93/75/332289375.db2.gz LKBOJNBZFLWDIF-QGZVFWFLSA-N 1 2 305.368 4.224 20 0 DIADLO CCCOc1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000559916539 332292788 /nfs/dbraw/zinc/29/27/88/332292788.db2.gz HFVDSYPXIYSHCO-ZDUSSCGKSA-N 1 2 317.433 4.007 20 0 DIADLO Cc1nn(-c2ccccc2)cc1N[C@H](C)c1cn2ccccc2[nH+]1 ZINC000559910028 332292941 /nfs/dbraw/zinc/29/29/41/332292941.db2.gz LFUPZQJEKHMBIA-CQSZACIVSA-N 1 2 317.396 4.002 20 0 DIADLO Clc1ccc2[nH+]c(CSCCCC3CCOCC3)cn2c1 ZINC000560025978 332303232 /nfs/dbraw/zinc/30/32/32/332303232.db2.gz QDWRQVVSPAWRQV-UHFFFAOYSA-N 1 2 324.877 4.428 20 0 DIADLO C[C@@H]1OCC[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)[C@H]1C ZINC000560260968 332325140 /nfs/dbraw/zinc/32/51/40/332325140.db2.gz FNSBSDKFLIQEIL-RYUDHWBXSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@@H]1OCC[N@@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)[C@H]1C ZINC000560260968 332325141 /nfs/dbraw/zinc/32/51/41/332325141.db2.gz FNSBSDKFLIQEIL-RYUDHWBXSA-N 1 2 322.861 4.073 20 0 DIADLO Cc1ccc[nH+]c1CCc1noc([C@H]2C[C@@H]2C2CCCCC2)n1 ZINC000560354402 332334021 /nfs/dbraw/zinc/33/40/21/332334021.db2.gz RMCXAENOPJIETN-CVEARBPZSA-N 1 2 311.429 4.242 20 0 DIADLO C[C@H]([NH2+][C@@H](Cc1ccccc1)c1ccccc1F)c1ncc[nH]1 ZINC000560530061 332352135 /nfs/dbraw/zinc/35/21/35/332352135.db2.gz YRLBNYZOHGUHIC-KSSFIOAISA-N 1 2 309.388 4.183 20 0 DIADLO Cc1oc2ccc(NC(=O)NCc3c[nH+]c(C)cc3C)cc2c1C ZINC000583365096 332357013 /nfs/dbraw/zinc/35/70/13/332357013.db2.gz YRCQEWUXFPOBTP-UHFFFAOYSA-N 1 2 323.396 4.383 20 0 DIADLO CC(C)[C@H]1CC[C@@H]1Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000560553249 332358924 /nfs/dbraw/zinc/35/89/24/332358924.db2.gz PNPHMTQAXATHFH-APWZRJJASA-N 1 2 307.441 4.448 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](Cc2ccccc2)C2CC2)n1 ZINC000119214286 332367099 /nfs/dbraw/zinc/36/70/99/332367099.db2.gz BRTHRBMNEMYAOW-CYBMUJFWSA-N 1 2 317.458 4.048 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](Cc2ccccc2)C2CC2)n1 ZINC000119214286 332367100 /nfs/dbraw/zinc/36/71/00/332367100.db2.gz BRTHRBMNEMYAOW-CYBMUJFWSA-N 1 2 317.458 4.048 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)CSCc1ccccc1 ZINC000425586848 335107367 /nfs/dbraw/zinc/10/73/67/335107367.db2.gz LPIOWLDSMNBLLD-CQSZACIVSA-N 1 2 314.454 4.206 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccc(OCCC(C)C)cc1 ZINC000425586969 335107426 /nfs/dbraw/zinc/10/74/26/335107426.db2.gz MMPOFHNVYRYVFZ-UHFFFAOYSA-N 1 2 312.413 4.376 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)Oc1ccc(Cl)c(C)c1 ZINC000425588398 335107653 /nfs/dbraw/zinc/10/76/53/335107653.db2.gz PWRYEKPTNRYHHD-ZDUSSCGKSA-N 1 2 318.804 4.066 20 0 DIADLO CC[C@H](Sc1ccccc1)C(=O)Nc1c(C)cc[nH+]c1C ZINC000425590686 335108551 /nfs/dbraw/zinc/10/85/51/335108551.db2.gz XDBCGJXUGSZOMP-HNNXBMFYSA-N 1 2 300.427 4.208 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccc(SC(C)C)cc1 ZINC000425590676 335108576 /nfs/dbraw/zinc/10/85/76/335108576.db2.gz XCJFDEKTFNMZFH-UHFFFAOYSA-N 1 2 300.427 4.451 20 0 DIADLO Cc1ccc2c(CCC(=O)Nc3c(C)cc[nH+]c3C)c[nH]c2c1 ZINC000425590693 335108642 /nfs/dbraw/zinc/10/86/42/335108642.db2.gz XDLSZULOLVACRE-UHFFFAOYSA-N 1 2 307.397 4.059 20 0 DIADLO CCSCc1ccc(NCc2cc(OC)cc(C)[nH+]2)cc1 ZINC000449601241 332440000 /nfs/dbraw/zinc/44/00/00/332440000.db2.gz MGVNJGLLFJVOSS-UHFFFAOYSA-N 1 2 302.443 4.264 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)Sc1ccc(Cl)cc1 ZINC000425583441 335106631 /nfs/dbraw/zinc/10/66/31/335106631.db2.gz AAFSPMHGZAHQEZ-GFCCVEGCSA-N 1 2 320.845 4.471 20 0 DIADLO Cc1ccc(S[C@H](C)C(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000425583726 335106661 /nfs/dbraw/zinc/10/66/61/335106661.db2.gz BMRIZUIPTUSORK-CQSZACIVSA-N 1 2 300.427 4.126 20 0 DIADLO Cc1cc(C)c(C)c(OCCC(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000425584739 335106865 /nfs/dbraw/zinc/10/68/65/335106865.db2.gz FPFZVXWFJOFESS-UHFFFAOYSA-N 1 2 312.413 4.031 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)cn1 ZINC000427833511 332534075 /nfs/dbraw/zinc/53/40/75/332534075.db2.gz WDOFSNHCFIHPNJ-KGLIPLIRSA-N 1 2 324.453 4.320 20 0 DIADLO CC(C)CCSc1[nH+]cnc2c1cnn2-c1ccc(F)cc1 ZINC000102080036 334376036 /nfs/dbraw/zinc/37/60/36/334376036.db2.gz XGCJAEIOJISAMZ-UHFFFAOYSA-N 1 2 316.405 4.093 20 0 DIADLO CCn1c(CNc2ccc3c(c2)CCC[NH2+]3)nc2ccccc21 ZINC000562744344 332622925 /nfs/dbraw/zinc/62/29/25/332622925.db2.gz WSLCKVPPMBFDEC-UHFFFAOYSA-N 1 2 306.413 4.026 20 0 DIADLO Cc1ccc(OC(F)F)c([C@H](C)[NH2+][C@H](C)c2cscn2)c1 ZINC000565247623 332715082 /nfs/dbraw/zinc/71/50/82/332715082.db2.gz UVWHQNYRQFBRHV-WDEREUQCSA-N 1 2 312.385 4.465 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(Cl)c3ccccc23)o1 ZINC000570437743 332755063 /nfs/dbraw/zinc/75/50/63/332755063.db2.gz ZZJXBIDRGDNELN-SNVBAGLBSA-N 1 2 301.777 4.035 20 0 DIADLO Cc1nc([C@H]([NH2+]C2CC3(CCC3)C2)c2ccc(Cl)cc2)no1 ZINC000580700379 332949406 /nfs/dbraw/zinc/94/94/06/332949406.db2.gz WCJMFKYMIOJIGE-OAHLLOKOSA-N 1 2 317.820 4.043 20 0 DIADLO O=C(CCc1ccoc1)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000177258472 332979049 /nfs/dbraw/zinc/97/90/49/332979049.db2.gz LDAPCYVSDHQLKV-UHFFFAOYSA-N 1 2 308.337 4.038 20 0 DIADLO C[N@H+](Cc1ccc(Oc2ccccc2)c(F)c1)Cc1cnccn1 ZINC000178465935 333013042 /nfs/dbraw/zinc/01/30/42/333013042.db2.gz IRLJGQPIVWSHEO-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[N@@H+](Cc1ccc(Oc2ccccc2)c(F)c1)Cc1cnccn1 ZINC000178465935 333013044 /nfs/dbraw/zinc/01/30/44/333013044.db2.gz IRLJGQPIVWSHEO-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1ccc([C@@H](Nc2cccc(Cl)c2)c2[nH]cc[nH+]2)cc1 ZINC000188341381 333043709 /nfs/dbraw/zinc/04/37/09/333043709.db2.gz FQLBGPMFKFPQGI-OAHLLOKOSA-N 1 2 301.752 4.404 20 0 DIADLO CC[C@H](C)Oc1cccc(NCc2cc(OC)cc(C)[nH+]2)c1 ZINC000378925528 333064422 /nfs/dbraw/zinc/06/44/22/333064422.db2.gz HDYPCTOXRUFESH-AWEZNQCLSA-N 1 2 300.402 4.188 20 0 DIADLO Cc1cc[nH+]c(NCC2(c3ccccc3)CCOCC2)c1Cl ZINC000460411055 333080908 /nfs/dbraw/zinc/08/09/08/333080908.db2.gz HZDRHLDWTRSYEY-UHFFFAOYSA-N 1 2 316.832 4.204 20 0 DIADLO Cc1[nH]c2ccc(COc3ccccc3Br)cc2[nH+]1 ZINC000460443034 333088087 /nfs/dbraw/zinc/08/80/87/333088087.db2.gz JAVNRVSWWLZSHL-UHFFFAOYSA-N 1 2 317.186 4.213 20 0 DIADLO Cc1[nH]c2cc(COc3ccccc3Br)ccc2[nH+]1 ZINC000460443034 333088088 /nfs/dbraw/zinc/08/80/88/333088088.db2.gz JAVNRVSWWLZSHL-UHFFFAOYSA-N 1 2 317.186 4.213 20 0 DIADLO Cc1[nH+]cn(-c2ccc(NC3CC(OC(C)(C)C)C3)cc2)c1C ZINC000463031472 333141675 /nfs/dbraw/zinc/14/16/75/333141675.db2.gz XOSBDGHYIHJVMB-UHFFFAOYSA-N 1 2 313.445 4.247 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)no2)cc1 ZINC000179531405 333151953 /nfs/dbraw/zinc/15/19/53/333151953.db2.gz URTYDFOCLBOAME-ZDUSSCGKSA-N 1 2 317.433 4.005 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2noc(C(C)(C)C)n2)cc1 ZINC000179531865 333152191 /nfs/dbraw/zinc/15/21/91/333152191.db2.gz DXWONQMLPGHBDT-CYBMUJFWSA-N 1 2 317.433 4.005 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@H](c2ccccc2)C2CC2)n1 ZINC000179688714 333154418 /nfs/dbraw/zinc/15/44/18/333154418.db2.gz QMQGVDYXJQJMIU-BLLLJJGKSA-N 1 2 317.458 4.125 20 0 DIADLO Cc1ccccc1NC(=O)C[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000181734824 333171923 /nfs/dbraw/zinc/17/19/23/333171923.db2.gz JHHAIYRYCOFKMH-LBPRGKRZSA-N 1 2 320.795 4.077 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCS[C@H]1CCO[C@H]1C ZINC000460868088 333178961 /nfs/dbraw/zinc/17/89/61/333178961.db2.gz AMWAYKKFKKAJTA-KSSFIOAISA-N 1 2 318.486 4.426 20 0 DIADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1cc2cc(F)ccc2o1 ZINC000522743396 333184596 /nfs/dbraw/zinc/18/45/96/333184596.db2.gz QBEDYIURIGAABD-UHFFFAOYSA-N 1 2 321.311 4.214 20 0 DIADLO COC(=O)[C@@H]([NH2+]CC1(c2ccccc2)CCCC1)c1ccccc1 ZINC000522752865 333188949 /nfs/dbraw/zinc/18/89/49/333188949.db2.gz SRCGLLQUQTYFFY-IBGZPJMESA-N 1 2 323.436 4.002 20 0 DIADLO CC[C@H](NC(=O)c1cc2c(s1)CCCCCC2)c1[nH]cc[nH+]1 ZINC000318589468 333191351 /nfs/dbraw/zinc/19/13/51/333191351.db2.gz LSEGRULDIDAOJZ-ZDUSSCGKSA-N 1 2 317.458 4.011 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+](C)Cc1ccccc1F ZINC000216273814 333205030 /nfs/dbraw/zinc/20/50/30/333205030.db2.gz FPOWROOIOUTTGV-UHFFFAOYSA-N 1 2 315.388 4.059 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+](C)Cc1ccccc1F ZINC000216273814 333205031 /nfs/dbraw/zinc/20/50/31/333205031.db2.gz FPOWROOIOUTTGV-UHFFFAOYSA-N 1 2 315.388 4.059 20 0 DIADLO c1coc(C[N@@H+]2CCCC[C@H]2c2nc(-c3ccccc3)no2)c1 ZINC000093005020 333209492 /nfs/dbraw/zinc/20/94/92/333209492.db2.gz NIVFZTXOSZSNEQ-INIZCTEOSA-N 1 2 309.369 4.057 20 0 DIADLO c1coc(C[N@H+]2CCCC[C@H]2c2nc(-c3ccccc3)no2)c1 ZINC000093005020 333209495 /nfs/dbraw/zinc/20/94/95/333209495.db2.gz NIVFZTXOSZSNEQ-INIZCTEOSA-N 1 2 309.369 4.057 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)o1 ZINC000318802064 333211558 /nfs/dbraw/zinc/21/15/58/333211558.db2.gz MSUGXMAIQYKEAU-WDEREUQCSA-N 1 2 314.307 4.293 20 0 DIADLO CCCOc1cccc2c(NCCc3cscn3)cc[nH+]c12 ZINC000497199988 333221078 /nfs/dbraw/zinc/22/10/78/333221078.db2.gz QQFKBDALRJGKQU-UHFFFAOYSA-N 1 2 313.426 4.135 20 0 DIADLO CCc1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccc(F)cc2)cc1F ZINC000188364129 333246071 /nfs/dbraw/zinc/24/60/71/333246071.db2.gz SQXDUPSCYPQOHH-KRWDZBQOSA-N 1 2 313.351 4.452 20 0 DIADLO CC[N@H+](Cc1nc(CCC(C)C)no1)[C@H](C)c1ccc(F)cc1 ZINC000518829316 335129516 /nfs/dbraw/zinc/12/95/16/335129516.db2.gz PNWFDEQTZJKHJM-CQSZACIVSA-N 1 2 319.424 4.380 20 0 DIADLO CC[N@@H+](Cc1nc(CCC(C)C)no1)[C@H](C)c1ccc(F)cc1 ZINC000518829316 335129517 /nfs/dbraw/zinc/12/95/17/335129517.db2.gz PNWFDEQTZJKHJM-CQSZACIVSA-N 1 2 319.424 4.380 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000497590351 333266201 /nfs/dbraw/zinc/26/62/01/333266201.db2.gz FGQYYMSNQJZEGX-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000497590351 333266203 /nfs/dbraw/zinc/26/62/03/333266203.db2.gz FGQYYMSNQJZEGX-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000497590353 333266301 /nfs/dbraw/zinc/26/63/01/333266301.db2.gz FGQYYMSNQJZEGX-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000497590353 333266303 /nfs/dbraw/zinc/26/63/03/333266303.db2.gz FGQYYMSNQJZEGX-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](CC(=O)N1CCC[C@@H]1c1[nH]c2c([nH+]1)CCCC2)C(C)(C)C ZINC000497670673 333276425 /nfs/dbraw/zinc/27/64/25/333276425.db2.gz HNRICHZJPFVNKD-CZUORRHYSA-N 1 2 317.477 4.024 20 0 DIADLO COc1cncc(/C=C/CC[NH2+][C@H](c2ccccc2)C(F)F)c1 ZINC000582119474 333294641 /nfs/dbraw/zinc/29/46/41/333294641.db2.gz WDUGTKABFTXZDZ-QQOXCAACSA-N 1 2 318.367 4.090 20 0 DIADLO CC(C)[C@H]([NH2+][C@H]1CCC[C@@H](c2cccnc2)C1)C(F)(F)F ZINC000502433431 333295019 /nfs/dbraw/zinc/29/50/19/333295019.db2.gz HYNHUXNWLGNKCE-SNPRPXQTSA-N 1 2 300.368 4.284 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H](c3ccccc3)C3CC3)cc2[nH+]1 ZINC000497897170 333306764 /nfs/dbraw/zinc/30/67/64/333306764.db2.gz YGKPFOZZWDFAAM-SFHVURJKSA-N 1 2 305.381 4.004 20 0 DIADLO Fc1cccc(C[NH2+]Cc2ccsc2Br)c1F ZINC000388447019 333308054 /nfs/dbraw/zinc/30/80/54/333308054.db2.gz WESWAFGNDRYBMD-UHFFFAOYSA-N 1 2 318.186 4.079 20 0 DIADLO Fc1cccc(F)c1C[NH2+]Cc1ccsc1Br ZINC000388449003 333308967 /nfs/dbraw/zinc/30/89/67/333308967.db2.gz XEYGSKUXSBSLHJ-UHFFFAOYSA-N 1 2 318.186 4.079 20 0 DIADLO Cc1ccc(C)c([C@@H]2C[N@H+](CCC(F)(F)F)[C@@H](C)CO2)c1 ZINC000525785978 333311614 /nfs/dbraw/zinc/31/16/14/333311614.db2.gz XKDGPTXYPCSUBJ-ZFWWWQNUSA-N 1 2 301.352 4.018 20 0 DIADLO Cc1ccc(C)c([C@@H]2C[N@@H+](CCC(F)(F)F)[C@@H](C)CO2)c1 ZINC000525785978 333311615 /nfs/dbraw/zinc/31/16/15/333311615.db2.gz XKDGPTXYPCSUBJ-ZFWWWQNUSA-N 1 2 301.352 4.018 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)o1 ZINC000111193397 333328740 /nfs/dbraw/zinc/32/87/40/333328740.db2.gz NSYULEJJHPMTKO-DTWKUNHWSA-N 1 2 314.216 4.351 20 0 DIADLO c1csc(-c2cnc(C[N@@H+]3CCC[C@H]3c3ccccn3)o2)c1 ZINC000531201741 333330823 /nfs/dbraw/zinc/33/08/23/333330823.db2.gz BWQBNPAFMFKHAO-AWEZNQCLSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2cnc(C[N@H+]3CCC[C@H]3c3ccccn3)o2)c1 ZINC000531201741 333330825 /nfs/dbraw/zinc/33/08/25/333330825.db2.gz BWQBNPAFMFKHAO-AWEZNQCLSA-N 1 2 311.410 4.135 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(Cl)n1C)c1cc(Cl)ccc1Cl ZINC000186764959 333378404 /nfs/dbraw/zinc/37/84/04/333378404.db2.gz YSBCGMVVROQQRE-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO Cc1cc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc[nH+]1 ZINC000186853599 333380224 /nfs/dbraw/zinc/38/02/24/333380224.db2.gz XGBHGVLPYZWEDA-UHFFFAOYSA-N 1 2 320.314 4.079 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCCCC[C@H]2c2ccccc2)no1 ZINC000521426132 333381220 /nfs/dbraw/zinc/38/12/20/333381220.db2.gz CUFUDPSRDAGLRJ-INIZCTEOSA-N 1 2 313.445 4.484 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCCCC[C@H]2c2ccccc2)no1 ZINC000521426132 333381221 /nfs/dbraw/zinc/38/12/21/333381221.db2.gz CUFUDPSRDAGLRJ-INIZCTEOSA-N 1 2 313.445 4.484 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2csc(-c3ccccn3)n2)c(C)o1 ZINC000124896384 333502086 /nfs/dbraw/zinc/50/20/86/333502086.db2.gz SWOCHHAOCWUIHM-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO Cn1ccnc1[C@H]([NH2+][C@@H]1CCCc2sccc21)c1ccccc1 ZINC000531687553 333543881 /nfs/dbraw/zinc/54/38/81/333543881.db2.gz IUXYEBGXUSCNCH-SJLPKXTDSA-N 1 2 323.465 4.238 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2c(Cl)cccc2Cl)c(C)n1 ZINC000531694373 333546571 /nfs/dbraw/zinc/54/65/71/333546571.db2.gz YIOFUEGIAKYKGU-VIFPVBQESA-N 1 2 310.228 4.251 20 0 DIADLO c1nc(C[NH+]2CCC(OCC3CCCCC3)CC2)oc1C1CC1 ZINC000534117337 333562354 /nfs/dbraw/zinc/56/23/54/333562354.db2.gz ACNSCILJKXMLQH-UHFFFAOYSA-N 1 2 318.461 4.113 20 0 DIADLO CC(C)c1cccc2c1N(C(=O)c1ccc3[nH+]ccn3c1)CCC2 ZINC000411080083 333628797 /nfs/dbraw/zinc/62/87/97/333628797.db2.gz IBRCNTJWCSAQMW-UHFFFAOYSA-N 1 2 319.408 4.051 20 0 DIADLO Cc1ccc(NC(=O)N(C)[C@H](C)c2ccc(F)c(F)c2)c(C)[nH+]1 ZINC000152156096 333633602 /nfs/dbraw/zinc/63/36/02/333633602.db2.gz MKLSISVPHPSJSI-GFCCVEGCSA-N 1 2 319.355 4.202 20 0 DIADLO Cc1cc(C(C)(C)C)cc(C)c1C[NH2+][C@H](C)c1csnn1 ZINC000412027168 333721304 /nfs/dbraw/zinc/72/13/04/333721304.db2.gz ONXRKRGZXJNUEX-CYBMUJFWSA-N 1 2 303.475 4.303 20 0 DIADLO C[C@H](CC(F)F)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000412109645 333727771 /nfs/dbraw/zinc/72/77/71/333727771.db2.gz PLZDCRXVPYYSSL-LLVKDONJSA-N 1 2 306.312 4.104 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1cc2n(n1)CCC2 ZINC000414097348 333895657 /nfs/dbraw/zinc/89/56/57/333895657.db2.gz RPZKOUOQGZKOAZ-QWRGUYRKSA-N 1 2 307.800 4.034 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccc(F)cc1F)C(C)(C)C)c1ccn(C)n1 ZINC000414115254 333905814 /nfs/dbraw/zinc/90/58/14/333905814.db2.gz PIIVDGGBUITVFX-BZNIZROVSA-N 1 2 307.388 4.136 20 0 DIADLO Cc1occc1C[NH2+]C(C)(C)c1nc(C(F)(F)F)cs1 ZINC000414364155 333945248 /nfs/dbraw/zinc/94/52/48/333945248.db2.gz MJMYABBVGXXULC-UHFFFAOYSA-N 1 2 304.337 4.088 20 0 DIADLO Clc1cc(C[NH2+]Cc2nnc(C3CC3)s2)c(Cl)s1 ZINC000414551229 334015562 /nfs/dbraw/zinc/01/55/62/334015562.db2.gz FAERJPMRVXNXEN-UHFFFAOYSA-N 1 2 320.270 4.074 20 0 DIADLO Cc1c(F)cccc1-c1ccc(C[NH2+][C@H](C)c2csnn2)o1 ZINC000414552538 334015746 /nfs/dbraw/zinc/01/57/46/334015746.db2.gz RKRYTWBWSNHOIU-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1cccc(C(F)(F)F)c1 ZINC000271652043 334024896 /nfs/dbraw/zinc/02/48/96/334024896.db2.gz JFCOIBPPJWOFSU-JTQLQIEISA-N 1 2 310.319 4.422 20 0 DIADLO c1sc(C[N@@H+]2CCSC[C@H]2c2ccccc2)nc1C1CC1 ZINC000343546221 335171311 /nfs/dbraw/zinc/17/13/11/335171311.db2.gz FTGDREINOLNVBP-INIZCTEOSA-N 1 2 316.495 4.311 20 0 DIADLO c1sc(C[N@H+]2CCSC[C@H]2c2ccccc2)nc1C1CC1 ZINC000343546221 335171313 /nfs/dbraw/zinc/17/13/13/335171313.db2.gz FTGDREINOLNVBP-INIZCTEOSA-N 1 2 316.495 4.311 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCOc2cc(Cl)ccc21)c1cscn1 ZINC000271913483 334028588 /nfs/dbraw/zinc/02/85/88/334028588.db2.gz YIOABHLQMXEWNM-MFKMUULPSA-N 1 2 308.834 4.361 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)[C@@H]1CCCCS1 ZINC000272968613 334041482 /nfs/dbraw/zinc/04/14/82/334041482.db2.gz MXNKNILWIMIECI-INIZCTEOSA-N 1 2 314.410 4.098 20 0 DIADLO CCS[C@@H](C)c1noc([C@@H]2CCC[N@@H+]2Cc2ccccc2)n1 ZINC000274005401 334053826 /nfs/dbraw/zinc/05/38/26/334053826.db2.gz RQPMUOZHSMKUKB-ZFWWWQNUSA-N 1 2 317.458 4.221 20 0 DIADLO CCS[C@@H](C)c1noc([C@@H]2CCC[N@H+]2Cc2ccccc2)n1 ZINC000274005401 334053827 /nfs/dbraw/zinc/05/38/27/334053827.db2.gz RQPMUOZHSMKUKB-ZFWWWQNUSA-N 1 2 317.458 4.221 20 0 DIADLO CCS[C@H](C)c1noc([C@H]2CCC[N@@H+]2Cc2ccccc2)n1 ZINC000274005398 334053849 /nfs/dbraw/zinc/05/38/49/334053849.db2.gz RQPMUOZHSMKUKB-UKRRQHHQSA-N 1 2 317.458 4.221 20 0 DIADLO CCS[C@H](C)c1noc([C@H]2CCC[N@H+]2Cc2ccccc2)n1 ZINC000274005398 334053850 /nfs/dbraw/zinc/05/38/50/334053850.db2.gz RQPMUOZHSMKUKB-UKRRQHHQSA-N 1 2 317.458 4.221 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@H+]2CC(C)=C[C@H](C)C2)c(Cl)c1 ZINC000430284084 334069114 /nfs/dbraw/zinc/06/91/14/334069114.db2.gz KLISZWSMAIXNHO-WFASDCNBSA-N 1 2 320.864 4.182 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@@H+]2CC(C)=C[C@H](C)C2)c(Cl)c1 ZINC000430284084 334069115 /nfs/dbraw/zinc/06/91/15/334069115.db2.gz KLISZWSMAIXNHO-WFASDCNBSA-N 1 2 320.864 4.182 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@H]2c2nc3ccccc3s2)nc1 ZINC000276401061 334077094 /nfs/dbraw/zinc/07/70/94/334077094.db2.gz UMFCWZMNSCOYIA-HNNXBMFYSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@H]2c2nc3ccccc3s2)nc1 ZINC000276401061 334077096 /nfs/dbraw/zinc/07/70/96/334077096.db2.gz UMFCWZMNSCOYIA-HNNXBMFYSA-N 1 2 313.401 4.168 20 0 DIADLO C[C@@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1csc(Cl)c1 ZINC000276462986 334079212 /nfs/dbraw/zinc/07/92/12/334079212.db2.gz CLZMEAZIFXTDEA-PRHODGIISA-N 1 2 317.788 4.064 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@@H+]1CCC2(C1)CCCCC2 ZINC000438164348 334093861 /nfs/dbraw/zinc/09/38/61/334093861.db2.gz AQIRYXQDBWLJDX-UHFFFAOYSA-N 1 2 303.450 4.274 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@H+]1CCC2(C1)CCCCC2 ZINC000438164348 334093864 /nfs/dbraw/zinc/09/38/64/334093864.db2.gz AQIRYXQDBWLJDX-UHFFFAOYSA-N 1 2 303.450 4.274 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1cccc(F)c1F ZINC000278883241 334102806 /nfs/dbraw/zinc/10/28/06/334102806.db2.gz UADDTRZIECCLKR-SECBINFHSA-N 1 2 316.273 4.229 20 0 DIADLO CCn1nc(CNc2ccc3c(c2)CCC[NH2+]3)c2ccccc21 ZINC000414851610 334125575 /nfs/dbraw/zinc/12/55/75/334125575.db2.gz OKWIBUMNBVHLTB-UHFFFAOYSA-N 1 2 306.413 4.026 20 0 DIADLO Brc1ccc(CNc2ccc3c(c2)CCC[NH2+]3)cc1 ZINC000414854081 334127608 /nfs/dbraw/zinc/12/76/08/334127608.db2.gz TVPNTMMQNPFBPB-UHFFFAOYSA-N 1 2 317.230 4.419 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(Cl)c2)C[N@@H+]1Cc1ccsc1 ZINC000438547061 334128312 /nfs/dbraw/zinc/12/83/12/334128312.db2.gz OLGRRWJWQSHGRQ-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(Cl)c2)C[N@H+]1Cc1ccsc1 ZINC000438547061 334128314 /nfs/dbraw/zinc/12/83/14/334128314.db2.gz OLGRRWJWQSHGRQ-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@H](c2cccc(Cl)c2)C[N@@H+]1Cc1ccsc1 ZINC000438547059 334128344 /nfs/dbraw/zinc/12/83/44/334128344.db2.gz OLGRRWJWQSHGRQ-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@H](c2cccc(Cl)c2)C[N@H+]1Cc1ccsc1 ZINC000438547059 334128346 /nfs/dbraw/zinc/12/83/46/334128346.db2.gz OLGRRWJWQSHGRQ-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO c1cc([C@H]2CCCC[N@H+]2Cc2cnc(-c3ccccc3)s2)n[nH]1 ZINC000285329930 334147109 /nfs/dbraw/zinc/14/71/09/334147109.db2.gz JQTLPFSRMHPPEX-QGZVFWFLSA-N 1 2 324.453 4.260 20 0 DIADLO c1cc([C@H]2CCCC[N@@H+]2Cc2cnc(-c3ccccc3)s2)n[nH]1 ZINC000285329930 334147110 /nfs/dbraw/zinc/14/71/10/334147110.db2.gz JQTLPFSRMHPPEX-QGZVFWFLSA-N 1 2 324.453 4.260 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)cc1O ZINC000289844040 334168446 /nfs/dbraw/zinc/16/84/46/334168446.db2.gz QUUQDTFTNZLFPG-QWRGUYRKSA-N 1 2 307.340 4.091 20 0 DIADLO Cc1ccc(NC(=O)N2CC3(CCC3)[C@H]2c2ccccc2)c(C)[nH+]1 ZINC000292872430 334193419 /nfs/dbraw/zinc/19/34/19/334193419.db2.gz XFYDFLBMPANLDN-GOSISDBHSA-N 1 2 321.424 4.458 20 0 DIADLO Cc1ccc(NC(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC000292872433 334193517 /nfs/dbraw/zinc/19/35/17/334193517.db2.gz XFYDFLBMPANLDN-SFHVURJKSA-N 1 2 321.424 4.458 20 0 DIADLO CCc1cnc(C[N@H+](C)C/C=C/c2ccc(F)c(F)c2)s1 ZINC000582149088 334273244 /nfs/dbraw/zinc/27/32/44/334273244.db2.gz VQNJHMQQGZXJBR-SNAWJCMRSA-N 1 2 308.397 4.129 20 0 DIADLO CCc1cnc(C[N@@H+](C)C/C=C/c2ccc(F)c(F)c2)s1 ZINC000582149088 334273245 /nfs/dbraw/zinc/27/32/45/334273245.db2.gz VQNJHMQQGZXJBR-SNAWJCMRSA-N 1 2 308.397 4.129 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2nc(-c3ccccc3)oc2C)s1 ZINC000298741506 334250802 /nfs/dbraw/zinc/25/08/02/334250802.db2.gz SHFDYMDVPMXZSG-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2nc(-c3ccccc3)oc2C)s1 ZINC000298741506 334250804 /nfs/dbraw/zinc/25/08/04/334250804.db2.gz SHFDYMDVPMXZSG-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2cc(-c3ccc(C)cc3)no2)s1 ZINC000298741410 334250922 /nfs/dbraw/zinc/25/09/22/334250922.db2.gz SDCARVCUZHVJBA-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2cc(-c3ccc(C)cc3)no2)s1 ZINC000298741410 334250923 /nfs/dbraw/zinc/25/09/23/334250923.db2.gz SDCARVCUZHVJBA-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccoc1C[N@@H+]1CCCC[C@@H]1c1nc(-c2ccccc2)no1 ZINC000514092087 334264371 /nfs/dbraw/zinc/26/43/71/334264371.db2.gz BURRPHOSFBRWLY-MRXNPFEDSA-N 1 2 323.396 4.365 20 0 DIADLO Cc1ccoc1C[N@H+]1CCCC[C@@H]1c1nc(-c2ccccc2)no1 ZINC000514092087 334264372 /nfs/dbraw/zinc/26/43/72/334264372.db2.gz BURRPHOSFBRWLY-MRXNPFEDSA-N 1 2 323.396 4.365 20 0 DIADLO CCCC[N@@H+](Cc1ccccc1Cl)Cc1nccc(C)n1 ZINC000534472462 334269549 /nfs/dbraw/zinc/26/95/49/334269549.db2.gz BATKCFSIHHYQDO-UHFFFAOYSA-N 1 2 303.837 4.241 20 0 DIADLO CCCC[N@H+](Cc1ccccc1Cl)Cc1nccc(C)n1 ZINC000534472462 334269550 /nfs/dbraw/zinc/26/95/50/334269550.db2.gz BATKCFSIHHYQDO-UHFFFAOYSA-N 1 2 303.837 4.241 20 0 DIADLO CCCCC[N@H+](Cc1ccc(F)cc1)Cc1nccc(C)n1 ZINC000534490309 334277157 /nfs/dbraw/zinc/27/71/57/334277157.db2.gz CNCWBMCCQQIZOT-UHFFFAOYSA-N 1 2 301.409 4.117 20 0 DIADLO CCCCC[N@@H+](Cc1ccc(F)cc1)Cc1nccc(C)n1 ZINC000534490309 334277159 /nfs/dbraw/zinc/27/71/59/334277159.db2.gz CNCWBMCCQQIZOT-UHFFFAOYSA-N 1 2 301.409 4.117 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C3(c4cc(C)cc(C)c4)CC3)cc2[nH+]1 ZINC000531930646 334291382 /nfs/dbraw/zinc/29/13/82/334291382.db2.gz ZALFNKVAVYMEEG-UHFFFAOYSA-N 1 2 319.408 4.158 20 0 DIADLO Clc1ccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)s1 ZINC000187862061 334296141 /nfs/dbraw/zinc/29/61/41/334296141.db2.gz CAECOIIVJWNKDI-CQSZACIVSA-N 1 2 303.818 4.004 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCc3c4ccccc4[nH]c3C2)cc1F ZINC000534665623 334318875 /nfs/dbraw/zinc/31/88/75/334318875.db2.gz DGOAIXKNTSIMBF-UHFFFAOYSA-N 1 2 312.363 4.047 20 0 DIADLO Fc1ccc(CC[N@H+]2CCc3c4ccccc4[nH]c3C2)cc1F ZINC000534665623 334318876 /nfs/dbraw/zinc/31/88/76/334318876.db2.gz DGOAIXKNTSIMBF-UHFFFAOYSA-N 1 2 312.363 4.047 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(C(F)(F)F)c(F)c2)c(C)[nH+]1 ZINC000187878363 334328131 /nfs/dbraw/zinc/32/81/31/334328131.db2.gz WTZMJODXIYMVIF-UHFFFAOYSA-N 1 2 312.266 4.109 20 0 DIADLO CC(C)COC[C@@H]([NH2+]Cc1ccccc1Cl)c1ccco1 ZINC000101597041 334336436 /nfs/dbraw/zinc/33/64/36/334336436.db2.gz RSOVOJDCXZDWQZ-MRXNPFEDSA-N 1 2 307.821 4.437 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@@H]2c2cccc(C)c2C)no1 ZINC000303910243 334342338 /nfs/dbraw/zinc/34/23/38/334342338.db2.gz MQODNRZYCZZUJJ-QGZVFWFLSA-N 1 2 313.445 4.366 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@@H]2c2cccc(C)c2C)no1 ZINC000303910243 334342339 /nfs/dbraw/zinc/34/23/39/334342339.db2.gz MQODNRZYCZZUJJ-QGZVFWFLSA-N 1 2 313.445 4.366 20 0 DIADLO Fc1cccc(C[NH+]2CC(c3nc4ccccc4s3)C2)c1F ZINC000534952081 334352192 /nfs/dbraw/zinc/35/21/92/334352192.db2.gz UMXITZCATCHBPU-UHFFFAOYSA-N 1 2 316.376 4.174 20 0 DIADLO Cc1cc(NC(=O)c2ccc(Oc3ccccc3)cc2)c(C)c[nH+]1 ZINC000535035808 334359070 /nfs/dbraw/zinc/35/90/70/334359070.db2.gz GNUFWKIHFGBSMF-UHFFFAOYSA-N 1 2 318.376 4.165 20 0 DIADLO CC(C)C[C@@H](C)Oc1cc(C[NH2+][C@H](C)c2cscn2)ccn1 ZINC000535064649 334362441 /nfs/dbraw/zinc/36/24/41/334362441.db2.gz TXCSXSOPQKLSEG-ZIAGYGMSSA-N 1 2 319.474 4.202 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3n2C)nc1 ZINC000535078134 334363159 /nfs/dbraw/zinc/36/31/59/334363159.db2.gz KYQXUFGBJQEFSA-IBGZPJMESA-N 1 2 320.440 4.004 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3n2C)nc1 ZINC000535078134 334363161 /nfs/dbraw/zinc/36/31/61/334363161.db2.gz KYQXUFGBJQEFSA-IBGZPJMESA-N 1 2 320.440 4.004 20 0 DIADLO C[C@H]1C[NH+](Cc2csc(-c3cccs3)n2)C[C@H](C)S1 ZINC000535085464 334367156 /nfs/dbraw/zinc/36/71/56/334367156.db2.gz UPAFZBUJQOSRHL-QWRGUYRKSA-N 1 2 310.513 4.197 20 0 DIADLO CC(C)c1ncc(C[N@H+](C)[C@@H](C)c2ccc(F)cc2F)cn1 ZINC000440478565 334367572 /nfs/dbraw/zinc/36/75/72/334367572.db2.gz LNBMGWCWUKKXQQ-LBPRGKRZSA-N 1 2 305.372 4.071 20 0 DIADLO CC(C)c1ncc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2F)cn1 ZINC000440478565 334367574 /nfs/dbraw/zinc/36/75/74/334367574.db2.gz LNBMGWCWUKKXQQ-LBPRGKRZSA-N 1 2 305.372 4.071 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@@H](c3ccccc3)[C@@H](C)C2)c(C)[nH+]1 ZINC000152281988 334367619 /nfs/dbraw/zinc/36/76/19/334367619.db2.gz YXYFHKMIXZUZHI-KBXCAEBGSA-N 1 2 323.440 4.356 20 0 DIADLO C[C@@H]1CCC[C@@H]1NC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000112211348 334373763 /nfs/dbraw/zinc/37/37/63/334373763.db2.gz QYQIZCJCFDCBKT-DYVFJYSZSA-N 1 2 311.385 4.184 20 0 DIADLO CC[C@H](NC(=O)C/C=C\c1ccc(C(C)C)cc1)c1[nH]cc[nH+]1 ZINC000443133130 338445270 /nfs/dbraw/zinc/44/52/70/338445270.db2.gz ULWFWBMTIVSJFB-OSJSJHBBSA-N 1 2 311.429 4.204 20 0 DIADLO CC(C)(C)c1csc(COc2ccccc2-n2cc[nH+]c2)n1 ZINC000532032904 334380950 /nfs/dbraw/zinc/38/09/50/334380950.db2.gz YBDVZGFSJCXOHC-UHFFFAOYSA-N 1 2 313.426 4.205 20 0 DIADLO Cc1cc(NC(=O)c2[nH]c3ccc(Cl)cc3c2Cl)cc[nH+]1 ZINC000112298520 334381448 /nfs/dbraw/zinc/38/14/48/334381448.db2.gz JXPGMSYJHOCPSM-UHFFFAOYSA-N 1 2 320.179 4.430 20 0 DIADLO Cc1ccc(C2CCN(c3ncnc4cccc(C)c43)CC2)c[nH+]1 ZINC000340846811 334386050 /nfs/dbraw/zinc/38/60/50/334386050.db2.gz UGHAWHKNASCELN-UHFFFAOYSA-N 1 2 318.424 4.026 20 0 DIADLO Cc1ccc(C2CCN(c3nccc4ccc(F)cc43)CC2)c[nH+]1 ZINC000340799663 334386364 /nfs/dbraw/zinc/38/63/64/334386364.db2.gz OSDCBPJTIBQOKY-UHFFFAOYSA-N 1 2 321.399 4.461 20 0 DIADLO Cc1ccc(C2CCN(c3ccc4ccccc4n3)CC2)c[nH+]1 ZINC000340818653 334387682 /nfs/dbraw/zinc/38/76/82/334387682.db2.gz HKUOMXNFHOQTNB-UHFFFAOYSA-N 1 2 303.409 4.322 20 0 DIADLO Cc1ccc2ncnc(N3CCC(c4ccc(C)[nH+]c4)CC3)c2c1 ZINC000340837396 334389039 /nfs/dbraw/zinc/38/90/39/334389039.db2.gz KTVMNEDXBBPNOA-UHFFFAOYSA-N 1 2 318.424 4.026 20 0 DIADLO C[N@H+](Cc1ncc(Br)s1)[C@H]1CCc2ccccc21 ZINC000340949406 334395931 /nfs/dbraw/zinc/39/59/31/334395931.db2.gz MZBCURIZSJRVLX-LBPRGKRZSA-N 1 2 323.259 4.025 20 0 DIADLO C[N@@H+](Cc1ncc(Br)s1)[C@H]1CCc2ccccc21 ZINC000340949406 334395933 /nfs/dbraw/zinc/39/59/33/334395933.db2.gz MZBCURIZSJRVLX-LBPRGKRZSA-N 1 2 323.259 4.025 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](C)Cc1ncc(Br)s1 ZINC000340922697 334397764 /nfs/dbraw/zinc/39/77/64/334397764.db2.gz WCCZLRZLEUTTQR-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1ncc(Br)s1 ZINC000340922697 334397765 /nfs/dbraw/zinc/39/77/65/334397765.db2.gz WCCZLRZLEUTTQR-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO Cc1ccc(NC(=O)C[C@@H](c2[nH]cc[nH+]2)c2ccccc2)cc1F ZINC000341011425 334399539 /nfs/dbraw/zinc/39/95/39/334399539.db2.gz FUTDKVUWPGBJBJ-MRXNPFEDSA-N 1 2 323.371 4.018 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)o1 ZINC000341220650 334419144 /nfs/dbraw/zinc/41/91/44/334419144.db2.gz NXZSUPMWZVHWGB-ZJUUUORDSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2ccc(SC(C)C)cc2)nc1 ZINC000341787227 334481166 /nfs/dbraw/zinc/48/11/66/334481166.db2.gz FOOMCPCXQMQMRU-CQSZACIVSA-N 1 2 301.459 4.136 20 0 DIADLO Clc1cccc2c(NCCCc3nccs3)cc[nH+]c12 ZINC000342133942 334513297 /nfs/dbraw/zinc/51/32/97/334513297.db2.gz RPXFGNLQBUMTRC-UHFFFAOYSA-N 1 2 303.818 4.389 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000342223171 334522604 /nfs/dbraw/zinc/52/26/04/334522604.db2.gz FTAFYFGQDXSPAY-CABCVRRESA-N 1 2 307.397 4.457 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nc(C3CCCC3)no2)ccc1F ZINC000342304191 334526792 /nfs/dbraw/zinc/52/67/92/334526792.db2.gz DVFZVEOUDDVDPU-GFCCVEGCSA-N 1 2 303.381 4.026 20 0 DIADLO COc1cc[nH+]cc1NC(=O)c1ccc(C(C)C)c(Cl)c1 ZINC000342443644 334542001 /nfs/dbraw/zinc/54/20/01/334542001.db2.gz WDXMJPTUNINEAY-UHFFFAOYSA-N 1 2 304.777 4.119 20 0 DIADLO C[C@H](Nc1cc[nH+]c2ccncc12)c1cc2ccccc2s1 ZINC000443500276 338452905 /nfs/dbraw/zinc/45/29/05/338452905.db2.gz LXHPBOPFXURYQY-LBPRGKRZSA-N 1 2 305.406 4.440 20 0 DIADLO C[C@@H]1CCN(c2[nH+]c3cccc(F)c3n2C)[C@@H](c2ccco2)C1 ZINC000443510488 338453158 /nfs/dbraw/zinc/45/31/58/338453158.db2.gz OAXQVVFRFAMITM-IUODEOHRSA-N 1 2 313.376 4.283 20 0 DIADLO C[C@@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1ccc(Cl)cn1 ZINC000343083487 334598429 /nfs/dbraw/zinc/59/84/29/334598429.db2.gz LZAHHKOYQHJLJK-MRVPVSSYSA-N 1 2 301.699 4.322 20 0 DIADLO CS[C@H]1CC[C@@H]1Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000425344952 334804166 /nfs/dbraw/zinc/80/41/66/334804166.db2.gz UVHFFIGLDQRMNX-IRXDYDNUSA-N 1 2 313.470 4.192 20 0 DIADLO CS[C@@H]1CC[C@@H]1Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000425356759 334837610 /nfs/dbraw/zinc/83/76/10/334837610.db2.gz MMSPZKUBWVLVIR-DOTOQJQBSA-N 1 2 313.470 4.192 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1F ZINC000126625633 334861219 /nfs/dbraw/zinc/86/12/19/334861219.db2.gz YIRFFOCCXPFFEK-VXGBXAGGSA-N 1 2 305.397 4.226 20 0 DIADLO CC(C)n1c[nH+]cc1CN1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000425390837 334884845 /nfs/dbraw/zinc/88/48/45/334884845.db2.gz YYRMTQQCHISUNH-KRWDZBQOSA-N 1 2 321.827 4.188 20 0 DIADLO CC(C)=CC[N@@H+](Cc1cncn1C)Cc1ccc(Cl)cc1 ZINC000343654700 335185520 /nfs/dbraw/zinc/18/55/20/335185520.db2.gz HPNHBENXVLYTIP-UHFFFAOYSA-N 1 2 303.837 4.042 20 0 DIADLO CC(C)=CC[N@H+](Cc1cncn1C)Cc1ccc(Cl)cc1 ZINC000343654700 335185521 /nfs/dbraw/zinc/18/55/21/335185521.db2.gz HPNHBENXVLYTIP-UHFFFAOYSA-N 1 2 303.837 4.042 20 0 DIADLO CC(C)=CCN(Cc1c[nH+]cn1C)Cc1ccc(Cl)cc1 ZINC000343654700 335185522 /nfs/dbraw/zinc/18/55/22/335185522.db2.gz HPNHBENXVLYTIP-UHFFFAOYSA-N 1 2 303.837 4.042 20 0 DIADLO C[N@H+](Cc1nc(C2CC2)cs1)Cc1ccc(Cl)c(F)c1 ZINC000343722428 335186593 /nfs/dbraw/zinc/18/65/93/335186593.db2.gz XBGIVTGCXIHAEC-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO C[N@@H+](Cc1nc(C2CC2)cs1)Cc1ccc(Cl)c(F)c1 ZINC000343722428 335186594 /nfs/dbraw/zinc/18/65/94/335186594.db2.gz XBGIVTGCXIHAEC-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO CN(C[C@@H]1CC=CCC1)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000343812140 335194932 /nfs/dbraw/zinc/19/49/32/335194932.db2.gz AYENVJQSRKKNQC-MRXNPFEDSA-N 1 2 322.408 4.302 20 0 DIADLO C[C@@H](Sc1[nH+]cc2ccccn21)c1nccn1-c1ccccc1 ZINC000343843815 335196801 /nfs/dbraw/zinc/19/68/01/335196801.db2.gz TVHGHNNHZGJZRQ-CQSZACIVSA-N 1 2 320.421 4.373 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)o1 ZINC000343853370 335197522 /nfs/dbraw/zinc/19/75/22/335197522.db2.gz HTJBOCCQOGWWGB-RKDXNWHRSA-N 1 2 304.337 4.475 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)o1)c1nc(C(F)(F)F)cs1 ZINC000343852920 335197780 /nfs/dbraw/zinc/19/77/80/335197780.db2.gz RLZLMRSEUAEWGG-ZCFIWIBFSA-N 1 2 310.728 4.259 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@@H](C3CC3)C2)cc1Oc1cc[nH+]cc1 ZINC000343875055 335199235 /nfs/dbraw/zinc/19/92/35/335199235.db2.gz ULSGDEGQYNWXSF-QGZVFWFLSA-N 1 2 322.408 4.054 20 0 DIADLO COc1cncc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)c1 ZINC000343905222 335201335 /nfs/dbraw/zinc/20/13/35/335201335.db2.gz JFUIEVVDBIYLFP-UHFFFAOYSA-N 1 2 324.346 4.045 20 0 DIADLO COc1cncc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)c1 ZINC000343905222 335201336 /nfs/dbraw/zinc/20/13/36/335201336.db2.gz JFUIEVVDBIYLFP-UHFFFAOYSA-N 1 2 324.346 4.045 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ncc(C(C)C)s3)CCC2)n1 ZINC000344204928 335225048 /nfs/dbraw/zinc/22/50/48/335225048.db2.gz IJNZZANTCKJCEP-UHFFFAOYSA-N 1 2 307.488 4.200 20 0 DIADLO Cc1sc(C[NH2+]Cc2csc(C3CC3)n2)nc1C(C)C ZINC000344167820 335226675 /nfs/dbraw/zinc/22/66/75/335226675.db2.gz DTXDGOMDUNXISE-UHFFFAOYSA-N 1 2 307.488 4.199 20 0 DIADLO Fc1ccc(-c2nc(C[N@@H+]3CCCc4occc4C3)co2)cc1 ZINC000344283416 335236095 /nfs/dbraw/zinc/23/60/95/335236095.db2.gz QNRYHUBFOHPFAV-UHFFFAOYSA-N 1 2 312.344 4.022 20 0 DIADLO Fc1ccc(-c2nc(C[N@H+]3CCCc4occc4C3)co2)cc1 ZINC000344283416 335236096 /nfs/dbraw/zinc/23/60/96/335236096.db2.gz QNRYHUBFOHPFAV-UHFFFAOYSA-N 1 2 312.344 4.022 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+]C(C)(C)c3nccs3)co2)cc1 ZINC000344305750 335239173 /nfs/dbraw/zinc/23/91/73/335239173.db2.gz HQYILDMUEWTZSH-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO COc1c(Cl)cccc1NCc1cc(-n2cc[nH+]c2)cs1 ZINC000344329494 335241357 /nfs/dbraw/zinc/24/13/57/335241357.db2.gz SITGJMCMPRFNLI-UHFFFAOYSA-N 1 2 319.817 4.208 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2ccccc2[nH]1)c1cc(F)ccc1F ZINC000344483990 335253185 /nfs/dbraw/zinc/25/31/85/335253185.db2.gz WDNRYFLSQBRIPU-CQSZACIVSA-N 1 2 301.340 4.082 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2ccc(Cl)cc2Cl)s1 ZINC000344634778 335261137 /nfs/dbraw/zinc/26/11/37/335261137.db2.gz CDEUKZKTSNZMGR-UHFFFAOYSA-N 1 2 316.257 4.258 20 0 DIADLO CC[C@@H]([NH2+]Cc1c(Cl)cccc1OC)c1nc(C)cs1 ZINC000118448999 335268253 /nfs/dbraw/zinc/26/82/53/335268253.db2.gz ZOLAYYYOGPRFBM-CYBMUJFWSA-N 1 2 310.850 4.354 20 0 DIADLO Cc1[nH]c(C(=O)N[C@H](c2ccc(Cl)cc2)C2CCCC2)c[nH+]1 ZINC000344732544 335272043 /nfs/dbraw/zinc/27/20/43/335272043.db2.gz QZMWTQHMJFDJFY-INIZCTEOSA-N 1 2 317.820 4.033 20 0 DIADLO CC(C)[C@@H](N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1)C(F)(F)F ZINC000345162105 335302590 /nfs/dbraw/zinc/30/25/90/335302590.db2.gz KBOYSHWBCDRSPP-SWLSCSKDSA-N 1 2 311.351 4.110 20 0 DIADLO COc1cc[nH+]cc1NC(=O)C[C@@H]1C[C@H](C(C)C)c2ccccc21 ZINC000345739845 335347098 /nfs/dbraw/zinc/34/70/98/335347098.db2.gz KJOFPNXFQFVJPA-WMLDXEAASA-N 1 2 324.424 4.346 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2ccc(F)cn2)C2CC2)o1 ZINC000345775989 335350598 /nfs/dbraw/zinc/35/05/98/335350598.db2.gz RSTUJTZVGFVNIU-SJKOYZFVSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2ccc(F)cn2)C2CC2)o1 ZINC000345775989 335350600 /nfs/dbraw/zinc/35/06/00/335350600.db2.gz RSTUJTZVGFVNIU-SJKOYZFVSA-N 1 2 300.377 4.102 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)C[C@@H]1C[C@@H](C(C)C)c2ccccc21 ZINC000345906771 335360020 /nfs/dbraw/zinc/36/00/20/335360020.db2.gz OOMXXTPNTAVQRX-YJBOKZPZSA-N 1 2 308.425 4.068 20 0 DIADLO C[C@H]1CC=CC[C@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000346007378 335369221 /nfs/dbraw/zinc/36/92/21/335369221.db2.gz AGGKFUAGEZLVIY-WMLDXEAASA-N 1 2 320.396 4.051 20 0 DIADLO Cn1cncc1C[N@@H+]1CCCC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000346155481 335382934 /nfs/dbraw/zinc/38/29/34/335382934.db2.gz UWFBOKOILBIQBE-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1cncc1C[N@H+]1CCCC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000346155481 335382935 /nfs/dbraw/zinc/38/29/35/335382935.db2.gz UWFBOKOILBIQBE-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO CCc1cnc(C[N@H+](C)[C@H](C)c2sc(CC)nc2C)s1 ZINC000346190138 335388186 /nfs/dbraw/zinc/38/81/86/335388186.db2.gz VYKDIOIDMHIBCZ-LLVKDONJSA-N 1 2 309.504 4.226 20 0 DIADLO CCc1cnc(C[N@@H+](C)[C@H](C)c2sc(CC)nc2C)s1 ZINC000346190138 335388187 /nfs/dbraw/zinc/38/81/87/335388187.db2.gz VYKDIOIDMHIBCZ-LLVKDONJSA-N 1 2 309.504 4.226 20 0 DIADLO Cc1ccc(C(=O)N2CCC(C)(C)CC2)cc1Oc1cc[nH+]cc1 ZINC000346355475 335397759 /nfs/dbraw/zinc/39/77/59/335397759.db2.gz WKTSHNZOHSJEDU-UHFFFAOYSA-N 1 2 324.424 4.445 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1noc(C2CC2)n1 ZINC000346307654 335398383 /nfs/dbraw/zinc/39/83/83/335398383.db2.gz YGCADHPKLOMZJN-CQSZACIVSA-N 1 2 305.809 4.184 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000346307654 335398384 /nfs/dbraw/zinc/39/83/84/335398384.db2.gz YGCADHPKLOMZJN-CQSZACIVSA-N 1 2 305.809 4.184 20 0 DIADLO Cc1ccc(N[C@@H]2CCc3c2c(Br)ccc3F)c[nH+]1 ZINC000347124071 335467856 /nfs/dbraw/zinc/46/78/56/335467856.db2.gz IPDRSWFECHRBAK-CQSZACIVSA-N 1 2 321.193 4.391 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(-c2ccsc2)oc1C)c1nccs1 ZINC000347911932 335533680 /nfs/dbraw/zinc/53/36/80/335533680.db2.gz LENXRVCMBXTGBX-GFCCVEGCSA-N 1 2 319.455 4.409 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2ccn(C3CCCC3)n2)C2CC2)s1 ZINC000347946052 335540909 /nfs/dbraw/zinc/54/09/09/335540909.db2.gz DWQYYXLCMLFYEW-MRXNPFEDSA-N 1 2 316.474 4.004 20 0 DIADLO Cc1noc([C@@H](C)[NH2+][C@H]2CCc3c2cc(Cl)cc3Cl)n1 ZINC000348094813 335552873 /nfs/dbraw/zinc/55/28/73/335552873.db2.gz ZNXCALMJTAOXMV-UHLUBPPHSA-N 1 2 312.200 4.023 20 0 DIADLO c1cn(Cc2ccc(N[C@H]3CC[C@H](c4ccccc4)C3)nc2)c[nH+]1 ZINC000348836423 335612003 /nfs/dbraw/zinc/61/20/03/335612003.db2.gz WDJNEHMJTWTURN-OALUTQOASA-N 1 2 318.424 4.075 20 0 DIADLO COc1ccc2cc([C@@H](C)[NH2+][C@H](C)c3csnn3)ccc2c1 ZINC000398429344 335649787 /nfs/dbraw/zinc/64/97/87/335649787.db2.gz UEYQSTILHKKPDF-VXGBXAGGSA-N 1 2 313.426 4.112 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(F)cc1F ZINC000349563729 335680994 /nfs/dbraw/zinc/68/09/94/335680994.db2.gz HBUSDIXAMMQZTE-LLVKDONJSA-N 1 2 302.777 4.316 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ncc(Cl)s3)CCCC2)n1 ZINC000349595778 335683137 /nfs/dbraw/zinc/68/31/37/335683137.db2.gz DYMWNULWBAXEPR-UHFFFAOYSA-N 1 2 313.879 4.121 20 0 DIADLO Cc1cc(N2CCc3sccc3[C@H]2C)nc(-c2ccncc2)[nH+]1 ZINC000350716810 335775771 /nfs/dbraw/zinc/77/57/71/335775771.db2.gz XTGOCQLPHUAXTG-CYBMUJFWSA-N 1 2 322.437 4.032 20 0 DIADLO CCSc1ccc(C(=O)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC000350716012 335775900 /nfs/dbraw/zinc/77/59/00/335775900.db2.gz TZWSZRVDUYDRGU-UHFFFAOYSA-N 1 2 323.421 4.237 20 0 DIADLO Cc1cc(NC(=O)c2cc(C(C)C)nc3ccccc32)c(C)c[nH+]1 ZINC000536575202 335840744 /nfs/dbraw/zinc/84/07/44/335840744.db2.gz IPWRDIPATGYQSY-UHFFFAOYSA-N 1 2 319.408 4.044 20 0 DIADLO CC[C@H](NC(=O)Nc1cc(C)[nH+]cc1C)c1ccc(Cl)s1 ZINC000536619434 335846425 /nfs/dbraw/zinc/84/64/25/335846425.db2.gz ZHBBACKZBQFAKM-NSHDSACASA-N 1 2 323.849 4.108 20 0 DIADLO Cc1cc(OCc2nc(C)c3ccccc3n2)c2ccccc2[nH+]1 ZINC000520500661 335983398 /nfs/dbraw/zinc/98/33/98/335983398.db2.gz PWPDDMJPPBJGAG-UHFFFAOYSA-N 1 2 315.376 4.374 20 0 DIADLO CC(C)(C)[N@H+](Cc1cocn1)Cc1ccccc1Br ZINC000191934659 336005426 /nfs/dbraw/zinc/00/54/26/336005426.db2.gz WAQDYXLQMMOHHC-UHFFFAOYSA-N 1 2 323.234 4.238 20 0 DIADLO CC(C)(C)[N@@H+](Cc1cocn1)Cc1ccccc1Br ZINC000191934659 336005428 /nfs/dbraw/zinc/00/54/28/336005428.db2.gz WAQDYXLQMMOHHC-UHFFFAOYSA-N 1 2 323.234 4.238 20 0 DIADLO CCC1(c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)CCCC1 ZINC000445795519 338509583 /nfs/dbraw/zinc/50/95/83/338509583.db2.gz VLJZBLJKFRFFQQ-UHFFFAOYSA-N 1 2 308.385 4.144 20 0 DIADLO CCCCC[N@H+](Cc1nccn1CC)Cc1ccc(F)cc1 ZINC000520695028 336021570 /nfs/dbraw/zinc/02/15/70/336021570.db2.gz KXWVQJBVKUFWBH-UHFFFAOYSA-N 1 2 303.425 4.235 20 0 DIADLO CCCCC[N@@H+](Cc1nccn1CC)Cc1ccc(F)cc1 ZINC000520695028 336021572 /nfs/dbraw/zinc/02/15/72/336021572.db2.gz KXWVQJBVKUFWBH-UHFFFAOYSA-N 1 2 303.425 4.235 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2cocn2)c2ccsc2)cc1 ZINC000192295847 336027648 /nfs/dbraw/zinc/02/76/48/336027648.db2.gz AEVDUKFTCHUBBX-HNNXBMFYSA-N 1 2 304.802 4.269 20 0 DIADLO CN(Cc1cn2c([nH+]1)CCCC2)Cc1cc(Cl)cc(Cl)c1 ZINC000351627634 336053158 /nfs/dbraw/zinc/05/31/58/336053158.db2.gz HOFPFORSNVDJGO-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO C[N@H+](Cc1cn2c(n1)CCCC2)Cc1cc(Cl)cc(Cl)c1 ZINC000351627634 336053159 /nfs/dbraw/zinc/05/31/59/336053159.db2.gz HOFPFORSNVDJGO-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO C[N@@H+](Cc1cn2c(n1)CCCC2)Cc1cc(Cl)cc(Cl)c1 ZINC000351627634 336053160 /nfs/dbraw/zinc/05/31/60/336053160.db2.gz HOFPFORSNVDJGO-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO Fc1ccc(C[N@H+](Cc2nccs2)C2CCCC2)c(F)c1 ZINC000351675683 336057210 /nfs/dbraw/zinc/05/72/10/336057210.db2.gz VSDQRRJRRGDMAR-UHFFFAOYSA-N 1 2 308.397 4.366 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2nccs2)C2CCCC2)c(F)c1 ZINC000351675683 336057212 /nfs/dbraw/zinc/05/72/12/336057212.db2.gz VSDQRRJRRGDMAR-UHFFFAOYSA-N 1 2 308.397 4.366 20 0 DIADLO Cc1cc(-c2noc(-c3[nH+]c(C4CC4)n4ccccc34)n2)c(C)o1 ZINC000445858157 338513226 /nfs/dbraw/zinc/51/32/26/338513226.db2.gz UCOQHKQSIODEFO-UHFFFAOYSA-N 1 2 320.352 4.139 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@@H+]2[C@@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331403827 336134818 /nfs/dbraw/zinc/13/48/18/336134818.db2.gz NSPHKJUDNONMJR-JSGCOSHPSA-N 1 2 317.433 4.421 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@H+]2[C@@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331403827 336134819 /nfs/dbraw/zinc/13/48/19/336134819.db2.gz NSPHKJUDNONMJR-JSGCOSHPSA-N 1 2 317.433 4.421 20 0 DIADLO CCC1(CNC(=O)N2CCCC[C@H]2c2[nH]cc[nH+]2)CCCCC1 ZINC000331717030 336145375 /nfs/dbraw/zinc/14/53/75/336145375.db2.gz OYNAQEQXOIZZQP-HNNXBMFYSA-N 1 2 318.465 4.007 20 0 DIADLO Cc1cc(NC(=O)c2cccc(O)c2)ccc1Oc1cc[nH+]cc1 ZINC000192588815 336164916 /nfs/dbraw/zinc/16/49/16/336164916.db2.gz NBOFEVXGXOCCMF-UHFFFAOYSA-N 1 2 320.348 4.140 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCc1csc2ccccc12 ZINC000351922827 336178953 /nfs/dbraw/zinc/17/89/53/336178953.db2.gz KYDHMWAESDJBCP-UHFFFAOYSA-N 1 2 311.410 4.235 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000351931334 336180447 /nfs/dbraw/zinc/18/04/47/336180447.db2.gz PWXITUCBDAQWIQ-GJZGRUSLSA-N 1 2 315.804 4.029 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000351931333 336180495 /nfs/dbraw/zinc/18/04/95/336180495.db2.gz PWXITUCBDAQWIQ-CABCVRRESA-N 1 2 315.804 4.029 20 0 DIADLO Cc1oc2ccccc2c1CNC(=O)Nc1c(C)cc[nH+]c1C ZINC000351934215 336181183 /nfs/dbraw/zinc/18/11/83/336181183.db2.gz BBENOHHZMZJOOH-UHFFFAOYSA-N 1 2 309.369 4.075 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@@H]2c2nccs2)cc1C ZINC000351940227 336181793 /nfs/dbraw/zinc/18/17/93/336181793.db2.gz AFTUKEGYNJWNNI-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@@H]2c2nccs2)cc1C ZINC000351940227 336181794 /nfs/dbraw/zinc/18/17/94/336181794.db2.gz AFTUKEGYNJWNNI-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)Cc1cc2ccccc2o1 ZINC000351944362 336182002 /nfs/dbraw/zinc/18/20/02/336182002.db2.gz SIVDNECZKKNHNU-UHFFFAOYSA-N 1 2 309.369 4.109 20 0 DIADLO Cc1ccccc1[C@@H](CC(C)C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000351956297 336182655 /nfs/dbraw/zinc/18/26/55/336182655.db2.gz NGJKCRMBWXSEOX-GOSISDBHSA-N 1 2 321.424 4.160 20 0 DIADLO Cc1ccccc1[C@H](C(C)C)N(C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000351956299 336182711 /nfs/dbraw/zinc/18/27/11/336182711.db2.gz NGTCRPAJQUEZMB-IBGZPJMESA-N 1 2 321.424 4.112 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ncc(Cl)s2)s1 ZINC000351989538 336186414 /nfs/dbraw/zinc/18/64/14/336186414.db2.gz UQDYOHZXZFAUFR-MRVPVSSYSA-N 1 2 301.868 4.063 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ncc(Cl)s2)s1 ZINC000351989538 336186415 /nfs/dbraw/zinc/18/64/15/336186415.db2.gz UQDYOHZXZFAUFR-MRVPVSSYSA-N 1 2 301.868 4.063 20 0 DIADLO Clc1cnc(C[N@H+](C2CC2)[C@H]2CCc3ccccc32)s1 ZINC000351989987 336186542 /nfs/dbraw/zinc/18/65/42/336186542.db2.gz XIYWOBXSEHEZJV-AWEZNQCLSA-N 1 2 304.846 4.448 20 0 DIADLO Clc1cnc(C[N@@H+](C2CC2)[C@H]2CCc3ccccc32)s1 ZINC000351989987 336186544 /nfs/dbraw/zinc/18/65/44/336186544.db2.gz XIYWOBXSEHEZJV-AWEZNQCLSA-N 1 2 304.846 4.448 20 0 DIADLO CN(C)c1cccc([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)c1 ZINC000351998250 336187241 /nfs/dbraw/zinc/18/72/41/336187241.db2.gz YXDTYLNTCBXXPK-AWEZNQCLSA-N 1 2 321.877 4.200 20 0 DIADLO CN(C)c1cccc([C@@H]2CCC[N@H+]2Cc2ncc(Cl)s2)c1 ZINC000351998250 336187242 /nfs/dbraw/zinc/18/72/42/336187242.db2.gz YXDTYLNTCBXXPK-AWEZNQCLSA-N 1 2 321.877 4.200 20 0 DIADLO Cc1csc([C@H]2CCCC[N@@H+]2Cc2cc(O)cc(F)c2)n1 ZINC000352001443 336187472 /nfs/dbraw/zinc/18/74/72/336187472.db2.gz GBIOTCLVZGVVLV-OAHLLOKOSA-N 1 2 306.406 4.023 20 0 DIADLO Cc1csc([C@H]2CCCC[N@H+]2Cc2cc(O)cc(F)c2)n1 ZINC000352001443 336187473 /nfs/dbraw/zinc/18/74/73/336187473.db2.gz GBIOTCLVZGVVLV-OAHLLOKOSA-N 1 2 306.406 4.023 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1ncc(Cl)s1)CCC2 ZINC000352002582 336187944 /nfs/dbraw/zinc/18/79/44/336187944.db2.gz MHZRGJDTLSXYSF-JTQLQIEISA-N 1 2 313.879 4.071 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ncc(Cl)s1)CCC2 ZINC000352002582 336187946 /nfs/dbraw/zinc/18/79/46/336187946.db2.gz MHZRGJDTLSXYSF-JTQLQIEISA-N 1 2 313.879 4.071 20 0 DIADLO Cc1nc([C@@H](C)[NH+]2CCC([C@H](F)c3ccccc3F)CC2)no1 ZINC000352093967 336194524 /nfs/dbraw/zinc/19/45/24/336194524.db2.gz VUWDEEINEJGSEX-BZNIZROVSA-N 1 2 321.371 4.001 20 0 DIADLO Cc1ccc2c(c1)[C@H](NC(=O)Nc1c(C)cc[nH+]c1C)CCC2 ZINC000333166406 336199205 /nfs/dbraw/zinc/19/92/05/336199205.db2.gz IINROXODCDNQRY-QGZVFWFLSA-N 1 2 309.413 4.206 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2cnc(-c3ccsc3)s2)s1 ZINC000352286141 336210253 /nfs/dbraw/zinc/21/02/53/336210253.db2.gz ITFDKTOBFNWBHF-UHFFFAOYSA-N 1 2 321.496 4.269 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2cnc(-c3ccsc3)s2)s1 ZINC000352286141 336210254 /nfs/dbraw/zinc/21/02/54/336210254.db2.gz ITFDKTOBFNWBHF-UHFFFAOYSA-N 1 2 321.496 4.269 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+](C)Cc3cnc(C)s3)s2)o1 ZINC000352301115 336210946 /nfs/dbraw/zinc/21/09/46/336210946.db2.gz CFBANFXDLCJZRA-UHFFFAOYSA-N 1 2 319.455 4.108 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+](C)Cc3cnc(C)s3)s2)o1 ZINC000352301115 336210947 /nfs/dbraw/zinc/21/09/47/336210947.db2.gz CFBANFXDLCJZRA-UHFFFAOYSA-N 1 2 319.455 4.108 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)cs1 ZINC000352431637 336218182 /nfs/dbraw/zinc/21/81/82/336218182.db2.gz MLVVLKHWPKGFNM-NVXWUHKLSA-N 1 2 320.502 4.019 20 0 DIADLO CCCCc1nc(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)cs1 ZINC000352431637 336218183 /nfs/dbraw/zinc/21/81/83/336218183.db2.gz MLVVLKHWPKGFNM-NVXWUHKLSA-N 1 2 320.502 4.019 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)cs1 ZINC000352431638 336218257 /nfs/dbraw/zinc/21/82/57/336218257.db2.gz MLVVLKHWPKGFNM-RDJZCZTQSA-N 1 2 320.502 4.019 20 0 DIADLO CCCCc1nc(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)cs1 ZINC000352431638 336218258 /nfs/dbraw/zinc/21/82/58/336218258.db2.gz MLVVLKHWPKGFNM-RDJZCZTQSA-N 1 2 320.502 4.019 20 0 DIADLO Fc1ccc(C[N@@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c(Cl)c1 ZINC000352437896 336218630 /nfs/dbraw/zinc/21/86/30/336218630.db2.gz DWGVFMMXZPNLLS-JKSUJKDBSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c(Cl)c1 ZINC000352437896 336218631 /nfs/dbraw/zinc/21/86/31/336218631.db2.gz DWGVFMMXZPNLLS-JKSUJKDBSA-N 1 2 309.812 4.013 20 0 DIADLO Clc1cnc(C[NH2+][C@@H]2CCc3sc(Cl)cc32)s1 ZINC000352473637 336221032 /nfs/dbraw/zinc/22/10/32/336221032.db2.gz WLNDAOIMRATEOM-SSDOTTSWSA-N 1 2 305.255 4.289 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1ccccc1F ZINC000352555770 336224471 /nfs/dbraw/zinc/22/44/71/336224471.db2.gz RBTSAYGDCNXPNO-LJQANCHMSA-N 1 2 309.388 4.252 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cc(-c3ccco3)on2)ccc1F ZINC000352673551 336229707 /nfs/dbraw/zinc/22/97/07/336229707.db2.gz NZPKIYKYQCQOGL-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cc(-c3ccco3)on2)ccc1F ZINC000352673551 336229708 /nfs/dbraw/zinc/22/97/08/336229708.db2.gz NZPKIYKYQCQOGL-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO O=C(Nc1csc2ccccc12)c1ccc(-n2cc[nH+]c2)cc1 ZINC000352714003 336231927 /nfs/dbraw/zinc/23/19/27/336231927.db2.gz QLONLKRORPCCSG-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO O=C(Nc1csc2ccccc12)c1cccc(-n2cc[nH+]c2)c1 ZINC000352719128 336232214 /nfs/dbraw/zinc/23/22/14/336232214.db2.gz ZFYJEJKDDFAVDN-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)s1 ZINC000352721096 336232265 /nfs/dbraw/zinc/23/22/65/336232265.db2.gz ZFADSFOFVQHXGZ-PBHICJAKSA-N 1 2 316.470 4.229 20 0 DIADLO CC(C)c1ncc(C[N@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)s1 ZINC000352721096 336232266 /nfs/dbraw/zinc/23/22/66/336232266.db2.gz ZFADSFOFVQHXGZ-PBHICJAKSA-N 1 2 316.470 4.229 20 0 DIADLO Cc1cccc(CNC(=O)c2cccc(Oc3cc[nH+]cc3)c2)c1 ZINC000352764966 336233614 /nfs/dbraw/zinc/23/36/14/336233614.db2.gz ZVUCDOMPNBFYJE-UHFFFAOYSA-N 1 2 318.376 4.112 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2OC)cn1 ZINC000352747680 336234606 /nfs/dbraw/zinc/23/46/06/336234606.db2.gz FZFFLGYHIJKBGV-HXUWFJFHSA-N 1 2 322.408 4.125 20 0 DIADLO Fc1cccc(F)c1C[NH2+]Cc1ccccc1Br ZINC000042419162 336240145 /nfs/dbraw/zinc/24/01/45/336240145.db2.gz NTHIZPIAEZGYCI-UHFFFAOYSA-N 1 2 312.157 4.017 20 0 DIADLO CCCOc1cccc(C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)c1 ZINC000103963744 336243160 /nfs/dbraw/zinc/24/31/60/336243160.db2.gz QVDZDBOITDAMJS-UHFFFAOYSA-N 1 2 321.380 4.118 20 0 DIADLO Cc1ncccc1C[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000532359263 336243215 /nfs/dbraw/zinc/24/32/15/336243215.db2.gz OUDBOBKYINKCOC-UHFFFAOYSA-N 1 2 307.224 4.476 20 0 DIADLO CC[C@@H](Cc1ccccc1)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000532440666 336247297 /nfs/dbraw/zinc/24/72/97/336247297.db2.gz XJUWJRLBPWIJEM-HNNXBMFYSA-N 1 2 307.397 4.079 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2nccs2)c2ccc(C)cc2)cc1 ZINC000532610360 336257478 /nfs/dbraw/zinc/25/74/78/336257478.db2.gz PCPGZAZSJSPFNG-LJQANCHMSA-N 1 2 324.449 4.339 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc(N3CCCC3)[nH+]c2)cc1F ZINC000192751795 336260616 /nfs/dbraw/zinc/26/06/16/336260616.db2.gz VIANHWMKIFNXMR-CYBMUJFWSA-N 1 2 315.392 4.003 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3cc(-c4cccs4)on3)CC2)cc1 ZINC000532723166 336268434 /nfs/dbraw/zinc/26/84/34/336268434.db2.gz ZITOGIVYWPGZFM-UHFFFAOYSA-N 1 2 314.385 4.321 20 0 DIADLO Cc1cc(C)cc(CCC(=O)Nc2ccccc2-n2cc[nH+]c2)c1 ZINC000532768888 336270242 /nfs/dbraw/zinc/27/02/42/336270242.db2.gz HWNMVGCCQSQFAK-UHFFFAOYSA-N 1 2 319.408 4.060 20 0 DIADLO C[C@@H]1C[C@@H](C)N1C(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000526933484 336275457 /nfs/dbraw/zinc/27/54/57/336275457.db2.gz KSASJZOGDWVJTI-VXGBXAGGSA-N 1 2 316.788 4.150 20 0 DIADLO CC(=O)Nc1ccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000192899251 336282503 /nfs/dbraw/zinc/28/25/03/336282503.db2.gz HIOBWEUXLYXDNN-CQSZACIVSA-N 1 2 320.396 4.004 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1CN(CC1CC1)c1ccccc1 ZINC000527075812 336282911 /nfs/dbraw/zinc/28/29/11/336282911.db2.gz AYPUCUDCBSXAFM-UHFFFAOYSA-N 1 2 317.436 4.348 20 0 DIADLO COc1ccccc1Oc1ccc(CNc2cccc[nH+]2)cc1 ZINC000019778114 336283484 /nfs/dbraw/zinc/28/34/84/336283484.db2.gz AMSWKLIFLHZEFJ-UHFFFAOYSA-N 1 2 306.365 4.495 20 0 DIADLO CCn1c[nH+]cc1CNc1cc(Cl)ccc1OC1CCCC1 ZINC000417992170 336285022 /nfs/dbraw/zinc/28/50/22/336285022.db2.gz MAWUMVMNKWPTAE-UHFFFAOYSA-N 1 2 319.836 4.490 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCNc1ccc2ccccc2n1 ZINC000301056377 336287601 /nfs/dbraw/zinc/28/76/01/336287601.db2.gz ATHPOFIXRXTLDS-UHFFFAOYSA-N 1 2 302.381 4.005 20 0 DIADLO COc1ccc([C@H](C)Nc2cc(C)[nH+]c(C(C)C)n2)cc1F ZINC000301080126 336288882 /nfs/dbraw/zinc/28/88/82/336288882.db2.gz SSCAVWSZMFTMAD-LBPRGKRZSA-N 1 2 303.381 4.229 20 0 DIADLO COc1ccc(OC)c([C@@H](C)Nc2cc(C)[nH+]c(C(C)C)n2)c1 ZINC000301083802 336288992 /nfs/dbraw/zinc/28/89/92/336288992.db2.gz VGSWVXYGZGYPGB-CYBMUJFWSA-N 1 2 315.417 4.099 20 0 DIADLO Cc1cc(NCc2ccccc2Cl)nc(-c2cccnc2)[nH+]1 ZINC000301084309 336289146 /nfs/dbraw/zinc/28/91/46/336289146.db2.gz KZVLCLKROJWRMY-UHFFFAOYSA-N 1 2 310.788 4.113 20 0 DIADLO COc1ccc(OC)c([C@H](C)Nc2ccc3ccccc3[nH+]2)c1 ZINC000301087827 336289311 /nfs/dbraw/zinc/28/93/11/336289311.db2.gz YKFRSPFRNPLQTG-ZDUSSCGKSA-N 1 2 308.381 4.425 20 0 DIADLO c1ccc(C2(CNc3ccc4ccccc4[nH+]3)CCOCC2)cc1 ZINC000301092820 336289646 /nfs/dbraw/zinc/28/96/46/336289646.db2.gz PMKGGJUSAVRRKQ-UHFFFAOYSA-N 1 2 318.420 4.395 20 0 DIADLO Cc1cc(N[C@@H](C)Cc2ccccc2F)nc(-c2cccnc2)[nH+]1 ZINC000301099317 336289941 /nfs/dbraw/zinc/28/99/41/336289941.db2.gz QLDCOXKNGOBITD-ZDUSSCGKSA-N 1 2 322.387 4.029 20 0 DIADLO c1cn(Cc2cccc(CNc3ccc4ccccc4n3)c2)c[nH+]1 ZINC000301121629 336291014 /nfs/dbraw/zinc/29/10/14/336291014.db2.gz SQYQQBQFKHDTMY-UHFFFAOYSA-N 1 2 314.392 4.092 20 0 DIADLO Cc1[nH+]c(-c2ccncc2)nc(NCc2ccccc2Cl)c1C ZINC000301154846 336292289 /nfs/dbraw/zinc/29/22/89/336292289.db2.gz COYVFNONYDGZKP-UHFFFAOYSA-N 1 2 324.815 4.421 20 0 DIADLO CCc1cc(NCc2ccccc2Cl)nc(-c2ccncc2)[nH+]1 ZINC000301172297 336293203 /nfs/dbraw/zinc/29/32/03/336293203.db2.gz KIQGBOQAYMISDU-UHFFFAOYSA-N 1 2 324.815 4.367 20 0 DIADLO CCc1cc(N[C@H](C)c2cc(C)oc2C)nc(-c2ccncc2)[nH+]1 ZINC000301178726 336293597 /nfs/dbraw/zinc/29/35/97/336293597.db2.gz OFFMKXBWJXXMCX-CYBMUJFWSA-N 1 2 322.412 4.484 20 0 DIADLO CCc1cc(N2CCC[C@@H]2CC(C)C)nc(-c2ccncc2)[nH+]1 ZINC000301187811 336293941 /nfs/dbraw/zinc/29/39/41/336293941.db2.gz WMFFYFXBPXIPCD-QGZVFWFLSA-N 1 2 310.445 4.116 20 0 DIADLO COc1ccc([C@H](Nc2cc(C)[nH+]cn2)c2ccc(F)cc2)cc1 ZINC000301221700 336295416 /nfs/dbraw/zinc/29/54/16/336295416.db2.gz ARYCENVGLIPQNY-LJQANCHMSA-N 1 2 323.371 4.134 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@@H](C)Nc1cc(C)[nH+]cn1 ZINC000301221403 336295433 /nfs/dbraw/zinc/29/54/33/336295433.db2.gz AMNLRHXTBSMYON-GFCCVEGCSA-N 1 2 310.426 4.390 20 0 DIADLO C[C@H](Nc1cc(N2CCCCC2)nc[nH+]1)c1cc2ccccc2o1 ZINC000301225586 336295687 /nfs/dbraw/zinc/29/56/87/336295687.db2.gz DJGYCXRDXSKKOY-AWEZNQCLSA-N 1 2 322.412 4.386 20 0 DIADLO C[C@H](Nc1cc(N2CCCCC2)[nH+]cn1)c1cc2ccccc2o1 ZINC000301225586 336295688 /nfs/dbraw/zinc/29/56/88/336295688.db2.gz DJGYCXRDXSKKOY-AWEZNQCLSA-N 1 2 322.412 4.386 20 0 DIADLO Cc1cc(N[C@@H]2c3ccccc3C[C@@H]2C)nc(-c2cccnc2)[nH+]1 ZINC000301266789 336297778 /nfs/dbraw/zinc/29/77/78/336297778.db2.gz WQBMSIJABHNUTN-DJJJIMSYSA-N 1 2 316.408 4.192 20 0 DIADLO Cc1ccc(CCNc2ncc(C(F)(F)F)cc2Cl)c[nH+]1 ZINC000301271556 336298007 /nfs/dbraw/zinc/29/80/07/336298007.db2.gz XYUUJDDVWLNVGD-UHFFFAOYSA-N 1 2 315.726 4.112 20 0 DIADLO Cc1cc(CNc2nc(-c3ccncc3)[nH+]c(C)c2C)ccc1F ZINC000301284313 336298805 /nfs/dbraw/zinc/29/88/05/336298805.db2.gz QYQXXLBCOBVXRW-UHFFFAOYSA-N 1 2 322.387 4.215 20 0 DIADLO CO[C@H](c1ccc(Cl)cc1)[C@@H](C)Nc1cc[nH+]c(C2CC2)n1 ZINC000301295145 336299433 /nfs/dbraw/zinc/29/94/33/336299433.db2.gz WYEWPBACQWBXQP-BZNIZROVSA-N 1 2 317.820 4.196 20 0 DIADLO CO[C@H](c1ccc(Cl)cc1)[C@H](C)Nc1cc[nH+]c(C2CC2)n1 ZINC000301295149 336299435 /nfs/dbraw/zinc/29/94/35/336299435.db2.gz WYEWPBACQWBXQP-ZBEGNZNMSA-N 1 2 317.820 4.196 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CCN2c2cc[nH+]c(C3CC3)n2)o1 ZINC000301425768 336305890 /nfs/dbraw/zinc/30/58/90/336305890.db2.gz GQUORVALQCPIJG-CJNGLKHVSA-N 1 2 311.429 4.487 20 0 DIADLO C[C@@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1ccc2c(c1)OCO2 ZINC000301502195 336310809 /nfs/dbraw/zinc/31/08/09/336310809.db2.gz BIKRAFUNFGCRPP-SECBINFHSA-N 1 2 310.275 4.002 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCNc1ncc(Cl)cc1F ZINC000301518696 336312002 /nfs/dbraw/zinc/31/20/02/336312002.db2.gz DNYLSRGWGQZWRG-UHFFFAOYSA-N 1 2 318.783 4.034 20 0 DIADLO FC(F)Oc1cccc(CNc2cc(C(F)(F)F)cc[nH+]2)c1 ZINC000301520189 336312122 /nfs/dbraw/zinc/31/21/22/336312122.db2.gz MXKGDMZHRPFITP-UHFFFAOYSA-N 1 2 318.245 4.314 20 0 DIADLO CC[C@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1nc2ccccc2[nH]1 ZINC000301521721 336312178 /nfs/dbraw/zinc/31/21/78/336312178.db2.gz LPMBMYSZCQVSFW-LBPRGKRZSA-N 1 2 309.417 4.214 20 0 DIADLO CC(C)(C)c1nc(NCc2ncc(-c3ccccc3)o2)cc[nH+]1 ZINC000301533841 336312951 /nfs/dbraw/zinc/31/29/51/336312951.db2.gz QFKVPUGRUDSHKB-UHFFFAOYSA-N 1 2 308.385 4.041 20 0 DIADLO Cn1c2ccccc2[nH+]c1CCCNc1ccc2ccccc2n1 ZINC000301541515 336313495 /nfs/dbraw/zinc/31/34/95/336313495.db2.gz CDAVWDNWFVHPGN-UHFFFAOYSA-N 1 2 316.408 4.166 20 0 DIADLO COc1ccc2c(c1)CN(c1[nH+]c3ccccc3cc1C)CC2 ZINC000301551058 336314293 /nfs/dbraw/zinc/31/42/93/336314293.db2.gz GZAVORVBQQXPNT-UHFFFAOYSA-N 1 2 304.393 4.115 20 0 DIADLO CC(C)[C@@H](CNc1cc(C(F)(F)F)cc[nH+]1)c1cccnc1 ZINC000301553964 336314427 /nfs/dbraw/zinc/31/44/27/336314427.db2.gz GTJJVOVBXDUCKU-CQSZACIVSA-N 1 2 309.335 4.347 20 0 DIADLO CC(C)(C)c1nc(NCc2cccc(OCC(F)F)c2)cc[nH+]1 ZINC000301555235 336314522 /nfs/dbraw/zinc/31/45/22/336314522.db2.gz WJQAWNMBANGSJA-UHFFFAOYSA-N 1 2 321.371 4.030 20 0 DIADLO c1ccc(COC[C@H](Nc2cccc[nH+]2)c2ccccc2)cc1 ZINC000301557025 336314703 /nfs/dbraw/zinc/31/47/03/336314703.db2.gz HVCBQCANAZIJAF-IBGZPJMESA-N 1 2 304.393 4.452 20 0 DIADLO CC[C@H](Nc1cc(C)[nH+]c(-c2ccncc2)n1)c1cccs1 ZINC000301597093 336317197 /nfs/dbraw/zinc/31/71/97/336317197.db2.gz ZPGKFUZGUALPSI-AWEZNQCLSA-N 1 2 310.426 4.472 20 0 DIADLO Cc1cc(N[C@@H](c2cccc(Cl)c2)c2ccccn2)nc[nH+]1 ZINC000301642849 336320187 /nfs/dbraw/zinc/32/01/87/336320187.db2.gz HAOWSOCWMKRLLR-KRWDZBQOSA-N 1 2 310.788 4.035 20 0 DIADLO Cc1cc(N2CCC(OCC(C)C)CC2)c2cccc(F)c2[nH+]1 ZINC000301643730 336320221 /nfs/dbraw/zinc/32/02/21/336320221.db2.gz CDFUMKJCFIUYSA-UHFFFAOYSA-N 1 2 316.420 4.324 20 0 DIADLO Cc1nc(CN(C)c2cc(C)[nH+]c3c(F)cccc23)cs1 ZINC000301645147 336320417 /nfs/dbraw/zinc/32/04/17/336320417.db2.gz CQZXQVLIXBTUCM-UHFFFAOYSA-N 1 2 301.390 4.084 20 0 DIADLO Cc1cc(NC[C@H](CCO)c2ccccc2)c2cccc(F)c2[nH+]1 ZINC000301668598 336322202 /nfs/dbraw/zinc/32/22/02/336322202.db2.gz MPWSZSUDKSPYCO-INIZCTEOSA-N 1 2 324.399 4.260 20 0 DIADLO FC(F)(F)c1ccccc1C1=CCN(c2cccc[nH+]2)CC1 ZINC000301669258 336322256 /nfs/dbraw/zinc/32/22/56/336322256.db2.gz NDBARXAALWWIIP-UHFFFAOYSA-N 1 2 304.315 4.394 20 0 DIADLO Clc1cc(Cl)c2c(c1)CN(c1cc[nH+]c(C3CC3)n1)CC2 ZINC000301680431 336322914 /nfs/dbraw/zinc/32/29/14/336322914.db2.gz FMLGJNKPKNZVBQ-UHFFFAOYSA-N 1 2 320.223 4.224 20 0 DIADLO Cc1cc(NC[C@H](O)c2ccccc2C)c2cccc(F)c2[nH+]1 ZINC000301679637 336322993 /nfs/dbraw/zinc/32/29/93/336322993.db2.gz RLHLRKBVSHQGFN-SFHVURJKSA-N 1 2 310.372 4.136 20 0 DIADLO Cc1cc(N[C@@H](C)c2noc(-c3ccccc3)n2)nc(C(C)C)[nH+]1 ZINC000301685245 336323381 /nfs/dbraw/zinc/32/33/81/336323381.db2.gz WRNZYHVQEOSMMS-ZDUSSCGKSA-N 1 2 323.400 4.132 20 0 DIADLO COCCC1(CNc2cc(C(F)(F)F)cc[nH+]2)CCCC1 ZINC000301687921 336323500 /nfs/dbraw/zinc/32/35/00/336323500.db2.gz XMJFXVMBCWPJGU-UHFFFAOYSA-N 1 2 302.340 4.109 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCO[C@H](c2cccc(F)c2)C1 ZINC000301716612 336325319 /nfs/dbraw/zinc/32/53/19/336325319.db2.gz KGOMLNCXBBOERZ-IBGZPJMESA-N 1 2 322.383 4.260 20 0 DIADLO Cc1cnc(CNc2cc(C(C)(C)C)[nH+]c(C(C)(C)C)n2)s1 ZINC000301738059 336326641 /nfs/dbraw/zinc/32/66/41/336326641.db2.gz CIMDLFRUUSGSPB-UHFFFAOYSA-N 1 2 318.490 4.449 20 0 DIADLO CCc1nn(C)c(CC)c1CNc1[nH+]c2ccccc2cc1C ZINC000301814911 336331964 /nfs/dbraw/zinc/33/19/64/336331964.db2.gz CWDXINHCHMVDOY-UHFFFAOYSA-N 1 2 308.429 4.014 20 0 DIADLO Cc1ccc([C@@H]2CCCN2c2cc(NCC3CC3)[nH+]cn2)s1 ZINC000301820150 336332298 /nfs/dbraw/zinc/33/22/98/336332298.db2.gz JFAUXSYRLJLBEQ-AWEZNQCLSA-N 1 2 314.458 4.010 20 0 DIADLO Cc1ccc([C@@H]2CCCN2c2cc(NCC3CC3)nc[nH+]2)s1 ZINC000301820150 336332299 /nfs/dbraw/zinc/33/22/99/336332299.db2.gz JFAUXSYRLJLBEQ-AWEZNQCLSA-N 1 2 314.458 4.010 20 0 DIADLO CCn1c[nH+]cc1CNc1ccccc1COC(C)(C)CC ZINC000418009749 336333888 /nfs/dbraw/zinc/33/38/88/336333888.db2.gz SDVAJOJQNTZCET-UHFFFAOYSA-N 1 2 301.434 4.220 20 0 DIADLO COC[C@H](Nc1cc(C(C)C)[nH+]c(C(C)C)n1)c1ccc(C)o1 ZINC000301850228 336333984 /nfs/dbraw/zinc/33/39/84/336333984.db2.gz DYLZPQPCFUXNGD-HNNXBMFYSA-N 1 2 317.433 4.424 20 0 DIADLO C[C@@H](CCc1ccccc1)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC000301851320 336334177 /nfs/dbraw/zinc/33/41/77/336334177.db2.gz XABCVUOPNUZVTE-AWEZNQCLSA-N 1 2 323.444 4.015 20 0 DIADLO Cc1ccccc1CSc1[nH+]cnc2c1cnn2C(C)(C)C ZINC000301852503 336334246 /nfs/dbraw/zinc/33/42/46/336334246.db2.gz AYMPWWVIBPNTNH-UHFFFAOYSA-N 1 2 312.442 4.182 20 0 DIADLO Cc1cc(N[C@@H](C)C[C@H](O)c2ccco2)c2cccc(F)c2[nH+]1 ZINC000301892284 336336494 /nfs/dbraw/zinc/33/64/94/336336494.db2.gz MGTDVFGFLQSTQH-LRDDRELGSA-N 1 2 314.360 4.199 20 0 DIADLO Cc1cc(N[C@H](C)C[C@@H](O)c2ccco2)c2cccc(F)c2[nH+]1 ZINC000301892287 336336629 /nfs/dbraw/zinc/33/66/29/336336629.db2.gz MGTDVFGFLQSTQH-MLGOLLRUSA-N 1 2 314.360 4.199 20 0 DIADLO CCOc1ccc(C2=CCN(c3nc(C)[nH+]c(C)c3C)CC2)cc1 ZINC000301910116 336337661 /nfs/dbraw/zinc/33/76/61/336337661.db2.gz BNXWDCHTAZEUBL-UHFFFAOYSA-N 1 2 323.440 4.094 20 0 DIADLO CC(C)c1cc(N2CCC[C@H]2c2ccncc2)nc(C(C)C)[nH+]1 ZINC000301918367 336338085 /nfs/dbraw/zinc/33/80/85/336338085.db2.gz JVLRKSVGPITTRL-KRWDZBQOSA-N 1 2 310.445 4.460 20 0 DIADLO Cc1cc(N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)nc[nH+]1 ZINC000301921179 336338181 /nfs/dbraw/zinc/33/81/81/336338181.db2.gz DMBUUJLYDAGULX-OAHLLOKOSA-N 1 2 307.319 4.367 20 0 DIADLO COC[C@H](Nc1ccc2ccccc2[nH+]1)c1ccc(F)c(F)c1 ZINC000301994036 336342131 /nfs/dbraw/zinc/34/21/31/336342131.db2.gz RKWIMQYVZGJUCU-KRWDZBQOSA-N 1 2 314.335 4.313 20 0 DIADLO CCc1cc(N2CC[C@@]3(CC[C@@H](C)C3)C2)nc(-c2ccncc2)[nH+]1 ZINC000302033324 336344452 /nfs/dbraw/zinc/34/44/52/336344452.db2.gz DBBVLOLNIWWRKJ-FOIQADDNSA-N 1 2 322.456 4.118 20 0 DIADLO CCc1cc(N2CC[C@]3(CC[C@@H](C)C3)C2)nc(-c2ccncc2)[nH+]1 ZINC000302033326 336344489 /nfs/dbraw/zinc/34/44/89/336344489.db2.gz DBBVLOLNIWWRKJ-QRWLVFNGSA-N 1 2 322.456 4.118 20 0 DIADLO CC(=O)c1ccc(CNc2cc(C)[nH+]c3c(F)cccc23)nc1C ZINC000302057673 336346111 /nfs/dbraw/zinc/34/61/11/336346111.db2.gz QXUQTXLENWCJBS-UHFFFAOYSA-N 1 2 323.371 4.200 20 0 DIADLO CCC(CC)[C@@H]1C[C@@H](Nc2cc(C(F)(F)F)cc[nH+]2)CCO1 ZINC000302081864 336347593 /nfs/dbraw/zinc/34/75/93/336347593.db2.gz YDCWSDMNGNODFR-KBPBESRZSA-N 1 2 316.367 4.496 20 0 DIADLO CCn1c2ccccc2nc1[C@@H](C)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000302368492 336357712 /nfs/dbraw/zinc/35/77/12/336357712.db2.gz GFQVFWOYOGFOMG-CYBMUJFWSA-N 1 2 323.444 4.317 20 0 DIADLO CC[C@H](Nc1cc(C)[nH+]cn1)c1cc(F)cc(Br)c1 ZINC000302437462 336358843 /nfs/dbraw/zinc/35/88/43/336358843.db2.gz LSVSABAGQZKWDR-ZDUSSCGKSA-N 1 2 324.197 4.250 20 0 DIADLO CCn1c2ccccc2nc1[C@@H](C)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000302487047 336359820 /nfs/dbraw/zinc/35/98/20/336359820.db2.gz ZCMKOOVNYOOTSF-CQSZACIVSA-N 1 2 323.444 4.451 20 0 DIADLO CCCO[C@@H]1CCCN(c2cc[nH+]c3c(OC)cccc23)CC1 ZINC000302499720 336360175 /nfs/dbraw/zinc/36/01/75/336360175.db2.gz CKUISYYDOXXMFE-OAHLLOKOSA-N 1 2 314.429 4.029 20 0 DIADLO Fc1cccc2c1OCC[C@@H]2Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000302519158 336360720 /nfs/dbraw/zinc/36/07/20/336360720.db2.gz APLPYZWJOBCINL-LBPRGKRZSA-N 1 2 312.266 4.175 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H](C)c2c(F)cccc2Cl)c(C)[nH+]1 ZINC000152433006 336362395 /nfs/dbraw/zinc/36/23/95/336362395.db2.gz ILCWRQVOEJAEGV-NSHDSACASA-N 1 2 321.783 4.374 20 0 DIADLO CC(C)c1nc(N[C@H](CO)c2ccsc2)cc(C(C)(C)C)[nH+]1 ZINC000302843960 336371804 /nfs/dbraw/zinc/37/18/04/336371804.db2.gz NDNVQGYBJHZZMT-CYBMUJFWSA-N 1 2 319.474 4.105 20 0 DIADLO CC(C)c1nc(NCc2cccc(CO)c2)cc(C(C)(C)C)[nH+]1 ZINC000302875240 336372803 /nfs/dbraw/zinc/37/28/03/336372803.db2.gz DXNFFCAJLSVOIR-UHFFFAOYSA-N 1 2 313.445 4.002 20 0 DIADLO CC(C)c1nc(NCCc2cscn2)cc(C(C)(C)C)[nH+]1 ZINC000302883553 336373062 /nfs/dbraw/zinc/37/30/62/336373062.db2.gz JORCEGPYVDSGIP-UHFFFAOYSA-N 1 2 304.463 4.009 20 0 DIADLO CC(C)c1nc(N(C)[C@H](C)c2ccccn2)cc(C(C)(C)C)[nH+]1 ZINC000302887473 336373242 /nfs/dbraw/zinc/37/32/42/336373242.db2.gz MCIBCEQLESCGJL-CQSZACIVSA-N 1 2 312.461 4.490 20 0 DIADLO CC(C)Sc1ccc([C@H](C)Nc2nc[nH+]c(N)c2Cl)cc1 ZINC000302917934 336374319 /nfs/dbraw/zinc/37/43/19/336374319.db2.gz XLWVXGWFPZGWGA-JTQLQIEISA-N 1 2 322.865 4.386 20 0 DIADLO CC(C)Sc1ccc([C@H](C)Nc2[nH+]cnc(N)c2Cl)cc1 ZINC000302917934 336374320 /nfs/dbraw/zinc/37/43/20/336374320.db2.gz XLWVXGWFPZGWGA-JTQLQIEISA-N 1 2 322.865 4.386 20 0 DIADLO Cc1ccccc1CNC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000352903631 336375586 /nfs/dbraw/zinc/37/55/86/336375586.db2.gz PRNIWAFOTDSZSJ-UHFFFAOYSA-N 1 2 318.376 4.112 20 0 DIADLO CCCN(CC1CC1)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000352909292 336376414 /nfs/dbraw/zinc/37/64/14/336376414.db2.gz LGKJRONDLXFZEZ-UHFFFAOYSA-N 1 2 310.397 4.136 20 0 DIADLO CC[C@@H](C)c1nnc([C@H](C)[NH2+]Cc2ccc(C)cc2Cl)[nH]1 ZINC000514609237 336386139 /nfs/dbraw/zinc/38/61/39/336386139.db2.gz OKOZXQXXKHYIBY-NEPJUHHUSA-N 1 2 306.841 4.131 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC2(Cc3ccccc3)CC2)c(C)[nH+]1 ZINC000563938259 336387414 /nfs/dbraw/zinc/38/74/14/336387414.db2.gz GESDMMDOLMGALO-UHFFFAOYSA-N 1 2 323.440 4.151 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2sc(Br)cc21)C(C)(F)F ZINC000389437720 336390901 /nfs/dbraw/zinc/39/09/01/336390901.db2.gz FFSGWZYVVPGSSG-POYBYMJQSA-N 1 2 310.207 4.131 20 0 DIADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1ccc(OC(F)F)cc1 ZINC000110127757 336395961 /nfs/dbraw/zinc/39/59/61/336395961.db2.gz BQZVNBGZBGHOMY-SNVBAGLBSA-N 1 2 305.328 4.129 20 0 DIADLO CCn1c2ccccc2nc1[C@H](C)Nc1cc[nH+]c(C(C)C)n1 ZINC000110334121 336396200 /nfs/dbraw/zinc/39/62/00/336396200.db2.gz ZHZYGXOBDCGNJI-ZDUSSCGKSA-N 1 2 309.417 4.143 20 0 DIADLO CC(C)(C)OCc1cccc(CNc2cc[nH+]c(C3CC3)n2)c1 ZINC000110481122 336396686 /nfs/dbraw/zinc/39/66/86/336396686.db2.gz QLIHQFHSTWGCQX-UHFFFAOYSA-N 1 2 311.429 4.281 20 0 DIADLO CCn1cncc1C[N@@H+](Cc1ccc(F)cc1Cl)CC1CC1 ZINC000418042146 336397914 /nfs/dbraw/zinc/39/79/14/336397914.db2.gz BGORBDUIIQDSKB-UHFFFAOYSA-N 1 2 321.827 4.108 20 0 DIADLO CCn1cncc1C[N@H+](Cc1ccc(F)cc1Cl)CC1CC1 ZINC000418042146 336397915 /nfs/dbraw/zinc/39/79/15/336397915.db2.gz BGORBDUIIQDSKB-UHFFFAOYSA-N 1 2 321.827 4.108 20 0 DIADLO CCn1c[nH+]cc1CN(Cc1ccc(F)cc1Cl)CC1CC1 ZINC000418042146 336397916 /nfs/dbraw/zinc/39/79/16/336397916.db2.gz BGORBDUIIQDSKB-UHFFFAOYSA-N 1 2 321.827 4.108 20 0 DIADLO CCOc1cccc(CNc2ccc(C)[nH+]c2C)c1OC(F)F ZINC000353222902 336407029 /nfs/dbraw/zinc/40/70/29/336407029.db2.gz RNCPVQMDQUTWMW-UHFFFAOYSA-N 1 2 322.355 4.311 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1nnc(C(C)C)s1 ZINC000353740737 336437373 /nfs/dbraw/zinc/43/73/73/336437373.db2.gz RSPIXKLSUQILGP-UHFFFAOYSA-N 1 2 309.866 4.167 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc2ccccc2n1 ZINC000353934931 336450056 /nfs/dbraw/zinc/45/00/56/336450056.db2.gz RWGUPACSCYNOPL-NEPJUHHUSA-N 1 2 313.351 4.320 20 0 DIADLO C[C@@H](Nc1[nH+]ccc2ccc(F)cc21)c1nc2ccccc2[nH]1 ZINC000354340710 336467374 /nfs/dbraw/zinc/46/73/74/336467374.db2.gz QCCVFINMLDLDGO-LLVKDONJSA-N 1 2 306.344 4.423 20 0 DIADLO CC(C)(C)[C@H]1C[C@H](Nc2[nH+]ccc3ccc(F)cc32)CCO1 ZINC000354881053 336486157 /nfs/dbraw/zinc/48/61/57/336486157.db2.gz DOYANSRWCINSTD-GDBMZVCRSA-N 1 2 302.393 4.380 20 0 DIADLO Fc1cccc(F)c1CSCc1[nH+]ccn1CC(F)(F)F ZINC000355265332 336501261 /nfs/dbraw/zinc/50/12/61/336501261.db2.gz LHJIKBYXTXVIFT-UHFFFAOYSA-N 1 2 322.302 4.157 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(CNc2ccc(-n3cc[nH+]c3)c(F)c2)o1 ZINC000355494352 336511745 /nfs/dbraw/zinc/51/17/45/336511745.db2.gz UUYVBBOGBFWCHJ-WFASDCNBSA-N 1 2 311.360 4.340 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2cc3cccc(F)c3o2)c(C)s1 ZINC000355729838 336520287 /nfs/dbraw/zinc/52/02/87/336520287.db2.gz OUKUNDVFNBNOTD-VIFPVBQESA-N 1 2 304.390 4.496 20 0 DIADLO CC1CCC(c2noc(CCc3[nH]c4ccccc4[nH+]3)n2)CC1 ZINC000356214898 336541193 /nfs/dbraw/zinc/54/11/93/336541193.db2.gz IQMWGQPSWJFBDT-UHFFFAOYSA-N 1 2 310.401 4.025 20 0 DIADLO Cc1c[nH+]c(CN2CC[C@H](C)Sc3ccc(Cl)cc32)n1C ZINC000356299155 336544921 /nfs/dbraw/zinc/54/49/21/336544921.db2.gz GWUOYIFPHSGTNO-LBPRGKRZSA-N 1 2 321.877 4.273 20 0 DIADLO Fc1ccccc1-c1csc(C[NH2+]Cc2ccc(Cl)o2)n1 ZINC000356425796 336549319 /nfs/dbraw/zinc/54/93/19/336549319.db2.gz NIGLPGIDPZYHAZ-UHFFFAOYSA-N 1 2 322.792 4.485 20 0 DIADLO C[C@H](CC1CCCCC1)C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000114322301 336551829 /nfs/dbraw/zinc/55/18/29/336551829.db2.gz MDMYKAXNJCEPLP-ZBFHGGJFSA-N 1 2 303.450 4.070 20 0 DIADLO Cc1ccc(C(=O)N(C)[C@H](C)C2CCC2)cc1Oc1cc[nH+]cc1 ZINC000356567117 336554787 /nfs/dbraw/zinc/55/47/87/336554787.db2.gz QLYACDLZBGKGKJ-OAHLLOKOSA-N 1 2 324.424 4.443 20 0 DIADLO C[C@@H](NC(=O)[C@@H]1CC12CCCCC2)c1cccc(-n2cc[nH+]c2)c1 ZINC000357011163 336569938 /nfs/dbraw/zinc/56/99/38/336569938.db2.gz JFDSTSDAUPDBOQ-QAPCUYQASA-N 1 2 323.440 4.020 20 0 DIADLO COCc1cc(N2CCC[C@H](C3CC3)C2)c2cc(F)ccc2[nH+]1 ZINC000357533089 336589426 /nfs/dbraw/zinc/58/94/26/336589426.db2.gz MVLPRXZDCDQFFT-AWEZNQCLSA-N 1 2 314.404 4.147 20 0 DIADLO COCc1cc(N2CC[C@@H](C)C(F)(F)C2)c2cc(F)ccc2[nH+]1 ZINC000357659738 336593562 /nfs/dbraw/zinc/59/35/62/336593562.db2.gz JTOSHNUYZYLJIY-LLVKDONJSA-N 1 2 324.346 4.002 20 0 DIADLO FC(F)(F)COc1cc(NCc2cccc3cc[nH]c32)cc[nH+]1 ZINC000357697870 336594848 /nfs/dbraw/zinc/59/48/48/336594848.db2.gz JEQSGYOELBFUSF-UHFFFAOYSA-N 1 2 321.302 4.116 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000357786081 336598438 /nfs/dbraw/zinc/59/84/38/336598438.db2.gz VEACCKTUTFIRSY-PBHICJAKSA-N 1 2 309.438 4.287 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[S@](=O)Cc1ccc(C)[nH+]c1C ZINC000358116188 336612163 /nfs/dbraw/zinc/61/21/63/336612163.db2.gz GJROKLUOBQQIDK-VGOFRKELSA-N 1 2 323.408 4.377 20 0 DIADLO CCN(CC1CCC1)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000358174086 336615024 /nfs/dbraw/zinc/61/50/24/336615024.db2.gz VPJMUHAQLMHTEC-UHFFFAOYSA-N 1 2 310.397 4.136 20 0 DIADLO Cc1ccc(CNc2ccc(Br)c(F)c2)c(C)[nH+]1 ZINC000358217563 336617343 /nfs/dbraw/zinc/61/73/43/336617343.db2.gz YXVDYCMWPQFPPK-UHFFFAOYSA-N 1 2 309.182 4.212 20 0 DIADLO Clc1ccc(SCc2ccc(-n3cc[nH+]c3)cc2)nc1 ZINC000358365135 336626489 /nfs/dbraw/zinc/62/64/89/336626489.db2.gz GMDBXBQBEMUCFH-UHFFFAOYSA-N 1 2 301.802 4.213 20 0 DIADLO COc1c(Br)cccc1CNc1ccc(C)[nH+]c1C ZINC000358456263 336630614 /nfs/dbraw/zinc/63/06/14/336630614.db2.gz YMZMFNKFKZAMSE-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO Cc1ccc(COc2ccc3c(c2)OC(C)(C)CC3=O)c(C)[nH+]1 ZINC000358680823 336639141 /nfs/dbraw/zinc/63/91/41/336639141.db2.gz BYKKFQIOXMBDCI-UHFFFAOYSA-N 1 2 311.381 4.021 20 0 DIADLO CCc1c(C(=O)Nc2ccc(C)[nH+]c2C)cnn1C(CC)CC ZINC000358829865 336644305 /nfs/dbraw/zinc/64/43/05/336644305.db2.gz MXAGJDBYDIIPEP-UHFFFAOYSA-N 1 2 314.433 4.071 20 0 DIADLO CCn1ncnc1C[NH2+][C@H](C)c1cc2c(ccc3ccccc23)o1 ZINC000359062570 336655756 /nfs/dbraw/zinc/65/57/56/336655756.db2.gz YOEWAQYQFZRSIT-CYBMUJFWSA-N 1 2 320.396 4.048 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCS[C@@H](C)[C@@H](C)O ZINC000359170199 336661204 /nfs/dbraw/zinc/66/12/04/336661204.db2.gz CXOWXNUITOSJEI-KGLIPLIRSA-N 1 2 306.475 4.018 20 0 DIADLO Cn1c2ccc(NC(=O)[C@H]3CCC(C)(C)C3)cc2[nH+]c1C1CC1 ZINC000359426596 336672509 /nfs/dbraw/zinc/67/25/09/336672509.db2.gz VJACOWTUDBSWLV-ZDUSSCGKSA-N 1 2 311.429 4.216 20 0 DIADLO Cc1ccc(NC(=O)C2(Cc3cccc(F)c3)CCC2)c(C)[nH+]1 ZINC000359496195 336675085 /nfs/dbraw/zinc/67/50/85/336675085.db2.gz WISNPTWJWQJGMJ-UHFFFAOYSA-N 1 2 312.388 4.189 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccc(Cl)cn1 ZINC000359647038 336681625 /nfs/dbraw/zinc/68/16/25/336681625.db2.gz LIJSZZNXVQBUJN-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO CCc1c[nH+]ccc1[C@@H](C)[C@H]1CCC(=O)Nc2ccc(F)cc21 ZINC000360616432 336716238 /nfs/dbraw/zinc/71/62/38/336716238.db2.gz UPRFHMJGWJCADT-MLGOLLRUSA-N 1 2 312.388 4.403 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCOc2c(F)ccc(F)c21)c1ccc(Cl)cn1 ZINC000361182333 336742714 /nfs/dbraw/zinc/74/27/14/336742714.db2.gz YSGZYLUNHMPGQM-OTYXRUKQSA-N 1 2 324.758 4.188 20 0 DIADLO Cc1ccc(F)c(C[NH2+][C@@H]2CCOc3c(F)ccc(F)c32)c1 ZINC000361253799 336747112 /nfs/dbraw/zinc/74/71/12/336747112.db2.gz XKVMPYTWKPXHEU-OAHLLOKOSA-N 1 2 307.315 4.026 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1C[C@@H]1c1ccccc1Cl ZINC000362397895 336795685 /nfs/dbraw/zinc/79/56/85/336795685.db2.gz TWWYEKKQYQQBPA-KGLIPLIRSA-N 1 2 300.789 4.094 20 0 DIADLO Cc1ccc(C2CCN(c3nc4c(cccc4F)o3)CC2)c[nH+]1 ZINC000362651022 336807868 /nfs/dbraw/zinc/80/78/68/336807868.db2.gz ULOTVNNHUIUNNT-UHFFFAOYSA-N 1 2 311.360 4.054 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+][C@@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000367533675 336824578 /nfs/dbraw/zinc/82/45/78/336824578.db2.gz NKSMZIWSUWQHAM-YWZLYKJASA-N 1 2 321.399 4.364 20 0 DIADLO CCc1ccc(C(=O)Nc2ccccc2-c2[nH]cc(C)[nH+]2)cc1 ZINC000371248879 336898475 /nfs/dbraw/zinc/89/84/75/336898475.db2.gz XUINUHIPNYVYSG-UHFFFAOYSA-N 1 2 305.381 4.200 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H](C)c2cccs2)[nH+]1 ZINC000371247853 336898496 /nfs/dbraw/zinc/89/84/96/336898496.db2.gz RENJBZRTTKZZPV-GFCCVEGCSA-N 1 2 311.410 4.189 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000371646702 336909970 /nfs/dbraw/zinc/90/99/70/336909970.db2.gz GWOWNGNXABDKKD-CVEARBPZSA-N 1 2 305.466 4.112 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)NC12CCC(CC1)C2 ZINC000371761757 336912399 /nfs/dbraw/zinc/91/23/99/336912399.db2.gz YTYRPBQKMIRFKS-UHFFFAOYSA-N 1 2 323.396 4.328 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@@H](C)c1c(F)cccc1Cl ZINC000120838347 336923309 /nfs/dbraw/zinc/92/33/09/336923309.db2.gz MDGIRGFYUUIFLE-JTQLQIEISA-N 1 2 307.756 4.065 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@@H](C)c1cc2ccccc2o1 ZINC000121114466 336931544 /nfs/dbraw/zinc/93/15/44/336931544.db2.gz KYKLZOOLPHBODY-ZDUSSCGKSA-N 1 2 309.369 4.361 20 0 DIADLO C[C@@H]1C[C@H](CSCc2cn3cc(Cl)ccc3[nH+]2)CCO1 ZINC000485562179 336961405 /nfs/dbraw/zinc/96/14/05/336961405.db2.gz RSSUIZSRITUZSW-VXGBXAGGSA-N 1 2 310.850 4.036 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H]2CCCC(F)(F)C2)[nH+]1 ZINC000373869474 336975194 /nfs/dbraw/zinc/97/51/94/336975194.db2.gz TYUYBKGHDBLGSM-GFCCVEGCSA-N 1 2 319.355 4.149 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H]2CCCC(F)(F)C2)[nH+]1 ZINC000373869475 336975210 /nfs/dbraw/zinc/97/52/10/336975210.db2.gz TYUYBKGHDBLGSM-LBPRGKRZSA-N 1 2 319.355 4.149 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1CCC[C@@H](c2ccccc2)CC1 ZINC000121816084 336980812 /nfs/dbraw/zinc/98/08/12/336980812.db2.gz ULOPSUGNCSAXQJ-QGZVFWFLSA-N 1 2 309.413 4.192 20 0 DIADLO Cc1nnc([C@@H](C)[NH+]2CCC(c3cccc(F)c3F)CC2)s1 ZINC000374914262 336999488 /nfs/dbraw/zinc/99/94/88/336999488.db2.gz NIQGEPVSYCMITG-SNVBAGLBSA-N 1 2 323.412 4.065 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+]2CCC=C(c3ccco3)C2)cs1 ZINC000375620275 337014975 /nfs/dbraw/zinc/01/49/75/337014975.db2.gz VVSGHEJJRDXENI-ZDUSSCGKSA-N 1 2 318.442 4.123 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+]2CCC=C(c3ccco3)C2)cs1 ZINC000375620275 337014976 /nfs/dbraw/zinc/01/49/76/337014976.db2.gz VVSGHEJJRDXENI-ZDUSSCGKSA-N 1 2 318.442 4.123 20 0 DIADLO Clc1scc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)c1Cl ZINC000376113662 337027429 /nfs/dbraw/zinc/02/74/29/337027429.db2.gz LRWQNEDIDIFTGA-SECBINFHSA-N 1 2 302.230 4.115 20 0 DIADLO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1csc(C(C)C)n1)CO2 ZINC000376317649 337031355 /nfs/dbraw/zinc/03/13/55/337031355.db2.gz AFRPUXQQKKCPFO-TZMCWYRMSA-N 1 2 302.443 4.359 20 0 DIADLO O=C(c1cccc(Oc2cc[nH+]cc2)c1)N1CCC2(CCC2)CC1 ZINC000376434810 337033403 /nfs/dbraw/zinc/03/34/03/337033403.db2.gz MGBZBTCSONBCRQ-UHFFFAOYSA-N 1 2 322.408 4.280 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccccc1F)c1nccn1-c1ccccc1 ZINC000376506124 337035293 /nfs/dbraw/zinc/03/52/93/337035293.db2.gz JLWNIWILIVVYCA-HUUCEWRRSA-N 1 2 309.388 4.423 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000376551022 337036608 /nfs/dbraw/zinc/03/66/08/337036608.db2.gz AJAORZSSDQEOLY-FZMZJTMJSA-N 1 2 322.239 4.367 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000376551022 337036609 /nfs/dbraw/zinc/03/66/09/337036609.db2.gz AJAORZSSDQEOLY-FZMZJTMJSA-N 1 2 322.239 4.367 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCCCC[C@H]1c1ccco1 ZINC000376598841 337037676 /nfs/dbraw/zinc/03/76/76/337037676.db2.gz VBFPBXHFYIPCKM-HNNXBMFYSA-N 1 2 313.401 4.441 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC(C)=C(c2ccco2)C1 ZINC000376613308 337038043 /nfs/dbraw/zinc/03/80/43/337038043.db2.gz XPFREWRYCMSNLU-UHFFFAOYSA-N 1 2 311.385 4.003 20 0 DIADLO Cc1ccccc1[C@H]1C[C@H](NC(=O)Nc2c(C)cc[nH+]c2C)C1 ZINC000376703273 337039774 /nfs/dbraw/zinc/03/97/74/337039774.db2.gz ZUGLUIUMJBOBMK-WKILWMFISA-N 1 2 309.413 4.075 20 0 DIADLO CC(C)(CC(=O)N1CCC[C@H]1c1[nH]cc[nH+]1)C1CCCCC1 ZINC000377090048 337046623 /nfs/dbraw/zinc/04/66/23/337046623.db2.gz JMKYRMURSJPXLO-HNNXBMFYSA-N 1 2 303.450 4.070 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1ncc(C(C)C)s1 ZINC000377222443 337048871 /nfs/dbraw/zinc/04/88/71/337048871.db2.gz HHRAIURNWJKWSL-AWEZNQCLSA-N 1 2 318.490 4.210 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H]2c3ccc(F)cc3O[C@@H]2C)s1 ZINC000377384683 337051461 /nfs/dbraw/zinc/05/14/61/337051461.db2.gz XRUVBLOBTPCHRV-HWPZZCPQSA-N 1 2 306.406 4.017 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H]2c3ccc(F)cc3O[C@H]2C)s1 ZINC000377384685 337051514 /nfs/dbraw/zinc/05/15/14/337051514.db2.gz XRUVBLOBTPCHRV-QFYYESIMSA-N 1 2 306.406 4.017 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2coc(-c3ccc(F)c(F)c3)n2)o1 ZINC000377533757 337054508 /nfs/dbraw/zinc/05/45/08/337054508.db2.gz LZCGKGGASHVNBR-UHFFFAOYSA-N 1 2 318.323 4.153 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2coc(-c3ccc(F)c(F)c3)n2)o1 ZINC000377533757 337054509 /nfs/dbraw/zinc/05/45/09/337054509.db2.gz LZCGKGGASHVNBR-UHFFFAOYSA-N 1 2 318.323 4.153 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000377787074 337061124 /nfs/dbraw/zinc/06/11/24/337061124.db2.gz RZVHQRMGCNPISI-FMKPAKJESA-N 1 2 318.461 4.067 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000377787074 337061125 /nfs/dbraw/zinc/06/11/25/337061125.db2.gz RZVHQRMGCNPISI-FMKPAKJESA-N 1 2 318.461 4.067 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)C=C2CCC(C)CC2)[nH+]1 ZINC000378172421 337067611 /nfs/dbraw/zinc/06/76/11/337067611.db2.gz DINKNXRVHQUISY-UHFFFAOYSA-N 1 2 309.413 4.460 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccncc2)cs1 ZINC000378202876 337068188 /nfs/dbraw/zinc/06/81/88/337068188.db2.gz PMQSOYOQXRDLDP-SCLBCKFNSA-N 1 2 309.438 4.287 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000170781934 337082989 /nfs/dbraw/zinc/08/29/89/337082989.db2.gz UXJYBUJSHPPCMI-CVEARBPZSA-N 1 2 305.466 4.460 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1nccn1Cc1ccccc1 ZINC000170956063 337085549 /nfs/dbraw/zinc/08/55/49/337085549.db2.gz OLWDMISDLLDIHU-QGZVFWFLSA-N 1 2 317.436 4.051 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1nccn1Cc1ccccc1 ZINC000170956063 337085550 /nfs/dbraw/zinc/08/55/50/337085550.db2.gz OLWDMISDLLDIHU-QGZVFWFLSA-N 1 2 317.436 4.051 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)Cc2ccc(F)cc2)cs1 ZINC000172317139 337091811 /nfs/dbraw/zinc/09/18/11/337091811.db2.gz BSCGEUFHGNXCIP-LBPRGKRZSA-N 1 2 308.422 4.012 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)Cc2ccc(F)cc2)cs1 ZINC000172317139 337091812 /nfs/dbraw/zinc/09/18/12/337091812.db2.gz BSCGEUFHGNXCIP-LBPRGKRZSA-N 1 2 308.422 4.012 20 0 DIADLO Fc1ccc(C[NH+]2CCC(=Cc3cccc(F)c3)CC2)nc1 ZINC000583701662 337094811 /nfs/dbraw/zinc/09/48/11/337094811.db2.gz WIYVWAGYNSXVPB-UHFFFAOYSA-N 1 2 300.352 4.039 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCCc4occc4C3)co2)cc1 ZINC000582569771 337107382 /nfs/dbraw/zinc/10/73/82/337107382.db2.gz OLKRGDHOCQQYBH-UHFFFAOYSA-N 1 2 308.381 4.191 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCCc4occc4C3)co2)cc1 ZINC000582569771 337107383 /nfs/dbraw/zinc/10/73/83/337107383.db2.gz OLKRGDHOCQQYBH-UHFFFAOYSA-N 1 2 308.381 4.191 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H]2CCC(C)=C(C)C2)[nH+]1 ZINC000582609347 337113447 /nfs/dbraw/zinc/11/34/47/337113447.db2.gz JCFLKFINPOLXNE-HNNXBMFYSA-N 1 2 309.413 4.460 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)cs1 ZINC000172909395 337132383 /nfs/dbraw/zinc/13/23/83/337132383.db2.gz HQVIDMGCWHCAEK-KBPBESRZSA-N 1 2 316.470 4.187 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+]2Cc3ccccc3C[C@@H]2C)cs1 ZINC000172909395 337132384 /nfs/dbraw/zinc/13/23/84/337132384.db2.gz HQVIDMGCWHCAEK-KBPBESRZSA-N 1 2 316.470 4.187 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1C[C@H](C)C[C@@H]1c1ccccc1F ZINC000173696827 337137310 /nfs/dbraw/zinc/13/73/10/337137310.db2.gz DGJBFYYJSCGFEU-RHSMWYFYSA-N 1 2 301.409 4.186 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1F ZINC000173696827 337137311 /nfs/dbraw/zinc/13/73/11/337137311.db2.gz DGJBFYYJSCGFEU-RHSMWYFYSA-N 1 2 301.409 4.186 20 0 DIADLO COc1cccc(C[NH2+][C@H](C)c2ncc(-c3ccccc3)o2)c1 ZINC000173800742 337138362 /nfs/dbraw/zinc/13/83/62/337138362.db2.gz BSSABDKQBWCEEU-CQSZACIVSA-N 1 2 308.381 4.201 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCS[C@@H]1CCCOC1 ZINC000460882789 337139160 /nfs/dbraw/zinc/13/91/60/337139160.db2.gz OMKAJRLRPTULCO-MRXNPFEDSA-N 1 2 318.486 4.427 20 0 DIADLO C[N@H+](Cc1nccs1)Cc1cccc(OCc2ccccc2)c1 ZINC000175058836 337144136 /nfs/dbraw/zinc/14/41/36/337144136.db2.gz SJEYESMAQMKXJX-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO C[N@@H+](Cc1nccs1)Cc1cccc(OCc2ccccc2)c1 ZINC000175058836 337144137 /nfs/dbraw/zinc/14/41/37/337144137.db2.gz SJEYESMAQMKXJX-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCCC[C@H]2c2cccn2C)cs1 ZINC000175139776 337144694 /nfs/dbraw/zinc/14/46/94/337144694.db2.gz FHDSRVWECKDTBH-INIZCTEOSA-N 1 2 303.475 4.332 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCCC[C@H]2c2cccn2C)cs1 ZINC000175139776 337144695 /nfs/dbraw/zinc/14/46/95/337144695.db2.gz FHDSRVWECKDTBH-INIZCTEOSA-N 1 2 303.475 4.332 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000175135922 337144725 /nfs/dbraw/zinc/14/47/25/337144725.db2.gz FBYGOHKJUDWEJC-GFCCVEGCSA-N 1 2 300.333 4.267 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000175135922 337144726 /nfs/dbraw/zinc/14/47/26/337144726.db2.gz FBYGOHKJUDWEJC-GFCCVEGCSA-N 1 2 300.333 4.267 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CCOC2(CCCCC2)C1 ZINC000175268930 337146666 /nfs/dbraw/zinc/14/66/66/337146666.db2.gz ZUNMEQPBQVZNHR-CQSZACIVSA-N 1 2 306.450 4.068 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCOC2(CCCCC2)C1 ZINC000175268930 337146667 /nfs/dbraw/zinc/14/66/67/337146667.db2.gz ZUNMEQPBQVZNHR-CQSZACIVSA-N 1 2 306.450 4.068 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2ccccc2OC(C)C)s1 ZINC000175506624 337147657 /nfs/dbraw/zinc/14/76/57/337147657.db2.gz RETVXTRMYNYKMH-UHFFFAOYSA-N 1 2 304.459 4.125 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2ccccc2OC(C)C)s1 ZINC000175506624 337147658 /nfs/dbraw/zinc/14/76/58/337147658.db2.gz RETVXTRMYNYKMH-UHFFFAOYSA-N 1 2 304.459 4.125 20 0 DIADLO c1cn(Cc2ccccc2)c(CNc2ccc3scnc3c2)[nH+]1 ZINC000176161433 337149484 /nfs/dbraw/zinc/14/94/84/337149484.db2.gz PDAJIGPJYMGPCS-UHFFFAOYSA-N 1 2 320.421 4.153 20 0 DIADLO C[C@H](C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1)c1cc2ccccc2o1 ZINC000176218971 337149715 /nfs/dbraw/zinc/14/97/15/337149715.db2.gz CYZVQLRIORGBIG-ZFWWWQNUSA-N 1 2 323.396 4.013 20 0 DIADLO C[C@@H](C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1)c1cc2ccccc2o1 ZINC000176218985 337149807 /nfs/dbraw/zinc/14/98/07/337149807.db2.gz CYZVQLRIORGBIG-HIFRSBDPSA-N 1 2 323.396 4.013 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2cccc(C(F)(F)F)c2)sc1C ZINC000176325748 337150921 /nfs/dbraw/zinc/15/09/21/337150921.db2.gz JKSXHNNIBATICT-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2cccc(C(F)(F)F)c2)sc1C ZINC000176325748 337150922 /nfs/dbraw/zinc/15/09/22/337150922.db2.gz JKSXHNNIBATICT-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1nc(N(Cc2cccs2)Cc2cccs2)cc[nH+]1 ZINC000176810158 337153284 /nfs/dbraw/zinc/15/32/84/337153284.db2.gz PQTSIHOINMZGPH-UHFFFAOYSA-N 1 2 301.440 4.115 20 0 DIADLO Cc1nc(C[N@H+](Cc2cccs2)C2CC2)nc2ccccc12 ZINC000532900111 337153481 /nfs/dbraw/zinc/15/34/81/337153481.db2.gz WCAWIRKQRNZMIH-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO Cc1nc(C[N@@H+](Cc2cccs2)C2CC2)nc2ccccc12 ZINC000532900111 337153482 /nfs/dbraw/zinc/15/34/82/337153482.db2.gz WCAWIRKQRNZMIH-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO O=C(C[C@H]1CCC[N@H+]1Cc1ccncc1Cl)c1cccs1 ZINC000177398183 337155728 /nfs/dbraw/zinc/15/57/28/337155728.db2.gz FBLCBBXXSOAHKL-CYBMUJFWSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@H]1CCC[N@@H+]1Cc1ccncc1Cl)c1cccs1 ZINC000177398183 337155729 /nfs/dbraw/zinc/15/57/29/337155729.db2.gz FBLCBBXXSOAHKL-CYBMUJFWSA-N 1 2 320.845 4.034 20 0 DIADLO CC[N@@H+](Cc1nccs1)Cc1ccc(Cl)c(Cl)c1 ZINC000179200048 337168254 /nfs/dbraw/zinc/16/82/54/337168254.db2.gz YUHILQHQAKXHLJ-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC(C)Sc1ccccc1NC(=O)c1ccc2[nH+]ccn2c1 ZINC000178049218 337160099 /nfs/dbraw/zinc/16/00/99/337160099.db2.gz IGWYDFWROMCSCR-UHFFFAOYSA-N 1 2 311.410 4.087 20 0 DIADLO CC[N@H+](Cc1nccs1)Cc1ccc(Cl)c(Cl)c1 ZINC000179200048 337168253 /nfs/dbraw/zinc/16/82/53/337168253.db2.gz YUHILQHQAKXHLJ-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CSCCC[NH2+][C@@H](c1cccc(OC(C)C)c1)C(F)F ZINC000582796781 337169615 /nfs/dbraw/zinc/16/96/15/337169615.db2.gz ZLCGZPGPPIFHPH-AWEZNQCLSA-N 1 2 303.418 4.123 20 0 DIADLO Cc1cnc(C[N@@H+]2CCC[C@H]2c2nc3ccccc3s2)s1 ZINC000180421507 337174323 /nfs/dbraw/zinc/17/43/23/337174323.db2.gz AWHXZRGDRRHZLK-ZDUSSCGKSA-N 1 2 315.467 4.398 20 0 DIADLO Cc1cnc(C[N@H+]2CCC[C@H]2c2nc3ccccc3s2)s1 ZINC000180421507 337174324 /nfs/dbraw/zinc/17/43/24/337174324.db2.gz AWHXZRGDRRHZLK-ZDUSSCGKSA-N 1 2 315.467 4.398 20 0 DIADLO Cc1cnc(C[N@@H+]2CCSC[C@H]2c2ccc(C)cc2)s1 ZINC000180499046 337175942 /nfs/dbraw/zinc/17/59/42/337175942.db2.gz VGXOCYQXZNDNST-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1cnc(C[N@H+]2CCSC[C@H]2c2ccc(C)cc2)s1 ZINC000180499046 337175943 /nfs/dbraw/zinc/17/59/43/337175943.db2.gz VGXOCYQXZNDNST-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1cnc(C[N@H+]2C[C@@H](c3cc(C)ccc3C)OC[C@H]2C)s1 ZINC000180514284 337176065 /nfs/dbraw/zinc/17/60/65/337176065.db2.gz GGWHBVASLPPOEA-PBHICJAKSA-N 1 2 316.470 4.030 20 0 DIADLO Cc1cnc(C[N@@H+]2C[C@@H](c3cc(C)ccc3C)OC[C@H]2C)s1 ZINC000180514284 337176066 /nfs/dbraw/zinc/17/60/66/337176066.db2.gz GGWHBVASLPPOEA-PBHICJAKSA-N 1 2 316.470 4.030 20 0 DIADLO C(=C/[C@H]1CCCCC[N@H+]1Cc1csnn1)\c1cccs1 ZINC000180843391 337178061 /nfs/dbraw/zinc/17/80/61/337178061.db2.gz FAHUTSFBYZYOEB-HSBSLETESA-N 1 2 305.472 4.058 20 0 DIADLO C(=C/[C@H]1CCCCC[N@@H+]1Cc1csnn1)\c1cccs1 ZINC000180843391 337178062 /nfs/dbraw/zinc/17/80/62/337178062.db2.gz FAHUTSFBYZYOEB-HSBSLETESA-N 1 2 305.472 4.058 20 0 DIADLO Fc1ccc(C[NH+]2CCC(=Cc3ccccc3F)CC2)nc1 ZINC000469733742 337179247 /nfs/dbraw/zinc/17/92/47/337179247.db2.gz LPSZZKDLJOUCFB-UHFFFAOYSA-N 1 2 300.352 4.039 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1nnc(C2CCC2)n1C ZINC000181025258 337179330 /nfs/dbraw/zinc/17/93/30/337179330.db2.gz ONBSGYDBUBCHTO-CYBMUJFWSA-N 1 2 324.428 4.022 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nnc(C2CCC2)n1C ZINC000181025258 337179331 /nfs/dbraw/zinc/17/93/31/337179331.db2.gz ONBSGYDBUBCHTO-CYBMUJFWSA-N 1 2 324.428 4.022 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](CC2CCC2)c2ccccc2)n1 ZINC000181353118 337181624 /nfs/dbraw/zinc/18/16/24/337181624.db2.gz NSXWGQUBLFHCTP-KRWDZBQOSA-N 1 2 313.445 4.433 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[NH2+][C@@H](C)c3cccnc3)o2)cc1C ZINC000181652689 337183498 /nfs/dbraw/zinc/18/34/98/337183498.db2.gz LZDPNPYARVVFKG-GJZGRUSLSA-N 1 2 322.412 4.160 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCCC[C@@H]2/C=C/c2cccs2)o1 ZINC000181958728 337185598 /nfs/dbraw/zinc/18/55/98/337185598.db2.gz FXRFRYHVQDQMNK-ATWMFIQVSA-N 1 2 317.458 4.152 20 0 DIADLO CCc1nnc(C[N@H+]2CCCCC[C@@H]2/C=C/c2cccs2)o1 ZINC000181958728 337185599 /nfs/dbraw/zinc/18/55/99/337185599.db2.gz FXRFRYHVQDQMNK-ATWMFIQVSA-N 1 2 317.458 4.152 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H](C)c1nc(C2CC2)no1 ZINC000183534973 337192219 /nfs/dbraw/zinc/19/22/19/337192219.db2.gz LDMTZRKXIBVQDB-RYUDHWBXSA-N 1 2 311.385 4.413 20 0 DIADLO CC[C@@H]([NH2+]Cc1sc(C)nc1C(F)(F)F)c1nccs1 ZINC000183669571 337194086 /nfs/dbraw/zinc/19/40/86/337194086.db2.gz YSERGTNMXVINEG-MRVPVSSYSA-N 1 2 321.393 4.168 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(Cl)n1)c1ncc(-c2ccccc2)o1 ZINC000184888254 337200675 /nfs/dbraw/zinc/20/06/75/337200675.db2.gz MIERHVRYZWGCCU-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1ccc(Cn2c3ccccc3nc2C(F)(F)F)c(C)[nH+]1 ZINC000185254634 337203665 /nfs/dbraw/zinc/20/36/65/337203665.db2.gz NPSNOTFXYJVLKD-UHFFFAOYSA-N 1 2 305.303 4.115 20 0 DIADLO Cc1ccc(COc2ccccc2OCC(F)(F)F)c(C)[nH+]1 ZINC000185365602 337204461 /nfs/dbraw/zinc/20/44/61/337204461.db2.gz UXEJNMILJXGPOF-UHFFFAOYSA-N 1 2 311.303 4.219 20 0 DIADLO Cc1ccc(COc2ccc(-c3noc(C4CC4)n3)cc2)c(C)[nH+]1 ZINC000185368275 337204493 /nfs/dbraw/zinc/20/44/93/337204493.db2.gz GQJNRYXERMEMHQ-UHFFFAOYSA-N 1 2 321.380 4.205 20 0 DIADLO CC(C)Oc1cccc([C@@H]([NH2+][C@H]2CCCSC2)C(F)F)c1 ZINC000582855984 337211276 /nfs/dbraw/zinc/21/12/76/337211276.db2.gz HUTNXMATEMTTNA-DZGCQCFKSA-N 1 2 315.429 4.265 20 0 DIADLO CC(C)(C)c1nc(COc2ccccc2-n2cc[nH+]c2)cs1 ZINC000583178255 337254891 /nfs/dbraw/zinc/25/48/91/337254891.db2.gz CBLFQGHZTZPEGE-UHFFFAOYSA-N 1 2 313.426 4.205 20 0 DIADLO Cc1ccc(C)c(C[N@@H+]2CCSC[C@H]2c2nccs2)c1 ZINC000186631023 337258107 /nfs/dbraw/zinc/25/81/07/337258107.db2.gz DRNGIPANGDVOJV-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1ccc(C)c(C[N@H+]2CCSC[C@H]2c2nccs2)c1 ZINC000186631023 337258108 /nfs/dbraw/zinc/25/81/08/337258108.db2.gz DRNGIPANGDVOJV-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO CC1(C)COCC[N@@H+]1Cc1nc(-c2ccccc2Cl)cs1 ZINC000186757328 337259377 /nfs/dbraw/zinc/25/93/77/337259377.db2.gz YXHPDCDXWJQPEE-UHFFFAOYSA-N 1 2 322.861 4.074 20 0 DIADLO CC1(C)COCC[N@H+]1Cc1nc(-c2ccccc2Cl)cs1 ZINC000186757328 337259378 /nfs/dbraw/zinc/25/93/78/337259378.db2.gz YXHPDCDXWJQPEE-UHFFFAOYSA-N 1 2 322.861 4.074 20 0 DIADLO CCc1cnc(C[NH2+]Cc2cc(Cl)ccc2Cl)s1 ZINC000229197211 337260237 /nfs/dbraw/zinc/26/02/37/337260237.db2.gz CHZMQMPKZJASMM-UHFFFAOYSA-N 1 2 301.242 4.302 20 0 DIADLO Cc1ccc(C[S@@](=O)[C@H](C)c2cccc(Cl)c2)c(C)[nH+]1 ZINC000187171595 337263482 /nfs/dbraw/zinc/26/34/82/337263482.db2.gz VPYCFMBTOLZZSN-ZUOKHONESA-N 1 2 307.846 4.362 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[S@](=O)Cc1ccc(C)[nH+]c1C ZINC000187160332 337263546 /nfs/dbraw/zinc/26/35/46/337263546.db2.gz KBIIIHHLZHLOQF-DYESRHJHSA-N 1 2 305.418 4.238 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[S@@](=O)Cc1ccc(C)[nH+]c1C ZINC000187160301 337263571 /nfs/dbraw/zinc/26/35/71/337263571.db2.gz KBIIIHHLZHLOQF-UTKZUKDTSA-N 1 2 305.418 4.238 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nc(-c3ccccc3F)no2)cc1 ZINC000189155026 337277152 /nfs/dbraw/zinc/27/71/52/337277152.db2.gz PEANAYKVHLKCMN-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO CCOc1ccccc1C[N@@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000189765727 337282596 /nfs/dbraw/zinc/28/25/96/337282596.db2.gz FZJMMVMZYIFGCU-MRXNPFEDSA-N 1 2 302.443 4.187 20 0 DIADLO CCOc1ccccc1C[N@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000189765727 337282597 /nfs/dbraw/zinc/28/25/97/337282597.db2.gz FZJMMVMZYIFGCU-MRXNPFEDSA-N 1 2 302.443 4.187 20 0 DIADLO Clc1cccc([C@@H]([NH2+]Cc2ncccn2)c2ccccc2)c1 ZINC000190347223 337286909 /nfs/dbraw/zinc/28/69/09/337286909.db2.gz TVMIDLRPDQYYPE-SFHVURJKSA-N 1 2 309.800 4.009 20 0 DIADLO CCN(C)c1ccc(CNc2cccc(COC(C)C)c2)c[nH+]1 ZINC000190874317 337290257 /nfs/dbraw/zinc/29/02/57/337290257.db2.gz YNEQJTVXSKZSNR-UHFFFAOYSA-N 1 2 313.445 4.075 20 0 DIADLO CCc1[nH+]c(C)ccc1OCc1nc(C(F)(F)F)cs1 ZINC000190773927 337290714 /nfs/dbraw/zinc/29/07/14/337290714.db2.gz QGNVKFXNTSRNHE-UHFFFAOYSA-N 1 2 302.321 4.007 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2nccn2-c2ccccc2)cc1 ZINC000191209983 337294992 /nfs/dbraw/zinc/29/49/92/337294992.db2.gz VLLRHTYSBOMVBO-INIZCTEOSA-N 1 2 321.424 4.074 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2nccn2-c2ccccc2)cc1 ZINC000191209983 337294993 /nfs/dbraw/zinc/29/49/93/337294993.db2.gz VLLRHTYSBOMVBO-INIZCTEOSA-N 1 2 321.424 4.074 20 0 DIADLO Cc1cccc([C@@H](NC(=O)C[C@@H](C)n2cc[nH+]c2)C(C)(C)C)c1 ZINC000583266848 337296416 /nfs/dbraw/zinc/29/64/16/337296416.db2.gz YMNDJFYYYYWNPV-CRAIPNDOSA-N 1 2 313.445 4.046 20 0 DIADLO Cc1cccc([C@H](NC(=O)C[C@@H](C)n2cc[nH+]c2)C(C)(C)C)c1 ZINC000583266850 337296516 /nfs/dbraw/zinc/29/65/16/337296516.db2.gz YMNDJFYYYYWNPV-QAPCUYQASA-N 1 2 313.445 4.046 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccc(Br)o2)C1 ZINC000191493384 337297394 /nfs/dbraw/zinc/29/73/94/337297394.db2.gz IYEPPJUNKOFUME-BXUZGUMPSA-N 1 2 321.218 4.020 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc(Br)o2)C1 ZINC000191493384 337297395 /nfs/dbraw/zinc/29/73/95/337297395.db2.gz IYEPPJUNKOFUME-BXUZGUMPSA-N 1 2 321.218 4.020 20 0 DIADLO Clc1cnc(C[NH+]2CCC(c3ccncc3)CC2)c(Cl)c1 ZINC000191630314 337298221 /nfs/dbraw/zinc/29/82/21/337298221.db2.gz WOVFCXCFEIUPPM-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Cc1ccc(-c2ncc(C[NH2+][C@H](C)c3cscn3)s2)cc1 ZINC000583274931 337300220 /nfs/dbraw/zinc/30/02/20/337300220.db2.gz VAZCAUQOYGQYNW-GFCCVEGCSA-N 1 2 315.467 4.426 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)c2ccncc2F)c1C(C)C ZINC000191956405 337301359 /nfs/dbraw/zinc/30/13/59/337301359.db2.gz ITGAMYSJYHXRQV-UHFFFAOYSA-N 1 2 323.371 4.453 20 0 DIADLO CC[N@H+](Cc1ncccn1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000191970494 337301539 /nfs/dbraw/zinc/30/15/39/337301539.db2.gz HKHRUNHSKNKGET-LBPRGKRZSA-N 1 2 309.335 4.079 20 0 DIADLO CC[N@@H+](Cc1ncccn1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000191970494 337301540 /nfs/dbraw/zinc/30/15/40/337301540.db2.gz HKHRUNHSKNKGET-LBPRGKRZSA-N 1 2 309.335 4.079 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](Cc1ncccn1)C1CC1 ZINC000191983910 337302638 /nfs/dbraw/zinc/30/26/38/337302638.db2.gz ZSDZDEOLYYHABX-LBPRGKRZSA-N 1 2 321.346 4.221 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](Cc1ncccn1)C1CC1 ZINC000191983910 337302639 /nfs/dbraw/zinc/30/26/39/337302639.db2.gz ZSDZDEOLYYHABX-LBPRGKRZSA-N 1 2 321.346 4.221 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](Cc1ncccn1)C1CC1 ZINC000191983916 337302662 /nfs/dbraw/zinc/30/26/62/337302662.db2.gz ZSDZDEOLYYHABX-GFCCVEGCSA-N 1 2 321.346 4.221 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](Cc1ncccn1)C1CC1 ZINC000191983916 337302663 /nfs/dbraw/zinc/30/26/63/337302663.db2.gz ZSDZDEOLYYHABX-GFCCVEGCSA-N 1 2 321.346 4.221 20 0 DIADLO COc1cccc(C[NH2+][C@@H](c2ccccc2)c2cccnc2)c1F ZINC000192679029 337306758 /nfs/dbraw/zinc/30/67/58/337306758.db2.gz GSCCPQMTRLMSCL-FQEVSTJZSA-N 1 2 322.383 4.109 20 0 DIADLO C[C@@H]([NH2+]Cc1nnsc1Cl)c1cc2ccccc2s1 ZINC000525952243 337307641 /nfs/dbraw/zinc/30/76/41/337307641.db2.gz AKTTYGBBFPICRI-MRVPVSSYSA-N 1 2 309.847 4.257 20 0 DIADLO Cc1nc([C@@H](C)[N@H+]2CC=C(c3cccc4ccccc43)CC2)no1 ZINC000583291649 337307698 /nfs/dbraw/zinc/30/76/98/337307698.db2.gz YSQDAEXMZAQXSH-CQSZACIVSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1nc([C@@H](C)[N@@H+]2CC=C(c3cccc4ccccc43)CC2)no1 ZINC000583291649 337307699 /nfs/dbraw/zinc/30/76/99/337307699.db2.gz YSQDAEXMZAQXSH-CQSZACIVSA-N 1 2 319.408 4.382 20 0 DIADLO CC(C)c1noc([C@H](C)[N@H+]2CC=C(c3ccc(F)cc3)CC2)n1 ZINC000193020080 337308879 /nfs/dbraw/zinc/30/88/79/337308879.db2.gz QBIBIPHHIHNLHC-ZDUSSCGKSA-N 1 2 315.392 4.182 20 0 DIADLO CC(C)c1noc([C@H](C)[N@@H+]2CC=C(c3ccc(F)cc3)CC2)n1 ZINC000193020080 337308880 /nfs/dbraw/zinc/30/88/80/337308880.db2.gz QBIBIPHHIHNLHC-ZDUSSCGKSA-N 1 2 315.392 4.182 20 0 DIADLO c1csc([C@H]2CCC[N@H+]2Cc2noc(-c3ccsc3)n2)c1 ZINC000193030055 337308969 /nfs/dbraw/zinc/30/89/69/337308969.db2.gz KRMFMSQFKVHRFN-GFCCVEGCSA-N 1 2 317.439 4.197 20 0 DIADLO c1csc([C@H]2CCC[N@@H+]2Cc2noc(-c3ccsc3)n2)c1 ZINC000193030055 337308970 /nfs/dbraw/zinc/30/89/70/337308970.db2.gz KRMFMSQFKVHRFN-GFCCVEGCSA-N 1 2 317.439 4.197 20 0 DIADLO Cc1csc([C@H](C)Nc2[nH+]ccc(C)c2Br)n1 ZINC000235542395 337310172 /nfs/dbraw/zinc/31/01/72/337310172.db2.gz LYKHYWHAXICORW-VIFPVBQESA-N 1 2 312.236 4.091 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NC[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000584453254 337340330 /nfs/dbraw/zinc/34/03/30/337340330.db2.gz IYVBBVMOGZRVLI-ZWKOTPCHSA-N 1 2 323.440 4.404 20 0 DIADLO CC(C)Oc1cccc([C@@H]([NH2+]CCc2cccnc2)C(F)F)c1 ZINC000584508170 337352443 /nfs/dbraw/zinc/35/24/43/337352443.db2.gz GTSQQBDYLRCNCJ-QGZVFWFLSA-N 1 2 320.383 4.007 20 0 DIADLO Cc1cc(N2CCC[C@H]2c2ccsc2)nc(-c2ccncc2)[nH+]1 ZINC000112074391 337390130 /nfs/dbraw/zinc/39/01/30/337390130.db2.gz WOTCYEPIBHITQI-INIZCTEOSA-N 1 2 322.437 4.250 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000114322376 337391465 /nfs/dbraw/zinc/39/14/65/337391465.db2.gz YOQCHIKLWVWGSY-KRWDZBQOSA-N 1 2 317.477 4.043 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c(C)n1C(C)C ZINC000043485519 337411485 /nfs/dbraw/zinc/41/14/85/337411485.db2.gz NUOIPGRTHSPQRT-UHFFFAOYSA-N 1 2 322.412 4.124 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)N[C@@H]2CC23CC3)c1 ZINC000425654541 337422044 /nfs/dbraw/zinc/42/20/44/337422044.db2.gz MZNGGOIJHGWMBZ-MRXNPFEDSA-N 1 2 324.428 4.024 20 0 DIADLO CCCCC[C@@H](C)[NH2+][C@@H](c1noc(C)n1)c1ccccc1OC ZINC000130832809 337434592 /nfs/dbraw/zinc/43/45/92/337434592.db2.gz HBLGWURSBBZVGR-CXAGYDPISA-N 1 2 317.433 4.034 20 0 DIADLO Fc1ccc(Cl)cc1C[NH2+]Cc1ncoc1-c1ccccc1 ZINC000359979144 337441406 /nfs/dbraw/zinc/44/14/06/337441406.db2.gz QLFOSEKQZYAIKP-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO Cc1cc(OCc2nnc(C(C)C)s2)c2cccc(C)c2[nH+]1 ZINC000418946485 337472493 /nfs/dbraw/zinc/47/24/93/337472493.db2.gz RMYIXYPROXXHJQ-UHFFFAOYSA-N 1 2 313.426 4.406 20 0 DIADLO Cc1ccncc1COc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000419013492 337473661 /nfs/dbraw/zinc/47/36/61/337473661.db2.gz ZSQQYVWPQOFILD-UHFFFAOYSA-N 1 2 319.408 4.169 20 0 DIADLO FC1(F)CC(COc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C1 ZINC000419009437 337474440 /nfs/dbraw/zinc/47/44/40/337474440.db2.gz NFLGNYZQZMNNSV-UHFFFAOYSA-N 1 2 318.367 4.311 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CSCc1noc(C(C)C)n1 ZINC000419402154 337482330 /nfs/dbraw/zinc/48/23/30/337482330.db2.gz BJHCROAMZIIHEK-UHFFFAOYSA-N 1 2 305.447 4.453 20 0 DIADLO Cc1[nH+]cccc1Cc1noc(-c2ccc(OC(C)(C)C)cc2)n1 ZINC000420509184 337505672 /nfs/dbraw/zinc/50/56/72/337505672.db2.gz CIOMYFKHLCRRIW-UHFFFAOYSA-N 1 2 323.396 4.208 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc([C@H](C)C(C)(C)C)n1 ZINC000445387481 337523529 /nfs/dbraw/zinc/52/35/29/337523529.db2.gz XQLSLTFZNBRXJG-LBPRGKRZSA-N 1 2 312.417 4.120 20 0 DIADLO CC[C@H]([NH2+]Cc1nn(C)c(C)c1Cl)c1ccc(Cl)s1 ZINC000421361438 337532073 /nfs/dbraw/zinc/53/20/73/337532073.db2.gz GSDHSXLVPNFQCQ-VIFPVBQESA-N 1 2 318.273 4.338 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2nnc(C(C)C)o2)c2ccccc2)cc1 ZINC000076292079 337568110 /nfs/dbraw/zinc/56/81/10/337568110.db2.gz YWVKMKPISNTMAP-IBGZPJMESA-N 1 2 321.424 4.381 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(Cl)cc1Cl ZINC000393327893 337574782 /nfs/dbraw/zinc/57/47/82/337574782.db2.gz VZYWOMOCTOLENN-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO CC(C)CCc1noc(C(C)(C)Cc2[nH]c3ccccc3[nH+]2)n1 ZINC000572277221 337602628 /nfs/dbraw/zinc/60/26/28/337602628.db2.gz IYRBFVKQYAUSCG-UHFFFAOYSA-N 1 2 312.417 4.055 20 0 DIADLO FC(F)Oc1cccc(N[C@@H]2CCc3ccc[nH+]c3CC2)c1 ZINC000421839272 337652907 /nfs/dbraw/zinc/65/29/07/337652907.db2.gz XEMRCFLBDSZSON-CYBMUJFWSA-N 1 2 304.340 4.043 20 0 DIADLO Cc1cc([NH+]2CCCC2)ccc1N[C@H]1CCc2cccnc2CC1 ZINC000421840134 337653284 /nfs/dbraw/zinc/65/32/84/337653284.db2.gz ZMJINCNZZUVBGU-SFHVURJKSA-N 1 2 321.468 4.350 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccncc1Cl ZINC000421846418 337654468 /nfs/dbraw/zinc/65/44/68/337654468.db2.gz SIUVCJKOFLAKNZ-XPTSAGLGSA-N 1 2 309.196 4.173 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2cc(F)c(Cl)cc2Cl)nn1 ZINC000396728479 337732145 /nfs/dbraw/zinc/73/21/45/337732145.db2.gz ZVAOTZVWMONBOE-SECBINFHSA-N 1 2 314.191 4.082 20 0 DIADLO C[C@@H]([NH2+]c1ccc(NS(C)(=O)=O)cc1)[C@@H](C)C1CCCCC1 ZINC000527221443 337738503 /nfs/dbraw/zinc/73/85/03/337738503.db2.gz CDOFVAJJBZZRPT-ZIAGYGMSSA-N 1 2 324.490 4.075 20 0 DIADLO Fc1ccc(F)c(C[NH2+]Cc2ccc3c(n2)CCCC3)c1Cl ZINC000527699592 337757398 /nfs/dbraw/zinc/75/73/98/337757398.db2.gz IIQWXKJXCBWRRP-UHFFFAOYSA-N 1 2 322.786 4.182 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cccc(OCC(F)(F)F)c1 ZINC000424138039 337757560 /nfs/dbraw/zinc/75/75/60/337757560.db2.gz BQEPRDGLUCOIRG-UHFFFAOYSA-N 1 2 313.323 4.017 20 0 DIADLO CC[C@@H](C)c1ccc([C@H](C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000527905948 337770263 /nfs/dbraw/zinc/77/02/63/337770263.db2.gz SYPCBEUDZSLBON-OLZOCXBDSA-N 1 2 305.853 4.438 20 0 DIADLO CC(C)c1cccc([C@H](C)[NH2+]Cc2nnc(C3CC3)s2)c1 ZINC000527909662 337770670 /nfs/dbraw/zinc/77/06/70/337770670.db2.gz RMFVLVYGIWDKJB-LBPRGKRZSA-N 1 2 301.459 4.390 20 0 DIADLO c1ccc([C@@H]2CN(c3[nH+]ccc4ccccc43)CCCO2)cc1 ZINC000527881406 337771408 /nfs/dbraw/zinc/77/14/08/337771408.db2.gz MPOZNHOZRNCYQD-IBGZPJMESA-N 1 2 304.393 4.203 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@H]1CC12CC2 ZINC000527879716 337771416 /nfs/dbraw/zinc/77/14/16/337771416.db2.gz GUAFGLCAONGJRJ-WMLDXEAASA-N 1 2 305.425 4.202 20 0 DIADLO CCCC(=O)Nc1cccc(NCc2c[nH+]cn2C(C)C)c1C ZINC000424159434 337786225 /nfs/dbraw/zinc/78/62/25/337786225.db2.gz SSSYIUKGVIPJDP-UHFFFAOYSA-N 1 2 314.433 4.123 20 0 DIADLO Cc1ccc(Cc2ccccn2)cc1NCc1c[nH+]cn1C(C)C ZINC000424171246 337791639 /nfs/dbraw/zinc/79/16/39/337791639.db2.gz CCHCBIKUAJHCPO-UHFFFAOYSA-N 1 2 320.440 4.370 20 0 DIADLO COc1cc(NCc2c[nH+]cn2C(C)C)ccc1C(F)(F)F ZINC000424200503 337808365 /nfs/dbraw/zinc/80/83/65/337808365.db2.gz ZPCSSPQGAVFWQR-UHFFFAOYSA-N 1 2 313.323 4.104 20 0 DIADLO O=C(C[C@@H]1C=CCC1)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000044568424 337811334 /nfs/dbraw/zinc/81/13/34/337811334.db2.gz BLWBSGVARJQEPZ-OAHLLOKOSA-N 1 2 321.424 4.181 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H]2COc3ccc(F)cc32)c(Cl)c1 ZINC000424286456 337815483 /nfs/dbraw/zinc/81/54/83/337815483.db2.gz WCDRGTHXWXOZIN-QFYYESIMSA-N 1 2 321.779 4.272 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CCc1ccc(-c2ccccc2F)o1 ZINC000107285617 337828272 /nfs/dbraw/zinc/82/82/72/337828272.db2.gz UCTCVRMACHHJCP-UHFFFAOYSA-N 1 2 324.355 4.360 20 0 DIADLO COc1cc(-c2ccccc2)sc1C(=O)Nc1cc[nH+]cc1C ZINC000107285121 337828274 /nfs/dbraw/zinc/82/82/74/337828274.db2.gz WBFQCUJDOXBERR-UHFFFAOYSA-N 1 2 324.405 4.379 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000107291322 337828333 /nfs/dbraw/zinc/82/83/33/337828333.db2.gz FXENAIRFZIARET-NEPJUHHUSA-N 1 2 321.207 4.439 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000107291326 337828439 /nfs/dbraw/zinc/82/84/39/337828439.db2.gz FXENAIRFZIARET-NWDGAFQWSA-N 1 2 321.207 4.439 20 0 DIADLO C[C@H](CC(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000046105397 337831991 /nfs/dbraw/zinc/83/19/91/337831991.db2.gz UNHLYTYMZCYEEJ-OAHLLOKOSA-N 1 2 305.381 4.005 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cc2cc(F)ccc2o1 ZINC000117776555 337849143 /nfs/dbraw/zinc/84/91/43/337849143.db2.gz ITMUUCWRQKBIJP-UHFFFAOYSA-N 1 2 321.311 4.214 20 0 DIADLO CCSCc1ccc(C(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000119057636 337853796 /nfs/dbraw/zinc/85/37/96/337853796.db2.gz UMOGCNJHAGGHGJ-UHFFFAOYSA-N 1 2 300.427 4.204 20 0 DIADLO Cc1ccc(NC(=O)Cc2csc(-c3ccccc3)n2)c(C)[nH+]1 ZINC000119235023 337856627 /nfs/dbraw/zinc/85/66/27/337856627.db2.gz BFQBPOCWMVRSPN-UHFFFAOYSA-N 1 2 323.421 4.003 20 0 DIADLO Cc1ccc(NC(=O)Cc2c(Cl)cccc2Cl)c(C)[nH+]1 ZINC000119240401 337856642 /nfs/dbraw/zinc/85/66/42/337856642.db2.gz HOWSZSNBIUEQBM-UHFFFAOYSA-N 1 2 309.196 4.186 20 0 DIADLO Cc1c2ccccc2oc1[C@@H]([NH2+]Cc1nccc(C)n1)C(C)C ZINC000537059595 337884440 /nfs/dbraw/zinc/88/44/40/337884440.db2.gz OYCZXKLHZSTWCF-SFHVURJKSA-N 1 2 309.413 4.327 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2Cl)c(OC)c1 ZINC000121333557 337892102 /nfs/dbraw/zinc/89/21/02/337892102.db2.gz RDYNXQFBJSESMC-NSHDSACASA-N 1 2 323.795 4.347 20 0 DIADLO CCc1cnc(C[NH2+]C2(c3ccc(F)cc3F)CCCC2)o1 ZINC000537133384 337894566 /nfs/dbraw/zinc/89/45/66/337894566.db2.gz UYXCVPRZINQXOD-UHFFFAOYSA-N 1 2 306.356 4.074 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(Oc3cccnc3)cc2)c(C)[nH+]1 ZINC000121591179 337895933 /nfs/dbraw/zinc/89/59/33/337895933.db2.gz CEQZGZUCJVVUKZ-UHFFFAOYSA-N 1 2 319.364 4.138 20 0 DIADLO CC[C@H]1CN(C(=O)Nc2cc[nH+]cc2C)CC[C@H]1c1ccccc1 ZINC000122073756 337906041 /nfs/dbraw/zinc/90/60/41/337906041.db2.gz WRHOCVNPZRNXCN-FUHWJXTLSA-N 1 2 323.440 4.438 20 0 DIADLO CCc1cnc(C[NH2+][C@H](CC(C)C)c2ccccc2OC)o1 ZINC000537173885 337906509 /nfs/dbraw/zinc/90/65/09/337906509.db2.gz NBIOHJNTFYYPOL-MRXNPFEDSA-N 1 2 302.418 4.123 20 0 DIADLO CCC[C@H]([NH2+]Cc1csnn1)c1ccc(Cl)c(Cl)c1 ZINC000537299745 337929540 /nfs/dbraw/zinc/92/95/40/337929540.db2.gz MTTRILIDSOPYOA-ZDUSSCGKSA-N 1 2 316.257 4.476 20 0 DIADLO CCCOc1cccc2c(N[C@H](C)c3csnn3)cc[nH+]c12 ZINC000514719024 337969203 /nfs/dbraw/zinc/96/92/03/337969203.db2.gz BYKQOCMECWTOTP-LLVKDONJSA-N 1 2 314.414 4.048 20 0 DIADLO CCCC[C@H](C)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000514755888 337969278 /nfs/dbraw/zinc/96/92/78/337969278.db2.gz KVIYLKMIEQEMQX-AWEZNQCLSA-N 1 2 310.401 4.275 20 0 DIADLO C[NH+](C)[C@H](c1nc(CCC2CCCCC2)no1)c1ccccc1 ZINC000515707818 337996248 /nfs/dbraw/zinc/99/62/48/337996248.db2.gz NHRGNGYMRAZJMR-SFHVURJKSA-N 1 2 313.445 4.234 20 0 DIADLO CCCc1nc(C[N@H+](CCC(F)(F)F)CC2CC2)cs1 ZINC000084138282 338000267 /nfs/dbraw/zinc/00/02/67/338000267.db2.gz YDEIRYJFOXCHGX-UHFFFAOYSA-N 1 2 306.397 4.260 20 0 DIADLO CCCc1nc(C[N@@H+](CCC(F)(F)F)CC2CC2)cs1 ZINC000084138282 338000268 /nfs/dbraw/zinc/00/02/68/338000268.db2.gz YDEIRYJFOXCHGX-UHFFFAOYSA-N 1 2 306.397 4.260 20 0 DIADLO CCSc1ccc(Cl)cc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000084297482 338001651 /nfs/dbraw/zinc/00/16/51/338001651.db2.gz QQZJKCYGXUFDFY-UHFFFAOYSA-N 1 2 306.818 4.408 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+](C)[C@@H](C)c2cccnc2)o1 ZINC000537900100 338002747 /nfs/dbraw/zinc/00/27/47/338002747.db2.gz PZGHEJDEUMJFHT-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+](C)[C@@H](C)c2cccnc2)o1 ZINC000537900100 338002748 /nfs/dbraw/zinc/00/27/48/338002748.db2.gz PZGHEJDEUMJFHT-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO CSCc1cnc(C[N@H+](Cc2ccccc2C)C2CC2)s1 ZINC000516100216 338004625 /nfs/dbraw/zinc/00/46/25/338004625.db2.gz WSOUPDDDOYFXEP-UHFFFAOYSA-N 1 2 318.511 4.479 20 0 DIADLO CSCc1cnc(C[N@@H+](Cc2ccccc2C)C2CC2)s1 ZINC000516100216 338004626 /nfs/dbraw/zinc/00/46/26/338004626.db2.gz WSOUPDDDOYFXEP-UHFFFAOYSA-N 1 2 318.511 4.479 20 0 DIADLO Cc1ccsc1CNc1cc[nH+]c(OCC(F)(F)F)c1 ZINC000516359436 338010706 /nfs/dbraw/zinc/01/07/06/338010706.db2.gz PTPMVHAFHFXKMK-UHFFFAOYSA-N 1 2 302.321 4.005 20 0 DIADLO COc1ccc(C[NH2+][C@@H](C)c2cscn2)cc1OCC(C)C ZINC000516492244 338013731 /nfs/dbraw/zinc/01/37/31/338013731.db2.gz ILRHHKDTMLABLO-ZDUSSCGKSA-N 1 2 320.458 4.037 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NC(=O)C(C)(C)c2ccccc2)c1 ZINC000516533718 338014757 /nfs/dbraw/zinc/01/47/57/338014757.db2.gz GPXCFPVMPJSPQN-UHFFFAOYSA-N 1 2 319.408 4.003 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccccc1CCC(F)(F)F ZINC000425596406 338015841 /nfs/dbraw/zinc/01/58/41/338015841.db2.gz NECMEIDVCCSCIC-UHFFFAOYSA-N 1 2 322.330 4.446 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)C1(Cc2ccc(Cl)cc2)CC1 ZINC000425598078 338015919 /nfs/dbraw/zinc/01/59/19/338015919.db2.gz VMMYSZRMSAVDGV-UHFFFAOYSA-N 1 2 314.816 4.313 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cc3ccc(C)cc3o2)s1 ZINC000426032765 338019939 /nfs/dbraw/zinc/01/99/39/338019939.db2.gz AAXVRCNEEJBDRC-GHMZBOCLSA-N 1 2 301.415 4.313 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)s1 ZINC000426032769 338019966 /nfs/dbraw/zinc/01/99/66/338019966.db2.gz AAXVRCNEEJBDRC-WDEREUQCSA-N 1 2 301.415 4.313 20 0 DIADLO Cc1cn2cc(NC(=O)N3CCC[C@@H]3CCC(C)C)ccc2[nH+]1 ZINC000426101791 338020413 /nfs/dbraw/zinc/02/04/13/338020413.db2.gz CJXULWZAYOMAFJ-MRXNPFEDSA-N 1 2 314.433 4.075 20 0 DIADLO COc1cc(C)[nH+]c(CNc2ccc(-c3ccco3)cc2F)c1 ZINC000426549574 338034600 /nfs/dbraw/zinc/03/46/00/338034600.db2.gz SDRPVTFBSQLMDA-UHFFFAOYSA-N 1 2 312.344 4.410 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nnc(C(C)C)[nH]2)o1 ZINC000428235546 338043500 /nfs/dbraw/zinc/04/35/00/338043500.db2.gz BVKWSZGBJXTPEI-HNNXBMFYSA-N 1 2 316.449 4.201 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@H+]2Cc2nnc(C(C)C)[nH]2)o1 ZINC000428235546 338043501 /nfs/dbraw/zinc/04/35/01/338043501.db2.gz BVKWSZGBJXTPEI-HNNXBMFYSA-N 1 2 316.449 4.201 20 0 DIADLO CCCc1nc(C)c(C[N@@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)o1 ZINC000428245477 338044208 /nfs/dbraw/zinc/04/42/08/338044208.db2.gz KBAFITDGWDRZBL-LBPRGKRZSA-N 1 2 320.383 4.333 20 0 DIADLO CCCc1nc(C)c(C[N@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)o1 ZINC000428245477 338044209 /nfs/dbraw/zinc/04/42/09/338044209.db2.gz KBAFITDGWDRZBL-LBPRGKRZSA-N 1 2 320.383 4.333 20 0 DIADLO CC(C)c1nnc(C[N@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)[nH]1 ZINC000428366775 338048992 /nfs/dbraw/zinc/04/89/92/338048992.db2.gz ZFOUSBUCKUGLJA-LBPRGKRZSA-N 1 2 318.852 4.307 20 0 DIADLO CC(C)c1nnc(C[N@@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)[nH]1 ZINC000428366775 338048993 /nfs/dbraw/zinc/04/89/93/338048993.db2.gz ZFOUSBUCKUGLJA-LBPRGKRZSA-N 1 2 318.852 4.307 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H]2COCc3ccccc32)cs1 ZINC000428451475 338052362 /nfs/dbraw/zinc/05/23/62/338052362.db2.gz BRICIQJPXHYPNE-IUODEOHRSA-N 1 2 302.443 4.189 20 0 DIADLO CC[N@H+](Cc1nnc(C(C)C)[nH]1)[C@@H](C)c1cc2ccccc2o1 ZINC000428458399 338052883 /nfs/dbraw/zinc/05/28/83/338052883.db2.gz BQEZJXPMXNQVTC-ZDUSSCGKSA-N 1 2 312.417 4.257 20 0 DIADLO CC[N@@H+](Cc1nnc(C(C)C)[nH]1)[C@@H](C)c1cc2ccccc2o1 ZINC000428458399 338052884 /nfs/dbraw/zinc/05/28/84/338052884.db2.gz BQEZJXPMXNQVTC-ZDUSSCGKSA-N 1 2 312.417 4.257 20 0 DIADLO Cc1nc(C[N@@H+](C)C[C@H](OC(C)C)c2ccccc2)cs1 ZINC000428473608 338054144 /nfs/dbraw/zinc/05/41/44/338054144.db2.gz NGDHYQUECNCVEB-KRWDZBQOSA-N 1 2 304.459 4.050 20 0 DIADLO Cc1nc(C[N@H+](C)C[C@H](OC(C)C)c2ccccc2)cs1 ZINC000428473608 338054145 /nfs/dbraw/zinc/05/41/45/338054145.db2.gz NGDHYQUECNCVEB-KRWDZBQOSA-N 1 2 304.459 4.050 20 0 DIADLO CCc1nc(C)c(C[N@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC000428484360 338054690 /nfs/dbraw/zinc/05/46/90/338054690.db2.gz LZNBFNGSYOXUEH-BLLLJJGKSA-N 1 2 314.429 4.426 20 0 DIADLO CCc1nc(C)c(C[N@@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC000428484360 338054691 /nfs/dbraw/zinc/05/46/91/338054691.db2.gz LZNBFNGSYOXUEH-BLLLJJGKSA-N 1 2 314.429 4.426 20 0 DIADLO Fc1ccc2cc[nH+]c(N3CCC(c4ccncc4)CC3)c2c1 ZINC000428662701 338058177 /nfs/dbraw/zinc/05/81/77/338058177.db2.gz CZWXEMIIVAGADD-UHFFFAOYSA-N 1 2 307.372 4.153 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc3ccccc3n2C)c(Cl)c1 ZINC000428723879 338059639 /nfs/dbraw/zinc/05/96/39/338059639.db2.gz OJDNUMHMFQJXFF-UHFFFAOYSA-N 1 2 313.832 4.167 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc3ccccc3n2C)c(Cl)c1 ZINC000428723879 338059640 /nfs/dbraw/zinc/05/96/40/338059640.db2.gz OJDNUMHMFQJXFF-UHFFFAOYSA-N 1 2 313.832 4.167 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)cs1 ZINC000428736367 338060045 /nfs/dbraw/zinc/06/00/45/338060045.db2.gz ZBEPAJOERZELSH-HIFRSBDPSA-N 1 2 314.445 4.209 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)cs1 ZINC000428736367 338060046 /nfs/dbraw/zinc/06/00/46/338060046.db2.gz ZBEPAJOERZELSH-HIFRSBDPSA-N 1 2 314.445 4.209 20 0 DIADLO CC(=O)Nc1nc(C[N@@H+](C(C)C)[C@@H](C)c2ccccc2)cs1 ZINC000428878826 338064354 /nfs/dbraw/zinc/06/43/54/338064354.db2.gz FXTQPHJVAIBHJZ-ZDUSSCGKSA-N 1 2 317.458 4.073 20 0 DIADLO CC(=O)Nc1nc(C[N@H+](C(C)C)[C@@H](C)c2ccccc2)cs1 ZINC000428878826 338064355 /nfs/dbraw/zinc/06/43/55/338064355.db2.gz FXTQPHJVAIBHJZ-ZDUSSCGKSA-N 1 2 317.458 4.073 20 0 DIADLO CC[C@H](F)C[N@@H+]1C[C@H](C)O[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000428933381 338065424 /nfs/dbraw/zinc/06/54/24/338065424.db2.gz UMFPPVPJXVCPCO-TUKIKUTGSA-N 1 2 319.342 4.215 20 0 DIADLO CC[C@H](F)C[N@H+]1C[C@H](C)O[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000428933381 338065425 /nfs/dbraw/zinc/06/54/25/338065425.db2.gz UMFPPVPJXVCPCO-TUKIKUTGSA-N 1 2 319.342 4.215 20 0 DIADLO C[C@H]1C[N@H+](Cc2nc(C(C)(C)C)cs2)Cc2ccccc2O1 ZINC000429147484 338071804 /nfs/dbraw/zinc/07/18/04/338071804.db2.gz FYRUQLAOEUUHKS-ZDUSSCGKSA-N 1 2 316.470 4.224 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nc(C(C)(C)C)cs2)Cc2ccccc2O1 ZINC000429147484 338071805 /nfs/dbraw/zinc/07/18/05/338071805.db2.gz FYRUQLAOEUUHKS-ZDUSSCGKSA-N 1 2 316.470 4.224 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC000429164448 338072410 /nfs/dbraw/zinc/07/24/10/338072410.db2.gz CQIWHYUBMSYCID-KGLIPLIRSA-N 1 2 314.429 4.316 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC000429164448 338072411 /nfs/dbraw/zinc/07/24/11/338072411.db2.gz CQIWHYUBMSYCID-KGLIPLIRSA-N 1 2 314.429 4.316 20 0 DIADLO CC[C@@H]1CC[N@@H+]1Cc1csc(COc2ccc(C)cc2)n1 ZINC000429278142 338075773 /nfs/dbraw/zinc/07/57/73/338075773.db2.gz PVWAFERFWKKRLT-OAHLLOKOSA-N 1 2 302.443 4.015 20 0 DIADLO CC[C@@H]1CC[N@H+]1Cc1csc(COc2ccc(C)cc2)n1 ZINC000429278142 338075774 /nfs/dbraw/zinc/07/57/74/338075774.db2.gz PVWAFERFWKKRLT-OAHLLOKOSA-N 1 2 302.443 4.015 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@@H](C)C(=O)Nc1cc(Cl)ccc1C ZINC000429367775 338078665 /nfs/dbraw/zinc/07/86/65/338078665.db2.gz OTZGEWMCTDPVDG-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@@H](C)C(=O)Nc1cc(Cl)ccc1C ZINC000429367775 338078666 /nfs/dbraw/zinc/07/86/66/338078666.db2.gz OTZGEWMCTDPVDG-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1csc(Cc2ccccc2)n1 ZINC000429377852 338079038 /nfs/dbraw/zinc/07/90/38/338079038.db2.gz LAPFFSZKWWMCDO-UHFFFAOYSA-N 1 2 312.438 4.267 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1csc(Cc2ccccc2)n1 ZINC000429377852 338079039 /nfs/dbraw/zinc/07/90/39/338079039.db2.gz LAPFFSZKWWMCDO-UHFFFAOYSA-N 1 2 312.438 4.267 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2cc(C(C)(C)C)on2)s1 ZINC000429697936 338087622 /nfs/dbraw/zinc/08/76/22/338087622.db2.gz MSUNGOYXWJESMP-LBPRGKRZSA-N 1 2 321.490 4.492 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2cc(C(C)(C)C)on2)s1 ZINC000429697936 338087623 /nfs/dbraw/zinc/08/76/23/338087623.db2.gz MSUNGOYXWJESMP-LBPRGKRZSA-N 1 2 321.490 4.492 20 0 DIADLO CC(C)(C)c1cc(C[N@H+](Cc2cccc(F)c2)C2CC2)no1 ZINC000429726335 338088376 /nfs/dbraw/zinc/08/83/76/338088376.db2.gz PPVPYBASDXNCKS-UHFFFAOYSA-N 1 2 302.393 4.276 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+](Cc2cccc(F)c2)C2CC2)no1 ZINC000429726335 338088377 /nfs/dbraw/zinc/08/83/77/338088377.db2.gz PPVPYBASDXNCKS-UHFFFAOYSA-N 1 2 302.393 4.276 20 0 DIADLO CCC(CC)n1ccc(C[N@H+](CC)Cc2cccc(F)c2)n1 ZINC000448468319 338093151 /nfs/dbraw/zinc/09/31/51/338093151.db2.gz UDKLCPRQCYSSRQ-UHFFFAOYSA-N 1 2 303.425 4.405 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+](CC)Cc2cccc(F)c2)n1 ZINC000448468319 338093152 /nfs/dbraw/zinc/09/31/52/338093152.db2.gz UDKLCPRQCYSSRQ-UHFFFAOYSA-N 1 2 303.425 4.405 20 0 DIADLO CC1(C)C[N@H+](Cc2c[nH]nc2-c2ccsc2)[C@H]1c1cccnc1 ZINC000430101799 338096659 /nfs/dbraw/zinc/09/66/59/338096659.db2.gz OHYBHCWGTKFIOA-KRWDZBQOSA-N 1 2 324.453 4.116 20 0 DIADLO CC1(C)C[N@@H+](Cc2c[nH]nc2-c2ccsc2)[C@H]1c1cccnc1 ZINC000430101799 338096660 /nfs/dbraw/zinc/09/66/60/338096660.db2.gz OHYBHCWGTKFIOA-KRWDZBQOSA-N 1 2 324.453 4.116 20 0 DIADLO CC1(C)C[N@H+](Cc2c[nH]nc2-c2cccs2)[C@H]1c1cccnc1 ZINC000430106326 338097025 /nfs/dbraw/zinc/09/70/25/338097025.db2.gz PRUMYFGJYYWOOV-KRWDZBQOSA-N 1 2 324.453 4.116 20 0 DIADLO CC1(C)C[N@@H+](Cc2c[nH]nc2-c2cccs2)[C@H]1c1cccnc1 ZINC000430106326 338097026 /nfs/dbraw/zinc/09/70/26/338097026.db2.gz PRUMYFGJYYWOOV-KRWDZBQOSA-N 1 2 324.453 4.116 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)Nc1ccc(C)s1 ZINC000430373862 338106059 /nfs/dbraw/zinc/10/60/59/338106059.db2.gz JSQBNTHSTRQVJF-CYBMUJFWSA-N 1 2 318.446 4.032 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000430866290 338117442 /nfs/dbraw/zinc/11/74/42/338117442.db2.gz GFTNQSCCPXMQCV-XIRDDKMYSA-N 1 2 313.445 4.347 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000430866290 338117443 /nfs/dbraw/zinc/11/74/43/338117443.db2.gz GFTNQSCCPXMQCV-XIRDDKMYSA-N 1 2 313.445 4.347 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1cc(F)c(F)c(F)c1 ZINC000430870046 338117652 /nfs/dbraw/zinc/11/76/52/338117652.db2.gz RUZSXHIHJCEUSE-OAHLLOKOSA-N 1 2 323.362 4.048 20 0 DIADLO Cn1c2cc(F)ccc2[nH+]c1N1CCC[C@H]1c1cccc(F)c1 ZINC000431038381 338120995 /nfs/dbraw/zinc/12/09/95/338120995.db2.gz NOCGDQNJBKBMKX-INIZCTEOSA-N 1 2 313.351 4.193 20 0 DIADLO Fc1cccc(F)c1-c1csc(COc2cc[nH+]cc2)n1 ZINC000431521760 338133099 /nfs/dbraw/zinc/13/30/99/338133099.db2.gz VCZKBGYFOIVCCP-UHFFFAOYSA-N 1 2 304.321 4.062 20 0 DIADLO CC(C)c1nc(N2CC[C@@H](c3cccc(Cl)c3)C2)cc[nH+]1 ZINC000432132351 338146550 /nfs/dbraw/zinc/14/65/50/338146550.db2.gz BPDKBMHJBPYDED-CQSZACIVSA-N 1 2 301.821 4.247 20 0 DIADLO Cc1cc(N2CC3(CCC3)[C@H]2c2ccccc2)nc(C2CC2)[nH+]1 ZINC000432145692 338147077 /nfs/dbraw/zinc/14/70/77/338147077.db2.gz VNOJTQBUHHHKKN-GOSISDBHSA-N 1 2 305.425 4.394 20 0 DIADLO Clc1scc(C[NH2+]Cc2cn3ccsc3n2)c1Cl ZINC000432235767 338149594 /nfs/dbraw/zinc/14/95/94/338149594.db2.gz MEFPJJVGFNHVNG-UHFFFAOYSA-N 1 2 318.254 4.054 20 0 DIADLO CC(C)c1nnc([C@@H](C)[NH2+]Cc2csc(Cl)c2Cl)[nH]1 ZINC000432254284 338151175 /nfs/dbraw/zinc/15/11/75/338151175.db2.gz NYVDMLKVVDDGBS-SSDOTTSWSA-N 1 2 319.261 4.147 20 0 DIADLO Cc1c(F)ccc(Cl)c1NCc1[nH+]ccn1CC(F)(F)F ZINC000432707312 338163714 /nfs/dbraw/zinc/16/37/14/338163714.db2.gz KRVOYHUABAGUJR-UHFFFAOYSA-N 1 2 321.705 4.158 20 0 DIADLO Cc1c(CNc2ccc(-c3ccc(Cl)s3)c[nH+]2)cnn1C ZINC000432734485 338164855 /nfs/dbraw/zinc/16/48/55/338164855.db2.gz TUPNNOZSUNWKPT-UHFFFAOYSA-N 1 2 318.833 4.118 20 0 DIADLO C[N@H+](Cc1nc2ccc(F)cc2s1)Cc1ccccc1F ZINC000432742772 338165602 /nfs/dbraw/zinc/16/56/02/338165602.db2.gz VCXUVRRYZUHMNQ-UHFFFAOYSA-N 1 2 304.365 4.207 20 0 DIADLO C[N@@H+](Cc1nc2ccc(F)cc2s1)Cc1ccccc1F ZINC000432742772 338165603 /nfs/dbraw/zinc/16/56/03/338165603.db2.gz VCXUVRRYZUHMNQ-UHFFFAOYSA-N 1 2 304.365 4.207 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCc3ccsc3C2)s1 ZINC000432748397 338166140 /nfs/dbraw/zinc/16/61/40/338166140.db2.gz CSEKVKXUMRJYGR-UHFFFAOYSA-N 1 2 303.374 4.387 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCc3ccsc3C2)s1 ZINC000432748397 338166141 /nfs/dbraw/zinc/16/61/41/338166141.db2.gz CSEKVKXUMRJYGR-UHFFFAOYSA-N 1 2 303.374 4.387 20 0 DIADLO OCc1cccc(NCc2ccc(Oc3cccc(F)c3)cc2)[nH+]1 ZINC000432748674 338166150 /nfs/dbraw/zinc/16/61/50/338166150.db2.gz DMGSDCAHBSZRTG-UHFFFAOYSA-N 1 2 324.355 4.117 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCc4c(F)cccc4C3)sc2c1 ZINC000432750329 338166197 /nfs/dbraw/zinc/16/61/97/338166197.db2.gz CEMDRRSYHRUUPC-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCc4c(F)cccc4C3)sc2c1 ZINC000432750329 338166198 /nfs/dbraw/zinc/16/61/98/338166198.db2.gz CEMDRRSYHRUUPC-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+](C2CC2)[C@@H]2CCCc3ccccc32)[nH]1 ZINC000432829074 338169595 /nfs/dbraw/zinc/16/95/95/338169595.db2.gz MLXNLLSGSYLZDT-QGZVFWFLSA-N 1 2 324.472 4.144 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+](C2CC2)[C@@H]2CCCc3ccccc32)[nH]1 ZINC000432829074 338169596 /nfs/dbraw/zinc/16/95/96/338169596.db2.gz MLXNLLSGSYLZDT-QGZVFWFLSA-N 1 2 324.472 4.144 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432919899 338173045 /nfs/dbraw/zinc/17/30/45/338173045.db2.gz WCDSHSGQOFIPPD-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432919899 338173046 /nfs/dbraw/zinc/17/30/46/338173046.db2.gz WCDSHSGQOFIPPD-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCc4cc(F)ccc4C3)sc2c1 ZINC000432923640 338173300 /nfs/dbraw/zinc/17/33/00/338173300.db2.gz GZOQBGFTLZUTJB-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCc4cc(F)ccc4C3)sc2c1 ZINC000432923640 338173301 /nfs/dbraw/zinc/17/33/01/338173301.db2.gz GZOQBGFTLZUTJB-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO Cc1ccc(C(=O)CC[NH2+][C@H](c2ccccc2)C(F)F)cc1 ZINC000433044330 338178117 /nfs/dbraw/zinc/17/81/17/338178117.db2.gz ASJGCJQDLYOWLP-QGZVFWFLSA-N 1 2 303.352 4.164 20 0 DIADLO FC(F)[C@H](NCc1cn2cc(Cl)ccc2[nH+]1)c1ccccc1 ZINC000433079640 338180565 /nfs/dbraw/zinc/18/05/65/338180565.db2.gz XJPKJOCZLMFNDS-OAHLLOKOSA-N 1 2 321.758 4.084 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1ccc(F)cn1 ZINC000433107177 338182130 /nfs/dbraw/zinc/18/21/30/338182130.db2.gz XVSLAQVETXDWBN-MRVPVSSYSA-N 1 2 300.711 4.003 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)no1 ZINC000433291201 338189621 /nfs/dbraw/zinc/18/96/21/338189621.db2.gz VCPPKGPXPZEYEY-ZDUSSCGKSA-N 1 2 319.836 4.010 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)no1 ZINC000433291201 338189622 /nfs/dbraw/zinc/18/96/22/338189622.db2.gz VCPPKGPXPZEYEY-ZDUSSCGKSA-N 1 2 319.836 4.010 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncc(C(F)(F)F)s1)c1c(C)noc1C ZINC000433333565 338192905 /nfs/dbraw/zinc/19/29/05/338192905.db2.gz HKXVAHMDGMONIG-SECBINFHSA-N 1 2 319.352 4.008 20 0 DIADLO Cc1ccc([C@]2(C)CCN(C(=O)Nc3ccc(C)[nH+]c3C)C2)cc1 ZINC000433590998 338197575 /nfs/dbraw/zinc/19/75/75/338197575.db2.gz OGSYHMSRVKIRFT-HXUWFJFHSA-N 1 2 323.440 4.202 20 0 DIADLO Cc1nc(N2CCc3cc(Cl)cc(Cl)c3[C@H]2C)cc[nH+]1 ZINC000433624928 338198630 /nfs/dbraw/zinc/19/86/30/338198630.db2.gz NYEHVZRQGCVNAF-SECBINFHSA-N 1 2 308.212 4.216 20 0 DIADLO Cc1cccc([C@@H]2CCCN2c2[nH+]c(C)nc3[nH]ccc32)c1C ZINC000433777451 338201596 /nfs/dbraw/zinc/20/15/96/338201596.db2.gz MBTYYFPNJDDFTO-KRWDZBQOSA-N 1 2 306.413 4.225 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000433782945 338201664 /nfs/dbraw/zinc/20/16/64/338201664.db2.gz LRFIOQOHPLINEH-NHYWBVRUSA-N 1 2 307.825 4.333 20 0 DIADLO COc1ccc([C@@H](Nc2[nH+]c(C)nc3[nH]ccc32)C(C)C)cc1 ZINC000433800763 338202231 /nfs/dbraw/zinc/20/22/31/338202231.db2.gz WTYIDRUYIFXNSN-INIZCTEOSA-N 1 2 310.401 4.084 20 0 DIADLO Cc1ncsc1CN(C)c1cc(C(C)(C)C)[nH+]c(C(C)C)n1 ZINC000434103087 338209496 /nfs/dbraw/zinc/20/94/96/338209496.db2.gz WMTMNDHOEOUMIR-UHFFFAOYSA-N 1 2 318.490 4.299 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)[C@H](c2ccc(F)cc2)C(C)C)no1 ZINC000434626489 338221724 /nfs/dbraw/zinc/22/17/24/338221724.db2.gz YTJPGFDWLULGRK-INIZCTEOSA-N 1 2 305.397 4.161 20 0 DIADLO CC(C)c1nc(C[N@H+](C)[C@H](c2ccc(F)cc2)C(C)C)no1 ZINC000434626489 338221725 /nfs/dbraw/zinc/22/17/25/338221725.db2.gz YTJPGFDWLULGRK-INIZCTEOSA-N 1 2 305.397 4.161 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2ncc(C(F)(F)F)s2)cc1 ZINC000434834792 338226171 /nfs/dbraw/zinc/22/61/71/338226171.db2.gz VBAWXKHIAPQEOD-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2ncc(C(F)(F)F)s2)cc1 ZINC000434834792 338226172 /nfs/dbraw/zinc/22/61/72/338226172.db2.gz VBAWXKHIAPQEOD-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO C[C@H]1CC[C@@]2(CC[N@H+](Cc3ncc(C(F)(F)F)s3)C2)C1 ZINC000434980870 338228555 /nfs/dbraw/zinc/22/85/55/338228555.db2.gz HHHDIKJRCWEIHJ-GXFFZTMASA-N 1 2 304.381 4.174 20 0 DIADLO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3ncc(C(F)(F)F)s3)C2)C1 ZINC000434980870 338228556 /nfs/dbraw/zinc/22/85/56/338228556.db2.gz HHHDIKJRCWEIHJ-GXFFZTMASA-N 1 2 304.381 4.174 20 0 DIADLO COc1cc(C[N@@H+]2CC[C@H]2c2ccccc2)cc(Cl)c1OC ZINC000434985054 338228719 /nfs/dbraw/zinc/22/87/19/338228719.db2.gz FPVQUBCXUMVKQR-INIZCTEOSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(C[N@H+]2CC[C@H]2c2ccccc2)cc(Cl)c1OC ZINC000434985054 338228720 /nfs/dbraw/zinc/22/87/20/338228720.db2.gz FPVQUBCXUMVKQR-INIZCTEOSA-N 1 2 317.816 4.304 20 0 DIADLO C/C(=C\c1ccccc1)C[NH2+]Cc1noc(-c2ccccc2F)n1 ZINC000435023869 338229683 /nfs/dbraw/zinc/22/96/83/338229683.db2.gz OPKZVIDXZXNOSX-SDNWHVSQSA-N 1 2 323.371 4.069 20 0 DIADLO CCc1occc1C(=O)Nc1ccc2[nH]c(C(C)(C)C)[nH+]c2c1 ZINC000435405849 338239276 /nfs/dbraw/zinc/23/92/76/338239276.db2.gz REEIALINDXNPOP-UHFFFAOYSA-N 1 2 311.385 4.268 20 0 DIADLO CCc1ccnc(CNc2c(C)c[nH+]c3c(OC)cccc23)c1 ZINC000435589027 338243016 /nfs/dbraw/zinc/24/30/16/338243016.db2.gz NWVBZITWEUZNAQ-UHFFFAOYSA-N 1 2 307.397 4.121 20 0 DIADLO CCc1ccccc1CCn1nc(C(F)(F)F)c2c[nH+]ccc21 ZINC000435791930 338249458 /nfs/dbraw/zinc/24/94/58/338249458.db2.gz RUQWXPJMEDRFKP-UHFFFAOYSA-N 1 2 319.330 4.255 20 0 DIADLO CCc1ccc([C@H](C)[NH2+]Cc2nc(Cc3ccccc3)no2)cc1 ZINC000154929643 338253265 /nfs/dbraw/zinc/25/32/65/338253265.db2.gz NJCUCHAHMXQKMJ-HNNXBMFYSA-N 1 2 321.424 4.074 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)[C@H](C)CC(C)(C)C ZINC000435981139 338255009 /nfs/dbraw/zinc/25/50/09/338255009.db2.gz IFWOGRMRVHCRHL-CABCVRRESA-N 1 2 305.466 4.029 20 0 DIADLO Cc1ccc(C(=O)N2CC(C)=C[C@@H](C)C2)cc1Oc1cc[nH+]cc1 ZINC000436014826 338255832 /nfs/dbraw/zinc/25/58/32/338255832.db2.gz SWDATXBKDMGGSC-CQSZACIVSA-N 1 2 322.408 4.221 20 0 DIADLO CC1=C(C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)CCC1 ZINC000436165761 338260272 /nfs/dbraw/zinc/26/02/72/338260272.db2.gz YYLCQDGPEUPGBW-UHFFFAOYSA-N 1 2 321.424 4.325 20 0 DIADLO C[C@H]1CC[C@H](C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)C1 ZINC000436173081 338260633 /nfs/dbraw/zinc/26/06/33/338260633.db2.gz AJMGKRBMSZARMX-HOCLYGCPSA-N 1 2 323.440 4.261 20 0 DIADLO CC1=CCC[N@@H+]([C@@H](C)c2nc(Cc3ccc(Cl)cc3)no2)C1 ZINC000436260558 338264171 /nfs/dbraw/zinc/26/41/71/338264171.db2.gz OESHUNKGPWVLAO-ZDUSSCGKSA-N 1 2 317.820 4.027 20 0 DIADLO CC1=CCC[N@H+]([C@@H](C)c2nc(Cc3ccc(Cl)cc3)no2)C1 ZINC000436260558 338264172 /nfs/dbraw/zinc/26/41/72/338264172.db2.gz OESHUNKGPWVLAO-ZDUSSCGKSA-N 1 2 317.820 4.027 20 0 DIADLO CCOc1ccc([C@@H]([NH2+]CCF)c2ccccc2Cl)cc1 ZINC000436295893 338267105 /nfs/dbraw/zinc/26/71/05/338267105.db2.gz SLAXZYUDZXLCRH-QGZVFWFLSA-N 1 2 307.796 4.387 20 0 DIADLO CSc1cccc([C@@H]([NH2+]CCF)c2cc(F)ccc2F)c1 ZINC000436298676 338267407 /nfs/dbraw/zinc/26/74/07/338267407.db2.gz ZTHJOFCLFJQRSX-MRXNPFEDSA-N 1 2 311.372 4.335 20 0 DIADLO Cc1cc(C)c(NC(=O)N2[C@H](C)C[C@@H]3CCCC[C@@H]32)c(C)[nH+]1 ZINC000436486988 338273896 /nfs/dbraw/zinc/27/38/96/338273896.db2.gz CKJPQQKHDBEWGP-KBMXLJTQSA-N 1 2 301.434 4.192 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H]2C2CCCC2)c(C)[nH+]1 ZINC000436491308 338274225 /nfs/dbraw/zinc/27/42/25/338274225.db2.gz IEFPRVSYUNKPEH-MRXNPFEDSA-N 1 2 301.434 4.193 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@H](C)[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC000436500320 338274457 /nfs/dbraw/zinc/27/44/57/338274457.db2.gz ZLGBQBRKLKWIFM-SCLBCKFNSA-N 1 2 309.413 4.232 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](Cc2ccccc2)C2CC2)c(C)[nH+]1 ZINC000436499873 338274548 /nfs/dbraw/zinc/27/45/48/338274548.db2.gz XYVZNPUZTODASY-GOSISDBHSA-N 1 2 323.440 4.150 20 0 DIADLO CSc1ccc(OCc2c[nH+]cn2Cc2ccccc2)cc1 ZINC000437604109 338315942 /nfs/dbraw/zinc/31/59/42/338315942.db2.gz PVZVMKRNWYCEKP-UHFFFAOYSA-N 1 2 310.422 4.232 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1COc1cccc2cccnc21 ZINC000437607621 338316064 /nfs/dbraw/zinc/31/60/64/338316064.db2.gz XGJHWJPQEJSFHV-UHFFFAOYSA-N 1 2 315.376 4.059 20 0 DIADLO Cn1ncc(Cl)c1C[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000437772441 338320803 /nfs/dbraw/zinc/32/08/03/338320803.db2.gz HVTAQWVPARWXKA-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1ncc(Cl)c1C[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000437772441 338320804 /nfs/dbraw/zinc/32/08/04/338320804.db2.gz HVTAQWVPARWXKA-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO c1c[nH]c([C@H]2CCC[N@H+]2Cc2cccc(OC3CCCC3)c2)n1 ZINC000437977933 338327111 /nfs/dbraw/zinc/32/71/11/338327111.db2.gz UFYXUSVQUOAHOT-GOSISDBHSA-N 1 2 311.429 4.068 20 0 DIADLO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2cccc(OC3CCCC3)c2)n1 ZINC000437977933 338327112 /nfs/dbraw/zinc/32/71/12/338327112.db2.gz UFYXUSVQUOAHOT-GOSISDBHSA-N 1 2 311.429 4.068 20 0 DIADLO Fc1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)o1 ZINC000437995398 338327776 /nfs/dbraw/zinc/32/77/76/338327776.db2.gz RGDFKPQCLWKBDS-MRXNPFEDSA-N 1 2 311.360 4.146 20 0 DIADLO Fc1ccccc1-c1ccc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)o1 ZINC000437995398 338327777 /nfs/dbraw/zinc/32/77/77/338327777.db2.gz RGDFKPQCLWKBDS-MRXNPFEDSA-N 1 2 311.360 4.146 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NCCCCOc2ccccc2)c1 ZINC000438083706 338330394 /nfs/dbraw/zinc/33/03/94/338330394.db2.gz YLJJGRHEXMHJKI-UHFFFAOYSA-N 1 2 321.424 4.358 20 0 DIADLO Cc1cccn2cc(-c3ccc(NCC[C@@H]4CCOC4)cc3)[nH+]c12 ZINC000438087745 338330700 /nfs/dbraw/zinc/33/07/00/338330700.db2.gz HCPXPMDZPYAUTJ-MRXNPFEDSA-N 1 2 321.424 4.148 20 0 DIADLO CC(C)N(C)c1ccccc1C[NH2+]Cc1csc(C2CC2)n1 ZINC000438335203 338340138 /nfs/dbraw/zinc/34/01/38/338340138.db2.gz OSVQQVXSTMFGLT-UHFFFAOYSA-N 1 2 315.486 4.155 20 0 DIADLO c1cc(Oc2ccccc2)oc1C[N@@H+]1CCc2ncsc2C1 ZINC000438375182 338341971 /nfs/dbraw/zinc/34/19/71/338341971.db2.gz MSFHZVXVCMKNQO-UHFFFAOYSA-N 1 2 312.394 4.087 20 0 DIADLO c1cc(Oc2ccccc2)oc1C[N@H+]1CCc2ncsc2C1 ZINC000438375182 338341972 /nfs/dbraw/zinc/34/19/72/338341972.db2.gz MSFHZVXVCMKNQO-UHFFFAOYSA-N 1 2 312.394 4.087 20 0 DIADLO CCC(CC)n1ccc(C[N@H+](CCC(F)(F)F)CC2CC2)n1 ZINC000438476337 338345214 /nfs/dbraw/zinc/34/52/14/338345214.db2.gz HQXVOOQXKYPJOC-UHFFFAOYSA-N 1 2 317.399 4.409 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+](CCC(F)(F)F)CC2CC2)n1 ZINC000438476337 338345215 /nfs/dbraw/zinc/34/52/15/338345215.db2.gz HQXVOOQXKYPJOC-UHFFFAOYSA-N 1 2 317.399 4.409 20 0 DIADLO Cc1ccoc1C[N@H+]1C[C@H](c2cccc(Cl)c2)OC[C@H]1C ZINC000438553579 338347848 /nfs/dbraw/zinc/34/78/48/338347848.db2.gz LNHYMFMATWGCBC-CXAGYDPISA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccoc1C[N@@H+]1C[C@H](c2cccc(Cl)c2)OC[C@H]1C ZINC000438553579 338347849 /nfs/dbraw/zinc/34/78/49/338347849.db2.gz LNHYMFMATWGCBC-CXAGYDPISA-N 1 2 305.805 4.203 20 0 DIADLO Cc1cccnc1C[N@H+]1C[C@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000438554726 338348019 /nfs/dbraw/zinc/34/80/19/338348019.db2.gz VVZUOGTXPYKYPL-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cccnc1C[N@@H+]1C[C@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000438554726 338348020 /nfs/dbraw/zinc/34/80/20/338348020.db2.gz VVZUOGTXPYKYPL-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCOC3(C2)CCCCCC3)n1 ZINC000438638013 338350507 /nfs/dbraw/zinc/35/05/07/338350507.db2.gz CFNKMOIBFWTZKJ-UHFFFAOYSA-N 1 2 319.493 4.169 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCOC3(C2)CCCCCC3)n1 ZINC000438638013 338350508 /nfs/dbraw/zinc/35/05/08/338350508.db2.gz CFNKMOIBFWTZKJ-UHFFFAOYSA-N 1 2 319.493 4.169 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CCCCC[C@H]2c2ccncc2)c1F ZINC000438856553 338354104 /nfs/dbraw/zinc/35/41/04/338354104.db2.gz XBURTMYYIOMIFI-INIZCTEOSA-N 1 2 318.367 4.183 20 0 DIADLO Oc1ccc(F)c(C[N@H+]2CCCCC[C@H]2c2ccncc2)c1F ZINC000438856553 338354105 /nfs/dbraw/zinc/35/41/05/338354105.db2.gz XBURTMYYIOMIFI-INIZCTEOSA-N 1 2 318.367 4.183 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2C[C@H](C)Sc3sccc32)cs1 ZINC000156425773 338359416 /nfs/dbraw/zinc/35/94/16/338359416.db2.gz PWSDSGBHUQIRKN-JOYOIKCWSA-N 1 2 310.513 4.482 20 0 DIADLO CC[N@H+](Cc1cncc(C)c1)Cc1ccccc1Br ZINC000439314241 338366807 /nfs/dbraw/zinc/36/68/07/338366807.db2.gz GBEBHKRCVKXQCD-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1cncc(C)c1)Cc1ccccc1Br ZINC000439314241 338366808 /nfs/dbraw/zinc/36/68/08/338366808.db2.gz GBEBHKRCVKXQCD-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+]3CCC[C@H](C(F)(F)F)C3)o2)cc1 ZINC000439312542 338366849 /nfs/dbraw/zinc/36/68/49/338366849.db2.gz CRCCFOYQTTUPFQ-AWEZNQCLSA-N 1 2 324.346 4.424 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+]3CCC[C@H](C(F)(F)F)C3)o2)cc1 ZINC000439312542 338366850 /nfs/dbraw/zinc/36/68/50/338366850.db2.gz CRCCFOYQTTUPFQ-AWEZNQCLSA-N 1 2 324.346 4.424 20 0 DIADLO COC(=O)[C@H]([NH2+][C@H](C)C1CCCCC1)c1cccc(Cl)c1 ZINC000439586888 338373933 /nfs/dbraw/zinc/37/39/33/338373933.db2.gz JXOZXXHKEGGFQW-MLGOLLRUSA-N 1 2 309.837 4.113 20 0 DIADLO CC(C)c1ncc(C[N@H+](C)Cc2cccc(Cl)c2F)cn1 ZINC000440493455 338388574 /nfs/dbraw/zinc/38/85/74/338388574.db2.gz ZRZOPBFEGUJBJR-UHFFFAOYSA-N 1 2 307.800 4.025 20 0 DIADLO CC(C)c1ncc(C[N@@H+](C)Cc2cccc(Cl)c2F)cn1 ZINC000440493455 338388575 /nfs/dbraw/zinc/38/85/75/338388575.db2.gz ZRZOPBFEGUJBJR-UHFFFAOYSA-N 1 2 307.800 4.025 20 0 DIADLO CC[C@H](F)C[N@@H+]1CCCC[C@@H]1c1nc(-c2cccc(F)c2)c[nH]1 ZINC000440500168 338388615 /nfs/dbraw/zinc/38/86/15/338388615.db2.gz YJMIUGNMEUQFPD-WMLDXEAASA-N 1 2 319.399 4.491 20 0 DIADLO CC[C@H](F)C[N@H+]1CCCC[C@@H]1c1nc(-c2cccc(F)c2)c[nH]1 ZINC000440500168 338388616 /nfs/dbraw/zinc/38/86/16/338388616.db2.gz YJMIUGNMEUQFPD-WMLDXEAASA-N 1 2 319.399 4.491 20 0 DIADLO Cc1c[nH+]ccc1CCNc1ncnc2sc3ccccc3c21 ZINC000440666881 338394794 /nfs/dbraw/zinc/39/47/94/338394794.db2.gz HVKISDABVHQQRB-UHFFFAOYSA-N 1 2 320.421 4.203 20 0 DIADLO COc1cccc2c(N[C@@H]3CCOc4ccc(F)cc43)cc[nH+]c12 ZINC000440664839 338394843 /nfs/dbraw/zinc/39/48/43/338394843.db2.gz ZATPWEONSJWUOO-MRXNPFEDSA-N 1 2 324.355 4.318 20 0 DIADLO C[C@H](CCC(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000440769363 338396795 /nfs/dbraw/zinc/39/67/95/338396795.db2.gz GJYLGBGNGIMRSV-MRXNPFEDSA-N 1 2 319.408 4.395 20 0 DIADLO CC[C@H](F)C[N@@H+]1CCC[C@@H]1c1nc(-c2cccc(C)c2)c[nH]1 ZINC000440778119 338397256 /nfs/dbraw/zinc/39/72/56/338397256.db2.gz AGRPMMGWPHKHJH-DOTOQJQBSA-N 1 2 301.409 4.270 20 0 DIADLO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1nc(-c2cccc(C)c2)c[nH]1 ZINC000440778119 338397257 /nfs/dbraw/zinc/39/72/57/338397257.db2.gz AGRPMMGWPHKHJH-DOTOQJQBSA-N 1 2 301.409 4.270 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+][C@H](CO)c1c(F)cccc1F ZINC000442848776 338434458 /nfs/dbraw/zinc/43/44/58/338434458.db2.gz BFASENCKXUQRNZ-IAQYHMDHSA-N 1 2 323.408 4.071 20 0 DIADLO CCCCN(C)c1ccc(C(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000446437833 338528201 /nfs/dbraw/zinc/52/82/01/338528201.db2.gz LDXKFSFLCGWMTQ-UHFFFAOYSA-N 1 2 311.429 4.187 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1ccc(C)[nH+]c1)CCCS2 ZINC000446938431 338541437 /nfs/dbraw/zinc/54/14/37/338541437.db2.gz INVQCQAEHMPYAO-INIZCTEOSA-N 1 2 300.427 4.438 20 0 DIADLO COCc1cccc(CSCc2cn3cccc(C)c3[nH+]2)c1 ZINC000446945809 338541612 /nfs/dbraw/zinc/54/16/12/338541612.db2.gz KFALWHJGRJVGOB-UHFFFAOYSA-N 1 2 312.438 4.223 20 0 DIADLO Cc1cc(N2CCC[C@@H]2c2nc3ccccc3n2C(C)C)nc[nH+]1 ZINC000447045479 338543593 /nfs/dbraw/zinc/54/35/93/338543593.db2.gz BFRDZMLTEHULJX-QGZVFWFLSA-N 1 2 321.428 4.057 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@H](Cc3ccccc3)[C@@H]2C)c(C)[nH+]1 ZINC000447168353 338546746 /nfs/dbraw/zinc/54/67/46/338546746.db2.gz MMZUKHIFFDUDTL-FUHWJXTLSA-N 1 2 323.440 4.183 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H]2CC[C@H]3CCCC[C@H]3C2)c(C)[nH+]1 ZINC000447176310 338546889 /nfs/dbraw/zinc/54/68/89/338546889.db2.gz MVKFFSSFEGBALE-OWCLPIDISA-N 1 2 301.434 4.179 20 0 DIADLO COc1cc(Cl)c(C)cc1NC(=O)Nc1ccc(C)[nH+]c1C ZINC000447181762 338547062 /nfs/dbraw/zinc/54/70/62/338547062.db2.gz FODPAJWZJWLKTP-UHFFFAOYSA-N 1 2 319.792 4.313 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+]Cc2ccn(C3CCCC3)n2)s1 ZINC000447898458 338571010 /nfs/dbraw/zinc/57/10/10/338571010.db2.gz VTHODLVVWBNDSR-UHFFFAOYSA-N 1 2 318.490 4.042 20 0 DIADLO Fc1cnccc1CNc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000449052139 338588352 /nfs/dbraw/zinc/58/83/52/338588352.db2.gz XHENNNHROQZWIJ-UHFFFAOYSA-N 1 2 322.387 4.033 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)cs1 ZINC000449122973 338595255 /nfs/dbraw/zinc/59/52/55/338595255.db2.gz MTWMGICHVPJOJC-HQJQHLMTSA-N 1 2 312.360 4.207 20 0 DIADLO COC[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccc(C)o1 ZINC000449177258 338599521 /nfs/dbraw/zinc/59/95/21/338599521.db2.gz PKPZWAWQSJLMGJ-SNVBAGLBSA-N 1 2 320.241 4.434 20 0 DIADLO Cc1cc(C[NH2+][C@@H](CO)c2c(Cl)cccc2Cl)cs1 ZINC000449296223 338610499 /nfs/dbraw/zinc/61/04/99/338610499.db2.gz APNUUHUKPHNREH-ZDUSSCGKSA-N 1 2 316.253 4.187 20 0 DIADLO C[C@H]1CSC[C@H]1Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000449281591 338609179 /nfs/dbraw/zinc/60/91/79/338609179.db2.gz DGLBGXKCRWLUSE-SUMWQHHRSA-N 1 2 313.470 4.050 20 0 DIADLO Fc1cccc(C=C2CC[NH+](Cc3ccncc3F)CC2)c1 ZINC000449324939 338613055 /nfs/dbraw/zinc/61/30/55/338613055.db2.gz IKEDSHRFVIZOJJ-UHFFFAOYSA-N 1 2 300.352 4.039 20 0 DIADLO Fc1cc(F)c2c(c1)[C@H]([NH2+]Cc1ncc(Cl)s1)CCC2 ZINC000449353108 338616833 /nfs/dbraw/zinc/61/68/33/338616833.db2.gz YDCNGOYJNWNWAY-GFCCVEGCSA-N 1 2 314.788 4.242 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(-c2ccc(F)cc2)o1 ZINC000449561979 338637938 /nfs/dbraw/zinc/63/79/38/338637938.db2.gz GDZZSPBNOAYLBG-ZDUSSCGKSA-N 1 2 313.376 4.153 20 0 DIADLO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)o2)c2nccn21 ZINC000449575411 338639469 /nfs/dbraw/zinc/63/94/69/338639469.db2.gz XUYKUADSUGVMNV-LRDDRELGSA-N 1 2 311.360 4.078 20 0 DIADLO CC(C)CC(CC(C)C)C(=O)N1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000450110145 338667550 /nfs/dbraw/zinc/66/75/50/338667550.db2.gz DJESCOHOEJMNSE-FUHWJXTLSA-N 1 2 319.493 4.001 20 0 DIADLO CCCCOC1CCN(c2[nH+]ccc3c(OC)cccc32)CC1 ZINC000450366472 338680110 /nfs/dbraw/zinc/68/01/10/338680110.db2.gz UTSBQAVAMDZTPG-UHFFFAOYSA-N 1 2 314.429 4.029 20 0 DIADLO COc1cccc2c1cc[nH+]c2NC[C@H](C)c1nc(C)cs1 ZINC000450437628 338684098 /nfs/dbraw/zinc/68/40/98/338684098.db2.gz JALJMGYMJWEPBB-NSHDSACASA-N 1 2 313.426 4.224 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1c1nc2cc(C)cc(C)c2o1 ZINC000450502839 338688177 /nfs/dbraw/zinc/68/81/77/338688177.db2.gz QOZFWMTYXRSSLN-MRXNPFEDSA-N 1 2 324.428 4.393 20 0 DIADLO COc1cccc2c1cc[nH+]c2N1CCC(CC(F)(F)F)CC1 ZINC000450519122 338689023 /nfs/dbraw/zinc/68/90/23/338689023.db2.gz RQHDIPLTAGRRMV-UHFFFAOYSA-N 1 2 324.346 4.412 20 0 DIADLO CC(C)[C@H]([NH2+][C@H](C)c1csnn1)c1ccc(Cl)cc1F ZINC000450709913 338700335 /nfs/dbraw/zinc/70/03/35/338700335.db2.gz BWZYBJJYJDGLDV-OTYXRUKQSA-N 1 2 313.829 4.379 20 0 DIADLO CCOc1cccc2cc([C@@H](C)[NH2+][C@H](C)c3csnn3)oc21 ZINC000450722520 338701385 /nfs/dbraw/zinc/70/13/85/338701385.db2.gz CIVZZMXAMSFLFB-GHMZBOCLSA-N 1 2 317.414 4.095 20 0 DIADLO CCn1cc([C@@H](C)Nc2cc[nH+]c3cc(F)c(Cl)cc23)cn1 ZINC000450869574 338709613 /nfs/dbraw/zinc/70/96/13/338709613.db2.gz BLTYSSSPEHYYLX-SNVBAGLBSA-N 1 2 318.783 4.417 20 0 DIADLO CC[C@@H]1C[C@@]1([NH2+]Cc1nnc(C2CC2)s1)c1cccc(C)c1 ZINC000450924320 338712612 /nfs/dbraw/zinc/71/26/12/338712612.db2.gz UFEWFNLDDCGJPG-KDOFPFPSSA-N 1 2 313.470 4.139 20 0 DIADLO CC(C)(C)c1csc(/C=C\c2[nH+]ccn2CC(F)(F)F)n1 ZINC000453018559 338786354 /nfs/dbraw/zinc/78/63/54/338786354.db2.gz AHEVUQFJHSIWEI-PLNGDYQASA-N 1 2 315.364 4.370 20 0 DIADLO Cc1ccccc1COc1cccc(N[C@@H]2CCn3cc[nH+]c32)c1 ZINC000453185408 338804371 /nfs/dbraw/zinc/80/43/71/338804371.db2.gz LHCDAKKCVHXMQN-LJQANCHMSA-N 1 2 319.408 4.327 20 0 DIADLO Cc1ccc(Cc2ccccn2)cc1N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000453206851 338807886 /nfs/dbraw/zinc/80/78/86/338807886.db2.gz FNWUZPNVLMRKHR-BEFAXECRSA-N 1 2 318.424 4.295 20 0 DIADLO CC[C@H]([NH2+][C@@H](COC)c1cccc(C(F)(F)F)c1)C(F)F ZINC000453228478 338810862 /nfs/dbraw/zinc/81/08/62/338810862.db2.gz BSXXNNOKILZMHU-RYUDHWBXSA-N 1 2 311.294 4.026 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1cnn(-c2ccc(F)cc2)c1C)C(F)F ZINC000453242916 338813142 /nfs/dbraw/zinc/81/31/42/338813142.db2.gz IHAUGCSJTYSDQD-MEBBXXQBSA-N 1 2 311.351 4.014 20 0 DIADLO C[C@H]([NH2+][C@@H](C)C(C)(F)F)c1ccc(OCC(F)(F)F)cc1 ZINC000453296090 338820114 /nfs/dbraw/zinc/82/01/14/338820114.db2.gz QVAWWYMZIIUVFM-UWVGGRQHSA-N 1 2 311.294 4.322 20 0 DIADLO C[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(OC(C)(C)C)cc1 ZINC000453312540 338822826 /nfs/dbraw/zinc/82/28/26/338822826.db2.gz HIJDZJFQUZVRAE-LBPRGKRZSA-N 1 2 321.852 4.102 20 0 DIADLO Cn1cc(Cl)c(C[NH2+][C@H](CC2CC2)c2ccc(Cl)cc2)n1 ZINC000453315621 338823304 /nfs/dbraw/zinc/82/33/04/338823304.db2.gz JLLJNBKKAOVDOP-OAHLLOKOSA-N 1 2 324.255 4.358 20 0 DIADLO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1ccc(-c2ccccc2)o1 ZINC000453339328 338827324 /nfs/dbraw/zinc/82/73/24/338827324.db2.gz GLHFPMIJFPYUAZ-YCPHGPKFSA-N 1 2 307.397 4.500 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000454166496 338855428 /nfs/dbraw/zinc/85/54/28/338855428.db2.gz PBFQTQHTIVUHHF-CYBMUJFWSA-N 1 2 314.433 4.083 20 0 DIADLO Cc1ccc(NC(=O)N2[C@H](C)C[C@H](c3ccccc3)[C@H]2C)c(C)[nH+]1 ZINC000455047041 338879553 /nfs/dbraw/zinc/87/95/53/338879553.db2.gz OVODRHHSKFBWPY-KYJSFNMBSA-N 1 2 323.440 4.497 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC2(CCCC2)[C@H]1C(C)C ZINC000455448101 338894826 /nfs/dbraw/zinc/89/48/26/338894826.db2.gz WDFAJSBICXJQCY-MRXNPFEDSA-N 1 2 301.434 4.131 20 0 DIADLO CC[C@@H]1CCCC[C@H]1N(C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455472983 338895570 /nfs/dbraw/zinc/89/55/70/338895570.db2.gz BWUWAWCUPBHEIF-HZPDHXFCSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC3C[C@@H]4CC2C[C@H](C3)C4)c(C)[nH+]1 ZINC000455477900 338895797 /nfs/dbraw/zinc/89/57/97/338895797.db2.gz MGVZMROMGAPGNJ-RYTJFDOTSA-N 1 2 313.445 4.049 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)Nc1cc(C)cc2ccccc21 ZINC000455733219 338905856 /nfs/dbraw/zinc/90/58/56/338905856.db2.gz DYDODELFWKJDBN-CQSZACIVSA-N 1 2 322.412 4.247 20 0 DIADLO CN(C(=O)C1=CCC(C)(C)CC1)[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000456055427 338918214 /nfs/dbraw/zinc/91/82/14/338918214.db2.gz DKOPKHIPMCRFKZ-QGZVFWFLSA-N 1 2 323.440 4.094 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)NC(=O)CC(C)(C)C1CCCCC1 ZINC000456359257 338927464 /nfs/dbraw/zinc/92/74/64/338927464.db2.gz QVQGFJXNUGJMGA-AWEZNQCLSA-N 1 2 305.466 4.077 20 0 DIADLO CCC(C)(C)OCC(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000457504150 338966881 /nfs/dbraw/zinc/96/68/81/338966881.db2.gz HHRGFRZJDPONBG-UHFFFAOYSA-N 1 2 314.385 4.018 20 0 DIADLO Cc1ccc(N[C@@H](C)c2ccc(F)c(Br)c2)c[nH+]1 ZINC000164608340 339008961 /nfs/dbraw/zinc/00/89/61/339008961.db2.gz VUWBBTLKEKJJCD-JTQLQIEISA-N 1 2 309.182 4.465 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)N(CC(C)(C)C)CC(C)(C)C ZINC000459072054 339012757 /nfs/dbraw/zinc/01/27/57/339012757.db2.gz YTBZKWNMIYKCOJ-CQSZACIVSA-N 1 2 322.497 4.068 20 0 DIADLO CCC[C@@H](NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1)C1CCCC1 ZINC000459280687 339018959 /nfs/dbraw/zinc/01/89/59/339018959.db2.gz KVTJYOYCUFHTPX-HZPDHXFCSA-N 1 2 318.465 4.005 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2c(C)nc3scc(C4CC4)n23)o1 ZINC000459291350 339019511 /nfs/dbraw/zinc/01/95/11/339019511.db2.gz MHBDRIKTDMUHSS-UHFFFAOYSA-N 1 2 315.442 4.115 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2c(C)nc3scc(C4CC4)n23)o1 ZINC000459291350 339019512 /nfs/dbraw/zinc/01/95/12/339019512.db2.gz MHBDRIKTDMUHSS-UHFFFAOYSA-N 1 2 315.442 4.115 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+]Cc2ccc(C3CC3)cc2)s1 ZINC000459441721 339029333 /nfs/dbraw/zinc/02/93/33/339029333.db2.gz OVBIYSTYATWSSD-UHFFFAOYSA-N 1 2 301.459 4.003 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1c(C)nc2scc(C3CC3)n12 ZINC000459553393 339035311 /nfs/dbraw/zinc/03/53/11/339035311.db2.gz AXWQMMJNSYIZOF-UHFFFAOYSA-N 1 2 315.442 4.115 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1c(C)nc2scc(C3CC3)n12 ZINC000459553393 339035312 /nfs/dbraw/zinc/03/53/12/339035312.db2.gz AXWQMMJNSYIZOF-UHFFFAOYSA-N 1 2 315.442 4.115 20 0 DIADLO c1ccc([C@H]2[N@H+](Cc3nc(C4CC4)no3)CC23CCCC3)cc1 ZINC000459560498 339035784 /nfs/dbraw/zinc/03/57/84/339035784.db2.gz ALMSOLVTEZYNAC-QGZVFWFLSA-N 1 2 309.413 4.064 20 0 DIADLO c1ccc([C@H]2[N@@H+](Cc3nc(C4CC4)no3)CC23CCCC3)cc1 ZINC000459560498 339035785 /nfs/dbraw/zinc/03/57/85/339035785.db2.gz ALMSOLVTEZYNAC-QGZVFWFLSA-N 1 2 309.413 4.064 20 0 DIADLO CC(C)(C)n1ncnc1C[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459568218 339036478 /nfs/dbraw/zinc/03/64/78/339036478.db2.gz BEBLKCFFFWFOPR-GOSISDBHSA-N 1 2 324.472 4.150 20 0 DIADLO CC(C)(C)n1ncnc1C[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459568218 339036479 /nfs/dbraw/zinc/03/64/79/339036479.db2.gz BEBLKCFFFWFOPR-GOSISDBHSA-N 1 2 324.472 4.150 20 0 DIADLO COc1ccc(-c2ccccc2C)cc1C[NH2+]C(CF)CF ZINC000459571218 339036551 /nfs/dbraw/zinc/03/65/51/339036551.db2.gz OTXODIZMAUAYKR-UHFFFAOYSA-N 1 2 305.368 4.068 20 0 DIADLO CCCc1noc(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)n1 ZINC000459574162 339036681 /nfs/dbraw/zinc/03/66/81/339036681.db2.gz RTZXFLDBIAAUGG-SFHVURJKSA-N 1 2 311.429 4.139 20 0 DIADLO CCCc1noc(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)n1 ZINC000459574162 339036682 /nfs/dbraw/zinc/03/66/82/339036682.db2.gz RTZXFLDBIAAUGG-SFHVURJKSA-N 1 2 311.429 4.139 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)n1C ZINC000459589283 339037395 /nfs/dbraw/zinc/03/73/95/339037395.db2.gz YCPOMADTONPJIG-GOSISDBHSA-N 1 2 324.472 4.056 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)n1C ZINC000459589283 339037396 /nfs/dbraw/zinc/03/73/96/339037396.db2.gz YCPOMADTONPJIG-GOSISDBHSA-N 1 2 324.472 4.056 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)ccc1F)c1nc2c(s1)CCC2 ZINC000459627456 339039129 /nfs/dbraw/zinc/03/91/29/339039129.db2.gz BXGXZFJVRVWCAH-VIFPVBQESA-N 1 2 310.825 4.275 20 0 DIADLO Cc1ccc(C[NH2+]Cc2csc(-c3cccs3)n2)nc1C ZINC000459664181 339041553 /nfs/dbraw/zinc/04/15/53/339041553.db2.gz JJXZIFBCQCTXGC-UHFFFAOYSA-N 1 2 315.467 4.173 20 0 DIADLO CC(C)n1ncnc1C[N@@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000459730895 339044872 /nfs/dbraw/zinc/04/48/72/339044872.db2.gz CCBLNPDYQQPWHZ-IBGZPJMESA-N 1 2 324.472 4.366 20 0 DIADLO CC(C)n1ncnc1C[N@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000459730895 339044873 /nfs/dbraw/zinc/04/48/73/339044873.db2.gz CCBLNPDYQQPWHZ-IBGZPJMESA-N 1 2 324.472 4.366 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1cccc2[nH+]ccn21)c1ccccc1 ZINC000460335955 339055553 /nfs/dbraw/zinc/05/55/53/339055553.db2.gz RGMWUNSMJVVPPQ-INIZCTEOSA-N 1 2 307.397 4.103 20 0 DIADLO COc1ccc(/C=C/c2ccc(OCc3c[nH+]cn3C)cc2)cc1 ZINC000461084454 339058877 /nfs/dbraw/zinc/05/88/77/339058877.db2.gz DQERDEORQMUQJK-ONEGZZNKSA-N 1 2 320.392 4.178 20 0 DIADLO COc1ccc(/C=C\c2ccc(OCc3c[nH+]cn3C)cc2)cc1 ZINC000461084452 339058881 /nfs/dbraw/zinc/05/88/81/339058881.db2.gz DQERDEORQMUQJK-ARJAWSKDSA-N 1 2 320.392 4.178 20 0 DIADLO CC[C@@H](C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1)C1CCC(C)CC1 ZINC000461344951 339062237 /nfs/dbraw/zinc/06/22/37/339062237.db2.gz OJGPXFTYUOVJMD-BACDZXNISA-N 1 2 317.477 4.316 20 0 DIADLO COC(=O)[C@H]([NH2+][C@@H](C)c1ccc(Cl)c2ccccc21)C1CC1 ZINC000462352650 339076339 /nfs/dbraw/zinc/07/63/39/339076339.db2.gz AULHHLXYRSEDMU-APPDUMDISA-N 1 2 317.816 4.095 20 0 DIADLO c1ccc(COc2ccc[nH+]c2N[C@@H]2CCO[C@@H](C3CC3)C2)cc1 ZINC000462689881 339084126 /nfs/dbraw/zinc/08/41/26/339084126.db2.gz FWYJQYPFLGZZBI-IEBWSBKVSA-N 1 2 324.424 4.030 20 0 DIADLO c1ccc(COc2ccc[nH+]c2N[C@H]2CCO[C@@H](C3CC3)C2)cc1 ZINC000462689883 339084208 /nfs/dbraw/zinc/08/42/08/339084208.db2.gz FWYJQYPFLGZZBI-PKOBYXMFSA-N 1 2 324.424 4.030 20 0 DIADLO Cc1nc(N[C@@H]2CCOc3c(-c4ccccc4)cccc32)cc[nH+]1 ZINC000462794305 339089215 /nfs/dbraw/zinc/08/92/15/339089215.db2.gz WRGYIQBPPXYKJT-GOSISDBHSA-N 1 2 317.392 4.388 20 0 DIADLO Oc1cccc2c1CCC[C@@H]2Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000462797176 339089398 /nfs/dbraw/zinc/08/93/98/339089398.db2.gz BOZCXFDGXVOJRH-SFHVURJKSA-N 1 2 323.440 4.267 20 0 DIADLO FC(F)(F)[C@@H](NCCCCNc1cccc[nH+]1)c1ccccc1 ZINC000462812123 339090989 /nfs/dbraw/zinc/09/09/89/339090989.db2.gz LRGOHIOGYFZYJX-INIZCTEOSA-N 1 2 323.362 4.167 20 0 DIADLO Oc1ccc2c(c1)[C@@H](Nc1ccc(N3CCCCC3)c[nH+]1)CCC2 ZINC000462813975 339091240 /nfs/dbraw/zinc/09/12/40/339091240.db2.gz CHLGQPZITUWNPP-IBGZPJMESA-N 1 2 323.440 4.267 20 0 DIADLO Cc1cc(N2CC[C@@H](c3ccccc3)[C@@H](C)C2)nc(C2CC2)[nH+]1 ZINC000462902528 339097050 /nfs/dbraw/zinc/09/70/50/339097050.db2.gz OAHJVHOAALMSAZ-KBXCAEBGSA-N 1 2 307.441 4.292 20 0 DIADLO Cc1cc(N2CC[C@@H](c3ccccc3)[C@H](C)C2)nc(C2CC2)[nH+]1 ZINC000462902531 339097102 /nfs/dbraw/zinc/09/71/02/339097102.db2.gz OAHJVHOAALMSAZ-RDTXWAMCSA-N 1 2 307.441 4.292 20 0 DIADLO CC[C@@H](CC(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1)C(C)C ZINC000463040382 339102609 /nfs/dbraw/zinc/10/26/09/339102609.db2.gz VGRWTNUDDNMRJY-CVEARBPZSA-N 1 2 322.518 4.026 20 0 DIADLO Cc1cc(N2C[C@H](C)C[C@@H]2c2cccc(F)c2)nc(C2CC2)[nH+]1 ZINC000463077352 339104776 /nfs/dbraw/zinc/10/47/76/339104776.db2.gz OOWJNAXKHBXWHA-SJKOYZFVSA-N 1 2 311.404 4.389 20 0 DIADLO CC(C)[C@H](C)SCc1cn2cc(Br)ccc2[nH+]1 ZINC000463231666 339110711 /nfs/dbraw/zinc/11/07/11/339110711.db2.gz NPRUMVHYMXAODP-JTQLQIEISA-N 1 2 313.264 4.375 20 0 DIADLO c1c2ccccc2n2c1C[N@H+](CCCCC1CCOCC1)CC2 ZINC000463348463 339115411 /nfs/dbraw/zinc/11/54/11/339115411.db2.gz MAOWWWATMIRRPC-UHFFFAOYSA-N 1 2 312.457 4.054 20 0 DIADLO c1c2ccccc2n2c1C[N@@H+](CCCCC1CCOCC1)CC2 ZINC000463348463 339115412 /nfs/dbraw/zinc/11/54/12/339115412.db2.gz MAOWWWATMIRRPC-UHFFFAOYSA-N 1 2 312.457 4.054 20 0 DIADLO Cc1ccc(NC(=O)NCCc2ccc(Cl)c(C)c2)c(C)[nH+]1 ZINC000463737421 339125153 /nfs/dbraw/zinc/12/51/53/339125153.db2.gz DMTAEQDSDCOLJZ-UHFFFAOYSA-N 1 2 317.820 4.024 20 0 DIADLO c1ccc(-c2nnc(C[N@@H+]3CC[C@@H]3c3ccccc3)s2)cc1 ZINC000464679111 339148597 /nfs/dbraw/zinc/14/85/97/339148597.db2.gz USOLVIQYDJGGOX-MRXNPFEDSA-N 1 2 307.422 4.152 20 0 DIADLO c1ccc(-c2nnc(C[N@H+]3CC[C@@H]3c3ccccc3)s2)cc1 ZINC000464679111 339148598 /nfs/dbraw/zinc/14/85/98/339148598.db2.gz USOLVIQYDJGGOX-MRXNPFEDSA-N 1 2 307.422 4.152 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2nc(C(C)C)no2)o1 ZINC000464831959 339155879 /nfs/dbraw/zinc/15/58/79/339155879.db2.gz KZNFEMXYGBYGPR-ZFWWWQNUSA-N 1 2 317.433 4.322 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2nc(C(C)C)no2)o1 ZINC000464831959 339155880 /nfs/dbraw/zinc/15/58/80/339155880.db2.gz KZNFEMXYGBYGPR-ZFWWWQNUSA-N 1 2 317.433 4.322 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2nc(C(C)C)no2)o1 ZINC000464831953 339155934 /nfs/dbraw/zinc/15/59/34/339155934.db2.gz KZNFEMXYGBYGPR-DZGCQCFKSA-N 1 2 317.433 4.322 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2nc(C(C)C)no2)o1 ZINC000464831953 339155935 /nfs/dbraw/zinc/15/59/35/339155935.db2.gz KZNFEMXYGBYGPR-DZGCQCFKSA-N 1 2 317.433 4.322 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2)[C@H](c2ccccc2)CO1 ZINC000464842912 339156994 /nfs/dbraw/zinc/15/69/94/339156994.db2.gz NIMBFIPCWCUJGE-KDOFPFPSSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2)[C@H](c2ccccc2)CO1 ZINC000464842912 339156995 /nfs/dbraw/zinc/15/69/95/339156995.db2.gz NIMBFIPCWCUJGE-KDOFPFPSSA-N 1 2 301.817 4.302 20 0 DIADLO CC(C)CCc1noc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccco2)n1 ZINC000464863101 339158830 /nfs/dbraw/zinc/15/88/30/339158830.db2.gz ZOPWAMDQUKIWKO-LSDHHAIUSA-N 1 2 317.433 4.224 20 0 DIADLO CC(C)CCc1noc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccco2)n1 ZINC000464863101 339158831 /nfs/dbraw/zinc/15/88/31/339158831.db2.gz ZOPWAMDQUKIWKO-LSDHHAIUSA-N 1 2 317.433 4.224 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1nc2cc(F)ccc2o1 ZINC000464864866 339159000 /nfs/dbraw/zinc/15/90/00/339159000.db2.gz BIEYKJYQFGPEET-JTQLQIEISA-N 1 2 302.374 4.148 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1nc2cc(F)ccc2o1 ZINC000464864866 339159001 /nfs/dbraw/zinc/15/90/01/339159001.db2.gz BIEYKJYQFGPEET-JTQLQIEISA-N 1 2 302.374 4.148 20 0 DIADLO Fc1ccccc1C=C1CCN(c2cc[nH+]c3ccncc32)CC1 ZINC000465056785 339167149 /nfs/dbraw/zinc/16/71/49/339167149.db2.gz MBLFPBBEGQEDCI-UHFFFAOYSA-N 1 2 319.383 4.453 20 0 DIADLO CCC(C)(C)CC(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC000465081546 339167798 /nfs/dbraw/zinc/16/77/98/339167798.db2.gz WPEIDODMQNMVFV-ZDUSSCGKSA-N 1 2 323.506 4.140 20 0 DIADLO CCC(C)(C)CC(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC000465081546 339167799 /nfs/dbraw/zinc/16/77/99/339167799.db2.gz WPEIDODMQNMVFV-ZDUSSCGKSA-N 1 2 323.506 4.140 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1c(Cl)oc3ccccc31)CO2 ZINC000466476043 339206725 /nfs/dbraw/zinc/20/67/25/339206725.db2.gz XWFLLHLKDPPDEX-CQSZACIVSA-N 1 2 317.747 4.449 20 0 DIADLO CCOc1cccc(CNc2ccc(-c3ccccc3)c[nH+]2)n1 ZINC000466619536 339210674 /nfs/dbraw/zinc/21/06/74/339210674.db2.gz PPALENPDAPCEPG-UHFFFAOYSA-N 1 2 305.381 4.154 20 0 DIADLO Cc1cccn2c(CNc3ccc(-c4ccccc4)cn3)c[nH+]c12 ZINC000466625438 339210777 /nfs/dbraw/zinc/21/07/77/339210777.db2.gz GEBUFXLRNLAZSE-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO Cn1cnc2cc(CNc3[nH+]cccc3-c3ccccc3)ccc21 ZINC000466636542 339211367 /nfs/dbraw/zinc/21/13/67/339211367.db2.gz CMQDVADYYMGGGI-UHFFFAOYSA-N 1 2 314.392 4.247 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+]1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000467180123 339227295 /nfs/dbraw/zinc/22/72/95/339227295.db2.gz JEJWSOBACMJQCB-KDOFPFPSSA-N 1 2 301.817 4.475 20 0 DIADLO C[C@H](c1ccccc1)[N@H+]1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000467180123 339227296 /nfs/dbraw/zinc/22/72/96/339227296.db2.gz JEJWSOBACMJQCB-KDOFPFPSSA-N 1 2 301.817 4.475 20 0 DIADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@@H](Nc2cccc3c2OCCO3)C1 ZINC000467354999 339233603 /nfs/dbraw/zinc/23/36/03/339233603.db2.gz NKVFLISQEDNYTM-HZPDHXFCSA-N 1 2 324.424 4.300 20 0 DIADLO Fc1cccc2c3c([nH]c21)C[N@@H+](C/C=C/c1ccncc1)CCC3 ZINC000467549031 339241890 /nfs/dbraw/zinc/24/18/90/339241890.db2.gz UWNZOHZEOVLHLG-DUXPYHPUSA-N 1 2 321.399 4.164 20 0 DIADLO Fc1cccc2c3c([nH]c21)C[N@H+](C/C=C/c1ccncc1)CCC3 ZINC000467549031 339241891 /nfs/dbraw/zinc/24/18/91/339241891.db2.gz UWNZOHZEOVLHLG-DUXPYHPUSA-N 1 2 321.399 4.164 20 0 DIADLO CC[C@H]1C[N@H+](Cc2cc(Cl)c(OC)cc2Cl)CCCO1 ZINC000467556974 339242421 /nfs/dbraw/zinc/24/24/21/339242421.db2.gz HIPAVQHYWVSCPV-LBPRGKRZSA-N 1 2 318.244 4.003 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2cc(Cl)c(OC)cc2Cl)CCCO1 ZINC000467556974 339242422 /nfs/dbraw/zinc/24/24/22/339242422.db2.gz HIPAVQHYWVSCPV-LBPRGKRZSA-N 1 2 318.244 4.003 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@H](C(F)(F)F)C3)sc2c1 ZINC000467557964 339242578 /nfs/dbraw/zinc/24/25/78/339242578.db2.gz PQEPUHNDJGLZRO-VIFPVBQESA-N 1 2 318.339 4.210 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@H](C(F)(F)F)C3)sc2c1 ZINC000467557964 339242579 /nfs/dbraw/zinc/24/25/79/339242579.db2.gz PQEPUHNDJGLZRO-VIFPVBQESA-N 1 2 318.339 4.210 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2ccc(F)cc21)c1ccc(F)cc1Cl ZINC000468030026 339251767 /nfs/dbraw/zinc/25/17/67/339251767.db2.gz IJCNXCNFGNBYDL-VFZGTOFNSA-N 1 2 309.743 4.403 20 0 DIADLO COc1ccc([C@@H](C)[C@H](C)[NH2+][C@@H](C(C)C)C(F)(F)F)cc1 ZINC000468796978 339271085 /nfs/dbraw/zinc/27/10/85/339271085.db2.gz CBHVRWHAJWIICI-HUBLWGQQSA-N 1 2 303.368 4.364 20 0 DIADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccccc1Oc1cccc(C)c1 ZINC000468848571 339272578 /nfs/dbraw/zinc/27/25/78/339272578.db2.gz GJXQENACHDBMAX-UHFFFAOYSA-N 1 2 321.380 4.000 20 0 DIADLO CC(C)CO[C@@H]1CC[N@H+](Cc2csc(C3CCCCC3)n2)C1 ZINC000469093586 339279912 /nfs/dbraw/zinc/27/99/12/339279912.db2.gz WIYRBTRGWVGRNZ-QGZVFWFLSA-N 1 2 322.518 4.438 20 0 DIADLO CC(C)CO[C@@H]1CC[N@@H+](Cc2csc(C3CCCCC3)n2)C1 ZINC000469093586 339279913 /nfs/dbraw/zinc/27/99/13/339279913.db2.gz WIYRBTRGWVGRNZ-QGZVFWFLSA-N 1 2 322.518 4.438 20 0 DIADLO COc1cc[nH+]cc1NC(=O)[C@@H](C)c1ccc(CC(C)C)cc1 ZINC000469095214 339280032 /nfs/dbraw/zinc/28/00/32/339280032.db2.gz XCUOXFCYCANJLX-AWEZNQCLSA-N 1 2 312.413 4.031 20 0 DIADLO Fc1ccc(SCC[N@@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000469200529 339282837 /nfs/dbraw/zinc/28/28/37/339282837.db2.gz BMJWLPSPCBWSIW-INIZCTEOSA-N 1 2 323.458 4.053 20 0 DIADLO Fc1ccc(SCC[N@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000469200529 339282838 /nfs/dbraw/zinc/28/28/38/339282838.db2.gz BMJWLPSPCBWSIW-INIZCTEOSA-N 1 2 323.458 4.053 20 0 DIADLO Cc1[nH+]c2ccccn2c1CN(CC(C)C)c1cccc(O)c1 ZINC000469223462 339283520 /nfs/dbraw/zinc/28/35/20/339283520.db2.gz VXKKJLYPELWFIT-UHFFFAOYSA-N 1 2 309.413 4.011 20 0 DIADLO CCC1(CC)C[N@@H+]([C@@H](C)c2ccccc2Cl)CC[S@@]1=O ZINC000469440813 339289335 /nfs/dbraw/zinc/28/93/35/339289335.db2.gz NMJHBQGHDUVSEN-RBZFPXEDSA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@H+]([C@@H](C)c2ccccc2Cl)CC[S@@]1=O ZINC000469440813 339289336 /nfs/dbraw/zinc/28/93/36/339289336.db2.gz NMJHBQGHDUVSEN-RBZFPXEDSA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@@H+]([C@H](C)c2ccccc2Cl)CC[S@@]1=O ZINC000469440815 339289430 /nfs/dbraw/zinc/28/94/30/339289430.db2.gz NMJHBQGHDUVSEN-XCLFUZPHSA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@H+]([C@H](C)c2ccccc2Cl)CC[S@@]1=O ZINC000469440815 339289431 /nfs/dbraw/zinc/28/94/31/339289431.db2.gz NMJHBQGHDUVSEN-XCLFUZPHSA-N 1 2 313.894 4.024 20 0 DIADLO CCC[N@H+](Cc1ccc(F)cn1)Cc1c(F)cccc1Cl ZINC000469608379 339294421 /nfs/dbraw/zinc/29/44/21/339294421.db2.gz CVMULVOYWFJKPJ-UHFFFAOYSA-N 1 2 310.775 4.425 20 0 DIADLO CCC[N@@H+](Cc1ccc(F)cn1)Cc1c(F)cccc1Cl ZINC000469608379 339294422 /nfs/dbraw/zinc/29/44/22/339294422.db2.gz CVMULVOYWFJKPJ-UHFFFAOYSA-N 1 2 310.775 4.425 20 0 DIADLO CCCC(C)(C)CC(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000469782373 339299563 /nfs/dbraw/zinc/29/95/63/339299563.db2.gz ZAJMAPWZUQDRLS-OAHLLOKOSA-N 1 2 322.518 4.170 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)cs1 ZINC000470012045 339308400 /nfs/dbraw/zinc/30/84/00/339308400.db2.gz OJBUYAUETXWMFM-NSHDSACASA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)cs1 ZINC000470012045 339308399 /nfs/dbraw/zinc/30/83/99/339308399.db2.gz OJBUYAUETXWMFM-NSHDSACASA-N 1 2 306.397 4.429 20 0 DIADLO Cc1ccc(C(=O)N[C@H](C)CCC2CC2)cc1Oc1cc[nH+]cc1 ZINC000470347534 339317902 /nfs/dbraw/zinc/31/79/02/339317902.db2.gz WAFJCGGRUCASIR-OAHLLOKOSA-N 1 2 324.424 4.491 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(-c2cccs2)on1 ZINC000470947068 339332223 /nfs/dbraw/zinc/33/22/23/339332223.db2.gz MWCVQDPHSODBKN-KOLCDFICSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(-c2cccs2)on1 ZINC000470947068 339332224 /nfs/dbraw/zinc/33/22/24/339332224.db2.gz MWCVQDPHSODBKN-KOLCDFICSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1csc(-c2ccco2)n1 ZINC000470949673 339332342 /nfs/dbraw/zinc/33/23/42/339332342.db2.gz XIZCZXOKHORIHG-ONGXEEELSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1csc(-c2ccco2)n1 ZINC000470949673 339332343 /nfs/dbraw/zinc/33/23/43/339332343.db2.gz XIZCZXOKHORIHG-ONGXEEELSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000470954732 339332678 /nfs/dbraw/zinc/33/26/78/339332678.db2.gz BSSCNKOBXXPTHT-NXEZZACHSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000470954732 339332679 /nfs/dbraw/zinc/33/26/79/339332679.db2.gz BSSCNKOBXXPTHT-NXEZZACHSA-N 1 2 306.397 4.213 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000470994602 339334062 /nfs/dbraw/zinc/33/40/62/339334062.db2.gz GDODGOFUDYTCPR-UHFFFAOYSA-N 1 2 315.486 4.352 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000470994602 339334063 /nfs/dbraw/zinc/33/40/63/339334063.db2.gz GDODGOFUDYTCPR-UHFFFAOYSA-N 1 2 315.486 4.352 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000471020349 339334498 /nfs/dbraw/zinc/33/44/98/339334498.db2.gz FJUZUSXKNRSIKJ-UHFFFAOYSA-N 1 2 304.459 4.326 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000471020349 339334499 /nfs/dbraw/zinc/33/44/99/339334499.db2.gz FJUZUSXKNRSIKJ-UHFFFAOYSA-N 1 2 304.459 4.326 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000471038746 339335186 /nfs/dbraw/zinc/33/51/86/339335186.db2.gz RJAMIJVHRPFXTR-JLTOFOAXSA-N 1 2 323.415 4.388 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000471038746 339335187 /nfs/dbraw/zinc/33/51/87/339335187.db2.gz RJAMIJVHRPFXTR-JLTOFOAXSA-N 1 2 323.415 4.388 20 0 DIADLO Fc1ccc(-c2nc(C[N@@H+]3CC[C@H]3c3ccccc3)co2)cc1 ZINC000471169066 339339387 /nfs/dbraw/zinc/33/93/87/339339387.db2.gz NAXNDKPZHDAGFG-SFHVURJKSA-N 1 2 308.356 4.428 20 0 DIADLO Fc1ccc(-c2nc(C[N@H+]3CC[C@H]3c3ccccc3)co2)cc1 ZINC000471169066 339339388 /nfs/dbraw/zinc/33/93/88/339339388.db2.gz NAXNDKPZHDAGFG-SFHVURJKSA-N 1 2 308.356 4.428 20 0 DIADLO CC[C@@H](Nc1[nH+]c(C)nc2[nH]ccc21)c1ccc(Cl)cc1 ZINC000471251922 339341141 /nfs/dbraw/zinc/34/11/41/339341141.db2.gz QUNKPLOFFBVEKD-CQSZACIVSA-N 1 2 300.793 4.483 20 0 DIADLO Cc1cc(C)c(C(=O)Nc2ccc3[nH]c(C(C)(C)C)[nH+]c3c2)[nH]1 ZINC000471495037 339346109 /nfs/dbraw/zinc/34/61/09/339346109.db2.gz DGPVEACWJDNDDP-UHFFFAOYSA-N 1 2 310.401 4.058 20 0 DIADLO Cc1ccc(C(=O)N2C[C@@H](C)CC2(C)C)cc1Oc1cc[nH+]cc1 ZINC000471703194 339351604 /nfs/dbraw/zinc/35/16/04/339351604.db2.gz YVTJPSWPDZIRAE-AWEZNQCLSA-N 1 2 324.424 4.443 20 0 DIADLO CCn1nc(C[NH2+]Cc2c(F)cccc2Cl)c2ccccc21 ZINC000472077106 339362768 /nfs/dbraw/zinc/36/27/68/339362768.db2.gz GNFLLTKUGLMKGZ-UHFFFAOYSA-N 1 2 317.795 4.139 20 0 DIADLO CCCc1nc(C[N@@H+]2CC[C@H](c3ccccc3)[C@H](CC)C2)no1 ZINC000472252843 339367761 /nfs/dbraw/zinc/36/77/61/339367761.db2.gz XPTLSADJJWEFJB-WBVHZDCISA-N 1 2 313.445 4.038 20 0 DIADLO CCCc1nc(C[N@H+]2CC[C@H](c3ccccc3)[C@H](CC)C2)no1 ZINC000472252843 339367762 /nfs/dbraw/zinc/36/77/62/339367762.db2.gz XPTLSADJJWEFJB-WBVHZDCISA-N 1 2 313.445 4.038 20 0 DIADLO Cc1ccccc1-c1cccc(CNc2cccc(CO)[nH+]2)c1 ZINC000472587442 339374355 /nfs/dbraw/zinc/37/43/55/339374355.db2.gz VMSOINKNHZGLSI-UHFFFAOYSA-N 1 2 304.393 4.161 20 0 DIADLO Cc1ccccc1-c1nc(C[N@H+](Cc2ccccc2)C(C)C)no1 ZINC000472758224 339377031 /nfs/dbraw/zinc/37/70/31/339377031.db2.gz WMAKJYDCOFMZPV-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO Cc1ccccc1-c1nc(C[N@@H+](Cc2ccccc2)C(C)C)no1 ZINC000472758224 339377032 /nfs/dbraw/zinc/37/70/32/339377032.db2.gz WMAKJYDCOFMZPV-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO Cc1ccccc1-c1nc(C[N@@H+]2CCC[C@@H]2c2ccccc2)no1 ZINC000472771416 339377272 /nfs/dbraw/zinc/37/72/72/339377272.db2.gz NLSZWXYGOZDTPA-GOSISDBHSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccccc1-c1nc(C[N@H+]2CCC[C@@H]2c2ccccc2)no1 ZINC000472771416 339377273 /nfs/dbraw/zinc/37/72/73/339377273.db2.gz NLSZWXYGOZDTPA-GOSISDBHSA-N 1 2 319.408 4.382 20 0 DIADLO C[C@@]1(c2ccccc2)CCC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000473139376 339381441 /nfs/dbraw/zinc/38/14/41/339381441.db2.gz JELDOKYKXFLHHC-MRXNPFEDSA-N 1 2 306.862 4.350 20 0 DIADLO C[C@@]1(c2ccccc2)CCC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000473139376 339381442 /nfs/dbraw/zinc/38/14/42/339381442.db2.gz JELDOKYKXFLHHC-MRXNPFEDSA-N 1 2 306.862 4.350 20 0 DIADLO COc1cccc([C@H]2C[C@@H](C)C[N@@H+]2Cc2ncc(Cl)s2)c1 ZINC000473125281 339381605 /nfs/dbraw/zinc/38/16/05/339381605.db2.gz HQRNIOXITYUEND-BXUZGUMPSA-N 1 2 322.861 4.388 20 0 DIADLO COc1cccc([C@H]2C[C@@H](C)C[N@H+]2Cc2ncc(Cl)s2)c1 ZINC000473125281 339381606 /nfs/dbraw/zinc/38/16/06/339381606.db2.gz HQRNIOXITYUEND-BXUZGUMPSA-N 1 2 322.861 4.388 20 0 DIADLO Fc1ccc(CC2CC[NH+](Cc3ncc(Cl)s3)CC2)cc1 ZINC000473140805 339382175 /nfs/dbraw/zinc/38/21/75/339382175.db2.gz SOFSWDPOATWPSM-UHFFFAOYSA-N 1 2 324.852 4.390 20 0 DIADLO Clc1cnc(C[N@@H+]2CC[C@@H](CSc3ccccc3)C2)s1 ZINC000473141886 339382183 /nfs/dbraw/zinc/38/21/83/339382183.db2.gz QGXASYFDVHZYKR-GFCCVEGCSA-N 1 2 324.902 4.411 20 0 DIADLO Clc1cnc(C[N@H+]2CC[C@@H](CSc3ccccc3)C2)s1 ZINC000473141886 339382184 /nfs/dbraw/zinc/38/21/84/339382184.db2.gz QGXASYFDVHZYKR-GFCCVEGCSA-N 1 2 324.902 4.411 20 0 DIADLO CCn1nc(C[N@H+](Cc2ccccc2F)C2CC2)c2ccccc21 ZINC000473141124 339382201 /nfs/dbraw/zinc/38/22/01/339382201.db2.gz DYYFOLVXNLHYHH-UHFFFAOYSA-N 1 2 323.415 4.360 20 0 DIADLO CCn1nc(C[N@@H+](Cc2ccccc2F)C2CC2)c2ccccc21 ZINC000473141124 339382202 /nfs/dbraw/zinc/38/22/02/339382202.db2.gz DYYFOLVXNLHYHH-UHFFFAOYSA-N 1 2 323.415 4.360 20 0 DIADLO Fc1cccc(CC[N@H+](Cc2ncc(Cl)s2)C2CC2)c1 ZINC000473143008 339382484 /nfs/dbraw/zinc/38/24/84/339382484.db2.gz DJKFOQVUKVGAPU-UHFFFAOYSA-N 1 2 310.825 4.143 20 0 DIADLO Fc1cccc(CC[N@@H+](Cc2ncc(Cl)s2)C2CC2)c1 ZINC000473143008 339382485 /nfs/dbraw/zinc/38/24/85/339382485.db2.gz DJKFOQVUKVGAPU-UHFFFAOYSA-N 1 2 310.825 4.143 20 0 DIADLO CCc1[nH+]c(C)ccc1OCc1coc(-c2ccc(F)cc2)n1 ZINC000473679088 339390154 /nfs/dbraw/zinc/39/01/54/339390154.db2.gz GCQDXSZRWSLHBI-UHFFFAOYSA-N 1 2 312.344 4.326 20 0 DIADLO COc1cccc(OC)c1SCc1ccc2[nH]c(C)[nH+]c2c1 ZINC000473794219 339392332 /nfs/dbraw/zinc/39/23/32/339392332.db2.gz ZZRQDAYOSOSDKH-UHFFFAOYSA-N 1 2 314.410 4.181 20 0 DIADLO COc1cccc(OC)c1SCc1ccc2[nH+]c(C)[nH]c2c1 ZINC000473794219 339392333 /nfs/dbraw/zinc/39/23/33/339392333.db2.gz ZZRQDAYOSOSDKH-UHFFFAOYSA-N 1 2 314.410 4.181 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@H]2CCOC[C@@H]2C)c1 ZINC000474481975 339417119 /nfs/dbraw/zinc/41/71/19/339417119.db2.gz JJKRKZKUWOKTEA-YJBOKZPZSA-N 1 2 313.445 4.187 20 0 DIADLO CCc1cccc(F)c1C[NH2+]Cc1ncc(-c2ccccc2)cn1 ZINC000474930287 339431746 /nfs/dbraw/zinc/43/17/46/339431746.db2.gz XKVAVQRIVKQYLN-UHFFFAOYSA-N 1 2 321.399 4.135 20 0 DIADLO CC[C@H]1CCCC[C@@H]1C(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000474961240 339433626 /nfs/dbraw/zinc/43/36/26/339433626.db2.gz CLHYNXZBYPWEPE-YOEHRIQHSA-N 1 2 311.429 4.242 20 0 DIADLO Cc1cccc2[nH+]c(CNc3ccccc3OCC(C)C)cn21 ZINC000475166243 339440417 /nfs/dbraw/zinc/44/04/17/339440417.db2.gz VRWZFYVIRCDNRA-UHFFFAOYSA-N 1 2 309.413 4.290 20 0 DIADLO Cc1cccc2[nH+]c(CNc3ccccc3OC(C)(C)C)cn21 ZINC000475169702 339440574 /nfs/dbraw/zinc/44/05/74/339440574.db2.gz FIKGDBDJGOYDLJ-UHFFFAOYSA-N 1 2 309.413 4.432 20 0 DIADLO COc1cc(NCc2ccc(N(C)C(C)C)[nH+]c2)c(C)cc1C ZINC000475667402 339458797 /nfs/dbraw/zinc/45/87/97/339458797.db2.gz GDSWZMLDWSEEMY-UHFFFAOYSA-N 1 2 313.445 4.164 20 0 DIADLO C[C@H](c1ccsc1)[NH+]1CCN(C(=O)[C@@H](C)CC(C)(C)C)CC1 ZINC000476254335 339472402 /nfs/dbraw/zinc/47/24/02/339472402.db2.gz KEQKDXROMVWBPY-LSDHHAIUSA-N 1 2 322.518 4.026 20 0 DIADLO CC(C)[C@@]1(C)C[C@H]1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000476385095 339475810 /nfs/dbraw/zinc/47/58/10/339475810.db2.gz HCXMZDIBCCEQFZ-PKOBYXMFSA-N 1 2 310.397 4.495 20 0 DIADLO Cc1ccc(CCC(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)cc1 ZINC000477978273 339506593 /nfs/dbraw/zinc/50/65/93/339506593.db2.gz YPRDPBLWSJQEIA-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO CCc1cccc(CC(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1 ZINC000477986218 339506739 /nfs/dbraw/zinc/50/67/39/339506739.db2.gz HNCPSGIIEKYZAZ-UHFFFAOYSA-N 1 2 319.408 4.129 20 0 DIADLO CCCOc1cccc2c(NCCc3ccccn3)cc[nH+]c12 ZINC000478271173 339512223 /nfs/dbraw/zinc/51/22/23/339512223.db2.gz AEWWZQVPRZCXER-UHFFFAOYSA-N 1 2 307.397 4.073 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)[C@@H](C)C2CC2)c1 ZINC000478609196 339519214 /nfs/dbraw/zinc/51/92/14/339519214.db2.gz MEMCVIACWBHSCB-AWEZNQCLSA-N 1 2 311.429 4.335 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1ccc2ncsc2c1)C(=O)OC(C)(C)C ZINC000479486617 339537671 /nfs/dbraw/zinc/53/76/71/339537671.db2.gz BWYXVXWPRZLKOG-WCQYABFASA-N 1 2 320.458 4.067 20 0 DIADLO COc1ccc(Cl)c(NCc2ccc(N(C)C(C)C)[nH+]c2)c1 ZINC000480266055 339566153 /nfs/dbraw/zinc/56/61/53/339566153.db2.gz OCOFRXRCCLPDEM-UHFFFAOYSA-N 1 2 319.836 4.200 20 0 DIADLO CCN(C)c1ccc(CNc2cc(F)ccc2OC(C)C)c[nH+]1 ZINC000480292214 339567408 /nfs/dbraw/zinc/56/74/08/339567408.db2.gz UKLBTBCFNIPLHQ-UHFFFAOYSA-N 1 2 317.408 4.076 20 0 DIADLO CCN(C)c1ccc(CNc2cc(C)c(C)c3ncccc23)c[nH+]1 ZINC000480298285 339567688 /nfs/dbraw/zinc/56/76/88/339567688.db2.gz ZEVUCIMNCAGKLV-UHFFFAOYSA-N 1 2 320.440 4.315 20 0 DIADLO Cc1cc(N2CCC[C@H]2CC(C)(C)C)nc(-c2ccncc2)[nH+]1 ZINC000480508087 339575364 /nfs/dbraw/zinc/57/53/64/339575364.db2.gz DNPJYXGSUSBZRU-INIZCTEOSA-N 1 2 310.445 4.252 20 0 DIADLO COCCCC[C@@H](Nc1cc[nH+]c2ccncc12)c1ccccc1 ZINC000480557628 339577411 /nfs/dbraw/zinc/57/74/11/339577411.db2.gz WSOBZIZTNLFZDW-GOSISDBHSA-N 1 2 321.424 4.022 20 0 DIADLO COc1c(C)ccc(NCc2ccc(N(C)C(C)C)[nH+]c2)c1C ZINC000480639939 339580898 /nfs/dbraw/zinc/58/08/98/339580898.db2.gz WUWXCICXXVASIE-UHFFFAOYSA-N 1 2 313.445 4.164 20 0 DIADLO CCCOc1cccc(NCc2ccc(N(C)C(C)C)[nH+]c2)c1 ZINC000480657678 339581368 /nfs/dbraw/zinc/58/13/68/339581368.db2.gz IQSMLNRGHVJFQS-UHFFFAOYSA-N 1 2 313.445 4.327 20 0 DIADLO Cc1ccccc1-c1nc(C[NH2+]Cc2ccc(Cl)s2)no1 ZINC000483328875 339661875 /nfs/dbraw/zinc/66/18/75/339661875.db2.gz WUPQPGWOXQOXCH-UHFFFAOYSA-N 1 2 319.817 4.050 20 0 DIADLO Cc1ccc(-c2nc(C[NH+]3CCC(C(F)F)CC3)cs2)o1 ZINC000483525380 339668106 /nfs/dbraw/zinc/66/81/06/339668106.db2.gz GIYBUPDANHGPRA-UHFFFAOYSA-N 1 2 312.385 4.189 20 0 DIADLO Cc1ccccc1-c1nc(C[NH2+]Cc2cc(C)c(C)cc2C)no1 ZINC000483828949 339675458 /nfs/dbraw/zinc/67/54/58/339675458.db2.gz CEIZWRUQUJYJOV-UHFFFAOYSA-N 1 2 321.424 4.260 20 0 DIADLO Clc1ccccc1CC1C[NH+](Cc2csc(C3CC3)n2)C1 ZINC000485308174 339701288 /nfs/dbraw/zinc/70/12/88/339701288.db2.gz YYBZBTASGMSQLA-UHFFFAOYSA-N 1 2 318.873 4.348 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](c1ccccc1)C1CCC1 ZINC000485475777 339704027 /nfs/dbraw/zinc/70/40/27/339704027.db2.gz OKTJJYYFCVJDDW-SFHVURJKSA-N 1 2 309.413 4.361 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCc1ccc(C(C)(C)C)cc1 ZINC000485497399 339704463 /nfs/dbraw/zinc/70/44/63/339704463.db2.gz LYBOTNKMYQRFLH-UHFFFAOYSA-N 1 2 311.429 4.318 20 0 DIADLO CCCSCC(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000485662190 339708513 /nfs/dbraw/zinc/70/85/13/339708513.db2.gz OBPQOKVHOWJEHB-UHFFFAOYSA-N 1 2 316.470 4.170 20 0 DIADLO Cc1c2cc(C)ccc2sc1C(=O)Nc1cccc2[nH+]ccn21 ZINC000485900417 339715910 /nfs/dbraw/zinc/71/59/10/339715910.db2.gz YCPWKFMFBKVTNY-UHFFFAOYSA-N 1 2 321.405 4.418 20 0 DIADLO Cc1cccn2cc(CNc3ccc(F)cc3OC(C)C)[nH+]c12 ZINC000486049752 339719297 /nfs/dbraw/zinc/71/92/97/339719297.db2.gz FHRSXCUCTOUGSI-UHFFFAOYSA-N 1 2 313.376 4.181 20 0 DIADLO COc1cc(C)cc(NCc2ccc(N(C)C(C)C)[nH+]c2)c1C ZINC000487197586 339746021 /nfs/dbraw/zinc/74/60/21/339746021.db2.gz FPTLXQNIHMCKKS-UHFFFAOYSA-N 1 2 313.445 4.164 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]C/C=C/c1ccncc1)c1ccco1 ZINC000487326793 339751450 /nfs/dbraw/zinc/75/14/50/339751450.db2.gz SHNGCGODMUXQEA-PEAOBZDDSA-N 1 2 320.392 4.076 20 0 DIADLO Cc1cc(F)ccc1C1CCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000488442754 339782545 /nfs/dbraw/zinc/78/25/45/339782545.db2.gz FTDLDFDXRBVONJ-UHFFFAOYSA-N 1 2 311.404 4.186 20 0 DIADLO C[C@@H]1CN(c2cccc[nH+]2)C[C@@H](c2cccc(C(F)(F)F)c2)O1 ZINC000488686731 339790451 /nfs/dbraw/zinc/79/04/51/339790451.db2.gz PHKQPGDYCMKBJJ-DOMZBBRYSA-N 1 2 322.330 4.067 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)N(C(=O)Nc3ccc(C)[nH+]c3C)C2)cc1 ZINC000488946574 339797838 /nfs/dbraw/zinc/79/78/38/339797838.db2.gz WUGBZCDNBZCXEW-YJBOKZPZSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1ccc(C[C@H](C)C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)cc1 ZINC000489034325 339800492 /nfs/dbraw/zinc/80/04/92/339800492.db2.gz JFIXICCTFXPEBP-HNNXBMFYSA-N 1 2 319.408 4.202 20 0 DIADLO O=C(c1cccc(Oc2cc[nH+]cc2)c1)N1CCc2ccccc21 ZINC000492445540 339900796 /nfs/dbraw/zinc/90/07/96/339900796.db2.gz NGFSEYWIMRICBG-UHFFFAOYSA-N 1 2 316.360 4.077 20 0 DIADLO CN(C(=O)/C=C/C1CCCCC1)[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000492813754 339909465 /nfs/dbraw/zinc/90/94/65/339909465.db2.gz ZRJJRERNQGKBGS-HYSAVQALSA-N 1 2 323.440 4.094 20 0 DIADLO O=C(/C=C/c1ccc(C2CC2)cc1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000493090226 339916958 /nfs/dbraw/zinc/91/69/58/339916958.db2.gz UUEVKNZBURWUKA-QKIXSCASSA-N 1 2 321.424 4.054 20 0 DIADLO Cc1cc(N[C@@H](C)C(c2ccccc2)c2ccccc2)nc[nH+]1 ZINC000493132413 339917949 /nfs/dbraw/zinc/91/79/49/339917949.db2.gz RWCAISKLGMAUER-INIZCTEOSA-N 1 2 303.409 4.418 20 0 DIADLO CCn1nc(C[NH2+]Cc2ccc(Cl)cc2F)c2ccccc21 ZINC000494476949 339950653 /nfs/dbraw/zinc/95/06/53/339950653.db2.gz WRSNUJDJLSIETA-UHFFFAOYSA-N 1 2 317.795 4.139 20 0 DIADLO COc1cc[nH+]cc1NC(=O)C(C)(C)CCCc1ccccc1 ZINC000494715582 339958351 /nfs/dbraw/zinc/95/83/51/339958351.db2.gz RBPWPQMSIYXWHX-UHFFFAOYSA-N 1 2 312.413 4.078 20 0 DIADLO CCCCC[N@H+](Cc1nc(CCC)no1)Cc1ccc(F)cc1 ZINC000497081774 340019838 /nfs/dbraw/zinc/01/98/38/340019838.db2.gz RDXQMSIGCJSPSJ-UHFFFAOYSA-N 1 2 319.424 4.354 20 0 DIADLO CCCCC[N@@H+](Cc1nc(CCC)no1)Cc1ccc(F)cc1 ZINC000497081774 340019839 /nfs/dbraw/zinc/01/98/39/340019839.db2.gz RDXQMSIGCJSPSJ-UHFFFAOYSA-N 1 2 319.424 4.354 20 0 DIADLO CCCOc1cccc2c(N[C@H](C)C3CCOCC3)cc[nH+]c12 ZINC000499141571 340030878 /nfs/dbraw/zinc/03/08/78/340030878.db2.gz LRENHOZQFOBYEW-CQSZACIVSA-N 1 2 314.429 4.251 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000499552971 340039325 /nfs/dbraw/zinc/03/93/25/340039325.db2.gz OJAWLIMZIGBCPK-QGZVFWFLSA-N 1 2 324.428 4.332 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000499552971 340039326 /nfs/dbraw/zinc/03/93/26/340039326.db2.gz OJAWLIMZIGBCPK-QGZVFWFLSA-N 1 2 324.428 4.332 20 0 DIADLO CCCC[C@H](CCC)NC(=O)CCn1c(C)[nH+]c2ccccc21 ZINC000500024952 340048840 /nfs/dbraw/zinc/04/88/40/340048840.db2.gz WBFXZWAEVDELCP-INIZCTEOSA-N 1 2 315.461 4.210 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000500032947 340048979 /nfs/dbraw/zinc/04/89/79/340048979.db2.gz WXKHTFPXBZGBQG-QGZVFWFLSA-N 1 2 317.477 4.112 20 0 DIADLO CCc1nc(C[NH2+][C@@]2(c3ccc(Cl)cc3)C[C@H]2C)cs1 ZINC000500417583 340057667 /nfs/dbraw/zinc/05/76/67/340057667.db2.gz TZEZEKZHJLHVBS-BZNIZROVSA-N 1 2 306.862 4.384 20 0 DIADLO C[C@H]1C[C@]1([NH2+]Cc1ncc(Cl)s1)c1ccc(Cl)cc1 ZINC000500449908 340059146 /nfs/dbraw/zinc/05/91/46/340059146.db2.gz FAMVBWADYHCQLJ-LKFCYVNXSA-N 1 2 313.253 4.475 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2cccc(OCc3ccccc3)c2)no1 ZINC000500544301 340061948 /nfs/dbraw/zinc/06/19/48/340061948.db2.gz IIXOIVHKHUMXDK-MRXNPFEDSA-N 1 2 322.408 4.413 20 0 DIADLO CCC(CC)(C(=O)Nc1cc[nH+]cc1C)c1ccc(Cl)cc1 ZINC000501221081 340076498 /nfs/dbraw/zinc/07/64/98/340076498.db2.gz HBIXHFKJWKSXIM-UHFFFAOYSA-N 1 2 316.832 4.162 20 0 DIADLO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+]1CC[C@@](C)(F)C1 ZINC000501415849 340080528 /nfs/dbraw/zinc/08/05/28/340080528.db2.gz FYRZUGZPLQSYAJ-BDJLRTHQSA-N 1 2 308.784 4.490 20 0 DIADLO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1CC[C@@](C)(F)C1 ZINC000501415849 340080529 /nfs/dbraw/zinc/08/05/29/340080529.db2.gz FYRZUGZPLQSYAJ-BDJLRTHQSA-N 1 2 308.784 4.490 20 0 DIADLO CCCCn1c(SCC=C(C)C)nnc1[C@@H](CC)[NH+](C)C ZINC000501753122 340087924 /nfs/dbraw/zinc/08/79/24/340087924.db2.gz FHDOEESNZXSITI-CQSZACIVSA-N 1 2 310.511 4.149 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+]1CCc2c(cnn2-c2ccccc2)C1 ZINC000501999306 340092424 /nfs/dbraw/zinc/09/24/24/340092424.db2.gz ILHRFEIXRAHZMQ-OAHLLOKOSA-N 1 2 321.399 4.131 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+]1CCc2c(cnn2-c2ccccc2)C1 ZINC000501999306 340092425 /nfs/dbraw/zinc/09/24/25/340092425.db2.gz ILHRFEIXRAHZMQ-OAHLLOKOSA-N 1 2 321.399 4.131 20 0 DIADLO Clc1ccccc1C[N@@H+]1CCc2c(cnn2-c2ccccc2)C1 ZINC000502068050 340094671 /nfs/dbraw/zinc/09/46/71/340094671.db2.gz IIUUSFPVHCKRNI-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1ccccc1C[N@H+]1CCc2c(cnn2-c2ccccc2)C1 ZINC000502068050 340094672 /nfs/dbraw/zinc/09/46/72/340094672.db2.gz IIUUSFPVHCKRNI-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2c(F)cccc2OC(F)F)oc1C ZINC000502419357 340102794 /nfs/dbraw/zinc/10/27/94/340102794.db2.gz XFVXZXWCVXOTOU-JTQLQIEISA-N 1 2 313.319 4.488 20 0 DIADLO c1cn(-c2cccc(N[C@@H]3CCC[C@@H](c4cccnc4)C3)c2)c[nH+]1 ZINC000502472990 340105098 /nfs/dbraw/zinc/10/50/98/340105098.db2.gz BGUXHIOBHIZUHF-SJLPKXTDSA-N 1 2 318.424 4.406 20 0 DIADLO CC[C@@H]1C[C@@]1([NH2+]Cc1nnc(-c2ccco2)o1)c1cccc(C)c1 ZINC000502482025 340105634 /nfs/dbraw/zinc/10/56/34/340105634.db2.gz OSHKHXIHZAHBBY-KUHUBIRLSA-N 1 2 323.396 4.053 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCc4cccc(F)c4C3)co2)cc1 ZINC000502555470 340107566 /nfs/dbraw/zinc/10/75/66/340107566.db2.gz XIEWMFYXKQRSSH-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCc4cccc(F)c4C3)co2)cc1 ZINC000502555470 340107567 /nfs/dbraw/zinc/10/75/67/340107567.db2.gz XIEWMFYXKQRSSH-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2ccncc2Cl)C1 ZINC000502876659 340115237 /nfs/dbraw/zinc/11/52/37/340115237.db2.gz QTAOUEWLRQFNQB-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2ccncc2Cl)C1 ZINC000502876659 340115238 /nfs/dbraw/zinc/11/52/38/340115238.db2.gz QTAOUEWLRQFNQB-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000502952117 340117432 /nfs/dbraw/zinc/11/74/32/340117432.db2.gz KKXNBCUFBNQJSQ-IBGZPJMESA-N 1 2 316.420 4.351 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000502952117 340117433 /nfs/dbraw/zinc/11/74/33/340117433.db2.gz KKXNBCUFBNQJSQ-IBGZPJMESA-N 1 2 316.420 4.351 20 0 DIADLO O=C(Nc1cccc2ccsc21)[C@H]1CC[N@@H+]1Cc1ccccc1 ZINC000502955602 340117502 /nfs/dbraw/zinc/11/75/02/340117502.db2.gz GGDNTBSZAFMUGV-QGZVFWFLSA-N 1 2 322.433 4.114 20 0 DIADLO O=C(Nc1cccc2ccsc21)[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000502955602 340117503 /nfs/dbraw/zinc/11/75/03/340117503.db2.gz GGDNTBSZAFMUGV-QGZVFWFLSA-N 1 2 322.433 4.114 20 0 DIADLO Cc1cc(F)cc([C@]2(F)CC[N@H+](C/C=C/c3ccncc3)C2)c1 ZINC000503030266 340119096 /nfs/dbraw/zinc/11/90/96/340119096.db2.gz GMKBPGWGWJSEEZ-PHXNAMCJSA-N 1 2 314.379 4.113 20 0 DIADLO Cc1cc(F)cc([C@]2(F)CC[N@@H+](C/C=C/c3ccncc3)C2)c1 ZINC000503030266 340119097 /nfs/dbraw/zinc/11/90/97/340119097.db2.gz GMKBPGWGWJSEEZ-PHXNAMCJSA-N 1 2 314.379 4.113 20 0 DIADLO CC[C@@H](C)[C@@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000503037472 340119168 /nfs/dbraw/zinc/11/91/68/340119168.db2.gz GXNJSAYYWDARLS-VXGBXAGGSA-N 1 2 305.809 4.146 20 0 DIADLO c1ccc2sc([C@@H]3COCC[N@H+]3C[C@H]3CC=CCC3)nc2c1 ZINC000503037882 340119365 /nfs/dbraw/zinc/11/93/65/340119365.db2.gz YPZOSSMGKWCBTO-HOCLYGCPSA-N 1 2 314.454 4.026 20 0 DIADLO c1ccc2sc([C@@H]3COCC[N@@H+]3C[C@H]3CC=CCC3)nc2c1 ZINC000503037882 340119366 /nfs/dbraw/zinc/11/93/66/340119366.db2.gz YPZOSSMGKWCBTO-HOCLYGCPSA-N 1 2 314.454 4.026 20 0 DIADLO CC[C@@H](C)[C@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000503037469 340119379 /nfs/dbraw/zinc/11/93/79/340119379.db2.gz GXNJSAYYWDARLS-NEPJUHHUSA-N 1 2 305.809 4.146 20 0 DIADLO CC[C@H](C)[C@@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000503037470 340119416 /nfs/dbraw/zinc/11/94/16/340119416.db2.gz GXNJSAYYWDARLS-NWDGAFQWSA-N 1 2 305.809 4.146 20 0 DIADLO FC(F)[C@H]1CCCC[N@@H+]1Cc1cccc(-c2ccncc2)c1 ZINC000503100528 340121025 /nfs/dbraw/zinc/12/10/25/340121025.db2.gz QXXYDOVFGGNFDF-QGZVFWFLSA-N 1 2 302.368 4.368 20 0 DIADLO FC(F)[C@H]1CCCC[N@H+]1Cc1cccc(-c2ccncc2)c1 ZINC000503100528 340121026 /nfs/dbraw/zinc/12/10/26/340121026.db2.gz QXXYDOVFGGNFDF-QGZVFWFLSA-N 1 2 302.368 4.368 20 0 DIADLO CCCCc1noc(C[NH2+][C@@]2(c3ccc(Cl)cc3)C[C@@H]2C)n1 ZINC000503390155 340127060 /nfs/dbraw/zinc/12/70/60/340127060.db2.gz JCRAPXXERKALRM-SJCJKPOMSA-N 1 2 319.836 4.091 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc(Cl)c(C)c3)CCCCC2)no1 ZINC000503562447 340130702 /nfs/dbraw/zinc/13/07/02/340130702.db2.gz KMKUQQUVZWUVFC-UHFFFAOYSA-N 1 2 319.836 4.289 20 0 DIADLO CCCOc1cccc2c(N[C@H](C)[C@H]3CCCOC3)cc[nH+]c12 ZINC000503577035 340131442 /nfs/dbraw/zinc/13/14/42/340131442.db2.gz UHYMJZFFOSKWQI-CABCVRRESA-N 1 2 314.429 4.251 20 0 DIADLO C[C@H]([NH2+]C1(C(F)F)CC1)c1ccc(SCC(F)F)cc1 ZINC000503868900 340135468 /nfs/dbraw/zinc/13/54/68/340135468.db2.gz CVAFNBWPSCVMJL-VIFPVBQESA-N 1 2 307.356 4.492 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]C2(C(F)F)CC2)c2cccc(Br)c21 ZINC000503950067 340138384 /nfs/dbraw/zinc/13/83/84/340138384.db2.gz SMRVRTRZFHYBTK-KCJUWKMLSA-N 1 2 316.189 4.385 20 0 DIADLO C[C@H]1CC(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)C[C@H](C)C1 ZINC000504072494 340140340 /nfs/dbraw/zinc/14/03/40/340140340.db2.gz FGKIVASJKJGCSD-ZIAGYGMSSA-N 1 2 311.429 4.098 20 0 DIADLO CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000504151808 340141717 /nfs/dbraw/zinc/14/17/17/340141717.db2.gz SAXRHOBQYRUPEN-RTBURBONSA-N 1 2 323.440 4.002 20 0 DIADLO Cc1cc(NC(=O)N2CCCC[C@@H]2c2cccc(C)c2C)cc[nH+]1 ZINC000504150210 340141858 /nfs/dbraw/zinc/14/18/58/340141858.db2.gz HQGXHWBQNOQTID-LJQANCHMSA-N 1 2 323.440 4.188 20 0 DIADLO CC[C@H](CC(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000504347407 340145463 /nfs/dbraw/zinc/14/54/63/340145463.db2.gz MCPRQYSFMUCXMM-MRXNPFEDSA-N 1 2 319.408 4.395 20 0 DIADLO Cc1ccc(C)c(CC(=O)Nc2c[nH+]ccc2OC(C)(C)C)c1 ZINC000504610885 340150130 /nfs/dbraw/zinc/15/01/30/340150130.db2.gz BLMBAXMRIDMFTJ-UHFFFAOYSA-N 1 2 312.413 4.057 20 0 DIADLO C(=C/[C@@H]1CCC[N@H+]1Cc1nc(C2CCCC2)no1)\c1ccccc1 ZINC000505819232 340178825 /nfs/dbraw/zinc/17/88/25/340178825.db2.gz LXTWPCXSZSSXIJ-HHNLSAEISA-N 1 2 323.440 4.405 20 0 DIADLO C(=C/[C@@H]1CCC[N@@H+]1Cc1nc(C2CCCC2)no1)\c1ccccc1 ZINC000505819232 340178826 /nfs/dbraw/zinc/17/88/26/340178826.db2.gz LXTWPCXSZSSXIJ-HHNLSAEISA-N 1 2 323.440 4.405 20 0 DIADLO CCCCc1noc(C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)n1 ZINC000505830312 340179145 /nfs/dbraw/zinc/17/91/45/340179145.db2.gz FTWRCUISYVTXLL-UJGDBWEASA-N 1 2 311.429 4.090 20 0 DIADLO CCCCc1noc(C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)n1 ZINC000505830312 340179146 /nfs/dbraw/zinc/17/91/46/340179146.db2.gz FTWRCUISYVTXLL-UJGDBWEASA-N 1 2 311.429 4.090 20 0 DIADLO Cc1cnc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000505854080 340179738 /nfs/dbraw/zinc/17/97/38/340179738.db2.gz ZSUWGSKYJLKQOM-CYBMUJFWSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1cnc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000505854080 340179739 /nfs/dbraw/zinc/17/97/39/340179739.db2.gz ZSUWGSKYJLKQOM-CYBMUJFWSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1ccc(OCCCn2c[nH+]c3cc(F)c(F)cc32)cc1C ZINC000506067702 340184822 /nfs/dbraw/zinc/18/48/22/340184822.db2.gz WLXATPUHNIOADM-UHFFFAOYSA-N 1 2 316.351 4.400 20 0 DIADLO C[N@H+](Cc1ccco1)Cc1ccc(Cl)cc1Br ZINC000506099446 340185570 /nfs/dbraw/zinc/18/55/70/340185570.db2.gz QOIKKUNMTJYSLG-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO C[N@@H+](Cc1ccco1)Cc1ccc(Cl)cc1Br ZINC000506099446 340185571 /nfs/dbraw/zinc/18/55/71/340185571.db2.gz QOIKKUNMTJYSLG-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO Fc1ccc2c(c1)CCCN2Cc1[nH+]ccn1Cc1ccccc1 ZINC000506168909 340187343 /nfs/dbraw/zinc/18/73/43/340187343.db2.gz QQQVFEHXSNNTSX-UHFFFAOYSA-N 1 2 321.399 4.023 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](C)Cc2ccc(Br)o2)o1 ZINC000506187005 340187961 /nfs/dbraw/zinc/18/79/61/340187961.db2.gz CRAWDZRLZDORRY-GWCFXTLKSA-N 1 2 324.218 4.391 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2ccc(Br)o2)o1 ZINC000506187005 340187962 /nfs/dbraw/zinc/18/79/62/340187962.db2.gz CRAWDZRLZDORRY-GWCFXTLKSA-N 1 2 324.218 4.391 20 0 DIADLO Fc1cc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)ccc1Cl ZINC000506370895 340193487 /nfs/dbraw/zinc/19/34/87/340193487.db2.gz QPMWUOBGGCCSLO-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1cc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)ccc1Cl ZINC000506370895 340193488 /nfs/dbraw/zinc/19/34/88/340193488.db2.gz QPMWUOBGGCCSLO-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2c(OC(F)F)ccc3ccccc32)CCO1 ZINC000506380173 340193717 /nfs/dbraw/zinc/19/37/17/340193717.db2.gz KVHYCOBFXKBVON-CQSZACIVSA-N 1 2 321.367 4.052 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)CCO1 ZINC000506380173 340193718 /nfs/dbraw/zinc/19/37/18/340193718.db2.gz KVHYCOBFXKBVON-CQSZACIVSA-N 1 2 321.367 4.052 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2Br)CCS1 ZINC000506475284 340194807 /nfs/dbraw/zinc/19/48/07/340194807.db2.gz UYSMCTSTDVUOSR-SECBINFHSA-N 1 2 320.683 4.040 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2Br)CCS1 ZINC000506475284 340194808 /nfs/dbraw/zinc/19/48/08/340194808.db2.gz UYSMCTSTDVUOSR-SECBINFHSA-N 1 2 320.683 4.040 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cc(-c2ccccc2)n[nH]1 ZINC000506583463 340197119 /nfs/dbraw/zinc/19/71/19/340197119.db2.gz CNEUSYHJPQNQOV-CQSZACIVSA-N 1 2 309.388 4.409 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cc(-c2ccccc2)n[nH]1 ZINC000506583463 340197120 /nfs/dbraw/zinc/19/71/20/340197120.db2.gz CNEUSYHJPQNQOV-CQSZACIVSA-N 1 2 309.388 4.409 20 0 DIADLO C[C@@H]1CCc2nc(C[N@H+](Cc3cccs3)C3CC3)sc2C1 ZINC000506614486 340197621 /nfs/dbraw/zinc/19/76/21/340197621.db2.gz HYKQQRZAGYGMDN-GFCCVEGCSA-N 1 2 318.511 4.494 20 0 DIADLO C[C@@H]1CCc2nc(C[N@@H+](Cc3cccs3)C3CC3)sc2C1 ZINC000506614486 340197622 /nfs/dbraw/zinc/19/76/22/340197622.db2.gz HYKQQRZAGYGMDN-GFCCVEGCSA-N 1 2 318.511 4.494 20 0 DIADLO O=C(c1ccccc1)C1CC[NH+](Cc2ccc(Cl)o2)CC1 ZINC000506647111 340198499 /nfs/dbraw/zinc/19/84/99/340198499.db2.gz UFGXATHCVOSGQH-UHFFFAOYSA-N 1 2 303.789 4.028 20 0 DIADLO CCCCOc1ccc(C[N@H+](C)Cc2csc(C)n2)cc1 ZINC000506668263 340199065 /nfs/dbraw/zinc/19/90/65/340199065.db2.gz HXGZZILECJDCCB-UHFFFAOYSA-N 1 2 304.459 4.262 20 0 DIADLO CCCCOc1ccc(C[N@@H+](C)Cc2csc(C)n2)cc1 ZINC000506668263 340199066 /nfs/dbraw/zinc/19/90/66/340199066.db2.gz HXGZZILECJDCCB-UHFFFAOYSA-N 1 2 304.459 4.262 20 0 DIADLO CCn1c2ccccc2c2cc(C[N@H+](C)Cc3cc[nH]n3)ccc21 ZINC000506706611 340199817 /nfs/dbraw/zinc/19/98/17/340199817.db2.gz LMKVYINPQGBDFR-UHFFFAOYSA-N 1 2 318.424 4.170 20 0 DIADLO CCn1c2ccccc2c2cc(C[N@@H+](C)Cc3cc[nH]n3)ccc21 ZINC000506706611 340199818 /nfs/dbraw/zinc/19/98/18/340199818.db2.gz LMKVYINPQGBDFR-UHFFFAOYSA-N 1 2 318.424 4.170 20 0 DIADLO Cc1[nH+]c2ccccn2c1CN(C)Cc1c(F)cccc1Cl ZINC000506788914 340201831 /nfs/dbraw/zinc/20/18/31/340201831.db2.gz IPAKIBRLCNGUFE-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cc(C(F)(F)F)ccc2F)o1 ZINC000506805043 340202117 /nfs/dbraw/zinc/20/21/17/340202117.db2.gz JHXZGANBZJQQHY-UHFFFAOYSA-N 1 2 301.283 4.378 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cc(C(F)(F)F)ccc2F)o1 ZINC000506805043 340202118 /nfs/dbraw/zinc/20/21/18/340202118.db2.gz JHXZGANBZJQQHY-UHFFFAOYSA-N 1 2 301.283 4.378 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](c2ccccc2)C(C)(C)C)no1 ZINC000507003570 340205107 /nfs/dbraw/zinc/20/51/07/340205107.db2.gz WNYAVJMDENUGBT-QGZVFWFLSA-N 1 2 301.434 4.289 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)s1 ZINC000507079779 340206735 /nfs/dbraw/zinc/20/67/35/340206735.db2.gz ZKBSVZCJFVLBIF-OAHLLOKOSA-N 1 2 322.474 4.482 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)s1 ZINC000507079779 340206736 /nfs/dbraw/zinc/20/67/36/340206736.db2.gz ZKBSVZCJFVLBIF-OAHLLOKOSA-N 1 2 322.474 4.482 20 0 DIADLO COCc1ccccc1/C=C(/C)C[N@H+](C)Cc1csc(C)n1 ZINC000507089733 340207110 /nfs/dbraw/zinc/20/71/10/340207110.db2.gz VFCMCUFIXOBKOZ-ZROIWOOFSA-N 1 2 316.470 4.133 20 0 DIADLO COCc1ccccc1/C=C(/C)C[N@@H+](C)Cc1csc(C)n1 ZINC000507089733 340207111 /nfs/dbraw/zinc/20/71/11/340207111.db2.gz VFCMCUFIXOBKOZ-ZROIWOOFSA-N 1 2 316.470 4.133 20 0 DIADLO COCc1ccc(C[N@H+](C)Cc2c(Cl)cccc2Cl)o1 ZINC000507144204 340209526 /nfs/dbraw/zinc/20/95/26/340209526.db2.gz OOTBEARNPIIUKQ-UHFFFAOYSA-N 1 2 314.212 4.365 20 0 DIADLO COCc1ccc(C[N@@H+](C)Cc2c(Cl)cccc2Cl)o1 ZINC000507144204 340209527 /nfs/dbraw/zinc/20/95/27/340209527.db2.gz OOTBEARNPIIUKQ-UHFFFAOYSA-N 1 2 314.212 4.365 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1cccc(O)c1Cl ZINC000507190061 340212135 /nfs/dbraw/zinc/21/21/35/340212135.db2.gz YECAFBLLFHKCHE-UHFFFAOYSA-N 1 2 305.805 4.076 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1cccc(O)c1Cl ZINC000507190061 340212136 /nfs/dbraw/zinc/21/21/36/340212136.db2.gz YECAFBLLFHKCHE-UHFFFAOYSA-N 1 2 305.805 4.076 20 0 DIADLO COCc1cccc(C[N@H+](C)[C@@H](C)c2c(F)cccc2F)c1 ZINC000507190795 340212182 /nfs/dbraw/zinc/21/21/82/340212182.db2.gz FQUWHSIPLIRYJF-ZDUSSCGKSA-N 1 2 305.368 4.304 20 0 DIADLO COCc1cccc(C[N@@H+](C)[C@@H](C)c2c(F)cccc2F)c1 ZINC000507190795 340212183 /nfs/dbraw/zinc/21/21/83/340212183.db2.gz FQUWHSIPLIRYJF-ZDUSSCGKSA-N 1 2 305.368 4.304 20 0 DIADLO Cc1nccc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000507191816 340212333 /nfs/dbraw/zinc/21/23/33/340212333.db2.gz PHXBNFMBRLIJBY-SNVBAGLBSA-N 1 2 310.228 4.285 20 0 DIADLO Cc1nccc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000507191816 340212334 /nfs/dbraw/zinc/21/23/34/340212334.db2.gz PHXBNFMBRLIJBY-SNVBAGLBSA-N 1 2 310.228 4.285 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000507200877 340212972 /nfs/dbraw/zinc/21/29/72/340212972.db2.gz DWCQIOAUOPRTDF-LLVKDONJSA-N 1 2 321.396 4.175 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000507200877 340212973 /nfs/dbraw/zinc/21/29/73/340212973.db2.gz DWCQIOAUOPRTDF-LLVKDONJSA-N 1 2 321.396 4.175 20 0 DIADLO Cc1ccn2c(C[N@@H+](C)[C@@H](C)c3cc(F)ccc3F)cnc2c1 ZINC000507203958 340213098 /nfs/dbraw/zinc/21/30/98/340213098.db2.gz OZMVVWIUYJZZRX-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1ccn2c(C[N@H+](C)[C@@H](C)c3cc(F)ccc3F)cnc2c1 ZINC000507203958 340213099 /nfs/dbraw/zinc/21/30/99/340213099.db2.gz OZMVVWIUYJZZRX-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO Oc1ccc(F)c(C[N@H+](Cc2ccco2)C2CCCC2)c1F ZINC000507205311 340213178 /nfs/dbraw/zinc/21/31/78/340213178.db2.gz VNAHWFDZOWLZJT-UHFFFAOYSA-N 1 2 307.340 4.208 20 0 DIADLO Oc1ccc(F)c(C[N@@H+](Cc2ccco2)C2CCCC2)c1F ZINC000507205311 340213179 /nfs/dbraw/zinc/21/31/79/340213179.db2.gz VNAHWFDZOWLZJT-UHFFFAOYSA-N 1 2 307.340 4.208 20 0 DIADLO Cc1cccn2c(C[N@@H+](C)[C@H](C)c3cc(F)ccc3F)cnc12 ZINC000507216614 340213970 /nfs/dbraw/zinc/21/39/70/340213970.db2.gz YQHDXZWZOHERND-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1cccn2c(C[N@H+](C)[C@H](C)c3cc(F)ccc3F)cnc12 ZINC000507216614 340213971 /nfs/dbraw/zinc/21/39/71/340213971.db2.gz YQHDXZWZOHERND-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1cccn2c(CN(C)[C@H](C)c3cc(F)ccc3F)c[nH+]c12 ZINC000507216614 340213972 /nfs/dbraw/zinc/21/39/72/340213972.db2.gz YQHDXZWZOHERND-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1nccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)n1 ZINC000507221346 340214140 /nfs/dbraw/zinc/21/41/40/340214140.db2.gz ILWXTWNDQDXQRC-MRXNPFEDSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1nccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)n1 ZINC000507221346 340214141 /nfs/dbraw/zinc/21/41/41/340214141.db2.gz ILWXTWNDQDXQRC-MRXNPFEDSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1ccc2[nH+]cc(CN(C)[C@H](C)c3cc(F)ccc3F)n2c1 ZINC000507223416 340214543 /nfs/dbraw/zinc/21/45/43/340214543.db2.gz ZZZWTDJVFPWODC-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1ccc2ncc(C[N@@H+](C)[C@H](C)c3cc(F)ccc3F)n2c1 ZINC000507223416 340214544 /nfs/dbraw/zinc/21/45/44/340214544.db2.gz ZZZWTDJVFPWODC-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1ccc2ncc(C[N@H+](C)[C@H](C)c3cc(F)ccc3F)n2c1 ZINC000507223416 340214545 /nfs/dbraw/zinc/21/45/45/340214545.db2.gz ZZZWTDJVFPWODC-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO CCOC(=O)c1ccc(C[N@H+](C)[C@H](C)c2ccccc2Cl)o1 ZINC000507233250 340214869 /nfs/dbraw/zinc/21/48/69/340214869.db2.gz QKALIFYBLGUIIU-GFCCVEGCSA-N 1 2 321.804 4.303 20 0 DIADLO CCOC(=O)c1ccc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)o1 ZINC000507233250 340214870 /nfs/dbraw/zinc/21/48/70/340214870.db2.gz QKALIFYBLGUIIU-GFCCVEGCSA-N 1 2 321.804 4.303 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)[C@H](C)c1c(F)cccc1F ZINC000507252207 340215704 /nfs/dbraw/zinc/21/57/04/340215704.db2.gz MGRIDQAEQSOQAT-LLVKDONJSA-N 1 2 321.396 4.175 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)[C@H](C)c1c(F)cccc1F ZINC000507252207 340215705 /nfs/dbraw/zinc/21/57/05/340215705.db2.gz MGRIDQAEQSOQAT-LLVKDONJSA-N 1 2 321.396 4.175 20 0 DIADLO C[N@H+](CCc1cccc2ccccc21)Cc1noc(C(C)(C)C)n1 ZINC000507275363 340216400 /nfs/dbraw/zinc/21/64/00/340216400.db2.gz CCJVGYNMNWWXGS-UHFFFAOYSA-N 1 2 323.440 4.195 20 0 DIADLO C[N@@H+](CCc1cccc2ccccc21)Cc1noc(C(C)(C)C)n1 ZINC000507275363 340216401 /nfs/dbraw/zinc/21/64/01/340216401.db2.gz CCJVGYNMNWWXGS-UHFFFAOYSA-N 1 2 323.440 4.195 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](Cc3ccc(Cl)cc3)CCO2)cc1 ZINC000507340146 340217646 /nfs/dbraw/zinc/21/76/46/340217646.db2.gz LWCFHRQERRPZAK-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](Cc3ccc(Cl)cc3)CCO2)cc1 ZINC000507340146 340217647 /nfs/dbraw/zinc/21/76/47/340217647.db2.gz LWCFHRQERRPZAK-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3)C2)o1 ZINC000507360178 340217926 /nfs/dbraw/zinc/21/79/26/340217926.db2.gz RDXGAEGPVYDHLT-XVGQJIODSA-N 1 2 315.388 4.116 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3)C2)o1 ZINC000507360178 340217927 /nfs/dbraw/zinc/21/79/27/340217927.db2.gz RDXGAEGPVYDHLT-XVGQJIODSA-N 1 2 315.388 4.116 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3)C2)o1 ZINC000507360176 340217929 /nfs/dbraw/zinc/21/79/29/340217929.db2.gz RDXGAEGPVYDHLT-FMEYXAORSA-N 1 2 315.388 4.116 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CCO[C@H](c3ccc(F)cc3)C2)o1 ZINC000507360176 340217930 /nfs/dbraw/zinc/21/79/30/340217930.db2.gz RDXGAEGPVYDHLT-FMEYXAORSA-N 1 2 315.388 4.116 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000507505536 340223224 /nfs/dbraw/zinc/22/32/24/340223224.db2.gz FARDRCIEXJWDPO-GFCCVEGCSA-N 1 2 303.475 4.249 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1csc(-c2ccco2)n1 ZINC000507516413 340223823 /nfs/dbraw/zinc/22/38/23/340223823.db2.gz XMQWVJVDIBACLA-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO CC[N@H+](Cc1cccc(O)c1Cl)[C@H](C)c1cccc(O)c1 ZINC000507561391 340225141 /nfs/dbraw/zinc/22/51/41/340225141.db2.gz ASQKVMXVZHSHGD-GFCCVEGCSA-N 1 2 305.805 4.334 20 0 DIADLO CC[N@@H+](Cc1cccc(O)c1Cl)[C@H](C)c1cccc(O)c1 ZINC000507561391 340225142 /nfs/dbraw/zinc/22/51/42/340225142.db2.gz ASQKVMXVZHSHGD-GFCCVEGCSA-N 1 2 305.805 4.334 20 0 DIADLO CC[N@H+](Cc1nc(C(C)(C)C)no1)[C@H](C)c1ccc(F)cc1 ZINC000507685881 340228274 /nfs/dbraw/zinc/22/82/74/340228274.db2.gz FEPPOSHUEOTILM-GFCCVEGCSA-N 1 2 305.397 4.089 20 0 DIADLO CC[N@@H+](Cc1nc(C(C)(C)C)no1)[C@H](C)c1ccc(F)cc1 ZINC000507685881 340228275 /nfs/dbraw/zinc/22/82/75/340228275.db2.gz FEPPOSHUEOTILM-GFCCVEGCSA-N 1 2 305.397 4.089 20 0 DIADLO Fc1cccc(C[N@@H+]2CCO[C@H](c3ccccc3Cl)C2)c1 ZINC000507804527 340232299 /nfs/dbraw/zinc/23/22/99/340232299.db2.gz PADYQMLJYQRXDJ-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1cccc(C[N@H+]2CCO[C@H](c3ccccc3Cl)C2)c1 ZINC000507804527 340232300 /nfs/dbraw/zinc/23/23/00/340232300.db2.gz PADYQMLJYQRXDJ-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@H](c3cccs3)C2)ccc1Cl ZINC000507814488 340232875 /nfs/dbraw/zinc/23/28/75/340232875.db2.gz MHHDRLKSMNHSOJ-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@H](c3cccs3)C2)ccc1Cl ZINC000507814488 340232876 /nfs/dbraw/zinc/23/28/76/340232876.db2.gz MHHDRLKSMNHSOJ-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cccc2[nH+]c(CCc3nc(CCC(C)(C)C)no3)[nH]c21 ZINC000508618074 340248374 /nfs/dbraw/zinc/24/83/74/340248374.db2.gz IQIRFXMFZLQQNE-UHFFFAOYSA-N 1 2 312.417 4.018 20 0 DIADLO Cc1cccc2[nH]c(CCc3nc(CCC(C)(C)C)no3)[nH+]c21 ZINC000508618074 340248375 /nfs/dbraw/zinc/24/83/75/340248375.db2.gz IQIRFXMFZLQQNE-UHFFFAOYSA-N 1 2 312.417 4.018 20 0 DIADLO Cc1ccc(-c2ccc(C[N@@H+](C)Cc3nccn3C)s2)cc1 ZINC000508657296 340249767 /nfs/dbraw/zinc/24/97/67/340249767.db2.gz RQRJHTSZBOIKFA-UHFFFAOYSA-N 1 2 311.454 4.089 20 0 DIADLO Cc1ccc(-c2ccc(C[N@H+](C)Cc3nccn3C)s2)cc1 ZINC000508657296 340249768 /nfs/dbraw/zinc/24/97/68/340249768.db2.gz RQRJHTSZBOIKFA-UHFFFAOYSA-N 1 2 311.454 4.089 20 0 DIADLO CCOc1ccc2c(c1)CC[N@@H+](Cc1cccc(O)c1Cl)C2 ZINC000508790910 340253083 /nfs/dbraw/zinc/25/30/83/340253083.db2.gz VNNFKMIGFZKPAN-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1ccc2c(c1)CC[N@H+](Cc1cccc(O)c1Cl)C2 ZINC000508790910 340253084 /nfs/dbraw/zinc/25/30/84/340253084.db2.gz VNNFKMIGFZKPAN-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO Clc1ccccc1[C@@H]1C[N@H+](C/C=C/c2ccccc2)CCO1 ZINC000509048408 340259392 /nfs/dbraw/zinc/25/93/92/340259392.db2.gz NEZTWQFKAXOFTJ-AIADIJKESA-N 1 2 313.828 4.427 20 0 DIADLO Clc1ccccc1[C@@H]1C[N@@H+](C/C=C/c2ccccc2)CCO1 ZINC000509048408 340259393 /nfs/dbraw/zinc/25/93/93/340259393.db2.gz NEZTWQFKAXOFTJ-AIADIJKESA-N 1 2 313.828 4.427 20 0 DIADLO CN(C(=O)c1ccccc1Oc1cc[nH+]cc1)c1ccccc1 ZINC000509059391 340259934 /nfs/dbraw/zinc/25/99/34/340259934.db2.gz AMBXAMCNDFBWDV-UHFFFAOYSA-N 1 2 304.349 4.151 20 0 DIADLO C[C@@H]1CCC[C@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)[C@@H]1C ZINC000509120728 340261691 /nfs/dbraw/zinc/26/16/91/340261691.db2.gz FVLZYPKOIWVHGS-RKVPGOIHSA-N 1 2 324.424 4.428 20 0 DIADLO O=C(NCC12CCC(CC1)C2)c1ccccc1Oc1cc[nH+]cc1 ZINC000509287146 340265385 /nfs/dbraw/zinc/26/53/85/340265385.db2.gz QZVFFBKEALZFOM-UHFFFAOYSA-N 1 2 322.408 4.184 20 0 DIADLO C[C@@H]1CC[C@@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)C[C@@H]1C ZINC000509305139 340265759 /nfs/dbraw/zinc/26/57/59/340265759.db2.gz SQEHPACBTYSYRG-OWCLPIDISA-N 1 2 324.424 4.428 20 0 DIADLO CN(C[C@H]1CC=CCC1)C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509307287 340265826 /nfs/dbraw/zinc/26/58/26/340265826.db2.gz SJJFTLZBIGGMGA-INIZCTEOSA-N 1 2 322.408 4.302 20 0 DIADLO CCCCN(Cc1c[nH+]c2ccc(Cl)cn12)CC(F)(F)F ZINC000509581204 340274009 /nfs/dbraw/zinc/27/40/09/340274009.db2.gz ZNJQXZWYPLDGAW-UHFFFAOYSA-N 1 2 319.758 4.152 20 0 DIADLO Oc1ccc(F)c(C[NH2+]Cc2ccc(Cl)cc2Cl)c1F ZINC000509621986 340274916 /nfs/dbraw/zinc/27/49/16/340274916.db2.gz NJZPFMKPBDBCDD-UHFFFAOYSA-N 1 2 318.150 4.267 20 0 DIADLO FC(F)(F)c1nn(C[C@H]2CCCC(F)(F)C2)c2cc[nH+]cc21 ZINC000509743345 340278239 /nfs/dbraw/zinc/27/82/39/340278239.db2.gz AEQFSOUOZCHKCA-VIFPVBQESA-N 1 2 319.277 4.276 20 0 DIADLO Cc1ccc(-n2cc[nH+]c2)c(C(=O)Nc2cc(C)cc(C)c2)c1 ZINC000509755813 340278482 /nfs/dbraw/zinc/27/84/82/340278482.db2.gz NXGAWUDAGATION-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO O=C(c1ccccc1Oc1cc[nH+]cc1)N1CCC[C@@H]2CCC[C@@H]21 ZINC000509993384 340284934 /nfs/dbraw/zinc/28/49/34/340284934.db2.gz FSZOMXIFAMOQPQ-YJBOKZPZSA-N 1 2 322.408 4.279 20 0 DIADLO FC(F)(F)c1cccc(C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)c1 ZINC000510069962 340287328 /nfs/dbraw/zinc/28/73/28/340287328.db2.gz GZAOTPDOQIRXOU-HNNXBMFYSA-N 1 2 309.335 4.156 20 0 DIADLO FC(F)(F)c1cccc(C[N@H+]2CCCC[C@H]2c2cc[nH]n2)c1 ZINC000510069962 340287329 /nfs/dbraw/zinc/28/73/29/340287329.db2.gz GZAOTPDOQIRXOU-HNNXBMFYSA-N 1 2 309.335 4.156 20 0 DIADLO Clc1ccc2[nH+]c(CN3CCSc4ccccc43)cn2c1 ZINC000510138996 340290229 /nfs/dbraw/zinc/29/02/29/340290229.db2.gz GUTZNPHXIZWDJY-UHFFFAOYSA-N 1 2 315.829 4.100 20 0 DIADLO COc1ccccc1[C@@H]1CC[C@@H](C)C[N@@H+]1Cc1cscn1 ZINC000510224995 340293143 /nfs/dbraw/zinc/29/31/43/340293143.db2.gz WBLJEKIPFQPCOP-CJNGLKHVSA-N 1 2 302.443 4.125 20 0 DIADLO COc1ccccc1[C@@H]1CC[C@@H](C)C[N@H+]1Cc1cscn1 ZINC000510224995 340293144 /nfs/dbraw/zinc/29/31/44/340293144.db2.gz WBLJEKIPFQPCOP-CJNGLKHVSA-N 1 2 302.443 4.125 20 0 DIADLO C[C@@H]1CCC[C@H]1CNC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000510750998 340309580 /nfs/dbraw/zinc/30/95/80/340309580.db2.gz MWFGZNIHOQFADM-CABCVRRESA-N 1 2 310.397 4.040 20 0 DIADLO C[C@@H]1CC[C@@H](CNC(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000510781674 340310807 /nfs/dbraw/zinc/31/08/07/340310807.db2.gz NOONOQMTDNNILN-HUUCEWRRSA-N 1 2 310.397 4.040 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)c1sccc1-c1ccccc1 ZINC000511006650 340318063 /nfs/dbraw/zinc/31/80/63/340318063.db2.gz DNTVHFWLRVIDTF-UHFFFAOYSA-N 1 2 308.406 4.047 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccc(F)cc2Cl)CC2CC2)no1 ZINC000511064536 340319846 /nfs/dbraw/zinc/31/98/46/340319846.db2.gz KXVKSAWNKYISOA-UHFFFAOYSA-N 1 2 308.784 4.188 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccc(F)cc2Cl)CC2CC2)no1 ZINC000511064536 340319847 /nfs/dbraw/zinc/31/98/47/340319847.db2.gz KXVKSAWNKYISOA-UHFFFAOYSA-N 1 2 308.784 4.188 20 0 DIADLO Cc1ccc(C)c(C[N@H+](C)Cc2nc(-c3cccs3)no2)c1 ZINC000511073193 340320136 /nfs/dbraw/zinc/32/01/36/340320136.db2.gz ITRZPPALNDFJDT-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccc(C)c(C[N@@H+](C)Cc2nc(-c3cccs3)no2)c1 ZINC000511073193 340320137 /nfs/dbraw/zinc/32/01/37/340320137.db2.gz ITRZPPALNDFJDT-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO CC(C)Sc1ccc(C[N@@H+]2CCO[C@H](c3ccco3)C2)cc1 ZINC000511133001 340322057 /nfs/dbraw/zinc/32/20/57/340322057.db2.gz ZWRBLZWKYGDGQU-SFHVURJKSA-N 1 2 317.454 4.354 20 0 DIADLO CC(C)Sc1ccc(C[N@H+]2CCO[C@H](c3ccco3)C2)cc1 ZINC000511133001 340322058 /nfs/dbraw/zinc/32/20/58/340322058.db2.gz ZWRBLZWKYGDGQU-SFHVURJKSA-N 1 2 317.454 4.354 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@@H+]2Cc2ccccc2SC)o1 ZINC000511151873 340322542 /nfs/dbraw/zinc/32/25/42/340322542.db2.gz WXOKOACFQJJOKU-INIZCTEOSA-N 1 2 317.454 4.137 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@H+]2Cc2ccccc2SC)o1 ZINC000511151873 340322543 /nfs/dbraw/zinc/32/25/43/340322543.db2.gz WXOKOACFQJJOKU-INIZCTEOSA-N 1 2 317.454 4.137 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3ccon3)CC2)cc1Cl ZINC000511189511 340323502 /nfs/dbraw/zinc/32/35/02/340323502.db2.gz WWYDSKGOUJUGJT-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3ccon3)CC2)cc1Cl ZINC000511189511 340323503 /nfs/dbraw/zinc/32/35/03/340323503.db2.gz WWYDSKGOUJUGJT-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)C1CCCCC1 ZINC000511305622 340325042 /nfs/dbraw/zinc/32/50/42/340325042.db2.gz LPTSACUXYWXKGH-HNNXBMFYSA-N 1 2 311.429 4.417 20 0 DIADLO Clc1ccc([C@@H]2CC[N@@H+]2Cc2cccc3c2OCCO3)cc1 ZINC000511544593 340330172 /nfs/dbraw/zinc/33/01/72/340330172.db2.gz BZGVTPABTBTFAQ-INIZCTEOSA-N 1 2 315.800 4.058 20 0 DIADLO Clc1ccc([C@@H]2CC[N@H+]2Cc2cccc3c2OCCO3)cc1 ZINC000511544593 340330173 /nfs/dbraw/zinc/33/01/73/340330173.db2.gz BZGVTPABTBTFAQ-INIZCTEOSA-N 1 2 315.800 4.058 20 0 DIADLO Cc1ccc(C[N@H+](C)CCC(F)(F)F)c(Br)c1 ZINC000511747867 340336928 /nfs/dbraw/zinc/33/69/28/340336928.db2.gz CNSCHQLJLUWLFD-UHFFFAOYSA-N 1 2 310.157 4.142 20 0 DIADLO Cc1ccc(C[N@@H+](C)CCC(F)(F)F)c(Br)c1 ZINC000511747867 340336929 /nfs/dbraw/zinc/33/69/29/340336929.db2.gz CNSCHQLJLUWLFD-UHFFFAOYSA-N 1 2 310.157 4.142 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc2occc2c1)c1noc(-c2ccccc2)n1 ZINC000512029014 340345897 /nfs/dbraw/zinc/34/58/97/340345897.db2.gz ZZISMTLUDGUNAP-CYBMUJFWSA-N 1 2 319.364 4.334 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NCc2ccc3occc3c2)c1 ZINC000512065878 340347386 /nfs/dbraw/zinc/34/73/86/340347386.db2.gz BGORDIMYOHHSTE-UHFFFAOYSA-N 1 2 303.365 4.445 20 0 DIADLO Cc1ccc2c(c1)C[N@H+]([C@H](C)c1ncc(C(C)(C)C)o1)CCO2 ZINC000512162892 340350497 /nfs/dbraw/zinc/35/04/97/340350497.db2.gz DQGYFYSWSSCZSS-CQSZACIVSA-N 1 2 314.429 4.236 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+]([C@H](C)c1ncc(C(C)(C)C)o1)CCO2 ZINC000512162892 340350498 /nfs/dbraw/zinc/35/04/98/340350498.db2.gz DQGYFYSWSSCZSS-CQSZACIVSA-N 1 2 314.429 4.236 20 0 DIADLO C[C@@H]1CCCCC[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000512173911 340350944 /nfs/dbraw/zinc/35/09/44/340350944.db2.gz CGWSIVCRIHBXLN-LLVKDONJSA-N 1 2 315.244 4.196 20 0 DIADLO C[C@@H]1CCCCC[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000512173911 340350945 /nfs/dbraw/zinc/35/09/45/340350945.db2.gz CGWSIVCRIHBXLN-LLVKDONJSA-N 1 2 315.244 4.196 20 0 DIADLO Cc1nc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)sc1C ZINC000173189990 340359926 /nfs/dbraw/zinc/35/99/26/340359926.db2.gz WJHTZHSSCRUGJS-IBGZPJMESA-N 1 2 323.465 4.167 20 0 DIADLO Cc1nc(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)sc1C ZINC000173189990 340359927 /nfs/dbraw/zinc/35/99/27/340359927.db2.gz WJHTZHSSCRUGJS-IBGZPJMESA-N 1 2 323.465 4.167 20 0 DIADLO CSc1cccc(F)c1C[NH2+]Cc1cc(F)c(F)cc1F ZINC000512522781 340365445 /nfs/dbraw/zinc/36/54/45/340365445.db2.gz YYFQEVMIJPIOJA-UHFFFAOYSA-N 1 2 315.335 4.255 20 0 DIADLO Clc1cccc(CN2CCCC[C@H]2c2[nH]cc[nH+]2)c1Cl ZINC000512542715 340366235 /nfs/dbraw/zinc/36/62/35/340366235.db2.gz UANCABQTAACENI-ZDUSSCGKSA-N 1 2 310.228 4.444 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)[C@H](C)c1cccc(CC(C)C)c1 ZINC000512576446 340367675 /nfs/dbraw/zinc/36/76/75/340367675.db2.gz CMNJYSIHHGMLBI-OAHLLOKOSA-N 1 2 310.441 4.007 20 0 DIADLO CCC[N@@H+](Cc1c[nH]nc1-c1ccc(Cl)cc1)CC(F)F ZINC000512590225 340368229 /nfs/dbraw/zinc/36/82/29/340368229.db2.gz KIQHBKNNYVQFBN-UHFFFAOYSA-N 1 2 313.779 4.207 20 0 DIADLO CCC[N@H+](Cc1c[nH]nc1-c1ccc(Cl)cc1)CC(F)F ZINC000512590225 340368230 /nfs/dbraw/zinc/36/82/30/340368230.db2.gz KIQHBKNNYVQFBN-UHFFFAOYSA-N 1 2 313.779 4.207 20 0 DIADLO CCC[C@@H](C)CC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000512624766 340369647 /nfs/dbraw/zinc/36/96/47/340369647.db2.gz LPOQEKNFQNXIGA-GFCCVEGCSA-N 1 2 305.809 4.291 20 0 DIADLO C[C@H]1CCC[N@@H+]1CC(=O)Nc1c(Cl)cc(Cl)cc1Cl ZINC000173984795 340379369 /nfs/dbraw/zinc/37/93/69/340379369.db2.gz BRFOAMCTPCPLOC-QMMMGPOBSA-N 1 2 321.635 4.070 20 0 DIADLO C[C@H]1CCC[N@H+]1CC(=O)Nc1c(Cl)cc(Cl)cc1Cl ZINC000173984795 340379370 /nfs/dbraw/zinc/37/93/70/340379370.db2.gz BRFOAMCTPCPLOC-QMMMGPOBSA-N 1 2 321.635 4.070 20 0 DIADLO FC(F)C1([NH2+]Cc2cnc(-c3ccco3)s2)CCCCC1 ZINC000512912526 340383776 /nfs/dbraw/zinc/38/37/76/340383776.db2.gz FFEWAUZTCLXXFJ-UHFFFAOYSA-N 1 2 312.385 4.461 20 0 DIADLO Fc1ccc(-n2cc(C[NH2+]C3(C(F)F)CCCCC3)cn2)cc1 ZINC000512912905 340383801 /nfs/dbraw/zinc/38/38/01/340383801.db2.gz JEMJDHPKBJUUTH-UHFFFAOYSA-N 1 2 323.362 4.069 20 0 DIADLO CC(C)C1CCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000174506185 340390465 /nfs/dbraw/zinc/39/04/65/340390465.db2.gz WEIQAVARNLLECN-UHFFFAOYSA-N 1 2 324.424 4.382 20 0 DIADLO Cc1[nH]ncc1C[N@@H+]1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000513127041 340394274 /nfs/dbraw/zinc/39/42/74/340394274.db2.gz BTFJNQMFKLVJFB-INIZCTEOSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000513127041 340394275 /nfs/dbraw/zinc/39/42/75/340394275.db2.gz BTFJNQMFKLVJFB-INIZCTEOSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2sc3c(cccc3Cl)c2C)n1 ZINC000513159598 340395484 /nfs/dbraw/zinc/39/54/84/340395484.db2.gz LYNGDUDXIMMXLH-VIFPVBQESA-N 1 2 321.833 4.405 20 0 DIADLO CC1(C)C[N@H+](Cc2c(F)ccc(O)c2F)CC[C@H]1C(F)(F)F ZINC000513183375 340396044 /nfs/dbraw/zinc/39/60/44/340396044.db2.gz KWYNZWYTLDOEEQ-GFCCVEGCSA-N 1 2 323.305 4.081 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(F)ccc(O)c2F)CC[C@H]1C(F)(F)F ZINC000513183375 340396045 /nfs/dbraw/zinc/39/60/45/340396045.db2.gz KWYNZWYTLDOEEQ-GFCCVEGCSA-N 1 2 323.305 4.081 20 0 DIADLO CC(C)C1CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)CC1 ZINC000513438852 340407534 /nfs/dbraw/zinc/40/75/34/340407534.db2.gz JWCXMODQZTZQJE-UHFFFAOYSA-N 1 2 324.424 4.382 20 0 DIADLO Clc1cccc(Cl)c1C1CC[NH+](Cc2ccon2)CC1 ZINC000564152033 340482142 /nfs/dbraw/zinc/48/21/42/340482142.db2.gz KNGWKZROZNOKSZ-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO CCCCCc1[nH+]c2ccccc2n1C[C@@H](O)CC(F)(F)F ZINC000189309845 340533524 /nfs/dbraw/zinc/53/35/24/340533524.db2.gz BIQMWQHSIATKJK-LBPRGKRZSA-N 1 2 314.351 4.082 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](CC(F)(F)F)c2ccccc2)s1 ZINC000223669644 340546953 /nfs/dbraw/zinc/54/69/53/340546953.db2.gz OKFKRSQIRXYDCO-LBPRGKRZSA-N 1 2 300.349 4.235 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)n1 ZINC000193546548 340579485 /nfs/dbraw/zinc/57/94/85/340579485.db2.gz ZHVFODGVSRSTIR-OAHLLOKOSA-N 1 2 305.397 4.209 20 0 DIADLO CCN(C(=O)c1ccc(-n2cc[nH+]c2)cc1)c1cccc(C)c1C ZINC000522176293 340582103 /nfs/dbraw/zinc/58/21/03/340582103.db2.gz YUJMAKBQFHEMKQ-UHFFFAOYSA-N 1 2 319.408 4.156 20 0 DIADLO CC(C)(C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1cccs1 ZINC000522320746 340598861 /nfs/dbraw/zinc/59/88/61/340598861.db2.gz JSUZXKJNVRJDOM-UHFFFAOYSA-N 1 2 311.410 4.055 20 0 DIADLO Cc1cn2cc(NC(=O)N[C@@H](C)c3cc(C)cc(C)c3)ccc2[nH+]1 ZINC000524129989 340648056 /nfs/dbraw/zinc/64/80/56/340648056.db2.gz AFBCWPWOTULVMN-HNNXBMFYSA-N 1 2 322.412 4.142 20 0 DIADLO CC[C@H]([NH2+]Cc1c(Cl)cccc1OC)c1ccc(F)cn1 ZINC000234064973 340650768 /nfs/dbraw/zinc/65/07/68/340650768.db2.gz PTXTWKXAFZQTAX-AWEZNQCLSA-N 1 2 308.784 4.124 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccccc1Cl)c1nnc2n1CCCCC2 ZINC000315934014 340677463 /nfs/dbraw/zinc/67/74/63/340677463.db2.gz WEFJSGRVNBZNNV-CHWSQXEVSA-N 1 2 318.852 4.070 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2nc3cc(C)ccc3s2)n1 ZINC000528449761 340719715 /nfs/dbraw/zinc/71/97/15/340719715.db2.gz PXZGNDUNICNKGV-NSHDSACASA-N 1 2 303.456 4.220 20 0 DIADLO C[C@@H]1[C@H](C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)[C@H]1C1CC1 ZINC000528540001 340723620 /nfs/dbraw/zinc/72/36/20/340723620.db2.gz SOXNUNVPWOMVOV-RZAIGCCYSA-N 1 2 308.381 4.105 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](c2cccc(C)c2)C(C)C)n1 ZINC000528765853 340733009 /nfs/dbraw/zinc/73/30/09/340733009.db2.gz MMUKDACZRUWFIU-SFHVURJKSA-N 1 2 301.434 4.208 20 0 DIADLO CCO[C@@H](C)c1noc(C[NH2+][C@H](CC)c2cc(C)ccc2C)n1 ZINC000528802430 340735106 /nfs/dbraw/zinc/73/51/06/340735106.db2.gz SKOUTOGQJZJWFB-GOEBONIOSA-N 1 2 317.433 4.025 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cccc1OC(F)F)c1ccccc1F ZINC000530366387 340789560 /nfs/dbraw/zinc/78/95/60/340789560.db2.gz ZMJMWWGLZRYPSI-SNVBAGLBSA-N 1 2 313.294 4.417 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2nnsc2Cl)C(C)(C)C)c1 ZINC000538235957 340814435 /nfs/dbraw/zinc/81/44/35/340814435.db2.gz WKICGZWTCKDEPY-ZDUSSCGKSA-N 1 2 309.866 4.377 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2nnsc2Cl)C(C)(C)C)c1 ZINC000538235956 340814467 /nfs/dbraw/zinc/81/44/67/340814467.db2.gz WKICGZWTCKDEPY-CYBMUJFWSA-N 1 2 309.866 4.377 20 0 DIADLO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1)c1nc2ccccc2n1C ZINC000539163110 340875227 /nfs/dbraw/zinc/87/52/27/340875227.db2.gz BXTMNVIYNQDSJH-VNHYZAJKSA-N 1 2 309.413 4.141 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1nc(C(C)(C)C)no1 ZINC000539227040 340877477 /nfs/dbraw/zinc/87/74/77/340877477.db2.gz XTGVUIYZLOCZRG-CYBMUJFWSA-N 1 2 317.433 4.005 20 0 DIADLO CC(C)(C)C[C@@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(F)cc1 ZINC000539279872 340879352 /nfs/dbraw/zinc/87/93/52/340879352.db2.gz IAISYGQZOLYSAD-OAHLLOKOSA-N 1 2 317.408 4.353 20 0 DIADLO C[C@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1cccc(F)c1F ZINC000539328912 340881348 /nfs/dbraw/zinc/88/13/48/340881348.db2.gz RUCJMQVDVLZGLQ-VIFPVBQESA-N 1 2 306.287 4.096 20 0 DIADLO COc1cccc2c1CC[C@H]2Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000539630862 340893639 /nfs/dbraw/zinc/89/36/39/340893639.db2.gz WTLXPEOCGSCFON-GOSISDBHSA-N 1 2 323.440 4.180 20 0 DIADLO CCCOc1cccc2c(NCc3ccccc3CO)cc[nH+]c12 ZINC000540870373 340949060 /nfs/dbraw/zinc/94/90/60/340949060.db2.gz XVQIONPVQSRZMU-UHFFFAOYSA-N 1 2 322.408 4.128 20 0 DIADLO Fc1ccccc1-c1n[nH]cc1CNc1c[nH+]c2c(c1)CCCC2 ZINC000541066004 340958280 /nfs/dbraw/zinc/95/82/80/340958280.db2.gz XSSHAVPXQKGWHI-UHFFFAOYSA-N 1 2 322.387 4.102 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1OC(F)F)c1ccon1 ZINC000541771925 340983526 /nfs/dbraw/zinc/98/35/26/340983526.db2.gz RDNWUZFYRGTNMS-DTWKUNHWSA-N 1 2 316.735 4.341 20 0 DIADLO C[C@@H](c1noc(-c2cccc(Cn3cc[nH+]c3)c2)n1)C(C)(C)C ZINC000564250535 340988316 /nfs/dbraw/zinc/98/83/16/340988316.db2.gz GMLATGAQSVWKLM-ZDUSSCGKSA-N 1 2 310.401 4.131 20 0 DIADLO COCC[N@H+](Cc1ncc(C(C)C)s1)[C@H](C)c1ccccc1 ZINC000542464443 341008186 /nfs/dbraw/zinc/00/81/86/341008186.db2.gz IKMIYEZXPMEEEN-OAHLLOKOSA-N 1 2 318.486 4.476 20 0 DIADLO COCC[N@@H+](Cc1ncc(C(C)C)s1)[C@H](C)c1ccccc1 ZINC000542464443 341008187 /nfs/dbraw/zinc/00/81/87/341008187.db2.gz IKMIYEZXPMEEEN-OAHLLOKOSA-N 1 2 318.486 4.476 20 0 DIADLO CCc1cnc(C[N@@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)s1 ZINC000542464749 341008329 /nfs/dbraw/zinc/00/83/29/341008329.db2.gz HTGXALUCKFVKLW-GUYCJALGSA-N 1 2 318.511 4.384 20 0 DIADLO CCc1cnc(C[N@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)s1 ZINC000542464749 341008330 /nfs/dbraw/zinc/00/83/30/341008330.db2.gz HTGXALUCKFVKLW-GUYCJALGSA-N 1 2 318.511 4.384 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](c2ccc(F)cc2)c2cnccn2)c(C)c1 ZINC000542479838 341009283 /nfs/dbraw/zinc/00/92/83/341009283.db2.gz XAYGTZDDNVCEFJ-FQEVSTJZSA-N 1 2 321.399 4.112 20 0 DIADLO CC(C)c1cnc(N[C@H](c2[nH+]ccn2C)c2ccccc2)s1 ZINC000542520355 341011985 /nfs/dbraw/zinc/01/19/85/341011985.db2.gz DHTSISULYPAGIV-HNNXBMFYSA-N 1 2 312.442 4.202 20 0 DIADLO Cc1cc(N2CCC3(CCOCC3)[C@@H]2C)c2cccc(F)c2[nH+]1 ZINC000542520752 341012001 /nfs/dbraw/zinc/01/20/01/341012001.db2.gz IMRYYNLFWOZVDX-AWEZNQCLSA-N 1 2 314.404 4.078 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2oc3ccc(OC)cc3c2C)o1 ZINC000542582537 341014594 /nfs/dbraw/zinc/01/45/94/341014594.db2.gz IYPIOPGEQDZILZ-LBPRGKRZSA-N 1 2 314.385 4.151 20 0 DIADLO CCc1ccc(-c2noc([C@@H](C)[NH2+]Cc3cccc(C)c3)n2)cc1 ZINC000542623865 341015141 /nfs/dbraw/zinc/01/51/41/341015141.db2.gz XRPLYYUYJKTZGP-OAHLLOKOSA-N 1 2 321.424 4.458 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)C(=O)[C@H](C)CCC(C)(C)C)c1C ZINC000542624610 341015296 /nfs/dbraw/zinc/01/52/96/341015296.db2.gz QBTQALUCRPBWRA-CYBMUJFWSA-N 1 2 320.477 4.128 20 0 DIADLO c1ccc2sc(C[N@@H+]3CCO[C@@H](C4CCCCC4)C3)nc2c1 ZINC000542651052 341015692 /nfs/dbraw/zinc/01/56/92/341015692.db2.gz YAHPVWVURJUKTB-MRXNPFEDSA-N 1 2 316.470 4.077 20 0 DIADLO c1ccc2sc(C[N@H+]3CCO[C@@H](C4CCCCC4)C3)nc2c1 ZINC000542651052 341015693 /nfs/dbraw/zinc/01/56/93/341015693.db2.gz YAHPVWVURJUKTB-MRXNPFEDSA-N 1 2 316.470 4.077 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2ccccc2Cl)o1)c1ccon1 ZINC000542709966 341018637 /nfs/dbraw/zinc/01/86/37/341018637.db2.gz NQGFFNMINJFVOL-NSHDSACASA-N 1 2 302.761 4.439 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1cnc(C(C)C)s1 ZINC000130431265 341021586 /nfs/dbraw/zinc/02/15/86/341021586.db2.gz VSUJSEHTEBBUFD-UHFFFAOYSA-N 1 2 304.459 4.297 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1cnc(C(C)C)s1 ZINC000130431265 341021587 /nfs/dbraw/zinc/02/15/87/341021587.db2.gz VSUJSEHTEBBUFD-UHFFFAOYSA-N 1 2 304.459 4.297 20 0 DIADLO CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]Cc1nnc(C)s1 ZINC000542810998 341021594 /nfs/dbraw/zinc/02/15/94/341021594.db2.gz JTKZSMRMZJEPNQ-LLVKDONJSA-N 1 2 315.442 4.314 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2nnsc2Cl)C(C)C)cc1 ZINC000071122844 341022811 /nfs/dbraw/zinc/02/28/11/341022811.db2.gz QNBCEXMAMRMEDU-AWEZNQCLSA-N 1 2 309.866 4.241 20 0 DIADLO CC(C)(C)c1nc(CNc2c[nH+]c3c(c2)CCCC3)cs1 ZINC000542924018 341026487 /nfs/dbraw/zinc/02/64/87/341026487.db2.gz FQTYXSVHDUWAGP-UHFFFAOYSA-N 1 2 301.459 4.327 20 0 DIADLO c1csc([C@@H]2CCC[N@H+]2Cc2nc(C3CCCC3)no2)c1 ZINC000130549491 341027745 /nfs/dbraw/zinc/02/77/45/341027745.db2.gz FPNYUOJHPNWSBZ-ZDUSSCGKSA-N 1 2 303.431 4.126 20 0 DIADLO c1csc([C@@H]2CCC[N@@H+]2Cc2nc(C3CCCC3)no2)c1 ZINC000130549491 341027746 /nfs/dbraw/zinc/02/77/46/341027746.db2.gz FPNYUOJHPNWSBZ-ZDUSSCGKSA-N 1 2 303.431 4.126 20 0 DIADLO COc1ccc(CSCc2cn3c(cccc3C)[nH+]2)cc1F ZINC000543017508 341028454 /nfs/dbraw/zinc/02/84/54/341028454.db2.gz JKOMTIZUNBMCPE-UHFFFAOYSA-N 1 2 316.401 4.224 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@@H+]2Cc3ccccc3[C@H]2C)c(F)c1 ZINC000543063034 341030181 /nfs/dbraw/zinc/03/01/81/341030181.db2.gz WTCSLLFXKIINES-KGLIPLIRSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@H+]2Cc3ccccc3[C@H]2C)c(F)c1 ZINC000543063034 341030182 /nfs/dbraw/zinc/03/01/82/341030182.db2.gz WTCSLLFXKIINES-KGLIPLIRSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1cccc(C[NH2+][C@H](c2cccnc2)c2ccc(F)c(C)c2)n1 ZINC000543408326 341042649 /nfs/dbraw/zinc/04/26/49/341042649.db2.gz FXDGZHLVKCSIPU-FQEVSTJZSA-N 1 2 321.399 4.112 20 0 DIADLO CCc1cnc(C[N@@H+]2[C@@H](C)Cc3cc(OC)ccc3[C@@H]2C)s1 ZINC000543415002 341043165 /nfs/dbraw/zinc/04/31/65/341043165.db2.gz VLMZBUTXPKFBGA-STQMWFEESA-N 1 2 316.470 4.222 20 0 DIADLO CCc1cnc(C[N@H+]2[C@@H](C)Cc3cc(OC)ccc3[C@@H]2C)s1 ZINC000543415002 341043166 /nfs/dbraw/zinc/04/31/66/341043166.db2.gz VLMZBUTXPKFBGA-STQMWFEESA-N 1 2 316.470 4.222 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@H](C)[C@H]2CCCO2)c1 ZINC000543426602 341043960 /nfs/dbraw/zinc/04/39/60/341043960.db2.gz WJADRIIBMPRKJW-CRAIPNDOSA-N 1 2 313.445 4.330 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+]Cc2ccccc2OC(C)C)o1 ZINC000543487304 341047141 /nfs/dbraw/zinc/04/71/41/341047141.db2.gz KAACLCRQWDCMKC-QGZVFWFLSA-N 1 2 317.429 4.107 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](C)c2cnn(C(C)C)c2)cs1 ZINC000543505935 341047960 /nfs/dbraw/zinc/04/79/60/341047960.db2.gz VOLCNINBPNINOP-CYBMUJFWSA-N 1 2 306.479 4.114 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](C)c2cnn(C(C)C)c2)cs1 ZINC000543505936 341048014 /nfs/dbraw/zinc/04/80/14/341048014.db2.gz VOLCNINBPNINOP-ZDUSSCGKSA-N 1 2 306.479 4.114 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2sc3ccccc3c2Cl)o1 ZINC000543543072 341048787 /nfs/dbraw/zinc/04/87/87/341048787.db2.gz DLPVBCZQJMKMRW-QMMMGPOBSA-N 1 2 307.806 4.097 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2nc(C3CCCC3)no2)cc1 ZINC000130844240 341048863 /nfs/dbraw/zinc/04/88/63/341048863.db2.gz PNOGRISYWYQUGT-MRXNPFEDSA-N 1 2 315.392 4.203 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2nc(C3CCCC3)no2)cc1 ZINC000130844240 341048864 /nfs/dbraw/zinc/04/88/64/341048864.db2.gz PNOGRISYWYQUGT-MRXNPFEDSA-N 1 2 315.392 4.203 20 0 DIADLO CC[C@@H]([NH2+][C@H](c1ccccc1)c1ccc(F)cc1)c1ccn(C)n1 ZINC000543603344 341050698 /nfs/dbraw/zinc/05/06/98/341050698.db2.gz VZDUJTUNSQUMTM-UYAOXDASSA-N 1 2 323.415 4.390 20 0 DIADLO CC[N@H+](CC(F)F)C[C@H](C)c1cccc(Br)c1 ZINC000543620325 341051304 /nfs/dbraw/zinc/05/13/04/341051304.db2.gz GEMOTMYBTVLBEQ-JTQLQIEISA-N 1 2 306.194 4.140 20 0 DIADLO CC[N@@H+](CC(F)F)C[C@H](C)c1cccc(Br)c1 ZINC000543620325 341051305 /nfs/dbraw/zinc/05/13/05/341051305.db2.gz GEMOTMYBTVLBEQ-JTQLQIEISA-N 1 2 306.194 4.140 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCOC[C@H]2c2ccccc2)c(F)c1 ZINC000543631350 341052336 /nfs/dbraw/zinc/05/23/36/341052336.db2.gz KAYRZSIWJFRYQT-QTWIXLPOSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCOC[C@H]2c2ccccc2)c(F)c1 ZINC000543631350 341052337 /nfs/dbraw/zinc/05/23/37/341052337.db2.gz KAYRZSIWJFRYQT-QTWIXLPOSA-N 1 2 315.363 4.052 20 0 DIADLO Cc1ncccc1C[N@@H+](C)[C@H](C)c1ccccc1Br ZINC000131019881 341056476 /nfs/dbraw/zinc/05/64/76/341056476.db2.gz XJFUUABIULVLPC-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ncccc1C[N@H+](C)[C@H](C)c1ccccc1Br ZINC000131019881 341056477 /nfs/dbraw/zinc/05/64/77/341056477.db2.gz XJFUUABIULVLPC-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(F)cc2F)o1 ZINC000131069125 341057771 /nfs/dbraw/zinc/05/77/71/341057771.db2.gz SGOKYAMNCLQLPK-MRXNPFEDSA-N 1 2 307.340 4.041 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccc(F)cc2F)o1 ZINC000131069125 341057772 /nfs/dbraw/zinc/05/77/72/341057772.db2.gz SGOKYAMNCLQLPK-MRXNPFEDSA-N 1 2 307.340 4.041 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1C[N@@H+]([C@H]2C=CCCC2)CCO1 ZINC000543806884 341059815 /nfs/dbraw/zinc/05/98/15/341059815.db2.gz DSFSWEBXDGIFHE-XJKSGUPXSA-N 1 2 311.347 4.187 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1C[N@H+]([C@H]2C=CCCC2)CCO1 ZINC000543806884 341059816 /nfs/dbraw/zinc/05/98/16/341059816.db2.gz DSFSWEBXDGIFHE-XJKSGUPXSA-N 1 2 311.347 4.187 20 0 DIADLO Clc1ccccc1[C@H]1C[N@H+](CCCc2ccsc2)CCO1 ZINC000543957937 341064172 /nfs/dbraw/zinc/06/41/72/341064172.db2.gz NQKJVFYGIFGIQK-QGZVFWFLSA-N 1 2 321.873 4.408 20 0 DIADLO Clc1ccccc1[C@H]1C[N@@H+](CCCc2ccsc2)CCO1 ZINC000543957937 341064173 /nfs/dbraw/zinc/06/41/73/341064173.db2.gz NQKJVFYGIFGIQK-QGZVFWFLSA-N 1 2 321.873 4.408 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(C)c(C)c3Cl)ccc2[nH+]1 ZINC000544003948 341065850 /nfs/dbraw/zinc/06/58/50/341065850.db2.gz KVXWMEVQOMAOHC-UHFFFAOYSA-N 1 2 313.788 4.165 20 0 DIADLO COc1cccc([C@H]2C[C@@H](C)CN2c2cc(C)[nH+]c(C3CC3)n2)c1 ZINC000544068918 341069024 /nfs/dbraw/zinc/06/90/24/341069024.db2.gz FTQCKBPNRGWCRS-FZKQIMNGSA-N 1 2 323.440 4.259 20 0 DIADLO Cc1ccc(Cc2noc(-c3cc(C)c(C)cc3Cl)n2)c[nH+]1 ZINC000544164645 341072464 /nfs/dbraw/zinc/07/24/64/341072464.db2.gz KAHDRPXKBOCMOO-UHFFFAOYSA-N 1 2 313.788 4.301 20 0 DIADLO Cc1ccc(Cc2noc(-c3cccc4ccccc43)n2)c[nH+]1 ZINC000544177951 341073036 /nfs/dbraw/zinc/07/30/36/341073036.db2.gz ZGAQAQDFCWRYSX-UHFFFAOYSA-N 1 2 301.349 4.184 20 0 DIADLO COc1ccc2c(c1)CCC[N@@H+](Cc1ncc(C(C)C)s1)C2 ZINC000544351765 341077603 /nfs/dbraw/zinc/07/76/03/341077603.db2.gz XWDOMPUCLYDASP-UHFFFAOYSA-N 1 2 316.470 4.224 20 0 DIADLO COc1ccc2c(c1)CCC[N@H+](Cc1ncc(C(C)C)s1)C2 ZINC000544351765 341077604 /nfs/dbraw/zinc/07/76/04/341077604.db2.gz XWDOMPUCLYDASP-UHFFFAOYSA-N 1 2 316.470 4.224 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@H](CC(C)C)c2cccs2)n1 ZINC000544449536 341082538 /nfs/dbraw/zinc/08/25/38/341082538.db2.gz PFEKANZLHYFYIU-CYBMUJFWSA-N 1 2 307.463 4.207 20 0 DIADLO C[C@H](CCC(C)(C)C)C(=O)NCc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000544540590 341085223 /nfs/dbraw/zinc/08/52/23/341085223.db2.gz LNVVJMCFQKEVMC-CQSZACIVSA-N 1 2 313.445 4.155 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccon2)cc1OC ZINC000544605959 341088325 /nfs/dbraw/zinc/08/83/25/341088325.db2.gz WCEIANFVTYTAQV-KBPBESRZSA-N 1 2 318.417 4.274 20 0 DIADLO Cc1c([C@H](C)[NH2+][C@@H](C)c2ccon2)cnn1-c1cc(C)ccc1C ZINC000544605017 341088358 /nfs/dbraw/zinc/08/83/58/341088358.db2.gz QGNVLGMECRVKJV-GJZGRUSLSA-N 1 2 324.428 4.197 20 0 DIADLO Cc1c([C@H](C)[NH2+][C@H](C)c2ccon2)cnn1-c1cc(C)ccc1C ZINC000544605019 341088361 /nfs/dbraw/zinc/08/83/61/341088361.db2.gz QGNVLGMECRVKJV-LSDHHAIUSA-N 1 2 324.428 4.197 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1Cl)c1ccon1 ZINC000544615680 341089220 /nfs/dbraw/zinc/08/92/20/341089220.db2.gz VDKJFPIDOJCRKX-MRVPVSSYSA-N 1 2 304.699 4.198 20 0 DIADLO CCc1ccsc1-c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000544796198 341094052 /nfs/dbraw/zinc/09/40/52/341094052.db2.gz SUFPQIPEJHLVFW-UHFFFAOYSA-N 1 2 322.393 4.213 20 0 DIADLO Cc1ccc([C@@H](c2noc(Cc3ccc[nH+]c3C)n2)C(C)C)cc1 ZINC000564281404 341094862 /nfs/dbraw/zinc/09/48/62/341094862.db2.gz FOFLYBLZTUAPPE-IBGZPJMESA-N 1 2 321.424 4.460 20 0 DIADLO Cc1cc(OCc2noc(C(C)(C)C)n2)c2cccc(C)c2[nH+]1 ZINC000544845139 341096084 /nfs/dbraw/zinc/09/60/84/341096084.db2.gz TVZPMCAKVKMEFY-UHFFFAOYSA-N 1 2 311.385 4.111 20 0 DIADLO Cc1cc(F)cc(-c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)c1 ZINC000545049852 341106089 /nfs/dbraw/zinc/10/60/89/341106089.db2.gz JYKWPXDPIHWVAD-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(Cl)c(F)c1 ZINC000131659892 341106960 /nfs/dbraw/zinc/10/69/60/341106960.db2.gz HBFZBFKZQSUHAN-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO C[C@H](c1nc(-c2ccccc2)no1)[N@H+](C)Cc1ccccc1F ZINC000072863592 341109446 /nfs/dbraw/zinc/10/94/46/341109446.db2.gz DONVYASKQBTJBA-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1nc(-c2ccccc2)no1)[N@@H+](C)Cc1ccccc1F ZINC000072863592 341109447 /nfs/dbraw/zinc/10/94/47/341109447.db2.gz DONVYASKQBTJBA-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1cnc(C(C)C)s1)c1ccco1 ZINC000131880065 341113100 /nfs/dbraw/zinc/11/31/00/341113100.db2.gz CNIMJIVHSWJXKH-HNNXBMFYSA-N 1 2 322.474 4.363 20 0 DIADLO CC(C)c1ccccc1NC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000073120383 341113318 /nfs/dbraw/zinc/11/33/18/341113318.db2.gz QQAFRZOWWIXKQF-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)c1cccc(Cl)c1 ZINC000132093435 341116181 /nfs/dbraw/zinc/11/61/81/341116181.db2.gz XCQWMPPURWMFTM-UHFFFAOYSA-N 1 2 304.777 4.165 20 0 DIADLO C[N@H+](Cc1nccn1C(F)F)[C@H]1CCc2c1cccc2Cl ZINC000132091057 341116256 /nfs/dbraw/zinc/11/62/56/341116256.db2.gz SGYNEQBWOBYDKM-ZDUSSCGKSA-N 1 2 311.763 4.051 20 0 DIADLO C[N@@H+](Cc1nccn1C(F)F)[C@H]1CCc2c1cccc2Cl ZINC000132091057 341116257 /nfs/dbraw/zinc/11/62/57/341116257.db2.gz SGYNEQBWOBYDKM-ZDUSSCGKSA-N 1 2 311.763 4.051 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1nc(C(C)(C)C)no1 ZINC000073637234 341119408 /nfs/dbraw/zinc/11/94/08/341119408.db2.gz VURMNGQJILHWKL-UWVGGRQHSA-N 1 2 309.360 4.057 20 0 DIADLO CCc1ccc(C[N@@H+]2CCSC[C@H]2c2nccs2)s1 ZINC000545322330 341121305 /nfs/dbraw/zinc/12/13/05/341121305.db2.gz LNLQOQHDCCCJCJ-ZDUSSCGKSA-N 1 2 310.513 4.057 20 0 DIADLO CCc1ccc(C[N@H+]2CCSC[C@H]2c2nccs2)s1 ZINC000545322330 341121306 /nfs/dbraw/zinc/12/13/06/341121306.db2.gz LNLQOQHDCCCJCJ-ZDUSSCGKSA-N 1 2 310.513 4.057 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1)c1nc(C(C)(C)C)no1 ZINC000073984230 341124589 /nfs/dbraw/zinc/12/45/89/341124589.db2.gz FCECOALHUYTJJD-GHMZBOCLSA-N 1 2 307.825 4.432 20 0 DIADLO Cc1cccc(C)c1[C@@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000545517549 341128003 /nfs/dbraw/zinc/12/80/03/341128003.db2.gz UTBIWWGNMAXXSV-ZIAGYGMSSA-N 1 2 301.434 4.396 20 0 DIADLO C[C@H](Cc1nc(Cc2cn3ccccc3[nH+]2)no1)C1CCCCC1 ZINC000545603061 341132645 /nfs/dbraw/zinc/13/26/45/341132645.db2.gz MOMHFABSXITYCI-CQSZACIVSA-N 1 2 324.428 4.067 20 0 DIADLO CC[C@H](Cc1ccccc1)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000545632591 341133956 /nfs/dbraw/zinc/13/39/56/341133956.db2.gz QPYFANPPHHUXRY-QGZVFWFLSA-N 1 2 307.397 4.100 20 0 DIADLO Cc1ccc(Cc2noc(C[C@@H]3CCCc4ccccc43)n2)c[nH+]1 ZINC000545632240 341134023 /nfs/dbraw/zinc/13/40/23/341134023.db2.gz MMNMPDGRJBWTEY-KRWDZBQOSA-N 1 2 319.408 4.026 20 0 DIADLO Cc1ccc(Cc2noc(-c3ccc(C)c(C)c3Cl)n2)c[nH+]1 ZINC000545634412 341134092 /nfs/dbraw/zinc/13/40/92/341134092.db2.gz ASVDSVWJDMVGNY-UHFFFAOYSA-N 1 2 313.788 4.301 20 0 DIADLO Cc1ccc(-c2noc(/C=C/C(C)(C)C)n2)c(N2CCCC2)[nH+]1 ZINC000545665663 341135422 /nfs/dbraw/zinc/13/54/22/341135422.db2.gz PYZCEWQBMLPCBB-MDZDMXLPSA-N 1 2 312.417 4.100 20 0 DIADLO Cc1ccc(-c2noc(/C=C\C(C)(C)C)n2)c(N2CCCC2)[nH+]1 ZINC000545665656 341135520 /nfs/dbraw/zinc/13/55/20/341135520.db2.gz PYZCEWQBMLPCBB-KTKRTIGZSA-N 1 2 312.417 4.100 20 0 DIADLO CC(C)[N@H+](Cc1nnc(-c2ccccc2)s1)Cc1ccccn1 ZINC000545918666 341146095 /nfs/dbraw/zinc/14/60/95/341146095.db2.gz RNGAMZJDQIWSSB-UHFFFAOYSA-N 1 2 324.453 4.011 20 0 DIADLO CC(C)[N@@H+](Cc1nnc(-c2ccccc2)s1)Cc1ccccn1 ZINC000545918666 341146096 /nfs/dbraw/zinc/14/60/96/341146096.db2.gz RNGAMZJDQIWSSB-UHFFFAOYSA-N 1 2 324.453 4.011 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3cccc4ccsc43)ccc2n1C ZINC000545931067 341146971 /nfs/dbraw/zinc/14/69/71/341146971.db2.gz IVTWZZYYRKDYNG-UHFFFAOYSA-N 1 2 321.405 4.349 20 0 DIADLO Cc1[nH]c2ccc(COc3ccc(F)c4c3C(=O)C[C@@H]4C)cc2[nH+]1 ZINC000545935509 341147139 /nfs/dbraw/zinc/14/71/39/341147139.db2.gz WXVPFRVABZWRRS-JTQLQIEISA-N 1 2 324.355 4.279 20 0 DIADLO Cc1[nH]c2cc(COc3ccc(F)c4c3C(=O)C[C@@H]4C)ccc2[nH+]1 ZINC000545935509 341147140 /nfs/dbraw/zinc/14/71/40/341147140.db2.gz WXVPFRVABZWRRS-JTQLQIEISA-N 1 2 324.355 4.279 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)c(C)[nH+]1 ZINC000132901279 341149008 /nfs/dbraw/zinc/14/90/08/341149008.db2.gz VSWBKIIUZPROAA-UKRRQHHQSA-N 1 2 316.351 4.027 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCC[N@@H+]2Cc2ccno2)c1 ZINC000545974587 341149217 /nfs/dbraw/zinc/14/92/17/341149217.db2.gz KOCUCDIDBHOAMH-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCC[N@H+]2Cc2ccno2)c1 ZINC000545974587 341149218 /nfs/dbraw/zinc/14/92/18/341149218.db2.gz KOCUCDIDBHOAMH-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO Clc1cnc(C[NH2+]Cc2c(Cl)cccc2Cl)s1 ZINC000546022577 341151751 /nfs/dbraw/zinc/15/17/51/341151751.db2.gz WFVMLPQSRGHBSH-UHFFFAOYSA-N 1 2 307.633 4.393 20 0 DIADLO Cc1cccc(C)c1[C@H](C)[NH2+]Cc1noc(-c2ccccc2)n1 ZINC000546224553 341157623 /nfs/dbraw/zinc/15/76/23/341157623.db2.gz BYHTVWGBIDSHBQ-HNNXBMFYSA-N 1 2 307.397 4.204 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2nc(C3CCCC3)no2)c1 ZINC000133219883 341164363 /nfs/dbraw/zinc/16/43/63/341164363.db2.gz HDKQTTDPIFHNQF-INIZCTEOSA-N 1 2 315.392 4.203 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2nc(C3CCCC3)no2)c1 ZINC000133219883 341164364 /nfs/dbraw/zinc/16/43/64/341164364.db2.gz HDKQTTDPIFHNQF-INIZCTEOSA-N 1 2 315.392 4.203 20 0 DIADLO Cc1ccc(-c2noc(/C=C3/CC[C@H](C)C3)n2)c(N2CCCC2)[nH+]1 ZINC000546368182 341165285 /nfs/dbraw/zinc/16/52/85/341165285.db2.gz PGTDJCJWWIAQMY-FRRXJZEGSA-N 1 2 324.428 4.244 20 0 DIADLO C[C@H]1CCCC[C@H]1c1noc(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC000546396895 341166539 /nfs/dbraw/zinc/16/65/39/341166539.db2.gz ITLPTLVZTKZJBG-WMLDXEAASA-N 1 2 322.412 4.275 20 0 DIADLO Cc1ccc(F)cc1-c1noc(-c2cccc(-n3cc[nH+]c3)c2)n1 ZINC000546410407 341167164 /nfs/dbraw/zinc/16/71/64/341167164.db2.gz BJAMZRUWEAMFOQ-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CSc1c(F)cc(NCCCc2c[nH+]ccc2C)cc1F ZINC000564303594 341171365 /nfs/dbraw/zinc/17/13/65/341171365.db2.gz FVWBRDQUZAMKRS-UHFFFAOYSA-N 1 2 308.397 4.435 20 0 DIADLO FC(F)c1ccc(COc2ccccc2-n2cc[nH+]c2)cc1 ZINC000546597190 341173998 /nfs/dbraw/zinc/17/39/98/341173998.db2.gz HWOKKRXNTXIQSL-UHFFFAOYSA-N 1 2 300.308 4.389 20 0 DIADLO CC[N@H+](Cc1nc(C2CCCC2)no1)[C@@H](C)c1ccc(F)cc1 ZINC000133508535 341176931 /nfs/dbraw/zinc/17/69/31/341176931.db2.gz KZLZUPPUEVYOSK-ZDUSSCGKSA-N 1 2 317.408 4.449 20 0 DIADLO CC[N@@H+](Cc1nc(C2CCCC2)no1)[C@@H](C)c1ccc(F)cc1 ZINC000133508535 341176932 /nfs/dbraw/zinc/17/69/32/341176932.db2.gz KZLZUPPUEVYOSK-ZDUSSCGKSA-N 1 2 317.408 4.449 20 0 DIADLO CCn1nc(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)c2ccccc21 ZINC000546728426 341180692 /nfs/dbraw/zinc/18/06/92/341180692.db2.gz WYMQWEZHQMKODS-BBRMVZONSA-N 1 2 309.413 4.062 20 0 DIADLO Cc1nc(C[N@H+]2C[C@@H](c3cc(C)ccc3C)OC[C@H]2C)cs1 ZINC000075837277 341185373 /nfs/dbraw/zinc/18/53/73/341185373.db2.gz WKKUIMUPCWSJTF-KDOFPFPSSA-N 1 2 316.470 4.030 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@@H](c3cc(C)ccc3C)OC[C@H]2C)cs1 ZINC000075837277 341185374 /nfs/dbraw/zinc/18/53/74/341185374.db2.gz WKKUIMUPCWSJTF-KDOFPFPSSA-N 1 2 316.470 4.030 20 0 DIADLO CCc1ccccc1-c1noc(-c2cccc(-n3cc[nH+]c3)c2)n1 ZINC000547023837 341192267 /nfs/dbraw/zinc/19/22/67/341192267.db2.gz HVTBEXVYODQSFP-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO Cc1c2cccc(C)c2oc1-c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000547052202 341193770 /nfs/dbraw/zinc/19/37/70/341193770.db2.gz CBRNFWBBJWXMQJ-UHFFFAOYSA-N 1 2 319.364 4.394 20 0 DIADLO Cc1cccn2cc(Cc3noc([C@@H]4CC45CCCCC5)n3)[nH+]c12 ZINC000547090661 341195536 /nfs/dbraw/zinc/19/55/36/341195536.db2.gz ZRGUACACABAXCT-HNNXBMFYSA-N 1 2 322.412 4.054 20 0 DIADLO c1cc(Oc2cc[nH+]cc2)cc(-c2nc(CCC3CC3)no2)c1 ZINC000547237914 341202497 /nfs/dbraw/zinc/20/24/97/341202497.db2.gz PDGVSRUWYYIPFF-UHFFFAOYSA-N 1 2 307.353 4.267 20 0 DIADLO COCC[C@@H](C)Nc1ccc(-c2cn3cccc(C)c3[nH+]2)cc1 ZINC000547367628 341209295 /nfs/dbraw/zinc/20/92/95/341209295.db2.gz IDVKTOQJQBPHBU-OAHLLOKOSA-N 1 2 309.413 4.147 20 0 DIADLO CC(C)COC[C@@H]([NH2+]Cc1cnc(C2CC2)s1)c1ccco1 ZINC000134264175 341211433 /nfs/dbraw/zinc/21/14/33/341211433.db2.gz JTSRSMDQVBMIKQ-OAHLLOKOSA-N 1 2 320.458 4.117 20 0 DIADLO Cc1nc(C[NH+]2CCC(Oc3ccc(C)c(C)c3)CC2)cs1 ZINC000076720366 341212830 /nfs/dbraw/zinc/21/28/30/341212830.db2.gz QAUNAJJXIGUZOT-UHFFFAOYSA-N 1 2 316.470 4.112 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+][C@H](C)c1nc2c(s1)CCC2 ZINC000134829634 341224809 /nfs/dbraw/zinc/22/48/09/341224809.db2.gz LOMHGAJTONWBKE-SNVBAGLBSA-N 1 2 322.861 4.145 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+][C@@H](C)c1nc2c(s1)CCC2 ZINC000134912098 341226705 /nfs/dbraw/zinc/22/67/05/341226705.db2.gz MYSBMOSQELPXSI-JTQLQIEISA-N 1 2 322.861 4.145 20 0 DIADLO Fc1cc(F)c(NCc2cn3cc(Cl)ccc3[nH+]2)c(F)c1 ZINC000135051209 341229867 /nfs/dbraw/zinc/22/98/67/341229867.db2.gz DARYLNZAQWDZJJ-UHFFFAOYSA-N 1 2 311.694 4.017 20 0 DIADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1csc(Cc2ccc(Cl)cc2)n1 ZINC000547769070 341231455 /nfs/dbraw/zinc/23/14/55/341231455.db2.gz LHJVENNQZYEXFA-VXGBXAGGSA-N 1 2 306.862 4.370 20 0 DIADLO Cc1cccc(C)c1NC(=O)/C=C/c1ccc(-n2cc[nH+]c2)cc1 ZINC000078326634 341240411 /nfs/dbraw/zinc/24/04/11/341240411.db2.gz PDXCXOVVELNIBX-DHZHZOJOSA-N 1 2 317.392 4.141 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000547972522 341241392 /nfs/dbraw/zinc/24/13/92/341241392.db2.gz KDYFSRMRUJXUKE-KZULUSFZSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000547972522 341241393 /nfs/dbraw/zinc/24/13/93/341241393.db2.gz KDYFSRMRUJXUKE-KZULUSFZSA-N 1 2 321.342 4.238 20 0 DIADLO Cc1ccc(OCc2nc(C[N@@H+]3[C@H](C)C[C@@H]3C)cs2)cc1 ZINC000548097791 341246955 /nfs/dbraw/zinc/24/69/55/341246955.db2.gz YQIUKRNSYHMWET-OKILXGFUSA-N 1 2 302.443 4.013 20 0 DIADLO Cc1ccc(OCc2nc(C[N@H+]3[C@H](C)C[C@@H]3C)cs2)cc1 ZINC000548097791 341246954 /nfs/dbraw/zinc/24/69/54/341246954.db2.gz YQIUKRNSYHMWET-OKILXGFUSA-N 1 2 302.443 4.013 20 0 DIADLO CC(C)(C)C1CCC([NH2+][C@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000548176136 341251725 /nfs/dbraw/zinc/25/17/25/341251725.db2.gz PRIQIQHOVFZPNN-JCYILVPMSA-N 1 2 312.461 4.089 20 0 DIADLO C[C@@H](Cc1ccsc1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000548317829 341255793 /nfs/dbraw/zinc/25/57/93/341255793.db2.gz ZHTOWYGBWAIHDX-YVEFUNNKSA-N 1 2 323.408 4.031 20 0 DIADLO C[C@@H](Cc1ccsc1)[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000548317829 341255794 /nfs/dbraw/zinc/25/57/94/341255794.db2.gz ZHTOWYGBWAIHDX-YVEFUNNKSA-N 1 2 323.408 4.031 20 0 DIADLO C[C@@H](Cc1ccsc1)[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000548317827 341255841 /nfs/dbraw/zinc/25/58/41/341255841.db2.gz ZHTOWYGBWAIHDX-SJCJKPOMSA-N 1 2 323.408 4.031 20 0 DIADLO C[C@@H](Cc1ccsc1)[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000548317827 341255842 /nfs/dbraw/zinc/25/58/42/341255842.db2.gz ZHTOWYGBWAIHDX-SJCJKPOMSA-N 1 2 323.408 4.031 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C3CC3)no2)cc1 ZINC000079304740 341256361 /nfs/dbraw/zinc/25/63/61/341256361.db2.gz XHEXETYJZUEVNA-OLZOCXBDSA-N 1 2 315.417 4.146 20 0 DIADLO CCc1cc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)oc1CC ZINC000136552125 341261794 /nfs/dbraw/zinc/26/17/94/341261794.db2.gz YEYGCSVQTIVERG-UHFFFAOYSA-N 1 2 309.369 4.047 20 0 DIADLO Cc1nc(C2CCCC2)sc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000080220807 341271097 /nfs/dbraw/zinc/27/10/97/341271097.db2.gz JICCQLRDNWGXGO-UHFFFAOYSA-N 1 2 301.415 4.065 20 0 DIADLO C[C@@H]1C[C@@H](C)[NH+]1CC(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000548752654 341272244 /nfs/dbraw/zinc/27/22/44/341272244.db2.gz QYLHGBLQKFIPTG-HTQZYQBOSA-N 1 2 321.635 4.068 20 0 DIADLO CCN(C(=O)c1cccc(Oc2cc[nH+]cc2)c1)[C@H](C)C(C)C ZINC000564360885 341282815 /nfs/dbraw/zinc/28/28/15/341282815.db2.gz XPBCLARYYQDRMO-OAHLLOKOSA-N 1 2 312.413 4.381 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000549180377 341288027 /nfs/dbraw/zinc/28/80/27/341288027.db2.gz LRMMPEBDASQSSF-GUYCJALGSA-N 1 2 304.796 4.367 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000549180377 341288028 /nfs/dbraw/zinc/28/80/28/341288028.db2.gz LRMMPEBDASQSSF-GUYCJALGSA-N 1 2 304.796 4.367 20 0 DIADLO COc1c(C)c[nH+]c(CSC[C@H](OC)c2ccccc2)c1C ZINC000549555684 341297676 /nfs/dbraw/zinc/29/76/76/341297676.db2.gz GMHKWXFXWMBRQC-KRWDZBQOSA-N 1 2 317.454 4.328 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1ccc(Cl)cc1F ZINC000549674911 341300259 /nfs/dbraw/zinc/30/02/59/341300259.db2.gz YLZYAVLPJCWGEV-INIZCTEOSA-N 1 2 321.827 4.423 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000245553994 341301590 /nfs/dbraw/zinc/30/15/90/341301590.db2.gz RYHPKCFDSCSEJT-YWZLYKJASA-N 1 2 322.408 4.136 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000245553994 341301591 /nfs/dbraw/zinc/30/15/91/341301591.db2.gz RYHPKCFDSCSEJT-YWZLYKJASA-N 1 2 322.408 4.136 20 0 DIADLO CC[C@H](C)Oc1cccc(NCc2cn3cc(C)ccc3[nH+]2)c1 ZINC000549842346 341304712 /nfs/dbraw/zinc/30/47/12/341304712.db2.gz RANADWIZPBHOGO-HNNXBMFYSA-N 1 2 309.413 4.432 20 0 DIADLO c1csc(C[N@@H+]2CCc3ccccc3[C@@H]2c2ccccc2)n1 ZINC000550347538 341315439 /nfs/dbraw/zinc/31/54/39/341315439.db2.gz WPFPMJFZOWKSNS-IBGZPJMESA-N 1 2 306.434 4.291 20 0 DIADLO c1csc(C[N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)n1 ZINC000550347538 341315440 /nfs/dbraw/zinc/31/54/40/341315440.db2.gz WPFPMJFZOWKSNS-IBGZPJMESA-N 1 2 306.434 4.291 20 0 DIADLO Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CC(C)(F)F ZINC000550882572 341325342 /nfs/dbraw/zinc/32/53/42/341325342.db2.gz NZHSNEYKLBAUKO-LLVKDONJSA-N 1 2 310.413 4.348 20 0 DIADLO Cc1cc(N2[C@H](C)C[C@H]3CCCC[C@H]32)nc(-c2ccncc2)[nH+]1 ZINC000246121083 341327869 /nfs/dbraw/zinc/32/78/69/341327869.db2.gz IZBXKTVXPZRFDN-DJIMGWMZSA-N 1 2 308.429 4.004 20 0 DIADLO C[C@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1Cc2cccnc2C1 ZINC000551045373 341330101 /nfs/dbraw/zinc/33/01/01/341330101.db2.gz NRLRJDBWAXTQKU-LLVKDONJSA-N 1 2 308.303 4.057 20 0 DIADLO C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1Cc2cccnc2C1 ZINC000551045373 341330102 /nfs/dbraw/zinc/33/01/02/341330102.db2.gz NRLRJDBWAXTQKU-LLVKDONJSA-N 1 2 308.303 4.057 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cccc(COC(C)C)c3)cn2c1 ZINC000551186990 341333532 /nfs/dbraw/zinc/33/35/32/341333532.db2.gz VABJDJADQGIFTD-UHFFFAOYSA-N 1 2 309.413 4.180 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cc(C)c(C)c4ncccc34)cn2c1 ZINC000551246359 341335464 /nfs/dbraw/zinc/33/54/64/341335464.db2.gz VGZJAIYNAIXYCL-UHFFFAOYSA-N 1 2 316.408 4.420 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1cn2ccccc2n1 ZINC000551272998 341336540 /nfs/dbraw/zinc/33/65/40/341336540.db2.gz ZHWOAYLFHDYZLA-FOIQADDNSA-N 1 2 317.392 4.368 20 0 DIADLO CC(C)(C)c1cnc(C[NH+]2CCC(CC(F)(F)F)CC2)o1 ZINC000551406700 341340711 /nfs/dbraw/zinc/34/07/11/341340711.db2.gz OSGXTUXMYMDHHR-UHFFFAOYSA-N 1 2 304.356 4.137 20 0 DIADLO Cc1ccccc1[C@@H](C)[N@@H+](Cc1noc(C2CC2)n1)CC(C)C ZINC000551422139 341341188 /nfs/dbraw/zinc/34/11/88/341341188.db2.gz XQQFEYWLXLAHDY-OAHLLOKOSA-N 1 2 313.445 4.475 20 0 DIADLO Cc1ccccc1[C@@H](C)[N@H+](Cc1noc(C2CC2)n1)CC(C)C ZINC000551422139 341341189 /nfs/dbraw/zinc/34/11/89/341341189.db2.gz XQQFEYWLXLAHDY-OAHLLOKOSA-N 1 2 313.445 4.475 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@@H]2c2ccc(C)c(C)c2)c(C)c[nH+]1 ZINC000551905270 341354562 /nfs/dbraw/zinc/35/45/62/341354562.db2.gz KJEFLEPOWBYRFV-LJQANCHMSA-N 1 2 323.440 4.106 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@H]2c2ccc(C)c(C)c2)c(C)c[nH+]1 ZINC000551905269 341354574 /nfs/dbraw/zinc/35/45/74/341354574.db2.gz KJEFLEPOWBYRFV-IBGZPJMESA-N 1 2 323.440 4.106 20 0 DIADLO C[C@H](CC(=O)Nc1ccc2oc3ccccc3c2c1)n1cc[nH+]c1 ZINC000551913050 341354769 /nfs/dbraw/zinc/35/47/69/341354769.db2.gz YJZLJCIHZFMEBN-CYBMUJFWSA-N 1 2 319.364 4.372 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)[C@H](C)c2ccccc2)cs1 ZINC000246691713 341355639 /nfs/dbraw/zinc/35/56/39/341355639.db2.gz FDWJDTACGHQPOC-KGLIPLIRSA-N 1 2 304.459 4.434 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)[C@H](C)c2ccccc2)cs1 ZINC000246691713 341355640 /nfs/dbraw/zinc/35/56/40/341355640.db2.gz FDWJDTACGHQPOC-KGLIPLIRSA-N 1 2 304.459 4.434 20 0 DIADLO Cc1ccc(C)c(Oc2ccc(C[NH2+][C@@H](C)c3ncc[nH]3)cn2)c1 ZINC000552033141 341363353 /nfs/dbraw/zinc/36/33/53/341363353.db2.gz OBPVLKIPMQNUCT-HNNXBMFYSA-N 1 2 322.412 4.065 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247465922 341365364 /nfs/dbraw/zinc/36/53/64/341365364.db2.gz PWBGWBVSJUYMRB-XHDPSFHLSA-N 1 2 309.381 4.161 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247465922 341365365 /nfs/dbraw/zinc/36/53/65/341365365.db2.gz PWBGWBVSJUYMRB-XHDPSFHLSA-N 1 2 309.381 4.161 20 0 DIADLO Cc1nc([C@H]([NH2+][C@@H]2CC[C@@H]2C(C)C)c2ccc(Cl)cc2)no1 ZINC000552070895 341367528 /nfs/dbraw/zinc/36/75/28/341367528.db2.gz IHKFZKHVEWWKIX-BZUAXINKSA-N 1 2 319.836 4.145 20 0 DIADLO CC(C)[C@@H]1C[N@H+](Cc2csc(Cl)c2Cl)CCCO1 ZINC000552159975 341374579 /nfs/dbraw/zinc/37/45/79/341374579.db2.gz RWZPKDWNMZGSCA-NSHDSACASA-N 1 2 308.274 4.302 20 0 DIADLO CC(C)[C@@H]1C[N@@H+](Cc2csc(Cl)c2Cl)CCCO1 ZINC000552159975 341374580 /nfs/dbraw/zinc/37/45/80/341374580.db2.gz RWZPKDWNMZGSCA-NSHDSACASA-N 1 2 308.274 4.302 20 0 DIADLO Cc1ccc(-c2noc(C[N@@H+]([C@H](C)c3ccco3)C3CC3)n2)cc1 ZINC000086233006 341379645 /nfs/dbraw/zinc/37/96/45/341379645.db2.gz IJEBKMVSLCHJDP-CQSZACIVSA-N 1 2 323.396 4.364 20 0 DIADLO Cc1ccc(-c2noc(C[N@H+]([C@H](C)c3ccco3)C3CC3)n2)cc1 ZINC000086233006 341379646 /nfs/dbraw/zinc/37/96/46/341379646.db2.gz IJEBKMVSLCHJDP-CQSZACIVSA-N 1 2 323.396 4.364 20 0 DIADLO COc1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)c(Cl)c1 ZINC000552278735 341383454 /nfs/dbraw/zinc/38/34/54/341383454.db2.gz KGIOJZWPJYTXLS-KRWDZBQOSA-N 1 2 316.832 4.327 20 0 DIADLO COc1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)c(Cl)c1 ZINC000552278735 341383455 /nfs/dbraw/zinc/38/34/55/341383455.db2.gz KGIOJZWPJYTXLS-KRWDZBQOSA-N 1 2 316.832 4.327 20 0 DIADLO Cn1c2ccccc2nc1C[N@@H+]1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000552316658 341386047 /nfs/dbraw/zinc/38/60/47/341386047.db2.gz ISCMSCPABRBACH-FQEVSTJZSA-N 1 2 317.436 4.301 20 0 DIADLO Cn1c2ccccc2nc1C[N@H+]1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000552316658 341386048 /nfs/dbraw/zinc/38/60/48/341386048.db2.gz ISCMSCPABRBACH-FQEVSTJZSA-N 1 2 317.436 4.301 20 0 DIADLO Cc1cncc([C@H](C)[NH2+]CC(F)(F)c2ccc(Cl)cc2)c1 ZINC000552337418 341387546 /nfs/dbraw/zinc/38/75/46/341387546.db2.gz TVIQLJVRUSMKOA-LBPRGKRZSA-N 1 2 310.775 4.486 20 0 DIADLO COC[C@@H]([NH2+]Cc1csc(-c2ccccc2)n1)c1ccccc1 ZINC000552433342 341393492 /nfs/dbraw/zinc/39/34/92/341393492.db2.gz YMQGGXGXAPZIHG-GOSISDBHSA-N 1 2 324.449 4.287 20 0 DIADLO c1cn(CCSCCCOc2cccc3ccccc32)c[nH+]1 ZINC000090200633 341414125 /nfs/dbraw/zinc/41/41/25/341414125.db2.gz GTZIFSLOKLHHRC-UHFFFAOYSA-N 1 2 312.438 4.239 20 0 DIADLO CCc1cc(OCC(=O)Nc2ccccc2C)c2ccccc2[nH+]1 ZINC000090368519 341414763 /nfs/dbraw/zinc/41/47/63/341414763.db2.gz MPWXLHJHPDRHDH-UHFFFAOYSA-N 1 2 320.392 4.123 20 0 DIADLO COCC1(C)CCN(c2cc[nH+]c3c(Cl)cccc23)CC1 ZINC000553183428 341419167 /nfs/dbraw/zinc/41/91/67/341419167.db2.gz OIYIGJMYIWJXOU-UHFFFAOYSA-N 1 2 304.821 4.141 20 0 DIADLO CC(C)OC1CCN(c2cc[nH+]c3c(Cl)cccc23)CC1 ZINC000553409143 341428248 /nfs/dbraw/zinc/42/82/48/341428248.db2.gz LKDMUCSLYMDPHD-UHFFFAOYSA-N 1 2 304.821 4.282 20 0 DIADLO c1[nH+]c(-c2ccc(N[C@H]3CC[C@@H]3C3CC3)cc2)n2c1CCCC2 ZINC000554372540 341451849 /nfs/dbraw/zinc/45/18/49/341451849.db2.gz NQORHOCNAMGUPK-MOPGFXCFSA-N 1 2 307.441 4.487 20 0 DIADLO COCc1cc(N2C[C@H]3CCCC[C@@H]3C2)c2cc(F)ccc2[nH+]1 ZINC000564567342 341504106 /nfs/dbraw/zinc/50/41/06/341504106.db2.gz JKXJTEIYFKVYFJ-ZIAGYGMSSA-N 1 2 314.404 4.147 20 0 DIADLO Cc1c2cccc(Cl)c2sc1CN1CCn2c[nH+]cc2C1 ZINC000564647292 341506056 /nfs/dbraw/zinc/50/60/56/341506056.db2.gz YFIMLWRNNJSLEB-UHFFFAOYSA-N 1 2 317.845 4.075 20 0 DIADLO C[C@@H]([NH2+]Cc1noc(C2CC2)n1)c1ccc(F)c2ccccc21 ZINC000564682422 341506740 /nfs/dbraw/zinc/50/67/40/341506740.db2.gz GFGPBZTVDAGINM-LLVKDONJSA-N 1 2 311.360 4.090 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[NH+]1CC(C(F)(F)F)C1 ZINC000565977157 341544314 /nfs/dbraw/zinc/54/43/14/341544314.db2.gz WWGFUIHKCJZWEX-QMMMGPOBSA-N 1 2 308.141 4.004 20 0 DIADLO CCSc1cccc(C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)c1 ZINC000163164779 341544594 /nfs/dbraw/zinc/54/45/94/341544594.db2.gz BULZWUIDZIKDCQ-UHFFFAOYSA-N 1 2 323.421 4.441 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N3C[C@@H](C(C)C)c4ccccc43)ccn12 ZINC000566453824 341558637 /nfs/dbraw/zinc/55/86/37/341558637.db2.gz XBZITYJQIBRMPM-KRWDZBQOSA-N 1 2 319.408 4.043 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCc2sc(Cl)cc21 ZINC000567652275 341624492 /nfs/dbraw/zinc/62/44/92/341624492.db2.gz ZYOLDONNDKEOPS-LLVKDONJSA-N 1 2 321.833 4.222 20 0 DIADLO CCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2nnc(C)s2)cc1 ZINC000274230091 341641853 /nfs/dbraw/zinc/64/18/53/341641853.db2.gz PKSJBSRSNYZHDV-VXGBXAGGSA-N 1 2 305.447 4.047 20 0 DIADLO COc1cc[nH+]cc1CSCc1ccccc1OC(C)C ZINC000568135767 341653386 /nfs/dbraw/zinc/65/33/86/341653386.db2.gz NUIGCZBMDBFEMM-UHFFFAOYSA-N 1 2 303.427 4.311 20 0 DIADLO Clc1ccc(C2([NH2+]Cc3nnc(C4CC4)o3)CC2)cc1Cl ZINC000568350356 341667202 /nfs/dbraw/zinc/66/72/02/341667202.db2.gz FZYUBZGBIMFKFW-UHFFFAOYSA-N 1 2 324.211 4.033 20 0 DIADLO CCC(=O)Nc1ccc(C)c(NCCCc2c[nH+]ccc2C)c1 ZINC000568496203 341673060 /nfs/dbraw/zinc/67/30/60/341673060.db2.gz PFXZNWXGJKDKLJ-UHFFFAOYSA-N 1 2 311.429 4.092 20 0 DIADLO Cc1ccc(NC(=O)N[C@H]2C[C@H](c3ccccc3C)C2)c(C)[nH+]1 ZINC000569091772 341690411 /nfs/dbraw/zinc/69/04/11/341690411.db2.gz XXCNRSKRLQDTQK-WKILWMFISA-N 1 2 309.413 4.075 20 0 DIADLO C[NH+](C)[C@H](c1nc([C@H]2CCCC(C)(C)C2)no1)c1ccccc1 ZINC000569272880 341696370 /nfs/dbraw/zinc/69/63/70/341696370.db2.gz ILQLGVKMKAONRP-HOTGVXAUSA-N 1 2 313.445 4.404 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2c(F)cccc2F)o1 ZINC000165280884 341710683 /nfs/dbraw/zinc/71/06/83/341710683.db2.gz JLWYBLSSJUKIKU-ABAIWWIYSA-N 1 2 309.356 4.159 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+][C@H](COC)c1ccc(CC)o1 ZINC000165302455 341710990 /nfs/dbraw/zinc/71/09/90/341710990.db2.gz LNGSSVWQGSZZDT-WMLDXEAASA-N 1 2 317.429 4.279 20 0 DIADLO CC(F)(F)C[NH2+]Cc1c(OC(F)F)ccc2ccccc21 ZINC000573109868 341717307 /nfs/dbraw/zinc/71/73/07/341717307.db2.gz JTEVVAQRZVYSTC-UHFFFAOYSA-N 1 2 301.283 4.186 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2sccc2Br)s1 ZINC000168354410 341739033 /nfs/dbraw/zinc/73/90/33/341739033.db2.gz RAIQEBZUMVKBGK-MRVPVSSYSA-N 1 2 317.277 4.126 20 0 DIADLO C[C@@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CC(C(F)(F)F)C1 ZINC000573960702 341744317 /nfs/dbraw/zinc/74/43/17/341744317.db2.gz DVAJMHLRYZOSEJ-QMMMGPOBSA-N 1 2 313.241 4.140 20 0 DIADLO C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CC(C(F)(F)F)C1 ZINC000573960699 341744355 /nfs/dbraw/zinc/74/43/55/341744355.db2.gz DVAJMHLRYZOSEJ-MRVPVSSYSA-N 1 2 313.241 4.140 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(OC(F)F)c(Cl)c1)c1cscn1 ZINC000576360228 341842434 /nfs/dbraw/zinc/84/24/34/341842434.db2.gz JYCCHHKUXAIZMV-QMMMGPOBSA-N 1 2 318.776 4.249 20 0 DIADLO CCC(CC)[C@@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)c1ccccc1 ZINC000576588624 341853873 /nfs/dbraw/zinc/85/38/73/341853873.db2.gz VIHJIRWARKDKCJ-DNVCBOLYSA-N 1 2 313.445 4.128 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)CN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000192654255 341882243 /nfs/dbraw/zinc/88/22/43/341882243.db2.gz MQCDQCDZDAFBHX-IUODEOHRSA-N 1 2 322.330 4.067 20 0 DIADLO CCO[C@@H](C)c1noc(C[NH2+][C@@H](CC(C)C)c2ccccc2)n1 ZINC000177381478 341919209 /nfs/dbraw/zinc/91/92/09/341919209.db2.gz NUGDHQPKAUPQGL-HOCLYGCPSA-N 1 2 317.433 4.044 20 0 DIADLO CCC[C@H]([NH2+][C@H](C)c1cc(C)n(C)n1)c1ccc(F)cc1F ZINC000281957375 517612155 /nfs/dbraw/zinc/61/21/55/517612155.db2.gz AVFDTDOUMKJQAI-WBMJQRKESA-N 1 2 307.388 4.199 20 0 DIADLO CCO[C@H]1C[C@H](Nc2[nH+]ccc3ccc(F)cc32)C12CCC2 ZINC000354329980 517718505 /nfs/dbraw/zinc/71/85/05/517718505.db2.gz VDYJFXJOLIHBGO-HOTGVXAUSA-N 1 2 300.377 4.134 20 0 DIADLO CC[C@@H](CC1CCCC1)C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000513458967 517764098 /nfs/dbraw/zinc/76/40/98/517764098.db2.gz WGGNFLWEIHDXJU-HOTGVXAUSA-N 1 2 303.450 4.070 20 0 DIADLO COc1c(Cl)cc(NCc2[nH+]ccn2C(C)C)cc1Cl ZINC000268197904 518126803 /nfs/dbraw/zinc/12/68/03/518126803.db2.gz YASNGJUNHOKFGR-UHFFFAOYSA-N 1 2 314.216 4.392 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1cnn(-c2ccccc2)c1 ZINC000338329338 518899468 /nfs/dbraw/zinc/89/94/68/518899468.db2.gz HRZLERROBSHCFV-UHFFFAOYSA-N 1 2 322.412 4.057 20 0 DIADLO CC(C)[C@@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1ccc(F)cc1 ZINC000337379399 519799622 /nfs/dbraw/zinc/79/96/22/519799622.db2.gz CKDBYPLFFACUGD-IAQYHMDHSA-N 1 2 303.381 4.134 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H]2CN(C)Cc3ccccc32)cs1 ZINC000364248002 519866296 /nfs/dbraw/zinc/86/62/96/519866296.db2.gz GVHNWPXKPYANHY-CZUORRHYSA-N 1 2 315.486 4.104 20 0 DIADLO CC(C)c1nc(N2CCC[C@@H](c3nc4ccccc4o3)C2)cc[nH+]1 ZINC000106464421 519877956 /nfs/dbraw/zinc/87/79/56/519877956.db2.gz YVXVJGMHDHDWOM-CQSZACIVSA-N 1 2 322.412 4.125 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2cc(Cl)ccc2Cl)s1 ZINC000338198404 519887314 /nfs/dbraw/zinc/88/73/14/519887314.db2.gz SEJWLWAJTUDBEP-UHFFFAOYSA-N 1 2 316.257 4.258 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)o1 ZINC000180017923 519888003 /nfs/dbraw/zinc/88/80/03/519888003.db2.gz DWTCTGBCWQADRY-DIOULYMOSA-N 1 2 319.836 4.333 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)n1 ZINC000182572700 519904962 /nfs/dbraw/zinc/90/49/62/519904962.db2.gz WKVSCWBAJHEIBQ-MRXNPFEDSA-N 1 2 319.836 4.477 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)cn1 ZINC000133584751 519976553 /nfs/dbraw/zinc/97/65/53/519976553.db2.gz XMXURGHXKAPKFS-GFCCVEGCSA-N 1 2 306.479 4.069 20 0 DIADLO CC(C)n1ccnc1C[N@H+](C)CCCOc1cccc(Cl)c1 ZINC000107299312 520023129 /nfs/dbraw/zinc/02/31/29/520023129.db2.gz MMOVAMSEDQJQGC-UHFFFAOYSA-N 1 2 321.852 4.018 20 0 DIADLO CC(C)n1ccnc1C[N@@H+](C)CCCOc1cccc(Cl)c1 ZINC000107299312 520023135 /nfs/dbraw/zinc/02/31/35/520023135.db2.gz MMOVAMSEDQJQGC-UHFFFAOYSA-N 1 2 321.852 4.018 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000337336145 520025699 /nfs/dbraw/zinc/02/56/99/520025699.db2.gz CWGMVQHWODJHGH-MRXNPFEDSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000337336145 520025708 /nfs/dbraw/zinc/02/57/08/520025708.db2.gz CWGMVQHWODJHGH-MRXNPFEDSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000337336144 520031908 /nfs/dbraw/zinc/03/19/08/520031908.db2.gz CWGMVQHWODJHGH-INIZCTEOSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000337336144 520031916 /nfs/dbraw/zinc/03/19/16/520031916.db2.gz CWGMVQHWODJHGH-INIZCTEOSA-N 1 2 303.837 4.455 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000368808899 520297102 /nfs/dbraw/zinc/29/71/02/520297102.db2.gz CWZXFWFGOWKMHG-GOSISDBHSA-N 1 2 305.466 4.112 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000368808899 520297110 /nfs/dbraw/zinc/29/71/10/520297110.db2.gz CWZXFWFGOWKMHG-GOSISDBHSA-N 1 2 305.466 4.112 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)[C@@H]2C[C@@H]2c2ccccc2)cs1 ZINC000336854168 520474782 /nfs/dbraw/zinc/47/47/82/520474782.db2.gz DFWPNCRVOOWQJV-KBRIMQKVSA-N 1 2 316.470 4.229 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)[C@@H]2C[C@@H]2c2ccccc2)cs1 ZINC000336854168 520474788 /nfs/dbraw/zinc/47/47/88/520474788.db2.gz DFWPNCRVOOWQJV-KBRIMQKVSA-N 1 2 316.470 4.229 20 0 DIADLO CCCC[C@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc(OC)cc1 ZINC000367743218 521241329 /nfs/dbraw/zinc/24/13/29/521241329.db2.gz ZBAUUWLMNCVTKL-ZWKOTPCHSA-N 1 2 313.445 4.317 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](C)c2cccc(OC(C)C)c2)n1 ZINC000179661956 521336827 /nfs/dbraw/zinc/33/68/27/521336827.db2.gz GHVQSQYKPAEFPC-CQSZACIVSA-N 1 2 317.433 4.050 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](C)c2ccc(OC(C)C)cc2)n1 ZINC000182623350 521337116 /nfs/dbraw/zinc/33/71/16/521337116.db2.gz QTROUYBQXAHVPZ-AWEZNQCLSA-N 1 2 317.433 4.050 20 0 DIADLO CC[N@H+](Cc1nccc(C)n1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000339589475 521460206 /nfs/dbraw/zinc/46/02/06/521460206.db2.gz HSGKLSJVNWCTGE-ZDUSSCGKSA-N 1 2 323.362 4.387 20 0 DIADLO CC[N@@H+](Cc1nccc(C)n1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000339589475 521460213 /nfs/dbraw/zinc/46/02/13/521460213.db2.gz HSGKLSJVNWCTGE-ZDUSSCGKSA-N 1 2 323.362 4.387 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2ccccc2F)C2CCCC2)n1 ZINC000181486538 521586694 /nfs/dbraw/zinc/58/66/94/521586694.db2.gz CXSVWPQSHISEBM-SFHVURJKSA-N 1 2 317.408 4.182 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)n1 ZINC000181613495 521587009 /nfs/dbraw/zinc/58/70/09/521587009.db2.gz DYYOKQIHZBSBNP-MRXNPFEDSA-N 1 2 323.387 4.177 20 0 DIADLO CCC[N@H+](Cc1nccn1C(C)C)[C@H](C)c1ccccc1OC ZINC000337347508 521695266 /nfs/dbraw/zinc/69/52/66/521695266.db2.gz NNCRJENZWKMWAY-MRXNPFEDSA-N 1 2 315.461 4.446 20 0 DIADLO CCC[N@@H+](Cc1nccn1C(C)C)[C@H](C)c1ccccc1OC ZINC000337347508 521695270 /nfs/dbraw/zinc/69/52/70/521695270.db2.gz NNCRJENZWKMWAY-MRXNPFEDSA-N 1 2 315.461 4.446 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@H](C)c2ccccc2C)n1 ZINC000181534665 521721718 /nfs/dbraw/zinc/72/17/18/521721718.db2.gz SQIAVKBVQWDPFQ-OLZOCXBDSA-N 1 2 305.447 4.043 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+]2CC=C(C(C)(C)C)CC2)n1 ZINC000336844777 521729101 /nfs/dbraw/zinc/72/91/01/521729101.db2.gz RWLXFICWUXZZQD-GFCCVEGCSA-N 1 2 309.479 4.062 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+]2CC=C(C(C)(C)C)CC2)n1 ZINC000336844777 521729102 /nfs/dbraw/zinc/72/91/02/521729102.db2.gz RWLXFICWUXZZQD-GFCCVEGCSA-N 1 2 309.479 4.062 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)c1cc(C2CC2)nc2ccccc21 ZINC000264998256 522083464 /nfs/dbraw/zinc/08/34/64/522083464.db2.gz DCVGIGAELZEQQX-UHFFFAOYSA-N 1 2 317.392 4.322 20 0 DIADLO CCc1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cs1 ZINC000338351269 522318766 /nfs/dbraw/zinc/31/87/66/522318766.db2.gz HXNCPRDWOIGCHL-GFCCVEGCSA-N 1 2 318.408 4.260 20 0 DIADLO CCc1nc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cs1 ZINC000338351269 522318769 /nfs/dbraw/zinc/31/87/69/522318769.db2.gz HXNCPRDWOIGCHL-GFCCVEGCSA-N 1 2 318.408 4.260 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CCCOc3ccc(Cl)cc32)cs1 ZINC000156404430 522353268 /nfs/dbraw/zinc/35/32/68/522353268.db2.gz MRKCWUDNGULCER-CQSZACIVSA-N 1 2 322.861 4.362 20 0 DIADLO COc1cc(C[N@H+](C)Cc2nc(C)sc2C)ccc1SC ZINC000336836753 522356963 /nfs/dbraw/zinc/35/69/63/522356963.db2.gz MGAUYKFTUTXKFL-UHFFFAOYSA-N 1 2 322.499 4.122 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2nc(C)sc2C)ccc1SC ZINC000336836753 522356982 /nfs/dbraw/zinc/35/69/82/522356982.db2.gz MGAUYKFTUTXKFL-UHFFFAOYSA-N 1 2 322.499 4.122 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2cccc(NC(C)=O)c2)cs1 ZINC000162267507 522454529 /nfs/dbraw/zinc/45/45/29/522454529.db2.gz MBYJDSVSYPTJEI-NEPJUHHUSA-N 1 2 317.458 4.076 20 0 DIADLO CN(CC1CCCC1)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000264897812 522646261 /nfs/dbraw/zinc/64/62/61/522646261.db2.gz IRCRZIFJNHCLGO-UHFFFAOYSA-N 1 2 310.397 4.136 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1ccccn1)c1nc(C(F)(F)F)cs1 ZINC000159275267 522742488 /nfs/dbraw/zinc/74/24/88/522742488.db2.gz CULJXNCLIPUWDR-ZJUUUORDSA-N 1 2 315.364 4.359 20 0 DIADLO CCc1nnc(C[NH2+][C@H](CC2CCCCC2)c2ccccc2)o1 ZINC000181824851 522746754 /nfs/dbraw/zinc/74/67/54/522746754.db2.gz WDCQGGGEYZJXBS-QGZVFWFLSA-N 1 2 313.445 4.433 20 0 DIADLO CC[C@H]([NH2+][C@H](COC)c1ccc(C)o1)c1cc(F)ccc1F ZINC000156412319 522747342 /nfs/dbraw/zinc/74/73/42/522747342.db2.gz JWHDZDRHBOAVRF-JKSUJKDBSA-N 1 2 309.356 4.295 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1cc(F)c(F)c(F)c1)c1ccc(C)o1 ZINC000156436659 522765742 /nfs/dbraw/zinc/76/57/42/522765742.db2.gz PWWCNXDYJPXVIQ-YGRLFVJLSA-N 1 2 313.319 4.044 20 0 DIADLO COC[C@H]([NH2+][C@H](CC(C)C)c1ccccn1)c1ccc(C)o1 ZINC000182229239 522766985 /nfs/dbraw/zinc/76/69/85/522766985.db2.gz TZOKPFJOVXVZHE-SJORKVTESA-N 1 2 302.418 4.048 20 0 DIADLO CC[C@H](Nc1ccc(OC(C)C)c(Cl)c1)c1[nH+]ccn1C ZINC000183092890 522768867 /nfs/dbraw/zinc/76/88/67/522768867.db2.gz VMGIHFNUWDFVSI-AWEZNQCLSA-N 1 2 307.825 4.424 20 0 DIADLO CC[C@H](Nc1cccc(N2CCC(C)CC2)c1)c1[nH+]ccn1C ZINC000179961235 522772782 /nfs/dbraw/zinc/77/27/82/522772782.db2.gz HTIRFRJZYHHYJA-SFHVURJKSA-N 1 2 312.461 4.220 20 0 DIADLO CC[C@@H](Nc1cc(F)c(OC(C)(C)C)c(F)c1)c1[nH+]ccn1C ZINC000180443132 522956209 /nfs/dbraw/zinc/95/62/09/522956209.db2.gz QUFQCXDHTMGADV-CQSZACIVSA-N 1 2 323.387 4.439 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155723858 522970296 /nfs/dbraw/zinc/97/02/96/522970296.db2.gz AIODGZJPNZXCHW-MRXNPFEDSA-N 1 2 324.453 4.183 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155723858 522970305 /nfs/dbraw/zinc/97/03/05/522970305.db2.gz AIODGZJPNZXCHW-MRXNPFEDSA-N 1 2 324.453 4.183 20 0 DIADLO COCCC[C@@H](C)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000182883840 523466095 /nfs/dbraw/zinc/46/60/95/523466095.db2.gz JQAGGTBCJPOLCY-OAHLLOKOSA-N 1 2 313.445 4.113 20 0 DIADLO CO[C@@H](C)c1noc(C[N@H+](C)[C@H](C)c2ccc(C(C)C)cc2)n1 ZINC000267037662 523481655 /nfs/dbraw/zinc/48/16/55/523481655.db2.gz OBAJQKICKXSVKW-KGLIPLIRSA-N 1 2 317.433 4.093 20 0 DIADLO CO[C@@H](C)c1noc(C[N@@H+](C)[C@H](C)c2ccc(C(C)C)cc2)n1 ZINC000267037662 523481666 /nfs/dbraw/zinc/48/16/66/523481666.db2.gz OBAJQKICKXSVKW-KGLIPLIRSA-N 1 2 317.433 4.093 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1 ZINC000339152363 523554599 /nfs/dbraw/zinc/55/45/99/523554599.db2.gz LHPYCJIBJMSKTJ-INIZCTEOSA-N 1 2 303.837 4.284 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1cccc(Cl)c1 ZINC000339152363 523554603 /nfs/dbraw/zinc/55/46/03/523554603.db2.gz LHPYCJIBJMSKTJ-INIZCTEOSA-N 1 2 303.837 4.284 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1ccc(Cl)cc1 ZINC000339154178 523560181 /nfs/dbraw/zinc/56/01/81/523560181.db2.gz WWPOAXGMRGAXDA-MRXNPFEDSA-N 1 2 303.837 4.284 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1ccc(Cl)cc1 ZINC000339154178 523560188 /nfs/dbraw/zinc/56/01/88/523560188.db2.gz WWPOAXGMRGAXDA-MRXNPFEDSA-N 1 2 303.837 4.284 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1ccc(SC)cc1 ZINC000339153234 523560401 /nfs/dbraw/zinc/56/04/01/523560401.db2.gz PCINAWMHLMIOPL-QGZVFWFLSA-N 1 2 315.486 4.352 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1ccc(SC)cc1 ZINC000339153234 523560411 /nfs/dbraw/zinc/56/04/11/523560411.db2.gz PCINAWMHLMIOPL-QGZVFWFLSA-N 1 2 315.486 4.352 20 0 DIADLO CCc1ccc(C2=CC[N@@H+]([C@@H](C)c3nnc(C)s3)CC2)cc1 ZINC000338278845 523902915 /nfs/dbraw/zinc/90/29/15/523902915.db2.gz HVQFYEYIFGBTHB-ZDUSSCGKSA-N 1 2 313.470 4.259 20 0 DIADLO CCc1ccc(C2=CC[N@H+]([C@@H](C)c3nnc(C)s3)CC2)cc1 ZINC000338278845 523902922 /nfs/dbraw/zinc/90/29/22/523902922.db2.gz HVQFYEYIFGBTHB-ZDUSSCGKSA-N 1 2 313.470 4.259 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](Cc2cccc(F)c2)C(C)C)cs1 ZINC000267003324 523912066 /nfs/dbraw/zinc/91/20/66/523912066.db2.gz DWSOHJZXZKWKBF-CYBMUJFWSA-N 1 2 322.449 4.400 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](Cc2cccc(F)c2)C(C)C)cs1 ZINC000267003324 523912071 /nfs/dbraw/zinc/91/20/71/523912071.db2.gz DWSOHJZXZKWKBF-CYBMUJFWSA-N 1 2 322.449 4.400 20 0 DIADLO CN(C(=O)c1cccc(Oc2cc[nH+]cc2)c1)C1CCCCC1 ZINC000264902376 523946093 /nfs/dbraw/zinc/94/60/93/523946093.db2.gz KNELVBSYHSNTEK-UHFFFAOYSA-N 1 2 310.397 4.279 20 0 DIADLO COc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)c(Cl)c1 ZINC000338146462 524098390 /nfs/dbraw/zinc/09/83/90/524098390.db2.gz NXFXDCFBSBDCKR-UHFFFAOYSA-N 1 2 313.788 4.146 20 0 DIADLO C[C@H]1CN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C(C)(C)C1 ZINC000266880161 524540648 /nfs/dbraw/zinc/54/06/48/524540648.db2.gz ADLZMHUYXMCWOR-CQSZACIVSA-N 1 2 310.397 4.135 20 0 DIADLO C[C@@H]1CC[C@@H](N(C)C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000338204078 524599436 /nfs/dbraw/zinc/59/94/36/524599436.db2.gz HMMOGYXOKCNJCF-HUUCEWRRSA-N 1 2 310.397 4.135 20 0 DIADLO Cc1ccc(F)cc1C[NH2+][C@@H](C)c1nc(C2CCCCC2)no1 ZINC000180269312 524852349 /nfs/dbraw/zinc/85/23/49/524852349.db2.gz QQFYRMSWSYGYQD-ZDUSSCGKSA-N 1 2 317.408 4.416 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2coc(-c3ccccc3)n2)o1 ZINC000237575763 524861764 /nfs/dbraw/zinc/86/17/64/524861764.db2.gz WINAHJBSNKUYLY-GUYCJALGSA-N 1 2 308.381 4.348 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2nnc(C(C)C)o2)C(C)(C)C)c1 ZINC000180792192 524882779 /nfs/dbraw/zinc/88/27/79/524882779.db2.gz VOPQIPOITOFMFP-INIZCTEOSA-N 1 2 301.434 4.378 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2nc(C(C)C)no2)C(C)(C)C)c1 ZINC000180791114 524884246 /nfs/dbraw/zinc/88/42/46/524884246.db2.gz BUYQRRLILBQZOS-INIZCTEOSA-N 1 2 301.434 4.378 20 0 DIADLO Cc1ccccc1-c1noc([C@H](C)[N@H+](C)Cc2cccs2)n1 ZINC000266737805 525022249 /nfs/dbraw/zinc/02/22/49/525022249.db2.gz PJOYGCMGCQJSCI-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccccc1-c1noc([C@H](C)[N@@H+](C)Cc2cccs2)n1 ZINC000266737805 525022258 /nfs/dbraw/zinc/02/22/58/525022258.db2.gz PJOYGCMGCQJSCI-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1cc(N(C)[C@H](C)c2cccs2)nc(-c2ccncc2)[nH+]1 ZINC000112964811 525031748 /nfs/dbraw/zinc/03/17/48/525031748.db2.gz LBVGWXYMPUENCR-CYBMUJFWSA-N 1 2 310.426 4.106 20 0 DIADLO Cc1ccc(NC(=O)N2CCC(C)=C(c3ccco3)C2)c(C)[nH+]1 ZINC000338396331 525119291 /nfs/dbraw/zinc/11/92/91/525119291.db2.gz MOZWKDJKLOTSPU-UHFFFAOYSA-N 1 2 311.385 4.003 20 0 DIADLO Cc1ccc(NC(=O)c2cccc(-n3cc[nH+]c3)c2)c(Cl)c1 ZINC000117563376 525242533 /nfs/dbraw/zinc/24/25/33/525242533.db2.gz GAXBJHJZDRJDQS-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1ccc(NCc2c(F)ccc(Br)c2F)c[nH+]1 ZINC000337287237 525281816 /nfs/dbraw/zinc/28/18/16/525281816.db2.gz KZIWRSGTADTPNW-UHFFFAOYSA-N 1 2 313.145 4.043 20 0 DIADLO C[C@H]([NH2+]C1(c2ccccc2F)CC1)c1nc2ccccc2n1C ZINC000182234002 525285332 /nfs/dbraw/zinc/28/53/32/525285332.db2.gz BBQPBNHURFEMHN-ZDUSSCGKSA-N 1 2 309.388 4.052 20 0 DIADLO CSCCCCC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000152073307 525409880 /nfs/dbraw/zinc/40/98/80/525409880.db2.gz WKTJIZHIETZFDU-UHFFFAOYSA-N 1 2 316.426 4.346 20 0 DIADLO C[C@H]([NH2+]Cc1csc(CCc2ccccc2)n1)c1ccco1 ZINC000269028838 525483041 /nfs/dbraw/zinc/48/30/41/525483041.db2.gz DGVGDEDNSSZMSG-AWEZNQCLSA-N 1 2 312.438 4.372 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nc(-c3cccs3)no2)c(C)s1 ZINC000182981427 525523070 /nfs/dbraw/zinc/52/30/70/525523070.db2.gz UBZCOMPZCPCUPY-JTQLQIEISA-N 1 2 319.455 4.327 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1cccc(F)c1F ZINC000181959800 525544184 /nfs/dbraw/zinc/54/41/84/525544184.db2.gz ZLPWXZBZBJCDJC-GFCCVEGCSA-N 1 2 305.372 4.127 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(C2CC2)n1C1CC1)c1cc2ccccc2o1 ZINC000182634291 525567103 /nfs/dbraw/zinc/56/71/03/525567103.db2.gz KWIZWSWVVAJHTN-GFCCVEGCSA-N 1 2 322.412 4.087 20 0 DIADLO C[C@@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1ccccc1Cl ZINC000267289539 525625838 /nfs/dbraw/zinc/62/58/38/525625838.db2.gz XICBRPOXVBRESM-BMIGLBTASA-N 1 2 311.759 4.002 20 0 DIADLO Cc1ccnc(C[N@@H+](Cc2cccc(C(F)(F)F)c2)C(C)C)n1 ZINC000339586615 525642492 /nfs/dbraw/zinc/64/24/92/525642492.db2.gz JVEMTSUSACKHED-UHFFFAOYSA-N 1 2 323.362 4.214 20 0 DIADLO Cc1ccnc(C[N@H+](Cc2cccc(C(F)(F)F)c2)C(C)C)n1 ZINC000339586615 525642504 /nfs/dbraw/zinc/64/25/04/525642504.db2.gz JVEMTSUSACKHED-UHFFFAOYSA-N 1 2 323.362 4.214 20 0 DIADLO C[C@@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1ccccc1Cl ZINC000267289541 525668239 /nfs/dbraw/zinc/66/82/39/525668239.db2.gz XICBRPOXVBRESM-MEBBXXQBSA-N 1 2 311.759 4.002 20 0 DIADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1ncc(-c2ccccc2)o1 ZINC000131659658 525671716 /nfs/dbraw/zinc/67/17/16/525671716.db2.gz GHCUISOSARZHNW-LBPRGKRZSA-N 1 2 306.369 4.182 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)c1 ZINC000368609225 525709822 /nfs/dbraw/zinc/70/98/22/525709822.db2.gz WSEYAKLEIVBKAO-RHSMWYFYSA-N 1 2 309.438 4.287 20 0 DIADLO Cc1ccc(-c2nc(CC(=O)Nc3cc[nH+]cc3C)cs2)cc1 ZINC000107292025 525807824 /nfs/dbraw/zinc/80/78/24/525807824.db2.gz CELCWTJNAVUTDG-UHFFFAOYSA-N 1 2 323.421 4.003 20 0 DIADLO Cc1cn2cc(NC(=O)C3(c4ccccc4C)CCC3)ccc2[nH+]1 ZINC000336947352 525948035 /nfs/dbraw/zinc/94/80/35/525948035.db2.gz PEGQYJJFRXSPLG-UHFFFAOYSA-N 1 2 319.408 4.012 20 0 DIADLO CSc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C3CC3)no2)cc1 ZINC000337232925 526076497 /nfs/dbraw/zinc/07/64/97/526076497.db2.gz YLLGYJUWPZIKSS-WDEREUQCSA-N 1 2 303.431 4.081 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1cccnc1Cl ZINC000188461323 526104860 /nfs/dbraw/zinc/10/48/60/526104860.db2.gz KYAIKLMFZDESIK-JTQLQIEISA-N 1 2 311.212 4.248 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cn(-c3ccccc3)nc2C(C)C)o1 ZINC000337211725 526127709 /nfs/dbraw/zinc/12/77/09/526127709.db2.gz AQOKESIUHAPFRY-OAHLLOKOSA-N 1 2 324.428 4.143 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000127610256 526161483 /nfs/dbraw/zinc/16/14/83/526161483.db2.gz IKTQTEAKEPCHKG-GFCCVEGCSA-N 1 2 316.355 4.019 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000127610256 526161489 /nfs/dbraw/zinc/16/14/89/526161489.db2.gz IKTQTEAKEPCHKG-GFCCVEGCSA-N 1 2 316.355 4.019 20 0 DIADLO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1noc(-c3ccccc3)n1)CC2 ZINC000124428447 526212499 /nfs/dbraw/zinc/21/24/99/526212499.db2.gz MCZZVMXQNXYSDQ-KBXCAEBGSA-N 1 2 319.408 4.383 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000107290720 526240319 /nfs/dbraw/zinc/24/03/19/526240319.db2.gz VLACHBBZZNIWBN-UONOGXRCSA-N 1 2 320.314 4.151 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1cccc(OCc2cccs2)c1 ZINC000107294044 526242091 /nfs/dbraw/zinc/24/20/91/526242091.db2.gz FUVISMMESQVMOA-UHFFFAOYSA-N 1 2 324.405 4.283 20 0 DIADLO Fc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC000339512134 526341262 /nfs/dbraw/zinc/34/12/62/526341262.db2.gz XVBCOLJWHPRCJR-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO Cc1nnc(C[NH2+][C@H](c2cccc(Cl)c2)C2CCCCC2)o1 ZINC000181030529 526344790 /nfs/dbraw/zinc/34/47/90/526344790.db2.gz GEMLFTSFOKTBCQ-KRWDZBQOSA-N 1 2 319.836 4.443 20 0 DIADLO Fc1ccc2oc(C[NH2+]Cc3c(F)cc(F)cc3F)cc2c1 ZINC000339524330 526378908 /nfs/dbraw/zinc/37/89/08/526378908.db2.gz QPXDELQOFDEIKO-UHFFFAOYSA-N 1 2 309.262 4.279 20 0 DIADLO c1c[nH]c([C@@H]([NH2+][C@H]2CCCc3sccc32)c2ccccc2)n1 ZINC000129723338 526406476 /nfs/dbraw/zinc/40/64/76/526406476.db2.gz LHRHBTRMLUWZDT-RDJZCZTQSA-N 1 2 309.438 4.228 20 0 DIADLO c1ccc2cc(C[N@@H+](Cc3nc(C4CC4)no3)C3CC3)ccc2c1 ZINC000339421188 526516875 /nfs/dbraw/zinc/51/68/75/526516875.db2.gz KGSBMQGGQPULJA-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO c1ccc2cc(C[N@H+](Cc3nc(C4CC4)no3)C3CC3)ccc2c1 ZINC000339421188 526516880 /nfs/dbraw/zinc/51/68/80/526516880.db2.gz KGSBMQGGQPULJA-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO Cc1nc(C(C)C)ccc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000339596274 526667879 /nfs/dbraw/zinc/66/78/79/526667879.db2.gz ZCPNBYLZGRWITM-UHFFFAOYSA-N 1 2 320.396 4.156 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+][C@@H](C)c1ccncc1F ZINC000338365808 526748372 /nfs/dbraw/zinc/74/83/72/526748372.db2.gz GURPOVJEUWZGQP-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO Cc1nc(C[NH2+][C@@H](CC(F)(F)F)c2ccc(F)cc2)oc1C ZINC000180574201 526891282 /nfs/dbraw/zinc/89/12/82/526891282.db2.gz KRBDXESYIJRFPM-ZDUSSCGKSA-N 1 2 316.298 4.214 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(-c3cccnc3)cc2)oc1C ZINC000181314811 526891756 /nfs/dbraw/zinc/89/17/56/526891756.db2.gz OXAJUDIVBIFLDW-AWEZNQCLSA-N 1 2 307.397 4.204 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CCC=C(c3ccccc3)C2)cs1 ZINC000284688372 536504781 /nfs/dbraw/zinc/50/47/81/536504781.db2.gz HJTYMRVFPZCJFQ-CQSZACIVSA-N 1 2 314.454 4.140 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CCC=C(c3ccccc3)C2)cs1 ZINC000284688372 536504787 /nfs/dbraw/zinc/50/47/87/536504787.db2.gz HJTYMRVFPZCJFQ-CQSZACIVSA-N 1 2 314.454 4.140 20 0 DIADLO Cn1cc([C@H]([NH2+]Cc2sccc2Cl)c2ccccc2)cn1 ZINC000365953298 527313864 /nfs/dbraw/zinc/31/38/64/527313864.db2.gz DYJILODOGCQFCB-MRXNPFEDSA-N 1 2 317.845 4.014 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000266922371 527409033 /nfs/dbraw/zinc/40/90/33/527409033.db2.gz IXIPMLDEOCVMHJ-OAHLLOKOSA-N 1 2 301.434 4.038 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000266922371 527409036 /nfs/dbraw/zinc/40/90/36/527409036.db2.gz IXIPMLDEOCVMHJ-OAHLLOKOSA-N 1 2 301.434 4.038 20 0 DIADLO Cc1nccnc1[C@H](C)[NH2+][C@H](C)c1nc(-c2ccccc2)cs1 ZINC000188185790 527458046 /nfs/dbraw/zinc/45/80/46/527458046.db2.gz PSRBQPQCRLOTLY-UONOGXRCSA-N 1 2 324.453 4.320 20 0 DIADLO Cn1c[nH+]cc1CNc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000124259397 527510449 /nfs/dbraw/zinc/51/04/49/527510449.db2.gz QAKXJCCCJPBQLV-UHFFFAOYSA-N 1 2 323.240 4.070 20 0 DIADLO CC(C)(C)c1noc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)n1 ZINC000299088734 534937907 /nfs/dbraw/zinc/93/79/07/534937907.db2.gz VAPAMOSQDNAPSY-HNNXBMFYSA-N 1 2 319.424 4.383 20 0 DIADLO CCCC(=O)Nc1cccc(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)c1C ZINC000297126746 535352677 /nfs/dbraw/zinc/35/26/77/535352677.db2.gz YSFIAPXXTJEMET-MLGOLLRUSA-N 1 2 312.417 4.048 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(F)cnc1Cl)c1cc(F)ccc1F ZINC000297309465 535805602 /nfs/dbraw/zinc/80/56/02/535805602.db2.gz MUIIJKKQIANTNE-CQSZACIVSA-N 1 2 314.738 4.393 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(CC(C)C)no1)c1ccc(Cl)s1 ZINC000273221917 535806301 /nfs/dbraw/zinc/80/63/01/535806301.db2.gz AZJUTWSJHZCNOX-SNVBAGLBSA-N 1 2 313.854 4.224 20 0 DIADLO CC[C@@H]([NH2+]Cc1csc([C@@H](C)OC)n1)c1ccccc1F ZINC000272353611 535806435 /nfs/dbraw/zinc/80/64/35/535806435.db2.gz DMMYKLHRBKBNDX-IAQYHMDHSA-N 1 2 308.422 4.231 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)c1scnc1C1CCCC1 ZINC000273590013 536090799 /nfs/dbraw/zinc/09/07/99/536090799.db2.gz IQDIAIMVTMGUQM-UHFFFAOYSA-N 1 2 301.415 4.010 20 0 DIADLO C[C@@H]1C[N@H+](CCCc2c(Cl)cccc2Cl)[C@H](C)CO1 ZINC001204429436 1035884990 /nfs/dbraw/zinc/88/49/90/1035884990.db2.gz DKRSPAWAHZEXDW-VXGBXAGGSA-N 1 2 302.245 4.035 20 0 DIADLO C[C@@H]1C[N@@H+](CCCc2c(Cl)cccc2Cl)[C@H](C)CO1 ZINC001204429436 1035885009 /nfs/dbraw/zinc/88/50/09/1035885009.db2.gz DKRSPAWAHZEXDW-VXGBXAGGSA-N 1 2 302.245 4.035 20 0 DIADLO CCC1(CC)C[N@H+](Cc2nc(Cl)ccc2Cl)CCS1 ZINC001617025228 1056762779 /nfs/dbraw/zinc/76/27/79/1056762779.db2.gz ZRFLWMLTOIQLBP-UHFFFAOYSA-N 1 2 319.301 4.496 20 0 DIADLO CCC1(CC)C[N@@H+](Cc2nc(Cl)ccc2Cl)CCS1 ZINC001617025228 1056762793 /nfs/dbraw/zinc/76/27/93/1056762793.db2.gz ZRFLWMLTOIQLBP-UHFFFAOYSA-N 1 2 319.301 4.496 20 0 DIADLO C[C@H]1CCN(C(=O)CCC2CCCCCC2)C[C@H]1n1cc[nH+]c1 ZINC000654893794 1035616236 /nfs/dbraw/zinc/61/62/36/1035616236.db2.gz UGDMQTKEXFETKS-FUHWJXTLSA-N 1 2 317.477 4.043 20 0 DIADLO Clc1ccc(C[N@H+](Cc2nc3c(o2)CCCC3)C2CC2)cc1 ZINC001167062521 1035681788 /nfs/dbraw/zinc/68/17/88/1035681788.db2.gz LOTBXMLDWTUDOI-UHFFFAOYSA-N 1 2 316.832 4.371 20 0 DIADLO Clc1ccc(C[N@@H+](Cc2nc3c(o2)CCCC3)C2CC2)cc1 ZINC001167062521 1035681796 /nfs/dbraw/zinc/68/17/96/1035681796.db2.gz LOTBXMLDWTUDOI-UHFFFAOYSA-N 1 2 316.832 4.371 20 0 DIADLO CCc1cccc(NC(=O)c2ccn3c(C)c[nH+]c3c2)c1CC ZINC000655026943 1035692717 /nfs/dbraw/zinc/69/27/17/1035692717.db2.gz HXTAXYIIUOBWBI-UHFFFAOYSA-N 1 2 307.397 4.020 20 0 DIADLO Cc1cc(C)c(Nc2cn3cc(C(F)(F)F)ccc3n2)c[nH+]1 ZINC001213510978 1035721480 /nfs/dbraw/zinc/72/14/80/1035721480.db2.gz PVYOLEHWRPCJIX-UHFFFAOYSA-N 1 2 306.291 4.109 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1cc2cccc(F)c2o1 ZINC000607797497 1035761953 /nfs/dbraw/zinc/76/19/53/1035761953.db2.gz ICRRZFOVTMCQLP-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO Cl/C=C(/Cl)C[N@@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000254955595 1035816391 /nfs/dbraw/zinc/81/63/91/1035816391.db2.gz MGSFHLGHFFOGKL-SERMCNLOSA-N 1 2 311.212 4.326 20 0 DIADLO Cl/C=C(/Cl)C[N@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000254955595 1035816412 /nfs/dbraw/zinc/81/64/12/1035816412.db2.gz MGSFHLGHFFOGKL-SERMCNLOSA-N 1 2 311.212 4.326 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2cccc(F)c2Cl)C2CC2)s1 ZINC000579857199 1035847689 /nfs/dbraw/zinc/84/76/89/1035847689.db2.gz NGTHOMUNCOLFSC-CQSZACIVSA-N 1 2 310.825 4.485 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc(F)c(F)c(F)c2)n1 ZINC000127009167 1035879746 /nfs/dbraw/zinc/87/97/46/1035879746.db2.gz XGRKUKIRSATNCN-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2cc(F)c(F)c(F)c2)n1 ZINC000127009167 1035879771 /nfs/dbraw/zinc/87/97/71/1035879771.db2.gz XGRKUKIRSATNCN-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)sn1 ZINC001167084705 1035894317 /nfs/dbraw/zinc/89/43/17/1035894317.db2.gz OBPQIADACHDVFD-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)sn1 ZINC001167084705 1035894338 /nfs/dbraw/zinc/89/43/38/1035894338.db2.gz OBPQIADACHDVFD-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO CCc1cccc(NC(=O)C[N@H+]([C@H](C)c2ccco2)C2CC2)c1 ZINC000440907081 1035951959 /nfs/dbraw/zinc/95/19/59/1035951959.db2.gz VRJWAUHVMAMPJF-CQSZACIVSA-N 1 2 312.413 4.006 20 0 DIADLO CCc1cccc(NC(=O)C[N@@H+]([C@H](C)c2ccco2)C2CC2)c1 ZINC000440907081 1035951976 /nfs/dbraw/zinc/95/19/76/1035951976.db2.gz VRJWAUHVMAMPJF-CQSZACIVSA-N 1 2 312.413 4.006 20 0 DIADLO O=C(c1ccccc1)C1CC[NH+](Cc2c(F)cccc2F)CC1 ZINC000179880288 1035982296 /nfs/dbraw/zinc/98/22/96/1035982296.db2.gz FHNUAIGSCGZAQZ-UHFFFAOYSA-N 1 2 315.363 4.060 20 0 DIADLO c1cc2cc(CNc3ccc(N4CCCCC4)[nH+]c3)ccc2cn1 ZINC000326933869 1035992603 /nfs/dbraw/zinc/99/26/03/1035992603.db2.gz YCWSCKOTLWTSLI-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C\c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000255031824 1036033468 /nfs/dbraw/zinc/03/34/68/1036033468.db2.gz DFMSHGLHVYNLKL-TWGQIWQCSA-N 1 2 300.789 4.312 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)cc1Cl)c1nc2ccccc2n1C ZINC000120225115 1036085158 /nfs/dbraw/zinc/08/51/58/1036085158.db2.gz RFCMHQXVDPEJLV-LLVKDONJSA-N 1 2 317.795 4.217 20 0 DIADLO CCc1nc(N2CCC[C@@H]2c2nc3ccccc3s2)cc(C)[nH+]1 ZINC000339969886 1036105685 /nfs/dbraw/zinc/10/56/85/1036105685.db2.gz VHWCACGXKQPHAD-CQSZACIVSA-N 1 2 324.453 4.299 20 0 DIADLO C[N@H+](CCC(=O)c1cccs1)Cc1ccc(F)cc1Cl ZINC001204438656 1036113537 /nfs/dbraw/zinc/11/35/37/1036113537.db2.gz IDLXKRAKDQQMBX-UHFFFAOYSA-N 1 2 311.809 4.245 20 0 DIADLO C[N@@H+](CCC(=O)c1cccs1)Cc1ccc(F)cc1Cl ZINC001204438656 1036113550 /nfs/dbraw/zinc/11/35/50/1036113550.db2.gz IDLXKRAKDQQMBX-UHFFFAOYSA-N 1 2 311.809 4.245 20 0 DIADLO Clc1cnc(NCCCCNc2cccc[nH+]2)c(Cl)c1 ZINC000340014918 1036116369 /nfs/dbraw/zinc/11/63/69/1036116369.db2.gz PUKQEBQIQCFJQC-UHFFFAOYSA-N 1 2 311.216 4.088 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1cc2c(s1)CCCC2 ZINC000047533753 1036126357 /nfs/dbraw/zinc/12/63/57/1036126357.db2.gz GNJSYGCGYLCKDK-UHFFFAOYSA-N 1 2 323.421 4.065 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155117808 1036132113 /nfs/dbraw/zinc/13/21/13/1036132113.db2.gz COPVPMIKSKZNFM-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155117808 1036132117 /nfs/dbraw/zinc/13/21/17/1036132117.db2.gz COPVPMIKSKZNFM-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC001167157376 1036223385 /nfs/dbraw/zinc/22/33/85/1036223385.db2.gz KHECUSRMKJZVNZ-MRXNPFEDSA-N 1 2 319.832 4.423 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC001167157376 1036223399 /nfs/dbraw/zinc/22/33/99/1036223399.db2.gz KHECUSRMKJZVNZ-MRXNPFEDSA-N 1 2 319.832 4.423 20 0 DIADLO Cc1csc(C[NH2+][C@@H](CC(F)(F)F)c2ccccc2)n1 ZINC000038091149 1036225816 /nfs/dbraw/zinc/22/58/16/1036225816.db2.gz NPIMXKAJHLQPHK-LBPRGKRZSA-N 1 2 300.349 4.235 20 0 DIADLO COc1c(Cl)cccc1C[N@H+](C)Cc1nc2ccccc2o1 ZINC001140061924 1036239095 /nfs/dbraw/zinc/23/90/95/1036239095.db2.gz BZHIKHUEJIEVEC-UHFFFAOYSA-N 1 2 316.788 4.122 20 0 DIADLO COc1c(Cl)cccc1C[N@@H+](C)Cc1nc2ccccc2o1 ZINC001140061924 1036239110 /nfs/dbraw/zinc/23/91/10/1036239110.db2.gz BZHIKHUEJIEVEC-UHFFFAOYSA-N 1 2 316.788 4.122 20 0 DIADLO COCC[N@H+](Cc1csc(C2CC2)n1)[C@@H](C)c1ccccc1 ZINC000340144272 1036240971 /nfs/dbraw/zinc/24/09/71/1036240971.db2.gz PWPPDVYBOQHEIE-AWEZNQCLSA-N 1 2 316.470 4.230 20 0 DIADLO COCC[N@@H+](Cc1csc(C2CC2)n1)[C@@H](C)c1ccccc1 ZINC000340144272 1036240985 /nfs/dbraw/zinc/24/09/85/1036240985.db2.gz PWPPDVYBOQHEIE-AWEZNQCLSA-N 1 2 316.470 4.230 20 0 DIADLO COc1cc2cc[nH+]c(N3CC4(C3)CCCCC4)c2cc1F ZINC001167183652 1036252502 /nfs/dbraw/zinc/25/25/02/1036252502.db2.gz JDYCKFIEUBZVBA-UHFFFAOYSA-N 1 2 300.377 4.153 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2C)n1 ZINC000932566044 1036284392 /nfs/dbraw/zinc/28/43/92/1036284392.db2.gz XPHLQYIPWABFCE-STQMWFEESA-N 1 2 305.397 4.272 20 0 DIADLO Cc1ccccc1C[N@H+](Cc1nccn1-c1ccccc1)C1CC1 ZINC001167227354 1036294743 /nfs/dbraw/zinc/29/47/43/1036294743.db2.gz MAKXCSWKFSQKOS-UHFFFAOYSA-N 1 2 317.436 4.345 20 0 DIADLO Cc1ccccc1C[N@@H+](Cc1nccn1-c1ccccc1)C1CC1 ZINC001167227354 1036294763 /nfs/dbraw/zinc/29/47/63/1036294763.db2.gz MAKXCSWKFSQKOS-UHFFFAOYSA-N 1 2 317.436 4.345 20 0 DIADLO Cc1cn(C)nc1C[N@@H+](C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC001167234339 1036300772 /nfs/dbraw/zinc/30/07/72/1036300772.db2.gz WQQCKJDFAIKACN-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO Cc1cn(C)nc1C[N@H+](C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC001167234339 1036300787 /nfs/dbraw/zinc/30/07/87/1036300787.db2.gz WQQCKJDFAIKACN-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1coc(-c2ccccc2F)n1 ZINC001167244662 1036314019 /nfs/dbraw/zinc/31/40/19/1036314019.db2.gz XQWLHMDZXSTDJF-LBPRGKRZSA-N 1 2 300.333 4.267 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1coc(-c2ccccc2F)n1 ZINC001167244662 1036314034 /nfs/dbraw/zinc/31/40/34/1036314034.db2.gz XQWLHMDZXSTDJF-LBPRGKRZSA-N 1 2 300.333 4.267 20 0 DIADLO c1cn(-c2ccccc2OCc2cc(-c3ccccc3)no2)c[nH+]1 ZINC000530717442 1036401776 /nfs/dbraw/zinc/40/17/76/1036401776.db2.gz SVWYAKMOEGEAIF-UHFFFAOYSA-N 1 2 317.348 4.106 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cc(O)ccc1Cl ZINC000625288787 1036456875 /nfs/dbraw/zinc/45/68/75/1036456875.db2.gz PZCGZWLJWSCGPJ-JTQLQIEISA-N 1 2 309.768 4.044 20 0 DIADLO COc1ccccc1/C(C)=C\C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000255083235 1036496718 /nfs/dbraw/zinc/49/67/18/1036496718.db2.gz SBVCHRVMUCVWGJ-QXMHVHEDSA-N 1 2 310.397 4.057 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCn2ccnc21)c1cccc(Cl)c1Cl ZINC000655726736 1036508630 /nfs/dbraw/zinc/50/86/30/1036508630.db2.gz PCUJDQXEUSTKDT-ZWNOBZJWSA-N 1 2 310.228 4.376 20 0 DIADLO Clc1sccc1CNc1ccc(N2CCCCC2)[nH+]c1 ZINC000312557239 1036573812 /nfs/dbraw/zinc/57/38/12/1036573812.db2.gz NBAFKWUWERMNTF-UHFFFAOYSA-N 1 2 307.850 4.399 20 0 DIADLO COc1cccc([C@@H](C)[NH2+][C@H](C)c2nnc(-c3ccccc3)o2)c1 ZINC000340431635 1036600859 /nfs/dbraw/zinc/60/08/59/1036600859.db2.gz VATXHPRZGHLERQ-ZIAGYGMSSA-N 1 2 323.396 4.157 20 0 DIADLO COc1ccc(C[NH2+]C2(c3nc(C)cs3)CCC2)c(Cl)c1 ZINC000340438127 1036612951 /nfs/dbraw/zinc/61/29/51/1036612951.db2.gz DITJEYFIFRURIF-UHFFFAOYSA-N 1 2 322.861 4.283 20 0 DIADLO COc1cc(C)ccc1C[NH2+]Cc1csc(-c2ccccc2)n1 ZINC000151011788 1036645369 /nfs/dbraw/zinc/64/53/69/1036645369.db2.gz UXUMSJUHYVIGHD-UHFFFAOYSA-N 1 2 324.449 4.417 20 0 DIADLO CCSc1nc(C[NH+]2CCCC2)nc2sc(C)c(C)c21 ZINC000340455135 1036648436 /nfs/dbraw/zinc/64/84/36/1036648436.db2.gz UFOIRDCZIXGSQR-UHFFFAOYSA-N 1 2 307.488 4.016 20 0 DIADLO COc1ccccc1/C=C/CNc1ccc(N2CCCCC2)c[nH+]1 ZINC001648874002 1036664993 /nfs/dbraw/zinc/66/49/93/1036664993.db2.gz HCPXTRKBCTZADU-VQHVLOKHSA-N 1 2 323.440 4.206 20 0 DIADLO Cc1ccc(Br)cc1NCc1cccc2[nH+]ccn21 ZINC001648884417 1036673151 /nfs/dbraw/zinc/67/31/51/1036673151.db2.gz OZFJSVHWNGNWJJ-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[NH2+]Cc1ccoc1 ZINC001648893175 1036675832 /nfs/dbraw/zinc/67/58/32/1036675832.db2.gz UHRQDVJREYRKHN-UHFFFAOYSA-N 1 2 318.573 4.124 20 0 DIADLO CCOc1cc(CNc2ccc([NH+]3CCCC3)cc2)ccc1O ZINC000076272784 1036703856 /nfs/dbraw/zinc/70/38/56/1036703856.db2.gz LMVJOQOFSMRVBF-UHFFFAOYSA-N 1 2 312.413 4.003 20 0 DIADLO CC(C)C[C@H](C)CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000340488324 1036736195 /nfs/dbraw/zinc/73/61/95/1036736195.db2.gz NYTSOUQQFHYVRX-ZDUSSCGKSA-N 1 2 303.381 4.022 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)ccc1OC(F)F)c1nccs1 ZINC000080266712 1036772115 /nfs/dbraw/zinc/77/21/15/1036772115.db2.gz FCCMSEYRXHHJKW-MRVPVSSYSA-N 1 2 318.776 4.249 20 0 DIADLO c1csc(-c2nc(C[N@@H+]3CCC[C@@H]3c3ccccn3)co2)c1 ZINC000530963164 1036799815 /nfs/dbraw/zinc/79/98/15/1036799815.db2.gz WAXIHECLTWDSMG-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2nc(C[N@H+]3CCC[C@@H]3c3ccccn3)co2)c1 ZINC000530963164 1036799827 /nfs/dbraw/zinc/79/98/27/1036799827.db2.gz WAXIHECLTWDSMG-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1c1noc(C[C@@H](C)n2cc[nH+]c2)n1 ZINC000656041567 1036831293 /nfs/dbraw/zinc/83/12/93/1036831293.db2.gz AHGBZNWFTXJCMJ-FPCVCCKLSA-N 1 2 316.449 4.246 20 0 DIADLO C[C@H]1C[N@H+](CCCCC(F)(F)F)C[C@H](c2ccsc2)O1 ZINC000155580092 1036863375 /nfs/dbraw/zinc/86/33/75/1036863375.db2.gz LQMIQVOJEXBCJU-WCQYABFASA-N 1 2 307.381 4.243 20 0 DIADLO C[C@H]1C[N@@H+](CCCCC(F)(F)F)C[C@H](c2ccsc2)O1 ZINC000155580092 1036863396 /nfs/dbraw/zinc/86/33/96/1036863396.db2.gz LQMIQVOJEXBCJU-WCQYABFASA-N 1 2 307.381 4.243 20 0 DIADLO Cc1nc([C@H]([NH2+][C@H](C)[C@@H]2CC2(C)C)c2ccc(Cl)cc2)no1 ZINC000683774466 1036893206 /nfs/dbraw/zinc/89/32/06/1036893206.db2.gz VKXSELQDYRANFW-WKPIXPDZSA-N 1 2 319.836 4.145 20 0 DIADLO FC(F)(F)COc1ccc(Nc2cccn3cc[nH+]c23)cc1 ZINC001210741017 1036933269 /nfs/dbraw/zinc/93/32/69/1036933269.db2.gz FICDBPORLJMBPX-UHFFFAOYSA-N 1 2 307.275 4.019 20 0 DIADLO COc1cc(Nc2ccccc2Oc2cccnc2)cc(C)[nH+]1 ZINC001210781019 1036963429 /nfs/dbraw/zinc/96/34/29/1036963429.db2.gz MFGODFCBBVCXEE-UHFFFAOYSA-N 1 2 307.353 4.330 20 0 DIADLO C[C@]1(c2ccccc2)C[N@H+](Cc2cc(Cl)cs2)CCO1 ZINC000683829693 1036986062 /nfs/dbraw/zinc/98/60/62/1036986062.db2.gz CALBNFFANGEXPU-MRXNPFEDSA-N 1 2 307.846 4.149 20 0 DIADLO C[C@]1(c2ccccc2)C[N@@H+](Cc2cc(Cl)cs2)CCO1 ZINC000683829693 1036986083 /nfs/dbraw/zinc/98/60/83/1036986083.db2.gz CALBNFFANGEXPU-MRXNPFEDSA-N 1 2 307.846 4.149 20 0 DIADLO Cc1cnc(C[N@H+](C)Cc2sc3ccccc3c2Cl)cn1 ZINC001207078569 1037039955 /nfs/dbraw/zinc/03/99/55/1037039955.db2.gz KWSHIDJABKDGKF-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO Cc1cnc(C[N@@H+](C)Cc2sc3ccccc3c2Cl)cn1 ZINC001207078569 1037039969 /nfs/dbraw/zinc/03/99/69/1037039969.db2.gz KWSHIDJABKDGKF-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO FC1(F)CCC[C@@H]1[NH2+]Cc1ccc(Cl)c(Br)c1 ZINC000397971736 1037055657 /nfs/dbraw/zinc/05/56/57/1037055657.db2.gz UELBICWBHJWOQP-NSHDSACASA-N 1 2 324.596 4.380 20 0 DIADLO COc1cc(Nc2ccc(C)c[nH+]2)c(C)cc1Br ZINC001211012294 1037089063 /nfs/dbraw/zinc/08/90/63/1037089063.db2.gz FTNZYULNEAOSLO-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO C[N@@H+](Cc1cscc1Br)Cc1cccc(F)c1 ZINC000580483116 1037159107 /nfs/dbraw/zinc/15/91/07/1037159107.db2.gz XGLYULDGBGNZSZ-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[N@H+](Cc1cscc1Br)Cc1cccc(F)c1 ZINC000580483116 1037159103 /nfs/dbraw/zinc/15/91/03/1037159103.db2.gz XGLYULDGBGNZSZ-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO CC[C@H]1C[N@H+](CCc2cccc(Cl)c2Cl)C[C@H](C)O1 ZINC001167421658 1037219556 /nfs/dbraw/zinc/21/95/56/1037219556.db2.gz ZPBKGZGCGGJVOQ-AAEUAGOBSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)C[C@H](C)O1 ZINC001167421658 1037219560 /nfs/dbraw/zinc/21/95/60/1037219560.db2.gz ZPBKGZGCGGJVOQ-AAEUAGOBSA-N 1 2 302.245 4.035 20 0 DIADLO C[C@@H]([NH2+]C/C=C\c1ccccc1)c1nc(C2CCCCC2)no1 ZINC000255629625 1037222305 /nfs/dbraw/zinc/22/23/05/1037222305.db2.gz YJXONKNQJXXOSR-MEODZPNASA-N 1 2 311.429 4.481 20 0 DIADLO FC1(F)CC12C[NH+](CCCc1c(Cl)cccc1Cl)C2 ZINC000656265466 1037237125 /nfs/dbraw/zinc/23/71/25/1037237125.db2.gz OTGJEELQPQCIAZ-UHFFFAOYSA-N 1 2 306.183 4.267 20 0 DIADLO c1c2ccccc2[nH]c1C[N@@H+]1CCO[C@@H](CCc2ccccc2)C1 ZINC000684026240 1037253960 /nfs/dbraw/zinc/25/39/60/1037253960.db2.gz ZKZPKWMRPHUNKP-FQEVSTJZSA-N 1 2 320.436 4.002 20 0 DIADLO c1c2ccccc2[nH]c1C[N@H+]1CCO[C@@H](CCc2ccccc2)C1 ZINC000684026240 1037253975 /nfs/dbraw/zinc/25/39/75/1037253975.db2.gz ZKZPKWMRPHUNKP-FQEVSTJZSA-N 1 2 320.436 4.002 20 0 DIADLO Clc1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)c(Cl)n1 ZINC001211274649 1037266092 /nfs/dbraw/zinc/26/60/92/1037266092.db2.gz YIGRGEHJVPNLKM-UHFFFAOYSA-N 1 2 313.575 4.433 20 0 DIADLO OCc1cccc(Nc2cc[nH+]c3cc(Cl)ccc23)c1F ZINC001211431412 1037320598 /nfs/dbraw/zinc/32/05/98/1037320598.db2.gz BHNNMNQNWLAQDU-UHFFFAOYSA-N 1 2 302.736 4.263 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H]1C[C@H](C)n2ncnc21)c1ccc(Cl)cc1F ZINC000926127902 1037349953 /nfs/dbraw/zinc/34/99/53/1037349953.db2.gz KRHJLQCXVGAGIO-VQISRLSMSA-N 1 2 322.815 4.063 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]Cc2ncc(C(C)(C)C)s2)cn1 ZINC000684110354 1037358992 /nfs/dbraw/zinc/35/89/92/1037358992.db2.gz XFIZFVQCDZEXPT-LBPRGKRZSA-N 1 2 306.479 4.069 20 0 DIADLO C/C(=C/c1ccccc1OC(F)F)C[N@@H+](C)Cc1cscn1 ZINC000581103811 1037436608 /nfs/dbraw/zinc/43/66/08/1037436608.db2.gz YGICKGPZLWDDHM-GHXNOFRVSA-N 1 2 324.396 4.280 20 0 DIADLO C/C(=C/c1ccccc1OC(F)F)C[N@H+](C)Cc1cscn1 ZINC000581103811 1037436623 /nfs/dbraw/zinc/43/66/23/1037436623.db2.gz YGICKGPZLWDDHM-GHXNOFRVSA-N 1 2 324.396 4.280 20 0 DIADLO CCCc1csc(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)n1 ZINC000581264554 1037504662 /nfs/dbraw/zinc/50/46/62/1037504662.db2.gz PDQLADPRENEBGS-KRWDZBQOSA-N 1 2 304.434 4.166 20 0 DIADLO CCCc1csc(C[N@H+]2CC[C@@](F)(c3ccccc3)C2)n1 ZINC000581264554 1037504672 /nfs/dbraw/zinc/50/46/72/1037504672.db2.gz PDQLADPRENEBGS-KRWDZBQOSA-N 1 2 304.434 4.166 20 0 DIADLO CC(C)c1ccc([C@@H]([NH2+]Cc2ncc[nH]2)c2cccs2)cc1 ZINC000067667185 1037517805 /nfs/dbraw/zinc/51/78/05/1037517805.db2.gz VVROYVUTZWFSPU-GOSISDBHSA-N 1 2 311.454 4.474 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2csc(-c3ccco3)n2)o1 ZINC000067975089 1037527773 /nfs/dbraw/zinc/52/77/73/1037527773.db2.gz QIVOTNZPFFPTBZ-RISCZKNCSA-N 1 2 314.410 4.409 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)o1 ZINC000068812914 1037555834 /nfs/dbraw/zinc/55/58/34/1037555834.db2.gz LJHHLIIKFRGDHX-MRXNPFEDSA-N 1 2 311.429 4.019 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)o1 ZINC000068812914 1037555843 /nfs/dbraw/zinc/55/58/43/1037555843.db2.gz LJHHLIIKFRGDHX-MRXNPFEDSA-N 1 2 311.429 4.019 20 0 DIADLO Cc1cc(-c2nnc(C[N@@H+]3CCc4ccccc4[C@@H]3C)o2)c(C)o1 ZINC000089896539 1037602339 /nfs/dbraw/zinc/60/23/39/1037602339.db2.gz GGQDERBZLAYNOE-ZDUSSCGKSA-N 1 2 323.396 4.066 20 0 DIADLO Cc1cc(-c2nnc(C[N@H+]3CCc4ccccc4[C@@H]3C)o2)c(C)o1 ZINC000089896539 1037602344 /nfs/dbraw/zinc/60/23/44/1037602344.db2.gz GGQDERBZLAYNOE-ZDUSSCGKSA-N 1 2 323.396 4.066 20 0 DIADLO CC(C)=CC[N@H+](Cc1ccc(Cl)cc1)Cc1cnccn1 ZINC000656592700 1037676204 /nfs/dbraw/zinc/67/62/04/1037676204.db2.gz WDUCFSQYWWHJQT-UHFFFAOYSA-N 1 2 301.821 4.098 20 0 DIADLO CC(C)=CC[N@@H+](Cc1ccc(Cl)cc1)Cc1cnccn1 ZINC000656592700 1037676215 /nfs/dbraw/zinc/67/62/15/1037676215.db2.gz WDUCFSQYWWHJQT-UHFFFAOYSA-N 1 2 301.821 4.098 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2csc(Cl)c2)cs1 ZINC000276304566 1037692639 /nfs/dbraw/zinc/69/26/39/1037692639.db2.gz DKMZSZIWQUMVST-IUCAKERBSA-N 1 2 316.879 4.416 20 0 DIADLO Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000341183005 1037712143 /nfs/dbraw/zinc/71/21/43/1037712143.db2.gz UZSNFTBVNOGDNR-INIZCTEOSA-N 1 2 319.408 4.313 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@H+](Cc2nc(C3CC3)cs2)C1 ZINC000581619774 1037785988 /nfs/dbraw/zinc/78/59/88/1037785988.db2.gz NXIQKCUXLIELAM-QGZVFWFLSA-N 1 2 302.418 4.091 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@@H+](Cc2nc(C3CC3)cs2)C1 ZINC000581619774 1037786002 /nfs/dbraw/zinc/78/60/02/1037786002.db2.gz NXIQKCUXLIELAM-QGZVFWFLSA-N 1 2 302.418 4.091 20 0 DIADLO CC(C)Cn1nccc1C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000647168904 1037800582 /nfs/dbraw/zinc/80/05/82/1037800582.db2.gz QFXWGFGTAYGOAI-IBGZPJMESA-N 1 2 309.413 4.011 20 0 DIADLO O=C(C[NH+]1CCCC1)Nc1nc(-c2cccc(Cl)c2)cs1 ZINC000051126634 1037821629 /nfs/dbraw/zinc/82/16/29/1037821629.db2.gz ZKWKBFWSBZSCQV-UHFFFAOYSA-N 1 2 321.833 4.147 20 0 DIADLO Cc1cc(C)c(NC(=O)NC(C2CCC2)C2CCC2)c(C)[nH+]1 ZINC000581650278 1037835435 /nfs/dbraw/zinc/83/54/35/1037835435.db2.gz DAMVOBPMTLADNK-UHFFFAOYSA-N 1 2 301.434 4.097 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cc(COC)cs1 ZINC000656772710 1037858678 /nfs/dbraw/zinc/85/86/78/1037858678.db2.gz WUBLMXLOFKITPF-UHFFFAOYSA-N 1 2 319.405 4.015 20 0 DIADLO COCc1csc(CNc2[nH+]c3ccccc3n2C(C)C)c1 ZINC000656781523 1037862499 /nfs/dbraw/zinc/86/24/99/1037862499.db2.gz ZNPLIVHFPPHOKW-UHFFFAOYSA-N 1 2 315.442 4.437 20 0 DIADLO c1oc(-c2ccccc2)nc1CNc1c[nH+]cc2c1CCCC2 ZINC000656775873 1037863728 /nfs/dbraw/zinc/86/37/28/1037863728.db2.gz FEHUZVJRTKNTQL-UHFFFAOYSA-N 1 2 305.381 4.228 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)[C@@H](C)[N@H+](C)Cc1ccsc1 ZINC000127229109 1037873407 /nfs/dbraw/zinc/87/34/07/1037873407.db2.gz MFUOWUAPWUHJQN-GFCCVEGCSA-N 1 2 322.861 4.169 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccsc1 ZINC000127229109 1037873424 /nfs/dbraw/zinc/87/34/24/1037873424.db2.gz MFUOWUAPWUHJQN-GFCCVEGCSA-N 1 2 322.861 4.169 20 0 DIADLO CCOc1ccc(CNc2ccc([NH+](C)C)cc2C)cc1OC ZINC000121425233 1037893236 /nfs/dbraw/zinc/89/32/36/1037893236.db2.gz UFDJBVZOWDZYPQ-UHFFFAOYSA-N 1 2 314.429 4.080 20 0 DIADLO Cc1ccc(Cl)nc1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC001140448335 1037945917 /nfs/dbraw/zinc/94/59/17/1037945917.db2.gz WNUKZBDKOFWGRM-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(Cl)nc1C[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC001140448335 1037945924 /nfs/dbraw/zinc/94/59/24/1037945924.db2.gz WNUKZBDKOFWGRM-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1c[nH+]c(CNc2cc(Cl)ccc2SC(C)C)n1C ZINC000341383869 1037950731 /nfs/dbraw/zinc/95/07/31/1037950731.db2.gz DSUCKNHFWVXHQD-UHFFFAOYSA-N 1 2 309.866 4.495 20 0 DIADLO CC(C)(C)C[C@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(F)cc1 ZINC000341458846 1038041719 /nfs/dbraw/zinc/04/17/19/1038041719.db2.gz QPBMXHYKORKMAH-HNNXBMFYSA-N 1 2 317.408 4.353 20 0 DIADLO Cc1cc(N(C)Cc2cccc(C(F)(F)F)c2)nc(C2CC2)[nH+]1 ZINC000341506660 1038060844 /nfs/dbraw/zinc/06/08/44/1038060844.db2.gz UNECNCWYGVWYJL-UHFFFAOYSA-N 1 2 321.346 4.318 20 0 DIADLO COc1cccc([C@H]2CCCN2c2cc(C)[nH+]c(C3CC3)n2)c1 ZINC000341493441 1038062193 /nfs/dbraw/zinc/06/21/93/1038062193.db2.gz WXSMEYBYPJUOHL-QGZVFWFLSA-N 1 2 309.413 4.013 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2coc(-c3ccc(C)cc3)n2)s1 ZINC000090418553 1038114798 /nfs/dbraw/zinc/11/47/98/1038114798.db2.gz AQOPQAOLOLEBHA-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2csc(-c3ccco3)n2)s1 ZINC000090419556 1038121526 /nfs/dbraw/zinc/12/15/26/1038121526.db2.gz LINFCDXYNQPRMW-SECBINFHSA-N 1 2 305.428 4.019 20 0 DIADLO Cc1cc([C@@H]2CCCN2c2[nH+]ccc3c4c([nH]c32)CCCC4)no1 ZINC000891702128 1038150479 /nfs/dbraw/zinc/15/04/79/1038150479.db2.gz GUARMHVUIDIPIL-KRWDZBQOSA-N 1 2 322.412 4.080 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](CC(C)(C)C)c2ccccc2)n1 ZINC000341594763 1038166697 /nfs/dbraw/zinc/16/66/97/1038166697.db2.gz NNRZWUYSXYQUOG-HNNXBMFYSA-N 1 2 301.434 4.289 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+]Cc1ccc(-c2ccccc2)c(C)c1 ZINC000926221443 1038185681 /nfs/dbraw/zinc/18/56/81/1038185681.db2.gz UPIAFLVNEQIPFV-AWEZNQCLSA-N 1 2 307.397 4.204 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000056493092 1038190017 /nfs/dbraw/zinc/19/00/17/1038190017.db2.gz SCYZLSIGOCSFPO-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000056493092 1038190024 /nfs/dbraw/zinc/19/00/24/1038190024.db2.gz SCYZLSIGOCSFPO-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO Cc1cc(NC(=O)CC2CCC(c3ccccc3)CC2)cc[nH+]1 ZINC001266882297 1038190643 /nfs/dbraw/zinc/19/06/43/1038190643.db2.gz ACENNXJVFIWMNC-UHFFFAOYSA-N 1 2 308.425 4.115 20 0 DIADLO FC(F)C[NH2+]C1(c2ccc(Br)cc2)CCCC1 ZINC000603409970 1038200398 /nfs/dbraw/zinc/20/03/98/1038200398.db2.gz UTQRUAHAQHNXID-UHFFFAOYSA-N 1 2 304.178 4.073 20 0 DIADLO Cc1cc(NC(=O)C(C)(C)c2cccc3ccccc32)c(C)c[nH+]1 ZINC001266899721 1038205468 /nfs/dbraw/zinc/20/54/68/1038205468.db2.gz NWAZZCQMYCXVEP-UHFFFAOYSA-N 1 2 318.420 4.190 20 0 DIADLO CC[C@]1(C)CCC[N@@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001167493548 1038233183 /nfs/dbraw/zinc/23/31/83/1038233183.db2.gz ZODYZKXDIVEPKD-NVXWUHKLSA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@]1(C)CCC[N@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001167493548 1038233198 /nfs/dbraw/zinc/23/31/98/1038233198.db2.gz ZODYZKXDIVEPKD-NVXWUHKLSA-N 1 2 309.837 4.066 20 0 DIADLO Cn1ncc2c1CCC[C@@H]2Nc1cc[nH+]c2c(Cl)cccc12 ZINC000341742859 1038257374 /nfs/dbraw/zinc/25/73/74/1038257374.db2.gz IRLNFEVHVHZXCS-AWEZNQCLSA-N 1 2 312.804 4.111 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+](Cc1ccccc1)C1CC1 ZINC001143413675 1038267249 /nfs/dbraw/zinc/26/72/49/1038267249.db2.gz VADARUWQHJWWNQ-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+](Cc1ccccc1)C1CC1 ZINC001143413675 1038267259 /nfs/dbraw/zinc/26/72/59/1038267259.db2.gz VADARUWQHJWWNQ-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO CC(C)Sc1ccc(C(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC000603819527 1038287356 /nfs/dbraw/zinc/28/73/56/1038287356.db2.gz SLHQBUNZJOWFQZ-UHFFFAOYSA-N 1 2 311.410 4.087 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2cccnc2s1)c1ccc(F)cc1Cl ZINC000341840036 1038291259 /nfs/dbraw/zinc/29/12/59/1038291259.db2.gz LMBYSBCEIAZINB-SECBINFHSA-N 1 2 321.808 4.335 20 0 DIADLO COC(=O)c1oc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)cc1C ZINC000603856610 1038301498 /nfs/dbraw/zinc/30/14/98/1038301498.db2.gz LLGJSSXUOBOZFM-LBPRGKRZSA-N 1 2 321.804 4.221 20 0 DIADLO COC(=O)c1oc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)cc1C ZINC000603856610 1038301513 /nfs/dbraw/zinc/30/15/13/1038301513.db2.gz LLGJSSXUOBOZFM-LBPRGKRZSA-N 1 2 321.804 4.221 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2cc(-c3cccs3)on2)s1 ZINC000639994788 1038309821 /nfs/dbraw/zinc/30/98/21/1038309821.db2.gz MVKMOFWWTJQUIU-SECBINFHSA-N 1 2 305.428 4.019 20 0 DIADLO Clc1ccc(Cl)c(C=C2CC[NH+](Cc3cc[nH]n3)CC2)c1 ZINC000535814740 1038342859 /nfs/dbraw/zinc/34/28/59/1038342859.db2.gz ATEKRLNXEPFWFH-UHFFFAOYSA-N 1 2 322.239 4.396 20 0 DIADLO Cc1ccc2oc(C(=O)Nc3ccccc3-n3cc[nH+]c3)cc2c1 ZINC000342023240 1038368828 /nfs/dbraw/zinc/36/88/28/1038368828.db2.gz XPYVJOSFGFJZKW-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO COc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)s2)n1 ZINC001137533402 1038386177 /nfs/dbraw/zinc/38/61/77/1038386177.db2.gz UGMAYLUJSAFTBU-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)s2)n1 ZINC001137533402 1038386193 /nfs/dbraw/zinc/38/61/93/1038386193.db2.gz UGMAYLUJSAFTBU-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cccc(C[NH2+][C@@H](c2ccco2)c2ccccc2OC)c1 ZINC000151135368 1038433354 /nfs/dbraw/zinc/43/33/54/1038433354.db2.gz OBLHFFQAZKWKAH-HXUWFJFHSA-N 1 2 323.392 4.176 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2cc(C)cnc2Cl)s1 ZINC000891992995 1038455730 /nfs/dbraw/zinc/45/57/30/1038455730.db2.gz QDLOWJMJXUGMTB-NSHDSACASA-N 1 2 309.866 4.310 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2cc(C)cnc2Cl)s1 ZINC000891992995 1038455737 /nfs/dbraw/zinc/45/57/37/1038455737.db2.gz QDLOWJMJXUGMTB-NSHDSACASA-N 1 2 309.866 4.310 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)n1 ZINC000604884997 1038461717 /nfs/dbraw/zinc/46/17/17/1038461717.db2.gz SKBWJFKYWKIQEB-KRWDZBQOSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)n1 ZINC000604884997 1038461720 /nfs/dbraw/zinc/46/17/20/1038461720.db2.gz SKBWJFKYWKIQEB-KRWDZBQOSA-N 1 2 303.837 4.455 20 0 DIADLO CCCC[C@H](CC)CC(=O)NCc1cccc(-n2cc[nH+]c2)c1 ZINC000604944611 1038466947 /nfs/dbraw/zinc/46/69/47/1038466947.db2.gz MYEQHENTQUSGPY-INIZCTEOSA-N 1 2 313.445 4.095 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2c(F)cncc2F)C1 ZINC001167503759 1038480148 /nfs/dbraw/zinc/48/01/48/1038480148.db2.gz DNUMUYXMYHAUHJ-PIGZYNQJSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2c(F)cncc2F)C1 ZINC001167503759 1038480153 /nfs/dbraw/zinc/48/01/53/1038480153.db2.gz DNUMUYXMYHAUHJ-PIGZYNQJSA-N 1 2 306.331 4.082 20 0 DIADLO CCSc1ccccc1C[N@@H+]1CCOC[C@H]1c1ccccc1 ZINC001167503926 1038480316 /nfs/dbraw/zinc/48/03/16/1038480316.db2.gz FRXNZZYRWRXVBM-SFHVURJKSA-N 1 2 313.466 4.372 20 0 DIADLO CCSc1ccccc1C[N@H+]1CCOC[C@H]1c1ccccc1 ZINC001167503926 1038480321 /nfs/dbraw/zinc/48/03/21/1038480321.db2.gz FRXNZZYRWRXVBM-SFHVURJKSA-N 1 2 313.466 4.372 20 0 DIADLO CCCc1nc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)cs1 ZINC000605154559 1038493375 /nfs/dbraw/zinc/49/33/75/1038493375.db2.gz UPWXRNCNJNTBGY-MRXNPFEDSA-N 1 2 318.511 4.386 20 0 DIADLO CCCc1nc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)cs1 ZINC000605154559 1038493379 /nfs/dbraw/zinc/49/33/79/1038493379.db2.gz UPWXRNCNJNTBGY-MRXNPFEDSA-N 1 2 318.511 4.386 20 0 DIADLO CCCc1nc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)cs1 ZINC000605154558 1038494627 /nfs/dbraw/zinc/49/46/27/1038494627.db2.gz UPWXRNCNJNTBGY-INIZCTEOSA-N 1 2 318.511 4.386 20 0 DIADLO CCCc1nc(C[N@H+]2CCS[C@H](c3ccccc3)C2)cs1 ZINC000605154558 1038494635 /nfs/dbraw/zinc/49/46/35/1038494635.db2.gz UPWXRNCNJNTBGY-INIZCTEOSA-N 1 2 318.511 4.386 20 0 DIADLO Cc1cc(-c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)ccc1F ZINC000605257982 1038496727 /nfs/dbraw/zinc/49/67/27/1038496727.db2.gz CGDFLRAPEBOPEJ-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO C[C@H](Nc1cc(NCC2CC2)[nH+]cn1)c1cc2ccccc2o1 ZINC000605432964 1038516288 /nfs/dbraw/zinc/51/62/88/1038516288.db2.gz SDPDMFHCRLYTSJ-LBPRGKRZSA-N 1 2 308.385 4.218 20 0 DIADLO C[C@H](Nc1cc(NCC2CC2)nc[nH+]1)c1cc2ccccc2o1 ZINC000605432964 1038516297 /nfs/dbraw/zinc/51/62/97/1038516297.db2.gz SDPDMFHCRLYTSJ-LBPRGKRZSA-N 1 2 308.385 4.218 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)s2)[nH]1 ZINC000277348085 1038517942 /nfs/dbraw/zinc/51/79/42/1038517942.db2.gz VOUDUDVQZPZYNT-AEJSXWLSSA-N 1 2 312.870 4.445 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(-c3ccco3)on2)cc1 ZINC000025361269 1038547563 /nfs/dbraw/zinc/54/75/63/1038547563.db2.gz INCFRVRSSZFMGS-INIZCTEOSA-N 1 2 312.344 4.411 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2cc(-c3ccco3)on2)cc1 ZINC000025361269 1038547570 /nfs/dbraw/zinc/54/75/70/1038547570.db2.gz INCFRVRSSZFMGS-INIZCTEOSA-N 1 2 312.344 4.411 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@@H+]1Cc1csc(C)n1 ZINC000605713807 1038547955 /nfs/dbraw/zinc/54/79/55/1038547955.db2.gz CFAKIRIAFZUJGT-MRXNPFEDSA-N 1 2 302.443 4.187 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1csc(C)n1 ZINC000605713807 1038547963 /nfs/dbraw/zinc/54/79/63/1038547963.db2.gz CFAKIRIAFZUJGT-MRXNPFEDSA-N 1 2 302.443 4.187 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1csc(C)n1 ZINC000605713806 1038548117 /nfs/dbraw/zinc/54/81/17/1038548117.db2.gz CFAKIRIAFZUJGT-INIZCTEOSA-N 1 2 302.443 4.187 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1csc(C)n1 ZINC000605713806 1038548123 /nfs/dbraw/zinc/54/81/23/1038548123.db2.gz CFAKIRIAFZUJGT-INIZCTEOSA-N 1 2 302.443 4.187 20 0 DIADLO Cc1[nH]c(CNc2cccc(OCCc3ccccc3)c2)[nH+]c1C ZINC000657320691 1038567216 /nfs/dbraw/zinc/56/72/16/1038567216.db2.gz HRCUSMXZYLEANA-UHFFFAOYSA-N 1 2 321.424 4.260 20 0 DIADLO CCc1nc(C[NH2+]Cc2cc3cccc(CC)c3o2)cs1 ZINC000657353582 1038596589 /nfs/dbraw/zinc/59/65/89/1038596589.db2.gz JVOKJIWOGUZXNO-UHFFFAOYSA-N 1 2 300.427 4.304 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@@H+]1CCOc2ccccc2C1 ZINC000606431717 1038602074 /nfs/dbraw/zinc/60/20/74/1038602074.db2.gz SNKOMMFAIKKNEL-QGZVFWFLSA-N 1 2 303.352 4.311 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@H+]1CCOc2ccccc2C1 ZINC000606431717 1038602077 /nfs/dbraw/zinc/60/20/77/1038602077.db2.gz SNKOMMFAIKKNEL-QGZVFWFLSA-N 1 2 303.352 4.311 20 0 DIADLO CCO[C@H]1CCC[N@H+](Cc2csc(C3CCCCC3)n2)C1 ZINC000606438611 1038602990 /nfs/dbraw/zinc/60/29/90/1038602990.db2.gz CCLCSELFFXDVBD-INIZCTEOSA-N 1 2 308.491 4.192 20 0 DIADLO CCO[C@H]1CCC[N@@H+](Cc2csc(C3CCCCC3)n2)C1 ZINC000606438611 1038602996 /nfs/dbraw/zinc/60/29/96/1038602996.db2.gz CCLCSELFFXDVBD-INIZCTEOSA-N 1 2 308.491 4.192 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cn(C2CCC2)nn1)c1ccccc1Cl ZINC000657361390 1038604626 /nfs/dbraw/zinc/60/46/26/1038604626.db2.gz CJUNLTSQSQBZFY-QGZVFWFLSA-N 1 2 318.852 4.143 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2nc(C(C)(C)C)no2)o1 ZINC000606454229 1038604941 /nfs/dbraw/zinc/60/49/41/1038604941.db2.gz ABEJLXPIGWTJRJ-CQSZACIVSA-N 1 2 317.433 4.386 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2nc(C(C)(C)C)no2)o1 ZINC000606454229 1038604946 /nfs/dbraw/zinc/60/49/46/1038604946.db2.gz ABEJLXPIGWTJRJ-CQSZACIVSA-N 1 2 317.433 4.386 20 0 DIADLO Cc1cccc2[nH]c(C[NH2+][C@@H](c3nc(C4CC4)no3)C(C)C)cc21 ZINC000657367802 1038613202 /nfs/dbraw/zinc/61/32/02/1038613202.db2.gz RFGQFAJVXNXPPO-QGZVFWFLSA-N 1 2 324.428 4.224 20 0 DIADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(OC(F)(F)F)c(Cl)c1 ZINC001140556209 1038613702 /nfs/dbraw/zinc/61/37/02/1038613702.db2.gz OSBYFMTVGPMPJD-SCZZXKLOSA-N 1 2 311.706 4.171 20 0 DIADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(OC(F)(F)F)c(Cl)c1 ZINC001140556209 1038613704 /nfs/dbraw/zinc/61/37/04/1038613704.db2.gz OSBYFMTVGPMPJD-SCZZXKLOSA-N 1 2 311.706 4.171 20 0 DIADLO Cc1cn2cc(NC(=O)NC(C)(C)c3cccc(C)c3)ccc2[nH+]1 ZINC000606568927 1038613790 /nfs/dbraw/zinc/61/37/90/1038613790.db2.gz IUHBIGVOHZAFCN-UHFFFAOYSA-N 1 2 322.412 4.008 20 0 DIADLO CCN(Cc1ccc(C)cc1)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000606570497 1038614928 /nfs/dbraw/zinc/61/49/28/1038614928.db2.gz ZFDGLWFRPPNDGM-UHFFFAOYSA-N 1 2 322.412 4.005 20 0 DIADLO CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606583569 1038615683 /nfs/dbraw/zinc/61/56/83/1038615683.db2.gz GVSDNFRXFDADMY-KRWDZBQOSA-N 1 2 322.412 4.339 20 0 DIADLO Cc1cn2cc(NC(=O)[C@H](Cc3ccccc3)C(C)C)ccc2[nH+]1 ZINC000606775877 1038624422 /nfs/dbraw/zinc/62/44/22/1038624422.db2.gz IXLPWIXODPDYLA-GOSISDBHSA-N 1 2 321.424 4.096 20 0 DIADLO c1cc2c(nc[nH+]c2Nc2ccc(COC3CCCC3)cc2)[nH]1 ZINC000606895140 1038636300 /nfs/dbraw/zinc/63/63/00/1038636300.db2.gz QMSSSAQOLYNVEH-UHFFFAOYSA-N 1 2 308.385 4.161 20 0 DIADLO FC(F)(F)[C@@H]1C[N@@H+](C2c3ccccc3-c3ccccc32)CCO1 ZINC000606902880 1038638589 /nfs/dbraw/zinc/63/85/89/1038638589.db2.gz XCDBKUIHJHNWBH-INIZCTEOSA-N 1 2 319.326 4.020 20 0 DIADLO FC(F)(F)[C@@H]1C[N@H+](C2c3ccccc3-c3ccccc32)CCO1 ZINC000606902880 1038638600 /nfs/dbraw/zinc/63/86/00/1038638600.db2.gz XCDBKUIHJHNWBH-INIZCTEOSA-N 1 2 319.326 4.020 20 0 DIADLO FC(F)(F)[C@H]1C[N@@H+](C2c3ccccc3-c3ccccc32)CCO1 ZINC000606902883 1038638714 /nfs/dbraw/zinc/63/87/14/1038638714.db2.gz XCDBKUIHJHNWBH-MRXNPFEDSA-N 1 2 319.326 4.020 20 0 DIADLO FC(F)(F)[C@H]1C[N@H+](C2c3ccccc3-c3ccccc32)CCO1 ZINC000606902883 1038638718 /nfs/dbraw/zinc/63/87/18/1038638718.db2.gz XCDBKUIHJHNWBH-MRXNPFEDSA-N 1 2 319.326 4.020 20 0 DIADLO C[C@H](c1cccc2ccccc21)[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000606902521 1038638760 /nfs/dbraw/zinc/63/87/60/1038638760.db2.gz ZSOBEONHEHNALK-MLGOLLRUSA-N 1 2 309.331 4.164 20 0 DIADLO C[C@H](c1cccc2ccccc21)[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000606902521 1038638764 /nfs/dbraw/zinc/63/87/64/1038638764.db2.gz ZSOBEONHEHNALK-MLGOLLRUSA-N 1 2 309.331 4.164 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Br)[nH]2)cc1 ZINC001232683874 1038643032 /nfs/dbraw/zinc/64/30/32/1038643032.db2.gz JMZHZGZFBXNXCX-AWEZNQCLSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Br)[nH]2)cc1 ZINC001232683874 1038643035 /nfs/dbraw/zinc/64/30/35/1038643035.db2.gz JMZHZGZFBXNXCX-AWEZNQCLSA-N 1 2 323.209 4.253 20 0 DIADLO CCCc1noc(C[N@@H+]2CCCCC[C@@H]2c2ccc(CC)o2)n1 ZINC000606936245 1038644104 /nfs/dbraw/zinc/64/41/04/1038644104.db2.gz HIZFEMAICWTUEB-OAHLLOKOSA-N 1 2 317.433 4.295 20 0 DIADLO CCCc1noc(C[N@H+]2CCCCC[C@@H]2c2ccc(CC)o2)n1 ZINC000606936245 1038644112 /nfs/dbraw/zinc/64/41/12/1038644112.db2.gz HIZFEMAICWTUEB-OAHLLOKOSA-N 1 2 317.433 4.295 20 0 DIADLO Cc1ccc2cc(CNc3ccc(N4CCCC4)[nH+]c3)[nH]c2c1 ZINC000657412268 1038652176 /nfs/dbraw/zinc/65/21/76/1038652176.db2.gz AEFBYYXMIGQSHJ-UHFFFAOYSA-N 1 2 306.413 4.084 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1cc2ccncc2s1 ZINC000657415479 1038654759 /nfs/dbraw/zinc/65/47/59/1038654759.db2.gz DQCRJQDFXPLZLY-UHFFFAOYSA-N 1 2 313.426 4.481 20 0 DIADLO CC(C)C[C@@H]1CCCCCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000607213208 1038664879 /nfs/dbraw/zinc/66/48/79/1038664879.db2.gz JBPBIIJFYGJANG-INIZCTEOSA-N 1 2 314.433 4.157 20 0 DIADLO CC(C)n1ccnc1C[NH2+][C@@H]1CCCOc2cc(Cl)ccc21 ZINC000657429002 1038666270 /nfs/dbraw/zinc/66/62/70/1038666270.db2.gz PSOOPKHRESIDGQ-OAHLLOKOSA-N 1 2 319.836 4.121 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ccc(Cl)nc2Cl)c1 ZINC000235045085 1038668008 /nfs/dbraw/zinc/66/80/08/1038668008.db2.gz NGNQTYXOBVYLKB-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ccc(Cl)nc2Cl)c1 ZINC000235045085 1038668012 /nfs/dbraw/zinc/66/80/12/1038668012.db2.gz NGNQTYXOBVYLKB-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2nc(C3CC3)cs2)c1 ZINC000342559287 1038670256 /nfs/dbraw/zinc/67/02/56/1038670256.db2.gz ADWPGQQVGSWHNA-UHFFFAOYSA-N 1 2 306.456 4.166 20 0 DIADLO Cc1[nH]c2ccc(CNC(=O)c3c(C)cc(C)[nH+]c3C)cc2c1C ZINC001625876408 1038672451 /nfs/dbraw/zinc/67/24/51/1038672451.db2.gz VDLWHTHMYIBKNT-UHFFFAOYSA-N 1 2 321.424 4.035 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCOc2ccccc2C1 ZINC000607356927 1038674778 /nfs/dbraw/zinc/67/47/78/1038674778.db2.gz FUYDZRBDJSULTA-OAHLLOKOSA-N 1 2 320.392 4.297 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCOc2ccccc2C1 ZINC000607356927 1038674782 /nfs/dbraw/zinc/67/47/82/1038674782.db2.gz FUYDZRBDJSULTA-OAHLLOKOSA-N 1 2 320.392 4.297 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc3c(s2)CC[C@@H](C)C3)c(C)[nH+]1 ZINC000097040201 1038684428 /nfs/dbraw/zinc/68/44/28/1038684428.db2.gz ZGANUYDNWNXZDF-SNVBAGLBSA-N 1 2 314.454 4.445 20 0 DIADLO COC(=O)c1occc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000342599802 1038684490 /nfs/dbraw/zinc/68/44/90/1038684490.db2.gz QAFJBINIGGXTKN-OAHLLOKOSA-N 1 2 319.788 4.057 20 0 DIADLO COC(=O)c1occc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000342599802 1038684493 /nfs/dbraw/zinc/68/44/93/1038684493.db2.gz QAFJBINIGGXTKN-OAHLLOKOSA-N 1 2 319.788 4.057 20 0 DIADLO C[C@H]1CCC[C@@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1 ZINC000607484605 1038688248 /nfs/dbraw/zinc/68/82/48/1038688248.db2.gz HEOVNWLDFIPWEV-QWHCGFSZSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1cc(C)c(NC(=O)COc2ccc(C(C)C)cc2)c(C)[nH+]1 ZINC000097075928 1038691615 /nfs/dbraw/zinc/69/16/15/1038691615.db2.gz KNPMDLFXRPBVCC-UHFFFAOYSA-N 1 2 312.413 4.148 20 0 DIADLO CCCc1c(NCc2[nH]c(C)c(C)[nH+]2)cnn1-c1ccc(C)cc1 ZINC000657449491 1038692134 /nfs/dbraw/zinc/69/21/34/1038692134.db2.gz ZPEMWHHQQJDTKD-UHFFFAOYSA-N 1 2 323.444 4.085 20 0 DIADLO CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)[N@H+](C)Cc1ccoc1 ZINC000342639817 1038697260 /nfs/dbraw/zinc/69/72/60/1038697260.db2.gz OUAJKPIYCQJHID-LSDHHAIUSA-N 1 2 314.429 4.252 20 0 DIADLO CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccoc1 ZINC000342639817 1038697265 /nfs/dbraw/zinc/69/72/65/1038697265.db2.gz OUAJKPIYCQJHID-LSDHHAIUSA-N 1 2 314.429 4.252 20 0 DIADLO CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)[N@H+](C)Cc1ccoc1 ZINC000342639814 1038697648 /nfs/dbraw/zinc/69/76/48/1038697648.db2.gz OUAJKPIYCQJHID-CABCVRRESA-N 1 2 314.429 4.252 20 0 DIADLO CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccoc1 ZINC000342639814 1038697655 /nfs/dbraw/zinc/69/76/55/1038697655.db2.gz OUAJKPIYCQJHID-CABCVRRESA-N 1 2 314.429 4.252 20 0 DIADLO Cc1ccc(Cl)c(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000152718235 1038709783 /nfs/dbraw/zinc/70/97/83/1038709783.db2.gz JGFXXWSVIFGJDG-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO COCc1cnc(C[N@H+](C)[C@@H](C)c2cccc(Cl)c2)s1 ZINC000342679046 1038717120 /nfs/dbraw/zinc/71/71/20/1038717120.db2.gz COWMGNLDEXYCET-NSHDSACASA-N 1 2 310.850 4.136 20 0 DIADLO COCc1cnc(C[N@@H+](C)[C@@H](C)c2cccc(Cl)c2)s1 ZINC000342679046 1038717126 /nfs/dbraw/zinc/71/71/26/1038717126.db2.gz COWMGNLDEXYCET-NSHDSACASA-N 1 2 310.850 4.136 20 0 DIADLO COCc1cnc(C[N@H+](C)[C@H](C)c2cc(C)ccc2C)s1 ZINC000342688726 1038722242 /nfs/dbraw/zinc/72/22/42/1038722242.db2.gz HFKOKCQYHCRBRY-CQSZACIVSA-N 1 2 304.459 4.099 20 0 DIADLO COCc1cnc(C[N@@H+](C)[C@H](C)c2cc(C)ccc2C)s1 ZINC000342688726 1038722251 /nfs/dbraw/zinc/72/22/51/1038722251.db2.gz HFKOKCQYHCRBRY-CQSZACIVSA-N 1 2 304.459 4.099 20 0 DIADLO COCc1cnc(C[N@H+](C)[C@H](C)c2ccc(C)cc2C)s1 ZINC000342686476 1038722879 /nfs/dbraw/zinc/72/28/79/1038722879.db2.gz DERKUTVOQIJQIQ-CQSZACIVSA-N 1 2 304.459 4.099 20 0 DIADLO COCc1cnc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2C)s1 ZINC000342686476 1038722883 /nfs/dbraw/zinc/72/28/83/1038722883.db2.gz DERKUTVOQIJQIQ-CQSZACIVSA-N 1 2 304.459 4.099 20 0 DIADLO COCc1cnc(C[N@H+](C)[C@@H](C)c2cc(C)ccc2C)s1 ZINC000342688725 1038723042 /nfs/dbraw/zinc/72/30/42/1038723042.db2.gz HFKOKCQYHCRBRY-AWEZNQCLSA-N 1 2 304.459 4.099 20 0 DIADLO COCc1cnc(C[N@@H+](C)[C@@H](C)c2cc(C)ccc2C)s1 ZINC000342688725 1038723044 /nfs/dbraw/zinc/72/30/44/1038723044.db2.gz HFKOKCQYHCRBRY-AWEZNQCLSA-N 1 2 304.459 4.099 20 0 DIADLO CCc1cccc2cc(C[NH2+]Cc3nnc(C4CC4)s3)oc21 ZINC000657497288 1038727003 /nfs/dbraw/zinc/72/70/03/1038727003.db2.gz XVIBMQUVYDOJQD-UHFFFAOYSA-N 1 2 313.426 4.014 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cnn(CC2CCC2)c1)c1nc2ccccc2o1 ZINC000934562483 1038734844 /nfs/dbraw/zinc/73/48/44/1038734844.db2.gz QKIHIWVMIGYMTH-UONOGXRCSA-N 1 2 324.428 4.236 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C3(Cc4ccccc4)CCC3)cc2[nH+]1 ZINC000342732774 1038750775 /nfs/dbraw/zinc/75/07/75/1038750775.db2.gz DIGBEZZRQZKYLQ-UHFFFAOYSA-N 1 2 319.408 4.223 20 0 DIADLO CC(C)([NH2+]Cc1cccc(Cl)c1Cl)c1nccs1 ZINC000116380795 1038754594 /nfs/dbraw/zinc/75/45/94/1038754594.db2.gz RVPOINDNFLKQPO-UHFFFAOYSA-N 1 2 301.242 4.475 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)s1 ZINC000608063002 1038761818 /nfs/dbraw/zinc/76/18/18/1038761818.db2.gz LDAPAXYVXIVPIP-UHFFFAOYSA-N 1 2 316.401 4.449 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2c(Cl)ccnc21)c1c(F)cncc1F ZINC000926420868 1038762000 /nfs/dbraw/zinc/76/20/00/1038762000.db2.gz YSKJODPUYQDLJS-OTYXRUKQSA-N 1 2 323.774 4.136 20 0 DIADLO C[N@H+](CCOc1cccc(Cl)c1)Cc1nc(C2CC2)cs1 ZINC000342762626 1038762881 /nfs/dbraw/zinc/76/28/81/1038762881.db2.gz YUZFINFQYLRGJB-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO C[N@@H+](CCOc1cccc(Cl)c1)Cc1nc(C2CC2)cs1 ZINC000342762626 1038762887 /nfs/dbraw/zinc/76/28/87/1038762887.db2.gz YUZFINFQYLRGJB-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO C[C@H]1c2c(Cl)cc(Cl)cc2CC[N@H+]1CCOCC(F)F ZINC001167602778 1038770095 /nfs/dbraw/zinc/77/00/95/1038770095.db2.gz PVDWWQGSUMGDRQ-VIFPVBQESA-N 1 2 324.198 4.194 20 0 DIADLO C[C@H]1c2c(Cl)cc(Cl)cc2CC[N@@H+]1CCOCC(F)F ZINC001167602778 1038770100 /nfs/dbraw/zinc/77/01/00/1038770100.db2.gz PVDWWQGSUMGDRQ-VIFPVBQESA-N 1 2 324.198 4.194 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)C1CCC(c2ccccc2)CC1 ZINC000608133675 1038777823 /nfs/dbraw/zinc/77/78/23/1038777823.db2.gz QDNLUCFPZYVLPL-UHFFFAOYSA-N 1 2 319.408 4.247 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccccc2)[C@H](C)c2ccccc2)n1C ZINC000342797686 1038797180 /nfs/dbraw/zinc/79/71/80/1038797180.db2.gz HQYYTEVTTKQGKW-GOSISDBHSA-N 1 2 319.452 4.492 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccccc2)[C@H](C)c2ccccc2)n1C ZINC000342797686 1038797196 /nfs/dbraw/zinc/79/71/96/1038797196.db2.gz HQYYTEVTTKQGKW-GOSISDBHSA-N 1 2 319.452 4.492 20 0 DIADLO Cc1c[nH+]c(CN(Cc2ccccc2)[C@H](C)c2ccccc2)n1C ZINC000342797686 1038797215 /nfs/dbraw/zinc/79/72/15/1038797215.db2.gz HQYYTEVTTKQGKW-GOSISDBHSA-N 1 2 319.452 4.492 20 0 DIADLO CCc1ccc(CC)c(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000075365806 1038801389 /nfs/dbraw/zinc/80/13/89/1038801389.db2.gz RYOJGDCFKDPMJZ-UHFFFAOYSA-N 1 2 319.408 4.249 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ncc(-c3ccc(C)cc3)o2)c1 ZINC000075615267 1038808565 /nfs/dbraw/zinc/80/85/65/1038808565.db2.gz KWKLOSAPNGNOIL-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ncc(-c3ccc(C)cc3)o2)c1 ZINC000075615267 1038808588 /nfs/dbraw/zinc/80/85/88/1038808588.db2.gz KWKLOSAPNGNOIL-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO C[C@@H](c1ccc(-c2ccccc2)cc1)[N@H+](C)Cc1nccn1C ZINC000075955840 1038816380 /nfs/dbraw/zinc/81/63/80/1038816380.db2.gz QMZQKZAAXQFFMB-INIZCTEOSA-N 1 2 305.425 4.280 20 0 DIADLO C[C@@H](c1ccc(-c2ccccc2)cc1)[N@@H+](C)Cc1nccn1C ZINC000075955840 1038816405 /nfs/dbraw/zinc/81/64/05/1038816405.db2.gz QMZQKZAAXQFFMB-INIZCTEOSA-N 1 2 305.425 4.280 20 0 DIADLO COc1c(O)cccc1C[N@H+](C)[C@@H](C)c1ccccc1Cl ZINC000491217352 1038858022 /nfs/dbraw/zinc/85/80/22/1038858022.db2.gz OXUZKVWFDHIHER-LBPRGKRZSA-N 1 2 305.805 4.247 20 0 DIADLO COc1c(O)cccc1C[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC000491217352 1038858044 /nfs/dbraw/zinc/85/80/44/1038858044.db2.gz OXUZKVWFDHIHER-LBPRGKRZSA-N 1 2 305.805 4.247 20 0 DIADLO Cc1cccc(C)c1C[N@H+](C)Cc1nccn1Cc1ccccc1 ZINC000608501553 1038867859 /nfs/dbraw/zinc/86/78/59/1038867859.db2.gz IAEQJXWUZGTUFE-UHFFFAOYSA-N 1 2 319.452 4.180 20 0 DIADLO Cc1cccc(C)c1C[N@@H+](C)Cc1nccn1Cc1ccccc1 ZINC000608501553 1038867882 /nfs/dbraw/zinc/86/78/82/1038867882.db2.gz IAEQJXWUZGTUFE-UHFFFAOYSA-N 1 2 319.452 4.180 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C\c2ccccc2Cl)c(C)[nH+]1 ZINC000255545058 1038899302 /nfs/dbraw/zinc/89/93/02/1038899302.db2.gz VHPYHYNWEHWHQB-HJWRWDBZSA-N 1 2 300.789 4.312 20 0 DIADLO CC[C@@H](C)Oc1cc(C[NH2+][C@@H](C)c2cscn2)ccc1OC ZINC000657599694 1038899359 /nfs/dbraw/zinc/89/93/59/1038899359.db2.gz QIOHIHPNUYFHOI-OLZOCXBDSA-N 1 2 320.458 4.180 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1nnc(-c2ccc(Cl)cc2)o1 ZINC000048812054 1038912042 /nfs/dbraw/zinc/91/20/42/1038912042.db2.gz VLLUIYQJXQFUKH-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1nnc(-c2ccc(Cl)cc2)o1 ZINC000048812054 1038912051 /nfs/dbraw/zinc/91/20/51/1038912051.db2.gz VLLUIYQJXQFUKH-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3cccc4ccccc43)ccc2[nH+]1 ZINC000608760684 1038916676 /nfs/dbraw/zinc/91/66/76/1038916676.db2.gz PYDIDXSUODCXEO-UHFFFAOYSA-N 1 2 316.364 4.440 20 0 DIADLO OCC[C@@H](Nc1cc[nH+]c2c(Cl)cccc12)c1ccco1 ZINC000342870418 1038940852 /nfs/dbraw/zinc/94/08/52/1038940852.db2.gz MKPLWAKZXWXXSI-CQSZACIVSA-N 1 2 302.761 4.017 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000078656672 1038995295 /nfs/dbraw/zinc/99/52/95/1038995295.db2.gz QYHWZIDDOKBWGP-OAHLLOKOSA-N 1 2 307.825 4.333 20 0 DIADLO Cc1cc(NC(=O)[C@H]2C[C@H]2c2ccc3ccccc3c2)c(C)c[nH+]1 ZINC000534299880 1039021720 /nfs/dbraw/zinc/02/17/20/1039021720.db2.gz JEHAQUSRSQLXMI-OALUTQOASA-N 1 2 316.404 4.016 20 0 DIADLO CC[C@H](c1ccccc1)N(CC)C(=O)Nc1cc(C)[nH+]cc1C ZINC000534326062 1039027122 /nfs/dbraw/zinc/02/71/22/1039027122.db2.gz QMINPKHUXKYYII-GOSISDBHSA-N 1 2 311.429 4.125 20 0 DIADLO COCc1cnc(C[N@@H+]2CC[C@H](C)[C@@H]2c2cccc(F)c2)s1 ZINC000342954943 1039051622 /nfs/dbraw/zinc/05/16/22/1039051622.db2.gz ZOPKUERPPNTUKF-YVEFUNNKSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1cnc(C[N@H+]2CC[C@H](C)[C@@H]2c2cccc(F)c2)s1 ZINC000342954943 1039051641 /nfs/dbraw/zinc/05/16/41/1039051641.db2.gz ZOPKUERPPNTUKF-YVEFUNNKSA-N 1 2 320.433 4.012 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)cs1 ZINC000042624749 1039053760 /nfs/dbraw/zinc/05/37/60/1039053760.db2.gz ZTHBJONIKCDBES-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2)cs1 ZINC000042624749 1039053778 /nfs/dbraw/zinc/05/37/78/1039053778.db2.gz ZTHBJONIKCDBES-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO COc1cc(Cl)ccc1[C@@H](C)[NH2+]Cc1cc(C(C)C)no1 ZINC000643346230 1039071202 /nfs/dbraw/zinc/07/12/02/1039071202.db2.gz SDUVECOYJRJYFF-LLVKDONJSA-N 1 2 308.809 4.311 20 0 DIADLO COc1cc(Cl)ccc1[C@H](C)[NH2+]Cc1cc(C(C)C)no1 ZINC000643346231 1039072204 /nfs/dbraw/zinc/07/22/04/1039072204.db2.gz SDUVECOYJRJYFF-NSHDSACASA-N 1 2 308.809 4.311 20 0 DIADLO Cc1c(C(=O)NCc2c[nH+]c(C)cc2C)oc2c1c(C)ccc2C ZINC000456836863 1039086221 /nfs/dbraw/zinc/08/62/21/1039086221.db2.gz BLSAGUQSEGFTFM-UHFFFAOYSA-N 1 2 322.408 4.300 20 0 DIADLO Cc1cccc([C@H](C)C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)c1 ZINC000150780042 1039157638 /nfs/dbraw/zinc/15/76/38/1039157638.db2.gz XPXKIBLABLGAJE-AWEZNQCLSA-N 1 2 323.371 4.062 20 0 DIADLO COc1cc(C)[nH+]c(CN2C[C@@H](C)C[C@@H]2c2ccccc2F)c1 ZINC000535281337 1039167613 /nfs/dbraw/zinc/16/76/13/1039167613.db2.gz RVQZLRDYLPRRCY-ORAYPTAESA-N 1 2 314.404 4.121 20 0 DIADLO c1cc2c(s1)CC[N@@H+](Cc1ncc(-c3ccccc3)s1)C2 ZINC000539408634 1039255471 /nfs/dbraw/zinc/25/54/71/1039255471.db2.gz MOTKNCMZZXMUHA-UHFFFAOYSA-N 1 2 312.463 4.430 20 0 DIADLO c1cc2c(s1)CC[N@H+](Cc1ncc(-c3ccccc3)s1)C2 ZINC000539408634 1039255483 /nfs/dbraw/zinc/25/54/83/1039255483.db2.gz MOTKNCMZZXMUHA-UHFFFAOYSA-N 1 2 312.463 4.430 20 0 DIADLO Cc1cc(C)c(-c2nn(C[N@H+]3CC[C@@H](C)C3)c(=S)o2)c(C)c1 ZINC000728561028 1039262701 /nfs/dbraw/zinc/26/27/01/1039262701.db2.gz PTPWYUXGXVTIER-LLVKDONJSA-N 1 2 317.458 4.097 20 0 DIADLO Cc1cc(C)c(-c2nn(C[N@@H+]3CC[C@@H](C)C3)c(=S)o2)c(C)c1 ZINC000728561028 1039262716 /nfs/dbraw/zinc/26/27/16/1039262716.db2.gz PTPWYUXGXVTIER-LLVKDONJSA-N 1 2 317.458 4.097 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccccc2OC(F)(F)F)cs1 ZINC000126547126 1039275131 /nfs/dbraw/zinc/27/51/31/1039275131.db2.gz UDUAXHQVZFHLRP-VIFPVBQESA-N 1 2 316.348 4.201 20 0 DIADLO C[C@H]1CCc2cc(N)ccc2N1c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213087966 1039287043 /nfs/dbraw/zinc/28/70/43/1039287043.db2.gz IXKABGDEUVAZBC-ZDUSSCGKSA-N 1 2 304.397 4.132 20 0 DIADLO Cc1csc(C[NH2+][C@H](C)c2ccc(F)cc2OC(F)F)n1 ZINC000126285247 1039294724 /nfs/dbraw/zinc/29/47/24/1039294724.db2.gz HWPPELDCKFLLGL-SECBINFHSA-N 1 2 316.348 4.043 20 0 DIADLO Fc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)c2ncccc12 ZINC000155952484 1039295657 /nfs/dbraw/zinc/29/56/57/1039295657.db2.gz TZIHKQHHNRQMFR-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1cc2n(n1)CCCC2)c1ccc(F)cc1F ZINC000647289865 1039309607 /nfs/dbraw/zinc/30/96/07/1039309607.db2.gz MKDHLRCAOKQZFU-SJCJKPOMSA-N 1 2 319.399 4.300 20 0 DIADLO CCn1c2ccccc2nc1SCc1cc(OC)cc(C)[nH+]1 ZINC000536010539 1039309831 /nfs/dbraw/zinc/30/98/31/1039309831.db2.gz DDVUEENLTSTGSU-UHFFFAOYSA-N 1 2 313.426 4.061 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccccc1N(C)C ZINC000539739239 1039330892 /nfs/dbraw/zinc/33/08/92/1039330892.db2.gz QYONMEKDGNMSTE-INIZCTEOSA-N 1 2 324.472 4.311 20 0 DIADLO Clc1cc(Cl)cc(CC[N@@H+]2CCOC3(CCCC3)C2)c1 ZINC001167668867 1039339832 /nfs/dbraw/zinc/33/98/32/1039339832.db2.gz QIBBATLHEJWAGS-UHFFFAOYSA-N 1 2 314.256 4.181 20 0 DIADLO Clc1cc(Cl)cc(CC[N@H+]2CCOC3(CCCC3)C2)c1 ZINC001167668867 1039339853 /nfs/dbraw/zinc/33/98/53/1039339853.db2.gz QIBBATLHEJWAGS-UHFFFAOYSA-N 1 2 314.256 4.181 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc3ccc(Cl)cn23)[C@@H]1c1ccccc1 ZINC000539825340 1039344506 /nfs/dbraw/zinc/34/45/06/1039344506.db2.gz RYAYLQFFVLAVAC-ACJLOTCBSA-N 1 2 311.816 4.181 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc3ccc(Cl)cn23)[C@@H]1c1ccccc1 ZINC000539825340 1039344526 /nfs/dbraw/zinc/34/45/26/1039344526.db2.gz RYAYLQFFVLAVAC-ACJLOTCBSA-N 1 2 311.816 4.181 20 0 DIADLO Cc1csc(C[N@H+](Cc2ccccc2)[C@@H]2COC(C)(C)C2)n1 ZINC000661193648 1039350828 /nfs/dbraw/zinc/35/08/28/1039350828.db2.gz IIEDVIQFWPXNSF-INIZCTEOSA-N 1 2 316.470 4.021 20 0 DIADLO Cc1csc(C[N@@H+](Cc2ccccc2)[C@@H]2COC(C)(C)C2)n1 ZINC000661193648 1039350844 /nfs/dbraw/zinc/35/08/44/1039350844.db2.gz IIEDVIQFWPXNSF-INIZCTEOSA-N 1 2 316.470 4.021 20 0 DIADLO Cc1ccc(CN(CCCn2cc[nH+]c2)c2ccc(F)cc2)o1 ZINC000343302885 1039386333 /nfs/dbraw/zinc/38/63/33/1039386333.db2.gz NBBPDFFFVQAORC-UHFFFAOYSA-N 1 2 313.376 4.021 20 0 DIADLO Cc1nc(N[C@@H](C)c2ccccc2Oc2ccccc2)cc[nH+]1 ZINC000462795220 1039397333 /nfs/dbraw/zinc/39/73/33/1039397333.db2.gz PRSUJXVHJAFNHG-AWEZNQCLSA-N 1 2 305.381 4.750 20 0 DIADLO O=C(Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CCCCC1 ZINC001272321384 1039397515 /nfs/dbraw/zinc/39/75/15/1039397515.db2.gz VBNKIPAKQQDVBG-UHFFFAOYSA-N 1 2 324.424 4.372 20 0 DIADLO Cc1nn(C)c2cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)ccc12 ZINC001213090171 1039421769 /nfs/dbraw/zinc/42/17/69/1039421769.db2.gz XRFUJGKGSRQIAR-UHFFFAOYSA-N 1 2 303.369 4.015 20 0 DIADLO C[C@@H](N[C@@H]1C[N@H+](C)Cc2ccccc21)c1ccc(F)cc1Cl ZINC000540147943 1039427079 /nfs/dbraw/zinc/42/70/79/1039427079.db2.gz DJBFTRJXDIQDCH-KZULUSFZSA-N 1 2 318.823 4.316 20 0 DIADLO C[C@@H](N[C@@H]1C[N@@H+](C)Cc2ccccc21)c1ccc(F)cc1Cl ZINC000540147943 1039427086 /nfs/dbraw/zinc/42/70/86/1039427086.db2.gz DJBFTRJXDIQDCH-KZULUSFZSA-N 1 2 318.823 4.316 20 0 DIADLO C[C@H](N[C@H]1C[N@H+](C)Cc2ccccc21)c1ccc(F)cc1Cl ZINC000540147946 1039427191 /nfs/dbraw/zinc/42/71/91/1039427191.db2.gz DJBFTRJXDIQDCH-SGTLLEGYSA-N 1 2 318.823 4.316 20 0 DIADLO C[C@H](N[C@H]1C[N@@H+](C)Cc2ccccc21)c1ccc(F)cc1Cl ZINC000540147946 1039427196 /nfs/dbraw/zinc/42/71/96/1039427196.db2.gz DJBFTRJXDIQDCH-SGTLLEGYSA-N 1 2 318.823 4.316 20 0 DIADLO CC(C)(C)C(F)(F)C[NH2+]Cc1ccc(Oc2cnccn2)cc1 ZINC000657793961 1039464190 /nfs/dbraw/zinc/46/41/90/1039464190.db2.gz RSOGKJOEHHTILT-UHFFFAOYSA-N 1 2 321.371 4.040 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000278433950 1039468716 /nfs/dbraw/zinc/46/87/16/1039468716.db2.gz KKFDGNGTDGZIMG-GFCCVEGCSA-N 1 2 315.417 4.332 20 0 DIADLO Cc1nc(F)ccc1C[N@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000278433950 1039468722 /nfs/dbraw/zinc/46/87/22/1039468722.db2.gz KKFDGNGTDGZIMG-GFCCVEGCSA-N 1 2 315.417 4.332 20 0 DIADLO CCn1ncc2cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)ccc21 ZINC001213090933 1039480234 /nfs/dbraw/zinc/48/02/34/1039480234.db2.gz NMJJHTBEHRPDBD-UHFFFAOYSA-N 1 2 303.369 4.190 20 0 DIADLO CC(C)n1ccc(Nc2cc(Br)c3[nH+]ccn3c2)c1 ZINC001203159349 1039480885 /nfs/dbraw/zinc/48/08/85/1039480885.db2.gz SMPAZOREOPJCCV-UHFFFAOYSA-N 1 2 319.206 4.223 20 0 DIADLO CC(=O)n1ccc2cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)ccc21 ZINC001213091169 1039488420 /nfs/dbraw/zinc/48/84/20/1039488420.db2.gz ZTYMSAUDGRNDOK-UHFFFAOYSA-N 1 2 316.364 4.435 20 0 DIADLO Cc1cc(NCc2c(F)cccc2OC(F)(F)F)c[nH+]c1C ZINC001203484588 1039499376 /nfs/dbraw/zinc/49/93/76/1039499376.db2.gz ACDIHGJSSXZLPV-UHFFFAOYSA-N 1 2 314.282 4.348 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](COC)c2ccc(F)cc2)cs1 ZINC000540475884 1039501564 /nfs/dbraw/zinc/50/15/64/1039501564.db2.gz UDSFLMGUINXDIR-INIZCTEOSA-N 1 2 322.449 4.102 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ncc(-c3ccccc3)s2)cc1 ZINC000540506306 1039506710 /nfs/dbraw/zinc/50/67/10/1039506710.db2.gz FVGCBGNMENMMLG-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ncc(-c3ccccc3)s2)cc1 ZINC000540506306 1039506726 /nfs/dbraw/zinc/50/67/26/1039506726.db2.gz FVGCBGNMENMMLG-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO Cc1cc(-c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)cs1 ZINC000685242905 1039529773 /nfs/dbraw/zinc/52/97/73/1039529773.db2.gz UNPQRQCZLAYVCP-UHFFFAOYSA-N 1 2 322.393 4.018 20 0 DIADLO Cc1ccc(-c2cc(C[N@@H+](C)Cc3ccccc3F)on2)cc1 ZINC000642252310 1039543754 /nfs/dbraw/zinc/54/37/54/1039543754.db2.gz RPOXNERYEFEUIR-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1ccc(-c2cc(C[N@H+](C)Cc3ccccc3F)on2)cc1 ZINC000642252310 1039543768 /nfs/dbraw/zinc/54/37/68/1039543768.db2.gz RPOXNERYEFEUIR-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO FC(F)(F)c1cnc(C[NH2+]Cc2ccc(Cl)cc2)s1 ZINC000278562752 1039548791 /nfs/dbraw/zinc/54/87/91/1039548791.db2.gz CQSSJISUSVXBJE-UHFFFAOYSA-N 1 2 306.740 4.105 20 0 DIADLO C[C@H](Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccc(F)cc1F ZINC000540832597 1039580026 /nfs/dbraw/zinc/58/00/26/1039580026.db2.gz GVJWVZBAZDVAFE-NSHDSACASA-N 1 2 317.314 4.463 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1cccc2cccnc21 ZINC000158887620 1039601960 /nfs/dbraw/zinc/60/19/60/1039601960.db2.gz KOHVNXLSIFRRTG-UHFFFAOYSA-N 1 2 302.381 4.217 20 0 DIADLO CC[N@H+](Cc1nc(C(C)(C)c2ccc(Cl)cc2)no1)C1CC1 ZINC000584140202 1039616729 /nfs/dbraw/zinc/61/67/29/1039616729.db2.gz XFVPGSVQOYZKAW-UHFFFAOYSA-N 1 2 319.836 4.033 20 0 DIADLO CC[N@@H+](Cc1nc(C(C)(C)c2ccc(Cl)cc2)no1)C1CC1 ZINC000584140202 1039616738 /nfs/dbraw/zinc/61/67/38/1039616738.db2.gz XFVPGSVQOYZKAW-UHFFFAOYSA-N 1 2 319.836 4.033 20 0 DIADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1nc(-c2ccccc2)cs1 ZINC000584136184 1039618537 /nfs/dbraw/zinc/61/85/37/1039618537.db2.gz OPMHFDDILBEGQZ-YJYMSZOUSA-N 1 2 322.433 4.422 20 0 DIADLO CCc1cnccc1[C@H](C)[NH2+]Cc1ncc(-c2ccccc2C)o1 ZINC000541193931 1039629506 /nfs/dbraw/zinc/62/95/06/1039629506.db2.gz ARSJLTWRFUBHTP-HNNXBMFYSA-N 1 2 321.424 4.458 20 0 DIADLO CC(C)C[C@H]1CCCC[N@@H+]1Cc1ncc(Br)s1 ZINC000541236556 1039644476 /nfs/dbraw/zinc/64/44/76/1039644476.db2.gz QAVTYVDRZAOPGB-LLVKDONJSA-N 1 2 317.296 4.306 20 0 DIADLO CC(C)C[C@H]1CCCC[N@H+]1Cc1ncc(Br)s1 ZINC000541236556 1039644481 /nfs/dbraw/zinc/64/44/81/1039644481.db2.gz QAVTYVDRZAOPGB-LLVKDONJSA-N 1 2 317.296 4.306 20 0 DIADLO COc1c(Cl)cccc1NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000159318598 1039650759 /nfs/dbraw/zinc/65/07/59/1039650759.db2.gz ILIQDDPNTMHKBO-UHFFFAOYSA-N 1 2 313.788 4.146 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2ncc(C(F)(F)F)s2)cc1 ZINC000278694987 1039655984 /nfs/dbraw/zinc/65/59/84/1039655984.db2.gz QIMIOYANHHFYAO-VIFPVBQESA-N 1 2 316.348 4.021 20 0 DIADLO CCCCOc1ccc(-n2c(C)[nH+]c3ccc(N)cc32)cc1F ZINC001211613046 1039658372 /nfs/dbraw/zinc/65/83/72/1039658372.db2.gz UBYPDVOFCQEFFK-UHFFFAOYSA-N 1 2 313.376 4.234 20 0 DIADLO C[C@H]1C[N@H+](CCc2cccc(F)c2F)C[C@@H](c2ccsc2)O1 ZINC000541349601 1039671060 /nfs/dbraw/zinc/67/10/60/1039671060.db2.gz NLUAQKGQVIMFJH-LRDDRELGSA-N 1 2 323.408 4.031 20 0 DIADLO C[C@H]1C[N@@H+](CCc2cccc(F)c2F)C[C@@H](c2ccsc2)O1 ZINC000541349601 1039671069 /nfs/dbraw/zinc/67/10/69/1039671069.db2.gz NLUAQKGQVIMFJH-LRDDRELGSA-N 1 2 323.408 4.031 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@H+](C)Cc1cccc(O)c1 ZINC000080923980 1039689339 /nfs/dbraw/zinc/68/93/39/1039689339.db2.gz ARERHQQOIJGCJY-CQSZACIVSA-N 1 2 308.381 4.240 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+](C)Cc1cccc(O)c1 ZINC000080923980 1039689347 /nfs/dbraw/zinc/68/93/47/1039689347.db2.gz ARERHQQOIJGCJY-CQSZACIVSA-N 1 2 308.381 4.240 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@H]2CCSc3c(F)cccc32)[nH+]1 ZINC000080945591 1039691870 /nfs/dbraw/zinc/69/18/70/1039691870.db2.gz AICYTXYAWBEFNC-ZDUSSCGKSA-N 1 2 314.389 4.054 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@@H+]2Cc2ccco2)s1 ZINC000541555285 1039702819 /nfs/dbraw/zinc/70/28/19/1039702819.db2.gz VBJIOZGBOVSOSV-NSHDSACASA-N 1 2 312.232 4.441 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@H+]2Cc2ccco2)s1 ZINC000541555285 1039702839 /nfs/dbraw/zinc/70/28/39/1039702839.db2.gz VBJIOZGBOVSOSV-NSHDSACASA-N 1 2 312.232 4.441 20 0 DIADLO Cc1nc2cc(NCc3c[nH+]c(C)n3-c3ccccc3)ccc2o1 ZINC000081292530 1039710338 /nfs/dbraw/zinc/71/03/38/1039710338.db2.gz PGUWQHPJWOQDBF-UHFFFAOYSA-N 1 2 318.380 4.242 20 0 DIADLO Cc1cc(N[C@H](C)c2cccc(N3CCCC3)c2)nc(C2CC2)[nH+]1 ZINC000088758993 1039767394 /nfs/dbraw/zinc/76/73/94/1039767394.db2.gz AFKUYNLIKLWKNT-OAHLLOKOSA-N 1 2 322.456 4.436 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@H](C)c2cnn(C(C)C)c2)cs1 ZINC000090049919 1039789269 /nfs/dbraw/zinc/78/92/69/1039789269.db2.gz TZXFBQCZDWVPTH-OLZOCXBDSA-N 1 2 306.479 4.456 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2cnccn2)cc(C(F)(F)F)c1 ZINC001143455666 1039794989 /nfs/dbraw/zinc/79/49/89/1039794989.db2.gz VVZNGWHOLJJAAW-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2cnccn2)cc(C(F)(F)F)c1 ZINC001143455666 1039795002 /nfs/dbraw/zinc/79/50/02/1039795002.db2.gz VVZNGWHOLJJAAW-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@@H](C)c1ccc(F)cn1 ZINC000090118345 1039803414 /nfs/dbraw/zinc/80/34/14/1039803414.db2.gz GQQWHJNITGRBDR-QWHCGFSZSA-N 1 2 312.392 4.002 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2OC(F)F)o1 ZINC000090177395 1039804774 /nfs/dbraw/zinc/80/47/74/1039804774.db2.gz JFDNWJLXMHICCC-SNVBAGLBSA-N 1 2 313.319 4.433 20 0 DIADLO CC[C@H]([NH2+]Cc1ncccc1F)c1ccccc1OC(F)F ZINC000090720116 1039814978 /nfs/dbraw/zinc/81/49/78/1039814978.db2.gz QMVMZVBXTUUZCE-ZDUSSCGKSA-N 1 2 310.319 4.063 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)nc1)Cn1c2ccccc2oc1=S ZINC000029886157 1039833080 /nfs/dbraw/zinc/83/30/80/1039833080.db2.gz SSNFMDHXCBCULL-UHFFFAOYSA-N 1 2 319.817 4.102 20 0 DIADLO C[N@H+](Cc1ccc(Cl)nc1)Cn1c2ccccc2oc1=S ZINC000029886157 1039833102 /nfs/dbraw/zinc/83/31/02/1039833102.db2.gz SSNFMDHXCBCULL-UHFFFAOYSA-N 1 2 319.817 4.102 20 0 DIADLO O=C(Nc1csc2ccccc12)[C@@H]1CC[N@@H+]1Cc1ccccc1 ZINC000491458082 1039851862 /nfs/dbraw/zinc/85/18/62/1039851862.db2.gz QZBVJKZUIYEKIZ-KRWDZBQOSA-N 1 2 322.433 4.114 20 0 DIADLO O=C(Nc1csc2ccccc12)[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000491458082 1039851880 /nfs/dbraw/zinc/85/18/80/1039851880.db2.gz QZBVJKZUIYEKIZ-KRWDZBQOSA-N 1 2 322.433 4.114 20 0 DIADLO C[C@@H]([NH2+][C@@H](CO)c1ccc(Cl)cc1)c1c(F)cccc1F ZINC000091743715 1039857730 /nfs/dbraw/zinc/85/77/30/1039857730.db2.gz PBWHPXPUDRELIA-BMIGLBTASA-N 1 2 311.759 4.002 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nc(-c2ccc(C)cc2)no1 ZINC000092224114 1039862932 /nfs/dbraw/zinc/86/29/32/1039862932.db2.gz NBQVQSDPRBRLTQ-KRWDZBQOSA-N 1 2 322.412 4.023 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nc(-c2ccc(C)cc2)no1 ZINC000092224114 1039862955 /nfs/dbraw/zinc/86/29/55/1039862955.db2.gz NBQVQSDPRBRLTQ-KRWDZBQOSA-N 1 2 322.412 4.023 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(-c2ccc(F)cc2)o1)c1ccsc1 ZINC000669938664 1039878014 /nfs/dbraw/zinc/87/80/14/1039878014.db2.gz UMWKGZGJTDBSBL-LLVKDONJSA-N 1 2 302.374 4.393 20 0 DIADLO CC[C@H]1CC[C@H](C(=O)Nc2nc(C[NH+](CC)CC)cs2)CC1 ZINC000784351079 1039879362 /nfs/dbraw/zinc/87/93/62/1039879362.db2.gz JRKYGEFVIRBIDF-HDJSIYSDSA-N 1 2 323.506 4.140 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(-c2ccccc2)n1)c1ccc(F)cn1 ZINC000092741777 1039882455 /nfs/dbraw/zinc/88/24/55/1039882455.db2.gz YLWRIYAMCSKZMH-GFCCVEGCSA-N 1 2 313.401 4.195 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(-c3ccsc3)cc2)s1 ZINC000278774947 1039967069 /nfs/dbraw/zinc/96/70/69/1039967069.db2.gz NIFUNLINYFNIMA-NSHDSACASA-N 1 2 315.467 4.426 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)CC(=O)c1c[nH]c2ccccc12 ZINC000165177362 1039978256 /nfs/dbraw/zinc/97/82/56/1039978256.db2.gz YYEUFIXHXPHCKN-CYBMUJFWSA-N 1 2 310.372 4.183 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)CC(=O)c1c[nH]c2ccccc12 ZINC000165177362 1039978269 /nfs/dbraw/zinc/97/82/69/1039978269.db2.gz YYEUFIXHXPHCKN-CYBMUJFWSA-N 1 2 310.372 4.183 20 0 DIADLO Fc1cccc(-c2cnc(C[N@@H+]3CCc4ccccc4C3)o2)c1 ZINC000175028466 1040001827 /nfs/dbraw/zinc/00/18/27/1040001827.db2.gz UEKQEZVKIRORCR-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1cccc(-c2cnc(C[N@H+]3CCc4ccccc4C3)o2)c1 ZINC000175028466 1040001844 /nfs/dbraw/zinc/00/18/44/1040001844.db2.gz UEKQEZVKIRORCR-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO CCCC[N@H+](Cc1cn(C(C)C)nn1)[C@H](C)c1ccc(C)o1 ZINC000685410600 1040033564 /nfs/dbraw/zinc/03/35/64/1040033564.db2.gz ISYFUXOOPRTENO-OAHLLOKOSA-N 1 2 304.438 4.124 20 0 DIADLO CCCC[N@@H+](Cc1cn(C(C)C)nn1)[C@H](C)c1ccc(C)o1 ZINC000685410600 1040033579 /nfs/dbraw/zinc/03/35/79/1040033579.db2.gz ISYFUXOOPRTENO-OAHLLOKOSA-N 1 2 304.438 4.124 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1ccc(OC)cc1Br ZINC000685414780 1040037297 /nfs/dbraw/zinc/03/72/97/1040037297.db2.gz ORUUMNGDSBSHRI-UHFFFAOYSA-N 1 2 324.218 4.073 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1ccc(OC)cc1Br ZINC000685414780 1040037318 /nfs/dbraw/zinc/03/73/18/1040037318.db2.gz ORUUMNGDSBSHRI-UHFFFAOYSA-N 1 2 324.218 4.073 20 0 DIADLO c1cn(Cc2ccc(N[C@@H]3CCC[C@H]3c3ccccc3)nc2)c[nH+]1 ZINC000685447612 1040056428 /nfs/dbraw/zinc/05/64/28/1040056428.db2.gz PKDQHAAVCCJFRJ-RBUKOAKNSA-N 1 2 318.424 4.075 20 0 DIADLO CC(C)(C)c1n[nH]cc1C[N@@H+]1CCCn2c(cc3ccccc32)C1 ZINC000685473759 1040072142 /nfs/dbraw/zinc/07/21/42/1040072142.db2.gz CDFICNQLSUAAEW-UHFFFAOYSA-N 1 2 322.456 4.068 20 0 DIADLO CC(C)(C)c1n[nH]cc1C[N@H+]1CCCn2c(cc3ccccc32)C1 ZINC000685473759 1040072159 /nfs/dbraw/zinc/07/21/59/1040072159.db2.gz CDFICNQLSUAAEW-UHFFFAOYSA-N 1 2 322.456 4.068 20 0 DIADLO Cc1ccc([C@@H](c2noc([C@@H]3C[C@H]3c3c[nH]c[nH+]3)n2)C(C)C)cc1 ZINC000924070848 1040083819 /nfs/dbraw/zinc/08/38/19/1040083819.db2.gz ZUBDERJOIIYALD-INMHGKMJSA-N 1 2 322.412 4.160 20 0 DIADLO Cc1csc(C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)n1 ZINC000115611230 1040107561 /nfs/dbraw/zinc/10/75/61/1040107561.db2.gz DQJXFJMGISDQRN-UHFFFAOYSA-N 1 2 320.364 4.280 20 0 DIADLO Cc1cc(NCc2sccc2Br)nc(C2CC2)[nH+]1 ZINC000172014783 1040118013 /nfs/dbraw/zinc/11/80/13/1040118013.db2.gz XRVGCSOXQBFXCB-UHFFFAOYSA-N 1 2 324.247 4.099 20 0 DIADLO CCC1(Cc2ccccc2)CC[NH+]([C@H](C)c2noc(C)n2)CC1 ZINC000685580454 1040141171 /nfs/dbraw/zinc/14/11/71/1040141171.db2.gz ZRSGJFOYJPHLAI-OAHLLOKOSA-N 1 2 313.445 4.174 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000685612519 1040154610 /nfs/dbraw/zinc/15/46/10/1040154610.db2.gz ITFRVAHGIUCWJT-SFHVURJKSA-N 1 2 311.816 4.251 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000685612519 1040154614 /nfs/dbraw/zinc/15/46/14/1040154614.db2.gz ITFRVAHGIUCWJT-SFHVURJKSA-N 1 2 311.816 4.251 20 0 DIADLO CSc1ccc(C[NH2+]Cc2c(F)c(F)cc(F)c2F)s1 ZINC000685617963 1040162092 /nfs/dbraw/zinc/16/20/92/1040162092.db2.gz SZLRSQYYCPADRS-UHFFFAOYSA-N 1 2 321.364 4.316 20 0 DIADLO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ncnc21)c1cc2cc(Cl)ccc2o1 ZINC000658101074 1040311856 /nfs/dbraw/zinc/31/18/56/1040311856.db2.gz KHWWBEUWJFKPPF-NRUUGDAUSA-N 1 2 316.792 4.034 20 0 DIADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ncnc21)c1cc2cc(Cl)ccc2o1 ZINC000658101075 1040312033 /nfs/dbraw/zinc/31/20/33/1040312033.db2.gz KHWWBEUWJFKPPF-OUJBWJOFSA-N 1 2 316.792 4.034 20 0 DIADLO COc1cccc(OC)c1C[NH2+][C@@H](C)c1ccc(F)cc1Cl ZINC000658120481 1040321124 /nfs/dbraw/zinc/32/11/24/1040321124.db2.gz IUQPEWZZWBQYPA-NSHDSACASA-N 1 2 323.795 4.347 20 0 DIADLO COc1ccnc(C[NH2+][C@H](CCC(C)C)c2ccoc2)c1F ZINC000658223638 1040365424 /nfs/dbraw/zinc/36/54/24/1040365424.db2.gz KZXQTRFEPPQSNY-CQSZACIVSA-N 1 2 306.381 4.089 20 0 DIADLO CCSc1ccccc1[C@@H](C)[NH2+]Cc1nccc(OC)c1F ZINC000658229031 1040368276 /nfs/dbraw/zinc/36/82/76/1040368276.db2.gz YLQQFTBVCKBTBX-GFCCVEGCSA-N 1 2 320.433 4.192 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@@H]2CCc3ccc(O)cc32)cs1 ZINC000658237494 1040380938 /nfs/dbraw/zinc/38/09/38/1040380938.db2.gz MQDFXIRLMXYQSC-XHDPSFHLSA-N 1 2 302.443 4.310 20 0 DIADLO Cc1cnc(=S)n(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000179460907 1040464402 /nfs/dbraw/zinc/46/44/02/1040464402.db2.gz AZMWWGLVMDMMQW-OAHLLOKOSA-N 1 2 319.861 4.369 20 0 DIADLO Cc1cnc(=S)n(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000179460907 1040464418 /nfs/dbraw/zinc/46/44/18/1040464418.db2.gz AZMWWGLVMDMMQW-OAHLLOKOSA-N 1 2 319.861 4.369 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]C1(c2ccccc2F)CCC1 ZINC000926635132 1040523937 /nfs/dbraw/zinc/52/39/37/1040523937.db2.gz UIPKLXZYTNTRSY-HNNXBMFYSA-N 1 2 300.377 4.169 20 0 DIADLO CO[C@H]1CCC[N@H+](Cn2c(-c3ccccc3)csc2=S)C1 ZINC000177142344 1040539319 /nfs/dbraw/zinc/53/93/19/1040539319.db2.gz KKWICZYQXLPJNK-AWEZNQCLSA-N 1 2 320.483 4.014 20 0 DIADLO CO[C@H]1CCC[N@@H+](Cn2c(-c3ccccc3)csc2=S)C1 ZINC000177142344 1040539333 /nfs/dbraw/zinc/53/93/33/1040539333.db2.gz KKWICZYQXLPJNK-AWEZNQCLSA-N 1 2 320.483 4.014 20 0 DIADLO CC(C)c1noc([C@H](C)[NH+]2CCC(c3ccccc3F)CC2)n1 ZINC000605576675 1040551147 /nfs/dbraw/zinc/55/11/47/1040551147.db2.gz YSUULZLNTHVDBK-ZDUSSCGKSA-N 1 2 317.408 4.273 20 0 DIADLO COC(=O)C[N@H+](Cc1ccccc1)Cc1cccc2ccccc21 ZINC000064628074 1040712881 /nfs/dbraw/zinc/71/28/81/1040712881.db2.gz SAMYRVYHHBKCHF-UHFFFAOYSA-N 1 2 319.404 4.015 20 0 DIADLO COC(=O)C[N@@H+](Cc1ccccc1)Cc1cccc2ccccc21 ZINC000064628074 1040712900 /nfs/dbraw/zinc/71/29/00/1040712900.db2.gz SAMYRVYHHBKCHF-UHFFFAOYSA-N 1 2 319.404 4.015 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+][C@H]1COCc2cccc(Cl)c21 ZINC000924560522 1040732238 /nfs/dbraw/zinc/73/22/38/1040732238.db2.gz XOOQOOSERDXIAC-LRDDRELGSA-N 1 2 317.816 4.271 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2nc3ccccc3s2)o1)c1ncc[nH]1 ZINC000322138743 1040792239 /nfs/dbraw/zinc/79/22/39/1040792239.db2.gz AYHVCEBCOJQHSD-NSHDSACASA-N 1 2 324.409 4.130 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc3c(s2)CCC3)c(F)c1 ZINC000414142005 1040917066 /nfs/dbraw/zinc/91/70/66/1040917066.db2.gz IRQVMZPITDFPJP-MNOVXSKESA-N 1 2 320.433 4.191 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccn(CC)n1)c1ccc(Cl)cc1Cl ZINC000414200385 1040990403 /nfs/dbraw/zinc/99/04/03/1040990403.db2.gz BBAFBFITSDPIOE-OAHLLOKOSA-N 1 2 312.244 4.451 20 0 DIADLO CC(C)[N@H+](Cc1coc(-c2cccs2)n1)Cc1ccccn1 ZINC000613494817 1041008857 /nfs/dbraw/zinc/00/88/57/1041008857.db2.gz NJPBFZRIUQUTGD-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)[N@@H+](Cc1coc(-c2cccs2)n1)Cc1ccccn1 ZINC000613494817 1041008876 /nfs/dbraw/zinc/00/88/76/1041008876.db2.gz NJPBFZRIUQUTGD-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC001625885058 1041073823 /nfs/dbraw/zinc/07/38/23/1041073823.db2.gz YTHIRJFRTDCWFJ-RTBURBONSA-N 1 2 316.404 4.016 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2Cc2cccc3ccccc32)no1 ZINC000613529420 1041101911 /nfs/dbraw/zinc/10/19/11/1041101911.db2.gz MDXBIPNHDMOKRN-SFHVURJKSA-N 1 2 307.397 4.258 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2Cc2cccc3ccccc32)no1 ZINC000613529420 1041101923 /nfs/dbraw/zinc/10/19/23/1041101923.db2.gz MDXBIPNHDMOKRN-SFHVURJKSA-N 1 2 307.397 4.258 20 0 DIADLO CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1csnn1)CCC2 ZINC000414305244 1041102368 /nfs/dbraw/zinc/10/23/68/1041102368.db2.gz PUEAENVSDXVTHN-BLLLJJGKSA-N 1 2 301.459 4.390 20 0 DIADLO CC(C)CC[C@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccoc1 ZINC000414335059 1041141860 /nfs/dbraw/zinc/14/18/60/1041141860.db2.gz XUEYURRIMBWRNF-AWEZNQCLSA-N 1 2 305.447 4.276 20 0 DIADLO CCCCCC[C@H](CC)[NH2+][C@H](C(=O)OC)[C@@H](C)OC(C)(C)C ZINC001170578783 1041158514 /nfs/dbraw/zinc/15/85/14/1041158514.db2.gz KIWCPJDXOWHVLV-PMPSAXMXSA-N 1 2 315.498 4.070 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccc(Cl)cc2)no1)c1ccccc1 ZINC000007335655 1041181295 /nfs/dbraw/zinc/18/12/95/1041181295.db2.gz MQKGQPXSYWEWAB-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO CCCCn1c(S[C@@H]2C=CCCC2)nnc1[C@@H](CC)[NH+](C)C ZINC000176537504 1041184457 /nfs/dbraw/zinc/18/44/57/1041184457.db2.gz CLNVFUSWUCASFP-HUUCEWRRSA-N 1 2 322.522 4.292 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2C/C=C\c2ccc(F)c(F)c2)no1 ZINC000809546646 1041188920 /nfs/dbraw/zinc/18/89/20/1041188920.db2.gz BYMADGFKMQSOQX-POKLJVKSSA-N 1 2 304.340 4.112 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2C/C=C\c2ccc(F)c(F)c2)no1 ZINC000809546646 1041188930 /nfs/dbraw/zinc/18/89/30/1041188930.db2.gz BYMADGFKMQSOQX-POKLJVKSSA-N 1 2 304.340 4.112 20 0 DIADLO Cc1ccc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)nn1 ZINC000414374392 1041192060 /nfs/dbraw/zinc/19/20/60/1041192060.db2.gz VHYPDPAIYFVNCS-CYBMUJFWSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1ccc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)nn1 ZINC000414374392 1041192064 /nfs/dbraw/zinc/19/20/64/1041192064.db2.gz VHYPDPAIYFVNCS-CYBMUJFWSA-N 1 2 301.821 4.164 20 0 DIADLO CCc1noc(C)c1C[N@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000342278266 1041221347 /nfs/dbraw/zinc/22/13/47/1041221347.db2.gz WBGKSRAEFFWJFR-MLGOLLRUSA-N 1 2 314.429 4.426 20 0 DIADLO CCc1noc(C)c1C[N@@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000342278266 1041221365 /nfs/dbraw/zinc/22/13/65/1041221365.db2.gz WBGKSRAEFFWJFR-MLGOLLRUSA-N 1 2 314.429 4.426 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2c(Cl)nc(Cl)n2C)C1 ZINC000809716844 1041233229 /nfs/dbraw/zinc/23/32/29/1041233229.db2.gz ZRQHSVLJGWBMDM-WCQYABFASA-N 1 2 324.255 4.310 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2)[N@@H+](Cc2c(Cl)nc(Cl)n2C)C1 ZINC000809716844 1041233245 /nfs/dbraw/zinc/23/32/45/1041233245.db2.gz ZRQHSVLJGWBMDM-WCQYABFASA-N 1 2 324.255 4.310 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1cc(-n3ccnc3)cs1)C2 ZINC000809770967 1041236462 /nfs/dbraw/zinc/23/64/62/1041236462.db2.gz BYLZCEDSULWVJW-UHFFFAOYSA-N 1 2 315.829 4.103 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1cc(-n3ccnc3)cs1)C2 ZINC000809770967 1041236472 /nfs/dbraw/zinc/23/64/72/1041236472.db2.gz BYLZCEDSULWVJW-UHFFFAOYSA-N 1 2 315.829 4.103 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2ccc(Cl)cc2)cs1 ZINC000177637318 1041284946 /nfs/dbraw/zinc/28/49/46/1041284946.db2.gz WOAPGJMIOWAWNU-GHMZBOCLSA-N 1 2 310.850 4.355 20 0 DIADLO Cl/C=C(\Cl)C[N@@H+]1CC[C@@H](Oc2ccc(Cl)cc2)C1 ZINC001170594941 1041298621 /nfs/dbraw/zinc/29/86/21/1041298621.db2.gz ZGRMENSAQSCEBQ-LWMSPQMPSA-N 1 2 306.620 4.112 20 0 DIADLO Cl/C=C(\Cl)C[N@H+]1CC[C@@H](Oc2ccc(Cl)cc2)C1 ZINC001170594941 1041298639 /nfs/dbraw/zinc/29/86/39/1041298639.db2.gz ZGRMENSAQSCEBQ-LWMSPQMPSA-N 1 2 306.620 4.112 20 0 DIADLO C[C@@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1cnn(C2CCC2)c1 ZINC000926810642 1041311761 /nfs/dbraw/zinc/31/17/61/1041311761.db2.gz UNEJWOKCCNSMEV-SJKOYZFVSA-N 1 2 305.372 4.109 20 0 DIADLO COc1ccc([NH2+]C[C@H]2CC(C)=C[C@H](C)C2)c(OC)c1OC ZINC000810149896 1041324641 /nfs/dbraw/zinc/32/46/41/1041324641.db2.gz WTFMEEXUDCKZNZ-GXTWGEPZSA-N 1 2 305.418 4.117 20 0 DIADLO CCCCCC[C@H](CC)[N@@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001170600057 1041331195 /nfs/dbraw/zinc/33/11/95/1041331195.db2.gz QRURDTRRJXPHAA-HOTGVXAUSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCCC[C@H](CC)[N@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001170600057 1041331213 /nfs/dbraw/zinc/33/12/13/1041331213.db2.gz QRURDTRRJXPHAA-HOTGVXAUSA-N 1 2 307.482 4.155 20 0 DIADLO CC(C)(C)[C@H]([NH2+]Cc1nc(C(F)F)no1)c1cccc(F)c1 ZINC000425465046 1041344941 /nfs/dbraw/zinc/34/49/41/1041344941.db2.gz YTJQWDOBVLYREO-GFCCVEGCSA-N 1 2 313.323 4.023 20 0 DIADLO Clc1cc(CN2CCC[C@H](n3cc[nH+]c3)C2)c(Cl)s1 ZINC000648366951 1041348961 /nfs/dbraw/zinc/34/89/61/1041348961.db2.gz VQYCQGUYYDCSLI-NSHDSACASA-N 1 2 316.257 4.089 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2nc3ccccc3[nH]2)C(C)C)sc1C ZINC000892722027 1041385643 /nfs/dbraw/zinc/38/56/43/1041385643.db2.gz WCWNAGILNMIBLH-INIZCTEOSA-N 1 2 314.458 4.123 20 0 DIADLO Fc1ccc(C[NH2+]Cc2csc(C(F)(F)F)n2)cc1Cl ZINC000892791874 1041402359 /nfs/dbraw/zinc/40/23/59/1041402359.db2.gz QIHHFXJXFLWEML-UHFFFAOYSA-N 1 2 324.730 4.244 20 0 DIADLO CCN(CC)c1ccc(N[C@H](C)c2sc(C)nc2C)c[nH+]1 ZINC000111360730 1041404530 /nfs/dbraw/zinc/40/45/30/1041404530.db2.gz ZAAHRJIBCCYGPB-GFCCVEGCSA-N 1 2 304.463 4.174 20 0 DIADLO CCOc1ccc(F)c(F)c1C[N@@H+]1CCC(F)(F)C(C)(C)C1 ZINC001143489210 1041406384 /nfs/dbraw/zinc/40/63/84/1041406384.db2.gz ZGTQYCHSNHDKKN-UHFFFAOYSA-N 1 2 319.342 4.231 20 0 DIADLO CCOc1ccc(F)c(F)c1C[N@H+]1CCC(F)(F)C(C)(C)C1 ZINC001143489210 1041406387 /nfs/dbraw/zinc/40/63/87/1041406387.db2.gz ZGTQYCHSNHDKKN-UHFFFAOYSA-N 1 2 319.342 4.231 20 0 DIADLO CCc1nnc(C[NH2+]Cc2cccc(-c3cccc(C)c3)c2)s1 ZINC000892808590 1041406532 /nfs/dbraw/zinc/40/65/32/1041406532.db2.gz CABPVPJIQMRPBS-UHFFFAOYSA-N 1 2 323.465 4.366 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+]2CCC[C@H]2c2ccsc2)n1 ZINC000613670586 1041419583 /nfs/dbraw/zinc/41/95/83/1041419583.db2.gz HRZUZZCOQFTWOV-JSGCOSHPSA-N 1 2 305.447 4.372 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+]2CCC[C@H]2c2ccsc2)n1 ZINC000613670586 1041419590 /nfs/dbraw/zinc/41/95/90/1041419590.db2.gz HRZUZZCOQFTWOV-JSGCOSHPSA-N 1 2 305.447 4.372 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)NC[C@H]1c2ccccc2C[N@H+]1C ZINC001132405727 1041426698 /nfs/dbraw/zinc/42/66/98/1041426698.db2.gz XEVQWAVVAPWVIJ-AZUAARDMSA-N 1 2 316.489 4.286 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)NC[C@H]1c2ccccc2C[N@@H+]1C ZINC001132405727 1041426704 /nfs/dbraw/zinc/42/67/04/1041426704.db2.gz XEVQWAVVAPWVIJ-AZUAARDMSA-N 1 2 316.489 4.286 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)NC[C@H]1c2ccccc2C[N@H+]1C ZINC001132405728 1041426807 /nfs/dbraw/zinc/42/68/07/1041426807.db2.gz XEVQWAVVAPWVIJ-ICSRJNTNSA-N 1 2 316.489 4.286 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)NC[C@H]1c2ccccc2C[N@@H+]1C ZINC001132405728 1041426810 /nfs/dbraw/zinc/42/68/10/1041426810.db2.gz XEVQWAVVAPWVIJ-ICSRJNTNSA-N 1 2 316.489 4.286 20 0 DIADLO C[C@H](c1ccc([S@](C)=O)cc1)[N@H+](C)Cc1ccccc1Cl ZINC000175391007 1041441038 /nfs/dbraw/zinc/44/10/38/1041441038.db2.gz FGDOKJDHVYWCAK-ASSNKEHSSA-N 1 2 321.873 4.270 20 0 DIADLO C[C@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)Cc1ccccc1Cl ZINC000175391007 1041441042 /nfs/dbraw/zinc/44/10/42/1041441042.db2.gz FGDOKJDHVYWCAK-ASSNKEHSSA-N 1 2 321.873 4.270 20 0 DIADLO CC1(C)CC(Nc2cc3cc(F)ccc3c[nH+]2)CC(C)(C)N1O ZINC001167719854 1041448886 /nfs/dbraw/zinc/44/88/86/1041448886.db2.gz PIPGGYOQWZGAKC-UHFFFAOYSA-N 1 2 317.408 4.197 20 0 DIADLO CC[N@H+](Cc1ccncc1)[C@@H](C)c1nc(-c2ccccc2C)no1 ZINC000270988242 1041483568 /nfs/dbraw/zinc/48/35/68/1041483568.db2.gz HSSYHUIJUKIIJI-HNNXBMFYSA-N 1 2 322.412 4.023 20 0 DIADLO CC[N@@H+](Cc1ccncc1)[C@@H](C)c1nc(-c2ccccc2C)no1 ZINC000270988242 1041483577 /nfs/dbraw/zinc/48/35/77/1041483577.db2.gz HSSYHUIJUKIIJI-HNNXBMFYSA-N 1 2 322.412 4.023 20 0 DIADLO CCCCCC[C@H](CC)C(=O)NC[C@@H]1c2ccccc2C[N@H+]1C ZINC001132625163 1041483622 /nfs/dbraw/zinc/48/36/22/1041483622.db2.gz ZIUXDCKJHNBGMA-QFBILLFUSA-N 1 2 316.489 4.286 20 0 DIADLO CCCCCC[C@H](CC)C(=O)NC[C@@H]1c2ccccc2C[N@@H+]1C ZINC001132625163 1041483627 /nfs/dbraw/zinc/48/36/27/1041483627.db2.gz ZIUXDCKJHNBGMA-QFBILLFUSA-N 1 2 316.489 4.286 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1cscn1 ZINC000271024126 1041491006 /nfs/dbraw/zinc/49/10/06/1041491006.db2.gz AVKCPPADSKRZTL-UONOGXRCSA-N 1 2 304.459 4.480 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC[C@H](C3CCC3)CC2)c(C)[nH+]1 ZINC001132683762 1041494121 /nfs/dbraw/zinc/49/41/21/1041494121.db2.gz SZPUUOCGMHBVFA-KRWDZBQOSA-N 1 2 300.446 4.049 20 0 DIADLO C[C@H]1CCC[C@]1(C)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000651201703 1041499884 /nfs/dbraw/zinc/49/98/84/1041499884.db2.gz XOSRJKYTVQCZIM-LIRRHRJNSA-N 1 2 322.412 4.059 20 0 DIADLO Cc1cc(N2C[C@@H](C)C[C@H]2c2cccnc2)nc(C2CCC2)[nH+]1 ZINC000893155391 1041507153 /nfs/dbraw/zinc/50/71/53/1041507153.db2.gz HSESGVQDNNTBKQ-GUYCJALGSA-N 1 2 308.429 4.035 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2ccc(F)cc21)c1nc(C(C)(C)C)no1 ZINC000179754763 1041517791 /nfs/dbraw/zinc/51/77/91/1041517791.db2.gz GFGZYDDBDDQDED-IAQYHMDHSA-N 1 2 317.408 4.234 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ccnc(Cl)c2Cl)c1 ZINC000811454171 1041518723 /nfs/dbraw/zinc/51/87/23/1041518723.db2.gz XCQGBFADCGBWQK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ccnc(Cl)c2Cl)c1 ZINC000811454171 1041518726 /nfs/dbraw/zinc/51/87/26/1041518726.db2.gz XCQGBFADCGBWQK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccnc(Cl)c1Cl ZINC000811498566 1041525996 /nfs/dbraw/zinc/52/59/96/1041525996.db2.gz YRIUKDXKQPJLIC-IONNQARKSA-N 1 2 313.150 4.161 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccnc(Cl)c1Cl ZINC000811498566 1041526001 /nfs/dbraw/zinc/52/60/01/1041526001.db2.gz YRIUKDXKQPJLIC-IONNQARKSA-N 1 2 313.150 4.161 20 0 DIADLO CC[C@H]([NH2+]Cc1ccnc(Cl)c1Cl)c1nccs1 ZINC000811481010 1041529029 /nfs/dbraw/zinc/52/90/29/1041529029.db2.gz MCJSPDJNJYRBEN-VIFPVBQESA-N 1 2 302.230 4.086 20 0 DIADLO CSc1ccc(C[N@@H+]2CCC(C)=C(Br)C2)s1 ZINC000811500991 1041531833 /nfs/dbraw/zinc/53/18/33/1041531833.db2.gz BXJIIESXEULTCZ-UHFFFAOYSA-N 1 2 318.305 4.345 20 0 DIADLO CSc1ccc(C[N@H+]2CCC(C)=C(Br)C2)s1 ZINC000811500991 1041531838 /nfs/dbraw/zinc/53/18/38/1041531838.db2.gz BXJIIESXEULTCZ-UHFFFAOYSA-N 1 2 318.305 4.345 20 0 DIADLO CC(C)C[C@H]1CCCCC[N@@H+]1Cc1nnc(C(F)(F)F)s1 ZINC000659946619 1041554777 /nfs/dbraw/zinc/55/47/77/1041554777.db2.gz HSAMHMJVUDIRMZ-LLVKDONJSA-N 1 2 321.412 4.348 20 0 DIADLO CC(C)C[C@H]1CCCCC[N@H+]1Cc1nnc(C(F)(F)F)s1 ZINC000659946619 1041554785 /nfs/dbraw/zinc/55/47/85/1041554785.db2.gz HSAMHMJVUDIRMZ-LLVKDONJSA-N 1 2 321.412 4.348 20 0 DIADLO Cc1nc(C[N@@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)co1 ZINC000659962222 1041562623 /nfs/dbraw/zinc/56/26/23/1041562623.db2.gz URXVCAPQGUHIPE-HXUWFJFHSA-N 1 2 304.393 4.283 20 0 DIADLO Cc1nc(C[N@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)co1 ZINC000659962222 1041562628 /nfs/dbraw/zinc/56/26/28/1041562628.db2.gz URXVCAPQGUHIPE-HXUWFJFHSA-N 1 2 304.393 4.283 20 0 DIADLO Clc1cccc([C@@H]([NH2+]Cc2cncs2)c2ccccn2)c1 ZINC000136350402 1041565242 /nfs/dbraw/zinc/56/52/42/1041565242.db2.gz WXZYATGQBXUYQB-MRXNPFEDSA-N 1 2 315.829 4.071 20 0 DIADLO COc1cc(C)c([C@@H](C)Nc2ccc([NH+](C)C)cc2)cc1OC ZINC000182495911 1041568636 /nfs/dbraw/zinc/56/86/36/1041568636.db2.gz PJNGTTYAWDYTNQ-CQSZACIVSA-N 1 2 314.429 4.251 20 0 DIADLO CCc1ccc(C[N@H+](Cc2nc(-c3ccco3)no2)C2CC2)cc1 ZINC000042146734 1041580219 /nfs/dbraw/zinc/58/02/19/1041580219.db2.gz AOOUZVOESNAIIS-UHFFFAOYSA-N 1 2 323.396 4.057 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2nc(-c3ccco3)no2)C2CC2)cc1 ZINC000042146734 1041580225 /nfs/dbraw/zinc/58/02/25/1041580225.db2.gz AOOUZVOESNAIIS-UHFFFAOYSA-N 1 2 323.396 4.057 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3Cl)C2)co1 ZINC001206074785 1041585724 /nfs/dbraw/zinc/58/57/24/1041585724.db2.gz VBJXZBUYARDREB-LLVKDONJSA-N 1 2 311.212 4.279 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3Cl)C2)co1 ZINC001206074785 1041585730 /nfs/dbraw/zinc/58/57/30/1041585730.db2.gz VBJXZBUYARDREB-LLVKDONJSA-N 1 2 311.212 4.279 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)c(C)o1 ZINC000660038430 1041589162 /nfs/dbraw/zinc/58/91/62/1041589162.db2.gz VJHQMYFHNHSWGT-UHFFFAOYSA-N 1 2 311.212 4.377 20 0 DIADLO CC[N@H+](C[C@@H](C)OC)Cn1c(-c2ccccc2)csc1=S ZINC000812302409 1041615560 /nfs/dbraw/zinc/61/55/60/1041615560.db2.gz BXIVNRRGMBCVMD-CYBMUJFWSA-N 1 2 322.499 4.260 20 0 DIADLO CC[N@@H+](C[C@@H](C)OC)Cn1c(-c2ccccc2)csc1=S ZINC000812302409 1041615564 /nfs/dbraw/zinc/61/55/64/1041615564.db2.gz BXIVNRRGMBCVMD-CYBMUJFWSA-N 1 2 322.499 4.260 20 0 DIADLO CC[N@H+](C[C@H](C)OC)Cn1c(-c2ccccc2)csc1=S ZINC000812302414 1041615616 /nfs/dbraw/zinc/61/56/16/1041615616.db2.gz BXIVNRRGMBCVMD-ZDUSSCGKSA-N 1 2 322.499 4.260 20 0 DIADLO CC[N@@H+](C[C@H](C)OC)Cn1c(-c2ccccc2)csc1=S ZINC000812302414 1041615618 /nfs/dbraw/zinc/61/56/18/1041615618.db2.gz BXIVNRRGMBCVMD-ZDUSSCGKSA-N 1 2 322.499 4.260 20 0 DIADLO CCc1nocc1C[N@@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC000660104050 1041615667 /nfs/dbraw/zinc/61/56/67/1041615667.db2.gz LGUCTQJQFPJHEB-KRWDZBQOSA-N 1 2 306.356 4.242 20 0 DIADLO CCc1nocc1C[N@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC000660104050 1041615669 /nfs/dbraw/zinc/61/56/69/1041615669.db2.gz LGUCTQJQFPJHEB-KRWDZBQOSA-N 1 2 306.356 4.242 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nnc(C(F)(F)F)s2)c(C)s1 ZINC000660178526 1041650177 /nfs/dbraw/zinc/65/01/77/1041650177.db2.gz LYZXDRUIKDGXEM-ZETCQYMHSA-N 1 2 321.393 4.086 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+]Cc2coc(C)n2)cc1OC ZINC000660187585 1041656801 /nfs/dbraw/zinc/65/68/01/1041656801.db2.gz OASLXOFMHUQXEQ-CYBMUJFWSA-N 1 2 318.417 4.021 20 0 DIADLO c1ccc(COc2cc(NC3(C4CCOCC4)CC3)cc[nH+]2)cc1 ZINC001167743530 1041666577 /nfs/dbraw/zinc/66/65/77/1041666577.db2.gz IPIHOHJAPKMHPG-UHFFFAOYSA-N 1 2 324.424 4.032 20 0 DIADLO O=C(CCCC1CC1)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000813097146 1041672508 /nfs/dbraw/zinc/67/25/08/1041672508.db2.gz BMFMXZUSCUNVQO-UHFFFAOYSA-N 1 2 324.424 4.372 20 0 DIADLO COc1cc(F)cc(CNc2ccc([NH+]3CCCC3)cc2)c1 ZINC000312499575 1041675669 /nfs/dbraw/zinc/67/56/69/1041675669.db2.gz GDHORPGFSXWIQD-UHFFFAOYSA-N 1 2 300.377 4.047 20 0 DIADLO CCc1ccc(-c2ccc(C(=O)Nc3c(C)c[nH+]cc3C)o2)cc1 ZINC001133682478 1041690071 /nfs/dbraw/zinc/69/00/71/1041690071.db2.gz ZXBLIEFVWQPHQJ-UHFFFAOYSA-N 1 2 320.392 4.195 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2cc(F)ccc2OC(F)F)n1 ZINC000660266835 1041697325 /nfs/dbraw/zinc/69/73/25/1041697325.db2.gz UGRZHKUHGCHOHZ-SECBINFHSA-N 1 2 316.348 4.043 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2cc(F)ccc2OC(F)F)n1 ZINC000660266836 1041697819 /nfs/dbraw/zinc/69/78/19/1041697819.db2.gz UGRZHKUHGCHOHZ-VIFPVBQESA-N 1 2 316.348 4.043 20 0 DIADLO CCn1c[nH+]cc1CNc1cccc(CSC(C)C)c1C ZINC000417812159 1041703032 /nfs/dbraw/zinc/70/30/32/1041703032.db2.gz PHKLHRHGCGSUBW-UHFFFAOYSA-N 1 2 303.475 4.465 20 0 DIADLO CCn1c[nH+]cc1CNc1cc(F)ccc1SCC(F)F ZINC000417847890 1041706382 /nfs/dbraw/zinc/70/63/82/1041706382.db2.gz ZWXALJPBTIUHDE-UHFFFAOYSA-N 1 2 315.364 4.011 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(NCc2cccc3ccnn32)c1 ZINC001170708358 1041717581 /nfs/dbraw/zinc/71/75/81/1041717581.db2.gz WTILPHZZCMYVOM-UHFFFAOYSA-N 1 2 308.429 4.101 20 0 DIADLO CCc1nc(C)c([C@H](C)[NH2+][C@@H]2COc3cc(F)cc(F)c32)s1 ZINC000364311237 1041739984 /nfs/dbraw/zinc/73/99/84/1041739984.db2.gz JQEHIEYRPZWFHN-QPUJVOFHSA-N 1 2 324.396 4.076 20 0 DIADLO CCc1nc(C[N@H+]2CC=C(c3ccc(Cl)nc3)CC2)cs1 ZINC000364306918 1041740285 /nfs/dbraw/zinc/74/02/85/1041740285.db2.gz RKYYFTAEKMNOKQ-UHFFFAOYSA-N 1 2 319.861 4.043 20 0 DIADLO CCc1nc(C[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)cs1 ZINC000364306918 1041740292 /nfs/dbraw/zinc/74/02/92/1041740292.db2.gz RKYYFTAEKMNOKQ-UHFFFAOYSA-N 1 2 319.861 4.043 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c1 ZINC001137996539 1041759874 /nfs/dbraw/zinc/75/98/74/1041759874.db2.gz WDKOXMWAYPUWRS-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)c1 ZINC001137996539 1041759877 /nfs/dbraw/zinc/75/98/77/1041759877.db2.gz WDKOXMWAYPUWRS-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO CCOC(=O)C[N@H+](Cc1cc(Cl)cc(Cl)c1)C(C)(C)C ZINC001167759441 1041776877 /nfs/dbraw/zinc/77/68/77/1041776877.db2.gz DUBRBXDUKJLXAU-UHFFFAOYSA-N 1 2 318.244 4.157 20 0 DIADLO CCOC(=O)C[N@@H+](Cc1cc(Cl)cc(Cl)c1)C(C)(C)C ZINC001167759441 1041776881 /nfs/dbraw/zinc/77/68/81/1041776881.db2.gz DUBRBXDUKJLXAU-UHFFFAOYSA-N 1 2 318.244 4.157 20 0 DIADLO Fc1cccc(F)c1-c1ncc(C[N@H+]2CCC[C@H](F)C2)s1 ZINC000652076008 1041780608 /nfs/dbraw/zinc/78/06/08/1041780608.db2.gz IWHRFPFYQNJTSU-JTQLQIEISA-N 1 2 312.360 4.022 20 0 DIADLO Fc1cccc(F)c1-c1ncc(C[N@@H+]2CCC[C@H](F)C2)s1 ZINC000652076008 1041780611 /nfs/dbraw/zinc/78/06/11/1041780611.db2.gz IWHRFPFYQNJTSU-JTQLQIEISA-N 1 2 312.360 4.022 20 0 DIADLO C[C@H](CC(=O)Nc1cccc2c1[C@H](C)CC2(C)C)n1cc[nH+]c1 ZINC001134154343 1041786313 /nfs/dbraw/zinc/78/63/13/1041786313.db2.gz HONNWQIXHKZQFF-ZIAGYGMSSA-N 1 2 311.429 4.258 20 0 DIADLO C[C@H](Nc1cc2c3c(c1)CCC[NH+]3CCC2)c1cccc(N)c1 ZINC001170733195 1041790357 /nfs/dbraw/zinc/79/03/57/1041790357.db2.gz JSIKJZYQAWBMAP-AWEZNQCLSA-N 1 2 307.441 4.141 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@@H](F)C2)cc(C(F)(F)F)c1 ZINC001143511728 1041810798 /nfs/dbraw/zinc/81/07/98/1041810798.db2.gz IQAVBZPELOURFL-CYBMUJFWSA-N 1 2 305.315 4.038 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@@H](F)C2)cc(C(F)(F)F)c1 ZINC001143511728 1041810810 /nfs/dbraw/zinc/81/08/10/1041810810.db2.gz IQAVBZPELOURFL-CYBMUJFWSA-N 1 2 305.315 4.038 20 0 DIADLO Cc1nc(C[NH+]2CCC(F)(c3ccc(Cl)cc3)CC2)co1 ZINC000660469494 1041812989 /nfs/dbraw/zinc/81/29/89/1041812989.db2.gz ZLAICVCQDFWMSG-UHFFFAOYSA-N 1 2 308.784 4.097 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccsc2C(F)(F)F)c(C)[nH+]1 ZINC000636582135 1041822984 /nfs/dbraw/zinc/82/29/84/1041822984.db2.gz VQWFUEMSUDJWOL-UHFFFAOYSA-N 1 2 314.332 4.339 20 0 DIADLO C[C@H]1C[N@H+](Cc2ncccc2C(F)(F)F)[C@@H]1c1ccccc1 ZINC000093867425 1041836429 /nfs/dbraw/zinc/83/64/29/1041836429.db2.gz HEEGVJAWQCNSNQ-LRDDRELGSA-N 1 2 306.331 4.293 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ncccc2C(F)(F)F)[C@@H]1c1ccccc1 ZINC000093867425 1041836434 /nfs/dbraw/zinc/83/64/34/1041836434.db2.gz HEEGVJAWQCNSNQ-LRDDRELGSA-N 1 2 306.331 4.293 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2nc3cc(Cl)ccc3[nH]2)nc1 ZINC000660710075 1041855450 /nfs/dbraw/zinc/85/54/50/1041855450.db2.gz JJVWZAGAQIJHOE-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2nc3cc(Cl)ccc3[nH]2)nc1 ZINC000660710075 1041855456 /nfs/dbraw/zinc/85/54/56/1041855456.db2.gz JJVWZAGAQIJHOE-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@H+](Cc1cc2cnccc2o1)CC3 ZINC000651619253 1041858068 /nfs/dbraw/zinc/85/80/68/1041858068.db2.gz OHWBKBHWIUDFMM-UHFFFAOYSA-N 1 2 317.392 4.176 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](Cc1cc2cnccc2o1)CC3 ZINC000651619253 1041858070 /nfs/dbraw/zinc/85/80/70/1041858070.db2.gz OHWBKBHWIUDFMM-UHFFFAOYSA-N 1 2 317.392 4.176 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)[nH]1 ZINC000660767389 1041858887 /nfs/dbraw/zinc/85/88/87/1041858887.db2.gz QVZOXORYCPQSKK-RHSMWYFYSA-N 1 2 310.445 4.045 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)[nH]1 ZINC000660767389 1041858896 /nfs/dbraw/zinc/85/88/96/1041858896.db2.gz QVZOXORYCPQSKK-RHSMWYFYSA-N 1 2 310.445 4.045 20 0 DIADLO C[N@H+](C[C@H]1CCCCC1(C)C)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660764307 1041860789 /nfs/dbraw/zinc/86/07/89/1041860789.db2.gz JDKYVOYYWSXUIJ-IAGOWNOFSA-N 1 2 312.461 4.042 20 0 DIADLO C[N@@H+](C[C@H]1CCCCC1(C)C)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660764307 1041860798 /nfs/dbraw/zinc/86/07/98/1041860798.db2.gz JDKYVOYYWSXUIJ-IAGOWNOFSA-N 1 2 312.461 4.042 20 0 DIADLO CCc1cc(C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)on1 ZINC000651664678 1041871315 /nfs/dbraw/zinc/87/13/15/1041871315.db2.gz XXCZLJDUYADYMO-CQSZACIVSA-N 1 2 307.397 4.150 20 0 DIADLO FC(F)(F)c1nnc(C[N@@H+]2CCC[C@@H]2CC2CCCC2)s1 ZINC000660925217 1041872699 /nfs/dbraw/zinc/87/26/99/1041872699.db2.gz AATKYTUQUARBQS-LLVKDONJSA-N 1 2 319.396 4.102 20 0 DIADLO FC(F)(F)c1nnc(C[N@H+]2CCC[C@@H]2CC2CCCC2)s1 ZINC000660925217 1041872707 /nfs/dbraw/zinc/87/27/07/1041872707.db2.gz AATKYTUQUARBQS-LLVKDONJSA-N 1 2 319.396 4.102 20 0 DIADLO CC(C)c1nc(C[NH2+]Cc2coc3ccccc23)c2ccccn21 ZINC000651714284 1041890289 /nfs/dbraw/zinc/89/02/89/1041890289.db2.gz WYEQQXSALBHMRW-UHFFFAOYSA-N 1 2 319.408 4.494 20 0 DIADLO CCO[C@@H](C)c1noc(C[N@H+](Cc2ccsc2)C(C)(C)C)n1 ZINC000661136216 1041892592 /nfs/dbraw/zinc/89/25/92/1041892592.db2.gz OUCMEJWBDRDGLI-LBPRGKRZSA-N 1 2 323.462 4.029 20 0 DIADLO CCO[C@@H](C)c1noc(C[N@@H+](Cc2ccsc2)C(C)(C)C)n1 ZINC000661136216 1041892600 /nfs/dbraw/zinc/89/26/00/1041892600.db2.gz OUCMEJWBDRDGLI-LBPRGKRZSA-N 1 2 323.462 4.029 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncc(CSC)s1)c1ccccc1OC ZINC000815115435 1041915412 /nfs/dbraw/zinc/91/54/12/1041915412.db2.gz ZUGPNJPGNNBUGB-CQSZACIVSA-N 1 2 322.499 4.256 20 0 DIADLO c1ccc(-c2nnc(C[NH2+]Cc3ccc(C4CCC4)cc3)[nH]2)cc1 ZINC000815126184 1041916841 /nfs/dbraw/zinc/91/68/41/1041916841.db2.gz IBKHMKNUYSOVBH-UHFFFAOYSA-N 1 2 318.424 4.029 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3sccc3F)c2)[nH+]c1C ZINC000815098486 1041917720 /nfs/dbraw/zinc/91/77/20/1041917720.db2.gz HDBAWUXMBXOUJB-UHFFFAOYSA-N 1 2 315.373 4.146 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2ccccc2OCC2CC2)c(F)c1 ZINC000815151866 1041920007 /nfs/dbraw/zinc/92/00/07/1041920007.db2.gz DFAVWKQHCTUFRV-UHFFFAOYSA-N 1 2 321.342 4.183 20 0 DIADLO COc1ccc2oc(C[NH2+]Cc3c(F)cc(F)cc3F)cc2c1 ZINC000815152185 1041921265 /nfs/dbraw/zinc/92/12/65/1041921265.db2.gz ITJGRTHGJXJGFE-UHFFFAOYSA-N 1 2 321.298 4.149 20 0 DIADLO CCCc1ncc(C[NH2+][C@@H]2CCc3ccc(F)c(Cl)c32)o1 ZINC000651823429 1041922680 /nfs/dbraw/zinc/92/26/80/1041922680.db2.gz IHXATWHHUBDUAV-CYBMUJFWSA-N 1 2 308.784 4.197 20 0 DIADLO Clc1ccc2c(c1Cl)C[N@@H+](CCc1cscn1)CC2 ZINC000661374326 1041926705 /nfs/dbraw/zinc/92/67/05/1041926705.db2.gz VQCDOIUHRRDYTG-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO Clc1ccc2c(c1Cl)C[N@H+](CCc1cscn1)CC2 ZINC000661374326 1041926714 /nfs/dbraw/zinc/92/67/14/1041926714.db2.gz VQCDOIUHRRDYTG-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO CC(C)(C)n1cc(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccco2)cn1 ZINC000661432288 1041936447 /nfs/dbraw/zinc/93/64/47/1041936447.db2.gz BZYKECLVHAXLPZ-QGZVFWFLSA-N 1 2 313.445 4.348 20 0 DIADLO CC(C)(C)n1cc(C[N@H+]2CC3(CCCC3)[C@H]2c2ccco2)cn1 ZINC000661432288 1041936450 /nfs/dbraw/zinc/93/64/50/1041936450.db2.gz BZYKECLVHAXLPZ-QGZVFWFLSA-N 1 2 313.445 4.348 20 0 DIADLO Clc1ccc(C[N@@H+]2CC3(CCOCC3)[C@H]2c2ccco2)s1 ZINC000661559618 1041952924 /nfs/dbraw/zinc/95/29/24/1041952924.db2.gz ADSSCLAVENIRPN-OAHLLOKOSA-N 1 2 323.845 4.348 20 0 DIADLO Clc1ccc(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccco2)s1 ZINC000661559618 1041952928 /nfs/dbraw/zinc/95/29/28/1041952928.db2.gz ADSSCLAVENIRPN-OAHLLOKOSA-N 1 2 323.845 4.348 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)cn2)cc1F ZINC000661660597 1041966436 /nfs/dbraw/zinc/96/64/36/1041966436.db2.gz SBFRDADPFDCMGA-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)cn2)cc1F ZINC000661660597 1041966439 /nfs/dbraw/zinc/96/64/39/1041966439.db2.gz SBFRDADPFDCMGA-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO Brc1nc(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)cs1 ZINC001137583566 1041993247 /nfs/dbraw/zinc/99/32/47/1041993247.db2.gz ZHPCONMEMHRYSG-PWSUYJOCSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1nc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)cs1 ZINC001137583566 1041993252 /nfs/dbraw/zinc/99/32/52/1041993252.db2.gz ZHPCONMEMHRYSG-PWSUYJOCSA-N 1 2 315.280 4.060 20 0 DIADLO COCc1cc[nH+]c(N[C@H](c2cccnc2)C2CCCCC2)c1 ZINC000652331905 1042012442 /nfs/dbraw/zinc/01/24/42/1042012442.db2.gz XZHVCICLLZNWDD-IBGZPJMESA-N 1 2 311.429 4.357 20 0 DIADLO COc1cccc(C2([NH2+]Cc3cc(C(C)(C)C)on3)CCC2)c1 ZINC000662111661 1042066839 /nfs/dbraw/zinc/06/68/39/1042066839.db2.gz WJNHOKPCUPVMQU-UHFFFAOYSA-N 1 2 314.429 4.150 20 0 DIADLO CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ncc(Br)s1 ZINC000662160882 1042074714 /nfs/dbraw/zinc/07/47/14/1042074714.db2.gz OHVWFSKCHCBGHS-VHSXEESVSA-N 1 2 303.269 4.059 20 0 DIADLO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1ncc(Br)s1 ZINC000662160882 1042074718 /nfs/dbraw/zinc/07/47/18/1042074718.db2.gz OHVWFSKCHCBGHS-VHSXEESVSA-N 1 2 303.269 4.059 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(C(F)F)cc2)C[C@@H](CC(F)(F)F)O1 ZINC000662238965 1042097051 /nfs/dbraw/zinc/09/70/51/1042097051.db2.gz XEZWYVMHAGZCSW-GXFFZTMASA-N 1 2 323.305 4.166 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(C(F)F)cc2)C[C@@H](CC(F)(F)F)O1 ZINC000662238965 1042097055 /nfs/dbraw/zinc/09/70/55/1042097055.db2.gz XEZWYVMHAGZCSW-GXFFZTMASA-N 1 2 323.305 4.166 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@]2(c3ccccc3)CC2(C)C)cs1 ZINC000662342376 1042115922 /nfs/dbraw/zinc/11/59/22/1042115922.db2.gz ARPVADRVCFDDGS-FZKQIMNGSA-N 1 2 316.470 4.266 20 0 DIADLO Clc1ncc(-c2c[nH+]c3c(c2)CCCN3)c(Cl)c1Cl ZINC001245809424 1042125784 /nfs/dbraw/zinc/12/57/84/1042125784.db2.gz WIZWAMPLBOIYGP-UHFFFAOYSA-N 1 2 314.603 4.105 20 0 DIADLO Cc1c([C@H](C)Nc2ccc3c(c2)CC[NH2+]3)cnn1-c1ccccc1 ZINC000817949013 1042130415 /nfs/dbraw/zinc/13/04/15/1042130415.db2.gz GCIZAEIHOGVFIL-AWEZNQCLSA-N 1 2 318.424 4.322 20 0 DIADLO C[N@H+](Cc1nc2ccccc2n1C(F)F)Cc1cccc(F)c1 ZINC000051558314 1042143086 /nfs/dbraw/zinc/14/30/86/1042143086.db2.gz SMLQXRHNNXKFCH-UHFFFAOYSA-N 1 2 319.330 4.203 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2n1C(F)F)Cc1cccc(F)c1 ZINC000051558314 1042143090 /nfs/dbraw/zinc/14/30/90/1042143090.db2.gz SMLQXRHNNXKFCH-UHFFFAOYSA-N 1 2 319.330 4.203 20 0 DIADLO CCC1(CC)Oc2ccc(NCc3c[nH+]cn3C(C)C)cc2O1 ZINC000818214193 1042143724 /nfs/dbraw/zinc/14/37/24/1042143724.db2.gz ZHYRTNKSSDKGGW-UHFFFAOYSA-N 1 2 315.417 4.364 20 0 DIADLO COc1c(F)cccc1C[N@@H+]1CCc2ccc(Cl)cc2C1 ZINC001143525795 1042149850 /nfs/dbraw/zinc/14/98/50/1042149850.db2.gz ZSLNWQVTMRGZKK-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1c(F)cccc1C[N@H+]1CCc2ccc(Cl)cc2C1 ZINC001143525795 1042149854 /nfs/dbraw/zinc/14/98/54/1042149854.db2.gz ZSLNWQVTMRGZKK-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CC(C)Oc1c(F)cc(-c2cc[nH+]c(N(C)C)c2)cc1Cl ZINC001245868280 1042158438 /nfs/dbraw/zinc/15/84/38/1042158438.db2.gz RIWNGFCNMZCAEQ-UHFFFAOYSA-N 1 2 308.784 4.394 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N3CCCCC[C@H]3CC(C)C)ccn12 ZINC001126278473 1042159993 /nfs/dbraw/zinc/15/99/93/1042159993.db2.gz PQQJNJCDMVNXDI-KRWDZBQOSA-N 1 2 313.445 4.074 20 0 DIADLO CC[N@H+](Cc1cc(C(=O)OC)oc1C)Cc1ccccc1Cl ZINC000604513041 1042215695 /nfs/dbraw/zinc/21/56/95/1042215695.db2.gz XXUCIENQQWGEGN-UHFFFAOYSA-N 1 2 321.804 4.050 20 0 DIADLO CC[N@@H+](Cc1cc(C(=O)OC)oc1C)Cc1ccccc1Cl ZINC000604513041 1042215701 /nfs/dbraw/zinc/21/57/01/1042215701.db2.gz XXUCIENQQWGEGN-UHFFFAOYSA-N 1 2 321.804 4.050 20 0 DIADLO Cc1nc(N[C@@H](C)c2ccc(C(F)(F)F)nc2Cl)cc[nH+]1 ZINC000820594321 1042220756 /nfs/dbraw/zinc/22/07/56/1042220756.db2.gz HCWRSJREWXPXEM-ZETCQYMHSA-N 1 2 316.714 4.025 20 0 DIADLO Cc1nc(N[C@H](C)c2ccc(C(F)(F)F)nc2Cl)cc[nH+]1 ZINC000820594319 1042221089 /nfs/dbraw/zinc/22/10/89/1042221089.db2.gz HCWRSJREWXPXEM-SSDOTTSWSA-N 1 2 316.714 4.025 20 0 DIADLO CC(C)C[C@H](C(=O)N(C)c1cccc(C(C)C)c1)n1cc[nH+]c1 ZINC001136387355 1042230288 /nfs/dbraw/zinc/23/02/88/1042230288.db2.gz GWNVOPBIWABNLX-GOSISDBHSA-N 1 2 313.445 4.257 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1c(F)cccc1F ZINC000278944646 1042251254 /nfs/dbraw/zinc/25/12/54/1042251254.db2.gz YGOHEFXITCIYFZ-VIFPVBQESA-N 1 2 316.273 4.229 20 0 DIADLO CC(C)(C)SCC[N@@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000369205284 1042253310 /nfs/dbraw/zinc/25/33/10/1042253310.db2.gz JCNSKGQIZLGSIF-ZDUSSCGKSA-N 1 2 309.479 4.006 20 0 DIADLO CC(C)(C)SCC[N@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000369205284 1042253317 /nfs/dbraw/zinc/25/33/17/1042253317.db2.gz JCNSKGQIZLGSIF-ZDUSSCGKSA-N 1 2 309.479 4.006 20 0 DIADLO Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606584372 1042289473 /nfs/dbraw/zinc/28/94/73/1042289473.db2.gz QXGFQEMQZZXVDZ-QGZVFWFLSA-N 1 2 320.396 4.012 20 0 DIADLO CC(C)([NH2+]Cc1nccn1C1CC1)c1cccc(Cl)c1F ZINC000893660449 1042293732 /nfs/dbraw/zinc/29/37/32/1042293732.db2.gz DVWHWFFBZSLKQI-UHFFFAOYSA-N 1 2 307.800 4.035 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@@H]3CC[C@H]4C[C@H]43)c2)[nH+]c1C ZINC000822730454 1042299183 /nfs/dbraw/zinc/29/91/83/1042299183.db2.gz LHHXBXXKKBHGFD-GRDNDAEWSA-N 1 2 309.413 4.068 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(F)F)no1)c1csc2ccccc21 ZINC000822846126 1042303656 /nfs/dbraw/zinc/30/36/56/1042303656.db2.gz YQHUWJORYPCWME-QMMMGPOBSA-N 1 2 309.341 4.073 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@H](c2ccccc2)[C@@H](C)O)cs1 ZINC000658359796 1042305222 /nfs/dbraw/zinc/30/52/22/1042305222.db2.gz HVRKGZAMFHOMKF-ZENOOKHLSA-N 1 2 304.459 4.039 20 0 DIADLO Clc1cccc(Cl)c1C[N@H+](C[C@@H]1CCCO1)C1CC1 ZINC000621285491 1042308408 /nfs/dbraw/zinc/30/84/08/1042308408.db2.gz UZMJKMUTBLXMFA-LBPRGKRZSA-N 1 2 300.229 4.137 20 0 DIADLO Clc1cccc(Cl)c1C[N@@H+](C[C@@H]1CCCO1)C1CC1 ZINC000621285491 1042308414 /nfs/dbraw/zinc/30/84/14/1042308414.db2.gz UZMJKMUTBLXMFA-LBPRGKRZSA-N 1 2 300.229 4.137 20 0 DIADLO CC(C)C[C@@H](C(=O)N1CCCC2(CCCCC2)C1)n1cc[nH+]c1 ZINC001136673852 1042313733 /nfs/dbraw/zinc/31/37/33/1042313733.db2.gz LDTDEWZDHSGWGO-KRWDZBQOSA-N 1 2 317.477 4.043 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cncs1)c1nc(C(F)(F)F)cs1 ZINC000279492086 1042318727 /nfs/dbraw/zinc/31/87/27/1042318727.db2.gz LTXVTWFBOBXWDS-NKWVEPMBSA-N 1 2 307.366 4.030 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CCC[C@H]4C[C@H]43)c2)[nH+]c1C ZINC000823354028 1042322247 /nfs/dbraw/zinc/32/22/47/1042322247.db2.gz YBRWCQUDTHTIEF-IAOVAPTHSA-N 1 2 309.413 4.068 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1ccc(Cl)nc1Cl ZINC000233485052 1042351213 /nfs/dbraw/zinc/35/12/13/1042351213.db2.gz FDDXZPCIVCJLIN-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1ccc(Cl)nc1Cl ZINC000233485052 1042351218 /nfs/dbraw/zinc/35/12/18/1042351218.db2.gz FDDXZPCIVCJLIN-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccnc(Cl)c2F)s1 ZINC000823444651 1042326420 /nfs/dbraw/zinc/32/64/20/1042326420.db2.gz RYHFUDZCZMOWHG-VIFPVBQESA-N 1 2 313.829 4.140 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccnc(Cl)c2F)s1 ZINC000823444651 1042326426 /nfs/dbraw/zinc/32/64/26/1042326426.db2.gz RYHFUDZCZMOWHG-VIFPVBQESA-N 1 2 313.829 4.140 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2cc(F)ncc2F)C1 ZINC000823459447 1042326628 /nfs/dbraw/zinc/32/66/28/1042326628.db2.gz UGPVYCZUNACQQE-ZBEGNZNMSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2cc(F)ncc2F)C1 ZINC000823459447 1042326635 /nfs/dbraw/zinc/32/66/35/1042326635.db2.gz UGPVYCZUNACQQE-ZBEGNZNMSA-N 1 2 306.331 4.082 20 0 DIADLO COc1cc[nH+]cc1NCc1cc(-c2cccc(Cl)c2)no1 ZINC001171020947 1042332499 /nfs/dbraw/zinc/33/24/99/1042332499.db2.gz XLQSPLJOGPYRTA-UHFFFAOYSA-N 1 2 315.760 4.011 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+][C@@H]2CCCC23CCC3)cc1 ZINC000823554071 1042334330 /nfs/dbraw/zinc/33/43/30/1042334330.db2.gz GVUOFZZHWPYWLC-CRAIPNDOSA-N 1 2 300.446 4.046 20 0 DIADLO Cc1cc(NC(=O)c2ccc(-c3ccccc3)nc2C)cc[nH+]1 ZINC000010165236 1042336683 /nfs/dbraw/zinc/33/66/83/1042336683.db2.gz JBTRMORLFINESH-UHFFFAOYSA-N 1 2 303.365 4.013 20 0 DIADLO Cc1noc(C(C)C)c1C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000279828028 1042346089 /nfs/dbraw/zinc/34/60/89/1042346089.db2.gz AOSVNUZUBSVHHX-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1csc(C(C)(C)C)n1 ZINC000098170797 1042365677 /nfs/dbraw/zinc/36/56/77/1042365677.db2.gz PEEJTYSLFQLWBZ-UHFFFAOYSA-N 1 2 303.475 4.427 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(F)nc1Br ZINC001213494672 1042366742 /nfs/dbraw/zinc/36/67/42/1042366742.db2.gz FIFAAGOLGPBFAL-UHFFFAOYSA-N 1 2 322.181 4.308 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)s1 ZINC001139817290 1042367087 /nfs/dbraw/zinc/36/70/87/1042367087.db2.gz GLWZRRCGVPYYGJ-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)s1 ZINC001139817290 1042367092 /nfs/dbraw/zinc/36/70/92/1042367092.db2.gz GLWZRRCGVPYYGJ-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]C1(c2cccc(Cl)c2)CC1 ZINC000925884453 1042375913 /nfs/dbraw/zinc/37/59/13/1042375913.db2.gz WUDQMWVVCSLLIF-CQSZACIVSA-N 1 2 302.805 4.293 20 0 DIADLO Cc1cccc(NC(=O)C[N@@H+](C)[C@H](C)c2ccccc2F)c1C ZINC000051537155 1042377175 /nfs/dbraw/zinc/37/71/75/1042377175.db2.gz KFUQSAWDIPWBFE-OAHLLOKOSA-N 1 2 314.404 4.074 20 0 DIADLO Cc1cccc(NC(=O)C[N@H+](C)[C@H](C)c2ccccc2F)c1C ZINC000051537155 1042377177 /nfs/dbraw/zinc/37/71/77/1042377177.db2.gz KFUQSAWDIPWBFE-OAHLLOKOSA-N 1 2 314.404 4.074 20 0 DIADLO COc1c(F)cccc1C[N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001143533960 1042390666 /nfs/dbraw/zinc/39/06/66/1042390666.db2.gz LUMXFQNPCZNVNC-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cccc1C[N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001143533960 1042390671 /nfs/dbraw/zinc/39/06/71/1042390671.db2.gz LUMXFQNPCZNVNC-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO Clc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc3c2OCCO3)o1 ZINC000353145465 1042430688 /nfs/dbraw/zinc/43/06/88/1042430688.db2.gz WQNFZBNOIYJCNA-CQSZACIVSA-N 1 2 319.788 4.041 20 0 DIADLO Clc1ccc(C[N@H+]2CCC[C@@H]2c2cccc3c2OCCO3)o1 ZINC000353145465 1042430694 /nfs/dbraw/zinc/43/06/94/1042430694.db2.gz WQNFZBNOIYJCNA-CQSZACIVSA-N 1 2 319.788 4.041 20 0 DIADLO c1nc2c(s1)CCC[C@H]2Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000623954278 1042437770 /nfs/dbraw/zinc/43/77/70/1042437770.db2.gz IERVLHDUECMYBS-CQSZACIVSA-N 1 2 314.458 4.018 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1ncoc1C(C)C)CCC2 ZINC000092805953 1042445406 /nfs/dbraw/zinc/44/54/06/1042445406.db2.gz NVTRGHNJMVFDPI-CQSZACIVSA-N 1 2 319.474 4.326 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1ncoc1C(C)C)CCC2 ZINC000092805953 1042445412 /nfs/dbraw/zinc/44/54/12/1042445412.db2.gz NVTRGHNJMVFDPI-CQSZACIVSA-N 1 2 319.474 4.326 20 0 DIADLO Cc1nc2ccc(Nc3cccc(Cn4cc[nH+]c4)c3)cc2o1 ZINC001213066722 1042451499 /nfs/dbraw/zinc/45/14/99/1042451499.db2.gz KPKOVDDIDMYKCO-UHFFFAOYSA-N 1 2 304.353 4.125 20 0 DIADLO CCCCOc1cccc(F)c1Nc1cc[nH+]c(NC(C)=O)c1 ZINC001211792664 1042451530 /nfs/dbraw/zinc/45/15/30/1042451530.db2.gz OVLHHDVDRIMSBQ-UHFFFAOYSA-N 1 2 317.364 4.102 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CCC34CCCC4)cc2)CCO1 ZINC000249161609 1042452380 /nfs/dbraw/zinc/45/23/80/1042452380.db2.gz ZYFHQLXCLHHGKC-QAPCUYQASA-N 1 2 300.446 4.046 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CCCc2c(cnn2C)C1 ZINC000411842890 1042462099 /nfs/dbraw/zinc/46/20/99/1042462099.db2.gz JTHNMKRKBBOXQZ-LLVKDONJSA-N 1 2 324.255 4.236 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCCc2c(cnn2C)C1 ZINC000411842890 1042462104 /nfs/dbraw/zinc/46/21/04/1042462104.db2.gz JTHNMKRKBBOXQZ-LLVKDONJSA-N 1 2 324.255 4.236 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(C2CCCCC2)cc1)c1csnn1 ZINC000412047943 1042465216 /nfs/dbraw/zinc/46/52/16/1042465216.db2.gz WLVBQXMYZJIEJD-CYBMUJFWSA-N 1 2 301.459 4.437 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC(c3cccnc3)CC2)c1 ZINC000645204243 1042468001 /nfs/dbraw/zinc/46/80/01/1042468001.db2.gz RGJOSFAWWRLVNN-UHFFFAOYSA-N 1 2 307.372 4.153 20 0 DIADLO CC[C@H](Nc1ccc([NH+](C)C)cc1)c1ccc(OC)c(OC)c1 ZINC000319512566 1042473393 /nfs/dbraw/zinc/47/33/93/1042473393.db2.gz IJTFTQSIQZOAPM-KRWDZBQOSA-N 1 2 314.429 4.333 20 0 DIADLO Cc1ccc(OCc2nc(C[NH2+][C@@H]3CCC[C@@H]3F)cs2)cc1 ZINC000645220370 1042474801 /nfs/dbraw/zinc/47/48/01/1042474801.db2.gz NIMTYLFNEUNCEE-JKSUJKDBSA-N 1 2 320.433 4.011 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+](C)Cc1nnc(-c2ccco2)o1 ZINC000052162042 1042477000 /nfs/dbraw/zinc/47/70/00/1042477000.db2.gz MNCIGHCVYHEOGC-LLVKDONJSA-N 1 2 317.776 4.176 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1nnc(-c2ccco2)o1 ZINC000052162042 1042477003 /nfs/dbraw/zinc/47/70/03/1042477003.db2.gz MNCIGHCVYHEOGC-LLVKDONJSA-N 1 2 317.776 4.176 20 0 DIADLO O=C(Nc1cccc(CNc2cccc[nH+]2)c1)c1cccc(F)c1 ZINC000052489465 1042481847 /nfs/dbraw/zinc/48/18/47/1042481847.db2.gz JBZFMTIZFBVXNA-UHFFFAOYSA-N 1 2 321.355 4.085 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)CCO1 ZINC000576417132 1042489835 /nfs/dbraw/zinc/48/98/35/1042489835.db2.gz ODZMQNSWTPJEQS-UHFFFAOYSA-N 1 2 322.861 4.074 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)CCO1 ZINC000576417132 1042489838 /nfs/dbraw/zinc/48/98/38/1042489838.db2.gz ODZMQNSWTPJEQS-UHFFFAOYSA-N 1 2 322.861 4.074 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+][C@@H](C)c1cn(C(C)C)nn1 ZINC000924894873 1042508071 /nfs/dbraw/zinc/50/80/71/1042508071.db2.gz BIAWECYQIZQYOW-GOEBONIOSA-N 1 2 316.449 4.060 20 0 DIADLO O=C(C[N@@H+]1CCC[C@@H]1c1ccsc1)Nc1ccccc1Cl ZINC000052803120 1042518224 /nfs/dbraw/zinc/51/82/24/1042518224.db2.gz BTPLORQMZREEAV-OAHLLOKOSA-N 1 2 320.845 4.177 20 0 DIADLO O=C(C[N@H+]1CCC[C@@H]1c1ccsc1)Nc1ccccc1Cl ZINC000052803120 1042518227 /nfs/dbraw/zinc/51/82/27/1042518227.db2.gz BTPLORQMZREEAV-OAHLLOKOSA-N 1 2 320.845 4.177 20 0 DIADLO C[C@H](CC(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccccc1 ZINC000052909423 1042522543 /nfs/dbraw/zinc/52/25/43/1042522543.db2.gz ZVWYYXCCYDZTOF-OAHLLOKOSA-N 1 2 305.381 4.005 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1cc([N+](=O)[O-])ccc1Cl ZINC000237099905 1042524837 /nfs/dbraw/zinc/52/48/37/1042524837.db2.gz GQDGCVBHMFWQSW-UHFFFAOYSA-N 1 2 319.792 4.235 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@H]2CCc3c2c(F)ccc3F)o1 ZINC000513344273 1042535804 /nfs/dbraw/zinc/53/58/04/1042535804.db2.gz YZKSIDRJBOFVEX-HOTGVXAUSA-N 1 2 321.367 4.085 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@H]2CCc3c2c(F)ccc3F)o1 ZINC000513344275 1042535840 /nfs/dbraw/zinc/53/58/40/1042535840.db2.gz YZKSIDRJBOFVEX-JKSUJKDBSA-N 1 2 321.367 4.085 20 0 DIADLO CCC(C)(C)c1ccc(C[N@@H+]2CCOC[C@@H]2CC(F)F)cc1 ZINC000513401362 1042539368 /nfs/dbraw/zinc/53/93/68/1042539368.db2.gz LWOHBMLJUKTHAQ-INIZCTEOSA-N 1 2 311.416 4.230 20 0 DIADLO CCC(C)(C)c1ccc(C[N@H+]2CCOC[C@@H]2CC(F)F)cc1 ZINC000513401362 1042539371 /nfs/dbraw/zinc/53/93/71/1042539371.db2.gz LWOHBMLJUKTHAQ-INIZCTEOSA-N 1 2 311.416 4.230 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc3c(s2)C[C@H](C)CC3)s1 ZINC000513437991 1042541459 /nfs/dbraw/zinc/54/14/59/1042541459.db2.gz HPXDMUPTURYQFS-LLVKDONJSA-N 1 2 306.500 4.270 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc3c(s2)C[C@H](C)CC3)s1 ZINC000513437991 1042541463 /nfs/dbraw/zinc/54/14/63/1042541463.db2.gz HPXDMUPTURYQFS-LLVKDONJSA-N 1 2 306.500 4.270 20 0 DIADLO C(=C/c1ccccc1)\C[N@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000513442419 1042542344 /nfs/dbraw/zinc/54/23/44/1042542344.db2.gz GOHZMQKUYYKYRF-KPKJPENVSA-N 1 2 303.409 4.125 20 0 DIADLO C(=C/c1ccccc1)\C[N@@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000513442419 1042542350 /nfs/dbraw/zinc/54/23/50/1042542350.db2.gz GOHZMQKUYYKYRF-KPKJPENVSA-N 1 2 303.409 4.125 20 0 DIADLO Clc1ccccc1C1([NH2+]Cc2cnc(C3CC3)o2)CCC1 ZINC000628323171 1042568365 /nfs/dbraw/zinc/56/83/65/1042568365.db2.gz FGZVXOBAJYQBEZ-UHFFFAOYSA-N 1 2 302.805 4.374 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2ccc(Cl)cc2OC)cs1 ZINC000280280714 1042569858 /nfs/dbraw/zinc/56/98/58/1042569858.db2.gz SFBJCXPSOCZAGJ-JTQLQIEISA-N 1 2 310.850 4.218 20 0 DIADLO Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280719468 1042578511 /nfs/dbraw/zinc/57/85/11/1042578511.db2.gz BZFHMWFAOJRXOX-KRWDZBQOSA-N 1 2 320.396 4.012 20 0 DIADLO Cc1occc1C[N@@H+]1CCC[C@@H]1c1ccc(Br)cn1 ZINC000414462064 1042610293 /nfs/dbraw/zinc/61/02/93/1042610293.db2.gz PNRXXPZDXJZEFT-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1occc1C[N@H+]1CCC[C@@H]1c1ccc(Br)cn1 ZINC000414462064 1042610298 /nfs/dbraw/zinc/61/02/98/1042610298.db2.gz PNRXXPZDXJZEFT-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NC[C@H]2CC23CCSCC3)c1 ZINC000420650098 1042611357 /nfs/dbraw/zinc/61/13/57/1042611357.db2.gz HDRIFHNJJSJTNX-LLVKDONJSA-N 1 2 302.365 4.046 20 0 DIADLO Cc1cc(CNC(=O)N[C@@H](C)c2cc3ccccc3o2)cc(C)[nH+]1 ZINC000420836328 1042613170 /nfs/dbraw/zinc/61/31/70/1042613170.db2.gz PIMYNLPGOJTXMG-AWEZNQCLSA-N 1 2 323.396 4.005 20 0 DIADLO CCCc1nc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)cs1 ZINC000420952207 1042616644 /nfs/dbraw/zinc/61/66/44/1042616644.db2.gz RUKJRYUNAVENNK-NSHDSACASA-N 1 2 306.397 4.260 20 0 DIADLO CCCc1nc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cs1 ZINC000420952207 1042616645 /nfs/dbraw/zinc/61/66/45/1042616645.db2.gz RUKJRYUNAVENNK-NSHDSACASA-N 1 2 306.397 4.260 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)o1 ZINC000420955641 1042617659 /nfs/dbraw/zinc/61/76/59/1042617659.db2.gz WSQMLZXTVNHFPL-LLVKDONJSA-N 1 2 304.356 4.137 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)o1 ZINC000420955641 1042617663 /nfs/dbraw/zinc/61/76/63/1042617663.db2.gz WSQMLZXTVNHFPL-LLVKDONJSA-N 1 2 304.356 4.137 20 0 DIADLO CC(C)[N@H+](Cc1nc(C(C)(C)C)no1)[C@@H](C)c1ccsc1 ZINC000421008303 1042621581 /nfs/dbraw/zinc/62/15/81/1042621581.db2.gz LXYMHQKRYSYVMU-LBPRGKRZSA-N 1 2 307.463 4.400 20 0 DIADLO CC(C)[N@@H+](Cc1nc(C(C)(C)C)no1)[C@@H](C)c1ccsc1 ZINC000421008303 1042621584 /nfs/dbraw/zinc/62/15/84/1042621584.db2.gz LXYMHQKRYSYVMU-LBPRGKRZSA-N 1 2 307.463 4.400 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccccc2C(C)(C)C)cc(C)[nH+]1 ZINC000421035425 1042621827 /nfs/dbraw/zinc/62/18/27/1042621827.db2.gz LTXRKWYWCREZQK-UHFFFAOYSA-N 1 2 311.429 4.318 20 0 DIADLO CCc1cccc(CC)c1NC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000421043417 1042623391 /nfs/dbraw/zinc/62/33/91/1042623391.db2.gz QEXMEVXHOCQESV-UHFFFAOYSA-N 1 2 311.429 4.145 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3Cl)C2)s1 ZINC000513746133 1042629182 /nfs/dbraw/zinc/62/91/82/1042629182.db2.gz OXGVNVDUUYRYQG-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3Cl)C2)s1 ZINC000513746133 1042629185 /nfs/dbraw/zinc/62/91/85/1042629185.db2.gz OXGVNVDUUYRYQG-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H](c2ccc(F)cc2)C(C)C)nn1C ZINC000421335237 1042631358 /nfs/dbraw/zinc/63/13/58/1042631358.db2.gz RXKCURHYATVWSM-INIZCTEOSA-N 1 2 309.816 4.008 20 0 DIADLO COCc1cnc(C[N@H+](C(C)C)[C@H](C)c2ccsc2)s1 ZINC000421371180 1042633382 /nfs/dbraw/zinc/63/33/82/1042633382.db2.gz KKYFAVVQCWVLKV-GFCCVEGCSA-N 1 2 310.488 4.323 20 0 DIADLO COCc1cnc(C[N@@H+](C(C)C)[C@H](C)c2ccsc2)s1 ZINC000421371180 1042633386 /nfs/dbraw/zinc/63/33/86/1042633386.db2.gz KKYFAVVQCWVLKV-GFCCVEGCSA-N 1 2 310.488 4.323 20 0 DIADLO Cc1cc(CNC(=O)CCCCCc2cccs2)cc(C)[nH+]1 ZINC000421573546 1042644465 /nfs/dbraw/zinc/64/44/65/1042644465.db2.gz BECKDDVKVSLAPO-UHFFFAOYSA-N 1 2 316.470 4.179 20 0 DIADLO COc1cc(Cl)ccc1[C@@H](C)[NH2+][C@@H](C)c1nnc(C(C)C)[nH]1 ZINC000421837537 1042656292 /nfs/dbraw/zinc/65/62/92/1042656292.db2.gz RHVGBZLLZRYKBI-MNOVXSKESA-N 1 2 322.840 4.002 20 0 DIADLO COc1cc(Cl)ccc1[C@H](C)[NH2+][C@H](C)c1nnc(C(C)C)[nH]1 ZINC000421837541 1042656395 /nfs/dbraw/zinc/65/63/95/1042656395.db2.gz RHVGBZLLZRYKBI-WDEREUQCSA-N 1 2 322.840 4.002 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)cc(C)n1 ZINC000421853149 1042657039 /nfs/dbraw/zinc/65/70/39/1042657039.db2.gz IPHZOXBRJSMUSZ-SNVBAGLBSA-N 1 2 315.364 4.025 20 0 DIADLO CC[C@H]([NH2+]Cc1nc([C@@H](C)OCC(C)C)no1)c1ccccc1 ZINC000271701110 1042666571 /nfs/dbraw/zinc/66/65/71/1042666571.db2.gz SNGJKOSZXYIBDV-ZBFHGGJFSA-N 1 2 317.433 4.044 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(OC(F)F)cc1 ZINC000271827466 1042669682 /nfs/dbraw/zinc/66/96/82/1042669682.db2.gz WMKRUIYHMKYHGC-SNVBAGLBSA-N 1 2 308.328 4.004 20 0 DIADLO COC[C@H]([NH2+]Cc1nc(-c2ccccc2)oc1C)c1ccccc1 ZINC000271838990 1042670260 /nfs/dbraw/zinc/67/02/60/1042670260.db2.gz UJZKJWILVGAYEW-IBGZPJMESA-N 1 2 322.408 4.127 20 0 DIADLO Cc1nnc(C[NH2+][C@H](C)c2ccc(OCCC(C)C)cc2)s1 ZINC000271855426 1042670868 /nfs/dbraw/zinc/67/08/68/1042670868.db2.gz XLKIFESXEAZPJE-CYBMUJFWSA-N 1 2 319.474 4.122 20 0 DIADLO Cc1cc([C@@H]([NH2+][C@@H](C)c2nc(C3CC3)no2)C2CC2)ccc1F ZINC000272055862 1042676320 /nfs/dbraw/zinc/67/63/20/1042676320.db2.gz HBAIKCDZWVZBGR-ZBEGNZNMSA-N 1 2 315.392 4.196 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H]2CCCOc3cc(F)ccc32)cs1 ZINC000272104377 1042677258 /nfs/dbraw/zinc/67/72/58/1042677258.db2.gz ZMHIULDGGIGFNX-IINYFYTJSA-N 1 2 306.406 4.155 20 0 DIADLO Cc1cc(CNC(=O)N(C)[C@@H]2CCC[C@@H]2C(C)(C)C)cc(C)[nH+]1 ZINC000422215288 1042682116 /nfs/dbraw/zinc/68/21/16/1042682116.db2.gz UEXJDCKUPLAIFF-DLBZAZTESA-N 1 2 317.477 4.055 20 0 DIADLO Fc1ccc2c(c1)[C@@H](Nc1ccc3c(c1)CC[NH2+]3)CCS2 ZINC000423218946 1042700901 /nfs/dbraw/zinc/70/09/01/1042700901.db2.gz SPYCFBMTPKKLQB-INIZCTEOSA-N 1 2 300.402 4.443 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1cccc(OC(F)F)c1 ZINC000423215031 1042701281 /nfs/dbraw/zinc/70/12/81/1042701281.db2.gz MHNHGGSMYOUYKJ-LLVKDONJSA-N 1 2 304.340 4.429 20 0 DIADLO COC[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(Cl)cc1 ZINC000423217171 1042701441 /nfs/dbraw/zinc/70/14/41/1042701441.db2.gz PKBFTSQNDITUGD-QGZVFWFLSA-N 1 2 302.805 4.108 20 0 DIADLO CCCCN1CCc2ccc(NCc3c[nH+]cn3C(C)C)cc21 ZINC000424140214 1042726532 /nfs/dbraw/zinc/72/65/32/1042726532.db2.gz FAPWKLSTIOTVJT-UHFFFAOYSA-N 1 2 312.461 4.239 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc(Cl)cc1OC(F)F ZINC000424175761 1042727413 /nfs/dbraw/zinc/72/74/13/1042727413.db2.gz OCEXMFAWFJXXTG-UHFFFAOYSA-N 1 2 315.751 4.331 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cccc(OCc2cccnc2)c1 ZINC000424164245 1042728394 /nfs/dbraw/zinc/72/83/94/1042728394.db2.gz YUYCZHFDKGUXDE-UHFFFAOYSA-N 1 2 322.412 4.050 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2cncn2C(C)C)c2ccccn2)c1 ZINC000424162850 1042728709 /nfs/dbraw/zinc/72/87/09/1042728709.db2.gz UJFOZNGGYQYOIH-FQEVSTJZSA-N 1 2 320.440 4.047 20 0 DIADLO CCc1nc(C[NH2+]C(C)(C)c2cc(Cl)ccc2OC)cs1 ZINC000424205163 1042729278 /nfs/dbraw/zinc/72/92/78/1042729278.db2.gz UDCSSCNVGGUVSM-UHFFFAOYSA-N 1 2 324.877 4.392 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2nccn2CC(C)C)c(Cl)c1 ZINC000424319852 1042733580 /nfs/dbraw/zinc/73/35/80/1042733580.db2.gz SMAVKHPUQRHPAT-CYBMUJFWSA-N 1 2 321.852 4.052 20 0 DIADLO CCCC(C)(C)CC(=O)N1CC[NH2+][C@H](c2cccc(Cl)c2)C1 ZINC000514002477 1042766693 /nfs/dbraw/zinc/76/66/93/1042766693.db2.gz XKYPTWSAXAJHOE-INIZCTEOSA-N 1 2 322.880 4.029 20 0 DIADLO C[C@@H]1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C[C@H](C)O1 ZINC000664468066 1042786500 /nfs/dbraw/zinc/78/65/00/1042786500.db2.gz GKIOXGMBDXHONR-NEPJUHHUSA-N 1 2 324.346 4.257 20 0 DIADLO CCCN(C(=O)C[C@@H](C)n1cc[nH+]c1)[C@@H](CC)c1ccccc1 ZINC000514791675 1042791411 /nfs/dbraw/zinc/79/14/11/1042791411.db2.gz BOVZQPLUJIWNJQ-AEFFLSMTSA-N 1 2 313.445 4.224 20 0 DIADLO CC(C)[N@H+](Cc1nc(C(F)F)no1)Cc1cccc(Cl)c1 ZINC000425406944 1042814090 /nfs/dbraw/zinc/81/40/90/1042814090.db2.gz OACKUSXSWOZBPG-UHFFFAOYSA-N 1 2 315.751 4.071 20 0 DIADLO CC(C)[N@@H+](Cc1nc(C(F)F)no1)Cc1cccc(Cl)c1 ZINC000425406944 1042814095 /nfs/dbraw/zinc/81/40/95/1042814095.db2.gz OACKUSXSWOZBPG-UHFFFAOYSA-N 1 2 315.751 4.071 20 0 DIADLO FC(F)c1noc(C[NH2+][C@H](CC2CCCC2)c2ccccc2)n1 ZINC000425451398 1042825154 /nfs/dbraw/zinc/82/51/54/1042825154.db2.gz BRDFUNXFICXIGM-CQSZACIVSA-N 1 2 321.371 4.418 20 0 DIADLO OC1CCC(CNc2[nH+]ccc3cc(C(F)(F)F)ccc32)CC1 ZINC000664528461 1042828374 /nfs/dbraw/zinc/82/83/74/1042828374.db2.gz KKCMPDWRSXONPF-UHFFFAOYSA-N 1 2 324.346 4.217 20 0 DIADLO CC(C)[N@H+](Cc1nc(C(F)F)no1)[C@@H](C)c1ccsc1 ZINC000425487491 1042831432 /nfs/dbraw/zinc/83/14/32/1042831432.db2.gz YSAUVYBODDENHY-VIFPVBQESA-N 1 2 301.362 4.040 20 0 DIADLO CC(C)[N@@H+](Cc1nc(C(F)F)no1)[C@@H](C)c1ccsc1 ZINC000425487491 1042831442 /nfs/dbraw/zinc/83/14/42/1042831442.db2.gz YSAUVYBODDENHY-VIFPVBQESA-N 1 2 301.362 4.040 20 0 DIADLO Clc1cccc2c(N3CCC(c4ccon4)CC3)cc[nH+]c12 ZINC000664566826 1042840722 /nfs/dbraw/zinc/84/07/22/1042840722.db2.gz ZUFPRTFROAFUKT-UHFFFAOYSA-N 1 2 313.788 4.260 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(F)ccc2Br)CCC1(F)F ZINC000516688322 1042851544 /nfs/dbraw/zinc/85/15/44/1042851544.db2.gz BBAJWHZWTHDDFN-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2Br)CCC1(F)F ZINC000516688322 1042851549 /nfs/dbraw/zinc/85/15/49/1042851549.db2.gz BBAJWHZWTHDDFN-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO COc1cc(C(C)=O)ccc1SCCc1[nH+]cc(C)cc1C ZINC000516926481 1042860533 /nfs/dbraw/zinc/86/05/33/1042860533.db2.gz PIQLUWHXLFFETR-UHFFFAOYSA-N 1 2 315.438 4.244 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H]2CCCc3c(Cl)ccnc32)cs1 ZINC000925033680 1042899720 /nfs/dbraw/zinc/89/97/20/1042899720.db2.gz NASLTWGGXSMGFV-ZWNOBZJWSA-N 1 2 321.877 4.482 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@@H](c1oc2ccccc2c1C)C(C)C ZINC000925038327 1042908136 /nfs/dbraw/zinc/90/81/36/1042908136.db2.gz TUDFRCYBQHGSFS-BLLLJJGKSA-N 1 2 313.401 4.481 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@@H]3CCOC4(CCC4)C3)cc2)c1C ZINC000295940636 1042915386 /nfs/dbraw/zinc/91/53/86/1042915386.db2.gz GIJIAUQAWLRHLK-QGZVFWFLSA-N 1 2 311.429 4.003 20 0 DIADLO CC(C)[C@H](C)NC(=O)C[N@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000519193070 1042937085 /nfs/dbraw/zinc/93/70/85/1042937085.db2.gz YMCFYBGNAOCSGX-KBPBESRZSA-N 1 2 322.880 4.026 20 0 DIADLO CC(C)[C@H](C)NC(=O)C[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000519193070 1042937090 /nfs/dbraw/zinc/93/70/90/1042937090.db2.gz YMCFYBGNAOCSGX-KBPBESRZSA-N 1 2 322.880 4.026 20 0 DIADLO COc1ccc2c(c1)C[N@H+]([C@H](C)c1cc(F)ccc1F)CC2 ZINC000519214543 1042939096 /nfs/dbraw/zinc/93/90/96/1042939096.db2.gz MLDLLCSYZLPNKO-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc2c(c1)C[N@@H+]([C@H](C)c1cc(F)ccc1F)CC2 ZINC000519214543 1042939099 /nfs/dbraw/zinc/93/90/99/1042939099.db2.gz MLDLLCSYZLPNKO-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO CC[C@H](Nc1[nH+]cnc2c1cnn2-c1ccccc1)C(C)(C)C ZINC000519244840 1042940509 /nfs/dbraw/zinc/94/05/09/1042940509.db2.gz XSKXPTLCDXDASC-HNNXBMFYSA-N 1 2 309.417 4.052 20 0 DIADLO CC[C@@]1(C)C[N@H+](Cc2cnc(C3CCCCC3)s2)CCO1 ZINC000519295658 1042943039 /nfs/dbraw/zinc/94/30/39/1042943039.db2.gz YVOARTSLBJNDGI-KRWDZBQOSA-N 1 2 308.491 4.192 20 0 DIADLO CC[C@@]1(C)C[N@@H+](Cc2cnc(C3CCCCC3)s2)CCO1 ZINC000519295658 1042943045 /nfs/dbraw/zinc/94/30/45/1042943045.db2.gz YVOARTSLBJNDGI-KRWDZBQOSA-N 1 2 308.491 4.192 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(-c3ccccc3)no2)[C@H]1c1cccnc1 ZINC000664825433 1042965178 /nfs/dbraw/zinc/96/51/78/1042965178.db2.gz JGZDCAGSUXOOOZ-IBGZPJMESA-N 1 2 319.408 4.320 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(-c3ccccc3)no2)[C@H]1c1cccnc1 ZINC000664825433 1042965184 /nfs/dbraw/zinc/96/51/84/1042965184.db2.gz JGZDCAGSUXOOOZ-IBGZPJMESA-N 1 2 319.408 4.320 20 0 DIADLO Cc1ncoc1C[NH2+]C1(c2c(Cl)cccc2Cl)CCC1 ZINC000894582022 1042968809 /nfs/dbraw/zinc/96/88/09/1042968809.db2.gz RJSKAHPTZSVRBT-UHFFFAOYSA-N 1 2 311.212 4.459 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000664832374 1042969099 /nfs/dbraw/zinc/96/90/99/1042969099.db2.gz JMBINZLLPQEIFW-DYVFJYSZSA-N 1 2 307.397 4.367 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000664832374 1042969101 /nfs/dbraw/zinc/96/91/01/1042969101.db2.gz JMBINZLLPQEIFW-DYVFJYSZSA-N 1 2 307.397 4.367 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cnc(C(C)C)nc2)c(Cl)c1 ZINC000440470917 1042975108 /nfs/dbraw/zinc/97/51/08/1042975108.db2.gz SSVLIFPXBHMVNM-UHFFFAOYSA-N 1 2 303.837 4.194 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cnc(C(C)C)nc2)c(Cl)c1 ZINC000440470917 1042975109 /nfs/dbraw/zinc/97/51/09/1042975109.db2.gz SSVLIFPXBHMVNM-UHFFFAOYSA-N 1 2 303.837 4.194 20 0 DIADLO Cc1cc(Cl)ccc1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000164591268 1043000149 /nfs/dbraw/zinc/00/01/49/1043000149.db2.gz VVGMYRBXLRVJAU-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO CC(C)CCO[C@@H]1CC[N@H+](Cc2csc(-c3ccco3)n2)C1 ZINC000083246875 1043002499 /nfs/dbraw/zinc/00/24/99/1043002499.db2.gz UZPBDFMXBQWMRV-OAHLLOKOSA-N 1 2 320.458 4.040 20 0 DIADLO CC(C)CCO[C@@H]1CC[N@@H+](Cc2csc(-c3ccco3)n2)C1 ZINC000083246875 1043002502 /nfs/dbraw/zinc/00/25/02/1043002502.db2.gz UZPBDFMXBQWMRV-OAHLLOKOSA-N 1 2 320.458 4.040 20 0 DIADLO CC[N@H+](Cc1noc(-c2ccccc2)n1)Cc1ccc(C)cc1 ZINC000519918190 1043009413 /nfs/dbraw/zinc/00/94/13/1043009413.db2.gz GNACCQZSWIPNIU-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO CC[N@@H+](Cc1noc(-c2ccccc2)n1)Cc1ccc(C)cc1 ZINC000519918190 1043009418 /nfs/dbraw/zinc/00/94/18/1043009418.db2.gz GNACCQZSWIPNIU-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@@H+](Cc1nc(C)c(C)s1)C2 ZINC000441055661 1043017606 /nfs/dbraw/zinc/01/76/06/1043017606.db2.gz CTBJQTKTQUCBEH-UHFFFAOYSA-N 1 2 316.470 4.107 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@H+](Cc1nc(C)c(C)s1)C2 ZINC000441055661 1043017613 /nfs/dbraw/zinc/01/76/13/1043017613.db2.gz CTBJQTKTQUCBEH-UHFFFAOYSA-N 1 2 316.470 4.107 20 0 DIADLO CC(C)c1cccc(NC(=O)C[N@H+](Cc2ccco2)C(C)C)c1 ZINC000520168537 1043021924 /nfs/dbraw/zinc/02/19/24/1043021924.db2.gz FBSIVYSDRNIWSZ-UHFFFAOYSA-N 1 2 314.429 4.252 20 0 DIADLO CC(C)c1cccc(NC(=O)C[N@@H+](Cc2ccco2)C(C)C)c1 ZINC000520168537 1043021929 /nfs/dbraw/zinc/02/19/29/1043021929.db2.gz FBSIVYSDRNIWSZ-UHFFFAOYSA-N 1 2 314.429 4.252 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2cn3ccsc3n2)C1 ZINC000441329017 1043037436 /nfs/dbraw/zinc/03/74/36/1043037436.db2.gz DODCSTJETVXQKY-BLLLJJGKSA-N 1 2 315.417 4.118 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2cn3ccsc3n2)C1 ZINC000441329017 1043037440 /nfs/dbraw/zinc/03/74/40/1043037440.db2.gz DODCSTJETVXQKY-BLLLJJGKSA-N 1 2 315.417 4.118 20 0 DIADLO CCCCc1noc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccc(F)c2)n1 ZINC000441345088 1043039434 /nfs/dbraw/zinc/03/94/34/1043039434.db2.gz ZRKCLSBWRXRTFH-CJNGLKHVSA-N 1 2 317.408 4.134 20 0 DIADLO CCCCc1noc(C[N@H+]2C[C@H](C)C[C@H]2c2cccc(F)c2)n1 ZINC000441345088 1043039438 /nfs/dbraw/zinc/03/94/38/1043039438.db2.gz ZRKCLSBWRXRTFH-CJNGLKHVSA-N 1 2 317.408 4.134 20 0 DIADLO CCCCc1noc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccc(F)c2)n1 ZINC000441345093 1043039566 /nfs/dbraw/zinc/03/95/66/1043039566.db2.gz ZRKCLSBWRXRTFH-CZUORRHYSA-N 1 2 317.408 4.134 20 0 DIADLO CCCCc1noc(C[N@H+]2C[C@H](C)C[C@@H]2c2cccc(F)c2)n1 ZINC000441345093 1043039569 /nfs/dbraw/zinc/03/95/69/1043039569.db2.gz ZRKCLSBWRXRTFH-CZUORRHYSA-N 1 2 317.408 4.134 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C3(C(F)F)CCC3)c2)[nH+]c1C ZINC000864988921 1043052793 /nfs/dbraw/zinc/05/27/93/1043052793.db2.gz JOLCCRGNAIZIHN-UHFFFAOYSA-N 1 2 319.355 4.067 20 0 DIADLO C[C@@H](Cc1nc(C2CC(C)(C)CC(C)(C)C2)no1)n1cc[nH+]c1 ZINC000664976633 1043057023 /nfs/dbraw/zinc/05/70/23/1043057023.db2.gz BPNTVHBBHIZRCU-ZDUSSCGKSA-N 1 2 316.449 4.390 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2nc(Cc3ccccc3)no2)cc1 ZINC000173971865 1043057775 /nfs/dbraw/zinc/05/77/75/1043057775.db2.gz QYTCPKQHBXYBSO-JKSUJKDBSA-N 1 2 321.424 4.381 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[NH2+]C(C)(C)c1cn(C(C)C)nn1 ZINC000894988056 1043061457 /nfs/dbraw/zinc/06/14/57/1043061457.db2.gz YQMCEIXHNUPZMR-UHFFFAOYSA-N 1 2 318.465 4.083 20 0 DIADLO Cc1noc([C@@H]2CCCC[N@@H+]2C/C=C\c2ccc(Cl)cc2)n1 ZINC000579268567 1043062324 /nfs/dbraw/zinc/06/23/24/1043062324.db2.gz HWVPFJGOGONYHD-AWFCHZOYSA-N 1 2 317.820 4.272 20 0 DIADLO Cc1noc([C@@H]2CCCC[N@H+]2C/C=C\c2ccc(Cl)cc2)n1 ZINC000579268567 1043062327 /nfs/dbraw/zinc/06/23/27/1043062327.db2.gz HWVPFJGOGONYHD-AWFCHZOYSA-N 1 2 317.820 4.272 20 0 DIADLO Cc1cncc([C@H]2CCCN2c2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC000895039289 1043069212 /nfs/dbraw/zinc/06/92/12/1043069212.db2.gz XUIWLDVFQMTXSO-QGZVFWFLSA-N 1 2 308.429 4.097 20 0 DIADLO Cc1ccc(C)c(NC(=O)Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001202768125 1043071502 /nfs/dbraw/zinc/07/15/02/1043071502.db2.gz VMKPLLBGSSOSHU-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CCC[C@@H]2c2ccccc2)cs1 ZINC000175022379 1043073731 /nfs/dbraw/zinc/07/37/31/1043073731.db2.gz IFWUKWKAGLSVEM-CZUORRHYSA-N 1 2 302.443 4.188 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CCC[C@@H]2c2ccccc2)cs1 ZINC000175022379 1043073740 /nfs/dbraw/zinc/07/37/40/1043073740.db2.gz IFWUKWKAGLSVEM-CZUORRHYSA-N 1 2 302.443 4.188 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](C)[C@H](C)c2ccc(C)cc2)cs1 ZINC000175096693 1043075644 /nfs/dbraw/zinc/07/56/44/1043075644.db2.gz DCYXOZPORMXAPB-ZIAGYGMSSA-N 1 2 304.459 4.352 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2)cs1 ZINC000175096693 1043075657 /nfs/dbraw/zinc/07/56/57/1043075657.db2.gz DCYXOZPORMXAPB-ZIAGYGMSSA-N 1 2 304.459 4.352 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1C ZINC000330653693 1043096348 /nfs/dbraw/zinc/09/63/48/1043096348.db2.gz RUPRWKIINGNZRU-ZIAGYGMSSA-N 1 2 301.434 4.396 20 0 DIADLO CC[C@H](c1ccccc1)[S@@](=O)Cc1cn2cccc(C)c2[nH+]1 ZINC000176517361 1043096811 /nfs/dbraw/zinc/09/68/11/1043096811.db2.gz KXXCSAHETIDZIL-VGSWGCGISA-N 1 2 312.438 4.043 20 0 DIADLO C[N@H+](Cc1nc(C2CC2)no1)C1c2ccccc2-c2ccccc21 ZINC000176432927 1043097304 /nfs/dbraw/zinc/09/73/04/1043097304.db2.gz LSKAMPVNZWZVEW-UHFFFAOYSA-N 1 2 317.392 4.149 20 0 DIADLO C[N@@H+](Cc1nc(C2CC2)no1)C1c2ccccc2-c2ccccc21 ZINC000176432927 1043097313 /nfs/dbraw/zinc/09/73/13/1043097313.db2.gz LSKAMPVNZWZVEW-UHFFFAOYSA-N 1 2 317.392 4.149 20 0 DIADLO C[C@H]([NH2+]Cc1cn(C2CC2)cn1)c1cccc(Cl)c1Cl ZINC000865468980 1043103277 /nfs/dbraw/zinc/10/32/77/1043103277.db2.gz HFJWIVOGPPKZAQ-JTQLQIEISA-N 1 2 310.228 4.376 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2ccccc2Cl)cs1 ZINC000177637154 1043110041 /nfs/dbraw/zinc/11/00/41/1043110041.db2.gz LYDRYOCQOJOHKL-MNOVXSKESA-N 1 2 310.850 4.355 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](c2ncccc2C)C(C)C)cs1 ZINC000177683652 1043111262 /nfs/dbraw/zinc/11/12/62/1043111262.db2.gz VRUSZFOUUODXAX-DZGCQCFKSA-N 1 2 319.474 4.041 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](c2ncccc2C)C(C)C)cs1 ZINC000177683663 1043112478 /nfs/dbraw/zinc/11/24/78/1043112478.db2.gz VRUSZFOUUODXAX-ZFWWWQNUSA-N 1 2 319.474 4.041 20 0 DIADLO CC(C)(C)c1ccncc1C[NH2+]Cc1c(Cl)cncc1Cl ZINC000865602473 1043116410 /nfs/dbraw/zinc/11/64/10/1043116410.db2.gz CWGGKZZTHVAVJC-UHFFFAOYSA-N 1 2 324.255 4.371 20 0 DIADLO CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000331292443 1043116546 /nfs/dbraw/zinc/11/65/46/1043116546.db2.gz QEFYMTUUKDPWKR-DQYPLSBCSA-N 1 2 318.461 4.319 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)NCc1ccn2cc[nH+]c2c1 ZINC000178157562 1043122825 /nfs/dbraw/zinc/12/28/25/1043122825.db2.gz FONBNUBPTGQHQG-UHFFFAOYSA-N 1 2 322.412 4.088 20 0 DIADLO Fc1cccc(C[NH2+]Cc2ccc(CSC(F)F)o2)c1F ZINC000865676864 1043123886 /nfs/dbraw/zinc/12/38/86/1043123886.db2.gz QIUKQDKUZSBBBK-UHFFFAOYSA-N 1 2 319.323 4.303 20 0 DIADLO Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]Cc1ccon1 ZINC000178261805 1043125437 /nfs/dbraw/zinc/12/54/37/1043125437.db2.gz CKDBAEBOCSCOEY-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO Clc1ccccc1OC[C@H]1CCC[N@H+](Cc2cscn2)C1 ZINC000179005453 1043139175 /nfs/dbraw/zinc/13/91/75/1043139175.db2.gz VJTZERPKQBYUDW-ZDUSSCGKSA-N 1 2 322.861 4.088 20 0 DIADLO Clc1ccccc1OC[C@H]1CCC[N@@H+](Cc2cscn2)C1 ZINC000179005453 1043139182 /nfs/dbraw/zinc/13/91/82/1043139182.db2.gz VJTZERPKQBYUDW-ZDUSSCGKSA-N 1 2 322.861 4.088 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2nc3ccccc3[nH]2)C2CCCCC2)on1 ZINC000865841655 1043140082 /nfs/dbraw/zinc/14/00/82/1043140082.db2.gz GXPMEEWEEDMVDA-SFHVURJKSA-N 1 2 324.428 4.271 20 0 DIADLO Cc1c[nH]c(C[NH2+][C@H](c2nc3ccccc3[nH]2)C2CCCCC2)n1 ZINC000865841259 1043140346 /nfs/dbraw/zinc/14/03/46/1043140346.db2.gz AKDACDVPQOGERK-SFHVURJKSA-N 1 2 323.444 4.006 20 0 DIADLO C[C@H](NCc1ccc(F)c(C[NH+](C)C)c1)c1cccc(F)c1F ZINC000183265182 1043159306 /nfs/dbraw/zinc/15/93/06/1043159306.db2.gz FSAGIHCDZVAEPN-LBPRGKRZSA-N 1 2 322.374 4.016 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)cs1 ZINC000866238675 1043164200 /nfs/dbraw/zinc/16/42/00/1043164200.db2.gz MSGNEBYSSCQARI-QMMMGPOBSA-N 1 2 307.806 4.097 20 0 DIADLO Cc1cncc(C[N@@H+](C)[C@H](C)c2ccccc2Br)c1 ZINC000189811330 1043165830 /nfs/dbraw/zinc/16/58/30/1043165830.db2.gz UFFSGOQXYBODRA-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cncc(C[N@H+](C)[C@H](C)c2ccccc2Br)c1 ZINC000189811330 1043165832 /nfs/dbraw/zinc/16/58/32/1043165832.db2.gz UFFSGOQXYBODRA-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2sc(C)nc2C(F)(F)F)s1 ZINC000183671442 1043168110 /nfs/dbraw/zinc/16/81/10/1043168110.db2.gz DIXOUCBCEVOFGZ-SSDOTTSWSA-N 1 2 321.393 4.086 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1nc(C(C)(C)C)no1 ZINC000073984214 1043168273 /nfs/dbraw/zinc/16/82/73/1043168273.db2.gz IDSMVJYQEREAIA-WDEREUQCSA-N 1 2 307.825 4.432 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2sc(-c3ccccc3)nc2C)o1 ZINC000183743655 1043171078 /nfs/dbraw/zinc/17/10/78/1043171078.db2.gz RHNZBEMGXLNFHD-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](C)c2cc3ccccc3s2)n1 ZINC000184351507 1043183642 /nfs/dbraw/zinc/18/36/42/1043183642.db2.gz DNVDTHOVWOYGRU-NSHDSACASA-N 1 2 301.415 4.259 20 0 DIADLO CCCNc1ccc(C[NH2+][C@H]2c3ccccc3OC[C@@H]2F)cc1 ZINC000866348047 1043186525 /nfs/dbraw/zinc/18/65/25/1043186525.db2.gz MHCFLOVUTNXZEW-HKUYNNGSSA-N 1 2 314.404 4.070 20 0 DIADLO CC(=O)Nc1cccc(C[NH2+][C@@H](C)c2csc(C(C)C)n2)c1 ZINC000184726528 1043188329 /nfs/dbraw/zinc/18/83/29/1043188329.db2.gz LMFDLXZQJMQWGR-LBPRGKRZSA-N 1 2 317.458 4.076 20 0 DIADLO Cc1[nH+]c(NCc2ccsc2Cl)ccc1-c1cnn(C)c1 ZINC001202521291 1043201131 /nfs/dbraw/zinc/20/11/31/1043201131.db2.gz TUKRWXWAPONKPJ-UHFFFAOYSA-N 1 2 318.833 4.118 20 0 DIADLO CC[N@H+](Cc1ccccc1N(C)C)Cc1c(F)cccc1F ZINC000441542509 1043212825 /nfs/dbraw/zinc/21/28/25/1043212825.db2.gz DTFWFQDOKSYEDN-UHFFFAOYSA-N 1 2 304.384 4.053 20 0 DIADLO CC[N@@H+](Cc1ccccc1N(C)C)Cc1c(F)cccc1F ZINC000441542509 1043212836 /nfs/dbraw/zinc/21/28/36/1043212836.db2.gz DTFWFQDOKSYEDN-UHFFFAOYSA-N 1 2 304.384 4.053 20 0 DIADLO Fc1ccc(NC2CCN(c3cccc[nH+]3)CC2)cc1C(F)F ZINC000866509171 1043213485 /nfs/dbraw/zinc/21/34/85/1043213485.db2.gz VARPBIGZJQTWCQ-UHFFFAOYSA-N 1 2 321.346 4.239 20 0 DIADLO COc1ccsc1[C@H](C)[NH2+]Cc1csc(-c2ccco2)n1 ZINC000186197472 1043216606 /nfs/dbraw/zinc/21/66/06/1043216606.db2.gz KLTOLMRLQSVNFA-JTQLQIEISA-N 1 2 320.439 4.324 20 0 DIADLO CC(C)Oc1ccc(C[NH2+][C@@H](C)c2csc(C(C)C)n2)cn1 ZINC000186250584 1043219639 /nfs/dbraw/zinc/21/96/39/1043219639.db2.gz XISBCWQAHMGEIT-ZDUSSCGKSA-N 1 2 319.474 4.300 20 0 DIADLO COc1cc(C)ccc1C[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000186383695 1043222277 /nfs/dbraw/zinc/22/22/77/1043222277.db2.gz PBNBHORATCJXCU-CYBMUJFWSA-N 1 2 304.459 4.434 20 0 DIADLO CC(C)c1ccc(C[NH2+]Cc2cc(COC(C)(C)C)on2)cc1 ZINC000186421281 1043222478 /nfs/dbraw/zinc/22/24/78/1043222478.db2.gz ZWFXLMCIORZBET-UHFFFAOYSA-N 1 2 316.445 4.403 20 0 DIADLO COc1cc(C)ccc1C[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000186383682 1043223567 /nfs/dbraw/zinc/22/35/67/1043223567.db2.gz PBNBHORATCJXCU-ZDUSSCGKSA-N 1 2 304.459 4.434 20 0 DIADLO CC(C)c1nc([C@H](C)Nc2ccc(N3CCCC3)[nH+]c2)cs1 ZINC000186467675 1043225492 /nfs/dbraw/zinc/22/54/92/1043225492.db2.gz CGGAYFOZEZONGC-ZDUSSCGKSA-N 1 2 316.474 4.435 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1F)c1nccn1C ZINC000866576506 1043227329 /nfs/dbraw/zinc/22/73/29/1043227329.db2.gz GODDBFJXHJUTEW-LBPRGKRZSA-N 1 2 316.207 4.107 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(C(C)(C)C)o1)c1nc2ccccc2n1C ZINC000866574735 1043227476 /nfs/dbraw/zinc/22/74/76/1043227476.db2.gz XXICXAWBKOFGHA-CYBMUJFWSA-N 1 2 311.429 4.315 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2csc(C(F)(F)F)n2)CC1 ZINC000895091899 1043240087 /nfs/dbraw/zinc/24/00/87/1043240087.db2.gz JSQZJRLGNCRWEC-UHFFFAOYSA-N 1 2 312.360 4.249 20 0 DIADLO Fc1ccc([C@@H]([NH2+][C@@H]2CCCc3ccccc32)c2ncc[nH]2)cc1 ZINC000187677929 1043248510 /nfs/dbraw/zinc/24/85/10/1043248510.db2.gz SXFIJPTYZJCURZ-RTBURBONSA-N 1 2 321.399 4.305 20 0 DIADLO Fc1ccc([C@H]([NH2+][C@@H]2CCCc3ccccc32)c2ncc[nH]2)cc1 ZINC000187677880 1043248905 /nfs/dbraw/zinc/24/89/05/1043248905.db2.gz SXFIJPTYZJCURZ-MOPGFXCFSA-N 1 2 321.399 4.305 20 0 DIADLO COCc1cccc(CNc2ccc([N@@H+]3C[C@H]4CC[C@@H]3C4)cc2)c1 ZINC000192215119 1043266328 /nfs/dbraw/zinc/26/63/28/1043266328.db2.gz SMTVLEDPMXSUFF-LAUBAEHRSA-N 1 2 322.452 4.434 20 0 DIADLO COCc1cccc(CNc2ccc([N@H+]3C[C@H]4CC[C@@H]3C4)cc2)c1 ZINC000192215119 1043266344 /nfs/dbraw/zinc/26/63/44/1043266344.db2.gz SMTVLEDPMXSUFF-LAUBAEHRSA-N 1 2 322.452 4.434 20 0 DIADLO CC(C)(C)n1cc(CNc2ccc([N@@H+]3C[C@H]4CC[C@@H]3C4)cc2)cn1 ZINC000192217478 1043267334 /nfs/dbraw/zinc/26/73/34/1043267334.db2.gz MUPKFEDYSBALJX-HNAYVOBHSA-N 1 2 324.472 4.239 20 0 DIADLO CC(C)(C)n1cc(CNc2ccc([N@H+]3C[C@H]4CC[C@@H]3C4)cc2)cn1 ZINC000192217478 1043267347 /nfs/dbraw/zinc/26/73/47/1043267347.db2.gz MUPKFEDYSBALJX-HNAYVOBHSA-N 1 2 324.472 4.239 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@@H]1CCCc2occc21)c1ccco1 ZINC000192795727 1043274529 /nfs/dbraw/zinc/27/45/29/1043274529.db2.gz GUEGMCCTHFOZFZ-CVEARBPZSA-N 1 2 303.402 4.254 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@@H]1CCCc2occc21)c1ccco1 ZINC000192795736 1043275882 /nfs/dbraw/zinc/27/58/82/1043275882.db2.gz GUEGMCCTHFOZFZ-HZPDHXFCSA-N 1 2 303.402 4.254 20 0 DIADLO FC(F)Oc1ccc(Nc2ccn3cc[nH+]c3c2)cc1Cl ZINC001204978593 1043286611 /nfs/dbraw/zinc/28/66/11/1043286611.db2.gz WCQTWRRAVNXVBW-UHFFFAOYSA-N 1 2 309.703 4.333 20 0 DIADLO CCc1ccc([C@H]2CCN(C(=O)c3c(C)cc(C)[nH+]c3C)C2)cc1 ZINC001274275177 1043302900 /nfs/dbraw/zinc/30/29/00/1043302900.db2.gz UKYINYQYKFKKDP-IBGZPJMESA-N 1 2 322.452 4.199 20 0 DIADLO c1ccc([C@H]([NH2+][C@H]2COCc3ccccc32)c2ccccn2)cc1 ZINC000428216052 1043330031 /nfs/dbraw/zinc/33/00/31/1043330031.db2.gz BFDJEPFACLFTCD-SFTDATJTSA-N 1 2 316.404 4.032 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1nc(C(F)(F)F)cs1 ZINC000268974774 1043346170 /nfs/dbraw/zinc/34/61/70/1043346170.db2.gz JATQLEBQMVIXSI-SECBINFHSA-N 1 2 316.348 4.021 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(-c3ccccc3)no2)cc1 ZINC000269043463 1043352488 /nfs/dbraw/zinc/35/24/88/1043352488.db2.gz DOEXFDRTHJHRRI-KGLIPLIRSA-N 1 2 323.396 4.157 20 0 DIADLO Cc1nnsc1C[N@@H+](C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000521253139 1043380964 /nfs/dbraw/zinc/38/09/64/1043380964.db2.gz UZIPQELOXMHGQN-SECBINFHSA-N 1 2 316.257 4.346 20 0 DIADLO Cc1nnsc1C[N@H+](C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000521253139 1043380971 /nfs/dbraw/zinc/38/09/71/1043380971.db2.gz UZIPQELOXMHGQN-SECBINFHSA-N 1 2 316.257 4.346 20 0 DIADLO Cc1cc(C)c(NC(=O)CCc2cc3ccccc3o2)c(C)[nH+]1 ZINC000521343451 1043389432 /nfs/dbraw/zinc/38/94/32/1043389432.db2.gz PNFRJYGBLXULGM-UHFFFAOYSA-N 1 2 308.381 4.324 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2F)[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270593975 1043390885 /nfs/dbraw/zinc/39/08/85/1043390885.db2.gz KRCBATBJKHKOOW-MLGOLLRUSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270593975 1043390892 /nfs/dbraw/zinc/39/08/92/1043390892.db2.gz KRCBATBJKHKOOW-MLGOLLRUSA-N 1 2 300.377 4.274 20 0 DIADLO CC(C)c1csc(C[NH2+][C@@H]2CCc3c2nccc3Cl)n1 ZINC000925283297 1043405891 /nfs/dbraw/zinc/40/58/91/1043405891.db2.gz PZKWZPPWHPROHF-GFCCVEGCSA-N 1 2 307.850 4.092 20 0 DIADLO CC(C)c1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(F)c(Cl)c2)[nH]1 ZINC000271434715 1043416301 /nfs/dbraw/zinc/41/63/01/1043416301.db2.gz DRINFIBZGXQJIQ-NXEZZACHSA-N 1 2 310.804 4.132 20 0 DIADLO CCOC(=O)[C@@H](c1ccccc1)[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000558054350 1043428821 /nfs/dbraw/zinc/42/88/21/1043428821.db2.gz URYZWXIHKWTZGU-IAGOWNOFSA-N 1 2 315.438 4.189 20 0 DIADLO CCOC(=O)[C@@H](c1ccccc1)[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000558054350 1043428829 /nfs/dbraw/zinc/42/88/29/1043428829.db2.gz URYZWXIHKWTZGU-IAGOWNOFSA-N 1 2 315.438 4.189 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nnc(C(C)C)[nH]1)c1ccc(F)cc1F ZINC000271535737 1043431568 /nfs/dbraw/zinc/43/15/68/1043431568.db2.gz QGVBOXZDXSMQHU-QMTHXVAHSA-N 1 2 308.376 4.008 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@@H](C)c1cnccc1C)c1ccco1 ZINC000271561418 1043436111 /nfs/dbraw/zinc/43/61/11/1043436111.db2.gz WVPAAJULFPHVHI-MGPUTAFESA-N 1 2 322.408 4.432 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2ccccc2SC)[nH]1 ZINC000442859786 1043436653 /nfs/dbraw/zinc/43/66/53/1043436653.db2.gz REWXUUIMUNWBPJ-YNEHKIRRSA-N 1 2 318.490 4.452 20 0 DIADLO Fc1ccc(F)c2c1CC[C@@H]2[NH2+]Cc1nc(C2CC2)cs1 ZINC000271558827 1043436761 /nfs/dbraw/zinc/43/67/61/1043436761.db2.gz WJLHUYFPYWEYQK-ZDUSSCGKSA-N 1 2 306.381 4.076 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@H](C)c1cnccc1C)c1ccco1 ZINC000271561423 1043437403 /nfs/dbraw/zinc/43/74/03/1043437403.db2.gz WVPAAJULFPHVHI-QRWLVFNGSA-N 1 2 322.408 4.432 20 0 DIADLO CCOc1cc(Cl)ccc1C[NH2+][C@@H]1CCCc2oc(C)nc21 ZINC000925605726 1043438610 /nfs/dbraw/zinc/43/86/10/1043438610.db2.gz HZWYFYXNADHLRD-CQSZACIVSA-N 1 2 320.820 4.202 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H](C)c1nnc(C(C)C)[nH]1 ZINC000271593495 1043441078 /nfs/dbraw/zinc/44/10/78/1043441078.db2.gz YPQFEHLYUWIACY-STQMWFEESA-N 1 2 312.417 4.395 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1nnc(C(C)C)[nH]1 ZINC000442872464 1043441136 /nfs/dbraw/zinc/44/11/36/1043441136.db2.gz NMUCMGQTCHOYAN-NEPJUHHUSA-N 1 2 304.463 4.062 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)[nH]1 ZINC000271594964 1043442227 /nfs/dbraw/zinc/44/22/27/1043442227.db2.gz YUEQBFXNBZPELX-IUCAKERBSA-N 1 2 313.232 4.086 20 0 DIADLO CO[C@H](C)c1noc(C[NH2+][C@@H](CC(C)(C)C)c2ccccc2)n1 ZINC000271639164 1043443671 /nfs/dbraw/zinc/44/36/71/1043443671.db2.gz CGRWCWMKOZXGMM-HIFRSBDPSA-N 1 2 317.433 4.044 20 0 DIADLO COc1cccc(C[N@@H+]2CCCn3c(cc4ccccc43)C2)c1 ZINC000558171472 1043449379 /nfs/dbraw/zinc/44/93/79/1043449379.db2.gz BGACAMFGKRJWFR-UHFFFAOYSA-N 1 2 306.409 4.056 20 0 DIADLO COc1cccc(C[N@H+]2CCCn3c(cc4ccccc43)C2)c1 ZINC000558171472 1043449395 /nfs/dbraw/zinc/44/93/95/1043449395.db2.gz BGACAMFGKRJWFR-UHFFFAOYSA-N 1 2 306.409 4.056 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+]3CCCc4occc4C3)o2)cc1 ZINC000558183851 1043452488 /nfs/dbraw/zinc/45/24/88/1043452488.db2.gz ZQQLTRPYTHCLHP-UHFFFAOYSA-N 1 2 308.381 4.191 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+]3CCCc4occc4C3)o2)cc1 ZINC000558183851 1043452495 /nfs/dbraw/zinc/45/24/95/1043452495.db2.gz ZQQLTRPYTHCLHP-UHFFFAOYSA-N 1 2 308.381 4.191 20 0 DIADLO Clc1ccnc2c1CC[C@H]2Nc1ccc([NH+]2CCCC2)cc1 ZINC000925726405 1043457600 /nfs/dbraw/zinc/45/76/00/1043457600.db2.gz HXJQIQVQRRWRBP-QGZVFWFLSA-N 1 2 313.832 4.435 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nnc(-c3ccccc3)[nH]2)cc(C)c1F ZINC000777573571 1043462267 /nfs/dbraw/zinc/46/22/67/1043462267.db2.gz BGNQNUZZIVPVQE-CQSZACIVSA-N 1 2 324.403 4.078 20 0 DIADLO Cc1cc(C)c([C@H](C)[NH2+]Cc2nnc(-c3ccccc3)[nH]2)cc1C ZINC000777573607 1043462281 /nfs/dbraw/zinc/46/22/81/1043462281.db2.gz CJYYXXIGCAOZKD-INIZCTEOSA-N 1 2 320.440 4.248 20 0 DIADLO Cc1cc(C)c([C@H](C)[NH2+]Cc2nc(-c3ccccc3)n[nH]2)cc1C ZINC000777573607 1043462291 /nfs/dbraw/zinc/46/22/91/1043462291.db2.gz CJYYXXIGCAOZKD-INIZCTEOSA-N 1 2 320.440 4.248 20 0 DIADLO C[C@@H](Nc1ccc2oc(C3CC3)nc2c1)c1cn2c([nH+]1)CCCC2 ZINC000925760902 1043465285 /nfs/dbraw/zinc/46/52/85/1043465285.db2.gz RQPALNPECTUXCT-GFCCVEGCSA-N 1 2 322.412 4.411 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1nc(-c2ccncc2)cs1 ZINC000872122694 1043468589 /nfs/dbraw/zinc/46/85/89/1043468589.db2.gz XWHXHCABUFGGTQ-CYBMUJFWSA-N 1 2 324.453 4.013 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+]Cc2nnc(-c3ccccc3)[nH]2)cc1 ZINC000777575387 1043474038 /nfs/dbraw/zinc/47/40/38/1043474038.db2.gz PZMGFISRNXOIIJ-CYBMUJFWSA-N 1 2 324.453 4.044 20 0 DIADLO CCCc1ccc([C@H](C)[NH2+]Cc2nnc(-c3ccccc3)[nH]2)cc1 ZINC000777575405 1043474419 /nfs/dbraw/zinc/47/44/19/1043474419.db2.gz QLTAKQNWEKBHKJ-HNNXBMFYSA-N 1 2 320.440 4.275 20 0 DIADLO Cc1cccc(-c2noc(C[N@@H+](Cc3ccco3)C(C)C)n2)c1 ZINC000521814360 1043477940 /nfs/dbraw/zinc/47/79/40/1043477940.db2.gz XMRUQHPOEUFZSZ-UHFFFAOYSA-N 1 2 311.385 4.049 20 0 DIADLO Cc1cccc(-c2noc(C[N@H+](Cc3ccco3)C(C)C)n2)c1 ZINC000521814360 1043477950 /nfs/dbraw/zinc/47/79/50/1043477950.db2.gz XMRUQHPOEUFZSZ-UHFFFAOYSA-N 1 2 311.385 4.049 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]C1(c2ccc(Cl)cc2)CC1 ZINC000925844265 1043480860 /nfs/dbraw/zinc/48/08/60/1043480860.db2.gz JHWDHCXIHLMRDM-AWEZNQCLSA-N 1 2 302.805 4.293 20 0 DIADLO CCC[C@@H](C)c1noc([C@@H]([NH3+])c2ccc(C(F)(F)F)cc2)n1 ZINC000872174911 1043484521 /nfs/dbraw/zinc/48/45/21/1043484521.db2.gz FYXAJTIBTHRXJN-SKDRFNHKSA-N 1 2 313.323 4.040 20 0 DIADLO c1ccc(-c2nnc(C[NH2+][C@@H]3CCCCc4ccccc43)[nH]2)cc1 ZINC000777579134 1043487112 /nfs/dbraw/zinc/48/71/12/1043487112.db2.gz QNHAKJJZMJUVGM-GOSISDBHSA-N 1 2 318.424 4.029 20 0 DIADLO CC(C)[N@H+](Cc1nc2c(s1)C[C@@H](C)CC2)Cc1cccnc1 ZINC000349274532 1043500273 /nfs/dbraw/zinc/50/02/73/1043500273.db2.gz GEESPARVAGBVEH-AWEZNQCLSA-N 1 2 315.486 4.074 20 0 DIADLO CC(C)[N@@H+](Cc1nc2c(s1)C[C@@H](C)CC2)Cc1cccnc1 ZINC000349274532 1043500283 /nfs/dbraw/zinc/50/02/83/1043500283.db2.gz GEESPARVAGBVEH-AWEZNQCLSA-N 1 2 315.486 4.074 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)CC(=O)N1[C@H](C)CCC[C@@H]1C ZINC000521921933 1043505301 /nfs/dbraw/zinc/50/53/01/1043505301.db2.gz PIHWFXHXQNFYDX-QLFBSQMISA-N 1 2 322.880 4.122 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)CC(=O)N1[C@H](C)CCC[C@@H]1C ZINC000521921933 1043505308 /nfs/dbraw/zinc/50/53/08/1043505308.db2.gz PIHWFXHXQNFYDX-QLFBSQMISA-N 1 2 322.880 4.122 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc(C(F)(F)F)nc2)nc(C2CC2)[nH+]1 ZINC000872766352 1043506839 /nfs/dbraw/zinc/50/68/39/1043506839.db2.gz CFFHIYLDPVCXTI-SNVBAGLBSA-N 1 2 322.334 4.249 20 0 DIADLO Cc1ccsc1C[N@H+](C)Cc1csc(-c2ccccn2)n1 ZINC000349563397 1043510340 /nfs/dbraw/zinc/51/03/40/1043510340.db2.gz OEHQJUSKYKJUDR-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO Cc1ccsc1C[N@@H+](C)Cc1csc(-c2ccccn2)n1 ZINC000349563397 1043510353 /nfs/dbraw/zinc/51/03/53/1043510353.db2.gz OEHQJUSKYKJUDR-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO C[NH+](C)c1ccc(NC2CCC(C(=O)OC(C)(C)C)CC2)cc1 ZINC000124327840 1043511042 /nfs/dbraw/zinc/51/10/42/1043511042.db2.gz IVPKLPGJEQILFP-UHFFFAOYSA-N 1 2 318.461 4.065 20 0 DIADLO CN(C)c1ccc([NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)cc1 ZINC000124327840 1043511053 /nfs/dbraw/zinc/51/10/53/1043511053.db2.gz IVPKLPGJEQILFP-UHFFFAOYSA-N 1 2 318.461 4.065 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1cccc(Br)n1 ZINC000926024586 1043511126 /nfs/dbraw/zinc/51/11/26/1043511126.db2.gz ABMOYADMXWMJDE-NSHDSACASA-N 1 2 320.234 4.083 20 0 DIADLO Cc1ncc(C[NH+](Cc2cccs2)Cc2cccs2)cn1 ZINC000349561288 1043511776 /nfs/dbraw/zinc/51/17/76/1043511776.db2.gz HLHINJIARZRTJW-UHFFFAOYSA-N 1 2 315.467 4.110 20 0 DIADLO Clc1cnc(C[NH2+][C@H]2CCOc3c(Cl)cccc32)s1 ZINC000349628478 1043515966 /nfs/dbraw/zinc/51/59/66/1043515966.db2.gz GDHGHONHVZMSGJ-JTQLQIEISA-N 1 2 315.225 4.063 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](C)Cc2cnn(-c3ccccc3)c2)o1 ZINC000349642269 1043517489 /nfs/dbraw/zinc/51/74/89/1043517489.db2.gz PTUKZFCHCROEKE-KXBFYZLASA-N 1 2 321.424 4.221 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)o1 ZINC000349642269 1043517499 /nfs/dbraw/zinc/51/74/99/1043517499.db2.gz PTUKZFCHCROEKE-KXBFYZLASA-N 1 2 321.424 4.221 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000349650516 1043517773 /nfs/dbraw/zinc/51/77/73/1043517773.db2.gz AWWFPNXAWASCQB-BXUZGUMPSA-N 1 2 315.442 4.053 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000349650516 1043517782 /nfs/dbraw/zinc/51/77/82/1043517782.db2.gz AWWFPNXAWASCQB-BXUZGUMPSA-N 1 2 315.442 4.053 20 0 DIADLO Cc1noc(C)c1[C@H](C)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000926079840 1043519534 /nfs/dbraw/zinc/51/95/34/1043519534.db2.gz WYLBOVGOSOHPJY-JTQLQIEISA-N 1 2 316.792 4.304 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1ncc(Cl)s1 ZINC000873164899 1043521315 /nfs/dbraw/zinc/52/13/15/1043521315.db2.gz GNDJATRYGRFYAO-UHFFFAOYSA-N 1 2 301.242 4.302 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@@H]1CCCOc2c(F)cccc21 ZINC000926111837 1043530106 /nfs/dbraw/zinc/53/01/06/1043530106.db2.gz KIGIEEYKUHTZAG-HUUCEWRRSA-N 1 2 316.376 4.003 20 0 DIADLO Clc1ccc2c(c1)CC[N@@H+](Cc1ccc(N3CCCC3)o1)C2 ZINC001137069795 1043531409 /nfs/dbraw/zinc/53/14/09/1043531409.db2.gz NOPVSRLSEFTOTC-UHFFFAOYSA-N 1 2 316.832 4.092 20 0 DIADLO Clc1ccc2c(c1)CC[N@H+](Cc1ccc(N3CCCC3)o1)C2 ZINC001137069795 1043531416 /nfs/dbraw/zinc/53/14/16/1043531416.db2.gz NOPVSRLSEFTOTC-UHFFFAOYSA-N 1 2 316.832 4.092 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H]1C[C@@H](C)n2ncnc21)c1ccc(Cl)cc1F ZINC000926127889 1043531714 /nfs/dbraw/zinc/53/17/14/1043531714.db2.gz KRHJLQCXVGAGIO-KMUNFCNLSA-N 1 2 322.815 4.063 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)no1 ZINC000522096478 1043537369 /nfs/dbraw/zinc/53/73/69/1043537369.db2.gz FYTPIWDLDVIOHL-CQSZACIVSA-N 1 2 319.836 4.055 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)no1 ZINC000522096478 1043537372 /nfs/dbraw/zinc/53/73/72/1043537372.db2.gz FYTPIWDLDVIOHL-CQSZACIVSA-N 1 2 319.836 4.055 20 0 DIADLO CC(=O)Nc1ccc(C[N@@H+](C)Cc2c(F)cccc2Cl)cc1 ZINC000350074922 1043537884 /nfs/dbraw/zinc/53/78/84/1043537884.db2.gz LTEMCFWTIOYOPT-UHFFFAOYSA-N 1 2 320.795 4.070 20 0 DIADLO CC(=O)Nc1ccc(C[N@H+](C)Cc2c(F)cccc2Cl)cc1 ZINC000350074922 1043537894 /nfs/dbraw/zinc/53/78/94/1043537894.db2.gz LTEMCFWTIOYOPT-UHFFFAOYSA-N 1 2 320.795 4.070 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2c2nc3cccc(F)c3s2)[nH+]c1C ZINC000895196314 1043560394 /nfs/dbraw/zinc/56/03/94/1043560394.db2.gz KOSNEWWSWFZJCY-CYBMUJFWSA-N 1 2 316.405 4.117 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1cc(F)c(Cl)cc1F ZINC000926321688 1043564368 /nfs/dbraw/zinc/56/43/68/1043564368.db2.gz NYDXCDOCVROVEB-ZETCQYMHSA-N 1 2 300.736 4.074 20 0 DIADLO Cc1oc(C(C)C)cc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000351957422 1043565136 /nfs/dbraw/zinc/56/51/36/1043565136.db2.gz GISKRAFVLUSQAV-UHFFFAOYSA-N 1 2 309.369 4.354 20 0 DIADLO C[C@@H]([NH2+]Cc1cc2cc(F)ccc2o1)c1c(F)cncc1F ZINC000353120077 1043584525 /nfs/dbraw/zinc/58/45/25/1043584525.db2.gz PDKDASRUGCREQC-SECBINFHSA-N 1 2 306.287 4.096 20 0 DIADLO C/C=C\c1ccc(NC(=O)N2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)cc1 ZINC000353243932 1043593810 /nfs/dbraw/zinc/59/38/10/1043593810.db2.gz NNZVSTMMZLKFTL-IGMKCIBUSA-N 1 2 324.428 4.031 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](c1ccc(C)cc1)c1cccnc1 ZINC000926532939 1043594532 /nfs/dbraw/zinc/59/45/32/1043594532.db2.gz OCDGURVFMUCGFJ-LPHOPBHVSA-N 1 2 320.440 4.047 20 0 DIADLO C[C@@H](c1ccccc1)N(C(=O)Nc1ccn2cc[nH+]c2c1)C1CC1 ZINC000353324963 1043600529 /nfs/dbraw/zinc/60/05/29/1043600529.db2.gz YBEJJQMNBSSAFY-AWEZNQCLSA-N 1 2 320.396 4.092 20 0 DIADLO C[NH+](C)c1ccc(N[C@H](C[C@H]2CCOC2)c2ccccc2)cc1 ZINC000777602307 1043602033 /nfs/dbraw/zinc/60/20/33/1043602033.db2.gz KHYLQAIVNVJALG-OXQOHEQNSA-N 1 2 310.441 4.332 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1ccc(-n2cccn2)cc1 ZINC000777602104 1043604379 /nfs/dbraw/zinc/60/43/79/1043604379.db2.gz GTBVSQSASIHZRO-HNNXBMFYSA-N 1 2 306.413 4.111 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cccc(C)c2)Cc2ccccn2)o1 ZINC000353419279 1043606890 /nfs/dbraw/zinc/60/68/90/1043606890.db2.gz KGVOSDILFOZDLI-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cccc(C)c2)Cc2ccccn2)o1 ZINC000353419279 1043606893 /nfs/dbraw/zinc/60/68/93/1043606893.db2.gz KGVOSDILFOZDLI-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO CCc1ccc(C[N@H+](Cc2ccco2)Cc2ccc(O)cc2)o1 ZINC000353446655 1043609626 /nfs/dbraw/zinc/60/96/26/1043609626.db2.gz JMSXODZPPFVNRW-UHFFFAOYSA-N 1 2 311.381 4.343 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2ccco2)Cc2ccc(O)cc2)o1 ZINC000353446655 1043609637 /nfs/dbraw/zinc/60/96/37/1043609637.db2.gz JMSXODZPPFVNRW-UHFFFAOYSA-N 1 2 311.381 4.343 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)s1 ZINC000353555802 1043618697 /nfs/dbraw/zinc/61/86/97/1043618697.db2.gz DQUAAFGYWNAJPZ-LLVKDONJSA-N 1 2 301.415 4.006 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc(Cl)cc(Cl)c1F)c1nccn1C ZINC000926728311 1043622499 /nfs/dbraw/zinc/62/24/99/1043622499.db2.gz SCBBMHOPUJTTKZ-RKDXNWHRSA-N 1 2 316.207 4.278 20 0 DIADLO COc1cc(F)c([C@@H](C)Nc2ccc([NH+](C)C)cc2)cc1OC ZINC000777604210 1043624933 /nfs/dbraw/zinc/62/49/33/1043624933.db2.gz HMYGIQRTAAHXJZ-GFCCVEGCSA-N 1 2 318.392 4.082 20 0 DIADLO C[C@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1ccnn1CC1CCC1 ZINC000926810744 1043634978 /nfs/dbraw/zinc/63/49/78/1043634978.db2.gz WQSQBDZKHOEORN-SUMWQHHRSA-N 1 2 319.399 4.184 20 0 DIADLO C[C@@]12CC[N@H+](Cc3ccc(F)c(F)c3F)C[C@@H]1C2(Cl)Cl ZINC000825823951 1043638933 /nfs/dbraw/zinc/63/89/33/1043638933.db2.gz CUEVLIYOYUSWHI-GXFFZTMASA-N 1 2 324.173 4.120 20 0 DIADLO C[C@@]12CC[N@@H+](Cc3ccc(F)c(F)c3F)C[C@@H]1C2(Cl)Cl ZINC000825823951 1043638938 /nfs/dbraw/zinc/63/89/38/1043638938.db2.gz CUEVLIYOYUSWHI-GXFFZTMASA-N 1 2 324.173 4.120 20 0 DIADLO Cc1oc2ccccc2c1[C@@H](C)[NH2+]C1(c2ncccn2)CCC1 ZINC000926851876 1043642473 /nfs/dbraw/zinc/64/24/73/1043642473.db2.gz MNTAJSMITGVRIC-CYBMUJFWSA-N 1 2 307.397 4.261 20 0 DIADLO Cc1cc(N[C@H](C)c2cccc(Br)n2)c[nH+]c1C ZINC000926856506 1043644612 /nfs/dbraw/zinc/64/46/12/1043644612.db2.gz VFNPBVRYNAWSCP-LLVKDONJSA-N 1 2 306.207 4.029 20 0 DIADLO C[C@H]([NH2+][C@@H]1c2ccccc2OC[C@H]1F)c1cc2ccccc2[nH]1 ZINC000926889290 1043647909 /nfs/dbraw/zinc/64/79/09/1043647909.db2.gz NUJDWUFQGVTDKB-IOHHAYIISA-N 1 2 310.372 4.290 20 0 DIADLO Clc1cccc2c1[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)COC2 ZINC000926895826 1043649821 /nfs/dbraw/zinc/64/98/21/1043649821.db2.gz YBRAKCAERWLWFA-SJLPKXTDSA-N 1 2 314.816 4.047 20 0 DIADLO Clc1cccc2c1[C@@H]([NH2+][C@H](c1ccccn1)C1CC1)COC2 ZINC000926895827 1043650513 /nfs/dbraw/zinc/65/05/13/1043650513.db2.gz YBRAKCAERWLWFA-WMZOPIPTSA-N 1 2 314.816 4.047 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc2ccccc2n1 ZINC000353934933 1043662612 /nfs/dbraw/zinc/66/26/12/1043662612.db2.gz RWGUPACSCYNOPL-RYUDHWBXSA-N 1 2 313.351 4.320 20 0 DIADLO CC(C)[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc(F)cn1 ZINC000354023440 1043674436 /nfs/dbraw/zinc/67/44/36/1043674436.db2.gz YKWDOKVVJWAYOS-SFHVURJKSA-N 1 2 314.408 4.025 20 0 DIADLO CC[C@H]1CCCC[C@@H]1Nc1nc(C)[nH+]c(C)c1Br ZINC000322762553 1043679986 /nfs/dbraw/zinc/67/99/86/1043679986.db2.gz CQSRVTDRYATBAL-RYUDHWBXSA-N 1 2 312.255 4.237 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(Br)cc(F)c2F)C2(CC2)C1 ZINC001141805706 1043682366 /nfs/dbraw/zinc/68/23/66/1043682366.db2.gz YRIQFYJNBKIRNS-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(Br)cc(F)c2F)C2(CC2)C1 ZINC001141805706 1043682373 /nfs/dbraw/zinc/68/23/73/1043682373.db2.gz YRIQFYJNBKIRNS-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO C[N@H+](Cc1ccns1)Cc1ccc(OC(F)F)c(Cl)c1 ZINC000895453355 1043684907 /nfs/dbraw/zinc/68/49/07/1043684907.db2.gz JWBKPJXCPXGRBV-UHFFFAOYSA-N 1 2 318.776 4.030 20 0 DIADLO C[N@@H+](Cc1ccns1)Cc1ccc(OC(F)F)c(Cl)c1 ZINC000895453355 1043684914 /nfs/dbraw/zinc/68/49/14/1043684914.db2.gz JWBKPJXCPXGRBV-UHFFFAOYSA-N 1 2 318.776 4.030 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1cccc(Cl)c1Cl ZINC000927111978 1043689486 /nfs/dbraw/zinc/68/94/86/1043689486.db2.gz CPMFLYYGLUJLEO-JTQLQIEISA-N 1 2 324.255 4.455 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000354358436 1043695525 /nfs/dbraw/zinc/69/55/25/1043695525.db2.gz KNISOSSLVSYSDV-UHFFFAOYSA-N 1 2 304.777 4.269 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000354358436 1043695530 /nfs/dbraw/zinc/69/55/30/1043695530.db2.gz KNISOSSLVSYSDV-UHFFFAOYSA-N 1 2 304.777 4.269 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1cnc(-c2cccs2)s1 ZINC000354357789 1043696739 /nfs/dbraw/zinc/69/67/39/1043696739.db2.gz FIMCLFBQKALIKT-UHFFFAOYSA-N 1 2 319.455 4.054 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1cnc(-c2cccs2)s1 ZINC000354357789 1043696750 /nfs/dbraw/zinc/69/67/50/1043696750.db2.gz FIMCLFBQKALIKT-UHFFFAOYSA-N 1 2 319.455 4.054 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccccc2CC(F)(F)F)no1 ZINC000876593831 1043701542 /nfs/dbraw/zinc/70/15/42/1043701542.db2.gz YJKJDSXUOHEOSM-MRXNPFEDSA-N 1 2 324.346 4.425 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccccc2CC(F)(F)F)no1 ZINC000876593831 1043701549 /nfs/dbraw/zinc/70/15/49/1043701549.db2.gz YJKJDSXUOHEOSM-MRXNPFEDSA-N 1 2 324.346 4.425 20 0 DIADLO Cc1ccc(C)c([C@@H]2CCC[N@@H+]2Cc2noc(C(C)(C)C)n2)c1 ZINC000474226436 1043702056 /nfs/dbraw/zinc/70/20/56/1043702056.db2.gz KNFKGDSOPLILRY-INIZCTEOSA-N 1 2 313.445 4.321 20 0 DIADLO Cc1ccc(C)c([C@@H]2CCC[N@H+]2Cc2noc(C(C)(C)C)n2)c1 ZINC000474226436 1043702070 /nfs/dbraw/zinc/70/20/70/1043702070.db2.gz KNFKGDSOPLILRY-INIZCTEOSA-N 1 2 313.445 4.321 20 0 DIADLO C[C@H](C[C@@H]1CCCO1)Nc1[nH+]cccc1OCc1ccccc1 ZINC000354578739 1043710931 /nfs/dbraw/zinc/71/09/31/1043710931.db2.gz QQWIJVVAZKAKLV-WBVHZDCISA-N 1 2 312.413 4.030 20 0 DIADLO C[C@@H](C[C@H]1CCCO1)Nc1[nH+]cccc1OCc1ccccc1 ZINC000354578736 1043711105 /nfs/dbraw/zinc/71/11/05/1043711105.db2.gz QQWIJVVAZKAKLV-DOTOQJQBSA-N 1 2 312.413 4.030 20 0 DIADLO CCO[P@@](C)(=O)CC[C@H](C)Nc1ccc([NH+]2CCCC2)cc1 ZINC000876820693 1043714192 /nfs/dbraw/zinc/71/41/92/1043714192.db2.gz QSTYNJXSDSHVJO-OYHNWAKOSA-N 1 2 324.405 4.422 20 0 DIADLO CCO[P@@](C)(=O)CC[C@H](C)[NH2+]c1ccc(N2CCCC2)cc1 ZINC000876820693 1043714198 /nfs/dbraw/zinc/71/41/98/1043714198.db2.gz QSTYNJXSDSHVJO-OYHNWAKOSA-N 1 2 324.405 4.422 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+](Cc3ncc(Cl)s3)C2)c1 ZINC001137113002 1043716842 /nfs/dbraw/zinc/71/68/42/1043716842.db2.gz OCMRUMOUSKFRHN-CYBMUJFWSA-N 1 2 322.861 4.185 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+](Cc3ncc(Cl)s3)C2)c1 ZINC001137113002 1043716849 /nfs/dbraw/zinc/71/68/49/1043716849.db2.gz OCMRUMOUSKFRHN-CYBMUJFWSA-N 1 2 322.861 4.185 20 0 DIADLO Fc1cccc2c1SCC[C@@H]2[NH2+]Cc1nc(Cl)cs1 ZINC000876911511 1043723368 /nfs/dbraw/zinc/72/33/68/1043723368.db2.gz FYALHLNCIQOJJQ-JTQLQIEISA-N 1 2 314.838 4.262 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nc(Cl)cs1)c1nc2ccccc2[nH]1 ZINC000876985979 1043730637 /nfs/dbraw/zinc/73/06/37/1043730637.db2.gz WCQPMIUIXFYXNA-AWEZNQCLSA-N 1 2 320.849 4.160 20 0 DIADLO CCCc1nc(C)c(NCc2ccc(-n3cc[nH+]c3)cc2)s1 ZINC000354927862 1043731397 /nfs/dbraw/zinc/73/13/97/1043731397.db2.gz SKNZEHISOIUBGQ-UHFFFAOYSA-N 1 2 312.442 4.202 20 0 DIADLO CCSCc1ccc[nH+]c1N[C@H]1CCOC2(CCCC2)C1 ZINC000895689350 1043733226 /nfs/dbraw/zinc/73/32/26/1043733226.db2.gz RCSHLUQECXEXON-HNNXBMFYSA-N 1 2 306.475 4.238 20 0 DIADLO c1ccc(-c2nc(C[NH2+][C@H](c3ccccc3)C3CCC3)no2)cc1 ZINC000114719084 1043734906 /nfs/dbraw/zinc/73/49/06/1043734906.db2.gz JLQKWSDHERSCSJ-LJQANCHMSA-N 1 2 319.408 4.368 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(Cl)cs1)c1cc(F)ccc1F ZINC000877054913 1043740305 /nfs/dbraw/zinc/74/03/05/1043740305.db2.gz LJDKCKZNQMLIHA-NSHDSACASA-N 1 2 302.777 4.316 20 0 DIADLO CC(C)c1cc(N[C@H](c2ncccn2)C2CC2)nc(C(C)C)[nH+]1 ZINC000895777379 1043752230 /nfs/dbraw/zinc/75/22/30/1043752230.db2.gz KGNVGYDKEBCQEB-INIZCTEOSA-N 1 2 311.433 4.077 20 0 DIADLO C[C@@H](C[N@H+](C)Cc1c(Cl)cncc1Cl)c1nccs1 ZINC000877315793 1043755750 /nfs/dbraw/zinc/75/57/50/1043755750.db2.gz BCSHWUIFLBIIIO-VIFPVBQESA-N 1 2 316.257 4.080 20 0 DIADLO C[C@@H](C[N@@H+](C)Cc1c(Cl)cncc1Cl)c1nccs1 ZINC000877315793 1043755760 /nfs/dbraw/zinc/75/57/60/1043755760.db2.gz BCSHWUIFLBIIIO-VIFPVBQESA-N 1 2 316.257 4.080 20 0 DIADLO Fc1c(Cl)cccc1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000355344348 1043762096 /nfs/dbraw/zinc/76/20/96/1043762096.db2.gz QVSOJWCJUMTOGG-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccnc(Cl)c1 ZINC000777704960 1043770893 /nfs/dbraw/zinc/77/08/93/1043770893.db2.gz OCLZCFKZQNCWFO-CYBMUJFWSA-N 1 2 316.836 4.293 20 0 DIADLO Clc1ccc(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)nn1 ZINC000877579538 1043777576 /nfs/dbraw/zinc/77/75/76/1043777576.db2.gz VDEVRBQHUQWKOY-KRWDZBQOSA-N 1 2 313.832 4.247 20 0 DIADLO Clc1ccc(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)nn1 ZINC000877579538 1043777585 /nfs/dbraw/zinc/77/75/85/1043777585.db2.gz VDEVRBQHUQWKOY-KRWDZBQOSA-N 1 2 313.832 4.247 20 0 DIADLO Cc1ccoc1C[NH2+]C(C)(C)c1nc2cc(Cl)ccc2o1 ZINC000877669247 1043787466 /nfs/dbraw/zinc/78/74/66/1043787466.db2.gz ZTWLBFVHIBYKTB-UHFFFAOYSA-N 1 2 304.777 4.408 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2coc(C(C)(C)C)n2)cc1 ZINC000929113184 1043790737 /nfs/dbraw/zinc/79/07/37/1043790737.db2.gz ZZTJZHBPUGOTGI-CYBMUJFWSA-N 1 2 302.418 4.174 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2coc(C(C)(C)C)n2)cc1 ZINC000929113184 1043790748 /nfs/dbraw/zinc/79/07/48/1043790748.db2.gz ZZTJZHBPUGOTGI-CYBMUJFWSA-N 1 2 302.418 4.174 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000877734648 1043792873 /nfs/dbraw/zinc/79/28/73/1043792873.db2.gz CJIDOGBSWUVDBT-UHFFFAOYSA-N 1 2 315.175 4.288 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2csc(-c3ccco3)n2)C1 ZINC000877812064 1043798943 /nfs/dbraw/zinc/79/89/43/1043798943.db2.gz GOGGLAWKAORQLR-CYBMUJFWSA-N 1 2 316.348 4.177 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2csc(-c3ccco3)n2)C1 ZINC000877812064 1043798959 /nfs/dbraw/zinc/79/89/59/1043798959.db2.gz GOGGLAWKAORQLR-CYBMUJFWSA-N 1 2 316.348 4.177 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2coc(C(C)(C)C)n2)cc1 ZINC000929208872 1043799832 /nfs/dbraw/zinc/79/98/32/1043799832.db2.gz HXNARXSCHGSBOY-UHFFFAOYSA-N 1 2 302.418 4.003 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2coc(C(C)(C)C)n2)cc1 ZINC000929208872 1043799837 /nfs/dbraw/zinc/79/98/37/1043799837.db2.gz HXNARXSCHGSBOY-UHFFFAOYSA-N 1 2 302.418 4.003 20 0 DIADLO C[C@H](c1ccc(F)nc1)[N@H+](C)Cc1nc2ccccc2s1 ZINC000929231050 1043803240 /nfs/dbraw/zinc/80/32/40/1043803240.db2.gz CWBBHBIVXRMCQK-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO C[C@H](c1ccc(F)nc1)[N@@H+](C)Cc1nc2ccccc2s1 ZINC000929231050 1043803256 /nfs/dbraw/zinc/80/32/56/1043803256.db2.gz CWBBHBIVXRMCQK-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSc1nccn1C(C)C ZINC000356041352 1043804067 /nfs/dbraw/zinc/80/40/67/1043804067.db2.gz LAWWYXSBOJJXQU-UHFFFAOYSA-N 1 2 312.442 4.250 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cscc2C(F)(F)F)on1 ZINC000356081142 1043807310 /nfs/dbraw/zinc/80/73/10/1043807310.db2.gz FPGPNSBAQUOMGM-GFCCVEGCSA-N 1 2 316.348 4.400 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cscc2C(F)(F)F)on1 ZINC000356081142 1043807332 /nfs/dbraw/zinc/80/73/32/1043807332.db2.gz FPGPNSBAQUOMGM-GFCCVEGCSA-N 1 2 316.348 4.400 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2oc(-c3ccccc3)nc2C)no1 ZINC000877922005 1043825631 /nfs/dbraw/zinc/82/56/31/1043825631.db2.gz NXEMSEVYMDBWCJ-KRWDZBQOSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2oc(-c3ccccc3)nc2C)no1 ZINC000877922005 1043825650 /nfs/dbraw/zinc/82/56/50/1043825650.db2.gz NXEMSEVYMDBWCJ-KRWDZBQOSA-N 1 2 323.396 4.284 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H](C)c2ncc(C)o2)ccc1OC(C)C ZINC000356270534 1043826625 /nfs/dbraw/zinc/82/66/25/1043826625.db2.gz GAWICGLTNSJWLM-KGLIPLIRSA-N 1 2 318.417 4.191 20 0 DIADLO CCC(CC)c1noc(/C=C/c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000356539749 1043848342 /nfs/dbraw/zinc/84/83/42/1043848342.db2.gz KHOVPTCKQKOAOH-JXMROGBWSA-N 1 2 308.385 4.329 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccccc3CF)CCCCCC2)no1 ZINC000929897418 1043851072 /nfs/dbraw/zinc/85/10/72/1043851072.db2.gz LRBWYIBSFAFYMO-UHFFFAOYSA-N 1 2 317.408 4.187 20 0 DIADLO CC(C)(C)c1cc(C[NH2+]C2(c3cccc(Cl)c3)CC2)no1 ZINC000289670255 1043860497 /nfs/dbraw/zinc/86/04/97/1043860497.db2.gz YQALABVFHCHFLF-UHFFFAOYSA-N 1 2 304.821 4.404 20 0 DIADLO CC(C)([NH2+]Cc1ccc2ccc(Cl)cc2n1)c1nccs1 ZINC000878249254 1043862386 /nfs/dbraw/zinc/86/23/86/1043862386.db2.gz MSVCVOOTBQHLFC-UHFFFAOYSA-N 1 2 317.845 4.370 20 0 DIADLO CC[C@](C)([NH2+]Cc1cc(C(F)(F)F)co1)c1nccs1 ZINC000878254346 1043862860 /nfs/dbraw/zinc/86/28/60/1043862860.db2.gz STRVYIQQPVDBMB-LBPRGKRZSA-N 1 2 304.337 4.170 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2c(C)ccc3cc(C)ccc32)no1 ZINC000878239036 1043865119 /nfs/dbraw/zinc/86/51/19/1043865119.db2.gz KXEHZNCSXLFLMP-UHFFFAOYSA-N 1 2 309.413 4.173 20 0 DIADLO CC[C@](C)([NH2+]Cc1ccc(C)c(Cl)n1)c1nc(C)cs1 ZINC000878262840 1043867011 /nfs/dbraw/zinc/86/70/11/1043867011.db2.gz WTMDENUKYOGWJG-HNNXBMFYSA-N 1 2 309.866 4.223 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2nc3c(o2)CCCC3)c1 ZINC000878352963 1043877387 /nfs/dbraw/zinc/87/73/87/1043877387.db2.gz QOBBUPRTMKCZIB-AWEZNQCLSA-N 1 2 314.429 4.191 20 0 DIADLO CC1(C)CCc2onc(C[NH2+]C3(c4cccc(F)c4)CC3)c2C1 ZINC000878365903 1043879976 /nfs/dbraw/zinc/87/99/76/1043879976.db2.gz GEHCKPBLAJHMHJ-UHFFFAOYSA-N 1 2 314.404 4.108 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3c(Cl)cncc3Cl)CC2)c1 ZINC000878366402 1043880463 /nfs/dbraw/zinc/88/04/63/1043880463.db2.gz NFJOPRXGZZWYSD-UHFFFAOYSA-N 1 2 311.187 4.306 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+]Cc2coc(C(C)(C)C)n2)cc1 ZINC000930187761 1043891051 /nfs/dbraw/zinc/89/10/51/1043891051.db2.gz QKUSZAFXVLXWGA-CYBMUJFWSA-N 1 2 302.418 4.222 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(C)c(Cl)n2)o1 ZINC000878441153 1043891440 /nfs/dbraw/zinc/89/14/40/1043891440.db2.gz QQBQZKJTMSQPID-OAHLLOKOSA-N 1 2 320.820 4.120 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccc(C)c(Cl)n2)o1 ZINC000878441153 1043891459 /nfs/dbraw/zinc/89/14/59/1043891459.db2.gz QQBQZKJTMSQPID-OAHLLOKOSA-N 1 2 320.820 4.120 20 0 DIADLO CC(C)(C)SCCC[N@@H+]1CCSC[C@H]1c1nccs1 ZINC000878448875 1043894239 /nfs/dbraw/zinc/89/42/39/1043894239.db2.gz WOEKXDCMGKPYRE-LBPRGKRZSA-N 1 2 316.561 4.155 20 0 DIADLO CC(C)(C)SCCC[N@H+]1CCSC[C@H]1c1nccs1 ZINC000878448875 1043894259 /nfs/dbraw/zinc/89/42/59/1043894259.db2.gz WOEKXDCMGKPYRE-LBPRGKRZSA-N 1 2 316.561 4.155 20 0 DIADLO CCc1ncc(C[NH2+]C(C)(C)c2ccccc2Br)o1 ZINC000930233222 1043900921 /nfs/dbraw/zinc/90/09/21/1043900921.db2.gz NOUXNGKRDFCWJK-UHFFFAOYSA-N 1 2 323.234 4.024 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)N(C)c1cc(N2CCCC2)[nH+]cn1 ZINC000561142133 1043901548 /nfs/dbraw/zinc/90/15/48/1043901548.db2.gz HPTZVTAIJFSAFW-AWEZNQCLSA-N 1 2 322.412 4.020 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)N(C)c1cc(N2CCCC2)nc[nH+]1 ZINC000561142133 1043901565 /nfs/dbraw/zinc/90/15/65/1043901565.db2.gz HPTZVTAIJFSAFW-AWEZNQCLSA-N 1 2 322.412 4.020 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+]Cc2nc3c(o2)CCCC3)cc1 ZINC000878552416 1043903913 /nfs/dbraw/zinc/90/39/13/1043903913.db2.gz DNYBLIUSKJHNKW-GFCCVEGCSA-N 1 2 302.443 4.126 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ccc(Oc3ccccc3)o2)n1 ZINC000357002328 1043904663 /nfs/dbraw/zinc/90/46/63/1043904663.db2.gz YTMWFNWYMKRMJR-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ccc(Oc3ccccc3)o2)n1 ZINC000357002328 1043904671 /nfs/dbraw/zinc/90/46/71/1043904671.db2.gz YTMWFNWYMKRMJR-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2)no1)c1ccc(F)cc1F ZINC000561160146 1043905933 /nfs/dbraw/zinc/90/59/33/1043905933.db2.gz LKGKUZKMGSECJV-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO CCc1nnc(C[NH2+][C@H]2CCSc3cc(C)c(C)cc32)s1 ZINC000290030702 1043912154 /nfs/dbraw/zinc/91/21/54/1043912154.db2.gz CWEODDSCFAYSSP-ZDUSSCGKSA-N 1 2 319.499 4.044 20 0 DIADLO Clc1cccc(C2([NH2+]Cc3nc4c(o3)CCCC4)CCC2)c1 ZINC000878770216 1043917758 /nfs/dbraw/zinc/91/77/58/1043917758.db2.gz UOSFAZDLVCHFOM-UHFFFAOYSA-N 1 2 316.832 4.376 20 0 DIADLO C[N@H+](Cc1coc(-c2cccs2)n1)Cc1cccc(F)c1 ZINC000102672872 1043927425 /nfs/dbraw/zinc/92/74/25/1043927425.db2.gz IWCGUCGOZQHFDR-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1coc(-c2cccs2)n1)Cc1cccc(F)c1 ZINC000102672872 1043927432 /nfs/dbraw/zinc/92/74/32/1043927432.db2.gz IWCGUCGOZQHFDR-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO Cc1nc(COc2ccc(C[N@@H+]3CCC=C(F)C3)cc2)cs1 ZINC000357239889 1043931021 /nfs/dbraw/zinc/93/10/21/1043931021.db2.gz SXNRBXVTZNMAMQ-UHFFFAOYSA-N 1 2 318.417 4.090 20 0 DIADLO Cc1nc(COc2ccc(C[N@H+]3CCC=C(F)C3)cc2)cs1 ZINC000357239889 1043931034 /nfs/dbraw/zinc/93/10/34/1043931034.db2.gz SXNRBXVTZNMAMQ-UHFFFAOYSA-N 1 2 318.417 4.090 20 0 DIADLO COCC[N@H+](Cc1cccs1)Cc1nc2ccccc2s1 ZINC000357243853 1043933965 /nfs/dbraw/zinc/93/39/65/1043933965.db2.gz RNRKJDLDKKFHOO-UHFFFAOYSA-N 1 2 318.467 4.006 20 0 DIADLO COCC[N@@H+](Cc1cccs1)Cc1nc2ccccc2s1 ZINC000357243853 1043933980 /nfs/dbraw/zinc/93/39/80/1043933980.db2.gz RNRKJDLDKKFHOO-UHFFFAOYSA-N 1 2 318.467 4.006 20 0 DIADLO COCCC[C@@H](CNc1cccc[nH+]1)c1ccc(Cl)cc1 ZINC000561358849 1043936845 /nfs/dbraw/zinc/93/68/45/1043936845.db2.gz HFWNMKZQEUCNKI-HNNXBMFYSA-N 1 2 304.821 4.357 20 0 DIADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2Cc1c(Cl)cncc1Cl ZINC000879030288 1043938371 /nfs/dbraw/zinc/93/83/71/1043938371.db2.gz BOSIOIJBVJXYCC-DTORHVGOSA-N 1 2 307.171 4.151 20 0 DIADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1c(Cl)cncc1Cl ZINC000879030288 1043938375 /nfs/dbraw/zinc/93/83/75/1043938375.db2.gz BOSIOIJBVJXYCC-DTORHVGOSA-N 1 2 307.171 4.151 20 0 DIADLO Cc1ccn2cc(C[N@@H+](C)Cc3ccccc3OC(C)C)nc2c1 ZINC001137140714 1043944386 /nfs/dbraw/zinc/94/43/86/1043944386.db2.gz MYSIIURPUWDMQJ-UHFFFAOYSA-N 1 2 323.440 4.062 20 0 DIADLO Cc1ccn2cc(C[N@H+](C)Cc3ccccc3OC(C)C)nc2c1 ZINC001137140714 1043944394 /nfs/dbraw/zinc/94/43/94/1043944394.db2.gz MYSIIURPUWDMQJ-UHFFFAOYSA-N 1 2 323.440 4.062 20 0 DIADLO CCc1ncc(C[N@H+](Cc2ccccn2)Cc2ccccc2C)o1 ZINC000930615817 1043948169 /nfs/dbraw/zinc/94/81/69/1043948169.db2.gz UNOJBBOGWUOYKL-UHFFFAOYSA-N 1 2 321.424 4.143 20 0 DIADLO CCc1ncc(C[N@@H+](Cc2ccccn2)Cc2ccccc2C)o1 ZINC000930615817 1043948181 /nfs/dbraw/zinc/94/81/81/1043948181.db2.gz UNOJBBOGWUOYKL-UHFFFAOYSA-N 1 2 321.424 4.143 20 0 DIADLO CCc1nc(N2CCCC[C@@H]2c2nc3ccccc3o2)cc(C)[nH+]1 ZINC000329177642 1043950262 /nfs/dbraw/zinc/95/02/62/1043950262.db2.gz CFZKRVRPQPMBTM-OAHLLOKOSA-N 1 2 322.412 4.220 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@@H](C)c2ccc(F)cc2F)c(C)[nH+]1 ZINC000179240195 1043950521 /nfs/dbraw/zinc/95/05/21/1043950521.db2.gz FAABVLAHZKADDR-SNVBAGLBSA-N 1 2 318.367 4.417 20 0 DIADLO COCc1cccc(C[NH+](Cc2ccco2)Cc2ccco2)c1 ZINC000179183696 1043950757 /nfs/dbraw/zinc/95/07/57/1043950757.db2.gz BNRZCAJPPSDAIQ-UHFFFAOYSA-N 1 2 311.381 4.221 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2c(Cl)cncc2Cl)s1 ZINC000879253009 1043953086 /nfs/dbraw/zinc/95/30/86/1043953086.db2.gz FQKPOMICWBOQOE-SSDOTTSWSA-N 1 2 302.230 4.004 20 0 DIADLO CC[N@H+](Cc1cnc(-c2ccccc2)[nH]1)[C@@H](C)c1cccnc1 ZINC000290496727 1043957615 /nfs/dbraw/zinc/95/76/15/1043957615.db2.gz OWIAOEVVICUEIR-HNNXBMFYSA-N 1 2 306.413 4.055 20 0 DIADLO CC[N@@H+](Cc1cnc(-c2ccccc2)[nH]1)[C@@H](C)c1cccnc1 ZINC000290496727 1043957623 /nfs/dbraw/zinc/95/76/23/1043957623.db2.gz OWIAOEVVICUEIR-HNNXBMFYSA-N 1 2 306.413 4.055 20 0 DIADLO O=C(c1ccc(C2CCCC2)cc1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000290513354 1043959691 /nfs/dbraw/zinc/95/96/91/1043959691.db2.gz PWDNUZHIWUPDGE-GOSISDBHSA-N 1 2 323.440 4.087 20 0 DIADLO CCc1cc(N2CCCC[C@H]2c2nc3ccccc3o2)nc(C)[nH+]1 ZINC000329280278 1043963529 /nfs/dbraw/zinc/96/35/29/1043963529.db2.gz DNRCAIBWLORINK-INIZCTEOSA-N 1 2 322.412 4.220 20 0 DIADLO C/C(=C\c1ccccc1OC(F)F)C[N@@H+](C)Cc1cscn1 ZINC000290569246 1043965106 /nfs/dbraw/zinc/96/51/06/1043965106.db2.gz YGICKGPZLWDDHM-KPKJPENVSA-N 1 2 324.396 4.280 20 0 DIADLO C/C(=C\c1ccccc1OC(F)F)C[N@H+](C)Cc1cscn1 ZINC000290569246 1043965111 /nfs/dbraw/zinc/96/51/11/1043965111.db2.gz YGICKGPZLWDDHM-KPKJPENVSA-N 1 2 324.396 4.280 20 0 DIADLO C[C@H](c1ccc(F)nc1)[N@@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000930967487 1043978918 /nfs/dbraw/zinc/97/89/18/1043978918.db2.gz XVANUUNNVGJHIC-DYVFJYSZSA-N 1 2 300.377 4.492 20 0 DIADLO C[C@H](c1ccc(F)nc1)[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000930967487 1043978926 /nfs/dbraw/zinc/97/89/26/1043978926.db2.gz XVANUUNNVGJHIC-DYVFJYSZSA-N 1 2 300.377 4.492 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2nnc3n2CCCCC3)cc1 ZINC000357730228 1043981514 /nfs/dbraw/zinc/98/15/14/1043981514.db2.gz NVCLXNSRZSUKAM-SFHVURJKSA-N 1 2 324.472 4.040 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2nnc3n2CCCCC3)cc1 ZINC000357730228 1043981527 /nfs/dbraw/zinc/98/15/27/1043981527.db2.gz NVCLXNSRZSUKAM-SFHVURJKSA-N 1 2 324.472 4.040 20 0 DIADLO C[C@@H](Cc1ccsc1)[N@H+](C)Cc1ncc(C(F)(F)F)s1 ZINC001308595314 1043981852 /nfs/dbraw/zinc/98/18/52/1043981852.db2.gz RDTXTQDPZNDQJV-VIFPVBQESA-N 1 2 320.405 4.286 20 0 DIADLO C[C@@H](Cc1ccsc1)[N@@H+](C)Cc1ncc(C(F)(F)F)s1 ZINC001308595314 1043981858 /nfs/dbraw/zinc/98/18/58/1043981858.db2.gz RDTXTQDPZNDQJV-VIFPVBQESA-N 1 2 320.405 4.286 20 0 DIADLO C/C=C\c1ccc(NC(=O)c2cccc(Cn3cc[nH+]c3)c2)cc1 ZINC000561648425 1043983658 /nfs/dbraw/zinc/98/36/58/1043983658.db2.gz UAHVPQANKNLQIZ-RQOWECAXSA-N 1 2 317.392 4.217 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2nccc3ccccc32)[nH]1 ZINC000290790165 1043985046 /nfs/dbraw/zinc/98/50/46/1043985046.db2.gz UPFBDDQUVFENAM-BFHYXJOUSA-N 1 2 323.444 4.278 20 0 DIADLO Cc1nc(-c2ccc(C[NH2+][C@@H](C)c3nccs3)o2)cs1 ZINC000357786065 1043986716 /nfs/dbraw/zinc/98/67/16/1043986716.db2.gz UUTLLAMGUNRQFN-VIFPVBQESA-N 1 2 305.428 4.019 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(-c3ccccc3)o2)[C@H]1c1cccnc1 ZINC000931081736 1043990518 /nfs/dbraw/zinc/99/05/18/1043990518.db2.gz AJRIKOVATADPNE-SFHVURJKSA-N 1 2 319.408 4.320 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(-c3ccccc3)o2)[C@H]1c1cccnc1 ZINC000931081736 1043990527 /nfs/dbraw/zinc/99/05/27/1043990527.db2.gz AJRIKOVATADPNE-SFHVURJKSA-N 1 2 319.408 4.320 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(-c3ccccc3)o2)[C@H]1c1ccncc1 ZINC000931085295 1043990617 /nfs/dbraw/zinc/99/06/17/1043990617.db2.gz XQCKGKYSGGFFEK-SFHVURJKSA-N 1 2 319.408 4.320 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(-c3ccccc3)o2)[C@H]1c1ccncc1 ZINC000931085295 1043990628 /nfs/dbraw/zinc/99/06/28/1043990628.db2.gz XQCKGKYSGGFFEK-SFHVURJKSA-N 1 2 319.408 4.320 20 0 DIADLO CC(C)C[C@@H]1CCC[C@@H]([NH2+][C@@H](c2nnc[nH]2)c2ccccc2)C1 ZINC000474937947 1043992210 /nfs/dbraw/zinc/99/22/10/1043992210.db2.gz BWUYJBPXPJGFLJ-CGTJXYLNSA-N 1 2 312.461 4.089 20 0 DIADLO CC(C)C[C@@H]1CCC[C@@H]([NH2+][C@H](c2nnc[nH]2)c2ccccc2)C1 ZINC000474937948 1043992241 /nfs/dbraw/zinc/99/22/41/1043992241.db2.gz BWUYJBPXPJGFLJ-JQHSSLGASA-N 1 2 312.461 4.089 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1nccc2ccccc21 ZINC000290847811 1043992418 /nfs/dbraw/zinc/99/24/18/1043992418.db2.gz ZGUNNWYHDINNKR-HNNXBMFYSA-N 1 2 318.424 4.403 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@H](O)c2ccccc2)no1 ZINC000290847906 1043993652 /nfs/dbraw/zinc/99/36/52/1043993652.db2.gz ZHYAZEQHAGJXLR-RYGJVYDSSA-N 1 2 322.408 4.109 20 0 DIADLO Cn1c2ccccc2nc1[C@@H]1CCCC[N@@H+]1Cc1ccccc1F ZINC000561739335 1043997496 /nfs/dbraw/zinc/99/74/96/1043997496.db2.gz GSJQLIVOIHZYOL-IBGZPJMESA-N 1 2 323.415 4.440 20 0 DIADLO Cn1c2ccccc2nc1[C@@H]1CCCC[N@H+]1Cc1ccccc1F ZINC000561739335 1043997504 /nfs/dbraw/zinc/99/75/04/1043997504.db2.gz GSJQLIVOIHZYOL-IBGZPJMESA-N 1 2 323.415 4.440 20 0 DIADLO CC(C)c1cc([C@H]2CCC[N@H+](C/C(Cl)=C/Cl)C2)[nH]n1 ZINC000879920104 1044000964 /nfs/dbraw/zinc/00/09/64/1044000964.db2.gz WCRRWUARVPQRHK-ZWIPKHHJSA-N 1 2 302.249 4.032 20 0 DIADLO CC(C)c1cc([C@H]2CCC[N@@H+](C/C(Cl)=C/Cl)C2)[nH]n1 ZINC000879920104 1044000978 /nfs/dbraw/zinc/00/09/78/1044000978.db2.gz WCRRWUARVPQRHK-ZWIPKHHJSA-N 1 2 302.249 4.032 20 0 DIADLO CC(C)c1cc([C@@H]2CCC[N@H+](C/C(Cl)=C/Cl)C2)[nH]n1 ZINC000879920097 1044001271 /nfs/dbraw/zinc/00/12/71/1044001271.db2.gz WCRRWUARVPQRHK-HBZGRHIISA-N 1 2 302.249 4.032 20 0 DIADLO CC(C)c1cc([C@@H]2CCC[N@@H+](C/C(Cl)=C/Cl)C2)[nH]n1 ZINC000879920097 1044001285 /nfs/dbraw/zinc/00/12/85/1044001285.db2.gz WCRRWUARVPQRHK-HBZGRHIISA-N 1 2 302.249 4.032 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2cc(Cl)nc(Cl)c2)C1 ZINC000880001488 1044004225 /nfs/dbraw/zinc/00/42/25/1044004225.db2.gz PWPLKVVXEZUBTD-LLVKDONJSA-N 1 2 313.150 4.163 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cc(Cl)nc(Cl)c2)C1 ZINC000880001488 1044004239 /nfs/dbraw/zinc/00/42/39/1044004239.db2.gz PWPLKVVXEZUBTD-LLVKDONJSA-N 1 2 313.150 4.163 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2oc3ccc(F)cc3c2C)cs1 ZINC000358034646 1044008476 /nfs/dbraw/zinc/00/84/76/1044008476.db2.gz HNQYTWIUNYPCIG-JTQLQIEISA-N 1 2 304.390 4.496 20 0 DIADLO Fc1ccc(-c2cnc(C[N@@H+]3CCC[C@@H]3c3cccnc3)o2)cc1 ZINC000561862118 1044016434 /nfs/dbraw/zinc/01/64/34/1044016434.db2.gz RQUXIWQQZQOZBJ-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(-c2cnc(C[N@H+]3CCC[C@@H]3c3cccnc3)o2)cc1 ZINC000561862118 1044016451 /nfs/dbraw/zinc/01/64/51/1044016451.db2.gz RQUXIWQQZQOZBJ-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC3(CCCC3)OC(C)(C)C2)s1 ZINC000443789889 1044018942 /nfs/dbraw/zinc/01/89/42/1044018942.db2.gz NTVWSPBGUAWOCQ-UHFFFAOYSA-N 1 2 308.491 4.190 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC3(CCCC3)OC(C)(C)C2)s1 ZINC000443789889 1044018958 /nfs/dbraw/zinc/01/89/58/1044018958.db2.gz NTVWSPBGUAWOCQ-UHFFFAOYSA-N 1 2 308.491 4.190 20 0 DIADLO CCC[C@@](C)(CC)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000475019184 1044031588 /nfs/dbraw/zinc/03/15/88/1044031588.db2.gz UKYYKLSTAHPGGC-QGZVFWFLSA-N 1 2 303.381 4.166 20 0 DIADLO Cc1nc(C[NH2+]C(C)(C)c2ccc(C(F)(F)F)cc2)oc1C ZINC000880383670 1044033323 /nfs/dbraw/zinc/03/33/23/1044033323.db2.gz IMOXJGZUCPHEQW-UHFFFAOYSA-N 1 2 312.335 4.335 20 0 DIADLO COc1c(C)cnc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)c1C ZINC000561960461 1044034855 /nfs/dbraw/zinc/03/48/55/1044034855.db2.gz SQKPHHXJJWRBQV-QGZVFWFLSA-N 1 2 316.470 4.352 20 0 DIADLO COc1c(C)cnc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)c1C ZINC000561960461 1044034872 /nfs/dbraw/zinc/03/48/72/1044034872.db2.gz SQKPHHXJJWRBQV-QGZVFWFLSA-N 1 2 316.470 4.352 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)[nH]1 ZINC000358237287 1044038336 /nfs/dbraw/zinc/03/83/36/1044038336.db2.gz LAPLIDXGCDDTSH-OLZOCXBDSA-N 1 2 310.401 4.039 20 0 DIADLO FC(F)[C@@H]([NH2+]CCC1CCOCC1)c1cccc(Cl)c1 ZINC000880533799 1044045638 /nfs/dbraw/zinc/04/56/38/1044045638.db2.gz HQLKUJMMDGFKOJ-AWEZNQCLSA-N 1 2 303.780 4.053 20 0 DIADLO C[C@@H]1C[C@@H](C[NH2+][C@@H](c2cccc(Cl)c2)C(F)F)CCO1 ZINC000880533967 1044046173 /nfs/dbraw/zinc/04/61/73/1044046173.db2.gz JRARTSRRTNOYIM-SUNKGSAMSA-N 1 2 303.780 4.051 20 0 DIADLO Cc1cc(N(C)Cc2ccc3ccccc3c2)nc(C2CC2)[nH+]1 ZINC000522570678 1044046392 /nfs/dbraw/zinc/04/63/92/1044046392.db2.gz FJRLCVDMCMRVGI-UHFFFAOYSA-N 1 2 303.409 4.452 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1nc(C2CC2)cs1 ZINC000358291204 1044048393 /nfs/dbraw/zinc/04/83/93/1044048393.db2.gz SPIMMIUCKQDDAE-SNVBAGLBSA-N 1 2 306.406 4.019 20 0 DIADLO CCC(CC)(C(=O)Nc1cccc2[nH+]ccn21)c1ccccc1 ZINC000443879902 1044048935 /nfs/dbraw/zinc/04/89/35/1044048935.db2.gz NZKPHBWTFOHDOG-UHFFFAOYSA-N 1 2 307.397 4.031 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(c3ccccc3C)C(C)C)ccn12 ZINC000888825067 1044050531 /nfs/dbraw/zinc/05/05/31/1044050531.db2.gz BZFAUSSPAPJNDW-UHFFFAOYSA-N 1 2 307.397 4.006 20 0 DIADLO Cc1cn2c([nH+]1)[C@@H](CNc1cc(C)nc3c(F)cccc13)CCC2 ZINC000443888265 1044050649 /nfs/dbraw/zinc/05/06/49/1044050649.db2.gz YXDABZMEIKHCNG-CQSZACIVSA-N 1 2 324.403 4.177 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@@H+]2Cc2cccc3ccccc32)o1 ZINC000522659088 1044064427 /nfs/dbraw/zinc/06/44/27/1044064427.db2.gz DQEXHYAQMYNUNZ-IBGZPJMESA-N 1 2 307.393 4.315 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@H+]2Cc2cccc3ccccc32)o1 ZINC000522659088 1044064442 /nfs/dbraw/zinc/06/44/42/1044064442.db2.gz DQEXHYAQMYNUNZ-IBGZPJMESA-N 1 2 307.393 4.315 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1csc(-c2ccccc2F)n1)c1cn[nH]c1 ZINC000291383506 1044069398 /nfs/dbraw/zinc/06/93/98/1044069398.db2.gz ZPVHCWLVTDSVKC-MNOVXSKESA-N 1 2 316.405 4.084 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H]2CCc3cccc4cccc2c43)n1 ZINC000931805441 1044072321 /nfs/dbraw/zinc/07/23/21/1044072321.db2.gz DIGWWTDCEDYDDD-MRXNPFEDSA-N 1 2 307.397 4.123 20 0 DIADLO FCCCCC[N@@H+]1CCc2nc[nH]c2[C@@H]1c1ccc(Cl)cc1 ZINC000931796866 1044073409 /nfs/dbraw/zinc/07/34/09/1044073409.db2.gz OGVWWSZXRBSBEU-KRWDZBQOSA-N 1 2 321.827 4.150 20 0 DIADLO FCCCCC[N@H+]1CCc2nc[nH]c2[C@@H]1c1ccc(Cl)cc1 ZINC000931796866 1044073421 /nfs/dbraw/zinc/07/34/21/1044073421.db2.gz OGVWWSZXRBSBEU-KRWDZBQOSA-N 1 2 321.827 4.150 20 0 DIADLO CC(C)(C)c1noc(C[NH2+][C@H]2CCc3cccc4cccc2c43)n1 ZINC000931805681 1044075474 /nfs/dbraw/zinc/07/54/74/1044075474.db2.gz HLFRJWFJBWRZJF-INIZCTEOSA-N 1 2 321.424 4.297 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@H+]1CCC(F)(F)[C@H](CO)C1 ZINC000291768592 1044101939 /nfs/dbraw/zinc/10/19/39/1044101939.db2.gz LPBUSXRQLMATHJ-ZJUUUORDSA-N 1 2 324.198 4.004 20 0 DIADLO Cc1ccc(CSCc2ccc(-n3cccn3)cc2)c(C)[nH+]1 ZINC000358659051 1044090100 /nfs/dbraw/zinc/09/01/00/1044090100.db2.gz YTTFEALBQGSOCM-UHFFFAOYSA-N 1 2 309.438 4.318 20 0 DIADLO Cc1ccc(CSCc2ccn(-c3ccccc3)n2)c(C)[nH+]1 ZINC000358663852 1044090683 /nfs/dbraw/zinc/09/06/83/1044090683.db2.gz RYTDUDLUCGAULV-UHFFFAOYSA-N 1 2 309.438 4.318 20 0 DIADLO O=C(/C=C\c1ccc(Cl)cc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000881024748 1044095938 /nfs/dbraw/zinc/09/59/38/1044095938.db2.gz ILWIEZXCMKFJBK-KMKOMSMNSA-N 1 2 323.783 4.178 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+]1CCC(F)(F)[C@H](CO)C1 ZINC000291768592 1044101937 /nfs/dbraw/zinc/10/19/37/1044101937.db2.gz LPBUSXRQLMATHJ-ZJUUUORDSA-N 1 2 324.198 4.004 20 0 DIADLO CC(C)([NH2+]Cc1ncc(C(F)(F)F)s1)c1ccccc1F ZINC000291782765 1044103160 /nfs/dbraw/zinc/10/31/60/1044103160.db2.gz VCFVUKNYPPEDOC-UHFFFAOYSA-N 1 2 318.339 4.326 20 0 DIADLO c1csc(-c2nc(C[NH2+][C@@H](c3ccccn3)C3CC3)co2)c1 ZINC000932379654 1044122083 /nfs/dbraw/zinc/12/20/83/1044122083.db2.gz ISGHUFHHNJSEFM-MRXNPFEDSA-N 1 2 311.410 4.039 20 0 DIADLO Fc1cccc(-c2nc(C[NH2+][C@@H](c3ccccn3)C3CC3)co2)c1 ZINC000932375439 1044122175 /nfs/dbraw/zinc/12/21/75/1044122175.db2.gz QTDAUEHHLBCTIR-GOSISDBHSA-N 1 2 323.371 4.117 20 0 DIADLO c1csc(-c2cnc(C[NH2+][C@H](c3ccccn3)C3CC3)o2)c1 ZINC000932382483 1044124494 /nfs/dbraw/zinc/12/44/94/1044124494.db2.gz UDQFHDRZHLYJHP-KRWDZBQOSA-N 1 2 311.410 4.039 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H]3CCSc4ccccc43)cc2[nH+]1 ZINC000359049152 1044124659 /nfs/dbraw/zinc/12/46/59/1044124659.db2.gz ZSBUBRWNTXXBAB-CQSZACIVSA-N 1 2 323.421 4.089 20 0 DIADLO Cc1ccc(C[N@H+](Cc2nc3ccccc3s2)C2CC2)cn1 ZINC000932394666 1044125899 /nfs/dbraw/zinc/12/58/99/1044125899.db2.gz ODPDSNGNSQZKBK-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2nc3ccccc3s2)C2CC2)cn1 ZINC000932394666 1044125905 /nfs/dbraw/zinc/12/59/05/1044125905.db2.gz ODPDSNGNSQZKBK-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO Cc1ncccc1C[N@H+](Cc1nc2ccccc2s1)C1CC1 ZINC000932394274 1044126016 /nfs/dbraw/zinc/12/60/16/1044126016.db2.gz LGLMJCCUYUUVNA-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO Cc1ncccc1C[N@@H+](Cc1nc2ccccc2s1)C1CC1 ZINC000932394274 1044126023 /nfs/dbraw/zinc/12/60/23/1044126023.db2.gz LGLMJCCUYUUVNA-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO CC(C)c1ccc(C[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)cc1 ZINC000292018188 1044127522 /nfs/dbraw/zinc/12/75/22/1044127522.db2.gz CCACJISQPAXZSY-GOSISDBHSA-N 1 2 312.461 4.339 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+](Cc2ccccn2)CC(C)C)n1 ZINC000932442243 1044130391 /nfs/dbraw/zinc/13/03/91/1044130391.db2.gz NJFSPGZMOYKJQM-OAHLLOKOSA-N 1 2 316.449 4.026 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+](Cc2ccccn2)CC(C)C)n1 ZINC000932442243 1044130395 /nfs/dbraw/zinc/13/03/95/1044130395.db2.gz NJFSPGZMOYKJQM-OAHLLOKOSA-N 1 2 316.449 4.026 20 0 DIADLO CC(C)(C)CCC[S@@](=O)Cc1c[nH+]cn1Cc1ccccc1 ZINC000359100439 1044131151 /nfs/dbraw/zinc/13/11/51/1044131151.db2.gz BFZFNYKLCBKQNF-JOCHJYFZSA-N 1 2 318.486 4.006 20 0 DIADLO FC(F)c1ccc(C[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)cc1 ZINC000292110980 1044137875 /nfs/dbraw/zinc/13/78/75/1044137875.db2.gz KFECHLGVWHYWIF-OAHLLOKOSA-N 1 2 320.387 4.154 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@H](C)c2ccc(F)cc2C)n1 ZINC000932557873 1044142062 /nfs/dbraw/zinc/14/20/62/1044142062.db2.gz VKCCYILSMYIGGG-NEPJUHHUSA-N 1 2 323.437 4.182 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cncc(Cl)c1Cl ZINC001308745964 1044143396 /nfs/dbraw/zinc/14/33/96/1044143396.db2.gz JMURROCWSURBAB-AWEZNQCLSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cncc(Cl)c1Cl ZINC001308745964 1044143403 /nfs/dbraw/zinc/14/34/03/1044143403.db2.gz JMURROCWSURBAB-AWEZNQCLSA-N 1 2 310.228 4.367 20 0 DIADLO O=C(Nc1cccc(C2CCC2)c1)N1CCC(n2cc[nH+]c2)CC1 ZINC000292167199 1044145273 /nfs/dbraw/zinc/14/52/73/1044145273.db2.gz YFMPLHZUMLSHKR-UHFFFAOYSA-N 1 2 324.428 4.020 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@@H](C)c2ccc(OC)c(C)c2)n1 ZINC000932576308 1044146468 /nfs/dbraw/zinc/14/64/68/1044146468.db2.gz QFPKEOSHHVPZDC-KBPBESRZSA-N 1 2 317.433 4.141 20 0 DIADLO Cc1oc2ccccc2c1C[NH2+][C@H](c1nnc[nH]1)C1CCCCC1 ZINC000292287228 1044158496 /nfs/dbraw/zinc/15/84/96/1044158496.db2.gz VAJPAAMZCBLEJD-SFHVURJKSA-N 1 2 324.428 4.271 20 0 DIADLO CCc1nc(C)c(CNc2c(C)c[nH+]c3c(OC)cccc23)o1 ZINC000292443592 1044172179 /nfs/dbraw/zinc/17/21/79/1044172179.db2.gz YMWDVNHKBOKQRK-UHFFFAOYSA-N 1 2 311.385 4.023 20 0 DIADLO C[C@H]([NH2+]Cc1nc2cc(Cl)ccc2s1)c1ccccn1 ZINC000346976728 1044179322 /nfs/dbraw/zinc/17/93/22/1044179322.db2.gz HLUGDHZTGPUSEU-JTQLQIEISA-N 1 2 303.818 4.196 20 0 DIADLO COc1ccncc1C[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000347008518 1044183079 /nfs/dbraw/zinc/18/30/79/1044183079.db2.gz FAAPZKYOONUHTO-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1ccncc1C[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000347008518 1044183086 /nfs/dbraw/zinc/18/30/86/1044183086.db2.gz FAAPZKYOONUHTO-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO Fc1cncc(C[NH+]2CCC(=Cc3ccccc3F)CC2)c1 ZINC000347055216 1044189417 /nfs/dbraw/zinc/18/94/17/1044189417.db2.gz MOGHLFRQFMIMPB-UHFFFAOYSA-N 1 2 300.352 4.039 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nccn1C)c1ccc(F)cc1)c1cccs1 ZINC000359729121 1044195101 /nfs/dbraw/zinc/19/51/01/1044195101.db2.gz JPLVFJWQBQUUOE-BLLLJJGKSA-N 1 2 315.417 4.061 20 0 DIADLO CCCCc1nc(C[NH2+][C@@]2(C)CCOc3ccccc32)cs1 ZINC000933365584 1044196275 /nfs/dbraw/zinc/19/62/75/1044196275.db2.gz CVMPSTPENJZZSC-SFHVURJKSA-N 1 2 316.470 4.273 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+]C(c2ccccc2)c2ccccc2)n1 ZINC000882877825 1044197842 /nfs/dbraw/zinc/19/78/42/1044197842.db2.gz GLYCZBOKATVLDV-UHFFFAOYSA-N 1 2 305.425 4.412 20 0 DIADLO Cc1c2cc(F)ccc2oc1C[NH2+]Cc1nc(C(C)C)c[nH]1 ZINC000882923084 1044205015 /nfs/dbraw/zinc/20/50/15/1044205015.db2.gz VQVUSWNMUNVOKS-UHFFFAOYSA-N 1 2 301.365 4.017 20 0 DIADLO CCO[C@@H]1C[C@@H](Nc2cc(CSCC)cc[nH+]2)C12CCC2 ZINC000347205762 1044207142 /nfs/dbraw/zinc/20/71/42/1044207142.db2.gz QDPFPPGNZVVEHT-HUUCEWRRSA-N 1 2 306.475 4.094 20 0 DIADLO Cc1ncc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)s1 ZINC000347223474 1044208341 /nfs/dbraw/zinc/20/83/41/1044208341.db2.gz FFCNCEYONILASU-MRXNPFEDSA-N 1 2 308.397 4.457 20 0 DIADLO Cc1ncc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)s1 ZINC000347223474 1044208351 /nfs/dbraw/zinc/20/83/51/1044208351.db2.gz FFCNCEYONILASU-MRXNPFEDSA-N 1 2 308.397 4.457 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000292825679 1044217716 /nfs/dbraw/zinc/21/77/16/1044217716.db2.gz OIWAINBVQNTUPS-SFHVURJKSA-N 1 2 316.470 4.148 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000292825679 1044217722 /nfs/dbraw/zinc/21/77/22/1044217722.db2.gz OIWAINBVQNTUPS-SFHVURJKSA-N 1 2 316.470 4.148 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+]Cc2ccc(-c3ccco3)cc2F)n1 ZINC000883105985 1044221466 /nfs/dbraw/zinc/22/14/66/1044221466.db2.gz DDXJSTNZGOZJAV-UHFFFAOYSA-N 1 2 313.376 4.222 20 0 DIADLO CSCc1cnc(C[NH2+]C(C)(C)c2ccccc2F)s1 ZINC000293085655 1044245755 /nfs/dbraw/zinc/24/57/55/1044245755.db2.gz WPOHXXOPCDDFKY-UHFFFAOYSA-N 1 2 310.463 4.170 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+]Cc1nccn1C(C)C ZINC000883258711 1044247145 /nfs/dbraw/zinc/24/71/45/1044247145.db2.gz MNBBPKGZBSHDOO-UHFFFAOYSA-N 1 2 321.852 4.194 20 0 DIADLO Cc1cc(C(=O)C[N@H+](Cc2ccco2)C(C)C)c(C)n1C1CC1 ZINC000444251373 1044247641 /nfs/dbraw/zinc/24/76/41/1044247641.db2.gz SYBWDQZMYONTLZ-UHFFFAOYSA-N 1 2 314.429 4.126 20 0 DIADLO Cc1cc(C(=O)C[N@@H+](Cc2ccco2)C(C)C)c(C)n1C1CC1 ZINC000444251373 1044247654 /nfs/dbraw/zinc/24/76/54/1044247654.db2.gz SYBWDQZMYONTLZ-UHFFFAOYSA-N 1 2 314.429 4.126 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2ccccc2F)C2CCCC2)[nH]1 ZINC000293106106 1044248246 /nfs/dbraw/zinc/24/82/46/1044248246.db2.gz JOXXZRGOIDGTDB-QGZVFWFLSA-N 1 2 316.424 4.088 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(Cl)cc1OC(C)C ZINC000883267968 1044256307 /nfs/dbraw/zinc/25/63/07/1044256307.db2.gz YWKPOOGGNGBZQT-ZDUSSCGKSA-N 1 2 321.852 4.194 20 0 DIADLO CC[C@@H]([NH2+]C1(c2ncccn2)CCC1)c1ccc(Cl)s1 ZINC000883312780 1044264602 /nfs/dbraw/zinc/26/46/02/1044264602.db2.gz MUQUYEOLGVWHON-LLVKDONJSA-N 1 2 307.850 4.312 20 0 DIADLO C[C@H]([NH2+]C1(c2ncccn2)CCC1)c1cccc(C(F)(F)F)c1 ZINC000883314231 1044268314 /nfs/dbraw/zinc/26/83/14/1044268314.db2.gz YSHYNSIAFTYBDY-LBPRGKRZSA-N 1 2 321.346 4.225 20 0 DIADLO Cc1cc(N[C@H](C)c2cc(Br)ncc2F)c[nH+]c1C ZINC000883343058 1044279573 /nfs/dbraw/zinc/27/95/73/1044279573.db2.gz YLNFCTGUBSRXJT-SNVBAGLBSA-N 1 2 324.197 4.168 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2cccc(O)c2Cl)C2CC2)n1 ZINC000293478555 1044289550 /nfs/dbraw/zinc/28/95/50/1044289550.db2.gz FOUPBPLMOVBTAQ-CQSZACIVSA-N 1 2 308.834 4.051 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@H](C)c2ccncc2F)c2ccccn2)c1 ZINC000563670170 1044300716 /nfs/dbraw/zinc/30/07/16/1044300716.db2.gz LFRXMERHXHRIIG-FOIQADDNSA-N 1 2 321.399 4.364 20 0 DIADLO FCc1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3F)C2)cc1 ZINC000778280086 1044301595 /nfs/dbraw/zinc/30/15/95/1044301595.db2.gz GOJNRHWNCRKWAH-SFHVURJKSA-N 1 2 321.342 4.008 20 0 DIADLO FCc1ccc(C[N@H+]2CCO[C@H](c3ccc(F)cc3F)C2)cc1 ZINC000778280086 1044301608 /nfs/dbraw/zinc/30/16/08/1044301608.db2.gz GOJNRHWNCRKWAH-SFHVURJKSA-N 1 2 321.342 4.008 20 0 DIADLO c1cn(C2CCCC2)nc1C[N@@H+]1Cc2ccccc2C2(CC2)C1 ZINC000360726858 1044304432 /nfs/dbraw/zinc/30/44/32/1044304432.db2.gz SNEAIKRCKMPLBX-UHFFFAOYSA-N 1 2 307.441 4.046 20 0 DIADLO c1cn(C2CCCC2)nc1C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000360726858 1044304435 /nfs/dbraw/zinc/30/44/35/1044304435.db2.gz SNEAIKRCKMPLBX-UHFFFAOYSA-N 1 2 307.441 4.046 20 0 DIADLO CC(C)CN(C(=O)c1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000563726441 1044304648 /nfs/dbraw/zinc/30/46/48/1044304648.db2.gz ZYBPEJCJZFNPMD-UHFFFAOYSA-N 1 2 319.408 4.175 20 0 DIADLO Cc1cc(Nc2cccc3[nH+]c(C)ccc23)n(-c2ccccn2)n1 ZINC001212794900 1044314197 /nfs/dbraw/zinc/31/41/97/1044314197.db2.gz CCHZBGGKSSMAAH-UHFFFAOYSA-N 1 2 315.380 4.176 20 0 DIADLO Cc1sc(Nc2cccc3[nH+]c(C)ccc23)c(C(N)=O)c1C ZINC001212795008 1044318263 /nfs/dbraw/zinc/31/82/63/1044318263.db2.gz JLZIKRIXOAPQKM-UHFFFAOYSA-N 1 2 311.410 4.064 20 0 DIADLO CSCc1cnc(C[NH2+][C@H](c2ncccc2C)C(C)C)s1 ZINC000293733985 1044318663 /nfs/dbraw/zinc/31/86/63/1044318663.db2.gz ZNJOFDFZDHKBDP-HNNXBMFYSA-N 1 2 321.515 4.196 20 0 DIADLO CC1(F)CC[NH+](Cc2cc(F)c(F)cc2Br)CC1 ZINC001142003813 1044331565 /nfs/dbraw/zinc/33/15/65/1044331565.db2.gz ZCBDLIVUTZRNGW-UHFFFAOYSA-N 1 2 322.168 4.051 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+](Cc2ccc(F)cc2)C(C)(C)C)o1 ZINC000132790138 1044333966 /nfs/dbraw/zinc/33/39/66/1044333966.db2.gz ZBTIWIVQKUPJBR-UHFFFAOYSA-N 1 2 319.424 4.307 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+](Cc2ccc(F)cc2)C(C)(C)C)o1 ZINC000132790138 1044333980 /nfs/dbraw/zinc/33/39/80/1044333980.db2.gz ZBTIWIVQKUPJBR-UHFFFAOYSA-N 1 2 319.424 4.307 20 0 DIADLO COc1cc(F)c([C@@H](C)[NH2+][C@H](C)c2nc(C)cs2)cc1OC ZINC000361012309 1044347397 /nfs/dbraw/zinc/34/73/97/1044347397.db2.gz IQTZIIIQAUFNPF-GHMZBOCLSA-N 1 2 324.421 4.020 20 0 DIADLO Cc1cc(NC(=O)C[C@@H](c2ccccc2)C(F)(F)F)cc[nH+]1 ZINC000103186455 1044348494 /nfs/dbraw/zinc/34/84/94/1044348494.db2.gz KKGMHOKYSCUJER-AWEZNQCLSA-N 1 2 308.303 4.065 20 0 DIADLO Cc1cccc(C)c1NC(=O)[C@@H](C)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000361057999 1044353212 /nfs/dbraw/zinc/35/32/12/1044353212.db2.gz AWNOJVOTIGPALW-HZPDHXFCSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1cccc(C)c1NC(=O)[C@@H](C)[N@H+]1Cc2ccccc2[C@H]1C ZINC000361057999 1044353224 /nfs/dbraw/zinc/35/32/24/1044353224.db2.gz AWNOJVOTIGPALW-HZPDHXFCSA-N 1 2 308.425 4.207 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)C(C)(C)CC(C)(C)C ZINC000935642125 1044355289 /nfs/dbraw/zinc/35/52/89/1044355289.db2.gz ACYVPFLVZYYSHF-UHFFFAOYSA-N 1 2 321.509 4.147 20 0 DIADLO Cc1ccc2c(Nc3nnccc3C(F)(F)F)cccc2[nH+]1 ZINC001212797124 1044355768 /nfs/dbraw/zinc/35/57/68/1044355768.db2.gz ZIBOWKYFRRBCPW-UHFFFAOYSA-N 1 2 304.275 4.096 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccc(OC3CCCC3)nc2)cs1 ZINC000361097302 1044361091 /nfs/dbraw/zinc/36/10/91/1044361091.db2.gz ORWIQDSOIRLASE-LBPRGKRZSA-N 1 2 317.458 4.019 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1cnc(-c3ccccn3)s1)C2 ZINC000361113834 1044361146 /nfs/dbraw/zinc/36/11/46/1044361146.db2.gz OHQLLRMPRQWTKT-UHFFFAOYSA-N 1 2 307.422 4.029 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1cnc(-c3ccccn3)s1)C2 ZINC000361113834 1044361162 /nfs/dbraw/zinc/36/11/62/1044361162.db2.gz OHQLLRMPRQWTKT-UHFFFAOYSA-N 1 2 307.422 4.029 20 0 DIADLO Cc1ccc2c(Nc3ccc(OC4COC4)cc3)cccc2[nH+]1 ZINC001212797643 1044366804 /nfs/dbraw/zinc/36/68/04/1044366804.db2.gz BFKAGGMAHGIHEC-UHFFFAOYSA-N 1 2 306.365 4.064 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1C[C@@H]2C[C@@H]2C[C@@H]1C ZINC000935759499 1044367493 /nfs/dbraw/zinc/36/74/93/1044367493.db2.gz JTJMDXAAXWDTHD-QCEMKRCNSA-N 1 2 309.413 4.006 20 0 DIADLO O=C(N[C@@H]1CCCCC12CCCC2)c1ccc(-n2cc[nH+]c2)cc1 ZINC000361191036 1044372168 /nfs/dbraw/zinc/37/21/68/1044372168.db2.gz QNYSODLMGATRFP-GOSISDBHSA-N 1 2 323.440 4.105 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+][C@H]1CCOc2c(F)ccc(F)c21 ZINC000361185828 1044373188 /nfs/dbraw/zinc/37/31/88/1044373188.db2.gz IUQWMQWSWJVROF-ABAIWWIYSA-N 1 2 319.351 4.148 20 0 DIADLO Cc1[nH+]cn(-c2ccc(NC/C=C\c3ccncc3)cc2)c1C ZINC000361227039 1044378299 /nfs/dbraw/zinc/37/82/99/1044378299.db2.gz DIHJSRIWZCASAZ-ARJAWSKDSA-N 1 2 304.397 4.009 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1cncc(C(F)(F)F)c1 ZINC000361291369 1044385888 /nfs/dbraw/zinc/38/58/88/1044385888.db2.gz WZBPFHSFYDMAPZ-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cncc(C(F)(F)F)c1 ZINC000361291369 1044385906 /nfs/dbraw/zinc/38/59/06/1044385906.db2.gz WZBPFHSFYDMAPZ-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cncc(C(F)(F)F)c1 ZINC000361311007 1044389861 /nfs/dbraw/zinc/38/98/61/1044389861.db2.gz VVIVNYTVYURDBP-LBPRGKRZSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cncc(C(F)(F)F)c1 ZINC000361311007 1044389877 /nfs/dbraw/zinc/38/98/77/1044389877.db2.gz VVIVNYTVYURDBP-LBPRGKRZSA-N 1 2 306.331 4.047 20 0 DIADLO Cc1ccccc1[C@@H](C)[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000564547833 1044391146 /nfs/dbraw/zinc/39/11/46/1044391146.db2.gz AJHWRJDUKYGZID-MRXNPFEDSA-N 1 2 303.409 4.258 20 0 DIADLO Cc1ccccc1[C@@H](C)[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000564547833 1044391159 /nfs/dbraw/zinc/39/11/59/1044391159.db2.gz AJHWRJDUKYGZID-MRXNPFEDSA-N 1 2 303.409 4.258 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncnn1C(C)(C)C)c1cccc(Cl)c1F ZINC000282874243 1044394623 /nfs/dbraw/zinc/39/46/23/1044394623.db2.gz VIWLGSDIESWBFZ-CYBMUJFWSA-N 1 2 324.831 4.067 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2ncc(CSC)s2)cc1 ZINC000294336705 1044408633 /nfs/dbraw/zinc/40/86/33/1044408633.db2.gz AJCMZTLGWDQPEY-GFCCVEGCSA-N 1 2 322.499 4.208 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2ncc(CSC)s2)cc1 ZINC000294336705 1044408636 /nfs/dbraw/zinc/40/86/36/1044408636.db2.gz AJCMZTLGWDQPEY-GFCCVEGCSA-N 1 2 322.499 4.208 20 0 DIADLO Cc1ccc([C@H](C)C[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)cc1 ZINC000565131385 1044416130 /nfs/dbraw/zinc/41/61/30/1044416130.db2.gz CFHIUXWWDKGOFB-CRAIPNDOSA-N 1 2 312.461 4.128 20 0 DIADLO CC(C)n1ccnc1C[N@H+](C)[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000361579958 1044419683 /nfs/dbraw/zinc/41/96/83/1044419683.db2.gz YLSVEALRQPWTCO-STQMWFEESA-N 1 2 303.372 4.017 20 0 DIADLO CC(C)n1ccnc1C[N@@H+](C)[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000361579958 1044419689 /nfs/dbraw/zinc/41/96/89/1044419689.db2.gz YLSVEALRQPWTCO-STQMWFEESA-N 1 2 303.372 4.017 20 0 DIADLO C[N@H+](Cc1cc2ccccc2o1)Cc1nccn1-c1ccccc1 ZINC000361565698 1044419900 /nfs/dbraw/zinc/41/99/00/1044419900.db2.gz NZINATGBMVEUJU-UHFFFAOYSA-N 1 2 317.392 4.251 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2o1)Cc1nccn1-c1ccccc1 ZINC000361565698 1044419906 /nfs/dbraw/zinc/41/99/06/1044419906.db2.gz NZINATGBMVEUJU-UHFFFAOYSA-N 1 2 317.392 4.251 20 0 DIADLO Cc1ccc(OC(F)F)c([C@@H](C)[NH2+][C@@H](C)c2cscn2)c1 ZINC000565247618 1044422228 /nfs/dbraw/zinc/42/22/28/1044422228.db2.gz UVWHQNYRQFBRHV-MNOVXSKESA-N 1 2 312.385 4.465 20 0 DIADLO Cc1cc(NC(=O)c2ccc(C3SCCS3)cc2)cc[nH+]1 ZINC000010162974 1044427034 /nfs/dbraw/zinc/42/70/34/1044427034.db2.gz HBAWIUIDEWAODB-UHFFFAOYSA-N 1 2 316.451 4.121 20 0 DIADLO Cc1nc(C[NH2+]C(c2cccs2)c2cccs2)[nH]c1C ZINC000565432347 1044434422 /nfs/dbraw/zinc/43/44/22/1044434422.db2.gz MNKQGGYGOSJIHG-UHFFFAOYSA-N 1 2 303.456 4.029 20 0 DIADLO Cc1[nH]c(CNC(c2cccs2)c2cccs2)[nH+]c1C ZINC000565432347 1044434430 /nfs/dbraw/zinc/43/44/30/1044434430.db2.gz MNKQGGYGOSJIHG-UHFFFAOYSA-N 1 2 303.456 4.029 20 0 DIADLO CC(C)c1ccc(C[N@@H+](Cc2cn(C(C)C)nn2)C2CC2)cc1 ZINC000565625984 1044444998 /nfs/dbraw/zinc/44/49/98/1044444998.db2.gz KOCXHZCWEPSJKU-UHFFFAOYSA-N 1 2 312.461 4.147 20 0 DIADLO CC(C)c1ccc(C[N@H+](Cc2cn(C(C)C)nn2)C2CC2)cc1 ZINC000565625984 1044445010 /nfs/dbraw/zinc/44/50/10/1044445010.db2.gz KOCXHZCWEPSJKU-UHFFFAOYSA-N 1 2 312.461 4.147 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)n1 ZINC000565639753 1044447296 /nfs/dbraw/zinc/44/72/96/1044447296.db2.gz VKZXIGJRMDLPOW-OAHLLOKOSA-N 1 2 323.799 4.226 20 0 DIADLO CCC(CC)[C@H](NC(=O)C[C@H](C)n1cc[nH+]c1)c1cccs1 ZINC000565660598 1044448188 /nfs/dbraw/zinc/44/81/88/1044448188.db2.gz JLZCNEABEKQCGD-GUYCJALGSA-N 1 2 319.474 4.189 20 0 DIADLO CC(C)(C[NH2+][C@H](c1cccs1)c1nnc[nH]1)C1CCCCC1 ZINC000294803939 1044462111 /nfs/dbraw/zinc/46/21/11/1044462111.db2.gz PCKMUIDUCQCPCO-OAHLLOKOSA-N 1 2 318.490 4.152 20 0 DIADLO CCc1ccc([C@@H](C)CC(=O)Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC000523093006 1044463421 /nfs/dbraw/zinc/46/34/21/1044463421.db2.gz CESFZHAJJMBMFY-AWEZNQCLSA-N 1 2 321.424 4.337 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]C2(c3nccs3)CCCC2)o1 ZINC000116374391 1044470146 /nfs/dbraw/zinc/47/01/46/1044470146.db2.gz VKJVXRWUXYNYBG-TZMCWYRMSA-N 1 2 302.443 4.419 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](C)c2cccc(O)c2)c2ccccn21 ZINC000566074179 1044473399 /nfs/dbraw/zinc/47/33/99/1044473399.db2.gz TWTVFLHSCSAOHU-CQSZACIVSA-N 1 2 309.413 4.014 20 0 DIADLO Cc1c[nH+]c(CCSCc2nc(C3CCCC3)no2)c(C)c1 ZINC000566239407 1044478636 /nfs/dbraw/zinc/47/86/36/1044478636.db2.gz ODZDVBYWIFVPHM-UHFFFAOYSA-N 1 2 317.458 4.215 20 0 DIADLO Cc1cccn2c([C@H](C)NC(=O)Nc3cccc(C)c3C)c[nH+]c12 ZINC001202709686 1044488855 /nfs/dbraw/zinc/48/88/55/1044488855.db2.gz IVTCMFRLHLEKPT-HNNXBMFYSA-N 1 2 322.412 4.142 20 0 DIADLO Cc1ccsc1-c1noc(-c2cccc(Cn3cc[nH+]c3)c2)n1 ZINC000566532679 1044496479 /nfs/dbraw/zinc/49/64/79/1044496479.db2.gz JMPNMOLKVLCKRJ-UHFFFAOYSA-N 1 2 322.393 4.018 20 0 DIADLO CCc1nnc(C[N@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)o1 ZINC000362382784 1044504304 /nfs/dbraw/zinc/50/43/04/1044504304.db2.gz BSNSPYHKHNWVME-OAHLLOKOSA-N 1 2 321.424 4.492 20 0 DIADLO CCc1nnc(C[N@@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)o1 ZINC000362382784 1044504313 /nfs/dbraw/zinc/50/43/13/1044504313.db2.gz BSNSPYHKHNWVME-OAHLLOKOSA-N 1 2 321.424 4.492 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2nccc3ccccc32)s1 ZINC000566766716 1044513435 /nfs/dbraw/zinc/51/34/35/1044513435.db2.gz BMAIYGBSMCMGIX-LBPRGKRZSA-N 1 2 312.442 4.061 20 0 DIADLO C[C@@H](NCc1ccc(F)c(C[NH+](C)C)c1)c1cc(F)ccc1F ZINC000120842943 1044514606 /nfs/dbraw/zinc/51/46/06/1044514606.db2.gz FEDJNUGUQNWCPX-GFCCVEGCSA-N 1 2 322.374 4.016 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000566776741 1044515329 /nfs/dbraw/zinc/51/53/29/1044515329.db2.gz DTSMKXWVDOQTAA-LLVKDONJSA-N 1 2 307.388 4.178 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000566776741 1044515347 /nfs/dbraw/zinc/51/53/47/1044515347.db2.gz DTSMKXWVDOQTAA-LLVKDONJSA-N 1 2 307.388 4.178 20 0 DIADLO Cc1nocc1C[N@H+]1CCC[C@@H]1c1nc2ccccc2n1C(C)C ZINC000295356707 1044515810 /nfs/dbraw/zinc/51/58/10/1044515810.db2.gz NOABERVLOKSJIS-GOSISDBHSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1nocc1C[N@@H+]1CCC[C@@H]1c1nc2ccccc2n1C(C)C ZINC000295356707 1044515827 /nfs/dbraw/zinc/51/58/27/1044515827.db2.gz NOABERVLOKSJIS-GOSISDBHSA-N 1 2 324.428 4.251 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2ncc(C)s2)c2cccnc2)cc1 ZINC000925153804 1044539412 /nfs/dbraw/zinc/53/94/12/1044539412.db2.gz VOTGGUKXIPRHAN-IBGZPJMESA-N 1 2 323.465 4.288 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1nc2cccnc2s1 ZINC000348328441 1044540812 /nfs/dbraw/zinc/54/08/12/1044540812.db2.gz KFIVVYZDWWSQDG-UHFFFAOYSA-N 1 2 315.467 4.045 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1nc2cccnc2s1 ZINC000348328441 1044540817 /nfs/dbraw/zinc/54/08/17/1044540817.db2.gz KFIVVYZDWWSQDG-UHFFFAOYSA-N 1 2 315.467 4.045 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@H]3C=CCCC3)c2)[nH+]c1C ZINC000778570427 1044543785 /nfs/dbraw/zinc/54/37/85/1044543785.db2.gz FZAWDIKQFQYRCZ-HNNXBMFYSA-N 1 2 309.413 4.378 20 0 DIADLO CCCCCCC(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1 ZINC000884971565 1044556853 /nfs/dbraw/zinc/55/68/53/1044556853.db2.gz ONBZAUKNFBTILC-UHFFFAOYSA-N 1 2 323.506 4.284 20 0 DIADLO CC(C)Oc1cccc([C@@H]([NH2+]CC2CC(F)(F)C2)C(F)F)c1 ZINC000567290883 1044557157 /nfs/dbraw/zinc/55/71/57/1044557157.db2.gz OKQFCVIEHFSUIY-CQSZACIVSA-N 1 2 319.342 4.415 20 0 DIADLO CCCOc1cccc2c(N[C@H](C)c3cn(C)nc3C)cc[nH+]c12 ZINC000194712263 1044557349 /nfs/dbraw/zinc/55/73/49/1044557349.db2.gz YUIKVZPBEFBOHR-CYBMUJFWSA-N 1 2 324.428 4.239 20 0 DIADLO O=C(C/C=C/c1cccc(F)c1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000362900542 1044558943 /nfs/dbraw/zinc/55/89/43/1044558943.db2.gz KRXBRKGGKXKRGN-DUXPYHPUSA-N 1 2 321.355 4.053 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2OCc2ccccc2)no1 ZINC000567432402 1044565451 /nfs/dbraw/zinc/56/54/51/1044565451.db2.gz SQGZBGFCXQKVNA-MRXNPFEDSA-N 1 2 322.408 4.413 20 0 DIADLO Cc1[nH+]cc(CNc2ccc3scnc3c2)n1-c1ccccc1 ZINC000362991439 1044573887 /nfs/dbraw/zinc/57/38/87/1044573887.db2.gz AXQKPCXAYXEODA-UHFFFAOYSA-N 1 2 320.421 4.403 20 0 DIADLO c1nnc([C@H]([NH2+]Cc2ccc(C3CCC3)cc2)C2CCCCC2)[nH]1 ZINC000567560104 1044575073 /nfs/dbraw/zinc/57/50/73/1044575073.db2.gz OSJQFFPEQVMSJG-LJQANCHMSA-N 1 2 324.472 4.483 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1ccccc1Br ZINC000295977026 1044580479 /nfs/dbraw/zinc/58/04/79/1044580479.db2.gz MZTJVOUWMXHJTM-NEPJUHHUSA-N 1 2 322.250 4.077 20 0 DIADLO CC(C)c1nc([C@H]2CCC[N@@H+]2Cc2cccc3ccoc32)no1 ZINC000567680547 1044580661 /nfs/dbraw/zinc/58/06/61/1044580661.db2.gz KZJSPFOSEBWHTE-OAHLLOKOSA-N 1 2 311.385 4.276 20 0 DIADLO CC(C)c1nc([C@H]2CCC[N@H+]2Cc2cccc3ccoc32)no1 ZINC000567680547 1044580667 /nfs/dbraw/zinc/58/06/67/1044580667.db2.gz KZJSPFOSEBWHTE-OAHLLOKOSA-N 1 2 311.385 4.276 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CC[C@H]3CCC[C@@H]3C2)c(C)[nH+]1 ZINC000567849577 1044588690 /nfs/dbraw/zinc/58/86/90/1044588690.db2.gz JQDWICVOOQNEMQ-BZUAXINKSA-N 1 2 301.434 4.097 20 0 DIADLO C[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2)c2ccc(F)cc2)c2nccn21 ZINC000296186194 1044595267 /nfs/dbraw/zinc/59/52/67/1044595267.db2.gz YGHOSUYRCUKWGM-MDASCCDHSA-N 1 2 321.399 4.407 20 0 DIADLO O=C(CC1CCCCC1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000523312085 1044598367 /nfs/dbraw/zinc/59/83/67/1044598367.db2.gz FQZHEHJRTQQCLS-UHFFFAOYSA-N 1 2 317.820 4.435 20 0 DIADLO Cc1[nH]nc(CNc2ccc([N@H+]3CCCC[C@H]3C)cc2C)c1C ZINC000886040433 1044601144 /nfs/dbraw/zinc/60/11/44/1044601144.db2.gz YZDOXRYCSPLTCS-CQSZACIVSA-N 1 2 312.461 4.326 20 0 DIADLO Cc1[nH]nc(CNc2ccc([N@@H+]3CCCC[C@H]3C)cc2C)c1C ZINC000886040433 1044601155 /nfs/dbraw/zinc/60/11/55/1044601155.db2.gz YZDOXRYCSPLTCS-CQSZACIVSA-N 1 2 312.461 4.326 20 0 DIADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H](CC1CCCCC1)C(C)(C)C ZINC000568199255 1044607733 /nfs/dbraw/zinc/60/77/33/1044607733.db2.gz RJLRLVIGZRNDNL-RHSMWYFYSA-N 1 2 319.493 4.090 20 0 DIADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H](CC1CCCCC1)C(C)(C)C ZINC000568199255 1044607741 /nfs/dbraw/zinc/60/77/41/1044607741.db2.gz RJLRLVIGZRNDNL-RHSMWYFYSA-N 1 2 319.493 4.090 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2nnc(C(C)C)[nH]2)c2ccccc2)cc1 ZINC000296313063 1044607718 /nfs/dbraw/zinc/60/77/18/1044607718.db2.gz GMMUOWUFVPGQQC-IBGZPJMESA-N 1 2 320.440 4.116 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)cs1 ZINC000444711131 1044611065 /nfs/dbraw/zinc/61/10/65/1044611065.db2.gz UAODSERWOVSDIM-JTQLQIEISA-N 1 2 306.397 4.215 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)cs1 ZINC000444711131 1044611071 /nfs/dbraw/zinc/61/10/71/1044611071.db2.gz UAODSERWOVSDIM-JTQLQIEISA-N 1 2 306.397 4.215 20 0 DIADLO COC(=O)c1oc([C@@H](C)[N@H+](C)Cc2cc(C)ccc2F)cc1C ZINC000444735063 1044614409 /nfs/dbraw/zinc/61/44/09/1044614409.db2.gz ONYCDDILXBQBFM-CYBMUJFWSA-N 1 2 319.376 4.015 20 0 DIADLO COC(=O)c1oc([C@@H](C)[N@@H+](C)Cc2cc(C)ccc2F)cc1C ZINC000444735063 1044614418 /nfs/dbraw/zinc/61/44/18/1044614418.db2.gz ONYCDDILXBQBFM-CYBMUJFWSA-N 1 2 319.376 4.015 20 0 DIADLO OCC[C@@H](Nc1cc[nH+]c2c(Cl)cccc12)c1ccccc1 ZINC000568427740 1044623951 /nfs/dbraw/zinc/62/39/51/1044623951.db2.gz LTPPMLQOSVDERC-MRXNPFEDSA-N 1 2 312.800 4.424 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)[nH]1 ZINC000296605483 1044633500 /nfs/dbraw/zinc/63/35/00/1044633500.db2.gz VXTVBIJUMXAZSD-SECBINFHSA-N 1 2 313.232 4.086 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000523443940 1044638945 /nfs/dbraw/zinc/63/89/45/1044638945.db2.gz KABNUULREZYQTK-JQWIXIFHSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000523443940 1044638950 /nfs/dbraw/zinc/63/89/50/1044638950.db2.gz KABNUULREZYQTK-JQWIXIFHSA-N 1 2 323.305 4.069 20 0 DIADLO c1coc(-c2nc(C[NH2+][C@@H]3CCCc4occc43)cs2)c1 ZINC000067968325 1044647059 /nfs/dbraw/zinc/64/70/59/1044647059.db2.gz WHONCUMNQOIMRS-CYBMUJFWSA-N 1 2 300.383 4.163 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1sccc1Br)c1cscn1 ZINC000568783142 1044648243 /nfs/dbraw/zinc/64/82/43/1044648243.db2.gz NWEAILQBIZWHFW-SFYZADRCSA-N 1 2 317.277 4.379 20 0 DIADLO CCc1ccc(C[NH2+][C@H](CO)c2c(Cl)cccc2Cl)cc1 ZINC000475619915 1044666970 /nfs/dbraw/zinc/66/69/70/1044666970.db2.gz BBDNWAYWGMRFPJ-MRXNPFEDSA-N 1 2 324.251 4.379 20 0 DIADLO C[C@@H]([NH2+]Cc1ncoc1-c1ccccc1)c1ccc(F)cc1F ZINC000364492002 1044667063 /nfs/dbraw/zinc/66/70/63/1044667063.db2.gz DJRQSLZUANWBOP-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO Cc1cc(C)c(CNC(=O)[C@@](C)(Cc2ccccc2)C(C)C)c[nH+]1 ZINC001275917558 1044667860 /nfs/dbraw/zinc/66/78/60/1044667860.db2.gz UQZZBBJBXLGRQD-NRFANRHFSA-N 1 2 324.468 4.220 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2cccc(C3CCCC3)c2)c[nH+]1 ZINC001275917862 1044669363 /nfs/dbraw/zinc/66/93/63/1044669363.db2.gz ZQHRJEZOCXFWIN-UHFFFAOYSA-N 1 2 308.425 4.286 20 0 DIADLO Clc1cc(Cl)c2c(c1)CC[N@@H+](CCc1cscn1)C2 ZINC000569073748 1044671841 /nfs/dbraw/zinc/67/18/41/1044671841.db2.gz HORZRWVVUXLPQQ-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO Clc1cc(Cl)c2c(c1)CC[N@H+](CCc1cscn1)C2 ZINC000569073748 1044671851 /nfs/dbraw/zinc/67/18/51/1044671851.db2.gz HORZRWVVUXLPQQ-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000364642709 1044673546 /nfs/dbraw/zinc/67/35/46/1044673546.db2.gz RCVDWXOXUSQKQU-YJBOKZPZSA-N 1 2 305.466 4.112 20 0 DIADLO Cn1ccnc1[C@H]([NH2+]Cc1ccc2occc2c1)c1ccccc1 ZINC000569248633 1044687405 /nfs/dbraw/zinc/68/74/05/1044687405.db2.gz ARPLWOCMYJQORF-LJQANCHMSA-N 1 2 317.392 4.046 20 0 DIADLO Cn1ccnc1[C@@H]([NH2+]Cc1ccc2occc2c1)c1ccccc1 ZINC000569248632 1044687713 /nfs/dbraw/zinc/68/77/13/1044687713.db2.gz ARPLWOCMYJQORF-IBGZPJMESA-N 1 2 317.392 4.046 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1cnccn1 ZINC000445227256 1044689429 /nfs/dbraw/zinc/68/94/29/1044689429.db2.gz FWMSXMWFISEQRI-OAHLLOKOSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1cnccn1 ZINC000445227256 1044689433 /nfs/dbraw/zinc/68/94/33/1044689433.db2.gz FWMSXMWFISEQRI-OAHLLOKOSA-N 1 2 310.228 4.367 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000076120379 1044691351 /nfs/dbraw/zinc/69/13/51/1044691351.db2.gz QEEUDJVULKDLJE-TZMCWYRMSA-N 1 2 303.406 4.068 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000076120379 1044691356 /nfs/dbraw/zinc/69/13/56/1044691356.db2.gz QEEUDJVULKDLJE-TZMCWYRMSA-N 1 2 303.406 4.068 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000365457862 1044692782 /nfs/dbraw/zinc/69/27/82/1044692782.db2.gz IIFKMWLWKZYNKO-DLBZAZTESA-N 1 2 319.493 4.123 20 0 DIADLO O=C(Nc1ccccc1-c1ccccc1)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000366190917 1044714853 /nfs/dbraw/zinc/71/48/53/1044714853.db2.gz LHGNPSQABSWIKE-MRXNPFEDSA-N 1 2 317.392 4.135 20 0 DIADLO c1csc(C2([NH2+]Cc3nc4ccccc4s3)CCCC2)n1 ZINC000081577888 1044717648 /nfs/dbraw/zinc/71/76/48/1044717648.db2.gz LNPOXPVITZRUMA-UHFFFAOYSA-N 1 2 315.467 4.312 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C(F)F)no1)c1cccc2ccccc21 ZINC000886919299 1044717857 /nfs/dbraw/zinc/71/78/57/1044717857.db2.gz HAJYQZHMNAOYKP-AWEZNQCLSA-N 1 2 317.339 4.401 20 0 DIADLO CC1(C)CCc2onc(C[NH2+][C@H]3CCc4c3cccc4F)c2C1 ZINC000886924120 1044719791 /nfs/dbraw/zinc/71/97/91/1044719791.db2.gz KGUIGWSSYZBQNO-INIZCTEOSA-N 1 2 314.404 4.106 20 0 DIADLO C[C@@H]([NH2+]Cc1csnn1)c1cccc(SC(F)(F)F)c1 ZINC000886931212 1044720485 /nfs/dbraw/zinc/72/04/85/1044720485.db2.gz HCNJTUNXEGTBMO-MRVPVSSYSA-N 1 2 319.377 4.001 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](c2cccs2)C2CC2)c(C)[nH+]1 ZINC000570019917 1044726381 /nfs/dbraw/zinc/72/63/81/1044726381.db2.gz VCCWCOOVCGCPJB-INIZCTEOSA-N 1 2 315.442 4.341 20 0 DIADLO COc1cccc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)c1F ZINC000367243781 1044735338 /nfs/dbraw/zinc/73/53/38/1044735338.db2.gz MLTXXCNSLCCPOT-FQEVSTJZSA-N 1 2 322.383 4.109 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H]2CCCOc3c(Cl)cccc32)no1 ZINC000367381717 1044739224 /nfs/dbraw/zinc/73/92/24/1044739224.db2.gz LSSQODVVFYCUIN-FZMZJTMJSA-N 1 2 306.793 4.201 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cn3ccccc3n2)C2CC2)o1 ZINC000524143092 1044747054 /nfs/dbraw/zinc/74/70/54/1044747054.db2.gz HPNFDGIPUDAXNV-KSSFIOAISA-N 1 2 321.424 4.215 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cn3ccccc3n2)C2CC2)o1 ZINC000524143092 1044747068 /nfs/dbraw/zinc/74/70/68/1044747068.db2.gz HPNFDGIPUDAXNV-KSSFIOAISA-N 1 2 321.424 4.215 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000524179628 1044760607 /nfs/dbraw/zinc/76/06/07/1044760607.db2.gz ZBNWTONZVRVBHV-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000524179628 1044760617 /nfs/dbraw/zinc/76/06/17/1044760617.db2.gz ZBNWTONZVRVBHV-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000524179626 1044761141 /nfs/dbraw/zinc/76/11/41/1044761141.db2.gz ZBNWTONZVRVBHV-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000524179626 1044761153 /nfs/dbraw/zinc/76/11/53/1044761153.db2.gz ZBNWTONZVRVBHV-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO CC[N@H+](Cc1nc(C(C)(C)c2ccccc2Cl)no1)C1CC1 ZINC000445680917 1044788834 /nfs/dbraw/zinc/78/88/34/1044788834.db2.gz JANNEYWCGQLFOP-UHFFFAOYSA-N 1 2 319.836 4.033 20 0 DIADLO CC[N@@H+](Cc1nc(C(C)(C)c2ccccc2Cl)no1)C1CC1 ZINC000445680917 1044788848 /nfs/dbraw/zinc/78/88/48/1044788848.db2.gz JANNEYWCGQLFOP-UHFFFAOYSA-N 1 2 319.836 4.033 20 0 DIADLO Cc1ccc(C)c(NC(=O)Nc2ccccc2-n2cc[nH+]c2)c1 ZINC001202755745 1044796657 /nfs/dbraw/zinc/79/66/57/1044796657.db2.gz HDKNOQCCXIBCOU-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2cccc(Cl)n2)c2ccccn2)cc1 ZINC000369290778 1044800031 /nfs/dbraw/zinc/80/00/31/1044800031.db2.gz RCQLZGPEUDCRCD-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2cc3cc(OC)ccc3o2)cs1 ZINC000125383400 1044802841 /nfs/dbraw/zinc/80/28/41/1044802841.db2.gz AWDPXXAHORIONF-LLVKDONJSA-N 1 2 316.426 4.311 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ccoc3Cl)c2)[nH+]c1C ZINC000369369934 1044803811 /nfs/dbraw/zinc/80/38/11/1044803811.db2.gz MNQSQMTWHZKGBX-UHFFFAOYSA-N 1 2 315.760 4.192 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2ccc(Cl)nc2)c2ccccn2)cc1 ZINC000369304661 1044804324 /nfs/dbraw/zinc/80/43/24/1044804324.db2.gz FBAPJJGKUKMXAC-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000369709552 1044814625 /nfs/dbraw/zinc/81/46/25/1044814625.db2.gz FNTVGUKOIGCTGD-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1nnc([C@H](C)[NH+]2CCC(F)(c3ccc(Cl)cc3)CC2)o1 ZINC000369737960 1044816061 /nfs/dbraw/zinc/81/60/61/1044816061.db2.gz JOPGLBSONWSXOK-NSHDSACASA-N 1 2 323.799 4.053 20 0 DIADLO Cc1nnc([C@@H](C)[NH+]2CCC(F)(c3ccc(Cl)cc3)CC2)o1 ZINC000369737956 1044816160 /nfs/dbraw/zinc/81/61/60/1044816160.db2.gz JOPGLBSONWSXOK-LLVKDONJSA-N 1 2 323.799 4.053 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+]C1(c2nc(C)cs2)CCC1 ZINC000263879277 1044834805 /nfs/dbraw/zinc/83/48/05/1044834805.db2.gz ABMZYCMIZJAHHD-UHFFFAOYSA-N 1 2 322.861 4.283 20 0 DIADLO CCOc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1csc(C)n1)CCO2 ZINC000370625018 1044844291 /nfs/dbraw/zinc/84/42/91/1044844291.db2.gz SZMMIKOIJMQTBQ-IAQYHMDHSA-N 1 2 318.442 4.025 20 0 DIADLO CC[C@@H](C)[C@@H](C(=O)Nc1ccn2cc[nH+]c2c1)c1ccccc1 ZINC000572549205 1044862295 /nfs/dbraw/zinc/86/22/95/1044862295.db2.gz LTNCXZYLUCIVED-RDTXWAMCSA-N 1 2 307.397 4.103 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2ccccc2SC)cs1 ZINC000337386274 1044888588 /nfs/dbraw/zinc/88/85/88/1044888588.db2.gz XKQMBZVEWXUVKU-VXGBXAGGSA-N 1 2 322.499 4.423 20 0 DIADLO CCc1cc(OCCCO[C@@H]2CCCCO2)c2ccccc2[nH+]1 ZINC000573240077 1044900929 /nfs/dbraw/zinc/90/09/29/1044900929.db2.gz HKXPHNWSRRYEGP-LJQANCHMSA-N 1 2 315.413 4.109 20 0 DIADLO c1cn(-c2cccc(-c3noc(C4=CCCCCC4)n3)c2)c[nH+]1 ZINC000573524605 1044911228 /nfs/dbraw/zinc/91/12/28/1044911228.db2.gz GANVRGHZZNAXKC-UHFFFAOYSA-N 1 2 306.369 4.270 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](CC(F)(F)F)c2ccccc2)nn1C ZINC000337532098 1044914809 /nfs/dbraw/zinc/91/48/09/1044914809.db2.gz VVRXOPKGZZVDKW-WFASDCNBSA-N 1 2 311.351 4.073 20 0 DIADLO C[C@H]1CCC[C@@H](c2noc(-c3cccc(Cn4cc[nH+]c4)c3)n2)C1 ZINC000573841858 1044926980 /nfs/dbraw/zinc/92/69/80/1044926980.db2.gz PRDCDOBFZMUDMD-GOEBONIOSA-N 1 2 322.412 4.275 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)n1 ZINC000573893222 1044932387 /nfs/dbraw/zinc/93/23/87/1044932387.db2.gz OHTSVLAMDATUKQ-VFZGTOFNSA-N 1 2 323.799 4.226 20 0 DIADLO CC(=O)Nc1cccc(C[N@@H+](C)[C@H](C)c2c(F)cccc2F)c1 ZINC000337663471 1044936069 /nfs/dbraw/zinc/93/60/69/1044936069.db2.gz NUQANSFWLBZEOY-GFCCVEGCSA-N 1 2 318.367 4.116 20 0 DIADLO CC(=O)Nc1cccc(C[N@H+](C)[C@H](C)c2c(F)cccc2F)c1 ZINC000337663471 1044936088 /nfs/dbraw/zinc/93/60/88/1044936088.db2.gz NUQANSFWLBZEOY-GFCCVEGCSA-N 1 2 318.367 4.116 20 0 DIADLO Cc1cc(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)no1 ZINC000574419130 1044952152 /nfs/dbraw/zinc/95/21/52/1044952152.db2.gz FRLUGYKANBRSMA-UHFFFAOYSA-N 1 2 319.817 4.050 20 0 DIADLO Cc1ccccc1[C@@H](c1noc(C[C@@H](C)n2cc[nH+]c2)n1)C(C)C ZINC000574457935 1044956003 /nfs/dbraw/zinc/95/60/03/1044956003.db2.gz SJZJROAFPSDLCW-QAPCUYQASA-N 1 2 324.428 4.166 20 0 DIADLO CN(CC1(c2ccc(Br)cc2)CC1)c1cccc[nH+]1 ZINC000524947938 1044957432 /nfs/dbraw/zinc/95/74/32/1044957432.db2.gz NUVIISKFUIXVGZ-UHFFFAOYSA-N 1 2 317.230 4.012 20 0 DIADLO Cc1cc2[nH]c(C[NH2+]Cc3nnc(C(C)C)s3)cc2c(C)c1 ZINC000358985046 1044973987 /nfs/dbraw/zinc/97/39/87/1044973987.db2.gz MCYBGDRJRJYOJY-UHFFFAOYSA-N 1 2 314.458 4.049 20 0 DIADLO C/C=C\c1ccc(NC(=O)[C@H]2CCc3[nH+]c(C(C)C)[nH]c3C2)cc1 ZINC000575210096 1044990188 /nfs/dbraw/zinc/99/01/88/1044990188.db2.gz UZJOFRHYYPIJQW-XVWMLYKFSA-N 1 2 323.440 4.310 20 0 DIADLO CC=Cc1ccc(NC(=O)[C@H]2CCc3[nH]c(C(C)C)[nH+]c3C2)cc1 ZINC000575210096 1044990204 /nfs/dbraw/zinc/99/02/04/1044990204.db2.gz UZJOFRHYYPIJQW-XVWMLYKFSA-N 1 2 323.440 4.310 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2cccc(Cl)c2)CCO1 ZINC000525125112 1044993281 /nfs/dbraw/zinc/99/32/81/1044993281.db2.gz ASQVLJNHHLYHBC-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2cccc(Cl)c2)CCO1 ZINC000525125112 1044993294 /nfs/dbraw/zinc/99/32/94/1044993294.db2.gz ASQVLJNHHLYHBC-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)cs1 ZINC000575220743 1044993933 /nfs/dbraw/zinc/99/39/33/1044993933.db2.gz VSUQCYIIOFRNJJ-GFCCVEGCSA-N 1 2 302.434 4.209 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC(F)(F)[C@H](C)C2)cs1 ZINC000575220743 1044993937 /nfs/dbraw/zinc/99/39/37/1044993937.db2.gz VSUQCYIIOFRNJJ-GFCCVEGCSA-N 1 2 302.434 4.209 20 0 DIADLO Cc1noc(C[NH2+][C@@H](c2cccc(Cl)c2)C2CCCCC2)n1 ZINC000150793249 1045007206 /nfs/dbraw/zinc/00/72/06/1045007206.db2.gz HBWVHEPYEINLNY-QGZVFWFLSA-N 1 2 319.836 4.443 20 0 DIADLO COc1cccc(C2([NH2+]Cc3csc(C(C)(C)C)n3)CC2)c1 ZINC000150887879 1045009396 /nfs/dbraw/zinc/00/93/96/1045009396.db2.gz HVFJXDCDXCFTKJ-UHFFFAOYSA-N 1 2 316.470 4.228 20 0 DIADLO Cc1csc(C[NH2+]Cc2ccc(C)cc2OC(C)(C)C)n1 ZINC000150971282 1045012009 /nfs/dbraw/zinc/01/20/09/1045012009.db2.gz UZHVDSPQPPLPBF-UHFFFAOYSA-N 1 2 304.459 4.227 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2ccc(-c3ncco3)cc2F)n1 ZINC000411519453 1045017054 /nfs/dbraw/zinc/01/70/54/1045017054.db2.gz MQBBUUOFHPXCTC-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO CCc1nc(C[N@@H+]2C[C@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000525272712 1045019278 /nfs/dbraw/zinc/01/92/78/1045019278.db2.gz OCUSPGCLYPLLPF-WBMJQRKESA-N 1 2 304.434 4.428 20 0 DIADLO CCc1nc(C[N@H+]2C[C@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000525272712 1045019289 /nfs/dbraw/zinc/01/92/89/1045019289.db2.gz OCUSPGCLYPLLPF-WBMJQRKESA-N 1 2 304.434 4.428 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCOC[C@@H]2c2ccccc2)cc1 ZINC000525269654 1045019905 /nfs/dbraw/zinc/01/99/05/1045019905.db2.gz PJHNOSKXIZBITF-QGZVFWFLSA-N 1 2 321.342 4.279 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCOC[C@@H]2c2ccccc2)cc1 ZINC000525269654 1045019915 /nfs/dbraw/zinc/01/99/15/1045019915.db2.gz PJHNOSKXIZBITF-QGZVFWFLSA-N 1 2 321.342 4.279 20 0 DIADLO CCc1cnc(C[N@@H+](CC)Cc2cccc(Br)c2)o1 ZINC000525269894 1045028264 /nfs/dbraw/zinc/02/82/64/1045028264.db2.gz ATOXJAYDPZGQQK-UHFFFAOYSA-N 1 2 323.234 4.022 20 0 DIADLO CCc1cnc(C[N@H+](CC)Cc2cccc(Br)c2)o1 ZINC000525269894 1045028279 /nfs/dbraw/zinc/02/82/79/1045028279.db2.gz ATOXJAYDPZGQQK-UHFFFAOYSA-N 1 2 323.234 4.022 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](C[C@H]1CCC3(CCCCC3)O1)C2 ZINC000411934051 1045038713 /nfs/dbraw/zinc/03/87/13/1045038713.db2.gz DKCSDAPSHIWDMM-LJQANCHMSA-N 1 2 313.441 4.087 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](C[C@H]1CCC3(CCCCC3)O1)C2 ZINC000411934051 1045038722 /nfs/dbraw/zinc/03/87/22/1045038722.db2.gz DKCSDAPSHIWDMM-LJQANCHMSA-N 1 2 313.441 4.087 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2ccccc2F)c2ccco2)cc1 ZINC000576192594 1045040815 /nfs/dbraw/zinc/04/08/15/1045040815.db2.gz KSRHABWXJPCHDJ-LJQANCHMSA-N 1 2 311.356 4.307 20 0 DIADLO FC(F)c1cccc(COc2ccccc2-n2cc[nH+]c2)c1 ZINC000576206327 1045042591 /nfs/dbraw/zinc/04/25/91/1045042591.db2.gz NCQGIOUOPCUFQD-UHFFFAOYSA-N 1 2 300.308 4.389 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+][C@H](COCC(C)C)c1ccco1 ZINC000152583771 1045044169 /nfs/dbraw/zinc/04/41/69/1045044169.db2.gz YDWMGLHDDNXXNU-DOTOQJQBSA-N 1 2 317.429 4.353 20 0 DIADLO CC[N@H+](Cc1occc1C)[C@@H](C)c1nnc(-c2ccccc2)o1 ZINC000412047860 1045050556 /nfs/dbraw/zinc/05/05/56/1045050556.db2.gz VNTKYTGHEMEDGF-AWEZNQCLSA-N 1 2 311.385 4.221 20 0 DIADLO CC[N@@H+](Cc1occc1C)[C@@H](C)c1nnc(-c2ccccc2)o1 ZINC000412047860 1045050568 /nfs/dbraw/zinc/05/05/68/1045050568.db2.gz VNTKYTGHEMEDGF-AWEZNQCLSA-N 1 2 311.385 4.221 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](c2cnn(C)c2)c2ccccc2)oc1C ZINC000374346087 1045051194 /nfs/dbraw/zinc/05/11/94/1045051194.db2.gz PRZDEWWDVLXWTJ-KUHUBIRLSA-N 1 2 309.413 4.070 20 0 DIADLO CC(C)Cn1ccc2cc(NC(=O)C[C@H](C)n3cc[nH+]c3)ccc21 ZINC000576470222 1045058769 /nfs/dbraw/zinc/05/87/69/1045058769.db2.gz VRGQXXHKCUCQHG-HNNXBMFYSA-N 1 2 324.428 4.084 20 0 DIADLO CC(C)(C)OC(=O)Nc1cccc(C[N@@H+]2CCC=C(F)C2)c1 ZINC000778960342 1045081297 /nfs/dbraw/zinc/08/12/97/1045081297.db2.gz JSGUPQMMKJGIDM-UHFFFAOYSA-N 1 2 306.381 4.093 20 0 DIADLO CC(C)(C)OC(=O)Nc1cccc(C[N@H+]2CCC=C(F)C2)c1 ZINC000778960342 1045081309 /nfs/dbraw/zinc/08/13/09/1045081309.db2.gz JSGUPQMMKJGIDM-UHFFFAOYSA-N 1 2 306.381 4.093 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)c2ccccn21 ZINC000576949463 1045089773 /nfs/dbraw/zinc/08/97/73/1045089773.db2.gz GQWMELAOZAEDEH-QGZVFWFLSA-N 1 2 308.429 4.123 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c2ccccn21 ZINC000576949463 1045089786 /nfs/dbraw/zinc/08/97/86/1045089786.db2.gz GQWMELAOZAEDEH-QGZVFWFLSA-N 1 2 308.429 4.123 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](C)Cc2cc(C(C)(C)C)n[nH]2)o1 ZINC000447077738 1045093600 /nfs/dbraw/zinc/09/36/00/1045093600.db2.gz MEXVHELYOUAVHO-DOMZBBRYSA-N 1 2 301.434 4.056 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2cc(C(C)(C)C)n[nH]2)o1 ZINC000447077738 1045093614 /nfs/dbraw/zinc/09/36/14/1045093614.db2.gz MEXVHELYOUAVHO-DOMZBBRYSA-N 1 2 301.434 4.056 20 0 DIADLO CCCn1ncnc1C[N@@H+]1CCC[C@@H]1c1ccc(C(C)C)cc1 ZINC000577144423 1045102478 /nfs/dbraw/zinc/10/24/78/1045102478.db2.gz ZPQPPEQPOSXLPU-GOSISDBHSA-N 1 2 312.461 4.149 20 0 DIADLO CCCn1ncnc1C[N@H+]1CCC[C@@H]1c1ccc(C(C)C)cc1 ZINC000577144423 1045102483 /nfs/dbraw/zinc/10/24/83/1045102483.db2.gz ZPQPPEQPOSXLPU-GOSISDBHSA-N 1 2 312.461 4.149 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2nc3ccc(C)cc3[nH]2)C2CCC2)o1 ZINC000577247736 1045110649 /nfs/dbraw/zinc/11/06/49/1045110649.db2.gz MPUXKZBVMSMJIE-IBGZPJMESA-N 1 2 309.413 4.404 20 0 DIADLO CSc1ccc(F)cc1C[NH2+][C@@H]1CCCc2oc(C)nc21 ZINC000925193487 1045110586 /nfs/dbraw/zinc/11/05/86/1045110586.db2.gz YTVPSVJMDUZAHT-CYBMUJFWSA-N 1 2 306.406 4.011 20 0 DIADLO CCCCn1c(S[C@@H](C)C(C)C)nnc1[C@H](CC)[NH+](C)C ZINC000412984844 1045116624 /nfs/dbraw/zinc/11/66/24/1045116624.db2.gz QNDHQKQNQZIIHN-KBPBESRZSA-N 1 2 312.527 4.228 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)Cc1ccc(C)cc1Cl ZINC000447308662 1045116716 /nfs/dbraw/zinc/11/67/16/1045116716.db2.gz GRABNXMMTAJMEQ-UHFFFAOYSA-N 1 2 319.861 4.298 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)Cc1ccc(C)cc1Cl ZINC000447308662 1045116722 /nfs/dbraw/zinc/11/67/22/1045116722.db2.gz GRABNXMMTAJMEQ-UHFFFAOYSA-N 1 2 319.861 4.298 20 0 DIADLO CC(C)[N@H+](Cc1ncc(Cl)n1C)Cc1cccc(Cl)c1 ZINC000047959379 1045118374 /nfs/dbraw/zinc/11/83/74/1045118374.db2.gz AORKKUCMKOIAMB-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO CC(C)[N@@H+](Cc1ncc(Cl)n1C)Cc1cccc(Cl)c1 ZINC000047959379 1045118379 /nfs/dbraw/zinc/11/83/79/1045118379.db2.gz AORKKUCMKOIAMB-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@H](c3cccs3)C2)c(Cl)c1 ZINC000447316114 1045118688 /nfs/dbraw/zinc/11/86/88/1045118688.db2.gz VZSODQVPPDMJJT-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@H](c3cccs3)C2)c(Cl)c1 ZINC000447316114 1045118692 /nfs/dbraw/zinc/11/86/92/1045118692.db2.gz VZSODQVPPDMJJT-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nccn2CCc2ccccc2)oc1C ZINC000282021407 1045120646 /nfs/dbraw/zinc/12/06/46/1045120646.db2.gz DYNYGKKDHODDRN-MRXNPFEDSA-N 1 2 323.440 4.186 20 0 DIADLO COC(=O)c1sccc1C[N@H+](Cc1cccc(F)c1)C(C)C ZINC000447373486 1045123230 /nfs/dbraw/zinc/12/32/30/1045123230.db2.gz LQVKFRBINLNSKY-UHFFFAOYSA-N 1 2 321.417 4.084 20 0 DIADLO COC(=O)c1sccc1C[N@@H+](Cc1cccc(F)c1)C(C)C ZINC000447373486 1045123237 /nfs/dbraw/zinc/12/32/37/1045123237.db2.gz LQVKFRBINLNSKY-UHFFFAOYSA-N 1 2 321.417 4.084 20 0 DIADLO C[N@H+](CCOc1ccc(F)cc1)Cc1nc(C(C)(C)C)cs1 ZINC000447374702 1045124190 /nfs/dbraw/zinc/12/41/90/1045124190.db2.gz OSMGLOZHRPCIOM-UHFFFAOYSA-N 1 2 322.449 4.091 20 0 DIADLO C[N@@H+](CCOc1ccc(F)cc1)Cc1nc(C(C)(C)C)cs1 ZINC000447374702 1045124197 /nfs/dbraw/zinc/12/41/97/1045124197.db2.gz OSMGLOZHRPCIOM-UHFFFAOYSA-N 1 2 322.449 4.091 20 0 DIADLO Cc1ccc(CC[C@@H](C)Nc2ccc(Cn3cc[nH+]c3)cn2)cc1 ZINC000577442969 1045125680 /nfs/dbraw/zinc/12/56/80/1045125680.db2.gz GPMRFCOPPYQENE-QGZVFWFLSA-N 1 2 320.440 4.068 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccn(-c3ccccc3F)n2)s1 ZINC000525833311 1045127943 /nfs/dbraw/zinc/12/79/43/1045127943.db2.gz ZQJJZDSPSBWCTH-UHFFFAOYSA-N 1 2 315.417 4.013 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccn(-c3ccccc3F)n2)s1 ZINC000525833311 1045127946 /nfs/dbraw/zinc/12/79/46/1045127946.db2.gz ZQJJZDSPSBWCTH-UHFFFAOYSA-N 1 2 315.417 4.013 20 0 DIADLO Cc1ccc(Cc2noc([C@@H](CC(C)C)n3cc[nH+]c3)n2)cc1C ZINC000924121978 1045147973 /nfs/dbraw/zinc/14/79/73/1045147973.db2.gz QRRVGCNIHATAPX-QGZVFWFLSA-N 1 2 324.428 4.109 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1nccn1C ZINC000447567071 1045151083 /nfs/dbraw/zinc/15/10/83/1045151083.db2.gz YVWQNPRATOPGDS-JSGCOSHPSA-N 1 2 311.351 4.073 20 0 DIADLO C[C@H]1CC(C)(C)C[C@@H]1Nc1ccccc1OCCn1cc[nH+]c1 ZINC000447595407 1045157419 /nfs/dbraw/zinc/15/74/19/1045157419.db2.gz NISQJJDXGGZGEE-RDJZCZTQSA-N 1 2 313.445 4.199 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@H+](Cc2coc(-c3ccccc3)n2)C1 ZINC000577772474 1045169311 /nfs/dbraw/zinc/16/93/11/1045169311.db2.gz VWHQQNPNMIWDBS-FQEVSTJZSA-N 1 2 322.383 4.412 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@@H+](Cc2coc(-c3ccccc3)n2)C1 ZINC000577772474 1045169317 /nfs/dbraw/zinc/16/93/17/1045169317.db2.gz VWHQQNPNMIWDBS-FQEVSTJZSA-N 1 2 322.383 4.412 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1cnc(C(F)(F)F)s1 ZINC000447736592 1045172309 /nfs/dbraw/zinc/17/23/09/1045172309.db2.gz NSHGUEACFBRRHE-QMMMGPOBSA-N 1 2 306.378 4.416 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1cnc(C(F)(F)F)s1 ZINC000447736592 1045172313 /nfs/dbraw/zinc/17/23/13/1045172313.db2.gz NSHGUEACFBRRHE-QMMMGPOBSA-N 1 2 306.378 4.416 20 0 DIADLO CCc1nnc(C[N@@H+](CC)C(c2ccccc2)c2ccccc2)o1 ZINC000557416249 1045174308 /nfs/dbraw/zinc/17/43/08/1045174308.db2.gz CGZZVZUIDQHDMJ-UHFFFAOYSA-N 1 2 321.424 4.244 20 0 DIADLO CCc1nnc(C[N@H+](CC)C(c2ccccc2)c2ccccc2)o1 ZINC000557416249 1045174312 /nfs/dbraw/zinc/17/43/12/1045174312.db2.gz CGZZVZUIDQHDMJ-UHFFFAOYSA-N 1 2 321.424 4.244 20 0 DIADLO C[N@H+](Cc1cnc(C(F)(F)F)s1)Cc1cccc(Cl)c1 ZINC000447797981 1045176780 /nfs/dbraw/zinc/17/67/80/1045176780.db2.gz PSYHNBJYKDEPIQ-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1cnc(C(F)(F)F)s1)Cc1cccc(Cl)c1 ZINC000447797981 1045176784 /nfs/dbraw/zinc/17/67/84/1045176784.db2.gz PSYHNBJYKDEPIQ-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO CC[C@@H]([NH2+][C@H]1CCCc2oc(C)nc21)c1ccccc1OC ZINC000924646063 1045187404 /nfs/dbraw/zinc/18/74/04/1045187404.db2.gz JRPAKZYJEPGPMS-CABCVRRESA-N 1 2 300.402 4.110 20 0 DIADLO CCO[C@@H]1C[C@@H](Nc2ccc([NH+]3CCCC3)cc2)C12CCCC2 ZINC000320737133 1045187672 /nfs/dbraw/zinc/18/76/72/1045187672.db2.gz MZJKCSUCXDXTJL-RTBURBONSA-N 1 2 314.473 4.437 20 0 DIADLO CC(C)(C)c1cnc(CNc2ccc(N3CCCC3)[nH+]c2)s1 ZINC000447899385 1045188361 /nfs/dbraw/zinc/18/83/61/1045188361.db2.gz SWLKKGBLKHCERO-UHFFFAOYSA-N 1 2 316.474 4.048 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@H](C)c1ccccc1OC(C)C ZINC000924692126 1045189294 /nfs/dbraw/zinc/18/92/94/1045189294.db2.gz LBJRJFVJGZIPAP-CJNGLKHVSA-N 1 2 314.429 4.498 20 0 DIADLO Cc1ccc2c(c1C)OC[C@H]2[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000447942463 1045190307 /nfs/dbraw/zinc/19/03/07/1045190307.db2.gz VBCGVALCACBVPB-CQSZACIVSA-N 1 2 316.470 4.281 20 0 DIADLO CCn1nc(C)c([C@H](C)[NH2+][C@@H](C)c2oc3ccccc3c2C)n1 ZINC000924773328 1045198104 /nfs/dbraw/zinc/19/81/04/1045198104.db2.gz OTBUSEMMIUBFQN-JSGCOSHPSA-N 1 2 312.417 4.073 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)C[C@@H](C2CC2)O1 ZINC000527239217 1045206062 /nfs/dbraw/zinc/20/60/62/1045206062.db2.gz VGZJINVDUTVURM-GUYCJALGSA-N 1 2 320.502 4.190 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)C[C@@H](C2CC2)O1 ZINC000527239217 1045206067 /nfs/dbraw/zinc/20/60/67/1045206067.db2.gz VGZJINVDUTVURM-GUYCJALGSA-N 1 2 320.502 4.190 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2Cl)on1 ZINC000924859531 1045206390 /nfs/dbraw/zinc/20/63/90/1045206390.db2.gz UEKGDNDYVFXLAL-BDAKNGLRSA-N 1 2 315.200 4.402 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccnn1C1CCC1 ZINC000924897913 1045209076 /nfs/dbraw/zinc/20/90/76/1045209076.db2.gz KDXOJONIQWLGNH-CQSZACIVSA-N 1 2 322.412 4.114 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H]2CCc3c2nccc3Cl)cs1 ZINC000925034768 1045221436 /nfs/dbraw/zinc/22/14/36/1045221436.db2.gz UKZXHRODBPCCEX-SKDRFNHKSA-N 1 2 307.850 4.092 20 0 DIADLO Cc1cc(F)ccc1-c1ccc(C[NH2+]Cc2nccs2)o1 ZINC000115612904 1045225159 /nfs/dbraw/zinc/22/51/59/1045225159.db2.gz YPEPGHAPMHDSNH-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO Clc1cccc2c1[C@@H]([NH2+][C@H]1CSc3ccccc31)COC2 ZINC000925091867 1045225298 /nfs/dbraw/zinc/22/52/98/1045225298.db2.gz DCAYMEVYEHLYFW-GJZGRUSLSA-N 1 2 317.841 4.348 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1cn2c(n1)CCCC2)c1ccc(F)cc1F ZINC000925097037 1045225464 /nfs/dbraw/zinc/22/54/64/1045225464.db2.gz JOTXGMRNSWZDLE-MLGOLLRUSA-N 1 2 319.399 4.300 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1cn2c(n1)CCCC2)c1ccc(F)cc1F ZINC000925097038 1045226759 /nfs/dbraw/zinc/22/67/59/1045226759.db2.gz JOTXGMRNSWZDLE-WBMJQRKESA-N 1 2 319.399 4.300 20 0 DIADLO Cc1nnsc1C[N@@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000578326662 1045230286 /nfs/dbraw/zinc/23/02/86/1045230286.db2.gz AKWYGWWIEZDIIB-SFHVURJKSA-N 1 2 321.449 4.146 20 0 DIADLO Cc1nnsc1C[N@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000578326662 1045230302 /nfs/dbraw/zinc/23/03/02/1045230302.db2.gz AKWYGWWIEZDIIB-SFHVURJKSA-N 1 2 321.449 4.146 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1cnn(C2CCC2)c1 ZINC000925152189 1045230876 /nfs/dbraw/zinc/23/08/76/1045230876.db2.gz GPIMTWVVPQQTHV-CQSZACIVSA-N 1 2 322.412 4.114 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2cc(-c3ccccc3)no2)s1 ZINC000925162517 1045231378 /nfs/dbraw/zinc/23/13/78/1045231378.db2.gz HRHYDJOJMAOONA-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1ccns1)c1nc(C(F)(F)F)cs1 ZINC000925196358 1045234907 /nfs/dbraw/zinc/23/49/07/1045234907.db2.gz ZPARSESGNQGMJE-JGVFFNPUSA-N 1 2 321.393 4.420 20 0 DIADLO CC(C)([NH2+]Cc1ccncc1Cl)c1nc2ccccc2s1 ZINC000527744666 1045257631 /nfs/dbraw/zinc/25/76/31/1045257631.db2.gz MYMISOSDIZRTOA-UHFFFAOYSA-N 1 2 317.845 4.370 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@@H](c2ccccn2)C2CCC2)cs1 ZINC000527773064 1045262325 /nfs/dbraw/zinc/26/23/25/1045262325.db2.gz OMTDMIRWYZJZGL-MRXNPFEDSA-N 1 2 315.486 4.467 20 0 DIADLO c1ccc(COC2CCN(c3[nH+]ccc4ccccc43)CC2)cc1 ZINC000527834931 1045267114 /nfs/dbraw/zinc/26/71/14/1045267114.db2.gz RUBMBHQCDFJQLD-UHFFFAOYSA-N 1 2 318.420 4.420 20 0 DIADLO C[C@H](CC(=O)N[C@H](CC(C)(C)C)c1ccccc1)n1cc[nH+]c1 ZINC000579115501 1045294498 /nfs/dbraw/zinc/29/44/98/1045294498.db2.gz OERLPSLSILIAJN-NVXWUHKLSA-N 1 2 313.445 4.128 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccncc1F ZINC000579148283 1045297331 /nfs/dbraw/zinc/29/73/31/1045297331.db2.gz KHHRXIVMNOVTEZ-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccc(Cl)c(F)c1 ZINC000579195787 1045299140 /nfs/dbraw/zinc/29/91/40/1045299140.db2.gz VEAXNUQTNMYAKU-MRVPVSSYSA-N 1 2 311.813 4.059 20 0 DIADLO CC[N@H+](Cc1cc(C(C)=O)no1)[C@H](C)c1cc2ccccc2o1 ZINC000579430598 1045315389 /nfs/dbraw/zinc/31/53/89/1045315389.db2.gz KNVVTFCTDBMLQD-GFCCVEGCSA-N 1 2 312.369 4.207 20 0 DIADLO CC[N@@H+](Cc1cc(C(C)=O)no1)[C@H](C)c1cc2ccccc2o1 ZINC000579430598 1045315396 /nfs/dbraw/zinc/31/53/96/1045315396.db2.gz KNVVTFCTDBMLQD-GFCCVEGCSA-N 1 2 312.369 4.207 20 0 DIADLO COc1ccccc1[C@@H]1CCN(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000579587213 1045324558 /nfs/dbraw/zinc/32/45/58/1045324558.db2.gz XUXZALPGAHVUJR-OAHLLOKOSA-N 1 2 322.383 4.376 20 0 DIADLO C=C(C)[C@H]([NH2+]Cc1cccc(Cl)n1)c1ccc(F)c(F)c1 ZINC000187772412 1045330855 /nfs/dbraw/zinc/33/08/55/1045330855.db2.gz RNUIIPWNMDBCKP-INIZCTEOSA-N 1 2 308.759 4.420 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1ccnn1C1CCCC1 ZINC000449011851 1045333719 /nfs/dbraw/zinc/33/37/19/1045333719.db2.gz VMZFTPLKCXXFGM-CQSZACIVSA-N 1 2 301.409 4.330 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccnn1C1CCCC1 ZINC000449011851 1045333724 /nfs/dbraw/zinc/33/37/24/1045333724.db2.gz VMZFTPLKCXXFGM-CQSZACIVSA-N 1 2 301.409 4.330 20 0 DIADLO COc1cc2ccccc2cc1C[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000449038116 1045336820 /nfs/dbraw/zinc/33/68/20/1045336820.db2.gz ROQDBLRFFZEDSI-HXUWFJFHSA-N 1 2 323.392 4.015 20 0 DIADLO COc1cc2ccccc2cc1C[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000449038116 1045336826 /nfs/dbraw/zinc/33/68/26/1045336826.db2.gz ROQDBLRFFZEDSI-HXUWFJFHSA-N 1 2 323.392 4.015 20 0 DIADLO Fc1ccc(CNc2[nH+]c3ccccc3n2C2CCCC2)cn1 ZINC000188538630 1045337054 /nfs/dbraw/zinc/33/70/54/1045337054.db2.gz DBXBUBYZGPXWNA-UHFFFAOYSA-N 1 2 310.376 4.298 20 0 DIADLO c1cn(CCOc2ccccc2N[C@@H]2CCCC23CCC3)c[nH+]1 ZINC000449050553 1045341128 /nfs/dbraw/zinc/34/11/28/1045341128.db2.gz PJOKTCIKECCWNN-GOSISDBHSA-N 1 2 311.429 4.097 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+][C@@H]2CCC23CCCC3)cc1 ZINC000189213208 1045343536 /nfs/dbraw/zinc/34/35/36/1045343536.db2.gz GAEZPSVLJWSFPX-CRAIPNDOSA-N 1 2 300.446 4.046 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1cc(CO)ccc1F ZINC000528352781 1045343890 /nfs/dbraw/zinc/34/38/90/1045343890.db2.gz FADQZTONNADMHN-LBPRGKRZSA-N 1 2 307.796 4.164 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1cc(CO)ccc1F ZINC000528352781 1045343894 /nfs/dbraw/zinc/34/38/94/1045343894.db2.gz FADQZTONNADMHN-LBPRGKRZSA-N 1 2 307.796 4.164 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)n1 ZINC000449117049 1045348550 /nfs/dbraw/zinc/34/85/50/1045348550.db2.gz NFKSLNILUNEBNI-KWQFWETISA-N 1 2 312.360 4.207 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1cccnc1C(F)(F)F ZINC000528400915 1045351203 /nfs/dbraw/zinc/35/12/03/1045351203.db2.gz SXPJJFCQEFRSRB-HNNXBMFYSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1cccnc1C(F)(F)F ZINC000528400915 1045351207 /nfs/dbraw/zinc/35/12/07/1045351207.db2.gz SXPJJFCQEFRSRB-HNNXBMFYSA-N 1 2 323.362 4.166 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2ccnn2C2CCCC2)on1 ZINC000449166404 1045357334 /nfs/dbraw/zinc/35/73/34/1045357334.db2.gz CQACBSBOCGSHBW-UHFFFAOYSA-N 1 2 316.449 4.180 20 0 DIADLO Cc1cccc(C[NH2+]Cc2c(F)cccc2OC(F)F)c1F ZINC000449179256 1045359139 /nfs/dbraw/zinc/35/91/39/1045359139.db2.gz WHKBLDPQLYDJJG-UHFFFAOYSA-N 1 2 313.294 4.164 20 0 DIADLO O=[N+]([O-])c1ccc(C[NH+]2CCC(C(F)(F)F)CC2)cc1Cl ZINC000189630243 1045359810 /nfs/dbraw/zinc/35/98/10/1045359810.db2.gz RAOLKYUIPHWLSM-UHFFFAOYSA-N 1 2 322.714 4.023 20 0 DIADLO FC(F)(F)c1ncccc1C[N@@H+]1Cc2ccccc2C2(CC2)C1 ZINC000528458151 1045361159 /nfs/dbraw/zinc/36/11/59/1045361159.db2.gz MZWWQZTZBUMVBS-UHFFFAOYSA-N 1 2 318.342 4.148 20 0 DIADLO FC(F)(F)c1ncccc1C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000528458151 1045361167 /nfs/dbraw/zinc/36/11/67/1045361167.db2.gz MZWWQZTZBUMVBS-UHFFFAOYSA-N 1 2 318.342 4.148 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1cccc(Br)c1F ZINC000449225638 1045364156 /nfs/dbraw/zinc/36/41/56/1045364156.db2.gz KYNUMNXZVKAZTN-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1cccc(Br)c1F ZINC000449225638 1045364150 /nfs/dbraw/zinc/36/41/50/1045364150.db2.gz KYNUMNXZVKAZTN-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cnc(-c3ccccc3F)s2)o1 ZINC000449224971 1045365722 /nfs/dbraw/zinc/36/57/22/1045365722.db2.gz IZUKBYSLANHCGE-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO CC(C)([NH2+]Cc1c(Cl)ccc2cccnc21)c1nccs1 ZINC000118848492 1045374511 /nfs/dbraw/zinc/37/45/11/1045374511.db2.gz HQPTWLSGVBXJKD-UHFFFAOYSA-N 1 2 317.845 4.370 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ncccc2Cl)cc1F ZINC000528554529 1045376979 /nfs/dbraw/zinc/37/69/79/1045376979.db2.gz LROYSKZJTSSJNR-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ncccc2Cl)cc1F ZINC000528554529 1045376983 /nfs/dbraw/zinc/37/69/83/1045376983.db2.gz LROYSKZJTSSJNR-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccccn1 ZINC000076902671 1045377102 /nfs/dbraw/zinc/37/71/02/1045377102.db2.gz UHGCKPKUTMCOQF-MRXNPFEDSA-N 1 2 313.426 4.285 20 0 DIADLO COCCCC[NH2+]c1ccc(OC)cc1OCc1ccccc1 ZINC000190149632 1045385690 /nfs/dbraw/zinc/38/56/90/1045385690.db2.gz RXWNPXGZFHOYBU-UHFFFAOYSA-N 1 2 315.413 4.113 20 0 DIADLO Cc1ccc(OCc2nc(C[N@@H+]3CC[C@H]3C3CC3)cs2)cc1 ZINC000449427130 1045392588 /nfs/dbraw/zinc/39/25/88/1045392588.db2.gz NKUQYHOHTAHPIO-KRWDZBQOSA-N 1 2 314.454 4.015 20 0 DIADLO Cc1ccc(OCc2nc(C[N@H+]3CC[C@H]3C3CC3)cs2)cc1 ZINC000449427130 1045392589 /nfs/dbraw/zinc/39/25/89/1045392589.db2.gz NKUQYHOHTAHPIO-KRWDZBQOSA-N 1 2 314.454 4.015 20 0 DIADLO c1c(C[NH2+][C@@H](c2ccccn2)C2CCC2)noc1-c1ccccc1 ZINC000528652107 1045393560 /nfs/dbraw/zinc/39/35/60/1045393560.db2.gz UKHXSXNPHUHQCI-HXUWFJFHSA-N 1 2 319.408 4.368 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000449456534 1045395826 /nfs/dbraw/zinc/39/58/26/1045395826.db2.gz CZVMJWLKQAVGGP-OCCSQVGLSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000449456534 1045395833 /nfs/dbraw/zinc/39/58/33/1045395833.db2.gz CZVMJWLKQAVGGP-OCCSQVGLSA-N 1 2 323.362 4.240 20 0 DIADLO COc1ccc(C(C)(C)[NH2+]Cc2cc(C(C)(C)C)on2)cc1F ZINC000528680657 1045395845 /nfs/dbraw/zinc/39/58/45/1045395845.db2.gz VQHGFGAHTQFWPS-UHFFFAOYSA-N 1 2 320.408 4.145 20 0 DIADLO Cc1ccoc1C[NH2+]Cc1nn(CCC(C)C)c2ccccc12 ZINC000449487833 1045401523 /nfs/dbraw/zinc/40/15/23/1045401523.db2.gz ARBYXBICHAWEAD-UHFFFAOYSA-N 1 2 311.429 4.274 20 0 DIADLO Cc1ccc(C[NH2+]Cc2nn(CCC(C)C)c3ccccc23)o1 ZINC000449489802 1045402587 /nfs/dbraw/zinc/40/25/87/1045402587.db2.gz UPYIIFYKUZQHPK-UHFFFAOYSA-N 1 2 311.429 4.274 20 0 DIADLO CCc1noc(C)c1C[N@@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000528722088 1045403380 /nfs/dbraw/zinc/40/33/80/1045403380.db2.gz WHNNUIOGWFSZFU-UHFFFAOYSA-N 1 2 324.346 4.123 20 0 DIADLO CCc1noc(C)c1C[N@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000528722088 1045403382 /nfs/dbraw/zinc/40/33/82/1045403382.db2.gz WHNNUIOGWFSZFU-UHFFFAOYSA-N 1 2 324.346 4.123 20 0 DIADLO Cc1noc([C@H](C)[N@H+]2CC=C(c3ccc(Cl)cc3C)CC2)n1 ZINC000528740515 1045406662 /nfs/dbraw/zinc/40/66/62/1045406662.db2.gz ILFIFSKLADYCGH-LBPRGKRZSA-N 1 2 317.820 4.190 20 0 DIADLO Cc1noc([C@H](C)[N@@H+]2CC=C(c3ccc(Cl)cc3C)CC2)n1 ZINC000528740515 1045406664 /nfs/dbraw/zinc/40/66/64/1045406664.db2.gz ILFIFSKLADYCGH-LBPRGKRZSA-N 1 2 317.820 4.190 20 0 DIADLO Cc1cnc(C[N@H+]2CC=C(c3ccc(Cl)cc3C)CC2)nc1 ZINC000528740351 1045407037 /nfs/dbraw/zinc/40/70/37/1045407037.db2.gz DXRYKQLZBYOCMY-UHFFFAOYSA-N 1 2 313.832 4.036 20 0 DIADLO Cc1cnc(C[N@@H+]2CC=C(c3ccc(Cl)cc3C)CC2)nc1 ZINC000528740351 1045407040 /nfs/dbraw/zinc/40/70/40/1045407040.db2.gz DXRYKQLZBYOCMY-UHFFFAOYSA-N 1 2 313.832 4.036 20 0 DIADLO c1csc(-c2nc(C[N@@H+]3CCSC[C@@H]3C3CC3)cs2)c1 ZINC000449527807 1045407702 /nfs/dbraw/zinc/40/77/02/1045407702.db2.gz LCUQARFSEABCBD-CYBMUJFWSA-N 1 2 322.524 4.199 20 0 DIADLO c1csc(-c2nc(C[N@H+]3CCSC[C@@H]3C3CC3)cs2)c1 ZINC000449527807 1045407705 /nfs/dbraw/zinc/40/77/05/1045407705.db2.gz LCUQARFSEABCBD-CYBMUJFWSA-N 1 2 322.524 4.199 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1ccc(Br)s1 ZINC000528764534 1045408548 /nfs/dbraw/zinc/40/85/48/1045408548.db2.gz FNSWTUBKEFHLGP-QMMMGPOBSA-N 1 2 310.207 4.130 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1ccc(Br)s1 ZINC000528764534 1045408553 /nfs/dbraw/zinc/40/85/53/1045408553.db2.gz FNSWTUBKEFHLGP-QMMMGPOBSA-N 1 2 310.207 4.130 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1ncc(-c2ccccc2F)o1 ZINC000528763713 1045408823 /nfs/dbraw/zinc/40/88/23/1045408823.db2.gz BBZOYPGQEIOAQM-LLVKDONJSA-N 1 2 310.319 4.100 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1ncc(-c2ccccc2F)o1 ZINC000528763713 1045408825 /nfs/dbraw/zinc/40/88/25/1045408825.db2.gz BBZOYPGQEIOAQM-LLVKDONJSA-N 1 2 310.319 4.100 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1CC(=O)Nc1ccccc1C(C)(C)C ZINC000528769482 1045411666 /nfs/dbraw/zinc/41/16/66/1045411666.db2.gz QLSOMAPQBBDVGR-ZDUSSCGKSA-N 1 2 324.415 4.042 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1CC(=O)Nc1ccccc1C(C)(C)C ZINC000528769482 1045411668 /nfs/dbraw/zinc/41/16/68/1045411668.db2.gz QLSOMAPQBBDVGR-ZDUSSCGKSA-N 1 2 324.415 4.042 20 0 DIADLO CC[C@@H](C)[N@H+](C)Cc1csc(N(C(C)=O)c2ccccc2)n1 ZINC000119240444 1045411700 /nfs/dbraw/zinc/41/17/00/1045411700.db2.gz MVIZCLVOMGFPSP-CYBMUJFWSA-N 1 2 317.458 4.058 20 0 DIADLO CC[C@@H](C)[N@@H+](C)Cc1csc(N(C(C)=O)c2ccccc2)n1 ZINC000119240444 1045411702 /nfs/dbraw/zinc/41/17/02/1045411702.db2.gz MVIZCLVOMGFPSP-CYBMUJFWSA-N 1 2 317.458 4.058 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2(C)C)no1 ZINC000528767368 1045411777 /nfs/dbraw/zinc/41/17/77/1045411777.db2.gz KAJBWPWQDQEKMA-HNNXBMFYSA-N 1 2 317.408 4.100 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2(C)C)no1 ZINC000528767368 1045411779 /nfs/dbraw/zinc/41/17/79/1045411779.db2.gz KAJBWPWQDQEKMA-HNNXBMFYSA-N 1 2 317.408 4.100 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1ncc(-c2ccc(F)cc2)o1 ZINC000528765030 1045411808 /nfs/dbraw/zinc/41/18/08/1045411808.db2.gz FVCYNFRDQZKEJH-LLVKDONJSA-N 1 2 310.319 4.100 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1ncc(-c2ccc(F)cc2)o1 ZINC000528765030 1045411809 /nfs/dbraw/zinc/41/18/09/1045411809.db2.gz FVCYNFRDQZKEJH-LLVKDONJSA-N 1 2 310.319 4.100 20 0 DIADLO Clc1ccc(C2C[NH+](Cc3csc(C4CC4)n3)C2)cc1 ZINC000449554570 1045412972 /nfs/dbraw/zinc/41/29/72/1045412972.db2.gz CQFYTWJHKKCCMS-UHFFFAOYSA-N 1 2 304.846 4.273 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2F)o1 ZINC000449563942 1045415059 /nfs/dbraw/zinc/41/50/59/1045415059.db2.gz ZWSBDWDKQLDYCA-CYBMUJFWSA-N 1 2 313.376 4.153 20 0 DIADLO CCCc1ncc(C[NH2+]Cc2nc(-c3ccccc3)cs2)o1 ZINC000449613078 1045418748 /nfs/dbraw/zinc/41/87/48/1045418748.db2.gz QPYDHGQAJCLEMD-UHFFFAOYSA-N 1 2 313.426 4.040 20 0 DIADLO CC1(C)C[C@H](O)CC[N@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449616396 1045422737 /nfs/dbraw/zinc/42/27/37/1045422737.db2.gz CRANCGKTMYXFQQ-SNVBAGLBSA-N 1 2 308.274 4.038 20 0 DIADLO CC1(C)C[C@H](O)CC[N@@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449616396 1045422741 /nfs/dbraw/zinc/42/27/41/1045422741.db2.gz CRANCGKTMYXFQQ-SNVBAGLBSA-N 1 2 308.274 4.038 20 0 DIADLO COc1ccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)cc1F ZINC000449632670 1045423670 /nfs/dbraw/zinc/42/36/70/1045423670.db2.gz NCDADEQDCHXENL-QGZVFWFLSA-N 1 2 301.361 4.155 20 0 DIADLO COc1ccc(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)cc1F ZINC000449632670 1045423672 /nfs/dbraw/zinc/42/36/72/1045423672.db2.gz NCDADEQDCHXENL-QGZVFWFLSA-N 1 2 301.361 4.155 20 0 DIADLO COc1cc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)cc(OC)c1 ZINC000449634134 1045423705 /nfs/dbraw/zinc/42/37/05/1045423705.db2.gz QVRLRUONCPOUSA-GOSISDBHSA-N 1 2 313.397 4.024 20 0 DIADLO COc1cc(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)cc(OC)c1 ZINC000449634134 1045423707 /nfs/dbraw/zinc/42/37/07/1045423707.db2.gz QVRLRUONCPOUSA-GOSISDBHSA-N 1 2 313.397 4.024 20 0 DIADLO CCc1ccc(-c2ccc(C[NH2+]Cc3ncccc3OC)o2)cc1 ZINC000449746369 1045434715 /nfs/dbraw/zinc/43/47/15/1045434715.db2.gz FNQOZRNGZKCJHZ-UHFFFAOYSA-N 1 2 322.408 4.202 20 0 DIADLO CC(=O)c1cccc(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)c1 ZINC000450272068 1045480418 /nfs/dbraw/zinc/48/04/18/1045480418.db2.gz VMZFOGYABXCQCJ-GFCCVEGCSA-N 1 2 303.352 4.360 20 0 DIADLO CC(=O)c1cccc(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)c1 ZINC000450272068 1045480421 /nfs/dbraw/zinc/48/04/21/1045480421.db2.gz VMZFOGYABXCQCJ-GFCCVEGCSA-N 1 2 303.352 4.360 20 0 DIADLO C[C@H](c1csnn1)[N@H+]1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000450247244 1045480579 /nfs/dbraw/zinc/48/05/79/1045480579.db2.gz XMZUHLCOOOBCCF-RDTXWAMCSA-N 1 2 321.449 4.247 20 0 DIADLO C[C@H](c1csnn1)[N@@H+]1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000450247244 1045480581 /nfs/dbraw/zinc/48/05/81/1045480581.db2.gz XMZUHLCOOOBCCF-RDTXWAMCSA-N 1 2 321.449 4.247 20 0 DIADLO CC(=O)c1ccc(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)cc1 ZINC000450267908 1045481913 /nfs/dbraw/zinc/48/19/13/1045481913.db2.gz BZXOLPRLYOBSCO-LBPRGKRZSA-N 1 2 303.352 4.360 20 0 DIADLO CC(=O)c1ccc(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)cc1 ZINC000450267908 1045481915 /nfs/dbraw/zinc/48/19/15/1045481915.db2.gz BZXOLPRLYOBSCO-LBPRGKRZSA-N 1 2 303.352 4.360 20 0 DIADLO CC[C@H](c1ccccc1)[N@H+](CC)Cc1nnc(C2CC2)s1 ZINC000450304472 1045484503 /nfs/dbraw/zinc/48/45/03/1045484503.db2.gz MGGZGDQKEBQBLP-OAHLLOKOSA-N 1 2 301.459 4.389 20 0 DIADLO CC[C@H](c1ccccc1)[N@@H+](CC)Cc1nnc(C2CC2)s1 ZINC000450304472 1045484506 /nfs/dbraw/zinc/48/45/06/1045484506.db2.gz MGGZGDQKEBQBLP-OAHLLOKOSA-N 1 2 301.459 4.389 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2nnc(C3CC3)s2)c1 ZINC000450297645 1045485437 /nfs/dbraw/zinc/48/54/37/1045485437.db2.gz KEZBFBCCBWOURK-ZDUSSCGKSA-N 1 2 301.459 4.225 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2nnc(C3CC3)s2)c1 ZINC000450297645 1045485442 /nfs/dbraw/zinc/48/54/42/1045485442.db2.gz KEZBFBCCBWOURK-ZDUSSCGKSA-N 1 2 301.459 4.225 20 0 DIADLO COCC[N@H+](Cc1ccco1)Cc1ccsc1C(F)(F)F ZINC000529523688 1045490252 /nfs/dbraw/zinc/49/02/52/1045490252.db2.gz BPHGDHMPXCKFSE-UHFFFAOYSA-N 1 2 319.348 4.009 20 0 DIADLO COCC[N@@H+](Cc1ccco1)Cc1ccsc1C(F)(F)F ZINC000529523688 1045490257 /nfs/dbraw/zinc/49/02/57/1045490257.db2.gz BPHGDHMPXCKFSE-UHFFFAOYSA-N 1 2 319.348 4.009 20 0 DIADLO CC(=O)c1ccc(C[N@@H+]2CCCC[C@@H]2c2nc(C)cs2)cc1 ZINC000450335325 1045494253 /nfs/dbraw/zinc/49/42/53/1045494253.db2.gz KTYSGSCUZQHHKO-QGZVFWFLSA-N 1 2 314.454 4.381 20 0 DIADLO CC(=O)c1ccc(C[N@H+]2CCCC[C@@H]2c2nc(C)cs2)cc1 ZINC000450335325 1045494255 /nfs/dbraw/zinc/49/42/55/1045494255.db2.gz KTYSGSCUZQHHKO-QGZVFWFLSA-N 1 2 314.454 4.381 20 0 DIADLO FC(F)(F)c1ccc2c(cc[nH+]c2N2CCOC3(CCC3)C2)c1 ZINC000450422664 1045503342 /nfs/dbraw/zinc/50/33/42/1045503342.db2.gz VUSGWAHCVBLOFW-UHFFFAOYSA-N 1 2 322.330 4.013 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2nnc(C3CC3)s2)C1 ZINC000450437189 1045503920 /nfs/dbraw/zinc/50/39/20/1045503920.db2.gz HXJDGTVBRPUVCG-NHYWBVRUSA-N 1 2 317.433 4.138 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2nnc(C3CC3)s2)C1 ZINC000450437189 1045503931 /nfs/dbraw/zinc/50/39/31/1045503931.db2.gz HXJDGTVBRPUVCG-NHYWBVRUSA-N 1 2 317.433 4.138 20 0 DIADLO CC(=O)c1cccc(C[N@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)c1 ZINC000450435357 1045504157 /nfs/dbraw/zinc/50/41/57/1045504157.db2.gz HVBUVOUAOKDZAJ-HRAATJIYSA-N 1 2 323.436 4.160 20 0 DIADLO CC(=O)c1cccc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)c1 ZINC000450435357 1045504160 /nfs/dbraw/zinc/50/41/60/1045504160.db2.gz HVBUVOUAOKDZAJ-HRAATJIYSA-N 1 2 323.436 4.160 20 0 DIADLO OCCCC1CCN(c2cc[nH+]c3cc(F)c(Cl)cc32)CC1 ZINC000450442276 1045505424 /nfs/dbraw/zinc/50/54/24/1045505424.db2.gz SHXXDLHVADPLLL-UHFFFAOYSA-N 1 2 322.811 4.016 20 0 DIADLO O=C(Nc1cccc(C2CCCCC2)c1)[C@H]1CCn2c[nH+]cc2C1 ZINC000529649531 1045507388 /nfs/dbraw/zinc/50/73/88/1045507388.db2.gz POJQCYULEHJOJZ-KRWDZBQOSA-N 1 2 323.440 4.132 20 0 DIADLO c1coc(CC2C[NH+](Cc3nc(-c4ccccc4)cs3)C2)c1 ZINC000529649269 1045507593 /nfs/dbraw/zinc/50/75/93/1045507593.db2.gz PNRIXCLOKHFTIU-UHFFFAOYSA-N 1 2 310.422 4.078 20 0 DIADLO c1coc(CC2C[NH+](Cc3csc(-c4ccccc4)n3)C2)c1 ZINC000529653649 1045508295 /nfs/dbraw/zinc/50/82/95/1045508295.db2.gz SSZBIKMZAHJTNY-UHFFFAOYSA-N 1 2 310.422 4.078 20 0 DIADLO COCC1=CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)CC1 ZINC000450454515 1045508307 /nfs/dbraw/zinc/50/83/07/1045508307.db2.gz LKTJVJGKEQFNMB-UHFFFAOYSA-N 1 2 322.330 4.037 20 0 DIADLO CC[C@@]1(CO)CCCN(c2cc[nH+]c3cc(F)c(Cl)cc32)C1 ZINC000450457079 1045509281 /nfs/dbraw/zinc/50/92/81/1045509281.db2.gz ZPMPTOJCLFZILV-QGZVFWFLSA-N 1 2 322.811 4.016 20 0 DIADLO FC(F)C1(CNc2[nH+]ccc3cc(C(F)(F)F)ccc32)CC1 ZINC000450489076 1045512854 /nfs/dbraw/zinc/51/28/54/1045512854.db2.gz HTFLPFHDPHZZDU-UHFFFAOYSA-N 1 2 316.273 4.711 20 0 DIADLO CC(C)c1nnc(C[N@H+](C2CC2)[C@H]2CCc3ccccc32)s1 ZINC000450521281 1045516698 /nfs/dbraw/zinc/51/66/98/1045516698.db2.gz SWJLISNZMUBEDB-INIZCTEOSA-N 1 2 313.470 4.313 20 0 DIADLO CC(C)c1nnc(C[N@@H+](C2CC2)[C@H]2CCc3ccccc32)s1 ZINC000450521281 1045516708 /nfs/dbraw/zinc/51/67/08/1045516708.db2.gz SWJLISNZMUBEDB-INIZCTEOSA-N 1 2 313.470 4.313 20 0 DIADLO FC1(F)CC(C[N@@H+]2CCc3[nH]c4ccc(Cl)cc4c3C2)C1 ZINC000450549641 1045518414 /nfs/dbraw/zinc/51/84/14/1045518414.db2.gz BWPSXFLXCQCDJO-UHFFFAOYSA-N 1 2 310.775 4.225 20 0 DIADLO FC1(F)CC(C[N@H+]2CCc3[nH]c4ccc(Cl)cc4c3C2)C1 ZINC000450549641 1045518424 /nfs/dbraw/zinc/51/84/24/1045518424.db2.gz BWPSXFLXCQCDJO-UHFFFAOYSA-N 1 2 310.775 4.225 20 0 DIADLO Cc1nn(C[NH2+][C@@H](c2ccccc2)C(C)(C)C)c(=S)s1 ZINC000077433871 1045520336 /nfs/dbraw/zinc/52/03/36/1045520336.db2.gz AKNBVFRAEJFMER-ZDUSSCGKSA-N 1 2 307.488 4.317 20 0 DIADLO CCOc1cccc2cc([C@@H](C)[NH2+][C@H](C)c3ncccn3)oc21 ZINC001119732911 1045524039 /nfs/dbraw/zinc/52/40/39/1045524039.db2.gz RUPMMPQYZNSGKH-CHWSQXEVSA-N 1 2 311.385 4.033 20 0 DIADLO CC[C@@H]1c2ccccc2CN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001119768818 1045524924 /nfs/dbraw/zinc/52/49/24/1045524924.db2.gz JHOYBIJFLJEXFE-QGZVFWFLSA-N 1 2 320.396 4.142 20 0 DIADLO Cc1nc(C[N@@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)[nH]c1C ZINC000628130519 1045525088 /nfs/dbraw/zinc/52/50/88/1045525088.db2.gz BYDSQQVPPPHYCB-CYBMUJFWSA-N 1 2 303.837 4.406 20 0 DIADLO Cc1nc(C[N@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)[nH]c1C ZINC000628130519 1045525097 /nfs/dbraw/zinc/52/50/97/1045525097.db2.gz BYDSQQVPPPHYCB-CYBMUJFWSA-N 1 2 303.837 4.406 20 0 DIADLO Cc1[nH]c(CN([C@H](C)c2ccc(Cl)cc2)C2CC2)[nH+]c1C ZINC000628130519 1045525105 /nfs/dbraw/zinc/52/51/05/1045525105.db2.gz BYDSQQVPPPHYCB-CYBMUJFWSA-N 1 2 303.837 4.406 20 0 DIADLO Cc1ncc(C[N@@H+]2CCc3sccc3[C@H]2c2cccs2)o1 ZINC000628123157 1045526694 /nfs/dbraw/zinc/52/66/94/1045526694.db2.gz CYRNPXRBZPSALF-INIZCTEOSA-N 1 2 316.451 4.254 20 0 DIADLO Cc1ncc(C[N@H+]2CCc3sccc3[C@H]2c2cccs2)o1 ZINC000628123157 1045526704 /nfs/dbraw/zinc/52/67/04/1045526704.db2.gz CYRNPXRBZPSALF-INIZCTEOSA-N 1 2 316.451 4.254 20 0 DIADLO Cc1[nH]c(CN(Cc2ccco2)Cc2cccc(C)c2)[nH+]c1C ZINC000628133290 1045527683 /nfs/dbraw/zinc/52/76/83/1045527683.db2.gz XWLNEPSZWQGCHQ-UHFFFAOYSA-N 1 2 309.413 4.130 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2cnc(-c3ccccc3)s2)C[C@@H]1F ZINC001138527683 1045527836 /nfs/dbraw/zinc/52/78/36/1045527836.db2.gz RZBQRLGJUGEMME-HOCLYGCPSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2cnc(-c3ccccc3)s2)C[C@@H]1F ZINC001138527683 1045527845 /nfs/dbraw/zinc/52/78/45/1045527845.db2.gz RZBQRLGJUGEMME-HOCLYGCPSA-N 1 2 308.397 4.082 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC[C@@H]2c2ccccn2)cs1 ZINC000628136739 1045528615 /nfs/dbraw/zinc/52/86/15/1045528615.db2.gz LXRCXGBAAQOMTF-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC[C@@H]2c2ccccn2)cs1 ZINC000628136739 1045528619 /nfs/dbraw/zinc/52/86/19/1045528619.db2.gz LXRCXGBAAQOMTF-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO CCCN(Cc1[nH]c(C)c(C)[nH+]1)Cc1c(F)cccc1Cl ZINC000628139785 1045528936 /nfs/dbraw/zinc/52/89/36/1045528936.db2.gz QBSDQANWKYTCPM-UHFFFAOYSA-N 1 2 309.816 4.231 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(F)(F)F)n(C)n1)c1cc2ccccc2o1 ZINC001120046731 1045535297 /nfs/dbraw/zinc/53/52/97/1045535297.db2.gz MBIOKMAIRCJZPF-JTQLQIEISA-N 1 2 323.318 4.036 20 0 DIADLO CC[C@@H]([NH2+]Cc1cccc(C)n1)c1nc(C(F)(F)F)cs1 ZINC000450723356 1045548587 /nfs/dbraw/zinc/54/85/87/1045548587.db2.gz COTODFDMYZCVGA-LLVKDONJSA-N 1 2 315.364 4.106 20 0 DIADLO COc1cccc2c(NC[C@@H]3CCOC4(CCC4)C3)cc[nH+]c12 ZINC000450711689 1045551775 /nfs/dbraw/zinc/55/17/75/1045551775.db2.gz DEEBKXBNNNKFPA-CQSZACIVSA-N 1 2 312.413 4.005 20 0 DIADLO Cc1[nH]c(CN2CCCC[C@@H]2c2cccc(Cl)c2)[nH+]c1C ZINC000628252655 1045555607 /nfs/dbraw/zinc/55/56/07/1045555607.db2.gz BTUMYBUWSBNJAX-MRXNPFEDSA-N 1 2 303.837 4.407 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(CC(F)(F)F)n1)c1cc2ccccc2o1 ZINC000450726660 1045559407 /nfs/dbraw/zinc/55/94/07/1045559407.db2.gz VSBMUPOXCKAMRN-NSHDSACASA-N 1 2 323.318 4.042 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3cc4occc4[nH]3)c2)[nH+]c1C ZINC000750854406 1045563035 /nfs/dbraw/zinc/56/30/35/1045563035.db2.gz NFMKANWUPOFYGJ-UHFFFAOYSA-N 1 2 320.352 4.020 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC[C@H]2c2ccncc2)cs1 ZINC000628277533 1045563846 /nfs/dbraw/zinc/56/38/46/1045563846.db2.gz WRBQBOARDLCDRM-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC[C@H]2c2ccncc2)cs1 ZINC000628277533 1045563857 /nfs/dbraw/zinc/56/38/57/1045563857.db2.gz WRBQBOARDLCDRM-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO CO[C@@H]1CCN(c2cc[nH+]c3c(Cl)cccc23)CC1(C)C ZINC000450753415 1045564215 /nfs/dbraw/zinc/56/42/15/1045564215.db2.gz HTBFEZCWGMEJFB-OAHLLOKOSA-N 1 2 304.821 4.140 20 0 DIADLO CC(C)[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1nnc(C2CC2)s1 ZINC000450885935 1045588101 /nfs/dbraw/zinc/58/81/01/1045588101.db2.gz VWZQBEGPSYKBMT-INIZCTEOSA-N 1 2 319.449 4.384 20 0 DIADLO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1nnc(C2CC2)s1 ZINC000450885935 1045588113 /nfs/dbraw/zinc/58/81/13/1045588113.db2.gz VWZQBEGPSYKBMT-INIZCTEOSA-N 1 2 319.449 4.384 20 0 DIADLO Fc1cccc(F)c1C1([NH2+]Cc2ccc3c(n2)CCC3)CCC1 ZINC000628501283 1045590205 /nfs/dbraw/zinc/59/02/05/1045590205.db2.gz RDEWBEIBLYEEPQ-UHFFFAOYSA-N 1 2 314.379 4.018 20 0 DIADLO CC(C)[N@H+](Cc1nnc(C2CC2)s1)[C@@H](C)c1ccccc1 ZINC000451060215 1045619836 /nfs/dbraw/zinc/61/98/36/1045619836.db2.gz PDMBHUKXOVZNGL-ZDUSSCGKSA-N 1 2 301.459 4.387 20 0 DIADLO CC(C)[N@@H+](Cc1nnc(C2CC2)s1)[C@@H](C)c1ccccc1 ZINC000451060215 1045619841 /nfs/dbraw/zinc/61/98/41/1045619841.db2.gz PDMBHUKXOVZNGL-ZDUSSCGKSA-N 1 2 301.459 4.387 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2cccc(Cl)n2)C1 ZINC000800472941 1045624236 /nfs/dbraw/zinc/62/42/36/1045624236.db2.gz FXBXWTXOBLYQCQ-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2cccc(Cl)n2)C1 ZINC000800472941 1045624243 /nfs/dbraw/zinc/62/42/43/1045624243.db2.gz FXBXWTXOBLYQCQ-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccoc2)no1)c1cccc(C2CC2)c1 ZINC000451116939 1045626727 /nfs/dbraw/zinc/62/67/27/1045626727.db2.gz SVPUVSVAIUTRAN-GFCCVEGCSA-N 1 2 309.369 4.058 20 0 DIADLO COc1ccc([NH2+][C@H]2CCC[C@H](c3cccnc3)C2)c(OC)c1 ZINC000800483789 1045627564 /nfs/dbraw/zinc/62/75/64/1045627564.db2.gz PELQXAROVXINDQ-HOCLYGCPSA-N 1 2 312.413 4.237 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCC[C@@H]4C[C@@]43C)cc2)C[C@H](C)O1 ZINC000800489998 1045630003 /nfs/dbraw/zinc/63/00/03/1045630003.db2.gz YXSLMUATAVBXBZ-YMBUTIGBSA-N 1 2 314.473 4.291 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCC[C@@H]4C[C@@]43C)cc2)C[C@@H](C)O1 ZINC000800489995 1045630161 /nfs/dbraw/zinc/63/01/61/1045630161.db2.gz YXSLMUATAVBXBZ-BIQFIRCYSA-N 1 2 314.473 4.291 20 0 DIADLO Cc1cc([NH2+][C@H]2CCC23CCC3)ccc1N1CCSCC1 ZINC000800489655 1045630955 /nfs/dbraw/zinc/63/09/55/1045630955.db2.gz VBEHECAVRKPJFD-KRWDZBQOSA-N 1 2 302.487 4.293 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2c(O)ccc(Cl)c2F)cs1 ZINC000191006443 1045642235 /nfs/dbraw/zinc/64/22/35/1045642235.db2.gz YHPYSFVIBZUROK-MRVPVSSYSA-N 1 2 314.813 4.054 20 0 DIADLO Cc1ccc(Nc2nn(C[N@H+]3CCC[C@H]3C)c(=S)s2)cc1 ZINC000751926723 1045642329 /nfs/dbraw/zinc/64/23/29/1045642329.db2.gz WGAKFWVFGPBLER-GFCCVEGCSA-N 1 2 320.487 4.168 20 0 DIADLO Cc1ccc(Nc2nn(C[N@@H+]3CCC[C@H]3C)c(=S)s2)cc1 ZINC000751926723 1045642335 /nfs/dbraw/zinc/64/23/35/1045642335.db2.gz WGAKFWVFGPBLER-GFCCVEGCSA-N 1 2 320.487 4.168 20 0 DIADLO Cc1cnc(CSCc2ccc(-n3cc[nH+]c3)cc2C)s1 ZINC000190996524 1045643194 /nfs/dbraw/zinc/64/31/94/1045643194.db2.gz CUAZRVHKZWMGMO-UHFFFAOYSA-N 1 2 315.467 4.379 20 0 DIADLO CCCOc1cc(CNc2ccc([NH2+]C)cc2)ccc1OC ZINC000629388451 1045664273 /nfs/dbraw/zinc/66/42/73/1045664273.db2.gz BMLXTNGVUXFNIM-UHFFFAOYSA-N 1 2 300.402 4.138 20 0 DIADLO C[NH2+]c1ccc(NCc2cccc(OC)c2OC(C)C)cc1 ZINC000629389760 1045665483 /nfs/dbraw/zinc/66/54/83/1045665483.db2.gz UZMPEBWXBDKVBZ-UHFFFAOYSA-N 1 2 300.402 4.136 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2ncccc2F)c2ccccc2)cc1 ZINC000530476288 1045673743 /nfs/dbraw/zinc/67/37/43/1045673743.db2.gz FYKANTQIHZESCN-FQEVSTJZSA-N 1 2 306.384 4.408 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CC[C@@H]3C3CCC3)cc2)C[C@@H](C)O1 ZINC000800981089 1045676298 /nfs/dbraw/zinc/67/62/98/1045676298.db2.gz KBFMNCJEXVXSNM-PBGAUENZSA-N 1 2 314.473 4.291 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CCC[C@@H]3CCCF)cc2)CCO1 ZINC000800982195 1045676334 /nfs/dbraw/zinc/67/63/34/1045676334.db2.gz OVRASGJLTUASIQ-MDZRGWNJSA-N 1 2 320.452 4.242 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2c(O)ccc(Cl)c2F)n1 ZINC000191369736 1045685565 /nfs/dbraw/zinc/68/55/65/1045685565.db2.gz VJVWJNGQYPVALL-OAHLLOKOSA-N 1 2 320.795 4.225 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2c(O)ccc(Cl)c2F)n1 ZINC000191369736 1045685569 /nfs/dbraw/zinc/68/55/69/1045685569.db2.gz VJVWJNGQYPVALL-OAHLLOKOSA-N 1 2 320.795 4.225 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCC[C@@H]1c1nc2ccccc2[nH]1 ZINC000451463486 1045687178 /nfs/dbraw/zinc/68/71/78/1045687178.db2.gz LERZEKYEOXHSAR-MRXNPFEDSA-N 1 2 324.428 4.320 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1CCC[C@@H]1c1nc2ccccc2[nH]1 ZINC000451463486 1045687181 /nfs/dbraw/zinc/68/71/81/1045687181.db2.gz LERZEKYEOXHSAR-MRXNPFEDSA-N 1 2 324.428 4.320 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000191493186 1045715172 /nfs/dbraw/zinc/71/51/72/1045715172.db2.gz IZXJGTHESDNNLP-NHYWBVRUSA-N 1 2 320.795 4.163 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000191493186 1045715184 /nfs/dbraw/zinc/71/51/84/1045715184.db2.gz IZXJGTHESDNNLP-NHYWBVRUSA-N 1 2 320.795 4.163 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[S@@](=O)C(C)(C)CC1 ZINC000451755440 1045721562 /nfs/dbraw/zinc/72/15/62/1045721562.db2.gz KLWFSSJHQGNRPI-MGPUTAFESA-N 1 2 313.894 4.024 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[S@@](=O)C(C)(C)CC1 ZINC000451755440 1045721573 /nfs/dbraw/zinc/72/15/73/1045721573.db2.gz KLWFSSJHQGNRPI-MGPUTAFESA-N 1 2 313.894 4.024 20 0 DIADLO Clc1ccc(C[N@@H+]2CC[C@H]2Cc2ccccc2)c(Cl)n1 ZINC000801520322 1045727987 /nfs/dbraw/zinc/72/79/87/1045727987.db2.gz FEMZPABDMZGIDV-AWEZNQCLSA-N 1 2 307.224 4.205 20 0 DIADLO Clc1ccc(C[N@H+]2CC[C@H]2Cc2ccccc2)c(Cl)n1 ZINC000801520322 1045727998 /nfs/dbraw/zinc/72/79/98/1045727998.db2.gz FEMZPABDMZGIDV-AWEZNQCLSA-N 1 2 307.224 4.205 20 0 DIADLO CCCc1nc(C)c(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)o1 ZINC000451836453 1045733942 /nfs/dbraw/zinc/73/39/42/1045733942.db2.gz ASPXMCKAWPQYRT-KRWDZBQOSA-N 1 2 300.402 4.256 20 0 DIADLO CCCc1nc(C)c(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)o1 ZINC000451836453 1045733954 /nfs/dbraw/zinc/73/39/54/1045733954.db2.gz ASPXMCKAWPQYRT-KRWDZBQOSA-N 1 2 300.402 4.256 20 0 DIADLO Cc1nc(/C=C\c2c[nH+]cn2C(C)C)sc1Br ZINC000901518806 1045756351 /nfs/dbraw/zinc/75/63/51/1045756351.db2.gz ZCJDWGZUIMZNHP-PLNGDYQASA-N 1 2 312.236 4.162 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@@H+]1Cc1cn2ccsc2n1 ZINC000451972921 1045758166 /nfs/dbraw/zinc/75/81/66/1045758166.db2.gz PRBZAFPJDTZVTJ-INIZCTEOSA-N 1 2 315.417 4.180 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@H+]1Cc1cn2ccsc2n1 ZINC000451972921 1045758182 /nfs/dbraw/zinc/75/81/82/1045758182.db2.gz PRBZAFPJDTZVTJ-INIZCTEOSA-N 1 2 315.417 4.180 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@@H+]1Cc1nc(C(C)(C)C)no1 ZINC000451970487 1045758512 /nfs/dbraw/zinc/75/85/12/1045758512.db2.gz LQZYCNGPCCYVPI-OAHLLOKOSA-N 1 2 317.408 4.152 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@H+]1Cc1nc(C(C)(C)C)no1 ZINC000451970487 1045758525 /nfs/dbraw/zinc/75/85/25/1045758525.db2.gz LQZYCNGPCCYVPI-OAHLLOKOSA-N 1 2 317.408 4.152 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2nc(C(C)(C)C)no2)cc1C ZINC000452037482 1045764136 /nfs/dbraw/zinc/76/41/36/1045764136.db2.gz BFQRQBFJMYBDBU-CQSZACIVSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)c2nc(C(C)(C)C)no2)cc1C ZINC000452037482 1045764143 /nfs/dbraw/zinc/76/41/43/1045764143.db2.gz BFQRQBFJMYBDBU-CQSZACIVSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1cccc([C@H](C)[NH2+]Cc2noc(-c3ccccc3C)n2)c1 ZINC000452075502 1045765964 /nfs/dbraw/zinc/76/59/64/1045765964.db2.gz CADOTIBMPGJDMA-HNNXBMFYSA-N 1 2 307.397 4.204 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)cc1Cl ZINC000901670687 1045791059 /nfs/dbraw/zinc/79/10/59/1045791059.db2.gz ZQIPZVSWNQPRJB-NSHDSACASA-N 1 2 322.836 4.485 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@@H](c2ccccc2)C(C)C)c(C)[nH+]1 ZINC001124898771 1045794839 /nfs/dbraw/zinc/79/48/39/1045794839.db2.gz WCWOUBPZDXTLOI-GOSISDBHSA-N 1 2 310.441 4.176 20 0 DIADLO CC(C)c1cc(C[NH2+]Cc2oc3ccccc3c2Cl)on1 ZINC000631071271 1045808470 /nfs/dbraw/zinc/80/84/70/1045808470.db2.gz DXENFOXINJJECV-UHFFFAOYSA-N 1 2 304.777 4.487 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1ccc(C(F)F)nc1 ZINC000631107632 1045816900 /nfs/dbraw/zinc/81/69/00/1045816900.db2.gz ZCFUCGKXUANRCO-UHFFFAOYSA-N 1 2 307.344 4.204 20 0 DIADLO CN(C)c1cc(C[N@H+](C)Cc2cccc(Cl)c2Cl)ccn1 ZINC000753994348 1045829823 /nfs/dbraw/zinc/82/98/23/1045829823.db2.gz KRSQAAFUKDUGAQ-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1cc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)ccn1 ZINC000753994348 1045829849 /nfs/dbraw/zinc/82/98/49/1045829849.db2.gz KRSQAAFUKDUGAQ-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](CCc2ccccc2)c2ccccn2)s1 ZINC000631201403 1045834200 /nfs/dbraw/zinc/83/42/00/1045834200.db2.gz VJWKTCKDOLFBCS-SFHVURJKSA-N 1 2 323.465 4.310 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2csc(-c3cccs3)n2)s1 ZINC000631224432 1045840333 /nfs/dbraw/zinc/84/03/33/1045840333.db2.gz WUTFEPMVJFTGDD-SECBINFHSA-N 1 2 321.496 4.487 20 0 DIADLO Cc1cc(CNc2c[nH+]ccc2OC(C)(C)C)cnc1Cl ZINC000754064266 1045840364 /nfs/dbraw/zinc/84/03/64/1045840364.db2.gz OOXPAVCJGRUSLL-UHFFFAOYSA-N 1 2 305.809 4.228 20 0 DIADLO COc1ccc(C[NH2+][C@@H](CF)c2ccc(F)cc2)cc1Cl ZINC000631285146 1045846367 /nfs/dbraw/zinc/84/63/67/1045846367.db2.gz YEMAGRYKJQPELU-HNNXBMFYSA-N 1 2 311.759 4.288 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C3CCC4(CC4)CC3)cc2)C[C@H](C)O1 ZINC000754100173 1045848256 /nfs/dbraw/zinc/84/82/56/1045848256.db2.gz IRRROLWWBHNKHZ-IYBDPMFKSA-N 1 2 314.473 4.435 20 0 DIADLO CC(C)Cc1ncc(C[NH2+][C@@H](CF)c2ccc(F)cc2)s1 ZINC000631284526 1045849435 /nfs/dbraw/zinc/84/94/35/1045849435.db2.gz PODPUPUKWYUHMJ-HNNXBMFYSA-N 1 2 310.413 4.281 20 0 DIADLO c1csc(CC2CCN(c3[nH+]ccc4ccccc43)CC2)n1 ZINC000631445596 1045857770 /nfs/dbraw/zinc/85/77/70/1045857770.db2.gz KHVDWKNHMSUGIP-UHFFFAOYSA-N 1 2 309.438 4.150 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1ccc(Cl)s1 ZINC000754331952 1045875658 /nfs/dbraw/zinc/87/56/58/1045875658.db2.gz CFWMDMIMKDOGBT-VIFPVBQESA-N 1 2 313.854 4.323 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccccc2Cl)C[C@@H](c2ccsc2)O1 ZINC000531588443 1045875754 /nfs/dbraw/zinc/87/57/54/1045875754.db2.gz XJEFAISLAOPCBD-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccccc2Cl)C[C@@H](c2ccsc2)O1 ZINC000531588443 1045875767 /nfs/dbraw/zinc/87/57/67/1045875767.db2.gz XJEFAISLAOPCBD-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO CC(F)(F)CCCNc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000902018285 1045889419 /nfs/dbraw/zinc/88/94/19/1045889419.db2.gz DZHRADXCQVTXSZ-UHFFFAOYSA-N 1 2 317.383 4.449 20 0 DIADLO C[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(C2CCC2)cc1 ZINC000631632713 1045891559 /nfs/dbraw/zinc/89/15/59/1045891559.db2.gz SHBRFKSDAYMJBN-LBPRGKRZSA-N 1 2 303.837 4.192 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)cc1 ZINC000531687487 1045892082 /nfs/dbraw/zinc/89/20/82/1045892082.db2.gz AWHAWVIFDBQSHV-OXQOHEQNSA-N 1 2 319.452 4.423 20 0 DIADLO Clc1cc(Br)ccc1C[N@@H+]1CCC[C@H]2C[C@H]21 ZINC001137565125 1045897087 /nfs/dbraw/zinc/89/70/87/1045897087.db2.gz AJVOJEBPICFDBT-TVQRCGJNSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1cc(Br)ccc1C[N@H+]1CCC[C@H]2C[C@H]21 ZINC001137565125 1045897098 /nfs/dbraw/zinc/89/70/98/1045897098.db2.gz AJVOJEBPICFDBT-TVQRCGJNSA-N 1 2 300.627 4.087 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(C)cc2OC)cs1 ZINC000531715789 1045905258 /nfs/dbraw/zinc/90/52/58/1045905258.db2.gz FRQJWHCDSAKZOF-CHWSQXEVSA-N 1 2 304.459 4.434 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nc([C@@H](C)OCC(C)C)no2)s1 ZINC000754667819 1045906973 /nfs/dbraw/zinc/90/69/73/1045906973.db2.gz LZODCSUZIVZEFI-CHWSQXEVSA-N 1 2 323.462 4.024 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@H](C)c1nc2ccccc2s1 ZINC000754697926 1045914398 /nfs/dbraw/zinc/91/43/98/1045914398.db2.gz DZTODVSVHGMEOT-LLVKDONJSA-N 1 2 316.401 4.295 20 0 DIADLO Cc1c([C@@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)cnn1C(C)C ZINC000631798520 1045918856 /nfs/dbraw/zinc/91/88/56/1045918856.db2.gz UMXNVTCPLRMKFY-SJKOYZFVSA-N 1 2 307.388 4.273 20 0 DIADLO Cc1c([C@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)cnn1C(C)(C)C ZINC000631797920 1045919401 /nfs/dbraw/zinc/91/94/01/1045919401.db2.gz JYLXSAOESIVDOB-SJCJKPOMSA-N 1 2 321.415 4.447 20 0 DIADLO Cc1c([C@@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)cnn1C(C)(C)C ZINC000631797921 1045919443 /nfs/dbraw/zinc/91/94/43/1045919443.db2.gz JYLXSAOESIVDOB-SJKOYZFVSA-N 1 2 321.415 4.447 20 0 DIADLO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)c1 ZINC000631795121 1045919521 /nfs/dbraw/zinc/91/95/21/1045919521.db2.gz GILHJHCSUBTUGF-XIKOKIGWSA-N 1 2 318.367 4.146 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)cc1OC ZINC000631795314 1045919643 /nfs/dbraw/zinc/91/96/43/1045919643.db2.gz HZTZHNTZZNYLTO-LRDDRELGSA-N 1 2 321.367 4.204 20 0 DIADLO COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@@H](CF)c1ccc(F)cc1 ZINC000631798461 1045920291 /nfs/dbraw/zinc/92/02/91/1045920291.db2.gz SYLMMMKESAMRAU-IRXDYDNUSA-N 1 2 321.342 4.261 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1ccc(C2CC2)cc1F)n1cc[nH+]c1 ZINC000828611112 1045921630 /nfs/dbraw/zinc/92/16/30/1045921630.db2.gz MYUDHTXDPYXQEQ-KRWDZBQOSA-N 1 2 315.392 4.126 20 0 DIADLO FC[C@@H]1C[N@H+](Cc2ccc(Cl)cc2F)C[C@H]1C(F)(F)F ZINC001137656502 1045923265 /nfs/dbraw/zinc/92/32/65/1045923265.db2.gz HYXVFXBOEOELLQ-MWLCHTKSSA-N 1 2 313.697 4.059 20 0 DIADLO FC[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2F)C[C@H]1C(F)(F)F ZINC001137656502 1045923276 /nfs/dbraw/zinc/92/32/76/1045923276.db2.gz HYXVFXBOEOELLQ-MWLCHTKSSA-N 1 2 313.697 4.059 20 0 DIADLO CCOc1nnc(C[NH2+][C@@H](C)c2csc3ccccc23)s1 ZINC000754739020 1045923944 /nfs/dbraw/zinc/92/39/44/1045923944.db2.gz QGFKUJOPEYHHTF-JTQLQIEISA-N 1 2 319.455 4.002 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1csc(Cl)n1 ZINC000828656085 1045926267 /nfs/dbraw/zinc/92/62/67/1045926267.db2.gz OBVMJHPJFYGSRG-CYBMUJFWSA-N 1 2 310.850 4.436 20 0 DIADLO O=C1CC[N@@H+](Cc2c[nH]c3ccc(Cl)cc23)[C@@H]2CCCC[C@@H]12 ZINC001137708560 1045940659 /nfs/dbraw/zinc/94/06/59/1045940659.db2.gz YKUXQWOQRJLEOB-RHSMWYFYSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c[nH]c3ccc(Cl)cc23)[C@@H]2CCCC[C@@H]12 ZINC001137708560 1045940665 /nfs/dbraw/zinc/94/06/65/1045940665.db2.gz YKUXQWOQRJLEOB-RHSMWYFYSA-N 1 2 316.832 4.155 20 0 DIADLO Cc1cc(Nc2ccc([N+](=O)[O-])c3cnccc23)ccc1[NH+](C)C ZINC000029627333 1045943651 /nfs/dbraw/zinc/94/36/51/1045943651.db2.gz AUESYFUOAPYMFM-UHFFFAOYSA-N 1 2 322.368 4.261 20 0 DIADLO CCC[C@@H]([NH2+][C@H](C)c1nccn1CC)c1ccc(F)cc1F ZINC000453146176 1045947986 /nfs/dbraw/zinc/94/79/86/1045947986.db2.gz SQTILCAMPLDRET-MLGOLLRUSA-N 1 2 307.388 4.373 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]C(c1cccs1)c1cccs1 ZINC000453145105 1045948358 /nfs/dbraw/zinc/94/83/58/1045948358.db2.gz NIKWWKUPYOOJSU-LBPRGKRZSA-N 1 2 317.483 4.466 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(CF)cc1)c1nc(C2CCCCC2)no1 ZINC000755073479 1045950264 /nfs/dbraw/zinc/95/02/64/1045950264.db2.gz ITZLJJFWKIPADK-CYBMUJFWSA-N 1 2 317.408 4.438 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CCCC[C@@H]1c1ccccc1F ZINC001137749084 1045956186 /nfs/dbraw/zinc/95/61/86/1045956186.db2.gz CMIRTBGQRZMHPJ-MRXNPFEDSA-N 1 2 321.827 4.248 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CCCC[C@@H]1c1ccccc1F ZINC001137749084 1045956198 /nfs/dbraw/zinc/95/61/98/1045956198.db2.gz CMIRTBGQRZMHPJ-MRXNPFEDSA-N 1 2 321.827 4.248 20 0 DIADLO CC(C)c1ccc([C@H](C)[N@@H+]2CCc3cc(Cl)nnc3C2)cc1 ZINC000829169957 1045958577 /nfs/dbraw/zinc/95/85/77/1045958577.db2.gz UFALIGDPNDOXGM-ZDUSSCGKSA-N 1 2 315.848 4.373 20 0 DIADLO CC(C)c1ccc([C@H](C)[N@H+]2CCc3cc(Cl)nnc3C2)cc1 ZINC000829169957 1045958591 /nfs/dbraw/zinc/95/85/91/1045958591.db2.gz UFALIGDPNDOXGM-ZDUSSCGKSA-N 1 2 315.848 4.373 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccc(Cl)nc2C(F)(F)F)CCS1 ZINC000755198002 1045961518 /nfs/dbraw/zinc/96/15/18/1045961518.db2.gz COUWZRHMZNGYEH-VIFPVBQESA-N 1 2 324.799 4.081 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccc(Cl)nc2C(F)(F)F)CCS1 ZINC000755198002 1045961528 /nfs/dbraw/zinc/96/15/28/1045961528.db2.gz COUWZRHMZNGYEH-VIFPVBQESA-N 1 2 324.799 4.081 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(Cl)nc2C(F)(F)F)CCS1 ZINC000755198001 1045962610 /nfs/dbraw/zinc/96/26/10/1045962610.db2.gz COUWZRHMZNGYEH-SECBINFHSA-N 1 2 324.799 4.081 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)nc2C(F)(F)F)CCS1 ZINC000755198001 1045962613 /nfs/dbraw/zinc/96/26/13/1045962613.db2.gz COUWZRHMZNGYEH-SECBINFHSA-N 1 2 324.799 4.081 20 0 DIADLO CCn1cnc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)c1 ZINC000902313736 1045972675 /nfs/dbraw/zinc/97/26/75/1045972675.db2.gz SWHKZQFPDVYUNH-MRXNPFEDSA-N 1 2 307.388 4.058 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccncc1F)c1ncc(-c2ccccc2)n1C ZINC000453207020 1045984253 /nfs/dbraw/zinc/98/42/53/1045984253.db2.gz FVEVITRNNKNSHL-UONOGXRCSA-N 1 2 324.403 4.033 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncc(-c2ccccc2)n1C)c1ccncc1F ZINC000453207018 1045984555 /nfs/dbraw/zinc/98/45/55/1045984555.db2.gz FVEVITRNNKNSHL-KGLIPLIRSA-N 1 2 324.403 4.033 20 0 DIADLO Fc1cccc2c1CCC[C@@H]2[NH2+][C@@H](c1ncc[nH]1)c1ccccc1 ZINC000453223887 1045992593 /nfs/dbraw/zinc/99/25/93/1045992593.db2.gz BQXIGJHPIKFJBQ-RBUKOAKNSA-N 1 2 321.399 4.305 20 0 DIADLO Fc1cc(F)c(F)c(C[N@@H+]2CCC[C@@H](Oc3ccccc3)C2)c1 ZINC001137872140 1045993817 /nfs/dbraw/zinc/99/38/17/1045993817.db2.gz DJVPSSLSNNJMOT-MRXNPFEDSA-N 1 2 321.342 4.147 20 0 DIADLO Fc1cc(F)c(F)c(C[N@H+]2CCC[C@@H](Oc3ccccc3)C2)c1 ZINC001137872140 1045993828 /nfs/dbraw/zinc/99/38/28/1045993828.db2.gz DJVPSSLSNNJMOT-MRXNPFEDSA-N 1 2 321.342 4.147 20 0 DIADLO Cc1nc(C[NH2+]C2(c3cccc(F)c3)CCC2)nc2ccccc12 ZINC000829712417 1045998473 /nfs/dbraw/zinc/99/84/73/1045998473.db2.gz PNYOJILBISZMQX-UHFFFAOYSA-N 1 2 321.399 4.246 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(F)c(F)cc1F ZINC001137891562 1045999359 /nfs/dbraw/zinc/99/93/59/1045999359.db2.gz ZRPWINDIKPYELH-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc(F)c(F)cc1F ZINC001137891562 1045999367 /nfs/dbraw/zinc/99/93/67/1045999367.db2.gz ZRPWINDIKPYELH-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CC=C(c3ccccc3)CC2)cc1F ZINC001137892509 1046001414 /nfs/dbraw/zinc/00/14/14/1046001414.db2.gz VQDKUYJWIQFTQL-UHFFFAOYSA-N 1 2 303.327 4.393 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CC=C(c3ccccc3)CC2)cc1F ZINC001137892509 1046001429 /nfs/dbraw/zinc/00/14/29/1046001429.db2.gz VQDKUYJWIQFTQL-UHFFFAOYSA-N 1 2 303.327 4.393 20 0 DIADLO CNc1ccccc1C[NH2+][C@H](C)c1nc(C(F)(F)F)cs1 ZINC000902531417 1046015447 /nfs/dbraw/zinc/01/54/47/1046015447.db2.gz VKBXVXMIOBMVQS-SECBINFHSA-N 1 2 315.364 4.054 20 0 DIADLO C[N@H+](Cn1c(-c2ccccc2)csc1=S)[C@@H]1CCSC1 ZINC000755791164 1046017195 /nfs/dbraw/zinc/01/71/95/1046017195.db2.gz BVCNXBKEKVHRSK-CYBMUJFWSA-N 1 2 322.524 4.341 20 0 DIADLO C[N@@H+](Cn1c(-c2ccccc2)csc1=S)[C@@H]1CCSC1 ZINC000755791164 1046017209 /nfs/dbraw/zinc/01/72/09/1046017209.db2.gz BVCNXBKEKVHRSK-CYBMUJFWSA-N 1 2 322.524 4.341 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(c3ccccc3)[C@H](C)C3CC3)ccn12 ZINC000633848743 1046036171 /nfs/dbraw/zinc/03/61/71/1046036171.db2.gz ZHXZBDPMSWFOSZ-OAHLLOKOSA-N 1 2 319.408 4.088 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)sc1C ZINC000756048054 1046044935 /nfs/dbraw/zinc/04/49/35/1046044935.db2.gz MRZOHTUTSCKGIQ-OAHLLOKOSA-N 1 2 308.397 4.375 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)sc1C ZINC000756048054 1046044948 /nfs/dbraw/zinc/04/49/48/1046044948.db2.gz MRZOHTUTSCKGIQ-OAHLLOKOSA-N 1 2 308.397 4.375 20 0 DIADLO Fc1c(Cl)cc(C(F)(F)F)cc1C[N@@H+]1CCC2(CC2)C1 ZINC001137986251 1046047678 /nfs/dbraw/zinc/04/76/78/1046047678.db2.gz CJCGQTLKLVLQAY-UHFFFAOYSA-N 1 2 307.718 4.484 20 0 DIADLO Fc1c(Cl)cc(C(F)(F)F)cc1C[N@H+]1CCC2(CC2)C1 ZINC001137986251 1046047690 /nfs/dbraw/zinc/04/76/90/1046047690.db2.gz CJCGQTLKLVLQAY-UHFFFAOYSA-N 1 2 307.718 4.484 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c1 ZINC001137997587 1046048980 /nfs/dbraw/zinc/04/89/80/1046048980.db2.gz RJHWTNYCCCJGHX-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)c1 ZINC001137997587 1046048997 /nfs/dbraw/zinc/04/89/97/1046048997.db2.gz RJHWTNYCCCJGHX-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc3nc(C)sc3c2)no1 ZINC000756075877 1046049928 /nfs/dbraw/zinc/04/99/28/1046049928.db2.gz JPGJNLPNTRTEAJ-INIZCTEOSA-N 1 2 313.426 4.238 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc3nc(C)sc3c2)no1 ZINC000756075877 1046049946 /nfs/dbraw/zinc/04/99/46/1046049946.db2.gz JPGJNLPNTRTEAJ-INIZCTEOSA-N 1 2 313.426 4.238 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nccn1CC)c1cccc(Cl)c1F ZINC000453353043 1046051675 /nfs/dbraw/zinc/05/16/75/1046051675.db2.gz NGCAANWWMHUEKA-FZMZJTMJSA-N 1 2 309.816 4.497 20 0 DIADLO CCCOC1CC[NH+](Cc2c(F)ccc(F)c2Cl)CC1 ZINC001138004163 1046051834 /nfs/dbraw/zinc/05/18/34/1046051834.db2.gz ZQCFCNMARLAHRJ-UHFFFAOYSA-N 1 2 303.780 4.009 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c1Cl ZINC001138004080 1046052462 /nfs/dbraw/zinc/05/24/62/1046052462.db2.gz WDWPJTIPETVCEI-ZDUSSCGKSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c1Cl ZINC001138004080 1046052479 /nfs/dbraw/zinc/05/24/79/1046052479.db2.gz WDWPJTIPETVCEI-ZDUSSCGKSA-N 1 2 323.770 4.272 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H]3C[C@H]2[C@@H](C(F)(F)F)O3)c2ccccc12 ZINC001138016680 1046059937 /nfs/dbraw/zinc/05/99/37/1046059937.db2.gz MTBOWZLVYZKWCX-JQFCIGGWSA-N 1 2 321.342 4.052 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H]3C[C@H]2[C@@H](C(F)(F)F)O3)c2ccccc12 ZINC001138016680 1046059950 /nfs/dbraw/zinc/05/99/50/1046059950.db2.gz MTBOWZLVYZKWCX-JQFCIGGWSA-N 1 2 321.342 4.052 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1ccc(C(F)(F)F)cn1 ZINC000902792458 1046070789 /nfs/dbraw/zinc/07/07/89/1046070789.db2.gz AHEPDWSTINMHQP-VIFPVBQESA-N 1 2 316.273 4.229 20 0 DIADLO CCCn1cc([C@@H](C)[NH2+][C@H](c2ccccc2Cl)C(C)C)nn1 ZINC000902807075 1046074804 /nfs/dbraw/zinc/07/48/04/1046074804.db2.gz VLNLOQIMKXIBPB-DYVFJYSZSA-N 1 2 320.868 4.389 20 0 DIADLO CCC[C@H]([NH2+][C@H](C)c1cn(CCC)nn1)c1ccc(F)cc1F ZINC000902841254 1046083476 /nfs/dbraw/zinc/08/34/76/1046083476.db2.gz NIMKUHFUFLPOCP-WBMJQRKESA-N 1 2 322.403 4.158 20 0 DIADLO Cc1ccoc1C[N@@H+]1CCC[C@H]1c1ccc(Br)cn1 ZINC000453618974 1046100293 /nfs/dbraw/zinc/10/02/93/1046100293.db2.gz VOSIOIJPQFKHOJ-AWEZNQCLSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ccoc1C[N@H+]1CCC[C@H]1c1ccc(Br)cn1 ZINC000453618974 1046100301 /nfs/dbraw/zinc/10/03/01/1046100301.db2.gz VOSIOIJPQFKHOJ-AWEZNQCLSA-N 1 2 321.218 4.083 20 0 DIADLO Clc1cnc(C[N@@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)cn1 ZINC000830764971 1046100427 /nfs/dbraw/zinc/10/04/27/1046100427.db2.gz NPNSIDDTLGCZRU-QGZVFWFLSA-N 1 2 311.816 4.023 20 0 DIADLO Clc1cnc(C[N@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)cn1 ZINC000830764971 1046100432 /nfs/dbraw/zinc/10/04/32/1046100432.db2.gz NPNSIDDTLGCZRU-QGZVFWFLSA-N 1 2 311.816 4.023 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2c(F)ccc(C)c2F)cc1 ZINC001138119982 1046100518 /nfs/dbraw/zinc/10/05/18/1046100518.db2.gz YQKVHHATVQPKDT-CYBMUJFWSA-N 1 2 305.368 4.475 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2c(F)ccc(C)c2F)cc1 ZINC001138119982 1046100523 /nfs/dbraw/zinc/10/05/23/1046100523.db2.gz YQKVHHATVQPKDT-CYBMUJFWSA-N 1 2 305.368 4.475 20 0 DIADLO O[C@@H](C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1)c1c(F)cccc1F ZINC000081604746 1046102391 /nfs/dbraw/zinc/10/23/91/1046102391.db2.gz LWYHGCPITHWQNJ-CVEARBPZSA-N 1 2 323.770 4.099 20 0 DIADLO O[C@@H](C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1)c1c(F)cccc1F ZINC000081604746 1046102408 /nfs/dbraw/zinc/10/24/08/1046102408.db2.gz LWYHGCPITHWQNJ-CVEARBPZSA-N 1 2 323.770 4.099 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cc(O)ccc2Br)cc1 ZINC001138145984 1046108338 /nfs/dbraw/zinc/10/83/38/1046108338.db2.gz UILIMVTXKQMALJ-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cc(O)ccc2Br)cc1 ZINC001138145984 1046108348 /nfs/dbraw/zinc/10/83/48/1046108348.db2.gz UILIMVTXKQMALJ-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO C[C@@H]1COCC[C@H]1[NH2+]c1ccc(N(C)Cc2ccccc2)cc1 ZINC000195085983 1046113380 /nfs/dbraw/zinc/11/33/80/1046113380.db2.gz JPOWKROBWGLUDF-OXQOHEQNSA-N 1 2 310.441 4.160 20 0 DIADLO C[N@H+](CCc1ccccc1F)Cc1c(F)c(F)cc(F)c1F ZINC001138237991 1046124341 /nfs/dbraw/zinc/12/43/41/1046124341.db2.gz CXCSQXGYYGCGDM-UHFFFAOYSA-N 1 2 315.285 4.057 20 0 DIADLO C[N@@H+](CCc1ccccc1F)Cc1c(F)c(F)cc(F)c1F ZINC001138237991 1046124351 /nfs/dbraw/zinc/12/43/51/1046124351.db2.gz CXCSQXGYYGCGDM-UHFFFAOYSA-N 1 2 315.285 4.057 20 0 DIADLO C[N@H+](CCc1ccc(F)cc1)Cc1c(F)c(F)cc(F)c1F ZINC001138236174 1046124694 /nfs/dbraw/zinc/12/46/94/1046124694.db2.gz OPYQXMFNDYUSNA-UHFFFAOYSA-N 1 2 315.285 4.057 20 0 DIADLO C[N@@H+](CCc1ccc(F)cc1)Cc1c(F)c(F)cc(F)c1F ZINC001138236174 1046124697 /nfs/dbraw/zinc/12/46/97/1046124697.db2.gz OPYQXMFNDYUSNA-UHFFFAOYSA-N 1 2 315.285 4.057 20 0 DIADLO Fc1cc(F)c(F)c(C[N@@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)c1F ZINC001138236721 1046125563 /nfs/dbraw/zinc/12/55/63/1046125563.db2.gz NDGXRXYBUDDQAQ-PHIMTYICSA-N 1 2 321.317 4.330 20 0 DIADLO Fc1cc(F)c(F)c(C[N@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)c1F ZINC001138236721 1046125573 /nfs/dbraw/zinc/12/55/73/1046125573.db2.gz NDGXRXYBUDDQAQ-PHIMTYICSA-N 1 2 321.317 4.330 20 0 DIADLO CCc1nc(C[NH2+][C@@H](CCc2ccccc2)c2cccnc2)co1 ZINC000903012542 1046141419 /nfs/dbraw/zinc/14/14/19/1046141419.db2.gz QHTVWYGLZDFCTD-IBGZPJMESA-N 1 2 321.424 4.096 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[NH2+]Cc1nc(C)cs1 ZINC000903067398 1046155563 /nfs/dbraw/zinc/15/55/63/1046155563.db2.gz PHCNLTWCZCRSSJ-ZDUSSCGKSA-N 1 2 322.861 4.281 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[NH2+]Cc1csc(C)n1 ZINC000903072138 1046155578 /nfs/dbraw/zinc/15/55/78/1046155578.db2.gz CJYWIIKZDKRVET-CQSZACIVSA-N 1 2 322.861 4.281 20 0 DIADLO COc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001138375542 1046160214 /nfs/dbraw/zinc/16/02/14/1046160214.db2.gz BRPCNMKTNCXNAX-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)cc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001138375542 1046160215 /nfs/dbraw/zinc/16/02/15/1046160215.db2.gz BRPCNMKTNCXNAX-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(F)c1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC001138383544 1046161453 /nfs/dbraw/zinc/16/14/53/1046161453.db2.gz GWYNYPKALHDWFJ-QGZVFWFLSA-N 1 2 317.429 4.124 20 0 DIADLO COc1cccc(F)c1C[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC001138383544 1046161462 /nfs/dbraw/zinc/16/14/62/1046161462.db2.gz GWYNYPKALHDWFJ-QGZVFWFLSA-N 1 2 317.429 4.124 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(C(F)(F)F)s2)cs1 ZINC000718000555 1046163044 /nfs/dbraw/zinc/16/30/44/1046163044.db2.gz QONLGTUAKFYHCV-ZETCQYMHSA-N 1 2 306.378 4.383 20 0 DIADLO Fc1ccc2oc(C[NH2+]Cc3ccc(C4CC4)cc3F)nc2c1 ZINC000634981558 1046169087 /nfs/dbraw/zinc/16/90/87/1046169087.db2.gz MAAWXICGDYDTCO-UHFFFAOYSA-N 1 2 314.335 4.273 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000635065982 1046173209 /nfs/dbraw/zinc/17/32/09/1046173209.db2.gz VXFZYUZWYNCSFW-HNNXBMFYSA-N 1 2 305.809 4.071 20 0 DIADLO CC(C)c1ccc(NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)c(C(C)C)c1 ZINC000635267538 1046183235 /nfs/dbraw/zinc/18/32/35/1046183235.db2.gz NRZBFOYDTPKJBQ-HZPDHXFCSA-N 1 2 311.429 4.399 20 0 DIADLO CC(C)c1ccc(NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)c(C(C)C)c1 ZINC000635267538 1046183244 /nfs/dbraw/zinc/18/32/44/1046183244.db2.gz NRZBFOYDTPKJBQ-HZPDHXFCSA-N 1 2 311.429 4.399 20 0 DIADLO CCOc1ccc2ccccc2c1C[N@@H+]1CCn2cccc2C1 ZINC001138443709 1046184577 /nfs/dbraw/zinc/18/45/77/1046184577.db2.gz JAOBVFIXACYUCT-UHFFFAOYSA-N 1 2 306.409 4.056 20 0 DIADLO CCOc1ccc2ccccc2c1C[N@H+]1CCn2cccc2C1 ZINC001138443709 1046184580 /nfs/dbraw/zinc/18/45/80/1046184580.db2.gz JAOBVFIXACYUCT-UHFFFAOYSA-N 1 2 306.409 4.056 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+]Cc2nccc3c2CCCC3)cs1 ZINC000903181539 1046184649 /nfs/dbraw/zinc/18/46/49/1046184649.db2.gz KJZGXEGUPIXKSB-ZDUSSCGKSA-N 1 2 315.486 4.391 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2nc3c(s2)CCC3)c(Cl)c1 ZINC000903190556 1046186705 /nfs/dbraw/zinc/18/67/05/1046186705.db2.gz ALNLXNCPNNAKMR-JTQLQIEISA-N 1 2 322.861 4.145 20 0 DIADLO C[C@@H]1C[C@@H](C)[C@H](C)[N@H+](CCC(=O)Nc2ccccc2Cl)C1 ZINC000475745649 1046194991 /nfs/dbraw/zinc/19/49/91/1046194991.db2.gz GIULNGURHYRDKQ-MCIONIFRSA-N 1 2 308.853 4.035 20 0 DIADLO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](CCC(=O)Nc2ccccc2Cl)C1 ZINC000475745649 1046194993 /nfs/dbraw/zinc/19/49/93/1046194993.db2.gz GIULNGURHYRDKQ-MCIONIFRSA-N 1 2 308.853 4.035 20 0 DIADLO COc1ccnc(C[N@H+](C)[C@@H](C)[C@@H](C)c2ccc(Cl)cc2)c1 ZINC000475745777 1046195115 /nfs/dbraw/zinc/19/51/15/1046195115.db2.gz WZUQGNGWJMNINS-KGLIPLIRSA-N 1 2 318.848 4.368 20 0 DIADLO COc1ccnc(C[N@@H+](C)[C@@H](C)[C@@H](C)c2ccc(Cl)cc2)c1 ZINC000475745777 1046195122 /nfs/dbraw/zinc/19/51/22/1046195122.db2.gz WZUQGNGWJMNINS-KGLIPLIRSA-N 1 2 318.848 4.368 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1CCc2cc(F)ccc2C1 ZINC001138482754 1046196275 /nfs/dbraw/zinc/19/62/75/1046196275.db2.gz NWDHDRDEFYWELF-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1CCc2cc(F)ccc2C1 ZINC001138482754 1046196285 /nfs/dbraw/zinc/19/62/85/1046196285.db2.gz NWDHDRDEFYWELF-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO c1oc(C2CC2)nc1C[NH2+][C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000757701986 1046203186 /nfs/dbraw/zinc/20/31/86/1046203186.db2.gz CWTLOJKQQWXGDQ-MRXNPFEDSA-N 1 2 310.397 4.088 20 0 DIADLO Cc1cc(C)cc(NC(=O)Nc2ccccc2-n2cc[nH+]c2)c1 ZINC001202837486 1046210698 /nfs/dbraw/zinc/21/06/98/1046210698.db2.gz JIFJLUVRXDFJDC-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1ccccc1C(C)(F)F)n1cc[nH+]c1 ZINC000635982473 1046213032 /nfs/dbraw/zinc/21/30/32/1046213032.db2.gz DUOVIICXMLPKDG-OAHLLOKOSA-N 1 2 321.371 4.221 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cnc(-c3ccccc3)s1)C2 ZINC001138530948 1046214580 /nfs/dbraw/zinc/21/45/80/1046214580.db2.gz WECLKQJFHLPCAJ-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cnc(-c3ccccc3)s1)C2 ZINC001138530948 1046214592 /nfs/dbraw/zinc/21/45/92/1046214592.db2.gz WECLKQJFHLPCAJ-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1cccc(Cl)c1C ZINC000102517739 1046216489 /nfs/dbraw/zinc/21/64/89/1046216489.db2.gz BBFHKUJFXZFJGE-CYBMUJFWSA-N 1 2 320.820 4.091 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1cccc(Cl)c1C ZINC000102517739 1046216503 /nfs/dbraw/zinc/21/65/03/1046216503.db2.gz BBFHKUJFXZFJGE-CYBMUJFWSA-N 1 2 320.820 4.091 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1c(C)cc(C)cc1C ZINC000102518903 1046217755 /nfs/dbraw/zinc/21/77/55/1046217755.db2.gz AJILBGOOCHQEME-MRXNPFEDSA-N 1 2 314.429 4.054 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1c(C)cc(C)cc1C ZINC000102518903 1046217769 /nfs/dbraw/zinc/21/77/69/1046217769.db2.gz AJILBGOOCHQEME-MRXNPFEDSA-N 1 2 314.429 4.054 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1cnc2ccsc2c1 ZINC000903312980 1046234635 /nfs/dbraw/zinc/23/46/35/1046234635.db2.gz FBICKJNEMYDVDE-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO CC[C@H]([NH2+][C@H](c1ncccn1)C1CC1)c1sccc1Cl ZINC000903321993 1046237019 /nfs/dbraw/zinc/23/70/19/1046237019.db2.gz FITFRKHDVXBECC-STQMWFEESA-N 1 2 307.850 4.384 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1ncccn1)C1CC1)c1sccc1Cl ZINC000903321992 1046237124 /nfs/dbraw/zinc/23/71/24/1046237124.db2.gz FITFRKHDVXBECC-QWHCGFSZSA-N 1 2 307.850 4.384 20 0 DIADLO CCC[C@H]([NH2+][C@@H](C)c1cn(C(C)C)nn1)c1ccc(F)cc1F ZINC000925265487 1046237682 /nfs/dbraw/zinc/23/76/82/1046237682.db2.gz UKRSJDVVSWZWQO-LRDDRELGSA-N 1 2 322.403 4.329 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1ccccc1N1CCCCC1)C2 ZINC001138605358 1046238263 /nfs/dbraw/zinc/23/82/63/1046238263.db2.gz GKWVJDAMKQEYHY-UHFFFAOYSA-N 1 2 310.416 4.332 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1ccccc1N1CCCCC1)C2 ZINC001138605358 1046238272 /nfs/dbraw/zinc/23/82/72/1046238272.db2.gz GKWVJDAMKQEYHY-UHFFFAOYSA-N 1 2 310.416 4.332 20 0 DIADLO Cc1cccnc1[C@H]([NH2+][C@@H](C)c1cn(C(C)C)nn1)C(C)(C)C ZINC000903329145 1046240639 /nfs/dbraw/zinc/24/06/39/1046240639.db2.gz PRUTUBQXEQHXIJ-YOEHRIQHSA-N 1 2 315.465 4.000 20 0 DIADLO Cc1cccnc1[C@H]([NH2+][C@H](C)c1cn(C(C)C)nn1)C(C)(C)C ZINC000903328875 1046241091 /nfs/dbraw/zinc/24/10/91/1046241091.db2.gz PRUTUBQXEQHXIJ-PBHICJAKSA-N 1 2 315.465 4.000 20 0 DIADLO COc1ccc(-c2cccc(C[N@@H+]3C[C@@H](F)C[C@H]3CF)c2)cc1 ZINC001138614366 1046241213 /nfs/dbraw/zinc/24/12/13/1046241213.db2.gz YCDPGFHALDPRLF-ROUUACIJSA-N 1 2 317.379 4.244 20 0 DIADLO COc1ccc(-c2cccc(C[N@H+]3C[C@@H](F)C[C@H]3CF)c2)cc1 ZINC001138614366 1046241223 /nfs/dbraw/zinc/24/12/23/1046241223.db2.gz YCDPGFHALDPRLF-ROUUACIJSA-N 1 2 317.379 4.244 20 0 DIADLO CCSc1ccccc1[C@@H](C)[NH2+][C@H](c1ncccn1)C1CC1 ZINC000903327405 1046241716 /nfs/dbraw/zinc/24/17/16/1046241716.db2.gz SPHVCMOSHQVKFH-DYVFJYSZSA-N 1 2 313.470 4.391 20 0 DIADLO CC[C@H]([NH2+][C@H](c1ncccn1)C1CC1)c1cccc(Cl)c1F ZINC000903327472 1046242010 /nfs/dbraw/zinc/24/20/10/1046242010.db2.gz UKIVQBDYFLOUQK-HOCLYGCPSA-N 1 2 319.811 4.461 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+][C@H](c2ncccn2)C2CC2)cc1F ZINC000903327766 1046242629 /nfs/dbraw/zinc/24/26/29/1046242629.db2.gz YNYUUMHBGMTPDZ-BZNIZROVSA-N 1 2 317.433 4.140 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1csc(C)n1)c1cc(F)ccc1OC ZINC000903370126 1046256385 /nfs/dbraw/zinc/25/63/85/1046256385.db2.gz CQJNILZQYLXSKN-QMTHXVAHSA-N 1 2 308.422 4.401 20 0 DIADLO CCSc1ncc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cn1 ZINC001138650599 1046256453 /nfs/dbraw/zinc/25/64/53/1046256453.db2.gz YWVABWNFKLUADL-MRXNPFEDSA-N 1 2 317.433 4.065 20 0 DIADLO CCSc1ncc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cn1 ZINC001138650599 1046256461 /nfs/dbraw/zinc/25/64/61/1046256461.db2.gz YWVABWNFKLUADL-MRXNPFEDSA-N 1 2 317.433 4.065 20 0 DIADLO CCSc1ncc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)cn1 ZINC001138654562 1046257845 /nfs/dbraw/zinc/25/78/45/1046257845.db2.gz GFVLNINYAWKOIK-MRXNPFEDSA-N 1 2 317.433 4.065 20 0 DIADLO CCSc1ncc(C[N@H+]2CCC[C@@H]2c2ccccc2F)cn1 ZINC001138654562 1046257855 /nfs/dbraw/zinc/25/78/55/1046257855.db2.gz GFVLNINYAWKOIK-MRXNPFEDSA-N 1 2 317.433 4.065 20 0 DIADLO CCCC[N@@H+](Cc1ccccc1F)Cn1cc(C)cnc1=S ZINC000758308716 1046260294 /nfs/dbraw/zinc/26/02/94/1046260294.db2.gz XMRGMPGAWDSPOJ-UHFFFAOYSA-N 1 2 319.449 4.320 20 0 DIADLO CCCC[N@H+](Cc1ccccc1F)Cn1cc(C)cnc1=S ZINC000758308716 1046260303 /nfs/dbraw/zinc/26/03/03/1046260303.db2.gz XMRGMPGAWDSPOJ-UHFFFAOYSA-N 1 2 319.449 4.320 20 0 DIADLO Cc1cnc(=S)n(C[N@H+](Cc2ccccc2F)CC(C)C)c1 ZINC000758307439 1046260546 /nfs/dbraw/zinc/26/05/46/1046260546.db2.gz NZVCXCXJNQAHDQ-UHFFFAOYSA-N 1 2 319.449 4.176 20 0 DIADLO Cc1cnc(=S)n(C[N@@H+](Cc2ccccc2F)CC(C)C)c1 ZINC000758307439 1046260559 /nfs/dbraw/zinc/26/05/59/1046260559.db2.gz NZVCXCXJNQAHDQ-UHFFFAOYSA-N 1 2 319.449 4.176 20 0 DIADLO CC(C)c1cccc(NC(=S)Nc2cc(N(C)C)cc[nH+]2)c1 ZINC000783764879 1046263417 /nfs/dbraw/zinc/26/34/17/1046263417.db2.gz UWFRJKVFFIYFSC-UHFFFAOYSA-N 1 2 314.458 4.080 20 0 DIADLO Fc1ccc(-c2ccc(C[N@@H+]3Cc4cccnc4C3)cc2)cc1 ZINC001138679523 1046265665 /nfs/dbraw/zinc/26/56/65/1046265665.db2.gz DCBRFMOCGGXPKQ-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Fc1ccc(-c2ccc(C[N@H+]3Cc4cccnc4C3)cc2)cc1 ZINC001138679523 1046265667 /nfs/dbraw/zinc/26/56/67/1046265667.db2.gz DCBRFMOCGGXPKQ-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC001138719955 1046275860 /nfs/dbraw/zinc/27/58/60/1046275860.db2.gz KVGSTKVIDULITH-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC001138719955 1046275876 /nfs/dbraw/zinc/27/58/76/1046275876.db2.gz KVGSTKVIDULITH-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[NH2+]Cc1nnc(C2CC2)s1 ZINC000666254852 1046278106 /nfs/dbraw/zinc/27/81/06/1046278106.db2.gz RFKITDTUJKHFMB-VIFPVBQESA-N 1 2 322.503 4.155 20 0 DIADLO CCCCc1ccc(C[N@@H+]2CCO[C@H](c3ccccn3)C2)s1 ZINC001138756520 1046287953 /nfs/dbraw/zinc/28/79/53/1046287953.db2.gz FGAOALUOELXXOW-SFHVURJKSA-N 1 2 316.470 4.059 20 0 DIADLO CCCCc1ccc(C[N@H+]2CCO[C@H](c3ccccn3)C2)s1 ZINC001138756520 1046287966 /nfs/dbraw/zinc/28/79/66/1046287966.db2.gz FGAOALUOELXXOW-SFHVURJKSA-N 1 2 316.470 4.059 20 0 DIADLO c1coc([C@@H]2CCCC[N@H+]2[C@@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000638076287 1046291485 /nfs/dbraw/zinc/29/14/85/1046291485.db2.gz YHKSEVKEEBQJRA-DOTOQJQBSA-N 1 2 314.433 4.246 20 0 DIADLO c1coc([C@@H]2CCCC[N@@H+]2[C@@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000638076287 1046291497 /nfs/dbraw/zinc/29/14/97/1046291497.db2.gz YHKSEVKEEBQJRA-DOTOQJQBSA-N 1 2 314.433 4.246 20 0 DIADLO CC[C@H](Nc1cccc(C[N@H+](C)Cc2cscn2)c1)C1CC1 ZINC000638256473 1046306042 /nfs/dbraw/zinc/30/60/42/1046306042.db2.gz OVCREULRZCNLFB-SFHVURJKSA-N 1 2 315.486 4.376 20 0 DIADLO CC[C@H](Nc1cccc(C[N@@H+](C)Cc2cscn2)c1)C1CC1 ZINC000638256473 1046306056 /nfs/dbraw/zinc/30/60/56/1046306056.db2.gz OVCREULRZCNLFB-SFHVURJKSA-N 1 2 315.486 4.376 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nnc[nH]1)C1CCCCC1)c1ccc(Cl)cc1 ZINC000638290302 1046308529 /nfs/dbraw/zinc/30/85/29/1046308529.db2.gz FFMPLJBMXWGDAH-WBMJQRKESA-N 1 2 318.852 4.430 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1ccc(C)cc1)c1ccccn1 ZINC000089797340 1046313573 /nfs/dbraw/zinc/31/35/73/1046313573.db2.gz XCIUHZSARLKRCG-NRFANRHFSA-N 1 2 318.420 4.278 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CCOC[C@@H]3C(C)C)c(Cl)nc2c1 ZINC001138862502 1046313568 /nfs/dbraw/zinc/31/35/68/1046313568.db2.gz NHSRGTJFSGTSHT-QGZVFWFLSA-N 1 2 318.848 4.053 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CCOC[C@@H]3C(C)C)c(Cl)nc2c1 ZINC001138862502 1046313577 /nfs/dbraw/zinc/31/35/77/1046313577.db2.gz NHSRGTJFSGTSHT-QGZVFWFLSA-N 1 2 318.848 4.053 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2csc(C(C)C)n2)cn1 ZINC001138887491 1046317686 /nfs/dbraw/zinc/31/76/86/1046317686.db2.gz APPFJZACZFOHHW-MRXNPFEDSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2csc(C(C)C)n2)cn1 ZINC001138887491 1046317699 /nfs/dbraw/zinc/31/76/99/1046317699.db2.gz APPFJZACZFOHHW-MRXNPFEDSA-N 1 2 301.459 4.307 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@H](OCc3ccccc3)C2)cs1 ZINC001138887052 1046318716 /nfs/dbraw/zinc/31/87/16/1046318716.db2.gz NDEOLOHTQNGMGH-KRWDZBQOSA-N 1 2 316.470 4.058 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@H](OCc3ccccc3)C2)cs1 ZINC001138887052 1046318731 /nfs/dbraw/zinc/31/87/31/1046318731.db2.gz NDEOLOHTQNGMGH-KRWDZBQOSA-N 1 2 316.470 4.058 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)c(C)c1 ZINC000638399045 1046320170 /nfs/dbraw/zinc/32/01/70/1046320170.db2.gz XZAWETJIKHPPOE-CRAIPNDOSA-N 1 2 312.461 4.394 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(OCC2CC2)c(F)c1)c1ncco1 ZINC000925268478 1046320386 /nfs/dbraw/zinc/32/03/86/1046320386.db2.gz IDIJLRKHFIGKSB-NWDGAFQWSA-N 1 2 304.365 4.014 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(F)cnc1Cl ZINC001138894698 1046321046 /nfs/dbraw/zinc/32/10/46/1046321046.db2.gz XZTVOVUIIAUSBU-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc(F)cnc1Cl ZINC001138894698 1046321063 /nfs/dbraw/zinc/32/10/63/1046321063.db2.gz XZTVOVUIIAUSBU-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(Cl)s1)c1nc2ccccc2s1 ZINC000718200027 1046321759 /nfs/dbraw/zinc/32/17/59/1046321759.db2.gz JQVGLCAFYUQRKW-MRVPVSSYSA-N 1 2 309.847 4.257 20 0 DIADLO Fc1cnc(Cl)c(C[NH+]2CCC(c3cccs3)CC2)c1 ZINC001138892741 1046322251 /nfs/dbraw/zinc/32/22/51/1046322251.db2.gz XBGCFPLJWODGSP-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO c1nnc([C@@H]([NH2+]C2(c3ccccc3)CCC2)C2CCCCC2)[nH]1 ZINC000638457497 1046324011 /nfs/dbraw/zinc/32/40/11/1046324011.db2.gz SDLDEDFEQGITLM-KRWDZBQOSA-N 1 2 310.445 4.095 20 0 DIADLO FCCC1CC[NH+](Cc2nc3ccccc3n2C(F)F)CC1 ZINC000639987659 1046324562 /nfs/dbraw/zinc/32/45/62/1046324562.db2.gz MIOVCPLOKCVHLS-UHFFFAOYSA-N 1 2 311.351 4.003 20 0 DIADLO Cc1cc(C)cc([C@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000638530652 1046326893 /nfs/dbraw/zinc/32/68/93/1046326893.db2.gz BCSJATYGSFKUAW-YJBOKZPZSA-N 1 2 312.461 4.394 20 0 DIADLO Cn1c2ccccc2c2cc(C[N@@H+]3Cc4cccnc4C3)ccc21 ZINC001138914862 1046327111 /nfs/dbraw/zinc/32/71/11/1046327111.db2.gz MYYUGXSYAXAQKP-UHFFFAOYSA-N 1 2 313.404 4.242 20 0 DIADLO Cn1c2ccccc2c2cc(C[N@H+]3Cc4cccnc4C3)ccc21 ZINC001138914862 1046327119 /nfs/dbraw/zinc/32/71/19/1046327119.db2.gz MYYUGXSYAXAQKP-UHFFFAOYSA-N 1 2 313.404 4.242 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc2ccc(F)c(F)c2n1)c1nccs1 ZINC000638664234 1046333766 /nfs/dbraw/zinc/33/37/66/1046333766.db2.gz UDRVEKOWROVBJA-ZDUSSCGKSA-N 1 2 319.380 4.210 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cc(Br)cnc2Cl)[C@@H]1C ZINC001138945057 1046335773 /nfs/dbraw/zinc/33/57/73/1046335773.db2.gz PSSVXAMQDYPONM-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cc(Br)cnc2Cl)[C@@H]1C ZINC001138945057 1046335790 /nfs/dbraw/zinc/33/57/90/1046335790.db2.gz PSSVXAMQDYPONM-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO CCCCOc1cccc(C[N@H+](C)CC(=O)c2ccccc2)c1 ZINC001138956396 1046339052 /nfs/dbraw/zinc/33/90/52/1046339052.db2.gz LQRUGUANHCDMJE-UHFFFAOYSA-N 1 2 311.425 4.180 20 0 DIADLO CCCCOc1cccc(C[N@@H+](C)CC(=O)c2ccccc2)c1 ZINC001138956396 1046339066 /nfs/dbraw/zinc/33/90/66/1046339066.db2.gz LQRUGUANHCDMJE-UHFFFAOYSA-N 1 2 311.425 4.180 20 0 DIADLO C[N@H+](Cc1ccc(C(F)F)nc1)Cc1cc(F)c(F)c(F)c1 ZINC000638845062 1046344451 /nfs/dbraw/zinc/34/44/51/1046344451.db2.gz HHVCJBLEFQSSLU-UHFFFAOYSA-N 1 2 316.273 4.069 20 0 DIADLO C[N@@H+](Cc1ccc(C(F)F)nc1)Cc1cc(F)c(F)c(F)c1 ZINC000638845062 1046344462 /nfs/dbraw/zinc/34/44/62/1046344462.db2.gz HHVCJBLEFQSSLU-UHFFFAOYSA-N 1 2 316.273 4.069 20 0 DIADLO C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)Cc1cscn1 ZINC000170871674 1046348259 /nfs/dbraw/zinc/34/82/59/1046348259.db2.gz RCXXTOJVOFTZJS-SNVBAGLBSA-N 1 2 300.349 4.355 20 0 DIADLO C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)Cc1cscn1 ZINC000170871674 1046348265 /nfs/dbraw/zinc/34/82/65/1046348265.db2.gz RCXXTOJVOFTZJS-SNVBAGLBSA-N 1 2 300.349 4.355 20 0 DIADLO CCc1cccc(NC(=O)Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001202884615 1046350334 /nfs/dbraw/zinc/35/03/34/1046350334.db2.gz GLFXXLFVZAXRSC-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2c(Cl)ccc3cccnc32)s1 ZINC000053154480 1046351712 /nfs/dbraw/zinc/35/17/12/1046351712.db2.gz LUGGEXCHCFOQET-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2c(Cl)ccc3cccnc32)s1 ZINC000053154480 1046351729 /nfs/dbraw/zinc/35/17/29/1046351729.db2.gz LUGGEXCHCFOQET-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO CC(C)Oc1ccc(Br)cc1C[NH+]1CC2(CCC2)C1 ZINC001138993368 1046353525 /nfs/dbraw/zinc/35/35/25/1046353525.db2.gz VVNJHNUYDNTSAD-UHFFFAOYSA-N 1 2 324.262 4.222 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@H+](Cc1ccco1)C1CC1 ZINC001139010802 1046355597 /nfs/dbraw/zinc/35/55/97/1046355597.db2.gz DFUVLGDOHJQKFH-UHFFFAOYSA-N 1 2 305.805 4.496 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@@H+](Cc1ccco1)C1CC1 ZINC001139010802 1046355605 /nfs/dbraw/zinc/35/56/05/1046355605.db2.gz DFUVLGDOHJQKFH-UHFFFAOYSA-N 1 2 305.805 4.496 20 0 DIADLO Cc1cnc(C[NH2+][C@H]2CCc3ccc(-c4ccccc4)cc32)o1 ZINC000639095841 1046358651 /nfs/dbraw/zinc/35/86/51/1046358651.db2.gz UIEZIHTVSSRVJY-IBGZPJMESA-N 1 2 304.393 4.427 20 0 DIADLO FC1C[C@@H]2COC[C@H](C1)[N@@H+]2Cc1ccc(-c2cccs2)s1 ZINC001139023786 1046362756 /nfs/dbraw/zinc/36/27/56/1046362756.db2.gz YWKZOLHXURZADQ-YHWZYXNKSA-N 1 2 323.458 4.178 20 0 DIADLO FC1C[C@@H]2COC[C@H](C1)[N@H+]2Cc1ccc(-c2cccs2)s1 ZINC001139023786 1046362760 /nfs/dbraw/zinc/36/27/60/1046362760.db2.gz YWKZOLHXURZADQ-YHWZYXNKSA-N 1 2 323.458 4.178 20 0 DIADLO CCOC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(-c2cccs2)s1 ZINC001139022578 1046363002 /nfs/dbraw/zinc/36/30/02/1046363002.db2.gz HVMYYTMKTMNGNU-ZDUSSCGKSA-N 1 2 321.467 4.004 20 0 DIADLO CCOC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(-c2cccs2)s1 ZINC001139022578 1046363006 /nfs/dbraw/zinc/36/30/06/1046363006.db2.gz HVMYYTMKTMNGNU-ZDUSSCGKSA-N 1 2 321.467 4.004 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)cn1 ZINC000639234683 1046375428 /nfs/dbraw/zinc/37/54/28/1046375428.db2.gz KWSIIQSUVOJKHH-HNNXBMFYSA-N 1 2 304.340 4.339 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)cn1 ZINC000639234683 1046375444 /nfs/dbraw/zinc/37/54/44/1046375444.db2.gz KWSIIQSUVOJKHH-HNNXBMFYSA-N 1 2 304.340 4.339 20 0 DIADLO CC[C@@H](C(=O)OCc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000748491043 1046377283 /nfs/dbraw/zinc/37/72/83/1046377283.db2.gz GADFBIXHJWMKBB-LJQANCHMSA-N 1 2 320.392 4.109 20 0 DIADLO CCCCc1oc2ccccc2c1CNc1cc(CO)cc[nH+]1 ZINC001202891374 1046379132 /nfs/dbraw/zinc/37/91/32/1046379132.db2.gz CXHKWOITBJBQQC-UHFFFAOYSA-N 1 2 310.397 4.275 20 0 DIADLO Cc1c2cccc(Cl)c2sc1CNc1cc(CO)cc[nH+]1 ZINC001202891924 1046382425 /nfs/dbraw/zinc/38/24/25/1046382425.db2.gz HQFLRZGPQVESFZ-UHFFFAOYSA-N 1 2 318.829 4.363 20 0 DIADLO CC(C)c1nc(C[NH+]2CCC(Cc3nccs3)CC2)cs1 ZINC000639375710 1046387815 /nfs/dbraw/zinc/38/78/15/1046387815.db2.gz APTFMNNKPRPDMC-UHFFFAOYSA-N 1 2 321.515 4.178 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Nc1ccc(-c2ccccc2)cc1F ZINC000748617481 1046389086 /nfs/dbraw/zinc/38/90/86/1046389086.db2.gz KAINPFUOPKJSHV-UHFFFAOYSA-N 1 2 323.371 4.108 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nc(C2CCC2)no1)c1ccc(Cl)cc1 ZINC000639442018 1046401026 /nfs/dbraw/zinc/40/10/26/1046401026.db2.gz ZSBKHRIBZXYFQU-MRXNPFEDSA-N 1 2 319.836 4.477 20 0 DIADLO CCSc1nn(C[N@@H+]2CCC[C@H]2CC(C)C)c(=S)s1 ZINC000748792721 1046404661 /nfs/dbraw/zinc/40/46/61/1046404661.db2.gz RKBXUXVESIQUCP-NSHDSACASA-N 1 2 317.549 4.254 20 0 DIADLO CCSc1nn(C[N@H+]2CCC[C@H]2CC(C)C)c(=S)s1 ZINC000748792721 1046404668 /nfs/dbraw/zinc/40/46/68/1046404668.db2.gz RKBXUXVESIQUCP-NSHDSACASA-N 1 2 317.549 4.254 20 0 DIADLO CCc1ccc(C2=CC[N@H+](Cc3coc(C4CC4)n3)CC2)cc1 ZINC000780782264 1046405078 /nfs/dbraw/zinc/40/50/78/1046405078.db2.gz OFYBOYAUWJZKRH-UHFFFAOYSA-N 1 2 308.425 4.404 20 0 DIADLO CCc1ccc(C2=CC[N@@H+](Cc3coc(C4CC4)n3)CC2)cc1 ZINC000780782264 1046405086 /nfs/dbraw/zinc/40/50/86/1046405086.db2.gz OFYBOYAUWJZKRH-UHFFFAOYSA-N 1 2 308.425 4.404 20 0 DIADLO F[C@@H]1C[NH+](Cc2c3ccccc3[nH]c2-c2ccccc2)C[C@H]1F ZINC001139198132 1046409456 /nfs/dbraw/zinc/40/94/56/1046409456.db2.gz HUMFHHCNSYOFFQ-IAGOWNOFSA-N 1 2 312.363 4.327 20 0 DIADLO CC(C)(C)[C@H]([NH2+]Cc1nc(CC2CC2)no1)c1ccc(F)cc1 ZINC000639538422 1046411456 /nfs/dbraw/zinc/41/14/56/1046411456.db2.gz OJCSUHJGIKGVBV-QGZVFWFLSA-N 1 2 317.408 4.038 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+]Cc2nc(C3CCC3)no2)cc1 ZINC000639563968 1046412592 /nfs/dbraw/zinc/41/25/92/1046412592.db2.gz FQVXIFUBVMRWRL-GFCCVEGCSA-N 1 2 317.458 4.300 20 0 DIADLO Cc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nc(CC2CC2)no1 ZINC000639565766 1046412749 /nfs/dbraw/zinc/41/27/49/1046412749.db2.gz SLGQVEWWZUORMB-KRWDZBQOSA-N 1 2 313.445 4.208 20 0 DIADLO c1ccc([C@H](CC2CCC2)[NH2+]Cc2nc(CC3CC3)no2)cc1 ZINC000639572426 1046412939 /nfs/dbraw/zinc/41/29/39/1046412939.db2.gz QTAVNRSLLBENFH-KRWDZBQOSA-N 1 2 311.429 4.043 20 0 DIADLO Cc1ccccc1[C@H]([NH2+]Cc1nc(CC2CC2)no1)C(C)(C)C ZINC000639565019 1046413428 /nfs/dbraw/zinc/41/34/28/1046413428.db2.gz FMXKPYLQNMHMIT-SFHVURJKSA-N 1 2 313.445 4.208 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1nc(C2CCC2)no1)c1cccs1 ZINC000639577696 1046413486 /nfs/dbraw/zinc/41/34/86/1046413486.db2.gz JAWAHECPXZOGLO-CYBMUJFWSA-N 1 2 305.447 4.276 20 0 DIADLO Cc1cc([C@H]([NH2+]Cc2nc(C3CCC3)no2)C2CC2)ccc1F ZINC000639570439 1046413597 /nfs/dbraw/zinc/41/35/97/1046413597.db2.gz OJXYEFNDTJVQKE-QGZVFWFLSA-N 1 2 315.392 4.026 20 0 DIADLO Cc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nc(CC2CC2)no1 ZINC000639565768 1046413682 /nfs/dbraw/zinc/41/36/82/1046413682.db2.gz SLGQVEWWZUORMB-QGZVFWFLSA-N 1 2 313.445 4.208 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2oc(-c3ccccc3)nc2C)n1 ZINC000639582035 1046414726 /nfs/dbraw/zinc/41/47/26/1046414726.db2.gz ZNMRXOADRPHDJZ-CYBMUJFWSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CCC2)no1)c1cc2ccccc2s1 ZINC000639582057 1046414959 /nfs/dbraw/zinc/41/49/59/1046414959.db2.gz ZRBJJXUCNFUUOT-NSHDSACASA-N 1 2 313.426 4.403 20 0 DIADLO FC1(F)CC2(C[NH+](Cc3ccc(Oc4ccccc4)nc3)C2)C1 ZINC001139246266 1046419209 /nfs/dbraw/zinc/41/92/09/1046419209.db2.gz YOYPFRNPULIHDL-UHFFFAOYSA-N 1 2 316.351 4.105 20 0 DIADLO C[N@H+](Cc1cnccn1)Cc1ccccc1Oc1ccc(F)cc1 ZINC001139299749 1046427499 /nfs/dbraw/zinc/42/74/99/1046427499.db2.gz ZJJOZSKYKXALGQ-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[N@@H+](Cc1cnccn1)Cc1ccccc1Oc1ccc(F)cc1 ZINC001139299749 1046427505 /nfs/dbraw/zinc/42/75/05/1046427505.db2.gz ZJJOZSKYKXALGQ-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(Cl)c(F)c1 ZINC000719414666 1046427778 /nfs/dbraw/zinc/42/77/78/1046427778.db2.gz XYZMFMAEICZQFT-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO COc1ccc2cc(C[N@@H+]3CCCC[C@H](F)C3)c(Cl)nc2c1 ZINC001139310321 1046429095 /nfs/dbraw/zinc/42/90/95/1046429095.db2.gz BEUDSSCMVNGXSD-AWEZNQCLSA-N 1 2 322.811 4.221 20 0 DIADLO COc1ccc2cc(C[N@H+]3CCCC[C@H](F)C3)c(Cl)nc2c1 ZINC001139310321 1046429097 /nfs/dbraw/zinc/42/90/97/1046429097.db2.gz BEUDSSCMVNGXSD-AWEZNQCLSA-N 1 2 322.811 4.221 20 0 DIADLO COc1ccc2cc(C[N@@H+]3CCCC[C@@H](F)C3)c(Cl)nc2c1 ZINC001139310322 1046429672 /nfs/dbraw/zinc/42/96/72/1046429672.db2.gz BEUDSSCMVNGXSD-CQSZACIVSA-N 1 2 322.811 4.221 20 0 DIADLO COc1ccc2cc(C[N@H+]3CCCC[C@@H](F)C3)c(Cl)nc2c1 ZINC001139310322 1046429674 /nfs/dbraw/zinc/42/96/74/1046429674.db2.gz BEUDSSCMVNGXSD-CQSZACIVSA-N 1 2 322.811 4.221 20 0 DIADLO C[N@H+](CCc1cccs1)Cc1c(Cl)ccnc1Cl ZINC001139478926 1046454227 /nfs/dbraw/zinc/45/42/27/1046454227.db2.gz SIQKWKAYEZTIGN-UHFFFAOYSA-N 1 2 301.242 4.124 20 0 DIADLO C[N@@H+](CCc1cccs1)Cc1c(Cl)ccnc1Cl ZINC001139478926 1046454235 /nfs/dbraw/zinc/45/42/35/1046454235.db2.gz SIQKWKAYEZTIGN-UHFFFAOYSA-N 1 2 301.242 4.124 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2csc(C3CCCC3)n2)s1 ZINC000639995697 1046441177 /nfs/dbraw/zinc/44/11/77/1046441177.db2.gz XUJCSTLXZGYPHH-JTQLQIEISA-N 1 2 307.488 4.416 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2nc(-c3ccccc3)oc2C)s1 ZINC000639994552 1046441934 /nfs/dbraw/zinc/44/19/34/1046441934.db2.gz KEUBYIFWMHGZOP-LLVKDONJSA-N 1 2 313.426 4.266 20 0 DIADLO CCc1noc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCCCC2)n1 ZINC000640013773 1046443399 /nfs/dbraw/zinc/44/33/99/1046443399.db2.gz RQWDOLKFFGEDCT-GOSISDBHSA-N 1 2 317.408 4.182 20 0 DIADLO Cc1scc(CNC(=O)Nc2c(C)cc(C)[nH+]c2C)c1C ZINC000640141187 1046450981 /nfs/dbraw/zinc/45/09/81/1046450981.db2.gz GCZNBKZVHDKDQI-UHFFFAOYSA-N 1 2 303.431 4.007 20 0 DIADLO C[N@H+](CCc1cccc(F)c1)Cc1c(Cl)ccnc1Cl ZINC001139481548 1046454197 /nfs/dbraw/zinc/45/41/97/1046454197.db2.gz IEZPCROTZODFEM-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1cccc(F)c1)Cc1c(Cl)ccnc1Cl ZINC001139481548 1046454202 /nfs/dbraw/zinc/45/42/02/1046454202.db2.gz IEZPCROTZODFEM-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO CCc1ccc(NC(=O)Nc2cccc(Cn3cc[nH+]c3)c2)cc1 ZINC001202940880 1046456168 /nfs/dbraw/zinc/45/61/68/1046456168.db2.gz ZBLHOZHDADDKOZ-UHFFFAOYSA-N 1 2 320.396 4.138 20 0 DIADLO Fc1ccc(F)c2c1CC[C@@H]2[NH2+][C@@H]1COc2c1cccc2Cl ZINC000677042307 1046456666 /nfs/dbraw/zinc/45/66/66/1046456666.db2.gz FYKHRUVIRSPSTO-LSDHHAIUSA-N 1 2 321.754 4.329 20 0 DIADLO Brc1cc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cs1 ZINC000125389292 1046466274 /nfs/dbraw/zinc/46/62/74/1046466274.db2.gz IQBPYAHQUPHUNT-GFCCVEGCSA-N 1 2 311.248 4.176 20 0 DIADLO Brc1cc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)cs1 ZINC000125389292 1046466282 /nfs/dbraw/zinc/46/62/82/1046466282.db2.gz IQBPYAHQUPHUNT-GFCCVEGCSA-N 1 2 311.248 4.176 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cccc(C)c2)Cc2ccccn2)nc1 ZINC000125414931 1046467789 /nfs/dbraw/zinc/46/77/89/1046467789.db2.gz SPHVBGQMEJQZEB-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cccc(C)c2)Cc2ccccn2)nc1 ZINC000125414931 1046467794 /nfs/dbraw/zinc/46/77/94/1046467794.db2.gz SPHVBGQMEJQZEB-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cnc(-c3ccccc3)[nH]2)cn1 ZINC001139556885 1046470421 /nfs/dbraw/zinc/47/04/21/1046470421.db2.gz SFEVKNJHKMNHBV-IBGZPJMESA-N 1 2 318.424 4.117 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cnc(-c3ccccc3)[nH]2)cn1 ZINC001139556885 1046470425 /nfs/dbraw/zinc/47/04/25/1046470425.db2.gz SFEVKNJHKMNHBV-IBGZPJMESA-N 1 2 318.424 4.117 20 0 DIADLO Cn1c2ccccc2nc1[C@@H]([NH2+]C/C=C/Cl)c1ccccc1 ZINC000125941104 1046474410 /nfs/dbraw/zinc/47/44/10/1046474410.db2.gz RZKIFQLQQWFCSI-CRVDFBCUSA-N 1 2 311.816 4.005 20 0 DIADLO CCC[C@@H](NC(=O)NCc1c[nH+]c(C)cc1C)c1ccccc1 ZINC000454221493 1046478434 /nfs/dbraw/zinc/47/84/34/1046478434.db2.gz MNXCQKSMVWTUBI-GOSISDBHSA-N 1 2 311.429 4.039 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000247678748 1046494299 /nfs/dbraw/zinc/49/42/99/1046494299.db2.gz ROHFCJBUDXCPPZ-SQNIBIBYSA-N 1 2 319.493 4.289 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@H](c2nccn2C)c2cccc(F)c2)c1 ZINC000128544681 1046494678 /nfs/dbraw/zinc/49/46/78/1046494678.db2.gz XRCWDBMWVOCPEY-KXBFYZLASA-N 1 2 323.415 4.308 20 0 DIADLO CCC[C@H](C)[N@@H+]1CCO[C@H](c2ccccc2Br)C1 ZINC000782181288 1046497586 /nfs/dbraw/zinc/49/75/86/1046497586.db2.gz RACMARQWDGBETO-WFASDCNBSA-N 1 2 312.251 4.011 20 0 DIADLO CCC[C@H](C)[N@H+]1CCO[C@H](c2ccccc2Br)C1 ZINC000782181288 1046497589 /nfs/dbraw/zinc/49/75/89/1046497589.db2.gz RACMARQWDGBETO-WFASDCNBSA-N 1 2 312.251 4.011 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)s1 ZINC000130619504 1046513159 /nfs/dbraw/zinc/51/31/59/1046513159.db2.gz VRPCTSZQPMXHJP-YOEHRIQHSA-N 1 2 316.470 4.229 20 0 DIADLO CC(C)c1ncc(C[N@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)s1 ZINC000130619504 1046513165 /nfs/dbraw/zinc/51/31/65/1046513165.db2.gz VRPCTSZQPMXHJP-YOEHRIQHSA-N 1 2 316.470 4.229 20 0 DIADLO Cc1nc(SCc2c[nH+]cn2Cc2ccccc2)sc1C ZINC000782280345 1046513725 /nfs/dbraw/zinc/51/37/25/1046513725.db2.gz JXUINRHQNFTLPT-UHFFFAOYSA-N 1 2 315.467 4.297 20 0 DIADLO Cc1ccc(Nc2nc(C[N@@H+]3CC[C@@H](C(F)F)C3)cs2)cc1 ZINC000677731165 1046517301 /nfs/dbraw/zinc/51/73/01/1046517301.db2.gz FAOUFYBKBZUFOV-GFCCVEGCSA-N 1 2 323.412 4.282 20 0 DIADLO Cc1ccc(Nc2nc(C[N@H+]3CC[C@@H](C(F)F)C3)cs2)cc1 ZINC000677731165 1046517311 /nfs/dbraw/zinc/51/73/11/1046517311.db2.gz FAOUFYBKBZUFOV-GFCCVEGCSA-N 1 2 323.412 4.282 20 0 DIADLO CN1CC[N@H+](Cc2ccccc2C(F)F)[C@H](c2ccccc2)C1 ZINC001139795826 1046518025 /nfs/dbraw/zinc/51/80/25/1046518025.db2.gz IZIYOVNJZRKONB-SFHVURJKSA-N 1 2 316.395 4.113 20 0 DIADLO CN1CC[N@@H+](Cc2ccccc2C(F)F)[C@H](c2ccccc2)C1 ZINC001139795826 1046518038 /nfs/dbraw/zinc/51/80/38/1046518038.db2.gz IZIYOVNJZRKONB-SFHVURJKSA-N 1 2 316.395 4.113 20 0 DIADLO CN1CC[N@H+](Cc2ccccc2C(F)F)[C@@H](c2ccccc2)C1 ZINC001139795824 1046519296 /nfs/dbraw/zinc/51/92/96/1046519296.db2.gz IZIYOVNJZRKONB-GOSISDBHSA-N 1 2 316.395 4.113 20 0 DIADLO CN1CC[N@@H+](Cc2ccccc2C(F)F)[C@@H](c2ccccc2)C1 ZINC001139795824 1046519307 /nfs/dbraw/zinc/51/93/07/1046519307.db2.gz IZIYOVNJZRKONB-GOSISDBHSA-N 1 2 316.395 4.113 20 0 DIADLO FC(F)[C@@H]1CC[N@H+](Cc2csc(C3CCCCC3)n2)C1 ZINC000677733366 1046519671 /nfs/dbraw/zinc/51/96/71/1046519671.db2.gz QNJZQUMWMPIQFQ-GFCCVEGCSA-N 1 2 300.418 4.278 20 0 DIADLO FC(F)[C@@H]1CC[N@@H+](Cc2csc(C3CCCCC3)n2)C1 ZINC000677733366 1046519683 /nfs/dbraw/zinc/51/96/83/1046519683.db2.gz QNJZQUMWMPIQFQ-GFCCVEGCSA-N 1 2 300.418 4.278 20 0 DIADLO Clc1cc(C[N@H+]2CCC23CCCC3)c(Br)cn1 ZINC001139803009 1046522333 /nfs/dbraw/zinc/52/23/33/1046522333.db2.gz WLAGZVAZWUNBLL-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Clc1cc(C[N@@H+]2CCC23CCCC3)c(Br)cn1 ZINC001139803009 1046522324 /nfs/dbraw/zinc/52/23/24/1046522324.db2.gz WLAGZVAZWUNBLL-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)s2)s1 ZINC001139818309 1046524745 /nfs/dbraw/zinc/52/47/45/1046524745.db2.gz BRVITVMDOBLLKX-JTQLQIEISA-N 1 2 314.863 4.204 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@H]2c2ccc(Cl)s2)s1 ZINC001139818309 1046524751 /nfs/dbraw/zinc/52/47/51/1046524751.db2.gz BRVITVMDOBLLKX-JTQLQIEISA-N 1 2 314.863 4.204 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@H]1Cc2ccc(Cl)cc21 ZINC001625981201 1046525724 /nfs/dbraw/zinc/52/57/24/1046525724.db2.gz FQCHAZQUJPCIRB-INIZCTEOSA-N 1 2 323.783 4.009 20 0 DIADLO C[N@H+](Cc1coc(-c2ccccc2)n1)Cc1ccc(F)c(F)c1 ZINC000641934771 1046528402 /nfs/dbraw/zinc/52/84/02/1046528402.db2.gz XXZRVWZWQZUQTI-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1coc(-c2ccccc2)n1)Cc1ccc(F)c(F)c1 ZINC000641934771 1046528409 /nfs/dbraw/zinc/52/84/09/1046528409.db2.gz XXZRVWZWQZUQTI-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000641959457 1046532386 /nfs/dbraw/zinc/53/23/86/1046532386.db2.gz CSYKSFWZFPVEOV-KDOFPFPSSA-N 1 2 301.817 4.475 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000641959457 1046532394 /nfs/dbraw/zinc/53/23/94/1046532394.db2.gz CSYKSFWZFPVEOV-KDOFPFPSSA-N 1 2 301.817 4.475 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H](C)c1nc(C)no1 ZINC000677886149 1046533119 /nfs/dbraw/zinc/53/31/19/1046533119.db2.gz KXIUWTZQIQXDMV-VIFPVBQESA-N 1 2 314.216 4.268 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H](C)c1nc(C)no1 ZINC000677886149 1046533126 /nfs/dbraw/zinc/53/31/26/1046533126.db2.gz KXIUWTZQIQXDMV-VIFPVBQESA-N 1 2 314.216 4.268 20 0 DIADLO COc1ccccc1[C@@H]1CCCCN1c1cc(C)[nH+]c(C2CC2)n1 ZINC000677882423 1046533966 /nfs/dbraw/zinc/53/39/66/1046533966.db2.gz JEJYJYXVPQJMCO-KRWDZBQOSA-N 1 2 323.440 4.403 20 0 DIADLO CCSCC[C@H](C)[N@H+](C)Cc1noc(-c2ccccc2C)n1 ZINC000132648717 1046534230 /nfs/dbraw/zinc/53/42/30/1046534230.db2.gz GTYHGCWBRXOFJI-AWEZNQCLSA-N 1 2 319.474 4.009 20 0 DIADLO CCSCC[C@H](C)[N@@H+](C)Cc1noc(-c2ccccc2C)n1 ZINC000132648717 1046534246 /nfs/dbraw/zinc/53/42/46/1046534246.db2.gz GTYHGCWBRXOFJI-AWEZNQCLSA-N 1 2 319.474 4.009 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1C[N@@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001139888052 1046544526 /nfs/dbraw/zinc/54/45/26/1046544526.db2.gz JEJNSYHZPVKJNP-UONOGXRCSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1C[N@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001139888052 1046544537 /nfs/dbraw/zinc/54/45/37/1046544537.db2.gz JEJNSYHZPVKJNP-UONOGXRCSA-N 1 2 307.306 4.286 20 0 DIADLO CCCCCC[C@H](C)NC(=O)C[N@@H+]1CCc2sccc2[C@H]1C ZINC000783010982 1046551164 /nfs/dbraw/zinc/55/11/64/1046551164.db2.gz ILPGVOJYLKQSQQ-LSDHHAIUSA-N 1 2 322.518 4.142 20 0 DIADLO CCCCCC[C@H](C)NC(=O)C[N@H+]1CCc2sccc2[C@H]1C ZINC000783010982 1046551180 /nfs/dbraw/zinc/55/11/80/1046551180.db2.gz ILPGVOJYLKQSQQ-LSDHHAIUSA-N 1 2 322.518 4.142 20 0 DIADLO CCCCCC[C@H](C)NC(=O)C[N@@H+]1CCc2sccc2[C@@H]1C ZINC000783010980 1046551589 /nfs/dbraw/zinc/55/15/89/1046551589.db2.gz ILPGVOJYLKQSQQ-GJZGRUSLSA-N 1 2 322.518 4.142 20 0 DIADLO CCCCCC[C@H](C)NC(=O)C[N@H+]1CCc2sccc2[C@@H]1C ZINC000783010980 1046551599 /nfs/dbraw/zinc/55/15/99/1046551599.db2.gz ILPGVOJYLKQSQQ-GJZGRUSLSA-N 1 2 322.518 4.142 20 0 DIADLO C[N@H+](C/C=C/c1ccccc1)Cc1cnc(Br)s1 ZINC001139915476 1046553476 /nfs/dbraw/zinc/55/34/76/1046553476.db2.gz ZZZXGDGIHRPYOD-VMPITWQZSA-N 1 2 323.259 4.051 20 0 DIADLO C[N@@H+](C/C=C/c1ccccc1)Cc1cnc(Br)s1 ZINC001139915476 1046553491 /nfs/dbraw/zinc/55/34/91/1046553491.db2.gz ZZZXGDGIHRPYOD-VMPITWQZSA-N 1 2 323.259 4.051 20 0 DIADLO COc1cc(CNc2cc3cc[nH]c3c[nH+]2)cc(C(F)(F)F)c1 ZINC001202987306 1046555342 /nfs/dbraw/zinc/55/53/42/1046555342.db2.gz XIDLPMSDTGBXHQ-UHFFFAOYSA-N 1 2 321.302 4.202 20 0 DIADLO COCc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)o1 ZINC000678122592 1046558058 /nfs/dbraw/zinc/55/80/58/1046558058.db2.gz FLHFXXFDOHWYMQ-UHFFFAOYSA-N 1 2 314.212 4.365 20 0 DIADLO COCc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)o1 ZINC000678122592 1046558075 /nfs/dbraw/zinc/55/80/75/1046558075.db2.gz FLHFXXFDOHWYMQ-UHFFFAOYSA-N 1 2 314.212 4.365 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@@H](C)C(=O)Nc1cc(Cl)ccc1C ZINC000055082532 1046558561 /nfs/dbraw/zinc/55/85/61/1046558561.db2.gz BOKWKYPOVLZWLR-LBPRGKRZSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1occc1C[N@H+](C)[C@@H](C)C(=O)Nc1cc(Cl)ccc1C ZINC000055082532 1046558575 /nfs/dbraw/zinc/55/85/75/1046558575.db2.gz BOKWKYPOVLZWLR-LBPRGKRZSA-N 1 2 320.820 4.009 20 0 DIADLO CCCn1cc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)cn1 ZINC000678122960 1046558776 /nfs/dbraw/zinc/55/87/76/1046558776.db2.gz IJDIXSQRVZJZTM-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO CCCn1cc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)cn1 ZINC000678122960 1046558789 /nfs/dbraw/zinc/55/87/89/1046558789.db2.gz IJDIXSQRVZJZTM-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc(Cl)c1C ZINC000055082715 1046559982 /nfs/dbraw/zinc/55/99/82/1046559982.db2.gz XADXNODBEYTGKO-LBPRGKRZSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1occc1C[N@H+](C)[C@@H](C)C(=O)Nc1cccc(Cl)c1C ZINC000055082715 1046559990 /nfs/dbraw/zinc/55/99/90/1046559990.db2.gz XADXNODBEYTGKO-LBPRGKRZSA-N 1 2 320.820 4.009 20 0 DIADLO COc1c(Cl)cccc1C[NH2+]Cc1csc(C(C)(C)C)n1 ZINC000897483119 1046563230 /nfs/dbraw/zinc/56/32/30/1046563230.db2.gz JRVCAXVFPIZSOL-UHFFFAOYSA-N 1 2 324.877 4.392 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1n[nH]c2ccccc21 ZINC000678132091 1046563264 /nfs/dbraw/zinc/56/32/64/1046563264.db2.gz XNAYNJCJCPSUOR-NSHDSACASA-N 1 2 301.340 4.034 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1n[nH]c2ccccc21 ZINC000678132091 1046563274 /nfs/dbraw/zinc/56/32/74/1046563274.db2.gz XNAYNJCJCPSUOR-NSHDSACASA-N 1 2 301.340 4.034 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1nn(C)c2ccccc12 ZINC000678125505 1046563527 /nfs/dbraw/zinc/56/35/27/1046563527.db2.gz UUKFSEVHZSMHFU-UHFFFAOYSA-N 1 2 319.861 4.310 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1nn(C)c2ccccc12 ZINC000678125505 1046563543 /nfs/dbraw/zinc/56/35/43/1046563543.db2.gz UUKFSEVHZSMHFU-UHFFFAOYSA-N 1 2 319.861 4.310 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1cc2ccccc2cn1 ZINC001140001320 1046566855 /nfs/dbraw/zinc/56/68/55/1046566855.db2.gz LUBKOKJFUWOGQP-UHFFFAOYSA-N 1 2 318.420 4.328 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1cc2ccccc2cn1 ZINC001140001320 1046566870 /nfs/dbraw/zinc/56/68/70/1046566870.db2.gz LUBKOKJFUWOGQP-UHFFFAOYSA-N 1 2 318.420 4.328 20 0 DIADLO CC(C)[N@H+](Cc1cn2cccc(F)c2n1)Cc1ccccc1F ZINC000678141954 1046569289 /nfs/dbraw/zinc/56/92/89/1046569289.db2.gz WVEQGVLYXDFWDA-UHFFFAOYSA-N 1 2 315.367 4.023 20 0 DIADLO CC(C)[N@@H+](Cc1cn2cccc(F)c2n1)Cc1ccccc1F ZINC000678141954 1046569305 /nfs/dbraw/zinc/56/93/05/1046569305.db2.gz WVEQGVLYXDFWDA-UHFFFAOYSA-N 1 2 315.367 4.023 20 0 DIADLO CCC[N@H+](Cc1cn2cccc(F)c2n1)Cc1ccccc1F ZINC000678146493 1046569794 /nfs/dbraw/zinc/56/97/94/1046569794.db2.gz CDEKQEQGCGYDOV-UHFFFAOYSA-N 1 2 315.367 4.025 20 0 DIADLO CCC[N@@H+](Cc1cn2cccc(F)c2n1)Cc1ccccc1F ZINC000678146493 1046569808 /nfs/dbraw/zinc/56/98/08/1046569808.db2.gz CDEKQEQGCGYDOV-UHFFFAOYSA-N 1 2 315.367 4.025 20 0 DIADLO CC[C@H](C)c1ccccc1NC(=O)[C@H](C)[N@H+](C)Cc1ccco1 ZINC000057875896 1046572670 /nfs/dbraw/zinc/57/26/70/1046572670.db2.gz ISQIVNKMERRUCJ-GJZGRUSLSA-N 1 2 314.429 4.252 20 0 DIADLO CC[C@H](C)c1ccccc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccco1 ZINC000057875896 1046572687 /nfs/dbraw/zinc/57/26/87/1046572687.db2.gz ISQIVNKMERRUCJ-GJZGRUSLSA-N 1 2 314.429 4.252 20 0 DIADLO Clc1cccc(C[NH2+]Cc2cccnc2Cl)c1Cl ZINC000729679018 1046574200 /nfs/dbraw/zinc/57/42/00/1046574200.db2.gz ARXKOQXQNNEATL-UHFFFAOYSA-N 1 2 301.604 4.332 20 0 DIADLO CC(=O)Nc1nc2ccc(Nc3c[nH+]c(C)cc3C)cc2s1 ZINC001212938737 1046575718 /nfs/dbraw/zinc/57/57/18/1046575718.db2.gz UQZHGOUYSDVETO-UHFFFAOYSA-N 1 2 312.398 4.010 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CC=C(c3ccc(F)cc3)CC2)o1 ZINC000642187540 1046578356 /nfs/dbraw/zinc/57/83/56/1046578356.db2.gz BLYMJPWKXGCDNM-UHFFFAOYSA-N 1 2 314.404 4.401 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)o1 ZINC000642187540 1046578369 /nfs/dbraw/zinc/57/83/69/1046578369.db2.gz BLYMJPWKXGCDNM-UHFFFAOYSA-N 1 2 314.404 4.401 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cnc(Br)cc2Cl)CC1 ZINC001140076475 1046580004 /nfs/dbraw/zinc/58/00/04/1046580004.db2.gz UOHGSCXDSQBHJQ-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cnc(Br)cc2Cl)CC1 ZINC001140076475 1046580014 /nfs/dbraw/zinc/58/00/14/1046580014.db2.gz UOHGSCXDSQBHJQ-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@H](c1ccccc1)[N@H+](C)Cc1n[nH]c2ccc(OC)cc21 ZINC001140069306 1046580877 /nfs/dbraw/zinc/58/08/77/1046580877.db2.gz RDCUPCWTDHAMPR-LJQANCHMSA-N 1 2 309.413 4.155 20 0 DIADLO CC[C@H](c1ccccc1)[N@@H+](C)Cc1n[nH]c2ccc(OC)cc21 ZINC001140069306 1046580887 /nfs/dbraw/zinc/58/08/87/1046580887.db2.gz RDCUPCWTDHAMPR-LJQANCHMSA-N 1 2 309.413 4.155 20 0 DIADLO C[C@H](CC(F)(F)F)Nc1[nH+]cnc2[nH]c3cc(F)ccc3c21 ZINC000642231295 1046583633 /nfs/dbraw/zinc/58/36/33/1046583633.db2.gz GCGVORKWTQEIJP-SSDOTTSWSA-N 1 2 312.270 4.003 20 0 DIADLO CCCCCCOc1ccc(C[NH2+][C@@H](C)c2nc(C)no2)cc1 ZINC000729684761 1046586913 /nfs/dbraw/zinc/58/69/13/1046586913.db2.gz VTQFFLAJOGIROK-AWEZNQCLSA-N 1 2 317.433 4.188 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(C(F)(F)F)ccn2)Cc2ccccc21 ZINC001140104671 1046588227 /nfs/dbraw/zinc/58/82/27/1046588227.db2.gz XETOCFANGDGYJZ-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(C(F)(F)F)ccn2)Cc2ccccc21 ZINC001140104671 1046588239 /nfs/dbraw/zinc/58/82/39/1046588239.db2.gz XETOCFANGDGYJZ-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO Cc1cnc(C[NH2+]C2(c3ccc(F)cc3F)CCCCC2)o1 ZINC000678218856 1046588887 /nfs/dbraw/zinc/58/88/87/1046588887.db2.gz OEJOBCRLYUYUOS-UHFFFAOYSA-N 1 2 306.356 4.210 20 0 DIADLO C[C@H]1C[N@H+](Cc2cscc2Cl)C[C@H](c2ccccc2)O1 ZINC000678213649 1046589023 /nfs/dbraw/zinc/58/90/23/1046589023.db2.gz CZXXPPMHLXOBKQ-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cscc2Cl)C[C@H](c2ccccc2)O1 ZINC000678213649 1046589034 /nfs/dbraw/zinc/58/90/34/1046589034.db2.gz CZXXPPMHLXOBKQ-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]([NH2+][C@H](c1cccc(F)c1)c1ccccn1)c1cccc(O)c1 ZINC000194941228 1046590727 /nfs/dbraw/zinc/59/07/27/1046590727.db2.gz XVEOGKUDGNYRAO-JLTOFOAXSA-N 1 2 322.383 4.367 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(O)cc1F ZINC001140129552 1046594170 /nfs/dbraw/zinc/59/41/70/1046594170.db2.gz HKDOZEJCQFUBED-GOSISDBHSA-N 1 2 315.388 4.015 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(O)cc1F ZINC001140129552 1046594186 /nfs/dbraw/zinc/59/41/86/1046594186.db2.gz HKDOZEJCQFUBED-GOSISDBHSA-N 1 2 315.388 4.015 20 0 DIADLO C[C@H](Nc1cc[nH+]c2c(Br)cccc12)c1ccc[nH]1 ZINC000760275433 1046595473 /nfs/dbraw/zinc/59/54/73/1046595473.db2.gz YPXPZHKEXXBPNN-JTQLQIEISA-N 1 2 316.202 4.499 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CCC[C@H]2c2ccccc2)cs1 ZINC000245464993 1046606057 /nfs/dbraw/zinc/60/60/57/1046606057.db2.gz IFWUKWKAGLSVEM-CJNGLKHVSA-N 1 2 302.443 4.188 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CCC[C@H]2c2ccccc2)cs1 ZINC000245464993 1046606065 /nfs/dbraw/zinc/60/60/65/1046606065.db2.gz IFWUKWKAGLSVEM-CJNGLKHVSA-N 1 2 302.443 4.188 20 0 DIADLO O=C(CCCc1ccsc1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000783575707 1046610786 /nfs/dbraw/zinc/61/07/86/1046610786.db2.gz YKSUVBMJBSGMNY-UHFFFAOYSA-N 1 2 311.410 4.100 20 0 DIADLO Fc1ccc(F)c2c1CC[N@H+](Cc1nccc3ccccc31)C2 ZINC000678286163 1046613798 /nfs/dbraw/zinc/61/37/98/1046613798.db2.gz FLRUDMLFYUQFNL-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1ccc(F)c2c1CC[N@@H+](Cc1nccc3ccccc31)C2 ZINC000678286163 1046613809 /nfs/dbraw/zinc/61/38/09/1046613809.db2.gz FLRUDMLFYUQFNL-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO C[C@H]1C[N@H+](Cc2ncccc2C(F)(F)F)[C@H]1c1ccccc1 ZINC000678295543 1046615168 /nfs/dbraw/zinc/61/51/68/1046615168.db2.gz HEEGVJAWQCNSNQ-BLLLJJGKSA-N 1 2 306.331 4.293 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ncccc2C(F)(F)F)[C@H]1c1ccccc1 ZINC000678295543 1046615174 /nfs/dbraw/zinc/61/51/74/1046615174.db2.gz HEEGVJAWQCNSNQ-BLLLJJGKSA-N 1 2 306.331 4.293 20 0 DIADLO CC1(C)CC[NH+](CC(=O)Nc2cc(Cl)ccc2Cl)CC1 ZINC000532944321 1046629868 /nfs/dbraw/zinc/62/98/68/1046629868.db2.gz CTCLQRYIGSXJFG-UHFFFAOYSA-N 1 2 315.244 4.054 20 0 DIADLO CCc1nn(C)c(Cl)c1C[N@H+](C)Cc1cc2ccccc2o1 ZINC000093689125 1046635271 /nfs/dbraw/zinc/63/52/71/1046635271.db2.gz KKMXTDCBZPQOMJ-UHFFFAOYSA-N 1 2 317.820 4.014 20 0 DIADLO CCc1nn(C)c(Cl)c1C[N@@H+](C)Cc1cc2ccccc2o1 ZINC000093689125 1046635277 /nfs/dbraw/zinc/63/52/77/1046635277.db2.gz KKMXTDCBZPQOMJ-UHFFFAOYSA-N 1 2 317.820 4.014 20 0 DIADLO CSc1ccc(Cn2nc(C(F)(F)F)c3c[nH+]ccc32)cc1 ZINC000678480858 1046644800 /nfs/dbraw/zinc/64/48/00/1046644800.db2.gz RKEDSIIIANKAME-UHFFFAOYSA-N 1 2 323.343 4.220 20 0 DIADLO C[C@H]1CC[C@H](c2ccccc2)[N@@H+](Cn2ncsc2=S)C1 ZINC000795707353 1046651695 /nfs/dbraw/zinc/65/16/95/1046651695.db2.gz WRPWTNMMYUBOEA-GXTWGEPZSA-N 1 2 305.472 4.105 20 0 DIADLO C[C@H]1CC[C@H](c2ccccc2)[N@H+](Cn2ncsc2=S)C1 ZINC000795707353 1046651692 /nfs/dbraw/zinc/65/16/92/1046651692.db2.gz WRPWTNMMYUBOEA-GXTWGEPZSA-N 1 2 305.472 4.105 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CCc3ccc([C@H]4C[C@H]4C)o3)cc2[nH+]1 ZINC000643247967 1046651982 /nfs/dbraw/zinc/65/19/82/1046651982.db2.gz PQDJSFRSZOABFE-ABAIWWIYSA-N 1 2 323.396 4.159 20 0 DIADLO C[C@@H]1CC[C@@H](c2ccccc2)[N@H+](Cn2ncsc2=S)C1 ZINC000795707357 1046652068 /nfs/dbraw/zinc/65/20/68/1046652068.db2.gz WRPWTNMMYUBOEA-OCCSQVGLSA-N 1 2 305.472 4.105 20 0 DIADLO C[C@@H]1CC[C@@H](c2ccccc2)[N@@H+](Cn2ncsc2=S)C1 ZINC000795707357 1046652076 /nfs/dbraw/zinc/65/20/76/1046652076.db2.gz WRPWTNMMYUBOEA-OCCSQVGLSA-N 1 2 305.472 4.105 20 0 DIADLO C[C@H]1CC[C@@H]([NH2+]Cc2nnc(-c3ccccc3)[nH]2)c2sccc21 ZINC000834741209 1046660498 /nfs/dbraw/zinc/66/04/98/1046660498.db2.gz KTGDCWVJKZOERK-SWLSCSKDSA-N 1 2 324.453 4.261 20 0 DIADLO C[C@H]1CC[C@@H]([NH2+]Cc2nc(-c3ccccc3)n[nH]2)c2sccc21 ZINC000834741209 1046660505 /nfs/dbraw/zinc/66/05/05/1046660505.db2.gz KTGDCWVJKZOERK-SWLSCSKDSA-N 1 2 324.453 4.261 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1ncc(-c2ccccc2)n1C ZINC000834741066 1046660926 /nfs/dbraw/zinc/66/09/26/1046660926.db2.gz JBQGJLNTQPYMQW-OAHLLOKOSA-N 1 2 320.440 4.326 20 0 DIADLO Cc1nn(C[N@@H+]2C[C@@H](C)C[C@@H]2c2ccccc2)c(=S)s1 ZINC000795744227 1046675014 /nfs/dbraw/zinc/67/50/14/1046675014.db2.gz LOHVZGRMNGSMOX-SMDDNHRTSA-N 1 2 305.472 4.023 20 0 DIADLO Cc1nn(C[N@H+]2C[C@@H](C)C[C@@H]2c2ccccc2)c(=S)s1 ZINC000795744227 1046675017 /nfs/dbraw/zinc/67/50/17/1046675017.db2.gz LOHVZGRMNGSMOX-SMDDNHRTSA-N 1 2 305.472 4.023 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1ccc(-c3ccccn3)cc1)C2 ZINC001140380832 1046678942 /nfs/dbraw/zinc/67/89/42/1046678942.db2.gz FWVGIWANYUWBCP-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1ccc(-c3ccccn3)cc1)C2 ZINC001140380832 1046678948 /nfs/dbraw/zinc/67/89/48/1046678948.db2.gz FWVGIWANYUWBCP-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Cc1cc(CNc2[nH+]c3cccc(Cl)c3n2C)cc(Cl)n1 ZINC000795792799 1046679123 /nfs/dbraw/zinc/67/91/23/1046679123.db2.gz WNBOXKXYVKCBAF-UHFFFAOYSA-N 1 2 321.211 4.196 20 0 DIADLO CCCC[C@](C)(F)C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000834845095 1046684792 /nfs/dbraw/zinc/68/47/92/1046684792.db2.gz WSTMHILSRATEPK-KRWDZBQOSA-N 1 2 303.381 4.242 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1noc2c1CCCC2 ZINC000678743713 1046692697 /nfs/dbraw/zinc/69/26/97/1046692697.db2.gz HNSRYSZAAFNTNL-CQSZACIVSA-N 1 2 314.429 4.191 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@H](C)c2nccn2C)c2ccccc2)cc1 ZINC000678763422 1046695103 /nfs/dbraw/zinc/69/51/03/1046695103.db2.gz FQARDPCHISAJOL-VQIMIIECSA-N 1 2 305.425 4.169 20 0 DIADLO CSc1ccc(C)c(NC(=O)NCc2c[nH+]c(C)cc2C)c1 ZINC000455072592 1046699887 /nfs/dbraw/zinc/69/98/87/1046699887.db2.gz LARZAJYVQKNQOC-UHFFFAOYSA-N 1 2 315.442 4.050 20 0 DIADLO c1ccc([C@H](CC2CC2)[NH2+]Cc2nc(C3CCCC3)no2)cc1 ZINC000678778292 1046701313 /nfs/dbraw/zinc/70/13/13/1046701313.db2.gz WAXUNSNTFHOYPZ-KRWDZBQOSA-N 1 2 311.429 4.358 20 0 DIADLO CCc1noc(C[NH2+][C@H](c2cccc(Cl)c2)C2CCCC2)n1 ZINC000678792122 1046701925 /nfs/dbraw/zinc/70/19/25/1046701925.db2.gz GSJLMYVBGVOVEQ-KRWDZBQOSA-N 1 2 319.836 4.307 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+]Cc2coc(CC)n2)cc1 ZINC000834898528 1046709871 /nfs/dbraw/zinc/70/98/71/1046709871.db2.gz LAIRHQULBQQPSD-CQSZACIVSA-N 1 2 302.418 4.267 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2ccc(OCC(C)C)cc2)co1 ZINC000834901601 1046711076 /nfs/dbraw/zinc/71/10/76/1046711076.db2.gz WSWKXJRDRLMINP-AWEZNQCLSA-N 1 2 302.418 4.123 20 0 DIADLO CCc1nc(C[NH2+][C@@H](c2ccccc2)c2ccc(C)cc2)co1 ZINC000834900948 1046711660 /nfs/dbraw/zinc/71/16/60/1046711660.db2.gz XOXQPULIKZHDFK-FQEVSTJZSA-N 1 2 306.409 4.425 20 0 DIADLO CC(C)([NH2+]Cc1cc2ccccc2[nH]1)c1cc(C(F)(F)F)on1 ZINC000644442649 1046715777 /nfs/dbraw/zinc/71/57/77/1046715777.db2.gz RUDGRIZDOHLIKH-UHFFFAOYSA-N 1 2 323.318 4.200 20 0 DIADLO Clc1ccc(C[N@@H+]2CCC=C(c3ccco3)C2)c(Cl)n1 ZINC000796122076 1046717641 /nfs/dbraw/zinc/71/76/41/1046717641.db2.gz ZYVBOQGLSPPEKY-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Clc1ccc(C[N@H+]2CCC=C(c3ccco3)C2)c(Cl)n1 ZINC000796122076 1046717654 /nfs/dbraw/zinc/71/76/54/1046717654.db2.gz ZYVBOQGLSPPEKY-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1c[nH]c3cccc(Cl)c13)C2 ZINC001140436506 1046723836 /nfs/dbraw/zinc/72/38/36/1046723836.db2.gz DYXVSSIEPRIURL-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1c[nH]c3cccc(Cl)c13)C2 ZINC001140436506 1046723850 /nfs/dbraw/zinc/72/38/50/1046723850.db2.gz DYXVSSIEPRIURL-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO CCC[C@H]([NH2+]Cc1csnn1)c1cccc(C(F)(F)F)c1 ZINC000678921542 1046732302 /nfs/dbraw/zinc/73/23/02/1046732302.db2.gz DEXIFWJBMZLCML-ZDUSSCGKSA-N 1 2 315.364 4.188 20 0 DIADLO Fc1cccc(C[NH2+]Cc2csc(-c3ccccc3)n2)c1F ZINC000678930772 1046736272 /nfs/dbraw/zinc/73/62/72/1046736272.db2.gz LUFOEWNOOFIACP-UHFFFAOYSA-N 1 2 316.376 4.378 20 0 DIADLO Cc1c2ccccc2oc1[C@H]([NH2+]Cc1csnn1)C(C)C ZINC000678929809 1046736673 /nfs/dbraw/zinc/73/66/73/1046736673.db2.gz OCZFNOAVLAZOLG-OAHLLOKOSA-N 1 2 301.415 4.080 20 0 DIADLO CC(C)(C)C[C@H]([NH2+]Cc1csnn1)c1ccc(Cl)cc1 ZINC000678936505 1046739087 /nfs/dbraw/zinc/73/90/87/1046739087.db2.gz MUORWWFWFSEIQI-AWEZNQCLSA-N 1 2 309.866 4.459 20 0 DIADLO CC(C)CC[C@@H]([NH2+]Cc1cn(-c2ccccc2)nn1)c1ccoc1 ZINC000796840573 1046744571 /nfs/dbraw/zinc/74/45/71/1046744571.db2.gz YWKHCPZYFTVGHW-LJQANCHMSA-N 1 2 324.428 4.127 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc2c(s1)CCCC2)c1nc(C)cs1 ZINC000678955288 1046745616 /nfs/dbraw/zinc/74/56/16/1046745616.db2.gz LTOQKXNGNLOBJT-MRXNPFEDSA-N 1 2 321.515 4.202 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc([NH+](C)C)cc2)c(C)c1OC ZINC000796901505 1046754443 /nfs/dbraw/zinc/75/44/43/1046754443.db2.gz YIOQTTQJGHUIAY-AWEZNQCLSA-N 1 2 314.429 4.251 20 0 DIADLO COC(=O)c1csc([C@@H](C)Nc2ccc([NH+](C)C)c(C)c2)c1 ZINC000796911718 1046756752 /nfs/dbraw/zinc/75/67/52/1046756752.db2.gz KHBLAZMLBNVYKP-GFCCVEGCSA-N 1 2 318.442 4.082 20 0 DIADLO C[C@H]([NH2+]Cc1cocn1)c1ccc2ccccc2c1OC(F)F ZINC000679048493 1046765550 /nfs/dbraw/zinc/76/55/50/1046765550.db2.gz HRHQDEOPPOZIME-NSHDSACASA-N 1 2 318.323 4.280 20 0 DIADLO Oc1cccc(C[NH2+]C2(c3cccc(Cl)c3)CC2)c1Cl ZINC000645157414 1046768759 /nfs/dbraw/zinc/76/87/59/1046768759.db2.gz DHWWRXNFTIXLIS-UHFFFAOYSA-N 1 2 308.208 4.478 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CCC[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC000455476116 1046769125 /nfs/dbraw/zinc/76/91/25/1046769125.db2.gz LNWPBXSFAUSUGJ-QZTJIDSGSA-N 1 2 323.440 4.465 20 0 DIADLO Fc1cc(Cl)cc(C[N@@H+]2CC[C@H]2COCc2ccccc2)c1 ZINC001140538786 1046770417 /nfs/dbraw/zinc/77/04/17/1046770417.db2.gz LJRTWAQPIJMHOJ-SFHVURJKSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1cc(Cl)cc(C[N@H+]2CC[C@H]2COCc2ccccc2)c1 ZINC001140538786 1046770431 /nfs/dbraw/zinc/77/04/31/1046770431.db2.gz LJRTWAQPIJMHOJ-SFHVURJKSA-N 1 2 319.807 4.270 20 0 DIADLO Cc1cc(C)c(NC(=O)Nc2cccc(OC(C)C)c2)c(C)[nH+]1 ZINC000455494184 1046770994 /nfs/dbraw/zinc/77/09/94/1046770994.db2.gz DKDSKCGHXTXFHL-UHFFFAOYSA-N 1 2 313.401 4.438 20 0 DIADLO Oc1cccc(C[NH2+][C@H](c2ccccc2)c2cccnc2)c1Cl ZINC000645151889 1046771357 /nfs/dbraw/zinc/77/13/57/1046771357.db2.gz CDFUTFOHIAMYJI-LJQANCHMSA-N 1 2 324.811 4.320 20 0 DIADLO Cc1cc(C)c(NC(=O)N([C@@H](C)c2ccco2)C2CC2)c(C)[nH+]1 ZINC000455479304 1046771489 /nfs/dbraw/zinc/77/14/89/1046771489.db2.gz GGBYMZQJYSMSBX-AWEZNQCLSA-N 1 2 313.401 4.357 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2ccc(C(F)F)cc2)c(C)[nH+]1 ZINC000455495409 1046771686 /nfs/dbraw/zinc/77/16/86/1046771686.db2.gz OBGDKDFABWINEH-UHFFFAOYSA-N 1 2 319.355 4.266 20 0 DIADLO Cc1cc(Cl)cc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000645159781 1046771853 /nfs/dbraw/zinc/77/18/53/1046771853.db2.gz OFAXSMWTZBORMI-LLVKDONJSA-N 1 2 307.825 4.180 20 0 DIADLO CCOCc1ccc(NC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000455500661 1046778195 /nfs/dbraw/zinc/77/81/95/1046778195.db2.gz UBBDIHAPTZHKAN-UHFFFAOYSA-N 1 2 313.401 4.187 20 0 DIADLO CC(F)(F)C[NH2+]Cc1ccc(OCc2cccc(F)c2)cc1 ZINC000645196685 1046778177 /nfs/dbraw/zinc/77/81/77/1046778177.db2.gz IMASBWZGVCPKTD-UHFFFAOYSA-N 1 2 309.331 4.150 20 0 DIADLO FC[C@H]1CCC[N@@H+]1Cc1ccc(OC(F)(F)F)c(Cl)c1 ZINC001140559499 1046781087 /nfs/dbraw/zinc/78/10/87/1046781087.db2.gz GQQZQIICPKDDEG-SNVBAGLBSA-N 1 2 311.706 4.173 20 0 DIADLO FC[C@H]1CCC[N@H+]1Cc1ccc(OC(F)(F)F)c(Cl)c1 ZINC001140559499 1046781102 /nfs/dbraw/zinc/78/11/02/1046781102.db2.gz GQQZQIICPKDDEG-SNVBAGLBSA-N 1 2 311.706 4.173 20 0 DIADLO Cc1cc(C)c(NC(=O)NC(C)(C)c2ccccc2C)c(C)[nH+]1 ZINC000455532249 1046781189 /nfs/dbraw/zinc/78/11/89/1046781189.db2.gz SXGAFYFCWAXHOB-UHFFFAOYSA-N 1 2 311.429 4.372 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](c2ccccc2)C(F)F)c(C)[nH+]1 ZINC000455531951 1046782302 /nfs/dbraw/zinc/78/23/02/1046782302.db2.gz SRBXEIDPYVNIRB-HNNXBMFYSA-N 1 2 319.355 4.135 20 0 DIADLO C[N@H+](Cc1cncs1)Cc1cc(Cl)ccc1C(F)(F)F ZINC001140568505 1046788008 /nfs/dbraw/zinc/78/80/08/1046788008.db2.gz IPQIVTMXYLQICQ-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1cncs1)Cc1cc(Cl)ccc1C(F)(F)F ZINC001140568505 1046788019 /nfs/dbraw/zinc/78/80/19/1046788019.db2.gz IPQIVTMXYLQICQ-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@H+](C)[C@H](C)c1ccco1 ZINC000069069278 1046791395 /nfs/dbraw/zinc/79/13/95/1046791395.db2.gz NXGCYHJFSCJAPY-OAHLLOKOSA-N 1 2 314.429 4.343 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+](C)[C@H](C)c1ccco1 ZINC000069069278 1046791407 /nfs/dbraw/zinc/79/14/07/1046791407.db2.gz NXGCYHJFSCJAPY-OAHLLOKOSA-N 1 2 314.429 4.343 20 0 DIADLO CCC1(CC)CCC([NH2+][C@@H](c2cccs2)c2nnc[nH]2)CC1 ZINC000645454819 1046792220 /nfs/dbraw/zinc/79/22/20/1046792220.db2.gz UFYJUGFVCCEOTR-HNNXBMFYSA-N 1 2 318.490 4.294 20 0 DIADLO Clc1ccc(C[N@@H+]2CC[C@H](Oc3ccccc3Cl)C2)nc1 ZINC000679220320 1046792517 /nfs/dbraw/zinc/79/25/17/1046792517.db2.gz YGYOJJHHHVGMPH-AWEZNQCLSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccc(C[N@H+]2CC[C@H](Oc3ccccc3Cl)C2)nc1 ZINC000679220320 1046792526 /nfs/dbraw/zinc/79/25/26/1046792526.db2.gz YGYOJJHHHVGMPH-AWEZNQCLSA-N 1 2 323.223 4.042 20 0 DIADLO Cc1ccc(F)cc1C[NH+](Cc1ccccn1)Cc1ccccn1 ZINC001140588605 1046797935 /nfs/dbraw/zinc/79/79/35/1046797935.db2.gz YETKPMWOJULLKX-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1)[N@H+]1CC=CCC1 ZINC000679322068 1046811234 /nfs/dbraw/zinc/81/12/34/1046811234.db2.gz UGHISOKTISLDLM-INIZCTEOSA-N 1 2 322.408 4.068 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1)[N@@H+]1CC=CCC1 ZINC000679322068 1046811252 /nfs/dbraw/zinc/81/12/52/1046811252.db2.gz UGHISOKTISLDLM-INIZCTEOSA-N 1 2 322.408 4.068 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@@H](C)COc1ccc(C(C)(C)C)cc1 ZINC000679333933 1046813326 /nfs/dbraw/zinc/81/33/26/1046813326.db2.gz WZYOZJSWEBXSEB-UONOGXRCSA-N 1 2 315.461 4.134 20 0 DIADLO FC(F)C(F)(F)C[N@@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000796282215 1046830981 /nfs/dbraw/zinc/83/09/81/1046830981.db2.gz KHMGATQPXUZZNI-MCIONIFRSA-N 1 2 301.327 4.155 20 0 DIADLO FC(F)C(F)(F)C[N@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000796282215 1046831001 /nfs/dbraw/zinc/83/10/01/1046831001.db2.gz KHMGATQPXUZZNI-MCIONIFRSA-N 1 2 301.327 4.155 20 0 DIADLO Cc1cccc2nc(C[NH2+]C3(c4ccccc4Cl)CC3)cn21 ZINC000645976822 1046838650 /nfs/dbraw/zinc/83/86/50/1046838650.db2.gz YBTWWXSNVKXRMG-UHFFFAOYSA-N 1 2 311.816 4.075 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cccc(O)c2Cl)n1 ZINC000646087817 1046853545 /nfs/dbraw/zinc/85/35/45/1046853545.db2.gz GGMBRNRZZJQQCB-OAHLLOKOSA-N 1 2 302.805 4.086 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2cccc(O)c2Cl)n1 ZINC000646087817 1046853564 /nfs/dbraw/zinc/85/35/64/1046853564.db2.gz GGMBRNRZZJQQCB-OAHLLOKOSA-N 1 2 302.805 4.086 20 0 DIADLO COCc1nc(C[NH2+]C2(c3cccc(Cl)c3)CCC2)cs1 ZINC000646095319 1046854773 /nfs/dbraw/zinc/85/47/73/1046854773.db2.gz MJBZUXOACHXDPU-UHFFFAOYSA-N 1 2 322.861 4.112 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccn(C2CCCC2)n1 ZINC000679540899 1046862822 /nfs/dbraw/zinc/86/28/22/1046862822.db2.gz IFZJYYZYVZWAET-CHWSQXEVSA-N 1 2 315.383 4.161 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccn(C2CCCC2)n1 ZINC000679540899 1046862839 /nfs/dbraw/zinc/86/28/39/1046862839.db2.gz IFZJYYZYVZWAET-CHWSQXEVSA-N 1 2 315.383 4.161 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3cc(F)ccc3[C@@H]2C)cc(Cl)n1 ZINC000797592441 1046863337 /nfs/dbraw/zinc/86/33/37/1046863337.db2.gz YGYWHXKKINNOEQ-LBPRGKRZSA-N 1 2 304.796 4.302 20 0 DIADLO Cc1cc(C[N@H+]2CCc3cc(F)ccc3[C@@H]2C)cc(Cl)n1 ZINC000797592441 1046863355 /nfs/dbraw/zinc/86/33/55/1046863355.db2.gz YGYWHXKKINNOEQ-LBPRGKRZSA-N 1 2 304.796 4.302 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cc(-c2ccco2)on1 ZINC000679539444 1046864156 /nfs/dbraw/zinc/86/41/56/1046864156.db2.gz AWXNPOABYUMDLA-MNOVXSKESA-N 1 2 314.307 4.097 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cc(-c2ccco2)on1 ZINC000679539444 1046864178 /nfs/dbraw/zinc/86/41/78/1046864178.db2.gz AWXNPOABYUMDLA-MNOVXSKESA-N 1 2 314.307 4.097 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)n1 ZINC000679546393 1046869667 /nfs/dbraw/zinc/86/96/67/1046869667.db2.gz PMJYSFWGMJACRD-CHWSQXEVSA-N 1 2 317.399 4.407 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)n1 ZINC000679546393 1046869696 /nfs/dbraw/zinc/86/96/96/1046869696.db2.gz PMJYSFWGMJACRD-CHWSQXEVSA-N 1 2 317.399 4.407 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000679583744 1046875232 /nfs/dbraw/zinc/87/52/32/1046875232.db2.gz HCUXNCLUWJMUKM-OCCSQVGLSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000679583744 1046875245 /nfs/dbraw/zinc/87/52/45/1046875245.db2.gz HCUXNCLUWJMUKM-OCCSQVGLSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](Cc1noc(C2CC2)n1)CC1CCC1 ZINC000077372528 1046880195 /nfs/dbraw/zinc/88/01/95/1046880195.db2.gz ZYZVWUMHXKRWGZ-CQSZACIVSA-N 1 2 311.429 4.310 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](Cc1noc(C2CC2)n1)CC1CCC1 ZINC000077372528 1046880215 /nfs/dbraw/zinc/88/02/15/1046880215.db2.gz ZYZVWUMHXKRWGZ-CQSZACIVSA-N 1 2 311.429 4.310 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]C1CSC1)c1ccccc1Cl ZINC000679626423 1046887080 /nfs/dbraw/zinc/88/70/80/1046887080.db2.gz ZOQDHIYAYUBTOD-KRWDZBQOSA-N 1 2 319.857 4.143 20 0 DIADLO FC(F)O[C@H]1CCC[N@H+](Cc2ncc(-c3ccccc3)s2)C1 ZINC000679678408 1046892055 /nfs/dbraw/zinc/89/20/55/1046892055.db2.gz AYFWUZSHHGMNEY-ZDUSSCGKSA-N 1 2 324.396 4.014 20 0 DIADLO FC(F)O[C@H]1CCC[N@@H+](Cc2ncc(-c3ccccc3)s2)C1 ZINC000679678408 1046892063 /nfs/dbraw/zinc/89/20/63/1046892063.db2.gz AYFWUZSHHGMNEY-ZDUSSCGKSA-N 1 2 324.396 4.014 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2[nH+]1 ZINC000010895987 1046901698 /nfs/dbraw/zinc/90/16/98/1046901698.db2.gz UNGRCRKBRMFJHT-UHFFFAOYSA-N 1 2 307.397 4.421 20 0 DIADLO CCc1cc(N2CCCC[C@@H]2c2ccccc2OC)nc(C)[nH+]1 ZINC000679839331 1046906364 /nfs/dbraw/zinc/90/63/64/1046906364.db2.gz XYIJFIGKJKFENZ-QGZVFWFLSA-N 1 2 311.429 4.088 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H]3CC[C@H]4CCCC[C@H]4C3)cc2[nH+]1 ZINC001137392754 1046911554 /nfs/dbraw/zinc/91/15/54/1046911554.db2.gz IRPNEXMZIZNKQJ-QLFBSQMISA-N 1 2 311.429 4.416 20 0 DIADLO Cc1cc(Br)ccc1C[N@@H+]1CCCC[C@H](F)C1 ZINC001140815596 1046914366 /nfs/dbraw/zinc/91/43/66/1046914366.db2.gz YGABZIUXLUNWPJ-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cc(Br)ccc1C[N@H+]1CCCC[C@H](F)C1 ZINC001140815596 1046914374 /nfs/dbraw/zinc/91/43/74/1046914374.db2.gz YGABZIUXLUNWPJ-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cn1ccc(-c2ccccc2)n1 ZINC000303365768 1046914898 /nfs/dbraw/zinc/91/48/98/1046914898.db2.gz IPEIGJXLHPVUNG-UHFFFAOYSA-N 1 2 321.424 4.038 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cn1ccc(-c2ccccc2)n1 ZINC000303365768 1046914908 /nfs/dbraw/zinc/91/49/08/1046914908.db2.gz IPEIGJXLHPVUNG-UHFFFAOYSA-N 1 2 321.424 4.038 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+][C@H](C)c1ncc(-c2ccccc2)o1 ZINC000679943123 1046916221 /nfs/dbraw/zinc/91/62/21/1046916221.db2.gz BWJRFQLPUMNGDN-LSDHHAIUSA-N 1 2 307.397 4.457 20 0 DIADLO COc1cc(F)c(C[N@H+]2Cc3ccccc3[C@H](C)C2)c(F)c1 ZINC001140823330 1046916320 /nfs/dbraw/zinc/91/63/20/1046916320.db2.gz CHRMTATVZINNAG-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c(F)c1 ZINC001140823330 1046916330 /nfs/dbraw/zinc/91/63/30/1046916330.db2.gz CHRMTATVZINNAG-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+][C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000679943109 1046917000 /nfs/dbraw/zinc/91/70/00/1046917000.db2.gz BWJRFQLPUMNGDN-CABCVRRESA-N 1 2 307.397 4.457 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2c(F)cc(OC)cc2F)cc1 ZINC001140827623 1046918250 /nfs/dbraw/zinc/91/82/50/1046918250.db2.gz FXINDQFNQVVNPF-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2c(F)cc(OC)cc2F)cc1 ZINC001140827623 1046918262 /nfs/dbraw/zinc/91/82/62/1046918262.db2.gz FXINDQFNQVVNPF-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO Fc1cccc(C2([NH2+][C@@H]3COCc4cccc(Cl)c43)CC2)c1 ZINC000798182958 1046933608 /nfs/dbraw/zinc/93/36/08/1046933608.db2.gz KLQZBPCJSVWJMG-MRXNPFEDSA-N 1 2 317.791 4.329 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1ccc(Cl)s1 ZINC000680041673 1046937296 /nfs/dbraw/zinc/93/72/96/1046937296.db2.gz MEQWUUCWWSNYKN-GMSGAONNSA-N 1 2 315.772 4.464 20 0 DIADLO Nc1cccc(F)c1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001140877781 1046939832 /nfs/dbraw/zinc/93/98/32/1046939832.db2.gz UICFPMVBNMERHC-QGZVFWFLSA-N 1 2 306.331 4.023 20 0 DIADLO Nc1cccc(F)c1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001140877781 1046939837 /nfs/dbraw/zinc/93/98/37/1046939837.db2.gz UICFPMVBNMERHC-QGZVFWFLSA-N 1 2 306.331 4.023 20 0 DIADLO Cc1ccccc1[C@@H](C)CC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000261455023 1046941231 /nfs/dbraw/zinc/94/12/31/1046941231.db2.gz QWBKKIDXBGHSEY-INIZCTEOSA-N 1 2 319.408 4.313 20 0 DIADLO C[C@]1(F)CCC[N@H+](Cc2ccc(OC(F)(F)F)c(F)c2)C1 ZINC001140885933 1046941461 /nfs/dbraw/zinc/94/14/61/1046941461.db2.gz LJJJJRSGNLEIFX-ZDUSSCGKSA-N 1 2 309.278 4.048 20 0 DIADLO C[C@]1(F)CCC[N@@H+](Cc2ccc(OC(F)(F)F)c(F)c2)C1 ZINC001140885933 1046941469 /nfs/dbraw/zinc/94/14/69/1046941469.db2.gz LJJJJRSGNLEIFX-ZDUSSCGKSA-N 1 2 309.278 4.048 20 0 DIADLO CC/C=C(/C)C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000798268532 1046941823 /nfs/dbraw/zinc/94/18/23/1046941823.db2.gz XPMKMGUGEJJOAI-ZSOIEALJSA-N 1 2 309.413 4.181 20 0 DIADLO [NH3+][C@H](c1nc(C2CCCCCC2)no1)c1cccc(Cl)c1 ZINC000647121498 1046942126 /nfs/dbraw/zinc/94/21/26/1046942126.db2.gz SAJJVAJZANXXRV-AWEZNQCLSA-N 1 2 305.809 4.209 20 0 DIADLO CCc1nnc(C[N@H+](Cc2cccc(F)c2)C2CCCC2)s1 ZINC000680063230 1046943916 /nfs/dbraw/zinc/94/39/16/1046943916.db2.gz JZRVKXYVKPCURS-UHFFFAOYSA-N 1 2 319.449 4.184 20 0 DIADLO CCc1nnc(C[N@@H+](Cc2cccc(F)c2)C2CCCC2)s1 ZINC000680063230 1046943927 /nfs/dbraw/zinc/94/39/27/1046943927.db2.gz JZRVKXYVKPCURS-UHFFFAOYSA-N 1 2 319.449 4.184 20 0 DIADLO CCc1nnc(C[N@H+](C2CC2)[C@@H]2CCCc3ccccc32)s1 ZINC000680062454 1046944935 /nfs/dbraw/zinc/94/49/35/1046944935.db2.gz NZYLMLALJNPLPI-MRXNPFEDSA-N 1 2 313.470 4.143 20 0 DIADLO CCc1nnc(C[N@@H+](C2CC2)[C@@H]2CCCc3ccccc32)s1 ZINC000680062454 1046944943 /nfs/dbraw/zinc/94/49/43/1046944943.db2.gz NZYLMLALJNPLPI-MRXNPFEDSA-N 1 2 313.470 4.143 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2ccc(-c3cccnc3)cc2)s1 ZINC000680075883 1046946614 /nfs/dbraw/zinc/94/66/14/1046946614.db2.gz PWZUZGQJQLCOJG-CYBMUJFWSA-N 1 2 324.453 4.013 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c(F)c1F ZINC001140894016 1046946553 /nfs/dbraw/zinc/94/65/53/1046946553.db2.gz NWJCNRHNKINSKO-AWEZNQCLSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c(F)c1F ZINC001140894016 1046946560 /nfs/dbraw/zinc/94/65/60/1046946560.db2.gz NWJCNRHNKINSKO-AWEZNQCLSA-N 1 2 307.315 4.147 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnccc2C(F)(F)F)Cc2ccccc21 ZINC001140915626 1046948258 /nfs/dbraw/zinc/94/82/58/1046948258.db2.gz ORTROJPWGPMPQU-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnccc2C(F)(F)F)Cc2ccccc21 ZINC001140915626 1046948270 /nfs/dbraw/zinc/94/82/70/1046948270.db2.gz ORTROJPWGPMPQU-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1cnccc1C(F)(F)F ZINC001140919971 1046950211 /nfs/dbraw/zinc/95/02/11/1046950211.db2.gz IPJPSZHZQTWQMK-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1cnccc1C(F)(F)F ZINC001140919971 1046950221 /nfs/dbraw/zinc/95/02/21/1046950221.db2.gz IPJPSZHZQTWQMK-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO Cc1cc2c(cn1)C[N@H+](Cc1ccc(OC(F)(F)F)cc1C)C2 ZINC001140966006 1046965008 /nfs/dbraw/zinc/96/50/08/1046965008.db2.gz PNDBVXRLFQBMCR-UHFFFAOYSA-N 1 2 322.330 4.113 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+](Cc1ccc(OC(F)(F)F)cc1C)C2 ZINC001140966006 1046965013 /nfs/dbraw/zinc/96/50/13/1046965013.db2.gz PNDBVXRLFQBMCR-UHFFFAOYSA-N 1 2 322.330 4.113 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1cccc(-c3ncccn3)c1)C2 ZINC001140980704 1046968877 /nfs/dbraw/zinc/96/88/77/1046968877.db2.gz IGQJCJLOZGOTKR-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1cccc(-c3ncccn3)c1)C2 ZINC001140980704 1046968880 /nfs/dbraw/zinc/96/88/80/1046968880.db2.gz IGQJCJLOZGOTKR-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Fc1cc2c(c(F)c1)[C@H]([NH2+][C@H]1CCSc3ccccc31)CO2 ZINC000680354886 1046971807 /nfs/dbraw/zinc/97/18/07/1046971807.db2.gz KCIAXVHCJHWPPE-UONOGXRCSA-N 1 2 319.376 4.225 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3c(C)noc3C)cs2)o1 ZINC000680381614 1046977497 /nfs/dbraw/zinc/97/74/97/1046977497.db2.gz URMKAZASQYBUTL-JTQLQIEISA-N 1 2 317.414 4.167 20 0 DIADLO c1coc(C[N@@H+]2CCSC[C@H]2c2cccc3ccccc32)n1 ZINC001141012584 1046978552 /nfs/dbraw/zinc/97/85/52/1046978552.db2.gz RDFDVODSGJKFOG-KRWDZBQOSA-N 1 2 310.422 4.118 20 0 DIADLO c1coc(C[N@H+]2CCSC[C@H]2c2cccc3ccccc32)n1 ZINC001141012584 1046978558 /nfs/dbraw/zinc/97/85/58/1046978558.db2.gz RDFDVODSGJKFOG-KRWDZBQOSA-N 1 2 310.422 4.118 20 0 DIADLO c1coc(C[N@@H+]2CCSC[C@@H]2c2cccc3ccccc32)n1 ZINC001141012585 1046979538 /nfs/dbraw/zinc/97/95/38/1046979538.db2.gz RDFDVODSGJKFOG-QGZVFWFLSA-N 1 2 310.422 4.118 20 0 DIADLO c1coc(C[N@H+]2CCSC[C@@H]2c2cccc3ccccc32)n1 ZINC001141012585 1046979544 /nfs/dbraw/zinc/97/95/44/1046979544.db2.gz RDFDVODSGJKFOG-QGZVFWFLSA-N 1 2 310.422 4.118 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2cc(Cl)cc3c2OCC3)c(C)s1 ZINC000680469318 1046985853 /nfs/dbraw/zinc/98/58/53/1046985853.db2.gz CPNLCGXDDVILEH-VIFPVBQESA-N 1 2 322.861 4.199 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2c(Cl)oc3ccccc32)cn1 ZINC000680480679 1046988186 /nfs/dbraw/zinc/98/81/86/1046988186.db2.gz KYMZWSPCVMCMBV-UHFFFAOYSA-N 1 2 316.788 4.122 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2c(Cl)oc3ccccc32)cn1 ZINC000680480679 1046988193 /nfs/dbraw/zinc/98/81/93/1046988193.db2.gz KYMZWSPCVMCMBV-UHFFFAOYSA-N 1 2 316.788 4.122 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000798930858 1046988769 /nfs/dbraw/zinc/98/87/69/1046988769.db2.gz BHQBIEKKDMAPMO-YQVWRLOYSA-N 1 2 314.473 4.294 20 0 DIADLO c1cc(N2CCCC2)ccc1[NH2+][C@@H]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000798930858 1046988781 /nfs/dbraw/zinc/98/87/81/1046988781.db2.gz BHQBIEKKDMAPMO-YQVWRLOYSA-N 1 2 314.473 4.294 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000798930857 1046989123 /nfs/dbraw/zinc/98/91/23/1046989123.db2.gz BHQBIEKKDMAPMO-JENIJYKNSA-N 1 2 314.473 4.294 20 0 DIADLO c1cc(N2CCCC2)ccc1[NH2+][C@@H]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000798930857 1046989126 /nfs/dbraw/zinc/98/91/26/1046989126.db2.gz BHQBIEKKDMAPMO-JENIJYKNSA-N 1 2 314.473 4.294 20 0 DIADLO CN(C)c1[nH+]ccc2cc(NC(=O)C3=CCCCCC3)ccc21 ZINC001141050111 1046991033 /nfs/dbraw/zinc/99/10/33/1046991033.db2.gz DRYPBPCTPGPEGU-UHFFFAOYSA-N 1 2 309.413 4.130 20 0 DIADLO Cn1nc(C[NH2+]Cc2cc(Cl)ccc2Cl)c2ccccc21 ZINC000680545967 1046992319 /nfs/dbraw/zinc/99/23/19/1046992319.db2.gz QPTRHWBMKQVAGP-UHFFFAOYSA-N 1 2 320.223 4.170 20 0 DIADLO FC1(F)CC[C@H](Nc2[nH+]cccc2OCc2ccccc2)C1 ZINC000680621890 1046995701 /nfs/dbraw/zinc/99/57/01/1046995701.db2.gz KPRFQFUFMDOKAP-AWEZNQCLSA-N 1 2 304.340 4.260 20 0 DIADLO CCCCc1[nH]cc(CN2CCC[C@H]2c2ccc(F)cc2F)[nH+]1 ZINC001141071127 1046995844 /nfs/dbraw/zinc/99/58/44/1046995844.db2.gz CLAVXSCOXBKWKM-KRWDZBQOSA-N 1 2 319.399 4.368 20 0 DIADLO CCCCc1[nH]c(CN2CCC[C@H]2c2ccc(F)cc2F)c[nH+]1 ZINC001141071127 1046995852 /nfs/dbraw/zinc/99/58/52/1046995852.db2.gz CLAVXSCOXBKWKM-KRWDZBQOSA-N 1 2 319.399 4.368 20 0 DIADLO CCCCc1[nH]cc(CN2CCC[C@H]2c2cc(F)ccc2F)[nH+]1 ZINC001141070320 1046996024 /nfs/dbraw/zinc/99/60/24/1046996024.db2.gz USARMZMRMWVLOB-KRWDZBQOSA-N 1 2 319.399 4.368 20 0 DIADLO CCCCc1[nH]c(CN2CCC[C@H]2c2cc(F)ccc2F)c[nH+]1 ZINC001141070320 1046996034 /nfs/dbraw/zinc/99/60/34/1046996034.db2.gz USARMZMRMWVLOB-KRWDZBQOSA-N 1 2 319.399 4.368 20 0 DIADLO Cc1cccc(C[NH+]2Cc3ccccc3C2)c1Br ZINC001141089225 1047005156 /nfs/dbraw/zinc/00/51/56/1047005156.db2.gz MWUGGEBFFKQNTJ-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO CC[N@H+](Cc1c(Cl)nc(Cl)cc1C(F)(F)F)C1CC1 ZINC001141097678 1047013957 /nfs/dbraw/zinc/01/39/57/1047013957.db2.gz VIYASOTVFKYREG-UHFFFAOYSA-N 1 2 313.150 4.392 20 0 DIADLO CC[N@@H+](Cc1c(Cl)nc(Cl)cc1C(F)(F)F)C1CC1 ZINC001141097678 1047013972 /nfs/dbraw/zinc/01/39/72/1047013972.db2.gz VIYASOTVFKYREG-UHFFFAOYSA-N 1 2 313.150 4.392 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CCC=C(Br)C2)cc1 ZINC000799327272 1047018895 /nfs/dbraw/zinc/01/88/95/1047018895.db2.gz NOUBCIBOFIKBTP-UHFFFAOYSA-N 1 2 302.162 4.109 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CCC=C(Br)C2)cc1 ZINC000799327272 1047018906 /nfs/dbraw/zinc/01/89/06/1047018906.db2.gz NOUBCIBOFIKBTP-UHFFFAOYSA-N 1 2 302.162 4.109 20 0 DIADLO C[C@H]1CCCC[C@@H]1c1noc(-c2cccc(Cn3cc[nH+]c3)c2)n1 ZINC000680740279 1047024398 /nfs/dbraw/zinc/02/43/98/1047024398.db2.gz LSBQQAIOTQLSJF-YOEHRIQHSA-N 1 2 322.412 4.275 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ncc(C(C)C)s2)CC2CC2)cn1 ZINC000648057788 1047031058 /nfs/dbraw/zinc/03/10/58/1047031058.db2.gz OZSUDELROXLCBL-UHFFFAOYSA-N 1 2 315.486 4.382 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ncc(C(C)C)s2)CC2CC2)cn1 ZINC000648057788 1047031067 /nfs/dbraw/zinc/03/10/67/1047031067.db2.gz OZSUDELROXLCBL-UHFFFAOYSA-N 1 2 315.486 4.382 20 0 DIADLO CCc1noc(C)c1C[N@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000162796153 1047034519 /nfs/dbraw/zinc/03/45/19/1047034519.db2.gz WBGKSRAEFFWJFR-LRDDRELGSA-N 1 2 314.429 4.426 20 0 DIADLO CCc1noc(C)c1C[N@@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000162796153 1047034532 /nfs/dbraw/zinc/03/45/32/1047034532.db2.gz WBGKSRAEFFWJFR-LRDDRELGSA-N 1 2 314.429 4.426 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc3c(c1)CCC(C)(C)O3)C2 ZINC001141183325 1047039411 /nfs/dbraw/zinc/03/94/11/1047039411.db2.gz ADGARPPGFVOLNP-UHFFFAOYSA-N 1 2 323.436 4.315 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc3c(c1)CCC(C)(C)O3)C2 ZINC001141183325 1047039425 /nfs/dbraw/zinc/03/94/25/1047039425.db2.gz ADGARPPGFVOLNP-UHFFFAOYSA-N 1 2 323.436 4.315 20 0 DIADLO CC[C@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)C[C@@H](C)O1 ZINC000536654381 1047045677 /nfs/dbraw/zinc/04/56/77/1047045677.db2.gz PPHFHDKXCODYHJ-HIFRSBDPSA-N 1 2 308.491 4.190 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)C[C@@H](C)O1 ZINC000536654381 1047045690 /nfs/dbraw/zinc/04/56/90/1047045690.db2.gz PPHFHDKXCODYHJ-HIFRSBDPSA-N 1 2 308.491 4.190 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cccc(-c2ccc(F)cc2)n1 ZINC001141209130 1047047790 /nfs/dbraw/zinc/04/77/90/1047047790.db2.gz QRCIWIGDPGXGLO-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cccc(-c2ccc(F)cc2)n1 ZINC001141209130 1047047799 /nfs/dbraw/zinc/04/77/99/1047047799.db2.gz QRCIWIGDPGXGLO-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO COc1cccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1F ZINC001141222939 1047051000 /nfs/dbraw/zinc/05/10/00/1047051000.db2.gz CCOXSANPUDTINE-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1F ZINC001141222939 1047051017 /nfs/dbraw/zinc/05/10/17/1047051017.db2.gz CCOXSANPUDTINE-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H]1Cc2[nH]c3ccccc3c2C1 ZINC000799720990 1047055276 /nfs/dbraw/zinc/05/52/76/1047055276.db2.gz PDBHUWGJCPGGHP-CQSZACIVSA-N 1 2 305.425 4.122 20 0 DIADLO COc1ccc(OC)c(CNc2[nH+]c3ccccc3n2C2CC2)c1 ZINC000680852644 1047055912 /nfs/dbraw/zinc/05/59/12/1047055912.db2.gz MEMKRSXCWYXJSC-UHFFFAOYSA-N 1 2 323.396 4.001 20 0 DIADLO C[N@H+](Cc1cc[nH]n1)Cc1ccc(Sc2ccccc2)cc1 ZINC000536674340 1047067802 /nfs/dbraw/zinc/06/78/02/1047067802.db2.gz NOURRFMDZHTVEV-UHFFFAOYSA-N 1 2 309.438 4.193 20 0 DIADLO C[N@@H+](Cc1cc[nH]n1)Cc1ccc(Sc2ccccc2)cc1 ZINC000536674340 1047067814 /nfs/dbraw/zinc/06/78/14/1047067814.db2.gz NOURRFMDZHTVEV-UHFFFAOYSA-N 1 2 309.438 4.193 20 0 DIADLO Brc1csc(C[N@@H+]2CCc3ccsc3C2)c1 ZINC000536680582 1047069343 /nfs/dbraw/zinc/06/93/43/1047069343.db2.gz VMBSDRAUFYOVRY-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO Brc1csc(C[N@H+]2CCc3ccsc3C2)c1 ZINC000536680582 1047069354 /nfs/dbraw/zinc/06/93/54/1047069354.db2.gz VMBSDRAUFYOVRY-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1nccc2ccccc21 ZINC000680961410 1047072081 /nfs/dbraw/zinc/07/20/81/1047072081.db2.gz HGBRGFTWWHZEPH-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO C[N@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1cc2ccccc2o1 ZINC000536698057 1047075882 /nfs/dbraw/zinc/07/58/82/1047075882.db2.gz NZGQCNPZNAWQOM-UHFFFAOYSA-N 1 2 317.392 4.455 20 0 DIADLO C[N@@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1cc2ccccc2o1 ZINC000536698057 1047075899 /nfs/dbraw/zinc/07/58/99/1047075899.db2.gz NZGQCNPZNAWQOM-UHFFFAOYSA-N 1 2 317.392 4.455 20 0 DIADLO C[N@@H+](Cc1c[nH]c(-c2ccccc2)n1)Cc1cc2ccccc2o1 ZINC000536698057 1047075915 /nfs/dbraw/zinc/07/59/15/1047075915.db2.gz NZGQCNPZNAWQOM-UHFFFAOYSA-N 1 2 317.392 4.455 20 0 DIADLO C[N@H+](Cc1c[nH]c(-c2ccccc2)n1)Cc1cc2ccccc2o1 ZINC000536698057 1047075929 /nfs/dbraw/zinc/07/59/29/1047075929.db2.gz NZGQCNPZNAWQOM-UHFFFAOYSA-N 1 2 317.392 4.455 20 0 DIADLO CCc1ccc(C2=CC[N@H+](Cc3ncc(C4CC4)o3)CC2)cc1 ZINC000536745145 1047089144 /nfs/dbraw/zinc/08/91/44/1047089144.db2.gz GXRMUHDHFRWSQU-UHFFFAOYSA-N 1 2 308.425 4.404 20 0 DIADLO CCc1ccc(C2=CC[N@@H+](Cc3ncc(C4CC4)o3)CC2)cc1 ZINC000536745145 1047089159 /nfs/dbraw/zinc/08/91/59/1047089159.db2.gz GXRMUHDHFRWSQU-UHFFFAOYSA-N 1 2 308.425 4.404 20 0 DIADLO C[C@@H](O)[C@H]1CCC[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC000681082751 1047092476 /nfs/dbraw/zinc/09/24/76/1047092476.db2.gz OQAFHGJDAVQRPH-ZJUUUORDSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H](O)[C@H]1CCC[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC000681082751 1047092489 /nfs/dbraw/zinc/09/24/89/1047092489.db2.gz OQAFHGJDAVQRPH-ZJUUUORDSA-N 1 2 322.663 4.240 20 0 DIADLO c1coc([C@H]2[N@H+](Cc3cnc(C4CC4)s3)CC23CCC3)c1 ZINC000648801755 1047092931 /nfs/dbraw/zinc/09/29/31/1047092931.db2.gz ZHAUPFBGKRWHBO-OAHLLOKOSA-N 1 2 300.427 4.341 20 0 DIADLO c1coc([C@H]2[N@@H+](Cc3cnc(C4CC4)s3)CC23CCC3)c1 ZINC000648801755 1047092947 /nfs/dbraw/zinc/09/29/47/1047092947.db2.gz ZHAUPFBGKRWHBO-OAHLLOKOSA-N 1 2 300.427 4.341 20 0 DIADLO CC(C)=CCC[C@H](C)CC(=O)N1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000648823869 1047094750 /nfs/dbraw/zinc/09/47/50/1047094750.db2.gz VZDAZRVDCXFYQM-OKZBNKHCSA-N 1 2 317.477 4.065 20 0 DIADLO CC(C)=CCC[C@H](C)CC(=O)N1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000648823868 1047094858 /nfs/dbraw/zinc/09/48/58/1047094858.db2.gz VZDAZRVDCXFYQM-KSZLIROESA-N 1 2 317.477 4.065 20 0 DIADLO COc1cc(Cl)ncc1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001141341428 1047100324 /nfs/dbraw/zinc/10/03/24/1047100324.db2.gz BTHQZXSBAZSSRG-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(Cl)ncc1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001141341428 1047100328 /nfs/dbraw/zinc/10/03/28/1047100328.db2.gz BTHQZXSBAZSSRG-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccsc1[C@H](C)[NH2+]Cc1c(F)c(F)cc(F)c1F ZINC000681139603 1047101862 /nfs/dbraw/zinc/10/18/62/1047101862.db2.gz LWYPSWHTNIXIQO-ZETCQYMHSA-N 1 2 319.323 4.164 20 0 DIADLO c1csc([C@H]2CSCC[N@H+]2Cc2ccccc2C2CC2)n1 ZINC000681168051 1047104338 /nfs/dbraw/zinc/10/43/38/1047104338.db2.gz IAFDSWINKAHHPU-MRXNPFEDSA-N 1 2 316.495 4.311 20 0 DIADLO c1csc([C@H]2CSCC[N@@H+]2Cc2ccccc2C2CC2)n1 ZINC000681168051 1047104347 /nfs/dbraw/zinc/10/43/47/1047104347.db2.gz IAFDSWINKAHHPU-MRXNPFEDSA-N 1 2 316.495 4.311 20 0 DIADLO COc1cccc(C[N@@H+](Cc2ncc(Cl)s2)CC(C)C)c1 ZINC000681165106 1047105272 /nfs/dbraw/zinc/10/52/72/1047105272.db2.gz WALYVHJXDATNNX-UHFFFAOYSA-N 1 2 324.877 4.463 20 0 DIADLO COc1cccc(C[N@H+](Cc2ncc(Cl)s2)CC(C)C)c1 ZINC000681165106 1047105279 /nfs/dbraw/zinc/10/52/79/1047105279.db2.gz WALYVHJXDATNNX-UHFFFAOYSA-N 1 2 324.877 4.463 20 0 DIADLO Cc1cnc(Nc2cccc3cc[nH+]cc32)c(Br)c1 ZINC000097846487 1047116681 /nfs/dbraw/zinc/11/66/81/1047116681.db2.gz ODUGDISFXCFQNX-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO Fc1cccc2c1CC[C@H]2[N@@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC001116188374 1047116974 /nfs/dbraw/zinc/11/69/74/1047116974.db2.gz YVCSMKVABIFZTC-RTBURBONSA-N 1 2 315.363 4.026 20 0 DIADLO Fc1cccc2c1CC[C@H]2[N@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC001116188374 1047116980 /nfs/dbraw/zinc/11/69/80/1047116980.db2.gz YVCSMKVABIFZTC-RTBURBONSA-N 1 2 315.363 4.026 20 0 DIADLO CCN(C[C@@H]1CCOC1)c1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000649307039 1047121399 /nfs/dbraw/zinc/12/13/99/1047121399.db2.gz KYJQCJIDQHOFEN-LBPRGKRZSA-N 1 2 324.346 4.116 20 0 DIADLO CCc1ncc(C[N@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)o1 ZINC000929114796 1047125736 /nfs/dbraw/zinc/12/57/36/1047125736.db2.gz AJDGIGVBUKNBPD-WBMJQRKESA-N 1 2 300.402 4.118 20 0 DIADLO CCc1ncc(C[N@@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)o1 ZINC000929114796 1047125739 /nfs/dbraw/zinc/12/57/39/1047125739.db2.gz AJDGIGVBUKNBPD-WBMJQRKESA-N 1 2 300.402 4.118 20 0 DIADLO CCc1ncc(C[N@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC000929114792 1047125778 /nfs/dbraw/zinc/12/57/78/1047125778.db2.gz AJDGIGVBUKNBPD-BLLLJJGKSA-N 1 2 300.402 4.118 20 0 DIADLO CCc1ncc(C[N@@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC000929114792 1047125784 /nfs/dbraw/zinc/12/57/84/1047125784.db2.gz AJDGIGVBUKNBPD-BLLLJJGKSA-N 1 2 300.402 4.118 20 0 DIADLO Cc1nc(C(F)(F)F)ccc1C[N@@H+](C)Cc1ccccc1F ZINC001141430800 1047130236 /nfs/dbraw/zinc/13/02/36/1047130236.db2.gz NNYKGDDIIKZWLW-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1nc(C(F)(F)F)ccc1C[N@H+](C)Cc1ccccc1F ZINC001141430800 1047130243 /nfs/dbraw/zinc/13/02/43/1047130243.db2.gz NNYKGDDIIKZWLW-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO CC(C)Sc1ccc([C@@H](C)[NH2+]Cc2nnc(C3CC3)o2)cc1 ZINC000537102534 1047136592 /nfs/dbraw/zinc/13/65/92/1047136592.db2.gz HBOYVWPUIWGIGO-GFCCVEGCSA-N 1 2 317.458 4.298 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+](C)Cc1cc2n(n1)CCCC2 ZINC000649489854 1047138174 /nfs/dbraw/zinc/13/81/74/1047138174.db2.gz JPJMSVPEIQTIRL-CYBMUJFWSA-N 1 2 303.837 4.066 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1cc2n(n1)CCCC2 ZINC000649489854 1047138179 /nfs/dbraw/zinc/13/81/79/1047138179.db2.gz JPJMSVPEIQTIRL-CYBMUJFWSA-N 1 2 303.837 4.066 20 0 DIADLO C[C@@H]([NH2+]Cc1cc2n(n1)CCCC2)c1cc(Cl)ccc1Cl ZINC000649573770 1047147456 /nfs/dbraw/zinc/14/74/56/1047147456.db2.gz PEAKMYIEDYQTAV-LLVKDONJSA-N 1 2 324.255 4.377 20 0 DIADLO Cc1ccc(N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)c(C)[nH+]1 ZINC001116496229 1047150130 /nfs/dbraw/zinc/15/01/30/1047150130.db2.gz WYTFSSVJVRQLPL-CYBMUJFWSA-N 1 2 324.428 4.155 20 0 DIADLO CC1(O)CCC(Nc2[nH+]ccc3cc(C(F)(F)F)ccc32)CC1 ZINC000827726574 1047150464 /nfs/dbraw/zinc/15/04/64/1047150464.db2.gz ZLPCUOCLGGEFQU-UHFFFAOYSA-N 1 2 324.346 4.359 20 0 DIADLO COCc1cnc(C[N@H+](C)Cc2ccc(C(C)C)cc2)s1 ZINC000537206777 1047150756 /nfs/dbraw/zinc/15/07/56/1047150756.db2.gz UUFYGAKVOUBKRW-UHFFFAOYSA-N 1 2 304.459 4.045 20 0 DIADLO COCc1cnc(C[N@@H+](C)Cc2ccc(C(C)C)cc2)s1 ZINC000537206777 1047150763 /nfs/dbraw/zinc/15/07/63/1047150763.db2.gz UUFYGAKVOUBKRW-UHFFFAOYSA-N 1 2 304.459 4.045 20 0 DIADLO CCCCN(C(=O)C[C@H](C)n1cc[nH+]c1)[C@H](C)c1ccc(C)o1 ZINC000649595024 1047150887 /nfs/dbraw/zinc/15/08/87/1047150887.db2.gz YFYJQWLPENMZNR-GOEBONIOSA-N 1 2 317.433 4.126 20 0 DIADLO CC[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1cccc(Cl)c1 ZINC001141514855 1047154731 /nfs/dbraw/zinc/15/47/31/1047154731.db2.gz GSHUSEQCQXJRBM-AWEZNQCLSA-N 1 2 313.788 4.097 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCOc2c(Cl)cccc21)c1cscn1 ZINC000537305067 1047162807 /nfs/dbraw/zinc/16/28/07/1047162807.db2.gz AQKAWPCHQPUWSY-MFKMUULPSA-N 1 2 308.834 4.361 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@@H+]([C@H](C)c2c(F)cccc2F)C1 ZINC000682038639 1047163785 /nfs/dbraw/zinc/16/37/85/1047163785.db2.gz DYUQCZIYXSRUTR-QMTHXVAHSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@H+]([C@H](C)c2c(F)cccc2F)C1 ZINC000682038639 1047163788 /nfs/dbraw/zinc/16/37/88/1047163788.db2.gz DYUQCZIYXSRUTR-QMTHXVAHSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@@H+]([C@@H](C)c2ccc(F)cc2F)C1 ZINC000682042751 1047164569 /nfs/dbraw/zinc/16/45/69/1047164569.db2.gz ZKHRXCFYPALMOB-IINYFYTJSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@H+]([C@@H](C)c2ccc(F)cc2F)C1 ZINC000682042751 1047164575 /nfs/dbraw/zinc/16/45/75/1047164575.db2.gz ZKHRXCFYPALMOB-IINYFYTJSA-N 1 2 323.305 4.069 20 0 DIADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1nc(-c2ccccc2)oc1C ZINC000649722124 1047167045 /nfs/dbraw/zinc/16/70/45/1047167045.db2.gz IQIFUDFRWOUJMW-SJORKVTESA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1nc(-c2ccccc2)oc1C ZINC000649722124 1047167048 /nfs/dbraw/zinc/16/70/48/1047167048.db2.gz IQIFUDFRWOUJMW-SJORKVTESA-N 1 2 314.429 4.039 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1cccc2nccn21 ZINC001116726632 1047171676 /nfs/dbraw/zinc/17/16/76/1047171676.db2.gz OIGWOPUQPLYFDT-UHFFFAOYSA-N 1 2 319.412 4.051 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ccc(C)nc3Cl)CCCC2)n1 ZINC000838900141 1047172133 /nfs/dbraw/zinc/17/21/33/1047172133.db2.gz MKZRBBXHONDDNU-UHFFFAOYSA-N 1 2 321.877 4.367 20 0 DIADLO Cc1cc(N[C@@H](C)[C@@H](O)c2ccc(F)cc2)[nH+]c2ccccc12 ZINC001116736235 1047174224 /nfs/dbraw/zinc/17/42/24/1047174224.db2.gz NILNTUNKHOMJOZ-ORAYPTAESA-N 1 2 310.372 4.216 20 0 DIADLO FC1(F)CC12CC[NH+](Cc1ncc(Cl)cc1Cl)CC2 ZINC000649773837 1047174355 /nfs/dbraw/zinc/17/43/55/1047174355.db2.gz HXGMBFWWMKJESQ-UHFFFAOYSA-N 1 2 307.171 4.010 20 0 DIADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cc2cccc(Cl)c2nc1Cl ZINC001141543700 1047175886 /nfs/dbraw/zinc/17/58/86/1047175886.db2.gz KEIJRDWJLCFGCO-BXKDBHETSA-N 1 2 313.203 4.474 20 0 DIADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cc2cccc(Cl)c2nc1Cl ZINC001141543700 1047175892 /nfs/dbraw/zinc/17/58/92/1047175892.db2.gz KEIJRDWJLCFGCO-BXKDBHETSA-N 1 2 313.203 4.474 20 0 DIADLO FC(F)(F)c1cccc(OCCCC[N@@H+]2CCC(F)(F)C2)c1 ZINC000537372539 1047176583 /nfs/dbraw/zinc/17/65/83/1047176583.db2.gz JWVYEEAMGZGVOR-UHFFFAOYSA-N 1 2 323.305 4.205 20 0 DIADLO FC(F)(F)c1cccc(OCCCC[N@H+]2CCC(F)(F)C2)c1 ZINC000537372539 1047176587 /nfs/dbraw/zinc/17/65/87/1047176587.db2.gz JWVYEEAMGZGVOR-UHFFFAOYSA-N 1 2 323.305 4.205 20 0 DIADLO CCCC[N@H+](Cc1c(Cl)cnn1C)[C@H](C)c1ccc(C)o1 ZINC000682150653 1047177437 /nfs/dbraw/zinc/17/74/37/1047177437.db2.gz CXJNMUJLYNOYBR-CYBMUJFWSA-N 1 2 309.841 4.338 20 0 DIADLO CCCC[N@@H+](Cc1c(Cl)cnn1C)[C@H](C)c1ccc(C)o1 ZINC000682150653 1047177447 /nfs/dbraw/zinc/17/74/47/1047177447.db2.gz CXJNMUJLYNOYBR-CYBMUJFWSA-N 1 2 309.841 4.338 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(C)nc2Cl)o1 ZINC000838932558 1047178015 /nfs/dbraw/zinc/17/80/15/1047178015.db2.gz KXITZGHKNZJUIB-OAHLLOKOSA-N 1 2 320.820 4.120 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccc(C)nc2Cl)o1 ZINC000838932558 1047178019 /nfs/dbraw/zinc/17/80/19/1047178019.db2.gz KXITZGHKNZJUIB-OAHLLOKOSA-N 1 2 320.820 4.120 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H]2CCOc3c(F)cccc32)c(C)s1 ZINC000682144561 1047178044 /nfs/dbraw/zinc/17/80/44/1047178044.db2.gz RVUAVOQLNLPJNI-LKFCYVNXSA-N 1 2 306.406 4.073 20 0 DIADLO Fc1cc(Br)cc(F)c1C[NH+]1CCCCCC1 ZINC001141551449 1047179832 /nfs/dbraw/zinc/17/98/32/1047179832.db2.gz BVAQVBODAQUXQD-UHFFFAOYSA-N 1 2 304.178 4.103 20 0 DIADLO CCc1noc([C@H](C)[N@H+](C)Cc2oc3c(cccc3C)c2C)n1 ZINC000649819410 1047179979 /nfs/dbraw/zinc/17/99/79/1047179979.db2.gz WDHPRCDWQFZLTM-ZDUSSCGKSA-N 1 2 313.401 4.188 20 0 DIADLO CCc1noc([C@H](C)[N@@H+](C)Cc2oc3c(cccc3C)c2C)n1 ZINC000649819410 1047179985 /nfs/dbraw/zinc/17/99/85/1047179985.db2.gz WDHPRCDWQFZLTM-ZDUSSCGKSA-N 1 2 313.401 4.188 20 0 DIADLO Cc1cc(Cl)c(NC(=O)C[C@H](C)n2cc[nH+]c2)cc1Cl ZINC000649858832 1047183193 /nfs/dbraw/zinc/18/31/93/1047183193.db2.gz RRQVBNBJHHXCHN-JTQLQIEISA-N 1 2 312.200 4.088 20 0 DIADLO C[C@@H](CC(=O)Nc1cc(C(F)F)ccc1Cl)n1cc[nH+]c1 ZINC000649847248 1047183242 /nfs/dbraw/zinc/18/32/42/1047183242.db2.gz DDKBTGXMQINYMJ-VIFPVBQESA-N 1 2 313.735 4.064 20 0 DIADLO CCc1cnc(C[NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)o1 ZINC000649875204 1047184822 /nfs/dbraw/zinc/18/48/22/1047184822.db2.gz IXPGMYIBEFQGOK-INIZCTEOSA-N 1 2 308.784 4.270 20 0 DIADLO Cc1ccc(N[C@@H]2CCCc3nn(-c4ccccc4)cc32)c(C)[nH+]1 ZINC001116890563 1047186594 /nfs/dbraw/zinc/18/65/94/1047186594.db2.gz YKZKQDSFBURKRP-LJQANCHMSA-N 1 2 318.424 4.374 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H]2CCOc3c(F)cccc32)c(C)s1 ZINC000682377565 1047188982 /nfs/dbraw/zinc/18/89/82/1047188982.db2.gz RVUAVOQLNLPJNI-XPTSAGLGSA-N 1 2 306.406 4.073 20 0 DIADLO C[C@H]1CO[C@H](c2cccc(Cl)c2)C[N@@H+]1Cc1ccc(O)cc1 ZINC000682407313 1047191701 /nfs/dbraw/zinc/19/17/01/1047191701.db2.gz WZRIJGAJFBUDIZ-UGSOOPFHSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@H]1CO[C@H](c2cccc(Cl)c2)C[N@H+]1Cc1ccc(O)cc1 ZINC000682407313 1047191707 /nfs/dbraw/zinc/19/17/07/1047191707.db2.gz WZRIJGAJFBUDIZ-UGSOOPFHSA-N 1 2 317.816 4.008 20 0 DIADLO Cc1cc(C(F)(F)F)ccc1C[NH2+]Cc1n[nH]c2ccccc21 ZINC000682419735 1047194275 /nfs/dbraw/zinc/19/42/75/1047194275.db2.gz UKBGQSOLFAQMEN-UHFFFAOYSA-N 1 2 319.330 4.180 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1csc(Cl)c1 ZINC000682497390 1047200913 /nfs/dbraw/zinc/20/09/13/1047200913.db2.gz BGZJEPNCRDYUCS-HQJQHLMTSA-N 1 2 315.772 4.464 20 0 DIADLO Cc1[nH+]cc(CNc2ccc3ncccc3c2)n1-c1ccccc1 ZINC000325690499 1047206048 /nfs/dbraw/zinc/20/60/48/1047206048.db2.gz NLFJRWHVEKNOSO-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO CCCc1cccc(C(C)C)c1NC(=O)CCCn1cc[nH+]c1 ZINC000682678208 1047213037 /nfs/dbraw/zinc/21/30/37/1047213037.db2.gz NCFBXOOCIWRSQR-UHFFFAOYSA-N 1 2 313.445 4.378 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2c(Cl)oc3ccccc32)nc1 ZINC000682786786 1047224831 /nfs/dbraw/zinc/22/48/31/1047224831.db2.gz AVVBWEUSLICRIB-UHFFFAOYSA-N 1 2 300.789 4.422 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2c(Cl)oc3ccccc32)nc1 ZINC000682786786 1047224839 /nfs/dbraw/zinc/22/48/39/1047224839.db2.gz AVVBWEUSLICRIB-UHFFFAOYSA-N 1 2 300.789 4.422 20 0 DIADLO Nc1ccc(Nc2cc[nH+]c3ccc(Cl)cc23)cc1Cl ZINC001212105639 1047225133 /nfs/dbraw/zinc/22/51/33/1047225133.db2.gz KFAKCGVNIFIUOQ-UHFFFAOYSA-N 1 2 304.180 4.289 20 0 DIADLO C[S@](=O)c1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)cc1 ZINC001117646329 1047233458 /nfs/dbraw/zinc/23/34/58/1047233458.db2.gz XRYDULPCHJGETH-KKSFZXQISA-N 1 2 319.495 4.069 20 0 DIADLO C[S@](=O)c1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)cc1 ZINC001117646329 1047233467 /nfs/dbraw/zinc/23/34/67/1047233467.db2.gz XRYDULPCHJGETH-KKSFZXQISA-N 1 2 319.495 4.069 20 0 DIADLO C[S@](=O)c1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)cc1 ZINC001117646325 1047233937 /nfs/dbraw/zinc/23/39/37/1047233937.db2.gz XRYDULPCHJGETH-IERDGZPVSA-N 1 2 319.495 4.069 20 0 DIADLO C[S@](=O)c1ccc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)cc1 ZINC001117646325 1047233947 /nfs/dbraw/zinc/23/39/47/1047233947.db2.gz XRYDULPCHJGETH-IERDGZPVSA-N 1 2 319.495 4.069 20 0 DIADLO Cc1cc(CNC(=O)Nc2cc(C(F)F)ccc2F)cc(C)[nH+]1 ZINC000650379140 1047234761 /nfs/dbraw/zinc/23/47/61/1047234761.db2.gz DLCZJTBYNDHOBM-UHFFFAOYSA-N 1 2 323.318 4.097 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2cnc(-c3ccccc3)s2)cs1 ZINC001117657525 1047235521 /nfs/dbraw/zinc/23/55/21/1047235521.db2.gz MMHNOKSXZCYULP-LLVKDONJSA-N 1 2 315.467 4.426 20 0 DIADLO Cc1ncsc1CSCc1ccc(-n2cc[nH+]c2)cc1 ZINC001117687524 1047237228 /nfs/dbraw/zinc/23/72/28/1047237228.db2.gz NVKXXPUEGWRPLH-UHFFFAOYSA-N 1 2 301.440 4.071 20 0 DIADLO Fc1cccc2c1CC[N@@H+](Cc1cc3cccnc3cc1F)C2 ZINC001141634647 1047241465 /nfs/dbraw/zinc/24/14/65/1047241465.db2.gz LXLFLGDGBWXUDN-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1cccc2c1CC[N@H+](Cc1cc3cccnc3cc1F)C2 ZINC001141634647 1047241476 /nfs/dbraw/zinc/24/14/76/1047241476.db2.gz LXLFLGDGBWXUDN-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO CC(C)N(C)c1ccc(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)cn1 ZINC000682998420 1047249104 /nfs/dbraw/zinc/24/91/04/1047249104.db2.gz VRBSXQMUENJLNF-GOSISDBHSA-N 1 2 313.420 4.012 20 0 DIADLO CC(C)N(C)c1ccc(C[N@H+]2CC[C@@H]2c2cccc(F)c2)cn1 ZINC000682998420 1047249125 /nfs/dbraw/zinc/24/91/25/1047249125.db2.gz VRBSXQMUENJLNF-GOSISDBHSA-N 1 2 313.420 4.012 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ccccn2)Cc2cc(C)ccn2)c1 ZINC000683016669 1047254545 /nfs/dbraw/zinc/25/45/45/1047254545.db2.gz AJWIUMVNARFDKT-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ccccn2)Cc2cc(C)ccn2)c1 ZINC000683016669 1047254573 /nfs/dbraw/zinc/25/45/73/1047254573.db2.gz AJWIUMVNARFDKT-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO Cc1ccnc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3n2C)c1 ZINC000683015796 1047256226 /nfs/dbraw/zinc/25/62/26/1047256226.db2.gz NEGMSFUBVMFZDY-IBGZPJMESA-N 1 2 320.440 4.004 20 0 DIADLO Cc1ccnc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3n2C)c1 ZINC000683015796 1047256239 /nfs/dbraw/zinc/25/62/39/1047256239.db2.gz NEGMSFUBVMFZDY-IBGZPJMESA-N 1 2 320.440 4.004 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[NH+]1CCCCC1 ZINC001141689580 1047267492 /nfs/dbraw/zinc/26/74/92/1047267492.db2.gz FLBRUZYQCLNGDE-UHFFFAOYSA-N 1 2 306.606 4.228 20 0 DIADLO Fc1c(Br)ccc(C[N@H+]2CCC[C@@H](F)CC2)c1F ZINC001141743485 1047284354 /nfs/dbraw/zinc/28/43/54/1047284354.db2.gz XZFVMANLIDSOFM-SNVBAGLBSA-N 1 2 322.168 4.051 20 0 DIADLO Fc1c(Br)ccc(C[N@@H+]2CCC[C@@H](F)CC2)c1F ZINC001141743485 1047284360 /nfs/dbraw/zinc/28/43/60/1047284360.db2.gz XZFVMANLIDSOFM-SNVBAGLBSA-N 1 2 322.168 4.051 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+](C)Cc1ccc(Cl)nc1 ZINC000796443683 1047286332 /nfs/dbraw/zinc/28/63/32/1047286332.db2.gz UVAVVKGYQBTJEG-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000796443683 1047286347 /nfs/dbraw/zinc/28/63/47/1047286347.db2.gz UVAVVKGYQBTJEG-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO O=C1SCCN1C[N@@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000840160972 1047290980 /nfs/dbraw/zinc/29/09/80/1047290980.db2.gz FBCCAVBFKJONOZ-MRXNPFEDSA-N 1 2 316.470 4.120 20 0 DIADLO O=C1SCCN1C[N@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000840160972 1047290986 /nfs/dbraw/zinc/29/09/86/1047290986.db2.gz FBCCAVBFKJONOZ-MRXNPFEDSA-N 1 2 316.470 4.120 20 0 DIADLO CC(C)CC[C@H]([NH2+]c1ccc(N2CCOCC2)cc1)C1CC1 ZINC000389925575 1047293271 /nfs/dbraw/zinc/29/32/71/1047293271.db2.gz UPCOBPREOKAMFH-IBGZPJMESA-N 1 2 302.462 4.150 20 0 DIADLO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]Cc1c[nH]cn1 ZINC000796448634 1047293664 /nfs/dbraw/zinc/29/36/64/1047293664.db2.gz GEPJBNATUXBMGI-GFCCVEGCSA-N 1 2 312.442 4.001 20 0 DIADLO COc1ccc(OC)c([C@@H](C)Nc2ccc([NH+](C)C)cc2C)c1 ZINC000390286496 1047296116 /nfs/dbraw/zinc/29/61/16/1047296116.db2.gz NMFPIMXJSPXPMO-CQSZACIVSA-N 1 2 314.429 4.251 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2ccc(C)nc2Cl)c1 ZINC001118518463 1047300406 /nfs/dbraw/zinc/30/04/06/1047300406.db2.gz UQAJCDVUYNWJPM-UHFFFAOYSA-N 1 2 308.834 4.189 20 0 DIADLO c1cc(CNc2ccc([NH+]3CCCC3)cc2)c2c(c1)CCCN2 ZINC000390871892 1047301698 /nfs/dbraw/zinc/30/16/98/1047301698.db2.gz QYAKMLMSBKKUPC-UHFFFAOYSA-N 1 2 307.441 4.257 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1ncc(-c2ccccc2)n1C ZINC000651229815 1047304654 /nfs/dbraw/zinc/30/46/54/1047304654.db2.gz OQKAUDSGQCMPEL-OCCSQVGLSA-N 1 2 324.428 4.104 20 0 DIADLO CCc1nnc(C[NH2+]C(c2cccs2)c2cccs2)s1 ZINC000391799486 1047305337 /nfs/dbraw/zinc/30/53/37/1047305337.db2.gz BNZZXVZDKAUHFV-UHFFFAOYSA-N 1 2 321.496 4.103 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccccc2)c[nH]1)[C@H](C)c1cccc(O)c1 ZINC001118938986 1047318594 /nfs/dbraw/zinc/31/85/94/1047318594.db2.gz STWOEKXYWKBDSS-OAHLLOKOSA-N 1 2 321.424 4.365 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccccc2)c[nH]1)[C@H](C)c1cccc(O)c1 ZINC001118938986 1047318610 /nfs/dbraw/zinc/31/86/10/1047318610.db2.gz STWOEKXYWKBDSS-OAHLLOKOSA-N 1 2 321.424 4.365 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2cnn(CC3CCC3)c2)c(C)s1 ZINC000898179109 1047325139 /nfs/dbraw/zinc/32/51/39/1047325139.db2.gz HSPAWBMVXZXWKO-NEPJUHHUSA-N 1 2 318.490 4.168 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1ccc(-c2ccccc2)cn1 ZINC000651738202 1047325070 /nfs/dbraw/zinc/32/50/70/1047325070.db2.gz FBUZSONREKSDBU-AUUYWEPGSA-N 1 2 318.424 4.200 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1ccc(-c2ccccc2)cn1 ZINC000651738202 1047325086 /nfs/dbraw/zinc/32/50/86/1047325086.db2.gz FBUZSONREKSDBU-AUUYWEPGSA-N 1 2 318.424 4.200 20 0 DIADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1ccc(-c2ccccc2)cn1 ZINC000651822533 1047328584 /nfs/dbraw/zinc/32/85/84/1047328584.db2.gz AQFFNKPDSUQVNO-YZVOILCLSA-N 1 2 318.424 4.302 20 0 DIADLO CCC/C(C)=C/C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000726146023 1047337031 /nfs/dbraw/zinc/33/70/31/1047337031.db2.gz CXMJEPDPZVKUGT-FMIVXFBMSA-N 1 2 303.793 4.211 20 0 DIADLO c1cc(Oc2ccccc2)c(C[N@@H+]2CCOC[C@H]2C2CC2)s1 ZINC001142001108 1047338676 /nfs/dbraw/zinc/33/86/76/1047338676.db2.gz HMVFNRMADDHNJO-INIZCTEOSA-N 1 2 315.438 4.151 20 0 DIADLO c1cc(Oc2ccccc2)c(C[N@H+]2CCOC[C@H]2C2CC2)s1 ZINC001142001108 1047338687 /nfs/dbraw/zinc/33/86/87/1047338687.db2.gz HMVFNRMADDHNJO-INIZCTEOSA-N 1 2 315.438 4.151 20 0 DIADLO c1cc(Oc2ccccc2)c(C[N@@H+]2CCc3cccnc3C2)s1 ZINC001142001650 1047339371 /nfs/dbraw/zinc/33/93/71/1047339371.db2.gz YNZRUWMSTGRDPZ-UHFFFAOYSA-N 1 2 322.433 4.494 20 0 DIADLO c1cc(Oc2ccccc2)c(C[N@H+]2CCc3cccnc3C2)s1 ZINC001142001650 1047339381 /nfs/dbraw/zinc/33/93/81/1047339381.db2.gz YNZRUWMSTGRDPZ-UHFFFAOYSA-N 1 2 322.433 4.494 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3ncc(Cl)cc3Cl)CC2)cc1 ZINC000537513310 1047350769 /nfs/dbraw/zinc/35/07/69/1047350769.db2.gz KYHZYEUSGJPUKI-UHFFFAOYSA-N 1 2 311.187 4.306 20 0 DIADLO CSc1ccc(C[N@@H+]2CCc3ccc(C(C)=O)cc3C2)s1 ZINC001142029000 1047352954 /nfs/dbraw/zinc/35/29/54/1047352954.db2.gz DHBANPIMLCBKLR-UHFFFAOYSA-N 1 2 317.479 4.231 20 0 DIADLO CSc1ccc(C[N@H+]2CCc3ccc(C(C)=O)cc3C2)s1 ZINC001142029000 1047352964 /nfs/dbraw/zinc/35/29/64/1047352964.db2.gz DHBANPIMLCBKLR-UHFFFAOYSA-N 1 2 317.479 4.231 20 0 DIADLO CC(C)c1nn(C[NH+]2CCC3(CCCCC3)CC2)c(=S)n1C ZINC000726591499 1047366276 /nfs/dbraw/zinc/36/62/76/1047366276.db2.gz JIPZHBLJZAVWBN-UHFFFAOYSA-N 1 2 322.522 4.078 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@H+](CC)Cc2ccoc2)cc1 ZINC000726598822 1047368397 /nfs/dbraw/zinc/36/83/97/1047368397.db2.gz YYIHHRSSRPFBPN-OAHLLOKOSA-N 1 2 314.429 4.254 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@@H+](CC)Cc2ccoc2)cc1 ZINC000726598822 1047368408 /nfs/dbraw/zinc/36/84/08/1047368408.db2.gz YYIHHRSSRPFBPN-OAHLLOKOSA-N 1 2 314.429 4.254 20 0 DIADLO Clc1ccc(C[NH+]2CCC(c3ccccc3Cl)CC2)nn1 ZINC001142073708 1047369481 /nfs/dbraw/zinc/36/94/81/1047369481.db2.gz ZZZUBEDMTPFEEW-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO C[C@H]1CCC[N@@H+]1Cc1c(F)ccc(Br)c1Cl ZINC001142078210 1047371763 /nfs/dbraw/zinc/37/17/63/1047371763.db2.gz BPRZAAMXPIYMAS-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@H]1CCC[N@H+]1Cc1c(F)ccc(Br)c1Cl ZINC001142078210 1047371775 /nfs/dbraw/zinc/37/17/75/1047371775.db2.gz BPRZAAMXPIYMAS-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000726693021 1047375102 /nfs/dbraw/zinc/37/51/02/1047375102.db2.gz PUAIFMLCCFWSOV-AWEZNQCLSA-N 1 2 311.385 4.221 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000726693021 1047375113 /nfs/dbraw/zinc/37/51/13/1047375113.db2.gz PUAIFMLCCFWSOV-AWEZNQCLSA-N 1 2 311.385 4.221 20 0 DIADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccc(-c2ccccc2Cl)cc1 ZINC001142102361 1047380060 /nfs/dbraw/zinc/38/00/60/1047380060.db2.gz SRXJCTUUCADVKQ-ZDUSSCGKSA-N 1 2 317.816 4.000 20 0 DIADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccc(-c2ccccc2Cl)cc1 ZINC001142102361 1047380070 /nfs/dbraw/zinc/38/00/70/1047380070.db2.gz SRXJCTUUCADVKQ-ZDUSSCGKSA-N 1 2 317.816 4.000 20 0 DIADLO CCC(CC)(CC)C(=O)N[C@H]1CC[C@H](Nc2cccc[nH+]2)CC1 ZINC000653032692 1047382392 /nfs/dbraw/zinc/38/23/92/1047382392.db2.gz SRZMYFBGWWQODI-WKILWMFISA-N 1 2 317.477 4.137 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccccc2OCC(C)C)no1 ZINC000726788568 1047382918 /nfs/dbraw/zinc/38/29/18/1047382918.db2.gz FYNFKHXFRMVRIE-GOSISDBHSA-N 1 2 314.429 4.355 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccccc2OCC(C)C)no1 ZINC000726788568 1047382929 /nfs/dbraw/zinc/38/29/29/1047382929.db2.gz FYNFKHXFRMVRIE-GOSISDBHSA-N 1 2 314.429 4.355 20 0 DIADLO CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(F)(F)CC1 ZINC000796540174 1047383919 /nfs/dbraw/zinc/38/39/19/1047383919.db2.gz HHPBTSRBTUZGKC-UONOGXRCSA-N 1 2 324.415 4.258 20 0 DIADLO Oc1cc(Cl)c(C[N@@H+]2CCC[C@@H]2c2ccccn2)c(Cl)c1 ZINC001142114793 1047383917 /nfs/dbraw/zinc/38/39/17/1047383917.db2.gz OYBGCDPXJGSDGQ-MRXNPFEDSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1cc(Cl)c(C[N@H+]2CCC[C@@H]2c2ccccn2)c(Cl)c1 ZINC001142114793 1047383924 /nfs/dbraw/zinc/38/39/24/1047383924.db2.gz OYBGCDPXJGSDGQ-MRXNPFEDSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1cc(Cl)c(C[N@@H+]2CC[C@H](C(F)(F)F)C2)c(Cl)c1 ZINC001142114996 1047383995 /nfs/dbraw/zinc/38/39/95/1047383995.db2.gz SJWWGKGHXYPCHE-ZETCQYMHSA-N 1 2 314.134 4.083 20 0 DIADLO Oc1cc(Cl)c(C[N@H+]2CC[C@H](C(F)(F)F)C2)c(Cl)c1 ZINC001142114996 1047384001 /nfs/dbraw/zinc/38/40/01/1047384001.db2.gz SJWWGKGHXYPCHE-ZETCQYMHSA-N 1 2 314.134 4.083 20 0 DIADLO CC(C)(C)c1nc[nH]c1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001142227038 1047406414 /nfs/dbraw/zinc/40/64/14/1047406414.db2.gz YWFGZBNGNVYKFR-INIZCTEOSA-N 1 2 319.399 4.323 20 0 DIADLO CC(C)(C)c1nc[nH]c1C[N@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001142227038 1047406421 /nfs/dbraw/zinc/40/64/21/1047406421.db2.gz YWFGZBNGNVYKFR-INIZCTEOSA-N 1 2 319.399 4.323 20 0 DIADLO COC[C@H]([NH2+]Cc1cc(C(C)C)ccc1OC)c1ccc(C)o1 ZINC000653613563 1047407700 /nfs/dbraw/zinc/40/77/00/1047407700.db2.gz RHVJGKPAXOEBQM-KRWDZBQOSA-N 1 2 317.429 4.197 20 0 DIADLO C/C(=C/c1ccc(F)cc1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000749362032 1047413003 /nfs/dbraw/zinc/41/30/03/1047413003.db2.gz FGAURKCLNDIQGB-SEYXRHQNSA-N 1 2 321.355 4.258 20 0 DIADLO COc1ccc(C(C)C)cc1C[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000653671596 1047414971 /nfs/dbraw/zinc/41/49/71/1047414971.db2.gz LGLMVMBLKZPRFK-GOSISDBHSA-N 1 2 313.445 4.269 20 0 DIADLO COc1ccc(C(C)C)cc1C[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000653671596 1047414973 /nfs/dbraw/zinc/41/49/73/1047414973.db2.gz LGLMVMBLKZPRFK-GOSISDBHSA-N 1 2 313.445 4.269 20 0 DIADLO c1sc(C2CCCC2)nc1C[N@@H+]1CCC[C@H](OC2CCC2)C1 ZINC000653813402 1047423423 /nfs/dbraw/zinc/42/34/23/1047423423.db2.gz BDVAHLNZDUXPBG-KRWDZBQOSA-N 1 2 320.502 4.334 20 0 DIADLO c1sc(C2CCCC2)nc1C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000653813402 1047423427 /nfs/dbraw/zinc/42/34/27/1047423427.db2.gz BDVAHLNZDUXPBG-KRWDZBQOSA-N 1 2 320.502 4.334 20 0 DIADLO COCC[C@H](c1ccccc1)[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653832091 1047424823 /nfs/dbraw/zinc/42/48/23/1047424823.db2.gz WBVGGYSJGVIHMP-GOSISDBHSA-N 1 2 303.352 4.058 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccc(Cl)nc2)c(Cl)c1 ZINC000749843460 1047439310 /nfs/dbraw/zinc/43/93/10/1047439310.db2.gz CMKLEWFWZLBCOK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)nc2)c(Cl)c1 ZINC000749843460 1047439319 /nfs/dbraw/zinc/43/93/19/1047439319.db2.gz CMKLEWFWZLBCOK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Oc1ccc2c(c1)[C@@H](Nc1ccc([NH+]3CCCC3)cc1)CCC2 ZINC000322999048 1047440876 /nfs/dbraw/zinc/44/08/76/1047440876.db2.gz FECLAFNSWTZENL-FQEVSTJZSA-N 1 2 308.425 4.482 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC(c3ccccc3)(C(C)C)C2)c(C)[nH+]1 ZINC001142414875 1047443670 /nfs/dbraw/zinc/44/36/70/1047443670.db2.gz GVZSSTLCWKWVFL-UHFFFAOYSA-N 1 2 322.452 4.057 20 0 DIADLO CC1(C)C(=O)N(C[N@@H+]2CC[C@@H]2c2ccccc2)[C@@H]1c1ccccc1 ZINC000749940231 1047450729 /nfs/dbraw/zinc/45/07/29/1047450729.db2.gz YCTMCDTYOUSHLY-RTBURBONSA-N 1 2 320.436 4.001 20 0 DIADLO CC1(C)C(=O)N(C[N@H+]2CC[C@@H]2c2ccccc2)[C@@H]1c1ccccc1 ZINC000749940231 1047450736 /nfs/dbraw/zinc/45/07/36/1047450736.db2.gz YCTMCDTYOUSHLY-RTBURBONSA-N 1 2 320.436 4.001 20 0 DIADLO Cc1csc(CSCc2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000088308988 1047459725 /nfs/dbraw/zinc/45/97/25/1047459725.db2.gz UQEAKWSHXVRIJM-UHFFFAOYSA-N 1 2 301.440 4.071 20 0 DIADLO Cc1csc(C[N@@H+]2CCSC[C@@H]2c2ccc(C)cc2)n1 ZINC000088600098 1047466066 /nfs/dbraw/zinc/46/60/66/1047466066.db2.gz CVNLRXULBIHNDU-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1csc(C[N@H+]2CCSC[C@@H]2c2ccc(C)cc2)n1 ZINC000088600098 1047466075 /nfs/dbraw/zinc/46/60/75/1047466075.db2.gz CVNLRXULBIHNDU-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO COc1ccccc1-c1nc(C[N@H+](C)Cc2ccccc2)cs1 ZINC000057828281 1047473718 /nfs/dbraw/zinc/47/37/18/1047473718.db2.gz AFXKPNAWOMKMNW-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1ccccc1-c1nc(C[N@@H+](C)Cc2ccccc2)cs1 ZINC000057828281 1047473724 /nfs/dbraw/zinc/47/37/24/1047473724.db2.gz AFXKPNAWOMKMNW-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO CC[N@H+](Cc1cccc2[nH]cnc21)Cc1c(F)cccc1Cl ZINC001142692515 1047482375 /nfs/dbraw/zinc/48/23/75/1047482375.db2.gz HRUNHCKPPVNNSB-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO CC[N@@H+](Cc1cccc2[nH]cnc21)Cc1c(F)cccc1Cl ZINC001142692515 1047482380 /nfs/dbraw/zinc/48/23/80/1047482380.db2.gz HRUNHCKPPVNNSB-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2Cl)C[N@@H+]1Cc1ccsc1 ZINC000537627483 1047486591 /nfs/dbraw/zinc/48/65/91/1047486591.db2.gz UUEXEQGMVWFUKT-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2Cl)C[N@H+]1Cc1ccsc1 ZINC000537627483 1047486594 /nfs/dbraw/zinc/48/65/94/1047486594.db2.gz UUEXEQGMVWFUKT-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1ccc(N2CC[NH+](Cc3csc(Cl)c3)CC2)cc1 ZINC001142760640 1047491370 /nfs/dbraw/zinc/49/13/70/1047491370.db2.gz ZMEYERLXKAIFNW-UHFFFAOYSA-N 1 2 306.862 4.032 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCSC[C@H]3C)cs2)cc1 ZINC000537630140 1047496805 /nfs/dbraw/zinc/49/68/05/1047496805.db2.gz PPMVDHRHNUOJHN-CYBMUJFWSA-N 1 2 304.484 4.056 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCSC[C@H]3C)cs2)cc1 ZINC000537630140 1047496808 /nfs/dbraw/zinc/49/68/08/1047496808.db2.gz PPMVDHRHNUOJHN-CYBMUJFWSA-N 1 2 304.484 4.056 20 0 DIADLO Clc1cccc(-c2nc(CSCCn3cc[nH+]c3)co2)c1 ZINC000090200267 1047499527 /nfs/dbraw/zinc/49/95/27/1047499527.db2.gz QBHKGFFQYYJMGS-UHFFFAOYSA-N 1 2 319.817 4.125 20 0 DIADLO c1cn(CCSCc2csc(C3CCCCC3)n2)c[nH+]1 ZINC000090200229 1047499743 /nfs/dbraw/zinc/49/97/43/1047499743.db2.gz FCQXZSOETQFIJM-UHFFFAOYSA-N 1 2 307.488 4.321 20 0 DIADLO Clc1cccc2c1CC[N@H+](Cc1cnc(C3CC3)s1)C2 ZINC000537631435 1047499815 /nfs/dbraw/zinc/49/98/15/1047499815.db2.gz MKDAFNAGXLBVKP-UHFFFAOYSA-N 1 2 304.846 4.232 20 0 DIADLO Clc1cccc2c1CC[N@@H+](Cc1cnc(C3CC3)s1)C2 ZINC000537631435 1047499820 /nfs/dbraw/zinc/49/98/20/1047499820.db2.gz MKDAFNAGXLBVKP-UHFFFAOYSA-N 1 2 304.846 4.232 20 0 DIADLO C[C@H](SCCn1cc[nH+]c1)c1ccc(C(F)(F)F)cc1 ZINC000090201084 1047500053 /nfs/dbraw/zinc/50/00/53/1047500053.db2.gz IHICMLKWNPSBKH-NSHDSACASA-N 1 2 300.349 4.396 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cc(F)cc(F)c1 ZINC000120822139 1047504197 /nfs/dbraw/zinc/50/41/97/1047504197.db2.gz OLNHAMHIXYGKCP-GFCCVEGCSA-N 1 2 303.356 4.133 20 0 DIADLO CC[N@H+](Cc1ccnc2[nH]ccc21)Cc1c(F)cccc1Cl ZINC001142882414 1047508926 /nfs/dbraw/zinc/50/89/26/1047508926.db2.gz NOGXJGODZMWPBZ-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO CC[N@@H+](Cc1ccnc2[nH]ccc21)Cc1c(F)cccc1Cl ZINC001142882414 1047508935 /nfs/dbraw/zinc/50/89/35/1047508935.db2.gz NOGXJGODZMWPBZ-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO Cc1cc(C)c(NC(=O)CCCc2c[nH]c3ccccc23)c(C)[nH+]1 ZINC000121108941 1047510619 /nfs/dbraw/zinc/51/06/19/1047510619.db2.gz KVBGPFNKKNKVGI-UHFFFAOYSA-N 1 2 321.424 4.450 20 0 DIADLO COc1ccccc1C1([NH2+][C@H](C)c2cccnc2Cl)CC1 ZINC000842903423 1047512488 /nfs/dbraw/zinc/51/24/88/1047512488.db2.gz PNUPVDVISRUEIQ-GFCCVEGCSA-N 1 2 302.805 4.084 20 0 DIADLO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000091081047 1047514882 /nfs/dbraw/zinc/51/48/82/1047514882.db2.gz YAEJBNAUKUJNJQ-AWEZNQCLSA-N 1 2 318.490 4.118 20 0 DIADLO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000091081047 1047514887 /nfs/dbraw/zinc/51/48/87/1047514887.db2.gz YAEJBNAUKUJNJQ-AWEZNQCLSA-N 1 2 318.490 4.118 20 0 DIADLO COc1cc(C)cc(C[N@H+](C)Cc2csc(C(C)C)n2)c1 ZINC001143156446 1047536547 /nfs/dbraw/zinc/53/65/47/1047536547.db2.gz JQFLHFUTDYIGJI-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO COc1cc(C)cc(C[N@@H+](C)Cc2csc(C(C)C)n2)c1 ZINC001143156446 1047536554 /nfs/dbraw/zinc/53/65/54/1047536554.db2.gz JQFLHFUTDYIGJI-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO Fc1ccc(OC2C[NH+](Cc3ccc(C(F)F)cc3)C2)cc1 ZINC001143252200 1047544643 /nfs/dbraw/zinc/54/46/43/1047544643.db2.gz SSMKPUZYSVCLJX-UHFFFAOYSA-N 1 2 307.315 4.027 20 0 DIADLO COc1ccc(C[NH2+][C@@H](CCc2ccccc2)C(F)F)cc1 ZINC001203136483 1047547114 /nfs/dbraw/zinc/54/71/14/1047547114.db2.gz PORJYOGEMRMKIO-KRWDZBQOSA-N 1 2 305.368 4.051 20 0 DIADLO CC(=O)C1CC[NH+](Cc2c(Cl)cccc2C(F)(F)F)CC1 ZINC001143288395 1047548498 /nfs/dbraw/zinc/54/84/98/1047548498.db2.gz GVOPPPPOJWVBEB-UHFFFAOYSA-N 1 2 319.754 4.160 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1c(Br)ccc(F)c1F ZINC001143328668 1047553128 /nfs/dbraw/zinc/55/31/28/1047553128.db2.gz JLMXCSQTPYMEAQ-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1c(Br)ccc(F)c1F ZINC001143328668 1047553131 /nfs/dbraw/zinc/55/31/31/1047553131.db2.gz JLMXCSQTPYMEAQ-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO COc1cc(C[N@@H+]2CCn3cccc3[C@@H]2C)ccc1C(F)(F)F ZINC001143349631 1047554466 /nfs/dbraw/zinc/55/44/66/1047554466.db2.gz MKYVZPQOFDHQRN-LBPRGKRZSA-N 1 2 324.346 4.092 20 0 DIADLO COc1cc(C[N@H+]2CCn3cccc3[C@@H]2C)ccc1C(F)(F)F ZINC001143349631 1047554474 /nfs/dbraw/zinc/55/44/74/1047554474.db2.gz MKYVZPQOFDHQRN-LBPRGKRZSA-N 1 2 324.346 4.092 20 0 DIADLO COc1c(F)ccc(C[N@@H+]2CCC[C@H]2c2ccc(C)nc2)c1F ZINC001143329023 1047554829 /nfs/dbraw/zinc/55/48/29/1047554829.db2.gz HQVZLUMOGNPVBS-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1c(F)ccc(C[N@H+]2CCC[C@H]2c2ccc(C)nc2)c1F ZINC001143329023 1047554834 /nfs/dbraw/zinc/55/48/34/1047554834.db2.gz HQVZLUMOGNPVBS-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO CCC(CC)CCCN(C)C(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001149125968 1047555767 /nfs/dbraw/zinc/55/57/67/1047555767.db2.gz LJLSUSZZKAEJFV-QGZVFWFLSA-N 1 2 307.482 4.145 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](c2ccccc2)C(C)(C)C)n1 ZINC000123064055 1047571093 /nfs/dbraw/zinc/57/10/93/1047571093.db2.gz AUOIEMJBOBTXNE-KRWDZBQOSA-N 1 2 301.434 4.289 20 0 DIADLO CSCc1ccc(C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000097213789 1047571840 /nfs/dbraw/zinc/57/18/40/1047571840.db2.gz NSQXGTNEFHBUBZ-UHFFFAOYSA-N 1 2 300.427 4.122 20 0 DIADLO CCOC(=O)c1cccc(SCc2ccc(C)[nH+]c2C)c1 ZINC000477048163 1047590473 /nfs/dbraw/zinc/59/04/73/1047590473.db2.gz KNQYLKYMYWSJFO-UHFFFAOYSA-N 1 2 301.411 4.167 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000477142025 1047598361 /nfs/dbraw/zinc/59/83/61/1047598361.db2.gz MTDGMPALAKRHPG-AWEZNQCLSA-N 1 2 301.409 4.330 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000477142025 1047598370 /nfs/dbraw/zinc/59/83/70/1047598370.db2.gz MTDGMPALAKRHPG-AWEZNQCLSA-N 1 2 301.409 4.330 20 0 DIADLO COC(=O)c1cnc([C@@H](C)[NH2+][C@@H](C)c2cc(C)sc2C)s1 ZINC000315438406 1047606672 /nfs/dbraw/zinc/60/66/72/1047606672.db2.gz WUXXAVLMOGXBCQ-VHSXEESVSA-N 1 2 324.471 4.020 20 0 DIADLO COC(=O)c1cnc([C@H](C)[NH2+][C@H](C)c2cc(C)sc2C)s1 ZINC000315438409 1047607222 /nfs/dbraw/zinc/60/72/22/1047607222.db2.gz WUXXAVLMOGXBCQ-ZJUUUORDSA-N 1 2 324.471 4.020 20 0 DIADLO CC(C)c1ccc2cc(C(=O)Nc3cc(N(C)C)cc[nH+]3)[nH]c2c1 ZINC001152319116 1047610027 /nfs/dbraw/zinc/61/00/27/1047610027.db2.gz BQWXOMZLEFNLBI-UHFFFAOYSA-N 1 2 322.412 4.005 20 0 DIADLO CCC(C)(C)c1ccc(C(=O)Nc2cc(N(C)C)cc[nH+]2)cc1 ZINC001152320902 1047610322 /nfs/dbraw/zinc/61/03/22/1047610322.db2.gz ZXBLPOGAYUFYRQ-UHFFFAOYSA-N 1 2 311.429 4.088 20 0 DIADLO Cc1cccc(Oc2cccc(NC(=O)CCn3cc[nH+]c3)c2)c1 ZINC001152474964 1047612262 /nfs/dbraw/zinc/61/22/62/1047612262.db2.gz WSNGHOYRIZZLHE-UHFFFAOYSA-N 1 2 321.380 4.013 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1ccn(C2CCCC2)n1 ZINC000477301566 1047612523 /nfs/dbraw/zinc/61/25/23/1047612523.db2.gz JUKGXWVLOVTCDO-LJQANCHMSA-N 1 2 312.461 4.064 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1ccn(C2CCCC2)n1 ZINC000477301566 1047612529 /nfs/dbraw/zinc/61/25/29/1047612529.db2.gz JUKGXWVLOVTCDO-LJQANCHMSA-N 1 2 312.461 4.064 20 0 DIADLO O=C(N[C@@H](CC1CCC1)c1ccccc1)c1cc2c[nH+]ccc2[nH]1 ZINC001152852251 1047616655 /nfs/dbraw/zinc/61/66/55/1047616655.db2.gz HXWYADLWAWFOTK-SFHVURJKSA-N 1 2 319.408 4.224 20 0 DIADLO CC[N@H+](Cc1ccccc1)[C@H](C)c1noc(-c2ccccc2)n1 ZINC000477671025 1047629014 /nfs/dbraw/zinc/62/90/14/1047629014.db2.gz SMRDAFIFWNDENI-OAHLLOKOSA-N 1 2 307.397 4.320 20 0 DIADLO CC[N@@H+](Cc1ccccc1)[C@H](C)c1noc(-c2ccccc2)n1 ZINC000477671025 1047629017 /nfs/dbraw/zinc/62/90/17/1047629017.db2.gz SMRDAFIFWNDENI-OAHLLOKOSA-N 1 2 307.397 4.320 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+]2CCC[C@H](Oc3ccccc3Cl)C2)o1 ZINC000537850781 1047639777 /nfs/dbraw/zinc/63/97/77/1047639777.db2.gz CCKJAMHPNBLLAM-KGLIPLIRSA-N 1 2 320.820 4.241 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+]2CCC[C@H](Oc3ccccc3Cl)C2)o1 ZINC000537850781 1047639782 /nfs/dbraw/zinc/63/97/82/1047639782.db2.gz CCKJAMHPNBLLAM-KGLIPLIRSA-N 1 2 320.820 4.241 20 0 DIADLO CC(C)Oc1cc(-c2cc(F)c(C[NH+](C)C)c(F)c2)c(F)cn1 ZINC001206652326 1047640433 /nfs/dbraw/zinc/64/04/33/1047640433.db2.gz HHHFROFFUSVMFV-UHFFFAOYSA-N 1 2 324.346 4.015 20 0 DIADLO CC(C)C[C@H](C(=O)NCC[C@H](C)CC(C)(C)C)n1cc[nH+]c1 ZINC001154338605 1047645574 /nfs/dbraw/zinc/64/55/74/1047645574.db2.gz BBLVRMTZVUBLFU-JKSUJKDBSA-N 1 2 307.482 4.049 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccc(F)cc1F ZINC000537961155 1047647657 /nfs/dbraw/zinc/64/76/57/1047647657.db2.gz ZEQQNLFQXRQRIB-PSLIRLAXSA-N 1 2 309.743 4.403 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@@H]1CCSc2c(F)cccc21 ZINC000924650601 1047655690 /nfs/dbraw/zinc/65/56/90/1047655690.db2.gz ZYNNCNDKXBLWJH-ZIAGYGMSSA-N 1 2 318.417 4.326 20 0 DIADLO CC[C@@H](CN(CC)C(=O)c1cc2c[nH+]ccc2[nH]1)c1ccccc1 ZINC001154794361 1047656722 /nfs/dbraw/zinc/65/67/22/1047656722.db2.gz WLYMCURTJPXQPB-HNNXBMFYSA-N 1 2 321.424 4.219 20 0 DIADLO CC[C@H](CN(CC)C(=O)c1cc2c[nH+]ccc2[nH]1)c1ccccc1 ZINC001154794362 1047656757 /nfs/dbraw/zinc/65/67/57/1047656757.db2.gz WLYMCURTJPXQPB-OAHLLOKOSA-N 1 2 321.424 4.219 20 0 DIADLO CC[C@H](C)[C@@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000538192992 1047662241 /nfs/dbraw/zinc/66/22/41/1047662241.db2.gz NXFGWKJHTTWHPV-MEDUHNTESA-N 1 2 319.836 4.477 20 0 DIADLO C[N@H+](CCC(F)(F)F)Cc1c(Cl)cccc1N1CCCC1 ZINC000538263723 1047664720 /nfs/dbraw/zinc/66/47/20/1047664720.db2.gz FREDRJIELRHGQS-UHFFFAOYSA-N 1 2 320.786 4.324 20 0 DIADLO C[N@@H+](CCC(F)(F)F)Cc1c(Cl)cccc1N1CCCC1 ZINC000538263723 1047664724 /nfs/dbraw/zinc/66/47/24/1047664724.db2.gz FREDRJIELRHGQS-UHFFFAOYSA-N 1 2 320.786 4.324 20 0 DIADLO CC(=O)c1ccc2c(c1)CN(c1cc3ccccc3c[nH+]1)CC2 ZINC001155071025 1047666687 /nfs/dbraw/zinc/66/66/87/1047666687.db2.gz GGMUVBMRNRQOJP-UHFFFAOYSA-N 1 2 302.377 4.000 20 0 DIADLO CC(=O)c1ccc2c(c1)CN(c1cc(C)c3ccccc3[nH+]1)CC2 ZINC001155071249 1047666877 /nfs/dbraw/zinc/66/68/77/1047666877.db2.gz NRLPLNRPKQJJFB-UHFFFAOYSA-N 1 2 316.404 4.309 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cccc(OCC(C)C)c2)s1 ZINC000538304635 1047668524 /nfs/dbraw/zinc/66/85/24/1047668524.db2.gz MBBZIELMHLHFOA-UHFFFAOYSA-N 1 2 318.486 4.372 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cccc(OCC(C)C)c2)s1 ZINC000538304635 1047668532 /nfs/dbraw/zinc/66/85/32/1047668532.db2.gz MBBZIELMHLHFOA-UHFFFAOYSA-N 1 2 318.486 4.372 20 0 DIADLO COCc1cc[nH+]c(N2CCC(n3ccc4ccccc43)CC2)c1 ZINC001155254131 1047673076 /nfs/dbraw/zinc/67/30/76/1047673076.db2.gz ZLHOSAXUWCCYCO-UHFFFAOYSA-N 1 2 321.424 4.024 20 0 DIADLO COc1ccccc1[C@H](C)Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000538526623 1047685219 /nfs/dbraw/zinc/68/52/19/1047685219.db2.gz QPAGKWKUGCLWBI-HNNXBMFYSA-N 1 2 311.429 4.254 20 0 DIADLO C[C@H]1Cc2ccc(F)cc2[C@@H]1Nc1ccc(N2CCCC2)[nH+]c1 ZINC000538558435 1047687608 /nfs/dbraw/zinc/68/76/08/1047687608.db2.gz AZLUIEGMKSNUML-ORAYPTAESA-N 1 2 311.404 4.166 20 0 DIADLO Cc1ccc(Cl)c(CNc2ccc(Cl)c(N)[nH+]2)c1F ZINC001155833140 1047689579 /nfs/dbraw/zinc/68/95/79/1047689579.db2.gz UEZUTJGUSUAGPB-UHFFFAOYSA-N 1 2 300.164 4.030 20 0 DIADLO [NH2+]=C(Nc1ncnc2ccc(F)cc21)C12CC3CC(CC(C3)C1)C2 ZINC001155956522 1047692982 /nfs/dbraw/zinc/69/29/82/1047692982.db2.gz SKQRYBMXTPFIQS-UHFFFAOYSA-N 1 2 324.403 4.374 20 0 DIADLO [NH2+]=C(Nc1ncc(F)cc1Cl)C12CC3CC(CC(C3)C1)C2 ZINC001155960186 1047693072 /nfs/dbraw/zinc/69/30/72/1047693072.db2.gz ULRUNYSPTIVBSO-UHFFFAOYSA-N 1 2 307.800 4.480 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)C[C@@H]2CCc3ccccc32)c(C)[nH+]1 ZINC000667119640 1047695481 /nfs/dbraw/zinc/69/54/81/1047695481.db2.gz YNFZIRGKWYSDCW-KRWDZBQOSA-N 1 2 323.440 4.201 20 0 DIADLO CCCc1ccc(C[NH2+]C2(c3noc(C)n3)CCCCC2)cc1 ZINC000538691723 1047696610 /nfs/dbraw/zinc/69/66/10/1047696610.db2.gz AUMNUTFALTUFHO-UHFFFAOYSA-N 1 2 313.445 4.280 20 0 DIADLO COc1ccc(O[C@@H](C)CNc2cc3ccccc3c[nH+]2)cc1 ZINC001156077206 1047698347 /nfs/dbraw/zinc/69/83/47/1047698347.db2.gz ZSUSZAVOUCLGKR-AWEZNQCLSA-N 1 2 308.381 4.123 20 0 DIADLO CNc1ccc(CNc2cc(C3CCCCC3)[nH+]c(C)n2)cc1 ZINC001156142842 1047702789 /nfs/dbraw/zinc/70/27/89/1047702789.db2.gz ZFWHWUBJFJKBBO-UHFFFAOYSA-N 1 2 310.445 4.487 20 0 DIADLO Cc1cc(N[C@H](c2cccnc2)C(F)(F)F)nc(C(C)C)[nH+]1 ZINC001156163430 1047703798 /nfs/dbraw/zinc/70/37/98/1047703798.db2.gz QBSNFROVSNMTOI-CYBMUJFWSA-N 1 2 310.323 4.019 20 0 DIADLO CC(C)(C)c1ccc(N[C@@H](c2cccnc2)C(F)(F)F)[nH+]c1 ZINC001156163633 1047703863 /nfs/dbraw/zinc/70/38/63/1047703863.db2.gz VFDPLNQESXFXLH-AWEZNQCLSA-N 1 2 309.335 4.490 20 0 DIADLO CCC[C@H]1C[N@H+](Cc2cnc(-c3ccc(C)cc3)s2)CCO1 ZINC000538725543 1047706181 /nfs/dbraw/zinc/70/61/81/1047706181.db2.gz CUFHPSINRIUYHW-INIZCTEOSA-N 1 2 316.470 4.119 20 0 DIADLO CCC[C@H]1C[N@@H+](Cc2cnc(-c3ccc(C)cc3)s2)CCO1 ZINC000538725543 1047706183 /nfs/dbraw/zinc/70/61/83/1047706183.db2.gz CUFHPSINRIUYHW-INIZCTEOSA-N 1 2 316.470 4.119 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCOC[C@H]2c2ccccc2)cc1 ZINC000538751938 1047708621 /nfs/dbraw/zinc/70/86/21/1047708621.db2.gz XVUYPUQJPZLUMR-FQEVSTJZSA-N 1 2 311.425 4.047 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCOC[C@H]2c2ccccc2)cc1 ZINC000538751938 1047708625 /nfs/dbraw/zinc/70/86/25/1047708625.db2.gz XVUYPUQJPZLUMR-FQEVSTJZSA-N 1 2 311.425 4.047 20 0 DIADLO CCOc1ccccc1C[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000538752854 1047709428 /nfs/dbraw/zinc/70/94/28/1047709428.db2.gz REJWCOIALWAZQE-KDOFPFPSSA-N 1 2 317.454 4.109 20 0 DIADLO CCOc1ccccc1C[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000538752854 1047709430 /nfs/dbraw/zinc/70/94/30/1047709430.db2.gz REJWCOIALWAZQE-KDOFPFPSSA-N 1 2 317.454 4.109 20 0 DIADLO CC(C)(C)C1=CC[N@H+](Cc2ccc(Br)cn2)CC1 ZINC000538797146 1047711257 /nfs/dbraw/zinc/71/12/57/1047711257.db2.gz QPYSTKFJGVGCJO-UHFFFAOYSA-N 1 2 309.251 4.022 20 0 DIADLO CC(C)(C)C1=CC[N@@H+](Cc2ccc(Br)cn2)CC1 ZINC000538797146 1047711261 /nfs/dbraw/zinc/71/12/61/1047711261.db2.gz QPYSTKFJGVGCJO-UHFFFAOYSA-N 1 2 309.251 4.022 20 0 DIADLO CCCn1cc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)cn1 ZINC000538796680 1047711516 /nfs/dbraw/zinc/71/15/16/1047711516.db2.gz PMNBUFFEWHSHFS-GOSISDBHSA-N 1 2 319.399 4.299 20 0 DIADLO CCCn1cc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)cn1 ZINC000538796680 1047711523 /nfs/dbraw/zinc/71/15/23/1047711523.db2.gz PMNBUFFEWHSHFS-GOSISDBHSA-N 1 2 319.399 4.299 20 0 DIADLO COc1ccc2c(c1)[nH+]c(N[C@H](C)CCO)cc2-c1ccccc1 ZINC001156451581 1047713356 /nfs/dbraw/zinc/71/33/56/1047713356.db2.gz KJCKCIHRRCULQU-CQSZACIVSA-N 1 2 322.408 4.093 20 0 DIADLO Clc1ccc([C@H]2COCCN2c2cccc(C3CC3)[nH+]2)cc1 ZINC001156731584 1047721265 /nfs/dbraw/zinc/72/12/65/1047721265.db2.gz NUJSKKFZXYJFDA-QGZVFWFLSA-N 1 2 314.816 4.190 20 0 DIADLO Clc1ccc([C@H]2COCCN2c2[nH+]ccc3ccccc32)cc1 ZINC001156714028 1047721380 /nfs/dbraw/zinc/72/13/80/1047721380.db2.gz JYQWUFPBTIVJGI-GOSISDBHSA-N 1 2 324.811 4.466 20 0 DIADLO CCSc1cc[nH+]c(NC2CC(C)(C)N(O)C(C)(C)C2)c1 ZINC001156890649 1047726553 /nfs/dbraw/zinc/72/65/53/1047726553.db2.gz BLUXMESBISCFJG-UHFFFAOYSA-N 1 2 309.479 4.016 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H]2CCc3c2cccc3Cl)s1 ZINC000539058815 1047729729 /nfs/dbraw/zinc/72/97/29/1047729729.db2.gz HDAYZFAQGPLFTD-CYBMUJFWSA-N 1 2 307.850 4.092 20 0 DIADLO CCCOCCNc1cc(SCc2ccccc2)cc[nH+]1 ZINC001157088495 1047735430 /nfs/dbraw/zinc/73/54/30/1047735430.db2.gz QWGVRLQRVCOPQY-UHFFFAOYSA-N 1 2 302.443 4.212 20 0 DIADLO CSCc1ccc(N[C@@H]2C[C@H]2c2ccc(F)c(F)c2)[nH+]c1 ZINC001157301297 1047739358 /nfs/dbraw/zinc/73/93/58/1047739358.db2.gz CPHQJKJTJXYZHB-SWLSCSKDSA-N 1 2 306.381 4.191 20 0 DIADLO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1nc2ccccc2n1C ZINC000539163112 1047739410 /nfs/dbraw/zinc/73/94/10/1047739410.db2.gz BXTMNVIYNQDSJH-YDHLFZDLSA-N 1 2 309.413 4.141 20 0 DIADLO CC(C)c1ccc(N2CCn3cc(-c4ccccc4)nc3C2)[nH+]c1 ZINC001157308459 1047739446 /nfs/dbraw/zinc/73/94/46/1047739446.db2.gz YSEJZGDIYQCLID-UHFFFAOYSA-N 1 2 318.424 4.089 20 0 DIADLO Cn1cc2cccc(CNc3[nH+]ccc4cc(Cl)ccc43)c2n1 ZINC001157415671 1047742877 /nfs/dbraw/zinc/74/28/77/1047742877.db2.gz WBAVYEDCXFBLAM-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO Cc1cccc(C2(Nc3cc(-c4ccccc4)cc[nH+]3)COC2)c1 ZINC001157674891 1047748351 /nfs/dbraw/zinc/74/83/51/1047748351.db2.gz ROVNJALDZUJVRK-UHFFFAOYSA-N 1 2 316.404 4.395 20 0 DIADLO CCCc1cc(N2CC=C(c3ccc(OC)cc3)CC2)nc(C)[nH+]1 ZINC001157734598 1047751514 /nfs/dbraw/zinc/75/15/14/1047751514.db2.gz QMXXFVMHBPARAH-UHFFFAOYSA-N 1 2 323.440 4.040 20 0 DIADLO COC1CCC(Nc2cc(C3CCCCC3)[nH+]c(C)n2)CC1 ZINC001157808173 1047755596 /nfs/dbraw/zinc/75/55/96/1047755596.db2.gz GKHAMOIOSOQYBF-UHFFFAOYSA-N 1 2 303.450 4.202 20 0 DIADLO Clc1cccc2c1ccnc2NCCc1cn2ccccc2[nH+]1 ZINC001158146354 1047770170 /nfs/dbraw/zinc/77/01/70/1047770170.db2.gz YXVYJUFBDSJHCI-UHFFFAOYSA-N 1 2 322.799 4.191 20 0 DIADLO Cc1cccn2cc(CNc3cc(-c4ccccc4)cc[nH+]3)nc12 ZINC001158154095 1047770773 /nfs/dbraw/zinc/77/07/73/1047770773.db2.gz CEBMFTMHDOINLC-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO Cc1cccn2cc(CNc3cc(C)c4ccccc4[nH+]3)nc12 ZINC001158155533 1047770836 /nfs/dbraw/zinc/77/08/36/1047770836.db2.gz BSGLQHLJSDJAFV-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc2c(c1)CCC(C)(C)O2 ZINC001213012421 1047771301 /nfs/dbraw/zinc/77/13/01/1047771301.db2.gz HHNOMRCSGUILRJ-UHFFFAOYSA-N 1 2 307.397 4.020 20 0 DIADLO CSc1cc[nH+]c(NCc2c(Cl)cncc2Cl)c1 ZINC001158302319 1047774322 /nfs/dbraw/zinc/77/43/22/1047774322.db2.gz BQWXOHPZGDIWMC-UHFFFAOYSA-N 1 2 300.214 4.117 20 0 DIADLO COc1cc2ccc(N[C@H]3CCCC(F)(F)C3)[nH+]c2cc1OC ZINC001158334897 1047775183 /nfs/dbraw/zinc/77/51/83/1047775183.db2.gz CFXUVFSWEPXIHB-LBPRGKRZSA-N 1 2 322.355 4.242 20 0 DIADLO CSc1cc[nH+]c(N[C@@H](CCO)c2cccc3ccccc32)c1 ZINC001158510037 1047787928 /nfs/dbraw/zinc/78/79/28/1047787928.db2.gz SWMMULJVWKXHHH-SFHVURJKSA-N 1 2 324.449 4.492 20 0 DIADLO C[C@H](Nc1cc(SCc2ccccc2)cc[nH+]1)c1cnccn1 ZINC001158601675 1047789889 /nfs/dbraw/zinc/78/98/89/1047789889.db2.gz VTLVKLOELSNGLC-AWEZNQCLSA-N 1 2 322.437 4.337 20 0 DIADLO C[C@H]([NH2+]Cc1cccc2ccccc21)c1nc(C(C)(C)C)no1 ZINC000237502901 1047790232 /nfs/dbraw/zinc/79/02/32/1047790232.db2.gz ACDWTSKVVVSZTJ-ZDUSSCGKSA-N 1 2 309.413 4.371 20 0 DIADLO COc1cc2c(cc1OC)CN(c1cc(C)c3ccccc3[nH+]1)C2 ZINC001158610171 1047792087 /nfs/dbraw/zinc/79/20/87/1047792087.db2.gz XVWRATOXEJXSAL-UHFFFAOYSA-N 1 2 320.392 4.081 20 0 DIADLO Fc1ccc2c(c1)[nH]c1nc[nH+]c(N[C@@H]3C[C@H]3c3ccccc3)c21 ZINC001158843097 1047801207 /nfs/dbraw/zinc/80/12/07/1047801207.db2.gz UTKMHTNJRFSRSF-GOEBONIOSA-N 1 2 318.355 4.218 20 0 DIADLO OC[C@@H](CNc1cc(-c2ccccc2)cc[nH+]1)Cc1ccccc1 ZINC001158915900 1047803915 /nfs/dbraw/zinc/80/39/15/1047803915.db2.gz JLAOZFIVGXPLGK-GOSISDBHSA-N 1 2 318.420 4.012 20 0 DIADLO FC(F)(F)COCCCNc1cc[nH+]c2c(Cl)cccc12 ZINC000552960310 1047810851 /nfs/dbraw/zinc/81/08/51/1047810851.db2.gz MBXQNZZZIZYQFM-UHFFFAOYSA-N 1 2 318.726 4.269 20 0 DIADLO Cc1ccc(Nc2cccc(NC(=O)OC(C)(C)C)n2)c(C)[nH+]1 ZINC001159107621 1047812044 /nfs/dbraw/zinc/81/20/44/1047812044.db2.gz SFCMHVOIVNOIET-UHFFFAOYSA-N 1 2 314.389 4.184 20 0 DIADLO CNc1ccc(Nc2ccc(NCc3ccccc3)cc2)c[nH+]1 ZINC001159253981 1047823532 /nfs/dbraw/zinc/82/35/32/1047823532.db2.gz OKMZJBQOEVOGAM-UHFFFAOYSA-N 1 2 304.397 4.479 20 0 DIADLO Cc1ccc(OCc2ccccc2)c(Nc2ccc(N)[nH+]c2)c1 ZINC001159281188 1047825848 /nfs/dbraw/zinc/82/58/48/1047825848.db2.gz QRIDESLXRKCVDJ-UHFFFAOYSA-N 1 2 305.381 4.295 20 0 DIADLO Cc1ccc(OCc2ccccc2)cc1Nc1ccc(N)[nH+]c1 ZINC001159281910 1047825951 /nfs/dbraw/zinc/82/59/51/1047825951.db2.gz IVLNNAWCDMZPTB-UHFFFAOYSA-N 1 2 305.381 4.295 20 0 DIADLO Cc1ccc(Nc2ccc(N)[nH+]c2)cc1OCc1ccccc1 ZINC001159282596 1047826357 /nfs/dbraw/zinc/82/63/57/1047826357.db2.gz YZVYANMWEVBFFT-UHFFFAOYSA-N 1 2 305.381 4.295 20 0 DIADLO Clc1cccc2c(N(Cc3ccccn3)C3CC3)cc[nH+]c12 ZINC000553248063 1047832603 /nfs/dbraw/zinc/83/26/03/1047832603.db2.gz AQTMJYHNBPAZLU-UHFFFAOYSA-N 1 2 309.800 4.452 20 0 DIADLO Nc1ccc2cc(Nc3ccc(N4CCCC4)[nH+]c3)ccc2c1 ZINC001159366316 1047836380 /nfs/dbraw/zinc/83/63/80/1047836380.db2.gz VXBWALBYRDHQJC-UHFFFAOYSA-N 1 2 304.397 4.161 20 0 DIADLO Nc1ccc2cc(Nc3ccc(-n4cc[nH+]c4)cc3)ccc2c1 ZINC001159429806 1047843183 /nfs/dbraw/zinc/84/31/83/1047843183.db2.gz CGLNYGOPXCTAFT-UHFFFAOYSA-N 1 2 300.365 4.351 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2ccccc2Br)o1 ZINC001204388734 1047843810 /nfs/dbraw/zinc/84/38/10/1047843810.db2.gz BKAPGRIWODKRFH-UHFFFAOYSA-N 1 2 308.219 4.237 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2ccccc2Br)o1 ZINC001204388734 1047843825 /nfs/dbraw/zinc/84/38/25/1047843825.db2.gz BKAPGRIWODKRFH-UHFFFAOYSA-N 1 2 308.219 4.237 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CCc4ccc(C(C)C)cc4C3)cn2c1 ZINC001182781311 1047846122 /nfs/dbraw/zinc/84/61/22/1047846122.db2.gz LNVLWBARGXNQAQ-UHFFFAOYSA-N 1 2 319.452 4.324 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CCc4ccc(C(C)C)cc4C3)cn2c1 ZINC001182781311 1047846138 /nfs/dbraw/zinc/84/61/38/1047846138.db2.gz LNVLWBARGXNQAQ-UHFFFAOYSA-N 1 2 319.452 4.324 20 0 DIADLO C[C@H](CCc1ccc2c(c1)OCO2)Nc1c[nH+]cc2c1CCCC2 ZINC001182844682 1047846463 /nfs/dbraw/zinc/84/64/63/1047846463.db2.gz OIRQDTIQMIJHRJ-CQSZACIVSA-N 1 2 324.424 4.122 20 0 DIADLO c1cncc([C@H]2CCC[C@@H](Nc3c[nH+]cc4c3CCCC4)C2)c1 ZINC001182844937 1047847706 /nfs/dbraw/zinc/84/77/06/1047847706.db2.gz PKCYDVHUVVRIMC-MAUKXSAKSA-N 1 2 307.441 4.494 20 0 DIADLO c1cncc([C@@H]2CCC[C@@H](Nc3c[nH+]cc4c3CCCC4)C2)c1 ZINC001182844936 1047848103 /nfs/dbraw/zinc/84/81/03/1047848103.db2.gz PKCYDVHUVVRIMC-CRAIPNDOSA-N 1 2 307.441 4.494 20 0 DIADLO CNc1ccc(Nc2ccc(Br)c(Cl)c2)c[nH+]1 ZINC001159484156 1047855074 /nfs/dbraw/zinc/85/50/74/1047855074.db2.gz CDPOROZESMGGON-UHFFFAOYSA-N 1 2 312.598 4.283 20 0 DIADLO c1c[nH+]c(N2CCCCC2)c(Nc2ccc(N3CCCC3)cc2)c1 ZINC001174525580 1047855257 /nfs/dbraw/zinc/85/52/57/1047855257.db2.gz YUUQZUANYXBPHS-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO Cc1cn2c(cccc2NC(=O)Nc2c(C)cccc2Cl)[nH+]1 ZINC001182901079 1047859775 /nfs/dbraw/zinc/85/97/75/1047859775.db2.gz WGPUYLPBXZKXGW-UHFFFAOYSA-N 1 2 314.776 4.249 20 0 DIADLO Fc1cc(Nc2cccc3[nH+]ccn32)ccc1OC(F)(F)F ZINC001213018209 1047860775 /nfs/dbraw/zinc/86/07/75/1047860775.db2.gz JSBHITYACCLSNW-UHFFFAOYSA-N 1 2 311.238 4.116 20 0 DIADLO Clc1cccc2c(N3CCOC4(CCCC4)C3)cc[nH+]c12 ZINC000553481596 1047861109 /nfs/dbraw/zinc/86/11/09/1047861109.db2.gz RJTBTTYNINZMRM-UHFFFAOYSA-N 1 2 302.805 4.038 20 0 DIADLO CNc1ncc2cc(Nc3ccc4c(C)cc[nH+]c4c3)ccc2n1 ZINC001174534361 1047862727 /nfs/dbraw/zinc/86/27/27/1047862727.db2.gz UFBPXUFKVOGXJJ-UHFFFAOYSA-N 1 2 315.380 4.272 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2cccs2)c2ccc(F)cc2)on1 ZINC000553485503 1047863806 /nfs/dbraw/zinc/86/38/06/1047863806.db2.gz SOSCMNBPFNKZIG-INIZCTEOSA-N 1 2 302.374 4.063 20 0 DIADLO CCSc1cccc(C[N@@H+]2C[C@@H](C)O[C@](C)(C(F)F)C2)c1 ZINC001182969346 1047870733 /nfs/dbraw/zinc/87/07/33/1047870733.db2.gz HKKIEIIRKKRKHY-WBMJQRKESA-N 1 2 315.429 4.043 20 0 DIADLO CCSc1cccc(C[N@H+]2C[C@@H](C)O[C@](C)(C(F)F)C2)c1 ZINC001182969346 1047870745 /nfs/dbraw/zinc/87/07/45/1047870745.db2.gz HKKIEIIRKKRKHY-WBMJQRKESA-N 1 2 315.429 4.043 20 0 DIADLO c1cc(-c2cccc(Nc3ccc(-n4cc[nH+]c4)cc3)c2)n[nH]1 ZINC001174508589 1047872956 /nfs/dbraw/zinc/87/29/56/1047872956.db2.gz SIMQZWYIDHVMBR-UHFFFAOYSA-N 1 2 301.353 4.006 20 0 DIADLO Oc1ccc(CNc2ccc(Nc3ccccc3)c[nH+]2)cc1F ZINC001182979318 1047877428 /nfs/dbraw/zinc/87/74/28/1047877428.db2.gz UWDPTLJZDCARDV-UHFFFAOYSA-N 1 2 309.344 4.282 20 0 DIADLO CC(=O)c1ccc(C)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174523562 1047884741 /nfs/dbraw/zinc/88/47/41/1047884741.db2.gz ORLKRPVVIZWCJE-UHFFFAOYSA-N 1 2 309.413 4.327 20 0 DIADLO O=c1ccc2cc(Nc3ccc(N4CCCCC4)[nH+]c3)c[nH]c-2c1 ZINC001174523010 1047885704 /nfs/dbraw/zinc/88/57/04/1047885704.db2.gz SWUUAWKJJWRYGF-UHFFFAOYSA-N 1 2 320.396 4.069 20 0 DIADLO Oc1cccc(Cl)c1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174524846 1047887425 /nfs/dbraw/zinc/88/74/25/1047887425.db2.gz RNNQVTYVEAXZPT-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO c1coc(-c2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc2)n1 ZINC001174524661 1047887668 /nfs/dbraw/zinc/88/76/68/1047887668.db2.gz NOOJDFZEOPPYEC-UHFFFAOYSA-N 1 2 320.396 4.471 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H](C)c3cccc(N)c3)c(C)cc2c1 ZINC001159636009 1047889408 /nfs/dbraw/zinc/88/94/08/1047889408.db2.gz LJJGLIMEWWYMIZ-ZDUSSCGKSA-N 1 2 307.397 4.307 20 0 DIADLO CC(C)(O)c1cncc(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001174591049 1047897614 /nfs/dbraw/zinc/89/76/14/1047897614.db2.gz KQZGMDPVACEZGE-UHFFFAOYSA-N 1 2 311.429 4.043 20 0 DIADLO C[C@@H]1COCC[C@H]1Nc1cc(SCc2ccccc2)cc[nH+]1 ZINC001159719050 1047908704 /nfs/dbraw/zinc/90/87/04/1047908704.db2.gz OOKBXBHSJOIFDV-RHSMWYFYSA-N 1 2 314.454 4.211 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)N(C)Cc1c[nH+]c2n1CCC2 ZINC000667499723 1047910798 /nfs/dbraw/zinc/91/07/98/1047910798.db2.gz SWVIOSQMWHMJCQ-LLVKDONJSA-N 1 2 324.255 4.329 20 0 DIADLO Cc1ccc(NC(=S)Nc2cccc(-n3cc[nH+]c3)c2)c(C)c1 ZINC001197988825 1047916734 /nfs/dbraw/zinc/91/67/34/1047916734.db2.gz KYOJIGMPVJERHW-UHFFFAOYSA-N 1 2 322.437 4.298 20 0 DIADLO Cc1ccc2c(Nc3cnn([C@@H]4CCCCO4)c3)cccc2[nH+]1 ZINC001174605434 1047923490 /nfs/dbraw/zinc/92/34/90/1047923490.db2.gz PTTCCCYHJXVMQM-SFHVURJKSA-N 1 2 308.385 4.182 20 0 DIADLO C[C@@H]([NH2+]C/C(Cl)=C/Cl)c1cc(Cl)cc2c1OCC2 ZINC001198105336 1047927311 /nfs/dbraw/zinc/92/73/11/1047927311.db2.gz WTZPWWRBARRQJT-QKNMJKLUSA-N 1 2 306.620 4.245 20 0 DIADLO C[C@H]([NH2+]C/C(Cl)=C/Cl)c1cc(Cl)cc2c1OCC2 ZINC001198105334 1047928442 /nfs/dbraw/zinc/92/84/42/1047928442.db2.gz WTZPWWRBARRQJT-OITNDJBGSA-N 1 2 306.620 4.245 20 0 DIADLO COC(=O)[C@]1([NH2+]Cc2c(C)cc(C)cc2C)CCCC(C)(C)C1 ZINC001174679993 1047932983 /nfs/dbraw/zinc/93/29/83/1047932983.db2.gz AJSSCSZNTGXXLA-FQEVSTJZSA-N 1 2 317.473 4.213 20 0 DIADLO Cc1cc(N[C@H]2CCc3ccc(O)cc3C2)[nH+]c2ccccc12 ZINC001159892090 1047941768 /nfs/dbraw/zinc/94/17/68/1047941768.db2.gz AEVCGYTVODKCLD-INIZCTEOSA-N 1 2 304.393 4.218 20 0 DIADLO Cc1ccc2c(Nc3ccc(N4CCOCC4)cc3)cccc2[nH+]1 ZINC001174710269 1047948882 /nfs/dbraw/zinc/94/88/82/1047948882.db2.gz LVDJVUKEQANUGK-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO C[C@@H]1CCOCC[N@@H+]1Cn1c(-c2ccccc2)csc1=S ZINC000774661087 1047954189 /nfs/dbraw/zinc/95/41/89/1047954189.db2.gz SHHMERPECZCGBA-CYBMUJFWSA-N 1 2 320.483 4.014 20 0 DIADLO C[C@@H]1CCOCC[N@H+]1Cn1c(-c2ccccc2)csc1=S ZINC000774661087 1047954196 /nfs/dbraw/zinc/95/41/96/1047954196.db2.gz SHHMERPECZCGBA-CYBMUJFWSA-N 1 2 320.483 4.014 20 0 DIADLO Cc1ccccc1NC(=S)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001198427470 1047955582 /nfs/dbraw/zinc/95/55/82/1047955582.db2.gz CBDZRHJEMJVLTD-UHFFFAOYSA-N 1 2 322.437 4.049 20 0 DIADLO CCO[C@@H]1CCC[N@H+](Cc2ccc(F)c(Cl)c2Cl)C1 ZINC001204146510 1047956349 /nfs/dbraw/zinc/95/63/49/1047956349.db2.gz VSYYOYNUHAWKQI-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@@H]1CCC[N@@H+](Cc2ccc(F)c(Cl)c2Cl)C1 ZINC001204146510 1047956357 /nfs/dbraw/zinc/95/63/57/1047956357.db2.gz VSYYOYNUHAWKQI-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@H+]1Cc1cnc2ccccc2c1 ZINC000794432910 1047965425 /nfs/dbraw/zinc/96/54/25/1047965425.db2.gz GOZXSSOUSZYCCQ-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@@H+]1Cc1cnc2ccccc2c1 ZINC000794432910 1047965439 /nfs/dbraw/zinc/96/54/39/1047965439.db2.gz GOZXSSOUSZYCCQ-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO COc1cccc([C@@H](C)CC(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)c1 ZINC000479772898 1047965434 /nfs/dbraw/zinc/96/54/34/1047965434.db2.gz JPEYVPYUGLZOPE-LBPRGKRZSA-N 1 2 323.396 4.012 20 0 DIADLO FC(F)(F)c1ccc(Nc2[nH+]cccc2N2CCCC2)cc1 ZINC001174772728 1047966428 /nfs/dbraw/zinc/96/64/28/1047966428.db2.gz DTLXEXHBSAUMPB-UHFFFAOYSA-N 1 2 307.319 4.444 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C/C=C/c3ccc(C)cc3)cc2[nH+]1 ZINC000479794862 1047970072 /nfs/dbraw/zinc/97/00/72/1047970072.db2.gz HKKNXNRKZSYZBI-ONEGZZNKSA-N 1 2 305.381 4.222 20 0 DIADLO COC(=O)c1cc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)c(C)o1 ZINC000553991829 1047978530 /nfs/dbraw/zinc/97/85/30/1047978530.db2.gz MHHDUCVRNIRYAF-HNNXBMFYSA-N 1 2 319.426 4.019 20 0 DIADLO COC(=O)c1cc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)c(C)o1 ZINC000553991829 1047978540 /nfs/dbraw/zinc/97/85/40/1047978540.db2.gz MHHDUCVRNIRYAF-HNNXBMFYSA-N 1 2 319.426 4.019 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)cccc2Cl)nc1 ZINC001198597228 1047981359 /nfs/dbraw/zinc/98/13/59/1047981359.db2.gz RRDYWBKDOXCNGN-KRWDZBQOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)cccc2Cl)nc1 ZINC001198597228 1047981368 /nfs/dbraw/zinc/98/13/68/1047981368.db2.gz RRDYWBKDOXCNGN-KRWDZBQOSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)c1ccc(NC(=S)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001198597419 1047983034 /nfs/dbraw/zinc/98/30/34/1047983034.db2.gz XCDKTCSYIUWNSO-UHFFFAOYSA-N 1 2 310.426 4.267 20 0 DIADLO COc1cc(C)nc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)c1 ZINC000553987731 1047984172 /nfs/dbraw/zinc/98/41/72/1047984172.db2.gz SGEUZOOGDMHWPZ-MRXNPFEDSA-N 1 2 302.443 4.043 20 0 DIADLO COc1cc(C)nc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)c1 ZINC000553987731 1047984182 /nfs/dbraw/zinc/98/41/82/1047984182.db2.gz SGEUZOOGDMHWPZ-MRXNPFEDSA-N 1 2 302.443 4.043 20 0 DIADLO CCc1ccc([C@@H](C)NC[C@@H](c2cccs2)[NH+]2CCCC2)o1 ZINC000479847649 1047987642 /nfs/dbraw/zinc/98/76/42/1047987642.db2.gz CJMMZMUARBJFJZ-ZBFHGGJFSA-N 1 2 318.486 4.391 20 0 DIADLO Fc1ccc(C[NH+]2CCC(OC3CCCC3)CC2)c(F)c1F ZINC000667568604 1047994775 /nfs/dbraw/zinc/99/47/75/1047994775.db2.gz JVCLSTYHUBMZOG-UHFFFAOYSA-N 1 2 313.363 4.028 20 0 DIADLO COc1cc(Nc2ccc(Oc3cccnc3)cc2)cc(C)[nH+]1 ZINC001174848404 1047998438 /nfs/dbraw/zinc/99/84/38/1047998438.db2.gz CZDQQHMCTLACJE-UHFFFAOYSA-N 1 2 307.353 4.330 20 0 DIADLO CN(c1ccc(Nc2ccc(F)c(N)c2)c[nH+]1)C1CCCCC1 ZINC001160241418 1048008922 /nfs/dbraw/zinc/00/89/22/1048008922.db2.gz NFAMFFVJWKVRQJ-UHFFFAOYSA-N 1 2 314.408 4.315 20 0 DIADLO c1cnc2cccc(Nc3ccc[nH+]c3N3CCCCC3)c2c1 ZINC001174903337 1048018678 /nfs/dbraw/zinc/01/86/78/1048018678.db2.gz BTNROIVMTWLXRB-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO c1cn(Cc2ccc(Nc3cccc4ncccc43)cc2)c[nH+]1 ZINC001174908071 1048020876 /nfs/dbraw/zinc/02/08/76/1048020876.db2.gz UOVKOMCVWFGEFP-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(Br)c(N)c1 ZINC001160304390 1048026901 /nfs/dbraw/zinc/02/69/01/1048026901.db2.gz DJQLWMFLSZVYLF-UHFFFAOYSA-N 1 2 318.218 4.356 20 0 DIADLO Fc1ccc(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)c(F)c1F ZINC000667591284 1048027795 /nfs/dbraw/zinc/02/77/95/1048027795.db2.gz ONBZBUCBSCHTIV-INIZCTEOSA-N 1 2 321.342 4.068 20 0 DIADLO Fc1ccc(C[N@H+]2CCCO[C@H](c3ccccc3)C2)c(F)c1F ZINC000667591284 1048027807 /nfs/dbraw/zinc/02/78/07/1048027807.db2.gz ONBZBUCBSCHTIV-INIZCTEOSA-N 1 2 321.342 4.068 20 0 DIADLO CC(C)C[N@H+](Cc1noc(C(C)(C)C)n1)Cc1ccccc1 ZINC000554196588 1048028157 /nfs/dbraw/zinc/02/81/57/1048028157.db2.gz UPJNUPUXJCMGIH-UHFFFAOYSA-N 1 2 301.434 4.025 20 0 DIADLO CC(C)C[N@@H+](Cc1noc(C(C)(C)C)n1)Cc1ccccc1 ZINC000554196588 1048028166 /nfs/dbraw/zinc/02/81/66/1048028166.db2.gz UPJNUPUXJCMGIH-UHFFFAOYSA-N 1 2 301.434 4.025 20 0 DIADLO Cc1c(N)cccc1Nc1ccc(N(C)Cc2ccccc2)[nH+]c1 ZINC001160310596 1048029063 /nfs/dbraw/zinc/02/90/63/1048029063.db2.gz VBODUJDIMSUTKD-UHFFFAOYSA-N 1 2 318.424 4.352 20 0 DIADLO CC[C@H](C)c1ccccc1Nc1ccc(N2CCOCC2)[nH+]c1 ZINC001174974521 1048036589 /nfs/dbraw/zinc/03/65/89/1048036589.db2.gz OHSGCIYBOJVHIB-HNNXBMFYSA-N 1 2 311.429 4.175 20 0 DIADLO Cc1cccc(Nc2ccc(O[C@@H]3CC[NH2+]CC3(F)F)cc2)c1 ZINC001160341605 1048037771 /nfs/dbraw/zinc/03/77/71/1048037771.db2.gz UBDVYGRDTOMZMQ-QGZVFWFLSA-N 1 2 318.367 4.115 20 0 DIADLO CCSc1cc[nH+]c(NCc2ccn(Cc3ccccc3)n2)c1 ZINC001160390355 1048044164 /nfs/dbraw/zinc/04/41/64/1048044164.db2.gz NYRRNGWYQCPXSE-UHFFFAOYSA-N 1 2 324.453 4.051 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2csc(C(C)(C)C)n2)C1 ZINC000554265636 1048050091 /nfs/dbraw/zinc/05/00/91/1048050091.db2.gz UHGXPJSZSUFERI-XJKSGUPXSA-N 1 2 315.486 4.419 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2csc(C(C)(C)C)n2)C1 ZINC000554265636 1048050104 /nfs/dbraw/zinc/05/01/04/1048050104.db2.gz UHGXPJSZSUFERI-XJKSGUPXSA-N 1 2 315.486 4.419 20 0 DIADLO CN(Cc1cccc(Cl)c1)c1nc2ccccc2n2c[nH+]cc12 ZINC001184515625 1048056291 /nfs/dbraw/zinc/05/62/91/1048056291.db2.gz AHRFHAPZNUNBNP-UHFFFAOYSA-N 1 2 322.799 4.172 20 0 DIADLO Cc1ccc2c(C(=O)Nc3cccc4[nH+]ccn43)csc2c1 ZINC000480109741 1048056437 /nfs/dbraw/zinc/05/64/37/1048056437.db2.gz OFVCSWROKUNOPU-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO Cc1nc2ccc(NCc3c[nH+]c4c(C)cccn34)cc2s1 ZINC001199505487 1048067995 /nfs/dbraw/zinc/06/79/95/1048067995.db2.gz JPFALKUGPZQXNF-UHFFFAOYSA-N 1 2 308.410 4.173 20 0 DIADLO COC1CCC(CCNc2[nH+]cnc3[nH]c4ccccc4c32)CC1 ZINC001160641887 1048074336 /nfs/dbraw/zinc/07/43/36/1048074336.db2.gz LFKLYIAZVBTFQO-UHFFFAOYSA-N 1 2 324.428 4.118 20 0 DIADLO Cc1cccc(OCCCNc2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC001184667050 1048076035 /nfs/dbraw/zinc/07/60/35/1048076035.db2.gz SGGIYYXSEDTLQV-UHFFFAOYSA-N 1 2 311.429 4.242 20 0 DIADLO CCc1cc(NCCCO[C@H](C)c2ccccc2)nc(CC)[nH+]1 ZINC001184666469 1048077147 /nfs/dbraw/zinc/07/71/47/1048077147.db2.gz NANJUZLRHZANLB-OAHLLOKOSA-N 1 2 313.445 4.181 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3nc(C)c(Cl)cc3C)c[nH+]c12 ZINC001160686282 1048077200 /nfs/dbraw/zinc/07/72/00/1048077200.db2.gz DJNQVMQWSYVDDB-ZDUSSCGKSA-N 1 2 314.820 4.481 20 0 DIADLO Cc1nc2ccsc2c(N[C@@H](C)c2c[nH+]c3c(C)cccn23)n1 ZINC001160683699 1048077626 /nfs/dbraw/zinc/07/76/26/1048077626.db2.gz UGFPXFDLZTZOPJ-NSHDSACASA-N 1 2 323.425 4.129 20 0 DIADLO Cc1ccc2c(cccc2Nc2ccc(N3CCOCC3)[nH+]c2)c1 ZINC001174979965 1048079220 /nfs/dbraw/zinc/07/92/20/1048079220.db2.gz LANQYOYVHZITJE-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO C[C@@H](CCCC(F)(F)F)Nc1ccc(N2CCCC2)c[nH+]1 ZINC000480177372 1048080047 /nfs/dbraw/zinc/08/00/47/1048080047.db2.gz HKUOQDWWBZPEKJ-LBPRGKRZSA-N 1 2 301.356 4.215 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccc(Cl)cn1 ZINC000480194502 1048081405 /nfs/dbraw/zinc/08/14/05/1048081405.db2.gz HXAZSFMMGYWNAH-OTYXRUKQSA-N 1 2 309.196 4.173 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccc(Cl)cn1 ZINC000480194506 1048082520 /nfs/dbraw/zinc/08/25/20/1048082520.db2.gz HXAZSFMMGYWNAH-YMTOWFKASA-N 1 2 309.196 4.173 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](CCc3ccccc3Cl)CCO2)cc1 ZINC000480194943 1048082875 /nfs/dbraw/zinc/08/28/75/1048082875.db2.gz GLBAVHFEXHYJRO-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](CCc3ccccc3Cl)CCO2)cc1 ZINC000480194943 1048082892 /nfs/dbraw/zinc/08/28/92/1048082892.db2.gz GLBAVHFEXHYJRO-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2ccccc2)C2CCCCC2)no1 ZINC000776005121 1048083779 /nfs/dbraw/zinc/08/37/79/1048083779.db2.gz BQFISCZGGHTABA-LJQANCHMSA-N 1 2 313.445 4.433 20 0 DIADLO COc1ccc(Nc2cccc3[nH+]ccn32)cc1C(F)(F)F ZINC001175069557 1048089323 /nfs/dbraw/zinc/08/93/23/1048089323.db2.gz SQKXFLJGBKTSDC-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO Clc1cnc(Br)c(Nc2cccc3[nH+]c[nH]c32)c1 ZINC001213026997 1048089525 /nfs/dbraw/zinc/08/95/25/1048089525.db2.gz CLCMJRTWTYZAFW-UHFFFAOYSA-N 1 2 323.581 4.117 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H](C)c2ccc(Br)cc2)o1 ZINC000774786087 1048093950 /nfs/dbraw/zinc/09/39/50/1048093950.db2.gz ITGYDRAXGWAMBQ-LLVKDONJSA-N 1 2 323.234 4.411 20 0 DIADLO Clc1cc(Nc2cccc3[nH+]c[nH]c32)cnc1Br ZINC001213028023 1048098754 /nfs/dbraw/zinc/09/87/54/1048098754.db2.gz FTNMQZUFYBZBEI-UHFFFAOYSA-N 1 2 323.581 4.117 20 0 DIADLO Clc1ccc(C[NH2+]Cc2nc3cc(Cl)ccc3s2)nc1 ZINC001199776477 1048100170 /nfs/dbraw/zinc/10/01/70/1048100170.db2.gz DIFQVXIPDXVWQI-UHFFFAOYSA-N 1 2 324.236 4.288 20 0 DIADLO Oc1cc(Cl)cc(C[NH2+]Cc2coc(-c3cccs3)n2)c1 ZINC001199777179 1048102001 /nfs/dbraw/zinc/10/20/01/1048102001.db2.gz OOLIQPBUFMLICF-UHFFFAOYSA-N 1 2 320.801 4.052 20 0 DIADLO CCOc1ccc(F)c(Nc2cccn3cc(C)[nH+]c23)c1F ZINC001175037261 1048102022 /nfs/dbraw/zinc/10/20/22/1048102022.db2.gz NJDPZEXYCIGRHZ-UHFFFAOYSA-N 1 2 303.312 4.063 20 0 DIADLO CCOc1ccc(F)c(Nc2cc(Cl)c3[nH+]ccn3c2)c1F ZINC001175038155 1048102108 /nfs/dbraw/zinc/10/21/08/1048102108.db2.gz CTYMZMJBMDFUQT-UHFFFAOYSA-N 1 2 323.730 4.408 20 0 DIADLO CCOc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1F ZINC001175069338 1048105338 /nfs/dbraw/zinc/10/53/38/1048105338.db2.gz SQRQSHXEVFMZAK-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO Cc1cc(Cl)c(Nc2ccc[nH+]c2N2CCCC2)cc1O ZINC001184965031 1048105503 /nfs/dbraw/zinc/10/55/03/1048105503.db2.gz QPIVAWYCQHCJJE-UHFFFAOYSA-N 1 2 303.793 4.093 20 0 DIADLO O=C1CCCCc2c(Nc3ccc[nH+]c3N3CCCC3)cccc21 ZINC001184965064 1048105577 /nfs/dbraw/zinc/10/55/77/1048105577.db2.gz RIEYTFGERIDOQN-UHFFFAOYSA-N 1 2 321.424 4.335 20 0 DIADLO Clc1ccccc1-n1nccc1Nc1cccc2[nH+]c[nH]c21 ZINC001213029211 1048106365 /nfs/dbraw/zinc/10/63/65/1048106365.db2.gz IOTINYFEWLPRHQ-UHFFFAOYSA-N 1 2 309.760 4.146 20 0 DIADLO Oc1cc(Cl)c(Nc2ccc[nH+]c2N2CCCC2)cc1Cl ZINC001184969182 1048107261 /nfs/dbraw/zinc/10/72/61/1048107261.db2.gz XCGZURYVDXOCGC-UHFFFAOYSA-N 1 2 324.211 4.438 20 0 DIADLO Fc1cc(F)c(Nc2ccc[nH+]c2N2CCCC2)cc1Cl ZINC001184967471 1048107903 /nfs/dbraw/zinc/10/79/03/1048107903.db2.gz DBYDTTOVRRKOCN-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO CCOc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)ccc1F ZINC001175050123 1048110378 /nfs/dbraw/zinc/11/03/78/1048110378.db2.gz BTNGXUNZGNZZTA-UHFFFAOYSA-N 1 2 315.392 4.353 20 0 DIADLO CCN(CC)c1ccc(N[C@H](C)c2ccc(Cl)cn2)c[nH+]1 ZINC000480285303 1048113292 /nfs/dbraw/zinc/11/32/92/1048113292.db2.gz POUGMGHWATURRR-GFCCVEGCSA-N 1 2 304.825 4.149 20 0 DIADLO Cc1ccc(-c2cc(Nc3cccc4[nH+]c[nH]c43)n(C)n2)cc1 ZINC001213030694 1048113896 /nfs/dbraw/zinc/11/38/96/1048113896.db2.gz MTFDIYHENCKWRO-UHFFFAOYSA-N 1 2 303.369 4.015 20 0 DIADLO COc1ccc(C2(Nc3cc(C)[nH+]c(C(C)(C)C)n3)CC2)cc1 ZINC001161264117 1048118570 /nfs/dbraw/zinc/11/85/70/1048118570.db2.gz MOVCJIFMXXPEMK-UHFFFAOYSA-N 1 2 311.429 4.192 20 0 DIADLO Fc1cc(F)cc(C[NH2+]C2(c3c(F)cccc3F)CCC2)c1 ZINC001175104205 1048120024 /nfs/dbraw/zinc/12/00/24/1048120024.db2.gz UXYPJURMAKNLLC-UHFFFAOYSA-N 1 2 309.306 4.412 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)cc3c2OCC3)cs1 ZINC000927142753 1048120943 /nfs/dbraw/zinc/12/09/43/1048120943.db2.gz XAAYMYVHCQRQTD-UWVGGRQHSA-N 1 2 322.861 4.452 20 0 DIADLO CCN(CC)C(=O)c1cc(Nc2cccc(C)[nH+]2)ccc1Cl ZINC001185042751 1048121959 /nfs/dbraw/zinc/12/19/59/1048121959.db2.gz IKRMEHPYQDRZCA-UHFFFAOYSA-N 1 2 317.820 4.269 20 0 DIADLO Fc1cncc2cccc(Nc3ccc[nH+]c3N3CCCC3)c12 ZINC001185043390 1048122210 /nfs/dbraw/zinc/12/22/10/1048122210.db2.gz NCPPWWXOLBKTDD-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO c1ccc(-c2ccncc2)c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001185042716 1048122578 /nfs/dbraw/zinc/12/25/78/1048122578.db2.gz GZTJHCIKIRIJSK-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO CC[C@@H](Nc1ccc2cc(OC)c(OC)cc2[nH+]1)C(F)(F)F ZINC001161375537 1048125055 /nfs/dbraw/zinc/12/50/55/1048125055.db2.gz NUPGTJRXAYRLQR-CYBMUJFWSA-N 1 2 314.307 4.005 20 0 DIADLO Cc1nc(N[C@@H]2CCCc3nccnc32)cc(C2CCCCC2)[nH+]1 ZINC001161409564 1048127338 /nfs/dbraw/zinc/12/73/38/1048127338.db2.gz QODDOAHRERFAFO-MRXNPFEDSA-N 1 2 323.444 4.112 20 0 DIADLO FC(F)(F)COc1ccc(Nc2cccc3[nH+]c[nH]c32)cc1 ZINC001213032586 1048129366 /nfs/dbraw/zinc/12/93/66/1048129366.db2.gz NLRRSKTVKANFFA-UHFFFAOYSA-N 1 2 307.275 4.248 20 0 DIADLO c1[nH]c2c(cccc2Nc2ccc(OCc3ccncc3)cc2)[nH+]1 ZINC001213032774 1048130831 /nfs/dbraw/zinc/13/08/31/1048130831.db2.gz XJCDXGZNORXTFO-UHFFFAOYSA-N 1 2 316.364 4.281 20 0 DIADLO FC(F)[C@@H]1CCCCN1CCCC[N@@H+]1CCCC[C@H]1C(F)F ZINC000554567360 1048134641 /nfs/dbraw/zinc/13/46/41/1048134641.db2.gz DCZKDSJIMYJONT-KBPBESRZSA-N 1 2 324.406 4.006 20 0 DIADLO FC(F)[C@@H]1CCCCN1CCCC[N@H+]1CCCC[C@H]1C(F)F ZINC000554567360 1048134646 /nfs/dbraw/zinc/13/46/46/1048134646.db2.gz DCZKDSJIMYJONT-KBPBESRZSA-N 1 2 324.406 4.006 20 0 DIADLO Cc1c2ccc(F)cc2sc1C(=O)Nc1cc(C)[nH+]cc1C ZINC000554593145 1048136075 /nfs/dbraw/zinc/13/60/75/1048136075.db2.gz BIUTZVDGCYXSOV-UHFFFAOYSA-N 1 2 314.385 4.035 20 0 DIADLO FC(F)(F)COc1ccccc1Nc1cccc2[nH+]c[nH]c21 ZINC001213033440 1048137045 /nfs/dbraw/zinc/13/70/45/1048137045.db2.gz GMNTZYUKXPQKFE-UHFFFAOYSA-N 1 2 307.275 4.248 20 0 DIADLO CCSc1cc[nH+]c(N[C@H](C)c2ccc3c(c2)OCO3)c1 ZINC001161517943 1048137440 /nfs/dbraw/zinc/13/74/40/1048137440.db2.gz RZNYCLUMXWVAHR-LLVKDONJSA-N 1 2 302.399 4.095 20 0 DIADLO Fc1cc(F)c(Nc2cccc(Cn3cc[nH+]c3)c2)cc1F ZINC001175086926 1048137869 /nfs/dbraw/zinc/13/78/69/1048137869.db2.gz PLYNJVYWHZXZIQ-UHFFFAOYSA-N 1 2 303.287 4.092 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc2ccc(Cl)cc2n1 ZINC001161565370 1048138060 /nfs/dbraw/zinc/13/80/60/1048138060.db2.gz NXHSZFUENVONFB-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO Cc1cc2c(nc(Cl)nc2NCc2c[nH+]cn2C(C)C)s1 ZINC001161562946 1048138613 /nfs/dbraw/zinc/13/86/13/1048138613.db2.gz ITOWHLHKGBQMIV-UHFFFAOYSA-N 1 2 321.837 4.043 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc2c(Cl)cccc2n1 ZINC001161565051 1048139119 /nfs/dbraw/zinc/13/91/19/1048139119.db2.gz JHQKKMCMJKWCPC-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO Cn1ncc(C2CCC2)c1C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000667671834 1048140332 /nfs/dbraw/zinc/14/03/32/1048140332.db2.gz AYZCLAZDNMEQJB-QGZVFWFLSA-N 1 2 315.848 4.288 20 0 DIADLO Cn1ncc(C2CCC2)c1C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000667671834 1048140338 /nfs/dbraw/zinc/14/03/38/1048140338.db2.gz AYZCLAZDNMEQJB-QGZVFWFLSA-N 1 2 315.848 4.288 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1nc(Cl)cc2cccc(F)c21 ZINC001161569380 1048140493 /nfs/dbraw/zinc/14/04/93/1048140493.db2.gz ISSWTJOESRBOOE-UHFFFAOYSA-N 1 2 318.783 4.417 20 0 DIADLO CC[C@@H](CNc1nc2ccccc2n2c[nH+]cc12)c1ccccc1 ZINC001185149993 1048144456 /nfs/dbraw/zinc/14/44/56/1048144456.db2.gz YTRJXXUKOVROHF-HNNXBMFYSA-N 1 2 316.408 4.488 20 0 DIADLO Clc1ccccc1-c1cccc(NCCCn2cc[nH+]c2)n1 ZINC001161682425 1048152442 /nfs/dbraw/zinc/15/24/42/1048152442.db2.gz QLMBVOLBDSVWGS-UHFFFAOYSA-N 1 2 312.804 4.101 20 0 DIADLO CCOc1ccc(C)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001175123258 1048153678 /nfs/dbraw/zinc/15/36/78/1048153678.db2.gz NQZXRPFTLSPUBD-UHFFFAOYSA-N 1 2 307.397 4.382 20 0 DIADLO CCc1cc(N2CCC[C@H](Cc3ccccc3)C2)nc(CC)[nH+]1 ZINC001185263967 1048154058 /nfs/dbraw/zinc/15/40/58/1048154058.db2.gz UDLPTKVVQQLVAO-QGZVFWFLSA-N 1 2 309.457 4.061 20 0 DIADLO O=C(c1ccccc1Nc1cccc2[nH+]c[nH]c21)C(F)(F)F ZINC001213034710 1048155482 /nfs/dbraw/zinc/15/54/82/1048155482.db2.gz YJIIAFZOCIJKMF-UHFFFAOYSA-N 1 2 305.259 4.052 20 0 DIADLO CC(C)c1cc(N[C@@H](C)CC(=O)OC(C)(C)C)nc(C(C)C)[nH+]1 ZINC001185298114 1048160407 /nfs/dbraw/zinc/16/04/07/1048160407.db2.gz GSHGGNPQXOJTJV-ZDUSSCGKSA-N 1 2 321.465 4.256 20 0 DIADLO CC(C)(C[NH2+][C@H](c1nnc[nH]1)c1ccccc1)C1=CCCCC1 ZINC000554736207 1048168031 /nfs/dbraw/zinc/16/80/31/1048168031.db2.gz ADQMBGZCFJDGSE-KRWDZBQOSA-N 1 2 310.445 4.010 20 0 DIADLO CC(C)(C[NH2+][C@@H](c1nnc[nH]1)c1ccccc1)C1=CCCCC1 ZINC000554736208 1048168072 /nfs/dbraw/zinc/16/80/72/1048168072.db2.gz ADQMBGZCFJDGSE-QGZVFWFLSA-N 1 2 310.445 4.010 20 0 DIADLO COc1cc(C)c[nH+]c1N[C@@H](CC1CC1)c1ccccc1F ZINC001161772410 1048170083 /nfs/dbraw/zinc/17/00/83/1048170083.db2.gz MPDGBTWDNZXREF-INIZCTEOSA-N 1 2 300.377 4.491 20 0 DIADLO COc1ncccc1[C@@H](Nc1[nH+]c(C)cc(Cl)c1C)C1CC1 ZINC001161783649 1048172021 /nfs/dbraw/zinc/17/20/21/1048172021.db2.gz QSLLJIWJYSXZQZ-HNNXBMFYSA-N 1 2 317.820 4.319 20 0 DIADLO CCSc1cc[nH+]c(N[C@H](c2cccnc2OC)C2CC2)c1 ZINC001161794023 1048173007 /nfs/dbraw/zinc/17/30/07/1048173007.db2.gz NOEFMQGLBYRVLF-INIZCTEOSA-N 1 2 315.442 4.160 20 0 DIADLO CCO[C@H]1C[C@H](Nc2cc(C(C)C)[nH+]c(C(C)C)n2)C12CCC2 ZINC001185421431 1048175535 /nfs/dbraw/zinc/17/55/35/1048175535.db2.gz VOJLXPGPLZXVEG-HOTGVXAUSA-N 1 2 317.477 4.483 20 0 DIADLO Cc1cc(N[C@H](c2cncc(F)c2)C2CC2)nc(C(C)(C)C)[nH+]1 ZINC001161817804 1048177100 /nfs/dbraw/zinc/17/71/00/1048177100.db2.gz HCDNSKGPGQBBRZ-INIZCTEOSA-N 1 2 314.408 4.180 20 0 DIADLO CCSc1cc[nH+]c(N[C@H](c2cncc(F)c2)C2CC2)c1 ZINC001161817148 1048177155 /nfs/dbraw/zinc/17/71/55/1048177155.db2.gz AKSYQXPNWRATSW-INIZCTEOSA-N 1 2 303.406 4.291 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1cccc(Cl)c1 ZINC000774875371 1048178025 /nfs/dbraw/zinc/17/80/25/1048178025.db2.gz PYHWDZUWWVFYPS-CYBMUJFWSA-N 1 2 307.825 4.261 20 0 DIADLO CCOc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1C ZINC001175171561 1048180577 /nfs/dbraw/zinc/18/05/77/1048180577.db2.gz WKTMPNQGZFSQIK-UHFFFAOYSA-N 1 2 307.397 4.382 20 0 DIADLO Cc1ccc(C)c(CCNc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001161832491 1048181329 /nfs/dbraw/zinc/18/13/29/1048181329.db2.gz PGHPIMDLEUGIPI-UHFFFAOYSA-N 1 2 305.425 4.203 20 0 DIADLO COc1ccccc1CN(C)c1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC001161952410 1048197874 /nfs/dbraw/zinc/19/78/74/1048197874.db2.gz XYHJWLVUOUQAGS-UHFFFAOYSA-N 1 2 313.445 4.368 20 0 DIADLO c1cn(Cc2ccc(N[C@@H](c3ccccc3)C3CC3)cc2)c[nH+]1 ZINC001161961086 1048200472 /nfs/dbraw/zinc/20/04/72/1048200472.db2.gz DCWQDKWEVOYCMM-FQEVSTJZSA-N 1 2 303.409 4.495 20 0 DIADLO CCO[C@H]1C[C@H](Nc2nc(C)[nH+]c3c2CCCC3)C1(CC)CC ZINC001185545143 1048200754 /nfs/dbraw/zinc/20/07/54/1048200754.db2.gz XIQMGAVNFYOXDE-IRXDYDNUSA-N 1 2 317.477 4.060 20 0 DIADLO CCc1ccccc1NC(=S)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001201145169 1048200750 /nfs/dbraw/zinc/20/07/50/1048200750.db2.gz KOOBUIBDUCNRAL-UHFFFAOYSA-N 1 2 322.437 4.244 20 0 DIADLO Clc1ccc([C@H]2CC[N@H+](Cc3cscn3)C2)cc1Cl ZINC001137596090 1048201581 /nfs/dbraw/zinc/20/15/81/1048201581.db2.gz CDZKBAUSGLIDGL-NSHDSACASA-N 1 2 313.253 4.439 20 0 DIADLO Clc1ccc([C@H]2CC[N@@H+](Cc3cscn3)C2)cc1Cl ZINC001137596090 1048201588 /nfs/dbraw/zinc/20/15/88/1048201588.db2.gz CDZKBAUSGLIDGL-NSHDSACASA-N 1 2 313.253 4.439 20 0 DIADLO Clc1ccc([C@@H]2CC[N@H+](Cc3cscn3)C2)cc1Cl ZINC001137596089 1048203094 /nfs/dbraw/zinc/20/30/94/1048203094.db2.gz CDZKBAUSGLIDGL-LLVKDONJSA-N 1 2 313.253 4.439 20 0 DIADLO Clc1ccc([C@@H]2CC[N@@H+](Cc3cscn3)C2)cc1Cl ZINC001137596089 1048203107 /nfs/dbraw/zinc/20/31/07/1048203107.db2.gz CDZKBAUSGLIDGL-LLVKDONJSA-N 1 2 313.253 4.439 20 0 DIADLO FC(F)Oc1cccc(CNc2ccc(-n3cccc3)c[nH+]2)c1 ZINC001161985159 1048208731 /nfs/dbraw/zinc/20/87/31/1048208731.db2.gz NELLWQAQQJOFFE-UHFFFAOYSA-N 1 2 315.323 4.086 20 0 DIADLO CCO[C@H]1C[C@@H](N(C)c2cc(C)[nH+]c(C3CC3)n2)C1(CC)CC ZINC001185620123 1048210043 /nfs/dbraw/zinc/21/00/43/1048210043.db2.gz DDUDJHZSTHQHKR-CVEARBPZSA-N 1 2 317.477 4.082 20 0 DIADLO CCO[C@@H]1C[C@@H](N(C)c2cc(C)[nH+]c(C3CC3)n2)C1(CC)CC ZINC001185620125 1048210894 /nfs/dbraw/zinc/21/08/94/1048210894.db2.gz DDUDJHZSTHQHKR-HZPDHXFCSA-N 1 2 317.477 4.082 20 0 DIADLO CCCOc1cc(C)ccc1CNc1cc(CC)[nH+]c(CC)n1 ZINC001185677020 1048216027 /nfs/dbraw/zinc/21/60/27/1048216027.db2.gz QOBSJCUQIFXMRO-UHFFFAOYSA-N 1 2 313.445 4.311 20 0 DIADLO CC(C)C[C@H]1CCCCN1c1nc2ccccc2n2c[nH+]cc12 ZINC001185726789 1048219287 /nfs/dbraw/zinc/21/92/87/1048219287.db2.gz VVMOTISIOCXYJI-OAHLLOKOSA-N 1 2 308.429 4.288 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H](C)c2cccc(OC(F)F)c2)o1 ZINC000774925596 1048222586 /nfs/dbraw/zinc/22/25/86/1048222586.db2.gz MARZDBAICPOLNL-LLVKDONJSA-N 1 2 310.344 4.250 20 0 DIADLO CCc1cc(N2CCC[C@@H]2c2ccc(Cl)cc2)nc(C)[nH+]1 ZINC001162099188 1048225227 /nfs/dbraw/zinc/22/52/27/1048225227.db2.gz OXPRNQKNJXGAAG-MRXNPFEDSA-N 1 2 301.821 4.342 20 0 DIADLO COc1ccc(Oc2ccc(Nc3ccc(N)[nH+]c3)cc2)cc1 ZINC001201286844 1048225459 /nfs/dbraw/zinc/22/54/59/1048225459.db2.gz DBIIDZNUIJZPJY-UHFFFAOYSA-N 1 2 307.353 4.208 20 0 DIADLO Fc1cc(NCc2cccc(Cl)c2F)ccc1-n1cc[nH+]c1 ZINC001201258035 1048228206 /nfs/dbraw/zinc/22/82/06/1048228206.db2.gz YLFAHEGHLFIYKT-UHFFFAOYSA-N 1 2 319.742 4.416 20 0 DIADLO CC(=O)c1ccc(Oc2ccc(Nc3ccc(N)[nH+]c3)cc2)cc1 ZINC001201292032 1048228800 /nfs/dbraw/zinc/22/88/00/1048228800.db2.gz UWMUYARXHMAWGR-UHFFFAOYSA-N 1 2 319.364 4.402 20 0 DIADLO Fc1cc(NCc2ccccc2Cl)ccc1-n1cc[nH+]c1 ZINC001201256829 1048229267 /nfs/dbraw/zinc/22/92/67/1048229267.db2.gz GVSCJHIGAZOKSE-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO COc1cc[nH+]c(C(C)(C)CNc2cc3ccsc3cn2)c1 ZINC001162129969 1048229301 /nfs/dbraw/zinc/22/93/01/1048229301.db2.gz TVBGAIDHKQEZII-UHFFFAOYSA-N 1 2 313.426 4.090 20 0 DIADLO Nc1ccc(Nc2cn(Cc3ccccc3)c3ccccc23)c[nH+]1 ZINC001201278404 1048230609 /nfs/dbraw/zinc/23/06/09/1048230609.db2.gz IQRSYQPLTHKSHK-UHFFFAOYSA-N 1 2 314.392 4.410 20 0 DIADLO Cc1ccc(C[NH2+]Cc2ccon2)c(OCCCC(C)C)c1 ZINC001201331224 1048230988 /nfs/dbraw/zinc/23/09/88/1048230988.db2.gz LSEUTCSAFIAKDC-UHFFFAOYSA-N 1 2 302.418 4.088 20 0 DIADLO CC(C)n1c(CNc2ccc([NH+](C)C)cc2)nc2ccccc21 ZINC001201331552 1048231541 /nfs/dbraw/zinc/23/15/41/1048231541.db2.gz QPMTYEAJYOGTHS-UHFFFAOYSA-N 1 2 308.429 4.295 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3ccc(OC(F)F)cc3)ccc21 ZINC001201307922 1048233908 /nfs/dbraw/zinc/23/39/08/1048233908.db2.gz ABUGVILRODNBIR-UHFFFAOYSA-N 1 2 318.367 4.283 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3ccc(OC(F)F)cc3)ccc21 ZINC001201307922 1048233921 /nfs/dbraw/zinc/23/39/21/1048233921.db2.gz ABUGVILRODNBIR-UHFFFAOYSA-N 1 2 318.367 4.283 20 0 DIADLO CC(C)Oc1ccc(Nc2nc3ccccc3n3c[nH+]cc23)cc1 ZINC001162176685 1048237403 /nfs/dbraw/zinc/23/74/03/1048237403.db2.gz IQCCTDAMTDXCCA-UHFFFAOYSA-N 1 2 318.380 4.413 20 0 DIADLO Cc1cc(NCc2ccc3c(ccn3C)c2)cc(OC(F)F)[nH+]1 ZINC001162173651 1048238114 /nfs/dbraw/zinc/23/81/14/1048238114.db2.gz WDTISUNZQZADRC-UHFFFAOYSA-N 1 2 317.339 4.095 20 0 DIADLO Clc1ccc([C@@H]2C[N@H+](CCC3CC3)CCO2)cc1Cl ZINC000480769059 1048238836 /nfs/dbraw/zinc/23/88/36/1048238836.db2.gz KUZSCOYOFKQDNX-HNNXBMFYSA-N 1 2 300.229 4.167 20 0 DIADLO Clc1ccc([C@@H]2C[N@@H+](CCC3CC3)CCO2)cc1Cl ZINC000480769059 1048238841 /nfs/dbraw/zinc/23/88/41/1048238841.db2.gz KUZSCOYOFKQDNX-HNNXBMFYSA-N 1 2 300.229 4.167 20 0 DIADLO Cc1ccc(C(=O)CC[N@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)cc1 ZINC000480773498 1048242666 /nfs/dbraw/zinc/24/26/66/1048242666.db2.gz XPZOJSMSEZBKNC-UWJYYQICSA-N 1 2 323.436 4.030 20 0 DIADLO Cc1ccc(C(=O)CC[N@@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)cc1 ZINC000480773498 1048242678 /nfs/dbraw/zinc/24/26/78/1048242678.db2.gz XPZOJSMSEZBKNC-UWJYYQICSA-N 1 2 323.436 4.030 20 0 DIADLO Cc1cc(CNc2ccc([NH+]3CCCC3)cc2)cnc1Cl ZINC001201339291 1048243118 /nfs/dbraw/zinc/24/31/18/1048243118.db2.gz WMDDUUGYYLPSJT-UHFFFAOYSA-N 1 2 301.821 4.256 20 0 DIADLO CN(C)c1ccc(Nc2ccc3sc(Cl)nc3c2)c[nH+]1 ZINC001175343866 1048249452 /nfs/dbraw/zinc/24/94/52/1048249452.db2.gz RISDAKUSXZVCOU-UHFFFAOYSA-N 1 2 304.806 4.154 20 0 DIADLO CN(C)c1ccc(Nc2cccnc2Oc2ccccc2F)c[nH+]1 ZINC001175342039 1048249590 /nfs/dbraw/zinc/24/95/90/1048249590.db2.gz ZCEOYNCTDSGKNQ-UHFFFAOYSA-N 1 2 324.359 4.218 20 0 DIADLO CN(C)c1ccc(Nc2ccc(-c3ccc(N)cc3)cc2)c[nH+]1 ZINC001175343501 1048249884 /nfs/dbraw/zinc/24/98/84/1048249884.db2.gz LOHJTQNXYQFUBQ-UHFFFAOYSA-N 1 2 304.397 4.140 20 0 DIADLO CN(C)c1ccc(Nc2cc(-c3ccc(Cl)s3)on2)c[nH+]1 ZINC001175341701 1048251086 /nfs/dbraw/zinc/25/10/86/1048251086.db2.gz IUKLOKAUQLFIEZ-UHFFFAOYSA-N 1 2 320.805 4.261 20 0 DIADLO CO[C@@]1(C)CCCN(c2cc(C(C)C)[nH+]c(C(C)C)n2)CC1 ZINC000480830262 1048251440 /nfs/dbraw/zinc/25/14/40/1048251440.db2.gz SWCUZNTVBBSNSP-SFHVURJKSA-N 1 2 305.466 4.119 20 0 DIADLO C[C@@H](CCc1ccccc1)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001186012156 1048251719 /nfs/dbraw/zinc/25/17/19/1048251719.db2.gz AFNPHEWCKONFRM-INIZCTEOSA-N 1 2 319.408 4.080 20 0 DIADLO Cc1c(Cl)cc(Nc2ccc(N(C)C)[nH+]c2)c(O)c1Cl ZINC001175345704 1048252123 /nfs/dbraw/zinc/25/21/23/1048252123.db2.gz GEXOFOANWAPHJH-UHFFFAOYSA-N 1 2 312.200 4.212 20 0 DIADLO Fc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c2ccncc12 ZINC001175348565 1048252258 /nfs/dbraw/zinc/25/22/58/1048252258.db2.gz GPAPGMZQGWFGQG-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO CN(C)c1ccc(Nc2cccc(F)c2N2CCCCC2)c[nH+]1 ZINC001175345701 1048252462 /nfs/dbraw/zinc/25/24/62/1048252462.db2.gz GBMIUHXWPZLQQF-UHFFFAOYSA-N 1 2 314.408 4.021 20 0 DIADLO Clc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c(Cl)n1 ZINC001175345950 1048252565 /nfs/dbraw/zinc/25/25/65/1048252565.db2.gz KGKZEPKXYNDDPF-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO Cc1cc([NH+]2CCCCC2)ccc1Nc1ccc(N(C)C)nc1 ZINC001175345478 1048252630 /nfs/dbraw/zinc/25/26/30/1048252630.db2.gz CTNMDAGDSWWVIK-UHFFFAOYSA-N 1 2 310.445 4.190 20 0 DIADLO CC(C)Oc1cc(F)ccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175348302 1048252655 /nfs/dbraw/zinc/25/26/55/1048252655.db2.gz DNBJLNRQMXYTLZ-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO c1ccc(-c2ccncc2Nc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC001175348585 1048253028 /nfs/dbraw/zinc/25/30/28/1048253028.db2.gz HIDIICOSFVPKAO-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO O=C1CCCCc2c(Nc3ccc(N4CCCC4)[nH+]c3)cccc21 ZINC001175348507 1048253043 /nfs/dbraw/zinc/25/30/43/1048253043.db2.gz FNMONCHFZJVWRV-UHFFFAOYSA-N 1 2 321.424 4.335 20 0 DIADLO c1c(CNc2cc(-c3ccccc3)cc[nH+]2)nn2ccccc12 ZINC001162284142 1048255844 /nfs/dbraw/zinc/25/58/44/1048255844.db2.gz OLOOROCZPHGZKQ-UHFFFAOYSA-N 1 2 300.365 4.008 20 0 DIADLO Cc1cc(N[C@H](C)COc2cccc(F)c2)nc(C2CCC2)[nH+]1 ZINC001162291161 1048258237 /nfs/dbraw/zinc/25/82/37/1048258237.db2.gz DJYXCOSGJHYRRX-CYBMUJFWSA-N 1 2 315.392 4.071 20 0 DIADLO Fc1ccc2c[nH+]c(NCc3cnccc3C(F)(F)F)cc2c1 ZINC001162287686 1048258269 /nfs/dbraw/zinc/25/82/69/1048258269.db2.gz GHBUQPOHKLWGOP-UHFFFAOYSA-N 1 2 321.277 4.400 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccc(C)cc2O[C@H](C)CC)s1 ZINC001201425261 1048263134 /nfs/dbraw/zinc/26/31/34/1048263134.db2.gz PBCMUPZQZJBMHQ-CQSZACIVSA-N 1 2 318.486 4.481 20 0 DIADLO C[C@@]1(O)CC[C@@H](Nc2ccc3[nH]c(-c4ccccc4)[nH+]c3c2)CC1 ZINC001162360346 1048268258 /nfs/dbraw/zinc/26/82/58/1048268258.db2.gz IOTSELSAWBAURF-SGNKCFNYSA-N 1 2 321.424 4.335 20 0 DIADLO Cc1cc(NCCCc2ccc(Cl)cc2)nc(C2CC2)[nH+]1 ZINC001162361234 1048268302 /nfs/dbraw/zinc/26/83/02/1048268302.db2.gz KYWSPORQFBFEPK-UHFFFAOYSA-N 1 2 301.821 4.361 20 0 DIADLO CC(=O)c1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c(Cl)c1 ZINC001175349151 1048268773 /nfs/dbraw/zinc/26/87/73/1048268773.db2.gz LWHSZKTXKJUOGB-UHFFFAOYSA-N 1 2 315.804 4.281 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(C(F)(F)F)ccc2F)CCC1(F)F ZINC000555099747 1048268955 /nfs/dbraw/zinc/26/89/55/1048268955.db2.gz PZDFHAZNGVQKEG-VIFPVBQESA-N 1 2 311.269 4.322 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(C(F)(F)F)ccc2F)CCC1(F)F ZINC000555099747 1048268963 /nfs/dbraw/zinc/26/89/63/1048268963.db2.gz PZDFHAZNGVQKEG-VIFPVBQESA-N 1 2 311.269 4.322 20 0 DIADLO CN(C)c1ccc(Nc2ccc(Oc3ccccc3F)nc2)c[nH+]1 ZINC001175341134 1048269257 /nfs/dbraw/zinc/26/92/57/1048269257.db2.gz PLQDTGOQGDTCRK-UHFFFAOYSA-N 1 2 324.359 4.218 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cccc3cnccc32)c1 ZINC001201457898 1048269248 /nfs/dbraw/zinc/26/92/48/1048269248.db2.gz KBLOBHLWBYDOJD-UHFFFAOYSA-N 1 2 309.438 4.495 20 0 DIADLO CN(C)c1ccc(Nc2cc(C3CCC3)nn2C(C)(C)C)c[nH+]1 ZINC001175338412 1048269571 /nfs/dbraw/zinc/26/95/71/1048269571.db2.gz RZNTWIVHHXDSMV-UHFFFAOYSA-N 1 2 313.449 4.110 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175350172 1048272516 /nfs/dbraw/zinc/27/25/16/1048272516.db2.gz VARADOUZHHQJNH-UHFFFAOYSA-N 1 2 323.227 4.436 20 0 DIADLO C[C@H]1c2ncc(COCC3CCCC3)n2CC[N@H+]1CC(C)(C)C ZINC001201435747 1048273815 /nfs/dbraw/zinc/27/38/15/1048273815.db2.gz WOOZHMIGXNVSAD-HNNXBMFYSA-N 1 2 319.493 4.013 20 0 DIADLO C[C@H]1c2ncc(COCC3CCCC3)n2CC[N@@H+]1CC(C)(C)C ZINC001201435747 1048273822 /nfs/dbraw/zinc/27/38/22/1048273822.db2.gz WOOZHMIGXNVSAD-HNNXBMFYSA-N 1 2 319.493 4.013 20 0 DIADLO Cc1ccc2cc(Nc3ccc(N4CCCC4)[nH+]c3)ccc2n1 ZINC001175352433 1048274646 /nfs/dbraw/zinc/27/46/46/1048274646.db2.gz PAFAAPBEVDAEMX-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO Cc1cc(N[C@H]2CCCO[C@@H]2CC(C)C)nc(C2CCC2)[nH+]1 ZINC001186212522 1048276426 /nfs/dbraw/zinc/27/64/26/1048276426.db2.gz QNPCLXSBXQOTOG-JKSUJKDBSA-N 1 2 303.450 4.058 20 0 DIADLO CCc1c(C)sc(Nc2ccc([NH2+]C(C)C)cc2)c1C(N)=O ZINC001201486970 1048278328 /nfs/dbraw/zinc/27/83/28/1048278328.db2.gz DEVBLKSSLDYCPJ-UHFFFAOYSA-N 1 2 317.458 4.282 20 0 DIADLO c1cnn(-c2ccc(Nc3[nH+]cccc3N3CCCCC3)cc2)c1 ZINC001175370035 1048281181 /nfs/dbraw/zinc/28/11/81/1048281181.db2.gz TXNZNXGGOJYYLL-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cnc(Br)s2)cc1 ZINC001201492164 1048282346 /nfs/dbraw/zinc/28/23/46/1048282346.db2.gz VSNVRJKQZODFFT-UHFFFAOYSA-N 1 2 312.236 4.470 20 0 DIADLO COC(=O)c1nc(Cl)ccc1Nc1ccc([NH2+]C(C)C)cc1 ZINC001201491181 1048282735 /nfs/dbraw/zinc/28/27/35/1048282735.db2.gz OBVVZWPKGGZOSF-UHFFFAOYSA-N 1 2 319.792 4.086 20 0 DIADLO CC(C)[NH2+]c1ccc(-n2cc(N)c(Cl)c3ccnc2-3)cc1 ZINC001201491014 1048283310 /nfs/dbraw/zinc/28/33/10/1048283310.db2.gz KEPFWCJMUROHQU-UHFFFAOYSA-N 1 2 300.793 4.033 20 0 DIADLO Cc1cc(N2CCc3c(cccc3C(C)C)C2)nc(C2CC2)[nH+]1 ZINC001186352399 1048284454 /nfs/dbraw/zinc/28/44/54/1048284454.db2.gz ZHTUTXMKUSIDNZ-UHFFFAOYSA-N 1 2 307.441 4.349 20 0 DIADLO c1cn(Cc2ccc(Nc3ccc4ncccc4c3)cc2)c[nH+]1 ZINC001175376196 1048286417 /nfs/dbraw/zinc/28/64/17/1048286417.db2.gz QOWVRWBQKZXLCJ-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO C=Cc1ccc(NCCc2ccc(Br)s2)[nH+]c1 ZINC001162588441 1048307257 /nfs/dbraw/zinc/30/72/57/1048307257.db2.gz VKWNDNLCDNJABA-UHFFFAOYSA-N 1 2 309.232 4.203 20 0 DIADLO Cc1cc(C)cc(Cc2noc([C@H](CC(C)C)n3cc[nH+]c3)n2)c1 ZINC000923813126 1048315956 /nfs/dbraw/zinc/31/59/56/1048315956.db2.gz YVZBGLMBEZFFEJ-KRWDZBQOSA-N 1 2 324.428 4.109 20 0 DIADLO CCCCCOc1ccc(CNc2c[nH+]ccc2OC)cc1 ZINC001201572887 1048321981 /nfs/dbraw/zinc/32/19/81/1048321981.db2.gz FULPDPFRCCJWNE-UHFFFAOYSA-N 1 2 300.402 4.271 20 0 DIADLO FC1(F)CC[C@@H](C[NH2+]c2ccc3c(c2)C2(CN3)CCOCC2)C1 ZINC001162647723 1048326651 /nfs/dbraw/zinc/32/66/51/1048326651.db2.gz FBZKLPITXTXIJO-CYBMUJFWSA-N 1 2 322.399 4.008 20 0 DIADLO Brc1ccc2c(Nc3cncs3)cc[nH+]c2c1 ZINC001175496711 1048328253 /nfs/dbraw/zinc/32/82/53/1048328253.db2.gz ICPJGZGNWBSAPX-UHFFFAOYSA-N 1 2 306.188 4.197 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2CC[C@@](F)(c3ccccc3F)C2)s1 ZINC000555366013 1048331817 /nfs/dbraw/zinc/33/18/17/1048331817.db2.gz WWVGKJVGDRGJDZ-KRWDZBQOSA-N 1 2 322.424 4.476 20 0 DIADLO CC(C)c1ncc(C[N@H+]2CC[C@@](F)(c3ccccc3F)C2)s1 ZINC000555366013 1048331829 /nfs/dbraw/zinc/33/18/29/1048331829.db2.gz WWVGKJVGDRGJDZ-KRWDZBQOSA-N 1 2 322.424 4.476 20 0 DIADLO CSc1ccccc1NC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC001186708623 1048331613 /nfs/dbraw/zinc/33/16/13/1048331613.db2.gz RCZPEKAFNFWTGQ-UHFFFAOYSA-N 1 2 324.409 4.238 20 0 DIADLO CSc1ccccc1NC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001186746719 1048339308 /nfs/dbraw/zinc/33/93/08/1048339308.db2.gz ISYCAIZBQSINRT-UHFFFAOYSA-N 1 2 324.409 4.238 20 0 DIADLO Cn1cccc1CNc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1 ZINC001162711060 1048341001 /nfs/dbraw/zinc/34/10/01/1048341001.db2.gz JIROMYPBGCEGSX-UHFFFAOYSA-N 1 2 302.381 4.181 20 0 DIADLO Cc1cnccc1CNc1ccc2c(c1)[nH+]cn2-c1ccccc1 ZINC001162721643 1048342138 /nfs/dbraw/zinc/34/21/38/1048342138.db2.gz ADVUWKLMFXEOHP-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Cc1cc(NC2(Cc3ccc(O)cc3)CC2)[nH+]c2ccccc12 ZINC001162729610 1048343859 /nfs/dbraw/zinc/34/38/59/1048343859.db2.gz MPFCMWOGJMUHSJ-UHFFFAOYSA-N 1 2 304.393 4.436 20 0 DIADLO Cc1cc(NCCc2c(F)cccc2Cl)nc(C2CCC2)[nH+]1 ZINC001162725592 1048344709 /nfs/dbraw/zinc/34/47/09/1048344709.db2.gz PQCCOUXDYVDASV-UHFFFAOYSA-N 1 2 319.811 4.500 20 0 DIADLO Cc1cc([NH2+]C[C@@H](C)c2ccccc2)ccc1N1CCOCC1 ZINC000775053614 1048348351 /nfs/dbraw/zinc/34/83/51/1048348351.db2.gz HQJPNMJFSRRWNO-QGZVFWFLSA-N 1 2 310.441 4.047 20 0 DIADLO Cc1nc(N2CCc3oc(-c4ccccc4)cc3C2)c(C)c(C)[nH+]1 ZINC001186951595 1048361912 /nfs/dbraw/zinc/36/19/12/1048361912.db2.gz AGNWDBFYSDAKFH-UHFFFAOYSA-N 1 2 319.408 4.225 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2NCC(C)(C)C1CCCC1 ZINC001162833045 1048369510 /nfs/dbraw/zinc/36/95/10/1048369510.db2.gz NWDSSCXXKWDDFE-UHFFFAOYSA-N 1 2 315.465 4.210 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2conc2Cc2ccccc2)o1 ZINC000555524693 1048374116 /nfs/dbraw/zinc/37/41/16/1048374116.db2.gz WUCAMNIIVMDAEB-RDTXWAMCSA-N 1 2 322.408 4.272 20 0 DIADLO CCC1(CC)[C@H](Nc2cc(C)[nH+]c(C3CCC3)n2)C[C@@H]1OC ZINC001162891729 1048376810 /nfs/dbraw/zinc/37/68/10/1048376810.db2.gz JPCQEDVCUGAGGX-CABCVRRESA-N 1 2 303.450 4.058 20 0 DIADLO Clc1ccc2nc([C@H]3CCC[N@@H+]3C[C@H]3CCC=CO3)[nH]c2c1 ZINC000775097832 1048382058 /nfs/dbraw/zinc/38/20/58/1048382058.db2.gz VYGRWRAAZJVYDH-CZUORRHYSA-N 1 2 317.820 4.046 20 0 DIADLO Clc1ccc2nc([C@H]3CCC[N@H+]3C[C@H]3CCC=CO3)[nH]c2c1 ZINC000775097832 1048382070 /nfs/dbraw/zinc/38/20/70/1048382070.db2.gz VYGRWRAAZJVYDH-CZUORRHYSA-N 1 2 317.820 4.046 20 0 DIADLO COc1ccsc1C[NH2+][C@@H](c1cccc(C)c1)c1ccccn1 ZINC001201842109 1048387562 /nfs/dbraw/zinc/38/75/62/1048387562.db2.gz HCLGBWZOGCQYKP-IBGZPJMESA-N 1 2 324.449 4.339 20 0 DIADLO CC(C)c1cc(NC[C@H]2CCC3(CCC3)O2)nc(C(C)C)[nH+]1 ZINC001187430799 1048398653 /nfs/dbraw/zinc/39/86/53/1048398653.db2.gz PRLPAGDLXKAFBN-CQSZACIVSA-N 1 2 303.450 4.237 20 0 DIADLO COC(=O)C12CCC(Nc3cc(C)c4cccc(C)c4[nH+]3)(CC1)C2 ZINC001162975942 1048399987 /nfs/dbraw/zinc/39/99/87/1048399987.db2.gz TXXPNTWOASIXDD-UHFFFAOYSA-N 1 2 324.424 4.139 20 0 DIADLO COC1CC(CNc2cc(SCc3ccccc3)cc[nH+]2)C1 ZINC001162993783 1048401385 /nfs/dbraw/zinc/40/13/85/1048401385.db2.gz VGFXHGDZAQQUGA-UHFFFAOYSA-N 1 2 314.454 4.211 20 0 DIADLO Cc1nc(N2CCCC[C@@H]2c2ccccc2)c2c([nH+]1)CCCC2 ZINC001162994548 1048401499 /nfs/dbraw/zinc/40/14/99/1048401499.db2.gz IGZXWAFAFAQJAW-LJQANCHMSA-N 1 2 307.441 4.395 20 0 DIADLO CC[C@@H]1Cc2ccccc2CN1c1nc(C)[nH+]c2c1CCCC2 ZINC001163001244 1048402198 /nfs/dbraw/zinc/40/21/98/1048402198.db2.gz WBTSIPYLUOXTDK-QGZVFWFLSA-N 1 2 307.441 4.005 20 0 DIADLO c1c[nH+]c(N2CCCCC2)c(Nc2ccc3ccncc3c2)c1 ZINC001175703378 1048406796 /nfs/dbraw/zinc/40/67/96/1048406796.db2.gz ZSLJSGWXMCXPPM-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO Cc1n[nH]c2cc(Nc3ccc[nH+]c3N3CCCCC3)ccc12 ZINC001175660386 1048410545 /nfs/dbraw/zinc/41/05/45/1048410545.db2.gz YBBFAMQGDBNTKQ-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2c2nc3cccc(C)c3s2)[nH+]c1C ZINC001187600138 1048410896 /nfs/dbraw/zinc/41/08/96/1048410896.db2.gz MCIZFFVAJWTBAY-AWEZNQCLSA-N 1 2 312.442 4.286 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](CC(C)C)n2cc[nH+]c2)c(Cl)c1C ZINC001163062749 1048411843 /nfs/dbraw/zinc/41/18/43/1048411843.db2.gz RUZZVFVZDBIWJT-OAHLLOKOSA-N 1 2 319.836 4.379 20 0 DIADLO CSc1cc[nH+]c(NCCOc2cccc3ccoc32)c1 ZINC001163077852 1048412995 /nfs/dbraw/zinc/41/29/95/1048412995.db2.gz MTXOITRBKIEIEU-UHFFFAOYSA-N 1 2 300.383 4.041 20 0 DIADLO CSCc1cc[nH+]c(NCCOc2cccc3ccoc32)c1 ZINC001163078191 1048415670 /nfs/dbraw/zinc/41/56/70/1048415670.db2.gz WCSOYIZRLJGCNA-UHFFFAOYSA-N 1 2 314.410 4.182 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3ccccc3[C@@H]2c2ccccc2)no1 ZINC000555659191 1048416154 /nfs/dbraw/zinc/41/61/54/1048416154.db2.gz DBACRPINPRBJCX-FQEVSTJZSA-N 1 2 304.393 4.131 20 0 DIADLO Cc1cc(C[N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)no1 ZINC000555659191 1048416167 /nfs/dbraw/zinc/41/61/67/1048416167.db2.gz DBACRPINPRBJCX-FQEVSTJZSA-N 1 2 304.393 4.131 20 0 DIADLO Cc1cc(F)ccc1C[NH2+]C(C)(C)c1cc(C(F)(F)F)on1 ZINC000555660186 1048416381 /nfs/dbraw/zinc/41/63/81/1048416381.db2.gz RBRNVAOJAQQIGA-UHFFFAOYSA-N 1 2 316.298 4.166 20 0 DIADLO Cc1c(Cl)cccc1C[NH2+][C@H]1c2ccccc2OC[C@@H]1F ZINC001203665365 1048416637 /nfs/dbraw/zinc/41/66/37/1048416637.db2.gz MSMCLASKBXFYND-RDJZCZTQSA-N 1 2 305.780 4.210 20 0 DIADLO CCc1ccccc1NC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001187637748 1048417904 /nfs/dbraw/zinc/41/79/04/1048417904.db2.gz SNWNBGGBDDBNCF-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO Clc1cc(NCc2ccc3[nH+]ccn3c2)c2ccccc2n1 ZINC001163136320 1048419404 /nfs/dbraw/zinc/41/94/04/1048419404.db2.gz XEBCTPMSRKNAPK-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO CCOc1ccc(C)cc1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175712528 1048419529 /nfs/dbraw/zinc/41/95/29/1048419529.db2.gz CRDOSWYOICDIKB-UHFFFAOYSA-N 1 2 311.307 4.133 20 0 DIADLO CCCOc1ccc(Nc2c[nH+]c(N)cc2C(F)(F)F)cc1 ZINC001175712924 1048419662 /nfs/dbraw/zinc/41/96/62/1048419662.db2.gz NLSMAYACBPCWGL-UHFFFAOYSA-N 1 2 311.307 4.215 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccccc2C(F)F)c[nH+]1 ZINC001175713215 1048419696 /nfs/dbraw/zinc/41/96/96/1048419696.db2.gz XAGBLJDQURIIIQ-UHFFFAOYSA-N 1 2 303.234 4.364 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc(F)ccc2Cl)c[nH+]1 ZINC001175712434 1048419877 /nfs/dbraw/zinc/41/98/77/1048419877.db2.gz AUIBHBMVTFORMM-UHFFFAOYSA-N 1 2 305.662 4.219 20 0 DIADLO Clc1cc2ccccc2nc1NCc1ccc2[nH+]ccn2c1 ZINC001163136813 1048420387 /nfs/dbraw/zinc/42/03/87/1048420387.db2.gz PXSOGWRLDLQCON-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc3ncc(F)cc32)c[nH+]1 ZINC001175716094 1048420459 /nfs/dbraw/zinc/42/04/59/1048420459.db2.gz SVWRLAWFDGAQLJ-UHFFFAOYSA-N 1 2 322.265 4.114 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc(F)c2Cl)c[nH+]1 ZINC001175713270 1048420506 /nfs/dbraw/zinc/42/05/06/1048420506.db2.gz ZRSLVDFSLSOTAP-UHFFFAOYSA-N 1 2 305.662 4.219 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(Cl)c(F)c2F)c[nH+]1 ZINC001175714898 1048420651 /nfs/dbraw/zinc/42/06/51/1048420651.db2.gz YMCFAPQTOHNCEV-UHFFFAOYSA-N 1 2 323.652 4.358 20 0 DIADLO COc1cccc(Cl)c1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175714823 1048421173 /nfs/dbraw/zinc/42/11/73/1048421173.db2.gz VSLABMJTMXIDTM-UHFFFAOYSA-N 1 2 317.698 4.088 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc(Cl)c(F)cc2F)c[nH+]1 ZINC001175713891 1048421189 /nfs/dbraw/zinc/42/11/89/1048421189.db2.gz FOAMAQYZFIVOCI-UHFFFAOYSA-N 1 2 323.652 4.358 20 0 DIADLO Cc1ccc2cc(Cl)nc(NCc3ccc4[nH+]ccn4c3)c2c1 ZINC001163139103 1048421395 /nfs/dbraw/zinc/42/13/95/1048421395.db2.gz JCGGAEAIJZEEIU-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO CC(C)(C)[C@H]1CCCN(c2nc3ccccc3n3c[nH+]cc23)C1 ZINC001163150851 1048422663 /nfs/dbraw/zinc/42/26/63/1048422663.db2.gz CIOKBSGSBWESOR-AWEZNQCLSA-N 1 2 308.429 4.145 20 0 DIADLO CC(=O)Nc1ccc([C@H](C)Nc2cc(C)[nH+]c(C(C)C)n2)cc1 ZINC001163150853 1048422910 /nfs/dbraw/zinc/42/29/10/1048422910.db2.gz SSRKLPHSYOIBOA-ZDUSSCGKSA-N 1 2 312.417 4.040 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc3cccc(N)c32)c[nH+]1 ZINC001175716925 1048422963 /nfs/dbraw/zinc/42/29/63/1048422963.db2.gz DCTBWIUPFQNCRM-UHFFFAOYSA-N 1 2 318.302 4.162 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc3ccc(O)cc32)c[nH+]1 ZINC001175717753 1048423204 /nfs/dbraw/zinc/42/32/04/1048423204.db2.gz OJLQKDBAZLMZQT-UHFFFAOYSA-N 1 2 319.286 4.285 20 0 DIADLO Cc1cc(Nc2c[nH+]c(N)cc2C(F)(F)F)cc2scnc21 ZINC001175716842 1048423610 /nfs/dbraw/zinc/42/36/10/1048423610.db2.gz ZKQWZVNPVGRRFY-UHFFFAOYSA-N 1 2 324.331 4.344 20 0 DIADLO CCc1cc(N2CCC[C@H]2[C@H](C)c2ccccc2)nc(CC)[nH+]1 ZINC001187686086 1048425979 /nfs/dbraw/zinc/42/59/79/1048425979.db2.gz JACYIHIUHSURLF-QAPCUYQASA-N 1 2 309.457 4.374 20 0 DIADLO C[C@@H]1CCC[C@H](CNc2nc3ccccc3n3c[nH+]cc23)[C@@H]1C ZINC001163184773 1048429957 /nfs/dbraw/zinc/42/99/57/1048429957.db2.gz IZIRYESMAGVXJN-RBSFLKMASA-N 1 2 308.429 4.367 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1ccnc(Br)c1 ZINC001175745029 1048433273 /nfs/dbraw/zinc/43/32/73/1048433273.db2.gz FVYOFOUOXXKWSZ-UHFFFAOYSA-N 1 2 306.207 4.415 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cncc(Cl)c2Cl)c[nH+]1 ZINC001175705980 1048436560 /nfs/dbraw/zinc/43/65/60/1048436560.db2.gz KTIMBCRTHHXKDA-UHFFFAOYSA-N 1 2 323.105 4.128 20 0 DIADLO Cc1ccc2nc(Nc3c[nH+]c(N)cc3C(F)(F)F)sc2c1 ZINC001175709979 1048437736 /nfs/dbraw/zinc/43/77/36/1048437736.db2.gz PNSVOCATUPTCAK-UHFFFAOYSA-N 1 2 324.331 4.344 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cnc3cccc(F)c3c2)c[nH+]1 ZINC001175710911 1048437982 /nfs/dbraw/zinc/43/79/82/1048437982.db2.gz OETVRLUZYCUGAC-UHFFFAOYSA-N 1 2 322.265 4.114 20 0 DIADLO Cc1nc2ccccc2cc1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175707204 1048438287 /nfs/dbraw/zinc/43/82/87/1048438287.db2.gz ZMCZYBAINXAWLV-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO COc1cccc2c1OC[C@H]2Nc1cc(C)c2ccccc2[nH+]1 ZINC001163224844 1048439585 /nfs/dbraw/zinc/43/95/85/1048439585.db2.gz FXKWZKHRWHYNFD-MRXNPFEDSA-N 1 2 306.365 4.097 20 0 DIADLO Cc1nc(N2CCC[C@H]2/C=C\c2ccccc2)c2c([nH+]1)CCCC2 ZINC001187765746 1048442110 /nfs/dbraw/zinc/44/21/10/1048442110.db2.gz PUZZMQLUFIARCF-HWOXTHGCSA-N 1 2 319.452 4.346 20 0 DIADLO Cc1cccc2c(C)cc(NCc3cnn4ccccc34)[nH+]c12 ZINC001163275938 1048446116 /nfs/dbraw/zinc/44/61/16/1048446116.db2.gz NZUXVCWVLZHZFF-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO Cc1nc(N2CCC[C@](C)(c3ccccc3)CC2)c(C)c(C)[nH+]1 ZINC001163278751 1048447174 /nfs/dbraw/zinc/44/71/74/1048447174.db2.gz UDLBBGHFCKDRJF-FQEVSTJZSA-N 1 2 309.457 4.350 20 0 DIADLO COc1cc(Nc2cccc(Cn3cc[nH+]c3)c2)ccc1Cl ZINC001175771779 1048447758 /nfs/dbraw/zinc/44/77/58/1048447758.db2.gz QULXBAGJQVVILI-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO Cc1cc(NC[C@@H]2C[C@@H]2Cc2ccccc2)nc(C2CCC2)[nH+]1 ZINC001187898312 1048448185 /nfs/dbraw/zinc/44/81/85/1048448185.db2.gz ZSZYMWOOBHOTPR-ROUUACIJSA-N 1 2 307.441 4.343 20 0 DIADLO COCCOc1ccc(Nc2c(C)cc[nH+]c2C(C)C)cc1 ZINC001175785323 1048451694 /nfs/dbraw/zinc/45/16/94/1048451694.db2.gz QUXQLVNJKLPXCB-UHFFFAOYSA-N 1 2 300.402 4.282 20 0 DIADLO COc1c(F)cccc1[C@H](C)Nc1cc(CSC)cc[nH+]1 ZINC001163341407 1048456944 /nfs/dbraw/zinc/45/69/44/1048456944.db2.gz VGLAKXGCWIWNHU-NSHDSACASA-N 1 2 306.406 4.265 20 0 DIADLO Cc1cc(N[C@@H](c2cccc(N)n2)C(C)C)[nH+]c2ccccc12 ZINC001163341964 1048458543 /nfs/dbraw/zinc/45/85/43/1048458543.db2.gz OZINRYYEGMGRPZ-LJQANCHMSA-N 1 2 306.413 4.330 20 0 DIADLO CSc1cccc(NC(=O)Nc2cccc3[nH+]c(C)cn32)c1 ZINC001188015663 1048466870 /nfs/dbraw/zinc/46/68/70/1048466870.db2.gz GOAANVFKMBJZDT-UHFFFAOYSA-N 1 2 312.398 4.009 20 0 DIADLO COc1cnccc1[C@@H](Nc1ccc(C(C)(C)C)c[nH+]1)C1CC1 ZINC001163401838 1048467849 /nfs/dbraw/zinc/46/78/49/1048467849.db2.gz YVCRANJGIDTBLY-SFHVURJKSA-N 1 2 311.429 4.346 20 0 DIADLO Cc1cccc(C)c1NC(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001202193784 1048477966 /nfs/dbraw/zinc/47/79/66/1048477966.db2.gz OUWYZNJFCBIGNO-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO c1csc(-c2nc(C[N@@H+]3Cc4ccccc4C4(CC4)C3)co2)c1 ZINC000481760336 1048479736 /nfs/dbraw/zinc/47/97/36/1048479736.db2.gz ZXRBOAWVDJMTMK-UHFFFAOYSA-N 1 2 322.433 4.451 20 0 DIADLO c1csc(-c2nc(C[N@H+]3Cc4ccccc4C4(CC4)C3)co2)c1 ZINC000481760336 1048479742 /nfs/dbraw/zinc/47/97/42/1048479742.db2.gz ZXRBOAWVDJMTMK-UHFFFAOYSA-N 1 2 322.433 4.451 20 0 DIADLO Cc1cc(Oc2ccc(NC(=O)NCc3ccco3)cc2)cc[nH+]1 ZINC001188171740 1048482865 /nfs/dbraw/zinc/48/28/65/1048482865.db2.gz PDDQELXRCKRSCA-UHFFFAOYSA-N 1 2 323.352 4.097 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@H](C(F)(F)F)CC1 ZINC001175873065 1048486826 /nfs/dbraw/zinc/48/68/26/1048486826.db2.gz MCNVJDSYTZHWQQ-KBPBESRZSA-N 1 2 323.305 4.069 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@H+]1CCO[C@H](C(F)(F)F)CC1 ZINC001175873065 1048486834 /nfs/dbraw/zinc/48/68/34/1048486834.db2.gz MCNVJDSYTZHWQQ-KBPBESRZSA-N 1 2 323.305 4.069 20 0 DIADLO c1cn2c(cccc2Nc2cccnc2OCc2ccccc2)[nH+]1 ZINC001175872878 1048487516 /nfs/dbraw/zinc/48/75/16/1048487516.db2.gz VKZVGLAEEATHCS-UHFFFAOYSA-N 1 2 316.364 4.052 20 0 DIADLO COC(=O)C1(c2ccc(Nc3cccc(C4CCC4)[nH+]3)cc2)CC1 ZINC001175919093 1048499907 /nfs/dbraw/zinc/49/99/07/1048499907.db2.gz DGTVCOAHXQBXNY-UHFFFAOYSA-N 1 2 322.408 4.297 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(C3(C(=O)OC)CC3)cc2)cc1 ZINC001175921069 1048500685 /nfs/dbraw/zinc/50/06/85/1048500685.db2.gz PJVFXBLTYANAFC-UHFFFAOYSA-N 1 2 324.424 4.091 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(C3(C(=O)OC)CC3)cc2)cc1 ZINC001175921069 1048500703 /nfs/dbraw/zinc/50/07/03/1048500703.db2.gz PJVFXBLTYANAFC-UHFFFAOYSA-N 1 2 324.424 4.091 20 0 DIADLO Cc1cc(NC(=O)NCC2CCC(C(C)(C)C)CC2)c(C)c[nH+]1 ZINC001202245835 1048502469 /nfs/dbraw/zinc/50/24/69/1048502469.db2.gz RJOVVCTXIOCCCR-UHFFFAOYSA-N 1 2 317.477 4.094 20 0 DIADLO CN(CC(F)(F)F)c1cc(SCc2ccccc2)cc[nH+]1 ZINC001163711108 1048509695 /nfs/dbraw/zinc/50/96/95/1048509695.db2.gz UJDLIEGMBRLSLD-UHFFFAOYSA-N 1 2 312.360 4.372 20 0 DIADLO Cc1ccc(CC2CN(c3cc(C)[nH+]c(C4CCC4)n3)C2)cc1 ZINC001163745018 1048514971 /nfs/dbraw/zinc/51/49/71/1048514971.db2.gz ROVNWTYGUULXGD-UHFFFAOYSA-N 1 2 307.441 4.040 20 0 DIADLO Cc1cc(NCc2cc(F)ccc2OC(F)F)nc(C2CC2)[nH+]1 ZINC001163808266 1048528476 /nfs/dbraw/zinc/52/84/76/1048528476.db2.gz QEIIPVITBJPSGR-UHFFFAOYSA-N 1 2 323.318 4.015 20 0 DIADLO c1cc2n(c1)CCN(c1cccc(C3CC3)[nH+]1)[C@@H]2c1ccccc1 ZINC001163847643 1048536656 /nfs/dbraw/zinc/53/66/56/1048536656.db2.gz ZLPCAOHTWFZHEL-OAQYLSRUSA-N 1 2 315.420 4.370 20 0 DIADLO Cc1ccc2c(Nc3cccc(N4CCOCC4)c3)cccc2[nH+]1 ZINC001176021764 1048538276 /nfs/dbraw/zinc/53/82/76/1048538276.db2.gz XLOPKKHLMYZFRR-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO CCC[C@@H](C(=O)Nc1nc(C[NH+]2CCCCC2)cs1)C(C)C ZINC000481947770 1048538397 /nfs/dbraw/zinc/53/83/97/1048538397.db2.gz SJWTWCCGPAPLMW-OAHLLOKOSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H](C)c1cn(C(C)C)nn1 ZINC000924772519 1048545192 /nfs/dbraw/zinc/54/51/92/1048545192.db2.gz HUXUXPTXDOIJHO-UONOGXRCSA-N 1 2 312.417 4.325 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2Cc2ccc(F)c(Cl)c2)[nH+]c1C ZINC001176079309 1048548184 /nfs/dbraw/zinc/54/81/84/1048548184.db2.gz XSDJTTZLQWZFAT-HNNXBMFYSA-N 1 2 307.800 4.156 20 0 DIADLO COc1cccc2[nH+]c(NCc3cc4ccccc4n3C)ccc21 ZINC001163931408 1048551062 /nfs/dbraw/zinc/55/10/62/1048551062.db2.gz DIEHDKQDSIRMQE-UHFFFAOYSA-N 1 2 317.392 4.347 20 0 DIADLO COc1cccc2[nH]c(Nc3ccc[nH+]c3N3CCCCC3)cc21 ZINC001176061142 1048556127 /nfs/dbraw/zinc/55/61/27/1048556127.db2.gz FGHVYRHWSFOQFO-UHFFFAOYSA-N 1 2 322.412 4.305 20 0 DIADLO COc1ccccc1C/C(C)=C/C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000106606463 1048556170 /nfs/dbraw/zinc/55/61/70/1048556170.db2.gz JLIDVXWAHRCNIH-ACCUITESSA-N 1 2 324.424 4.143 20 0 DIADLO COc1ccc2cc[nH+]c(N3CCc4ccccc4[C@H]3C)c2c1 ZINC001163956832 1048560733 /nfs/dbraw/zinc/56/07/33/1048560733.db2.gz VOLPQWNOJMLAHL-CQSZACIVSA-N 1 2 304.393 4.367 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)Cc1cccs1 ZINC000338912671 1048568861 /nfs/dbraw/zinc/56/88/61/1048568861.db2.gz QCDYHUOKPBSDQN-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)Cc1cccs1 ZINC000338912671 1048568872 /nfs/dbraw/zinc/56/88/72/1048568872.db2.gz QCDYHUOKPBSDQN-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO CC(C)(C)C(=O)CNc1ccc2c(c1)[nH+]cn2-c1ccccc1 ZINC001164005826 1048570014 /nfs/dbraw/zinc/57/00/14/1048570014.db2.gz VOCRQBFDXNFKKC-UHFFFAOYSA-N 1 2 307.397 4.053 20 0 DIADLO F[C@@H]1CCCN(c2[nH+]ccc3cc(Cl)ccc32)CC1(F)F ZINC001164059364 1048572867 /nfs/dbraw/zinc/57/28/67/1048572867.db2.gz GTCDZEDHMLFBCU-CYBMUJFWSA-N 1 2 314.738 4.462 20 0 DIADLO COc1cc[nH+]cc1Nc1cccc(C(=O)c2ccccc2)c1 ZINC001176120544 1048573670 /nfs/dbraw/zinc/57/36/70/1048573670.db2.gz DEOUUOXIGBONKN-UHFFFAOYSA-N 1 2 304.349 4.065 20 0 DIADLO COc1cc[nH+]cc1Nc1cccc(NC(=O)c2ccccc2)c1 ZINC001176121144 1048575641 /nfs/dbraw/zinc/57/56/41/1048575641.db2.gz PWMBKHRAFSKVDL-UHFFFAOYSA-N 1 2 319.364 4.086 20 0 DIADLO COc1cc[nH+]cc1Nc1ccccc1NC(=O)OC(C)(C)C ZINC001176122641 1048576147 /nfs/dbraw/zinc/57/61/47/1048576147.db2.gz FWHLZKOWGSSURB-UHFFFAOYSA-N 1 2 315.373 4.181 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(F)cc(Br)c1C ZINC001176122867 1048576526 /nfs/dbraw/zinc/57/65/26/1048576526.db2.gz KCTUZGLMCGWYLV-UHFFFAOYSA-N 1 2 311.154 4.044 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc2nc(C(F)(F)F)ccc2c1 ZINC001176123711 1048576900 /nfs/dbraw/zinc/57/69/00/1048576900.db2.gz DMMBYVDLOTXBSJ-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(F)c(Br)cc1C ZINC001176122597 1048577325 /nfs/dbraw/zinc/57/73/25/1048577325.db2.gz CPWCPTQAEPFRGC-UHFFFAOYSA-N 1 2 311.154 4.044 20 0 DIADLO CC(C)=CCC[C@H](C)CC[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000482254899 1048579495 /nfs/dbraw/zinc/57/94/95/1048579495.db2.gz VCVWERJOIBTLRA-FUHWJXTLSA-N 1 2 312.461 4.256 20 0 DIADLO C[C@H](Nc1ccn2cc[nH+]c2c1)c1ccc(Br)s1 ZINC001164088618 1048580571 /nfs/dbraw/zinc/58/05/71/1048580571.db2.gz IICXBBWFGGTTHF-VIFPVBQESA-N 1 2 322.231 4.331 20 0 DIADLO COc1ccc2[nH+]c(N3CC[C@H](C)C(F)(F)CC3)cc(C)c2c1 ZINC001164115716 1048585786 /nfs/dbraw/zinc/58/57/86/1048585786.db2.gz VUIWHVDUJCSODJ-ZDUSSCGKSA-N 1 2 320.383 4.423 20 0 DIADLO Cc1c(F)cccc1NC(=O)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001189052365 1048586013 /nfs/dbraw/zinc/58/60/13/1048586013.db2.gz XONUBQPEVWITSB-UHFFFAOYSA-N 1 2 324.359 4.023 20 0 DIADLO CCN(C)c1cc(N[C@H](C)c2ccc3ccccc3c2)[nH+]cn1 ZINC001164144840 1048591093 /nfs/dbraw/zinc/59/10/93/1048591093.db2.gz IEQHWMNCPORWBC-CQSZACIVSA-N 1 2 306.413 4.259 20 0 DIADLO CCN(C)c1cc(N[C@H](C)c2ccc3ccccc3c2)nc[nH+]1 ZINC001164144840 1048591105 /nfs/dbraw/zinc/59/11/05/1048591105.db2.gz IEQHWMNCPORWBC-CQSZACIVSA-N 1 2 306.413 4.259 20 0 DIADLO C[C@@H](Nc1ccn2cc(N)[nH+]c2c1)c1ccc2ccccc2c1 ZINC001164144427 1048591733 /nfs/dbraw/zinc/59/17/33/1048591733.db2.gz DIGQMIWSESNCBZ-CYBMUJFWSA-N 1 2 302.381 4.243 20 0 DIADLO CCc1cc(N[C@@H](CC)c2cc(F)ccc2OC)nc(CC)[nH+]1 ZINC001164182949 1048599240 /nfs/dbraw/zinc/59/92/40/1048599240.db2.gz WQOIRHWUAHPSRL-HNNXBMFYSA-N 1 2 317.408 4.312 20 0 DIADLO COc1ccc(CCCNc2cccc(-c3c[nH+]cn3C)c2)cc1 ZINC001164194784 1048602622 /nfs/dbraw/zinc/60/26/22/1048602622.db2.gz UFUJCULDJKIDIF-UHFFFAOYSA-N 1 2 321.424 4.140 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@]3(C)CC=CCC3)cc2)[nH+]c1C ZINC001176211331 1048606042 /nfs/dbraw/zinc/60/60/42/1048606042.db2.gz OYTTWQMQXJOOGJ-IBGZPJMESA-N 1 2 309.413 4.378 20 0 DIADLO Cc1cc(NCc2cnc3ccccc3c2)cc(OC(F)F)[nH+]1 ZINC001164206567 1048608341 /nfs/dbraw/zinc/60/83/41/1048608341.db2.gz RYBXQSPYOXQHSK-UHFFFAOYSA-N 1 2 315.323 4.152 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000482495056 1048618217 /nfs/dbraw/zinc/61/82/17/1048618217.db2.gz HADDIWDCTZDCCG-IUODEOHRSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000482495056 1048618224 /nfs/dbraw/zinc/61/82/24/1048618224.db2.gz HADDIWDCTZDCCG-IUODEOHRSA-N 1 2 323.362 4.240 20 0 DIADLO Clc1ccc2ncc(C[N@@H+]3Cc4ccccc4C4(CC4)C3)n2c1 ZINC000482496066 1048620612 /nfs/dbraw/zinc/62/06/12/1048620612.db2.gz RSFQMIFABUEICS-UHFFFAOYSA-N 1 2 323.827 4.035 20 0 DIADLO Clc1ccc2ncc(C[N@H+]3Cc4ccccc4C4(CC4)C3)n2c1 ZINC000482496066 1048620620 /nfs/dbraw/zinc/62/06/20/1048620620.db2.gz RSFQMIFABUEICS-UHFFFAOYSA-N 1 2 323.827 4.035 20 0 DIADLO C[C@@H]1C[NH+](CCSc2ccc(Cl)cc2Cl)C[C@@H](C)O1 ZINC001189358854 1048624094 /nfs/dbraw/zinc/62/40/94/1048624094.db2.gz UCNHLKGFWIGSEQ-GHMZBOCLSA-N 1 2 320.285 4.195 20 0 DIADLO C[C@H]1C[NH+](CCSc2ccc(Cl)cc2Cl)C[C@H](C)O1 ZINC001189358961 1048624134 /nfs/dbraw/zinc/62/41/34/1048624134.db2.gz UCNHLKGFWIGSEQ-QWRGUYRKSA-N 1 2 320.285 4.195 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)c1cccc(-c2ccsc2)c1 ZINC001189363267 1048624211 /nfs/dbraw/zinc/62/42/11/1048624211.db2.gz YYRQHWZDPPAGMW-UHFFFAOYSA-N 1 2 319.389 4.315 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+]Cc1ccc(F)c(F)c1F)CCC2 ZINC000850241422 1048626938 /nfs/dbraw/zinc/62/69/38/1048626938.db2.gz FTUXZBBTXAKVOI-AWEZNQCLSA-N 1 2 323.362 4.049 20 0 DIADLO Cc1nc(N2CC(F)(F)C[C@H]2CF)cc(C2CCCCC2)[nH+]1 ZINC001164528599 1048638519 /nfs/dbraw/zinc/63/85/19/1048638519.db2.gz FMMZMOAAELRBQF-ZDUSSCGKSA-N 1 2 313.367 4.016 20 0 DIADLO c1cn2c(cccc2Nc2ccc(OCc3ccccc3)nc2)[nH+]1 ZINC001176299896 1048639115 /nfs/dbraw/zinc/63/91/15/1048639115.db2.gz DWRHBBKVSQNMKE-UHFFFAOYSA-N 1 2 316.364 4.052 20 0 DIADLO C[C@]1(c2ccc(F)cc2)CC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000482588818 1048640674 /nfs/dbraw/zinc/64/06/74/1048640674.db2.gz HMIQRVASIYWGGF-HNNXBMFYSA-N 1 2 310.825 4.099 20 0 DIADLO C[C@]1(c2ccc(F)cc2)CC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000482588818 1048640681 /nfs/dbraw/zinc/64/06/81/1048640681.db2.gz HMIQRVASIYWGGF-HNNXBMFYSA-N 1 2 310.825 4.099 20 0 DIADLO COc1ccc2[nH+]c(N3CC(F)(F)C[C@@]3(C)CF)cc(C)c2c1 ZINC001164563087 1048643100 /nfs/dbraw/zinc/64/31/00/1048643100.db2.gz KAEYRDYASWYRRT-INIZCTEOSA-N 1 2 324.346 4.125 20 0 DIADLO Cc1cccc2c(C)cc(N3CC(F)(F)C[C@@]3(C)CF)[nH+]c12 ZINC001164557752 1048643345 /nfs/dbraw/zinc/64/33/45/1048643345.db2.gz NQHLULSXRBRUJS-INIZCTEOSA-N 1 2 308.347 4.425 20 0 DIADLO CC(C)n1c[nH+]cc1CNC(=O)Nc1ccccc1C(C)(C)C ZINC001189613151 1048645150 /nfs/dbraw/zinc/64/51/50/1048645150.db2.gz YRIXOCNFLIHOGU-UHFFFAOYSA-N 1 2 314.433 4.083 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3nc[nH]c3[C@H]2c2ccccc2)cc1F ZINC001176322654 1048651515 /nfs/dbraw/zinc/65/15/15/1048651515.db2.gz MZXBYDKRDKIGOD-HXUWFJFHSA-N 1 2 321.399 4.005 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3nc[nH]c3[C@H]2c2ccccc2)cc1F ZINC001176322654 1048651528 /nfs/dbraw/zinc/65/15/28/1048651528.db2.gz MZXBYDKRDKIGOD-HXUWFJFHSA-N 1 2 321.399 4.005 20 0 DIADLO Oc1ccc2cc(Nc3cccc(-n4cc[nH+]c4)c3)ccc2c1 ZINC001176387094 1048653469 /nfs/dbraw/zinc/65/34/69/1048653469.db2.gz LNTAIMIVQXHHOZ-UHFFFAOYSA-N 1 2 301.349 4.475 20 0 DIADLO CC(C)c1nnc2n1CC[N@@H+](CC[C@H]1C[C@H](C)C[C@H](C)C1)[C@H]2C ZINC001176373002 1048665413 /nfs/dbraw/zinc/66/54/13/1048665413.db2.gz LPEZGRLRFFLNHT-VVLHAWIVSA-N 1 2 318.509 4.241 20 0 DIADLO CC(C)c1nnc2n1CC[N@H+](CC[C@H]1C[C@H](C)C[C@H](C)C1)[C@H]2C ZINC001176373002 1048665417 /nfs/dbraw/zinc/66/54/17/1048665417.db2.gz LPEZGRLRFFLNHT-VVLHAWIVSA-N 1 2 318.509 4.241 20 0 DIADLO Cc1nonc1C[NH2+][C@H](C)c1ccc(Oc2ccccc2)cc1 ZINC000775332962 1048674477 /nfs/dbraw/zinc/67/44/77/1048674477.db2.gz QAOJCNFTOFCKKR-CYBMUJFWSA-N 1 2 309.369 4.021 20 0 DIADLO FC(F)(F)C1CCC(Nc2ccc(Cn3cc[nH+]c3)cc2)CC1 ZINC001165642251 1048703616 /nfs/dbraw/zinc/70/36/16/1048703616.db2.gz QRSPUTCWGOWMKQ-UHFFFAOYSA-N 1 2 323.362 4.464 20 0 DIADLO CC(C)c1ccccc1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001190238838 1048710086 /nfs/dbraw/zinc/71/00/86/1048710086.db2.gz GUNJMLQXBMZJKH-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@@H+]1CCO[C@H](c3cccc(F)c3)C1)CC2 ZINC000482953241 1048711440 /nfs/dbraw/zinc/71/14/40/1048711440.db2.gz WAJGLPOFCVOYAR-OALUTQOASA-N 1 2 315.363 4.026 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@H+]1CCO[C@H](c3cccc(F)c3)C1)CC2 ZINC000482953241 1048711450 /nfs/dbraw/zinc/71/14/50/1048711450.db2.gz WAJGLPOFCVOYAR-OALUTQOASA-N 1 2 315.363 4.026 20 0 DIADLO CC1(C)CC(CNC(=O)c2cc3c[nH+]ccc3[nH]2)CC(C)(C)C1 ZINC001165785884 1048718586 /nfs/dbraw/zinc/71/85/86/1048718586.db2.gz RIGNTUXCRNOOET-UHFFFAOYSA-N 1 2 313.445 4.145 20 0 DIADLO O=C(c1cccc(C2CCCC2)c1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000668191568 1048724303 /nfs/dbraw/zinc/72/43/03/1048724303.db2.gz FZPYVEADCHCAMB-LJQANCHMSA-N 1 2 323.440 4.018 20 0 DIADLO Cn1cc(Nc2cc(Cl)c3[nH+]ccn3c2)c(-c2ccccc2)n1 ZINC001176567985 1048726785 /nfs/dbraw/zinc/72/67/85/1048726785.db2.gz MCDXGLIJECJZIM-UHFFFAOYSA-N 1 2 323.787 4.132 20 0 DIADLO CCc1ccc(NC(=O)C[N@H+](C)[C@@H](C)c2ccccc2F)cc1 ZINC001190392400 1048727209 /nfs/dbraw/zinc/72/72/09/1048727209.db2.gz OWYBONMOPZDDRM-AWEZNQCLSA-N 1 2 314.404 4.020 20 0 DIADLO CCc1ccc(NC(=O)C[N@@H+](C)[C@@H](C)c2ccccc2F)cc1 ZINC001190392400 1048727223 /nfs/dbraw/zinc/72/72/23/1048727223.db2.gz OWYBONMOPZDDRM-AWEZNQCLSA-N 1 2 314.404 4.020 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@](C)(CC)c2ccccc2)n1 ZINC000775386365 1048736246 /nfs/dbraw/zinc/73/62/46/1048736246.db2.gz CWONEWHNICRNKI-SUMWQHHRSA-N 1 2 319.474 4.299 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc(CCC(C)C)no1)c1ccccc1 ZINC000775387787 1048738518 /nfs/dbraw/zinc/73/85/18/1048738518.db2.gz MGOPDJILNQTVBR-GOSISDBHSA-N 1 2 301.434 4.073 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(OC(F)(F)F)cc2)[nH+]1 ZINC001176638443 1048742523 /nfs/dbraw/zinc/74/25/23/1048742523.db2.gz TXMUHZWOCWQYDQ-UHFFFAOYSA-N 1 2 307.275 4.285 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@H]2c2cccs2)o1 ZINC000483142353 1048745550 /nfs/dbraw/zinc/74/55/50/1048745550.db2.gz JAIGFIVRYRNLLI-NSHDSACASA-N 1 2 312.232 4.441 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@H]2c2cccs2)o1 ZINC000483142353 1048745565 /nfs/dbraw/zinc/74/55/65/1048745565.db2.gz JAIGFIVRYRNLLI-NSHDSACASA-N 1 2 312.232 4.441 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@H+](CCCC)[C@H](C)c1ccc(C)o1 ZINC001190588820 1048762369 /nfs/dbraw/zinc/76/23/69/1048762369.db2.gz FYIYQVNSJBUQDT-HZPDHXFCSA-N 1 2 309.450 4.483 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@@H+](CCCC)[C@H](C)c1ccc(C)o1 ZINC001190588820 1048762378 /nfs/dbraw/zinc/76/23/78/1048762378.db2.gz FYIYQVNSJBUQDT-HZPDHXFCSA-N 1 2 309.450 4.483 20 0 DIADLO Clc1sccc1C[N@@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000483255780 1048763613 /nfs/dbraw/zinc/76/36/13/1048763613.db2.gz LFWBIJCVUFBRSL-KRWDZBQOSA-N 1 2 319.857 4.075 20 0 DIADLO Clc1sccc1C[N@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000483255780 1048763622 /nfs/dbraw/zinc/76/36/22/1048763622.db2.gz LFWBIJCVUFBRSL-KRWDZBQOSA-N 1 2 319.857 4.075 20 0 DIADLO FC(F)(F)c1ccc(C=CNc2cccn3cc[nH+]c23)cc1 ZINC001176661715 1048766650 /nfs/dbraw/zinc/76/66/50/1048766650.db2.gz XXZYQVKTQOBDJL-BQYQJAHWSA-N 1 2 303.287 4.436 20 0 DIADLO CCCOc1ccc(C(C)(C)[NH2+]Cc2nc(C(C)C)no2)cc1 ZINC000483282387 1048773056 /nfs/dbraw/zinc/77/30/56/1048773056.db2.gz WARQSHFLNZBPHC-UHFFFAOYSA-N 1 2 317.433 4.007 20 0 DIADLO CC(C)(C)c1cn(CCOc2ccccc2C(F)(F)F)c[nH+]1 ZINC001166619816 1048774255 /nfs/dbraw/zinc/77/42/55/1048774255.db2.gz ZYGNLTDLGUOBRY-UHFFFAOYSA-N 1 2 312.335 4.278 20 0 DIADLO CCC[C@H](C)c1cc(Nc2ccc[nH+]c2N2CCCC2)on1 ZINC001176743334 1048777775 /nfs/dbraw/zinc/77/77/75/1048777775.db2.gz IMSFDJXTVIRLAJ-ZDUSSCGKSA-N 1 2 300.406 4.317 20 0 DIADLO Cc1nc2c(F)cccc2cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176750532 1048778017 /nfs/dbraw/zinc/77/80/17/1048778017.db2.gz XRNSODWSMLNLQQ-UHFFFAOYSA-N 1 2 322.387 4.421 20 0 DIADLO Fc1cccc(-c2cc(Nc3ccc[nH+]c3N3CCCC3)on2)c1 ZINC001176750507 1048778301 /nfs/dbraw/zinc/77/83/01/1048778301.db2.gz WSYYUCGKJDCKNA-UHFFFAOYSA-N 1 2 324.359 4.220 20 0 DIADLO Clc1cnc(Cl)c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001176743734 1048778610 /nfs/dbraw/zinc/77/86/10/1048778610.db2.gz LDIWMVGHNZTEMB-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO c1cncc(-c2cccc(Nc3ccc[nH+]c3N3CCCC3)c2)c1 ZINC001176750784 1048778977 /nfs/dbraw/zinc/77/89/77/1048778977.db2.gz MJELCYKBHYROLP-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO c1c(-c2ccccc2)noc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176743387 1048779220 /nfs/dbraw/zinc/77/92/20/1048779220.db2.gz JLLWLLJWPQELPU-UHFFFAOYSA-N 1 2 306.369 4.080 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1nc2ccccc2o1 ZINC000110033179 1048780515 /nfs/dbraw/zinc/78/05/15/1048780515.db2.gz YXOVOPJXRLVOKM-SIFCLUCFSA-N 1 2 322.408 4.178 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@H+]1Cc1nc2ccccc2o1 ZINC000110033179 1048780525 /nfs/dbraw/zinc/78/05/25/1048780525.db2.gz YXOVOPJXRLVOKM-SIFCLUCFSA-N 1 2 322.408 4.178 20 0 DIADLO CSc1ccc(OCC[N@@H+]2Cc3cccc(Cl)c3C2)cc1 ZINC001176797946 1048788331 /nfs/dbraw/zinc/78/83/31/1048788331.db2.gz HUHIWDPDPBPILY-UHFFFAOYSA-N 1 2 319.857 4.457 20 0 DIADLO CSc1ccc(OCC[N@H+]2Cc3cccc(Cl)c3C2)cc1 ZINC001176797946 1048788343 /nfs/dbraw/zinc/78/83/43/1048788343.db2.gz HUHIWDPDPBPILY-UHFFFAOYSA-N 1 2 319.857 4.457 20 0 DIADLO Cc1nc(N2CCC[C@H](C(F)F)C2)cc(C2CCCCC2)[nH+]1 ZINC001166773853 1048789991 /nfs/dbraw/zinc/78/99/91/1048789991.db2.gz FHCFAOYRPPVRSZ-AWEZNQCLSA-N 1 2 309.404 4.314 20 0 DIADLO COC(C)(C)[C@@H]1CCCN1c1[nH+]ccc2cc(Cl)ccc21 ZINC001166791121 1048795461 /nfs/dbraw/zinc/79/54/61/1048795461.db2.gz CUECABLHXSWIAE-HNNXBMFYSA-N 1 2 304.821 4.282 20 0 DIADLO COCC[N@H+](CC(F)F)CC1CCC(c2ccccc2)CC1 ZINC001190872216 1048795669 /nfs/dbraw/zinc/79/56/69/1048795669.db2.gz HKQQXYAUPXXFDC-UHFFFAOYSA-N 1 2 311.416 4.174 20 0 DIADLO COCC[N@@H+](CC(F)F)CC1CCC(c2ccccc2)CC1 ZINC001190872216 1048795673 /nfs/dbraw/zinc/79/56/73/1048795673.db2.gz HKQQXYAUPXXFDC-UHFFFAOYSA-N 1 2 311.416 4.174 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3Cl)C2)cc1 ZINC001190923841 1048798637 /nfs/dbraw/zinc/79/86/37/1048798637.db2.gz HLKCODGYIPJJBC-LJQANCHMSA-N 1 2 315.844 4.476 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3Cl)C2)cc1 ZINC001190923841 1048798651 /nfs/dbraw/zinc/79/86/51/1048798651.db2.gz HLKCODGYIPJJBC-LJQANCHMSA-N 1 2 315.844 4.476 20 0 DIADLO CC[C@@H](CC(F)F)C[N@@H+]1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000851746948 1048799353 /nfs/dbraw/zinc/79/93/53/1048799353.db2.gz CVTMHQZCJRLFMO-XHDPSFHLSA-N 1 2 319.342 4.020 20 0 DIADLO CC[C@@H](CC(F)F)C[N@H+]1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000851746948 1048799364 /nfs/dbraw/zinc/79/93/64/1048799364.db2.gz CVTMHQZCJRLFMO-XHDPSFHLSA-N 1 2 319.342 4.020 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1coc(-c3ccccc3F)n1)C2 ZINC001190905164 1048805325 /nfs/dbraw/zinc/80/53/25/1048805325.db2.gz WJRWEXDEOLTBSJ-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1coc(-c3ccccc3F)n1)C2 ZINC001190905164 1048805343 /nfs/dbraw/zinc/80/53/43/1048805343.db2.gz WJRWEXDEOLTBSJ-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Fc1cccc(C[NH+]2CCC(=Cc3ccccc3F)CC2)n1 ZINC000851807475 1048805663 /nfs/dbraw/zinc/80/56/63/1048805663.db2.gz GTFPDMICZOUFLE-UHFFFAOYSA-N 1 2 300.352 4.039 20 0 DIADLO ClC(Cl)=CC[N@H+]1CC=C(c2ccc(Cl)nc2)CC1 ZINC000851891386 1048809066 /nfs/dbraw/zinc/80/90/66/1048809066.db2.gz RADWSPWQRGONNQ-UHFFFAOYSA-N 1 2 303.620 4.143 20 0 DIADLO ClC(Cl)=CC[N@@H+]1CC=C(c2ccc(Cl)nc2)CC1 ZINC000851891386 1048809076 /nfs/dbraw/zinc/80/90/76/1048809076.db2.gz RADWSPWQRGONNQ-UHFFFAOYSA-N 1 2 303.620 4.143 20 0 DIADLO C[C@H]([NH2+]CC=C(Cl)Cl)c1nc2ccccc2n1C(F)F ZINC000851966684 1048816151 /nfs/dbraw/zinc/81/61/51/1048816151.db2.gz QKWNHKBPGUHUQP-QMMMGPOBSA-N 1 2 320.170 4.401 20 0 DIADLO O=C(c1ccc(F)cc1)C1CC[NH+](CC=C(Cl)Cl)CC1 ZINC000851998054 1048816670 /nfs/dbraw/zinc/81/66/70/1048816670.db2.gz PKKMICDVQNTLDZ-UHFFFAOYSA-N 1 2 316.203 4.039 20 0 DIADLO CCC(CC)C[N@H+](CC)Cc1ncsc1Br ZINC001166996307 1048823979 /nfs/dbraw/zinc/82/39/79/1048823979.db2.gz ACLZPDCGQCGACT-UHFFFAOYSA-N 1 2 305.285 4.164 20 0 DIADLO CCC(CC)C[N@@H+](CC)Cc1ncsc1Br ZINC001166996307 1048824005 /nfs/dbraw/zinc/82/40/05/1048824005.db2.gz ACLZPDCGQCGACT-UHFFFAOYSA-N 1 2 305.285 4.164 20 0 DIADLO ClC(Cl)=CC[N@@H+]1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000852173721 1048825172 /nfs/dbraw/zinc/82/51/72/1048825172.db2.gz YCNMOOGPKFVCAA-OAHLLOKOSA-N 1 2 312.240 4.159 20 0 DIADLO ClC(Cl)=CC[N@H+]1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000852173721 1048825186 /nfs/dbraw/zinc/82/51/86/1048825186.db2.gz YCNMOOGPKFVCAA-OAHLLOKOSA-N 1 2 312.240 4.159 20 0 DIADLO Cc1nc(N(C)Cc2csc(C(C)C)n2)cc(C(C)C)[nH+]1 ZINC001167004987 1048827386 /nfs/dbraw/zinc/82/73/86/1048827386.db2.gz NPBFBOVIJXBXDI-UHFFFAOYSA-N 1 2 304.463 4.125 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1nc3ccccc3o1)CCS2 ZINC001177158060 1048841116 /nfs/dbraw/zinc/84/11/16/1048841116.db2.gz QXABBVXHTNURHQ-ZDUSSCGKSA-N 1 2 314.385 4.294 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)nc1C(F)(F)F)c1cscn1 ZINC000852417369 1048841649 /nfs/dbraw/zinc/84/16/49/1048841649.db2.gz RZXSSMINVSZZNI-SSDOTTSWSA-N 1 2 321.755 4.061 20 0 DIADLO CCOc1cncc(CNc2ccc(Nc3ccccc3)c[nH+]2)c1 ZINC001203193901 1048843260 /nfs/dbraw/zinc/84/32/60/1048843260.db2.gz CAXWYSBUQIITGM-UHFFFAOYSA-N 1 2 320.396 4.231 20 0 DIADLO C[C@@H]1[C@@H](c2cccc(Cl)c2)OCC[N@@H+]1CC1CC(F)(F)C1 ZINC000852572924 1048852387 /nfs/dbraw/zinc/85/23/87/1048852387.db2.gz BMGINRRDUAHKKO-ABAIWWIYSA-N 1 2 315.791 4.147 20 0 DIADLO C[C@@H]1[C@@H](c2cccc(Cl)c2)OCC[N@H+]1CC1CC(F)(F)C1 ZINC000852572924 1048852409 /nfs/dbraw/zinc/85/24/09/1048852409.db2.gz BMGINRRDUAHKKO-ABAIWWIYSA-N 1 2 315.791 4.147 20 0 DIADLO Clc1cc(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)cc(Cl)n1 ZINC000852681336 1048853171 /nfs/dbraw/zinc/85/31/71/1048853171.db2.gz OBTAWKNGDPLLRC-CQSZACIVSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cc(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)cc(Cl)n1 ZINC000852681336 1048853196 /nfs/dbraw/zinc/85/31/96/1048853196.db2.gz OBTAWKNGDPLLRC-CQSZACIVSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccc(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c(Cl)n1 ZINC000852681554 1048855742 /nfs/dbraw/zinc/85/57/42/1048855742.db2.gz SZDWNZPCPVEQBN-CQSZACIVSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccc(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c(Cl)n1 ZINC000852681554 1048855760 /nfs/dbraw/zinc/85/57/60/1048855760.db2.gz SZDWNZPCPVEQBN-CQSZACIVSA-N 1 2 323.223 4.042 20 0 DIADLO Cc1cc(CNc2ccc(N3CCCCC3)c[nH+]2)cc(Cl)n1 ZINC000797595952 1048857356 /nfs/dbraw/zinc/85/73/56/1048857356.db2.gz KFLDXVAKTYQNNA-UHFFFAOYSA-N 1 2 316.836 4.041 20 0 DIADLO Fc1ccc([C@@H]2CSCC[N@@H+]2Cc2ccccc2F)cc1 ZINC001203353868 1048862151 /nfs/dbraw/zinc/86/21/51/1048862151.db2.gz QFRXUYGMSXKQHM-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1ccc([C@@H]2CSCC[N@H+]2Cc2ccccc2F)cc1 ZINC001203353868 1048862163 /nfs/dbraw/zinc/86/21/63/1048862163.db2.gz QFRXUYGMSXKQHM-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+]Cc1cccc(F)c1F ZINC001203300865 1048864184 /nfs/dbraw/zinc/86/41/84/1048864184.db2.gz QRUJVXHWKHFYIL-UHFFFAOYSA-N 1 2 320.364 4.280 20 0 DIADLO Clc1ccc(-c2cc3n(n2)CC[N@H+](Cc2ccccc2)C3)cc1 ZINC001203315038 1048867482 /nfs/dbraw/zinc/86/74/82/1048867482.db2.gz GJRRVSMXPZQAQC-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Clc1ccc(-c2cc3n(n2)CC[N@@H+](Cc2ccccc2)C3)cc1 ZINC001203315038 1048867499 /nfs/dbraw/zinc/86/74/99/1048867499.db2.gz GJRRVSMXPZQAQC-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Cc1cn2cccc(Nc3cccc(C(=O)C(F)(F)F)c3)c2[nH+]1 ZINC001203336442 1048873491 /nfs/dbraw/zinc/87/34/91/1048873491.db2.gz HBFDPVHZRSMZJL-UHFFFAOYSA-N 1 2 319.286 4.131 20 0 DIADLO C[C@@H](CCCC(F)(F)F)Nc1ccc(N2CCCC2)[nH+]c1 ZINC000163281855 1048873877 /nfs/dbraw/zinc/87/38/77/1048873877.db2.gz AGWLPPJCUGGELZ-LBPRGKRZSA-N 1 2 301.356 4.215 20 0 DIADLO Cc1ccc(Nc2c(Cl)nccc2Br)c(C)[nH+]1 ZINC001203370274 1048882331 /nfs/dbraw/zinc/88/23/31/1048882331.db2.gz YSDXBANSJARWBO-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1ccc(Nc2nc3cc(Br)ccc3o2)c(C)[nH+]1 ZINC001203363203 1048883419 /nfs/dbraw/zinc/88/34/19/1048883419.db2.gz NNWODWMIONBLSX-UHFFFAOYSA-N 1 2 318.174 4.346 20 0 DIADLO c1cc2cc(CNc3ccc(N4CCCCC4)c[nH+]3)ccc2o1 ZINC001177403821 1048883502 /nfs/dbraw/zinc/88/35/02/1048883502.db2.gz DJJLPVYEEOGBRL-UHFFFAOYSA-N 1 2 307.397 4.430 20 0 DIADLO COc1cccc(Cn2ncc(C)c2Nc2ccc(C)[nH+]c2C)c1 ZINC001203370304 1048887499 /nfs/dbraw/zinc/88/74/99/1048887499.db2.gz ZIAGIKVQDOTFLO-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO C[C@H]1CO[C@@H](c2cccc(Cl)c2)C[N@@H+]1Cc1cccs1 ZINC000483975570 1048889133 /nfs/dbraw/zinc/88/91/33/1048889133.db2.gz GZDPKILUUSRVMO-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@@H](c2cccc(Cl)c2)C[N@H+]1Cc1cccs1 ZINC000483975570 1048889154 /nfs/dbraw/zinc/88/91/54/1048889154.db2.gz GZDPKILUUSRVMO-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO CC[C@]1(C)CCC[N@@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191214544 1048890296 /nfs/dbraw/zinc/89/02/96/1048890296.db2.gz PPVMTODOPMBEDH-NVXWUHKLSA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@]1(C)CCC[N@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191214544 1048890316 /nfs/dbraw/zinc/89/03/16/1048890316.db2.gz PPVMTODOPMBEDH-NVXWUHKLSA-N 1 2 309.837 4.066 20 0 DIADLO Cc1ccc(-c2ccc(C(=O)Nc3cccc4[nH+]ccn43)cc2)o1 ZINC001191189401 1048893971 /nfs/dbraw/zinc/89/39/71/1048893971.db2.gz XKDDYJOTIGGZJS-UHFFFAOYSA-N 1 2 317.348 4.155 20 0 DIADLO COc1ccc(Cl)c(C[NH2+][C@@H](C)c2c(F)cccc2F)c1 ZINC000484101712 1048898649 /nfs/dbraw/zinc/89/86/49/1048898649.db2.gz QOFZSCBZAAPXQC-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2csnc2OC)o1 ZINC001191259036 1048901425 /nfs/dbraw/zinc/90/14/25/1048901425.db2.gz RUTVQLGETRLZMX-DOMZBBRYSA-N 1 2 320.458 4.280 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2csnc2OC)o1 ZINC001191259036 1048901434 /nfs/dbraw/zinc/90/14/34/1048901434.db2.gz RUTVQLGETRLZMX-DOMZBBRYSA-N 1 2 320.458 4.280 20 0 DIADLO c1csc(-c2nc(C[NH2+]Cc3cnc(C4CC4)s3)co2)c1 ZINC001177506376 1048902886 /nfs/dbraw/zinc/90/28/86/1048902886.db2.gz LIQBMPYZRGARHB-UHFFFAOYSA-N 1 2 317.439 4.027 20 0 DIADLO CNc1ccc(Nc2c(O)cc(C(F)(F)F)cc2Cl)c[nH+]1 ZINC001203458912 1048904965 /nfs/dbraw/zinc/90/49/65/1048904965.db2.gz AYJNTHQVPQUTHP-UHFFFAOYSA-N 1 2 317.698 4.245 20 0 DIADLO Fc1ccc2c(C[NH2+]Cc3cc(Cl)ccc3F)noc2c1 ZINC001203458028 1048907407 /nfs/dbraw/zinc/90/74/07/1048907407.db2.gz TXEWLLJDLYIQDV-UHFFFAOYSA-N 1 2 308.715 4.049 20 0 DIADLO CNc1ccc(Nc2cc3ccccc3nc2C(F)(F)F)c[nH+]1 ZINC001203453263 1048907614 /nfs/dbraw/zinc/90/76/14/1048907614.db2.gz ZQKIVJMZAMOWOK-UHFFFAOYSA-N 1 2 318.302 4.434 20 0 DIADLO FC(F)(F)CC[N@H+](CC1CC1)Cn1ncc(Cl)c1C1CC1 ZINC000853501311 1048908547 /nfs/dbraw/zinc/90/85/47/1048908547.db2.gz FNVQFUPGGPHNJJ-UHFFFAOYSA-N 1 2 321.774 4.036 20 0 DIADLO FC(F)(F)CC[N@@H+](CC1CC1)Cn1ncc(Cl)c1C1CC1 ZINC000853501311 1048908563 /nfs/dbraw/zinc/90/85/63/1048908563.db2.gz FNVQFUPGGPHNJJ-UHFFFAOYSA-N 1 2 321.774 4.036 20 0 DIADLO Clc1ccc(/C=C\C[N@@H+]2CCOC[C@H]2c2ccccc2)cc1 ZINC001191243042 1048909715 /nfs/dbraw/zinc/90/97/15/1048909715.db2.gz BKBHWCVLPZMZOT-HMECNJMJSA-N 1 2 313.828 4.427 20 0 DIADLO Clc1ccc(/C=C\C[N@H+]2CCOC[C@H]2c2ccccc2)cc1 ZINC001191243042 1048909722 /nfs/dbraw/zinc/90/97/22/1048909722.db2.gz BKBHWCVLPZMZOT-HMECNJMJSA-N 1 2 313.828 4.427 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cc(C)ccc1NC ZINC001203465001 1048909841 /nfs/dbraw/zinc/90/98/41/1048909841.db2.gz UKOPSTVUMWMVIF-UHFFFAOYSA-N 1 2 301.459 4.297 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1ccc(C)cc1OC ZINC001203464102 1048910302 /nfs/dbraw/zinc/91/03/02/1048910302.db2.gz LAEVEMXQARGZFU-UHFFFAOYSA-N 1 2 302.443 4.264 20 0 DIADLO Fc1ccc2oc(C[NH2+]Cc3ccc(F)c(Cl)c3)nc2c1 ZINC001177590578 1048920548 /nfs/dbraw/zinc/92/05/48/1048920548.db2.gz SLMROZRFFOMAKP-UHFFFAOYSA-N 1 2 308.715 4.049 20 0 DIADLO Cc1cc(CNc2[nH]c3ccc(Br)cc3[nH+]2)c(C)o1 ZINC001203529831 1048921381 /nfs/dbraw/zinc/92/13/81/1048921381.db2.gz KDTHSAIKLMFJNI-UHFFFAOYSA-N 1 2 320.190 4.147 20 0 DIADLO Cc1cc(CNc2[nH]c3cc(Br)ccc3[nH+]2)c(C)o1 ZINC001203529831 1048921390 /nfs/dbraw/zinc/92/13/90/1048921390.db2.gz KDTHSAIKLMFJNI-UHFFFAOYSA-N 1 2 320.190 4.147 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2cc(-c3ccccc3)no2)CC1 ZINC000775451956 1048923257 /nfs/dbraw/zinc/92/32/57/1048923257.db2.gz MMCDVGUDELDFRY-UHFFFAOYSA-N 1 2 308.356 4.260 20 0 DIADLO CC1(C)C[N@H+](Cc2nc(C3CC3)cs2)CC[C@H]1C(F)(F)F ZINC000484346463 1048928744 /nfs/dbraw/zinc/92/87/44/1048928744.db2.gz RGUAIFPURIRISC-GFCCVEGCSA-N 1 2 318.408 4.431 20 0 DIADLO CC1(C)C[N@@H+](Cc2nc(C3CC3)cs2)CC[C@H]1C(F)(F)F ZINC000484346463 1048928755 /nfs/dbraw/zinc/92/87/55/1048928755.db2.gz RGUAIFPURIRISC-GFCCVEGCSA-N 1 2 318.408 4.431 20 0 DIADLO CC(C)c1nc([C@H]2CCCC[N@@H+]2C[C@H]2CCC(F)(F)C2)no1 ZINC001191382013 1048931352 /nfs/dbraw/zinc/93/13/52/1048931352.db2.gz PAQDEHSHPYEQEI-QWHCGFSZSA-N 1 2 313.392 4.155 20 0 DIADLO CC(C)c1nc([C@H]2CCCC[N@H+]2C[C@H]2CCC(F)(F)C2)no1 ZINC001191382013 1048931364 /nfs/dbraw/zinc/93/13/64/1048931364.db2.gz PAQDEHSHPYEQEI-QWHCGFSZSA-N 1 2 313.392 4.155 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cn3cc(C(F)(F)F)ccc3n2)c1 ZINC001203657456 1048951339 /nfs/dbraw/zinc/95/13/39/1048951339.db2.gz MWZDLXHQNVXGLX-UHFFFAOYSA-N 1 2 306.291 4.109 20 0 DIADLO Fc1ccc(/C=C/C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)cc1F ZINC001203665919 1048952785 /nfs/dbraw/zinc/95/27/85/1048952785.db2.gz TYRMSWXVQJTWNI-CMDLKFMISA-N 1 2 319.326 4.039 20 0 DIADLO COc1ccc(Nc2cc(C)c[nH+]c2C)cc1Br ZINC001203663847 1048954288 /nfs/dbraw/zinc/95/42/88/1048954288.db2.gz WZHRTKFQSYQKTC-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cc(Br)c(C)cc2N)c1 ZINC001203663649 1048955182 /nfs/dbraw/zinc/95/51/82/1048955182.db2.gz VKHYKWSVUIGMFB-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc3c(cnn3[C@H]3CCCCO3)c2)c1 ZINC001203663440 1048955518 /nfs/dbraw/zinc/95/55/18/1048955518.db2.gz QUQNTUMXUGUFOL-LJQANCHMSA-N 1 2 322.412 4.491 20 0 DIADLO CC(C)CCOc1ccc(NCc2cccc3[nH+]ccn32)cc1 ZINC001177928608 1048964224 /nfs/dbraw/zinc/96/42/24/1048964224.db2.gz NKXIDTQEONWTSF-UHFFFAOYSA-N 1 2 309.413 4.371 20 0 DIADLO COC(=O)c1ccc(Nc2ccc([NH+]3CCCCC3)cc2)s1 ZINC001203712096 1048972503 /nfs/dbraw/zinc/97/25/03/1048972503.db2.gz CLDSCQWJDHFRKL-UHFFFAOYSA-N 1 2 316.426 4.269 20 0 DIADLO c1c(-c2ccncc2)noc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718268 1048975294 /nfs/dbraw/zinc/97/52/94/1048975294.db2.gz YZOVOHXJJGRFBL-UHFFFAOYSA-N 1 2 320.396 4.471 20 0 DIADLO CCOc1ccc(N)cc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718849 1048975508 /nfs/dbraw/zinc/97/55/08/1048975508.db2.gz DVAUKMMZPPKBAP-UHFFFAOYSA-N 1 2 311.429 4.401 20 0 DIADLO FC(F)(F)c1nccnc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718932 1048976617 /nfs/dbraw/zinc/97/66/17/1048976617.db2.gz NIHWMSVZJJIJST-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO Nc1cccc2c1N(c1ccc([NH+]3CCCCC3)cc1)CCC2 ZINC001203723888 1048978896 /nfs/dbraw/zinc/97/88/96/1048978896.db2.gz BXDQVMYCODAQIG-UHFFFAOYSA-N 1 2 307.441 4.343 20 0 DIADLO O[C@@H]1CCOc2c(Nc3ccc([NH+]4CCCCC4)cc3)cccc21 ZINC001203724970 1048981124 /nfs/dbraw/zinc/98/11/24/1048981124.db2.gz YPQVJGANQKZQGU-LJQANCHMSA-N 1 2 324.424 4.236 20 0 DIADLO O=C1CCc2c(Nc3ccc([NH+]4CCCCC4)cc3)cccc2N1 ZINC001203724439 1048981693 /nfs/dbraw/zinc/98/16/93/1048981693.db2.gz ODDMUQIVURHIMQ-UHFFFAOYSA-N 1 2 321.424 4.305 20 0 DIADLO Nc1ccc2c(c1)N(c1ccc([NH+]3CCCCC3)cc1)CCC2 ZINC001203724421 1048982272 /nfs/dbraw/zinc/98/22/72/1048982272.db2.gz NIGUUORTVIUYDS-UHFFFAOYSA-N 1 2 307.441 4.343 20 0 DIADLO CN1CCc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc21 ZINC001203725050 1048982512 /nfs/dbraw/zinc/98/25/12/1048982512.db2.gz DBFICHINURUVDB-UHFFFAOYSA-N 1 2 307.441 4.413 20 0 DIADLO Nc1ccccc1-c1ccn(-c2ccc([NH+]3CCCCC3)cc2)n1 ZINC001203724231 1048982890 /nfs/dbraw/zinc/98/28/90/1048982890.db2.gz JKHJGJLOCJCFLA-UHFFFAOYSA-N 1 2 318.424 4.112 20 0 DIADLO CCO[C@@H](c1noc([C@@H]2CC[N@@H+]2C2CCCC2)n1)C1CCCC1 ZINC000904136241 1048983916 /nfs/dbraw/zinc/98/39/16/1048983916.db2.gz JNTVGNXUJNNFOK-JKSUJKDBSA-N 1 2 319.449 4.027 20 0 DIADLO CCO[C@@H](c1noc([C@@H]2CC[N@H+]2C2CCCC2)n1)C1CCCC1 ZINC000904136241 1048983931 /nfs/dbraw/zinc/98/39/31/1048983931.db2.gz JNTVGNXUJNNFOK-JKSUJKDBSA-N 1 2 319.449 4.027 20 0 DIADLO Cc1ccc(C)c(C[N@@H+]2CCc3ncc(C(F)(F)F)cc3C2)c1 ZINC001203749395 1048989245 /nfs/dbraw/zinc/98/92/45/1048989245.db2.gz BIEBEZCDRPLDFW-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1ccc(C)c(C[N@H+]2CCc3ncc(C(F)(F)F)cc3C2)c1 ZINC001203749395 1048989259 /nfs/dbraw/zinc/98/92/59/1048989259.db2.gz BIEBEZCDRPLDFW-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO CCNc1ccccc1CNc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001178094296 1048989427 /nfs/dbraw/zinc/98/94/27/1048989427.db2.gz DLODBLAATGEQHT-UHFFFAOYSA-N 1 2 310.376 4.055 20 0 DIADLO Cc1cn2c(cccc2NC(=O)Nc2ccc(Cl)c(C)c2)[nH+]1 ZINC001191731810 1048991089 /nfs/dbraw/zinc/99/10/89/1048991089.db2.gz CWGPKMOTYIMGTJ-UHFFFAOYSA-N 1 2 314.776 4.249 20 0 DIADLO Cc1cc(CNc2ccc(-n3cc[nH+]c3)c(C)c2)cnc1Cl ZINC001178139564 1048991174 /nfs/dbraw/zinc/99/11/74/1048991174.db2.gz YLGZRNLTMMIJPG-UHFFFAOYSA-N 1 2 312.804 4.150 20 0 DIADLO Fc1cccc2cc(CNc3cccc(-n4cc[nH+]c4)c3)cnc12 ZINC001178132309 1048994132 /nfs/dbraw/zinc/99/41/32/1048994132.db2.gz VSTXQNFUUTWLDP-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO Cn1c(CNc2ccc([NH+]3CCCC3)cc2)cc2ccccc21 ZINC001178124605 1048994208 /nfs/dbraw/zinc/99/42/08/1048994208.db2.gz LDMGADCYSTYQAT-UHFFFAOYSA-N 1 2 305.425 4.391 20 0 DIADLO C[C@@H](N[C@@H](C)c1cn2c([nH+]1)CCCC2)c1c(F)cccc1Cl ZINC000925488519 1048994911 /nfs/dbraw/zinc/99/49/11/1048994911.db2.gz KEZVAJFJLYGMLJ-NWDGAFQWSA-N 1 2 321.827 4.424 20 0 DIADLO CCSCc1cc[nH+]c(NCc2ccc(F)c(F)c2F)c1 ZINC001178188340 1048996103 /nfs/dbraw/zinc/99/61/03/1048996103.db2.gz WHCOJHMRZTYMIO-UHFFFAOYSA-N 1 2 312.360 4.364 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)cc1F ZINC001203796380 1048998684 /nfs/dbraw/zinc/99/86/84/1048998684.db2.gz TZIGJKQXUSBXAU-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)cc1F ZINC001203796380 1048998701 /nfs/dbraw/zinc/99/87/01/1048998701.db2.gz TZIGJKQXUSBXAU-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1coc(CNc2cccc3c2CN(c2cccc[nH+]2)C3)c1 ZINC001178213799 1048999157 /nfs/dbraw/zinc/99/91/57/1048999157.db2.gz UINNSEMCWOXEAK-UHFFFAOYSA-N 1 2 305.381 4.115 20 0 DIADLO Clc1cccc(C[NH+](Cc2cccnc2)Cc2cccnc2)c1 ZINC001203799969 1048999797 /nfs/dbraw/zinc/99/97/97/1048999797.db2.gz FAQAARXOYPZURK-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO CCC[C@H]1[C@H](C)CCC[N@@H+]1Cc1ncc(Br)s1 ZINC001191790131 1049001198 /nfs/dbraw/zinc/00/11/98/1049001198.db2.gz UKXONLFOACDQAT-MNOVXSKESA-N 1 2 317.296 4.306 20 0 DIADLO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1ncc(Br)s1 ZINC001191790131 1049001206 /nfs/dbraw/zinc/00/12/06/1049001206.db2.gz UKXONLFOACDQAT-MNOVXSKESA-N 1 2 317.296 4.306 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000776767178 1049001686 /nfs/dbraw/zinc/00/16/86/1049001686.db2.gz ZQKQXJFNRZXTFU-CQSZACIVSA-N 1 2 323.440 4.119 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H]1CCc2c1c(F)ccc2F ZINC000776766719 1049004497 /nfs/dbraw/zinc/00/44/97/1049004497.db2.gz MJXHKKPDBUMYSV-QGZVFWFLSA-N 1 2 302.368 4.439 20 0 DIADLO CCC1(CC)CC[NH+](Cn2nc(C3CCC3)n(C)c2=S)CC1 ZINC000776771932 1049005168 /nfs/dbraw/zinc/00/51/68/1049005168.db2.gz NWIGXANNGZJTHL-UHFFFAOYSA-N 1 2 322.522 4.078 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)cc1O ZINC001203870063 1049018986 /nfs/dbraw/zinc/01/89/86/1049018986.db2.gz OEVSAHLLYJODGF-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)cc1O ZINC001203870063 1049018995 /nfs/dbraw/zinc/01/89/95/1049018995.db2.gz OEVSAHLLYJODGF-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc2c(c1)CC[N@@H+](Cc1cccc(C(F)(F)F)c1)C2 ZINC001203884969 1049022335 /nfs/dbraw/zinc/02/23/35/1049022335.db2.gz ITCKWCWYKOTLHM-UHFFFAOYSA-N 1 2 321.342 4.272 20 0 DIADLO COc1ccc2c(c1)CC[N@H+](Cc1cccc(C(F)(F)F)c1)C2 ZINC001203884969 1049022350 /nfs/dbraw/zinc/02/23/50/1049022350.db2.gz ITCKWCWYKOTLHM-UHFFFAOYSA-N 1 2 321.342 4.272 20 0 DIADLO COc1nc2ccccc2cc1CNc1ccc([NH+](C)C)c(C)c1 ZINC001178360289 1049027535 /nfs/dbraw/zinc/02/75/35/1049027535.db2.gz LQCUHIQKHVYXOL-UHFFFAOYSA-N 1 2 321.424 4.230 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2cc(C(F)(F)F)ccc2F)n1 ZINC000113334641 1049033731 /nfs/dbraw/zinc/03/37/31/1049033731.db2.gz KGYQWLDCIDOZBJ-VIFPVBQESA-N 1 2 318.339 4.460 20 0 DIADLO c1cc2n(c1)CC[N@@H+](Cc1ccc(Oc3ccccc3)cc1)C2 ZINC001203945633 1049041621 /nfs/dbraw/zinc/04/16/21/1049041621.db2.gz GRYIMKUNQJMLRZ-UHFFFAOYSA-N 1 2 304.393 4.296 20 0 DIADLO c1cc2n(c1)CC[N@H+](Cc1ccc(Oc3ccccc3)cc1)C2 ZINC001203945633 1049041633 /nfs/dbraw/zinc/04/16/33/1049041633.db2.gz GRYIMKUNQJMLRZ-UHFFFAOYSA-N 1 2 304.393 4.296 20 0 DIADLO Clc1ccc2c(n1)CC[N@@H+](Cc1ccc3ccccc3c1)C2 ZINC001204000912 1049059047 /nfs/dbraw/zinc/05/90/47/1049059047.db2.gz VKTMRODPRSSRCV-UHFFFAOYSA-N 1 2 308.812 4.447 20 0 DIADLO Clc1ccc2c(n1)CC[N@H+](Cc1ccc3ccccc3c1)C2 ZINC001204000912 1049059060 /nfs/dbraw/zinc/05/90/60/1049059060.db2.gz VKTMRODPRSSRCV-UHFFFAOYSA-N 1 2 308.812 4.447 20 0 DIADLO Brc1ccc2c(c1)C[N@@H+](Cc1cccs1)CC2 ZINC001204015063 1049063892 /nfs/dbraw/zinc/06/38/92/1049063892.db2.gz CBWLGSFCTZMTTC-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1ccc2c(c1)C[N@H+](Cc1cccs1)CC2 ZINC001204015063 1049063906 /nfs/dbraw/zinc/06/39/06/1049063906.db2.gz CBWLGSFCTZMTTC-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000173323572 1049076665 /nfs/dbraw/zinc/07/66/65/1049076665.db2.gz VKVBPKKZCQTKSP-UHFFFAOYSA-N 1 2 322.408 4.375 20 0 DIADLO Clc1cccc([C@@H]2CSCC[N@@H+]2Cc2ccncc2)c1 ZINC001204080842 1049079024 /nfs/dbraw/zinc/07/90/24/1049079024.db2.gz ZAZJXNIPZZRUOT-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cccc([C@@H]2CSCC[N@H+]2Cc2ccncc2)c1 ZINC001204080842 1049079040 /nfs/dbraw/zinc/07/90/40/1049079040.db2.gz ZAZJXNIPZZRUOT-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NC/C=C\c1cccc(F)c1 ZINC001204079962 1049079690 /nfs/dbraw/zinc/07/96/90/1049079690.db2.gz VYMRJQOUUNIYGC-HYXAFXHYSA-N 1 2 315.779 4.491 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cc(O)cc(Cl)c1 ZINC001204079769 1049079765 /nfs/dbraw/zinc/07/97/65/1049079765.db2.gz OLZWBIDHHKXIKF-UHFFFAOYSA-N 1 2 319.767 4.166 20 0 DIADLO Cc1nnsc1[C@@H](C)[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001192325687 1049080536 /nfs/dbraw/zinc/08/05/36/1049080536.db2.gz PGCWEHWPOGSGJU-GFCCVEGCSA-N 1 2 319.861 4.350 20 0 DIADLO Cc1nnsc1[C@@H](C)[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001192325687 1049080549 /nfs/dbraw/zinc/08/05/49/1049080549.db2.gz PGCWEHWPOGSGJU-GFCCVEGCSA-N 1 2 319.861 4.350 20 0 DIADLO CCNc1ccccc1CNc1[nH+]c2cc(F)ccc2n1CC ZINC001204089456 1049080947 /nfs/dbraw/zinc/08/09/47/1049080947.db2.gz NPZXRWAATKRNPX-UHFFFAOYSA-N 1 2 312.392 4.239 20 0 DIADLO C[C@@H](c1nc(-c2ccccc2)no1)[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000484922771 1049082651 /nfs/dbraw/zinc/08/26/51/1049082651.db2.gz CRURZBYMGNIELT-WMLDXEAASA-N 1 2 305.381 4.245 20 0 DIADLO C[C@@H](c1nc(-c2ccccc2)no1)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000484922771 1049082668 /nfs/dbraw/zinc/08/26/68/1049082668.db2.gz CRURZBYMGNIELT-WMLDXEAASA-N 1 2 305.381 4.245 20 0 DIADLO CC[N@H+](Cc1ccc(O)c(OC)c1)Cc1c(F)cccc1Cl ZINC001204117653 1049087231 /nfs/dbraw/zinc/08/72/31/1049087231.db2.gz CSIPZODCRDJQKH-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO CC[N@@H+](Cc1ccc(O)c(OC)c1)Cc1c(F)cccc1Cl ZINC001204117653 1049087245 /nfs/dbraw/zinc/08/72/45/1049087245.db2.gz CSIPZODCRDJQKH-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO Cc1[nH+]c(NCc2cscc2Cl)ccc1-c1cnn(C)c1 ZINC001178778318 1049094088 /nfs/dbraw/zinc/09/40/88/1049094088.db2.gz LEYSDWPIBQNGJI-UHFFFAOYSA-N 1 2 318.833 4.118 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1ccc(C(F)(F)F)cc1 ZINC001204166814 1049102265 /nfs/dbraw/zinc/10/22/65/1049102265.db2.gz ZBMYZSUINAOVEG-UHFFFAOYSA-N 1 2 307.315 4.020 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1ccc(C(F)(F)F)cc1 ZINC001204166814 1049102267 /nfs/dbraw/zinc/10/22/67/1049102267.db2.gz ZBMYZSUINAOVEG-UHFFFAOYSA-N 1 2 307.315 4.020 20 0 DIADLO Fc1ccc(-c2[nH]c3ccc(NCc4ccns4)cc3[nH+]2)cc1 ZINC001178895428 1049104872 /nfs/dbraw/zinc/10/48/72/1049104872.db2.gz KMGYLTPPBRBLTC-UHFFFAOYSA-N 1 2 324.384 4.438 20 0 DIADLO Cc1ccccc1-c1cccc(C[NH2+][C@H](C)c2csnn2)c1 ZINC001178971703 1049115428 /nfs/dbraw/zinc/11/54/28/1049115428.db2.gz LWFZAQCQXYEPNZ-CQSZACIVSA-N 1 2 309.438 4.364 20 0 DIADLO CC[N@H+](Cc1cccc(Br)c1)Cc1ncccc1F ZINC001204261496 1049124012 /nfs/dbraw/zinc/12/40/12/1049124012.db2.gz JHMAWBCLTMRPSR-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1cccc(Br)c1)Cc1ncccc1F ZINC001204261496 1049124014 /nfs/dbraw/zinc/12/40/14/1049124014.db2.gz JHMAWBCLTMRPSR-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO FC(F)(F)Cc1ccc(CNc2cc3cc[nH]c3c[nH+]2)cc1 ZINC001179044950 1049123934 /nfs/dbraw/zinc/12/39/34/1049123934.db2.gz VZSIPXKWKJFMLO-UHFFFAOYSA-N 1 2 305.303 4.280 20 0 DIADLO CC[N@H+](Cc1nc(Cl)cs1)Cc1cccc(Cl)c1 ZINC001204261498 1049123895 /nfs/dbraw/zinc/12/38/95/1049123895.db2.gz JKEVAUVAWOTIQY-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC[N@@H+](Cc1nc(Cl)cs1)Cc1cccc(Cl)c1 ZINC001204261498 1049123896 /nfs/dbraw/zinc/12/38/96/1049123896.db2.gz JKEVAUVAWOTIQY-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc(F)c(Cl)c1)CC2 ZINC001204280895 1049125562 /nfs/dbraw/zinc/12/55/62/1049125562.db2.gz RNONPOPAYVYQJG-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc(F)c(Cl)c1)CC2 ZINC001204280895 1049125572 /nfs/dbraw/zinc/12/55/72/1049125572.db2.gz RNONPOPAYVYQJG-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CCC(F)(F)C[NH2+]Cc1cccc(COc2ccccc2)c1 ZINC001179165280 1049138276 /nfs/dbraw/zinc/13/82/76/1049138276.db2.gz OAUOHRKBEHMAHA-UHFFFAOYSA-N 1 2 305.368 4.401 20 0 DIADLO Cc1nnc(C[NH2+][C@H](C)c2ccc(SC(F)F)cc2)s1 ZINC000775550297 1049139423 /nfs/dbraw/zinc/13/94/23/1049139423.db2.gz YJKICFYCVRJLKO-MRVPVSSYSA-N 1 2 315.414 4.012 20 0 DIADLO C[C@@H]1CO[C@@H](C)C[N@H+]1CCCc1c(Cl)cccc1Cl ZINC001204429433 1049161890 /nfs/dbraw/zinc/16/18/90/1049161890.db2.gz DKRSPAWAHZEXDW-NEPJUHHUSA-N 1 2 302.245 4.035 20 0 DIADLO Cn1ncc(CNc2ccc(Nc3ccccc3)c[nH+]2)c1C1CC1 ZINC001179205550 1049141463 /nfs/dbraw/zinc/14/14/63/1049141463.db2.gz PTTYMGQQFOGDEA-UHFFFAOYSA-N 1 2 319.412 4.048 20 0 DIADLO CCCCCCOc1ccc(C[N@@H+]2CCC(=O)C[C@@H]2C)cc1 ZINC001204365120 1049151930 /nfs/dbraw/zinc/15/19/30/1049151930.db2.gz OFGSZXAOIHNUNK-INIZCTEOSA-N 1 2 303.446 4.199 20 0 DIADLO CCCCCCOc1ccc(C[N@H+]2CCC(=O)C[C@@H]2C)cc1 ZINC001204365120 1049151934 /nfs/dbraw/zinc/15/19/34/1049151934.db2.gz OFGSZXAOIHNUNK-INIZCTEOSA-N 1 2 303.446 4.199 20 0 DIADLO COc1cccc(C[N@@H+]2CCc3c4ccccc4[nH]c3C2)c1C ZINC001193001249 1049160905 /nfs/dbraw/zinc/16/09/05/1049160905.db2.gz GJQNVXBQQNBXOW-UHFFFAOYSA-N 1 2 306.409 4.043 20 0 DIADLO COc1cccc(C[N@H+]2CCc3c4ccccc4[nH]c3C2)c1C ZINC001193001249 1049160911 /nfs/dbraw/zinc/16/09/11/1049160911.db2.gz GJQNVXBQQNBXOW-UHFFFAOYSA-N 1 2 306.409 4.043 20 0 DIADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1CCCc1c(Cl)cccc1Cl ZINC001204429433 1049161886 /nfs/dbraw/zinc/16/18/86/1049161886.db2.gz DKRSPAWAHZEXDW-NEPJUHHUSA-N 1 2 302.245 4.035 20 0 DIADLO COc1cccc2c1CC[N@H+](Cc1ccc(F)cc1Cl)C2 ZINC001204439564 1049162411 /nfs/dbraw/zinc/16/24/11/1049162411.db2.gz ZIOYGLCARCKCEE-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc2c1CC[N@@H+](Cc1ccc(F)cc1Cl)C2 ZINC001204439564 1049162417 /nfs/dbraw/zinc/16/24/17/1049162417.db2.gz ZIOYGLCARCKCEE-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Fc1ccc(C[N@@H+]2CC[C@@H]2COCc2ccccc2)c(Cl)c1 ZINC001204436456 1049162501 /nfs/dbraw/zinc/16/25/01/1049162501.db2.gz GZHIVANHEKAOOY-QGZVFWFLSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1ccc(C[N@H+]2CC[C@@H]2COCc2ccccc2)c(Cl)c1 ZINC001204436456 1049162508 /nfs/dbraw/zinc/16/25/08/1049162508.db2.gz GZHIVANHEKAOOY-QGZVFWFLSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1cc(C(F)(F)F)ccc1C[N@@H+]1CCc2sccc2C1 ZINC001204465047 1049168676 /nfs/dbraw/zinc/16/86/76/1049168676.db2.gz BKDSTDGNSVFPAH-UHFFFAOYSA-N 1 2 315.335 4.464 20 0 DIADLO Fc1cc(C(F)(F)F)ccc1C[N@H+]1CCc2sccc2C1 ZINC001204465047 1049168683 /nfs/dbraw/zinc/16/86/83/1049168683.db2.gz BKDSTDGNSVFPAH-UHFFFAOYSA-N 1 2 315.335 4.464 20 0 DIADLO COc1ccc(F)cc1CNc1[nH+]c2ccccc2n1C(C)C ZINC001179479965 1049170984 /nfs/dbraw/zinc/17/09/84/1049170984.db2.gz YTTDWEHECREJOZ-UHFFFAOYSA-N 1 2 313.376 4.377 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1ccc(C(C)(C)O)cc1 ZINC001179479490 1049171458 /nfs/dbraw/zinc/17/14/58/1049171458.db2.gz NGMJGMUHNLQMOJ-UHFFFAOYSA-N 1 2 323.440 4.457 20 0 DIADLO Cc1ccc(CNc2[nH+]c3ccccc3n2CCC(C)C)cn1 ZINC001179489966 1049172420 /nfs/dbraw/zinc/17/24/20/1049172420.db2.gz YOXUGHYGRLEJFF-UHFFFAOYSA-N 1 2 308.429 4.398 20 0 DIADLO Cc1ncccc1C[N@@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC001204478400 1049173064 /nfs/dbraw/zinc/17/30/64/1049173064.db2.gz YFSMQHNXKSSKHF-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ncccc1C[N@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC001204478400 1049173066 /nfs/dbraw/zinc/17/30/66/1049173066.db2.gz YFSMQHNXKSSKHF-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1cc(C[NH2+]Cc2cc(-c3ccc(F)cc3F)on2)c(C)o1 ZINC001179502123 1049175490 /nfs/dbraw/zinc/17/54/90/1049175490.db2.gz LYNHUNBKUUOELB-UHFFFAOYSA-N 1 2 318.323 4.119 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2c(F)cc(Br)cc2F)CC1 ZINC001204497976 1049176573 /nfs/dbraw/zinc/17/65/73/1049176573.db2.gz VNKYXCHXRGVAGM-SNVBAGLBSA-N 1 2 318.205 4.349 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2c(F)cc(Br)cc2F)CC1 ZINC001204497976 1049176579 /nfs/dbraw/zinc/17/65/79/1049176579.db2.gz VNKYXCHXRGVAGM-SNVBAGLBSA-N 1 2 318.205 4.349 20 0 DIADLO COc1cc(C[NH2+]Cc2ncc(Cl)s2)cc2ccccc21 ZINC001179512573 1049177988 /nfs/dbraw/zinc/17/79/88/1049177988.db2.gz XDQHNEJTFCWNIY-UHFFFAOYSA-N 1 2 318.829 4.248 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)nc1)c1ncc(-c2ccccc2)o1 ZINC001193103618 1049179050 /nfs/dbraw/zinc/17/90/50/1049179050.db2.gz JZECCRDGIMZBQZ-CHWSQXEVSA-N 1 2 311.360 4.288 20 0 DIADLO Fc1cccc(CC[N@@H+]2CCO[C@H](c3cccc(Cl)c3)C2)c1 ZINC001193118127 1049180042 /nfs/dbraw/zinc/18/00/42/1049180042.db2.gz RXHYVTFWVLWUKI-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1cccc(CC[N@H+]2CCO[C@H](c3cccc(Cl)c3)C2)c1 ZINC001193118127 1049180046 /nfs/dbraw/zinc/18/00/46/1049180046.db2.gz RXHYVTFWVLWUKI-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Cc1cc(C)cc(C[N@@H+]2CCc3ncc(C(F)(F)F)cc3C2)c1 ZINC001204525560 1049182272 /nfs/dbraw/zinc/18/22/72/1049182272.db2.gz HFXIHLLUXRRBPN-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C)cc(C[N@H+]2CCc3ncc(C(F)(F)F)cc3C2)c1 ZINC001204525560 1049182274 /nfs/dbraw/zinc/18/22/74/1049182274.db2.gz HFXIHLLUXRRBPN-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cnn(-c2ccccc2)c1 ZINC000339005532 1049184986 /nfs/dbraw/zinc/18/49/86/1049184986.db2.gz UOTOLMUYFJDCFT-OAHLLOKOSA-N 1 2 309.388 4.204 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cnn(-c2ccccc2)c1 ZINC000339005532 1049184990 /nfs/dbraw/zinc/18/49/90/1049184990.db2.gz UOTOLMUYFJDCFT-OAHLLOKOSA-N 1 2 309.388 4.204 20 0 DIADLO CCSc1cccc(C[N@H+](CC(=O)OC(C)(C)C)C(C)C)c1 ZINC001204550662 1049187401 /nfs/dbraw/zinc/18/74/01/1049187401.db2.gz HSOXRFCXOHDMDT-UHFFFAOYSA-N 1 2 323.502 4.351 20 0 DIADLO CCSc1cccc(C[N@@H+](CC(=O)OC(C)(C)C)C(C)C)c1 ZINC001204550662 1049187405 /nfs/dbraw/zinc/18/74/05/1049187405.db2.gz HSOXRFCXOHDMDT-UHFFFAOYSA-N 1 2 323.502 4.351 20 0 DIADLO Cc1nn(C)cc1C[N@H+](C)Cc1sc2ccccc2c1Cl ZINC001204577798 1049191902 /nfs/dbraw/zinc/19/19/02/1049191902.db2.gz NQEPKLRYCTVLTF-UHFFFAOYSA-N 1 2 319.861 4.229 20 0 DIADLO Cc1nn(C)cc1C[N@@H+](C)Cc1sc2ccccc2c1Cl ZINC001204577798 1049191909 /nfs/dbraw/zinc/19/19/09/1049191909.db2.gz NQEPKLRYCTVLTF-UHFFFAOYSA-N 1 2 319.861 4.229 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cc(C(F)(F)F)co1 ZINC001193293648 1049196099 /nfs/dbraw/zinc/19/60/99/1049196099.db2.gz OVOPALBDBAUKNK-IUCAKERBSA-N 1 2 315.257 4.461 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cc(C(F)(F)F)co1 ZINC001193293648 1049196106 /nfs/dbraw/zinc/19/61/06/1049196106.db2.gz OVOPALBDBAUKNK-IUCAKERBSA-N 1 2 315.257 4.461 20 0 DIADLO CCOc1c(Cl)cccc1C[NH2+]Cc1c(F)cccc1OC ZINC001179681858 1049197404 /nfs/dbraw/zinc/19/74/04/1049197404.db2.gz RMDQOEDAEHTVLU-UHFFFAOYSA-N 1 2 323.795 4.176 20 0 DIADLO Fc1cccc([C@H]([NH2+][C@H]2CCCc3cn[nH]c32)c2ccccc2)c1 ZINC000857857433 1049202305 /nfs/dbraw/zinc/20/23/05/1049202305.db2.gz UFWXMVFHASTSHC-RBUKOAKNSA-N 1 2 321.399 4.305 20 0 DIADLO Fc1cccc([C@H]([NH2+][C@H]2CCCc3c[nH]nc32)c2ccccc2)c1 ZINC000857857433 1049202312 /nfs/dbraw/zinc/20/23/12/1049202312.db2.gz UFWXMVFHASTSHC-RBUKOAKNSA-N 1 2 321.399 4.305 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1cncc(Cl)c1Cl ZINC001204625017 1049205377 /nfs/dbraw/zinc/20/53/77/1049205377.db2.gz JKIQYUQHUVOXAJ-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO C[C@@H](c1ccc(C[N@@H+]2Cc3ccncc3C2)cc1)C(F)(F)F ZINC000857882338 1049204764 /nfs/dbraw/zinc/20/47/64/1049204764.db2.gz QVAWPXLKMYBDHO-LBPRGKRZSA-N 1 2 306.331 4.263 20 0 DIADLO C[C@@H](c1ccc(C[N@H+]2Cc3ccncc3C2)cc1)C(F)(F)F ZINC000857882338 1049204773 /nfs/dbraw/zinc/20/47/73/1049204773.db2.gz QVAWPXLKMYBDHO-LBPRGKRZSA-N 1 2 306.331 4.263 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1cncc(Cl)c1Cl ZINC001204625017 1049205390 /nfs/dbraw/zinc/20/53/90/1049205390.db2.gz JKIQYUQHUVOXAJ-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2ccc(Cl)nc21)c1c(F)cccc1F ZINC000857902898 1049206389 /nfs/dbraw/zinc/20/63/89/1049206389.db2.gz WUNDMYUSTSFODY-RNCFNFMXSA-N 1 2 308.759 4.351 20 0 DIADLO CC(C)c1csc(C[NH2+][C@@H]2CCc3ccc(Cl)nc32)n1 ZINC000857905412 1049210024 /nfs/dbraw/zinc/21/00/24/1049210024.db2.gz GANYJOBYCFZQBZ-LLVKDONJSA-N 1 2 307.850 4.092 20 0 DIADLO CC(C)[C@@H]1CCC[C@H](NC(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC001204648831 1049211419 /nfs/dbraw/zinc/21/14/19/1049211419.db2.gz MSFBBEIJXBIUJW-CABCVRRESA-N 1 2 314.433 4.061 20 0 DIADLO CCCCCC[C@@](C)(CCC)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857982863 1049212704 /nfs/dbraw/zinc/21/27/04/1049212704.db2.gz NEIVSMQMNSYAOR-CRAIPNDOSA-N 1 2 305.466 4.221 20 0 DIADLO CC[N@H+](Cc1cc(COC)cs1)Cc1c(F)cccc1F ZINC001179869516 1049222954 /nfs/dbraw/zinc/22/29/54/1049222954.db2.gz XIUWOWYDDAEBJR-UHFFFAOYSA-N 1 2 311.397 4.195 20 0 DIADLO CC[N@@H+](Cc1cc(COC)cs1)Cc1c(F)cccc1F ZINC001179869516 1049222969 /nfs/dbraw/zinc/22/29/69/1049222969.db2.gz XIUWOWYDDAEBJR-UHFFFAOYSA-N 1 2 311.397 4.195 20 0 DIADLO Brc1ccoc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000858239361 1049230158 /nfs/dbraw/zinc/23/01/58/1049230158.db2.gz RKMCEOCWHTVYIK-HNNXBMFYSA-N 1 2 321.218 4.068 20 0 DIADLO CC(C)Sc1ccccc1NC(=O)c1cccc2[nH+]ccn21 ZINC000777017989 1049236594 /nfs/dbraw/zinc/23/65/94/1049236594.db2.gz CRFNBTIUNKMZDA-UHFFFAOYSA-N 1 2 311.410 4.087 20 0 DIADLO CCc1cnccc1[C@@H](C)[C@@H](c1[nH+]ccn1C)c1cccc(F)c1 ZINC000485432174 1049244297 /nfs/dbraw/zinc/24/42/97/1049244297.db2.gz CDXKLPSSAVEYHS-AUUYWEPGSA-N 1 2 323.415 4.452 20 0 DIADLO Clc1ccccc1-c1ccc(C[N@@H+]2CCn3cccc3C2)o1 ZINC001204738616 1049245771 /nfs/dbraw/zinc/24/57/71/1049245771.db2.gz KQBPEFLAZAYOSJ-UHFFFAOYSA-N 1 2 312.800 4.417 20 0 DIADLO Clc1ccccc1-c1ccc(C[N@H+]2CCn3cccc3C2)o1 ZINC001204738616 1049245785 /nfs/dbraw/zinc/24/57/85/1049245785.db2.gz KQBPEFLAZAYOSJ-UHFFFAOYSA-N 1 2 312.800 4.417 20 0 DIADLO C[C@H]1CC[N@H+](Cn2c(-c3ccccc3)csc2=S)CCO1 ZINC000905740107 1049247306 /nfs/dbraw/zinc/24/73/06/1049247306.db2.gz QYYQYIKXAXEHHU-ZDUSSCGKSA-N 1 2 320.483 4.014 20 0 DIADLO C[C@H]1CC[N@@H+](Cn2c(-c3ccccc3)csc2=S)CCO1 ZINC000905740107 1049247318 /nfs/dbraw/zinc/24/73/18/1049247318.db2.gz QYYQYIKXAXEHHU-ZDUSSCGKSA-N 1 2 320.483 4.014 20 0 DIADLO C[C@@H]1CC[N@H+](Cn2c(-c3ccccc3)csc2=S)CCO1 ZINC000905740105 1049247528 /nfs/dbraw/zinc/24/75/28/1049247528.db2.gz QYYQYIKXAXEHHU-CYBMUJFWSA-N 1 2 320.483 4.014 20 0 DIADLO C[C@@H]1CC[N@@H+](Cn2c(-c3ccccc3)csc2=S)CCO1 ZINC000905740105 1049247537 /nfs/dbraw/zinc/24/75/37/1049247537.db2.gz QYYQYIKXAXEHHU-CYBMUJFWSA-N 1 2 320.483 4.014 20 0 DIADLO CCSCC[C@@H](C)[N@H+](C)Cc1c(Cl)ccnc1Cl ZINC001179957865 1049248112 /nfs/dbraw/zinc/24/81/12/1049248112.db2.gz STIAAEJEXNCFQJ-SNVBAGLBSA-N 1 2 307.290 4.352 20 0 DIADLO CCSCC[C@@H](C)[N@@H+](C)Cc1c(Cl)ccnc1Cl ZINC001179957865 1049248125 /nfs/dbraw/zinc/24/81/25/1049248125.db2.gz STIAAEJEXNCFQJ-SNVBAGLBSA-N 1 2 307.290 4.352 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2scnc21)c1nc2ccccc2s1 ZINC000858365582 1049249563 /nfs/dbraw/zinc/24/95/63/1049249563.db2.gz PEMIFJSMMORGQA-JQWIXIFHSA-N 1 2 315.467 4.481 20 0 DIADLO Fc1cccc2c1C[N@H+](C/C=C\c1ccc(Cl)cc1)CCO2 ZINC001193795591 1049263315 /nfs/dbraw/zinc/26/33/15/1049263315.db2.gz AFCUYLQDFLDBSD-IHWYPQMZSA-N 1 2 317.791 4.387 20 0 DIADLO Fc1cccc2c1C[N@@H+](C/C=C\c1ccc(Cl)cc1)CCO2 ZINC001193795591 1049263330 /nfs/dbraw/zinc/26/33/30/1049263330.db2.gz AFCUYLQDFLDBSD-IHWYPQMZSA-N 1 2 317.791 4.387 20 0 DIADLO Fc1ccccc1[C@H]1CCCC[N@@H+]1Cc1nc2ccccc2[nH]1 ZINC001204780357 1049263937 /nfs/dbraw/zinc/26/39/37/1049263937.db2.gz VITCMQCJMBQAEY-GOSISDBHSA-N 1 2 309.388 4.429 20 0 DIADLO Fc1ccccc1[C@H]1CCCC[N@H+]1Cc1nc2ccccc2[nH]1 ZINC001204780357 1049263951 /nfs/dbraw/zinc/26/39/51/1049263951.db2.gz VITCMQCJMBQAEY-GOSISDBHSA-N 1 2 309.388 4.429 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@@H+]2CCO[C@@H](c3ccco3)C2)cc1C ZINC001204804199 1049269970 /nfs/dbraw/zinc/26/99/70/1049269970.db2.gz XVQQLSCJSNLSFO-PEAOBZDDSA-N 1 2 311.425 4.292 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@H+]2CCO[C@@H](c3ccco3)C2)cc1C ZINC001204804199 1049269986 /nfs/dbraw/zinc/26/99/86/1049269986.db2.gz XVQQLSCJSNLSFO-PEAOBZDDSA-N 1 2 311.425 4.292 20 0 DIADLO C[N@H+](CC(=O)OC(C)(C)C)Cc1cc(Cl)cc2ccccc21 ZINC001193881137 1049271947 /nfs/dbraw/zinc/27/19/47/1049271947.db2.gz MEKUUAIEUSUHON-UHFFFAOYSA-N 1 2 319.832 4.267 20 0 DIADLO C[N@@H+](CC(=O)OC(C)(C)C)Cc1cc(Cl)cc2ccccc21 ZINC001193881137 1049271958 /nfs/dbraw/zinc/27/19/58/1049271958.db2.gz MEKUUAIEUSUHON-UHFFFAOYSA-N 1 2 319.832 4.267 20 0 DIADLO CSCCCCCCC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000858558387 1049274159 /nfs/dbraw/zinc/27/41/59/1049274159.db2.gz PNWJIXMBOKAEGT-UHFFFAOYSA-N 1 2 317.458 4.124 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@@H+]2CCC[C@@H](c3ccn[nH]3)C2)cc1C ZINC001204840651 1049281580 /nfs/dbraw/zinc/28/15/80/1049281580.db2.gz NNCIDBFRKNWUBC-GJEJWFRCSA-N 1 2 309.457 4.228 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@H+]2CCC[C@@H](c3ccn[nH]3)C2)cc1C ZINC001204840651 1049281586 /nfs/dbraw/zinc/28/15/86/1049281586.db2.gz NNCIDBFRKNWUBC-GJEJWFRCSA-N 1 2 309.457 4.228 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@@H+]2CCC[C@H](c3ccn[nH]3)C2)cc1C ZINC001204840652 1049282548 /nfs/dbraw/zinc/28/25/48/1049282548.db2.gz NNCIDBFRKNWUBC-OQBYNLHGSA-N 1 2 309.457 4.228 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@H+]2CCC[C@H](c3ccn[nH]3)C2)cc1C ZINC001204840652 1049282559 /nfs/dbraw/zinc/28/25/59/1049282559.db2.gz NNCIDBFRKNWUBC-OQBYNLHGSA-N 1 2 309.457 4.228 20 0 DIADLO C[C@H]1C[N@H+](CCc2cc(Cl)cc(Cl)c2)C[C@H](C2CC2)O1 ZINC001193974868 1049289694 /nfs/dbraw/zinc/28/96/94/1049289694.db2.gz DMTLLVAAVFKGMP-MEDUHNTESA-N 1 2 314.256 4.035 20 0 DIADLO C[C@H]1C[N@@H+](CCc2cc(Cl)cc(Cl)c2)C[C@H](C2CC2)O1 ZINC001193974868 1049289706 /nfs/dbraw/zinc/28/97/06/1049289706.db2.gz DMTLLVAAVFKGMP-MEDUHNTESA-N 1 2 314.256 4.035 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@@H+]1CC(C)(C)OCC1(C)C ZINC001180120813 1049291667 /nfs/dbraw/zinc/29/16/67/1049291667.db2.gz LJGSUYGNYQSSOM-UHFFFAOYSA-N 1 2 311.853 4.128 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@H+]1CC(C)(C)OCC1(C)C ZINC001180120813 1049291678 /nfs/dbraw/zinc/29/16/78/1049291678.db2.gz LJGSUYGNYQSSOM-UHFFFAOYSA-N 1 2 311.853 4.128 20 0 DIADLO CCCC[C@@H](CC)COC(=O)NCc1c[nH+]cn1CC1CCC1 ZINC001193983746 1049293501 /nfs/dbraw/zinc/29/35/01/1049293501.db2.gz LGSVYHVOLNNWHJ-OAHLLOKOSA-N 1 2 321.465 4.126 20 0 DIADLO c1cn2c(cccc2-c2cccc3c2cnn3[C@@H]2CCCCO2)[nH+]1 ZINC001204881847 1049295442 /nfs/dbraw/zinc/29/54/42/1049295442.db2.gz MLCWIHDTBBJICS-IBGZPJMESA-N 1 2 318.380 4.050 20 0 DIADLO CCC[N@H+](Cc1cc(Cl)n(C)n1)[C@H](C)c1ccccc1OC ZINC000859098207 1049311490 /nfs/dbraw/zinc/31/14/90/1049311490.db2.gz BZFLZIPFRZTAGY-CYBMUJFWSA-N 1 2 321.852 4.055 20 0 DIADLO CCC[N@@H+](Cc1cc(Cl)n(C)n1)[C@H](C)c1ccccc1OC ZINC000859098207 1049311492 /nfs/dbraw/zinc/31/14/92/1049311492.db2.gz BZFLZIPFRZTAGY-CYBMUJFWSA-N 1 2 321.852 4.055 20 0 DIADLO c1ccc([C@H]2CCC[N@@H+](Cc3noc(C4CCC4)n3)CC2)cc1 ZINC000859116628 1049314710 /nfs/dbraw/zinc/31/47/10/1049314710.db2.gz KUSWYMNXHXKCAR-INIZCTEOSA-N 1 2 311.429 4.107 20 0 DIADLO c1ccc([C@H]2CCC[N@H+](Cc3noc(C4CCC4)n3)CC2)cc1 ZINC000859116628 1049314722 /nfs/dbraw/zinc/31/47/22/1049314722.db2.gz KUSWYMNXHXKCAR-INIZCTEOSA-N 1 2 311.429 4.107 20 0 DIADLO COc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)c1F ZINC001180233363 1049316089 /nfs/dbraw/zinc/31/60/89/1049316089.db2.gz DAIWMKZBKZVSJU-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(C[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)c1F ZINC001180233363 1049316101 /nfs/dbraw/zinc/31/61/01/1049316101.db2.gz DAIWMKZBKZVSJU-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c(F)c1 ZINC001204947861 1049319776 /nfs/dbraw/zinc/31/97/76/1049319776.db2.gz RTISUAUBJHJNFG-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c(F)c1 ZINC001204947861 1049319785 /nfs/dbraw/zinc/31/97/85/1049319785.db2.gz RTISUAUBJHJNFG-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO C[N@@H+](Cc1cscn1)Cc1cc2nc(Cl)ccc2s1 ZINC001180253765 1049321442 /nfs/dbraw/zinc/32/14/42/1049321442.db2.gz QKBLLMMDSPHLRU-UHFFFAOYSA-N 1 2 309.847 4.038 20 0 DIADLO C[N@H+](Cc1cscn1)Cc1cc2nc(Cl)ccc2s1 ZINC001180253765 1049321454 /nfs/dbraw/zinc/32/14/54/1049321454.db2.gz QKBLLMMDSPHLRU-UHFFFAOYSA-N 1 2 309.847 4.038 20 0 DIADLO Clc1ccccc1-c1cc(Nc2ccn3cc[nH+]c3c2)on1 ZINC001204958904 1049322270 /nfs/dbraw/zinc/32/22/70/1049322270.db2.gz DALSTGOMAWOHHP-UHFFFAOYSA-N 1 2 310.744 4.386 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cc(Cl)n(C)n1)c1ccccc1Cl ZINC000859234412 1049324590 /nfs/dbraw/zinc/32/45/90/1049324590.db2.gz QHGKEUIVXOMEKJ-HNNXBMFYSA-N 1 2 312.244 4.214 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1c(F)cncc1F ZINC001194101977 1049329189 /nfs/dbraw/zinc/32/91/89/1049329189.db2.gz TZOCWEXHFFXWLZ-NSHDSACASA-N 1 2 302.324 4.265 20 0 DIADLO CC(C)(C)OC(=O)Nc1ccccc1Nc1ccn2cc[nH+]c2c1 ZINC001204983684 1049331121 /nfs/dbraw/zinc/33/11/21/1049331121.db2.gz ZTIMQFBWABWCTP-UHFFFAOYSA-N 1 2 324.384 4.425 20 0 DIADLO Fc1cc(C(F)(F)F)c(F)cc1Nc1ccn2cc[nH+]c2c1 ZINC001204983470 1049331875 /nfs/dbraw/zinc/33/18/75/1049331875.db2.gz WGCSQKNUTPAANJ-UHFFFAOYSA-N 1 2 313.229 4.375 20 0 DIADLO C[C@H]1C[NH+](Cc2cc(Cl)nc(Cl)c2)C[C@H](C)C1(F)F ZINC000859410660 1049332469 /nfs/dbraw/zinc/33/24/69/1049332469.db2.gz DCNTWXSWZDWWOK-IUCAKERBSA-N 1 2 309.187 4.112 20 0 DIADLO CC[C@H](c1ccc(Br)cc1)[N@@H+]1CCO[C@H](C2CC2)C1 ZINC000485793162 1049337331 /nfs/dbraw/zinc/33/73/31/1049337331.db2.gz MQTJZNHPELNMCZ-CVEARBPZSA-N 1 2 324.262 4.011 20 0 DIADLO CC[C@H](c1ccc(Br)cc1)[N@H+]1CCO[C@H](C2CC2)C1 ZINC000485793162 1049337341 /nfs/dbraw/zinc/33/73/41/1049337341.db2.gz MQTJZNHPELNMCZ-CVEARBPZSA-N 1 2 324.262 4.011 20 0 DIADLO Fc1ccc(Br)c(F)c1Nc1ccn2cc[nH+]c2c1 ZINC001205005677 1049337269 /nfs/dbraw/zinc/33/72/69/1049337269.db2.gz KJGQGSPSGFJLHK-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO CC(C)Cc1ncc(CNc2cccc(-n3cc[nH+]c3)c2)s1 ZINC000163027953 1049342333 /nfs/dbraw/zinc/34/23/33/1049342333.db2.gz MMTZLPCZLXUGHK-UHFFFAOYSA-N 1 2 312.442 4.139 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CC(C)(C)c3ccccc32)c(C)[nH+]1 ZINC001127005201 1049344320 /nfs/dbraw/zinc/34/43/20/1049344320.db2.gz SGNPTKDZYSZSPU-QGZVFWFLSA-N 1 2 308.425 4.159 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(C(C)(C)CC)cc2)C[C@H](C)[S@@]1=O ZINC001194239656 1049348587 /nfs/dbraw/zinc/34/85/87/1049348587.db2.gz FFHXIAZBNLLDDG-REDKUUPNSA-N 1 2 321.530 4.106 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(C(C)(C)CC)cc2)C[C@H](C)[S@@]1=O ZINC001194239656 1049348601 /nfs/dbraw/zinc/34/86/01/1049348601.db2.gz FFHXIAZBNLLDDG-REDKUUPNSA-N 1 2 321.530 4.106 20 0 DIADLO Cc1cccc(C[NH+](Cc2ccccn2)Cc2ccccn2)c1C ZINC001205060869 1049360494 /nfs/dbraw/zinc/36/04/94/1049360494.db2.gz VKVQUYDZBNYGJI-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO Cc1ccc(-c2csc(C[NH2+][C@@H](C)c3ccns3)n2)cc1 ZINC000860062244 1049366163 /nfs/dbraw/zinc/36/61/63/1049366163.db2.gz SDSDOTQYMQPSQO-LBPRGKRZSA-N 1 2 315.467 4.426 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@H+](C)Cc1ccc2ccccc2c1 ZINC001205089583 1049371128 /nfs/dbraw/zinc/37/11/28/1049371128.db2.gz SQXTZVNWQDCXQQ-UHFFFAOYSA-N 1 2 313.832 4.411 20 0 DIADLO COc1ccc2c(c1)C[N@H+]([C@H](C)c1ccccc1Cl)CCO2 ZINC001194417894 1049371296 /nfs/dbraw/zinc/37/12/96/1049371296.db2.gz JPDCVCCPLOPDHT-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc2c(c1)C[N@@H+]([C@H](C)c1ccccc1Cl)CCO2 ZINC001194417894 1049371313 /nfs/dbraw/zinc/37/13/13/1049371313.db2.gz JPDCVCCPLOPDHT-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@@H+](C)Cc1ccc2ccccc2c1 ZINC001205089583 1049371144 /nfs/dbraw/zinc/37/11/44/1049371144.db2.gz SQXTZVNWQDCXQQ-UHFFFAOYSA-N 1 2 313.832 4.411 20 0 DIADLO c1coc(C[NH+](Cc2ccco2)Cc2cccc3c2NCCC3)c1 ZINC001205088139 1049371875 /nfs/dbraw/zinc/37/18/75/1049371875.db2.gz IVPYCKSVSKEETH-UHFFFAOYSA-N 1 2 322.408 4.433 20 0 DIADLO C[N@H+](Cc1c(Cl)ccnc1F)[C@@H]1CCCc2ccccc21 ZINC001205094130 1049374026 /nfs/dbraw/zinc/37/40/26/1049374026.db2.gz QSWAPJINFCRUCZ-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO C[N@@H+](Cc1c(Cl)ccnc1F)[C@@H]1CCCc2ccccc21 ZINC001205094130 1049374040 /nfs/dbraw/zinc/37/40/40/1049374040.db2.gz QSWAPJINFCRUCZ-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO COc1cc(Cl)cc(-c2ccc(-n3cc[nH+]c3)cc2OC)c1 ZINC001205145109 1049393834 /nfs/dbraw/zinc/39/38/34/1049393834.db2.gz RPWUXOQRKORDHV-UHFFFAOYSA-N 1 2 314.772 4.210 20 0 DIADLO C[N@@H+](Cc1c(F)cccc1F)C[C@H]1CC[C@H](c2ccccc2)O1 ZINC001194570808 1049393843 /nfs/dbraw/zinc/39/38/43/1049393843.db2.gz PTHGFFOKOXCRLX-DNVCBOLYSA-N 1 2 317.379 4.317 20 0 DIADLO C[N@H+](Cc1c(F)cccc1F)C[C@H]1CC[C@H](c2ccccc2)O1 ZINC001194570808 1049393862 /nfs/dbraw/zinc/39/38/62/1049393862.db2.gz PTHGFFOKOXCRLX-DNVCBOLYSA-N 1 2 317.379 4.317 20 0 DIADLO Cc1cc(C[NH+](Cc2ccccn2)Cc2ccccn2)ccc1F ZINC001205155098 1049395800 /nfs/dbraw/zinc/39/58/00/1049395800.db2.gz RQIQDMWKAWVVTN-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO CCCC[C@H]([NH2+][C@@H](C)Cc1ccccc1SCC)C(=O)OC ZINC001180663921 1049395778 /nfs/dbraw/zinc/39/57/78/1049395778.db2.gz BBWMGNOVKTUTMA-HOCLYGCPSA-N 1 2 323.502 4.051 20 0 DIADLO Cc1ccc(NC(=O)COc2cc(C)[nH+]c3ccccc32)c(F)c1 ZINC000486201399 1049401174 /nfs/dbraw/zinc/40/11/74/1049401174.db2.gz CUNSSXFJKHMXAP-UHFFFAOYSA-N 1 2 324.355 4.008 20 0 DIADLO Fc1cc(F)c(-c2ccc(Cn3cc[nH+]c3)cc2)c(F)c1F ZINC001205179791 1049403559 /nfs/dbraw/zinc/40/35/59/1049403559.db2.gz IZALRGZKZMHBFJ-UHFFFAOYSA-N 1 2 306.262 4.155 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CC(C)(C)O[C@](C)(C(F)(F)F)C1 ZINC001194648041 1049403867 /nfs/dbraw/zinc/40/38/67/1049403867.db2.gz DOJKROJCEHSDDQ-ABAIWWIYSA-N 1 2 319.342 4.319 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+]1CC(C)(C)O[C@](C)(C(F)(F)F)C1 ZINC001194648041 1049403872 /nfs/dbraw/zinc/40/38/72/1049403872.db2.gz DOJKROJCEHSDDQ-ABAIWWIYSA-N 1 2 319.342 4.319 20 0 DIADLO Cc1cc(OCc2ccn(C3CCCC3)n2)c2ccccc2[nH+]1 ZINC000486218199 1049403952 /nfs/dbraw/zinc/40/39/52/1049403952.db2.gz QKRAOSPANLLQMA-UHFFFAOYSA-N 1 2 307.397 4.434 20 0 DIADLO Cc1cc(OCc2noc(-c3cccs3)n2)c2ccccc2[nH+]1 ZINC000486215219 1049404515 /nfs/dbraw/zinc/40/45/15/1049404515.db2.gz AVNDNDBNIBSTBR-UHFFFAOYSA-N 1 2 323.377 4.234 20 0 DIADLO CC(C)c1ccc(C[N@H+](Cc2cn(C)nc2Cl)C2CC2)cc1 ZINC001205225205 1049413593 /nfs/dbraw/zinc/41/35/93/1049413593.db2.gz SPQAVXGSGKDFDC-UHFFFAOYSA-N 1 2 317.864 4.362 20 0 DIADLO CC(C)c1ccc(C[N@@H+](Cc2cn(C)nc2Cl)C2CC2)cc1 ZINC001205225205 1049413598 /nfs/dbraw/zinc/41/35/98/1049413598.db2.gz SPQAVXGSGKDFDC-UHFFFAOYSA-N 1 2 317.864 4.362 20 0 DIADLO C[N@H+](CCc1cccc(Br)c1)C/C(Cl)=C/Cl ZINC001194693002 1049414394 /nfs/dbraw/zinc/41/43/94/1049414394.db2.gz XBJZRSTVBROAQL-WQLSENKSSA-N 1 2 323.061 4.242 20 0 DIADLO C[N@@H+](CCc1cccc(Br)c1)C/C(Cl)=C/Cl ZINC001194693002 1049414402 /nfs/dbraw/zinc/41/44/02/1049414402.db2.gz XBJZRSTVBROAQL-WQLSENKSSA-N 1 2 323.061 4.242 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@](C)(c3ccc(F)cc3)C2)cc1F ZINC001205243390 1049416559 /nfs/dbraw/zinc/41/65/59/1049416559.db2.gz FJRWGCYGMQVACR-IBGZPJMESA-N 1 2 317.379 4.021 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@](C)(c3ccc(F)cc3)C2)cc1F ZINC001205243390 1049416560 /nfs/dbraw/zinc/41/65/60/1049416560.db2.gz FJRWGCYGMQVACR-IBGZPJMESA-N 1 2 317.379 4.021 20 0 DIADLO Nc1c(F)cccc1C[N@@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC001204286570 1049422851 /nfs/dbraw/zinc/42/28/51/1049422851.db2.gz BMVNNZXFBYDJJB-QGZVFWFLSA-N 1 2 320.358 4.413 20 0 DIADLO Nc1c(F)cccc1C[N@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC001204286570 1049422862 /nfs/dbraw/zinc/42/28/62/1049422862.db2.gz BMVNNZXFBYDJJB-QGZVFWFLSA-N 1 2 320.358 4.413 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(F)c2n[nH]cc21 ZINC001205342217 1049444500 /nfs/dbraw/zinc/44/45/00/1049444500.db2.gz NHCPHJKTUIDLEG-UHFFFAOYSA-N 1 2 310.376 4.063 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cccc(-c3c[nH+]cn3C)c2)cc1C ZINC001194907034 1049445608 /nfs/dbraw/zinc/44/56/08/1049445608.db2.gz KEVGRYDWTUXZAZ-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO CC(C)CCC[C@@H](C)NC(=O)c1cccc(-c2c[nH+]cn2C)c1 ZINC001194916649 1049447946 /nfs/dbraw/zinc/44/79/46/1049447946.db2.gz DLSIKXWSHMRQFW-OAHLLOKOSA-N 1 2 313.445 4.032 20 0 DIADLO CC1=C(Br)C[N@H+](Cc2cc3ccccc3n2C)CC1 ZINC001181253802 1049456835 /nfs/dbraw/zinc/45/68/35/1049456835.db2.gz DPWXLLOCMVYUAO-UHFFFAOYSA-N 1 2 319.246 4.053 20 0 DIADLO CC1=C(Br)C[N@@H+](Cc2cc3ccccc3n2C)CC1 ZINC001181253802 1049456840 /nfs/dbraw/zinc/45/68/40/1049456840.db2.gz DPWXLLOCMVYUAO-UHFFFAOYSA-N 1 2 319.246 4.053 20 0 DIADLO CC1(C)C[NH+](Cc2cscc2C(F)(F)F)CC(C)(C)O1 ZINC001205423340 1049467202 /nfs/dbraw/zinc/46/72/02/1049467202.db2.gz MWLFJOQMWPMZDB-UHFFFAOYSA-N 1 2 307.381 4.156 20 0 DIADLO CC[N@H+](Cc1nc(C)c(C)[nH]1)Cc1ccc(C(F)(F)F)cc1 ZINC000862223392 1049478517 /nfs/dbraw/zinc/47/85/17/1049478517.db2.gz PCOCUHDLZXGNPA-UHFFFAOYSA-N 1 2 311.351 4.067 20 0 DIADLO CC[N@@H+](Cc1nc(C)c(C)[nH]1)Cc1ccc(C(F)(F)F)cc1 ZINC000862223392 1049478526 /nfs/dbraw/zinc/47/85/26/1049478526.db2.gz PCOCUHDLZXGNPA-UHFFFAOYSA-N 1 2 311.351 4.067 20 0 DIADLO CCN(Cc1[nH]c(C)c(C)[nH+]1)Cc1ccc(C(F)(F)F)cc1 ZINC000862223392 1049478529 /nfs/dbraw/zinc/47/85/29/1049478529.db2.gz PCOCUHDLZXGNPA-UHFFFAOYSA-N 1 2 311.351 4.067 20 0 DIADLO C/C=C/C[C@@H]([NH2+]C1CC(c2ccc(Cl)cc2)C1)C(=O)OCC ZINC001181453680 1049479447 /nfs/dbraw/zinc/47/94/47/1049479447.db2.gz BOMUCOPBIJKGDG-ALOWHPFOSA-N 1 2 321.848 4.074 20 0 DIADLO C[C@H]([NH2+]c1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1)C1CC(F)(F)C1 ZINC000862260639 1049483082 /nfs/dbraw/zinc/48/30/82/1049483082.db2.gz ANOVZXBATSSCEQ-MCIONIFRSA-N 1 2 324.415 4.146 20 0 DIADLO CC[C@@H](C)c1nnc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3)o2)[nH]1 ZINC000486876300 1049487099 /nfs/dbraw/zinc/48/70/99/1049487099.db2.gz CANGGLYZBMZFGV-KGLIPLIRSA-N 1 2 324.428 4.429 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1ccc3c(c1)CCCC3)CCO2 ZINC001205517675 1049490838 /nfs/dbraw/zinc/49/08/38/1049490838.db2.gz UMLFDYGLJMJATC-UHFFFAOYSA-N 1 2 311.400 4.099 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1ccc3c(c1)CCCC3)CCO2 ZINC001205517675 1049490847 /nfs/dbraw/zinc/49/08/47/1049490847.db2.gz UMLFDYGLJMJATC-UHFFFAOYSA-N 1 2 311.400 4.099 20 0 DIADLO Cc1ccc(Nc2cc(Cl)ncc2Br)c(C)[nH+]1 ZINC001203367398 1049493281 /nfs/dbraw/zinc/49/32/81/1049493281.db2.gz KTVYEFQBGFYYJR-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2ccnn2-c2ccccc2C)c1 ZINC001205555482 1049497869 /nfs/dbraw/zinc/49/78/69/1049497869.db2.gz SZGSALVLSRYERG-UHFFFAOYSA-N 1 2 323.415 4.260 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2ccnn2-c2ccccc2C)c1 ZINC001205555482 1049497872 /nfs/dbraw/zinc/49/78/72/1049497872.db2.gz SZGSALVLSRYERG-UHFFFAOYSA-N 1 2 323.415 4.260 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ncco2)cc1OC ZINC000924820618 1049506348 /nfs/dbraw/zinc/50/63/48/1049506348.db2.gz QQOVHPXAPPZUNV-KBPBESRZSA-N 1 2 318.417 4.274 20 0 DIADLO CC[C@@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)C[C@H](CC)O1 ZINC001195299293 1049513562 /nfs/dbraw/zinc/51/35/62/1049513562.db2.gz MXPWFXOXKQUGMH-OKILXGFUSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@@H]1C[N@H+](CCc2cccc(Cl)c2Cl)C[C@H](CC)O1 ZINC001195299293 1049513577 /nfs/dbraw/zinc/51/35/77/1049513577.db2.gz MXPWFXOXKQUGMH-OKILXGFUSA-N 1 2 316.272 4.425 20 0 DIADLO CC(C)(C)c1nn(C[N@@H+]2CCC[C@H]2c2ccccc2)c(=S)[nH]1 ZINC000014309233 1049516195 /nfs/dbraw/zinc/51/61/95/1049516195.db2.gz WHKVBNWRAJNATP-AWEZNQCLSA-N 1 2 316.474 4.033 20 0 DIADLO CC(C)(C)c1nn(C[N@H+]2CCC[C@H]2c2ccccc2)c(=S)[nH]1 ZINC000014309233 1049516203 /nfs/dbraw/zinc/51/62/03/1049516203.db2.gz WHKVBNWRAJNATP-AWEZNQCLSA-N 1 2 316.474 4.033 20 0 DIADLO Cc1ccc(F)cc1C[N@@H+]1[C@H](C)CCC[C@@H]1C(=O)OC(C)(C)C ZINC001195412967 1049522611 /nfs/dbraw/zinc/52/26/11/1049522611.db2.gz JDUUHQHJNMHLIV-RHSMWYFYSA-N 1 2 321.436 4.219 20 0 DIADLO Cc1ccc(F)cc1C[N@H+]1[C@H](C)CCC[C@@H]1C(=O)OC(C)(C)C ZINC001195412967 1049522618 /nfs/dbraw/zinc/52/26/18/1049522618.db2.gz JDUUHQHJNMHLIV-RHSMWYFYSA-N 1 2 321.436 4.219 20 0 DIADLO CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1ccc(O)c(F)c1F ZINC001205692910 1049535202 /nfs/dbraw/zinc/53/52/02/1049535202.db2.gz NZFHGJOHWJSZEI-OAHLLOKOSA-N 1 2 321.367 4.262 20 0 DIADLO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1ccc(O)c(F)c1F ZINC001205692910 1049535213 /nfs/dbraw/zinc/53/52/13/1049535213.db2.gz NZFHGJOHWJSZEI-OAHLLOKOSA-N 1 2 321.367 4.262 20 0 DIADLO C[C@H]([NH2+][C@H](Cc1ccccc1)c1ncco1)c1cccc(F)c1 ZINC001195558032 1049540195 /nfs/dbraw/zinc/54/01/95/1049540195.db2.gz MKWWGBUVUBXDKV-KBXCAEBGSA-N 1 2 310.372 4.448 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(F)c(F)c1Cl ZINC001205726310 1049544064 /nfs/dbraw/zinc/54/40/64/1049544064.db2.gz AOFAIKBWZNZTON-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO CC[C@@H](C)[C@@H](C[NH2+]CC(F)(F)c1ccc(Cl)cc1)OC ZINC001205735355 1049546810 /nfs/dbraw/zinc/54/68/10/1049546810.db2.gz JNTRBEDIOBSVAA-BXUZGUMPSA-N 1 2 305.796 4.083 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(F)c2Cl)CC2(CCCCC2)O1 ZINC001195649379 1049554471 /nfs/dbraw/zinc/55/44/71/1049554471.db2.gz ILTSMXNJASTNBG-ZDUSSCGKSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(F)c2Cl)CC2(CCCCC2)O1 ZINC001195649379 1049554485 /nfs/dbraw/zinc/55/44/85/1049554485.db2.gz ILTSMXNJASTNBG-ZDUSSCGKSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@@H]1CC1(C)C ZINC000487547668 1049558219 /nfs/dbraw/zinc/55/82/19/1049558219.db2.gz ALNNULQGHGVKHU-PBHICJAKSA-N 1 2 307.441 4.448 20 0 DIADLO Oc1ccc2cc(-c3ccccc3Cn3cc[nH+]c3)ccc2c1 ZINC001205772052 1049560526 /nfs/dbraw/zinc/56/05/26/1049560526.db2.gz KKSDNVMSSLXIKA-UHFFFAOYSA-N 1 2 300.361 4.457 20 0 DIADLO CCOc1c(F)c(F)ccc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001205804452 1049567245 /nfs/dbraw/zinc/56/72/45/1049567245.db2.gz IJQMIMXYHWCLGD-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO CCOc1c(F)c(F)ccc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001205824226 1049574522 /nfs/dbraw/zinc/57/45/22/1049574522.db2.gz ZDAOGFAAZGNEPM-UHFFFAOYSA-N 1 2 318.298 4.355 20 0 DIADLO CC1(C)CC(C[N@@H+]2CCO[C@@H](c3c(F)cccc3Cl)C2)C1 ZINC001195841896 1049578256 /nfs/dbraw/zinc/57/82/56/1049578256.db2.gz AIFANNPSKZNBMC-OAHLLOKOSA-N 1 2 311.828 4.289 20 0 DIADLO CC1(C)CC(C[N@H+]2CCO[C@@H](c3c(F)cccc3Cl)C2)C1 ZINC001195841896 1049578263 /nfs/dbraw/zinc/57/82/63/1049578263.db2.gz AIFANNPSKZNBMC-OAHLLOKOSA-N 1 2 311.828 4.289 20 0 DIADLO Cc1cc(-c2ccc(F)c(F)c2OC(C)C)c2[nH+]ccn2c1 ZINC001205854231 1049581968 /nfs/dbraw/zinc/58/19/68/1049581968.db2.gz CYVMVKGRVWVFCE-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO COC(=O)[C@@H](c1ccsc1)[NH+]1CCC2(CCCCC2)CC1 ZINC001195938641 1049585927 /nfs/dbraw/zinc/58/59/27/1049585927.db2.gz QKICRUSRANFMHV-OAHLLOKOSA-N 1 2 307.459 4.009 20 0 DIADLO Cc1cnccc1C[N@@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001205862427 1049586111 /nfs/dbraw/zinc/58/61/11/1049586111.db2.gz AYYVSZQJVBZYDQ-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cnccc1C[N@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001205862427 1049586125 /nfs/dbraw/zinc/58/61/25/1049586125.db2.gz AYYVSZQJVBZYDQ-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@@H+](Cc1cccnc1Cl)CC2 ZINC001195910375 1049587371 /nfs/dbraw/zinc/58/73/71/1049587371.db2.gz HFONAOXHWXMBQA-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@H+](Cc1cccnc1Cl)CC2 ZINC001195910375 1049587390 /nfs/dbraw/zinc/58/73/90/1049587390.db2.gz HFONAOXHWXMBQA-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+]2CCc3ccc(C(C)C)cc3C2)cc1 ZINC001195911158 1049588745 /nfs/dbraw/zinc/58/87/45/1049588745.db2.gz NNEUQGQXQVQBCU-UHFFFAOYSA-N 1 2 322.452 4.115 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+]2CCc3ccc(C(C)C)cc3C2)cc1 ZINC001195911158 1049588757 /nfs/dbraw/zinc/58/87/57/1049588757.db2.gz NNEUQGQXQVQBCU-UHFFFAOYSA-N 1 2 322.452 4.115 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@H](C)c2ccc(F)c3ccccc32)n1 ZINC000488007124 1049590734 /nfs/dbraw/zinc/59/07/34/1049590734.db2.gz ODQWJZXDKJKJGC-VXGBXAGGSA-N 1 2 313.376 4.336 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000488011625 1049591250 /nfs/dbraw/zinc/59/12/50/1049591250.db2.gz RRJGCYAOXKDTKX-UHFFFAOYSA-N 1 2 301.409 4.078 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000488011625 1049591263 /nfs/dbraw/zinc/59/12/63/1049591263.db2.gz RRJGCYAOXKDTKX-UHFFFAOYSA-N 1 2 301.409 4.078 20 0 DIADLO CC[NH+](CC)[C@@H](C(=O)N(C(C)C)C(C)C)c1ccccc1Cl ZINC001182217661 1049592466 /nfs/dbraw/zinc/59/24/66/1049592466.db2.gz BZCFPUITFGKUHL-QGZVFWFLSA-N 1 2 324.896 4.368 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1coc(-c2cccs2)n1 ZINC000488033131 1049593501 /nfs/dbraw/zinc/59/35/01/1049593501.db2.gz HWOWTQYKILQKHQ-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1coc(-c2cccs2)n1 ZINC000488033131 1049593510 /nfs/dbraw/zinc/59/35/10/1049593510.db2.gz HWOWTQYKILQKHQ-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC(C)(C)C2CCCC2)c(C)[nH+]1 ZINC001205899452 1049595512 /nfs/dbraw/zinc/59/55/12/1049595512.db2.gz JXIVEWUISHUILH-UHFFFAOYSA-N 1 2 303.450 4.345 20 0 DIADLO C[N@H+](Cc1cc2c(ccnc2Cl)o1)Cc1c(F)cccc1F ZINC001205932888 1049607178 /nfs/dbraw/zinc/60/71/78/1049607178.db2.gz MFRDZUCJAOIXQQ-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO C[N@@H+](Cc1cc2c(ccnc2Cl)o1)Cc1c(F)cccc1F ZINC001205932888 1049607183 /nfs/dbraw/zinc/60/71/83/1049607183.db2.gz MFRDZUCJAOIXQQ-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccc(C(C)(C)O)cc1 ZINC000864001533 1049611415 /nfs/dbraw/zinc/61/14/15/1049611415.db2.gz MEFIXKXAWWNOGE-OAHLLOKOSA-N 1 2 324.468 4.470 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccc(C(C)(C)O)cc1 ZINC000864001533 1049611422 /nfs/dbraw/zinc/61/14/22/1049611422.db2.gz MEFIXKXAWWNOGE-OAHLLOKOSA-N 1 2 324.468 4.470 20 0 DIADLO CCCCC[N@H+](Cc1ncnn1CC)Cc1ccc(Cl)cc1 ZINC000488243087 1049616671 /nfs/dbraw/zinc/61/66/71/1049616671.db2.gz KLYFXDUWPHZQMA-UHFFFAOYSA-N 1 2 320.868 4.144 20 0 DIADLO CCCCC[N@@H+](Cc1ncnn1CC)Cc1ccc(Cl)cc1 ZINC000488243087 1049616683 /nfs/dbraw/zinc/61/66/83/1049616683.db2.gz KLYFXDUWPHZQMA-UHFFFAOYSA-N 1 2 320.868 4.144 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(F)ccc1SC ZINC001205989850 1049622113 /nfs/dbraw/zinc/62/21/13/1049622113.db2.gz FMMAODMOQPXJBZ-UHFFFAOYSA-N 1 2 314.385 4.409 20 0 DIADLO COc1ccc2c(c1)CC[N@H+]([C@H](C)c1c(F)cccc1F)C2 ZINC001196165619 1049626377 /nfs/dbraw/zinc/62/63/77/1049626377.db2.gz DRNGTIVVMLHBLK-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc2c(c1)CC[N@@H+]([C@H](C)c1c(F)cccc1F)C2 ZINC001196165619 1049626383 /nfs/dbraw/zinc/62/63/83/1049626383.db2.gz DRNGTIVVMLHBLK-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1nc2cc(NCc3ccc(-n4cc[nH+]c4)cc3)ccc2s1 ZINC000864023667 1049627780 /nfs/dbraw/zinc/62/77/80/1049627780.db2.gz XTTGUCKTLPLGTP-UHFFFAOYSA-N 1 2 320.421 4.403 20 0 DIADLO Fc1ccc(Cl)cc1C[N@@H+]1CC[C@@H]1COCc1ccccc1 ZINC001206020010 1049630941 /nfs/dbraw/zinc/63/09/41/1049630941.db2.gz DHOSMTIPNOKTSB-QGZVFWFLSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1ccc(Cl)cc1C[N@H+]1CC[C@@H]1COCc1ccccc1 ZINC001206020010 1049630945 /nfs/dbraw/zinc/63/09/45/1049630945.db2.gz DHOSMTIPNOKTSB-QGZVFWFLSA-N 1 2 319.807 4.270 20 0 DIADLO C[C@H](Cc1ccccc1)[N@H+](Cc1cnsn1)Cc1ccccc1 ZINC001196311976 1049637383 /nfs/dbraw/zinc/63/73/83/1049637383.db2.gz JNPMFYUMTAKZDW-MRXNPFEDSA-N 1 2 323.465 4.172 20 0 DIADLO C[C@H](Cc1ccccc1)[N@@H+](Cc1cnsn1)Cc1ccccc1 ZINC001196311976 1049637389 /nfs/dbraw/zinc/63/73/89/1049637389.db2.gz JNPMFYUMTAKZDW-MRXNPFEDSA-N 1 2 323.465 4.172 20 0 DIADLO Cc1ccc(C[N@H+](Cc2noc(C3CCC3)n2)C(C)(C)C)cc1 ZINC001196337890 1049644033 /nfs/dbraw/zinc/64/40/33/1049644033.db2.gz HZKQBJAUHCNLSB-UHFFFAOYSA-N 1 2 313.445 4.446 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2noc(C3CCC3)n2)C(C)(C)C)cc1 ZINC001196337890 1049644041 /nfs/dbraw/zinc/64/40/41/1049644041.db2.gz HZKQBJAUHCNLSB-UHFFFAOYSA-N 1 2 313.445 4.446 20 0 DIADLO Fc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)cc(N2CCCC2)c1 ZINC001206120977 1049658893 /nfs/dbraw/zinc/65/88/93/1049658893.db2.gz CGZSNQGTEJKGIJ-UHFFFAOYSA-N 1 2 321.399 4.338 20 0 DIADLO CC(C)c1cc(N2CC[C@]3(C)[C@H](C2)C3(F)F)nc(C(C)C)[nH+]1 ZINC000488467474 1049660060 /nfs/dbraw/zinc/66/00/60/1049660060.db2.gz NHBLHVHXSRVWGT-XJKSGUPXSA-N 1 2 309.404 4.205 20 0 DIADLO COc1nc(C)cc(C)c1C[N@H+](C)Cc1ccc(C)cc1Cl ZINC001196450636 1049661020 /nfs/dbraw/zinc/66/10/20/1049661020.db2.gz GNAHUDLYRYMRJR-UHFFFAOYSA-N 1 2 318.848 4.301 20 0 DIADLO COc1nc(C)cc(C)c1C[N@@H+](C)Cc1ccc(C)cc1Cl ZINC001196450636 1049661025 /nfs/dbraw/zinc/66/10/25/1049661025.db2.gz GNAHUDLYRYMRJR-UHFFFAOYSA-N 1 2 318.848 4.301 20 0 DIADLO C[C@@H]1CCc2nc(C[N@@H+]3CCc4sccc4[C@H]3C)sc2C1 ZINC001206128769 1049662389 /nfs/dbraw/zinc/66/23/89/1049662389.db2.gz ZYZBGGYEMUUPLD-VXGBXAGGSA-N 1 2 318.511 4.449 20 0 DIADLO C[C@@H]1CCc2nc(C[N@H+]3CCc4sccc4[C@H]3C)sc2C1 ZINC001206128769 1049662391 /nfs/dbraw/zinc/66/23/91/1049662391.db2.gz ZYZBGGYEMUUPLD-VXGBXAGGSA-N 1 2 318.511 4.449 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3sccc3[C@@H]2C)c(F)c1OC ZINC001206127997 1049662521 /nfs/dbraw/zinc/66/25/21/1049662521.db2.gz OMUQRVDBCLFGAT-NSHDSACASA-N 1 2 321.417 4.024 20 0 DIADLO COc1ccc(C[N@H+]2CCc3sccc3[C@@H]2C)c(F)c1OC ZINC001206127997 1049662525 /nfs/dbraw/zinc/66/25/25/1049662525.db2.gz OMUQRVDBCLFGAT-NSHDSACASA-N 1 2 321.417 4.024 20 0 DIADLO Fc1ccc2c(c1)OCC[N@H+]([C@@H]1CCc3cc(Cl)ccc31)C2 ZINC001196606362 1049674790 /nfs/dbraw/zinc/67/47/90/1049674790.db2.gz VIGMVZZRXRHOKY-QGZVFWFLSA-N 1 2 317.791 4.361 20 0 DIADLO Fc1ccc2c(c1)OCC[N@@H+]([C@@H]1CCc3cc(Cl)ccc31)C2 ZINC001196606362 1049674799 /nfs/dbraw/zinc/67/47/99/1049674799.db2.gz VIGMVZZRXRHOKY-QGZVFWFLSA-N 1 2 317.791 4.361 20 0 DIADLO CC1(CC(F)(F)F)C[NH+](Cc2ccccc2C(F)(F)F)C1 ZINC001206194215 1049680381 /nfs/dbraw/zinc/68/03/81/1049680381.db2.gz ARBCHENSIBGADL-UHFFFAOYSA-N 1 2 311.269 4.480 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@H](C)[C@@H]2C(=O)OC(C)(C)C)c(F)c1 ZINC001182488581 1049680473 /nfs/dbraw/zinc/68/04/73/1049680473.db2.gz BTHVQJVEYFJYGF-WMLDXEAASA-N 1 2 321.436 4.076 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@H](C)[C@@H]2C(=O)OC(C)(C)C)c(F)c1 ZINC001182488581 1049680481 /nfs/dbraw/zinc/68/04/81/1049680481.db2.gz BTHVQJVEYFJYGF-WMLDXEAASA-N 1 2 321.436 4.076 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@H](C)[C@H]2C(=O)OC(C)(C)C)c(F)c1 ZINC001182488582 1049682421 /nfs/dbraw/zinc/68/24/21/1049682421.db2.gz BTHVQJVEYFJYGF-YOEHRIQHSA-N 1 2 321.436 4.076 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@H](C)[C@H]2C(=O)OC(C)(C)C)c(F)c1 ZINC001182488582 1049682431 /nfs/dbraw/zinc/68/24/31/1049682431.db2.gz BTHVQJVEYFJYGF-YOEHRIQHSA-N 1 2 321.436 4.076 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)sn1 ZINC001196708431 1049682367 /nfs/dbraw/zinc/68/23/67/1049682367.db2.gz RUYQQRTYSHNIJT-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1cc(C[N@H+]2CCc3cccc(C(F)(F)F)c3C2)sn1 ZINC001196708431 1049682372 /nfs/dbraw/zinc/68/23/72/1049682372.db2.gz RUYQQRTYSHNIJT-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO COC(=O)[C@@H](c1ccsc1)[N@H+](C)C[C@H](C)C1CCCCC1 ZINC001196818613 1049693372 /nfs/dbraw/zinc/69/33/72/1049693372.db2.gz LVGNLNKBBUDEFU-XJKSGUPXSA-N 1 2 309.475 4.110 20 0 DIADLO COC(=O)[C@@H](c1ccsc1)[N@@H+](C)C[C@H](C)C1CCCCC1 ZINC001196818613 1049693377 /nfs/dbraw/zinc/69/33/77/1049693377.db2.gz LVGNLNKBBUDEFU-XJKSGUPXSA-N 1 2 309.475 4.110 20 0 DIADLO CCc1noc([C@H](C)[N@H+](CC)Cc2ccc3ccccc3c2)n1 ZINC000488762277 1049694368 /nfs/dbraw/zinc/69/43/68/1049694368.db2.gz PUVDQLGGQVQOTE-AWEZNQCLSA-N 1 2 309.413 4.368 20 0 DIADLO CCc1noc([C@H](C)[N@@H+](CC)Cc2ccc3ccccc3c2)n1 ZINC000488762277 1049694369 /nfs/dbraw/zinc/69/43/69/1049694369.db2.gz PUVDQLGGQVQOTE-AWEZNQCLSA-N 1 2 309.413 4.368 20 0 DIADLO COCc1cc(C)c(-c2cc(F)c(C[NH+](C)C)c(F)c2)c(C)c1 ZINC001206344588 1049716991 /nfs/dbraw/zinc/71/69/91/1049716991.db2.gz IJJWUADBGNPIKB-UHFFFAOYSA-N 1 2 319.395 4.457 20 0 DIADLO Fc1cc(F)c(F)c(Nc2ccc[nH+]c2N2CCCCC2)c1 ZINC001206383042 1049723715 /nfs/dbraw/zinc/72/37/15/1049723715.db2.gz MOKVREKOCKRFIX-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1CCCC[N@@H+]1CCc1ccccc1Cl ZINC001197177105 1049727330 /nfs/dbraw/zinc/72/73/30/1049727330.db2.gz LEBHLLYYEIMWQH-INIZCTEOSA-N 1 2 323.864 4.079 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1CCCC[N@H+]1CCc1ccccc1Cl ZINC001197177105 1049727339 /nfs/dbraw/zinc/72/73/39/1049727339.db2.gz LEBHLLYYEIMWQH-INIZCTEOSA-N 1 2 323.864 4.079 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1nc2ccccc2o1)c1cc2cnccc2o1 ZINC001197229102 1049730537 /nfs/dbraw/zinc/73/05/37/1049730537.db2.gz BLJKZGCMWKEEDW-RYUDHWBXSA-N 1 2 307.353 4.381 20 0 DIADLO Cc1cc(CNc2cc(F)cc(N(C)C)c2)c2c([nH+]1)CCCC2 ZINC001206484453 1049742002 /nfs/dbraw/zinc/74/20/02/1049742002.db2.gz KNEQDJYFTOHULX-UHFFFAOYSA-N 1 2 313.420 4.086 20 0 DIADLO COc1nccc(C[N@@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)c1F ZINC001206537640 1049751903 /nfs/dbraw/zinc/75/19/03/1049751903.db2.gz LKUOBOBJJRAZBA-GOSISDBHSA-N 1 2 324.399 4.123 20 0 DIADLO COc1nccc(C[N@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)c1F ZINC001206537640 1049751912 /nfs/dbraw/zinc/75/19/12/1049751912.db2.gz LKUOBOBJJRAZBA-GOSISDBHSA-N 1 2 324.399 4.123 20 0 DIADLO CCc1nc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2(C)C)no1 ZINC001197480624 1049753917 /nfs/dbraw/zinc/75/39/17/1049753917.db2.gz DSFRVHUOHBNPCC-CQSZACIVSA-N 1 2 319.836 4.054 20 0 DIADLO CCc1nc(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2(C)C)no1 ZINC001197480624 1049753924 /nfs/dbraw/zinc/75/39/24/1049753924.db2.gz DSFRVHUOHBNPCC-CQSZACIVSA-N 1 2 319.836 4.054 20 0 DIADLO C[N@H+](Cc1csc(COc2ccc(F)cc2)n1)[C@H]1CC1(C)C ZINC000489457942 1049759419 /nfs/dbraw/zinc/75/94/19/1049759419.db2.gz ALNYNEJHIQEMAM-HNNXBMFYSA-N 1 2 320.433 4.092 20 0 DIADLO C[N@@H+](Cc1csc(COc2ccc(F)cc2)n1)[C@H]1CC1(C)C ZINC000489457942 1049759433 /nfs/dbraw/zinc/75/94/33/1049759433.db2.gz ALNYNEJHIQEMAM-HNNXBMFYSA-N 1 2 320.433 4.092 20 0 DIADLO COc1ncccc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)s1 ZINC001206585192 1049761710 /nfs/dbraw/zinc/76/17/10/1049761710.db2.gz RPRRLGVUCLBMOH-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ncccc1C[N@H+]1CCC[C@H]1c1ccc(Cl)s1 ZINC001206585192 1049761715 /nfs/dbraw/zinc/76/17/15/1049761715.db2.gz RPRRLGVUCLBMOH-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1cc(-c2ccc3cnn([C@@H]4CCCCO4)c3c2)cc(C)[nH+]1 ZINC001206643008 1049775020 /nfs/dbraw/zinc/77/50/20/1049775020.db2.gz NAOHIDQSKRENLF-IBGZPJMESA-N 1 2 307.397 4.414 20 0 DIADLO Cc1cc[nH+]c(C)c1-c1ccc2cnn([C@H]3CCCCO3)c2c1 ZINC001206665854 1049777464 /nfs/dbraw/zinc/77/74/64/1049777464.db2.gz JRYNOKFTWBRUOW-GOSISDBHSA-N 1 2 307.397 4.414 20 0 DIADLO Cc1ccc(F)cc1-c1noc([C@@H](CC(C)C)n2cc[nH+]c2)n1 ZINC000923817631 1049792867 /nfs/dbraw/zinc/79/28/67/1049792867.db2.gz JWIPZDJOVYLVAQ-OAHLLOKOSA-N 1 2 314.364 4.016 20 0 DIADLO COC[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nc(C)c(C)s1 ZINC000490059798 1049797448 /nfs/dbraw/zinc/79/74/48/1049797448.db2.gz LTMBRWRHCYIQQK-HNNXBMFYSA-N 1 2 324.877 4.233 20 0 DIADLO COC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nc(C)c(C)s1 ZINC000490059798 1049797454 /nfs/dbraw/zinc/79/74/54/1049797454.db2.gz LTMBRWRHCYIQQK-HNNXBMFYSA-N 1 2 324.877 4.233 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccc(F)cn1 ZINC000490145956 1049803267 /nfs/dbraw/zinc/80/32/67/1049803267.db2.gz XHTIBDVINGWNRH-INIZCTEOSA-N 1 2 311.360 4.117 20 0 DIADLO Cc1cc(C[N@@H+]2CCSC[C@H]2c2cccc3ccccc32)no1 ZINC001206822622 1049806122 /nfs/dbraw/zinc/80/61/22/1049806122.db2.gz ZPZWTFWMVGNNIO-IBGZPJMESA-N 1 2 324.449 4.426 20 0 DIADLO Cc1cc(C[N@H+]2CCSC[C@H]2c2cccc3ccccc32)no1 ZINC001206822622 1049806129 /nfs/dbraw/zinc/80/61/29/1049806129.db2.gz ZPZWTFWMVGNNIO-IBGZPJMESA-N 1 2 324.449 4.426 20 0 DIADLO Fc1cncc(F)c1C[N@@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC001206862607 1049814069 /nfs/dbraw/zinc/81/40/69/1049814069.db2.gz NPYNBZFEMCUQCR-GFCCVEGCSA-N 1 2 308.759 4.003 20 0 DIADLO Fc1cncc(F)c1C[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC001206862607 1049814078 /nfs/dbraw/zinc/81/40/78/1049814078.db2.gz NPYNBZFEMCUQCR-GFCCVEGCSA-N 1 2 308.759 4.003 20 0 DIADLO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)cncc2F)cc1 ZINC001206861110 1049814356 /nfs/dbraw/zinc/81/43/56/1049814356.db2.gz UHPIPXIWGZFLRX-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)cncc2F)cc1 ZINC001206861110 1049814364 /nfs/dbraw/zinc/81/43/64/1049814364.db2.gz UHPIPXIWGZFLRX-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO Fc1ccc(C2CC[NH+](Cc3c(F)cncc3F)CC2)c(F)c1 ZINC001206863580 1049817488 /nfs/dbraw/zinc/81/74/88/1049817488.db2.gz NENSRCOQYNEVHS-UHFFFAOYSA-N 1 2 324.321 4.018 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+](C)Cc2ccc(CC)cc2)n1 ZINC000490295800 1049820101 /nfs/dbraw/zinc/82/01/01/1049820101.db2.gz ANEUOOKBGRJCQV-CQSZACIVSA-N 1 2 301.434 4.168 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+](C)Cc2ccc(CC)cc2)n1 ZINC000490295800 1049820115 /nfs/dbraw/zinc/82/01/15/1049820115.db2.gz ANEUOOKBGRJCQV-CQSZACIVSA-N 1 2 301.434 4.168 20 0 DIADLO COc1cccc([C@@H]2CCCC[N@@H+]2Cc2ncc3ccccn32)c1 ZINC001207053398 1049827790 /nfs/dbraw/zinc/82/77/90/1049827790.db2.gz QQMSQFHPQLGPCF-IBGZPJMESA-N 1 2 321.424 4.070 20 0 DIADLO COc1cccc([C@@H]2CCCC[N@H+]2Cc2ncc3ccccn32)c1 ZINC001207053398 1049827805 /nfs/dbraw/zinc/82/78/05/1049827805.db2.gz QQMSQFHPQLGPCF-IBGZPJMESA-N 1 2 321.424 4.070 20 0 DIADLO CCC[NH+](CCC)Cn1nc(-c2ccccc2)n(CC)c1=S ZINC000913057998 1049834568 /nfs/dbraw/zinc/83/45/68/1049834568.db2.gz LKVYKFZGITWQED-UHFFFAOYSA-N 1 2 318.490 4.180 20 0 DIADLO CSc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ncc(F)cc1F ZINC001207098880 1049835766 /nfs/dbraw/zinc/83/57/66/1049835766.db2.gz LFWCNOFVSJPWHI-INIZCTEOSA-N 1 2 320.408 4.419 20 0 DIADLO CSc1ccccc1[C@@H]1CCC[N@H+]1Cc1ncc(F)cc1F ZINC001207098880 1049835779 /nfs/dbraw/zinc/83/57/79/1049835779.db2.gz LFWCNOFVSJPWHI-INIZCTEOSA-N 1 2 320.408 4.419 20 0 DIADLO Fc1cccc(OC(F)F)c1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC001207112931 1049838588 /nfs/dbraw/zinc/83/85/88/1049838588.db2.gz UZPYISUAPGDGOP-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(OC(F)F)c1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC001207112931 1049838604 /nfs/dbraw/zinc/83/86/04/1049838604.db2.gz UZPYISUAPGDGOP-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Cc1cncc(C[N@@H+]2CCSC[C@@H]2c2cccc(Cl)c2)c1 ZINC001207160785 1049847539 /nfs/dbraw/zinc/84/75/39/1049847539.db2.gz KCPNMPHQHROQNB-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cncc(C[N@H+]2CCSC[C@@H]2c2cccc(Cl)c2)c1 ZINC001207160785 1049847547 /nfs/dbraw/zinc/84/75/47/1049847547.db2.gz KCPNMPHQHROQNB-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO CC(C)(C[N@@H+]1Cc2cncnc2C1)Sc1ccc(Cl)cc1 ZINC001207295459 1049877157 /nfs/dbraw/zinc/87/71/57/1049877157.db2.gz RGTAKNVVMOXBBO-UHFFFAOYSA-N 1 2 319.861 4.017 20 0 DIADLO CC(C)(C[N@H+]1Cc2cncnc2C1)Sc1ccc(Cl)cc1 ZINC001207295459 1049877164 /nfs/dbraw/zinc/87/71/64/1049877164.db2.gz RGTAKNVVMOXBBO-UHFFFAOYSA-N 1 2 319.861 4.017 20 0 DIADLO c1nc2c(s1)C[N@@H+](CC(c1ccccc1)c1ccccc1)C2 ZINC001207526779 1049904693 /nfs/dbraw/zinc/90/46/93/1049904693.db2.gz DCSSYFDQYPMENK-UHFFFAOYSA-N 1 2 306.434 4.291 20 0 DIADLO c1nc2c(s1)C[N@H+](CC(c1ccccc1)c1ccccc1)C2 ZINC001207526779 1049904697 /nfs/dbraw/zinc/90/46/97/1049904697.db2.gz DCSSYFDQYPMENK-UHFFFAOYSA-N 1 2 306.434 4.291 20 0 DIADLO CCO[C@@H]1C[C@H](Nc2ccc3[nH+]c(C)cc(C)c3c2)[C@H]1SC ZINC001207554342 1049908743 /nfs/dbraw/zinc/90/87/43/1049908743.db2.gz UDWRWFBHVOYOSA-RCCFBDPRSA-N 1 2 316.470 4.173 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001207563932 1049910127 /nfs/dbraw/zinc/91/01/27/1049910127.db2.gz IOCDGAMHFDSMGW-CYBMUJFWSA-N 1 2 321.408 4.365 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001207563932 1049910131 /nfs/dbraw/zinc/91/01/31/1049910131.db2.gz IOCDGAMHFDSMGW-CYBMUJFWSA-N 1 2 321.408 4.365 20 0 DIADLO COC(=O)[C@@H]([NH2+]C1CCC(C)CC1)c1cccc2ccccc21 ZINC001207563694 1049910701 /nfs/dbraw/zinc/91/07/01/1049910701.db2.gz CUPVYUPAHXCHGR-KJXMEXGPSA-N 1 2 311.425 4.222 20 0 DIADLO CCC(CC)(CC)NC(=O)C[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000669173924 1049917922 /nfs/dbraw/zinc/91/79/22/1049917922.db2.gz RTPFDARRBIFJJX-MRXNPFEDSA-N 1 2 313.445 4.017 20 0 DIADLO Cc1cccnc1C[N@@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000571331654 1049929562 /nfs/dbraw/zinc/92/95/62/1049929562.db2.gz MBQQLIRUVLSFQS-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1cccnc1C[N@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000571331654 1049929566 /nfs/dbraw/zinc/92/95/66/1049929566.db2.gz MBQQLIRUVLSFQS-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO FC(F)(F)c1cccc(CCC[N@@H+]2CCCC(F)(F)C2)c1 ZINC001207841853 1049942777 /nfs/dbraw/zinc/94/27/77/1049942777.db2.gz JVNJDJSBBPJYHS-UHFFFAOYSA-N 1 2 307.306 4.369 20 0 DIADLO FC(F)(F)c1cccc(CCC[N@H+]2CCCC(F)(F)C2)c1 ZINC001207841853 1049942797 /nfs/dbraw/zinc/94/27/97/1049942797.db2.gz JVNJDJSBBPJYHS-UHFFFAOYSA-N 1 2 307.306 4.369 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1cccc2n[nH]cc21 ZINC001207873256 1049948940 /nfs/dbraw/zinc/94/89/40/1049948940.db2.gz OYAUKDBIOJIHMG-UHFFFAOYSA-N 1 2 305.385 4.106 20 0 DIADLO Cc1cc(C)c(NC(=O)NC[C@]2(C)C[C@H]2c2ccccc2)c(C)[nH+]1 ZINC000572217344 1049998489 /nfs/dbraw/zinc/99/84/89/1049998489.db2.gz ROUOIZMONVFVQC-PXNSSMCTSA-N 1 2 323.440 4.322 20 0 DIADLO C[C@H](C[N@@H+]1CC(F)(F)CC[C@H]1CO)c1cccc2ccccc21 ZINC001208707428 1050004937 /nfs/dbraw/zinc/00/49/37/1050004937.db2.gz SSWDRDNXERNTPB-ZBFHGGJFSA-N 1 2 319.395 4.035 20 0 DIADLO C[C@H](C[N@H+]1CC(F)(F)CC[C@H]1CO)c1cccc2ccccc21 ZINC001208707428 1050004941 /nfs/dbraw/zinc/00/49/41/1050004941.db2.gz SSWDRDNXERNTPB-ZBFHGGJFSA-N 1 2 319.395 4.035 20 0 DIADLO Clc1ccc(CC[N@@H+]2Cc3cnn(-c4ccccc4)c3C2)cc1 ZINC001208743267 1050008198 /nfs/dbraw/zinc/00/81/98/1050008198.db2.gz ZDROHHDJMFYQDI-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1ccc(CC[N@H+]2Cc3cnn(-c4ccccc4)c3C2)cc1 ZINC001208743267 1050008203 /nfs/dbraw/zinc/00/82/03/1050008203.db2.gz ZDROHHDJMFYQDI-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO C[C@@H]1CCc2nc(C[NH2+][C@@H]3CSc4ccccc43)sc2C1 ZINC000498353547 1050013135 /nfs/dbraw/zinc/01/31/35/1050013135.db2.gz MIEYCRQGRYKNNK-BXUZGUMPSA-N 1 2 316.495 4.205 20 0 DIADLO F[C@@H]1CCC[N@@H+](CCCCOCc2ccccc2)CC1(F)F ZINC001209256501 1050048009 /nfs/dbraw/zinc/04/80/09/1050048009.db2.gz IQDZMUVAMOQTNJ-MRXNPFEDSA-N 1 2 315.379 4.053 20 0 DIADLO F[C@@H]1CCC[N@H+](CCCCOCc2ccccc2)CC1(F)F ZINC001209256501 1050048004 /nfs/dbraw/zinc/04/80/04/1050048004.db2.gz IQDZMUVAMOQTNJ-MRXNPFEDSA-N 1 2 315.379 4.053 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](CCc1ccccc1C(F)(F)F)C2 ZINC001209283028 1050049456 /nfs/dbraw/zinc/04/94/56/1050049456.db2.gz MCSYXVWABVGVED-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](CCc1ccccc1C(F)(F)F)C2 ZINC001209283028 1050049460 /nfs/dbraw/zinc/04/94/60/1050049460.db2.gz MCSYXVWABVGVED-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Cc1ccccc1C[N@@H+]1CCO[C@@H](c2ccc(F)c(Cl)c2)C1 ZINC000589600172 1050050373 /nfs/dbraw/zinc/05/03/73/1050050373.db2.gz OTXZNFMYKWLYBP-GOSISDBHSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1ccccc1C[N@H+]1CCO[C@@H](c2ccc(F)c(Cl)c2)C1 ZINC000589600172 1050050376 /nfs/dbraw/zinc/05/03/76/1050050376.db2.gz OTXZNFMYKWLYBP-GOSISDBHSA-N 1 2 319.807 4.361 20 0 DIADLO C[C@H]([NH2+]Cc1n[nH]c2ccccc21)c1ccc(OC(F)F)cc1 ZINC000589638931 1050051639 /nfs/dbraw/zinc/05/16/39/1050051639.db2.gz HFCQMXKPRJCNET-NSHDSACASA-N 1 2 317.339 4.015 20 0 DIADLO C[NH+](C)c1ccc(NCc2cc(Br)cs2)cc1 ZINC000057611246 1050103051 /nfs/dbraw/zinc/10/30/51/1050103051.db2.gz GGVGQSDAPUEYEJ-UHFFFAOYSA-N 1 2 311.248 4.189 20 0 DIADLO Cc1ccc(O[C@@H]2CCC[N@H+](Cc3cnc(Cl)s3)C2)cc1 ZINC001209470040 1050061263 /nfs/dbraw/zinc/06/12/63/1050061263.db2.gz AQUYHACABUSJTI-CQSZACIVSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1ccc(O[C@@H]2CCC[N@@H+](Cc3cnc(Cl)s3)C2)cc1 ZINC001209470040 1050061268 /nfs/dbraw/zinc/06/12/68/1050061268.db2.gz AQUYHACABUSJTI-CQSZACIVSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1ccc(C[N@H+]2Cc3ccc(Br)cc3C[C@@H]2C)[nH]1 ZINC001209577015 1050069919 /nfs/dbraw/zinc/06/99/19/1050069919.db2.gz KYMZBECGSWVDCG-LBPRGKRZSA-N 1 2 319.246 4.032 20 0 DIADLO Cc1ccc(C[N@@H+]2Cc3ccc(Br)cc3C[C@@H]2C)[nH]1 ZINC001209577015 1050069925 /nfs/dbraw/zinc/06/99/25/1050069925.db2.gz KYMZBECGSWVDCG-LBPRGKRZSA-N 1 2 319.246 4.032 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1n[nH]c2ccc(Cl)cc21 ZINC001209760125 1050081950 /nfs/dbraw/zinc/08/19/50/1050081950.db2.gz UKMBZCCKEPOCKT-UHFFFAOYSA-N 1 2 305.834 4.300 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1n[nH]c2ccc(Cl)cc21 ZINC001209760125 1050081956 /nfs/dbraw/zinc/08/19/56/1050081956.db2.gz UKMBZCCKEPOCKT-UHFFFAOYSA-N 1 2 305.834 4.300 20 0 DIADLO Clc1ccc2c(Nc3ccc4c(c3)NCCO4)cc[nH+]c2c1 ZINC001209795901 1050085262 /nfs/dbraw/zinc/08/52/62/1050085262.db2.gz VDKYIDJVBRQPMW-UHFFFAOYSA-N 1 2 311.772 4.436 20 0 DIADLO COc1c(F)ccc(Nc2ccc[nH+]c2N2CCCC2)c1Cl ZINC001209801678 1050086646 /nfs/dbraw/zinc/08/66/46/1050086646.db2.gz UBWKURJJMBDPTC-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO CCCCC1CCC(C(=O)N2CCC[C@@H](n3cc[nH+]c3)C2)CC1 ZINC000590729396 1050105763 /nfs/dbraw/zinc/10/57/63/1050105763.db2.gz JGMUMOGJNOHGBU-DAWZGUTISA-N 1 2 317.477 4.043 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@@H](C)c2cccc(OCC)c2)n1 ZINC000068839567 1050111309 /nfs/dbraw/zinc/11/13/09/1050111309.db2.gz FPHWDMSWZWGGIY-UONOGXRCSA-N 1 2 317.433 4.223 20 0 DIADLO COc1ccc([C@H](Cc2ccccc2)Nc2cc[nH+]c(C)n2)cc1 ZINC000573029942 1050116348 /nfs/dbraw/zinc/11/63/48/1050116348.db2.gz QMXILKRAFFFQPV-IBGZPJMESA-N 1 2 319.408 4.190 20 0 DIADLO CC(C)Oc1ccccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001210022362 1050124117 /nfs/dbraw/zinc/12/41/17/1050124117.db2.gz FPGURSBLMYBZCR-UHFFFAOYSA-N 1 2 307.397 4.462 20 0 DIADLO Cc1nc(Nc2ccc3c[nH+]ccc3c2)ccc1Br ZINC001210043216 1050127482 /nfs/dbraw/zinc/12/74/82/1050127482.db2.gz AUAWCRRELORTQI-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO Cc1cc(Nc2ccc(-c3ccccn3)nc2)ccc1[NH+](C)C ZINC001210041368 1050127536 /nfs/dbraw/zinc/12/75/36/1050127536.db2.gz NKMJHUDSFHVONS-UHFFFAOYSA-N 1 2 304.397 4.262 20 0 DIADLO Cc1cc(Nc2ccc3nnc(C4CCC4)n3c2)ccc1[NH+](C)C ZINC001210043636 1050127602 /nfs/dbraw/zinc/12/76/02/1050127602.db2.gz XTQVJYZVHDZBHS-UHFFFAOYSA-N 1 2 321.428 4.115 20 0 DIADLO FC(F)(F)Oc1cccnc1Nc1ccc2c[nH+]ccc2c1 ZINC001210046593 1050128217 /nfs/dbraw/zinc/12/82/17/1050128217.db2.gz ICQMBMKIQISEEE-UHFFFAOYSA-N 1 2 305.259 4.272 20 0 DIADLO Cc1cc(Nc2ccc3c(c2)CCCC(=O)N3)ccc1[NH+](C)C ZINC001210045796 1050128789 /nfs/dbraw/zinc/12/87/89/1050128789.db2.gz YCWQUGHLDUZERQ-UHFFFAOYSA-N 1 2 309.413 4.079 20 0 DIADLO Cc1cc(=O)c2ccc(Nc3ccc([NH+](C)C)c(C)c3)cc2o1 ZINC001210044068 1050128850 /nfs/dbraw/zinc/12/88/50/1050128850.db2.gz KLVWAVOWOVSQJR-UHFFFAOYSA-N 1 2 308.381 4.219 20 0 DIADLO COC(=O)c1c(F)ccc(Nc2ccc([NH+](C)C)c(C)c2)c1C ZINC001210045686 1050128853 /nfs/dbraw/zinc/12/88/53/1050128853.db2.gz WJNYGSQWNGZQKN-UHFFFAOYSA-N 1 2 316.376 4.039 20 0 DIADLO COC(=O)[C@H]1CCc2cc(Nc3ccc([NH+](C)C)c(C)c3)ccc21 ZINC001210045940 1050128857 /nfs/dbraw/zinc/12/88/57/1050128857.db2.gz ZZYAZJYESUSMCC-SFHVURJKSA-N 1 2 324.424 4.007 20 0 DIADLO Fc1nc(Nc2ccc3c[nH+]ccc3c2)c(F)c(Cl)c1F ZINC001210047036 1050129495 /nfs/dbraw/zinc/12/94/95/1050129495.db2.gz GTXHNMAKJWSDLB-UHFFFAOYSA-N 1 2 309.678 4.444 20 0 DIADLO Nc1ccc(N(c2ccc3c[nH+]ccc3c2)C2CCCC2)nc1 ZINC001210047125 1050129523 /nfs/dbraw/zinc/12/95/23/1050129523.db2.gz LRFKSMYAPVQFDL-UHFFFAOYSA-N 1 2 304.397 4.293 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1c(F)cccc1C(F)(F)F ZINC001210128059 1050140822 /nfs/dbraw/zinc/14/08/22/1050140822.db2.gz COSMEXWQJUNVNR-UHFFFAOYSA-N 1 2 309.266 4.074 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)no1 ZINC000573169174 1050141041 /nfs/dbraw/zinc/14/10/41/1050141041.db2.gz XIDFCGFBQUNLDL-MRXNPFEDSA-N 1 2 302.393 4.448 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)no1 ZINC000573169174 1050141046 /nfs/dbraw/zinc/14/10/46/1050141046.db2.gz XIDFCGFBQUNLDL-MRXNPFEDSA-N 1 2 302.393 4.448 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)s1 ZINC000646119459 1050150338 /nfs/dbraw/zinc/15/03/38/1050150338.db2.gz UUWKOBJTVNGSJW-CJNGLKHVSA-N 1 2 311.454 4.301 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)s1 ZINC000646119459 1050150342 /nfs/dbraw/zinc/15/03/42/1050150342.db2.gz UUWKOBJTVNGSJW-CJNGLKHVSA-N 1 2 311.454 4.301 20 0 DIADLO C[N@H+](CC1CCCC1)Cn1nc(-c2ccc(F)cc2)oc1=S ZINC000746504662 1050158181 /nfs/dbraw/zinc/15/81/81/1050158181.db2.gz LVLPLCMSIZJCEL-UHFFFAOYSA-N 1 2 321.421 4.091 20 0 DIADLO C[N@@H+](CC1CCCC1)Cn1nc(-c2ccc(F)cc2)oc1=S ZINC000746504662 1050158185 /nfs/dbraw/zinc/15/81/85/1050158185.db2.gz LVLPLCMSIZJCEL-UHFFFAOYSA-N 1 2 321.421 4.091 20 0 DIADLO CC1CC[NH+](c2ccc(NCc3ccc4nc[nH]c4c3)cc2)CC1 ZINC000770513572 1050163467 /nfs/dbraw/zinc/16/34/67/1050163467.db2.gz UTUGZPPWEQAOMX-UHFFFAOYSA-N 1 2 320.440 4.411 20 0 DIADLO Cc1ccc(Nc2cccc3cc[nH+]cc32)c(Br)n1 ZINC001210224379 1050165098 /nfs/dbraw/zinc/16/50/98/1050165098.db2.gz YNIDZTWVFYGTTI-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO O=c1[nH]cc(-c2ccncc2)cc1Nc1cccc2cc[nH+]cc21 ZINC001210223943 1050165861 /nfs/dbraw/zinc/16/58/61/1050165861.db2.gz KLUQBDQDULXQAO-UHFFFAOYSA-N 1 2 314.348 4.141 20 0 DIADLO Fc1ccc(Cn2nccc2Nc2cccc3cc[nH+]cc32)cc1 ZINC001210223883 1050166247 /nfs/dbraw/zinc/16/62/47/1050166247.db2.gz HBLLYUAIZCSTOF-UHFFFAOYSA-N 1 2 318.355 4.362 20 0 DIADLO Brc1ncccc1Nc1cccc2cc[nH+]cc21 ZINC001210223960 1050166414 /nfs/dbraw/zinc/16/64/14/1050166414.db2.gz LQGRNHPXZIRHLW-UHFFFAOYSA-N 1 2 300.159 4.136 20 0 DIADLO Oc1cc(Br)ccc1Nc1cccc2cc[nH+]cc21 ZINC001210230838 1050167373 /nfs/dbraw/zinc/16/73/73/1050167373.db2.gz GYHXFQAMMFRYNV-UHFFFAOYSA-N 1 2 315.170 4.447 20 0 DIADLO FC(F)(F)Oc1ncccc1Nc1cccc2cc[nH+]cc21 ZINC001210225185 1050167576 /nfs/dbraw/zinc/16/75/76/1050167576.db2.gz FFEUSJSSFWEMHS-UHFFFAOYSA-N 1 2 305.259 4.272 20 0 DIADLO c1sc(Nc2cccc3cc[nH+]cc32)cc1-c1ccncn1 ZINC001210224625 1050168364 /nfs/dbraw/zinc/16/83/64/1050168364.db2.gz TWWMCAWTHNZLIW-UHFFFAOYSA-N 1 2 304.378 4.497 20 0 DIADLO Fc1nccc(Nc2cccc3cc[nH+]cc32)c1Br ZINC001210224865 1050168435 /nfs/dbraw/zinc/16/84/35/1050168435.db2.gz YXNOTHLNFGYRMT-UHFFFAOYSA-N 1 2 318.149 4.275 20 0 DIADLO CC(C)(C)c1cnn2cc(Nc3cccc4cc[nH+]cc43)cnc12 ZINC001210225866 1050168565 /nfs/dbraw/zinc/16/85/65/1050168565.db2.gz MNUSZYSTWVYAFC-UHFFFAOYSA-N 1 2 317.396 4.319 20 0 DIADLO COCCOc1cccc(F)c1Nc1cccc2cc[nH+]cc21 ZINC001210232132 1050170420 /nfs/dbraw/zinc/17/04/20/1050170420.db2.gz GQOZJVPGEHJRPY-UHFFFAOYSA-N 1 2 312.344 4.143 20 0 DIADLO COc1ccc(C(C)=O)c(Nc2cccc3cc[nH+]cc32)c1OC ZINC001210231881 1050170541 /nfs/dbraw/zinc/17/05/41/1050170541.db2.gz URKBHSDWEAROOB-UHFFFAOYSA-N 1 2 322.364 4.198 20 0 DIADLO CCOC(=O)Cc1ccc(F)c(Nc2cccc3cc[nH+]cc32)c1 ZINC001210231701 1050170588 /nfs/dbraw/zinc/17/05/88/1050170588.db2.gz AYNYTFKUSPQTEY-UHFFFAOYSA-N 1 2 324.355 4.223 20 0 DIADLO FC(F)(F)c1ncccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001210233992 1050172058 /nfs/dbraw/zinc/17/20/58/1050172058.db2.gz AYOPOUKHNPSQDA-UHFFFAOYSA-N 1 2 318.302 4.089 20 0 DIADLO CC[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1ccc(Cl)s1 ZINC001136806331 1050176281 /nfs/dbraw/zinc/17/62/81/1050176281.db2.gz KJVXJQXDKQHDOU-JTQLQIEISA-N 1 2 319.817 4.159 20 0 DIADLO C[C@@H]1CC[N@H+](Cn2nc(C3CC3)sc2=S)CC12CCC2 ZINC000770671320 1050184207 /nfs/dbraw/zinc/18/42/07/1050184207.db2.gz RKJILBXAMXTVAO-LLVKDONJSA-N 1 2 309.504 4.021 20 0 DIADLO C[C@@H]1CC[N@@H+](Cn2nc(C3CC3)sc2=S)CC12CCC2 ZINC000770671320 1050184215 /nfs/dbraw/zinc/18/42/15/1050184215.db2.gz RKJILBXAMXTVAO-LLVKDONJSA-N 1 2 309.504 4.021 20 0 DIADLO CC(C)c1noc(C[NH2+]C(C)(C)c2ccc3ccccc3c2)n1 ZINC000626115078 1050187948 /nfs/dbraw/zinc/18/79/48/1050187948.db2.gz FPMDTTMRBQFCPN-UHFFFAOYSA-N 1 2 309.413 4.371 20 0 DIADLO Cc1cc(Nc2cc[nH+]c(NC(=O)OC(C)(C)C)c2)c(C)o1 ZINC001210278694 1050188092 /nfs/dbraw/zinc/18/80/92/1050188092.db2.gz QQDHSAXFOAVMIQ-UHFFFAOYSA-N 1 2 303.362 4.382 20 0 DIADLO Cc1[nH+]cc(Nc2cnc3ccccc3c2C(F)(F)F)cc1N ZINC001210289112 1050190958 /nfs/dbraw/zinc/19/09/58/1050190958.db2.gz VFWMISKDBRRCEA-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Cc1[nH+]cc(Nc2cc(-c3ccccc3)nn2C2CCC2)cc1N ZINC001210289074 1050192218 /nfs/dbraw/zinc/19/22/18/1050192218.db2.gz SYXQQCLAOZNEDX-UHFFFAOYSA-N 1 2 319.412 4.304 20 0 DIADLO Cc1[nH+]cc(Nc2cc(OC(F)(F)F)ccc2Cl)cc1N ZINC001210289346 1050192500 /nfs/dbraw/zinc/19/25/00/1050192500.db2.gz HHHCJFKSMKMXHG-UHFFFAOYSA-N 1 2 317.698 4.268 20 0 DIADLO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccnc(Cl)c1F ZINC000824250414 1050195315 /nfs/dbraw/zinc/19/53/15/1050195315.db2.gz OCEPFBNNPCITTB-SECBINFHSA-N 1 2 310.722 4.037 20 0 DIADLO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1ccnc(Cl)c1F ZINC000824250414 1050195317 /nfs/dbraw/zinc/19/53/17/1050195317.db2.gz OCEPFBNNPCITTB-SECBINFHSA-N 1 2 310.722 4.037 20 0 DIADLO Cc1cc(C)c(Nc2ccc3c(cnn3[C@H]3CCCCO3)c2)c[nH+]1 ZINC001210331945 1050208062 /nfs/dbraw/zinc/20/80/62/1050208062.db2.gz AQVBUOPWSVPJAS-LJQANCHMSA-N 1 2 322.412 4.491 20 0 DIADLO Cc1ccc(Nc2ccc3c(cnn3[C@@H]3CCCCO3)c2)[nH+]c1 ZINC001210331785 1050208590 /nfs/dbraw/zinc/20/85/90/1050208590.db2.gz WIQPFNPITFPXOV-SFHVURJKSA-N 1 2 308.385 4.182 20 0 DIADLO C[C@@H](c1csnn1)[NH+]1CCC(c2ccnc3ccccc32)CC1 ZINC000573503032 1050208851 /nfs/dbraw/zinc/20/88/51/1050208851.db2.gz HYORAPYLSFAQNI-ZDUSSCGKSA-N 1 2 324.453 4.027 20 0 DIADLO Clc1ccc([C@H]2CCC[N@@H+]2Cc2cn3ccccc3n2)s1 ZINC001136880929 1050215741 /nfs/dbraw/zinc/21/57/41/1050215741.db2.gz PJDKUSUGBJZPLY-CYBMUJFWSA-N 1 2 317.845 4.386 20 0 DIADLO Clc1ccc([C@H]2CCC[N@H+]2Cc2cn3ccccc3n2)s1 ZINC001136880929 1050215750 /nfs/dbraw/zinc/21/57/50/1050215750.db2.gz PJDKUSUGBJZPLY-CYBMUJFWSA-N 1 2 317.845 4.386 20 0 DIADLO CC(=O)c1ccc([C@H](C)Nc2ccc(F)c(-n3cc[nH+]c3)c2)cc1 ZINC001171059224 1050223154 /nfs/dbraw/zinc/22/31/54/1050223154.db2.gz IOCRETTZUGKYMJ-ZDUSSCGKSA-N 1 2 323.371 4.387 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)C=C2CCC(C)CC2)n1 ZINC000734123237 1050230977 /nfs/dbraw/zinc/23/09/77/1050230977.db2.gz JWILBBQRUCFKLN-UHFFFAOYSA-N 1 2 321.490 4.060 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@@H](C)c2csc3ccccc23)n1 ZINC000734160645 1050233430 /nfs/dbraw/zinc/23/34/30/1050233430.db2.gz YLYIHHQOPOHVFH-WDEREUQCSA-N 1 2 301.415 4.259 20 0 DIADLO Clc1ccc(C[N@H+](Cc2ccccc2)Cc2ccccn2)nc1 ZINC001136925796 1050234337 /nfs/dbraw/zinc/23/43/37/1050234337.db2.gz RCTDWSFJQRFGOJ-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1ccc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)nc1 ZINC001136925796 1050234341 /nfs/dbraw/zinc/23/43/41/1050234341.db2.gz RCTDWSFJQRFGOJ-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO C[C@H]([N@H+](C)Cn1nc(C(F)(F)F)sc1=S)C(C)(C)C ZINC000780424500 1050235023 /nfs/dbraw/zinc/23/50/23/1050235023.db2.gz CDPQUCQJWWAHPE-ZETCQYMHSA-N 1 2 313.414 4.017 20 0 DIADLO C[C@H]([N@@H+](C)Cn1nc(C(F)(F)F)sc1=S)C(C)(C)C ZINC000780424500 1050235035 /nfs/dbraw/zinc/23/50/35/1050235035.db2.gz CDPQUCQJWWAHPE-ZETCQYMHSA-N 1 2 313.414 4.017 20 0 DIADLO O[C@H](CNc1cc2cc[nH]c2c[nH+]1)c1c(Cl)cccc1Cl ZINC001170025492 1050245457 /nfs/dbraw/zinc/24/54/57/1050245457.db2.gz BXGVDULMTRILQE-CYBMUJFWSA-N 1 2 322.195 4.015 20 0 DIADLO Clc1ccc(-c2ncc(CNc3cccc[nH+]3)s2)cc1 ZINC000573702850 1050246226 /nfs/dbraw/zinc/24/62/26/1050246226.db2.gz DUICHGPZEVYDIG-UHFFFAOYSA-N 1 2 301.802 4.471 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@@H+]2Cc2cn(C(C)C)nn2)o1 ZINC000573727145 1050247926 /nfs/dbraw/zinc/24/79/26/1050247926.db2.gz PTKHISYEVGDBDG-QGZVFWFLSA-N 1 2 316.449 4.132 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@H+]2Cc2cn(C(C)C)nn2)o1 ZINC000573727145 1050247942 /nfs/dbraw/zinc/24/79/42/1050247942.db2.gz PTKHISYEVGDBDG-QGZVFWFLSA-N 1 2 316.449 4.132 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1nc2ccccc2s1 ZINC001136955954 1050250507 /nfs/dbraw/zinc/25/05/07/1050250507.db2.gz BSCIHTIUPZWIBF-CYBMUJFWSA-N 1 2 312.438 4.498 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1nc2ccccc2s1 ZINC001136955954 1050250510 /nfs/dbraw/zinc/25/05/10/1050250510.db2.gz BSCIHTIUPZWIBF-CYBMUJFWSA-N 1 2 312.438 4.498 20 0 DIADLO CC(C)CC1CC[NH+]([C@@H](C)C(=O)Nc2c(F)cccc2F)CC1 ZINC000760925617 1050265898 /nfs/dbraw/zinc/26/58/98/1050265898.db2.gz LOHZDWROVZRIPD-ZDUSSCGKSA-N 1 2 324.415 4.050 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccc(-c3ccccc3OC)cc2)co1 ZINC000825050017 1050267754 /nfs/dbraw/zinc/26/77/54/1050267754.db2.gz GADWFNPTGLKYLE-UHFFFAOYSA-N 1 2 322.408 4.202 20 0 DIADLO Clc1cncc(C[N@H+](Cc2ccccc2)Cc2ccncc2)c1 ZINC001136989231 1050272775 /nfs/dbraw/zinc/27/27/75/1050272775.db2.gz AWORRMVTJLCQFK-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1cncc(C[N@@H+](Cc2ccccc2)Cc2ccncc2)c1 ZINC001136989231 1050272789 /nfs/dbraw/zinc/27/27/89/1050272789.db2.gz AWORRMVTJLCQFK-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@H](C)C(=O)Nc1ccc2ccccc2c1 ZINC000771796332 1050280781 /nfs/dbraw/zinc/28/07/81/1050280781.db2.gz MOYAROHSFTZRCK-CQSZACIVSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1occc1C[N@H+](C)[C@H](C)C(=O)Nc1ccc2ccccc2c1 ZINC000771796332 1050280791 /nfs/dbraw/zinc/28/07/91/1050280791.db2.gz MOYAROHSFTZRCK-CQSZACIVSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc2ccccc2c1 ZINC000771796331 1050282117 /nfs/dbraw/zinc/28/21/17/1050282117.db2.gz MOYAROHSFTZRCK-AWEZNQCLSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1occc1C[N@H+](C)[C@@H](C)C(=O)Nc1ccc2ccccc2c1 ZINC000771796331 1050282127 /nfs/dbraw/zinc/28/21/27/1050282127.db2.gz MOYAROHSFTZRCK-AWEZNQCLSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC000825214952 1050285046 /nfs/dbraw/zinc/28/50/46/1050285046.db2.gz BVZNTNKWNMMUIR-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(F)ccc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC000825214952 1050285054 /nfs/dbraw/zinc/28/50/54/1050285054.db2.gz BVZNTNKWNMMUIR-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(NC[C@H](O)c2c(Cl)cccc2Cl)c[nH+]c1C ZINC001170033859 1050286088 /nfs/dbraw/zinc/28/60/88/1050286088.db2.gz QTSMJGOTSZDUKB-AWEZNQCLSA-N 1 2 311.212 4.151 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)cc1C ZINC001137007589 1050287439 /nfs/dbraw/zinc/28/74/39/1050287439.db2.gz GFIURDPQFFWJHL-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)cc1C ZINC001137007589 1050287452 /nfs/dbraw/zinc/28/74/52/1050287452.db2.gz GFIURDPQFFWJHL-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)cc1C ZINC001137007375 1050287511 /nfs/dbraw/zinc/28/75/11/1050287511.db2.gz BJBYKDJPHKFMEX-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)cc1C ZINC001137007375 1050287524 /nfs/dbraw/zinc/28/75/24/1050287524.db2.gz BJBYKDJPHKFMEX-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)cc1C ZINC001137007590 1050287719 /nfs/dbraw/zinc/28/77/19/1050287719.db2.gz GFIURDPQFFWJHL-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)cc1C ZINC001137007590 1050287730 /nfs/dbraw/zinc/28/77/30/1050287730.db2.gz GFIURDPQFFWJHL-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO C[C@H]([NH2+][C@@H](CO)c1c(Cl)cccc1Cl)c1ccsc1 ZINC000479560990 1050288936 /nfs/dbraw/zinc/28/89/36/1050288936.db2.gz SNFLOIGILDJZFN-ZANVPECISA-N 1 2 316.253 4.439 20 0 DIADLO CC[N@H+](Cc1nc(C(F)(F)F)c[nH]1)Cc1ccc(C)c(C)c1 ZINC001137018700 1050294277 /nfs/dbraw/zinc/29/42/77/1050294277.db2.gz BBKMFVVXUOIBEG-UHFFFAOYSA-N 1 2 311.351 4.067 20 0 DIADLO CC[N@@H+](Cc1nc(C(F)(F)F)c[nH]1)Cc1ccc(C)c(C)c1 ZINC001137018700 1050294293 /nfs/dbraw/zinc/29/42/93/1050294293.db2.gz BBKMFVVXUOIBEG-UHFFFAOYSA-N 1 2 311.351 4.067 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(C3CCCCC3)n2)[C@@H]2COC[C@@H]21 ZINC001171087241 1050303295 /nfs/dbraw/zinc/30/32/95/1050303295.db2.gz OAHUKARISDDRBD-JKSUJKDBSA-N 1 2 320.502 4.048 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(C3CCCCC3)n2)[C@@H]2COC[C@@H]21 ZINC001171087241 1050303306 /nfs/dbraw/zinc/30/33/06/1050303306.db2.gz OAHUKARISDDRBD-JKSUJKDBSA-N 1 2 320.502 4.048 20 0 DIADLO COc1cc2ccccc2c(Nc2ccc3c(c2)[nH+]cn3C)c1 ZINC001210589115 1050309382 /nfs/dbraw/zinc/30/93/82/1050309382.db2.gz WDXMGEGXJYBDIC-UHFFFAOYSA-N 1 2 303.365 4.479 20 0 DIADLO NC(Cc1ccccc1Cl)=[NH+]OCc1ccc(Cl)s1 ZINC000058497892 1050317634 /nfs/dbraw/zinc/31/76/34/1050317634.db2.gz SNXPURZGDAHGTP-UHFFFAOYSA-N 1 2 315.225 4.086 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1ccc(F)c(Cl)c1F ZINC001143626226 1050328303 /nfs/dbraw/zinc/32/83/03/1050328303.db2.gz MYZACAWDEQHUPY-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1ccc(F)c(Cl)c1F ZINC001143626226 1050328311 /nfs/dbraw/zinc/32/83/11/1050328311.db2.gz MYZACAWDEQHUPY-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CC(C)OC1CC[NH+](Cc2ccc(F)c(Cl)c2F)CC1 ZINC001143626267 1050328429 /nfs/dbraw/zinc/32/84/29/1050328429.db2.gz OLCPMTFLLGLTOK-UHFFFAOYSA-N 1 2 303.780 4.008 20 0 DIADLO CC(C)[C@H]1COCC[N@@H+]1Cc1ccc(C(F)(F)F)cc1Cl ZINC001143715488 1050338139 /nfs/dbraw/zinc/33/81/39/1050338139.db2.gz JSEPFXFOIJYKIZ-CQSZACIVSA-N 1 2 321.770 4.216 20 0 DIADLO CC(C)[C@H]1COCC[N@H+]1Cc1ccc(C(F)(F)F)cc1Cl ZINC001143715488 1050338146 /nfs/dbraw/zinc/33/81/46/1050338146.db2.gz JSEPFXFOIJYKIZ-CQSZACIVSA-N 1 2 321.770 4.216 20 0 DIADLO C[C@@H]1CC[C@H](CO)C[N@@H+]1Cc1c(Cl)cc(Cl)cc1Cl ZINC001143797679 1050363840 /nfs/dbraw/zinc/36/38/40/1050363840.db2.gz OSYCXILOYGHZHE-ZJUUUORDSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[C@H](CO)C[N@H+]1Cc1c(Cl)cc(Cl)cc1Cl ZINC001143797679 1050363852 /nfs/dbraw/zinc/36/38/52/1050363852.db2.gz OSYCXILOYGHZHE-ZJUUUORDSA-N 1 2 322.663 4.240 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)NCC[NH+]1Cc2ccccc2C1 ZINC000735039438 1050340863 /nfs/dbraw/zinc/34/08/63/1050340863.db2.gz VIAMKEZPGKSKNB-QGZVFWFLSA-N 1 2 316.489 4.115 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000735040490 1050342415 /nfs/dbraw/zinc/34/24/15/1050342415.db2.gz VZQCRUIQUATFSF-OAHLLOKOSA-N 1 2 305.466 4.112 20 0 DIADLO Cc1ccc(OC2CC[NH+](Cc3ncc(C(C)C)o3)CC2)cc1 ZINC000735078639 1050343896 /nfs/dbraw/zinc/34/38/96/1050343896.db2.gz ORMNCPOLHSELBM-UHFFFAOYSA-N 1 2 314.429 4.150 20 0 DIADLO CC(C)Oc1cccc(C[NH2+]Cc2occc2Br)c1 ZINC000735324515 1050371686 /nfs/dbraw/zinc/37/16/86/1050371686.db2.gz OLZRACCAXQFJFA-UHFFFAOYSA-N 1 2 324.218 4.119 20 0 DIADLO c1cnn(-c2ccccc2Nc2ccc[nH+]c2N2CCCCC2)c1 ZINC001210729387 1050351849 /nfs/dbraw/zinc/35/18/49/1050351849.db2.gz QPRMEOORUNJUJN-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO CCCC[C@@H](CC)CC(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000735271468 1050362417 /nfs/dbraw/zinc/36/24/17/1050362417.db2.gz HMZOSGCJDABTKH-HZPDHXFCSA-N 1 2 307.482 4.021 20 0 DIADLO CCCC[C@H](CC)CC(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000735271467 1050362860 /nfs/dbraw/zinc/36/28/60/1050362860.db2.gz HMZOSGCJDABTKH-HOTGVXAUSA-N 1 2 307.482 4.021 20 0 DIADLO F[C@@H]1C[N@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)C[C@@H]2C[C@@H]21 ZINC001143804469 1050365381 /nfs/dbraw/zinc/36/53/81/1050365381.db2.gz RPSDIYLPQURXMS-OUJBWJOFSA-N 1 2 307.718 4.149 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)C[C@@H]2C[C@@H]21 ZINC001143804469 1050365387 /nfs/dbraw/zinc/36/53/87/1050365387.db2.gz RPSDIYLPQURXMS-OUJBWJOFSA-N 1 2 307.718 4.149 20 0 DIADLO Fc1ccc(F)c(C[N@H+](CC2CC2)C2CC2)c1Br ZINC001143824239 1050367934 /nfs/dbraw/zinc/36/79/34/1050367934.db2.gz XIIYXXKMYFOMQD-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1ccc(F)c(C[N@@H+](CC2CC2)C2CC2)c1Br ZINC001143824239 1050367948 /nfs/dbraw/zinc/36/79/48/1050367948.db2.gz XIIYXXKMYFOMQD-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO CCOC1CC[NH+](Cc2c(F)ccc(Cl)c2Cl)CC1 ZINC001143860913 1050377755 /nfs/dbraw/zinc/37/77/55/1050377755.db2.gz VMZQUNYCEIXHOP-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO COC1(C)CC[NH+](Cc2c(F)ccc(Cl)c2Cl)CC1 ZINC001143864995 1050377980 /nfs/dbraw/zinc/37/79/80/1050377980.db2.gz WLHRDQBQFQFTQZ-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC001143854978 1050385144 /nfs/dbraw/zinc/38/51/44/1050385144.db2.gz PAPVSJYRIQYKRX-HNNXBMFYSA-N 1 2 318.219 4.135 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[N@H+]1CCC[C@]2(CCOC2)C1 ZINC001143854978 1050385155 /nfs/dbraw/zinc/38/51/55/1050385155.db2.gz PAPVSJYRIQYKRX-HNNXBMFYSA-N 1 2 318.219 4.135 20 0 DIADLO Cc1c(C[N@H+](C)CC(=O)c2ccccc2)cccc1C(F)(F)F ZINC001143929891 1050402919 /nfs/dbraw/zinc/40/29/19/1050402919.db2.gz FGFNVKDZBXWFGX-UHFFFAOYSA-N 1 2 321.342 4.329 20 0 DIADLO Cc1c(C[N@@H+](C)CC(=O)c2ccccc2)cccc1C(F)(F)F ZINC001143929891 1050402927 /nfs/dbraw/zinc/40/29/27/1050402927.db2.gz FGFNVKDZBXWFGX-UHFFFAOYSA-N 1 2 321.342 4.329 20 0 DIADLO CC[C@H]1CCC[C@]1(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001143939849 1050411246 /nfs/dbraw/zinc/41/12/46/1050411246.db2.gz PDJTZBLKYJEBSU-KXBFYZLASA-N 1 2 311.429 4.336 20 0 DIADLO CCCc1ccccc1C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001143945923 1050412091 /nfs/dbraw/zinc/41/20/91/1050412091.db2.gz FYJBMGVOMCAFOR-UHFFFAOYSA-N 1 2 319.408 4.386 20 0 DIADLO Fc1ccc(Cl)c(C[NH+]2CCC(OC3CCC3)CC2)c1F ZINC001143946852 1050412643 /nfs/dbraw/zinc/41/26/43/1050412643.db2.gz YAFHHHIDZNATQE-UHFFFAOYSA-N 1 2 315.791 4.152 20 0 DIADLO c1coc(-c2nc(C[N@@H+]3CCCc4sccc4C3)cs2)c1 ZINC000593440597 1050415213 /nfs/dbraw/zinc/41/52/13/1050415213.db2.gz ZEKJKHZFSCMTER-UHFFFAOYSA-N 1 2 316.451 4.413 20 0 DIADLO c1coc(-c2nc(C[N@H+]3CCCc4sccc4C3)cs2)c1 ZINC000593440597 1050415226 /nfs/dbraw/zinc/41/52/26/1050415226.db2.gz ZEKJKHZFSCMTER-UHFFFAOYSA-N 1 2 316.451 4.413 20 0 DIADLO COc1ccc(F)c(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c1F ZINC001143967602 1050419551 /nfs/dbraw/zinc/41/95/51/1050419551.db2.gz KAUJUYVFNSHSPH-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c1F ZINC001143967602 1050419555 /nfs/dbraw/zinc/41/95/55/1050419555.db2.gz KAUJUYVFNSHSPH-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)cs1 ZINC000844434566 1050424475 /nfs/dbraw/zinc/42/44/75/1050424475.db2.gz LEXPIPGWGPWNLR-CQSZACIVSA-N 1 2 300.418 4.062 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)cs1 ZINC000844434566 1050424478 /nfs/dbraw/zinc/42/44/78/1050424478.db2.gz LEXPIPGWGPWNLR-CQSZACIVSA-N 1 2 300.418 4.062 20 0 DIADLO CCC[N@@H+]1CCc2c(N)sc(Nc3cccc(S)c3)c2C1 ZINC001210946304 1050427436 /nfs/dbraw/zinc/42/74/36/1050427436.db2.gz ILJGOADQZAQEEE-UHFFFAOYSA-N 1 2 319.499 4.131 20 0 DIADLO CCC[N@H+]1CCc2c(N)sc(Nc3cccc(S)c3)c2C1 ZINC001210946304 1050427443 /nfs/dbraw/zinc/42/74/43/1050427443.db2.gz ILJGOADQZAQEEE-UHFFFAOYSA-N 1 2 319.499 4.131 20 0 DIADLO CC(C)(C)OC(=O)c1ncccc1Nc1cccc2cc[nH+]cc21 ZINC001210956711 1050431347 /nfs/dbraw/zinc/43/13/47/1050431347.db2.gz KPILWLXPSAVYSN-UHFFFAOYSA-N 1 2 321.380 4.329 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)ccc1OCC1CC1)c1cscn1 ZINC000574340017 1050439050 /nfs/dbraw/zinc/43/90/50/1050439050.db2.gz RBJHGBCHTNSKOW-LLVKDONJSA-N 1 2 322.861 4.436 20 0 DIADLO CCOc1c(F)cc(C[NH+]2CCC(C(F)(F)F)CC2)cc1F ZINC001144020238 1050442845 /nfs/dbraw/zinc/44/28/45/1050442845.db2.gz BFZVNHIRDRPVRH-UHFFFAOYSA-N 1 2 323.305 4.138 20 0 DIADLO c1nc(C2CC2)c(CNc2ccc(N3CCCCC3)[nH+]c2)s1 ZINC000362633056 1050446446 /nfs/dbraw/zinc/44/64/46/1050446446.db2.gz HQDWWSHXMVFFGS-UHFFFAOYSA-N 1 2 314.458 4.018 20 0 DIADLO CC(=O)Nc1ccc(Nc2ccc(C)c[nH+]2)cc1C(F)(F)F ZINC001211014243 1050447042 /nfs/dbraw/zinc/44/70/42/1050447042.db2.gz VYNPWHJIPFBSMF-UHFFFAOYSA-N 1 2 309.291 4.111 20 0 DIADLO Cn1c2ccccc2[nH+]c1Nc1cncc(-c2ccccc2)c1 ZINC001211019971 1050448248 /nfs/dbraw/zinc/44/82/48/1050448248.db2.gz QEGRVJHLGOELNB-UHFFFAOYSA-N 1 2 300.365 4.379 20 0 DIADLO Cc1ccc(Oc2cccc(C[NH+]3CC4(C3)CCCO4)c2)cc1 ZINC001144089362 1050458521 /nfs/dbraw/zinc/45/85/21/1050458521.db2.gz SAMHBVWQKFOMMH-UHFFFAOYSA-N 1 2 309.409 4.152 20 0 DIADLO COCc1cncc(Nc2ccc(Oc3cc[nH+]c(C)c3)cc2)c1 ZINC001211081479 1050467983 /nfs/dbraw/zinc/46/79/83/1050467983.db2.gz HONWMCPGNZBHNS-UHFFFAOYSA-N 1 2 321.380 4.467 20 0 DIADLO Fc1cc(F)c(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)cc1Cl ZINC001144125490 1050474804 /nfs/dbraw/zinc/47/48/04/1050474804.db2.gz KMXDAWQWBGELID-AOOOYVTPSA-N 1 2 307.718 4.095 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)cc1Cl ZINC001144125490 1050474818 /nfs/dbraw/zinc/47/48/18/1050474818.db2.gz KMXDAWQWBGELID-AOOOYVTPSA-N 1 2 307.718 4.095 20 0 DIADLO S=c1ncccn1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000046476931 1050475511 /nfs/dbraw/zinc/47/55/11/1050475511.db2.gz BZYFQXIFVWHYLS-AWEZNQCLSA-N 1 2 305.834 4.061 20 0 DIADLO S=c1ncccn1C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000046476931 1050475521 /nfs/dbraw/zinc/47/55/21/1050475521.db2.gz BZYFQXIFVWHYLS-AWEZNQCLSA-N 1 2 305.834 4.061 20 0 DIADLO Fc1cc(F)c(C[NH+]2CCC(c3ccccn3)CC2)cc1Cl ZINC001144131276 1050478810 /nfs/dbraw/zinc/47/88/10/1050478810.db2.gz XQOFSKJHROPHGW-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO C[N@H+](CCC(=O)c1ccccc1)Cc1cc(Cl)c(F)cc1F ZINC001144130440 1050479840 /nfs/dbraw/zinc/47/98/40/1050479840.db2.gz HHWDSSFMMDNEDN-UHFFFAOYSA-N 1 2 323.770 4.323 20 0 DIADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1cc(Cl)c(F)cc1F ZINC001144130440 1050479843 /nfs/dbraw/zinc/47/98/43/1050479843.db2.gz HHWDSSFMMDNEDN-UHFFFAOYSA-N 1 2 323.770 4.323 20 0 DIADLO OC[C@@H](Nc1ccc(C2CC2)c[nH+]1)c1ccc(C(F)(F)F)cc1 ZINC001171146118 1050481645 /nfs/dbraw/zinc/48/16/45/1050481645.db2.gz KXHRUPHWPKIUOH-OAHLLOKOSA-N 1 2 322.330 4.123 20 0 DIADLO Fc1ccc2[nH]nc(C[N@@H+]3CCCC[C@@H]3c3ccccc3)c2c1 ZINC001144191738 1050491553 /nfs/dbraw/zinc/49/15/53/1050491553.db2.gz XYNZHCNFUROMOU-LJQANCHMSA-N 1 2 309.388 4.429 20 0 DIADLO Fc1ccc2[nH]nc(C[N@H+]3CCCC[C@@H]3c3ccccc3)c2c1 ZINC001144191738 1050491557 /nfs/dbraw/zinc/49/15/57/1050491557.db2.gz XYNZHCNFUROMOU-LJQANCHMSA-N 1 2 309.388 4.429 20 0 DIADLO Clc1cccc([C@@H]2CSCC[N@@H+]2Cc2ccccn2)c1 ZINC001204059416 1050492042 /nfs/dbraw/zinc/49/20/42/1050492042.db2.gz BHADTCXKIHNNJD-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cccc([C@@H]2CSCC[N@H+]2Cc2ccccn2)c1 ZINC001204059416 1050492052 /nfs/dbraw/zinc/49/20/52/1050492052.db2.gz BHADTCXKIHNNJD-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Cc1cn2c(cccc2Nc2cccc(-c3cccnc3)c2)[nH+]1 ZINC001211142462 1050493490 /nfs/dbraw/zinc/49/34/90/1050493490.db2.gz UMEVFRWAKAEAPG-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO Clc1cnc2c(c1)C[N@@H+](Cc1ccc(-n3cccc3)cc1)CC2 ZINC001144251350 1050519324 /nfs/dbraw/zinc/51/93/24/1050519324.db2.gz FDHVTWGFKQPCCP-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1cnc2c(c1)C[N@H+](Cc1ccc(-n3cccc3)cc1)CC2 ZINC001144251350 1050519335 /nfs/dbraw/zinc/51/93/35/1050519335.db2.gz FDHVTWGFKQPCCP-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Cc1ccsc1-c1nn(C[N@@H+](C)CC(C)(C)C)c(=S)o1 ZINC000738098652 1050522027 /nfs/dbraw/zinc/52/20/27/1050522027.db2.gz KXXYYAVSUZTFCP-UHFFFAOYSA-N 1 2 311.476 4.178 20 0 DIADLO Cc1ccsc1-c1nn(C[N@H+](C)CC(C)(C)C)c(=S)o1 ZINC000738098652 1050522040 /nfs/dbraw/zinc/52/20/40/1050522040.db2.gz KXXYYAVSUZTFCP-UHFFFAOYSA-N 1 2 311.476 4.178 20 0 DIADLO CO[C@@H](c1ccccc1)[C@H](C)Nc1ccc([NH+]2CCCC2)cc1 ZINC000786870838 1050523997 /nfs/dbraw/zinc/52/39/97/1050523997.db2.gz GNPRNMFNYVSWAQ-OXJNMPFZSA-N 1 2 310.441 4.475 20 0 DIADLO C[C@@H]1CCCCC[N@@H+]1Cn1nc(-c2ccccc2)oc1=S ZINC000738226227 1050527872 /nfs/dbraw/zinc/52/78/72/1050527872.db2.gz WDGUUKHWKJJYNQ-CYBMUJFWSA-N 1 2 303.431 4.095 20 0 DIADLO C[C@@H]1CCCCC[N@H+]1Cn1nc(-c2ccccc2)oc1=S ZINC000738226227 1050527888 /nfs/dbraw/zinc/52/78/88/1050527888.db2.gz WDGUUKHWKJJYNQ-CYBMUJFWSA-N 1 2 303.431 4.095 20 0 DIADLO C[C@H]1CSCC[N@@H+]1Cn1c(=S)oc2cc(Cl)ccc21 ZINC000738275900 1050528156 /nfs/dbraw/zinc/52/81/56/1050528156.db2.gz CLARTCFDUYILDG-VIFPVBQESA-N 1 2 314.863 4.012 20 0 DIADLO C[C@H]1CSCC[N@H+]1Cn1c(=S)oc2cc(Cl)ccc21 ZINC000738275900 1050528169 /nfs/dbraw/zinc/52/81/69/1050528169.db2.gz CLARTCFDUYILDG-VIFPVBQESA-N 1 2 314.863 4.012 20 0 DIADLO COc1cc(C)[nH+]c(CSCCc2noc3ccccc23)c1 ZINC000594558745 1050536553 /nfs/dbraw/zinc/53/65/53/1050536553.db2.gz VFQZRXCKAKCKOZ-UHFFFAOYSA-N 1 2 314.410 4.016 20 0 DIADLO CCc1cccc(C[N@H+](Cc2cccnc2)Cc2ccccn2)c1 ZINC001144323007 1050542230 /nfs/dbraw/zinc/54/22/30/1050542230.db2.gz MHDCEWFOZLJHMA-UHFFFAOYSA-N 1 2 317.436 4.241 20 0 DIADLO CCc1cccc(C[N@@H+](Cc2cccnc2)Cc2ccccn2)c1 ZINC001144323007 1050542244 /nfs/dbraw/zinc/54/22/44/1050542244.db2.gz MHDCEWFOZLJHMA-UHFFFAOYSA-N 1 2 317.436 4.241 20 0 DIADLO CCc1cccc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1 ZINC001144326739 1050543811 /nfs/dbraw/zinc/54/38/11/1050543811.db2.gz QGYZJSXVQOUWDA-LJQANCHMSA-N 1 2 317.379 4.101 20 0 DIADLO CCc1cccc(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1 ZINC001144326739 1050543828 /nfs/dbraw/zinc/54/38/28/1050543828.db2.gz QGYZJSXVQOUWDA-LJQANCHMSA-N 1 2 317.379 4.101 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cc(OC)cc(C(F)(F)F)c1 ZINC001211334781 1050548394 /nfs/dbraw/zinc/54/83/94/1050548394.db2.gz ONSZWVGLCLCEKY-UHFFFAOYSA-N 1 2 312.291 4.251 20 0 DIADLO COc1cc(Nc2cccc3[nH+]ccn32)cc(C(F)(F)F)c1 ZINC001211332959 1050548795 /nfs/dbraw/zinc/54/87/95/1050548795.db2.gz CBLOSVBNPSZWNN-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO CCOC(=O)c1[nH]ccc1C[N@H+](C)[C@H](C)c1ccccc1Cl ZINC001144337521 1050550097 /nfs/dbraw/zinc/55/00/97/1050550097.db2.gz FZKJNTKBXYKBBQ-GFCCVEGCSA-N 1 2 320.820 4.038 20 0 DIADLO CCOC(=O)c1[nH]ccc1C[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC001144337521 1050550112 /nfs/dbraw/zinc/55/01/12/1050550112.db2.gz FZKJNTKBXYKBBQ-GFCCVEGCSA-N 1 2 320.820 4.038 20 0 DIADLO C[C@@H](SCc1c[nH+]cn1C)c1cccc(C(F)(F)F)c1 ZINC000594909072 1050559177 /nfs/dbraw/zinc/55/91/77/1050559177.db2.gz ABSGQJNZWITZKC-SNVBAGLBSA-N 1 2 300.349 4.433 20 0 DIADLO C[C@@H](CC(=O)O[C@@H](C)c1cccc2ccccc21)n1cc[nH+]c1 ZINC000845280012 1050559077 /nfs/dbraw/zinc/55/90/77/1050559077.db2.gz ANILKHYSNWVWPA-GJZGRUSLSA-N 1 2 308.381 4.292 20 0 DIADLO Cc1ccc2ccccc2c1COC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000845280473 1050560838 /nfs/dbraw/zinc/56/08/38/1050560838.db2.gz CHWULZWPTIUUPK-OAHLLOKOSA-N 1 2 308.381 4.039 20 0 DIADLO Cc1cc(C)c([C@@H](C)OC(=O)C[C@@H](C)n2cc[nH+]c2)c(C)c1 ZINC000845283358 1050560904 /nfs/dbraw/zinc/56/09/04/1050560904.db2.gz VULZVKFBXGIQLX-HZPDHXFCSA-N 1 2 300.402 4.064 20 0 DIADLO Fc1nc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(F)c(Cl)c1F ZINC001213087866 1050584325 /nfs/dbraw/zinc/58/43/25/1050584325.db2.gz DWUMNBCYEWKJCS-UHFFFAOYSA-N 1 2 324.693 4.286 20 0 DIADLO COc1cccc(C(C)=O)c1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213089841 1050585660 /nfs/dbraw/zinc/58/56/60/1050585660.db2.gz HHVATGYPVJAAAG-UHFFFAOYSA-N 1 2 307.353 4.032 20 0 DIADLO Cc1cc2c(ccc(N)c2F)n1-c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213090735 1050586034 /nfs/dbraw/zinc/58/60/34/1050586034.db2.gz DHPDCMKSUQWNKX-UHFFFAOYSA-N 1 2 306.344 4.050 20 0 DIADLO COC(=O)[C@H](C)c1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001213090672 1050587088 /nfs/dbraw/zinc/58/70/88/1050587088.db2.gz ALFZKHKVKDFIPC-CYBMUJFWSA-N 1 2 321.380 4.097 20 0 DIADLO O=C1CCCc2cc(Nc3cccc(Cn4cc[nH+]c4)c3)ccc21 ZINC001213104809 1050589779 /nfs/dbraw/zinc/58/97/79/1050589779.db2.gz GLVWNJNJKLRRQG-UHFFFAOYSA-N 1 2 317.392 4.194 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)cc1F ZINC001144463484 1050590103 /nfs/dbraw/zinc/59/01/03/1050590103.db2.gz SDUCQXVXBKHYTD-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)cc1F ZINC001144463484 1050590118 /nfs/dbraw/zinc/59/01/18/1050590118.db2.gz SDUCQXVXBKHYTD-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(CC(N)=[NH+]OCc2ccc3ccccc3c2)cc1 ZINC000739899230 1050592892 /nfs/dbraw/zinc/59/28/92/1050592892.db2.gz GDBDFEGAENOYQA-UHFFFAOYSA-N 1 2 320.392 4.090 20 0 DIADLO C[C@H](CC(=O)O[C@H]1CC[C@H](c2ccccc2)CC1)n1cc[nH+]c1 ZINC000845569261 1050595045 /nfs/dbraw/zinc/59/50/45/1050595045.db2.gz KCOORENXPDGOLC-KBAYOESNSA-N 1 2 312.413 4.104 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc4c(c3)CCC(=O)N4C)ccc12 ZINC001213139858 1050598967 /nfs/dbraw/zinc/59/89/67/1050598967.db2.gz STNAOHXEWVHSOG-UHFFFAOYSA-N 1 2 317.392 4.196 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1cccnc1C(F)(F)F ZINC001144520639 1050604621 /nfs/dbraw/zinc/60/46/21/1050604621.db2.gz XFENXYLUVGWVIX-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cccnc1C(F)(F)F ZINC001144520639 1050604629 /nfs/dbraw/zinc/60/46/29/1050604629.db2.gz XFENXYLUVGWVIX-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO CC[C@@H](Nc1cc(C2(C)OCCO2)cc[nH+]1)c1ccccc1C ZINC001171198453 1050612186 /nfs/dbraw/zinc/61/21/86/1050612186.db2.gz QNPHGWBZHIXOJY-QGZVFWFLSA-N 1 2 312.413 4.173 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)c(F)c1 ZINC001144554914 1050613797 /nfs/dbraw/zinc/61/37/97/1050613797.db2.gz LWNVSXIOBXRMEI-LLVKDONJSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@@H](c3ccccc3Cl)C2)c(F)c1 ZINC001144554914 1050613806 /nfs/dbraw/zinc/61/38/06/1050613806.db2.gz LWNVSXIOBXRMEI-LLVKDONJSA-N 1 2 323.770 4.313 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1c(F)cc(O)cc1F ZINC001144555132 1050614910 /nfs/dbraw/zinc/61/49/10/1050614910.db2.gz WQGRLMNXVYEXOF-QGZVFWFLSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1c(F)cc(O)cc1F ZINC001144555132 1050614917 /nfs/dbraw/zinc/61/49/17/1050614917.db2.gz WQGRLMNXVYEXOF-QGZVFWFLSA-N 1 2 319.351 4.016 20 0 DIADLO Oc1cc(F)c(C[NH+]2CCC(c3ccc(F)cc3)CC2)c(F)c1 ZINC001144555076 1050615013 /nfs/dbraw/zinc/61/50/13/1050615013.db2.gz UGGOVZDCOYATRH-UHFFFAOYSA-N 1 2 321.342 4.189 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2c(F)ccc(F)c2F)cc1F ZINC001241049569 1050617176 /nfs/dbraw/zinc/61/71/76/1050617176.db2.gz YHDAJVXHRJAJAJ-UHFFFAOYSA-N 1 2 301.258 4.111 20 0 DIADLO Clc1nccc(CNc2ccc(-n3cc[nH+]c3)cc2)c1Cl ZINC000787775462 1050622624 /nfs/dbraw/zinc/62/26/24/1050622624.db2.gz YCADFJXVSKKHIT-UHFFFAOYSA-N 1 2 319.195 4.186 20 0 DIADLO CC[C@@H](Nc1cc(C(=O)OC)cc2[nH+]c[nH]c21)c1ccccc1C ZINC001171199998 1050624217 /nfs/dbraw/zinc/62/42/17/1050624217.db2.gz NZGDUNOOSNEZBH-OAHLLOKOSA-N 1 2 323.396 4.221 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1cc(C)ns1 ZINC000787796971 1050624304 /nfs/dbraw/zinc/62/43/04/1050624304.db2.gz SMWHLMLJXOWPAA-UHFFFAOYSA-N 1 2 306.822 4.087 20 0 DIADLO CC[C@@]1(C)CCC[C@H]1[NH2+]c1ccc(N2CCC(O)CC2)cc1 ZINC000845916537 1050630332 /nfs/dbraw/zinc/63/03/32/1050630332.db2.gz WUEHQBUOWSVOGD-MOPGFXCFSA-N 1 2 302.462 4.028 20 0 DIADLO COc1cccc(C(F)(F)F)c1Nc1cccc2[nH+]ccn21 ZINC001213339502 1050634146 /nfs/dbraw/zinc/63/41/46/1050634146.db2.gz MIQGKFSSJIFDJY-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(F)c(O)cc2F)c1 ZINC001144657900 1050641825 /nfs/dbraw/zinc/64/18/25/1050641825.db2.gz MLMUYYXJTSXKPJ-KRWDZBQOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2cc(F)c(O)cc2F)c1 ZINC001144657900 1050641827 /nfs/dbraw/zinc/64/18/27/1050641827.db2.gz MLMUYYXJTSXKPJ-KRWDZBQOSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2ccc(Cl)nc2Cl)s1 ZINC000788022257 1050646175 /nfs/dbraw/zinc/64/61/75/1050646175.db2.gz ARKPMQRWKLSYNI-UHFFFAOYSA-N 1 2 316.257 4.178 20 0 DIADLO CCCOC(=O)[C@@H](c1cccc(C(F)(F)F)c1)[NH+](CC)CC ZINC000741027312 1050646526 /nfs/dbraw/zinc/64/65/26/1050646526.db2.gz XJKZTEBJKQOKST-CQSZACIVSA-N 1 2 317.351 4.042 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cc(F)c(O)cc1F ZINC001144659330 1050648663 /nfs/dbraw/zinc/64/86/63/1050648663.db2.gz DMHVAQSBMCUINO-KRWDZBQOSA-N 1 2 303.352 4.180 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(F)c(O)cc1F ZINC001144659330 1050648671 /nfs/dbraw/zinc/64/86/71/1050648671.db2.gz DMHVAQSBMCUINO-KRWDZBQOSA-N 1 2 303.352 4.180 20 0 DIADLO CC[N@H+](Cc1cccc(Cl)c1)Cc1cc(F)c(O)cc1F ZINC001144659515 1050649601 /nfs/dbraw/zinc/64/96/01/1050649601.db2.gz LLGDSQMMUSCJJJ-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC[N@@H+](Cc1cccc(Cl)c1)Cc1cc(F)c(O)cc1F ZINC001144659515 1050649604 /nfs/dbraw/zinc/64/96/04/1050649604.db2.gz LLGDSQMMUSCJJJ-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC(C)(C)CCCCCC(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC001144684113 1050658290 /nfs/dbraw/zinc/65/82/90/1050658290.db2.gz YMPKLKUKWJUZSP-UHFFFAOYSA-N 1 2 305.466 4.112 20 0 DIADLO CC(C)(C)CCCCCC(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC001144684113 1050658299 /nfs/dbraw/zinc/65/82/99/1050658299.db2.gz YMPKLKUKWJUZSP-UHFFFAOYSA-N 1 2 305.466 4.112 20 0 DIADLO Clc1ccc(C[NH2+]Cc2occc2Br)s1 ZINC000227365365 1050663566 /nfs/dbraw/zinc/66/35/66/1050663566.db2.gz SMHPZLWYGHROFD-UHFFFAOYSA-N 1 2 306.612 4.047 20 0 DIADLO Cc1nc(Cl)nc(Cl)c1Nc1cc(C2CC2)c[nH+]c1C ZINC001213491420 1050669553 /nfs/dbraw/zinc/66/95/53/1050669553.db2.gz JKSQZNKDFCPSQB-UHFFFAOYSA-N 1 2 309.200 4.416 20 0 DIADLO Cc1cc(Nc2cc(C3CC3)c[nH+]c2C)cc(Br)n1 ZINC001213495237 1050670424 /nfs/dbraw/zinc/67/04/24/1050670424.db2.gz XLELVXJFOPITPM-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2nnc(C(C)(C)C)n2c1 ZINC001213496875 1050671874 /nfs/dbraw/zinc/67/18/74/1050671874.db2.gz BMPHBKQYBQQMKN-UHFFFAOYSA-N 1 2 321.428 4.351 20 0 DIADLO COc1cc(OC)c(F)c(Nc2cc(C3CC3)c[nH+]c2C)c1F ZINC001213497520 1050671894 /nfs/dbraw/zinc/67/18/94/1050671894.db2.gz SOIGHEOFGPYMNX-UHFFFAOYSA-N 1 2 320.339 4.306 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(O)cc1Br ZINC001213501366 1050674390 /nfs/dbraw/zinc/67/43/90/1050674390.db2.gz VHGLGTXNCHUEBZ-UHFFFAOYSA-N 1 2 319.202 4.479 20 0 DIADLO COc1ccccc1Cn1nc(C)cc1Nc1c[nH+]c(C)cc1C ZINC001213505821 1050674777 /nfs/dbraw/zinc/67/47/77/1050674777.db2.gz QLTUPWSJMVHNAA-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO CCOC(=O)c1ccc(Nc2cc(C3CC3)c[nH+]c2C)cc1F ZINC001213503647 1050674847 /nfs/dbraw/zinc/67/48/47/1050674847.db2.gz QOVPOIVNVBKWQY-UHFFFAOYSA-N 1 2 314.360 4.327 20 0 DIADLO COC(=O)c1cccc(Nc2cc(C3CC3)c[nH+]c2C)c1Cl ZINC001213503479 1050674983 /nfs/dbraw/zinc/67/49/83/1050674983.db2.gz ISXQSDCIJKXZBL-UHFFFAOYSA-N 1 2 316.788 4.451 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2c(c1)C[C@@H](C)C(=O)N2C ZINC001213503418 1050675118 /nfs/dbraw/zinc/67/51/18/1050675118.db2.gz FASGICLKLGSUJP-GFCCVEGCSA-N 1 2 321.424 4.166 20 0 DIADLO Cc1cc(C)c(Nc2ccc(C(=O)NC3CCCC3)cc2)c[nH+]1 ZINC001213515885 1050676293 /nfs/dbraw/zinc/67/62/93/1050676293.db2.gz QUWIFDMLFBTXFY-UHFFFAOYSA-N 1 2 309.413 4.114 20 0 DIADLO Cc1nc([C@H]([NH2+][C@@H](C)C2CCCC2)c2ccc(Cl)cc2)no1 ZINC000179894690 1050676232 /nfs/dbraw/zinc/67/62/32/1050676232.db2.gz DPQAXADHENLJDF-MEDUHNTESA-N 1 2 319.836 4.289 20 0 DIADLO Cc1cc(Nc2c[nH+]c(C)cc2C)n(Cc2ccccc2F)n1 ZINC001213510946 1050676581 /nfs/dbraw/zinc/67/65/81/1050676581.db2.gz NPOGIUKOOAYSNS-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO CCc1ncc(Br)cc1Nc1c[nH+]c(C)cc1C ZINC001213511127 1050677461 /nfs/dbraw/zinc/67/74/61/1050677461.db2.gz XWRDDLQAHIHODQ-UHFFFAOYSA-N 1 2 306.207 4.162 20 0 DIADLO Cc1cnn(Cc2ccccc2F)c1Nc1c[nH+]c(C)cc1C ZINC001213510962 1050677471 /nfs/dbraw/zinc/67/74/71/1050677471.db2.gz OPDDRNKYGRFLJI-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO Cc1cc(C)c(Nc2cc(C(C)(C)C)nn2-c2cccnc2)c[nH+]1 ZINC001213510505 1050677532 /nfs/dbraw/zinc/67/75/32/1050677532.db2.gz DILFXXUMECMZEL-UHFFFAOYSA-N 1 2 321.428 4.320 20 0 DIADLO CCOC(=O)c1ccc2c(cccc2Nc2c[nH+]c(C)cc2C)n1 ZINC001213521009 1050678511 /nfs/dbraw/zinc/67/85/11/1050678511.db2.gz OKDPBJRVFOBKDP-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO Cc1c[nH+]cc(Nc2cc(C)c(Br)c(C)n2)c1C ZINC001213523310 1050679140 /nfs/dbraw/zinc/67/91/40/1050679140.db2.gz POEOVJGOXNUYGK-UHFFFAOYSA-N 1 2 306.207 4.216 20 0 DIADLO Cc1cc(C)c(Nc2ccc3c(c2)C(C)(C)CC(=O)N3C)c[nH+]1 ZINC001213521073 1050680199 /nfs/dbraw/zinc/68/01/99/1050680199.db2.gz RXFUKQRDUJTGLI-UHFFFAOYSA-N 1 2 309.413 4.086 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc3cnn([C@@H]4CCCCO4)c3c2)c1C ZINC001213530877 1050681810 /nfs/dbraw/zinc/68/18/10/1050681810.db2.gz PICVWXKQESBYGF-IBGZPJMESA-N 1 2 322.412 4.491 20 0 DIADLO CCOC(=O)Cc1ccc(Nc2c[nH+]cc(C)c2C)c(Cl)c1 ZINC001213534020 1050682089 /nfs/dbraw/zinc/68/20/89/1050682089.db2.gz IDUHRDIAGTVEIG-UHFFFAOYSA-N 1 2 318.804 4.201 20 0 DIADLO Cc1ccc(C[S@@](=O)Cc2cccc(C(C)C)c2)c(C)[nH+]1 ZINC000596037868 1050683244 /nfs/dbraw/zinc/68/32/44/1050683244.db2.gz OJELPAQDAVGPHF-NRFANRHFSA-N 1 2 301.455 4.271 20 0 DIADLO COCc1ccc(C)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001213576741 1050687291 /nfs/dbraw/zinc/68/72/91/1050687291.db2.gz VFLGRSRQGFDEHF-UHFFFAOYSA-N 1 2 307.397 4.130 20 0 DIADLO CC[C@@H](Nc1cc(CC(=O)OC)cc[nH+]1)c1cccc(Cl)c1 ZINC000596143938 1050688678 /nfs/dbraw/zinc/68/86/78/1050688678.db2.gz XEDMBBDXOVFUJT-OAHLLOKOSA-N 1 2 318.804 4.014 20 0 DIADLO C[C@H]([NH2+]CCN1CCC[C@@H]1C)c1cc(Cl)sc1Cl ZINC000766271929 1050689517 /nfs/dbraw/zinc/68/95/17/1050689517.db2.gz HIFOQNFPVCGTOE-UWVGGRQHSA-N 1 2 307.290 4.190 20 0 DIADLO c1ccc(N2CCCC2)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001213602081 1050693128 /nfs/dbraw/zinc/69/31/28/1050693128.db2.gz ULELMIVNOXHLON-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@H]3CCCc4ccc(O)cc43)ccc21 ZINC000788730007 1050735564 /nfs/dbraw/zinc/73/55/64/1050735564.db2.gz WGUSALZZKLPLEP-IBGZPJMESA-N 1 2 308.425 4.264 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@H]3CCCc4ccc(O)cc43)ccc21 ZINC000788730007 1050735578 /nfs/dbraw/zinc/73/55/78/1050735578.db2.gz WGUSALZZKLPLEP-IBGZPJMESA-N 1 2 308.425 4.264 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc4[nH]c(=O)ccc4c3)ccc12 ZINC001213780090 1050736884 /nfs/dbraw/zinc/73/68/84/1050736884.db2.gz USXBYSHBRSKZQU-UHFFFAOYSA-N 1 2 301.349 4.128 20 0 DIADLO CCn1ncnc1C[NH2+][C@@H](C)c1ccccc1SC(C)(C)C ZINC000788803832 1050748003 /nfs/dbraw/zinc/74/80/03/1050748003.db2.gz HPKLTBVQZRPFBP-ZDUSSCGKSA-N 1 2 318.490 4.039 20 0 DIADLO CC(C)c1ccccc1CNc1cc(CSCCO)cc[nH+]1 ZINC000846775760 1050750038 /nfs/dbraw/zinc/75/00/38/1050750038.db2.gz VDRDESFIYIGTHX-UHFFFAOYSA-N 1 2 316.470 4.043 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cnc(Cl)c(F)c2)cc1 ZINC000846769103 1050753517 /nfs/dbraw/zinc/75/35/17/1050753517.db2.gz WJUMGPLKTRCWFQ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cnc(Cl)c(F)c2)cc1 ZINC000846769103 1050753530 /nfs/dbraw/zinc/75/35/30/1050753530.db2.gz WJUMGPLKTRCWFQ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1cc(Cl)nc(C[NH2+][C@@H]2COCc3cccc(Cl)c32)c1 ZINC000788825274 1050759575 /nfs/dbraw/zinc/75/95/75/1050759575.db2.gz XVCPLONDOYFXFW-CQSZACIVSA-N 1 2 323.223 4.058 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cnsn1)c1cccc(C(F)(F)F)c1 ZINC000846845520 1050769935 /nfs/dbraw/zinc/76/99/35/1050769935.db2.gz XVHJOFXIMFPYDB-CYBMUJFWSA-N 1 2 315.364 4.044 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2cnsn2)C2CCCC2)cc1 ZINC000846845612 1050770493 /nfs/dbraw/zinc/77/04/93/1050770493.db2.gz ZPPQCDXIEQEJLQ-HNNXBMFYSA-N 1 2 307.850 4.213 20 0 DIADLO CC/C(=C\C(=O)Nc1cccc2[nH+]ccn21)c1ccc(C)cc1 ZINC000741970294 1050789546 /nfs/dbraw/zinc/78/95/46/1050789546.db2.gz YFQQWCJASRCNEV-FYWRMAATSA-N 1 2 305.381 4.075 20 0 DIADLO OCc1c(F)cc(Nc2ccc([NH+]3CCCCC3)cc2)cc1F ZINC001214035151 1050801719 /nfs/dbraw/zinc/80/17/19/1050801719.db2.gz VYYGRBVNKBYIED-UHFFFAOYSA-N 1 2 318.367 4.191 20 0 DIADLO CC(C)C[N@H+](C)Cn1nc(-c2ccc(Cl)s2)oc1=S ZINC000742146834 1050803580 /nfs/dbraw/zinc/80/35/80/1050803580.db2.gz ODQWDEDMOISDPD-UHFFFAOYSA-N 1 2 317.867 4.133 20 0 DIADLO CC(C)C[N@@H+](C)Cn1nc(-c2ccc(Cl)s2)oc1=S ZINC000742146834 1050803592 /nfs/dbraw/zinc/80/35/92/1050803592.db2.gz ODQWDEDMOISDPD-UHFFFAOYSA-N 1 2 317.867 4.133 20 0 DIADLO CC(C)(C)c1nn(C[N@@H+]2CCC3(C2)CCCCC3)c(=S)o1 ZINC000742165087 1050805254 /nfs/dbraw/zinc/80/52/54/1050805254.db2.gz KJLQSGPSLOAFSF-UHFFFAOYSA-N 1 2 309.479 4.117 20 0 DIADLO CC(C)(C)c1nn(C[N@H+]2CCC3(C2)CCCCC3)c(=S)o1 ZINC000742165087 1050805261 /nfs/dbraw/zinc/80/52/61/1050805261.db2.gz KJLQSGPSLOAFSF-UHFFFAOYSA-N 1 2 309.479 4.117 20 0 DIADLO CCSc1nn(C[N@@H+]2C[C@H](C)CCC[C@H]2C)c(=S)s1 ZINC000742154453 1050806023 /nfs/dbraw/zinc/80/60/23/1050806023.db2.gz JRSDVFFTCUSROR-GHMZBOCLSA-N 1 2 317.549 4.254 20 0 DIADLO CCSc1nn(C[N@H+]2C[C@H](C)CCC[C@H]2C)c(=S)s1 ZINC000742154453 1050806038 /nfs/dbraw/zinc/80/60/38/1050806038.db2.gz JRSDVFFTCUSROR-GHMZBOCLSA-N 1 2 317.549 4.254 20 0 DIADLO Cc1nn(C[N@@H+]2CCC[C@H]2c2cccc(C)c2C)c(=S)s1 ZINC000742153788 1050806443 /nfs/dbraw/zinc/80/64/43/1050806443.db2.gz YWIUZGZUKPMIII-HNNXBMFYSA-N 1 2 319.499 4.394 20 0 DIADLO Cc1nn(C[N@H+]2CCC[C@H]2c2cccc(C)c2C)c(=S)s1 ZINC000742153788 1050806458 /nfs/dbraw/zinc/80/64/58/1050806458.db2.gz YWIUZGZUKPMIII-HNNXBMFYSA-N 1 2 319.499 4.394 20 0 DIADLO Cc1noc([C@H](C)[N@H+](C)Cc2ccc3oc4ccccc4c3c2)n1 ZINC000847054327 1050807154 /nfs/dbraw/zinc/80/71/54/1050807154.db2.gz PXYASVWDLXRZHX-LBPRGKRZSA-N 1 2 321.380 4.470 20 0 DIADLO Cc1noc([C@H](C)[N@@H+](C)Cc2ccc3oc4ccccc4c3c2)n1 ZINC000847054327 1050807167 /nfs/dbraw/zinc/80/71/67/1050807167.db2.gz PXYASVWDLXRZHX-LBPRGKRZSA-N 1 2 321.380 4.470 20 0 DIADLO C[C@H]([NH2+]C1(c2ccccc2Cl)CC1)c1cn2ccccc2n1 ZINC000655779879 1050819001 /nfs/dbraw/zinc/81/90/01/1050819001.db2.gz SZPFPXPWGXLJBA-ZDUSSCGKSA-N 1 2 311.816 4.328 20 0 DIADLO CC(C)C[C@@H](C(=O)N1CCC[C@H](C(C)(C)C)CC1)n1cc[nH+]c1 ZINC001146669294 1050835503 /nfs/dbraw/zinc/83/55/03/1050835503.db2.gz MOCSKWMOXKPDOW-IRXDYDNUSA-N 1 2 319.493 4.145 20 0 DIADLO CCCc1cc(N[C@H]2COCc3ccccc32)nc(CCC)[nH+]1 ZINC001171292789 1050853443 /nfs/dbraw/zinc/85/34/43/1050853443.db2.gz ZGFCQVMFAAVCEE-KRWDZBQOSA-N 1 2 311.429 4.065 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3cc(C)cc(F)c3)c2)[nH+]c1C ZINC000742577607 1050892500 /nfs/dbraw/zinc/89/25/00/1050892500.db2.gz IUYYSAMVWLTQCQ-UHFFFAOYSA-N 1 2 323.371 4.393 20 0 DIADLO O=C(Nc1ccsc1)[C@H]1CCC[N@H+]1Cc1ccc(Cl)cc1 ZINC001147765455 1050899646 /nfs/dbraw/zinc/89/96/46/1050899646.db2.gz UMYDJZSNOONEPD-OAHLLOKOSA-N 1 2 320.845 4.005 20 0 DIADLO O=C(Nc1ccsc1)[C@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1 ZINC001147765455 1050899654 /nfs/dbraw/zinc/89/96/54/1050899654.db2.gz UMYDJZSNOONEPD-OAHLLOKOSA-N 1 2 320.845 4.005 20 0 DIADLO CCCCCC[C@](C)(CC)C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000742627194 1050905713 /nfs/dbraw/zinc/90/57/13/1050905713.db2.gz HAOUVTIIVQNUJC-IBGZPJMESA-N 1 2 318.461 4.058 20 0 DIADLO Cc1ncc(CCNc2cc(C(C)C)[nH+]c(C(C)C)n2)s1 ZINC000761239600 1050912716 /nfs/dbraw/zinc/91/27/16/1050912716.db2.gz GVXMBROJBHITPR-UHFFFAOYSA-N 1 2 304.463 4.143 20 0 DIADLO c1cn(-c2ccc(CSC3=Nc4ccccc4C3)cc2)c[nH+]1 ZINC000790269009 1050937722 /nfs/dbraw/zinc/93/77/22/1050937722.db2.gz SRFKEUSJSCPSOT-UHFFFAOYSA-N 1 2 305.406 4.392 20 0 DIADLO Oc1ccc(Cl)c(Nc2ccc[nH+]c2N2CCCCC2)c1F ZINC001214553805 1050940130 /nfs/dbraw/zinc/94/01/30/1050940130.db2.gz AJJJJRDGXPPUSM-UHFFFAOYSA-N 1 2 321.783 4.314 20 0 DIADLO O[C@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2F)C2(CCC2)C1 ZINC001171333353 1050953520 /nfs/dbraw/zinc/95/35/20/1050953520.db2.gz VQRVYGCTMYGLLF-LBPRGKRZSA-N 1 2 318.219 4.012 20 0 DIADLO O[C@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C2(CCC2)C1 ZINC001171333353 1050953532 /nfs/dbraw/zinc/95/35/32/1050953532.db2.gz VQRVYGCTMYGLLF-LBPRGKRZSA-N 1 2 318.219 4.012 20 0 DIADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1c(Cl)cccc1OC ZINC000790699856 1050987441 /nfs/dbraw/zinc/98/74/41/1050987441.db2.gz ZTGGYMFQKUHRIB-SNVBAGLBSA-N 1 2 308.809 4.058 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2nnc(-c3cccs3)o2)c(C)o1 ZINC000348105461 1050987892 /nfs/dbraw/zinc/98/78/92/1050987892.db2.gz DCQXCBYKVYCMEC-MNOVXSKESA-N 1 2 317.414 4.420 20 0 DIADLO Cc1[nH+]ccn1-c1ccc(Nc2ccc(Cl)c(O)c2F)cc1 ZINC001214799593 1051005858 /nfs/dbraw/zinc/00/58/58/1051005858.db2.gz ZVEWEBBHSDGPOL-UHFFFAOYSA-N 1 2 317.751 4.422 20 0 DIADLO OCc1cc(Nc2[nH+]cccc2C2CC2)ccc1OC(F)(F)F ZINC001214828736 1051011092 /nfs/dbraw/zinc/01/10/92/1051011092.db2.gz JDJAAKRVMVZCTM-UHFFFAOYSA-N 1 2 324.302 4.094 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H](Cc1ccccc1)c1cccs1 ZINC000180903875 1051018545 /nfs/dbraw/zinc/01/85/45/1051018545.db2.gz KGFBUHHPYVBECN-SUMWQHHRSA-N 1 2 311.454 4.414 20 0 DIADLO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cn1nnc2ccccc2c1=S ZINC000743379454 1051022337 /nfs/dbraw/zinc/02/23/37/1051022337.db2.gz PAGQMAHIHWPOMY-BBRMVZONSA-N 1 2 316.474 4.019 20 0 DIADLO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cn1nnc2ccccc2c1=S ZINC000743379454 1051022348 /nfs/dbraw/zinc/02/23/48/1051022348.db2.gz PAGQMAHIHWPOMY-BBRMVZONSA-N 1 2 316.474 4.019 20 0 DIADLO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cn1nnc2ccccc2c1=S ZINC000743379456 1051023178 /nfs/dbraw/zinc/02/31/78/1051023178.db2.gz PAGQMAHIHWPOMY-CZUORRHYSA-N 1 2 316.474 4.019 20 0 DIADLO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cn1nnc2ccccc2c1=S ZINC000743379456 1051023187 /nfs/dbraw/zinc/02/31/87/1051023187.db2.gz PAGQMAHIHWPOMY-CZUORRHYSA-N 1 2 316.474 4.019 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1cccnc1Cl ZINC000773061418 1051043960 /nfs/dbraw/zinc/04/39/60/1051043960.db2.gz XOXHLRFWOXOBKY-TVQRCGJNSA-N 1 2 309.196 4.173 20 0 DIADLO OCc1ccc(Nc2ccc([NH+]3CCCCC3)cc2)c(F)c1F ZINC001215034960 1051057182 /nfs/dbraw/zinc/05/71/82/1051057182.db2.gz ISCFMUOKCNAWFC-UHFFFAOYSA-N 1 2 318.367 4.191 20 0 DIADLO CC(C)Oc1ccc(F)c(F)c1Nc1ccn2cc[nH+]c2c1 ZINC001215076426 1051071786 /nfs/dbraw/zinc/07/17/86/1051071786.db2.gz NCNMZRKQAQAHCS-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO C[C@@H]([NH2+]Cc1cnn(C)c1Cl)c1ccc(Cl)cc1Cl ZINC000712470187 1051076075 /nfs/dbraw/zinc/07/60/75/1051076075.db2.gz SJDHWBOZEKPVRG-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO COCOc1cc(C)c(Nc2ccc(-n3cc[nH+]c3)cc2)c(C)c1 ZINC001215163963 1051095295 /nfs/dbraw/zinc/09/52/95/1051095295.db2.gz SJNRCMGESZUFQJ-UHFFFAOYSA-N 1 2 323.396 4.215 20 0 DIADLO CCOc1cc[nH+]cc1Nc1c(F)ccc(OC(C)C)c1F ZINC001215173102 1051101044 /nfs/dbraw/zinc/10/10/44/1051101044.db2.gz QKVCGDMEPSRFKU-UHFFFAOYSA-N 1 2 308.328 4.289 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(OC(F)(F)F)c(Cl)c1 ZINC000401186972 1051114691 /nfs/dbraw/zinc/11/46/91/1051114691.db2.gz ADKYGILLUBWGQJ-UHFFFAOYSA-N 1 2 319.714 4.067 20 0 DIADLO COc1c(F)ccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c1Cl ZINC001241498564 1051116539 /nfs/dbraw/zinc/11/65/39/1051116539.db2.gz QYNZQVXPMVXREX-UHFFFAOYSA-N 1 2 320.673 4.151 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cn1cc(-c2ccccc2)cn1 ZINC000744130371 1051118439 /nfs/dbraw/zinc/11/84/39/1051118439.db2.gz JUJDINBZMKFONH-AWEZNQCLSA-N 1 2 309.438 4.188 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cn1cc(-c2ccccc2)cn1 ZINC000744130371 1051118445 /nfs/dbraw/zinc/11/84/45/1051118445.db2.gz JUJDINBZMKFONH-AWEZNQCLSA-N 1 2 309.438 4.188 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cn2ccc(C(F)(F)F)n2)c1 ZINC000744141462 1051120433 /nfs/dbraw/zinc/12/04/33/1051120433.db2.gz LRGJFKOBTWMXOW-CQSZACIVSA-N 1 2 309.335 4.005 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cn2ccc(C(F)(F)F)n2)c1 ZINC000744141462 1051120440 /nfs/dbraw/zinc/12/04/40/1051120440.db2.gz LRGJFKOBTWMXOW-CQSZACIVSA-N 1 2 309.335 4.005 20 0 DIADLO Cc1cccc(F)c1-c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001215286395 1051151205 /nfs/dbraw/zinc/15/12/05/1051151205.db2.gz FHSJNJMVPGULTP-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CC(=O)CC(C)(C)Nc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1 ZINC001171502290 1051155722 /nfs/dbraw/zinc/15/57/22/1051155722.db2.gz DWPFDSISONPXAF-UHFFFAOYSA-N 1 2 307.397 4.400 20 0 DIADLO CC(C)(Nc1cc2c3c(c1)CCC[NH+]3CCC2)c1ccncc1 ZINC001171517355 1051160486 /nfs/dbraw/zinc/16/04/86/1051160486.db2.gz SUMYWMSDALOMNO-UHFFFAOYSA-N 1 2 307.441 4.128 20 0 DIADLO CC[C@H]1C[C@@H](C)C[N@@H+]1Cn1nc(-c2cccs2)oc1=S ZINC000744443765 1051176807 /nfs/dbraw/zinc/17/68/07/1051176807.db2.gz OHNYGRZZAHGDRN-MNOVXSKESA-N 1 2 309.460 4.012 20 0 DIADLO CC[C@H]1C[C@@H](C)C[N@H+]1Cn1nc(-c2cccs2)oc1=S ZINC000744443765 1051176812 /nfs/dbraw/zinc/17/68/12/1051176812.db2.gz OHNYGRZZAHGDRN-MNOVXSKESA-N 1 2 309.460 4.012 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2[C@@H](C)Cc2ccccc2Cl)no1 ZINC001170286306 1051181849 /nfs/dbraw/zinc/18/18/49/1051181849.db2.gz XNPGFRLYTWXXSY-BLLLJJGKSA-N 1 2 319.836 4.190 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2[C@@H](C)Cc2ccccc2Cl)no1 ZINC001170286306 1051181854 /nfs/dbraw/zinc/18/18/54/1051181854.db2.gz XNPGFRLYTWXXSY-BLLLJJGKSA-N 1 2 319.836 4.190 20 0 DIADLO CC1(C)CC(Nc2cc(-c3ccncc3)cc[nH+]2)CC(C)(C)O1 ZINC001170360098 1051189185 /nfs/dbraw/zinc/18/91/85/1051189185.db2.gz RDJNELRLZMSVNK-UHFFFAOYSA-N 1 2 311.429 4.292 20 0 DIADLO C[C@@H]([NH2+]Cc1noc2c1CCCC2)c1cccc(C(F)(F)F)c1 ZINC000181606857 1051189782 /nfs/dbraw/zinc/18/97/82/1051189782.db2.gz JDJWGKXFUVLKDO-LLVKDONJSA-N 1 2 324.346 4.423 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2cccc(C(F)(F)F)c2)[C@H](CC)CO1 ZINC001171778812 1051213288 /nfs/dbraw/zinc/21/32/88/1051213288.db2.gz PUNBDDIWVKODMR-HUUCEWRRSA-N 1 2 301.352 4.095 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2)[C@H](CC)CO1 ZINC001171778812 1051213292 /nfs/dbraw/zinc/21/32/92/1051213292.db2.gz PUNBDDIWVKODMR-HUUCEWRRSA-N 1 2 301.352 4.095 20 0 DIADLO C[C@@H](c1noc(-c2ccccc2)n1)[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000792862165 1051217715 /nfs/dbraw/zinc/21/77/15/1051217715.db2.gz KKERTOZHCPJBFY-CABCVRRESA-N 1 2 319.408 4.417 20 0 DIADLO C[C@@H](c1noc(-c2ccccc2)n1)[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000792862165 1051217725 /nfs/dbraw/zinc/21/77/25/1051217725.db2.gz KKERTOZHCPJBFY-CABCVRRESA-N 1 2 319.408 4.417 20 0 DIADLO CC[C@@H](OC(=O)[C@H](c1ccccc1)[N@H+](C)CC)c1ccccc1 ZINC000745098697 1051221718 /nfs/dbraw/zinc/22/17/18/1051221718.db2.gz UZCBRLUQKPLCDF-MOPGFXCFSA-N 1 2 311.425 4.374 20 0 DIADLO CC[C@@H](OC(=O)[C@H](c1ccccc1)[N@@H+](C)CC)c1ccccc1 ZINC000745098697 1051221728 /nfs/dbraw/zinc/22/17/28/1051221728.db2.gz UZCBRLUQKPLCDF-MOPGFXCFSA-N 1 2 311.425 4.374 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cs1 ZINC000792897484 1051222404 /nfs/dbraw/zinc/22/24/04/1051222404.db2.gz BXBSEDHIGOEIDZ-YPMHNXCESA-N 1 2 319.301 4.282 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cs1 ZINC000792897484 1051222420 /nfs/dbraw/zinc/22/24/20/1051222420.db2.gz BXBSEDHIGOEIDZ-YPMHNXCESA-N 1 2 319.301 4.282 20 0 DIADLO CCCOc1ccc([C@H](C)[NH2+]Cc2cocn2)cc1OCCC ZINC000182068684 1051225010 /nfs/dbraw/zinc/22/50/10/1051225010.db2.gz DMPZRVWQCIQNNO-AWEZNQCLSA-N 1 2 318.417 4.103 20 0 DIADLO Fc1ccc([C@H]2CC[N@@H+]2Cc2ccc3c(c2)OC(F)(F)O3)cc1 ZINC001171847084 1051232384 /nfs/dbraw/zinc/23/23/84/1051232384.db2.gz IOXILPXPPKFETK-CQSZACIVSA-N 1 2 321.298 4.094 20 0 DIADLO Fc1ccc([C@H]2CC[N@H+]2Cc2ccc3c(c2)OC(F)(F)O3)cc1 ZINC001171847084 1051232395 /nfs/dbraw/zinc/23/23/95/1051232395.db2.gz IOXILPXPPKFETK-CQSZACIVSA-N 1 2 321.298 4.094 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1ccc2c(c1)CCC2 ZINC001204080133 1051256306 /nfs/dbraw/zinc/25/63/06/1051256306.db2.gz YXWPTDAQWRUHJS-UHFFFAOYSA-N 1 2 311.816 4.328 20 0 DIADLO Oc1cc(C(F)(F)F)ccc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001212632566 1051259055 /nfs/dbraw/zinc/25/90/55/1051259055.db2.gz IGQZWYPVEMRDKN-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO Clc1cccc(C2=CC[N@H+](Cc3coc(C4CC4)n3)CC2)c1 ZINC000793297536 1051278304 /nfs/dbraw/zinc/27/83/04/1051278304.db2.gz QWUBTEWEUGLGRY-UHFFFAOYSA-N 1 2 314.816 4.495 20 0 DIADLO Clc1cccc(C2=CC[N@@H+](Cc3coc(C4CC4)n3)CC2)c1 ZINC000793297536 1051278314 /nfs/dbraw/zinc/27/83/14/1051278314.db2.gz QWUBTEWEUGLGRY-UHFFFAOYSA-N 1 2 314.816 4.495 20 0 DIADLO Cc1cc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)sc1C ZINC001212641648 1051288815 /nfs/dbraw/zinc/28/88/15/1051288815.db2.gz HXMSMPVOVZQFRG-UHFFFAOYSA-N 1 2 322.393 4.268 20 0 DIADLO Cc1cc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)sc1C ZINC001212641900 1051293631 /nfs/dbraw/zinc/29/36/31/1051293631.db2.gz XBGJAMYJMLOGQR-UHFFFAOYSA-N 1 2 322.393 4.268 20 0 DIADLO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]c2ccc(N(C)C)cc2)cc1 ZINC000793541246 1051313657 /nfs/dbraw/zinc/31/36/57/1051313657.db2.gz CZEQQJGMDULAFB-VHKYSDTDSA-N 1 2 310.441 4.365 20 0 DIADLO COc1ccc([C@H]2C[C@@H]2[C@H](C)Nc2ccc([NH+](C)C)cc2)cc1 ZINC000793541246 1051313665 /nfs/dbraw/zinc/31/36/65/1051313665.db2.gz CZEQQJGMDULAFB-VHKYSDTDSA-N 1 2 310.441 4.365 20 0 DIADLO COc1ncc([C@H](C)Nc2ccc([NH+](C)C)cc2C)cc1Cl ZINC000793548127 1051315569 /nfs/dbraw/zinc/31/55/69/1051315569.db2.gz SODHZNMVOUVJGP-LBPRGKRZSA-N 1 2 319.836 4.291 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)CC(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000746124773 1051325151 /nfs/dbraw/zinc/32/51/51/1051325151.db2.gz WGVFCQZPBAARSK-CQSZACIVSA-N 1 2 314.429 4.209 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)CC(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000746124773 1051325159 /nfs/dbraw/zinc/32/51/59/1051325159.db2.gz WGVFCQZPBAARSK-CQSZACIVSA-N 1 2 314.429 4.209 20 0 DIADLO CC(C)[N@H+](CC(=O)Nc1ccc2ccccc2c1)Cc1ccco1 ZINC000746115692 1051328492 /nfs/dbraw/zinc/32/84/92/1051328492.db2.gz XQVMICOXSVBMLL-UHFFFAOYSA-N 1 2 322.408 4.282 20 0 DIADLO CC(C)[N@@H+](CC(=O)Nc1ccc2ccccc2c1)Cc1ccco1 ZINC000746115692 1051328497 /nfs/dbraw/zinc/32/84/97/1051328497.db2.gz XQVMICOXSVBMLL-UHFFFAOYSA-N 1 2 322.408 4.282 20 0 DIADLO CCC[N@H+](Cc1ncc(Cl)n1C)[C@@H](C)c1ccccc1OC ZINC000746145795 1051330062 /nfs/dbraw/zinc/33/00/62/1051330062.db2.gz QMAKAWYHOXIDDK-ZDUSSCGKSA-N 1 2 321.852 4.055 20 0 DIADLO CCC[N@@H+](Cc1ncc(Cl)n1C)[C@@H](C)c1ccccc1OC ZINC000746145795 1051330071 /nfs/dbraw/zinc/33/00/71/1051330071.db2.gz QMAKAWYHOXIDDK-ZDUSSCGKSA-N 1 2 321.852 4.055 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1noc2c1CCCC2 ZINC000183535843 1051331054 /nfs/dbraw/zinc/33/10/54/1051331054.db2.gz QAAJNXQWFYPXRU-CYBMUJFWSA-N 1 2 310.397 4.459 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(C3CCOCC3)cc2)[nH+]1 ZINC001212649669 1051333479 /nfs/dbraw/zinc/33/34/79/1051333479.db2.gz RLLMQZUYJNLYCU-UHFFFAOYSA-N 1 2 307.397 4.280 20 0 DIADLO COc1ccc(Nc2ccc([NH+]3CCCCC3)cc2)c2c[nH]nc21 ZINC001215751435 1051344124 /nfs/dbraw/zinc/34/41/24/1051344124.db2.gz KVJPKYKIYKYDTR-UHFFFAOYSA-N 1 2 322.412 4.305 20 0 DIADLO CC(C)Oc1ccc(Nc2[nH+]cccc2N)cc1C(F)(F)F ZINC001215800925 1051377986 /nfs/dbraw/zinc/37/79/86/1051377986.db2.gz TXXHHACMZWUMFL-UHFFFAOYSA-N 1 2 311.307 4.213 20 0 DIADLO CCOCC[C@H](C)[N@@H+]1CC[C@@H](Cc2ccccc2)C(F)(F)C1 ZINC001172430248 1051387161 /nfs/dbraw/zinc/38/71/61/1051387161.db2.gz FTTJLXJTOGYJHN-RDJZCZTQSA-N 1 2 311.416 4.001 20 0 DIADLO CCOCC[C@H](C)[N@H+]1CC[C@@H](Cc2ccccc2)C(F)(F)C1 ZINC001172430248 1051387174 /nfs/dbraw/zinc/38/71/74/1051387174.db2.gz FTTJLXJTOGYJHN-RDJZCZTQSA-N 1 2 311.416 4.001 20 0 DIADLO CCOCC[C@H](C)[N@@H+]1CC[C@H](Cc2ccccc2)C(F)(F)C1 ZINC001172430244 1051387291 /nfs/dbraw/zinc/38/72/91/1051387291.db2.gz FTTJLXJTOGYJHN-DOTOQJQBSA-N 1 2 311.416 4.001 20 0 DIADLO CCOCC[C@H](C)[N@H+]1CC[C@H](Cc2ccccc2)C(F)(F)C1 ZINC001172430244 1051387299 /nfs/dbraw/zinc/38/72/99/1051387299.db2.gz FTTJLXJTOGYJHN-DOTOQJQBSA-N 1 2 311.416 4.001 20 0 DIADLO CC(C)[C@H]1CCC[N@H+](Cn2nc(C3CC3)sc2=S)CC1 ZINC000746380166 1051388577 /nfs/dbraw/zinc/38/85/77/1051388577.db2.gz LPRADKWPROHGON-LBPRGKRZSA-N 1 2 311.520 4.267 20 0 DIADLO CC(C)[C@H]1CCC[N@@H+](Cn2nc(C3CC3)sc2=S)CC1 ZINC000746380166 1051388588 /nfs/dbraw/zinc/38/85/88/1051388588.db2.gz LPRADKWPROHGON-LBPRGKRZSA-N 1 2 311.520 4.267 20 0 DIADLO CCc1ccc([C@H](C)CC(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001129482162 1051402862 /nfs/dbraw/zinc/40/28/62/1051402862.db2.gz RQSFDNBWVIJEIX-CQSZACIVSA-N 1 2 307.397 4.029 20 0 DIADLO C/C(=C/C(=O)Nc1ccn2cc[nH+]c2c1)c1cccc(Cl)c1 ZINC001129479946 1051403081 /nfs/dbraw/zinc/40/30/81/1051403081.db2.gz DIQAPRLXMRDHIX-XFXZXTDPSA-N 1 2 311.772 4.030 20 0 DIADLO Cc1c(F)cccc1-c1noc(-c2cccc(-n3cc[nH+]c3)c2)n1 ZINC001215845594 1051409599 /nfs/dbraw/zinc/40/95/99/1051409599.db2.gz BGSXYIHGOAPHOV-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CC(C)c1ccc(CNc2[nH+]cnc3c2cnn3C(C)(C)C)cc1 ZINC000766402346 1051415256 /nfs/dbraw/zinc/41/52/56/1051415256.db2.gz AUTBEOFEAKAOCB-UHFFFAOYSA-N 1 2 323.444 4.317 20 0 DIADLO O[C@H](CNc1cc[nH+]c2c(Cl)cccc12)c1ccsc1 ZINC000804481007 1051416168 /nfs/dbraw/zinc/41/61/68/1051416168.db2.gz DTDXPYXNRBWKMC-CQSZACIVSA-N 1 2 304.802 4.095 20 0 DIADLO CC[C@H](C)c1ccccc1Nc1ccc(C[NH+]2CC(O)C2)cc1 ZINC001212668462 1051431892 /nfs/dbraw/zinc/43/18/92/1051431892.db2.gz ZLRYLQAEVXDWEM-HNNXBMFYSA-N 1 2 310.441 4.120 20 0 DIADLO CSc1ccc(Cl)cc1-n1c(C)[nH+]c2ccc(N)cc21 ZINC001215913812 1051451183 /nfs/dbraw/zinc/45/11/83/1051451183.db2.gz RPXWDRSOKMPSOS-UHFFFAOYSA-N 1 2 303.818 4.291 20 0 DIADLO Cc1ccc([C@H](C)Nc2cc[nH+]c3[nH]cc(C(F)(F)F)c32)nc1 ZINC001168857242 1051452264 /nfs/dbraw/zinc/45/22/64/1051452264.db2.gz GQHNIPKDCHWVPE-JTQLQIEISA-N 1 2 320.318 4.458 20 0 DIADLO CC[C@@H](CC(=O)Nc1ccn2cc[nH+]c2c1)c1ccc(C)cc1 ZINC001129594864 1051453781 /nfs/dbraw/zinc/45/37/81/1051453781.db2.gz YEDZKSIFFIARAP-HNNXBMFYSA-N 1 2 307.397 4.165 20 0 DIADLO Cc1ccc2sc(C(=O)Nc3ccn4cc[nH+]c4c3)cc2c1 ZINC001129594119 1051454012 /nfs/dbraw/zinc/45/40/12/1051454012.db2.gz MSBSJOLWBWVOPQ-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO CCCCOC(=O)[C@H](C)[NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172543048 1051454762 /nfs/dbraw/zinc/45/47/62/1051454762.db2.gz MBKRYEOWDYLERW-CGTJXYLNSA-N 1 2 303.446 4.034 20 0 DIADLO Cc1ccc2c(cccc2Nc2ccc(C[NH+]3CC(O)C3)cc2)c1 ZINC001212673197 1051476333 /nfs/dbraw/zinc/47/63/33/1051476333.db2.gz GBKTUYLNEJUWLC-UHFFFAOYSA-N 1 2 318.420 4.068 20 0 DIADLO Fc1ccc2c[nH+]c(NCc3ccccc3-n3cccn3)cc2c1 ZINC001168959925 1051479023 /nfs/dbraw/zinc/47/90/23/1051479023.db2.gz KBQZMHLGELUMGQ-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO CN(C)c1ccc(Nc2cnc(F)c(-c3ccccc3)c2)c[nH+]1 ZINC001215957962 1051481896 /nfs/dbraw/zinc/48/18/96/1051481896.db2.gz CNXIGPOPQFBITN-UHFFFAOYSA-N 1 2 308.360 4.092 20 0 DIADLO CC(C)c1cnc(C(C)C)c(NCCc2cn3ccccc3[nH+]2)n1 ZINC001169002153 1051484929 /nfs/dbraw/zinc/48/49/29/1051484929.db2.gz HUZZYKLZNPIIIQ-UHFFFAOYSA-N 1 2 323.444 4.026 20 0 DIADLO FC(F)(F)c1cccc(NCCc2cn3ccccc3[nH+]2)c1 ZINC001169003783 1051485108 /nfs/dbraw/zinc/48/51/08/1051485108.db2.gz FOBXBZYDKZNVDL-UHFFFAOYSA-N 1 2 305.303 4.008 20 0 DIADLO Clc1cccc2cnc(NCCc3cn4ccccc4[nH+]3)cc12 ZINC001169005149 1051485697 /nfs/dbraw/zinc/48/56/97/1051485697.db2.gz YRBOSDHIMDQMRD-UHFFFAOYSA-N 1 2 322.799 4.191 20 0 DIADLO Cc1cc2cc(NCc3ccsc3Br)[nH+]cc2[nH]1 ZINC001169056822 1051499287 /nfs/dbraw/zinc/49/92/87/1051499287.db2.gz AQVDPESTIRJRFH-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO CCOC(CCNc1cc[nH+]c2c(Cl)cccc12)OCC ZINC000804646967 1051511387 /nfs/dbraw/zinc/51/13/87/1051511387.db2.gz ZTCOYFLNDXPDMJ-UHFFFAOYSA-N 1 2 308.809 4.089 20 0 DIADLO CCC[N@H+](CC(=O)OC(C)(C)C)Cc1ccc(Cl)cc1C ZINC001169092544 1051519038 /nfs/dbraw/zinc/51/90/38/1051519038.db2.gz UMJWDHGMCUZYLI-UHFFFAOYSA-N 1 2 311.853 4.202 20 0 DIADLO CCCCN(C(=O)Nc1cc(C)[nH+]cc1C)[C@@H]1CCC[C@@H](C)C1 ZINC001216003157 1051518822 /nfs/dbraw/zinc/51/88/22/1051518822.db2.gz CLKXBTXUXSBWRB-RHSMWYFYSA-N 1 2 317.477 4.333 20 0 DIADLO CCC[N@@H+](CC(=O)OC(C)(C)C)Cc1ccc(Cl)cc1C ZINC001169092544 1051519050 /nfs/dbraw/zinc/51/90/50/1051519050.db2.gz UMJWDHGMCUZYLI-UHFFFAOYSA-N 1 2 311.853 4.202 20 0 DIADLO CC(C)c1ccc(N)c(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001216020868 1051528256 /nfs/dbraw/zinc/52/82/56/1051528256.db2.gz GJEOVXWXGHAQAN-UHFFFAOYSA-N 1 2 306.413 4.381 20 0 DIADLO Nc1ccc(Nc2[nH+]ccc3ccccc32)cc1OC(F)(F)F ZINC001216029817 1051535069 /nfs/dbraw/zinc/53/50/69/1051535069.db2.gz VUXAVLRPXODPHY-UHFFFAOYSA-N 1 2 319.286 4.459 20 0 DIADLO CC(C)c1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)ccc1N ZINC001216044890 1051543825 /nfs/dbraw/zinc/54/38/25/1051543825.db2.gz KAOMOXAYWHUSQU-UHFFFAOYSA-N 1 2 306.413 4.381 20 0 DIADLO Nc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1C(F)(F)F ZINC001216048469 1051547171 /nfs/dbraw/zinc/54/71/71/1051547171.db2.gz CKYXEQCKYWLYPE-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO FC1(F)CCC[C@@H](Nc2cc3c4c(c2)CCC[NH+]4CCC3)C1 ZINC001169217342 1051554838 /nfs/dbraw/zinc/55/48/38/1051554838.db2.gz FRBUWFKGVAPHRE-OAHLLOKOSA-N 1 2 306.400 4.375 20 0 DIADLO FC1(F)CCC[C@@H]([NH2+]c2cc3c4c(c2)CCCN4CCC3)C1 ZINC001169217342 1051554847 /nfs/dbraw/zinc/55/48/47/1051554847.db2.gz FRBUWFKGVAPHRE-OAHLLOKOSA-N 1 2 306.400 4.375 20 0 DIADLO CN(C)c1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC001216061556 1051558365 /nfs/dbraw/zinc/55/83/65/1051558365.db2.gz WMTSOLNPYMDSRU-UHFFFAOYSA-N 1 2 312.804 4.335 20 0 DIADLO Cc1cc(Cl)c(N)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001216091508 1051574811 /nfs/dbraw/zinc/57/48/11/1051574811.db2.gz KSPIYUDEXSRSTL-UHFFFAOYSA-N 1 2 312.804 4.219 20 0 DIADLO Oc1cc(Nc2ccc[nH+]c2N2CCCCC2)ccc1Cl ZINC001212588534 1051579050 /nfs/dbraw/zinc/57/90/50/1051579050.db2.gz SPMDSUFGAMXNQB-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO COc1c(Cl)cccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212695342 1051582274 /nfs/dbraw/zinc/58/22/74/1051582274.db2.gz APDZANMSUHDFOQ-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO c1cn(Cc2ccc(Nc3cnccc3C3CCC3)cc2)c[nH+]1 ZINC001212695147 1051582677 /nfs/dbraw/zinc/58/26/77/1051582677.db2.gz PYIGKOBRMJZHFP-UHFFFAOYSA-N 1 2 304.397 4.338 20 0 DIADLO c1cn(Cc2ccc(Nc3cccc(C4CCC4)n3)cc2)c[nH+]1 ZINC001212695026 1051582787 /nfs/dbraw/zinc/58/27/87/1051582787.db2.gz JUTMMSYINOCICH-UHFFFAOYSA-N 1 2 304.397 4.338 20 0 DIADLO CCc1cc(Nc2ccc([NH+]3CCCCC3)cc2)ccc1CO ZINC001216107391 1051583292 /nfs/dbraw/zinc/58/32/92/1051583292.db2.gz BGTMWGPGEBDSMM-UHFFFAOYSA-N 1 2 310.441 4.475 20 0 DIADLO Cc1c(Cl)cc(N)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212698411 1051586587 /nfs/dbraw/zinc/58/65/87/1051586587.db2.gz RMDFAWGFHSZBAA-UHFFFAOYSA-N 1 2 312.804 4.219 20 0 DIADLO Fc1cncc2cccc(Nc3ccc(Cn4cc[nH+]c4)cc3)c12 ZINC001212699043 1051587014 /nfs/dbraw/zinc/58/70/14/1051587014.db2.gz KTIFNCUHNRFFBU-UHFFFAOYSA-N 1 2 318.355 4.362 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001212700013 1051587090 /nfs/dbraw/zinc/58/70/90/1051587090.db2.gz PCIGMCRTPYZIFJ-UHFFFAOYSA-N 1 2 306.413 4.131 20 0 DIADLO Cc1cc(Cl)c(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1O ZINC001212697915 1051588437 /nfs/dbraw/zinc/58/84/37/1051588437.db2.gz AXFNWXOYBAJYIY-UHFFFAOYSA-N 1 2 313.788 4.342 20 0 DIADLO CC(=O)c1cccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1C ZINC001212698911 1051589028 /nfs/dbraw/zinc/58/90/28/1051589028.db2.gz DASJZCGFIIXCEK-UHFFFAOYSA-N 1 2 305.381 4.186 20 0 DIADLO COC[C@H]([NH2+]Cc1cc(Cl)ccc1Cl)c1ccc(C)o1 ZINC000179012135 1051597691 /nfs/dbraw/zinc/59/76/91/1051597691.db2.gz ZMIJLEUBNQVGJG-AWEZNQCLSA-N 1 2 314.212 4.372 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CCCC2(CCCC2)C1 ZINC001169395303 1051607097 /nfs/dbraw/zinc/60/70/97/1051607097.db2.gz GLGQWCRZRWPOIN-INIZCTEOSA-N 1 2 321.848 4.210 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CCCC2(CCCC2)C1 ZINC001169395303 1051607100 /nfs/dbraw/zinc/60/71/00/1051607100.db2.gz GLGQWCRZRWPOIN-INIZCTEOSA-N 1 2 321.848 4.210 20 0 DIADLO Cc1ccc(CNc2[nH+]c(C)nc3c2ccn3C)c2ccccc12 ZINC001169413751 1051615138 /nfs/dbraw/zinc/61/51/38/1051615138.db2.gz LQNSMZLPHNUULU-UHFFFAOYSA-N 1 2 316.408 4.350 20 0 DIADLO C[C@@H]([NH2+]Cc1cn2ccccc2n1)c1ccc(Cl)cc1Cl ZINC000007049806 1051627658 /nfs/dbraw/zinc/62/76/58/1051627658.db2.gz IMCKAHIZYJEUTE-LLVKDONJSA-N 1 2 320.223 4.492 20 0 DIADLO CSc1ncc(C)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001216242493 1051649271 /nfs/dbraw/zinc/64/92/71/1051649271.db2.gz FYQODHVRYXLFHY-UHFFFAOYSA-N 1 2 310.426 4.100 20 0 DIADLO c1ccc([C@H]2C[C@H](Nc3ccc(N4CCCC4)[nH+]c3)CCO2)cc1 ZINC001169756485 1051692581 /nfs/dbraw/zinc/69/25/81/1051692581.db2.gz BIPFSAZPMASOSO-IEBWSBKVSA-N 1 2 323.440 4.014 20 0 DIADLO CCCCCn1cc(C[NH2+]Cc2nc(CCC)cs2)c(C)n1 ZINC000494185460 1051697948 /nfs/dbraw/zinc/69/79/48/1051697948.db2.gz KIWDBKRYFCYRBX-UHFFFAOYSA-N 1 2 320.506 4.081 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(CO)c(C)c2Cl)cc1 ZINC001216330222 1051703934 /nfs/dbraw/zinc/70/39/34/1051703934.db2.gz AUFNSMCVFICXQJ-UHFFFAOYSA-N 1 2 304.821 4.340 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(CO)c(C)c2Cl)cc1 ZINC001216330222 1051703946 /nfs/dbraw/zinc/70/39/46/1051703946.db2.gz AUFNSMCVFICXQJ-UHFFFAOYSA-N 1 2 304.821 4.340 20 0 DIADLO COc1ccc(Cl)c(C[N@H+](C)Cc2cc(C)ccc2F)c1 ZINC001169822982 1051706792 /nfs/dbraw/zinc/70/67/92/1051706792.db2.gz YNRSHRIIURAPQK-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+](C)Cc2cc(C)ccc2F)c1 ZINC001169822982 1051706807 /nfs/dbraw/zinc/70/68/07/1051706807.db2.gz YNRSHRIIURAPQK-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cccc(OC(C)(C)C)n2)c1 ZINC001169820305 1051707346 /nfs/dbraw/zinc/70/73/46/1051707346.db2.gz BAYIJEKXBHLZKM-UHFFFAOYSA-N 1 2 316.420 4.338 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cccc(OC(C)(C)C)n2)c1 ZINC001169820305 1051707355 /nfs/dbraw/zinc/70/73/55/1051707355.db2.gz BAYIJEKXBHLZKM-UHFFFAOYSA-N 1 2 316.420 4.338 20 0 DIADLO Cc1ccc2cc(NCc3cccnc3N3CCCC3)[nH+]cc2c1 ZINC001169853240 1051714055 /nfs/dbraw/zinc/71/40/55/1051714055.db2.gz FIWOWPHXZNMABK-UHFFFAOYSA-N 1 2 318.424 4.151 20 0 DIADLO FC(F)(F)c1cccc2cc[nH+]c(NCCc3cncs3)c21 ZINC001169862263 1051718272 /nfs/dbraw/zinc/71/82/72/1051718272.db2.gz CWRAILWNCBJMKV-UHFFFAOYSA-N 1 2 323.343 4.365 20 0 DIADLO COC(=O)C[N@H+](Cc1ccc(C(C)C)cc1C(C)C)C1CC1 ZINC001169898434 1051725798 /nfs/dbraw/zinc/72/57/98/1051725798.db2.gz CEDNTNNGCNOWAO-UHFFFAOYSA-N 1 2 303.446 4.071 20 0 DIADLO COC(=O)C[N@@H+](Cc1ccc(C(C)C)cc1C(C)C)C1CC1 ZINC001169898434 1051725812 /nfs/dbraw/zinc/72/58/12/1051725812.db2.gz CEDNTNNGCNOWAO-UHFFFAOYSA-N 1 2 303.446 4.071 20 0 DIADLO CC(C)(C)[C@@H]1C[N@H+](CCc2cccc(Cl)c2Cl)CCO1 ZINC001169927888 1051730387 /nfs/dbraw/zinc/73/03/87/1051730387.db2.gz JLCQRUQHYRTUNE-AWEZNQCLSA-N 1 2 316.272 4.283 20 0 DIADLO CC(C)(C)[C@@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)CCO1 ZINC001169927888 1051730398 /nfs/dbraw/zinc/73/03/98/1051730398.db2.gz JLCQRUQHYRTUNE-AWEZNQCLSA-N 1 2 316.272 4.283 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H]2CCc3nc(Cl)ccc32)cs1 ZINC000806139021 1051740483 /nfs/dbraw/zinc/74/04/83/1051740483.db2.gz HDGOCQDBMXTDAV-ONGXEEELSA-N 1 2 307.850 4.092 20 0 DIADLO Oc1ccc(Cl)cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001216398681 1051746031 /nfs/dbraw/zinc/74/60/31/1051746031.db2.gz VMTOEYDGBJPOIQ-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO Oc1ccc(Nc2ccc[nH+]c2N2CCCCC2)c(Cl)c1 ZINC001216426353 1051758916 /nfs/dbraw/zinc/75/89/16/1051758916.db2.gz ZMAPHALKLWBOID-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+][C@@H]2CC[C@H]2C(C)(C)C)cc1 ZINC000806156465 1051760502 /nfs/dbraw/zinc/76/05/02/1051760502.db2.gz DDUSKZIKUCASRW-ZTFGCOKTSA-N 1 2 302.462 4.148 20 0 DIADLO C[C@H](CC(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)C1CC1 ZINC000767092593 1051760895 /nfs/dbraw/zinc/76/08/95/1051760895.db2.gz PFFQAZGFKFZJEM-CQSZACIVSA-N 1 2 323.440 4.261 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(C(C)C)nc1Cl ZINC001216445066 1051770998 /nfs/dbraw/zinc/77/09/98/1051770998.db2.gz OYVZLNYKIONMLM-UHFFFAOYSA-N 1 2 300.793 4.088 20 0 DIADLO CCOc1ccc(Cl)cc1Nc1ccc2c(c1)[nH+]cn2C ZINC001216449274 1051774603 /nfs/dbraw/zinc/77/46/03/1051774603.db2.gz BWXWOJWEYBKSHE-UHFFFAOYSA-N 1 2 301.777 4.369 20 0 DIADLO CC(C)(C)[C@H]1CN(C(=O)c2cccc3[nH+]ccn32)c2ccccc21 ZINC000767230255 1051781026 /nfs/dbraw/zinc/78/10/26/1051781026.db2.gz NEAHOERZQTUOBA-HNNXBMFYSA-N 1 2 319.408 4.124 20 0 DIADLO Cn1c(NCc2cnc3ccccc3c2)[nH+]c2cccc(Cl)c21 ZINC000767292212 1051784625 /nfs/dbraw/zinc/78/46/25/1051784625.db2.gz TVQYUSRVQHUTKY-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000186247280 1051801543 /nfs/dbraw/zinc/80/15/43/1051801543.db2.gz MRYMQFLOPYXDDD-MEDUHNTESA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000186247280 1051801554 /nfs/dbraw/zinc/80/15/54/1051801554.db2.gz MRYMQFLOPYXDDD-MEDUHNTESA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000186247262 1051802450 /nfs/dbraw/zinc/80/24/50/1051802450.db2.gz MRYMQFLOPYXDDD-BDJLRTHQSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000186247262 1051802455 /nfs/dbraw/zinc/80/24/55/1051802455.db2.gz MRYMQFLOPYXDDD-BDJLRTHQSA-N 1 2 306.331 4.082 20 0 DIADLO c1ccc2c(c1)cccc2Nc1ccccc1C[NH+]1CCOCC1 ZINC001173796081 1051804414 /nfs/dbraw/zinc/80/44/14/1051804414.db2.gz GBNFYNZYDKDJED-UHFFFAOYSA-N 1 2 318.420 4.416 20 0 DIADLO Cc1cccc(Nc2ccc3[nH+]cc(Br)n3c2)c1 ZINC001173807440 1051812658 /nfs/dbraw/zinc/81/26/58/1051812658.db2.gz QTMWGELGSKHBLL-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO COc1c(F)cc(SC)cc1Nc1cccn2cc(C)[nH+]c12 ZINC001216579966 1051822272 /nfs/dbraw/zinc/82/22/72/1051822272.db2.gz OOOGEIVLDJLFPI-UHFFFAOYSA-N 1 2 317.389 4.256 20 0 DIADLO C/C(=C\c1ccccc1)C[N@@H+]1CCSC[C@H]1c1nccs1 ZINC000186641044 1051825172 /nfs/dbraw/zinc/82/51/72/1051825172.db2.gz BNHKAOWKWVIJEY-UKYUDJEDSA-N 1 2 316.495 4.337 20 0 DIADLO C/C(=C\c1ccccc1)C[N@H+]1CCSC[C@H]1c1nccs1 ZINC000186641044 1051825184 /nfs/dbraw/zinc/82/51/84/1051825184.db2.gz BNHKAOWKWVIJEY-UKYUDJEDSA-N 1 2 316.495 4.337 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@@H+]2CCCC3(CC3)C2)c(Cl)c1 ZINC000186966097 1051832641 /nfs/dbraw/zinc/83/26/41/1051832641.db2.gz WMQVFBUSINHQOM-CQSZACIVSA-N 1 2 320.864 4.160 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@H+]2CCCC3(CC3)C2)c(Cl)c1 ZINC000186966097 1051832659 /nfs/dbraw/zinc/83/26/59/1051832659.db2.gz WMQVFBUSINHQOM-CQSZACIVSA-N 1 2 320.864 4.160 20 0 DIADLO Fc1ccc(Nc2cc(Br)c3[nH+]ccn3c2)cc1F ZINC001173867780 1051838844 /nfs/dbraw/zinc/83/88/44/1051838844.db2.gz OOTODMIJWDNDRC-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO CCCCC[C@@H]1CCC[N@@H+]1Cn1ncn(C(C)(C)C)c1=S ZINC000767763247 1051847089 /nfs/dbraw/zinc/84/70/89/1051847089.db2.gz SGXHKSIGXXHHMR-CQSZACIVSA-N 1 2 310.511 4.171 20 0 DIADLO CCCCC[C@@H]1CCC[N@H+]1Cn1ncn(C(C)(C)C)c1=S ZINC000767763247 1051847097 /nfs/dbraw/zinc/84/70/97/1051847097.db2.gz SGXHKSIGXXHHMR-CQSZACIVSA-N 1 2 310.511 4.171 20 0 DIADLO Cc1c(F)cccc1-c1noc(-c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC001216653328 1051852024 /nfs/dbraw/zinc/85/20/24/1051852024.db2.gz COIQSGHOZKCJHO-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CCc1cccc(-c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)c1 ZINC001216658142 1051854000 /nfs/dbraw/zinc/85/40/00/1051854000.db2.gz TUIMPGGTMXHUMT-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO COc1ccc(Nc2ccc([NH+]3CCCCC3)cc2)c(OC)c1 ZINC001173892759 1051859433 /nfs/dbraw/zinc/85/94/33/1051859433.db2.gz VVUYCNCKGZTOGU-UHFFFAOYSA-N 1 2 312.413 4.438 20 0 DIADLO C[C@@H](SCc1cc[nH+]c(N(C)C)c1)c1ccc(F)c(F)c1 ZINC000767871962 1051860891 /nfs/dbraw/zinc/86/08/91/1051860891.db2.gz QZKHJKPOIJTEDA-LLVKDONJSA-N 1 2 308.397 4.420 20 0 DIADLO Fc1ccc(Nc2cc(Br)c3[nH+]ccn3c2)c(F)c1 ZINC001173926943 1051861004 /nfs/dbraw/zinc/86/10/04/1051861004.db2.gz ZLUUBJHXISBWNP-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO C/C(=C\c1ccccc1)C[N@@H+](C)Cc1nc(CCC(C)C)no1 ZINC000494267702 1051869835 /nfs/dbraw/zinc/86/98/35/1051869835.db2.gz IUAUFEJVBFDCMO-FOWTUZBSSA-N 1 2 313.445 4.194 20 0 DIADLO C/C(=C\c1ccccc1)C[N@H+](C)Cc1nc(CCC(C)C)no1 ZINC000494267702 1051869845 /nfs/dbraw/zinc/86/98/45/1051869845.db2.gz IUAUFEJVBFDCMO-FOWTUZBSSA-N 1 2 313.445 4.194 20 0 DIADLO CCc1ccc(-c2noc(-c3ccccc3-n3cc[nH+]c3)n2)cc1 ZINC001216757472 1051873284 /nfs/dbraw/zinc/87/32/84/1051873284.db2.gz ZJIXBUDDPRNQOB-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ncc(Cl)cc2Br)c1 ZINC000404534351 1051875469 /nfs/dbraw/zinc/87/54/69/1051875469.db2.gz YXZMBPGWDDNWEL-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO c1cc([NH+]2CCCCC2)ccc1Nc1ccc2c(c1)OCCO2 ZINC001173877946 1051884697 /nfs/dbraw/zinc/88/46/97/1051884697.db2.gz LTBKFSOVPNTQLX-UHFFFAOYSA-N 1 2 310.397 4.192 20 0 DIADLO COc1ccc(C)cc1C[N@H+](C)Cc1cc(-c2ccccc2)n[nH]1 ZINC000768201568 1051894603 /nfs/dbraw/zinc/89/46/03/1051894603.db2.gz UXXYFPSIWRJCQJ-UHFFFAOYSA-N 1 2 321.424 4.026 20 0 DIADLO COc1ccc(C)cc1C[N@@H+](C)Cc1cc(-c2ccccc2)n[nH]1 ZINC000768201568 1051894610 /nfs/dbraw/zinc/89/46/10/1051894610.db2.gz UXXYFPSIWRJCQJ-UHFFFAOYSA-N 1 2 321.424 4.026 20 0 DIADLO COc1ccc(Nc2ccc(Oc3cc[nH+]c(C)c3)cc2)cn1 ZINC001173961239 1051895956 /nfs/dbraw/zinc/89/59/56/1051895956.db2.gz ZURRVEGOWXHMHT-UHFFFAOYSA-N 1 2 307.353 4.330 20 0 DIADLO CC[C@H](OC(=O)CCCn1cc[nH+]c1)c1ccc(Cl)cc1F ZINC000768186518 1051899184 /nfs/dbraw/zinc/89/91/84/1051899184.db2.gz SOQNDHAIKJNKBN-HNNXBMFYSA-N 1 2 324.783 4.150 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ncccc2C(F)(F)F)Cc2ccccc21 ZINC000768194847 1051902125 /nfs/dbraw/zinc/90/21/25/1051902125.db2.gz GPSOXURPGHEVPW-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ncccc2C(F)(F)F)Cc2ccccc21 ZINC000768194847 1051902133 /nfs/dbraw/zinc/90/21/33/1051902133.db2.gz GPSOXURPGHEVPW-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3coc(C4CC4)n3)CC2)cc1 ZINC000768237340 1051904402 /nfs/dbraw/zinc/90/44/02/1051904402.db2.gz PEIZJEDFPYHEMU-UHFFFAOYSA-N 1 2 314.816 4.495 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3coc(C4CC4)n3)CC2)cc1 ZINC000768237340 1051904410 /nfs/dbraw/zinc/90/44/10/1051904410.db2.gz PEIZJEDFPYHEMU-UHFFFAOYSA-N 1 2 314.816 4.495 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1occc1Br ZINC000768198432 1051904425 /nfs/dbraw/zinc/90/44/25/1051904425.db2.gz SWWWEWILJPSXIE-UHFFFAOYSA-N 1 2 300.221 4.126 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1occc1Br ZINC000768198432 1051904435 /nfs/dbraw/zinc/90/44/35/1051904435.db2.gz SWWWEWILJPSXIE-UHFFFAOYSA-N 1 2 300.221 4.126 20 0 DIADLO C[N@H+](Cc1occc1Br)[C@H]1CCc2ccccc21 ZINC000768233672 1051906360 /nfs/dbraw/zinc/90/63/60/1051906360.db2.gz NOBVJSLZQRQBFW-AWEZNQCLSA-N 1 2 306.203 4.161 20 0 DIADLO C[N@@H+](Cc1occc1Br)[C@H]1CCc2ccccc21 ZINC000768233672 1051906379 /nfs/dbraw/zinc/90/63/79/1051906379.db2.gz NOBVJSLZQRQBFW-AWEZNQCLSA-N 1 2 306.203 4.161 20 0 DIADLO Cc1cc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)cnc1Cl ZINC000768249630 1051909316 /nfs/dbraw/zinc/90/93/16/1051909316.db2.gz WZCRWJXOMBDFNA-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(C[N@H+]2CCSC[C@@H]2c2ccccc2)cnc1Cl ZINC000768249630 1051909326 /nfs/dbraw/zinc/90/93/26/1051909326.db2.gz WZCRWJXOMBDFNA-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO Fc1ccc(F)c(Nc2cc(Br)cn3cc[nH+]c23)c1 ZINC001173951220 1051915476 /nfs/dbraw/zinc/91/54/76/1051915476.db2.gz WOHGVHOHFVGYPX-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2c(Cl)nc(Cl)n2C)c1 ZINC000768330691 1051920072 /nfs/dbraw/zinc/92/00/72/1051920072.db2.gz YCIDMFPXRPGKAU-ZDUSSCGKSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2c(Cl)nc(Cl)n2C)c1 ZINC000768330691 1051920084 /nfs/dbraw/zinc/92/00/84/1051920084.db2.gz YCIDMFPXRPGKAU-ZDUSSCGKSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cccc3c2OC(C)(C)C3)no1 ZINC000768429022 1051929824 /nfs/dbraw/zinc/92/98/24/1051929824.db2.gz IWIHLTQVYZBKNR-KRWDZBQOSA-N 1 2 312.413 4.034 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cccc3c2OC(C)(C)C3)no1 ZINC000768429022 1051929838 /nfs/dbraw/zinc/92/98/38/1051929838.db2.gz IWIHLTQVYZBKNR-KRWDZBQOSA-N 1 2 312.413 4.034 20 0 DIADLO Cc1ccc(Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)[nH+]c2)c(C)c1 ZINC001174013592 1051935250 /nfs/dbraw/zinc/93/52/50/1051935250.db2.gz VACGUCXDAUSYBF-IYBDPMFKSA-N 1 2 311.429 4.056 20 0 DIADLO CCCCOc1ccccc1C[N@@H+]1CCC[C@@H]1c1cc(C)on1 ZINC000768506139 1051936053 /nfs/dbraw/zinc/93/60/53/1051936053.db2.gz TVVIZRCPJGFDFW-GOSISDBHSA-N 1 2 314.429 4.499 20 0 DIADLO CCCCOc1ccccc1C[N@H+]1CCC[C@@H]1c1cc(C)on1 ZINC000768506139 1051936065 /nfs/dbraw/zinc/93/60/65/1051936065.db2.gz TVVIZRCPJGFDFW-GOSISDBHSA-N 1 2 314.429 4.499 20 0 DIADLO COc1ccc(OC)c(OC)c1Nc1ccc2c(C)cc[nH+]c2c1 ZINC001174055162 1051943108 /nfs/dbraw/zinc/94/31/08/1051943108.db2.gz FFEOXJNZYAAQRW-UHFFFAOYSA-N 1 2 324.380 4.313 20 0 DIADLO CCN(CC)C(=O)c1ccc(Nc2cc[nH+]c(SC)c2)cc1 ZINC001174063289 1051946263 /nfs/dbraw/zinc/94/62/63/1051946263.db2.gz MDLJVYZCZWZJBW-UHFFFAOYSA-N 1 2 315.442 4.029 20 0 DIADLO CC[N@H+](Cc1occc1Br)[C@H](C)c1cccc(O)c1 ZINC000768872165 1051975167 /nfs/dbraw/zinc/97/51/67/1051975167.db2.gz DZXWALNMZZOJJZ-LLVKDONJSA-N 1 2 324.218 4.331 20 0 DIADLO CC[N@@H+](Cc1occc1Br)[C@H](C)c1cccc(O)c1 ZINC000768872165 1051975177 /nfs/dbraw/zinc/97/51/77/1051975177.db2.gz DZXWALNMZZOJJZ-LLVKDONJSA-N 1 2 324.218 4.331 20 0 DIADLO CC(C)c1cc(N[C@@H](C)[C@@H](O)c2ccccc2)nc(C(C)C)[nH+]1 ZINC000808129925 1051976556 /nfs/dbraw/zinc/97/65/56/1051976556.db2.gz HQXHJFSPTVWDFF-KBXCAEBGSA-N 1 2 313.445 4.257 20 0 DIADLO CCc1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)cs1 ZINC000191660754 1051979690 /nfs/dbraw/zinc/97/96/90/1051979690.db2.gz KNQMENDPBTUMAJ-LLVKDONJSA-N 1 2 306.397 4.116 20 0 DIADLO CCc1nc(C[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)cs1 ZINC000191660754 1051979696 /nfs/dbraw/zinc/97/96/96/1051979696.db2.gz KNQMENDPBTUMAJ-LLVKDONJSA-N 1 2 306.397 4.116 20 0 DIADLO CC1(C)CCC(=O)N1C[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC000808152571 1051981219 /nfs/dbraw/zinc/98/12/19/1051981219.db2.gz MTAGGPFOIZVZTB-UHFFFAOYSA-N 1 2 320.436 4.028 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2CCOc3ccccc3[C@H]2C)s1 ZINC000768930175 1051981657 /nfs/dbraw/zinc/98/16/57/1051981657.db2.gz LZYIAAHNVSUEFL-CYBMUJFWSA-N 1 2 302.443 4.222 20 0 DIADLO CC(C)c1ncc(C[N@H+]2CCOc3ccccc3[C@H]2C)s1 ZINC000768930175 1051981668 /nfs/dbraw/zinc/98/16/68/1051981668.db2.gz LZYIAAHNVSUEFL-CYBMUJFWSA-N 1 2 302.443 4.222 20 0 DIADLO CC(C)Oc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)cc1 ZINC001174109437 1051983555 /nfs/dbraw/zinc/98/35/55/1051983555.db2.gz VLMWKCCDUCOLMP-UHFFFAOYSA-N 1 2 307.397 4.462 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1ccc(C(=O)NCC(C)C)cc1 ZINC001174078241 1051994529 /nfs/dbraw/zinc/99/45/29/1051994529.db2.gz ZITPDWXVQAHSEA-UHFFFAOYSA-N 1 2 311.429 4.082 20 0 DIADLO CC[C@H](CCc1ccccc1)NC(=O)c1c(C)cc(C)[nH+]c1C ZINC001131236341 1052001826 /nfs/dbraw/zinc/00/18/26/1052001826.db2.gz ZZFDJDKPTNCFBI-GOSISDBHSA-N 1 2 310.441 4.148 20 0 DIADLO CCCc1cc[nH+]c(Nc2ccc(C(=O)NC(C)(C)C)cc2)c1 ZINC001174126126 1052004364 /nfs/dbraw/zinc/00/43/64/1052004364.db2.gz QDFBRDRAMIBFCP-UHFFFAOYSA-N 1 2 311.429 4.306 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1ccc(C(=O)NC(C)(C)C)cc1 ZINC001174126001 1052005165 /nfs/dbraw/zinc/00/51/65/1052005165.db2.gz NPAIFECYRVAICR-UHFFFAOYSA-N 1 2 311.429 4.224 20 0 DIADLO c1c[nH]c([C@@H]2CCCC[N@H+]2Cc2ccccc2N2CCCCC2)n1 ZINC000769211352 1052009936 /nfs/dbraw/zinc/00/99/36/1052009936.db2.gz UTGVOMVYKANBTB-IBGZPJMESA-N 1 2 324.472 4.127 20 0 DIADLO c1c[nH]c([C@@H]2CCCC[N@@H+]2Cc2ccccc2N2CCCCC2)n1 ZINC000769211352 1052009942 /nfs/dbraw/zinc/00/99/42/1052009942.db2.gz UTGVOMVYKANBTB-IBGZPJMESA-N 1 2 324.472 4.127 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1OC(F)F ZINC000225306287 1052011409 /nfs/dbraw/zinc/01/14/09/1052011409.db2.gz BAYXHIKQCFALKU-MRVPVSSYSA-N 1 2 318.776 4.249 20 0 DIADLO Cc1cc(C)c(NC(=O)CCOc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000192537172 1052012984 /nfs/dbraw/zinc/01/29/84/1052012984.db2.gz YCGJOAYBBJALNW-UHFFFAOYSA-N 1 2 318.804 4.068 20 0 DIADLO Cc1ccc(SCC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000192679903 1052016836 /nfs/dbraw/zinc/01/68/36/1052016836.db2.gz PSUDRQFTTUDASJ-UHFFFAOYSA-N 1 2 300.427 4.046 20 0 DIADLO CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001217318133 1052022282 /nfs/dbraw/zinc/02/22/82/1052022282.db2.gz HUBXSQLARUKURH-HOCLYGCPSA-N 1 2 314.433 4.061 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(C(=O)Nc2ccccc2)cc1 ZINC001174160377 1052025479 /nfs/dbraw/zinc/02/54/79/1052025479.db2.gz DZFWJAHMQDLFBE-UHFFFAOYSA-N 1 2 319.364 4.086 20 0 DIADLO C/C(=C\C(=O)Nc1ccc2[nH+]ccn2c1)c1cccc(Cl)c1 ZINC001131309753 1052026995 /nfs/dbraw/zinc/02/69/95/1052026995.db2.gz WMQCZDMFESQGAH-FMIVXFBMSA-N 1 2 311.772 4.030 20 0 DIADLO Cc1ccc(Nc2cccc(C(=O)NCc3ccccc3)c2)[nH+]c1 ZINC001174182177 1052035058 /nfs/dbraw/zinc/03/50/58/1052035058.db2.gz YSHLCLUQDJZREN-UHFFFAOYSA-N 1 2 317.392 4.064 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cccc(C(=O)NC(C)C)c2)cc1 ZINC001174188557 1052038655 /nfs/dbraw/zinc/03/86/55/1052038655.db2.gz XIHFVYOUFONXLK-UHFFFAOYSA-N 1 2 311.429 4.025 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cccc(C(=O)NC(C)C)c2)cc1 ZINC001174188557 1052038663 /nfs/dbraw/zinc/03/86/63/1052038663.db2.gz XIHFVYOUFONXLK-UHFFFAOYSA-N 1 2 311.429 4.025 20 0 DIADLO C[C@H](CCC1CC1)[NH2+]c1ccc(N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000769417077 1052044987 /nfs/dbraw/zinc/04/49/87/1052044987.db2.gz PKGOEUHMVWDELM-OAGGEKHMSA-N 1 2 302.462 4.291 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2[nH]nc3ccccc32)cc1F ZINC000769427021 1052045451 /nfs/dbraw/zinc/04/54/51/1052045451.db2.gz FKRHVGJIOWNLJC-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2[nH]nc3ccccc32)cc1F ZINC000769427021 1052045455 /nfs/dbraw/zinc/04/54/55/1052045455.db2.gz FKRHVGJIOWNLJC-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2n[nH]c3ccccc32)cc1F ZINC000769427021 1052045457 /nfs/dbraw/zinc/04/54/57/1052045457.db2.gz FKRHVGJIOWNLJC-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2n[nH]c3ccccc32)cc1F ZINC000769427021 1052045463 /nfs/dbraw/zinc/04/54/63/1052045463.db2.gz FKRHVGJIOWNLJC-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO COc1cc[nH+]cc1Nc1cccc(C(=O)Nc2ccccc2)c1 ZINC001174206084 1052048839 /nfs/dbraw/zinc/04/88/39/1052048839.db2.gz AYRQPUVRSXQXLV-UHFFFAOYSA-N 1 2 319.364 4.086 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2ccc(Br)s2)C1 ZINC001137641251 1052058646 /nfs/dbraw/zinc/05/86/46/1052058646.db2.gz RSHBHNXVZUURPO-GFCCVEGCSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2ccc(Br)s2)C1 ZINC001137641251 1052058653 /nfs/dbraw/zinc/05/86/53/1052058653.db2.gz RSHBHNXVZUURPO-GFCCVEGCSA-N 1 2 306.244 4.225 20 0 DIADLO O=C(c1ccccc1)c1ccc(Nc2cccc3[nH+]ccn32)cc1 ZINC001174223215 1052060006 /nfs/dbraw/zinc/06/00/06/1052060006.db2.gz UIFUTIDEFALSCK-UHFFFAOYSA-N 1 2 313.360 4.309 20 0 DIADLO Fc1ccccc1C1CC[NH+](Cc2coc(C3CC3)n2)CC1 ZINC000769465831 1052061200 /nfs/dbraw/zinc/06/12/00/1052061200.db2.gz JNVASYRBISRLOV-UHFFFAOYSA-N 1 2 300.377 4.071 20 0 DIADLO CC(C)CCCCCC[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000808673127 1052065264 /nfs/dbraw/zinc/06/52/64/1052065264.db2.gz YGULGVUCACCCFG-KRWDZBQOSA-N 1 2 300.450 4.090 20 0 DIADLO Cc1cc(Cl)cc(-c2noc(-c3cccc4[nH+]ccn43)n2)c1 ZINC001217501140 1052075388 /nfs/dbraw/zinc/07/53/88/1052075388.db2.gz SQHROCNTOPMBGA-UHFFFAOYSA-N 1 2 310.744 4.013 20 0 DIADLO CC(C)(C)c1ccc(-c2noc(-c3cccc4[nH+]ccn43)n2)cc1 ZINC001217501203 1052075648 /nfs/dbraw/zinc/07/56/48/1052075648.db2.gz VCFDAIVZDZPWMK-UHFFFAOYSA-N 1 2 318.380 4.349 20 0 DIADLO FC(F)C1CC(Nc2cccc3c2CN(c2cccc[nH+]2)C3)C1 ZINC000769536457 1052077490 /nfs/dbraw/zinc/07/74/90/1052077490.db2.gz ATDWEDJYDPJDDS-UHFFFAOYSA-N 1 2 315.367 4.057 20 0 DIADLO Nc1ccc[nH+]c1Nc1cccc(OCc2ccccc2F)c1 ZINC001174311763 1052092847 /nfs/dbraw/zinc/09/28/47/1052092847.db2.gz NDZDQIATIGVDIG-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO CC(C)c1ccc(-c2nnc([C@H]3Cc4ccccc4C[NH2+]3)o2)cc1 ZINC001217695262 1052118081 /nfs/dbraw/zinc/11/80/81/1052118081.db2.gz HXZUDSBNCKRDLN-GOSISDBHSA-N 1 2 319.408 4.247 20 0 DIADLO Clc1cnc(C[NH2+]Cc2cccc(OC3CCCC3)c2)s1 ZINC000769912873 1052120145 /nfs/dbraw/zinc/12/01/45/1052120145.db2.gz YILTUYHUBCQVDA-UHFFFAOYSA-N 1 2 322.861 4.408 20 0 DIADLO CCn1nc(CNc2ccc([NH+](C)C)cc2C)c2ccccc21 ZINC000769911648 1052121084 /nfs/dbraw/zinc/12/10/84/1052121084.db2.gz ZBCSQYNPLYBERY-UHFFFAOYSA-N 1 2 308.429 4.043 20 0 DIADLO CCn1nc(CNc2ccc([NH+](C)C)c(C)c2)c2ccccc21 ZINC000769918967 1052122309 /nfs/dbraw/zinc/12/23/09/1052122309.db2.gz ISLMPXBVEZQJEU-UHFFFAOYSA-N 1 2 308.429 4.043 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1csc(-c2ccco2)n1 ZINC000769870244 1052122980 /nfs/dbraw/zinc/12/29/80/1052122980.db2.gz FNMNJTKNLPEZJH-JTQLQIEISA-N 1 2 317.414 4.113 20 0 DIADLO FC(F)(F)c1cc(Nc2ccc(-n3cc[nH+]c3)cc2)ccn1 ZINC001174361369 1052127702 /nfs/dbraw/zinc/12/77/02/1052127702.db2.gz KOJYEIOUEMHJNU-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO c1cn(Cc2cccc(Nc3ccc4ncsc4c3)c2)c[nH+]1 ZINC001174367846 1052132076 /nfs/dbraw/zinc/13/20/76/1052132076.db2.gz GRHWOPMHFYWDFN-UHFFFAOYSA-N 1 2 306.394 4.285 20 0 DIADLO COc1nccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)c1Cl ZINC001174380844 1052138512 /nfs/dbraw/zinc/13/85/12/1052138512.db2.gz MPNSORMMGVQENU-UHFFFAOYSA-N 1 2 316.792 4.418 20 0 DIADLO Cc1cn2cccc(Nc3ccc4c(c3)[nH+]cn4C(C)C)c2n1 ZINC001174381274 1052138813 /nfs/dbraw/zinc/13/88/13/1052138813.db2.gz DQLGYGFENREJPS-UHFFFAOYSA-N 1 2 305.385 4.317 20 0 DIADLO COc1cc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cc(OC)c1 ZINC001174381932 1052140581 /nfs/dbraw/zinc/14/05/81/1052140581.db2.gz WSMZLUDJZNKQRA-UHFFFAOYSA-N 1 2 311.385 4.378 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc4ccccc4oc3=O)ccc21 ZINC001174381632 1052141149 /nfs/dbraw/zinc/14/11/49/1052141149.db2.gz LMHGABQRRKPJBC-UHFFFAOYSA-N 1 2 319.364 4.467 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)[C@H](C)c1ccccc1Br ZINC000194975929 1052141783 /nfs/dbraw/zinc/14/17/83/1052141783.db2.gz GUOILHZRZWTXTH-LLVKDONJSA-N 1 2 323.234 4.247 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)[C@H](C)c1ccccc1Br ZINC000194975929 1052141786 /nfs/dbraw/zinc/14/17/86/1052141786.db2.gz GUOILHZRZWTXTH-LLVKDONJSA-N 1 2 323.234 4.247 20 0 DIADLO COc1ccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)c(OC)c1 ZINC001174383057 1052142323 /nfs/dbraw/zinc/14/23/23/1052142323.db2.gz KKYIFWLNPWKWGM-UHFFFAOYSA-N 1 2 311.385 4.378 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ncc(O)cc3Cl)ccc21 ZINC001174382483 1052142934 /nfs/dbraw/zinc/14/29/34/1052142934.db2.gz RUKYBBYZZDULTA-UHFFFAOYSA-N 1 2 302.765 4.115 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cncc(OC(F)F)c3)ccc21 ZINC001174382388 1052143055 /nfs/dbraw/zinc/14/30/55/1052143055.db2.gz NOCHXDXRRPKQNN-UHFFFAOYSA-N 1 2 318.327 4.357 20 0 DIADLO CC(C)n1c[nH+]c2cc(N3CCCc4c(N)cccc43)ccc21 ZINC001174383020 1052143199 /nfs/dbraw/zinc/14/31/99/1052143199.db2.gz JFNWUVDXUQLUCI-UHFFFAOYSA-N 1 2 306.413 4.284 20 0 DIADLO CC(C)n1c[nH+]c2cc(N3CCCc4cccc(N)c43)ccc21 ZINC001174384437 1052145320 /nfs/dbraw/zinc/14/53/20/1052145320.db2.gz WQGORVKEFUPWHI-UHFFFAOYSA-N 1 2 306.413 4.284 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4oc(=O)[nH]c4c3)ccc21 ZINC001174384605 1052145633 /nfs/dbraw/zinc/14/56/33/1052145633.db2.gz IZPUXFVAWPVUKU-UHFFFAOYSA-N 1 2 308.341 4.208 20 0 DIADLO Cc1c(Nc2ccc3c(c2)[nH+]cn3C(C)C)ccc2c1OCCO2 ZINC001174384497 1052145652 /nfs/dbraw/zinc/14/56/52/1052145652.db2.gz HJLGGNAQRSVJQM-UHFFFAOYSA-N 1 2 323.396 4.440 20 0 DIADLO COc1ccc(F)c(F)c1Nc1ccc[nH+]c1N1CCCCC1 ZINC001174423080 1052153342 /nfs/dbraw/zinc/15/33/42/1052153342.db2.gz JEVYPNJBDFWNCD-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO CC(C)(C)OC(=O)c1ccc(Nc2ccn3cc[nH+]c3c2)cc1 ZINC001174428724 1052155576 /nfs/dbraw/zinc/15/55/76/1052155576.db2.gz ZAVCNEXXWAZWSW-UHFFFAOYSA-N 1 2 309.369 4.033 20 0 DIADLO c1n[nH]c([C@H]([NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)C2CCCCC2)n1 ZINC000494885560 1052160055 /nfs/dbraw/zinc/16/00/55/1052160055.db2.gz HYDYNZMDDNAEQJ-BZZMCLGOSA-N 1 2 316.493 4.375 20 0 DIADLO Fc1cc(Nc2cc[nH+]c3[nH]ccc32)ccc1OC(F)(F)F ZINC001174410963 1052163920 /nfs/dbraw/zinc/16/39/20/1052163920.db2.gz AWJREVLCWRXODH-UHFFFAOYSA-N 1 2 311.238 4.296 20 0 DIADLO O=C(c1ccccc1)c1cccc(Nc2cc[nH+]c3[nH]ccc32)c1 ZINC001174411221 1052164644 /nfs/dbraw/zinc/16/46/44/1052164644.db2.gz PKPOGOIYLXXTIT-UHFFFAOYSA-N 1 2 313.360 4.489 20 0 DIADLO c1cc2c([nH]1)[nH+]ccc2Nc1ccc(Cc2ccncc2)cc1 ZINC001174411200 1052164739 /nfs/dbraw/zinc/16/47/39/1052164739.db2.gz ORFZFUWKSLISNC-UHFFFAOYSA-N 1 2 300.365 4.244 20 0 DIADLO Cc1ccc(Br)cc1Nc1cc[nH+]c2[nH]ccc21 ZINC001174411771 1052165376 /nfs/dbraw/zinc/16/53/76/1052165376.db2.gz HVKLSRUVSMSRIH-UHFFFAOYSA-N 1 2 302.175 4.329 20 0 DIADLO Fc1cc(Nc2cc[nH+]c3[nH]ccc32)cc(F)c1OCC1CC1 ZINC001174415131 1052166931 /nfs/dbraw/zinc/16/69/31/1052166931.db2.gz IWQLKODPTPKRIF-UHFFFAOYSA-N 1 2 315.323 4.325 20 0 DIADLO CC(C)C[N@H+](Cn1nc(-c2cccs2)oc1=S)C1CC1 ZINC000914566842 1052167566 /nfs/dbraw/zinc/16/75/66/1052167566.db2.gz KCBUNMRNKWLQEP-UHFFFAOYSA-N 1 2 309.460 4.012 20 0 DIADLO CC(C)C[N@@H+](Cn1nc(-c2cccs2)oc1=S)C1CC1 ZINC000914566842 1052167573 /nfs/dbraw/zinc/16/75/73/1052167573.db2.gz KCBUNMRNKWLQEP-UHFFFAOYSA-N 1 2 309.460 4.012 20 0 DIADLO CC(C)n1ccn(C[N@H+](Cc2cccs2)C2CC2)c1=S ZINC000914569426 1052168873 /nfs/dbraw/zinc/16/88/73/1052168873.db2.gz URKOLSKCLUVEGF-UHFFFAOYSA-N 1 2 307.488 4.284 20 0 DIADLO CC(C)n1ccn(C[N@@H+](Cc2cccs2)C2CC2)c1=S ZINC000914569426 1052168882 /nfs/dbraw/zinc/16/88/82/1052168882.db2.gz URKOLSKCLUVEGF-UHFFFAOYSA-N 1 2 307.488 4.284 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1cc(F)ccc1C(F)(F)F ZINC001174484882 1052169770 /nfs/dbraw/zinc/16/97/70/1052169770.db2.gz UMVKUYOVXUGNHX-UHFFFAOYSA-N 1 2 309.266 4.074 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1sccc1Cl ZINC000494935101 1052171502 /nfs/dbraw/zinc/17/15/02/1052171502.db2.gz IPNOPVWAHKLBPK-SWLSCSKDSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1sccc1Cl ZINC000494935101 1052171507 /nfs/dbraw/zinc/17/15/07/1052171507.db2.gz IPNOPVWAHKLBPK-SWLSCSKDSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H](c1ccccc1)c1ccccc1O[C@H]1CC[NH2+]CC1(F)F ZINC001218011433 1052185037 /nfs/dbraw/zinc/18/50/37/1052185037.db2.gz HOQUCNFZEFPTAO-KDOFPFPSSA-N 1 2 317.379 4.214 20 0 DIADLO CC(C)[C@@H]1CCC[C@@H]([NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC000495045368 1052200335 /nfs/dbraw/zinc/20/03/35/1052200335.db2.gz LVDXCBMMMKWKCH-BRWVUGGUSA-N 1 2 304.482 4.231 20 0 DIADLO CC(C)C[C@H](c1nc(-c2ccc3cc[nH]c3c2)no1)n1cc[nH+]c1 ZINC000923858156 1052207813 /nfs/dbraw/zinc/20/78/13/1052207813.db2.gz GJFDDIISQCJIMB-MRXNPFEDSA-N 1 2 321.384 4.050 20 0 DIADLO CC[C@H](C)Oc1ccc(C(=O)Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC000495094509 1052215360 /nfs/dbraw/zinc/21/53/60/1052215360.db2.gz QLNOLEQRCDUSMA-AWEZNQCLSA-N 1 2 323.396 4.072 20 0 DIADLO C[C@@H](c1ccccc1)c1ccccc1O[C@H]1C[NH2+]CC(F)(F)C1 ZINC001218280979 1052217019 /nfs/dbraw/zinc/21/70/19/1052217019.db2.gz YOPXAEURKBNWQY-GOEBONIOSA-N 1 2 317.379 4.214 20 0 DIADLO O=C(C/C=C\c1ccccc1F)Nc1ccccc1-n1cc[nH+]c1 ZINC000495170469 1052245346 /nfs/dbraw/zinc/24/53/46/1052245346.db2.gz VYVPLIXLQFOMAJ-ALCCZGGFSA-N 1 2 321.355 4.053 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@]2(C)CCCc3ccccc32)c(C)[nH+]1 ZINC001219009461 1052268572 /nfs/dbraw/zinc/26/85/72/1052268572.db2.gz ALELLNUXDLUZOH-FQEVSTJZSA-N 1 2 323.440 4.380 20 0 DIADLO CCCC1(CCC)CCCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001219556964 1052294092 /nfs/dbraw/zinc/29/40/92/1052294092.db2.gz LJDSMDXEBSVSPA-UHFFFAOYSA-N 1 2 314.433 4.301 20 0 DIADLO CCCc1ccc(NC(=O)c2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC000915057583 1052328108 /nfs/dbraw/zinc/32/81/08/1052328108.db2.gz IBUNTIDWROCFIV-UHFFFAOYSA-N 1 2 319.408 4.136 20 0 DIADLO COc1cccc(C(F)(F)F)c1CNc1c[nH+]cc(C)c1C ZINC001168488609 1052363801 /nfs/dbraw/zinc/36/38/01/1052363801.db2.gz ANJKLERCARPVQM-UHFFFAOYSA-N 1 2 310.319 4.338 20 0 DIADLO CC(C)[C@H](C)[N@H+](C)Cn1[nH]c(/C=C/c2ccccc2)nc1=S ZINC000915208115 1052367754 /nfs/dbraw/zinc/36/77/54/1052367754.db2.gz CGHRHNWUHWUNCP-VNDWYCCKSA-N 1 2 316.474 4.045 20 0 DIADLO CC(C)[C@H](C)[N@@H+](C)Cn1[nH]c(/C=C/c2ccccc2)nc1=S ZINC000915208115 1052367759 /nfs/dbraw/zinc/36/77/59/1052367759.db2.gz CGHRHNWUHWUNCP-VNDWYCCKSA-N 1 2 316.474 4.045 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nsc2ccccc12)c1nc(C)cs1 ZINC000660094383 1052374146 /nfs/dbraw/zinc/37/41/46/1052374146.db2.gz YJFMKBYJRJXRLJ-MRXNPFEDSA-N 1 2 317.483 4.476 20 0 DIADLO COC(=O)c1ccccc1C[N@H+](C)[C@H](C)c1ccccc1Cl ZINC000316809831 1052374896 /nfs/dbraw/zinc/37/48/96/1052374896.db2.gz ANTGKXZICBVWEM-CYBMUJFWSA-N 1 2 317.816 4.320 20 0 DIADLO COC(=O)c1ccccc1C[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC000316809831 1052374902 /nfs/dbraw/zinc/37/49/02/1052374902.db2.gz ANTGKXZICBVWEM-CYBMUJFWSA-N 1 2 317.816 4.320 20 0 DIADLO S=c1n2ccccc2nn1C[N@@H+]1CCCC[C@H]1c1ccccc1 ZINC000762467531 1052388056 /nfs/dbraw/zinc/38/80/56/1052388056.db2.gz ROXVUIGIRCXGIC-INIZCTEOSA-N 1 2 324.453 4.050 20 0 DIADLO S=c1n2ccccc2nn1C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000762467531 1052388057 /nfs/dbraw/zinc/38/80/57/1052388057.db2.gz ROXVUIGIRCXGIC-INIZCTEOSA-N 1 2 324.453 4.050 20 0 DIADLO COc1ccccc1[C@H](C)SCc1cc[nH+]c(N(C)C)c1 ZINC000762479835 1052390327 /nfs/dbraw/zinc/39/03/27/1052390327.db2.gz NIZOMMLADHWZBE-ZDUSSCGKSA-N 1 2 302.443 4.151 20 0 DIADLO Cc1cc(NC(=O)CCCn2cc[nH+]c2)ccc1-c1ccccc1 ZINC000762511808 1052394461 /nfs/dbraw/zinc/39/44/61/1052394461.db2.gz SIZPDDLBBZEJAJ-UHFFFAOYSA-N 1 2 319.408 4.277 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2ccc(Cl)nc2)c2ccccn2)c1 ZINC000153564097 1052395778 /nfs/dbraw/zinc/39/57/78/1052395778.db2.gz PSNUBGWXIDXMMX-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO O=c1[nH]c(C[N@@H+]2CCCC[C@@H]2c2ccccc2)nc2ccccc21 ZINC000762633348 1052409838 /nfs/dbraw/zinc/40/98/38/1052409838.db2.gz KANLNLBYCGZFSP-GOSISDBHSA-N 1 2 319.408 4.063 20 0 DIADLO O=c1[nH]c(C[N@H+]2CCCC[C@@H]2c2ccccc2)nc2ccccc21 ZINC000762633348 1052409846 /nfs/dbraw/zinc/40/98/46/1052409846.db2.gz KANLNLBYCGZFSP-GOSISDBHSA-N 1 2 319.408 4.063 20 0 DIADLO CCCCc1ccc([C@H](C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000393388663 1052450752 /nfs/dbraw/zinc/45/07/52/1052450752.db2.gz ZQMVADJCLCTKMB-ZDUSSCGKSA-N 1 2 305.853 4.267 20 0 DIADLO CCCCc1ccc([C@@H](C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000393388660 1052451445 /nfs/dbraw/zinc/45/14/45/1052451445.db2.gz ZQMVADJCLCTKMB-CYBMUJFWSA-N 1 2 305.853 4.267 20 0 DIADLO CCCOc1ccc(C)c(-c2ccc(-n3c[nH+]c(C)c3C)nn2)c1 ZINC001222172033 1052456177 /nfs/dbraw/zinc/45/61/77/1052456177.db2.gz VQBJKXIBFMVMSK-UHFFFAOYSA-N 1 2 322.412 4.043 20 0 DIADLO CNc1ccc(Nc2cc(C(F)(F)F)nc3ccccc32)c[nH+]1 ZINC001203452874 1052457030 /nfs/dbraw/zinc/45/70/30/1052457030.db2.gz RMEVIFSTWFKXMP-UHFFFAOYSA-N 1 2 318.302 4.434 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cc(C)c(Cl)cc3F)nn2)c1C ZINC001222225660 1052464086 /nfs/dbraw/zinc/46/40/86/1052464086.db2.gz FHDGECVEVRILHY-UHFFFAOYSA-N 1 2 316.767 4.047 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)co1 ZINC000929891757 1052465559 /nfs/dbraw/zinc/46/55/59/1052465559.db2.gz QUVVAUIMEDJULX-INIZCTEOSA-N 1 2 300.402 4.015 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)co1 ZINC000929891757 1052465562 /nfs/dbraw/zinc/46/55/62/1052465562.db2.gz QUVVAUIMEDJULX-INIZCTEOSA-N 1 2 300.402 4.015 20 0 DIADLO C[N@H+](Cc1ccc(C(F)(F)F)s1)Cc1ccc(Cl)nc1 ZINC000762955441 1052473517 /nfs/dbraw/zinc/47/35/17/1052473517.db2.gz VQEMRAVDTMQHLP-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1ccc(C(F)(F)F)s1)Cc1ccc(Cl)nc1 ZINC000762955441 1052473523 /nfs/dbraw/zinc/47/35/23/1052473523.db2.gz VQEMRAVDTMQHLP-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO Cc1ccc(C[NH+](Cc2ccccn2)Cc2ccccn2)s1 ZINC000197823716 1052473774 /nfs/dbraw/zinc/47/37/74/1052473774.db2.gz HFDOYJYZSMOIHV-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO FC(F)(F)Oc1cccc(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001222326785 1052484075 /nfs/dbraw/zinc/48/40/75/1052484075.db2.gz FLWHVGLIDCXVJH-UHFFFAOYSA-N 1 2 318.298 4.497 20 0 DIADLO Clc1cc(Cl)cc(-c2ccc(Cn3cc[nH+]c3)cn2)c1 ZINC001222588580 1052513936 /nfs/dbraw/zinc/51/39/36/1052513936.db2.gz IWAPDRCQRBHVOO-UHFFFAOYSA-N 1 2 304.180 4.300 20 0 DIADLO CC(C)c1ccsc1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000056014029 1052545552 /nfs/dbraw/zinc/54/55/52/1052545552.db2.gz DFLAKQOGNABHBA-UHFFFAOYSA-N 1 2 311.410 4.310 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@H+](Cc2nc3c(s2)CCCC3)C1 ZINC000670272139 1052548200 /nfs/dbraw/zinc/54/82/00/1052548200.db2.gz MGDGLOBXVGKXHT-GOSISDBHSA-N 1 2 316.445 4.093 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@@H+](Cc2nc3c(s2)CCCC3)C1 ZINC000670272139 1052548204 /nfs/dbraw/zinc/54/82/04/1052548204.db2.gz MGDGLOBXVGKXHT-GOSISDBHSA-N 1 2 316.445 4.093 20 0 DIADLO CCOC(=O)c1ccc(-c2ccc(CNc3cccc[nH+]3)o2)cc1 ZINC000614240062 1052555206 /nfs/dbraw/zinc/55/52/06/1052555206.db2.gz CFXWGLAJTVWCQP-UHFFFAOYSA-N 1 2 322.364 4.130 20 0 DIADLO Cc1cc(C)c(C)c(OC(=O)c2cccc(Cn3cc[nH+]c3)c2)c1 ZINC000916373826 1052605023 /nfs/dbraw/zinc/60/50/23/1052605023.db2.gz MZVFPOATXUZREE-UHFFFAOYSA-N 1 2 320.392 4.076 20 0 DIADLO Cc1cc(Cl)ccc1NC1CCN(c2cccc[nH+]2)CC1 ZINC000037217085 1052613381 /nfs/dbraw/zinc/61/33/81/1052613381.db2.gz OUOIUVDXFSRSKT-UHFFFAOYSA-N 1 2 301.821 4.124 20 0 DIADLO c1nc(C[NH2+]Cc2ccccc2OCc2ccccc2)cs1 ZINC000062254862 1052632162 /nfs/dbraw/zinc/63/21/62/1052632162.db2.gz XCYDPLHUIHUUGO-UHFFFAOYSA-N 1 2 310.422 4.012 20 0 DIADLO Cc1ccccc1C[N@H+](C)Cc1csc(-c2ccccn2)n1 ZINC000124176674 1052637269 /nfs/dbraw/zinc/63/72/69/1052637269.db2.gz RKKYAHOPVREUBJ-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1ccccc1C[N@@H+](C)Cc1csc(-c2ccccn2)n1 ZINC000124176674 1052637271 /nfs/dbraw/zinc/63/72/71/1052637271.db2.gz RKKYAHOPVREUBJ-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2noc(C(C)C)n2)C(C)C)cc1 ZINC000064931572 1052654033 /nfs/dbraw/zinc/65/40/33/1052654033.db2.gz ITQFIODVTOYJRA-KRWDZBQOSA-N 1 2 301.434 4.242 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000125805472 1052654476 /nfs/dbraw/zinc/65/44/76/1052654476.db2.gz XNLPBXALKWXEHA-AWEZNQCLSA-N 1 2 308.381 4.201 20 0 DIADLO COc1ccc(C[NH2+][C@H](C)c2c(F)cccc2F)c(Cl)c1 ZINC000916839966 1052658980 /nfs/dbraw/zinc/65/89/80/1052658980.db2.gz SQFLYPCQLLFTJM-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO CC(C)(C)c1ccc(-c2nnc([C@@H]([NH3+])c3ccccc3)o2)cc1 ZINC000321291328 1052665252 /nfs/dbraw/zinc/66/52/52/1052665252.db2.gz HGRHSIUQUHYFQB-INIZCTEOSA-N 1 2 307.397 4.082 20 0 DIADLO c1c[nH]c([C@H]([NH2+]Cc2ccc3ccccc3c2)c2ccccc2)n1 ZINC000126201621 1052667109 /nfs/dbraw/zinc/66/71/09/1052667109.db2.gz SWNWRVQLNIYQPH-HXUWFJFHSA-N 1 2 313.404 4.442 20 0 DIADLO Cc1c(F)cccc1-c1ccc(C[NH2+]Cc2ncccc2F)o1 ZINC000126320621 1052669524 /nfs/dbraw/zinc/66/95/24/1052669524.db2.gz MSGSYUWZVRMFQB-UHFFFAOYSA-N 1 2 314.335 4.218 20 0 DIADLO Cc1cc(Cl)c2c(c1)[C@H]([NH2+]Cc1nccs1)CCCO2 ZINC000126581076 1052671581 /nfs/dbraw/zinc/67/15/81/1052671581.db2.gz DYIHCWLFJFXKCP-CYBMUJFWSA-N 1 2 308.834 4.108 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@H](c2cccc(O)c2)C1 ZINC000127398963 1052694364 /nfs/dbraw/zinc/69/43/64/1052694364.db2.gz YGGFZYSCISGQMD-UGSOOPFHSA-N 1 2 317.816 4.180 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@H](c2cccc(O)c2)C1 ZINC000127398963 1052694366 /nfs/dbraw/zinc/69/43/66/1052694366.db2.gz YGGFZYSCISGQMD-UGSOOPFHSA-N 1 2 317.816 4.180 20 0 DIADLO c1c[nH]c([C@H]([NH2+][C@H]2CCSc3ccccc32)c2ccccc2)n1 ZINC000127804763 1052702665 /nfs/dbraw/zinc/70/26/65/1052702665.db2.gz BZKBOKNYIKUREJ-FUHWJXTLSA-N 1 2 321.449 4.326 20 0 DIADLO c1c[nH]c([C@@H]([NH2+][C@@H]2CCSc3ccccc32)c2ccccc2)n1 ZINC000127804101 1052702798 /nfs/dbraw/zinc/70/27/98/1052702798.db2.gz BZKBOKNYIKUREJ-AEFFLSMTSA-N 1 2 321.449 4.326 20 0 DIADLO CCCc1noc(C[N@H+](CC)[C@@H](C)c2cc3ccccc3o2)n1 ZINC000067458249 1052704119 /nfs/dbraw/zinc/70/41/19/1052704119.db2.gz VQLHMNGWDQVUIQ-ZDUSSCGKSA-N 1 2 313.401 4.351 20 0 DIADLO CCCc1noc(C[N@@H+](CC)[C@@H](C)c2cc3ccccc3o2)n1 ZINC000067458249 1052704128 /nfs/dbraw/zinc/70/41/28/1052704128.db2.gz VQLHMNGWDQVUIQ-ZDUSSCGKSA-N 1 2 313.401 4.351 20 0 DIADLO CCC[NH+](CCC)Cn1ncn([C@H](C)c2ccccc2)c1=S ZINC000917423644 1052728717 /nfs/dbraw/zinc/72/87/17/1052728717.db2.gz XQWQRNXRQZOMQK-OAHLLOKOSA-N 1 2 318.490 4.103 20 0 DIADLO Cn1c2ccccc2n(C[N@@H+]2CC[C@@H]2c2ccccc2)c1=S ZINC000917446111 1052728767 /nfs/dbraw/zinc/72/87/67/1052728767.db2.gz HOPXIAWMCSXYHS-OAHLLOKOSA-N 1 2 309.438 4.114 20 0 DIADLO Cn1c2ccccc2n(C[N@H+]2CC[C@@H]2c2ccccc2)c1=S ZINC000917446111 1052728769 /nfs/dbraw/zinc/72/87/69/1052728769.db2.gz HOPXIAWMCSXYHS-OAHLLOKOSA-N 1 2 309.438 4.114 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@H]([C@@H]3CCCC3(C)C)C2)c(C)[nH+]1 ZINC001277024931 1052756190 /nfs/dbraw/zinc/75/61/90/1052756190.db2.gz VJPRFCNNWNBYPO-IRXDYDNUSA-N 1 2 314.473 4.295 20 0 DIADLO C[C@H](Oc1cc[nH+]cc1)c1c(F)cc(Br)cc1F ZINC001225295639 1052769516 /nfs/dbraw/zinc/76/95/16/1052769516.db2.gz NCGMSTFGOSKUDR-QMMMGPOBSA-N 1 2 314.129 4.262 20 0 DIADLO Cc1nccnc1C[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F ZINC000699949077 1052775353 /nfs/dbraw/zinc/77/53/53/1052775353.db2.gz ZEJFZONBYBBISE-QMMMGPOBSA-N 1 2 314.191 4.082 20 0 DIADLO Cc1cc(CNc2[nH+]c3ccccc3n2C2CC2)cnc1Cl ZINC000763425683 1052777061 /nfs/dbraw/zinc/77/70/61/1052777061.db2.gz MRBWQCBFIAASLO-UHFFFAOYSA-N 1 2 312.804 4.340 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000069066730 1052777939 /nfs/dbraw/zinc/77/79/39/1052777939.db2.gz QMYIQCLXLIPJIU-LBPRGKRZSA-N 1 2 300.333 4.267 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000069066730 1052777940 /nfs/dbraw/zinc/77/79/40/1052777940.db2.gz QMYIQCLXLIPJIU-LBPRGKRZSA-N 1 2 300.333 4.267 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1csc(C2CCCC2)n1 ZINC000069193388 1052781136 /nfs/dbraw/zinc/78/11/36/1052781136.db2.gz VTVXGKSBMXKQLQ-KRWDZBQOSA-N 1 2 315.486 4.476 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1csc(C2CCCC2)n1 ZINC000069193388 1052781140 /nfs/dbraw/zinc/78/11/40/1052781140.db2.gz VTVXGKSBMXKQLQ-KRWDZBQOSA-N 1 2 315.486 4.476 20 0 DIADLO CCC(CC)[N@H+](Cn1[nH]c(-c2ccccc2)nc1=S)C1CC1 ZINC000918179501 1052786795 /nfs/dbraw/zinc/78/67/95/1052786795.db2.gz QTTJMRFAOUCMIV-UHFFFAOYSA-N 1 2 316.474 4.218 20 0 DIADLO CCC(CC)[N@@H+](Cn1[nH]c(-c2ccccc2)nc1=S)C1CC1 ZINC000918179501 1052786796 /nfs/dbraw/zinc/78/67/96/1052786796.db2.gz QTTJMRFAOUCMIV-UHFFFAOYSA-N 1 2 316.474 4.218 20 0 DIADLO C[N@H+](Cc1nc(-c2cc3ccccc3o2)no1)Cc1ccccc1 ZINC000129576365 1052796042 /nfs/dbraw/zinc/79/60/42/1052796042.db2.gz NEEQDFJUJMEHAU-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO C[N@@H+](Cc1nc(-c2cc3ccccc3o2)no1)Cc1ccccc1 ZINC000129576365 1052796048 /nfs/dbraw/zinc/79/60/48/1052796048.db2.gz NEEQDFJUJMEHAU-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)ccc1Cl ZINC000129686678 1052803572 /nfs/dbraw/zinc/80/35/72/1052803572.db2.gz QLSPGLKQIJJMIN-KRWDZBQOSA-N 1 2 311.816 4.251 20 0 DIADLO CCc1ccc(N(CC)C(=O)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000918562163 1052812465 /nfs/dbraw/zinc/81/24/65/1052812465.db2.gz QYGAWSFGKHLSHF-UHFFFAOYSA-N 1 2 319.408 4.101 20 0 DIADLO C[C@@H](c1nc(-c2cccs2)no1)[N@H+](C)Cc1cccc(F)c1 ZINC000129926330 1052814460 /nfs/dbraw/zinc/81/44/60/1052814460.db2.gz VJBVLADCJQSEBH-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO C[C@@H](c1nc(-c2cccs2)no1)[N@@H+](C)Cc1cccc(F)c1 ZINC000129926330 1052814465 /nfs/dbraw/zinc/81/44/65/1052814465.db2.gz VJBVLADCJQSEBH-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO Cn1ccc(C[NH2+]Cc2ccc(-c3ccc(C(C)(C)C)cc3)o2)n1 ZINC000498359108 1052821994 /nfs/dbraw/zinc/82/19/94/1052821994.db2.gz LWHVAKULKOCQDD-UHFFFAOYSA-N 1 2 323.440 4.267 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1c1noc(-c2cc(-n3cc[nH+]c3)ccn2)n1 ZINC000556386089 1052844995 /nfs/dbraw/zinc/84/49/95/1052844995.db2.gz GTBZBFAOEJPJTG-HIFRSBDPSA-N 1 2 323.400 4.001 20 0 DIADLO Cc1nnsc1[C@H](C)[NH+]1CCC(=Cc2cccc(F)c2)CC1 ZINC000930052588 1052846601 /nfs/dbraw/zinc/84/66/01/1052846601.db2.gz NRFDKTQMLLVJRL-ZDUSSCGKSA-N 1 2 317.433 4.226 20 0 DIADLO Clc1nccc(Nc2ccc(-n3cc[nH+]c3)cc2)c1Cl ZINC001212238217 1052851896 /nfs/dbraw/zinc/85/18/96/1052851896.db2.gz WPIAUAZNJRBFBT-UHFFFAOYSA-N 1 2 305.168 4.318 20 0 DIADLO Cc1noc(C[N@@H+](CC(C)C)[C@H](C)c2ccccc2Cl)n1 ZINC000556517182 1052859852 /nfs/dbraw/zinc/85/98/52/1052859852.db2.gz RLFKHCCYXJVYNY-GFCCVEGCSA-N 1 2 307.825 4.251 20 0 DIADLO Cc1noc(C[N@H+](CC(C)C)[C@H](C)c2ccccc2Cl)n1 ZINC000556517182 1052859858 /nfs/dbraw/zinc/85/98/58/1052859858.db2.gz RLFKHCCYXJVYNY-GFCCVEGCSA-N 1 2 307.825 4.251 20 0 DIADLO FC(F)[C@@H](CCc1ccccc1)[NH2+]CC1(C(F)(F)F)CC1 ZINC000556920305 1052899808 /nfs/dbraw/zinc/89/98/08/1052899808.db2.gz GKMFOIKWMXQMGX-GFCCVEGCSA-N 1 2 307.306 4.185 20 0 DIADLO CCCC[NH+](CCCC)Cn1nc(OC(C)C)sc1=S ZINC000919941367 1052905533 /nfs/dbraw/zinc/90/55/33/1052905533.db2.gz YMJRXJSNPYOTPA-UHFFFAOYSA-N 1 2 317.524 4.321 20 0 DIADLO COCOc1cccc(Cl)c1Nc1cccn2cc(C)[nH+]c12 ZINC001214304878 1052966204 /nfs/dbraw/zinc/96/62/04/1052966204.db2.gz PSQOELDOGIDJDC-UHFFFAOYSA-N 1 2 317.776 4.022 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccc(OC)cc1 ZINC000921488137 1052972751 /nfs/dbraw/zinc/97/27/51/1052972751.db2.gz JLNHFSAESKJPKJ-HNNXBMFYSA-N 1 2 302.418 4.222 20 0 DIADLO CC(C)CCCCNc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC000322930735 1052977123 /nfs/dbraw/zinc/97/71/23/1052977123.db2.gz OGIGFTROAHLXHG-UHFFFAOYSA-N 1 2 309.417 4.054 20 0 DIADLO COc1ccccc1[C@H](Oc1c(C)cc[nH+]c1C)C(F)(F)F ZINC001227263649 1052977242 /nfs/dbraw/zinc/97/72/42/1052977242.db2.gz GMBVQXBJDWCSBP-HNNXBMFYSA-N 1 2 311.303 4.389 20 0 DIADLO Cc1cc[nH+]c(C)c1O[C@H]1CC=C[C@@H]1COCc1ccccc1 ZINC001227263316 1052977269 /nfs/dbraw/zinc/97/72/69/1052977269.db2.gz DHTIXVPNHQCMPD-MOPGFXCFSA-N 1 2 309.409 4.239 20 0 DIADLO CC1(C)CN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)CCCO1 ZINC000649280116 1052987693 /nfs/dbraw/zinc/98/76/93/1052987693.db2.gz ALSNNDGAQHVKJD-UHFFFAOYSA-N 1 2 324.346 4.259 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@H+](Cc1cccc(Cl)c1)C1CC1 ZINC000610012923 1053004126 /nfs/dbraw/zinc/00/41/26/1053004126.db2.gz LKGKCTUJUBSWKR-GFCCVEGCSA-N 1 2 309.837 4.035 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+](Cc1cccc(Cl)c1)C1CC1 ZINC000610012923 1053004129 /nfs/dbraw/zinc/00/41/29/1053004129.db2.gz LKGKCTUJUBSWKR-GFCCVEGCSA-N 1 2 309.837 4.035 20 0 DIADLO Cc1nc(NC(C)(C)CC(C)(C)C)c(Br)c(C)[nH+]1 ZINC000323193818 1053014837 /nfs/dbraw/zinc/01/48/37/1053014837.db2.gz NFSRIDSRUHLDSG-UHFFFAOYSA-N 1 2 314.271 4.483 20 0 DIADLO C[N@H+](CC(=O)c1cccc(O[C@@H]2C=CCC2)c1)Cc1ccccc1 ZINC001228105448 1053044681 /nfs/dbraw/zinc/04/46/81/1053044681.db2.gz WHDWLKOJKIWIPP-LJQANCHMSA-N 1 2 321.420 4.099 20 0 DIADLO C[N@@H+](CC(=O)c1cccc(O[C@@H]2C=CCC2)c1)Cc1ccccc1 ZINC001228105448 1053044682 /nfs/dbraw/zinc/04/46/82/1053044682.db2.gz WHDWLKOJKIWIPP-LJQANCHMSA-N 1 2 321.420 4.099 20 0 DIADLO Cc1ccc(F)c(NC(=O)[C@H](c2ccc(Cl)cc2)[NH+](C)C)c1 ZINC001350467143 1053065624 /nfs/dbraw/zinc/06/56/24/1053065624.db2.gz DNFXGCHXZIANLN-INIZCTEOSA-N 1 2 320.795 4.029 20 0 DIADLO Cc1[nH]c2ccc(O[C@@H]3CCc4c3cc(F)cc4F)cc2[nH+]1 ZINC001228328512 1053075083 /nfs/dbraw/zinc/07/50/83/1053075083.db2.gz FXARLIHGHKGLOP-QGZVFWFLSA-N 1 2 300.308 4.216 20 0 DIADLO Cc1[nH]c2ccc(O[C@H](c3ccccc3)C3CCOCC3)cc2[nH+]1 ZINC001228328439 1053076622 /nfs/dbraw/zinc/07/66/22/1053076622.db2.gz FADVSHLIKFOYRE-HXUWFJFHSA-N 1 2 322.408 4.418 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@@H]1CCCC[C@H]1C1CC1 ZINC001350618016 1053088516 /nfs/dbraw/zinc/08/85/16/1053088516.db2.gz SPSOTUCQLMQQOA-ZWKOTPCHSA-N 1 2 309.413 4.027 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C=CSc3ccccc3)cc2[nH+]1 ZINC000849366288 1053089870 /nfs/dbraw/zinc/08/98/70/1053089870.db2.gz XEKCDNRPIQLMNB-MDZDMXLPSA-N 1 2 309.394 4.116 20 0 DIADLO CC(C)(C)c1cnc(NCc2ccc(-n3cc[nH+]c3)cc2)s1 ZINC000541819853 1053122122 /nfs/dbraw/zinc/12/21/22/1053122122.db2.gz HBHFRWHSCZXCOI-UHFFFAOYSA-N 1 2 312.442 4.238 20 0 DIADLO Cc1cn(C2CCCCC2)nc1NCc1c[nH+]c2ccc(C)cn12 ZINC000544179556 1053135318 /nfs/dbraw/zinc/13/53/18/1053135318.db2.gz JAMVRXPSHMUOMR-UHFFFAOYSA-N 1 2 323.444 4.265 20 0 DIADLO CC[C@H](C)Sc1ccc(NC(=O)[C@H](C)n2cc[nH+]c2)c(C)c1 ZINC001318081476 1053148951 /nfs/dbraw/zinc/14/89/51/1053148951.db2.gz GOEWVERMIODYEV-KBPBESRZSA-N 1 2 317.458 4.282 20 0 DIADLO Cc1cc(NCc2ccn(-c3ccccc3)n2)[nH+]c2ccccc12 ZINC001318074363 1053148976 /nfs/dbraw/zinc/14/89/76/1053148976.db2.gz XCMVSNXRKMBMJJ-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Cc1cc(NCc2ccc(OCC3CC3)nc2)[nH+]c2ccccc12 ZINC001318088258 1053149107 /nfs/dbraw/zinc/14/91/07/1053149107.db2.gz JIPKDJDRZQXEFL-UHFFFAOYSA-N 1 2 319.408 4.339 20 0 DIADLO O=C(c1ccc(-n2cc[nH+]c2)cc1)N1CCCC2(CCCC2)CC1 ZINC000617566051 1053163574 /nfs/dbraw/zinc/16/35/74/1053163574.db2.gz RVPFMTQPVIUTEW-UHFFFAOYSA-N 1 2 323.440 4.059 20 0 DIADLO Cc1cc(N2CCO[C@@H](c3cccc(F)c3)C2)[nH+]c2ccccc12 ZINC001318398304 1053166986 /nfs/dbraw/zinc/16/69/86/1053166986.db2.gz BJWFWHIIVIDDHH-LJQANCHMSA-N 1 2 322.383 4.260 20 0 DIADLO COc1nscc1C[N@H+](C)Cc1c(C)cc(Cl)cc1C ZINC001474722952 1053170138 /nfs/dbraw/zinc/17/01/38/1053170138.db2.gz RPOWQRNACWZPRW-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COc1nscc1C[N@@H+](C)Cc1c(C)cc(Cl)cc1C ZINC001474722952 1053170147 /nfs/dbraw/zinc/17/01/47/1053170147.db2.gz RPOWQRNACWZPRW-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)co1 ZINC001351389927 1053174148 /nfs/dbraw/zinc/17/41/48/1053174148.db2.gz VEOGKMSIYACCOW-LLVKDONJSA-N 1 2 304.356 4.135 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)co1 ZINC001351389927 1053174151 /nfs/dbraw/zinc/17/41/51/1053174151.db2.gz VEOGKMSIYACCOW-LLVKDONJSA-N 1 2 304.356 4.135 20 0 DIADLO CCO[C@H]1CCC[N@H+](Cc2cc(Cl)c(F)c(Cl)c2)C1 ZINC001236662050 1053176915 /nfs/dbraw/zinc/17/69/15/1053176915.db2.gz NLBYEQWHRPJUPW-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@H]1CCC[N@@H+](Cc2cc(Cl)c(F)c(Cl)c2)C1 ZINC001236662050 1053176921 /nfs/dbraw/zinc/17/69/21/1053176921.db2.gz NLBYEQWHRPJUPW-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO CCCCn1c(SC[C@@H](C)CC)nnc1[C@@H](CC)[NH+](C)C ZINC000088484589 1053189223 /nfs/dbraw/zinc/18/92/23/1053189223.db2.gz PZGWZJCDMWMSMP-UONOGXRCSA-N 1 2 312.527 4.229 20 0 DIADLO CCCCn1c(SC[C@@H](C)CC)nnc1[C@H](CC)[NH+](C)C ZINC000088484591 1053189797 /nfs/dbraw/zinc/18/97/97/1053189797.db2.gz PZGWZJCDMWMSMP-KBPBESRZSA-N 1 2 312.527 4.229 20 0 DIADLO COc1ccccc1O[C@@H](C)CNc1cc(C)c2ccccc2[nH+]1 ZINC001318779605 1053191234 /nfs/dbraw/zinc/19/12/34/1053191234.db2.gz PHXOQLFTSPEJLK-HNNXBMFYSA-N 1 2 322.408 4.431 20 0 DIADLO CC(C)c1ccc(/C=C\CC(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC001360225012 1053200772 /nfs/dbraw/zinc/20/07/72/1053200772.db2.gz NCQSIUFBRPYBMT-HYXAFXHYSA-N 1 2 319.408 4.500 20 0 DIADLO Cc1cc(C)c(C(=O)NCC(C)(C)Cc2ccccc2)c(C)[nH+]1 ZINC001360246516 1053203449 /nfs/dbraw/zinc/20/34/49/1053203449.db2.gz BIEIIFAKIGZJAN-UHFFFAOYSA-N 1 2 310.441 4.006 20 0 DIADLO Cc1ccc2[nH]c(CNc3cc(C)c4ccccc4[nH+]3)nc2c1 ZINC001318970762 1053208059 /nfs/dbraw/zinc/20/80/59/1053208059.db2.gz UQDSTJANYKAEOS-UHFFFAOYSA-N 1 2 302.381 4.340 20 0 DIADLO Cc1ccc2nc(CNc3cc(C)c4ccccc4[nH+]3)[nH]c2c1 ZINC001318970762 1053208065 /nfs/dbraw/zinc/20/80/65/1053208065.db2.gz UQDSTJANYKAEOS-UHFFFAOYSA-N 1 2 302.381 4.340 20 0 DIADLO Cc1ccccc1[C@@H](CC(C)C)NC(=O)c1cccc2[nH+]ccn21 ZINC001360378689 1053219239 /nfs/dbraw/zinc/21/92/39/1053219239.db2.gz YETQKZASTXTJMZ-QGZVFWFLSA-N 1 2 321.424 4.160 20 0 DIADLO FC(F)C1CC[NH+](Cn2cc(-c3ccccc3)oc2=S)CC1 ZINC001319187494 1053224074 /nfs/dbraw/zinc/22/40/74/1053224074.db2.gz NTCPPWDTLDCYIX-UHFFFAOYSA-N 1 2 324.396 4.412 20 0 DIADLO C[N@H+](Cc1ccn(-c2ccccc2)n1)[C@H]1CCc2c1cccc2F ZINC001319312449 1053233972 /nfs/dbraw/zinc/23/39/72/1053233972.db2.gz NTVHADZGKRJTNT-FQEVSTJZSA-N 1 2 321.399 4.131 20 0 DIADLO C[N@@H+](Cc1ccn(-c2ccccc2)n1)[C@H]1CCc2c1cccc2F ZINC001319312449 1053233976 /nfs/dbraw/zinc/23/39/76/1053233976.db2.gz NTVHADZGKRJTNT-FQEVSTJZSA-N 1 2 321.399 4.131 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CC[C@@H]3CCCC[C@@H]3C2)n1 ZINC001319421640 1053243165 /nfs/dbraw/zinc/24/31/65/1053243165.db2.gz MNFCDERJFJECTL-WDEREUQCSA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CC[C@@H]3CCCC[C@@H]3C2)n1 ZINC001319421640 1053243172 /nfs/dbraw/zinc/24/31/72/1053243172.db2.gz MNFCDERJFJECTL-WDEREUQCSA-N 1 2 304.381 4.174 20 0 DIADLO Cc1cc(N[C@@H]2CC[C@@H]3SCCS[C@H]23)[nH+]c2ccccc12 ZINC001319583216 1053253741 /nfs/dbraw/zinc/25/37/41/1053253741.db2.gz IJYPSGCCDFORNO-HLLBOEOZSA-N 1 2 316.495 4.335 20 0 DIADLO Fc1cnccc1CNc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000449286663 1053266272 /nfs/dbraw/zinc/26/62/72/1053266272.db2.gz VITZKRRATCDJPD-UHFFFAOYSA-N 1 2 322.387 4.033 20 0 DIADLO COCC[N@H+](Cc1ncoc1C(C)C)[C@H](C)c1ccccc1 ZINC001319753429 1053269566 /nfs/dbraw/zinc/26/95/66/1053269566.db2.gz KEKVYPOINPGZOM-OAHLLOKOSA-N 1 2 302.418 4.008 20 0 DIADLO COCC[N@@H+](Cc1ncoc1C(C)C)[C@H](C)c1ccccc1 ZINC001319753429 1053269569 /nfs/dbraw/zinc/26/95/69/1053269569.db2.gz KEKVYPOINPGZOM-OAHLLOKOSA-N 1 2 302.418 4.008 20 0 DIADLO C[C@@H](C(=O)Nc1ccc2c(c1)C(C)(C)CC2(C)C)n1cc[nH+]c1 ZINC001319761441 1053271677 /nfs/dbraw/zinc/27/16/77/1053271677.db2.gz AYFOUGKQYFSHEB-ZDUSSCGKSA-N 1 2 311.429 4.042 20 0 DIADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1cnc(C(C)(C)C)s1 ZINC000091931163 1053274722 /nfs/dbraw/zinc/27/47/22/1053274722.db2.gz WNHLCNCPVBNIBT-UHFFFAOYSA-N 1 2 311.882 4.065 20 0 DIADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1cnc(C(C)(C)C)s1 ZINC000091931163 1053274731 /nfs/dbraw/zinc/27/47/31/1053274731.db2.gz WNHLCNCPVBNIBT-UHFFFAOYSA-N 1 2 311.882 4.065 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1cc(O)ccc1F)CCC2 ZINC001352083956 1053276931 /nfs/dbraw/zinc/27/69/31/1053276931.db2.gz IAKPQUBMMDIZBR-SJCJKPOMSA-N 1 2 317.408 4.037 20 0 DIADLO CC(C)c1nn(C)c(Cl)c1C[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000069753109 1053290052 /nfs/dbraw/zinc/29/00/52/1053290052.db2.gz LXKRTILXLVTBSZ-AAEUAGOBSA-N 1 2 321.852 4.203 20 0 DIADLO Cc1ccc(N[C@@H](C)c2ncc(Br)cc2F)c(C)[nH+]1 ZINC001320470139 1053337826 /nfs/dbraw/zinc/33/78/26/1053337826.db2.gz IQCVHYAQEBRYHQ-JTQLQIEISA-N 1 2 324.197 4.168 20 0 DIADLO Cc1cc(N[C@H](COCC(C)C)c2ccco2)nc(C(C)C)[nH+]1 ZINC000471055076 1053320067 /nfs/dbraw/zinc/32/00/67/1053320067.db2.gz FPSLAFYJLNHYBB-OAHLLOKOSA-N 1 2 317.433 4.327 20 0 DIADLO C[C@H](C(=O)NCC1(C2CCCCC2)CCCCC1)n1cc[nH+]c1 ZINC001320402982 1053331921 /nfs/dbraw/zinc/33/19/21/1053331921.db2.gz LYONAKFJLFSOPW-MRXNPFEDSA-N 1 2 317.477 4.091 20 0 DIADLO Cn1c2ccccc2[nH+]c1N[C@@H]1CCSc2ccc(F)cc21 ZINC001320629455 1053350292 /nfs/dbraw/zinc/35/02/92/1053350292.db2.gz WWIIHRPQUQVNJB-CYBMUJFWSA-N 1 2 313.401 4.361 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C(F)(F)F)s1)c1ccc(F)cc1 ZINC001561034581 1053355795 /nfs/dbraw/zinc/35/57/95/1053355795.db2.gz WAPRQBWWOORIOC-MRVPVSSYSA-N 1 2 304.312 4.152 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCC(F)(F)C(F)F ZINC001320994240 1053379994 /nfs/dbraw/zinc/37/99/94/1053379994.db2.gz IVUDDRUUABDQHD-UHFFFAOYSA-N 1 2 318.339 4.314 20 0 DIADLO CC[C@H]1CCC[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001434922246 1053386948 /nfs/dbraw/zinc/38/69/48/1053386948.db2.gz VUUSWYUBIGDGKX-JSGCOSHPSA-N 1 2 317.820 4.291 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2CCO[C@@](C)(c3ccccc3)C2)s1 ZINC000093341741 1053389822 /nfs/dbraw/zinc/38/98/22/1053389822.db2.gz DWEQVYJMVCKNEX-GOSISDBHSA-N 1 2 316.470 4.014 20 0 DIADLO CC(C)c1ncc(C[N@H+]2CCO[C@@](C)(c3ccccc3)C2)s1 ZINC000093341741 1053389838 /nfs/dbraw/zinc/38/98/38/1053389838.db2.gz DWEQVYJMVCKNEX-GOSISDBHSA-N 1 2 316.470 4.014 20 0 DIADLO CCC[C@@H]([NH2+]Cc1c[nH]c(-c2ccccc2)n1)c1ccccn1 ZINC001200135048 1053407712 /nfs/dbraw/zinc/40/77/12/1053407712.db2.gz FUYTZPIECUGLGA-QGZVFWFLSA-N 1 2 306.413 4.103 20 0 DIADLO C[C@@H](CCc1ccc(O)cc1)[NH2+][C@H](c1ccccc1)C(F)F ZINC001474761592 1053430826 /nfs/dbraw/zinc/43/08/26/1053430826.db2.gz BEZRQQNMTHJETO-SUMWQHHRSA-N 1 2 305.368 4.309 20 0 DIADLO Oc1c(Cl)cccc1C[NH2+]C1(c2cccc(Cl)c2)CC1 ZINC000182413675 1053435337 /nfs/dbraw/zinc/43/53/37/1053435337.db2.gz ISHBVGAWSXPCRV-UHFFFAOYSA-N 1 2 308.208 4.478 20 0 DIADLO Cc1ccc(OC[C@H](C)Oc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001229953526 1053437958 /nfs/dbraw/zinc/43/79/58/1053437958.db2.gz ARIPVILMURMIDJ-INIZCTEOSA-N 1 2 308.381 4.027 20 0 DIADLO Clc1ccnc2ccc(OC3C[NH+](Cc4ccccc4)C3)cc12 ZINC001230009546 1053452761 /nfs/dbraw/zinc/45/27/61/1053452761.db2.gz WUDGPAOTARTVFK-UHFFFAOYSA-N 1 2 324.811 4.151 20 0 DIADLO CC1(C)CCCC[C@@H]1Nc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC000325354173 1053467578 /nfs/dbraw/zinc/46/75/78/1053467578.db2.gz AYPPHRZAQWZFFZ-INIZCTEOSA-N 1 2 321.428 4.196 20 0 DIADLO CC1CCC(OC2CC[NH+](C/C(Cl)=C/Cl)CC2)CC1 ZINC000763545750 1053468388 /nfs/dbraw/zinc/46/83/88/1053468388.db2.gz ZMXCDIPLTPUBQX-RAXLEYEMSA-N 1 2 306.277 4.365 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2C/C(Cl)=C/Cl)cc1OC ZINC000763551252 1053470708 /nfs/dbraw/zinc/47/07/08/1053470708.db2.gz CETLNMMLAIZYPC-SUIFULHWSA-N 1 2 316.228 4.160 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2C/C(Cl)=C/Cl)cc1OC ZINC000763551252 1053470714 /nfs/dbraw/zinc/47/07/14/1053470714.db2.gz CETLNMMLAIZYPC-SUIFULHWSA-N 1 2 316.228 4.160 20 0 DIADLO Fc1cccc([C@H]2C[N@@H+]([C@H]3CCc4c3cccc4F)CCO2)c1 ZINC001322271799 1053475330 /nfs/dbraw/zinc/47/53/30/1053475330.db2.gz GEJCTVNUXPSXNT-RBUKOAKNSA-N 1 2 315.363 4.026 20 0 DIADLO Fc1cccc([C@H]2C[N@H+]([C@H]3CCc4c3cccc4F)CCO2)c1 ZINC001322271799 1053475333 /nfs/dbraw/zinc/47/53/33/1053475333.db2.gz GEJCTVNUXPSXNT-RBUKOAKNSA-N 1 2 315.363 4.026 20 0 DIADLO C[C@@H](CSc1ccccc1)[N@H+](C)Cc1ncc(Cl)s1 ZINC000649666383 1053503909 /nfs/dbraw/zinc/50/39/09/1053503909.db2.gz PRKHKXXPYDORSW-NSHDSACASA-N 1 2 312.891 4.409 20 0 DIADLO C[C@@H](CSc1ccccc1)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000649666383 1053503919 /nfs/dbraw/zinc/50/39/19/1053503919.db2.gz PRKHKXXPYDORSW-NSHDSACASA-N 1 2 312.891 4.409 20 0 DIADLO Cc1cc(N[C@H](C)c2nc3ccccc3n2C)ccc1[NH+](C)C ZINC000182848943 1053532903 /nfs/dbraw/zinc/53/29/03/1053532903.db2.gz GGUQEKJWLRXHMM-CQSZACIVSA-N 1 2 308.429 4.121 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1)[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000152816052 1053533917 /nfs/dbraw/zinc/53/39/17/1053533917.db2.gz OIKXMCNIQREPMZ-LBPRGKRZSA-N 1 2 305.397 4.089 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1)[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000152816052 1053533929 /nfs/dbraw/zinc/53/39/29/1053533929.db2.gz OIKXMCNIQREPMZ-LBPRGKRZSA-N 1 2 305.397 4.089 20 0 DIADLO CC(C)c1nc(CNc2c[nH+]ccc2OC(C)(C)C)cs1 ZINC001322965784 1053557305 /nfs/dbraw/zinc/55/73/05/1053557305.db2.gz ANXJGQOOIKJENA-UHFFFAOYSA-N 1 2 305.447 4.451 20 0 DIADLO Cc1nc2c(s1)[C@H](Nc1ccc3c(c1)CCC[N@H+]3C)CCC2 ZINC000182956590 1053561921 /nfs/dbraw/zinc/56/19/21/1053561921.db2.gz VNYVUPAXPBBPHD-MRXNPFEDSA-N 1 2 313.470 4.323 20 0 DIADLO Cc1nc2c(s1)[C@H](Nc1ccc3c(c1)CCC[N@@H+]3C)CCC2 ZINC000182956590 1053561931 /nfs/dbraw/zinc/56/19/31/1053561931.db2.gz VNYVUPAXPBBPHD-MRXNPFEDSA-N 1 2 313.470 4.323 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2ncoc2C(C)C)c1C ZINC001323492306 1053584776 /nfs/dbraw/zinc/58/47/76/1053584776.db2.gz NUJCWXVYOZTDTQ-UHFFFAOYSA-N 1 2 306.431 4.252 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@@H](F)CC1CCCCC1 ZINC001353483526 1053586999 /nfs/dbraw/zinc/58/69/99/1053586999.db2.gz XNHZSKYFRGXXPA-KRWDZBQOSA-N 1 2 315.392 4.119 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000620128040 1053610024 /nfs/dbraw/zinc/61/00/24/1053610024.db2.gz UKPRFAGVYHSDBM-BIENJYKASA-N 1 2 317.379 4.488 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000620128040 1053610044 /nfs/dbraw/zinc/61/00/44/1053610044.db2.gz UKPRFAGVYHSDBM-BIENJYKASA-N 1 2 317.379 4.488 20 0 DIADLO FC(F)n1ccnc1C[N@@H+]1C[C@@H]2CCCC[C@@]21c1ccccc1 ZINC001324058643 1053620189 /nfs/dbraw/zinc/62/01/89/1053620189.db2.gz AUIAISKEURHHQJ-MAUKXSAKSA-N 1 2 317.383 4.180 20 0 DIADLO FC(F)n1ccnc1C[N@H+]1C[C@@H]2CCCC[C@@]21c1ccccc1 ZINC001324058643 1053620202 /nfs/dbraw/zinc/62/02/02/1053620202.db2.gz AUIAISKEURHHQJ-MAUKXSAKSA-N 1 2 317.383 4.180 20 0 DIADLO C[C@H](Oc1cc2c(cc1O)C=[NH+]CC2)c1ccc(Cl)cc1 ZINC001230920449 1053625402 /nfs/dbraw/zinc/62/54/02/1053625402.db2.gz NCFRGPDLEFRPHM-NSHDSACASA-N 1 2 301.773 4.161 20 0 DIADLO C[C@H](Oc1cc2c(cc1O)C=[NH+]CC2)c1cccc(Cl)c1 ZINC001230920069 1053625423 /nfs/dbraw/zinc/62/54/23/1053625423.db2.gz JBIFSJBHQFVFOA-NSHDSACASA-N 1 2 301.773 4.161 20 0 DIADLO Cc1ccc(NC(=O)C[C@@H]2C[C@@H](C)CC(C)(C)C2)c(N(C)C)[nH+]1 ZINC001435646241 1053628274 /nfs/dbraw/zinc/62/82/74/1053628274.db2.gz VDAJANGWFJPVKX-HIFRSBDPSA-N 1 2 317.477 4.247 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1cnc2ccccn12 ZINC001324341924 1053646531 /nfs/dbraw/zinc/64/65/31/1053646531.db2.gz DLKGMNGXKVRDMO-UHFFFAOYSA-N 1 2 319.412 4.051 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)CC3CC(F)(F)C3)c2)[nH+]c1C ZINC001324378579 1053648187 /nfs/dbraw/zinc/64/81/87/1053648187.db2.gz LUHNMSADFDHKFJ-UHFFFAOYSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1cc(NC(=O)[C@@H](C)c2cccc(CC(C)C)c2)c(C)c[nH+]1 ZINC001435756414 1053665572 /nfs/dbraw/zinc/66/55/72/1053665572.db2.gz CVGLAUCBRCBTFG-INIZCTEOSA-N 1 2 310.441 4.061 20 0 DIADLO Cc1cc(NC(=O)c2cc3c(s2)CCCCCC3)c(C)c[nH+]1 ZINC001435759244 1053667023 /nfs/dbraw/zinc/66/70/23/1053667023.db2.gz XJACRNSOGAYCKC-UHFFFAOYSA-N 1 2 314.454 4.093 20 0 DIADLO Fc1cc2c(c(F)c1)CC[C@@H]2Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231080329 1053668730 /nfs/dbraw/zinc/66/87/30/1053668730.db2.gz BWXZIAVAYDVECD-KRWDZBQOSA-N 1 2 312.319 4.421 20 0 DIADLO Clc1ccnc2c1CC[C@H]2Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231080271 1053669572 /nfs/dbraw/zinc/66/95/72/1053669572.db2.gz AYHGBGAXWIVCQX-OAHLLOKOSA-N 1 2 311.772 4.191 20 0 DIADLO Cc1cccc(OC[C@H](C)Oc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001231082587 1053671676 /nfs/dbraw/zinc/67/16/76/1053671676.db2.gz XHOVFZBLLSDDEI-HNNXBMFYSA-N 1 2 308.381 4.231 20 0 DIADLO C[C@H](Oc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc(F)c1F ZINC001231082751 1053671690 /nfs/dbraw/zinc/67/16/90/1053671690.db2.gz YSLGBFPBPSHBRP-NSHDSACASA-N 1 2 300.308 4.495 20 0 DIADLO O=C1CC[C@H](Oc2ccc(-c3[nH]cc[nH+]3)cc2)c2ccccc21 ZINC001231081835 1053671993 /nfs/dbraw/zinc/67/19/93/1053671993.db2.gz OGKWJZXOGJTSPC-SFHVURJKSA-N 1 2 304.349 4.173 20 0 DIADLO Cc1cccc(C[N@@H+]2CCO[C@@H](c3ccc(Cl)s3)C2)c1 ZINC001324746453 1053676383 /nfs/dbraw/zinc/67/63/83/1053676383.db2.gz MJGJYNSAKGCYFL-CQSZACIVSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cccc(C[N@H+]2CCO[C@@H](c3ccc(Cl)s3)C2)c1 ZINC001324746453 1053676392 /nfs/dbraw/zinc/67/63/92/1053676392.db2.gz MJGJYNSAKGCYFL-CQSZACIVSA-N 1 2 307.846 4.283 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1ccc(Cl)c(F)c1 ZINC001324891413 1053686679 /nfs/dbraw/zinc/68/66/79/1053686679.db2.gz PLDIZCOKFZXKPF-SNVBAGLBSA-N 1 2 304.752 4.471 20 0 DIADLO CCCn1c(C)nnc1C[N@H+](Cc1cccc(Cl)c1)C(C)C ZINC000154042761 1053724367 /nfs/dbraw/zinc/72/43/67/1053724367.db2.gz PVJSFJVHQPAOOV-UHFFFAOYSA-N 1 2 320.868 4.061 20 0 DIADLO CCCn1c(C)nnc1C[N@@H+](Cc1cccc(Cl)c1)C(C)C ZINC000154042761 1053724379 /nfs/dbraw/zinc/72/43/79/1053724379.db2.gz PVJSFJVHQPAOOV-UHFFFAOYSA-N 1 2 320.868 4.061 20 0 DIADLO CC[N@H+](Cc1ccc([S@@](C)=O)cc1)Cc1ccccc1Cl ZINC000154175422 1053732010 /nfs/dbraw/zinc/73/20/10/1053732010.db2.gz LDZATGFENQAMFH-NRFANRHFSA-N 1 2 321.873 4.100 20 0 DIADLO CC[N@@H+](Cc1ccc([S@@](C)=O)cc1)Cc1ccccc1Cl ZINC000154175422 1053732022 /nfs/dbraw/zinc/73/20/22/1053732022.db2.gz LDZATGFENQAMFH-NRFANRHFSA-N 1 2 321.873 4.100 20 0 DIADLO CC[N@H+](Cc1ccc(F)cc1)Cc1c(F)ccc(F)c1OC ZINC001231414422 1053745562 /nfs/dbraw/zinc/74/55/62/1053745562.db2.gz SMUMOGRKLRDBNO-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccc(F)cc1)Cc1c(F)ccc(F)c1OC ZINC001231414422 1053745570 /nfs/dbraw/zinc/74/55/70/1053745570.db2.gz SMUMOGRKLRDBNO-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC(C)(C(=O)Nc1cccc(-n2cc[nH+]c2)c1)C1CCCCC1 ZINC001354089736 1053762078 /nfs/dbraw/zinc/76/20/78/1053762078.db2.gz QMNROGAEEZTVEX-UHFFFAOYSA-N 1 2 311.429 4.417 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)C1[C@H]2CCCCCC[C@H]12 ZINC001354094989 1053762726 /nfs/dbraw/zinc/76/27/26/1053762726.db2.gz APSYFJCKWIOWRT-IRXDYDNUSA-N 1 2 309.413 4.027 20 0 DIADLO C[N@H+](Cc1ccon1)Cc1ccc(/C=C/c2ccccc2)cc1 ZINC001231490250 1053768643 /nfs/dbraw/zinc/76/86/43/1053768643.db2.gz YQKPRFDJNJQKLH-BQYQJAHWSA-N 1 2 304.393 4.477 20 0 DIADLO C[N@@H+](Cc1ccon1)Cc1ccc(/C=C/c2ccccc2)cc1 ZINC001231490250 1053768655 /nfs/dbraw/zinc/76/86/55/1053768655.db2.gz YQKPRFDJNJQKLH-BQYQJAHWSA-N 1 2 304.393 4.477 20 0 DIADLO Cc1nc2c(o1)CC[N@H+](Cc1cccc(-c3ccccc3)c1)C2 ZINC001231512174 1053778774 /nfs/dbraw/zinc/77/87/74/1053778774.db2.gz KXIZZRFKLYFGPD-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO Cc1nc2c(o1)CC[N@@H+](Cc1cccc(-c3ccccc3)c1)C2 ZINC001231512174 1053778787 /nfs/dbraw/zinc/77/87/87/1053778787.db2.gz KXIZZRFKLYFGPD-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO Fc1ccc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)cc1Oc1ccccc1 ZINC001231535991 1053780098 /nfs/dbraw/zinc/78/00/98/1053780098.db2.gz BVULCIFJEPHCEO-QILLFSRXSA-N 1 2 315.363 4.408 20 0 DIADLO Fc1ccc(C[N@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)cc1Oc1ccccc1 ZINC001231535991 1053780110 /nfs/dbraw/zinc/78/01/10/1053780110.db2.gz BVULCIFJEPHCEO-QILLFSRXSA-N 1 2 315.363 4.408 20 0 DIADLO Fc1ccc(C[NH+]2CC(C(F)F)C2)cc1Oc1ccccc1 ZINC001231539526 1053783862 /nfs/dbraw/zinc/78/38/62/1053783862.db2.gz KPXMCASMTMEANI-UHFFFAOYSA-N 1 2 307.315 4.315 20 0 DIADLO Brc1c[nH]c(C[N@@H+]2CCC[C@H]2c2cccs2)c1 ZINC001231576914 1053789257 /nfs/dbraw/zinc/78/92/57/1053789257.db2.gz PGVBWKVYDMWTDN-LBPRGKRZSA-N 1 2 311.248 4.176 20 0 DIADLO Brc1c[nH]c(C[N@H+]2CCC[C@H]2c2cccs2)c1 ZINC001231576914 1053789267 /nfs/dbraw/zinc/78/92/67/1053789267.db2.gz PGVBWKVYDMWTDN-LBPRGKRZSA-N 1 2 311.248 4.176 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nc3c(s2)CCCC3)cn1 ZINC001231584054 1053790061 /nfs/dbraw/zinc/79/00/61/1053790061.db2.gz YEDLVHBZCSHSLA-INIZCTEOSA-N 1 2 313.470 4.062 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nc3c(s2)CCCC3)cn1 ZINC001231584054 1053790076 /nfs/dbraw/zinc/79/00/76/1053790076.db2.gz YEDLVHBZCSHSLA-INIZCTEOSA-N 1 2 313.470 4.062 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1nc2c(s1)CCCC2 ZINC001231582942 1053790241 /nfs/dbraw/zinc/79/02/41/1053790241.db2.gz DLBVMMITWIBCTK-ZDUSSCGKSA-N 1 2 316.470 4.224 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1nc2c(s1)CCCC2 ZINC001231582942 1053790254 /nfs/dbraw/zinc/79/02/54/1053790254.db2.gz DLBVMMITWIBCTK-ZDUSSCGKSA-N 1 2 316.470 4.224 20 0 DIADLO C[N@H+](Cc1cc(Br)c[nH]1)Cc1ccccc1Cl ZINC001231577647 1053790347 /nfs/dbraw/zinc/79/03/47/1053790347.db2.gz YUNPSVOXHZCSNU-UHFFFAOYSA-N 1 2 313.626 4.063 20 0 DIADLO C[N@@H+](Cc1cc(Br)c[nH]1)Cc1ccccc1Cl ZINC001231577647 1053790356 /nfs/dbraw/zinc/79/03/56/1053790356.db2.gz YUNPSVOXHZCSNU-UHFFFAOYSA-N 1 2 313.626 4.063 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CCCC2)no1)c1ccc(Cl)cc1 ZINC000155938719 1053792800 /nfs/dbraw/zinc/79/28/00/1053792800.db2.gz VOWURJVCBSJVSS-NSHDSACASA-N 1 2 305.809 4.231 20 0 DIADLO c1ccc2c(c1)CC[C@H]2[N@H+](Cc1nc(C2CCCC2)no1)C1CC1 ZINC000156177848 1053798804 /nfs/dbraw/zinc/79/88/04/1053798804.db2.gz WIBOPHBZXWQGAG-GOSISDBHSA-N 1 2 323.440 4.379 20 0 DIADLO c1ccc2c(c1)CC[C@H]2[N@@H+](Cc1nc(C2CCCC2)no1)C1CC1 ZINC000156177848 1053798816 /nfs/dbraw/zinc/79/88/16/1053798816.db2.gz WIBOPHBZXWQGAG-GOSISDBHSA-N 1 2 323.440 4.379 20 0 DIADLO CO[C@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)C1 ZINC001231599141 1053799388 /nfs/dbraw/zinc/79/93/88/1053799388.db2.gz FJAKVATWKLHQEJ-NSHDSACASA-N 1 2 308.636 4.258 20 0 DIADLO CO[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)C1 ZINC001231599141 1053799396 /nfs/dbraw/zinc/79/93/96/1053799396.db2.gz FJAKVATWKLHQEJ-NSHDSACASA-N 1 2 308.636 4.258 20 0 DIADLO Clc1cc(Cl)c(Cl)c(C[NH+]2CCC3(CCO3)CC2)c1 ZINC001231605380 1053801928 /nfs/dbraw/zinc/80/19/28/1053801928.db2.gz WVQSLLPWQCECQM-UHFFFAOYSA-N 1 2 320.647 4.402 20 0 DIADLO COc1cc(F)ccc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001231608888 1053802841 /nfs/dbraw/zinc/80/28/41/1053802841.db2.gz RHWOHQONJVURSW-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)ccc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001231608888 1053802855 /nfs/dbraw/zinc/80/28/55/1053802855.db2.gz RHWOHQONJVURSW-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COC[C@@H]([NH2+][C@H]1CCOc2c(Cl)cccc21)c1ccc(C)o1 ZINC000156437779 1053806669 /nfs/dbraw/zinc/80/66/69/1053806669.db2.gz JUCNBPPHVJYSHX-LSDHHAIUSA-N 1 2 321.804 4.042 20 0 DIADLO COC[C@H]([NH2+][C@H]1CCOc2c(Cl)cccc21)c1ccc(C)o1 ZINC000156437897 1053808127 /nfs/dbraw/zinc/80/81/27/1053808127.db2.gz JUCNBPPHVJYSHX-GJZGRUSLSA-N 1 2 321.804 4.042 20 0 DIADLO c1oc(-c2ccccc2)nc1C[N@@H+]1CCSc2ccccc2C1 ZINC001231632239 1053809704 /nfs/dbraw/zinc/80/97/04/1053809704.db2.gz KAZWWWWWRLARHV-UHFFFAOYSA-N 1 2 322.433 4.450 20 0 DIADLO c1oc(-c2ccccc2)nc1C[N@H+]1CCSc2ccccc2C1 ZINC001231632239 1053809721 /nfs/dbraw/zinc/80/97/21/1053809721.db2.gz KAZWWWWWRLARHV-UHFFFAOYSA-N 1 2 322.433 4.450 20 0 DIADLO Cc1cccc2cc(C[NH+]3CC4(C3)CC(F)(F)C4)c(Cl)nc12 ZINC001231646052 1053818975 /nfs/dbraw/zinc/81/89/75/1053818975.db2.gz DZFWHPAACFTAJM-UHFFFAOYSA-N 1 2 322.786 4.428 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+][C@@H]1COc2cc(F)cc(F)c21 ZINC001327031253 1053827926 /nfs/dbraw/zinc/82/79/26/1053827926.db2.gz CNNDWDJRBULQFS-QMTHXVAHSA-N 1 2 321.392 4.471 20 0 DIADLO COCc1ccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)o1 ZINC001231692978 1053833067 /nfs/dbraw/zinc/83/30/67/1053833067.db2.gz UGGNYXKQPUYTCT-KRWDZBQOSA-N 1 2 307.340 4.041 20 0 DIADLO COCc1ccc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)o1 ZINC001231692978 1053833086 /nfs/dbraw/zinc/83/30/86/1053833086.db2.gz UGGNYXKQPUYTCT-KRWDZBQOSA-N 1 2 307.340 4.041 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[N@@H+]1CCC(=O)C[C@H]1C ZINC001231735008 1053845562 /nfs/dbraw/zinc/84/55/62/1053845562.db2.gz IEIKFTLIPHDCAE-OAHLLOKOSA-N 1 2 311.425 4.180 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[N@H+]1CCC(=O)C[C@H]1C ZINC001231735008 1053845580 /nfs/dbraw/zinc/84/55/80/1053845580.db2.gz IEIKFTLIPHDCAE-OAHLLOKOSA-N 1 2 311.425 4.180 20 0 DIADLO COc1ncc(F)cc1C[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC001231745499 1053848115 /nfs/dbraw/zinc/84/81/15/1053848115.db2.gz NBWRNHXLNKWERJ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(F)cc1C[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC001231745499 1053848129 /nfs/dbraw/zinc/84/81/29/1053848129.db2.gz NBWRNHXLNKWERJ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)Sc1nc2sccn2c1C[NH+]1CC2(C1)CCCC2 ZINC001231776163 1053854405 /nfs/dbraw/zinc/85/44/05/1053854405.db2.gz VYGSVIWPKUVVRK-UHFFFAOYSA-N 1 2 321.515 4.272 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCc2ncc(Cl)cc2C1 ZINC001231785863 1053857097 /nfs/dbraw/zinc/85/70/97/1053857097.db2.gz KEODDSDBGAGKEZ-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CSc1ccccc1C[N@H+]1CCc2ncc(Cl)cc2C1 ZINC001231785863 1053857107 /nfs/dbraw/zinc/85/71/07/1053857107.db2.gz KEODDSDBGAGKEZ-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2nnc(C)s2)cc1 ZINC000274230088 1053859862 /nfs/dbraw/zinc/85/98/62/1053859862.db2.gz PKSJBSRSNYZHDV-RYUDHWBXSA-N 1 2 305.447 4.047 20 0 DIADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2ccn(-c3ccccc3)n2)c1 ZINC000621114797 1053860312 /nfs/dbraw/zinc/86/03/12/1053860312.db2.gz QNBVONAWADIDCA-HXUWFJFHSA-N 1 2 321.399 4.349 20 0 DIADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2ccn(-c3ccccc3)n2)c1 ZINC000621114797 1053860320 /nfs/dbraw/zinc/86/03/20/1053860320.db2.gz QNBVONAWADIDCA-HXUWFJFHSA-N 1 2 321.399 4.349 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCc2cc(F)c(F)cc2C1 ZINC001231788022 1053860749 /nfs/dbraw/zinc/86/07/49/1053860749.db2.gz TVWSKKOFKQTTIO-UHFFFAOYSA-N 1 2 305.393 4.245 20 0 DIADLO CSc1ccccc1C[N@H+]1CCc2cc(F)c(F)cc2C1 ZINC001231788022 1053860770 /nfs/dbraw/zinc/86/07/70/1053860770.db2.gz TVWSKKOFKQTTIO-UHFFFAOYSA-N 1 2 305.393 4.245 20 0 DIADLO CC[C@H](C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccc(F)cc1 ZINC000157657908 1053863040 /nfs/dbraw/zinc/86/30/40/1053863040.db2.gz LAYQKJGRBSQOQT-SFHVURJKSA-N 1 2 323.371 4.144 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ncoc2C(C)C)cc1F ZINC001327584145 1053867030 /nfs/dbraw/zinc/86/70/30/1053867030.db2.gz UUVSVXKPTICVJE-MRXNPFEDSA-N 1 2 318.392 4.283 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ncoc2C(C)C)cc1F ZINC001327584145 1053867037 /nfs/dbraw/zinc/86/70/37/1053867037.db2.gz UUVSVXKPTICVJE-MRXNPFEDSA-N 1 2 318.392 4.283 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccccc1-c1ccc(F)cc1 ZINC001231821812 1053875866 /nfs/dbraw/zinc/87/58/66/1053875866.db2.gz DZUCGSSZPOXBLB-IRXDYDNUSA-N 1 2 305.343 4.375 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@H+]1Cc1ccccc1-c1ccc(F)cc1 ZINC001231821812 1053875884 /nfs/dbraw/zinc/87/58/84/1053875884.db2.gz DZUCGSSZPOXBLB-IRXDYDNUSA-N 1 2 305.343 4.375 20 0 DIADLO Cc1csc2sc(C[N@@H+](C)Cc3ncccn3)c(C)c12 ZINC001231827892 1053883413 /nfs/dbraw/zinc/88/34/13/1053883413.db2.gz BTKCOPMUADZZRO-UHFFFAOYSA-N 1 2 303.456 4.002 20 0 DIADLO Cc1csc2sc(C[N@H+](C)Cc3ncccn3)c(C)c12 ZINC001231827892 1053883428 /nfs/dbraw/zinc/88/34/28/1053883428.db2.gz BTKCOPMUADZZRO-UHFFFAOYSA-N 1 2 303.456 4.002 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1cnc2ccccn12 ZINC000158241937 1053896955 /nfs/dbraw/zinc/89/69/55/1053896955.db2.gz ICDUIKYXNUCIAJ-CYBMUJFWSA-N 1 2 322.437 4.137 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cnc2ccccn12 ZINC000158241937 1053896967 /nfs/dbraw/zinc/89/69/67/1053896967.db2.gz ICDUIKYXNUCIAJ-CYBMUJFWSA-N 1 2 322.437 4.137 20 0 DIADLO CC[N@H+](Cc1ccnc(C(F)F)c1)Cc1cccc(F)c1F ZINC001231890609 1053904770 /nfs/dbraw/zinc/90/47/70/1053904770.db2.gz BOKHZXPQMPADNQ-UHFFFAOYSA-N 1 2 312.310 4.320 20 0 DIADLO CC[N@@H+](Cc1ccnc(C(F)F)c1)Cc1cccc(F)c1F ZINC001231890609 1053904778 /nfs/dbraw/zinc/90/47/78/1053904778.db2.gz BOKHZXPQMPADNQ-UHFFFAOYSA-N 1 2 312.310 4.320 20 0 DIADLO COc1cccc2c(C[N@@H+]3Cc4ccc(Cl)cc4C3)c[nH]c21 ZINC001231896749 1053908451 /nfs/dbraw/zinc/90/84/51/1053908451.db2.gz BXLQWILANHLXON-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1cccc2c(C[N@H+]3Cc4ccc(Cl)cc4C3)c[nH]c21 ZINC001231896749 1053908462 /nfs/dbraw/zinc/90/84/62/1053908462.db2.gz BXLQWILANHLXON-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO CC[N@H+](Cc1ccc2c[nH]nc2c1)Cc1c(F)cccc1Cl ZINC001231908101 1053912185 /nfs/dbraw/zinc/91/21/85/1053912185.db2.gz GOIDXNMTACVLGM-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO CC[N@@H+](Cc1ccc2c[nH]nc2c1)Cc1c(F)cccc1Cl ZINC001231908101 1053912190 /nfs/dbraw/zinc/91/21/90/1053912190.db2.gz GOIDXNMTACVLGM-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO CC(C)Cc1ccc(CCC(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001436598855 1053916556 /nfs/dbraw/zinc/91/65/56/1053916556.db2.gz QEFLOPGGZDSEDU-UHFFFAOYSA-N 1 2 321.424 4.104 20 0 DIADLO CC(C)Oc1cccc([C@@H]([NH2+]C[C@@H]2CCSC2)C(F)F)c1 ZINC000671123173 1053918391 /nfs/dbraw/zinc/91/83/91/1053918391.db2.gz PHEMTEMAQLBLBI-SWLSCSKDSA-N 1 2 315.429 4.123 20 0 DIADLO FC(F)(F)c1cccnc1C[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001231963063 1053923101 /nfs/dbraw/zinc/92/31/01/1053923101.db2.gz QXEVPYDHSQLGAE-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1cccnc1C[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001231963063 1053923114 /nfs/dbraw/zinc/92/31/14/1053923114.db2.gz QXEVPYDHSQLGAE-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2ccc3ccnc(Cl)c3c2)C[C@H]1F ZINC001231976358 1053926851 /nfs/dbraw/zinc/92/68/51/1053926851.db2.gz OERDHBRFWALRKT-ZBFHGGJFSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2ccc3ccnc(Cl)c3c2)C[C@H]1F ZINC001231976358 1053926867 /nfs/dbraw/zinc/92/68/67/1053926867.db2.gz OERDHBRFWALRKT-ZBFHGGJFSA-N 1 2 310.775 4.160 20 0 DIADLO O=C(C[C@@H]1CCC[N@H+]1Cc1cncc(Cl)c1)c1cccs1 ZINC000621268622 1053937068 /nfs/dbraw/zinc/93/70/68/1053937068.db2.gz RYDLCTMUAQWPCK-AWEZNQCLSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@@H]1CCC[N@@H+]1Cc1cncc(Cl)c1)c1cccs1 ZINC000621268622 1053937085 /nfs/dbraw/zinc/93/70/85/1053937085.db2.gz RYDLCTMUAQWPCK-AWEZNQCLSA-N 1 2 320.845 4.034 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1cn(C)nc1Cl ZINC001328506271 1053937918 /nfs/dbraw/zinc/93/79/18/1053937918.db2.gz RYSSSPZUQNWPQA-LLVKDONJSA-N 1 2 303.793 4.013 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1cn(C)nc1Cl ZINC001328506271 1053937929 /nfs/dbraw/zinc/93/79/29/1053937929.db2.gz RYSSSPZUQNWPQA-LLVKDONJSA-N 1 2 303.793 4.013 20 0 DIADLO CC[N@H+](CC(=O)OC(C)C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC001328603327 1053941826 /nfs/dbraw/zinc/94/18/26/1053941826.db2.gz WTUAFWGALNYTLS-LBPRGKRZSA-N 1 2 317.351 4.040 20 0 DIADLO CC[N@@H+](CC(=O)OC(C)C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC001328603327 1053941837 /nfs/dbraw/zinc/94/18/37/1053941837.db2.gz WTUAFWGALNYTLS-LBPRGKRZSA-N 1 2 317.351 4.040 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cccc(C(F)(F)F)n2)cn1 ZINC001232073453 1053954034 /nfs/dbraw/zinc/95/40/34/1053954034.db2.gz DVDKLLLWHPYJCW-OAHLLOKOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cccc(C(F)(F)F)n2)cn1 ZINC001232073453 1053954043 /nfs/dbraw/zinc/95/40/43/1053954043.db2.gz DVDKLLLWHPYJCW-OAHLLOKOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)c(C)n1 ZINC001232083713 1053957455 /nfs/dbraw/zinc/95/74/55/1053957455.db2.gz DMXCEFMQTQBHRR-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3cccc(C(F)(F)F)c3C2)c(C)n1 ZINC001232083713 1053957476 /nfs/dbraw/zinc/95/74/76/1053957476.db2.gz DMXCEFMQTQBHRR-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c(Cl)c1 ZINC001232102517 1053966581 /nfs/dbraw/zinc/96/65/81/1053966581.db2.gz VJMASMFNMVWBPV-AWEZNQCLSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c(Cl)c1 ZINC001232102517 1053966590 /nfs/dbraw/zinc/96/65/90/1053966590.db2.gz VJMASMFNMVWBPV-AWEZNQCLSA-N 1 2 323.770 4.272 20 0 DIADLO Cc1cc(NC[C@@]2(c3ccccc3)CC2(C)C)nc(C2CC2)[nH+]1 ZINC001472837945 1053968224 /nfs/dbraw/zinc/96/82/24/1053968224.db2.gz GPIVMKHHZWMZJG-HXUWFJFHSA-N 1 2 307.441 4.442 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccccc2OC(C)(C)C)s1 ZINC001200783101 1053970951 /nfs/dbraw/zinc/97/09/51/1053970951.db2.gz CYUXGVCSSUCXAZ-UHFFFAOYSA-N 1 2 304.459 4.173 20 0 DIADLO COc1ccnc(Cl)c1C[N@H+](Cc1ccccc1)C1CCC1 ZINC001232158725 1053975035 /nfs/dbraw/zinc/97/50/35/1053975035.db2.gz BCQUGMNVONQPCD-UHFFFAOYSA-N 1 2 316.832 4.298 20 0 DIADLO COc1ccnc(Cl)c1C[N@@H+](Cc1ccccc1)C1CCC1 ZINC001232158725 1053975051 /nfs/dbraw/zinc/97/50/51/1053975051.db2.gz BCQUGMNVONQPCD-UHFFFAOYSA-N 1 2 316.832 4.298 20 0 DIADLO CC[C@@H](c1ccccc1)[N@H+](C)Cc1ncccc1Br ZINC001232164620 1053975852 /nfs/dbraw/zinc/97/58/52/1053975852.db2.gz AUVGXMIEXMKRJM-INIZCTEOSA-N 1 2 319.246 4.427 20 0 DIADLO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1ncccc1Br ZINC001232164620 1053975864 /nfs/dbraw/zinc/97/58/64/1053975864.db2.gz AUVGXMIEXMKRJM-INIZCTEOSA-N 1 2 319.246 4.427 20 0 DIADLO COc1ccnc(Cl)c1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001232153525 1053977129 /nfs/dbraw/zinc/97/71/29/1053977129.db2.gz PVQAKMWBCPWBAR-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccnc(Cl)c1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001232153525 1053977140 /nfs/dbraw/zinc/97/71/40/1053977140.db2.gz PVQAKMWBCPWBAR-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2ncccc2C(F)(F)F)o1 ZINC001329291085 1053977732 /nfs/dbraw/zinc/97/77/32/1053977732.db2.gz HQCZKFMDUCOVKZ-UHFFFAOYSA-N 1 2 312.335 4.281 20 0 DIADLO Cc1cc(CNC(=O)CCc2cccc3ccccc32)cc(C)[nH+]1 ZINC001436881868 1053982718 /nfs/dbraw/zinc/98/27/18/1053982718.db2.gz LIAXBWIGCAMNRI-UHFFFAOYSA-N 1 2 318.420 4.101 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1ccnc(C(C)(C)C)c1 ZINC001232217594 1053992720 /nfs/dbraw/zinc/99/27/20/1053992720.db2.gz MQJUHACFKCRZEY-UHFFFAOYSA-N 1 2 324.468 4.472 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1ccnc(C(C)(C)C)c1 ZINC001232217594 1053992738 /nfs/dbraw/zinc/99/27/38/1053992738.db2.gz MQJUHACFKCRZEY-UHFFFAOYSA-N 1 2 324.468 4.472 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cccn2Cc2ccccc2)no1 ZINC001232230858 1053999359 /nfs/dbraw/zinc/99/93/59/1053999359.db2.gz CAQCGDBJNIBXCE-HXUWFJFHSA-N 1 2 321.424 4.170 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cccn2Cc2ccccc2)no1 ZINC001232230858 1053999366 /nfs/dbraw/zinc/99/93/66/1053999366.db2.gz CAQCGDBJNIBXCE-HXUWFJFHSA-N 1 2 321.424 4.170 20 0 DIADLO CCCC[N@H+](Cc1nc(CCC)no1)[C@H](C)c1ccc(C)o1 ZINC000621739054 1054006302 /nfs/dbraw/zinc/00/63/02/1054006302.db2.gz CEWPOHASPTYIFC-CQSZACIVSA-N 1 2 305.422 4.287 20 0 DIADLO CCCC[N@@H+](Cc1nc(CCC)no1)[C@H](C)c1ccc(C)o1 ZINC000621739054 1054006314 /nfs/dbraw/zinc/00/63/14/1054006314.db2.gz CEWPOHASPTYIFC-CQSZACIVSA-N 1 2 305.422 4.287 20 0 DIADLO CC(C)(C)c1nc(C[NH+]2CC(Cc3ccsc3)C2)cs1 ZINC000621741517 1054006408 /nfs/dbraw/zinc/00/64/08/1054006408.db2.gz XCNMPQZQFWRLFR-UHFFFAOYSA-N 1 2 306.500 4.177 20 0 DIADLO Cc1cc(N2C[C@@H](CC(F)(F)F)O[C@@H](C)C2)[nH+]c2ccccc12 ZINC001330088542 1054022717 /nfs/dbraw/zinc/02/27/17/1054022717.db2.gz QQQUSMXLLCTTCD-QWHCGFSZSA-N 1 2 324.346 4.089 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c(C)n1 ZINC001232334832 1054025001 /nfs/dbraw/zinc/02/50/01/1054025001.db2.gz MGCZWXBRQPHPCF-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)c(C)n1 ZINC001232334832 1054025013 /nfs/dbraw/zinc/02/50/13/1054025013.db2.gz MGCZWXBRQPHPCF-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(OC(C)C)c(C[N@@H+]2Cc3cccc(C)c3C2)c1 ZINC001232387561 1054034341 /nfs/dbraw/zinc/03/43/41/1054034341.db2.gz OZRRWJHLSVTSEH-UHFFFAOYSA-N 1 2 311.425 4.307 20 0 DIADLO COc1ccc(OC(C)C)c(C[N@H+]2Cc3cccc(C)c3C2)c1 ZINC001232387561 1054034353 /nfs/dbraw/zinc/03/43/53/1054034353.db2.gz OZRRWJHLSVTSEH-UHFFFAOYSA-N 1 2 311.425 4.307 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2cc(C(F)(F)F)co2)C2CC2)s1 ZINC001330672606 1054045870 /nfs/dbraw/zinc/04/58/70/1054045870.db2.gz OJGQYGXYSIISNX-LBPRGKRZSA-N 1 2 316.348 4.304 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2nc3ccccc3[nH]2)C1 ZINC001330855512 1054054262 /nfs/dbraw/zinc/05/42/62/1054054262.db2.gz JDCNEYCGUMLRLC-ACJLOTCBSA-N 1 2 309.388 4.285 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2nc3ccccc3[nH]2)C1 ZINC001330855512 1054054274 /nfs/dbraw/zinc/05/42/74/1054054274.db2.gz JDCNEYCGUMLRLC-ACJLOTCBSA-N 1 2 309.388 4.285 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2F)[N@H+](Cc2nc3ccccc3[nH]2)C1 ZINC001330855515 1054054913 /nfs/dbraw/zinc/05/49/13/1054054913.db2.gz JDCNEYCGUMLRLC-SCLBCKFNSA-N 1 2 309.388 4.285 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2nc3ccccc3[nH]2)C1 ZINC001330855515 1054054928 /nfs/dbraw/zinc/05/49/28/1054054928.db2.gz JDCNEYCGUMLRLC-SCLBCKFNSA-N 1 2 309.388 4.285 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2cc(C)c(F)c(C)c2)cs1 ZINC000165281405 1054073871 /nfs/dbraw/zinc/07/38/71/1054073871.db2.gz FYWYNGHUGCCSJB-QWHCGFSZSA-N 1 2 322.449 4.457 20 0 DIADLO FC1(F)CC2(C1)CC[NH+](Cc1ncc(Cl)cc1Cl)CC2 ZINC001232570106 1054074006 /nfs/dbraw/zinc/07/40/06/1054074006.db2.gz CSMHGBXUOMZNJG-UHFFFAOYSA-N 1 2 321.198 4.400 20 0 DIADLO CCOc1ccnc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c1 ZINC001232584073 1054074131 /nfs/dbraw/zinc/07/41/31/1054074131.db2.gz WARZJSKFOBEAMK-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccnc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)c1 ZINC001232584073 1054074140 /nfs/dbraw/zinc/07/41/40/1054074140.db2.gz WARZJSKFOBEAMK-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2nc(C)c[nH]2)c2cccc(F)c2)cc1 ZINC001331517184 1054079308 /nfs/dbraw/zinc/07/93/08/1054079308.db2.gz CUKSZXMJKOBBDQ-FQEVSTJZSA-N 1 2 323.415 4.299 20 0 DIADLO C[C@@H](c1nc([C@@H]2CCC(C)(C)c3ccccc32)no1)n1cc[nH+]c1 ZINC001331515889 1054079421 /nfs/dbraw/zinc/07/94/21/1054079421.db2.gz TZANMSVKPXLOMR-DZGCQCFKSA-N 1 2 322.412 4.079 20 0 DIADLO c1cc2ccc(C[N@@H+]3CCOC[C@@H]3c3ccccc3)cc2s1 ZINC001232610487 1054084038 /nfs/dbraw/zinc/08/40/38/1054084038.db2.gz RNEJMROACGZKDR-GOSISDBHSA-N 1 2 309.434 4.475 20 0 DIADLO c1cc2ccc(C[N@H+]3CCOC[C@@H]3c3ccccc3)cc2s1 ZINC001232610487 1054084052 /nfs/dbraw/zinc/08/40/52/1054084052.db2.gz RNEJMROACGZKDR-GOSISDBHSA-N 1 2 309.434 4.475 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1c(Cl)ccnc1F ZINC001232618825 1054086059 /nfs/dbraw/zinc/08/60/59/1054086059.db2.gz GPJDTCTTYBADAE-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1c(Cl)ccnc1F ZINC001232618825 1054086071 /nfs/dbraw/zinc/08/60/71/1054086071.db2.gz GPJDTCTTYBADAE-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO COc1cccc(C)c1C[N@H+](CC(=O)c1ccccc1)C(C)C ZINC001232626238 1054088085 /nfs/dbraw/zinc/08/80/85/1054088085.db2.gz XGNBDAHLXGWBDC-UHFFFAOYSA-N 1 2 311.425 4.097 20 0 DIADLO COc1cccc(C)c1C[N@@H+](CC(=O)c1ccccc1)C(C)C ZINC001232626238 1054088093 /nfs/dbraw/zinc/08/80/93/1054088093.db2.gz XGNBDAHLXGWBDC-UHFFFAOYSA-N 1 2 311.425 4.097 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1cnc(Cl)cc1Br ZINC001232685333 1054101218 /nfs/dbraw/zinc/10/12/18/1054101218.db2.gz WQYKCZVQTLRMQZ-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1cnc(Cl)cc1Br ZINC001232685333 1054101222 /nfs/dbraw/zinc/10/12/22/1054101222.db2.gz WQYKCZVQTLRMQZ-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO Cc1ccc2[nH+]c(C)cc(OCc3cn(C)nc3C(F)F)c2c1 ZINC001331983937 1054104711 /nfs/dbraw/zinc/10/47/11/1054104711.db2.gz KECAILOXPWTZPX-UHFFFAOYSA-N 1 2 317.339 4.102 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc3ccc(Cl)cc3[nH]2)no1 ZINC001232726363 1054108327 /nfs/dbraw/zinc/10/83/27/1054108327.db2.gz CAQBMFBIIIUIDZ-KRWDZBQOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc3ccc(Cl)cc3[nH]2)no1 ZINC001232726363 1054108335 /nfs/dbraw/zinc/10/83/35/1054108335.db2.gz CAQBMFBIIIUIDZ-KRWDZBQOSA-N 1 2 315.804 4.455 20 0 DIADLO CC(C)[C@H](CCc1ccccc1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001437909498 1054111243 /nfs/dbraw/zinc/11/12/43/1054111243.db2.gz NTGDFSQIXPECEL-SFHVURJKSA-N 1 2 321.424 4.178 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2cccnc2)c(F)cc1F ZINC001232783350 1054119540 /nfs/dbraw/zinc/11/95/40/1054119540.db2.gz WDPATAUQVHKYOJ-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2cccnc2)c(F)cc1F ZINC001232783350 1054119548 /nfs/dbraw/zinc/11/95/48/1054119548.db2.gz WDPATAUQVHKYOJ-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO COc1cc(O)cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1 ZINC001232806160 1054124148 /nfs/dbraw/zinc/12/41/48/1054124148.db2.gz BBVHGERZQRMFPS-GOSISDBHSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cc(O)cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1 ZINC001232806160 1054124157 /nfs/dbraw/zinc/12/41/57/1054124157.db2.gz BBVHGERZQRMFPS-GOSISDBHSA-N 1 2 319.351 4.016 20 0 DIADLO Fc1ccc(C[NH+]2CCC(OC3CCC3)CC2)c(Cl)c1F ZINC001232874312 1054135560 /nfs/dbraw/zinc/13/55/60/1054135560.db2.gz REPJTCCKEZGVCU-UHFFFAOYSA-N 1 2 315.791 4.152 20 0 DIADLO CC(C)[C@H]([NH2+][C@H](C)c1ncccn1)c1ccc(Cl)cc1F ZINC001333300009 1054148469 /nfs/dbraw/zinc/14/84/69/1054148469.db2.gz OXKKCSQHJTUGOZ-ABAIWWIYSA-N 1 2 307.800 4.317 20 0 DIADLO CC[C@H]([NH2+]Cc1ncoc1C(C)C)c1cc(F)ccc1OC ZINC001333318588 1054149957 /nfs/dbraw/zinc/14/99/57/1054149957.db2.gz IPTRGQMYAFYUFZ-AWEZNQCLSA-N 1 2 306.381 4.187 20 0 DIADLO Oc1c(F)ccc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)c1F ZINC001232936358 1054150436 /nfs/dbraw/zinc/15/04/36/1054150436.db2.gz BFNHWJJPKVMMGU-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO CC(C)c1nsc(C[NH+]2CCC(c3ccsc3)CC2)n1 ZINC001333373136 1054151981 /nfs/dbraw/zinc/15/19/81/1054151981.db2.gz QJEATUJMSMYFBM-UHFFFAOYSA-N 1 2 307.488 4.103 20 0 DIADLO C[N@H+](Cc1ccc2ccccc2c1)Cc1ccc(F)c(O)c1F ZINC001232939138 1054153552 /nfs/dbraw/zinc/15/35/52/1054153552.db2.gz GJBAPSIWPNLCGX-UHFFFAOYSA-N 1 2 313.347 4.456 20 0 DIADLO C[N@@H+](Cc1ccc2ccccc2c1)Cc1ccc(F)c(O)c1F ZINC001232939138 1054153555 /nfs/dbraw/zinc/15/35/55/1054153555.db2.gz GJBAPSIWPNLCGX-UHFFFAOYSA-N 1 2 313.347 4.456 20 0 DIADLO CCC1CC[NH+](Cc2cc(Cl)cnc2Br)CC1 ZINC001232958264 1054159232 /nfs/dbraw/zinc/15/92/32/1054159232.db2.gz IVKNMSCSSZQHNS-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1cc(Cl)cnc1Br ZINC001232962104 1054159403 /nfs/dbraw/zinc/15/94/03/1054159403.db2.gz ZLXJRQUOIBYOTO-LBPRGKRZSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1cc(Cl)cnc1Br ZINC001232962104 1054159415 /nfs/dbraw/zinc/15/94/15/1054159415.db2.gz ZLXJRQUOIBYOTO-LBPRGKRZSA-N 1 2 317.658 4.262 20 0 DIADLO Oc1cc(C[NH+]2CCC(c3cccs3)CC2)cc(F)c1F ZINC001232971813 1054162530 /nfs/dbraw/zinc/16/25/30/1054162530.db2.gz PJRIUXCJUMIRGX-UHFFFAOYSA-N 1 2 309.381 4.112 20 0 DIADLO Oc1cc(C[NH+]2CCC(Cc3ccccc3)CC2)cc(F)c1F ZINC001232969356 1054163246 /nfs/dbraw/zinc/16/32/46/1054163246.db2.gz QMIHBFITFDTXCM-UHFFFAOYSA-N 1 2 317.379 4.125 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232972195 1054163411 /nfs/dbraw/zinc/16/34/11/1054163411.db2.gz VTPZBINJWSQPFO-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232972195 1054163416 /nfs/dbraw/zinc/16/34/16/1054163416.db2.gz VTPZBINJWSQPFO-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1ncc(F)cc1C[N@H+](Cc1ccccc1)Cc1cccnc1 ZINC001232989074 1054166693 /nfs/dbraw/zinc/16/66/93/1054166693.db2.gz MQRCBTOCRDWUKA-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ncc(F)cc1C[N@@H+](Cc1ccccc1)Cc1cccnc1 ZINC001232989074 1054166706 /nfs/dbraw/zinc/16/67/06/1054166706.db2.gz MQRCBTOCRDWUKA-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO F[C@@H]1C[N@H+](Cc2ccc(OC(F)(F)F)cc2Cl)C[C@@H]2C[C@@H]21 ZINC001232992479 1054168499 /nfs/dbraw/zinc/16/84/99/1054168499.db2.gz USMIGJKZCLWCSU-XHVZSJERSA-N 1 2 323.717 4.028 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2ccc(OC(F)(F)F)cc2Cl)C[C@@H]2C[C@@H]21 ZINC001232992479 1054168508 /nfs/dbraw/zinc/16/85/08/1054168508.db2.gz USMIGJKZCLWCSU-XHVZSJERSA-N 1 2 323.717 4.028 20 0 DIADLO CC[C@@H]1CCC[N@H+](Cc2ccc(Cl)c(Br)n2)C1 ZINC001233093328 1054185418 /nfs/dbraw/zinc/18/54/18/1054185418.db2.gz JXBGRUVNPZNLRR-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@@H]1CCC[N@@H+](Cc2ccc(Cl)c(Br)n2)C1 ZINC001233093328 1054185422 /nfs/dbraw/zinc/18/54/22/1054185422.db2.gz JXBGRUVNPZNLRR-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)cn1 ZINC001233009045 1054170501 /nfs/dbraw/zinc/17/05/01/1054170501.db2.gz ZYSULBBTVUNETB-NRFANRHFSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)cn1 ZINC001233009045 1054170510 /nfs/dbraw/zinc/17/05/10/1054170510.db2.gz ZYSULBBTVUNETB-NRFANRHFSA-N 1 2 317.436 4.105 20 0 DIADLO Oc1cnc(Cl)cc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001233038737 1054175040 /nfs/dbraw/zinc/17/50/40/1054175040.db2.gz GUWCKHICPXZIAM-AWEZNQCLSA-N 1 2 324.758 4.056 20 0 DIADLO Oc1cnc(Cl)cc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001233038737 1054175046 /nfs/dbraw/zinc/17/50/46/1054175046.db2.gz GUWCKHICPXZIAM-AWEZNQCLSA-N 1 2 324.758 4.056 20 0 DIADLO CCOc1c(Cl)cc(C[NH+]2CCC(F)CC2)cc1Cl ZINC001233107981 1054185588 /nfs/dbraw/zinc/18/55/88/1054185588.db2.gz QYQKZQXYFHIXLV-UHFFFAOYSA-N 1 2 306.208 4.326 20 0 DIADLO COCC[C@@H]([NH2+]Cc1nc(C)c(C(C)(C)C)s1)c1ccco1 ZINC001334050356 1054179608 /nfs/dbraw/zinc/17/96/08/1054179608.db2.gz ZGKYDYZHUVLGPH-CYBMUJFWSA-N 1 2 322.474 4.209 20 0 DIADLO Clc1sccc1C[N@@H+]1CC[C@@H]1COCc1ccccc1 ZINC001233056448 1054180043 /nfs/dbraw/zinc/18/00/43/1054180043.db2.gz IZOZVTWQNNRDGA-OAHLLOKOSA-N 1 2 307.846 4.193 20 0 DIADLO Clc1sccc1C[N@H+]1CC[C@@H]1COCc1ccccc1 ZINC001233056448 1054180052 /nfs/dbraw/zinc/18/00/52/1054180052.db2.gz IZOZVTWQNNRDGA-OAHLLOKOSA-N 1 2 307.846 4.193 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1cccc(F)c1)c1cnccn1 ZINC000168544349 1054180336 /nfs/dbraw/zinc/18/03/36/1054180336.db2.gz YPVIRQBPUAJLEQ-AUUYWEPGSA-N 1 2 307.372 4.056 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1cccc(F)c1)c1cnccn1 ZINC000168544040 1054180368 /nfs/dbraw/zinc/18/03/68/1054180368.db2.gz YPVIRQBPUAJLEQ-LIRRHRJNSA-N 1 2 307.372 4.056 20 0 DIADLO CCc1ncc(C[NH2+][C@@H](CC(F)(F)F)c2ccccc2C)o1 ZINC001334207194 1054184181 /nfs/dbraw/zinc/18/41/81/1054184181.db2.gz OKLRJBJFZKBMOD-AWEZNQCLSA-N 1 2 312.335 4.329 20 0 DIADLO CCC[C@@H]1CCCC[N@@H+]1Cc1nc(C)sc1Br ZINC001233155020 1054191515 /nfs/dbraw/zinc/19/15/15/1054191515.db2.gz VOKNWFQSKYECEG-LLVKDONJSA-N 1 2 317.296 4.369 20 0 DIADLO CCC[C@@H]1CCCC[N@H+]1Cc1nc(C)sc1Br ZINC001233155020 1054191516 /nfs/dbraw/zinc/19/15/16/1054191516.db2.gz VOKNWFQSKYECEG-LLVKDONJSA-N 1 2 317.296 4.369 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)c1ccc(-c2ccccc2)s1 ZINC001334559709 1054192130 /nfs/dbraw/zinc/19/21/30/1054192130.db2.gz VTSPULHMNBGDIR-UHFFFAOYSA-N 1 2 319.389 4.315 20 0 DIADLO CC(C)Oc1ncc(Cl)cc1C[N@H+](C)Cc1ccc(F)cc1 ZINC001233165130 1054193064 /nfs/dbraw/zinc/19/30/64/1054193064.db2.gz TURAUBYCILTULI-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO CC(C)Oc1ncc(Cl)cc1C[N@@H+](C)Cc1ccc(F)cc1 ZINC001233165130 1054193066 /nfs/dbraw/zinc/19/30/66/1054193066.db2.gz TURAUBYCILTULI-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)cs1 ZINC001233175753 1054195720 /nfs/dbraw/zinc/19/57/20/1054195720.db2.gz QPJPNTISRXIJQH-AOOOYVTPSA-N 1 2 311.319 4.244 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)cs1 ZINC001233175753 1054195729 /nfs/dbraw/zinc/19/57/29/1054195729.db2.gz QPJPNTISRXIJQH-AOOOYVTPSA-N 1 2 311.319 4.244 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2csc(C(F)(F)F)c2)cn1 ZINC001233176386 1054196754 /nfs/dbraw/zinc/19/67/54/1054196754.db2.gz ADJPDKMSGXFOJP-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2csc(C(F)(F)F)c2)cn1 ZINC001233176386 1054196760 /nfs/dbraw/zinc/19/67/60/1054196760.db2.gz ADJPDKMSGXFOJP-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccnc(Cl)c2Br)[C@@H](C)C1 ZINC001233181207 1054198096 /nfs/dbraw/zinc/19/80/96/1054198096.db2.gz HDDANEXFTDHAFY-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccnc(Cl)c2Br)[C@@H](C)C1 ZINC001233181207 1054198099 /nfs/dbraw/zinc/19/80/99/1054198099.db2.gz HDDANEXFTDHAFY-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccnc(Cl)c2Br)[C@@H](C)C1 ZINC001233181213 1054199003 /nfs/dbraw/zinc/19/90/03/1054199003.db2.gz HDDANEXFTDHAFY-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccnc(Cl)c2Br)[C@@H](C)C1 ZINC001233181213 1054199012 /nfs/dbraw/zinc/19/90/12/1054199012.db2.gz HDDANEXFTDHAFY-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccnc(Cl)c1Br ZINC001233178403 1054199400 /nfs/dbraw/zinc/19/94/00/1054199400.db2.gz SHJOLJLTDGWWTF-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ccnc(Cl)c1Br ZINC001233178403 1054199404 /nfs/dbraw/zinc/19/94/04/1054199404.db2.gz SHJOLJLTDGWWTF-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO Fc1c(Cl)ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c1F ZINC001233208035 1054200301 /nfs/dbraw/zinc/20/03/01/1054200301.db2.gz UUALDPXRUBTHML-AOOOYVTPSA-N 1 2 307.718 4.095 20 0 DIADLO Fc1c(Cl)ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c1F ZINC001233208035 1054200314 /nfs/dbraw/zinc/20/03/14/1054200314.db2.gz UUALDPXRUBTHML-AOOOYVTPSA-N 1 2 307.718 4.095 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ccc(Cl)c(F)c2F)c1 ZINC001233210042 1054201836 /nfs/dbraw/zinc/20/18/36/1054201836.db2.gz AWEVFOJECMNARH-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ccc(Cl)c(F)c2F)c1 ZINC001233210042 1054201852 /nfs/dbraw/zinc/20/18/52/1054201852.db2.gz AWEVFOJECMNARH-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(Cl)c(F)c2F)CCC1(F)F ZINC001233208033 1054202032 /nfs/dbraw/zinc/20/20/32/1054202032.db2.gz UOCUTXUPGFFLGO-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(Cl)c(F)c2F)CCC1(F)F ZINC001233208033 1054202044 /nfs/dbraw/zinc/20/20/44/1054202044.db2.gz UOCUTXUPGFFLGO-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)cc1O ZINC001233234972 1054214682 /nfs/dbraw/zinc/21/46/82/1054214682.db2.gz KPMFEYDNWOZPCB-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3cccc(C(F)(F)F)c3C2)cc1O ZINC001233234972 1054214691 /nfs/dbraw/zinc/21/46/91/1054214691.db2.gz KPMFEYDNWOZPCB-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO FC[C@H]1CCC[N@@H+]1Cc1ccc(F)cc1OCc1ccccc1 ZINC001233246096 1054215665 /nfs/dbraw/zinc/21/56/65/1054215665.db2.gz WUHXPIMPUKQXDM-GOSISDBHSA-N 1 2 317.379 4.339 20 0 DIADLO FC[C@H]1CCC[N@H+]1Cc1ccc(F)cc1OCc1ccccc1 ZINC001233246096 1054215676 /nfs/dbraw/zinc/21/56/76/1054215676.db2.gz WUHXPIMPUKQXDM-GOSISDBHSA-N 1 2 317.379 4.339 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2ccsc2Br)C1 ZINC001233479099 1054280971 /nfs/dbraw/zinc/28/09/71/1054280971.db2.gz JOZOSOUFJLLDAV-LBPRGKRZSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cc(Br)ncc2Cl)[C@@H]1C ZINC001233427150 1054270545 /nfs/dbraw/zinc/27/05/45/1054270545.db2.gz LGYDZSPKJAAWIY-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cc(Br)ncc2Cl)[C@@H]1C ZINC001233427150 1054270558 /nfs/dbraw/zinc/27/05/58/1054270558.db2.gz LGYDZSPKJAAWIY-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1cc2c(cn1)C[N@H+](Cc1ccc(Cc3ccccc3)cc1)C2 ZINC001233330966 1054235445 /nfs/dbraw/zinc/23/54/45/1054235445.db2.gz BOJGRBHKWANEIF-UHFFFAOYSA-N 1 2 314.432 4.497 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+](Cc1ccc(Cc3ccccc3)cc1)C2 ZINC001233330966 1054235450 /nfs/dbraw/zinc/23/54/50/1054235450.db2.gz BOJGRBHKWANEIF-UHFFFAOYSA-N 1 2 314.432 4.497 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccccc2F)cc1F ZINC001233343284 1054237843 /nfs/dbraw/zinc/23/78/43/1054237843.db2.gz GXBADUFQQWBWMM-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccccc2F)cc1F ZINC001233343284 1054237860 /nfs/dbraw/zinc/23/78/60/1054237860.db2.gz GXBADUFQQWBWMM-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1cc(F)c(OC)cc1F ZINC001233344288 1054243073 /nfs/dbraw/zinc/24/30/73/1054243073.db2.gz WXJJEXDXHSGSQP-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1cc(F)c(OC)cc1F ZINC001233344288 1054243078 /nfs/dbraw/zinc/24/30/78/1054243078.db2.gz WXJJEXDXHSGSQP-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO FC1(F)CC[C@@H](C[N@@H+]2CCO[C@H](c3ccc(Cl)s3)C2)C1 ZINC001336756924 1054245304 /nfs/dbraw/zinc/24/53/04/1054245304.db2.gz NTVUXQFRDOGSJE-MNOVXSKESA-N 1 2 321.820 4.210 20 0 DIADLO FC1(F)CC[C@@H](C[N@H+]2CCO[C@H](c3ccc(Cl)s3)C2)C1 ZINC001336756924 1054245315 /nfs/dbraw/zinc/24/53/15/1054245315.db2.gz NTVUXQFRDOGSJE-MNOVXSKESA-N 1 2 321.820 4.210 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+]1CCC(=O)[C@H]2CCCC[C@H]21 ZINC001233350935 1054245874 /nfs/dbraw/zinc/24/58/74/1054245874.db2.gz ZTSFSABWZKNMTD-SWLSCSKDSA-N 1 2 323.889 4.396 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+]1CCC(=O)[C@H]2CCCC[C@H]21 ZINC001233350935 1054245884 /nfs/dbraw/zinc/24/58/84/1054245884.db2.gz ZTSFSABWZKNMTD-SWLSCSKDSA-N 1 2 323.889 4.396 20 0 DIADLO Cc1nc(Cl)c(C[N@@H+]2CCC(C)(C)C2)cc1Br ZINC001233467644 1054280531 /nfs/dbraw/zinc/28/05/31/1054280531.db2.gz NGOCLSKYKIZBJO-UHFFFAOYSA-N 1 2 317.658 4.038 20 0 DIADLO Cc1nc(Cl)c(C[N@H+]2CCC(C)(C)C2)cc1Br ZINC001233467644 1054280543 /nfs/dbraw/zinc/28/05/43/1054280543.db2.gz NGOCLSKYKIZBJO-UHFFFAOYSA-N 1 2 317.658 4.038 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1c(Cl)cccc1SC ZINC001233352888 1054248572 /nfs/dbraw/zinc/24/85/72/1054248572.db2.gz XWRZVVFFWZPLCE-UHFFFAOYSA-N 1 2 306.862 4.479 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1c(Cl)cccc1SC ZINC001233352888 1054248584 /nfs/dbraw/zinc/24/85/84/1054248584.db2.gz XWRZVVFFWZPLCE-UHFFFAOYSA-N 1 2 306.862 4.479 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1c(F)ccc(O)c1F ZINC001233396477 1054260594 /nfs/dbraw/zinc/26/05/94/1054260594.db2.gz FIOCQZHRIKSAKK-INIZCTEOSA-N 1 2 303.352 4.180 20 0 DIADLO CC(C)(C)C1CC[NH+](Cc2c(Cl)ncnc2Cl)CC1 ZINC001233407575 1054261380 /nfs/dbraw/zinc/26/13/80/1054261380.db2.gz KAKXRFGJTQZSBR-UHFFFAOYSA-N 1 2 302.249 4.042 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3ccccc3[C@H]2C)c(Cl)c1O ZINC001233397857 1054261444 /nfs/dbraw/zinc/26/14/44/1054261444.db2.gz ODERXYUKLFHHEA-GFCCVEGCSA-N 1 2 317.816 4.174 20 0 DIADLO Cc1ccc(N[C@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)c(C)[nH+]1 ZINC001337320626 1054263487 /nfs/dbraw/zinc/26/34/87/1054263487.db2.gz INFPBKQSJNYLLP-GFCCVEGCSA-N 1 2 309.413 4.101 20 0 DIADLO COc1cc(F)c([C@H](C)Nc2ccc(C)[nH+]c2C)cc1OC ZINC001337320399 1054263809 /nfs/dbraw/zinc/26/38/09/1054263809.db2.gz HQADGCJUCJPJBO-NSHDSACASA-N 1 2 304.365 4.028 20 0 DIADLO CC[N@H+](Cc1cn2cccc(Cl)c2n1)Cc1ccccc1F ZINC001233422921 1054268459 /nfs/dbraw/zinc/26/84/59/1054268459.db2.gz AEQCMIAEZXQNDZ-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO CC[N@@H+](Cc1cn2cccc(Cl)c2n1)Cc1ccccc1F ZINC001233422921 1054268466 /nfs/dbraw/zinc/26/84/66/1054268466.db2.gz AEQCMIAEZXQNDZ-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO CC[C@@H]1CCC[N@H+](Cc2cc(Br)ncc2Cl)C1 ZINC001233428536 1054269078 /nfs/dbraw/zinc/26/90/78/1054269078.db2.gz QADIZLWMSFLZES-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@@H]1CCC[N@@H+](Cc2cc(Br)ncc2Cl)C1 ZINC001233428536 1054269082 /nfs/dbraw/zinc/26/90/82/1054269082.db2.gz QADIZLWMSFLZES-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cc(Br)ncc1Cl ZINC001233428152 1054270041 /nfs/dbraw/zinc/27/00/41/1054270041.db2.gz ZMGIVKJBSDCQAZ-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cc(Br)ncc1Cl ZINC001233428152 1054270048 /nfs/dbraw/zinc/27/00/48/1054270048.db2.gz ZMGIVKJBSDCQAZ-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1ncoc1C(C)C)[C@@H]2C ZINC001337548144 1054272914 /nfs/dbraw/zinc/27/29/14/1054272914.db2.gz DLXLGKFESDBQRW-UONOGXRCSA-N 1 2 314.429 4.314 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1ncoc1C(C)C)[C@@H]2C ZINC001337548144 1054272929 /nfs/dbraw/zinc/27/29/29/1054272929.db2.gz DLXLGKFESDBQRW-UONOGXRCSA-N 1 2 314.429 4.314 20 0 DIADLO C[C@@H]1CCC[N@@H+]1Cc1cc(Br)c(Cl)cc1F ZINC001233439107 1054273008 /nfs/dbraw/zinc/27/30/08/1054273008.db2.gz RWMQJQWBHGCYSW-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@@H]1CCC[N@H+]1Cc1cc(Br)c(Cl)cc1F ZINC001233439107 1054273021 /nfs/dbraw/zinc/27/30/21/1054273021.db2.gz RWMQJQWBHGCYSW-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO Cc1cc2c(cn1)C[N@H+](Cc1ccc3nc(Cl)ccc3c1)C2 ZINC001233445133 1054276842 /nfs/dbraw/zinc/27/68/42/1054276842.db2.gz RYMQTKMDIFARNL-UHFFFAOYSA-N 1 2 309.800 4.107 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+](Cc1ccc3nc(Cl)ccc3c1)C2 ZINC001233445133 1054276851 /nfs/dbraw/zinc/27/68/51/1054276851.db2.gz RYMQTKMDIFARNL-UHFFFAOYSA-N 1 2 309.800 4.107 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2ccsc2Br)C1 ZINC001233479099 1054280957 /nfs/dbraw/zinc/28/09/57/1054280957.db2.gz JOZOSOUFJLLDAV-LBPRGKRZSA-N 1 2 306.244 4.225 20 0 DIADLO Cc1nc(Cl)c(C[NH+]2CCCCCC2)cc1Br ZINC001233465263 1054280929 /nfs/dbraw/zinc/28/09/29/1054280929.db2.gz AZGVBPMESSCGCF-UHFFFAOYSA-N 1 2 317.658 4.182 20 0 DIADLO CCC[C@H](C)CC(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001338443094 1054305319 /nfs/dbraw/zinc/30/53/19/1054305319.db2.gz HXIKEYPJXOWASS-HOTGVXAUSA-N 1 2 319.493 4.170 20 0 DIADLO CCC[C@H](C)CC(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001338443396 1054306563 /nfs/dbraw/zinc/30/65/63/1054306563.db2.gz HXIKEYPJXOWASS-JKSUJKDBSA-N 1 2 319.493 4.170 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1ccc(C)[nH+]c1C)CCS2 ZINC001338751137 1054311436 /nfs/dbraw/zinc/31/14/36/1054311436.db2.gz XCCBUTVMUPBPPH-INIZCTEOSA-N 1 2 300.427 4.356 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)[C@@H](C)C(C)(C)C ZINC001356297762 1054316199 /nfs/dbraw/zinc/31/61/99/1054316199.db2.gz YRWFIHLOCICQIW-CHWSQXEVSA-N 1 2 317.408 4.268 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC001338992552 1054320437 /nfs/dbraw/zinc/32/04/37/1054320437.db2.gz LMIQEQJXJGEGOW-LLVKDONJSA-N 1 2 323.223 4.169 20 0 DIADLO Cc1cc(C[NH+](Cc2ccccn2)Cc2ccccn2)sc1C ZINC001233645176 1054320598 /nfs/dbraw/zinc/32/05/98/1054320598.db2.gz FQQQIAVGXVHLJM-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)CC(C1CC1)C1CC1 ZINC001339688889 1054347378 /nfs/dbraw/zinc/34/73/78/1054347378.db2.gz PFHDYBZKSOTNCR-UHFFFAOYSA-N 1 2 309.413 4.150 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)N1CCC(c2c[nH+]cn2C)CC1 ZINC001341096778 1054377633 /nfs/dbraw/zinc/37/76/33/1054377633.db2.gz ZKTZRYGOZAMACC-MRXNPFEDSA-N 1 2 319.493 4.123 20 0 DIADLO Clc1sccc1CNc1ccc(N2CCCCC2)c[nH+]1 ZINC000478574349 1054387591 /nfs/dbraw/zinc/38/75/91/1054387591.db2.gz FTVBNFGBZAYFRR-UHFFFAOYSA-N 1 2 307.850 4.399 20 0 DIADLO Cc1cccc2nc(NC3CCN(c4cccc[nH+]4)CC3)sc21 ZINC000479388342 1054389906 /nfs/dbraw/zinc/38/99/06/1054389906.db2.gz BQZDIGWNHMMSBY-UHFFFAOYSA-N 1 2 324.453 4.081 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@H]2c2ccc(F)cc2F)c(C)[nH+]1 ZINC000171916898 1054396372 /nfs/dbraw/zinc/39/63/72/1054396372.db2.gz IREMTBBFMMOGPS-GJZGRUSLSA-N 1 2 316.351 4.027 20 0 DIADLO CC(C)n1ccc(C[N@H+](C)Cc2cccc(C(F)(F)F)c2)n1 ZINC000172012298 1054401068 /nfs/dbraw/zinc/40/10/68/1054401068.db2.gz LICONWHZQHTADQ-UHFFFAOYSA-N 1 2 311.351 4.115 20 0 DIADLO CC(C)n1ccc(C[N@@H+](C)Cc2cccc(C(F)(F)F)c2)n1 ZINC000172012298 1054401074 /nfs/dbraw/zinc/40/10/74/1054401074.db2.gz LICONWHZQHTADQ-UHFFFAOYSA-N 1 2 311.351 4.115 20 0 DIADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccc(Oc2cc(C)cc(C)c2)cc1 ZINC001441949808 1054403843 /nfs/dbraw/zinc/40/38/43/1054403843.db2.gz KJSHRLALGUBREA-LJQANCHMSA-N 1 2 324.424 4.128 20 0 DIADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccc(Oc2cc(C)cc(C)c2)cc1 ZINC001441949808 1054403846 /nfs/dbraw/zinc/40/38/46/1054403846.db2.gz KJSHRLALGUBREA-LJQANCHMSA-N 1 2 324.424 4.128 20 0 DIADLO COc1ccccc1CNc1cc(C)c(Br)c(C)[nH+]1 ZINC001342076123 1054414976 /nfs/dbraw/zinc/41/49/76/1054414976.db2.gz BJWNTWNVRBKJCI-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO Cc1cc(N2CC3(CCC3)[C@@H]2c2ccncc2)nc(C2CCC2)[nH+]1 ZINC001343189525 1054439857 /nfs/dbraw/zinc/43/98/57/1054439857.db2.gz SCLULTXPJHVEHZ-SFHVURJKSA-N 1 2 320.440 4.179 20 0 DIADLO C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001357253878 1054445693 /nfs/dbraw/zinc/44/56/93/1054445693.db2.gz HFHAFBOXXVJEKF-OCCSQVGLSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2CCC(C)=C(C)C2)ccc1-n1cc[nH+]c1 ZINC001443310710 1054445698 /nfs/dbraw/zinc/44/56/98/1054445698.db2.gz KQXCUFGZQJPABS-MRXNPFEDSA-N 1 2 309.413 4.256 20 0 DIADLO CCC[C@@H](CC)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001357253221 1054445715 /nfs/dbraw/zinc/44/57/15/1054445715.db2.gz AEAHPPSSLPCXNH-GFCCVEGCSA-N 1 2 305.809 4.291 20 0 DIADLO C[C@@H](c1noc(-c2ccccc2)n1)[N@@H+]1CCCc2ccccc2C1 ZINC000671241063 1054456976 /nfs/dbraw/zinc/45/69/76/1054456976.db2.gz JXACTZNPUBEFLY-HNNXBMFYSA-N 1 2 319.408 4.246 20 0 DIADLO C[C@@H](c1noc(-c2ccccc2)n1)[N@H+]1CCCc2ccccc2C1 ZINC000671241063 1054456987 /nfs/dbraw/zinc/45/69/87/1054456987.db2.gz JXACTZNPUBEFLY-HNNXBMFYSA-N 1 2 319.408 4.246 20 0 DIADLO CC[N@H+](Cc1conc1Cc1ccccc1)Cc1ccccc1F ZINC001343960910 1054459040 /nfs/dbraw/zinc/45/90/40/1054459040.db2.gz DQTXDUUVVQANAZ-UHFFFAOYSA-N 1 2 324.399 4.427 20 0 DIADLO CC[N@@H+](Cc1conc1Cc1ccccc1)Cc1ccccc1F ZINC001343960910 1054459046 /nfs/dbraw/zinc/45/90/46/1054459046.db2.gz DQTXDUUVVQANAZ-UHFFFAOYSA-N 1 2 324.399 4.427 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)c1ccc(-c2ccccc2)s1 ZINC001344874117 1054482461 /nfs/dbraw/zinc/48/24/61/1054482461.db2.gz XIPATQKPQIWHTL-UHFFFAOYSA-N 1 2 319.389 4.315 20 0 DIADLO CCO[C@@H](C)c1noc(C[NH2+][C@@H](CC)c2cccc(Cl)c2)n1 ZINC000173449595 1054483834 /nfs/dbraw/zinc/48/38/34/1054483834.db2.gz OZWKLBYTSVKHBU-FZMZJTMJSA-N 1 2 323.824 4.061 20 0 DIADLO CCO[C@@H](C)c1noc(C[NH2+][C@H](CC)c2cccc(Cl)c2)n1 ZINC000173449609 1054484082 /nfs/dbraw/zinc/48/40/82/1054484082.db2.gz OZWKLBYTSVKHBU-SMDDNHRTSA-N 1 2 323.824 4.061 20 0 DIADLO COc1c(Cl)cccc1C[NH2+]Cc1csc(C(C)C)n1 ZINC001345091047 1054486552 /nfs/dbraw/zinc/48/65/52/1054486552.db2.gz PIFULYBECIZBPO-UHFFFAOYSA-N 1 2 310.850 4.218 20 0 DIADLO CC[C@H](c1ccccc1)N(C(=O)CCCn1cc[nH+]c1)C(C)C ZINC000622975643 1054496077 /nfs/dbraw/zinc/49/60/77/1054496077.db2.gz QCOXCRVLDNDZIE-GOSISDBHSA-N 1 2 313.445 4.052 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@@H]1CCC[C@@H]2CCCC[C@H]12 ZINC001357549326 1054498573 /nfs/dbraw/zinc/49/85/73/1054498573.db2.gz DPQRHVOERJBWHR-ZYSHUDEJSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+]Cc3nccn3CC(C)C)o2)cc1 ZINC000174455451 1054507991 /nfs/dbraw/zinc/50/79/91/1054507991.db2.gz FTGARKFGXCEPIA-UHFFFAOYSA-N 1 2 323.440 4.397 20 0 DIADLO CC[N@H+](Cc1ccn(-c2ccccc2)n1)[C@H](C)c1cccc(O)c1 ZINC000174621256 1054513061 /nfs/dbraw/zinc/51/30/61/1054513061.db2.gz ZZIQQLXLPSIHRT-MRXNPFEDSA-N 1 2 321.424 4.161 20 0 DIADLO CC[N@@H+](Cc1ccn(-c2ccccc2)n1)[C@H](C)c1cccc(O)c1 ZINC000174621256 1054513079 /nfs/dbraw/zinc/51/30/79/1054513079.db2.gz ZZIQQLXLPSIHRT-MRXNPFEDSA-N 1 2 321.424 4.161 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc2ccccc2c1)c1nc(C(C)(C)C)no1 ZINC000174662963 1054513516 /nfs/dbraw/zinc/51/35/16/1054513516.db2.gz ISXHYUIGJHTYDK-CYBMUJFWSA-N 1 2 309.413 4.371 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2cc3ccccc3o2)nc2ccccc12 ZINC000175175389 1054520990 /nfs/dbraw/zinc/52/09/90/1054520990.db2.gz KPGFKMDZCUFQNA-UHFFFAOYSA-N 1 2 317.392 4.316 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2cc3ccccc3o2)nc2ccccc12 ZINC000175175389 1054520994 /nfs/dbraw/zinc/52/09/94/1054520994.db2.gz KPGFKMDZCUFQNA-UHFFFAOYSA-N 1 2 317.392 4.316 20 0 DIADLO CC(C)c1ccc(NC(=O)CCc2[nH+]ccn2C)c(C(C)C)c1 ZINC001346173097 1054529335 /nfs/dbraw/zinc/52/93/35/1054529335.db2.gz KMBRROVLQBHGRM-UHFFFAOYSA-N 1 2 313.445 4.238 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1nc(-c2cccs2)oc1C ZINC000623120927 1054533886 /nfs/dbraw/zinc/53/38/86/1054533886.db2.gz NOPKIJFOKOMQFD-UHFFFAOYSA-N 1 2 318.364 4.486 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1nc(-c2cccs2)oc1C ZINC000623120927 1054533902 /nfs/dbraw/zinc/53/39/02/1054533902.db2.gz NOPKIJFOKOMQFD-UHFFFAOYSA-N 1 2 318.364 4.486 20 0 DIADLO CC[N@H+](CCC(F)(F)F)CC(=O)Nc1cccc(C(C)C)c1 ZINC000623121140 1054534566 /nfs/dbraw/zinc/53/45/66/1054534566.db2.gz RMEOYBDUBOUPHN-UHFFFAOYSA-N 1 2 316.367 4.023 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)CC(=O)Nc1cccc(C(C)C)c1 ZINC000623121140 1054534580 /nfs/dbraw/zinc/53/45/80/1054534580.db2.gz RMEOYBDUBOUPHN-UHFFFAOYSA-N 1 2 316.367 4.023 20 0 DIADLO CC[N@H+](CCC(F)(F)F)CC(=O)Nc1ccccc1C(C)C ZINC000623121837 1054535221 /nfs/dbraw/zinc/53/52/21/1054535221.db2.gz ONWKAXWZZQHCLB-UHFFFAOYSA-N 1 2 316.367 4.023 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)CC(=O)Nc1ccccc1C(C)C ZINC000623121837 1054535236 /nfs/dbraw/zinc/53/52/36/1054535236.db2.gz ONWKAXWZZQHCLB-UHFFFAOYSA-N 1 2 316.367 4.023 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@@H]2CCCN(c3ccccc3)C2)cc1 ZINC001234588427 1054551517 /nfs/dbraw/zinc/55/15/17/1054551517.db2.gz NXZHWOGXBIITMA-LJQANCHMSA-N 1 2 324.424 4.096 20 0 DIADLO Clc1ccc(Br)c(C[NH+]2CCCC2)c1Cl ZINC001238288071 1054585778 /nfs/dbraw/zinc/58/57/78/1054585778.db2.gz IYSPARBOAGEGAO-UHFFFAOYSA-N 1 2 309.034 4.352 20 0 DIADLO c1cc2cccc(C[N@@H+]3CCCC[C@@H]3c3noc(C4CC4)n3)c2o1 ZINC001347782466 1054582812 /nfs/dbraw/zinc/58/28/12/1054582812.db2.gz OQACFDHYNXBLSI-MRXNPFEDSA-N 1 2 323.396 4.420 20 0 DIADLO c1cc2cccc(C[N@H+]3CCCC[C@@H]3c3noc(C4CC4)n3)c2o1 ZINC001347782466 1054582825 /nfs/dbraw/zinc/58/28/25/1054582825.db2.gz OQACFDHYNXBLSI-MRXNPFEDSA-N 1 2 323.396 4.420 20 0 DIADLO C/C=C(/C=C/C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1)CC ZINC001449817542 1054631451 /nfs/dbraw/zinc/63/14/51/1054631451.db2.gz MINJIHYUAOGDOQ-KQANTMRISA-N 1 2 309.413 4.152 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cncc(Br)c2)[C@@H]1c1ccccc1 ZINC000177828154 1054636941 /nfs/dbraw/zinc/63/69/41/1054636941.db2.gz JEOARSYFUGSIOY-WBMJQRKESA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cncc(Br)c2)[C@@H]1c1ccccc1 ZINC000177828154 1054636948 /nfs/dbraw/zinc/63/69/48/1054636948.db2.gz JEOARSYFUGSIOY-WBMJQRKESA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1c[nH]c(-c2ccccc2F)c1 ZINC001235041969 1054645762 /nfs/dbraw/zinc/64/57/62/1054645762.db2.gz FUGXYVHQXCTSLM-AWEZNQCLSA-N 1 2 309.388 4.199 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1c[nH]c(-c2ccccc2F)c1 ZINC001235041969 1054645773 /nfs/dbraw/zinc/64/57/73/1054645773.db2.gz FUGXYVHQXCTSLM-AWEZNQCLSA-N 1 2 309.388 4.199 20 0 DIADLO C[C@@H]([NH2+]Cc1ccon1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000178262148 1054648378 /nfs/dbraw/zinc/64/83/78/1054648378.db2.gz KMWQWTNODNIANJ-CYBMUJFWSA-N 1 2 312.344 4.457 20 0 DIADLO CCCCC[C@H](C(=O)Nc1ccc2[nH+]c(C)cn2c1)C(C)C ZINC001358364255 1054665814 /nfs/dbraw/zinc/66/58/14/1054665814.db2.gz UKHVHHMRSBSVDD-INIZCTEOSA-N 1 2 301.434 4.434 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000179138226 1054667178 /nfs/dbraw/zinc/66/71/78/1054667178.db2.gz CUZLCCHKIPHNEH-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000179138226 1054667188 /nfs/dbraw/zinc/66/71/88/1054667188.db2.gz CUZLCCHKIPHNEH-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO CC/C(C)=C(\C)C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001348644592 1054669550 /nfs/dbraw/zinc/66/95/50/1054669550.db2.gz OFIXJGXKBXQRFT-UTZKEFOASA-N 1 2 317.477 4.091 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2cccc(OC(C)C)c2)sc1C ZINC000179429519 1054680788 /nfs/dbraw/zinc/68/07/88/1054680788.db2.gz OGRSKNWPBWOQMW-UHFFFAOYSA-N 1 2 304.459 4.179 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2cccc(OC(C)C)c2)sc1C ZINC000179429519 1054680793 /nfs/dbraw/zinc/68/07/93/1054680793.db2.gz OGRSKNWPBWOQMW-UHFFFAOYSA-N 1 2 304.459 4.179 20 0 DIADLO CC[C@H]([NH2+]Cc1noc2c1CCCC2)c1ccc(F)cc1F ZINC000179629213 1054691743 /nfs/dbraw/zinc/69/17/43/1054691743.db2.gz FPMJGKWBTFTRLV-HNNXBMFYSA-N 1 2 306.356 4.073 20 0 DIADLO CCc1cccc(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)n1 ZINC001235250046 1054691689 /nfs/dbraw/zinc/69/16/89/1054691689.db2.gz HKSMJPPCJBWEJR-OAQYLSRUSA-N 1 2 317.436 4.051 20 0 DIADLO CCc1cccc(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)n1 ZINC001235250046 1054691695 /nfs/dbraw/zinc/69/16/95/1054691695.db2.gz HKSMJPPCJBWEJR-OAQYLSRUSA-N 1 2 317.436 4.051 20 0 DIADLO CCO[C@@H](C)c1nc(C[NH2+]C2(c3cccc(F)c3)CC2)cs1 ZINC000179694030 1054696883 /nfs/dbraw/zinc/69/68/83/1054696883.db2.gz GXPAFKDGVLUDSW-LBPRGKRZSA-N 1 2 320.433 4.159 20 0 DIADLO Cc1cc(C[NH2+][C@@H](Cc2ccccc2)c2ccccc2F)no1 ZINC000179811326 1054706162 /nfs/dbraw/zinc/70/61/62/1054706162.db2.gz LZNHHBBYJRJWJD-IBGZPJMESA-N 1 2 310.372 4.196 20 0 DIADLO Cc1nc(C)c([C@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)s1 ZINC000179918692 1054716021 /nfs/dbraw/zinc/71/60/21/1054716021.db2.gz JHUTUQKCQZAGRG-ZDUSSCGKSA-N 1 2 316.474 4.318 20 0 DIADLO Clc1cc(C[NH+]2CCC3(CCO3)CC2)cc(Cl)c1Cl ZINC001235599865 1054749487 /nfs/dbraw/zinc/74/94/87/1054749487.db2.gz XLANKCCGDYFAAY-UHFFFAOYSA-N 1 2 320.647 4.402 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@H]1CCCc2c3cc(Cl)ccc3[nH]c21 ZINC000623754471 1054729645 /nfs/dbraw/zinc/72/96/45/1054729645.db2.gz OUULIKGLJJSFIM-INIZCTEOSA-N 1 2 314.820 4.020 20 0 DIADLO Fc1cncc(C[NH+]2CCC(c3cccs3)CC2)c1Cl ZINC001235493377 1054730254 /nfs/dbraw/zinc/73/02/54/1054730254.db2.gz ACLKULXZTBKBFT-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cncc(F)c2Cl)c1 ZINC001235501098 1054732722 /nfs/dbraw/zinc/73/27/22/1054732722.db2.gz VVENFWVLYWWMMP-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2cncc(F)c2Cl)c1 ZINC001235501098 1054732737 /nfs/dbraw/zinc/73/27/37/1054732737.db2.gz VVENFWVLYWWMMP-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2cncc(F)c2Cl)cc1 ZINC001235501236 1054733033 /nfs/dbraw/zinc/73/30/33/1054733033.db2.gz WTKSLGZVAIKPTI-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2cncc(F)c2Cl)cc1 ZINC001235501236 1054733051 /nfs/dbraw/zinc/73/30/51/1054733051.db2.gz WTKSLGZVAIKPTI-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO CC[N@H+](Cc1c(C)ncn1C)Cc1ccc(Cl)cc1Cl ZINC001235557806 1054740588 /nfs/dbraw/zinc/74/05/88/1054740588.db2.gz WRZUMERDSMHQFM-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO CC[N@@H+](Cc1c(C)ncn1C)Cc1ccc(Cl)cc1Cl ZINC001235557806 1054740601 /nfs/dbraw/zinc/74/06/01/1054740601.db2.gz WRZUMERDSMHQFM-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO c1coc([C@@H]([NH2+]Cc2ccnn2C2CCC2)c2ccccc2)c1 ZINC000921508221 1054745427 /nfs/dbraw/zinc/74/54/27/1054745427.db2.gz BFKYVUOQSPIXTK-IBGZPJMESA-N 1 2 307.397 4.080 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2nccc(C)c2Cl)cc1 ZINC001235588624 1054746445 /nfs/dbraw/zinc/74/64/45/1054746445.db2.gz OHLDMNOFNUGJJX-CYBMUJFWSA-N 1 2 304.821 4.245 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2nccc(C)c2Cl)cc1 ZINC001235588624 1054746456 /nfs/dbraw/zinc/74/64/56/1054746456.db2.gz OHLDMNOFNUGJJX-CYBMUJFWSA-N 1 2 304.821 4.245 20 0 DIADLO CO[C@@H](C)C1C[NH+](Cc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC001235597531 1054750589 /nfs/dbraw/zinc/75/05/89/1054750589.db2.gz LYYVBHAUEZXJQX-QMMMGPOBSA-N 1 2 308.636 4.114 20 0 DIADLO C[N@H+](Cc1cncnc1)Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235596484 1054750624 /nfs/dbraw/zinc/75/06/24/1054750624.db2.gz CRIOLWJYYACSFR-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO C[N@@H+](Cc1cncnc1)Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235596484 1054750639 /nfs/dbraw/zinc/75/06/39/1054750639.db2.gz CRIOLWJYYACSFR-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2csc(C3CC3)n2)c1C ZINC000180415072 1054755090 /nfs/dbraw/zinc/75/50/90/1054755090.db2.gz PQXGHVUCAMSAQB-UHFFFAOYSA-N 1 2 320.483 4.474 20 0 DIADLO CC[C@]1(C)C[N@@H+]([C@@H](C)c2ccc(Br)cc2)CCO1 ZINC001307688070 1054757374 /nfs/dbraw/zinc/75/73/74/1054757374.db2.gz KGFISPDOZZHQIT-SWLSCSKDSA-N 1 2 312.251 4.011 20 0 DIADLO CC[C@]1(C)C[N@H+]([C@@H](C)c2ccc(Br)cc2)CCO1 ZINC001307688070 1054757389 /nfs/dbraw/zinc/75/73/89/1054757389.db2.gz KGFISPDOZZHQIT-SWLSCSKDSA-N 1 2 312.251 4.011 20 0 DIADLO CCCC[C@H](CC)C(=O)N1CC[NH2+][C@H](c2ccc(Cl)cc2)C1 ZINC001454259511 1054761757 /nfs/dbraw/zinc/76/17/57/1054761757.db2.gz XPRGGOADGUQTAH-YOEHRIQHSA-N 1 2 322.880 4.029 20 0 DIADLO Fc1ccc2nc(C[NH+]3CCC4(CCCCC4)CC3)[nH]c2c1 ZINC001235682488 1054775829 /nfs/dbraw/zinc/77/58/29/1054775829.db2.gz KMVAGKNNRKNXAA-UHFFFAOYSA-N 1 2 301.409 4.248 20 0 DIADLO CCC/C(C)=C/C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001349682078 1054785202 /nfs/dbraw/zinc/78/52/02/1054785202.db2.gz LAILHFFWPQVASS-RBFDBLARSA-N 1 2 317.477 4.091 20 0 DIADLO Cc1ncc(CNc2[nH+]c3ccccc3n2C(C)(C)C)s1 ZINC001349761322 1054792329 /nfs/dbraw/zinc/79/23/29/1054792329.db2.gz BZNVGHVYHBTAKE-UHFFFAOYSA-N 1 2 300.431 4.168 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2c(F)cc(Cl)cc2Cl)[C@@H](C)C1 ZINC001235740701 1054796095 /nfs/dbraw/zinc/79/60/95/1054796095.db2.gz BQISLLMTCPZJOX-GXSJLCMTSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2c(F)cc(Cl)cc2Cl)[C@@H](C)C1 ZINC001235740701 1054796111 /nfs/dbraw/zinc/79/61/11/1054796111.db2.gz BQISLLMTCPZJOX-GXSJLCMTSA-N 1 2 306.208 4.132 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(OCc3ccccc3)c(F)c2)C[C@@H]1F ZINC001235765223 1054801172 /nfs/dbraw/zinc/80/11/72/1054801172.db2.gz HDHFZRILKRNIAZ-KDOFPFPSSA-N 1 2 317.379 4.195 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(OCc3ccccc3)c(F)c2)C[C@@H]1F ZINC001235765223 1054801178 /nfs/dbraw/zinc/80/11/78/1054801178.db2.gz HDHFZRILKRNIAZ-KDOFPFPSSA-N 1 2 317.379 4.195 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1cc(-c2ccccc2)n(C)n1 ZINC000623894240 1054804892 /nfs/dbraw/zinc/80/48/92/1054804892.db2.gz NKBYHOWEYXSZKW-QWHCGFSZSA-N 1 2 324.428 4.104 20 0 DIADLO CC(C)COc1ccccc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000623869970 1054805056 /nfs/dbraw/zinc/80/50/56/1054805056.db2.gz MGZYNFXJQJUDJE-OAHLLOKOSA-N 1 2 316.470 4.345 20 0 DIADLO c1nc2c(s1)CCC[C@H]2[NH2+]Cc1ccccc1OCC1CC1 ZINC000623897166 1054805761 /nfs/dbraw/zinc/80/57/61/1054805761.db2.gz HVODZSJVXRRMOO-OAHLLOKOSA-N 1 2 314.454 4.099 20 0 DIADLO C[C@@H](Nc1[nH+]c2ccccc2n1C)c1ccccc1OC(F)F ZINC000534243421 1054816000 /nfs/dbraw/zinc/81/60/00/1054816000.db2.gz YVYOLPWKEDBBST-LLVKDONJSA-N 1 2 317.339 4.348 20 0 DIADLO CC(C)c1cc(NCCc2c[nH]c3ncccc23)nc(C(C)C)[nH+]1 ZINC000535594765 1054819923 /nfs/dbraw/zinc/81/99/23/1054819923.db2.gz BVDSTAANYHTJTB-UHFFFAOYSA-N 1 2 323.444 4.254 20 0 DIADLO CC(C)c1cc(N[C@H](C)COCC(F)(F)F)nc(C(C)C)[nH+]1 ZINC000535592656 1054820872 /nfs/dbraw/zinc/82/08/72/1054820872.db2.gz FCIMKWSAXTZTQK-LLVKDONJSA-N 1 2 319.371 4.103 20 0 DIADLO Cc1nc2cc(C[N@@H+]3CCCC(F)(F)[C@H](F)C3)ccc2s1 ZINC001235851346 1054821306 /nfs/dbraw/zinc/82/13/06/1054821306.db2.gz WMIAILFJTDVWMT-CQSZACIVSA-N 1 2 314.376 4.174 20 0 DIADLO Cc1nc2cc(C[N@H+]3CCCC(F)(F)[C@H](F)C3)ccc2s1 ZINC001235851346 1054821316 /nfs/dbraw/zinc/82/13/16/1054821316.db2.gz WMIAILFJTDVWMT-CQSZACIVSA-N 1 2 314.376 4.174 20 0 DIADLO Cc1csc([C@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)n1 ZINC000623932611 1054822413 /nfs/dbraw/zinc/82/24/13/1054822413.db2.gz VUFQYFINLNNQNU-ZDUSSCGKSA-N 1 2 302.447 4.010 20 0 DIADLO C[C@H]([NH2+][C@H]1CC[C@H](c2cccc(Cl)c2)C1)C(=O)OC(C)(C)C ZINC001474575509 1054826273 /nfs/dbraw/zinc/82/62/73/1054826273.db2.gz KOCBMTJSUUCBLI-NOLJZWGESA-N 1 2 323.864 4.296 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc3sc(C)nc3c1)C2 ZINC001235859368 1054826617 /nfs/dbraw/zinc/82/66/17/1054826617.db2.gz QCKASBHNRMJAEF-UHFFFAOYSA-N 1 2 310.422 4.129 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc3sc(C)nc3c1)C2 ZINC001235859368 1054826619 /nfs/dbraw/zinc/82/66/19/1054826619.db2.gz QCKASBHNRMJAEF-UHFFFAOYSA-N 1 2 310.422 4.129 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1nc(C)cs1)c1cccc(Cl)c1 ZINC000623985028 1054839412 /nfs/dbraw/zinc/83/94/12/1054839412.db2.gz BVWQQDZPLFCGBP-FZMZJTMJSA-N 1 2 310.850 4.143 20 0 DIADLO C[C@H](CC(=O)Nc1cccc(Oc2ccccc2)c1)n1cc[nH+]c1 ZINC001350023226 1054851352 /nfs/dbraw/zinc/85/13/52/1054851352.db2.gz DHSPSJXHYFMQCM-OAHLLOKOSA-N 1 2 321.380 4.265 20 0 DIADLO c1ccc2c(c1)COC21CCN(c2[nH+]ccc3ccccc32)CC1 ZINC000624036397 1054862423 /nfs/dbraw/zinc/86/24/23/1054862423.db2.gz KEGHAKCEMOFHHW-UHFFFAOYSA-N 1 2 316.404 4.261 20 0 DIADLO C[C@@H]([NH2+]Cc1c(Cl)oc2ccccc21)c1cc2n(n1)CCC2 ZINC000624109281 1054879326 /nfs/dbraw/zinc/87/93/26/1054879326.db2.gz RYCVRSSWLQFQHR-LLVKDONJSA-N 1 2 315.804 4.080 20 0 DIADLO C[C@@H]([NH2+][C@H](CCc1ccccc1)C(F)F)c1cccc(CO)c1 ZINC000624125067 1054884266 /nfs/dbraw/zinc/88/42/66/1054884266.db2.gz SBSNJXAVHFFRGO-RDTXWAMCSA-N 1 2 319.395 4.096 20 0 DIADLO CCC(F)(F)C[NH2+][C@H](Cc1ccncc1)c1ccc(OC)cc1 ZINC000624148907 1054890673 /nfs/dbraw/zinc/89/06/73/1054890673.db2.gz QWFRRSFJIOGBIK-QGZVFWFLSA-N 1 2 320.383 4.009 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](c2cccc(F)c2)C(C)(C)C)n1 ZINC000181055010 1054901182 /nfs/dbraw/zinc/90/11/82/1054901182.db2.gz UCLBJFUKCUABFX-KRWDZBQOSA-N 1 2 319.424 4.428 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000181147519 1054906091 /nfs/dbraw/zinc/90/60/91/1054906091.db2.gz RYHPKCFDSCSEJT-MGPUTAFESA-N 1 2 322.408 4.136 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000181147519 1054906106 /nfs/dbraw/zinc/90/61/06/1054906106.db2.gz RYHPKCFDSCSEJT-MGPUTAFESA-N 1 2 322.408 4.136 20 0 DIADLO c1cc(-c2ccc(-c3cc[nH+]c(N4CCCC4)c3)cc2)ccn1 ZINC001236037853 1054906598 /nfs/dbraw/zinc/90/65/98/1054906598.db2.gz AICXZWOSJHNNFP-UHFFFAOYSA-N 1 2 301.393 4.411 20 0 DIADLO CCCc1noc(C[NH2+]C2(c3cccc(Cl)c3)CCCC2)n1 ZINC000181456071 1054915867 /nfs/dbraw/zinc/91/58/67/1054915867.db2.gz JWJLFNMPYLGTJJ-UHFFFAOYSA-N 1 2 319.836 4.235 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1c(C)cc(OC(C)C)cc1C ZINC001236078959 1054930571 /nfs/dbraw/zinc/93/05/71/1054930571.db2.gz HFRXJOWWACKGEM-UHFFFAOYSA-N 1 2 310.397 4.414 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1ncc(Cl)cc1Cl ZINC000181941362 1054947466 /nfs/dbraw/zinc/94/74/66/1054947466.db2.gz OEQRQDOZPPOLLR-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1ncc(Cl)cc1Cl ZINC000181941362 1054947478 /nfs/dbraw/zinc/94/74/78/1054947478.db2.gz OEQRQDOZPPOLLR-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO Nc1ccc2c(c1)CC[N@@H+](Cc1c(Cl)cccc1Cl)C2 ZINC001236105872 1054948345 /nfs/dbraw/zinc/94/83/45/1054948345.db2.gz VJXBFAYKORZWNN-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1ccc2c(c1)CC[N@H+](Cc1c(Cl)cccc1Cl)C2 ZINC001236105872 1054948357 /nfs/dbraw/zinc/94/83/57/1054948357.db2.gz VJXBFAYKORZWNN-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO CCCc1noc(C[NH2+][C@H](C)c2ccc(SC(C)C)cc2)n1 ZINC000182094896 1054961911 /nfs/dbraw/zinc/96/19/11/1054961911.db2.gz OCWIPHQIKDBWKF-CYBMUJFWSA-N 1 2 319.474 4.373 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+]Cc2nnc(C(C)C)o2)cc1 ZINC000182129223 1054963737 /nfs/dbraw/zinc/96/37/37/1054963737.db2.gz LFQFXDUSWMDOPU-LBPRGKRZSA-N 1 2 305.447 4.156 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ncc(Cl)cc2Cl)s1 ZINC000182215870 1054970042 /nfs/dbraw/zinc/97/00/42/1054970042.db2.gz XFOMVENJENHKFC-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ncc(Cl)cc2Cl)s1 ZINC000182215870 1054970057 /nfs/dbraw/zinc/97/00/57/1054970057.db2.gz XFOMVENJENHKFC-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2cn[nH]c2)c2ccccc2Cl)cc1 ZINC000624217155 1054975848 /nfs/dbraw/zinc/97/58/48/1054975848.db2.gz FDAJKSFYAHAFRP-KRWDZBQOSA-N 1 2 315.779 4.081 20 0 DIADLO CCc1ccc(-c2noc(C[NH2+][C@@H](C)c3ccc(C)cc3)n2)cc1 ZINC000182320945 1054980522 /nfs/dbraw/zinc/98/05/22/1054980522.db2.gz ZLMTYFFLPAVYFP-HNNXBMFYSA-N 1 2 321.424 4.458 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1c(C)noc1C ZINC000182395258 1054984250 /nfs/dbraw/zinc/98/42/50/1054984250.db2.gz CTPKESGMGVCHBD-LBPRGKRZSA-N 1 2 307.463 4.286 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nc(C3CCCC3)no2)c(C)s1 ZINC000182745384 1055005295 /nfs/dbraw/zinc/00/52/95/1055005295.db2.gz UMHNVWOIYAHMCQ-LLVKDONJSA-N 1 2 305.447 4.256 20 0 DIADLO Fc1cc(N[C@H]2CCCOc3ccccc32)ccc1-n1cc[nH+]c1 ZINC000182909412 1055016525 /nfs/dbraw/zinc/01/65/25/1055016525.db2.gz YQZLSYLDNBMMRI-KRWDZBQOSA-N 1 2 323.371 4.337 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1ccc(-n3cc[nH+]c3)c(F)c1)CC2 ZINC000182911927 1055017231 /nfs/dbraw/zinc/01/72/31/1055017231.db2.gz DCIWYKVOKHJGCB-SFHVURJKSA-N 1 2 323.371 4.119 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3ccc(N)cc3C2)c(Cl)c1Cl ZINC001236233953 1055024493 /nfs/dbraw/zinc/02/44/93/1055024493.db2.gz WVUWBPCVSHYECM-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3ccc(N)cc3C2)c(Cl)c1Cl ZINC001236233953 1055024502 /nfs/dbraw/zinc/02/45/02/1055024502.db2.gz WVUWBPCVSHYECM-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO CC(C)C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccccn1 ZINC000183146882 1055031078 /nfs/dbraw/zinc/03/10/78/1055031078.db2.gz XPPXSNRGGHFZLC-GOSISDBHSA-N 1 2 310.445 4.276 20 0 DIADLO CC(C)C(=O)Nc1ccc(-c2cccc(-c3c[nH+]cn3C)c2)cc1 ZINC001236268734 1055045534 /nfs/dbraw/zinc/04/55/34/1055045534.db2.gz JSTDQWONLMVDEH-UHFFFAOYSA-N 1 2 319.408 4.349 20 0 DIADLO Cc1cc(F)cc(-c2cccc(Cl)c2C[NH+]2CCOCC2)c1 ZINC001236267934 1055045977 /nfs/dbraw/zinc/04/59/77/1055045977.db2.gz MKVHKGQIIWEFMR-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO c1ccc(C2([NH2+]Cc3nc(C4CCCC4)no3)CCCC2)cc1 ZINC000183550264 1055049959 /nfs/dbraw/zinc/04/99/59/1055049959.db2.gz AJHGKELMTVYNDL-UHFFFAOYSA-N 1 2 311.429 4.286 20 0 DIADLO COc1cc(F)cc(C[NH2+][C@H](c2ccco2)c2ccccc2)c1 ZINC000183831438 1055058396 /nfs/dbraw/zinc/05/83/96/1055058396.db2.gz BXGXOSONPNQLCR-IBGZPJMESA-N 1 2 311.356 4.307 20 0 DIADLO Cc1cn2cc(NC(=O)[C@H]3CCC[C@@H]3c3ccccc3)ccc2[nH+]1 ZINC001536223067 1055061789 /nfs/dbraw/zinc/06/17/89/1055061789.db2.gz IWHMZWDQHPMZFC-MSOLQXFVSA-N 1 2 319.408 4.165 20 0 DIADLO CNc1cc(-c2ccc(NC(=O)c3ccccc3)cc2)cc[nH+]1 ZINC001236340927 1055067375 /nfs/dbraw/zinc/06/73/75/1055067375.db2.gz SMCYIUUNHGBAKF-UHFFFAOYSA-N 1 2 303.365 4.043 20 0 DIADLO COc1cc(OC(F)(F)F)ccc1-c1cccc2[nH+]c(C)cn21 ZINC001236382205 1055086910 /nfs/dbraw/zinc/08/69/10/1055086910.db2.gz NQMDMJAYFVLNIR-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO Cc1c(-c2ccc(Cn3cc[nH+]c3)cc2)cnn1-c1ccccc1 ZINC001236402604 1055095618 /nfs/dbraw/zinc/09/56/18/1055095618.db2.gz MBBIFQZKVUUZGH-UHFFFAOYSA-N 1 2 314.392 4.093 20 0 DIADLO Cc1ccc(F)c(-c2c[nH+]c(N3CCCCC3)cc2C)c1O ZINC001236404483 1055097150 /nfs/dbraw/zinc/09/71/50/1055097150.db2.gz PFIXUXXWNYQRQN-UHFFFAOYSA-N 1 2 300.377 4.200 20 0 DIADLO COc1nc(C(C)C)ccc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001236447554 1055117882 /nfs/dbraw/zinc/11/78/82/1055117882.db2.gz OPYLHPOEAKWDGH-UHFFFAOYSA-N 1 2 311.360 4.205 20 0 DIADLO CC[C@H](C)c1ccc(C(=O)Nc2ccc(C)[nH+]c2N(C)C)cc1 ZINC001536522899 1055122801 /nfs/dbraw/zinc/12/28/01/1055122801.db2.gz GZYPPBXMRGTXKP-ZDUSSCGKSA-N 1 2 311.429 4.222 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1ccc(F)cc1 ZINC000195032430 1055142613 /nfs/dbraw/zinc/14/26/13/1055142613.db2.gz SNEHPGJGHLJMOF-SMDDNHRTSA-N 1 2 305.397 4.308 20 0 DIADLO Cc1cc(CNC(=O)c2ccc(C(C)C)c(Cl)c2)cc(C)[nH+]1 ZINC001536668246 1055150247 /nfs/dbraw/zinc/15/02/47/1055150247.db2.gz ZQHIKFWZKHNEQW-UHFFFAOYSA-N 1 2 316.832 4.405 20 0 DIADLO Cc1cc(CNC(=O)c2ccccc2CC(C)(C)C)cc(C)[nH+]1 ZINC001536668052 1055150554 /nfs/dbraw/zinc/15/05/54/1055150554.db2.gz XJXAKGCJTRMGMV-UHFFFAOYSA-N 1 2 310.441 4.217 20 0 DIADLO CCC(C)(C)c1ccc(C(=O)NCc2cc(C)[nH+]c(C)c2)cc1 ZINC001536665053 1055150579 /nfs/dbraw/zinc/15/05/79/1055150579.db2.gz BMRWFWIDDYQULB-UHFFFAOYSA-N 1 2 310.441 4.316 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1ccc(F)cc1Br ZINC000381191682 1055154229 /nfs/dbraw/zinc/15/42/29/1055154229.db2.gz XZNMNESTZFGWJW-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1ccc(F)cc1Br ZINC000381191682 1055154239 /nfs/dbraw/zinc/15/42/39/1055154239.db2.gz XZNMNESTZFGWJW-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1c(Br)ccnc1Cl ZINC001236598385 1055200949 /nfs/dbraw/zinc/20/09/49/1055200949.db2.gz QHCDUIQJTUNOLW-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1c(Br)ccnc1Cl ZINC001236598385 1055200960 /nfs/dbraw/zinc/20/09/60/1055200960.db2.gz QHCDUIQJTUNOLW-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO Clc1ccccc1C1CC[NH+](Cc2nccnc2Cl)CC1 ZINC001236616819 1055206800 /nfs/dbraw/zinc/20/68/00/1055206800.db2.gz FAPYNAJLOYCAOT-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO COC[C@H]1CCCC[N@@H+]1Cc1cc(Cl)c(F)c(Cl)c1 ZINC001236651835 1055212722 /nfs/dbraw/zinc/21/27/22/1055212722.db2.gz CJKRZOHPXMUQSH-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO COC[C@H]1CCCC[N@H+]1Cc1cc(Cl)c(F)c(Cl)c1 ZINC001236651835 1055212729 /nfs/dbraw/zinc/21/27/29/1055212729.db2.gz CJKRZOHPXMUQSH-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2Cc2cccc3sccc32)no1 ZINC001236688379 1055228007 /nfs/dbraw/zinc/22/80/07/1055228007.db2.gz BIKUJGPLNBSMIM-OAHLLOKOSA-N 1 2 313.426 4.320 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2Cc2cccc3sccc32)no1 ZINC001236688379 1055228032 /nfs/dbraw/zinc/22/80/32/1055228032.db2.gz BIKUJGPLNBSMIM-OAHLLOKOSA-N 1 2 313.426 4.320 20 0 DIADLO CCOc1ncc(C[N@@H+]2CCC[C@H]2c2ccccc2F)cc1F ZINC001236695762 1055231886 /nfs/dbraw/zinc/23/18/86/1055231886.db2.gz YIINQFVECQXKSY-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ncc(C[N@H+]2CCC[C@H]2c2ccccc2F)cc1F ZINC001236695762 1055231907 /nfs/dbraw/zinc/23/19/07/1055231907.db2.gz YIINQFVECQXKSY-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO Oc1cc(C[N@H+](Cc2ccccc2)Cc2cccnc2)ccc1F ZINC001236706714 1055236047 /nfs/dbraw/zinc/23/60/47/1055236047.db2.gz WUQCQJAHSBEQME-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO Oc1cc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)ccc1F ZINC001236706714 1055236057 /nfs/dbraw/zinc/23/60/57/1055236057.db2.gz WUQCQJAHSBEQME-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO CCCCN1CC[C@]2(CCC[N@@H+](c3ccc(C)cc3)CC2)C1=O ZINC001278001174 1055241763 /nfs/dbraw/zinc/24/17/63/1055241763.db2.gz YRFRBWPNZAQVLD-HXUWFJFHSA-N 1 2 314.473 4.004 20 0 DIADLO CCCCN1CC[C@]2(CCC[N@H+](c3ccc(C)cc3)CC2)C1=O ZINC001278001174 1055241773 /nfs/dbraw/zinc/24/17/73/1055241773.db2.gz YRFRBWPNZAQVLD-HXUWFJFHSA-N 1 2 314.473 4.004 20 0 DIADLO Oc1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c(OC(F)(F)F)c1 ZINC001236730394 1055244408 /nfs/dbraw/zinc/24/44/08/1055244408.db2.gz NFCSFKLLOGUTPQ-OAHLLOKOSA-N 1 2 323.314 4.238 20 0 DIADLO Oc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)c(OC(F)(F)F)c1 ZINC001236730394 1055244423 /nfs/dbraw/zinc/24/44/23/1055244423.db2.gz NFCSFKLLOGUTPQ-OAHLLOKOSA-N 1 2 323.314 4.238 20 0 DIADLO Cc1cccc(F)c1NC(=O)[C@H](c1ccc(Cl)cc1)[NH+](C)C ZINC001537172359 1055244902 /nfs/dbraw/zinc/24/49/02/1055244902.db2.gz WOZRIVYRDMNYTN-INIZCTEOSA-N 1 2 320.795 4.029 20 0 DIADLO C[C@@H]1CC[N@@H+]1Cc1cccc(C(F)(F)F)c1Br ZINC001236728008 1055245774 /nfs/dbraw/zinc/24/57/74/1055245774.db2.gz WXGYYSGCAOWBIR-MRVPVSSYSA-N 1 2 308.141 4.062 20 0 DIADLO C[C@@H]1CC[N@H+]1Cc1cccc(C(F)(F)F)c1Br ZINC001236728008 1055245790 /nfs/dbraw/zinc/24/57/90/1055245790.db2.gz WXGYYSGCAOWBIR-MRVPVSSYSA-N 1 2 308.141 4.062 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3ccc4ccc(C)cc4c3)ccn12 ZINC001537204443 1055252545 /nfs/dbraw/zinc/25/25/45/1055252545.db2.gz MZVSKJDFWVESMO-UHFFFAOYSA-N 1 2 316.360 4.324 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@H]2c2cccnc2)c(F)cc1F ZINC001236823444 1055275670 /nfs/dbraw/zinc/27/56/70/1055275670.db2.gz IPPGFNGLAHRWJE-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@H]2c2cccnc2)c(F)cc1F ZINC001236823444 1055275691 /nfs/dbraw/zinc/27/56/91/1055275691.db2.gz IPPGFNGLAHRWJE-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccccc2F)c(F)cc1F ZINC001236833290 1055283954 /nfs/dbraw/zinc/28/39/54/1055283954.db2.gz FWBQCUCRYTUWPY-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccccc2F)c(F)cc1F ZINC001236833290 1055283965 /nfs/dbraw/zinc/28/39/65/1055283965.db2.gz FWBQCUCRYTUWPY-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@@H]1CC(C)(C)N(C(=O)c2cccc3[nH+]ccn32)c2ccccc21 ZINC001537355740 1055289429 /nfs/dbraw/zinc/28/94/29/1055289429.db2.gz NHUUXNVRWUWUIR-CQSZACIVSA-N 1 2 319.408 4.267 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)CCC2 ZINC000764939850 1055295302 /nfs/dbraw/zinc/29/53/02/1055295302.db2.gz MNKWTLZSJVVDAJ-PXAZEXFGSA-N 1 2 319.399 4.470 20 0 DIADLO FC1(F)CC2(C[NH+](Cc3nc4ccccc4cc3Cl)C2)C1 ZINC001236870784 1055298115 /nfs/dbraw/zinc/29/81/15/1055298115.db2.gz LFIHGIIIYNJJNR-UHFFFAOYSA-N 1 2 308.759 4.119 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@H](C)c1cc(F)ccc1F)CCC2 ZINC000764939150 1055299374 /nfs/dbraw/zinc/29/93/74/1055299374.db2.gz JOPZZUAFYDSLIE-PXAZEXFGSA-N 1 2 319.399 4.470 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2cncc(-c3ccc(F)cc3)c2)C[C@@H]1F ZINC001236998332 1055333649 /nfs/dbraw/zinc/33/36/49/1055333649.db2.gz WNOXZBSKGJBGQX-ZWKOTPCHSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2cncc(-c3ccc(F)cc3)c2)C[C@@H]1F ZINC001236998332 1055333663 /nfs/dbraw/zinc/33/36/63/1055333663.db2.gz WNOXZBSKGJBGQX-ZWKOTPCHSA-N 1 2 320.358 4.160 20 0 DIADLO Nc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1F ZINC001237057036 1055356984 /nfs/dbraw/zinc/35/69/84/1055356984.db2.gz GHAXZJTYANCNSX-MRXNPFEDSA-N 1 2 324.321 4.162 20 0 DIADLO Nc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1F ZINC001237057036 1055356996 /nfs/dbraw/zinc/35/69/96/1055356996.db2.gz GHAXZJTYANCNSX-MRXNPFEDSA-N 1 2 324.321 4.162 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1cccc(OC(C)(C)C)c1 ZINC001237104389 1055372566 /nfs/dbraw/zinc/37/25/66/1055372566.db2.gz GLTJSYXZQVXLFU-UHFFFAOYSA-N 1 2 311.425 4.179 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1cccc(OC(C)(C)C)c1 ZINC001237104389 1055372577 /nfs/dbraw/zinc/37/25/77/1055372577.db2.gz GLTJSYXZQVXLFU-UHFFFAOYSA-N 1 2 311.425 4.179 20 0 DIADLO CC[C@@H]([NH2+]Cc1nccn1CC)c1ccc(Cl)cc1Cl ZINC000385449502 1055375000 /nfs/dbraw/zinc/37/50/00/1055375000.db2.gz JAXNUJUDICQORO-CQSZACIVSA-N 1 2 312.244 4.451 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1cc2c(s1)CCCCCC2 ZINC001537604666 1055377158 /nfs/dbraw/zinc/37/71/58/1055377158.db2.gz WQJKQUQHVVIMMU-UHFFFAOYSA-N 1 2 314.454 4.093 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C=Cc1ccc(C(C)(C)C)cc1 ZINC001537609182 1055379808 /nfs/dbraw/zinc/37/98/08/1055379808.db2.gz DFDAXBAXFGPODP-DHZHZOJOSA-N 1 2 308.425 4.070 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2ccnc3c(Cl)cccc23)C[C@@H]1F ZINC001237151729 1055388235 /nfs/dbraw/zinc/38/82/35/1055388235.db2.gz ZTSCOVLQKBUZCG-HOCLYGCPSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2ccnc3c(Cl)cccc23)C[C@@H]1F ZINC001237151729 1055388244 /nfs/dbraw/zinc/38/82/44/1055388244.db2.gz ZTSCOVLQKBUZCG-HOCLYGCPSA-N 1 2 310.775 4.160 20 0 DIADLO CC(C)[C@](C)(Cc1ccccc1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001587889659 1055391325 /nfs/dbraw/zinc/39/13/25/1055391325.db2.gz KYGRULLNYMKPCR-FQEVSTJZSA-N 1 2 321.424 4.178 20 0 DIADLO COc1cccc(C[N@@H+]2CCc3ccc(F)cc3C2)c1Cl ZINC001237192995 1055399791 /nfs/dbraw/zinc/39/97/91/1055399791.db2.gz FQTHXFWNAGHNMN-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc(C[N@H+]2CCc3ccc(F)cc3C2)c1Cl ZINC001237192995 1055399809 /nfs/dbraw/zinc/39/98/09/1055399809.db2.gz FQTHXFWNAGHNMN-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc3nccc(Cl)c3c1)C2 ZINC001237268095 1055410440 /nfs/dbraw/zinc/41/04/40/1055410440.db2.gz HCPMZIPIOZEHOR-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc3nccc(Cl)c3c1)C2 ZINC001237268095 1055410445 /nfs/dbraw/zinc/41/04/45/1055410445.db2.gz HCPMZIPIOZEHOR-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2ccc3nccc(Cl)c3c2)C[C@H]1F ZINC001237265278 1055410641 /nfs/dbraw/zinc/41/06/41/1055410641.db2.gz RHDMKUANNNWQFL-CVEARBPZSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2ccc3nccc(Cl)c3c2)C[C@H]1F ZINC001237265278 1055410644 /nfs/dbraw/zinc/41/06/44/1055410644.db2.gz RHDMKUANNNWQFL-CVEARBPZSA-N 1 2 310.775 4.160 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2nccs2)ccc1C(F)F ZINC001237281926 1055415964 /nfs/dbraw/zinc/41/59/64/1055415964.db2.gz YOCDKNUHAFVRSV-CYBMUJFWSA-N 1 2 324.396 4.426 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2nccs2)ccc1C(F)F ZINC001237281926 1055415965 /nfs/dbraw/zinc/41/59/65/1055415965.db2.gz YOCDKNUHAFVRSV-CYBMUJFWSA-N 1 2 324.396 4.426 20 0 DIADLO Oc1cc(F)cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)c1 ZINC001237284017 1055416207 /nfs/dbraw/zinc/41/62/07/1055416207.db2.gz QZBNFSROFIJWOY-KRWDZBQOSA-N 1 2 307.315 4.147 20 0 DIADLO FC(F)(F)c1cnccc1C[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001237291346 1055417637 /nfs/dbraw/zinc/41/76/37/1055417637.db2.gz WPEOSQFRRZZGRY-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1cnccc1C[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001237291346 1055417642 /nfs/dbraw/zinc/41/76/42/1055417642.db2.gz WPEOSQFRRZZGRY-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO Cc1cc(Br)c(C[N@H+](C)Cc2ccccc2)cc1O ZINC001237295388 1055418670 /nfs/dbraw/zinc/41/86/70/1055418670.db2.gz TUJJPJVPIZRWSU-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1cc(Br)c(C[N@@H+](C)Cc2ccccc2)cc1O ZINC001237295388 1055418676 /nfs/dbraw/zinc/41/86/76/1055418676.db2.gz TUJJPJVPIZRWSU-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc4[nH]c(C)c(C)c4c3)cc2[nH+]1 ZINC000010656925 1055420216 /nfs/dbraw/zinc/42/02/16/1055420216.db2.gz RGPVXNVTWUKYMF-UHFFFAOYSA-N 1 2 318.380 4.222 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccncc2C(F)(F)F)cn1 ZINC001237295990 1055421481 /nfs/dbraw/zinc/42/14/81/1055421481.db2.gz VIEUNLFVSKMMJE-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccncc2C(F)(F)F)cn1 ZINC001237295990 1055421486 /nfs/dbraw/zinc/42/14/86/1055421486.db2.gz VIEUNLFVSKMMJE-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc(Cl)c(C[NH+]2CC(c3cccnc3)C2)c1Cl ZINC001237329927 1055428561 /nfs/dbraw/zinc/42/85/61/1055428561.db2.gz GPCBABFRZVGVPV-UHFFFAOYSA-N 1 2 307.224 4.296 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2cnccc2Br)cc1 ZINC001237393422 1055444679 /nfs/dbraw/zinc/44/46/79/1055444679.db2.gz QUDMDTYMTQIZHK-UHFFFAOYSA-N 1 2 319.246 4.039 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2cnccc2Br)cc1 ZINC001237393422 1055444680 /nfs/dbraw/zinc/44/46/80/1055444680.db2.gz QUDMDTYMTQIZHK-UHFFFAOYSA-N 1 2 319.246 4.039 20 0 DIADLO C[N@H+](Cc1cc2ccccn2n1)Cc1cc(Cl)cc(Cl)c1 ZINC001237451633 1055453657 /nfs/dbraw/zinc/45/36/57/1055453657.db2.gz AQZAINOFRVHBJC-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1cc2ccccn2n1)Cc1cc(Cl)cc(Cl)c1 ZINC001237451633 1055453665 /nfs/dbraw/zinc/45/36/65/1055453665.db2.gz AQZAINOFRVHBJC-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO CCCn1c[nH+]cc1CNc1cccc(N2CCC(C)CC2)c1 ZINC001620840629 1055455284 /nfs/dbraw/zinc/45/52/84/1055455284.db2.gz MNHINVZOQYWUNE-UHFFFAOYSA-N 1 2 312.461 4.142 20 0 DIADLO Fc1ccc(Br)c(F)c1C[NH+]1CCCCCC1 ZINC000230341296 1055455940 /nfs/dbraw/zinc/45/59/40/1055455940.db2.gz KEMVJDSCMCNIIO-UHFFFAOYSA-N 1 2 304.178 4.103 20 0 DIADLO F[C@H]1CCC[N@H+](Cc2cc(Cl)nc(C(F)(F)F)c2)CC1 ZINC001237493066 1055460819 /nfs/dbraw/zinc/46/08/19/1055460819.db2.gz ZYNLBHJROAHUOA-JTQLQIEISA-N 1 2 310.722 4.078 20 0 DIADLO F[C@H]1CCC[N@@H+](Cc2cc(Cl)nc(C(F)(F)F)c2)CC1 ZINC001237493066 1055460828 /nfs/dbraw/zinc/46/08/28/1055460828.db2.gz ZYNLBHJROAHUOA-JTQLQIEISA-N 1 2 310.722 4.078 20 0 DIADLO CSC1CC[NH+](Cc2cc(Cl)nc(C(F)(F)F)c2)CC1 ZINC001237497332 1055461628 /nfs/dbraw/zinc/46/16/28/1055461628.db2.gz DSUNQQPKUBMNLR-UHFFFAOYSA-N 1 2 324.799 4.081 20 0 DIADLO Cc1cc(N(C)Cc2nc3ccccc3s2)nc(C(C)C)[nH+]1 ZINC000018059855 1055466097 /nfs/dbraw/zinc/46/60/97/1055466097.db2.gz FPPGDVXODHLGKB-UHFFFAOYSA-N 1 2 312.442 4.155 20 0 DIADLO CSCc1ccc(NCc2cc(-n3cc[nH+]c3)cs2)cc1 ZINC001620843879 1055472274 /nfs/dbraw/zinc/47/22/74/1055472274.db2.gz PHXWZZXHCCADBE-UHFFFAOYSA-N 1 2 315.467 4.409 20 0 DIADLO CNc1ccccc1C[NH2+][C@@H](c1ccco1)c1ccccc1OC ZINC001620844276 1055473035 /nfs/dbraw/zinc/47/30/35/1055473035.db2.gz KOVMAVLPKVIGAZ-HXUWFJFHSA-N 1 2 322.408 4.209 20 0 DIADLO Cc1cc(CNc2ccc(N(C)C)c[nH+]2)ccc1C(F)(F)F ZINC001620844537 1055473210 /nfs/dbraw/zinc/47/32/10/1055473210.db2.gz XWDRGHRFBDHJMJ-UHFFFAOYSA-N 1 2 309.335 4.087 20 0 DIADLO Fc1cc(Cl)c(C[N@@H+]2CC[C@H]3CCCO[C@H]3C2)c(Cl)c1 ZINC001237594777 1055482347 /nfs/dbraw/zinc/48/23/47/1055482347.db2.gz WWIUMWKOQQGRED-BMIGLBTASA-N 1 2 318.219 4.133 20 0 DIADLO Fc1cc(Cl)c(C[N@H+]2CC[C@H]3CCCO[C@H]3C2)c(Cl)c1 ZINC001237594777 1055482350 /nfs/dbraw/zinc/48/23/50/1055482350.db2.gz WWIUMWKOQQGRED-BMIGLBTASA-N 1 2 318.219 4.133 20 0 DIADLO Cc1cc(NCc2cncc3ccccc32)ccc1-n1cc[nH+]c1 ZINC001620854299 1055482761 /nfs/dbraw/zinc/48/27/61/1055482761.db2.gz ZFVXHCDSMNKRSD-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Fc1cc(Cl)c(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c(Cl)c1 ZINC001237600482 1055483249 /nfs/dbraw/zinc/48/32/49/1055483249.db2.gz YGVTYPAILCCUKH-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1cc(Cl)c(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c(Cl)c1 ZINC001237600482 1055483255 /nfs/dbraw/zinc/48/32/55/1055483255.db2.gz YGVTYPAILCCUKH-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO Cc1ccnc2cccc(C[N@@H+]3CCC[C@@H](F)C(F)(F)C3)c12 ZINC001237624900 1055487977 /nfs/dbraw/zinc/48/79/77/1055487977.db2.gz CQXOTUVPHLNGDG-OAHLLOKOSA-N 1 2 308.347 4.112 20 0 DIADLO Cc1ccnc2cccc(C[N@H+]3CCC[C@@H](F)C(F)(F)C3)c12 ZINC001237624900 1055487983 /nfs/dbraw/zinc/48/79/83/1055487983.db2.gz CQXOTUVPHLNGDG-OAHLLOKOSA-N 1 2 308.347 4.112 20 0 DIADLO Cc1coc(C[N@@H+]2CCSC[C@@H]2c2cccc3ccccc32)n1 ZINC001237641032 1055491394 /nfs/dbraw/zinc/49/13/94/1055491394.db2.gz PRIZSOXDEKNYOA-GOSISDBHSA-N 1 2 324.449 4.426 20 0 DIADLO Cc1coc(C[N@H+]2CCSC[C@@H]2c2cccc3ccccc32)n1 ZINC001237641032 1055491399 /nfs/dbraw/zinc/49/13/99/1055491399.db2.gz PRIZSOXDEKNYOA-GOSISDBHSA-N 1 2 324.449 4.426 20 0 DIADLO CCCCOc1cccc(C[NH2+]Cc2nc(C(C)(C)C)co2)c1 ZINC000921542626 1055495757 /nfs/dbraw/zinc/49/57/57/1055495757.db2.gz ICTRHHIUZYYDRZ-UHFFFAOYSA-N 1 2 316.445 4.441 20 0 DIADLO Cc1cc(C[NH+]2CC3(C2)C[C@H](F)CS3)c(Cl)cc1Cl ZINC001237699400 1055506439 /nfs/dbraw/zinc/50/64/39/1055506439.db2.gz LWFIIXHRQNMIMF-NSHDSACASA-N 1 2 320.260 4.331 20 0 DIADLO COc1ccc(CNc2c[nH+]ccc2OC(C)(C)C)c(C)c1 ZINC001620887003 1055510622 /nfs/dbraw/zinc/51/06/22/1055510622.db2.gz HVEKQWTVHCMAHA-UHFFFAOYSA-N 1 2 300.402 4.188 20 0 DIADLO CC(C)c1cc(Br)ccc1C[NH+]1CC(C(F)F)C1 ZINC001237739336 1055520190 /nfs/dbraw/zinc/52/01/90/1055520190.db2.gz VHMXEYNOGNLTER-UHFFFAOYSA-N 1 2 318.205 4.269 20 0 DIADLO CC[C@H]1CCC[N@H+](Cc2ncc(Cl)cc2Br)C1 ZINC001237766722 1055525573 /nfs/dbraw/zinc/52/55/73/1055525573.db2.gz JBJZJPUSJCICQH-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@H]1CCC[N@@H+](Cc2ncc(Cl)cc2Br)C1 ZINC001237766722 1055525585 /nfs/dbraw/zinc/52/55/85/1055525585.db2.gz JBJZJPUSJCICQH-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)c(C)[nH+]1 ZINC001127920479 1055528850 /nfs/dbraw/zinc/52/88/50/1055528850.db2.gz DXPRAHCYLSFBDK-OAHLLOKOSA-N 1 2 322.452 4.377 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NCc1cccc(OC(F)F)c1 ZINC001620904649 1055529260 /nfs/dbraw/zinc/52/92/60/1055529260.db2.gz MGJLIJDIOPHXMC-UHFFFAOYSA-N 1 2 308.328 4.082 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C)c2ccccc2n1)c1ccccc1OC ZINC000765637811 1055530661 /nfs/dbraw/zinc/53/06/61/1055530661.db2.gz HUVSBWZZBNGHTG-QGZVFWFLSA-N 1 2 321.424 4.188 20 0 DIADLO Cc1cnc(C[N@@H+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)nc1 ZINC001237808678 1055531115 /nfs/dbraw/zinc/53/11/15/1055531115.db2.gz OEQJTOOBTZRWFF-CYBMUJFWSA-N 1 2 322.239 4.081 20 0 DIADLO Cc1cnc(C[N@H+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)nc1 ZINC001237808678 1055531126 /nfs/dbraw/zinc/53/11/26/1055531126.db2.gz OEQJTOOBTZRWFF-CYBMUJFWSA-N 1 2 322.239 4.081 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)ccc1F ZINC001237819112 1055537744 /nfs/dbraw/zinc/53/77/44/1055537744.db2.gz AYVAMJMUVSNFBN-KRWDZBQOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)ccc1F ZINC001237819112 1055537757 /nfs/dbraw/zinc/53/77/57/1055537757.db2.gz AYVAMJMUVSNFBN-KRWDZBQOSA-N 1 2 306.331 4.144 20 0 DIADLO CCc1ncc(C[N@H+](Cc2ccccc2)Cc2ccccn2)s1 ZINC001237821591 1055538675 /nfs/dbraw/zinc/53/86/75/1055538675.db2.gz QCAQHNSGEBSZBY-UHFFFAOYSA-N 1 2 323.465 4.303 20 0 DIADLO CCc1ncc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)s1 ZINC001237821591 1055538683 /nfs/dbraw/zinc/53/86/83/1055538683.db2.gz QCAQHNSGEBSZBY-UHFFFAOYSA-N 1 2 323.465 4.303 20 0 DIADLO CCOc1ccccc1C[N@H+](CC(=O)c1ccccc1)C(C)C ZINC001203543872 1055539278 /nfs/dbraw/zinc/53/92/78/1055539278.db2.gz IZUMGCUPHPQIIJ-UHFFFAOYSA-N 1 2 311.425 4.179 20 0 DIADLO CCOc1ccccc1C[N@@H+](CC(=O)c1ccccc1)C(C)C ZINC001203543872 1055539291 /nfs/dbraw/zinc/53/92/91/1055539291.db2.gz IZUMGCUPHPQIIJ-UHFFFAOYSA-N 1 2 311.425 4.179 20 0 DIADLO CCc1ncc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)s1 ZINC001237830317 1055540322 /nfs/dbraw/zinc/54/03/22/1055540322.db2.gz IRIXUTOJDIRHDA-OAHLLOKOSA-N 1 2 308.397 4.321 20 0 DIADLO CCc1ncc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)s1 ZINC001237830317 1055540329 /nfs/dbraw/zinc/54/03/29/1055540329.db2.gz IRIXUTOJDIRHDA-OAHLLOKOSA-N 1 2 308.397 4.321 20 0 DIADLO CCc1c(NCc2cc(C)[nH+]c(C)c2)cnn1C(CC)CC ZINC001620923378 1055543290 /nfs/dbraw/zinc/54/32/90/1055543290.db2.gz GANKPSZTMWZVLD-UHFFFAOYSA-N 1 2 300.450 4.431 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(Br)c(Cl)c2F)C1 ZINC001237890455 1055550861 /nfs/dbraw/zinc/55/08/61/1055550861.db2.gz ZWBYBXAKLQWXKI-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(Br)c(Cl)c2F)C1 ZINC001237890455 1055550868 /nfs/dbraw/zinc/55/08/68/1055550868.db2.gz ZWBYBXAKLQWXKI-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO FC1(F)CCCC[N@H+](Cc2ccccc2C2CCOCC2)C1 ZINC001237900701 1055555807 /nfs/dbraw/zinc/55/58/07/1055555807.db2.gz XMLMEOFEKMQHBJ-UHFFFAOYSA-N 1 2 309.400 4.202 20 0 DIADLO FC1(F)CCCC[N@@H+](Cc2ccccc2C2CCOCC2)C1 ZINC001237900701 1055555818 /nfs/dbraw/zinc/55/58/18/1055555818.db2.gz XMLMEOFEKMQHBJ-UHFFFAOYSA-N 1 2 309.400 4.202 20 0 DIADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2csc(-c3cccc(F)c3)n2)C1 ZINC001237970175 1055567156 /nfs/dbraw/zinc/56/71/56/1055567156.db2.gz WYOWTUKFZAPCMI-NHYWBVRUSA-N 1 2 308.397 4.129 20 0 DIADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2csc(-c3cccc(F)c3)n2)C1 ZINC001237970175 1055567168 /nfs/dbraw/zinc/56/71/68/1055567168.db2.gz WYOWTUKFZAPCMI-NHYWBVRUSA-N 1 2 308.397 4.129 20 0 DIADLO C[N@@H+](Cc1csc(-c2ccc(O)cc2)n1)Cc1cccs1 ZINC001237980124 1055574543 /nfs/dbraw/zinc/57/45/43/1055574543.db2.gz KRFGKDUPXDNYNY-UHFFFAOYSA-N 1 2 316.451 4.209 20 0 DIADLO C[N@H+](Cc1csc(-c2ccc(O)cc2)n1)Cc1cccs1 ZINC001237980124 1055574555 /nfs/dbraw/zinc/57/45/55/1055574555.db2.gz KRFGKDUPXDNYNY-UHFFFAOYSA-N 1 2 316.451 4.209 20 0 DIADLO Oc1ccc(-c2nc(C[N@@H+]3CC[C@@H]3c3ccccc3)cs2)cc1 ZINC001237983174 1055574901 /nfs/dbraw/zinc/57/49/01/1055574901.db2.gz NLUGBKWQNMRCOI-GOSISDBHSA-N 1 2 322.433 4.463 20 0 DIADLO Oc1ccc(-c2nc(C[N@H+]3CC[C@@H]3c3ccccc3)cs2)cc1 ZINC001237983174 1055574914 /nfs/dbraw/zinc/57/49/14/1055574914.db2.gz NLUGBKWQNMRCOI-GOSISDBHSA-N 1 2 322.433 4.463 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2cc(F)c(O)c(Cl)c2)cc1 ZINC001237994084 1055575708 /nfs/dbraw/zinc/57/57/08/1055575708.db2.gz BSOYFJTZYXRKIS-NSHDSACASA-N 1 2 323.795 4.386 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[N@@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC001237997365 1055576817 /nfs/dbraw/zinc/57/68/17/1055576817.db2.gz DJRSRSOPRQOSGP-YVEFUNNKSA-N 1 2 303.837 4.371 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[N@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC001237997365 1055576827 /nfs/dbraw/zinc/57/68/27/1055576827.db2.gz DJRSRSOPRQOSGP-YVEFUNNKSA-N 1 2 303.837 4.371 20 0 DIADLO CC(C)COc1cccc(C[NH2+]Cc2nc(C(C)(C)C)co2)c1 ZINC000921586968 1055577512 /nfs/dbraw/zinc/57/75/12/1055577512.db2.gz GAQIVSATFQVSIL-UHFFFAOYSA-N 1 2 316.445 4.297 20 0 DIADLO Clc1ccc2c(c1)n[nH]c2C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC001238000763 1055581466 /nfs/dbraw/zinc/58/14/66/1055581466.db2.gz NYWQXTQTGJMCRZ-CQSZACIVSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1ccc2c(c1)n[nH]c2C[N@H+]1CCC[C@@H]1c1nccs1 ZINC001238000763 1055581476 /nfs/dbraw/zinc/58/14/76/1055581476.db2.gz NYWQXTQTGJMCRZ-CQSZACIVSA-N 1 2 318.833 4.010 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)Cc3ccc(C4CCC4)cc3)cc2[nH+]1 ZINC001595321351 1055585682 /nfs/dbraw/zinc/58/56/82/1055585682.db2.gz MTAGVEPEGMXRGZ-UHFFFAOYSA-N 1 2 319.408 4.320 20 0 DIADLO COc1ccc(C(F)(F)F)c(C[N@@H+]2CCCC[C@@H](F)C2)c1 ZINC001238048813 1055594413 /nfs/dbraw/zinc/59/44/13/1055594413.db2.gz SFGIBLUKUPCCGY-GFCCVEGCSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C(F)(F)F)c(C[N@H+]2CCCC[C@@H](F)C2)c1 ZINC001238048813 1055594428 /nfs/dbraw/zinc/59/44/28/1055594428.db2.gz SFGIBLUKUPCCGY-GFCCVEGCSA-N 1 2 305.315 4.038 20 0 DIADLO CCOC(=O)c1c(Cl)cccc1C[NH+]1CC2(C1)CCCCC2 ZINC001238047940 1055594922 /nfs/dbraw/zinc/59/49/22/1055594922.db2.gz QTKBPEZRHDASMM-UHFFFAOYSA-N 1 2 321.848 4.283 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1C[N@@H+]1CCC(=O)[C@H](C)C1 ZINC001238063458 1055598317 /nfs/dbraw/zinc/59/83/17/1055598317.db2.gz SIMYOYHAHVLPOT-MRXNPFEDSA-N 1 2 309.409 4.198 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1C[N@H+]1CCC(=O)[C@H](C)C1 ZINC001238063458 1055598328 /nfs/dbraw/zinc/59/83/28/1055598328.db2.gz SIMYOYHAHVLPOT-MRXNPFEDSA-N 1 2 309.409 4.198 20 0 DIADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1cccc(OCC2CCCCC2)c1 ZINC001238066047 1055599004 /nfs/dbraw/zinc/59/90/04/1055599004.db2.gz HFMWQVQXCWUGBH-MRXNPFEDSA-N 1 2 315.457 4.199 20 0 DIADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1cccc(OCC2CCCCC2)c1 ZINC001238066047 1055599015 /nfs/dbraw/zinc/59/90/15/1055599015.db2.gz HFMWQVQXCWUGBH-MRXNPFEDSA-N 1 2 315.457 4.199 20 0 DIADLO Cc1ccc(O)cc1C[N@@H+](C)Cc1ccccc1Br ZINC001238102038 1055605657 /nfs/dbraw/zinc/60/56/57/1055605657.db2.gz YSPQGCOALCCEKV-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1ccc(O)cc1C[N@H+](C)Cc1ccccc1Br ZINC001238102038 1055605666 /nfs/dbraw/zinc/60/56/66/1055605666.db2.gz YSPQGCOALCCEKV-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO COc1cccc([C@H]2CCCC[N@@H+]2Cc2cccc3c[nH+]cn32)c1 ZINC001238113046 1055609029 /nfs/dbraw/zinc/60/90/29/1055609029.db2.gz IFVUMPSRPVYWHA-HXUWFJFHSA-N 1 2 321.424 4.070 20 0 DIADLO Cc1ncncc1C[N@H+](C)Cc1sc2ccccc2c1Cl ZINC001238176060 1055614867 /nfs/dbraw/zinc/61/48/67/1055614867.db2.gz SDYABDBYXOUTKI-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO Cc1ncncc1C[N@@H+](C)Cc1sc2ccccc2c1Cl ZINC001238176060 1055614876 /nfs/dbraw/zinc/61/48/76/1055614876.db2.gz SDYABDBYXOUTKI-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cncc(C2CC2)c1 ZINC001238195788 1055617566 /nfs/dbraw/zinc/61/75/66/1055617566.db2.gz VCDRUBOVVUNCOX-HXUWFJFHSA-N 1 2 322.452 4.442 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cncc(C2CC2)c1 ZINC001238195788 1055617581 /nfs/dbraw/zinc/61/75/81/1055617581.db2.gz VCDRUBOVVUNCOX-HXUWFJFHSA-N 1 2 322.452 4.442 20 0 DIADLO c1cn(Cc2cccc(CNc3nc4ccccc4s3)c2)c[nH+]1 ZINC000029585261 1055620132 /nfs/dbraw/zinc/62/01/32/1055620132.db2.gz PHIMSZULNHUUIM-UHFFFAOYSA-N 1 2 320.421 4.153 20 0 DIADLO CC(C)c1cc(C[N@@H+]2CCc3ncccc3C2)ccc1Cl ZINC001238229821 1055626994 /nfs/dbraw/zinc/62/69/94/1055626994.db2.gz UMQLGZZCWHDUBM-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1cc(C[N@H+]2CCc3ncccc3C2)ccc1Cl ZINC001238229821 1055627001 /nfs/dbraw/zinc/62/70/01/1055627001.db2.gz UMQLGZZCWHDUBM-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO Fc1ccc(-c2[nH]c3ccc(NCc4ccncc4)cc3[nH+]2)cc1 ZINC001620961922 1055627798 /nfs/dbraw/zinc/62/77/98/1055627798.db2.gz HANHFXSAHKFMQN-UHFFFAOYSA-N 1 2 318.355 4.376 20 0 DIADLO Fc1ccc(C[NH+]2CCC3(CC3)CC2)c(F)c1C(F)(F)F ZINC001238244022 1055629372 /nfs/dbraw/zinc/62/93/72/1055629372.db2.gz UIYJMHLKKIDAAF-UHFFFAOYSA-N 1 2 305.290 4.360 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3cc(O)ccc3C2)c(F)cc1Cl ZINC001238301596 1055636795 /nfs/dbraw/zinc/63/67/95/1055636795.db2.gz ZEAOTVYFSJAHNC-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Cc1cc(C[N@H+]2CCc3cc(O)ccc3C2)c(F)cc1Cl ZINC001238301596 1055636801 /nfs/dbraw/zinc/63/68/01/1055636801.db2.gz ZEAOTVYFSJAHNC-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Clc1ccc(Br)c(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c1Cl ZINC001238288599 1055637067 /nfs/dbraw/zinc/63/70/67/1055637067.db2.gz LCORQVYDNDFRGP-OCAPTIKFSA-N 1 2 321.045 4.208 20 0 DIADLO Clc1ccc(Br)c(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1Cl ZINC001238288599 1055637072 /nfs/dbraw/zinc/63/70/72/1055637072.db2.gz LCORQVYDNDFRGP-OCAPTIKFSA-N 1 2 321.045 4.208 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@@H+]1CCC(F)(F)C(C)(C)C1 ZINC001238340782 1055641285 /nfs/dbraw/zinc/64/12/85/1055641285.db2.gz OTXXPAFJVAJWIW-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@H+]1CCC(F)(F)C(C)(C)C1 ZINC001238340782 1055641289 /nfs/dbraw/zinc/64/12/89/1055641289.db2.gz OTXXPAFJVAJWIW-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(F)c(OCc2ccccc2)c1 ZINC001238338758 1055641699 /nfs/dbraw/zinc/64/16/99/1055641699.db2.gz GKZZYUIJUCOLET-PBHICJAKSA-N 1 2 317.379 4.337 20 0 DIADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(F)c(OCc2ccccc2)c1 ZINC001238338758 1055641708 /nfs/dbraw/zinc/64/17/08/1055641708.db2.gz GKZZYUIJUCOLET-PBHICJAKSA-N 1 2 317.379 4.337 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@H](F)C2)cc1OCc1ccccc1 ZINC001238345574 1055643394 /nfs/dbraw/zinc/64/33/94/1055643394.db2.gz SHPBAXUPMZTGHI-KRWDZBQOSA-N 1 2 317.379 4.339 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@H](F)C2)cc1OCc1ccccc1 ZINC001238345574 1055643399 /nfs/dbraw/zinc/64/33/99/1055643399.db2.gz SHPBAXUPMZTGHI-KRWDZBQOSA-N 1 2 317.379 4.339 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccnc(Br)c1Cl ZINC001238370707 1055646362 /nfs/dbraw/zinc/64/63/62/1055646362.db2.gz JJGSDYFYVYYVKU-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c(F)c1O ZINC001238361296 1055646635 /nfs/dbraw/zinc/64/66/35/1055646635.db2.gz RNFIMEAPZHQTKC-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c(F)c1O ZINC001238361296 1055646642 /nfs/dbraw/zinc/64/66/42/1055646642.db2.gz RNFIMEAPZHQTKC-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO Clc1cncc(Br)c1C[N@@H+]1CCC12CCCC2 ZINC001238385449 1055648868 /nfs/dbraw/zinc/64/88/68/1055648868.db2.gz AEKRCJKYORUILF-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Clc1cncc(Br)c1C[N@H+]1CCC12CCCC2 ZINC001238385449 1055648873 /nfs/dbraw/zinc/64/88/73/1055648873.db2.gz AEKRCJKYORUILF-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO CC(C)c1cc(Br)cc(C[NH+]2CC(C(F)F)C2)c1 ZINC001238412629 1055653935 /nfs/dbraw/zinc/65/39/35/1055653935.db2.gz FAWCHYAQICHURE-UHFFFAOYSA-N 1 2 318.205 4.269 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3sccc3[C@@H]2c2cccs2)on1 ZINC000032774586 1055654683 /nfs/dbraw/zinc/65/46/83/1055654683.db2.gz SHVMNLXAZYMCCS-MRXNPFEDSA-N 1 2 316.451 4.254 20 0 DIADLO Cc1cc(C[N@H+]2CCc3sccc3[C@@H]2c2cccs2)on1 ZINC000032774586 1055654686 /nfs/dbraw/zinc/65/46/86/1055654686.db2.gz SHVMNLXAZYMCCS-MRXNPFEDSA-N 1 2 316.451 4.254 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(C)c(Cl)cn2)cn1 ZINC001238424038 1055655150 /nfs/dbraw/zinc/65/51/50/1055655150.db2.gz VCTKVLUIKHQICG-KRWDZBQOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc(C)c(Cl)cn2)cn1 ZINC001238424038 1055655156 /nfs/dbraw/zinc/65/51/56/1055655156.db2.gz VCTKVLUIKHQICG-KRWDZBQOSA-N 1 2 301.821 4.084 20 0 DIADLO CCOc1cccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)c1 ZINC000921621172 1055657245 /nfs/dbraw/zinc/65/72/45/1055657245.db2.gz BSAXZAGGBFURBX-CYBMUJFWSA-N 1 2 302.418 4.222 20 0 DIADLO Cc1cnc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)c(C)c1 ZINC001238429197 1055658738 /nfs/dbraw/zinc/65/87/38/1055658738.db2.gz CCVUKVJBXADYPQ-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cnc(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)c(C)c1 ZINC001238429197 1055658744 /nfs/dbraw/zinc/65/87/44/1055658744.db2.gz CCVUKVJBXADYPQ-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO CC(C)Oc1cc(C[N@@H+]2CCc3sccc3C2)ccc1F ZINC001238455049 1055663316 /nfs/dbraw/zinc/66/33/16/1055663316.db2.gz UAXHDYWGKIHZSU-UHFFFAOYSA-N 1 2 305.418 4.233 20 0 DIADLO CC(C)Oc1cc(C[N@H+]2CCc3sccc3C2)ccc1F ZINC001238455049 1055663320 /nfs/dbraw/zinc/66/33/20/1055663320.db2.gz UAXHDYWGKIHZSU-UHFFFAOYSA-N 1 2 305.418 4.233 20 0 DIADLO Cc1cc(F)cc(Br)c1C[N@H+](C)C1CC(F)(F)C1 ZINC001238567414 1055690114 /nfs/dbraw/zinc/69/01/14/1055690114.db2.gz SELCUFDMZMBZBW-UHFFFAOYSA-N 1 2 322.168 4.126 20 0 DIADLO COc1cnc(C[N@H+](C)Cc2ccc(Cl)cc2)c(Cl)c1 ZINC001238489953 1055671956 /nfs/dbraw/zinc/67/19/56/1055671956.db2.gz WDSZTLQXFSZTQK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cnc(C[N@@H+](C)Cc2ccc(Cl)cc2)c(Cl)c1 ZINC001238489953 1055671961 /nfs/dbraw/zinc/67/19/61/1055671961.db2.gz WDSZTLQXFSZTQK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@H]2c2nccs2)cc1C1CC1 ZINC001238511340 1055676389 /nfs/dbraw/zinc/67/63/89/1055676389.db2.gz LBFIXAJRYMFZCD-INIZCTEOSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@H]2c2nccs2)cc1C1CC1 ZINC001238511340 1055676397 /nfs/dbraw/zinc/67/63/97/1055676397.db2.gz LBFIXAJRYMFZCD-INIZCTEOSA-N 1 2 302.418 4.497 20 0 DIADLO Cc1cc(C[N@@H+]2CCOCC23CC3)ccc1Oc1ccccc1 ZINC001238519930 1055678387 /nfs/dbraw/zinc/67/83/87/1055678387.db2.gz ALKLUCRZZSIBHP-UHFFFAOYSA-N 1 2 309.409 4.152 20 0 DIADLO Cc1cc(C[N@H+]2CCOCC23CC3)ccc1Oc1ccccc1 ZINC001238519930 1055678390 /nfs/dbraw/zinc/67/83/90/1055678390.db2.gz ALKLUCRZZSIBHP-UHFFFAOYSA-N 1 2 309.409 4.152 20 0 DIADLO Cc1ncccc1C[N@@H+](C)Cc1ccc(F)c(OC(C)C)c1F ZINC001238536573 1055680523 /nfs/dbraw/zinc/68/05/23/1055680523.db2.gz PODSQSICOYHUCP-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO Cc1ncccc1C[N@H+](C)Cc1ccc(F)c(OC(C)C)c1F ZINC001238536573 1055680531 /nfs/dbraw/zinc/68/05/31/1055680531.db2.gz PODSQSICOYHUCP-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO Cc1cc(F)cc(Br)c1C[N@@H+](C)C1CC(F)(F)C1 ZINC001238567414 1055690107 /nfs/dbraw/zinc/69/01/07/1055690107.db2.gz SELCUFDMZMBZBW-UHFFFAOYSA-N 1 2 322.168 4.126 20 0 DIADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccccc1-c1ccc(F)cc1F ZINC001238585138 1055692485 /nfs/dbraw/zinc/69/24/85/1055692485.db2.gz ZATADGRHDAEAJN-CYBMUJFWSA-N 1 2 315.363 4.185 20 0 DIADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1ccccc1-c1ccc(F)cc1F ZINC001238585138 1055692489 /nfs/dbraw/zinc/69/24/89/1055692489.db2.gz ZATADGRHDAEAJN-CYBMUJFWSA-N 1 2 315.363 4.185 20 0 DIADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@@H]2C)cnc1-c1ccccc1 ZINC001238614627 1055697946 /nfs/dbraw/zinc/69/79/46/1055697946.db2.gz JWEMDNYPEWTMIV-KRWDZBQOSA-N 1 2 317.436 4.435 20 0 DIADLO Cc1cc(C[N@H+]2CCn3cccc3[C@@H]2C)cnc1-c1ccccc1 ZINC001238614627 1055697950 /nfs/dbraw/zinc/69/79/50/1055697950.db2.gz JWEMDNYPEWTMIV-KRWDZBQOSA-N 1 2 317.436 4.435 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1cnc(C3CC3)c(C)c1)CC2 ZINC001238622790 1055700080 /nfs/dbraw/zinc/70/00/80/1055700080.db2.gz FDOYCHWEORXLMM-UHFFFAOYSA-N 1 2 320.436 4.028 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1cnc(C3CC3)c(C)c1)CC2 ZINC001238622790 1055700083 /nfs/dbraw/zinc/70/00/83/1055700083.db2.gz FDOYCHWEORXLMM-UHFFFAOYSA-N 1 2 320.436 4.028 20 0 DIADLO Cc1cnc(-c2ccccc2)c(C[N@@H+]2CCn3cccc3[C@@H]2C)c1 ZINC001238624667 1055700104 /nfs/dbraw/zinc/70/01/04/1055700104.db2.gz KHSKOLSBHPAHBH-KRWDZBQOSA-N 1 2 317.436 4.435 20 0 DIADLO Cc1cnc(-c2ccccc2)c(C[N@H+]2CCn3cccc3[C@@H]2C)c1 ZINC001238624667 1055700110 /nfs/dbraw/zinc/70/01/10/1055700110.db2.gz KHSKOLSBHPAHBH-KRWDZBQOSA-N 1 2 317.436 4.435 20 0 DIADLO Cc1cnc(-c2ccccc2)c(C[N@@H+]2CCn3cccc3[C@H]2C)c1 ZINC001238624669 1055702542 /nfs/dbraw/zinc/70/25/42/1055702542.db2.gz KHSKOLSBHPAHBH-QGZVFWFLSA-N 1 2 317.436 4.435 20 0 DIADLO Cc1cnc(-c2ccccc2)c(C[N@H+]2CCn3cccc3[C@H]2C)c1 ZINC001238624669 1055702552 /nfs/dbraw/zinc/70/25/52/1055702552.db2.gz KHSKOLSBHPAHBH-QGZVFWFLSA-N 1 2 317.436 4.435 20 0 DIADLO Cc1ccc(C(=O)Nc2ccn3cc[nH+]c3c2)c(Cl)c1Cl ZINC001596385815 1055703329 /nfs/dbraw/zinc/70/33/29/1055703329.db2.gz AMUHUIVSXRKWMS-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO CCCOC1C[NH+](Cc2cccc(-c3ccc(Cl)cn3)c2)C1 ZINC001238642033 1055706606 /nfs/dbraw/zinc/70/66/06/1055706606.db2.gz RUSJAUKCEKUUED-UHFFFAOYSA-N 1 2 316.832 4.013 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@H+](C)Cc1ccccc1OC ZINC001238654361 1055710092 /nfs/dbraw/zinc/71/00/92/1055710092.db2.gz WJIZUIRHCPOYFQ-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@@H+](C)Cc1ccccc1OC ZINC001238654361 1055710105 /nfs/dbraw/zinc/71/01/05/1055710105.db2.gz WJIZUIRHCPOYFQ-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(-c3ccccc3)cnc2F)C[C@H]1F ZINC001238657794 1055710170 /nfs/dbraw/zinc/71/01/70/1055710170.db2.gz KYXTYTBIXZGJSL-CXAGYDPISA-N 1 2 302.368 4.068 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)cnc2F)C[C@H]1F ZINC001238657794 1055710183 /nfs/dbraw/zinc/71/01/83/1055710183.db2.gz KYXTYTBIXZGJSL-CXAGYDPISA-N 1 2 302.368 4.068 20 0 DIADLO C[N@H+](Cc1cccc(O)c1)Cc1cc(-c2ccccc2)cnc1F ZINC001238657136 1055710390 /nfs/dbraw/zinc/71/03/90/1055710390.db2.gz HKSFCNFGFUBYTP-UHFFFAOYSA-N 1 2 322.383 4.225 20 0 DIADLO C[N@@H+](Cc1cccc(O)c1)Cc1cc(-c2ccccc2)cnc1F ZINC001238657136 1055710401 /nfs/dbraw/zinc/71/04/01/1055710401.db2.gz HKSFCNFGFUBYTP-UHFFFAOYSA-N 1 2 322.383 4.225 20 0 DIADLO CSc1ccc(Cl)cc1C[N@@H+]1CCc2nc(C)sc2C1 ZINC001238677920 1055718459 /nfs/dbraw/zinc/71/84/59/1055718459.db2.gz RETBETUIUWNDCR-UHFFFAOYSA-N 1 2 324.902 4.385 20 0 DIADLO CSc1ccc(Cl)cc1C[N@H+]1CCc2nc(C)sc2C1 ZINC001238677920 1055718470 /nfs/dbraw/zinc/71/84/70/1055718470.db2.gz RETBETUIUWNDCR-UHFFFAOYSA-N 1 2 324.902 4.385 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(-c2ccc(Cl)cn2)cc1 ZINC001238687539 1055724281 /nfs/dbraw/zinc/72/42/81/1055724281.db2.gz MRTZBHKMOYJWEY-HOTGVXAUSA-N 1 2 322.786 4.284 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(-c2ccc(Cl)cn2)cc1 ZINC001238687539 1055724289 /nfs/dbraw/zinc/72/42/89/1055724289.db2.gz MRTZBHKMOYJWEY-HOTGVXAUSA-N 1 2 322.786 4.284 20 0 DIADLO C[N@H+](Cc1coc(-c2cccc(F)c2)n1)Cc1ccc(F)cc1 ZINC000045735461 1055727550 /nfs/dbraw/zinc/72/75/50/1055727550.db2.gz GUCJPMFIMZABCL-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1coc(-c2cccc(F)c2)n1)Cc1ccc(F)cc1 ZINC000045735461 1055727558 /nfs/dbraw/zinc/72/75/58/1055727558.db2.gz GUCJPMFIMZABCL-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO CSc1ncc(C)cc1C[N@@H+]1CCc2c(Cl)cccc2C1 ZINC001238719395 1055730614 /nfs/dbraw/zinc/73/06/14/1055730614.db2.gz YGLSVVPZVDAJHO-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CSc1ncc(C)cc1C[N@H+]1CCc2c(Cl)cccc2C1 ZINC001238719395 1055730624 /nfs/dbraw/zinc/73/06/24/1055730624.db2.gz YGLSVVPZVDAJHO-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c(F)cn1 ZINC001238729893 1055736440 /nfs/dbraw/zinc/73/64/40/1055736440.db2.gz PAUOLEDETHMMNJ-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c(F)cn1 ZINC001238729893 1055736450 /nfs/dbraw/zinc/73/64/50/1055736450.db2.gz PAUOLEDETHMMNJ-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CC(C)Oc1c(C[N@@H+]2CCC(F)(F)[C@H](C)C2)ccc(F)c1F ZINC001238738933 1055737827 /nfs/dbraw/zinc/73/78/27/1055737827.db2.gz HOHBTQJZMGWLNK-LLVKDONJSA-N 1 2 319.342 4.229 20 0 DIADLO CC(C)Oc1c(C[N@H+]2CCC(F)(F)[C@H](C)C2)ccc(F)c1F ZINC001238738933 1055737837 /nfs/dbraw/zinc/73/78/37/1055737837.db2.gz HOHBTQJZMGWLNK-LLVKDONJSA-N 1 2 319.342 4.229 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cc(Cl)cc2cccnc21 ZINC000046503334 1055739532 /nfs/dbraw/zinc/73/95/32/1055739532.db2.gz MJNXNAVUPAXRAH-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cc(Cl)cc2cccnc21 ZINC000046503334 1055739543 /nfs/dbraw/zinc/73/95/43/1055739543.db2.gz MJNXNAVUPAXRAH-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC23CCCC3)c(Br)c1F ZINC001238762185 1055741309 /nfs/dbraw/zinc/74/13/09/1055741309.db2.gz FLQHEYJQRNCRGG-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1ccc(C[N@H+]2CCC23CCCC3)c(Br)c1F ZINC001238762185 1055741316 /nfs/dbraw/zinc/74/13/16/1055741316.db2.gz FLQHEYJQRNCRGG-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Cc1cc(F)cc(Cl)c1C[N@@H+]1CCc2c(O)cccc2C1 ZINC001238779487 1055750834 /nfs/dbraw/zinc/75/08/34/1055750834.db2.gz AUQUQXHUFITUKG-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Cc1cc(F)cc(Cl)c1C[N@H+]1CCc2c(O)cccc2C1 ZINC001238779487 1055750850 /nfs/dbraw/zinc/75/08/50/1055750850.db2.gz AUQUQXHUFITUKG-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Cc1cc(OC(C)C)ncc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001238829344 1055756670 /nfs/dbraw/zinc/75/66/70/1055756670.db2.gz MREDFBPBUPKFGG-UHFFFAOYSA-N 1 2 311.360 4.169 20 0 DIADLO Cc1noc([C@H](C)[NH+]2CCC([C@@H](F)c3ccccc3F)CC2)n1 ZINC000671699522 1055756893 /nfs/dbraw/zinc/75/68/93/1055756893.db2.gz KMLSHTMMTACWRZ-MEDUHNTESA-N 1 2 321.371 4.001 20 0 DIADLO COc1ccc([C@H](Nc2cccc[nH+]2)c2ccc(F)cc2)cc1 ZINC000057151098 1055775563 /nfs/dbraw/zinc/77/55/63/1055775563.db2.gz QDPHQIJZWIUKMU-LJQANCHMSA-N 1 2 308.356 4.431 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1ncc(C2CC2)o1 ZINC000347538119 1055786138 /nfs/dbraw/zinc/78/61/38/1055786138.db2.gz KKYKGUDTVYQYLX-OAHLLOKOSA-N 1 2 300.402 4.144 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000347538119 1055786147 /nfs/dbraw/zinc/78/61/47/1055786147.db2.gz KKYKGUDTVYQYLX-OAHLLOKOSA-N 1 2 300.402 4.144 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2csc(-c3ccco3)n2)oc1C ZINC000282195321 1055787311 /nfs/dbraw/zinc/78/73/11/1055787311.db2.gz NPXSAOQAKLJKGF-LLVKDONJSA-N 1 2 302.399 4.464 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2Cl)nn1C ZINC000282197194 1055792174 /nfs/dbraw/zinc/79/21/74/1055792174.db2.gz NSZZXDARUOOXFH-WDEREUQCSA-N 1 2 312.244 4.447 20 0 DIADLO C[C@@H]1CO[C@H](C(F)(F)F)C[N@@H+]1Cc1csc2ccccc12 ZINC000671712834 1055807476 /nfs/dbraw/zinc/80/74/76/1055807476.db2.gz JEPZDGHDXZBWCK-YGRLFVJLSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@@H]1CO[C@H](C(F)(F)F)C[N@H+]1Cc1csc2ccccc12 ZINC000671712834 1055807483 /nfs/dbraw/zinc/80/74/83/1055807483.db2.gz JEPZDGHDXZBWCK-YGRLFVJLSA-N 1 2 315.360 4.053 20 0 DIADLO CC(C)c1ccc(-c2noc(C[N@H+](C)Cc3ccccc3)n2)cc1 ZINC000061745489 1055870519 /nfs/dbraw/zinc/87/05/19/1055870519.db2.gz VCACLSQTOWYHCD-UHFFFAOYSA-N 1 2 321.424 4.492 20 0 DIADLO CC(C)c1ccc(-c2noc(C[N@@H+](C)Cc3ccccc3)n2)cc1 ZINC000061745489 1055870532 /nfs/dbraw/zinc/87/05/32/1055870532.db2.gz VCACLSQTOWYHCD-UHFFFAOYSA-N 1 2 321.424 4.492 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H]1CCCC(F)(F)C1 ZINC000282246995 1055873345 /nfs/dbraw/zinc/87/33/45/1055873345.db2.gz OCSRRUJPUKHXEQ-ZDUSSCGKSA-N 1 2 319.355 4.149 20 0 DIADLO O=C(c1cccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1)C(F)(F)F ZINC001239386068 1055884462 /nfs/dbraw/zinc/88/44/62/1055884462.db2.gz GFAJXMCBDTYXMX-UHFFFAOYSA-N 1 2 316.282 4.489 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cccc(C(=O)C(F)(F)F)c1 ZINC001239385393 1055884506 /nfs/dbraw/zinc/88/45/06/1055884506.db2.gz BROXPRDSZPUOHN-UHFFFAOYSA-N 1 2 304.271 4.055 20 0 DIADLO CC[N@H+](Cc1ccn(-c2ccccc2)n1)Cc1cccc(F)c1 ZINC000063517558 1055894258 /nfs/dbraw/zinc/89/42/58/1055894258.db2.gz CXWLGMCBMTUVRH-UHFFFAOYSA-N 1 2 309.388 4.034 20 0 DIADLO CC[N@@H+](Cc1ccn(-c2ccccc2)n1)Cc1cccc(F)c1 ZINC000063517558 1055894267 /nfs/dbraw/zinc/89/42/67/1055894267.db2.gz CXWLGMCBMTUVRH-UHFFFAOYSA-N 1 2 309.388 4.034 20 0 DIADLO Cc1cc(CNC(=O)C[C@H]2C[C@H](C)CC(C)(C)C2)cc(C)[nH+]1 ZINC001597956378 1055897583 /nfs/dbraw/zinc/89/75/83/1055897583.db2.gz VNLWJOCFDGWLTN-XJKSGUPXSA-N 1 2 302.462 4.167 20 0 DIADLO Cc1cc(CNC(=O)[C@@H](C)c2cccc(CC(C)C)c2)cc(C)[nH+]1 ZINC001597955455 1055897676 /nfs/dbraw/zinc/89/76/76/1055897676.db2.gz BLBQYFRZEGDWGG-KRWDZBQOSA-N 1 2 324.468 4.317 20 0 DIADLO Cc1cc(CNC(=O)C(C)(C)CCCc2ccccc2)cc(C)[nH+]1 ZINC001597955740 1055897917 /nfs/dbraw/zinc/89/79/17/1055897917.db2.gz FBKXFECWHWRDQH-UHFFFAOYSA-N 1 2 324.468 4.364 20 0 DIADLO c1ccc(-c2ccc(-c3cc[nH+]c(N4CCOCC4)c3)cc2)cc1 ZINC001239492498 1055907719 /nfs/dbraw/zinc/90/77/19/1055907719.db2.gz MIWBGQWEZZJVCS-UHFFFAOYSA-N 1 2 316.404 4.252 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)C1CCC(C2CC2)CC1 ZINC001598071732 1055910534 /nfs/dbraw/zinc/91/05/34/1055910534.db2.gz UDQWZTIWUOXNNL-UHFFFAOYSA-N 1 2 309.413 4.232 20 0 DIADLO CCNc1ccc(C)cc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001598076641 1055910665 /nfs/dbraw/zinc/91/06/65/1055910665.db2.gz CRCJXQOHGGMDDU-UHFFFAOYSA-N 1 2 320.396 4.069 20 0 DIADLO CSc1ccc(-c2ccc(C[NH+]3CCOCC3)cc2F)cc1 ZINC001239499872 1055913987 /nfs/dbraw/zinc/91/39/87/1055913987.db2.gz XZXIAAONXFOTSQ-UHFFFAOYSA-N 1 2 317.429 4.047 20 0 DIADLO COc1ccccc1C[N@H+](Cc1cccs1)Cc1ccccn1 ZINC000064809618 1055928104 /nfs/dbraw/zinc/92/81/04/1055928104.db2.gz NWNKPHWPZVBOQS-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1cccs1)Cc1ccccn1 ZINC000064809618 1055928115 /nfs/dbraw/zinc/92/81/15/1055928115.db2.gz NWNKPHWPZVBOQS-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO Cc1cc(C)cc(-c2ncnc3c2C[N@H+](Cc2ccccc2)C3)c1 ZINC001239523265 1055928330 /nfs/dbraw/zinc/92/83/30/1055928330.db2.gz XSROZOUEZSTLHK-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1cc(C)cc(-c2ncnc3c2C[N@@H+](Cc2ccccc2)C3)c1 ZINC001239523265 1055928344 /nfs/dbraw/zinc/92/83/44/1055928344.db2.gz XSROZOUEZSTLHK-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO CCc1ccc(C(C)(C)CNC(=O)c2c(C)cc(C)[nH+]c2C)cc1 ZINC001539917724 1055931823 /nfs/dbraw/zinc/93/18/23/1055931823.db2.gz JDMMSKHUHWUPET-UHFFFAOYSA-N 1 2 324.468 4.277 20 0 DIADLO CCc1cnc(C[N@H+](C)C[C@@H]2CC[C@H](c3ccccc3)O2)s1 ZINC001615743775 1055933891 /nfs/dbraw/zinc/93/38/91/1055933891.db2.gz HBYXFWUJXCCKNQ-DOTOQJQBSA-N 1 2 316.470 4.058 20 0 DIADLO CCc1cnc(C[N@@H+](C)C[C@@H]2CC[C@H](c3ccccc3)O2)s1 ZINC001615743775 1055933903 /nfs/dbraw/zinc/93/39/03/1055933903.db2.gz HBYXFWUJXCCKNQ-DOTOQJQBSA-N 1 2 316.470 4.058 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2csc(CCC(C)C)n2)cc1 ZINC000065040593 1055934938 /nfs/dbraw/zinc/93/49/38/1055934938.db2.gz IEPBHCPMWKSOCJ-UHFFFAOYSA-N 1 2 318.486 4.372 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2csc(CCC(C)C)n2)cc1 ZINC000065040593 1055934951 /nfs/dbraw/zinc/93/49/51/1055934951.db2.gz IEPBHCPMWKSOCJ-UHFFFAOYSA-N 1 2 318.486 4.372 20 0 DIADLO Fc1cccc(-c2ccc(-c3ccc(-n4cc[nH+]c4)cc3)nn2)c1 ZINC001239534320 1055935153 /nfs/dbraw/zinc/93/51/53/1055935153.db2.gz RAHFJVQPYHJQLI-UHFFFAOYSA-N 1 2 316.339 4.135 20 0 DIADLO CCCCc1nc(C[N@@H+](Cc2ccccc2)CC2CCC2)no1 ZINC000065161240 1055941193 /nfs/dbraw/zinc/94/11/93/1055941193.db2.gz ITXNKNHCGZZZBM-UHFFFAOYSA-N 1 2 313.445 4.215 20 0 DIADLO CCCCc1nc(C[N@H+](Cc2ccccc2)CC2CCC2)no1 ZINC000065161240 1055941204 /nfs/dbraw/zinc/94/12/04/1055941204.db2.gz ITXNKNHCGZZZBM-UHFFFAOYSA-N 1 2 313.445 4.215 20 0 DIADLO Cc1c(Cl)c(C[N@H+]2C[C@@H](C)OC(C)(C)C2)nc2ccccc12 ZINC000065423216 1055946798 /nfs/dbraw/zinc/94/67/98/1055946798.db2.gz PGMRHKJCUBAYFE-GFCCVEGCSA-N 1 2 318.848 4.196 20 0 DIADLO Cc1c(Cl)c(C[N@@H+]2C[C@@H](C)OC(C)(C)C2)nc2ccccc12 ZINC000065423216 1055946807 /nfs/dbraw/zinc/94/68/07/1055946807.db2.gz PGMRHKJCUBAYFE-GFCCVEGCSA-N 1 2 318.848 4.196 20 0 DIADLO CCn1cc(CNc2cc3cc[nH]c3c[nH+]2)c(-c2ccccc2)n1 ZINC001620988997 1055962622 /nfs/dbraw/zinc/96/26/22/1055962622.db2.gz XUUNHTHZOGOTNK-UHFFFAOYSA-N 1 2 317.396 4.058 20 0 DIADLO CC[N@H+](Cc1nc2c(s1)C[C@H](C)CC2)Cc1scnc1C ZINC001620676874 1055978518 /nfs/dbraw/zinc/97/85/18/1055978518.db2.gz FZDUSZARWHPNIH-LLVKDONJSA-N 1 2 321.515 4.055 20 0 DIADLO CC[N@@H+](Cc1nc2c(s1)C[C@H](C)CC2)Cc1scnc1C ZINC001620676874 1055978524 /nfs/dbraw/zinc/97/85/24/1055978524.db2.gz FZDUSZARWHPNIH-LLVKDONJSA-N 1 2 321.515 4.055 20 0 DIADLO COc1ccc(-c2c[nH+]c(N3CCCCC3)cc2C)c(OC)c1 ZINC001239620956 1055981216 /nfs/dbraw/zinc/98/12/16/1055981216.db2.gz AJSZAGWAAJAEFL-UHFFFAOYSA-N 1 2 312.413 4.065 20 0 DIADLO COc1ccc(C[NH2+]Cc2cc(Cl)cc(Cl)c2F)o1 ZINC001621034648 1055996327 /nfs/dbraw/zinc/99/63/27/1055996327.db2.gz IGIXRMGQYJXMBY-UHFFFAOYSA-N 1 2 304.148 4.024 20 0 DIADLO C[C@H]([NH2+]Cc1nc2c(s1)CCC2)c1nc2ccccc2s1 ZINC001620801363 1055996641 /nfs/dbraw/zinc/99/66/41/1055996641.db2.gz ZPQHFLKICUMRQO-JTQLQIEISA-N 1 2 315.467 4.092 20 0 DIADLO c1ccc(-c2cccc(-c3cc[nH+]c(N4CCOCC4)c3)c2)cc1 ZINC001239651692 1056001360 /nfs/dbraw/zinc/00/13/60/1056001360.db2.gz MBJRCWRSEGOPSP-UHFFFAOYSA-N 1 2 316.404 4.252 20 0 DIADLO Brc1ccsc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000067966792 1056002137 /nfs/dbraw/zinc/00/21/37/1056002137.db2.gz HGIPJXDAZGDXGA-GFCCVEGCSA-N 1 2 311.248 4.176 20 0 DIADLO Brc1ccsc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000067966792 1056002144 /nfs/dbraw/zinc/00/21/44/1056002144.db2.gz HGIPJXDAZGDXGA-GFCCVEGCSA-N 1 2 311.248 4.176 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1ccc2c(c1)C[C@@H](C)O2 ZINC001621043630 1056003640 /nfs/dbraw/zinc/00/36/40/1056003640.db2.gz MNYLOLPGJCTBFO-CYBMUJFWSA-N 1 2 314.454 4.270 20 0 DIADLO CCOc1cccc(CNc2c[nH+]c(C)c(C)c2)c1OC(F)F ZINC001621047053 1056005784 /nfs/dbraw/zinc/00/57/84/1056005784.db2.gz FLVDLFYNLPTNJN-UHFFFAOYSA-N 1 2 322.355 4.311 20 0 DIADLO COc1ccc(C(C)C)cc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001239659207 1056006408 /nfs/dbraw/zinc/00/64/08/1056006408.db2.gz UEAUVQKRNAOYNN-UHFFFAOYSA-N 1 2 307.397 4.125 20 0 DIADLO CCn1cc(CNc2[nH+]c3ccccc3n2C2CCCC2)c(C)n1 ZINC001621051400 1056010434 /nfs/dbraw/zinc/01/04/34/1056010434.db2.gz CJTVTPRSSUDWLI-UHFFFAOYSA-N 1 2 323.444 4.288 20 0 DIADLO COc1ccc(OC)c(-c2c[nH+]c(N3CCCCC3)cc2C)c1 ZINC001239664596 1056013784 /nfs/dbraw/zinc/01/37/84/1056013784.db2.gz BGCTVVWGRIVTHD-UHFFFAOYSA-N 1 2 312.413 4.065 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000071090524 1056029354 /nfs/dbraw/zinc/02/93/54/1056029354.db2.gz LMRSDKGYINNQBP-HXUWFJFHSA-N 1 2 322.383 4.109 20 0 DIADLO CCCCC1CCC(NC(=O)[C@@H](CC(C)C)n2cc[nH+]c2)CC1 ZINC001583168673 1056032399 /nfs/dbraw/zinc/03/23/99/1056032399.db2.gz WMKSRDYXGSWVNC-DAWZGUTISA-N 1 2 319.493 4.336 20 0 DIADLO CC[C@](C)([NH2+]Cc1cc(-c2ccccc2)no1)c1nccs1 ZINC000072684138 1056032696 /nfs/dbraw/zinc/03/26/96/1056032696.db2.gz RHVOJOMBKNBHGH-KRWDZBQOSA-N 1 2 313.426 4.213 20 0 DIADLO CC(C)C[C@H](C(=O)N(C)c1ccc2ccccc2c1)n1cc[nH+]c1 ZINC001540590289 1056048034 /nfs/dbraw/zinc/04/80/34/1056048034.db2.gz FYVIETRNQDRFNR-LJQANCHMSA-N 1 2 321.424 4.287 20 0 DIADLO CCc1ccccc1-c1ncnc2c1C[N@H+](Cc1ccccc1)C2 ZINC001239743668 1056052429 /nfs/dbraw/zinc/05/24/29/1056052429.db2.gz WIEJDHGSGPAMKA-UHFFFAOYSA-N 1 2 315.420 4.222 20 0 DIADLO CCc1ccccc1-c1ncnc2c1C[N@@H+](Cc1ccccc1)C2 ZINC001239743668 1056052437 /nfs/dbraw/zinc/05/24/37/1056052437.db2.gz WIEJDHGSGPAMKA-UHFFFAOYSA-N 1 2 315.420 4.222 20 0 DIADLO CCN(C(=O)[C@@H](CC(C)C)n1cc[nH+]c1)c1cccc(Cl)c1 ZINC001540687566 1056062742 /nfs/dbraw/zinc/06/27/42/1056062742.db2.gz UFFHOOPPKXAWJQ-MRXNPFEDSA-N 1 2 319.836 4.177 20 0 DIADLO CCN(C(=O)[C@H](CC(C)C)n1cc[nH+]c1)c1cccc(Cl)c1 ZINC001540687565 1056063554 /nfs/dbraw/zinc/06/35/54/1056063554.db2.gz UFFHOOPPKXAWJQ-INIZCTEOSA-N 1 2 319.836 4.177 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccc(C(=O)N(C)C)cc2)c1 ZINC001239801006 1056080131 /nfs/dbraw/zinc/08/01/31/1056080131.db2.gz KLKNIZDCGINVBA-UHFFFAOYSA-N 1 2 310.441 4.210 20 0 DIADLO Cc1ccc(-c2ccccc2C[NH+]2CCOCC2)c(Cl)c1 ZINC001239862921 1056113729 /nfs/dbraw/zinc/11/37/29/1056113729.db2.gz MDJYXOTWHFPSLB-UHFFFAOYSA-N 1 2 301.817 4.148 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@H]2CSc3ccccc32)n1 ZINC000765805462 1056120648 /nfs/dbraw/zinc/12/06/48/1056120648.db2.gz WAYDCJWUGCUOLP-LBPRGKRZSA-N 1 2 304.484 4.377 20 0 DIADLO CC[C@H](c1ccccc1)N(CC)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001542469373 1056124418 /nfs/dbraw/zinc/12/44/18/1056124418.db2.gz CAJWMWFWQMSHJJ-GOSISDBHSA-N 1 2 307.397 4.176 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)/C=C/C=C(Cl)Cl ZINC001611244620 1056130384 /nfs/dbraw/zinc/13/03/84/1056130384.db2.gz JXUUXIQOPKBQBY-DUXPYHPUSA-N 1 2 322.195 4.199 20 0 DIADLO CCN(CC)C(=O)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001239890955 1056137188 /nfs/dbraw/zinc/13/71/88/1056137188.db2.gz RRCGZXVGXKIKBK-UHFFFAOYSA-N 1 2 319.408 4.226 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(C(=O)NCC(C)C)cc2)c1 ZINC001239913737 1056152246 /nfs/dbraw/zinc/15/22/46/1056152246.db2.gz DTDVXYHMVKLHRF-UHFFFAOYSA-N 1 2 324.424 4.101 20 0 DIADLO Clc1cccc(Br)c1C[N@@H+]1CCC[C@@H]2C[C@@H]21 ZINC001137815824 1056157345 /nfs/dbraw/zinc/15/73/45/1056157345.db2.gz BPWRRQRWDMUYQT-RNCFNFMXSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1cccc(Br)c1C[N@H+]1CCC[C@@H]2C[C@@H]21 ZINC001137815824 1056157348 /nfs/dbraw/zinc/15/73/48/1056157348.db2.gz BPWRRQRWDMUYQT-RNCFNFMXSA-N 1 2 300.627 4.087 20 0 DIADLO Cc1cc(NC(=O)[C@H](C)CC2CCCC2)ccc1-n1cc[nH+]c1 ZINC001542875899 1056161885 /nfs/dbraw/zinc/16/18/85/1056161885.db2.gz WZAXMUZMWQEWSI-OAHLLOKOSA-N 1 2 311.429 4.336 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C[C@H](C)c3ccco3)cc2)[nH+]c1C ZINC000921652309 1056164207 /nfs/dbraw/zinc/16/42/07/1056164207.db2.gz HKMOKQODRRRQCD-LBPRGKRZSA-N 1 2 323.396 4.419 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C[C@@H](C)n3cccc3)cc2)[nH+]c1C ZINC000921665176 1056173326 /nfs/dbraw/zinc/17/33/26/1056173326.db2.gz XJZJCCKXQMBZTQ-CYBMUJFWSA-N 1 2 322.412 4.085 20 0 DIADLO CCC(C)(C)c1ccc(C(=O)NCc2c[nH+]c(C)cc2C)cc1 ZINC001583839694 1056182258 /nfs/dbraw/zinc/18/22/58/1056182258.db2.gz LQHIKGUKGXPDNJ-UHFFFAOYSA-N 1 2 310.441 4.316 20 0 DIADLO CCC[C@H]1CCCC[C@H]1CNC(=O)c1c(C)cc(C)[nH+]c1C ZINC001583876228 1056191901 /nfs/dbraw/zinc/19/19/01/1056191901.db2.gz DICSXWQWIPBCEL-IRXDYDNUSA-N 1 2 302.462 4.343 20 0 DIADLO CCCOc1cccc(Nc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001611786178 1056192135 /nfs/dbraw/zinc/19/21/35/1056192135.db2.gz QJIICDDPLDMNLF-UHFFFAOYSA-N 1 2 318.380 4.415 20 0 DIADLO Nc1[nH+]cccc1Nc1cc(Cl)c(Cl)c(Cl)c1O ZINC001212410217 1056204591 /nfs/dbraw/zinc/20/45/91/1056204591.db2.gz IJUHJRVVBQTCBG-UHFFFAOYSA-N 1 2 304.564 4.073 20 0 DIADLO Cc1ccc(F)c(-c2cc(F)cc(C)c2C[NH+]2CCOCC2)c1 ZINC001239966762 1056205488 /nfs/dbraw/zinc/20/54/88/1056205488.db2.gz UDDCSKLVCFNOBA-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO CC[C@@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccccc1 ZINC000054225411 1056209081 /nfs/dbraw/zinc/20/90/81/1056209081.db2.gz FEDWLEMZNWSIQK-MRXNPFEDSA-N 1 2 323.371 4.144 20 0 DIADLO CCc1cc(N(C)[C@H](CC)Cc2ccc(C)cc2)nc(CC)[nH+]1 ZINC001612043892 1056228867 /nfs/dbraw/zinc/22/88/67/1056228867.db2.gz YEWSEZSFZKBQSR-GOSISDBHSA-N 1 2 311.473 4.367 20 0 DIADLO Cc1cc(N2CC[C@@H](c3ccccc3)[C@@H]2C)nc(C2CCC2)[nH+]1 ZINC001612074103 1056233921 /nfs/dbraw/zinc/23/39/21/1056233921.db2.gz VBKWHQRVBDBBOU-MAUKXSAKSA-N 1 2 307.441 4.435 20 0 DIADLO Cc1cc(NC(=O)C=C2CCC(C(C)(C)C)CC2)c(C)c[nH+]1 ZINC001584009128 1056235514 /nfs/dbraw/zinc/23/55/14/1056235514.db2.gz FZGANFNTTWECER-UHFFFAOYSA-N 1 2 300.446 4.222 20 0 DIADLO CCc1nccc(Nc2ccc([N@@H+]3CCCC[C@@H]3C)cc2C)n1 ZINC001612135527 1056245237 /nfs/dbraw/zinc/24/52/37/1056245237.db2.gz IDZCZTHTPMQHJV-HNNXBMFYSA-N 1 2 310.445 4.470 20 0 DIADLO CCc1nccc(Nc2ccc([N@H+]3CCCC[C@@H]3C)cc2C)n1 ZINC001612135527 1056245254 /nfs/dbraw/zinc/24/52/54/1056245254.db2.gz IDZCZTHTPMQHJV-HNNXBMFYSA-N 1 2 310.445 4.470 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+][C@H]1CCCc2cn(C(C)C)nc21 ZINC000765822347 1056253842 /nfs/dbraw/zinc/25/38/42/1056253842.db2.gz ZRVPFCDAIYQTNF-LRDDRELGSA-N 1 2 316.449 4.051 20 0 DIADLO Cc1nc(N(C)Cc2ccc(Cl)c(F)c2)c2c([nH+]1)CCCC2 ZINC001612215914 1056254365 /nfs/dbraw/zinc/25/43/65/1056254365.db2.gz ZEJXVMFLKKEIBP-UHFFFAOYSA-N 1 2 319.811 4.093 20 0 DIADLO CC[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1nc(C)cs1 ZINC000347643448 1056259370 /nfs/dbraw/zinc/25/93/70/1056259370.db2.gz WSSANSKMEWVLLY-CQSZACIVSA-N 1 2 319.474 4.265 20 0 DIADLO CC(C)OC(=O)CC[C@H](C)Nc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC001612335617 1056274112 /nfs/dbraw/zinc/27/41/12/1056274112.db2.gz AJKYRHHFNXZTIN-AWEZNQCLSA-N 1 2 321.465 4.256 20 0 DIADLO CC(C)OC(=O)CC[C@@H](C)Nc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC001612335618 1056274136 /nfs/dbraw/zinc/27/41/36/1056274136.db2.gz AJKYRHHFNXZTIN-CQSZACIVSA-N 1 2 321.465 4.256 20 0 DIADLO C/C(=C/C(=O)NCc1cc(C)[nH+]c(C)c1)c1ccccc1Cl ZINC001584183142 1056277011 /nfs/dbraw/zinc/27/70/11/1056277011.db2.gz DPFVXMUADIAOTQ-WQLSENKSSA-N 1 2 314.816 4.072 20 0 DIADLO Cc1cc[nH+]c(C)c1-c1ccc(C(=O)N2CCC(C)CC2)cc1 ZINC001240043032 1056277857 /nfs/dbraw/zinc/27/78/57/1056277857.db2.gz FPEFAUXEUGYSLV-UHFFFAOYSA-N 1 2 308.425 4.238 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2cccc(C(=O)N(CC)CC)c2)cc1 ZINC001240053641 1056287081 /nfs/dbraw/zinc/28/70/81/1056287081.db2.gz JVZMUMJBPDNFQY-UHFFFAOYSA-N 1 2 324.424 4.197 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@@H+]1Cc1cncnc1 ZINC000353140142 1056290736 /nfs/dbraw/zinc/29/07/36/1056290736.db2.gz AFFDSDUEJSHOOX-MRXNPFEDSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@H+]1Cc1cncnc1 ZINC000353140142 1056290749 /nfs/dbraw/zinc/29/07/49/1056290749.db2.gz AFFDSDUEJSHOOX-MRXNPFEDSA-N 1 2 321.346 4.223 20 0 DIADLO CC(C)c1cc(NC[C@H]2CCOC(C)(C)C2)nc(C(C)C)[nH+]1 ZINC001612457456 1056291628 /nfs/dbraw/zinc/29/16/28/1056291628.db2.gz ZLGQRSBNBWDCQC-AWEZNQCLSA-N 1 2 305.466 4.341 20 0 DIADLO O=C(c1ccc(-n2cc[nH+]c2)cc1)N1CCC2(CCCCC2)CC1 ZINC000338688114 1056294070 /nfs/dbraw/zinc/29/40/70/1056294070.db2.gz AYBLCFWXQVVPDT-UHFFFAOYSA-N 1 2 323.440 4.059 20 0 DIADLO CC(C)(C)[C@@H]1CCC[C@@H]1Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001612471898 1056294384 /nfs/dbraw/zinc/29/43/84/1056294384.db2.gz ZXKDOCXYZVJTFL-KGLIPLIRSA-N 1 2 315.465 4.208 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C[C@H](C)c1ccc(C(C)C)cc1 ZINC001584250193 1056297796 /nfs/dbraw/zinc/29/77/96/1056297796.db2.gz HCKXASFASLDKQT-AWEZNQCLSA-N 1 2 310.441 4.376 20 0 DIADLO Cc1cc(N[C@H]2CCNc3ccccc32)[nH+]cc1C(F)(F)F ZINC001168640042 1056311760 /nfs/dbraw/zinc/31/17/60/1056311760.db2.gz WUOLDOSSLGVVSB-AWEZNQCLSA-N 1 2 307.319 4.378 20 0 DIADLO Nc1ccc(Cl)cc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001212427730 1056313786 /nfs/dbraw/zinc/31/37/86/1056313786.db2.gz ZIHSXDANSGSFRS-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO CCc1cc(N2CCC[C@@]2(C)Cc2cccc(C)c2)nc(C)[nH+]1 ZINC001612678722 1056319058 /nfs/dbraw/zinc/31/90/58/1056319058.db2.gz OKXAFGJKFDLARE-FQEVSTJZSA-N 1 2 309.457 4.257 20 0 DIADLO Cc1cc(N2CCC[C@@](F)(c3ccccc3)C2)nc(C2CC2)[nH+]1 ZINC001612785668 1056326930 /nfs/dbraw/zinc/32/69/30/1056326930.db2.gz CUQIFQMJKOWWNN-IBGZPJMESA-N 1 2 311.404 4.128 20 0 DIADLO C[C@H]([NH2+][C@H](COCc1ccccc1)c1ccccc1)c1ncc[nH]1 ZINC000353535496 1056329241 /nfs/dbraw/zinc/32/92/41/1056329241.db2.gz WDFZNUWMIQQQQJ-QFBILLFUSA-N 1 2 321.424 4.018 20 0 DIADLO CCc1cc(N[C@H](C)c2ccc(C(F)(F)F)nc2)nc(CC)[nH+]1 ZINC001612858998 1056332711 /nfs/dbraw/zinc/33/27/11/1056332711.db2.gz AENCLSSSRUQHBV-SNVBAGLBSA-N 1 2 324.350 4.188 20 0 DIADLO Cc1cc(NC[C@@H]2[C@@H](c3ccccc3)C2(F)F)nc(C2CC2)[nH+]1 ZINC001612871051 1056334703 /nfs/dbraw/zinc/33/47/03/1056334703.db2.gz DLWLSECQRRDAMK-GDBMZVCRSA-N 1 2 315.367 4.123 20 0 DIADLO O=C(Nc1ccccc1)c1cccc(-c2ccc3[nH+]ccn3c2)c1 ZINC001240114096 1056334723 /nfs/dbraw/zinc/33/47/23/1056334723.db2.gz QXVOOEJSMWYOFM-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO Cc1cc(NCc2cccc3ncccc23)nc(C2CCC2)[nH+]1 ZINC001612871231 1056335825 /nfs/dbraw/zinc/33/58/25/1056335825.db2.gz JHBYRSLSXPTCGI-UHFFFAOYSA-N 1 2 304.397 4.213 20 0 DIADLO c1ccc2c(c1)NCC[C@@H]2Nc1cc2c3c(c1)CCC[NH+]3CCC2 ZINC001168644430 1056336455 /nfs/dbraw/zinc/33/64/55/1056336455.db2.gz KDFLEKYSGFIGHS-FQEVSTJZSA-N 1 2 319.452 4.354 20 0 DIADLO Cc1cc(N[C@H](C)COCC2CCCCC2)nc(C2CC2)[nH+]1 ZINC001612945788 1056341702 /nfs/dbraw/zinc/34/17/02/1056341702.db2.gz NBWAXRFRWRNJRO-CQSZACIVSA-N 1 2 303.450 4.060 20 0 DIADLO CC(C)(C)C[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1ccccc1 ZINC001544014280 1056344227 /nfs/dbraw/zinc/34/42/27/1056344227.db2.gz UMVLOZQUBSPWRJ-GOSISDBHSA-N 1 2 321.424 4.470 20 0 DIADLO O=C(CCc1c[nH]c[nH+]1)Nc1ccccc1Sc1ccccc1 ZINC000353821641 1056371974 /nfs/dbraw/zinc/37/19/74/1056371974.db2.gz DPTPVECSTNXNQR-UHFFFAOYSA-N 1 2 323.421 4.132 20 0 DIADLO O=C(CCc1c[nH+]c[nH]1)Nc1ccccc1Sc1ccccc1 ZINC000353821641 1056371992 /nfs/dbraw/zinc/37/19/92/1056371992.db2.gz DPTPVECSTNXNQR-UHFFFAOYSA-N 1 2 323.421 4.132 20 0 DIADLO Cc1cc(N)nc(SCc2cc(Cl)cc(Cl)c2F)[nH+]1 ZINC001613370937 1056372299 /nfs/dbraw/zinc/37/22/99/1056372299.db2.gz ZXWFIBPRDJVLKP-UHFFFAOYSA-N 1 2 318.204 4.105 20 0 DIADLO COc1ccc(-c2ccccn2)cc1-c1ccc2[nH+]ccn2c1 ZINC001240218435 1056375791 /nfs/dbraw/zinc/37/57/91/1056375791.db2.gz NMHQCFKLSYTCRY-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO c1cn2cc(-c3cncc(SCc4ccccc4)n3)ccc2[nH+]1 ZINC001240217550 1056376239 /nfs/dbraw/zinc/37/62/39/1056376239.db2.gz QIYRSVQYHZYADZ-UHFFFAOYSA-N 1 2 318.405 4.084 20 0 DIADLO c1cn2cc(-c3ccc(-c4cn5ccccc5n4)cc3)ccc2[nH+]1 ZINC001240218557 1056376821 /nfs/dbraw/zinc/37/68/21/1056376821.db2.gz ROSSPDJWQXEKCH-UHFFFAOYSA-N 1 2 310.360 4.316 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2noc3c2CCCC3)cc1 ZINC000108851799 1056378311 /nfs/dbraw/zinc/37/83/11/1056378311.db2.gz ABPJGGGNEGFRNV-KRWDZBQOSA-N 1 2 300.377 4.030 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2noc3c2CCCC3)cc1 ZINC000108851799 1056378327 /nfs/dbraw/zinc/37/83/27/1056378327.db2.gz ABPJGGGNEGFRNV-KRWDZBQOSA-N 1 2 300.377 4.030 20 0 DIADLO CCCCOc1c(F)cc(-c2ccc3[nH+]ccn3c2)cc1F ZINC001240221651 1056379429 /nfs/dbraw/zinc/37/94/29/1056379429.db2.gz OLTDXZUYARXLME-UHFFFAOYSA-N 1 2 302.324 4.458 20 0 DIADLO C/C(=C(/F)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C1CC1 ZINC001544368767 1056414597 /nfs/dbraw/zinc/41/45/97/1056414597.db2.gz JAFZJMZZIWGCTF-GDNBJRDFSA-N 1 2 319.767 4.118 20 0 DIADLO Cc1cc(NC(=O)C2CCC(C)(C)CC2)ccc1-n1cc[nH+]c1 ZINC001584947832 1056448151 /nfs/dbraw/zinc/44/81/51/1056448151.db2.gz HHURVOMLWFSNCY-UHFFFAOYSA-N 1 2 311.429 4.336 20 0 DIADLO COc1cccc(-c2nc(C[N@H+](C)Cc3ccccc3)cs2)c1 ZINC000057828298 1056448878 /nfs/dbraw/zinc/44/88/78/1056448878.db2.gz IWHKIXUKEUIIFG-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1cccc(-c2nc(C[N@@H+](C)Cc3ccccc3)cs2)c1 ZINC000057828298 1056448890 /nfs/dbraw/zinc/44/88/90/1056448890.db2.gz IWHKIXUKEUIIFG-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO Cc1cc(NC(=O)C2CC3(C2)CCCCC3)ccc1-n1cc[nH+]c1 ZINC001584953794 1056449492 /nfs/dbraw/zinc/44/94/92/1056449492.db2.gz YINAQHRIJQINJM-UHFFFAOYSA-N 1 2 323.440 4.480 20 0 DIADLO Cc1cc(NC(=O)[C@@]2(C)CC=C(C)CC2)ccc1-n1cc[nH+]c1 ZINC001584952947 1056449857 /nfs/dbraw/zinc/44/98/57/1056449857.db2.gz MVLLRXLEIOJKIE-IBGZPJMESA-N 1 2 309.413 4.256 20 0 DIADLO COc1cccc2c(N[C@@H]3CCCc4cccnc43)cc[nH+]c12 ZINC001168660667 1056456588 /nfs/dbraw/zinc/45/65/88/1056456588.db2.gz IXJUHPPVURFQSE-MRXNPFEDSA-N 1 2 305.381 4.128 20 0 DIADLO CCc1cnc(C[NH2+]C(C)(C)c2ccc(Br)cc2)o1 ZINC000072578489 1056461446 /nfs/dbraw/zinc/46/14/46/1056461446.db2.gz HONVYJSOPGOELN-UHFFFAOYSA-N 1 2 323.234 4.024 20 0 DIADLO CCc1cn(Cc2ccc(OCc3ccc(F)cc3)cc2)c[nH+]1 ZINC001614962116 1056461698 /nfs/dbraw/zinc/46/16/98/1056461698.db2.gz YWMZEBCRLKOEBV-UHFFFAOYSA-N 1 2 310.372 4.212 20 0 DIADLO CC(C)[C@@H]1N(C(=O)C[C@H](C)n2cc[nH+]c2)CC12CCCCCC2 ZINC001544619370 1056467390 /nfs/dbraw/zinc/46/73/90/1056467390.db2.gz QHQGBZRXPCTMKT-WMZOPIPTSA-N 1 2 317.477 4.042 20 0 DIADLO CC(C)[C@H]1N(C(=O)C[C@@H](C)n2cc[nH+]c2)CC12CCCCCC2 ZINC001544619369 1056468278 /nfs/dbraw/zinc/46/82/78/1056468278.db2.gz QHQGBZRXPCTMKT-SJLPKXTDSA-N 1 2 317.477 4.042 20 0 DIADLO C[C@H](c1nc(-c2ccccc2)no1)[N@H+](C)Cc1ccc(F)cc1 ZINC000072863363 1056472324 /nfs/dbraw/zinc/47/23/24/1056472324.db2.gz SDJBLAZQHWMKCV-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1nc(-c2ccccc2)no1)[N@@H+](C)Cc1ccc(F)cc1 ZINC000072863363 1056472327 /nfs/dbraw/zinc/47/23/27/1056472327.db2.gz SDJBLAZQHWMKCV-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO Fc1cc(C(F)(F)F)ccc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001240396961 1056479734 /nfs/dbraw/zinc/47/97/34/1056479734.db2.gz UZBYGDMBZGVPJN-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2cc(C)cnc2Cl)C2CC2)n1 ZINC000921783130 1056486748 /nfs/dbraw/zinc/48/67/48/1056486748.db2.gz NSXDXUCUAPKCLT-ZDUSSCGKSA-N 1 2 307.850 4.049 20 0 DIADLO Fc1cc(C[NH+]2CCOCC2)ccc1-c1ccc2occc2c1 ZINC001240425303 1056498341 /nfs/dbraw/zinc/49/83/41/1056498341.db2.gz FMUSXRZPRYKAIQ-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1nc3cc(C)ccc3s1)CC2 ZINC001615366204 1056498339 /nfs/dbraw/zinc/49/83/39/1056498339.db2.gz DWDBPVDJZVPDST-UHFFFAOYSA-N 1 2 324.449 4.172 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1nc3cc(C)ccc3s1)CC2 ZINC001615366204 1056498344 /nfs/dbraw/zinc/49/83/44/1056498344.db2.gz DWDBPVDJZVPDST-UHFFFAOYSA-N 1 2 324.449 4.172 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)cc1-c1ccc2occc2c1 ZINC001240424946 1056498770 /nfs/dbraw/zinc/49/87/70/1056498770.db2.gz DALOSCBQZBOYDP-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2ccc(-c3cccnc3)cc2)n1 ZINC000921802904 1056503100 /nfs/dbraw/zinc/50/31/00/1056503100.db2.gz FMLMMVNUQXQAOG-UHFFFAOYSA-N 1 2 321.424 4.324 20 0 DIADLO CNc1ccc(Nc2c(SC)cc(C)nc2SC)c[nH+]1 ZINC001203447720 1056504958 /nfs/dbraw/zinc/50/49/58/1056504958.db2.gz ODNGXAWKWOIXEH-UHFFFAOYSA-N 1 2 306.460 4.014 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1coc(-c2ccccc2F)n1 ZINC001615397066 1056505022 /nfs/dbraw/zinc/50/50/22/1056505022.db2.gz DFGSXNMMYOATAG-UHFFFAOYSA-N 1 2 300.333 4.096 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1coc(-c2ccccc2F)n1 ZINC001615397066 1056505037 /nfs/dbraw/zinc/50/50/37/1056505037.db2.gz DFGSXNMMYOATAG-UHFFFAOYSA-N 1 2 300.333 4.096 20 0 DIADLO COc1cccc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)n1 ZINC001615435899 1056511213 /nfs/dbraw/zinc/51/12/13/1056511213.db2.gz MAXVOEIKGGSEDU-ZDUSSCGKSA-N 1 2 316.832 4.469 20 0 DIADLO COc1cccc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)n1 ZINC001615435899 1056511224 /nfs/dbraw/zinc/51/12/24/1056511224.db2.gz MAXVOEIKGGSEDU-ZDUSSCGKSA-N 1 2 316.832 4.469 20 0 DIADLO CC(C)OCCCNc1[nH+]ccc2cccc(C(F)(F)F)c21 ZINC001168676779 1056521733 /nfs/dbraw/zinc/52/17/33/1056521733.db2.gz HAYIHRGCWKERBE-UHFFFAOYSA-N 1 2 312.335 4.481 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)OCc3ccccc3CC(C)C)ccn12 ZINC001585286831 1056523781 /nfs/dbraw/zinc/52/37/81/1056523781.db2.gz UWGPIOLMBPTYJI-UHFFFAOYSA-N 1 2 322.408 4.198 20 0 DIADLO C[C@H]1CCC[C@H](C)[N@H+](Cc2c(F)c(F)c(F)c(F)c2F)C1 ZINC001615544805 1056532085 /nfs/dbraw/zinc/53/20/85/1056532085.db2.gz ZZOJITSHPVTIBI-IUCAKERBSA-N 1 2 307.306 4.393 20 0 DIADLO C[C@H]1CCC[C@H](C)[N@@H+](Cc2c(F)c(F)c(F)c(F)c2F)C1 ZINC001615544805 1056532092 /nfs/dbraw/zinc/53/20/92/1056532092.db2.gz ZZOJITSHPVTIBI-IUCAKERBSA-N 1 2 307.306 4.393 20 0 DIADLO Cc1cccc(Oc2nc(-c3ccn4cc[nH+]c4c3)ncc2F)c1 ZINC001240503684 1056540769 /nfs/dbraw/zinc/54/07/69/1056540769.db2.gz SKFSLBMYJDQABR-UHFFFAOYSA-N 1 2 320.327 4.031 20 0 DIADLO CCc1ccc(-c2ccc(-c3ccn4cc[nH+]c4c3)nn2)cc1 ZINC001240503493 1056540954 /nfs/dbraw/zinc/54/09/54/1056540954.db2.gz CJPOVNLRBWACED-UHFFFAOYSA-N 1 2 300.365 4.021 20 0 DIADLO CC(C)C[C@@H](C(=O)N1CCCC[C@@H]1CC1CCC1)n1cc[nH+]c1 ZINC001585376826 1056541259 /nfs/dbraw/zinc/54/12/59/1056541259.db2.gz WIXHRSWMYBVSFH-MSOLQXFVSA-N 1 2 317.477 4.042 20 0 DIADLO CC(C)OCCCNc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1 ZINC001168681841 1056542560 /nfs/dbraw/zinc/54/25/60/1056542560.db2.gz XZHLOKFPJKZOAD-UHFFFAOYSA-N 1 2 309.413 4.457 20 0 DIADLO Fc1c(F)c(-c2ccn3cc[nH+]c3c2)ccc1OC(F)(F)F ZINC001240508828 1056543747 /nfs/dbraw/zinc/54/37/47/1056543747.db2.gz LKDNJDAKMYQYEL-UHFFFAOYSA-N 1 2 314.213 4.178 20 0 DIADLO Cc1nc2c(cc(-c3ccn4cc[nH+]c4c3)cc2F)n1C(C)C ZINC001240509186 1056543872 /nfs/dbraw/zinc/54/38/72/1056543872.db2.gz UOTPAGNPVAJNCN-UHFFFAOYSA-N 1 2 308.360 4.379 20 0 DIADLO CCOC(=O)c1cc2c(ccc(-c3ccn4cc[nH+]c4c3)c2C)o1 ZINC001240512957 1056546776 /nfs/dbraw/zinc/54/67/76/1056546776.db2.gz DQTRNVYYDZMZSX-UHFFFAOYSA-N 1 2 320.348 4.233 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc(N2CCCC2)c1 ZINC001240537974 1056560746 /nfs/dbraw/zinc/56/07/46/1056560746.db2.gz RQJQIIQQMCNPHA-UHFFFAOYSA-N 1 2 319.408 4.148 20 0 DIADLO CC[C@@H](C)C[C@H](C)Nc1[nH+]cccc1CC(=O)OC(C)(C)C ZINC001168688767 1056563570 /nfs/dbraw/zinc/56/35/70/1056563570.db2.gz DMLNPDOAZNZZLE-KGLIPLIRSA-N 1 2 306.450 4.202 20 0 DIADLO c1ccc([C@@H](CC2CC2)Nc2cc(N3CCCC3)nc[nH+]2)cc1 ZINC000672224292 1056573507 /nfs/dbraw/zinc/57/35/07/1056573507.db2.gz AMCOFXMAVCIGEB-QGZVFWFLSA-N 1 2 308.429 4.030 20 0 DIADLO c1ccc([C@@H](CC2CC2)Nc2cc(N3CCCC3)[nH+]cn2)cc1 ZINC000672224292 1056573519 /nfs/dbraw/zinc/57/35/19/1056573519.db2.gz AMCOFXMAVCIGEB-QGZVFWFLSA-N 1 2 308.429 4.030 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cccc(-c3cc[nH]n3)c2)cc1 ZINC001240563745 1056580137 /nfs/dbraw/zinc/58/01/37/1056580137.db2.gz RHFRCTOHZBJZGW-UHFFFAOYSA-N 1 2 300.365 4.144 20 0 DIADLO Clc1cccc2c(NCC3(c4ccccn4)CC3)cc[nH+]c12 ZINC000672250650 1056589044 /nfs/dbraw/zinc/58/90/44/1056589044.db2.gz PLSJEWJKCQRWKA-UHFFFAOYSA-N 1 2 309.800 4.427 20 0 DIADLO Fc1cc(F)c(F)c(C[NH2+]Cc2cccc(C3CC3)c2)c1F ZINC001620829120 1056590728 /nfs/dbraw/zinc/59/07/28/1056590728.db2.gz RCERLEFFXAWRLI-UHFFFAOYSA-N 1 2 309.306 4.410 20 0 DIADLO Clc1cccc2c(N3CCC([C@H]4CCOC4)CC3)cc[nH+]c12 ZINC000672250399 1056591270 /nfs/dbraw/zinc/59/12/70/1056591270.db2.gz UWEYVUGPRWVMMY-AWEZNQCLSA-N 1 2 316.832 4.141 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCOc3ccccc3[C@@H]2C)c1 ZINC001616041739 1056607514 /nfs/dbraw/zinc/60/75/14/1056607514.db2.gz ATOAEHNIECJOOY-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCOc3ccccc3[C@@H]2C)c1 ZINC001616041739 1056607517 /nfs/dbraw/zinc/60/75/17/1056607517.db2.gz ATOAEHNIECJOOY-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO CC(C)c1cc(N2CCC3(CCOCC3)CC2)nc(C(C)C)[nH+]1 ZINC000672297067 1056615089 /nfs/dbraw/zinc/61/50/89/1056615089.db2.gz INBBTQMLFKJERH-UHFFFAOYSA-N 1 2 317.477 4.120 20 0 DIADLO CCC[C@H]1CCC[N@@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001616158814 1056616056 /nfs/dbraw/zinc/61/60/56/1056616056.db2.gz KARLGLLVUCJLTH-BBRMVZONSA-N 1 2 309.837 4.066 20 0 DIADLO CCC[C@H]1CCC[N@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001616158814 1056616061 /nfs/dbraw/zinc/61/60/61/1056616061.db2.gz KARLGLLVUCJLTH-BBRMVZONSA-N 1 2 309.837 4.066 20 0 DIADLO Cc1cccc2c1[C@@H](C)C[C@@H]2CC(=O)Nc1c(C)c[nH+]cc1C ZINC001616246114 1056624529 /nfs/dbraw/zinc/62/45/29/1056624529.db2.gz FGMQMKMTFLSPCK-XJKSGUPXSA-N 1 2 308.425 4.048 20 0 DIADLO Cc1ccc2ncc(C[N@@H+]3CCc4ccc(F)c(F)c4C3)cc2c1 ZINC001616348787 1056639524 /nfs/dbraw/zinc/63/95/24/1056639524.db2.gz YBHGEQWTEDWHDI-UHFFFAOYSA-N 1 2 324.374 4.380 20 0 DIADLO Cc1ccc2ncc(C[N@H+]3CCc4ccc(F)c(F)c4C3)cc2c1 ZINC001616348787 1056639528 /nfs/dbraw/zinc/63/95/28/1056639528.db2.gz YBHGEQWTEDWHDI-UHFFFAOYSA-N 1 2 324.374 4.380 20 0 DIADLO CCC1(CC)CN(Cc2cc(OC)cc(C)[nH+]2)c2ccccc21 ZINC001616483078 1056663579 /nfs/dbraw/zinc/66/35/79/1056663579.db2.gz IOMRJIKPHHDKBW-UHFFFAOYSA-N 1 2 310.441 4.477 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@@H]2CCCc3cc(F)ccc32)n1 ZINC000921948801 1056670662 /nfs/dbraw/zinc/67/06/62/1056670662.db2.gz HPHUYOLHXOBEOR-OAHLLOKOSA-N 1 2 302.393 4.278 20 0 DIADLO C[C@H]1c2cc(Cl)c(Cl)cc2CC[N@H+]1CCOCC1CC1 ZINC001616584658 1056682670 /nfs/dbraw/zinc/68/26/70/1056682670.db2.gz RLDAFMJQEAWORU-NSHDSACASA-N 1 2 314.256 4.339 20 0 DIADLO C[C@H]1c2cc(Cl)c(Cl)cc2CC[N@@H+]1CCOCC1CC1 ZINC001616584658 1056682675 /nfs/dbraw/zinc/68/26/75/1056682675.db2.gz RLDAFMJQEAWORU-NSHDSACASA-N 1 2 314.256 4.339 20 0 DIADLO O[C@H]1CCN(c2ccc(Nc3ccc(C4CCCC4)cc3)c[nH+]2)C1 ZINC001212457481 1056696313 /nfs/dbraw/zinc/69/63/13/1056696313.db2.gz FPSHMLCNZFVZHY-IBGZPJMESA-N 1 2 323.440 4.054 20 0 DIADLO COc1ccc(C(F)(F)F)cc1-c1ccc2[nH+]c(C)cn2c1 ZINC001240826675 1056722283 /nfs/dbraw/zinc/72/22/83/1056722283.db2.gz SAZQIPRKQCYLKF-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Cc1cccn2cc(C[N@@H+]3CC(C)(C)[C@@H]3c3cccs3)nc12 ZINC000672578635 1056726827 /nfs/dbraw/zinc/72/68/27/1056726827.db2.gz HMLXEKUBUAKJJC-INIZCTEOSA-N 1 2 311.454 4.287 20 0 DIADLO Cc1cccn2cc(C[N@H+]3CC(C)(C)[C@@H]3c3cccs3)nc12 ZINC000672578635 1056726839 /nfs/dbraw/zinc/72/68/39/1056726839.db2.gz HMLXEKUBUAKJJC-INIZCTEOSA-N 1 2 311.454 4.287 20 0 DIADLO Cc1cn2cc(-c3ccc(Oc4cccnc4)cc3)ccc2[nH+]1 ZINC001240880534 1056738185 /nfs/dbraw/zinc/73/81/85/1056738185.db2.gz KVBRYEDXAQFGAR-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO COCCC[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc(F)cc1 ZINC000672622277 1056738527 /nfs/dbraw/zinc/73/85/27/1056738527.db2.gz VMWVKLQWBTULAA-HUUCEWRRSA-N 1 2 301.352 4.071 20 0 DIADLO COCCC[C@H]([NH2+][C@H]1CCCC1(F)F)c1ccc(F)cc1 ZINC000672622276 1056739001 /nfs/dbraw/zinc/73/90/01/1056739001.db2.gz VMWVKLQWBTULAA-GJZGRUSLSA-N 1 2 301.352 4.071 20 0 DIADLO FC(F)(F)c1cnc2c(c1)[C@@H]([NH2+][C@@H]1CCCC1(F)F)CCC2 ZINC000672622515 1056739284 /nfs/dbraw/zinc/73/92/84/1056739284.db2.gz ZYGMOEXUHWCUCE-QWHCGFSZSA-N 1 2 320.305 4.255 20 0 DIADLO CC(C)[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc2[nH]c(=O)oc2c1 ZINC000672621897 1056740244 /nfs/dbraw/zinc/74/02/44/1056740244.db2.gz NDFDUZKGIZZNQI-ZIAGYGMSSA-N 1 2 310.344 4.008 20 0 DIADLO Cc1ccc(N2CC[NH+](Cc3ccc(Cl)s3)CC2)cc1C ZINC001616935556 1056743178 /nfs/dbraw/zinc/74/31/78/1056743178.db2.gz DKQPTYLKPKQZKR-UHFFFAOYSA-N 1 2 320.889 4.341 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC[C@@](C)(c3ccccc3)C2)c(C)[nH+]1 ZINC001616970635 1056749005 /nfs/dbraw/zinc/74/90/05/1056749005.db2.gz WCIMNVYWJVTWKR-OAQYLSRUSA-N 1 2 322.452 4.201 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2ccn(C(F)F)n2)o1 ZINC000347680854 1056750097 /nfs/dbraw/zinc/75/00/97/1056750097.db2.gz KQJCREDBGGQLQP-AWEZNQCLSA-N 1 2 309.360 4.297 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2ccn(C(F)F)n2)o1 ZINC000347680854 1056750108 /nfs/dbraw/zinc/75/01/08/1056750108.db2.gz KQJCREDBGGQLQP-AWEZNQCLSA-N 1 2 309.360 4.297 20 0 DIADLO CCCC[C@H]([NH2+][C@H](C(=O)OC)c1ccccc1C)C1CCC1 ZINC001617096548 1056775923 /nfs/dbraw/zinc/77/59/23/1056775923.db2.gz QRROPXALNJXYHD-ROUUACIJSA-N 1 2 303.446 4.158 20 0 DIADLO CC(C)OC(=O)c1cccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1 ZINC001240948538 1056776461 /nfs/dbraw/zinc/77/64/61/1056776461.db2.gz QHLJAPXQLJMXNE-UHFFFAOYSA-N 1 2 324.355 4.244 20 0 DIADLO COc1cc(F)c(-c2ccc(-c3c[nH+]cn3C)cc2)cc1F ZINC001240956570 1056783036 /nfs/dbraw/zinc/78/30/36/1056783036.db2.gz BLBXLSPVMGGYDC-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc(F)c(F)c(F)c1 ZINC001240980364 1056797714 /nfs/dbraw/zinc/79/77/14/1056797714.db2.gz SHGMEWUUABYQDD-UHFFFAOYSA-N 1 2 306.331 4.465 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(F)c(F)c1F ZINC001240991342 1056803314 /nfs/dbraw/zinc/80/33/14/1056803314.db2.gz YZBCDIDJYSAMJD-UHFFFAOYSA-N 1 2 306.331 4.465 20 0 DIADLO COc1c(F)ccc(Nc2ccc[nH+]c2N2CCCCC2)c1F ZINC001212494520 1056846569 /nfs/dbraw/zinc/84/65/69/1056846569.db2.gz OMTIEQVHHQYYTH-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO Clc1cccc(CC[N@@H+]2CCC[C@@H]2c2cc[nH]n2)c1Cl ZINC001617554389 1056848082 /nfs/dbraw/zinc/84/80/82/1056848082.db2.gz DRCHFZKWVMLCMF-CQSZACIVSA-N 1 2 310.228 4.096 20 0 DIADLO Clc1cccc(CC[N@H+]2CCC[C@@H]2c2cc[nH]n2)c1Cl ZINC001617554389 1056848087 /nfs/dbraw/zinc/84/80/87/1056848087.db2.gz DRCHFZKWVMLCMF-CQSZACIVSA-N 1 2 310.228 4.096 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@@H]2CCCc3c(F)cc(F)cc32)n1 ZINC000922150339 1056852815 /nfs/dbraw/zinc/85/28/15/1056852815.db2.gz RMQRKQYGVYAFST-OAHLLOKOSA-N 1 2 320.383 4.418 20 0 DIADLO C[C@H]1C[N@@H+]([C@@H](c2ccccc2)c2ccc(Cl)cc2)CCO1 ZINC000673064213 1056854971 /nfs/dbraw/zinc/85/49/71/1056854971.db2.gz ZIRPLFMZAAWDOO-KSSFIOAISA-N 1 2 301.817 4.150 20 0 DIADLO C[C@H]1C[N@H+]([C@@H](c2ccccc2)c2ccc(Cl)cc2)CCO1 ZINC000673064213 1056854978 /nfs/dbraw/zinc/85/49/78/1056854978.db2.gz ZIRPLFMZAAWDOO-KSSFIOAISA-N 1 2 301.817 4.150 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cc(F)cc(OCC(C)C)c1 ZINC001241076134 1056867439 /nfs/dbraw/zinc/86/74/39/1056867439.db2.gz IOXQFQNXVQQLCQ-UHFFFAOYSA-N 1 2 314.360 4.184 20 0 DIADLO CCOc1ccc(-c2cc[nH+]c(N3CCCCC3)c2)cc1F ZINC001241086397 1056878340 /nfs/dbraw/zinc/87/83/40/1056878340.db2.gz SHPATJPXUTZISO-UHFFFAOYSA-N 1 2 300.377 4.277 20 0 DIADLO c1cn2c(cccc2CNc2cccnc2Oc2ccccc2)[nH+]1 ZINC000682159757 1056893190 /nfs/dbraw/zinc/89/31/90/1056893190.db2.gz MQVLCJISOJNDSX-UHFFFAOYSA-N 1 2 316.364 4.134 20 0 DIADLO COc1cc(OC)cc(-c2c[nH+]c(N3CCCCC3)cc2C)c1 ZINC001241130385 1056912762 /nfs/dbraw/zinc/91/27/62/1056912762.db2.gz CHKRWMIAWJQYFT-UHFFFAOYSA-N 1 2 312.413 4.065 20 0 DIADLO Cc1ccc([C@@H]2CCCCN2C(=O)c2cc3c[nH+]ccc3[nH]2)cc1 ZINC001618009007 1056913442 /nfs/dbraw/zinc/91/34/42/1056913442.db2.gz IGJIAVIXDYTBSN-IBGZPJMESA-N 1 2 319.408 4.239 20 0 DIADLO Cc1ccc(F)cc1C[N@@H+]1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC001618107284 1056923522 /nfs/dbraw/zinc/92/35/22/1056923522.db2.gz ZYDAISUPSOUKBI-GOSISDBHSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1ccc(F)cc1C[N@H+]1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC001618107284 1056923533 /nfs/dbraw/zinc/92/35/33/1056923533.db2.gz ZYDAISUPSOUKBI-GOSISDBHSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+][C@H]2C[C@H](C)n3ccnc32)c1Cl ZINC000922163568 1056939504 /nfs/dbraw/zinc/93/95/04/1056939504.db2.gz CEFSDOUCDBRLOK-ZANVPECISA-N 1 2 310.228 4.294 20 0 DIADLO CCc1nc(C[NH2+]Cc2cccc(COc3ccccc3)c2)co1 ZINC000922163237 1056939964 /nfs/dbraw/zinc/93/99/64/1056939964.db2.gz LCMNFQZNMVQRGH-UHFFFAOYSA-N 1 2 322.408 4.106 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1cc(F)cc(OC(C)C)c1 ZINC001241166638 1056941103 /nfs/dbraw/zinc/94/11/03/1056941103.db2.gz IBGNQBPVWQYHIW-UHFFFAOYSA-N 1 2 300.333 4.165 20 0 DIADLO CC[C@](C)([NH2+]Cc1cccc(OC2CC2)c1F)c1nccs1 ZINC000657369924 1056942832 /nfs/dbraw/zinc/94/28/32/1056942832.db2.gz JBAUXTCIQOJJGN-KRWDZBQOSA-N 1 2 320.433 4.238 20 0 DIADLO CCO[C@@H](C)Oc1ccc2cc(-c3cc[nH+]c(N)c3)ccc2c1 ZINC001241170064 1056943033 /nfs/dbraw/zinc/94/30/33/1056943033.db2.gz IBDXMMCZONOQKW-CYBMUJFWSA-N 1 2 308.381 4.245 20 0 DIADLO Nc1cc(-c2cc(F)c(F)c(OCc3ccccc3)c2)cc[nH+]1 ZINC001241170458 1056943583 /nfs/dbraw/zinc/94/35/83/1056943583.db2.gz OSYJBNWXSIEPPS-UHFFFAOYSA-N 1 2 312.319 4.188 20 0 DIADLO Nc1cc(-c2ccc(-c3noc(C4CCCCC4)n3)cc2)cc[nH+]1 ZINC001241170316 1056943872 /nfs/dbraw/zinc/94/38/72/1056943872.db2.gz HQZAUBKHJYMGME-UHFFFAOYSA-N 1 2 320.396 4.429 20 0 DIADLO Nc1cc(-c2ccc(-c3nnc(-c4ccccc4)o3)cc2)cc[nH+]1 ZINC001241170315 1056943917 /nfs/dbraw/zinc/94/39/17/1056943917.db2.gz HPHQIPCPUYTBES-UHFFFAOYSA-N 1 2 314.348 4.048 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@H](C)c2cccc(F)c2)c(C)[nH+]1 ZINC000115984609 1056959880 /nfs/dbraw/zinc/95/98/80/1056959880.db2.gz ARFPLFLSWFMWLX-NSHDSACASA-N 1 2 300.377 4.278 20 0 DIADLO Cc1cn2c(cccc2-c2cccc(O[C@@H]3CCCCO3)c2)[nH+]1 ZINC001241213228 1056962830 /nfs/dbraw/zinc/96/28/30/1056962830.db2.gz MGDXBIXMGYSQFK-LJQANCHMSA-N 1 2 308.381 4.215 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cccc(O[C@@H]2CCCCO2)c1 ZINC001241215094 1056963585 /nfs/dbraw/zinc/96/35/85/1056963585.db2.gz YNLHGTPSBDXDAR-LJQANCHMSA-N 1 2 308.381 4.215 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc(F)c1 ZINC000116185179 1056967073 /nfs/dbraw/zinc/96/70/73/1056967073.db2.gz YHOJJQVACMMIRD-ZDUSSCGKSA-N 1 2 323.371 4.348 20 0 DIADLO Cc1ccc(C)c(-c2ccc(-c3c[nH+]c(N(C)C)cc3C)nn2)c1 ZINC001241241238 1056976209 /nfs/dbraw/zinc/97/62/09/1056976209.db2.gz ZWXUTJMZPBHHDC-UHFFFAOYSA-N 1 2 318.424 4.197 20 0 DIADLO Cc1ccnc(-c2cc(C)cc(-c3c[nH+]c(N(C)C)cc3C)n2)c1 ZINC001241249970 1056979671 /nfs/dbraw/zinc/97/96/71/1056979671.db2.gz BSCRBDHCNSKEFT-UHFFFAOYSA-N 1 2 318.424 4.197 20 0 DIADLO c1cc(C[NH2+]Cc2nnc(C3CC3)s2)cc(C2CCCC2)c1 ZINC000657496201 1056979970 /nfs/dbraw/zinc/97/99/70/1056979970.db2.gz MZSYCWXXIJXMEZ-UHFFFAOYSA-N 1 2 313.470 4.363 20 0 DIADLO Fc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c(F)c1Cl ZINC001143617922 1056985953 /nfs/dbraw/zinc/98/59/53/1056985953.db2.gz CEYKACSVYUPNNF-AOOOYVTPSA-N 1 2 307.718 4.095 20 0 DIADLO Fc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c(F)c1Cl ZINC001143617922 1056985956 /nfs/dbraw/zinc/98/59/56/1056985956.db2.gz CEYKACSVYUPNNF-AOOOYVTPSA-N 1 2 307.718 4.095 20 0 DIADLO CC(C)OC(=O)c1ccc(-c2ccc(-c3c[nH+]cn3C)cc2)cc1 ZINC001241286154 1056997128 /nfs/dbraw/zinc/99/71/28/1056997128.db2.gz ZKTXGYNXWNPTQM-UHFFFAOYSA-N 1 2 320.392 4.319 20 0 DIADLO Fc1cccc(F)c1C1([NH2+]Cc2ccnn2C2CCC2)CCC1 ZINC000922300800 1057001400 /nfs/dbraw/zinc/00/14/00/1057001400.db2.gz SAQSHOFAMXNNTF-UHFFFAOYSA-N 1 2 317.383 4.055 20 0 DIADLO CCOc1ccc(F)c(F)c1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001241310671 1057008489 /nfs/dbraw/zinc/00/84/89/1057008489.db2.gz JKNSOTZPQCHMII-UHFFFAOYSA-N 1 2 314.335 4.431 20 0 DIADLO CC(C)(C)c1coc(CNc2[nH+]c3ccccc3n2C2CC2)n1 ZINC000922328392 1057009011 /nfs/dbraw/zinc/00/90/11/1057009011.db2.gz CTOBFNKPOOGNFM-UHFFFAOYSA-N 1 2 310.401 4.269 20 0 DIADLO CCOc1cc(F)ccc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001241321152 1057013387 /nfs/dbraw/zinc/01/33/87/1057013387.db2.gz CVGZPACENKHKLX-UHFFFAOYSA-N 1 2 309.331 4.231 20 0 DIADLO COc1ccc(OCc2ccccc2)c(-c2c[nH+]c(N)c(C)c2)c1 ZINC001241325435 1057014523 /nfs/dbraw/zinc/01/45/23/1057014523.db2.gz SJOQKDZACMBKFM-UHFFFAOYSA-N 1 2 320.392 4.227 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@H](C)c3ccccc3F)cc2[nH+]1 ZINC000338854383 1057023960 /nfs/dbraw/zinc/02/39/60/1057023960.db2.gz FYMPWTUEVZSHKE-NSHDSACASA-N 1 2 311.360 4.143 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1F ZINC000338855563 1057025272 /nfs/dbraw/zinc/02/52/72/1057025272.db2.gz DYQNPQQHDIIMHR-AWEZNQCLSA-N 1 2 323.371 4.144 20 0 DIADLO CCc1cccc2c1OCC[C@@H]2[NH2+][C@@H]1CCCc2oc(C)nc21 ZINC000925359702 1057027236 /nfs/dbraw/zinc/02/72/36/1057027236.db2.gz CVBFCNWJJKUOIF-JKSUJKDBSA-N 1 2 312.413 4.036 20 0 DIADLO CSc1ccc(C[NH2+][C@H]2c3ccccc3OC[C@@H]2F)s1 ZINC000922520300 1057030238 /nfs/dbraw/zinc/03/02/38/1057030238.db2.gz LAOKKLFXEKUYCZ-WFASDCNBSA-N 1 2 309.431 4.031 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@@H](c2ccccn2)C2CC2)cs1 ZINC000922586887 1057037606 /nfs/dbraw/zinc/03/76/06/1057037606.db2.gz SUVJFUPYPDHEPU-OAHLLOKOSA-N 1 2 301.459 4.077 20 0 DIADLO Cn1c[nH+]cc1CNc1ccccc1Oc1ccc(Cl)cc1 ZINC000347725922 1057039757 /nfs/dbraw/zinc/03/97/57/1057039757.db2.gz PXJIDTNILYYDDY-UHFFFAOYSA-N 1 2 313.788 4.478 20 0 DIADLO C[C@H]([NH2+]Cc1cnc([C@H]2CCCO2)s1)c1c(F)cccc1F ZINC000922652001 1057044950 /nfs/dbraw/zinc/04/49/50/1057044950.db2.gz JJZJZPGQHJQYSI-IINYFYTJSA-N 1 2 324.396 4.124 20 0 DIADLO O=C(CC1CCC(F)(F)CC1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000624958311 1057050027 /nfs/dbraw/zinc/05/00/27/1057050027.db2.gz OIZBPBDCCPWPNF-UHFFFAOYSA-N 1 2 319.355 4.231 20 0 DIADLO FC1(F)CCC[C@@H]1[NH2+]Cc1c[nH]nc1-c1cccc(Cl)c1 ZINC000673618270 1057062028 /nfs/dbraw/zinc/06/20/28/1057062028.db2.gz YWPJITWCXQMALC-ZDUSSCGKSA-N 1 2 311.763 4.008 20 0 DIADLO CC[C@H](C)Oc1cc(C[NH2+][C@H]2CCCC2(F)F)ccc1OC ZINC000673618598 1057062657 /nfs/dbraw/zinc/06/26/57/1057062657.db2.gz UQTFULYAXYZCMK-LRDDRELGSA-N 1 2 313.388 4.150 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Nc1cccc(-c2cccs2)c1 ZINC000624988674 1057064459 /nfs/dbraw/zinc/06/44/59/1057064459.db2.gz SXJRJEAEVPIRJK-UHFFFAOYSA-N 1 2 311.410 4.031 20 0 DIADLO Cn1c[nH+]cc1CNc1ccc(F)cc1-c1ccc(Cl)cc1 ZINC000347760360 1057071371 /nfs/dbraw/zinc/07/13/71/1057071371.db2.gz XOAHAARUPKTKLH-UHFFFAOYSA-N 1 2 315.779 4.492 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@@H]2CCCc3cccnc32)c(Cl)c1 ZINC000922874642 1057072683 /nfs/dbraw/zinc/07/26/83/1057072683.db2.gz AJLLSRRACNFKBK-MRXNPFEDSA-N 1 2 304.796 4.350 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cccnc1C(F)(F)F ZINC000625088001 1057086172 /nfs/dbraw/zinc/08/61/72/1057086172.db2.gz ICPUDTAYTUBDLO-LLVKDONJSA-N 1 2 312.310 4.433 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cccnc1C(F)(F)F ZINC000625088001 1057086177 /nfs/dbraw/zinc/08/61/77/1057086177.db2.gz ICPUDTAYTUBDLO-LLVKDONJSA-N 1 2 312.310 4.433 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cccnc1C(F)(F)F ZINC000625088003 1057086322 /nfs/dbraw/zinc/08/63/22/1057086322.db2.gz ICPUDTAYTUBDLO-NSHDSACASA-N 1 2 312.310 4.433 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cccnc1C(F)(F)F ZINC000625088003 1057086325 /nfs/dbraw/zinc/08/63/25/1057086325.db2.gz ICPUDTAYTUBDLO-NSHDSACASA-N 1 2 312.310 4.433 20 0 DIADLO CCC[N@H+](Cc1noc(C2CCC2)n1)[C@@H]1CCc2ccccc21 ZINC000625113645 1057089870 /nfs/dbraw/zinc/08/98/70/1057089870.db2.gz PFJBPMMZTGNBGP-QGZVFWFLSA-N 1 2 311.429 4.237 20 0 DIADLO CCC[N@@H+](Cc1noc(C2CCC2)n1)[C@@H]1CCc2ccccc21 ZINC000625113645 1057089877 /nfs/dbraw/zinc/08/98/77/1057089877.db2.gz PFJBPMMZTGNBGP-QGZVFWFLSA-N 1 2 311.429 4.237 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1coc(-c2ccccc2F)n1 ZINC000625129490 1057091663 /nfs/dbraw/zinc/09/16/63/1057091663.db2.gz IPEFVDZWGVTPRB-UHFFFAOYSA-N 1 2 316.298 4.255 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1coc(-c2ccccc2F)n1 ZINC000625129490 1057091667 /nfs/dbraw/zinc/09/16/67/1057091667.db2.gz IPEFVDZWGVTPRB-UHFFFAOYSA-N 1 2 316.298 4.255 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1)[N@H+](C)Cc1noc(C2CCC2)n1 ZINC000625176195 1057095564 /nfs/dbraw/zinc/09/55/64/1057095564.db2.gz GWBCEOPTERWXPQ-LBPRGKRZSA-N 1 2 319.836 4.054 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1noc(C2CCC2)n1 ZINC000625176195 1057095573 /nfs/dbraw/zinc/09/55/73/1057095573.db2.gz GWBCEOPTERWXPQ-LBPRGKRZSA-N 1 2 319.836 4.054 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2noc(C3CCC3)n2)c1C ZINC000625185607 1057099180 /nfs/dbraw/zinc/09/91/80/1057099180.db2.gz SJVWLCHDUVKMTF-QGZVFWFLSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2noc(C3CCC3)n2)c1C ZINC000625185607 1057099185 /nfs/dbraw/zinc/09/91/85/1057099185.db2.gz SJVWLCHDUVKMTF-QGZVFWFLSA-N 1 2 311.429 4.291 20 0 DIADLO c1ccc([C@@H]([NH2+]Cc2noc(C3CCC3)n2)C2CCCC2)cc1 ZINC000625251110 1057108134 /nfs/dbraw/zinc/10/81/34/1057108134.db2.gz CDVSCMNNMKMXTP-GOSISDBHSA-N 1 2 311.429 4.358 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1noc2c1CCCC2 ZINC000673692218 1057112474 /nfs/dbraw/zinc/11/24/74/1057112474.db2.gz YAONZMJCSAQFPV-UHFFFAOYSA-N 1 2 304.821 4.059 20 0 DIADLO Fc1ccccc1-c1nc(C[N@@H+]2CCC[C@@H]2c2cccnc2)co1 ZINC000625271308 1057112680 /nfs/dbraw/zinc/11/26/80/1057112680.db2.gz LZXTWVNGSPUPLF-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccccc1-c1nc(C[N@H+]2CCC[C@@H]2c2cccnc2)co1 ZINC000625271308 1057112684 /nfs/dbraw/zinc/11/26/84/1057112684.db2.gz LZXTWVNGSPUPLF-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO COCCC[C@H](Nc1ccc([NH+](C)C)cc1)c1ccc(F)cc1 ZINC000282445948 1057133718 /nfs/dbraw/zinc/13/37/18/1057133718.db2.gz UUMPYPGLEWTKMJ-IBGZPJMESA-N 1 2 316.420 4.472 20 0 DIADLO COc1cc(F)c(-c2c[nH+]c(N3CCCCC3)cc2C)c(F)c1 ZINC001241693329 1057140093 /nfs/dbraw/zinc/14/00/93/1057140093.db2.gz QWYDXLWKUDUIGQ-UHFFFAOYSA-N 1 2 318.367 4.334 20 0 DIADLO CCCC[N@H+](Cc1nc([C@@H](C)OC)no1)[C@@H](C)c1ccc(C)o1 ZINC000673856971 1057143947 /nfs/dbraw/zinc/14/39/47/1057143947.db2.gz ZBIHXEAVTSENQL-UONOGXRCSA-N 1 2 321.421 4.042 20 0 DIADLO CCCC[N@@H+](Cc1nc([C@@H](C)OC)no1)[C@@H](C)c1ccc(C)o1 ZINC000673856971 1057143950 /nfs/dbraw/zinc/14/39/50/1057143950.db2.gz ZBIHXEAVTSENQL-UONOGXRCSA-N 1 2 321.421 4.042 20 0 DIADLO Cc1cscc1-c1cc(F)cc(C)c1C[NH+]1CCOCC1 ZINC001241731318 1057149512 /nfs/dbraw/zinc/14/95/12/1057149512.db2.gz XVFNCYZXOLWXEP-UHFFFAOYSA-N 1 2 305.418 4.003 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2nc3cc(C)ccc3s2)CC1 ZINC000625506428 1057152388 /nfs/dbraw/zinc/15/23/88/1057152388.db2.gz NJQDLCIZXAVDOB-UHFFFAOYSA-N 1 2 324.449 4.392 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc(C(F)F)nc1 ZINC000657955084 1057157302 /nfs/dbraw/zinc/15/73/02/1057157302.db2.gz YQILOLCSTJLNFG-LBPRGKRZSA-N 1 2 318.371 4.188 20 0 DIADLO Fc1cccc([C@@H]2CC[N@H+]2Cc2ccccc2OC(F)F)c1 ZINC000674011831 1057177693 /nfs/dbraw/zinc/17/76/93/1057177693.db2.gz YAHCNPLODSTWKK-HNNXBMFYSA-N 1 2 307.315 4.374 20 0 DIADLO Fc1cccc([C@@H]2CC[N@@H+]2Cc2ccccc2OC(F)F)c1 ZINC000674011831 1057177696 /nfs/dbraw/zinc/17/76/96/1057177696.db2.gz YAHCNPLODSTWKK-HNNXBMFYSA-N 1 2 307.315 4.374 20 0 DIADLO c1cc2c[nH+]c(-c3cccnc3OCc3ccccc3)cc2[nH]1 ZINC001241826396 1057178285 /nfs/dbraw/zinc/17/82/85/1057178285.db2.gz BJOMWKSJDVTROB-UHFFFAOYSA-N 1 2 301.349 4.204 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cccnc1OCc1ccccc1 ZINC001241829767 1057180205 /nfs/dbraw/zinc/18/02/05/1057180205.db2.gz FTLLYILJKZBKJT-UHFFFAOYSA-N 1 2 319.408 4.097 20 0 DIADLO CCOc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)c(Cl)c1 ZINC001241848761 1057190680 /nfs/dbraw/zinc/19/06/80/1057190680.db2.gz NHSPILLYQAHAFA-UHFFFAOYSA-N 1 2 313.788 4.046 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1ccc(F)c2ccccc21 ZINC001241902396 1057205334 /nfs/dbraw/zinc/20/53/34/1057205334.db2.gz VNOGNYSNZPZFBH-UHFFFAOYSA-N 1 2 322.383 4.186 20 0 DIADLO COc1cc(Cl)ccc1-c1ccc(-n2cc[nH+]c2)cc1OC ZINC001241905774 1057207322 /nfs/dbraw/zinc/20/73/22/1057207322.db2.gz BUJZJNKHLOPZOI-UHFFFAOYSA-N 1 2 314.772 4.210 20 0 DIADLO Cc1nnc(-c2cccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)c2)o1 ZINC001241936799 1057218279 /nfs/dbraw/zinc/21/82/79/1057218279.db2.gz JPTMBQMUAQYKHB-UHFFFAOYSA-N 1 2 302.337 4.102 20 0 DIADLO CCOC(=O)c1cc2c(-c3cc(C)[nH+]c(C)c3)[nH]c(C)c(C)c-2n1 ZINC001241990175 1057231710 /nfs/dbraw/zinc/23/17/10/1057231710.db2.gz KFVASAXKFFTTLN-UHFFFAOYSA-N 1 2 323.396 4.035 20 0 DIADLO COC(=O)c1cc(-c2cc(C)[nH+]c(C)c2)ccc1C(F)(F)F ZINC001241992580 1057232718 /nfs/dbraw/zinc/23/27/18/1057232718.db2.gz OFTBVNNDKCKTOJ-UHFFFAOYSA-N 1 2 309.287 4.171 20 0 DIADLO CCOC(=O)c1cnc2ccc(-c3cc(C)[nH+]c(C)c3)cc2c1 ZINC001241992985 1057232939 /nfs/dbraw/zinc/23/29/39/1057232939.db2.gz BEWDCXFHSMDDAD-UHFFFAOYSA-N 1 2 306.365 4.090 20 0 DIADLO Cc1cc(-c2ccnc(OCc3cccc(F)c3)c2)cc(C)[nH+]1 ZINC001241995700 1057233260 /nfs/dbraw/zinc/23/32/60/1057233260.db2.gz QUCHUXJNLHALRV-UHFFFAOYSA-N 1 2 308.356 4.479 20 0 DIADLO CSc1ccc(F)cc1-c1ccccc1C[NH+]1CCOCC1 ZINC001241993995 1057233591 /nfs/dbraw/zinc/23/35/91/1057233591.db2.gz FAHCQCXDZQQBRN-UHFFFAOYSA-N 1 2 317.429 4.047 20 0 DIADLO COc1cccc([C@@H](C)[NH2+]Cc2c(F)c(F)cc(F)c2F)c1 ZINC000674376315 1057236398 /nfs/dbraw/zinc/23/63/98/1057236398.db2.gz SCPLVTMOHZAWSR-SECBINFHSA-N 1 2 313.294 4.102 20 0 DIADLO COc1cccc2[nH]c(-c3ccc(F)c(-n4cc[nH+]c4)c3)cc21 ZINC001242002215 1057237216 /nfs/dbraw/zinc/23/72/16/1057237216.db2.gz XYIZVBMCWPTEKD-UHFFFAOYSA-N 1 2 307.328 4.168 20 0 DIADLO C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+]1Cc2ccc(O)cc2C1 ZINC000625727361 1057243286 /nfs/dbraw/zinc/24/32/86/1057243286.db2.gz XOPVJSPWFAIARY-NSHDSACASA-N 1 2 305.324 4.070 20 0 DIADLO C[C@@H](c1ccc(OC(F)F)cc1)[N@H+]1Cc2ccc(O)cc2C1 ZINC000625727361 1057243291 /nfs/dbraw/zinc/24/32/91/1057243291.db2.gz XOPVJSPWFAIARY-NSHDSACASA-N 1 2 305.324 4.070 20 0 DIADLO CCSc1cccc(NC(=O)c2cccc(-n3cc[nH+]c3)c2)c1 ZINC000172078952 1057246666 /nfs/dbraw/zinc/24/66/66/1057246666.db2.gz ZNSZBTGAARPJTE-UHFFFAOYSA-N 1 2 323.421 4.237 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1ncnc2scc(-c3cccs3)c21 ZINC001242070914 1057255254 /nfs/dbraw/zinc/25/52/54/1057255254.db2.gz PLWNPWWGGOCFTM-UHFFFAOYSA-N 1 2 324.434 4.372 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1nnc(-c2ccccc2)c2ccccc21 ZINC001242078184 1057255832 /nfs/dbraw/zinc/25/58/32/1057255832.db2.gz DXPCFCRPJZEZIU-UHFFFAOYSA-N 1 2 312.376 4.249 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cnn(Cc3cccs3)c2)c1 ZINC001242094241 1057262058 /nfs/dbraw/zinc/26/20/58/1057262058.db2.gz PVHHGPONQJURPR-UHFFFAOYSA-N 1 2 320.421 4.060 20 0 DIADLO Cc1cc(C(F)(F)F)ccc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001242129046 1057271891 /nfs/dbraw/zinc/27/18/91/1057271891.db2.gz FBXXVVRSYFGFBL-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H]2CCOc3ccccc32)c2ccccn21 ZINC000674866783 1057292797 /nfs/dbraw/zinc/29/27/97/1057292797.db2.gz OUZMNKLKJNRBIR-INIZCTEOSA-N 1 2 321.424 4.071 20 0 DIADLO CC(C)(C)OCCC[N@@H+]1CCc2[nH]c3ccc(Cl)cc3c2C1 ZINC000674907442 1057299209 /nfs/dbraw/zinc/29/92/09/1057299209.db2.gz UGZWUQVUOVXVRL-UHFFFAOYSA-N 1 2 320.864 4.385 20 0 DIADLO CC(C)(C)OCCC[N@H+]1CCc2[nH]c3ccc(Cl)cc3c2C1 ZINC000674907442 1057299215 /nfs/dbraw/zinc/29/92/15/1057299215.db2.gz UGZWUQVUOVXVRL-UHFFFAOYSA-N 1 2 320.864 4.385 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1cccnc1Cl ZINC000766108530 1057345990 /nfs/dbraw/zinc/34/59/90/1057345990.db2.gz PZWPOOQAAPGNCX-UHFFFAOYSA-N 1 2 321.211 4.370 20 0 DIADLO CCc1nc(C2([NH2+]Cc3c(C)cc(C)cc3C)CCCC2)no1 ZINC000174237148 1057354374 /nfs/dbraw/zinc/35/43/74/1057354374.db2.gz MOKYYCIXPUEXER-UHFFFAOYSA-N 1 2 313.445 4.116 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2cccc(O)c2F)cc[nH+]1 ZINC001212545307 1057355360 /nfs/dbraw/zinc/35/53/60/1057355360.db2.gz AWYSWUCEOAQTCL-UHFFFAOYSA-N 1 2 319.336 4.017 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2noc3c2CCCC3)[C@H](c2ccco2)C1 ZINC000174511996 1057364410 /nfs/dbraw/zinc/36/44/10/1057364410.db2.gz JPHUPXKRFHUZEM-CJNGLKHVSA-N 1 2 300.402 4.120 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2noc3c2CCCC3)[C@H](c2ccco2)C1 ZINC000174511996 1057364417 /nfs/dbraw/zinc/36/44/17/1057364417.db2.gz JPHUPXKRFHUZEM-CJNGLKHVSA-N 1 2 300.402 4.120 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(OC(F)F)cc2)cc1 ZINC001242441610 1057369032 /nfs/dbraw/zinc/36/90/32/1057369032.db2.gz FJXWBOJSYAPLKB-UHFFFAOYSA-N 1 2 300.308 4.356 20 0 DIADLO c1cn2cc(-c3ccc4c(cnn4[C@@H]4CCCCO4)c3)ccc2[nH+]1 ZINC001242447479 1057371436 /nfs/dbraw/zinc/37/14/36/1057371436.db2.gz PKXWHXURTYFSFG-IBGZPJMESA-N 1 2 318.380 4.050 20 0 DIADLO c1cn2cccc(-c3ccc4c(cnn4[C@H]4CCCCO4)c3)c2[nH+]1 ZINC001242447503 1057371500 /nfs/dbraw/zinc/37/15/00/1057371500.db2.gz PLCUQQYOUDTUNO-GOSISDBHSA-N 1 2 318.380 4.050 20 0 DIADLO Cc1cc[nH+]c(C)c1-c1ccc2c(cnn2[C@H]2CCCCO2)c1 ZINC001242449363 1057372395 /nfs/dbraw/zinc/37/23/95/1057372395.db2.gz OVZIIZURLSWNBX-GOSISDBHSA-N 1 2 307.397 4.414 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](CN2CCCCC2)c2ccccc2)o1 ZINC000675473031 1057379321 /nfs/dbraw/zinc/37/93/21/1057379321.db2.gz MTWMBSCQXWSFPO-FQEVSTJZSA-N 1 2 312.457 4.159 20 0 DIADLO Cn1ccnc1-c1ccc(-c2ccc(-c3c[nH+]cn3C)cc2)cc1 ZINC001242496144 1057385274 /nfs/dbraw/zinc/38/52/74/1057385274.db2.gz ALZWJOYOIREGRS-UHFFFAOYSA-N 1 2 314.392 4.155 20 0 DIADLO Fc1ccc(C[NH2+]Cc2c(Cl)ccc(Cl)c2Cl)nc1 ZINC000675646141 1057392587 /nfs/dbraw/zinc/39/25/87/1057392587.db2.gz XBOCNTDVNFWXKJ-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO CCOc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1nc(C)cs1)CCO2 ZINC000675810279 1057417552 /nfs/dbraw/zinc/41/75/52/1057417552.db2.gz QKEXVFQFODXBIZ-DOMZBBRYSA-N 1 2 318.442 4.025 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccccc2OCC2CC2)c(C)s1 ZINC000676492936 1057477390 /nfs/dbraw/zinc/47/73/90/1057477390.db2.gz QOWCYTRZFLPBTA-GFCCVEGCSA-N 1 2 316.470 4.400 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccccc2OC2CC2)cc1F ZINC001242794040 1057478329 /nfs/dbraw/zinc/47/83/29/1057478329.db2.gz ADKJDHBQURIZBL-UHFFFAOYSA-N 1 2 303.352 4.235 20 0 DIADLO Cc1cc(NC(=O)c2cc3c(cccc3Cl)s2)c(C)c[nH+]1 ZINC000676588333 1057486920 /nfs/dbraw/zinc/48/69/20/1057486920.db2.gz WNJNFXOLLPTZOR-UHFFFAOYSA-N 1 2 316.813 4.241 20 0 DIADLO C[N@@H+]1CCc2ccc(-c3cc(Cl)c(O)c(Cl)c3)cc2C1 ZINC001242854333 1057500192 /nfs/dbraw/zinc/50/01/92/1057500192.db2.gz BNSIAHASTWTANC-UHFFFAOYSA-N 1 2 308.208 4.354 20 0 DIADLO C[N@H+]1CCc2ccc(-c3cc(Cl)c(O)c(Cl)c3)cc2C1 ZINC001242854333 1057500196 /nfs/dbraw/zinc/50/01/96/1057500196.db2.gz BNSIAHASTWTANC-UHFFFAOYSA-N 1 2 308.208 4.354 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cn(C)cn1)c1cc(Cl)cc(Cl)c1F ZINC000710070021 1057502044 /nfs/dbraw/zinc/50/20/44/1057502044.db2.gz FBQLLVXCWPFPAA-BDAKNGLRSA-N 1 2 316.207 4.278 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)c1cn(C)cn1 ZINC000710178936 1057502172 /nfs/dbraw/zinc/50/21/72/1057502172.db2.gz UNAINHIMBBNQOZ-DTWKUNHWSA-N 1 2 316.207 4.278 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccccc1N1CCCCC1 ZINC001242876256 1057510342 /nfs/dbraw/zinc/51/03/42/1057510342.db2.gz RDVDHNVQKHHVNH-UHFFFAOYSA-N 1 2 307.397 4.000 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccccc1N1CCCCC1 ZINC001242876299 1057510381 /nfs/dbraw/zinc/51/03/81/1057510381.db2.gz NYVOLHGUJRWJPD-UHFFFAOYSA-N 1 2 307.397 4.229 20 0 DIADLO CC(C)(C)OCc1cccc(NCc2cccc3[nH+]ccn32)c1 ZINC000922915911 1057511751 /nfs/dbraw/zinc/51/17/51/1057511751.db2.gz XDUYDRBWFZDMNO-UHFFFAOYSA-N 1 2 309.413 4.262 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2cc(Cl)cc3c2OCC3)s1 ZINC000922986008 1057520101 /nfs/dbraw/zinc/52/01/01/1057520101.db2.gz QMIIIWZPAWRSPU-JTQLQIEISA-N 1 2 322.861 4.145 20 0 DIADLO CSc1ccccc1-c1cc(C[NH+]2CCOCC2)ccc1F ZINC001242945543 1057525786 /nfs/dbraw/zinc/52/57/86/1057525786.db2.gz BFLHLAUOGUMMTK-UHFFFAOYSA-N 1 2 317.429 4.047 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)o1 ZINC000626007596 1057548747 /nfs/dbraw/zinc/54/87/47/1057548747.db2.gz MQOWEUOOOXFXLO-LLVKDONJSA-N 1 2 310.319 4.121 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+]2CCc3cc(C(F)(F)F)ccc3C2)o1 ZINC000626007596 1057548750 /nfs/dbraw/zinc/54/87/50/1057548750.db2.gz MQOWEUOOOXFXLO-LLVKDONJSA-N 1 2 310.319 4.121 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1cnc3ccc(C)cc3c1)C2 ZINC000626023304 1057549540 /nfs/dbraw/zinc/54/95/40/1057549540.db2.gz DDQAEHSDSIBNDO-UHFFFAOYSA-N 1 2 304.393 4.068 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1cnc3ccc(C)cc3c1)C2 ZINC000626023304 1057549547 /nfs/dbraw/zinc/54/95/47/1057549547.db2.gz DDQAEHSDSIBNDO-UHFFFAOYSA-N 1 2 304.393 4.068 20 0 DIADLO Cc1cn2c(cccc2-c2ccc(C(F)(F)F)nc2Cl)[nH+]1 ZINC001243035914 1057553578 /nfs/dbraw/zinc/55/35/78/1057553578.db2.gz VECPEAGKSDBXNM-UHFFFAOYSA-N 1 2 311.694 4.377 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1ccc(C(F)(F)F)nc1Cl ZINC001243036257 1057553622 /nfs/dbraw/zinc/55/36/22/1057553622.db2.gz DEGVSUGRJCVWQE-UHFFFAOYSA-N 1 2 311.694 4.377 20 0 DIADLO Cc1cc(-c2ccc(C(F)(F)F)nc2Cl)cn2cc[nH+]c12 ZINC001243036786 1057553804 /nfs/dbraw/zinc/55/38/04/1057553804.db2.gz UTUIUMIEBDXNKT-UHFFFAOYSA-N 1 2 311.694 4.377 20 0 DIADLO Nc1nc(N2CCC[C@H]2c2ccc(Cl)cc2)[nH+]c2ccccc12 ZINC000535721418 1057556072 /nfs/dbraw/zinc/55/60/72/1057556072.db2.gz CZPUBDMVEOBQOW-INIZCTEOSA-N 1 2 324.815 4.207 20 0 DIADLO Cc1cc(-c2cc(Cl)cc(C(F)(F)F)c2F)c[nH+]c1N ZINC001243067067 1057562729 /nfs/dbraw/zinc/56/27/29/1057562729.db2.gz FBXLYEBGZRTYAV-UHFFFAOYSA-N 1 2 304.674 4.451 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)c(-c2ccc(C3CC3)cc2)c1 ZINC001243088080 1057567102 /nfs/dbraw/zinc/56/71/02/1057567102.db2.gz SHXUTMSAUQVFJP-UHFFFAOYSA-N 1 2 311.400 4.202 20 0 DIADLO Cc1cc(C)c(-c2cc(F)ccc2C[NH+]2CCOCC2)cc1C ZINC001243087975 1057567144 /nfs/dbraw/zinc/56/71/44/1057567144.db2.gz QTHOJXLCTHJUNF-UHFFFAOYSA-N 1 2 313.416 4.250 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(Cl)nc1Cl ZINC001243088565 1057567246 /nfs/dbraw/zinc/56/72/46/1057567246.db2.gz FSSOVMMLBORATH-UHFFFAOYSA-N 1 2 320.179 4.250 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)c(-c2cccc3ccoc32)c1 ZINC001243088042 1057567354 /nfs/dbraw/zinc/56/73/54/1057567354.db2.gz RNWIUFFFHNBIRV-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO CC1=Cc2cccc(-c3cc(F)ccc3C[NH+]3CCOCC3)c2C1 ZINC001243088612 1057567781 /nfs/dbraw/zinc/56/77/81/1057567781.db2.gz WTFKAGREOUNZQR-UHFFFAOYSA-N 1 2 323.411 4.284 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@@H](Cc2ccccc2)c2ccccc2)n1 ZINC000078541090 1057568597 /nfs/dbraw/zinc/56/85/97/1057568597.db2.gz VAHXWDRXCHYMQO-KSSFIOAISA-N 1 2 307.397 4.013 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCCOc3ccccc3)c2c1 ZINC000195581174 1057570097 /nfs/dbraw/zinc/57/00/97/1057570097.db2.gz FXKSAQQLHRDBIH-UHFFFAOYSA-N 1 2 309.365 4.010 20 0 DIADLO c1nc(C2CC2)c(C[NH2+][C@@H](c2ccccc2)c2ccccn2)s1 ZINC000486936504 1057571100 /nfs/dbraw/zinc/57/11/00/1057571100.db2.gz KCNTYOALUOFIJC-SFHVURJKSA-N 1 2 321.449 4.295 20 0 DIADLO CCCCOc1ccc(-c2cn3cc[nH+]c3cc2OC)c(C)c1 ZINC001243100894 1057572748 /nfs/dbraw/zinc/57/27/48/1057572748.db2.gz NCGOLBLQGSOAJX-UHFFFAOYSA-N 1 2 310.397 4.497 20 0 DIADLO C=Cc1cc(F)cc(-c2cc(F)ccc2C[NH+]2CCOCC2)c1 ZINC001243102510 1057573010 /nfs/dbraw/zinc/57/30/10/1057573010.db2.gz FLQOCKMOKQOZGX-UHFFFAOYSA-N 1 2 315.363 4.107 20 0 DIADLO Cc1cc(-c2cc(F)ccc2C[NH+]2CCOCC2)cc2[nH]ccc21 ZINC001243100845 1057573206 /nfs/dbraw/zinc/57/32/06/1057573206.db2.gz GTHYBUQKMZJXSF-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO COc1cc(-c2cc3[nH]c[nH+]c3cc2OC)cc(C(F)(F)F)c1 ZINC001243120357 1057578932 /nfs/dbraw/zinc/57/89/32/1057578932.db2.gz YEWRJSBQTLUPRU-UHFFFAOYSA-N 1 2 322.286 4.266 20 0 DIADLO C/C(=C\C=C\[NH3+])c1cc(F)cc(F)c1OCc1ccccc1 ZINC001243168793 1057592955 /nfs/dbraw/zinc/59/29/55/1057592955.db2.gz GZPIAZVPXMZJCM-PMHYKQBESA-N 1 2 301.336 4.420 20 0 DIADLO CCCOc1ccc(-c2cc3[nH]c[nH+]c3cc2OC)cc1F ZINC001243221580 1057610730 /nfs/dbraw/zinc/61/07/30/1057610730.db2.gz XHIKMKLRPXSJIF-UHFFFAOYSA-N 1 2 300.333 4.166 20 0 DIADLO COCc1ccc(C[NH+](Cc2ccco2)Cc2ccco2)cc1 ZINC000162562013 1057615263 /nfs/dbraw/zinc/61/52/63/1057615263.db2.gz KJERSBPITMVVSI-UHFFFAOYSA-N 1 2 311.381 4.221 20 0 DIADLO CCCCOc1ccc(F)cc1-c1cc(-n2ccnc2)cc[nH+]1 ZINC001243238386 1057617346 /nfs/dbraw/zinc/61/73/46/1057617346.db2.gz HXBIOJUHIWTULS-UHFFFAOYSA-N 1 2 311.360 4.252 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2ncc[nH]2)c(OCCCC(C)C)c1 ZINC000513716685 1057623663 /nfs/dbraw/zinc/62/36/63/1057623663.db2.gz GLHRDNPYEULXHP-INIZCTEOSA-N 1 2 315.461 4.384 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccccc1OCc1ccccc1)c1ncc[nH]1 ZINC000513684457 1057623732 /nfs/dbraw/zinc/62/37/32/1057623732.db2.gz RQTGPXSSLFLDCK-HZPDHXFCSA-N 1 2 321.424 4.401 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccccc2OC(F)F)c(C)s1 ZINC000020556273 1057637172 /nfs/dbraw/zinc/63/71/72/1057637172.db2.gz WLFPMCLUZAFYIZ-SECBINFHSA-N 1 2 312.385 4.212 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000727221772 1057641978 /nfs/dbraw/zinc/64/19/78/1057641978.db2.gz IEZZDZPHVAPFMQ-HNNXBMFYSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000727221772 1057641981 /nfs/dbraw/zinc/64/19/81/1057641981.db2.gz IEZZDZPHVAPFMQ-HNNXBMFYSA-N 1 2 324.255 4.372 20 0 DIADLO Fc1ccc(-c2cc(Cl)cc3n[nH]cc32)cc1-n1cc[nH+]c1 ZINC001243322135 1057645803 /nfs/dbraw/zinc/64/58/03/1057645803.db2.gz UTLUBPROINYKEH-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO S=c1oc(Cc2cccs2)nn1C[NH+]1CCCCCCC1 ZINC000727417311 1057652227 /nfs/dbraw/zinc/65/22/27/1057652227.db2.gz HXSBDCSGYRZSFQ-UHFFFAOYSA-N 1 2 323.487 4.081 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(O)c(F)c1F ZINC001243342344 1057653322 /nfs/dbraw/zinc/65/33/22/1057653322.db2.gz LDQFDLYNJVUXBB-UHFFFAOYSA-N 1 2 304.340 4.031 20 0 DIADLO Fc1cccc(-c2cc[nH+]c3c2CCN3)c1OCc1ccccc1 ZINC001243347131 1057654565 /nfs/dbraw/zinc/65/45/65/1057654565.db2.gz BRKALNKWKSHDOZ-UHFFFAOYSA-N 1 2 320.367 4.077 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(C2CC2)n1)c1ccc(OC(F)F)cc1 ZINC000727465757 1057654835 /nfs/dbraw/zinc/65/48/35/1057654835.db2.gz REQXGYJIWAKPPF-SNVBAGLBSA-N 1 2 308.328 4.004 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cccc(OC(F)F)c2)c1 ZINC001243359602 1057658334 /nfs/dbraw/zinc/65/83/34/1057658334.db2.gz LIZUWRSOHFEUFU-UHFFFAOYSA-N 1 2 300.308 4.356 20 0 DIADLO FC(F)(F)COc1cccc(-c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001243392650 1057669332 /nfs/dbraw/zinc/66/93/32/1057669332.db2.gz ZTYKEHWWCJIUCG-UHFFFAOYSA-N 1 2 318.298 4.480 20 0 DIADLO CC[C@H]1CCC[N@@H+]1Cn1nc(-c2ccc(C)cc2)oc1=S ZINC000727825036 1057675703 /nfs/dbraw/zinc/67/57/03/1057675703.db2.gz UPCPPORAOBGFHF-AWEZNQCLSA-N 1 2 303.431 4.013 20 0 DIADLO CC[C@H]1CCC[N@H+]1Cn1nc(-c2ccc(C)cc2)oc1=S ZINC000727825036 1057675708 /nfs/dbraw/zinc/67/57/08/1057675708.db2.gz UPCPPORAOBGFHF-AWEZNQCLSA-N 1 2 303.431 4.013 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccnc(Cl)c2Cl)cc1F ZINC001243417783 1057677371 /nfs/dbraw/zinc/67/73/71/1057677371.db2.gz GJGBGGPBOGJGNQ-UHFFFAOYSA-N 1 2 317.166 4.395 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(C)cc3OC(C)C)nn2)c1C ZINC001243420295 1057678430 /nfs/dbraw/zinc/67/84/30/1057678430.db2.gz ITYHJJPCMOAKMH-UHFFFAOYSA-N 1 2 322.412 4.042 20 0 DIADLO CC(C)COc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)cc1 ZINC001243431232 1057680814 /nfs/dbraw/zinc/68/08/14/1057680814.db2.gz HUEQIQIKCHMAFS-UHFFFAOYSA-N 1 2 307.397 4.028 20 0 DIADLO CC(C)Oc1cc(F)ccc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001243433651 1057682095 /nfs/dbraw/zinc/68/20/95/1057682095.db2.gz RLJDEWOUTKRGCI-UHFFFAOYSA-N 1 2 314.282 4.276 20 0 DIADLO CCCC[N@H+](Cn1c(=O)sc2c1CC[C@H](CCC)C2)C1CC1 ZINC000728042036 1057684852 /nfs/dbraw/zinc/68/48/52/1057684852.db2.gz GCYGSVSMVCDPEG-AWEZNQCLSA-N 1 2 322.518 4.037 20 0 DIADLO CCCC[N@@H+](Cn1c(=O)sc2c1CC[C@H](CCC)C2)C1CC1 ZINC000728042036 1057684854 /nfs/dbraw/zinc/68/48/54/1057684854.db2.gz GCYGSVSMVCDPEG-AWEZNQCLSA-N 1 2 322.518 4.037 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2nccn2CC(F)(F)F)C1 ZINC000285535352 1057686094 /nfs/dbraw/zinc/68/60/94/1057686094.db2.gz FPXPXCZRFQIEEI-UKRRQHHQSA-N 1 2 323.362 4.029 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](Cc2nccn2CC(F)(F)F)C1 ZINC000285535352 1057686098 /nfs/dbraw/zinc/68/60/98/1057686098.db2.gz FPXPXCZRFQIEEI-UKRRQHHQSA-N 1 2 323.362 4.029 20 0 DIADLO COc1cccc(OC)c1-c1ccc(-c2ccc[nH+]c2N)cc1 ZINC001243477336 1057691426 /nfs/dbraw/zinc/69/14/26/1057691426.db2.gz KSBSUGCTHLAKNM-UHFFFAOYSA-N 1 2 306.365 4.015 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cc(F)c(OC(F)F)c(F)c1 ZINC001243493152 1057695633 /nfs/dbraw/zinc/69/56/33/1057695633.db2.gz VIKNPMDDDJJDOD-UHFFFAOYSA-N 1 2 310.250 4.189 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2cc(F)cc(F)c2O)nc1 ZINC001243501103 1057696131 /nfs/dbraw/zinc/69/61/31/1057696131.db2.gz CXUQVOXXDCLTSM-GFCCVEGCSA-N 1 2 318.367 4.107 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1ccc(-c2cc(F)cc(F)c2O)nc1 ZINC001243501103 1057696133 /nfs/dbraw/zinc/69/61/33/1057696133.db2.gz CXUQVOXXDCLTSM-GFCCVEGCSA-N 1 2 318.367 4.107 20 0 DIADLO CCOc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)ccc1OC ZINC001243544469 1057709323 /nfs/dbraw/zinc/70/93/23/1057709323.db2.gz WHYCGYXEHJXOND-UHFFFAOYSA-N 1 2 308.381 4.006 20 0 DIADLO CCOc1ccc(Cl)c(-c2cc(N)c(C(F)(F)F)c[nH+]2)c1 ZINC001243564384 1057714823 /nfs/dbraw/zinc/71/48/23/1057714823.db2.gz CZPHAXVLAFKIAZ-UHFFFAOYSA-N 1 2 316.710 4.402 20 0 DIADLO CCOc1cc(-c2cc3[nH]c[nH+]c3cc2OC)ccc1Cl ZINC001243570958 1057718070 /nfs/dbraw/zinc/71/80/70/1057718070.db2.gz HBDLXKFFCQJFDM-UHFFFAOYSA-N 1 2 302.761 4.291 20 0 DIADLO NC(Cc1cccs1)=[NH+]OCc1ccc(C(F)(F)F)cc1 ZINC000731028975 1057732620 /nfs/dbraw/zinc/73/26/20/1057732620.db2.gz LSCKEJDFKWMHTR-UHFFFAOYSA-N 1 2 314.332 4.008 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)CC(=O)OCc2ccccc2)c(C)c1 ZINC000731031107 1057733450 /nfs/dbraw/zinc/73/34/50/1057733450.db2.gz QESXBYTYZICLDM-KRWDZBQOSA-N 1 2 311.425 4.040 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)CC(=O)OCc2ccccc2)c(C)c1 ZINC000731031107 1057733453 /nfs/dbraw/zinc/73/34/53/1057733453.db2.gz QESXBYTYZICLDM-KRWDZBQOSA-N 1 2 311.425 4.040 20 0 DIADLO Oc1cc(C(F)(F)F)ccc1-c1ccccc1Cn1cc[nH+]c1 ZINC001243612089 1057733588 /nfs/dbraw/zinc/73/35/88/1057733588.db2.gz RGZGCTAOTFHBPD-UHFFFAOYSA-N 1 2 318.298 4.323 20 0 DIADLO Cc1nc(C(F)(F)F)ccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243656878 1057745376 /nfs/dbraw/zinc/74/53/76/1057745376.db2.gz HAKIMRPRBZRHMC-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO Fc1ccc2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)nc2c1 ZINC001243657240 1057745393 /nfs/dbraw/zinc/74/53/93/1057745393.db2.gz SUBYENGUWRDHIU-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO COC(=O)c1cc(C)c(-c2ccc(Cn3cc[nH+]c3)cc2)c(C)c1 ZINC001243658063 1057746062 /nfs/dbraw/zinc/74/60/62/1057746062.db2.gz BQSROZQMWOSIAT-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO c1cn(Cc2ccc(-c3ccc4[nH]c(C5CC5)cc4n3)cc2)c[nH+]1 ZINC001243658285 1057746214 /nfs/dbraw/zinc/74/62/14/1057746214.db2.gz VJOXFDRLWFXOEA-UHFFFAOYSA-N 1 2 314.392 4.352 20 0 DIADLO Fc1ccc2cc(-c3ccc(Cn4cc[nH+]c4)cc3)cnc2c1 ZINC001243658769 1057746615 /nfs/dbraw/zinc/74/66/15/1057746615.db2.gz KFLXKCDWIXVDGS-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO COC(=O)c1c(C)cc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1C ZINC001243658529 1057746685 /nfs/dbraw/zinc/74/66/85/1057746685.db2.gz SHRQVPNNDRKMDL-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO COC(=O)c1cc(-c2ccc(Cn3cc[nH+]c3)cc2)c(C)cc1C ZINC001243659463 1057747076 /nfs/dbraw/zinc/74/70/76/1057747076.db2.gz UWOAZOJGKGVEGA-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO CC(C)Sc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cn1 ZINC001243661954 1057747997 /nfs/dbraw/zinc/74/79/97/1057747997.db2.gz HBQRTLDDKDIEML-UHFFFAOYSA-N 1 2 309.438 4.494 20 0 DIADLO COC(=O)c1ccc(C)c(-c2ccc(Cn3cc[nH+]c3)cc2)c1C ZINC001243662374 1057748114 /nfs/dbraw/zinc/74/81/14/1057748114.db2.gz NRRCTYJWINRHEI-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO Fc1ccc2c(cncc2-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243661964 1057748129 /nfs/dbraw/zinc/74/81/29/1057748129.db2.gz HOOUTRZZPXBWLV-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO Cc1nc(OC(C)C)ccc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001243663161 1057748571 /nfs/dbraw/zinc/74/85/71/1057748571.db2.gz RVKWXBYPOXUBIE-UHFFFAOYSA-N 1 2 320.383 4.184 20 0 DIADLO Clc1ccc(-c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)cc1 ZINC000731787565 1057753306 /nfs/dbraw/zinc/75/33/06/1057753306.db2.gz WILYOBALVGFGAV-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO Cc1ccc(-c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)cc1F ZINC000731791894 1057753863 /nfs/dbraw/zinc/75/38/63/1057753863.db2.gz BJIZIOMOGBRRIT-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CC(=O)OCc1cccc(C)c1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001243719156 1057761008 /nfs/dbraw/zinc/76/10/08/1057761008.db2.gz ANJIAZHMPVSGKN-UHFFFAOYSA-N 1 2 320.392 4.126 20 0 DIADLO C/C(=C\C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1cccc(F)c1 ZINC000731966020 1057762324 /nfs/dbraw/zinc/76/23/24/1057762324.db2.gz GATIAEATCGCLPU-SDNWHVSQSA-N 1 2 321.355 4.053 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ncoc3C(C)C)c2)[nH+]c1C ZINC000732063248 1057766936 /nfs/dbraw/zinc/76/69/36/1057766936.db2.gz ZRDFNOQZXGTTSZ-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO CC[C@@H](C)C[N@H+](C)Cn1nc(-c2ccccc2)sc1=S ZINC000732182783 1057769554 /nfs/dbraw/zinc/76/95/54/1057769554.db2.gz IKQFXVKFFLXPJY-GFCCVEGCSA-N 1 2 307.488 4.276 20 0 DIADLO CC[C@@H](C)C[N@@H+](C)Cn1nc(-c2ccccc2)sc1=S ZINC000732182783 1057769557 /nfs/dbraw/zinc/76/95/57/1057769557.db2.gz IKQFXVKFFLXPJY-GFCCVEGCSA-N 1 2 307.488 4.276 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2cc3cccc(OC)c3o2)cs1 ZINC000732232695 1057771750 /nfs/dbraw/zinc/77/17/50/1057771750.db2.gz SALKYMUHWJBSFO-LLVKDONJSA-N 1 2 316.426 4.311 20 0 DIADLO Cn1ccc2c1cc[nH+]c2-c1ccc(Br)cc1F ZINC001243791317 1057780206 /nfs/dbraw/zinc/78/02/06/1057780206.db2.gz FMGYNIROHWWKIG-UHFFFAOYSA-N 1 2 305.150 4.142 20 0 DIADLO Cc1nc(OCC(C)C)ccc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001243799738 1057781996 /nfs/dbraw/zinc/78/19/96/1057781996.db2.gz ZIZHSMMNFYVMAU-UHFFFAOYSA-N 1 2 307.397 4.278 20 0 DIADLO Fc1cc(Br)ccc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001243802564 1057783220 /nfs/dbraw/zinc/78/32/20/1057783220.db2.gz MQSWFHCNYUWXFF-UHFFFAOYSA-N 1 2 317.161 4.441 20 0 DIADLO Cc1cn2cc(-c3ccc(Br)cc3F)ccc2[nH+]1 ZINC001243805760 1057783833 /nfs/dbraw/zinc/78/38/33/1057783833.db2.gz PDYANCZSZGWHBT-UHFFFAOYSA-N 1 2 305.150 4.211 20 0 DIADLO COc1ccc(-c2cc(C)cn3cc[nH+]c23)c(OC(F)(F)F)c1 ZINC001243813282 1057785763 /nfs/dbraw/zinc/78/57/63/1057785763.db2.gz IPUDNHANUNAXDH-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO COc1ccc(-c2ccc3[nH+]ccn3c2C)c(OC(F)(F)F)c1 ZINC001243829909 1057789733 /nfs/dbraw/zinc/78/97/33/1057789733.db2.gz XOJMGELVMVJEBD-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO CC1(C)CCC[N@H+](Cn2c(=S)snc2-c2ccccc2)C1 ZINC000732979699 1057794736 /nfs/dbraw/zinc/79/47/36/1057794736.db2.gz ILXPNZYMWRQVRZ-UHFFFAOYSA-N 1 2 319.499 4.421 20 0 DIADLO CC1(C)CCC[N@@H+](Cn2c(=S)snc2-c2ccccc2)C1 ZINC000732979699 1057794741 /nfs/dbraw/zinc/79/47/41/1057794741.db2.gz ILXPNZYMWRQVRZ-UHFFFAOYSA-N 1 2 319.499 4.421 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc(C2CC2)cnc1F ZINC001243860073 1057795080 /nfs/dbraw/zinc/79/50/80/1057795080.db2.gz JCUXYVABODLXNN-UHFFFAOYSA-N 1 2 311.404 4.459 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2nc3ccccc3o2)cc1F ZINC000732989511 1057795920 /nfs/dbraw/zinc/79/59/20/1057795920.db2.gz RLUFCDNXTZPXKM-INIZCTEOSA-N 1 2 314.335 4.443 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2nc3ccccc3o2)cc1F ZINC000732989511 1057795923 /nfs/dbraw/zinc/79/59/23/1057795923.db2.gz RLUFCDNXTZPXKM-INIZCTEOSA-N 1 2 314.335 4.443 20 0 DIADLO CC1(C)CCc2cc(-c3ccc(Cn4cc[nH+]c4)cn3)ccc2O1 ZINC001243913314 1057804520 /nfs/dbraw/zinc/80/45/20/1057804520.db2.gz OGBQSGBEXDXSBH-UHFFFAOYSA-N 1 2 319.408 4.097 20 0 DIADLO Fc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)cc(C(F)(F)F)n1 ZINC001243913086 1057804540 /nfs/dbraw/zinc/80/45/40/1057804540.db2.gz XUUWHNKXDTUEED-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO Cc1cc(-c2ccc(OC(F)(F)F)c(F)c2)c2[nH+]ccn2c1 ZINC001243923050 1057809080 /nfs/dbraw/zinc/80/90/80/1057809080.db2.gz COPCZIFTMKPUCQ-UHFFFAOYSA-N 1 2 310.250 4.347 20 0 DIADLO CC[C@H]([NH2+]Cc1csc(C2CC2)n1)c1ccccc1OC ZINC000733324334 1057812592 /nfs/dbraw/zinc/81/25/92/1057812592.db2.gz PYBQNZYFZIFBNM-HNNXBMFYSA-N 1 2 302.443 4.270 20 0 DIADLO CC[C@@H]([NH2+]Cc1csc(C2CC2)n1)c1ccccc1OC ZINC000733324335 1057812996 /nfs/dbraw/zinc/81/29/96/1057812996.db2.gz PYBQNZYFZIFBNM-OAHLLOKOSA-N 1 2 302.443 4.270 20 0 DIADLO CC(C)C(=O)Nc1cccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001243975874 1057826369 /nfs/dbraw/zinc/82/63/69/1057826369.db2.gz DXSOIKIKUPNXJD-UHFFFAOYSA-N 1 2 305.381 4.338 20 0 DIADLO COc1nccc2cc(-c3ccc(-c4[nH]cc[nH+]4)cc3)ccc21 ZINC001243977404 1057827110 /nfs/dbraw/zinc/82/71/10/1057827110.db2.gz FORZUAWFCZZJDI-UHFFFAOYSA-N 1 2 301.349 4.301 20 0 DIADLO COc1ccc2cc(-c3ccc(-c4[nH]cc[nH+]4)cc3)ccc2n1 ZINC001243977526 1057827384 /nfs/dbraw/zinc/82/73/84/1057827384.db2.gz KYLHZNNANGIFMI-UHFFFAOYSA-N 1 2 301.349 4.301 20 0 DIADLO COC(=O)c1cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c(C)cc1C ZINC001243977674 1057827521 /nfs/dbraw/zinc/82/75/21/1057827521.db2.gz QZBXGVTZFWSBQE-UHFFFAOYSA-N 1 2 306.365 4.147 20 0 DIADLO CC[S@@](=N)(=O)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001243979470 1057828189 /nfs/dbraw/zinc/82/81/89/1057828189.db2.gz QZZIVDJOASEPDS-JOCHJYFZSA-N 1 2 311.410 4.169 20 0 DIADLO CC1(C)Cc2cc(-c3ccc(-c4[nH]cc[nH+]4)cc3)ccc2NC1=O ZINC001243982972 1057828570 /nfs/dbraw/zinc/82/85/70/1057828570.db2.gz WDZONZKTDUTKLO-UHFFFAOYSA-N 1 2 317.392 4.265 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2c(c1)CCCC2=O ZINC001243993815 1057831931 /nfs/dbraw/zinc/83/19/31/1057831931.db2.gz WKJKFIHXZSDWJU-UHFFFAOYSA-N 1 2 318.376 4.067 20 0 DIADLO O=C1CCCc2cc(-c3ccc(F)c(-n4cc[nH+]c4)c3)ccc21 ZINC001243993047 1057832295 /nfs/dbraw/zinc/83/22/95/1057832295.db2.gz SQUDBFLEXDKKOX-UHFFFAOYSA-N 1 2 306.340 4.197 20 0 DIADLO CCOc1ccc(-c2ccc(-c3c[nH+]cn3C)cc2)c(OC)c1 ZINC001244003353 1057835569 /nfs/dbraw/zinc/83/55/69/1057835569.db2.gz ZZEXDVYMKVKRTF-UHFFFAOYSA-N 1 2 308.381 4.161 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1cc(F)c(OC(C)C)c(F)c1 ZINC001244114431 1057873415 /nfs/dbraw/zinc/87/34/15/1057873415.db2.gz WGODPKJMOMGBSH-UHFFFAOYSA-N 1 2 318.323 4.304 20 0 DIADLO c1cc2c[nH+]c(-c3ccc(COc4ccccc4)cc3)nc2[nH]1 ZINC001244184892 1057894462 /nfs/dbraw/zinc/89/44/62/1057894462.db2.gz SPVKEAJNQIHWLH-UHFFFAOYSA-N 1 2 301.349 4.156 20 0 DIADLO CCCN(CCC)C(=O)c1cccc(-c2cccn3cc[nH+]c23)c1 ZINC001244213242 1057901569 /nfs/dbraw/zinc/90/15/69/1057901569.db2.gz WWPUMFXCCOQLPZ-UHFFFAOYSA-N 1 2 321.424 4.264 20 0 DIADLO CCCN(CCC)C(=O)c1cccc(-c2cc[nH+]c(NC)c2)c1 ZINC001244219547 1057902750 /nfs/dbraw/zinc/90/27/50/1057902750.db2.gz ZTCYVAIDYGZQAD-UHFFFAOYSA-N 1 2 311.429 4.053 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc3[nH]c(=O)ccc3c2)c1 ZINC001244237755 1057905939 /nfs/dbraw/zinc/90/59/39/1057905939.db2.gz LUVRDXXPQVDENZ-UHFFFAOYSA-N 1 2 301.349 4.008 20 0 DIADLO COc1cccc(C2CC2)c1-c1ccccc1Cn1cc[nH+]c1 ZINC001244254895 1057912291 /nfs/dbraw/zinc/91/22/91/1057912291.db2.gz BRDAWQAUUCBPLC-UHFFFAOYSA-N 1 2 304.393 4.484 20 0 DIADLO COc1cccc(C2CC2)c1-c1ccc(-n2cc[nH+]c2)cc1OC ZINC001244257568 1057913677 /nfs/dbraw/zinc/91/36/77/1057913677.db2.gz LTTFKOKYBGBLQN-UHFFFAOYSA-N 1 2 320.392 4.434 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2ccc(N)c(OC(F)(F)F)c2)cc1 ZINC001244267603 1057917508 /nfs/dbraw/zinc/91/75/08/1057917508.db2.gz QSIUTMFRIZNDEA-UHFFFAOYSA-N 1 2 324.302 4.196 20 0 DIADLO COc1cc(F)c(-c2ccc(Cn3cc[nH+]c3)cc2)cc1Cl ZINC001244351855 1057940286 /nfs/dbraw/zinc/94/02/86/1057940286.db2.gz MMXLHDXOAKHIJA-UHFFFAOYSA-N 1 2 316.763 4.400 20 0 DIADLO Nc1ccc(-c2cc[nH+]c(N3CCCCC3)c2)cc1C(F)(F)F ZINC001244352028 1057940366 /nfs/dbraw/zinc/94/03/66/1057940366.db2.gz FHFGZBZYDKCXKU-UHFFFAOYSA-N 1 2 321.346 4.340 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cc(F)cc(C)c3Cl)nn2)c1C ZINC001244354274 1057940985 /nfs/dbraw/zinc/94/09/85/1057940985.db2.gz BTKCZLSGQHIIJV-UHFFFAOYSA-N 1 2 316.767 4.047 20 0 DIADLO Cc1cc(F)cc(-c2ccc(Cn3cc[nH+]c3)cn2)c1Cl ZINC001244354323 1057940992 /nfs/dbraw/zinc/94/09/92/1057940992.db2.gz CNAWRZPSDBCOLX-UHFFFAOYSA-N 1 2 301.752 4.094 20 0 DIADLO Cc1cc(F)cc(-c2ccccc2C[NH+]2CCOCC2)c1Cl ZINC001244355536 1057941380 /nfs/dbraw/zinc/94/13/80/1057941380.db2.gz YRUIDFVIJPSQKO-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO CCCOc1cc(F)ccc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001244357696 1057942719 /nfs/dbraw/zinc/94/27/19/1057942719.db2.gz ZLQLJFYLOYBSBH-UHFFFAOYSA-N 1 2 314.282 4.278 20 0 DIADLO Nc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1C(F)(F)F ZINC001244365089 1057944710 /nfs/dbraw/zinc/94/47/10/1057944710.db2.gz VBWCXVDRWCTHLN-UHFFFAOYSA-N 1 2 317.314 4.199 20 0 DIADLO Cc1ccc(C)c(NC(=O)c2ccc(-c3cc[nH+]c(N)c3)cc2)c1 ZINC001244389652 1057949029 /nfs/dbraw/zinc/94/90/29/1057949029.db2.gz SFLNJKXZOSCHAW-UHFFFAOYSA-N 1 2 317.392 4.200 20 0 DIADLO Oc1c(F)cc(-c2cnccc2C[NH+]2CCCCC2)cc1Cl ZINC001244504321 1057978687 /nfs/dbraw/zinc/97/86/87/1057978687.db2.gz LZOCQHOWNXHVIQ-UHFFFAOYSA-N 1 2 320.795 4.233 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1c(Cl)ccc(O)c1F ZINC001244541501 1057991226 /nfs/dbraw/zinc/99/12/26/1057991226.db2.gz DGURNAFEZZTGPX-UHFFFAOYSA-N 1 2 318.735 4.046 20 0 DIADLO CC(=O)c1cc(-c2c[nH+]c(N3CCCCC3)cc2C)cs1 ZINC001244626938 1058013335 /nfs/dbraw/zinc/01/33/35/1058013335.db2.gz WJQOFWCYOBZSJH-UHFFFAOYSA-N 1 2 300.427 4.311 20 0 DIADLO CC(=O)c1ccc(-c2ccccc2Cn2cc[nH+]c2)c(F)c1F ZINC001244700982 1058030265 /nfs/dbraw/zinc/03/02/65/1058030265.db2.gz IGDONXJHHOVJAA-UHFFFAOYSA-N 1 2 312.319 4.079 20 0 DIADLO CC(=O)c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c(F)c1F ZINC001244704098 1058031583 /nfs/dbraw/zinc/03/15/83/1058031583.db2.gz RXKLYMCLMGXXFX-UHFFFAOYSA-N 1 2 312.319 4.079 20 0 DIADLO Nc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c(C(F)(F)F)c1 ZINC001244756290 1058042259 /nfs/dbraw/zinc/04/22/59/1058042259.db2.gz BRJUVWRLQKZUNU-UHFFFAOYSA-N 1 2 317.314 4.199 20 0 DIADLO Cc1cc(C2=CC[C@@H](OC(=O)c3ccccc3)CC2)c(C)c[nH+]1 ZINC001244806847 1058050895 /nfs/dbraw/zinc/05/08/95/1058050895.db2.gz UFBNQXXAGDBURX-GOSISDBHSA-N 1 2 307.393 4.491 20 0 DIADLO Cc1ccc(-c2cccc(C[NH+]3CCOCC3)c2F)c2cc[nH]c21 ZINC001244853459 1058058582 /nfs/dbraw/zinc/05/85/82/1058058582.db2.gz HWAMCAQEMFECSU-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO CSc1ncc(C)cc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001244883293 1058064392 /nfs/dbraw/zinc/06/43/92/1058064392.db2.gz AGSJFBBNXHQFMN-UHFFFAOYSA-N 1 2 308.397 4.119 20 0 DIADLO CCCNc1cc(C)[nH+]c(-c2ccc(OC(C)C)c(OC)c2)n1 ZINC001244882486 1058064531 /nfs/dbraw/zinc/06/45/31/1058064531.db2.gz BXTQDLAEQYUEOW-UHFFFAOYSA-N 1 2 315.417 4.070 20 0 DIADLO Clc1ccnc(Cl)c1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001244938370 1058075566 /nfs/dbraw/zinc/07/55/66/1058075566.db2.gz AZMAWFYPSAVPEW-UHFFFAOYSA-N 1 2 304.180 4.300 20 0 DIADLO CCOC(=O)c1cc2c(ccc(-c3cc[nH+]c(NC)c3)c2C)o1 ZINC001244976499 1058084131 /nfs/dbraw/zinc/08/41/31/1058084131.db2.gz KZMAZJNBHHAZCN-UHFFFAOYSA-N 1 2 310.353 4.022 20 0 DIADLO CCOC(=O)c1cccc2c(-c3cc[nH+]c(NC)c3)cccc12 ZINC001244977034 1058084597 /nfs/dbraw/zinc/08/45/97/1058084597.db2.gz OYMNVBKNODROJD-UHFFFAOYSA-N 1 2 306.365 4.120 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(O)cc1Cl ZINC001245083769 1058108907 /nfs/dbraw/zinc/10/89/07/1058108907.db2.gz QWESPSZVUCBDJU-UHFFFAOYSA-N 1 2 302.805 4.406 20 0 DIADLO CNc1cc(-c2ccc(C(=O)N(C)c3ccccc3)cc2)cc[nH+]1 ZINC001245125064 1058116701 /nfs/dbraw/zinc/11/67/01/1058116701.db2.gz MNIYNMHWMPLMHX-UHFFFAOYSA-N 1 2 317.392 4.067 20 0 DIADLO CC(C)(O)c1cc(F)cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1 ZINC001245142950 1058120427 /nfs/dbraw/zinc/12/04/27/1058120427.db2.gz FFMBNFWSNTWEQO-UHFFFAOYSA-N 1 2 314.335 4.045 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1-c1ccc(-c2csnn2)cc1 ZINC001245197556 1058126160 /nfs/dbraw/zinc/12/61/60/1058126160.db2.gz UKDDUCTWZJEZIX-UHFFFAOYSA-N 1 2 318.405 4.117 20 0 DIADLO c1coc(-c2cccc(-c3c[nH+]cn3Cc3ccccc3)c2)n1 ZINC001245197184 1058126459 /nfs/dbraw/zinc/12/64/59/1058126459.db2.gz QJRRHJOGSBSHOS-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO CCN(CC)c1ccc(-c2c[nH+]cn2Cc2ccccc2)cc1 ZINC001245197227 1058126472 /nfs/dbraw/zinc/12/64/72/1058126472.db2.gz SKYSJXNOENBHOE-UHFFFAOYSA-N 1 2 305.425 4.445 20 0 DIADLO CCc1cc2cc(-c3c[nH+]cn3Cc3ccccc3)cnc2[nH]1 ZINC001245196643 1058126581 /nfs/dbraw/zinc/12/65/81/1058126581.db2.gz JZDGBLWXLCWORE-UHFFFAOYSA-N 1 2 302.381 4.037 20 0 DIADLO CC1(C)COc2ccc(-c3c[nH+]cn3Cc3ccccc3)cc21 ZINC001245201018 1058127109 /nfs/dbraw/zinc/12/71/09/1058127109.db2.gz NKCVLMMPWCYFBD-UHFFFAOYSA-N 1 2 304.393 4.268 20 0 DIADLO COC(=[NH2+])c1cccc(-c2cc(SC)cc(F)c2OC)c1 ZINC001245225725 1058129585 /nfs/dbraw/zinc/12/95/85/1058129585.db2.gz HGVRIOHOMBBELS-UHFFFAOYSA-N 1 2 305.374 4.195 20 0 DIADLO Fc1ccccc1COc1ccc(-c2nc3[nH]ccc3c[nH+]2)cc1 ZINC001245294529 1058141423 /nfs/dbraw/zinc/14/14/23/1058141423.db2.gz AOCUBVMZHMTYQU-UHFFFAOYSA-N 1 2 319.339 4.295 20 0 DIADLO Cc1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)[nH+]c1N ZINC001245325801 1058145518 /nfs/dbraw/zinc/14/55/18/1058145518.db2.gz LFBQXTKARQZWII-UHFFFAOYSA-N 1 2 301.349 4.447 20 0 DIADLO Nc1ccc2cc(-c3cc[nH+]c(N4CCCCC4)c3)ccc2c1 ZINC001245369415 1058154305 /nfs/dbraw/zinc/15/43/05/1058154305.db2.gz RLFICMWPMRIXLQ-UHFFFAOYSA-N 1 2 303.409 4.474 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cnn(CC(F)(F)F)c2)c1 ZINC001245387178 1058158083 /nfs/dbraw/zinc/15/80/83/1058158083.db2.gz CEMKQYBNJXCRPM-UHFFFAOYSA-N 1 2 311.351 4.267 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1c[nH]c2ncc(F)cc12 ZINC001245431886 1058165393 /nfs/dbraw/zinc/16/53/93/1058165393.db2.gz WIXQSHDLYWXIPX-UHFFFAOYSA-N 1 2 310.376 4.063 20 0 DIADLO CC(C)[C@H](CCc1ccccc1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001527606585 1058186357 /nfs/dbraw/zinc/18/63/57/1058186357.db2.gz VJFYWGGJAXQJCS-SFHVURJKSA-N 1 2 321.424 4.178 20 0 DIADLO CC[C@H](Cc1ccccc1C)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC001545563447 1058211139 /nfs/dbraw/zinc/21/11/39/1058211139.db2.gz RYTJSLGYWBMGNB-OAHLLOKOSA-N 1 2 321.424 4.387 20 0 DIADLO CC(=Cc1ccc(C)cc1)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC001545563060 1058211627 /nfs/dbraw/zinc/21/16/27/1058211627.db2.gz IASBCUATAWXWKM-JLHYYAGUSA-N 1 2 305.381 4.222 20 0 DIADLO Cc1cc(-c2ccc(-c3cn4ccsc4n3)cc2)c[nH+]c1N ZINC001245537911 1058215046 /nfs/dbraw/zinc/21/50/46/1058215046.db2.gz HFDFZDHBGAQWTC-UHFFFAOYSA-N 1 2 306.394 4.015 20 0 DIADLO Cc1cc(-c2nc(C)nc3sc4c(c32)CC[C@@H](C)C4)c[nH+]c1N ZINC001245537776 1058215317 /nfs/dbraw/zinc/21/53/17/1058215317.db2.gz IGDRCJOGAQKUOH-SECBINFHSA-N 1 2 324.453 4.077 20 0 DIADLO Cc1cc(-c2ccc3ccc(C(F)(F)F)cc3n2)c[nH+]c1N ZINC001245535878 1058217049 /nfs/dbraw/zinc/21/70/49/1058217049.db2.gz HBCJMCRLRFPPBL-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1cc(-c2cc(SCc3ccccc3)ccn2)c[nH+]c1N ZINC001245539334 1058218221 /nfs/dbraw/zinc/21/82/21/1058218221.db2.gz YAASUODFMRLQIX-UHFFFAOYSA-N 1 2 307.422 4.327 20 0 DIADLO Cc1cc(-c2cnc3cc(C(F)(F)F)ccc3c2)c[nH+]c1N ZINC001245540684 1058218821 /nfs/dbraw/zinc/21/88/21/1058218821.db2.gz YHFHEDWOTKNXQP-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1cc(-c2ccc(C(F)(F)F)c3ncccc23)c[nH+]c1N ZINC001245540649 1058219127 /nfs/dbraw/zinc/21/91/27/1058219127.db2.gz XJEARMCESIJQFP-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1cc(-c2ccc(OCCCc3ccccn3)cc2)c[nH+]c1N ZINC001245539072 1058219425 /nfs/dbraw/zinc/21/94/25/1058219425.db2.gz QHFYVGHPIDIKOG-UHFFFAOYSA-N 1 2 319.408 4.046 20 0 DIADLO COC(=O)c1cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c(C)cc1C ZINC001245556007 1058229797 /nfs/dbraw/zinc/22/97/97/1058229797.db2.gz OLWDFHSHZYVXCT-UHFFFAOYSA-N 1 2 324.355 4.082 20 0 DIADLO C[C@@H](CC1CCCCC1)C(=O)N1CCCC[C@H]1c1c[nH+]cn1C ZINC001548828318 1058263882 /nfs/dbraw/zinc/26/38/82/1058263882.db2.gz OOKFIEZJRXZGPN-RDJZCZTQSA-N 1 2 317.477 4.080 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2Cc2cncn2C(C)C)sc1C ZINC001549006965 1058279183 /nfs/dbraw/zinc/27/91/83/1058279183.db2.gz PRZHNXAWNYSRBJ-INIZCTEOSA-N 1 2 318.490 4.265 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2Cc2cncn2C(C)C)sc1C ZINC001549006965 1058279200 /nfs/dbraw/zinc/27/92/00/1058279200.db2.gz PRZHNXAWNYSRBJ-INIZCTEOSA-N 1 2 318.490 4.265 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2Cc2cnc(C3CC3)o2)sc1C ZINC001549631653 1058299989 /nfs/dbraw/zinc/29/99/89/1058299989.db2.gz IOLPPFXOHZCMOX-HNNXBMFYSA-N 1 2 317.458 4.353 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2Cc2cnc(C3CC3)o2)sc1C ZINC001549631653 1058300006 /nfs/dbraw/zinc/30/00/06/1058300006.db2.gz IOLPPFXOHZCMOX-HNNXBMFYSA-N 1 2 317.458 4.353 20 0 DIADLO Oc1cc(F)c(-c2cc(C[NH+]3CCCCC3)ccn2)cc1Cl ZINC001245669437 1058325856 /nfs/dbraw/zinc/32/58/56/1058325856.db2.gz SIURCUOBUCJDSI-UHFFFAOYSA-N 1 2 320.795 4.233 20 0 DIADLO COc1c(Br)cccc1-c1cc(C)c2[nH+]ccn2c1 ZINC001245682275 1058345680 /nfs/dbraw/zinc/34/56/80/1058345680.db2.gz CCKBJAQSPBZXOY-UHFFFAOYSA-N 1 2 317.186 4.081 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@H]2c2nc(C)c(C)s2)o1 ZINC001550623378 1058350773 /nfs/dbraw/zinc/35/07/73/1058350773.db2.gz QXTIIYDFDVKHDQ-AWEZNQCLSA-N 1 2 306.431 4.089 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@H]2c2nc(C)c(C)s2)o1 ZINC001550623378 1058350790 /nfs/dbraw/zinc/35/07/90/1058350790.db2.gz QXTIIYDFDVKHDQ-AWEZNQCLSA-N 1 2 306.431 4.089 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@H]3CCCC[C@@H]3C2)c(C)[nH+]1 ZINC001562900629 1058357724 /nfs/dbraw/zinc/35/77/24/1058357724.db2.gz MAPYJXIRRKCYJU-HZPDHXFCSA-N 1 2 301.434 4.051 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2ccc(C3CCC3)cc2)c(C)[nH+]1 ZINC001518698644 1058367540 /nfs/dbraw/zinc/36/75/40/1058367540.db2.gz HFHQJFRUCBPWQL-UHFFFAOYSA-N 1 2 308.425 4.456 20 0 DIADLO Cc1cc(N2CC[C@H](c3ccccc3)O[C@H](C)C2)nc(C2CC2)[nH+]1 ZINC001551229492 1058381111 /nfs/dbraw/zinc/38/11/11/1058381111.db2.gz UWAWYIDCBKOPAH-CRAIPNDOSA-N 1 2 323.440 4.019 20 0 DIADLO Nc1cn2ccc(-c3cccc(C(F)(F)F)c3Cl)cc2[nH+]1 ZINC001245711483 1058384311 /nfs/dbraw/zinc/38/43/11/1058384311.db2.gz WGUMWKHESWWOJY-UHFFFAOYSA-N 1 2 311.694 4.256 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc(Cl)s2)CC[C@H](c2ccccc2)O1 ZINC001551397124 1058394696 /nfs/dbraw/zinc/39/46/96/1058394696.db2.gz UKQOMTCADXCYSG-SWLSCSKDSA-N 1 2 322.861 4.149 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnc(Cl)s2)CC[C@H](c2ccccc2)O1 ZINC001551397124 1058394709 /nfs/dbraw/zinc/39/47/09/1058394709.db2.gz UKQOMTCADXCYSG-SWLSCSKDSA-N 1 2 322.861 4.149 20 0 DIADLO COc1c(Cl)ccc(F)c1-c1ccccc1Cn1cc[nH+]c1 ZINC001245729694 1058407348 /nfs/dbraw/zinc/40/73/48/1058407348.db2.gz BAIHLIKRESHISV-UHFFFAOYSA-N 1 2 316.763 4.400 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@H]3CCCC[C@@H]32)[nH+]c1C ZINC001551740613 1058408232 /nfs/dbraw/zinc/40/82/32/1058408232.db2.gz NRSJKHJJTSRRNF-HLLBOEOZSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@H]2C(C)(C)C)[nH+]c1C ZINC001551738165 1058408655 /nfs/dbraw/zinc/40/86/55/1058408655.db2.gz HMANDAFEZVIEET-LSDHHAIUSA-N 1 2 311.429 4.314 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2CCCC2(C)C)[nH+]c1C ZINC001551737362 1058408704 /nfs/dbraw/zinc/40/87/04/1058408704.db2.gz CVYAVVCIZFUWOR-HNNXBMFYSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)CC[C@@H]2CC2(F)F)[nH+]c1C ZINC001551738869 1058409221 /nfs/dbraw/zinc/40/92/21/1058409221.db2.gz JXVDSZYZFWAPRN-GFCCVEGCSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]23)[nH+]c1C ZINC001551740620 1058409629 /nfs/dbraw/zinc/40/96/29/1058409629.db2.gz NRSJKHJJTSRRNF-ZMSDIMECSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@@]2(C)C(C)C)[nH+]c1C ZINC001551743579 1058411991 /nfs/dbraw/zinc/41/19/91/1058411991.db2.gz XBWVPZFPKKLMQE-KXBFYZLASA-N 1 2 311.429 4.314 20 0 DIADLO C/C(=C\C(C)(C)C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001519379800 1058423853 /nfs/dbraw/zinc/42/38/53/1058423853.db2.gz IZCYWIXETLRFMH-ZRDIBKRKSA-N 1 2 317.820 4.457 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001245745242 1058426710 /nfs/dbraw/zinc/42/67/10/1058426710.db2.gz UFWSJELTPSLZER-UHFFFAOYSA-N 1 2 322.170 4.439 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(SC)ccc1F ZINC001245746026 1058427033 /nfs/dbraw/zinc/42/70/33/1058427033.db2.gz GSNGUDKPMLCFEI-UHFFFAOYSA-N 1 2 314.385 4.409 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccc(C3=CCCC3)cc2)c[nH+]1 ZINC001528521320 1058442243 /nfs/dbraw/zinc/44/22/43/1058442243.db2.gz RDVYICPZZVFYBN-UHFFFAOYSA-N 1 2 306.409 4.196 20 0 DIADLO Cc1cc(N[C@@H]2CCO[C@H](c3cccnc3)C2)[nH+]c2ccccc12 ZINC001553701188 1058498254 /nfs/dbraw/zinc/49/82/54/1058498254.db2.gz RRSPIFUNXOAMGX-APWZRJJASA-N 1 2 319.408 4.270 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N[C@@H]1CCO[C@H](c2ccccn2)C1 ZINC001553702322 1058500220 /nfs/dbraw/zinc/50/02/20/1058500220.db2.gz QWFWNIGVWHUXJC-APWZRJJASA-N 1 2 319.408 4.270 20 0 DIADLO CC(C)c1nc(C[NH+]2CCC(c3cccc4[nH]ccc43)CC2)no1 ZINC001553875797 1058507459 /nfs/dbraw/zinc/50/74/59/1058507459.db2.gz SOQLGAPCCCYRSY-UHFFFAOYSA-N 1 2 324.428 4.054 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C[C@@H](C)c2ccco2)[nH+]c1C ZINC001553989930 1058512964 /nfs/dbraw/zinc/51/29/64/1058512964.db2.gz UXOLPVWSDVTXMU-GFCCVEGCSA-N 1 2 323.396 4.419 20 0 DIADLO CCOc1nccc(-c2ccc(-c3c[nH+]cn3C)cc2)c1Cl ZINC001245846417 1058550989 /nfs/dbraw/zinc/55/09/89/1058550989.db2.gz IXOFOJUTNNKNQI-UHFFFAOYSA-N 1 2 313.788 4.201 20 0 DIADLO COc1cc(-c2c[nH+]c(N(C)C)cc2C)c(F)c(F)c1Cl ZINC001245857550 1058565165 /nfs/dbraw/zinc/56/51/65/1058565165.db2.gz UFHMCZMTCFFWAU-UHFFFAOYSA-N 1 2 312.747 4.063 20 0 DIADLO Cn1c[nH+]cc1-c1cc(F)c(OCc2ccccc2)c(Cl)c1 ZINC001245865449 1058574070 /nfs/dbraw/zinc/57/40/70/1058574070.db2.gz LYDKJNWWBNJHMC-UHFFFAOYSA-N 1 2 316.763 4.459 20 0 DIADLO COc1ccc(F)c(-c2ccc(-n3cc[nH+]c3)cc2)c1Cl ZINC001245886902 1058598958 /nfs/dbraw/zinc/59/89/58/1058598958.db2.gz QVXSKHDXIGTUFL-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO CCCCC[C@@H](NC(=O)c1cccc2[nH+]ccn21)c1ccccc1 ZINC001520548506 1058635287 /nfs/dbraw/zinc/63/52/87/1058635287.db2.gz FEIXJYYYWXGEFL-QGZVFWFLSA-N 1 2 321.424 4.386 20 0 DIADLO CCCCC[C@H](NC(=O)c1cccc2[nH+]ccn21)c1ccccc1 ZINC001520548505 1058636137 /nfs/dbraw/zinc/63/61/37/1058636137.db2.gz FEIXJYYYWXGEFL-KRWDZBQOSA-N 1 2 321.424 4.386 20 0 DIADLO Cc1ccc(C[C@@H]2CCCN2C(=O)c2c(C)cc(C)[nH+]c2C)cc1 ZINC001529299639 1058669295 /nfs/dbraw/zinc/66/92/95/1058669295.db2.gz VDDRSIJGJFJFIG-IBGZPJMESA-N 1 2 322.452 4.163 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)CCC2CCCCC2)c(C)[nH+]1 ZINC001529376056 1058690544 /nfs/dbraw/zinc/69/05/44/1058690544.db2.gz MABHBNJAGBNPRB-CQSZACIVSA-N 1 2 302.462 4.486 20 0 DIADLO Cc1oc(-c2ccccc2)cc1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001529650442 1058782247 /nfs/dbraw/zinc/78/22/47/1058782247.db2.gz GJCHRIFJXGZGDM-UHFFFAOYSA-N 1 2 317.348 4.155 20 0 DIADLO Cc1cc(C(=O)Oc2ccc(-c3[nH+]cc4n3CCCC4)cc2)co1 ZINC001521242211 1058797430 /nfs/dbraw/zinc/79/74/30/1058797430.db2.gz NJQORNFUJSLVKS-UHFFFAOYSA-N 1 2 322.364 4.007 20 0 DIADLO CCC[C@@H](C(=O)N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1)C(C)C ZINC001558953074 1058928159 /nfs/dbraw/zinc/92/81/59/1058928159.db2.gz AKUBGEHRICQLFV-MAUKXSAKSA-N 1 2 313.445 4.122 20 0 DIADLO Cc1cc(N(C)Cc2ccccc2Cl)nc(C2CCC2)[nH+]1 ZINC001559049668 1058946570 /nfs/dbraw/zinc/94/65/70/1058946570.db2.gz PQHUJFYVXDHNPV-UHFFFAOYSA-N 1 2 301.821 4.342 20 0 DIADLO Cc1cc(NCc2ccc(OC(C)C)cc2)nc(C2CCC2)[nH+]1 ZINC001559060846 1058955532 /nfs/dbraw/zinc/95/55/32/1058955532.db2.gz HBSRXUVSOMSZCF-UHFFFAOYSA-N 1 2 311.429 4.452 20 0 DIADLO Cc1nc(N(C)CCCCc2ccccc2)c2c([nH+]1)CCCC2 ZINC001559073676 1058965194 /nfs/dbraw/zinc/96/51/94/1058965194.db2.gz KQVAOWNBGFYVRE-UHFFFAOYSA-N 1 2 309.457 4.123 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(Nc3cccc(OCC(C)C)c3)c12 ZINC001559074728 1058967218 /nfs/dbraw/zinc/96/72/18/1058967218.db2.gz CXGZWOWFAPYZJJ-UHFFFAOYSA-N 1 2 310.401 4.299 20 0 DIADLO CCc1cc(N2CCC[C@H]2c2ccccc2Cl)nc(C)[nH+]1 ZINC001559075877 1058967864 /nfs/dbraw/zinc/96/78/64/1058967864.db2.gz ZNVLVYUQHOHSMF-INIZCTEOSA-N 1 2 301.821 4.342 20 0 DIADLO Cc1nc(NCCCCCc2ccccc2)c2c([nH+]1)CCCC2 ZINC001559095033 1058983797 /nfs/dbraw/zinc/98/37/97/1058983797.db2.gz LRGSSWIGRWYTCN-UHFFFAOYSA-N 1 2 309.457 4.489 20 0 DIADLO Cc1nc(N2CCC[C@@H](C(C)(C)C)CC2)c2c([nH+]1)CCCC2 ZINC001559105940 1058993093 /nfs/dbraw/zinc/99/30/93/1058993093.db2.gz HXFOMQJAKCRVSQ-OAHLLOKOSA-N 1 2 301.478 4.316 20 0 DIADLO CC[C@@H](CNc1cc(C)[nH+]c(C2CC2)n1)Oc1ccccc1C ZINC001559121223 1059007895 /nfs/dbraw/zinc/00/78/95/1059007895.db2.gz NCDDOIIQNONDFA-INIZCTEOSA-N 1 2 311.429 4.240 20 0 DIADLO C[C@@H](Nc1nc2ccccc2n2c[nH+]cc12)[C@H](C)c1ccccc1 ZINC001559124139 1059015017 /nfs/dbraw/zinc/01/50/17/1059015017.db2.gz XHJRJLHJOMFUCA-LSDHHAIUSA-N 1 2 316.408 4.487 20 0 DIADLO COC1CCC(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)CC1 ZINC001559128814 1059019446 /nfs/dbraw/zinc/01/94/46/1059019446.db2.gz HYWIGABBTGKQAA-UHFFFAOYSA-N 1 2 305.466 4.341 20 0 DIADLO Cc1cc(N2CCc3cccc(F)c3[C@H]2C)nc(C2CCC2)[nH+]1 ZINC001559161637 1059046411 /nfs/dbraw/zinc/04/64/11/1059046411.db2.gz HRINIWICIXPCSA-CYBMUJFWSA-N 1 2 311.404 4.315 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)N(c3nc(C)[nH+]c4c3CCCC4)C2)cc1 ZINC001559179056 1059060593 /nfs/dbraw/zinc/06/05/93/1059060593.db2.gz KSUUBCBHIMDSCK-CRAIPNDOSA-N 1 2 321.468 4.355 20 0 DIADLO CCc1cc(N2CC[C@@H](c3ccc(C)cc3C)C2)nc(CC)[nH+]1 ZINC001559184211 1059068500 /nfs/dbraw/zinc/06/85/00/1059068500.db2.gz YYOGEDMBDNPSHY-MRXNPFEDSA-N 1 2 309.457 4.212 20 0 DIADLO Cc1cc(C)c(CNc2nc(C)nc3sc4c(c32)CCC4)c[nH+]1 ZINC001559210701 1059092590 /nfs/dbraw/zinc/09/25/90/1059092590.db2.gz CGMZULVZTGGVPV-UHFFFAOYSA-N 1 2 324.453 4.112 20 0 DIADLO COCC1(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)CCCC1 ZINC001559213355 1059094683 /nfs/dbraw/zinc/09/46/83/1059094683.db2.gz OJCSVZSZRDJCMX-UHFFFAOYSA-N 1 2 305.466 4.342 20 0 DIADLO Cc1cccc(-c2nsc(NCCc3[nH+]cc(C)cc3C)n2)c1 ZINC001559223470 1059101647 /nfs/dbraw/zinc/10/16/47/1059101647.db2.gz DINSAABLSGOXEI-UHFFFAOYSA-N 1 2 324.453 4.180 20 0 DIADLO CN(C)c1[nH+]ccc2cc(NC(=O)/C=C/c3cccs3)ccc21 ZINC001522598124 1059119140 /nfs/dbraw/zinc/11/91/40/1059119140.db2.gz NXIGISDODLUFMD-SOFGYWHQSA-N 1 2 323.421 4.014 20 0 DIADLO CCNc1cc(CNc2cc(C(C)C)nc(C(C)C)n2)cc[nH+]1 ZINC001559252053 1059122070 /nfs/dbraw/zinc/12/20/70/1059122070.db2.gz QYBHOHPQAHELNB-UHFFFAOYSA-N 1 2 313.449 4.162 20 0 DIADLO CC(C)c1cc(N2CC(Cc3cccs3)C2)nc(C(C)C)[nH+]1 ZINC001559251274 1059122395 /nfs/dbraw/zinc/12/23/95/1059122395.db2.gz KFUCWHHFVUZXDY-UHFFFAOYSA-N 1 2 315.486 4.464 20 0 DIADLO CCc1cc(NCc2ccc(C(F)(F)F)s2)nc(CC)[nH+]1 ZINC001559271960 1059134972 /nfs/dbraw/zinc/13/49/72/1059134972.db2.gz ZDVXCXQXJWLFTQ-UHFFFAOYSA-N 1 2 315.364 4.294 20 0 DIADLO CC(C)c1cc(NCC[C@H]2CC(C)(C)CO2)nc(C(C)C)[nH+]1 ZINC001559277095 1059136976 /nfs/dbraw/zinc/13/69/76/1059136976.db2.gz DJCXASQILRQROK-AWEZNQCLSA-N 1 2 305.466 4.341 20 0 DIADLO CCc1cc(N[C@H]2C[C@H](c3ccc(F)cc3F)C2)nc(CC)[nH+]1 ZINC001559290682 1059145004 /nfs/dbraw/zinc/14/50/04/1059145004.db2.gz XYILABSTHVCLID-YEORSEQZSA-N 1 2 317.383 4.238 20 0 DIADLO Cc1cc(N)nc(SCc2c(C)c(C)c(C)c(C)c2C)[nH+]1 ZINC001559342795 1059173757 /nfs/dbraw/zinc/17/37/57/1059173757.db2.gz SGBICEUGHOOKPC-UHFFFAOYSA-N 1 2 301.459 4.202 20 0 DIADLO FC(F)(F)c1cc2nc([C@@H]3CCCC[NH2+]3)[nH]c2c(Cl)c1 ZINC001247007101 1059231282 /nfs/dbraw/zinc/23/12/82/1059231282.db2.gz CAXZJSFSBMKKRG-VIFPVBQESA-N 1 2 303.715 4.050 20 0 DIADLO CC(C)(C)c1ccc(/C=C/C(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC001531286241 1059270226 /nfs/dbraw/zinc/27/02/26/1059270226.db2.gz RQZGYKDKKDCFDE-FMIVXFBMSA-N 1 2 319.408 4.284 20 0 DIADLO CC[N@H+](Cc1cc(Cl)n(C)n1)[C@H](C)c1cc2ccccc2o1 ZINC001559499230 1059281469 /nfs/dbraw/zinc/28/14/69/1059281469.db2.gz MLRHMRVAHJPWTP-GFCCVEGCSA-N 1 2 317.820 4.403 20 0 DIADLO CC[N@@H+](Cc1cc(Cl)n(C)n1)[C@H](C)c1cc2ccccc2o1 ZINC001559499230 1059281494 /nfs/dbraw/zinc/28/14/94/1059281494.db2.gz MLRHMRVAHJPWTP-GFCCVEGCSA-N 1 2 317.820 4.403 20 0 DIADLO CC(C)C[N@H+](Cc1cc2n(n1)CCCC2)Cc1ccccc1F ZINC001559505861 1059292450 /nfs/dbraw/zinc/29/24/50/1059292450.db2.gz PIXBLQDAYRGTEI-UHFFFAOYSA-N 1 2 315.436 4.017 20 0 DIADLO CC(C)C[N@@H+](Cc1cc2n(n1)CCCC2)Cc1ccccc1F ZINC001559505861 1059292469 /nfs/dbraw/zinc/29/24/69/1059292469.db2.gz PIXBLQDAYRGTEI-UHFFFAOYSA-N 1 2 315.436 4.017 20 0 DIADLO c1[nH]c2c([nH+]1)[C@@H](c1nc(-c3ccc4ccccc4c3)no1)CCC2 ZINC001247275726 1059365853 /nfs/dbraw/zinc/36/58/53/1059365853.db2.gz LKSXHCFZXIVVGI-HNNXBMFYSA-N 1 2 316.364 4.081 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CCC2(C1)CCCCC2 ZINC001559562256 1059379608 /nfs/dbraw/zinc/37/96/08/1059379608.db2.gz YRKYDDWKQRGWIW-INIZCTEOSA-N 1 2 321.848 4.210 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CCC2(C1)CCCCC2 ZINC001559562256 1059379616 /nfs/dbraw/zinc/37/96/16/1059379616.db2.gz YRKYDDWKQRGWIW-INIZCTEOSA-N 1 2 321.848 4.210 20 0 DIADLO C[C@H]1CC[C@H](c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)CC1 ZINC001247357988 1059395728 /nfs/dbraw/zinc/39/57/28/1059395728.db2.gz HVHCKGXYWCIIJD-CTYIDZIISA-N 1 2 308.385 4.216 20 0 DIADLO c1cn(-c2ccc(-c3noc(CCC4CCCC4)n3)cc2)c[nH+]1 ZINC001247379502 1059423977 /nfs/dbraw/zinc/42/39/77/1059423977.db2.gz BHHNHSCEEMCURZ-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)sn1 ZINC001559612670 1059445905 /nfs/dbraw/zinc/44/59/05/1059445905.db2.gz NCSXQUVJSZUORE-INIZCTEOSA-N 1 2 308.397 4.457 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)sn1 ZINC001559612670 1059445910 /nfs/dbraw/zinc/44/59/10/1059445910.db2.gz NCSXQUVJSZUORE-INIZCTEOSA-N 1 2 308.397 4.457 20 0 DIADLO CCC1CCC([NH2+]Cc2c(C)cc(C)cc2C)(C(=O)OC)CC1 ZINC001559624867 1059453615 /nfs/dbraw/zinc/45/36/15/1059453615.db2.gz WQYOQFITOVXRCJ-UHFFFAOYSA-N 1 2 317.473 4.213 20 0 DIADLO C(=C/c1ccccc1)\c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001247410145 1059462173 /nfs/dbraw/zinc/46/21/73/1059462173.db2.gz DTJPSYRVNBYPBS-IZZDOVSWSA-N 1 2 314.348 4.093 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@@H](CC(C)C)C1 ZINC001559649345 1059474341 /nfs/dbraw/zinc/47/43/41/1059474341.db2.gz DOLSWWDYLVHWNM-WMLDXEAASA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@@H](CC(C)C)C1 ZINC001559649345 1059474354 /nfs/dbraw/zinc/47/43/54/1059474354.db2.gz DOLSWWDYLVHWNM-WMLDXEAASA-N 1 2 323.864 4.312 20 0 DIADLO CCC(C)(C)c1ccc(C[N@H+](C)[C@H](C)C(=O)OC(C)C)cc1 ZINC001559649330 1059475083 /nfs/dbraw/zinc/47/50/83/1059475083.db2.gz DEYNJLYOKURQKS-OAHLLOKOSA-N 1 2 305.462 4.146 20 0 DIADLO CCC(C)(C)c1ccc(C[N@@H+](C)[C@H](C)C(=O)OC(C)C)cc1 ZINC001559649330 1059475089 /nfs/dbraw/zinc/47/50/89/1059475089.db2.gz DEYNJLYOKURQKS-OAHLLOKOSA-N 1 2 305.462 4.146 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@H](CC(C)C)C1 ZINC001559649343 1059476748 /nfs/dbraw/zinc/47/67/48/1059476748.db2.gz DOLSWWDYLVHWNM-PBHICJAKSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@H](CC(C)C)C1 ZINC001559649343 1059476751 /nfs/dbraw/zinc/47/67/51/1059476751.db2.gz DOLSWWDYLVHWNM-PBHICJAKSA-N 1 2 323.864 4.312 20 0 DIADLO Cc1cc(C)nc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)c1 ZINC001559650862 1059477948 /nfs/dbraw/zinc/47/79/48/1059477948.db2.gz QNGPMIJYEXHPNB-ZDUSSCGKSA-N 1 2 302.368 4.096 20 0 DIADLO Cc1cc(C)nc(C[N@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)c1 ZINC001559650862 1059477955 /nfs/dbraw/zinc/47/79/55/1059477955.db2.gz QNGPMIJYEXHPNB-ZDUSSCGKSA-N 1 2 302.368 4.096 20 0 DIADLO CCN(Cc1ccc(Cl)s1)C(=O)c1c(C)cc(C)[nH+]c1C ZINC001524435891 1059521211 /nfs/dbraw/zinc/52/12/11/1059521211.db2.gz QOWCHQKHIMOUBY-UHFFFAOYSA-N 1 2 322.861 4.384 20 0 DIADLO CCCC/C=C/Cc1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001247540851 1059525737 /nfs/dbraw/zinc/52/57/37/1059525737.db2.gz ZKZBPTGCTURJIY-AATRIKPKSA-N 1 2 308.385 4.211 20 0 DIADLO C[C@H]([NH2+]Cc1csc(C2CC2)n1)c1ccccc1OC(F)F ZINC001559697335 1059526821 /nfs/dbraw/zinc/52/68/21/1059526821.db2.gz AELQJHPNYZUIGU-JTQLQIEISA-N 1 2 324.396 4.473 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1ccc(-c2ncco2)cc1F ZINC001559722463 1059550555 /nfs/dbraw/zinc/55/05/55/1059550555.db2.gz SOAXJUIMMLTHFT-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccc(-c2ncco2)cc1F ZINC001559722463 1059550576 /nfs/dbraw/zinc/55/05/76/1059550576.db2.gz SOAXJUIMMLTHFT-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC001524628255 1059558288 /nfs/dbraw/zinc/55/82/88/1059558288.db2.gz FKWVCWUVQFDROM-QZTJIDSGSA-N 1 2 319.408 4.247 20 0 DIADLO CCOc1cccc2cc([C@H](C)[NH2+]Cc3nccs3)oc21 ZINC001559729102 1059563221 /nfs/dbraw/zinc/56/32/21/1059563221.db2.gz METOVSJCACEVKD-NSHDSACASA-N 1 2 302.399 4.139 20 0 DIADLO C[C@@H](c1ccsc1)N1CC[NH+]([C@@H](C)c2ccccc2F)CC1 ZINC001559771995 1059609614 /nfs/dbraw/zinc/60/96/14/1059609614.db2.gz LALAKXPOCIEBMT-GJZGRUSLSA-N 1 2 318.461 4.327 20 0 DIADLO C[C@H](c1ccsc1)N1CC[NH+]([C@H](C)c2ccccc2F)CC1 ZINC001559771996 1059610131 /nfs/dbraw/zinc/61/01/31/1059610131.db2.gz LALAKXPOCIEBMT-HUUCEWRRSA-N 1 2 318.461 4.327 20 0 DIADLO CCCC[C@H]([NH2+][C@H]1CC(C)(C)CCc2ccccc21)C(=O)OC ZINC001559782366 1059619088 /nfs/dbraw/zinc/61/90/88/1059619088.db2.gz MFDDYJYMQLDJIX-ROUUACIJSA-N 1 2 317.473 4.412 20 0 DIADLO C[C@]1(C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)C=CCC1 ZINC001524815177 1059638046 /nfs/dbraw/zinc/63/80/46/1059638046.db2.gz ISXWNBJGCLKIPZ-FQEVSTJZSA-N 1 2 321.424 4.181 20 0 DIADLO Clc1ccc([C@@H]2CC[N@@H+]2CC2(Br)CC2)cc1 ZINC001559829475 1059661107 /nfs/dbraw/zinc/66/11/07/1059661107.db2.gz UVDJFPFNNZVTME-LBPRGKRZSA-N 1 2 300.627 4.014 20 0 DIADLO Clc1ccc([C@@H]2CC[N@H+]2CC2(Br)CC2)cc1 ZINC001559829475 1059661121 /nfs/dbraw/zinc/66/11/21/1059661121.db2.gz UVDJFPFNNZVTME-LBPRGKRZSA-N 1 2 300.627 4.014 20 0 DIADLO CC[C@@]([NH2+]C[C@H](C)CC(C)(C)C)(C(=O)OC)c1ccccc1 ZINC001559829816 1059665181 /nfs/dbraw/zinc/66/51/81/1059665181.db2.gz CVAQBJOAFHDJFJ-BEFAXECRSA-N 1 2 305.462 4.127 20 0 DIADLO COc1cccc(C[N@@H+]2CCc3c(Cl)cc(F)cc3C2)c1C ZINC001559875066 1059693403 /nfs/dbraw/zinc/69/34/03/1059693403.db2.gz KOUVTEHNMMFDLX-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO COc1cccc(C[N@H+]2CCc3c(Cl)cc(F)cc3C2)c1C ZINC001559875066 1059693413 /nfs/dbraw/zinc/69/34/13/1059693413.db2.gz KOUVTEHNMMFDLX-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001559876360 1059697117 /nfs/dbraw/zinc/69/71/17/1059697117.db2.gz TYLAIRXMHDUURM-QWHCGFSZSA-N 1 2 303.352 4.309 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001559876360 1059697123 /nfs/dbraw/zinc/69/71/23/1059697123.db2.gz TYLAIRXMHDUURM-QWHCGFSZSA-N 1 2 303.352 4.309 20 0 DIADLO CCSCC[N@@H+]1CCCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC001559891593 1059709614 /nfs/dbraw/zinc/70/96/14/1059709614.db2.gz MZCKMVJGTAQBJQ-OAHLLOKOSA-N 1 2 323.893 4.496 20 0 DIADLO CCSCC[N@H+]1CCCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC001559891593 1059709627 /nfs/dbraw/zinc/70/96/27/1059709627.db2.gz MZCKMVJGTAQBJQ-OAHLLOKOSA-N 1 2 323.893 4.496 20 0 DIADLO Cc1cc(C[N@@H+]([C@@H](C)C(=O)OC(C)(C)C)C2CC2)c(C)s1 ZINC001559900872 1059717802 /nfs/dbraw/zinc/71/78/02/1059717802.db2.gz AWIANNNJCVDFEG-LBPRGKRZSA-N 1 2 309.475 4.060 20 0 DIADLO Cc1cc(C[N@H+]([C@@H](C)C(=O)OC(C)(C)C)C2CC2)c(C)s1 ZINC001559900872 1059717823 /nfs/dbraw/zinc/71/78/23/1059717823.db2.gz AWIANNNJCVDFEG-LBPRGKRZSA-N 1 2 309.475 4.060 20 0 DIADLO CCc1ccc(-c2noc([C@H]3Cc4ccccc4C[N@@H+]3C)n2)cc1 ZINC001248119643 1059731623 /nfs/dbraw/zinc/73/16/23/1059731623.db2.gz LLSVIAJHFBVONT-GOSISDBHSA-N 1 2 319.408 4.028 20 0 DIADLO CCc1ccc(-c2noc([C@H]3Cc4ccccc4C[N@H+]3C)n2)cc1 ZINC001248119643 1059731645 /nfs/dbraw/zinc/73/16/45/1059731645.db2.gz LLSVIAJHFBVONT-GOSISDBHSA-N 1 2 319.408 4.028 20 0 DIADLO CCc1cccc(-c2noc([C@@H]3Cc4ccccc4C[N@@H+]3C)n2)c1 ZINC001248121405 1059734773 /nfs/dbraw/zinc/73/47/73/1059734773.db2.gz XBFDPUDVVHSQBB-SFHVURJKSA-N 1 2 319.408 4.028 20 0 DIADLO CCc1cccc(-c2noc([C@@H]3Cc4ccccc4C[N@H+]3C)n2)c1 ZINC001248121405 1059734786 /nfs/dbraw/zinc/73/47/86/1059734786.db2.gz XBFDPUDVVHSQBB-SFHVURJKSA-N 1 2 319.408 4.028 20 0 DIADLO Cc1noc([C@@H](C)[N@H+](C)Cc2c(C)c(C)c(C)c(C)c2C)n1 ZINC001559949012 1059761858 /nfs/dbraw/zinc/76/18/58/1059761858.db2.gz LGBSUDCEZIBABC-OAHLLOKOSA-N 1 2 301.434 4.113 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2c(C)c(C)c(C)c(C)c2C)n1 ZINC001559949012 1059761863 /nfs/dbraw/zinc/76/18/63/1059761863.db2.gz LGBSUDCEZIBABC-OAHLLOKOSA-N 1 2 301.434 4.113 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(F)cccc2Cl)CC2(CCCCC2)O1 ZINC001559954262 1059764236 /nfs/dbraw/zinc/76/42/36/1059764236.db2.gz PRPSLLSCJMDHSS-CYBMUJFWSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(F)cccc2Cl)CC2(CCCCC2)O1 ZINC001559954262 1059764247 /nfs/dbraw/zinc/76/42/47/1059764247.db2.gz PRPSLLSCJMDHSS-CYBMUJFWSA-N 1 2 311.828 4.403 20 0 DIADLO CC(C)(C)c1ccc(-c2noc(C[NH2+]Cc3ccccc3)n2)cc1 ZINC001248302734 1059779453 /nfs/dbraw/zinc/77/94/53/1059779453.db2.gz NIVGTSIUDDWWFZ-UHFFFAOYSA-N 1 2 321.424 4.324 20 0 DIADLO CC[C@@H]1C[N@H+](CCc2c(Cl)cccc2Cl)[C@H](CC)CO1 ZINC001559973022 1059779373 /nfs/dbraw/zinc/77/93/73/1059779373.db2.gz CFEBKHAMPAVKKQ-CHWSQXEVSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)[C@H](CC)CO1 ZINC001559973022 1059779387 /nfs/dbraw/zinc/77/93/87/1059779387.db2.gz CFEBKHAMPAVKKQ-CHWSQXEVSA-N 1 2 316.272 4.425 20 0 DIADLO C[C@@H]1COC2(CCC2)C[N@@H+]1CCc1cccc(Cl)c1Cl ZINC001559976908 1059785297 /nfs/dbraw/zinc/78/52/97/1059785297.db2.gz IRDUKZCJLYZQJP-GFCCVEGCSA-N 1 2 314.256 4.179 20 0 DIADLO C[C@@H]1COC2(CCC2)C[N@H+]1CCc1cccc(Cl)c1Cl ZINC001559976908 1059785316 /nfs/dbraw/zinc/78/53/16/1059785316.db2.gz IRDUKZCJLYZQJP-GFCCVEGCSA-N 1 2 314.256 4.179 20 0 DIADLO COc1cccc(C[N@@H+]2CC[C@H]2c2ccc(F)cc2)c1Cl ZINC001559984192 1059788555 /nfs/dbraw/zinc/78/85/55/1059788555.db2.gz VIHXFBKSEWOGEF-HNNXBMFYSA-N 1 2 305.780 4.435 20 0 DIADLO COc1cccc(C[N@H+]2CC[C@H]2c2ccc(F)cc2)c1Cl ZINC001559984192 1059788579 /nfs/dbraw/zinc/78/85/79/1059788579.db2.gz VIHXFBKSEWOGEF-HNNXBMFYSA-N 1 2 305.780 4.435 20 0 DIADLO CC1(c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)CCCCC1 ZINC001248366452 1059799645 /nfs/dbraw/zinc/79/96/45/1059799645.db2.gz MEQYXHXGZPERML-UHFFFAOYSA-N 1 2 308.385 4.144 20 0 DIADLO Fc1cc(F)cc([C@@H]2COCC[N@@H+]2CC2CCCCCC2)c1 ZINC001560002847 1059808828 /nfs/dbraw/zinc/80/88/28/1059808828.db2.gz ZLBGCUFJTLUMEX-SFHVURJKSA-N 1 2 309.400 4.309 20 0 DIADLO Fc1cc(F)cc([C@@H]2COCC[N@H+]2CC2CCCCCC2)c1 ZINC001560002847 1059808854 /nfs/dbraw/zinc/80/88/54/1059808854.db2.gz ZLBGCUFJTLUMEX-SFHVURJKSA-N 1 2 309.400 4.309 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC001560013816 1059821236 /nfs/dbraw/zinc/82/12/36/1059821236.db2.gz DISLOWNSAVQTLJ-HFAKWTLXSA-N 1 2 303.780 4.146 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC001560013816 1059821259 /nfs/dbraw/zinc/82/12/59/1059821259.db2.gz DISLOWNSAVQTLJ-HFAKWTLXSA-N 1 2 303.780 4.146 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccc(CC(C)C)cc3)ccn12 ZINC001533312700 1059859300 /nfs/dbraw/zinc/85/93/00/1059859300.db2.gz ISIGVNBIOLLPJL-UHFFFAOYSA-N 1 2 307.397 4.094 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2Cl)on1)c1ccns1 ZINC001560047521 1059862406 /nfs/dbraw/zinc/86/24/06/1059862406.db2.gz LFBRCQUYUAEIAE-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@H+](Cc1cc(C)cc(C)c1)C3 ZINC001560104672 1059909885 /nfs/dbraw/zinc/90/98/85/1059909885.db2.gz BLVXKIJPMWIOQM-UHFFFAOYSA-N 1 2 320.436 4.352 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@@H+](Cc1cc(C)cc(C)c1)C3 ZINC001560104672 1059909904 /nfs/dbraw/zinc/90/99/04/1059909904.db2.gz BLVXKIJPMWIOQM-UHFFFAOYSA-N 1 2 320.436 4.352 20 0 DIADLO Cc1cc(Br)c(C[NH+]2CCC(F)CC2)cc1Cl ZINC001560105254 1059910997 /nfs/dbraw/zinc/91/09/97/1059910997.db2.gz WYEMHZACJPAGFV-UHFFFAOYSA-N 1 2 320.633 4.345 20 0 DIADLO CCCO[C@@H]1CC[N@H+](Cc2ccc(Cl)c(Cl)c2OC)C1 ZINC001248637701 1059922529 /nfs/dbraw/zinc/92/25/29/1059922529.db2.gz WNQPVAQOPZXRTP-GFCCVEGCSA-N 1 2 318.244 4.003 20 0 DIADLO CCCO[C@@H]1CC[N@@H+](Cc2ccc(Cl)c(Cl)c2OC)C1 ZINC001248637701 1059922551 /nfs/dbraw/zinc/92/25/51/1059922551.db2.gz WNQPVAQOPZXRTP-GFCCVEGCSA-N 1 2 318.244 4.003 20 0 DIADLO COc1c(C[N@@H+]2CCC(F)(F)[C@H](C)C2)ccc(Cl)c1Cl ZINC001248628055 1059918762 /nfs/dbraw/zinc/91/87/62/1059918762.db2.gz KMOOHDDTLSDSOL-SECBINFHSA-N 1 2 324.198 4.479 20 0 DIADLO COc1c(C[N@H+]2CCC(F)(F)[C@H](C)C2)ccc(Cl)c1Cl ZINC001248628055 1059918791 /nfs/dbraw/zinc/91/87/91/1059918791.db2.gz KMOOHDDTLSDSOL-SECBINFHSA-N 1 2 324.198 4.479 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2ccc3ccccc3c2)c(C)[nH+]1 ZINC001533519926 1059919208 /nfs/dbraw/zinc/91/92/08/1059919208.db2.gz LPUTWMRMOZPCEG-UHFFFAOYSA-N 1 2 304.393 4.090 20 0 DIADLO COC[C@H]1CCCC[N@@H+]1Cc1ccc(Cl)c(Cl)c1OC ZINC001248628534 1059919074 /nfs/dbraw/zinc/91/90/74/1059919074.db2.gz QAWGBEZFOKZNNM-GFCCVEGCSA-N 1 2 318.244 4.003 20 0 DIADLO COC[C@H]1CCCC[N@H+]1Cc1ccc(Cl)c(Cl)c1OC ZINC001248628534 1059919094 /nfs/dbraw/zinc/91/90/94/1059919094.db2.gz QAWGBEZFOKZNNM-GFCCVEGCSA-N 1 2 318.244 4.003 20 0 DIADLO C/C(=C/c1ccc(C)cc1)C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001525571545 1059942081 /nfs/dbraw/zinc/94/20/81/1059942081.db2.gz IFKWGXIDHWUAGZ-VBKFSLOCSA-N 1 2 317.392 4.223 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@H+]1Cc2c[nH]nc2C[C@@H](C)C1 ZINC001560143438 1059942939 /nfs/dbraw/zinc/94/29/39/1059942939.db2.gz BAIDKMZZUXKMOV-MNOVXSKESA-N 1 2 324.255 4.472 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@@H+]1Cc2c[nH]nc2C[C@@H](C)C1 ZINC001560143438 1059942961 /nfs/dbraw/zinc/94/29/61/1059942961.db2.gz BAIDKMZZUXKMOV-MNOVXSKESA-N 1 2 324.255 4.472 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@H+]1Cc2c[nH]nc2C[C@H](C)C1 ZINC001560143439 1059943246 /nfs/dbraw/zinc/94/32/46/1059943246.db2.gz BAIDKMZZUXKMOV-QWRGUYRKSA-N 1 2 324.255 4.472 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@@H+]1Cc2c[nH]nc2C[C@H](C)C1 ZINC001560143439 1059943259 /nfs/dbraw/zinc/94/32/59/1059943259.db2.gz BAIDKMZZUXKMOV-QWRGUYRKSA-N 1 2 324.255 4.472 20 0 DIADLO CCc1cccc(C)c1NC(=S)Nc1cccc2[nH+]ccn21 ZINC001248711660 1059948341 /nfs/dbraw/zinc/94/83/41/1059948341.db2.gz CHSWKYVUNHCMBT-UHFFFAOYSA-N 1 2 310.426 4.014 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1ccc(OC)c(OC)c1F ZINC001248756746 1059970422 /nfs/dbraw/zinc/97/04/22/1059970422.db2.gz VUUAOMSOVATROS-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1ccc(OC)c(OC)c1F ZINC001248756746 1059970449 /nfs/dbraw/zinc/97/04/49/1059970449.db2.gz VUUAOMSOVATROS-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)c(OC)c1Cl ZINC001248799565 1059978487 /nfs/dbraw/zinc/97/84/87/1059978487.db2.gz JMKLUFHDUQADCZ-HNNXBMFYSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(C[N@H+]2CC[C@H]2c2ccccc2)c(OC)c1Cl ZINC001248799565 1059978507 /nfs/dbraw/zinc/97/85/07/1059978507.db2.gz JMKLUFHDUQADCZ-HNNXBMFYSA-N 1 2 317.816 4.304 20 0 DIADLO COc1nccc(Cl)c1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001248792086 1059979214 /nfs/dbraw/zinc/97/92/14/1059979214.db2.gz FMBIESSOXHRVEY-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(Cl)c1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001248792086 1059979236 /nfs/dbraw/zinc/97/92/36/1059979236.db2.gz FMBIESSOXHRVEY-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@](C)(F)C2)c(OC)c1Cl ZINC001248796762 1059981646 /nfs/dbraw/zinc/98/16/46/1059981646.db2.gz GTCHXOFBCKYMMA-INIZCTEOSA-N 1 2 315.816 4.071 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@](C)(F)C2)c(OC)c1Cl ZINC001248796762 1059981663 /nfs/dbraw/zinc/98/16/63/1059981663.db2.gz GTCHXOFBCKYMMA-INIZCTEOSA-N 1 2 315.816 4.071 20 0 DIADLO COc1nccc(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001248792087 1059981770 /nfs/dbraw/zinc/98/17/70/1059981770.db2.gz FMBIESSOXHRVEY-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(Cl)c1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001248792087 1059981788 /nfs/dbraw/zinc/98/17/88/1059981788.db2.gz FMBIESSOXHRVEY-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1cnc2ccccc2c1Cl ZINC001248810145 1059985452 /nfs/dbraw/zinc/98/54/52/1059985452.db2.gz ACNMFWFYRCHOCY-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1cnc2ccccc2c1Cl ZINC001248810145 1059985474 /nfs/dbraw/zinc/98/54/74/1059985474.db2.gz ACNMFWFYRCHOCY-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO C[N@H+](Cc1cccc(O)c1)Cc1cnc2ccccc2c1Cl ZINC001248810719 1059987381 /nfs/dbraw/zinc/98/73/81/1059987381.db2.gz WHOPILCZRDKNIU-UHFFFAOYSA-N 1 2 312.800 4.226 20 0 DIADLO C[N@@H+](Cc1cccc(O)c1)Cc1cnc2ccccc2c1Cl ZINC001248810719 1059987405 /nfs/dbraw/zinc/98/74/05/1059987405.db2.gz WHOPILCZRDKNIU-UHFFFAOYSA-N 1 2 312.800 4.226 20 0 DIADLO FC1(F)CC2(C[NH+](Cc3cnc4ccccc4c3Cl)C2)C1 ZINC001248810187 1059987939 /nfs/dbraw/zinc/98/79/39/1059987939.db2.gz BSFDNWJPCCAEOC-UHFFFAOYSA-N 1 2 308.759 4.119 20 0 DIADLO Clc1cc(-c2ccccc2)ccc1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001248820564 1060005587 /nfs/dbraw/zinc/00/55/87/1060005587.db2.gz QTTZVNSKPAFIQK-QZTJIDSGSA-N 1 2 313.828 4.370 20 0 DIADLO Clc1cc(-c2ccccc2)ccc1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001248820564 1060005611 /nfs/dbraw/zinc/00/56/11/1060005611.db2.gz QTTZVNSKPAFIQK-QZTJIDSGSA-N 1 2 313.828 4.370 20 0 DIADLO Brc1c2ccccc2oc1CNc1cccc[nH+]1 ZINC001560278592 1060054756 /nfs/dbraw/zinc/05/47/56/1060054756.db2.gz LPVPGMVUXDJHGL-UHFFFAOYSA-N 1 2 303.159 4.202 20 0 DIADLO CCC1(CC)C[C@@H]1c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001248946547 1060073920 /nfs/dbraw/zinc/07/39/20/1060073920.db2.gz CXUQZSMXJQFOCC-CQSZACIVSA-N 1 2 308.385 4.216 20 0 DIADLO Oc1cc(Cl)cc(C[NH2+]Cc2c(F)cccc2Cl)c1 ZINC001560297952 1060082894 /nfs/dbraw/zinc/08/28/94/1060082894.db2.gz RPNNMXRNFVVSQK-UHFFFAOYSA-N 1 2 300.160 4.128 20 0 DIADLO Cc1ccc(F)cc1C[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC001560302647 1060089635 /nfs/dbraw/zinc/08/96/35/1060089635.db2.gz FZLFEPQBLJIHNC-QGZVFWFLSA-N 1 2 312.413 4.470 20 0 DIADLO CC(C)c1cccc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001533987519 1060098252 /nfs/dbraw/zinc/09/82/52/1060098252.db2.gz ABUHYQIMSBDPIP-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO Cc1ccc(-c2noc([C@@H]([NH3+])c3ccc(Cl)cc3)n2)cc1C ZINC001248998390 1060106905 /nfs/dbraw/zinc/10/69/05/1060106905.db2.gz XTCRKHLQUSKYGK-HNNXBMFYSA-N 1 2 313.788 4.055 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(C)c(C)nc2Cl)cn1 ZINC001249029826 1060120232 /nfs/dbraw/zinc/12/02/32/1060120232.db2.gz YTJVJDWVZDLGSR-QGZVFWFLSA-N 1 2 315.848 4.392 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc(C)c(C)nc2Cl)cn1 ZINC001249029826 1060120248 /nfs/dbraw/zinc/12/02/48/1060120248.db2.gz YTJVJDWVZDLGSR-QGZVFWFLSA-N 1 2 315.848 4.392 20 0 DIADLO C[C@H]1Cc2cc(CNc3ccc4c(c3)CCC[N@H+]4C)ccc2O1 ZINC001560389732 1060176341 /nfs/dbraw/zinc/17/63/41/1060176341.db2.gz LFPLKRBUGYGPFQ-AWEZNQCLSA-N 1 2 308.425 4.005 20 0 DIADLO C[C@H]1Cc2cc(CNc3ccc4c(c3)CCC[N@@H+]4C)ccc2O1 ZINC001560389732 1060176351 /nfs/dbraw/zinc/17/63/51/1060176351.db2.gz LFPLKRBUGYGPFQ-AWEZNQCLSA-N 1 2 308.425 4.005 20 0 DIADLO Cc1nn(-c2cccc(C)c2)cc1CNc1ccc([NH+](C)C)cc1 ZINC001560390759 1060176505 /nfs/dbraw/zinc/17/65/05/1060176505.db2.gz BPDIVVVWSKAAEN-UHFFFAOYSA-N 1 2 320.440 4.167 20 0 DIADLO COc1cc(CNc2cccc(-n3cc[nH+]c3)c2)ccc1Cl ZINC001560391560 1060177089 /nfs/dbraw/zinc/17/70/89/1060177089.db2.gz HZAQDRMORSWSDZ-UHFFFAOYSA-N 1 2 313.788 4.146 20 0 DIADLO FC(F)(F)CCc1ccccc1NCc1cccc2[nH+]ccn21 ZINC001560395690 1060180250 /nfs/dbraw/zinc/18/02/50/1060180250.db2.gz XUGUOFFTLBQJBM-UHFFFAOYSA-N 1 2 319.330 4.441 20 0 DIADLO CCc1cc(OC)ccc1CNc1ccc(N(CC)CC)[nH+]c1 ZINC001560407030 1060193237 /nfs/dbraw/zinc/19/32/37/1060193237.db2.gz BFRDVXMNXBBMNT-UHFFFAOYSA-N 1 2 313.445 4.111 20 0 DIADLO CC[C@@H](C)n1nc(NCc2cc(C)[nH+]c3c2CCCC3)cc1C ZINC001560415718 1060199628 /nfs/dbraw/zinc/19/96/28/1060199628.db2.gz YFDBCIZEXBUHQQ-CQSZACIVSA-N 1 2 312.461 4.357 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2cccc(C)c2)c2ccccn2)sn1 ZINC001560427603 1060215302 /nfs/dbraw/zinc/21/53/02/1060215302.db2.gz IACVTYGUPPDLLJ-SFHVURJKSA-N 1 2 309.438 4.034 20 0 DIADLO CCCC[C@@](C)(F)C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC001526422842 1060217891 /nfs/dbraw/zinc/21/78/91/1060217891.db2.gz DXYPMGKBBYREOJ-GOSISDBHSA-N 1 2 317.408 4.158 20 0 DIADLO [NH3+][C@H](c1nc(-c2ccccc2F)no1)c1ccc2ccccc2c1 ZINC001249325637 1060220150 /nfs/dbraw/zinc/22/01/50/1060220150.db2.gz SKKFYNNSBLCVPX-KRWDZBQOSA-N 1 2 319.339 4.077 20 0 DIADLO Cc1cccc(-c2noc([C@H]([NH3+])c3ccc4ccccc4c3)n2)c1 ZINC001249325523 1060220209 /nfs/dbraw/zinc/22/02/09/1060220209.db2.gz NQSJPCUIHJQNCR-GOSISDBHSA-N 1 2 315.376 4.246 20 0 DIADLO CCOc1ccc(NCc2cc(C)[nH+]c(C)c2)c2ncccc12 ZINC001560431913 1060220238 /nfs/dbraw/zinc/22/02/38/1060220238.db2.gz JJSSWUZLHXGADJ-UHFFFAOYSA-N 1 2 307.397 4.257 20 0 DIADLO [NH3+][C@H](c1nc(-c2cccc(F)c2)no1)c1ccc2ccccc2c1 ZINC001249325631 1060220494 /nfs/dbraw/zinc/22/04/94/1060220494.db2.gz RYXRBMAPUUIDRJ-KRWDZBQOSA-N 1 2 319.339 4.077 20 0 DIADLO CC(C)(C)OC(=O)Nc1cccc(F)c1C[NH+]1CC2(CCC2)C1 ZINC001249382798 1060231472 /nfs/dbraw/zinc/23/14/72/1060231472.db2.gz DCNFNEYEFBVXSP-UHFFFAOYSA-N 1 2 320.408 4.159 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1cnc(C)cc1C(F)(F)F)CC2 ZINC001249512726 1060269331 /nfs/dbraw/zinc/26/93/31/1060269331.db2.gz ZJIQGRWQHQEIOG-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1cnc(C)cc1C(F)(F)F)CC2 ZINC001249512726 1060269351 /nfs/dbraw/zinc/26/93/51/1060269351.db2.gz ZJIQGRWQHQEIOG-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1cc(F)cc2cc[nH]c21 ZINC001249522005 1060274200 /nfs/dbraw/zinc/27/42/00/1060274200.db2.gz KROOGXOXHYCNCZ-UHFFFAOYSA-N 1 2 309.797 4.049 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1cc(F)cc2cc[nH]c21 ZINC001249522005 1060274213 /nfs/dbraw/zinc/27/42/13/1060274213.db2.gz KROOGXOXHYCNCZ-UHFFFAOYSA-N 1 2 309.797 4.049 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(C)c3ccccc23)c(N(C)C)[nH+]1 ZINC001526674299 1060297454 /nfs/dbraw/zinc/29/74/54/1060297454.db2.gz GLYOKURDKUWQJY-UHFFFAOYSA-N 1 2 319.408 4.170 20 0 DIADLO COc1cccc([C@@H]2CCCC[N@@H+]2Cc2cc(C)sn2)c1 ZINC001249581517 1060299717 /nfs/dbraw/zinc/29/97/17/1060299717.db2.gz KOONIGGJUBHTFG-KRWDZBQOSA-N 1 2 302.443 4.187 20 0 DIADLO COc1cccc([C@@H]2CCCC[N@H+]2Cc2cc(C)sn2)c1 ZINC001249581517 1060299736 /nfs/dbraw/zinc/29/97/36/1060299736.db2.gz KOONIGGJUBHTFG-KRWDZBQOSA-N 1 2 302.443 4.187 20 0 DIADLO FC(F)(F)c1c[nH+]ccc1Nc1ncccc1-c1ccccc1 ZINC001249584331 1060303375 /nfs/dbraw/zinc/30/33/75/1060303375.db2.gz FYAVNGNOKQXNCO-UHFFFAOYSA-N 1 2 315.298 4.328 20 0 DIADLO Cc1cc(C[NH+]2CCC(c3ccc(F)cc3F)CC2)ns1 ZINC001249590006 1060306496 /nfs/dbraw/zinc/30/64/96/1060306496.db2.gz GQJGWOXFPIDCEG-UHFFFAOYSA-N 1 2 308.397 4.109 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C)c2ccccc2Cl)c(C)[nH+]1 ZINC001526772418 1060330737 /nfs/dbraw/zinc/33/07/37/1060330737.db2.gz XEXBRDUGOJZBNM-LBPRGKRZSA-N 1 2 302.805 4.151 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1cc(Cl)cc2ccccc21 ZINC001534712134 1060346114 /nfs/dbraw/zinc/34/61/14/1060346114.db2.gz FDTAFGYACOREJL-UHFFFAOYSA-N 1 2 310.784 4.179 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1cc2c(cccc2Cl)s1 ZINC001534712815 1060346708 /nfs/dbraw/zinc/34/67/08/1060346708.db2.gz PMUXPLVBVAPMCH-UHFFFAOYSA-N 1 2 316.813 4.241 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cccc2cccnc21 ZINC001560568532 1060377168 /nfs/dbraw/zinc/37/71/68/1060377168.db2.gz QTLMHSNLDYTNCF-UHFFFAOYSA-N 1 2 309.438 4.495 20 0 DIADLO COc1ccc(CNc2[nH+]c3ccccc3n2C(C)(C)C)cc1 ZINC001560574475 1060386760 /nfs/dbraw/zinc/38/67/60/1060386760.db2.gz GBTUWDFSRMDHKH-UHFFFAOYSA-N 1 2 309.413 4.412 20 0 DIADLO CCOCCCn1c2ccccc2[nH+]c1NCc1ccccc1C ZINC001560574431 1060388280 /nfs/dbraw/zinc/38/82/80/1060388280.db2.gz CIUZHYXVOYHIRT-UHFFFAOYSA-N 1 2 323.440 4.383 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1ccncc1Cl ZINC001560574370 1060389026 /nfs/dbraw/zinc/38/90/26/1060389026.db2.gz RNMBDNPCGKSEAG-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO CC(C)Oc1cc(F)c(Nc2cccc3[nH+]ccn32)c(F)c1 ZINC001249772496 1060390943 /nfs/dbraw/zinc/39/09/43/1060390943.db2.gz LPPGNFTZMSGSBY-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO Cc1cn2cccc(Nc3c(F)cc(OC(C)C)cc3F)c2[nH+]1 ZINC001249774299 1060391906 /nfs/dbraw/zinc/39/19/06/1060391906.db2.gz YGWLDRKTPQEVRB-UHFFFAOYSA-N 1 2 317.339 4.452 20 0 DIADLO Cc1cc(CNc2[nH+]c3ccccc3n2CC2CC2)cc(C)n1 ZINC001560595436 1060407734 /nfs/dbraw/zinc/40/77/34/1060407734.db2.gz AYSQWLWRFPBZSF-UHFFFAOYSA-N 1 2 306.413 4.070 20 0 DIADLO Fc1ccc2[nH]c(Nc3ccc(Cn4cc[nH+]c4)cc3)cc2c1 ZINC001249855093 1060423106 /nfs/dbraw/zinc/42/31/06/1060423106.db2.gz YBXFIWFXDQQZPK-UHFFFAOYSA-N 1 2 306.344 4.295 20 0 DIADLO CC[N@H+](Cc1c(Br)cc(F)c(C)c1F)C1CC1 ZINC001249865177 1060432016 /nfs/dbraw/zinc/43/20/16/1060432016.db2.gz VLDDXDUBHKHOQM-UHFFFAOYSA-N 1 2 304.178 4.020 20 0 DIADLO CC[N@@H+](Cc1c(Br)cc(F)c(C)c1F)C1CC1 ZINC001249865177 1060432024 /nfs/dbraw/zinc/43/20/24/1060432024.db2.gz VLDDXDUBHKHOQM-UHFFFAOYSA-N 1 2 304.178 4.020 20 0 DIADLO Fc1ccc2cc(Nc3ccc[nH+]c3N3CCCCC3)[nH]c2c1 ZINC001249874664 1060437334 /nfs/dbraw/zinc/43/73/34/1060437334.db2.gz RKQKTVHFNDYDLQ-UHFFFAOYSA-N 1 2 310.376 4.436 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@H]2CCC[C@H]2c2ccccc2)c(C)[nH+]1 ZINC001527119011 1060439758 /nfs/dbraw/zinc/43/97/58/1060439758.db2.gz UXRKPBPZQWPBQR-MOPGFXCFSA-N 1 2 322.452 4.321 20 0 DIADLO Fc1ccc2cc(Nc3ccc(Cn4cc[nH+]c4)cc3)[nH]c2c1 ZINC001249878407 1060440185 /nfs/dbraw/zinc/44/01/85/1060440185.db2.gz AWBOVNZRIYIXLN-UHFFFAOYSA-N 1 2 306.344 4.295 20 0 DIADLO COc1ccc2[nH]c(Nc3ccc[nH+]c3N3CCCCC3)cc2c1 ZINC001249879801 1060443039 /nfs/dbraw/zinc/44/30/39/1060443039.db2.gz BAVBVDURFCNRSR-UHFFFAOYSA-N 1 2 322.412 4.305 20 0 DIADLO COc1ccc2[nH]c(Nc3cccc(-n4cc[nH+]c4)c3)cc2c1 ZINC001249884401 1060444631 /nfs/dbraw/zinc/44/46/31/1060444631.db2.gz ZBANVIISRCKSTI-UHFFFAOYSA-N 1 2 304.353 4.106 20 0 DIADLO COc1ccc2[nH]c(Nc3cc(OC(F)(F)F)cc[nH+]3)cc2c1 ZINC001249884325 1060445013 /nfs/dbraw/zinc/44/50/13/1060445013.db2.gz WANBXIWONFRQNW-UHFFFAOYSA-N 1 2 323.274 4.214 20 0 DIADLO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001560635717 1060448246 /nfs/dbraw/zinc/44/82/46/1060448246.db2.gz LKGJKXHFQBJHRT-CHWSQXEVSA-N 1 2 317.260 4.024 20 0 DIADLO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001560635717 1060448251 /nfs/dbraw/zinc/44/82/51/1060448251.db2.gz LKGJKXHFQBJHRT-CHWSQXEVSA-N 1 2 317.260 4.024 20 0 DIADLO COc1ccc2[nH]c(Nc3cccc(Cn4cc[nH+]c4)c3)cc2c1 ZINC001249885190 1060448276 /nfs/dbraw/zinc/44/82/76/1060448276.db2.gz JGAGAAAURSTXHF-UHFFFAOYSA-N 1 2 318.380 4.165 20 0 DIADLO CCOc1cncc(C[N@H+](CC)Cc2ccccc2Cl)c1 ZINC001560639310 1060455053 /nfs/dbraw/zinc/45/50/53/1060455053.db2.gz TUJPHDZHECLPFQ-UHFFFAOYSA-N 1 2 304.821 4.156 20 0 DIADLO CCOc1cncc(C[N@@H+](CC)Cc2ccccc2Cl)c1 ZINC001560639310 1060455066 /nfs/dbraw/zinc/45/50/66/1060455066.db2.gz TUJPHDZHECLPFQ-UHFFFAOYSA-N 1 2 304.821 4.156 20 0 DIADLO CC[N@H+](Cc1ccc(C)c(OC)n1)Cc1ccccc1Cl ZINC001560639317 1060455738 /nfs/dbraw/zinc/45/57/38/1060455738.db2.gz TXYGEGKIGFQELJ-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CC[N@@H+](Cc1ccc(C)c(OC)n1)Cc1ccccc1Cl ZINC001560639317 1060455744 /nfs/dbraw/zinc/45/57/44/1060455744.db2.gz TXYGEGKIGFQELJ-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CNc1cc(CC(=O)c2ccc(-c3ccccc3)cc2)cc[nH+]1 ZINC001249908478 1060474342 /nfs/dbraw/zinc/47/43/42/1060474342.db2.gz UYWCAUGOIWHAEY-UHFFFAOYSA-N 1 2 302.377 4.216 20 0 DIADLO Fc1ccccc1[C@H]1C[N@H+](Cc2ccc(C3CC3)cc2)CCO1 ZINC001560659280 1060483830 /nfs/dbraw/zinc/48/38/30/1060483830.db2.gz CKUBISDYBVTQJK-HXUWFJFHSA-N 1 2 311.400 4.277 20 0 DIADLO Fc1ccccc1[C@H]1C[N@@H+](Cc2ccc(C3CC3)cc2)CCO1 ZINC001560659280 1060483843 /nfs/dbraw/zinc/48/38/43/1060483843.db2.gz CKUBISDYBVTQJK-HXUWFJFHSA-N 1 2 311.400 4.277 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)cnc1Cl ZINC001249926146 1060486779 /nfs/dbraw/zinc/48/67/79/1060486779.db2.gz AYKMBNOVNRNGOP-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2F)cnc1Cl ZINC001249926146 1060486791 /nfs/dbraw/zinc/48/67/91/1060486791.db2.gz AYKMBNOVNRNGOP-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO C[N@H+](Cc1cc2ccccc2o1)Cc1c(Cl)n[nH]c1C1CC1 ZINC001560662342 1060490427 /nfs/dbraw/zinc/49/04/27/1060490427.db2.gz WWNNSRLOKUQMGB-UHFFFAOYSA-N 1 2 315.804 4.319 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2o1)Cc1c(Cl)n[nH]c1C1CC1 ZINC001560662342 1060490438 /nfs/dbraw/zinc/49/04/38/1060490438.db2.gz WWNNSRLOKUQMGB-UHFFFAOYSA-N 1 2 315.804 4.319 20 0 DIADLO Cc1ccc(C[N@@H+](CC(=O)OC(C)(C)C)C(C)C)cc1Cl ZINC001560662403 1060490973 /nfs/dbraw/zinc/49/09/73/1060490973.db2.gz YCIQAQZILHMIFE-UHFFFAOYSA-N 1 2 311.853 4.201 20 0 DIADLO Cc1ccc(C[N@H+](CC(=O)OC(C)(C)C)C(C)C)cc1Cl ZINC001560662403 1060490978 /nfs/dbraw/zinc/49/09/78/1060490978.db2.gz YCIQAQZILHMIFE-UHFFFAOYSA-N 1 2 311.853 4.201 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[NH+]1CCC2(CCCO2)CC1 ZINC001249945736 1060499042 /nfs/dbraw/zinc/49/90/42/1060499042.db2.gz OLWULEKMEMHYDM-UHFFFAOYSA-N 1 2 318.219 4.278 20 0 DIADLO Cc1cn2cc(NC(=O)[C@H](C)CCCc3ccccc3)ccc2[nH+]1 ZINC001527356804 1060499202 /nfs/dbraw/zinc/49/92/02/1060499202.db2.gz SHVQLUPXCGUNQB-OAHLLOKOSA-N 1 2 321.424 4.240 20 0 DIADLO COc1cc(C[NH+]2Cc3ccccc3C2)ccc1OC(F)(F)F ZINC001249978699 1060515018 /nfs/dbraw/zinc/51/50/18/1060515018.db2.gz QTLAFQSKTWUWBH-UHFFFAOYSA-N 1 2 323.314 4.110 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1ncc(C(C)(C)C)s1)C2 ZINC001560684283 1060528768 /nfs/dbraw/zinc/52/87/68/1060528768.db2.gz FWLGQMXYLBVGMY-UHFFFAOYSA-N 1 2 300.471 4.307 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1ncc(C(C)(C)C)s1)C2 ZINC001560684283 1060528788 /nfs/dbraw/zinc/52/87/88/1060528788.db2.gz FWLGQMXYLBVGMY-UHFFFAOYSA-N 1 2 300.471 4.307 20 0 DIADLO Cc1[nH]nc(C[N@@H+]2CCC[C@@H](CCCc3ccccc3)C2)c1C ZINC001560688988 1060535496 /nfs/dbraw/zinc/53/54/96/1060535496.db2.gz ABLVNXDPFHHLRX-LJQANCHMSA-N 1 2 311.473 4.261 20 0 DIADLO Cc1[nH]nc(C[N@H+]2CCC[C@@H](CCCc3ccccc3)C2)c1C ZINC001560688988 1060535519 /nfs/dbraw/zinc/53/55/19/1060535519.db2.gz ABLVNXDPFHHLRX-LJQANCHMSA-N 1 2 311.473 4.261 20 0 DIADLO CCCc1cccc(CN2CC[NH+](Cc3ccsc3)CC2)c1 ZINC001560715044 1060573902 /nfs/dbraw/zinc/57/39/02/1060573902.db2.gz MOPCPJXDKDOUNW-UHFFFAOYSA-N 1 2 314.498 4.018 20 0 DIADLO CCOc1cc(OC)ccc1C[N@H+](C)Cc1ccc(F)cc1F ZINC001250064876 1060578258 /nfs/dbraw/zinc/57/82/58/1060578258.db2.gz OUGVZRPQCFUWRV-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CCOc1cc(OC)ccc1C[N@@H+](C)Cc1ccc(F)cc1F ZINC001250064876 1060578271 /nfs/dbraw/zinc/57/82/71/1060578271.db2.gz OUGVZRPQCFUWRV-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1CCCc1c(Cl)cccc1Cl ZINC001560726715 1060587645 /nfs/dbraw/zinc/58/76/45/1060587645.db2.gz BIFQQYJUIDJRMR-CHWSQXEVSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@H+]1CCCc1c(Cl)cccc1Cl ZINC001560726715 1060587660 /nfs/dbraw/zinc/58/76/60/1060587660.db2.gz BIFQQYJUIDJRMR-CHWSQXEVSA-N 1 2 316.272 4.425 20 0 DIADLO COc1cnc(F)c(C[N@H+](C)Cc2ccc(C(C)(C)C)cc2)c1 ZINC001560725149 1060588008 /nfs/dbraw/zinc/58/80/08/1060588008.db2.gz NFCXWPXHSVSWQI-UHFFFAOYSA-N 1 2 316.420 4.159 20 0 DIADLO COc1cnc(F)c(C[N@@H+](C)Cc2ccc(C(C)(C)C)cc2)c1 ZINC001560725149 1060588024 /nfs/dbraw/zinc/58/80/24/1060588024.db2.gz NFCXWPXHSVSWQI-UHFFFAOYSA-N 1 2 316.420 4.159 20 0 DIADLO CCc1cccc(Nc2ccc(OC(F)(F)F)c(OC)c2)[nH+]1 ZINC001250079771 1060592032 /nfs/dbraw/zinc/59/20/32/1060592032.db2.gz SELMDKHKRDMVGT-UHFFFAOYSA-N 1 2 312.291 4.295 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@H+](Cc3nccn3C3CC3)CC2)c1 ZINC001560746551 1060612938 /nfs/dbraw/zinc/61/29/38/1060612938.db2.gz FGLJIVUBELXVMS-UHFFFAOYSA-N 1 2 307.441 4.124 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@@H+](Cc3nccn3C3CC3)CC2)c1 ZINC001560746551 1060612947 /nfs/dbraw/zinc/61/29/47/1060612947.db2.gz FGLJIVUBELXVMS-UHFFFAOYSA-N 1 2 307.441 4.124 20 0 DIADLO COC(=O)[C@@H](CC1CCCCC1)[NH2+]CC[C@H](C)c1ccccc1 ZINC001560756082 1060622348 /nfs/dbraw/zinc/62/23/48/1060622348.db2.gz AADNOONHCWXVFO-QFBILLFUSA-N 1 2 317.473 4.282 20 0 DIADLO Cc1ccccc1C[N@@H+]1CCO[C@@H](c2ccc(F)cc2Cl)C1 ZINC001560766674 1060632105 /nfs/dbraw/zinc/63/21/05/1060632105.db2.gz WMIQNHSGVUYMKA-GOSISDBHSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1ccccc1C[N@H+]1CCO[C@@H](c2ccc(F)cc2Cl)C1 ZINC001560766674 1060632116 /nfs/dbraw/zinc/63/21/16/1060632116.db2.gz WMIQNHSGVUYMKA-GOSISDBHSA-N 1 2 319.807 4.361 20 0 DIADLO CCOc1cc(C)ccc1C[N@@H+]1CCC[C@@H]1c1cc(C)on1 ZINC001250171497 1060656608 /nfs/dbraw/zinc/65/66/08/1060656608.db2.gz OWGJVDCGKPGXIL-QGZVFWFLSA-N 1 2 300.402 4.027 20 0 DIADLO CCOc1cc(C)ccc1C[N@H+]1CCC[C@@H]1c1cc(C)on1 ZINC001250171497 1060656623 /nfs/dbraw/zinc/65/66/23/1060656623.db2.gz OWGJVDCGKPGXIL-QGZVFWFLSA-N 1 2 300.402 4.027 20 0 DIADLO CCOc1cc(C)ccc1C[N@@H+]1CCC[C@H]1c1cc(C)on1 ZINC001250171496 1060657474 /nfs/dbraw/zinc/65/74/74/1060657474.db2.gz OWGJVDCGKPGXIL-KRWDZBQOSA-N 1 2 300.402 4.027 20 0 DIADLO CCOc1cc(C)ccc1C[N@H+]1CCC[C@H]1c1cc(C)on1 ZINC001250171496 1060657480 /nfs/dbraw/zinc/65/74/80/1060657480.db2.gz OWGJVDCGKPGXIL-KRWDZBQOSA-N 1 2 300.402 4.027 20 0 DIADLO CCC[C@H](Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)[nH+]c1)C1CCC1 ZINC001560798841 1060657695 /nfs/dbraw/zinc/65/76/95/1060657695.db2.gz QKKSJMFZJNRPAK-MPGHIAIKSA-N 1 2 317.477 4.076 20 0 DIADLO CCC[C@H](Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)[nH+]c1)C1CCC1 ZINC001560798842 1060657830 /nfs/dbraw/zinc/65/78/30/1060657830.db2.gz QKKSJMFZJNRPAK-RKVPGOIHSA-N 1 2 317.477 4.076 20 0 DIADLO CCCC[C@H](CC)Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001560798288 1060657956 /nfs/dbraw/zinc/65/79/56/1060657956.db2.gz CGNNQJBUQXRRQG-XHSDSOJGSA-N 1 2 305.466 4.076 20 0 DIADLO COc1c(F)c(Cl)ccc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001250190841 1060668483 /nfs/dbraw/zinc/66/84/83/1060668483.db2.gz DMPARUZXTXGRTM-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO FC(F)(F)Oc1ccc(Cc2ccc[nH+]c2N2CCCC2)cc1 ZINC001250199387 1060677480 /nfs/dbraw/zinc/67/74/80/1060677480.db2.gz QFTZKVHLYDZMEE-UHFFFAOYSA-N 1 2 322.330 4.171 20 0 DIADLO CC(C)(C)OC1CC([NH2+]CC(F)(F)c2ccc(Cl)cc2)C1 ZINC001560821271 1060679673 /nfs/dbraw/zinc/67/96/73/1060679673.db2.gz PLXQHLPCBXGCSX-UHFFFAOYSA-N 1 2 317.807 4.368 20 0 DIADLO Cc1ccc(C[N@H+](C)CC(=O)c2ccccc2)c(C)c1Cl ZINC001250205108 1060684037 /nfs/dbraw/zinc/68/40/37/1060684037.db2.gz ZRKPLJULKLAVAD-UHFFFAOYSA-N 1 2 301.817 4.272 20 0 DIADLO Cc1ccc(C[N@@H+](C)CC(=O)c2ccccc2)c(C)c1Cl ZINC001250205108 1060684042 /nfs/dbraw/zinc/68/40/42/1060684042.db2.gz ZRKPLJULKLAVAD-UHFFFAOYSA-N 1 2 301.817 4.272 20 0 DIADLO CCOc1c(F)cc(Nc2cccn3cc[nH+]c23)cc1Cl ZINC001250219134 1060699058 /nfs/dbraw/zinc/69/90/58/1060699058.db2.gz AYKVRSYETLSOIE-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO Fc1cccc(C(F)(F)F)c1Cc1ccc[nH+]c1N1CCCC1 ZINC001250229857 1060707955 /nfs/dbraw/zinc/70/79/55/1060707955.db2.gz JNZQEQOSYNGAJF-UHFFFAOYSA-N 1 2 324.321 4.431 20 0 DIADLO Oc1cccc2sc(C[NH2+]CC(F)(F)c3ccccc3)cc21 ZINC001560870773 1060729285 /nfs/dbraw/zinc/72/92/85/1060729285.db2.gz PNEJYETTXRXZLH-UHFFFAOYSA-N 1 2 319.376 4.489 20 0 DIADLO COc1cc(OC)c(C[N@@H+]2CCc3sccc3[C@@H]2C)cc1F ZINC001560870522 1060731478 /nfs/dbraw/zinc/73/14/78/1060731478.db2.gz IRFFUSRRWLXPJA-NSHDSACASA-N 1 2 321.417 4.024 20 0 DIADLO COc1cc(OC)c(C[N@H+]2CCc3sccc3[C@@H]2C)cc1F ZINC001560870522 1060731495 /nfs/dbraw/zinc/73/14/95/1060731495.db2.gz IRFFUSRRWLXPJA-NSHDSACASA-N 1 2 321.417 4.024 20 0 DIADLO Fc1ccc(C2C[NH+](Cc3nc4ccc(F)cc4s3)C2)cc1 ZINC001560874916 1060736071 /nfs/dbraw/zinc/73/60/71/1060736071.db2.gz SDNUAMJBRPAYOR-UHFFFAOYSA-N 1 2 316.376 4.174 20 0 DIADLO Cc1scc(C[N@@H+]([C@@H](C)C(=O)OC(C)(C)C)C2CC2)c1C ZINC001560881613 1060744148 /nfs/dbraw/zinc/74/41/48/1060744148.db2.gz OBTLCWMBCAKUNP-LBPRGKRZSA-N 1 2 309.475 4.060 20 0 DIADLO Cc1scc(C[N@H+]([C@@H](C)C(=O)OC(C)(C)C)C2CC2)c1C ZINC001560881613 1060744160 /nfs/dbraw/zinc/74/41/60/1060744160.db2.gz OBTLCWMBCAKUNP-LBPRGKRZSA-N 1 2 309.475 4.060 20 0 DIADLO COC(=O)[C@H](CC(C)(C)C)[NH2+]CCc1ccc(C(C)(C)C)cc1 ZINC001560901874 1060764107 /nfs/dbraw/zinc/76/41/07/1060764107.db2.gz GYJMDTWCFXLTPL-KRWDZBQOSA-N 1 2 319.489 4.094 20 0 DIADLO COc1ccc(F)c(Nc2cccc(-n3cc[nH+]c3)c2)c1Cl ZINC001250306589 1060771334 /nfs/dbraw/zinc/77/13/34/1060771334.db2.gz QCULAMYDVPKMGF-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO Cc1cc(CCn2cc[nH+]c2)cc(C)c1OCc1ccccc1 ZINC001250316350 1060775847 /nfs/dbraw/zinc/77/58/47/1060775847.db2.gz KJYCDNRNAYYGMU-UHFFFAOYSA-N 1 2 306.409 4.322 20 0 DIADLO Clc1cccc(COc2ccccc2CCn2cc[nH+]c2)c1 ZINC001250320481 1060777610 /nfs/dbraw/zinc/77/76/10/1060777610.db2.gz MMZJYNHVADLUKQ-UHFFFAOYSA-N 1 2 312.800 4.358 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+](C)[C@H](C)CSc1ccccc1 ZINC001560919778 1060781784 /nfs/dbraw/zinc/78/17/84/1060781784.db2.gz MZTLOSYGSCSRKM-CYBMUJFWSA-N 1 2 323.893 4.169 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+](C)[C@H](C)CSc1ccccc1 ZINC001560919778 1060781796 /nfs/dbraw/zinc/78/17/96/1060781796.db2.gz MZTLOSYGSCSRKM-CYBMUJFWSA-N 1 2 323.893 4.169 20 0 DIADLO C[C@@H](CSc1ccccc1)[N@H+](C)Cc1ccc(O)c(F)c1F ZINC001560919579 1060783565 /nfs/dbraw/zinc/78/35/65/1060783565.db2.gz IGDOSVLDPJQLTK-LBPRGKRZSA-N 1 2 323.408 4.283 20 0 DIADLO C[C@@H](CSc1ccccc1)[N@@H+](C)Cc1ccc(O)c(F)c1F ZINC001560919579 1060783581 /nfs/dbraw/zinc/78/35/81/1060783581.db2.gz IGDOSVLDPJQLTK-LBPRGKRZSA-N 1 2 323.408 4.283 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CC[C@H](c2ccc(Cl)cc2)C1)C(=O)OC(C)(C)C ZINC001560926815 1060789942 /nfs/dbraw/zinc/78/99/42/1060789942.db2.gz ZAZOYCGNIBGQAB-IVMMDQJWSA-N 1 2 323.864 4.296 20 0 DIADLO Clc1cncc(CNc2c[nH+]cc3c2CCCC3)c1Cl ZINC001560926858 1060790967 /nfs/dbraw/zinc/79/09/67/1060790967.db2.gz AUARFPQGZPRBRJ-UHFFFAOYSA-N 1 2 308.212 4.274 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(F)c(Cl)c2Cl)C[C@H](C)O1 ZINC001560932640 1060794209 /nfs/dbraw/zinc/79/42/09/1060794209.db2.gz OYTQEHXJRZELHR-ZJUUUORDSA-N 1 2 306.208 4.132 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(F)c(Cl)c2Cl)C[C@H](C)O1 ZINC001560932640 1060794225 /nfs/dbraw/zinc/79/42/25/1060794225.db2.gz OYTQEHXJRZELHR-ZJUUUORDSA-N 1 2 306.208 4.132 20 0 DIADLO Cc1ccc(CC2C[NH+](Cc3ccc(F)c(F)c3F)C2)cc1 ZINC001560935462 1060799063 /nfs/dbraw/zinc/79/90/63/1060799063.db2.gz XXFNSSYQWRTUGX-UHFFFAOYSA-N 1 2 305.343 4.087 20 0 DIADLO CCc1cnc(C[N@@H+](Cc2ccccc2F)CC2CC2)s1 ZINC001560936914 1060799488 /nfs/dbraw/zinc/79/94/88/1060799488.db2.gz NPYUFINIHUFESQ-UHFFFAOYSA-N 1 2 304.434 4.257 20 0 DIADLO CCc1cnc(C[N@H+](Cc2ccccc2F)CC2CC2)s1 ZINC001560936914 1060799503 /nfs/dbraw/zinc/79/95/03/1060799503.db2.gz NPYUFINIHUFESQ-UHFFFAOYSA-N 1 2 304.434 4.257 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cncc(Br)c1Cl ZINC001250464721 1060821798 /nfs/dbraw/zinc/82/17/98/1060821798.db2.gz JALFIIZOJCQWJT-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cncc(Br)c1Cl ZINC001250464721 1060821811 /nfs/dbraw/zinc/82/18/11/1060821811.db2.gz JALFIIZOJCQWJT-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO CCSCc1ccc[nH+]c1NC[C@@H](Cc1ccccc1)OC ZINC001560982260 1060847896 /nfs/dbraw/zinc/84/78/96/1060847896.db2.gz RUBGUYAFEJXXIT-QGZVFWFLSA-N 1 2 316.470 4.004 20 0 DIADLO Fc1cc2[nH]c(-c3sccc3Cl)nc2cc1-n1cc[nH+]c1 ZINC001250504485 1060855276 /nfs/dbraw/zinc/85/52/76/1060855276.db2.gz DNBMRRYQDLXBJV-UHFFFAOYSA-N 1 2 318.764 4.270 20 0 DIADLO COc1cc2[nH+]c(Cc3cccc(Cl)c3)[nH]c2cc1Cl ZINC001250548628 1060888422 /nfs/dbraw/zinc/88/84/22/1060888422.db2.gz DYNKMDHNORCPHW-UHFFFAOYSA-N 1 2 307.180 4.469 20 0 DIADLO Cc1cc(F)cc2[nH+]c(Cc3ccccc3Br)[nH]c21 ZINC001250554370 1060893522 /nfs/dbraw/zinc/89/35/22/1060893522.db2.gz RJCTXKXNYDJQKH-UHFFFAOYSA-N 1 2 319.177 4.364 20 0 DIADLO CCn1c2ccc(C)cc2[nH+]c1C[C@H](C)CCCC(C)(C)O ZINC001250557092 1060896790 /nfs/dbraw/zinc/89/67/90/1060896790.db2.gz ZDCGVRUAGPIDMU-CQSZACIVSA-N 1 2 302.462 4.484 20 0 DIADLO CC[N@@H+](Cc1cc(C)oc1C)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001561050895 1060897822 /nfs/dbraw/zinc/89/78/22/1060897822.db2.gz JPNJWYKOZQFNTJ-GFCCVEGCSA-N 1 2 318.486 4.500 20 0 DIADLO CC[N@H+](Cc1cc(C)oc1C)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001561050895 1060897829 /nfs/dbraw/zinc/89/78/29/1060897829.db2.gz JPNJWYKOZQFNTJ-GFCCVEGCSA-N 1 2 318.486 4.500 20 0 DIADLO Cc1cc(F)cc2[nH+]c([C@H](C)Cc3ccc4c(c3)OCO4)[nH]c21 ZINC001250568138 1060904261 /nfs/dbraw/zinc/90/42/61/1060904261.db2.gz RTTZIUDJSBSPQA-LLVKDONJSA-N 1 2 312.344 4.085 20 0 DIADLO CCn1c(CCc2ccc(F)cc2)[nH+]c2ccc(F)c(F)c21 ZINC001250578568 1060912535 /nfs/dbraw/zinc/91/25/35/1060912535.db2.gz MOROTLJRVRHSIF-UHFFFAOYSA-N 1 2 304.315 4.259 20 0 DIADLO COc1cc2[nH+]c(C3CCN(c4ccccc4)CC3)[nH]c2cc1C ZINC001250583854 1060920675 /nfs/dbraw/zinc/92/06/75/1060920675.db2.gz CMQUYECJJFJBAE-UHFFFAOYSA-N 1 2 321.424 4.264 20 0 DIADLO c1ccc(COCCCc2[nH]c3cc4c(cc3[nH+]2)CCC4)cc1 ZINC001250605009 1060936008 /nfs/dbraw/zinc/93/60/08/1060936008.db2.gz GFCCAWCBUDTLFN-UHFFFAOYSA-N 1 2 306.409 4.201 20 0 DIADLO CCCOc1cc2[nH]c(CC(C)(C)OC)[nH+]c2cc1OCCC ZINC001250613404 1060944024 /nfs/dbraw/zinc/94/40/24/1060944024.db2.gz PLLIOYPLVUURCE-UHFFFAOYSA-N 1 2 320.433 4.108 20 0 DIADLO CCC[C@]1(C)CCC[N@@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001473191245 1060944538 /nfs/dbraw/zinc/94/45/38/1060944538.db2.gz KFWLMVYGDAJZMM-SJLPKXTDSA-N 1 2 323.864 4.456 20 0 DIADLO CCC[C@]1(C)CCC[N@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001473191245 1060944565 /nfs/dbraw/zinc/94/45/65/1060944565.db2.gz KFWLMVYGDAJZMM-SJLPKXTDSA-N 1 2 323.864 4.456 20 0 DIADLO COc1cccc(-c2nc(C[N@@H+]3CC[C@@H]3c3ccccc3)co2)c1 ZINC001473206062 1060967762 /nfs/dbraw/zinc/96/77/62/1060967762.db2.gz DRMCSTQDPHRWGC-LJQANCHMSA-N 1 2 320.392 4.297 20 0 DIADLO COc1cccc(-c2nc(C[N@H+]3CC[C@@H]3c3ccccc3)co2)c1 ZINC001473206062 1060967774 /nfs/dbraw/zinc/96/77/74/1060967774.db2.gz DRMCSTQDPHRWGC-LJQANCHMSA-N 1 2 320.392 4.297 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1C/C=C/c1cccc(F)c1 ZINC001462152971 1060974577 /nfs/dbraw/zinc/97/45/77/1060974577.db2.gz CZIWQBQYOVQCTI-JHTBKMLMSA-N 1 2 313.420 4.283 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1C/C=C/c1cccc(F)c1 ZINC001462152971 1060974597 /nfs/dbraw/zinc/97/45/97/1060974597.db2.gz CZIWQBQYOVQCTI-JHTBKMLMSA-N 1 2 313.420 4.283 20 0 DIADLO Cc1conc1C[N@H+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC001473237881 1061015874 /nfs/dbraw/zinc/01/58/74/1061015874.db2.gz PYRXUZOCCCTSCT-UHFFFAOYSA-N 1 2 322.330 4.291 20 0 DIADLO Cc1conc1C[N@@H+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC001473237881 1061015894 /nfs/dbraw/zinc/01/58/94/1061015894.db2.gz PYRXUZOCCCTSCT-UHFFFAOYSA-N 1 2 322.330 4.291 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+]1CCOc2ccccc2[C@@H]1C ZINC001473249590 1061028599 /nfs/dbraw/zinc/02/85/99/1061028599.db2.gz KYWXXXZSBSXKQO-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+]1CCOc2ccccc2[C@@H]1C ZINC001473249590 1061028613 /nfs/dbraw/zinc/02/86/13/1061028613.db2.gz KYWXXXZSBSXKQO-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO Cc1conc1C[N@H+](Cc1ccc(F)cc1F)C1CCCC1 ZINC001473262034 1061037541 /nfs/dbraw/zinc/03/75/41/1061037541.db2.gz QZYQIUAJZXOFNO-UHFFFAOYSA-N 1 2 306.356 4.206 20 0 DIADLO Cc1conc1C[N@@H+](Cc1ccc(F)cc1F)C1CCCC1 ZINC001473262034 1061037555 /nfs/dbraw/zinc/03/75/55/1061037555.db2.gz QZYQIUAJZXOFNO-UHFFFAOYSA-N 1 2 306.356 4.206 20 0 DIADLO CCC[C@H]1C[N@@H+]([C@H](C)c2ccccc2Br)CCO1 ZINC001473281984 1061053229 /nfs/dbraw/zinc/05/32/29/1061053229.db2.gz IKYOHGICZKBGHE-OLZOCXBDSA-N 1 2 312.251 4.011 20 0 DIADLO CCC[C@H]1C[N@H+]([C@H](C)c2ccccc2Br)CCO1 ZINC001473281984 1061053242 /nfs/dbraw/zinc/05/32/42/1061053242.db2.gz IKYOHGICZKBGHE-OLZOCXBDSA-N 1 2 312.251 4.011 20 0 DIADLO c1cnc2cc(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)ccc2c1 ZINC001250758325 1061060416 /nfs/dbraw/zinc/06/04/16/1061060416.db2.gz UWYIZHRGZHRKJA-UHFFFAOYSA-N 1 2 314.392 4.378 20 0 DIADLO Cc1cc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3)nc2cc1Cl ZINC001250772379 1061063094 /nfs/dbraw/zinc/06/30/94/1061063094.db2.gz SOTYRLIVEJHCQP-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO Clc1cccc([C@H]([NH2+]Cc2ccns2)c2ccccn2)c1 ZINC001473295143 1061063841 /nfs/dbraw/zinc/06/38/41/1061063841.db2.gz CFYAUCCWRATLOL-INIZCTEOSA-N 1 2 315.829 4.071 20 0 DIADLO CCCCC[C@@H]([NH2+]Cc1nc(CC2CC2)no1)c1ccccc1 ZINC001473340896 1061100172 /nfs/dbraw/zinc/10/01/72/1061100172.db2.gz NJLYQPVOSKVKEF-QGZVFWFLSA-N 1 2 313.445 4.433 20 0 DIADLO Cc1cc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)cc(C)c1O ZINC001250891502 1061112188 /nfs/dbraw/zinc/11/21/88/1061112188.db2.gz FZGQBLYCRXDSCI-UHFFFAOYSA-N 1 2 307.397 4.153 20 0 DIADLO COc1ccc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c(C)c1 ZINC001250893674 1061114906 /nfs/dbraw/zinc/11/49/06/1061114906.db2.gz WPTGRASKSCVSQC-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO COC(=O)[C@@H]1CCCCC[N@@H+]1Cc1c(Cl)oc2ccccc21 ZINC001473370703 1061116985 /nfs/dbraw/zinc/11/69/85/1061116985.db2.gz NDDFQJYGSRFJDU-AWEZNQCLSA-N 1 2 321.804 4.004 20 0 DIADLO COC(=O)[C@@H]1CCCCC[N@H+]1Cc1c(Cl)oc2ccccc21 ZINC001473370703 1061116996 /nfs/dbraw/zinc/11/69/96/1061116996.db2.gz NDDFQJYGSRFJDU-AWEZNQCLSA-N 1 2 321.804 4.004 20 0 DIADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1nsc2ccccc21 ZINC001473372913 1061118617 /nfs/dbraw/zinc/11/86/17/1061118617.db2.gz JOXUKPAGEJJIQJ-ZDUSSCGKSA-N 1 2 310.422 4.079 20 0 DIADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1nsc2ccccc21 ZINC001473372913 1061118624 /nfs/dbraw/zinc/11/86/24/1061118624.db2.gz JOXUKPAGEJJIQJ-ZDUSSCGKSA-N 1 2 310.422 4.079 20 0 DIADLO CCCn1c(-c2ccn3cc[nH+]c3c2)nc2ccc(F)c(F)c21 ZINC001250928111 1061128923 /nfs/dbraw/zinc/12/89/23/1061128923.db2.gz WOHJPYZAQMIATF-UHFFFAOYSA-N 1 2 312.323 4.039 20 0 DIADLO c1ccc(CSCCNc2ccc(N3CCCC3)c[nH+]2)cc1 ZINC001462361825 1061128979 /nfs/dbraw/zinc/12/89/79/1061128979.db2.gz AGQHFABOHSIIMI-UHFFFAOYSA-N 1 2 313.470 4.027 20 0 DIADLO Cc1ccc2c(c1)nc(-c1ccn3cc[nH+]c3c1)n2CC1CC1 ZINC001250928165 1061129119 /nfs/dbraw/zinc/12/91/19/1061129119.db2.gz ZSFMPSHUCULRJN-UHFFFAOYSA-N 1 2 302.381 4.069 20 0 DIADLO Clc1ccc2c(c1)nc(-c1ccn3cc[nH+]c3c1)n2C1CC1 ZINC001250927630 1061129183 /nfs/dbraw/zinc/12/91/83/1061129183.db2.gz GAOBXGZMTSZMMS-UHFFFAOYSA-N 1 2 308.772 4.339 20 0 DIADLO Clc1cc2[nH]c(-c3ccn4cc[nH+]c4c3)nc2c(Cl)c1 ZINC001250927941 1061129741 /nfs/dbraw/zinc/12/97/41/1061129741.db2.gz NFBZVTIUEMRJOB-UHFFFAOYSA-N 1 2 303.152 4.184 20 0 DIADLO CC[C@]1(C)C[N@H+](CCc2cc(Cl)cc(Cl)c2)CCO1 ZINC001473389882 1061130521 /nfs/dbraw/zinc/13/05/21/1061130521.db2.gz UYKHIJJRIIAISW-OAHLLOKOSA-N 1 2 302.245 4.037 20 0 DIADLO CC[C@]1(C)C[N@@H+](CCc2cc(Cl)cc(Cl)c2)CCO1 ZINC001473389882 1061130529 /nfs/dbraw/zinc/13/05/29/1061130529.db2.gz UYKHIJJRIIAISW-OAHLLOKOSA-N 1 2 302.245 4.037 20 0 DIADLO c1cn(-c2cccc(-c3nc4ccccc4n3C3CC3)c2)c[nH+]1 ZINC001250940554 1061139361 /nfs/dbraw/zinc/13/93/61/1061139361.db2.gz SURZMGDBCJBPPD-UHFFFAOYSA-N 1 2 300.365 4.224 20 0 DIADLO CC[C@H]1Cc2c(Br)cccc2C[N@@H+]1C/C=C/Cl ZINC001473427348 1061154991 /nfs/dbraw/zinc/15/49/91/1061154991.db2.gz YFRPYIHSMJFWCE-NTYUQYKDSA-N 1 2 314.654 4.338 20 0 DIADLO CC[C@H]1Cc2c(Br)cccc2C[N@H+]1C/C=C/Cl ZINC001473427348 1061155000 /nfs/dbraw/zinc/15/50/00/1061155000.db2.gz YFRPYIHSMJFWCE-NTYUQYKDSA-N 1 2 314.654 4.338 20 0 DIADLO CC[C@@H]1Cc2c(Br)cccc2C[N@@H+]1C/C=C/Cl ZINC001473427349 1061155661 /nfs/dbraw/zinc/15/56/61/1061155661.db2.gz YFRPYIHSMJFWCE-RPTYSRGTSA-N 1 2 314.654 4.338 20 0 DIADLO CC[C@@H]1Cc2c(Br)cccc2C[N@H+]1C/C=C/Cl ZINC001473427349 1061155666 /nfs/dbraw/zinc/15/56/66/1061155666.db2.gz YFRPYIHSMJFWCE-RPTYSRGTSA-N 1 2 314.654 4.338 20 0 DIADLO Fc1cc2[nH]c(-c3ccc4[nH+]ccn4c3)nc2c(C(F)(F)F)c1 ZINC001250979333 1061157682 /nfs/dbraw/zinc/15/76/82/1061157682.db2.gz YERAEJWYXIAWAZ-UHFFFAOYSA-N 1 2 320.249 4.036 20 0 DIADLO Cc1ccc(-c2nc3cc(Cl)ccc3n2CC2CC2)c(N)[nH+]1 ZINC001250981299 1061159679 /nfs/dbraw/zinc/15/96/79/1061159679.db2.gz APKILNGBNJZGCP-UHFFFAOYSA-N 1 2 312.804 4.052 20 0 DIADLO CC(C)(C)[C@@H]1C[N@H+](CCc2c(Cl)cccc2Cl)CCO1 ZINC001473439576 1061160144 /nfs/dbraw/zinc/16/01/44/1061160144.db2.gz IKEVUVAUCLIYIO-HNNXBMFYSA-N 1 2 316.272 4.283 20 0 DIADLO CC(C)(C)[C@@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)CCO1 ZINC001473439576 1061160151 /nfs/dbraw/zinc/16/01/51/1061160151.db2.gz IKEVUVAUCLIYIO-HNNXBMFYSA-N 1 2 316.272 4.283 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[NH+]1CCC2(CCC2)CC1 ZINC001473453813 1061166770 /nfs/dbraw/zinc/16/67/70/1061166770.db2.gz KLQMYHGKMDMGEL-MRXNPFEDSA-N 1 2 321.848 4.210 20 0 DIADLO C[N@H+](C/C=C/Cl)Cc1ccc(Br)cc1Cl ZINC001473450596 1061168180 /nfs/dbraw/zinc/16/81/80/1061168180.db2.gz ZTRUDDWTEPNRLM-GORDUTHDSA-N 1 2 309.034 4.287 20 0 DIADLO C[N@@H+](C/C=C/Cl)Cc1ccc(Br)cc1Cl ZINC001473450596 1061168189 /nfs/dbraw/zinc/16/81/89/1061168189.db2.gz ZTRUDDWTEPNRLM-GORDUTHDSA-N 1 2 309.034 4.287 20 0 DIADLO CC1(C)CCC[C@@H]1CC[NH2+][C@H](c1ncn[nH]1)C1CCCCC1 ZINC001462454659 1061183880 /nfs/dbraw/zinc/18/38/80/1061183880.db2.gz HQBMCGFSXCGNGS-CVEARBPZSA-N 1 2 304.482 4.232 20 0 DIADLO CC(C)(C)c1ccc(C2CC[NH+](Cc3csnn3)CC2)cc1 ZINC001473488911 1061187842 /nfs/dbraw/zinc/18/78/42/1061187842.db2.gz UTCHKIYAWCHPQN-UHFFFAOYSA-N 1 2 315.486 4.215 20 0 DIADLO CCCOc1cccc(C[N@H+](C)Cc2c(F)cccc2F)c1 ZINC001473494042 1061190680 /nfs/dbraw/zinc/19/06/80/1061190680.db2.gz KWVOZKNYXWYBHX-UHFFFAOYSA-N 1 2 305.368 4.386 20 0 DIADLO CCCOc1cccc(C[N@@H+](C)Cc2c(F)cccc2F)c1 ZINC001473494042 1061190687 /nfs/dbraw/zinc/19/06/87/1061190687.db2.gz KWVOZKNYXWYBHX-UHFFFAOYSA-N 1 2 305.368 4.386 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001473514461 1061210020 /nfs/dbraw/zinc/21/00/20/1061210020.db2.gz PKODNHMMKDJIQO-ZDUSSCGKSA-N 1 2 317.816 4.132 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001473514461 1061210033 /nfs/dbraw/zinc/21/00/33/1061210033.db2.gz PKODNHMMKDJIQO-ZDUSSCGKSA-N 1 2 317.816 4.132 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[NH+]1CCC(C)(C2CC2)CC1 ZINC001473516743 1061212754 /nfs/dbraw/zinc/21/27/54/1061212754.db2.gz OZNPWUBQFWIWNQ-MRXNPFEDSA-N 1 2 321.848 4.066 20 0 DIADLO FC1(F)CCC[C@@H]1CC[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC001473516511 1061213406 /nfs/dbraw/zinc/21/34/06/1061213406.db2.gz VZVPVVBLIPSJCF-OAHLLOKOSA-N 1 2 317.383 4.013 20 0 DIADLO FC1(F)CCC[C@@H]1CC[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC001473516511 1061213422 /nfs/dbraw/zinc/21/34/22/1061213422.db2.gz VZVPVVBLIPSJCF-OAHLLOKOSA-N 1 2 317.383 4.013 20 0 DIADLO CC[C@@H](CC(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1)C(C)(C)C ZINC001455770648 1061233936 /nfs/dbraw/zinc/23/39/36/1061233936.db2.gz NAGANLJKLFTFIM-LSDHHAIUSA-N 1 2 305.466 4.152 20 0 DIADLO CCn1c2ccc(C(F)(F)F)cc2nc1-c1ccc(N)[nH+]c1C ZINC001251092623 1061236122 /nfs/dbraw/zinc/23/61/22/1061236122.db2.gz UTDKBWPHIIWCDB-UHFFFAOYSA-N 1 2 320.318 4.028 20 0 DIADLO CCSCc1ccc[nH+]c1N[C@@H](C)CCc1cccnc1 ZINC001462527561 1061237974 /nfs/dbraw/zinc/23/79/74/1061237974.db2.gz MNUVWDWCVNCOOA-AWEZNQCLSA-N 1 2 301.459 4.163 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cc(C)c(O)c(C)c1 ZINC001462529095 1061238351 /nfs/dbraw/zinc/23/83/51/1061238351.db2.gz QGKGADXYVMLMIM-UHFFFAOYSA-N 1 2 302.443 4.269 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@H](C)[C@H]2C(=O)OC(C)(C)C)cc1F ZINC001473571288 1061256537 /nfs/dbraw/zinc/25/65/37/1061256537.db2.gz FEYVNZZRULIPCM-YOEHRIQHSA-N 1 2 321.436 4.076 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@H](C)[C@H]2C(=O)OC(C)(C)C)cc1F ZINC001473571288 1061256551 /nfs/dbraw/zinc/25/65/51/1061256551.db2.gz FEYVNZZRULIPCM-YOEHRIQHSA-N 1 2 321.436 4.076 20 0 DIADLO COc1c(C)c[nH+]c(CN2CCc3ccccc3C2(C)C)c1C ZINC001473575408 1061263783 /nfs/dbraw/zinc/26/37/83/1061263783.db2.gz VYWHVXOQHYIIQT-UHFFFAOYSA-N 1 2 310.441 4.000 20 0 DIADLO C[N@H+](CCCF)Cc1c(F)c(Cl)ccc1Br ZINC001462598593 1061286427 /nfs/dbraw/zinc/28/64/27/1061286427.db2.gz VLNLLAAPYCAWMJ-UHFFFAOYSA-N 1 2 312.585 4.033 20 0 DIADLO C[N@@H+](CCCF)Cc1c(F)c(Cl)ccc1Br ZINC001462598593 1061286445 /nfs/dbraw/zinc/28/64/45/1061286445.db2.gz VLNLLAAPYCAWMJ-UHFFFAOYSA-N 1 2 312.585 4.033 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CC3(CCC3)OC[C@@H]2C)cc1Cl ZINC001473621769 1061293936 /nfs/dbraw/zinc/29/39/36/1061293936.db2.gz PNSVTXBPQJZREV-AWEZNQCLSA-N 1 2 323.864 4.271 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CC3(CCC3)OC[C@@H]2C)cc1Cl ZINC001473621769 1061293952 /nfs/dbraw/zinc/29/39/52/1061293952.db2.gz PNSVTXBPQJZREV-AWEZNQCLSA-N 1 2 323.864 4.271 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@@H+]1C[C@@H](C)O[C@@H](CC(F)(F)F)C1 ZINC001473661657 1061324555 /nfs/dbraw/zinc/32/45/55/1061324555.db2.gz UGOLIHHXUDTKHJ-BYCMXARLSA-N 1 2 319.342 4.319 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@H+]1C[C@@H](C)O[C@@H](CC(F)(F)F)C1 ZINC001473661657 1061324575 /nfs/dbraw/zinc/32/45/75/1061324575.db2.gz UGOLIHHXUDTKHJ-BYCMXARLSA-N 1 2 319.342 4.319 20 0 DIADLO COc1nc(C)cc(C)c1C[N@H+](C)[C@@H](C)c1ccc(F)cc1F ZINC001473675059 1061339028 /nfs/dbraw/zinc/33/90/28/1061339028.db2.gz SDZJZZIQPJDTHO-ZDUSSCGKSA-N 1 2 320.383 4.178 20 0 DIADLO COc1nc(C)cc(C)c1C[N@@H+](C)[C@@H](C)c1ccc(F)cc1F ZINC001473675059 1061339048 /nfs/dbraw/zinc/33/90/48/1061339048.db2.gz SDZJZZIQPJDTHO-ZDUSSCGKSA-N 1 2 320.383 4.178 20 0 DIADLO Cc1c2cc(Cl)ccc2oc1C(=O)Nc1c(C)c[nH+]cc1C ZINC001462732298 1061346511 /nfs/dbraw/zinc/34/65/11/1061346511.db2.gz NHJVMAMCAFEZEL-UHFFFAOYSA-N 1 2 314.772 4.081 20 0 DIADLO COC[C@H](C)[N@H+](C/C(Cl)=C/Cl)[C@H]1CCc2ccccc21 ZINC001473691190 1061349852 /nfs/dbraw/zinc/34/98/52/1061349852.db2.gz DVWADQZOECBQGI-IZWMIFJYSA-N 1 2 314.256 4.330 20 0 DIADLO COC[C@H](C)[N@@H+](C/C(Cl)=C/Cl)[C@H]1CCc2ccccc21 ZINC001473691190 1061349871 /nfs/dbraw/zinc/34/98/71/1061349871.db2.gz DVWADQZOECBQGI-IZWMIFJYSA-N 1 2 314.256 4.330 20 0 DIADLO CC(C)C[C@H](C)[NH2+][C@@H](Cc1ccccc1)C(=O)OC1CCCC1 ZINC001473699495 1061355614 /nfs/dbraw/zinc/35/56/14/1061355614.db2.gz KRLFCYTYGTUDKV-LPHOPBHVSA-N 1 2 317.473 4.108 20 0 DIADLO CC(C)[C@H](C)N(C(=O)c1cccc2[nH+]ccn21)c1ccccc1 ZINC001462771198 1061356241 /nfs/dbraw/zinc/35/62/41/1061356241.db2.gz WLPWZBMYKGEVLD-HNNXBMFYSA-N 1 2 307.397 4.026 20 0 DIADLO C=C/C=C\CC[NH2+][C@H](Cc1cccc2ccccc21)C(=O)OCC ZINC001473699121 1061356503 /nfs/dbraw/zinc/35/65/03/1061356503.db2.gz BRHUHYYIQQRGNQ-KKHYBRAUSA-N 1 2 323.436 4.036 20 0 DIADLO c1cn(-c2ccc(CN(c3ccccc3)C3CCC3)cc2)c[nH+]1 ZINC001473711211 1061362664 /nfs/dbraw/zinc/36/26/64/1061362664.db2.gz MQVXWJVYZMTZEU-UHFFFAOYSA-N 1 2 303.409 4.431 20 0 DIADLO C[C@@H]([NH2+]Cc1nccc(Cl)c1Cl)c1cc2cnccc2o1 ZINC001473743219 1061383269 /nfs/dbraw/zinc/38/32/69/1061383269.db2.gz FEPAUOFZHGTYEO-SECBINFHSA-N 1 2 322.195 4.380 20 0 DIADLO Fc1cccc2[nH]c(-c3ccc(-n4cc[nH+]c4)c(Cl)c3)nc21 ZINC001251507819 1061384426 /nfs/dbraw/zinc/38/44/26/1061384426.db2.gz UDDUPKDAHJUBIA-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO COc1ccc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3Cl)nc2c1 ZINC001251507774 1061384938 /nfs/dbraw/zinc/38/49/38/1061384938.db2.gz ROFSREFPMLZZFF-UHFFFAOYSA-N 1 2 324.771 4.078 20 0 DIADLO Cc1ccc(C(C)(C)CN(C)C(=O)c2c(C)cc(C)[nH+]c2C)cc1 ZINC001456966304 1061392492 /nfs/dbraw/zinc/39/24/92/1061392492.db2.gz ZECOFMJOCODVQA-UHFFFAOYSA-N 1 2 324.468 4.365 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccc(F)c(N4CCCC4)c3)[nH+]c2c1 ZINC001251536729 1061395156 /nfs/dbraw/zinc/39/51/56/1061395156.db2.gz YZOUTFFSOICYHD-UHFFFAOYSA-N 1 2 324.403 4.035 20 0 DIADLO Cc1cc(F)cc(C)c1-c1nc2cc(-n3cc[nH+]c3)c(F)cc2[nH]1 ZINC001251583234 1061409049 /nfs/dbraw/zinc/40/90/49/1061409049.db2.gz OVPQCHAGUZSCRJ-UHFFFAOYSA-N 1 2 324.334 4.311 20 0 DIADLO COCC[N@H+](Cc1ccc(C)c(C)c1)Cc1ncccc1Cl ZINC001473803205 1061414854 /nfs/dbraw/zinc/41/48/54/1061414854.db2.gz XSMKVUOLOFTYRW-UHFFFAOYSA-N 1 2 318.848 4.000 20 0 DIADLO COCC[N@@H+](Cc1ccc(C)c(C)c1)Cc1ncccc1Cl ZINC001473803205 1061414860 /nfs/dbraw/zinc/41/48/60/1061414860.db2.gz XSMKVUOLOFTYRW-UHFFFAOYSA-N 1 2 318.848 4.000 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cccc1F)c1cc(Cl)cc2c1OCC2 ZINC001473827450 1061425881 /nfs/dbraw/zinc/42/58/81/1061425881.db2.gz ZKUSHHMJNKYUDI-SNVBAGLBSA-N 1 2 323.770 4.404 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1 ZINC001457334571 1061439325 /nfs/dbraw/zinc/43/93/25/1061439325.db2.gz HKJSCIQKGXBOPP-QGZVFWFLSA-N 1 2 319.493 4.187 20 0 DIADLO Cc1cccnc1[C@H](C)[NH2+][C@@H](C)c1ncc(-c2ccccc2)o1 ZINC001473878789 1061446943 /nfs/dbraw/zinc/44/69/43/1061446943.db2.gz ABJYPTCBIKXYRD-GJZGRUSLSA-N 1 2 307.397 4.457 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@@H+](Cc1ccc(C(F)F)cc1)C2 ZINC001473903911 1061456292 /nfs/dbraw/zinc/45/62/92/1061456292.db2.gz HFEQZTHEGUOKFX-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@H+](Cc1ccc(C(F)F)cc1)C2 ZINC001473903911 1061456303 /nfs/dbraw/zinc/45/63/03/1061456303.db2.gz HFEQZTHEGUOKFX-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO CCc1cc(C[NH2+]Cc2c(Cl)ccc(Cl)c2Cl)[nH]n1 ZINC001473997301 1061540188 /nfs/dbraw/zinc/54/01/88/1061540188.db2.gz VIMNCMGTORJTFB-UHFFFAOYSA-N 1 2 318.635 4.222 20 0 DIADLO Cc1cc(-c2ccccc2)ccc1NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC001464091869 1061556102 /nfs/dbraw/zinc/55/61/02/1061556102.db2.gz NYNPEFHMXDQVIV-HNNXBMFYSA-N 1 2 319.408 4.202 20 0 DIADLO Cc1cc(-c2ccccc2)ccc1NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC001464091869 1061556120 /nfs/dbraw/zinc/55/61/20/1061556120.db2.gz NYNPEFHMXDQVIV-HNNXBMFYSA-N 1 2 319.408 4.202 20 0 DIADLO CC(C)(C)[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1ccccc1 ZINC001464291700 1061572431 /nfs/dbraw/zinc/57/24/31/1061572431.db2.gz LFPFXBKGZCDBFI-KRWDZBQOSA-N 1 2 307.397 4.080 20 0 DIADLO C/C(=C/c1ccc(Cl)cc1)CNc1ccc(N(C)C)c[nH+]1 ZINC001474052974 1061601133 /nfs/dbraw/zinc/60/11/33/1061601133.db2.gz AUZVKFPFLUSJCV-RAXLEYEMSA-N 1 2 301.821 4.316 20 0 DIADLO Fc1ccccc1CNc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001474054785 1061601912 /nfs/dbraw/zinc/60/19/12/1061601912.db2.gz BVSUSHJEBWPTRF-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3c[nH]c(-c4ccccc4)n3)ccc21 ZINC001474060752 1061607821 /nfs/dbraw/zinc/60/78/21/1061607821.db2.gz ZQHCZADTXNDLMK-UHFFFAOYSA-N 1 2 318.424 4.071 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3c[nH]c(-c4ccccc4)n3)ccc21 ZINC001474060752 1061607828 /nfs/dbraw/zinc/60/78/28/1061607828.db2.gz ZQHCZADTXNDLMK-UHFFFAOYSA-N 1 2 318.424 4.071 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccc(CC(F)(F)F)cc2)cc1 ZINC001474062108 1061608365 /nfs/dbraw/zinc/60/83/65/1061608365.db2.gz HBAYURJBSVCSQI-UHFFFAOYSA-N 1 2 308.347 4.470 20 0 DIADLO COc1ccccc1/C=C/CNc1ccc([NH+]2CCCC2)cc1 ZINC001474063088 1061610417 /nfs/dbraw/zinc/61/04/17/1061610417.db2.gz PHMNYXXEYMNIFQ-SOFGYWHQSA-N 1 2 308.425 4.421 20 0 DIADLO CN(C)c1ccc(NCc2ccc(-c3cccs3)cc2)c[nH+]1 ZINC001474064553 1061610760 /nfs/dbraw/zinc/61/07/60/1061610760.db2.gz LNIWJNAKAZZQRF-UHFFFAOYSA-N 1 2 309.438 4.488 20 0 DIADLO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001464603597 1061611346 /nfs/dbraw/zinc/61/13/46/1061611346.db2.gz HCEKHSPVBDZCTL-IIAWOOMASA-N 1 2 313.445 4.001 20 0 DIADLO Fc1ccc(C[NH2+][C@@H]2COc3ccc(Cl)cc32)c(Cl)c1 ZINC001474065760 1061613278 /nfs/dbraw/zinc/61/32/78/1061613278.db2.gz UJZXRFKESHITLJ-CQSZACIVSA-N 1 2 312.171 4.356 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)c(N(C)C)[nH+]1 ZINC001458216880 1061640087 /nfs/dbraw/zinc/64/00/87/1061640087.db2.gz PXOINUNEZGKAIQ-BZUAXINKSA-N 1 2 315.461 4.001 20 0 DIADLO CCc1cc(N2C[C@H](C)C[C@@H]2c2ccccc2F)nc(CC)[nH+]1 ZINC001458223214 1061642505 /nfs/dbraw/zinc/64/25/05/1061642505.db2.gz BZUPFYLPXYIMAJ-CXAGYDPISA-N 1 2 313.420 4.328 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc(Cl)cc2Cl)cc(C)[nH+]1 ZINC001464897544 1061645370 /nfs/dbraw/zinc/64/53/70/1061645370.db2.gz BPZZDMBMEWUHCV-UHFFFAOYSA-N 1 2 324.211 4.327 20 0 DIADLO Cc1cc(N(C)[C@H](C)Cc2cccs2)nc(C2CCC2)[nH+]1 ZINC001458234568 1061650664 /nfs/dbraw/zinc/65/06/64/1061650664.db2.gz VTIRBTPLUGHQGC-CYBMUJFWSA-N 1 2 301.459 4.181 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc3sccc3c2)cc(C)[nH+]1 ZINC001464930724 1061652441 /nfs/dbraw/zinc/65/24/41/1061652441.db2.gz OBMZSEAHWOVGKN-UHFFFAOYSA-N 1 2 311.410 4.235 20 0 DIADLO CCc1nc(N(Cc2ccco2)Cc2cccc(C)c2)cc(C)[nH+]1 ZINC001458254966 1061663027 /nfs/dbraw/zinc/66/30/27/1061663027.db2.gz SBTDAHNCJPYCOG-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO COc1ccc(C2(CNc3cc(C)[nH+]c(C4CC4)n3)CCC2)cc1 ZINC001458279807 1061673980 /nfs/dbraw/zinc/67/39/80/1061673980.db2.gz PUTAGRVCNSIOBT-UHFFFAOYSA-N 1 2 323.440 4.205 20 0 DIADLO CC(C)c1ccc2ncnc(NCc3ccn4cc[nH+]c4c3)c2c1 ZINC001458289589 1061678547 /nfs/dbraw/zinc/67/85/47/1061678547.db2.gz GOZOQTYUYHWLGZ-UHFFFAOYSA-N 1 2 317.396 4.013 20 0 DIADLO Cc1cnc([C@@H](C)CNc2cc(C)[nH+]c(C3CCC3)n2)s1 ZINC001458304088 1061685781 /nfs/dbraw/zinc/68/57/81/1061685781.db2.gz ASPVTWRBOIFFRW-JTQLQIEISA-N 1 2 302.447 4.033 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccc3oc4ccccc4c3c2)co1 ZINC001474149091 1061693454 /nfs/dbraw/zinc/69/34/54/1061693454.db2.gz GIGWLXJEQAHKHP-UHFFFAOYSA-N 1 2 306.365 4.426 20 0 DIADLO Cc1cc(NCCCc2cccc(Cl)c2)nc(C2CC2)[nH+]1 ZINC001458356798 1061718735 /nfs/dbraw/zinc/71/87/35/1061718735.db2.gz MGQQFLCUMREUTH-UHFFFAOYSA-N 1 2 301.821 4.361 20 0 DIADLO Clc1ccc(-c2nnc(-c3ccccc3-n3cc[nH+]c3)o2)cc1 ZINC001252788238 1061719012 /nfs/dbraw/zinc/71/90/12/1061719012.db2.gz XNINUPSVOIAPOW-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2F)s1)c1csnn1 ZINC001474185390 1061733153 /nfs/dbraw/zinc/73/31/53/1061733153.db2.gz QJZIEDGYBYOPIK-SNVBAGLBSA-N 1 2 319.430 4.257 20 0 DIADLO Cc1cc(N2Cc3ccccc3OC(C)(C)C2)nc(C2CCC2)[nH+]1 ZINC001458406079 1061747303 /nfs/dbraw/zinc/74/73/03/1061747303.db2.gz NPNZHHXAJURLJP-UHFFFAOYSA-N 1 2 323.440 4.230 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3cccc(OC(C)C)c3)ccc2[nH+]1 ZINC001465532037 1061773096 /nfs/dbraw/zinc/77/30/96/1061773096.db2.gz PAQLPLYLIAZLFE-UHFFFAOYSA-N 1 2 324.384 4.074 20 0 DIADLO Fc1ccc(C(F)(F)C[NH2+]Cc2cccc3cccnc32)cc1 ZINC001474221587 1061780397 /nfs/dbraw/zinc/78/03/97/1061780397.db2.gz ORBCBAWQKDWYEA-UHFFFAOYSA-N 1 2 316.326 4.256 20 0 DIADLO Cc1nc(N2CCC(C)(C)CC(C)(C)C2)c2c([nH+]1)CCCC2 ZINC001458475078 1061783469 /nfs/dbraw/zinc/78/34/69/1061783469.db2.gz DTGJETMLGZTSJE-UHFFFAOYSA-N 1 2 301.478 4.316 20 0 DIADLO CCc1cc(N(C)[C@H](C)CSc2ccccc2)nc(CC)[nH+]1 ZINC001458472962 1061785542 /nfs/dbraw/zinc/78/55/42/1061785542.db2.gz RYIFXSMQBPWJMX-CQSZACIVSA-N 1 2 315.486 4.218 20 0 DIADLO C[C@@](O)(CNc1cc[nH+]c2c(Cl)cccc12)c1ccccc1 ZINC001253092737 1061799627 /nfs/dbraw/zinc/79/96/27/1061799627.db2.gz KLIHBMHAMMVYDS-GOSISDBHSA-N 1 2 312.800 4.208 20 0 DIADLO CC(C)c1nn(C)c(Cl)c1C[NH2+]Cc1ccc(C(C)(C)C)o1 ZINC001474237272 1061802266 /nfs/dbraw/zinc/80/22/66/1061802266.db2.gz GBNDXSIOWBAFCH-UHFFFAOYSA-N 1 2 323.868 4.377 20 0 DIADLO Cc1[nH]c(CNC(=O)c2csc(C3CCCCC3)c2)[nH+]c1C ZINC001465748986 1061804665 /nfs/dbraw/zinc/80/46/65/1061804665.db2.gz IBHIABAROVEXGX-UHFFFAOYSA-N 1 2 317.458 4.066 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1nc(-c2ccccc2)c[nH]1 ZINC001474244739 1061808689 /nfs/dbraw/zinc/80/86/89/1061808689.db2.gz CAPJFUYQFAVLSQ-UHFFFAOYSA-N 1 2 324.453 4.337 20 0 DIADLO Cc1ccc2[nH+]c(NCc3c(F)cccc3N3CCCC3)[nH]c2c1 ZINC001474247742 1061816593 /nfs/dbraw/zinc/81/65/93/1061816593.db2.gz ADXANQLPKLVNIA-UHFFFAOYSA-N 1 2 324.403 4.223 20 0 DIADLO CC(C)c1cc(N[C@H](C2CCC2)[C@@H]2CCCO2)nc(C(C)C)[nH+]1 ZINC001458521792 1061818417 /nfs/dbraw/zinc/81/84/17/1061818417.db2.gz ZVXORYQLHWQDIL-FUHWJXTLSA-N 1 2 317.477 4.483 20 0 DIADLO CCCn1cncc1CNc1[nH+]c2ccccc2n1C(C)(C)C ZINC001474251570 1061818595 /nfs/dbraw/zinc/81/85/95/1061818595.db2.gz WQFCOAFRCURQMR-UHFFFAOYSA-N 1 2 311.433 4.010 20 0 DIADLO CC(C)Oc1ccc(C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)cc1 ZINC001474266067 1061832444 /nfs/dbraw/zinc/83/24/44/1061832444.db2.gz LOEZIYVGIJTWGV-IEBWSBKVSA-N 1 2 315.388 4.035 20 0 DIADLO COC1(CNc2[nH+]c3ccccc3n2CC2CC2)CCCCC1 ZINC001474274325 1061842482 /nfs/dbraw/zinc/84/24/82/1061842482.db2.gz YZYPYOOSAFIDJJ-UHFFFAOYSA-N 1 2 313.445 4.208 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1NC[C@H](O)c1ccc(F)c(F)c1 ZINC001253351343 1061875448 /nfs/dbraw/zinc/87/54/48/1061875448.db2.gz PDWQOZVQCDKFDR-SFHVURJKSA-N 1 2 320.383 4.012 20 0 DIADLO CCc1ccc2c(c1)CCN(c1cc(C)[nH+]c(C3CCC3)n1)C2 ZINC001458720647 1061884461 /nfs/dbraw/zinc/88/44/61/1061884461.db2.gz YLIKRHOZRGEKHV-UHFFFAOYSA-N 1 2 307.441 4.178 20 0 DIADLO CC[N@H+](Cc1cnc2ccccc2n1)Cc1ccccc1Cl ZINC001474318953 1061889961 /nfs/dbraw/zinc/88/99/61/1061889961.db2.gz KSHMPQUMKBVVIB-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO CC[N@@H+](Cc1cnc2ccccc2n1)Cc1ccccc1Cl ZINC001474318953 1061889985 /nfs/dbraw/zinc/88/99/85/1061889985.db2.gz KSHMPQUMKBVVIB-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO CCCCC[C@H](O)C[N@@H+]1CCc2[nH]c3ccc(Cl)cc3c2C1 ZINC001253532630 1061916378 /nfs/dbraw/zinc/91/63/78/1061916378.db2.gz KXJVYOFJKGETQP-AWEZNQCLSA-N 1 2 320.864 4.121 20 0 DIADLO CCCCC[C@H](O)C[N@H+]1CCc2[nH]c3ccc(Cl)cc3c2C1 ZINC001253532630 1061916391 /nfs/dbraw/zinc/91/63/91/1061916391.db2.gz KXJVYOFJKGETQP-AWEZNQCLSA-N 1 2 320.864 4.121 20 0 DIADLO Cc1cc(Oc2ccc(NC[C@H](O)C(C)(C)C)cc2)cc[nH+]1 ZINC001253734861 1061965226 /nfs/dbraw/zinc/96/52/26/1061965226.db2.gz IXYVLZRGSHSJQI-KRWDZBQOSA-N 1 2 300.402 4.001 20 0 DIADLO CCCC[N@H+](Cc1nn(C)cc1Cl)[C@H](C)c1ccccc1 ZINC001474361407 1061986884 /nfs/dbraw/zinc/98/68/84/1061986884.db2.gz QGOVQKQPYWDLDP-CQSZACIVSA-N 1 2 305.853 4.437 20 0 DIADLO CCCC[N@@H+](Cc1nn(C)cc1Cl)[C@H](C)c1ccccc1 ZINC001474361407 1061986895 /nfs/dbraw/zinc/98/68/95/1061986895.db2.gz QGOVQKQPYWDLDP-CQSZACIVSA-N 1 2 305.853 4.437 20 0 DIADLO C[C@H]1CSCC[N@@H+]1Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC001474374997 1062017594 /nfs/dbraw/zinc/01/75/94/1062017594.db2.gz KHOJBLWHNGKKJK-VIFPVBQESA-N 1 2 309.784 4.296 20 0 DIADLO C[C@H]1CSCC[N@H+]1Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC001474374997 1062017614 /nfs/dbraw/zinc/01/76/14/1062017614.db2.gz KHOJBLWHNGKKJK-VIFPVBQESA-N 1 2 309.784 4.296 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3)C2)c1 ZINC001474377700 1062021311 /nfs/dbraw/zinc/02/13/11/1062021311.db2.gz QMSWQVYJIMKGFK-GOSISDBHSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3)C2)c1 ZINC001474377700 1062021334 /nfs/dbraw/zinc/02/13/34/1062021334.db2.gz QMSWQVYJIMKGFK-GOSISDBHSA-N 1 2 319.807 4.361 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1cc3c(ccnc3Cl)o1)CC2 ZINC001474386232 1062033645 /nfs/dbraw/zinc/03/36/45/1062033645.db2.gz NPCHSLAYNRTOEK-UHFFFAOYSA-N 1 2 316.763 4.179 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1cc3c(ccnc3Cl)o1)CC2 ZINC001474386232 1062033664 /nfs/dbraw/zinc/03/36/64/1062033664.db2.gz NPCHSLAYNRTOEK-UHFFFAOYSA-N 1 2 316.763 4.179 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CC[C@@H](Cc3ccccc3)C2)c(C)[nH+]1 ZINC001459169054 1062034024 /nfs/dbraw/zinc/03/40/24/1062034024.db2.gz ZBLRYDZWXLTGKJ-RBUKOAKNSA-N 1 2 322.452 4.148 20 0 DIADLO CC(C)(C)c1cn(CC(=O)Nc2ccc(C(C)(C)C)cc2)c[nH+]1 ZINC001459210764 1062042963 /nfs/dbraw/zinc/04/29/63/1062042963.db2.gz POHAIVWLWAKVDV-UHFFFAOYSA-N 1 2 313.445 4.117 20 0 DIADLO Cc1cn(C)nc1C[N@H+](C)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC001474411057 1062080044 /nfs/dbraw/zinc/08/00/44/1062080044.db2.gz TUCZZMCOQOCSDO-HXUWFJFHSA-N 1 2 323.415 4.089 20 0 DIADLO Cc1cn(C)nc1C[N@@H+](C)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC001474411057 1062080069 /nfs/dbraw/zinc/08/00/69/1062080069.db2.gz TUCZZMCOQOCSDO-HXUWFJFHSA-N 1 2 323.415 4.089 20 0 DIADLO CC(C)n1c[nH+]cc1CN1CC2(CCCC2)c2c1cccc2F ZINC001474429075 1062103333 /nfs/dbraw/zinc/10/33/33/1062103333.db2.gz AWWBJPXCECKFGI-UHFFFAOYSA-N 1 2 313.420 4.435 20 0 DIADLO CC[C@@H]1CCC[N@H+](Cc2nc(C)c(Br)s2)CC1 ZINC001459482836 1062162852 /nfs/dbraw/zinc/16/28/52/1062162852.db2.gz WAOPAUYLJAWODS-LLVKDONJSA-N 1 2 317.296 4.226 20 0 DIADLO CC[C@@H]1CCC[N@@H+](Cc2nc(C)c(Br)s2)CC1 ZINC001459482836 1062162858 /nfs/dbraw/zinc/16/28/58/1062162858.db2.gz WAOPAUYLJAWODS-LLVKDONJSA-N 1 2 317.296 4.226 20 0 DIADLO CC(C)n1c[nH+]cc1CN1CCOc2c1cccc2C(C)(C)C ZINC001474444307 1062124336 /nfs/dbraw/zinc/12/43/36/1062124336.db2.gz HZXHSJRDTIQEDF-UHFFFAOYSA-N 1 2 313.445 4.161 20 0 DIADLO C[N@H+](CCOCC1CCC1)Cc1c(Cl)cccc1Cl ZINC001459415005 1062134558 /nfs/dbraw/zinc/13/45/58/1062134558.db2.gz PDGSFIDLJCTUML-UHFFFAOYSA-N 1 2 302.245 4.242 20 0 DIADLO C[N@@H+](CCOCC1CCC1)Cc1c(Cl)cccc1Cl ZINC001459415005 1062134575 /nfs/dbraw/zinc/13/45/75/1062134575.db2.gz PDGSFIDLJCTUML-UHFFFAOYSA-N 1 2 302.245 4.242 20 0 DIADLO CCCC[N@H+](Cc1c(C)nnn1CC)Cc1ccccc1Cl ZINC001459422778 1062137198 /nfs/dbraw/zinc/13/71/98/1062137198.db2.gz ZGHSJBBOECSBSU-UHFFFAOYSA-N 1 2 320.868 4.062 20 0 DIADLO CCCC[N@@H+](Cc1c(C)nnn1CC)Cc1ccccc1Cl ZINC001459422778 1062137210 /nfs/dbraw/zinc/13/72/10/1062137210.db2.gz ZGHSJBBOECSBSU-UHFFFAOYSA-N 1 2 320.868 4.062 20 0 DIADLO CC1(C)CC[NH+](Cc2cc(Br)cc(F)c2F)CC1 ZINC001459426922 1062141623 /nfs/dbraw/zinc/14/16/23/1062141623.db2.gz ADNRDOSCGFKRTF-UHFFFAOYSA-N 1 2 318.205 4.349 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCC[C@H](OCC3CC3)C2)c1Cl ZINC001474467495 1062146756 /nfs/dbraw/zinc/14/67/56/1062146756.db2.gz VIIOOANBVDMEST-LBPRGKRZSA-N 1 2 315.791 4.009 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCC[C@H](OCC3CC3)C2)c1Cl ZINC001474467495 1062146763 /nfs/dbraw/zinc/14/67/63/1062146763.db2.gz VIIOOANBVDMEST-LBPRGKRZSA-N 1 2 315.791 4.009 20 0 DIADLO CCOC(=O)c1oc2ccccc2c1C[NH+]1Cc2ccccc2C1 ZINC001459451760 1062147784 /nfs/dbraw/zinc/14/77/84/1062147784.db2.gz KCOXGXPBKJUUEI-UHFFFAOYSA-N 1 2 321.376 4.125 20 0 DIADLO C[C@@H]1CN(c2ccc(N[C@@H]3CCCC(C)(C)C3)c[nH+]2)C[C@@H](C)O1 ZINC001474487766 1062166486 /nfs/dbraw/zinc/16/64/86/1062166486.db2.gz UPZKJENGLUSGGC-BZUAXINKSA-N 1 2 317.477 4.076 20 0 DIADLO CC1(C)C[N@H+](CCc2cccc(Cl)c2Cl)C(C)(C)CO1 ZINC001459518501 1062179789 /nfs/dbraw/zinc/17/97/89/1062179789.db2.gz DLOHDRGWQBANDV-UHFFFAOYSA-N 1 2 316.272 4.425 20 0 DIADLO CC1(C)C[N@@H+](CCc2cccc(Cl)c2Cl)C(C)(C)CO1 ZINC001459518501 1062179798 /nfs/dbraw/zinc/17/97/98/1062179798.db2.gz DLOHDRGWQBANDV-UHFFFAOYSA-N 1 2 316.272 4.425 20 0 DIADLO CSC1CC([NH2+][C@@H](CCC(C)(C)C)C(=O)OC(C)(C)C)C1 ZINC001474530485 1062216194 /nfs/dbraw/zinc/21/61/94/1062216194.db2.gz POFXWLSGHATPKA-RUXDESIVSA-N 1 2 315.523 4.007 20 0 DIADLO CCn1ncc(C[N@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC001459553749 1062203211 /nfs/dbraw/zinc/20/32/11/1062203211.db2.gz GSJCYJSCDWNDIE-INIZCTEOSA-N 1 2 320.440 4.158 20 0 DIADLO CCn1ncc(C[N@@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC001459553749 1062203234 /nfs/dbraw/zinc/20/32/34/1062203234.db2.gz GSJCYJSCDWNDIE-INIZCTEOSA-N 1 2 320.440 4.158 20 0 DIADLO CCCn1c[nH+]cc1CN1CC[C@@H](C(F)(F)F)c2ccccc21 ZINC001474541801 1062233374 /nfs/dbraw/zinc/23/33/74/1062233374.db2.gz PJPFTTLMFGTFES-OAHLLOKOSA-N 1 2 323.362 4.349 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1C[NH2+][C@H](c1ncn[nH]1)C1CCCCC1 ZINC001474553238 1062249094 /nfs/dbraw/zinc/24/90/94/1062249094.db2.gz YLKSHOOHESPJRY-OIISXLGYSA-N 1 2 304.482 4.232 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(Cl)n2)CC[C@H]1c1ccccc1 ZINC001459646518 1062277200 /nfs/dbraw/zinc/27/72/00/1062277200.db2.gz LSQHHSLEYFBOQY-IUODEOHRSA-N 1 2 306.862 4.422 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(Cl)n2)CC[C@H]1c1ccccc1 ZINC001459646518 1062277213 /nfs/dbraw/zinc/27/72/13/1062277213.db2.gz LSQHHSLEYFBOQY-IUODEOHRSA-N 1 2 306.862 4.422 20 0 DIADLO Fc1cncc(F)c1C[N@@H+]1C[C@H]2CCCC[C@]21c1ccccc1 ZINC001459677109 1062298302 /nfs/dbraw/zinc/29/83/02/1062298302.db2.gz OBNIWBUQEJACES-BEFAXECRSA-N 1 2 314.379 4.261 20 0 DIADLO Fc1cncc(F)c1C[N@H+]1C[C@H]2CCCC[C@]21c1ccccc1 ZINC001459677109 1062298317 /nfs/dbraw/zinc/29/83/17/1062298317.db2.gz OBNIWBUQEJACES-BEFAXECRSA-N 1 2 314.379 4.261 20 0 DIADLO Fc1cncc(F)c1C[N@@H+]1C[C@H]2CCCC[C@@]21c1ccccc1 ZINC001459677110 1062298720 /nfs/dbraw/zinc/29/87/20/1062298720.db2.gz OBNIWBUQEJACES-DNVCBOLYSA-N 1 2 314.379 4.261 20 0 DIADLO Fc1cncc(F)c1C[N@H+]1C[C@H]2CCCC[C@@]21c1ccccc1 ZINC001459677110 1062298733 /nfs/dbraw/zinc/29/87/33/1062298733.db2.gz OBNIWBUQEJACES-DNVCBOLYSA-N 1 2 314.379 4.261 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1)Nc1ccc(N2CCCC2)c[nH+]1 ZINC001474592024 1062304810 /nfs/dbraw/zinc/30/48/10/1062304810.db2.gz TVKKKHAIERMEIQ-CQSZACIVSA-N 1 2 315.848 4.378 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)N(C(=O)c3c(C)cc(C)[nH+]c3C)C2)cc1 ZINC001459700699 1062318569 /nfs/dbraw/zinc/31/85/69/1062318569.db2.gz XTJSTPNZMSQUEW-LPHOPBHVSA-N 1 2 322.452 4.333 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1CCOc2ccccc2[C@@H]1C ZINC001459718971 1062332216 /nfs/dbraw/zinc/33/22/16/1062332216.db2.gz OBVUEYPNTIHYCY-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1CCOc2ccccc2[C@@H]1C ZINC001459718971 1062332233 /nfs/dbraw/zinc/33/22/33/1062332233.db2.gz OBVUEYPNTIHYCY-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1ccc(F)c(Cl)c1 ZINC001459721868 1062333750 /nfs/dbraw/zinc/33/37/50/1062333750.db2.gz WIQABYGZXPPXFL-GFCCVEGCSA-N 1 2 305.780 4.435 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1ccc(F)c(Cl)c1 ZINC001459721868 1062333770 /nfs/dbraw/zinc/33/37/70/1062333770.db2.gz WIQABYGZXPPXFL-GFCCVEGCSA-N 1 2 305.780 4.435 20 0 DIADLO CCC[C@H]1CCC[N@@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001459738495 1062352306 /nfs/dbraw/zinc/35/23/06/1062352306.db2.gz DOJGNVWLAYRVMC-XJKSGUPXSA-N 1 2 309.837 4.066 20 0 DIADLO CCC[C@H]1CCC[N@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001459738495 1062352330 /nfs/dbraw/zinc/35/23/30/1062352330.db2.gz DOJGNVWLAYRVMC-XJKSGUPXSA-N 1 2 309.837 4.066 20 0 DIADLO Cc1ccc(N2CC[NH+](Cc3cscc3Cl)CC2)c(C)c1 ZINC001474640065 1062365166 /nfs/dbraw/zinc/36/51/66/1062365166.db2.gz XRSDTXLIVMAAGK-UHFFFAOYSA-N 1 2 320.889 4.341 20 0 DIADLO CCCC[C@@H](C)[NH2+][C@H](C(=O)OC(C)(C)C)[C@@H](C)OC(C)(C)C ZINC001255309746 1062390299 /nfs/dbraw/zinc/39/02/99/1062390299.db2.gz KOJSOIZQKGCTLP-KFWWJZLASA-N 1 2 315.498 4.069 20 0 DIADLO Cc1[nH]c(CN2Cc3ccccc3C[C@@H]2c2ccccc2)[nH+]c1C ZINC001459788971 1062398965 /nfs/dbraw/zinc/39/89/65/1062398965.db2.gz SPIKBSOPVIQKOQ-HXUWFJFHSA-N 1 2 317.436 4.326 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@@H+](Cc1cncc(Cl)c1)C2 ZINC001459789408 1062402444 /nfs/dbraw/zinc/40/24/44/1062402444.db2.gz HMCCBLKZEHWZLS-UHFFFAOYSA-N 1 2 316.832 4.082 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@H+](Cc1cncc(Cl)c1)C2 ZINC001459789408 1062402460 /nfs/dbraw/zinc/40/24/60/1062402460.db2.gz HMCCBLKZEHWZLS-UHFFFAOYSA-N 1 2 316.832 4.082 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+]1CCc2c(F)cc(F)cc2C1 ZINC001459798016 1062408693 /nfs/dbraw/zinc/40/86/93/1062408693.db2.gz RMKIZQCVWLUHTB-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+]1CCc2c(F)cc(F)cc2C1 ZINC001459798016 1062408705 /nfs/dbraw/zinc/40/87/05/1062408705.db2.gz RMKIZQCVWLUHTB-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1ccc(O)c(F)c1F)C(C)(C)C ZINC001474740890 1062456912 /nfs/dbraw/zinc/45/69/12/1062456912.db2.gz DKWWOKACZUATNU-QGZVFWFLSA-N 1 2 320.383 4.251 20 0 DIADLO Cc1ccc(C)c(C2CC[NH+](Cc3nn(C)cc3Cl)CC2)c1 ZINC001474741714 1062457535 /nfs/dbraw/zinc/45/75/35/1062457535.db2.gz WNPYPFHOTAWWGH-UHFFFAOYSA-N 1 2 317.864 4.070 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)[NH2+][C@H](c1ccccc1)C(F)F ZINC001474764217 1062468034 /nfs/dbraw/zinc/46/80/34/1062468034.db2.gz UVNMQKWRFOVFMS-YOEYROIRSA-N 1 2 319.332 4.305 20 0 DIADLO CCc1ccc(NC(=O)c2ccn3c(C)c[nH+]c3c2)cc1Cl ZINC001459901848 1062482970 /nfs/dbraw/zinc/48/29/70/1062482970.db2.gz QKMBUWOSJLPZIJ-UHFFFAOYSA-N 1 2 313.788 4.111 20 0 DIADLO Cc1cccc(C[N@@H+](C)[C@H](C)c2cccnc2)c1Br ZINC001459901612 1062483048 /nfs/dbraw/zinc/48/30/48/1062483048.db2.gz QEKDBWGLKMEPBJ-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cccc(C[N@H+](C)[C@H](C)c2cccnc2)c1Br ZINC001459901612 1062483054 /nfs/dbraw/zinc/48/30/54/1062483054.db2.gz QEKDBWGLKMEPBJ-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO C[C@H](CC(F)(F)F)[N@@H+]1CCO[C@@](C)(c2ccc(Cl)cc2)C1 ZINC001255654453 1062499417 /nfs/dbraw/zinc/49/94/17/1062499417.db2.gz DFQSXYWBLQMDAP-BXUZGUMPSA-N 1 2 321.770 4.228 20 0 DIADLO C[C@H](CC(F)(F)F)[N@H+]1CCO[C@@](C)(c2ccc(Cl)cc2)C1 ZINC001255654453 1062499428 /nfs/dbraw/zinc/49/94/28/1062499428.db2.gz DFQSXYWBLQMDAP-BXUZGUMPSA-N 1 2 321.770 4.228 20 0 DIADLO CCC[N@H+](Cc1c(C)cccc1Cl)[C@@H](CC)C(=O)OCC ZINC001459946779 1062516387 /nfs/dbraw/zinc/51/63/87/1062516387.db2.gz XUYAQZNKCVSQSM-INIZCTEOSA-N 1 2 311.853 4.202 20 0 DIADLO CCC[N@@H+](Cc1c(C)cccc1Cl)[C@@H](CC)C(=O)OCC ZINC001459946779 1062516404 /nfs/dbraw/zinc/51/64/04/1062516404.db2.gz XUYAQZNKCVSQSM-INIZCTEOSA-N 1 2 311.853 4.202 20 0 DIADLO CCC[C@@H](C)CCC[N@@H+]1CCOC[C@@H]1CC(=O)c1cccs1 ZINC001459971582 1062536805 /nfs/dbraw/zinc/53/68/05/1062536805.db2.gz MMYNVNRCEBDELV-CVEARBPZSA-N 1 2 323.502 4.238 20 0 DIADLO CCC[C@@H](C)CCC[N@H+]1CCOC[C@@H]1CC(=O)c1cccs1 ZINC001459971582 1062536821 /nfs/dbraw/zinc/53/68/21/1062536821.db2.gz MMYNVNRCEBDELV-CVEARBPZSA-N 1 2 323.502 4.238 20 0 DIADLO COC(=O)[C@@H](CC(C)C)[NH2+][C@H]1CC(C)(C)CCc2ccccc21 ZINC001460003661 1062559989 /nfs/dbraw/zinc/55/99/89/1062559989.db2.gz FWHZARDVRNBCCX-MSOLQXFVSA-N 1 2 317.473 4.268 20 0 DIADLO FC(F)(F)c1cccc([C@]2(F)CC[N@H+](C/C=C/Cl)C2)c1 ZINC001460003215 1062561706 /nfs/dbraw/zinc/56/17/06/1062561706.db2.gz NWUXPZCXCZJUFS-NHEDYWLLSA-N 1 2 307.718 4.328 20 0 DIADLO FC(F)(F)c1cccc([C@]2(F)CC[N@@H+](C/C=C/Cl)C2)c1 ZINC001460003215 1062561721 /nfs/dbraw/zinc/56/17/21/1062561721.db2.gz NWUXPZCXCZJUFS-NHEDYWLLSA-N 1 2 307.718 4.328 20 0 DIADLO C[C@H]1CN(c2ccccc2F)CC[N@@H+]1Cc1ccc(Cl)s1 ZINC001460051074 1062602599 /nfs/dbraw/zinc/60/25/99/1062602599.db2.gz ZPFDFSZZHJWIBH-LBPRGKRZSA-N 1 2 324.852 4.251 20 0 DIADLO C[C@H]1CN(c2ccccc2F)CC[N@H+]1Cc1ccc(Cl)s1 ZINC001460051074 1062602608 /nfs/dbraw/zinc/60/26/08/1062602608.db2.gz ZPFDFSZZHJWIBH-LBPRGKRZSA-N 1 2 324.852 4.251 20 0 DIADLO C[C@@H]1CN(c2ccccc2F)CC[N@@H+]1Cc1ccc(Cl)s1 ZINC001460051071 1062603924 /nfs/dbraw/zinc/60/39/24/1062603924.db2.gz ZPFDFSZZHJWIBH-GFCCVEGCSA-N 1 2 324.852 4.251 20 0 DIADLO C[C@@H]1CN(c2ccccc2F)CC[N@H+]1Cc1ccc(Cl)s1 ZINC001460051071 1062603938 /nfs/dbraw/zinc/60/39/38/1062603938.db2.gz ZPFDFSZZHJWIBH-GFCCVEGCSA-N 1 2 324.852 4.251 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1ccccc1C(F)(F)F)CCO2 ZINC001460079866 1062620694 /nfs/dbraw/zinc/62/06/94/1062620694.db2.gz CLFFUZSTWKMTLD-UHFFFAOYSA-N 1 2 321.342 4.408 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1ccccc1C(F)(F)F)CCO2 ZINC001460079866 1062620701 /nfs/dbraw/zinc/62/07/01/1062620701.db2.gz CLFFUZSTWKMTLD-UHFFFAOYSA-N 1 2 321.342 4.408 20 0 DIADLO CCC(CC)N(CC(C)C)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001476316520 1062632336 /nfs/dbraw/zinc/63/23/36/1062632336.db2.gz BKXSBKOMAHZOSJ-UHFFFAOYSA-N 1 2 320.481 4.135 20 0 DIADLO CCc1ccc([N@H+](CCCN2CCCC2=O)CC(C)(C)C)cc1 ZINC001460108303 1062642660 /nfs/dbraw/zinc/64/26/60/1062642660.db2.gz IFYJOQSDJZNUTG-UHFFFAOYSA-N 1 2 316.489 4.114 20 0 DIADLO CCc1ccc([N@@H+](CCCN2CCCC2=O)CC(C)(C)C)cc1 ZINC001460108303 1062642665 /nfs/dbraw/zinc/64/26/65/1062642665.db2.gz IFYJOQSDJZNUTG-UHFFFAOYSA-N 1 2 316.489 4.114 20 0 DIADLO CCCCC[C@@H]1CCCCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001476536058 1062677576 /nfs/dbraw/zinc/67/75/76/1062677576.db2.gz XKYSOUAQWGIGCA-MRXNPFEDSA-N 1 2 314.433 4.301 20 0 DIADLO CC(C)c1cccc(N(C)C(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC001476535872 1062677793 /nfs/dbraw/zinc/67/77/93/1062677793.db2.gz QSXORMSYTKXFAJ-UHFFFAOYSA-N 1 2 308.385 4.126 20 0 DIADLO CCc1cccc(N(C)Cc2c[nH+]c(N(C)C)c3ccccc23)c1 ZINC001460200769 1062695422 /nfs/dbraw/zinc/69/54/22/1062695422.db2.gz CMWHDWVTUMUBSB-UHFFFAOYSA-N 1 2 319.452 4.500 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC001460201476 1062696396 /nfs/dbraw/zinc/69/63/96/1062696396.db2.gz HUMKBFNKDZHXJI-WBVHZDCISA-N 1 2 315.457 4.334 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC001460201476 1062696402 /nfs/dbraw/zinc/69/64/02/1062696402.db2.gz HUMKBFNKDZHXJI-WBVHZDCISA-N 1 2 315.457 4.334 20 0 DIADLO Cc1cncc([C@H]2CCCN2C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC001476699130 1062702926 /nfs/dbraw/zinc/70/29/26/1062702926.db2.gz PYDPYOIESCVMNH-QGZVFWFLSA-N 1 2 324.428 4.079 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@H]2c2ccc(F)cc2)c(C)[nH+]1 ZINC001476698077 1062703685 /nfs/dbraw/zinc/70/36/85/1062703685.db2.gz DOIDHYSIAWULNK-MRXNPFEDSA-N 1 2 313.376 4.125 20 0 DIADLO Cc1cc(C)c(NC(=O)NC2CCC(C(C)C)CC2)c(C)[nH+]1 ZINC001476698532 1062703780 /nfs/dbraw/zinc/70/37/80/1062703780.db2.gz XNEGBWQWKYYYNF-UHFFFAOYSA-N 1 2 303.450 4.343 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@H]2c2ccc(F)cc2)c(C)[nH+]1 ZINC001476698074 1062703826 /nfs/dbraw/zinc/70/38/26/1062703826.db2.gz DOIDHYSIAWULNK-INIZCTEOSA-N 1 2 313.376 4.125 20 0 DIADLO CCc1ccccc1C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC001460273043 1062749712 /nfs/dbraw/zinc/74/97/12/1062749712.db2.gz PSOHIKCBNCLXLZ-UHFFFAOYSA-N 1 2 319.408 4.116 20 0 DIADLO CC[C@H]1C[N@H+](CCc2c(Cl)cccc2Cl)[C@H](C)CO1 ZINC001460338810 1062794988 /nfs/dbraw/zinc/79/49/88/1062794988.db2.gz MRVDMYQGZWXZTJ-NEPJUHHUSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)[C@H](C)CO1 ZINC001460338810 1062795005 /nfs/dbraw/zinc/79/50/05/1062795005.db2.gz MRVDMYQGZWXZTJ-NEPJUHHUSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1C[N@H+](CCc2cccc(Cl)c2Cl)[C@@H](CC)CO1 ZINC001460371936 1062819670 /nfs/dbraw/zinc/81/96/70/1062819670.db2.gz RGERLBXUOBCPFV-UONOGXRCSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)[C@@H](CC)CO1 ZINC001460371936 1062819694 /nfs/dbraw/zinc/81/96/94/1062819694.db2.gz RGERLBXUOBCPFV-UONOGXRCSA-N 1 2 316.272 4.425 20 0 DIADLO Cc1ccc(C(C)(C)CNC(=O)c2c(C)cc(C)[nH+]c2C)c(C)c1 ZINC001460432951 1062853568 /nfs/dbraw/zinc/85/35/68/1062853568.db2.gz PPDXZFDLRMZTJY-UHFFFAOYSA-N 1 2 324.468 4.331 20 0 DIADLO CC(C)(CC[N@@H+]1CCOC[C@@H]1c1cc(F)cc(F)c1)C1CC1 ZINC001460438683 1062856790 /nfs/dbraw/zinc/85/67/90/1062856790.db2.gz ABFOTZZIMOZYNQ-QGZVFWFLSA-N 1 2 309.400 4.164 20 0 DIADLO CC(C)(CC[N@H+]1CCOC[C@@H]1c1cc(F)cc(F)c1)C1CC1 ZINC001460438683 1062856818 /nfs/dbraw/zinc/85/68/18/1062856818.db2.gz ABFOTZZIMOZYNQ-QGZVFWFLSA-N 1 2 309.400 4.164 20 0 DIADLO CC(C)c1cccc(C[N@@H+]2C[C@H](C)O[C@@H](CC(F)(F)F)C2)c1 ZINC001460487587 1062876875 /nfs/dbraw/zinc/87/68/75/1062876875.db2.gz WZFAINBKUUGODZ-BBRMVZONSA-N 1 2 315.379 4.352 20 0 DIADLO CC(C)c1cccc(C[N@H+]2C[C@H](C)O[C@@H](CC(F)(F)F)C2)c1 ZINC001460487587 1062876890 /nfs/dbraw/zinc/87/68/90/1062876890.db2.gz WZFAINBKUUGODZ-BBRMVZONSA-N 1 2 315.379 4.352 20 0 DIADLO Cc1cc(N2CCC=C(Br)C2)[nH+]c2ccccc12 ZINC001256567982 1062895926 /nfs/dbraw/zinc/89/59/26/1062895926.db2.gz RGJGQKVZNKQOMT-UHFFFAOYSA-N 1 2 303.203 4.032 20 0 DIADLO CCC(CC)CCC[N@H+](C)[C@H](C(=O)OC)c1ccc(F)cc1 ZINC001460526593 1062899264 /nfs/dbraw/zinc/89/92/64/1062899264.db2.gz CTSLLFGETFABQK-KRWDZBQOSA-N 1 2 309.425 4.188 20 0 DIADLO CCC(CC)CCC[N@@H+](C)[C@H](C(=O)OC)c1ccc(F)cc1 ZINC001460526593 1062899279 /nfs/dbraw/zinc/89/92/79/1062899279.db2.gz CTSLLFGETFABQK-KRWDZBQOSA-N 1 2 309.425 4.188 20 0 DIADLO CC(C)Oc1cccc(C[NH2+][C@@H](CF)c2ccc(F)cc2)c1 ZINC001460659582 1062969184 /nfs/dbraw/zinc/96/91/84/1062969184.db2.gz QRGRFRUVCPXOQD-SFHVURJKSA-N 1 2 305.368 4.413 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3ccc(Cl)c(C)c3C2)sc1C ZINC001460665706 1062972421 /nfs/dbraw/zinc/97/24/21/1062972421.db2.gz LFBFDGBHJARGCC-UHFFFAOYSA-N 1 2 306.862 4.280 20 0 DIADLO Cc1nc(C[N@H+]2CCc3ccc(Cl)c(C)c3C2)sc1C ZINC001460665706 1062972443 /nfs/dbraw/zinc/97/24/43/1062972443.db2.gz LFBFDGBHJARGCC-UHFFFAOYSA-N 1 2 306.862 4.280 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@H+](Cc1cc(F)cc(F)c1)CC2 ZINC001460666986 1062973008 /nfs/dbraw/zinc/97/30/08/1062973008.db2.gz SFRPWGVZMZQQHK-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@@H+](Cc1cc(F)cc(F)c1)CC2 ZINC001460666986 1062973027 /nfs/dbraw/zinc/97/30/27/1062973027.db2.gz SFRPWGVZMZQQHK-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@H+](Cc1cc(C)ccc1C)C3 ZINC001460698654 1062994629 /nfs/dbraw/zinc/99/46/29/1062994629.db2.gz GEDTWIBNYDMGHR-UHFFFAOYSA-N 1 2 320.436 4.352 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@@H+](Cc1cc(C)ccc1C)C3 ZINC001460698654 1062994650 /nfs/dbraw/zinc/99/46/50/1062994650.db2.gz GEDTWIBNYDMGHR-UHFFFAOYSA-N 1 2 320.436 4.352 20 0 DIADLO CCC[C@H](C)CCC[NH2+][C@](C)(Cc1ccc(F)cc1)C(=O)OC ZINC001460707057 1063003531 /nfs/dbraw/zinc/00/35/31/1063003531.db2.gz PWWUGGZWOFPLNI-HNAYVOBHSA-N 1 2 323.452 4.106 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC001460730121 1063024601 /nfs/dbraw/zinc/02/46/01/1063024601.db2.gz NVARAESVFDZFNV-BFVZDQMLSA-N 1 2 323.305 4.068 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC001460730121 1063024615 /nfs/dbraw/zinc/02/46/15/1063024615.db2.gz NVARAESVFDZFNV-BFVZDQMLSA-N 1 2 323.305 4.068 20 0 DIADLO FC(F)[C@@H]1C[N@H+](Cc2ccc(C3CCCCC3)cc2)CCO1 ZINC001460749017 1063036573 /nfs/dbraw/zinc/03/65/73/1063036573.db2.gz ZZRSVGMBADINKD-KRWDZBQOSA-N 1 2 309.400 4.200 20 0 DIADLO FC(F)[C@@H]1C[N@@H+](Cc2ccc(C3CCCCC3)cc2)CCO1 ZINC001460749017 1063036596 /nfs/dbraw/zinc/03/65/96/1063036596.db2.gz ZZRSVGMBADINKD-KRWDZBQOSA-N 1 2 309.400 4.200 20 0 DIADLO CCC[C@@H](C)CCC[N@@H+]1CCOC[C@H]1c1ccc(COC)o1 ZINC001460819981 1063078926 /nfs/dbraw/zinc/07/89/26/1063078926.db2.gz RTRRMODKVWMLTD-WBVHZDCISA-N 1 2 309.450 4.016 20 0 DIADLO CCC[C@@H](C)CCC[N@H+]1CCOC[C@H]1c1ccc(COC)o1 ZINC001460819981 1063078943 /nfs/dbraw/zinc/07/89/43/1063078943.db2.gz RTRRMODKVWMLTD-WBVHZDCISA-N 1 2 309.450 4.016 20 0 DIADLO CC(C)C[C@H](C)CC(=O)N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC001472532983 1063097810 /nfs/dbraw/zinc/09/78/10/1063097810.db2.gz OFAWVQZYURTMBZ-HOTGVXAUSA-N 1 2 313.445 4.122 20 0 DIADLO Cc1cccc(C2(C(=O)NCc3c[nH+]c(C)cc3C)CCCC2)c1 ZINC001460889676 1063116506 /nfs/dbraw/zinc/11/65/06/1063116506.db2.gz HWSRWZONWGYAFX-UHFFFAOYSA-N 1 2 322.452 4.135 20 0 DIADLO CCc1cc(NCCc2cccc3ccccc32)nc(CC)[nH+]1 ZINC001472689705 1063152503 /nfs/dbraw/zinc/15/25/03/1063152503.db2.gz WEBAEVFZTBEMNK-UHFFFAOYSA-N 1 2 305.425 4.409 20 0 DIADLO CCC[C@H](CC)[NH2+][C@H](C(=O)OC(C)(C)C)[C@@H](C)OC(C)(C)C ZINC001257243744 1063154647 /nfs/dbraw/zinc/15/46/47/1063154647.db2.gz DNUGCGKNQWTGKK-ILXRZTDVSA-N 1 2 315.498 4.069 20 0 DIADLO CCc1cc(N2CCC[C@H]2c2ccc(F)c(F)c2)nc(CC)[nH+]1 ZINC001472696606 1063158615 /nfs/dbraw/zinc/15/86/15/1063158615.db2.gz MTAQVOMGRDFVMD-INIZCTEOSA-N 1 2 317.383 4.221 20 0 DIADLO CCc1ccc2c(c1)CC[N@@H+](Cc1ccc(C)c(Cl)n1)C2 ZINC001460975099 1063164542 /nfs/dbraw/zinc/16/45/42/1063164542.db2.gz NTCNLVLLTLYYBY-UHFFFAOYSA-N 1 2 300.833 4.164 20 0 DIADLO CCc1ccc2c(c1)CC[N@H+](Cc1ccc(C)c(Cl)n1)C2 ZINC001460975099 1063164558 /nfs/dbraw/zinc/16/45/58/1063164558.db2.gz NTCNLVLLTLYYBY-UHFFFAOYSA-N 1 2 300.833 4.164 20 0 DIADLO COc1ccc2cc(CC[C@H](C)[N@H+](C)CC(F)F)ccc2c1 ZINC001257285005 1063179954 /nfs/dbraw/zinc/17/99/54/1063179954.db2.gz LEHKISBMKOWLNB-ZDUSSCGKSA-N 1 2 307.384 4.366 20 0 DIADLO COc1ccc2cc(CC[C@H](C)[N@@H+](C)CC(F)F)ccc2c1 ZINC001257285005 1063179966 /nfs/dbraw/zinc/17/99/66/1063179966.db2.gz LEHKISBMKOWLNB-ZDUSSCGKSA-N 1 2 307.384 4.366 20 0 DIADLO COCCC1(CNc2cc(C)[nH+]c(C3CCC3)n2)CCCC1 ZINC001472722081 1063182172 /nfs/dbraw/zinc/18/21/72/1063182172.db2.gz WYMKYJWSXVGJFH-UHFFFAOYSA-N 1 2 303.450 4.061 20 0 DIADLO Cc1cc(CNC(=O)c2ccc(Cl)c3occc32)cc(C)[nH+]1 ZINC001461006828 1063183911 /nfs/dbraw/zinc/18/39/11/1063183911.db2.gz HDMBWLNNWFSYPG-UHFFFAOYSA-N 1 2 314.772 4.028 20 0 DIADLO Cc1cc(N(Cc2c(F)cccc2F)C2CC2)nc(C2CC2)[nH+]1 ZINC001472757072 1063209916 /nfs/dbraw/zinc/20/99/16/1063209916.db2.gz NSKNJDZMSRDBQA-UHFFFAOYSA-N 1 2 315.367 4.110 20 0 DIADLO CCCC(CCC)[NH2+][C@H](C[NH3+])c1ccc(Br)cc1 ZINC001257330640 1063212817 /nfs/dbraw/zinc/21/28/17/1063212817.db2.gz UBALFZIHTRHWBT-OAHLLOKOSA-N 1 2 313.283 4.007 20 0 DIADLO CCc1cc(NCc2c(F)cccc2SC)nc(CC)[nH+]1 ZINC001472778222 1063227883 /nfs/dbraw/zinc/22/78/83/1063227883.db2.gz ATUOJHFTLQNEAM-UHFFFAOYSA-N 1 2 305.422 4.075 20 0 DIADLO Fc1ccc(/C=C\CNc2ccc(N3CCCCC3)c[nH+]2)cc1 ZINC001461079936 1063238769 /nfs/dbraw/zinc/23/87/69/1063238769.db2.gz VQFBZFOPRLUWEU-PLNGDYQASA-N 1 2 311.404 4.336 20 0 DIADLO CCOc1ccc(NCc2cc(C)[nH+]c3c2CCCC3)cc1F ZINC001461084538 1063241119 /nfs/dbraw/zinc/24/11/19/1063241119.db2.gz ATOWTBDJCCSMPO-UHFFFAOYSA-N 1 2 314.404 4.419 20 0 DIADLO COc1c(F)cc(NCc2cc(C)[nH+]c3c2CCCC3)cc1F ZINC001461087412 1063245792 /nfs/dbraw/zinc/24/57/92/1063245792.db2.gz RLBVWBYYCYCLQI-UHFFFAOYSA-N 1 2 318.367 4.168 20 0 DIADLO CCCCOC(=O)CC[C@@H](C)[N@@H+]1Cc2cccc(Cl)c2C1 ZINC001257403920 1063254740 /nfs/dbraw/zinc/25/47/40/1063254740.db2.gz YMLKIFKIQWTVTI-CYBMUJFWSA-N 1 2 309.837 4.168 20 0 DIADLO CCCCOC(=O)CC[C@@H](C)[N@H+]1Cc2cccc(Cl)c2C1 ZINC001257403920 1063254759 /nfs/dbraw/zinc/25/47/59/1063254759.db2.gz YMLKIFKIQWTVTI-CYBMUJFWSA-N 1 2 309.837 4.168 20 0 DIADLO CCCC[C@H](CC)[NH2+][C@@H](c1nnc(C)o1)c1ccccc1OC ZINC001257416634 1063265719 /nfs/dbraw/zinc/26/57/19/1063265719.db2.gz NSDFCCNGDBHDCD-WMLDXEAASA-N 1 2 317.433 4.034 20 0 DIADLO Cc1cc(N[C@@H]2C[C@@H](OC(C)(C)C)C23CCC3)nc(C2CC2)[nH+]1 ZINC001472831851 1063273777 /nfs/dbraw/zinc/27/37/77/1063273777.db2.gz USCLPEFNCIBCAG-HUUCEWRRSA-N 1 2 315.461 4.201 20 0 DIADLO CC(C)c1cc(N[C@@H](C2CCC2)[C@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC001472856581 1063284519 /nfs/dbraw/zinc/28/45/19/1063284519.db2.gz CLUHJIOIXCGEQK-YJBOKZPZSA-N 1 2 317.477 4.341 20 0 DIADLO CC(C)c1cc(N[C@H](C2CCC2)[C@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC001472856579 1063284691 /nfs/dbraw/zinc/28/46/91/1063284691.db2.gz CLUHJIOIXCGEQK-MAUKXSAKSA-N 1 2 317.477 4.341 20 0 DIADLO FC[C@H](Nc1nc2ccccc2n2c[nH+]cc12)c1ccc(F)cc1 ZINC001472858574 1063288062 /nfs/dbraw/zinc/28/80/62/1063288062.db2.gz DNRPVRSKAGVSCB-HNNXBMFYSA-N 1 2 324.334 4.144 20 0 DIADLO Cc1cc(N[C@@H]2CCOc3c(F)cccc32)nc(C2CCC2)[nH+]1 ZINC001472890605 1063300831 /nfs/dbraw/zinc/30/08/31/1063300831.db2.gz HAMXPRDUTVSBAD-OAHLLOKOSA-N 1 2 313.376 4.127 20 0 DIADLO C(=C/c1ccc(Cn2cc[nH+]c2)cc1)\c1nnc(C2CCCC2)o1 ZINC001257489893 1063309023 /nfs/dbraw/zinc/30/90/23/1063309023.db2.gz PUJWROHVWBRJQT-MDZDMXLPSA-N 1 2 320.396 4.142 20 0 DIADLO CC(C)[N@@H+]1CC[C@H]1c1nnc([C@@H]2C[C@@H]2c2ccc(Cl)cc2)o1 ZINC001257685255 1063369418 /nfs/dbraw/zinc/36/94/18/1063369418.db2.gz WWAOSYBWTPTWIQ-KFWWJZLASA-N 1 2 317.820 4.149 20 0 DIADLO CC(C)[N@H+]1CC[C@H]1c1nnc([C@@H]2C[C@@H]2c2ccc(Cl)cc2)o1 ZINC001257685255 1063369437 /nfs/dbraw/zinc/36/94/37/1063369437.db2.gz WWAOSYBWTPTWIQ-KFWWJZLASA-N 1 2 317.820 4.149 20 0 DIADLO Cc1cnc(SCc2ccc(-n3cc[nH+]c3)cc2C)c(C)c1 ZINC001473060311 1063381313 /nfs/dbraw/zinc/38/13/13/1063381313.db2.gz YVFXXVLABRAMTP-UHFFFAOYSA-N 1 2 309.438 4.485 20 0 DIADLO COc1ccc(C[NH2+][C@H](C)c2c(F)cccc2Cl)c(F)c1 ZINC001461282628 1063388266 /nfs/dbraw/zinc/38/82/66/1063388266.db2.gz DMSUZSNHZAQAHN-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1CCc1cccc(Cl)c1Cl ZINC001473105506 1063400867 /nfs/dbraw/zinc/40/08/67/1063400867.db2.gz MCBBGYKTQYCWGQ-WCQYABFASA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1CCc1cccc(Cl)c1Cl ZINC001473105506 1063400884 /nfs/dbraw/zinc/40/08/84/1063400884.db2.gz MCBBGYKTQYCWGQ-WCQYABFASA-N 1 2 302.245 4.035 20 0 DIADLO Fc1cccc(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)c1F ZINC001461313908 1063410828 /nfs/dbraw/zinc/41/08/28/1063410828.db2.gz MQGQTZKKPSKQNW-UHFFFAOYSA-N 1 2 319.742 4.416 20 0 DIADLO C[C@H]1CCCC[C@H]1CNc1ccccc1OCCn1cc[nH+]c1 ZINC001461324786 1063418776 /nfs/dbraw/zinc/41/87/76/1063418776.db2.gz PESQMQJKGUJFSH-IRXDYDNUSA-N 1 2 313.445 4.200 20 0 DIADLO COCC[N@@H+](CC=C(Cl)Cl)Cc1ccc(C)cc1C ZINC001473126699 1063433904 /nfs/dbraw/zinc/43/39/04/1063433904.db2.gz XXHKFXWCBTXRIF-UHFFFAOYSA-N 1 2 302.245 4.071 20 0 DIADLO Cc1cc(NCc2ccc3c(c2)CCCO3)ccc1-n1cc[nH+]c1 ZINC001461330878 1063424897 /nfs/dbraw/zinc/42/48/97/1063424897.db2.gz FZOUALZZOAUXQB-UHFFFAOYSA-N 1 2 319.408 4.118 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)c2cccc3ccccc32)c1C ZINC001473125331 1063429691 /nfs/dbraw/zinc/42/96/91/1063429691.db2.gz RHNFYAVMBWAKQV-UHFFFAOYSA-N 1 2 306.409 4.497 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+](C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC001473128939 1063433072 /nfs/dbraw/zinc/43/30/72/1063433072.db2.gz YQOYWFXJGWSRRV-WDEREUQCSA-N 1 2 318.244 4.328 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+](C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC001473128939 1063433079 /nfs/dbraw/zinc/43/30/79/1063433079.db2.gz YQOYWFXJGWSRRV-WDEREUQCSA-N 1 2 318.244 4.328 20 0 DIADLO COCC[N@H+](CC=C(Cl)Cl)Cc1ccc(C)cc1C ZINC001473126699 1063433889 /nfs/dbraw/zinc/43/38/89/1063433889.db2.gz XXHKFXWCBTXRIF-UHFFFAOYSA-N 1 2 302.245 4.071 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC001473130448 1063436686 /nfs/dbraw/zinc/43/66/86/1063436686.db2.gz ZONPJSFWXLCPEG-MRXNPFEDSA-N 1 2 323.436 4.271 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC001473130448 1063436696 /nfs/dbraw/zinc/43/66/96/1063436696.db2.gz ZONPJSFWXLCPEG-MRXNPFEDSA-N 1 2 323.436 4.271 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@@H+]1Cc2ccc(C(=O)OC)cc2C1 ZINC001473153350 1063455951 /nfs/dbraw/zinc/45/59/51/1063455951.db2.gz CMYLXYSEASMUOV-GOSISDBHSA-N 1 2 313.372 4.079 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@H+]1Cc2ccc(C(=O)OC)cc2C1 ZINC001473153350 1063455958 /nfs/dbraw/zinc/45/59/58/1063455958.db2.gz CMYLXYSEASMUOV-GOSISDBHSA-N 1 2 313.372 4.079 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@H](C)C[C@@H](C)CC(C)C)[C@H]2C ZINC001258066424 1063493824 /nfs/dbraw/zinc/49/38/24/1063493824.db2.gz QKRVKAFDYLCIRG-BBWFWOEESA-N 1 2 321.509 4.257 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@H](C)C[C@@H](C)CC(C)C)[C@H]2C ZINC001258066424 1063493833 /nfs/dbraw/zinc/49/38/33/1063493833.db2.gz QKRVKAFDYLCIRG-BBWFWOEESA-N 1 2 321.509 4.257 20 0 DIADLO CC(C)C[C@@H](C)C[C@@H](C)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258070321 1063497347 /nfs/dbraw/zinc/49/73/47/1063497347.db2.gz PBOVWWLTAPSCDT-CHWSQXEVSA-N 1 2 317.399 4.178 20 0 DIADLO CC(C)C[C@@H](C)C[C@@H](C)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258070321 1063497363 /nfs/dbraw/zinc/49/73/63/1063497363.db2.gz PBOVWWLTAPSCDT-CHWSQXEVSA-N 1 2 317.399 4.178 20 0 DIADLO COc1cccc(NCc2cc(C)[nH+]c3c2CCCC3)c1F ZINC001461448397 1063512039 /nfs/dbraw/zinc/51/20/39/1063512039.db2.gz PAWBCLSNIAGOPN-UHFFFAOYSA-N 1 2 300.377 4.029 20 0 DIADLO OCc1cc[nH+]c(NCc2ccc(-c3ccccc3Cl)o2)c1 ZINC001461592821 1063601755 /nfs/dbraw/zinc/60/17/55/1063601755.db2.gz GDBFBGWCTVQBIC-UHFFFAOYSA-N 1 2 314.772 4.099 20 0 DIADLO COc1c(C)cccc1C[NH2+]Cc1c(F)ccc(F)c1Cl ZINC001461602783 1063605653 /nfs/dbraw/zinc/60/56/53/1063605653.db2.gz BNKFHEGJLZOUTD-UHFFFAOYSA-N 1 2 311.759 4.225 20 0 DIADLO CCOc1ccc(C[NH2+]Cc2c(Cl)oc3ccccc32)o1 ZINC001461629315 1063624671 /nfs/dbraw/zinc/62/46/71/1063624671.db2.gz NPDOGHIILSWREE-UHFFFAOYSA-N 1 2 305.761 4.368 20 0 DIADLO Cc1cc(C)c(C[NH2+]C[C@H]2CC[N@@H+]2C2CCCCC2)c(C)c1 ZINC001461645170 1063632884 /nfs/dbraw/zinc/63/28/84/1063632884.db2.gz JZFUDRLLBIAALQ-LJQANCHMSA-N 1 2 300.490 4.108 20 0 DIADLO Cc1cc(C)c(C[NH2+]C[C@H]2CC[N@H+]2C2CCCCC2)c(C)c1 ZINC001461645170 1063632890 /nfs/dbraw/zinc/63/28/90/1063632890.db2.gz JZFUDRLLBIAALQ-LJQANCHMSA-N 1 2 300.490 4.108 20 0 DIADLO CC(C)(C)C(F)(F)C[NH2+]Cc1cc(Br)cs1 ZINC001461655665 1063640628 /nfs/dbraw/zinc/64/06/28/1063640628.db2.gz YOMMJSNIRUKDKT-UHFFFAOYSA-N 1 2 312.223 4.282 20 0 DIADLO Cc1c2cccc(Cl)c2sc1C[NH2+]Cc1csnn1 ZINC001461673675 1063651397 /nfs/dbraw/zinc/65/13/97/1063651397.db2.gz VNUOOVHGMNOCDJ-UHFFFAOYSA-N 1 2 309.847 4.004 20 0 DIADLO C[C@@H]1CCc2nc(C[NH2+]Cc3ccc(C(C)(C)C)o3)sc2C1 ZINC001461696532 1063662045 /nfs/dbraw/zinc/66/20/45/1063662045.db2.gz CBGASXBJUNKIDU-GFCCVEGCSA-N 1 2 318.486 4.448 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC001461749905 1063694269 /nfs/dbraw/zinc/69/42/69/1063694269.db2.gz YWZSBGROMCIEFJ-QZTJIDSGSA-N 1 2 319.408 4.247 20 0 DIADLO CC1(C)CC[C@@H]([N@@H+]2CCCC[C@@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258604389 1063703922 /nfs/dbraw/zinc/70/39/22/1063703922.db2.gz CAZWQAFJCYOBQY-GHMZBOCLSA-N 1 2 317.355 4.194 20 0 DIADLO CC1(C)CC[C@@H]([N@H+]2CCCC[C@@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258604389 1063703932 /nfs/dbraw/zinc/70/39/32/1063703932.db2.gz CAZWQAFJCYOBQY-GHMZBOCLSA-N 1 2 317.355 4.194 20 0 DIADLO CC1(C)CC[C@H]([N@@H+]2CCCC[C@@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258604392 1063706137 /nfs/dbraw/zinc/70/61/37/1063706137.db2.gz CAZWQAFJCYOBQY-WDEREUQCSA-N 1 2 317.355 4.194 20 0 DIADLO CC1(C)CC[C@H]([N@H+]2CCCC[C@@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258604392 1063706146 /nfs/dbraw/zinc/70/61/46/1063706146.db2.gz CAZWQAFJCYOBQY-WDEREUQCSA-N 1 2 317.355 4.194 20 0 DIADLO c1cn(-c2ccc(CNc3ccc(-c4ccon4)cc3)cc2)c[nH+]1 ZINC001461773926 1063708211 /nfs/dbraw/zinc/70/82/11/1063708211.db2.gz FGBMCLGVXQCLLQ-UHFFFAOYSA-N 1 2 316.364 4.139 20 0 DIADLO Clc1cccc(Oc2ccnc(C[NH2+]Cc3ccco3)c2)c1 ZINC001461792375 1063721347 /nfs/dbraw/zinc/72/13/47/1063721347.db2.gz DQFOWGAVNUYIIH-UHFFFAOYSA-N 1 2 314.772 4.410 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1ccc(C)c(F)c1 ZINC001461832125 1063740983 /nfs/dbraw/zinc/74/09/83/1063740983.db2.gz SNFAWUBSQZDWTC-UHFFFAOYSA-N 1 2 301.340 4.255 20 0 DIADLO CCOc1cc(C[N@@H+]2CC[C@@H]2c2ccccc2)cc(Cl)c1O ZINC001461839555 1063743690 /nfs/dbraw/zinc/74/36/90/1063743690.db2.gz VUCPRMKHAPGDSI-MRXNPFEDSA-N 1 2 317.816 4.391 20 0 DIADLO CCOc1cc(C[N@H+]2CC[C@@H]2c2ccccc2)cc(Cl)c1O ZINC001461839555 1063743699 /nfs/dbraw/zinc/74/36/99/1063743699.db2.gz VUCPRMKHAPGDSI-MRXNPFEDSA-N 1 2 317.816 4.391 20 0 DIADLO Clc1csc(C[N@@H+]2CC[C@H](CSc3ccccc3)C2)n1 ZINC001461845554 1063749267 /nfs/dbraw/zinc/74/92/67/1063749267.db2.gz QTONMULRSSNEFR-LBPRGKRZSA-N 1 2 324.902 4.411 20 0 DIADLO Clc1csc(C[N@H+]2CC[C@H](CSc3ccccc3)C2)n1 ZINC001461845554 1063749277 /nfs/dbraw/zinc/74/92/77/1063749277.db2.gz QTONMULRSSNEFR-LBPRGKRZSA-N 1 2 324.902 4.411 20 0 DIADLO CCCn1nccc1C[N@@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC001461880088 1063769197 /nfs/dbraw/zinc/76/91/97/1063769197.db2.gz IYQLINQJNZHUPF-UHFFFAOYSA-N 1 2 321.424 4.111 20 0 DIADLO CCCn1nccc1C[N@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC001461880088 1063769213 /nfs/dbraw/zinc/76/92/13/1063769213.db2.gz IYQLINQJNZHUPF-UHFFFAOYSA-N 1 2 321.424 4.111 20 0 DIADLO CC(C)C1(C[N@@H+]2CCO[C@H](c3ccc(F)c(Cl)c3)C2)CC1 ZINC001461909294 1063790864 /nfs/dbraw/zinc/79/08/64/1063790864.db2.gz MMKVOBSWFOEFQY-INIZCTEOSA-N 1 2 311.828 4.289 20 0 DIADLO CC(C)C1(C[N@H+]2CCO[C@H](c3ccc(F)c(Cl)c3)C2)CC1 ZINC001461909294 1063790878 /nfs/dbraw/zinc/79/08/78/1063790878.db2.gz MMKVOBSWFOEFQY-INIZCTEOSA-N 1 2 311.828 4.289 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2[C@H](C)Cc2cccc(Cl)c2)no1 ZINC001258750170 1063796938 /nfs/dbraw/zinc/79/69/38/1063796938.db2.gz PYHGDCALJYBRTG-MLGOLLRUSA-N 1 2 319.836 4.190 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2[C@H](C)Cc2cccc(Cl)c2)no1 ZINC001258750170 1063796946 /nfs/dbraw/zinc/79/69/46/1063796946.db2.gz PYHGDCALJYBRTG-MLGOLLRUSA-N 1 2 319.836 4.190 20 0 DIADLO CC(C)C[C@@H]1CCC[N@H+](Cc2nc(Br)cs2)C1 ZINC001461915118 1063798760 /nfs/dbraw/zinc/79/87/60/1063798760.db2.gz PFUVYCUVQWEDBK-NSHDSACASA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)C[C@@H]1CCC[N@@H+](Cc2nc(Br)cs2)C1 ZINC001461915118 1063798769 /nfs/dbraw/zinc/79/87/69/1063798769.db2.gz PFUVYCUVQWEDBK-NSHDSACASA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2C[C@@H](C)OC[C@@H]2c2ccccc2)cn1 ZINC001461920964 1063803490 /nfs/dbraw/zinc/80/34/90/1063803490.db2.gz HAQFGETZMFGZIP-DYESRHJHSA-N 1 2 324.468 4.242 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2C[C@@H](C)OC[C@@H]2c2ccccc2)cn1 ZINC001461920964 1063803510 /nfs/dbraw/zinc/80/35/10/1063803510.db2.gz HAQFGETZMFGZIP-DYESRHJHSA-N 1 2 324.468 4.242 20 0 DIADLO Clc1cccc(Cl)c1CCC[N@@H+]1CCOC[C@@H]1C1CC1 ZINC001461920906 1063805142 /nfs/dbraw/zinc/80/51/42/1063805142.db2.gz NKSBBSWNFOVPSG-MRXNPFEDSA-N 1 2 314.256 4.037 20 0 DIADLO Clc1cccc(Cl)c1CCC[N@H+]1CCOC[C@@H]1C1CC1 ZINC001461920906 1063805153 /nfs/dbraw/zinc/80/51/53/1063805153.db2.gz NKSBBSWNFOVPSG-MRXNPFEDSA-N 1 2 314.256 4.037 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)c(F)c1 ZINC001461922382 1063805297 /nfs/dbraw/zinc/80/52/97/1063805297.db2.gz XXYURXAWFSJUTK-DYVFJYSZSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)c(F)c1 ZINC001461922382 1063805311 /nfs/dbraw/zinc/80/53/11/1063805311.db2.gz XXYURXAWFSJUTK-DYVFJYSZSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1nn(C)c(C[N@@H+](C)[C@H](C)c2ccc(C)cc2C)c1Cl ZINC001461938277 1063823365 /nfs/dbraw/zinc/82/33/65/1063823365.db2.gz LSKHCTTUTFEAAI-CQSZACIVSA-N 1 2 305.853 4.192 20 0 DIADLO Cc1nn(C)c(C[N@H+](C)[C@H](C)c2ccc(C)cc2C)c1Cl ZINC001461938277 1063823375 /nfs/dbraw/zinc/82/33/75/1063823375.db2.gz LSKHCTTUTFEAAI-CQSZACIVSA-N 1 2 305.853 4.192 20 0 DIADLO CCOCc1cnc2n1CC[N@H+](C1CCC(C(C)C)CC1)[C@@H]2C ZINC001258803932 1063835492 /nfs/dbraw/zinc/83/54/92/1063835492.db2.gz IAUHLAXDPMNMBV-KLAILNCOSA-N 1 2 319.493 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+](C1CCC(C(C)C)CC1)[C@@H]2C ZINC001258803932 1063835501 /nfs/dbraw/zinc/83/55/01/1063835501.db2.gz IAUHLAXDPMNMBV-KLAILNCOSA-N 1 2 319.493 4.011 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(F)c(Cl)c2Cl)CCS1 ZINC001461958383 1063838074 /nfs/dbraw/zinc/83/80/74/1063838074.db2.gz JPQOZMUYAMSFQR-SNVBAGLBSA-N 1 2 308.249 4.460 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(F)c(Cl)c2Cl)CCS1 ZINC001461958383 1063838086 /nfs/dbraw/zinc/83/80/86/1063838086.db2.gz JPQOZMUYAMSFQR-SNVBAGLBSA-N 1 2 308.249 4.460 20 0 DIADLO CCOCc1cnc2n1CC[N@H+](C(CC(C)C)CC(C)C)[C@@H]2C ZINC001258834786 1063857068 /nfs/dbraw/zinc/85/70/68/1063857068.db2.gz NPSJLWHEICVQGW-MRXNPFEDSA-N 1 2 321.509 4.257 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+](C(CC(C)C)CC(C)C)[C@@H]2C ZINC001258834786 1063857080 /nfs/dbraw/zinc/85/70/80/1063857080.db2.gz NPSJLWHEICVQGW-MRXNPFEDSA-N 1 2 321.509 4.257 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cc(Br)c(Cl)s2)C1 ZINC001462007624 1063875376 /nfs/dbraw/zinc/87/53/76/1063875376.db2.gz NVUXAWYHZXFYIW-MRVPVSSYSA-N 1 2 308.672 4.396 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cc(Br)c(Cl)s2)C1 ZINC001462007624 1063875392 /nfs/dbraw/zinc/87/53/92/1063875392.db2.gz NVUXAWYHZXFYIW-MRVPVSSYSA-N 1 2 308.672 4.396 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1N ZINC001462030387 1063888560 /nfs/dbraw/zinc/88/85/60/1063888560.db2.gz BLBOBNFMJMOQPC-HNNXBMFYSA-N 1 2 324.255 4.251 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1N ZINC001462030387 1063888567 /nfs/dbraw/zinc/88/85/67/1063888567.db2.gz BLBOBNFMJMOQPC-HNNXBMFYSA-N 1 2 324.255 4.251 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+](C)Cc3ccc(F)cc3F)cc21 ZINC001462038682 1063895202 /nfs/dbraw/zinc/89/52/02/1063895202.db2.gz DYNJDEVPRZISCR-UHFFFAOYSA-N 1 2 300.352 4.387 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+](C)Cc3ccc(F)cc3F)cc21 ZINC001462038682 1063895212 /nfs/dbraw/zinc/89/52/12/1063895212.db2.gz DYNJDEVPRZISCR-UHFFFAOYSA-N 1 2 300.352 4.387 20 0 DIADLO COc1c(C)c[nH+]c(CNc2cc(F)c(SC)c(F)c2)c1C ZINC001462090948 1063924007 /nfs/dbraw/zinc/92/40/07/1063924007.db2.gz RRXAXBJSPALJBV-UHFFFAOYSA-N 1 2 324.396 4.319 20 0 DIADLO C[C@@]1(C[N@@H+]2CCO[C@@H](c3ccc(Cl)s3)C2)CCCS1 ZINC001261828177 1063947491 /nfs/dbraw/zinc/94/74/91/1063947491.db2.gz BBNCCTCZRXZRTJ-RISCZKNCSA-N 1 2 317.907 4.061 20 0 DIADLO C[C@@]1(C[N@H+]2CCO[C@@H](c3ccc(Cl)s3)C2)CCCS1 ZINC001261828177 1063947496 /nfs/dbraw/zinc/94/74/96/1063947496.db2.gz BBNCCTCZRXZRTJ-RISCZKNCSA-N 1 2 317.907 4.061 20 0 DIADLO C[C@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccc(Cl)c(F)c1 ZINC001262013763 1063953038 /nfs/dbraw/zinc/95/30/38/1063953038.db2.gz MBDHLIXHKIBXCK-JTQLQIEISA-N 1 2 308.784 4.197 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(Cl)cs1)c1cc(F)ccc1OC ZINC001262375464 1063965243 /nfs/dbraw/zinc/96/52/43/1063965243.db2.gz LJCBJVCWEWKSKR-LLVKDONJSA-N 1 2 314.813 4.185 20 0 DIADLO CCC[N@H+](Cc1ccccc1)Cc1ncccc1Br ZINC000384361724 1064004883 /nfs/dbraw/zinc/00/48/83/1064004883.db2.gz WETPTVUTEWEZTI-UHFFFAOYSA-N 1 2 319.246 4.256 20 0 DIADLO CCC[N@@H+](Cc1ccccc1)Cc1ncccc1Br ZINC000384361724 1064004887 /nfs/dbraw/zinc/00/48/87/1064004887.db2.gz WETPTVUTEWEZTI-UHFFFAOYSA-N 1 2 319.246 4.256 20 0 DIADLO CCCCCc1ccc(NC(=O)c2cccc3[nH+]ccn32)cc1 ZINC001264031147 1064008620 /nfs/dbraw/zinc/00/86/20/1064008620.db2.gz FXLSVHNQHIHYOG-UHFFFAOYSA-N 1 2 307.397 4.319 20 0 DIADLO Cc1ccc2c(c1)[C@@H](Nc1cc(N3CCC[C@H](C)C3)nc[nH+]1)CC2 ZINC000592462644 1064066375 /nfs/dbraw/zinc/06/63/75/1064066375.db2.gz MJITVURRSJCZRK-YJBOKZPZSA-N 1 2 322.456 4.121 20 0 DIADLO Cc1ccc2c(c1)[C@@H](Nc1cc(N3CCC[C@H](C)C3)[nH+]cn1)CC2 ZINC000592462644 1064066385 /nfs/dbraw/zinc/06/63/85/1064066385.db2.gz MJITVURRSJCZRK-YJBOKZPZSA-N 1 2 322.456 4.121 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC001264340262 1064078599 /nfs/dbraw/zinc/07/85/99/1064078599.db2.gz NXTVIVADEYXQKT-YESZJQIVSA-N 1 2 323.440 4.417 20 0 DIADLO Fc1cc(F)c(Nc2ccc([NH+]3CCCCC3)cc2)nc1F ZINC000389633082 1064134294 /nfs/dbraw/zinc/13/42/94/1064134294.db2.gz IMSLPBVOTQVJDN-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO C[C@H]1CCC[C@H]1CC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001264831751 1064144885 /nfs/dbraw/zinc/14/48/85/1064144885.db2.gz KEILMFAYUOIJOV-STQMWFEESA-N 1 2 317.820 4.291 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H]3CCC[C@@H]4CCCC[C@@H]34)ccc2[nH+]1 ZINC001264857948 1064151233 /nfs/dbraw/zinc/15/12/33/1064151233.db2.gz NWQSICWCYDOWIX-USXIJHARSA-N 1 2 311.429 4.188 20 0 DIADLO CC[C@@H](C(=O)Nc1ccc2[nH+]c(C)cn2c1)C1CCC(C)CC1 ZINC001264857954 1064151355 /nfs/dbraw/zinc/15/13/55/1064151355.db2.gz ODBXHCZSFKVJOX-PUJMQQBBSA-N 1 2 313.445 4.434 20 0 DIADLO Cc1cc(C)c(C(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)c(C)[nH+]1 ZINC001265153372 1064197417 /nfs/dbraw/zinc/19/74/17/1064197417.db2.gz VUNSIQKFHYNMSP-YJBOKZPZSA-N 1 2 308.425 4.025 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@@H](c3ccccc3)[C@@H](C)C2)c(C)[nH+]1 ZINC001265476311 1064234514 /nfs/dbraw/zinc/23/45/14/1064234514.db2.gz ZOCYBZDNEVVFBA-HNAYVOBHSA-N 1 2 322.452 4.273 20 0 DIADLO CC[C@H]1CCC[N@@H+]1Cc1ccc(Br)c(F)c1F ZINC000701281879 1064245060 /nfs/dbraw/zinc/24/50/60/1064245060.db2.gz OACHWWKZHKBYGX-JTQLQIEISA-N 1 2 304.178 4.102 20 0 DIADLO CC[C@H]1CCC[N@H+]1Cc1ccc(Br)c(F)c1F ZINC000701281879 1064245070 /nfs/dbraw/zinc/24/50/70/1064245070.db2.gz OACHWWKZHKBYGX-JTQLQIEISA-N 1 2 304.178 4.102 20 0 DIADLO c1ccc2c(c1)cncc2CNc1ccc(N2CCCCC2)[nH+]c1 ZINC000393388903 1064277656 /nfs/dbraw/zinc/27/76/56/1064277656.db2.gz PILLRJZNGBJTBF-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO Cc1nnsc1[C@@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC001332854339 1064414804 /nfs/dbraw/zinc/41/48/04/1064414804.db2.gz QXCXKILUGGLLMF-PSASIEDQSA-N 1 2 310.492 4.012 20 0 DIADLO Cc1c(C(=O)Nc2c(C)c[nH+]cc2C)sc2cccc(F)c12 ZINC001288772653 1064568825 /nfs/dbraw/zinc/56/88/25/1064568825.db2.gz YWVKNDZQPQPDOE-UHFFFAOYSA-N 1 2 314.385 4.035 20 0 DIADLO Cc1nc(NCc2cccc(OC(C)C)c2)c2c([nH+]1)CCCC2 ZINC001306935204 1064721810 /nfs/dbraw/zinc/72/18/10/1064721810.db2.gz KJCYRRHKEDDNBQ-UHFFFAOYSA-N 1 2 311.429 4.063 20 0 DIADLO C[C@H](C1CCCCC1)N(C)c1nc2ccccc2n2c[nH+]cc12 ZINC001307105003 1064750731 /nfs/dbraw/zinc/75/07/31/1064750731.db2.gz FVDAAMBCFFWAAH-CQSZACIVSA-N 1 2 308.429 4.288 20 0 DIADLO Cc1cccc(C)c1Oc1ccccc1NC(=O)Cc1c[nH]c[nH+]1 ZINC001291929022 1064751374 /nfs/dbraw/zinc/75/13/74/1064751374.db2.gz SECPOKJAKCFWSJ-UHFFFAOYSA-N 1 2 321.380 4.000 20 0 DIADLO C[C@@H](C1CCCCC1)N(C)c1nc2ccccc2n2c[nH+]cc12 ZINC001307104999 1064751778 /nfs/dbraw/zinc/75/17/78/1064751778.db2.gz FVDAAMBCFFWAAH-AWEZNQCLSA-N 1 2 308.429 4.288 20 0 DIADLO CC(C)C[C@H](C(=O)NCC1(CC(C)C)CCCC1)n1cc[nH+]c1 ZINC001294660742 1064880605 /nfs/dbraw/zinc/88/06/05/1064880605.db2.gz RYCZHQDJROSIFG-QGZVFWFLSA-N 1 2 319.493 4.193 20 0 DIADLO Cc1nc(N2CC[C@H](C)[C@@H]2c2ccccc2)c2c([nH+]1)CCCC2 ZINC001307208049 1064937016 /nfs/dbraw/zinc/93/70/16/1064937016.db2.gz SVGFQIPKTXYBAE-IFXJQAMLSA-N 1 2 307.441 4.251 20 0 DIADLO CC(C)C[C@@H](C(=O)N1CC[C@@]1(C)C1CCCCC1)n1cc[nH+]c1 ZINC001302914473 1065100933 /nfs/dbraw/zinc/10/09/33/1065100933.db2.gz DYBVBCGPEGHEQF-HKUYNNGSSA-N 1 2 317.477 4.042 20 0 DIADLO CC(C)c1[nH]cc(CNC(=O)c2ccc(C3CCCC3)cc2)[nH+]1 ZINC001304107229 1065131205 /nfs/dbraw/zinc/13/12/05/1065131205.db2.gz HBNZAKSIPZZQAI-UHFFFAOYSA-N 1 2 311.429 4.121 20 0 DIADLO CC(C)c1[nH]c(CNC(=O)c2ccc(C3CCCC3)cc2)c[nH+]1 ZINC001304107229 1065131212 /nfs/dbraw/zinc/13/12/12/1065131212.db2.gz HBNZAKSIPZZQAI-UHFFFAOYSA-N 1 2 311.429 4.121 20 0 DIADLO CCc1cc(NC[C@@H](Nc2ccccc2)C(C)C)nc(CC)[nH+]1 ZINC001306923417 1065206325 /nfs/dbraw/zinc/20/63/25/1065206325.db2.gz AUCSCLFUYORYSF-QGZVFWFLSA-N 1 2 312.461 4.150 20 0 DIADLO CCCC[N@H+](C)c1ccc(Nc2cc(Cl)nc(C)n2)cc1 ZINC001306960895 1065221808 /nfs/dbraw/zinc/22/18/08/1065221808.db2.gz UUOBWTCVONDRFR-UHFFFAOYSA-N 1 2 304.825 4.418 20 0 DIADLO CCCC[N@@H+](C)c1ccc(Nc2cc(Cl)nc(C)n2)cc1 ZINC001306960895 1065221819 /nfs/dbraw/zinc/22/18/19/1065221819.db2.gz UUOBWTCVONDRFR-UHFFFAOYSA-N 1 2 304.825 4.418 20 0 DIADLO CC(C)c1cc(N[C@@H](CCO)C2CCCCC2)nc(C(C)C)[nH+]1 ZINC001306965861 1065225360 /nfs/dbraw/zinc/22/53/60/1065225360.db2.gz QZVFTXAAEMMCSU-INIZCTEOSA-N 1 2 319.493 4.467 20 0 DIADLO CCO[C@H]1C[C@@H](N(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)C1(C)C ZINC001306976277 1065231437 /nfs/dbraw/zinc/23/14/37/1065231437.db2.gz LZLKBUHFSYEPFC-CVEARBPZSA-N 1 2 319.493 4.363 20 0 DIADLO CC[C@@H](Cc1ccc(C)cc1)N(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC001306977665 1065232930 /nfs/dbraw/zinc/23/29/30/1065232930.db2.gz BKSMBMJBTABNKJ-SFHVURJKSA-N 1 2 309.457 4.428 20 0 DIADLO CCO[C@@H]1C[C@H](N(C)c2cc(CC)[nH+]c(CC)n2)C1(CC)CC ZINC001306990051 1065238430 /nfs/dbraw/zinc/23/84/30/1065238430.db2.gz NGLVXBLLRSHENM-JKSUJKDBSA-N 1 2 319.493 4.021 20 0 DIADLO FC1(F)CCCC[C@H]1CNc1nc2ccccc2n2c[nH+]cc12 ZINC001307126793 1065272822 /nfs/dbraw/zinc/27/28/22/1065272822.db2.gz IXNOJDDCMVJUJQ-LBPRGKRZSA-N 1 2 316.355 4.120 20 0 DIADLO CC[C@@H]1CCC[C@@H]1CNc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC001307123652 1065273866 /nfs/dbraw/zinc/27/38/66/1065273866.db2.gz ODSGVUFEFFXREC-HUUCEWRRSA-N 1 2 321.428 4.054 20 0 DIADLO CC[C@H](Nc1cc(C(C)C)[nH+]c(C(C)C)n1)[C@@H]1CCCOC1 ZINC001307196168 1065299743 /nfs/dbraw/zinc/29/97/43/1065299743.db2.gz XMGZYXCEHCDBMJ-CABCVRRESA-N 1 2 305.466 4.341 20 0 DIADLO Fc1cc(OCCSc2[nH+]cc3ccccn32)ccc1Cl ZINC001307253973 1065315400 /nfs/dbraw/zinc/31/54/00/1065315400.db2.gz UXMFSANSJNYWMB-UHFFFAOYSA-N 1 2 322.792 4.298 20 0 DIADLO CCC(CC)C[N@H+](CC)[C@H](C(=O)OC)c1ccccc1Cl ZINC001307413740 1065374703 /nfs/dbraw/zinc/37/47/03/1065374703.db2.gz RWHGYRBBCYRNAN-INIZCTEOSA-N 1 2 311.853 4.312 20 0 DIADLO CCC(CC)C[N@@H+](CC)[C@H](C(=O)OC)c1ccccc1Cl ZINC001307413740 1065374712 /nfs/dbraw/zinc/37/47/12/1065374712.db2.gz RWHGYRBBCYRNAN-INIZCTEOSA-N 1 2 311.853 4.312 20 0 DIADLO CCc1nc([C@H]2CCCC[N@@H+]2CCc2ccc(Cl)cc2)no1 ZINC001307422860 1065383537 /nfs/dbraw/zinc/38/35/37/1065383537.db2.gz UHRYFOQWLBUCRJ-OAHLLOKOSA-N 1 2 319.836 4.055 20 0 DIADLO CCc1nc([C@H]2CCCC[N@H+]2CCc2ccc(Cl)cc2)no1 ZINC001307422860 1065383544 /nfs/dbraw/zinc/38/35/44/1065383544.db2.gz UHRYFOQWLBUCRJ-OAHLLOKOSA-N 1 2 319.836 4.055 20 0 DIADLO C[N@H+](CCCOc1ccc(Cl)cc1)C/C(Cl)=C\Cl ZINC001307422085 1065384142 /nfs/dbraw/zinc/38/41/42/1065384142.db2.gz GQIVVIFASUMRDT-FMIVXFBMSA-N 1 2 308.636 4.360 20 0 DIADLO C[N@@H+](CCCOc1ccc(Cl)cc1)C/C(Cl)=C\Cl ZINC001307422085 1065384150 /nfs/dbraw/zinc/38/41/50/1065384150.db2.gz GQIVVIFASUMRDT-FMIVXFBMSA-N 1 2 308.636 4.360 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@H](C)CC1 ZINC001307441227 1065402661 /nfs/dbraw/zinc/40/26/61/1065402661.db2.gz YKGJXLWHZZLBES-BBRMVZONSA-N 1 2 309.837 4.066 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H](C)CC1 ZINC001307441227 1065402667 /nfs/dbraw/zinc/40/26/67/1065402667.db2.gz YKGJXLWHZZLBES-BBRMVZONSA-N 1 2 309.837 4.066 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2nc(CC3CC3)no2)o1 ZINC001307489713 1065434330 /nfs/dbraw/zinc/43/43/30/1065434330.db2.gz MIIUPOPXJWVNDE-OAHLLOKOSA-N 1 2 315.417 4.041 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2nc(CC3CC3)no2)o1 ZINC001307489713 1065434336 /nfs/dbraw/zinc/43/43/36/1065434336.db2.gz MIIUPOPXJWVNDE-OAHLLOKOSA-N 1 2 315.417 4.041 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CC[C@H](CC(C)C)C1 ZINC001307506900 1065448379 /nfs/dbraw/zinc/44/83/79/1065448379.db2.gz RCBFBEGVUCPVDE-RHSMWYFYSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CC[C@H](CC(C)C)C1 ZINC001307506900 1065448383 /nfs/dbraw/zinc/44/83/83/1065448383.db2.gz RCBFBEGVUCPVDE-RHSMWYFYSA-N 1 2 323.864 4.312 20 0 DIADLO CC(C)c1nc([C@@H]2CCCC[N@@H+]2CCCCOC(C)(C)C)no1 ZINC001307510820 1065450607 /nfs/dbraw/zinc/45/06/07/1065450607.db2.gz OBKQPBATWYJTRI-HNNXBMFYSA-N 1 2 323.481 4.315 20 0 DIADLO CC(C)c1nc([C@@H]2CCCC[N@H+]2CCCCOC(C)(C)C)no1 ZINC001307510820 1065450623 /nfs/dbraw/zinc/45/06/23/1065450623.db2.gz OBKQPBATWYJTRI-HNNXBMFYSA-N 1 2 323.481 4.315 20 0 DIADLO CC(C)c1nc([C@@H]2CCCC[N@@H+]2CCCc2ccsc2)no1 ZINC001307509290 1065451575 /nfs/dbraw/zinc/45/15/75/1065451575.db2.gz FWXUODGEQXQTDB-HNNXBMFYSA-N 1 2 319.474 4.414 20 0 DIADLO CC(C)c1nc([C@@H]2CCCC[N@H+]2CCCc2ccsc2)no1 ZINC001307509290 1065451579 /nfs/dbraw/zinc/45/15/79/1065451579.db2.gz FWXUODGEQXQTDB-HNNXBMFYSA-N 1 2 319.474 4.414 20 0 DIADLO CC(C)CCC1CC[NH+](CC(=O)Nc2ccc(F)cc2F)CC1 ZINC001307533520 1065468278 /nfs/dbraw/zinc/46/82/78/1065468278.db2.gz ZDQWOPONIAOHSU-UHFFFAOYSA-N 1 2 324.415 4.052 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CN1CCc2c1cccc2Cl ZINC001307558462 1065482578 /nfs/dbraw/zinc/48/25/78/1065482578.db2.gz QFKZTGCJSFCZGN-UHFFFAOYSA-N 1 2 323.827 4.397 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1cccc(Cl)n1 ZINC001307589257 1065502473 /nfs/dbraw/zinc/50/24/73/1065502473.db2.gz UUQKJEDTUCJPDO-NEPJUHHUSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1cccc(Cl)n1 ZINC001307589257 1065502482 /nfs/dbraw/zinc/50/24/82/1065502482.db2.gz UUQKJEDTUCJPDO-NEPJUHHUSA-N 1 2 304.796 4.382 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](CC(=O)c1ccccc1F)C(C)(C)C2 ZINC001307793830 1065624188 /nfs/dbraw/zinc/62/41/88/1065624188.db2.gz LPCRKXLPBGJGRE-UHFFFAOYSA-N 1 2 311.400 4.154 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](CC(=O)c1ccccc1F)C(C)(C)C2 ZINC001307793830 1065624192 /nfs/dbraw/zinc/62/41/92/1065624192.db2.gz LPCRKXLPBGJGRE-UHFFFAOYSA-N 1 2 311.400 4.154 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@@H+](Cc1ccc3c(c1)COC3)CC2 ZINC001307806060 1065631534 /nfs/dbraw/zinc/63/15/34/1065631534.db2.gz PVGVSEWIOAXFOQ-UHFFFAOYSA-N 1 2 317.791 4.068 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@H+](Cc1ccc3c(c1)COC3)CC2 ZINC001307806060 1065631538 /nfs/dbraw/zinc/63/15/38/1065631538.db2.gz PVGVSEWIOAXFOQ-UHFFFAOYSA-N 1 2 317.791 4.068 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nnc(-c3ccccc3)s2)cc1C ZINC001307845438 1065650264 /nfs/dbraw/zinc/65/02/64/1065650264.db2.gz PBKFUOMQTQOGAP-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nnc(-c3ccccc3)s2)cc1C ZINC001307845438 1065650270 /nfs/dbraw/zinc/65/02/70/1065650270.db2.gz PBKFUOMQTQOGAP-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Fc1ccc([C@H]2CC[N@H+]2Cc2ccccc2OC(F)F)cc1 ZINC001307915880 1065680179 /nfs/dbraw/zinc/68/01/79/1065680179.db2.gz IEAXEMVRKCXZAL-OAHLLOKOSA-N 1 2 307.315 4.374 20 0 DIADLO Fc1ccc([C@H]2CC[N@@H+]2Cc2ccccc2OC(F)F)cc1 ZINC001307915880 1065680182 /nfs/dbraw/zinc/68/01/82/1065680182.db2.gz IEAXEMVRKCXZAL-OAHLLOKOSA-N 1 2 307.315 4.374 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1c2ccccc2CC[N@@H+]1[C@@H]1C=CCCC1 ZINC001307947576 1065695378 /nfs/dbraw/zinc/69/53/78/1065695378.db2.gz MLDPJHMTUSTESL-AEFFLSMTSA-N 1 2 313.441 4.036 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1c2ccccc2CC[N@H+]1[C@@H]1C=CCCC1 ZINC001307947576 1065695385 /nfs/dbraw/zinc/69/53/85/1065695385.db2.gz MLDPJHMTUSTESL-AEFFLSMTSA-N 1 2 313.441 4.036 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CCOc2ccc(O)cc2C1 ZINC001307953817 1065697124 /nfs/dbraw/zinc/69/71/24/1065697124.db2.gz DQJGDFFYTXOORF-QGZVFWFLSA-N 1 2 317.816 4.391 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+]1CCOc2ccc(O)cc2C1 ZINC001307953817 1065697129 /nfs/dbraw/zinc/69/71/29/1065697129.db2.gz DQJGDFFYTXOORF-QGZVFWFLSA-N 1 2 317.816 4.391 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001307993079 1065715971 /nfs/dbraw/zinc/71/59/71/1065715971.db2.gz PSYCPJNEDJAUNP-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001307993079 1065715984 /nfs/dbraw/zinc/71/59/84/1065715984.db2.gz PSYCPJNEDJAUNP-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H](c1csnn1)[NH+]1CCC(Cc2ccc(Cl)cc2)CC1 ZINC001308011374 1065724448 /nfs/dbraw/zinc/72/44/48/1065724448.db2.gz OWXYXZMECDASSI-LBPRGKRZSA-N 1 2 321.877 4.207 20 0 DIADLO COC(=O)[C@@H](CC(C)C)[NH2+][C@@H]1CCc2cccc3cccc1c32 ZINC001308092793 1065760392 /nfs/dbraw/zinc/76/03/92/1065760392.db2.gz NAGLXYQVGUKWSI-QZTJIDSGSA-N 1 2 311.425 4.004 20 0 DIADLO Fc1cncc(F)c1C[N@@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC001308123121 1065773504 /nfs/dbraw/zinc/77/35/04/1065773504.db2.gz ULHGEZLPTCMFOL-CDNLZTBQSA-N 1 2 300.352 4.038 20 0 DIADLO Fc1cncc(F)c1C[N@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC001308123121 1065773509 /nfs/dbraw/zinc/77/35/09/1065773509.db2.gz ULHGEZLPTCMFOL-CDNLZTBQSA-N 1 2 300.352 4.038 20 0 DIADLO c1nc(C2CC2)sc1C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC001308180580 1065791805 /nfs/dbraw/zinc/79/18/05/1065791805.db2.gz LXQOUSUMGWSWBV-SFHVURJKSA-N 1 2 321.449 4.295 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1c[nH]c(-c2ccccc2)n1 ZINC001308210744 1065817093 /nfs/dbraw/zinc/81/70/93/1065817093.db2.gz LUCZINZESBQGGF-UHFFFAOYSA-N 1 2 306.413 4.063 20 0 DIADLO CCCOc1cccc(NCc2cc(-n3cc[nH+]c3)cs2)c1 ZINC001308208966 1065818079 /nfs/dbraw/zinc/81/80/79/1065818079.db2.gz JGXQJCQKHUXOCM-UHFFFAOYSA-N 1 2 313.426 4.335 20 0 DIADLO c1nc2cc(CNc3ccc(N4CCCCC4)c[nH+]3)ccc2s1 ZINC001308214543 1065822480 /nfs/dbraw/zinc/82/24/80/1065822480.db2.gz UPXJHBJZXFEPJK-UHFFFAOYSA-N 1 2 324.453 4.294 20 0 DIADLO CCc1cccc2c1OCC[C@@H]2[NH2+]Cc1csc(C2CC2)n1 ZINC001308256011 1065859991 /nfs/dbraw/zinc/85/99/91/1065859991.db2.gz ZLNYNKGHUQTSJT-INIZCTEOSA-N 1 2 314.454 4.196 20 0 DIADLO CCn1cnc(Cl)c1C[NH2+][C@@H](C)c1nc2ccccc2s1 ZINC001308272452 1065871502 /nfs/dbraw/zinc/87/15/02/1065871502.db2.gz JWPVXBKYJILAAG-JTQLQIEISA-N 1 2 320.849 4.017 20 0 DIADLO CC[C@@H]([NH2+]Cc1c(Cl)ncn1CC)c1cc(F)ccc1F ZINC001308276499 1065876274 /nfs/dbraw/zinc/87/62/74/1065876274.db2.gz NUSBJSPBXABKPC-CYBMUJFWSA-N 1 2 313.779 4.076 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3nc4c(s3)CCCC4)ccc21 ZINC001308321377 1065911468 /nfs/dbraw/zinc/91/14/68/1065911468.db2.gz FZMOGCUSRPIIQU-UHFFFAOYSA-N 1 2 313.470 4.016 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3nc4c(s3)CCCC4)ccc21 ZINC001308321377 1065911473 /nfs/dbraw/zinc/91/14/73/1065911473.db2.gz FZMOGCUSRPIIQU-UHFFFAOYSA-N 1 2 313.470 4.016 20 0 DIADLO Cc1cc(F)c(CNc2ccc(-n3cc[nH+]c3)c(C)c2)c(F)c1 ZINC001308325056 1065914864 /nfs/dbraw/zinc/91/48/64/1065914864.db2.gz RORJQWIIEORIAR-UHFFFAOYSA-N 1 2 313.351 4.379 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1cc(Cl)ccc1F ZINC001308353571 1065934734 /nfs/dbraw/zinc/93/47/34/1065934734.db2.gz LBXDFKGYIMFJGT-SNVBAGLBSA-N 1 2 304.752 4.471 20 0 DIADLO CCCn1c[nH+]cc1CNc1cnn(-c2cc(C)ccc2C)c1C ZINC001308354876 1065935569 /nfs/dbraw/zinc/93/55/69/1065935569.db2.gz RWDVBMYPOVOBKG-UHFFFAOYSA-N 1 2 323.444 4.016 20 0 DIADLO C[C@H](CNc1cc(CSCCO)cc[nH+]1)CC1CCCCC1 ZINC001308363226 1065941129 /nfs/dbraw/zinc/94/11/29/1065941129.db2.gz XXEHJBKWSBJDPX-HNNXBMFYSA-N 1 2 322.518 4.326 20 0 DIADLO FCC(CF)[NH2+]Cc1ccc(-c2ccccc2Cl)s1 ZINC001308417639 1065974401 /nfs/dbraw/zinc/97/44/01/1065974401.db2.gz PVVMBPNBNXUNEA-UHFFFAOYSA-N 1 2 301.789 4.466 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(-c2ccc(Cl)s2)nc1 ZINC001308385544 1065954593 /nfs/dbraw/zinc/95/45/93/1065954593.db2.gz NISFTOIOMNFISA-UHFFFAOYSA-N 1 2 318.833 4.292 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1ccccc1F ZINC001308451991 1065996962 /nfs/dbraw/zinc/99/69/62/1065996962.db2.gz VGZFWAOJOODCPP-CQSZACIVSA-N 1 2 302.324 4.347 20 0 DIADLO Fc1ccc(C(F)(F)C[NH2+]Cc2cccc3ncccc23)cc1 ZINC001308474274 1066014304 /nfs/dbraw/zinc/01/43/04/1066014304.db2.gz BRGMPWNKGVZSJN-UHFFFAOYSA-N 1 2 316.326 4.256 20 0 DIADLO CCSCc1ccc[nH+]c1NCC1=Cc2ccccc2OC1 ZINC001308501281 1066030550 /nfs/dbraw/zinc/03/05/50/1066030550.db2.gz SDLFMUFALAYRLJ-UHFFFAOYSA-N 1 2 312.438 4.223 20 0 DIADLO Cn1c2ccccc2[nH+]c1NCc1ccc(C(F)(F)F)s1 ZINC001308501634 1066031238 /nfs/dbraw/zinc/03/12/38/1066031238.db2.gz PKQIBMFHSOKAHW-UHFFFAOYSA-N 1 2 311.332 4.266 20 0 DIADLO Cc1cc(NCc2ccc(F)cc2Br)c[nH+]c1C ZINC001308503691 1066032946 /nfs/dbraw/zinc/03/29/46/1066032946.db2.gz QVRHEUNXYGPUQX-UHFFFAOYSA-N 1 2 309.182 4.212 20 0 DIADLO Oc1cc(Cl)cc(CNc2[nH+]c3ccccc3n2C2CC2)c1 ZINC001308507576 1066035243 /nfs/dbraw/zinc/03/52/43/1066035243.db2.gz QLCAHCVUNPOUCM-UHFFFAOYSA-N 1 2 313.788 4.342 20 0 DIADLO F[C@H]1COc2ccccc2[C@H]1[NH2+]Cc1cc2ccccc2s1 ZINC001308521470 1066042701 /nfs/dbraw/zinc/04/27/01/1066042701.db2.gz UOKOACSOPGYMGI-MAUKXSAKSA-N 1 2 313.397 4.463 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3cccc4c(C)nccc34)n2c1 ZINC001308520652 1066042903 /nfs/dbraw/zinc/04/29/03/1066042903.db2.gz QOHLQUFRQISOAK-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO COc1cccc(OC)c1CNc1ccc2[nH+]c(C)cc(C)c2c1 ZINC001308521783 1066043689 /nfs/dbraw/zinc/04/36/89/1066043689.db2.gz IDCLDVROIVKZSK-UHFFFAOYSA-N 1 2 322.408 4.481 20 0 DIADLO CCCOc1cccc(C[NH2+][C@H]2c3ccccc3OC[C@@H]2F)c1 ZINC001308521646 1066044275 /nfs/dbraw/zinc/04/42/75/1066044275.db2.gz WPXIVKCDGLDIFF-HKUYNNGSSA-N 1 2 315.388 4.037 20 0 DIADLO Cc1[nH+]cc(CNc2ccc(C(C)(C)C)nc2)n1-c1ccccc1 ZINC001308541827 1066059339 /nfs/dbraw/zinc/05/93/39/1066059339.db2.gz JMHZUBMKWBZOTC-UHFFFAOYSA-N 1 2 320.440 4.485 20 0 DIADLO Cc1cc(CNc2cncc(C(F)(F)F)c2)c2c([nH+]1)CCCC2 ZINC001308551031 1066064174 /nfs/dbraw/zinc/06/41/74/1066064174.db2.gz GCDIKQHBCAYIJA-UHFFFAOYSA-N 1 2 321.346 4.295 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2F)[N@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308573638 1066085903 /nfs/dbraw/zinc/08/59/03/1066085903.db2.gz PUKYYWPIJGGMNN-XHDPSFHLSA-N 1 2 321.342 4.393 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308573638 1066085911 /nfs/dbraw/zinc/08/59/11/1066085911.db2.gz PUKYYWPIJGGMNN-XHDPSFHLSA-N 1 2 321.342 4.393 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308573637 1066087612 /nfs/dbraw/zinc/08/76/12/1066087612.db2.gz PUKYYWPIJGGMNN-NHYWBVRUSA-N 1 2 321.342 4.393 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308573637 1066087621 /nfs/dbraw/zinc/08/76/21/1066087621.db2.gz PUKYYWPIJGGMNN-NHYWBVRUSA-N 1 2 321.342 4.393 20 0 DIADLO CC(C)CO[C@@H]1CC[N@H+](Cc2ccc(F)c(Cl)c2Cl)C1 ZINC001308602615 1066111742 /nfs/dbraw/zinc/11/17/42/1066111742.db2.gz DZGHBVDBRKJXHG-GFCCVEGCSA-N 1 2 320.235 4.379 20 0 DIADLO CC(C)CO[C@@H]1CC[N@@H+](Cc2ccc(F)c(Cl)c2Cl)C1 ZINC001308602615 1066111749 /nfs/dbraw/zinc/11/17/49/1066111749.db2.gz DZGHBVDBRKJXHG-GFCCVEGCSA-N 1 2 320.235 4.379 20 0 DIADLO CCCn1cncc1C[N@@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC001308576745 1066091651 /nfs/dbraw/zinc/09/16/51/1066091651.db2.gz BOZYNEZSKBNYAW-UHFFFAOYSA-N 1 2 321.424 4.111 20 0 DIADLO CCCn1cncc1C[N@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC001308576745 1066091664 /nfs/dbraw/zinc/09/16/64/1066091664.db2.gz BOZYNEZSKBNYAW-UHFFFAOYSA-N 1 2 321.424 4.111 20 0 DIADLO CC[C@@H]1CN(C)c2ccccc2C[N@@H+]1Cc1nc(Cl)cs1 ZINC001308585060 1066101840 /nfs/dbraw/zinc/10/18/40/1066101840.db2.gz XPDMLMCNKPBMDO-CYBMUJFWSA-N 1 2 321.877 4.027 20 0 DIADLO CC[C@@H]1CN(C)c2ccccc2C[N@H+]1Cc1nc(Cl)cs1 ZINC001308585060 1066101845 /nfs/dbraw/zinc/10/18/45/1066101845.db2.gz XPDMLMCNKPBMDO-CYBMUJFWSA-N 1 2 321.877 4.027 20 0 DIADLO Clc1ccc([C@@H]2CCC[N@@H+]2Cc2cc3n(n2)CCCC3)cc1 ZINC001308606510 1066113540 /nfs/dbraw/zinc/11/35/40/1066113540.db2.gz XCURINTZPZCKBF-SFHVURJKSA-N 1 2 315.848 4.210 20 0 DIADLO Clc1ccc([C@@H]2CCC[N@H+]2Cc2cc3n(n2)CCCC3)cc1 ZINC001308606510 1066113543 /nfs/dbraw/zinc/11/35/43/1066113543.db2.gz XCURINTZPZCKBF-SFHVURJKSA-N 1 2 315.848 4.210 20 0 DIADLO CCCOc1ccc(C[N@H+](C)Cc2csc(CC)n2)cc1C ZINC001308627022 1066124735 /nfs/dbraw/zinc/12/47/35/1066124735.db2.gz HQPJCDCQAJIFLZ-UHFFFAOYSA-N 1 2 318.486 4.435 20 0 DIADLO CCCOc1ccc(C[N@@H+](C)Cc2csc(CC)n2)cc1C ZINC001308627022 1066124739 /nfs/dbraw/zinc/12/47/39/1066124739.db2.gz HQPJCDCQAJIFLZ-UHFFFAOYSA-N 1 2 318.486 4.435 20 0 DIADLO Cc1ccc(CC[NH2+][C@@H](CC(C)C)C(=O)OC(C)(C)C)cc1C ZINC001308656709 1066140978 /nfs/dbraw/zinc/14/09/78/1066140978.db2.gz OPTANOQOKOEQPH-SFHVURJKSA-N 1 2 319.489 4.192 20 0 DIADLO CC1=C(Br)C[N@H+](Cc2ccc3occc3c2)CC1 ZINC001308722621 1066199288 /nfs/dbraw/zinc/19/92/88/1066199288.db2.gz MHABIJBCKRAARH-UHFFFAOYSA-N 1 2 306.203 4.307 20 0 DIADLO CC1=C(Br)C[N@@H+](Cc2ccc3occc3c2)CC1 ZINC001308722621 1066199296 /nfs/dbraw/zinc/19/92/96/1066199296.db2.gz MHABIJBCKRAARH-UHFFFAOYSA-N 1 2 306.203 4.307 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C3CC4(C3)CCCC4)cc2)C[C@H](C)O1 ZINC001308733680 1066208994 /nfs/dbraw/zinc/20/89/94/1066208994.db2.gz DTNPCJQOCASEGV-IYBDPMFKSA-N 1 2 314.473 4.435 20 0 DIADLO CC[C@@H]([NH2+]C1CC(c2ccc(Cl)cc2)C1)C(=O)OC(C)(C)C ZINC001308836731 1066312583 /nfs/dbraw/zinc/31/25/83/1066312583.db2.gz VVUWXZAMNNUGOE-AVVWSFFYSA-N 1 2 323.864 4.296 20 0 DIADLO CO[C@H](C[NH2+]CC(F)(F)c1ccc(F)cc1)C1CCCCC1 ZINC001308880664 1066360218 /nfs/dbraw/zinc/36/02/18/1066360218.db2.gz OCCFQQVEUXUXHJ-MRXNPFEDSA-N 1 2 315.379 4.102 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCc3cc(F)c(F)cc3C2)cc1F ZINC001308917966 1066396154 /nfs/dbraw/zinc/39/61/54/1066396154.db2.gz HNKHSFPUJTVIDK-OWOJBTEDSA-N 1 2 321.317 4.315 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCc3cc(F)c(F)cc3C2)cc1F ZINC001308917966 1066396167 /nfs/dbraw/zinc/39/61/67/1066396167.db2.gz HNKHSFPUJTVIDK-OWOJBTEDSA-N 1 2 321.317 4.315 20 0 DIADLO Cc1cc(NC(=O)N[C@H](c2ccccc2)C2CCCC2)c(C)c[nH+]1 ZINC001310450608 1066525271 /nfs/dbraw/zinc/52/52/71/1066525271.db2.gz OEXAWOSRQYWCBD-LJQANCHMSA-N 1 2 323.440 4.173 20 0 DIADLO CCCCC[C@@H](NC(=O)Nc1cc(C)[nH+]cc1C)C(C)(C)C ZINC001310450341 1066525711 /nfs/dbraw/zinc/52/57/11/1066525711.db2.gz DTBMMZDFIZQDDL-MRXNPFEDSA-N 1 2 305.466 4.237 20 0 DIADLO CCCC1CCC(N(C)C(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC001310675342 1066549979 /nfs/dbraw/zinc/54/99/79/1066549979.db2.gz WGZQGPDBLWXYSC-UHFFFAOYSA-N 1 2 314.433 4.157 20 0 DIADLO CC[C@@H](NC(=O)Nc1ccn2cc[nH+]c2c1)c1cc(C)ccc1C ZINC001310675129 1066550520 /nfs/dbraw/zinc/55/05/20/1066550520.db2.gz OAIOVBLSHKBDSU-QGZVFWFLSA-N 1 2 322.412 4.224 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2c3ccccc3CC[C@H]2C)c(C)[nH+]1 ZINC001310833688 1066566885 /nfs/dbraw/zinc/56/68/85/1066566885.db2.gz CWOALOUKQWIKKN-CWTRNNRKSA-N 1 2 323.440 4.452 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@H](C)CCC2CCCCC2)c[nH+]1 ZINC001311969291 1066720042 /nfs/dbraw/zinc/72/00/42/1066720042.db2.gz KJYRYYPDJVNUOJ-OAHLLOKOSA-N 1 2 317.477 4.247 20 0 DIADLO Cc1nc(N[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc[nH+]1 ZINC000343283440 334925102 /nfs/dbraw/zinc/92/51/02/334925102.db2.gz JSRJHTLHHMYNPD-HNNXBMFYSA-N 1 2 323.318 4.247 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2sccc2Br)cs1 ZINC000087574950 185228577 /nfs/dbraw/zinc/22/85/77/185228577.db2.gz XJPRKKGELFWUDI-SSDOTTSWSA-N 1 2 317.277 4.126 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1nc(C2CC2)cs1 ZINC000090460056 185297743 /nfs/dbraw/zinc/29/77/43/185297743.db2.gz NHOKGDGQCCBVMB-GFCCVEGCSA-N 1 2 302.443 4.188 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CCO[C@H](c3cccs3)C2)s1 ZINC000092594544 185328345 /nfs/dbraw/zinc/32/83/45/185328345.db2.gz MGMMPNMGMHOORL-ZDUSSCGKSA-N 1 2 322.499 4.076 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CCO[C@H](c3cccs3)C2)s1 ZINC000092594544 185328346 /nfs/dbraw/zinc/32/83/46/185328346.db2.gz MGMMPNMGMHOORL-ZDUSSCGKSA-N 1 2 322.499 4.076 20 0 DIADLO COc1cc[nH+]cc1CSc1cccc(Br)c1 ZINC000343832071 335200406 /nfs/dbraw/zinc/20/04/06/335200406.db2.gz OIOHVAPEOYZMLW-UHFFFAOYSA-N 1 2 310.216 4.145 20 0 DIADLO Cc1cccc(C2=CCN(C(=O)Nc3cc[nH+]cc3C)CC2)c1 ZINC000092822864 185344423 /nfs/dbraw/zinc/34/44/23/185344423.db2.gz NELGLYHQPGRWJK-UHFFFAOYSA-N 1 2 307.397 4.020 20 0 DIADLO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1ccn(C(C)C)n1 ZINC000425508264 334952222 /nfs/dbraw/zinc/95/22/22/334952222.db2.gz GTDMMHXXFNLFAM-UHFFFAOYSA-N 1 2 321.852 4.151 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc2ccccc2s1)c1nccs1 ZINC000072684381 191214036 /nfs/dbraw/zinc/21/40/36/191214036.db2.gz XIZSBFXKBHPLCI-OAHLLOKOSA-N 1 2 303.456 4.168 20 0 DIADLO c1coc(CNc2nc(NCc3ccco3)c3ccccc3[nH+]2)c1 ZINC000004186265 181083452 /nfs/dbraw/zinc/08/34/52/181083452.db2.gz KXVJCXFOVGJMGE-UHFFFAOYSA-N 1 2 320.352 4.040 20 0 DIADLO COC[C@H]([NH2+]Cc1cccc(Cl)c1Cl)c1ccco1 ZINC000080240355 192016070 /nfs/dbraw/zinc/01/60/70/192016070.db2.gz WWZJJVVFRFSYOT-LBPRGKRZSA-N 1 2 300.185 4.064 20 0 DIADLO CC(C)c1csc(C[NH2+][C@H](C)c2nc3ccccc3n2C)n1 ZINC000091371682 193048085 /nfs/dbraw/zinc/04/80/85/193048085.db2.gz BVXDZIWHPIHYCY-GFCCVEGCSA-N 1 2 314.458 4.004 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1nccs1 ZINC000091735981 193098782 /nfs/dbraw/zinc/09/87/82/193098782.db2.gz PEYOKMSMORLYIV-UONOGXRCSA-N 1 2 304.459 4.480 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nccs1)c1nc(C(F)(F)F)cs1 ZINC000091731816 193099197 /nfs/dbraw/zinc/09/91/97/193099197.db2.gz NFSWSLALKLTOPP-HTQZYQBOSA-N 1 2 321.393 4.420 20 0 DIADLO CC(C)CCc1nc(C[N@H+](C)[C@@H](C)c2ccncc2)cs1 ZINC000091987397 193136986 /nfs/dbraw/zinc/13/69/86/193136986.db2.gz KRYSJYFRISTUQA-AWEZNQCLSA-N 1 2 303.475 4.320 20 0 DIADLO CC(C)CCc1nc(C[N@@H+](C)[C@@H](C)c2ccncc2)cs1 ZINC000091987397 193136987 /nfs/dbraw/zinc/13/69/87/193136987.db2.gz KRYSJYFRISTUQA-AWEZNQCLSA-N 1 2 303.475 4.320 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(Cl)c(C(F)(F)F)c2)no1 ZINC000092254815 193182186 /nfs/dbraw/zinc/18/21/86/193182186.db2.gz KCUXAWAHKUZDDY-UHFFFAOYSA-N 1 2 318.726 4.287 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(Cl)c(C(F)(F)F)c2)no1 ZINC000092254815 193182188 /nfs/dbraw/zinc/18/21/88/193182188.db2.gz KCUXAWAHKUZDDY-UHFFFAOYSA-N 1 2 318.726 4.287 20 0 DIADLO COc1c(C)c[nH+]c(CSc2nc3ccccc3o2)c1C ZINC000039937910 183023171 /nfs/dbraw/zinc/02/31/71/183023171.db2.gz JENIYVDQJQFEBX-UHFFFAOYSA-N 1 2 300.383 4.141 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccc(F)cc1)C1CCC1)c1nc(C2CC2)no1 ZINC000104706371 194029012 /nfs/dbraw/zinc/02/90/12/194029012.db2.gz FGHOJYMNMYNUCQ-BZNIZROVSA-N 1 2 315.392 4.278 20 0 DIADLO CC(C)c1nnc(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)o1 ZINC000104708220 194029370 /nfs/dbraw/zinc/02/93/70/194029370.db2.gz XMOKIZHUBDARJX-UHFFFAOYSA-N 1 2 305.809 4.015 20 0 DIADLO Cc1cccc(COc2ccc([C@@H](C)[NH2+]Cc3ccn[nH]3)cc2)c1 ZINC000105492008 194106816 /nfs/dbraw/zinc/10/68/16/194106816.db2.gz NLAMHPWFWDPQBU-MRXNPFEDSA-N 1 2 321.424 4.148 20 0 DIADLO CCCc1csc(C[N@H+](Cc2ccc(F)cc2)C2CC2)n1 ZINC000426041948 335045682 /nfs/dbraw/zinc/04/56/82/335045682.db2.gz ARMUPSUZPKIOTL-UHFFFAOYSA-N 1 2 304.434 4.399 20 0 DIADLO CCCc1csc(C[N@@H+](Cc2ccc(F)cc2)C2CC2)n1 ZINC000426041948 335045683 /nfs/dbraw/zinc/04/56/83/335045683.db2.gz ARMUPSUZPKIOTL-UHFFFAOYSA-N 1 2 304.434 4.399 20 0 DIADLO CCOc1cccc([C@@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)c1 ZINC000289283142 535472053 /nfs/dbraw/zinc/47/20/53/535472053.db2.gz ACYVVXFIKBCOQT-CYBMUJFWSA-N 1 2 302.418 4.222 20 0 DIADLO CC[C@H](C)[C@@H](C)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000272539360 130038627 /nfs/dbraw/zinc/03/86/27/130038627.db2.gz KXSNTJPVAIICAT-LSDHHAIUSA-N 1 2 323.440 4.223 20 0 DIADLO CC(C)COC1CC[NH+](Cc2nc(Cl)ccc2Cl)CC1 ZINC000273215388 130097681 /nfs/dbraw/zinc/09/76/81/130097681.db2.gz XQAXWWBKRZVUBV-UHFFFAOYSA-N 1 2 317.260 4.025 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2ccn(C3CCCC3)n2)C2CC2)n1 ZINC000273413580 130119473 /nfs/dbraw/zinc/11/94/73/130119473.db2.gz QUQCCMGEYPCYOF-INIZCTEOSA-N 1 2 316.474 4.004 20 0 DIADLO Cc1nnc([C@H](C)Nc2cc(C(C)C)[nH+]c(C(C)C)n2)s1 ZINC000273530051 130132661 /nfs/dbraw/zinc/13/26/61/130132661.db2.gz UMABGEUIFIVEPO-JTQLQIEISA-N 1 2 305.451 4.056 20 0 DIADLO C[C@@H](CC1CCCC1)c1nc(-c2ccc(-n3cc[nH+]c3)nc2)no1 ZINC000273731794 130159915 /nfs/dbraw/zinc/15/99/15/130159915.db2.gz NTEGELJJXTZXDS-ZDUSSCGKSA-N 1 2 323.400 4.001 20 0 DIADLO Cc1ccc(Cc2noc([C@@H](C)c3ccc(Cl)s3)n2)c[nH+]1 ZINC000273947034 130190568 /nfs/dbraw/zinc/19/05/68/130190568.db2.gz NQHLFWRQSMFEFO-JTQLQIEISA-N 1 2 319.817 4.231 20 0 DIADLO Cc1csc(C2([NH2+]Cc3nc(C(C)(C)C)cs3)CCC2)n1 ZINC000274013384 130197561 /nfs/dbraw/zinc/19/75/61/130197561.db2.gz MBIAWJAKNKPSPK-UHFFFAOYSA-N 1 2 321.515 4.375 20 0 DIADLO CC(C)C[C@H](C)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000274159676 130211831 /nfs/dbraw/zinc/21/18/31/130211831.db2.gz MLMNYTMUXYXKME-HNNXBMFYSA-N 1 2 323.440 4.223 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nnc(C)s1)c1ccc(Cl)s1 ZINC000274182692 130214106 /nfs/dbraw/zinc/21/41/06/130214106.db2.gz JAFRDMGJPWSKAQ-IONNQARKSA-N 1 2 301.868 4.363 20 0 DIADLO C[C@H]([NH2+]Cc1cn(C)nc1C(F)F)c1c(F)cccc1Cl ZINC000274470524 130238498 /nfs/dbraw/zinc/23/84/98/130238498.db2.gz JRQCLLJIQDJAIW-QMMMGPOBSA-N 1 2 317.742 4.001 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1F)c1nc(C(F)(F)F)cs1 ZINC000274577493 130244976 /nfs/dbraw/zinc/24/49/76/130244976.db2.gz IIFHCYTWIHHGNY-ZETCQYMHSA-N 1 2 322.302 4.291 20 0 DIADLO Cn1cc[nH+]c1[C@@H](Nc1ccc2oc(C3CC3)nc2c1)C1CC1 ZINC000275031111 130285678 /nfs/dbraw/zinc/28/56/78/130285678.db2.gz FQVRDPFMJMUBRD-INIZCTEOSA-N 1 2 308.385 4.002 20 0 DIADLO C[C@H]([NH2+]C/C(Cl)=C/Cl)c1nc2ccccc2n1C(F)F ZINC000275463182 130322626 /nfs/dbraw/zinc/32/26/26/130322626.db2.gz NDJYSSNRUQMRQJ-HWPCKVLBSA-N 1 2 320.170 4.401 20 0 DIADLO CC(C)c1ccc(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000275660512 130356780 /nfs/dbraw/zinc/35/67/80/130356780.db2.gz BIBHRYALBZOXKX-IBGZPJMESA-N 1 2 305.425 4.412 20 0 DIADLO COC[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(Cl)cc1 ZINC000278820856 130720763 /nfs/dbraw/zinc/72/07/63/130720763.db2.gz IKGJKUBMOVPNHD-AWEZNQCLSA-N 1 2 322.836 4.103 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccc(C)cc2OC(C)(C)C)nn1C ZINC000282227527 130908735 /nfs/dbraw/zinc/90/87/35/130908735.db2.gz PEUPNHZXAWRKLD-OAHLLOKOSA-N 1 2 315.461 4.065 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)[C@@H](C)c1nnc(C)s1 ZINC000283662376 131012024 /nfs/dbraw/zinc/01/20/24/131012024.db2.gz URRYYVVVMKDXHZ-NSHDSACASA-N 1 2 315.442 4.348 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)[C@@H](C)c1nnc(C)s1 ZINC000283662376 131012025 /nfs/dbraw/zinc/01/20/25/131012025.db2.gz URRYYVVVMKDXHZ-NSHDSACASA-N 1 2 315.442 4.348 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](CC(F)(F)F)c2ccc(F)cc2)no1 ZINC000284882047 131119188 /nfs/dbraw/zinc/11/91/88/131119188.db2.gz BJQQTCZVQPCHQS-HZMBPMFUSA-N 1 2 316.298 4.466 20 0 DIADLO COc1cccc(C2([NH2+]Cc3cc(-c4ccccc4)on3)CC2)c1 ZINC000285040416 131133125 /nfs/dbraw/zinc/13/31/25/131133125.db2.gz NOQKSNBWFLPCDH-UHFFFAOYSA-N 1 2 320.392 4.129 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2nc(-c3ccccc3)c[nH]2)on1 ZINC000285150231 131142914 /nfs/dbraw/zinc/14/29/14/131142914.db2.gz UDEPBYDLKVKMQE-GOSISDBHSA-N 1 2 322.412 4.100 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2nc(-c3ccccc3)c[nH]2)on1 ZINC000285150231 131142916 /nfs/dbraw/zinc/14/29/16/131142916.db2.gz UDEPBYDLKVKMQE-GOSISDBHSA-N 1 2 322.412 4.100 20 0 DIADLO c1cc([C@H]2CCCC[N@H+]2Cc2nc(-c3ccccc3)cs2)n[nH]1 ZINC000285348566 131160013 /nfs/dbraw/zinc/16/00/13/131160013.db2.gz LCLHNLRFBYXITN-QGZVFWFLSA-N 1 2 324.453 4.260 20 0 DIADLO c1cc([C@H]2CCCC[N@@H+]2Cc2nc(-c3ccccc3)cs2)n[nH]1 ZINC000285348566 131160015 /nfs/dbraw/zinc/16/00/15/131160015.db2.gz LCLHNLRFBYXITN-QGZVFWFLSA-N 1 2 324.453 4.260 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)[C@@H](C)CC1CCCC1 ZINC000366641382 131166798 /nfs/dbraw/zinc/16/67/98/131166798.db2.gz BQZBTEJPHSCXDI-DOTOQJQBSA-N 1 2 317.477 4.173 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1csc(Cl)c1 ZINC000285509311 131176121 /nfs/dbraw/zinc/17/61/21/131176121.db2.gz BAAHVLHUZDYSBB-YUMQZZPRSA-N 1 2 302.777 4.487 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1csc(CCC(C)C)n1 ZINC000285509030 131176316 /nfs/dbraw/zinc/17/63/16/131176316.db2.gz DDORVSUDZVOPKC-UHFFFAOYSA-N 1 2 321.490 4.361 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cc(F)ccc1F ZINC000285626471 131188456 /nfs/dbraw/zinc/18/84/56/131188456.db2.gz KEPLQQFGAWDBBA-BJOHPYRUSA-N 1 2 312.310 4.440 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cc(C)ccc1OC ZINC000285643905 131189305 /nfs/dbraw/zinc/18/93/05/131189305.db2.gz LBSHKADQHQGMHT-LRDDRELGSA-N 1 2 320.383 4.479 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1nc2c(s1)CCCC2 ZINC000285745249 131198577 /nfs/dbraw/zinc/19/85/77/131198577.db2.gz RPILMHGJNGAANB-NXEZZACHSA-N 1 2 323.412 4.107 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000286947656 131257069 /nfs/dbraw/zinc/25/70/69/131257069.db2.gz CSKPKONJWAZGKH-SCTDSRPQSA-N 1 2 321.424 4.190 20 0 DIADLO CC(C)CC[C@@H]([NH2+]Cc1ncnn1-c1ccccc1)c1ccoc1 ZINC000286952422 131257248 /nfs/dbraw/zinc/25/72/48/131257248.db2.gz BPVFOHNQBYTOPH-GOSISDBHSA-N 1 2 324.428 4.127 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000286947651 131257506 /nfs/dbraw/zinc/25/75/06/131257506.db2.gz CSKPKONJWAZGKH-LMMKCTJWSA-N 1 2 321.424 4.190 20 0 DIADLO C[C@H]([NH2+]Cc1nccc(C(F)F)n1)c1cc2ccccc2o1 ZINC000286965466 131258246 /nfs/dbraw/zinc/25/82/46/131258246.db2.gz IECAKVQCCBLKIA-JTQLQIEISA-N 1 2 303.312 4.011 20 0 DIADLO C[C@H]([NH2+]Cc1ccncc1OCCC(C)(C)C)c1cscn1 ZINC000287338323 131275314 /nfs/dbraw/zinc/27/53/14/131275314.db2.gz MWOCYLVDOGGMDF-ZDUSSCGKSA-N 1 2 319.474 4.204 20 0 DIADLO C[C@@H]([NH2+]Cc1ccncc1OCCC(C)(C)C)c1cscn1 ZINC000287338319 131275374 /nfs/dbraw/zinc/27/53/74/131275374.db2.gz MWOCYLVDOGGMDF-CYBMUJFWSA-N 1 2 319.474 4.204 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)N(C(=O)Nc3c(C)cc[nH+]c3C)C2)cc1 ZINC000287399026 131279453 /nfs/dbraw/zinc/27/94/53/131279453.db2.gz DKYSFZZBHIKIKT-YJBOKZPZSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@](C)(c2ccccc2)C1 ZINC000287458069 131281680 /nfs/dbraw/zinc/28/16/80/131281680.db2.gz IPODMVZQMYKAMX-FQEVSTJZSA-N 1 2 323.440 4.284 20 0 DIADLO Fc1cccc(C[N@@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)c1 ZINC000287526778 131285305 /nfs/dbraw/zinc/28/53/05/131285305.db2.gz VFRJUIPCGZLWEO-INIZCTEOSA-N 1 2 315.392 4.203 20 0 DIADLO Fc1cccc(C[N@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)c1 ZINC000287526778 131285306 /nfs/dbraw/zinc/28/53/06/131285306.db2.gz VFRJUIPCGZLWEO-INIZCTEOSA-N 1 2 315.392 4.203 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCc2cc(Cl)ccc21 ZINC000287536027 131285858 /nfs/dbraw/zinc/28/58/58/131285858.db2.gz NWMYNOCSPPGNQI-OAHLLOKOSA-N 1 2 315.804 4.161 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCc1ccccc1C(F)(F)F ZINC000287623539 131291442 /nfs/dbraw/zinc/29/14/42/131291442.db2.gz UJDAODBNCKFPQP-UHFFFAOYSA-N 1 2 323.318 4.039 20 0 DIADLO Cc1cccc([C@H]2CCCN2C(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000287645117 131292331 /nfs/dbraw/zinc/29/23/31/131292331.db2.gz VXUZARNNMDTZQL-QGZVFWFLSA-N 1 2 309.413 4.376 20 0 DIADLO CC[C@H](NC(=O)Nc1c(C)cc[nH+]c1C)c1cc(F)ccc1F ZINC000287670286 131292990 /nfs/dbraw/zinc/29/29/90/131292990.db2.gz XQRUGHGRKFQLDG-HNNXBMFYSA-N 1 2 319.355 4.249 20 0 DIADLO Cc1nn(C)c2sc([C@@H](C)Nc3ccc([NH+](C)C)cc3)cc12 ZINC000287731541 131297650 /nfs/dbraw/zinc/29/76/50/131297650.db2.gz PDKSCECKLKEBHG-GFCCVEGCSA-N 1 2 314.458 4.182 20 0 DIADLO Cc1nn(C)cc1[C@H](C)Nc1cc[nH+]c2c(Cl)cccc12 ZINC000288160403 131314644 /nfs/dbraw/zinc/31/46/44/131314644.db2.gz ZPMAABHEVVBJOH-JTQLQIEISA-N 1 2 300.793 4.103 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1csc(C(C)(C)C)n1 ZINC000288710750 131336352 /nfs/dbraw/zinc/33/63/52/131336352.db2.gz ZGHWKGMOTVFJCB-XHDPSFHLSA-N 1 2 302.443 4.052 20 0 DIADLO CCC(CC)N(CC)C(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000288780695 131338761 /nfs/dbraw/zinc/33/87/61/131338761.db2.gz LDTOHPHUCKBJFS-UHFFFAOYSA-N 1 2 314.433 4.130 20 0 DIADLO C[C@@H](O)c1ncc(C[N@H+](C)[C@H](C)c2ccccc2Cl)s1 ZINC000288952730 131347449 /nfs/dbraw/zinc/34/74/49/131347449.db2.gz AGOYBOIHJSWVSC-GHMZBOCLSA-N 1 2 310.850 4.043 20 0 DIADLO C[C@@H](O)c1ncc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)s1 ZINC000288952730 131347451 /nfs/dbraw/zinc/34/74/51/131347451.db2.gz AGOYBOIHJSWVSC-GHMZBOCLSA-N 1 2 310.850 4.043 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](c2ccc(CC(C)C)cc2)C2CC2)no1 ZINC000289300676 131371826 /nfs/dbraw/zinc/37/18/26/131371826.db2.gz BLULCMIKQGAJKH-SCLBCKFNSA-N 1 2 313.445 4.378 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H](c2ccc(CC(C)C)cc2)C2CC2)no1 ZINC000289300673 131372027 /nfs/dbraw/zinc/37/20/27/131372027.db2.gz BLULCMIKQGAJKH-ACJLOTCBSA-N 1 2 313.445 4.378 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cc(C(C)(C)C)on1 ZINC000289365473 131379006 /nfs/dbraw/zinc/37/90/06/131379006.db2.gz NMWFAEZYJQLQSR-CYBMUJFWSA-N 1 2 302.418 4.140 20 0 DIADLO Clc1nccc(C[N@@H+]2CCC=C(c3ccncc3)C2)c1Cl ZINC000291478439 131574270 /nfs/dbraw/zinc/57/42/70/131574270.db2.gz FPURIHZOQMUKBQ-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1nccc(C[N@H+]2CCC=C(c3ccncc3)C2)c1Cl ZINC000291478439 131574271 /nfs/dbraw/zinc/57/42/71/131574271.db2.gz FPURIHZOQMUKBQ-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ccnc(Cl)c1Cl ZINC000291668549 131590568 /nfs/dbraw/zinc/59/05/68/131590568.db2.gz WBDDVZAWHIROOS-LKFCYVNXSA-N 1 2 309.196 4.000 20 0 DIADLO C[C@@H]1C[C@H](Nc2ccc(Cl)c(OC(F)F)c2)c2[nH+]ccn21 ZINC000296619989 131976357 /nfs/dbraw/zinc/97/63/57/131976357.db2.gz ZCRSBZNSQJMMSB-KCJUWKMLSA-N 1 2 313.735 4.256 20 0 DIADLO CCSc1cccc(CNC(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000297207836 132004069 /nfs/dbraw/zinc/00/40/69/132004069.db2.gz YKXLEQAEZGRZOD-UHFFFAOYSA-N 1 2 315.442 4.132 20 0 DIADLO COCC[N@H+](Cc1csc(Cl)n1)[C@@H](C)c1ccccc1 ZINC000297276344 132007312 /nfs/dbraw/zinc/00/73/12/132007312.db2.gz XCKHBXOYHOAGKL-LBPRGKRZSA-N 1 2 310.850 4.006 20 0 DIADLO COCC[N@@H+](Cc1csc(Cl)n1)[C@@H](C)c1ccccc1 ZINC000297276344 132007314 /nfs/dbraw/zinc/00/73/14/132007314.db2.gz XCKHBXOYHOAGKL-LBPRGKRZSA-N 1 2 310.850 4.006 20 0 DIADLO CCOc1ccc(N(CC)C(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000297375162 132012494 /nfs/dbraw/zinc/01/24/94/132012494.db2.gz IACGBVHYWAFYFP-UHFFFAOYSA-N 1 2 313.401 4.156 20 0 DIADLO CCC[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1ccc(F)cc1F ZINC000297557016 132022671 /nfs/dbraw/zinc/02/26/71/132022671.db2.gz FZKQFGOPZNOJIZ-XFBWCDHKSA-N 1 2 305.372 4.298 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccccc1OCCC(C)C ZINC000297823439 132035226 /nfs/dbraw/zinc/03/52/26/132035226.db2.gz RMCLPFWZKRCLBE-MRXNPFEDSA-N 1 2 315.461 4.179 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccccc1OCCC(C)C ZINC000297823434 132035261 /nfs/dbraw/zinc/03/52/61/132035261.db2.gz RMCLPFWZKRCLBE-INIZCTEOSA-N 1 2 315.461 4.179 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1[C@H](C)C[C@H](c2ccccc2)[C@@H]1C ZINC000297831650 132036080 /nfs/dbraw/zinc/03/60/80/132036080.db2.gz RIDVJZHSCXBNPV-VYDXJSESSA-N 1 2 309.413 4.188 20 0 DIADLO CCc1noc([C@@H](C)[NH2+]C(c2ccccc2)c2ccccc2)n1 ZINC000298202649 132050401 /nfs/dbraw/zinc/05/04/01/132050401.db2.gz GZWLRSDGORMDKL-CQSZACIVSA-N 1 2 307.397 4.072 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccccc1OC(F)F ZINC000298526681 132066851 /nfs/dbraw/zinc/06/68/51/132066851.db2.gz XZNULNFJSOPBIW-LLVKDONJSA-N 1 2 324.371 4.424 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)no1 ZINC000299085708 132088375 /nfs/dbraw/zinc/08/83/75/132088375.db2.gz UBRJJUHTOKWDSX-OAHLLOKOSA-N 1 2 307.825 4.333 20 0 DIADLO Cc1cc(C[NH2+]C2(c3noc(C)n3)CCCCC2)c(C)s1 ZINC000299279785 132096221 /nfs/dbraw/zinc/09/62/21/132096221.db2.gz TZPVLLHGTRYYEX-UHFFFAOYSA-N 1 2 305.447 4.006 20 0 DIADLO Cc1ccn(-c2ccc([NH2+]CCCCOC(C)(C)C)cc2)n1 ZINC000340626976 132099776 /nfs/dbraw/zinc/09/97/76/132099776.db2.gz SVPADOHYIOTPDY-UHFFFAOYSA-N 1 2 301.434 4.188 20 0 DIADLO CCc1oc(C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)cc1C ZINC000340665452 132135652 /nfs/dbraw/zinc/13/56/52/132135652.db2.gz JETIEKJVOJWUBL-UHFFFAOYSA-N 1 2 323.396 4.167 20 0 DIADLO CCC[N@H+](Cc1csc(C)n1)[C@@H](C)c1ccccc1OC ZINC000340685970 132147605 /nfs/dbraw/zinc/14/76/05/132147605.db2.gz MQTFYSBNLHLREH-ZDUSSCGKSA-N 1 2 304.459 4.433 20 0 DIADLO CCC[N@@H+](Cc1csc(C)n1)[C@@H](C)c1ccccc1OC ZINC000340685970 132147607 /nfs/dbraw/zinc/14/76/07/132147607.db2.gz MQTFYSBNLHLREH-ZDUSSCGKSA-N 1 2 304.459 4.433 20 0 DIADLO CCC[N@H+](Cc1csc(C)n1)[C@H](C)c1ccccc1OC ZINC000340684633 132149362 /nfs/dbraw/zinc/14/93/62/132149362.db2.gz MQTFYSBNLHLREH-CYBMUJFWSA-N 1 2 304.459 4.433 20 0 DIADLO CCC[N@@H+](Cc1csc(C)n1)[C@H](C)c1ccccc1OC ZINC000340684633 132149364 /nfs/dbraw/zinc/14/93/64/132149364.db2.gz MQTFYSBNLHLREH-CYBMUJFWSA-N 1 2 304.459 4.433 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc3nccc(C)c3c2)c(C)[nH+]1 ZINC000340775319 132187049 /nfs/dbraw/zinc/18/70/49/132187049.db2.gz JMWQOPXRDMAVKV-UHFFFAOYSA-N 1 2 305.381 4.116 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@H+](Cc2coc3ccccc23)CCO1 ZINC000514099348 335072998 /nfs/dbraw/zinc/07/29/98/335072998.db2.gz NKLXSHMQNFDEHQ-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@@H+](Cc2coc3ccccc23)CCO1 ZINC000514099348 335073000 /nfs/dbraw/zinc/07/30/00/335073000.db2.gz NKLXSHMQNFDEHQ-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO CC1(C)CC(C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)C1 ZINC000425562708 335090906 /nfs/dbraw/zinc/09/09/06/335090906.db2.gz CVGNSNOQEZKTJT-UHFFFAOYSA-N 1 2 323.440 4.261 20 0 DIADLO CC(C)c1nc(NCCc2ccc(Br)cc2)cc[nH+]1 ZINC000522693198 434930433 /nfs/dbraw/zinc/93/04/33/434930433.db2.gz MTKQZJZCDTVIBC-UHFFFAOYSA-N 1 2 320.234 4.017 20 0 DIADLO COc1ccc2[nH+]c(NC[C@@H](OC)c3ccccc3)ccc2c1 ZINC000608079236 435348942 /nfs/dbraw/zinc/34/89/42/435348942.db2.gz ROYQZZYVKKWJMH-GOSISDBHSA-N 1 2 308.381 4.043 20 0 DIADLO COc1ccc2[nH+]c(NC[C@H](OC)c3ccccc3)ccc2c1 ZINC000608079238 435350070 /nfs/dbraw/zinc/35/00/70/435350070.db2.gz ROYQZZYVKKWJMH-SFHVURJKSA-N 1 2 308.381 4.043 20 0 DIADLO Cc1nc([C@H](C)Nc2[nH+]c(C(C)C)nc3[nH]ccc32)cs1 ZINC000631112334 435401298 /nfs/dbraw/zinc/40/12/98/435401298.db2.gz VCCJGBLNOJEAEH-VIFPVBQESA-N 1 2 301.419 4.019 20 0 DIADLO CC(C)c1nc2[nH]ccc2c(N[C@@H](CCCO)c2ccccc2)[nH+]1 ZINC000631127069 435401324 /nfs/dbraw/zinc/40/13/24/435401324.db2.gz ODIUWPFAJICJJB-INIZCTEOSA-N 1 2 324.428 4.007 20 0 DIADLO FC(F)(F)CC1CC[NH+](Cc2ccn(-c3ccccc3)n2)CC1 ZINC000570704652 332803955 /nfs/dbraw/zinc/80/39/55/332803955.db2.gz XPQOPWGUDMQGEN-UHFFFAOYSA-N 1 2 323.362 4.037 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc([C@@H]2CC[C@@H](C)C2)n1 ZINC000570768871 332813318 /nfs/dbraw/zinc/81/33/18/332813318.db2.gz SNZNFYTZKMQFIE-ZIAGYGMSSA-N 1 2 324.428 4.495 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ncc(C(C)(C)C)s2)o1 ZINC000570896761 332837105 /nfs/dbraw/zinc/83/71/05/332837105.db2.gz VASYQYJFYCXZGG-DGCLKSJQSA-N 1 2 304.459 4.447 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2ccccc2OC)c2ccco2)cc1 ZINC000575024437 332885388 /nfs/dbraw/zinc/88/53/88/332885388.db2.gz AXOPIBLMLVJPKW-FQEVSTJZSA-N 1 2 323.392 4.176 20 0 DIADLO COc1cc(Oc2ccccc2)ccc1[NH2+]C[C@@H]1CCCOC1 ZINC000533466905 331537742 /nfs/dbraw/zinc/53/77/42/331537742.db2.gz CJLVNDAEOWIZHG-HNNXBMFYSA-N 1 2 313.397 4.326 20 0 DIADLO COc1cc[nH+]c(CN(C)Cc2cccc(Cl)c2Cl)c1 ZINC000533478785 331543621 /nfs/dbraw/zinc/54/36/21/331543621.db2.gz PTKWLSMKYYLKGW-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO CN(CCCNc1cc(C(F)(F)F)cc[nH+]1)c1ccccc1 ZINC000317224193 331609242 /nfs/dbraw/zinc/60/92/42/331609242.db2.gz XJGAWCNBXNUAGM-UHFFFAOYSA-N 1 2 309.335 4.039 20 0 DIADLO CCCCCN(C)c1ccc(F)cc1C[NH2+]Cc1cc(C)on1 ZINC000530648253 331615647 /nfs/dbraw/zinc/61/56/47/331615647.db2.gz OSORPIIXBDBBLN-UHFFFAOYSA-N 1 2 319.424 4.038 20 0 DIADLO FC(F)(F)CC1CC[NH+](Cc2ccn(C3CCCC3)n2)CC1 ZINC000556505017 331709063 /nfs/dbraw/zinc/70/90/63/331709063.db2.gz BOOCUPJPZWESFE-UHFFFAOYSA-N 1 2 315.383 4.163 20 0 DIADLO Cc1ccc(NC(=O)CSc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000176191638 332927425 /nfs/dbraw/zinc/92/74/25/332927425.db2.gz QJFWQGCNEVEQCV-UHFFFAOYSA-N 1 2 306.818 4.083 20 0 DIADLO CC(C)n1nccc1C[NH2+]Cc1cc(Cl)sc1Cl ZINC000312755282 331728685 /nfs/dbraw/zinc/72/86/85/331728685.db2.gz BQXREOYHNACAPP-UHFFFAOYSA-N 1 2 304.246 4.122 20 0 DIADLO CSc1ccc(Cl)c(C(=O)Nc2ccc(C)[nH+]c2C)c1 ZINC000176197513 332928171 /nfs/dbraw/zinc/92/81/71/332928171.db2.gz OLBKGWFKXBRWLK-UHFFFAOYSA-N 1 2 306.818 4.326 20 0 DIADLO Cc1ccc(NC(=O)C[C@H](C)Cc2cccc(F)c2)c(C)[nH+]1 ZINC000176187248 332927032 /nfs/dbraw/zinc/92/70/32/332927032.db2.gz LGSUIYGZHFGEGS-GFCCVEGCSA-N 1 2 300.377 4.045 20 0 DIADLO Cc1nc(C)c(CCNc2[nH+]ccc3ccc(F)cc32)s1 ZINC000354329938 331824361 /nfs/dbraw/zinc/82/43/61/331824361.db2.gz ULKJPZXTFJQUBE-UHFFFAOYSA-N 1 2 301.390 4.102 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC(C)(CC(C)C)CC1 ZINC000558210044 331883739 /nfs/dbraw/zinc/88/37/39/331883739.db2.gz KIWSVFVCZCMNMA-UHFFFAOYSA-N 1 2 303.450 4.379 20 0 DIADLO CC(C)(C)CCCCc1nc(Cc2cn3ccccc3[nH+]2)no1 ZINC000558284561 331893407 /nfs/dbraw/zinc/89/34/07/331893407.db2.gz BTTIQORRSYPIAG-UHFFFAOYSA-N 1 2 312.417 4.067 20 0 DIADLO O=C(NC1CCC2(CC2)CC1)c1ccccc1Oc1cc[nH+]cc1 ZINC000558700527 331936791 /nfs/dbraw/zinc/93/67/91/331936791.db2.gz BRSYMNHAIWUAFC-UHFFFAOYSA-N 1 2 322.408 4.327 20 0 DIADLO CCc1ccccc1[C@@H]1C[C@H]1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000558756130 331941747 /nfs/dbraw/zinc/94/17/47/331941747.db2.gz VZGCFECAMZSIJI-ZWKOTPCHSA-N 1 2 308.425 4.311 20 0 DIADLO CC(C)(C)c1nc(C[NH2+]C2(c3ccccc3F)CC2)cs1 ZINC000076767017 331956391 /nfs/dbraw/zinc/95/63/91/331956391.db2.gz DCBYTSYZEXIWNF-UHFFFAOYSA-N 1 2 304.434 4.359 20 0 DIADLO Cc1cc(C)c(NC(=O)CCCc2ccc(F)c(F)c2)c(C)[nH+]1 ZINC000176392088 332938468 /nfs/dbraw/zinc/93/84/68/332938468.db2.gz ILQOZCLJTVCDLN-UHFFFAOYSA-N 1 2 318.367 4.246 20 0 DIADLO Cn1c(CCSCc2ccc(F)cc2F)[nH+]c2ccccc21 ZINC000518247559 332000189 /nfs/dbraw/zinc/00/01/89/332000189.db2.gz FRVKYEKHVRXBHS-UHFFFAOYSA-N 1 2 318.392 4.327 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cc(C)cc(Cl)c3)CCCCC2)no1 ZINC000559254491 332007348 /nfs/dbraw/zinc/00/73/48/332007348.db2.gz MOVVCTAGGRJGPA-UHFFFAOYSA-N 1 2 319.836 4.289 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@@H](C)c2c(F)cccc2Cl)c1 ZINC000559273806 332011353 /nfs/dbraw/zinc/01/13/53/332011353.db2.gz ZZKPRYUNSUYKOD-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO CC1(C)C[N@H+](CCCCC(F)(F)F)C[C@@](C)(C(F)(F)F)O1 ZINC000559312764 332024036 /nfs/dbraw/zinc/02/40/36/332024036.db2.gz LYXSEDHEWYOTJA-NSHDSACASA-N 1 2 321.305 4.151 20 0 DIADLO CC1(C)C[N@@H+](CCCCC(F)(F)F)C[C@@](C)(C(F)(F)F)O1 ZINC000559312764 332024038 /nfs/dbraw/zinc/02/40/38/332024038.db2.gz LYXSEDHEWYOTJA-NSHDSACASA-N 1 2 321.305 4.151 20 0 DIADLO FC(F)O[C@@H]1CCCC[C@H]1Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000409529971 332037518 /nfs/dbraw/zinc/03/75/18/332037518.db2.gz NMWLVOPFKYBDND-NXEZZACHSA-N 1 2 310.266 4.063 20 0 DIADLO Cc1cn2cc(NC(=O)CC3CC(c4ccccc4)C3)ccc2[nH+]1 ZINC000409629840 332042712 /nfs/dbraw/zinc/04/27/12/332042712.db2.gz BPMHFDNTOBNFLP-UHFFFAOYSA-N 1 2 319.408 4.165 20 0 DIADLO COc1cc[nH+]cc1NC(=O)CC1CCC(c2ccccc2)CC1 ZINC000409653357 332043910 /nfs/dbraw/zinc/04/39/10/332043910.db2.gz RFSBTBWUIGFAOV-UHFFFAOYSA-N 1 2 324.424 4.393 20 0 DIADLO Cc1cnn([C@H]2CC[N@H+](Cc3cc(Cl)sc3Cl)C2)c1 ZINC000449339715 332052529 /nfs/dbraw/zinc/05/25/29/332052529.db2.gz UWQXDIIGJWKGLK-NSHDSACASA-N 1 2 316.257 4.007 20 0 DIADLO Cc1cnn([C@H]2CC[N@@H+](Cc3cc(Cl)sc3Cl)C2)c1 ZINC000449339715 332052530 /nfs/dbraw/zinc/05/25/30/332052530.db2.gz UWQXDIIGJWKGLK-NSHDSACASA-N 1 2 316.257 4.007 20 0 DIADLO Cc1ccoc1C[NH2+][C@@H](c1cccnc1)c1ccc(F)c(C)c1 ZINC000426352486 332074108 /nfs/dbraw/zinc/07/41/08/332074108.db2.gz QAJHNRUGGRGXGC-LJQANCHMSA-N 1 2 310.372 4.310 20 0 DIADLO CC[C@@H]([NH2+]Cc1cnc(-c2c(F)cccc2F)s1)C(F)F ZINC000449363599 332075566 /nfs/dbraw/zinc/07/55/66/332075566.db2.gz PULLIWLGQFRQEC-LLVKDONJSA-N 1 2 318.339 4.222 20 0 DIADLO CCCc1csc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)n1 ZINC000426359748 332082247 /nfs/dbraw/zinc/08/22/47/332082247.db2.gz JBZLJQQAILDMAC-ZYHUDNBSSA-N 1 2 306.397 4.258 20 0 DIADLO CCCc1csc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)n1 ZINC000426359748 332082248 /nfs/dbraw/zinc/08/22/48/332082248.db2.gz JBZLJQQAILDMAC-ZYHUDNBSSA-N 1 2 306.397 4.258 20 0 DIADLO COc1ccccc1-c1ccc(C[N@H+](C)Cc2nccs2)cc1 ZINC000093582504 332140471 /nfs/dbraw/zinc/14/04/71/332140471.db2.gz ABGMVUFUXUGJEU-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1ccccc1-c1ccc(C[N@@H+](C)Cc2nccs2)cc1 ZINC000093582504 332140473 /nfs/dbraw/zinc/14/04/73/332140473.db2.gz ABGMVUFUXUGJEU-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO Cc1[nH]c(CNc2ccc(-c3cnc(C4CC4)o3)cc2)[nH+]c1C ZINC000569591767 332151439 /nfs/dbraw/zinc/15/14/39/332151439.db2.gz MYIAAFZMGZEPRX-UHFFFAOYSA-N 1 2 308.385 4.171 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCCC[C@@H]1c1nccs1 ZINC000428416234 332162381 /nfs/dbraw/zinc/16/23/81/332162381.db2.gz FDGDFXVFBPGNRF-CYBMUJFWSA-N 1 2 305.447 4.290 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1CCCC[C@@H]1c1nccs1 ZINC000428416234 332162382 /nfs/dbraw/zinc/16/23/82/332162382.db2.gz FDGDFXVFBPGNRF-CYBMUJFWSA-N 1 2 305.447 4.290 20 0 DIADLO Clc1ccc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)nc1 ZINC000181061561 332173615 /nfs/dbraw/zinc/17/36/15/332173615.db2.gz NMRIFPIUBHILPS-UHFFFAOYSA-N 1 2 314.772 4.410 20 0 DIADLO CCOc1cc(C)ccc1[NH2+][C@@H]1CCC[C@H](c2ccnn2C)C1 ZINC000448020627 332178960 /nfs/dbraw/zinc/17/89/60/332178960.db2.gz CZXLDUKAQIZLLK-JKSUJKDBSA-N 1 2 313.445 4.266 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000181169513 332186874 /nfs/dbraw/zinc/18/68/74/332186874.db2.gz RKISTYDNGQFBEX-CYBMUJFWSA-N 1 2 317.392 4.428 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000181169513 332186875 /nfs/dbraw/zinc/18/68/75/332186875.db2.gz RKISTYDNGQFBEX-CYBMUJFWSA-N 1 2 317.392 4.428 20 0 DIADLO FC(F)(F)[C@H]1CC[N@H+](Cc2cnc(Cl)s2)CC12CCC2 ZINC000374624072 332244557 /nfs/dbraw/zinc/24/45/57/332244557.db2.gz XYBQJRAFGJGJAZ-JTQLQIEISA-N 1 2 324.799 4.351 20 0 DIADLO FC(F)(F)[C@H]1CC[N@@H+](Cc2cnc(Cl)s2)CC12CCC2 ZINC000374624072 332244559 /nfs/dbraw/zinc/24/45/59/332244559.db2.gz XYBQJRAFGJGJAZ-JTQLQIEISA-N 1 2 324.799 4.351 20 0 DIADLO Cc1c[nH+]c(CCSCc2cc(-c3ccco3)on2)c(C)c1 ZINC000566238113 332272994 /nfs/dbraw/zinc/27/29/94/332272994.db2.gz DETWWUWALNKVSJ-UHFFFAOYSA-N 1 2 314.410 4.422 20 0 DIADLO C[C@@H](Nc1cccc([NH+]2CCCCCC2)c1)[C@@]1(C)CCCO1 ZINC000559835890 332284322 /nfs/dbraw/zinc/28/43/22/332284322.db2.gz NZHLCURRQKYGKK-VQIMIIECSA-N 1 2 302.462 4.437 20 0 DIADLO Cc1ccc2[nH+]c(/C=C/c3ncc(Br)s3)cn2c1 ZINC000559941443 332295396 /nfs/dbraw/zinc/29/53/96/332295396.db2.gz XWHGJIALOOBURK-HWKANZROSA-N 1 2 320.215 4.032 20 0 DIADLO CC(C)C[N@H+](Cc1ccn(C)n1)[C@@H](C)c1ccccc1Cl ZINC000560184591 332317066 /nfs/dbraw/zinc/31/70/66/332317066.db2.gz OMWMDRVZUJTAAI-AWEZNQCLSA-N 1 2 305.853 4.293 20 0 DIADLO CC(C)C[N@@H+](Cc1ccn(C)n1)[C@@H](C)c1ccccc1Cl ZINC000560184591 332317068 /nfs/dbraw/zinc/31/70/68/332317068.db2.gz OMWMDRVZUJTAAI-AWEZNQCLSA-N 1 2 305.853 4.293 20 0 DIADLO Cc1cc(C)c(NC(=O)COc2cccc(C(C)C)c2)c(C)[nH+]1 ZINC000097075982 332317566 /nfs/dbraw/zinc/31/75/66/332317566.db2.gz GMOZTLRNBUCEPN-UHFFFAOYSA-N 1 2 312.413 4.148 20 0 DIADLO C[C@@H]([NH2+][C@H](Cc1ccccc1)c1ccccc1F)c1ncc[nH]1 ZINC000560530064 332352292 /nfs/dbraw/zinc/35/22/92/332352292.db2.gz YRLBNYZOHGUHIC-RDTXWAMCSA-N 1 2 309.388 4.183 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+][C@@H](COCC(C)C)c2ccco2)c1 ZINC000560530349 332352512 /nfs/dbraw/zinc/35/25/12/332352512.db2.gz YAGYBCGWESJBQO-RDJZCZTQSA-N 1 2 302.418 4.048 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+][C@H](COCC(C)C)c2ccco2)c1 ZINC000560530347 332352516 /nfs/dbraw/zinc/35/25/16/332352516.db2.gz YAGYBCGWESJBQO-NVXWUHKLSA-N 1 2 302.418 4.048 20 0 DIADLO CCOc1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)cc1F ZINC000560552031 332358709 /nfs/dbraw/zinc/35/87/09/332358709.db2.gz JYALWDMMHIORLX-GOSISDBHSA-N 1 2 314.404 4.203 20 0 DIADLO CCOc1ccc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)cc1F ZINC000560552031 332358710 /nfs/dbraw/zinc/35/87/10/332358710.db2.gz JYALWDMMHIORLX-GOSISDBHSA-N 1 2 314.404 4.203 20 0 DIADLO CCn1nccc1C[N@H+](Cc1cc(F)ccc1F)C1CCCC1 ZINC000560574983 332363187 /nfs/dbraw/zinc/36/31/87/332363187.db2.gz YTSSJSPXGNVRFD-UHFFFAOYSA-N 1 2 319.399 4.126 20 0 DIADLO CCn1nccc1C[N@@H+](Cc1cc(F)ccc1F)C1CCCC1 ZINC000560574983 332363188 /nfs/dbraw/zinc/36/31/88/332363188.db2.gz YTSSJSPXGNVRFD-UHFFFAOYSA-N 1 2 319.399 4.126 20 0 DIADLO COc1cccc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1OC ZINC000560588002 332363959 /nfs/dbraw/zinc/36/39/59/332363959.db2.gz IRVNAFGLHDJPSM-MRXNPFEDSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cccc(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1OC ZINC000560588002 332363960 /nfs/dbraw/zinc/36/39/60/332363960.db2.gz IRVNAFGLHDJPSM-MRXNPFEDSA-N 1 2 317.816 4.304 20 0 DIADLO CC[C@]1(C)C[C@@H]1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000425566753 335103231 /nfs/dbraw/zinc/10/32/31/335103231.db2.gz IFLOLWNYEGQTIU-OXQOHEQNSA-N 1 2 323.440 4.261 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@@H](C)c1ccc(-c2ccc(F)cc2)s1 ZINC000560901134 332392737 /nfs/dbraw/zinc/39/27/37/332392737.db2.gz HJYKFKHSNZMODW-LBPRGKRZSA-N 1 2 315.417 4.437 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@@H](C)c1cncs1)c1ccco1 ZINC000560917291 332394113 /nfs/dbraw/zinc/39/41/13/332394113.db2.gz GFJPAQLBNZLKPM-YVEFUNNKSA-N 1 2 314.410 4.185 20 0 DIADLO CCc1ccccc1NC(=O)C[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000561108750 332412080 /nfs/dbraw/zinc/41/20/80/332412080.db2.gz TYZFACFTOVMUPK-KRWDZBQOSA-N 1 2 319.408 4.133 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000425590795 335108669 /nfs/dbraw/zinc/10/86/69/335108669.db2.gz XVOUHPYYRMFODP-NEPJUHHUSA-N 1 2 300.324 4.006 20 0 DIADLO Cc1cccc2[nH+]c(CNc3cccc(-c4ncco4)c3C)cn21 ZINC000427414723 332420542 /nfs/dbraw/zinc/42/05/42/332420542.db2.gz NNVKBRLHRMSSKP-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000425579055 335105849 /nfs/dbraw/zinc/10/58/49/335105849.db2.gz CEMJLPVTPAPOER-GHMZBOCLSA-N 1 2 306.818 4.156 20 0 DIADLO CC(C)[C@H]1C[C@@H]1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000425580847 335106365 /nfs/dbraw/zinc/10/63/65/335106365.db2.gz YRXHJTKTQOONRU-SJORKVTESA-N 1 2 323.440 4.117 20 0 DIADLO CC(C)[C@@H]1C[C@H]1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000425580840 335106417 /nfs/dbraw/zinc/10/64/17/335106417.db2.gz YRXHJTKTQOONRU-DLBZAZTESA-N 1 2 323.440 4.117 20 0 DIADLO CC(C)[C@@H]1CC[C@@H](Nc2ccc(Cn3cc[nH+]c3)cn2)C[C@@H]1C ZINC000561398236 332446442 /nfs/dbraw/zinc/44/64/42/332446442.db2.gz RPSPANMUSJUGPU-JQHSSLGASA-N 1 2 312.461 4.199 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1cccc(OC2CCCC2)c1 ZINC000425584695 335106853 /nfs/dbraw/zinc/10/68/53/335106853.db2.gz FLHJHGRHQJXHEF-UHFFFAOYSA-N 1 2 310.397 4.272 20 0 DIADLO Cc1ccc(C[C@H](C)N(C)C(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000152424435 335110075 /nfs/dbraw/zinc/11/00/75/335110075.db2.gz XQKDTKCHFFJXEA-HNNXBMFYSA-N 1 2 311.429 4.102 20 0 DIADLO Cc1ccc(C[C@@H](C)N(C)C(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000152424361 335110106 /nfs/dbraw/zinc/11/01/06/335110106.db2.gz XQKDTKCHFFJXEA-OAHLLOKOSA-N 1 2 311.429 4.102 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1ccc(Cl)cc1F ZINC000427878593 332552580 /nfs/dbraw/zinc/55/25/80/332552580.db2.gz WCSNRDHRIBBDIY-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO CSC[C@H](C)[NH2+][C@@H](c1cccc(OC(C)C)c1)C(F)F ZINC000562449954 332594560 /nfs/dbraw/zinc/59/45/60/332594560.db2.gz CVBJPJRZROKYKP-FZMZJTMJSA-N 1 2 303.418 4.121 20 0 DIADLO Cc1cc(C)c(NC(=O)NC[C@H](c2ccccc2)C2CC2)c(C)[nH+]1 ZINC000562892522 332637273 /nfs/dbraw/zinc/63/72/73/332637273.db2.gz GEFVIDAKXAXXFA-GOSISDBHSA-N 1 2 323.440 4.322 20 0 DIADLO CS[C@H](C)C[NH2+][C@H](c1cccc(OC(C)C)c1)C(F)F ZINC000562933441 332646989 /nfs/dbraw/zinc/64/69/89/332646989.db2.gz VFGFZGOMUKOYAB-BXUZGUMPSA-N 1 2 303.418 4.121 20 0 DIADLO CC(C)c1nc(CSCc2cn3ccccc3[nH+]2)cs1 ZINC000176899392 332962254 /nfs/dbraw/zinc/96/22/54/332962254.db2.gz MYHOMINCIUNOJR-UHFFFAOYSA-N 1 2 303.456 4.348 20 0 DIADLO Cc1ccc(C[NH2+][C@H](c2ncc[nH]2)c2ccc(F)cc2)c(C)c1 ZINC000187794944 332987560 /nfs/dbraw/zinc/98/75/60/332987560.db2.gz SJRKXZIVXDQQCM-SFHVURJKSA-N 1 2 309.388 4.045 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1sccc1Br ZINC000178064782 333001452 /nfs/dbraw/zinc/00/14/52/333001452.db2.gz JIPZGJRTOYMPSD-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1sccc1Br ZINC000178064782 333001453 /nfs/dbraw/zinc/00/14/53/333001453.db2.gz JIPZGJRTOYMPSD-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccc(CSC(F)F)o2)cs1 ZINC000107716170 333004859 /nfs/dbraw/zinc/00/48/59/333004859.db2.gz IATODMVUQYHOFM-UHFFFAOYSA-N 1 2 318.414 4.044 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)[C@@H]2CCc3ccccc32)n1 ZINC000178292481 333006899 /nfs/dbraw/zinc/00/68/99/333006899.db2.gz ASUAEMLTUUZXMS-IUODEOHRSA-N 1 2 317.458 4.003 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)[C@@H]2CCc3ccccc32)n1 ZINC000178292481 333006900 /nfs/dbraw/zinc/00/69/00/333006900.db2.gz ASUAEMLTUUZXMS-IUODEOHRSA-N 1 2 317.458 4.003 20 0 DIADLO O=C(c1cccc(Oc2cc[nH+]cc2)c1)N1C[C@H]2CCCC[C@@H]2C1 ZINC000178350555 333008262 /nfs/dbraw/zinc/00/82/62/333008262.db2.gz UDWZGZXPAYYSCC-IAGOWNOFSA-N 1 2 322.408 4.136 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1Br)c1cccc(O)c1 ZINC000181509666 333030729 /nfs/dbraw/zinc/03/07/29/333030729.db2.gz RPLFJMPBPPVXHF-JTQLQIEISA-N 1 2 324.193 4.145 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[NH2+][C@@H](C)c3cccc(O)c3)o2)cc1 ZINC000181550779 333031014 /nfs/dbraw/zinc/03/10/14/333031014.db2.gz OIEWPWCZULVALD-UONOGXRCSA-N 1 2 323.396 4.162 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000181716028 333031351 /nfs/dbraw/zinc/03/13/51/333031351.db2.gz NRMFJOHYKGUGTL-LJQANCHMSA-N 1 2 311.356 4.307 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccc2c(n1)CCC2 ZINC000580285357 333060220 /nfs/dbraw/zinc/06/02/20/333060220.db2.gz BYHBKTZTVIXVLM-ZDUSSCGKSA-N 1 2 323.465 4.373 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccc2c(n1)CCC2 ZINC000580285357 333060222 /nfs/dbraw/zinc/06/02/22/333060222.db2.gz BYHBKTZTVIXVLM-ZDUSSCGKSA-N 1 2 323.465 4.373 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+](CC)Cc1cccs1 ZINC000215910928 333083322 /nfs/dbraw/zinc/08/33/22/333083322.db2.gz TUZARVBDKZYZBO-UHFFFAOYSA-N 1 2 317.454 4.372 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+](CC)Cc1cccs1 ZINC000215910928 333083323 /nfs/dbraw/zinc/08/33/23/333083323.db2.gz TUZARVBDKZYZBO-UHFFFAOYSA-N 1 2 317.454 4.372 20 0 DIADLO Clc1ccc(/C=C\C[N@@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000526056820 333107890 /nfs/dbraw/zinc/10/78/90/333107890.db2.gz KFXNQKRHEKGSRZ-YYZONTRBSA-N 1 2 319.857 4.488 20 0 DIADLO Clc1ccc(/C=C\C[N@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000526056820 333107892 /nfs/dbraw/zinc/10/78/92/333107892.db2.gz KFXNQKRHEKGSRZ-YYZONTRBSA-N 1 2 319.857 4.488 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1sccc1Br ZINC000177371880 333128028 /nfs/dbraw/zinc/12/80/28/333128028.db2.gz GAAABLFROXUEJC-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1sccc1Br ZINC000177371880 333128029 /nfs/dbraw/zinc/12/80/29/333128029.db2.gz GAAABLFROXUEJC-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(/C=C/C(C)(C)C)n1 ZINC000460737669 333131209 /nfs/dbraw/zinc/13/12/09/333131209.db2.gz FZEMRTHNABOQCF-ZHACJKMWSA-N 1 2 310.401 4.089 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(/C=C(/C)C(C)(C)C)n1 ZINC000460738250 333131292 /nfs/dbraw/zinc/13/12/92/333131292.db2.gz SVADDRZLXOUKEC-QBFSEMIESA-N 1 2 324.428 4.479 20 0 DIADLO C[C@@H]1CCCC[N@H+](CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000187920522 333153502 /nfs/dbraw/zinc/15/35/02/333153502.db2.gz ZPQGZAYBHOYGPJ-LLVKDONJSA-N 1 2 315.244 4.054 20 0 DIADLO C[C@@H]1CCCC[N@@H+](CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000187920522 333153503 /nfs/dbraw/zinc/15/35/03/333153503.db2.gz ZPQGZAYBHOYGPJ-LLVKDONJSA-N 1 2 315.244 4.054 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](Cc3cccs3)CCO2)cc1Cl ZINC000092972806 333156685 /nfs/dbraw/zinc/15/66/85/333156685.db2.gz SVDMEEUFGLQSIM-HNNXBMFYSA-N 1 2 311.809 4.114 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](Cc3cccs3)CCO2)cc1Cl ZINC000092972806 333156687 /nfs/dbraw/zinc/15/66/87/333156687.db2.gz SVDMEEUFGLQSIM-HNNXBMFYSA-N 1 2 311.809 4.114 20 0 DIADLO CCC[C@H]([NH2+]Cc1nc(CC(C)C)no1)c1ccc(F)cc1F ZINC000181673549 333171278 /nfs/dbraw/zinc/17/12/78/333171278.db2.gz KWGIXGBZJUFQKV-HNNXBMFYSA-N 1 2 323.387 4.177 20 0 DIADLO Cn1ccnc1C[N@@H+]1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000522711522 333172607 /nfs/dbraw/zinc/17/26/07/333172607.db2.gz CLYVMKGAPMDGKO-MRXNPFEDSA-N 1 2 303.837 4.191 20 0 DIADLO Cn1ccnc1C[N@H+]1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000522711522 333172609 /nfs/dbraw/zinc/17/26/09/333172609.db2.gz CLYVMKGAPMDGKO-MRXNPFEDSA-N 1 2 303.837 4.191 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCSc1ncccn1 ZINC000460871818 333180685 /nfs/dbraw/zinc/18/06/85/333180685.db2.gz PVBIBHRTUAMBSJ-UHFFFAOYSA-N 1 2 312.442 4.097 20 0 DIADLO Cc1nc(C[NH2+][C@@H](CC(F)(F)F)c2ccccc2C)[nH]c1C ZINC000582073490 333199911 /nfs/dbraw/zinc/19/99/11/333199911.db2.gz GEUDGYLXEQMXLG-AWEZNQCLSA-N 1 2 311.351 4.118 20 0 DIADLO Cc1[nH]c(CN[C@@H](CC(F)(F)F)c2ccccc2C)[nH+]c1C ZINC000582073490 333199912 /nfs/dbraw/zinc/19/99/12/333199912.db2.gz GEUDGYLXEQMXLG-AWEZNQCLSA-N 1 2 311.351 4.118 20 0 DIADLO Cc1nnc(C[NH2+][C@H](C)c2ccc(Cl)c3ccccc32)o1 ZINC000185393028 333208100 /nfs/dbraw/zinc/20/81/00/333208100.db2.gz KNCAKBQIEIZVTO-SNVBAGLBSA-N 1 2 301.777 4.035 20 0 DIADLO CC(C)[C@H](NC(=O)C[C@H](C)n1cc[nH+]c1)c1ccccc1Cl ZINC000565306537 333226859 /nfs/dbraw/zinc/22/68/59/333226859.db2.gz BMLZWYUGXUSAPK-GUYCJALGSA-N 1 2 319.836 4.001 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000497590746 333266552 /nfs/dbraw/zinc/26/65/52/333266552.db2.gz MZHXZZPZCWMGPJ-SGTLLEGYSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000497590746 333266554 /nfs/dbraw/zinc/26/65/54/333266554.db2.gz MZHXZZPZCWMGPJ-SGTLLEGYSA-N 1 2 321.342 4.238 20 0 DIADLO CCOc1ccc([C@H](C)Nc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC000390361580 333271993 /nfs/dbraw/zinc/27/19/93/333271993.db2.gz CZJSQSSSPJQISB-HNNXBMFYSA-N 1 2 311.429 4.254 20 0 DIADLO Fc1cccc(F)c1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000497719963 333282611 /nfs/dbraw/zinc/28/26/11/333282611.db2.gz PMULOFONDVNHFA-LJQANCHMSA-N 1 2 310.347 4.239 20 0 DIADLO CCC[C@H](Nc1cc(C)[nH+]c(-c2ccncc2)n1)c1ccccc1 ZINC000498844072 333285266 /nfs/dbraw/zinc/28/52/66/333285266.db2.gz MOLFEYMBEJGUSR-SFHVURJKSA-N 1 2 318.424 4.222 20 0 DIADLO COCC[N@H+](Cc1ccc(C)o1)Cc1ccc(F)cc1Cl ZINC000195674584 335131778 /nfs/dbraw/zinc/13/17/78/335131778.db2.gz ZLPFVLUWYJDJRG-UHFFFAOYSA-N 1 2 311.784 4.029 20 0 DIADLO COCC[N@@H+](Cc1ccc(C)o1)Cc1ccc(F)cc1Cl ZINC000195674584 335131779 /nfs/dbraw/zinc/13/17/79/335131779.db2.gz ZLPFVLUWYJDJRG-UHFFFAOYSA-N 1 2 311.784 4.029 20 0 DIADLO COc1cncc(/C=C\CC[NH2+][C@@H](c2ccccc2)C(F)F)c1 ZINC000582119476 333294604 /nfs/dbraw/zinc/29/46/04/333294604.db2.gz WDUGTKABFTXZDZ-WVRJYTFGSA-N 1 2 318.367 4.090 20 0 DIADLO C[C@@H]([NH2+][C@H](CO)c1cccc(Cl)c1F)c1ccccc1F ZINC000499946440 333320397 /nfs/dbraw/zinc/32/03/97/333320397.db2.gz LXLHBUVMPRHLSH-MEBBXXQBSA-N 1 2 311.759 4.002 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCC[C@@H]3c3ccccn3)co2)cc1 ZINC000531440757 333353587 /nfs/dbraw/zinc/35/35/87/333353587.db2.gz ZWWKPHNJYIADML-LJQANCHMSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCC[C@@H]3c3ccccn3)co2)cc1 ZINC000531440757 333353588 /nfs/dbraw/zinc/35/35/88/333353588.db2.gz ZWWKPHNJYIADML-LJQANCHMSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)NCc1ccc(C(F)(F)F)cc1C ZINC000188188809 333357060 /nfs/dbraw/zinc/35/70/60/333357060.db2.gz XGXZKJQCVKYGMH-UHFFFAOYSA-N 1 2 323.318 4.039 20 0 DIADLO CC[C@@H](C(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccc(OC)cc1 ZINC000463256230 333366180 /nfs/dbraw/zinc/36/61/80/333366180.db2.gz DGOAEYKSZKXYEN-QGZVFWFLSA-N 1 2 312.413 4.148 20 0 DIADLO Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)Nc1cc[nH+]cc1C ZINC000121462321 333386466 /nfs/dbraw/zinc/38/64/66/333386466.db2.gz RWCAQISKTLHWAY-OAHLLOKOSA-N 1 2 313.401 4.127 20 0 DIADLO Cc1ccc(-c2noc(C[NH2+]C3(c4ccccc4)CCC3)n2)cc1 ZINC000123579500 333418807 /nfs/dbraw/zinc/41/88/07/333418807.db2.gz UFKDBUCOUHDBQF-UHFFFAOYSA-N 1 2 319.408 4.214 20 0 DIADLO CC(C)Oc1ccccc1C[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000236683241 333513651 /nfs/dbraw/zinc/51/36/51/333513651.db2.gz DTBQIAFUEZWAHB-ZDUSSCGKSA-N 1 2 317.433 4.005 20 0 DIADLO C[C@@H]([NH2+]Cc1cc[nH]n1)c1ccc2ccccc2c1OC(F)F ZINC000531719659 333550715 /nfs/dbraw/zinc/55/07/15/333550715.db2.gz YMQCMVOZQREIRO-LLVKDONJSA-N 1 2 317.339 4.015 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCO[C@@H](c2ccccc2)C1 ZINC000531758327 333555731 /nfs/dbraw/zinc/55/57/31/333555731.db2.gz IGFLUUAVJCCSJU-LJQANCHMSA-N 1 2 304.393 4.121 20 0 DIADLO CCCN(C(=O)Nc1cc(C)[nH+]cc1C)[C@@H]1CCc2ccccc21 ZINC000534323506 333576454 /nfs/dbraw/zinc/57/64/54/333576454.db2.gz HOXJYSNCTFBZTQ-LJQANCHMSA-N 1 2 323.440 4.052 20 0 DIADLO C[C@@H]1CCc2nc(CNc3ccc(-n4cc[nH+]c4)cc3)sc2C1 ZINC000152247534 333651307 /nfs/dbraw/zinc/65/13/07/333651307.db2.gz ZEHWWJPARZSFKZ-CYBMUJFWSA-N 1 2 324.453 4.066 20 0 DIADLO C[C@H]1CCc2nc(CNc3ccc(-n4cc[nH+]c4)cc3)sc2C1 ZINC000152247617 333651372 /nfs/dbraw/zinc/65/13/72/333651372.db2.gz ZEHWWJPARZSFKZ-ZDUSSCGKSA-N 1 2 324.453 4.066 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1nc2ccccc2n1C(F)F ZINC000411879503 333711531 /nfs/dbraw/zinc/71/15/31/333711531.db2.gz KPNRPASQFRTJBN-ZJUUUORDSA-N 1 2 322.384 4.300 20 0 DIADLO CC(C)(C)C[C@H]([NH2+][C@H]1CCO[C@@H](C(F)(F)F)C1)C(F)(F)F ZINC000571311329 333729389 /nfs/dbraw/zinc/72/93/89/333729389.db2.gz DJNLXHYZVBVPCG-LPEHRKFASA-N 1 2 321.305 4.053 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@H](C)c1c(F)cccc1Cl ZINC000571531863 333814418 /nfs/dbraw/zinc/81/44/18/333814418.db2.gz PBHCSPPRZPWQOT-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H](C)c2nc3c(s2)CCC3)c(F)c1 ZINC000414142010 333902175 /nfs/dbraw/zinc/90/21/75/333902175.db2.gz IRQVMZPITDFPJP-WDEREUQCSA-N 1 2 320.433 4.191 20 0 DIADLO C[C@@H]([NH2+]Cc1nccc(C(F)(F)F)n1)c1cc2ccccc2o1 ZINC000414235470 333917112 /nfs/dbraw/zinc/91/71/12/333917112.db2.gz HARVKGKJUBAORP-SNVBAGLBSA-N 1 2 321.302 4.092 20 0 DIADLO CCn1ccc(C[NH2+][C@H](c2cccc(C)c2)c2cccc(F)c2)n1 ZINC000414206061 333921413 /nfs/dbraw/zinc/92/14/13/333921413.db2.gz IDWXNVCXRVKHJI-HXUWFJFHSA-N 1 2 323.415 4.230 20 0 DIADLO Cc1ccc(C[S@](=O)C2CCC(C(F)(F)F)CC2)c(C)[nH+]1 ZINC000414269844 333931219 /nfs/dbraw/zinc/93/12/19/333931219.db2.gz PGESDTFPCNJUFE-ABNGFUMUSA-N 1 2 319.392 4.068 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1csnn1)c1cc(Cl)ccc1OC ZINC000414308032 333937051 /nfs/dbraw/zinc/93/70/51/333937051.db2.gz SGWOJYZTCIINIX-SKDRFNHKSA-N 1 2 311.838 4.002 20 0 DIADLO CC[N@H+](Cc1cnc(C(F)(F)F)s1)Cc1occc1C ZINC000414544349 334014470 /nfs/dbraw/zinc/01/44/70/334014470.db2.gz CPJAJKQIIUJLIV-UHFFFAOYSA-N 1 2 304.337 4.085 20 0 DIADLO CC[N@@H+](Cc1cnc(C(F)(F)F)s1)Cc1occc1C ZINC000414544349 334014471 /nfs/dbraw/zinc/01/44/71/334014471.db2.gz CPJAJKQIIUJLIV-UHFFFAOYSA-N 1 2 304.337 4.085 20 0 DIADLO CC[N@H+](Cc1nc(C2CC2)cs1)[C@H](C)c1cccc(O)c1 ZINC000343538784 335170757 /nfs/dbraw/zinc/17/07/57/335170757.db2.gz OIIJDDAJNKQHRN-GFCCVEGCSA-N 1 2 302.443 4.309 20 0 DIADLO CC[N@@H+](Cc1nc(C2CC2)cs1)[C@H](C)c1cccc(O)c1 ZINC000343538784 335170758 /nfs/dbraw/zinc/17/07/58/335170758.db2.gz OIIJDDAJNKQHRN-GFCCVEGCSA-N 1 2 302.443 4.309 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](CC(C)(C)C)c2ccccc2)no1 ZINC000271764288 334026506 /nfs/dbraw/zinc/02/65/06/334026506.db2.gz MYZJZMKSNFFFDF-HNNXBMFYSA-N 1 2 301.434 4.460 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc2c(ccc3ccccc23)o1)c1ncn(C)n1 ZINC000275629010 334072303 /nfs/dbraw/zinc/07/23/03/334072303.db2.gz BASHIUPTYFLDLF-QWHCGFSZSA-N 1 2 320.396 4.126 20 0 DIADLO COc1c(C)cc(C[N@H+](C)Cc2nc(C3CC3)cs2)cc1C ZINC000343534055 335175700 /nfs/dbraw/zinc/17/57/00/335175700.db2.gz PWBSLRUFFYPKLF-UHFFFAOYSA-N 1 2 316.470 4.278 20 0 DIADLO COc1c(C)cc(C[N@@H+](C)Cc2nc(C3CC3)cs2)cc1C ZINC000343534055 335175703 /nfs/dbraw/zinc/17/57/03/335175703.db2.gz PWBSLRUFFYPKLF-UHFFFAOYSA-N 1 2 316.470 4.278 20 0 DIADLO Cc1c([C@@H](C)Nc2ccc([NH+](C)C)cc2C)cnn1C(C)C ZINC000276564136 334082151 /nfs/dbraw/zinc/08/21/51/334082151.db2.gz SHEWZLVGDQXUHG-CQSZACIVSA-N 1 2 300.450 4.320 20 0 DIADLO CCOc1ccc(CNc2ccc3c(c2)CCC[NH2+]3)cc1OC ZINC000414857165 334130644 /nfs/dbraw/zinc/13/06/44/334130644.db2.gz ZYVQIRLBEPRXME-UHFFFAOYSA-N 1 2 312.413 4.064 20 0 DIADLO C[C@@H](Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)c1ccncc1F ZINC000340343121 334172979 /nfs/dbraw/zinc/17/29/79/334172979.db2.gz KDJXVYMODZTRBS-LLVKDONJSA-N 1 2 316.767 4.233 20 0 DIADLO c1c[nH+]c([C@H](Nc2ccc([C@@H]3CCOC3)cc2)c2ccccc2)[nH]1 ZINC000295050943 334215966 /nfs/dbraw/zinc/21/59/66/334215966.db2.gz QGSVPCYFSWGSCS-IEBWSBKVSA-N 1 2 319.408 4.115 20 0 DIADLO CSc1ccc(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000187828680 334274245 /nfs/dbraw/zinc/27/42/45/334274245.db2.gz YVBXRPOXFCFNJB-KRWDZBQOSA-N 1 2 309.438 4.011 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)Nc1ccc(C)c(Br)c1 ZINC000296347080 334232423 /nfs/dbraw/zinc/23/24/23/334232423.db2.gz HGTWSPMMOWGPGU-NSHDSACASA-N 1 2 308.223 4.147 20 0 DIADLO CC[N@H+](Cc1ncc(C(C)(C)C)o1)Cc1ccc(OC)cc1 ZINC000298760089 334251289 /nfs/dbraw/zinc/25/12/89/334251289.db2.gz ZTQHXXBZMMPVOT-UHFFFAOYSA-N 1 2 302.418 4.003 20 0 DIADLO CC[N@@H+](Cc1ncc(C(C)(C)C)o1)Cc1ccc(OC)cc1 ZINC000298760089 334251290 /nfs/dbraw/zinc/25/12/90/334251290.db2.gz ZTQHXXBZMMPVOT-UHFFFAOYSA-N 1 2 302.418 4.003 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)no1 ZINC000299068498 334252542 /nfs/dbraw/zinc/25/25/42/334252542.db2.gz AFTAEWXWYJBMSC-MRXNPFEDSA-N 1 2 307.825 4.162 20 0 DIADLO CC(C)(C)[C@H]([NH2+]Cc1nnc(C2CC2)[nH]1)c1cc2ccccc2o1 ZINC000583482271 334263623 /nfs/dbraw/zinc/26/36/23/334263623.db2.gz NIAABCNVKVDJIM-QGZVFWFLSA-N 1 2 324.428 4.305 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccsc1Br)c1nccs1 ZINC000388752565 334265697 /nfs/dbraw/zinc/26/56/97/334265697.db2.gz PFGHHKZYGBUYJV-SECBINFHSA-N 1 2 317.277 4.208 20 0 DIADLO Cc1ccc2cc(CNc3cccc(-n4cc[nH+]c4)c3)ccc2n1 ZINC000187637903 334266236 /nfs/dbraw/zinc/26/62/36/334266236.db2.gz ZBNROQPOOGLDOY-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO c1ccc(N2Cc3cccc(NC[C@H]4CC=CCC4)c3C2)[nH+]c1 ZINC000534514955 334278317 /nfs/dbraw/zinc/27/83/17/334278317.db2.gz POSLSKKKYGYOPF-INIZCTEOSA-N 1 2 305.425 4.370 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)N1CC[NH+](Cc2ccsc2)CC1 ZINC000534527103 334278885 /nfs/dbraw/zinc/27/88/85/334278885.db2.gz XXQWQMVITBYUPF-SFHVURJKSA-N 1 2 318.461 4.156 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CCc3ccccc3Cl)cc2[nH+]1 ZINC000531930328 334291056 /nfs/dbraw/zinc/29/10/56/334291056.db2.gz MWCOOGZSMZXART-UHFFFAOYSA-N 1 2 313.788 4.096 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1cc(-c2cccs2)on1 ZINC000111239654 334312260 /nfs/dbraw/zinc/31/22/60/334312260.db2.gz BQGIHTOKBJTMGO-LBPRGKRZSA-N 1 2 314.410 4.302 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1cc(-c2cccs2)on1 ZINC000111239654 334312262 /nfs/dbraw/zinc/31/22/62/334312262.db2.gz BQGIHTOKBJTMGO-LBPRGKRZSA-N 1 2 314.410 4.302 20 0 DIADLO C[C@@H]1C[N@H+](C/C=C/c2ccccc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000303862565 334337202 /nfs/dbraw/zinc/33/72/02/334337202.db2.gz GVHHTNCKLVGOOV-QKGFZSOASA-N 1 2 311.400 4.301 20 0 DIADLO C[C@@H]1C[N@@H+](C/C=C/c2ccccc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000303862565 334337203 /nfs/dbraw/zinc/33/72/03/334337203.db2.gz GVHHTNCKLVGOOV-QKGFZSOASA-N 1 2 311.400 4.301 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)c(C)c1 ZINC000534808933 334337956 /nfs/dbraw/zinc/33/79/56/334337956.db2.gz RPUMQLTUDIIMPQ-UHFFFAOYSA-N 1 2 319.408 4.320 20 0 DIADLO CC(C)c1cc(N2CC=C(C(F)(F)F)CC2)nc(C(C)C)[nH+]1 ZINC000534883352 334344134 /nfs/dbraw/zinc/34/41/34/334344134.db2.gz KOLDAAKULCMESP-UHFFFAOYSA-N 1 2 313.367 4.422 20 0 DIADLO Cn1c2ccccc2[nH+]c1N[C@H](c1nccs1)c1ccccc1 ZINC000534979214 334351510 /nfs/dbraw/zinc/35/15/10/334351510.db2.gz FWZDEJHVEGHNJO-INIZCTEOSA-N 1 2 320.421 4.231 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2ccc(C)cc2OC)o1 ZINC000531980920 334352967 /nfs/dbraw/zinc/35/29/67/334352967.db2.gz IVSWHFIFGBBMJE-WMLDXEAASA-N 1 2 317.429 4.197 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2ccc(C)cc2OC)o1 ZINC000531980919 334352990 /nfs/dbraw/zinc/35/29/90/334352990.db2.gz IVSWHFIFGBBMJE-RHSMWYFYSA-N 1 2 317.429 4.197 20 0 DIADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)[C@@H](c1ccccc1)C1CC1 ZINC000535027082 334356529 /nfs/dbraw/zinc/35/65/29/334356529.db2.gz BXXSKFXHPFTNBE-IBGZPJMESA-N 1 2 317.392 4.209 20 0 DIADLO CCn1c(C[N@@H+]2CCc3sccc3[C@H]2C)nc2ccccc21 ZINC000535066122 334362986 /nfs/dbraw/zinc/36/29/86/334362986.db2.gz IBBVWNRCFBUKQP-CYBMUJFWSA-N 1 2 311.454 4.237 20 0 DIADLO CCn1c(C[N@H+]2CCc3sccc3[C@H]2C)nc2ccccc21 ZINC000535066122 334362987 /nfs/dbraw/zinc/36/29/87/334362987.db2.gz IBBVWNRCFBUKQP-CYBMUJFWSA-N 1 2 311.454 4.237 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1cnc(C2CC2)s1 ZINC000535081160 334366102 /nfs/dbraw/zinc/36/61/02/334366102.db2.gz MPSFXYNLKGVTSP-UHFFFAOYSA-N 1 2 302.443 4.051 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1cnc(C2CC2)s1 ZINC000535081160 334366104 /nfs/dbraw/zinc/36/61/04/334366104.db2.gz MPSFXYNLKGVTSP-UHFFFAOYSA-N 1 2 302.443 4.051 20 0 DIADLO C[C@H]1CCC[C@@H]1NC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000112211349 334373829 /nfs/dbraw/zinc/37/38/29/334373829.db2.gz QYQIZCJCFDCBKT-GUYCJALGSA-N 1 2 311.385 4.184 20 0 DIADLO O=C(NC[C@@H]1CC=CCC1)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000112211642 334373904 /nfs/dbraw/zinc/37/39/04/334373904.db2.gz XYQMPBQQKMLKOT-OAHLLOKOSA-N 1 2 323.396 4.352 20 0 DIADLO Cc1cc(NC(=O)[C@H](Oc2ccccc2)c2ccccc2)cc[nH+]1 ZINC000112298411 334381482 /nfs/dbraw/zinc/38/14/82/334381482.db2.gz WZNXTSZOQWYDOI-LJQANCHMSA-N 1 2 318.376 4.149 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(Cl)cc(Cl)cc3[C@H]2C)on1 ZINC000532038715 334381626 /nfs/dbraw/zinc/38/16/26/334381626.db2.gz FGBDLDKDLJBPLR-SNVBAGLBSA-N 1 2 311.212 4.409 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(Cl)cc(Cl)cc3[C@H]2C)on1 ZINC000532038715 334381628 /nfs/dbraw/zinc/38/16/28/334381628.db2.gz FGBDLDKDLJBPLR-SNVBAGLBSA-N 1 2 311.212 4.409 20 0 DIADLO O=C(C[C@@H]1C[C@@H]1c1ccccc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000340951097 334396068 /nfs/dbraw/zinc/39/60/68/334396068.db2.gz JRYUGAPVMBQOCI-QFBILLFUSA-N 1 2 317.392 4.005 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(C(C)(C)C)cc2)o1 ZINC000341097756 334408708 /nfs/dbraw/zinc/40/87/08/334408708.db2.gz IFUUFAFNPXHIRK-OLZOCXBDSA-N 1 2 301.434 4.341 20 0 DIADLO COc1ccccc1[C@H]1CCCN1c1cc(C)[nH+]c(C2CC2)n1 ZINC000341495317 334448284 /nfs/dbraw/zinc/44/82/84/334448284.db2.gz GVJZREASOHKGOI-MRXNPFEDSA-N 1 2 309.413 4.013 20 0 DIADLO Cc1cc(N2CCC[C@H]2Cc2ccc(F)cc2)nc(C2CC2)[nH+]1 ZINC000341496384 334448302 /nfs/dbraw/zinc/44/83/02/334448302.db2.gz KTGJLNNMAITYJL-KRWDZBQOSA-N 1 2 311.404 4.013 20 0 DIADLO COc1ccc([C@@H]2CCCN2c2cc(C)[nH+]c(C3CC3)n2)cc1 ZINC000341468406 334451292 /nfs/dbraw/zinc/45/12/92/334451292.db2.gz FHUYPJTUPBCTKP-KRWDZBQOSA-N 1 2 309.413 4.013 20 0 DIADLO Cc1ccnc(C[NH2+][C@H](C)c2ccc(SC(C)C)cc2)n1 ZINC000341795399 334479835 /nfs/dbraw/zinc/47/98/35/334479835.db2.gz GRIAPJYSYUXNRK-CQSZACIVSA-N 1 2 301.459 4.136 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)cs1 ZINC000341879619 334489052 /nfs/dbraw/zinc/48/90/52/334489052.db2.gz OJQKAYNABRWIOH-LLVKDONJSA-N 1 2 322.861 4.283 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)s1 ZINC000342262085 334528382 /nfs/dbraw/zinc/52/83/82/334528382.db2.gz CJQOJWQZLOOWDV-AWEZNQCLSA-N 1 2 311.401 4.002 20 0 DIADLO C[C@@H]1CCN(c2[nH+]c3cccc(F)c3n2C)[C@H](c2ccco2)C1 ZINC000443510487 338453147 /nfs/dbraw/zinc/45/31/47/338453147.db2.gz OAXQVVFRFAMITM-DOMZBBRYSA-N 1 2 313.376 4.283 20 0 DIADLO CCc1ccc([C@@H]2CCCN2c2[nH+]c3cccc(F)c3n2C)o1 ZINC000443519961 338453485 /nfs/dbraw/zinc/45/34/85/338453485.db2.gz PTUUYEMZTWRYME-HNNXBMFYSA-N 1 2 313.376 4.209 20 0 DIADLO OCC[C@H](Nc1cc[nH+]c2c(Cl)cccc12)c1ccco1 ZINC000342870417 334585108 /nfs/dbraw/zinc/58/51/08/334585108.db2.gz MKPLWAKZXWXXSI-AWEZNQCLSA-N 1 2 302.761 4.017 20 0 DIADLO Cc1ccc(C(=O)N2C[C@H](C)[C@H](C)[C@@H]2C)cc1Oc1cc[nH+]cc1 ZINC000416071821 334649467 /nfs/dbraw/zinc/64/94/67/334649467.db2.gz MATMVWYZTDHUNO-JYJNAYRXSA-N 1 2 324.424 4.299 20 0 DIADLO Cc1ccc(C(=O)N2C[C@H](C)[C@@H](C)[C@@H]2C)cc1Oc1cc[nH+]cc1 ZINC000416071823 334649476 /nfs/dbraw/zinc/64/94/76/334649476.db2.gz MATMVWYZTDHUNO-XHSDSOJGSA-N 1 2 324.424 4.299 20 0 DIADLO Cc1nc([C@H]([NH2+]CCC(C)(C)C)c2ccc(Cl)cc2)no1 ZINC000188216645 334666529 /nfs/dbraw/zinc/66/65/29/334666529.db2.gz VNNARWHLKHARDD-CQSZACIVSA-N 1 2 307.825 4.147 20 0 DIADLO Cc1csc2nc(C)nc(NCCCc3cccc(C)[nH+]3)c12 ZINC000343239921 334723870 /nfs/dbraw/zinc/72/38/70/334723870.db2.gz SGDNAMONBQQVAZ-UHFFFAOYSA-N 1 2 312.442 4.056 20 0 DIADLO CC(C)n1c[nH+]cc1CN(C)[C@@H](C)c1nc2ccccc2s1 ZINC000425323643 334735216 /nfs/dbraw/zinc/73/52/16/334735216.db2.gz LDAKGSBKRXKOSX-ZDUSSCGKSA-N 1 2 314.458 4.267 20 0 DIADLO CC[C@H]([NH2+]Cc1cnc(C(F)(F)F)s1)c1nc(C)cs1 ZINC000443964382 338464448 /nfs/dbraw/zinc/46/44/48/338464448.db2.gz LLRZGJZBXSAWME-VIFPVBQESA-N 1 2 321.393 4.168 20 0 DIADLO C[C@H]1[C@H](Cc2ccccc2)CCN1c1cc[nH+]c2ccncc21 ZINC000444071853 338467899 /nfs/dbraw/zinc/46/78/99/338467899.db2.gz GWTXMBKPARNAPS-RDJZCZTQSA-N 1 2 303.409 4.087 20 0 DIADLO CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000331292445 334855053 /nfs/dbraw/zinc/85/50/53/334855053.db2.gz QEFYMTUUKDPWKR-VUCTXSBTSA-N 1 2 318.461 4.319 20 0 DIADLO FC(F)CC1C[NH+](Cc2cc(Cl)ccc2OC(F)F)C1 ZINC000425367018 334859292 /nfs/dbraw/zinc/85/92/92/334859292.db2.gz RNFOSWDOSYCNED-UHFFFAOYSA-N 1 2 311.706 4.028 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1F ZINC000126625874 334861436 /nfs/dbraw/zinc/86/14/36/334861436.db2.gz YIRFFOCCXPFFEK-NWDGAFQWSA-N 1 2 305.397 4.226 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nc(C(F)F)no1)c1ccc(Cl)cc1 ZINC000425386635 334862074 /nfs/dbraw/zinc/86/20/74/334862074.db2.gz SDVKXKFHPTVTFH-LBPRGKRZSA-N 1 2 315.751 4.148 20 0 DIADLO CC(C)(C)C[C@@H]([NH2+]Cc1nc(C(F)F)no1)c1ccccc1 ZINC000425460566 334913972 /nfs/dbraw/zinc/91/39/72/334913972.db2.gz QYTFXQABFIKXNK-GFCCVEGCSA-N 1 2 309.360 4.274 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@H+](Cc1ccco1)C(C)C ZINC000343717555 335186509 /nfs/dbraw/zinc/18/65/09/335186509.db2.gz GWSWWGLXERXANB-UHFFFAOYSA-N 1 2 315.392 4.199 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@@H+](Cc1ccco1)C(C)C ZINC000343717555 335186510 /nfs/dbraw/zinc/18/65/10/335186510.db2.gz GWSWWGLXERXANB-UHFFFAOYSA-N 1 2 315.392 4.199 20 0 DIADLO COc1cncc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)c1 ZINC000343835686 335200793 /nfs/dbraw/zinc/20/07/93/335200793.db2.gz CZWVGGANOSFCJI-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cncc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)c1 ZINC000343835686 335200794 /nfs/dbraw/zinc/20/07/94/335200794.db2.gz CZWVGGANOSFCJI-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO C[C@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1ccc2n[nH]cc2c1 ZINC000343992526 335206345 /nfs/dbraw/zinc/20/63/45/335206345.db2.gz YAQHDHLHMBMTNE-VIFPVBQESA-N 1 2 306.291 4.150 20 0 DIADLO C[C@@H](Nc1[nH+]ccc2ccc(F)cc21)c1ccc2n[nH]cc2c1 ZINC000343950607 335207483 /nfs/dbraw/zinc/20/74/83/335207483.db2.gz BLZHMPSJTGYUBV-LLVKDONJSA-N 1 2 306.344 4.423 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H]2CCCOc3ccc(F)cc32)s1 ZINC000344134330 335220405 /nfs/dbraw/zinc/22/04/05/335220405.db2.gz RATPFXVGRXOMOR-CQSZACIVSA-N 1 2 320.433 4.409 20 0 DIADLO CC1(C)C[N@H+](Cc2nc(C3CC3)cs2)Cc2ccccc2O1 ZINC000344104238 335223258 /nfs/dbraw/zinc/22/32/58/335223258.db2.gz HFEGJHKVJMQTBM-UHFFFAOYSA-N 1 2 314.454 4.194 20 0 DIADLO CC1(C)C[N@@H+](Cc2nc(C3CC3)cs2)Cc2ccccc2O1 ZINC000344104238 335223259 /nfs/dbraw/zinc/22/32/59/335223259.db2.gz HFEGJHKVJMQTBM-UHFFFAOYSA-N 1 2 314.454 4.194 20 0 DIADLO c1cc2c(o1)CCC[N@@H+](Cc1csc(C3CCCC3)n1)C2 ZINC000344227214 335229982 /nfs/dbraw/zinc/22/99/82/335229982.db2.gz AMGSRJSKCWOBNO-UHFFFAOYSA-N 1 2 302.443 4.342 20 0 DIADLO c1cc2c(o1)CCC[N@H+](Cc1csc(C3CCCC3)n1)C2 ZINC000344227214 335229983 /nfs/dbraw/zinc/22/99/83/335229983.db2.gz AMGSRJSKCWOBNO-UHFFFAOYSA-N 1 2 302.443 4.342 20 0 DIADLO Cc1ccc(NC(=O)c2cccc(-n3cc[nH+]c3)c2)cc1Cl ZINC000344293719 335237497 /nfs/dbraw/zinc/23/74/97/335237497.db2.gz PCNXUCMNIGDTNR-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO COCC[C@H]([NH2+]Cc1ncc(C(C)C)s1)c1ccc(C)o1 ZINC000344319117 335240632 /nfs/dbraw/zinc/24/06/32/335240632.db2.gz BGTVMUZWTNNVTH-ZDUSSCGKSA-N 1 2 308.447 4.035 20 0 DIADLO Cc1ccc2c(c1)[C@H](NC(=O)Nc1ccc(C)[nH+]c1C)CCC2 ZINC000344423265 335247513 /nfs/dbraw/zinc/24/75/13/335247513.db2.gz ICERZXVLXBMYII-GOSISDBHSA-N 1 2 309.413 4.206 20 0 DIADLO O=C(Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1)C12CCC(CC1)C2 ZINC000344880539 335282564 /nfs/dbraw/zinc/28/25/64/335282564.db2.gz OXJVZXBAANVTSR-UHFFFAOYSA-N 1 2 309.413 4.349 20 0 DIADLO Cc1ccoc1CN(C)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000345059410 335296049 /nfs/dbraw/zinc/29/60/49/335296049.db2.gz IGMIVXAGQZHFRE-UHFFFAOYSA-N 1 2 322.364 4.048 20 0 DIADLO C[C@@H]1CC[C@@H](C(=O)Nc2ccc(-c3cn4c([nH+]3)CCCC4)cc2)C1 ZINC000345133616 335304348 /nfs/dbraw/zinc/30/43/48/335304348.db2.gz AUIIHBZZUFZRFN-GDBMZVCRSA-N 1 2 323.440 4.261 20 0 DIADLO C[C@@H]([NH2+]Cc1nccn1CC(F)(F)F)c1csc(Cl)c1 ZINC000345311387 335316080 /nfs/dbraw/zinc/31/60/80/335316080.db2.gz LEFOZTGXYHCAAA-MRVPVSSYSA-N 1 2 323.771 4.011 20 0 DIADLO CC1(C)CCC([S@@](=O)Cc2cn3cc(Cl)ccc3[nH+]2)CC1 ZINC000346062192 335371996 /nfs/dbraw/zinc/37/19/96/335371996.db2.gz JNUYWNPVUGUWGH-NRFANRHFSA-N 1 2 324.877 4.205 20 0 DIADLO Cc1cc(CNc2[nH+]cccc2OC(F)F)cc2cccnc12 ZINC000346085801 335373671 /nfs/dbraw/zinc/37/36/71/335373671.db2.gz HQZLKFGHCPMBQJ-UHFFFAOYSA-N 1 2 315.323 4.152 20 0 DIADLO COc1ccc(Cl)c(NCc2cc(-n3cc[nH+]c3)cs2)c1 ZINC000346171124 335377371 /nfs/dbraw/zinc/37/73/71/335377371.db2.gz OAQVUKOFECAQIA-UHFFFAOYSA-N 1 2 319.817 4.208 20 0 DIADLO Cn1cc[nH+]c1CN1CCCC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000346154967 335382852 /nfs/dbraw/zinc/38/28/52/335382852.db2.gz UAYWSQVNUJEHJA-HNNXBMFYSA-N 1 2 323.362 4.166 20 0 DIADLO CCCCOc1ccc([C@@H](C)Nc2cc(C)[nH+]cn2)cc1OC ZINC000346730441 335432476 /nfs/dbraw/zinc/43/24/76/335432476.db2.gz DPJDEJFPFHISSY-CQSZACIVSA-N 1 2 315.417 4.146 20 0 DIADLO CCN(CC)c1ccc(N[C@@H]2CCCc3nc(C)sc32)c[nH+]1 ZINC000346947989 335452123 /nfs/dbraw/zinc/45/21/23/335452123.db2.gz VZOMSBMLRVMZTH-OAHLLOKOSA-N 1 2 316.474 4.182 20 0 DIADLO Cc1cc(-c2noc(-c3cc(C)ccc3-n3cc[nH+]c3)n2)c(C)o1 ZINC000347137835 335472769 /nfs/dbraw/zinc/47/27/69/335472769.db2.gz HDJNCDBRVVZJJY-UHFFFAOYSA-N 1 2 320.352 4.108 20 0 DIADLO Fc1ccc(C[NH2+]Cc2ncc(Cl)s2)c(C(F)(F)F)c1 ZINC000349561770 335681030 /nfs/dbraw/zinc/68/10/30/335681030.db2.gz BVAVSHNSLHODNN-UHFFFAOYSA-N 1 2 324.730 4.244 20 0 DIADLO CCN(C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)C1CCC1 ZINC000349719268 335693948 /nfs/dbraw/zinc/69/39/48/335693948.db2.gz HDJPDYLJNLTMMD-UHFFFAOYSA-N 1 2 311.385 4.280 20 0 DIADLO CC[C@@H](NC(=O)Nc1cc(C)[nH+]cc1C)c1cccc(Cl)c1 ZINC000536618635 335846415 /nfs/dbraw/zinc/84/64/15/335846415.db2.gz PNGZEJGZRQAFAN-OAHLLOKOSA-N 1 2 317.820 4.047 20 0 DIADLO COc1ccccc1CSCc1c[nH+]cn1Cc1ccccc1 ZINC000445603619 338502115 /nfs/dbraw/zinc/50/21/15/338502115.db2.gz FSFDWVMZTLWEQZ-UHFFFAOYSA-N 1 2 324.449 4.373 20 0 DIADLO COc1cc(C)[nH+]c(CNc2ccccc2OC(C)(C)C)c1 ZINC000536699693 335864803 /nfs/dbraw/zinc/86/48/03/335864803.db2.gz HXCODQVSHWGGOV-UHFFFAOYSA-N 1 2 300.402 4.188 20 0 DIADLO Cc1cccc(C2(C(=O)Nc3cccc4[nH+]ccn43)CCCC2)c1 ZINC000460329618 335875987 /nfs/dbraw/zinc/87/59/87/335875987.db2.gz DALHOFAAJMYZNP-UHFFFAOYSA-N 1 2 319.408 4.093 20 0 DIADLO CC[C@@H](O)CN(Cc1ccc(C(C)C)[nH+]c1C)c1ccccc1 ZINC000519554640 335876369 /nfs/dbraw/zinc/87/63/69/335876369.db2.gz NLPQQOKUYDQYFX-LJQANCHMSA-N 1 2 312.457 4.291 20 0 DIADLO Cc1cc(N2CCC[C@@H]2c2ccccn2)c2cccc(F)c2[nH+]1 ZINC000532205517 335914891 /nfs/dbraw/zinc/91/48/91/335914891.db2.gz DXLLYEIZWCYUEI-QGZVFWFLSA-N 1 2 307.372 4.419 20 0 DIADLO CCC[C@@H](C)c1nc(Cn2c3ccccc3[nH+]c2C(C)C)no1 ZINC000445660435 338504867 /nfs/dbraw/zinc/50/48/67/338504867.db2.gz QZJOZTLOADDGSA-CYBMUJFWSA-N 1 2 312.417 4.495 20 0 DIADLO Cc1occc1-c1nc(Cn2c3ccccc3[nH+]c2C(C)C)no1 ZINC000445660721 338504870 /nfs/dbraw/zinc/50/48/70/338504870.db2.gz WAHGYNYWAPDVJE-UHFFFAOYSA-N 1 2 322.368 4.159 20 0 DIADLO CCc1cc(N2CCCC[C@@H]2c2nc3ccccc3o2)nc(C)[nH+]1 ZINC000329280281 335959297 /nfs/dbraw/zinc/95/92/97/335959297.db2.gz DNRCAIBWLORINK-MRXNPFEDSA-N 1 2 322.412 4.220 20 0 DIADLO CCSc1ccccc1C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000520618264 335995625 /nfs/dbraw/zinc/99/56/25/335995625.db2.gz KSWZYVJXKMBQBI-UHFFFAOYSA-N 1 2 323.421 4.441 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H]1CC12CCCCC2 ZINC000520684904 336015465 /nfs/dbraw/zinc/01/54/65/336015465.db2.gz RIXVEHOCIGQDLC-OAHLLOKOSA-N 1 2 309.413 4.294 20 0 DIADLO Cc1c([C@@H](C)Nc2cc(C(C)(C)C)[nH+]c(C(C)C)n2)cnn1C ZINC000192275796 336024620 /nfs/dbraw/zinc/02/46/20/336024620.db2.gz CTDOQBRTWUZXSR-GFCCVEGCSA-N 1 2 315.465 4.113 20 0 DIADLO Cc1cc(C[NH2+]Cc2cocn2)ccc1Oc1ccc(F)cc1 ZINC000192312962 336027119 /nfs/dbraw/zinc/02/71/19/336027119.db2.gz RMOWRDABLCEUSM-UHFFFAOYSA-N 1 2 312.344 4.204 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1ccccc1)Cc1ccccn1 ZINC000351661811 336056025 /nfs/dbraw/zinc/05/60/25/336056025.db2.gz OWXCFXUNUVGLHY-UHFFFAOYSA-N 1 2 306.384 4.423 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1ccccc1)Cc1ccccn1 ZINC000351661811 336056026 /nfs/dbraw/zinc/05/60/26/336056026.db2.gz OWXCFXUNUVGLHY-UHFFFAOYSA-N 1 2 306.384 4.423 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(O)c2Cl)C[C@H](c2ccsc2)O1 ZINC000351686360 336058249 /nfs/dbraw/zinc/05/82/49/336058249.db2.gz QSNSDIHPZXDNFL-XHDPSFHLSA-N 1 2 323.845 4.069 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(O)c2Cl)C[C@H](c2ccsc2)O1 ZINC000351686360 336058251 /nfs/dbraw/zinc/05/82/51/336058251.db2.gz QSNSDIHPZXDNFL-XHDPSFHLSA-N 1 2 323.845 4.069 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3CC=CC[C@H]3C)n2)c(N2CCCC2)[nH+]1 ZINC000329766906 336079511 /nfs/dbraw/zinc/07/95/11/336079511.db2.gz YSQLSFIVCNBYJF-UKRRQHHQSA-N 1 2 324.428 4.110 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2nc(C3CC3)no2)c2ccccc2)cc1 ZINC000029455066 336110246 /nfs/dbraw/zinc/11/02/46/336110246.db2.gz LBJSCWZVIGCGRX-IBGZPJMESA-N 1 2 319.408 4.135 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccc2c(c1)CCO2 ZINC000324255695 336121362 /nfs/dbraw/zinc/12/13/62/336121362.db2.gz CFHPWPMEBPMKKC-HNNXBMFYSA-N 1 2 323.440 4.180 20 0 DIADLO COC(=O)[C@H]([NH2+]C1CCC(c2ccccc2)CC1)c1ccccc1 ZINC000324284430 336129600 /nfs/dbraw/zinc/12/96/00/336129600.db2.gz PXITZTIMGQIEOE-LYBXBRPPSA-N 1 2 323.436 4.217 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+]2CCC[C@H]2c2ccc(C)o2)n1 ZINC000331375015 336134077 /nfs/dbraw/zinc/13/40/77/336134077.db2.gz CSXDMEULHFCPTN-KGLIPLIRSA-N 1 2 303.406 4.212 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+]2CCC[C@H]2c2ccc(C)o2)n1 ZINC000331375015 336134079 /nfs/dbraw/zinc/13/40/79/336134079.db2.gz CSXDMEULHFCPTN-KGLIPLIRSA-N 1 2 303.406 4.212 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC000332484335 336172943 /nfs/dbraw/zinc/17/29/43/336172943.db2.gz NIOBKLSGNDRWPV-OWCLPIDISA-N 1 2 301.434 4.179 20 0 DIADLO Clc1ccccc1C1=CC[N@H+](Cc2ncc(C3CC3)o2)CC1 ZINC000351935220 336181171 /nfs/dbraw/zinc/18/11/71/336181171.db2.gz LTJIOIQMMQCVHX-UHFFFAOYSA-N 1 2 314.816 4.495 20 0 DIADLO Clc1ccccc1C1=CC[N@@H+](Cc2ncc(C3CC3)o2)CC1 ZINC000351935220 336181173 /nfs/dbraw/zinc/18/11/73/336181173.db2.gz LTJIOIQMMQCVHX-UHFFFAOYSA-N 1 2 314.816 4.495 20 0 DIADLO CSc1ccccc1CN(C)C(=O)Nc1c(C)cc[nH+]c1C ZINC000351942196 336184259 /nfs/dbraw/zinc/18/42/59/336184259.db2.gz BZJBFUXQGZYPPW-UHFFFAOYSA-N 1 2 315.442 4.084 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)cc1 ZINC000351998103 336187193 /nfs/dbraw/zinc/18/71/93/336187193.db2.gz XGKZUOSRPZIQAK-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ncc(Cl)s2)cc1 ZINC000351998103 336187194 /nfs/dbraw/zinc/18/71/94/336187194.db2.gz XGKZUOSRPZIQAK-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO C[N@H+](Cc1ncc(Cl)s1)Cc1ccccc1C(F)(F)F ZINC000351996170 336187325 /nfs/dbraw/zinc/18/73/25/336187325.db2.gz MZMHRJIEMCZQKD-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1ncc(Cl)s1)Cc1ccccc1C(F)(F)F ZINC000351996170 336187326 /nfs/dbraw/zinc/18/73/26/336187326.db2.gz MZMHRJIEMCZQKD-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ncc(Cl)s1 ZINC000352001657 336187502 /nfs/dbraw/zinc/18/75/02/336187502.db2.gz HBANWUZYFYPOGX-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1ncc(Cl)s1 ZINC000352001657 336187503 /nfs/dbraw/zinc/18/75/03/336187503.db2.gz HBANWUZYFYPOGX-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+]2CC=C(c3c(F)cccc3F)CC2)o1 ZINC000352022853 336190004 /nfs/dbraw/zinc/19/00/04/336190004.db2.gz RMHPTGQVUDICID-GFCCVEGCSA-N 1 2 304.340 4.112 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+]2CC=C(c3c(F)cccc3F)CC2)o1 ZINC000352022853 336190005 /nfs/dbraw/zinc/19/00/05/336190005.db2.gz RMHPTGQVUDICID-GFCCVEGCSA-N 1 2 304.340 4.112 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1ccc2c(c1)CCC=C2 ZINC000352215294 336203554 /nfs/dbraw/zinc/20/35/54/336203554.db2.gz BYLIGKPZSMPUEL-UHFFFAOYSA-N 1 2 315.376 4.084 20 0 DIADLO CC[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc2c(c1)CCO2 ZINC000324386449 336204897 /nfs/dbraw/zinc/20/48/97/336204897.db2.gz OTFICNZLHRMENU-SFHVURJKSA-N 1 2 323.440 4.180 20 0 DIADLO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1)c1nccn1-c1ccccc1 ZINC000352334900 336212910 /nfs/dbraw/zinc/21/29/10/336212910.db2.gz MWMUBSUDLOWMQY-RVKKMQEKSA-N 1 2 321.424 4.440 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+](C)Cc3cnccc3C)n2)cc1 ZINC000352395000 336216024 /nfs/dbraw/zinc/21/60/24/336216024.db2.gz XUFAHQYZEGTTLW-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+](C)Cc3cnccc3C)n2)cc1 ZINC000352395000 336216025 /nfs/dbraw/zinc/21/60/25/336216025.db2.gz XUFAHQYZEGTTLW-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Fc1cccc(Cl)c1C[N@@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000352439166 336218762 /nfs/dbraw/zinc/21/87/62/336218762.db2.gz KHJMZRDTIVOYQB-CVEARBPZSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cccc(Cl)c1C[N@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000352439166 336218763 /nfs/dbraw/zinc/21/87/63/336218763.db2.gz KHJMZRDTIVOYQB-CVEARBPZSA-N 1 2 309.812 4.013 20 0 DIADLO CC(C)(C)OCCCCn1nc(C(F)(F)F)c2c[nH+]ccc21 ZINC000352548801 336224044 /nfs/dbraw/zinc/22/40/44/336224044.db2.gz WCHYUELRBMIMEU-UHFFFAOYSA-N 1 2 315.339 4.045 20 0 DIADLO CC(C)c1nn(-c2ccccc2)cc1C[N@H+](C)Cc1ccoc1 ZINC000352649850 336228623 /nfs/dbraw/zinc/22/86/23/336228623.db2.gz PUPRYEJQGCJLKT-UHFFFAOYSA-N 1 2 309.413 4.221 20 0 DIADLO CC(C)c1nn(-c2ccccc2)cc1C[N@@H+](C)Cc1ccoc1 ZINC000352649850 336228624 /nfs/dbraw/zinc/22/86/24/336228624.db2.gz PUPRYEJQGCJLKT-UHFFFAOYSA-N 1 2 309.413 4.221 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@H+](C)Cc1ccoc1 ZINC000352649565 336228628 /nfs/dbraw/zinc/22/86/28/336228628.db2.gz LMQLPBWIQVSYPT-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@@H+](C)Cc1ccoc1 ZINC000352649565 336228629 /nfs/dbraw/zinc/22/86/29/336228629.db2.gz LMQLPBWIQVSYPT-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO Cc1ccc(F)cc1C[N@H+](C)Cc1nccn1Cc1ccccc1 ZINC000352691558 336230810 /nfs/dbraw/zinc/23/08/10/336230810.db2.gz AWFNVQFOBLPSDY-UHFFFAOYSA-N 1 2 323.415 4.011 20 0 DIADLO Cc1ccc(F)cc1C[N@@H+](C)Cc1nccn1Cc1ccccc1 ZINC000352691558 336230811 /nfs/dbraw/zinc/23/08/11/336230811.db2.gz AWFNVQFOBLPSDY-UHFFFAOYSA-N 1 2 323.415 4.011 20 0 DIADLO CCC(C)(C)C1CCC2(C[C@H]2C(=O)N(C)Cc2[nH]cc[nH+]2)CC1 ZINC000352726530 336232681 /nfs/dbraw/zinc/23/26/81/336232681.db2.gz UONBKNDHFQUNRS-HVEKOLDVSA-N 1 2 317.477 4.001 20 0 DIADLO COc1c(O)cccc1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC000352744281 336234245 /nfs/dbraw/zinc/23/42/45/336234245.db2.gz NCLPMPANFNXTQT-UHFFFAOYSA-N 1 2 323.392 4.196 20 0 DIADLO COc1c(O)cccc1C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000352744281 336234246 /nfs/dbraw/zinc/23/42/46/336234246.db2.gz NCLPMPANFNXTQT-UHFFFAOYSA-N 1 2 323.392 4.196 20 0 DIADLO c1ccc(C[C@H]([NH2+]Cc2nc(C3CC3)no2)c2ccccc2)cc1 ZINC000352757562 336235297 /nfs/dbraw/zinc/23/52/97/336235297.db2.gz KEZSKUZTMITQSF-SFHVURJKSA-N 1 2 319.408 4.021 20 0 DIADLO Cc1ccc(C(C)(C)C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000103078120 336237564 /nfs/dbraw/zinc/23/75/64/336237564.db2.gz OOUNHNUUCZOEQN-UHFFFAOYSA-N 1 2 319.408 4.301 20 0 DIADLO C[N@H+](CCC(F)(F)F)Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000103227735 336238952 /nfs/dbraw/zinc/23/89/52/336238952.db2.gz ATKYXUCLZXUGHM-UHFFFAOYSA-N 1 2 320.261 4.004 20 0 DIADLO C[N@@H+](CCC(F)(F)F)Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000103227735 336238953 /nfs/dbraw/zinc/23/89/53/336238953.db2.gz ATKYXUCLZXUGHM-UHFFFAOYSA-N 1 2 320.261 4.004 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2cccc(-c3ccncc3)c2)s1 ZINC000532329017 336240722 /nfs/dbraw/zinc/24/07/22/336240722.db2.gz KPRSERBEFKQNTM-UHFFFAOYSA-N 1 2 324.453 4.013 20 0 DIADLO Cc1ccsc1CNC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000352804459 336241036 /nfs/dbraw/zinc/24/10/36/336241036.db2.gz DQVUUQZLGBBCMJ-UHFFFAOYSA-N 1 2 324.405 4.174 20 0 DIADLO CC[C@H](C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccccc1 ZINC000103964778 336243164 /nfs/dbraw/zinc/24/31/64/336243164.db2.gz RNWGHQIBBFFRFI-KRWDZBQOSA-N 1 2 305.381 4.209 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2)C[C@H](c2ccsc2)O1 ZINC000532352203 336243729 /nfs/dbraw/zinc/24/37/29/336243729.db2.gz SGMHVIYEXXZLCG-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2)C[C@H](c2ccsc2)O1 ZINC000532352203 336243730 /nfs/dbraw/zinc/24/37/30/336243730.db2.gz SGMHVIYEXXZLCG-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1cc(C)cc([C@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)c1 ZINC000532452343 336250131 /nfs/dbraw/zinc/25/01/31/336250131.db2.gz MJPYPGBQGGWTNG-PXNSSMCTSA-N 1 2 319.452 4.477 20 0 DIADLO CC(C)(C)C1CCC(CC(=O)NCCCCn2cc[nH+]c2)CC1 ZINC000532494718 336250859 /nfs/dbraw/zinc/25/08/59/336250859.db2.gz SVKSFCZEHXDHSH-UHFFFAOYSA-N 1 2 319.493 4.022 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+](Cc2ccco2)C(C)C)c(Cl)c1 ZINC000532487955 336251749 /nfs/dbraw/zinc/25/17/49/336251749.db2.gz RVVXHDDRQSVDAV-UHFFFAOYSA-N 1 2 320.820 4.091 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+](Cc2ccco2)C(C)C)c(Cl)c1 ZINC000532487955 336251750 /nfs/dbraw/zinc/25/17/50/336251750.db2.gz RVVXHDDRQSVDAV-UHFFFAOYSA-N 1 2 320.820 4.091 20 0 DIADLO COc1cccc(-c2nc(C[NH+]3Cc4ccccc4C3)cs2)c1 ZINC000532547519 336254816 /nfs/dbraw/zinc/25/48/16/336254816.db2.gz BITLUJZFJQSILR-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2nccs2)c2ccc(C)cc2)cc1 ZINC000532610357 336257492 /nfs/dbraw/zinc/25/74/92/336257492.db2.gz PCPGZAZSJSPFNG-IBGZPJMESA-N 1 2 324.449 4.339 20 0 DIADLO COCc1cccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000192703962 336258894 /nfs/dbraw/zinc/25/88/94/336258894.db2.gz VHSZUMRSPODXGG-OAHLLOKOSA-N 1 2 307.397 4.192 20 0 DIADLO CCn1cc[nH+]c1CNc1ccc2oc(CC(C)(C)C)nc2c1 ZINC000532736608 336268777 /nfs/dbraw/zinc/26/87/77/336268777.db2.gz CAXVCCCYYKJEMO-UHFFFAOYSA-N 1 2 312.417 4.245 20 0 DIADLO CCOc1ccccc1N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000192900354 336282323 /nfs/dbraw/zinc/28/23/23/336282323.db2.gz PQOKPXYIOTTZBV-OAHLLOKOSA-N 1 2 307.397 4.444 20 0 DIADLO COc1ccc(C)cc1N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000192902775 336283158 /nfs/dbraw/zinc/28/31/58/336283158.db2.gz FREYEXJSDNQJHB-OAHLLOKOSA-N 1 2 307.397 4.362 20 0 DIADLO Clc1nc(NCCc2cn3ccccc3[nH+]2)cc2ccccc12 ZINC000301064622 336288078 /nfs/dbraw/zinc/28/80/78/336288078.db2.gz FYUUCVOVEBQYOG-UHFFFAOYSA-N 1 2 322.799 4.191 20 0 DIADLO c1cnn(Cc2ccccc2CNc2ccc3ccccc3[nH+]2)c1 ZINC000301098036 336289956 /nfs/dbraw/zinc/28/99/56/336289956.db2.gz QCTQGLVFFGHERG-UHFFFAOYSA-N 1 2 314.392 4.092 20 0 DIADLO COc1cccc(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)c1 ZINC000352875576 336289997 /nfs/dbraw/zinc/28/99/97/336289997.db2.gz ILNHWCRWNBOBDC-UHFFFAOYSA-N 1 2 320.348 4.135 20 0 DIADLO Cc1cc(N2CCC(OC3CCCCC3)CC2)nc(C(C)C)[nH+]1 ZINC000301118500 336290792 /nfs/dbraw/zinc/29/07/92/336290792.db2.gz POWWWUZBJGPJHP-UHFFFAOYSA-N 1 2 317.477 4.227 20 0 DIADLO c1ccc(N2CCC(Nc3ccc4ccccc4[nH+]3)CC2)cc1 ZINC000301116830 336290868 /nfs/dbraw/zinc/29/08/68/336290868.db2.gz YQPBHZBPYAJAOO-UHFFFAOYSA-N 1 2 303.409 4.316 20 0 DIADLO Cc1cc(N[C@H](c2ccccc2)C2CC2)nc(-c2cccnc2)[nH+]1 ZINC000301124944 336291252 /nfs/dbraw/zinc/29/12/52/336291252.db2.gz PNJMZKLKZORCMP-LJQANCHMSA-N 1 2 316.408 4.410 20 0 DIADLO Cc1cccc2[nH+]c(CNc3cc4ccccc4c(Cl)n3)cn21 ZINC000301214617 336295277 /nfs/dbraw/zinc/29/52/77/336295277.db2.gz YQXKZZMSYUPYRI-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO CN(Cc1cccc(C(F)(F)F)c1)c1cc[nH+]c(C2CC2)n1 ZINC000301226422 336295633 /nfs/dbraw/zinc/29/56/33/336295633.db2.gz FBPFOFLQCFRKLS-UHFFFAOYSA-N 1 2 307.319 4.009 20 0 DIADLO Cc1ccc(CNc2nc(-c3ccncc3)[nH+]c(C)c2C)s1 ZINC000301275080 336298071 /nfs/dbraw/zinc/29/80/71/336298071.db2.gz OOGYJFIEHITSES-UHFFFAOYSA-N 1 2 310.426 4.137 20 0 DIADLO Clc1ccccc1C[C@@H]1CCCN1c1cc[nH+]c(C2CC2)n1 ZINC000301276419 336298242 /nfs/dbraw/zinc/29/82/42/336298242.db2.gz ZLEWEBLZNOAZIR-HNNXBMFYSA-N 1 2 313.832 4.219 20 0 DIADLO CCOc1ccc([C@@H](Nc2cc(C)[nH+]cn2)c2ccccc2)cc1 ZINC000301281774 336298563 /nfs/dbraw/zinc/29/85/63/336298563.db2.gz QEKRTJUUPOUKNR-FQEVSTJZSA-N 1 2 319.408 4.385 20 0 DIADLO Cc1cc(NC[C@H]2C[C@@H]2c2ccccc2)nc(-c2cccnc2)[nH+]1 ZINC000301293213 336299215 /nfs/dbraw/zinc/29/92/15/336299215.db2.gz XKVFEPUJFCUPTB-QZTJIDSGSA-N 1 2 316.408 4.063 20 0 DIADLO CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)Nc1cc[nH+]c(C2CC2)n1 ZINC000301295143 336299317 /nfs/dbraw/zinc/29/93/17/336299317.db2.gz WYEWPBACQWBXQP-BDJLRTHQSA-N 1 2 317.820 4.196 20 0 DIADLO Fc1cccc(N2CCC(Nc3ccc4ccccc4[nH+]3)CC2)c1 ZINC000301335321 336301178 /nfs/dbraw/zinc/30/11/78/336301178.db2.gz BVUUSVWWQAKHDJ-UHFFFAOYSA-N 1 2 321.399 4.455 20 0 DIADLO CCc1cc(N2CCC3(CCCC3)CC2)nc(-c2ccncc2)[nH+]1 ZINC000301370121 336302893 /nfs/dbraw/zinc/30/28/93/336302893.db2.gz PNTOASNNVJXJGQ-UHFFFAOYSA-N 1 2 322.456 4.262 20 0 DIADLO Fc1cccc(Cl)c1[C@@H]1C[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000301380747 336303661 /nfs/dbraw/zinc/30/36/61/336303661.db2.gz YGHYDPHPLRTWRP-ZWNOBZJWSA-N 1 2 303.768 4.115 20 0 DIADLO Cc1cc(NC[C@@H](C)Cc2cccs2)nc(-c2cccnc2)[nH+]1 ZINC000301427594 336306153 /nfs/dbraw/zinc/30/61/53/336306153.db2.gz PLNSJDLXVCPDMR-ZDUSSCGKSA-N 1 2 324.453 4.199 20 0 DIADLO CCc1cc(N2CCC3(C2)CCCCC3)nc(-c2ccncc2)[nH+]1 ZINC000301461496 336308287 /nfs/dbraw/zinc/30/82/87/336308287.db2.gz OEIMMRANPIFMPI-UHFFFAOYSA-N 1 2 322.456 4.262 20 0 DIADLO FC(F)Oc1ccccc1CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000301500146 336310753 /nfs/dbraw/zinc/31/07/53/336310753.db2.gz AJQXELWCZXKSNW-UHFFFAOYSA-N 1 2 318.245 4.314 20 0 DIADLO CC(C)(C)c1nc(NCc2ccc(-c3cccnc3)cc2)cc[nH+]1 ZINC000301511431 336311422 /nfs/dbraw/zinc/31/14/22/336311422.db2.gz FFTULQVUCIVJQD-UHFFFAOYSA-N 1 2 318.424 4.448 20 0 DIADLO Cc1cc(N2CCC(OCC3CCCC3)CC2)nc(C(C)C)[nH+]1 ZINC000301549382 336314239 /nfs/dbraw/zinc/31/42/39/336314239.db2.gz FNSMBELXFXVNRF-UHFFFAOYSA-N 1 2 317.477 4.084 20 0 DIADLO COc1ccc(Cl)cc1CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000301554843 336314528 /nfs/dbraw/zinc/31/45/28/336314528.db2.gz ZKZYQOFAUNZCKR-UHFFFAOYSA-N 1 2 316.710 4.375 20 0 DIADLO Cc1cnc([C@H](Nc2cc[nH+]c(C(C)(C)C)n2)C2CC2)s1 ZINC000301583747 336316338 /nfs/dbraw/zinc/31/63/38/336316338.db2.gz OGDQULKOLFMMHQ-CYBMUJFWSA-N 1 2 302.447 4.102 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N(Cc2ccco2)Cc2ccco2)c1 ZINC000301604931 336317860 /nfs/dbraw/zinc/31/78/60/336317860.db2.gz XXTGWCARARUFQE-UHFFFAOYSA-N 1 2 322.286 4.493 20 0 DIADLO COc1cccc([C@H]2CCCN2c2cc(C(F)(F)F)cc[nH+]2)c1 ZINC000301607392 336317965 /nfs/dbraw/zinc/31/79/65/336317965.db2.gz ZFCFDYPUDNGDMU-OAHLLOKOSA-N 1 2 322.330 4.451 20 0 DIADLO Cc1cnc([C@H](Nc2cc(C)[nH+]c(C(C)C)n2)C2CC2)s1 ZINC000301607866 336317973 /nfs/dbraw/zinc/31/79/73/336317973.db2.gz ZODSWEUGYRAENX-CQSZACIVSA-N 1 2 302.447 4.237 20 0 DIADLO CC[C@H](Nc1cc(C)[nH+]c(C(C)C)n1)c1nc2ccccc2[nH]1 ZINC000301623315 336318961 /nfs/dbraw/zinc/31/89/61/336318961.db2.gz GDTOBIYNGLOLFN-ZDUSSCGKSA-N 1 2 309.417 4.348 20 0 DIADLO Cc1cc(NC[C@](C)(O)c2cccs2)c2cccc(F)c2[nH+]1 ZINC000301648659 336320581 /nfs/dbraw/zinc/32/05/81/336320581.db2.gz FCZVPDFEBGIUOY-KRWDZBQOSA-N 1 2 316.401 4.063 20 0 DIADLO Cc1csc([C@@H](Nc2cc(C)[nH+]c(C(C)C)n2)C2CC2)n1 ZINC000301647995 336320674 /nfs/dbraw/zinc/32/06/74/336320674.db2.gz IQHSAIOKZHSSKY-AWEZNQCLSA-N 1 2 302.447 4.237 20 0 DIADLO Cc1cc(N[C@@H]2CCC[C@H]3OCC[C@H]32)c2cccc(F)c2[nH+]1 ZINC000301653753 336321034 /nfs/dbraw/zinc/32/10/34/336321034.db2.gz ABDDRIUSKYNAMX-XGWLTEMNSA-N 1 2 300.377 4.052 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCO[C@H](c2ccsc2)C1 ZINC000301693709 336323840 /nfs/dbraw/zinc/32/38/40/336323840.db2.gz ABFRGSVBWDDXLG-KRWDZBQOSA-N 1 2 310.422 4.183 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCO[C@@H](c2ccccc2F)C1 ZINC000301694664 336323908 /nfs/dbraw/zinc/32/39/08/336323908.db2.gz ANHZYOQEGTXEEG-LJQANCHMSA-N 1 2 322.383 4.260 20 0 DIADLO Clc1ccccc1OC[C@H]1CCCN(c2cccc[nH+]2)C1 ZINC000301797723 336330601 /nfs/dbraw/zinc/33/06/01/336330601.db2.gz ARUCZXYKQQBAEN-AWEZNQCLSA-N 1 2 302.805 4.030 20 0 DIADLO COC[C@@H](Nc1cc(C(C)C)[nH+]c(C(C)C)n1)c1ccc(C)o1 ZINC000301850229 336333932 /nfs/dbraw/zinc/33/39/32/336333932.db2.gz DYLZPQPCFUXNGD-OAHLLOKOSA-N 1 2 317.433 4.424 20 0 DIADLO FC(F)(F)c1ccc(Nc2ccc([NH+]3CCCCC3)cc2)nn1 ZINC000301850772 336334038 /nfs/dbraw/zinc/33/40/38/336334038.db2.gz WSWQHTPFNHGFAN-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO COc1ccc([C@H](Nc2nc(N)c3ccccc3[nH+]2)C(C)C)cc1 ZINC000301858027 336334565 /nfs/dbraw/zinc/33/45/65/336334565.db2.gz DPACFOJVMPHBJG-QGZVFWFLSA-N 1 2 322.412 4.030 20 0 DIADLO Nc1nc(N2CCC[C@@H]2c2cccc(Cl)c2)[nH+]c2ccccc12 ZINC000301873035 336335532 /nfs/dbraw/zinc/33/55/32/336335532.db2.gz JFZQWCHJPIOXRB-MRXNPFEDSA-N 1 2 324.815 4.207 20 0 DIADLO CC(C)c1cc(N[C@@H]2CCC[C@H]3OCC[C@@H]32)nc(C(C)C)[nH+]1 ZINC000301875923 336335618 /nfs/dbraw/zinc/33/56/18/336335618.db2.gz RWMQJRWWECCXGT-IIAWOOMASA-N 1 2 303.450 4.093 20 0 DIADLO CC[C@H](Nc1nc(N)c2ccccc2[nH+]1)c1cc(F)ccc1F ZINC000301889407 336336344 /nfs/dbraw/zinc/33/63/44/336336344.db2.gz LHYGNUSQAYHFTP-AWEZNQCLSA-N 1 2 314.339 4.053 20 0 DIADLO C[C@H](CCNc1[nH+]cnc2c1cnn2C(C)(C)C)c1ccccc1 ZINC000301898671 336336975 /nfs/dbraw/zinc/33/69/75/336336975.db2.gz SJSFEVISKQEBJP-CQSZACIVSA-N 1 2 323.444 4.187 20 0 DIADLO Fc1cccc([C@@H]2C[N@H+](Cc3coc4ccccc34)CCO2)c1 ZINC000514101173 336337617 /nfs/dbraw/zinc/33/76/17/336337617.db2.gz ZEYSFWDRNBPMBO-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO Fc1cccc([C@@H]2C[N@@H+](Cc3coc4ccccc34)CCO2)c1 ZINC000514101173 336337618 /nfs/dbraw/zinc/33/76/18/336337618.db2.gz ZEYSFWDRNBPMBO-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO CCc1cc(N2CCCC[C@H]2C(C)C)nc(-c2ccncc2)[nH+]1 ZINC000301991201 336341857 /nfs/dbraw/zinc/34/18/57/336341857.db2.gz YGCOFFYQKAAFIS-KRWDZBQOSA-N 1 2 310.445 4.116 20 0 DIADLO CC(C)c1nc(N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)cc[nH+]1 ZINC000301992914 336341943 /nfs/dbraw/zinc/34/19/43/336341943.db2.gz OCKYZPJQRBUMEU-HOCLYGCPSA-N 1 2 317.820 4.196 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)N(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000302112717 336349105 /nfs/dbraw/zinc/34/91/05/336349105.db2.gz BCSGHEOZZAAAII-BXUZGUMPSA-N 1 2 307.319 4.083 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)N(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000302112720 336349149 /nfs/dbraw/zinc/34/91/49/336349149.db2.gz BCSGHEOZZAAAII-SMDDNHRTSA-N 1 2 307.319 4.083 20 0 DIADLO CC(C)c1cc(NC[C@H](C)c2nccs2)nc(C(C)C)[nH+]1 ZINC000302130844 336349917 /nfs/dbraw/zinc/34/99/17/336349917.db2.gz KGCJUSOOYQWAMX-LBPRGKRZSA-N 1 2 304.463 4.396 20 0 DIADLO CC(C)c1cc(NCC2(c3ccccn3)CC2)nc(C(C)C)[nH+]1 ZINC000302186351 336352964 /nfs/dbraw/zinc/35/29/64/336352964.db2.gz UHFMGDZFRQUPAP-UHFFFAOYSA-N 1 2 310.445 4.262 20 0 DIADLO Cn1cc(CNc2ccc3ccccc3[nH+]2)c(-c2ccccc2)n1 ZINC000302194052 336353357 /nfs/dbraw/zinc/35/33/57/336353357.db2.gz RYPPTEWMFWQASK-UHFFFAOYSA-N 1 2 314.392 4.247 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCC(O)(c2ccccc2)CC1 ZINC000302214122 336354286 /nfs/dbraw/zinc/35/42/86/336354286.db2.gz NYHWOYUXBZSQLH-UHFFFAOYSA-N 1 2 318.420 4.031 20 0 DIADLO Clc1ccc(C2CCN(c3cc[nH+]c(C4CC4)n3)CC2)cc1 ZINC000302337711 336357370 /nfs/dbraw/zinc/35/73/70/336357370.db2.gz BCGBLONYSYHHSE-UHFFFAOYSA-N 1 2 313.832 4.391 20 0 DIADLO Cc1cc(N2CCC(C)(C(C)C)CC2)nc(-c2ccncc2)[nH+]1 ZINC000302353182 336357490 /nfs/dbraw/zinc/35/74/90/336357490.db2.gz BWTJHIVXPMZDBD-UHFFFAOYSA-N 1 2 310.445 4.110 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NCCc2nc3ccccc3s2)c1 ZINC000302463919 336359348 /nfs/dbraw/zinc/35/93/48/336359348.db2.gz RZRTUTBNTAMTEB-UHFFFAOYSA-N 1 2 323.343 4.365 20 0 DIADLO COc1ccc(F)cc1CNc1cc[nH+]c2c(OC)cccc12 ZINC000302522100 336360718 /nfs/dbraw/zinc/36/07/18/336360718.db2.gz JBOBDYBEAHHOLT-UHFFFAOYSA-N 1 2 312.344 4.003 20 0 DIADLO COc1cccc2c(NCCC[C@@H]3CCCCO3)cc[nH+]c12 ZINC000302536005 336361093 /nfs/dbraw/zinc/36/10/93/336361093.db2.gz MLOIAJLLBKMHQG-AWEZNQCLSA-N 1 2 300.402 4.005 20 0 DIADLO Cc1cc(N2CCC([C@@H]3CCCO3)CC2)c2cccc(F)c2[nH+]1 ZINC000302556944 336361590 /nfs/dbraw/zinc/36/15/90/336361590.db2.gz LSWIYWJEWNGHIO-SFHVURJKSA-N 1 2 314.404 4.078 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC(C(F)(F)F)CC1 ZINC000302596564 336362334 /nfs/dbraw/zinc/36/23/34/336362334.db2.gz BHDGPQALFCYPRR-UHFFFAOYSA-N 1 2 324.346 4.331 20 0 DIADLO Cc1cccc2c1OCC[C@H]2Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000302632479 336362990 /nfs/dbraw/zinc/36/29/90/336362990.db2.gz CGWIJTLHCFUITQ-CYBMUJFWSA-N 1 2 308.303 4.345 20 0 DIADLO COc1cccc2c(N[C@@H](C)c3cccc(O)c3)c(C)c[nH+]c12 ZINC000302677092 336364516 /nfs/dbraw/zinc/36/45/16/336364516.db2.gz UZDFJCIQDSOPRM-ZDUSSCGKSA-N 1 2 308.381 4.431 20 0 DIADLO COc1cccc2c(NCc3ccnc(OC(C)C)c3)cc[nH+]c12 ZINC000302680607 336364712 /nfs/dbraw/zinc/36/47/12/336364712.db2.gz RQUHAVORHHVOSV-UHFFFAOYSA-N 1 2 323.396 4.038 20 0 DIADLO CCOC1CC(CCNc2cc(C)[nH+]c3c(F)cccc23)C1 ZINC000302711468 336366097 /nfs/dbraw/zinc/36/60/97/336366097.db2.gz XAMUZDVGGNPRLS-UHFFFAOYSA-N 1 2 302.393 4.299 20 0 DIADLO Cc1cc(NCc2ccc(C3CC3)cc2)nc(-c2cccnc2)[nH+]1 ZINC000302738394 336367332 /nfs/dbraw/zinc/36/73/32/336367332.db2.gz XXMTXFMLBJDWJH-UHFFFAOYSA-N 1 2 316.408 4.337 20 0 DIADLO COc1cc(Br)ccc1[C@H](C)Nc1cccc[nH+]1 ZINC000302741400 336367476 /nfs/dbraw/zinc/36/74/76/336367476.db2.gz CXULVBQHVJMIRB-JTQLQIEISA-N 1 2 307.191 4.026 20 0 DIADLO Cc1nc(CNc2cc(C(C)(C)C)[nH+]c(C(C)C)n2)oc1C ZINC000302773867 336368430 /nfs/dbraw/zinc/36/84/30/336368430.db2.gz NVWJQQLDDBEZCU-UHFFFAOYSA-N 1 2 302.422 4.114 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)Nc1cc(N2CCCC2)nc[nH+]1 ZINC000302805001 336369993 /nfs/dbraw/zinc/36/99/93/336369993.db2.gz WJJZXGQDDXVNFM-CQSZACIVSA-N 1 2 322.412 4.305 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)Nc1cc(N2CCCC2)[nH+]cn1 ZINC000302805001 336369994 /nfs/dbraw/zinc/36/99/94/336369994.db2.gz WJJZXGQDDXVNFM-CQSZACIVSA-N 1 2 322.412 4.305 20 0 DIADLO CC(C)c1nc(N[C@@H]2CCOC(C)(C)C2)cc(C(C)(C)C)[nH+]1 ZINC000302862281 336372326 /nfs/dbraw/zinc/37/23/26/336372326.db2.gz WBILWFWKSLPBMF-CYBMUJFWSA-N 1 2 305.466 4.267 20 0 DIADLO CCOC[C@H]1CCCN(c2cc(C(C)(C)C)[nH+]c(C(C)C)n2)C1 ZINC000302878276 336372961 /nfs/dbraw/zinc/37/29/61/336372961.db2.gz GJXGSIMALAHIHA-HNNXBMFYSA-N 1 2 319.493 4.150 20 0 DIADLO CC(C)c1nc(N(C)[C@@H](C)c2ccccn2)cc(C(C)(C)C)[nH+]1 ZINC000302887472 336373237 /nfs/dbraw/zinc/37/32/37/336373237.db2.gz MCIBCEQLESCGJL-AWEZNQCLSA-N 1 2 312.461 4.490 20 0 DIADLO Cc1ncsc1CNc1cc(C(C)(C)C)[nH+]c(C(C)C)n1 ZINC000302893898 336373579 /nfs/dbraw/zinc/37/35/79/336373579.db2.gz OKUIISMVXAHVSV-UHFFFAOYSA-N 1 2 304.463 4.275 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1ccc(N3CCCCC3)[nH+]c1)CC2 ZINC000392033232 336374518 /nfs/dbraw/zinc/37/45/18/336374518.db2.gz IJIVIKOTTAUSSD-IBGZPJMESA-N 1 2 323.440 4.180 20 0 DIADLO CC(C)(C)OCCCCSCc1[nH+]ccn1CC(F)(F)F ZINC000352917878 336376999 /nfs/dbraw/zinc/37/69/99/336376999.db2.gz VTZOATCJWIPOJG-UHFFFAOYSA-N 1 2 324.412 4.274 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC000352955080 336379151 /nfs/dbraw/zinc/37/91/51/336379151.db2.gz HIDMIKNYCZDMOK-UHFFFAOYSA-N 1 2 303.409 4.161 20 0 DIADLO Cc1[nH]ncc1C[N@@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC000352955080 336379152 /nfs/dbraw/zinc/37/91/52/336379152.db2.gz HIDMIKNYCZDMOK-UHFFFAOYSA-N 1 2 303.409 4.161 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCc3c(C)cc(C)cc3C2)s1 ZINC000352954716 336379171 /nfs/dbraw/zinc/37/91/71/336379171.db2.gz GKCOCLZQDNERCN-UHFFFAOYSA-N 1 2 318.511 4.181 20 0 DIADLO CSCc1cnc(C[N@H+]2CCc3c(C)cc(C)cc3C2)s1 ZINC000352954716 336379172 /nfs/dbraw/zinc/37/91/72/336379172.db2.gz GKCOCLZQDNERCN-UHFFFAOYSA-N 1 2 318.511 4.181 20 0 DIADLO Fc1cccc(F)c1C[N@H+](Cc1ccc2[nH]cnc2c1)C1CC1 ZINC000514643394 336389773 /nfs/dbraw/zinc/38/97/73/336389773.db2.gz NKMZPZWJWMMZPV-UHFFFAOYSA-N 1 2 313.351 4.006 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](Cc1ccc2[nH]cnc2c1)C1CC1 ZINC000514643394 336389774 /nfs/dbraw/zinc/38/97/74/336389774.db2.gz NKMZPZWJWMMZPV-UHFFFAOYSA-N 1 2 313.351 4.006 20 0 DIADLO Fc1cccc(F)c1C[N@H+](Cc1ccc2nc[nH]c2c1)C1CC1 ZINC000514643394 336389775 /nfs/dbraw/zinc/38/97/75/336389775.db2.gz NKMZPZWJWMMZPV-UHFFFAOYSA-N 1 2 313.351 4.006 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](Cc1ccc2nc[nH]c2c1)C1CC1 ZINC000514643394 336389776 /nfs/dbraw/zinc/38/97/76/336389776.db2.gz NKMZPZWJWMMZPV-UHFFFAOYSA-N 1 2 313.351 4.006 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2cccc(Cl)c2Cl)c(C)[nH+]1 ZINC000193068513 336392817 /nfs/dbraw/zinc/39/28/17/336392817.db2.gz BVWDCEOSKBNBET-UHFFFAOYSA-N 1 2 323.223 4.495 20 0 DIADLO CCn1c[nH+]cc1CNc1cnn(-c2ccc(C)cc2)c1C(C)C ZINC000418031462 336393369 /nfs/dbraw/zinc/39/33/69/336393369.db2.gz LHEOKGARMMTUHL-UHFFFAOYSA-N 1 2 323.444 4.133 20 0 DIADLO CCCCCOc1cc(CNc2cccc[nH+]2)ccc1OC ZINC000019778029 336395052 /nfs/dbraw/zinc/39/50/52/336395052.db2.gz OPRVTZLQASOZDC-UHFFFAOYSA-N 1 2 300.402 4.271 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H](C)c2cc(C)on2)ccc1OC(C)C ZINC000353410312 336416075 /nfs/dbraw/zinc/41/60/75/336416075.db2.gz HBVOLMYNOMSSQM-KBPBESRZSA-N 1 2 318.417 4.191 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+][C@H](C)c2nc(-c3ccncc3)cs2)c1 ZINC000353617057 336429078 /nfs/dbraw/zinc/42/90/78/336429078.db2.gz CPSLPKDNHWSOND-ZIAGYGMSSA-N 1 2 324.453 4.320 20 0 DIADLO Cc1ccc(CCC(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)s1 ZINC000353764382 336439494 /nfs/dbraw/zinc/43/94/94/336439494.db2.gz XVRJPWBVOJZBMK-UHFFFAOYSA-N 1 2 311.410 4.018 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cnn(C2CCCC2)c1 ZINC000353927901 336449141 /nfs/dbraw/zinc/44/91/41/336449141.db2.gz WYFKWAZMBYNEHG-NEPJUHHUSA-N 1 2 320.387 4.083 20 0 DIADLO Cc1ccc(CCCNc2ccc3oc(C4CC4)nc3c2)c[nH+]1 ZINC000354194037 336462972 /nfs/dbraw/zinc/46/29/72/336462972.db2.gz WUTGLCMCPBBQKZ-UHFFFAOYSA-N 1 2 307.397 4.453 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2nc(C(C)C)oc2C)[nH+]1 ZINC000354371636 336468624 /nfs/dbraw/zinc/46/86/24/336468624.db2.gz OKWMNWZTFKRYEC-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO COc1cccc2c1CC[C@@H]2Nc1[nH+]ccc2ccc(F)cc21 ZINC000354874913 336485879 /nfs/dbraw/zinc/48/58/79/336485879.db2.gz IEHIXSUAWNDJHO-KRWDZBQOSA-N 1 2 308.356 4.482 20 0 DIADLO CCN(CCC1CC1)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000354879310 336486149 /nfs/dbraw/zinc/48/61/49/336486149.db2.gz IHCNTFSWUUHGRO-UHFFFAOYSA-N 1 2 310.397 4.136 20 0 DIADLO c1cn(-c2ccc(NCc3ccccc3OCC3CC3)cc2)c[nH+]1 ZINC000355329820 336504360 /nfs/dbraw/zinc/50/43/60/336504360.db2.gz CPTLIGQNCABFAI-UHFFFAOYSA-N 1 2 319.408 4.273 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]Cc2ccc(Cl)c(C)c2)cs1 ZINC000355672043 336518725 /nfs/dbraw/zinc/51/87/25/336518725.db2.gz MMICIFVAEGUBCS-LLVKDONJSA-N 1 2 310.850 4.102 20 0 DIADLO CC(C)c1cc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)on1 ZINC000355897804 336527249 /nfs/dbraw/zinc/52/72/49/336527249.db2.gz OAGNYODWCXBVPH-UHFFFAOYSA-N 1 2 323.352 4.238 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2ncc(C)o2)cc1OCC ZINC000356268544 336543300 /nfs/dbraw/zinc/54/33/00/336543300.db2.gz MRYBFKWNHADKMH-UONOGXRCSA-N 1 2 318.417 4.192 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2ccc(-c3cccc(F)c3)s2)n1 ZINC000356900816 336565521 /nfs/dbraw/zinc/56/55/21/336565521.db2.gz ZLPDYEZXIUABQA-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO COCc1cc(N2C[C@H](C)C[C@H](C)C2)c2cc(F)ccc2[nH+]1 ZINC000357093062 336573468 /nfs/dbraw/zinc/57/34/68/336573468.db2.gz VUNSDTYOQVCXTR-BETUJISGSA-N 1 2 302.393 4.003 20 0 DIADLO CC[C@H](C)N(C)C(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000357771711 336597617 /nfs/dbraw/zinc/59/76/17/336597617.db2.gz MAZZICIJKBXMPF-LBPRGKRZSA-N 1 2 318.804 4.398 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C(C)C)s1)c1cc(C)ccc1OC ZINC000357780214 336597958 /nfs/dbraw/zinc/59/79/58/336597958.db2.gz VFCMDNJHCDGREI-AWEZNQCLSA-N 1 2 319.474 4.219 20 0 DIADLO Fc1cccc(F)c1CN(c1cc[nH+]c2ccncc21)C1CC1 ZINC000357892656 336602704 /nfs/dbraw/zinc/60/27/04/336602704.db2.gz DHJBEOXIWKPZQI-UHFFFAOYSA-N 1 2 311.335 4.077 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H]2CCCOc3ccc(F)cc32)cs1 ZINC000358027132 336607319 /nfs/dbraw/zinc/60/73/19/336607319.db2.gz VYMIHJKCBWESNB-HZMBPMFUSA-N 1 2 306.406 4.155 20 0 DIADLO c1c[nH+]c([C@H](Nc2cccc3ccsc32)c2cccnc2)[nH]1 ZINC000358991546 336651674 /nfs/dbraw/zinc/65/16/74/336651674.db2.gz PYCIVBWERYOHAD-OAHLLOKOSA-N 1 2 306.394 4.221 20 0 DIADLO c1coc(C[NH2+]Cc2nc(-c3cc4ccccc4o3)cs2)c1 ZINC000358992693 336651766 /nfs/dbraw/zinc/65/17/66/336651766.db2.gz PHZZABNKLPGAER-UHFFFAOYSA-N 1 2 310.378 4.439 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCc1ccc(CO)cc1 ZINC000359056766 336655564 /nfs/dbraw/zinc/65/55/64/336655564.db2.gz QKOWRDGAICYFOB-UHFFFAOYSA-N 1 2 324.449 4.106 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)c1nc(C2CC2)no1 ZINC000359633827 336681070 /nfs/dbraw/zinc/68/10/70/336681070.db2.gz LMLQFDNNEYUGLA-HZMBPMFUSA-N 1 2 320.824 4.043 20 0 DIADLO CCc1c[nH+]ccc1[C@H](C)[C@H]1CCC(=O)Nc2ccc(F)cc21 ZINC000360616427 336716220 /nfs/dbraw/zinc/71/62/20/336716220.db2.gz UPRFHMJGWJCADT-BLLLJJGKSA-N 1 2 312.388 4.403 20 0 DIADLO CC[C@@H]([NH2+][C@@H]1CCOc2c(F)ccc(F)c21)c1ccc(F)cn1 ZINC000361181405 336742759 /nfs/dbraw/zinc/74/27/59/336742759.db2.gz MAHIWZXGINVSHR-UKRRQHHQSA-N 1 2 322.330 4.063 20 0 DIADLO CC[C@@H]1C[C@@H](CNc2ccc(-n3c[nH+]c(C)c3C)cc2)CCO1 ZINC000361252157 336747030 /nfs/dbraw/zinc/74/70/30/336747030.db2.gz PXYLSDZGVYCPHC-QFBILLFUSA-N 1 2 313.445 4.106 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H]2CCCOc3c(Cl)cccc32)no1 ZINC000367381719 336763924 /nfs/dbraw/zinc/76/39/24/336763924.db2.gz LSSQODVVFYCUIN-SMDDNHRTSA-N 1 2 306.793 4.201 20 0 DIADLO CCOCc1csc([C@@H](C)n2c[nH+]c3cc(C)c(C)cc32)n1 ZINC000362928175 336815114 /nfs/dbraw/zinc/81/51/14/336815114.db2.gz PLVCYTSNQDWBLL-CYBMUJFWSA-N 1 2 315.442 4.255 20 0 DIADLO Cc1ccc(C(=O)N2C[C@H](C)C[C@H](C)C2)cc1Oc1cc[nH+]cc1 ZINC000115315119 336823866 /nfs/dbraw/zinc/82/38/66/336823866.db2.gz CBZOPINIZLBOLY-GASCZTMLSA-N 1 2 324.424 4.300 20 0 DIADLO Cc1ccc(C(=O)N2CCCC(C)(C)C2)cc1Oc1cc[nH+]cc1 ZINC000115382845 336824119 /nfs/dbraw/zinc/82/41/19/336824119.db2.gz RDWXEULTNXUZHG-UHFFFAOYSA-N 1 2 324.424 4.445 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@H](C)c2nccn2-c2ccccc2)n1 ZINC000367855491 336831037 /nfs/dbraw/zinc/83/10/37/336831037.db2.gz HVZGBSOHTZUUOP-KGLIPLIRSA-N 1 2 312.442 4.049 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2ccc(Cl)cn2)c2ccccn2)cc1 ZINC000369303305 336862164 /nfs/dbraw/zinc/86/21/64/336862164.db2.gz OMNWZSLXYHHSJQ-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO CCN(Cc1cccc(Cl)c1)C(=O)Nc1cc[nH+]c(C)c1 ZINC000119272158 336883870 /nfs/dbraw/zinc/88/38/70/336883870.db2.gz XWZSIEXSOUICFV-UHFFFAOYSA-N 1 2 303.793 4.097 20 0 DIADLO Cc1nc([C@@H](C)[NH+]2CCC(c3c(C)[nH]c4ccccc43)CC2)no1 ZINC000370597622 336888307 /nfs/dbraw/zinc/88/83/07/336888307.db2.gz OGVUMQOODRUNJT-CYBMUJFWSA-N 1 2 324.428 4.108 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)CCc2cccc(C)c2)[nH+]1 ZINC000370741551 336892533 /nfs/dbraw/zinc/89/25/33/336892533.db2.gz MOAGPWGQWBIPMF-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO CCc1cc(C(=O)Nc2ccccc2-c2[nH]cc(C)[nH+]2)oc1CC ZINC000371246737 336898369 /nfs/dbraw/zinc/89/83/69/336898369.db2.gz GSRHCMHNGCFXSD-UHFFFAOYSA-N 1 2 323.396 4.355 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc(F)c(C)c2)[nH+]1 ZINC000371247828 336898506 /nfs/dbraw/zinc/89/85/06/336898506.db2.gz QXDNQGNTOHXQDA-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)NCc1ccc(Cl)cc1Cl ZINC000120776622 336920973 /nfs/dbraw/zinc/92/09/73/336920973.db2.gz XYNIONOODAVIKI-UHFFFAOYSA-N 1 2 310.184 4.019 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000373056611 336946681 /nfs/dbraw/zinc/94/66/81/336946681.db2.gz KUWNUXURWJJKKY-IAGOWNOFSA-N 1 2 319.493 4.123 20 0 DIADLO Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNc1cccc[nH+]1 ZINC000121578001 336964228 /nfs/dbraw/zinc/96/42/28/336964228.db2.gz SQVYOLKTDMMFCB-UHFFFAOYSA-N 1 2 312.804 4.150 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)CC1CCCCCC1 ZINC000373750223 336971884 /nfs/dbraw/zinc/97/18/84/336971884.db2.gz FGQNILJWNAETMR-KRWDZBQOSA-N 1 2 317.477 4.317 20 0 DIADLO Cc1nn(C(C)C)cc1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000374277681 336985603 /nfs/dbraw/zinc/98/56/03/336985603.db2.gz NAHKRURJQWEIMS-LJQANCHMSA-N 1 2 309.413 4.245 20 0 DIADLO CC[C@H]([NH2+]Cc1cscc1Br)c1nccs1 ZINC000304532522 336996968 /nfs/dbraw/zinc/99/69/68/336996968.db2.gz HCCZXNOHIUHTSV-JTQLQIEISA-N 1 2 317.277 4.208 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2nc(Cl)ccc2Cl)n1 ZINC000375127729 337004054 /nfs/dbraw/zinc/00/40/54/337004054.db2.gz RQNNXQYRSKYWTI-HNNXBMFYSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2nc(Cl)ccc2Cl)n1 ZINC000375127729 337004055 /nfs/dbraw/zinc/00/40/55/337004055.db2.gz RQNNXQYRSKYWTI-HNNXBMFYSA-N 1 2 322.239 4.429 20 0 DIADLO Clc1scc(CN2CCC(n3cc[nH+]c3)CC2)c1Cl ZINC000375416903 337010775 /nfs/dbraw/zinc/01/07/75/337010775.db2.gz SCMORMYGSPRNFG-UHFFFAOYSA-N 1 2 316.257 4.089 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccccn2)c1 ZINC000375783400 337019561 /nfs/dbraw/zinc/01/95/61/337019561.db2.gz RKVUQELXXACDEE-OXQOHEQNSA-N 1 2 303.409 4.225 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nccn1-c1ccccc1)c1ccccc1F ZINC000376506122 337035325 /nfs/dbraw/zinc/03/53/25/337035325.db2.gz JLWNIWILIVVYCA-CABCVRRESA-N 1 2 309.388 4.423 20 0 DIADLO Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1c(C)cc[nH+]c1C ZINC000376598907 337037631 /nfs/dbraw/zinc/03/76/31/337037631.db2.gz VOPNJYLZODIRGO-KRWDZBQOSA-N 1 2 309.413 4.376 20 0 DIADLO Cc1ccc(-c2ncco2)cc1NC(=O)Nc1c(C)cc[nH+]c1C ZINC000376601014 337037744 /nfs/dbraw/zinc/03/77/44/337037744.db2.gz BLBQHYJSOTUUJT-UHFFFAOYSA-N 1 2 322.368 4.306 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000376607387 337037877 /nfs/dbraw/zinc/03/78/77/337037877.db2.gz XAUUERRHDSGLHN-DOJUMQAQSA-N 1 2 321.424 4.408 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1cc2ccccc2[nH]1 ZINC000377391945 337051735 /nfs/dbraw/zinc/05/17/35/337051735.db2.gz NTIOVVKXQNEKJA-SFHVURJKSA-N 1 2 308.429 4.112 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC000377391945 337051736 /nfs/dbraw/zinc/05/17/36/337051736.db2.gz NTIOVVKXQNEKJA-SFHVURJKSA-N 1 2 308.429 4.112 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2CCCc3sccc32)c(C)[nH+]1 ZINC000378194377 337068126 /nfs/dbraw/zinc/06/81/26/337068126.db2.gz JBSUFHSQXFZSNB-CQSZACIVSA-N 1 2 300.427 4.127 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1nccs1 ZINC000378471956 337073684 /nfs/dbraw/zinc/07/36/84/337073684.db2.gz KKCQNLDDLLEAOV-CYBMUJFWSA-N 1 2 322.437 4.231 20 0 DIADLO C[C@@H](NC(=O)c1cccc(Oc2cc[nH+]cc2)c1)c1cccs1 ZINC000172000699 337090788 /nfs/dbraw/zinc/09/07/88/337090788.db2.gz YVEVLMBPFXPPPR-CYBMUJFWSA-N 1 2 324.405 4.426 20 0 DIADLO CC(C)c1cnc(SCCCc2[nH]c3ccccc3[nH+]2)n1C ZINC000582669331 337118756 /nfs/dbraw/zinc/11/87/56/337118756.db2.gz JXPKULYDAMOCJQ-UHFFFAOYSA-N 1 2 314.458 4.145 20 0 DIADLO Cc1ccc([C@@H]2CCCCN2C(=O)c2ccc3[nH+]ccn3c2)cc1 ZINC000172665143 337129440 /nfs/dbraw/zinc/12/94/40/337129440.db2.gz WUQNOKPKVLBZBW-SFHVURJKSA-N 1 2 319.408 4.010 20 0 DIADLO CS[C@@H](C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000172532704 337129961 /nfs/dbraw/zinc/12/99/61/337129961.db2.gz NAZGVZYTMZLISZ-MRXNPFEDSA-N 1 2 323.421 4.120 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2cn3ccsc3n2)o1 ZINC000172868859 337131660 /nfs/dbraw/zinc/13/16/60/337131660.db2.gz XQBDBOSEHSOQAB-CQSZACIVSA-N 1 2 301.415 4.024 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2cn3ccsc3n2)o1 ZINC000172868859 337131661 /nfs/dbraw/zinc/13/16/61/337131661.db2.gz XQBDBOSEHSOQAB-CQSZACIVSA-N 1 2 301.415 4.024 20 0 DIADLO Cc1cc2cc(C(=O)N3CCCC[C@@H]3c3[nH]cc[nH+]3)oc2cc1C ZINC000172930849 337132500 /nfs/dbraw/zinc/13/25/00/337132500.db2.gz RQCYYLBBBUHGJF-OAHLLOKOSA-N 1 2 323.396 4.140 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2nccn2C(C)C)o1 ZINC000173996930 337140311 /nfs/dbraw/zinc/14/03/11/337140311.db2.gz JZOVRFXDWRHXGK-GDBMZVCRSA-N 1 2 301.434 4.339 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2nccn2C(C)C)o1 ZINC000173996930 337140312 /nfs/dbraw/zinc/14/03/12/337140312.db2.gz JZOVRFXDWRHXGK-GDBMZVCRSA-N 1 2 301.434 4.339 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2nccn2C(C)C)o1 ZINC000173996946 337140362 /nfs/dbraw/zinc/14/03/62/337140362.db2.gz JZOVRFXDWRHXGK-HOCLYGCPSA-N 1 2 301.434 4.339 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2nccn2C(C)C)o1 ZINC000173996946 337140363 /nfs/dbraw/zinc/14/03/63/337140363.db2.gz JZOVRFXDWRHXGK-HOCLYGCPSA-N 1 2 301.434 4.339 20 0 DIADLO Cc1[nH+]cccc1Cc1noc(C[C@H]2CCCc3ccccc32)n1 ZINC000582776359 337146822 /nfs/dbraw/zinc/14/68/22/337146822.db2.gz ULQHHLHGNQFUNH-QGZVFWFLSA-N 1 2 319.408 4.026 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCCC[C@H]2c2ncc[nH]2)cc1 ZINC000177040923 337152936 /nfs/dbraw/zinc/15/29/36/337152936.db2.gz YCMBFUWJBZVWNW-AWEZNQCLSA-N 1 2 309.335 4.156 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCCC[C@H]2c2ncc[nH]2)cc1 ZINC000177040923 337152937 /nfs/dbraw/zinc/15/29/37/337152937.db2.gz YCMBFUWJBZVWNW-AWEZNQCLSA-N 1 2 309.335 4.156 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@H](C)[C@H]2C)cc1Oc1cc[nH+]cc1 ZINC000177040087 337152946 /nfs/dbraw/zinc/15/29/46/337152946.db2.gz IAEOOFPXKBSYHC-DZGCQCFKSA-N 1 2 310.397 4.053 20 0 DIADLO C[C@H]1CC(CC[S@@](=O)Cc2cn3ccccc3[nH+]2)C[C@@H](C)C1 ZINC000176987087 337153954 /nfs/dbraw/zinc/15/39/54/337153954.db2.gz NKKIEWNQFSIPQC-FHFHRFLYSA-N 1 2 318.486 4.045 20 0 DIADLO Cc1cccc(C[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)n1 ZINC000178417062 337164638 /nfs/dbraw/zinc/16/46/38/337164638.db2.gz HZBBQBPJCFSDKF-AWEZNQCLSA-N 1 2 309.438 4.364 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2cnc(C3CCCC3)s2)s1 ZINC000179381529 337167670 /nfs/dbraw/zinc/16/76/70/337167670.db2.gz SYCMNXCSZUVJDL-UHFFFAOYSA-N 1 2 307.488 4.198 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2cnc(C3CCCC3)s2)s1 ZINC000179381529 337167671 /nfs/dbraw/zinc/16/76/71/337167671.db2.gz SYCMNXCSZUVJDL-UHFFFAOYSA-N 1 2 307.488 4.198 20 0 DIADLO Cc1ccc(NC(=O)N[C@H]2CCCc3cc(F)ccc32)c(C)[nH+]1 ZINC000179838887 337172224 /nfs/dbraw/zinc/17/22/24/337172224.db2.gz KXKJYKACMGYYGW-KRWDZBQOSA-N 1 2 313.376 4.037 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1cccn1C1CCCC1 ZINC000180687531 337177268 /nfs/dbraw/zinc/17/72/68/337177268.db2.gz RPQAQCIYOBDRBF-UHFFFAOYSA-N 1 2 320.396 4.041 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)s1 ZINC000180980136 337179087 /nfs/dbraw/zinc/17/90/87/337179087.db2.gz NOEANWCIHXYGKX-UHFFFAOYSA-N 1 2 314.410 4.381 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2nnc(C3CCC3)n2C)cc1 ZINC000181376260 337181747 /nfs/dbraw/zinc/18/17/47/337181747.db2.gz LTAZMVYGUHVCMD-GOSISDBHSA-N 1 2 324.472 4.118 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2nnc(C3CCC3)n2C)cc1 ZINC000181376260 337181748 /nfs/dbraw/zinc/18/17/48/337181748.db2.gz LTAZMVYGUHVCMD-GOSISDBHSA-N 1 2 324.472 4.118 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(-c2cccc(F)c2)o1)c1cccc(O)c1 ZINC000181491515 337182557 /nfs/dbraw/zinc/18/25/57/337182557.db2.gz XAHNECHWIKXOBI-GFCCVEGCSA-N 1 2 312.344 4.037 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(-c2ccccc2)o1)c1cc2ccccc2o1 ZINC000181778453 337184677 /nfs/dbraw/zinc/18/46/77/337184677.db2.gz YDWLMIVTKMPFIQ-ZDUSSCGKSA-N 1 2 319.364 4.334 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(-c2cccc(Cl)c2)o1)c1ccccn1 ZINC000181900404 337185138 /nfs/dbraw/zinc/18/51/38/337185138.db2.gz QQMQOOHSQPBWKT-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1nnc(-c2ccco2)o1 ZINC000183557010 337192084 /nfs/dbraw/zinc/19/20/84/337192084.db2.gz GGHGTRVLVRHSBK-LBPRGKRZSA-N 1 2 323.352 4.235 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+](C)Cc2ccccc2F)s1 ZINC000183562381 337192271 /nfs/dbraw/zinc/19/22/71/337192271.db2.gz BRMWESNRUPIUCP-UHFFFAOYSA-N 1 2 318.339 4.241 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+](C)Cc2ccccc2F)s1 ZINC000183562381 337192272 /nfs/dbraw/zinc/19/22/72/337192272.db2.gz BRMWESNRUPIUCP-UHFFFAOYSA-N 1 2 318.339 4.241 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](c2nccs2)c2ccccc2)c(C)n1 ZINC000184442117 337197350 /nfs/dbraw/zinc/19/73/50/337197350.db2.gz SRMXQDZYCIEOJJ-QGZVFWFLSA-N 1 2 309.438 4.034 20 0 DIADLO Cc1ccc(SC[C@H](C)NC(=O)Nc2cc[nH+]cc2C)cc1 ZINC000184581582 337198631 /nfs/dbraw/zinc/19/86/31/337198631.db2.gz RIGDEGPTWQKMHT-AWEZNQCLSA-N 1 2 315.442 4.001 20 0 DIADLO Cc1ccc(CSCc2cc(-c3ccco3)on2)c(C)[nH+]1 ZINC000184821113 337200437 /nfs/dbraw/zinc/20/04/37/337200437.db2.gz YBYFJWYTODCUTJ-UHFFFAOYSA-N 1 2 300.383 4.380 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(Cl)n1)c1ncc(-c2ccccc2)o1 ZINC000184888270 337200685 /nfs/dbraw/zinc/20/06/85/337200685.db2.gz MIERHVRYZWGCCU-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1cnn(-c2ccc(NCCCc3c[nH+]ccc3C)cc2F)c1 ZINC000582872074 337209377 /nfs/dbraw/zinc/20/93/77/337209377.db2.gz SZYCNTOEJAZAPA-UHFFFAOYSA-N 1 2 324.403 4.068 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+][C@H]2CCCSC2)C(F)F)c1 ZINC000582855987 337211256 /nfs/dbraw/zinc/21/12/56/337211256.db2.gz HUTNXMATEMTTNA-ZFWWWQNUSA-N 1 2 315.429 4.265 20 0 DIADLO C[C@@H](CSCCc1[nH+]c2ccccc2n1C)C(F)(F)F ZINC000582927460 337215711 /nfs/dbraw/zinc/21/57/11/337215711.db2.gz HYYDVCFEJMYBEH-JTQLQIEISA-N 1 2 302.365 4.047 20 0 DIADLO Cc1csc(-c2nc(CCc3[nH+]cccc3C)no2)c1Cl ZINC000582946948 337221012 /nfs/dbraw/zinc/22/10/12/337221012.db2.gz ZOMDEGLYTXUULB-UHFFFAOYSA-N 1 2 319.817 4.249 20 0 DIADLO CC1(C)C[N@H+](C/C=C/c2ccc(F)cc2F)[C@@H]1c1ccncc1 ZINC000582980439 337222487 /nfs/dbraw/zinc/22/24/87/337222487.db2.gz IFKVTLNMBAWJSF-OAJJDEHYSA-N 1 2 314.379 4.456 20 0 DIADLO CC1(C)C[N@@H+](C/C=C/c2ccc(F)cc2F)[C@@H]1c1ccncc1 ZINC000582980439 337222488 /nfs/dbraw/zinc/22/24/88/337222488.db2.gz IFKVTLNMBAWJSF-OAJJDEHYSA-N 1 2 314.379 4.456 20 0 DIADLO CC1(C)C[N@H+](C/C=C/c2ccc(F)cc2F)[C@H]1c1ccncc1 ZINC000582980440 337222551 /nfs/dbraw/zinc/22/25/51/337222551.db2.gz IFKVTLNMBAWJSF-WHLIDYPQSA-N 1 2 314.379 4.456 20 0 DIADLO CC1(C)C[N@@H+](C/C=C/c2ccc(F)cc2F)[C@H]1c1ccncc1 ZINC000582980440 337222552 /nfs/dbraw/zinc/22/25/52/337222552.db2.gz IFKVTLNMBAWJSF-WHLIDYPQSA-N 1 2 314.379 4.456 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2cc(O)cc(F)c2)c2ccccn2)c1 ZINC000185614582 337249678 /nfs/dbraw/zinc/24/96/78/337249678.db2.gz HILHSIRIKHYDCB-HXUWFJFHSA-N 1 2 322.383 4.114 20 0 DIADLO Cc1cc(C)cc(CCC(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)c1 ZINC000532904566 337255078 /nfs/dbraw/zinc/25/50/78/337255078.db2.gz JRSPWGXJMGRPNW-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2nc(Cc3ccccc3)no2)cc1 ZINC000532904430 337255122 /nfs/dbraw/zinc/25/51/22/337255122.db2.gz ZXHLWPCVQAOWBK-INIZCTEOSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2nc(Cc3ccccc3)no2)cc1 ZINC000532904430 337255123 /nfs/dbraw/zinc/25/51/23/337255123.db2.gz ZXHLWPCVQAOWBK-INIZCTEOSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2nc(Cc3ccccc3)no2)cc1 ZINC000532904431 337255130 /nfs/dbraw/zinc/25/51/30/337255130.db2.gz ZXHLWPCVQAOWBK-MRXNPFEDSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)c2nc(Cc3ccccc3)no2)cc1 ZINC000532904431 337255131 /nfs/dbraw/zinc/25/51/31/337255131.db2.gz ZXHLWPCVQAOWBK-MRXNPFEDSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)c2cn(C)c3ccccc23)c(C)[nH+]1 ZINC000186653146 337258269 /nfs/dbraw/zinc/25/82/69/337258269.db2.gz GKPVBUQWPWFCBT-CQSZACIVSA-N 1 2 321.424 4.241 20 0 DIADLO Cc1cc(C)cc(C[N@@H+]2CCSC[C@@H]2c2nccs2)c1 ZINC000186661717 337258324 /nfs/dbraw/zinc/25/83/24/337258324.db2.gz DRRZQNRPANEDJJ-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1cc(C)cc(C[N@H+]2CCSC[C@@H]2c2nccs2)c1 ZINC000186661717 337258325 /nfs/dbraw/zinc/25/83/25/337258325.db2.gz DRRZQNRPANEDJJ-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1ccc(C[S@](=O)[C@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000187069746 337261623 /nfs/dbraw/zinc/26/16/23/337261623.db2.gz INRYRLQUDBBNTA-XCLFUZPHSA-N 1 2 307.846 4.362 20 0 DIADLO Cc1ccc(C[S@@](=O)[C@@H](C)c2cccc(Cl)c2)c(C)[nH+]1 ZINC000187171561 337263502 /nfs/dbraw/zinc/26/35/02/337263502.db2.gz VPYCFMBTOLZZSN-RNODOKPDSA-N 1 2 307.846 4.362 20 0 DIADLO Cc1ccc(C[S@](=O)[C@@H](C)c2cccc(Cl)c2)c(C)[nH+]1 ZINC000187171575 337263535 /nfs/dbraw/zinc/26/35/35/337263535.db2.gz VPYCFMBTOLZZSN-RBZFPXEDSA-N 1 2 307.846 4.362 20 0 DIADLO Oc1cccc(CNc2ccc(N3CCCCC3)[nH+]c2)c1Cl ZINC000393385257 337263659 /nfs/dbraw/zinc/26/36/59/337263659.db2.gz QCDCLHXPYNUCSQ-UHFFFAOYSA-N 1 2 317.820 4.043 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)C1(Cc2ccccc2Cl)CC1 ZINC000187652593 337267790 /nfs/dbraw/zinc/26/77/90/337267790.db2.gz AEBHDLHQECPRGB-UHFFFAOYSA-N 1 2 300.789 4.005 20 0 DIADLO Cc1ccc(CNc2cc(Cl)ccc2-n2cccn2)c(C)[nH+]1 ZINC000187721258 337269537 /nfs/dbraw/zinc/26/95/37/337269537.db2.gz LHHMQCFXTUDTND-UHFFFAOYSA-N 1 2 312.804 4.150 20 0 DIADLO COc1ccc(Br)cc1NCc1ccc(C)[nH+]c1C ZINC000187725431 337269585 /nfs/dbraw/zinc/26/95/85/337269585.db2.gz DISJIUGMSWOXPL-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO c1c[nH]c([C@@H]([NH2+]Cc2ccc(C3CC3)cc2)c2ccccc2)n1 ZINC000188720344 337274603 /nfs/dbraw/zinc/27/46/03/337274603.db2.gz XSQFWOHEDXRPLH-IBGZPJMESA-N 1 2 303.409 4.166 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2ccccc2OC(F)F)cs1 ZINC000189786352 337282074 /nfs/dbraw/zinc/28/20/74/337282074.db2.gz JVLRRSDOSWXLAY-CQSZACIVSA-N 1 2 324.396 4.390 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2ccccc2OC(F)F)cs1 ZINC000189786352 337282075 /nfs/dbraw/zinc/28/20/75/337282075.db2.gz JVLRRSDOSWXLAY-CQSZACIVSA-N 1 2 324.396 4.390 20 0 DIADLO Cc1cc(NC(=O)N2CCc3c(cccc3C(C)C)C2)cc[nH+]1 ZINC000189824599 337283230 /nfs/dbraw/zinc/28/32/30/337283230.db2.gz MFPNKMZZYPQCIQ-UHFFFAOYSA-N 1 2 309.413 4.104 20 0 DIADLO CCN(C)c1ccc(CNc2ccc(-c3cnc(C)o3)cc2)c[nH+]1 ZINC000191379699 337296396 /nfs/dbraw/zinc/29/63/96/337296396.db2.gz SGRDZIUUEFNRFO-UHFFFAOYSA-N 1 2 322.412 4.113 20 0 DIADLO FC(F)(F)CC[N@H+](Cc1nccs1)Cc1ccccc1 ZINC000191781765 337300143 /nfs/dbraw/zinc/30/01/43/337300143.db2.gz PGVRNDAZKCFULS-UHFFFAOYSA-N 1 2 300.349 4.098 20 0 DIADLO FC(F)(F)CC[N@@H+](Cc1nccs1)Cc1ccccc1 ZINC000191781765 337300144 /nfs/dbraw/zinc/30/01/44/337300144.db2.gz PGVRNDAZKCFULS-UHFFFAOYSA-N 1 2 300.349 4.098 20 0 DIADLO CCCc1[nH+]c2ccccc2n1CCC(=O)N(C)C(C)(C)CC ZINC000525947793 337301007 /nfs/dbraw/zinc/30/10/07/337301007.db2.gz MELOCEJZTKGZRV-UHFFFAOYSA-N 1 2 315.461 4.026 20 0 DIADLO C[C@H]([NH2+]Cc1ncccn1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000192151869 337303265 /nfs/dbraw/zinc/30/32/65/337303265.db2.gz MASFZEUBZULSMH-AWEZNQCLSA-N 1 2 323.371 4.259 20 0 DIADLO Fc1ccc(-c2nc(CNc3cc[nH+]cc3F)cs2)cc1 ZINC000192150197 337303363 /nfs/dbraw/zinc/30/33/63/337303363.db2.gz RYYQNNLQVZKGSM-UHFFFAOYSA-N 1 2 303.337 4.095 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1noc(-c2ccsc2)n1 ZINC000192667101 337306017 /nfs/dbraw/zinc/30/60/17/337306017.db2.gz YFHWVMFGEXQXTL-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1noc(-c2ccsc2)n1 ZINC000192667101 337306018 /nfs/dbraw/zinc/30/60/18/337306018.db2.gz YFHWVMFGEXQXTL-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO COc1c(C)cnc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)c1C ZINC000086235950 337309835 /nfs/dbraw/zinc/30/98/35/337309835.db2.gz UFZREQYPPIRYPL-AWEZNQCLSA-N 1 2 300.402 4.026 20 0 DIADLO COc1c(C)cnc(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)c1C ZINC000086235950 337309836 /nfs/dbraw/zinc/30/98/36/337309836.db2.gz UFZREQYPPIRYPL-AWEZNQCLSA-N 1 2 300.402 4.026 20 0 DIADLO CC(C)=CCC[C@H](C)CC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000584412375 337321474 /nfs/dbraw/zinc/32/14/74/337321474.db2.gz KRAMIBHEKBDBOY-HOTGVXAUSA-N 1 2 303.450 4.236 20 0 DIADLO C[C@H]1c2cc(F)cc(F)c2CC[N@H+]1Cc1c[nH]nc1C(C)(C)C ZINC000583803445 337335155 /nfs/dbraw/zinc/33/51/55/337335155.db2.gz WDOHKPSZBWOJLZ-NSHDSACASA-N 1 2 319.399 4.105 20 0 DIADLO C[C@H]1c2cc(F)cc(F)c2CC[N@@H+]1Cc1c[nH]nc1C(C)(C)C ZINC000583803445 337335156 /nfs/dbraw/zinc/33/51/56/337335156.db2.gz WDOHKPSZBWOJLZ-NSHDSACASA-N 1 2 319.399 4.105 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+]CCc2cccnc2)C(F)F)c1 ZINC000584508169 337352422 /nfs/dbraw/zinc/35/24/22/337352422.db2.gz GTSQQBDYLRCNCJ-KRWDZBQOSA-N 1 2 320.383 4.007 20 0 DIADLO CC(C)c1nc(N[C@@H](c2ccccc2)c2ccccn2)cc[nH+]1 ZINC000106462637 337387152 /nfs/dbraw/zinc/38/71/52/337387152.db2.gz KSCWUIJKSQQKPI-SFHVURJKSA-N 1 2 304.397 4.197 20 0 DIADLO Fc1ccc(C[NH2+]Cc2cscc2Br)c(F)c1 ZINC000310093326 337388394 /nfs/dbraw/zinc/38/83/94/337388394.db2.gz GIUIYFFVYXIZQS-UHFFFAOYSA-N 1 2 318.186 4.079 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCc3ccc(OC)cc3C2)cs1 ZINC000520782268 337390420 /nfs/dbraw/zinc/39/04/20/337390420.db2.gz WPFBCFZRBMFGCX-UHFFFAOYSA-N 1 2 316.470 4.053 20 0 DIADLO CCCCc1nc(C[N@H+]2CCc3ccc(OC)cc3C2)cs1 ZINC000520782268 337390421 /nfs/dbraw/zinc/39/04/21/337390421.db2.gz WPFBCFZRBMFGCX-UHFFFAOYSA-N 1 2 316.470 4.053 20 0 DIADLO CC(C)[N@H+](CC(=O)Nc1cccc2ccccc21)Cc1ccco1 ZINC000532926187 337393060 /nfs/dbraw/zinc/39/30/60/337393060.db2.gz YIHCPEFUHOZLQQ-UHFFFAOYSA-N 1 2 322.408 4.282 20 0 DIADLO CC(C)[N@@H+](CC(=O)Nc1cccc2ccccc21)Cc1ccco1 ZINC000532926187 337393061 /nfs/dbraw/zinc/39/30/61/337393061.db2.gz YIHCPEFUHOZLQQ-UHFFFAOYSA-N 1 2 322.408 4.282 20 0 DIADLO c1csc([C@H]2c3ccsc3CC[N@H+]2Cc2cncs2)c1 ZINC000121130444 337396252 /nfs/dbraw/zinc/39/62/52/337396252.db2.gz SJBYQXLJVCYFFV-OAHLLOKOSA-N 1 2 318.492 4.414 20 0 DIADLO c1csc([C@H]2c3ccsc3CC[N@@H+]2Cc2cncs2)c1 ZINC000121130444 337396253 /nfs/dbraw/zinc/39/62/53/337396253.db2.gz SJBYQXLJVCYFFV-OAHLLOKOSA-N 1 2 318.492 4.414 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](CC)c2cccc(Cl)c2)n1 ZINC000125286966 337410434 /nfs/dbraw/zinc/41/04/34/337410434.db2.gz GIWJKPSCVPUUGM-CQSZACIVSA-N 1 2 307.825 4.307 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)[C@@H]1CCCc2sccc21 ZINC000128629341 337426164 /nfs/dbraw/zinc/42/61/64/337426164.db2.gz QWGIZZNQBJXNCX-OAHLLOKOSA-N 1 2 323.421 4.197 20 0 DIADLO CCSc1cccc(N[C@H](c2[nH]cc[nH+]2)c2cccnc2)c1 ZINC000195109638 337465343 /nfs/dbraw/zinc/46/53/43/337465343.db2.gz HPHSZCUWAIWVJI-INIZCTEOSA-N 1 2 310.426 4.118 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CSCc1ccc(CO)cc1 ZINC000419452287 337484969 /nfs/dbraw/zinc/48/49/69/337484969.db2.gz GKXOXVRHMPWYJG-UHFFFAOYSA-N 1 2 301.455 4.439 20 0 DIADLO Cc1ccc(Cc2noc(Cc3cccc(C(C)C)c3)n2)c[nH+]1 ZINC000420485199 337502363 /nfs/dbraw/zinc/50/23/63/337502363.db2.gz VGMSAYZLAJIOCM-UHFFFAOYSA-N 1 2 307.397 4.078 20 0 DIADLO Cc1[nH+]cccc1Cc1noc(C[C@H](c2ccccc2)C(C)C)n1 ZINC000420508857 337505664 /nfs/dbraw/zinc/50/56/64/337505664.db2.gz AWLXCUSMRLAZCP-SFHVURJKSA-N 1 2 321.424 4.346 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@H](c2ccccc2)C(C)C)n1 ZINC000420509189 337505749 /nfs/dbraw/zinc/50/57/49/337505749.db2.gz CJJAWBDBPKISOZ-SFHVURJKSA-N 1 2 307.397 4.152 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@@H](Cc2ccccc2)C(C)C)n1 ZINC000420511332 337506077 /nfs/dbraw/zinc/50/60/77/337506077.db2.gz NNWLXGCVSLAYRG-SFHVURJKSA-N 1 2 321.424 4.346 20 0 DIADLO Cc1ccccc1[C@H](C)Cc1nc(Cc2ccc[nH+]c2C)no1 ZINC000420511847 337506125 /nfs/dbraw/zinc/50/61/25/337506125.db2.gz PYMBDNAGPPTCOQ-CQSZACIVSA-N 1 2 307.397 4.018 20 0 DIADLO CC[C@@H](Oc1ccccc1C)c1nc(Cc2ccc[nH+]c2C)no1 ZINC000420514179 337506511 /nfs/dbraw/zinc/50/65/11/337506511.db2.gz ZBSYOONJJRUFNT-MRXNPFEDSA-N 1 2 323.396 4.202 20 0 DIADLO C[C@@H]1C[C@@H]1[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(Cl)cc1 ZINC000420938577 337516926 /nfs/dbraw/zinc/51/69/26/337516926.db2.gz MISOOUQVPDURIW-AKWBHNSASA-N 1 2 324.255 4.214 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@H](C3CCCC3)C2)c(C)[nH+]1 ZINC000421109010 337521800 /nfs/dbraw/zinc/52/18/00/337521800.db2.gz FUKXWXDORBYFNP-MRXNPFEDSA-N 1 2 301.434 4.051 20 0 DIADLO CSc1cc(C)ccc1NC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000421165999 337522883 /nfs/dbraw/zinc/52/28/83/337522883.db2.gz YRKDUERNRPXURZ-UHFFFAOYSA-N 1 2 315.442 4.050 20 0 DIADLO OC[C@@H]([NH2+]Cc1csc(Cl)c1Cl)c1cccc(F)c1 ZINC000432250441 337538994 /nfs/dbraw/zinc/53/89/94/337538994.db2.gz KDJVWYOAVRJPBP-LLVKDONJSA-N 1 2 320.216 4.017 20 0 DIADLO CC[C@@H](C)[C@@H](C(=O)NCc1cc(C)[nH+]c(C)c1)c1ccccc1 ZINC000421560436 337541288 /nfs/dbraw/zinc/54/12/88/337541288.db2.gz QPNXGNASHGTMJS-AUUYWEPGSA-N 1 2 310.441 4.145 20 0 DIADLO CCn1cc[nH+]c1CN(Cc1cccs1)Cc1cccs1 ZINC000076292151 337568118 /nfs/dbraw/zinc/56/81/18/337568118.db2.gz NDGMMSPZNOSFNC-UHFFFAOYSA-N 1 2 317.483 4.228 20 0 DIADLO Cc1cc(NC(=O)Nc2ccc3oc(C(C)C)nc3c2)c(C)c[nH+]1 ZINC000572112097 337591225 /nfs/dbraw/zinc/59/12/25/337591225.db2.gz YBBSIDICLQNTSY-UHFFFAOYSA-N 1 2 324.384 4.029 20 0 DIADLO Cc1ccc(C(=O)N2[C@H](C)CC[C@H]2C)cc1Oc1cc[nH+]cc1 ZINC000162135407 337607031 /nfs/dbraw/zinc/60/70/31/337607031.db2.gz SHDDTRAKISQUDI-HUUCEWRRSA-N 1 2 310.397 4.195 20 0 DIADLO Cc1nc(CNc2cccc(-c3ccc4c(c3)CCO4)[nH+]2)cs1 ZINC000162293825 337612926 /nfs/dbraw/zinc/61/29/26/337612926.db2.gz DRAPUBWPDPLZCU-UHFFFAOYSA-N 1 2 323.421 4.061 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccc(F)cc1F ZINC000429779976 337703388 /nfs/dbraw/zinc/70/33/88/337703388.db2.gz BVZDIQANBMZEEF-SSDOTTSWSA-N 1 2 319.248 4.372 20 0 DIADLO Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]c2ccc3c(c2)CCN3)C1 ZINC000423209867 337704321 /nfs/dbraw/zinc/70/43/21/337704321.db2.gz FNHQQIXYNWIJRX-IAGOWNOFSA-N 1 2 307.441 4.496 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc3c(c2)CC[NH2+]3)c(C)c1OC ZINC000423220867 337705404 /nfs/dbraw/zinc/70/54/04/337705404.db2.gz WCCCJSOUQPQKPJ-CYBMUJFWSA-N 1 2 312.413 4.153 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ccsc1Br ZINC000527708399 337758092 /nfs/dbraw/zinc/75/80/92/337758092.db2.gz GVXMPHHHGGTPKF-TVQRCGJNSA-N 1 2 324.243 4.122 20 0 DIADLO Oc1ccc(C2CCN(c3[nH+]ccc4ccccc43)CC2)cc1 ZINC000527838819 337767718 /nfs/dbraw/zinc/76/77/18/337767718.db2.gz ZSVDAURHTRUGOP-UHFFFAOYSA-N 1 2 304.393 4.324 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1ccccc1OC(F)F ZINC000528036358 337782556 /nfs/dbraw/zinc/78/25/56/337782556.db2.gz QNBKJXJVONPYKZ-QWRGUYRKSA-N 1 2 310.319 4.234 20 0 DIADLO Cc1ccc(Cc2noc(C3CCc4ccccc4CC3)n2)c[nH+]1 ZINC000528111715 337788549 /nfs/dbraw/zinc/78/85/49/337788549.db2.gz DTWMVUXBDPSFPU-UHFFFAOYSA-N 1 2 319.408 4.026 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc([C@@H]2CCCC23CC3)n1 ZINC000528157393 337790571 /nfs/dbraw/zinc/79/05/71/337790571.db2.gz HYVHJTWUSIKGPB-ZDUSSCGKSA-N 1 2 322.412 4.078 20 0 DIADLO O=C(Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1cccs1 ZINC000044567599 337811372 /nfs/dbraw/zinc/81/13/72/337811372.db2.gz HWAOBSDBLGSKMW-UHFFFAOYSA-N 1 2 323.421 4.200 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2cnc(C3CC3)o2)c(Cl)c1 ZINC000424332427 337822451 /nfs/dbraw/zinc/82/24/51/337822451.db2.gz KQXJPCIYFALQLT-JTQLQIEISA-N 1 2 306.793 4.065 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccc(COc2ccccc2)cc1 ZINC000107293470 337828369 /nfs/dbraw/zinc/82/83/69/337828369.db2.gz JSYLZYPMZHYKTP-UHFFFAOYSA-N 1 2 318.376 4.221 20 0 DIADLO Cc1ccc(-c2nc(C(=O)Nc3cc[nH+]cc3C)cs2)c(C)c1 ZINC000107292540 337828422 /nfs/dbraw/zinc/82/84/22/337828422.db2.gz KIHUZQRBFSTOKA-UHFFFAOYSA-N 1 2 323.421 4.383 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1 ZINC000107293420 337828435 /nfs/dbraw/zinc/82/84/35/337828435.db2.gz GDFDWHYSMXZXCZ-AWEZNQCLSA-N 1 2 312.413 4.094 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1cccc(-n2cccn2)c1 ZINC000533125230 337829742 /nfs/dbraw/zinc/82/97/42/337829742.db2.gz SZZVHAPHLCUPBL-UHFFFAOYSA-N 1 2 322.412 4.057 20 0 DIADLO CCCc1ccc(C(=O)CCC(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000119374183 337858790 /nfs/dbraw/zinc/85/87/90/337858790.db2.gz BESLJHPZSKICON-UHFFFAOYSA-N 1 2 324.424 4.253 20 0 DIADLO Cc1ccc([C@H]2CCCCN2C(=O)Nc2cc[nH+]c(C)c2)cc1 ZINC000119815592 337866277 /nfs/dbraw/zinc/86/62/77/337866277.db2.gz NLZUVHKLQSTQET-GOSISDBHSA-N 1 2 309.413 4.458 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1nc2ccccc2o1 ZINC000537023795 337870706 /nfs/dbraw/zinc/87/07/06/337870706.db2.gz NDJXGFAMHIKTEZ-AWEZNQCLSA-N 1 2 310.397 4.466 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@@H](C)c1cccc2ccccc21 ZINC000120345845 337872685 /nfs/dbraw/zinc/87/26/85/337872685.db2.gz MCGLWYVCIWOGHQ-AWEZNQCLSA-N 1 2 305.381 4.426 20 0 DIADLO COc1cccc([C@@H](C)[NH2+]Cc2ncc(-c3ccccc3)o2)c1 ZINC000537028994 337872839 /nfs/dbraw/zinc/87/28/39/337872839.db2.gz ZYKYULDLOYHQKT-CQSZACIVSA-N 1 2 308.381 4.201 20 0 DIADLO C[C@H]([NH2+][C@@H](c1cccc(F)c1)c1ccccn1)c1cccnc1 ZINC000090955971 337887527 /nfs/dbraw/zinc/88/75/27/337887527.db2.gz VSTRFGKVDVDKKJ-LIRRHRJNSA-N 1 2 307.372 4.056 20 0 DIADLO CC(C)C[C@@H](C)Oc1cc(C[NH2+][C@H](C)c2nccs2)ccn1 ZINC000091723134 337894825 /nfs/dbraw/zinc/89/48/25/337894825.db2.gz KAHPEEAPFOXLGD-ZIAGYGMSSA-N 1 2 319.474 4.202 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@@H](C)c2c(F)cccc2OC)n1 ZINC000537158847 337902369 /nfs/dbraw/zinc/90/23/69/337902369.db2.gz SAPOLFGXXFZWST-ZDUSSCGKSA-N 1 2 319.424 4.243 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@H](C)c2nc3c(s2)CCCC3)n1 ZINC000093404749 337916483 /nfs/dbraw/zinc/91/64/83/337916483.db2.gz QPPVGLILDSFQLH-WDEREUQCSA-N 1 2 307.488 4.199 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@H](C)c2nc3c(s2)CCCC3)n1 ZINC000093404748 337916499 /nfs/dbraw/zinc/91/64/99/337916499.db2.gz QPPVGLILDSFQLH-GHMZBOCLSA-N 1 2 307.488 4.199 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@@H](C)c2nc3c(s2)CCCC3)n1 ZINC000093404747 337916574 /nfs/dbraw/zinc/91/65/74/337916574.db2.gz QPPVGLILDSFQLH-QWRGUYRKSA-N 1 2 307.488 4.199 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCOc2c(Cl)cccc21)c1cscn1 ZINC000537305066 337929889 /nfs/dbraw/zinc/92/98/89/337929889.db2.gz AQKAWPCHQPUWSY-GXFFZTMASA-N 1 2 308.834 4.361 20 0 DIADLO CC(C)C[C@H]1C[C@H](Nc2cc(C(F)(F)F)cc[nH+]2)CCO1 ZINC000537388533 337934684 /nfs/dbraw/zinc/93/46/84/337934684.db2.gz ASOVOIZYISADKZ-OLZOCXBDSA-N 1 2 302.340 4.106 20 0 DIADLO COc1ccc2c(c1)CCCN(c1[nH+]ccc3ccc(F)cc31)C2 ZINC000537657236 337957033 /nfs/dbraw/zinc/95/70/33/337957033.db2.gz RHJDCZDIXMBZOR-UHFFFAOYSA-N 1 2 322.383 4.335 20 0 DIADLO COc1ccc([C@@H]2CCN(c3[nH+]ccc4ccc(F)cc43)C2)cc1 ZINC000537688197 337957680 /nfs/dbraw/zinc/95/76/80/337957680.db2.gz ZKSXKDBDIDOHTG-MRXNPFEDSA-N 1 2 322.383 4.376 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccc(F)cc1F ZINC000537961157 337964817 /nfs/dbraw/zinc/96/48/17/337964817.db2.gz ZEQQNLFQXRQRIB-VFZGTOFNSA-N 1 2 309.743 4.403 20 0 DIADLO CCCCN(C(=O)c1ccc2[nH+]ccn2c1)[C@@H]1CCC[C@H](C)C1 ZINC000515245056 337982998 /nfs/dbraw/zinc/98/29/98/337982998.db2.gz YYYRIJCJMOEZBM-DOTOQJQBSA-N 1 2 313.445 4.155 20 0 DIADLO Cc1cc[nH+]c(NC[C@@H](C[C@@H](C)O)c2ccccc2)c1Cl ZINC000515262632 337984009 /nfs/dbraw/zinc/98/40/09/337984009.db2.gz XKMSPOLFNWBODH-UKRRQHHQSA-N 1 2 304.821 4.010 20 0 DIADLO COC(=O)c1cnc([C@H](C)[NH2+][C@@H](C)c2cc(C)sc2C)s1 ZINC000315438404 337987270 /nfs/dbraw/zinc/98/72/70/337987270.db2.gz WUXXAVLMOGXBCQ-UWVGGRQHSA-N 1 2 324.471 4.020 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2csc(C)n2)cc1F ZINC000426149772 338021258 /nfs/dbraw/zinc/02/12/58/338021258.db2.gz CFMBEUNNYGRTHF-MRXNPFEDSA-N 1 2 320.433 4.326 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2csc(C)n2)cc1F ZINC000426149772 338021259 /nfs/dbraw/zinc/02/12/59/338021259.db2.gz CFMBEUNNYGRTHF-MRXNPFEDSA-N 1 2 320.433 4.326 20 0 DIADLO CCSc1cccc(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)c1 ZINC000426352086 338028451 /nfs/dbraw/zinc/02/84/51/338028451.db2.gz OKWVYFOPNANMSG-SFHVURJKSA-N 1 2 323.465 4.401 20 0 DIADLO CCCc1csc(C[N@H+](C)[C@@H]2CCCc3nc(C)sc32)n1 ZINC000426398536 338030720 /nfs/dbraw/zinc/03/07/20/338030720.db2.gz YSSSVDFALFWUKM-CQSZACIVSA-N 1 2 321.515 4.370 20 0 DIADLO CCCc1csc(C[N@@H+](C)[C@@H]2CCCc3nc(C)sc32)n1 ZINC000426398536 338030721 /nfs/dbraw/zinc/03/07/21/338030721.db2.gz YSSSVDFALFWUKM-CQSZACIVSA-N 1 2 321.515 4.370 20 0 DIADLO CCCOc1cccc(-c2noc(CCc3c[nH+]cc(C)c3)n2)c1 ZINC000426408782 338031192 /nfs/dbraw/zinc/03/11/92/338031192.db2.gz FHNRZWTYMQMJGG-UHFFFAOYSA-N 1 2 323.396 4.014 20 0 DIADLO Cc1cc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)ncn1 ZINC000428215839 338042609 /nfs/dbraw/zinc/04/26/09/338042609.db2.gz DCRRKZTYXPPCKG-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO Cc1cc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)ncn1 ZINC000428215839 338042610 /nfs/dbraw/zinc/04/26/10/338042610.db2.gz DCRRKZTYXPPCKG-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO CCCc1nc(C)c(C[N@H+](C)Cc2ccc(F)cc2Cl)o1 ZINC000428221493 338042893 /nfs/dbraw/zinc/04/28/93/338042893.db2.gz KPXVVYZHPMMKCF-UHFFFAOYSA-N 1 2 310.800 4.360 20 0 DIADLO CCCc1nc(C)c(C[N@@H+](C)Cc2ccc(F)cc2Cl)o1 ZINC000428221493 338042894 /nfs/dbraw/zinc/04/28/94/338042894.db2.gz KPXVVYZHPMMKCF-UHFFFAOYSA-N 1 2 310.800 4.360 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+]2CC=C(c3ccccc3Cl)CC2)cn1 ZINC000428292803 338045787 /nfs/dbraw/zinc/04/57/87/338045787.db2.gz CZSNCHKTBKPMJU-CQSZACIVSA-N 1 2 313.832 4.289 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+]2CC=C(c3ccccc3Cl)CC2)cn1 ZINC000428292803 338045788 /nfs/dbraw/zinc/04/57/88/338045788.db2.gz CZSNCHKTBKPMJU-CQSZACIVSA-N 1 2 313.832 4.289 20 0 DIADLO CCc1nc(C)c(C[N@H+](C)Cc2cccc(Cl)c2Cl)o1 ZINC000428364456 338048762 /nfs/dbraw/zinc/04/87/62/338048762.db2.gz NVUDDPBBOZZXDV-UHFFFAOYSA-N 1 2 313.228 4.484 20 0 DIADLO CCc1nc(C)c(C[N@@H+](C)Cc2cccc(Cl)c2Cl)o1 ZINC000428364456 338048763 /nfs/dbraw/zinc/04/87/63/338048763.db2.gz NVUDDPBBOZZXDV-UHFFFAOYSA-N 1 2 313.228 4.484 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+]2CCc3cc(-c4ccccc4)oc3C2)cn1 ZINC000428381095 338049618 /nfs/dbraw/zinc/04/96/18/338049618.db2.gz FLQIJIMRMKKQKZ-HNNXBMFYSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1cnc([C@H](C)[N@H+]2CCc3cc(-c4ccccc4)oc3C2)cn1 ZINC000428381095 338049619 /nfs/dbraw/zinc/04/96/19/338049619.db2.gz FLQIJIMRMKKQKZ-HNNXBMFYSA-N 1 2 319.408 4.164 20 0 DIADLO CC[C@](C)([NH2+]Cc1oc(C(C)C)nc1C)c1nc(C)cs1 ZINC000428386586 338049907 /nfs/dbraw/zinc/04/99/07/338049907.db2.gz XJVZCWLURQRMGU-INIZCTEOSA-N 1 2 307.463 4.286 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+]2CCC[C@H]2c2nc3ccccc3s2)cn1 ZINC000428472115 338054163 /nfs/dbraw/zinc/05/41/63/338054163.db2.gz FNAJJOPQWCQLQO-BBRMVZONSA-N 1 2 324.453 4.293 20 0 DIADLO Cc1cnc([C@H](C)[N@H+]2CCC[C@H]2c2nc3ccccc3s2)cn1 ZINC000428472115 338054164 /nfs/dbraw/zinc/05/41/64/338054164.db2.gz FNAJJOPQWCQLQO-BBRMVZONSA-N 1 2 324.453 4.293 20 0 DIADLO CCc1nc(C)c(C[N@H+](Cc2ccco2)Cc2ccccc2)o1 ZINC000428473458 338054291 /nfs/dbraw/zinc/05/42/91/338054291.db2.gz MOYCKSUKKFKZHX-UHFFFAOYSA-N 1 2 310.397 4.341 20 0 DIADLO CCc1nc(C)c(C[N@@H+](Cc2ccco2)Cc2ccccc2)o1 ZINC000428473458 338054292 /nfs/dbraw/zinc/05/42/92/338054292.db2.gz MOYCKSUKKFKZHX-UHFFFAOYSA-N 1 2 310.397 4.341 20 0 DIADLO Cc1nc([C@H](C)[NH+]2CCC(Cc3ccc(C)c(C)c3)CC2)no1 ZINC000428718461 338059371 /nfs/dbraw/zinc/05/93/71/338059371.db2.gz HTRAKJOYALDPSM-HNNXBMFYSA-N 1 2 313.445 4.011 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2nc3ccc(F)cc3s2)s1 ZINC000428872103 338063800 /nfs/dbraw/zinc/06/38/00/338063800.db2.gz LOFGHGQJBZTHBU-SECBINFHSA-N 1 2 307.419 4.051 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(-c3ccccc3)on2)Cc2ccccc2O1 ZINC000429150330 338072121 /nfs/dbraw/zinc/07/21/21/338072121.db2.gz IIDVGWSWSPGQFW-OAHLLOKOSA-N 1 2 320.392 4.125 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(-c3ccccc3)on2)Cc2ccccc2O1 ZINC000429150330 338072122 /nfs/dbraw/zinc/07/21/22/338072122.db2.gz IIDVGWSWSPGQFW-OAHLLOKOSA-N 1 2 320.392 4.125 20 0 DIADLO CC[C@@H]1CC[N@@H+]1Cc1cc(Br)ccc1OC(F)F ZINC000429282335 338076145 /nfs/dbraw/zinc/07/61/45/338076145.db2.gz BBJIFRVOQBAVRY-LLVKDONJSA-N 1 2 320.177 4.035 20 0 DIADLO CC[C@@H]1CC[N@H+]1Cc1cc(Br)ccc1OC(F)F ZINC000429282335 338076146 /nfs/dbraw/zinc/07/61/46/338076146.db2.gz BBJIFRVOQBAVRY-LLVKDONJSA-N 1 2 320.177 4.035 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc(Cl)c1C ZINC000429405754 338079947 /nfs/dbraw/zinc/07/99/47/338079947.db2.gz LYCIWFLFUMVWKN-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@@H](C)C(=O)Nc1cccc(Cl)c1C ZINC000429405754 338079948 /nfs/dbraw/zinc/07/99/48/338079948.db2.gz LYCIWFLFUMVWKN-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO CC(C)Cc1ccc(CN(C)Cc2cn3c([nH+]2)CCCC3)cc1 ZINC000429554899 338083884 /nfs/dbraw/zinc/08/38/84/338083884.db2.gz UYCYZKVWUSYZFD-UHFFFAOYSA-N 1 2 311.473 4.050 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2c(Cl)cccc2OC)cs1 ZINC000429703073 338087867 /nfs/dbraw/zinc/08/78/67/338087867.db2.gz YZLUPSAERYOMQL-SNVBAGLBSA-N 1 2 310.850 4.218 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(OC(C)(C)C)cc3)ccc2[nH+]1 ZINC000429821270 338090655 /nfs/dbraw/zinc/09/06/55/338090655.db2.gz PQAZOSDRPLUNKH-UHFFFAOYSA-N 1 2 323.396 4.072 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2cc(Cl)cs2)c(F)c1F ZINC000430029149 338093796 /nfs/dbraw/zinc/09/37/96/338093796.db2.gz UFCNKWXIGUSPTB-UHFFFAOYSA-N 1 2 309.715 4.248 20 0 DIADLO Clc1scc(C[N@@H+]2CCOC[C@H](C3CCC3)C2)c1Cl ZINC000430142766 338098899 /nfs/dbraw/zinc/09/88/99/338098899.db2.gz DEXCRBGQYSUUJS-LLVKDONJSA-N 1 2 320.285 4.303 20 0 DIADLO Clc1scc(C[N@H+]2CCOC[C@H](C3CCC3)C2)c1Cl ZINC000430142766 338098900 /nfs/dbraw/zinc/09/89/00/338098900.db2.gz DEXCRBGQYSUUJS-LLVKDONJSA-N 1 2 320.285 4.303 20 0 DIADLO CC(C)c1cnc(C[N@H+]2Cc3ccccc3O[C@H](C)C2)s1 ZINC000430148469 338099209 /nfs/dbraw/zinc/09/92/09/338099209.db2.gz SFNDXBYVLDWQSX-CYBMUJFWSA-N 1 2 302.443 4.050 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2Cc3ccccc3O[C@H](C)C2)s1 ZINC000430148469 338099210 /nfs/dbraw/zinc/09/92/10/338099210.db2.gz SFNDXBYVLDWQSX-CYBMUJFWSA-N 1 2 302.443 4.050 20 0 DIADLO COc1ccsc1[C@H](C)[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000430725139 338112424 /nfs/dbraw/zinc/11/24/24/338112424.db2.gz PZWLOXBYDJAJCC-ZETCQYMHSA-N 1 2 319.323 4.164 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1cc(F)ccc1C ZINC000430875931 338117772 /nfs/dbraw/zinc/11/77/72/338117772.db2.gz BSIXPJIJYFZOBD-QGZVFWFLSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1cc(F)ccc1C ZINC000430875931 338117773 /nfs/dbraw/zinc/11/77/73/338117773.db2.gz BSIXPJIJYFZOBD-QGZVFWFLSA-N 1 2 301.409 4.078 20 0 DIADLO Cn1c2cc(F)ccc2[nH+]c1N1CCC[C@@H]1c1ccc(F)cc1 ZINC000431036360 338120955 /nfs/dbraw/zinc/12/09/55/338120955.db2.gz FLHDCNSSPXEGBJ-MRXNPFEDSA-N 1 2 313.351 4.193 20 0 DIADLO Cn1ncc2c1nc[nH+]c2NCc1ccc(C2CCCCC2)cc1 ZINC000431163772 338124568 /nfs/dbraw/zinc/12/45/68/338124568.db2.gz PSJQUESVCJDZKK-UHFFFAOYSA-N 1 2 321.428 4.023 20 0 DIADLO Cc1ccc(Cn2nc(C(F)(F)F)c3c[nH+]ccc32)cc1C ZINC000431880259 338140816 /nfs/dbraw/zinc/14/08/16/338140816.db2.gz CMGMQKKFPJTQKL-UHFFFAOYSA-N 1 2 305.303 4.115 20 0 DIADLO Clc1cccc([C@H]2CCN(c3cc[nH+]c4ccncc43)C2)c1 ZINC000432136289 338146617 /nfs/dbraw/zinc/14/66/17/338146617.db2.gz BSYZUZRJANESQK-AWEZNQCLSA-N 1 2 309.800 4.277 20 0 DIADLO Cc1cc(N2CC[C@H](c3cccc(Cl)c3)C2)nc(C2CC2)[nH+]1 ZINC000432134224 338146731 /nfs/dbraw/zinc/14/67/31/338146731.db2.gz CJHDNQOKOATNAU-HNNXBMFYSA-N 1 2 313.832 4.310 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1csc(Cl)c1Cl)CO2 ZINC000432232591 338149356 /nfs/dbraw/zinc/14/93/56/338149356.db2.gz NDQRMFZPSCMUCH-JTQLQIEISA-N 1 2 318.200 4.417 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2csc(Cl)c2Cl)s1 ZINC000432250463 338150898 /nfs/dbraw/zinc/15/08/98/338150898.db2.gz KIQOJCDOPXSWPQ-UHFFFAOYSA-N 1 2 322.286 4.320 20 0 DIADLO COc1cc[nH+]cc1NCc1ccc(F)c(Cl)c1Cl ZINC000432252486 338151129 /nfs/dbraw/zinc/15/11/29/338151129.db2.gz GPGBSPUKFDAGHU-UHFFFAOYSA-N 1 2 301.148 4.148 20 0 DIADLO COC[C@@H]([NH2+]Cc1csc(Cl)c1Cl)c1ccc(C)o1 ZINC000432252156 338151145 /nfs/dbraw/zinc/15/11/45/338151145.db2.gz XENRSEOWERLVJE-SNVBAGLBSA-N 1 2 320.241 4.434 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCOC3(CCCCC3)C2)s1 ZINC000432746344 338165754 /nfs/dbraw/zinc/16/57/54/338165754.db2.gz BUCZPARCEWBSCH-UHFFFAOYSA-N 1 2 319.392 4.302 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCOC3(CCCCC3)C2)s1 ZINC000432746344 338165755 /nfs/dbraw/zinc/16/57/55/338165755.db2.gz BUCZPARCEWBSCH-UHFFFAOYSA-N 1 2 319.392 4.302 20 0 DIADLO Fc1ccc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)c(Cl)c1Cl ZINC000432917092 338172861 /nfs/dbraw/zinc/17/28/61/338172861.db2.gz OPMRJMUTLLRIDQ-LLVKDONJSA-N 1 2 314.191 4.193 20 0 DIADLO COc1cc[nH+]cc1CN1CC[C@@H](C(F)(F)F)c2ccccc21 ZINC000433034510 338177547 /nfs/dbraw/zinc/17/75/47/338177547.db2.gz IHUYOMLKUCJFAN-CQSZACIVSA-N 1 2 322.330 4.146 20 0 DIADLO FC(F)[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1ccccc1 ZINC000433059926 338179240 /nfs/dbraw/zinc/17/92/40/338179240.db2.gz FKTAMFNQOLFDKC-JKSUJKDBSA-N 1 2 309.400 4.464 20 0 DIADLO FC(F)[C@@H]([NH2+]CCOc1ccccc1Cl)c1ccccc1 ZINC000433061941 338179462 /nfs/dbraw/zinc/17/94/62/338179462.db2.gz MMFMUHOEROTREU-HNNXBMFYSA-N 1 2 311.759 4.315 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2cc(F)c(Cl)cc2F)cc1F ZINC000433196915 338185377 /nfs/dbraw/zinc/18/53/77/338185377.db2.gz NYQQYVVCXCIYRL-UHFFFAOYSA-N 1 2 321.676 4.325 20 0 DIADLO Cc1ccc(NC(=O)N(C)Cc2cc(Cl)ccc2F)c(C)[nH+]1 ZINC000434224454 338212571 /nfs/dbraw/zinc/21/25/71/338212571.db2.gz BFBKIFXTODULAJ-UHFFFAOYSA-N 1 2 321.783 4.155 20 0 DIADLO Brc1cnc(C[N@@H+]2CCCC3(CCCC3)C2)s1 ZINC000434506836 338218757 /nfs/dbraw/zinc/21/87/57/338218757.db2.gz WXVLPIYWGSHODL-UHFFFAOYSA-N 1 2 315.280 4.062 20 0 DIADLO Brc1cnc(C[N@H+]2CCCC3(CCCC3)C2)s1 ZINC000434506836 338218758 /nfs/dbraw/zinc/21/87/58/338218758.db2.gz WXVLPIYWGSHODL-UHFFFAOYSA-N 1 2 315.280 4.062 20 0 DIADLO CC(C)c1noc(C[N@@H+](C)[C@H](c2ccc(F)cc2)C(C)C)n1 ZINC000434619019 338221347 /nfs/dbraw/zinc/22/13/47/338221347.db2.gz BRBMFUKQWAAETK-INIZCTEOSA-N 1 2 305.397 4.161 20 0 DIADLO CC(C)c1noc(C[N@H+](C)[C@H](c2ccc(F)cc2)C(C)C)n1 ZINC000434619019 338221348 /nfs/dbraw/zinc/22/13/48/338221348.db2.gz BRBMFUKQWAAETK-INIZCTEOSA-N 1 2 305.397 4.161 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1ccccc1OC(F)(F)F ZINC000153323112 338222414 /nfs/dbraw/zinc/22/24/14/338222414.db2.gz TVZOFZZWKOALGJ-ZJUUUORDSA-N 1 2 316.348 4.454 20 0 DIADLO C[C@H]([NH2+]Cc1cocn1)c1cccc(OCc2ccccc2)c1 ZINC000434791814 338225881 /nfs/dbraw/zinc/22/58/81/338225881.db2.gz FJWLIKKPYRTQHU-HNNXBMFYSA-N 1 2 308.381 4.104 20 0 DIADLO CC[N@H+](Cc1ncc(C(F)(F)F)s1)Cc1ccccc1 ZINC000434836410 338226082 /nfs/dbraw/zinc/22/60/82/338226082.db2.gz MZEDAERXDXWXLX-UHFFFAOYSA-N 1 2 300.349 4.184 20 0 DIADLO CC[N@@H+](Cc1ncc(C(F)(F)F)s1)Cc1ccccc1 ZINC000434836410 338226083 /nfs/dbraw/zinc/22/60/83/338226083.db2.gz MZEDAERXDXWXLX-UHFFFAOYSA-N 1 2 300.349 4.184 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c(Cl)c1OC ZINC000434979690 338228496 /nfs/dbraw/zinc/22/84/96/338228496.db2.gz WASBVLXAURAANM-OAHLLOKOSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)c(Cl)c1OC ZINC000434979690 338228497 /nfs/dbraw/zinc/22/84/97/338228497.db2.gz WASBVLXAURAANM-OAHLLOKOSA-N 1 2 317.816 4.304 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ncc(C(F)(F)F)s2)CC12CCC2 ZINC000434988745 338229218 /nfs/dbraw/zinc/22/92/18/338229218.db2.gz WBUNZMWFNVGBKU-JTQLQIEISA-N 1 2 304.381 4.174 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ncc(C(F)(F)F)s2)CC12CCC2 ZINC000434988745 338229219 /nfs/dbraw/zinc/22/92/19/338229219.db2.gz WBUNZMWFNVGBKU-JTQLQIEISA-N 1 2 304.381 4.174 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ncc(C(F)(F)F)s2)CC12CCC2 ZINC000434988746 338229283 /nfs/dbraw/zinc/22/92/83/338229283.db2.gz WBUNZMWFNVGBKU-SNVBAGLBSA-N 1 2 304.381 4.174 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ncc(C(F)(F)F)s2)CC12CCC2 ZINC000434988746 338229284 /nfs/dbraw/zinc/22/92/84/338229284.db2.gz WBUNZMWFNVGBKU-SNVBAGLBSA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1cnc(C[NH+]2CCC3(CCCC3)CC2)s1 ZINC000435128853 338232595 /nfs/dbraw/zinc/23/25/95/338232595.db2.gz JZZIBTCEIWXXKX-UHFFFAOYSA-N 1 2 304.381 4.318 20 0 DIADLO C[N@H+](Cc1cscn1)Cc1cccc(NC2CC(C)(C)C2)c1 ZINC000435129198 338232755 /nfs/dbraw/zinc/23/27/55/338232755.db2.gz LNPCZFHZQIHUFQ-UHFFFAOYSA-N 1 2 315.486 4.376 20 0 DIADLO C[N@@H+](Cc1cscn1)Cc1cccc(NC2CC(C)(C)C2)c1 ZINC000435129198 338232756 /nfs/dbraw/zinc/23/27/56/338232756.db2.gz LNPCZFHZQIHUFQ-UHFFFAOYSA-N 1 2 315.486 4.376 20 0 DIADLO Clc1ccc(-c2ccc(C[NH+]3CCOCC3)o2)cc1Cl ZINC000435239199 338234909 /nfs/dbraw/zinc/23/49/09/338234909.db2.gz UYOMCGBXDSPZLN-UHFFFAOYSA-N 1 2 312.196 4.086 20 0 DIADLO CC(C)[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1c(Cl)cnn1C ZINC000435301389 338236819 /nfs/dbraw/zinc/23/68/19/338236819.db2.gz YAPMTSDOIMZHGV-INIZCTEOSA-N 1 2 309.816 4.042 20 0 DIADLO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1c(Cl)cnn1C ZINC000435301389 338236820 /nfs/dbraw/zinc/23/68/20/338236820.db2.gz YAPMTSDOIMZHGV-INIZCTEOSA-N 1 2 309.816 4.042 20 0 DIADLO C[C@@H]1[C@H](C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)[C@H]1c1ccccc1 ZINC000435679280 338245075 /nfs/dbraw/zinc/24/50/75/338245075.db2.gz XSUMUDBCQHEVCM-VHSSKADRSA-N 1 2 317.392 4.065 20 0 DIADLO Cc1[nH]ncc1C[N@H+](Cc1ccc(F)cc1)C1CCCCC1 ZINC000435766918 338248302 /nfs/dbraw/zinc/24/83/02/338248302.db2.gz BSWMGUKCVCXSEH-UHFFFAOYSA-N 1 2 301.409 4.192 20 0 DIADLO Cc1[nH]ncc1C[N@@H+](Cc1ccc(F)cc1)C1CCCCC1 ZINC000435766918 338248303 /nfs/dbraw/zinc/24/83/03/338248303.db2.gz BSWMGUKCVCXSEH-UHFFFAOYSA-N 1 2 301.409 4.192 20 0 DIADLO c1cn(CCSCc2nc(C3CCCCC3)cs2)c[nH+]1 ZINC000435886516 338251826 /nfs/dbraw/zinc/25/18/26/338251826.db2.gz YHCLTGOGQAFGEC-UHFFFAOYSA-N 1 2 307.488 4.321 20 0 DIADLO O=C(CCC1CCC1)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436162217 338260023 /nfs/dbraw/zinc/26/00/23/338260023.db2.gz NNPMJHKUITYVTM-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO CC(C)[C@H](C)C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436174439 338260584 /nfs/dbraw/zinc/26/05/84/338260584.db2.gz VEHAKLKCXCLCTP-AWEZNQCLSA-N 1 2 311.429 4.117 20 0 DIADLO COc1cccc2c(NCc3cc4ccccc4[nH]3)cc[nH+]c12 ZINC000436281617 338265664 /nfs/dbraw/zinc/26/56/64/338265664.db2.gz HAPZPNUSODOYOD-UHFFFAOYSA-N 1 2 303.365 4.337 20 0 DIADLO Fc1cccc2[nH]c(CNc3ccc(-n4cc[nH+]c4)cc3)cc21 ZINC000436283343 338265714 /nfs/dbraw/zinc/26/57/14/338265714.db2.gz URIJNULUZOGMGH-UHFFFAOYSA-N 1 2 306.344 4.105 20 0 DIADLO COCCN(Cc1ccccc1)c1[nH+]ccc2ccc(F)cc21 ZINC000436430812 338272273 /nfs/dbraw/zinc/27/22/73/338272273.db2.gz KEFKIYVKIWGIBC-UHFFFAOYSA-N 1 2 310.372 4.027 20 0 DIADLO COc1cccc2c(N[C@H]3CCO[C@@H](C(C)(C)C)C3)cc[nH+]c12 ZINC000436460128 338272806 /nfs/dbraw/zinc/27/28/06/338272806.db2.gz MXMCMIUSQXZIDM-SUMWQHHRSA-N 1 2 314.429 4.249 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1)c1csnn1 ZINC000436470075 338273336 /nfs/dbraw/zinc/27/33/36/338273336.db2.gz IAYIYQPQMSZMSD-STQMWFEESA-N 1 2 310.426 4.012 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@H](Cc3ccccc3)C2)c(C)[nH+]1 ZINC000436491990 338274127 /nfs/dbraw/zinc/27/41/27/338274127.db2.gz JBZGKCPEMDSAEL-SFHVURJKSA-N 1 2 323.440 4.103 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](Cc2ccccc2)C2CC2)c(C)[nH+]1 ZINC000436499875 338274413 /nfs/dbraw/zinc/27/44/13/338274413.db2.gz XYVZNPUZTODASY-SFHVURJKSA-N 1 2 323.440 4.150 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@@H](C)[C@H]2c2ccccc2)c(C)[nH+]1 ZINC000436500318 338274444 /nfs/dbraw/zinc/27/44/44/338274444.db2.gz ZLGBQBRKLKWIFM-ACJLOTCBSA-N 1 2 309.413 4.232 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)CC2(c3ccccc3)CC2)c(C)[nH+]1 ZINC000436499652 338274543 /nfs/dbraw/zinc/27/45/43/338274543.db2.gz XUFLRRLUBMTVKF-UHFFFAOYSA-N 1 2 323.440 4.202 20 0 DIADLO Cc1cn[nH]c1C[N@H+](Cc1ccccc1)[C@@H](C)c1ccccc1 ZINC000436651530 338281472 /nfs/dbraw/zinc/28/14/72/338281472.db2.gz GFAVQETWKADNJO-KRWDZBQOSA-N 1 2 305.425 4.482 20 0 DIADLO Cc1cn[nH]c1C[N@@H+](Cc1ccccc1)[C@@H](C)c1ccccc1 ZINC000436651530 338281473 /nfs/dbraw/zinc/28/14/73/338281473.db2.gz GFAVQETWKADNJO-KRWDZBQOSA-N 1 2 305.425 4.482 20 0 DIADLO CCc1cccc(CC)c1NC(=O)[C@H](C)[NH+]1Cc2ccccc2C1 ZINC000155464793 338282258 /nfs/dbraw/zinc/28/22/58/338282258.db2.gz MMZOXTVFHKOMEK-HNNXBMFYSA-N 1 2 322.452 4.154 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[NH+]3Cc4ccccc4C3)o2)cc1 ZINC000155490146 338283681 /nfs/dbraw/zinc/28/36/81/338283681.db2.gz FDJYGZBPTIRXSL-AWEZNQCLSA-N 1 2 305.381 4.122 20 0 DIADLO Cc1ccc(-c2noc([C@@H](C)[NH+]3Cc4ccccc4C3)n2)cc1F ZINC000155520433 338286974 /nfs/dbraw/zinc/28/69/74/338286974.db2.gz HQEHMIQZMXWYFX-CYBMUJFWSA-N 1 2 323.371 4.261 20 0 DIADLO CCC(C)(C)CC[S@@](=O)Cc1cn2cc(Cl)ccc2[nH+]1 ZINC000437167613 338303085 /nfs/dbraw/zinc/30/30/85/338303085.db2.gz OHBKDZUOKJRANH-HXUWFJFHSA-N 1 2 312.866 4.063 20 0 DIADLO FC(F)(F)Cn1cc[nH+]c1CSC/C=C/c1ccccc1 ZINC000437267200 338305337 /nfs/dbraw/zinc/30/53/37/338305337.db2.gz MXTFKAFKIKYOGN-QPJJXVBHSA-N 1 2 312.360 4.392 20 0 DIADLO Cc1cc2[nH+]cn(Cc3ccn(-c4ccccc4F)n3)c2cc1C ZINC000437629283 338316644 /nfs/dbraw/zinc/31/66/44/338316644.db2.gz YHIVYLXIAAGOSM-UHFFFAOYSA-N 1 2 320.371 4.026 20 0 DIADLO Clc1oc2ccccc2c1CN1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000437956712 338326363 /nfs/dbraw/zinc/32/63/63/338326363.db2.gz BNOYBKWLWWGOGZ-CYBMUJFWSA-N 1 2 301.777 4.146 20 0 DIADLO Clc1oc2ccccc2c1C[N@@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000437956712 338326364 /nfs/dbraw/zinc/32/63/64/338326364.db2.gz BNOYBKWLWWGOGZ-CYBMUJFWSA-N 1 2 301.777 4.146 20 0 DIADLO Clc1oc2ccccc2c1C[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000437956712 338326365 /nfs/dbraw/zinc/32/63/65/338326365.db2.gz BNOYBKWLWWGOGZ-CYBMUJFWSA-N 1 2 301.777 4.146 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2cc3c(cccc3F)[nH]2)cs1 ZINC000437974071 338326991 /nfs/dbraw/zinc/32/69/91/338326991.db2.gz FBSLFKLQYAGVDP-QGZVFWFLSA-N 1 2 315.417 4.409 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2cc3c(cccc3F)[nH]2)cs1 ZINC000437974071 338326992 /nfs/dbraw/zinc/32/69/92/338326992.db2.gz FBSLFKLQYAGVDP-QGZVFWFLSA-N 1 2 315.417 4.409 20 0 DIADLO CC[C@@H](C)C[C@H](C)NC(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000437980003 338327073 /nfs/dbraw/zinc/32/70/73/338327073.db2.gz RYITZGCXDNMXNO-KGLIPLIRSA-N 1 2 314.433 4.033 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3c(cccc3F)[nH]2)[C@@H](c2ccccc2)CO1 ZINC000438091157 338330998 /nfs/dbraw/zinc/33/09/98/338330998.db2.gz AGOPDLMDHXSDJS-VBKZILBWSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3c(cccc3F)[nH]2)[C@@H](c2ccccc2)CO1 ZINC000438091157 338330999 /nfs/dbraw/zinc/33/09/99/338330999.db2.gz AGOPDLMDHXSDJS-VBKZILBWSA-N 1 2 324.399 4.269 20 0 DIADLO Fc1cc(Cl)ccc1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000438113015 338332554 /nfs/dbraw/zinc/33/25/54/338332554.db2.gz IXFJSZVVEFUGSR-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@H]2c2nc3cc(Cl)ccc3[nH]2)o1 ZINC000438290132 338338776 /nfs/dbraw/zinc/33/87/76/338338776.db2.gz MTLDNXGUDRJZSK-INIZCTEOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@H]2c2nc3cc(Cl)ccc3[nH]2)o1 ZINC000438290132 338338777 /nfs/dbraw/zinc/33/87/77/338338777.db2.gz MTLDNXGUDRJZSK-INIZCTEOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)o1 ZINC000438290132 338338778 /nfs/dbraw/zinc/33/87/78/338338778.db2.gz MTLDNXGUDRJZSK-INIZCTEOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)o1 ZINC000438290132 338338779 /nfs/dbraw/zinc/33/87/79/338338779.db2.gz MTLDNXGUDRJZSK-INIZCTEOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1ccc(F)cc1CSCc1[nH+]ccn1CC(F)(F)F ZINC000438307070 338339076 /nfs/dbraw/zinc/33/90/76/338339076.db2.gz RKTDELICWMYLQY-UHFFFAOYSA-N 1 2 318.339 4.326 20 0 DIADLO CCc1ccc(OCc2c[nH+]cn2Cc2ccccc2)c(OC)c1 ZINC000438322952 338339545 /nfs/dbraw/zinc/33/95/45/338339545.db2.gz VOUKCBLTLNGUDF-UHFFFAOYSA-N 1 2 322.408 4.081 20 0 DIADLO c1nc2cc(NCc3c[nH+]cn3Cc3ccccc3)ccc2s1 ZINC000438328735 338339769 /nfs/dbraw/zinc/33/97/69/338339769.db2.gz OCLKQLLQYCSDTE-UHFFFAOYSA-N 1 2 320.421 4.153 20 0 DIADLO CCC1(CNC(=O)c2cccc(Oc3cc[nH+]cc3)c2)CCC1 ZINC000438541689 338347377 /nfs/dbraw/zinc/34/73/77/338347377.db2.gz QXDAZYOYDLBYGK-UHFFFAOYSA-N 1 2 310.397 4.184 20 0 DIADLO C[C@H]1CO[C@@H](c2cccc(Cl)c2)C[N@@H+]1Cc1ccsc1 ZINC000438547058 338347612 /nfs/dbraw/zinc/34/76/12/338347612.db2.gz OLGRRWJWQSHGRQ-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@@H](c2cccc(Cl)c2)C[N@H+]1Cc1ccsc1 ZINC000438547058 338347613 /nfs/dbraw/zinc/34/76/13/338347613.db2.gz OLGRRWJWQSHGRQ-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO CCCc1noc(C[N@H+](Cc2cccc(F)c2)C2CCCC2)n1 ZINC000438874864 338354528 /nfs/dbraw/zinc/35/45/28/338354528.db2.gz LTXQHGHAYVDSPQ-UHFFFAOYSA-N 1 2 317.408 4.106 20 0 DIADLO CCCc1noc(C[N@@H+](Cc2cccc(F)c2)C2CCCC2)n1 ZINC000438874864 338354529 /nfs/dbraw/zinc/35/45/29/338354529.db2.gz LTXQHGHAYVDSPQ-UHFFFAOYSA-N 1 2 317.408 4.106 20 0 DIADLO CSc1c(F)cccc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000439108642 338361193 /nfs/dbraw/zinc/36/11/93/338361193.db2.gz CYIIDFZGWGLPFB-UHFFFAOYSA-N 1 2 304.390 4.120 20 0 DIADLO CC[N@H+](Cc1ccccc1Br)[C@H](C)c1ccccn1 ZINC000439314689 338366768 /nfs/dbraw/zinc/36/67/68/338366768.db2.gz NMEUIDLMGSMXKM-CYBMUJFWSA-N 1 2 319.246 4.427 20 0 DIADLO CC[N@@H+](Cc1ccccc1Br)[C@H](C)c1ccccn1 ZINC000439314689 338366769 /nfs/dbraw/zinc/36/67/69/338366769.db2.gz NMEUIDLMGSMXKM-CYBMUJFWSA-N 1 2 319.246 4.427 20 0 DIADLO COC(=O)[C@@H]([NH2+][C@H](C)C1CCCCC1)c1cccc(Cl)c1 ZINC000439586889 338373896 /nfs/dbraw/zinc/37/38/96/338373896.db2.gz JXOZXXHKEGGFQW-WBMJQRKESA-N 1 2 309.837 4.113 20 0 DIADLO CC[C@@H](Nc1cnc2cc(Cl)c(Cl)cc2n1)c1[nH]cc[nH+]1 ZINC000439643011 338375266 /nfs/dbraw/zinc/37/52/66/338375266.db2.gz ISEQBMFPATVHMR-SNVBAGLBSA-N 1 2 322.199 4.223 20 0 DIADLO CC[C@H](F)C[NH2+][C@H](c1nc2ccccc2n1C)c1ccccc1 ZINC000440518437 338388968 /nfs/dbraw/zinc/38/89/68/338388968.db2.gz KDNKFKVUMSGNFV-YJBOKZPZSA-N 1 2 311.404 4.000 20 0 DIADLO CC[C@@H](F)C[NH2+][C@H](c1nc2ccccc2n1C)c1ccccc1 ZINC000440518436 338388987 /nfs/dbraw/zinc/38/89/87/338388987.db2.gz KDNKFKVUMSGNFV-QAPCUYQASA-N 1 2 311.404 4.000 20 0 DIADLO Cc1ccc(/C=C\CC(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000440600538 338391944 /nfs/dbraw/zinc/39/19/44/338391944.db2.gz XQCDSCMEKOZKRI-RQOWECAXSA-N 1 2 317.392 4.223 20 0 DIADLO CCN(Cc1[nH+]ccn1CC(F)(F)F)c1ccccc1Cl ZINC000440627519 338392981 /nfs/dbraw/zinc/39/29/81/338392981.db2.gz ITBPDEZADURWIR-UHFFFAOYSA-N 1 2 317.742 4.125 20 0 DIADLO COc1cccc2c(N3CCC[C@@H](C(F)(F)F)[C@H]3C)cc[nH+]c12 ZINC000440643683 338393991 /nfs/dbraw/zinc/39/39/91/338393991.db2.gz ABEDVWXZSPIBAX-DGCLKSJQSA-N 1 2 324.346 4.411 20 0 DIADLO FC(F)(F)Cn1cc[nH+]c1CN1CCCCCc2ccccc21 ZINC000440764554 338396650 /nfs/dbraw/zinc/39/66/50/338396650.db2.gz VNGYRJZBRJYUFW-UHFFFAOYSA-N 1 2 323.362 4.178 20 0 DIADLO C[C@@H](CCC(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000440769362 338396822 /nfs/dbraw/zinc/39/68/22/338396822.db2.gz GJYLGBGNGIMRSV-INIZCTEOSA-N 1 2 319.408 4.395 20 0 DIADLO CC[C@@H](F)C[N@@H+]1CCC[C@H]1c1nc(-c2ccc(F)cc2)c[nH]1 ZINC000440785573 338397387 /nfs/dbraw/zinc/39/73/87/338397387.db2.gz PRPYYNGSPBGWEF-CJNGLKHVSA-N 1 2 305.372 4.101 20 0 DIADLO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1nc(-c2ccc(F)cc2)c[nH]1 ZINC000440785573 338397388 /nfs/dbraw/zinc/39/73/88/338397388.db2.gz PRPYYNGSPBGWEF-CJNGLKHVSA-N 1 2 305.372 4.101 20 0 DIADLO Cc1ccc(Cl)c(N(Cc2[nH]cc[nH+]2)C(=O)CC(C)(C)C)c1 ZINC000440892185 338399350 /nfs/dbraw/zinc/39/93/50/338399350.db2.gz SEMVXTCUNRHYSO-UHFFFAOYSA-N 1 2 319.836 4.341 20 0 DIADLO C[C@H](c1ccco1)[N@H+](CC(=O)Nc1ccc(Cl)cc1)C1CC1 ZINC000440890159 338399378 /nfs/dbraw/zinc/39/93/78/338399378.db2.gz GQWXLWWPZDJWCX-GFCCVEGCSA-N 1 2 318.804 4.097 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](CC(=O)Nc1ccc(Cl)cc1)C1CC1 ZINC000440890159 338399379 /nfs/dbraw/zinc/39/93/79/338399379.db2.gz GQWXLWWPZDJWCX-GFCCVEGCSA-N 1 2 318.804 4.097 20 0 DIADLO Cc1ccc(Cl)c(N(Cc2[nH]cc[nH+]2)C(=O)CCC2CC2)c1 ZINC000440908066 338399842 /nfs/dbraw/zinc/39/98/42/338399842.db2.gz YKKSWSSCLJNGQO-UHFFFAOYSA-N 1 2 317.820 4.095 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)C[C@H]2C=CCC2)c1C(C)C ZINC000441577437 338417054 /nfs/dbraw/zinc/41/70/54/338417054.db2.gz SKIXPSDIBYXLLM-HNNXBMFYSA-N 1 2 308.425 4.383 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)CCc2ccco2)c1C(C)C ZINC000441575883 338417095 /nfs/dbraw/zinc/41/70/95/338417095.db2.gz PHXDKWBSTJXGNN-UHFFFAOYSA-N 1 2 322.408 4.253 20 0 DIADLO Cc1ccc(-c2cnc(C[NH+]3CC(C)(C)OC(C)(C)C3)o2)cc1 ZINC000442876163 338437321 /nfs/dbraw/zinc/43/73/21/338437321.db2.gz QNSKKZBQDSDCMJ-UHFFFAOYSA-N 1 2 314.429 4.039 20 0 DIADLO CCCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(C)[nH+]c1C ZINC000447167797 338546817 /nfs/dbraw/zinc/54/68/17/338546817.db2.gz PTGPMXVXIQDBHC-UHFFFAOYSA-N 1 2 315.392 4.282 20 0 DIADLO CC[C@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c21)c1nccs1 ZINC000449159815 338597954 /nfs/dbraw/zinc/59/79/54/338597954.db2.gz IWVCHDWOXAEHFK-QWRGUYRKSA-N 1 2 312.360 4.289 20 0 DIADLO Fc1cc2c(c(F)c1F)[C@@H]([NH2+]Cc1nc(C3CC3)cs1)CC2 ZINC000449185384 338600368 /nfs/dbraw/zinc/60/03/68/338600368.db2.gz HQSVUEDOYQPYNM-NSHDSACASA-N 1 2 324.371 4.215 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]Cc2c(Cl)oc3ccccc32)c2nccn21 ZINC000449575927 338639515 /nfs/dbraw/zinc/63/95/15/338639515.db2.gz ZAOFMLUXZPCXIT-GXFFZTMASA-N 1 2 301.777 4.078 20 0 DIADLO Cn1c2ccc(NC(=O)C(C)(C)C(C)(F)F)cc2[nH+]c1C1CC1 ZINC000450283284 338675217 /nfs/dbraw/zinc/67/52/17/338675217.db2.gz CTGSXNYSEHLBMG-UHFFFAOYSA-N 1 2 321.371 4.071 20 0 DIADLO CC(C)Sc1ccc([C@H](C)[NH2+][C@H](C)c2csnn2)cc1 ZINC000450666300 338697231 /nfs/dbraw/zinc/69/72/31/338697231.db2.gz HJRXQVUENREECU-NWDGAFQWSA-N 1 2 307.488 4.450 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1OC1CC1)c1c(F)cccc1F ZINC000450671095 338697682 /nfs/dbraw/zinc/69/76/82/338697682.db2.gz ULEBXTWBWLYWRF-GFCCVEGCSA-N 1 2 303.352 4.357 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccc(F)cc1F ZINC000450681287 338698680 /nfs/dbraw/zinc/69/86/80/338698680.db2.gz LZTZGYYICICUBE-CQSZACIVSA-N 1 2 323.412 4.325 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(CC(F)(F)F)n1)c1cc2ccccc2o1 ZINC000450726659 338701691 /nfs/dbraw/zinc/70/16/91/338701691.db2.gz VSBMUPOXCKAMRN-LLVKDONJSA-N 1 2 323.318 4.042 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)Nc1nc(C)nc2sc(C)c(C)c21 ZINC000450836361 338707793 /nfs/dbraw/zinc/70/77/93/338707793.db2.gz YRPFLJATGOCYHT-JTQLQIEISA-N 1 2 315.446 4.006 20 0 DIADLO C[C@@H](c1csnn1)[NH+]1CCC(C)(c2ccc(Cl)cc2)CC1 ZINC000450886509 338710679 /nfs/dbraw/zinc/71/06/79/338710679.db2.gz XBOHRHDDVQBYRU-LBPRGKRZSA-N 1 2 321.877 4.306 20 0 DIADLO CCC[C@@H]1CCC[C@H]1C(=O)N1CCCC[C@@H]1c1[nH+]ccn1CC ZINC000451388459 338732225 /nfs/dbraw/zinc/73/22/25/338732225.db2.gz CBXMBPCTXYJJLM-BRWVUGGUSA-N 1 2 317.477 4.173 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(Cl)ccc(F)c1Cl)c1ccncn1 ZINC000453067484 338789810 /nfs/dbraw/zinc/78/98/10/338789810.db2.gz WPTGFFAOEOKFDZ-BDAKNGLRSA-N 1 2 314.191 4.334 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@@H]1C[C@@H](C)n2ccnc21 ZINC000453225849 338810662 /nfs/dbraw/zinc/81/06/62/338810662.db2.gz XIBXLQRWPNAZIH-YUELXQCFSA-N 1 2 323.362 4.481 20 0 DIADLO CC[C@@H]([NH2+][C@H]1CCCc2ncc(C(F)(F)F)cc21)C(F)F ZINC000453249326 338814179 /nfs/dbraw/zinc/81/41/79/338814179.db2.gz QBHXQNLJSYMQMJ-PWSUYJOCSA-N 1 2 308.294 4.111 20 0 DIADLO Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+][C@H](C)C(C)(F)F ZINC000453283839 338818349 /nfs/dbraw/zinc/81/83/49/338818349.db2.gz IQFGRQLCPGICJC-GXSJLCMTSA-N 1 2 311.401 4.208 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nccn1CC)c1cc(Cl)ccc1OC ZINC000453356003 338830562 /nfs/dbraw/zinc/83/05/62/338830562.db2.gz OVMWTNRMBXXEKB-SWLSCSKDSA-N 1 2 321.852 4.367 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nnc(-c3ccccc3)o2)c(C)s1 ZINC000195087846 338852089 /nfs/dbraw/zinc/85/20/89/338852089.db2.gz FJDYDVMGOKPEJW-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nnc(-c3ccccc3)o2)c(C)s1 ZINC000195087857 338852126 /nfs/dbraw/zinc/85/21/26/338852126.db2.gz FJDYDVMGOKPEJW-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455470139 338895524 /nfs/dbraw/zinc/89/55/24/338895524.db2.gz HWACFZFBPWFVDG-QGZVFWFLSA-N 1 2 309.413 4.124 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)c(C)[nH+]1 ZINC000455476399 338895694 /nfs/dbraw/zinc/89/56/94/338895694.db2.gz DUPVVUFKZGPKOQ-FUHWJXTLSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@H]2CCC(C)C)c(C)[nH+]1 ZINC000455476422 338895717 /nfs/dbraw/zinc/89/57/17/338895717.db2.gz DUUYDENLMAOQLN-INIZCTEOSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@]3(CC[C@@H](C)C3)C2)c(C)[nH+]1 ZINC000455508395 338897107 /nfs/dbraw/zinc/89/71/07/338897107.db2.gz ZSUGGNWECREOMB-KZULUSFZSA-N 1 2 301.434 4.051 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](CC(F)(F)F)C(C)C)c(C)[nH+]1 ZINC000455532223 338898112 /nfs/dbraw/zinc/89/81/12/338898112.db2.gz SWQYJWQDNKVVBN-GFCCVEGCSA-N 1 2 317.355 4.105 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000456363371 338927852 /nfs/dbraw/zinc/92/78/52/338927852.db2.gz UPRJUNKHGOKKEU-HOCLYGCPSA-N 1 2 305.466 4.077 20 0 DIADLO C[C@H](C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CCC1 ZINC000457434294 338963495 /nfs/dbraw/zinc/96/34/95/338963495.db2.gz GYWSJFUZWJMKQU-AWEZNQCLSA-N 1 2 323.440 4.261 20 0 DIADLO CCCCCN(C(=O)N[C@H](C)c1[nH+]ccn1CC)[C@@H](C)CCC ZINC000459053761 339012206 /nfs/dbraw/zinc/01/22/06/339012206.db2.gz HKQKGXYJFZTXEH-JKSUJKDBSA-N 1 2 322.497 4.354 20 0 DIADLO CCCCCN(CCCCC)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000459097268 339013576 /nfs/dbraw/zinc/01/35/76/339013576.db2.gz DVGJKMNCMQIMPI-JKSUJKDBSA-N 1 2 320.481 4.281 20 0 DIADLO CCOc1cc(C[N@@H+]2CCc3sccc3C2)cc(Cl)c1O ZINC000459312073 339021028 /nfs/dbraw/zinc/02/10/28/339021028.db2.gz NTQMTLLEQUJNKO-UHFFFAOYSA-N 1 2 323.845 4.064 20 0 DIADLO CCOc1cc(C[N@H+]2CCc3sccc3C2)cc(Cl)c1O ZINC000459312073 339021029 /nfs/dbraw/zinc/02/10/29/339021029.db2.gz NTQMTLLEQUJNKO-UHFFFAOYSA-N 1 2 323.845 4.064 20 0 DIADLO Cc1cc(F)c(C[NH2+]Cc2ccn(C3CCCC3)n2)c(Cl)c1 ZINC000459433266 339028938 /nfs/dbraw/zinc/02/89/38/339028938.db2.gz LPRRPXSEHKDXKT-UHFFFAOYSA-N 1 2 321.827 4.389 20 0 DIADLO COc1ccc(NC(=O)Nc2ccc(C)[nH+]c2C)cc1SC ZINC000459441568 339029362 /nfs/dbraw/zinc/02/93/62/339029362.db2.gz YOGKOOYVOTWSTP-UHFFFAOYSA-N 1 2 317.414 4.073 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ccc(C2CC2)cc1)c1nc(C2CC2)no1 ZINC000459466487 339030755 /nfs/dbraw/zinc/03/07/55/339030755.db2.gz OJNMTCKLSLCPKT-QGZVFWFLSA-N 1 2 311.429 4.311 20 0 DIADLO Fc1cccc(C=C2CC[NH+](Cc3cnc(C4CC4)nc3)CC2)c1 ZINC000459557240 339035478 /nfs/dbraw/zinc/03/54/78/339035478.db2.gz JAUJOJWXCVMMIC-UHFFFAOYSA-N 1 2 323.415 4.173 20 0 DIADLO Cc1nnc(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)n1C1CC1 ZINC000459587383 339037333 /nfs/dbraw/zinc/03/73/33/339037333.db2.gz WEIZCSVXBYNLKM-LJQANCHMSA-N 1 2 322.456 4.039 20 0 DIADLO Cc1nnc(C[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)n1C1CC1 ZINC000459587383 339037334 /nfs/dbraw/zinc/03/73/34/339037334.db2.gz WEIZCSVXBYNLKM-LJQANCHMSA-N 1 2 322.456 4.039 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)n1C ZINC000459589285 339037559 /nfs/dbraw/zinc/03/75/59/339037559.db2.gz YCPOMADTONPJIG-SFHVURJKSA-N 1 2 324.472 4.056 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)n1C ZINC000459589285 339037560 /nfs/dbraw/zinc/03/75/60/339037560.db2.gz YCPOMADTONPJIG-SFHVURJKSA-N 1 2 324.472 4.056 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](C)c2nc3c(s2)CCC3)cs1 ZINC000459630981 339039290 /nfs/dbraw/zinc/03/92/90/339039290.db2.gz HLQBSXNEKWFDMV-LLVKDONJSA-N 1 2 321.515 4.282 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)cc1Cl)c1nc2c(s1)CCC2 ZINC000459632920 339039307 /nfs/dbraw/zinc/03/93/07/339039307.db2.gz OMGLRCRFMKQYTN-SECBINFHSA-N 1 2 310.825 4.275 20 0 DIADLO CC1(CC(F)(F)F)C[NH+](Cc2nc3ccc(F)cc3s2)C1 ZINC000459640827 339039944 /nfs/dbraw/zinc/03/99/44/339039944.db2.gz QJPDSQOTSWTZLC-UHFFFAOYSA-N 1 2 318.339 4.210 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ncc(C(C)C)s1 ZINC000459651462 339040610 /nfs/dbraw/zinc/04/06/10/339040610.db2.gz QDNVXLCHUPELNK-CYBMUJFWSA-N 1 2 304.459 4.434 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000459653438 339040723 /nfs/dbraw/zinc/04/07/23/339040723.db2.gz BZSADPPBGCCHIM-CHWSQXEVSA-N 1 2 317.433 4.096 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H](C)c2nc3c(s2)CCC3)s1 ZINC000459652873 339040757 /nfs/dbraw/zinc/04/07/57/339040757.db2.gz RADJIVSGEGCGAC-SNVBAGLBSA-N 1 2 307.488 4.063 20 0 DIADLO CCCc1nc(C)c(C[N@@H+]2CCc3cccc(Cl)c3C2)o1 ZINC000459667594 339041804 /nfs/dbraw/zinc/04/18/04/339041804.db2.gz BCQUTQZRRUDKND-UHFFFAOYSA-N 1 2 304.821 4.147 20 0 DIADLO CCCc1nc(C)c(C[N@H+]2CCc3cccc(Cl)c3C2)o1 ZINC000459667594 339041805 /nfs/dbraw/zinc/04/18/05/339041805.db2.gz BCQUTQZRRUDKND-UHFFFAOYSA-N 1 2 304.821 4.147 20 0 DIADLO Cc1nc([C@@H](C)[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)no1 ZINC000459744840 339045705 /nfs/dbraw/zinc/04/57/05/339045705.db2.gz MKELKERVYMLGNF-RHSMWYFYSA-N 1 2 311.429 4.446 20 0 DIADLO Cc1nc([C@@H](C)[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)no1 ZINC000459744840 339045706 /nfs/dbraw/zinc/04/57/06/339045706.db2.gz MKELKERVYMLGNF-RHSMWYFYSA-N 1 2 311.429 4.446 20 0 DIADLO CCCn1ncnc1C[N@@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000459749489 339046042 /nfs/dbraw/zinc/04/60/42/339046042.db2.gz PINKYNOQQRNUTG-IBGZPJMESA-N 1 2 324.472 4.196 20 0 DIADLO CCCn1ncnc1C[N@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000459749489 339046043 /nfs/dbraw/zinc/04/60/43/339046043.db2.gz PINKYNOQQRNUTG-IBGZPJMESA-N 1 2 324.472 4.196 20 0 DIADLO CCC1(c2ccccc2)C[NH+](Cc2ncc(CSC)s2)C1 ZINC000459782440 339048273 /nfs/dbraw/zinc/04/82/73/339048273.db2.gz ZZFZCUHRJWPDDW-UHFFFAOYSA-N 1 2 318.511 4.170 20 0 DIADLO CCCc1sc(C(=O)Nc2cccc3[nH+]ccn32)cc1CC ZINC000460326965 339055387 /nfs/dbraw/zinc/05/53/87/339055387.db2.gz UXDPYWVHUFUBNQ-UHFFFAOYSA-N 1 2 313.426 4.163 20 0 DIADLO CC(C)(CCCc1ccccc1)C(=O)Nc1cccc2[nH+]ccn21 ZINC000460343351 339055748 /nfs/dbraw/zinc/05/57/48/339055748.db2.gz ZMKXRBLYEMSPIQ-UHFFFAOYSA-N 1 2 321.424 4.322 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CCOC[C@H]2c2ccccc2)cc1 ZINC000461404512 339063249 /nfs/dbraw/zinc/06/32/49/339063249.db2.gz WCDGJXIRPFUDBL-KRWDZBQOSA-N 1 2 303.352 4.198 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CCOC[C@H]2c2ccccc2)cc1 ZINC000461404512 339063250 /nfs/dbraw/zinc/06/32/50/339063250.db2.gz WCDGJXIRPFUDBL-KRWDZBQOSA-N 1 2 303.352 4.198 20 0 DIADLO CCC1(C(=O)NCc2cccc(-c3[nH]cc[nH+]3)c2)CCCCC1 ZINC000461485080 339064461 /nfs/dbraw/zinc/06/44/61/339064461.db2.gz GHYITVSGNULGQQ-UHFFFAOYSA-N 1 2 311.429 4.053 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CCn3c(cc4ccccc43)C2)c1 ZINC000462091766 339072130 /nfs/dbraw/zinc/07/21/30/339072130.db2.gz HQYJMTWHKKOHOR-UHFFFAOYSA-N 1 2 317.314 4.075 20 0 DIADLO CC(C)(C)c1ccccc1NCc1[nH+]ccn1CC(F)(F)F ZINC000462220791 339074438 /nfs/dbraw/zinc/07/44/38/339074438.db2.gz HBTQQVUPYOKXHK-UHFFFAOYSA-N 1 2 311.351 4.355 20 0 DIADLO CC(C)C[C@@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000462487339 339079934 /nfs/dbraw/zinc/07/99/34/339079934.db2.gz UBAVQYUTHMITNL-GFCCVEGCSA-N 1 2 305.809 4.146 20 0 DIADLO Cc1cc2[nH+]cn(Cc3ccn(-c4ccc(F)cc4)n3)c2cc1C ZINC000462553500 339081254 /nfs/dbraw/zinc/08/12/54/339081254.db2.gz OAMHGFIHWIBODY-UHFFFAOYSA-N 1 2 320.371 4.026 20 0 DIADLO Oc1cccc2c1CCC[C@H]2Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000462814273 339091350 /nfs/dbraw/zinc/09/13/50/339091350.db2.gz DKMLZFKMQQNOHU-GOSISDBHSA-N 1 2 323.440 4.267 20 0 DIADLO C[N@H+](Cc1ncc(Cl)s1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463040783 339102710 /nfs/dbraw/zinc/10/27/10/339102710.db2.gz WJXAFHOWGWQICT-BDAKNGLRSA-N 1 2 312.788 4.349 20 0 DIADLO C[N@@H+](Cc1ncc(Cl)s1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463040783 339102711 /nfs/dbraw/zinc/10/27/11/339102711.db2.gz WJXAFHOWGWQICT-BDAKNGLRSA-N 1 2 312.788 4.349 20 0 DIADLO CCOC[C@@H]1CCC[C@H]1Nc1ccc(-n2c[nH+]c(C)c2C)cc1 ZINC000463028451 339101485 /nfs/dbraw/zinc/10/14/85/339101485.db2.gz ASQAZSVZLQPGDT-QFBILLFUSA-N 1 2 313.445 4.106 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@H]3CS[C@H](C(C)C)C3)cc2)c1C ZINC000463032664 339101925 /nfs/dbraw/zinc/10/19/25/339101925.db2.gz ISJBSIXOKFRGTO-AEFFLSMTSA-N 1 2 315.486 4.431 20 0 DIADLO CC(C)CC(C)(C)C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000463033101 339101981 /nfs/dbraw/zinc/10/19/81/339101981.db2.gz IUBSKWXARIYALJ-HNNXBMFYSA-N 1 2 322.518 4.026 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCN(C)CC(F)(F)F ZINC000463074012 339104439 /nfs/dbraw/zinc/10/44/39/339104439.db2.gz NEWSAHXASPGAAJ-UHFFFAOYSA-N 1 2 313.367 4.009 20 0 DIADLO Cc1cc(N2C[C@@H](C)C[C@@H]2c2ccccc2F)nc(C2CC2)[nH+]1 ZINC000463088920 339105294 /nfs/dbraw/zinc/10/52/94/339105294.db2.gz YZHLFEINVZYPFR-YVEFUNNKSA-N 1 2 311.404 4.389 20 0 DIADLO Cc1cccc2[nH+]c(CCc3nc(CC4CC(C)(C)C4)no3)[nH]c21 ZINC000463191026 339108623 /nfs/dbraw/zinc/10/86/23/339108623.db2.gz NXBGMPSDTMXSIQ-UHFFFAOYSA-N 1 2 324.428 4.018 20 0 DIADLO Cc1cccc2[nH]c(CCc3nc(CC4CC(C)(C)C4)no3)[nH+]c21 ZINC000463191026 339108624 /nfs/dbraw/zinc/10/86/24/339108624.db2.gz NXBGMPSDTMXSIQ-UHFFFAOYSA-N 1 2 324.428 4.018 20 0 DIADLO COCC[C@@H](c1ccccc1)[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000463359777 339115681 /nfs/dbraw/zinc/11/56/81/339115681.db2.gz VUXACVHLHMMHJB-FQEVSTJZSA-N 1 2 320.436 4.235 20 0 DIADLO COCC[C@@H](c1ccccc1)[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000463359777 339115682 /nfs/dbraw/zinc/11/56/82/339115682.db2.gz VUXACVHLHMMHJB-FQEVSTJZSA-N 1 2 320.436 4.235 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463416988 339117052 /nfs/dbraw/zinc/11/70/52/339117052.db2.gz UVGYYUMXNCZAPU-LBPRGKRZSA-N 1 2 315.363 4.279 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463416988 339117053 /nfs/dbraw/zinc/11/70/53/339117053.db2.gz UVGYYUMXNCZAPU-LBPRGKRZSA-N 1 2 315.363 4.279 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCCc1ccc(Cl)c(C)c1 ZINC000463881762 339127935 /nfs/dbraw/zinc/12/79/35/339127935.db2.gz GYEGSQVWUKQUST-UHFFFAOYSA-N 1 2 317.820 4.024 20 0 DIADLO C[C@@H](NC(=O)C[C@H](C)C(C)(C)C)c1cccc(-n2cc[nH+]c2)c1 ZINC000464514631 339144028 /nfs/dbraw/zinc/14/40/28/339144028.db2.gz GUIFOHVIUAONJX-LSDHHAIUSA-N 1 2 313.445 4.122 20 0 DIADLO CC(C)[C@H]1C[N@H+](Cc2csc(C3CCCC3)n2)CCS1 ZINC000464769663 339152078 /nfs/dbraw/zinc/15/20/78/339152078.db2.gz ISKNMUIEPCZNAZ-OAHLLOKOSA-N 1 2 310.532 4.374 20 0 DIADLO CC(C)[C@H]1C[N@@H+](Cc2csc(C3CCCC3)n2)CCS1 ZINC000464769663 339152079 /nfs/dbraw/zinc/15/20/79/339152079.db2.gz ISKNMUIEPCZNAZ-OAHLLOKOSA-N 1 2 310.532 4.374 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nc(-c3ccccc3)no2)[C@H](c2ccco2)C1 ZINC000464854258 339158216 /nfs/dbraw/zinc/15/82/16/339158216.db2.gz OENDRKBKKUYXAM-ZBFHGGJFSA-N 1 2 323.396 4.303 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nc(-c3ccccc3)no2)[C@H](c2ccco2)C1 ZINC000464854258 339158217 /nfs/dbraw/zinc/15/82/17/339158217.db2.gz OENDRKBKKUYXAM-ZBFHGGJFSA-N 1 2 323.396 4.303 20 0 DIADLO CCc1ccc(CC)c(NC(=O)Cn2c(C)[nH+]c3ccccc32)c1 ZINC000464992726 339164801 /nfs/dbraw/zinc/16/48/01/339164801.db2.gz BQKMESKIGLZJFQ-UHFFFAOYSA-N 1 2 321.424 4.108 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+][C@@H](C)c3cc(F)ccc3F)nc2c1 ZINC000465396287 339175246 /nfs/dbraw/zinc/17/52/46/339175246.db2.gz ADOLATDXQYOBCS-NSHDSACASA-N 1 2 301.340 4.000 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@@H](C)c3cc(F)ccc3F)[nH]c2c1 ZINC000465396287 339175247 /nfs/dbraw/zinc/17/52/47/339175247.db2.gz ADOLATDXQYOBCS-NSHDSACASA-N 1 2 301.340 4.000 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)CCCc1csc2ccccc12 ZINC000465462620 339177563 /nfs/dbraw/zinc/17/75/63/339177563.db2.gz GDXFOEAZPRFPPU-UHFFFAOYSA-N 1 2 324.449 4.242 20 0 DIADLO CC[C@]1(C)C[C@H]1C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000466444596 339205277 /nfs/dbraw/zinc/20/52/77/339205277.db2.gz AXXDWEPWLYIBSF-FXAWDEMLSA-N 1 2 323.440 4.261 20 0 DIADLO Cc1cccc2[nH+]cc(CNc3ccc(-c4ccccc4)cn3)n21 ZINC000466622104 339210774 /nfs/dbraw/zinc/21/07/74/339210774.db2.gz XDRJUWUINXYPBE-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO Cc1ccc(CNc2cccc(-c3ccc4c(c3)CCO4)[nH+]2)o1 ZINC000466638075 339211472 /nfs/dbraw/zinc/21/14/72/339211472.db2.gz VLWSTPXZIAULSJ-UHFFFAOYSA-N 1 2 306.365 4.197 20 0 DIADLO COC(=O)c1ccc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)s1 ZINC000466816802 339218028 /nfs/dbraw/zinc/21/80/28/339218028.db2.gz YWGUEUDDTFVOQK-NSHDSACASA-N 1 2 323.845 4.381 20 0 DIADLO COC(=O)c1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)s1 ZINC000466816802 339218029 /nfs/dbraw/zinc/21/80/29/339218029.db2.gz YWGUEUDDTFVOQK-NSHDSACASA-N 1 2 323.845 4.381 20 0 DIADLO CCc1noc(C)c1C[N@H+](C)Cc1cccc(Cl)c1Cl ZINC000466833123 339218506 /nfs/dbraw/zinc/21/85/06/339218506.db2.gz SUAIDZCXYXDJDX-UHFFFAOYSA-N 1 2 313.228 4.484 20 0 DIADLO CCc1noc(C)c1C[N@@H+](C)Cc1cccc(Cl)c1Cl ZINC000466833123 339218507 /nfs/dbraw/zinc/21/85/07/339218507.db2.gz SUAIDZCXYXDJDX-UHFFFAOYSA-N 1 2 313.228 4.484 20 0 DIADLO C[C@H](C(=O)Nc1c(F)cccc1F)[NH+]1CC(C)(C)CC(C)(C)C1 ZINC000466937659 339222310 /nfs/dbraw/zinc/22/23/10/339222310.db2.gz GYMWKKCONZOEEV-GFCCVEGCSA-N 1 2 324.415 4.050 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)CCOc2ccccc2)c(C)[nH+]1 ZINC000466997676 339224047 /nfs/dbraw/zinc/22/40/47/339224047.db2.gz GLRMPIPWNRRGQV-CYBMUJFWSA-N 1 2 312.413 4.051 20 0 DIADLO Clc1cccc([C@H]2C[N@H+](CCCc3ccsc3)CCO2)c1 ZINC000467194205 339227671 /nfs/dbraw/zinc/22/76/71/339227671.db2.gz CDAXOBLJMJPFSZ-QGZVFWFLSA-N 1 2 321.873 4.408 20 0 DIADLO Clc1cccc([C@H]2C[N@@H+](CCCc3ccsc3)CCO2)c1 ZINC000467194205 339227672 /nfs/dbraw/zinc/22/76/72/339227672.db2.gz CDAXOBLJMJPFSZ-QGZVFWFLSA-N 1 2 321.873 4.408 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@@H](Nc2cccc3c2OCCO3)C1 ZINC000467355001 339233671 /nfs/dbraw/zinc/23/36/71/339233671.db2.gz NKVFLISQEDNYTM-JKSUJKDBSA-N 1 2 324.424 4.300 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2cccc(-c3ccc(C)cc3)c2)n1 ZINC000467399058 339236537 /nfs/dbraw/zinc/23/65/37/339236537.db2.gz CKFDYJTWDYLKKK-CQSZACIVSA-N 1 2 307.397 4.204 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@H](CO)c2cccc(Cl)c2F)o1 ZINC000467415501 339237383 /nfs/dbraw/zinc/23/73/83/339237383.db2.gz YPUAUJDVGPOERJ-QMTHXVAHSA-N 1 2 311.784 4.019 20 0 DIADLO CCn1cc[nH+]c1CNc1c(F)cccc1Oc1ccccc1 ZINC000467758619 339245935 /nfs/dbraw/zinc/24/59/35/339245935.db2.gz JHZWCNXPXYUGHA-UHFFFAOYSA-N 1 2 311.360 4.447 20 0 DIADLO Cc1cccc(C)c1Oc1ccccc1NCc1[nH+]ccn1C ZINC000467762995 339246071 /nfs/dbraw/zinc/24/60/71/339246071.db2.gz FMKLCKSFZYPKBA-UHFFFAOYSA-N 1 2 307.397 4.441 20 0 DIADLO CCc1ccccc1CC(=O)Nc1c[nH+]ccc1OC(C)(C)C ZINC000467957753 339249866 /nfs/dbraw/zinc/24/98/66/339249866.db2.gz HFRWYJRDGPGFRK-UHFFFAOYSA-N 1 2 312.413 4.003 20 0 DIADLO CC[C@@]1(C)CC[N@H+](CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000468113651 339254481 /nfs/dbraw/zinc/25/44/81/339254481.db2.gz PWEBIXIOXLPYJH-HNNXBMFYSA-N 1 2 315.244 4.054 20 0 DIADLO CC[C@@]1(C)CC[N@@H+](CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000468113651 339254482 /nfs/dbraw/zinc/25/44/82/339254482.db2.gz PWEBIXIOXLPYJH-HNNXBMFYSA-N 1 2 315.244 4.054 20 0 DIADLO Fc1cncc(C[NH+]2Cc3ccccc3-c3ccccc3C2)c1 ZINC000468489615 339264083 /nfs/dbraw/zinc/26/40/83/339264083.db2.gz RUTFQPYESIMJEJ-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO COc1ccc([C@@H](C)[C@@H](C)[NH2+][C@@H](C(C)C)C(F)(F)F)cc1 ZINC000468797077 339270950 /nfs/dbraw/zinc/27/09/50/339270950.db2.gz CBHVRWHAJWIICI-ZOWXZIJZSA-N 1 2 303.368 4.364 20 0 DIADLO CC(C)[C@H]([NH2+]C1CCC(C(=O)OC(C)(C)C)CC1)C(F)(F)F ZINC000468793558 339270983 /nfs/dbraw/zinc/27/09/83/339270983.db2.gz BWJPBCLZUNFVDO-BPCQOVAHSA-N 1 2 323.399 4.063 20 0 DIADLO FC(F)Oc1ccc[nH+]c1NCc1ccccc1OCC1CC1 ZINC000469468475 339290637 /nfs/dbraw/zinc/29/06/37/339290637.db2.gz KJUASQWCHVMVIJ-UHFFFAOYSA-N 1 2 320.339 4.084 20 0 DIADLO C[N@H+](Cc1cc(-c2ccccc2)no1)Cc1nc2ccccc2o1 ZINC000469741285 339297438 /nfs/dbraw/zinc/29/74/38/339297438.db2.gz IXELTLKQMFMWCG-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccccc2)no1)Cc1nc2ccccc2o1 ZINC000469741285 339297439 /nfs/dbraw/zinc/29/74/39/339297439.db2.gz IXELTLKQMFMWCG-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1csc(C(C)C)n1)c1ccc(F)cc1 ZINC000469773054 339298603 /nfs/dbraw/zinc/29/86/03/339298603.db2.gz UKGLMNOJVJQIFP-WFASDCNBSA-N 1 2 322.449 4.444 20 0 DIADLO Brc1cccc(SCc2c[nH+]c3ccccn23)c1 ZINC000469808101 339301566 /nfs/dbraw/zinc/30/15/66/339301566.db2.gz JSVFXMGRYGXDQN-UHFFFAOYSA-N 1 2 319.227 4.389 20 0 DIADLO CC(C)(C)[C@@H]1CN(C(=O)c2ccc3[nH+]ccn3c2)c2ccccc21 ZINC000470308312 339316897 /nfs/dbraw/zinc/31/68/97/339316897.db2.gz LYLKWQVAJFDWKQ-MRXNPFEDSA-N 1 2 319.408 4.124 20 0 DIADLO FC(F)c1cccc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c1 ZINC000470718375 339325963 /nfs/dbraw/zinc/32/59/63/339325963.db2.gz RFJQNYWUZKLOFG-KRWDZBQOSA-N 1 2 303.352 4.198 20 0 DIADLO FC(F)c1cccc(C[N@H+]2CCO[C@H](c3ccccc3)C2)c1 ZINC000470718375 339325964 /nfs/dbraw/zinc/32/59/64/339325964.db2.gz RFJQNYWUZKLOFG-KRWDZBQOSA-N 1 2 303.352 4.198 20 0 DIADLO CC(C)[N@H+](CC(=O)OC(C)(C)C)Cc1cccc(C(F)F)c1 ZINC000470766034 339327198 /nfs/dbraw/zinc/32/71/98/339327198.db2.gz OZKQNLOYEAEOHD-UHFFFAOYSA-N 1 2 313.388 4.176 20 0 DIADLO CC(C)[N@@H+](CC(=O)OC(C)(C)C)Cc1cccc(C(F)F)c1 ZINC000470766034 339327199 /nfs/dbraw/zinc/32/71/99/339327199.db2.gz OZKQNLOYEAEOHD-UHFFFAOYSA-N 1 2 313.388 4.176 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cccc(C(F)F)c1)C(=O)OC(C)(C)C ZINC000470781723 339327929 /nfs/dbraw/zinc/32/79/29/339327929.db2.gz ZJMSTTLATWMAEZ-AWEZNQCLSA-N 1 2 313.388 4.080 20 0 DIADLO CC[C@H]1CN(c2cc[nH+]c(C3CC3)n2)CC[C@@H]1c1ccccc1 ZINC000470869348 339329667 /nfs/dbraw/zinc/32/96/67/339329667.db2.gz BDQUJYVEFWYYND-YJBOKZPZSA-N 1 2 307.441 4.374 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc(C3CCCCC3)cs2)C[C@H](C2CC2)O1 ZINC000470907593 339330855 /nfs/dbraw/zinc/33/08/55/339330855.db2.gz TYDUANDNRPHDFE-CXAGYDPISA-N 1 2 320.502 4.190 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc(C3CCCCC3)cs2)C[C@H](C2CC2)O1 ZINC000470907593 339330856 /nfs/dbraw/zinc/33/08/56/339330856.db2.gz TYDUANDNRPHDFE-CXAGYDPISA-N 1 2 320.502 4.190 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)n1 ZINC000470937940 339331749 /nfs/dbraw/zinc/33/17/49/339331749.db2.gz QSHQTMPPBUDVIC-SMDDNHRTSA-N 1 2 303.372 4.017 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)n1 ZINC000470937940 339331750 /nfs/dbraw/zinc/33/17/50/339331750.db2.gz QSHQTMPPBUDVIC-SMDDNHRTSA-N 1 2 303.372 4.017 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1coc(-c2cccs2)n1 ZINC000470942055 339331833 /nfs/dbraw/zinc/33/18/33/339331833.db2.gz AJFPCNIXPIJBBV-KOLCDFICSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1coc(-c2cccs2)n1 ZINC000470942055 339331834 /nfs/dbraw/zinc/33/18/34/339331834.db2.gz AJFPCNIXPIJBBV-KOLCDFICSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ncc(-c2cccs2)o1 ZINC000470953251 339332606 /nfs/dbraw/zinc/33/26/06/339332606.db2.gz MQRHMPNFCZNKLU-ZJUUUORDSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ncc(-c2cccs2)o1 ZINC000470953251 339332607 /nfs/dbraw/zinc/33/26/07/339332607.db2.gz MQRHMPNFCZNKLU-ZJUUUORDSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000470953595 339332733 /nfs/dbraw/zinc/33/27/33/339332733.db2.gz QNJAUGZJHSPYPG-GMTAPVOTSA-N 1 2 304.356 4.306 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000470953595 339332734 /nfs/dbraw/zinc/33/27/34/339332734.db2.gz QNJAUGZJHSPYPG-GMTAPVOTSA-N 1 2 304.356 4.306 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+](C)Cc2ccccc2SC)n1 ZINC000471016893 339334644 /nfs/dbraw/zinc/33/46/44/339334644.db2.gz FJMHEXYLWBUJPG-CYBMUJFWSA-N 1 2 319.474 4.327 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+](C)Cc2ccccc2SC)n1 ZINC000471016893 339334645 /nfs/dbraw/zinc/33/46/45/339334645.db2.gz FJMHEXYLWBUJPG-CYBMUJFWSA-N 1 2 319.474 4.327 20 0 DIADLO CSc1ccccc1C[N@H+](C)[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000471022849 339334781 /nfs/dbraw/zinc/33/47/81/339334781.db2.gz QKDTWSDKRWCLLO-LBPRGKRZSA-N 1 2 319.474 4.282 20 0 DIADLO CSc1ccccc1C[N@@H+](C)[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000471022849 339334782 /nfs/dbraw/zinc/33/47/82/339334782.db2.gz QKDTWSDKRWCLLO-LBPRGKRZSA-N 1 2 319.474 4.282 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1nc2ccc(F)cc2o1 ZINC000471029775 339334925 /nfs/dbraw/zinc/33/49/25/339334925.db2.gz QSFRZBYJACNLDU-UHFFFAOYSA-N 1 2 316.401 4.321 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1nc2ccc(F)cc2o1 ZINC000471029775 339334926 /nfs/dbraw/zinc/33/49/26/339334926.db2.gz QSFRZBYJACNLDU-UHFFFAOYSA-N 1 2 316.401 4.321 20 0 DIADLO O=C(C[N@@H+]1CCC12CCC2)Nc1ccccc1Oc1ccccc1 ZINC000471036031 339335141 /nfs/dbraw/zinc/33/51/41/339335141.db2.gz VBLYATHSISFRFH-UHFFFAOYSA-N 1 2 322.408 4.046 20 0 DIADLO O=C(C[N@H+]1CCC12CCC2)Nc1ccccc1Oc1ccccc1 ZINC000471036031 339335142 /nfs/dbraw/zinc/33/51/42/339335142.db2.gz VBLYATHSISFRFH-UHFFFAOYSA-N 1 2 322.408 4.046 20 0 DIADLO Fc1ccc(-c2nc(C[N@@H+]3CC[C@@H]3c3ccccc3)co2)cc1 ZINC000471169065 339339345 /nfs/dbraw/zinc/33/93/45/339339345.db2.gz NAXNDKPZHDAGFG-GOSISDBHSA-N 1 2 308.356 4.428 20 0 DIADLO Fc1ccc(-c2nc(C[N@H+]3CC[C@@H]3c3ccccc3)co2)cc1 ZINC000471169065 339339346 /nfs/dbraw/zinc/33/93/46/339339346.db2.gz NAXNDKPZHDAGFG-GOSISDBHSA-N 1 2 308.356 4.428 20 0 DIADLO COc1ccc(-c2cnc(C[N@@H+]3CC[C@H]3c3ccccc3)o2)cc1 ZINC000471176537 339339708 /nfs/dbraw/zinc/33/97/08/339339708.db2.gz JHBLBDGKWDHURK-SFHVURJKSA-N 1 2 320.392 4.297 20 0 DIADLO COc1ccc(-c2cnc(C[N@H+]3CC[C@H]3c3ccccc3)o2)cc1 ZINC000471176537 339339709 /nfs/dbraw/zinc/33/97/09/339339709.db2.gz JHBLBDGKWDHURK-SFHVURJKSA-N 1 2 320.392 4.297 20 0 DIADLO CN(Cc1ccc(Cl)cc1)c1cc(C(F)(F)F)cc[nH+]1 ZINC000471252706 339341199 /nfs/dbraw/zinc/34/11/99/339341199.db2.gz AQPJJZYLLBHHIF-UHFFFAOYSA-N 1 2 300.711 4.390 20 0 DIADLO Clc1cnc(CNc2ccc(-c3ccccc3)c[nH+]2)s1 ZINC000471458873 339345352 /nfs/dbraw/zinc/34/53/52/339345352.db2.gz KKAVXRKNBMHHQD-UHFFFAOYSA-N 1 2 301.802 4.471 20 0 DIADLO CCCOc1ccc(CNc2cccc[nH+]2)c(OC(F)F)c1 ZINC000471739561 339352798 /nfs/dbraw/zinc/35/27/98/339352798.db2.gz VCUGRDGUGBSCOF-UHFFFAOYSA-N 1 2 308.328 4.084 20 0 DIADLO CCCc1nc(C[N@H+](C)Cc2cc3ccccc3o2)cs1 ZINC000472282467 339368818 /nfs/dbraw/zinc/36/88/18/339368818.db2.gz OMYSMTPCTJVQJP-UHFFFAOYSA-N 1 2 300.427 4.474 20 0 DIADLO CCCc1nc(C[N@@H+](C)Cc2cc3ccccc3o2)cs1 ZINC000472282467 339368819 /nfs/dbraw/zinc/36/88/19/339368819.db2.gz OMYSMTPCTJVQJP-UHFFFAOYSA-N 1 2 300.427 4.474 20 0 DIADLO CCCCc1noc(C[N@@H+]2CC[C@H](C)[C@H]2c2cccc(F)c2)n1 ZINC000472312450 339369574 /nfs/dbraw/zinc/36/95/74/339369574.db2.gz DTXQMAQINVGADI-UGSOOPFHSA-N 1 2 317.408 4.134 20 0 DIADLO CCCCc1noc(C[N@H+]2CC[C@H](C)[C@H]2c2cccc(F)c2)n1 ZINC000472312450 339369575 /nfs/dbraw/zinc/36/95/75/339369575.db2.gz DTXQMAQINVGADI-UGSOOPFHSA-N 1 2 317.408 4.134 20 0 DIADLO Cc1ccc(-c2cccc(CNc3cccc(CO)[nH+]3)c2)cc1 ZINC000472577301 339374241 /nfs/dbraw/zinc/37/42/41/339374241.db2.gz BDCLBXNHCVWDJF-UHFFFAOYSA-N 1 2 304.393 4.161 20 0 DIADLO OCc1cccc(NCc2ccc(-c3cccc(F)c3)s2)[nH+]1 ZINC000472582701 339374357 /nfs/dbraw/zinc/37/43/57/339374357.db2.gz QONUDSZCYUARIS-UHFFFAOYSA-N 1 2 314.385 4.054 20 0 DIADLO Fc1ccc(SCC[N@@H+]2CCO[C@H](c3cccs3)C2)cc1 ZINC000472970446 339379658 /nfs/dbraw/zinc/37/96/58/339379658.db2.gz LCMJSQKREAKGKB-HNNXBMFYSA-N 1 2 323.458 4.053 20 0 DIADLO Fc1ccc(SCC[N@H+]2CCO[C@H](c3cccs3)C2)cc1 ZINC000472970446 339379659 /nfs/dbraw/zinc/37/96/59/339379659.db2.gz LCMJSQKREAKGKB-HNNXBMFYSA-N 1 2 323.458 4.053 20 0 DIADLO OCCC[N@H+](CC1CCC(C(F)(F)F)CC1)c1ccccc1 ZINC000473048375 339380568 /nfs/dbraw/zinc/38/05/68/339380568.db2.gz PWWQYNXMOAKAPY-UHFFFAOYSA-N 1 2 315.379 4.244 20 0 DIADLO OCCC[N@@H+](CC1CCC(C(F)(F)F)CC1)c1ccccc1 ZINC000473048375 339380569 /nfs/dbraw/zinc/38/05/69/339380569.db2.gz PWWQYNXMOAKAPY-UHFFFAOYSA-N 1 2 315.379 4.244 20 0 DIADLO C/C(=C/c1ccccc1)C[N@@H+]1CCSC[C@H]1c1nccs1 ZINC000473069466 339380831 /nfs/dbraw/zinc/38/08/31/339380831.db2.gz BNHKAOWKWVIJEY-QBOMHBFWSA-N 1 2 316.495 4.337 20 0 DIADLO C/C(=C/c1ccccc1)C[N@H+]1CCSC[C@H]1c1nccs1 ZINC000473069466 339380832 /nfs/dbraw/zinc/38/08/32/339380832.db2.gz BNHKAOWKWVIJEY-QBOMHBFWSA-N 1 2 316.495 4.337 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCSC[C@@H]2c2nccs2)cc1C ZINC000473060972 339380859 /nfs/dbraw/zinc/38/08/59/339380859.db2.gz WMALEQXUMHPNOP-MRXNPFEDSA-N 1 2 318.511 4.358 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCSC[C@@H]2c2nccs2)cc1C ZINC000473060972 339380860 /nfs/dbraw/zinc/38/08/60/339380860.db2.gz WMALEQXUMHPNOP-MRXNPFEDSA-N 1 2 318.511 4.358 20 0 DIADLO COc1cccc([C@@H]2C[C@@H](C)C[N@@H+]2Cc2ncc(Cl)s2)c1 ZINC000473125288 339381546 /nfs/dbraw/zinc/38/15/46/339381546.db2.gz HQRNIOXITYUEND-RISCZKNCSA-N 1 2 322.861 4.388 20 0 DIADLO COc1cccc([C@@H]2C[C@@H](C)C[N@H+]2Cc2ncc(Cl)s2)c1 ZINC000473125288 339381547 /nfs/dbraw/zinc/38/15/47/339381547.db2.gz HQRNIOXITYUEND-RISCZKNCSA-N 1 2 322.861 4.388 20 0 DIADLO CCn1nc(C[N@H+](C)[C@@H](C)c2ccccc2F)c2ccccc21 ZINC000473137889 339382112 /nfs/dbraw/zinc/38/21/12/339382112.db2.gz JLCIEBIZIPOXQT-AWEZNQCLSA-N 1 2 311.404 4.388 20 0 DIADLO CCn1nc(C[N@@H+](C)[C@@H](C)c2ccccc2F)c2ccccc21 ZINC000473137889 339382113 /nfs/dbraw/zinc/38/21/13/339382113.db2.gz JLCIEBIZIPOXQT-AWEZNQCLSA-N 1 2 311.404 4.388 20 0 DIADLO CCSc1cccc(C[N@@H+]2CCO[C@@H](c3ccsc3)C2)c1 ZINC000473140046 339382211 /nfs/dbraw/zinc/38/22/11/339382211.db2.gz ASIXDXUWRICTBV-QGZVFWFLSA-N 1 2 319.495 4.434 20 0 DIADLO CCSc1cccc(C[N@H+]2CCO[C@@H](c3ccsc3)C2)c1 ZINC000473140046 339382212 /nfs/dbraw/zinc/38/22/12/339382212.db2.gz ASIXDXUWRICTBV-QGZVFWFLSA-N 1 2 319.495 4.434 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CCCC[C@H]3c3ncc[nH]3)cc2c1C ZINC000473142772 339382523 /nfs/dbraw/zinc/38/25/23/339382523.db2.gz UECYETZBYGJJOG-SFHVURJKSA-N 1 2 308.429 4.235 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CCCC[C@H]3c3ncc[nH]3)cc2c1C ZINC000473142772 339382524 /nfs/dbraw/zinc/38/25/24/339382524.db2.gz UECYETZBYGJJOG-SFHVURJKSA-N 1 2 308.429 4.235 20 0 DIADLO COc1ccc2c(c1)CCC[C@H]2[N@H+](C)Cc1ncc(Cl)s1 ZINC000473148260 339383095 /nfs/dbraw/zinc/38/30/95/339383095.db2.gz ZIHRSUPFVVJWJH-CQSZACIVSA-N 1 2 322.861 4.315 20 0 DIADLO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)Cc1ncc(Cl)s1 ZINC000473148260 339383096 /nfs/dbraw/zinc/38/30/96/339383096.db2.gz ZIHRSUPFVVJWJH-CQSZACIVSA-N 1 2 322.861 4.315 20 0 DIADLO CCCc1sc(C(=O)N[C@H](c2[nH]cc[nH+]2)C(C)C)cc1CC ZINC000473305127 339384320 /nfs/dbraw/zinc/38/43/20/339384320.db2.gz WFWSUBFMOMINKK-HNNXBMFYSA-N 1 2 319.474 4.113 20 0 DIADLO C[C@@H](Nc1cc[nH+]c2ccncc12)c1cc2cccc(F)c2o1 ZINC000473911476 339394765 /nfs/dbraw/zinc/39/47/65/339394765.db2.gz OQINVZQPNMQNIH-LLVKDONJSA-N 1 2 307.328 4.110 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2cc3cccc(F)c3o2)cs1 ZINC000473992847 339396609 /nfs/dbraw/zinc/39/66/09/339396609.db2.gz FWTDVLYHFVEYFP-SNVBAGLBSA-N 1 2 304.390 4.442 20 0 DIADLO C[C@@H]([NH2+]c1ccc(-n2cccn2)cc1)C1CCC(F)(F)CC1 ZINC000474037547 339398230 /nfs/dbraw/zinc/39/82/30/339398230.db2.gz YQZGINKOZOOLNG-CYBMUJFWSA-N 1 2 305.372 4.498 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)c[nH+]1)C1CCC(F)(F)CC1 ZINC000474037148 339398291 /nfs/dbraw/zinc/39/82/91/339398291.db2.gz AXVQLWUBVKEBHD-CYBMUJFWSA-N 1 2 309.404 4.308 20 0 DIADLO Cc1nc(N2CC[C@@H](c3ccc(Cl)cc3)C2)c(C)c(C)[nH+]1 ZINC000474779488 339425712 /nfs/dbraw/zinc/42/57/12/339425712.db2.gz IUXIXJUUJFLGNB-OAHLLOKOSA-N 1 2 301.821 4.049 20 0 DIADLO CC(C)N(C)c1ccc(CN(C)c2ccc3cc[nH]c3c2)c[nH+]1 ZINC000475331054 339446938 /nfs/dbraw/zinc/44/69/38/339446938.db2.gz GSQONKMJWWFVLM-UHFFFAOYSA-N 1 2 308.429 4.044 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCC(=O)NC(C)(C)CC(C)(C)C ZINC000475485296 339452107 /nfs/dbraw/zinc/45/21/07/339452107.db2.gz GJVYZTBALIRREM-UHFFFAOYSA-N 1 2 315.461 4.066 20 0 DIADLO Cc1cc(C)cc(C[NH2+][C@@H](CO)c2c(Cl)cccc2Cl)c1 ZINC000475626877 339457536 /nfs/dbraw/zinc/45/75/36/339457536.db2.gz RPCVMODNAXQBTF-INIZCTEOSA-N 1 2 324.251 4.433 20 0 DIADLO CCc1ccccc1CC(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000477991240 339506827 /nfs/dbraw/zinc/50/68/27/339506827.db2.gz RGLJGEYSPJKPPE-UHFFFAOYSA-N 1 2 319.408 4.129 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cccc(C)c1F ZINC000478017998 339507195 /nfs/dbraw/zinc/50/71/95/339507195.db2.gz PKTWYVLYXLWKCL-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO CCCOc1cccc2c(NCCCc3c[nH]nc3C)cc[nH+]c12 ZINC000478257911 339511723 /nfs/dbraw/zinc/51/17/23/339511723.db2.gz SHPOKVPQCMPQHC-UHFFFAOYSA-N 1 2 324.428 4.100 20 0 DIADLO CC(C)(C)c1cnc(SCc2ccc(-n3cc[nH+]c3)cc2)o1 ZINC000478715814 339521056 /nfs/dbraw/zinc/52/10/56/339521056.db2.gz KCAQFTHHSOYCBU-UHFFFAOYSA-N 1 2 313.426 4.450 20 0 DIADLO CCc1nc(C[NH2+][C@@H](c2cc(F)ccc2F)C(C)C)cs1 ZINC000479074777 339527074 /nfs/dbraw/zinc/52/70/74/339527074.db2.gz AUBPGCVJEHHFJR-MRXNPFEDSA-N 1 2 310.413 4.471 20 0 DIADLO CCc1nc(C[NH2+][C@H](c2cc(F)ccc2F)C(C)C)cs1 ZINC000479074776 339527125 /nfs/dbraw/zinc/52/71/25/339527125.db2.gz AUBPGCVJEHHFJR-INIZCTEOSA-N 1 2 310.413 4.471 20 0 DIADLO Fc1cccc2ncnc(Nc3ccc(NC4CCCC4)[nH+]c3)c12 ZINC000480483037 339574631 /nfs/dbraw/zinc/57/46/31/339574631.db2.gz MDCHTJVMGLSOTQ-UHFFFAOYSA-N 1 2 323.375 4.262 20 0 DIADLO CCc1c[nH+]ccc1[C@H](C)C1CCN(c2nc(C)cs2)CC1 ZINC000498418439 339578527 /nfs/dbraw/zinc/57/85/27/339578527.db2.gz ZCLYUGMPSUUDGQ-CQSZACIVSA-N 1 2 315.486 4.429 20 0 DIADLO Cc1cc(N2C[C@H](C)C[C@H]2c2ccc(C(F)(F)F)cc2)nc[nH+]1 ZINC000482098734 339622983 /nfs/dbraw/zinc/62/29/83/339622983.db2.gz LZXQJXLTOWBKGT-ABAIWWIYSA-N 1 2 321.346 4.391 20 0 DIADLO O=C(c1ccc2[nH+]ccn2c1)N(c1ccccc1)C1CCCCC1 ZINC000483324897 339661862 /nfs/dbraw/zinc/66/18/62/339661862.db2.gz LXDCSZIZJHQNBD-UHFFFAOYSA-N 1 2 319.408 4.314 20 0 DIADLO CC(C)N(C(=O)c1ccc2[nH+]ccn2c1)c1ccc(Cl)cc1 ZINC000483499018 339667294 /nfs/dbraw/zinc/66/72/94/339667294.db2.gz YKCHUUUJIAEHTC-UHFFFAOYSA-N 1 2 313.788 4.043 20 0 DIADLO Cc1cc([C@@H]2CCCN2c2cccc[nH+]2)ccc1Br ZINC000485402646 339702706 /nfs/dbraw/zinc/70/27/06/339702706.db2.gz HPZMHWFJKNCAKU-HNNXBMFYSA-N 1 2 317.230 4.494 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CC(C)(C)c2ccccc21 ZINC000485481813 339704253 /nfs/dbraw/zinc/70/42/53/339704253.db2.gz OWMWRGVGHOZHKF-INIZCTEOSA-N 1 2 309.413 4.243 20 0 DIADLO Cc1ccccc1-c1nc(C(=O)Nc2c(C)cc[nH+]c2C)cs1 ZINC000485489742 339704269 /nfs/dbraw/zinc/70/42/69/339704269.db2.gz KGVNXNNFVQCQBK-UHFFFAOYSA-N 1 2 323.421 4.383 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CCC[C@@H](C(C)C)CC1 ZINC000485628687 339707619 /nfs/dbraw/zinc/70/76/19/339707619.db2.gz HJANYQYAQYSNPS-CVEARBPZSA-N 1 2 303.450 4.425 20 0 DIADLO Cc1ccc(C[C@H](C)NC(=O)Nc2c(C)cc[nH+]c2C)c(C)c1 ZINC000485626530 339707632 /nfs/dbraw/zinc/70/76/32/339707632.db2.gz BXXHSUPHVXMYHW-HNNXBMFYSA-N 1 2 311.429 4.068 20 0 DIADLO Cc1cc(Br)cc(NCc2cccc3[nH+]ccn32)c1 ZINC000485706541 339710339 /nfs/dbraw/zinc/71/03/39/339710339.db2.gz CQMBZVOHKQJOHM-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2cc(F)cc(Cl)c2)o1 ZINC000485724605 339711327 /nfs/dbraw/zinc/71/13/27/339711327.db2.gz ZLYSKVWTWGKYAH-HNNXBMFYSA-N 1 2 311.784 4.112 20 0 DIADLO c1ccc(CC2CCN(c3cc[nH+]c4ccncc43)CC2)cc1 ZINC000486491825 339728439 /nfs/dbraw/zinc/72/84/39/339728439.db2.gz CDURMYGZYZEERK-UHFFFAOYSA-N 1 2 303.409 4.089 20 0 DIADLO CCOc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)cc1F ZINC000486944837 339739269 /nfs/dbraw/zinc/73/92/69/339739269.db2.gz ZNHJJNCBUWQSJE-UHFFFAOYSA-N 1 2 311.360 4.022 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@@H](C)c2ccc(F)c3ccccc32)n1 ZINC000488007122 339768187 /nfs/dbraw/zinc/76/81/87/339768187.db2.gz ODQWJZXDKJKJGC-RYUDHWBXSA-N 1 2 313.376 4.336 20 0 DIADLO C[C@]12CCN(c3cc[nH+]c4c(Cl)cccc34)C[C@H]1C2(F)F ZINC000488466430 339784181 /nfs/dbraw/zinc/78/41/81/339784181.db2.gz QDMINPZORBOTBD-HIFRSBDPSA-N 1 2 308.759 4.370 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)C=CCc1ccc(C(C)C)cc1 ZINC000489983220 339822969 /nfs/dbraw/zinc/82/29/69/339822969.db2.gz RGXMUYQUJXHUIY-AATRIKPKSA-N 1 2 308.425 4.231 20 0 DIADLO CN(C(=O)c1cccc(Oc2cc[nH+]cc2)c1)C1(C)CCCC1 ZINC000490656304 339836654 /nfs/dbraw/zinc/83/66/54/339836654.db2.gz PTPBXCLHBLKMSR-UHFFFAOYSA-N 1 2 310.397 4.279 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccc(F)cn1 ZINC000491060107 339847379 /nfs/dbraw/zinc/84/73/79/339847379.db2.gz MQQIXOOFIOYQIY-GFCCVEGCSA-N 1 2 307.438 4.216 20 0 DIADLO CN(Cc1cccc2[nH]ccc21)c1[nH+]ccc2ccc(F)cc21 ZINC000493637208 339930052 /nfs/dbraw/zinc/93/00/52/339930052.db2.gz WGMROXILXHCKHC-UHFFFAOYSA-N 1 2 305.356 4.492 20 0 DIADLO CC[C@@H](C)Sc1ccc(NC(=O)/C=C/c2[nH]cc[nH+]2)c(C)c1 ZINC000493836671 339934623 /nfs/dbraw/zinc/93/46/23/339934623.db2.gz MYZHYBGQXNKUOH-SBDDDAINSA-N 1 2 315.442 4.261 20 0 DIADLO CCCc1csc(C[NH2+][C@@H](c2ccccc2)c2ccncc2)n1 ZINC000494020636 339939185 /nfs/dbraw/zinc/93/91/85/339939185.db2.gz ZHDZAIJYKPUJHH-IBGZPJMESA-N 1 2 323.465 4.370 20 0 DIADLO CCCc1csc(CNc2cccc(-c3[nH+]ccn3C)c2)n1 ZINC000494193230 339943349 /nfs/dbraw/zinc/94/33/49/339943349.db2.gz XRYCWMYROVFOQA-UHFFFAOYSA-N 1 2 312.442 4.108 20 0 DIADLO C[C@@H]1CCC[C@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)[C@H]1C ZINC000494699019 339958019 /nfs/dbraw/zinc/95/80/19/339958019.db2.gz YIDOYPFLGUJGEX-VCBZYWHSSA-N 1 2 324.424 4.428 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCC(=O)N[C@@H](C)CCC(C)(C)C ZINC000498641678 340021428 /nfs/dbraw/zinc/02/14/28/340021428.db2.gz YNEWGGMZTQIGEO-AWEZNQCLSA-N 1 2 315.461 4.066 20 0 DIADLO CC[C@@H](C(=O)NCCC[N@H+](CC)c1ccccc1)c1ccccc1 ZINC000498698882 340021790 /nfs/dbraw/zinc/02/17/90/340021790.db2.gz DJCUQLYHIDGOOD-HXUWFJFHSA-N 1 2 324.468 4.213 20 0 DIADLO CC[C@@H](C(=O)NCCC[N@@H+](CC)c1ccccc1)c1ccccc1 ZINC000498698882 340021791 /nfs/dbraw/zinc/02/17/91/340021791.db2.gz DJCUQLYHIDGOOD-HXUWFJFHSA-N 1 2 324.468 4.213 20 0 DIADLO Cc1cc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)ccc1O ZINC000499864079 340046137 /nfs/dbraw/zinc/04/61/37/340046137.db2.gz RHWLQZVMQMCOAO-UHFFFAOYSA-N 1 2 320.348 4.140 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cc(C)c(C)cc2OC(F)F)o1 ZINC000500363117 340055704 /nfs/dbraw/zinc/05/57/04/340055704.db2.gz QJVXKEYJIGJKPO-LBPRGKRZSA-N 1 2 310.344 4.052 20 0 DIADLO CC(C)OC[C@@H](C)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000500424663 340058130 /nfs/dbraw/zinc/05/81/30/340058130.db2.gz LWCTVIPIDGVDOB-OAHLLOKOSA-N 1 2 313.445 4.112 20 0 DIADLO CC(C)OC[C@@H](C)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000500443531 340058936 /nfs/dbraw/zinc/05/89/36/340058936.db2.gz ZCWOXWKICIIQPC-OAHLLOKOSA-N 1 2 313.445 4.112 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1cc2sc3ccccc3c2s1 ZINC000501174065 340075574 /nfs/dbraw/zinc/07/55/74/340075574.db2.gz VMEMIEGXUGAKRI-UHFFFAOYSA-N 1 2 324.430 4.494 20 0 DIADLO c1ccc2c(c1)cccc2CNc1cc(N2CCCCC2)nc[nH+]1 ZINC000501222308 340076503 /nfs/dbraw/zinc/07/65/03/340076503.db2.gz RRYKFXRLNCUCAD-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO c1ccc2c(c1)cccc2CNc1cc(N2CCCCC2)[nH+]cn1 ZINC000501222308 340076504 /nfs/dbraw/zinc/07/65/04/340076504.db2.gz RRYKFXRLNCUCAD-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000501397449 340080045 /nfs/dbraw/zinc/08/00/45/340080045.db2.gz XCGHFIWAHXNMHV-OAHLLOKOSA-N 1 2 310.825 4.397 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000501397449 340080046 /nfs/dbraw/zinc/08/00/46/340080046.db2.gz XCGHFIWAHXNMHV-OAHLLOKOSA-N 1 2 310.825 4.397 20 0 DIADLO CCc1nc(C2([NH2+]C/C(C)=C\c3ccccc3)CCCC2)no1 ZINC000501429338 340080781 /nfs/dbraw/zinc/08/07/81/340080781.db2.gz XYZGGZDRIYEBKJ-SQFISAMPSA-N 1 2 311.429 4.094 20 0 DIADLO CSCC(C)(C)C(=O)Nc1ccc2[nH]c(C(C)(C)C)[nH+]c2c1 ZINC000501558084 340083582 /nfs/dbraw/zinc/08/35/82/340083582.db2.gz BHXABSGVQAIBAB-UHFFFAOYSA-N 1 2 319.474 4.188 20 0 DIADLO CCCOc1cccc2c(N[C@H]3CCO[C@H](C)C3)cc[nH+]c12 ZINC000502007362 340092780 /nfs/dbraw/zinc/09/27/80/340092780.db2.gz WSUULKAEFYBBSR-KGLIPLIRSA-N 1 2 300.402 4.003 20 0 DIADLO CCCOc1cccc2c(N[C@@H]3CCO[C@@H](C)C3)cc[nH+]c12 ZINC000502007363 340092801 /nfs/dbraw/zinc/09/28/01/340092801.db2.gz WSUULKAEFYBBSR-UONOGXRCSA-N 1 2 300.402 4.003 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1F)c1nc2c(s1)CCC2 ZINC000502017759 340092978 /nfs/dbraw/zinc/09/29/78/340092978.db2.gz ODMREHKHXGGUCV-VHSXEESVSA-N 1 2 308.397 4.322 20 0 DIADLO CC[N@H+](CC(=O)Nc1cscc1C)Cc1ccccc1Cl ZINC000502093278 340095113 /nfs/dbraw/zinc/09/51/13/340095113.db2.gz BUJXSJWFGLSTBS-UHFFFAOYSA-N 1 2 322.861 4.171 20 0 DIADLO CC[N@@H+](CC(=O)Nc1cscc1C)Cc1ccccc1Cl ZINC000502093278 340095114 /nfs/dbraw/zinc/09/51/14/340095114.db2.gz BUJXSJWFGLSTBS-UHFFFAOYSA-N 1 2 322.861 4.171 20 0 DIADLO c1cnn(-c2ccc([NH2+][C@@H]3CCC[C@H](c4cccnc4)C3)cc2)c1 ZINC000502238773 340097458 /nfs/dbraw/zinc/09/74/58/340097458.db2.gz CHLNRFWYUMUZFE-QFBILLFUSA-N 1 2 318.424 4.406 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)oc1C ZINC000502443810 340103731 /nfs/dbraw/zinc/10/37/31/340103731.db2.gz KNSMXRZNTCPRNP-MRVPVSSYSA-N 1 2 301.283 4.304 20 0 DIADLO COCC[C@H]1CCC[C@@H]1Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000502463962 340104747 /nfs/dbraw/zinc/10/47/47/340104747.db2.gz QZRUWSOSKFBKLN-CJNGLKHVSA-N 1 2 319.836 4.143 20 0 DIADLO COCC[C@@H]1CCC[C@H]1Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000502463964 340104809 /nfs/dbraw/zinc/10/48/09/340104809.db2.gz QZRUWSOSKFBKLN-XJKSGUPXSA-N 1 2 319.836 4.143 20 0 DIADLO Cc1cc(N2CCSCC2)ccc1[NH2+][C@@H]1CCC12CCC2 ZINC000502478955 340105453 /nfs/dbraw/zinc/10/54/53/340105453.db2.gz XIZPRTCHBZOJCO-QGZVFWFLSA-N 1 2 302.487 4.293 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)C)no1 ZINC000502546157 340107336 /nfs/dbraw/zinc/10/73/36/340107336.db2.gz ZEPXNGYKAXJGHB-QGZVFWFLSA-N 1 2 305.397 4.038 20 0 DIADLO CCCCc1nc(C[NH2+][C@]2(c3cccc(C)c3)C[C@H]2CC)no1 ZINC000502552498 340107645 /nfs/dbraw/zinc/10/76/45/340107645.db2.gz QGEOPMROGPMNRW-DNVCBOLYSA-N 1 2 313.445 4.136 20 0 DIADLO CC[C@H]1C[C@@]1([NH2+]Cc1nc(-c2ccco2)no1)c1cccc(C)c1 ZINC000502590847 340108670 /nfs/dbraw/zinc/10/86/70/340108670.db2.gz HVSKHBSDVQQSKU-LIRRHRJNSA-N 1 2 323.396 4.053 20 0 DIADLO Cc1ccc(CCCC(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000502752886 340112935 /nfs/dbraw/zinc/11/29/35/340112935.db2.gz ILASWLSDVMBZLO-UHFFFAOYSA-N 1 2 319.408 4.347 20 0 DIADLO FC(F)[C@@H]1CCCC[N@@H+]1Cc1ccc(OCC(F)(F)F)cc1 ZINC000502787137 340113488 /nfs/dbraw/zinc/11/34/88/340113488.db2.gz AQKCKEABUOSGTF-ZDUSSCGKSA-N 1 2 323.305 4.247 20 0 DIADLO FC(F)[C@@H]1CCCC[N@H+]1Cc1ccc(OCC(F)(F)F)cc1 ZINC000502787137 340113489 /nfs/dbraw/zinc/11/34/89/340113489.db2.gz AQKCKEABUOSGTF-ZDUSSCGKSA-N 1 2 323.305 4.247 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+]([C@H](C)c2nc(C(C)C)no2)C1 ZINC000502893865 340115806 /nfs/dbraw/zinc/11/58/06/340115806.db2.gz SRHSBEHKUGSWHW-RDTXWAMCSA-N 1 2 317.408 4.133 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+]([C@H](C)c2nc(C(C)C)no2)C1 ZINC000502893865 340115807 /nfs/dbraw/zinc/11/58/07/340115807.db2.gz SRHSBEHKUGSWHW-RDTXWAMCSA-N 1 2 317.408 4.133 20 0 DIADLO CCc1noc(C)c1C[N@@H+]1CC[C@@](F)(c2cc(C)cc(F)c2)C1 ZINC000502943582 340117252 /nfs/dbraw/zinc/11/72/52/340117252.db2.gz JMDXADYECARGCD-SFHVURJKSA-N 1 2 320.383 4.064 20 0 DIADLO CCc1noc(C)c1C[N@H+]1CC[C@@](F)(c2cc(C)cc(F)c2)C1 ZINC000502943582 340117253 /nfs/dbraw/zinc/11/72/53/340117253.db2.gz JMDXADYECARGCD-SFHVURJKSA-N 1 2 320.383 4.064 20 0 DIADLO Cc1cc(NC(=O)[C@H]2CC=CCC2)c[nH+]c1N1CCCC[C@H]1C ZINC000503185271 340122906 /nfs/dbraw/zinc/12/29/06/340122906.db2.gz QWJHZAGJTVVXDO-CVEARBPZSA-N 1 2 313.445 4.064 20 0 DIADLO Cc1cc(NC(=O)[C@H]2CC=CCC2)c[nH+]c1N1CCCC[C@@H]1C ZINC000503185272 340122949 /nfs/dbraw/zinc/12/29/49/340122949.db2.gz QWJHZAGJTVVXDO-HOTGVXAUSA-N 1 2 313.445 4.064 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3cc(-c4ccccc4)on3)CC2)c1 ZINC000503207622 340123236 /nfs/dbraw/zinc/12/32/36/340123236.db2.gz LWEDZKFNSROVKD-UHFFFAOYSA-N 1 2 308.356 4.260 20 0 DIADLO CC[N@H+](CC(=O)OC(C)(C)C)[C@@H](C)c1cc2ccccc2o1 ZINC000513417591 340124864 /nfs/dbraw/zinc/12/48/64/340124864.db2.gz WXJIICISGXNSTQ-ZDUSSCGKSA-N 1 2 303.402 4.157 20 0 DIADLO CC[N@@H+](CC(=O)OC(C)(C)C)[C@@H](C)c1cc2ccccc2o1 ZINC000513417591 340124865 /nfs/dbraw/zinc/12/48/65/340124865.db2.gz WXJIICISGXNSTQ-ZDUSSCGKSA-N 1 2 303.402 4.157 20 0 DIADLO Fc1ccc2cc[nH+]c(N3CC[C@@H](COc4ccccc4)C3)c2c1 ZINC000503306213 340125039 /nfs/dbraw/zinc/12/50/39/340125039.db2.gz YCVITWSGCCQSRS-OAHLLOKOSA-N 1 2 322.383 4.279 20 0 DIADLO CCCCc1noc(C[NH2+][C@]2(c3ccc(Cl)cc3)C[C@@H]2C)n1 ZINC000503390157 340127103 /nfs/dbraw/zinc/12/71/03/340127103.db2.gz JCRAPXXERKALRM-YVEFUNNKSA-N 1 2 319.836 4.091 20 0 DIADLO CCCCc1noc(C[NH2+][C@]2(c3ccc(Cl)cc3)C[C@H]2C)n1 ZINC000503390156 340127123 /nfs/dbraw/zinc/12/71/23/340127123.db2.gz JCRAPXXERKALRM-SJKOYZFVSA-N 1 2 319.836 4.091 20 0 DIADLO Cc1cc(C[NH2+]Cc2nnc(C(C)(C)C)s2)ccc1Cl ZINC000503574815 340131264 /nfs/dbraw/zinc/13/12/64/340131264.db2.gz VOYXBWBWMYNQCE-UHFFFAOYSA-N 1 2 309.866 4.087 20 0 DIADLO C/C(=C\c1ccccc1C(F)(F)F)C[N@@H+](C)Cc1ccon1 ZINC000503884270 340135662 /nfs/dbraw/zinc/13/56/62/340135662.db2.gz HCBZQFNIRWVHMU-FMIVXFBMSA-N 1 2 310.319 4.229 20 0 DIADLO C/C(=C\c1ccccc1C(F)(F)F)C[N@H+](C)Cc1ccon1 ZINC000503884270 340135663 /nfs/dbraw/zinc/13/56/63/340135663.db2.gz HCBZQFNIRWVHMU-FMIVXFBMSA-N 1 2 310.319 4.229 20 0 DIADLO CC[C@@H]([NH2+]C1(C(F)F)CC1)c1cc(F)cc(Br)c1 ZINC000503887625 340135810 /nfs/dbraw/zinc/13/58/10/340135810.db2.gz RLQBVWWPJRXDMI-LLVKDONJSA-N 1 2 322.168 4.427 20 0 DIADLO C[C@@H](Nc1cccc(OCCc2ccccc2)c1)c1[nH+]ccn1C ZINC000503937115 340137610 /nfs/dbraw/zinc/13/76/10/340137610.db2.gz KYHQSCOXXDXCER-MRXNPFEDSA-N 1 2 321.424 4.215 20 0 DIADLO Cc1ccccc1[C@H](NC(=O)Nc1cc[nH+]cc1C)C(C)(C)C ZINC000504150800 340141738 /nfs/dbraw/zinc/14/17/38/340141738.db2.gz KPPHTZWKYKOYFG-KRWDZBQOSA-N 1 2 311.429 4.029 20 0 DIADLO CCC(CC)[C@H](NC(=O)Nc1cc[nH+]cc1C)c1cccs1 ZINC000504155646 340141952 /nfs/dbraw/zinc/14/19/52/340141952.db2.gz GZPVVBGXVGJXBV-INIZCTEOSA-N 1 2 317.458 4.172 20 0 DIADLO Cc1cccc([C@H](NC(=O)Nc2cc[nH+]cc2C)C(C)(C)C)c1 ZINC000504167073 340142345 /nfs/dbraw/zinc/14/23/45/340142345.db2.gz BHAQAOIYCNCDJJ-KRWDZBQOSA-N 1 2 311.429 4.029 20 0 DIADLO CC(C)(C)C1CC(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000504838774 340153446 /nfs/dbraw/zinc/15/34/46/340153446.db2.gz NULXTLLYKGLUNO-UHFFFAOYSA-N 1 2 324.424 4.428 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](c2ccc(CCC)cc2)C(C)C)no1 ZINC000505576391 340171377 /nfs/dbraw/zinc/17/13/77/340171377.db2.gz IJCQNWSNUNYCIU-LJQANCHMSA-N 1 2 315.461 4.462 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+]3CCn4cccc4[C@H]3C)s2)cc1 ZINC000505630512 340173435 /nfs/dbraw/zinc/17/34/35/340173435.db2.gz BSVUPXHIAUQGQC-OAHLLOKOSA-N 1 2 323.465 4.497 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+]3CCn4cccc4[C@H]3C)s2)cc1 ZINC000505630512 340173436 /nfs/dbraw/zinc/17/34/36/340173436.db2.gz BSVUPXHIAUQGQC-OAHLLOKOSA-N 1 2 323.465 4.497 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ccccc2F)c1OC(C)C ZINC000505628730 340173440 /nfs/dbraw/zinc/17/34/40/340173440.db2.gz ATOFMCZEUHHSQP-UHFFFAOYSA-N 1 2 317.404 4.254 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ccccc2F)c1OC(C)C ZINC000505628730 340173441 /nfs/dbraw/zinc/17/34/41/340173441.db2.gz ATOFMCZEUHHSQP-UHFFFAOYSA-N 1 2 317.404 4.254 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2nc(-c3ccccc3)cs2)c1 ZINC000505662262 340174680 /nfs/dbraw/zinc/17/46/80/340174680.db2.gz MAENVESZKQKRPR-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2nc(-c3ccccc3)cs2)c1 ZINC000505662262 340174681 /nfs/dbraw/zinc/17/46/81/340174681.db2.gz MAENVESZKQKRPR-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO CCCCc1noc(C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)n1 ZINC000505830309 340178975 /nfs/dbraw/zinc/17/89/75/340178975.db2.gz FTWRCUISYVTXLL-GZKZCVOOSA-N 1 2 311.429 4.090 20 0 DIADLO CCCCc1noc(C[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)n1 ZINC000505830309 340178976 /nfs/dbraw/zinc/17/89/76/340178976.db2.gz FTWRCUISYVTXLL-GZKZCVOOSA-N 1 2 311.429 4.090 20 0 DIADLO CCCCc1oc2ccccc2c1C[N@H+](C)Cc1ccn(C)n1 ZINC000506055221 340184567 /nfs/dbraw/zinc/18/45/67/340184567.db2.gz IOVLTIBPPPWSJB-UHFFFAOYSA-N 1 2 311.429 4.141 20 0 DIADLO CCCCc1oc2ccccc2c1C[N@@H+](C)Cc1ccn(C)n1 ZINC000506055221 340184568 /nfs/dbraw/zinc/18/45/68/340184568.db2.gz IOVLTIBPPPWSJB-UHFFFAOYSA-N 1 2 311.429 4.141 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)Cc2ccco2)cc1Cl ZINC000506070547 340184893 /nfs/dbraw/zinc/18/48/93/340184893.db2.gz IJIOVNHZCMFKEX-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)Cc2ccco2)cc1Cl ZINC000506070547 340184894 /nfs/dbraw/zinc/18/48/94/340184894.db2.gz IJIOVNHZCMFKEX-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO c1coc(C[NH+](Cc2ccco2)CC2=Cc3ccccc3OC2)c1 ZINC000506086899 340185132 /nfs/dbraw/zinc/18/51/32/340185132.db2.gz PIMGHMPBRZSDKF-UHFFFAOYSA-N 1 2 321.376 4.351 20 0 DIADLO C[N@H+](Cc1ccco1)Cc1cc(Br)ccc1Cl ZINC000506112345 340185921 /nfs/dbraw/zinc/18/59/21/340185921.db2.gz HQDVYOJQFWSKDJ-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO C[N@@H+](Cc1ccco1)Cc1cc(Br)ccc1Cl ZINC000506112345 340185922 /nfs/dbraw/zinc/18/59/22/340185922.db2.gz HQDVYOJQFWSKDJ-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2ccc(Br)o2)c1 ZINC000506216466 340188926 /nfs/dbraw/zinc/18/89/26/340188926.db2.gz ARPGTJQNWGLLKF-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2ccc(Br)o2)c1 ZINC000506216466 340188927 /nfs/dbraw/zinc/18/89/27/340188927.db2.gz ARPGTJQNWGLLKF-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO C[N@H+](Cc1cc(F)c(F)c(F)c1)Cc1ccc(F)cc1F ZINC000506354380 340192997 /nfs/dbraw/zinc/19/29/97/340192997.db2.gz WBUVGWIHNXGFJS-UHFFFAOYSA-N 1 2 301.258 4.014 20 0 DIADLO C[N@@H+](Cc1cc(F)c(F)c(F)c1)Cc1ccc(F)cc1F ZINC000506354380 340192998 /nfs/dbraw/zinc/19/29/98/340192998.db2.gz WBUVGWIHNXGFJS-UHFFFAOYSA-N 1 2 301.258 4.014 20 0 DIADLO FC(F)(F)c1cccc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c1 ZINC000506357579 340193191 /nfs/dbraw/zinc/19/31/91/340193191.db2.gz STAGGFSZCPABQB-KRWDZBQOSA-N 1 2 321.342 4.279 20 0 DIADLO FC(F)(F)c1cccc(C[N@H+]2CCO[C@H](c3ccccc3)C2)c1 ZINC000506357579 340193192 /nfs/dbraw/zinc/19/31/92/340193192.db2.gz STAGGFSZCPABQB-KRWDZBQOSA-N 1 2 321.342 4.279 20 0 DIADLO Cc1cc(N(C)CCC2CCCCC2)nc(-c2cccnc2)[nH+]1 ZINC000506767505 340201254 /nfs/dbraw/zinc/20/12/54/340201254.db2.gz LTTQEYVODFKWCZ-UHFFFAOYSA-N 1 2 310.445 4.254 20 0 DIADLO Oc1cccc(C[N@H+](Cc2ccc(F)cc2)C2CC2)c1Cl ZINC000506808817 340202226 /nfs/dbraw/zinc/20/22/26/340202226.db2.gz YYQISZIGMZSHMG-UHFFFAOYSA-N 1 2 305.780 4.349 20 0 DIADLO Oc1cccc(C[N@@H+](Cc2ccc(F)cc2)C2CC2)c1Cl ZINC000506808817 340202227 /nfs/dbraw/zinc/20/22/27/340202227.db2.gz YYQISZIGMZSHMG-UHFFFAOYSA-N 1 2 305.780 4.349 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)s1 ZINC000507079778 340206719 /nfs/dbraw/zinc/20/67/19/340206719.db2.gz ZKBSVZCJFVLBIF-HNNXBMFYSA-N 1 2 322.474 4.482 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)s1 ZINC000507079778 340206720 /nfs/dbraw/zinc/20/67/20/340206720.db2.gz ZKBSVZCJFVLBIF-HNNXBMFYSA-N 1 2 322.474 4.482 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@H+](C)Cc1cccc(O)c1 ZINC000507229526 340214317 /nfs/dbraw/zinc/21/43/17/340214317.db2.gz MNWKNMOKCAJUKF-LBPRGKRZSA-N 1 2 320.230 4.348 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@@H+](C)Cc1cccc(O)c1 ZINC000507229526 340214318 /nfs/dbraw/zinc/21/43/18/340214318.db2.gz MNWKNMOKCAJUKF-LBPRGKRZSA-N 1 2 320.230 4.348 20 0 DIADLO Cc1ccc2[nH+]cc(CN(C)[C@@H](C)c3cc(F)ccc3F)n2c1 ZINC000507223417 340214512 /nfs/dbraw/zinc/21/45/12/340214512.db2.gz ZZZWTDJVFPWODC-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1ccc2ncc(C[N@@H+](C)[C@@H](C)c3cc(F)ccc3F)n2c1 ZINC000507223417 340214513 /nfs/dbraw/zinc/21/45/13/340214513.db2.gz ZZZWTDJVFPWODC-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1ccc2ncc(C[N@H+](C)[C@@H](C)c3cc(F)ccc3F)n2c1 ZINC000507223417 340214514 /nfs/dbraw/zinc/21/45/14/340214514.db2.gz ZZZWTDJVFPWODC-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc2n[nH]cc2c1)c1ncc(C(C)(C)C)o1 ZINC000507232587 340214954 /nfs/dbraw/zinc/21/49/54/340214954.db2.gz OFHNKEAUUNFYHK-VXGBXAGGSA-N 1 2 312.417 4.260 20 0 DIADLO CC(C)c1nc(C[N@H+](C)Cc2ccccc2-c2ccccc2)no1 ZINC000507244541 340215248 /nfs/dbraw/zinc/21/52/48/340215248.db2.gz WYGZSCMDSWNPHS-UHFFFAOYSA-N 1 2 321.424 4.492 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)Cc2ccccc2-c2ccccc2)no1 ZINC000507244541 340215249 /nfs/dbraw/zinc/21/52/49/340215249.db2.gz WYGZSCMDSWNPHS-UHFFFAOYSA-N 1 2 321.424 4.492 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+](C)Cc1ccc2c(c1)CCO2 ZINC000507247498 340215516 /nfs/dbraw/zinc/21/55/16/340215516.db2.gz OPDDLQWBVQGTIK-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccc2c(c1)CCO2 ZINC000507247498 340215517 /nfs/dbraw/zinc/21/55/17/340215517.db2.gz OPDDLQWBVQGTIK-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO CC[N@H+](Cc1ccc(OC)c(F)c1)Cc1c(F)cccc1F ZINC000507271764 340216346 /nfs/dbraw/zinc/21/63/46/340216346.db2.gz CRXMAYQKXCZYQU-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)c(F)c1)Cc1c(F)cccc1F ZINC000507271764 340216347 /nfs/dbraw/zinc/21/63/47/340216347.db2.gz CRXMAYQKXCZYQU-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO COc1ccsc1C[N@@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000507352189 340217695 /nfs/dbraw/zinc/21/76/95/340217695.db2.gz ILQHBEGTEWOAJT-LJQANCHMSA-N 1 2 324.449 4.163 20 0 DIADLO COc1ccsc1C[N@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000507352189 340217696 /nfs/dbraw/zinc/21/76/96/340217696.db2.gz ILQHBEGTEWOAJT-LJQANCHMSA-N 1 2 324.449 4.163 20 0 DIADLO COc1ccccc1C[N@@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000507372160 340218190 /nfs/dbraw/zinc/21/81/90/340218190.db2.gz PAQORXXHZKIRMP-OAQYLSRUSA-N 1 2 318.420 4.102 20 0 DIADLO COc1ccccc1C[N@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000507372160 340218191 /nfs/dbraw/zinc/21/81/91/340218191.db2.gz PAQORXXHZKIRMP-OAQYLSRUSA-N 1 2 318.420 4.102 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000507474633 340221646 /nfs/dbraw/zinc/22/16/46/340221646.db2.gz YBRYTUGDZZQRLO-KKSFZXQISA-N 1 2 317.436 4.479 20 0 DIADLO COCC[C@H]([NH2+][C@@H](CCc1ccccc1)C(F)F)c1ccco1 ZINC000507479199 340221722 /nfs/dbraw/zinc/22/17/22/340221722.db2.gz NYFYGOVLUQHHCE-HOTGVXAUSA-N 1 2 323.383 4.213 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1cc(C(CC)CC)no1 ZINC000507489900 340222471 /nfs/dbraw/zinc/22/24/71/340222471.db2.gz YTWSQSCZUFTLPE-CYBMUJFWSA-N 1 2 301.434 4.386 20 0 DIADLO Cc1sccc1C[N@@H+]1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000507492207 340222588 /nfs/dbraw/zinc/22/25/88/340222588.db2.gz OBVLSNXCRHPQTJ-UHFFFAOYSA-N 1 2 300.402 4.235 20 0 DIADLO Cc1sccc1C[N@H+]1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000507492207 340222589 /nfs/dbraw/zinc/22/25/89/340222589.db2.gz OBVLSNXCRHPQTJ-UHFFFAOYSA-N 1 2 300.402 4.235 20 0 DIADLO CCSc1ccc(CC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000507727086 340229584 /nfs/dbraw/zinc/22/95/84/340229584.db2.gz PXACPZYBJJNALR-UHFFFAOYSA-N 1 2 314.454 4.300 20 0 DIADLO Cc1ccc(F)c(N[C@H](c2[nH+]ccn2C)c2cccc(F)c2)c1 ZINC000507810855 340232596 /nfs/dbraw/zinc/23/25/96/340232596.db2.gz CJISQDGXEBVMJR-KRWDZBQOSA-N 1 2 313.351 4.208 20 0 DIADLO C[C@@H](c1cnn(C)c1)[N@H+](C)Cc1ccc(-c2ccccc2)cc1F ZINC000507856553 340234282 /nfs/dbraw/zinc/23/42/82/340234282.db2.gz WJYZGMRRWPRNRY-HNNXBMFYSA-N 1 2 323.415 4.419 20 0 DIADLO C[C@@H](c1cnn(C)c1)[N@@H+](C)Cc1ccc(-c2ccccc2)cc1F ZINC000507856553 340234283 /nfs/dbraw/zinc/23/42/83/340234283.db2.gz WJYZGMRRWPRNRY-HNNXBMFYSA-N 1 2 323.415 4.419 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)ccc(O)c2F)s1 ZINC000508234002 340241120 /nfs/dbraw/zinc/24/11/20/340241120.db2.gz FJSPJABUOXVXRN-ZDUSSCGKSA-N 1 2 309.381 4.377 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)ccc(O)c2F)s1 ZINC000508234002 340241121 /nfs/dbraw/zinc/24/11/21/340241121.db2.gz FJSPJABUOXVXRN-ZDUSSCGKSA-N 1 2 309.381 4.377 20 0 DIADLO Fc1cc(NCc2c[nH+]c3ccc(Cl)cn23)cc(F)c1F ZINC000508464307 340244224 /nfs/dbraw/zinc/24/42/24/340244224.db2.gz BYVMYZGSYYXUBF-UHFFFAOYSA-N 1 2 311.694 4.017 20 0 DIADLO CCC[N@H+](Cc1cnn(CC)c1)Cc1c(F)cccc1Cl ZINC000508609461 340247888 /nfs/dbraw/zinc/24/78/88/340247888.db2.gz QMSVZPVNJOQSOU-UHFFFAOYSA-N 1 2 309.816 4.108 20 0 DIADLO CCC[N@@H+](Cc1cnn(CC)c1)Cc1c(F)cccc1Cl ZINC000508609461 340247889 /nfs/dbraw/zinc/24/78/89/340247889.db2.gz QMSVZPVNJOQSOU-UHFFFAOYSA-N 1 2 309.816 4.108 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1cccc(O)c1Cl ZINC000508968460 340256544 /nfs/dbraw/zinc/25/65/44/340256544.db2.gz QMXJWGGDRQRYMU-HNNXBMFYSA-N 1 2 304.821 4.111 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](C)Cc2c(F)ccc(O)c2F)c1 ZINC000508975113 340256668 /nfs/dbraw/zinc/25/66/68/340256668.db2.gz CARQEXGAUQWHJI-UHFFFAOYSA-N 1 2 321.367 4.090 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2c(F)ccc(O)c2F)c1 ZINC000508975113 340256669 /nfs/dbraw/zinc/25/66/69/340256669.db2.gz CARQEXGAUQWHJI-UHFFFAOYSA-N 1 2 321.367 4.090 20 0 DIADLO Cc1ccccc1NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509016627 340258320 /nfs/dbraw/zinc/25/83/20/340258320.db2.gz QTCCVQPTBONBEZ-UHFFFAOYSA-N 1 2 304.349 4.435 20 0 DIADLO CC[C@H]([NH2+][C@@H](CC(C)C)C(=O)OC)c1ccc(Cl)s1 ZINC000509032195 340258869 /nfs/dbraw/zinc/25/88/69/340258869.db2.gz MRSMTVZHAJTIAG-QWRGUYRKSA-N 1 2 303.855 4.030 20 0 DIADLO Cc1cc(C)nc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)c1 ZINC000509178248 340263199 /nfs/dbraw/zinc/26/31/99/340263199.db2.gz KQDCJCIMPQGZQK-UHFFFAOYSA-N 1 2 319.364 4.138 20 0 DIADLO CC(C)(C)[C@H]1CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509299670 340265577 /nfs/dbraw/zinc/26/55/77/340265577.db2.gz CMPTYLFJTNGZHK-HNNXBMFYSA-N 1 2 324.424 4.382 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1nc(-c2ccc(C)cc2)cs1 ZINC000509310739 340265869 /nfs/dbraw/zinc/26/58/69/340265869.db2.gz QIQHWMVFWBBUGL-HOCLYGCPSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1nc(-c2ccc(C)cc2)cs1 ZINC000509310739 340265870 /nfs/dbraw/zinc/26/58/70/340265870.db2.gz QIQHWMVFWBBUGL-HOCLYGCPSA-N 1 2 316.470 4.118 20 0 DIADLO C[N@H+](CC(=O)Nc1ccccc1)Cc1ccc(-c2ccccc2)o1 ZINC000509329328 340266474 /nfs/dbraw/zinc/26/64/74/340266474.db2.gz YNGIPWMQTOCORK-UHFFFAOYSA-N 1 2 320.392 4.017 20 0 DIADLO C[N@@H+](CC(=O)Nc1ccccc1)Cc1ccc(-c2ccccc2)o1 ZINC000509329328 340266475 /nfs/dbraw/zinc/26/64/75/340266475.db2.gz YNGIPWMQTOCORK-UHFFFAOYSA-N 1 2 320.392 4.017 20 0 DIADLO Clc1ccccc1C1=CC[N@H+](Cc2cn3ccccc3n2)CC1 ZINC000509436678 340269441 /nfs/dbraw/zinc/26/94/41/340269441.db2.gz LXQBYIKNLSZBJB-UHFFFAOYSA-N 1 2 323.827 4.277 20 0 DIADLO Clc1ccccc1C1=CC[N@@H+](Cc2cn3ccccc3n2)CC1 ZINC000509436678 340269442 /nfs/dbraw/zinc/26/94/42/340269442.db2.gz LXQBYIKNLSZBJB-UHFFFAOYSA-N 1 2 323.827 4.277 20 0 DIADLO Cc1nc2[nH]ccc2c(N2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)[nH+]1 ZINC000509459742 340270162 /nfs/dbraw/zinc/27/01/62/340270162.db2.gz PLDNIXQNATWLPU-BJWYYQGGSA-N 1 2 318.424 4.181 20 0 DIADLO Cc1ccsc1CNC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509614233 340274798 /nfs/dbraw/zinc/27/47/98/340274798.db2.gz ASNTXBFNSODSJY-UHFFFAOYSA-N 1 2 324.405 4.174 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)C(=O)CC2(C)CCCCC2)c1C ZINC000509693249 340277109 /nfs/dbraw/zinc/27/71/09/340277109.db2.gz NTICXVYANUJQFS-UHFFFAOYSA-N 1 2 318.461 4.026 20 0 DIADLO C[C@H](F)CC[N@@H+]1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000509695911 340277325 /nfs/dbraw/zinc/27/73/25/340277325.db2.gz IARIPZPWFYQISR-LKFCYVNXSA-N 1 2 324.198 4.254 20 0 DIADLO C[C@H](F)CC[N@H+]1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000509695911 340277326 /nfs/dbraw/zinc/27/73/26/340277326.db2.gz IARIPZPWFYQISR-LKFCYVNXSA-N 1 2 324.198 4.254 20 0 DIADLO Cc1ccc(-n2cc[nH+]c2)c(C(=O)Nc2ccc(C)c(C)c2)c1 ZINC000509788598 340279166 /nfs/dbraw/zinc/27/91/66/340279166.db2.gz FNBNLVDXXVXXQO-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO Cn1c2ccccc2[nH+]c1CCSc1ccnc2ccccc21 ZINC000509951779 340283749 /nfs/dbraw/zinc/28/37/49/340283749.db2.gz KQPGIJCGVIDSCT-UHFFFAOYSA-N 1 2 319.433 4.456 20 0 DIADLO C[C@@H]1CC(NC(=O)c2ccccc2Oc2cc[nH+]cc2)C[C@@H](C)C1 ZINC000509989133 340284704 /nfs/dbraw/zinc/28/47/04/340284704.db2.gz LGNBFFYYLKNROV-GJZGRUSLSA-N 1 2 324.424 4.428 20 0 DIADLO C[C@H](CC1CCCCC1)C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000510045190 340286184 /nfs/dbraw/zinc/28/61/84/340286184.db2.gz YEVXSLZFZVAIMM-OAHLLOKOSA-N 1 2 311.429 4.417 20 0 DIADLO C[C@@H](CC1CCCCC1)C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000510045189 340286237 /nfs/dbraw/zinc/28/62/37/340286237.db2.gz YEVXSLZFZVAIMM-HNNXBMFYSA-N 1 2 311.429 4.417 20 0 DIADLO Cc1cc(C)c(NC(=O)C[NH2+]C2(C(F)F)CCCCC2)c(C)c1 ZINC000510122047 340289410 /nfs/dbraw/zinc/28/94/10/340289410.db2.gz RQXFESKTZYCGMZ-UHFFFAOYSA-N 1 2 324.415 4.108 20 0 DIADLO COc1cccc(C2([NH2+]Cc3c(F)cccc3Cl)CC2)c1 ZINC000510209582 340292592 /nfs/dbraw/zinc/29/25/92/340292592.db2.gz IMHSWMQQNOKQOW-UHFFFAOYSA-N 1 2 305.780 4.267 20 0 DIADLO C[C@H]1CCC[C@H](C)C1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000510320501 340295804 /nfs/dbraw/zinc/29/58/04/340295804.db2.gz FACWWDFIPQMYPI-GJZGRUSLSA-N 1 2 324.424 4.428 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+]3CC(C)(C)OC[C@@H]3C)n2)cc1 ZINC000510762994 340310178 /nfs/dbraw/zinc/31/01/78/340310178.db2.gz LBRLCQVWPBQSRV-AWEZNQCLSA-N 1 2 316.470 4.118 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+]3CC(C)(C)OC[C@@H]3C)n2)cc1 ZINC000510762994 340310179 /nfs/dbraw/zinc/31/01/79/340310179.db2.gz LBRLCQVWPBQSRV-AWEZNQCLSA-N 1 2 316.470 4.118 20 0 DIADLO c1ccc(-c2ccc(NCc3cccc4c3OCCO4)[nH+]c2)cc1 ZINC000510895916 340314182 /nfs/dbraw/zinc/31/41/82/340314182.db2.gz SHWPOOMOQGBHHA-UHFFFAOYSA-N 1 2 318.376 4.132 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCNC(=O)CCCC(C)(C)C ZINC000303238377 340314893 /nfs/dbraw/zinc/31/48/93/340314893.db2.gz ZYLQDCUQVXLVQR-UHFFFAOYSA-N 1 2 315.461 4.067 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC=C(c3ccco3)C2)cs1 ZINC000511078435 340320064 /nfs/dbraw/zinc/32/00/64/340320064.db2.gz AKVZNPPOLLGMCR-UHFFFAOYSA-N 1 2 302.443 4.323 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC=C(c3ccco3)C2)cs1 ZINC000511078435 340320065 /nfs/dbraw/zinc/32/00/65/340320065.db2.gz AKVZNPPOLLGMCR-UHFFFAOYSA-N 1 2 302.443 4.323 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccc(F)cc2Cl)CC2CC2)oc1C ZINC000511127003 340321636 /nfs/dbraw/zinc/32/16/36/340321636.db2.gz SQKQJUJLBCQLBS-UHFFFAOYSA-N 1 2 322.811 4.496 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccc(F)cc2Cl)CC2CC2)oc1C ZINC000511127003 340321637 /nfs/dbraw/zinc/32/16/37/340321637.db2.gz SQKQJUJLBCQLBS-UHFFFAOYSA-N 1 2 322.811 4.496 20 0 DIADLO CCc1ccc([C@H]2COCC[N@@H+]2Cc2ccccc2SC)o1 ZINC000511151874 340322623 /nfs/dbraw/zinc/32/26/23/340322623.db2.gz WXOKOACFQJJOKU-MRXNPFEDSA-N 1 2 317.454 4.137 20 0 DIADLO CCc1ccc([C@H]2COCC[N@H+]2Cc2ccccc2SC)o1 ZINC000511151874 340322624 /nfs/dbraw/zinc/32/26/24/340322624.db2.gz WXOKOACFQJJOKU-MRXNPFEDSA-N 1 2 317.454 4.137 20 0 DIADLO CC(C)c1noc(C[N@@H+]2CCc3ccc(C(C)(C)C)cc3C2)n1 ZINC000511216337 340323998 /nfs/dbraw/zinc/32/39/98/340323998.db2.gz RCKUISJXSJYTOJ-UHFFFAOYSA-N 1 2 313.445 4.049 20 0 DIADLO CC(C)c1noc(C[N@H+]2CCc3ccc(C(C)(C)C)cc3C2)n1 ZINC000511216337 340323999 /nfs/dbraw/zinc/32/39/99/340323999.db2.gz RCKUISJXSJYTOJ-UHFFFAOYSA-N 1 2 313.445 4.049 20 0 DIADLO C[C@@H]1C[C@H](C)[C@H](C)N(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000511290566 340324799 /nfs/dbraw/zinc/32/47/99/340324799.db2.gz YEZYSBZVCJRZMJ-PMPSAXMXSA-N 1 2 324.424 4.381 20 0 DIADLO Cc1nc2ccccn2c1C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511568313 340330877 /nfs/dbraw/zinc/33/08/77/340330877.db2.gz UENYDSZACIEFRU-INIZCTEOSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1nc2ccccn2c1C[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511568313 340330878 /nfs/dbraw/zinc/33/08/78/340330878.db2.gz UENYDSZACIEFRU-INIZCTEOSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC000511568519 340331060 /nfs/dbraw/zinc/33/10/60/340331060.db2.gz VFKRDVKMDVOOSM-QGZVFWFLSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC000511568519 340331061 /nfs/dbraw/zinc/33/10/61/340331061.db2.gz VFKRDVKMDVOOSM-QGZVFWFLSA-N 1 2 314.816 4.034 20 0 DIADLO CC(C)N(C(=O)[C@H](C)[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1)C(C)C ZINC000511621243 340332797 /nfs/dbraw/zinc/33/27/97/340332797.db2.gz BWWHKWMUTPEMNL-WMLDXEAASA-N 1 2 322.880 4.121 20 0 DIADLO CC(C)N(C(=O)[C@H](C)[N@H+]1CC[C@@H]1c1ccc(Cl)cc1)C(C)C ZINC000511621243 340332798 /nfs/dbraw/zinc/33/27/98/340332798.db2.gz BWWHKWMUTPEMNL-WMLDXEAASA-N 1 2 322.880 4.121 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Cl)s2)C[C@H](c2ccccc2)O1 ZINC000511838178 340339708 /nfs/dbraw/zinc/33/97/08/340339708.db2.gz LZEVYYJEPUMQIA-IUODEOHRSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Cl)s2)C[C@H](c2ccccc2)O1 ZINC000511838178 340339709 /nfs/dbraw/zinc/33/97/09/340339709.db2.gz LZEVYYJEPUMQIA-IUODEOHRSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3C[C@@H](C)OC(C)(C)C3)cs2)cc1 ZINC000511978554 340344334 /nfs/dbraw/zinc/34/43/34/340344334.db2.gz NLAPCQXTDZOGLC-CQSZACIVSA-N 1 2 316.470 4.118 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3C[C@@H](C)OC(C)(C)C3)cs2)cc1 ZINC000511978554 340344335 /nfs/dbraw/zinc/34/43/35/340344335.db2.gz NLAPCQXTDZOGLC-CQSZACIVSA-N 1 2 316.470 4.118 20 0 DIADLO CC(C)CCn1cccc1C[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000512237139 340353542 /nfs/dbraw/zinc/35/35/42/340353542.db2.gz NCDNHPUJVDDRIL-QGZVFWFLSA-N 1 2 318.486 4.169 20 0 DIADLO CC(C)CCn1cccc1C[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000512237139 340353543 /nfs/dbraw/zinc/35/35/43/340353543.db2.gz NCDNHPUJVDDRIL-QGZVFWFLSA-N 1 2 318.486 4.169 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1cccc(N[C@H](C)C(C)C)c1C ZINC000173173423 340359338 /nfs/dbraw/zinc/35/93/38/340359338.db2.gz HAFSXAASMCNXCL-OAHLLOKOSA-N 1 2 311.429 4.407 20 0 DIADLO Cc1nc(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)sc1C ZINC000173190011 340359877 /nfs/dbraw/zinc/35/98/77/340359877.db2.gz WJHTZHSSCRUGJS-LJQANCHMSA-N 1 2 323.465 4.167 20 0 DIADLO Cc1nc(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)sc1C ZINC000173190011 340359878 /nfs/dbraw/zinc/35/98/78/340359878.db2.gz WJHTZHSSCRUGJS-LJQANCHMSA-N 1 2 323.465 4.167 20 0 DIADLO CCC[N@@H+](Cc1ccc(OCc2cccnc2)cc1)CC(F)F ZINC000512615714 340369166 /nfs/dbraw/zinc/36/91/66/340369166.db2.gz YNODFYGNSMXDAW-UHFFFAOYSA-N 1 2 320.383 4.138 20 0 DIADLO CCC[N@H+](Cc1ccc(OCc2cccnc2)cc1)CC(F)F ZINC000512615714 340369167 /nfs/dbraw/zinc/36/91/67/340369167.db2.gz YNODFYGNSMXDAW-UHFFFAOYSA-N 1 2 320.383 4.138 20 0 DIADLO CCC[C@@H](C)C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000512623974 340369761 /nfs/dbraw/zinc/36/97/61/340369761.db2.gz VKPSCGJUHVPBOX-CQSZACIVSA-N 1 2 311.429 4.261 20 0 DIADLO FC(F)C1([NH2+]Cc2cnc(C(F)(F)F)s2)CCCCC1 ZINC000512849448 340380707 /nfs/dbraw/zinc/38/07/07/340380707.db2.gz FFUOMYAXVRFOJP-UHFFFAOYSA-N 1 2 314.323 4.220 20 0 DIADLO CC(C)(C)c1ncc(C[NH2+]C2(C(F)F)CCCCC2)s1 ZINC000512903744 340383429 /nfs/dbraw/zinc/38/34/29/340383429.db2.gz FUQMEFUUSFNFTN-UHFFFAOYSA-N 1 2 302.434 4.498 20 0 DIADLO FC(F)(C[NH2+]Cc1ccc2c[nH]nc2c1)c1ccc(Cl)cc1 ZINC000512994277 340387332 /nfs/dbraw/zinc/38/73/32/340387332.db2.gz XPPOKDUXKXRZRA-UHFFFAOYSA-N 1 2 321.758 4.098 20 0 DIADLO FC(F)(C[NH2+]Cc1cccc2c[nH]nc21)c1ccc(Cl)cc1 ZINC000513007855 340388137 /nfs/dbraw/zinc/38/81/37/340388137.db2.gz XLHLVQIDPGXITE-UHFFFAOYSA-N 1 2 321.758 4.098 20 0 DIADLO OC[C@@H](Nc1ccc2ccccc2[nH+]1)c1cccc(Cl)c1F ZINC000513045160 340390503 /nfs/dbraw/zinc/39/05/03/340390503.db2.gz BSLRHJLQZKAPFL-OAHLLOKOSA-N 1 2 316.763 4.173 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)cc(Cl)c1)c1c(F)cncc1F ZINC000513061911 340391568 /nfs/dbraw/zinc/39/15/68/340391568.db2.gz DKQXWXIMRJTLQQ-MRVPVSSYSA-N 1 2 300.711 4.003 20 0 DIADLO Cn1ccc(C[N@@H+]2CCCC[C@H]2c2ccccc2C(F)(F)F)n1 ZINC000513129104 340394466 /nfs/dbraw/zinc/39/44/66/340394466.db2.gz VWWPNLRNJKFGML-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1ccc(C[N@H+]2CCCC[C@H]2c2ccccc2C(F)(F)F)n1 ZINC000513129104 340394467 /nfs/dbraw/zinc/39/44/67/340394467.db2.gz VWWPNLRNJKFGML-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000513137920 340394648 /nfs/dbraw/zinc/39/46/48/340394648.db2.gz BXSSKLXWHXQDFL-KRWDZBQOSA-N 1 2 319.351 4.016 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@H+]1CCOc2cc(O)ccc2C1 ZINC000513137920 340394649 /nfs/dbraw/zinc/39/46/49/340394649.db2.gz BXSSKLXWHXQDFL-KRWDZBQOSA-N 1 2 319.351 4.016 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)ccc1Cl)c1c(F)cncc1F ZINC000513251443 340399247 /nfs/dbraw/zinc/39/92/47/340399247.db2.gz AXTBUOITBIDVEA-QMMMGPOBSA-N 1 2 300.711 4.003 20 0 DIADLO Oc1ccc(F)c(C[NH+]2CCC(F)(c3ccccc3)CC2)c1F ZINC000513312003 340401900 /nfs/dbraw/zinc/40/19/00/340401900.db2.gz LKUSBJYZFGFGTN-UHFFFAOYSA-N 1 2 321.342 4.131 20 0 DIADLO Fc1ccc(-c2nc(C[NH+]3Cc4ccccc4C3)cs2)cc1 ZINC000513655323 340417573 /nfs/dbraw/zinc/41/75/73/340417573.db2.gz LRRSPGFLFHBPFI-UHFFFAOYSA-N 1 2 310.397 4.465 20 0 DIADLO Cc1ccc(NC(=O)c2cncc(-c3ccccc3)c2)c(C)[nH+]1 ZINC000176618399 340429244 /nfs/dbraw/zinc/42/92/44/340429244.db2.gz GVDHALHCKLXBSZ-UHFFFAOYSA-N 1 2 303.365 4.013 20 0 DIADLO CC[C@@H](CC(=O)Nc1ccc(C)[nH+]c1C)c1ccc(OC)cc1 ZINC000178914433 340452425 /nfs/dbraw/zinc/45/24/25/340452425.db2.gz TYEJHQSOEHTKGQ-HNNXBMFYSA-N 1 2 312.413 4.229 20 0 DIADLO C[C@H]([NH2+]Cc1nccn1-c1ccccc1)c1ccccc1Cl ZINC000190675024 340546389 /nfs/dbraw/zinc/54/63/89/340546389.db2.gz BYWKMUULSFGJIY-AWEZNQCLSA-N 1 2 311.816 4.377 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)CCOC(C)C)c1C(C)C ZINC000191957566 340560607 /nfs/dbraw/zinc/56/06/07/340560607.db2.gz GSJJFWKWHINVJR-UHFFFAOYSA-N 1 2 314.429 4.420 20 0 DIADLO Cc1cc(NC(=O)/C=C/c2ccc[nH]2)ccc1Oc1cc[nH+]cc1 ZINC000192587791 340567947 /nfs/dbraw/zinc/56/79/47/340567947.db2.gz SZFVWMOKERVMSF-FNORWQNLSA-N 1 2 319.364 4.162 20 0 DIADLO CCCCc1noc([C@@H](C)[NH+]2CCC(OCCC(C)C)CC2)n1 ZINC000193105999 340572521 /nfs/dbraw/zinc/57/25/21/340572521.db2.gz RLZMVPMTVWCHAS-OAHLLOKOSA-N 1 2 323.481 4.000 20 0 DIADLO Fc1cc(NCc2sccc2Cl)ccc1-n1cc[nH+]c1 ZINC000193161414 340573321 /nfs/dbraw/zinc/57/33/21/340573321.db2.gz KKJNLGCLRVTPRX-UHFFFAOYSA-N 1 2 307.781 4.338 20 0 DIADLO Cc1ccccc1N1CC[NH+]([C@H](C)c2ccc(F)cc2F)CC1 ZINC000195594218 340582261 /nfs/dbraw/zinc/58/22/61/340582261.db2.gz OKPWSZLCOVRNMV-OAHLLOKOSA-N 1 2 316.395 4.156 20 0 DIADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1coc2ccccc12 ZINC000522208298 340588244 /nfs/dbraw/zinc/58/82/44/340588244.db2.gz XZSXDONNDFCXGM-UHFFFAOYSA-N 1 2 303.321 4.075 20 0 DIADLO CC(C)(C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1ccccc1F ZINC000522254190 340593900 /nfs/dbraw/zinc/59/39/00/340593900.db2.gz DRWOHQPDMGIFLS-UHFFFAOYSA-N 1 2 323.371 4.132 20 0 DIADLO COc1ccc(Br)c(CNc2ccc(C)[nH+]c2C)c1 ZINC000227846771 340603684 /nfs/dbraw/zinc/60/36/84/340603684.db2.gz VMCUCCNJFSTQFP-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO CC(C)C[C@@H](C)CC(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000524312549 340652268 /nfs/dbraw/zinc/65/22/68/340652268.db2.gz YMIVWOFIMQHHSE-CQSZACIVSA-N 1 2 323.506 4.140 20 0 DIADLO CCc1ccc([C@H](NC(=O)c2ccc3[nH+]ccn3c2)C(C)C)cc1 ZINC000524345941 340652914 /nfs/dbraw/zinc/65/29/14/340652914.db2.gz GIELYNJZYUWCIE-LJQANCHMSA-N 1 2 321.424 4.024 20 0 DIADLO CCCOc1cccc(NCc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000236776589 340665044 /nfs/dbraw/zinc/66/50/44/340665044.db2.gz DNTBQNBXYXBQJO-UHFFFAOYSA-N 1 2 307.397 4.273 20 0 DIADLO Fc1ccc(C2CC(Nc3ccc(N4CCCC4)[nH+]c3)C2)cc1 ZINC000237833318 340674379 /nfs/dbraw/zinc/67/43/79/340674379.db2.gz ARAHXNGHTUKHNB-UHFFFAOYSA-N 1 2 311.404 4.179 20 0 DIADLO CC(C)[C@@H](C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1ccccc1 ZINC000525199468 340694844 /nfs/dbraw/zinc/69/48/44/340694844.db2.gz HXEMGRCQZSECFG-LJQANCHMSA-N 1 2 319.408 4.455 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]Cc2ccc(C(F)F)cc2)cs1 ZINC000525988957 340707554 /nfs/dbraw/zinc/70/75/54/340707554.db2.gz XDFAOMUOCCJRKS-SNVBAGLBSA-N 1 2 312.385 4.078 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)C34CC5CC(CC(C5)C3)C4)ccc2n1C ZINC000074985685 340711324 /nfs/dbraw/zinc/71/13/24/340711324.db2.gz FPPARHRNUKSWBG-UHFFFAOYSA-N 1 2 323.440 4.037 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2ccccn2)C2CCC2)cs1 ZINC000528652274 340728040 /nfs/dbraw/zinc/72/80/40/340728040.db2.gz UDJLFBKZPCNGJA-KRWDZBQOSA-N 1 2 301.459 4.122 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2nc(C(C)(C)C)no2)C(C)C)c1 ZINC000528768851 340733371 /nfs/dbraw/zinc/73/33/71/340733371.db2.gz SRMMXVHBCWSVAT-MRXNPFEDSA-N 1 2 301.434 4.162 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](c2ccccn2)C2CCC2)c(C)[nH+]1 ZINC000529102779 340745000 /nfs/dbraw/zinc/74/50/00/340745000.db2.gz JTPMDLBQIOKIQB-SFHVURJKSA-N 1 2 324.428 4.065 20 0 DIADLO Cc1cc[nH+]cc1CCCNc1cccc(C2CCOCC2)c1 ZINC000529668736 340767376 /nfs/dbraw/zinc/76/73/76/340767376.db2.gz MFZFNYHNWUPSRL-UHFFFAOYSA-N 1 2 310.441 4.329 20 0 DIADLO c1coc(C[NH+](Cc2ccco2)C[C@@H]2CCC3(CCCC3)O2)c1 ZINC000530419145 340791146 /nfs/dbraw/zinc/79/11/46/340791146.db2.gz DHZHCAIDFUYMGD-SFHVURJKSA-N 1 2 315.413 4.367 20 0 DIADLO CCc1cnc(C[NH2+][C@H](CC(F)(F)F)c2ccc(F)cc2)o1 ZINC000538174840 340812280 /nfs/dbraw/zinc/81/22/80/340812280.db2.gz GEGNELGZJNVTPD-CYBMUJFWSA-N 1 2 316.298 4.159 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2nnc(C3CC3)o2)C2CCCC2)cc1 ZINC000538209302 340813358 /nfs/dbraw/zinc/81/33/58/340813358.db2.gz AHBDEQQHRAOOBF-KRWDZBQOSA-N 1 2 315.392 4.107 20 0 DIADLO COc1cc(C)[nH+]c(CNc2ccc(Oc3ccccn3)cc2)c1 ZINC000538755182 340848197 /nfs/dbraw/zinc/84/81/97/340848197.db2.gz CQZKMXKYVOAAKX-UHFFFAOYSA-N 1 2 321.380 4.198 20 0 DIADLO Cc1ncc(-c2ccccc2)cc1NCc1cccc2[nH+]ccn21 ZINC000538760851 340848979 /nfs/dbraw/zinc/84/89/79/340848979.db2.gz PRYAQSXPFYLDCO-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO Cc1ccc(Cl)cc1C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000127572030 340853357 /nfs/dbraw/zinc/85/33/57/340853357.db2.gz XCLODEXDJUXLGE-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO COc1ccc(C[NH2+][C@H](C)c2nc3c(s2)CCCC3)c(F)c1 ZINC000539057786 340868905 /nfs/dbraw/zinc/86/89/05/340868905.db2.gz IGAZNXFPZYFENM-LLVKDONJSA-N 1 2 320.433 4.020 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1cccs1)c1ccc(F)cc1)c1cnccn1 ZINC000539073049 340870651 /nfs/dbraw/zinc/87/06/51/340870651.db2.gz NFDUXBJKIIPSAD-SJKOYZFVSA-N 1 2 313.401 4.117 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@H](C)c2ccccc2Cl)n1 ZINC000067961040 340874450 /nfs/dbraw/zinc/87/44/50/340874450.db2.gz SGJFVTOBGPHJQZ-GFCCVEGCSA-N 1 2 307.825 4.162 20 0 DIADLO COc1cccc(C=C2CC[NH+]([C@H](C)c3ncc(C)o3)CC2)c1 ZINC000540052278 340913285 /nfs/dbraw/zinc/91/32/85/340913285.db2.gz SIEIIAHXEHWVQN-OAHLLOKOSA-N 1 2 312.413 4.232 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2nnc(C3CC3)o2)C2CCC2)cc1 ZINC000540403217 340929877 /nfs/dbraw/zinc/92/98/77/340929877.db2.gz CNJGWMSSBNMMPW-INIZCTEOSA-N 1 2 317.820 4.231 20 0 DIADLO CC(C)(C)[C@H]([NH2+]Cc1nnsc1Cl)c1cccc(F)c1 ZINC000540427042 340930981 /nfs/dbraw/zinc/93/09/81/340930981.db2.gz LIZBIOFSMVQRCP-GFCCVEGCSA-N 1 2 313.829 4.208 20 0 DIADLO CCc1cc(Nc2cccc(OCc3cccnc3)c2)nc(C)[nH+]1 ZINC000541090643 340958830 /nfs/dbraw/zinc/95/88/30/340958830.db2.gz TWPMLXAYXNCZDB-UHFFFAOYSA-N 1 2 320.396 4.065 20 0 DIADLO Cc1nc([C@H]([NH2+][C@@H]2CCC(C)(C)C2)c2ccc(Cl)cc2)no1 ZINC000541587386 340976112 /nfs/dbraw/zinc/97/61/12/340976112.db2.gz GKVVGBSWZDNZGS-HUUCEWRRSA-N 1 2 319.836 4.289 20 0 DIADLO Cc1nc2[nH]ccc2c(N2CC[C@H](c3ccccc3)C[C@@H]2C)[nH+]1 ZINC000542137833 340996905 /nfs/dbraw/zinc/99/69/05/340996905.db2.gz GJNGJNDUTUYAAG-BBRMVZONSA-N 1 2 306.413 4.039 20 0 DIADLO CSc1c(F)cc(NCc2cn3cccc(C)c3[nH+]2)cc1F ZINC000542222493 341000931 /nfs/dbraw/zinc/00/09/31/341000931.db2.gz YPSIKZSSNPYLJR-UHFFFAOYSA-N 1 2 319.380 4.255 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1ncc(-c2cccs2)o1 ZINC000130175097 341005014 /nfs/dbraw/zinc/00/50/14/341005014.db2.gz BWKMWVPWXRDDDO-CQSZACIVSA-N 1 2 313.426 4.381 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ncc(-c2cccs2)o1 ZINC000130175097 341005015 /nfs/dbraw/zinc/00/50/15/341005015.db2.gz BWKMWVPWXRDDDO-CQSZACIVSA-N 1 2 313.426 4.381 20 0 DIADLO COc1ccccc1C[N@H+](Cc1cnc(C2CC2)s1)C1CC1 ZINC000130180080 341005505 /nfs/dbraw/zinc/00/55/05/341005505.db2.gz CSSRZHDJMGLABE-UHFFFAOYSA-N 1 2 314.454 4.194 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1cnc(C2CC2)s1)C1CC1 ZINC000130180080 341005506 /nfs/dbraw/zinc/00/55/06/341005506.db2.gz CSSRZHDJMGLABE-UHFFFAOYSA-N 1 2 314.454 4.194 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1sccc1Br ZINC000070717645 341007308 /nfs/dbraw/zinc/00/73/08/341007308.db2.gz MVKXWJCXTZWCHY-SFYZADRCSA-N 1 2 317.277 4.379 20 0 DIADLO CCc1cnc(C[N@@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)s1 ZINC000542464750 341008278 /nfs/dbraw/zinc/00/82/78/341008278.db2.gz HTGXALUCKFVKLW-SUMWQHHRSA-N 1 2 318.511 4.384 20 0 DIADLO CCc1cnc(C[N@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)s1 ZINC000542464750 341008279 /nfs/dbraw/zinc/00/82/79/341008279.db2.gz HTGXALUCKFVKLW-SUMWQHHRSA-N 1 2 318.511 4.384 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnsc1Cl)c1ccc(Cl)s1 ZINC000542556889 341013419 /nfs/dbraw/zinc/01/34/19/341013419.db2.gz OONPMNWWKGOGAK-ZCFIWIBFSA-N 1 2 308.259 4.147 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@H+](C)Cc1ccncc1 ZINC000130299985 341014896 /nfs/dbraw/zinc/01/48/96/341014896.db2.gz DRACIWCONCQDBY-LBPRGKRZSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@@H+](C)Cc1ccncc1 ZINC000130299985 341014897 /nfs/dbraw/zinc/01/48/97/341014897.db2.gz DRACIWCONCQDBY-LBPRGKRZSA-N 1 2 305.219 4.037 20 0 DIADLO c1ccc2sc(C[N@@H+]3CCO[C@H](C4CCCCC4)C3)nc2c1 ZINC000542651051 341015721 /nfs/dbraw/zinc/01/57/21/341015721.db2.gz YAHPVWVURJUKTB-INIZCTEOSA-N 1 2 316.470 4.077 20 0 DIADLO c1ccc2sc(C[N@H+]3CCO[C@H](C4CCCCC4)C3)nc2c1 ZINC000542651051 341015722 /nfs/dbraw/zinc/01/57/22/341015722.db2.gz YAHPVWVURJUKTB-INIZCTEOSA-N 1 2 316.470 4.077 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](c2ccc(C)o2)C2CCC2)cs1 ZINC000542664277 341016160 /nfs/dbraw/zinc/01/61/60/341016160.db2.gz UQTGOVDJHRZRSL-MLGOLLRUSA-N 1 2 320.458 4.383 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2c(F)cccc2F)o1)c1ccon1 ZINC000542709732 341018600 /nfs/dbraw/zinc/01/86/00/341018600.db2.gz FTNMAGWPMUUVCI-JTQLQIEISA-N 1 2 304.296 4.064 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3C)C2)s1 ZINC000564259722 341020789 /nfs/dbraw/zinc/02/07/89/341020789.db2.gz DYKWCCRACRSSSQ-MRXNPFEDSA-N 1 2 319.495 4.352 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3C)C2)s1 ZINC000564259722 341020790 /nfs/dbraw/zinc/02/07/90/341020790.db2.gz DYKWCCRACRSSSQ-MRXNPFEDSA-N 1 2 319.495 4.352 20 0 DIADLO CCc1cccc(CC)c1NC(=O)C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000543061346 341029832 /nfs/dbraw/zinc/02/98/32/341029832.db2.gz JMXGLZKDYFMTIA-OAHLLOKOSA-N 1 2 322.452 4.327 20 0 DIADLO CCc1cccc(CC)c1NC(=O)C[N@H+]1Cc2ccccc2[C@H]1C ZINC000543061346 341029833 /nfs/dbraw/zinc/02/98/33/341029833.db2.gz JMXGLZKDYFMTIA-OAHLLOKOSA-N 1 2 322.452 4.327 20 0 DIADLO Cc1ccc(C)c(NC(=O)[C@H](C)[N@@H+]2Cc3ccccc3[C@H]2C)c1 ZINC000543061398 341029990 /nfs/dbraw/zinc/02/99/90/341029990.db2.gz GQUFBKMZGWKCOM-CVEARBPZSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1ccc(C)c(NC(=O)[C@H](C)[N@H+]2Cc3ccccc3[C@H]2C)c1 ZINC000543061398 341029991 /nfs/dbraw/zinc/02/99/91/341029991.db2.gz GQUFBKMZGWKCOM-CVEARBPZSA-N 1 2 308.425 4.207 20 0 DIADLO CSc1cc(C[NH2+][C@@H](c2ccco2)c2ccccc2)ccn1 ZINC000543400665 341042464 /nfs/dbraw/zinc/04/24/64/341042464.db2.gz IKULSMJIYMLPEH-GOSISDBHSA-N 1 2 310.422 4.276 20 0 DIADLO COCC[C@@H]([NH2+]Cc1c(Cl)cccc1Cl)c1ccco1 ZINC000543458613 341045815 /nfs/dbraw/zinc/04/58/15/341045815.db2.gz HSYJGVUFUKFZME-CQSZACIVSA-N 1 2 314.212 4.454 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccn(C)n1 ZINC000543596318 341050088 /nfs/dbraw/zinc/05/00/88/341050088.db2.gz UNEIZRLGWNPCRY-VIFPVBQESA-N 1 2 304.246 4.029 20 0 DIADLO CCc1nc(C[N@H+](C)C/C=C\c2ccc(F)cc2F)cs1 ZINC000543629400 341052072 /nfs/dbraw/zinc/05/20/72/341052072.db2.gz CGKHNABEKIDZAR-PLNGDYQASA-N 1 2 308.397 4.129 20 0 DIADLO CCc1nc(C[N@@H+](C)C/C=C\c2ccc(F)cc2F)cs1 ZINC000543629400 341052073 /nfs/dbraw/zinc/05/20/73/341052073.db2.gz CGKHNABEKIDZAR-PLNGDYQASA-N 1 2 308.397 4.129 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)ccc2F)o1 ZINC000130999967 341056124 /nfs/dbraw/zinc/05/61/24/341056124.db2.gz NKNPNIOCNDPWJC-MRXNPFEDSA-N 1 2 307.340 4.041 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)ccc2F)o1 ZINC000130999967 341056125 /nfs/dbraw/zinc/05/61/25/341056125.db2.gz NKNPNIOCNDPWJC-MRXNPFEDSA-N 1 2 307.340 4.041 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cc(Cl)cc2c1OCC2)c1nccs1 ZINC000543989528 341065271 /nfs/dbraw/zinc/06/52/71/341065271.db2.gz NEXCATZZXIYQMP-MRXNPFEDSA-N 1 2 322.861 4.146 20 0 DIADLO CCCCS(=O)(=O)Nc1ccc([NH2+][C@@H](CC)C(C)C)cc1 ZINC000544022957 341067068 /nfs/dbraw/zinc/06/70/68/341067068.db2.gz JWSPRNCBPNGAIQ-INIZCTEOSA-N 1 2 312.479 4.075 20 0 DIADLO c1ccc(N2CCC(Nc3c[nH+]c4c(c3)CCCC4)CC2)cc1 ZINC000544041727 341067721 /nfs/dbraw/zinc/06/77/21/341067721.db2.gz YSMMWUDQNXAVCQ-UHFFFAOYSA-N 1 2 307.441 4.041 20 0 DIADLO CCC(CC)(c1nc(Cc2ccc(C)[nH+]c2)no1)c1ccccc1 ZINC000544177186 341072928 /nfs/dbraw/zinc/07/29/28/341072928.db2.gz IDVDZWVEMYUQSU-UHFFFAOYSA-N 1 2 321.424 4.470 20 0 DIADLO Cc1ccc(Cc2noc(-c3cc(Cl)cc(Cl)c3)n2)c[nH+]1 ZINC000544177508 341072941 /nfs/dbraw/zinc/07/29/41/341072941.db2.gz NNMXCRDIKAYALZ-UHFFFAOYSA-N 1 2 320.179 4.338 20 0 DIADLO Cc1cccn2cc(-c3ccc(N[C@@H](C)[C@@H]4CCCO4)cc3)[nH+]c12 ZINC000544387141 341079737 /nfs/dbraw/zinc/07/97/37/341079737.db2.gz HQSPKLPPKAHTTK-KXBFYZLASA-N 1 2 321.424 4.289 20 0 DIADLO Cc1ccccc1-c1cnc(C[NH2+][C@H](C)c2cnn(C(C)C)c2)o1 ZINC000544469499 341083540 /nfs/dbraw/zinc/08/35/40/341083540.db2.gz OLHYCSADAVVUOF-OAHLLOKOSA-N 1 2 324.428 4.278 20 0 DIADLO Cc1ccccc1-c1nc(C[NH2+]C(C)(C)c2cccs2)no1 ZINC000544470977 341083730 /nfs/dbraw/zinc/08/37/30/341083730.db2.gz PWXUVBZSQNFLAN-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO Cc1c([C@@H](C)[NH2+][C@@H](C)c2ccon2)cnn1-c1cc(C)ccc1C ZINC000544605016 341088387 /nfs/dbraw/zinc/08/83/87/341088387.db2.gz QGNVLGMECRVKJV-CABCVRRESA-N 1 2 324.428 4.197 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCO[C@H](c3ccccc3)C2)c(F)c1 ZINC000544610628 341088794 /nfs/dbraw/zinc/08/87/94/341088794.db2.gz AARCEDJRRQFSKR-QTWIXLPOSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCO[C@H](c3ccccc3)C2)c(F)c1 ZINC000544610628 341088795 /nfs/dbraw/zinc/08/87/95/341088795.db2.gz AARCEDJRRQFSKR-QTWIXLPOSA-N 1 2 315.363 4.052 20 0 DIADLO Cc1c(F)cccc1-c1ccc(C[NH2+][C@H](C)c2ccon2)o1 ZINC000544614819 341089165 /nfs/dbraw/zinc/08/91/65/341089165.db2.gz MENKCRFBHTUJFO-GFCCVEGCSA-N 1 2 300.333 4.233 20 0 DIADLO COc1ccc(Oc2ccc(C[NH2+][C@@H](C)c3ccon3)cc2)cc1 ZINC000544616672 341089376 /nfs/dbraw/zinc/08/93/76/341089376.db2.gz CCZMBDQSBTVFKF-AWEZNQCLSA-N 1 2 324.380 4.326 20 0 DIADLO C[N@H+](Cc1nc(C2CCCC2)no1)Cc1cccc(Cl)c1 ZINC000131476165 341090795 /nfs/dbraw/zinc/09/07/95/341090795.db2.gz PAJNEXVQVCHVEE-UHFFFAOYSA-N 1 2 305.809 4.013 20 0 DIADLO C[N@@H+](Cc1nc(C2CCCC2)no1)Cc1cccc(Cl)c1 ZINC000131476165 341090796 /nfs/dbraw/zinc/09/07/96/341090796.db2.gz PAJNEXVQVCHVEE-UHFFFAOYSA-N 1 2 305.809 4.013 20 0 DIADLO c1cn(-c2cccc(-c3noc(CC4CCCCC4)n3)c2)c[nH+]1 ZINC000544767734 341093400 /nfs/dbraw/zinc/09/34/00/341093400.db2.gz DEQFZPGCGBHSOZ-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1cnc(C2CC2)s1 ZINC000131598203 341100235 /nfs/dbraw/zinc/10/02/35/341100235.db2.gz PSLSEBHMLIOGRX-SNVBAGLBSA-N 1 2 308.397 4.492 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cnc(C2CC2)s1 ZINC000131598203 341100236 /nfs/dbraw/zinc/10/02/36/341100236.db2.gz PSLSEBHMLIOGRX-SNVBAGLBSA-N 1 2 308.397 4.492 20 0 DIADLO CCc1ccccc1-c1noc(Cn2c(C)[nH+]c3ccccc32)n1 ZINC000545029716 341105138 /nfs/dbraw/zinc/10/51/38/341105138.db2.gz DHKQILHWJJPPSL-UHFFFAOYSA-N 1 2 318.380 4.005 20 0 DIADLO CC(C)C[C@H](C)OCCC(=O)Nc1c[nH+]ccc1OC(C)(C)C ZINC000131839955 341112422 /nfs/dbraw/zinc/11/24/22/341112422.db2.gz PXGLHHBYRBAKAC-AWEZNQCLSA-N 1 2 322.449 4.039 20 0 DIADLO CCc1ccc(C[N@@H+]2CCSC[C@@H]2c2nccs2)s1 ZINC000545322329 341121363 /nfs/dbraw/zinc/12/13/63/341121363.db2.gz LNLQOQHDCCCJCJ-CYBMUJFWSA-N 1 2 310.513 4.057 20 0 DIADLO CCc1ccc(C[N@H+]2CCSC[C@@H]2c2nccs2)s1 ZINC000545322329 341121364 /nfs/dbraw/zinc/12/13/64/341121364.db2.gz LNLQOQHDCCCJCJ-CYBMUJFWSA-N 1 2 310.513 4.057 20 0 DIADLO c1ccc(COc2ccc[nH+]c2N[C@@H]2CCC[C@@H]3OCC[C@H]32)cc1 ZINC000545474386 341126746 /nfs/dbraw/zinc/12/67/46/341126746.db2.gz WFTYVVMCVLBJNG-KSZLIROESA-N 1 2 324.424 4.030 20 0 DIADLO c1ccc(COc2ccc[nH+]c2N[C@@H]2CCC[C@@H]3OCC[C@@H]32)cc1 ZINC000545474387 341126771 /nfs/dbraw/zinc/12/67/71/341126771.db2.gz WFTYVVMCVLBJNG-KURKYZTESA-N 1 2 324.424 4.030 20 0 DIADLO CC[C@]1(C)CCC[N@H+](CC(=O)Nc2c(C)cccc2Cl)C1 ZINC000132569847 341127803 /nfs/dbraw/zinc/12/78/03/341127803.db2.gz PMEYCPWIKOMOMU-QGZVFWFLSA-N 1 2 308.853 4.099 20 0 DIADLO CC[C@]1(C)CCC[N@@H+](CC(=O)Nc2c(C)cccc2Cl)C1 ZINC000132569847 341127804 /nfs/dbraw/zinc/12/78/04/341127804.db2.gz PMEYCPWIKOMOMU-QGZVFWFLSA-N 1 2 308.853 4.099 20 0 DIADLO Cc1cccc([C@H](C)C(=O)Nc2c[nH+]ccc2OC(C)(C)C)c1 ZINC000132612265 341131756 /nfs/dbraw/zinc/13/17/56/341131756.db2.gz IGQRYSCQLALWRG-AWEZNQCLSA-N 1 2 312.413 4.310 20 0 DIADLO Cc1ccc(Cc2noc(-c3ccc(SC4CC4)cc3)n2)c[nH+]1 ZINC000545633356 341134062 /nfs/dbraw/zinc/13/40/62/341134062.db2.gz JAWSBYGUMYSNBD-UHFFFAOYSA-N 1 2 323.421 4.285 20 0 DIADLO Cc1ccc(Cc2noc(/C=C/c3ccc(Cl)cc3)n2)c[nH+]1 ZINC000545638344 341134382 /nfs/dbraw/zinc/13/43/82/341134382.db2.gz ZITSIDVFNXAFMU-RMKNXTFCSA-N 1 2 311.772 4.188 20 0 DIADLO Cc1cccc(-c2nc(-c3ccc(C)[nH+]c3N3CCCC3)no2)c1 ZINC000545660326 341135182 /nfs/dbraw/zinc/13/51/82/341135182.db2.gz TXLFLQCMFLZVNF-UHFFFAOYSA-N 1 2 320.396 4.016 20 0 DIADLO CCCC(CCC)c1nc(Cc2cn3cccc(C)c3[nH+]2)no1 ZINC000545677858 341135998 /nfs/dbraw/zinc/13/59/98/341135998.db2.gz HTRHKANJPSSYFS-UHFFFAOYSA-N 1 2 312.417 4.300 20 0 DIADLO CCCOc1ccc(CNc2[nH+]cccc2OC(F)F)cc1 ZINC000545912320 341145583 /nfs/dbraw/zinc/14/55/83/341145583.db2.gz HFNXJZHVRQCINU-UHFFFAOYSA-N 1 2 308.328 4.084 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(Cl)cc1Cl)CO2 ZINC000545928491 341146749 /nfs/dbraw/zinc/14/67/49/341146749.db2.gz MIKIHPUVKVNIIE-CQSZACIVSA-N 1 2 312.171 4.356 20 0 DIADLO Cc1ccc(Cc2noc(-c3cc4ccccc4s3)n2)c[nH+]1 ZINC000546347563 341164498 /nfs/dbraw/zinc/16/44/98/341164498.db2.gz XFWAKGMCSQMEHS-UHFFFAOYSA-N 1 2 307.378 4.246 20 0 DIADLO CCc1ccc(/C(C)=C\c2nc(Cc3ccc(C)[nH+]c3)no2)cc1 ZINC000546350030 341164664 /nfs/dbraw/zinc/16/46/64/341164664.db2.gz ALHMGSXUDGEFIO-KAMYIIQDSA-N 1 2 319.408 4.487 20 0 DIADLO c1cn(-c2cccc(-c3noc(CCC4CCCC4)n3)c2)c[nH+]1 ZINC000546399570 341166630 /nfs/dbraw/zinc/16/66/30/341166630.db2.gz GTFJJXNDBYCRCX-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO Brc1cccc(C2=CCN(c3cccc[nH+]3)CC2)c1 ZINC000546580976 341173386 /nfs/dbraw/zinc/17/33/86/341173386.db2.gz GNMZTQGEPKVQQQ-UHFFFAOYSA-N 1 2 315.214 4.138 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1nccn1Cc1ccccc1 ZINC000075608725 341179483 /nfs/dbraw/zinc/17/94/83/341179483.db2.gz VCSJTXBPDNAEOV-UHFFFAOYSA-N 1 2 311.454 4.015 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1nccn1Cc1ccccc1 ZINC000075608725 341179484 /nfs/dbraw/zinc/17/94/84/341179484.db2.gz VCSJTXBPDNAEOV-UHFFFAOYSA-N 1 2 311.454 4.015 20 0 DIADLO COc1cc(C[N@H+](C)Cc2ccncc2Cl)ccc1SC ZINC000075675530 341180735 /nfs/dbraw/zinc/18/07/35/341180735.db2.gz ZWDAYSZAYMRUPL-UHFFFAOYSA-N 1 2 322.861 4.098 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2ccncc2Cl)ccc1SC ZINC000075675530 341180736 /nfs/dbraw/zinc/18/07/36/341180736.db2.gz ZWDAYSZAYMRUPL-UHFFFAOYSA-N 1 2 322.861 4.098 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)Cc2cc(C)ccc2C)cs1 ZINC000075887824 341188324 /nfs/dbraw/zinc/18/83/24/341188324.db2.gz RRSVHFDOOHHSHW-OAHLLOKOSA-N 1 2 318.486 4.489 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)Cc2cc(C)ccc2C)cs1 ZINC000075887824 341188325 /nfs/dbraw/zinc/18/83/25/341188325.db2.gz RRSVHFDOOHHSHW-OAHLLOKOSA-N 1 2 318.486 4.489 20 0 DIADLO Cc1ccc(Cc2nc(-c3cc(Cl)cc(Cl)c3)no2)c[nH+]1 ZINC000546993383 341190325 /nfs/dbraw/zinc/19/03/25/341190325.db2.gz DACXJTOUHFVPJN-UHFFFAOYSA-N 1 2 320.179 4.338 20 0 DIADLO C[C@H](CCC(C)(C)C)c1nc(Cc2cn3ccccc3[nH+]2)no1 ZINC000547018553 341191669 /nfs/dbraw/zinc/19/16/69/341191669.db2.gz PJRVVMGERXDYEV-CYBMUJFWSA-N 1 2 312.417 4.238 20 0 DIADLO Cc1ccc(Cc2noc(-c3ccc(C(C)(C)C)cc3)n2)c[nH+]1 ZINC000547051837 341193736 /nfs/dbraw/zinc/19/37/36/341193736.db2.gz RPYRDOFIXPEMFN-UHFFFAOYSA-N 1 2 307.397 4.328 20 0 DIADLO c1cn(-c2cccc(-c3nc(CC4CCCCC4)no3)c2)c[nH+]1 ZINC000547088996 341195418 /nfs/dbraw/zinc/19/54/18/341195418.db2.gz GADSSHSGDIYHKM-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO CC[C@@H](C)Oc1ccc(-c2noc(Cc3ccc(C)[nH+]c3)n2)cc1 ZINC000547164265 341199317 /nfs/dbraw/zinc/19/93/17/341199317.db2.gz LOHQCFZCMUQVDT-CQSZACIVSA-N 1 2 323.396 4.208 20 0 DIADLO CCC1(CC)C[N@@H+]([C@@H](C)c2ccc(Cl)cc2)CC[S@@]1=O ZINC000547398377 341211126 /nfs/dbraw/zinc/21/11/26/341211126.db2.gz VIAJPYZHUVKEGE-RBZFPXEDSA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@H+]([C@@H](C)c2ccc(Cl)cc2)CC[S@@]1=O ZINC000547398377 341211127 /nfs/dbraw/zinc/21/11/27/341211127.db2.gz VIAJPYZHUVKEGE-RBZFPXEDSA-N 1 2 313.894 4.024 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)[C@@H]2CCc3ccccc32)cs1 ZINC000076718100 341212959 /nfs/dbraw/zinc/21/29/59/341212959.db2.gz WPDULEBFYKJVGJ-CXAGYDPISA-N 1 2 316.470 4.360 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)[C@@H]2CCc3ccccc32)cs1 ZINC000076718100 341212960 /nfs/dbraw/zinc/21/29/60/341212960.db2.gz WPDULEBFYKJVGJ-CXAGYDPISA-N 1 2 316.470 4.360 20 0 DIADLO Clc1cnc(C[NH2+]Cc2cccc(Cl)c2Cl)s1 ZINC000547435858 341213466 /nfs/dbraw/zinc/21/34/66/341213466.db2.gz URPLZCRIGABUST-UHFFFAOYSA-N 1 2 307.633 4.393 20 0 DIADLO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2csc(Cc3ccccc3)n2)c1 ZINC000077171095 341219880 /nfs/dbraw/zinc/21/98/80/341219880.db2.gz JXAAKCUUVDRSTI-SFHVURJKSA-N 1 2 323.465 4.399 20 0 DIADLO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2csc(Cc3ccccc3)n2)c1 ZINC000077171095 341219881 /nfs/dbraw/zinc/21/98/81/341219881.db2.gz JXAAKCUUVDRSTI-SFHVURJKSA-N 1 2 323.465 4.399 20 0 DIADLO C[C@H](c1ccccc1F)N(C)Cc1[nH+]ccn1Cc1ccccc1 ZINC000077183827 341220124 /nfs/dbraw/zinc/22/01/24/341220124.db2.gz TYTBKSCMHCGMTH-MRXNPFEDSA-N 1 2 323.415 4.264 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1csc(C2CC2)n1 ZINC000134875624 341225710 /nfs/dbraw/zinc/22/57/10/341225710.db2.gz XMUQZVADEZDVCJ-JTQLQIEISA-N 1 2 308.397 4.492 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000134875624 341225711 /nfs/dbraw/zinc/22/57/11/341225711.db2.gz XMUQZVADEZDVCJ-JTQLQIEISA-N 1 2 308.397 4.492 20 0 DIADLO COc1ccc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)nc1 ZINC000547671891 341226525 /nfs/dbraw/zinc/22/65/25/341226525.db2.gz GVURFTPFUYCGIB-ZDUSSCGKSA-N 1 2 316.832 4.469 20 0 DIADLO COc1ccc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)nc1 ZINC000547671891 341226526 /nfs/dbraw/zinc/22/65/26/341226526.db2.gz GVURFTPFUYCGIB-ZDUSSCGKSA-N 1 2 316.832 4.469 20 0 DIADLO Brc1cccc([C@H]2CCC[N@@H+]2Cc2nccs2)c1 ZINC000134996606 341228285 /nfs/dbraw/zinc/22/82/85/341228285.db2.gz HHLRRBYDRKPGIV-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cccc([C@H]2CCC[N@H+]2Cc2nccs2)c1 ZINC000134996606 341228286 /nfs/dbraw/zinc/22/82/86/341228286.db2.gz HHLRRBYDRKPGIV-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2csc(C3CC3)n2)c1 ZINC000135112214 341231236 /nfs/dbraw/zinc/23/12/36/341231236.db2.gz CJKURDVJJMPMGA-MRXNPFEDSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2csc(C3CC3)n2)c1 ZINC000135112214 341231237 /nfs/dbraw/zinc/23/12/37/341231237.db2.gz CJKURDVJJMPMGA-MRXNPFEDSA-N 1 2 302.418 4.497 20 0 DIADLO Cc1cccn2cc(CSCc3csc(C4CC4)n3)[nH+]c12 ZINC000135264349 341234808 /nfs/dbraw/zinc/23/48/08/341234808.db2.gz YRKSBKZOXQGURX-UHFFFAOYSA-N 1 2 315.467 4.410 20 0 DIADLO Clc1snnc1C[N@@H+]1CCC[C@@H]1CCCc1ccccc1 ZINC000135361007 341238049 /nfs/dbraw/zinc/23/80/49/341238049.db2.gz PPCFRRTXVCGNOJ-AWEZNQCLSA-N 1 2 321.877 4.179 20 0 DIADLO Clc1snnc1C[N@H+]1CCC[C@@H]1CCCc1ccccc1 ZINC000135361007 341238050 /nfs/dbraw/zinc/23/80/50/341238050.db2.gz PPCFRRTXVCGNOJ-AWEZNQCLSA-N 1 2 321.877 4.179 20 0 DIADLO CC(C)c1cccc(N(C)Cc2[nH+]ccn2CC(F)(F)F)c1 ZINC000078489009 341242988 /nfs/dbraw/zinc/24/29/88/341242988.db2.gz NSXABSSPYGYOBV-UHFFFAOYSA-N 1 2 311.351 4.205 20 0 DIADLO Cc1cc(F)ccc1CSCc1[nH+]ccn1CC(F)(F)F ZINC000548151063 341249602 /nfs/dbraw/zinc/24/96/02/341249602.db2.gz IVIQNJUWUGYMSV-UHFFFAOYSA-N 1 2 318.339 4.326 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2cc(F)c(F)cc2F)sc1C ZINC000136183844 341254631 /nfs/dbraw/zinc/25/46/31/341254631.db2.gz PITUKVROOPLVBK-UHFFFAOYSA-N 1 2 314.376 4.202 20 0 DIADLO COC[C@@H]([NH2+]Cc1cnc(C2CCCC2)s1)c1ccc(C)o1 ZINC000136270096 341256103 /nfs/dbraw/zinc/25/61/03/341256103.db2.gz RUSWSUBNECOHKX-OAHLLOKOSA-N 1 2 320.458 4.179 20 0 DIADLO CC1(C)CC(CNC(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000548386970 341258290 /nfs/dbraw/zinc/25/82/90/341258290.db2.gz ODFYNXDHZNGLGW-UHFFFAOYSA-N 1 2 310.397 4.040 20 0 DIADLO Cc1[nH]c(CNc2ccccc2CN(C)c2ccccc2)[nH+]c1C ZINC000564350800 341260594 /nfs/dbraw/zinc/26/05/94/341260594.db2.gz OXAIPCWAEGBGQC-UHFFFAOYSA-N 1 2 320.440 4.275 20 0 DIADLO CC[C@@H](C(=O)Nc1cccc(-c2[nH+]ccn2C)c1)c1ccccc1 ZINC000079586864 341261702 /nfs/dbraw/zinc/26/17/02/341261702.db2.gz XMJWIBUULLCOLK-GOSISDBHSA-N 1 2 319.408 4.219 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@@H+]2Cc2nc3ccccc3[nH]2)cc1 ZINC000548485137 341263331 /nfs/dbraw/zinc/26/33/31/341263331.db2.gz WAUZUDPFODBQBH-SFHVURJKSA-N 1 2 323.465 4.161 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@H+]2Cc2nc3ccccc3[nH]2)cc1 ZINC000548485137 341263332 /nfs/dbraw/zinc/26/33/32/341263332.db2.gz WAUZUDPFODBQBH-SFHVURJKSA-N 1 2 323.465 4.161 20 0 DIADLO Cc1cccnc1C[N@@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000548623219 341267570 /nfs/dbraw/zinc/26/75/70/341267570.db2.gz BJOSXLNPRJPKLI-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cccnc1C[N@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000548623219 341267571 /nfs/dbraw/zinc/26/75/71/341267571.db2.gz BJOSXLNPRJPKLI-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000548628466 341267755 /nfs/dbraw/zinc/26/77/55/341267755.db2.gz FFLYMBGGGFLRKT-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000548628466 341267756 /nfs/dbraw/zinc/26/77/56/341267756.db2.gz FFLYMBGGGFLRKT-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2cnc(-c3ccccc3)s2)s1 ZINC000080040822 341268931 /nfs/dbraw/zinc/26/89/31/341268931.db2.gz GVKRHOHVQLZMCM-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2cnc(-c3ccccc3)s2)s1 ZINC000080040822 341268932 /nfs/dbraw/zinc/26/89/32/341268932.db2.gz GVKRHOHVQLZMCM-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO CCc1cnccc1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000137047409 341271205 /nfs/dbraw/zinc/27/12/05/341271205.db2.gz JKTPWVUGSWBBOH-UHFFFAOYSA-N 1 2 319.364 4.084 20 0 DIADLO CC[N@H+](Cc1nc(C)c2ccccc2n1)[C@H](C)c1cccc(O)c1 ZINC000080931652 341276836 /nfs/dbraw/zinc/27/68/36/341276836.db2.gz FNBASAGEFPKWTR-OAHLLOKOSA-N 1 2 321.424 4.227 20 0 DIADLO CC[N@@H+](Cc1nc(C)c2ccccc2n1)[C@H](C)c1cccc(O)c1 ZINC000080931652 341276837 /nfs/dbraw/zinc/27/68/37/341276837.db2.gz FNBASAGEFPKWTR-OAHLLOKOSA-N 1 2 321.424 4.227 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccccc2OC(C)C)s1 ZINC000548916924 341280840 /nfs/dbraw/zinc/28/08/40/341280840.db2.gz ODDBMTCEOPOGDD-VXGBXAGGSA-N 1 2 305.447 4.046 20 0 DIADLO Cc1c(C(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)ccn1C(C)C ZINC000549089279 341285823 /nfs/dbraw/zinc/28/58/23/341285823.db2.gz VJLXIPKAFJUTAR-UHFFFAOYSA-N 1 2 308.385 4.020 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)cn1 ZINC000549422985 341294212 /nfs/dbraw/zinc/29/42/12/341294212.db2.gz XEMAFQOZTYNSDA-KRWDZBQOSA-N 1 2 321.827 4.188 20 0 DIADLO CC(C)n1cc(C[N@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)cn1 ZINC000549422985 341294213 /nfs/dbraw/zinc/29/42/13/341294213.db2.gz XEMAFQOZTYNSDA-KRWDZBQOSA-N 1 2 321.827 4.188 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1C[C@H](C)OC[C@H]1c1ccccc1 ZINC000549463997 341295182 /nfs/dbraw/zinc/29/51/82/341295182.db2.gz BJAVNDIGPUZXFB-KKSFZXQISA-N 1 2 324.468 4.475 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1C[C@H](C)OC[C@H]1c1ccccc1 ZINC000549463997 341295183 /nfs/dbraw/zinc/29/51/83/341295183.db2.gz BJAVNDIGPUZXFB-KKSFZXQISA-N 1 2 324.468 4.475 20 0 DIADLO CCc1nc(C(C)C)ccc1C[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC000549464278 341295196 /nfs/dbraw/zinc/29/51/96/341295196.db2.gz SISVQIIQNXXBON-OAQYLSRUSA-N 1 2 324.468 4.341 20 0 DIADLO CCc1nc(C(C)C)ccc1C[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC000549464278 341295197 /nfs/dbraw/zinc/29/51/97/341295197.db2.gz SISVQIIQNXXBON-OAQYLSRUSA-N 1 2 324.468 4.341 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2csc([C@H](C)OC)n2)cc1 ZINC000245461786 341295521 /nfs/dbraw/zinc/29/55/21/341295521.db2.gz GCHDIZHGKDNNNM-STQMWFEESA-N 1 2 320.458 4.052 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2csc([C@H](C)OC)n2)cc1 ZINC000245461786 341295522 /nfs/dbraw/zinc/29/55/22/341295522.db2.gz GCHDIZHGKDNNNM-STQMWFEESA-N 1 2 320.458 4.052 20 0 DIADLO COc1ccc(F)c(C[NH2+]Cc2cc(Cl)sc2Cl)c1 ZINC000549803619 341303444 /nfs/dbraw/zinc/30/34/44/341303444.db2.gz GERRQODOSQDFFV-UHFFFAOYSA-N 1 2 320.216 4.492 20 0 DIADLO Cc1sccc1C[NH2+][C@H](CO)c1c(Cl)cccc1Cl ZINC000549817319 341304103 /nfs/dbraw/zinc/30/41/03/341304103.db2.gz KHHXKMVHWDCLLI-CYBMUJFWSA-N 1 2 316.253 4.187 20 0 DIADLO Cc1ccccc1C(C)(C)[NH2+]Cc1noc(C2CCCCC2)n1 ZINC000549868492 341305681 /nfs/dbraw/zinc/30/56/81/341305681.db2.gz WOWJRNMGWRUJJL-UHFFFAOYSA-N 1 2 313.445 4.451 20 0 DIADLO CC[C@H](C[C@@H](C)CC)[NH2+][C@@H](c1noc(C)n1)c1ccccc1F ZINC000245652561 341308086 /nfs/dbraw/zinc/30/80/86/341308086.db2.gz BNUOIFCXEIRGHU-DXCKQFNASA-N 1 2 319.424 4.411 20 0 DIADLO COC1(CC[N@@H+]2CCn3c(cc4cc(Cl)ccc43)C2)CCC1 ZINC000549997237 341308415 /nfs/dbraw/zinc/30/84/15/341308415.db2.gz HPOPQYUETAGNAU-UHFFFAOYSA-N 1 2 318.848 4.070 20 0 DIADLO COC1(CC[N@H+]2CCn3c(cc4cc(Cl)ccc43)C2)CCC1 ZINC000549997237 341308416 /nfs/dbraw/zinc/30/84/16/341308416.db2.gz HPOPQYUETAGNAU-UHFFFAOYSA-N 1 2 318.848 4.070 20 0 DIADLO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+]1CCC[C@@H]1CF ZINC000550008280 341308674 /nfs/dbraw/zinc/30/86/74/341308674.db2.gz MRVKGDOWLXCQEX-BXUZGUMPSA-N 1 2 308.784 4.490 20 0 DIADLO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1CCC[C@@H]1CF ZINC000550008280 341308675 /nfs/dbraw/zinc/30/86/75/341308675.db2.gz MRVKGDOWLXCQEX-BXUZGUMPSA-N 1 2 308.784 4.490 20 0 DIADLO FC[C@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1Br ZINC000550029764 341308949 /nfs/dbraw/zinc/30/89/49/341308949.db2.gz WKABOJAKJJJSFU-LLVKDONJSA-N 1 2 306.606 4.036 20 0 DIADLO FC[C@H]1CCC[N@H+]1Cc1ccc(Cl)cc1Br ZINC000550029764 341308950 /nfs/dbraw/zinc/30/89/50/341308950.db2.gz WKABOJAKJJJSFU-LLVKDONJSA-N 1 2 306.606 4.036 20 0 DIADLO Cc1ncsc1C[N@H+]1C[C@H](c2ccccc2Cl)OC[C@H]1C ZINC000245708532 341311170 /nfs/dbraw/zinc/31/11/70/341311170.db2.gz FMELWGUAPQGXNP-IAQYHMDHSA-N 1 2 322.861 4.067 20 0 DIADLO Cc1ncsc1C[N@@H+]1C[C@H](c2ccccc2Cl)OC[C@H]1C ZINC000245708532 341311171 /nfs/dbraw/zinc/31/11/71/341311171.db2.gz FMELWGUAPQGXNP-IAQYHMDHSA-N 1 2 322.861 4.067 20 0 DIADLO Fc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000550442831 341317081 /nfs/dbraw/zinc/31/70/81/341317081.db2.gz ANBNQFCWKZJPCU-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc(C[N@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000550442831 341317082 /nfs/dbraw/zinc/31/70/82/341317082.db2.gz ANBNQFCWKZJPCU-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@@H+]1Cc2ccccc2C(C)(C)C1 ZINC000550645594 341320281 /nfs/dbraw/zinc/32/02/81/341320281.db2.gz DXJGMSIXRWORCN-ZDUSSCGKSA-N 1 2 313.445 4.222 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@H+]1Cc2ccccc2C(C)(C)C1 ZINC000550645594 341320282 /nfs/dbraw/zinc/32/02/82/341320282.db2.gz DXJGMSIXRWORCN-ZDUSSCGKSA-N 1 2 313.445 4.222 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(Br)s2)no1 ZINC000550909530 341326559 /nfs/dbraw/zinc/32/65/59/341326559.db2.gz ABCVSQUUVQITHT-RKDXNWHRSA-N 1 2 315.236 4.219 20 0 DIADLO COc1cc(C)[nH+]c(COc2cnc3ccc(Cl)cc3c2)c1 ZINC000550983548 341328312 /nfs/dbraw/zinc/32/83/12/341328312.db2.gz RNLZZFBDTJSDSL-UHFFFAOYSA-N 1 2 314.772 4.179 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)cs1)c1ccncc1F ZINC000551030384 341329630 /nfs/dbraw/zinc/32/96/30/341329630.db2.gz NMIXMQDMKMCNHN-MNOVXSKESA-N 1 2 307.438 4.387 20 0 DIADLO Cc1ccc2nc(C[NH2+]Cc3ccc(-c4ccccc4)o3)cn2c1 ZINC000551186217 341333486 /nfs/dbraw/zinc/33/34/86/341333486.db2.gz HMKNTMLUETVRCC-UHFFFAOYSA-N 1 2 317.392 4.193 20 0 DIADLO CC(F)(F)C[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000551255294 341335560 /nfs/dbraw/zinc/33/55/60/341335560.db2.gz PARLHVIEIPPVQX-HNNXBMFYSA-N 1 2 310.775 4.264 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1ccc(C(F)(F)F)cn1 ZINC000551382424 341340071 /nfs/dbraw/zinc/34/00/71/341340071.db2.gz ZCKCENYTIHOBOA-LLVKDONJSA-N 1 2 312.310 4.433 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccc(C(F)(F)F)cn1 ZINC000551382424 341340072 /nfs/dbraw/zinc/34/00/72/341340072.db2.gz ZCKCENYTIHOBOA-LLVKDONJSA-N 1 2 312.310 4.433 20 0 DIADLO C[NH+](C)[C@H](c1nc(CC2CCCC2)no1)c1cccc(Cl)c1 ZINC000551510999 341343417 /nfs/dbraw/zinc/34/34/17/341343417.db2.gz SOHYRIDDCGHSLC-INIZCTEOSA-N 1 2 319.836 4.107 20 0 DIADLO CCOc1cc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)ccc1C ZINC000551572809 341346082 /nfs/dbraw/zinc/34/60/82/341346082.db2.gz KRKVSITYEXJBGH-SFHVURJKSA-N 1 2 307.397 4.318 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCC=C(c3ccccc3)C2)s1 ZINC000551827506 341353137 /nfs/dbraw/zinc/35/31/37/341353137.db2.gz UIAGRKIKXDVVLU-UHFFFAOYSA-N 1 2 324.371 4.451 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCC=C(c3ccccc3)C2)s1 ZINC000551827506 341353138 /nfs/dbraw/zinc/35/31/38/341353138.db2.gz UIAGRKIKXDVVLU-UHFFFAOYSA-N 1 2 324.371 4.451 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc2oc3ccccc3c2c1)n1cc[nH+]c1 ZINC000551913051 341354772 /nfs/dbraw/zinc/35/47/72/341354772.db2.gz YJZLJCIHZFMEBN-ZDUSSCGKSA-N 1 2 319.364 4.372 20 0 DIADLO Cc1cc(NC(=O)[C@@H](C)c2ccc(Cl)c(Cl)c2)c(C)c[nH+]1 ZINC000551957998 341356090 /nfs/dbraw/zinc/35/60/90/341356090.db2.gz OQRDAEVSHJATLX-NSHDSACASA-N 1 2 323.223 4.169 20 0 DIADLO C[C@H]([NH2+][C@@H]1CC2(CCC2)Oc2ccccc21)c1cscn1 ZINC000552002265 341359040 /nfs/dbraw/zinc/35/90/40/341359040.db2.gz XVQDQQXWLAILOK-GXTWGEPZSA-N 1 2 300.427 4.240 20 0 DIADLO Cc1ccc2c(c1)[C@H]([NH2+]Cc1cscc1Br)CO2 ZINC000552012515 341360267 /nfs/dbraw/zinc/36/02/67/341360267.db2.gz ZZLWHJZIBBUFEI-CYBMUJFWSA-N 1 2 324.243 4.042 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)[C@H]2CCc3ccccc32)n1 ZINC000247132159 341361301 /nfs/dbraw/zinc/36/13/01/341361301.db2.gz ASUAEMLTUUZXMS-DOMZBBRYSA-N 1 2 317.458 4.003 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)[C@H]2CCc3ccccc32)n1 ZINC000247132159 341361302 /nfs/dbraw/zinc/36/13/02/341361302.db2.gz ASUAEMLTUUZXMS-DOMZBBRYSA-N 1 2 317.458 4.003 20 0 DIADLO CC[C@@H]([NH2+]C1(C(F)F)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000552053713 341365352 /nfs/dbraw/zinc/36/53/52/341365352.db2.gz SZBMXJMRLSUVKR-LLVKDONJSA-N 1 2 309.278 4.424 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2ccncc2Cl)[C@@H](C)CO1 ZINC000247506567 341366014 /nfs/dbraw/zinc/36/60/14/341366014.db2.gz MDNXYYIZPUUAMI-KSSFIOAISA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2ccncc2Cl)[C@@H](C)CO1 ZINC000247506567 341366015 /nfs/dbraw/zinc/36/60/15/341366015.db2.gz MDNXYYIZPUUAMI-KSSFIOAISA-N 1 2 316.832 4.005 20 0 DIADLO Cc1nc([C@H]([NH2+][C@H]2CC[C@@H]2C(C)C)c2ccc(Cl)cc2)no1 ZINC000552070897 341367541 /nfs/dbraw/zinc/36/75/41/341367541.db2.gz IHKFZKHVEWWKIX-OWCLPIDISA-N 1 2 319.836 4.145 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247563115 341367557 /nfs/dbraw/zinc/36/75/57/341367557.db2.gz RVNXTYCXQYVFRL-BXUZGUMPSA-N 1 2 309.381 4.161 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247563115 341367558 /nfs/dbraw/zinc/36/75/58/341367558.db2.gz RVNXTYCXQYVFRL-BXUZGUMPSA-N 1 2 309.381 4.161 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CC4(CCC4)[C@@H]3c3ccccc3)cn2c1 ZINC000552085983 341368581 /nfs/dbraw/zinc/36/85/81/341368581.db2.gz UDNYOKUYEDNJLI-FQEVSTJZSA-N 1 2 317.436 4.370 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CC4(CCC4)[C@@H]3c3ccccc3)cn2c1 ZINC000552085983 341368582 /nfs/dbraw/zinc/36/85/82/341368582.db2.gz UDNYOKUYEDNJLI-FQEVSTJZSA-N 1 2 317.436 4.370 20 0 DIADLO Cc1ncc(C[N@H+]2C[C@H](c3cc(C)ccc3C)OC[C@@H]2C)s1 ZINC000247709320 341369516 /nfs/dbraw/zinc/36/95/16/341369516.db2.gz ZSNAMJNQXBTIHL-KBXCAEBGSA-N 1 2 316.470 4.030 20 0 DIADLO Cc1ncc(C[N@@H+]2C[C@H](c3cc(C)ccc3C)OC[C@@H]2C)s1 ZINC000247709320 341369517 /nfs/dbraw/zinc/36/95/17/341369517.db2.gz ZSNAMJNQXBTIHL-KBXCAEBGSA-N 1 2 316.470 4.030 20 0 DIADLO CC(C)[C@H]1C[N@H+](Cc2csc(Cl)c2Cl)CCCO1 ZINC000552159974 341374541 /nfs/dbraw/zinc/37/45/41/341374541.db2.gz RWZPKDWNMZGSCA-LLVKDONJSA-N 1 2 308.274 4.302 20 0 DIADLO CC(C)[C@H]1C[N@@H+](Cc2csc(Cl)c2Cl)CCCO1 ZINC000552159974 341374542 /nfs/dbraw/zinc/37/45/42/341374542.db2.gz RWZPKDWNMZGSCA-LLVKDONJSA-N 1 2 308.274 4.302 20 0 DIADLO Cc1nc(C[N@@H+]([C@H](C)c2ccco2)C2CC2)nc2ccccc12 ZINC000086232934 341379622 /nfs/dbraw/zinc/37/96/22/341379622.db2.gz KEYZUZZRNINRPH-CQSZACIVSA-N 1 2 307.397 4.257 20 0 DIADLO Cc1nc(C[N@H+]([C@H](C)c2ccco2)C2CC2)nc2ccccc12 ZINC000086232934 341379623 /nfs/dbraw/zinc/37/96/23/341379623.db2.gz KEYZUZZRNINRPH-CQSZACIVSA-N 1 2 307.397 4.257 20 0 DIADLO Cc1cccc(COc2cccc(N[C@@H](C)c3[nH]cc[nH+]3)c2)c1 ZINC000552283061 341384005 /nfs/dbraw/zinc/38/40/05/341384005.db2.gz WTFFCSQEMZPLGM-HNNXBMFYSA-N 1 2 307.397 4.470 20 0 DIADLO COc1ccc(F)c(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000552284013 341384074 /nfs/dbraw/zinc/38/40/74/341384074.db2.gz PEFVYBNAOVKSHG-INIZCTEOSA-N 1 2 303.381 4.291 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)c(F)cc1Br)c1ccco1 ZINC000552333549 341387277 /nfs/dbraw/zinc/38/72/77/341387277.db2.gz IJDBWIJEPYUIFN-MRVPVSSYSA-N 1 2 316.145 4.171 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)c(F)cc1Br)c1ccoc1 ZINC000552338979 341387595 /nfs/dbraw/zinc/38/75/95/341387595.db2.gz VCIQVBVMAGNOPL-MRVPVSSYSA-N 1 2 316.145 4.171 20 0 DIADLO Cc1ccc2[nH+]cc(CN3CC[C@@H]3c3ccc(Cl)cc3)n2c1 ZINC000552343513 341388049 /nfs/dbraw/zinc/38/80/49/341388049.db2.gz DOVAPMHAEOIJTD-QGZVFWFLSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1ccc2ncc(C[N@@H+]3CC[C@@H]3c3ccc(Cl)cc3)n2c1 ZINC000552343513 341388050 /nfs/dbraw/zinc/38/80/50/341388050.db2.gz DOVAPMHAEOIJTD-QGZVFWFLSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1ccc2ncc(C[N@H+]3CC[C@@H]3c3ccc(Cl)cc3)n2c1 ZINC000552343513 341388051 /nfs/dbraw/zinc/38/80/51/341388051.db2.gz DOVAPMHAEOIJTD-QGZVFWFLSA-N 1 2 311.816 4.243 20 0 DIADLO C[C@@H](C[N@@H+]1Cc2cnn(-c3ccccc3)c2C1)c1ccc(F)cc1 ZINC000552442613 341394117 /nfs/dbraw/zinc/39/41/17/341394117.db2.gz FWFVQEPUATXWHI-HNNXBMFYSA-N 1 2 321.399 4.131 20 0 DIADLO C[C@@H](C[N@H+]1Cc2cnn(-c3ccccc3)c2C1)c1ccc(F)cc1 ZINC000552442613 341394118 /nfs/dbraw/zinc/39/41/18/341394118.db2.gz FWFVQEPUATXWHI-HNNXBMFYSA-N 1 2 321.399 4.131 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccccn1 ZINC000090572259 341417205 /nfs/dbraw/zinc/41/72/05/341417205.db2.gz ZTEMVILJONKONX-LJQANCHMSA-N 1 2 312.461 4.270 20 0 DIADLO Clc1cccc2c(N3CCC[C@H](OCC4CC4)C3)cc[nH+]c12 ZINC000553540696 341431446 /nfs/dbraw/zinc/43/14/46/341431446.db2.gz GUSRUBNYKLIRIK-AWEZNQCLSA-N 1 2 316.832 4.284 20 0 DIADLO CC(C)OCCC[NH2+][C@@H](c1cccc(OC(C)C)c1)C(F)F ZINC000556238641 341498638 /nfs/dbraw/zinc/49/86/38/341498638.db2.gz LZNPBGFASBLDHV-INIZCTEOSA-N 1 2 315.404 4.185 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc(F)c(C3CC3)c2)cc(C)[nH+]1 ZINC000565533537 341530395 /nfs/dbraw/zinc/53/03/95/341530395.db2.gz QCDWEZLLLDVEGU-UHFFFAOYSA-N 1 2 313.376 4.037 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1c1noc([C@H](c2ccccc2)[NH+](C)C)n1 ZINC000566013213 341545413 /nfs/dbraw/zinc/54/54/13/341545413.db2.gz IXQJKCCPZWFODU-PVAVHDDUSA-N 1 2 313.445 4.404 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc(C2CC3(CCC3)C2)n1 ZINC000566217744 341551094 /nfs/dbraw/zinc/55/10/94/341551094.db2.gz YGAZEYZFNVSUQW-UHFFFAOYSA-N 1 2 322.412 4.018 20 0 DIADLO Cc1[nH]c(CNc2ccc(COCc3ccccc3)cc2)[nH+]c1C ZINC000566497458 341560134 /nfs/dbraw/zinc/56/01/34/341560134.db2.gz XLPLDXAJNOAJNH-UHFFFAOYSA-N 1 2 321.424 4.355 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1OC(F)(F)F)c1cscn1 ZINC000566748463 341567168 /nfs/dbraw/zinc/56/71/68/341567168.db2.gz KUFHMHGUCMILOH-QMMMGPOBSA-N 1 2 320.311 4.032 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2nccc3ccccc32)s1 ZINC000566766715 341567550 /nfs/dbraw/zinc/56/75/50/341567550.db2.gz BMAIYGBSMCMGIX-GFCCVEGCSA-N 1 2 312.442 4.061 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nnc(C)o1)c1ccc(Cl)cc1Cl ZINC000566837512 341569540 /nfs/dbraw/zinc/56/95/40/341569540.db2.gz FDNQCDWWHCDBAI-ISVAXAHUSA-N 1 2 314.216 4.487 20 0 DIADLO C[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000566985083 341573590 /nfs/dbraw/zinc/57/35/90/341573590.db2.gz IMMGJTLTJJKSLG-RHSMWYFYSA-N 1 2 310.397 4.182 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2nn(-c3ccccc3)cc21)c1cscn1 ZINC000567250514 341591267 /nfs/dbraw/zinc/59/12/67/341591267.db2.gz NBZZLKFCUWPNPK-XJKSGUPXSA-N 1 2 324.453 4.057 20 0 DIADLO C[C@H]([NH2+]Cc1nnsc1Cl)c1cccc2ccccc21 ZINC000155895860 341614498 /nfs/dbraw/zinc/61/44/98/341614498.db2.gz RXMMOMVTPJEKPM-JTQLQIEISA-N 1 2 303.818 4.196 20 0 DIADLO O=C(NC[C@@H]1C[C@H]1C1CCC1)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000567726761 341630115 /nfs/dbraw/zinc/63/01/15/341630115.db2.gz VZOVLCHBTIUKHO-LPHOPBHVSA-N 1 2 322.408 4.040 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)s1 ZINC000273619506 341636717 /nfs/dbraw/zinc/63/67/17/341636717.db2.gz QJQVANQDJDJVQT-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO CCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2nnc(C)s2)cc1 ZINC000274230082 341641840 /nfs/dbraw/zinc/64/18/40/341641840.db2.gz PKSJBSRSNYZHDV-NEPJUHHUSA-N 1 2 305.447 4.047 20 0 DIADLO CC(C)[C@@H](C)C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000568925533 341685651 /nfs/dbraw/zinc/68/56/51/341685651.db2.gz SBXBNYDPWPXBTG-CQSZACIVSA-N 1 2 311.429 4.117 20 0 DIADLO Cc1cc[nH+]c(N[C@@H]2CCCC(F)(F)C2)c1Br ZINC000569016436 341688310 /nfs/dbraw/zinc/68/83/10/341688310.db2.gz ZMMQHRRWBIJQDU-SECBINFHSA-N 1 2 305.166 4.142 20 0 DIADLO CSc1ccc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)s1 ZINC000572849698 341706397 /nfs/dbraw/zinc/70/63/97/341706397.db2.gz BZEOKPNAIPIFRI-UHFFFAOYSA-N 1 2 321.364 4.316 20 0 DIADLO OC[C@@H]1CCC[C@H](CNc2cc[nH+]c3c(Cl)cccc23)C1 ZINC000575018521 341772159 /nfs/dbraw/zinc/77/21/59/341772159.db2.gz GSCQSTBUJSUTFX-QWHCGFSZSA-N 1 2 304.821 4.099 20 0 DIADLO c1csc([C@H](Nc2cc[nH+]c(C3CC3)n2)c2ccccc2)n1 ZINC000171926084 341788111 /nfs/dbraw/zinc/78/81/11/341788111.db2.gz LVELMENSPKOYNX-OAHLLOKOSA-N 1 2 308.410 4.012 20 0 DIADLO CCCc1c(NCc2[nH]c(C)c(C)[nH+]2)cnn1-c1ccccc1C ZINC000576479264 341848616 /nfs/dbraw/zinc/84/86/16/341848616.db2.gz CTYUEFIHFBQWCX-UHFFFAOYSA-N 1 2 323.444 4.085 20 0 DIADLO C[C@H](CC(=O)N1c2ccccc2[C@H](C)CC1(C)C)n1cc[nH+]c1 ZINC000580572229 341879240 /nfs/dbraw/zinc/87/92/40/341879240.db2.gz UUYPBEPYRGEQBH-HUUCEWRRSA-N 1 2 311.429 4.153 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)CC2(C(F)(F)F)CC2)[nH+]1 ZINC000577256090 341900444 /nfs/dbraw/zinc/90/04/44/341900444.db2.gz XHQHOTHBHJXAGX-UHFFFAOYSA-N 1 2 323.318 4.056 20 0 DIADLO CCOc1cccc([C@H](C)[NH2+]Cc2nc(C)c3ccccc3n2)c1 ZINC000178460591 341955163 /nfs/dbraw/zinc/95/51/63/341955163.db2.gz KMTVDWOZJRRDCI-AWEZNQCLSA-N 1 2 321.424 4.188 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H](c2ccc(F)c(C)c2)C2CC2)nn1C ZINC000421340741 518185961 /nfs/dbraw/zinc/18/59/61/518185961.db2.gz JTWHVPLGFQCHDA-QGZVFWFLSA-N 1 2 321.827 4.070 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cc(C)cc(C)c2)[nH+]1 ZINC000371246591 518191644 /nfs/dbraw/zinc/19/16/44/518191644.db2.gz FRHQRDRXVIXEFE-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@H](CC2CCC2)c2ccccc2)no1 ZINC000182297529 519100220 /nfs/dbraw/zinc/10/02/20/519100220.db2.gz PZMWTZQCMYWOEE-MRXNPFEDSA-N 1 2 313.445 4.388 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1ccccc1 ZINC000181799727 519250564 /nfs/dbraw/zinc/25/05/64/519250564.db2.gz XTHOXIMUEZYOHW-OAHLLOKOSA-N 1 2 301.434 4.244 20 0 DIADLO CC(=O)Nc1cccc([C@@H](C)Nc2ccc([NH+](C)C)c(C)c2)c1 ZINC000182849845 519747635 /nfs/dbraw/zinc/74/76/35/519747635.db2.gz VUPGLZNGPMFFKN-CQSZACIVSA-N 1 2 311.429 4.193 20 0 DIADLO CC(C)c1ccc(C[N@H+](C)Cc2nnc(C3CC3)n2C2CC2)cc1 ZINC000181074481 519835758 /nfs/dbraw/zinc/83/57/58/519835758.db2.gz FZTONJCNFZKOPB-UHFFFAOYSA-N 1 2 324.472 4.246 20 0 DIADLO CC(C)c1ccc(C[N@@H+](C)Cc2nnc(C3CC3)n2C2CC2)cc1 ZINC000181074481 519835759 /nfs/dbraw/zinc/83/57/59/519835759.db2.gz FZTONJCNFZKOPB-UHFFFAOYSA-N 1 2 324.472 4.246 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)no1 ZINC000180291769 519864179 /nfs/dbraw/zinc/86/41/79/519864179.db2.gz AXLNWYVYKWXPDB-KRWDZBQOSA-N 1 2 317.408 4.353 20 0 DIADLO CC(C)c1nc([C@@H]2CCC[N@@H+]2Cc2ccc3ncccc3c2)no1 ZINC000127804621 519867222 /nfs/dbraw/zinc/86/72/22/519867222.db2.gz AFQGGAHEHMNRFR-KRWDZBQOSA-N 1 2 322.412 4.078 20 0 DIADLO CC(C)c1nc([C@@H]2CCC[N@H+]2Cc2ccc3ncccc3c2)no1 ZINC000127804621 519867223 /nfs/dbraw/zinc/86/72/23/519867223.db2.gz AFQGGAHEHMNRFR-KRWDZBQOSA-N 1 2 322.412 4.078 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2CN(C)Cc3ccccc32)cs1 ZINC000364247992 519867760 /nfs/dbraw/zinc/86/77/60/519867760.db2.gz GVHNWPXKPYANHY-BBRMVZONSA-N 1 2 315.486 4.104 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)n1 ZINC000182572720 519904706 /nfs/dbraw/zinc/90/47/06/519904706.db2.gz WKVSCWBAJHEIBQ-INIZCTEOSA-N 1 2 319.836 4.477 20 0 DIADLO CC(C)c1noc(C[NH2+]C2(c3cccc(Cl)c3)CCCC2)n1 ZINC000181458512 519904829 /nfs/dbraw/zinc/90/48/29/519904829.db2.gz GAHTXWFMZBFJPY-UHFFFAOYSA-N 1 2 319.836 4.406 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)n1 ZINC000181617981 519904914 /nfs/dbraw/zinc/90/49/14/519904914.db2.gz CYBBYFFHQSBSED-HNNXBMFYSA-N 1 2 323.387 4.348 20 0 DIADLO CCCCCCC(=O)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000268013420 519951990 /nfs/dbraw/zinc/95/19/90/519951990.db2.gz AATVIVRLTNGTLU-UHFFFAOYSA-N 1 2 303.381 4.052 20 0 DIADLO CCN(C(=O)Nc1ccc(C)[nH+]c1C)[C@H](C)Cc1ccsc1 ZINC000189112666 519996369 /nfs/dbraw/zinc/99/63/69/519996369.db2.gz TXSBDLWCXURCCH-CYBMUJFWSA-N 1 2 317.458 4.245 20 0 DIADLO CC(C)n1ccnc1C[N@H+](C)CCCOc1ccc(Cl)cc1 ZINC000107299298 520022952 /nfs/dbraw/zinc/02/29/52/520022952.db2.gz XJDPSKFVETYBFV-UHFFFAOYSA-N 1 2 321.852 4.018 20 0 DIADLO CC(C)n1ccnc1C[N@@H+](C)CCCOc1ccc(Cl)cc1 ZINC000107299298 520022965 /nfs/dbraw/zinc/02/29/65/520022965.db2.gz XJDPSKFVETYBFV-UHFFFAOYSA-N 1 2 321.852 4.018 20 0 DIADLO CC(C)n1cc[nH+]c1CN(C)Cc1cc(Cl)cc(Cl)c1 ZINC000107299126 520027605 /nfs/dbraw/zinc/02/76/05/520027605.db2.gz JGIREOIPDCSQQQ-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1ccnc1C[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000107299126 520027613 /nfs/dbraw/zinc/02/76/13/520027613.db2.gz JGIREOIPDCSQQQ-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1ccnc1C[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000107299126 520027621 /nfs/dbraw/zinc/02/76/21/520027621.db2.gz JGIREOIPDCSQQQ-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1cc[nH+]c1CN1CCc2c(Cl)c(Cl)ccc2C1 ZINC000338427085 520031647 /nfs/dbraw/zinc/03/16/47/520031647.db2.gz VEONERCKDMDQCA-UHFFFAOYSA-N 1 2 324.255 4.329 20 0 DIADLO CC(C)n1nccc1C[N@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000337138571 520098702 /nfs/dbraw/zinc/09/87/02/520098702.db2.gz QTJKQVOYLAKWHO-KSSFIOAISA-N 1 2 313.445 4.345 20 0 DIADLO CC(C)n1nccc1C[N@@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000337138571 520098703 /nfs/dbraw/zinc/09/87/03/520098703.db2.gz QTJKQVOYLAKWHO-KSSFIOAISA-N 1 2 313.445 4.345 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](Cc2ccco2)C(C)C)cs1 ZINC000336835968 520475540 /nfs/dbraw/zinc/47/55/40/520475540.db2.gz KUXVNTBTJAZQRR-CYBMUJFWSA-N 1 2 308.447 4.244 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](Cc2ccco2)C(C)C)cs1 ZINC000336835968 520475547 /nfs/dbraw/zinc/47/55/47/520475547.db2.gz KUXVNTBTJAZQRR-CYBMUJFWSA-N 1 2 308.447 4.244 20 0 DIADLO CCOc1cc(C)ccc1C[NH2+]Cc1ncc(CSC)s1 ZINC000339297479 520682127 /nfs/dbraw/zinc/68/21/27/520682127.db2.gz IAPANQBKNSXQAP-UHFFFAOYSA-N 1 2 322.499 4.003 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1ccc(F)cc1F ZINC000181680546 520782872 /nfs/dbraw/zinc/78/28/72/520782872.db2.gz SNWLTQIJGQJLIB-CQSZACIVSA-N 1 2 323.387 4.276 20 0 DIADLO CCC[C@@H]([NH2+]Cc1noc(C)n1)c1cccc(C(F)(F)F)c1 ZINC000181857699 520785384 /nfs/dbraw/zinc/78/53/84/520785384.db2.gz JQHAJZSNUYLLHD-CYBMUJFWSA-N 1 2 313.323 4.028 20 0 DIADLO CCCC[C@H]([NH2+]Cc1nc(C(C)C)no1)c1ccc(OC)cc1 ZINC000182143413 521241775 /nfs/dbraw/zinc/24/17/75/521241775.db2.gz UWDCZRCPPSCFOE-INIZCTEOSA-N 1 2 317.433 4.223 20 0 DIADLO CCCC[C@H]([NH2+]Cc1noc(CCC)n1)c1ccc(OC)cc1 ZINC000182144854 521242442 /nfs/dbraw/zinc/24/24/42/521242442.db2.gz HRWXMSOHASXVIG-INIZCTEOSA-N 1 2 317.433 4.052 20 0 DIADLO CC[N@H+](Cc1csc(-c2ccsc2)n1)Cc1ccccn1 ZINC000125314823 521443866 /nfs/dbraw/zinc/44/38/66/521443866.db2.gz HCCMINUPNPXBMX-UHFFFAOYSA-N 1 2 315.467 4.289 20 0 DIADLO CC[N@@H+](Cc1csc(-c2ccsc2)n1)Cc1ccccn1 ZINC000125314823 521443872 /nfs/dbraw/zinc/44/38/72/521443872.db2.gz HCCMINUPNPXBMX-UHFFFAOYSA-N 1 2 315.467 4.289 20 0 DIADLO CCCc1occc1C(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000336988882 521610884 /nfs/dbraw/zinc/61/08/84/521610884.db2.gz JXFKLWRZBPPEMK-UHFFFAOYSA-N 1 2 323.396 4.249 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@H](C)c2cc(C)cc(C)c2)n1 ZINC000182876866 521721926 /nfs/dbraw/zinc/72/19/26/521721926.db2.gz NFZORZDFXPKLRH-KGLIPLIRSA-N 1 2 319.474 4.351 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)c1c(C)c(CC)nc2ccccc21 ZINC000264976458 522082991 /nfs/dbraw/zinc/08/29/91/522082991.db2.gz FVVKPSUVGPZBAO-UHFFFAOYSA-N 1 2 319.408 4.315 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2nc(C)sc2C)s1 ZINC000336821011 522219239 /nfs/dbraw/zinc/21/92/39/522219239.db2.gz GEMOBQSEJKWHLI-SNVBAGLBSA-N 1 2 309.504 4.280 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2nc(C)sc2C)s1 ZINC000336821011 522219254 /nfs/dbraw/zinc/21/92/54/522219254.db2.gz GEMOBQSEJKWHLI-SNVBAGLBSA-N 1 2 309.504 4.280 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1cc(F)c(F)c(F)c1)c1ccc(C)o1 ZINC000156436299 522372363 /nfs/dbraw/zinc/37/23/63/522372363.db2.gz PWWCNXDYJPXVIQ-IINYFYTJSA-N 1 2 313.319 4.044 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2cc(C)ccc2OC)cs1 ZINC000162338546 522453591 /nfs/dbraw/zinc/45/35/91/522453591.db2.gz ITTUSBDUEXWSSJ-STQMWFEESA-N 1 2 304.459 4.434 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H]2CCc3c2c(F)ccc3F)cs1 ZINC000269812270 522457753 /nfs/dbraw/zinc/45/77/53/522457753.db2.gz HFCLAGRSWKRBIB-ZANVPECISA-N 1 2 308.397 4.322 20 0 DIADLO CC[C@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1ccc(Cl)cc1 ZINC000122225259 522675583 /nfs/dbraw/zinc/67/55/83/522675583.db2.gz YKEFZKPELJQVDC-ZDUSSCGKSA-N 1 2 307.825 4.261 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1cccc(Cl)c1 ZINC000182587104 522744843 /nfs/dbraw/zinc/74/48/43/522744843.db2.gz PQVJDHIJCCBDKL-YGRLFVJLSA-N 1 2 305.809 4.402 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(-c2ccoc2)no1)c1ccc(Cl)cc1 ZINC000105607842 522893389 /nfs/dbraw/zinc/89/33/89/522893389.db2.gz IZZHPUFHYFCUTF-CQSZACIVSA-N 1 2 317.776 4.224 20 0 DIADLO CC[C@@H](Nc1ccc2oc(C(C)(C)C)nc2c1)c1[nH+]ccn1C ZINC000179881953 522960222 /nfs/dbraw/zinc/96/02/22/522960222.db2.gz TVLFGHGFVGNRFI-CYBMUJFWSA-N 1 2 312.417 4.422 20 0 DIADLO CC[C@@H](Nc1cccc(-c2nc(C)c(C)o2)c1)c1[nH+]ccn1C ZINC000183018484 522960440 /nfs/dbraw/zinc/96/04/40/522960440.db2.gz NKIWAWBXMJDOPK-MRXNPFEDSA-N 1 2 310.401 4.255 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1csc(-c2ccoc2)n1 ZINC000130095189 522967997 /nfs/dbraw/zinc/96/79/97/522967997.db2.gz QUQIZFSAWWWKDM-MRXNPFEDSA-N 1 2 313.426 4.381 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1csc(-c2ccoc2)n1 ZINC000130095189 522968007 /nfs/dbraw/zinc/96/80/07/522968007.db2.gz QUQIZFSAWWWKDM-MRXNPFEDSA-N 1 2 313.426 4.381 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000130177737 522970558 /nfs/dbraw/zinc/97/05/58/522970558.db2.gz CHBWWEUOLQZXAZ-CQSZACIVSA-N 1 2 303.475 4.419 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000130177737 522970569 /nfs/dbraw/zinc/97/05/69/522970569.db2.gz CHBWWEUOLQZXAZ-CQSZACIVSA-N 1 2 303.475 4.419 20 0 DIADLO COCCCCC(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000191319460 523103461 /nfs/dbraw/zinc/10/34/61/523103461.db2.gz ZFSYNMQPEUOBKV-UHFFFAOYSA-N 1 2 314.429 4.422 20 0 DIADLO COCc1nc(C[NH2+][C@@H](C)c2oc3ccccc3c2C)cs1 ZINC000266173766 523204177 /nfs/dbraw/zinc/20/41/77/523204177.db2.gz DFSJVDFRUMBPFD-LBPRGKRZSA-N 1 2 316.426 4.195 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](Cc2cccs2)C(C)C)cs1 ZINC000267078307 523912709 /nfs/dbraw/zinc/91/27/09/523912709.db2.gz XHGDKWXXHOTGBI-GFCCVEGCSA-N 1 2 310.488 4.323 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](Cc2cccs2)C(C)C)cs1 ZINC000267078307 523912715 /nfs/dbraw/zinc/91/27/15/523912715.db2.gz XHGDKWXXHOTGBI-GFCCVEGCSA-N 1 2 310.488 4.323 20 0 DIADLO CCc1ccc(C[NH2+][C@H](C)c2nc(Cc3ccccc3)no2)cc1 ZINC000237154879 523946256 /nfs/dbraw/zinc/94/62/56/523946256.db2.gz CJMRVRJEZASRCC-OAHLLOKOSA-N 1 2 321.424 4.074 20 0 DIADLO CCc1ccc([C@H]2CCC[N@@H+]2[C@@H](C)c2nc(C(C)C)no2)o1 ZINC000265383651 524054799 /nfs/dbraw/zinc/05/47/99/524054799.db2.gz DFDRGMIFFSYENS-GXTWGEPZSA-N 1 2 303.406 4.247 20 0 DIADLO CCc1ccc([C@H]2CCC[N@H+]2[C@@H](C)c2nc(C(C)C)no2)o1 ZINC000265383651 524054801 /nfs/dbraw/zinc/05/48/01/524054801.db2.gz DFDRGMIFFSYENS-GXTWGEPZSA-N 1 2 303.406 4.247 20 0 DIADLO Cc1cccc(C)c1OC[C@H]([NH2+]Cc1ccon1)c1ccccc1 ZINC000181379738 524321623 /nfs/dbraw/zinc/32/16/23/524321623.db2.gz DJMOEZFMPPVLFN-IBGZPJMESA-N 1 2 322.408 4.201 20 0 DIADLO Cc1cccc(C[N@@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)n1 ZINC000338367302 524405898 /nfs/dbraw/zinc/40/58/98/524405898.db2.gz BAKCVMGKKATKMU-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1cccc(C[N@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)n1 ZINC000338367302 524405902 /nfs/dbraw/zinc/40/59/02/524405902.db2.gz BAKCVMGKKATKMU-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1cccc(C[NH2+][C@@H](C)c2nccs2)c1Br ZINC000191540822 524434897 /nfs/dbraw/zinc/43/48/97/524434897.db2.gz JNXRWPKESGDTAN-JTQLQIEISA-N 1 2 311.248 4.065 20 0 DIADLO Cc1cccc(COc2ccc([C@H](C)[NH2+]Cc3cocn3)cc2)c1 ZINC000182066969 524447301 /nfs/dbraw/zinc/44/73/01/524447301.db2.gz WXAFLLRIDZBXHU-INIZCTEOSA-N 1 2 322.408 4.413 20 0 DIADLO C[C@H](C[C@@H](O)c1cccs1)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000128871588 524621014 /nfs/dbraw/zinc/62/10/14/524621014.db2.gz BKJVGKYPARDSNO-MWLCHTKSSA-N 1 2 316.348 4.086 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117567596 524754923 /nfs/dbraw/zinc/75/49/23/524754923.db2.gz NDHMZRYKFDCJPG-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2ccc(F)cc2)c1 ZINC000268739194 524832276 /nfs/dbraw/zinc/83/22/76/524832276.db2.gz CMTSLSGHHZDRKJ-DNVCBOLYSA-N 1 2 323.415 4.308 20 0 DIADLO COc1ccc(OC)c(C[NH2+][C@H](C)c2csc(C(C)C)n2)c1 ZINC000124360111 524838330 /nfs/dbraw/zinc/83/83/30/524838330.db2.gz GYVWRVRCSNFSPG-GFCCVEGCSA-N 1 2 320.458 4.135 20 0 DIADLO Cc1ccc(F)cc1C[NH2+][C@H](C)c1nc(C2CCCCC2)no1 ZINC000180269329 524853875 /nfs/dbraw/zinc/85/38/75/524853875.db2.gz QQFYRMSWSYGYQD-CYBMUJFWSA-N 1 2 317.408 4.416 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@H](C)C[C@H]2c2ccco2)c(C)[nH+]1 ZINC000162259580 525140991 /nfs/dbraw/zinc/14/09/91/525140991.db2.gz ONNPJIGAZWGUCE-LRDDRELGSA-N 1 2 313.401 4.297 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1nc2c(s1)CCCC2 ZINC000130235819 525430075 /nfs/dbraw/zinc/43/00/75/525430075.db2.gz BVTUCPQUDSGFDC-JTQLQIEISA-N 1 2 308.397 4.151 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)cc1F)c1nc2c(s1)CCCC2 ZINC000265457615 525446659 /nfs/dbraw/zinc/44/66/59/525446659.db2.gz DAIMNRQGWKQTSP-JTQLQIEISA-N 1 2 308.397 4.151 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2noc(-c3ccccc3)n2)c(C)s1 ZINC000182763264 525467616 /nfs/dbraw/zinc/46/76/16/525467616.db2.gz PBPITQVKDNUPDY-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@H]([NH2+]Cc1cccs1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000364146063 525468053 /nfs/dbraw/zinc/46/80/53/525468053.db2.gz OSYVIFLARGLIAB-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1cccc(F)c1F ZINC000181959781 525469817 /nfs/dbraw/zinc/46/98/17/525469817.db2.gz ZLPWXZBZBJCDJC-LBPRGKRZSA-N 1 2 305.372 4.127 20 0 DIADLO C[C@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1ccccn1 ZINC000181810708 525484136 /nfs/dbraw/zinc/48/41/36/525484136.db2.gz RQVLBJYZYBXZOC-ZDUSSCGKSA-N 1 2 301.459 4.437 20 0 DIADLO COc1ccc2c(c1)CCC[C@@H]2CC(=O)Nc1ccc(C)[nH+]c1C ZINC000119320892 525516775 /nfs/dbraw/zinc/51/67/75/525516775.db2.gz BPABDVXEYQAXGP-MRXNPFEDSA-N 1 2 324.424 4.156 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc2[nH]ccc21)c1nc(C2CCCCC2)no1 ZINC000237339809 525535816 /nfs/dbraw/zinc/53/58/16/525535816.db2.gz ZGXQHLBTQCYNIU-CYBMUJFWSA-N 1 2 324.428 4.449 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(F)(F)F)cs1)c1cccc(F)c1F ZINC000181976322 525559580 /nfs/dbraw/zinc/55/95/80/525559580.db2.gz KOFRLHGKDWSPKR-SSDOTTSWSA-N 1 2 322.302 4.291 20 0 DIADLO COc1ccc2cc(C[N@H+](C)Cc3csc(C)n3)ccc2c1 ZINC000102675539 525625764 /nfs/dbraw/zinc/62/57/64/525625764.db2.gz MFIIBYRHMLWPPS-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO COc1ccc2cc(C[N@@H+](C)Cc3csc(C)n3)ccc2c1 ZINC000102675539 525625772 /nfs/dbraw/zinc/62/57/72/525625772.db2.gz MFIIBYRHMLWPPS-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2ccccc21)c1noc(-c2ccccc2)n1 ZINC000124454781 525680952 /nfs/dbraw/zinc/68/09/52/525680952.db2.gz XQAFSRGTGDHRFS-KDOFPFPSSA-N 1 2 319.408 4.465 20 0 DIADLO C[C@@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1cccnc1 ZINC000182883972 525700469 /nfs/dbraw/zinc/70/04/69/525700469.db2.gz LGVQGIXAEMEKQN-OAHLLOKOSA-N 1 2 318.424 4.455 20 0 DIADLO Cc1ccsc1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000338379501 525827121 /nfs/dbraw/zinc/82/71/21/525827121.db2.gz GCFOLJYMBYGBER-UHFFFAOYSA-N 1 2 317.801 4.148 20 0 DIADLO Cc1c([C@@H](C)[NH2+]Cc2coc(-c3ccccc3)n2)cnn1C(C)C ZINC000191313740 525900472 /nfs/dbraw/zinc/90/04/72/525900472.db2.gz DWJPTXXZTGQERI-CQSZACIVSA-N 1 2 324.428 4.278 20 0 DIADLO Cc1cn2cc(NC(=O)N3CCC[C@H]3c3ccccc3)ccc2[nH+]1 ZINC000265725039 525951409 /nfs/dbraw/zinc/95/14/09/525951409.db2.gz QJIFOYVGVCUSRV-KRWDZBQOSA-N 1 2 320.396 4.012 20 0 DIADLO Cc1cnc(C[N@H+](CCc2ccccc2)Cc2cccnc2)s1 ZINC000191351521 526009715 /nfs/dbraw/zinc/00/97/15/526009715.db2.gz ONEJACIXIXAGAX-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO Cc1cnc(C[N@@H+](CCc2ccccc2)Cc2cccnc2)s1 ZINC000191351521 526009723 /nfs/dbraw/zinc/00/97/23/526009723.db2.gz ONEJACIXIXAGAX-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO COc1cccc(Cl)c1C[N@H+](Cc1cccnc1)C(C)C ZINC000338278814 526096301 /nfs/dbraw/zinc/09/63/01/526096301.db2.gz SRIXRHRZWIVKOM-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+](Cc1cccnc1)C(C)C ZINC000338278814 526096312 /nfs/dbraw/zinc/09/63/12/526096312.db2.gz SRIXRHRZWIVKOM-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H](c1nc(C)cs1)C1CC1 ZINC000338300246 526105079 /nfs/dbraw/zinc/10/50/79/526105079.db2.gz CHHULZCSRNSATA-HNNXBMFYSA-N 1 2 322.861 4.354 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1csc(-c2cccs2)n1 ZINC000127724899 526132041 /nfs/dbraw/zinc/13/20/41/526132041.db2.gz OXFVVJJWUDUMML-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1csc(-c2cccs2)n1 ZINC000127724899 526132046 /nfs/dbraw/zinc/13/20/46/526132046.db2.gz OXFVVJJWUDUMML-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@H](C(=O)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1)C(C)(F)F ZINC000339603102 526149843 /nfs/dbraw/zinc/14/98/43/526149843.db2.gz JTWOOLDABCATQC-SECBINFHSA-N 1 2 307.344 4.060 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1csc(-c2cccs2)n1 ZINC000127498686 526161261 /nfs/dbraw/zinc/16/12/61/526161261.db2.gz KEYISPDTLIJYGP-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1csc(-c2cccs2)n1 ZINC000127498686 526161269 /nfs/dbraw/zinc/16/12/69/526161269.db2.gz KEYISPDTLIJYGP-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000181146417 526179860 /nfs/dbraw/zinc/17/98/60/526179860.db2.gz SMACOMYYALSXSH-WBMJQRKESA-N 1 2 314.410 4.024 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000181146417 526179869 /nfs/dbraw/zinc/17/98/69/526179869.db2.gz SMACOMYYALSXSH-WBMJQRKESA-N 1 2 314.410 4.024 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+](C)Cc1cc(Cl)cn1C ZINC000120003784 526181624 /nfs/dbraw/zinc/18/16/24/526181624.db2.gz GZJMOKLDEMAJDG-NSHDSACASA-N 1 2 309.841 4.157 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)Cc1cc(Cl)cn1C ZINC000120003784 526181635 /nfs/dbraw/zinc/18/16/35/526181635.db2.gz GZJMOKLDEMAJDG-NSHDSACASA-N 1 2 309.841 4.157 20 0 DIADLO C[C@H]1CC2(CCC2)CN1C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000338031441 526234603 /nfs/dbraw/zinc/23/46/03/526234603.db2.gz MEOJDYRHUGGFOW-HNNXBMFYSA-N 1 2 322.408 4.279 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)C(c1ccccc1)c1ccccc1 ZINC000107285773 526236530 /nfs/dbraw/zinc/23/65/30/526236530.db2.gz GGYGDZDJQNWEKV-UHFFFAOYSA-N 1 2 302.377 4.161 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CCCc1ncc(-c2ccccc2)o1 ZINC000107290496 526236852 /nfs/dbraw/zinc/23/68/52/526236852.db2.gz VNYCXUPXCKFQGH-UHFFFAOYSA-N 1 2 321.380 4.006 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N(Cc1ccoc1)C1CCCCC1 ZINC000181962387 526238966 /nfs/dbraw/zinc/23/89/66/526238966.db2.gz LJYQFNQKQYNZCC-UHFFFAOYSA-N 1 2 313.401 4.350 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000121474748 526240212 /nfs/dbraw/zinc/24/02/12/526240212.db2.gz AUNIKMOLMVUXGX-LLVKDONJSA-N 1 2 323.318 4.292 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1cccc2c3c([nH]c21)CCCC3 ZINC000107293244 526242043 /nfs/dbraw/zinc/24/20/43/526242043.db2.gz OEVIKESBWBVDRZ-UHFFFAOYSA-N 1 2 305.381 4.002 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2cnc(C3CCC3)s2)c(F)c1 ZINC000339522686 526304519 /nfs/dbraw/zinc/30/45/19/526304519.db2.gz MTAFZSUXBYFZGJ-UHFFFAOYSA-N 1 2 312.360 4.118 20 0 DIADLO Cc1csc(C2([NH2+]Cc3c(F)cccc3F)CCCC2)n1 ZINC000182633855 526326194 /nfs/dbraw/zinc/32/61/94/526326194.db2.gz FKRAOZYHVLHNLS-UHFFFAOYSA-N 1 2 308.397 4.289 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](c2cccc(Cl)c2)C2CCCCC2)o1 ZINC000181030511 526343704 /nfs/dbraw/zinc/34/37/04/526343704.db2.gz GEMLFTSFOKTBCQ-QGZVFWFLSA-N 1 2 319.836 4.443 20 0 DIADLO Fc1ccc(Cl)c(C[NH2+]C2(c3nccs3)CCCC2)c1 ZINC000189200406 526346471 /nfs/dbraw/zinc/34/64/71/526346471.db2.gz MMNVXEZDCVZIKF-UHFFFAOYSA-N 1 2 310.825 4.495 20 0 DIADLO Fc1ccc(F)c2c1CC[N@H+](Cc1cnc3ccccc3c1)C2 ZINC000337199266 526351031 /nfs/dbraw/zinc/35/10/31/526351031.db2.gz YQGJMNJBPMDUKX-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1ccc(F)c2c1CC[N@@H+](Cc1cnc3ccccc3c1)C2 ZINC000337199266 526351034 /nfs/dbraw/zinc/35/10/34/526351034.db2.gz YQGJMNJBPMDUKX-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO O=C(CC1CCCCC1)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000267045746 526359101 /nfs/dbraw/zinc/35/91/01/526359101.db2.gz CIZYBJYVAOXKAH-UHFFFAOYSA-N 1 2 315.392 4.052 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2noc(C3CC3)n2)C2CCCC2)cc1 ZINC000180280090 526362565 /nfs/dbraw/zinc/36/25/65/526362565.db2.gz HFJADDQENLQFIJ-KRWDZBQOSA-N 1 2 315.392 4.107 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2nc(C3CC3)no2)C2CCCC2)cc1 ZINC000180287202 526366827 /nfs/dbraw/zinc/36/68/27/526366827.db2.gz HPPVLGQCLLJIBG-QGZVFWFLSA-N 1 2 315.392 4.107 20 0 DIADLO Fc1ccc2cc[nH+]c(N[C@@H]3CCCC[C@H]3OC(F)F)c2c1 ZINC000336904666 526377377 /nfs/dbraw/zinc/37/73/77/526377377.db2.gz SNSVEIXUUNFJOK-ZIAGYGMSSA-N 1 2 310.319 4.336 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCOCC34CCCC4)cs2)cs1 ZINC000270649893 526414251 /nfs/dbraw/zinc/41/42/51/526414251.db2.gz OMFMMWBJFIOEPB-UHFFFAOYSA-N 1 2 320.483 4.017 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCOCC34CCCC4)cs2)cs1 ZINC000270649893 526414255 /nfs/dbraw/zinc/41/42/55/526414255.db2.gz OMFMMWBJFIOEPB-UHFFFAOYSA-N 1 2 320.483 4.017 20 0 DIADLO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]Cc1ccn[nH]1 ZINC000237468702 526568741 /nfs/dbraw/zinc/56/87/41/526568741.db2.gz HOVIQWAYWQMJIY-GFCCVEGCSA-N 1 2 312.442 4.001 20 0 DIADLO Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]Cc1cocn1 ZINC000182062911 526575138 /nfs/dbraw/zinc/57/51/38/526575138.db2.gz KPHFJENXVVGEBC-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2cccc(O)c2Cl)sc1C ZINC000339267942 526664485 /nfs/dbraw/zinc/66/44/85/526664485.db2.gz CEWYQBRRCITNRB-UHFFFAOYSA-N 1 2 310.850 4.144 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000128110573 526739769 /nfs/dbraw/zinc/73/97/69/526739769.db2.gz FHHWSVAGZTXGMK-AWEZNQCLSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+](C)[C@@H](C)c1ccccn1 ZINC000128110573 526739780 /nfs/dbraw/zinc/73/97/80/526739780.db2.gz FHHWSVAGZTXGMK-AWEZNQCLSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000127882408 526740229 /nfs/dbraw/zinc/74/02/29/526740229.db2.gz JNMIRDTYHNPALX-CQSZACIVSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+](C)[C@H](C)c1cccnc1 ZINC000127882408 526740237 /nfs/dbraw/zinc/74/02/37/526740237.db2.gz JNMIRDTYHNPALX-CQSZACIVSA-N 1 2 307.397 4.238 20 0 DIADLO O=C(c1cccc(Oc2cc[nH+]cc2)c1)N1CCC[C@@H]1C1CCC1 ZINC000264929800 526775519 /nfs/dbraw/zinc/77/55/19/526775519.db2.gz XDQGORKOUNKTKB-LJQANCHMSA-N 1 2 322.408 4.279 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccccc2F)C2CCCC2)oc1C ZINC000181498388 526892571 /nfs/dbraw/zinc/89/25/71/526892571.db2.gz KLABECQMXGFLMI-GOSISDBHSA-N 1 2 302.393 4.452 20 0 DIADLO Cc1nc(COc2ccc([NH2+][C@@H]3CCC34CCCC4)cc2)no1 ZINC000189211878 526908465 /nfs/dbraw/zinc/90/84/65/526908465.db2.gz JEUZFUGKVZIAKE-MRXNPFEDSA-N 1 2 313.401 4.092 20 0 DIADLO Clc1ccc([C@H]2CSCC[N@@H+]2Cc2cccnc2)cc1 ZINC000116411085 526964384 /nfs/dbraw/zinc/96/43/84/526964384.db2.gz BPEGYNDDVXKITJ-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccc([C@H]2CSCC[N@H+]2Cc2cccnc2)cc1 ZINC000116411085 526964390 /nfs/dbraw/zinc/96/43/90/526964390.db2.gz BPEGYNDDVXKITJ-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cccc(C2([NH2+]Cc3noc(C4CC4)n3)CCCC2)c1 ZINC000181456228 526974077 /nfs/dbraw/zinc/97/40/77/526974077.db2.gz MXOYHQNSIXDKJG-UHFFFAOYSA-N 1 2 317.820 4.160 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1)c1cc[nH]c1 ZINC000109266555 527252759 /nfs/dbraw/zinc/25/27/59/527252759.db2.gz RDCYDFNDXLACHU-UHFFFAOYSA-N 1 2 313.744 4.108 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000163212685 527409654 /nfs/dbraw/zinc/40/96/54/527409654.db2.gz QFWYYDDMGYCCAX-MRXNPFEDSA-N 1 2 301.459 4.086 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1csc(C2CC2)n1 ZINC000163212685 527409662 /nfs/dbraw/zinc/40/96/62/527409662.db2.gz QFWYYDDMGYCCAX-MRXNPFEDSA-N 1 2 301.459 4.086 20 0 DIADLO FC(F)(F)[C@H]1CC[N@H+](Cc2ncc(Cl)s2)CC12CCC2 ZINC000338388148 527678937 /nfs/dbraw/zinc/67/89/37/527678937.db2.gz VEWUMVRBTQYSHJ-VIFPVBQESA-N 1 2 324.799 4.351 20 0 DIADLO FC(F)(F)[C@H]1CC[N@@H+](Cc2ncc(Cl)s2)CC12CCC2 ZINC000338388148 527678942 /nfs/dbraw/zinc/67/89/42/527678942.db2.gz VEWUMVRBTQYSHJ-VIFPVBQESA-N 1 2 324.799 4.351 20 0 DIADLO FC(F)(F)c1cnc(C[NH2+]Cc2coc3ccccc23)s1 ZINC000339405775 527688743 /nfs/dbraw/zinc/68/87/43/527688743.db2.gz CZKHZFQWGJXPIF-UHFFFAOYSA-N 1 2 312.316 4.198 20 0 DIADLO CC(C)(C)OC1CC[NH+](Cc2nc(Cl)ccc2Cl)CC1 ZINC000274282260 534969754 /nfs/dbraw/zinc/96/97/54/534969754.db2.gz DGCRDTBPMHPPHK-UHFFFAOYSA-N 1 2 317.260 4.168 20 0 DIADLO CCCC(=O)Nc1cccc(N[C@@H]2C[C@H](C)n3cc[nH+]c32)c1C ZINC000297126739 535352762 /nfs/dbraw/zinc/35/27/62/535352762.db2.gz YSFIAPXXTJEMET-BLLLJJGKSA-N 1 2 312.417 4.048 20 0 DIADLO CCCC(CCC)c1nc(-c2ccc(-n3cc[nH+]c3)nc2)no1 ZINC000273836855 535359613 /nfs/dbraw/zinc/35/96/13/535359613.db2.gz ZNQCXQFTGLYRQJ-UHFFFAOYSA-N 1 2 311.389 4.001 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(Cl)ccc1Cl)c1nc(C)cs1 ZINC000274303958 535806364 /nfs/dbraw/zinc/80/63/64/535806364.db2.gz KOQDNRQQLVTDGK-SNVBAGLBSA-N 1 2 316.257 4.394 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nnc(C)s1)c1ccc(Cl)s1 ZINC000274182694 535808870 /nfs/dbraw/zinc/80/88/70/535808870.db2.gz JAFRDMGJPWSKAQ-VXNVDRBHSA-N 1 2 301.868 4.363 20 0 DIADLO CCn1ccnc1C[NH2+][C@H](c1ccccc1)c1ccc(C)cc1 ZINC000299585685 536111631 /nfs/dbraw/zinc/11/16/31/536111631.db2.gz JMEORQXUMPYCET-HXUWFJFHSA-N 1 2 305.425 4.091 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)Nc1cc(C)ccc1Br ZINC000296466126 536117058 /nfs/dbraw/zinc/11/70/58/536117058.db2.gz OCYIXBJQPQSQIR-LLVKDONJSA-N 1 2 308.223 4.147 20 0 DIADLO COc1cc[nH+]cc1CS[C@@H](C)c1nc2ccccc2o1 ZINC000289374817 537120584 /nfs/dbraw/zinc/12/05/84/537120584.db2.gz JWSDWSKYGAZWFU-NSHDSACASA-N 1 2 300.383 4.226 20 0 DIADLO Cc1ccnc(C[NH2+][C@@H](C)c2ccsc2)c1Br ZINC000865559558 1043112817 /nfs/dbraw/zinc/11/28/17/1043112817.db2.gz VCNIJJZEOIUSFX-JTQLQIEISA-N 1 2 311.248 4.065 20 0 DIADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccc(Br)cc1Cl ZINC001137563467 1045895306 /nfs/dbraw/zinc/89/53/06/1045895306.db2.gz IETXBDZAJQLVER-XHVZSJERSA-N 1 2 318.617 4.035 20 0 DIADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccc(Br)cc1Cl ZINC001137563467 1045895322 /nfs/dbraw/zinc/89/53/22/1045895322.db2.gz IETXBDZAJQLVER-XHVZSJERSA-N 1 2 318.617 4.035 20 0 DIADLO CC[N@H+](Cc1c(F)c(Cl)ccc1Br)C1CC1 ZINC001141689834 1047265115 /nfs/dbraw/zinc/26/51/15/1047265115.db2.gz PTHFXJZLSHONSA-UHFFFAOYSA-N 1 2 306.606 4.226 20 0 DIADLO CC[N@@H+](Cc1c(F)c(Cl)ccc1Br)C1CC1 ZINC001141689834 1047265129 /nfs/dbraw/zinc/26/51/29/1047265129.db2.gz PTHFXJZLSHONSA-UHFFFAOYSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(Cl)c(OC(F)(F)F)c1 ZINC001143356912 1050314055 /nfs/dbraw/zinc/31/40/55/1050314055.db2.gz KVILGGSKDGRDKY-SCZZXKLOSA-N 1 2 311.706 4.171 20 0 DIADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(Cl)c(OC(F)(F)F)c1 ZINC001143356912 1050314071 /nfs/dbraw/zinc/31/40/71/1050314071.db2.gz KVILGGSKDGRDKY-SCZZXKLOSA-N 1 2 311.706 4.171 20 0 DIADLO COc1cccc(Br)c1Nc1c[nH+]cc(C)c1C ZINC001213534319 1050681236 /nfs/dbraw/zinc/68/12/36/1050681236.db2.gz WUVLQAWPFAYYJN-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cc(C(F)(F)F)cnc2Cl)[C@H]1C ZINC001232009201 1053938196 /nfs/dbraw/zinc/93/81/96/1053938196.db2.gz RAAOPYHIHHBTEY-ZJUUUORDSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cc(C(F)(F)F)cnc2Cl)[C@H]1C ZINC001232009201 1053938204 /nfs/dbraw/zinc/93/82/04/1053938204.db2.gz RAAOPYHIHHBTEY-ZJUUUORDSA-N 1 2 306.759 4.374 20 0 DIADLO Cc1cc(C[NH+]2CC3(C2)C[C@@H](F)CS3)c(Cl)cc1Cl ZINC001237699396 1055507640 /nfs/dbraw/zinc/50/76/40/1055507640.db2.gz LWFIIXHRQNMIMF-LLVKDONJSA-N 1 2 320.260 4.331 20 0 DIADLO CCC[C@@H](C)C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000044568473 1035506141 /nfs/dbraw/zinc/50/61/41/1035506141.db2.gz UBIZUMQWHHMGNF-CQSZACIVSA-N 1 2 311.429 4.261 20 0 DIADLO CCC[C@H](C)C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000044568476 1035506250 /nfs/dbraw/zinc/50/62/50/1035506250.db2.gz UBIZUMQWHHMGNF-AWEZNQCLSA-N 1 2 311.429 4.261 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000607064815 1035583550 /nfs/dbraw/zinc/58/35/50/1035583550.db2.gz SDWQYGQXNBIRPA-QGZVFWFLSA-N 1 2 307.397 4.103 20 0 DIADLO c1ccc(C2CC2)c(CNc2cc[nH+]c(OC3CCOCC3)c2)c1 ZINC001167052041 1035589131 /nfs/dbraw/zinc/58/91/31/1035589131.db2.gz HYVUFSSQGBDJEY-UHFFFAOYSA-N 1 2 324.424 4.129 20 0 DIADLO O=C1SCCN1C[N@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC000063735569 1035589779 /nfs/dbraw/zinc/58/97/79/1035589779.db2.gz OAWYFOLYPYVHAB-UHFFFAOYSA-N 1 2 324.449 4.055 20 0 DIADLO O=C1SCCN1C[N@@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC000063735569 1035589795 /nfs/dbraw/zinc/58/97/95/1035589795.db2.gz OAWYFOLYPYVHAB-UHFFFAOYSA-N 1 2 324.449 4.055 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC(C)(c3ccccc3)CC2)c(C)[nH+]1 ZINC001266276244 1035622238 /nfs/dbraw/zinc/62/22/38/1035622238.db2.gz DCRIJVMNBFQAPQ-UHFFFAOYSA-N 1 2 322.452 4.201 20 0 DIADLO CCCC1CCC(N(C)C(=O)c2ccn3c(C)c[nH+]c3c2)CC1 ZINC000655025819 1035689177 /nfs/dbraw/zinc/68/91/77/1035689177.db2.gz SLVXKKQXWRDYJW-UHFFFAOYSA-N 1 2 313.445 4.074 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cn2ccc(C(F)(F)F)n2)c1 ZINC000065941854 1035743059 /nfs/dbraw/zinc/74/30/59/1035743059.db2.gz LRGJFKOBTWMXOW-AWEZNQCLSA-N 1 2 309.335 4.005 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cn2ccc(C(F)(F)F)n2)c1 ZINC000065941854 1035743078 /nfs/dbraw/zinc/74/30/78/1035743078.db2.gz LRGJFKOBTWMXOW-AWEZNQCLSA-N 1 2 309.335 4.005 20 0 DIADLO CC[N@@H+](Cc1cccc(Cl)c1)Cn1ccc(C(F)(F)F)n1 ZINC000065941603 1035744709 /nfs/dbraw/zinc/74/47/09/1035744709.db2.gz LSGRBOKWBSQVEW-UHFFFAOYSA-N 1 2 317.742 4.035 20 0 DIADLO CC[N@H+](Cc1cccc(Cl)c1)Cn1ccc(C(F)(F)F)n1 ZINC000065941603 1035744723 /nfs/dbraw/zinc/74/47/23/1035744723.db2.gz LSGRBOKWBSQVEW-UHFFFAOYSA-N 1 2 317.742 4.035 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(F)c1)[C@@H]1CCC=CCCC1 ZINC001125300810 1035832694 /nfs/dbraw/zinc/83/26/94/1035832694.db2.gz DKEFKDJYVJVHQT-CQSZACIVSA-N 1 2 313.376 4.086 20 0 DIADLO c1nc(C2CCCCC2)sc1C[N@@H+]1CCOCC12CCCC2 ZINC000538763323 1035888961 /nfs/dbraw/zinc/88/89/61/1035888961.db2.gz VXPQSSYTTXBJTQ-UHFFFAOYSA-N 1 2 320.502 4.336 20 0 DIADLO c1nc(C2CCCCC2)sc1C[N@H+]1CCOCC12CCCC2 ZINC000538763323 1035888982 /nfs/dbraw/zinc/88/89/82/1035888982.db2.gz VXPQSSYTTXBJTQ-UHFFFAOYSA-N 1 2 320.502 4.336 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(C(C)(F)F)cc3)ccc2[nH+]1 ZINC000339691754 1035920405 /nfs/dbraw/zinc/92/04/05/1035920405.db2.gz NEUCGUJOTGVCSJ-UHFFFAOYSA-N 1 2 315.323 4.007 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)s1)c1nnc2n1CCCCC2 ZINC000037140688 1035950883 /nfs/dbraw/zinc/95/08/83/1035950883.db2.gz CHZQBOARMQPVET-WDEREUQCSA-N 1 2 324.881 4.131 20 0 DIADLO FC1(F)CCC[C@H](C[N@@H+]2Cc3cnn(-c4ccccc4)c3C2)C1 ZINC000339808758 1035969128 /nfs/dbraw/zinc/96/91/28/1035969128.db2.gz NAAZYKJUWMDWJQ-AWEZNQCLSA-N 1 2 317.383 4.013 20 0 DIADLO FC1(F)CCC[C@H](C[N@H+]2Cc3cnn(-c4ccccc4)c3C2)C1 ZINC000339808758 1035969144 /nfs/dbraw/zinc/96/91/44/1035969144.db2.gz NAAZYKJUWMDWJQ-AWEZNQCLSA-N 1 2 317.383 4.013 20 0 DIADLO CCCc1cc(N(Cc2ccccn2)C2CCCCC2)nc(C)[nH+]1 ZINC001167101422 1036038743 /nfs/dbraw/zinc/03/87/43/1036038743.db2.gz AZGURXLUVVGWHO-UHFFFAOYSA-N 1 2 324.472 4.472 20 0 DIADLO Nc1cc(Cl)[nH+]c(N(Cc2ccccn2)C2CCCCC2)c1 ZINC001167102326 1036049647 /nfs/dbraw/zinc/04/96/47/1036049647.db2.gz QDWBHYHDASPKIZ-UHFFFAOYSA-N 1 2 316.836 4.052 20 0 DIADLO C[N@H+](Cc1cc2ccccc2s1)Cc1nccn1C(F)F ZINC000154982800 1036080238 /nfs/dbraw/zinc/08/02/38/1036080238.db2.gz GFRAXOXDJVYIKX-UHFFFAOYSA-N 1 2 307.369 4.125 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2s1)Cc1nccn1C(F)F ZINC000154982800 1036080249 /nfs/dbraw/zinc/08/02/49/1036080249.db2.gz GFRAXOXDJVYIKX-UHFFFAOYSA-N 1 2 307.369 4.125 20 0 DIADLO COc1ccccc1[C@@H](C)N(C)c1cc(C)[nH+]c(C(C)(C)C)n1 ZINC001167107325 1036090564 /nfs/dbraw/zinc/09/05/64/1036090564.db2.gz QXHUWRZVNCTNCB-CQSZACIVSA-N 1 2 313.445 4.289 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2coc(-c3cccs3)n2)cn1 ZINC000155049431 1036106423 /nfs/dbraw/zinc/10/64/23/1036106423.db2.gz IEZQGWZBTUAGNW-GFCCVEGCSA-N 1 2 316.430 4.031 20 0 DIADLO CC[C@@H](c1ccccc1)N(C)c1cc(N2CCCCC2)[nH+]cn1 ZINC001167127417 1036143958 /nfs/dbraw/zinc/14/39/58/1036143958.db2.gz DRVZDYMDKIVPCB-KRWDZBQOSA-N 1 2 310.445 4.054 20 0 DIADLO CC[C@@H](c1ccccc1)N(C)c1cc(N2CCCCC2)nc[nH+]1 ZINC001167127417 1036143963 /nfs/dbraw/zinc/14/39/63/1036143963.db2.gz DRVZDYMDKIVPCB-KRWDZBQOSA-N 1 2 310.445 4.054 20 0 DIADLO C[C@@]1(c2ccc(F)cc2)CN(c2[nH+]ccc3ccccc32)CCO1 ZINC001167137218 1036169207 /nfs/dbraw/zinc/16/92/07/1036169207.db2.gz JJAXEWDUGMVUFM-FQEVSTJZSA-N 1 2 322.383 4.126 20 0 DIADLO CC(C)=C[C@@H]1[C@H](C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)C1(C)C ZINC000072058466 1036176335 /nfs/dbraw/zinc/17/63/35/1036176335.db2.gz CMYGRPKTSAXJRS-HZPDHXFCSA-N 1 2 309.413 4.254 20 0 DIADLO COCC[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccc(C)o1 ZINC000348132684 1036187598 /nfs/dbraw/zinc/18/75/98/1036187598.db2.gz ZJWPCLXKLRFZKE-ZDUSSCGKSA-N 1 2 322.474 4.209 20 0 DIADLO CCC1CC[NH+](CC(=O)Nc2cc(Cl)ccc2Cl)CC1 ZINC000048584344 1036198247 /nfs/dbraw/zinc/19/82/47/1036198247.db2.gz NYYOPFIAMGNACD-UHFFFAOYSA-N 1 2 315.244 4.054 20 0 DIADLO Cn1c2ccccc2[nH+]c1NCc1cc(Br)cs1 ZINC000079047637 1036216265 /nfs/dbraw/zinc/21/62/65/1036216265.db2.gz NPFUSDMTJMSLBA-UHFFFAOYSA-N 1 2 322.231 4.009 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC001167157375 1036223515 /nfs/dbraw/zinc/22/35/15/1036223515.db2.gz KHECUSRMKJZVNZ-INIZCTEOSA-N 1 2 319.832 4.423 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC001167157375 1036223526 /nfs/dbraw/zinc/22/35/26/1036223526.db2.gz KHECUSRMKJZVNZ-INIZCTEOSA-N 1 2 319.832 4.423 20 0 DIADLO Clc1cc(Cl)cc(C2=CC[N@H+](Cc3ccon3)CC2)c1 ZINC001209561054 1036227273 /nfs/dbraw/zinc/22/72/73/1036227273.db2.gz MXMANMYVQBKHGT-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Clc1cc(Cl)cc(C2=CC[N@@H+](Cc3ccon3)CC2)c1 ZINC001209561054 1036227287 /nfs/dbraw/zinc/22/72/87/1036227287.db2.gz MXMANMYVQBKHGT-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Cc1cc(Cl)ncc1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC001209632728 1036236155 /nfs/dbraw/zinc/23/61/55/1036236155.db2.gz AWRHUSFVPOMYIA-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(Cl)ncc1C[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC001209632728 1036236170 /nfs/dbraw/zinc/23/61/70/1036236170.db2.gz AWRHUSFVPOMYIA-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO CCC[N@H+](Cc1c(C)onc1CC)Cc1ccc(F)cc1F ZINC001167237561 1036304380 /nfs/dbraw/zinc/30/43/80/1036304380.db2.gz KKSOPMVZNNJNNB-UHFFFAOYSA-N 1 2 308.372 4.236 20 0 DIADLO CCC[N@@H+](Cc1c(C)onc1CC)Cc1ccc(F)cc1F ZINC001167237561 1036304397 /nfs/dbraw/zinc/30/43/97/1036304397.db2.gz KKSOPMVZNNJNNB-UHFFFAOYSA-N 1 2 308.372 4.236 20 0 DIADLO CC[C@](C)([NH2+]Cc1cc(O)ccc1Cl)c1nc(C)cs1 ZINC000625256659 1036305990 /nfs/dbraw/zinc/30/59/90/1036305990.db2.gz HZFASWZFMWJZND-HNNXBMFYSA-N 1 2 310.850 4.226 20 0 DIADLO CCC[N@H+](Cc1nnc(C(C)C)s1)Cc1ccc(C)cc1 ZINC000579917866 1036412697 /nfs/dbraw/zinc/41/26/97/1036412697.db2.gz DRASBRWTTRUNRM-UHFFFAOYSA-N 1 2 303.475 4.382 20 0 DIADLO CCC[N@@H+](Cc1nnc(C(C)C)s1)Cc1ccc(C)cc1 ZINC000579917866 1036412701 /nfs/dbraw/zinc/41/27/01/1036412701.db2.gz DRASBRWTTRUNRM-UHFFFAOYSA-N 1 2 303.475 4.382 20 0 DIADLO Cc1ccc(C[NH2+][C@H]2COc3cc(F)cc(F)c32)cc1Cl ZINC000683471519 1036422165 /nfs/dbraw/zinc/42/21/65/1036422165.db2.gz VPUZASLKAGOKAJ-AWEZNQCLSA-N 1 2 309.743 4.150 20 0 DIADLO C[C@@H]1c2ccc(F)cc2CC[N@H+]1Cc1ccc(C(F)(F)F)cn1 ZINC000683521385 1036437020 /nfs/dbraw/zinc/43/70/20/1036437020.db2.gz KHAUYBDGBPDGEG-LLVKDONJSA-N 1 2 324.321 4.359 20 0 DIADLO C[C@@H]1c2ccc(F)cc2CC[N@@H+]1Cc1ccc(C(F)(F)F)cn1 ZINC000683521385 1036437029 /nfs/dbraw/zinc/43/70/29/1036437029.db2.gz KHAUYBDGBPDGEG-LLVKDONJSA-N 1 2 324.321 4.359 20 0 DIADLO CCCCCCN(Cc1ccco1)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000890940958 1036481066 /nfs/dbraw/zinc/48/10/66/1036481066.db2.gz MTBAHHXPJXMRHA-MRXNPFEDSA-N 1 2 317.433 4.036 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCn2ccnc21)c1ccc(Cl)cc1Cl ZINC000655693280 1036482693 /nfs/dbraw/zinc/48/26/93/1036482693.db2.gz WIRFCBSYFLKLHN-QMTHXVAHSA-N 1 2 310.228 4.376 20 0 DIADLO CC(C)(C)CC(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000579939265 1036494524 /nfs/dbraw/zinc/49/45/24/1036494524.db2.gz TZAAEXJHMYNSQK-UHFFFAOYSA-N 1 2 311.429 4.261 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc2[nH]ccc2c1)c1nc(C2CCCCC2)no1 ZINC000655742869 1036515009 /nfs/dbraw/zinc/51/50/09/1036515009.db2.gz NBQLPIAEGSRLAY-CYBMUJFWSA-N 1 2 324.428 4.449 20 0 DIADLO FC(F)(F)c1ncccc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001210233251 1036547607 /nfs/dbraw/zinc/54/76/07/1036547607.db2.gz VZZSTEVDVKRARX-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H]3CCCc4occc43)co2)cc1 ZINC000155460923 1036587388 /nfs/dbraw/zinc/58/73/88/1036587388.db2.gz IYXLMRAIFDSVMV-QGZVFWFLSA-N 1 2 308.381 4.410 20 0 DIADLO C=C(C)[C@H]([NH2+]Cc1cccnc1Cl)c1ccc(F)c(F)c1 ZINC000187371904 1036609311 /nfs/dbraw/zinc/60/93/11/1036609311.db2.gz YWDUEBNRKAMYNE-HNNXBMFYSA-N 1 2 308.759 4.420 20 0 DIADLO FC(F)Oc1ccc(Nc2ccc[nH+]c2N2CCCCC2)cc1 ZINC001210324130 1036616774 /nfs/dbraw/zinc/61/67/74/1036616774.db2.gz FOMPEKAHCLXSCJ-UHFFFAOYSA-N 1 2 319.355 4.417 20 0 DIADLO CC(C)Oc1ccc(NCc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000079078559 1036757514 /nfs/dbraw/zinc/75/75/14/1036757514.db2.gz JWFZUOMMLYAFRW-UHFFFAOYSA-N 1 2 307.397 4.272 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1ccncc1F ZINC000340511318 1036776587 /nfs/dbraw/zinc/77/65/87/1036776587.db2.gz PXIKDNWBFPHMPJ-QMMMGPOBSA-N 1 2 300.711 4.003 20 0 DIADLO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1c1noc(C[C@H](C)n2cc[nH+]c2)n1 ZINC000656041570 1036830367 /nfs/dbraw/zinc/83/03/67/1036830367.db2.gz AHGBZNWFTXJCMJ-QXSJWSMHSA-N 1 2 316.449 4.246 20 0 DIADLO CCCc1nc(C[N@H+](C)Cc2ccc(OCC)cc2)cs1 ZINC000042651840 1036839943 /nfs/dbraw/zinc/83/99/43/1036839943.db2.gz RSWGVMVQROLJQV-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO CCCc1nc(C[N@@H+](C)Cc2ccc(OCC)cc2)cs1 ZINC000042651840 1036839958 /nfs/dbraw/zinc/83/99/58/1036839958.db2.gz RSWGVMVQROLJQV-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1cccc(F)c1OC(F)F)C2 ZINC001167353742 1036952296 /nfs/dbraw/zinc/95/22/96/1036952296.db2.gz NOVXROLRRHNBSY-UHFFFAOYSA-N 1 2 321.342 4.294 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1cccc(F)c1OC(F)F)C2 ZINC001167353742 1036952315 /nfs/dbraw/zinc/95/23/15/1036952315.db2.gz NOVXROLRRHNBSY-UHFFFAOYSA-N 1 2 321.342 4.294 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccncc2)n1 ZINC000316355171 1037042099 /nfs/dbraw/zinc/04/20/99/1037042099.db2.gz ZNCZIEDKUWYWMA-WMLDXEAASA-N 1 2 309.438 4.287 20 0 DIADLO [NH3+][C@@H](c1nc(C2CCCCCC2)no1)c1cccc(Cl)c1 ZINC000647121499 1037054866 /nfs/dbraw/zinc/05/48/66/1037054866.db2.gz SAJJVAJZANXXRV-CQSZACIVSA-N 1 2 305.809 4.209 20 0 DIADLO CC[C@@H]1CCC[N@@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1 ZINC001167382122 1037066661 /nfs/dbraw/zinc/06/66/61/1037066661.db2.gz VJBIDPQDKCHITD-CZUORRHYSA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@@H]1CCC[N@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1 ZINC001167382122 1037066682 /nfs/dbraw/zinc/06/66/82/1037066682.db2.gz VJBIDPQDKCHITD-CZUORRHYSA-N 1 2 309.837 4.066 20 0 DIADLO Fc1c(F)c(F)c(C[NH2+]C2(c3ccccc3)CC2)c(F)c1F ZINC000728291461 1037071585 /nfs/dbraw/zinc/07/15/85/1037071585.db2.gz NSTFNBGWCHXRMO-UHFFFAOYSA-N 1 2 313.269 4.161 20 0 DIADLO Cc1nc(C)c(C[N@@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC000683896982 1037074083 /nfs/dbraw/zinc/07/40/83/1037074083.db2.gz GXRHIWFTXQRLRH-MEDUHNTESA-N 1 2 300.402 4.172 20 0 DIADLO Cc1nc(C)c(C[N@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC000683896982 1037074099 /nfs/dbraw/zinc/07/40/99/1037074099.db2.gz GXRHIWFTXQRLRH-MEDUHNTESA-N 1 2 300.402 4.172 20 0 DIADLO Cc1nc(C)c(C[NH+]2Cc3ccccc3-c3ccccc3C2)o1 ZINC000683899049 1037078735 /nfs/dbraw/zinc/07/87/35/1037078735.db2.gz WKAYFTPLPAXDSY-UHFFFAOYSA-N 1 2 304.393 4.474 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)n1 ZINC000565639750 1037091654 /nfs/dbraw/zinc/09/16/54/1037091654.db2.gz VKZXIGJRMDLPOW-HNNXBMFYSA-N 1 2 323.799 4.226 20 0 DIADLO Cn1nccc1C1=CC[N@H+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000580602572 1037221470 /nfs/dbraw/zinc/22/14/70/1037221470.db2.gz KVQBDDYRDKLVPS-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1nccc1C1=CC[N@@H+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000580602572 1037221479 /nfs/dbraw/zinc/22/14/79/1037221479.db2.gz KVQBDDYRDKLVPS-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Nc1cccc(C[N@@H+]2CCc3c(Cl)cc(Cl)cc3C2)c1 ZINC000580615151 1037223865 /nfs/dbraw/zinc/22/38/65/1037223865.db2.gz PKOSBKHPZSLJBD-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1cccc(C[N@H+]2CCc3c(Cl)cc(Cl)cc3C2)c1 ZINC000580615151 1037223880 /nfs/dbraw/zinc/22/38/80/1037223880.db2.gz PKOSBKHPZSLJBD-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3ccccc3[nH]2)C[C@H](c2ccsc2)O1 ZINC000684020403 1037243577 /nfs/dbraw/zinc/24/35/77/1037243577.db2.gz CBCRLKRUWYWALJ-SCLBCKFNSA-N 1 2 312.438 4.191 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)C[C@H](c2ccsc2)O1 ZINC000684020403 1037243593 /nfs/dbraw/zinc/24/35/93/1037243593.db2.gz CBCRLKRUWYWALJ-SCLBCKFNSA-N 1 2 312.438 4.191 20 0 DIADLO Cc1cc([C@@H]2C[N@H+](Cc3cc4ccccc4[nH]3)CCO2)ccc1F ZINC000684021702 1037248520 /nfs/dbraw/zinc/24/85/20/1037248520.db2.gz SIJGHAQOBZCBLF-FQEVSTJZSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1cc([C@@H]2C[N@@H+](Cc3cc4ccccc4[nH]3)CCO2)ccc1F ZINC000684021702 1037248532 /nfs/dbraw/zinc/24/85/32/1037248532.db2.gz SIJGHAQOBZCBLF-FQEVSTJZSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2F)nn1 ZINC000692301294 1037285893 /nfs/dbraw/zinc/28/58/93/1037285893.db2.gz RGIKMITYLFKCAN-SECBINFHSA-N 1 2 314.191 4.082 20 0 DIADLO Cc1ccsc1C[N@H+](C)Cc1nc(-c2cccc(C)c2)no1 ZINC000048056425 1037310647 /nfs/dbraw/zinc/31/06/47/1037310647.db2.gz LDJQJCICORXLOD-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccsc1C[N@@H+](C)Cc1nc(-c2cccc(C)c2)no1 ZINC000048056425 1037310672 /nfs/dbraw/zinc/31/06/72/1037310672.db2.gz LDJQJCICORXLOD-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1)c1ccco1 ZINC000261687893 1037311748 /nfs/dbraw/zinc/31/17/48/1037311748.db2.gz KMZBVUXFOMSWPU-OIISXLGYSA-N 1 2 317.429 4.500 20 0 DIADLO COc1cc([C@H](C)[NH2+]Cc2cscn2)ccc1OCC(C)C ZINC000060523556 1037336332 /nfs/dbraw/zinc/33/63/32/1037336332.db2.gz VHOVRGQTHDPSSW-ZDUSSCGKSA-N 1 2 320.458 4.037 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2ncc(C(C)(C)C)s2)cn1 ZINC000684110351 1037357697 /nfs/dbraw/zinc/35/76/97/1037357697.db2.gz XFIZFVQCDZEXPT-GFCCVEGCSA-N 1 2 306.479 4.069 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)[C@@]12C[C@@H]1CCCC2 ZINC001125480470 1037379739 /nfs/dbraw/zinc/37/97/39/1037379739.db2.gz MSEYLOANOZMDAL-SJCJKPOMSA-N 1 2 315.804 4.045 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(Cl)nc2Br)c1C ZINC001213524818 1037379900 /nfs/dbraw/zinc/37/99/00/1037379900.db2.gz FPWAIZFCUFVNJR-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC001143386932 1037401957 /nfs/dbraw/zinc/40/19/57/1037401957.db2.gz RFUCTOFEARWXNP-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC001143386932 1037401965 /nfs/dbraw/zinc/40/19/65/1037401965.db2.gz RFUCTOFEARWXNP-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001143387539 1037410881 /nfs/dbraw/zinc/41/08/81/1037410881.db2.gz LQJYVNFWCOKOFL-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001143387539 1037410887 /nfs/dbraw/zinc/41/08/87/1037410887.db2.gz LQJYVNFWCOKOFL-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO CCC[C@H](C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000023889308 1037460225 /nfs/dbraw/zinc/46/02/25/1037460225.db2.gz HZPNJILGZITJGH-IBGZPJMESA-N 1 2 319.408 4.395 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2csc(-c3ccco3)n2)o1 ZINC000067975095 1037528476 /nfs/dbraw/zinc/52/84/76/1037528476.db2.gz QIVOTNZPFFPTBZ-BXUZGUMPSA-N 1 2 314.410 4.409 20 0 DIADLO COCCCNc1cccc(F)c1Nc1c[nH+]cc(C)c1C ZINC001213534301 1037531434 /nfs/dbraw/zinc/53/14/34/1037531434.db2.gz WBFQVVPLRXAUEE-UHFFFAOYSA-N 1 2 303.381 4.030 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2cccc(OC(C)C)c2)s1 ZINC000283050443 1037533314 /nfs/dbraw/zinc/53/33/14/1037533314.db2.gz IYDJPOMOEPBWCC-NEPJUHHUSA-N 1 2 305.447 4.046 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCc2ccc(O)cc2C1 ZINC000581342111 1037543828 /nfs/dbraw/zinc/54/38/28/1037543828.db2.gz WQCQMEUJKWRQIC-CQSZACIVSA-N 1 2 320.392 4.167 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCc2ccc(O)cc2C1 ZINC000581342111 1037543845 /nfs/dbraw/zinc/54/38/45/1037543845.db2.gz WQCQMEUJKWRQIC-CQSZACIVSA-N 1 2 320.392 4.167 20 0 DIADLO Cc1cc(-c2nnc(C[N@@H+]3CCc4ccccc4[C@H]3C)o2)c(C)o1 ZINC000089896540 1037602285 /nfs/dbraw/zinc/60/22/85/1037602285.db2.gz GGQDERBZLAYNOE-CYBMUJFWSA-N 1 2 323.396 4.066 20 0 DIADLO Cc1cc(-c2nnc(C[N@H+]3CCc4ccccc4[C@H]3C)o2)c(C)o1 ZINC000089896540 1037602293 /nfs/dbraw/zinc/60/22/93/1037602293.db2.gz GGQDERBZLAYNOE-CYBMUJFWSA-N 1 2 323.396 4.066 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2cc(Cl)cc3c2OCC3)sc1C ZINC000933273222 1037616670 /nfs/dbraw/zinc/61/66/70/1037616670.db2.gz QVUWLIYPYJFDDV-SNVBAGLBSA-N 1 2 322.861 4.199 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(C(C)(C)C)cc2)o1 ZINC000341097760 1037675852 /nfs/dbraw/zinc/67/58/52/1037675852.db2.gz IFUUFAFNPXHIRK-STQMWFEESA-N 1 2 301.434 4.341 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(-c4cccs4)o3)ccc2[nH+]1 ZINC000341132945 1037680945 /nfs/dbraw/zinc/68/09/45/1037680945.db2.gz WIQFTYDUAIEDLJ-UHFFFAOYSA-N 1 2 323.377 4.217 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)C)n1 ZINC000072558002 1037687297 /nfs/dbraw/zinc/68/72/97/1037687297.db2.gz CXIJKXGMECEKBP-GOSISDBHSA-N 1 2 319.424 4.284 20 0 DIADLO Fc1ccc(COc2ccccc2-n2cc[nH+]c2)c(Cl)c1 ZINC000605434291 1037721861 /nfs/dbraw/zinc/72/18/61/1037721861.db2.gz YSCYZDVTUDIGEM-UHFFFAOYSA-N 1 2 302.736 4.244 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2c(F)c(F)cc(F)c2F)cc1 ZINC000090229009 1037760070 /nfs/dbraw/zinc/76/00/70/1037760070.db2.gz CINLMMDNLAKXDG-VIFPVBQESA-N 1 2 313.294 4.102 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1ccc(F)c(F)c1 ZINC000090228343 1037763708 /nfs/dbraw/zinc/76/37/08/1037763708.db2.gz IFQSDPSBUXFUJH-SSDOTTSWSA-N 1 2 319.248 4.372 20 0 DIADLO FC(F)(F)CC1C[NH+](Cc2cscc2C(F)(F)F)C1 ZINC000656688401 1037796156 /nfs/dbraw/zinc/79/61/56/1037796156.db2.gz NOJAPPFZMQFOPO-UHFFFAOYSA-N 1 2 303.271 4.151 20 0 DIADLO CC[C@H](C)n1ncc(NCc2c[nH+]c3ccc(C)cn23)c1C1CC1 ZINC000341254011 1037811499 /nfs/dbraw/zinc/81/14/99/1037811499.db2.gz DRCRBZDKAPFJEQ-AWEZNQCLSA-N 1 2 323.444 4.300 20 0 DIADLO c1c2ccncc2sc1CNc1ccc(N2CCCCC2)[nH+]c1 ZINC000656769699 1037854376 /nfs/dbraw/zinc/85/43/76/1037854376.db2.gz XJHXFCZIAPIVAA-UHFFFAOYSA-N 1 2 324.453 4.294 20 0 DIADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2Cc1csc(Br)c1 ZINC000625683394 1037855710 /nfs/dbraw/zinc/85/57/10/1037855710.db2.gz DKKMYRGNHIPWGD-AOOOYVTPSA-N 1 2 322.218 4.273 20 0 DIADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1csc(Br)c1 ZINC000625683394 1037855732 /nfs/dbraw/zinc/85/57/32/1037855732.db2.gz DKKMYRGNHIPWGD-AOOOYVTPSA-N 1 2 322.218 4.273 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+]2CCCCC[C@H]2c2ccco2)o1 ZINC000076804879 1037855939 /nfs/dbraw/zinc/85/59/39/1037855939.db2.gz IOBIVNUQOPTAPK-ZDUSSCGKSA-N 1 2 303.406 4.077 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+]2CCCCC[C@H]2c2ccco2)o1 ZINC000076804879 1037855958 /nfs/dbraw/zinc/85/59/58/1037855958.db2.gz IOBIVNUQOPTAPK-ZDUSSCGKSA-N 1 2 303.406 4.077 20 0 DIADLO COCc1csc(CNc2[nH+]c3ccccc3n2C2CC2)c1 ZINC000656771878 1037857538 /nfs/dbraw/zinc/85/75/38/1037857538.db2.gz HKFTVDWYPHIMGU-UHFFFAOYSA-N 1 2 313.426 4.191 20 0 DIADLO Cn1cc(CNc2c[nH+]cc3c2CCCC3)c(-c2cccs2)n1 ZINC000656776970 1037864559 /nfs/dbraw/zinc/86/45/59/1037864559.db2.gz WLMMYJLYWVSRBQ-UHFFFAOYSA-N 1 2 324.453 4.035 20 0 DIADLO Clc1cnc2oc(CNc3c[nH+]cc4c3CCCC4)cc2c1 ZINC000656776157 1037865751 /nfs/dbraw/zinc/86/57/51/1037865751.db2.gz JVWSTHLFPNZSOO-UHFFFAOYSA-N 1 2 313.788 4.367 20 0 DIADLO Fc1cc(F)c(F)c(C[NH2+]Cc2ccc(C(F)F)cc2)c1F ZINC000684382529 1037906817 /nfs/dbraw/zinc/90/68/17/1037906817.db2.gz UGGIOJAGXOPAOA-UHFFFAOYSA-N 1 2 319.248 4.470 20 0 DIADLO C[C@H]1CSCC[N@@H+]1Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC001167478597 1037916185 /nfs/dbraw/zinc/91/61/85/1037916185.db2.gz UGXWPMNSWDZRSC-VIFPVBQESA-N 1 2 309.784 4.296 20 0 DIADLO C[C@H]1CSCC[N@H+]1Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC001167478597 1037916194 /nfs/dbraw/zinc/91/61/94/1037916194.db2.gz UGXWPMNSWDZRSC-VIFPVBQESA-N 1 2 309.784 4.296 20 0 DIADLO C[C@@]1([NH2+]Cc2nc(Cl)ccc2Cl)CCOc2ccccc21 ZINC000933374665 1037924242 /nfs/dbraw/zinc/92/42/42/1037924242.db2.gz NCFUOAKEIDYFED-MRXNPFEDSA-N 1 2 323.223 4.176 20 0 DIADLO C[N@H+](Cc1nnsc1Cl)[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000581772258 1037989013 /nfs/dbraw/zinc/98/90/13/1037989013.db2.gz NTFMUIOPSQODPB-HIFRSBDPSA-N 1 2 321.877 4.350 20 0 DIADLO C[N@@H+](Cc1nnsc1Cl)[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000581772258 1037989030 /nfs/dbraw/zinc/98/90/30/1037989030.db2.gz NTFMUIOPSQODPB-HIFRSBDPSA-N 1 2 321.877 4.350 20 0 DIADLO CC(C)CO[C@@H](C)c1noc(C[N@H+](C)[C@@H]2C=CCCCCC2)n1 ZINC000559105528 1038000090 /nfs/dbraw/zinc/00/00/90/1038000090.db2.gz CEXRFWIDLVZGDT-JKSUJKDBSA-N 1 2 321.465 4.124 20 0 DIADLO CC(C)CO[C@@H](C)c1noc(C[N@@H+](C)[C@@H]2C=CCCCCC2)n1 ZINC000559105528 1038000110 /nfs/dbraw/zinc/00/01/10/1038000110.db2.gz CEXRFWIDLVZGDT-JKSUJKDBSA-N 1 2 321.465 4.124 20 0 DIADLO CCCCC[N@H+](Cc1noc(Cc2ccccc2)n1)C(C)C ZINC000598135152 1038031960 /nfs/dbraw/zinc/03/19/60/1038031960.db2.gz ZOGZCLGYQAYBOC-UHFFFAOYSA-N 1 2 301.434 4.061 20 0 DIADLO CCCCC[N@@H+](Cc1noc(Cc2ccccc2)n1)C(C)C ZINC000598135152 1038031982 /nfs/dbraw/zinc/03/19/82/1038031982.db2.gz ZOGZCLGYQAYBOC-UHFFFAOYSA-N 1 2 301.434 4.061 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000602572511 1038040309 /nfs/dbraw/zinc/04/03/09/1038040309.db2.gz MEMCMCXGBHRUST-JQWIXIFHSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000602572511 1038040326 /nfs/dbraw/zinc/04/03/26/1038040326.db2.gz MEMCMCXGBHRUST-JQWIXIFHSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000602572515 1038041630 /nfs/dbraw/zinc/04/16/30/1038041630.db2.gz MEMCMCXGBHRUST-ZYHUDNBSSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000602572515 1038041650 /nfs/dbraw/zinc/04/16/50/1038041650.db2.gz MEMCMCXGBHRUST-ZYHUDNBSSA-N 1 2 323.305 4.069 20 0 DIADLO CCSCc1cc[nH+]c(NCc2nc3ccccc3nc2C)c1 ZINC000602577017 1038047853 /nfs/dbraw/zinc/04/78/53/1038047853.db2.gz MWEOSQKLYHCJFS-UHFFFAOYSA-N 1 2 324.453 4.198 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+](C)[C@H](C)c1ccccc1OC ZINC001143399933 1038049797 /nfs/dbraw/zinc/04/97/97/1038049797.db2.gz FVHCTQJILXJFIC-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+](C)[C@H](C)c1ccccc1OC ZINC001143399933 1038049818 /nfs/dbraw/zinc/04/98/18/1038049818.db2.gz FVHCTQJILXJFIC-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO CCCCc1noc([C@H](C)SCCc2[nH+]cc(C)cc2C)n1 ZINC000581884576 1038081985 /nfs/dbraw/zinc/08/19/85/1038081985.db2.gz OQMKVEBHUQKWRE-AWEZNQCLSA-N 1 2 319.474 4.461 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@H]2c2ccccc2Cl)c(C)[nH+]1 ZINC000097214014 1038082701 /nfs/dbraw/zinc/08/27/01/1038082701.db2.gz QHAHXXZHHMDYKP-GJZGRUSLSA-N 1 2 314.816 4.402 20 0 DIADLO Cc1cccc(-c2noc(C[N@@H+](C)[C@H](C)c3cccs3)n2)c1 ZINC000029710480 1038113751 /nfs/dbraw/zinc/11/37/51/1038113751.db2.gz KRFSWSDFATWQRW-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1cccc(-c2noc(C[N@H+](C)[C@H](C)c3cccs3)n2)c1 ZINC000029710480 1038113761 /nfs/dbraw/zinc/11/37/61/1038113761.db2.gz KRFSWSDFATWQRW-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2Br)n1 ZINC000127236999 1038128201 /nfs/dbraw/zinc/12/82/01/1038128201.db2.gz XKWJYALGDPNCNR-LLVKDONJSA-N 1 2 323.209 4.142 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@@H](CC(F)(F)F)c2ccccc2)n1 ZINC000341569040 1038142164 /nfs/dbraw/zinc/14/21/64/1038142164.db2.gz CGKZORVNMNLFKZ-HNNXBMFYSA-N 1 2 311.351 4.247 20 0 DIADLO CCC[N@H+](CCC(=O)Nc1cccc2ccccc21)CC(F)F ZINC000498551765 1038146705 /nfs/dbraw/zinc/14/67/05/1038146705.db2.gz BGMOBALTHCTKJG-UHFFFAOYSA-N 1 2 320.383 4.146 20 0 DIADLO CCC[N@@H+](CCC(=O)Nc1cccc2ccccc21)CC(F)F ZINC000498551765 1038146717 /nfs/dbraw/zinc/14/67/17/1038146717.db2.gz BGMOBALTHCTKJG-UHFFFAOYSA-N 1 2 320.383 4.146 20 0 DIADLO Cc1nccc(C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2F)n1 ZINC000692325213 1038150742 /nfs/dbraw/zinc/15/07/42/1038150742.db2.gz SFKZJZWGIOPECL-QMMMGPOBSA-N 1 2 314.191 4.082 20 0 DIADLO Cc1nccc(C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2F)n1 ZINC000692325210 1038150903 /nfs/dbraw/zinc/15/09/03/1038150903.db2.gz SFKZJZWGIOPECL-MRVPVSSYSA-N 1 2 314.191 4.082 20 0 DIADLO CC[N@H+](Cc1nc(C(C)(C)C)co1)[C@H](C)c1cccc(O)c1 ZINC000891713431 1038159443 /nfs/dbraw/zinc/15/94/43/1038159443.db2.gz DKLDIEJVUDWJQK-CYBMUJFWSA-N 1 2 302.418 4.261 20 0 DIADLO CC[N@@H+](Cc1nc(C(C)(C)C)co1)[C@H](C)c1cccc(O)c1 ZINC000891713431 1038159453 /nfs/dbraw/zinc/15/94/53/1038159453.db2.gz DKLDIEJVUDWJQK-CYBMUJFWSA-N 1 2 302.418 4.261 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)[nH]c1C ZINC000581954784 1038171369 /nfs/dbraw/zinc/17/13/69/1038171369.db2.gz JSFSZNGSLMRYOE-MRXNPFEDSA-N 1 2 309.816 4.306 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1nc2cccnc2s1 ZINC000341605123 1038171541 /nfs/dbraw/zinc/17/15/41/1038171541.db2.gz PLOVFUKHKQZMFM-UHFFFAOYSA-N 1 2 323.874 4.428 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1nc2cccnc2s1 ZINC000341605123 1038171552 /nfs/dbraw/zinc/17/15/52/1038171552.db2.gz PLOVFUKHKQZMFM-UHFFFAOYSA-N 1 2 323.874 4.428 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)Cc3c(C)oc4ccccc43)cc2[nH+]1 ZINC000341619974 1038182975 /nfs/dbraw/zinc/18/29/75/1038182975.db2.gz FVVOSNSPAWBZOO-UHFFFAOYSA-N 1 2 319.364 4.107 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000056493094 1038190735 /nfs/dbraw/zinc/19/07/35/1038190735.db2.gz SCYZLSIGOCSFPO-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000056493094 1038190742 /nfs/dbraw/zinc/19/07/42/1038190742.db2.gz SCYZLSIGOCSFPO-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO Cc1cc(NC(=O)C2(c3ccccc3)CCCCCC2)c(C)c[nH+]1 ZINC001266899651 1038206496 /nfs/dbraw/zinc/20/64/96/1038206496.db2.gz KTCVVMIVNVEDGR-UHFFFAOYSA-N 1 2 322.452 4.351 20 0 DIADLO CCC[C@@H](CC1CCCC1)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000603469754 1038213882 /nfs/dbraw/zinc/21/38/82/1038213882.db2.gz HYJFLXAVZRYSPM-ROUUACIJSA-N 1 2 317.477 4.043 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CC=C(c3c[nH]c4ccccc43)CC2)s1 ZINC000933819243 1038231418 /nfs/dbraw/zinc/23/14/18/1038231418.db2.gz NAIZEOSKDHFSLW-LBPRGKRZSA-N 1 2 324.453 4.178 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CC=C(c3c[nH]c4ccccc43)CC2)s1 ZINC000933819243 1038231431 /nfs/dbraw/zinc/23/14/31/1038231431.db2.gz NAIZEOSKDHFSLW-LBPRGKRZSA-N 1 2 324.453 4.178 20 0 DIADLO CCC[N@H+](Cc1ccno1)[C@@H](C)c1ccccc1Br ZINC000599203723 1038254675 /nfs/dbraw/zinc/25/46/75/1038254675.db2.gz BSNNMXUOFSEJIS-LBPRGKRZSA-N 1 2 323.234 4.410 20 0 DIADLO CCC[N@@H+](Cc1ccno1)[C@@H](C)c1ccccc1Br ZINC000599203723 1038254692 /nfs/dbraw/zinc/25/46/92/1038254692.db2.gz BSNNMXUOFSEJIS-LBPRGKRZSA-N 1 2 323.234 4.410 20 0 DIADLO CC[N@H+](Cc1ccc(F)cc1)Cc1c(F)c(F)ccc1OC ZINC001143413404 1038265463 /nfs/dbraw/zinc/26/54/63/1038265463.db2.gz PSAYXFRBBKABCZ-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccc(F)cc1)Cc1c(F)c(F)ccc1OC ZINC001143413404 1038265473 /nfs/dbraw/zinc/26/54/73/1038265473.db2.gz PSAYXFRBBKABCZ-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO Cc1ccnc(C[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)n1 ZINC000341795397 1038272400 /nfs/dbraw/zinc/27/24/00/1038272400.db2.gz GRIAPJYSYUXNRK-AWEZNQCLSA-N 1 2 301.459 4.136 20 0 DIADLO CC(C)c1ccc(CCC(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC000603785625 1038280640 /nfs/dbraw/zinc/28/06/40/1038280640.db2.gz GWQOBUXTAZFVAB-UHFFFAOYSA-N 1 2 307.397 4.029 20 0 DIADLO Fc1ccc(C2=CC[N@H+](Cc3cccnc3Cl)CC2)cc1 ZINC000171075959 1038319716 /nfs/dbraw/zinc/31/97/16/1038319716.db2.gz QDFQEESNEMPXTN-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Fc1ccc(C2=CC[N@@H+](Cc3cccnc3Cl)CC2)cc1 ZINC000171075959 1038319729 /nfs/dbraw/zinc/31/97/29/1038319729.db2.gz QDFQEESNEMPXTN-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)[nH]1 ZINC000277066144 1038360465 /nfs/dbraw/zinc/36/04/65/1038360465.db2.gz DNGRFPXNXOCCHV-SRVKXCTJSA-N 1 2 306.841 4.383 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2nc3c(s2)CCC3)C1 ZINC000669717642 1038424304 /nfs/dbraw/zinc/42/43/04/1038424304.db2.gz XHNIKTNJVBMRSN-SFHVURJKSA-N 1 2 316.445 4.011 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2nc3c(s2)CCC3)C1 ZINC000669717642 1038424312 /nfs/dbraw/zinc/42/43/12/1038424312.db2.gz XHNIKTNJVBMRSN-SFHVURJKSA-N 1 2 316.445 4.011 20 0 DIADLO COc1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2OC)cc1 ZINC000151123888 1038432258 /nfs/dbraw/zinc/43/22/58/1038432258.db2.gz JZVJHLNXHFXHLZ-HXUWFJFHSA-N 1 2 323.392 4.176 20 0 DIADLO Cc1nc2ccc(C[N@@H+]3CCCC[C@H]3c3cc[nH]n3)cc2s1 ZINC000348713228 1038440991 /nfs/dbraw/zinc/44/09/91/1038440991.db2.gz KEUZNJPRMSGPNU-INIZCTEOSA-N 1 2 312.442 4.055 20 0 DIADLO Cc1nc2ccc(C[N@H+]3CCCC[C@H]3c3cc[nH]n3)cc2s1 ZINC000348713228 1038440996 /nfs/dbraw/zinc/44/09/96/1038440996.db2.gz KEUZNJPRMSGPNU-INIZCTEOSA-N 1 2 312.442 4.055 20 0 DIADLO Cc1cc(N2CCC[C@H](c3ccccc3)CC2)nc(C2CC2)[nH+]1 ZINC000604757600 1038449391 /nfs/dbraw/zinc/44/93/91/1038449391.db2.gz KNLDFRWVRWBEAB-KRWDZBQOSA-N 1 2 307.441 4.437 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@H](Cc2ccccc2)c2cccs2)n1 ZINC000604891897 1038463333 /nfs/dbraw/zinc/46/33/33/1038463333.db2.gz FSOHDYQTDYMBBB-SWLSCSKDSA-N 1 2 313.426 4.074 20 0 DIADLO CCc1nc(C)c([C@H](C)[NH2+][C@@H](C)c2nnc([C@@H](C)CC)[nH]2)s1 ZINC000277266032 1038474234 /nfs/dbraw/zinc/47/42/34/1038474234.db2.gz PHGZDONTPHHCQP-NHCYSSNCSA-N 1 2 321.494 4.057 20 0 DIADLO CCc1ccc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000604997672 1038474477 /nfs/dbraw/zinc/47/44/77/1038474477.db2.gz ADNZCPNFOFOYGF-UHFFFAOYSA-N 1 2 305.425 4.175 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000604997672 1038474484 /nfs/dbraw/zinc/47/44/84/1038474484.db2.gz ADNZCPNFOFOYGF-UHFFFAOYSA-N 1 2 305.425 4.175 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)cc1 ZINC000604997708 1038474550 /nfs/dbraw/zinc/47/45/50/1038474550.db2.gz CXEUHYYVBBEJBA-IBGZPJMESA-N 1 2 317.379 4.101 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)cc1 ZINC000604997708 1038474555 /nfs/dbraw/zinc/47/45/55/1038474555.db2.gz CXEUHYYVBBEJBA-IBGZPJMESA-N 1 2 317.379 4.101 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2c(F)cncc2F)C1 ZINC001167503757 1038480409 /nfs/dbraw/zinc/48/04/09/1038480409.db2.gz DNUMUYXMYHAUHJ-DIFFPNOSSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2c(F)cncc2F)C1 ZINC001167503757 1038480415 /nfs/dbraw/zinc/48/04/15/1038480415.db2.gz DNUMUYXMYHAUHJ-DIFFPNOSSA-N 1 2 306.331 4.082 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2cc3ccccc3[nH]2)c(F)c1F ZINC000684663953 1038482102 /nfs/dbraw/zinc/48/21/02/1038482102.db2.gz HXJBYPFJRYYWJH-UHFFFAOYSA-N 1 2 308.278 4.014 20 0 DIADLO FC(F)(F)Oc1cc(Cl)ccc1C[N@@H+]1CCC2(CC2)C1 ZINC001143427964 1038497332 /nfs/dbraw/zinc/49/73/32/1038497332.db2.gz GTFSXTXPLGLQOE-UHFFFAOYSA-N 1 2 305.727 4.225 20 0 DIADLO FC(F)(F)Oc1cc(Cl)ccc1C[N@H+]1CCC2(CC2)C1 ZINC001143427964 1038497336 /nfs/dbraw/zinc/49/73/36/1038497336.db2.gz GTFSXTXPLGLQOE-UHFFFAOYSA-N 1 2 305.727 4.225 20 0 DIADLO c1csc(-c2cc(COc3ccccc3-n3cc[nH+]c3)no2)c1 ZINC000605434217 1038516846 /nfs/dbraw/zinc/51/68/46/1038516846.db2.gz NZSLIFVJIBTWMQ-UHFFFAOYSA-N 1 2 323.377 4.168 20 0 DIADLO CC[C@@H](c1ccccc1)N1CC[NH+](Cc2cccs2)CC1 ZINC000060876249 1038527961 /nfs/dbraw/zinc/52/79/61/1038527961.db2.gz XPSBRTQSMLBGJZ-SFHVURJKSA-N 1 2 300.471 4.017 20 0 DIADLO O=C(C[N@H+]1CCC[C@H]1c1cccc(Cl)c1)Nc1ccccc1 ZINC000071953734 1038540010 /nfs/dbraw/zinc/54/00/10/1038540010.db2.gz LQBBELPIXVHTMP-KRWDZBQOSA-N 1 2 314.816 4.116 20 0 DIADLO O=C(C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1)Nc1ccccc1 ZINC000071953734 1038540015 /nfs/dbraw/zinc/54/00/15/1038540015.db2.gz LQBBELPIXVHTMP-KRWDZBQOSA-N 1 2 314.816 4.116 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1)[N@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000605732443 1038548043 /nfs/dbraw/zinc/54/80/43/1038548043.db2.gz FKCGKFIKZGVGTH-LBPRGKRZSA-N 1 2 321.852 4.084 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000605732443 1038548045 /nfs/dbraw/zinc/54/80/45/1038548045.db2.gz FKCGKFIKZGVGTH-LBPRGKRZSA-N 1 2 321.852 4.084 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1ccc(F)c(F)c1F ZINC000657315895 1038556445 /nfs/dbraw/zinc/55/64/45/1038556445.db2.gz SQSVQNKRUHRBSL-SECBINFHSA-N 1 2 313.294 4.102 20 0 DIADLO O=C(CC/C=C\c1ccccc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000606168237 1038573963 /nfs/dbraw/zinc/57/39/63/1038573963.db2.gz OYWADELGKNROMG-YWEYNIOJSA-N 1 2 317.392 4.304 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1csc(Cl)n1)C(C)(C)C ZINC000934289410 1038581337 /nfs/dbraw/zinc/58/13/37/1038581337.db2.gz NDXFYMQORXTZQM-CYBMUJFWSA-N 1 2 309.866 4.377 20 0 DIADLO CC[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1nc(C)cs1 ZINC000657350951 1038594439 /nfs/dbraw/zinc/59/44/39/1038594439.db2.gz YJQIQHPLZWRHAC-AWEZNQCLSA-N 1 2 320.433 4.373 20 0 DIADLO Cc1cccc(C)c1C[N@@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000606431697 1038601610 /nfs/dbraw/zinc/60/16/10/1038601610.db2.gz ODIMBVIQPQQTMV-KRWDZBQOSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1cccc(C)c1C[N@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000606431697 1038601616 /nfs/dbraw/zinc/60/16/16/1038601616.db2.gz ODIMBVIQPQQTMV-KRWDZBQOSA-N 1 2 311.429 4.291 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@@H+]1CCOc2ccccc2C1 ZINC000606431716 1038601730 /nfs/dbraw/zinc/60/17/30/1038601730.db2.gz SNKOMMFAIKKNEL-KRWDZBQOSA-N 1 2 303.352 4.311 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@H+]1CCOc2ccccc2C1 ZINC000606431716 1038601732 /nfs/dbraw/zinc/60/17/32/1038601732.db2.gz SNKOMMFAIKKNEL-KRWDZBQOSA-N 1 2 303.352 4.311 20 0 DIADLO Fc1ccc(C[NH2+]C2(c3nccs3)CCCC2)c(F)c1F ZINC000657364080 1038608590 /nfs/dbraw/zinc/60/85/90/1038608590.db2.gz TUSBSPVUEZOZBI-UHFFFAOYSA-N 1 2 312.360 4.120 20 0 DIADLO CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000606570163 1038614549 /nfs/dbraw/zinc/61/45/49/1038614549.db2.gz YWOZYDIWZUNJKH-CZUORRHYSA-N 1 2 314.433 4.075 20 0 DIADLO CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000606570161 1038615186 /nfs/dbraw/zinc/61/51/86/1038615186.db2.gz YWOZYDIWZUNJKH-BBRMVZONSA-N 1 2 314.433 4.075 20 0 DIADLO C[C@H](c1ccc2ccccc2c1)[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000606904637 1038639139 /nfs/dbraw/zinc/63/91/39/1038639139.db2.gz OBYCQMDHVAVYRC-MLGOLLRUSA-N 1 2 309.331 4.164 20 0 DIADLO C[C@H](c1ccc2ccccc2c1)[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000606904637 1038639141 /nfs/dbraw/zinc/63/91/41/1038639141.db2.gz OBYCQMDHVAVYRC-MLGOLLRUSA-N 1 2 309.331 4.164 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Br)[nH]2)cc1 ZINC001232683876 1038643621 /nfs/dbraw/zinc/64/36/21/1038643621.db2.gz JMZHZGZFBXNXCX-CQSZACIVSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Br)[nH]2)cc1 ZINC001232683876 1038643624 /nfs/dbraw/zinc/64/36/24/1038643624.db2.gz JMZHZGZFBXNXCX-CQSZACIVSA-N 1 2 323.209 4.253 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(Br)[nH]1 ZINC001232693797 1038655927 /nfs/dbraw/zinc/65/59/27/1038655927.db2.gz LMZLULJOJMMVJV-HNNXBMFYSA-N 1 2 319.246 4.287 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc(Br)[nH]1 ZINC001232693797 1038655932 /nfs/dbraw/zinc/65/59/32/1038655932.db2.gz LMZLULJOJMMVJV-HNNXBMFYSA-N 1 2 319.246 4.287 20 0 DIADLO Cc1ccccc1[C@H]1C[C@H]([NH2+][C@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC000582413627 1038659537 /nfs/dbraw/zinc/65/95/37/1038659537.db2.gz WPDGJKKSSGTTGC-LNLFQRSKSA-N 1 2 324.472 4.270 20 0 DIADLO CCCc1nc(C[N@H+](CC2CCC2)[C@@H](C)c2ccccc2)no1 ZINC000607158887 1038660640 /nfs/dbraw/zinc/66/06/40/1038660640.db2.gz ZHALNYUOXVIEJQ-HNNXBMFYSA-N 1 2 313.445 4.385 20 0 DIADLO CCCc1nc(C[N@@H+](CC2CCC2)[C@@H](C)c2ccccc2)no1 ZINC000607158887 1038660646 /nfs/dbraw/zinc/66/06/46/1038660646.db2.gz ZHALNYUOXVIEJQ-HNNXBMFYSA-N 1 2 313.445 4.385 20 0 DIADLO CCc1cccc2cc(C[NH2+][C@H](C)c3nnc(C)s3)oc21 ZINC000657434166 1038672513 /nfs/dbraw/zinc/67/25/13/1038672513.db2.gz HEBUDEBAGGDAOM-SNVBAGLBSA-N 1 2 301.415 4.006 20 0 DIADLO Cc1cccn2c(/C=C\c3ccc4cccc(O)c4n3)c[nH+]c12 ZINC000607436069 1038681712 /nfs/dbraw/zinc/68/17/12/1038681712.db2.gz OATAPOXWGLGZQO-KTKRTIGZSA-N 1 2 301.349 4.067 20 0 DIADLO Cc1cccn2c(/C=C/c3ccc4cccc(O)c4n3)c[nH+]c12 ZINC000607436073 1038681728 /nfs/dbraw/zinc/68/17/28/1038681728.db2.gz OATAPOXWGLGZQO-MDZDMXLPSA-N 1 2 301.349 4.067 20 0 DIADLO COC(=O)c1occc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000342599801 1038684579 /nfs/dbraw/zinc/68/45/79/1038684579.db2.gz QAFJBINIGGXTKN-HNNXBMFYSA-N 1 2 319.788 4.057 20 0 DIADLO COC(=O)c1occc1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000342599801 1038684581 /nfs/dbraw/zinc/68/45/81/1038684581.db2.gz QAFJBINIGGXTKN-HNNXBMFYSA-N 1 2 319.788 4.057 20 0 DIADLO COC(=O)c1ccoc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000342602492 1038684818 /nfs/dbraw/zinc/68/48/18/1038684818.db2.gz VBPYRTMDMWUUHX-OAHLLOKOSA-N 1 2 319.788 4.057 20 0 DIADLO COC(=O)c1ccoc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000342602492 1038684824 /nfs/dbraw/zinc/68/48/24/1038684824.db2.gz VBPYRTMDMWUUHX-OAHLLOKOSA-N 1 2 319.788 4.057 20 0 DIADLO CC[N@H+](Cc1ncc(COC)s1)[C@H](C)c1ccc(F)cc1 ZINC000342618260 1038689397 /nfs/dbraw/zinc/68/93/97/1038689397.db2.gz CEWSPSIFQQZMQP-GFCCVEGCSA-N 1 2 308.422 4.012 20 0 DIADLO CC[N@@H+](Cc1ncc(COC)s1)[C@H](C)c1ccc(F)cc1 ZINC000342618260 1038689402 /nfs/dbraw/zinc/68/94/02/1038689402.db2.gz CEWSPSIFQQZMQP-GFCCVEGCSA-N 1 2 308.422 4.012 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(c3cc(C)ccc3C)C(C)C)ccn12 ZINC001125603184 1038693047 /nfs/dbraw/zinc/69/30/47/1038693047.db2.gz HPIJKFAXAKBKRP-UHFFFAOYSA-N 1 2 321.424 4.315 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@H+](C)Cc2ccoc2)c(Cl)c1 ZINC000342646101 1038698903 /nfs/dbraw/zinc/69/89/03/1038698903.db2.gz SQFXAVBWENAGNB-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@@H+](C)Cc2ccoc2)c(Cl)c1 ZINC000342646101 1038698909 /nfs/dbraw/zinc/69/89/09/1038698909.db2.gz SQFXAVBWENAGNB-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Fc1cccc(Cl)c1C[N@@H+]1CC[C@H]1COCc1ccccc1 ZINC001203406596 1038711669 /nfs/dbraw/zinc/71/16/69/1038711669.db2.gz IYQVATHLONMJKG-HNNXBMFYSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1cccc(Cl)c1C[N@H+]1CC[C@H]1COCc1ccccc1 ZINC001203406596 1038711673 /nfs/dbraw/zinc/71/16/73/1038711673.db2.gz IYQVATHLONMJKG-HNNXBMFYSA-N 1 2 319.807 4.270 20 0 DIADLO Cn1cc(Cl)c(C[NH2+]Cc2cccc(C3CCCC3)c2)n1 ZINC000657481573 1038718403 /nfs/dbraw/zinc/71/84/03/1038718403.db2.gz SFVJDHFFNROQGZ-UHFFFAOYSA-N 1 2 303.837 4.021 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)Cc1ccc2c(c1)ncn2C ZINC000342681003 1038718496 /nfs/dbraw/zinc/71/84/96/1038718496.db2.gz MWSVLCNDYIBHNB-LBPRGKRZSA-N 1 2 315.367 4.045 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccc2c(c1)ncn2C ZINC000342681003 1038718501 /nfs/dbraw/zinc/71/85/01/1038718501.db2.gz MWSVLCNDYIBHNB-LBPRGKRZSA-N 1 2 315.367 4.045 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1csc(-c2ccco2)n1 ZINC000607747419 1038720004 /nfs/dbraw/zinc/72/00/04/1038720004.db2.gz ABZHLXNAJAYDOD-CYBMUJFWSA-N 1 2 310.422 4.350 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1csc(-c2ccco2)n1 ZINC000607747419 1038720009 /nfs/dbraw/zinc/72/00/09/1038720009.db2.gz ABZHLXNAJAYDOD-CYBMUJFWSA-N 1 2 310.422 4.350 20 0 DIADLO CC[C@H](C)[C@@H](C(=O)Nc1cccc2[nH+]ccn21)c1ccccc1 ZINC000607714934 1038726300 /nfs/dbraw/zinc/72/63/00/1038726300.db2.gz NXDPMUCYMCBHDU-KBXCAEBGSA-N 1 2 307.397 4.103 20 0 DIADLO FC(F)C[N@@H+](Cc1ccccc1)C[C@H]1CCCC12CCOCC2 ZINC001167589352 1038726506 /nfs/dbraw/zinc/72/65/06/1038726506.db2.gz CQSFZSKDMOUADE-QGZVFWFLSA-N 1 2 323.427 4.351 20 0 DIADLO FC(F)C[N@H+](Cc1ccccc1)C[C@H]1CCCC12CCOCC2 ZINC001167589352 1038726507 /nfs/dbraw/zinc/72/65/07/1038726507.db2.gz CQSFZSKDMOUADE-QGZVFWFLSA-N 1 2 323.427 4.351 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)c2cccc(Cl)c2)c(C)[nH+]1 ZINC000607779237 1038734068 /nfs/dbraw/zinc/73/40/68/1038734068.db2.gz YTKMLBDSRDQHDR-GFCCVEGCSA-N 1 2 302.805 4.402 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@H]1CCCc2cccnc21)c1ccco1 ZINC000684955913 1038741007 /nfs/dbraw/zinc/74/10/07/1038741007.db2.gz SASOBLQZTLZIKF-IRXDYDNUSA-N 1 2 314.429 4.056 20 0 DIADLO C[N@H+](CCOc1ccccc1Cl)Cc1nc(C2CC2)cs1 ZINC000342722348 1038741854 /nfs/dbraw/zinc/74/18/54/1038741854.db2.gz HBMSECZRVFDQTE-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO C[N@@H+](CCOc1ccccc1Cl)Cc1nc(C2CC2)cs1 ZINC000342722348 1038741859 /nfs/dbraw/zinc/74/18/59/1038741859.db2.gz HBMSECZRVFDQTE-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO Cc1cc(C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)co1 ZINC000277768451 1038744201 /nfs/dbraw/zinc/74/42/01/1038744201.db2.gz SKESAPUPORPNQL-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO Cn1nc(-c2ccccc2)cc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213085216 1038753193 /nfs/dbraw/zinc/75/31/93/1038753193.db2.gz APHKIVAVBYPUIB-UHFFFAOYSA-N 1 2 315.380 4.221 20 0 DIADLO Cc1ccc(F)c(C[NH2+][C@@H](c2ccccc2)c2ccccn2)c1 ZINC000116912232 1038762152 /nfs/dbraw/zinc/76/21/52/1038762152.db2.gz LNDKVXXHAUNNRD-FQEVSTJZSA-N 1 2 306.384 4.408 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2c(Cl)ccnc21)c1c(F)cncc1F ZINC000926420866 1038762366 /nfs/dbraw/zinc/76/23/66/1038762366.db2.gz YSKJODPUYQDLJS-LKFCYVNXSA-N 1 2 323.774 4.136 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2c(Cl)ccnc21)c1c(F)cncc1F ZINC000926420871 1038762980 /nfs/dbraw/zinc/76/29/80/1038762980.db2.gz YSKJODPUYQDLJS-YMTOWFKASA-N 1 2 323.774 4.136 20 0 DIADLO C[C@@H]([NH2+]Cc1cc2ccccc2s1)c1nc(C(C)(C)C)no1 ZINC000237386772 1038763377 /nfs/dbraw/zinc/76/33/77/1038763377.db2.gz WOTSDMIDHMQVOP-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc(C2CC2)cs1 ZINC000342766876 1038764376 /nfs/dbraw/zinc/76/43/76/1038764376.db2.gz YMOVQVRPPUCARO-JTQLQIEISA-N 1 2 308.397 4.492 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc(C2CC2)cs1 ZINC000342766876 1038764384 /nfs/dbraw/zinc/76/43/84/1038764384.db2.gz YMOVQVRPPUCARO-JTQLQIEISA-N 1 2 308.397 4.492 20 0 DIADLO Cc1cnc(C[N@@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)n1C ZINC000342790872 1038788212 /nfs/dbraw/zinc/78/82/12/1038788212.db2.gz BLUABHKQADNPBL-CYBMUJFWSA-N 1 2 303.837 4.108 20 0 DIADLO Cc1cnc(C[N@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)n1C ZINC000342790872 1038788226 /nfs/dbraw/zinc/78/82/26/1038788226.db2.gz BLUABHKQADNPBL-CYBMUJFWSA-N 1 2 303.837 4.108 20 0 DIADLO Cc1c[nH+]c(CN([C@H](C)c2ccc(Cl)cc2)C2CC2)n1C ZINC000342790872 1038788239 /nfs/dbraw/zinc/78/82/39/1038788239.db2.gz BLUABHKQADNPBL-CYBMUJFWSA-N 1 2 303.837 4.108 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000075532035 1038798215 /nfs/dbraw/zinc/79/82/15/1038798215.db2.gz AWVAPYNZPNPTCT-JKSUJKDBSA-N 1 2 305.466 4.112 20 0 DIADLO Cc1c[nH+]c(CN([C@H](C)c2ccccc2Cl)C2CC2)n1C ZINC000342799883 1038799058 /nfs/dbraw/zinc/79/90/58/1038799058.db2.gz PFSVFYSBKJPSTG-CYBMUJFWSA-N 1 2 303.837 4.108 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+](C)Cc2ccc(F)cc2)o1 ZINC000075592439 1038810060 /nfs/dbraw/zinc/81/00/60/1038810060.db2.gz DXCAXWBTXUARQY-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+](C)Cc2ccc(F)cc2)o1 ZINC000075592439 1038810091 /nfs/dbraw/zinc/81/00/91/1038810091.db2.gz DXCAXWBTXUARQY-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2C[C@H](C)C[C@H]2c2ccccc2F)n1 ZINC000075900504 1038820617 /nfs/dbraw/zinc/82/06/17/1038820617.db2.gz FHPFQCGIKUYCPV-KDOFPFPSSA-N 1 2 301.409 4.186 20 0 DIADLO CC(C)n1ccc(C[N@H+]2C[C@H](C)C[C@H]2c2ccccc2F)n1 ZINC000075900504 1038820641 /nfs/dbraw/zinc/82/06/41/1038820641.db2.gz FHPFQCGIKUYCPV-KDOFPFPSSA-N 1 2 301.409 4.186 20 0 DIADLO COCc1nc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccc(F)c2)cs1 ZINC000075842846 1038826308 /nfs/dbraw/zinc/82/63/08/1038826308.db2.gz GZSZPTDPMOBKMY-WBMJQRKESA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@H+]2C[C@H](C)C[C@H]2c2cccc(F)c2)cs1 ZINC000075842846 1038826332 /nfs/dbraw/zinc/82/63/32/1038826332.db2.gz GZSZPTDPMOBKMY-WBMJQRKESA-N 1 2 320.433 4.012 20 0 DIADLO CC(C)=C[C@@H]1[C@H](C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)C1(C)C ZINC000029912782 1038842942 /nfs/dbraw/zinc/84/29/42/1038842942.db2.gz ZEKFOXKKNMHMIK-IAGOWNOFSA-N 1 2 309.413 4.049 20 0 DIADLO CCC[C@@H]1CCCC[N@@H+]1Cc1nc(Br)cs1 ZINC001137779874 1038879024 /nfs/dbraw/zinc/87/90/24/1038879024.db2.gz QOPQUOHDDLWYBS-SNVBAGLBSA-N 1 2 303.269 4.060 20 0 DIADLO CCC[C@@H]1CCCC[N@H+]1Cc1nc(Br)cs1 ZINC001137779874 1038879041 /nfs/dbraw/zinc/87/90/41/1038879041.db2.gz QOPQUOHDDLWYBS-SNVBAGLBSA-N 1 2 303.269 4.060 20 0 DIADLO Brc1ccc2[nH]c3c(c2c1)C[N@H+](CC1CCC1)CC3 ZINC000608561883 1038884972 /nfs/dbraw/zinc/88/49/72/1038884972.db2.gz HGDCWVWANKUJND-UHFFFAOYSA-N 1 2 319.246 4.089 20 0 DIADLO Brc1ccc2[nH]c3c(c2c1)C[N@@H+](CC1CCC1)CC3 ZINC000608561883 1038884983 /nfs/dbraw/zinc/88/49/83/1038884983.db2.gz HGDCWVWANKUJND-UHFFFAOYSA-N 1 2 319.246 4.089 20 0 DIADLO CC[C@@H](C)Oc1cc(C[NH2+][C@H](C)c2cscn2)ccc1OC ZINC000657599693 1038899734 /nfs/dbraw/zinc/89/97/34/1038899734.db2.gz QIOHIHPNUYFHOI-CHWSQXEVSA-N 1 2 320.458 4.180 20 0 DIADLO C[C@H]1C[N@H+](CCc2ccc3ccccc3c2)C[C@@H](C(F)(F)F)O1 ZINC000608751721 1038912184 /nfs/dbraw/zinc/91/21/84/1038912184.db2.gz VXEFCXQPTQCIFF-GUYCJALGSA-N 1 2 323.358 4.034 20 0 DIADLO C[C@H]1C[N@@H+](CCc2ccc3ccccc3c2)C[C@@H](C(F)(F)F)O1 ZINC000608751721 1038912195 /nfs/dbraw/zinc/91/21/95/1038912195.db2.gz VXEFCXQPTQCIFF-GUYCJALGSA-N 1 2 323.358 4.034 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2cnc(C)o2)s1 ZINC000628156369 1038920338 /nfs/dbraw/zinc/92/03/38/1038920338.db2.gz MNBGLEJQHRIEQK-UHFFFAOYSA-N 1 2 302.399 4.148 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2cnc(C)o2)s1 ZINC000628156369 1038920357 /nfs/dbraw/zinc/92/03/57/1038920357.db2.gz MNBGLEJQHRIEQK-UHFFFAOYSA-N 1 2 302.399 4.148 20 0 DIADLO CC(=O)Nc1cc(NCc2cc(C)[nH+]c3c2CCCC3)ccc1C ZINC000892308562 1038950699 /nfs/dbraw/zinc/95/06/99/1038950699.db2.gz QEZLVCDZZPDNFM-UHFFFAOYSA-N 1 2 323.440 4.148 20 0 DIADLO COc1cccc2c(N3C[C@@H](C(F)(F)F)CC[C@H]3C)cc[nH+]c12 ZINC000685039669 1038985893 /nfs/dbraw/zinc/98/58/93/1038985893.db2.gz YYAWFIOQZUPSTJ-NEPJUHHUSA-N 1 2 324.346 4.411 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H]2CC(C)(C)CCc3ccccc32)no1 ZINC000685041751 1038995012 /nfs/dbraw/zinc/99/50/12/1038995012.db2.gz MJLACOZNBLSPSV-MRXNPFEDSA-N 1 2 313.445 4.386 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000078656675 1038996469 /nfs/dbraw/zinc/99/64/69/1038996469.db2.gz QYHWZIDDOKBWGP-HNNXBMFYSA-N 1 2 307.825 4.333 20 0 DIADLO COCc1cnc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccc(C)o2)s1 ZINC000342924501 1039014174 /nfs/dbraw/zinc/01/41/74/1039014174.db2.gz FGLRSLXKZVCDOB-SWLSCSKDSA-N 1 2 320.458 4.164 20 0 DIADLO COCc1cnc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccc(C)o2)s1 ZINC000342924501 1039014188 /nfs/dbraw/zinc/01/41/88/1039014188.db2.gz FGLRSLXKZVCDOB-SWLSCSKDSA-N 1 2 320.458 4.164 20 0 DIADLO O=c1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c2ccccc2[nH]1 ZINC001213086048 1039015569 /nfs/dbraw/zinc/01/55/69/1039015569.db2.gz FMVLWKMVWIHPFR-UHFFFAOYSA-N 1 2 302.337 4.074 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc(F)cc1F ZINC000120904760 1039023310 /nfs/dbraw/zinc/02/33/10/1039023310.db2.gz TZECOFRSQQAGAL-GFCCVEGCSA-N 1 2 305.372 4.127 20 0 DIADLO C[C@@H]([NH2+][C@@H](CC(F)(F)F)c1ccccc1)c1cscn1 ZINC000534329623 1039030979 /nfs/dbraw/zinc/03/09/79/1039030979.db2.gz REZWGTZBEBEVDO-PWSUYJOCSA-N 1 2 300.349 4.487 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2ccc(OC(C)C)cc2)cs1 ZINC000534349606 1039036091 /nfs/dbraw/zinc/03/60/91/1039036091.db2.gz CVZYTFHEADAQTH-UHFFFAOYSA-N 1 2 304.459 4.125 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2ccc(OC(C)C)cc2)cs1 ZINC000534349606 1039036098 /nfs/dbraw/zinc/03/60/98/1039036098.db2.gz CVZYTFHEADAQTH-UHFFFAOYSA-N 1 2 304.459 4.125 20 0 DIADLO COCc1cnc(C[N@H+](Cc2ccoc2)C2CCCCC2)s1 ZINC000342942155 1039036729 /nfs/dbraw/zinc/03/67/29/1039036729.db2.gz LHUUEQKQTYYENY-UHFFFAOYSA-N 1 2 320.458 4.217 20 0 DIADLO COCc1cnc(C[N@@H+](Cc2ccoc2)C2CCCCC2)s1 ZINC000342942155 1039036749 /nfs/dbraw/zinc/03/67/49/1039036749.db2.gz LHUUEQKQTYYENY-UHFFFAOYSA-N 1 2 320.458 4.217 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+](C)Cc1ccc2[nH]cnc2c1 ZINC000534336720 1039039323 /nfs/dbraw/zinc/03/93/23/1039039323.db2.gz NKZYNXMCTRMWGS-LLVKDONJSA-N 1 2 301.340 4.034 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccc2[nH]cnc2c1 ZINC000534336720 1039039343 /nfs/dbraw/zinc/03/93/43/1039039343.db2.gz NKZYNXMCTRMWGS-LLVKDONJSA-N 1 2 301.340 4.034 20 0 DIADLO Cc1ccc(C[NH2+]Cc2cc(Oc3ccc(F)cc3)ccn2)o1 ZINC000342982228 1039076939 /nfs/dbraw/zinc/07/69/39/1039076939.db2.gz WLRICIHYICNODQ-UHFFFAOYSA-N 1 2 312.344 4.204 20 0 DIADLO CCc1ccc([C@@H](C)CC(=O)NCc2c[nH+]c(C)cc2C)cc1 ZINC000456833924 1039083986 /nfs/dbraw/zinc/08/39/86/1039083986.db2.gz GUYTXDFRMVJOEF-HNNXBMFYSA-N 1 2 310.441 4.071 20 0 DIADLO CSc1ccc(Cl)c(C(=O)NCc2c[nH+]c(C)cc2C)c1 ZINC000456863665 1039089010 /nfs/dbraw/zinc/08/90/10/1039089010.db2.gz RMQSPMWVYHJPIX-UHFFFAOYSA-N 1 2 320.845 4.004 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1nc2c(s1)CCCC2 ZINC000091724599 1039110527 /nfs/dbraw/zinc/11/05/27/1039110527.db2.gz LWYVLNRVNNFYQY-ONGXEEELSA-N 1 2 305.447 4.039 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1nc2c(s1)CCCC2 ZINC000091724600 1039110826 /nfs/dbraw/zinc/11/08/26/1039110826.db2.gz LWYVLNRVNNFYQY-MWLCHTKSSA-N 1 2 305.447 4.039 20 0 DIADLO CC(C)CC1(C)CCN(C(=O)Nc2ccc3[nH+]ccn3c2)CC1 ZINC000685079373 1039136937 /nfs/dbraw/zinc/13/69/37/1039136937.db2.gz JHSYPZVDVVEJIK-UHFFFAOYSA-N 1 2 314.433 4.014 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+]2CCC[C@@H]2c2ccncc2)o1 ZINC000153915505 1039148219 /nfs/dbraw/zinc/14/82/19/1039148219.db2.gz ZFVVYBUKFYKBQP-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+]2CCC[C@@H]2c2ccncc2)o1 ZINC000153915505 1039148225 /nfs/dbraw/zinc/14/82/25/1039148225.db2.gz ZFVVYBUKFYKBQP-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Cc1[nH]c(CN2CCc3c(Cl)cc(Cl)cc3[C@@H]2C)[nH+]c1C ZINC001167658273 1039199071 /nfs/dbraw/zinc/19/90/71/1039199071.db2.gz DQZSAUWSJGCRFL-NSHDSACASA-N 1 2 324.255 4.453 20 0 DIADLO CSCc1cnc(C[N@H+](C)Cc2cc(C)ccc2C)s1 ZINC000353202463 1039242596 /nfs/dbraw/zinc/24/25/96/1039242596.db2.gz JTNMLPKAOAPTTG-UHFFFAOYSA-N 1 2 306.500 4.255 20 0 DIADLO CSCc1cnc(C[N@@H+](C)Cc2cc(C)ccc2C)s1 ZINC000353202463 1039242606 /nfs/dbraw/zinc/24/26/06/1039242606.db2.gz JTNMLPKAOAPTTG-UHFFFAOYSA-N 1 2 306.500 4.255 20 0 DIADLO CCSc1cccc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC000343166403 1039265672 /nfs/dbraw/zinc/26/56/72/1039265672.db2.gz ZSNDCUWGABQFGE-UHFFFAOYSA-N 1 2 323.421 4.237 20 0 DIADLO Cc1ccc2ncc(C[NH2+][C@H](c3ccco3)c3ccccc3)n2c1 ZINC000155701039 1039276137 /nfs/dbraw/zinc/27/61/37/1039276137.db2.gz QQYKTYLGRRRVDI-FQEVSTJZSA-N 1 2 317.392 4.115 20 0 DIADLO COC[C@@H]([NH2+]Cc1csc(C(C)(C)C)n1)c1ccc(F)cc1 ZINC000539519391 1039285134 /nfs/dbraw/zinc/28/51/34/1039285134.db2.gz ZUONIFKQHJUFLS-OAHLLOKOSA-N 1 2 322.449 4.057 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCOC3(CCCC3)C2)cc1Cl ZINC001167668652 1039332914 /nfs/dbraw/zinc/33/29/14/1039332914.db2.gz OOQOSQQPOADVMO-UHFFFAOYSA-N 1 2 323.864 4.272 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCOC3(CCCC3)C2)cc1Cl ZINC001167668652 1039332932 /nfs/dbraw/zinc/33/29/32/1039332932.db2.gz OOQOSQQPOADVMO-UHFFFAOYSA-N 1 2 323.864 4.272 20 0 DIADLO CC[N@H+](Cc1ccc(COC)cc1)Cc1c(F)cccc1F ZINC000539816639 1039344969 /nfs/dbraw/zinc/34/49/69/1039344969.db2.gz MEVBJUUVUYECJV-UHFFFAOYSA-N 1 2 305.368 4.133 20 0 DIADLO CC[N@@H+](Cc1ccc(COC)cc1)Cc1c(F)cccc1F ZINC000539816639 1039344989 /nfs/dbraw/zinc/34/49/89/1039344989.db2.gz MEVBJUUVUYECJV-UHFFFAOYSA-N 1 2 305.368 4.133 20 0 DIADLO c1[nH+]c(-c2ccc(NC[C@H]3CCSC3)cc2)n2c1CCCC2 ZINC000278287787 1039352422 /nfs/dbraw/zinc/35/24/22/1039352422.db2.gz AYJZYFKAIISPQN-CQSZACIVSA-N 1 2 313.470 4.051 20 0 DIADLO CC(C)C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccncc1 ZINC000647297426 1039358294 /nfs/dbraw/zinc/35/82/94/1039358294.db2.gz BVKIXMNZPXIXEA-SFHVURJKSA-N 1 2 310.445 4.276 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CCc3ccc(F)cc3C2)s1 ZINC000539839493 1039372911 /nfs/dbraw/zinc/37/29/11/1039372911.db2.gz CARMFSYFZAOSOW-UHFFFAOYSA-N 1 2 304.434 4.138 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CCc3ccc(F)cc3C2)s1 ZINC000539839493 1039372922 /nfs/dbraw/zinc/37/29/22/1039372922.db2.gz CARMFSYFZAOSOW-UHFFFAOYSA-N 1 2 304.434 4.138 20 0 DIADLO CCC1(C(=O)Oc2ccc(-c3[nH+]cc4n3CCCC4)cc2)CCC1 ZINC001272320835 1039393926 /nfs/dbraw/zinc/39/39/26/1039393926.db2.gz ROUUTCDQRGOZGH-UHFFFAOYSA-N 1 2 324.424 4.372 20 0 DIADLO Cc1nc(N[C@@H](C)c2ccc(Oc3ccccc3)c(F)c2)cc[nH+]1 ZINC000462792010 1039397381 /nfs/dbraw/zinc/39/73/81/1039397381.db2.gz UTYNYUQXTHBPKW-ZDUSSCGKSA-N 1 2 323.371 4.890 20 0 DIADLO CCc1ccc(C2=CC[N@H+](Cc3nccn3C(C)C)CC2)cc1 ZINC000540056598 1039410480 /nfs/dbraw/zinc/41/04/80/1039410480.db2.gz WJSFQRKBMSXUMY-UHFFFAOYSA-N 1 2 309.457 4.316 20 0 DIADLO CCc1ccc(C2=CC[N@@H+](Cc3nccn3C(C)C)CC2)cc1 ZINC000540056598 1039410487 /nfs/dbraw/zinc/41/04/87/1039410487.db2.gz WJSFQRKBMSXUMY-UHFFFAOYSA-N 1 2 309.457 4.316 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1cc(C)oc1C)c1nnc2n1CCCCC2 ZINC000278399251 1039441362 /nfs/dbraw/zinc/44/13/62/1039441362.db2.gz FLKGJXMUWRWQDL-XJKSGUPXSA-N 1 2 316.449 4.016 20 0 DIADLO Cc1noc(C)c1C[N@H+](Cc1ccccn1)Cc1ccccc1C ZINC000566682053 1039451991 /nfs/dbraw/zinc/45/19/91/1039451991.db2.gz NPCIWHMDYIUIJA-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1noc(C)c1C[N@@H+](Cc1ccccn1)Cc1ccccc1C ZINC000566682053 1039451995 /nfs/dbraw/zinc/45/19/95/1039451995.db2.gz NPCIWHMDYIUIJA-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Brc1csc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)n1 ZINC001137780992 1039452712 /nfs/dbraw/zinc/45/27/12/1039452712.db2.gz QDNQLPBSKYGCAH-GHMZBOCLSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1csc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)n1 ZINC001137780992 1039452716 /nfs/dbraw/zinc/45/27/16/1039452716.db2.gz QDNQLPBSKYGCAH-GHMZBOCLSA-N 1 2 315.280 4.060 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+]Cc2nnc(-c3ccc(F)cc3)[nH]2)cc1 ZINC000540219701 1039458732 /nfs/dbraw/zinc/45/87/32/1039458732.db2.gz HVCXEVGFTKZEMY-CYBMUJFWSA-N 1 2 324.403 4.024 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+]Cc2nc(-c3ccc(F)cc3)n[nH]2)cc1 ZINC000540219701 1039458747 /nfs/dbraw/zinc/45/87/47/1039458747.db2.gz HVCXEVGFTKZEMY-CYBMUJFWSA-N 1 2 324.403 4.024 20 0 DIADLO CC(C)Sc1cccc(Cl)c1C[NH2+][C@@H](C)c1nccn1C ZINC000657794793 1039463195 /nfs/dbraw/zinc/46/31/95/1039463195.db2.gz WPLWBALYQYLAIQ-LBPRGKRZSA-N 1 2 323.893 4.425 20 0 DIADLO CCCc1nc(C[N@@H+]2CCC[C@@H]2c2ccc(COC)o2)cs1 ZINC000131045735 1039482315 /nfs/dbraw/zinc/48/23/15/1039482315.db2.gz DTFITIDRLOUEDE-OAHLLOKOSA-N 1 2 320.458 4.172 20 0 DIADLO CCCc1nc(C[N@H+]2CCC[C@@H]2c2ccc(COC)o2)cs1 ZINC000131045735 1039482324 /nfs/dbraw/zinc/48/23/24/1039482324.db2.gz DTFITIDRLOUEDE-OAHLLOKOSA-N 1 2 320.458 4.172 20 0 DIADLO O=C(C/C=C/c1ccc(F)cc1)Nc1ccccc1-n1cc[nH+]c1 ZINC000080541899 1039486401 /nfs/dbraw/zinc/48/64/01/1039486401.db2.gz RXVQMGLYUVIFDK-ONEGZZNKSA-N 1 2 321.355 4.053 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](COC)c2ccc(F)cc2)cs1 ZINC000540475885 1039502112 /nfs/dbraw/zinc/50/21/12/1039502112.db2.gz UDSFLMGUINXDIR-MRXNPFEDSA-N 1 2 322.449 4.102 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@H](C)c2ccc(C(F)(F)F)cc2)[nH]c1C ZINC000628138755 1039502833 /nfs/dbraw/zinc/50/28/33/1039502833.db2.gz OACAUOQKOYUGDC-GFCCVEGCSA-N 1 2 311.351 4.238 20 0 DIADLO Cc1nc(C[N@H+](C)[C@H](C)c2ccc(C(F)(F)F)cc2)[nH]c1C ZINC000628138755 1039502839 /nfs/dbraw/zinc/50/28/39/1039502839.db2.gz OACAUOQKOYUGDC-GFCCVEGCSA-N 1 2 311.351 4.238 20 0 DIADLO Cc1[nH]c(CN(C)[C@H](C)c2ccc(C(F)(F)F)cc2)[nH+]c1C ZINC000628138755 1039502853 /nfs/dbraw/zinc/50/28/53/1039502853.db2.gz OACAUOQKOYUGDC-GFCCVEGCSA-N 1 2 311.351 4.238 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)s1 ZINC000562199442 1039505563 /nfs/dbraw/zinc/50/55/63/1039505563.db2.gz HJWIDHFRCXQNTD-OAHLLOKOSA-N 1 2 305.468 4.044 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)s1 ZINC000562199442 1039505567 /nfs/dbraw/zinc/50/55/67/1039505567.db2.gz HJWIDHFRCXQNTD-OAHLLOKOSA-N 1 2 305.468 4.044 20 0 DIADLO c1[nH]c(-c2ccccc2)nc1C[NH2+][C@@H]1CSc2ccccc21 ZINC000540599341 1039523634 /nfs/dbraw/zinc/52/36/34/1039523634.db2.gz ASUBGOZZQLUBAV-MRXNPFEDSA-N 1 2 307.422 4.013 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1ncc(C(F)(F)F)s1 ZINC000278564674 1039549605 /nfs/dbraw/zinc/54/96/05/1039549605.db2.gz CXBOVLFXHRHGGR-VIFPVBQESA-N 1 2 316.348 4.021 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccc2c(c1)COC2 ZINC000540727030 1039555825 /nfs/dbraw/zinc/55/58/25/1039555825.db2.gz CJRWOPSOVQCRSX-HNNXBMFYSA-N 1 2 323.440 4.275 20 0 DIADLO CC[N@H+](C)[C@H](c1nc(C2CCC(C)CC2)no1)c1ccccc1 ZINC000685263477 1039591030 /nfs/dbraw/zinc/59/10/30/1039591030.db2.gz JPPWQOCEINBKAP-PREGVCBESA-N 1 2 313.445 4.404 20 0 DIADLO CC[N@@H+](C)[C@H](c1nc(C2CCC(C)CC2)no1)c1ccccc1 ZINC000685263477 1039591038 /nfs/dbraw/zinc/59/10/38/1039591038.db2.gz JPPWQOCEINBKAP-PREGVCBESA-N 1 2 313.445 4.404 20 0 DIADLO FC(F)(F)C[C@H]1CC[N@H+](Cc2nc(Cl)ccc2Cl)C1 ZINC000278659451 1039628288 /nfs/dbraw/zinc/62/82/88/1039628288.db2.gz HSRVLIJTOCPDKG-MRVPVSSYSA-N 1 2 313.150 4.163 20 0 DIADLO FC(F)(F)C[C@H]1CC[N@@H+](Cc2nc(Cl)ccc2Cl)C1 ZINC000278659451 1039628293 /nfs/dbraw/zinc/62/82/93/1039628293.db2.gz HSRVLIJTOCPDKG-MRVPVSSYSA-N 1 2 313.150 4.163 20 0 DIADLO CCc1cnccc1[C@@H](C)[NH2+][C@H](C)c1nc(-c2ccccc2)no1 ZINC000541195459 1039636693 /nfs/dbraw/zinc/63/66/93/1039636693.db2.gz VWYJYPAXMZZJNH-ZIAGYGMSSA-N 1 2 322.412 4.106 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ncc(Br)s1)c1ccsc1 ZINC000381318340 1039672395 /nfs/dbraw/zinc/67/23/95/1039672395.db2.gz NWIXNYSAAKSINO-YUMQZZPRSA-N 1 2 317.277 4.379 20 0 DIADLO CCCn1nc(C)c(C[N@H+](Cc2ccccc2F)C2CC2)c1C ZINC000350035838 1039677432 /nfs/dbraw/zinc/67/74/32/1039677432.db2.gz OXFFUERBMMAPJW-UHFFFAOYSA-N 1 2 315.436 4.214 20 0 DIADLO CCCn1nc(C)c(C[N@@H+](Cc2ccccc2F)C2CC2)c1C ZINC000350035838 1039677441 /nfs/dbraw/zinc/67/74/41/1039677441.db2.gz OXFFUERBMMAPJW-UHFFFAOYSA-N 1 2 315.436 4.214 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@@H]2CCSc3c(F)cccc32)[nH+]1 ZINC000080945586 1039691378 /nfs/dbraw/zinc/69/13/78/1039691378.db2.gz AICYTXYAWBEFNC-CYBMUJFWSA-N 1 2 314.389 4.054 20 0 DIADLO CCOC(=O)c1ccc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)[nH]1 ZINC001140689523 1039701036 /nfs/dbraw/zinc/70/10/36/1039701036.db2.gz CLWWEROJTLSTID-LBPRGKRZSA-N 1 2 320.820 4.038 20 0 DIADLO CCOC(=O)c1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)[nH]1 ZINC001140689523 1039701051 /nfs/dbraw/zinc/70/10/51/1039701051.db2.gz CLWWEROJTLSTID-LBPRGKRZSA-N 1 2 320.820 4.038 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(-c2ccoc2)no1)c1ccc(Cl)s1 ZINC000541629704 1039718743 /nfs/dbraw/zinc/71/87/43/1039718743.db2.gz JXZYEHYBGXIYPY-JTQLQIEISA-N 1 2 323.805 4.285 20 0 DIADLO CCCOc1ccc([C@H](C)[NH2+]Cc2ccon2)cc1OCCC ZINC000172647546 1039722807 /nfs/dbraw/zinc/72/28/07/1039722807.db2.gz GBABEFJQPVCISN-AWEZNQCLSA-N 1 2 318.417 4.103 20 0 DIADLO CC(C)CCc1nc(C[NH2+][C@H](C)c2cnn(C(C)C)c2)cs1 ZINC000541645081 1039724055 /nfs/dbraw/zinc/72/40/55/1039724055.db2.gz AMDSLKTXOFQCMP-CQSZACIVSA-N 1 2 320.506 4.360 20 0 DIADLO C[N@H+](Cc1nnc(C2CC2)o1)C1c2ccccc2-c2ccccc21 ZINC000081596999 1039724139 /nfs/dbraw/zinc/72/41/39/1039724139.db2.gz CCEWPSYCBRPCJJ-UHFFFAOYSA-N 1 2 317.392 4.149 20 0 DIADLO C[N@@H+](Cc1nnc(C2CC2)o1)C1c2ccccc2-c2ccccc21 ZINC000081596999 1039724159 /nfs/dbraw/zinc/72/41/59/1039724159.db2.gz CCEWPSYCBRPCJJ-UHFFFAOYSA-N 1 2 317.392 4.149 20 0 DIADLO CCC[C@H]1CCCC[N@@H+]1Cc1ncc(Br)s1 ZINC000541780028 1039743794 /nfs/dbraw/zinc/74/37/94/1039743794.db2.gz WWIIBNVJQGATHV-JTQLQIEISA-N 1 2 303.269 4.060 20 0 DIADLO CCC[C@H]1CCCC[N@H+]1Cc1ncc(Br)s1 ZINC000541780028 1039743810 /nfs/dbraw/zinc/74/38/10/1039743810.db2.gz WWIIBNVJQGATHV-JTQLQIEISA-N 1 2 303.269 4.060 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@@H](C)c2cnn(C(C)C)c2)cs1 ZINC000090049913 1039788948 /nfs/dbraw/zinc/78/89/48/1039788948.db2.gz TZXFBQCZDWVPTH-STQMWFEESA-N 1 2 306.479 4.456 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2cnccn2)cc(C(F)(F)F)c1 ZINC001143455664 1039792988 /nfs/dbraw/zinc/79/29/88/1039792988.db2.gz VVZNGWHOLJJAAW-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2cnccn2)cc(C(F)(F)F)c1 ZINC001143455664 1039793011 /nfs/dbraw/zinc/79/30/11/1039793011.db2.gz VVZNGWHOLJJAAW-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cccc2nc(C[NH2+][C@H](C)c3cc4ccccc4o3)[nH]c21 ZINC000090947837 1039806920 /nfs/dbraw/zinc/80/69/20/1039806920.db2.gz NQKPTCMBNKSDNH-CYBMUJFWSA-N 1 2 305.381 4.468 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ncccc1F ZINC000090721408 1039816911 /nfs/dbraw/zinc/81/69/11/1039816911.db2.gz RUILGQLHBUKSHT-NSHDSACASA-N 1 2 308.784 4.124 20 0 DIADLO C[C@H]([NH2+]Cc1ccc2c(c1)CCCC2)c1nc(C(C)(C)C)no1 ZINC000491401005 1039844200 /nfs/dbraw/zinc/84/42/00/1039844200.db2.gz NJKYVABNDZAURI-ZDUSSCGKSA-N 1 2 313.445 4.097 20 0 DIADLO O=C(Nc1csc2ccccc12)[C@H]1CC[N@@H+]1Cc1ccccc1 ZINC000491458083 1039850633 /nfs/dbraw/zinc/85/06/33/1039850633.db2.gz QZBVJKZUIYEKIZ-QGZVFWFLSA-N 1 2 322.433 4.114 20 0 DIADLO O=C(Nc1csc2ccccc12)[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000491458083 1039850650 /nfs/dbraw/zinc/85/06/50/1039850650.db2.gz QZBVJKZUIYEKIZ-QGZVFWFLSA-N 1 2 322.433 4.114 20 0 DIADLO COC(=O)c1ccc([C@H](C)[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000091589375 1039855185 /nfs/dbraw/zinc/85/51/85/1039855185.db2.gz RCZDFRMVIWGRFJ-SMDDNHRTSA-N 1 2 319.788 4.228 20 0 DIADLO COC(=O)c1ccc([C@H](C)[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000091589375 1039855211 /nfs/dbraw/zinc/85/52/11/1039855211.db2.gz RCZDFRMVIWGRFJ-SMDDNHRTSA-N 1 2 319.788 4.228 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000091986403 1039866168 /nfs/dbraw/zinc/86/61/68/1039866168.db2.gz UVGHRRUFTPZUGH-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)[C@@H](C)c1ccncc1 ZINC000091986403 1039866192 /nfs/dbraw/zinc/86/61/92/1039866192.db2.gz UVGHRRUFTPZUGH-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1cc(-c2noc(C[NH2+][C@@H](C)c3ccsc3)n2)ccc1F ZINC000669937174 1039870538 /nfs/dbraw/zinc/87/05/38/1039870538.db2.gz QAAGKARFMMJAOL-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccc(F)cn1 ZINC000092720086 1039877716 /nfs/dbraw/zinc/87/77/16/1039877716.db2.gz LGGNYWOLMXGRKW-IFXJQAMLSA-N 1 2 307.372 4.056 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@H]2CCCc3ccccc32)c(C)[nH+]1 ZINC000170988441 1039893112 /nfs/dbraw/zinc/89/31/12/1039893112.db2.gz YIQPMTFBEGSTHO-QGZVFWFLSA-N 1 2 308.425 4.456 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(-c2cccc(Cl)c2)o1)c1ccsc1 ZINC000669940161 1039894380 /nfs/dbraw/zinc/89/43/80/1039894380.db2.gz ZPFSOVJSQCFVPB-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc2c(c1)CCC=C2 ZINC000491922100 1039894529 /nfs/dbraw/zinc/89/45/29/1039894529.db2.gz XARIBULRZVKXOS-UHFFFAOYSA-N 1 2 315.376 4.288 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(-c2cccc(Cl)c2)o1)c1ccsc1 ZINC000669940162 1039895338 /nfs/dbraw/zinc/89/53/38/1039895338.db2.gz ZPFSOVJSQCFVPB-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO FC(F)(F)c1cccnc1C[N@@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000669942755 1039903431 /nfs/dbraw/zinc/90/34/31/1039903431.db2.gz UWEYPGWIDWNFAQ-INIZCTEOSA-N 1 2 324.321 4.171 20 0 DIADLO FC(F)(F)c1cccnc1C[N@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000669942755 1039903445 /nfs/dbraw/zinc/90/34/45/1039903445.db2.gz UWEYPGWIDWNFAQ-INIZCTEOSA-N 1 2 324.321 4.171 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cc3cc(F)ccc3o2)s1 ZINC000093807480 1039905970 /nfs/dbraw/zinc/90/59/70/1039905970.db2.gz UQZLBEXNSBWNME-UHFFFAOYSA-N 1 2 304.390 4.223 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cc3cc(F)ccc3o2)s1 ZINC000093807480 1039905990 /nfs/dbraw/zinc/90/59/90/1039905990.db2.gz UQZLBEXNSBWNME-UHFFFAOYSA-N 1 2 304.390 4.223 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@@H](C)C(C)(C)C)no1)c1ccccc1 ZINC000685315087 1039913878 /nfs/dbraw/zinc/91/38/78/1039913878.db2.gz IVOWRLOXMVLXRJ-UKRRQHHQSA-N 1 2 301.434 4.260 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@@H](C)C(C)(C)C)no1)c1ccccc1 ZINC000685315087 1039913890 /nfs/dbraw/zinc/91/38/90/1039913890.db2.gz IVOWRLOXMVLXRJ-UKRRQHHQSA-N 1 2 301.434 4.260 20 0 DIADLO CC(C)([NH2+]Cc1coc2ccccc12)c1cc(C(F)(F)F)on1 ZINC000492193162 1039934868 /nfs/dbraw/zinc/93/48/68/1039934868.db2.gz MYBOSRNABNTBOH-UHFFFAOYSA-N 1 2 324.302 4.465 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2ccc(C(F)F)nc2)o1 ZINC000657886161 1039999182 /nfs/dbraw/zinc/99/91/82/1039999182.db2.gz CNJGTUOOOWGOLL-NHYWBVRUSA-N 1 2 324.371 4.213 20 0 DIADLO C[N@H+](Cc1ncc(-c2cccc(F)c2)o1)Cc1ccc(F)cc1 ZINC000175033187 1040004322 /nfs/dbraw/zinc/00/43/22/1040004322.db2.gz CBHFAASCNYEAHP-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1ncc(-c2cccc(F)c2)o1)Cc1ccc(F)cc1 ZINC000175033187 1040004336 /nfs/dbraw/zinc/00/43/36/1040004336.db2.gz CBHFAASCNYEAHP-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)Cc1nccs1 ZINC000175076194 1040006144 /nfs/dbraw/zinc/00/61/44/1040006144.db2.gz GMEHAFCHWNEDHX-JTQLQIEISA-N 1 2 300.349 4.355 20 0 DIADLO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)Cc1nccs1 ZINC000175076194 1040006161 /nfs/dbraw/zinc/00/61/61/1040006161.db2.gz GMEHAFCHWNEDHX-JTQLQIEISA-N 1 2 300.349 4.355 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)Cc1noc(C2CC2)n1 ZINC000175439022 1040034758 /nfs/dbraw/zinc/03/47/58/1040034758.db2.gz RDXOAEHBCWPKAZ-RYUDHWBXSA-N 1 2 319.836 4.224 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000175439022 1040034779 /nfs/dbraw/zinc/03/47/79/1040034779.db2.gz RDXOAEHBCWPKAZ-RYUDHWBXSA-N 1 2 319.836 4.224 20 0 DIADLO COc1cccc([C@@H]2C[N@H+](Cc3ccc4occc4c3)CCO2)c1 ZINC000685416082 1040037830 /nfs/dbraw/zinc/03/78/30/1040037830.db2.gz CSIZOLUGWMQPNN-FQEVSTJZSA-N 1 2 323.392 4.015 20 0 DIADLO COc1cccc([C@@H]2C[N@@H+](Cc3ccc4occc4c3)CCO2)c1 ZINC000685416082 1040037848 /nfs/dbraw/zinc/03/78/48/1040037848.db2.gz CSIZOLUGWMQPNN-FQEVSTJZSA-N 1 2 323.392 4.015 20 0 DIADLO CC(C)C[C@@H](C)C[C@H](C)Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000685447454 1040057422 /nfs/dbraw/zinc/05/74/22/1040057422.db2.gz WXPYWVCIMONZQN-CVEARBPZSA-N 1 2 300.450 4.199 20 0 DIADLO FC(F)c1ccc(C[NH2+]Cc2ncc(C(F)(F)F)s2)cc1 ZINC000278780640 1040088417 /nfs/dbraw/zinc/08/84/17/1040088417.db2.gz ZDTMAACODKQYFP-UHFFFAOYSA-N 1 2 322.302 4.389 20 0 DIADLO Fc1cc(C[N@H+]2CC[C@H](F)C(F)(F)CC2)c(F)cc1Cl ZINC001140699414 1040103727 /nfs/dbraw/zinc/10/37/27/1040103727.db2.gz ORCKDDKPSXBPAJ-LBPRGKRZSA-N 1 2 313.697 4.187 20 0 DIADLO Fc1cc(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c(F)cc1Cl ZINC001140699414 1040103731 /nfs/dbraw/zinc/10/37/31/1040103731.db2.gz ORCKDDKPSXBPAJ-LBPRGKRZSA-N 1 2 313.697 4.187 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1ccccc1Br ZINC000171944442 1040104344 /nfs/dbraw/zinc/10/43/44/1040104344.db2.gz YKWZRAXVQZBJJY-GFCCVEGCSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccccc1Br ZINC000171944442 1040104350 /nfs/dbraw/zinc/10/43/50/1040104350.db2.gz YKWZRAXVQZBJJY-GFCCVEGCSA-N 1 2 305.219 4.037 20 0 DIADLO CCC[C@H]([NH2+][C@H]1COCc2ccccc21)c1ncccc1Cl ZINC000926600910 1040114513 /nfs/dbraw/zinc/11/45/13/1040114513.db2.gz MFNBMOVJLTZEDV-IRXDYDNUSA-N 1 2 316.832 4.437 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@H](c3cccs3)C2)cc1 ZINC000177756361 1040136986 /nfs/dbraw/zinc/13/69/86/1040136986.db2.gz WZDUPBOOKZJSKH-HNNXBMFYSA-N 1 2 305.468 4.044 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@H](c3cccs3)C2)cc1 ZINC000177756361 1040136995 /nfs/dbraw/zinc/13/69/95/1040136995.db2.gz WZDUPBOOKZJSKH-HNNXBMFYSA-N 1 2 305.468 4.044 20 0 DIADLO Cc1ccc2[nH+]c(CSc3ncc(C(C)(C)C)o3)cn2c1 ZINC000177812494 1040142771 /nfs/dbraw/zinc/14/27/71/1040142771.db2.gz GXMHXVSPVZICJW-UHFFFAOYSA-N 1 2 301.415 4.221 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@H](C)c3ccc(F)cc3Cl)cn2c1 ZINC000178725778 1040150630 /nfs/dbraw/zinc/15/06/30/1040150630.db2.gz YEKWXRAZIPTELG-GFCCVEGCSA-N 1 2 317.795 4.286 20 0 DIADLO C/C(=C\c1ccccc1OC(F)F)C[NH2+]C(C)(C)C(F)F ZINC000685621579 1040160060 /nfs/dbraw/zinc/16/00/60/1040160060.db2.gz FTOOPDXBENEQCW-CSKARUKUSA-N 1 2 305.315 4.325 20 0 DIADLO C/C(=C\c1ccccc1OC(F)F)C[NH2+][C@H]1CCCC1(F)F ZINC000685623521 1040166630 /nfs/dbraw/zinc/16/66/30/1040166630.db2.gz MSDZZEJRIAFEBP-MARXPDLDSA-N 1 2 317.326 4.469 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccnc(Oc3ccccc3)c2)no1 ZINC000685644696 1040177970 /nfs/dbraw/zinc/17/79/70/1040177970.db2.gz UWOYQJPTLLTULD-CQSZACIVSA-N 1 2 309.369 4.021 20 0 DIADLO Cc1noc([C@@H](C)[N@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)n1 ZINC000080916436 1040190212 /nfs/dbraw/zinc/19/02/12/1040190212.db2.gz LUOGMTRFDVADNN-CYBMUJFWSA-N 1 2 322.412 4.018 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)n1 ZINC000080916436 1040190222 /nfs/dbraw/zinc/19/02/22/1040190222.db2.gz LUOGMTRFDVADNN-CYBMUJFWSA-N 1 2 322.412 4.018 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccccc1Cl)c1cn2c(n1)CCCC2 ZINC000924524186 1040198809 /nfs/dbraw/zinc/19/88/09/1040198809.db2.gz JQOHNSAELLZWPM-CHWSQXEVSA-N 1 2 303.837 4.285 20 0 DIADLO c1[nH+]c(-c2cccc(N[C@@H]3COC4(CCC4)C3)c2)n2c1CCCC2 ZINC000657994999 1040255683 /nfs/dbraw/zinc/25/56/83/1040255683.db2.gz XRBNIMBTNBGERF-KRWDZBQOSA-N 1 2 323.440 4.010 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H](c2cccc(F)c2)C(C)(C)C)nn1C ZINC000421329294 1040256653 /nfs/dbraw/zinc/25/66/53/1040256653.db2.gz VDJWEQSIGCJZIW-MRXNPFEDSA-N 1 2 323.843 4.398 20 0 DIADLO O=C(c1cccc(C2CCCC2)c1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000612063551 1040323603 /nfs/dbraw/zinc/32/36/03/1040323603.db2.gz KMZFWSAQINVTOC-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO O=C(c1cccc(C2CCCC2)c1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000612063551 1040323619 /nfs/dbraw/zinc/32/36/19/1040323619.db2.gz KMZFWSAQINVTOC-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO Cc1cc(C)c(NC(=O)C2CC(c3ccc(F)cc3)C2)c(C)[nH+]1 ZINC000658229533 1040368058 /nfs/dbraw/zinc/36/80/58/1040368058.db2.gz NFRBJGFWYNBJFQ-UHFFFAOYSA-N 1 2 312.388 4.278 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]CC(F)(F)C(C)(C)C)cc1OC ZINC000658337071 1040428332 /nfs/dbraw/zinc/42/83/32/1040428332.db2.gz LBUOCDPKKDDBPM-LLVKDONJSA-N 1 2 301.377 4.036 20 0 DIADLO O=C(/C=C\Sc1ccccc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000255771583 1040477604 /nfs/dbraw/zinc/47/76/04/1040477604.db2.gz LMEOKPFQIQUODU-XFXZXTDPSA-N 1 2 321.405 4.117 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCCC[C@H]2c2ccccc2)[nH]n1 ZINC000442847845 1040520090 /nfs/dbraw/zinc/52/00/90/1040520090.db2.gz DNNOXIJFLAWFPE-AWEZNQCLSA-N 1 2 309.335 4.156 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCCC[C@H]2c2ccccc2)[nH]n1 ZINC000442847845 1040520108 /nfs/dbraw/zinc/52/01/08/1040520108.db2.gz DNNOXIJFLAWFPE-AWEZNQCLSA-N 1 2 309.335 4.156 20 0 DIADLO Cc1nc(C)c(C[N@H+](Cc2cccnc2)Cc2ccccc2C)o1 ZINC000628278597 1040640643 /nfs/dbraw/zinc/64/06/43/1040640643.db2.gz XYWZMUHDFFUMBX-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1nc(C)c(C[N@@H+](Cc2cccnc2)Cc2ccccc2C)o1 ZINC000628278597 1040640652 /nfs/dbraw/zinc/64/06/52/1040640652.db2.gz XYWZMUHDFFUMBX-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1c[nH]nc1C[N@@H+]1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000685843803 1040785946 /nfs/dbraw/zinc/78/59/46/1040785946.db2.gz AFLXKAMDXFUGRS-MRXNPFEDSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1c[nH]nc1C[N@H+]1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000685843803 1040785961 /nfs/dbraw/zinc/78/59/61/1040785961.db2.gz AFLXKAMDXFUGRS-MRXNPFEDSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1ccc(-c2noc([C@@H](CC(C)C)n3cc[nH+]c3)n2)cc1F ZINC000923783692 1040806129 /nfs/dbraw/zinc/80/61/29/1040806129.db2.gz JGVCWRRBPBRFLL-OAHLLOKOSA-N 1 2 314.364 4.016 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2ccn(C)n2)c(OCCC(C)C)c1 ZINC000414113732 1040881939 /nfs/dbraw/zinc/88/19/39/1040881939.db2.gz OHPFXDAPDBHVAQ-INIZCTEOSA-N 1 2 315.461 4.004 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+][C@H](C)c1nc2c(s1)CCC2 ZINC000414137243 1040913120 /nfs/dbraw/zinc/91/31/20/1040913120.db2.gz DXBYYZJASZEJHS-NWDGAFQWSA-N 1 2 301.459 4.001 20 0 DIADLO c1cc(N2CCCC2)ccc1[NH2+][C@H]1CCCC12CCOCC2 ZINC000282454823 1040931563 /nfs/dbraw/zinc/93/15/63/1040931563.db2.gz FPEOWGVNSCDGHW-SFHVURJKSA-N 1 2 300.446 4.048 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@H]1CCCC12CCOCC2 ZINC000282454823 1040931585 /nfs/dbraw/zinc/93/15/85/1040931585.db2.gz FPEOWGVNSCDGHW-SFHVURJKSA-N 1 2 300.446 4.048 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)c1nc2c(s1)CCC2 ZINC000414155347 1040932475 /nfs/dbraw/zinc/93/24/75/1040932475.db2.gz NDLUXCAPUCUNPF-UWVGGRQHSA-N 1 2 307.850 4.092 20 0 DIADLO C[N@H+](CCCCc1ccccc1)Cc1noc(-c2ccccc2)n1 ZINC000613456420 1040963698 /nfs/dbraw/zinc/96/36/98/1040963698.db2.gz BKAUXPGDXBKZRO-UHFFFAOYSA-N 1 2 321.424 4.191 20 0 DIADLO C[N@@H+](CCCCc1ccccc1)Cc1noc(-c2ccccc2)n1 ZINC000613456420 1040963721 /nfs/dbraw/zinc/96/37/21/1040963721.db2.gz BKAUXPGDXBKZRO-UHFFFAOYSA-N 1 2 321.424 4.191 20 0 DIADLO O[C@H](c1ccccc1)[C@@H]([NH2+]C/C(Cl)=C\Cl)c1ccccc1 ZINC000808789401 1041028296 /nfs/dbraw/zinc/02/82/96/1041028296.db2.gz PORJMFTZQJDUNA-OSGGRZCESA-N 1 2 322.235 4.370 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@H](O)c2ccccc2)o1 ZINC000808787440 1041029044 /nfs/dbraw/zinc/02/90/44/1041029044.db2.gz GUSNATFHGLKOEB-ZYSHUDEJSA-N 1 2 322.408 4.109 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC001625885057 1041073343 /nfs/dbraw/zinc/07/33/43/1041073343.db2.gz YTHIRJFRTDCWFJ-RBUKOAKNSA-N 1 2 316.404 4.016 20 0 DIADLO CSc1ccc(C)c(C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000175557663 1041075504 /nfs/dbraw/zinc/07/55/04/1041075504.db2.gz FJERGZJKLUSPBJ-UHFFFAOYSA-N 1 2 300.427 4.289 20 0 DIADLO Fc1ccc([C@@H]([NH2+][C@@H]2CCCC[C@H]2F)c2cccnc2)c(F)c1 ZINC000414289128 1041083313 /nfs/dbraw/zinc/08/33/13/1041083313.db2.gz RBVCCYYZDGXKDA-NXHRZFHOSA-N 1 2 320.358 4.320 20 0 DIADLO Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]Cc1nnc(C2CC2)s1 ZINC000892607869 1041108521 /nfs/dbraw/zinc/10/85/21/1041108521.db2.gz MYJSLQCEWXYCCH-CYBMUJFWSA-N 1 2 317.458 4.120 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@@H](F)C2)c(C(F)(F)F)c1 ZINC001143473898 1041173404 /nfs/dbraw/zinc/17/34/04/1041173404.db2.gz SCJSPDBZAKHGJW-GFCCVEGCSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@@H](F)C2)c(C(F)(F)F)c1 ZINC001143473898 1041173417 /nfs/dbraw/zinc/17/34/17/1041173417.db2.gz SCJSPDBZAKHGJW-GFCCVEGCSA-N 1 2 305.315 4.038 20 0 DIADLO Cc1ccc(C[NH+](Cc2cccs2)Cc2cccs2)nn1 ZINC000414366835 1041181907 /nfs/dbraw/zinc/18/19/07/1041181907.db2.gz CJJDWXUTQQWZCJ-UHFFFAOYSA-N 1 2 315.467 4.110 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)nn1 ZINC000414371290 1041184829 /nfs/dbraw/zinc/18/48/29/1041184829.db2.gz NADWICDMWLFONC-LLVKDONJSA-N 1 2 310.228 4.285 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)nn1 ZINC000414371290 1041184831 /nfs/dbraw/zinc/18/48/31/1041184831.db2.gz NADWICDMWLFONC-LLVKDONJSA-N 1 2 310.228 4.285 20 0 DIADLO OC1CCN(c2ccc([NH2+]CCCC3CCCCC3)cc2)CC1 ZINC000809596509 1041199066 /nfs/dbraw/zinc/19/90/66/1041199066.db2.gz GVRKJXQSGIRDEV-UHFFFAOYSA-N 1 2 316.489 4.420 20 0 DIADLO OC1CC[NH+](c2ccc(NCCCC3CCCCC3)cc2)CC1 ZINC000809596509 1041199074 /nfs/dbraw/zinc/19/90/74/1041199074.db2.gz GVRKJXQSGIRDEV-UHFFFAOYSA-N 1 2 316.489 4.420 20 0 DIADLO Fc1cccc(C=C2CC[NH+](Cc3ccc(F)nc3)CC2)c1 ZINC000809736298 1041232351 /nfs/dbraw/zinc/23/23/51/1041232351.db2.gz OAKCEARVEVMKQT-UHFFFAOYSA-N 1 2 300.352 4.039 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1occc1Br ZINC000809764228 1041251199 /nfs/dbraw/zinc/25/11/99/1041251199.db2.gz CPAUNXVMZZMJMH-ZDUSSCGKSA-N 1 2 309.207 4.020 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1occc1Br ZINC000809764228 1041251215 /nfs/dbraw/zinc/25/12/15/1041251215.db2.gz CPAUNXVMZZMJMH-ZDUSSCGKSA-N 1 2 309.207 4.020 20 0 DIADLO c1cc2c(ccnc2NCc2cc[nH+]c(N3CCCCC3)c2)s1 ZINC000613544063 1041264892 /nfs/dbraw/zinc/26/48/92/1041264892.db2.gz UFMDOPMNVUVIQX-UHFFFAOYSA-N 1 2 324.453 4.294 20 0 DIADLO C[C@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1ccnn1C1CCC1 ZINC000926807041 1041300707 /nfs/dbraw/zinc/30/07/07/1041300707.db2.gz AOGBELCGPMWDIZ-LRDDRELGSA-N 1 2 305.372 4.109 20 0 DIADLO C[C@@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1ccnn1C1CCC1 ZINC000926807042 1041300751 /nfs/dbraw/zinc/30/07/51/1041300751.db2.gz AOGBELCGPMWDIZ-MLGOLLRUSA-N 1 2 305.372 4.109 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@@H+]2CCC(F)(F)[C@H](C)C2)cc1 ZINC000810044519 1041301443 /nfs/dbraw/zinc/30/14/43/1041301443.db2.gz CALOQXISVZTISG-ZIAGYGMSSA-N 1 2 324.415 4.116 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@H+]2CCC(F)(F)[C@H](C)C2)cc1 ZINC000810044519 1041301452 /nfs/dbraw/zinc/30/14/52/1041301452.db2.gz CALOQXISVZTISG-ZIAGYGMSSA-N 1 2 324.415 4.116 20 0 DIADLO CCc1nn(C)c(Cl)c1C[N@H+](C)C/C(C)=C\c1ccccc1 ZINC000756121556 1041361079 /nfs/dbraw/zinc/36/10/79/1041361079.db2.gz LYMBAEMOSXCYQR-KAMYIIQDSA-N 1 2 317.864 4.171 20 0 DIADLO CCc1nn(C)c(Cl)c1C[N@@H+](C)C/C(C)=C\c1ccccc1 ZINC000756121556 1041361087 /nfs/dbraw/zinc/36/10/87/1041361087.db2.gz LYMBAEMOSXCYQR-KAMYIIQDSA-N 1 2 317.864 4.171 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2cc(C3CC3)no2)C2CC2)o1 ZINC000659814945 1041376737 /nfs/dbraw/zinc/37/67/37/1041376737.db2.gz WOCZSDCEHITIEE-YVEFUNNKSA-N 1 2 312.413 4.433 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cc(C3CC3)no2)C2CC2)o1 ZINC000659814945 1041376741 /nfs/dbraw/zinc/37/67/41/1041376741.db2.gz WOCZSDCEHITIEE-YVEFUNNKSA-N 1 2 312.413 4.433 20 0 DIADLO C[C@@H]([NH2+]CCN1C[C@H](C)C[C@@H](C)C1)c1ccc(F)cc1Cl ZINC001170603804 1041378279 /nfs/dbraw/zinc/37/82/79/1041378279.db2.gz DUNNUJDVOWJQFU-MGPQQGTHSA-N 1 2 312.860 4.108 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2nc3ccccc3[nH]2)C(C)C)sc1C ZINC000892722029 1041384761 /nfs/dbraw/zinc/38/47/61/1041384761.db2.gz WCWNAGILNMIBLH-MRXNPFEDSA-N 1 2 314.458 4.123 20 0 DIADLO C[C@H]([NH2+]Cc1nccn1C1CC1)c1cc(Cl)ccc1Cl ZINC000892734497 1041391030 /nfs/dbraw/zinc/39/10/30/1041391030.db2.gz ZWBJCAQNXRJJDK-JTQLQIEISA-N 1 2 310.228 4.376 20 0 DIADLO CCN(CC)c1ccc(N[C@@H](C)c2sc(C)nc2C)c[nH+]1 ZINC000111360728 1041404498 /nfs/dbraw/zinc/40/44/98/1041404498.db2.gz ZAAHRJIBCCYGPB-LBPRGKRZSA-N 1 2 304.463 4.174 20 0 DIADLO C[C@H](C(=O)Nc1ccc(C(C)(C)C)cc1)[N@H+](C)Cc1ccco1 ZINC000023992930 1041420508 /nfs/dbraw/zinc/42/05/08/1041420508.db2.gz UTRKFLYSFGJSMY-CQSZACIVSA-N 1 2 314.429 4.036 20 0 DIADLO C[C@H](C(=O)Nc1ccc(C(C)(C)C)cc1)[N@@H+](C)Cc1ccco1 ZINC000023992930 1041420516 /nfs/dbraw/zinc/42/05/16/1041420516.db2.gz UTRKFLYSFGJSMY-CQSZACIVSA-N 1 2 314.429 4.036 20 0 DIADLO Fc1ccc([C@@H]2CC[N@@H+]2Cc2ccc(C(F)(F)F)cn2)cc1 ZINC000661513659 1041430767 /nfs/dbraw/zinc/43/07/67/1041430767.db2.gz NRSNRAUHRPNKHT-HNNXBMFYSA-N 1 2 310.294 4.187 20 0 DIADLO Fc1ccc([C@@H]2CC[N@H+]2Cc2ccc(C(F)(F)F)cn2)cc1 ZINC000661513659 1041430770 /nfs/dbraw/zinc/43/07/70/1041430770.db2.gz NRSNRAUHRPNKHT-HNNXBMFYSA-N 1 2 310.294 4.187 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2nccc(Cl)c2Cl)cc1 ZINC001167716815 1041431729 /nfs/dbraw/zinc/43/17/29/1041431729.db2.gz JISBGRBDXLSBPU-HNNXBMFYSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@H+]2Cc2nccc(Cl)c2Cl)cc1 ZINC001167716815 1041431735 /nfs/dbraw/zinc/43/17/35/1041431735.db2.gz JISBGRBDXLSBPU-HNNXBMFYSA-N 1 2 323.223 4.431 20 0 DIADLO CCc1ccccc1C[NH2+]Cc1csc(C(F)(F)F)n1 ZINC000893037068 1041466257 /nfs/dbraw/zinc/46/62/57/1041466257.db2.gz MGGNUVYCIJQDHJ-UHFFFAOYSA-N 1 2 300.349 4.014 20 0 DIADLO ClC1(Cl)C[C@H]1C[N@@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000747668212 1041473405 /nfs/dbraw/zinc/47/34/05/1041473405.db2.gz AHBOHGVUHJTWOX-HOCLYGCPSA-N 1 2 321.251 4.087 20 0 DIADLO ClC1(Cl)C[C@H]1C[N@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000747668212 1041473412 /nfs/dbraw/zinc/47/34/12/1041473412.db2.gz AHBOHGVUHJTWOX-HOCLYGCPSA-N 1 2 321.251 4.087 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)s1 ZINC000282525944 1041480784 /nfs/dbraw/zinc/48/07/84/1041480784.db2.gz PXENXOKZXBUCGW-DTWKUNHWSA-N 1 2 315.364 4.277 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nccn1C1CC1)c1ccc(F)cc1F ZINC000893108016 1041489656 /nfs/dbraw/zinc/48/96/56/1041489656.db2.gz KCOQUSJOPLQNCC-MRXNPFEDSA-N 1 2 305.372 4.127 20 0 DIADLO Cc1cc(N2C[C@@H](C)C[C@@H]2c2cccnc2)nc(C2CCC2)[nH+]1 ZINC000893155392 1041509183 /nfs/dbraw/zinc/50/91/83/1041509183.db2.gz HSESGVQDNNTBKQ-SUMWQHHRSA-N 1 2 308.429 4.035 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2ccnc(Cl)c2Cl)n1 ZINC000811477942 1041527321 /nfs/dbraw/zinc/52/73/21/1041527321.db2.gz IVLACPSEGFQINU-QMMMGPOBSA-N 1 2 302.230 4.004 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccnc(Cl)c2Cl)o1 ZINC000811475211 1041527726 /nfs/dbraw/zinc/52/77/26/1041527726.db2.gz XZEYCFCRGOKNIT-SKDRFNHKSA-N 1 2 311.212 4.395 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccnc(Cl)c2Cl)o1 ZINC000811475205 1041527845 /nfs/dbraw/zinc/52/78/45/1041527845.db2.gz XZEYCFCRGOKNIT-BXKDBHETSA-N 1 2 311.212 4.395 20 0 DIADLO Clc1nccc(C[NH+]2CCC(c3cccnc3)CC2)c1Cl ZINC000811507137 1041532874 /nfs/dbraw/zinc/53/28/74/1041532874.db2.gz SCVICZJCJLYHBJ-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3ccccc3[C@H]2c2ccccc2)co1 ZINC000659910769 1041535286 /nfs/dbraw/zinc/53/52/86/1041535286.db2.gz NHNNARJYVUISLD-HXUWFJFHSA-N 1 2 304.393 4.131 20 0 DIADLO Cc1nc(C[N@H+]2CCc3ccccc3[C@H]2c2ccccc2)co1 ZINC000659910769 1041535289 /nfs/dbraw/zinc/53/52/89/1041535289.db2.gz NHNNARJYVUISLD-HXUWFJFHSA-N 1 2 304.393 4.131 20 0 DIADLO Cc1cn2cc(NC(=O)c3occc3-c3ccccc3)ccc2[nH+]1 ZINC000339120508 1041545448 /nfs/dbraw/zinc/54/54/48/1041545448.db2.gz PZOKFBWLFOBHTO-UHFFFAOYSA-N 1 2 317.348 4.155 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@@H+]2Cc2cc(C3CC3)no2)cc1 ZINC000659938455 1041549913 /nfs/dbraw/zinc/54/99/13/1041549913.db2.gz UPLZPFBIASSRFO-SFHVURJKSA-N 1 2 314.454 4.151 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@H+]2Cc2cc(C3CC3)no2)cc1 ZINC000659938455 1041549919 /nfs/dbraw/zinc/54/99/19/1041549919.db2.gz UPLZPFBIASSRFO-SFHVURJKSA-N 1 2 314.454 4.151 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1nnc(-c2ccccc2)o1 ZINC000027557743 1041569562 /nfs/dbraw/zinc/56/95/62/1041569562.db2.gz RRYCDKSLYYYIGM-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1nnc(-c2ccccc2)o1 ZINC000027557743 1041569568 /nfs/dbraw/zinc/56/95/68/1041569568.db2.gz RRYCDKSLYYYIGM-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1 ZINC000659992196 1041574456 /nfs/dbraw/zinc/57/44/56/1041574456.db2.gz BNOKXRFOJHEDIS-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@H+]2CCC[C@@H]2c2ccccn2)c1 ZINC000659992196 1041574461 /nfs/dbraw/zinc/57/44/61/1041574461.db2.gz BNOKXRFOJHEDIS-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO CCn1c[nH+]cc1CNc1ncccc1O[C@@H](C)c1ccccc1 ZINC000416426111 1041575993 /nfs/dbraw/zinc/57/59/93/1041575993.db2.gz KYCYWBXVIFGUCN-HNNXBMFYSA-N 1 2 322.412 4.050 20 0 DIADLO C[C@H]([NH2+]c1ccc(N(C)Cc2ccccc2)cc1)[C@H]1CCOC1 ZINC000182901165 1041576116 /nfs/dbraw/zinc/57/61/16/1041576116.db2.gz SXCOGZYLBVRNNW-WMZOPIPTSA-N 1 2 310.441 4.160 20 0 DIADLO CC(C)Cc1ccc(C(=O)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC000613707860 1041583729 /nfs/dbraw/zinc/58/37/29/1041583729.db2.gz IDUXHOMDDUQSSQ-UHFFFAOYSA-N 1 2 319.408 4.323 20 0 DIADLO CC(C)=C[C@H]1[C@@H](C(=O)Nc2ccccc2-n2cc[nH+]c2)C1(C)C ZINC000613709508 1041584869 /nfs/dbraw/zinc/58/48/69/1041584869.db2.gz BESGCRMUJAPHGU-YOEHRIQHSA-N 1 2 309.413 4.049 20 0 DIADLO CC(C)=C[C@@H]1[C@@H](C(=O)Nc2ccccc2-n2cc[nH+]c2)C1(C)C ZINC000613709505 1041585086 /nfs/dbraw/zinc/58/50/86/1041585086.db2.gz BESGCRMUJAPHGU-PBHICJAKSA-N 1 2 309.413 4.049 20 0 DIADLO FC(F)(F)c1cc(Cl)ccc1C[N@@H+]1CCC[C@]2(CCO2)C1 ZINC001143506100 1041620063 /nfs/dbraw/zinc/62/00/63/1041620063.db2.gz YBGGMMJVURKBDO-AWEZNQCLSA-N 1 2 319.754 4.114 20 0 DIADLO FC(F)(F)c1cc(Cl)ccc1C[N@H+]1CCC[C@]2(CCO2)C1 ZINC001143506100 1041620067 /nfs/dbraw/zinc/62/00/67/1041620067.db2.gz YBGGMMJVURKBDO-AWEZNQCLSA-N 1 2 319.754 4.114 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC2(CC2(F)F)CC1 ZINC000651423771 1041639833 /nfs/dbraw/zinc/63/98/33/1041639833.db2.gz MEDAEKGVKPXTQM-UHFFFAOYSA-N 1 2 318.367 4.177 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)c(C)o1 ZINC000660200265 1041665172 /nfs/dbraw/zinc/66/51/72/1041665172.db2.gz HFXYNGFUQVUCLK-INIZCTEOSA-N 1 2 308.372 4.447 20 0 DIADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)C1CCCCC1 ZINC000584797134 1041674534 /nfs/dbraw/zinc/67/45/34/1041674534.db2.gz YQAAOWQDLQHMIS-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C=CCc1ccc(C(C)C)cc1 ZINC001133681964 1041689700 /nfs/dbraw/zinc/68/97/00/1041689700.db2.gz DKYJFWHQKGMXNR-WAYWQWQTSA-N 1 2 308.425 4.286 20 0 DIADLO Cc1cn2cc(-c3c(Cl)cc(CO)cc3Cl)ccc2[nH+]1 ZINC001245007243 1041696438 /nfs/dbraw/zinc/69/64/38/1041696438.db2.gz HYANHFFSWXMHRI-UHFFFAOYSA-N 1 2 307.180 4.109 20 0 DIADLO CCc1nocc1C[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000660267671 1041697334 /nfs/dbraw/zinc/69/73/34/1041697334.db2.gz UECDXYNGPCCOLS-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO COc1ccc2oc([C@@H](C)[NH2+]Cc3nc(C)oc3C)c(C)c2c1 ZINC000660267086 1041698770 /nfs/dbraw/zinc/69/87/70/1041698770.db2.gz VHOPDYQQJGXZMJ-LLVKDONJSA-N 1 2 314.385 4.205 20 0 DIADLO C[C@@H]([NH2+]Cc1cnn(C(C)(C)C)c1)c1ncc(-c2ccccc2)o1 ZINC000660271528 1041699250 /nfs/dbraw/zinc/69/92/50/1041699250.db2.gz ZCZBFDKIJRHQLR-CQSZACIVSA-N 1 2 324.428 4.144 20 0 DIADLO CCn1c[nH+]cc1CNc1cccc(COc2ccccc2)c1C ZINC000417813088 1041703255 /nfs/dbraw/zinc/70/32/55/1041703255.db2.gz QTQSFJXHSNOIAE-UHFFFAOYSA-N 1 2 321.424 4.403 20 0 DIADLO CCn1c[nH+]cc1CNc1cccc(OCCc2ccccc2)c1 ZINC000417811345 1041703705 /nfs/dbraw/zinc/70/37/05/1041703705.db2.gz JTIPEQYJSSJMLU-UHFFFAOYSA-N 1 2 321.424 4.137 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@@H+]2Cc2nc(C3CC3)no2)o1 ZINC000150725785 1041717817 /nfs/dbraw/zinc/71/78/17/1041717817.db2.gz CJOWAORZQZHGOB-OAHLLOKOSA-N 1 2 315.417 4.220 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@H+]2Cc2nc(C3CC3)no2)o1 ZINC000150725785 1041717827 /nfs/dbraw/zinc/71/78/27/1041717827.db2.gz CJOWAORZQZHGOB-OAHLLOKOSA-N 1 2 315.417 4.220 20 0 DIADLO CCc1nc(C)c([C@@H](C)[NH2+][C@H]2COc3cc(F)cc(F)c32)s1 ZINC000364311235 1041740065 /nfs/dbraw/zinc/74/00/65/1041740065.db2.gz JQEHIEYRPZWFHN-PELKAZGASA-N 1 2 324.396 4.076 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccccc1)[C@@H](O)c1ccccc1)c1cscn1 ZINC000813874648 1041740119 /nfs/dbraw/zinc/74/01/19/1041740119.db2.gz HLXVHUVKZKIMTC-KYNGSXCRSA-N 1 2 324.449 4.269 20 0 DIADLO Cn1cc(Nc2ccc[nH+]c2N2CCCCC2)c2ccccc21 ZINC001203416204 1041773493 /nfs/dbraw/zinc/77/34/93/1041773493.db2.gz ZBAKTCTWQIJTDX-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO CCOC(=O)C1([N@H+](C)Cc2ccc(C)cc2Cl)CCCCC1 ZINC001167759396 1041775554 /nfs/dbraw/zinc/77/55/54/1041775554.db2.gz BHOQDTXJNCGVPC-UHFFFAOYSA-N 1 2 323.864 4.346 20 0 DIADLO CCOC(=O)C1([N@@H+](C)Cc2ccc(C)cc2Cl)CCCCC1 ZINC001167759396 1041775561 /nfs/dbraw/zinc/77/55/61/1041775561.db2.gz BHOQDTXJNCGVPC-UHFFFAOYSA-N 1 2 323.864 4.346 20 0 DIADLO C[C@H](CC(=O)Nc1cccc2c1[C@@H](C)CC2(C)C)n1cc[nH+]c1 ZINC001134154342 1041786461 /nfs/dbraw/zinc/78/64/61/1041786461.db2.gz HONNWQIXHKZQFF-UONOGXRCSA-N 1 2 311.429 4.258 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1cccc(SC)c1 ZINC000660459732 1041811523 /nfs/dbraw/zinc/81/15/23/1041811523.db2.gz OIWKYNCBCPMWIF-KRWDZBQOSA-N 1 2 315.486 4.352 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1cccc(SC)c1 ZINC000660459732 1041811531 /nfs/dbraw/zinc/81/15/31/1041811531.db2.gz OIWKYNCBCPMWIF-KRWDZBQOSA-N 1 2 315.486 4.352 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1cccc2ccccc21 ZINC000196630163 1041822017 /nfs/dbraw/zinc/82/20/17/1041822017.db2.gz LQTHBQWDTRQZJV-UHFFFAOYSA-N 1 2 313.360 4.278 20 0 DIADLO Cc1ccc2occ(CC(=O)Nc3c(C)cc(C)[nH+]c3C)c2c1 ZINC000636582139 1041823114 /nfs/dbraw/zinc/82/31/14/1041823114.db2.gz VWLAOWXJIKPINP-UHFFFAOYSA-N 1 2 308.381 4.243 20 0 DIADLO Fc1ccc(SCC[N@@H+]2CCCC[C@H]2c2cc[nH]n2)c(F)c1 ZINC000660534636 1041828845 /nfs/dbraw/zinc/82/88/45/1041828845.db2.gz GEETUCRNIZCEIM-HNNXBMFYSA-N 1 2 323.412 4.007 20 0 DIADLO Fc1ccc(SCC[N@H+]2CCCC[C@H]2c2cc[nH]n2)c(F)c1 ZINC000660534636 1041828851 /nfs/dbraw/zinc/82/88/51/1041828851.db2.gz GEETUCRNIZCEIM-HNNXBMFYSA-N 1 2 323.412 4.007 20 0 DIADLO Cc1cccnc1C[N@@H+](C)[C@@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660708250 1041854754 /nfs/dbraw/zinc/85/47/54/1041854754.db2.gz OGKDZKYKAPMHOM-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1cccnc1C[N@H+](C)[C@@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660708250 1041854760 /nfs/dbraw/zinc/85/47/60/1041854760.db2.gz OGKDZKYKAPMHOM-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1ccncc1C[N@@H+](C)[C@@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660711273 1041855956 /nfs/dbraw/zinc/85/59/56/1041855956.db2.gz VUSDFOILLGNILH-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1ccncc1C[N@H+](C)[C@@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660711273 1041855962 /nfs/dbraw/zinc/85/59/62/1041855962.db2.gz VUSDFOILLGNILH-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1cc(C2CC2)no1 ZINC000660860952 1041866290 /nfs/dbraw/zinc/86/62/90/1041866290.db2.gz FKOQVKJFWITLLA-UHFFFAOYSA-N 1 2 320.820 4.239 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2)[C@@H]2COC(C)(C)C2)cs1 ZINC000661192940 1041902298 /nfs/dbraw/zinc/90/22/98/1041902298.db2.gz BWFFTEAXNAPGIY-KRWDZBQOSA-N 1 2 316.470 4.021 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2)[C@@H]2COC(C)(C)C2)cs1 ZINC000661192940 1041902306 /nfs/dbraw/zinc/90/23/06/1041902306.db2.gz BWFFTEAXNAPGIY-KRWDZBQOSA-N 1 2 316.470 4.021 20 0 DIADLO C[N@H+](Cc1nc2ccccc2n1C(F)F)Cc1ccc(F)cc1 ZINC000044995035 1041908905 /nfs/dbraw/zinc/90/89/05/1041908905.db2.gz YGCDPHMYBJMVSP-UHFFFAOYSA-N 1 2 319.330 4.203 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2n1C(F)F)Cc1ccc(F)cc1 ZINC000044995035 1041908910 /nfs/dbraw/zinc/90/89/10/1041908910.db2.gz YGCDPHMYBJMVSP-UHFFFAOYSA-N 1 2 319.330 4.203 20 0 DIADLO c1ccc2c(c1)-c1ccccc1C2Nc1ccc2c([nH+]1)CCOC2 ZINC001167776752 1041909879 /nfs/dbraw/zinc/90/98/79/1041909879.db2.gz MZKFVAYJFNKYQI-UHFFFAOYSA-N 1 2 314.388 4.336 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)CC(C)(C)C3CC3)c2)[nH+]c1C ZINC000815098138 1041917770 /nfs/dbraw/zinc/91/77/70/1041917770.db2.gz BJXCARGTRVWTLY-UHFFFAOYSA-N 1 2 311.429 4.458 20 0 DIADLO CSCc1cnc(CNc2ccc3c(c2)CCC[N@H+]3C)s1 ZINC000815130629 1041918076 /nfs/dbraw/zinc/91/80/76/1041918076.db2.gz BQWVSARZTXDYCK-UHFFFAOYSA-N 1 2 319.499 4.001 20 0 DIADLO CSCc1cnc(CNc2ccc3c(c2)CCC[N@@H+]3C)s1 ZINC000815130629 1041918086 /nfs/dbraw/zinc/91/80/86/1041918086.db2.gz BQWVSARZTXDYCK-UHFFFAOYSA-N 1 2 319.499 4.001 20 0 DIADLO CCc1ncc(C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)o1 ZINC000651823394 1041922836 /nfs/dbraw/zinc/92/28/36/1041922836.db2.gz GUQNALQGYUZSFM-CQSZACIVSA-N 1 2 307.397 4.150 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2)cn1 ZINC000651822513 1041924007 /nfs/dbraw/zinc/92/40/07/1041924007.db2.gz AAOYZPMNMALXIH-HOTGVXAUSA-N 1 2 320.440 4.377 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)C[NH+]1CCC(C2CCC2)CC1 ZINC000661374821 1041926897 /nfs/dbraw/zinc/92/68/97/1041926897.db2.gz PDFIBZJSRCKSAV-UHFFFAOYSA-N 1 2 320.864 4.099 20 0 DIADLO Clc1cc2c(s1)CC[N@H+](Cc1cc3cnccc3o1)C2 ZINC000651842839 1041931265 /nfs/dbraw/zinc/93/12/65/1041931265.db2.gz JRVQEJAZLVSENN-UHFFFAOYSA-N 1 2 304.802 4.101 20 0 DIADLO Clc1cc2c(s1)CC[N@@H+](Cc1cc3cnccc3o1)C2 ZINC000651842839 1041931271 /nfs/dbraw/zinc/93/12/71/1041931271.db2.gz JRVQEJAZLVSENN-UHFFFAOYSA-N 1 2 304.802 4.101 20 0 DIADLO CC(C)(C)n1cc(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccco2)cn1 ZINC000661432287 1041935648 /nfs/dbraw/zinc/93/56/48/1041935648.db2.gz BZYKECLVHAXLPZ-KRWDZBQOSA-N 1 2 313.445 4.348 20 0 DIADLO CC(C)(C)n1cc(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccco2)cn1 ZINC000661432287 1041935657 /nfs/dbraw/zinc/93/56/57/1041935657.db2.gz BZYKECLVHAXLPZ-KRWDZBQOSA-N 1 2 313.445 4.348 20 0 DIADLO CC(C)n1cncc1C[N@@H+]1CCc2oc(-c3ccccc3)cc2C1 ZINC000651879452 1041941115 /nfs/dbraw/zinc/94/11/15/1041941115.db2.gz XDSPUBUCNMEDFW-UHFFFAOYSA-N 1 2 321.424 4.282 20 0 DIADLO CC(C)n1cncc1C[N@H+]1CCc2oc(-c3ccccc3)cc2C1 ZINC000651879452 1041941125 /nfs/dbraw/zinc/94/11/25/1041941125.db2.gz XDSPUBUCNMEDFW-UHFFFAOYSA-N 1 2 321.424 4.282 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1cc2ccccc2s1 ZINC000045860268 1041945443 /nfs/dbraw/zinc/94/54/43/1041945443.db2.gz YWWXOGASCBGUCP-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO C/C(=C\C(=O)Nc1cccc2[nH+]ccn21)c1cccc(Cl)c1 ZINC001126097735 1041947322 /nfs/dbraw/zinc/94/73/22/1041947322.db2.gz PZFOKJUJWLWMHN-ZRDIBKRKSA-N 1 2 311.772 4.030 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccncc2Cl)cc1F ZINC000661661207 1041966590 /nfs/dbraw/zinc/96/65/90/1041966590.db2.gz VVNUAADNQZXOGK-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccncc2Cl)cc1F ZINC000661661207 1041966592 /nfs/dbraw/zinc/96/65/92/1041966592.db2.gz VVNUAADNQZXOGK-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CCCCc1nc(C[N@H+](C)Cc2ccc(OC)cc2)cs1 ZINC000048060834 1041978198 /nfs/dbraw/zinc/97/81/98/1041978198.db2.gz VMKHJOLGBQNPDH-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO CCCCc1nc(C[N@@H+](C)Cc2ccc(OC)cc2)cs1 ZINC000048060834 1041978204 /nfs/dbraw/zinc/97/82/04/1041978204.db2.gz VMKHJOLGBQNPDH-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1cccc(F)c1F ZINC000815649455 1041984168 /nfs/dbraw/zinc/98/41/68/1041984168.db2.gz QGSHQBFHATWKFP-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO CC(C)[N@@H+](Cc1ccccn1)Cc1ccccc1Br ZINC000048273032 1041985126 /nfs/dbraw/zinc/98/51/26/1041985126.db2.gz APDJWJDOAUBPAN-UHFFFAOYSA-N 1 2 319.246 4.255 20 0 DIADLO CC(C)[N@H+](Cc1ccccn1)Cc1ccccc1Br ZINC000048273032 1041985121 /nfs/dbraw/zinc/98/51/21/1041985121.db2.gz APDJWJDOAUBPAN-UHFFFAOYSA-N 1 2 319.246 4.255 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1cc(F)ccc1F ZINC000815650206 1041985290 /nfs/dbraw/zinc/98/52/90/1041985290.db2.gz LJYYUZGDBDYOHW-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO CC(C)n1ccc(C[N@@H+](Cc2ccccc2F)CC2CC2)n1 ZINC000661792527 1041995639 /nfs/dbraw/zinc/99/56/39/1041995639.db2.gz AMXVMVSJHVIOMR-UHFFFAOYSA-N 1 2 301.409 4.015 20 0 DIADLO CC(C)n1ccc(C[N@H+](Cc2ccccc2F)CC2CC2)n1 ZINC000661792527 1041995644 /nfs/dbraw/zinc/99/56/44/1041995644.db2.gz AMXVMVSJHVIOMR-UHFFFAOYSA-N 1 2 301.409 4.015 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)no1 ZINC000652329160 1042007964 /nfs/dbraw/zinc/00/79/64/1042007964.db2.gz LSMABEJUYSCLIR-LLVKDONJSA-N 1 2 310.319 4.342 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](c2ccc(F)c(C)c2)C2CC2)c1 ZINC000652330345 1042009204 /nfs/dbraw/zinc/00/92/04/1042009204.db2.gz CXULWOSTQAXHKA-GOSISDBHSA-N 1 2 300.377 4.239 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2ccc(OC)c(Cl)c2)c1 ZINC000652330781 1042009588 /nfs/dbraw/zinc/00/95/88/1042009588.db2.gz PKRKZCCKWOCEHQ-NSHDSACASA-N 1 2 306.793 4.063 20 0 DIADLO CC[C@H](Nc1cc(COC)cc[nH+]1)c1cc(C)ccc1OC ZINC000652330442 1042009674 /nfs/dbraw/zinc/00/96/74/1042009674.db2.gz GIBZFZLXCMRBOU-INIZCTEOSA-N 1 2 300.402 4.108 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](c2ccc(C)o2)C2CCCC2)c1 ZINC000652330994 1042010635 /nfs/dbraw/zinc/01/06/35/1042010635.db2.gz UYBSDJWKKXPTER-GOSISDBHSA-N 1 2 300.402 4.473 20 0 DIADLO O=C(Nc1ccc(Cl)cc1)c1c[nH+]ccc1Nc1ccccc1 ZINC001135510169 1042042497 /nfs/dbraw/zinc/04/24/97/1042042497.db2.gz LYAXGOSPIQNWIT-UHFFFAOYSA-N 1 2 323.783 4.153 20 0 DIADLO CCSc1cccc(NC(=O)c2ccn3c(C)c[nH+]c3c2)c1 ZINC001126191256 1042054962 /nfs/dbraw/zinc/05/49/62/1042054962.db2.gz OBAMXURUWSJCSH-UHFFFAOYSA-N 1 2 311.410 4.007 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2O)C[C@@H](c2ccccc2)O1 ZINC000245950878 1042059296 /nfs/dbraw/zinc/05/92/96/1042059296.db2.gz XBIHJDHHIHXHJB-DYVFJYSZSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2O)C[C@@H](c2ccccc2)O1 ZINC000245950878 1042059300 /nfs/dbraw/zinc/05/93/00/1042059300.db2.gz XBIHJDHHIHXHJB-DYVFJYSZSA-N 1 2 317.816 4.008 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1conc1Cc1ccccc1 ZINC000816522286 1042064321 /nfs/dbraw/zinc/06/43/21/1042064321.db2.gz RUCFZSUIRLKTRL-UHFFFAOYSA-N 1 2 321.424 4.252 20 0 DIADLO COc1cccc(C2([NH2+]Cc3ncc(C(C)(C)C)o3)CCC2)c1 ZINC000662109347 1042066936 /nfs/dbraw/zinc/06/69/36/1042066936.db2.gz XHMUHFHUFZRFDP-UHFFFAOYSA-N 1 2 314.429 4.150 20 0 DIADLO Cc1cn2cc(NC(=O)N(C)[C@@H](C)c3ccc(C)cc3)ccc2[nH+]1 ZINC000599405766 1042071095 /nfs/dbraw/zinc/07/10/95/1042071095.db2.gz OMBLVQPKWAARPK-HNNXBMFYSA-N 1 2 322.412 4.176 20 0 DIADLO Cc1ccc(NC(=O)C[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c(F)c1 ZINC001135675061 1042079538 /nfs/dbraw/zinc/07/95/38/1042079538.db2.gz ZIIKEJPTVGXOEZ-OAHLLOKOSA-N 1 2 323.371 4.018 20 0 DIADLO FC(F)(F)C[C@H]1C[N@H+](Cc2csc3ccccc23)CCO1 ZINC000662230561 1042093989 /nfs/dbraw/zinc/09/39/89/1042093989.db2.gz BHOMXOMHUPAPIA-LBPRGKRZSA-N 1 2 315.360 4.055 20 0 DIADLO FC(F)(F)C[C@H]1C[N@@H+](Cc2csc3ccccc23)CCO1 ZINC000662230561 1042093996 /nfs/dbraw/zinc/09/39/96/1042093996.db2.gz BHOMXOMHUPAPIA-LBPRGKRZSA-N 1 2 315.360 4.055 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(C(F)F)cc2)C[C@H](CC(F)(F)F)O1 ZINC000662238963 1042096840 /nfs/dbraw/zinc/09/68/40/1042096840.db2.gz XEZWYVMHAGZCSW-GWCFXTLKSA-N 1 2 323.305 4.166 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(C(F)F)cc2)C[C@H](CC(F)(F)F)O1 ZINC000662238963 1042096849 /nfs/dbraw/zinc/09/68/49/1042096849.db2.gz XEZWYVMHAGZCSW-GWCFXTLKSA-N 1 2 323.305 4.166 20 0 DIADLO c1sc(C2CC2)nc1C[NH+]1CCC(OC2CCCCC2)CC1 ZINC000161512718 1042109460 /nfs/dbraw/zinc/10/94/60/1042109460.db2.gz HFAPXVGGGJRUCA-UHFFFAOYSA-N 1 2 320.502 4.334 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2ccc(OC)cc2F)o1 ZINC000165212815 1042110674 /nfs/dbraw/zinc/11/06/74/1042110674.db2.gz OUHGEPKWTXAFDB-PXAZEXFGSA-N 1 2 321.392 4.028 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2csc(-c3ccco3)n2)c(C)o1 ZINC000062424307 1042111160 /nfs/dbraw/zinc/11/11/60/1042111160.db2.gz RFWNONGDPVVYAC-NSHDSACASA-N 1 2 302.399 4.464 20 0 DIADLO CC(C)N(C(=O)c1cccc2[nH+]ccn21)[C@@H](C)c1ccsc1 ZINC000817485861 1042111408 /nfs/dbraw/zinc/11/14/08/1042111408.db2.gz QPQXFZVHKIXGGI-ZDUSSCGKSA-N 1 2 313.426 4.008 20 0 DIADLO CC1(C)C[C@]1([NH2+]Cc1nnc(-c2ccccc2)o1)c1ccccc1 ZINC000662343746 1042115619 /nfs/dbraw/zinc/11/56/19/1042115619.db2.gz NKVLTMNPUACSQL-FQEVSTJZSA-N 1 2 319.408 4.152 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2ccc(Cl)s2)cs1 ZINC000165223360 1042116364 /nfs/dbraw/zinc/11/63/64/1042116364.db2.gz VWFHIAVZYWINSF-BDAKNGLRSA-N 1 2 316.879 4.416 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccncc1Cl ZINC000817584576 1042118294 /nfs/dbraw/zinc/11/82/94/1042118294.db2.gz BSXNOICLAINLAR-GFCCVEGCSA-N 1 2 301.821 4.291 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccncc1Cl ZINC000817584576 1042118296 /nfs/dbraw/zinc/11/82/96/1042118296.db2.gz BSXNOICLAINLAR-GFCCVEGCSA-N 1 2 301.821 4.291 20 0 DIADLO CC(C)CCc1noc(C[N@@H+]2CCC[C@H]2c2cccs2)n1 ZINC000063482736 1042121037 /nfs/dbraw/zinc/12/10/37/1042121037.db2.gz DZFXOLASROFBHJ-ZDUSSCGKSA-N 1 2 305.447 4.057 20 0 DIADLO CC(C)CCc1noc(C[N@H+]2CCC[C@H]2c2cccs2)n1 ZINC000063482736 1042121042 /nfs/dbraw/zinc/12/10/42/1042121042.db2.gz DZFXOLASROFBHJ-ZDUSSCGKSA-N 1 2 305.447 4.057 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ccc(F)c(C)c3)c2)[nH+]c1C ZINC000728860704 1042123037 /nfs/dbraw/zinc/12/30/37/1042123037.db2.gz HKPHSZRFECDBOC-UHFFFAOYSA-N 1 2 323.371 4.393 20 0 DIADLO Cn1c[nH+]c2ccc(N[C@@H](c3ccccc3)C(F)(F)F)cc21 ZINC001170881257 1042127338 /nfs/dbraw/zinc/12/73/38/1042127338.db2.gz IMVIGXUUWLBLGG-HNNXBMFYSA-N 1 2 305.303 4.289 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2cc3ccccc3o2)cs1 ZINC000165275388 1042135534 /nfs/dbraw/zinc/13/55/34/1042135534.db2.gz ADFJITZYKXXNBN-NWDGAFQWSA-N 1 2 316.426 4.448 20 0 DIADLO FC(F)(F)c1nn(CC[C@H]2CC2(Cl)Cl)c2cc[nH+]cc21 ZINC000818079347 1042138717 /nfs/dbraw/zinc/13/87/17/1042138717.db2.gz FPSCPKRRPOJRGD-ZETCQYMHSA-N 1 2 324.133 4.034 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000051688986 1042162282 /nfs/dbraw/zinc/16/22/82/1042162282.db2.gz URMVHSULDPAKCH-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000051688986 1042162286 /nfs/dbraw/zinc/16/22/86/1042162286.db2.gz URMVHSULDPAKCH-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO CCCC[C@@H](C)N(CCCC)C(=O)c1cccc2[nH+]ccn21 ZINC000818923802 1042163575 /nfs/dbraw/zinc/16/35/75/1042163575.db2.gz FQFYZYSGLMZLFY-OAHLLOKOSA-N 1 2 301.434 4.155 20 0 DIADLO CCn1c(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)nc2ccccc21 ZINC000071006123 1042174601 /nfs/dbraw/zinc/17/46/01/1042174601.db2.gz XOEBKIFSUWJYII-HIFRSBDPSA-N 1 2 309.413 4.062 20 0 DIADLO C[C@@H](c1nc2ccccc2n1C(F)F)[N@@H+]1CC[C@@H](C(F)F)C1 ZINC000663463833 1042177072 /nfs/dbraw/zinc/17/70/72/1042177072.db2.gz KQXLOVPBBMOQRJ-VHSXEESVSA-N 1 2 315.314 4.079 20 0 DIADLO C[C@@H](c1nc2ccccc2n1C(F)F)[N@H+]1CC[C@@H](C(F)F)C1 ZINC000663463833 1042177075 /nfs/dbraw/zinc/17/70/75/1042177075.db2.gz KQXLOVPBBMOQRJ-VHSXEESVSA-N 1 2 315.314 4.079 20 0 DIADLO CC[C@@]1(C)CC[N@H+](Cc2c(F)ccc(Br)c2F)C1 ZINC000399494376 1042203788 /nfs/dbraw/zinc/20/37/88/1042203788.db2.gz VYFZYKWPZJLGDO-AWEZNQCLSA-N 1 2 318.205 4.349 20 0 DIADLO CC[C@@]1(C)CC[N@@H+](Cc2c(F)ccc(Br)c2F)C1 ZINC000399494376 1042203793 /nfs/dbraw/zinc/20/37/93/1042203793.db2.gz VYFZYKWPZJLGDO-AWEZNQCLSA-N 1 2 318.205 4.349 20 0 DIADLO CC(C)N(C)c1ccc(NCc2c[nH+]cn2C(C)C)cc1F ZINC000317183757 1042214815 /nfs/dbraw/zinc/21/48/15/1042214815.db2.gz SGGKCGUUAXTIFG-UHFFFAOYSA-N 1 2 304.413 4.060 20 0 DIADLO COc1cc(C[NH2+][C@H](CF)c2ccc(F)cc2)ccc1Cl ZINC000631282798 1042247426 /nfs/dbraw/zinc/24/74/26/1042247426.db2.gz DEQYXWSQGSXMSE-OAHLLOKOSA-N 1 2 311.759 4.288 20 0 DIADLO CCc1ccc(C[NH2+]C2(c3noc(C)n3)CCCCCC2)cc1 ZINC000585817229 1042265304 /nfs/dbraw/zinc/26/53/04/1042265304.db2.gz DAYMTXKVXZOPKH-UHFFFAOYSA-N 1 2 313.445 4.280 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2ncc(C(C)(C)C)s2)C2CC2)n1 ZINC000279119177 1042274566 /nfs/dbraw/zinc/27/45/66/1042274566.db2.gz LKYPNRFUGCYXTH-AWEZNQCLSA-N 1 2 321.515 4.446 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC[C@]3(CCO3)C2)ccc1Cl ZINC001138051750 1042277100 /nfs/dbraw/zinc/27/71/00/1042277100.db2.gz LZHKVGVJDMGRDP-AWEZNQCLSA-N 1 2 319.754 4.114 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC[C@]3(CCO3)C2)ccc1Cl ZINC001138051750 1042277103 /nfs/dbraw/zinc/27/71/03/1042277103.db2.gz LZHKVGVJDMGRDP-AWEZNQCLSA-N 1 2 319.754 4.114 20 0 DIADLO COc1cccc2cc(CNc3ccc([NH+](C)C)cc3C)oc21 ZINC000319828641 1042284381 /nfs/dbraw/zinc/28/43/81/1042284381.db2.gz KTYGSERQIYPHQK-UHFFFAOYSA-N 1 2 310.397 4.428 20 0 DIADLO COc1c(F)cccc1C[N@@H+]1CCc2c(Cl)cccc2C1 ZINC001143529688 1042286175 /nfs/dbraw/zinc/28/61/75/1042286175.db2.gz BVCSNGAIZLAALZ-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1c(F)cccc1C[N@H+]1CCc2c(Cl)cccc2C1 ZINC001143529688 1042286179 /nfs/dbraw/zinc/28/61/79/1042286179.db2.gz BVCSNGAIZLAALZ-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Cn1c(Cl)cnc1C[N@@H+]1CC(C)(C)C[C@H]1c1ccccc1 ZINC000822525378 1042288857 /nfs/dbraw/zinc/28/88/57/1042288857.db2.gz FUKCHLSMUPOQTL-AWEZNQCLSA-N 1 2 303.837 4.047 20 0 DIADLO Cn1c(Cl)cnc1C[N@H+]1CC(C)(C)C[C@H]1c1ccccc1 ZINC000822525378 1042288861 /nfs/dbraw/zinc/28/88/61/1042288861.db2.gz FUKCHLSMUPOQTL-AWEZNQCLSA-N 1 2 303.837 4.047 20 0 DIADLO CC/C(C)=C/C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000822533878 1042289075 /nfs/dbraw/zinc/28/90/75/1042289075.db2.gz OPACNUVNIGKDQS-WYMLVPIESA-N 1 2 309.413 4.181 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@]3(C)CC=CCC3)c2)[nH+]c1C ZINC000822730090 1042299217 /nfs/dbraw/zinc/29/92/17/1042299217.db2.gz FSZBMFIXSPGTPM-LJQANCHMSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2nccc3c2CCCC3)cs1 ZINC000893679625 1042300227 /nfs/dbraw/zinc/30/02/27/1042300227.db2.gz VNOXXILCWUXPOA-GOSISDBHSA-N 1 2 313.470 4.062 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2nccc3c2CCCC3)cs1 ZINC000893679625 1042300231 /nfs/dbraw/zinc/30/02/31/1042300231.db2.gz VNOXXILCWUXPOA-GOSISDBHSA-N 1 2 313.470 4.062 20 0 DIADLO CCCC[C@@](C)(F)C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001136625770 1042300846 /nfs/dbraw/zinc/30/08/46/1042300846.db2.gz XYPDULWRNGEGKB-QGZVFWFLSA-N 1 2 303.381 4.038 20 0 DIADLO COc1cccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c1OC ZINC000061556113 1042310722 /nfs/dbraw/zinc/31/07/22/1042310722.db2.gz JMNWPKXBFNLWNF-LJQANCHMSA-N 1 2 323.392 4.176 20 0 DIADLO CC(C)C[C@H](C(=O)N1CCCC2(CCCCC2)C1)n1cc[nH+]c1 ZINC001136673853 1042313933 /nfs/dbraw/zinc/31/39/33/1042313933.db2.gz LDTDEWZDHSGWGO-QGZVFWFLSA-N 1 2 317.477 4.043 20 0 DIADLO Cc1cncc([C@H](C)[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000279479303 1042318553 /nfs/dbraw/zinc/31/85/53/1042318553.db2.gz KPQPBTQUUQFMMI-VHSXEESVSA-N 1 2 315.364 4.277 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccnc(Cl)c2F)cc1 ZINC000823372022 1042322140 /nfs/dbraw/zinc/32/21/40/1042322140.db2.gz SEPSXZBBCBFSTD-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccnc(Cl)c2F)cc1 ZINC000823372022 1042322149 /nfs/dbraw/zinc/32/21/49/1042322149.db2.gz SEPSXZBBCBFSTD-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Fc1cc(C[N@H+](Cc2ccc(Cl)cc2)C2CC2)c(F)cn1 ZINC000823399584 1042323522 /nfs/dbraw/zinc/32/35/22/1042323522.db2.gz KBXMAGQCUKEIID-UHFFFAOYSA-N 1 2 308.759 4.178 20 0 DIADLO Fc1cc(C[N@@H+](Cc2ccc(Cl)cc2)C2CC2)c(F)cn1 ZINC000823399584 1042323529 /nfs/dbraw/zinc/32/35/29/1042323529.db2.gz KBXMAGQCUKEIID-UHFFFAOYSA-N 1 2 308.759 4.178 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1cc(F)ncc1F ZINC000823436663 1042325047 /nfs/dbraw/zinc/32/50/47/1042325047.db2.gz BOKYMPOTNKALDJ-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1cc(F)ncc1F ZINC000823436663 1042325053 /nfs/dbraw/zinc/32/50/53/1042325053.db2.gz BOKYMPOTNKALDJ-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO COCC[N@H+](Cc1ccnc(Cl)c1F)[C@H](C)c1ccccc1 ZINC000823408637 1042325610 /nfs/dbraw/zinc/32/56/10/1042325610.db2.gz OUJSDKQUAWANTJ-CYBMUJFWSA-N 1 2 322.811 4.084 20 0 DIADLO COCC[N@@H+](Cc1ccnc(Cl)c1F)[C@H](C)c1ccccc1 ZINC000823408637 1042325617 /nfs/dbraw/zinc/32/56/17/1042325617.db2.gz OUJSDKQUAWANTJ-CYBMUJFWSA-N 1 2 322.811 4.084 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](C[C@H]1CC3(CO1)CCCCC3)C2 ZINC001171019897 1042327665 /nfs/dbraw/zinc/32/76/65/1042327665.db2.gz ZAENRAGSVCHMRA-QGZVFWFLSA-N 1 2 305.849 4.395 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](C[C@H]1CC3(CO1)CCCCC3)C2 ZINC001171019897 1042327672 /nfs/dbraw/zinc/32/76/72/1042327672.db2.gz ZAENRAGSVCHMRA-QGZVFWFLSA-N 1 2 305.849 4.395 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(F)ncc2F)[C@@H]1c1cccc(F)c1 ZINC000823470960 1042327841 /nfs/dbraw/zinc/32/78/41/1042327841.db2.gz PHUMCYQXSOJTOI-GTNSWQLSSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(F)ncc2F)[C@@H]1c1cccc(F)c1 ZINC000823470960 1042327845 /nfs/dbraw/zinc/32/78/45/1042327845.db2.gz PHUMCYQXSOJTOI-GTNSWQLSSA-N 1 2 306.331 4.082 20 0 DIADLO Clc1cccc(-c2cc(CNc3ccn4cc[nH+]c4c3)on2)c1 ZINC001171019377 1042328319 /nfs/dbraw/zinc/32/83/19/1042328319.db2.gz FLTRHKWQDMOTNF-UHFFFAOYSA-N 1 2 324.771 4.255 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](C)Cc2ccnc(Cl)c2F)c1 ZINC000823477245 1042328531 /nfs/dbraw/zinc/32/85/31/1042328531.db2.gz OAGBGUVDOZTBJV-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2ccnc(Cl)c2F)c1 ZINC000823477245 1042328535 /nfs/dbraw/zinc/32/85/35/1042328535.db2.gz OAGBGUVDOZTBJV-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO Clc1cccc(-c2cc(CNc3cc4cc[nH]c4c[nH+]3)on2)c1 ZINC001171020875 1042332542 /nfs/dbraw/zinc/33/25/42/1042332542.db2.gz SINLQYIERHVSLN-UHFFFAOYSA-N 1 2 324.771 4.483 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(SC(C)C)cc2)o1 ZINC000112543395 1042340847 /nfs/dbraw/zinc/34/08/47/1042340847.db2.gz MQKYMJOSHQYGRD-NEPJUHHUSA-N 1 2 305.447 4.290 20 0 DIADLO CC(C)n1ncnc1C[NH2+][C@@H](c1ccccc1F)C1CCCC1 ZINC000279794246 1042344202 /nfs/dbraw/zinc/34/42/02/1042344202.db2.gz VYVZZHLWZICGKL-GOSISDBHSA-N 1 2 316.424 4.019 20 0 DIADLO Nc1cccc2c1cc[nH+]c2N1CCC(c2ccsc2)CC1 ZINC000663820742 1042356993 /nfs/dbraw/zinc/35/69/93/1042356993.db2.gz YZEXDVBDYJEGEQ-UHFFFAOYSA-N 1 2 309.438 4.263 20 0 DIADLO CCCC[C@H](CC)CC[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000437986081 1042360635 /nfs/dbraw/zinc/36/06/35/1042360635.db2.gz KHZBZHSQXDDWKD-RDJZCZTQSA-N 1 2 300.450 4.090 20 0 DIADLO CC[N@H+](Cc1ncc(C)s1)Cc1cccc(C(F)(F)F)c1 ZINC001139813217 1042365098 /nfs/dbraw/zinc/36/50/98/1042365098.db2.gz YKIBUSYNLOLSAG-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CC[N@@H+](Cc1ncc(C)s1)Cc1cccc(C(F)(F)F)c1 ZINC001139813217 1042365100 /nfs/dbraw/zinc/36/51/00/1042365100.db2.gz YKIBUSYNLOLSAG-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO Cc1cnc(Br)cc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213491209 1042366943 /nfs/dbraw/zinc/36/69/43/1042366943.db2.gz BNPBEXGBJABEIC-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1cccc(C)c1NC(=O)C[N@@H+](C)[C@H](C)c1ccccc1F ZINC000051500156 1042374944 /nfs/dbraw/zinc/37/49/44/1042374944.db2.gz IHQGDILBMMZXKR-OAHLLOKOSA-N 1 2 314.404 4.074 20 0 DIADLO Cc1cccc(C)c1NC(=O)C[N@H+](C)[C@H](C)c1ccccc1F ZINC000051500156 1042374947 /nfs/dbraw/zinc/37/49/47/1042374947.db2.gz IHQGDILBMMZXKR-OAHLLOKOSA-N 1 2 314.404 4.074 20 0 DIADLO CC(C)c1c[nH]c(C[NH+]2CCC(OCC3CCCCC3)CC2)n1 ZINC000893979852 1042399496 /nfs/dbraw/zinc/39/94/96/1042399496.db2.gz GEEIKOQUYKMXLI-UHFFFAOYSA-N 1 2 319.493 4.094 20 0 DIADLO Cc1cc(NCc2ccnc(C(F)(F)F)c2)nc(C2CCC2)[nH+]1 ZINC000894037411 1042405988 /nfs/dbraw/zinc/40/59/88/1042405988.db2.gz KTAOVYPSAAOHLX-UHFFFAOYSA-N 1 2 322.334 4.078 20 0 DIADLO C[C@H](CSC(C)(C)C)[NH2+]c1ccc(N2CCO[C@@H](C)C2)cc1 ZINC000246110156 1042415200 /nfs/dbraw/zinc/41/52/00/1042415200.db2.gz NETIMKYAMGFYPY-CABCVRRESA-N 1 2 322.518 4.244 20 0 DIADLO CC[C@@H](CC(F)F)Cn1nc(C(F)(F)F)c2c[nH+]ccc21 ZINC000663995784 1042438663 /nfs/dbraw/zinc/43/86/63/1042438663.db2.gz NHBBPCYUPCBZPL-QMMMGPOBSA-N 1 2 307.266 4.132 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2cc(OC(F)F)ccc21)c1ncco1 ZINC000924873007 1042445482 /nfs/dbraw/zinc/44/54/82/1042445482.db2.gz UDCVEYBECNLZQC-YGRLFVJLSA-N 1 2 308.328 4.004 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2ccc(-c3ncco3)cc2F)s1 ZINC000411533352 1042455804 /nfs/dbraw/zinc/45/58/04/1042455804.db2.gz BHYZZORIPZJUQT-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO CCCc1nc(C[N@H+](CC)Cc2ccc(OC)cc2)cs1 ZINC000052039526 1042462813 /nfs/dbraw/zinc/46/28/13/1042462813.db2.gz KPVQOXLNIMKJBR-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO CCCc1nc(C[N@@H+](CC)Cc2ccc(OC)cc2)cs1 ZINC000052039526 1042462816 /nfs/dbraw/zinc/46/28/16/1042462816.db2.gz KPVQOXLNIMKJBR-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1coc2ccccc12 ZINC000113033560 1042464504 /nfs/dbraw/zinc/46/45/04/1042464504.db2.gz YUELTAZCUNKXDA-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO CCCn1c(CNc2ccc([NH+](C)C)cc2C)nc2ccccc21 ZINC000237034676 1042468063 /nfs/dbraw/zinc/46/80/63/1042468063.db2.gz JIUUMOLZYWSBND-UHFFFAOYSA-N 1 2 322.456 4.433 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2cccc(Br)c2)on1 ZINC000052213904 1042477717 /nfs/dbraw/zinc/47/77/17/1042477717.db2.gz GHDUMDYGJSTPBQ-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2cccc(Br)c2)on1 ZINC000052213904 1042477719 /nfs/dbraw/zinc/47/77/19/1042477719.db2.gz GHDUMDYGJSTPBQ-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO Fc1cccc(C[N@H+](Cc2cc(-c3ccco3)on2)C2CC2)c1 ZINC000052161582 1042483464 /nfs/dbraw/zinc/48/34/64/1042483464.db2.gz ASRRVOANGWRJHN-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2cc(-c3ccco3)on2)C2CC2)c1 ZINC000052161582 1042483465 /nfs/dbraw/zinc/48/34/65/1042483465.db2.gz ASRRVOANGWRJHN-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO COc1ccc([C@@H](Cc2ccccc2)Nc2cccc[nH+]2)cc1 ZINC000576389528 1042486614 /nfs/dbraw/zinc/48/66/14/1042486614.db2.gz ABRSTGVBBWBOLV-LJQANCHMSA-N 1 2 304.393 4.486 20 0 DIADLO Brc1cccc2c1CCC[C@@H]2Oc1cc[nH+]cc1 ZINC001225295339 1042498314 /nfs/dbraw/zinc/49/83/14/1042498314.db2.gz KSNRURZGBWBWNX-HNNXBMFYSA-N 1 2 304.187 4.301 20 0 DIADLO CCC(CC)CO[C@@H]1CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC001204940338 1042511930 /nfs/dbraw/zinc/51/19/30/1042511930.db2.gz ZSSVSMAXZCFFIU-CYBMUJFWSA-N 1 2 316.898 4.214 20 0 DIADLO CCC(CC)CO[C@@H]1CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC001204940338 1042511934 /nfs/dbraw/zinc/51/19/34/1042511934.db2.gz ZSSVSMAXZCFFIU-CYBMUJFWSA-N 1 2 316.898 4.214 20 0 DIADLO Nc1ncc2cc(Nc3cc[nH+]c4cc(Cl)ccc34)ccc2n1 ZINC001213109938 1042516951 /nfs/dbraw/zinc/51/69/51/1042516951.db2.gz XOZQUIMGXAYXJR-UHFFFAOYSA-N 1 2 321.771 4.157 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1F ZINC000513411201 1042538448 /nfs/dbraw/zinc/53/84/48/1042538448.db2.gz KVTNRXRPCBTYBV-UHFFFAOYSA-N 1 2 309.388 4.060 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1F ZINC000513411201 1042538451 /nfs/dbraw/zinc/53/84/51/1042538451.db2.gz KVTNRXRPCBTYBV-UHFFFAOYSA-N 1 2 309.388 4.060 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc3c(s2)C[C@@H](C)CC3)s1 ZINC000513437998 1042540946 /nfs/dbraw/zinc/54/09/46/1042540946.db2.gz HPXDMUPTURYQFS-NSHDSACASA-N 1 2 306.500 4.270 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc3c(s2)C[C@@H](C)CC3)s1 ZINC000513437998 1042540949 /nfs/dbraw/zinc/54/09/49/1042540949.db2.gz HPXDMUPTURYQFS-NSHDSACASA-N 1 2 306.500 4.270 20 0 DIADLO Cc1c2cccc(Cl)c2sc1C[N@H+]1CCOCC12CC2 ZINC000513563855 1042552522 /nfs/dbraw/zinc/55/25/22/1042552522.db2.gz OENMHDXCRSOACI-UHFFFAOYSA-N 1 2 307.846 4.228 20 0 DIADLO Cc1c2cccc(Cl)c2sc1C[N@@H+]1CCOCC12CC2 ZINC000513563855 1042552520 /nfs/dbraw/zinc/55/25/20/1042552520.db2.gz OENMHDXCRSOACI-UHFFFAOYSA-N 1 2 307.846 4.228 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1ncccc1C(F)(F)F ZINC000513668129 1042557610 /nfs/dbraw/zinc/55/76/10/1042557610.db2.gz WARVXTTWKHHYOG-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1ncccc1C(F)(F)F ZINC000513668129 1042557615 /nfs/dbraw/zinc/55/76/15/1042557615.db2.gz WARVXTTWKHHYOG-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO COCC[N@H+](Cc1ccco1)Cc1ccc(Cl)cc1Cl ZINC000513697664 1042574377 /nfs/dbraw/zinc/57/43/77/1042574377.db2.gz QJUODKSLTDPBBO-UHFFFAOYSA-N 1 2 314.212 4.235 20 0 DIADLO COCC[N@@H+](Cc1ccco1)Cc1ccc(Cl)cc1Cl ZINC000513697664 1042574380 /nfs/dbraw/zinc/57/43/80/1042574380.db2.gz QJUODKSLTDPBBO-UHFFFAOYSA-N 1 2 314.212 4.235 20 0 DIADLO Cc1cc(C)c(CNC(=O)N(C)[C@H]2CCC[C@H]2C(C)(C)C)c[nH+]1 ZINC000419510828 1042585797 /nfs/dbraw/zinc/58/57/97/1042585797.db2.gz WKFIZHGMYKCYED-SJORKVTESA-N 1 2 317.477 4.055 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+]Cc2csc(-c3ccccc3)n2)c1 ZINC000513718619 1042596430 /nfs/dbraw/zinc/59/64/30/1042596430.db2.gz ZZDMLCGDJKCOCU-AWEZNQCLSA-N 1 2 309.438 4.364 20 0 DIADLO Cc1cccc([C@@H]2CCCN2C(=O)NCc2cc(C)[nH+]c(C)c2)c1 ZINC000420847928 1042614073 /nfs/dbraw/zinc/61/40/73/1042614073.db2.gz LAZCPHLJQILULZ-IBGZPJMESA-N 1 2 323.440 4.054 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)cs1 ZINC000420948843 1042616830 /nfs/dbraw/zinc/61/68/30/1042616830.db2.gz OFLPJAKQRCHNTD-LLVKDONJSA-N 1 2 306.397 4.431 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)cs1 ZINC000420948843 1042616832 /nfs/dbraw/zinc/61/68/32/1042616832.db2.gz OFLPJAKQRCHNTD-LLVKDONJSA-N 1 2 306.397 4.431 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)cs1 ZINC000420951146 1042617007 /nfs/dbraw/zinc/61/70/07/1042617007.db2.gz QOHYWJSOLGVVTD-WDEREUQCSA-N 1 2 322.396 4.015 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)cs1 ZINC000420951146 1042617014 /nfs/dbraw/zinc/61/70/14/1042617014.db2.gz QOHYWJSOLGVVTD-WDEREUQCSA-N 1 2 322.396 4.015 20 0 DIADLO COCc1nc(C[N@H+](C(C)C)[C@H](C)c2ccsc2)cs1 ZINC000421020066 1042622579 /nfs/dbraw/zinc/62/25/79/1042622579.db2.gz YPZNGUGGFSGMPY-GFCCVEGCSA-N 1 2 310.488 4.323 20 0 DIADLO COCc1nc(C[N@@H+](C(C)C)[C@H](C)c2ccsc2)cs1 ZINC000421020066 1042622583 /nfs/dbraw/zinc/62/25/83/1042622583.db2.gz YPZNGUGGFSGMPY-GFCCVEGCSA-N 1 2 310.488 4.323 20 0 DIADLO Cc1cc(CNC(=O)Nc2cc(C)c(C)cc2Cl)cc(C)[nH+]1 ZINC000421112740 1042625610 /nfs/dbraw/zinc/62/56/10/1042625610.db2.gz MRCVEAKTEJSRFK-UHFFFAOYSA-N 1 2 317.820 4.290 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)nn1C ZINC000421329962 1042630732 /nfs/dbraw/zinc/63/07/32/1042630732.db2.gz WNYPDHSBWJQLIW-INIZCTEOSA-N 1 2 323.843 4.398 20 0 DIADLO Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]Cc1nn(C)c(C)c1Cl ZINC000421331316 1042630763 /nfs/dbraw/zinc/63/07/63/1042630763.db2.gz JMZZJZVZSUGUJQ-CYBMUJFWSA-N 1 2 321.852 4.087 20 0 DIADLO CCN(CC)c1ccc(N[C@H](C)c2ccncc2Cl)c[nH+]1 ZINC000421834670 1042655312 /nfs/dbraw/zinc/65/53/12/1042655312.db2.gz KYSZTQRYWZARJG-GFCCVEGCSA-N 1 2 304.825 4.149 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](C)c2ccccc2OC)cs1 ZINC000271597234 1042665500 /nfs/dbraw/zinc/66/55/00/1042665500.db2.gz AANKXAIZZVREAG-ZDUSSCGKSA-N 1 2 304.459 4.345 20 0 DIADLO Clc1cccc(C2([NH2+]Cc3ccn(C4CCCC4)n3)CC2)c1 ZINC000271766454 1042668204 /nfs/dbraw/zinc/66/82/04/1042668204.db2.gz IYJQJEHSRJDRAO-UHFFFAOYSA-N 1 2 315.848 4.431 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@@H](C)c2cccc(F)c2F)n1 ZINC000271820079 1042669351 /nfs/dbraw/zinc/66/93/51/1042669351.db2.gz UATSEDLFFQDHBB-LBPRGKRZSA-N 1 2 307.388 4.373 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](c2ccc(F)c(C)c2)C2CC2)n1 ZINC000272041708 1042675399 /nfs/dbraw/zinc/67/53/99/1042675399.db2.gz DMRUUHAHVVPSNO-SFHVURJKSA-N 1 2 317.408 4.101 20 0 DIADLO Cc1cc([C@@H]([NH2+][C@@H](C)c2nc(C(C)C)no2)C2CC2)ccc1F ZINC000272064363 1042676235 /nfs/dbraw/zinc/67/62/35/1042676235.db2.gz INZOFRKBOICJDU-LRDDRELGSA-N 1 2 317.408 4.442 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H]2CCCOc3cc(F)ccc32)cs1 ZINC000272104381 1042677296 /nfs/dbraw/zinc/67/72/96/1042677296.db2.gz ZMHIULDGGIGFNX-YGRLFVJLSA-N 1 2 306.406 4.155 20 0 DIADLO CC[C@@](C)([NH2+]Cc1c(F)ccc(C)c1F)c1nc(C)cs1 ZINC001167949591 1042684497 /nfs/dbraw/zinc/68/44/97/1042684497.db2.gz NBDNTBDVNUVKRV-MRXNPFEDSA-N 1 2 310.413 4.453 20 0 DIADLO Cc1cccc(NC(=O)C[C@H](C)[NH2+]c2ccc3c(c2)CCN3)c1C ZINC000423217271 1042701080 /nfs/dbraw/zinc/70/10/80/1042701080.db2.gz PURZPUYCKORGEI-AWEZNQCLSA-N 1 2 323.440 4.101 20 0 DIADLO Cc1ccc2oc(SCc3cn4cc(C)ccc4[nH+]3)nc2c1 ZINC000504504578 1042723124 /nfs/dbraw/zinc/72/31/24/1042723124.db2.gz SDMODCJAPLEQDO-UHFFFAOYSA-N 1 2 309.394 4.385 20 0 DIADLO CC(C)n1cncc1C[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC000424145996 1042727125 /nfs/dbraw/zinc/72/71/25/1042727125.db2.gz OPSFYJGOSBHZCX-GFCCVEGCSA-N 1 2 306.479 4.069 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@H]2CCOc3c(F)cccc32)c(F)c1 ZINC000424172719 1042728737 /nfs/dbraw/zinc/72/87/37/1042728737.db2.gz DHPNLUGPJPIKDJ-INIZCTEOSA-N 1 2 307.315 4.026 20 0 DIADLO Brc1cc(C[N@@H+]2CCc3ccccc3C2)cs1 ZINC000514071306 1042768851 /nfs/dbraw/zinc/76/88/51/1042768851.db2.gz KGQCOTCIPIMHKX-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1cc(C[N@H+]2CCc3ccccc3C2)cs1 ZINC000514071306 1042768856 /nfs/dbraw/zinc/76/88/56/1042768856.db2.gz KGQCOTCIPIMHKX-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cc(C)ccc3C3CC3)cc2[nH+]1 ZINC000424552451 1042741763 /nfs/dbraw/zinc/74/17/63/1042741763.db2.gz BDKWFWWFSAZJPD-UHFFFAOYSA-N 1 2 305.381 4.309 20 0 DIADLO CCCC[C@H](CC)C(=O)N1CC[NH2+][C@H](c2cccc(Cl)c2)C1 ZINC000513997326 1042765516 /nfs/dbraw/zinc/76/55/16/1042765516.db2.gz QUVINZNFPGHQTR-YOEHRIQHSA-N 1 2 322.880 4.029 20 0 DIADLO CC(C)n1cncc1C[N@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000425319279 1042791268 /nfs/dbraw/zinc/79/12/68/1042791268.db2.gz AQOJMTHZHCACBP-KDOFPFPSSA-N 1 2 313.445 4.345 20 0 DIADLO CC(C)n1cncc1C[N@@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000425319279 1042791272 /nfs/dbraw/zinc/79/12/72/1042791272.db2.gz AQOJMTHZHCACBP-KDOFPFPSSA-N 1 2 313.445 4.345 20 0 DIADLO COc1cc(Cl)c(C[NH+]2CC(CC(F)F)C2)cc1Cl ZINC000425365488 1042797644 /nfs/dbraw/zinc/79/76/44/1042797644.db2.gz KYKGMIIKEULCKZ-UHFFFAOYSA-N 1 2 310.171 4.089 20 0 DIADLO CC1(C)C[C@@H](c2ccccc2)[N@H+](Cc2nccn2C(F)F)C1 ZINC000425373583 1042800277 /nfs/dbraw/zinc/80/02/77/1042800277.db2.gz PYUHVJISDRDBFR-AWEZNQCLSA-N 1 2 305.372 4.251 20 0 DIADLO CC1(C)C[C@@H](c2ccccc2)[N@@H+](Cc2nccn2C(F)F)C1 ZINC000425373583 1042800279 /nfs/dbraw/zinc/80/02/79/1042800279.db2.gz PYUHVJISDRDBFR-AWEZNQCLSA-N 1 2 305.372 4.251 20 0 DIADLO CCN(C)c1ccc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)cn1 ZINC000514973693 1042802895 /nfs/dbraw/zinc/80/28/95/1042802895.db2.gz XIUYJMXPSGKVAH-KRWDZBQOSA-N 1 2 315.848 4.138 20 0 DIADLO CCN(C)c1ccc(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)cn1 ZINC000514973693 1042802898 /nfs/dbraw/zinc/80/28/98/1042802898.db2.gz XIUYJMXPSGKVAH-KRWDZBQOSA-N 1 2 315.848 4.138 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)o1 ZINC000515163384 1042810029 /nfs/dbraw/zinc/81/00/29/1042810029.db2.gz LFINWGKBHUXCST-CYBMUJFWSA-N 1 2 324.346 4.424 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)o1 ZINC000515163384 1042810040 /nfs/dbraw/zinc/81/00/40/1042810040.db2.gz LFINWGKBHUXCST-CYBMUJFWSA-N 1 2 324.346 4.424 20 0 DIADLO COc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1cscn1)CCS2 ZINC000515357158 1042817516 /nfs/dbraw/zinc/81/75/16/1042817516.db2.gz WFXCZLRWIVWHSE-ZWNOBZJWSA-N 1 2 306.456 4.039 20 0 DIADLO CCc1nc(C[N@H+](Cc2ccc(CC)cc2)C2CC2)cs1 ZINC000515549651 1042826377 /nfs/dbraw/zinc/82/63/77/1042826377.db2.gz LMRCINGDRUDSPL-UHFFFAOYSA-N 1 2 300.471 4.433 20 0 DIADLO CCc1nc(C[N@@H+](Cc2ccc(CC)cc2)C2CC2)cs1 ZINC000515549651 1042826383 /nfs/dbraw/zinc/82/63/83/1042826383.db2.gz LMRCINGDRUDSPL-UHFFFAOYSA-N 1 2 300.471 4.433 20 0 DIADLO CCCOc1ccc(C[NH2+][C@@H](C)c2cscn2)cc1OCC ZINC000515673211 1042830872 /nfs/dbraw/zinc/83/08/72/1042830872.db2.gz QLJCWCJSQIQFMQ-ZDUSSCGKSA-N 1 2 320.458 4.181 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)c1ccc(Cl)cc1 ZINC000638290301 1042842399 /nfs/dbraw/zinc/84/23/99/1042842399.db2.gz FFMPLJBMXWGDAH-MLGOLLRUSA-N 1 2 318.852 4.430 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2ccccc2C(F)(F)F)c(C)[nH+]1 ZINC000517163663 1042869857 /nfs/dbraw/zinc/86/98/57/1042869857.db2.gz ORXYWAXCNRRMPF-UHFFFAOYSA-N 1 2 322.330 4.207 20 0 DIADLO Cc1cc(N2CCC(Cc3ccccc3)CC2)nc(C2CC2)[nH+]1 ZINC000517636480 1042889902 /nfs/dbraw/zinc/88/99/02/1042889902.db2.gz ZFKXEWPDDZMMBS-UHFFFAOYSA-N 1 2 307.441 4.122 20 0 DIADLO Cc1nocc1C[NH+](Cc1cccs1)Cc1cccs1 ZINC000294333888 1042907944 /nfs/dbraw/zinc/90/79/44/1042907944.db2.gz ACYZOPDWHKHXDE-UHFFFAOYSA-N 1 2 304.440 4.308 20 0 DIADLO Clc1cccc2c1OCC[C@H]2[NH2+][C@H]1CCCc2scnc21 ZINC000623877297 1042917361 /nfs/dbraw/zinc/91/73/61/1042917361.db2.gz XYCHEIIZVRQWQM-OLZOCXBDSA-N 1 2 320.845 4.287 20 0 DIADLO COc1cc(C[NH2+]CC(C)(F)F)c(-c2ccccc2)cc1OC ZINC000518800109 1042921342 /nfs/dbraw/zinc/92/13/42/1042921342.db2.gz HQKRCLQZTNXVBN-UHFFFAOYSA-N 1 2 321.367 4.116 20 0 DIADLO COc1ccc2c(c1)C[N@H+]([C@@H](C)c1ccc(F)cc1F)CC2 ZINC000519214505 1042938503 /nfs/dbraw/zinc/93/85/03/1042938503.db2.gz IYMUNCVBMDYXHN-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc2c(c1)C[N@@H+]([C@@H](C)c1ccc(F)cc1F)CC2 ZINC000519214505 1042938505 /nfs/dbraw/zinc/93/85/05/1042938505.db2.gz IYMUNCVBMDYXHN-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO CC[C@@H](Nc1[nH+]cnc2c1cnn2-c1ccccc1)C(C)(C)C ZINC000519244841 1042940701 /nfs/dbraw/zinc/94/07/01/1042940701.db2.gz XSKXPTLCDXDASC-OAHLLOKOSA-N 1 2 309.417 4.052 20 0 DIADLO COc1ccnc([C@H](C)[NH2+][C@H](C)c2nc3ccccc3s2)c1 ZINC000925068586 1042945659 /nfs/dbraw/zinc/94/56/59/1042945659.db2.gz DWOWGWDUZRWBSO-NWDGAFQWSA-N 1 2 313.426 4.112 20 0 DIADLO Brc1ccccc1C[NH2+][C@H]1CCCc2scnc21 ZINC000623879987 1042946009 /nfs/dbraw/zinc/94/60/09/1042946009.db2.gz VQIZWWIINOCZMH-LBPRGKRZSA-N 1 2 323.259 4.073 20 0 DIADLO COc1c(F)cc(F)cc1C[N@@H+]1CCSc2ccccc2C1 ZINC001143568307 1042958977 /nfs/dbraw/zinc/95/89/77/1042958977.db2.gz SFFFPCSHCXSWMN-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO COc1c(F)cc(F)cc1C[N@H+]1CCSc2ccccc2C1 ZINC001143568307 1042958982 /nfs/dbraw/zinc/95/89/82/1042958982.db2.gz SFFFPCSHCXSWMN-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO C[C@H](Nc1ccc([NH+]2CCCC2)cc1)c1ccc2c(c1)OCO2 ZINC000319930282 1042962308 /nfs/dbraw/zinc/96/23/08/1042962308.db2.gz FRXDAACQOBOXHP-AWEZNQCLSA-N 1 2 310.397 4.189 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000664832375 1042968639 /nfs/dbraw/zinc/96/86/39/1042968639.db2.gz JMBINZLLPQEIFW-GUYCJALGSA-N 1 2 307.397 4.367 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000664832375 1042968641 /nfs/dbraw/zinc/96/86/41/1042968641.db2.gz JMBINZLLPQEIFW-GUYCJALGSA-N 1 2 307.397 4.367 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2csc(C(F)(F)F)n2)ccc1F ZINC000894667275 1042972105 /nfs/dbraw/zinc/97/21/05/1042972105.db2.gz LYIYRBCGOZQSBB-SECBINFHSA-N 1 2 318.339 4.460 20 0 DIADLO C[N@H+](Cc1ccc(-c2ccccc2Cl)o1)Cc1ccncn1 ZINC001204746185 1042973773 /nfs/dbraw/zinc/97/37/73/1042973773.db2.gz TWYRQGLVUKIUJU-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1ccc(-c2ccccc2Cl)o1)Cc1ccncn1 ZINC001204746185 1042973778 /nfs/dbraw/zinc/97/37/78/1042973778.db2.gz TWYRQGLVUKIUJU-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO CCN(Cc1ccc(-n2cc[nH+]c2)cc1C)c1ccccc1OC ZINC001167982601 1042975708 /nfs/dbraw/zinc/97/57/08/1042975708.db2.gz FIHGWVYHQVZRAI-UHFFFAOYSA-N 1 2 321.424 4.216 20 0 DIADLO Fc1ccccc1C[NH2+][C@H]1COc2c1ccc(Cl)c2Cl ZINC000608065989 1042977037 /nfs/dbraw/zinc/97/70/37/1042977037.db2.gz QFTSPLYSSZIWCC-ZDUSSCGKSA-N 1 2 312.171 4.356 20 0 DIADLO CC[C@@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)c1cccc2ccccc21 ZINC000894850890 1042987217 /nfs/dbraw/zinc/98/72/17/1042987217.db2.gz KKMWQKWAHJVSGW-DNVCBOLYSA-N 1 2 321.424 4.255 20 0 DIADLO CC[C@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)c1cccc2ccccc21 ZINC000894850888 1042987352 /nfs/dbraw/zinc/98/73/52/1042987352.db2.gz KKMWQKWAHJVSGW-BEFAXECRSA-N 1 2 321.424 4.255 20 0 DIADLO CC[C@@H](NC(=O)C[C@H](C)n1cc[nH+]c1)c1cccc2ccccc21 ZINC000894850894 1042987481 /nfs/dbraw/zinc/98/74/81/1042987481.db2.gz KKMWQKWAHJVSGW-HNAYVOBHSA-N 1 2 321.424 4.255 20 0 DIADLO C[NH+](C)c1ccc(NCc2nc(-c3ccccc3)cs2)cc1 ZINC000237147924 1042991010 /nfs/dbraw/zinc/99/10/10/1042991010.db2.gz UCABLWKYDFOKOW-UHFFFAOYSA-N 1 2 309.438 4.488 20 0 DIADLO CCC[C@](C)(CC)c1nc(Cc2cn3cccc(C)c3[nH+]2)no1 ZINC000519718985 1042999269 /nfs/dbraw/zinc/99/92/69/1042999269.db2.gz DGNYFRAMNXNAMF-SFHVURJKSA-N 1 2 312.417 4.084 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1Cl)c1cn2c(n1)CCCC2 ZINC000925095256 1043014514 /nfs/dbraw/zinc/01/45/14/1043014514.db2.gz SRFWQZVEMGMSQS-VXGBXAGGSA-N 1 2 321.827 4.424 20 0 DIADLO CC[C@H]([NH2+]Cc1nccn1CC(C)C)c1ccc(F)cc1F ZINC000164809967 1043017339 /nfs/dbraw/zinc/01/73/39/1043017339.db2.gz UYXDUUOQXQISJY-INIZCTEOSA-N 1 2 307.388 4.058 20 0 DIADLO CCOc1ccc2c(c1)CC[N@@H+](Cc1nc3ccccc3s1)C2 ZINC000441078529 1043018293 /nfs/dbraw/zinc/01/82/93/1043018293.db2.gz JNPULXAMWREWCN-UHFFFAOYSA-N 1 2 324.449 4.253 20 0 DIADLO CCOc1ccc2c(c1)CC[N@H+](Cc1nc3ccccc3s1)C2 ZINC000441078529 1043018297 /nfs/dbraw/zinc/01/82/97/1043018297.db2.gz JNPULXAMWREWCN-UHFFFAOYSA-N 1 2 324.449 4.253 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@@H+](Cc1nc3ccccc3o1)C2 ZINC000441081292 1043018416 /nfs/dbraw/zinc/01/84/16/1043018416.db2.gz SBMHZWSZDNOXBN-UHFFFAOYSA-N 1 2 322.408 4.175 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@H+](Cc1nc3ccccc3o1)C2 ZINC000441081292 1043018419 /nfs/dbraw/zinc/01/84/19/1043018419.db2.gz SBMHZWSZDNOXBN-UHFFFAOYSA-N 1 2 322.408 4.175 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000441174512 1043024832 /nfs/dbraw/zinc/02/48/32/1043024832.db2.gz SGVFNZPSSHKTBQ-DOTOQJQBSA-N 1 2 305.805 4.458 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000441174512 1043024834 /nfs/dbraw/zinc/02/48/34/1043024834.db2.gz SGVFNZPSSHKTBQ-DOTOQJQBSA-N 1 2 305.805 4.458 20 0 DIADLO Cc1ccc(F)c(NC(=O)[C@@H](c2cccc(Cl)c2)[NH+](C)C)c1 ZINC000520313711 1043033913 /nfs/dbraw/zinc/03/39/13/1043033913.db2.gz JUPIBKAVXFEAKO-MRXNPFEDSA-N 1 2 320.795 4.029 20 0 DIADLO COC(=O)c1cc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)c(C)o1 ZINC000520353162 1043037310 /nfs/dbraw/zinc/03/73/10/1043037310.db2.gz PUCRFTWTBLNWBU-NSHDSACASA-N 1 2 321.804 4.221 20 0 DIADLO COC(=O)c1cc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)c(C)o1 ZINC000520353162 1043037311 /nfs/dbraw/zinc/03/73/11/1043037311.db2.gz PUCRFTWTBLNWBU-NSHDSACASA-N 1 2 321.804 4.221 20 0 DIADLO CCCCc1nc(C[N@H+](C)CC(C)(C)c2ccc(C)cc2)no1 ZINC000441353508 1043038022 /nfs/dbraw/zinc/03/80/22/1043038022.db2.gz LSELDRRPWLMKAX-UHFFFAOYSA-N 1 2 315.461 4.130 20 0 DIADLO CCCCc1nc(C[N@@H+](C)CC(C)(C)c2ccc(C)cc2)no1 ZINC000441353508 1043038024 /nfs/dbraw/zinc/03/80/24/1043038024.db2.gz LSELDRRPWLMKAX-UHFFFAOYSA-N 1 2 315.461 4.130 20 0 DIADLO C[C@@H](Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)c1cncs1 ZINC000348530303 1043047419 /nfs/dbraw/zinc/04/74/19/1043047419.db2.gz YWIDQXJRUKDKCB-SNVBAGLBSA-N 1 2 304.806 4.155 20 0 DIADLO Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000173806680 1043053311 /nfs/dbraw/zinc/05/33/11/1043053311.db2.gz INHLRZJCIWJFRU-HOTGVXAUSA-N 1 2 321.424 4.381 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(Cc3ccccc3)no2)cc1 ZINC000173971831 1043057720 /nfs/dbraw/zinc/05/77/20/1043057720.db2.gz QYTCPKQHBXYBSO-CVEARBPZSA-N 1 2 321.424 4.381 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1cccc(F)c1F ZINC000188462960 1043085406 /nfs/dbraw/zinc/08/54/06/1043085406.db2.gz PFQKKPPJSLAZCH-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO c1nc(C[NH2+]C(c2ccccc2)c2ccccc2)cn1C1CC1 ZINC000865398030 1043091306 /nfs/dbraw/zinc/09/13/06/1043091306.db2.gz PIWYZOOUPIPQNP-UHFFFAOYSA-N 1 2 303.409 4.097 20 0 DIADLO CC(C)([NH2+]Cc1csc(C2CC2)n1)c1ccc(F)c(F)c1 ZINC000175990299 1043091403 /nfs/dbraw/zinc/09/14/03/1043091403.db2.gz GVSBIVLBRQWWIW-UHFFFAOYSA-N 1 2 308.397 4.324 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2c(Cl)cncc2Cl)o1 ZINC000865419843 1043096459 /nfs/dbraw/zinc/09/64/59/1043096459.db2.gz ZNQUVRHBMJQCBK-MWLCHTKSSA-N 1 2 311.212 4.395 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2cn(C3CC3)cn2)c2ccccc2)cc1 ZINC000865432130 1043098616 /nfs/dbraw/zinc/09/86/16/1043098616.db2.gz PXUPNGUSWVFQIC-FQEVSTJZSA-N 1 2 321.399 4.236 20 0 DIADLO COc1ccc(C[NH2+][C@@H](C)c2nnc(C)s2)cc1C(C)(C)C ZINC000865527401 1043109347 /nfs/dbraw/zinc/10/93/47/1043109347.db2.gz DDDZNHREHQMGJN-NSHDSACASA-N 1 2 319.474 4.003 20 0 DIADLO CC(C)([NH2+]Cc1cn(C2CC2)cn1)c1cccc(Cl)c1F ZINC000865531265 1043110518 /nfs/dbraw/zinc/11/05/18/1043110518.db2.gz LZVWPUQGQXTJPZ-UHFFFAOYSA-N 1 2 307.800 4.035 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](c2ncccc2C)C(C)C)cs1 ZINC000177683621 1043111972 /nfs/dbraw/zinc/11/19/72/1043111972.db2.gz VRUSZFOUUODXAX-UKRRQHHQSA-N 1 2 319.474 4.041 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](c2ncccc2C)C(C)C)cs1 ZINC000177683638 1043112018 /nfs/dbraw/zinc/11/20/18/1043112018.db2.gz VRUSZFOUUODXAX-HIFRSBDPSA-N 1 2 319.474 4.041 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1ccc2ccccc2n1)c1ccc(C)o1 ZINC000178229091 1043123583 /nfs/dbraw/zinc/12/35/83/1043123583.db2.gz GFDBRCIYTDTEQF-KSSFIOAISA-N 1 2 310.397 4.175 20 0 DIADLO COC[C@@H]([NH2+]Cc1cc(Cl)ccc1Cl)c1ccco1 ZINC000179012211 1043139022 /nfs/dbraw/zinc/13/90/22/1043139022.db2.gz XBFMEVJVYYVBSD-CYBMUJFWSA-N 1 2 300.185 4.064 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H](C)c2cc3cnccc3o2)s1 ZINC000865853985 1043141510 /nfs/dbraw/zinc/14/15/10/1043141510.db2.gz LEURSRQFCJFNQS-LLVKDONJSA-N 1 2 301.415 4.259 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C)c(C)o1)c1ccccc1OC(F)F ZINC000179722910 1043150525 /nfs/dbraw/zinc/15/05/25/1043150525.db2.gz NGEDFFBJZWXUKR-CYBMUJFWSA-N 1 2 310.344 4.134 20 0 DIADLO Cc1ccccc1[C@H]([NH2+]Cc1noc(C(C)(C)C)n1)C(C)C ZINC000183229735 1043159500 /nfs/dbraw/zinc/15/95/00/1043159500.db2.gz UUTMFOOHISPQRC-MRXNPFEDSA-N 1 2 301.434 4.162 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2coc(-c3cccs3)n2)c(C)o1 ZINC000183784919 1043172848 /nfs/dbraw/zinc/17/28/48/1043172848.db2.gz HBACIVRVRDQPEY-NSHDSACASA-N 1 2 302.399 4.464 20 0 DIADLO C[C@H]([NH2+]Cc1cocn1)c1cccc(SC(F)(F)F)c1 ZINC000866322498 1043179143 /nfs/dbraw/zinc/17/91/43/1043179143.db2.gz WCAKKODOIQNHSI-VIFPVBQESA-N 1 2 302.321 4.137 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2cc3ccccc3s2)o1 ZINC000184376001 1043184830 /nfs/dbraw/zinc/18/48/30/1043184830.db2.gz FOZUPMYFLJAAQK-LLVKDONJSA-N 1 2 301.415 4.259 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccccn1 ZINC000866351237 1043185939 /nfs/dbraw/zinc/18/59/39/1043185939.db2.gz IBXNURGLYFITPG-INIZCTEOSA-N 1 2 312.310 4.125 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cc2c(ccnc2Cl)o1)c1cscn1 ZINC000866388502 1043194152 /nfs/dbraw/zinc/19/41/52/1043194152.db2.gz KCENOMOSWQLGDP-IUCAKERBSA-N 1 2 307.806 4.350 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)CCc2cncc3ccccc32)c1 ZINC000866383894 1043195210 /nfs/dbraw/zinc/19/52/10/1043195210.db2.gz DPLOTFDJSAYBQL-OAHLLOKOSA-N 1 2 321.424 4.209 20 0 DIADLO Cc1noc([C@@H](C)[NH2+][C@@H](CCc2ccccc2)c2ccccc2)n1 ZINC000614573268 1043196790 /nfs/dbraw/zinc/19/67/90/1043196790.db2.gz BJORMYDKTCSGHP-BEFAXECRSA-N 1 2 321.424 4.403 20 0 DIADLO Cc1nn(C(C)(C)C)cc1[C@@H](C)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000185315856 1043198602 /nfs/dbraw/zinc/19/86/02/1043198602.db2.gz APQCFDFFQIIIOO-GFCCVEGCSA-N 1 2 313.449 4.095 20 0 DIADLO Cc1nc(C)c([C@@H](C)[NH2+]Cc2ncc(-c3ccccc3)cn2)s1 ZINC000186060392 1043213098 /nfs/dbraw/zinc/21/30/98/1043213098.db2.gz OUEKTADAJBQBOJ-GFCCVEGCSA-N 1 2 324.453 4.068 20 0 DIADLO Cc1nc(C)c([C@H](C)[NH2+]Cc2ncc(-c3ccccc3)cn2)s1 ZINC000186060412 1043213423 /nfs/dbraw/zinc/21/34/23/1043213423.db2.gz OUEKTADAJBQBOJ-LBPRGKRZSA-N 1 2 324.453 4.068 20 0 DIADLO C[C@@H]1CCN(c2ncc(-c3ccccc3)s2)C[C@@H]1n1cc[nH+]c1 ZINC000134091852 1043213654 /nfs/dbraw/zinc/21/36/54/1043213654.db2.gz RKRXTNZDCDCCOA-ZBFHGGJFSA-N 1 2 324.453 4.094 20 0 DIADLO CC(C)CC[C@H]([NH2+]Cc1nn(C)cc1C(F)F)c1ccoc1 ZINC000866565737 1043224541 /nfs/dbraw/zinc/22/45/41/1043224541.db2.gz PZLZVXRCRAWBCA-AWEZNQCLSA-N 1 2 311.376 4.218 20 0 DIADLO CCC[C@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1cccnc1 ZINC000186806154 1043234360 /nfs/dbraw/zinc/23/43/60/1043234360.db2.gz QUQVYCVTTUBMBH-KRWDZBQOSA-N 1 2 317.433 4.016 20 0 DIADLO CC(C)n1ccc(C[NH2+]C(C)(C)c2cccc(Cl)c2F)n1 ZINC000186884707 1043236690 /nfs/dbraw/zinc/23/66/90/1043236690.db2.gz ZYZQKJLJXUFQRS-UHFFFAOYSA-N 1 2 309.816 4.281 20 0 DIADLO CO[C@H](C)c1nc(C[NH+]2CCC(c3ccsc3)CC2)cs1 ZINC000186912831 1043237503 /nfs/dbraw/zinc/23/75/03/1043237503.db2.gz JEJAZFMRPJWMMD-GFCCVEGCSA-N 1 2 322.499 4.292 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccccc1OC ZINC001203438663 1043264235 /nfs/dbraw/zinc/26/42/35/1043264235.db2.gz OCHNHLRSDCAWMN-SFHVURJKSA-N 1 2 311.425 4.179 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccccc1OC ZINC001203438663 1043264241 /nfs/dbraw/zinc/26/42/41/1043264241.db2.gz OCHNHLRSDCAWMN-SFHVURJKSA-N 1 2 311.425 4.179 20 0 DIADLO COc1ccc(CNc2ccc([N@@H+]3C[C@H]4CC[C@@H]3C4)cc2)cc1O ZINC000192214914 1043267281 /nfs/dbraw/zinc/26/72/81/1043267281.db2.gz CZKJBGOHEZLVMS-MAUKXSAKSA-N 1 2 324.424 4.002 20 0 DIADLO COc1ccc(CNc2ccc([N@H+]3C[C@H]4CC[C@@H]3C4)cc2)cc1O ZINC000192214914 1043267291 /nfs/dbraw/zinc/26/72/91/1043267291.db2.gz CZKJBGOHEZLVMS-MAUKXSAKSA-N 1 2 324.424 4.002 20 0 DIADLO Fc1cc(F)c(Nc2ccn3cc[nH+]c3c2)c(Br)c1 ZINC001204977392 1043281386 /nfs/dbraw/zinc/28/13/86/1043281386.db2.gz GGWXTHVJBHTMAT-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2ncc(Cl)n2C)c1C ZINC000122277838 1043291479 /nfs/dbraw/zinc/29/14/79/1043291479.db2.gz XNRBCMPIAXHDOT-OAHLLOKOSA-N 1 2 303.837 4.027 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ncc(Cl)n2C)c1C ZINC000122277838 1043291486 /nfs/dbraw/zinc/29/14/86/1043291486.db2.gz XNRBCMPIAXHDOT-OAHLLOKOSA-N 1 2 303.837 4.027 20 0 DIADLO CO[C@H](CSCc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000339092604 1043322706 /nfs/dbraw/zinc/32/27/06/1043322706.db2.gz WHPPJFKEXJBPIO-LJQANCHMSA-N 1 2 324.449 4.493 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@@H](c2nccn2C)c2ccc(F)cc2)c1 ZINC000268739197 1043326886 /nfs/dbraw/zinc/32/68/86/1043326886.db2.gz CMTSLSGHHZDRKJ-HNAYVOBHSA-N 1 2 323.415 4.308 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2ccc(F)cc2)cc1 ZINC000268746790 1043327133 /nfs/dbraw/zinc/32/71/33/1043327133.db2.gz FYCBHVVJPXALLO-DNVCBOLYSA-N 1 2 323.415 4.308 20 0 DIADLO CCc1cc(C)cc(CC)c1NC(=O)c1ccn2c(C)c[nH+]c2c1 ZINC001270981976 1043333253 /nfs/dbraw/zinc/33/32/53/1043333253.db2.gz DDBRRZIRQCHHGG-UHFFFAOYSA-N 1 2 321.424 4.328 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](CC(C)C)c2ccccn2)cs1 ZINC000269040169 1043353667 /nfs/dbraw/zinc/35/36/67/1043353667.db2.gz GIACGQLSKQUHAJ-CJNGLKHVSA-N 1 2 319.474 4.123 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2ccc(F)c(C)c2)cs1 ZINC000269076396 1043357352 /nfs/dbraw/zinc/35/73/52/1043357352.db2.gz NNZWYAFNOSGQPV-VXGBXAGGSA-N 1 2 308.422 4.149 20 0 DIADLO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2nc(-c3ccccc3)no2)c1 ZINC000269085054 1043357527 /nfs/dbraw/zinc/35/75/27/1043357527.db2.gz MBYKNNIFLYQYEC-KGLIPLIRSA-N 1 2 323.396 4.157 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000795151869 1043359000 /nfs/dbraw/zinc/35/90/00/1043359000.db2.gz LSTXJJZXPKZLBC-CQSZACIVSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000795151869 1043359006 /nfs/dbraw/zinc/35/90/06/1043359006.db2.gz LSTXJJZXPKZLBC-CQSZACIVSA-N 1 2 311.385 4.139 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)c(Cl)c1OC ZINC000269502555 1043367694 /nfs/dbraw/zinc/36/76/94/1043367694.db2.gz QWLHVRGBAZSKKJ-CQSZACIVSA-N 1 2 320.820 4.022 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c(Cl)c1OC ZINC000269502555 1043367702 /nfs/dbraw/zinc/36/77/02/1043367702.db2.gz QWLHVRGBAZSKKJ-CQSZACIVSA-N 1 2 320.820 4.022 20 0 DIADLO C[N@H+](Cc1nc(C(F)(F)F)cs1)[C@H]1C[C@H]1c1ccccc1 ZINC000269755773 1043373419 /nfs/dbraw/zinc/37/34/19/1043373419.db2.gz GSISLYPSLVMWIA-RYUDHWBXSA-N 1 2 312.360 4.150 20 0 DIADLO C[N@@H+](Cc1nc(C(F)(F)F)cs1)[C@H]1C[C@H]1c1ccccc1 ZINC000269755773 1043373431 /nfs/dbraw/zinc/37/34/31/1043373431.db2.gz GSISLYPSLVMWIA-RYUDHWBXSA-N 1 2 312.360 4.150 20 0 DIADLO C[N@H+](CCOCC(F)(F)F)Cc1c(Cl)cccc1Cl ZINC000521222668 1043376903 /nfs/dbraw/zinc/37/69/03/1043376903.db2.gz OMBOBXUAHMLFIG-UHFFFAOYSA-N 1 2 316.150 4.004 20 0 DIADLO C[N@@H+](CCOCC(F)(F)F)Cc1c(Cl)cccc1Cl ZINC000521222668 1043376908 /nfs/dbraw/zinc/37/69/08/1043376908.db2.gz OMBOBXUAHMLFIG-UHFFFAOYSA-N 1 2 316.150 4.004 20 0 DIADLO Cn1c(Cl)nc(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC000123662172 1043380192 /nfs/dbraw/zinc/38/01/92/1043380192.db2.gz BWOXOFTVKNJMSR-GFCCVEGCSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1c(Cl)nc(Cl)c1C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000123662172 1043380198 /nfs/dbraw/zinc/38/01/98/1043380198.db2.gz BWOXOFTVKNJMSR-GFCCVEGCSA-N 1 2 310.228 4.064 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1ccc(Cl)nc1C(F)(F)F ZINC000795181015 1043384835 /nfs/dbraw/zinc/38/48/35/1043384835.db2.gz GAWUMVWJHPNDOX-UHFFFAOYSA-N 1 2 318.726 4.287 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1ccc(Cl)nc1C(F)(F)F ZINC000795181015 1043384845 /nfs/dbraw/zinc/38/48/45/1043384845.db2.gz GAWUMVWJHPNDOX-UHFFFAOYSA-N 1 2 318.726 4.287 20 0 DIADLO O=C(CC1CCCC1)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000270410167 1043385471 /nfs/dbraw/zinc/38/54/71/1043385471.db2.gz DQEQOCQPVOSEAC-UHFFFAOYSA-N 1 2 321.424 4.121 20 0 DIADLO COc1ccc2cc(C[N@H+](C)Cc3ncc(C4CC4)o3)ccc2c1 ZINC000270628388 1043393824 /nfs/dbraw/zinc/39/38/24/1043393824.db2.gz PYPVXQBJVDMYLP-UHFFFAOYSA-N 1 2 322.408 4.346 20 0 DIADLO COc1ccc2cc(C[N@@H+](C)Cc3ncc(C4CC4)o3)ccc2c1 ZINC000270628388 1043393837 /nfs/dbraw/zinc/39/38/37/1043393837.db2.gz PYPVXQBJVDMYLP-UHFFFAOYSA-N 1 2 322.408 4.346 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1cnc([C@@H]2CCCO2)s1 ZINC000271023536 1043400626 /nfs/dbraw/zinc/40/06/26/1043400626.db2.gz DIOAPFILGIOMHN-RISCZKNCSA-N 1 2 320.483 4.175 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1cnc([C@@H]2CCCO2)s1 ZINC000271023536 1043400636 /nfs/dbraw/zinc/40/06/36/1043400636.db2.gz DIOAPFILGIOMHN-RISCZKNCSA-N 1 2 320.483 4.175 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@H]1CC2(CCC2)Oc2ccccc21 ZINC000925270118 1043405875 /nfs/dbraw/zinc/40/58/75/1043405875.db2.gz RRFBQEZDVCFLCF-HOTGVXAUSA-N 1 2 324.424 4.397 20 0 DIADLO CC(C)c1csc(C[NH2+][C@H]2CCc3c2nccc3Cl)n1 ZINC000925283298 1043406122 /nfs/dbraw/zinc/40/61/22/1043406122.db2.gz PZKWZPPWHPROHF-LBPRGKRZSA-N 1 2 307.850 4.092 20 0 DIADLO CC(C)c1csc(C[NH2+][C@@H](C)c2cnn(C3CCC3)c2)n1 ZINC000925284025 1043407433 /nfs/dbraw/zinc/40/74/33/1043407433.db2.gz VUAXOJFSKVYZJB-LBPRGKRZSA-N 1 2 304.463 4.039 20 0 DIADLO CC(C)c1csc(C[NH2+][C@H](C)c2cnn(C3CCC3)c2)n1 ZINC000925284023 1043407775 /nfs/dbraw/zinc/40/77/75/1043407775.db2.gz VUAXOJFSKVYZJB-GFCCVEGCSA-N 1 2 304.463 4.039 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1ccc(Cl)cc1Cl ZINC000271430955 1043416826 /nfs/dbraw/zinc/41/68/26/1043416826.db2.gz BBZBJDSPYTUQOC-LKFCYVNXSA-N 1 2 310.228 4.445 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1ccc(Cl)cc1Cl ZINC000271430955 1043416833 /nfs/dbraw/zinc/41/68/33/1043416833.db2.gz BBZBJDSPYTUQOC-LKFCYVNXSA-N 1 2 310.228 4.445 20 0 DIADLO COc1ccc(Cl)cc1[C@@H](C)[NH2+][C@H](C)c1nnc(C(C)C)[nH]1 ZINC000271431696 1043417022 /nfs/dbraw/zinc/41/70/22/1043417022.db2.gz DGRSQNJPAIDYLN-GHMZBOCLSA-N 1 2 322.840 4.002 20 0 DIADLO C[C@@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1ccc(Cl)s1 ZINC000271425289 1043417515 /nfs/dbraw/zinc/41/75/15/1043417515.db2.gz CRKNOFPMBFMCDD-KCJUWKMLSA-N 1 2 317.788 4.064 20 0 DIADLO Cc1ccc(-c2csc(CO[NH+]=C(N)c3ccccc3)n2)cc1 ZINC000795197064 1043418721 /nfs/dbraw/zinc/41/87/21/1043418721.db2.gz KNTCFMXOUXRHNS-UHFFFAOYSA-N 1 2 323.421 4.165 20 0 DIADLO CC[C@@H]([NH2+][C@H]1CCCc2oc(C)nc21)c1cc(F)ccc1F ZINC000925453648 1043419562 /nfs/dbraw/zinc/41/95/62/1043419562.db2.gz OLVMJHWSJIUIFR-CABCVRRESA-N 1 2 306.356 4.380 20 0 DIADLO CCc1cccc2c1OCC[C@@H]2[NH2+][C@@H](C)c1csc(C)n1 ZINC000271458614 1043421707 /nfs/dbraw/zinc/42/17/07/1043421707.db2.gz JQKNRJYUFMQFPW-NHYWBVRUSA-N 1 2 302.443 4.188 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1cc(O)ccc1F ZINC000872025594 1043422783 /nfs/dbraw/zinc/42/27/83/1043422783.db2.gz PPNMAVIWYVCMDW-WDEREUQCSA-N 1 2 307.340 4.091 20 0 DIADLO Clc1ccnc2c1CC[C@@H]2[NH2+][C@H]1COc2c1cccc2Cl ZINC000925519466 1043422896 /nfs/dbraw/zinc/42/28/96/1043422896.db2.gz RLLPTNWTDJHLRE-KBPBESRZSA-N 1 2 321.207 4.099 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+][C@H](C)c1cccc(O)c1F ZINC000872024393 1043423187 /nfs/dbraw/zinc/42/31/87/1043423187.db2.gz AGCHUWBHGZQBRZ-MNOVXSKESA-N 1 2 307.340 4.091 20 0 DIADLO Clc1ccnc2c1CC[C@H]2[NH2+][C@H]1COc2c1cccc2Cl ZINC000925519467 1043424688 /nfs/dbraw/zinc/42/46/88/1043424688.db2.gz RLLPTNWTDJHLRE-KGLIPLIRSA-N 1 2 321.207 4.099 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H](C)c1nnc(C(C)C)[nH]1 ZINC000271593489 1043441123 /nfs/dbraw/zinc/44/11/23/1043441123.db2.gz YPQFEHLYUWIACY-QWHCGFSZSA-N 1 2 312.417 4.395 20 0 DIADLO Cc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCCC2)n1 ZINC000271667583 1043447170 /nfs/dbraw/zinc/44/71/70/1043447170.db2.gz FVGNBONHPPKDHD-INIZCTEOSA-N 1 2 305.809 4.053 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2F)n1 ZINC000271689842 1043449730 /nfs/dbraw/zinc/44/97/30/1043449730.db2.gz QQTQCTJBOJQLHT-LBPRGKRZSA-N 1 2 307.388 4.373 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1cccc(O)c1F)c1cccc(Cl)c1 ZINC000872072356 1043450203 /nfs/dbraw/zinc/45/02/03/1043450203.db2.gz CTOMWFIRBQZLJJ-NHYWBVRUSA-N 1 2 323.795 4.223 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(C(F)(F)F)n[nH]2)s1 ZINC000442891388 1043450937 /nfs/dbraw/zinc/45/09/37/1043450937.db2.gz RIUOBWOJCNNSKU-LLVKDONJSA-N 1 2 315.364 4.136 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc(C(F)(F)F)n[nH]2)s1 ZINC000442891388 1043450944 /nfs/dbraw/zinc/45/09/44/1043450944.db2.gz RIUOBWOJCNNSKU-LLVKDONJSA-N 1 2 315.364 4.136 20 0 DIADLO CCOc1cccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)n1 ZINC000558184336 1043453168 /nfs/dbraw/zinc/45/31/68/1043453168.db2.gz QMURDZANWMYOCN-MRXNPFEDSA-N 1 2 302.443 4.125 20 0 DIADLO CCOc1cccc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)n1 ZINC000558184336 1043453173 /nfs/dbraw/zinc/45/31/73/1043453173.db2.gz QMURDZANWMYOCN-MRXNPFEDSA-N 1 2 302.443 4.125 20 0 DIADLO CCCc1nc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)cs1 ZINC000113505973 1043454586 /nfs/dbraw/zinc/45/45/86/1043454586.db2.gz ISJWVOPVNWSHDR-UHFFFAOYSA-N 1 2 316.470 4.213 20 0 DIADLO CCCc1nc(C[N@H+](Cc2cccc(O)c2)CC2CC2)cs1 ZINC000113505973 1043454591 /nfs/dbraw/zinc/45/45/91/1043454591.db2.gz ISJWVOPVNWSHDR-UHFFFAOYSA-N 1 2 316.470 4.213 20 0 DIADLO CC(C)c1ccc([C@@H](C)[NH2+]Cc2nnc(-c3ccccc3)[nH]2)cc1 ZINC000777574141 1043460807 /nfs/dbraw/zinc/46/08/07/1043460807.db2.gz HFTYOUUUOISFQH-OAHLLOKOSA-N 1 2 320.440 4.446 20 0 DIADLO Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]Cc1ncc(Cl)s1 ZINC000872115089 1043464883 /nfs/dbraw/zinc/46/48/83/1043464883.db2.gz GSTHDUKLSKQZPO-LBPRGKRZSA-N 1 2 308.834 4.108 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(F)(F)F)cc(Cl)n1)c1ccco1 ZINC000872116853 1043465504 /nfs/dbraw/zinc/46/55/04/1043465504.db2.gz ORHQVYQRNHQOIB-QMMMGPOBSA-N 1 2 304.699 4.198 20 0 DIADLO CC(C)n1cc([C@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)cn1 ZINC000348796606 1043468151 /nfs/dbraw/zinc/46/81/51/1043468151.db2.gz DSTZHHHVEPUWLM-HNNXBMFYSA-N 1 2 313.449 4.022 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+]Cc1nc(-c2ccncc2)cs1 ZINC000872122695 1043469410 /nfs/dbraw/zinc/46/94/10/1043469410.db2.gz XWHXHCABUFGGTQ-ZDUSSCGKSA-N 1 2 324.453 4.013 20 0 DIADLO Cc1nccnc1[C@@H](C)[NH2+][C@H](C)c1csc(-c2ccccc2)n1 ZINC000872131693 1043472725 /nfs/dbraw/zinc/47/27/25/1043472725.db2.gz ZPEFAIUMNNQMMX-TZMCWYRMSA-N 1 2 324.453 4.320 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)C[N@H+](Cc1ccco1)C(C)C ZINC000521814145 1043476379 /nfs/dbraw/zinc/47/63/79/1043476379.db2.gz KTNVOPFIQMOKTJ-UHFFFAOYSA-N 1 2 320.820 4.091 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)C[N@@H+](Cc1ccco1)C(C)C ZINC000521814145 1043476382 /nfs/dbraw/zinc/47/63/82/1043476382.db2.gz KTNVOPFIQMOKTJ-UHFFFAOYSA-N 1 2 320.820 4.091 20 0 DIADLO CC(C)CCn1cccc1C[N@H+](C)Cc1cnc(C(C)C)nc1 ZINC000443067578 1043477737 /nfs/dbraw/zinc/47/77/37/1043477737.db2.gz MCQBUDHUNOZUHE-UHFFFAOYSA-N 1 2 314.477 4.080 20 0 DIADLO CC(C)CCn1cccc1C[N@@H+](C)Cc1cnc(C(C)C)nc1 ZINC000443067578 1043477746 /nfs/dbraw/zinc/47/77/46/1043477746.db2.gz MCQBUDHUNOZUHE-UHFFFAOYSA-N 1 2 314.477 4.080 20 0 DIADLO C[C@H]1CCc2nc(C[N@@H+]3CCC[C@@H]3c3cccnc3)sc2C1 ZINC000348894693 1043478459 /nfs/dbraw/zinc/47/84/59/1043478459.db2.gz OTJMEGKOFVVQLC-XJKSGUPXSA-N 1 2 313.470 4.000 20 0 DIADLO C[C@H]1CCc2nc(C[N@H+]3CCC[C@@H]3c3cccnc3)sc2C1 ZINC000348894693 1043478463 /nfs/dbraw/zinc/47/84/63/1043478463.db2.gz OTJMEGKOFVVQLC-XJKSGUPXSA-N 1 2 313.470 4.000 20 0 DIADLO C[C@H]([NH2+]Cc1cocn1)c1ccccc1SC(F)(F)F ZINC000925869339 1043485013 /nfs/dbraw/zinc/48/50/13/1043485013.db2.gz JTFFSGISZQPICR-VIFPVBQESA-N 1 2 302.321 4.137 20 0 DIADLO CCC[C@@H](C)c1noc([C@@H]([NH3+])c2cccc(C(F)(F)F)c2)n1 ZINC000872174827 1043485177 /nfs/dbraw/zinc/48/51/77/1043485177.db2.gz DTHREISDRNKNJH-SKDRFNHKSA-N 1 2 313.323 4.040 20 0 DIADLO CCC[C@H](C)c1noc([C@H]([NH3+])c2cccc(C(F)(F)F)c2)n1 ZINC000872174826 1043485674 /nfs/dbraw/zinc/48/56/74/1043485674.db2.gz DTHREISDRNKNJH-JOYOIKCWSA-N 1 2 313.323 4.040 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2nnc(-c3ccccc3)[nH]2)C2CC2)cc1 ZINC000777578990 1043489376 /nfs/dbraw/zinc/48/93/76/1043489376.db2.gz PHXXKJUGJSGCQP-LJQANCHMSA-N 1 2 318.424 4.021 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1C[N@H+](Cc1ccccn1)C1CC1 ZINC000349280061 1043499988 /nfs/dbraw/zinc/49/99/88/1043499988.db2.gz PHFHVPVXOBJWPF-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1C[N@@H+](Cc1ccccn1)C1CC1 ZINC000349280061 1043499995 /nfs/dbraw/zinc/49/99/95/1043499995.db2.gz PHFHVPVXOBJWPF-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Br)c(F)c2)CCC1(F)F ZINC000558467450 1043514913 /nfs/dbraw/zinc/51/49/13/1043514913.db2.gz REMTVYXLUMWDHS-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Br)c(F)c2)CCC1(F)F ZINC000558467450 1043514927 /nfs/dbraw/zinc/51/49/27/1043514927.db2.gz REMTVYXLUMWDHS-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](C)Cc2cnn(-c3ccccc3)c2)o1 ZINC000349642260 1043516422 /nfs/dbraw/zinc/51/64/22/1043516422.db2.gz PTUKZFCHCROEKE-BEFAXECRSA-N 1 2 321.424 4.221 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)o1 ZINC000349642260 1043516429 /nfs/dbraw/zinc/51/64/29/1043516429.db2.gz PTUKZFCHCROEKE-BEFAXECRSA-N 1 2 321.424 4.221 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1cnn(C2CCC2)c1 ZINC000926067461 1043517462 /nfs/dbraw/zinc/51/74/62/1043517462.db2.gz WROGZRUVQXJFTA-CQSZACIVSA-N 1 2 310.445 4.164 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1cnn(C2CCC2)c1 ZINC000926067461 1043517474 /nfs/dbraw/zinc/51/74/74/1043517474.db2.gz WROGZRUVQXJFTA-CQSZACIVSA-N 1 2 310.445 4.164 20 0 DIADLO CCc1cccc2cc(C[NH2+]Cc3ncc(Cl)s3)oc21 ZINC000873164280 1043521256 /nfs/dbraw/zinc/52/12/56/1043521256.db2.gz FWSHFNBPDPXYJK-UHFFFAOYSA-N 1 2 306.818 4.395 20 0 DIADLO CC1(C)CCc2onc(C[NH2+]Cc3nccc4ccccc43)c2C1 ZINC000873174176 1043522352 /nfs/dbraw/zinc/52/23/52/1043522352.db2.gz CPEIKWYXNXMYNS-UHFFFAOYSA-N 1 2 321.424 4.028 20 0 DIADLO Cc1nccnc1[C@H](C)[NH2+]Cc1csc(Cl)c1Cl ZINC000873186485 1043526100 /nfs/dbraw/zinc/52/61/00/1043526100.db2.gz BOIHYWSAKGJGDT-QMMMGPOBSA-N 1 2 302.230 4.004 20 0 DIADLO COCc1nc(C[N@H+]([C@@H](C)c2ccccc2)C2CC2)cs1 ZINC000349941551 1043531023 /nfs/dbraw/zinc/53/10/23/1043531023.db2.gz ARCRCLQRGAIXRO-ZDUSSCGKSA-N 1 2 302.443 4.015 20 0 DIADLO COCc1nc(C[N@@H+]([C@@H](C)c2ccccc2)C2CC2)cs1 ZINC000349941551 1043531032 /nfs/dbraw/zinc/53/10/32/1043531032.db2.gz ARCRCLQRGAIXRO-ZDUSSCGKSA-N 1 2 302.443 4.015 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)[C@H](C)c1ccccc1F ZINC000349916403 1043531417 /nfs/dbraw/zinc/53/14/17/1043531417.db2.gz REZDEQXCMFRMSY-GFCCVEGCSA-N 1 2 303.406 4.036 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)[C@H](C)c1ccccc1F ZINC000349916403 1043531428 /nfs/dbraw/zinc/53/14/28/1043531428.db2.gz REZDEQXCMFRMSY-GFCCVEGCSA-N 1 2 303.406 4.036 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+]C(c1ccccc1C)c1ccccc1C ZINC000926169672 1043538743 /nfs/dbraw/zinc/53/87/43/1043538743.db2.gz OBOYEWDGXXQLTP-OAHLLOKOSA-N 1 2 321.424 4.435 20 0 DIADLO FC(F)(F)c1ccc(C2([NH2+]Cc3nccn3C3CC3)CC2)cc1 ZINC000895189196 1043555326 /nfs/dbraw/zinc/55/53/26/1043555326.db2.gz WXNQAOVOHKAJJJ-UHFFFAOYSA-N 1 2 321.346 4.016 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2c2nc3ccc(F)cc3s2)[nH+]c1C ZINC000895198142 1043560261 /nfs/dbraw/zinc/56/02/61/1043560261.db2.gz YRJYJNNNYILXBT-ZDUSSCGKSA-N 1 2 316.405 4.117 20 0 DIADLO C[C@@H](Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)c1ncco1 ZINC000926293446 1043560257 /nfs/dbraw/zinc/56/02/57/1043560257.db2.gz MSEQDCICTGTQQL-CYBMUJFWSA-N 1 2 308.385 4.048 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2c2nc3cccc(F)c3s2)[nH+]c1C ZINC000895196315 1043560634 /nfs/dbraw/zinc/56/06/34/1043560634.db2.gz KOSNEWWSWFZJCY-ZDUSSCGKSA-N 1 2 316.405 4.117 20 0 DIADLO CCC(CC)Oc1ccc(C(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001274961611 1043563162 /nfs/dbraw/zinc/56/31/62/1043563162.db2.gz SWDRDDQQYSBENO-UHFFFAOYSA-N 1 2 323.396 4.154 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2csc(C(F)(F)F)c2)s1 ZINC000926462451 1043579812 /nfs/dbraw/zinc/57/98/12/1043579812.db2.gz YCUVMJGBVRZFGA-ZETCQYMHSA-N 1 2 321.393 4.032 20 0 DIADLO CCC[C@@H]([NH2+]Cc1c(C)onc1CC)c1ncccc1Cl ZINC000926482857 1043585405 /nfs/dbraw/zinc/58/54/05/1043585405.db2.gz RLVIUNAOBQOGAY-OAHLLOKOSA-N 1 2 307.825 4.225 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C2CC2)ccc1F)c1cn2c(n1)CCCC2 ZINC000926503060 1043588698 /nfs/dbraw/zinc/58/86/98/1043588698.db2.gz RZNBSTDCKKZASC-ZDUSSCGKSA-N 1 2 313.420 4.087 20 0 DIADLO CCc1ncc(C[NH2+][C@@H](c2cccnc2)c2cc(C)cc(C)c2)o1 ZINC000926540806 1043597080 /nfs/dbraw/zinc/59/70/80/1043597080.db2.gz MOAOEANIKZDSGW-FQEVSTJZSA-N 1 2 321.424 4.128 20 0 DIADLO CCCc1ncc(C[NH2+][C@H](c2ccc(C)cc2)c2cccnc2)o1 ZINC000926536693 1043597182 /nfs/dbraw/zinc/59/71/82/1043597182.db2.gz GYLPTZFRXDHNCS-HXUWFJFHSA-N 1 2 321.424 4.210 20 0 DIADLO Oc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2F)cc1 ZINC000353454807 1043609397 /nfs/dbraw/zinc/60/93/97/1043609397.db2.gz MCFPYDLBAMWIGL-UHFFFAOYSA-N 1 2 311.356 4.327 20 0 DIADLO Oc1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2F)cc1 ZINC000353454807 1043609400 /nfs/dbraw/zinc/60/94/00/1043609400.db2.gz MCFPYDLBAMWIGL-UHFFFAOYSA-N 1 2 311.356 4.327 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]C2(c3ccccc3Cl)CCC2)nn1 ZINC000926643425 1043612376 /nfs/dbraw/zinc/61/23/76/1043612376.db2.gz SSJYZWSLTQPNBZ-CYBMUJFWSA-N 1 2 318.852 4.242 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+]2CC[C@@H]2c2ccccc2)s1 ZINC000353536305 1043613117 /nfs/dbraw/zinc/61/31/17/1043613117.db2.gz ZXNJRDNWOBWSHW-GFCCVEGCSA-N 1 2 312.360 4.417 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+]2CC[C@@H]2c2ccccc2)s1 ZINC000353536305 1043613119 /nfs/dbraw/zinc/61/31/19/1043613119.db2.gz ZXNJRDNWOBWSHW-GFCCVEGCSA-N 1 2 312.360 4.417 20 0 DIADLO Fc1cccc2c1CC[N@H+](Cc1cnc(C3CCC3)s1)C2 ZINC000353541856 1043615480 /nfs/dbraw/zinc/61/54/80/1043615480.db2.gz JCYQGAMWVVRZHU-UHFFFAOYSA-N 1 2 302.418 4.108 20 0 DIADLO Fc1cccc2c1CC[N@@H+](Cc1cnc(C3CCC3)s1)C2 ZINC000353541856 1043615482 /nfs/dbraw/zinc/61/54/82/1043615482.db2.gz JCYQGAMWVVRZHU-UHFFFAOYSA-N 1 2 302.418 4.108 20 0 DIADLO Cc1noc([C@H]2CCC[N@H+]2Cc2ccc(SC(C)C)cc2)n1 ZINC000353540781 1043615497 /nfs/dbraw/zinc/61/54/97/1043615497.db2.gz FVFXVFYDXPNCOV-MRXNPFEDSA-N 1 2 317.458 4.216 20 0 DIADLO Cc1noc([C@H]2CCC[N@@H+]2Cc2ccc(SC(C)C)cc2)n1 ZINC000353540781 1043615502 /nfs/dbraw/zinc/61/55/02/1043615502.db2.gz FVFXVFYDXPNCOV-MRXNPFEDSA-N 1 2 317.458 4.216 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)n1 ZINC000443613000 1043617577 /nfs/dbraw/zinc/61/75/77/1043617577.db2.gz GTUXBWQPROCHJW-AWEZNQCLSA-N 1 2 316.392 4.484 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)n1 ZINC000443613000 1043617587 /nfs/dbraw/zinc/61/75/87/1043617587.db2.gz GTUXBWQPROCHJW-AWEZNQCLSA-N 1 2 316.392 4.484 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+][C@@H](C)c2nc(-c3ccncc3)cs2)c1 ZINC000353617055 1043624989 /nfs/dbraw/zinc/62/49/89/1043624989.db2.gz CPSLPKDNHWSOND-KGLIPLIRSA-N 1 2 324.453 4.320 20 0 DIADLO COc1cc(F)c([C@H](C)Nc2ccc([NH+](C)C)cc2)cc1OC ZINC000777604211 1043625072 /nfs/dbraw/zinc/62/50/72/1043625072.db2.gz HMYGIQRTAAHXJZ-LBPRGKRZSA-N 1 2 318.392 4.082 20 0 DIADLO C[C@@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1ccnn1CC1CCC1 ZINC000926810740 1043635244 /nfs/dbraw/zinc/63/52/44/1043635244.db2.gz WQSQBDZKHOEORN-CXAGYDPISA-N 1 2 319.399 4.184 20 0 DIADLO CCn1ccnc1C[N@@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000353743233 1043639395 /nfs/dbraw/zinc/63/93/95/1043639395.db2.gz BXWDHKVOIYGBAC-FQEVSTJZSA-N 1 2 317.436 4.203 20 0 DIADLO CCn1ccnc1C[N@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000353743233 1043639401 /nfs/dbraw/zinc/63/94/01/1043639401.db2.gz BXWDHKVOIYGBAC-FQEVSTJZSA-N 1 2 317.436 4.203 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1ccc(C(F)(F)F)s1 ZINC000926823040 1043640067 /nfs/dbraw/zinc/64/00/67/1043640067.db2.gz FKLGKOOLBHHMRL-JTQLQIEISA-N 1 2 316.348 4.231 20 0 DIADLO Clc1sc(CNc2cccc[nH+]2)cc1Br ZINC000191516400 1043654418 /nfs/dbraw/zinc/65/44/18/1043654418.db2.gz GNUXRTUOAXUMDE-UHFFFAOYSA-N 1 2 303.612 4.171 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cnn(C2CCCC2)c1 ZINC000353927903 1043659117 /nfs/dbraw/zinc/65/91/17/1043659117.db2.gz WYFKWAZMBYNEHG-RYUDHWBXSA-N 1 2 320.387 4.083 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H]2CCCc3cccnc32)cs1 ZINC000927060966 1043675824 /nfs/dbraw/zinc/67/58/24/1043675824.db2.gz HTBQKMRDXLBFPY-TZMCWYRMSA-N 1 2 301.459 4.390 20 0 DIADLO CCCCC[C@H](C)CC(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927090008 1043683688 /nfs/dbraw/zinc/68/36/88/1043683688.db2.gz SFWKGXAQVDLUJD-INIZCTEOSA-N 1 2 317.477 4.091 20 0 DIADLO Cc1cccc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)c1 ZINC000354122875 1043684740 /nfs/dbraw/zinc/68/47/40/1043684740.db2.gz PQKVTYABGRCVTD-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO CCCCC[C@@H](CC)C(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927087571 1043685142 /nfs/dbraw/zinc/68/51/42/1043685142.db2.gz SKERTNOQUAIGGD-MRXNPFEDSA-N 1 2 317.477 4.091 20 0 DIADLO CC[C@@H](C)CCC(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000354324302 1043693697 /nfs/dbraw/zinc/69/36/97/1043693697.db2.gz MJGMKPLHWYVELU-OAHLLOKOSA-N 1 2 323.440 4.367 20 0 DIADLO Fc1cccc(-c2noc([C@@H]3CCC[C@H](c4ccccc4)[NH2+]3)n2)c1 ZINC001211883601 1043695546 /nfs/dbraw/zinc/69/55/46/1043695546.db2.gz BAGUDYVVGRFMTC-SJORKVTESA-N 1 2 323.371 4.432 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2ccc(Cl)nn2)C2CC2)o1 ZINC000876570201 1043696778 /nfs/dbraw/zinc/69/67/78/1043696778.db2.gz WMAHIWFAIOFOQR-ABAIWWIYSA-N 1 2 317.820 4.011 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2ccc(Cl)nn2)C2CC2)o1 ZINC000876570201 1043696787 /nfs/dbraw/zinc/69/67/87/1043696787.db2.gz WMAHIWFAIOFOQR-ABAIWWIYSA-N 1 2 317.820 4.011 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C/C=C\c3ccc(F)cc3)cc2[nH+]1 ZINC000354326213 1043697051 /nfs/dbraw/zinc/69/70/51/1043697051.db2.gz CDZNYJBCIXIZTJ-IHWYPQMZSA-N 1 2 309.344 4.052 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2ccc(Cl)nn2)o1 ZINC000876797491 1043710133 /nfs/dbraw/zinc/71/01/33/1043710133.db2.gz RDJKEVOIPDVPTN-RISCZKNCSA-N 1 2 305.809 4.005 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2ccc(Cl)nn2)o1 ZINC000876797491 1043710143 /nfs/dbraw/zinc/71/01/43/1043710143.db2.gz RDJKEVOIPDVPTN-RISCZKNCSA-N 1 2 305.809 4.005 20 0 DIADLO Cc1ccncc1C[N@@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000474275200 1043717272 /nfs/dbraw/zinc/71/72/72/1043717272.db2.gz HIGDDOZLZOPFBQ-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccncc1C[N@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000474275200 1043717281 /nfs/dbraw/zinc/71/72/81/1043717281.db2.gz HIGDDOZLZOPFBQ-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@H+](Cc3nccn3C(C)C)CC2)c1 ZINC000354824216 1043720990 /nfs/dbraw/zinc/72/09/90/1043720990.db2.gz BAGRCVIJKDCQTQ-UHFFFAOYSA-N 1 2 309.457 4.370 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@@H+](Cc3nccn3C(C)C)CC2)c1 ZINC000354824216 1043721005 /nfs/dbraw/zinc/72/10/05/1043721005.db2.gz BAGRCVIJKDCQTQ-UHFFFAOYSA-N 1 2 309.457 4.370 20 0 DIADLO COc1c(C)c[nH+]c(CNc2cc(-c3ncco3)ccc2C)c1C ZINC000876872092 1043721303 /nfs/dbraw/zinc/72/13/03/1043721303.db2.gz ZZADTQIADOMGBE-UHFFFAOYSA-N 1 2 323.396 4.283 20 0 DIADLO Fc1ccc(-c2ccc(C[NH2+]Cc3cc(C4CC4)no3)o2)cc1 ZINC000876922959 1043724073 /nfs/dbraw/zinc/72/40/73/1043724073.db2.gz NIMKPVVUKOAUTG-UHFFFAOYSA-N 1 2 312.344 4.241 20 0 DIADLO C[C@@H](CSC(C)(C)C)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000777644965 1043725358 /nfs/dbraw/zinc/72/53/58/1043725358.db2.gz BHUTXZIWSBRSNR-LBPRGKRZSA-N 1 2 307.438 4.344 20 0 DIADLO Cc1cc(N[C@@H]2CCc3c2c(F)ccc3F)ccc1[NH+](C)C ZINC000777643146 1043725478 /nfs/dbraw/zinc/72/54/78/1043725478.db2.gz JHTAGSPVYXKQJX-MRXNPFEDSA-N 1 2 302.368 4.439 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccccc1N(C)C ZINC000777652655 1043727867 /nfs/dbraw/zinc/72/78/67/1043727867.db2.gz AAULZOVGGNYURU-OAHLLOKOSA-N 1 2 309.457 4.308 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccccc1N(C)C ZINC000777652655 1043727877 /nfs/dbraw/zinc/72/78/77/1043727877.db2.gz AAULZOVGGNYURU-OAHLLOKOSA-N 1 2 309.457 4.308 20 0 DIADLO CC(C)COc1ccccc1C[NH2+]Cc1nc(Cl)cs1 ZINC000876957604 1043729242 /nfs/dbraw/zinc/72/92/42/1043729242.db2.gz DOZGIQHMHMZNME-UHFFFAOYSA-N 1 2 310.850 4.121 20 0 DIADLO CCSCc1ccc[nH+]c1N[C@@H]1CCOC2(CCCC2)C1 ZINC000895689351 1043732652 /nfs/dbraw/zinc/73/26/52/1043732652.db2.gz RCSHLUQECXEXON-OAHLLOKOSA-N 1 2 306.475 4.238 20 0 DIADLO c1csc(C[C@@H]2CCCN(c3[nH+]ccc4ccccc43)C2)n1 ZINC000895683082 1043734842 /nfs/dbraw/zinc/73/48/42/1043734842.db2.gz RDYBSADIJIYASP-AWEZNQCLSA-N 1 2 309.438 4.150 20 0 DIADLO c1csc(C[C@H]2CCCN(c3[nH+]ccc4ccccc43)C2)n1 ZINC000895683083 1043735088 /nfs/dbraw/zinc/73/50/88/1043735088.db2.gz RDYBSADIJIYASP-CQSZACIVSA-N 1 2 309.438 4.150 20 0 DIADLO Clc1csc(C[NH2+]Cc2ccccc2OC2CCC2)n1 ZINC000877037263 1043735630 /nfs/dbraw/zinc/73/56/30/1043735630.db2.gz YXVNFGZIJXMJJE-UHFFFAOYSA-N 1 2 308.834 4.018 20 0 DIADLO CC(C)([NH2+]Cc1nc(Cl)cs1)c1ccc(F)c(F)c1 ZINC000877077606 1043739536 /nfs/dbraw/zinc/73/95/36/1043739536.db2.gz OMOTZCSQVZFWBT-UHFFFAOYSA-N 1 2 302.777 4.100 20 0 DIADLO Fc1cc(Cl)cc(Br)c1C[N@@H+]1CCCC12CC2 ZINC001141837935 1043741796 /nfs/dbraw/zinc/74/17/96/1043741796.db2.gz VKUGTPLIJAUJGJ-UHFFFAOYSA-N 1 2 318.617 4.370 20 0 DIADLO Fc1cc(Cl)cc(Br)c1C[N@H+]1CCCC12CC2 ZINC001141837935 1043741816 /nfs/dbraw/zinc/74/18/16/1043741816.db2.gz VKUGTPLIJAUJGJ-UHFFFAOYSA-N 1 2 318.617 4.370 20 0 DIADLO C[C@H]([NH2+]Cc1nc2ccccc2s1)c1nc2c(s1)CCC2 ZINC000355121585 1043744054 /nfs/dbraw/zinc/74/40/54/1043744054.db2.gz NTXCHSLKELBIOK-JTQLQIEISA-N 1 2 315.467 4.092 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)[NH2+]c1ccc2c(c1)CCCN2C ZINC000877160258 1043751761 /nfs/dbraw/zinc/75/17/61/1043751761.db2.gz UKRRYIDFFCDEMX-PEBXRYMYSA-N 1 2 324.405 4.204 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)Nc1ccc2c(c1)CCC[N@H+]2C ZINC000877160258 1043751771 /nfs/dbraw/zinc/75/17/71/1043751771.db2.gz UKRRYIDFFCDEMX-PEBXRYMYSA-N 1 2 324.405 4.204 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)Nc1ccc2c(c1)CCC[N@@H+]2C ZINC000877160258 1043751790 /nfs/dbraw/zinc/75/17/90/1043751790.db2.gz UKRRYIDFFCDEMX-PEBXRYMYSA-N 1 2 324.405 4.204 20 0 DIADLO Clc1ccc2sc(C[N@@H+]3CCC[C@H]3c3ncc[nH]3)cc2n1 ZINC000877344023 1043756958 /nfs/dbraw/zinc/75/69/58/1043756958.db2.gz CHNOJXBDSIDUQK-LBPRGKRZSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1ccc2sc(C[N@H+]3CCC[C@H]3c3ncc[nH]3)cc2n1 ZINC000877344023 1043756973 /nfs/dbraw/zinc/75/69/73/1043756973.db2.gz CHNOJXBDSIDUQK-LBPRGKRZSA-N 1 2 318.833 4.010 20 0 DIADLO Cc1[nH+]cc(CN(C)c2ccc3cc[nH]c3c2)n1-c1ccccc1 ZINC000355284822 1043757278 /nfs/dbraw/zinc/75/72/78/1043757278.db2.gz DLCJFPPPQQUKFY-UHFFFAOYSA-N 1 2 316.408 4.298 20 0 DIADLO CC(C)=CCC[C@@H](C)[NH2+]c1ccc(N2CCO[C@@H](C)C2)cc1 ZINC000777693859 1043760407 /nfs/dbraw/zinc/76/04/07/1043760407.db2.gz NWKVBUQMBGTGIZ-SJORKVTESA-N 1 2 302.462 4.459 20 0 DIADLO CC1(C)Cc2cc(CNc3ccc(-n4cc[nH+]c4)cc3)ccc2O1 ZINC000355334995 1043761830 /nfs/dbraw/zinc/76/18/30/1043761830.db2.gz NBVKHHHLLRQOSH-UHFFFAOYSA-N 1 2 319.408 4.198 20 0 DIADLO C(=C/c1ccc(-n2cc[nH+]c2)cc1)\c1nc(CC2=CCCC2)no1 ZINC000355439370 1043768696 /nfs/dbraw/zinc/76/86/96/1043768696.db2.gz JXNZWFGEXLKHPN-JXMROGBWSA-N 1 2 318.380 4.079 20 0 DIADLO C[C@@H]([NH2+]Cc1ccns1)c1ccc(C(F)(F)F)nc1Cl ZINC000877551271 1043775099 /nfs/dbraw/zinc/77/50/99/1043775099.db2.gz XZTPTCPFVGRSCO-SSDOTTSWSA-N 1 2 321.755 4.061 20 0 DIADLO Clc1cc(Cl)cc(C2=CC[N@H+](Cc3cc[nH]n3)CC2)c1 ZINC001137124215 1043779924 /nfs/dbraw/zinc/77/99/24/1043779924.db2.gz WJAKVJVVZLECNR-UHFFFAOYSA-N 1 2 308.212 4.006 20 0 DIADLO Clc1cc(Cl)cc(C2=CC[N@@H+](Cc3cc[nH]n3)CC2)c1 ZINC001137124215 1043779928 /nfs/dbraw/zinc/77/99/28/1043779928.db2.gz WJAKVJVVZLECNR-UHFFFAOYSA-N 1 2 308.212 4.006 20 0 DIADLO Fc1ccc2occ(C[N@@H+]3CCC[C@@H]3c3nccs3)c2c1 ZINC001141854796 1043781893 /nfs/dbraw/zinc/78/18/93/1043781893.db2.gz PWWUJFGGBMIZMH-CQSZACIVSA-N 1 2 302.374 4.366 20 0 DIADLO Fc1ccc2occ(C[N@H+]3CCC[C@@H]3c3nccs3)c2c1 ZINC001141854796 1043781907 /nfs/dbraw/zinc/78/19/07/1043781907.db2.gz PWWUJFGGBMIZMH-CQSZACIVSA-N 1 2 302.374 4.366 20 0 DIADLO C[C@@H](CC(C)(C)C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000355648776 1043783587 /nfs/dbraw/zinc/78/35/87/1043783587.db2.gz JQRQUCZWIOCHCT-LBPRGKRZSA-N 1 2 303.381 4.022 20 0 DIADLO Cc1scc(C[N@@H+]2CCc3c(ncn3-c3ccccc3)C2)c1C ZINC000929065796 1043789649 /nfs/dbraw/zinc/78/96/49/1043789649.db2.gz VZGHHMNFXAPGIF-UHFFFAOYSA-N 1 2 323.465 4.109 20 0 DIADLO Cc1scc(C[N@H+]2CCc3c(ncn3-c3ccccc3)C2)c1C ZINC000929065796 1043789656 /nfs/dbraw/zinc/78/96/56/1043789656.db2.gz VZGHHMNFXAPGIF-UHFFFAOYSA-N 1 2 323.465 4.109 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)[C@H](C)c1snnc1C ZINC000929131614 1043794281 /nfs/dbraw/zinc/79/42/81/1043794281.db2.gz YOPZUDMOIKVPMV-SECBINFHSA-N 1 2 301.868 4.145 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)[C@H](C)c1snnc1C ZINC000929131614 1043794286 /nfs/dbraw/zinc/79/42/86/1043794286.db2.gz YOPZUDMOIKVPMV-SECBINFHSA-N 1 2 301.868 4.145 20 0 DIADLO Cc1nnsc1[C@@H](C)[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000929231662 1043801588 /nfs/dbraw/zinc/80/15/88/1043801588.db2.gz JIYIUOUIRMTHQH-SECBINFHSA-N 1 2 316.257 4.346 20 0 DIADLO Cc1nnsc1[C@@H](C)[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000929231662 1043801610 /nfs/dbraw/zinc/80/16/10/1043801610.db2.gz JIYIUOUIRMTHQH-SECBINFHSA-N 1 2 316.257 4.346 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1ccc(C(F)(F)F)nc1 ZINC000877827819 1043804927 /nfs/dbraw/zinc/80/49/27/1043804927.db2.gz SYJVICFWXHGLFH-SNVBAGLBSA-N 1 2 321.302 4.092 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1nccn1CC(F)F ZINC000877892484 1043817484 /nfs/dbraw/zinc/81/74/84/1043817484.db2.gz YMDUOWZWQVCJEP-LBPRGKRZSA-N 1 2 319.355 4.087 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nccn1CC(F)F ZINC000877892484 1043817505 /nfs/dbraw/zinc/81/75/05/1043817505.db2.gz YMDUOWZWQVCJEP-LBPRGKRZSA-N 1 2 319.355 4.087 20 0 DIADLO Cc1cc(C)c2cc(NCc3cn(C)nc3C3CC3)ccc2[nH+]1 ZINC000896064795 1043818145 /nfs/dbraw/zinc/81/81/45/1043818145.db2.gz NZAAHCBMOGYXQW-UHFFFAOYSA-N 1 2 306.413 4.075 20 0 DIADLO CC1CCC(c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)CC1 ZINC000356220807 1043824213 /nfs/dbraw/zinc/82/42/13/1043824213.db2.gz PRYLKRDJLQKKQK-UHFFFAOYSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@H]1CCC[C@H](c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)C1 ZINC000356229578 1043824696 /nfs/dbraw/zinc/82/46/96/1043824696.db2.gz YXGFTBVZTFPDNW-KBPBESRZSA-N 1 2 308.385 4.216 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H](C)c2ncc(C)o2)ccc1OC(C)C ZINC000356270538 1043826521 /nfs/dbraw/zinc/82/65/21/1043826521.db2.gz GAWICGLTNSJWLM-UONOGXRCSA-N 1 2 318.417 4.191 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)co1 ZINC000929636500 1043829857 /nfs/dbraw/zinc/82/98/57/1043829857.db2.gz SWHKBCMJBZFWLQ-UHFFFAOYSA-N 1 2 314.429 4.090 20 0 DIADLO CC(C)(C)c1nc(C[N@H+](Cc2cccc(O)c2)CC2CC2)co1 ZINC000929636500 1043829878 /nfs/dbraw/zinc/82/98/78/1043829878.db2.gz SWHKBCMJBZFWLQ-UHFFFAOYSA-N 1 2 314.429 4.090 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@@H]2c2ccncc2)cc(C(F)(F)F)c1 ZINC000356313115 1043834788 /nfs/dbraw/zinc/83/47/88/1043834788.db2.gz DDFCKWQABDQPSV-MRXNPFEDSA-N 1 2 322.330 4.143 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@@H]2c2ccncc2)cc(C(F)(F)F)c1 ZINC000356313115 1043834805 /nfs/dbraw/zinc/83/48/05/1043834805.db2.gz DDFCKWQABDQPSV-MRXNPFEDSA-N 1 2 322.330 4.143 20 0 DIADLO COc1ccccc1-c1nc(C[N@H+](C)[C@@H](C)c2ccco2)co1 ZINC000878003033 1043836426 /nfs/dbraw/zinc/83/64/26/1043836426.db2.gz SDMBBBWMDAJSIB-ZDUSSCGKSA-N 1 2 312.369 4.136 20 0 DIADLO COc1ccccc1-c1nc(C[N@@H+](C)[C@@H](C)c2ccco2)co1 ZINC000878003033 1043836442 /nfs/dbraw/zinc/83/64/42/1043836442.db2.gz SDMBBBWMDAJSIB-ZDUSSCGKSA-N 1 2 312.369 4.136 20 0 DIADLO CC(C)(C)c1nc(C[N@H+](CCC(F)(F)F)CC2CC2)co1 ZINC000929816977 1043843358 /nfs/dbraw/zinc/84/33/58/1043843358.db2.gz DAESMHHWHSZCEK-UHFFFAOYSA-N 1 2 304.356 4.137 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+](CCC(F)(F)F)CC2CC2)co1 ZINC000929816977 1043843373 /nfs/dbraw/zinc/84/33/73/1043843373.db2.gz DAESMHHWHSZCEK-UHFFFAOYSA-N 1 2 304.356 4.137 20 0 DIADLO C[C@H]1CCC[C@@H](c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)C1 ZINC000356602653 1043853415 /nfs/dbraw/zinc/85/34/15/1043853415.db2.gz QEWNAABVOPNTPH-DZGCQCFKSA-N 1 2 308.385 4.216 20 0 DIADLO COc1ccccc1-c1nc(C[N@@H+]2CC[C@H]2c2ccccc2)co1 ZINC000878165954 1043854726 /nfs/dbraw/zinc/85/47/26/1043854726.db2.gz IJZDWGKTWOFXEE-SFHVURJKSA-N 1 2 320.392 4.297 20 0 DIADLO COc1ccccc1-c1nc(C[N@H+]2CC[C@H]2c2ccccc2)co1 ZINC000878165954 1043854740 /nfs/dbraw/zinc/85/47/40/1043854740.db2.gz IJZDWGKTWOFXEE-SFHVURJKSA-N 1 2 320.392 4.297 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc(C(F)(F)F)co2)n1 ZINC000878197360 1043858368 /nfs/dbraw/zinc/85/83/68/1043858368.db2.gz DLLHVRCYZUVANJ-OAHLLOKOSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2cc(C(F)(F)F)co2)n1 ZINC000878197360 1043858384 /nfs/dbraw/zinc/85/83/84/1043858384.db2.gz DLLHVRCYZUVANJ-OAHLLOKOSA-N 1 2 310.319 4.339 20 0 DIADLO CCc1nnc(C[NH2+]Cc2cccc(-c3ccc(C)cc3)c2)s1 ZINC000289681914 1043859727 /nfs/dbraw/zinc/85/97/27/1043859727.db2.gz COSFNBBXXJTSRE-UHFFFAOYSA-N 1 2 323.465 4.366 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2cnc(-c3ccccc3)o2)n1 ZINC000929988941 1043864018 /nfs/dbraw/zinc/86/40/18/1043864018.db2.gz VDUKOHCYZAZHCD-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2cc(Cl)ccc2s1)c1ccc(F)cn1 ZINC000356692111 1043864770 /nfs/dbraw/zinc/86/47/70/1043864770.db2.gz HGHGJCWWIZGUOP-SECBINFHSA-N 1 2 321.808 4.335 20 0 DIADLO CC[C@](C)([NH2+]Cc1cc(C(F)(F)F)co1)c1nc(C)cs1 ZINC000878261382 1043864797 /nfs/dbraw/zinc/86/47/97/1043864797.db2.gz INKSOEPORQWKGC-ZDUSSCGKSA-N 1 2 318.364 4.478 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1noc2c1CC(C)(C)CC2 ZINC000878316229 1043870993 /nfs/dbraw/zinc/87/09/93/1043870993.db2.gz HICFMGJXHZPAHM-KRWDZBQOSA-N 1 2 313.445 4.168 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1noc2c1CC(C)(C)CC2 ZINC000878316229 1043871000 /nfs/dbraw/zinc/87/10/00/1043871000.db2.gz HICFMGJXHZPAHM-KRWDZBQOSA-N 1 2 313.445 4.168 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)c(C)nn1 ZINC000930041469 1043871928 /nfs/dbraw/zinc/87/19/28/1043871928.db2.gz BUOVBHOACKKFPJ-GOSISDBHSA-N 1 2 317.383 4.099 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)c(C)nn1 ZINC000930041469 1043871944 /nfs/dbraw/zinc/87/19/44/1043871944.db2.gz BUOVBHOACKKFPJ-GOSISDBHSA-N 1 2 317.383 4.099 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1c(Cl)cncc1Cl ZINC000878344479 1043872489 /nfs/dbraw/zinc/87/24/89/1043872489.db2.gz DSVHUDQIWIYANM-JTQLQIEISA-N 1 2 311.212 4.248 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+]Cc2nocc2C)cc1OC ZINC000878356623 1043875574 /nfs/dbraw/zinc/87/55/74/1043875574.db2.gz WTQMYFCERXFJGU-CQSZACIVSA-N 1 2 318.417 4.021 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(F)(F)F)co1)c1c(F)cccc1F ZINC000878350120 1043876159 /nfs/dbraw/zinc/87/61/59/1043876159.db2.gz JMFCIWDVBSXFRB-QMMMGPOBSA-N 1 2 305.246 4.427 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2nc3c(o2)CCCC3)cc1 ZINC000878351396 1043877679 /nfs/dbraw/zinc/87/76/79/1043877679.db2.gz WCPKWHFYQMZWFA-CQSZACIVSA-N 1 2 314.429 4.191 20 0 DIADLO COc1cccc(C2([NH2+]Cc3c(Cl)cncc3Cl)CC2)c1 ZINC000878368984 1043880733 /nfs/dbraw/zinc/88/07/33/1043880733.db2.gz PGKCLEMCGPORSI-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccccc1C(F)(F)F ZINC000878366788 1043880942 /nfs/dbraw/zinc/88/09/42/1043880942.db2.gz BDRYLNLGQUTAEV-LLVKDONJSA-N 1 2 324.346 4.423 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(C(C)(C)C)n1)c1ccc(OC(F)F)cc1 ZINC000930196759 1043890239 /nfs/dbraw/zinc/89/02/39/1043890239.db2.gz JSGDKSFYZBUGRN-LLVKDONJSA-N 1 2 324.371 4.424 20 0 DIADLO C[C@H]([NH2+]Cc1coc(C(C)(C)C)n1)c1cccc(OC(F)F)c1 ZINC000930196600 1043891655 /nfs/dbraw/zinc/89/16/55/1043891655.db2.gz FIWBGYDNINAHJR-NSHDSACASA-N 1 2 324.371 4.424 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nncs1)c1ccc(Cl)c(Cl)c1 ZINC000930213081 1043892687 /nfs/dbraw/zinc/89/26/87/1043892687.db2.gz LYQPWMLPPFOJSN-GFCCVEGCSA-N 1 2 316.257 4.476 20 0 DIADLO C[N@H+](Cc1csc(C(F)(F)F)n1)[C@H]1CCc2ccccc21 ZINC001141887264 1043892947 /nfs/dbraw/zinc/89/29/47/1043892947.db2.gz AUXRKRVRMFFLMW-ZDUSSCGKSA-N 1 2 312.360 4.281 20 0 DIADLO C[N@@H+](Cc1csc(C(F)(F)F)n1)[C@H]1CCc2ccccc21 ZINC001141887264 1043892964 /nfs/dbraw/zinc/89/29/64/1043892964.db2.gz AUXRKRVRMFFLMW-ZDUSSCGKSA-N 1 2 312.360 4.281 20 0 DIADLO CCOc1cccc([C@H](C)[NH2+]Cc2coc(C(C)(C)C)n2)c1 ZINC000930209468 1043893173 /nfs/dbraw/zinc/89/31/73/1043893173.db2.gz CJHCGZZIVOILFY-ZDUSSCGKSA-N 1 2 302.418 4.222 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000289923559 1043897408 /nfs/dbraw/zinc/89/74/08/1043897408.db2.gz UKFUTISCANFELR-JTQLQIEISA-N 1 2 312.385 4.189 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000289923559 1043897424 /nfs/dbraw/zinc/89/74/24/1043897424.db2.gz UKFUTISCANFELR-JTQLQIEISA-N 1 2 312.385 4.189 20 0 DIADLO Cc1conc1C[NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1 ZINC000878518603 1043899021 /nfs/dbraw/zinc/89/90/21/1043899021.db2.gz XBTWDAJDBJRIEV-INIZCTEOSA-N 1 2 322.408 4.413 20 0 DIADLO Cc1conc1C[NH2+][C@H](C)c1cccc(OCc2ccccc2)c1 ZINC000878518604 1043899298 /nfs/dbraw/zinc/89/92/98/1043899298.db2.gz XBTWDAJDBJRIEV-MRXNPFEDSA-N 1 2 322.408 4.413 20 0 DIADLO CCCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nncs1 ZINC000930233464 1043902131 /nfs/dbraw/zinc/90/21/31/1043902131.db2.gz QUVMBAGTPKALOH-OAHLLOKOSA-N 1 2 319.474 4.204 20 0 DIADLO COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1c(F)cncc1F ZINC000930232214 1043902335 /nfs/dbraw/zinc/90/23/35/1043902335.db2.gz BFLYRCBPELVPAT-KRWDZBQOSA-N 1 2 320.383 4.245 20 0 DIADLO CC[C@H](c1ccccc1)[N@H+](CC)Cc1ncn(-c2ccccc2)n1 ZINC000357004561 1043904867 /nfs/dbraw/zinc/90/48/67/1043904867.db2.gz PTVBKUFISBNCHX-LJQANCHMSA-N 1 2 320.440 4.241 20 0 DIADLO CC[C@H](c1ccccc1)[N@@H+](CC)Cc1ncn(-c2ccccc2)n1 ZINC000357004561 1043904873 /nfs/dbraw/zinc/90/48/73/1043904873.db2.gz PTVBKUFISBNCHX-LJQANCHMSA-N 1 2 320.440 4.241 20 0 DIADLO C[C@@H](Nc1cc(N2CCCC2)nc[nH+]1)c1cc2ccccc2s1 ZINC000561208923 1043908546 /nfs/dbraw/zinc/90/85/46/1043908546.db2.gz AKTWOFBJVPVXRR-CYBMUJFWSA-N 1 2 324.453 4.465 20 0 DIADLO C[C@@H](Nc1cc(N2CCCC2)[nH+]cn1)c1cc2ccccc2s1 ZINC000561208923 1043908552 /nfs/dbraw/zinc/90/85/52/1043908552.db2.gz AKTWOFBJVPVXRR-CYBMUJFWSA-N 1 2 324.453 4.465 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@H](C)C(=O)Nc1c(C)cccc1Cl ZINC000878643577 1043909060 /nfs/dbraw/zinc/90/90/60/1043909060.db2.gz MVNLKAXSTTUAFU-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@H](C)C(=O)Nc1c(C)cccc1Cl ZINC000878643577 1043909070 /nfs/dbraw/zinc/90/90/70/1043909070.db2.gz MVNLKAXSTTUAFU-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nc(C(F)(F)F)cs2)CC12CCC2 ZINC000357051122 1043911002 /nfs/dbraw/zinc/91/10/02/1043911002.db2.gz ZUVHJGVNFXAGDV-SNVBAGLBSA-N 1 2 304.381 4.174 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nc(C(F)(F)F)cs2)CC12CCC2 ZINC000357051122 1043911018 /nfs/dbraw/zinc/91/10/18/1043911018.db2.gz ZUVHJGVNFXAGDV-SNVBAGLBSA-N 1 2 304.381 4.174 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1ccc2ccc(Cl)cc2n1 ZINC000878652802 1043911339 /nfs/dbraw/zinc/91/13/39/1043911339.db2.gz WLTANWZDKJWMMI-UHFFFAOYSA-N 1 2 315.804 4.071 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1ccc2ccc(Cl)cc2n1 ZINC000878652802 1043911344 /nfs/dbraw/zinc/91/13/44/1043911344.db2.gz WLTANWZDKJWMMI-UHFFFAOYSA-N 1 2 315.804 4.071 20 0 DIADLO CN(CCC1CCOCC1)c1cc[nH+]c2c(Cl)cccc12 ZINC000561236181 1043912458 /nfs/dbraw/zinc/91/24/58/1043912458.db2.gz OJWBLWMONQNOTB-UHFFFAOYSA-N 1 2 304.821 4.141 20 0 DIADLO CC(C)[N@H+](Cc1nccn1CC(F)F)[C@@H](C)c1ccsc1 ZINC000878721906 1043915254 /nfs/dbraw/zinc/91/52/54/1043915254.db2.gz LDFNBNUREHEDDQ-LBPRGKRZSA-N 1 2 313.417 4.181 20 0 DIADLO CC(C)[N@@H+](Cc1nccn1CC(F)F)[C@@H](C)c1ccsc1 ZINC000878721906 1043915261 /nfs/dbraw/zinc/91/52/61/1043915261.db2.gz LDFNBNUREHEDDQ-LBPRGKRZSA-N 1 2 313.417 4.181 20 0 DIADLO CN(C)c1cc(CSCc2nc3ccccc3s2)cc[nH+]1 ZINC000127368887 1043925088 /nfs/dbraw/zinc/92/50/88/1043925088.db2.gz AIJJNRRJCNAJQW-UHFFFAOYSA-N 1 2 315.467 4.191 20 0 DIADLO c1cc([C@H]2CCC[N@H+]2Cc2ccn(C3CCCC3)n2)cs1 ZINC000357174208 1043926169 /nfs/dbraw/zinc/92/61/69/1043926169.db2.gz CASPDBLSJJEZMH-QGZVFWFLSA-N 1 2 301.459 4.397 20 0 DIADLO c1cc([C@H]2CCC[N@@H+]2Cc2ccn(C3CCCC3)n2)cs1 ZINC000357174208 1043926173 /nfs/dbraw/zinc/92/61/73/1043926173.db2.gz CASPDBLSJJEZMH-QGZVFWFLSA-N 1 2 301.459 4.397 20 0 DIADLO CCSc1ccccc1C[NH2+][C@H](C)c1c(F)cncc1F ZINC000930474613 1043930136 /nfs/dbraw/zinc/93/01/36/1043930136.db2.gz SRDYKALQDVPRFU-LLVKDONJSA-N 1 2 308.397 4.323 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccoc2)no1)Cc1cccc(Cl)c1 ZINC000357262558 1043933196 /nfs/dbraw/zinc/93/31/96/1043933196.db2.gz YZPUMLZISXIQLS-UHFFFAOYSA-N 1 2 317.776 4.005 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccoc2)no1)Cc1cccc(Cl)c1 ZINC000357262558 1043933205 /nfs/dbraw/zinc/93/32/05/1043933205.db2.gz YZPUMLZISXIQLS-UHFFFAOYSA-N 1 2 317.776 4.005 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@H]2c2ncccn2)c2ccccc2n1 ZINC000878978710 1043933886 /nfs/dbraw/zinc/93/38/86/1043933886.db2.gz SSVQQORALLDRGA-INIZCTEOSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@H]2c2ncccn2)c2ccccc2n1 ZINC000878978710 1043933894 /nfs/dbraw/zinc/93/38/94/1043933894.db2.gz SSVQQORALLDRGA-INIZCTEOSA-N 1 2 324.815 4.015 20 0 DIADLO COCCC[C@H](CNc1cccc[nH+]1)c1ccc(Cl)cc1 ZINC000561358850 1043936458 /nfs/dbraw/zinc/93/64/58/1043936458.db2.gz HFWNMKZQEUCNKI-OAHLLOKOSA-N 1 2 304.821 4.357 20 0 DIADLO COc1ccc2cc(C[N@H+](C)Cc3ncc(C)s3)ccc2c1 ZINC000357316256 1043937440 /nfs/dbraw/zinc/93/74/40/1043937440.db2.gz PEJISFODBAQUTD-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO COc1ccc2cc(C[N@@H+](C)Cc3ncc(C)s3)ccc2c1 ZINC000357316256 1043937451 /nfs/dbraw/zinc/93/74/51/1043937451.db2.gz PEJISFODBAQUTD-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO Cc1conc1C[NH2+]C1(c2ccc(C(F)(F)F)cc2)CCC1 ZINC000879020163 1043938879 /nfs/dbraw/zinc/93/88/79/1043938879.db2.gz JMCPGRIBERSHCE-UHFFFAOYSA-N 1 2 310.319 4.171 20 0 DIADLO CC(C)[C@@H]1CC[C@H](Nc2ccc(Cn3cc[nH+]c3)cn2)C[C@@H]1C ZINC000561398239 1043943785 /nfs/dbraw/zinc/94/37/85/1043943785.db2.gz RPSPANMUSJUGPU-SZMVWBNQSA-N 1 2 312.461 4.199 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1cc2ccccc2nc1Cl ZINC000127572054 1043951167 /nfs/dbraw/zinc/95/11/67/1043951167.db2.gz NBKRSLXCEMRIFP-CYBMUJFWSA-N 1 2 311.816 4.476 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1cc2ccccc2nc1Cl ZINC000127572054 1043951175 /nfs/dbraw/zinc/95/11/75/1043951175.db2.gz NBKRSLXCEMRIFP-CYBMUJFWSA-N 1 2 311.816 4.476 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1ccnc(Cl)c1Cl ZINC000290432733 1043951641 /nfs/dbraw/zinc/95/16/41/1043951641.db2.gz NESMZVKJKGTCDF-SNVBAGLBSA-N 1 2 311.212 4.287 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ccnc(Cl)c1Cl ZINC000290432733 1043951645 /nfs/dbraw/zinc/95/16/45/1043951645.db2.gz NESMZVKJKGTCDF-SNVBAGLBSA-N 1 2 311.212 4.287 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)CC1(C(F)(F)F)CC1 ZINC000357545231 1043959370 /nfs/dbraw/zinc/95/93/70/1043959370.db2.gz YRZBEBWTBZVGKK-UHFFFAOYSA-N 1 2 323.318 4.056 20 0 DIADLO O=C(c1ccc(C2CCCC2)cc1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000290513357 1043960682 /nfs/dbraw/zinc/96/06/82/1043960682.db2.gz PWDNUZHIWUPDGE-SFHVURJKSA-N 1 2 323.440 4.087 20 0 DIADLO Cc1csc(C[C@@H]2CCN(c3[nH+]ccc4ccccc43)C2)n1 ZINC000896620701 1043967017 /nfs/dbraw/zinc/96/70/17/1043967017.db2.gz NKKUIQNRWPCWFF-AWEZNQCLSA-N 1 2 309.438 4.069 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)C1CCSCC1 ZINC000474878170 1043967457 /nfs/dbraw/zinc/96/74/57/1043967457.db2.gz JEFNSPMJGRQGFP-AWEZNQCLSA-N 1 2 305.491 4.016 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+]1CCC[C@@H]1c1noc(C)n1 ZINC000329423545 1043975030 /nfs/dbraw/zinc/97/50/30/1043975030.db2.gz IFOMIRBSRVDWCF-OAHLLOKOSA-N 1 2 311.385 4.024 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+]1CCC[C@@H]1c1noc(C)n1 ZINC000329423545 1043975041 /nfs/dbraw/zinc/97/50/41/1043975041.db2.gz IFOMIRBSRVDWCF-OAHLLOKOSA-N 1 2 311.385 4.024 20 0 DIADLO FC(F)C(F)(F)COc1cc(NCc2cccs2)cc[nH+]1 ZINC000357701624 1043976492 /nfs/dbraw/zinc/97/64/92/1043976492.db2.gz PNBKZSSOEYMKDJ-UHFFFAOYSA-N 1 2 320.311 4.034 20 0 DIADLO FC[C@H]([NH2+]Cc1cncc(C(F)(F)F)c1)c1ccc(F)cc1 ZINC000879659986 1043978690 /nfs/dbraw/zinc/97/86/90/1043978690.db2.gz LVSXBIKCOKMERU-AWEZNQCLSA-N 1 2 316.273 4.040 20 0 DIADLO CCc1cccc(F)c1C[N@@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000474921678 1043985351 /nfs/dbraw/zinc/98/53/51/1043985351.db2.gz DOWRMHICDZXLNM-QGZVFWFLSA-N 1 2 304.434 4.490 20 0 DIADLO CCc1cccc(F)c1C[N@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000474921678 1043985354 /nfs/dbraw/zinc/98/53/54/1043985354.db2.gz DOWRMHICDZXLNM-QGZVFWFLSA-N 1 2 304.434 4.490 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1ccc(Br)nc1 ZINC000290821976 1043990253 /nfs/dbraw/zinc/99/02/53/1043990253.db2.gz WZJGFDAROHUIDA-NSHDSACASA-N 1 2 320.234 4.083 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCC[C@@H]2c2cncc(C)c2)n1 ZINC000879750520 1043990537 /nfs/dbraw/zinc/99/05/37/1043990537.db2.gz WFSYCDBACAVQGV-LJQANCHMSA-N 1 2 312.461 4.285 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCC[C@@H]2c2cncc(C)c2)n1 ZINC000879750520 1043990544 /nfs/dbraw/zinc/99/05/44/1043990544.db2.gz WFSYCDBACAVQGV-LJQANCHMSA-N 1 2 312.461 4.285 20 0 DIADLO CC(C)C[C@@H]1CCC[C@H]([NH2+][C@H](c2nnc[nH]2)c2ccccc2)C1 ZINC000474937950 1043991693 /nfs/dbraw/zinc/99/16/93/1043991693.db2.gz BWUYJBPXPJGFLJ-SZMVWBNQSA-N 1 2 312.461 4.089 20 0 DIADLO C[C@H]([NH2+][C@H](c1nnc[nH]1)c1ccccc1)[C@@H](C)C1CCCCC1 ZINC000474937966 1043991800 /nfs/dbraw/zinc/99/18/00/1043991800.db2.gz CBWMCQMOFCHQOL-VKJFTORMSA-N 1 2 312.461 4.089 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccccc2)[C@H](O)c2ccccc2)no1 ZINC000290847909 1043992327 /nfs/dbraw/zinc/99/23/27/1043992327.db2.gz ZHYAZEQHAGJXLR-UIAACRFSSA-N 1 2 322.408 4.109 20 0 DIADLO Fc1cc(C[N@@H+]2CCC23CCCC3)c(F)cc1Br ZINC001141909931 1043993716 /nfs/dbraw/zinc/99/37/16/1043993716.db2.gz GZJTZODQXOZPGZ-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1cc(C[N@H+]2CCC23CCCC3)c(F)cc1Br ZINC001141909931 1043993725 /nfs/dbraw/zinc/99/37/25/1043993725.db2.gz GZJTZODQXOZPGZ-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1cc2ccccc2nc1Cl ZINC000128029011 1043994900 /nfs/dbraw/zinc/99/49/00/1043994900.db2.gz SVXBOUBEKOIXDZ-CYBMUJFWSA-N 1 2 311.816 4.476 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1cc2ccccc2nc1Cl ZINC000128029011 1043994913 /nfs/dbraw/zinc/99/49/13/1043994913.db2.gz SVXBOUBEKOIXDZ-CYBMUJFWSA-N 1 2 311.816 4.476 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cccc(C(C)C)n1 ZINC000357919542 1044001108 /nfs/dbraw/zinc/00/11/08/1044001108.db2.gz KIJBFCSEHLKQHR-UHFFFAOYSA-N 1 2 320.396 4.156 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2ncc(-c3cccs3)o2)C1 ZINC000880000126 1044003665 /nfs/dbraw/zinc/00/36/65/1044003665.db2.gz FNOADVFGZJULTQ-ZDUSSCGKSA-N 1 2 316.348 4.177 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2ncc(-c3cccs3)o2)C1 ZINC000880000126 1044003678 /nfs/dbraw/zinc/00/36/78/1044003678.db2.gz FNOADVFGZJULTQ-ZDUSSCGKSA-N 1 2 316.348 4.177 20 0 DIADLO Cc1cccc2c(C[N@@H+]3CCc4cc(Cl)ccc4C3)[nH]nc21 ZINC001137149371 1044007018 /nfs/dbraw/zinc/00/70/18/1044007018.db2.gz QUXUEQMNUWFTOO-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1cccc2c(C[N@H+]3CCc4cc(Cl)ccc4C3)[nH]nc21 ZINC001137149371 1044007033 /nfs/dbraw/zinc/00/70/33/1044007033.db2.gz QUXUEQMNUWFTOO-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2cc(F)c(F)c(F)c2)cs1 ZINC000358092204 1044020482 /nfs/dbraw/zinc/02/04/82/1044020482.db2.gz YBQPFBDZNRGOFG-SFYZADRCSA-N 1 2 300.349 4.281 20 0 DIADLO Cc1ccc(C[S@@](=O)CC[C@H]2C[C@H](C)C[C@H](C)C2)c(C)[nH+]1 ZINC000358159106 1044025617 /nfs/dbraw/zinc/02/56/17/1044025617.db2.gz YBAVRQDIHGBEFB-LOIAUBITSA-N 1 2 307.503 4.410 20 0 DIADLO Clc1ccc(C[N@@H+]2CC[C@@H](Oc3ccccc3Cl)C2)cn1 ZINC000128372525 1044031266 /nfs/dbraw/zinc/03/12/66/1044031266.db2.gz PWLMWSVMFJKPSP-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccc(C[N@H+]2CC[C@@H](Oc3ccccc3Cl)C2)cn1 ZINC000128372525 1044031282 /nfs/dbraw/zinc/03/12/82/1044031282.db2.gz PWLMWSVMFJKPSP-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1nc2ccccc2n1C ZINC000561957665 1044036002 /nfs/dbraw/zinc/03/60/02/1044036002.db2.gz PBPYVGSBOXHSCK-QGZVFWFLSA-N 1 2 323.440 4.165 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1nc2ccccc2n1C ZINC000561957665 1044036018 /nfs/dbraw/zinc/03/60/18/1044036018.db2.gz PBPYVGSBOXHSCK-QGZVFWFLSA-N 1 2 323.440 4.165 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1oc(C(C)C)nc1C ZINC000428308997 1044039447 /nfs/dbraw/zinc/03/94/47/1044039447.db2.gz BIMVLWCOYBKNBH-GFCCVEGCSA-N 1 2 306.381 4.105 20 0 DIADLO FC(F)[C@H]([NH2+]CCC1CCOCC1)c1cccc(Cl)c1 ZINC000880533800 1044045579 /nfs/dbraw/zinc/04/55/79/1044045579.db2.gz HQLKUJMMDGFKOJ-CQSZACIVSA-N 1 2 303.780 4.053 20 0 DIADLO CCOc1ccc([C@@H]2CCCN2c2cc(C)[nH+]c(C3CC3)n2)cc1 ZINC000522567716 1044045975 /nfs/dbraw/zinc/04/59/75/1044045975.db2.gz RITYUDHNPGCPSL-SFHVURJKSA-N 1 2 323.440 4.403 20 0 DIADLO c1cc(-c2noc(C[N@@H+]3C[C@@H]4CC[C@H]3c3ccccc34)n2)cs1 ZINC000880540042 1044046404 /nfs/dbraw/zinc/04/64/04/1044046404.db2.gz PSRKZRWJNZJZOK-LRDDRELGSA-N 1 2 323.421 4.232 20 0 DIADLO c1cc(-c2noc(C[N@H+]3C[C@@H]4CC[C@H]3c3ccccc34)n2)cs1 ZINC000880540042 1044046413 /nfs/dbraw/zinc/04/64/13/1044046413.db2.gz PSRKZRWJNZJZOK-LRDDRELGSA-N 1 2 323.421 4.232 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2ccc(C3CC3)cc2F)c[nH+]1 ZINC000880751041 1044071962 /nfs/dbraw/zinc/07/19/62/1044071962.db2.gz MTOGFZRHLXLUOT-UHFFFAOYSA-N 1 2 313.376 4.037 20 0 DIADLO CC(C)(C)c1noc(C[NH2+][C@@H]2CCc3cccc4cccc2c43)n1 ZINC000931805682 1044075301 /nfs/dbraw/zinc/07/53/01/1044075301.db2.gz HLFRJWFJBWRZJF-MRXNPFEDSA-N 1 2 321.424 4.297 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1ccnc(Cl)c1Cl ZINC000291585542 1044085000 /nfs/dbraw/zinc/08/50/00/1044085000.db2.gz PFUNQOJXGWFKSD-CYBMUJFWSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccnc(Cl)c1Cl ZINC000291585542 1044085018 /nfs/dbraw/zinc/08/50/18/1044085018.db2.gz PFUNQOJXGWFKSD-CYBMUJFWSA-N 1 2 310.228 4.367 20 0 DIADLO CC(C)c1ccoc1-c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000346380121 1044098932 /nfs/dbraw/zinc/09/89/32/1044098932.db2.gz FFIPHUDTPVMBOU-UHFFFAOYSA-N 1 2 320.352 4.306 20 0 DIADLO Clc1nc(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)cs1 ZINC000932214075 1044111148 /nfs/dbraw/zinc/11/11/48/1044111148.db2.gz HAUVOGHYOSYABC-CYBMUJFWSA-N 1 2 320.845 4.333 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2sc(C)nc2C)c1C ZINC000346569497 1044116844 /nfs/dbraw/zinc/11/68/44/1044116844.db2.gz AZJXQFYMVPFZJZ-UHFFFAOYSA-N 1 2 308.472 4.214 20 0 DIADLO Fc1ccccc1-c1nc(C[NH2+][C@@H](c2ccccn2)C2CC2)co1 ZINC000932381654 1044121547 /nfs/dbraw/zinc/12/15/47/1044121547.db2.gz AXJYIIGBNIWBOR-GOSISDBHSA-N 1 2 323.371 4.117 20 0 DIADLO Cc1ccc(-c2cnc(C[NH2+][C@@H](c3ccccn3)C3CC3)o2)cc1 ZINC000932376257 1044122011 /nfs/dbraw/zinc/12/20/11/1044122011.db2.gz BPZOXUXISOQAPR-HXUWFJFHSA-N 1 2 319.408 4.286 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+](Cc2cccc(F)c2)C2CCC2)o1 ZINC000932406464 1044126228 /nfs/dbraw/zinc/12/62/28/1044126228.db2.gz AUQQZIFAGQQIDH-UHFFFAOYSA-N 1 2 317.408 4.061 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+](Cc2cccc(F)c2)C2CCC2)o1 ZINC000932406464 1044126233 /nfs/dbraw/zinc/12/62/33/1044126233.db2.gz AUQQZIFAGQQIDH-UHFFFAOYSA-N 1 2 317.408 4.061 20 0 DIADLO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1nc(-c2ccsc2)no1 ZINC000932555278 1044142196 /nfs/dbraw/zinc/14/21/96/1044142196.db2.gz FKXXRSWVJRLJTO-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1c2ccccc2oc1C[NH2+][C@@H](c1nnc[nH]1)C1CCCCC1 ZINC000292183213 1044145399 /nfs/dbraw/zinc/14/53/99/1044145399.db2.gz OSWXCFMZKNGCOT-GOSISDBHSA-N 1 2 324.428 4.271 20 0 DIADLO Cc1cc(C[NH+](Cc2cccs2)Cc2cccs2)ncn1 ZINC000292174936 1044145423 /nfs/dbraw/zinc/14/54/23/1044145423.db2.gz MFPNHPQXSLCGKX-UHFFFAOYSA-N 1 2 315.467 4.110 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1ccc2c(n1)CCC2 ZINC000562679417 1044149327 /nfs/dbraw/zinc/14/93/27/1044149327.db2.gz WVLCDNAQGQLUOS-LBPRGKRZSA-N 1 2 302.368 4.042 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1ccc2c(n1)CCC2 ZINC000562679417 1044149329 /nfs/dbraw/zinc/14/93/29/1044149329.db2.gz WVLCDNAQGQLUOS-LBPRGKRZSA-N 1 2 302.368 4.042 20 0 DIADLO c1coc([C@H]([NH2+]Cc2ccc3c(n2)CCC3)c2ccccc2)c1 ZINC000562685743 1044150473 /nfs/dbraw/zinc/15/04/73/1044150473.db2.gz AGDMYMMXOJLWNB-HXUWFJFHSA-N 1 2 304.393 4.043 20 0 DIADLO CC(C)([NH2+]Cc1ccn(C2CCCC2)n1)c1ccccc1F ZINC000292223270 1044151016 /nfs/dbraw/zinc/15/10/16/1044151016.db2.gz VBNGKVVDNJAVBS-UHFFFAOYSA-N 1 2 301.409 4.162 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Oc2cccc(F)c2)cc1)c1ccon1 ZINC000444004021 1044151739 /nfs/dbraw/zinc/15/17/39/1044151739.db2.gz PWMZFLGVRZEHEZ-CYBMUJFWSA-N 1 2 312.344 4.457 20 0 DIADLO CC(C)c1ccc([C@@H](C)[N@@H+](C)Cc2nncn2C(C)C)cc1 ZINC000292288062 1044157999 /nfs/dbraw/zinc/15/79/99/1044157999.db2.gz CDVZTIJCKUTUDB-OAHLLOKOSA-N 1 2 300.450 4.175 20 0 DIADLO CC(C)c1ccc([C@@H](C)[N@H+](C)Cc2nncn2C(C)C)cc1 ZINC000292288062 1044158005 /nfs/dbraw/zinc/15/80/05/1044158005.db2.gz CDVZTIJCKUTUDB-OAHLLOKOSA-N 1 2 300.450 4.175 20 0 DIADLO CC(C)(C)SCCCC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000129518567 1044159559 /nfs/dbraw/zinc/15/95/59/1044159559.db2.gz NLXIXZCDHUQZJC-UHFFFAOYSA-N 1 2 317.458 4.123 20 0 DIADLO FC(F)CC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ncc(Cl)s1 ZINC000932805161 1044161558 /nfs/dbraw/zinc/16/15/58/1044161558.db2.gz SKOZQYMWTCBRTD-PBINXNQUSA-N 1 2 306.809 4.195 20 0 DIADLO FC(F)CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ncc(Cl)s1 ZINC000932805161 1044161565 /nfs/dbraw/zinc/16/15/65/1044161565.db2.gz SKOZQYMWTCBRTD-PBINXNQUSA-N 1 2 306.809 4.195 20 0 DIADLO Cc1cc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)ncn1 ZINC000292338470 1044164263 /nfs/dbraw/zinc/16/42/63/1044164263.db2.gz CUHSYIYSVIABEM-CYBMUJFWSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1cc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)ncn1 ZINC000292338470 1044164276 /nfs/dbraw/zinc/16/42/76/1044164276.db2.gz CUHSYIYSVIABEM-CYBMUJFWSA-N 1 2 301.821 4.164 20 0 DIADLO C[N@H+](Cc1ccc(C(F)(F)F)cc1)Cc1cccnc1Cl ZINC000129689462 1044172491 /nfs/dbraw/zinc/17/24/91/1044172491.db2.gz ZUXUTVVWPDVRHD-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cc1cccnc1Cl ZINC000129689462 1044172495 /nfs/dbraw/zinc/17/24/95/1044172495.db2.gz ZUXUTVVWPDVRHD-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nncn1C)c1ccccc1Oc1ccccc1 ZINC000346932368 1044173947 /nfs/dbraw/zinc/17/39/47/1044173947.db2.gz AXQZTPKLSRUBKM-CABCVRRESA-N 1 2 322.412 4.019 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000346968875 1044177699 /nfs/dbraw/zinc/17/76/99/1044177699.db2.gz FNRRHBFYQACQIN-LJQANCHMSA-N 1 2 324.424 4.020 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000346968875 1044177703 /nfs/dbraw/zinc/17/77/03/1044177703.db2.gz FNRRHBFYQACQIN-LJQANCHMSA-N 1 2 324.424 4.020 20 0 DIADLO Fc1cncc(C[N@@H+]2CCc3cc(-c4ccccc4)oc3C2)c1 ZINC000346987559 1044179711 /nfs/dbraw/zinc/17/97/11/1044179711.db2.gz SJFALDHZTUMJQI-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1cncc(C[N@H+]2CCc3cc(-c4ccccc4)oc3C2)c1 ZINC000346987559 1044179715 /nfs/dbraw/zinc/17/97/15/1044179715.db2.gz SJFALDHZTUMJQI-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2ccccc2SC)cs1 ZINC000281826824 1044197711 /nfs/dbraw/zinc/19/77/11/1044197711.db2.gz XKQMBZVEWXUVKU-NWDGAFQWSA-N 1 2 322.499 4.423 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2ncc(C(C)(C)C)o2)cc1C ZINC000933490289 1044200393 /nfs/dbraw/zinc/20/03/93/1044200393.db2.gz TVRFYANOAHHEJG-CYBMUJFWSA-N 1 2 302.418 4.140 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+]Cc2ccnc(Oc3ccccc3)c2)n1 ZINC000882887297 1044201340 /nfs/dbraw/zinc/20/13/40/1044201340.db2.gz LALHCGVHMLMJKB-UHFFFAOYSA-N 1 2 322.412 4.010 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1occc1Br ZINC000778181813 1044203723 /nfs/dbraw/zinc/20/37/23/1044203723.db2.gz PCQQHWTZWRATAL-UHFFFAOYSA-N 1 2 318.573 4.124 20 0 DIADLO CCO[C@H]1C[C@H](Nc2cc(CSCC)cc[nH+]2)C12CCC2 ZINC000347205760 1044205878 /nfs/dbraw/zinc/20/58/78/1044205878.db2.gz QDPFPPGNZVVEHT-GJZGRUSLSA-N 1 2 306.475 4.094 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+]C(C)(C)c2cccc(Cl)c2F)n1 ZINC000883091755 1044220301 /nfs/dbraw/zinc/22/03/01/1044220301.db2.gz WFGUHWXHOLAPEY-UHFFFAOYSA-N 1 2 309.816 4.351 20 0 DIADLO CCC[C@H]([NH2+][C@@H](C)c1cc(C)n(C)n1)c1ccc(F)cc1F ZINC000281957368 1044223625 /nfs/dbraw/zinc/22/36/25/1044223625.db2.gz AVFDTDOUMKJQAI-LRDDRELGSA-N 1 2 307.388 4.199 20 0 DIADLO FC(F)Sc1ccc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)cc1 ZINC000778226871 1044225830 /nfs/dbraw/zinc/22/58/30/1044225830.db2.gz UGONWSIJOXKEDJ-CYBMUJFWSA-N 1 2 309.385 4.062 20 0 DIADLO FC(F)Sc1ccc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)cc1 ZINC000778226871 1044225843 /nfs/dbraw/zinc/22/58/43/1044225843.db2.gz UGONWSIJOXKEDJ-CYBMUJFWSA-N 1 2 309.385 4.062 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nnc(C(C)C)[nH]1)c1sccc1Cl ZINC000883208320 1044233780 /nfs/dbraw/zinc/23/37/80/1044233780.db2.gz DBNJLJSJZKTISI-KOLCDFICSA-N 1 2 312.870 4.445 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nnc(C(C)C)[nH]1)c1sccc1Cl ZINC000883208321 1044234656 /nfs/dbraw/zinc/23/46/56/1044234656.db2.gz DBNJLJSJZKTISI-MWLCHTKSSA-N 1 2 312.870 4.445 20 0 DIADLO Cc1cc(C[NH+]2CCC(c3nc(C(C)(C)C)cs3)CC2)no1 ZINC000360107218 1044236132 /nfs/dbraw/zinc/23/61/32/1044236132.db2.gz GFBNWYPHUYCQJI-UHFFFAOYSA-N 1 2 319.474 4.117 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nnc(C)s1)c1sccc1Cl ZINC000883215631 1044237233 /nfs/dbraw/zinc/23/72/33/1044237233.db2.gz CETUIBIWRYJFFW-XVKPBYJWSA-N 1 2 301.868 4.363 20 0 DIADLO CC[C@H]([NH2+]Cc1nccc(OC)c1F)c1sccc1Cl ZINC000883235501 1044241228 /nfs/dbraw/zinc/24/12/28/1044241228.db2.gz DZULNFQWTLZWEG-JTQLQIEISA-N 1 2 314.813 4.185 20 0 DIADLO CC(C)(C)[C@@H]([NH2+]Cc1nc(C2CCC2)no1)c1ccc(F)cc1 ZINC000639533111 1044242134 /nfs/dbraw/zinc/24/21/34/1044242134.db2.gz CBRSFTNGRUNNBX-INIZCTEOSA-N 1 2 317.408 4.353 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)C[N@H+]2C[C@@H](C)[C@@H]2C)cc1 ZINC000563320569 1044248631 /nfs/dbraw/zinc/24/86/31/1044248631.db2.gz OJEMPTROGPDRKJ-CVEARBPZSA-N 1 2 324.424 4.066 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)C[N@@H+]2C[C@@H](C)[C@@H]2C)cc1 ZINC000563320569 1044248639 /nfs/dbraw/zinc/24/86/39/1044248639.db2.gz OJEMPTROGPDRKJ-CVEARBPZSA-N 1 2 324.424 4.066 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+]Cc1cnc(C2CC2)o1 ZINC000883259035 1044251187 /nfs/dbraw/zinc/25/11/87/1044251187.db2.gz YXWVBFVKZAVLJG-UHFFFAOYSA-N 1 2 320.820 4.282 20 0 DIADLO Cc1cc(C(=O)C[N@@H+]2CC[C@H]2c2ccccc2)c(C)n1C1CC1 ZINC000444291904 1044253827 /nfs/dbraw/zinc/25/38/27/1044253827.db2.gz MPDMSYUHVMRKKL-IBGZPJMESA-N 1 2 308.425 4.070 20 0 DIADLO Cc1cc(C(=O)C[N@H+]2CC[C@H]2c2ccccc2)c(C)n1C1CC1 ZINC000444291904 1044253840 /nfs/dbraw/zinc/25/38/40/1044253840.db2.gz MPDMSYUHVMRKKL-IBGZPJMESA-N 1 2 308.425 4.070 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+][C@@H]1C[C@@H](C)n2ccnc21 ZINC000883267618 1044254571 /nfs/dbraw/zinc/25/45/71/1044254571.db2.gz LFFPNKDCRBEUJS-IUODEOHRSA-N 1 2 319.836 4.119 20 0 DIADLO Cc1ccc(C[NH2+]Cc2ncc(C(C)(C)C)s2)c(Cl)n1 ZINC000883292845 1044260652 /nfs/dbraw/zinc/26/06/52/1044260652.db2.gz BLKPEBMQHWYUNR-UHFFFAOYSA-N 1 2 309.866 4.087 20 0 DIADLO C[C@@H]([NH2+]C1(c2ncccn2)CCC1)c1ccc(C(F)(F)F)cc1 ZINC000883313516 1044265779 /nfs/dbraw/zinc/26/57/79/1044265779.db2.gz GDGXEXJABDVHSB-GFCCVEGCSA-N 1 2 321.346 4.225 20 0 DIADLO Cc1ccc2cc([C@@H](C)[NH2+]C3(c4ncccn4)CCC3)oc2c1 ZINC000883311635 1044266208 /nfs/dbraw/zinc/26/62/08/1044266208.db2.gz HIPMALZVOIQQJL-CQSZACIVSA-N 1 2 307.397 4.261 20 0 DIADLO Oc1ccc(Cl)c(C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)c1 ZINC000883327037 1044273760 /nfs/dbraw/zinc/27/37/60/1044273760.db2.gz PLTQHLGKJRGEND-INIZCTEOSA-N 1 2 319.836 4.180 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc(Br)cn2)c[nH+]c1C ZINC000883342852 1044278316 /nfs/dbraw/zinc/27/83/16/1044278316.db2.gz OHYPKUYJRAPWGZ-NSHDSACASA-N 1 2 306.207 4.029 20 0 DIADLO Cc1[nH]c(CNc2ccc([C@@H](F)C(F)(F)F)cc2)[nH+]c1C ZINC000883367954 1044284646 /nfs/dbraw/zinc/28/46/46/1044284646.db2.gz BOROIZDMVWKOAY-CYBMUJFWSA-N 1 2 301.287 4.212 20 0 DIADLO Cc1nc(C(C)C)ccc1C[NH2+][C@H](C)c1c(F)cncc1F ZINC000293445048 1044285430 /nfs/dbraw/zinc/28/54/30/1044285430.db2.gz CFTIOTDDZRVLAA-GFCCVEGCSA-N 1 2 305.372 4.037 20 0 DIADLO Brc1cc(C[N@@H+]2CCC[C@H]2c2ccsc2)ccn1 ZINC000293452921 1044285850 /nfs/dbraw/zinc/28/58/50/1044285850.db2.gz KSZVAFVJTFXWBU-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cc(C[N@H+]2CCC[C@H]2c2ccsc2)ccn1 ZINC000293452921 1044285860 /nfs/dbraw/zinc/28/58/60/1044285860.db2.gz KSZVAFVJTFXWBU-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cnc(C(C)(C)C)nc1 ZINC000883377254 1044289466 /nfs/dbraw/zinc/28/94/66/1044289466.db2.gz CHWNFXQOLGDNNK-UHFFFAOYSA-N 1 2 316.474 4.034 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+][C@H]1c2ccccc2CC[C@H]1F ZINC000883376459 1044290294 /nfs/dbraw/zinc/29/02/94/1044290294.db2.gz LHMCIEOIJUVRCX-POHZPAGDSA-N 1 2 302.393 4.222 20 0 DIADLO CC(C)c1ncc(C[NH2+][C@H]2c3ccccc3CC[C@H]2F)s1 ZINC000883383103 1044293920 /nfs/dbraw/zinc/29/39/20/1044293920.db2.gz TWZJBRSIBUWVDK-CVEARBPZSA-N 1 2 304.434 4.382 20 0 DIADLO Cc1nc([C@H]([NH2+][C@@H]2CC=C(C)CC2)c2ccc(Cl)cc2)no1 ZINC000293553032 1044300243 /nfs/dbraw/zinc/30/02/43/1044300243.db2.gz HGYZSXXBDUXWOB-HZPDHXFCSA-N 1 2 317.820 4.209 20 0 DIADLO CCCCc1noc(C[N@@H+]2CCCCC[C@H]2c2ccco2)n1 ZINC000121255649 1044301212 /nfs/dbraw/zinc/30/12/12/1044301212.db2.gz XPOYVBLZIMLCDS-AWEZNQCLSA-N 1 2 303.406 4.123 20 0 DIADLO CCCCc1noc(C[N@H+]2CCCCC[C@H]2c2ccco2)n1 ZINC000121255649 1044301221 /nfs/dbraw/zinc/30/12/21/1044301221.db2.gz XPOYVBLZIMLCDS-AWEZNQCLSA-N 1 2 303.406 4.123 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2ccccc2OC(C)C)s1 ZINC000293610237 1044304122 /nfs/dbraw/zinc/30/41/22/1044304122.db2.gz PNZOTKUVRMRBIF-UHFFFAOYSA-N 1 2 322.499 4.083 20 0 DIADLO CC1(C)Nc2ccccc2[C@@H]1[NH2+]Cc1ncc(-c2ccccc2)o1 ZINC000883462841 1044307845 /nfs/dbraw/zinc/30/78/45/1044307845.db2.gz BDUXOQAJTQFSGG-IBGZPJMESA-N 1 2 319.408 4.377 20 0 DIADLO Cc1ccc2c(Nc3cnn(CC(F)(F)F)c3)cccc2[nH+]1 ZINC001212794364 1044311348 /nfs/dbraw/zinc/31/13/48/1044311348.db2.gz WEBWCXMGYZTFIW-UHFFFAOYSA-N 1 2 306.291 4.046 20 0 DIADLO Fc1cccc2c1OCC[N@@H+](Cc1ccc(C(F)F)cc1)C2 ZINC000475200709 1044324080 /nfs/dbraw/zinc/32/40/80/1044324080.db2.gz DWERQJFDBHFGAA-UHFFFAOYSA-N 1 2 307.315 4.158 20 0 DIADLO Fc1cccc2c1OCC[N@H+](Cc1ccc(C(F)F)cc1)C2 ZINC000475200709 1044324094 /nfs/dbraw/zinc/32/40/94/1044324094.db2.gz DWERQJFDBHFGAA-UHFFFAOYSA-N 1 2 307.315 4.158 20 0 DIADLO Cc1cc(Nc2cccc3[nH+]c(C)ccc23)n(CC(F)(F)F)n1 ZINC001212796240 1044325307 /nfs/dbraw/zinc/32/53/07/1044325307.db2.gz VFTMMFISMJTICU-UHFFFAOYSA-N 1 2 320.318 4.354 20 0 DIADLO Cc1ccc2c(Nc3ncc(C(F)(F)F)cc3N)cccc2[nH+]1 ZINC001212796425 1044328548 /nfs/dbraw/zinc/32/85/48/1044328548.db2.gz ZAKWDVVXQSFPLK-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO FC(F)[C@H](CCc1ccccc1)[NH2+]C[C@@H]1CC1(Cl)Cl ZINC001308862791 1044339159 /nfs/dbraw/zinc/33/91/59/1044339159.db2.gz IGKANIIHUZLZEU-RYUDHWBXSA-N 1 2 308.199 4.036 20 0 DIADLO Cc1ccc2c(Nc3ccc4nc(C(C)C)nn4c3)cccc2[nH+]1 ZINC001212796750 1044339349 /nfs/dbraw/zinc/33/93/49/1044339349.db2.gz AMXQBKFXLIELLI-UHFFFAOYSA-N 1 2 317.396 4.453 20 0 DIADLO CC(C)c1nc(C[N@@H+]2Cc3ccc(O)cc3C3(CC3)C2)cs1 ZINC000361021836 1044345873 /nfs/dbraw/zinc/34/58/73/1044345873.db2.gz IAMFHBIQQDSWIQ-UHFFFAOYSA-N 1 2 314.454 4.020 20 0 DIADLO CC(C)c1nc(C[N@H+]2Cc3ccc(O)cc3C3(CC3)C2)cs1 ZINC000361021836 1044345887 /nfs/dbraw/zinc/34/58/87/1044345887.db2.gz IAMFHBIQQDSWIQ-UHFFFAOYSA-N 1 2 314.454 4.020 20 0 DIADLO Cc1cccc2ncc(C[N@@H+](C)[C@@H](C)c3ccccc3Cl)n21 ZINC001137198914 1044354028 /nfs/dbraw/zinc/35/40/28/1044354028.db2.gz SGNBPTUNVYEMGC-AWEZNQCLSA-N 1 2 313.832 4.489 20 0 DIADLO Cc1cccc2ncc(C[N@H+](C)[C@@H](C)c3ccccc3Cl)n21 ZINC001137198914 1044354040 /nfs/dbraw/zinc/35/40/40/1044354040.db2.gz SGNBPTUNVYEMGC-AWEZNQCLSA-N 1 2 313.832 4.489 20 0 DIADLO Cc1ccc2c(Nc3ccccc3N3CCOCC3)cccc2[nH+]1 ZINC001212797058 1044354340 /nfs/dbraw/zinc/35/43/40/1044354340.db2.gz VWAFZLFNNXGXDO-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO CC1(CCC(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)CC1 ZINC000935779031 1044366593 /nfs/dbraw/zinc/36/65/93/1044366593.db2.gz AGNALFNTFOSDQD-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H]2CCOc3c(F)ccc(F)c32)c(C)o1 ZINC000361177126 1044369383 /nfs/dbraw/zinc/36/93/83/1044369383.db2.gz GUDHIZTYJATLHL-BONVTDFDSA-N 1 2 307.340 4.349 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+][C@@H]1CCOc2c(F)ccc(F)c21 ZINC000361185831 1044372623 /nfs/dbraw/zinc/37/26/23/1044372623.db2.gz IUQWMQWSWJVROF-XHDPSFHLSA-N 1 2 319.351 4.148 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H]2CCOc3c(F)ccc(F)c32)oc1C ZINC000361186779 1044372756 /nfs/dbraw/zinc/37/27/56/1044372756.db2.gz MSTACOWUSNSFMT-HZMBPMFUSA-N 1 2 307.340 4.349 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2cc(C)cc(C)c2)n1 ZINC000107071888 1044374536 /nfs/dbraw/zinc/37/45/36/1044374536.db2.gz RUDBCCYUNZPOBC-CABCVRRESA-N 1 2 301.434 4.441 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@@H](C)c2cc(C)cc(C)c2)n1 ZINC000107071884 1044375082 /nfs/dbraw/zinc/37/50/82/1044375082.db2.gz RUDBCCYUNZPOBC-GJZGRUSLSA-N 1 2 301.434 4.441 20 0 DIADLO CC(C)Oc1ccc(Cl)cc1NCc1cccc2[nH+]ccn21 ZINC000564420237 1044375451 /nfs/dbraw/zinc/37/54/51/1044375451.db2.gz WRQMRHYPSJCFNI-UHFFFAOYSA-N 1 2 315.804 4.387 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@H]2CCOc3c(F)ccc(F)c32)o1 ZINC000361236896 1044377387 /nfs/dbraw/zinc/37/73/87/1044377387.db2.gz MDLNNJJNBWFUAR-GMXABZIVSA-N 1 2 319.351 4.295 20 0 DIADLO Cc1cnn(C)c1C[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000564611840 1044394100 /nfs/dbraw/zinc/39/41/00/1044394100.db2.gz GTWXCSUZJHQSEU-CYBMUJFWSA-N 1 2 303.837 4.108 20 0 DIADLO Cc1cnn(C)c1C[N@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000564611840 1044394116 /nfs/dbraw/zinc/39/41/16/1044394116.db2.gz GTWXCSUZJHQSEU-CYBMUJFWSA-N 1 2 303.837 4.108 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CCC2)no1)c1ccc2c(c1)CCCC2 ZINC000639561394 1044394299 /nfs/dbraw/zinc/39/42/99/1044394299.db2.gz GQHWPSMCMYLCDQ-ZDUSSCGKSA-N 1 2 311.429 4.067 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1cc(C)on1)c1ccccc1OC(F)F ZINC000282878800 1044397113 /nfs/dbraw/zinc/39/71/13/1044397113.db2.gz VOFWBCKLDNCCJC-YPMHNXCESA-N 1 2 310.344 4.386 20 0 DIADLO C[N@H+](Cc1cncc(C(F)(F)F)c1)Cc1cc(F)cc(F)c1 ZINC000361381156 1044398827 /nfs/dbraw/zinc/39/88/27/1044398827.db2.gz LXWYKNNUFUHPDW-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO C[N@@H+](Cc1cncc(C(F)(F)F)c1)Cc1cc(F)cc(F)c1 ZINC000361381156 1044398837 /nfs/dbraw/zinc/39/88/37/1044398837.db2.gz LXWYKNNUFUHPDW-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO Cc1ccncc1C[N@@H+](C)[C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000361444891 1044403571 /nfs/dbraw/zinc/40/35/71/1044403571.db2.gz ZSFLUABWTYNYSP-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccncc1C[N@H+](C)[C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000361444891 1044403576 /nfs/dbraw/zinc/40/35/76/1044403576.db2.gz ZSFLUABWTYNYSP-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cc(F)ccc3F)CCCC2)n1 ZINC000112711079 1044445091 /nfs/dbraw/zinc/44/50/91/1044445091.db2.gz UCCPPOSWVXSXMI-UHFFFAOYSA-N 1 2 308.397 4.289 20 0 DIADLO C[C@@H](c1ccc(-c2ccccc2)cc1)[N@H+](C)Cc1ncccn1 ZINC000361834066 1044451161 /nfs/dbraw/zinc/45/11/61/1044451161.db2.gz ROTRJVOVAKIXGJ-INIZCTEOSA-N 1 2 303.409 4.337 20 0 DIADLO Cc1ccc2c(Nc3cccc4c3OCC[C@H]4O)cccc2[nH+]1 ZINC001212798787 1044450870 /nfs/dbraw/zinc/45/08/70/1044450870.db2.gz SGKUXNUVLWKKGW-GOSISDBHSA-N 1 2 306.365 4.103 20 0 DIADLO C[C@@H](c1ccc(-c2ccccc2)cc1)[N@@H+](C)Cc1ncccn1 ZINC000361834066 1044451165 /nfs/dbraw/zinc/45/11/65/1044451165.db2.gz ROTRJVOVAKIXGJ-INIZCTEOSA-N 1 2 303.409 4.337 20 0 DIADLO Cc1cc(C)c(C[NH2+]Cc2noc(-c3cccs3)n2)c(C)c1 ZINC000294695143 1044451468 /nfs/dbraw/zinc/45/14/68/1044451468.db2.gz AWRPRXVKBYLLIB-UHFFFAOYSA-N 1 2 313.426 4.013 20 0 DIADLO C[C@H]([NH2+]Cc1ncccn1)c1ccccc1Oc1ccccc1 ZINC000361861608 1044453559 /nfs/dbraw/zinc/45/35/59/1044453559.db2.gz DFDKYTLQINJBPP-HNNXBMFYSA-N 1 2 305.381 4.120 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc(Oc2cccnc2)cc1 ZINC001202668320 1044455187 /nfs/dbraw/zinc/45/51/87/1044455187.db2.gz VTYNVRWVYBAWMY-UHFFFAOYSA-N 1 2 308.385 4.263 20 0 DIADLO Cc1cnccc1CNc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000294764935 1044456763 /nfs/dbraw/zinc/45/67/63/1044456763.db2.gz MAWRGDRQLIFXSF-UHFFFAOYSA-N 1 2 318.424 4.202 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H](C)c1csnn1 ZINC000565821107 1044459175 /nfs/dbraw/zinc/45/91/75/1044459175.db2.gz XEWCXOLGLCDYJA-ABAIWWIYSA-N 1 2 312.442 4.056 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CCC=C(c2ccccn2)C1 ZINC000565870981 1044461363 /nfs/dbraw/zinc/46/13/63/1044461363.db2.gz UMCMZINMRPOZGR-CQSZACIVSA-N 1 2 311.429 4.217 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCC=C(c2ccccn2)C1 ZINC000565870981 1044461368 /nfs/dbraw/zinc/46/13/68/1044461368.db2.gz UMCMZINMRPOZGR-CQSZACIVSA-N 1 2 311.429 4.217 20 0 DIADLO CSc1ccc(C[N@H+](C)Cc2cn3ccc(C)cc3n2)s1 ZINC001142032367 1044465082 /nfs/dbraw/zinc/46/50/82/1044465082.db2.gz ZBCQVNJRXZMUPM-UHFFFAOYSA-N 1 2 317.483 4.058 20 0 DIADLO CSc1ccc(C[N@@H+](C)Cc2cn3ccc(C)cc3n2)s1 ZINC001142032367 1044465087 /nfs/dbraw/zinc/46/50/87/1044465087.db2.gz ZBCQVNJRXZMUPM-UHFFFAOYSA-N 1 2 317.483 4.058 20 0 DIADLO CC(C)C[C@H](c1nc([C@@H](C)c2cccs2)no1)n1cc[nH+]c1 ZINC000923907060 1044466526 /nfs/dbraw/zinc/46/65/26/1044466526.db2.gz LOWHFNKAYXGXKF-QWHCGFSZSA-N 1 2 316.430 4.115 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000565968873 1044467344 /nfs/dbraw/zinc/46/73/44/1044467344.db2.gz RYJDOPAOFFLMTC-CJNGLKHVSA-N 1 2 314.454 4.158 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000565968873 1044467349 /nfs/dbraw/zinc/46/73/49/1044467349.db2.gz RYJDOPAOFFLMTC-CJNGLKHVSA-N 1 2 314.454 4.158 20 0 DIADLO CC(C)C[C@H](c1nc([C@H](C)c2cccs2)no1)n1cc[nH+]c1 ZINC000923907055 1044471493 /nfs/dbraw/zinc/47/14/93/1044471493.db2.gz LOWHFNKAYXGXKF-CHWSQXEVSA-N 1 2 316.430 4.115 20 0 DIADLO CC(C)c1nnc(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)s1 ZINC000294996411 1044477912 /nfs/dbraw/zinc/47/79/12/1044477912.db2.gz RFLYJIMIDHGFJZ-UHFFFAOYSA-N 1 2 321.877 4.484 20 0 DIADLO CC(C)([NH2+]Cc1csc(Cl)n1)c1ccc(F)c(F)c1 ZINC000295017286 1044480821 /nfs/dbraw/zinc/48/08/21/1044480821.db2.gz QAHYJAVKIIOZDQ-UHFFFAOYSA-N 1 2 302.777 4.100 20 0 DIADLO CC(C)(C)OC1CC[NH+](Cc2csc(-c3ccco3)n2)CC1 ZINC000119103455 1044488721 /nfs/dbraw/zinc/48/87/21/1044488721.db2.gz MHFZKXFRXBVEFH-UHFFFAOYSA-N 1 2 320.458 4.183 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nccn1-c1ccccc1)c1ccc(F)cn1 ZINC000348313227 1044489850 /nfs/dbraw/zinc/48/98/50/1044489850.db2.gz GNNMUMHZZWMPEO-PBHICJAKSA-N 1 2 324.403 4.208 20 0 DIADLO CC(C)[N@H+](Cc1ccco1)Cc1ncc(-c2cccc(F)c2)o1 ZINC000475531147 1044491352 /nfs/dbraw/zinc/49/13/52/1044491352.db2.gz WSBUMDDIGAMDJR-UHFFFAOYSA-N 1 2 314.360 4.484 20 0 DIADLO CC(C)[N@@H+](Cc1ccco1)Cc1ncc(-c2cccc(F)c2)o1 ZINC000475531147 1044491357 /nfs/dbraw/zinc/49/13/57/1044491357.db2.gz WSBUMDDIGAMDJR-UHFFFAOYSA-N 1 2 314.360 4.484 20 0 DIADLO CCn1ccnc1C[NH2+][C@@H](C)c1cc2cc(Cl)ccc2o1 ZINC000119326740 1044493151 /nfs/dbraw/zinc/49/31/51/1044493151.db2.gz UEDXNGRPCRJDKI-NSHDSACASA-N 1 2 303.793 4.153 20 0 DIADLO Brc1cscc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000566530465 1044495894 /nfs/dbraw/zinc/49/58/94/1044495894.db2.gz URXUTCJTDXZCSG-CQSZACIVSA-N 1 2 308.244 4.458 20 0 DIADLO Brc1cscc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000566530465 1044495899 /nfs/dbraw/zinc/49/58/99/1044495899.db2.gz URXUTCJTDXZCSG-CQSZACIVSA-N 1 2 308.244 4.458 20 0 DIADLO Brc1cscc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000566530464 1044496735 /nfs/dbraw/zinc/49/67/35/1044496735.db2.gz URXUTCJTDXZCSG-AWEZNQCLSA-N 1 2 308.244 4.458 20 0 DIADLO Brc1cscc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000566530464 1044496742 /nfs/dbraw/zinc/49/67/42/1044496742.db2.gz URXUTCJTDXZCSG-AWEZNQCLSA-N 1 2 308.244 4.458 20 0 DIADLO CC[N@H+](Cc1nc([C@H](c2ccccc2C)C(C)C)no1)C1CC1 ZINC000566587912 1044500187 /nfs/dbraw/zinc/50/01/87/1044500187.db2.gz LNTTXWXYWKAQGD-SFHVURJKSA-N 1 2 313.445 4.150 20 0 DIADLO CC[N@@H+](Cc1nc([C@H](c2ccccc2C)C(C)C)no1)C1CC1 ZINC000566587912 1044500200 /nfs/dbraw/zinc/50/02/00/1044500200.db2.gz LNTTXWXYWKAQGD-SFHVURJKSA-N 1 2 313.445 4.150 20 0 DIADLO Clc1ccc([C@@H]2CC[N@@H+]2Cc2cccc3c2OCO3)cc1 ZINC000566627029 1044504617 /nfs/dbraw/zinc/50/46/17/1044504617.db2.gz WBUSDWSVGXARIR-HNNXBMFYSA-N 1 2 301.773 4.016 20 0 DIADLO Clc1ccc([C@@H]2CC[N@H+]2Cc2cccc3c2OCO3)cc1 ZINC000566627029 1044504631 /nfs/dbraw/zinc/50/46/31/1044504631.db2.gz WBUSDWSVGXARIR-HNNXBMFYSA-N 1 2 301.773 4.016 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+]Cc1nnc(C(C)C)s1 ZINC000295293596 1044507328 /nfs/dbraw/zinc/50/73/28/1044507328.db2.gz JNTLHISKUJFSCC-LLVKDONJSA-N 1 2 307.488 4.234 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@@]34CCCC[C@@H]3C4(F)F)cc2[nH+]1 ZINC000665796276 1044510031 /nfs/dbraw/zinc/51/00/31/1044510031.db2.gz SWSNZIWZXFKOCZ-HOCLYGCPSA-N 1 2 319.355 4.025 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2nc(CC(C)C)no2)o1 ZINC000362432274 1044510948 /nfs/dbraw/zinc/51/09/48/1044510948.db2.gz YQNJCXMIAAOABX-UKRRQHHQSA-N 1 2 317.433 4.143 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2nc(CC(C)C)no2)o1 ZINC000362432274 1044510959 /nfs/dbraw/zinc/51/09/59/1044510959.db2.gz YQNJCXMIAAOABX-UKRRQHHQSA-N 1 2 317.433 4.143 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(CC(C)C)no1)c1ccc(Cl)cc1 ZINC000121005801 1044517466 /nfs/dbraw/zinc/51/74/66/1044517466.db2.gz WOACTHDUUYHRRF-AWEZNQCLSA-N 1 2 307.825 4.162 20 0 DIADLO Cc1nnc(C[NH2+][C@H](CCCc2ccccc2)c2ccccc2)o1 ZINC000121411222 1044523657 /nfs/dbraw/zinc/52/36/57/1044523657.db2.gz XIKVRZOTSWLIOS-LJQANCHMSA-N 1 2 321.424 4.232 20 0 DIADLO CSc1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)s1 ZINC000567033618 1044537237 /nfs/dbraw/zinc/53/72/37/1044537237.db2.gz PFIFPFNLABSYJD-HNNXBMFYSA-N 1 2 304.484 4.448 20 0 DIADLO CSc1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)s1 ZINC000567033618 1044537244 /nfs/dbraw/zinc/53/72/44/1044537244.db2.gz PFIFPFNLABSYJD-HNNXBMFYSA-N 1 2 304.484 4.448 20 0 DIADLO CCCC[C@H](CCC)C[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000567142186 1044545722 /nfs/dbraw/zinc/54/57/22/1044545722.db2.gz HVHUUNWULCFCSQ-RDJZCZTQSA-N 1 2 300.450 4.090 20 0 DIADLO Cc1nc(C[N@@H+]2CCOCC23CCCCC3)sc1C(C)(C)C ZINC001307771145 1044546956 /nfs/dbraw/zinc/54/69/56/1044546956.db2.gz KSWTZWMUBSXQNV-UHFFFAOYSA-N 1 2 322.518 4.284 20 0 DIADLO Cc1nc(C[N@H+]2CCOCC23CCCCC3)sc1C(C)(C)C ZINC001307771145 1044546965 /nfs/dbraw/zinc/54/69/65/1044546965.db2.gz KSWTZWMUBSXQNV-UHFFFAOYSA-N 1 2 322.518 4.284 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ncccn1)c1ccc(Cl)c(Cl)c1 ZINC000567180109 1044548410 /nfs/dbraw/zinc/54/84/10/1044548410.db2.gz AFGLBOIXRIZYAL-HNNXBMFYSA-N 1 2 310.228 4.270 20 0 DIADLO CCn1nc(C)c(CNc2cc[nH+]c3c(Cl)cccc23)c1C ZINC000567224192 1044552338 /nfs/dbraw/zinc/55/23/38/1044552338.db2.gz MDGSLUMMGZVYHW-UHFFFAOYSA-N 1 2 314.820 4.334 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc3cc(C)ccc3n1)C2 ZINC001137217269 1044562719 /nfs/dbraw/zinc/56/27/19/1044562719.db2.gz QRYKQRAISHGCDC-UHFFFAOYSA-N 1 2 304.393 4.068 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc3cc(C)ccc3n1)C2 ZINC001137217269 1044562741 /nfs/dbraw/zinc/56/27/41/1044562741.db2.gz QRYKQRAISHGCDC-UHFFFAOYSA-N 1 2 304.393 4.068 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1ccccc1Br ZINC000295977029 1044579551 /nfs/dbraw/zinc/57/95/51/1044579551.db2.gz MZTJVOUWMXHJTM-VXGBXAGGSA-N 1 2 322.250 4.077 20 0 DIADLO c1nnc([C@@H]([NH2+]Cc2ccc(C3CCC3)cc2)C2CCCCC2)[nH]1 ZINC000567560103 1044574205 /nfs/dbraw/zinc/57/42/05/1044574205.db2.gz OSJQFFPEQVMSJG-IBGZPJMESA-N 1 2 324.472 4.483 20 0 DIADLO Fc1ccccc1C[N@@H+]1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000567618638 1044579215 /nfs/dbraw/zinc/57/92/15/1044579215.db2.gz RDRXQIKJLCDXDA-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccccc1C[N@H+]1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000567618638 1044579231 /nfs/dbraw/zinc/57/92/31/1044579231.db2.gz RDRXQIKJLCDXDA-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO CC(C)c1nc([C@@H]2CCC[N@@H+]2Cc2cccc3ccoc32)no1 ZINC000567680546 1044579960 /nfs/dbraw/zinc/57/99/60/1044579960.db2.gz KZJSPFOSEBWHTE-HNNXBMFYSA-N 1 2 311.385 4.276 20 0 DIADLO CC(C)c1nc([C@@H]2CCC[N@H+]2Cc2cccc3ccoc32)no1 ZINC000567680546 1044579968 /nfs/dbraw/zinc/57/99/68/1044579968.db2.gz KZJSPFOSEBWHTE-HNNXBMFYSA-N 1 2 311.385 4.276 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000296135405 1044594114 /nfs/dbraw/zinc/59/41/14/1044594114.db2.gz VYBJBPKRRDKEJA-KXBFYZLASA-N 1 2 323.415 4.482 20 0 DIADLO CSC[C@@H]1CCCN(Cc2[nH+]c(C(C)C)n3ccccc23)C1 ZINC000568033445 1044598450 /nfs/dbraw/zinc/59/84/50/1044598450.db2.gz NFTNGCQOBHAXNH-OAHLLOKOSA-N 1 2 317.502 4.033 20 0 DIADLO OC[C@@H]([NH2+]Cc1nc(C2CCCCC2)cs1)c1ccsc1 ZINC000444689512 1044602971 /nfs/dbraw/zinc/60/29/71/1044602971.db2.gz NTFBTAZJJDOSSA-CQSZACIVSA-N 1 2 322.499 4.076 20 0 DIADLO C[N@H+](Cc1cc(F)cc(F)c1)Cc1ncccc1C(F)(F)F ZINC000444690253 1044605409 /nfs/dbraw/zinc/60/54/09/1044605409.db2.gz JFUSIFFJDNDZEP-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO C[N@@H+](Cc1cc(F)cc(F)c1)Cc1ncccc1C(F)(F)F ZINC000444690253 1044605417 /nfs/dbraw/zinc/60/54/17/1044605417.db2.gz JFUSIFFJDNDZEP-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO Brc1cccc([C@@H]2C[N@H+](CC3CCCC3)CCO2)c1 ZINC000523329521 1044608664 /nfs/dbraw/zinc/60/86/64/1044608664.db2.gz VJYNRFLVOAUFCQ-INIZCTEOSA-N 1 2 324.262 4.013 20 0 DIADLO Brc1cccc([C@@H]2C[N@@H+](CC3CCCC3)CCO2)c1 ZINC000523329521 1044608670 /nfs/dbraw/zinc/60/86/70/1044608670.db2.gz VJYNRFLVOAUFCQ-INIZCTEOSA-N 1 2 324.262 4.013 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2cccc(OCc3ccccc3)c2)no1 ZINC000444734006 1044614377 /nfs/dbraw/zinc/61/43/77/1044614377.db2.gz YBFJLWRXKYMURL-MRXNPFEDSA-N 1 2 322.408 4.413 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)[C@H](C)[N@H+](C)Cc1ccco1 ZINC000053065827 1044616810 /nfs/dbraw/zinc/61/68/10/1044616810.db2.gz CEVJEXVJYABIPA-HNNXBMFYSA-N 1 2 314.429 4.170 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)[C@H](C)[N@@H+](C)Cc1ccco1 ZINC000053065827 1044616816 /nfs/dbraw/zinc/61/68/16/1044616816.db2.gz CEVJEXVJYABIPA-HNNXBMFYSA-N 1 2 314.429 4.170 20 0 DIADLO c1nc([C@@H]2CCC[N@H+]2Cc2ccc(-c3ccccc3)cc2)no1 ZINC000523370740 1044621033 /nfs/dbraw/zinc/62/10/33/1044621033.db2.gz OGGYWTCQNWBNCJ-SFHVURJKSA-N 1 2 305.381 4.074 20 0 DIADLO c1nc([C@@H]2CCC[N@@H+]2Cc2ccc(-c3ccccc3)cc2)no1 ZINC000523370740 1044621038 /nfs/dbraw/zinc/62/10/38/1044621038.db2.gz OGGYWTCQNWBNCJ-SFHVURJKSA-N 1 2 305.381 4.074 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccco3)cc2F)c2nccn21 ZINC000296500832 1044622296 /nfs/dbraw/zinc/62/22/96/1044622296.db2.gz QAUWNMMNTKWIOS-WBMJQRKESA-N 1 2 311.360 4.078 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+]Cc2cscc2Cl)s1 ZINC000886199224 1044623614 /nfs/dbraw/zinc/62/36/14/1044623614.db2.gz OJQWHSIUYUTCOJ-UHFFFAOYSA-N 1 2 300.880 4.445 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2cscc2Cl)s1 ZINC000886199494 1044623779 /nfs/dbraw/zinc/62/37/79/1044623779.db2.gz YVYZCTOEIVPDBN-UHFFFAOYSA-N 1 2 304.893 4.011 20 0 DIADLO Fc1cc(-c2ccncc2)ccc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000886270388 1044628227 /nfs/dbraw/zinc/62/82/27/1044628227.db2.gz CEDVDDCTNNMHFO-UHFFFAOYSA-N 1 2 323.371 4.043 20 0 DIADLO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ncc(C(F)(F)F)cn2)cc1C ZINC000296600815 1044634185 /nfs/dbraw/zinc/63/41/85/1044634185.db2.gz VOUQZXGIFBUPGW-CYBMUJFWSA-N 1 2 323.362 4.271 20 0 DIADLO CCCCCCOc1ccc(C[NH2+][C@H](C)c2csnn2)cc1 ZINC000840969797 1044634914 /nfs/dbraw/zinc/63/49/14/1044634914.db2.gz KGKABROSRFLURP-CQSZACIVSA-N 1 2 319.474 4.348 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(C(F)(F)F)n1)c1cc(F)ccc1F ZINC000296629063 1044636554 /nfs/dbraw/zinc/63/65/54/1044636554.db2.gz XIVQLRPENUYAIL-VIFPVBQESA-N 1 2 316.273 4.229 20 0 DIADLO Cc1ncsc1C[N@H+](C)Cc1cc(-c2ccc(C)cc2)no1 ZINC000066565955 1044642451 /nfs/dbraw/zinc/64/24/51/1044642451.db2.gz OJZNRWWBKUNKOK-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ncsc1C[N@@H+](C)Cc1cc(-c2ccc(C)cc2)no1 ZINC000066565955 1044642461 /nfs/dbraw/zinc/64/24/61/1044642461.db2.gz OJZNRWWBKUNKOK-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO c1coc(-c2nc(C[NH2+][C@H]3CCCc4occc43)cs2)c1 ZINC000067968327 1044645747 /nfs/dbraw/zinc/64/57/47/1044645747.db2.gz WHONCUMNQOIMRS-ZDUSSCGKSA-N 1 2 300.383 4.163 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nccn2CC(F)(F)F)[C@H]1c1ccccc1 ZINC000886545289 1044658899 /nfs/dbraw/zinc/65/88/99/1044658899.db2.gz KFMGBNYXRXCZIP-XJKSGUPXSA-N 1 2 323.362 4.029 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nccn2CC(F)(F)F)[C@H]1c1ccccc1 ZINC000886545289 1044658910 /nfs/dbraw/zinc/65/89/10/1044658910.db2.gz KFMGBNYXRXCZIP-XJKSGUPXSA-N 1 2 323.362 4.029 20 0 DIADLO Clc1cccc(C[NH+]2CC3(CCC3)C2)c1Br ZINC000719571592 1044664431 /nfs/dbraw/zinc/66/44/31/1044664431.db2.gz KJVUKKIOYSDLIA-UHFFFAOYSA-N 1 2 300.627 4.088 20 0 DIADLO Clc1ccc(Br)c(C[NH+]2CC3(CCC3)C2)c1 ZINC000719565587 1044666649 /nfs/dbraw/zinc/66/66/49/1044666649.db2.gz YIRUMQQDKAKBSI-UHFFFAOYSA-N 1 2 300.627 4.088 20 0 DIADLO Cc1nc(C2CC[NH+]([C@H](C)c3c(F)cccc3F)CC2)[nH]c1C ZINC000886668136 1044676556 /nfs/dbraw/zinc/67/65/56/1044676556.db2.gz NZKGGJAACIGYEL-CYBMUJFWSA-N 1 2 319.399 4.245 20 0 DIADLO COc1cc(Cl)ccc1[C@H](C)[NH2+]Cc1cc(C2CC2)no1 ZINC000886684963 1044679697 /nfs/dbraw/zinc/67/96/97/1044679697.db2.gz XGIANRPSOWOHBP-JTQLQIEISA-N 1 2 306.793 4.065 20 0 DIADLO Fc1cccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1F ZINC000523760274 1044683410 /nfs/dbraw/zinc/68/34/10/1044683410.db2.gz MGHKJIWQTPHJHQ-INIZCTEOSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1cccc(C[N@H+]2CCSC[C@H]2c2ccccc2)c1F ZINC000523760274 1044683414 /nfs/dbraw/zinc/68/34/14/1044683414.db2.gz MGHKJIWQTPHJHQ-INIZCTEOSA-N 1 2 305.393 4.255 20 0 DIADLO C[NH+](C)[C@@H](c1nc([C@H]2CCCC(C)(C)C2)no1)c1ccccc1 ZINC000569272882 1044688266 /nfs/dbraw/zinc/68/82/66/1044688266.db2.gz ILQLGVKMKAONRP-JKSUJKDBSA-N 1 2 313.445 4.404 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000076120381 1044692035 /nfs/dbraw/zinc/69/20/35/1044692035.db2.gz QEEUDJVULKDLJE-GXTWGEPZSA-N 1 2 303.406 4.068 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000076120381 1044692038 /nfs/dbraw/zinc/69/20/38/1044692038.db2.gz QEEUDJVULKDLJE-GXTWGEPZSA-N 1 2 303.406 4.068 20 0 DIADLO Cc1cccc(C[NH2+][C@@H](CO)c2c(Cl)cccc2Cl)c1 ZINC000475625288 1044699740 /nfs/dbraw/zinc/69/97/40/1044699740.db2.gz LJTOTXBBSNGETC-HNNXBMFYSA-N 1 2 310.224 4.125 20 0 DIADLO CC(C)(C)OCC[N@@H+]1CCc2c(Cl)c(Cl)ccc2C1 ZINC000523892728 1044700127 /nfs/dbraw/zinc/70/01/27/1044700127.db2.gz FYBPEWKLUOTJDW-UHFFFAOYSA-N 1 2 302.245 4.167 20 0 DIADLO CC(C)(C)OCC[N@H+]1CCc2c(Cl)c(Cl)ccc2C1 ZINC000523892728 1044700133 /nfs/dbraw/zinc/70/01/33/1044700133.db2.gz FYBPEWKLUOTJDW-UHFFFAOYSA-N 1 2 302.245 4.167 20 0 DIADLO CC(C)([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc(F)cc1F ZINC000886901318 1044717251 /nfs/dbraw/zinc/71/72/51/1044717251.db2.gz WWDGCHPNMHNDME-UHFFFAOYSA-N 1 2 319.399 4.301 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1cncc(F)c1 ZINC000366263614 1044717149 /nfs/dbraw/zinc/71/71/49/1044717149.db2.gz ASLWYZNARJJXLK-LIRRHRJNSA-N 1 2 307.372 4.056 20 0 DIADLO Cc1ccc(C)c(NC(=O)C[N@@H+]([C@H](C)c2ccco2)C2CC2)c1 ZINC000086233020 1044731202 /nfs/dbraw/zinc/73/12/02/1044731202.db2.gz UQOOASUEPYSYSF-OAHLLOKOSA-N 1 2 312.413 4.061 20 0 DIADLO Cc1ccc(C)c(NC(=O)C[N@H+]([C@H](C)c2ccco2)C2CC2)c1 ZINC000086233020 1044731210 /nfs/dbraw/zinc/73/12/10/1044731210.db2.gz UQOOASUEPYSYSF-OAHLLOKOSA-N 1 2 312.413 4.061 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)[C@@H](C)CO1 ZINC000570149268 1044736083 /nfs/dbraw/zinc/73/60/83/1044736083.db2.gz WXOMVNXSPZJGRH-RYUDHWBXSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)[C@@H](C)CO1 ZINC000570149268 1044736097 /nfs/dbraw/zinc/73/60/97/1044736097.db2.gz WXOMVNXSPZJGRH-RYUDHWBXSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc(F)c2ccccc21 ZINC000367492038 1044741992 /nfs/dbraw/zinc/74/19/92/1044741992.db2.gz XVFUIPHBCDUNCH-SGTLLEGYSA-N 1 2 309.388 4.430 20 0 DIADLO CC[N@H+](Cc1cscn1)Cc1cccc(-c2ccncc2)c1 ZINC000367658932 1044750118 /nfs/dbraw/zinc/75/01/18/1044750118.db2.gz QZYCKNSMPYIHFJ-UHFFFAOYSA-N 1 2 309.438 4.227 20 0 DIADLO CC[N@@H+](Cc1cscn1)Cc1cccc(-c2ccncc2)c1 ZINC000367658932 1044750132 /nfs/dbraw/zinc/75/01/32/1044750132.db2.gz QZYCKNSMPYIHFJ-UHFFFAOYSA-N 1 2 309.438 4.227 20 0 DIADLO COc1c(C)cnc(C[N@H+](Cc2ccccc2F)C(C)C)c1C ZINC000524178006 1044759515 /nfs/dbraw/zinc/75/95/15/1044759515.db2.gz VHQQDSICZFXDLN-UHFFFAOYSA-N 1 2 316.420 4.257 20 0 DIADLO COc1c(C)cnc(C[N@@H+](Cc2ccccc2F)C(C)C)c1C ZINC000524178006 1044759520 /nfs/dbraw/zinc/75/95/20/1044759520.db2.gz VHQQDSICZFXDLN-UHFFFAOYSA-N 1 2 316.420 4.257 20 0 DIADLO Clc1ccc(SCc2c[nH+]cn2Cc2ccccc2)nc1 ZINC000445603138 1044766777 /nfs/dbraw/zinc/76/67/77/1044766777.db2.gz ANULVOYSKCGTPT-UHFFFAOYSA-N 1 2 315.829 4.272 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2C/C=C/c2ccc(F)c(F)c2)no1 ZINC000368565263 1044780508 /nfs/dbraw/zinc/78/05/08/1044780508.db2.gz BYMADGFKMQSOQX-WVMJFEGXSA-N 1 2 304.340 4.112 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2C/C=C/c2ccc(F)c(F)c2)no1 ZINC000368565263 1044780515 /nfs/dbraw/zinc/78/05/15/1044780515.db2.gz BYMADGFKMQSOQX-WVMJFEGXSA-N 1 2 304.340 4.112 20 0 DIADLO Fc1cccc2c1OCC[C@H]2[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000368862952 1044790680 /nfs/dbraw/zinc/79/06/80/1044790680.db2.gz MPYVBMWKWXIPJK-QGZVFWFLSA-N 1 2 324.355 4.094 20 0 DIADLO Cc1cc(C)c(CNC(=O)N2CCCC[C@H]2c2ccccc2)c[nH+]1 ZINC000459074312 1044795264 /nfs/dbraw/zinc/79/52/64/1044795264.db2.gz JZTIBKBVMOATQJ-IBGZPJMESA-N 1 2 323.440 4.135 20 0 DIADLO Cc1csc(C[NH2+][C@@H](C)c2ccc(F)cc2OC(F)F)n1 ZINC000126285054 1044809828 /nfs/dbraw/zinc/80/98/28/1044809828.db2.gz HWPPELDCKFLLGL-VIFPVBQESA-N 1 2 316.348 4.043 20 0 DIADLO CCC[N@H+](Cc1nnc(C(C)C)o1)[C@H](C)c1ccccc1OC ZINC000263725376 1044821894 /nfs/dbraw/zinc/82/18/94/1044821894.db2.gz GASQGPBELYCFTA-CQSZACIVSA-N 1 2 317.433 4.175 20 0 DIADLO CCC[N@@H+](Cc1nnc(C(C)C)o1)[C@H](C)c1ccccc1OC ZINC000263725376 1044821916 /nfs/dbraw/zinc/82/19/16/1044821916.db2.gz GASQGPBELYCFTA-CQSZACIVSA-N 1 2 317.433 4.175 20 0 DIADLO CCN(Cc1c[nH+]cn1Cc1ccccc1)c1cccc(F)c1 ZINC000445805582 1044822035 /nfs/dbraw/zinc/82/20/35/1044822035.db2.gz LZMKNYAMNZHIER-UHFFFAOYSA-N 1 2 309.388 4.097 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](Cc1nccn1CC(F)(F)F)C1CC1 ZINC000264118300 1044850072 /nfs/dbraw/zinc/85/00/72/1044850072.db2.gz UYZITISOCMXDTL-CYBMUJFWSA-N 1 2 323.362 4.171 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](Cc1nccn1CC(F)(F)F)C1CC1 ZINC000264118300 1044850094 /nfs/dbraw/zinc/85/00/94/1044850094.db2.gz UYZITISOCMXDTL-CYBMUJFWSA-N 1 2 323.362 4.171 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c(F)cccc2Br)CCC1(F)F ZINC000573527961 1044911410 /nfs/dbraw/zinc/91/14/10/1044911410.db2.gz LXWDEFXDDSEVLD-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)no1 ZINC000572666377 1044869954 /nfs/dbraw/zinc/86/99/54/1044869954.db2.gz FIXIIUCQBDBALQ-NSHDSACASA-N 1 2 304.356 4.135 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)no1 ZINC000572666377 1044869979 /nfs/dbraw/zinc/86/99/79/1044869979.db2.gz FIXIIUCQBDBALQ-NSHDSACASA-N 1 2 304.356 4.135 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@@H+](C)Cc2nc(CC(C)C)no2)c1 ZINC000524594218 1044883048 /nfs/dbraw/zinc/88/30/48/1044883048.db2.gz HUBSBVXDYSCMLF-OAHLLOKOSA-N 1 2 301.434 4.078 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2nc(CC(C)C)no2)c1 ZINC000524594218 1044883063 /nfs/dbraw/zinc/88/30/63/1044883063.db2.gz HUBSBVXDYSCMLF-OAHLLOKOSA-N 1 2 301.434 4.078 20 0 DIADLO CCOc1cc(F)ccc1NCc1cc(-n2cc[nH+]c2)cs1 ZINC000337416471 1044896890 /nfs/dbraw/zinc/89/68/90/1044896890.db2.gz ZPIHSOGDGMOJFT-UHFFFAOYSA-N 1 2 317.389 4.084 20 0 DIADLO Cc1sc([C@H]2COCC[NH2+]2)nc1-c1ccc(C(C)(C)C)cc1 ZINC000446135052 1044900502 /nfs/dbraw/zinc/90/05/02/1044900502.db2.gz DQKDFNWBLNRQPD-OAHLLOKOSA-N 1 2 316.470 4.077 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(F)cccc2Br)CCC1(F)F ZINC000573527961 1044911398 /nfs/dbraw/zinc/91/13/98/1044911398.db2.gz LXWDEFXDDSEVLD-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@@H](c1ccccc1)c1cccnc1 ZINC000372414479 1044914395 /nfs/dbraw/zinc/91/43/95/1044914395.db2.gz BHJZMWBIQKKWKM-FQEVSTJZSA-N 1 2 322.383 4.109 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)n1 ZINC000573893219 1044932315 /nfs/dbraw/zinc/93/23/15/1044932315.db2.gz OHTSVLAMDATUKQ-BJOHPYRUSA-N 1 2 323.799 4.226 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nn(-c3ccccc3)c3c2CCC3)o1 ZINC000133295436 1044935166 /nfs/dbraw/zinc/93/51/66/1044935166.db2.gz OGCNMVSWRVUBQQ-OAHLLOKOSA-N 1 2 321.424 4.113 20 0 DIADLO Cc1cccc2nc(C[N@@H+]3CC(C)(C)[C@@H]3c3cccs3)cn21 ZINC000574144597 1044940927 /nfs/dbraw/zinc/94/09/27/1044940927.db2.gz GNKPAYCTBXYRTH-KRWDZBQOSA-N 1 2 311.454 4.287 20 0 DIADLO Cc1cccc2nc(C[N@H+]3CC(C)(C)[C@@H]3c3cccs3)cn21 ZINC000574144597 1044940940 /nfs/dbraw/zinc/94/09/40/1044940940.db2.gz GNKPAYCTBXYRTH-KRWDZBQOSA-N 1 2 311.454 4.287 20 0 DIADLO Cc1nnsc1C[N@H+](Cc1cc(F)ccc1F)C1CCCC1 ZINC000574455561 1044955697 /nfs/dbraw/zinc/95/56/97/1044955697.db2.gz AFLGAWAEZPKQLT-UHFFFAOYSA-N 1 2 323.412 4.070 20 0 DIADLO Cc1nnsc1C[N@@H+](Cc1cc(F)ccc1F)C1CCCC1 ZINC000574455561 1044955708 /nfs/dbraw/zinc/95/57/08/1044955708.db2.gz AFLGAWAEZPKQLT-UHFFFAOYSA-N 1 2 323.412 4.070 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(Cl)c1Cl)c1ccncc1F ZINC000337950292 1044968711 /nfs/dbraw/zinc/96/87/11/1044968711.db2.gz QMNZUZHOMCQSRP-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO CC[C@](C)([NH2+]Cc1cc(F)c(F)cc1F)c1nc(C)cs1 ZINC000136217560 1044985168 /nfs/dbraw/zinc/98/51/68/1044985168.db2.gz QQSWAPSVUVILKW-HNNXBMFYSA-N 1 2 314.376 4.284 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+]C2(c3ccccc3)CCC2)n1 ZINC000136346321 1044985229 /nfs/dbraw/zinc/98/52/29/1044985229.db2.gz BJCAZWKMEMSVBZ-CYBMUJFWSA-N 1 2 317.458 4.053 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)cs1 ZINC000575220744 1044992285 /nfs/dbraw/zinc/99/22/85/1044992285.db2.gz VSUQCYIIOFRNJJ-LBPRGKRZSA-N 1 2 302.434 4.209 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)cs1 ZINC000575220744 1044992307 /nfs/dbraw/zinc/99/23/07/1044992307.db2.gz VSUQCYIIOFRNJJ-LBPRGKRZSA-N 1 2 302.434 4.209 20 0 DIADLO C=Cc1ccc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)cc1 ZINC000373619591 1044992619 /nfs/dbraw/zinc/99/26/19/1044992619.db2.gz SXPPCUPKLHXUKW-UHFFFAOYSA-N 1 2 303.365 4.280 20 0 DIADLO C[C@@H]1C[N@@H+]([C@H]2C[C@H]2c2cccc(F)c2)C[C@@H](c2ccsc2)O1 ZINC000411313754 1044996143 /nfs/dbraw/zinc/99/61/43/1044996143.db2.gz CEJNFKJLURKOFY-IEGACIPQSA-N 1 2 317.429 4.205 20 0 DIADLO C[C@@H]1C[N@H+]([C@H]2C[C@H]2c2cccc(F)c2)C[C@@H](c2ccsc2)O1 ZINC000411313754 1044996152 /nfs/dbraw/zinc/99/61/52/1044996152.db2.gz CEJNFKJLURKOFY-IEGACIPQSA-N 1 2 317.429 4.205 20 0 DIADLO FC1(F)CC[C@H](C[N@@H+]2CCO[C@@H](c3ccccc3Cl)C2)C1 ZINC000575436167 1045001597 /nfs/dbraw/zinc/00/15/97/1045001597.db2.gz LFWPMYPDLLRUFQ-SWLSCSKDSA-N 1 2 315.791 4.149 20 0 DIADLO FC1(F)CC[C@H](C[N@H+]2CCO[C@@H](c3ccccc3Cl)C2)C1 ZINC000575436167 1045001610 /nfs/dbraw/zinc/00/16/10/1045001610.db2.gz LFWPMYPDLLRUFQ-SWLSCSKDSA-N 1 2 315.791 4.149 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1ccc(Cl)cc1 ZINC000373699200 1045003634 /nfs/dbraw/zinc/00/36/34/1045003634.db2.gz WCMPJKPHVZYNPW-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO CCCc1csc(C[NH2+]Cc2cc3cc(C)ccc3o2)n1 ZINC000575883277 1045015334 /nfs/dbraw/zinc/01/53/34/1045015334.db2.gz MFIUXLDALRLJIQ-UHFFFAOYSA-N 1 2 300.427 4.440 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCOC[C@H]2c2ccccc2)cc1 ZINC000525269653 1045021013 /nfs/dbraw/zinc/02/10/13/1045021013.db2.gz PJHNOSKXIZBITF-KRWDZBQOSA-N 1 2 321.342 4.279 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCOC[C@H]2c2ccccc2)cc1 ZINC000525269653 1045021024 /nfs/dbraw/zinc/02/10/24/1045021024.db2.gz PJHNOSKXIZBITF-KRWDZBQOSA-N 1 2 321.342 4.279 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](CCSC1CCCCC1)C2 ZINC000411967462 1045040942 /nfs/dbraw/zinc/04/09/42/1045040942.db2.gz ZJVVGHHHAPDGOU-UHFFFAOYSA-N 1 2 303.471 4.271 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](CCSC1CCCCC1)C2 ZINC000411967462 1045040957 /nfs/dbraw/zinc/04/09/57/1045040957.db2.gz ZJVVGHHHAPDGOU-UHFFFAOYSA-N 1 2 303.471 4.271 20 0 DIADLO C[C@H](C[N@H+](C)Cc1noc(C2CCCCC2)n1)c1ccccc1 ZINC000446828936 1045048932 /nfs/dbraw/zinc/04/89/32/1045048932.db2.gz BDBIMSRCUKDYCO-OAHLLOKOSA-N 1 2 313.445 4.353 20 0 DIADLO C[C@H](C[N@@H+](C)Cc1noc(C2CCCCC2)n1)c1ccccc1 ZINC000446828936 1045048940 /nfs/dbraw/zinc/04/89/40/1045048940.db2.gz BDBIMSRCUKDYCO-OAHLLOKOSA-N 1 2 313.445 4.353 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2nc(C)sc2C)cc1Cl ZINC000412039311 1045051555 /nfs/dbraw/zinc/05/15/55/1045051555.db2.gz KGLXXCTXFAOASL-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2nc(C)sc2C)cc1Cl ZINC000412039311 1045051570 /nfs/dbraw/zinc/05/15/70/1045051570.db2.gz KGLXXCTXFAOASL-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2nc(C3CC3)cs2)cc1Cl ZINC000412044469 1045052289 /nfs/dbraw/zinc/05/22/89/1045052289.db2.gz QOPXRFZDZKHREI-UHFFFAOYSA-N 1 2 322.861 4.315 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2nc(C3CC3)cs2)cc1Cl ZINC000412044469 1045052304 /nfs/dbraw/zinc/05/23/04/1045052304.db2.gz QOPXRFZDZKHREI-UHFFFAOYSA-N 1 2 322.861 4.315 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(C2CC2)s1)c1nccn1-c1ccccc1 ZINC000576425677 1045056496 /nfs/dbraw/zinc/05/64/96/1045056496.db2.gz DZUHOMWOFVWBMD-CYBMUJFWSA-N 1 2 324.453 4.057 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2)N(c2cc(N3CCCCC3)[nH+]cn2)C1 ZINC000576538504 1045064833 /nfs/dbraw/zinc/06/48/33/1045064833.db2.gz JRTNLJVXQHOBJZ-WMZOPIPTSA-N 1 2 322.456 4.054 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2)N(c2cc(N3CCCCC3)nc[nH+]2)C1 ZINC000576538504 1045064843 /nfs/dbraw/zinc/06/48/43/1045064843.db2.gz JRTNLJVXQHOBJZ-WMZOPIPTSA-N 1 2 322.456 4.054 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1cnc(C2CCCCC2)s1 ZINC000576582528 1045066031 /nfs/dbraw/zinc/06/60/31/1045066031.db2.gz XDWXIYUIAQJCTH-CYBMUJFWSA-N 1 2 318.490 4.258 20 0 DIADLO CC(C)[C@@]1(CO)CCCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000576602212 1045068411 /nfs/dbraw/zinc/06/84/11/1045068411.db2.gz ZVMGLCDOALGHLU-SFHVURJKSA-N 1 2 318.848 4.123 20 0 DIADLO Cc1nnc([C@H](C)[NH+]2CCC(c3cccc(F)c3F)CC2)s1 ZINC000374914261 1045098539 /nfs/dbraw/zinc/09/85/39/1045098539.db2.gz NIQGEPVSYCMITG-JTQLQIEISA-N 1 2 323.412 4.065 20 0 DIADLO Cc1ccc(C[S@](=O)Cc2ccc(C)[nH+]c2C)c(Cl)c1 ZINC000447105363 1045099183 /nfs/dbraw/zinc/09/91/83/1045099183.db2.gz GODASXUAUMLHGD-HXUWFJFHSA-N 1 2 307.846 4.109 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2noc(C(C)(C)C)n2)c1C ZINC000525637733 1045104501 /nfs/dbraw/zinc/10/45/01/1045104501.db2.gz AVDYXJDBFCLRGN-INIZCTEOSA-N 1 2 313.445 4.321 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2noc(C(C)(C)C)n2)c1C ZINC000525637733 1045104506 /nfs/dbraw/zinc/10/45/06/1045104506.db2.gz AVDYXJDBFCLRGN-INIZCTEOSA-N 1 2 313.445 4.321 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@@H](C)C2)no1 ZINC000525638873 1045104614 /nfs/dbraw/zinc/10/46/14/1045104614.db2.gz HAVLIIYOQGUPRE-DOTOQJQBSA-N 1 2 313.445 4.038 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@@H](c3ccccc3)[C@@H](C)C2)no1 ZINC000525638873 1045104620 /nfs/dbraw/zinc/10/46/20/1045104620.db2.gz HAVLIIYOQGUPRE-DOTOQJQBSA-N 1 2 313.445 4.038 20 0 DIADLO CCCCn1c(S[C@H](C)C(C)C)nnc1[C@H](CC)[NH+](C)C ZINC000412984846 1045116557 /nfs/dbraw/zinc/11/65/57/1045116557.db2.gz QNDHQKQNQZIIHN-KGLIPLIRSA-N 1 2 312.527 4.228 20 0 DIADLO CC(C)[N@H+](Cc1nnc(C(C)(C)C)o1)Cc1cccc(Cl)c1 ZINC000047959191 1045118397 /nfs/dbraw/zinc/11/83/97/1045118397.db2.gz KZZAZSSMLOHGCQ-UHFFFAOYSA-N 1 2 321.852 4.431 20 0 DIADLO CC(C)[N@@H+](Cc1nnc(C(C)(C)C)o1)Cc1cccc(Cl)c1 ZINC000047959191 1045118403 /nfs/dbraw/zinc/11/84/03/1045118403.db2.gz KZZAZSSMLOHGCQ-UHFFFAOYSA-N 1 2 321.852 4.431 20 0 DIADLO CCCc1csc(C[N@@H+]2CCC[C@@H]2c2cccc(C)n2)n1 ZINC000577330746 1045118458 /nfs/dbraw/zinc/11/84/58/1045118458.db2.gz WHQMAOREZRZHSV-MRXNPFEDSA-N 1 2 301.459 4.136 20 0 DIADLO CCCc1csc(C[N@H+]2CCC[C@@H]2c2cccc(C)n2)n1 ZINC000577330746 1045118464 /nfs/dbraw/zinc/11/84/64/1045118464.db2.gz WHQMAOREZRZHSV-MRXNPFEDSA-N 1 2 301.459 4.136 20 0 DIADLO CC(=O)c1cc(C[N@@H+](Cc2ccc(C(C)C)cc2)C2CC2)on1 ZINC000577461045 1045125481 /nfs/dbraw/zinc/12/54/81/1045125481.db2.gz PSXJMFPRPSIVHL-UHFFFAOYSA-N 1 2 312.413 4.165 20 0 DIADLO CC(=O)c1cc(C[N@H+](Cc2ccc(C(C)C)cc2)C2CC2)on1 ZINC000577461045 1045125489 /nfs/dbraw/zinc/12/54/89/1045125489.db2.gz PSXJMFPRPSIVHL-UHFFFAOYSA-N 1 2 312.413 4.165 20 0 DIADLO Clc1cc(C[NH2+]Cc2ccc3c(n2)CCC3)c(Cl)s1 ZINC000577467540 1045126403 /nfs/dbraw/zinc/12/64/03/1045126403.db2.gz LZOZUVGJZRUYPA-UHFFFAOYSA-N 1 2 313.253 4.228 20 0 DIADLO Clc1ccc2cc3n(c2c1)CC[N@@H+](CC[C@@H]1CCCCO1)C3 ZINC000447400961 1045129898 /nfs/dbraw/zinc/12/98/98/1045129898.db2.gz UDOZPUBNDKZVHZ-KRWDZBQOSA-N 1 2 318.848 4.070 20 0 DIADLO Clc1ccc2cc3n(c2c1)CC[N@H+](CC[C@@H]1CCCCO1)C3 ZINC000447400961 1045129902 /nfs/dbraw/zinc/12/99/02/1045129902.db2.gz UDOZPUBNDKZVHZ-KRWDZBQOSA-N 1 2 318.848 4.070 20 0 DIADLO CCC[N@H+](Cc1nnc(-c2ccccc2Cl)o1)CC1(F)CC1 ZINC000525977385 1045139982 /nfs/dbraw/zinc/13/99/82/1045139982.db2.gz QQIQLSVCRJISNM-UHFFFAOYSA-N 1 2 323.799 4.104 20 0 DIADLO CCC[N@@H+](Cc1nnc(-c2ccccc2Cl)o1)CC1(F)CC1 ZINC000525977385 1045139987 /nfs/dbraw/zinc/13/99/87/1045139987.db2.gz QQIQLSVCRJISNM-UHFFFAOYSA-N 1 2 323.799 4.104 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(Oc2ccccc2)cc1)n1cc[nH+]c1 ZINC000577778949 1045168858 /nfs/dbraw/zinc/16/88/58/1045168858.db2.gz KPKRGWROCJYNBU-HNNXBMFYSA-N 1 2 321.380 4.265 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@H+](Cc2coc(-c3ccccc3)n2)C1 ZINC000577772475 1045168892 /nfs/dbraw/zinc/16/88/92/1045168892.db2.gz VWHQQNPNMIWDBS-HXUWFJFHSA-N 1 2 322.383 4.412 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@@H+](Cc2coc(-c3ccccc3)n2)C1 ZINC000577772475 1045168900 /nfs/dbraw/zinc/16/89/00/1045168900.db2.gz VWHQQNPNMIWDBS-HXUWFJFHSA-N 1 2 322.383 4.412 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1ccc(Cl)cc1Cl ZINC000924536421 1045174348 /nfs/dbraw/zinc/17/43/48/1045174348.db2.gz UBAGKDQPPXHJJO-ZDUSSCGKSA-N 1 2 311.212 4.457 20 0 DIADLO FC(F)(F)c1ncc(C[N@H+](Cc2cccs2)C2CC2)s1 ZINC000447794764 1045175139 /nfs/dbraw/zinc/17/51/39/1045175139.db2.gz KEEWASNXSXSHSA-UHFFFAOYSA-N 1 2 318.389 4.388 20 0 DIADLO FC(F)(F)c1ncc(C[N@@H+](Cc2cccs2)C2CC2)s1 ZINC000447794764 1045175143 /nfs/dbraw/zinc/17/51/43/1045175143.db2.gz KEEWASNXSXSHSA-UHFFFAOYSA-N 1 2 318.389 4.388 20 0 DIADLO C=Cn1cc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)cn1 ZINC000447798164 1045176882 /nfs/dbraw/zinc/17/68/82/1045176882.db2.gz SCJWFPWGMXFWNK-UHFFFAOYSA-N 1 2 307.397 4.087 20 0 DIADLO C=Cn1cc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)cn1 ZINC000447798164 1045176886 /nfs/dbraw/zinc/17/68/86/1045176886.db2.gz SCJWFPWGMXFWNK-UHFFFAOYSA-N 1 2 307.397 4.087 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(COCc2ccccc2)cc1)c1ncco1 ZINC000924659487 1045187910 /nfs/dbraw/zinc/18/79/10/1045187910.db2.gz LPVMZONXMFOTMY-INIZCTEOSA-N 1 2 322.408 4.242 20 0 DIADLO CCOc1cc(C)ccc1C[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000447897466 1045188303 /nfs/dbraw/zinc/18/83/03/1045188303.db2.gz NBVZMNMLYHLUIR-UHFFFAOYSA-N 1 2 318.486 4.438 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+]Cc2ccc3ccccc3n2)s1 ZINC000447933832 1045192358 /nfs/dbraw/zinc/19/23/58/1045192358.db2.gz VJTHIUXPOUWJBF-UHFFFAOYSA-N 1 2 311.454 4.279 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2ccccc2)o1)c1cn2c(n1)CCCC2 ZINC000924718125 1045193436 /nfs/dbraw/zinc/19/34/36/1045193436.db2.gz RMEMNEVDIMFESA-HNNXBMFYSA-N 1 2 321.424 4.330 20 0 DIADLO CCC[C@@H]([NH2+]Cc1cccc2c1OCO2)c1ncccc1Cl ZINC000924732956 1045194290 /nfs/dbraw/zinc/19/42/90/1045194290.db2.gz BRABEOQYPNDSJV-CQSZACIVSA-N 1 2 318.804 4.095 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2)o1)c1cn2c(n1)CCCC2 ZINC000924718127 1045195401 /nfs/dbraw/zinc/19/54/01/1045195401.db2.gz RMEMNEVDIMFESA-OAHLLOKOSA-N 1 2 321.424 4.330 20 0 DIADLO CCn1nc(C)c([C@@H](C)[NH2+][C@@H](C)c2oc3ccccc3c2C)n1 ZINC000924773329 1045198567 /nfs/dbraw/zinc/19/85/67/1045198567.db2.gz OTBUSEMMIUBFQN-OCCSQVGLSA-N 1 2 312.417 4.073 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H](C)c2ncco2)ccc1OCC(C)C ZINC000924815412 1045200963 /nfs/dbraw/zinc/20/09/63/1045200963.db2.gz QEDQDGGBYWZXRH-UONOGXRCSA-N 1 2 318.417 4.130 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@@H]1CCOc2c(Cl)cccc21 ZINC000924823818 1045201464 /nfs/dbraw/zinc/20/14/64/1045201464.db2.gz CWEJLBXWLCDPEI-KGLIPLIRSA-N 1 2 318.804 4.127 20 0 DIADLO Cc1cc(NC(=O)N2CCCC3(CCCCC3)CC2)c(C)c[nH+]1 ZINC000527305243 1045213145 /nfs/dbraw/zinc/21/31/45/1045213145.db2.gz CMYPGTKDOHGRSC-UHFFFAOYSA-N 1 2 315.461 4.089 20 0 DIADLO FCc1ccc(C[NH2+][C@H](c2nccs2)c2ccccc2)cc1 ZINC000777539870 1045214991 /nfs/dbraw/zinc/21/49/91/1045214991.db2.gz FOTKYIFBNSJOCT-KRWDZBQOSA-N 1 2 312.413 4.492 20 0 DIADLO Cc1cscc1-c1noc(-c2cc(C)ccc2-n2cc[nH+]c2)n1 ZINC000578174314 1045217113 /nfs/dbraw/zinc/21/71/13/1045217113.db2.gz SYKRKAIXZDZKPR-UHFFFAOYSA-N 1 2 322.393 4.268 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1nccn1C)c1ccccc1)c1cccc(F)c1 ZINC000527348637 1045217553 /nfs/dbraw/zinc/21/75/53/1045217553.db2.gz LDGAGQWHOYSGDN-RBUKOAKNSA-N 1 2 323.415 4.390 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccnn2CC2CCC2)cs1 ZINC000925034042 1045220025 /nfs/dbraw/zinc/22/00/25/1045220025.db2.gz POOHUINCOGEVIT-OLZOCXBDSA-N 1 2 318.490 4.114 20 0 DIADLO C[N@H+](CCOc1ccccc1F)Cc1ncc(C(C)(C)C)s1 ZINC000448220132 1045220471 /nfs/dbraw/zinc/22/04/71/1045220471.db2.gz MAANLSSUQOKKRG-UHFFFAOYSA-N 1 2 322.449 4.091 20 0 DIADLO C[N@@H+](CCOc1ccccc1F)Cc1ncc(C(C)(C)C)s1 ZINC000448220132 1045220485 /nfs/dbraw/zinc/22/04/85/1045220485.db2.gz MAANLSSUQOKKRG-UHFFFAOYSA-N 1 2 322.449 4.091 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ncc(C(C)(C)C)s2)cc1 ZINC000448220866 1045220534 /nfs/dbraw/zinc/22/05/34/1045220534.db2.gz SXQDBHPMQBKEII-UHFFFAOYSA-N 1 2 304.459 4.081 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ncc(C(C)(C)C)s2)cc1 ZINC000448220866 1045220541 /nfs/dbraw/zinc/22/05/41/1045220541.db2.gz SXQDBHPMQBKEII-UHFFFAOYSA-N 1 2 304.459 4.081 20 0 DIADLO CCn1nc(C)c([C@@H](C)[NH2+][C@H](c2ccccc2Cl)C(C)C)n1 ZINC000925076989 1045224863 /nfs/dbraw/zinc/22/48/63/1045224863.db2.gz QVRUVRFWDFUFRV-WBMJQRKESA-N 1 2 320.868 4.308 20 0 DIADLO Cc1ccccc1C[C@@H]([NH2+]Cc1ccn(C(C)C)n1)c1ccco1 ZINC000925106288 1045228070 /nfs/dbraw/zinc/22/80/70/1045228070.db2.gz NBLZYCAASLRKJV-LJQANCHMSA-N 1 2 323.440 4.439 20 0 DIADLO CC1(C)C[N@H+](Cc2cscc2C(F)(F)F)[C@@H]1[C@H]1CCCO1 ZINC000578288032 1045228884 /nfs/dbraw/zinc/22/88/84/1045228884.db2.gz HOJISHKJVXSMOE-CHWSQXEVSA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2cscc2C(F)(F)F)[C@@H]1[C@H]1CCCO1 ZINC000578288032 1045228889 /nfs/dbraw/zinc/22/88/89/1045228889.db2.gz HOJISHKJVXSMOE-CHWSQXEVSA-N 1 2 319.392 4.156 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@@H](C)c2cc(O)cc(F)c2)on1 ZINC000925159037 1045230662 /nfs/dbraw/zinc/23/06/62/1045230662.db2.gz WKEPWFZNRBEOFJ-NSHDSACASA-N 1 2 306.381 4.274 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@@H]2CCc3c2nccc3Cl)on1 ZINC000925157239 1045231520 /nfs/dbraw/zinc/23/15/20/1045231520.db2.gz QHYYIEKJJPSALM-OAHLLOKOSA-N 1 2 319.836 4.404 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ncc(C(C)(C)C)s2)C1 ZINC000448336304 1045234913 /nfs/dbraw/zinc/23/49/13/1045234913.db2.gz BPQDQBSADWNAHS-ZFWWWQNUSA-N 1 2 315.486 4.419 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ncc(C(C)(C)C)s2)C1 ZINC000448336304 1045234917 /nfs/dbraw/zinc/23/49/17/1045234917.db2.gz BPQDQBSADWNAHS-ZFWWWQNUSA-N 1 2 315.486 4.419 20 0 DIADLO Clc1cccc2c(N3CCO[C@@H](c4ccccc4)C3)cc[nH+]c12 ZINC000578388163 1045237252 /nfs/dbraw/zinc/23/72/52/1045237252.db2.gz QHALLYGJUDIUGI-GOSISDBHSA-N 1 2 324.811 4.466 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@H+](Cc2nc3ccccc3s2)C1 ZINC000578455124 1045244149 /nfs/dbraw/zinc/24/41/49/1045244149.db2.gz RFBVYBBDBNQGEZ-GOSISDBHSA-N 1 2 312.413 4.367 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@@H+](Cc2nc3ccccc3s2)C1 ZINC000578455124 1045244161 /nfs/dbraw/zinc/24/41/61/1045244161.db2.gz RFBVYBBDBNQGEZ-GOSISDBHSA-N 1 2 312.413 4.367 20 0 DIADLO Cc1cccc(F)c1C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000779070699 1045245403 /nfs/dbraw/zinc/24/54/03/1045245403.db2.gz HUCVKGNZSPOWDR-FQEVSTJZSA-N 1 2 306.384 4.408 20 0 DIADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ccsc1Br ZINC000527708397 1045251033 /nfs/dbraw/zinc/25/10/33/1045251033.db2.gz GVXMPHHHGGTPKF-RNCFNFMXSA-N 1 2 324.243 4.122 20 0 DIADLO c1oc(-c2ccccc2)nc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000527773206 1045263013 /nfs/dbraw/zinc/26/30/13/1045263013.db2.gz PYKMRJBAPYBTFT-IBGZPJMESA-N 1 2 319.408 4.368 20 0 DIADLO CCS[C@@H]1CCC[C@@H]([NH2+][C@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC000578706151 1045267628 /nfs/dbraw/zinc/26/76/28/1045267628.db2.gz NHEFBWMNAMRYKB-OAGGEKHMSA-N 1 2 322.522 4.080 20 0 DIADLO Clc1cccc2c(N3CCC[C@H]3[C@@H]3CCCOC3)cc[nH+]c12 ZINC000578763857 1045269961 /nfs/dbraw/zinc/26/99/61/1045269961.db2.gz OMJMNUSYIGBLRF-CJNGLKHVSA-N 1 2 316.832 4.284 20 0 DIADLO CC(C)c1cccc([C@@H](C)[NH2+][C@H](CO)c2c(F)cccc2F)c1 ZINC000527872257 1045271185 /nfs/dbraw/zinc/27/11/85/1045271185.db2.gz VWDLUVYARLODTM-FZKQIMNGSA-N 1 2 319.395 4.472 20 0 DIADLO Cc1cc(N2CCCn3c(cc4ccccc43)C2)nc(C(C)C)[nH+]1 ZINC000578812727 1045274348 /nfs/dbraw/zinc/27/43/48/1045274348.db2.gz RDJPKYYGLKVWDB-UHFFFAOYSA-N 1 2 320.440 4.273 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncn(-c2ccccc2)n1)c1cc(C)ccc1C ZINC000527900945 1045279801 /nfs/dbraw/zinc/27/98/01/1045279801.db2.gz IKJYFCQSOYNNGX-LJQANCHMSA-N 1 2 320.440 4.125 20 0 DIADLO Cc1ccccc1[C@H]1CN(c2[nH+]ccc3ccccc32)CCO1 ZINC000527904909 1045279909 /nfs/dbraw/zinc/27/99/09/1045279909.db2.gz MZHWGOWUGAXMNC-LJQANCHMSA-N 1 2 304.393 4.121 20 0 DIADLO CC(C)c1nc(C2CCN(c3[nH+]ccc4ccccc43)CC2)no1 ZINC000528029727 1045294894 /nfs/dbraw/zinc/29/48/94/1045294894.db2.gz KBKRJMOINPJBOR-UHFFFAOYSA-N 1 2 322.412 4.125 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccncc1F ZINC000579148287 1045296708 /nfs/dbraw/zinc/29/67/08/1045296708.db2.gz KHHRXIVMNOVTEZ-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117562516 1045306849 /nfs/dbraw/zinc/30/68/49/1045306849.db2.gz RDDCLPXAJDYHII-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2cnc(-c3c(F)cccc3F)s2)C1 ZINC000449041976 1045339322 /nfs/dbraw/zinc/33/93/22/1045339322.db2.gz PSNQVEVXBMXDFJ-HNNXBMFYSA-N 1 2 312.360 4.022 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2cnc(-c3c(F)cccc3F)s2)C1 ZINC000449041976 1045339324 /nfs/dbraw/zinc/33/93/24/1045339324.db2.gz PSNQVEVXBMXDFJ-HNNXBMFYSA-N 1 2 312.360 4.022 20 0 DIADLO CCSCc1cc[nH+]c(NCc2ccnn2C2CCCC2)c1 ZINC000449214880 1045363558 /nfs/dbraw/zinc/36/35/58/1045363558.db2.gz MNLVKEPRBASCSC-UHFFFAOYSA-N 1 2 316.474 4.258 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1ccnn1C1CCCC1 ZINC000449221984 1045364794 /nfs/dbraw/zinc/36/47/94/1045364794.db2.gz LEFSXGIMQDESGC-UHFFFAOYSA-N 1 2 314.433 4.183 20 0 DIADLO CC[C@@]1(CO)CCC[N@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449260179 1045372676 /nfs/dbraw/zinc/37/26/76/1045372676.db2.gz VACZMPHJLBSNNB-CYBMUJFWSA-N 1 2 308.274 4.039 20 0 DIADLO CC[C@@]1(CO)CCC[N@@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449260179 1045372680 /nfs/dbraw/zinc/37/26/80/1045372680.db2.gz VACZMPHJLBSNNB-CYBMUJFWSA-N 1 2 308.274 4.039 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cs1 ZINC000449318318 1045376176 /nfs/dbraw/zinc/37/61/76/1045376176.db2.gz FYPNOKQDORUYNM-HNNXBMFYSA-N 1 2 317.458 4.434 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cs1 ZINC000449318318 1045376178 /nfs/dbraw/zinc/37/61/78/1045376178.db2.gz FYPNOKQDORUYNM-HNNXBMFYSA-N 1 2 317.458 4.434 20 0 DIADLO FC(F)OC[C@@H]1CC[N@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449318497 1045376309 /nfs/dbraw/zinc/37/63/09/1045376309.db2.gz DMQNSZAJLPKWSJ-SSDOTTSWSA-N 1 2 316.200 4.116 20 0 DIADLO FC(F)OC[C@@H]1CC[N@@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449318497 1045376311 /nfs/dbraw/zinc/37/63/11/1045376311.db2.gz DMQNSZAJLPKWSJ-SSDOTTSWSA-N 1 2 316.200 4.116 20 0 DIADLO CCc1noc(C)c1C[NH2+]Cc1cc(Cl)sc1Cl ZINC000449337486 1045382083 /nfs/dbraw/zinc/38/20/83/1045382083.db2.gz BNXGJNNEKKGUFP-UHFFFAOYSA-N 1 2 305.230 4.204 20 0 DIADLO Oc1cccc(C[NH2+]Cc2cc(C3CC3)ccc2F)c1Cl ZINC000449373851 1045384223 /nfs/dbraw/zinc/38/42/23/1045384223.db2.gz UXVCKNAZKBZNIK-UHFFFAOYSA-N 1 2 305.780 4.352 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CCc2nc(C(C)(C)C)ncc2C1 ZINC000528590397 1045384993 /nfs/dbraw/zinc/38/49/93/1045384993.db2.gz CVQAQLVBAPKADK-CYBMUJFWSA-N 1 2 313.420 4.033 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+]1CCc2nc(C(C)(C)C)ncc2C1 ZINC000528590397 1045384997 /nfs/dbraw/zinc/38/49/97/1045384997.db2.gz CVQAQLVBAPKADK-CYBMUJFWSA-N 1 2 313.420 4.033 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(Cl)s2)CC[C@@H]1C(F)(F)F ZINC000190166662 1045385813 /nfs/dbraw/zinc/38/58/13/1045385813.db2.gz URGBULZANULJSC-VIFPVBQESA-N 1 2 312.788 4.207 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(Cl)s2)CC[C@@H]1C(F)(F)F ZINC000190166662 1045385817 /nfs/dbraw/zinc/38/58/17/1045385817.db2.gz URGBULZANULJSC-VIFPVBQESA-N 1 2 312.788 4.207 20 0 DIADLO Cn1ccnc1[C@@H]1[N@H+](Cc2ccc3ccccc3c2)CC1(C)C ZINC000449414306 1045388276 /nfs/dbraw/zinc/38/82/76/1045388276.db2.gz VUQLWKLIHUJPRA-SFHVURJKSA-N 1 2 305.425 4.156 20 0 DIADLO Cn1ccnc1[C@@H]1[N@@H+](Cc2ccc3ccccc3c2)CC1(C)C ZINC000449414306 1045388280 /nfs/dbraw/zinc/38/82/80/1045388280.db2.gz VUQLWKLIHUJPRA-SFHVURJKSA-N 1 2 305.425 4.156 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1nc2ccccc2o1 ZINC000528653832 1045391356 /nfs/dbraw/zinc/39/13/56/1045391356.db2.gz ADNGNTHRQMCQIG-SCLBCKFNSA-N 1 2 307.397 4.415 20 0 DIADLO Clc1cnc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c(Cl)c1 ZINC000528660042 1045392868 /nfs/dbraw/zinc/39/28/68/1045392868.db2.gz PEJMYXHOCJREBZ-MRXNPFEDSA-N 1 2 322.239 4.414 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCc2nc(C3CC3)ncc2C1 ZINC000528733119 1045405559 /nfs/dbraw/zinc/40/55/59/1045405559.db2.gz IXFZOJMROITSGL-GFCCVEGCSA-N 1 2 313.832 4.127 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCc2nc(C3CC3)ncc2C1 ZINC000528733119 1045405562 /nfs/dbraw/zinc/40/55/62/1045405562.db2.gz IXFZOJMROITSGL-GFCCVEGCSA-N 1 2 313.832 4.127 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2cc(Cl)sc2Cl)CC1(C)C ZINC000449506126 1045406031 /nfs/dbraw/zinc/40/60/31/1045406031.db2.gz YHKPRJBTWKEIDY-SNVBAGLBSA-N 1 2 308.274 4.302 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2cc(Cl)sc2Cl)CC1(C)C ZINC000449506126 1045406032 /nfs/dbraw/zinc/40/60/32/1045406032.db2.gz YHKPRJBTWKEIDY-SNVBAGLBSA-N 1 2 308.274 4.302 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CC=C(c3ccc(Cl)cc3C)CC2)o1 ZINC000528742122 1045407956 /nfs/dbraw/zinc/40/79/56/1045407956.db2.gz SAXRUHIQFRCDIX-LBPRGKRZSA-N 1 2 317.820 4.190 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CC=C(c3ccc(Cl)cc3C)CC2)o1 ZINC000528742122 1045407957 /nfs/dbraw/zinc/40/79/57/1045407957.db2.gz SAXRUHIQFRCDIX-LBPRGKRZSA-N 1 2 317.820 4.190 20 0 DIADLO CCc1nc(C)c(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)o1 ZINC000528799405 1045416955 /nfs/dbraw/zinc/41/69/55/1045416955.db2.gz TVBROLZPKSMPPT-UHFFFAOYSA-N 1 2 324.346 4.123 20 0 DIADLO CCc1nc(C)c(C[N@H+]2CCc3cccc(C(F)(F)F)c3C2)o1 ZINC000528799405 1045416959 /nfs/dbraw/zinc/41/69/59/1045416959.db2.gz TVBROLZPKSMPPT-UHFFFAOYSA-N 1 2 324.346 4.123 20 0 DIADLO c1coc([C@H]2[N@H+](Cc3cnn(-c4ccccc4)c3)CC23CCC3)c1 ZINC000449629085 1045422114 /nfs/dbraw/zinc/42/21/14/1045422114.db2.gz DWDLXWUDHSKOPJ-LJQANCHMSA-N 1 2 319.408 4.193 20 0 DIADLO c1coc([C@H]2[N@@H+](Cc3cnn(-c4ccccc4)c3)CC23CCC3)c1 ZINC000449629085 1045422120 /nfs/dbraw/zinc/42/21/20/1045422120.db2.gz DWDLXWUDHSKOPJ-LJQANCHMSA-N 1 2 319.408 4.193 20 0 DIADLO COc1ccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)cc1OC ZINC000449636844 1045424545 /nfs/dbraw/zinc/42/45/45/1045424545.db2.gz XGUROMCWRCFVLS-GOSISDBHSA-N 1 2 313.397 4.024 20 0 DIADLO COc1ccc(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)cc1OC ZINC000449636844 1045424550 /nfs/dbraw/zinc/42/45/50/1045424550.db2.gz XGUROMCWRCFVLS-GOSISDBHSA-N 1 2 313.397 4.024 20 0 DIADLO Cc1csc(C[NH+]2CC(c3cccc(C(F)(F)F)c3)C2)n1 ZINC000449661948 1045425408 /nfs/dbraw/zinc/42/54/08/1045425408.db2.gz DUCQZYWBTGUJSL-UHFFFAOYSA-N 1 2 312.360 4.070 20 0 DIADLO Fc1ccc(C[NH2+]Cc2cnc(C3CC3)o2)c(Cl)c1Cl ZINC000449704868 1045429795 /nfs/dbraw/zinc/42/97/95/1045429795.db2.gz ITMNGMGUEYWMRD-UHFFFAOYSA-N 1 2 315.175 4.288 20 0 DIADLO c1cc(Oc2ccccc2)oc1C[NH2+]Cc1cnc(C2CC2)o1 ZINC000449703877 1045430301 /nfs/dbraw/zinc/43/03/01/1045430301.db2.gz GXZAJRJFHNTONE-UHFFFAOYSA-N 1 2 310.353 4.227 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@@H](CCc2ccccc2)C(F)F)cn1 ZINC000449733044 1045431160 /nfs/dbraw/zinc/43/11/60/1045431160.db2.gz FOLSSXZKUBXMSY-KRWDZBQOSA-N 1 2 304.384 4.055 20 0 DIADLO CCO[C@@H](C)c1noc(C[NH2+][C@H](CC)c2ccc(Cl)cc2)n1 ZINC000120416835 1045472657 /nfs/dbraw/zinc/47/26/57/1045472657.db2.gz IDFZWHYLCODXQA-SMDDNHRTSA-N 1 2 323.824 4.061 20 0 DIADLO CC[N@H+](Cc1nnc(C(C)(C)C)o1)[C@H](C)c1ccc(F)cc1 ZINC000054341018 1045474854 /nfs/dbraw/zinc/47/48/54/1045474854.db2.gz QDFQNINRAPSXIO-GFCCVEGCSA-N 1 2 305.397 4.089 20 0 DIADLO CC[N@@H+](Cc1nnc(C(C)(C)C)o1)[C@H](C)c1ccc(F)cc1 ZINC000054341018 1045474859 /nfs/dbraw/zinc/47/48/59/1045474859.db2.gz QDFQNINRAPSXIO-GFCCVEGCSA-N 1 2 305.397 4.089 20 0 DIADLO CC(=O)c1cccc(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)c1 ZINC000450272069 1045480337 /nfs/dbraw/zinc/48/03/37/1045480337.db2.gz VMZFOGYABXCQCJ-LBPRGKRZSA-N 1 2 303.352 4.360 20 0 DIADLO CC(=O)c1cccc(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)c1 ZINC000450272069 1045480340 /nfs/dbraw/zinc/48/03/40/1045480340.db2.gz VMZFOGYABXCQCJ-LBPRGKRZSA-N 1 2 303.352 4.360 20 0 DIADLO C[N@H+](Cc1nnc(C2CC2)s1)Cc1cccc2ccccc21 ZINC000450263915 1045481580 /nfs/dbraw/zinc/48/15/80/1045481580.db2.gz DLRKZWRWHMLPHV-UHFFFAOYSA-N 1 2 309.438 4.201 20 0 DIADLO C[N@@H+](Cc1nnc(C2CC2)s1)Cc1cccc2ccccc21 ZINC000450263915 1045481583 /nfs/dbraw/zinc/48/15/83/1045481583.db2.gz DLRKZWRWHMLPHV-UHFFFAOYSA-N 1 2 309.438 4.201 20 0 DIADLO CC(C)[N@@H+](Cc1cnns1)Cc1ccc(Cl)c(Cl)c1 ZINC000450268931 1045482428 /nfs/dbraw/zinc/48/24/28/1045482428.db2.gz JKBUSROKBZSHQB-UHFFFAOYSA-N 1 2 316.257 4.256 20 0 DIADLO CC(C)[N@H+](Cc1cnns1)Cc1ccc(Cl)c(Cl)c1 ZINC000450268931 1045482425 /nfs/dbraw/zinc/48/24/25/1045482425.db2.gz JKBUSROKBZSHQB-UHFFFAOYSA-N 1 2 316.257 4.256 20 0 DIADLO CC(C)[N@@H+](Cc1ccn(CCc2ccccc2)n1)Cc1ccco1 ZINC000450301664 1045484549 /nfs/dbraw/zinc/48/45/49/1045484549.db2.gz VNCQLNXHZFRLRQ-UHFFFAOYSA-N 1 2 323.440 4.129 20 0 DIADLO CC(C)[N@H+](Cc1ccn(CCc2ccccc2)n1)Cc1ccco1 ZINC000450301664 1045484554 /nfs/dbraw/zinc/48/45/54/1045484554.db2.gz VNCQLNXHZFRLRQ-UHFFFAOYSA-N 1 2 323.440 4.129 20 0 DIADLO FC(F)(F)c1sccc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000529521540 1045489590 /nfs/dbraw/zinc/48/95/90/1045489590.db2.gz AEKOUQVOYOMHBG-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1sccc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000529521540 1045489593 /nfs/dbraw/zinc/48/95/93/1045489593.db2.gz AEKOUQVOYOMHBG-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO CC(C)(C)C[N@H+](Cc1nnc(C2CC2)s1)Cc1ccccc1 ZINC000450355762 1045497030 /nfs/dbraw/zinc/49/70/30/1045497030.db2.gz SDDQMGKHQOGLHN-UHFFFAOYSA-N 1 2 315.486 4.464 20 0 DIADLO CC(C)(C)C[N@@H+](Cc1nnc(C2CC2)s1)Cc1ccccc1 ZINC000450355762 1045497034 /nfs/dbraw/zinc/49/70/34/1045497034.db2.gz SDDQMGKHQOGLHN-UHFFFAOYSA-N 1 2 315.486 4.464 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1cnns1)C1CCCCC1 ZINC000450355715 1045497049 /nfs/dbraw/zinc/49/70/49/1045497049.db2.gz DJGZTBLZOGTAJD-UHFFFAOYSA-N 1 2 305.422 4.012 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1cnns1)C1CCCCC1 ZINC000450355715 1045497052 /nfs/dbraw/zinc/49/70/52/1045497052.db2.gz DJGZTBLZOGTAJD-UHFFFAOYSA-N 1 2 305.422 4.012 20 0 DIADLO C[C@@H](CO)CCCNc1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000450413244 1045503074 /nfs/dbraw/zinc/50/30/74/1045503074.db2.gz UBVKOJDCDZEARD-LLVKDONJSA-N 1 2 312.335 4.074 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccc(F)c2)s1 ZINC000450433663 1045504187 /nfs/dbraw/zinc/50/41/87/1045504187.db2.gz BKOAIHZYFUJQFQ-SWLSCSKDSA-N 1 2 319.449 4.384 20 0 DIADLO CC(C)c1nnc(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccc(F)c2)s1 ZINC000450433663 1045504194 /nfs/dbraw/zinc/50/41/94/1045504194.db2.gz BKOAIHZYFUJQFQ-SWLSCSKDSA-N 1 2 319.449 4.384 20 0 DIADLO CC(=O)c1cccc(C[N@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)c1 ZINC000450435359 1045505016 /nfs/dbraw/zinc/50/50/16/1045505016.db2.gz HVBUVOUAOKDZAJ-IIBYNOLFSA-N 1 2 323.436 4.160 20 0 DIADLO CC(=O)c1cccc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)c1 ZINC000450435359 1045505020 /nfs/dbraw/zinc/50/50/20/1045505020.db2.gz HVBUVOUAOKDZAJ-IIBYNOLFSA-N 1 2 323.436 4.160 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cccc(-n3cccc3)c2)c(C)[nH+]1 ZINC000121115323 1045514401 /nfs/dbraw/zinc/51/44/01/1045514401.db2.gz UEGHDSCUCANBDV-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO Fc1cc2[nH+]ccc(N3CC[C@]4(C3)CCCOC4)c2cc1Cl ZINC000450511244 1045515065 /nfs/dbraw/zinc/51/50/65/1045515065.db2.gz ARFCARXFEPLYRI-KRWDZBQOSA-N 1 2 320.795 4.034 20 0 DIADLO CC(C)c1nnc(C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)s1 ZINC000450521283 1045516415 /nfs/dbraw/zinc/51/64/15/1045516415.db2.gz SWJLISNZMUBEDB-MRXNPFEDSA-N 1 2 313.470 4.313 20 0 DIADLO CC(C)c1nnc(C[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)s1 ZINC000450521283 1045516425 /nfs/dbraw/zinc/51/64/25/1045516425.db2.gz SWJLISNZMUBEDB-MRXNPFEDSA-N 1 2 313.470 4.313 20 0 DIADLO CCOc1cccc2cc([C@H](C)[NH2+][C@@H](C)c3ncccn3)oc21 ZINC001119732914 1045523873 /nfs/dbraw/zinc/52/38/73/1045523873.db2.gz RUPMMPQYZNSGKH-STQMWFEESA-N 1 2 311.385 4.033 20 0 DIADLO Cc1ncc(C[NH+](Cc2cccs2)Cc2cccs2)o1 ZINC000628122195 1045526674 /nfs/dbraw/zinc/52/66/74/1045526674.db2.gz NVUPQAFJIFDNRG-UHFFFAOYSA-N 1 2 304.440 4.308 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cs1 ZINC000628117530 1045526798 /nfs/dbraw/zinc/52/67/98/1045526798.db2.gz MJYDIANXJHNGFX-LBPRGKRZSA-N 1 2 300.349 4.432 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)cs1 ZINC000628117530 1045526809 /nfs/dbraw/zinc/52/68/09/1045526809.db2.gz MJYDIANXJHNGFX-LBPRGKRZSA-N 1 2 300.349 4.432 20 0 DIADLO COCC[N@@H+](Cc1csc(C(F)(F)F)c1)Cc1ccco1 ZINC000628142222 1045529359 /nfs/dbraw/zinc/52/93/59/1045529359.db2.gz VCAYNMJXIUPNIC-UHFFFAOYSA-N 1 2 319.348 4.009 20 0 DIADLO COCC[N@H+](Cc1csc(C(F)(F)F)c1)Cc1ccco1 ZINC000628142222 1045529372 /nfs/dbraw/zinc/52/93/72/1045529372.db2.gz VCAYNMJXIUPNIC-UHFFFAOYSA-N 1 2 319.348 4.009 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3ccccc3[C@H]2c2ccccc2)[nH]c1C ZINC000628170234 1045532932 /nfs/dbraw/zinc/53/29/32/1045532932.db2.gz UVWXVFSXTJEJSU-OAQYLSRUSA-N 1 2 317.436 4.174 20 0 DIADLO Cc1nc(C[N@H+]2CCc3ccccc3[C@H]2c2ccccc2)[nH]c1C ZINC000628170234 1045532943 /nfs/dbraw/zinc/53/29/43/1045532943.db2.gz UVWXVFSXTJEJSU-OAQYLSRUSA-N 1 2 317.436 4.174 20 0 DIADLO Cc1[nH]c(CN(CCc2ccc(C)cc2)Cc2ccco2)[nH+]c1C ZINC000628184061 1045537059 /nfs/dbraw/zinc/53/70/59/1045537059.db2.gz YEZHVSJXIFMNRJ-UHFFFAOYSA-N 1 2 323.440 4.173 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+]Cc1nnc(C2CC2)s1 ZINC000450661805 1045539474 /nfs/dbraw/zinc/53/94/74/1045539474.db2.gz GDOCQBAPHIXPTD-AWEZNQCLSA-N 1 2 317.458 4.055 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc1 ZINC000450666454 1045540380 /nfs/dbraw/zinc/54/03/80/1045540380.db2.gz IHGOCEPKACICQF-LLVKDONJSA-N 1 2 319.499 4.378 20 0 DIADLO CC(C)c1cc(Cl)ccc1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000529849425 1045541373 /nfs/dbraw/zinc/54/13/73/1045541373.db2.gz PUJNWBQGVTUBCU-GFCCVEGCSA-N 1 2 305.809 4.250 20 0 DIADLO CC(C)CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2csnn2)cc1 ZINC000450667709 1045541572 /nfs/dbraw/zinc/54/15/72/1045541572.db2.gz MCXPAKBRZQZILI-KGLIPLIRSA-N 1 2 319.474 4.375 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1ccnc(Cl)c1F ZINC001139665358 1045544740 /nfs/dbraw/zinc/54/47/40/1045544740.db2.gz PQIPOJYHNLMMAJ-OAHLLOKOSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccnc(Cl)c1F ZINC001139665358 1045544754 /nfs/dbraw/zinc/54/47/54/1045544754.db2.gz PQIPOJYHNLMMAJ-OAHLLOKOSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1ccnc(Cl)c1F ZINC001139665352 1045545086 /nfs/dbraw/zinc/54/50/86/1045545086.db2.gz PQIPOJYHNLMMAJ-HNNXBMFYSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1ccnc(Cl)c1F ZINC001139665352 1045545099 /nfs/dbraw/zinc/54/50/99/1045545099.db2.gz PQIPOJYHNLMMAJ-HNNXBMFYSA-N 1 2 304.796 4.384 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc(C)c1F ZINC000450682817 1045545420 /nfs/dbraw/zinc/54/54/20/1045545420.db2.gz QVXQZMLLJYJXQJ-LLVKDONJSA-N 1 2 305.422 4.022 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1cc(C(C)C)nc2ccccc21 ZINC001121138976 1045552475 /nfs/dbraw/zinc/55/24/75/1045552475.db2.gz GTUFXPUIZASGCR-UHFFFAOYSA-N 1 2 319.408 4.044 20 0 DIADLO CCO[C@H]1CCN(c2cc[nH+]c3c(Cl)cccc23)C[C@@H]1C ZINC000450748726 1045556686 /nfs/dbraw/zinc/55/66/86/1045556686.db2.gz XIOITGJZNLTELX-LRDDRELGSA-N 1 2 304.821 4.140 20 0 DIADLO C[C@@H]([NH2+][C@H](Cc1ccccc1)c1cccs1)c1csnn1 ZINC000450725586 1045556848 /nfs/dbraw/zinc/55/68/48/1045556848.db2.gz ITNCNQMOKWWRJK-TZMCWYRMSA-N 1 2 315.467 4.234 20 0 DIADLO CC(C)C[C@@H](C(=O)N1CCC[C@H]1C1CCCCC1)n1cc[nH+]c1 ZINC001626153671 1045561684 /nfs/dbraw/zinc/56/16/84/1045561684.db2.gz GNOBXNRTXQWATN-ROUUACIJSA-N 1 2 317.477 4.042 20 0 DIADLO Fc1cccc(F)c1C[N@H+]1CC=C(c2ccc(Cl)nc2)CC1 ZINC000780311348 1045562274 /nfs/dbraw/zinc/56/22/74/1045562274.db2.gz AXBXOZKWOUSKGL-UHFFFAOYSA-N 1 2 320.770 4.303 20 0 DIADLO Fc1cccc(F)c1C[N@@H+]1CC=C(c2ccc(Cl)nc2)CC1 ZINC000780311348 1045562280 /nfs/dbraw/zinc/56/22/80/1045562280.db2.gz AXBXOZKWOUSKGL-UHFFFAOYSA-N 1 2 320.770 4.303 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(C(F)(F)F)c2)[C@@H]1[C@H]1CCCO1 ZINC000628284145 1045563138 /nfs/dbraw/zinc/56/31/38/1045563138.db2.gz BRNWUGWAVDVJMO-DGCLKSJQSA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(C(F)(F)F)c2)[C@@H]1[C@H]1CCCO1 ZINC000628284145 1045563152 /nfs/dbraw/zinc/56/31/52/1045563152.db2.gz BRNWUGWAVDVJMO-DGCLKSJQSA-N 1 2 319.392 4.156 20 0 DIADLO C(=C\c1ccccc1)\CC[N@@H+]1CCSC[C@@H]1c1nccs1 ZINC000450761146 1045566461 /nfs/dbraw/zinc/56/64/61/1045566461.db2.gz QUDLSFPLBFGANN-LWAXHKBTSA-N 1 2 316.495 4.337 20 0 DIADLO C(=C\c1ccccc1)\CC[N@H+]1CCSC[C@@H]1c1nccs1 ZINC000450761146 1045566472 /nfs/dbraw/zinc/56/64/72/1045566472.db2.gz QUDLSFPLBFGANN-LWAXHKBTSA-N 1 2 316.495 4.337 20 0 DIADLO C[C@@H](c1csnn1)[NH+]1CCC(C)(c2cccc(Cl)c2)CC1 ZINC000450896596 1045586614 /nfs/dbraw/zinc/58/66/14/1045586614.db2.gz NMXOPBBJPDCYPX-LBPRGKRZSA-N 1 2 321.877 4.306 20 0 DIADLO Fc1cc2[nH+]ccc(N3CCC[C@]4(CCOC4)C3)c2cc1Cl ZINC000450880743 1045588409 /nfs/dbraw/zinc/58/84/09/1045588409.db2.gz KZXKLLSJNFATRS-KRWDZBQOSA-N 1 2 320.795 4.034 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2ccc(Cl)nc2)C1 ZINC000800473205 1045623460 /nfs/dbraw/zinc/62/34/60/1045623460.db2.gz NTRXIDAIAPKQCD-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2ccc(Cl)nc2)C1 ZINC000800473205 1045623475 /nfs/dbraw/zinc/62/34/75/1045623475.db2.gz NTRXIDAIAPKQCD-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2ccc(Cl)nc2)C1 ZINC000800473206 1045623746 /nfs/dbraw/zinc/62/37/46/1045623746.db2.gz NTRXIDAIAPKQCD-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2ccc(Cl)nc2)C1 ZINC000800473206 1045623750 /nfs/dbraw/zinc/62/37/50/1045623750.db2.gz NTRXIDAIAPKQCD-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO CC(C)(C)[C@@H](Cn1cc[nH+]c1)NC(=O)C[C@H]1CCCCC1(C)C ZINC000751686519 1045625425 /nfs/dbraw/zinc/62/54/25/1045625425.db2.gz FKZPCNGEFOLGLN-HZPDHXFCSA-N 1 2 319.493 4.021 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[N@@H+]3CCC[C@](C)(F)C3)o2)cc1C ZINC000451117844 1045625971 /nfs/dbraw/zinc/62/59/71/1045625971.db2.gz WLMFGSLKXQTAPR-KSSFIOAISA-N 1 2 317.408 4.238 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[N@H+]3CCC[C@](C)(F)C3)o2)cc1C ZINC000451117844 1045625978 /nfs/dbraw/zinc/62/59/78/1045625978.db2.gz WLMFGSLKXQTAPR-KSSFIOAISA-N 1 2 317.408 4.238 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCC[C@H]4C[C@]43C)cc2)C[C@H](C)O1 ZINC000800491976 1045629954 /nfs/dbraw/zinc/62/99/54/1045629954.db2.gz YXSLMUATAVBXBZ-HRYJEPKJSA-N 1 2 314.473 4.291 20 0 DIADLO Cc1cc(N2CCC(c3ccc(F)cc3)CC2)nc(C2CC2)[nH+]1 ZINC000751969666 1045646209 /nfs/dbraw/zinc/64/62/09/1045646209.db2.gz CZYDKPYOGSDZRM-UHFFFAOYSA-N 1 2 311.404 4.186 20 0 DIADLO CC[C@](C)([NH2+]Cc1c(O)ccc(Cl)c1F)c1nccs1 ZINC000191157297 1045661618 /nfs/dbraw/zinc/66/16/18/1045661618.db2.gz NBHLRDZJBJYYRM-AWEZNQCLSA-N 1 2 314.813 4.056 20 0 DIADLO C[NH2+]c1ccc(NCc2cccc(OCC(F)(F)F)c2)cc1 ZINC000629389668 1045664358 /nfs/dbraw/zinc/66/43/58/1045664358.db2.gz QLFYFGYWSVGGAG-UHFFFAOYSA-N 1 2 310.319 4.282 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1cccc(F)c1F ZINC000530443248 1045666588 /nfs/dbraw/zinc/66/65/88/1045666588.db2.gz XWDRYASDJYLHHO-UHFFFAOYSA-N 1 2 303.308 4.009 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)oc1C ZINC000451354039 1045668759 /nfs/dbraw/zinc/66/87/59/1045668759.db2.gz MCOBLVLJCIZASW-MRXNPFEDSA-N 1 2 308.784 4.325 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)o1 ZINC000451360476 1045671242 /nfs/dbraw/zinc/67/12/42/1045671242.db2.gz YKKMPISIZLVOLH-PSLIRLAXSA-N 1 2 323.799 4.226 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2ncccc2F)c2ccccc2)cc1 ZINC000530470779 1045671633 /nfs/dbraw/zinc/67/16/33/1045671633.db2.gz ITWOJIDNUYOUJG-FQEVSTJZSA-N 1 2 322.383 4.109 20 0 DIADLO FC(F)Oc1ccccc1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000121825689 1045672893 /nfs/dbraw/zinc/67/28/93/1045672893.db2.gz XTFLCXMMRNDTBM-UHFFFAOYSA-N 1 2 315.323 4.086 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CCC[C@H]3CCCF)cc2)CCO1 ZINC000800982189 1045675587 /nfs/dbraw/zinc/67/55/87/1045675587.db2.gz OVRASGJLTUASIQ-GJYPPUQNSA-N 1 2 320.452 4.242 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CC[C@@H]3C3CCC3)cc2)C[C@H](C)O1 ZINC000800981086 1045676540 /nfs/dbraw/zinc/67/65/40/1045676540.db2.gz KBFMNCJEXVXSNM-HRYATBACSA-N 1 2 314.473 4.291 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nc(C2CC2)cs1 ZINC000451412164 1045679350 /nfs/dbraw/zinc/67/93/50/1045679350.db2.gz WKNBLJPXMQUWCO-KOLCDFICSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1nc(C2CC2)cs1 ZINC000451412164 1045679354 /nfs/dbraw/zinc/67/93/54/1045679354.db2.gz WKNBLJPXMQUWCO-KOLCDFICSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@@H](C(=O)Nc1c(F)cccc1F)[NH+]1CCC(C(C)(C)C)CC1 ZINC000530519795 1045683592 /nfs/dbraw/zinc/68/35/92/1045683592.db2.gz HLCJXLDXWNAZAY-LBPRGKRZSA-N 1 2 324.415 4.050 20 0 DIADLO COc1ccc2oc([C@H](C)[NH2+]Cc3ncccc3F)c(C)c2c1 ZINC000530524158 1045684322 /nfs/dbraw/zinc/68/43/22/1045684322.db2.gz ILKFRODEASGCBB-LBPRGKRZSA-N 1 2 314.360 4.135 20 0 DIADLO CC(C)OC1CC[NH+](Cc2csc(C3CCCC3)n2)CC1 ZINC000530687646 1045710943 /nfs/dbraw/zinc/71/09/43/1045710943.db2.gz CREXCCMPBZATBL-UHFFFAOYSA-N 1 2 308.491 4.190 20 0 DIADLO c1oc(-c2ccccc2)nc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000530724412 1045720229 /nfs/dbraw/zinc/72/02/29/1045720229.db2.gz FVSGGWRVHOVYJI-GOSISDBHSA-N 1 2 305.381 4.074 20 0 DIADLO c1oc(-c2ccccc2)nc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000530724412 1045720242 /nfs/dbraw/zinc/72/02/42/1045720242.db2.gz FVSGGWRVHOVYJI-GOSISDBHSA-N 1 2 305.381 4.074 20 0 DIADLO Cc1ncc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)s1 ZINC000193478151 1045723438 /nfs/dbraw/zinc/72/34/38/1045723438.db2.gz VTBAEFREHIXCLS-JTQLQIEISA-N 1 2 303.456 4.254 20 0 DIADLO Cc1ncc(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)s1 ZINC000193478151 1045723453 /nfs/dbraw/zinc/72/34/53/1045723453.db2.gz VTBAEFREHIXCLS-JTQLQIEISA-N 1 2 303.456 4.254 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2cscc2Br)n1 ZINC000304527510 1045725195 /nfs/dbraw/zinc/72/51/95/1045725195.db2.gz GGPBYVMILQGNHF-MRVPVSSYSA-N 1 2 317.277 4.126 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1ccc(Cl)nc1Cl ZINC000801549802 1045737635 /nfs/dbraw/zinc/73/76/35/1045737635.db2.gz AVDOHMRQAMZOTF-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1ccc(Cl)nc1Cl ZINC000801549802 1045737650 /nfs/dbraw/zinc/73/76/50/1045737650.db2.gz AVDOHMRQAMZOTF-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)/C=C3\CC[C@H](C)C3)c2)[nH+]c1C ZINC000753590806 1045770626 /nfs/dbraw/zinc/77/06/26/1045770626.db2.gz DSUACHZVWKXUAO-XBUHWIKASA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C=C3CC[C@H](C)C3)c2)[nH+]c1C ZINC000753590806 1045770637 /nfs/dbraw/zinc/77/06/37/1045770637.db2.gz DSUACHZVWKXUAO-XBUHWIKASA-N 1 2 309.413 4.378 20 0 DIADLO CC(C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)=C1CCCC1 ZINC000753602020 1045774039 /nfs/dbraw/zinc/77/40/39/1045774039.db2.gz ZNERNHSZZWDDLV-UHFFFAOYSA-N 1 2 315.804 4.355 20 0 DIADLO C#CC[N@@H+](C)[C@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 ZINC000192223921 1045793207 /nfs/dbraw/zinc/79/32/07/1045793207.db2.gz CWAMFOAKXGFWKF-SNVBAGLBSA-N 1 2 309.196 4.274 20 0 DIADLO C#CC[N@H+](C)[C@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 ZINC000192223921 1045793228 /nfs/dbraw/zinc/79/32/28/1045793228.db2.gz CWAMFOAKXGFWKF-SNVBAGLBSA-N 1 2 309.196 4.274 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1nc(Cl)ccc1Cl ZINC000753787600 1045803808 /nfs/dbraw/zinc/80/38/08/1045803808.db2.gz YTVALJICZFOSBQ-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1nc(Cl)ccc1Cl ZINC000753787600 1045803831 /nfs/dbraw/zinc/80/38/31/1045803831.db2.gz YTVALJICZFOSBQ-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1nc(C2([NH2+]Cc3csc(C)c3C)CCCCC2)no1 ZINC000631058693 1045805131 /nfs/dbraw/zinc/80/51/31/1045805131.db2.gz VNLXIOARVVBQKK-UHFFFAOYSA-N 1 2 305.447 4.006 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1ccc(C(F)F)nc1)c1ccco1 ZINC000631058638 1045806057 /nfs/dbraw/zinc/80/60/57/1045806057.db2.gz TTXHZIZHKUKFBT-HNNXBMFYSA-N 1 2 324.371 4.116 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-c2ccccc2)cc1F)n1cc[nH+]c1 ZINC001124982317 1045823171 /nfs/dbraw/zinc/82/31/71/1045823171.db2.gz MXPYGOAIRYSXCU-CQSZACIVSA-N 1 2 323.371 4.279 20 0 DIADLO Cc1scc(C[NH2+]C(C)(C)c2cc(C(F)(F)F)on2)c1C ZINC000631143579 1045826423 /nfs/dbraw/zinc/82/64/23/1045826423.db2.gz UXCSHCVJSSBNTI-UHFFFAOYSA-N 1 2 318.364 4.397 20 0 DIADLO C[C@H](C[NH2+]c1ccc(N2CCOC[C@@H]2C)cc1)Cc1ccccc1 ZINC000753969402 1045826663 /nfs/dbraw/zinc/82/66/63/1045826663.db2.gz SOEUGWZQTKVCTH-ROUUACIJSA-N 1 2 324.468 4.202 20 0 DIADLO Fc1ccc(-c2nc(C[N@@H+]3CCC[C@H]3c3ccccn3)co2)cc1 ZINC000531440196 1045846198 /nfs/dbraw/zinc/84/61/98/1045846198.db2.gz SWYWBEGGQWWRKC-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(-c2nc(C[N@H+]3CCC[C@H]3c3ccccn3)co2)cc1 ZINC000531440196 1045846216 /nfs/dbraw/zinc/84/62/16/1045846216.db2.gz SWYWBEGGQWWRKC-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO CC(C)[C@@H]1C[C@@H]([NH2+]c2ccc(N3CCSCC3)cc2)CS1 ZINC000754130812 1045852459 /nfs/dbraw/zinc/85/24/59/1045852459.db2.gz RUGVWFAYOIGDDC-WBVHZDCISA-N 1 2 322.543 4.182 20 0 DIADLO CC(C)c1[nH]ccc1C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC000452797769 1045867605 /nfs/dbraw/zinc/86/76/05/1045867605.db2.gz POKWAQJZBSCNFP-UHFFFAOYSA-N 1 2 322.412 4.005 20 0 DIADLO Clc1nc(C[N@H+](C2CC2)[C@H]2CCc3ccccc32)cs1 ZINC000828150234 1045892858 /nfs/dbraw/zinc/89/28/58/1045892858.db2.gz CYPXRKDBRVESQK-HNNXBMFYSA-N 1 2 304.846 4.448 20 0 DIADLO Clc1nc(C[N@@H+](C2CC2)[C@H]2CCc3ccccc32)cs1 ZINC000828150234 1045892864 /nfs/dbraw/zinc/89/28/64/1045892864.db2.gz CYPXRKDBRVESQK-HNNXBMFYSA-N 1 2 304.846 4.448 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](CCc2ccccc2)c2ccccn2)no1 ZINC000631672283 1045902193 /nfs/dbraw/zinc/90/21/93/1045902193.db2.gz HDIYWWGMFJIOSK-QFBILLFUSA-N 1 2 321.424 4.403 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)cc1F ZINC000631795516 1045918073 /nfs/dbraw/zinc/91/80/73/1045918073.db2.gz KJXGXFYCKICZKD-BDJLRTHQSA-N 1 2 309.331 4.335 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)c(OC)c1 ZINC000631795969 1045919690 /nfs/dbraw/zinc/91/96/90/1045919690.db2.gz QFCBZJRSUNFBBZ-SJKOYZFVSA-N 1 2 321.367 4.204 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)cc1F ZINC000631795519 1045919714 /nfs/dbraw/zinc/91/97/14/1045919714.db2.gz KJXGXFYCKICZKD-ZBEGNZNMSA-N 1 2 309.331 4.335 20 0 DIADLO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)c1 ZINC000631795118 1045919839 /nfs/dbraw/zinc/91/98/39/1045919839.db2.gz GILHJHCSUBTUGF-KPZWWZAWSA-N 1 2 318.367 4.146 20 0 DIADLO C[C@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1ccccc1N(C)C ZINC000631797466 1045920025 /nfs/dbraw/zinc/92/00/25/1045920025.db2.gz BAABWIZPPNAUPR-SUMWQHHRSA-N 1 2 304.384 4.253 20 0 DIADLO Fc1cc(Cl)ccc1C[N@@H+]1CC[C@@H]1COCc1ccccc1 ZINC001137660656 1045925593 /nfs/dbraw/zinc/92/55/93/1045925593.db2.gz YRAYBBHCOVANGR-QGZVFWFLSA-N 1 2 319.807 4.270 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1cc2ccccc2s1 ZINC000754753363 1045925532 /nfs/dbraw/zinc/92/55/32/1045925532.db2.gz VBNLLLPAYZHFIU-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO Fc1cc(Cl)ccc1C[N@H+]1CC[C@@H]1COCc1ccccc1 ZINC001137660656 1045925609 /nfs/dbraw/zinc/92/56/09/1045925609.db2.gz YRAYBBHCOVANGR-QGZVFWFLSA-N 1 2 319.807 4.270 20 0 DIADLO Clc1ccc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c(Cl)n1 ZINC000829101397 1045954957 /nfs/dbraw/zinc/95/49/57/1045954957.db2.gz SZDWNZPCPVEQBN-AWEZNQCLSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccc(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c(Cl)n1 ZINC000829101397 1045954965 /nfs/dbraw/zinc/95/49/65/1045954965.db2.gz SZDWNZPCPVEQBN-AWEZNQCLSA-N 1 2 323.223 4.042 20 0 DIADLO CCCOc1cccc2c(NCc3coc(CC)n3)cc[nH+]c12 ZINC000829183447 1045961033 /nfs/dbraw/zinc/96/10/33/1045961033.db2.gz AJIZLHPNQFYAOA-UHFFFAOYSA-N 1 2 311.385 4.186 20 0 DIADLO COc1ccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1F ZINC000193161559 1045973306 /nfs/dbraw/zinc/97/33/06/1045973306.db2.gz VTSKOLDFPXJKKP-ZDUSSCGKSA-N 1 2 311.360 4.193 20 0 DIADLO Fc1cc(F)c(F)c(C[NH+]2CCC(Oc3ccccc3)CC2)c1 ZINC001137869007 1045992807 /nfs/dbraw/zinc/99/28/07/1045992807.db2.gz YYZXAOYYRPDXET-UHFFFAOYSA-N 1 2 321.342 4.147 20 0 DIADLO Fc1cc(F)c(F)c(C[N@@H+]2CCC[C@H](Oc3ccccc3)C2)c1 ZINC001137872139 1045994351 /nfs/dbraw/zinc/99/43/51/1045994351.db2.gz DJVPSSLSNNJMOT-INIZCTEOSA-N 1 2 321.342 4.147 20 0 DIADLO Fc1cc(F)c(F)c(C[N@H+]2CCC[C@H](Oc3ccccc3)C2)c1 ZINC001137872139 1045994361 /nfs/dbraw/zinc/99/43/61/1045994361.db2.gz DJVPSSLSNNJMOT-INIZCTEOSA-N 1 2 321.342 4.147 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(F)cc(F)c1F ZINC001137872609 1045995733 /nfs/dbraw/zinc/99/57/33/1045995733.db2.gz XORLKOQJHUNOBC-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc(F)cc(F)c1F ZINC001137872609 1045995736 /nfs/dbraw/zinc/99/57/36/1045995736.db2.gz XORLKOQJHUNOBC-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO CC(C)OC1CC[NH+](Cc2c(F)ccc(Cl)c2F)CC1 ZINC001137881461 1045996699 /nfs/dbraw/zinc/99/66/99/1045996699.db2.gz RHXIBXBWYFJTMZ-UHFFFAOYSA-N 1 2 303.780 4.008 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1cc(F)c(F)cc1F ZINC001137892054 1046001014 /nfs/dbraw/zinc/00/10/14/1046001014.db2.gz FSJUOWUZBYOSCG-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1cc(F)c(F)cc1F ZINC001137892054 1046001032 /nfs/dbraw/zinc/00/10/32/1046001032.db2.gz FSJUOWUZBYOSCG-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO CC[N@H+](Cc1ccc(OC)cc1)Cc1c(F)ccc(F)c1F ZINC001137933418 1046022377 /nfs/dbraw/zinc/02/23/77/1046022377.db2.gz GIMZCOADWIYWHY-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)cc1)Cc1c(F)ccc(F)c1F ZINC001137933418 1046022388 /nfs/dbraw/zinc/02/23/88/1046022388.db2.gz GIMZCOADWIYWHY-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)cnc1Cl ZINC000802656616 1046024310 /nfs/dbraw/zinc/02/43/10/1046024310.db2.gz NFNPAMDZTDJLAG-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@@](F)(c3ccccc3)C2)cnc1Cl ZINC000802656616 1046024327 /nfs/dbraw/zinc/02/43/27/1046024327.db2.gz NFNPAMDZTDJLAG-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccc(SC(F)(F)F)cc2)CCC1=O ZINC001137953282 1046030598 /nfs/dbraw/zinc/03/05/98/1046030598.db2.gz SECVWGDVACVNLH-NSHDSACASA-N 1 2 317.376 4.100 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccc(SC(F)(F)F)cc2)CCC1=O ZINC001137953282 1046030614 /nfs/dbraw/zinc/03/06/14/1046030614.db2.gz SECVWGDVACVNLH-NSHDSACASA-N 1 2 317.376 4.100 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](c1cc(F)ccc1F)C(C)C ZINC000453335902 1046042561 /nfs/dbraw/zinc/04/25/61/1046042561.db2.gz FBUUUDJYLQDKFS-MLGOLLRUSA-N 1 2 307.388 4.229 20 0 DIADLO COc1cccc2c1CC[C@@H](Nc1ccc([NH+]3CCCC3)cc1)C2 ZINC000756041344 1046043046 /nfs/dbraw/zinc/04/30/46/1046043046.db2.gz LJKKDYAGGPLCMR-GOSISDBHSA-N 1 2 322.452 4.265 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1cnc(C2CC2)o1 ZINC000453345163 1046047166 /nfs/dbraw/zinc/04/71/66/1046047166.db2.gz HNNFOLHVVXAWAN-NSHDSACASA-N 1 2 320.820 4.455 20 0 DIADLO CCCn1cc([C@H](C)[NH2+]C(c2ccccc2)c2ccccc2)nn1 ZINC000902720704 1046049906 /nfs/dbraw/zinc/04/99/06/1046049906.db2.gz MXBFZVRDWZHNTG-INIZCTEOSA-N 1 2 320.440 4.128 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(C(F)(F)F)c2F)CCC1(F)F ZINC001138007227 1046055194 /nfs/dbraw/zinc/05/51/94/1046055194.db2.gz ZOQOPNLVIVAJFL-VIFPVBQESA-N 1 2 311.269 4.322 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2F)CCC1(F)F ZINC001138007227 1046055211 /nfs/dbraw/zinc/05/52/11/1046055211.db2.gz ZOQOPNLVIVAJFL-VIFPVBQESA-N 1 2 311.269 4.322 20 0 DIADLO Cc1ncccc1C[N@@H+](C)Cc1cccc(C(F)(F)F)c1F ZINC001138011973 1046056662 /nfs/dbraw/zinc/05/66/62/1046056662.db2.gz PDSVTSLLUOYIGI-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ncccc1C[N@H+](C)Cc1cccc(C(F)(F)F)c1F ZINC001138011973 1046056676 /nfs/dbraw/zinc/05/66/76/1046056676.db2.gz PDSVTSLLUOYIGI-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO COc1cccnc1C[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000453363227 1046065502 /nfs/dbraw/zinc/06/55/02/1046065502.db2.gz MKFYGZDGMXVBFQ-JTQLQIEISA-N 1 2 311.212 4.248 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1Oc1ccccc1)c1cn(C)nn1 ZINC000902786580 1046069693 /nfs/dbraw/zinc/06/96/93/1046069693.db2.gz PTTCTKOIIYBXSC-GJZGRUSLSA-N 1 2 322.412 4.019 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)cn2)n1 ZINC000902789808 1046069837 /nfs/dbraw/zinc/06/98/37/1046069837.db2.gz NKNLDNKTXMWTKF-UWVGGRQHSA-N 1 2 315.364 4.277 20 0 DIADLO CCCn1cc([C@H](C)[NH2+][C@H](c2ccccc2Cl)C(C)C)nn1 ZINC000902807076 1046075039 /nfs/dbraw/zinc/07/50/39/1046075039.db2.gz VLNLOQIMKXIBPB-GUYCJALGSA-N 1 2 320.868 4.389 20 0 DIADLO CCc1ncc(C[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)o1 ZINC000453400610 1046077126 /nfs/dbraw/zinc/07/71/26/1046077126.db2.gz YOSAOVKYCWNTKM-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO CC(C)Cn1ccnc1C[NH2+][C@H](c1ccc(F)cc1F)C(C)C ZINC000634680183 1046084420 /nfs/dbraw/zinc/08/44/20/1046084420.db2.gz NEKYAXMYBWDMKJ-SFHVURJKSA-N 1 2 321.415 4.304 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(Br)cn2)o1 ZINC000453619089 1046099871 /nfs/dbraw/zinc/09/98/71/1046099871.db2.gz WDMGMVDHHHFUNV-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(Br)cn2)o1 ZINC000453619089 1046099881 /nfs/dbraw/zinc/09/98/81/1046099881.db2.gz WDMGMVDHHHFUNV-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO CCCC[C@H]([NH2+]Cc1n[nH]cc1Br)c1ccccc1 ZINC000532224904 1046118801 /nfs/dbraw/zinc/11/88/01/1046118801.db2.gz FZQKKQHGWDBYFM-AWEZNQCLSA-N 1 2 322.250 4.193 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCc3ccc(Cl)nc3)c2c1 ZINC000195533523 1046121492 /nfs/dbraw/zinc/12/14/92/1046121492.db2.gz WTUOOGKPEFYERI-UHFFFAOYSA-N 1 2 314.772 4.179 20 0 DIADLO C[N@H+](CCCc1ccccc1)Cc1c(F)c(F)cc(F)c1F ZINC001138234127 1046125464 /nfs/dbraw/zinc/12/54/64/1046125464.db2.gz IYTBIROHOONCBG-UHFFFAOYSA-N 1 2 311.322 4.308 20 0 DIADLO C[N@@H+](CCCc1ccccc1)Cc1c(F)c(F)cc(F)c1F ZINC001138234127 1046125475 /nfs/dbraw/zinc/12/54/75/1046125475.db2.gz IYTBIROHOONCBG-UHFFFAOYSA-N 1 2 311.322 4.308 20 0 DIADLO Clc1cc2c(cc1C[N@@H+]1CC[C@H]1c1ccccc1)OCO2 ZINC001138245201 1046127333 /nfs/dbraw/zinc/12/73/33/1046127333.db2.gz UMWWRMQFXGGGDB-HNNXBMFYSA-N 1 2 301.773 4.016 20 0 DIADLO Clc1cc2c(cc1C[N@H+]1CC[C@H]1c1ccccc1)OCO2 ZINC001138245201 1046127341 /nfs/dbraw/zinc/12/73/41/1046127341.db2.gz UMWWRMQFXGGGDB-HNNXBMFYSA-N 1 2 301.773 4.016 20 0 DIADLO C[C@H]([NH2+]Cc1noc2ccccc12)c1ccc(C(F)(F)F)cn1 ZINC000903046331 1046147410 /nfs/dbraw/zinc/14/74/10/1046147410.db2.gz ZWGYAUYEKHOLKM-JTQLQIEISA-N 1 2 321.302 4.092 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@H+](C)Cc2cccs2)cc1 ZINC000007846598 1046156904 /nfs/dbraw/zinc/15/69/04/1046156904.db2.gz AMDWMNPQISXHNU-AWEZNQCLSA-N 1 2 316.470 4.332 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@@H+](C)Cc2cccs2)cc1 ZINC000007846598 1046156914 /nfs/dbraw/zinc/15/69/14/1046156914.db2.gz AMDWMNPQISXHNU-AWEZNQCLSA-N 1 2 316.470 4.332 20 0 DIADLO COc1ccc(F)cc1C[N@@H+]1CCc2c(Cl)cccc2C1 ZINC001138374686 1046159272 /nfs/dbraw/zinc/15/92/72/1046159272.db2.gz CPHJOXOEQUSXHX-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(F)cc1C[N@H+]1CCc2c(Cl)cccc2C1 ZINC001138374686 1046159279 /nfs/dbraw/zinc/15/92/79/1046159279.db2.gz CPHJOXOEQUSXHX-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO c1ccc([C@@H](Nc2ccc(N3CCCCC3)c[nH+]2)C2CC2)nc1 ZINC000903134631 1046172377 /nfs/dbraw/zinc/17/23/77/1046172377.db2.gz FKZHITDHDCCCDP-IBGZPJMESA-N 1 2 308.429 4.030 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+](C)Cc3cccc(F)c3F)cc2c1 ZINC001138416652 1046172764 /nfs/dbraw/zinc/17/27/64/1046172764.db2.gz BHOIBBZCWXUWED-UHFFFAOYSA-N 1 2 300.352 4.387 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+](C)Cc3cccc(F)c3F)cc2c1 ZINC001138416652 1046172767 /nfs/dbraw/zinc/17/27/67/1046172767.db2.gz BHOIBBZCWXUWED-UHFFFAOYSA-N 1 2 300.352 4.387 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000635077428 1046175415 /nfs/dbraw/zinc/17/54/15/1046175415.db2.gz IBXRVILOENBUKS-OAHLLOKOSA-N 1 2 305.809 4.071 20 0 DIADLO CCOc1ccc2ccccc2c1C[N@@H+]1Cc2cccnc2C1 ZINC001138439737 1046182901 /nfs/dbraw/zinc/18/29/01/1046182901.db2.gz CNHMYKWEYUFJDC-UHFFFAOYSA-N 1 2 304.393 4.149 20 0 DIADLO CCOc1ccc2ccccc2c1C[N@H+]1Cc2cccnc2C1 ZINC001138439737 1046182902 /nfs/dbraw/zinc/18/29/02/1046182902.db2.gz CNHMYKWEYUFJDC-UHFFFAOYSA-N 1 2 304.393 4.149 20 0 DIADLO Fc1ccccc1[C@H]([NH2+][C@H]1CCCC1(F)F)C1CCOCC1 ZINC000903171070 1046183146 /nfs/dbraw/zinc/18/31/46/1046183146.db2.gz MIMCLVJEQXVYEC-JKSUJKDBSA-N 1 2 313.363 4.071 20 0 DIADLO CCCCc1noc(C[N@H+](Cc2cccc(Cl)c2)C(C)C)n1 ZINC000059038130 1046184265 /nfs/dbraw/zinc/18/42/65/1046184265.db2.gz UELWDGDQRLPHKT-UHFFFAOYSA-N 1 2 321.852 4.476 20 0 DIADLO CCCCc1noc(C[N@@H+](Cc2cccc(Cl)c2)C(C)C)n1 ZINC000059038130 1046184271 /nfs/dbraw/zinc/18/42/71/1046184271.db2.gz UELWDGDQRLPHKT-UHFFFAOYSA-N 1 2 321.852 4.476 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1)N1CC[C@@H]([NH3+])c2ccccc21 ZINC001168154574 1046195001 /nfs/dbraw/zinc/19/50/01/1046195001.db2.gz NCPJSZSLNGXXRT-SUMWQHHRSA-N 1 2 300.833 4.181 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CCCO1 ZINC001204695687 1046195298 /nfs/dbraw/zinc/19/52/98/1046195298.db2.gz YTHOWSFKNYZQGH-CYBMUJFWSA-N 1 2 305.805 4.211 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CCCO1 ZINC001204695687 1046195307 /nfs/dbraw/zinc/19/53/07/1046195307.db2.gz YTHOWSFKNYZQGH-CYBMUJFWSA-N 1 2 305.805 4.211 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1ncc(-c2cccc(F)c2)o1 ZINC000475755447 1046201890 /nfs/dbraw/zinc/20/18/90/1046201890.db2.gz XUBCKHIMISIIAQ-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1ncc(-c2cccc(F)c2)o1 ZINC000475755447 1046201909 /nfs/dbraw/zinc/20/19/09/1046201909.db2.gz XUBCKHIMISIIAQ-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO Cc1ccc(Cl)c(NC(=O)[C@@H](CC(C)C)n2cc[nH+]c2)c1 ZINC000635690033 1046202517 /nfs/dbraw/zinc/20/25/17/1046202517.db2.gz OPQOWBWKSSLWLJ-OAHLLOKOSA-N 1 2 305.809 4.071 20 0 DIADLO CC(C)c1ccc([C@H]2CCCN2C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)cc1 ZINC000635741442 1046203075 /nfs/dbraw/zinc/20/30/75/1046203075.db2.gz DWZFBOULBWIAMJ-ZHALLVOQSA-N 1 2 323.440 4.000 20 0 DIADLO CC(C)c1ccc([C@H]2CCCN2C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)cc1 ZINC000635741442 1046203089 /nfs/dbraw/zinc/20/30/89/1046203089.db2.gz DWZFBOULBWIAMJ-ZHALLVOQSA-N 1 2 323.440 4.000 20 0 DIADLO CC(C)=C(C)CC(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000635738759 1046203161 /nfs/dbraw/zinc/20/31/61/1046203161.db2.gz BUPMLLGSCVCXNB-UHFFFAOYSA-N 1 2 321.424 4.287 20 0 DIADLO COc1c(Cl)cccc1C[NH2+][C@@H](C)c1cc(O)ccc1F ZINC000903247330 1046206940 /nfs/dbraw/zinc/20/69/40/1046206940.db2.gz UFAQRXHKACCUOK-JTQLQIEISA-N 1 2 309.768 4.044 20 0 DIADLO CCCc1ccc(C[N@@H+]2Cc3ccc(C(=O)OC)cc3C2)s1 ZINC001138528628 1046211025 /nfs/dbraw/zinc/21/10/25/1046211025.db2.gz YDRHWZRHUUFSBB-UHFFFAOYSA-N 1 2 315.438 4.003 20 0 DIADLO CCCc1ccc(C[N@H+]2Cc3ccc(C(=O)OC)cc3C2)s1 ZINC001138528628 1046211040 /nfs/dbraw/zinc/21/10/40/1046211040.db2.gz YDRHWZRHUUFSBB-UHFFFAOYSA-N 1 2 315.438 4.003 20 0 DIADLO CC(C)C[C@H]([NH2+][C@H]1c2ccccc2OC[C@H]1F)c1ccncc1 ZINC000903266281 1046212632 /nfs/dbraw/zinc/21/26/32/1046212632.db2.gz MPJYCCGTKHRPDG-AOIWGVFYSA-N 1 2 314.404 4.230 20 0 DIADLO CC(C)COc1ccccc1C[NH2+]Cc1cc(C(C)C)no1 ZINC000648452130 1046217401 /nfs/dbraw/zinc/21/74/01/1046217401.db2.gz HQSVZLSBDYICGO-UHFFFAOYSA-N 1 2 302.418 4.123 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1ccccc1C(C)C ZINC000102519195 1046217941 /nfs/dbraw/zinc/21/79/41/1046217941.db2.gz IVSORARDNINGGR-HNNXBMFYSA-N 1 2 314.429 4.252 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1ccccc1C(C)C ZINC000102519195 1046217954 /nfs/dbraw/zinc/21/79/54/1046217954.db2.gz IVSORARDNINGGR-HNNXBMFYSA-N 1 2 314.429 4.252 20 0 DIADLO CCc1nc(C)c([C@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)s1 ZINC000903313586 1046234322 /nfs/dbraw/zinc/23/43/22/1046234322.db2.gz UFOYZRNFJDLPFC-JTQLQIEISA-N 1 2 307.463 4.150 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccc2c(c1)CCO2 ZINC000903313014 1046235182 /nfs/dbraw/zinc/23/51/82/1046235182.db2.gz FRANSAONVLIZAL-OAHLLOKOSA-N 1 2 314.429 4.148 20 0 DIADLO Cc1ccc2cc([C@H](C)[NH2+][C@@H](c3ncccn3)C3CC3)oc2c1 ZINC000903324232 1046238179 /nfs/dbraw/zinc/23/81/79/1046238179.db2.gz CWOSZCBCJDUSEX-SCLBCKFNSA-N 1 2 307.397 4.333 20 0 DIADLO CC(C)c1ccc([C@@H](C)CC(=O)OCCCn2cc[nH+]c2)cc1 ZINC000783748010 1046241909 /nfs/dbraw/zinc/24/19/09/1046241909.db2.gz YXJHMZDTHJGISC-INIZCTEOSA-N 1 2 314.429 4.134 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H](c2ccccn2)C2CC2)cs1 ZINC000903334954 1046245623 /nfs/dbraw/zinc/24/56/23/1046245623.db2.gz JDBXOTXFHONGJG-MLGOLLRUSA-N 1 2 301.459 4.463 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@@H](c2ccccn2)C2CC2)cs1 ZINC000903334952 1046246667 /nfs/dbraw/zinc/24/66/67/1046246667.db2.gz JDBXOTXFHONGJG-BLLLJJGKSA-N 1 2 301.459 4.463 20 0 DIADLO CCSc1ncc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cn1 ZINC001138650597 1046256624 /nfs/dbraw/zinc/25/66/24/1046256624.db2.gz YWVABWNFKLUADL-INIZCTEOSA-N 1 2 317.433 4.065 20 0 DIADLO CCSc1ncc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cn1 ZINC001138650597 1046256635 /nfs/dbraw/zinc/25/66/35/1046256635.db2.gz YWVABWNFKLUADL-INIZCTEOSA-N 1 2 317.433 4.065 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCc2ccc(F)c(F)c2C1 ZINC001168176532 1046267306 /nfs/dbraw/zinc/26/73/06/1046267306.db2.gz WLOOZBGMEPFPHJ-UHFFFAOYSA-N 1 2 305.393 4.245 20 0 DIADLO CSc1ccccc1C[N@H+]1CCc2ccc(F)c(F)c2C1 ZINC001168176532 1046267316 /nfs/dbraw/zinc/26/73/16/1046267316.db2.gz WLOOZBGMEPFPHJ-UHFFFAOYSA-N 1 2 305.393 4.245 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2c(C)cccc2Cl)c1OC ZINC001138722095 1046276185 /nfs/dbraw/zinc/27/61/85/1046276185.db2.gz PNGFXLSLURSUDP-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2c(C)cccc2Cl)c1OC ZINC001138722095 1046276196 /nfs/dbraw/zinc/27/61/96/1046276196.db2.gz PNGFXLSLURSUDP-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO CC(C)c1nc(C[N@H+](C)Cc2ccc3c(c2)CCCO3)cs1 ZINC001138718826 1046276896 /nfs/dbraw/zinc/27/68/96/1046276896.db2.gz OAERSHFRQKVLMZ-UHFFFAOYSA-N 1 2 316.470 4.224 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)Cc2ccc3c(c2)CCCO3)cs1 ZINC001138718826 1046276905 /nfs/dbraw/zinc/27/69/05/1046276905.db2.gz OAERSHFRQKVLMZ-UHFFFAOYSA-N 1 2 316.470 4.224 20 0 DIADLO CCc1cccc2cc(C[N@@H+]3C[C@H](F)C[C@H]3C)c(Cl)nc21 ZINC001138726848 1046279865 /nfs/dbraw/zinc/27/98/65/1046279865.db2.gz PHXIBBRNVBLKPK-IAQYHMDHSA-N 1 2 306.812 4.383 20 0 DIADLO CCc1cccc2cc(C[N@H+]3C[C@H](F)C[C@H]3C)c(Cl)nc21 ZINC001138726848 1046279874 /nfs/dbraw/zinc/27/98/74/1046279874.db2.gz PHXIBBRNVBLKPK-IAQYHMDHSA-N 1 2 306.812 4.383 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1OC ZINC001138746189 1046286525 /nfs/dbraw/zinc/28/65/25/1046286525.db2.gz SLLDJXRSDDZJLD-MRXNPFEDSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(Cl)cc(C[N@H+]2CC[C@@H]2c2ccccc2)c1OC ZINC001138746189 1046286535 /nfs/dbraw/zinc/28/65/35/1046286535.db2.gz SLLDJXRSDDZJLD-MRXNPFEDSA-N 1 2 317.816 4.304 20 0 DIADLO Cc1csc([C@H]2CCCC[N@H+]2[C@H](C)c2cnc(C)nc2C)n1 ZINC000638000009 1046292851 /nfs/dbraw/zinc/29/28/51/1046292851.db2.gz MHCLHRNYUQJUNR-CZUORRHYSA-N 1 2 316.474 4.147 20 0 DIADLO Cc1csc([C@H]2CCCC[N@@H+]2[C@H](C)c2cnc(C)nc2C)n1 ZINC000638000009 1046292858 /nfs/dbraw/zinc/29/28/58/1046292858.db2.gz MHCLHRNYUQJUNR-CZUORRHYSA-N 1 2 316.474 4.147 20 0 DIADLO Fc1ncccc1C[NH+](Cc1ccccc1)Cc1ccccc1 ZINC001138787054 1046293767 /nfs/dbraw/zinc/29/37/67/1046293767.db2.gz BCJXZZSDEOETGV-UHFFFAOYSA-N 1 2 306.384 4.423 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1ccnc(Cl)c1 ZINC000246055215 1046296480 /nfs/dbraw/zinc/29/64/80/1046296480.db2.gz FHTNCNHMHPJVBU-LBTNJELSSA-N 1 2 316.832 4.086 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1ccnc(Cl)c1 ZINC000246055215 1046296490 /nfs/dbraw/zinc/29/64/90/1046296490.db2.gz FHTNCNHMHPJVBU-LBTNJELSSA-N 1 2 316.832 4.086 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1ccnc(Cl)c1 ZINC000246055213 1046296749 /nfs/dbraw/zinc/29/67/49/1046296749.db2.gz FHTNCNHMHPJVBU-HBUWYVDXSA-N 1 2 316.832 4.086 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1ccnc(Cl)c1 ZINC000246055213 1046296757 /nfs/dbraw/zinc/29/67/57/1046296757.db2.gz FHTNCNHMHPJVBU-HBUWYVDXSA-N 1 2 316.832 4.086 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc2occc2c1 ZINC001138825017 1046301548 /nfs/dbraw/zinc/30/15/48/1046301548.db2.gz PBFQEGQALSJOIX-INIZCTEOSA-N 1 2 315.413 4.129 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc2occc2c1 ZINC001138825017 1046301564 /nfs/dbraw/zinc/30/15/64/1046301564.db2.gz PBFQEGQALSJOIX-INIZCTEOSA-N 1 2 315.413 4.129 20 0 DIADLO F[C@@H]1C[N@H+](Cc2c[nH]c3c2cccc3Cl)CCCC1(F)F ZINC001138830151 1046306145 /nfs/dbraw/zinc/30/61/45/1046306145.db2.gz GFDZSANFVOYLLU-CYBMUJFWSA-N 1 2 316.754 4.391 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2c[nH]c3c2cccc3Cl)CCCC1(F)F ZINC001138830151 1046306157 /nfs/dbraw/zinc/30/61/57/1046306157.db2.gz GFDZSANFVOYLLU-CYBMUJFWSA-N 1 2 316.754 4.391 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(Oc3ccccc3)cc2)nn1C ZINC001138830297 1046306226 /nfs/dbraw/zinc/30/62/26/1046306226.db2.gz FGAJKSJZBUMQDB-UHFFFAOYSA-N 1 2 321.424 4.153 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)nn1C ZINC001138830297 1046306244 /nfs/dbraw/zinc/30/62/44/1046306244.db2.gz FGAJKSJZBUMQDB-UHFFFAOYSA-N 1 2 321.424 4.153 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)cc1 ZINC000638291967 1046310375 /nfs/dbraw/zinc/31/03/75/1046310375.db2.gz CLKBKTRJRAOCNZ-RDTXWAMCSA-N 1 2 312.461 4.339 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CCn4cccc4C3)c(Cl)nc2c1 ZINC001138858940 1046311133 /nfs/dbraw/zinc/31/11/33/1046311133.db2.gz HBGCMYUSNULQRY-UHFFFAOYSA-N 1 2 311.816 4.014 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CCn4cccc4C3)c(Cl)nc2c1 ZINC001138858940 1046311146 /nfs/dbraw/zinc/31/11/46/1046311146.db2.gz HBGCMYUSNULQRY-UHFFFAOYSA-N 1 2 311.816 4.014 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1cccs1)c1ccccn1 ZINC000089796929 1046315082 /nfs/dbraw/zinc/31/50/82/1046315082.db2.gz FMOIHIOHXMLZPP-SFHVURJKSA-N 1 2 310.422 4.031 20 0 DIADLO CCCCn1nc(C)c(CNc2ccc(C)[nH+]c2C)c1Cl ZINC000759091748 1046319026 /nfs/dbraw/zinc/31/90/26/1046319026.db2.gz CHIZMYDSNJSUNB-UHFFFAOYSA-N 1 2 306.841 4.269 20 0 DIADLO CC(C)COc1ccccc1C[NH2+]Cc1nc2ccccc2o1 ZINC000638403566 1046320276 /nfs/dbraw/zinc/32/02/76/1046320276.db2.gz LRTANVCARJYDRS-UHFFFAOYSA-N 1 2 310.397 4.152 20 0 DIADLO CCn1c(=S)n(C[N@@H+]2CCC[C@H](CC(C)C)C2)nc1C1CC1 ZINC000759143246 1046325475 /nfs/dbraw/zinc/32/54/75/1046325475.db2.gz CQMWAQFQMPGITH-CQSZACIVSA-N 1 2 322.522 4.027 20 0 DIADLO CCn1c(=S)n(C[N@H+]2CCC[C@H](CC(C)C)C2)nc1C1CC1 ZINC000759143246 1046325489 /nfs/dbraw/zinc/32/54/89/1046325489.db2.gz CQMWAQFQMPGITH-CQSZACIVSA-N 1 2 322.522 4.027 20 0 DIADLO Cc1cc(C)cc([C@@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000638530648 1046326850 /nfs/dbraw/zinc/32/68/50/1046326850.db2.gz BCSJATYGSFKUAW-CRAIPNDOSA-N 1 2 312.461 4.394 20 0 DIADLO CCC(=CC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)CC ZINC000759170558 1046328679 /nfs/dbraw/zinc/32/86/79/1046328679.db2.gz NNBKGFOFFFXVRB-UHFFFAOYSA-N 1 2 303.793 4.211 20 0 DIADLO Cn1c2ccccc2c2cc(C[N@@H+]3Cc4ccncc4C3)ccc21 ZINC001138918984 1046329953 /nfs/dbraw/zinc/32/99/53/1046329953.db2.gz WHGBXIVSPFDARL-UHFFFAOYSA-N 1 2 313.404 4.242 20 0 DIADLO Cn1c2ccccc2c2cc(C[N@H+]3Cc4ccncc4C3)ccc21 ZINC001138918984 1046329966 /nfs/dbraw/zinc/32/99/66/1046329966.db2.gz WHGBXIVSPFDARL-UHFFFAOYSA-N 1 2 313.404 4.242 20 0 DIADLO Cc1ccc(C[C@@H](C)[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)s1 ZINC000638661191 1046333578 /nfs/dbraw/zinc/33/35/78/1046333578.db2.gz YPSJJLUXQKKEJI-MLGOLLRUSA-N 1 2 318.490 4.017 20 0 DIADLO CC[C@H]1CCC[N@H+](Cc2cc(Br)cnc2Cl)C1 ZINC001138945634 1046333745 /nfs/dbraw/zinc/33/37/45/1046333745.db2.gz LRSNHGWROGGQNF-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@H]1CCC[N@@H+](Cc2cc(Br)cnc2Cl)C1 ZINC001138945634 1046333761 /nfs/dbraw/zinc/33/37/61/1046333761.db2.gz LRSNHGWROGGQNF-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1cc(Br)cnc1Cl ZINC001138945381 1046335236 /nfs/dbraw/zinc/33/52/36/1046335236.db2.gz CZIFRVZWLOLZSL-GFCCVEGCSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1cc(Br)cnc1Cl ZINC001138945381 1046335251 /nfs/dbraw/zinc/33/52/51/1046335251.db2.gz CZIFRVZWLOLZSL-GFCCVEGCSA-N 1 2 317.658 4.262 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@@H+]1Cc1nnc(C(C)(C)C)o1 ZINC000832522894 1046335414 /nfs/dbraw/zinc/33/54/14/1046335414.db2.gz CAJIJHPBBNSJQF-HNNXBMFYSA-N 1 2 317.408 4.152 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@H+]1Cc1nnc(C(C)(C)C)o1 ZINC000832522894 1046335424 /nfs/dbraw/zinc/33/54/24/1046335424.db2.gz CAJIJHPBBNSJQF-HNNXBMFYSA-N 1 2 317.408 4.152 20 0 DIADLO COc1cccc(C)c1C[NH2+]Cc1coc(-c2ccc(C)cc2)n1 ZINC000638701000 1046335722 /nfs/dbraw/zinc/33/57/22/1046335722.db2.gz MGZQMNIUUFBGND-UHFFFAOYSA-N 1 2 322.408 4.257 20 0 DIADLO CC(C)Oc1ccc(Cl)cc1C[N@H+](C)Cc1cccnc1 ZINC001138957834 1046338862 /nfs/dbraw/zinc/33/88/62/1046338862.db2.gz OTEBWBOJJATEGR-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO CC(C)Oc1ccc(Cl)cc1C[N@@H+](C)Cc1cccnc1 ZINC001138957834 1046338878 /nfs/dbraw/zinc/33/88/78/1046338878.db2.gz OTEBWBOJJATEGR-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@H]1CC1(F)F ZINC000638803651 1046342703 /nfs/dbraw/zinc/34/27/03/1046342703.db2.gz GSMLJPICLVPFKF-IUODEOHRSA-N 1 2 315.367 4.057 20 0 DIADLO CC(C)COc1ccc(C[N@H+](C)CC(=O)c2ccccc2)cc1 ZINC001138970585 1046343181 /nfs/dbraw/zinc/34/31/81/1046343181.db2.gz QRZZAYPLOKSUFU-UHFFFAOYSA-N 1 2 311.425 4.036 20 0 DIADLO CC(C)COc1ccc(C[N@@H+](C)CC(=O)c2ccccc2)cc1 ZINC001138970585 1046343193 /nfs/dbraw/zinc/34/31/93/1046343193.db2.gz QRZZAYPLOKSUFU-UHFFFAOYSA-N 1 2 311.425 4.036 20 0 DIADLO Fc1ccc2ccnc(NCc3ccc(-n4cc[nH+]c4)cc3)c2c1 ZINC000759314613 1046343988 /nfs/dbraw/zinc/34/39/88/1046343988.db2.gz GQCPHRGJXRLYHY-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO CC1=C(C)C[C@H]([C@@H](C)[NH2+][C@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000639062624 1046356874 /nfs/dbraw/zinc/35/68/74/1046356874.db2.gz RNFAQEQCDDBULP-NXHRZFHOSA-N 1 2 310.445 4.009 20 0 DIADLO C[C@@H](CCCC(F)(F)F)[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1 ZINC000639106013 1046359485 /nfs/dbraw/zinc/35/94/85/1046359485.db2.gz KFIJYEPXWJYPHX-WCQYABFASA-N 1 2 318.387 4.137 20 0 DIADLO Cc1ccccc1C1([NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)CCC1 ZINC000639290858 1046377113 /nfs/dbraw/zinc/37/71/13/1046377113.db2.gz WGUQOYJXYSVCFH-GOSISDBHSA-N 1 2 324.472 4.404 20 0 DIADLO Cc1nc2c(o1)CC[N@H+](Cc1cccc(-c3ccc(F)cc3)c1)C2 ZINC001139069630 1046380482 /nfs/dbraw/zinc/38/04/82/1046380482.db2.gz SARAWDOZQXNHLY-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1nc2c(o1)CC[N@@H+](Cc1cccc(-c3ccc(F)cc3)c1)C2 ZINC001139069630 1046380497 /nfs/dbraw/zinc/38/04/97/1046380497.db2.gz SARAWDOZQXNHLY-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO COc1ccc(C(C)C)cc1C[NH2+][C@@H](C)c1c(F)cncc1F ZINC000653674393 1046380657 /nfs/dbraw/zinc/38/06/57/1046380657.db2.gz ATAGTGHXOSTFSM-LBPRGKRZSA-N 1 2 320.383 4.343 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccco2)C2CC2)c(Cl)c1OC ZINC001139120142 1046389619 /nfs/dbraw/zinc/38/96/19/1046389619.db2.gz KSBWGTWAGFNLIV-UHFFFAOYSA-N 1 2 321.804 4.115 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccco2)C2CC2)c(Cl)c1OC ZINC001139120142 1046389631 /nfs/dbraw/zinc/38/96/31/1046389631.db2.gz KSBWGTWAGFNLIV-UHFFFAOYSA-N 1 2 321.804 4.115 20 0 DIADLO C[C@@H]([NH2+]Cc1cc[nH]n1)c1ccc(Cl)c(Cl)c1Cl ZINC000041015394 1046392228 /nfs/dbraw/zinc/39/22/28/1046392228.db2.gz XAJWNVTUOAPYHG-SSDOTTSWSA-N 1 2 304.608 4.221 20 0 DIADLO COc1cc(O)ccc1C[N@@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001139145264 1046396581 /nfs/dbraw/zinc/39/65/81/1046396581.db2.gz XDKKONWVXBMRJI-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cc(O)ccc1C[N@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001139145264 1046396586 /nfs/dbraw/zinc/39/65/86/1046396586.db2.gz XDKKONWVXBMRJI-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO CCCCc1nc(Cl)c(C[N@H+](CC)Cc2ccccc2)[nH]1 ZINC001139174581 1046402979 /nfs/dbraw/zinc/40/29/79/1046402979.db2.gz QEZQZKAJYZOTBM-UHFFFAOYSA-N 1 2 305.853 4.428 20 0 DIADLO CCCCc1nc(Cl)c(C[N@@H+](CC)Cc2ccccc2)[nH]1 ZINC001139174581 1046402984 /nfs/dbraw/zinc/40/29/84/1046402984.db2.gz QEZQZKAJYZOTBM-UHFFFAOYSA-N 1 2 305.853 4.428 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)CC(=O)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000639462274 1046403705 /nfs/dbraw/zinc/40/37/05/1046403705.db2.gz UEEJPYLMJWEJLS-UPJWGTAASA-N 1 2 317.351 4.210 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)CC(=O)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000639462274 1046403707 /nfs/dbraw/zinc/40/37/07/1046403707.db2.gz UEEJPYLMJWEJLS-UPJWGTAASA-N 1 2 317.351 4.210 20 0 DIADLO CCSc1nn(C[N@@H+]2CCC[C@@H]2CC(C)C)c(=S)s1 ZINC000748792720 1046404161 /nfs/dbraw/zinc/40/41/61/1046404161.db2.gz RKBXUXVESIQUCP-LLVKDONJSA-N 1 2 317.549 4.254 20 0 DIADLO CCSc1nn(C[N@H+]2CCC[C@@H]2CC(C)C)c(=S)s1 ZINC000748792720 1046404171 /nfs/dbraw/zinc/40/41/71/1046404171.db2.gz RKBXUXVESIQUCP-LLVKDONJSA-N 1 2 317.549 4.254 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@H+](Cc2csc(-c3ccoc3)n2)C1 ZINC000170983389 1046406633 /nfs/dbraw/zinc/40/66/33/1046406633.db2.gz RLGQQEOFFNWFGT-LLVKDONJSA-N 1 2 316.348 4.177 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2csc(-c3ccoc3)n2)C1 ZINC000170983389 1046406639 /nfs/dbraw/zinc/40/66/39/1046406639.db2.gz RLGQQEOFFNWFGT-LLVKDONJSA-N 1 2 316.348 4.177 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2nc(C3CCC3)no2)C2CCC2)cc1 ZINC000639529610 1046409223 /nfs/dbraw/zinc/40/92/23/1046409223.db2.gz JBSBVPHHTGASRL-QGZVFWFLSA-N 1 2 315.392 4.107 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CCC2)no1)c1cccc2ccccc21 ZINC000639562084 1046411726 /nfs/dbraw/zinc/41/17/26/1046411726.db2.gz SDHYGUGJFUCAAK-CYBMUJFWSA-N 1 2 307.397 4.341 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2nc(CC3CC3)no2)C(C)(C)C)c1 ZINC000639567381 1046412703 /nfs/dbraw/zinc/41/27/03/1046412703.db2.gz NREHVMLZSPEBEV-GOSISDBHSA-N 1 2 313.445 4.208 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1nc(C2CCC2)no1)c1cccs1 ZINC000639577697 1046413639 /nfs/dbraw/zinc/41/36/39/1046413639.db2.gz JAWAHECPXZOGLO-ZDUSSCGKSA-N 1 2 305.447 4.276 20 0 DIADLO c1cc2c(s1)CC[N@@H+](Cc1ccc(Oc3ccccc3)nc1)C2 ZINC001139241868 1046416533 /nfs/dbraw/zinc/41/65/33/1046416533.db2.gz BGIIPFLATQRBHD-UHFFFAOYSA-N 1 2 322.433 4.494 20 0 DIADLO c1cc2c(s1)CC[N@H+](Cc1ccc(Oc3ccccc3)nc1)C2 ZINC001139241868 1046416539 /nfs/dbraw/zinc/41/65/39/1046416539.db2.gz BGIIPFLATQRBHD-UHFFFAOYSA-N 1 2 322.433 4.494 20 0 DIADLO c1n[nH]cc1[C@H]1CCC[N@H+]1Cc1nc(C2CCCCC2)cs1 ZINC000639777696 1046426922 /nfs/dbraw/zinc/42/69/22/1046426922.db2.gz MZXPIIPLXOUBQQ-MRXNPFEDSA-N 1 2 316.474 4.251 20 0 DIADLO c1n[nH]cc1[C@H]1CCC[N@@H+]1Cc1nc(C2CCCCC2)cs1 ZINC000639777696 1046426929 /nfs/dbraw/zinc/42/69/29/1046426929.db2.gz MZXPIIPLXOUBQQ-MRXNPFEDSA-N 1 2 316.474 4.251 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+]3CCC[C@@H]3c3cn[nH]c3)n2)cc1 ZINC000639778906 1046427641 /nfs/dbraw/zinc/42/76/41/1046427641.db2.gz VTFQHEHRVGGWTQ-QGZVFWFLSA-N 1 2 324.453 4.179 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+]3CCC[C@@H]3c3cn[nH]c3)n2)cc1 ZINC000639778906 1046427649 /nfs/dbraw/zinc/42/76/49/1046427649.db2.gz VTFQHEHRVGGWTQ-QGZVFWFLSA-N 1 2 324.453 4.179 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1Cc1ccncc1Cl ZINC001168234637 1046435410 /nfs/dbraw/zinc/43/54/10/1046435410.db2.gz NGSLAGCLMROULC-VXGBXAGGSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1Cc1ccncc1Cl ZINC001168234637 1046435412 /nfs/dbraw/zinc/43/54/12/1046435412.db2.gz NGSLAGCLMROULC-VXGBXAGGSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Cl)cnc2Cl)CCC1(F)F ZINC001139354144 1046437132 /nfs/dbraw/zinc/43/71/32/1046437132.db2.gz LBKLCSFKIMLKTD-SECBINFHSA-N 1 2 309.187 4.256 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Cl)cnc2Cl)CCC1(F)F ZINC001139354144 1046437142 /nfs/dbraw/zinc/43/71/42/1046437142.db2.gz LBKLCSFKIMLKTD-SECBINFHSA-N 1 2 309.187 4.256 20 0 DIADLO CC(C)n1ncc2cc(C[N@@H+]3CC(C)(C)[C@H]3c3ccco3)cnc21 ZINC000639927453 1046437658 /nfs/dbraw/zinc/43/76/58/1046437658.db2.gz RRITWMJBRDQURQ-QGZVFWFLSA-N 1 2 324.428 4.188 20 0 DIADLO CC(C)n1ncc2cc(C[N@H+]3CC(C)(C)[C@H]3c3ccco3)cnc21 ZINC000639927453 1046437662 /nfs/dbraw/zinc/43/76/62/1046437662.db2.gz RRITWMJBRDQURQ-QGZVFWFLSA-N 1 2 324.428 4.188 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCc3cc(F)ccc3C2)c1 ZINC001137265678 1046439253 /nfs/dbraw/zinc/43/92/53/1046439253.db2.gz RRQZCZXSHUKPFA-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCc3cc(F)ccc3C2)c1 ZINC001137265678 1046439256 /nfs/dbraw/zinc/43/92/56/1046439256.db2.gz RRQZCZXSHUKPFA-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Nc1ccccc1Nc1ccccc1 ZINC000676830610 1046439542 /nfs/dbraw/zinc/43/95/42/1046439542.db2.gz LQYDPSKVJUYEAV-UHFFFAOYSA-N 1 2 320.396 4.046 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2ncc(-c3ccc(F)cc3)o2)s1 ZINC000639995095 1046441034 /nfs/dbraw/zinc/44/10/34/1046441034.db2.gz QRUJWJQMOHRPQM-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2csc(CCC(C)C)n2)s1 ZINC000639993402 1046441069 /nfs/dbraw/zinc/44/10/69/1046441069.db2.gz AXRTUCTZPXHXAF-LLVKDONJSA-N 1 2 309.504 4.347 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)n1 ZINC000676857017 1046441444 /nfs/dbraw/zinc/44/14/44/1046441444.db2.gz QMDQBNOBMRJTKA-LBPRGKRZSA-N 1 2 313.376 4.336 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1ccc(-c3cnccn3)cc1)C2 ZINC001139393405 1046442041 /nfs/dbraw/zinc/44/20/41/1046442041.db2.gz QFFKCTKTANMZSH-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1ccc(-c3cnccn3)cc1)C2 ZINC001139393405 1046442047 /nfs/dbraw/zinc/44/20/47/1046442047.db2.gz QFFKCTKTANMZSH-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO COc1ncc(C[N@H+](C)Cc2ccc(Cl)s2)cc1Cl ZINC000676881185 1046443078 /nfs/dbraw/zinc/44/30/78/1046443078.db2.gz WEKZOYRRHQXOEA-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO COc1ncc(C[N@@H+](C)Cc2ccc(Cl)s2)cc1Cl ZINC000676881185 1046443084 /nfs/dbraw/zinc/44/30/84/1046443084.db2.gz WEKZOYRRHQXOEA-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO c1sc(CCc2ccccc2)nc1C[N@H+]1[C@H]2C=CC[C@@H]1CC2 ZINC000676908939 1046445890 /nfs/dbraw/zinc/44/58/90/1046445890.db2.gz QLGVKKFFPQVOTP-ZWKOTPCHSA-N 1 2 310.466 4.221 20 0 DIADLO c1sc(CCc2ccccc2)nc1C[N@@H+]1[C@H]2C=CC[C@@H]1CC2 ZINC000676908939 1046445896 /nfs/dbraw/zinc/44/58/96/1046445896.db2.gz QLGVKKFFPQVOTP-ZWKOTPCHSA-N 1 2 310.466 4.221 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)CCC1=O ZINC001139414886 1046446819 /nfs/dbraw/zinc/44/68/19/1046446819.db2.gz CTRKNHCVCDCFGP-LBPRGKRZSA-N 1 2 303.789 4.011 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)CCC1=O ZINC001139414886 1046446821 /nfs/dbraw/zinc/44/68/21/1046446821.db2.gz CTRKNHCVCDCFGP-LBPRGKRZSA-N 1 2 303.789 4.011 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2nc3ccccc3s2)sc1C ZINC000719618752 1046446851 /nfs/dbraw/zinc/44/68/51/1046446851.db2.gz XZHKCWACMMCENE-JTQLQIEISA-N 1 2 303.456 4.220 20 0 DIADLO Cc1nc(C(C)C)ccc1C[NH2+][C@@H](CF)c1ccc(F)cc1 ZINC000640155824 1046451125 /nfs/dbraw/zinc/45/11/25/1046451125.db2.gz ZBMLOOMAHXFARY-SFHVURJKSA-N 1 2 304.384 4.453 20 0 DIADLO Clc1ccnc(Cl)c1C[N@@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001139478378 1046454102 /nfs/dbraw/zinc/45/41/02/1046454102.db2.gz MIIPQRYKCCIBGR-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccnc(Cl)c1C[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001139478378 1046454107 /nfs/dbraw/zinc/45/41/07/1046454107.db2.gz MIIPQRYKCCIBGR-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO CC(C)(C)n1cc(C[NH2+][C@@H](c2ccco2)c2ccccc2)cn1 ZINC000124799148 1046459865 /nfs/dbraw/zinc/45/98/65/1046459865.db2.gz MZOZYODJKXOQTI-GOSISDBHSA-N 1 2 309.413 4.110 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc(-c3ccccc3)nc1)C2 ZINC001139517711 1046459866 /nfs/dbraw/zinc/45/98/66/1046459866.db2.gz BMAYLUXPOHOWRZ-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc(-c3ccccc3)nc1)C2 ZINC001139517711 1046459873 /nfs/dbraw/zinc/45/98/73/1046459873.db2.gz BMAYLUXPOHOWRZ-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO Cc1ccc(Cl)cc1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000124845959 1046460753 /nfs/dbraw/zinc/46/07/53/1046460753.db2.gz TXPNVOMQYCTBEL-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2cccc(-c3ccccn3)c2)cs1 ZINC000125046579 1046462478 /nfs/dbraw/zinc/46/24/78/1046462478.db2.gz MJZJSNVMOVMLSM-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2cccc(-c3ccccn3)c2)cs1 ZINC000125046579 1046462482 /nfs/dbraw/zinc/46/24/82/1046462482.db2.gz MJZJSNVMOVMLSM-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1c[nH]c(-c2ccccc2)n1 ZINC001139555419 1046471587 /nfs/dbraw/zinc/47/15/87/1046471587.db2.gz WIRKRIGDIVIGFA-HNNXBMFYSA-N 1 2 321.424 4.278 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1c[nH]c(-c2ccccc2)n1 ZINC001139555419 1046471590 /nfs/dbraw/zinc/47/15/90/1046471590.db2.gz WIRKRIGDIVIGFA-HNNXBMFYSA-N 1 2 321.424 4.278 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC001139555419 1046471595 /nfs/dbraw/zinc/47/15/95/1046471595.db2.gz WIRKRIGDIVIGFA-HNNXBMFYSA-N 1 2 321.424 4.278 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC001139555419 1046471599 /nfs/dbraw/zinc/47/15/99/1046471599.db2.gz WIRKRIGDIVIGFA-HNNXBMFYSA-N 1 2 321.424 4.278 20 0 DIADLO Clc1ccnc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC001139563870 1046472139 /nfs/dbraw/zinc/47/21/39/1046472139.db2.gz WGTAKACAMBHCFN-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccnc(C[N@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC001139563870 1046472144 /nfs/dbraw/zinc/47/21/44/1046472144.db2.gz WGTAKACAMBHCFN-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO COC1(C)C[NH+](Cc2ccccc2-c2ccccc2Cl)C1 ZINC001139571775 1046475089 /nfs/dbraw/zinc/47/50/89/1046475089.db2.gz GFAOZZFPQKFKCH-UHFFFAOYSA-N 1 2 301.817 4.228 20 0 DIADLO Clc1ccccc1-c1ccccc1CN1CCn2c[nH+]cc2C1 ZINC001139577294 1046477324 /nfs/dbraw/zinc/47/73/24/1046477324.db2.gz VGAOWTNFAWHIKS-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccccc2-c2ccccc2Cl)CCC1=O ZINC001139576217 1046477334 /nfs/dbraw/zinc/47/73/34/1046477334.db2.gz RPIQFLXDDWHEHP-AWEZNQCLSA-N 1 2 313.828 4.418 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccccc2-c2ccccc2Cl)CCC1=O ZINC001139576217 1046477336 /nfs/dbraw/zinc/47/73/36/1046477336.db2.gz RPIQFLXDDWHEHP-AWEZNQCLSA-N 1 2 313.828 4.418 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3ncc(C)cc3C2)cc1Cl ZINC001139597874 1046482337 /nfs/dbraw/zinc/48/23/37/1046482337.db2.gz MOYNFIJLAKNFLL-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3ncc(C)cc3C2)cc1Cl ZINC001139597874 1046482345 /nfs/dbraw/zinc/48/23/45/1046482345.db2.gz MOYNFIJLAKNFLL-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO COc1ccncc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)s1 ZINC001139609305 1046484173 /nfs/dbraw/zinc/48/41/73/1046484173.db2.gz UCDRAMOMDBMBDN-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccncc1C[N@H+]1CCC[C@H]1c1ccc(Cl)s1 ZINC001139609305 1046484181 /nfs/dbraw/zinc/48/41/81/1046484181.db2.gz UCDRAMOMDBMBDN-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cc(C[N@@H+]2CCc3cc(F)ccc3C2)ccc1Cl ZINC001139615910 1046486294 /nfs/dbraw/zinc/48/62/94/1046486294.db2.gz PSLJHRYTOMGLLB-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(C[N@H+]2CCc3cc(F)ccc3C2)ccc1Cl ZINC001139615910 1046486296 /nfs/dbraw/zinc/48/62/96/1046486296.db2.gz PSLJHRYTOMGLLB-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CCCCC[C@H](C(=O)N1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1)C(C)C ZINC000247544634 1046488179 /nfs/dbraw/zinc/48/81/79/1046488179.db2.gz KDURGXDOLPKHOO-BZSNNMDCSA-N 1 2 319.493 4.145 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3CCC(C)(C)C3)c2)[nH+]c1C ZINC000781950810 1046489574 /nfs/dbraw/zinc/48/95/74/1046489574.db2.gz JWNDUMRATINKLU-HNNXBMFYSA-N 1 2 311.429 4.458 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1cccc(Cl)n1)[C@H]2C ZINC000782097339 1046494515 /nfs/dbraw/zinc/49/45/15/1046494515.db2.gz JCLJGUOYXCWUIC-STQMWFEESA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1cccc(Cl)n1)[C@H]2C ZINC000782097339 1046494518 /nfs/dbraw/zinc/49/45/18/1046494518.db2.gz JCLJGUOYXCWUIC-STQMWFEESA-N 1 2 316.832 4.251 20 0 DIADLO Fc1cccc([C@@H]2CC[N@@H+]2Cc2cnn(Cc3ccccc3)c2)c1 ZINC000677441207 1046496221 /nfs/dbraw/zinc/49/62/21/1046496221.db2.gz IXCDLTZVMMTPAP-FQEVSTJZSA-N 1 2 321.399 4.018 20 0 DIADLO Fc1cccc([C@@H]2CC[N@H+]2Cc2cnn(Cc3ccccc3)c2)c1 ZINC000677441207 1046496231 /nfs/dbraw/zinc/49/62/31/1046496231.db2.gz IXCDLTZVMMTPAP-FQEVSTJZSA-N 1 2 321.399 4.018 20 0 DIADLO CCC[C@@H](C)[N@@H+]1CCO[C@H](c2ccccc2Br)C1 ZINC000782181285 1046497884 /nfs/dbraw/zinc/49/78/84/1046497884.db2.gz RACMARQWDGBETO-DOMZBBRYSA-N 1 2 312.251 4.011 20 0 DIADLO CCC[C@@H](C)[N@H+]1CCO[C@H](c2ccccc2Br)C1 ZINC000782181285 1046497887 /nfs/dbraw/zinc/49/78/87/1046497887.db2.gz RACMARQWDGBETO-DOMZBBRYSA-N 1 2 312.251 4.011 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](C)c2nc3ccccc3n2C(F)F)o1 ZINC000641705790 1046505269 /nfs/dbraw/zinc/50/52/69/1046505269.db2.gz UJSJYBSHMVNUGE-NSHDSACASA-N 1 2 319.355 4.438 20 0 DIADLO COc1ncc(Cl)cc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001139744747 1046509059 /nfs/dbraw/zinc/50/90/59/1046509059.db2.gz QYDGWNKCJXMDNT-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(Cl)cc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001139744747 1046509071 /nfs/dbraw/zinc/50/90/71/1046509071.db2.gz QYDGWNKCJXMDNT-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO c1ccc2c(c1)oc1ccc(C[N@@H+]3Cc4cccnc4C3)cc12 ZINC001139750902 1046511231 /nfs/dbraw/zinc/51/12/31/1046511231.db2.gz BAJIDFRGTCJQDL-UHFFFAOYSA-N 1 2 300.361 4.497 20 0 DIADLO c1ccc2c(c1)oc1ccc(C[N@H+]3Cc4cccnc4C3)cc12 ZINC001139750902 1046511242 /nfs/dbraw/zinc/51/12/42/1046511242.db2.gz BAJIDFRGTCJQDL-UHFFFAOYSA-N 1 2 300.361 4.497 20 0 DIADLO COc1ncc(Cl)cc1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001139749258 1046512658 /nfs/dbraw/zinc/51/26/58/1046512658.db2.gz RNMFNQRNRYZGOC-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1ncc(Cl)cc1C[N@@H+]1CC=C(c2ccccc2)CC1 ZINC001139749258 1046512669 /nfs/dbraw/zinc/51/26/69/1046512669.db2.gz RNMFNQRNRYZGOC-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO CC(C)c1nc(C[NH+]2CC(Cc3ccc(F)cc3)C2)cs1 ZINC000677699288 1046514241 /nfs/dbraw/zinc/51/42/41/1046514241.db2.gz CFMMPZZRHVQEPD-UHFFFAOYSA-N 1 2 304.434 4.080 20 0 DIADLO FC(F)c1ccccc1C[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC001139795543 1046520020 /nfs/dbraw/zinc/52/00/20/1046520020.db2.gz IWECNGREXWSYAO-QGZVFWFLSA-N 1 2 303.352 4.198 20 0 DIADLO FC(F)c1ccccc1C[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC001139795543 1046520026 /nfs/dbraw/zinc/52/00/26/1046520026.db2.gz IWECNGREXWSYAO-QGZVFWFLSA-N 1 2 303.352 4.198 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[NH+]1CC2(C1)CC(F)(F)C2 ZINC000677738501 1046520208 /nfs/dbraw/zinc/52/02/08/1046520208.db2.gz IMISSTHNHSQLPW-GFCCVEGCSA-N 1 2 304.340 4.134 20 0 DIADLO Cc1csc(CCNc2cc(C(C)C)[nH+]c(C(C)C)n2)n1 ZINC000677742802 1046520407 /nfs/dbraw/zinc/52/04/07/1046520407.db2.gz PZCULEIEXQYATC-UHFFFAOYSA-N 1 2 304.463 4.143 20 0 DIADLO Cc1nc(C[NH2+]Cc2cccc(Cl)c2Cl)sc1C ZINC000693675892 1046522845 /nfs/dbraw/zinc/52/28/45/1046522845.db2.gz QWDZHWGWWCHOEW-UHFFFAOYSA-N 1 2 301.242 4.357 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(Cl)ncc2Br)[C@@H](C)C1 ZINC001139807185 1046522900 /nfs/dbraw/zinc/52/29/00/1046522900.db2.gz SXYQNZXCFJLAOB-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(Cl)ncc2Br)[C@@H](C)C1 ZINC001139807185 1046522910 /nfs/dbraw/zinc/52/29/10/1046522910.db2.gz SXYQNZXCFJLAOB-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO COc1ncc(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)s1 ZINC001139817540 1046524309 /nfs/dbraw/zinc/52/43/09/1046524309.db2.gz WZLJEWUROPWDEO-OAHLLOKOSA-N 1 2 306.406 4.018 20 0 DIADLO COc1ncc(C[N@H+]2CCCC[C@@H]2c2ccccc2F)s1 ZINC001139817540 1046524315 /nfs/dbraw/zinc/52/43/15/1046524315.db2.gz WZLJEWUROPWDEO-OAHLLOKOSA-N 1 2 306.406 4.018 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000641959459 1046532513 /nfs/dbraw/zinc/53/25/13/1046532513.db2.gz CSYKSFWZFPVEOV-RDTXWAMCSA-N 1 2 301.817 4.475 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000641959459 1046532523 /nfs/dbraw/zinc/53/25/23/1046532523.db2.gz CSYKSFWZFPVEOV-RDTXWAMCSA-N 1 2 301.817 4.475 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+]Cc1ccc(Cl)cc1F)CCC2 ZINC000782530795 1046533646 /nfs/dbraw/zinc/53/36/46/1046533646.db2.gz MLIPRDHQQUQBCB-MRXNPFEDSA-N 1 2 321.827 4.424 20 0 DIADLO Cn1c(C[N@H+](C)Cc2cccc(F)c2F)cc2ccccc21 ZINC001139872515 1046536147 /nfs/dbraw/zinc/53/61/47/1046536147.db2.gz NSFIYAFOBVSHNO-UHFFFAOYSA-N 1 2 300.352 4.089 20 0 DIADLO Cn1c(C[N@@H+](C)Cc2cccc(F)c2F)cc2ccccc21 ZINC001139872515 1046536157 /nfs/dbraw/zinc/53/61/57/1046536157.db2.gz NSFIYAFOBVSHNO-UHFFFAOYSA-N 1 2 300.352 4.089 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccc(Cl)nc1 ZINC000179132770 1046543031 /nfs/dbraw/zinc/54/30/31/1046543031.db2.gz XPXAVFVGZIKKBH-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1C[N@@H+]1CCc2ncsc2C1 ZINC001139886703 1046544455 /nfs/dbraw/zinc/54/44/55/1046544455.db2.gz JJUCZRBNUYLODP-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1C[N@H+]1CCc2ncsc2C1 ZINC001139886703 1046544464 /nfs/dbraw/zinc/54/44/64/1046544464.db2.gz JJUCZRBNUYLODP-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1cnc2c(c1)C[N@@H+](Cc1cc(C(F)(F)F)ccc1C)CC2 ZINC001139887979 1046546082 /nfs/dbraw/zinc/54/60/82/1046546082.db2.gz GPSGJUZSUQNTTK-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cnc2c(c1)C[N@H+](Cc1cc(C(F)(F)F)ccc1C)CC2 ZINC001139887979 1046546095 /nfs/dbraw/zinc/54/60/95/1046546095.db2.gz GPSGJUZSUQNTTK-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO CCCCCC[C@@H](C)NC(=O)C[N@@H+]1CCc2sccc2[C@H]1C ZINC000783010981 1046552056 /nfs/dbraw/zinc/55/20/56/1046552056.db2.gz ILPGVOJYLKQSQQ-HUUCEWRRSA-N 1 2 322.518 4.142 20 0 DIADLO CCCCCC[C@@H](C)NC(=O)C[N@H+]1CCc2sccc2[C@H]1C ZINC000783010981 1046552066 /nfs/dbraw/zinc/55/20/66/1046552066.db2.gz ILPGVOJYLKQSQQ-HUUCEWRRSA-N 1 2 322.518 4.142 20 0 DIADLO Cc1cc(Br)cc(CNc2cc3cc[nH]c3c[nH+]2)c1 ZINC001202984817 1046555094 /nfs/dbraw/zinc/55/50/94/1046555094.db2.gz AIUMCZAGOXAYRF-UHFFFAOYSA-N 1 2 316.202 4.246 20 0 DIADLO COc1cccc2c(CNc3cc4cc[nH]c4c[nH+]3)cccc12 ZINC001202987307 1046555229 /nfs/dbraw/zinc/55/52/29/1046555229.db2.gz XJUDXCMDYVURSP-UHFFFAOYSA-N 1 2 303.365 4.337 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc2ccccc21)c1nc(C(C)(C)C)no1 ZINC000237343848 1046555262 /nfs/dbraw/zinc/55/52/62/1046555262.db2.gz ACDWTSKVVVSZTJ-CYBMUJFWSA-N 1 2 309.413 4.371 20 0 DIADLO CC(C)n1cc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)cn1 ZINC000678123166 1046558973 /nfs/dbraw/zinc/55/89/73/1046558973.db2.gz KRAYALFSEJISKS-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1cc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)cn1 ZINC000678123166 1046558988 /nfs/dbraw/zinc/55/89/88/1046558988.db2.gz KRAYALFSEJISKS-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO COc1c(Cl)cccc1C[NH2+][C@@H](C)c1nc(C)sc1C ZINC000897482837 1046560161 /nfs/dbraw/zinc/56/01/61/1046560161.db2.gz GJYAAMJOPYDHMS-VIFPVBQESA-N 1 2 310.850 4.273 20 0 DIADLO Cc1ccc(-c2csc(C[NH2+][C@H](C)c3nccnc3C)n2)cc1 ZINC000783225592 1046566735 /nfs/dbraw/zinc/56/67/35/1046566735.db2.gz WLCZEESGTDNWQB-CQSZACIVSA-N 1 2 324.453 4.068 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cc(-c3ccccc3)n[nH]2)C2CC2)o1 ZINC000678135894 1046567251 /nfs/dbraw/zinc/56/72/51/1046567251.db2.gz VMZYSENXCSGDAE-UHFFFAOYSA-N 1 2 307.397 4.143 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cc(-c3ccccc3)n[nH]2)C2CC2)o1 ZINC000678135894 1046567267 /nfs/dbraw/zinc/56/72/67/1046567267.db2.gz VMZYSENXCSGDAE-UHFFFAOYSA-N 1 2 307.397 4.143 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1[nH]nc2ccccc21 ZINC000678136385 1046567520 /nfs/dbraw/zinc/56/75/20/1046567520.db2.gz HCCFLIYCPWCSCO-NSHDSACASA-N 1 2 301.340 4.034 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1[nH]nc2ccccc21 ZINC000678136385 1046567530 /nfs/dbraw/zinc/56/75/30/1046567530.db2.gz HCCFLIYCPWCSCO-NSHDSACASA-N 1 2 301.340 4.034 20 0 DIADLO Cc1cccc(C)c1C[NH2+][C@@H](c1ncc[nH]1)c1ccc(F)cc1 ZINC000783252799 1046570413 /nfs/dbraw/zinc/57/04/13/1046570413.db2.gz CUKMYKCVKNNZHZ-GOSISDBHSA-N 1 2 309.388 4.045 20 0 DIADLO C[C@H]1CCCC[N@H+](Cc2cnc(Br)cc2Cl)C1 ZINC001140074803 1046581744 /nfs/dbraw/zinc/58/17/44/1046581744.db2.gz TZIGKWSUTHNJDE-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO C[C@H]1CCCC[N@@H+](Cc2cnc(Br)cc2Cl)C1 ZINC001140074803 1046581756 /nfs/dbraw/zinc/58/17/56/1046581756.db2.gz TZIGKWSUTHNJDE-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+]1CCOc2ccccc2[C@H]1C ZINC000678196810 1046584377 /nfs/dbraw/zinc/58/43/77/1046584377.db2.gz IKJMPJQFYCWUBA-OAHLLOKOSA-N 1 2 321.424 4.012 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+]1CCOc2ccccc2[C@H]1C ZINC000678196810 1046584387 /nfs/dbraw/zinc/58/43/87/1046584387.db2.gz IKJMPJQFYCWUBA-OAHLLOKOSA-N 1 2 321.424 4.012 20 0 DIADLO Cc1cccc(C[N@@H+]2CCCC[C@H]2c2noc(C3CC3)n2)c1C ZINC000678203236 1046585222 /nfs/dbraw/zinc/58/52/22/1046585222.db2.gz PLEMUSCTCIRSNU-KRWDZBQOSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1cccc(C[N@H+]2CCCC[C@H]2c2noc(C3CC3)n2)c1C ZINC000678203236 1046585233 /nfs/dbraw/zinc/58/52/33/1046585233.db2.gz PLEMUSCTCIRSNU-KRWDZBQOSA-N 1 2 311.429 4.291 20 0 DIADLO COc1ccc(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)c(OC)c1 ZINC000536637829 1046602108 /nfs/dbraw/zinc/60/21/08/1046602108.db2.gz RGYVLXCHCWMKGO-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)c(OC)c1 ZINC000536637829 1046602111 /nfs/dbraw/zinc/60/21/11/1046602111.db2.gz RGYVLXCHCWMKGO-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO Fc1cccn2cc(C[N@@H+]3CCCCC[C@@H]3c3ccco3)nc12 ZINC000678266385 1046603978 /nfs/dbraw/zinc/60/39/78/1046603978.db2.gz CQKRPOFCQQQDFO-MRXNPFEDSA-N 1 2 313.376 4.184 20 0 DIADLO Fc1cccn2cc(C[N@H+]3CCCCC[C@@H]3c3ccco3)nc12 ZINC000678266385 1046603987 /nfs/dbraw/zinc/60/39/87/1046603987.db2.gz CQKRPOFCQQQDFO-MRXNPFEDSA-N 1 2 313.376 4.184 20 0 DIADLO CCCCc1oc2ccccc2c1C[N@@H+]1CCc2c[nH]nc2C1 ZINC000678273571 1046607418 /nfs/dbraw/zinc/60/74/18/1046607418.db2.gz SRQCVWZQLHPGBR-UHFFFAOYSA-N 1 2 309.413 4.057 20 0 DIADLO CCCCc1oc2ccccc2c1C[N@H+]1CCc2c[nH]nc2C1 ZINC000678273571 1046607423 /nfs/dbraw/zinc/60/74/23/1046607423.db2.gz SRQCVWZQLHPGBR-UHFFFAOYSA-N 1 2 309.413 4.057 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3ccccc3s2)C[C@H](C(F)(F)F)O1 ZINC000678282367 1046610719 /nfs/dbraw/zinc/61/07/19/1046610719.db2.gz ZRCAQQUXWGJZHA-IINYFYTJSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3ccccc3s2)C[C@H](C(F)(F)F)O1 ZINC000678282367 1046610722 /nfs/dbraw/zinc/61/07/22/1046610722.db2.gz ZRCAQQUXWGJZHA-IINYFYTJSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cn3cccc(F)c3n2)[C@@H](c2ccco2)C1 ZINC000678285963 1046613452 /nfs/dbraw/zinc/61/34/52/1046613452.db2.gz QXESUJCTLADFEG-XJKSGUPXSA-N 1 2 313.376 4.040 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cn3cccc(F)c3n2)[C@@H](c2ccco2)C1 ZINC000678285963 1046613457 /nfs/dbraw/zinc/61/34/57/1046613457.db2.gz QXESUJCTLADFEG-XJKSGUPXSA-N 1 2 313.376 4.040 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@H](C(F)F)C2)ccc1Br ZINC001140213052 1046615013 /nfs/dbraw/zinc/61/50/13/1046615013.db2.gz OLGJTWYQTBFCOX-JTQLQIEISA-N 1 2 322.168 4.065 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@H](C(F)F)C2)ccc1Br ZINC001140213052 1046615018 /nfs/dbraw/zinc/61/50/18/1046615018.db2.gz OLGJTWYQTBFCOX-JTQLQIEISA-N 1 2 322.168 4.065 20 0 DIADLO CC(C)(C)c1ccc(C[N@@H+]2CCO[C@@H](c3ccco3)C2)s1 ZINC000678294264 1046616274 /nfs/dbraw/zinc/61/62/74/1046616274.db2.gz BWXCWYBMXNLHJW-OAHLLOKOSA-N 1 2 305.443 4.212 20 0 DIADLO CC(C)(C)c1ccc(C[N@H+]2CCO[C@@H](c3ccco3)C2)s1 ZINC000678294264 1046616285 /nfs/dbraw/zinc/61/62/85/1046616285.db2.gz BWXCWYBMXNLHJW-OAHLLOKOSA-N 1 2 305.443 4.212 20 0 DIADLO Cc1sc(/C=C/c2cc(-n3cc[nH+]c3)cs2)cc1C=O ZINC000783709573 1046624883 /nfs/dbraw/zinc/62/48/83/1046624883.db2.gz QCXXCSGNGWREGZ-NSCUHMNNSA-N 1 2 300.408 4.287 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@@H]2CCn3ccnc32)c2ccccc2)c(C)c1 ZINC000834548737 1046630017 /nfs/dbraw/zinc/63/00/17/1046630017.db2.gz QSRRVXHRIZGEJS-UXHICEINSA-N 1 2 317.436 4.324 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCn2ccnc21)c1cc2cc(Cl)ccc2o1 ZINC000834654630 1046646802 /nfs/dbraw/zinc/64/68/02/1046646802.db2.gz QHFKLNZIWLHYMI-MFKMUULPSA-N 1 2 301.777 4.078 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)o1 ZINC000245836715 1046658078 /nfs/dbraw/zinc/65/80/78/1046658078.db2.gz CSXABLUCWCKPEQ-KTJYFRGRSA-N 1 2 305.809 4.079 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2csc(C)n2)C(C)C)c(F)c1 ZINC000643344789 1046660372 /nfs/dbraw/zinc/66/03/72/1046660372.db2.gz RQKBQOQWWGLVMG-INIZCTEOSA-N 1 2 308.422 4.086 20 0 DIADLO C[C@@H]1CC[C@@H]([NH2+]Cc2nnc(-c3ccccc3)[nH]2)c2sccc21 ZINC000834741208 1046661222 /nfs/dbraw/zinc/66/12/22/1046661222.db2.gz KTGDCWVJKZOERK-IUODEOHRSA-N 1 2 324.453 4.261 20 0 DIADLO C[C@@H]1CC[C@@H]([NH2+]Cc2nc(-c3ccccc3)n[nH]2)c2sccc21 ZINC000834741208 1046661227 /nfs/dbraw/zinc/66/12/27/1046661227.db2.gz KTGDCWVJKZOERK-IUODEOHRSA-N 1 2 324.453 4.261 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H]2COc3c2cccc3Cl)c(C)s1 ZINC000678597279 1046670982 /nfs/dbraw/zinc/67/09/82/1046670982.db2.gz CMSKHXIWCUIECD-AMIZOPFISA-N 1 2 308.834 4.198 20 0 DIADLO CCC(CC)n1ccc(COc2ccccc2-n2cc[nH+]c2)n1 ZINC000533229198 1046676236 /nfs/dbraw/zinc/67/62/36/1046676236.db2.gz ZESUPSYOTQAYMQ-UHFFFAOYSA-N 1 2 310.401 4.009 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)CC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000533247294 1046677616 /nfs/dbraw/zinc/67/76/16/1046677616.db2.gz LFPPFPCECCJAAT-PGBRGIIUSA-N 1 2 301.430 4.058 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)CC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000533247294 1046677622 /nfs/dbraw/zinc/67/76/22/1046677622.db2.gz LFPPFPCECCJAAT-PGBRGIIUSA-N 1 2 301.430 4.058 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2c1cccc2Cl)c1cccc(F)c1F ZINC000678609983 1046678226 /nfs/dbraw/zinc/67/82/26/1046678226.db2.gz BMPYMWHJBOEZKX-XPTSAGLGSA-N 1 2 309.743 4.403 20 0 DIADLO Cc1cc(C[NH2+]Cc2nc(-c3ccccc3F)cs2)sn1 ZINC000643892239 1046688406 /nfs/dbraw/zinc/68/84/06/1046688406.db2.gz UUHMLHHETUZDKD-UHFFFAOYSA-N 1 2 319.430 4.004 20 0 DIADLO C[C@@H]([NH2+]Cc1noc2c1CCCC2)c1ccccc1OC(F)F ZINC000678737128 1046690716 /nfs/dbraw/zinc/69/07/16/1046690716.db2.gz KOSUYWPQNRPDKW-LLVKDONJSA-N 1 2 322.355 4.006 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@@H](C)c2nccn2C)c2ccccc2)cc1 ZINC000678763418 1046694527 /nfs/dbraw/zinc/69/45/27/1046694527.db2.gz FQARDPCHISAJOL-LPHOPBHVSA-N 1 2 305.425 4.169 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2ccc(Cl)cc2)o1)c1nccn1C ZINC000678765086 1046695585 /nfs/dbraw/zinc/69/55/85/1046695585.db2.gz XBWGUANYWQBFIA-GFCCVEGCSA-N 1 2 315.804 4.184 20 0 DIADLO c1ccc(-c2nc(C[NH2+][C@H](CC3CC3)c3ccccc3)no2)cc1 ZINC000678778349 1046700190 /nfs/dbraw/zinc/70/01/90/1046700190.db2.gz WRCZUZYCGOSFLE-GOSISDBHSA-N 1 2 319.408 4.368 20 0 DIADLO Fc1c[nH+]ccc1N1CCC(c2nc3ccccc3s2)CC1 ZINC000678789338 1046703617 /nfs/dbraw/zinc/70/36/17/1046703617.db2.gz YSNQJUFUFYHZBC-UHFFFAOYSA-N 1 2 313.401 4.214 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CCCOc3c(Cl)cc(C)cc32)co1 ZINC000834897715 1046706517 /nfs/dbraw/zinc/70/65/17/1046706517.db2.gz HNSLZHRXZPIDRQ-OAHLLOKOSA-N 1 2 320.820 4.202 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)co1 ZINC000834899371 1046708993 /nfs/dbraw/zinc/70/89/93/1046708993.db2.gz PILSANYDOYNPPN-JTQLQIEISA-N 1 2 304.777 4.487 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)co1 ZINC000834899377 1046710528 /nfs/dbraw/zinc/71/05/28/1046710528.db2.gz PILSANYDOYNPPN-SNVBAGLBSA-N 1 2 304.777 4.487 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)co1 ZINC000834900429 1046711207 /nfs/dbraw/zinc/71/12/07/1046711207.db2.gz OMPULJNEGDYGEG-ZDUSSCGKSA-N 1 2 311.212 4.321 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1[nH]nc2ccccc21 ZINC001137352268 1046711882 /nfs/dbraw/zinc/71/18/82/1046711882.db2.gz UYBIUEGDSWRVDY-IBGZPJMESA-N 1 2 321.424 4.046 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1[nH]nc2ccccc21 ZINC001137352268 1046711893 /nfs/dbraw/zinc/71/18/93/1046711893.db2.gz UYBIUEGDSWRVDY-IBGZPJMESA-N 1 2 321.424 4.046 20 0 DIADLO CCCCC[N@H+](Cc1nc(C)no1)Cc1ccc(Cl)cc1 ZINC000533392453 1046712994 /nfs/dbraw/zinc/71/29/94/1046712994.db2.gz MYAUBYBJGJIHIS-UHFFFAOYSA-N 1 2 307.825 4.224 20 0 DIADLO CCCCC[N@@H+](Cc1nc(C)no1)Cc1ccc(Cl)cc1 ZINC000533392453 1046713005 /nfs/dbraw/zinc/71/30/05/1046713005.db2.gz MYAUBYBJGJIHIS-UHFFFAOYSA-N 1 2 307.825 4.224 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2nc3c(s2)CCC3)s1 ZINC000678832961 1046714431 /nfs/dbraw/zinc/71/44/31/1046714431.db2.gz OTPXBMFIZRGAJY-NSHDSACASA-N 1 2 321.515 4.152 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2nc3c(s2)CCC3)s1 ZINC000678832961 1046714442 /nfs/dbraw/zinc/71/44/42/1046714442.db2.gz OTPXBMFIZRGAJY-NSHDSACASA-N 1 2 321.515 4.152 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)nc1 ZINC000678881826 1046726520 /nfs/dbraw/zinc/72/65/20/1046726520.db2.gz VPPKXIAWNNKUMA-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)nc1 ZINC000678881826 1046726534 /nfs/dbraw/zinc/72/65/34/1046726534.db2.gz VPPKXIAWNNKUMA-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2C[C@H]3[C@H](CC3(F)F)C2)c1Cl ZINC001137355049 1046729660 /nfs/dbraw/zinc/72/96/60/1046729660.db2.gz XTUDCYAAOJNMQE-APPZFPTMSA-N 1 2 310.146 4.220 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)c1Cl ZINC001137355049 1046729673 /nfs/dbraw/zinc/72/96/73/1046729673.db2.gz XTUDCYAAOJNMQE-APPZFPTMSA-N 1 2 310.146 4.220 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC[C@@H]3CCCO[C@H]3C2)c1Cl ZINC001137354808 1046730517 /nfs/dbraw/zinc/73/05/17/1046730517.db2.gz RPNXOJGEDCZNDI-HZMBPMFUSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC[C@@H]3CCCO[C@H]3C2)c1Cl ZINC001137354808 1046730528 /nfs/dbraw/zinc/73/05/28/1046730528.db2.gz RPNXOJGEDCZNDI-HZMBPMFUSA-N 1 2 318.219 4.133 20 0 DIADLO Cc1nc([C@@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)c(C)s1 ZINC000678904803 1046730915 /nfs/dbraw/zinc/73/09/15/1046730915.db2.gz KUANPACYAKITKJ-GFCCVEGCSA-N 1 2 316.474 4.318 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1csnn1)c1cccc(C(F)(F)F)c1 ZINC000678922404 1046733448 /nfs/dbraw/zinc/73/34/48/1046733448.db2.gz NUYUOXXXQTYCQA-CYBMUJFWSA-N 1 2 315.364 4.044 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCC[C@H]2c2cccc(C)n2)n1 ZINC000533483440 1046736001 /nfs/dbraw/zinc/73/60/01/1046736001.db2.gz LIVVZYPDUUXNAD-IBGZPJMESA-N 1 2 312.461 4.285 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCC[C@H]2c2cccc(C)n2)n1 ZINC000533483440 1046736017 /nfs/dbraw/zinc/73/60/17/1046736017.db2.gz LIVVZYPDUUXNAD-IBGZPJMESA-N 1 2 312.461 4.285 20 0 DIADLO COc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1 ZINC001140484595 1046744924 /nfs/dbraw/zinc/74/49/24/1046744924.db2.gz VSNWHIXSYPPPCE-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1 ZINC001140484595 1046744940 /nfs/dbraw/zinc/74/49/40/1046744940.db2.gz VSNWHIXSYPPPCE-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c1Cl ZINC001137358537 1046747304 /nfs/dbraw/zinc/74/73/04/1046747304.db2.gz RRYNBHLWVYBPEZ-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC[C@]3(CC3(F)F)C2)c1Cl ZINC001137358537 1046747318 /nfs/dbraw/zinc/74/73/18/1046747318.db2.gz RRYNBHLWVYBPEZ-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO CCO[C@H]1CCC[N@H+](Cc2c(Cl)ccc(F)c2Cl)C1 ZINC001137358647 1046747517 /nfs/dbraw/zinc/74/75/17/1046747517.db2.gz XETJFTCLGLIVFC-JTQLQIEISA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@H]1CCC[N@@H+](Cc2c(Cl)ccc(F)c2Cl)C1 ZINC001137358647 1046747532 /nfs/dbraw/zinc/74/75/32/1046747532.db2.gz XETJFTCLGLIVFC-JTQLQIEISA-N 1 2 306.208 4.133 20 0 DIADLO Cc1cc2nc(NCc3ccc(-n4cc[nH+]c4)cc3)oc2c(C)c1 ZINC000678994934 1046749075 /nfs/dbraw/zinc/74/90/75/1046749075.db2.gz VPZFVMPKMWVBPB-UHFFFAOYSA-N 1 2 318.380 4.242 20 0 DIADLO O=C(CCCC1CC1)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000644965115 1046751841 /nfs/dbraw/zinc/75/18/41/1046751841.db2.gz ZOAPAEAIOCUXKM-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2c(Cl)ccc(F)c2Cl)[C@H](C)C1 ZINC001137358772 1046755601 /nfs/dbraw/zinc/75/56/01/1046755601.db2.gz CULIOBYDGJZLJT-ZJUUUORDSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2c(Cl)ccc(F)c2Cl)[C@H](C)C1 ZINC001137358772 1046755613 /nfs/dbraw/zinc/75/56/13/1046755613.db2.gz CULIOBYDGJZLJT-ZJUUUORDSA-N 1 2 306.208 4.132 20 0 DIADLO FC(F)Sc1ccc(C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)cc1 ZINC000796196762 1046757673 /nfs/dbraw/zinc/75/76/73/1046757673.db2.gz WMIYEOPNGRVRHX-HNNXBMFYSA-N 1 2 323.412 4.452 20 0 DIADLO FC(F)Sc1ccc(C[N@H+]2CCCC[C@H]2c2cc[nH]n2)cc1 ZINC000796196762 1046757682 /nfs/dbraw/zinc/75/76/82/1046757682.db2.gz WMIYEOPNGRVRHX-HNNXBMFYSA-N 1 2 323.412 4.452 20 0 DIADLO CC(C)[C@@H]1CC[C@H]1[NH2+]c1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000796916815 1046759825 /nfs/dbraw/zinc/75/98/25/1046759825.db2.gz IGDSNQHDZRHJEN-VVWQDTPRSA-N 1 2 302.462 4.147 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)cc(F)cc2F)cc1 ZINC001140533027 1046768379 /nfs/dbraw/zinc/76/83/79/1046768379.db2.gz RHJLYWGDHZTAIT-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)cc(F)cc2F)cc1 ZINC001140533027 1046768391 /nfs/dbraw/zinc/76/83/91/1046768391.db2.gz RHJLYWGDHZTAIT-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)cc(F)cc2F)cc1 ZINC001140533026 1046768823 /nfs/dbraw/zinc/76/88/23/1046768823.db2.gz RHJLYWGDHZTAIT-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2c(F)cc(F)cc2F)cc1 ZINC001140533026 1046768841 /nfs/dbraw/zinc/76/88/41/1046768841.db2.gz RHJLYWGDHZTAIT-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC(C)(C)c2ccccc2)c(C)[nH+]1 ZINC000455477876 1046769291 /nfs/dbraw/zinc/76/92/91/1046769291.db2.gz MEBDDKKFSSXLFL-UHFFFAOYSA-N 1 2 311.429 4.106 20 0 DIADLO Cc1ccc(CC[C@H](C)NC(=O)Nc2c(C)cc(C)[nH+]c2C)o1 ZINC000455495851 1046771638 /nfs/dbraw/zinc/77/16/38/1046771638.db2.gz OKZUJEQTUBAULZ-LBPRGKRZSA-N 1 2 315.417 4.051 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@@H]2CCc3ccccc3C2)c(C)[nH+]1 ZINC000455485341 1046773450 /nfs/dbraw/zinc/77/34/50/1046773450.db2.gz RDEZQVWTXGOBMD-GOSISDBHSA-N 1 2 323.440 4.028 20 0 DIADLO Cc1nc([C@H]([NH2+][C@@H](C)CC2CCC2)c2ccc(Cl)cc2)no1 ZINC000679092401 1046774100 /nfs/dbraw/zinc/77/41/00/1046774100.db2.gz SIBCLNYFGRKWKV-MEDUHNTESA-N 1 2 319.836 4.289 20 0 DIADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@H+](C)Cc1cn2c(n1)CCCC2 ZINC000429535739 1046775334 /nfs/dbraw/zinc/77/53/34/1046775334.db2.gz IVLQRCDRHARKER-LBPRGKRZSA-N 1 2 321.827 4.205 20 0 DIADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+](C)Cc1cn2c(n1)CCCC2 ZINC000429535739 1046775345 /nfs/dbraw/zinc/77/53/45/1046775345.db2.gz IVLQRCDRHARKER-LBPRGKRZSA-N 1 2 321.827 4.205 20 0 DIADLO CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455492813 1046775931 /nfs/dbraw/zinc/77/59/31/1046775931.db2.gz LLPUCMYMPWRZJY-LRDDRELGSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1ccc(CNc2[nH+]c3ccccc3n2C2CCCC2)nc1 ZINC000679117656 1046776019 /nfs/dbraw/zinc/77/60/19/1046776019.db2.gz MPNFLCQYTWVXPS-UHFFFAOYSA-N 1 2 306.413 4.467 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC=C(C(C)(C)C)CC2)c(C)[nH+]1 ZINC000455502244 1046776498 /nfs/dbraw/zinc/77/64/98/1046776498.db2.gz UYSLEIMJIGDQFI-UHFFFAOYSA-N 1 2 301.434 4.217 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)c(C)[nH+]1 ZINC000455504373 1046777220 /nfs/dbraw/zinc/77/72/20/1046777220.db2.gz WNMGFMNFBSIYAI-SJCJKPOMSA-N 1 2 324.428 4.017 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C)[C@H](C)c2ccccc2)c(C)[nH+]1 ZINC000455500066 1046777592 /nfs/dbraw/zinc/77/75/92/1046777592.db2.gz SRSOHEQROYJMOI-GJZGRUSLSA-N 1 2 311.429 4.321 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC(C)(C)[C@@H]3CCC[C@H]32)c(C)[nH+]1 ZINC000455513580 1046779867 /nfs/dbraw/zinc/77/98/67/1046779867.db2.gz JCHFVQHHYCVOPR-HUUCEWRRSA-N 1 2 301.434 4.049 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@H](CC(C)(C)C)C2)c(C)[nH+]1 ZINC000455524474 1046780300 /nfs/dbraw/zinc/78/03/00/1046780300.db2.gz OKGJQYULPOBOOP-OAHLLOKOSA-N 1 2 303.450 4.297 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC3(CCCC3)[C@H]2C(C)C)c(C)[nH+]1 ZINC000455514439 1046780493 /nfs/dbraw/zinc/78/04/93/1046780493.db2.gz JTNWAZWPLBIJRW-QGZVFWFLSA-N 1 2 315.461 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC3(CCC3)[C@H]2C(C)C)c(C)[nH+]1 ZINC000455526485 1046781268 /nfs/dbraw/zinc/78/12/68/1046781268.db2.gz PQNJMJWNVBWWEH-MRXNPFEDSA-N 1 2 301.434 4.049 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cccc(F)c1Cl)CC2 ZINC001140560088 1046782993 /nfs/dbraw/zinc/78/29/93/1046782993.db2.gz KNTLWFNTTNUHNH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cccc(F)c1Cl)CC2 ZINC001140560088 1046783005 /nfs/dbraw/zinc/78/30/05/1046783005.db2.gz KNTLWFNTTNUHNH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Cc1ncc([C@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)s1 ZINC000679152437 1046787556 /nfs/dbraw/zinc/78/75/56/1046787556.db2.gz BCPICFOVQFUIIS-LBPRGKRZSA-N 1 2 302.447 4.010 20 0 DIADLO Cc1ncc([C@@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)s1 ZINC000679152435 1046788092 /nfs/dbraw/zinc/78/80/92/1046788092.db2.gz BCPICFOVQFUIIS-GFCCVEGCSA-N 1 2 302.447 4.010 20 0 DIADLO C[C@@H]1CC2(CN1c1cc[nH+]c3c(Cl)cccc13)CCOCC2 ZINC000645383939 1046788079 /nfs/dbraw/zinc/78/80/79/1046788079.db2.gz AIJCMQKSBJDLSV-CYBMUJFWSA-N 1 2 316.832 4.284 20 0 DIADLO CN(Cc1cn2c([nH+]1)CCCC2)Cc1ccc(Cl)cc1Cl ZINC000429543164 1046790024 /nfs/dbraw/zinc/79/00/24/1046790024.db2.gz SQVVCACCZMUMRH-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@H+](C)[C@@H](C)c1ccco1 ZINC000069069275 1046791523 /nfs/dbraw/zinc/79/15/23/1046791523.db2.gz NXGCYHJFSCJAPY-HNNXBMFYSA-N 1 2 314.429 4.343 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000069069275 1046791534 /nfs/dbraw/zinc/79/15/34/1046791534.db2.gz NXGCYHJFSCJAPY-HNNXBMFYSA-N 1 2 314.429 4.343 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccccc2C(C)C)o1 ZINC000070785911 1046793822 /nfs/dbraw/zinc/79/38/22/1046793822.db2.gz WRVPULHQBLYBAF-OAHLLOKOSA-N 1 2 314.429 4.170 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccccc2C(C)C)o1 ZINC000070785911 1046793830 /nfs/dbraw/zinc/79/38/30/1046793830.db2.gz WRVPULHQBLYBAF-OAHLLOKOSA-N 1 2 314.429 4.170 20 0 DIADLO C[N@H+](Cc1nccn1C(F)F)Cc1cccc2ccccc21 ZINC000071951969 1046796203 /nfs/dbraw/zinc/79/62/03/1046796203.db2.gz KERAXWIRTRMKOK-UHFFFAOYSA-N 1 2 301.340 4.063 20 0 DIADLO C[N@@H+](Cc1nccn1C(F)F)Cc1cccc2ccccc21 ZINC000071951969 1046796219 /nfs/dbraw/zinc/79/62/19/1046796219.db2.gz KERAXWIRTRMKOK-UHFFFAOYSA-N 1 2 301.340 4.063 20 0 DIADLO Cc1ccc(F)cc1C[N@H+](Cc1cccnc1)Cc1ccccn1 ZINC001140592775 1046800150 /nfs/dbraw/zinc/80/01/50/1046800150.db2.gz CBSMGCSVSMPLMO-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ccc(F)cc1C[N@@H+](Cc1cccnc1)Cc1ccccn1 ZINC001140592775 1046800161 /nfs/dbraw/zinc/80/01/61/1046800161.db2.gz CBSMGCSVSMPLMO-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Clc1cnc(C[N@@H+](Cc2ccccc2Cl)CC2CC2)cn1 ZINC000796260143 1046806559 /nfs/dbraw/zinc/80/65/59/1046806559.db2.gz JVEJVLCWWRBKLN-UHFFFAOYSA-N 1 2 322.239 4.196 20 0 DIADLO Clc1cnc(C[N@H+](Cc2ccccc2Cl)CC2CC2)cn1 ZINC000796260143 1046806571 /nfs/dbraw/zinc/80/65/71/1046806571.db2.gz JVEJVLCWWRBKLN-UHFFFAOYSA-N 1 2 322.239 4.196 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)ncc2F)cc1 ZINC001140607537 1046810116 /nfs/dbraw/zinc/81/01/16/1046810116.db2.gz NIZVSXZNGFMXOQ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(Cl)ncc2F)cc1 ZINC001140607537 1046810134 /nfs/dbraw/zinc/81/01/34/1046810134.db2.gz NIZVSXZNGFMXOQ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)c1cccc(C(C)C)c1NC(=O)C[N@H+]1CC=CCC1 ZINC000679322203 1046810104 /nfs/dbraw/zinc/81/01/04/1046810104.db2.gz VMYMTLCEHXGTPN-UHFFFAOYSA-N 1 2 300.446 4.134 20 0 DIADLO CC(C)c1cccc(C(C)C)c1NC(=O)C[N@@H+]1CC=CCC1 ZINC000679322203 1046810128 /nfs/dbraw/zinc/81/01/28/1046810128.db2.gz VMYMTLCEHXGTPN-UHFFFAOYSA-N 1 2 300.446 4.134 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@H](C)COc1ccc(C(C)(C)C)cc1 ZINC000679333934 1046814059 /nfs/dbraw/zinc/81/40/59/1046814059.db2.gz WZYOZJSWEBXSEB-ZIAGYGMSSA-N 1 2 315.461 4.134 20 0 DIADLO COC(=O)c1cccc2c1C[N@H+](Cc1csc3ccccc13)C2 ZINC001140637917 1046823672 /nfs/dbraw/zinc/82/36/72/1046823672.db2.gz ALBNOUDGGJJDOI-UHFFFAOYSA-N 1 2 323.417 4.204 20 0 DIADLO COC(=O)c1cccc2c1C[N@@H+](Cc1csc3ccccc13)C2 ZINC001140637917 1046823685 /nfs/dbraw/zinc/82/36/85/1046823685.db2.gz ALBNOUDGGJJDOI-UHFFFAOYSA-N 1 2 323.417 4.204 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2coc(-c3cccs3)n2)c1 ZINC000247907393 1046834552 /nfs/dbraw/zinc/83/45/52/1046834552.db2.gz SYDOYZJPERNQOF-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2coc(-c3cccs3)n2)c1 ZINC000247907393 1046834575 /nfs/dbraw/zinc/83/45/75/1046834575.db2.gz SYDOYZJPERNQOF-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO Cc1ccc(-c2noc(C[NH2+]C3(c4ccccc4C)CC3)n2)cc1 ZINC000645978889 1046836502 /nfs/dbraw/zinc/83/65/02/1046836502.db2.gz DLZDJIBYDSLCIM-UHFFFAOYSA-N 1 2 319.408 4.132 20 0 DIADLO Cc1nc2ccccc2nc1C[NH2+]C1(c2ccccc2Cl)CC1 ZINC000645976174 1046837280 /nfs/dbraw/zinc/83/72/80/1046837280.db2.gz DCOUVRXSWNCKHY-UHFFFAOYSA-N 1 2 323.827 4.371 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2ccn(C3CCCC3)n2)CCC1 ZINC000646025771 1046849286 /nfs/dbraw/zinc/84/92/86/1046849286.db2.gz GRKJOMYJYDXWNH-UHFFFAOYSA-N 1 2 313.420 4.306 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccnc(Cl)c1 ZINC000797586295 1046855218 /nfs/dbraw/zinc/85/52/18/1046855218.db2.gz YKRIUFBZPRCRDO-ZETCQYMHSA-N 1 2 318.701 4.142 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccnc(Cl)c1 ZINC000797586294 1046855650 /nfs/dbraw/zinc/85/56/50/1046855650.db2.gz YKRIUFBZPRCRDO-SSDOTTSWSA-N 1 2 318.701 4.142 20 0 DIADLO CC(C)c1noc([C@H](C)[N@@H+]2CC[C@@H](c3c(F)cccc3F)C2)n1 ZINC000248906192 1046856216 /nfs/dbraw/zinc/85/62/16/1046856216.db2.gz BEZPENYCPQIDCP-NWDGAFQWSA-N 1 2 321.371 4.022 20 0 DIADLO CC(C)c1noc([C@H](C)[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)n1 ZINC000248906192 1046856233 /nfs/dbraw/zinc/85/62/33/1046856233.db2.gz BEZPENYCPQIDCP-NWDGAFQWSA-N 1 2 321.371 4.022 20 0 DIADLO FC(F)Oc1cccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212061040 1046858352 /nfs/dbraw/zinc/85/83/52/1046858352.db2.gz QPNYPRYIPDFZMH-UHFFFAOYSA-N 1 2 315.323 4.276 20 0 DIADLO CCc1noc([C@H](C)[N@@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)n1 ZINC000646117414 1046860526 /nfs/dbraw/zinc/86/05/26/1046860526.db2.gz ZDPSRRGYWTVJMJ-WMLDXEAASA-N 1 2 309.413 4.086 20 0 DIADLO CCc1noc([C@H](C)[N@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)n1 ZINC000646117414 1046860544 /nfs/dbraw/zinc/86/05/44/1046860544.db2.gz ZDPSRRGYWTVJMJ-WMLDXEAASA-N 1 2 309.413 4.086 20 0 DIADLO Cc1cc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)cc(Cl)n1 ZINC000797589517 1046861377 /nfs/dbraw/zinc/86/13/77/1046861377.db2.gz VXENFHKMKQVFCT-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(C[N@H+]2CCSC[C@@H]2c2ccccc2)cc(Cl)n1 ZINC000797589517 1046861397 /nfs/dbraw/zinc/86/13/97/1046861397.db2.gz VXENFHKMKQVFCT-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3cc(F)ccc3[C@H]2C)cc(Cl)n1 ZINC000797592440 1046862600 /nfs/dbraw/zinc/86/26/00/1046862600.db2.gz YGYWHXKKINNOEQ-GFCCVEGCSA-N 1 2 304.796 4.302 20 0 DIADLO Cc1cc(C[N@H+]2CCc3cc(F)ccc3[C@H]2C)cc(Cl)n1 ZINC000797592440 1046862615 /nfs/dbraw/zinc/86/26/15/1046862615.db2.gz YGYWHXKKINNOEQ-GFCCVEGCSA-N 1 2 304.796 4.302 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[N@@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646116849 1046862682 /nfs/dbraw/zinc/86/26/82/1046862682.db2.gz HJERXXJRSBAQJM-PBHICJAKSA-N 1 2 321.424 4.401 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[N@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646116849 1046862702 /nfs/dbraw/zinc/86/27/02/1046862702.db2.gz HJERXXJRSBAQJM-PBHICJAKSA-N 1 2 321.424 4.401 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)n1 ZINC000679546509 1046866629 /nfs/dbraw/zinc/86/66/29/1046866629.db2.gz PMJYSFWGMJACRD-STQMWFEESA-N 1 2 317.399 4.407 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)n1 ZINC000679546509 1046866649 /nfs/dbraw/zinc/86/66/49/1046866649.db2.gz PMJYSFWGMJACRD-STQMWFEESA-N 1 2 317.399 4.407 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)n1 ZINC000679546394 1046867677 /nfs/dbraw/zinc/86/76/77/1046867677.db2.gz PMJYSFWGMJACRD-OLZOCXBDSA-N 1 2 317.399 4.407 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)n1 ZINC000679546394 1046867691 /nfs/dbraw/zinc/86/76/91/1046867691.db2.gz PMJYSFWGMJACRD-OLZOCXBDSA-N 1 2 317.399 4.407 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cccc(O)c1Cl ZINC000646156441 1046869205 /nfs/dbraw/zinc/86/92/05/1046869205.db2.gz UQLYVOSSLURSIU-KOLCDFICSA-N 1 2 307.743 4.208 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cccc(O)c1Cl ZINC000646156441 1046869225 /nfs/dbraw/zinc/86/92/25/1046869225.db2.gz UQLYVOSSLURSIU-KOLCDFICSA-N 1 2 307.743 4.208 20 0 DIADLO FC1(F)CC2(C[NH+](Cc3c(Cl)ncc4ccccc43)C2)C1 ZINC001140719893 1046872961 /nfs/dbraw/zinc/87/29/61/1046872961.db2.gz JPHIKUISTJFLHS-UHFFFAOYSA-N 1 2 308.759 4.119 20 0 DIADLO Cc1ccc(Br)c(C[N@@H+](C)Cc2ccc(C)nc2)c1 ZINC001137386009 1046892721 /nfs/dbraw/zinc/89/27/21/1046892721.db2.gz LZPCKASWUURSLG-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(Br)c(C[N@H+](C)Cc2ccc(C)nc2)c1 ZINC001137386009 1046892709 /nfs/dbraw/zinc/89/27/09/1046892709.db2.gz LZPCKASWUURSLG-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](Cc1cccnc1)Cc1ccccn1 ZINC001140780024 1046893285 /nfs/dbraw/zinc/89/32/85/1046893285.db2.gz KBEGCVYCSNVNML-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](Cc1cccnc1)Cc1ccccn1 ZINC001140780024 1046893296 /nfs/dbraw/zinc/89/32/96/1046893296.db2.gz KBEGCVYCSNVNML-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC3(CC=CC3)[C@H]2C(C)C)c(C)[nH+]1 ZINC000646408293 1046897292 /nfs/dbraw/zinc/89/72/92/1046897292.db2.gz IKNSLOBHCLVWBS-QGZVFWFLSA-N 1 2 313.445 4.215 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@@H]3CCCc4ccccc43)cc2[nH+]1 ZINC001137392709 1046911399 /nfs/dbraw/zinc/91/13/99/1046911399.db2.gz HBAVPKGQVZGLOI-HNNXBMFYSA-N 1 2 319.408 4.320 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+]Cc1ncc(-c2ccc(F)cc2)o1 ZINC000679939073 1046912814 /nfs/dbraw/zinc/91/28/14/1046912814.db2.gz BHRDXPSEESTATK-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO CCc1noc(C[N@@H+]2CCCCC[C@@H]2/C=C\c2cccs2)n1 ZINC000679952471 1046914972 /nfs/dbraw/zinc/91/49/72/1046914972.db2.gz KJTZZTOJFRRPJB-CFYYFVFUSA-N 1 2 317.458 4.152 20 0 DIADLO CCc1noc(C[N@H+]2CCCCC[C@@H]2/C=C\c2cccs2)n1 ZINC000679952471 1046914985 /nfs/dbraw/zinc/91/49/85/1046914985.db2.gz KJTZZTOJFRRPJB-CFYYFVFUSA-N 1 2 317.458 4.152 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+][C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000679943120 1046915149 /nfs/dbraw/zinc/91/51/49/1046915149.db2.gz BWJRFQLPUMNGDN-GJZGRUSLSA-N 1 2 307.397 4.457 20 0 DIADLO Cc1ccccc1-c1cnc(C[NH2+][C@H](C)c2cnccc2C)o1 ZINC000679940242 1046916912 /nfs/dbraw/zinc/91/69/12/1046916912.db2.gz MLJIMPOANAOAHP-OAHLLOKOSA-N 1 2 307.397 4.204 20 0 DIADLO C[C@H](Cc1ccsc1)[N@@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000679983982 1046920764 /nfs/dbraw/zinc/92/07/64/1046920764.db2.gz HPVWOUGBFOCOSE-IUODEOHRSA-N 1 2 317.458 4.167 20 0 DIADLO C[C@H](Cc1ccsc1)[N@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000679983982 1046920770 /nfs/dbraw/zinc/92/07/70/1046920770.db2.gz HPVWOUGBFOCOSE-IUODEOHRSA-N 1 2 317.458 4.167 20 0 DIADLO Clc1cc(Nc2cc(Cl)c3[nH+]ccn3c2)cc(Cl)n1 ZINC001212092305 1046932565 /nfs/dbraw/zinc/93/25/65/1046932565.db2.gz SMVGHAZAUUZADX-UHFFFAOYSA-N 1 2 313.575 4.433 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1ccc(Cl)cc1 ZINC000680042110 1046937722 /nfs/dbraw/zinc/93/77/22/1046937722.db2.gz YLCWXOUDFOZDJZ-YMTOWFKASA-N 1 2 309.743 4.403 20 0 DIADLO CCc1nnc(C[N@H+](C)Cc2ccccc2-c2ccccc2)s1 ZINC000680051264 1046941507 /nfs/dbraw/zinc/94/15/07/1046941507.db2.gz MGUMCPQEGKJWRP-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO CCc1nnc(C[N@@H+](C)Cc2ccccc2-c2ccccc2)s1 ZINC000680051264 1046941518 /nfs/dbraw/zinc/94/15/18/1046941518.db2.gz MGUMCPQEGKJWRP-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO C/C(=C/C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2)C1CC1 ZINC000798267464 1046941924 /nfs/dbraw/zinc/94/19/24/1046941924.db2.gz HKSUWEBAYKSFSK-OWBHPGMISA-N 1 2 321.424 4.181 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c(F)c1F ZINC001140889687 1046942719 /nfs/dbraw/zinc/94/27/19/1046942719.db2.gz JPGYOXJJDPCFRI-AWEZNQCLSA-N 1 2 307.315 4.147 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(O)c(F)c2F)cc1 ZINC001140893077 1046943415 /nfs/dbraw/zinc/94/34/15/1046943415.db2.gz FFFRMWHTXZQASG-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c(F)c1F ZINC001140892453 1046943631 /nfs/dbraw/zinc/94/36/31/1046943631.db2.gz NWJCNRHNKINSKO-CQSZACIVSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)c(F)c1F ZINC001140893170 1046943666 /nfs/dbraw/zinc/94/36/66/1046943666.db2.gz JTWBRLWTIFPOOT-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1)Cc1ccc(O)c(F)c1F ZINC001140893624 1046944430 /nfs/dbraw/zinc/94/44/30/1046944430.db2.gz VXSPLXXASHMAJW-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(O)c(F)c2F)c1 ZINC001140893705 1046944481 /nfs/dbraw/zinc/94/44/81/1046944481.db2.gz ZICMJYGSHGZGDP-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1cc(C[NH+]2CCC(c3ccc4ccccc4c3)CC2)n[nH]1 ZINC001203077444 1046948136 /nfs/dbraw/zinc/94/81/36/1046948136.db2.gz YKUWQYMKBGARRB-UHFFFAOYSA-N 1 2 305.425 4.251 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1cnc(N)s1 ZINC000261732873 1046949019 /nfs/dbraw/zinc/94/90/19/1046949019.db2.gz HIRZHVPJUHOYKI-QMMMGPOBSA-N 1 2 316.257 4.225 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1cnc(N)s1 ZINC000261732873 1046949026 /nfs/dbraw/zinc/94/90/26/1046949026.db2.gz HIRZHVPJUHOYKI-QMMMGPOBSA-N 1 2 316.257 4.225 20 0 DIADLO FC(F)(F)c1ccncc1C[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001140917835 1046949165 /nfs/dbraw/zinc/94/91/65/1046949165.db2.gz HXSMUALAFSJFTD-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1ccncc1C[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001140917835 1046949170 /nfs/dbraw/zinc/94/91/70/1046949170.db2.gz HXSMUALAFSJFTD-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cnccc1C(F)(F)F ZINC001140920423 1046951064 /nfs/dbraw/zinc/95/10/64/1046951064.db2.gz UZMRWYXVOSCERG-GFCCVEGCSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cnccc1C(F)(F)F ZINC001140920423 1046951067 /nfs/dbraw/zinc/95/10/67/1046951067.db2.gz UZMRWYXVOSCERG-GFCCVEGCSA-N 1 2 306.331 4.047 20 0 DIADLO CC(C)c1cc(N2CC[C@@H](c3ccccn3)C2)nc(C(C)C)[nH+]1 ZINC000798417097 1046953398 /nfs/dbraw/zinc/95/33/98/1046953398.db2.gz RHGSTMZQASNCIZ-OAHLLOKOSA-N 1 2 310.445 4.112 20 0 DIADLO Cc1c(C(=O)Nc2cc(N(C)C)cc[nH+]2)oc2c1c(C)ccc2C ZINC000680258237 1046960641 /nfs/dbraw/zinc/96/06/41/1046960641.db2.gz ZOJRRNZKJJCVCM-UHFFFAOYSA-N 1 2 323.396 4.071 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(Cl)c1Cl)c1cc2n(n1)CCCC2 ZINC000647286413 1046967763 /nfs/dbraw/zinc/96/77/63/1046967763.db2.gz VDBBCUNXAQTZAG-LLVKDONJSA-N 1 2 324.255 4.377 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1cc2n(n1)CCCC2)c1cc(F)ccc1F ZINC000647293322 1046969292 /nfs/dbraw/zinc/96/92/92/1046969292.db2.gz AFWYCAYRTQCRDG-SJKOYZFVSA-N 1 2 319.399 4.300 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1cc2n(n1)CCCC2)c1cc(F)ccc1F ZINC000647293320 1046970149 /nfs/dbraw/zinc/97/01/49/1046970149.db2.gz AFWYCAYRTQCRDG-PXAZEXFGSA-N 1 2 319.399 4.300 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1cc(F)cc(F)c1 ZINC000680355252 1046971615 /nfs/dbraw/zinc/97/16/15/1046971615.db2.gz NWSAMVATGFCMAY-RTHLEPHNSA-N 1 2 311.278 4.027 20 0 DIADLO CC1(C)Cc2occc2[C@H]([NH2+][C@@H]2COc3cc(F)cc(F)c32)C1 ZINC000680355379 1046973928 /nfs/dbraw/zinc/97/39/28/1046973928.db2.gz OPLJPSHIVSCINS-ZIAGYGMSSA-N 1 2 319.351 4.295 20 0 DIADLO Clc1cc(Cl)cc(C2=CC[N@H+](Cc3ncco3)CC2)c1 ZINC001141004783 1046977297 /nfs/dbraw/zinc/97/72/97/1046977297.db2.gz MRIFNGKNLRIMIU-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Clc1cc(Cl)cc(C2=CC[N@@H+](Cc3ncco3)CC2)c1 ZINC001141004783 1046977303 /nfs/dbraw/zinc/97/73/03/1046977303.db2.gz MRIFNGKNLRIMIU-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Cc1cc([NH2+][C@@H]2CCC[C@@H]([C@H]3CCOC3)C2)ccc1N(C)C ZINC000798931703 1046987438 /nfs/dbraw/zinc/98/74/38/1046987438.db2.gz DFNQNOIUQBUUDR-IXDOHACOSA-N 1 2 302.462 4.068 20 0 DIADLO Cc1cc(N[C@@H]2CCC[C@@H]([C@H]3CCOC3)C2)ccc1[NH+](C)C ZINC000798931703 1046987440 /nfs/dbraw/zinc/98/74/40/1046987440.db2.gz DFNQNOIUQBUUDR-IXDOHACOSA-N 1 2 302.462 4.068 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000798930859 1046988938 /nfs/dbraw/zinc/98/89/38/1046988938.db2.gz BHQBIEKKDMAPMO-ZHALLVOQSA-N 1 2 314.473 4.294 20 0 DIADLO c1cc(N2CCCC2)ccc1[NH2+][C@@H]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000798930859 1046988947 /nfs/dbraw/zinc/98/89/47/1046988947.db2.gz BHQBIEKKDMAPMO-ZHALLVOQSA-N 1 2 314.473 4.294 20 0 DIADLO Cc1cc(C[N@@H+]2CCSC[C@H]2c2cccc(Cl)c2)ccn1 ZINC001137415096 1046989758 /nfs/dbraw/zinc/98/97/58/1046989758.db2.gz DVFGHFUFTUPFFD-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(C[N@H+]2CCSC[C@H]2c2cccc(Cl)c2)ccn1 ZINC001137415096 1046989760 /nfs/dbraw/zinc/98/97/60/1046989760.db2.gz DVFGHFUFTUPFFD-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1sc(C)nc1C(F)(F)F ZINC000680580592 1046992976 /nfs/dbraw/zinc/99/29/76/1046992976.db2.gz ILMSRHUVDOQZMU-UHFFFAOYSA-N 1 2 304.337 4.085 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1sc(C)nc1C(F)(F)F ZINC000680580592 1046992979 /nfs/dbraw/zinc/99/29/79/1046992979.db2.gz ILMSRHUVDOQZMU-UHFFFAOYSA-N 1 2 304.337 4.085 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124915 1047002081 /nfs/dbraw/zinc/00/20/81/1047002081.db2.gz BFNFYSMMBXTYEU-RISCZKNCSA-N 1 2 305.809 4.005 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124915 1047002091 /nfs/dbraw/zinc/00/20/91/1047002091.db2.gz BFNFYSMMBXTYEU-RISCZKNCSA-N 1 2 305.809 4.005 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@H+](Cc3cnc(Cl)cn3)CC2)c1 ZINC000799149893 1047003776 /nfs/dbraw/zinc/00/37/76/1047003776.db2.gz KHWXFPPEGSBRBR-UHFFFAOYSA-N 1 2 313.832 4.036 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@@H+](Cc3cnc(Cl)cn3)CC2)c1 ZINC000799149893 1047003792 /nfs/dbraw/zinc/00/37/92/1047003792.db2.gz KHWXFPPEGSBRBR-UHFFFAOYSA-N 1 2 313.832 4.036 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(Cl)cn1)c1cc(Cl)ccc1Cl ZINC000799153469 1047005848 /nfs/dbraw/zinc/00/58/48/1047005848.db2.gz HECZFTUGLHSFLL-QMMMGPOBSA-N 1 2 316.619 4.288 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1cccc(C)c1Br ZINC001141091980 1047006718 /nfs/dbraw/zinc/00/67/18/1047006718.db2.gz BLORYPOPVZATJR-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1cccc(C)c1Br ZINC001141091980 1047006726 /nfs/dbraw/zinc/00/67/26/1047006726.db2.gz BLORYPOPVZATJR-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC(C)[N@H+](CCC(=O)c1ccc2ccccc2c1)Cc1cocn1 ZINC001141132745 1047022192 /nfs/dbraw/zinc/02/21/92/1047022192.db2.gz QQHQMQPSDGEWCB-UHFFFAOYSA-N 1 2 322.408 4.311 20 0 DIADLO CC(C)[N@@H+](CCC(=O)c1ccc2ccccc2c1)Cc1cocn1 ZINC001141132745 1047022205 /nfs/dbraw/zinc/02/22/05/1047022205.db2.gz QQHQMQPSDGEWCB-UHFFFAOYSA-N 1 2 322.408 4.311 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1ncc(Cl)nc1Cl ZINC001141134277 1047022840 /nfs/dbraw/zinc/02/28/40/1047022840.db2.gz WQFOCSHSIIYNDQ-CQSZACIVSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1ncc(Cl)nc1Cl ZINC001141134277 1047022845 /nfs/dbraw/zinc/02/28/45/1047022845.db2.gz WQFOCSHSIIYNDQ-CQSZACIVSA-N 1 2 322.239 4.429 20 0 DIADLO CC[C@H](c1ccccc1)[N@H+](C)Cc1ncc(Cl)nc1Cl ZINC001141138268 1047025559 /nfs/dbraw/zinc/02/55/59/1047025559.db2.gz HMEPYGPNCAPMPY-CYBMUJFWSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@H](c1ccccc1)[N@@H+](C)Cc1ncc(Cl)nc1Cl ZINC001141138268 1047025570 /nfs/dbraw/zinc/02/55/70/1047025570.db2.gz HMEPYGPNCAPMPY-CYBMUJFWSA-N 1 2 310.228 4.367 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)co1 ZINC000647956555 1047025806 /nfs/dbraw/zinc/02/58/06/1047025806.db2.gz ZASZXIXRLGQWJT-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)co1 ZINC000647956555 1047025818 /nfs/dbraw/zinc/02/58/18/1047025818.db2.gz ZASZXIXRLGQWJT-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCCC[C@H]2C2CCC2)s1 ZINC000648078059 1047035543 /nfs/dbraw/zinc/03/55/43/1047035543.db2.gz YTNHZVJFMPVGCZ-NSHDSACASA-N 1 2 304.381 4.317 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCCC[C@H]2C2CCC2)s1 ZINC000648078059 1047035555 /nfs/dbraw/zinc/03/55/55/1047035555.db2.gz YTNHZVJFMPVGCZ-NSHDSACASA-N 1 2 304.381 4.317 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cc3cc(Cl)cnc3o2)s1 ZINC000648379934 1047050496 /nfs/dbraw/zinc/05/04/96/1047050496.db2.gz SEWLAGASWDLTPA-UHFFFAOYSA-N 1 2 321.833 4.132 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cc3cc(Cl)cnc3o2)s1 ZINC000648379934 1047050508 /nfs/dbraw/zinc/05/05/08/1047050508.db2.gz SEWLAGASWDLTPA-UHFFFAOYSA-N 1 2 321.833 4.132 20 0 DIADLO C[N@@H+](Cc1ccon1)Cc1ccc(-c2ccccc2F)s1 ZINC000536660702 1047053401 /nfs/dbraw/zinc/05/34/01/1047053401.db2.gz NLOKRGOQAZPKLK-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@H+](Cc1ccon1)Cc1ccc(-c2ccccc2F)s1 ZINC000536660702 1047053412 /nfs/dbraw/zinc/05/34/12/1047053412.db2.gz NLOKRGOQAZPKLK-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001141231407 1047056302 /nfs/dbraw/zinc/05/63/02/1047056302.db2.gz NPRCJESUZHCHSB-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001141231407 1047056316 /nfs/dbraw/zinc/05/63/16/1047056316.db2.gz NPRCJESUZHCHSB-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO CN(Cc1cccc(-n2cc[nH+]c2)c1)[C@@H](C1CCC1)C(F)(F)F ZINC001141243912 1047062760 /nfs/dbraw/zinc/06/27/60/1047062760.db2.gz CGIUPJJFKQAFSV-INIZCTEOSA-N 1 2 323.362 4.035 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1cccc(-n3ccnc3)c1)C2 ZINC001141244798 1047064909 /nfs/dbraw/zinc/06/49/09/1047064909.db2.gz VKBNBOJEUQIELD-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1cccc(-n3ccnc3)c1)C2 ZINC001141244798 1047064925 /nfs/dbraw/zinc/06/49/25/1047064925.db2.gz VKBNBOJEUQIELD-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO Cc1cc2c(c(C)c1)/C(=C/c1cc(-n3cc[nH+]c3)cs1)C(=O)N2 ZINC000799897302 1047071450 /nfs/dbraw/zinc/07/14/50/1047071450.db2.gz NTTQOHWMMRGUSK-NVNXTCNLSA-N 1 2 321.405 4.043 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)o1 ZINC000536698026 1047076158 /nfs/dbraw/zinc/07/61/58/1047076158.db2.gz MONQHZVVDROILG-ZHCAMHROSA-N 1 2 317.454 4.427 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)o1 ZINC000536698026 1047076166 /nfs/dbraw/zinc/07/61/66/1047076166.db2.gz MONQHZVVDROILG-ZHCAMHROSA-N 1 2 317.454 4.427 20 0 DIADLO Clc1cc(C[NH2+]Cc2cnc(C3CC3)nc2)c(Cl)s1 ZINC000459469303 1047078395 /nfs/dbraw/zinc/07/83/95/1047078395.db2.gz SRDRCYVFZUWCJN-UHFFFAOYSA-N 1 2 314.241 4.012 20 0 DIADLO CCCC[N@H+](Cn1nc(NC(C)C)sc1=S)[C@@H](C)CC ZINC001115862088 1047087543 /nfs/dbraw/zinc/08/75/43/1047087543.db2.gz HKVAJKODTIYAHR-LBPRGKRZSA-N 1 2 316.540 4.352 20 0 DIADLO CCCC[N@@H+](Cn1nc(NC(C)C)sc1=S)[C@@H](C)CC ZINC001115862088 1047087561 /nfs/dbraw/zinc/08/75/61/1047087561.db2.gz HKVAJKODTIYAHR-LBPRGKRZSA-N 1 2 316.540 4.352 20 0 DIADLO C[C@H](O)[C@@H]1CCC[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC000681082749 1047092761 /nfs/dbraw/zinc/09/27/61/1047092761.db2.gz OQAFHGJDAVQRPH-VHSXEESVSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H](O)[C@@H]1CCC[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC000681082749 1047092776 /nfs/dbraw/zinc/09/27/76/1047092776.db2.gz OQAFHGJDAVQRPH-VHSXEESVSA-N 1 2 322.663 4.240 20 0 DIADLO CCC(C)(CC)C(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1 ZINC000681090379 1047094919 /nfs/dbraw/zinc/09/49/19/1047094919.db2.gz JZMQNKIAMPKPGH-UHFFFAOYSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1nc(N2CCC(c3cccc(F)c3F)CC2)c(C)c(C)[nH+]1 ZINC000681152379 1047104493 /nfs/dbraw/zinc/10/44/93/1047104493.db2.gz AQTPIHHIRPAGHB-UHFFFAOYSA-N 1 2 317.383 4.064 20 0 DIADLO CCn1nc(C[N@@H+]2CCOc3ccccc3[C@@H]2C)c2ccccc21 ZINC000681164272 1047105086 /nfs/dbraw/zinc/10/50/86/1047105086.db2.gz OFCMIQYUYIWDOV-HNNXBMFYSA-N 1 2 321.424 4.012 20 0 DIADLO CCn1nc(C[N@H+]2CCOc3ccccc3[C@@H]2C)c2ccccc21 ZINC000681164272 1047105092 /nfs/dbraw/zinc/10/50/92/1047105092.db2.gz OFCMIQYUYIWDOV-HNNXBMFYSA-N 1 2 321.424 4.012 20 0 DIADLO COCc1cc(CNc2cc(C)c3ccccc3[nH+]2)ccc1F ZINC001116102872 1047108160 /nfs/dbraw/zinc/10/81/60/1047108160.db2.gz MMIBIBSRDIOCGJ-UHFFFAOYSA-N 1 2 310.372 4.441 20 0 DIADLO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1ccn(-c2ccccc2)n1 ZINC000536859903 1047115210 /nfs/dbraw/zinc/11/52/10/1047115210.db2.gz VWFFOPGJLLJRAS-MRXNPFEDSA-N 1 2 321.424 4.040 20 0 DIADLO CC(C)c1cccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000681358940 1047117848 /nfs/dbraw/zinc/11/78/48/1047117848.db2.gz RLMUJPCMNGMXAS-CYBMUJFWSA-N 1 2 301.434 4.341 20 0 DIADLO CCC[N@H+](Cc1nnc(C(C)C)s1)Cc1ccc(OC)cc1 ZINC000649265832 1047119986 /nfs/dbraw/zinc/11/99/86/1047119986.db2.gz CTDSONAROYNIAV-UHFFFAOYSA-N 1 2 319.474 4.082 20 0 DIADLO CCC[N@@H+](Cc1nnc(C(C)C)s1)Cc1ccc(OC)cc1 ZINC000649265832 1047119992 /nfs/dbraw/zinc/11/99/92/1047119992.db2.gz CTDSONAROYNIAV-UHFFFAOYSA-N 1 2 319.474 4.082 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1nnc(C(C)C)s1 ZINC000649313101 1047121420 /nfs/dbraw/zinc/12/14/20/1047121420.db2.gz VBYAFULJNQTNQO-OAHLLOKOSA-N 1 2 301.459 4.171 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1nnc(C(C)C)s1 ZINC000649313101 1047121429 /nfs/dbraw/zinc/12/14/29/1047121429.db2.gz VBYAFULJNQTNQO-OAHLLOKOSA-N 1 2 301.459 4.171 20 0 DIADLO CC[NH+](CC)c1ccc(-n2nc3ccc(N)cc3c2Cl)cc1 ZINC001212970038 1047123641 /nfs/dbraw/zinc/12/36/41/1047123641.db2.gz REIMZXJMIKIEFI-UHFFFAOYSA-N 1 2 314.820 4.107 20 0 DIADLO CCC[N@H+](Cc1nccn1C(C)C)[C@H]1CCCc2cccnc21 ZINC000681468728 1047125127 /nfs/dbraw/zinc/12/51/27/1047125127.db2.gz IEYBBCJLMABALE-KRWDZBQOSA-N 1 2 312.461 4.149 20 0 DIADLO CCC[N@@H+](Cc1nccn1C(C)C)[C@H]1CCCc2cccnc21 ZINC000681468728 1047125129 /nfs/dbraw/zinc/12/51/29/1047125129.db2.gz IEYBBCJLMABALE-KRWDZBQOSA-N 1 2 312.461 4.149 20 0 DIADLO Cc1cc(N[C@H]2CCO[C@@]3(CCSC3)C2)[nH+]c2ccccc12 ZINC001116309152 1047129805 /nfs/dbraw/zinc/12/98/05/1047129805.db2.gz RKVJGGYKCDDKTD-KSSFIOAISA-N 1 2 314.454 4.010 20 0 DIADLO COc1ccc(C)cc1C[NH2+][C@H]1COCc2cccc(Cl)c21 ZINC000925305582 1047130284 /nfs/dbraw/zinc/13/02/84/1047130284.db2.gz NWPWTOINCCZWGK-INIZCTEOSA-N 1 2 317.816 4.018 20 0 DIADLO Cc1nc2ccccc2nc1C[NH2+][C@H](C)c1c(F)cccc1F ZINC000537026271 1047133468 /nfs/dbraw/zinc/13/34/68/1047133468.db2.gz AIEZFHIJPIQVKT-GFCCVEGCSA-N 1 2 313.351 4.067 20 0 DIADLO COc1cc(C)[nH+]c(CSc2ncc(-c3ccccc3)o2)c1 ZINC001116387628 1047136118 /nfs/dbraw/zinc/13/61/18/1047136118.db2.gz KFDUVZIXBHBPLZ-UHFFFAOYSA-N 1 2 312.394 4.346 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@H+]([C@@H](C)c1cnc(C)nc1C)CC3 ZINC000681670694 1047139889 /nfs/dbraw/zinc/13/98/89/1047139889.db2.gz FZFAAXUBCKQUMZ-AWEZNQCLSA-N 1 2 320.440 4.002 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@@H+]([C@@H](C)c1cnc(C)nc1C)CC3 ZINC000681670694 1047139896 /nfs/dbraw/zinc/13/98/96/1047139896.db2.gz FZFAAXUBCKQUMZ-AWEZNQCLSA-N 1 2 320.440 4.002 20 0 DIADLO CC[C@@H](C)[N@@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000681671180 1047140110 /nfs/dbraw/zinc/14/01/10/1047140110.db2.gz JNAIPZCEVPPAPF-SNVBAGLBSA-N 1 2 307.235 4.087 20 0 DIADLO CC[C@@H](C)[N@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000681671180 1047140115 /nfs/dbraw/zinc/14/01/15/1047140115.db2.gz JNAIPZCEVPPAPF-SNVBAGLBSA-N 1 2 307.235 4.087 20 0 DIADLO CC(C)(C)c1ccc(C(C)(C)[NH2+]Cc2nc(C3CC3)no2)cc1 ZINC000537105216 1047140496 /nfs/dbraw/zinc/14/04/96/1047140496.db2.gz ULXKVNULMOUQFO-UHFFFAOYSA-N 1 2 313.445 4.269 20 0 DIADLO CC(C)CCCCCCNC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC001141462898 1047140618 /nfs/dbraw/zinc/14/06/18/1047140618.db2.gz YGFLOFLYGOHEHF-UHFFFAOYSA-N 1 2 313.445 4.209 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ccc(F)cc2)[nH]n1 ZINC001116440623 1047141529 /nfs/dbraw/zinc/14/15/29/1047141529.db2.gz WLEDEZMLXUNFDR-UHFFFAOYSA-N 1 2 309.388 4.060 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2ccc(F)cc2)[nH]n1 ZINC001116440623 1047141534 /nfs/dbraw/zinc/14/15/34/1047141534.db2.gz WLEDEZMLXUNFDR-UHFFFAOYSA-N 1 2 309.388 4.060 20 0 DIADLO c1c(C[N@@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)nn2c1CCC2 ZINC000649559643 1047143813 /nfs/dbraw/zinc/14/38/13/1047143813.db2.gz KQIQYAOHWRJULQ-FQEVSTJZSA-N 1 2 320.440 4.038 20 0 DIADLO c1c(C[N@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)nn2c1CCC2 ZINC000649559643 1047143818 /nfs/dbraw/zinc/14/38/18/1047143818.db2.gz KQIQYAOHWRJULQ-FQEVSTJZSA-N 1 2 320.440 4.038 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000649566856 1047145462 /nfs/dbraw/zinc/14/54/62/1047145462.db2.gz ZWDDDTBABRWBLE-GFCCVEGCSA-N 1 2 302.805 4.402 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CCc4nc(Cl)ccc4C3)ccc2n1 ZINC001141480447 1047146826 /nfs/dbraw/zinc/14/68/26/1047146826.db2.gz CQIBVVYFYSYINQ-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CCc4nc(Cl)ccc4C3)ccc2n1 ZINC001141480447 1047146831 /nfs/dbraw/zinc/14/68/31/1047146831.db2.gz CQIBVVYFYSYINQ-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1ccc(N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)c(C)[nH+]1 ZINC001116496230 1047150050 /nfs/dbraw/zinc/15/00/50/1047150050.db2.gz WYTFSSVJVRQLPL-ZDUSSCGKSA-N 1 2 324.428 4.155 20 0 DIADLO Fc1cccc(Br)c1C[N@H+]1CCC[C@H](C(F)F)C1 ZINC001137466717 1047150806 /nfs/dbraw/zinc/15/08/06/1047150806.db2.gz OKUZRPUKQIYGJY-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO Fc1cccc(Br)c1C[N@@H+]1CCC[C@H](C(F)F)C1 ZINC001137466717 1047150809 /nfs/dbraw/zinc/15/08/09/1047150809.db2.gz OKUZRPUKQIYGJY-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO Fc1ccccc1C1CC[NH+](Cc2ccc(Cl)nc2F)CC1 ZINC001137474100 1047151857 /nfs/dbraw/zinc/15/18/57/1047151857.db2.gz IPTKQBAFFCMBOL-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)nc2F)c1 ZINC001137478122 1047152495 /nfs/dbraw/zinc/15/24/95/1047152495.db2.gz WGTSNBBEAWTJSO-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)nc2F)c1 ZINC001137478122 1047152500 /nfs/dbraw/zinc/15/25/00/1047152500.db2.gz WGTSNBBEAWTJSO-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)nc2F)cc1 ZINC001137474530 1047152917 /nfs/dbraw/zinc/15/29/17/1047152917.db2.gz XQVOEJBNYDCSHJ-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)nc2F)cc1 ZINC001137474530 1047152921 /nfs/dbraw/zinc/15/29/21/1047152921.db2.gz XQVOEJBNYDCSHJ-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Clc1ccccc1C1([NH2+]Cc2cn3ccccc3n2)CCC1 ZINC000649642562 1047156834 /nfs/dbraw/zinc/15/68/34/1047156834.db2.gz FPJCIRCODJPANL-UHFFFAOYSA-N 1 2 311.816 4.157 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@@H+]([C@H](C)c2ccc(F)cc2F)C1 ZINC000682042752 1047163949 /nfs/dbraw/zinc/16/39/49/1047163949.db2.gz ZKHRXCFYPALMOB-QMTHXVAHSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@H+]([C@H](C)c2ccc(F)cc2F)C1 ZINC000682042752 1047163954 /nfs/dbraw/zinc/16/39/54/1047163954.db2.gz ZKHRXCFYPALMOB-QMTHXVAHSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@@H+]([C@H](C)c2cc(F)ccc2F)C1 ZINC000682041826 1047164237 /nfs/dbraw/zinc/16/42/37/1047164237.db2.gz NDAYCEVXIRXKLQ-YGRLFVJLSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@H+]([C@H](C)c2cc(F)ccc2F)C1 ZINC000682041826 1047164241 /nfs/dbraw/zinc/16/42/41/1047164241.db2.gz NDAYCEVXIRXKLQ-YGRLFVJLSA-N 1 2 323.305 4.069 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(C)nc2Cl)n1 ZINC000838872826 1047166684 /nfs/dbraw/zinc/16/66/84/1047166684.db2.gz JYODGYIYLZALQU-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(C)nc2Cl)n1 ZINC000838872826 1047166688 /nfs/dbraw/zinc/16/66/88/1047166688.db2.gz JYODGYIYLZALQU-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO CC[N@H+](Cc1ccc(C)nc1Cl)[C@H](C)c1cccc(O)c1 ZINC000838866159 1047166722 /nfs/dbraw/zinc/16/67/22/1047166722.db2.gz SOKNZOGKAMQVKJ-CYBMUJFWSA-N 1 2 304.821 4.332 20 0 DIADLO CC[N@@H+](Cc1ccc(C)nc1Cl)[C@H](C)c1cccc(O)c1 ZINC000838866159 1047166732 /nfs/dbraw/zinc/16/67/32/1047166732.db2.gz SOKNZOGKAMQVKJ-CYBMUJFWSA-N 1 2 304.821 4.332 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C3CC4(CCC4)C3)cc2)C[C@H](C)O1 ZINC000838878406 1047168365 /nfs/dbraw/zinc/16/83/65/1047168365.db2.gz LLGWNNHGCGSPEC-GASCZTMLSA-N 1 2 300.446 4.045 20 0 DIADLO Cc1noc([C@H](C)[N@@H+]2CCc3ccc(-c4ccccc4)cc3C2)n1 ZINC000649725709 1047168915 /nfs/dbraw/zinc/16/89/15/1047168915.db2.gz IVQSYGDZJBDDPS-AWEZNQCLSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1noc([C@H](C)[N@H+]2CCc3ccc(-c4ccccc4)cc3C2)n1 ZINC000649725709 1047168922 /nfs/dbraw/zinc/16/89/22/1047168922.db2.gz IVQSYGDZJBDDPS-AWEZNQCLSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1ccccc1-c1cnc(C[NH2+][C@H](c2cccnc2)C2CC2)o1 ZINC000682086829 1047170663 /nfs/dbraw/zinc/17/06/63/1047170663.db2.gz SOSPIAOQQDNLFY-FQEVSTJZSA-N 1 2 319.408 4.286 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)c(Cl)n1 ZINC000838924308 1047176126 /nfs/dbraw/zinc/17/61/26/1047176126.db2.gz CZHDPLPSGWKFQG-PWSUYJOCSA-N 1 2 306.759 4.206 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)c(Cl)n1 ZINC000838924308 1047176129 /nfs/dbraw/zinc/17/61/29/1047176129.db2.gz CZHDPLPSGWKFQG-PWSUYJOCSA-N 1 2 306.759 4.206 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2C[C@H](C)c2cccc(Cl)c2)no1 ZINC000682150897 1047178335 /nfs/dbraw/zinc/17/83/35/1047178335.db2.gz BQKNFWHXHBAVFH-LRDDRELGSA-N 1 2 319.836 4.362 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2C[C@H](C)c2cccc(Cl)c2)no1 ZINC000682150897 1047178341 /nfs/dbraw/zinc/17/83/41/1047178341.db2.gz BQKNFWHXHBAVFH-LRDDRELGSA-N 1 2 319.836 4.362 20 0 DIADLO Cc1ccc(C[NH+]2CCC(CC(F)(F)F)CC2)c(Cl)n1 ZINC000838983607 1047179281 /nfs/dbraw/zinc/17/92/81/1047179281.db2.gz BSTZJXAFHRTVMU-UHFFFAOYSA-N 1 2 306.759 4.208 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(Cl)c2)C[N@@H+]1Cc1ccc(O)cc1 ZINC000682407302 1047192078 /nfs/dbraw/zinc/19/20/78/1047192078.db2.gz WZRIJGAJFBUDIZ-ACJLOTCBSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(Cl)c2)C[N@H+]1Cc1ccc(O)cc1 ZINC000682407302 1047192086 /nfs/dbraw/zinc/19/20/86/1047192086.db2.gz WZRIJGAJFBUDIZ-ACJLOTCBSA-N 1 2 317.816 4.008 20 0 DIADLO CC[C@H](NC(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccccc1F ZINC000650210702 1047222533 /nfs/dbraw/zinc/22/25/33/1047222533.db2.gz YOTZUPHLDGZIQB-INIZCTEOSA-N 1 2 315.392 4.419 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc(C)cc2Br)nc1 ZINC000682787342 1047223426 /nfs/dbraw/zinc/22/34/26/1047223426.db2.gz JDDZLEFVVYNWHL-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc(C)cc2Br)nc1 ZINC000682787342 1047223431 /nfs/dbraw/zinc/22/34/31/1047223431.db2.gz JDDZLEFVVYNWHL-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cn1cccc1C[N@H+](C)Cn1c(=S)oc2ccc(Cl)cc21 ZINC000760402705 1047229368 /nfs/dbraw/zinc/22/93/68/1047229368.db2.gz VLYNPDVLLVYWDV-UHFFFAOYSA-N 1 2 321.833 4.045 20 0 DIADLO Cn1cccc1C[N@@H+](C)Cn1c(=S)oc2ccc(Cl)cc21 ZINC000760402705 1047229382 /nfs/dbraw/zinc/22/93/82/1047229382.db2.gz VLYNPDVLLVYWDV-UHFFFAOYSA-N 1 2 321.833 4.045 20 0 DIADLO Cn1cccc1C[N@H+](C)Cn1c(=S)oc2cc(Cl)ccc21 ZINC000760402526 1047229484 /nfs/dbraw/zinc/22/94/84/1047229484.db2.gz SKXMDDJCYCUNEV-UHFFFAOYSA-N 1 2 321.833 4.045 20 0 DIADLO Cn1cccc1C[N@@H+](C)Cn1c(=S)oc2cc(Cl)ccc21 ZINC000760402526 1047229501 /nfs/dbraw/zinc/22/95/01/1047229501.db2.gz SKXMDDJCYCUNEV-UHFFFAOYSA-N 1 2 321.833 4.045 20 0 DIADLO CCc1oc(C(=O)Nc2cccc(-c3[nH]c(C)c(C)[nH+]3)c2)cc1C ZINC000760437883 1047235331 /nfs/dbraw/zinc/23/53/31/1047235331.db2.gz KDDUVBVQRPTIDX-UHFFFAOYSA-N 1 2 323.396 4.410 20 0 DIADLO Cc1cc(N[C@@H]2CCO[C@H](c3ccncc3)C2)[nH+]c2ccccc12 ZINC001117758597 1047241450 /nfs/dbraw/zinc/24/14/50/1047241450.db2.gz RLAGGRAWNHMLSG-APWZRJJASA-N 1 2 319.408 4.270 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc3cc(F)ccc3n2)no1 ZINC001141640353 1047243484 /nfs/dbraw/zinc/24/34/84/1047243484.db2.gz WRNSZPMYFMUUIN-SFHVURJKSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc3cc(F)ccc3n2)no1 ZINC001141640353 1047243488 /nfs/dbraw/zinc/24/34/88/1047243488.db2.gz WRNSZPMYFMUUIN-SFHVURJKSA-N 1 2 311.360 4.007 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1cscc1Cl ZINC000682946059 1047244242 /nfs/dbraw/zinc/24/42/42/1047244242.db2.gz CKISXYOHISGIRZ-UHFFFAOYSA-N 1 2 302.226 4.353 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cnc(Cl)s2)cc1Cl ZINC000839660131 1047254669 /nfs/dbraw/zinc/25/46/69/1047254669.db2.gz BYZPVFMQZCKFGK-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cnc(Cl)s2)cc1Cl ZINC000839660131 1047254692 /nfs/dbraw/zinc/25/46/92/1047254692.db2.gz BYZPVFMQZCKFGK-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(C)ccn1)c1nc(C(F)(F)F)cs1 ZINC000683021840 1047257690 /nfs/dbraw/zinc/25/76/90/1047257690.db2.gz LWTBGOFGYKNLJK-NSHDSACASA-N 1 2 315.364 4.106 20 0 DIADLO COc1ccc(COCCOc2cc(C)[nH+]c3ccccc32)cc1 ZINC000683072314 1047269177 /nfs/dbraw/zinc/26/91/77/1047269177.db2.gz CMBIIXISUWAXPA-UHFFFAOYSA-N 1 2 323.392 4.147 20 0 DIADLO Fc1ccc(C[N@@H+]2CC[C@H]3[C@@H](C2)C3(F)F)c(Cl)c1Cl ZINC001462333027 1047273831 /nfs/dbraw/zinc/27/38/31/1047273831.db2.gz MZTXHQNBIDETOK-DTWKUNHWSA-N 1 2 310.146 4.220 20 0 DIADLO Fc1ccc(C[N@H+]2CC[C@H]3[C@@H](C2)C3(F)F)c(Cl)c1Cl ZINC001462333027 1047273844 /nfs/dbraw/zinc/27/38/44/1047273844.db2.gz MZTXHQNBIDETOK-DTWKUNHWSA-N 1 2 310.146 4.220 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2cc(OC(C)C)ccn2)c1 ZINC001118228401 1047274518 /nfs/dbraw/zinc/27/45/18/1047274518.db2.gz PAQBZQMSGORJFN-UHFFFAOYSA-N 1 2 318.442 4.014 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CCOC2(CCCC2)C1 ZINC000388220029 1047287265 /nfs/dbraw/zinc/28/72/65/1047287265.db2.gz WTMHITNNHPXHFV-QGZVFWFLSA-N 1 2 300.446 4.191 20 0 DIADLO c1cc(N2CCCC2)ccc1[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000388220029 1047287270 /nfs/dbraw/zinc/28/72/70/1047287270.db2.gz WTMHITNNHPXHFV-QGZVFWFLSA-N 1 2 300.446 4.191 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cccc(Br)n1 ZINC000388760872 1047288943 /nfs/dbraw/zinc/28/89/43/1047288943.db2.gz NRTLQKCLENJJOY-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cccc(Br)n1 ZINC000388760872 1047288949 /nfs/dbraw/zinc/28/89/49/1047288949.db2.gz NRTLQKCLENJJOY-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO Fc1cc(Br)cc(C[NH+]2CCCCCC2)c1F ZINC001141795575 1047290706 /nfs/dbraw/zinc/29/07/06/1047290706.db2.gz KBRPRNRTLBLBKQ-UHFFFAOYSA-N 1 2 304.178 4.103 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1cnn(-c2ccccc2)c1 ZINC000391488598 1047304236 /nfs/dbraw/zinc/30/42/36/1047304236.db2.gz YISVYKMNEIJAAJ-OAHLLOKOSA-N 1 2 306.413 4.111 20 0 DIADLO COc1cc(C)c([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)cc1C ZINC000897942979 1047305662 /nfs/dbraw/zinc/30/56/62/1047305662.db2.gz VOVVRMVNKXHFLP-CQSZACIVSA-N 1 2 316.445 4.448 20 0 DIADLO c1n[nH]c([C@@H]([NH2+]CC[C@H]2CCc3ccccc32)C2CCCCC2)n1 ZINC000651376272 1047311638 /nfs/dbraw/zinc/31/16/38/1047311638.db2.gz ZDLVHUGNJIZSRV-APWZRJJASA-N 1 2 324.472 4.136 20 0 DIADLO CCn1c(C2CC2)nn(C[N@H+](C)CCC2CCCCC2)c1=S ZINC000725785664 1047313668 /nfs/dbraw/zinc/31/36/68/1047313668.db2.gz HHMNUPLZORIZAN-UHFFFAOYSA-N 1 2 322.522 4.171 20 0 DIADLO CCn1c(C2CC2)nn(C[N@@H+](C)CCC2CCCCC2)c1=S ZINC000725785664 1047313683 /nfs/dbraw/zinc/31/36/83/1047313683.db2.gz HHMNUPLZORIZAN-UHFFFAOYSA-N 1 2 322.522 4.171 20 0 DIADLO CCCOc1cccc2c(N3CC[C@]4(CC4(F)F)C3)cc[nH+]c12 ZINC000651489541 1047318349 /nfs/dbraw/zinc/31/83/49/1047318349.db2.gz ZOWKLHDKKACDSU-KRWDZBQOSA-N 1 2 318.367 4.259 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001118944808 1047319020 /nfs/dbraw/zinc/31/90/20/1047319020.db2.gz UARUOXXQFVDWRN-GXTWGEPZSA-N 1 2 323.362 4.240 20 0 DIADLO C[N@H+](Cc1ccccc1)Cc1ncc(C(F)(F)F)cc1Cl ZINC001142534383 1047319025 /nfs/dbraw/zinc/31/90/25/1047319025.db2.gz HRHYTBLRQXICJE-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccccc1)Cc1ncc(C(F)(F)F)cc1Cl ZINC001142534383 1047319041 /nfs/dbraw/zinc/31/90/41/1047319041.db2.gz HRHYTBLRQXICJE-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001118944808 1047319036 /nfs/dbraw/zinc/31/90/36/1047319036.db2.gz UARUOXXQFVDWRN-GXTWGEPZSA-N 1 2 323.362 4.240 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@H](C)c1cccc(O)c1F)CCC2 ZINC001119067024 1047322510 /nfs/dbraw/zinc/32/25/10/1047322510.db2.gz ZKIAAASWEBXLIC-IUODEOHRSA-N 1 2 317.408 4.037 20 0 DIADLO Cc1cc(C)c(CNc2ccc([N+](=O)[O-])cc2C(F)F)c[nH+]1 ZINC000397002194 1047325581 /nfs/dbraw/zinc/32/55/81/1047325581.db2.gz IPUHTYKRXKWBBC-UHFFFAOYSA-N 1 2 307.300 4.156 20 0 DIADLO C[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1ccc(-c2ccccc2)cn1 ZINC000651822531 1047329239 /nfs/dbraw/zinc/32/92/39/1047329239.db2.gz AQFFNKPDSUQVNO-DOXZYTNZSA-N 1 2 318.424 4.302 20 0 DIADLO CC(C)c1cnc(C[NH+]2CCC3(CC2)C(F)(F)C3(F)F)s1 ZINC000651901067 1047332709 /nfs/dbraw/zinc/33/27/09/1047332709.db2.gz UHPAHRUWAHRZCT-UHFFFAOYSA-N 1 2 322.371 4.133 20 0 DIADLO CSc1ccc(C[NH+]2CCC(C(=O)c3cccs3)CC2)o1 ZINC001119445109 1047333177 /nfs/dbraw/zinc/33/31/77/1047333177.db2.gz GTFKNPQJDKXGJZ-UHFFFAOYSA-N 1 2 321.467 4.158 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H]1C[C@H]1C1CCCC1 ZINC000651955911 1047336614 /nfs/dbraw/zinc/33/66/14/1047336614.db2.gz FLRSXGGFGDQPQR-HOTGVXAUSA-N 1 2 309.413 4.150 20 0 DIADLO c1cc(Oc2ccccc2)c(C[N@@H+]2CCOC[C@@H]2C2CC2)s1 ZINC001142001110 1047339743 /nfs/dbraw/zinc/33/97/43/1047339743.db2.gz HMVFNRMADDHNJO-MRXNPFEDSA-N 1 2 315.438 4.151 20 0 DIADLO c1cc(Oc2ccccc2)c(C[N@H+]2CCOC[C@@H]2C2CC2)s1 ZINC001142001110 1047339756 /nfs/dbraw/zinc/33/97/56/1047339756.db2.gz HMVFNRMADDHNJO-MRXNPFEDSA-N 1 2 315.438 4.151 20 0 DIADLO C[C@@H]1C[N@H+](Cc2sccc2Oc2ccccc2)[C@H](C)CO1 ZINC001142001526 1047340053 /nfs/dbraw/zinc/34/00/53/1047340053.db2.gz UHAHVORXQPNGQW-ZIAGYGMSSA-N 1 2 303.427 4.150 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2sccc2Oc2ccccc2)[C@H](C)CO1 ZINC001142001526 1047340067 /nfs/dbraw/zinc/34/00/67/1047340067.db2.gz UHAHVORXQPNGQW-ZIAGYGMSSA-N 1 2 303.427 4.150 20 0 DIADLO CC1(C)COCC[N@@H+]1Cc1sccc1Oc1ccccc1 ZINC001141999497 1047340233 /nfs/dbraw/zinc/34/02/33/1047340233.db2.gz KQUQUBAXSQGISI-UHFFFAOYSA-N 1 2 303.427 4.151 20 0 DIADLO CC1(C)COCC[N@H+]1Cc1sccc1Oc1ccccc1 ZINC001141999497 1047340244 /nfs/dbraw/zinc/34/02/44/1047340244.db2.gz KQUQUBAXSQGISI-UHFFFAOYSA-N 1 2 303.427 4.151 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2cc(F)c(Cl)cc2Cl)on1 ZINC000044299411 1047342690 /nfs/dbraw/zinc/34/26/90/1047342690.db2.gz XNHZKVKOHNLTBP-MRVPVSSYSA-N 1 2 303.164 4.280 20 0 DIADLO C[C@H]([NH2+][C@@H]1CC(C)(C)Oc2ccc(F)cc21)c1cscn1 ZINC000652266704 1047350809 /nfs/dbraw/zinc/35/08/09/1047350809.db2.gz JNOOJFSJZUKWRE-GXFFZTMASA-N 1 2 306.406 4.235 20 0 DIADLO CC(C)CCO[C@H]1CC[N@H+](Cc2ncc(Cl)cc2Cl)C1 ZINC000537516230 1047351192 /nfs/dbraw/zinc/35/11/92/1047351192.db2.gz NJIJIZZBHXQBQK-ZDUSSCGKSA-N 1 2 317.260 4.025 20 0 DIADLO CC(C)CCO[C@H]1CC[N@@H+](Cc2ncc(Cl)cc2Cl)C1 ZINC000537516230 1047351211 /nfs/dbraw/zinc/35/12/11/1047351211.db2.gz NJIJIZZBHXQBQK-ZDUSSCGKSA-N 1 2 317.260 4.025 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@H](Cc2ccccc2)c2nccn2C)o1 ZINC000652274425 1047352393 /nfs/dbraw/zinc/35/23/93/1047352393.db2.gz NQDSCBPPPCTZMX-MAUKXSAKSA-N 1 2 323.440 4.210 20 0 DIADLO CC[C@H](Nc1cc(COC)cc[nH+]1)c1ccc(OC(F)F)cc1 ZINC000652329868 1047354000 /nfs/dbraw/zinc/35/40/00/1047354000.db2.gz MEWVSCDRYRCBAY-HNNXBMFYSA-N 1 2 322.355 4.393 20 0 DIADLO CCCOc1ccc([C@H](C)Nc2cc(COC)cc[nH+]2)cc1 ZINC000652330711 1047355872 /nfs/dbraw/zinc/35/58/72/1047355872.db2.gz NJNLAZKHFFAVKJ-AWEZNQCLSA-N 1 2 300.402 4.190 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CCCc3ccc(SC)cc32)c1 ZINC000652331565 1047356662 /nfs/dbraw/zinc/35/66/62/1047356662.db2.gz LIHQIBUMJJJBDV-KRWDZBQOSA-N 1 2 314.454 4.439 20 0 DIADLO Oc1cc(Cl)c(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)c(Cl)c1 ZINC001142114995 1047382788 /nfs/dbraw/zinc/38/27/88/1047382788.db2.gz SJWWGKGHXYPCHE-SSDOTTSWSA-N 1 2 314.134 4.083 20 0 DIADLO Oc1cc(Cl)c(C[N@H+]2CC[C@@H](C(F)(F)F)C2)c(Cl)c1 ZINC001142114995 1047382796 /nfs/dbraw/zinc/38/27/96/1047382796.db2.gz SJWWGKGHXYPCHE-SSDOTTSWSA-N 1 2 314.134 4.083 20 0 DIADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc(-c2ccccc2Cl)cc1 ZINC001142102360 1047380466 /nfs/dbraw/zinc/38/04/66/1047380466.db2.gz SRXJCTUUCADVKQ-CYBMUJFWSA-N 1 2 317.816 4.000 20 0 DIADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(-c2ccccc2Cl)cc1 ZINC001142102360 1047380476 /nfs/dbraw/zinc/38/04/76/1047380476.db2.gz SRXJCTUUCADVKQ-CYBMUJFWSA-N 1 2 317.816 4.000 20 0 DIADLO CC(C)(C)Sc1ccc(NC(=O)CCCn2cc[nH+]c2)cc1 ZINC000726758705 1047380966 /nfs/dbraw/zinc/38/09/66/1047380966.db2.gz WLKDHVTTWFJUJS-UHFFFAOYSA-N 1 2 317.458 4.193 20 0 DIADLO Oc1cc(Cl)c(C[N@@H+]2CCC[C@@H](C(F)F)C2)c(Cl)c1 ZINC001142114417 1047382190 /nfs/dbraw/zinc/38/21/90/1047382190.db2.gz HRHNWXKDBHHSKW-MRVPVSSYSA-N 1 2 310.171 4.176 20 0 DIADLO Oc1cc(Cl)c(C[N@H+]2CCC[C@@H](C(F)F)C2)c(Cl)c1 ZINC001142114417 1047382199 /nfs/dbraw/zinc/38/21/99/1047382199.db2.gz HRHNWXKDBHHSKW-MRVPVSSYSA-N 1 2 310.171 4.176 20 0 DIADLO CC(C)OC1CC[NH+](Cc2c(Cl)cc(O)cc2Cl)CC1 ZINC001142115003 1047382728 /nfs/dbraw/zinc/38/27/28/1047382728.db2.gz SUFFQDWFJZPLET-UHFFFAOYSA-N 1 2 318.244 4.088 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@H]2c2cccc(F)c2)c(C)[nH+]1 ZINC000653183067 1047384500 /nfs/dbraw/zinc/38/45/00/1047384500.db2.gz KUQDHRVZBFDFJK-INIZCTEOSA-N 1 2 313.376 4.125 20 0 DIADLO Cc1ccc2c(c1)[C@H](NC(=O)Nc1c(C)cc(C)[nH+]c1C)CC2 ZINC000653179897 1047384904 /nfs/dbraw/zinc/38/49/04/1047384904.db2.gz ZZJHZUPESZYNAW-QGZVFWFLSA-N 1 2 309.413 4.124 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCCc3sccc3C2)c(C)[nH+]1 ZINC000653179895 1047385413 /nfs/dbraw/zinc/38/54/13/1047385413.db2.gz ZPGPOXMISQLKAM-UHFFFAOYSA-N 1 2 315.442 4.049 20 0 DIADLO Cc1ccc(C[N@@H+]2Cc3ccccc3C(C)(C)C2)c(Cl)n1 ZINC001142143922 1047389500 /nfs/dbraw/zinc/38/95/00/1047389500.db2.gz LPKOKSXTZTVKIO-UHFFFAOYSA-N 1 2 300.833 4.337 20 0 DIADLO Cc1ccc(C[N@H+]2Cc3ccccc3C(C)(C)C2)c(Cl)n1 ZINC001142143922 1047389512 /nfs/dbraw/zinc/38/95/12/1047389512.db2.gz LPKOKSXTZTVKIO-UHFFFAOYSA-N 1 2 300.833 4.337 20 0 DIADLO C/C(=C/c1ccc(F)cc1)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000749342722 1047412047 /nfs/dbraw/zinc/41/20/47/1047412047.db2.gz VTGDEZMYZAXSCV-OWBHPGMISA-N 1 2 321.355 4.053 20 0 DIADLO C/C(=C/c1ccc(F)cc1)C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000749347877 1047412315 /nfs/dbraw/zinc/41/23/15/1047412315.db2.gz JRWGTFSPOMGYSZ-KAMYIIQDSA-N 1 2 321.355 4.053 20 0 DIADLO C[C@@H](Cc1ccc(F)cc1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000749382171 1047414839 /nfs/dbraw/zinc/41/48/39/1047414839.db2.gz MMSLNJATBBYRDF-ZDUSSCGKSA-N 1 2 323.371 4.033 20 0 DIADLO C/C(=C\C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000749380827 1047414899 /nfs/dbraw/zinc/41/48/99/1047414899.db2.gz BRQSGGKMJXHLKH-BUHFOSPRSA-N 1 2 303.365 4.119 20 0 DIADLO CC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC001142247385 1047415163 /nfs/dbraw/zinc/41/51/63/1047415163.db2.gz XELYNCLWGQWVFI-RHSMWYFYSA-N 1 2 311.429 4.458 20 0 DIADLO C/C(=C/C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1)c1ccco1 ZINC001142247276 1047415638 /nfs/dbraw/zinc/41/56/38/1047415638.db2.gz RYWCPLFLPKIDKC-BENRWUELSA-N 1 2 321.380 4.329 20 0 DIADLO Cc1ccc(-c2ccc(C[N@H+](C)C3CC[NH+](C)CC3)cc2)cc1 ZINC001142299814 1047424192 /nfs/dbraw/zinc/42/41/92/1047424192.db2.gz DFGIVKCOCSRNPS-UHFFFAOYSA-N 1 2 308.469 4.188 20 0 DIADLO Cc1cccc(C)c1NC(=O)C[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000119163495 1047444681 /nfs/dbraw/zinc/44/46/81/1047444681.db2.gz YAQAAKDFPJCOSC-OAHLLOKOSA-N 1 2 312.413 4.061 20 0 DIADLO Cc1cccc(C)c1NC(=O)C[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000119163495 1047444686 /nfs/dbraw/zinc/44/46/86/1047444686.db2.gz YAQAAKDFPJCOSC-OAHLLOKOSA-N 1 2 312.413 4.061 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C)c2ccccc2n1)c1ccccc1F ZINC000537612408 1047446307 /nfs/dbraw/zinc/44/63/07/1047446307.db2.gz OTWNMTOKTLPASU-KRWDZBQOSA-N 1 2 309.388 4.318 20 0 DIADLO CC(C)Cc1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000152351699 1047448201 /nfs/dbraw/zinc/44/82/01/1047448201.db2.gz ZKMCLHPGAULWIR-AWEZNQCLSA-N 1 2 315.461 4.416 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(OC)c(Cc2ccccc2)c1 ZINC000841850230 1047460335 /nfs/dbraw/zinc/46/03/35/1047460335.db2.gz FZBDOWAIRHGYAC-UHFFFAOYSA-N 1 2 321.424 4.115 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cnccn1)c1nc(-c2ccccc2)cs1 ZINC000089553651 1047483910 /nfs/dbraw/zinc/48/39/10/1047483910.db2.gz MQJGVRKMCMBMQL-QWHCGFSZSA-N 1 2 310.426 4.012 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2occc2Br)cc1 ZINC001143128112 1047533557 /nfs/dbraw/zinc/53/35/57/1047533557.db2.gz LVJAQKLEHLFUME-UHFFFAOYSA-N 1 2 308.219 4.237 20 0 DIADLO Fc1ccccc1-c1nc(CSCCn2cc[nH+]c2)cs1 ZINC000090201064 1047499203 /nfs/dbraw/zinc/49/92/03/1047499203.db2.gz SZDQORSDNUJEHL-UHFFFAOYSA-N 1 2 319.430 4.079 20 0 DIADLO Cc1nc2ccccn2c1C[N@@H+](C)Cc1ccc(F)cc1Cl ZINC000537632002 1047504635 /nfs/dbraw/zinc/50/46/35/1047504635.db2.gz JYXXGSRDPUAGQF-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1nc2ccccn2c1C[N@H+](C)Cc1ccc(F)cc1Cl ZINC000537632002 1047504637 /nfs/dbraw/zinc/50/46/37/1047504637.db2.gz JYXXGSRDPUAGQF-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2csc(C(C)C)n2)c(OC)c1 ZINC000120956795 1047506500 /nfs/dbraw/zinc/50/65/00/1047506500.db2.gz RTSDBKPUHNYBKM-LBPRGKRZSA-N 1 2 320.458 4.135 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2occc2Br)cc1 ZINC001143128112 1047533554 /nfs/dbraw/zinc/53/35/54/1047533554.db2.gz LVJAQKLEHLFUME-UHFFFAOYSA-N 1 2 308.219 4.237 20 0 DIADLO Cc1csc(C[NH2+][C@@H](CC(F)(F)F)c2ccc(F)cc2)n1 ZINC000092850484 1047539870 /nfs/dbraw/zinc/53/98/70/1047539870.db2.gz BNYZBELIJPVRLH-LBPRGKRZSA-N 1 2 318.339 4.374 20 0 DIADLO CC(C)c1ccc(CCC(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001143254151 1047544275 /nfs/dbraw/zinc/54/42/75/1047544275.db2.gz LUULHFCJGLKCHD-UHFFFAOYSA-N 1 2 307.397 4.029 20 0 DIADLO Cn1c2ccccc2nc1C[N@H+](C)Cc1cc2cc(F)ccc2o1 ZINC000093363884 1047544952 /nfs/dbraw/zinc/54/49/52/1047544952.db2.gz DOTLVUOGPKVTDW-UHFFFAOYSA-N 1 2 323.371 4.091 20 0 DIADLO Cn1c2ccccc2nc1C[N@@H+](C)Cc1cc2cc(F)ccc2o1 ZINC000093363884 1047544957 /nfs/dbraw/zinc/54/49/57/1047544957.db2.gz DOTLVUOGPKVTDW-UHFFFAOYSA-N 1 2 323.371 4.091 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2cccnc2)c(F)c1F ZINC001143267678 1047546083 /nfs/dbraw/zinc/54/60/83/1047546083.db2.gz UBEHNAPMDPJBFT-HNNXBMFYSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@H]2c2cccnc2)c(F)c1F ZINC001143267678 1047546086 /nfs/dbraw/zinc/54/60/86/1047546086.db2.gz UBEHNAPMDPJBFT-HNNXBMFYSA-N 1 2 318.367 4.096 20 0 DIADLO CCc1nc(C[NH2+][C@H](CC)c2cc(C)ccc2OC)cs1 ZINC000093406208 1047546403 /nfs/dbraw/zinc/54/64/03/1047546403.db2.gz KDXNWPHRWUEUOX-OAHLLOKOSA-N 1 2 304.459 4.263 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c(F)c1F ZINC001143276667 1047547042 /nfs/dbraw/zinc/54/70/42/1047547042.db2.gz SVRIFYIMNFQHLC-OAHLLOKOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2ccncc2)c(F)c1F ZINC001143276667 1047547046 /nfs/dbraw/zinc/54/70/46/1047547046.db2.gz SVRIFYIMNFQHLC-OAHLLOKOSA-N 1 2 318.367 4.096 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cc3cc(OC)ccc3o2)s1 ZINC000093807764 1047552322 /nfs/dbraw/zinc/55/23/22/1047552322.db2.gz LETVQDBMVNGIJS-UHFFFAOYSA-N 1 2 316.426 4.092 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cc3cc(OC)ccc3o2)s1 ZINC000093807764 1047552325 /nfs/dbraw/zinc/55/23/25/1047552325.db2.gz LETVQDBMVNGIJS-UHFFFAOYSA-N 1 2 316.426 4.092 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1c(Br)ccc(F)c1F ZINC001143328666 1047553011 /nfs/dbraw/zinc/55/30/11/1047553011.db2.gz JLMXCSQTPYMEAQ-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1c(Br)ccc(F)c1F ZINC001143328666 1047553017 /nfs/dbraw/zinc/55/30/17/1047553017.db2.gz JLMXCSQTPYMEAQ-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO COc1c(F)ccc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c1F ZINC001143318088 1047553028 /nfs/dbraw/zinc/55/30/28/1047553028.db2.gz HPKGHDHIEKQGOS-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c1F ZINC001143318088 1047553034 /nfs/dbraw/zinc/55/30/34/1047553034.db2.gz HPKGHDHIEKQGOS-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1ccn(-c2cccc(F)c2)n1 ZINC000064557223 1047553785 /nfs/dbraw/zinc/55/37/85/1047553785.db2.gz ABLROXZJAAHVEH-ZDUSSCGKSA-N 1 2 315.417 4.266 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccn(-c2cccc(F)c2)n1 ZINC000064557223 1047553787 /nfs/dbraw/zinc/55/37/87/1047553787.db2.gz ABLROXZJAAHVEH-ZDUSSCGKSA-N 1 2 315.417 4.266 20 0 DIADLO Fc1ccc(Br)c(C[N@@H+]2CCCCC23CC3)c1F ZINC001143339253 1047554573 /nfs/dbraw/zinc/55/45/73/1047554573.db2.gz ZPKNSERQCLEDDF-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1ccc(Br)c(C[N@H+]2CCCCC23CC3)c1F ZINC001143339253 1047554577 /nfs/dbraw/zinc/55/45/77/1047554577.db2.gz ZPKNSERQCLEDDF-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO CCC[C@@](C)(CC)C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000476688895 1047565888 /nfs/dbraw/zinc/56/58/88/1047565888.db2.gz ACYOYGVAUQXZOJ-MAUKXSAKSA-N 1 2 322.518 4.170 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[N@H+](C)[C@@H](C)c1ccco1 ZINC000122983425 1047566688 /nfs/dbraw/zinc/56/66/88/1047566688.db2.gz CQEAMEXPORZEPE-AWEZNQCLSA-N 1 2 300.402 4.035 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000122983425 1047566693 /nfs/dbraw/zinc/56/66/93/1047566693.db2.gz CQEAMEXPORZEPE-AWEZNQCLSA-N 1 2 300.402 4.035 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H]3CC[C@@H](c4ccccc4)C3)cc2[nH+]1 ZINC001150106908 1047574011 /nfs/dbraw/zinc/57/40/11/1047574011.db2.gz UAYHOPHTHIGELK-HZPDHXFCSA-N 1 2 319.408 4.394 20 0 DIADLO CC(C)Oc1cc(-c2cccc(-c3c[nH+]cn3C)c2)c(F)cn1 ZINC001206642653 1047603308 /nfs/dbraw/zinc/60/33/08/1047603308.db2.gz BBOHYJATVFWKDV-UHFFFAOYSA-N 1 2 311.360 4.075 20 0 DIADLO COc1cc(Br)cc(Nc2ccc(C)[nH+]c2C)c1 ZINC001203375096 1047605052 /nfs/dbraw/zinc/60/50/52/1047605052.db2.gz SHXZTLOJNMZPPB-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO COc1cccc(Br)c1Nc1ccc(C)[nH+]c1C ZINC001203375821 1047609930 /nfs/dbraw/zinc/60/99/30/1047609930.db2.gz CIHWKHHNXQACLN-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1ccc(Nc2cccc(C(=O)Nc3cccnc3)c2)c(C)[nH+]1 ZINC001203375836 1047610312 /nfs/dbraw/zinc/61/03/12/1047610312.db2.gz CSVSFXSVBKWCIW-UHFFFAOYSA-N 1 2 318.380 4.089 20 0 DIADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1cccc(Cl)c1F ZINC000537705335 1047624732 /nfs/dbraw/zinc/62/47/32/1047624732.db2.gz HJDAEPHPMGTAIJ-UHFFFAOYSA-N 1 2 301.192 4.103 20 0 DIADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1cccc(Cl)c1F ZINC000537705335 1047624734 /nfs/dbraw/zinc/62/47/34/1047624734.db2.gz HJDAEPHPMGTAIJ-UHFFFAOYSA-N 1 2 301.192 4.103 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cccc2sccc21 ZINC001153427422 1047623067 /nfs/dbraw/zinc/62/30/67/1047623067.db2.gz CBNXUPCPCKRZFV-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H](F)c3ccccc3)cc2)[nH+]c1C ZINC001153557528 1047627769 /nfs/dbraw/zinc/62/77/69/1047627769.db2.gz ZCZOCYRNPKJFIX-KRWDZBQOSA-N 1 2 323.371 4.343 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H](C)C3CCCC3)cc2)[nH+]c1C ZINC001153554333 1047627772 /nfs/dbraw/zinc/62/77/72/1047627772.db2.gz BPGZJBLBWCOWLX-LBPRGKRZSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3CC[C@H]4C[C@H]4C3)cc2)[nH+]c1C ZINC001153557334 1047627833 /nfs/dbraw/zinc/62/78/33/1047627833.db2.gz WJUKLFXCLJLXNQ-XHSDSOJGSA-N 1 2 309.413 4.068 20 0 DIADLO CC[C@@H]1CCCC[C@H]1c1noc([C@@H](c2ccccc2)[NH+](C)C)n1 ZINC000566013210 1047639148 /nfs/dbraw/zinc/63/91/48/1047639148.db2.gz IXQJKCCPZWFODU-DJIMGWMZSA-N 1 2 313.445 4.404 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+]2CCC[C@@H](Oc3ccccc3Cl)C2)o1 ZINC000537850784 1047639833 /nfs/dbraw/zinc/63/98/33/1047639833.db2.gz CCKJAMHPNBLLAM-ZIAGYGMSSA-N 1 2 320.820 4.241 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+]2CCC[C@@H](Oc3ccccc3Cl)C2)o1 ZINC000537850784 1047639836 /nfs/dbraw/zinc/63/98/36/1047639836.db2.gz CCKJAMHPNBLLAM-ZIAGYGMSSA-N 1 2 320.820 4.241 20 0 DIADLO CCOC(=O)/C=C/c1ccc[nH+]c1N[C@@H](c1ccccc1)C1CC1 ZINC001154643345 1047653046 /nfs/dbraw/zinc/65/30/46/1047653046.db2.gz XHFMHKAYGLMGPK-HYSAVQALSA-N 1 2 322.408 4.221 20 0 DIADLO Cc1ncc(CNc2cc(C3CCCCC3)[nH+]c(C)n2)s1 ZINC001154798016 1047657277 /nfs/dbraw/zinc/65/72/77/1047657277.db2.gz XWVOKBNAOWXFAQ-UHFFFAOYSA-N 1 2 302.447 4.210 20 0 DIADLO COc1cccc([C@@H](C)[NH2+]Cc2ncc(-c3cccs3)o2)c1 ZINC000538129326 1047660588 /nfs/dbraw/zinc/66/05/88/1047660588.db2.gz SWDRWYDKUQWDAD-GFCCVEGCSA-N 1 2 314.410 4.263 20 0 DIADLO Cc1ccn2c(CNc3cc(C)c4cccc(C)c4[nH+]3)cnc2c1 ZINC001155274022 1047674336 /nfs/dbraw/zinc/67/43/36/1047674336.db2.gz IJTLSCLWPGFCIM-UHFFFAOYSA-N 1 2 316.408 4.420 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@H]2COc3ccc(Cl)cc32)o1 ZINC000538426023 1047677709 /nfs/dbraw/zinc/67/77/09/1047677709.db2.gz UJSWTWPVTBTRGF-DGFSRKRXSA-N 1 2 303.789 4.280 20 0 DIADLO Cc1[nH+]c[nH]c1CNC(=O)c1ccc(-c2cccc(C(C)C)c2)o1 ZINC000538528997 1047685827 /nfs/dbraw/zinc/68/58/27/1047685827.db2.gz MCUVRCKDENQZGL-UHFFFAOYSA-N 1 2 323.396 4.032 20 0 DIADLO CCOC(CCCNc1[nH+]c2ccccc2cc1C)OCC ZINC001155722099 1047687756 /nfs/dbraw/zinc/68/77/56/1047687756.db2.gz NOBOVRCNPKIHOK-UHFFFAOYSA-N 1 2 302.418 4.134 20 0 DIADLO Cc1ccc(Cl)c(CNc2cc(N)cc(Cl)[nH+]2)c1F ZINC001155829514 1047689584 /nfs/dbraw/zinc/68/95/84/1047689584.db2.gz WBAXWPJMVXVTLP-UHFFFAOYSA-N 1 2 300.164 4.030 20 0 DIADLO Oc1cccc(CCNc2[nH+]cccc2OCc2ccccc2)c1 ZINC001155866171 1047690644 /nfs/dbraw/zinc/69/06/44/1047690644.db2.gz LWGCXDAHTSPCAA-UHFFFAOYSA-N 1 2 320.392 4.021 20 0 DIADLO c1ccc2c(c1)OCCC[C@H]2Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000538637926 1047693683 /nfs/dbraw/zinc/69/36/83/1047693683.db2.gz OAVAAOPLGRKBKU-GOSISDBHSA-N 1 2 323.440 4.398 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N(C)CCC(=O)c1cccs1 ZINC001155966126 1047693781 /nfs/dbraw/zinc/69/37/81/1047693781.db2.gz IJXLIJWKXCBUAT-UHFFFAOYSA-N 1 2 310.422 4.314 20 0 DIADLO COc1cc2c(cc1F)C[N@@H+]([C@@H](C)c1ccccc1F)CC2 ZINC000538638484 1047693929 /nfs/dbraw/zinc/69/39/29/1047693929.db2.gz FLHRGJQIDIRDEE-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc2c(cc1F)C[N@H+]([C@@H](C)c1ccccc1F)CC2 ZINC000538638484 1047693932 /nfs/dbraw/zinc/69/39/32/1047693932.db2.gz FLHRGJQIDIRDEE-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1ccc2oc(CNC(=O)Nc3c(C)cc(C)[nH+]c3C)cc2c1 ZINC000667118909 1047694453 /nfs/dbraw/zinc/69/44/53/1047694453.db2.gz BDTCRNSHWFLBFD-UHFFFAOYSA-N 1 2 323.396 4.383 20 0 DIADLO Clc1ccc2c(cc[nH+]c2NC[C@H]2Cc3ccccc3O2)c1 ZINC001155971547 1047694548 /nfs/dbraw/zinc/69/45/48/1047694548.db2.gz WELIPQSHOZSALZ-OAHLLOKOSA-N 1 2 310.784 4.304 20 0 DIADLO FC(F)(F)[C@H](Nc1[nH+]ccc2ccccc21)c1cccnc1 ZINC001156155358 1047702712 /nfs/dbraw/zinc/70/27/12/1047702712.db2.gz LMLWMZRZVXGKDB-CQSZACIVSA-N 1 2 303.287 4.345 20 0 DIADLO Cc1nc(N[C@H](c2cccnc2)C(F)(F)F)cc(C(C)C)[nH+]1 ZINC001156156653 1047702803 /nfs/dbraw/zinc/70/28/03/1047702803.db2.gz SJYMJQJAUYUJIV-CQSZACIVSA-N 1 2 310.323 4.019 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3F)C2)s1 ZINC000538739153 1047704551 /nfs/dbraw/zinc/70/45/51/1047704551.db2.gz RMHXQNLFNZBFBB-KRWDZBQOSA-N 1 2 305.418 4.023 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@H](c3ccccc3F)C2)s1 ZINC000538739153 1047704555 /nfs/dbraw/zinc/70/45/55/1047704555.db2.gz RMHXQNLFNZBFBB-KRWDZBQOSA-N 1 2 305.418 4.023 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2ccc(OCC(C)C)cc2)s1 ZINC000538724747 1047705911 /nfs/dbraw/zinc/70/59/11/1047705911.db2.gz ZSBCVUJTRYSITF-UHFFFAOYSA-N 1 2 318.486 4.372 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2ccc(OCC(C)C)cc2)s1 ZINC000538724747 1047705916 /nfs/dbraw/zinc/70/59/16/1047705916.db2.gz ZSBCVUJTRYSITF-UHFFFAOYSA-N 1 2 318.486 4.372 20 0 DIADLO Cc1ccc(Nc2ccc(OCc3ccncc3)cc2)c(C)[nH+]1 ZINC001203376932 1047708492 /nfs/dbraw/zinc/70/84/92/1047708492.db2.gz XCLXIQLKBBTLNM-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO CCOC(=O)Cc1ccc(Nc2ccc(C)[nH+]c2C)c(Cl)c1 ZINC001203376844 1047708952 /nfs/dbraw/zinc/70/89/52/1047708952.db2.gz ULVFPDNQRHAANX-UHFFFAOYSA-N 1 2 318.804 4.201 20 0 DIADLO C[C@H]1CCCN(c2cc(NCc3ccccc3C3CC3)[nH+]cn2)C1 ZINC001156544865 1047717478 /nfs/dbraw/zinc/71/74/78/1047717478.db2.gz WKYQDZIKDLFJDD-HNNXBMFYSA-N 1 2 322.456 4.202 20 0 DIADLO C[C@H]1CCCN(c2cc(NCc3ccccc3C3CC3)nc[nH+]2)C1 ZINC001156544865 1047717481 /nfs/dbraw/zinc/71/74/81/1047717481.db2.gz WKYQDZIKDLFJDD-HNNXBMFYSA-N 1 2 322.456 4.202 20 0 DIADLO Cc1cc2c(s1)N(c1cc(F)ccn1)c1ccccc1NC2=[NH2+] ZINC001156668806 1047719861 /nfs/dbraw/zinc/71/98/61/1047719861.db2.gz RVNLHMOYPSSOKA-UHFFFAOYSA-N 1 2 324.384 4.411 20 0 DIADLO CSCc1cc[nH+]c(N[C@@H]2C[C@H]2c2ccc(F)c(F)c2)c1 ZINC001157301811 1047739408 /nfs/dbraw/zinc/73/94/08/1047739408.db2.gz SJBWPNQVFUCWHI-SWLSCSKDSA-N 1 2 306.381 4.191 20 0 DIADLO Cc1nc(N(C)[C@H](C)c2ccccc2Cl)c2c([nH+]1)CCC2 ZINC001157367675 1047740824 /nfs/dbraw/zinc/74/08/24/1047740824.db2.gz JCTORCVXOVMWBW-LLVKDONJSA-N 1 2 301.821 4.125 20 0 DIADLO COc1ccc2[nH+]c(NC3(c4ccccn4)CC3)cc(C)c2c1 ZINC001157371721 1047741366 /nfs/dbraw/zinc/74/13/66/1047741366.db2.gz FYRHETRPTYKIKD-UHFFFAOYSA-N 1 2 305.381 4.048 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H](c2ccccn2)C(F)(F)F)c1 ZINC001157687754 1047749919 /nfs/dbraw/zinc/74/99/19/1047749919.db2.gz YOZXHFSCMLGNJN-ZDUSSCGKSA-N 1 2 313.348 4.304 20 0 DIADLO Cc1ccc(Nc2cccc(F)c2OC[C@@H]2CCCO2)c(C)[nH+]1 ZINC001203380076 1047760016 /nfs/dbraw/zinc/76/00/16/1047760016.db2.gz HDOAECNEKSRSPQ-AWEZNQCLSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H](C)c1ccccc1F ZINC000478001804 1047763223 /nfs/dbraw/zinc/76/32/23/1047763223.db2.gz WXKYGKALLFTPNY-ZDUSSCGKSA-N 1 2 323.371 4.266 20 0 DIADLO CC[C@H](C)c1cc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)on1 ZINC000478000360 1047763464 /nfs/dbraw/zinc/76/34/64/1047763464.db2.gz IMNILXRLWWVVIP-NSHDSACASA-N 1 2 324.384 4.139 20 0 DIADLO CCOC(=O)/C=C/c1ccc[nH+]c1NC(C)(C)c1ccc(C)cc1 ZINC001157974462 1047765555 /nfs/dbraw/zinc/76/55/55/1047765555.db2.gz RQHBTNYCEIQHPT-JLHYYAGUSA-N 1 2 324.424 4.314 20 0 DIADLO COc1ncccc1C[NH2+][C@H](C)c1cc(Cl)sc1Cl ZINC000151148521 1047772582 /nfs/dbraw/zinc/77/25/82/1047772582.db2.gz ZMRMFZYVWWXTKW-MRVPVSSYSA-N 1 2 317.241 4.309 20 0 DIADLO COc1ncccc1C[NH2+][C@@H](C)c1cc(Cl)sc1Cl ZINC000151148463 1047772932 /nfs/dbraw/zinc/77/29/32/1047772932.db2.gz ZMRMFZYVWWXTKW-QMMMGPOBSA-N 1 2 317.241 4.309 20 0 DIADLO CCCN(CCC)c1cc(N[C@H]2CCCC(F)(F)C2)[nH+]cn1 ZINC001158335056 1047775411 /nfs/dbraw/zinc/77/54/11/1047775411.db2.gz FVQPABYWXJNAQK-ZDUSSCGKSA-N 1 2 312.408 4.093 20 0 DIADLO CCCN(CCC)c1cc(N[C@H]2CCCC(F)(F)C2)nc[nH+]1 ZINC001158335056 1047775415 /nfs/dbraw/zinc/77/54/15/1047775415.db2.gz FVQPABYWXJNAQK-ZDUSSCGKSA-N 1 2 312.408 4.093 20 0 DIADLO COC(=O)c1ccc2cc[nH+]c(N[C@@H]3CCCC(F)(F)C3)c2c1 ZINC001158332157 1047775438 /nfs/dbraw/zinc/77/54/38/1047775438.db2.gz CNECRYWIAWOXLA-CYBMUJFWSA-N 1 2 320.339 4.011 20 0 DIADLO Fc1ccc2c(c1)[nH]c1nc[nH+]c(N[C@@H]3CCCC(F)(F)C3)c21 ZINC001158339039 1047775972 /nfs/dbraw/zinc/77/59/72/1047775972.db2.gz YCHRZPPQSRHLJV-SNVBAGLBSA-N 1 2 320.318 4.240 20 0 DIADLO COC(OC)c1cc(C)c[nH+]c1N[C@@H]1C[C@H](C)c2ccccc21 ZINC001158471785 1047783337 /nfs/dbraw/zinc/78/33/37/1047783337.db2.gz JACVJKSPCOAENJ-SUMWQHHRSA-N 1 2 312.413 4.342 20 0 DIADLO Cc1c(F)cc[nH+]c1N[C@H](CCO)c1cccc2ccccc21 ZINC001158510048 1047787953 /nfs/dbraw/zinc/78/79/53/1047787953.db2.gz TVRPVBCHVCQPHU-GOSISDBHSA-N 1 2 310.372 4.218 20 0 DIADLO COC(=O)c1ccc([C@H]2CCCN2c2cccc(C3CC3)[nH+]2)cc1 ZINC001158598320 1047789511 /nfs/dbraw/zinc/78/95/11/1047789511.db2.gz NOUQRLURLAARJE-GOSISDBHSA-N 1 2 322.408 4.087 20 0 DIADLO Cc1c(F)cc[nH+]c1N(C)Cc1cccc(OC(F)(F)F)c1 ZINC001158599462 1047789767 /nfs/dbraw/zinc/78/97/67/1047789767.db2.gz PKJOABMJHAQPPA-UHFFFAOYSA-N 1 2 314.282 4.064 20 0 DIADLO Cc1ccc(Nc2c(F)cccc2OC[C@H]2CCCO2)c(C)[nH+]1 ZINC001203380723 1047792636 /nfs/dbraw/zinc/79/26/36/1047792636.db2.gz MQQKAPKSDVJNPN-CQSZACIVSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1cccc2c(C)cc(N[C@H]3CCc4ccccc4[C@H]3O)[nH+]c12 ZINC001158674305 1047793611 /nfs/dbraw/zinc/79/36/11/1047793611.db2.gz FKKSHKJTADYRII-GHTZIAJQSA-N 1 2 318.420 4.312 20 0 DIADLO Oc1cccnc1CNc1cc(SCc2ccccc2)cc[nH+]1 ZINC001158774166 1047798108 /nfs/dbraw/zinc/79/81/08/1047798108.db2.gz KTZMCRADMOTHSH-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO CCOc1ccc[nH+]c1NCc1ccc(-c2ccccn2)cc1 ZINC001158912786 1047804290 /nfs/dbraw/zinc/80/42/90/1047804290.db2.gz VKYICRHZOCIHAP-UHFFFAOYSA-N 1 2 305.381 4.154 20 0 DIADLO CC[C@@H](C)CC(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000478667303 1047806056 /nfs/dbraw/zinc/80/60/56/1047806056.db2.gz JSNBIMRTWNPILE-CQSZACIVSA-N 1 2 311.429 4.261 20 0 DIADLO CSc1cc[nH+]c(NCc2ccccc2-c2cccnc2)c1 ZINC001159108157 1047813635 /nfs/dbraw/zinc/81/36/35/1047813635.db2.gz ZNNHUNQSKDJZFI-UHFFFAOYSA-N 1 2 307.422 4.478 20 0 DIADLO OCc1cccc(Cl)c1Nc1cc[nH+]c2ccc(Cl)cc12 ZINC001159153548 1047816463 /nfs/dbraw/zinc/81/64/63/1047816463.db2.gz CDUOMEVEZLXYKK-UHFFFAOYSA-N 1 2 319.191 4.199 20 0 DIADLO Cc1c(F)cc[nH+]c1NCc1ccc(C2(C(F)(F)F)N=N2)cc1 ZINC001159255872 1047824446 /nfs/dbraw/zinc/82/44/46/1047824446.db2.gz INANQNIHKBCTNZ-UHFFFAOYSA-N 1 2 324.281 4.322 20 0 DIADLO Nc1ccc(Nc2ccc(OCc3ccccc3)c(F)c2)c[nH+]1 ZINC001159280925 1047825460 /nfs/dbraw/zinc/82/54/60/1047825460.db2.gz HRXBLVVAINLJHZ-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO Nc1ccc(Nc2ccc(C(F)(F)F)cc2C(F)(F)F)c[nH+]1 ZINC001159282106 1047825643 /nfs/dbraw/zinc/82/56/43/1047825643.db2.gz NFQCUAZADFMRFX-UHFFFAOYSA-N 1 2 321.224 4.445 20 0 DIADLO Cc1cc(Nc2ccc(N)[nH+]c2)ccc1OCc1ccccc1 ZINC001159280930 1047825966 /nfs/dbraw/zinc/82/59/66/1047825966.db2.gz IACHFIBWDJYOMC-UHFFFAOYSA-N 1 2 305.381 4.295 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H]2CCc3ccc(OC)cc3C2)c1 ZINC001159364447 1047834979 /nfs/dbraw/zinc/83/49/79/1047834979.db2.gz FZEOOKNAYBYQCR-OAHLLOKOSA-N 1 2 314.454 4.172 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@@H](C)c2ccnn2CC2CCC2)c(F)c1 ZINC000927091593 1047838729 /nfs/dbraw/zinc/83/87/29/1047838729.db2.gz AAJFYRQWTIBKII-ZDUSSCGKSA-N 1 2 319.399 4.121 20 0 DIADLO CCC1(CC)CCC[N@H+](Cc2nc(Br)cs2)C1 ZINC001182880708 1047854148 /nfs/dbraw/zinc/85/41/48/1047854148.db2.gz IRLYFOXXTSXFDN-UHFFFAOYSA-N 1 2 317.296 4.308 20 0 DIADLO CCC1(CC)CCC[N@@H+](Cc2nc(Br)cs2)C1 ZINC001182880708 1047854163 /nfs/dbraw/zinc/85/41/63/1047854163.db2.gz IRLYFOXXTSXFDN-UHFFFAOYSA-N 1 2 317.296 4.308 20 0 DIADLO Clc1cc(Nc2ccc(N3CCCC3)cc2)cn2cc[nH+]c12 ZINC001174526252 1047854497 /nfs/dbraw/zinc/85/44/97/1047854497.db2.gz ITWWONRMFOFHFA-UHFFFAOYSA-N 1 2 312.804 4.332 20 0 DIADLO O=c1ccc2cc(Nc3ccc([NH+]4CCCC4)cc3)ccc2o1 ZINC001174527548 1047857291 /nfs/dbraw/zinc/85/72/91/1047857291.db2.gz HJDMAEXZGSTIFB-UHFFFAOYSA-N 1 2 306.365 4.137 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1ccnn1CC1CCC1 ZINC000924719885 1047878110 /nfs/dbraw/zinc/87/81/10/1047878110.db2.gz AXIGSKKNSXTOBR-CHWSQXEVSA-N 1 2 319.399 4.373 20 0 DIADLO CCOC(=O)C[C@H]1CC[C@H](Nc2cc3ccccc3c[nH+]2)CC1 ZINC001159605105 1047881427 /nfs/dbraw/zinc/88/14/27/1047881427.db2.gz JRWPVJQFUMCOGZ-CZIWCDLHSA-N 1 2 312.413 4.159 20 0 DIADLO Cc1cccc2c(C)cc(NCc3cccc4ccnn43)[nH+]c12 ZINC001159612666 1047881487 /nfs/dbraw/zinc/88/14/87/1047881487.db2.gz WCBWYZYRYOAPOB-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1ccnn1CC1CC1 ZINC000667481752 1047883395 /nfs/dbraw/zinc/88/33/95/1047883395.db2.gz GHVDBQOQJXUPFJ-UHFFFAOYSA-N 1 2 309.866 4.030 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1ccnn1CC1CC1 ZINC000667481752 1047883405 /nfs/dbraw/zinc/88/34/05/1047883405.db2.gz GHVDBQOQJXUPFJ-UHFFFAOYSA-N 1 2 309.866 4.030 20 0 DIADLO Cc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)cc(Cl)n1 ZINC001174523247 1047884589 /nfs/dbraw/zinc/88/45/89/1047884589.db2.gz XPPOJYJXALYRKZ-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2ccc(Cl)c(Cl)c2)c[nH+]1 ZINC001197832275 1047884637 /nfs/dbraw/zinc/88/46/37/1047884637.db2.gz PHXOUZMQSNNEFF-UHFFFAOYSA-N 1 2 324.211 4.327 20 0 DIADLO Fc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)cnc1Cl ZINC001174522957 1047885192 /nfs/dbraw/zinc/88/51/92/1047885192.db2.gz SHQYQJLVSRJUSN-UHFFFAOYSA-N 1 2 306.772 4.003 20 0 DIADLO Cn1ncc(C2CCC2)c1C[N@H+](C)Cc1ccc(Cl)s1 ZINC000667481996 1047887163 /nfs/dbraw/zinc/88/71/63/1047887163.db2.gz NZRBDFNNJXBXEL-UHFFFAOYSA-N 1 2 309.866 4.035 20 0 DIADLO Cn1ncc(C2CCC2)c1C[N@@H+](C)Cc1ccc(Cl)s1 ZINC000667481996 1047887178 /nfs/dbraw/zinc/88/71/78/1047887178.db2.gz NZRBDFNNJXBXEL-UHFFFAOYSA-N 1 2 309.866 4.035 20 0 DIADLO c1cc2cc[nH+]cc2c(Nc2ccc(N3CCCCC3)nc2)c1 ZINC001174524827 1047887213 /nfs/dbraw/zinc/88/72/13/1047887213.db2.gz QSOBASXOBGZMFP-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO c1nsc2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc12 ZINC001174523946 1047887409 /nfs/dbraw/zinc/88/74/09/1047887409.db2.gz ZKGBJXHCVIMQIW-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO Cc1nc2c(cccc2Nc2ccc(N3CCCCC3)[nH+]c2)o1 ZINC001174524240 1047888692 /nfs/dbraw/zinc/88/86/92/1047888692.db2.gz JRBSKFHVQJQQDH-UHFFFAOYSA-N 1 2 308.385 4.265 20 0 DIADLO Nc1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)c(Cl)c1 ZINC001174524900 1047888791 /nfs/dbraw/zinc/88/87/91/1047888791.db2.gz UXAMHSXQJDMKHS-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO COc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)ccc1Cl ZINC001174525183 1047889137 /nfs/dbraw/zinc/88/91/37/1047889137.db2.gz YSOOYQBKTMMCNG-UHFFFAOYSA-N 1 2 317.820 4.478 20 0 DIADLO COC(=O)[C@H]([NH2+]CC12CCC(CC1)C2)c1cccc2ccccc21 ZINC001197827921 1047890306 /nfs/dbraw/zinc/89/03/06/1047890306.db2.gz ZKRJAHJNDRWOBX-QOSBUDKSSA-N 1 2 323.436 4.224 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccnn1C1CCC1)c1c(F)cccc1F ZINC000924721626 1047892296 /nfs/dbraw/zinc/89/22/96/1047892296.db2.gz PDRPIYCGGXHPOT-NWDGAFQWSA-N 1 2 305.372 4.298 20 0 DIADLO COc1ccc(Cn2cc(Nc3ccc(C)[nH+]c3C)c(C)n2)cc1 ZINC001174576795 1047892719 /nfs/dbraw/zinc/89/27/19/1047892719.db2.gz NTDCLVZJHZCBSP-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3CCO[C@@H](c4ccccc4)C3)cc21 ZINC000667494761 1047896929 /nfs/dbraw/zinc/89/69/29/1047896929.db2.gz KODPYBXSAMNITG-HXUWFJFHSA-N 1 2 306.409 4.050 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3CCO[C@@H](c4ccccc4)C3)cc21 ZINC000667494761 1047896944 /nfs/dbraw/zinc/89/69/44/1047896944.db2.gz KODPYBXSAMNITG-HXUWFJFHSA-N 1 2 306.409 4.050 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3CCO[C@H](c4ccccc4)C3)cc21 ZINC000667494760 1047897582 /nfs/dbraw/zinc/89/75/82/1047897582.db2.gz KODPYBXSAMNITG-FQEVSTJZSA-N 1 2 306.409 4.050 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3CCO[C@H](c4ccccc4)C3)cc21 ZINC000667494760 1047897598 /nfs/dbraw/zinc/89/75/98/1047897598.db2.gz KODPYBXSAMNITG-FQEVSTJZSA-N 1 2 306.409 4.050 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2cc(Cl)ccc2Cl)c[nH+]1 ZINC001197869928 1047898725 /nfs/dbraw/zinc/89/87/25/1047898725.db2.gz ZRRIJTBCHPUVAQ-UHFFFAOYSA-N 1 2 324.211 4.327 20 0 DIADLO CCn1ccc(C[N@H+]2CC=C(c3ccc(Cl)cc3C)CC2)n1 ZINC001183219692 1047906159 /nfs/dbraw/zinc/90/61/59/1047906159.db2.gz XIULIJVNHQMECA-UHFFFAOYSA-N 1 2 315.848 4.154 20 0 DIADLO CCn1ccc(C[N@@H+]2CC=C(c3ccc(Cl)cc3C)CC2)n1 ZINC001183219692 1047906162 /nfs/dbraw/zinc/90/61/62/1047906162.db2.gz XIULIJVNHQMECA-UHFFFAOYSA-N 1 2 315.848 4.154 20 0 DIADLO Cc1c2ccccc2sc1CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001183241820 1047909362 /nfs/dbraw/zinc/90/93/62/1047909362.db2.gz BQAWZSSBXGIWPD-UHFFFAOYSA-N 1 2 321.405 4.039 20 0 DIADLO CC(C)(C)c1cc2cccnc2c(NCc2ccc[nH+]c2N)c1 ZINC001183248735 1047911106 /nfs/dbraw/zinc/91/11/06/1047911106.db2.gz RDBDHDOMVKSAQA-UHFFFAOYSA-N 1 2 306.413 4.122 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1ccnn1CC1CC1 ZINC000667499812 1047911449 /nfs/dbraw/zinc/91/14/49/1047911449.db2.gz VTSGSGGLBGDUFE-ZDUSSCGKSA-N 1 2 303.837 4.140 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1ccnn1CC1CC1 ZINC000667499812 1047911452 /nfs/dbraw/zinc/91/14/52/1047911452.db2.gz VTSGSGGLBGDUFE-ZDUSSCGKSA-N 1 2 303.837 4.140 20 0 DIADLO CC(=O)Nc1c(C)cc[nH+]c1N[C@@H](c1ccccc1)C(F)(F)F ZINC001159772269 1047919321 /nfs/dbraw/zinc/91/93/21/1047919321.db2.gz IBHJTECUGBFECJ-AWEZNQCLSA-N 1 2 323.318 4.064 20 0 DIADLO CCCC[N@H+](Cc1c(C)oc(C)c1C)Cc1ncc(C)cn1 ZINC001198019999 1047920354 /nfs/dbraw/zinc/92/03/54/1047920354.db2.gz ILTWVBIGVFCXFH-UHFFFAOYSA-N 1 2 301.434 4.106 20 0 DIADLO CCCC[N@@H+](Cc1c(C)oc(C)c1C)Cc1ncc(C)cn1 ZINC001198019999 1047920356 /nfs/dbraw/zinc/92/03/56/1047920356.db2.gz ILTWVBIGVFCXFH-UHFFFAOYSA-N 1 2 301.434 4.106 20 0 DIADLO Cc1cc(N[C@@H](c2ccccc2)C(F)(F)F)nc(C2CC2)[nH+]1 ZINC001159772761 1047920823 /nfs/dbraw/zinc/92/08/23/1047920823.db2.gz OSSVCJJXKUMNQU-AWEZNQCLSA-N 1 2 307.319 4.378 20 0 DIADLO Cc1ccc2c(Nc3cnn([C@H]4CCCCO4)c3)cccc2[nH+]1 ZINC001174605433 1047923135 /nfs/dbraw/zinc/92/31/35/1047923135.db2.gz PTTCCCYHJXVMQM-GOSISDBHSA-N 1 2 308.385 4.182 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cnn([C@H]4CCCCO4)c3)ccc12 ZINC001174604786 1047923230 /nfs/dbraw/zinc/92/32/30/1047923230.db2.gz LWIWQJNJDOODRR-GOSISDBHSA-N 1 2 308.385 4.182 20 0 DIADLO COc1cccc(C[N@@H+]2CCCC[C@@H]2c2cc(C)n[nH]2)c1Cl ZINC001198129944 1047926984 /nfs/dbraw/zinc/92/69/84/1047926984.db2.gz BPGVXGDEWIQMBX-OAHLLOKOSA-N 1 2 319.836 4.107 20 0 DIADLO COc1cccc(C[N@H+]2CCCC[C@@H]2c2cc(C)n[nH]2)c1Cl ZINC001198129944 1047926990 /nfs/dbraw/zinc/92/69/90/1047926990.db2.gz BPGVXGDEWIQMBX-OAHLLOKOSA-N 1 2 319.836 4.107 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H](C)c2cc(OC)cc(OC)c2)c1 ZINC001159815420 1047930015 /nfs/dbraw/zinc/93/00/15/1047930015.db2.gz XMLYKHYWTCKTTQ-LBPRGKRZSA-N 1 2 318.442 4.384 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1ncccc1Cl)CC1CC1 ZINC001174681323 1047932256 /nfs/dbraw/zinc/93/22/56/1047932256.db2.gz VPXHZBYRQXAKPB-UHFFFAOYSA-N 1 2 304.796 4.286 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1ncccc1Cl)CC1CC1 ZINC001174681323 1047932268 /nfs/dbraw/zinc/93/22/68/1047932268.db2.gz VPXHZBYRQXAKPB-UHFFFAOYSA-N 1 2 304.796 4.286 20 0 DIADLO COc1c(F)ccc(F)c1Nc1ccc[nH+]c1N1CCCCC1 ZINC001174660781 1047939143 /nfs/dbraw/zinc/93/91/43/1047939143.db2.gz XWAWSXXZCJLPKB-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO CN(c1ccc(Nc2cccc(F)c2N)c[nH+]1)C1CCCCC1 ZINC001159870477 1047939289 /nfs/dbraw/zinc/93/92/89/1047939289.db2.gz IHVJSZKVAMCYNJ-UHFFFAOYSA-N 1 2 314.408 4.315 20 0 DIADLO CSc1cc[nH+]c(NCCc2ccccc2C(F)(F)F)c1 ZINC001159898138 1047943903 /nfs/dbraw/zinc/94/39/03/1047943903.db2.gz OGEUYVLNELPESJ-UHFFFAOYSA-N 1 2 312.360 4.477 20 0 DIADLO CC(=O)c1ccc([C@H](C)Nc2cc(C)[nH+]c(C(C)(C)C)n2)cc1 ZINC001159911313 1047946455 /nfs/dbraw/zinc/94/64/55/1047946455.db2.gz CFIYEBXHEWOACB-ZDUSSCGKSA-N 1 2 311.429 4.458 20 0 DIADLO Fc1cc2c(cc1Br)CC[N@@H+]([C@@H]1C=CCCC1)C2 ZINC001198311367 1047948506 /nfs/dbraw/zinc/94/85/06/1047948506.db2.gz YDTFQWCNAXBMDN-CYBMUJFWSA-N 1 2 310.210 4.055 20 0 DIADLO Fc1cc2c(cc1Br)CC[N@H+]([C@@H]1C=CCCC1)C2 ZINC001198311367 1047948514 /nfs/dbraw/zinc/94/85/14/1047948514.db2.gz YDTFQWCNAXBMDN-CYBMUJFWSA-N 1 2 310.210 4.055 20 0 DIADLO Fc1cccc(C2CC[NH+](Cc3nc(Cl)cs3)CC2)c1 ZINC001183653137 1047951213 /nfs/dbraw/zinc/95/12/13/1047951213.db2.gz YXLITUDGXAXHKH-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO C[N@H+](Cc1ccno1)Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000072803704 1047956054 /nfs/dbraw/zinc/95/60/54/1047956054.db2.gz WPHPIGDXKFSHMY-UHFFFAOYSA-N 1 2 302.761 4.220 20 0 DIADLO C[N@@H+](Cc1ccno1)Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000072803704 1047956064 /nfs/dbraw/zinc/95/60/64/1047956064.db2.gz WPHPIGDXKFSHMY-UHFFFAOYSA-N 1 2 302.761 4.220 20 0 DIADLO COc1nc(C)cc(C)c1C[N@H+](C)Cc1ccc(Cl)s1 ZINC000553870968 1047958782 /nfs/dbraw/zinc/95/87/82/1047958782.db2.gz YUUNKFMMVYGIMA-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COc1nc(C)cc(C)c1C[N@@H+](C)Cc1ccc(Cl)s1 ZINC000553870968 1047958787 /nfs/dbraw/zinc/95/87/87/1047958787.db2.gz YUUNKFMMVYGIMA-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COC(=O)[C@@H]([NH2+][C@@H](C)C1CCCC1)c1cccc2ccccc21 ZINC001183833469 1047969914 /nfs/dbraw/zinc/96/99/14/1047969914.db2.gz QIRHDCHLDJERNU-LIRRHRJNSA-N 1 2 311.425 4.222 20 0 DIADLO COc1ccc(C(F)(F)F)cc1Nc1ccn2cc[nH+]c2c1 ZINC001174777277 1047970047 /nfs/dbraw/zinc/97/00/47/1047970047.db2.gz WTGFWBHSZGRBSM-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO CC(C)(C)C[N@H+](CC(=O)OC(C)(C)C)Cc1ccc(F)cc1 ZINC001174807431 1047990120 /nfs/dbraw/zinc/99/01/20/1047990120.db2.gz IOBACKMKHJMNSU-UHFFFAOYSA-N 1 2 309.425 4.016 20 0 DIADLO CC(C)(C)C[N@@H+](CC(=O)OC(C)(C)C)Cc1ccc(F)cc1 ZINC001174807431 1047990127 /nfs/dbraw/zinc/99/01/27/1047990127.db2.gz IOBACKMKHJMNSU-UHFFFAOYSA-N 1 2 309.425 4.016 20 0 DIADLO c1cc2c(cccc2CNc2cc(N3CCCCC3)nc[nH+]2)s1 ZINC001160186740 1047992988 /nfs/dbraw/zinc/99/29/88/1047992988.db2.gz GFUGHDCLEYFRAU-UHFFFAOYSA-N 1 2 324.453 4.294 20 0 DIADLO c1cc2c(cccc2CNc2cc(N3CCCCC3)[nH+]cn2)s1 ZINC001160186740 1047993003 /nfs/dbraw/zinc/99/30/03/1047993003.db2.gz GFUGHDCLEYFRAU-UHFFFAOYSA-N 1 2 324.453 4.294 20 0 DIADLO c1cn2cccc(Nc3ccc(Oc4cccnc4)cc3)c2[nH+]1 ZINC001174848071 1047996956 /nfs/dbraw/zinc/99/69/56/1047996956.db2.gz XKDJQWAZXVBYGM-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO c1cn2c(cccc2Nc2ccc(Oc3cccnc3)cc2)[nH+]1 ZINC001174846231 1047997041 /nfs/dbraw/zinc/99/70/41/1047997041.db2.gz AOUQDKVIMGAJRW-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO c1cn(Cc2ccc(Nc3cccc4cccnc43)cc2)c[nH+]1 ZINC001174862739 1048004989 /nfs/dbraw/zinc/00/49/89/1048004989.db2.gz RACNJXQLUPQQGQ-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO Cc1cc(N2CCSCC2)ccc1[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000554087353 1048005643 /nfs/dbraw/zinc/00/56/43/1048005643.db2.gz BUUFCHBGSLPCKV-SJLPKXTDSA-N 1 2 302.487 4.149 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCc2cc(F)cc(F)c2C1 ZINC001198844474 1048009986 /nfs/dbraw/zinc/00/99/86/1048009986.db2.gz MPTXMFZEWNHRPG-UHFFFAOYSA-N 1 2 305.393 4.245 20 0 DIADLO CSc1ccccc1C[N@H+]1CCc2cc(F)cc(F)c2C1 ZINC001198844474 1048010000 /nfs/dbraw/zinc/01/00/00/1048010000.db2.gz MPTXMFZEWNHRPG-UHFFFAOYSA-N 1 2 305.393 4.245 20 0 DIADLO Cc1cccc(C[NH2+][C@H](c2ccccc2)c2ccccn2)c1F ZINC001198917444 1048016074 /nfs/dbraw/zinc/01/60/74/1048016074.db2.gz ARRFTRSWSYIXSO-HXUWFJFHSA-N 1 2 306.384 4.408 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cc(Br)ccc1N ZINC001160278668 1048020729 /nfs/dbraw/zinc/02/07/29/1048020729.db2.gz SXUXSRHVRJHQOK-UHFFFAOYSA-N 1 2 318.218 4.356 20 0 DIADLO Clc1ccc(C[N@@H+]2CCc3nn(-c4ccccc4)cc3C2)cc1 ZINC001203923238 1048022283 /nfs/dbraw/zinc/02/22/83/1048022283.db2.gz JJEAIWLZSXBMNJ-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1ccc(C[N@H+]2CCc3nn(-c4ccccc4)cc3C2)cc1 ZINC001203923238 1048022295 /nfs/dbraw/zinc/02/22/95/1048022295.db2.gz JJEAIWLZSXBMNJ-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Cc1cccc(Nc2ccc(N(C)C3CCCCC3)[nH+]c2)c1N ZINC001160302777 1048026503 /nfs/dbraw/zinc/02/65/03/1048026503.db2.gz KJWAMMRQBLYYPZ-UHFFFAOYSA-N 1 2 310.445 4.485 20 0 DIADLO COc1cc(F)c(Nc2cc(Cl)c3[nH+]ccn3c2)cc1F ZINC001174926301 1048034208 /nfs/dbraw/zinc/03/42/08/1048034208.db2.gz WYTWVBOLDBPRCI-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO CC[C@@H](C)c1ccccc1Nc1ccc(N2CCOCC2)[nH+]c1 ZINC001174974522 1048035837 /nfs/dbraw/zinc/03/58/37/1048035837.db2.gz OHSGCIYBOJVHIB-OAHLLOKOSA-N 1 2 311.429 4.175 20 0 DIADLO Cc1cccc(Nc2ccc(O[C@H]3CC[NH2+]CC3(F)F)cc2)c1 ZINC001160341604 1048038246 /nfs/dbraw/zinc/03/82/46/1048038246.db2.gz UBDVYGRDTOMZMQ-KRWDZBQOSA-N 1 2 318.367 4.115 20 0 DIADLO Cc1cscc1Nc1ccc(O[C@@H]2CC[NH2+]CC2(F)F)cc1 ZINC001160350077 1048039134 /nfs/dbraw/zinc/03/91/34/1048039134.db2.gz KEGPBHSCONHJJT-OAHLLOKOSA-N 1 2 324.396 4.176 20 0 DIADLO COc1c(C)cnc(CNc2[nH+]c3ccccc3n2C(C)C)c1C ZINC001184461446 1048042833 /nfs/dbraw/zinc/04/28/33/1048042833.db2.gz ABVVTCNAIFSOMB-UHFFFAOYSA-N 1 2 324.428 4.250 20 0 DIADLO Nc1ccc[nH+]c1Nc1ccc(F)c(OCc2ccccc2)c1 ZINC001174990025 1048058026 /nfs/dbraw/zinc/05/80/26/1048058026.db2.gz STUOZMNJEUYKQU-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(Nc3ccc(N4CCCCC4)cc3)c12 ZINC001184598327 1048063308 /nfs/dbraw/zinc/06/33/08/1048063308.db2.gz BAMKKLSKGFXQLM-UHFFFAOYSA-N 1 2 321.428 4.254 20 0 DIADLO CCSc1cc[nH+]c(N[C@H](CC(=O)OC)C2CCCCC2)c1 ZINC001160561950 1048065502 /nfs/dbraw/zinc/06/55/02/1048065502.db2.gz OAXCJYVHGDFPNR-OAHLLOKOSA-N 1 2 322.474 4.118 20 0 DIADLO Fc1ccc(Sc2nc3ccccc3n3c[nH+]cc23)c(F)c1 ZINC001184634669 1048070458 /nfs/dbraw/zinc/07/04/58/1048070458.db2.gz UFJJHNRBOAEMDW-UHFFFAOYSA-N 1 2 313.332 4.312 20 0 DIADLO CCOc1ccc(NCc2cc(C)[nH+]c(C)c2)cc1OCC ZINC001199506130 1048071463 /nfs/dbraw/zinc/07/14/63/1048071463.db2.gz RUFIKQJLGZNUBK-UHFFFAOYSA-N 1 2 300.402 4.108 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cn1 ZINC000480169241 1048075629 /nfs/dbraw/zinc/07/56/29/1048075629.db2.gz WVHJYZMZRGFBJG-GHMZBOCLSA-N 1 2 308.784 4.295 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3cc(Cl)nc(C)c3C)c[nH+]c12 ZINC001160686947 1048076861 /nfs/dbraw/zinc/07/68/61/1048076861.db2.gz UIVSLSXPYDDMIG-ZDUSSCGKSA-N 1 2 314.820 4.481 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3cccc(OCC(C)C)n3)c[nH+]c12 ZINC001160686220 1048077089 /nfs/dbraw/zinc/07/70/89/1048077089.db2.gz AJFJIUXCMIFKOT-HNNXBMFYSA-N 1 2 324.428 4.246 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3ccc4ccccc4n3)c[nH+]c12 ZINC001160684044 1048077278 /nfs/dbraw/zinc/07/72/78/1048077278.db2.gz WMLTXXATCCEYHM-AWEZNQCLSA-N 1 2 302.381 4.364 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3nccc4ccsc43)c[nH+]c12 ZINC001160682945 1048078185 /nfs/dbraw/zinc/07/81/85/1048078185.db2.gz IFXLMIABUOCBAY-LBPRGKRZSA-N 1 2 308.410 4.426 20 0 DIADLO CCN(Cc1ccccc1Cl)c1cc(C)[nH+]c(C2CC2)n1 ZINC001184819236 1048095151 /nfs/dbraw/zinc/09/51/51/1048095151.db2.gz CENGTLWTNUXBOM-UHFFFAOYSA-N 1 2 301.821 4.342 20 0 DIADLO COc1ccc(Nc2cccc3[nH+]c(C)cn32)cc1C(F)(F)F ZINC001175069200 1048095851 /nfs/dbraw/zinc/09/58/51/1048095851.db2.gz PLJPCARXNKWVHO-UHFFFAOYSA-N 1 2 321.302 4.414 20 0 DIADLO CCCC1CCC(NC(=O)Nc2ccc3[nH+]c(C)cn3c2)CC1 ZINC001199767824 1048100425 /nfs/dbraw/zinc/10/04/25/1048100425.db2.gz NCLNLCPEWUPDPD-UHFFFAOYSA-N 1 2 314.433 4.123 20 0 DIADLO FC(F)(F)c1cc(Cl)c(Nc2cccc3[nH+]c[nH]c32)cn1 ZINC001213028098 1048101256 /nfs/dbraw/zinc/10/12/56/1048101256.db2.gz HRJIYRDHLNXXFQ-UHFFFAOYSA-N 1 2 312.682 4.374 20 0 DIADLO Cc1cc(Nc2cccc3[nH+]c[nH]c32)n(-c2cccc(C)c2)n1 ZINC001213028559 1048101362 /nfs/dbraw/zinc/10/13/62/1048101362.db2.gz QZMHKRAFFLWWHE-UHFFFAOYSA-N 1 2 303.369 4.109 20 0 DIADLO c1sc(C2CC2)nc1C[NH2+][C@@H](c1ccccc1)[C@H]1CCCO1 ZINC001199783852 1048102120 /nfs/dbraw/zinc/10/21/20/1048102120.db2.gz LSOMWJDPSKQYLV-SJORKVTESA-N 1 2 314.454 4.030 20 0 DIADLO CCOc1ccc(F)c(Nc2ccc[nH+]c2N2CCCC2)c1F ZINC001175036853 1048102452 /nfs/dbraw/zinc/10/24/52/1048102452.db2.gz CEHCKUGEYOUBAG-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO Clc1ccc(-n2nccc2Nc2cccc3[nH+]c[nH]c32)cc1 ZINC001213029012 1048104839 /nfs/dbraw/zinc/10/48/39/1048104839.db2.gz DKZRKPKQEURIDL-UHFFFAOYSA-N 1 2 309.760 4.146 20 0 DIADLO c1c[nH+]c(N2CCCC2)c(Nc2ccc(OCC3CC3)cc2)c1 ZINC001184964509 1048105067 /nfs/dbraw/zinc/10/50/67/1048105067.db2.gz LFWYCHMQXXHKEV-UHFFFAOYSA-N 1 2 309.413 4.214 20 0 DIADLO CC(C)(C)c1ccc(O)c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001184964131 1048106140 /nfs/dbraw/zinc/10/61/40/1048106140.db2.gz GSOCVCISWFJKKD-UHFFFAOYSA-N 1 2 311.429 4.429 20 0 DIADLO COc1cccc(Cl)c1Nc1ccc[nH+]c1N1CCCC1 ZINC001184963892 1048106206 /nfs/dbraw/zinc/10/62/06/1048106206.db2.gz FZUKEIPAJRACCO-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO Cc1cncc2cccc(Nc3ccc[nH+]c3N3CCCC3)c12 ZINC001184965228 1048107450 /nfs/dbraw/zinc/10/74/50/1048107450.db2.gz UQJKMTQBJZOKLP-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO CC(C)OCc1cccc(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001184965527 1048107775 /nfs/dbraw/zinc/10/77/75/1048107775.db2.gz XCIOVDDRKKPZOQ-UHFFFAOYSA-N 1 2 311.429 4.350 20 0 DIADLO Fc1ccc(Nc2ccc[nH+]c2N2CCCC2)c(Cl)c1F ZINC001184965634 1048107929 /nfs/dbraw/zinc/10/79/29/1048107929.db2.gz ZWLGYNOBJGGUJO-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO Fc1cnc2cccc(Nc3ccc[nH+]c3N3CCCC3)c2c1 ZINC001184965217 1048108048 /nfs/dbraw/zinc/10/80/48/1048108048.db2.gz UPAGDWWONORPDV-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO Cc1cc(Nc2ccc[nH+]c2N2CCCC2)cc2scnc21 ZINC001184965458 1048108194 /nfs/dbraw/zinc/10/81/94/1048108194.db2.gz VRVPYQFLYQSTHI-UHFFFAOYSA-N 1 2 310.426 4.344 20 0 DIADLO O=C(c1cccc(C2CCCC2)c1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000667652131 1048111196 /nfs/dbraw/zinc/11/11/96/1048111196.db2.gz TVEVQXIKMXBWTJ-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2ccc(Cl)cn2)[C@H]1c1ccccc1 ZINC000554496254 1048114889 /nfs/dbraw/zinc/11/48/89/1048114889.db2.gz HSUUFFXUIQXSEG-SUMWQHHRSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2ccc(Cl)cn2)[C@H]1c1ccccc1 ZINC000554496254 1048114895 /nfs/dbraw/zinc/11/48/95/1048114895.db2.gz HSUUFFXUIQXSEG-SUMWQHHRSA-N 1 2 318.873 4.414 20 0 DIADLO Fc1cc(Nc2cccc3[nH+]c[nH]c32)ccc1OC(F)(F)F ZINC001213030927 1048115239 /nfs/dbraw/zinc/11/52/39/1048115239.db2.gz YACKJZCPFFTNFH-UHFFFAOYSA-N 1 2 311.238 4.344 20 0 DIADLO CCc1cc(NCc2cccc(OCC(C)C)c2)nc(CC)[nH+]1 ZINC001184998996 1048116191 /nfs/dbraw/zinc/11/61/91/1048116191.db2.gz JXGJKVZCTYROBD-UHFFFAOYSA-N 1 2 313.445 4.248 20 0 DIADLO Fc1ccc(C2=CC[N@H+](Cc3ccc(Cl)cn3)CC2)cc1 ZINC000554497253 1048117036 /nfs/dbraw/zinc/11/70/36/1048117036.db2.gz GIUGFKZCFYBZPS-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Fc1ccc(C2=CC[N@@H+](Cc3ccc(Cl)cn3)CC2)cc1 ZINC000554497253 1048117038 /nfs/dbraw/zinc/11/70/38/1048117038.db2.gz GIUGFKZCFYBZPS-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Fc1ccc(OC(F)(F)F)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213031464 1048117364 /nfs/dbraw/zinc/11/73/64/1048117364.db2.gz AZZHGWDRVICKNY-UHFFFAOYSA-N 1 2 311.238 4.344 20 0 DIADLO Fc1c(Br)cccc1Nc1cccc2[nH+]c[nH]c21 ZINC001213031523 1048119096 /nfs/dbraw/zinc/11/90/96/1048119096.db2.gz DLSXCNTZOUCXMZ-UHFFFAOYSA-N 1 2 306.138 4.208 20 0 DIADLO Clc1ccccc1C1(Nc2[nH+]ccc3ccccc32)COC1 ZINC001161265395 1048119781 /nfs/dbraw/zinc/11/97/81/1048119781.db2.gz JCZRPERIGQAJIH-UHFFFAOYSA-N 1 2 310.784 4.226 20 0 DIADLO Cc1c(C)c(Nc2ccc[nH+]c2N2CCCC2)c(C)c(C)c1N ZINC001185043913 1048123970 /nfs/dbraw/zinc/12/39/70/1048123970.db2.gz QIBZDDIXBMVXSY-UHFFFAOYSA-N 1 2 310.445 4.241 20 0 DIADLO Cc1cc([C@H]([NH2+]Cc2nnc(C(C)(C)C)o2)C2CC2)ccc1F ZINC000776032032 1048124026 /nfs/dbraw/zinc/12/40/26/1048124026.db2.gz OGNLRONCTYDHTD-MRXNPFEDSA-N 1 2 317.408 4.056 20 0 DIADLO COc1ccc(Nc2cccc3[nH+]c[nH]c32)cc1C(F)(F)F ZINC001213032157 1048124715 /nfs/dbraw/zinc/12/47/15/1048124715.db2.gz VWWUIEHXMVMTAW-UHFFFAOYSA-N 1 2 307.275 4.334 20 0 DIADLO Clc1ccc2c(cc[nH+]c2N[C@H]2CCCc3nccnc32)c1 ZINC001161408849 1048127178 /nfs/dbraw/zinc/12/71/78/1048127178.db2.gz YMMVUJWEOZTJSI-HNNXBMFYSA-N 1 2 310.788 4.168 20 0 DIADLO Cc1nc(N[C@H]2CCCc3nccnc32)cc(C2CCCCC2)[nH+]1 ZINC001161409563 1048127525 /nfs/dbraw/zinc/12/75/25/1048127525.db2.gz QODDOAHRERFAFO-INIZCTEOSA-N 1 2 323.444 4.112 20 0 DIADLO Cc1cc(C)n(-c2ccc(Nc3cccc4[nH+]c[nH]c43)cc2)n1 ZINC001213032652 1048128882 /nfs/dbraw/zinc/12/88/82/1048128882.db2.gz QTUWZGNBNGTACR-UHFFFAOYSA-N 1 2 303.369 4.109 20 0 DIADLO Clc1sccc1C[NH2+][C@H]1COc2ccc(Cl)cc21 ZINC000480360440 1048129034 /nfs/dbraw/zinc/12/90/34/1048129034.db2.gz UWBARBNLVLHDOV-NSHDSACASA-N 1 2 300.210 4.278 20 0 DIADLO Cc1cc2ccccc2nc1NCc1c[nH+]cn1CC1CCC1 ZINC001161531714 1048137259 /nfs/dbraw/zinc/13/72/59/1048137259.db2.gz UIYAOCBSANADEX-UHFFFAOYSA-N 1 2 306.413 4.152 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1nc(Cl)cc2ccc(F)cc21 ZINC001161562982 1048138339 /nfs/dbraw/zinc/13/83/39/1048138339.db2.gz LASKLFVBPWYWBG-UHFFFAOYSA-N 1 2 318.783 4.417 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1nccc2c(Cl)cccc21 ZINC001161565958 1048138601 /nfs/dbraw/zinc/13/86/01/1048138601.db2.gz WYHKMCWCISIUMY-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cc(Cl)nc2c(F)cccc12 ZINC001161569612 1048141346 /nfs/dbraw/zinc/14/13/46/1048141346.db2.gz NQLQSDNRUVNRBO-UHFFFAOYSA-N 1 2 318.783 4.417 20 0 DIADLO Cc1ccccc1CNc1[nH]c2ccc(Br)cc2[nH+]1 ZINC001161621150 1048147307 /nfs/dbraw/zinc/14/73/07/1048147307.db2.gz UZTJOGRMKFPGFD-UHFFFAOYSA-N 1 2 316.202 4.246 20 0 DIADLO Cc1ccccc1CNc1[nH]c2cc(Br)ccc2[nH+]1 ZINC001161621150 1048147312 /nfs/dbraw/zinc/14/73/12/1048147312.db2.gz UZTJOGRMKFPGFD-UHFFFAOYSA-N 1 2 316.202 4.246 20 0 DIADLO COc1ccc(C2(CNc3[nH+]c4ccccc4cc3C)CC2)nc1 ZINC001161628731 1048148085 /nfs/dbraw/zinc/14/80/85/1048148085.db2.gz QQCXEGYKFHMEDT-UHFFFAOYSA-N 1 2 319.408 4.091 20 0 DIADLO CSCc1ccc(NCC(C)(C)c2cccc(C)n2)[nH+]c1 ZINC001161644063 1048149344 /nfs/dbraw/zinc/14/93/44/1048149344.db2.gz NSAPJHLDYQZXSA-UHFFFAOYSA-N 1 2 301.459 4.038 20 0 DIADLO O=C(c1cccc(F)c1Nc1cccc2[nH+]c[nH]c21)C(F)(F)F ZINC001213034405 1048151408 /nfs/dbraw/zinc/15/14/08/1048151408.db2.gz HZVFNQKYGPDREJ-UHFFFAOYSA-N 1 2 323.249 4.191 20 0 DIADLO COc1ccc(-c2ccccc2Nc2cccc3[nH+]c[nH]c32)nc1 ZINC001213034536 1048152707 /nfs/dbraw/zinc/15/27/07/1048152707.db2.gz PFXKMTLEOLGTGI-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO CCc1cc(N2CCC[C@@H](Cc3ccccc3)C2)nc(CC)[nH+]1 ZINC001185263966 1048154036 /nfs/dbraw/zinc/15/40/36/1048154036.db2.gz UDLPTKVVQQLVAO-KRWDZBQOSA-N 1 2 309.457 4.061 20 0 DIADLO c1nocc1CCNc1cc(SCc2ccccc2)cc[nH+]1 ZINC001161702256 1048157132 /nfs/dbraw/zinc/15/71/32/1048157132.db2.gz QBRSFLYLCBYHDY-UHFFFAOYSA-N 1 2 311.410 4.017 20 0 DIADLO CC(C)Oc1cc(F)cc(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001175140660 1048163333 /nfs/dbraw/zinc/16/33/33/1048163333.db2.gz SVYNNYLHSJRLRQ-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO Cc1noc(C)c1C[NH+](CC1=CCCC1)Cc1c(C)noc1C ZINC000645805830 1048174298 /nfs/dbraw/zinc/17/42/98/1048174298.db2.gz OWIMKLUABLSZNT-UHFFFAOYSA-N 1 2 315.417 4.009 20 0 DIADLO CCO[C@@H]1C[C@H](Nc2cc(C(C)C)[nH+]c(C(C)C)n2)C12CCC2 ZINC001185421433 1048175586 /nfs/dbraw/zinc/17/55/86/1048175586.db2.gz VOJLXPGPLZXVEG-JKSUJKDBSA-N 1 2 317.477 4.483 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H](c2cncc(F)c2)C2CC2)c1 ZINC001161817150 1048176914 /nfs/dbraw/zinc/17/69/14/1048176914.db2.gz AKSYQXPNWRATSW-MRXNPFEDSA-N 1 2 303.406 4.291 20 0 DIADLO Cc1ccc(C)c(CCNc2cccc(Cc3ccncc3)[nH+]2)c1 ZINC001161830359 1048180439 /nfs/dbraw/zinc/18/04/39/1048180439.db2.gz QTMKJBRJVQAYQP-UHFFFAOYSA-N 1 2 317.436 4.339 20 0 DIADLO CCOc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)cc1C ZINC001175171542 1048181086 /nfs/dbraw/zinc/18/10/86/1048181086.db2.gz VNIRXSSMVGNRLI-UHFFFAOYSA-N 1 2 307.397 4.382 20 0 DIADLO Cc1nc(N[C@@H](c2ccnc(F)c2)C2CC2)cc(C(C)C)[nH+]1 ZINC001161841259 1048182717 /nfs/dbraw/zinc/18/27/17/1048182717.db2.gz NMMDVHYOBCURDG-QGZVFWFLSA-N 1 2 300.381 4.006 20 0 DIADLO Cc1cn2c(cccc2Nc2cccc(O[C@H]3CCCCO3)c2)[nH+]1 ZINC001175183043 1048187185 /nfs/dbraw/zinc/18/71/85/1048187185.db2.gz LSOUDKSUMILHMK-IBGZPJMESA-N 1 2 323.396 4.292 20 0 DIADLO CCOc1cccc(CNc2cc(-c3ccccc3)cc[nH+]2)n1 ZINC001161886510 1048188894 /nfs/dbraw/zinc/18/88/94/1048188894.db2.gz JAPCXRYCUZUKHS-UHFFFAOYSA-N 1 2 305.381 4.154 20 0 DIADLO CCc1cc(N2CC[C@H](c3ccccc3)[C@@H](C)C2)nc(CC)[nH+]1 ZINC001185519090 1048190813 /nfs/dbraw/zinc/19/08/13/1048190813.db2.gz UIXYNPJUNXGEBD-YJBOKZPZSA-N 1 2 309.457 4.231 20 0 DIADLO CC(C)c1cc(N[C@@H](CO)C2CCCCC2)nc(C(C)C)[nH+]1 ZINC001185518554 1048190902 /nfs/dbraw/zinc/19/09/02/1048190902.db2.gz MBHWEIPWTQWOBE-INIZCTEOSA-N 1 2 305.466 4.077 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CCN2c2cc(CC)[nH+]c(C)n2)o1 ZINC001185526381 1048192351 /nfs/dbraw/zinc/19/23/51/1048192351.db2.gz AKAMQJXLHLOTRN-DYVFJYSZSA-N 1 2 313.445 4.480 20 0 DIADLO COc1c(C)[nH+]c(C2CC2)nc1N[C@@H](c1ccccc1)C1CC1 ZINC001161958090 1048199305 /nfs/dbraw/zinc/19/93/05/1048199305.db2.gz IRRYVPQYBVMLEY-INIZCTEOSA-N 1 2 309.413 4.234 20 0 DIADLO Cc1[nH+]c(C(C)(C)C)nc(NCc2nc3ccccc3o2)c1C ZINC001161967873 1048202503 /nfs/dbraw/zinc/20/25/03/1048202503.db2.gz VMTCXPKWSCDGQB-UHFFFAOYSA-N 1 2 310.401 4.144 20 0 DIADLO CCN(CCc1cccs1)c1nc2ccccc2n2c[nH+]cc12 ZINC001185582680 1048205313 /nfs/dbraw/zinc/20/53/13/1048205313.db2.gz FVFCSDFXNMDMMW-UHFFFAOYSA-N 1 2 322.437 4.013 20 0 DIADLO CCCCC[N@H+](Cc1cn(C(C)C)nn1)Cc1ccc(F)cc1 ZINC000554854805 1048209768 /nfs/dbraw/zinc/20/97/68/1048209768.db2.gz YWBMLSRRZNEXLS-UHFFFAOYSA-N 1 2 318.440 4.191 20 0 DIADLO CCCCC[N@@H+](Cc1cn(C(C)C)nn1)Cc1ccc(F)cc1 ZINC000554854805 1048209781 /nfs/dbraw/zinc/20/97/81/1048209781.db2.gz YWBMLSRRZNEXLS-UHFFFAOYSA-N 1 2 318.440 4.191 20 0 DIADLO CCOc1cccc(Nc2ccc(N3CCCCC3)[nH+]c2)c1F ZINC001175234885 1048211985 /nfs/dbraw/zinc/21/19/85/1048211985.db2.gz SDYGYZKEPWTQLC-UHFFFAOYSA-N 1 2 315.392 4.353 20 0 DIADLO CC(C)C[C@@H]1CCCCN1c1nc2ccccc2n2c[nH+]cc12 ZINC001185726788 1048218116 /nfs/dbraw/zinc/21/81/16/1048218116.db2.gz VVMOTISIOCXYJI-HNNXBMFYSA-N 1 2 308.429 4.288 20 0 DIADLO CC1(CNc2cc(N3CCCCC3)nc[nH+]2)CCC(F)(F)CC1 ZINC001162030396 1048218360 /nfs/dbraw/zinc/21/83/60/1048218360.db2.gz GNZCOLDAUNEKGG-UHFFFAOYSA-N 1 2 324.419 4.094 20 0 DIADLO CC1(CNc2cc(N3CCCCC3)[nH+]cn2)CCC(F)(F)CC1 ZINC001162030396 1048218371 /nfs/dbraw/zinc/21/83/71/1048218371.db2.gz GNZCOLDAUNEKGG-UHFFFAOYSA-N 1 2 324.419 4.094 20 0 DIADLO CCOc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(C)c1 ZINC001175244017 1048219239 /nfs/dbraw/zinc/21/92/39/1048219239.db2.gz MMTZXZCWPPKXID-UHFFFAOYSA-N 1 2 307.397 4.382 20 0 DIADLO CC(C)(C)OC(=O)n1ccc2ccc(Nc3ccc(N)[nH+]c3)cc21 ZINC001201285876 1048225664 /nfs/dbraw/zinc/22/56/64/1048225664.db2.gz RJCDJKWOISPZSC-UHFFFAOYSA-N 1 2 324.384 4.145 20 0 DIADLO Cc1ccc(NC(=O)OC(C)(C)C)cc1Nc1ccc(N)[nH+]c1 ZINC001201291158 1048228114 /nfs/dbraw/zinc/22/81/14/1048228114.db2.gz CJEXXPUKMFJJRI-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO CC(C)(C)c1ccc(Nc2ccc(N)[nH+]c2)c(Br)c1 ZINC001201292810 1048228725 /nfs/dbraw/zinc/22/87/25/1048228725.db2.gz STLXFOFHIRFFIO-UHFFFAOYSA-N 1 2 320.234 4.467 20 0 DIADLO Nc1ccc(Nc2cc(-c3cccc(C(F)(F)F)c3)no2)c[nH+]1 ZINC001201272961 1048230631 /nfs/dbraw/zinc/23/06/31/1048230631.db2.gz XBTKXUMUFOBQRA-UHFFFAOYSA-N 1 2 320.274 4.081 20 0 DIADLO Cc1ccc(-n2nc(C(C)(C)C)cc2Nc2ccc(N)[nH+]c2)cc1 ZINC001201275638 1048231047 /nfs/dbraw/zinc/23/10/47/1048231047.db2.gz HHQJUYFVTPPODI-UHFFFAOYSA-N 1 2 321.428 4.199 20 0 DIADLO Nc1ccc(Nc2cc(-c3ccccc3)nn2CC2CCC2)c[nH+]1 ZINC001201278653 1048231582 /nfs/dbraw/zinc/23/15/82/1048231582.db2.gz FHGWUZVNPUEZRX-UHFFFAOYSA-N 1 2 319.412 4.071 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3ccc(F)c4cccnc34)ccc21 ZINC001201308642 1048233851 /nfs/dbraw/zinc/23/38/51/1048233851.db2.gz MLSBRHLXTSLUKX-UHFFFAOYSA-N 1 2 321.399 4.368 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3ccc(F)c4cccnc34)ccc21 ZINC001201308642 1048233863 /nfs/dbraw/zinc/23/38/63/1048233863.db2.gz MLSBRHLXTSLUKX-UHFFFAOYSA-N 1 2 321.399 4.368 20 0 DIADLO Cc1cc(O)c[nH+]c1Nc1ccc(NC(=O)c2ccccc2)cc1 ZINC001201308017 1048234972 /nfs/dbraw/zinc/23/49/72/1048234972.db2.gz YPAJFNQNNDIHLC-UHFFFAOYSA-N 1 2 319.364 4.092 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccccc2OCc2ccccc2)on1 ZINC001175300020 1048239119 /nfs/dbraw/zinc/23/91/19/1048239119.db2.gz BCEHFEFZRUEYPI-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccccc2OCc2ccccc2)on1 ZINC001175300020 1048239123 /nfs/dbraw/zinc/23/91/23/1048239123.db2.gz BCEHFEFZRUEYPI-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO CC(C)OC(=O)c1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001175257989 1048240078 /nfs/dbraw/zinc/24/00/78/1048240078.db2.gz GPGAPPQSIBILRM-UHFFFAOYSA-N 1 2 321.380 4.181 20 0 DIADLO Cc1c(Nc2ccc(-n3cc[nH+]c3)cc2)cnn1-c1ccccc1 ZINC001201370261 1048241109 /nfs/dbraw/zinc/24/11/09/1048241109.db2.gz IRFMFPGGXWGDNB-UHFFFAOYSA-N 1 2 315.380 4.110 20 0 DIADLO Oc1ccc(F)c(Nc2ccc([NH+]3CCCCC3)cc2)c1F ZINC001175268209 1048245429 /nfs/dbraw/zinc/24/54/29/1048245429.db2.gz KDHBSEZSLSWSBK-UHFFFAOYSA-N 1 2 304.340 4.404 20 0 DIADLO CCOc1cc(C)ccc1NCc1cc(-n2cc[nH+]c2)cs1 ZINC001201348010 1048246521 /nfs/dbraw/zinc/24/65/21/1048246521.db2.gz QASINSZYCZGSLV-UHFFFAOYSA-N 1 2 313.426 4.253 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001175267681 1048247326 /nfs/dbraw/zinc/24/73/26/1048247326.db2.gz IPQJFSHJEYJHNI-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001175267681 1048247336 /nfs/dbraw/zinc/24/73/36/1048247336.db2.gz IPQJFSHJEYJHNI-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO CN(C)c1ccc(Nc2ccc(Oc3nccs3)cc2)c[nH+]1 ZINC001175344430 1048249613 /nfs/dbraw/zinc/24/96/13/1048249613.db2.gz ZCEYZUKAUONMSP-UHFFFAOYSA-N 1 2 312.398 4.140 20 0 DIADLO CN(C)c1ccc(Nc2ccccc2Oc2cccnc2)c[nH+]1 ZINC001175343697 1048250106 /nfs/dbraw/zinc/25/01/06/1048250106.db2.gz MBUAFARFTTUGNH-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO Cc1c(Nc2ccc(N(C)C)[nH+]c2)snc1-c1ccccc1 ZINC001175341670 1048250312 /nfs/dbraw/zinc/25/03/12/1048250312.db2.gz MTQWTBVMOROPDL-UHFFFAOYSA-N 1 2 310.426 4.323 20 0 DIADLO CC(=O)c1ccc(C(F)(F)F)cc1Nc1ccc(N(C)C)[nH+]c1 ZINC001175344200 1048250637 /nfs/dbraw/zinc/25/06/37/1048250637.db2.gz ATWOUIWACYXVBI-UHFFFAOYSA-N 1 2 323.318 4.113 20 0 DIADLO Fc1ccc2cc(Nc3ccc(N4CCCC4)[nH+]c3)cnc2c1 ZINC001175347290 1048251481 /nfs/dbraw/zinc/25/14/81/1048251481.db2.gz HAQWNVLITVWZNT-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO Fc1ccc2ncc(Nc3ccc(N4CCCC4)[nH+]c3)cc2c1 ZINC001175347080 1048251891 /nfs/dbraw/zinc/25/18/91/1048251891.db2.gz AHDNQHFTJPNWJI-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO c1ccc(-c2cncc(Nc3ccc(N4CCCC4)[nH+]c3)c2)cc1 ZINC001175347528 1048252993 /nfs/dbraw/zinc/25/29/93/1048252993.db2.gz NQJVJLRXYFHGTB-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(Cl)c(OC(C)C)c1 ZINC001201383637 1048256014 /nfs/dbraw/zinc/25/60/14/1048256014.db2.gz UECAHBZTKMGXKB-UHFFFAOYSA-N 1 2 315.804 4.357 20 0 DIADLO C[C@@]1(O)CC[C@@H](Nc2ccc3c(c2)[nH+]cn3-c2ccccc2)CC1 ZINC001162359713 1048267684 /nfs/dbraw/zinc/26/76/84/1048267684.db2.gz HMYZOOLQMBHGOA-SGNKCFNYSA-N 1 2 321.424 4.131 20 0 DIADLO Brc1sccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175349746 1048271513 /nfs/dbraw/zinc/27/15/13/1048271513.db2.gz DBJWOTSWTIBMAX-UHFFFAOYSA-N 1 2 324.247 4.249 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc(N4CCCC4)nc3)ccc12 ZINC001175351484 1048271546 /nfs/dbraw/zinc/27/15/46/1048271546.db2.gz NNBJJJZLJDLBJS-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO COc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c(Cl)c1 ZINC001175349626 1048272114 /nfs/dbraw/zinc/27/21/14/1048272114.db2.gz BGSHYUOIAGVOOV-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO CC(=O)c1ccc(Cl)c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175350942 1048272200 /nfs/dbraw/zinc/27/22/00/1048272200.db2.gz JVNAFTICRKZURY-UHFFFAOYSA-N 1 2 315.804 4.281 20 0 DIADLO O=C(c1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1)C1CC1 ZINC001175351775 1048272554 /nfs/dbraw/zinc/27/25/54/1048272554.db2.gz BKUILFKDBBPVAP-UHFFFAOYSA-N 1 2 307.397 4.018 20 0 DIADLO Oc1cc(C(F)(F)F)ccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175352855 1048273269 /nfs/dbraw/zinc/27/32/69/1048273269.db2.gz TZLXMUSVSLWPQX-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO C[C@@H]1C[C@H]1c1csc(Cc2[nH+]ccn2Cc2ccccc2)n1 ZINC000899241176 1048278216 /nfs/dbraw/zinc/27/82/16/1048278216.db2.gz KGTKKICPZBSQDE-UKRRQHHQSA-N 1 2 309.438 4.102 20 0 DIADLO Cc1cc(N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)nc(C2CC2)[nH+]1 ZINC001186275108 1048278633 /nfs/dbraw/zinc/27/86/33/1048278633.db2.gz LDDVFQXOAWQTNH-SWLSCSKDSA-N 1 2 317.795 4.423 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cnccc2Br)cc1 ZINC001201488688 1048280677 /nfs/dbraw/zinc/28/06/77/1048280677.db2.gz GKXIOPLFLSLLSS-UHFFFAOYSA-N 1 2 306.207 4.408 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2c3ccccc3oc2C(N)=O)cc1 ZINC001201489864 1048281227 /nfs/dbraw/zinc/28/12/27/1048281227.db2.gz VJMLWHICZMTYFW-UHFFFAOYSA-N 1 2 309.369 4.096 20 0 DIADLO CC(C)[C@H]1CCC[C@@H](Nc2[nH+]cnc3c2cnn3C(C)(C)C)C1 ZINC001162460534 1048282749 /nfs/dbraw/zinc/28/27/49/1048282749.db2.gz MIMNFPUNUFKWIU-UONOGXRCSA-N 1 2 315.465 4.208 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cc(F)c4ccccc4c3)cc2[nH+]1 ZINC000555159784 1048283169 /nfs/dbraw/zinc/28/31/69/1048283169.db2.gz FCEBYORVZLEADU-UHFFFAOYSA-N 1 2 319.339 4.416 20 0 DIADLO C[C@@H]1CCC[C@H](CNc2[nH+]cnc3c2cnn3C(C)(C)C)[C@H]1C ZINC001186303543 1048283579 /nfs/dbraw/zinc/28/35/79/1048283579.db2.gz DPGRVXJVTJFBOH-HZSPNIEDSA-N 1 2 315.465 4.066 20 0 DIADLO Cc1cc(N[C@H](Cc2ccccc2)C2CC2)nc(C2CCC2)[nH+]1 ZINC001162503263 1048287554 /nfs/dbraw/zinc/28/75/54/1048287554.db2.gz XKPZUDCAZFNXJX-GOSISDBHSA-N 1 2 307.441 4.486 20 0 DIADLO CC(C)c1cc(N2CCCCC[C@H]2C[C@@H](C)O)nc(C(C)C)[nH+]1 ZINC001186406841 1048298010 /nfs/dbraw/zinc/29/80/10/1048298010.db2.gz WLXRGUMZMKOFLA-CVEARBPZSA-N 1 2 319.493 4.243 20 0 DIADLO CCCCn1c(S[C@@H](C)CCC)nnc1[C@@H](CC)[NH+](C)C ZINC000481049855 1048300116 /nfs/dbraw/zinc/30/01/16/1048300116.db2.gz AJXWLOCTNFCFNU-UONOGXRCSA-N 1 2 312.527 4.372 20 0 DIADLO CCc1cc(N[C@@H](CC)c2ccc(F)cc2F)nc(CC)[nH+]1 ZINC001162559442 1048303891 /nfs/dbraw/zinc/30/38/91/1048303891.db2.gz HJANZIPZBAUYFU-HNNXBMFYSA-N 1 2 305.372 4.443 20 0 DIADLO CCc1cc(N[C@H](CC)c2ccc(F)cc2F)nc(CC)[nH+]1 ZINC001162559444 1048304240 /nfs/dbraw/zinc/30/42/40/1048304240.db2.gz HJANZIPZBAUYFU-OAHLLOKOSA-N 1 2 305.372 4.443 20 0 DIADLO Cc1nc(NCCc2cc3ccccc3o2)c2c([nH+]1)CCCC2 ZINC001162568930 1048306121 /nfs/dbraw/zinc/30/61/21/1048306121.db2.gz XFIDNLWOTNHQNG-UHFFFAOYSA-N 1 2 307.397 4.065 20 0 DIADLO CCCCOc1ccc(C[N@@H+]2Cc3ccc(OC)cc3C2)cc1 ZINC001203970771 1048307664 /nfs/dbraw/zinc/30/76/64/1048307664.db2.gz SURLCINALICMNS-UHFFFAOYSA-N 1 2 311.425 4.390 20 0 DIADLO CCCCOc1ccc(C[N@H+]2Cc3ccc(OC)cc3C2)cc1 ZINC001203970771 1048307672 /nfs/dbraw/zinc/30/76/72/1048307672.db2.gz SURLCINALICMNS-UHFFFAOYSA-N 1 2 311.425 4.390 20 0 DIADLO Cc1ccc(Nc2[nH+]cnc3[nH]ccc32)cc1OCCC(C)C ZINC001162584153 1048308111 /nfs/dbraw/zinc/30/81/11/1048308111.db2.gz CWDQMCQNQDZGQZ-UHFFFAOYSA-N 1 2 310.401 4.435 20 0 DIADLO C[S@](=O)c1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1 ZINC001175475811 1048316219 /nfs/dbraw/zinc/31/62/19/1048316219.db2.gz IKXNVZMBMSQGMB-QFIPXVFZSA-N 1 2 314.454 4.158 20 0 DIADLO CCc1cc(N2[C@H](C)C[C@H](c3ccccc3)[C@@H]2C)nc(CC)[nH+]1 ZINC001186572204 1048318611 /nfs/dbraw/zinc/31/86/11/1048318611.db2.gz SMQANSRSRBWTKF-VKJFTORMSA-N 1 2 309.457 4.372 20 0 DIADLO COc1cc[nH+]cc1NCc1ccc(N(C)c2ccccc2)cc1 ZINC001201572818 1048322176 /nfs/dbraw/zinc/32/21/76/1048322176.db2.gz AWRREILCWSAYJC-UHFFFAOYSA-N 1 2 319.408 4.470 20 0 DIADLO CCCC[C@@H](CC)C[N@@H+]1Cc2cc(Br)cnc2C1 ZINC001201567986 1048322205 /nfs/dbraw/zinc/32/22/05/1048322205.db2.gz MKXWPXLEFHAKPF-GFCCVEGCSA-N 1 2 311.267 4.376 20 0 DIADLO CCCC[C@@H](CC)C[N@H+]1Cc2cc(Br)cnc2C1 ZINC001201567986 1048322218 /nfs/dbraw/zinc/32/22/18/1048322218.db2.gz MKXWPXLEFHAKPF-GFCCVEGCSA-N 1 2 311.267 4.376 20 0 DIADLO CCSc1cccc(CNc2cc(CC)[nH+]c(CC)n2)c1 ZINC001186633899 1048326974 /nfs/dbraw/zinc/32/69/74/1048326974.db2.gz XTLSODLQWRNYKW-UHFFFAOYSA-N 1 2 301.459 4.326 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@@](F)(c3ccccc3)C2)sc1C ZINC001175492686 1048327118 /nfs/dbraw/zinc/32/71/18/1048327118.db2.gz QMKOZNXPPFHWPG-KRWDZBQOSA-N 1 2 304.434 4.221 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@@](F)(c3ccccc3)C2)sc1C ZINC001175492686 1048327126 /nfs/dbraw/zinc/32/71/26/1048327126.db2.gz QMKOZNXPPFHWPG-KRWDZBQOSA-N 1 2 304.434 4.221 20 0 DIADLO Cc1cc(C)c(Nc2cncc(OCc3ccccc3)c2)c[nH+]1 ZINC001201621246 1048334132 /nfs/dbraw/zinc/33/41/32/1048334132.db2.gz FEKQTLFNXYXHPB-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1cccc(F)c1Cl ZINC000555420972 1048341661 /nfs/dbraw/zinc/34/16/61/1048341661.db2.gz RHONYXJPIMBEDP-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO COC(=O)c1ccc2cc[nH+]c(N[C@H]3CCc4sccc43)c2c1 ZINC001162767384 1048355433 /nfs/dbraw/zinc/35/54/33/1048355433.db2.gz VXPHZSMSSWYCBP-HNNXBMFYSA-N 1 2 324.405 4.182 20 0 DIADLO COC(=O)c1ccc2cc[nH+]c(N[C@@H]3CCc4sccc43)c2c1 ZINC001162767386 1048355645 /nfs/dbraw/zinc/35/56/45/1048355645.db2.gz VXPHZSMSSWYCBP-OAHLLOKOSA-N 1 2 324.405 4.182 20 0 DIADLO CCCc1nc(C[NH2+][C@H](CC)c2ccccc2OC)cs1 ZINC000775062488 1048359615 /nfs/dbraw/zinc/35/96/15/1048359615.db2.gz BPRNGFQTSTXXJJ-OAHLLOKOSA-N 1 2 304.459 4.345 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccccc1OC ZINC000775076144 1048367632 /nfs/dbraw/zinc/36/76/32/1048367632.db2.gz SOYVCGJPBZSYHG-CQSZACIVSA-N 1 2 302.418 4.222 20 0 DIADLO CNc1ccc(Nc2ccc(-c3ccc(Cl)s3)nn2)c[nH+]1 ZINC001162832499 1048370909 /nfs/dbraw/zinc/37/09/09/1048370909.db2.gz BSYZHOQYCAVTJD-UHFFFAOYSA-N 1 2 317.805 4.039 20 0 DIADLO Cc1c[nH+]cc(NCc2ccc(C(=O)OC(C)(C)C)cc2)c1C ZINC001162839666 1048372959 /nfs/dbraw/zinc/37/29/59/1048372959.db2.gz LVBBUIMPZGOPCZ-UHFFFAOYSA-N 1 2 312.413 4.266 20 0 DIADLO COc1ccccc1Cn1nc(C)cc1Nc1cc(C)c[nH+]c1C ZINC001203654658 1048373066 /nfs/dbraw/zinc/37/30/66/1048373066.db2.gz PBXGDVLPIMNFAK-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1cc(Oc2ccc(Nc3ccc(CO)cc3)cc2)cc[nH+]1 ZINC001175568260 1048373773 /nfs/dbraw/zinc/37/37/73/1048373773.db2.gz BHKIQLXRTOXVTR-UHFFFAOYSA-N 1 2 306.365 4.418 20 0 DIADLO Cc1cc(F)c(C[NH2+]Cc2cccc(OC(C)(C)C)n2)c(F)c1 ZINC001201814856 1048376992 /nfs/dbraw/zinc/37/69/92/1048376992.db2.gz OQCORBVWCRYAEE-UHFFFAOYSA-N 1 2 320.383 4.135 20 0 DIADLO C[C@@H](Nc1cc(N)cc(Cl)[nH+]1)c1cccc(F)c1Cl ZINC001162891131 1048377618 /nfs/dbraw/zinc/37/76/18/1048377618.db2.gz FCRSTNNLXDRKBX-SSDOTTSWSA-N 1 2 300.164 4.283 20 0 DIADLO CCC(C)(C)c1ccc(COC(=O)CCCn2cc[nH+]c2)cc1 ZINC000776216390 1048385997 /nfs/dbraw/zinc/38/59/97/1048385997.db2.gz RBFDBQUYCRIOMZ-UHFFFAOYSA-N 1 2 314.429 4.094 20 0 DIADLO Cc1cc(N[C@@H]2CCO[C@H](CC(C)C)C2)nc(C2CCC2)[nH+]1 ZINC001162921633 1048388140 /nfs/dbraw/zinc/38/81/40/1048388140.db2.gz IRKKMPDZSGSNIL-HZPDHXFCSA-N 1 2 303.450 4.058 20 0 DIADLO Cc1ccc2c(Nc3ccc(C(=O)NC4CC4)cc3)cccc2[nH+]1 ZINC001175607626 1048392165 /nfs/dbraw/zinc/39/21/65/1048392165.db2.gz NEGNGKFVFMERLH-UHFFFAOYSA-N 1 2 317.392 4.179 20 0 DIADLO CCC[N@H+](Cc1ncc(Cl)s1)[C@@H]1CCCc2cccnc21 ZINC000481430726 1048400121 /nfs/dbraw/zinc/40/01/21/1048400121.db2.gz CFXKPBKABZLQJW-CYBMUJFWSA-N 1 2 321.877 4.481 20 0 DIADLO CCC[N@@H+](Cc1ncc(Cl)s1)[C@@H]1CCCc2cccnc21 ZINC000481430726 1048400131 /nfs/dbraw/zinc/40/01/31/1048400131.db2.gz CFXKPBKABZLQJW-CYBMUJFWSA-N 1 2 321.877 4.481 20 0 DIADLO CC(C)c1ccc(CN2CC[NH+]([C@@H](C)c3ccccn3)CC2)cc1 ZINC000555605882 1048404876 /nfs/dbraw/zinc/40/48/76/1048404876.db2.gz SXWSKAIUNQILSR-SFHVURJKSA-N 1 2 323.484 4.084 20 0 DIADLO Cc1c(Cl)cccc1C[NH2+][C@@H]1c2ccccc2OC[C@H]1F ZINC001203665364 1048416703 /nfs/dbraw/zinc/41/67/03/1048416703.db2.gz MSMCLASKBXFYND-NVXWUHKLSA-N 1 2 305.780 4.210 20 0 DIADLO CCc1ccccc1NC(=O)Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001187636347 1048418321 /nfs/dbraw/zinc/41/83/21/1048418321.db2.gz MSJGHNGNLUFYQE-UHFFFAOYSA-N 1 2 320.396 4.138 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc(F)cc(Cl)c2)c[nH+]1 ZINC001175712701 1048418658 /nfs/dbraw/zinc/41/86/58/1048418658.db2.gz HMUXVDSADHLQFC-UHFFFAOYSA-N 1 2 305.662 4.219 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc(C(F)(F)F)c2)c[nH+]1 ZINC001175712837 1048418863 /nfs/dbraw/zinc/41/88/63/1048418863.db2.gz UDYZVMRHCJYWHN-UHFFFAOYSA-N 1 2 321.224 4.445 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(-c3cnco3)cc2)c[nH+]1 ZINC001175713255 1048419282 /nfs/dbraw/zinc/41/92/82/1048419282.db2.gz YUHQMIWQUQDLAJ-UHFFFAOYSA-N 1 2 320.274 4.081 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccccc2OC(F)F)c[nH+]1 ZINC001175712699 1048419513 /nfs/dbraw/zinc/41/95/13/1048419513.db2.gz HKUNOSLDQGKVHS-UHFFFAOYSA-N 1 2 319.233 4.028 20 0 DIADLO CCc1ccccc1NC(=O)N[C@@H](C)c1c[nH+]c2c(C)cccn12 ZINC001187656203 1048419688 /nfs/dbraw/zinc/41/96/88/1048419688.db2.gz MWHLKLDTYFDHHH-AWEZNQCLSA-N 1 2 322.412 4.088 20 0 DIADLO Clc1cccc2nc(NCc3ccc4[nH+]ccn4c3)ccc12 ZINC001163139653 1048420455 /nfs/dbraw/zinc/42/04/55/1048420455.db2.gz UFYYOPJMEOZRGB-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2c(F)cc(Cl)cc2F)c[nH+]1 ZINC001175714328 1048421098 /nfs/dbraw/zinc/42/10/98/1048421098.db2.gz MZYZCEJVLXCFBU-UHFFFAOYSA-N 1 2 323.652 4.358 20 0 DIADLO Clc1ccc2c(ccnc2NCc2ccc3[nH+]ccn3c2)c1 ZINC001163136487 1048421450 /nfs/dbraw/zinc/42/14/50/1048421450.db2.gz IKAOYMSTJFDPEB-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO COc1ccc2[nH+]c(N[C@H]3CCCc4ccncc43)c(C)cc2c1 ZINC001163161103 1048423988 /nfs/dbraw/zinc/42/39/88/1048423988.db2.gz CDQGJTWAVIKSQD-IBGZPJMESA-N 1 2 319.408 4.436 20 0 DIADLO CCc1cc(N2CCC[C@H]2[C@@H](C)c2ccccc2)nc(CC)[nH+]1 ZINC001187686087 1048426361 /nfs/dbraw/zinc/42/63/61/1048426361.db2.gz JACYIHIUHSURLF-YJBOKZPZSA-N 1 2 309.457 4.374 20 0 DIADLO C[C@@H]1CCC[C@H](CNc2nc3ccccc3n3c[nH+]cc23)[C@H]1C ZINC001163184771 1048429864 /nfs/dbraw/zinc/42/98/64/1048429864.db2.gz IZIRYESMAGVXJN-QLFBSQMISA-N 1 2 308.429 4.367 20 0 DIADLO CCOC(=O)c1ccc2ccc(Nc3cc(C)c[nH+]c3C)cc2n1 ZINC001203666710 1048432265 /nfs/dbraw/zinc/43/22/65/1048432265.db2.gz CDIZRVUZTTZEGF-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)Nc1ccc(Cl)cc1Cl ZINC001202072706 1048432480 /nfs/dbraw/zinc/43/24/80/1048432480.db2.gz YTIYSAGHLLPDDJ-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc(-c3ccccc3)no2)c[nH+]1 ZINC001175710077 1048437825 /nfs/dbraw/zinc/43/78/25/1048437825.db2.gz RUUGHUIBXZOTBL-UHFFFAOYSA-N 1 2 320.274 4.081 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cnc3ccsc3c2)c[nH+]1 ZINC001175710885 1048438063 /nfs/dbraw/zinc/43/80/63/1048438063.db2.gz MWWSTAYVSNKGPJ-UHFFFAOYSA-N 1 2 310.304 4.036 20 0 DIADLO CC(C)(C)c1cc(Nc2c[nH+]c(N)cc2C(F)(F)F)sn1 ZINC001175710863 1048438147 /nfs/dbraw/zinc/43/81/47/1048438147.db2.gz LZTKGNPUHSOSDF-UHFFFAOYSA-N 1 2 316.352 4.180 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)Nc1c(Cl)cccc1Cl ZINC001202090671 1048448166 /nfs/dbraw/zinc/44/81/66/1048448166.db2.gz PUOLQIYMRUOKAW-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO COc1cccc([C@H]2C[C@H](Nc3nc(C)[nH+]c4c3CCCC4)C2)c1 ZINC001163298970 1048448478 /nfs/dbraw/zinc/44/84/78/1048448478.db2.gz MAZRAYDFUMBOFS-WKILWMFISA-N 1 2 323.440 4.031 20 0 DIADLO Fc1ccc2oc(C[NH2+]C3(c4ccc(Cl)cc4)CC3)nc2c1 ZINC000557539651 1048452041 /nfs/dbraw/zinc/45/20/41/1048452041.db2.gz POXYJCITAQJQBC-UHFFFAOYSA-N 1 2 316.763 4.399 20 0 DIADLO Cc1ncsc1CCNc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC001163335142 1048455676 /nfs/dbraw/zinc/45/56/76/1048455676.db2.gz REPCNXXHWHEKJO-UHFFFAOYSA-N 1 2 304.463 4.143 20 0 DIADLO COc1c(F)cccc1[C@H](C)Nc1cc(C)[nH+]c(C(C)(C)C)n1 ZINC001163340825 1048457477 /nfs/dbraw/zinc/45/74/77/1048457477.db2.gz MTMAWXXXOXQTGX-LBPRGKRZSA-N 1 2 317.408 4.403 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2Cl)c(F)c1 ZINC000481719028 1048464149 /nfs/dbraw/zinc/46/41/49/1048464149.db2.gz OTQCYZSYIGXXOZ-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO c1nn(C2CCCCC2)cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175878865 1048469097 /nfs/dbraw/zinc/46/90/97/1048469097.db2.gz MKWVPSAFXLRGLE-UHFFFAOYSA-N 1 2 311.433 4.127 20 0 DIADLO c1cncc(-c2ccc(Nc3[nH+]cccc3N3CCCC3)cc2)c1 ZINC001175887036 1048473903 /nfs/dbraw/zinc/47/39/03/1048473903.db2.gz XDCXDRIQXORDKQ-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO CCc1noc([C@H](C)[N@H+]2CC=C(c3cccc(Cl)c3)CC2)n1 ZINC000481756603 1048476828 /nfs/dbraw/zinc/47/68/28/1048476828.db2.gz NBUJSDHAKLCTBK-LBPRGKRZSA-N 1 2 317.820 4.136 20 0 DIADLO CCc1noc([C@H](C)[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)n1 ZINC000481756603 1048476831 /nfs/dbraw/zinc/47/68/31/1048476831.db2.gz NBUJSDHAKLCTBK-LBPRGKRZSA-N 1 2 317.820 4.136 20 0 DIADLO Cc1cccc(C)c1NC(=O)Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001202205888 1048482303 /nfs/dbraw/zinc/48/23/03/1048482303.db2.gz HHPUMISAVDXHBN-UHFFFAOYSA-N 1 2 320.396 4.192 20 0 DIADLO COc1cc2ccc(N3[C@@H](C)CCC[C@@H]3C)[nH+]c2cc1OC ZINC001163544185 1048485802 /nfs/dbraw/zinc/48/58/02/1048485802.db2.gz DCTDLQAOPHOROK-STQMWFEESA-N 1 2 300.402 4.019 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@@H](C(F)(F)F)CC1 ZINC001175873068 1048486489 /nfs/dbraw/zinc/48/64/89/1048486489.db2.gz MCNVJDSYTZHWQQ-UONOGXRCSA-N 1 2 323.305 4.069 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@H+]1CCO[C@@H](C(F)(F)F)CC1 ZINC001175873068 1048486494 /nfs/dbraw/zinc/48/64/94/1048486494.db2.gz MCNVJDSYTZHWQQ-UONOGXRCSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@H]1Cc2cc(Br)ccc2C[N@@H+]1CCC(F)(F)F ZINC001202368321 1048535098 /nfs/dbraw/zinc/53/50/98/1048535098.db2.gz NCUYUQYJMAXVAR-VIFPVBQESA-N 1 2 322.168 4.148 20 0 DIADLO C[C@H]1Cc2cc(Br)ccc2C[N@H+]1CCC(F)(F)F ZINC001202368321 1048535110 /nfs/dbraw/zinc/53/51/10/1048535110.db2.gz NCUYUQYJMAXVAR-VIFPVBQESA-N 1 2 322.168 4.148 20 0 DIADLO Oc1cccc(CCNc2cc[nH+]c(OCc3ccccc3)c2)c1 ZINC001163698595 1048507826 /nfs/dbraw/zinc/50/78/26/1048507826.db2.gz QQCXWYAXCRQHBN-UHFFFAOYSA-N 1 2 320.392 4.021 20 0 DIADLO Cc1nc(N2CC3(C2)CC(F)(F)C3)cc(C2CCCCC2)[nH+]1 ZINC001163747006 1048515808 /nfs/dbraw/zinc/51/58/08/1048515808.db2.gz GKCNFJXDOLISDX-UHFFFAOYSA-N 1 2 307.388 4.068 20 0 DIADLO COc1ccc(Nc2cc[nH+]c3cc(Cl)ccc23)cc1CO ZINC001175979334 1048516121 /nfs/dbraw/zinc/51/61/21/1048516121.db2.gz KCMHJGQUMBYUHP-UHFFFAOYSA-N 1 2 314.772 4.133 20 0 DIADLO c1cn(-c2ccc(CSc3nncc4ccccc43)cc2)c[nH+]1 ZINC001188598854 1048525070 /nfs/dbraw/zinc/52/50/70/1048525070.db2.gz DARNUSNXKYPZKT-UHFFFAOYSA-N 1 2 318.405 4.108 20 0 DIADLO CC(C)c1cc(NCC2(O)CCC(C)CC2)nc(C(C)C)[nH+]1 ZINC001163818786 1048530097 /nfs/dbraw/zinc/53/00/97/1048530097.db2.gz ZOVYPPMIPDWEAD-UHFFFAOYSA-N 1 2 305.466 4.077 20 0 DIADLO CC[NH+](CC)[C@H](CN[C@H](C)c1ccc(F)cc1F)c1ccco1 ZINC000481944129 1048531662 /nfs/dbraw/zinc/53/16/62/1048531662.db2.gz GVFZYJZEESTKFY-CXAGYDPISA-N 1 2 322.399 4.292 20 0 DIADLO FC(F)Oc1ccccc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001176011083 1048531586 /nfs/dbraw/zinc/53/15/86/1048531586.db2.gz KSBNYOFBGCGVKY-UHFFFAOYSA-N 1 2 301.296 4.217 20 0 DIADLO FC(F)Oc1ccccc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001176012167 1048533150 /nfs/dbraw/zinc/53/31/50/1048533150.db2.gz UBTUOWWFJAKJFS-UHFFFAOYSA-N 1 2 301.296 4.217 20 0 DIADLO Cc1c(Cl)ncnc1NC(=[NH2+])C12CC3CC(CC(C3)C1)C2 ZINC001163839855 1048534422 /nfs/dbraw/zinc/53/44/22/1048534422.db2.gz QWDCHONQMFUAIQ-UHFFFAOYSA-N 1 2 304.825 4.044 20 0 DIADLO O=C(NCc1c[nH+]cn1C1CCC1)Nc1ccc2ccccc2c1 ZINC001188627758 1048537483 /nfs/dbraw/zinc/53/74/83/1048537483.db2.gz YQZBJRKOGUCQQK-UHFFFAOYSA-N 1 2 320.396 4.083 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2ccccc2OC(C)C)[nH]c1C ZINC001176076961 1048547032 /nfs/dbraw/zinc/54/70/32/1048547032.db2.gz IQRBFIYNBBLMNR-QGZVFWFLSA-N 1 2 313.445 4.151 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2ccccc2OC(C)C)[nH]c1C ZINC001176076961 1048547043 /nfs/dbraw/zinc/54/70/43/1048547043.db2.gz IQRBFIYNBBLMNR-QGZVFWFLSA-N 1 2 313.445 4.151 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2Cc2ccccc2OC(C)C)[nH+]c1C ZINC001176076961 1048547055 /nfs/dbraw/zinc/54/70/55/1048547055.db2.gz IQRBFIYNBBLMNR-QGZVFWFLSA-N 1 2 313.445 4.151 20 0 DIADLO CCCCCC(C)(C)CNC(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001202396462 1048548757 /nfs/dbraw/zinc/54/87/57/1048548757.db2.gz QDUQYAGVGSRCOL-UHFFFAOYSA-N 1 2 320.481 4.184 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cc(C(=O)N(C)C)ccc3F)ccc12 ZINC001176048514 1048554233 /nfs/dbraw/zinc/55/42/33/1048554233.db2.gz ACWVGHHAAOXNEU-UHFFFAOYSA-N 1 2 323.371 4.128 20 0 DIADLO Clc1cc(C[N@@H+]2Cc3ccccc3OC3(CCC3)C2)ccn1 ZINC001176053517 1048555409 /nfs/dbraw/zinc/55/54/09/1048555409.db2.gz XIEFXZNZQRAEAQ-UHFFFAOYSA-N 1 2 314.816 4.052 20 0 DIADLO Clc1cc(C[N@H+]2Cc3ccccc3OC3(CCC3)C2)ccn1 ZINC001176053517 1048555419 /nfs/dbraw/zinc/55/54/19/1048555419.db2.gz XIEFXZNZQRAEAQ-UHFFFAOYSA-N 1 2 314.816 4.052 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(NCc2cc3ccccc3n2C)c1 ZINC001163946937 1048555595 /nfs/dbraw/zinc/55/55/95/1048555595.db2.gz QQFPIUMVAHRCHL-UHFFFAOYSA-N 1 2 316.408 4.191 20 0 DIADLO COc1ccc(C)cc1C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000066236431 1048556801 /nfs/dbraw/zinc/55/68/01/1048556801.db2.gz KUTMLOHAPLSFKM-FQEVSTJZSA-N 1 2 307.393 4.476 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667986098 1048558838 /nfs/dbraw/zinc/55/88/38/1048558838.db2.gz PZYYCVFCCVWILQ-XHDPSFHLSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667986098 1048558848 /nfs/dbraw/zinc/55/88/48/1048558848.db2.gz PZYYCVFCCVWILQ-XHDPSFHLSA-N 1 2 306.331 4.082 20 0 DIADLO COc1cccc2[nH]c(Nc3ccc(Cn4cc[nH+]c4)cc3)cc21 ZINC001176062992 1048558967 /nfs/dbraw/zinc/55/89/67/1048558967.db2.gz BEVPNUOFRUNUSG-UHFFFAOYSA-N 1 2 318.380 4.165 20 0 DIADLO COc1cccc2[nH]c(Nc3cccc(-n4cc[nH+]c4)c3)cc21 ZINC001176064600 1048559793 /nfs/dbraw/zinc/55/97/93/1048559793.db2.gz UJFCQBDHLNZVTA-UHFFFAOYSA-N 1 2 304.353 4.106 20 0 DIADLO Cc1ccc(C[N@@H+](CCCC(C)C)Cc2ncc(C)cn2)o1 ZINC001176138368 1048562161 /nfs/dbraw/zinc/56/21/61/1048562161.db2.gz URIWVABMXVUQTN-UHFFFAOYSA-N 1 2 301.434 4.125 20 0 DIADLO Cc1ccc(C[N@H+](CCCC(C)C)Cc2ncc(C)cn2)o1 ZINC001176138368 1048562172 /nfs/dbraw/zinc/56/21/72/1048562172.db2.gz URIWVABMXVUQTN-UHFFFAOYSA-N 1 2 301.434 4.125 20 0 DIADLO Cc1cc(NCc2cc(O)ccc2Cl)nc(C2CCC2)[nH+]1 ZINC001164016792 1048570329 /nfs/dbraw/zinc/57/03/29/1048570329.db2.gz ZZRZNUCQNMZBCC-UHFFFAOYSA-N 1 2 303.793 4.024 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(-c2ccccc2)nn1C(C)C ZINC001176119611 1048573527 /nfs/dbraw/zinc/57/35/27/1048573527.db2.gz WEMYLQQJRQHVOR-UHFFFAOYSA-N 1 2 308.385 4.278 20 0 DIADLO COc1cc[nH+]cc1Nc1c(Cl)cc(Cl)nc1Cl ZINC001176118357 1048573718 /nfs/dbraw/zinc/57/37/18/1048573718.db2.gz GUAYGAIDJHXKIE-UHFFFAOYSA-N 1 2 304.564 4.189 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(Cl)c(Cl)c(Cl)c1O ZINC001176123694 1048575844 /nfs/dbraw/zinc/57/58/44/1048575844.db2.gz DZJOSTUDODBZKR-UHFFFAOYSA-N 1 2 319.575 4.500 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(C(F)(F)F)cc2ncccc21 ZINC001176123062 1048576678 /nfs/dbraw/zinc/57/66/78/1048576678.db2.gz ICPUNGAZLHBJSJ-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO FC(F)C[N@H+](CCCOc1cccc(Cl)c1)C1CCC1 ZINC001176193239 1048589289 /nfs/dbraw/zinc/58/92/89/1048589289.db2.gz NRSLRRCRRJDVPE-UHFFFAOYSA-N 1 2 303.780 4.229 20 0 DIADLO FC(F)C[N@@H+](CCCOc1cccc(Cl)c1)C1CCC1 ZINC001176193239 1048589306 /nfs/dbraw/zinc/58/93/06/1048589306.db2.gz NRSLRRCRRJDVPE-UHFFFAOYSA-N 1 2 303.780 4.229 20 0 DIADLO CC[N@H+](Cc1ccc2[nH]cnc2c1)Cc1c(F)cccc1Cl ZINC001137049104 1048580743 /nfs/dbraw/zinc/58/07/43/1048580743.db2.gz ZFAHWFJJMLVQRF-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO CC[N@@H+](Cc1ccc2[nH]cnc2c1)Cc1c(F)cccc1Cl ZINC001137049104 1048580757 /nfs/dbraw/zinc/58/07/57/1048580757.db2.gz ZFAHWFJJMLVQRF-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO COc1ccc2[nH+]c(N3CC[C@@H](C)C(F)(F)CC3)cc(C)c2c1 ZINC001164115715 1048586642 /nfs/dbraw/zinc/58/66/42/1048586642.db2.gz VUIWHVDUJCSODJ-CYBMUJFWSA-N 1 2 320.383 4.423 20 0 DIADLO Fc1ccc(C[NH2+]Cc2cccc(C(F)(F)F)n2)c(Cl)c1 ZINC001202474552 1048587900 /nfs/dbraw/zinc/58/79/00/1048587900.db2.gz FQAUJNKZKLSHTC-UHFFFAOYSA-N 1 2 318.701 4.183 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(OCOC)c(F)c2)cc1 ZINC001176193542 1048589716 /nfs/dbraw/zinc/58/97/16/1048589716.db2.gz BFRRRFGHTMJHAL-UHFFFAOYSA-N 1 2 304.365 4.008 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(OCOC)c(F)c2)cc1 ZINC001176193542 1048589731 /nfs/dbraw/zinc/58/97/31/1048589731.db2.gz BFRRRFGHTMJHAL-UHFFFAOYSA-N 1 2 304.365 4.008 20 0 DIADLO COCOc1ccc(Nc2ccc3c(C)cc[nH+]c3c2)cc1F ZINC001176191075 1048590635 /nfs/dbraw/zinc/59/06/35/1048590635.db2.gz SNNBGFPTNIUCTP-UHFFFAOYSA-N 1 2 312.344 4.409 20 0 DIADLO CNc1ccc(CNc2cc[nH+]c(OCc3ccccc3)c2)cc1 ZINC001164152473 1048595683 /nfs/dbraw/zinc/59/56/83/1048595683.db2.gz KFXNOLVDPJQARO-UHFFFAOYSA-N 1 2 319.408 4.314 20 0 DIADLO Cc1cc(N(C)Cc2cnc(Cl)s2)[nH+]c2ccccc12 ZINC001164168995 1048597858 /nfs/dbraw/zinc/59/78/58/1048597858.db2.gz SKAMCEPWFSLFSC-UHFFFAOYSA-N 1 2 303.818 4.290 20 0 DIADLO CCCCc1nc(N[C@@H](c2cccnc2)C(F)(F)F)cc(C)[nH+]1 ZINC001164180083 1048599649 /nfs/dbraw/zinc/59/96/49/1048599649.db2.gz KMMAGRKSQUGWKO-HNNXBMFYSA-N 1 2 324.350 4.238 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc(C(=O)N(C)C)cc3F)ccc12 ZINC001176206601 1048604038 /nfs/dbraw/zinc/60/40/38/1048604038.db2.gz YTGKXTHSXOEPLA-UHFFFAOYSA-N 1 2 323.371 4.128 20 0 DIADLO Cc1cc(C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)ns1 ZINC001249570992 1048606113 /nfs/dbraw/zinc/60/61/13/1048606113.db2.gz HULXSIXKAUXJJQ-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO Cc1cc(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)ns1 ZINC001249570992 1048606122 /nfs/dbraw/zinc/60/61/22/1048606122.db2.gz HULXSIXKAUXJJQ-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO c1cn(Cc2ccc(NCc3cnc4ccccc4c3)cc2)c[nH+]1 ZINC001164204062 1048606992 /nfs/dbraw/zinc/60/69/92/1048606992.db2.gz PPPIPEAYPZZDBH-UHFFFAOYSA-N 1 2 314.392 4.092 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)CC(C)(C)C3CC3)cc2)[nH+]c1C ZINC001176220223 1048607143 /nfs/dbraw/zinc/60/71/43/1048607143.db2.gz RHLUVYIFEIREJZ-UHFFFAOYSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2nc(-c3ccccc3)c[nH]2)C2CC2)n1 ZINC000194339497 1048613805 /nfs/dbraw/zinc/61/38/05/1048613805.db2.gz RUCJRUUGESFBEF-QGZVFWFLSA-N 1 2 324.453 4.083 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000482486362 1048615230 /nfs/dbraw/zinc/61/52/30/1048615230.db2.gz MNGDSJCWVDOOSK-WCBMZHEXSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000482486362 1048615238 /nfs/dbraw/zinc/61/52/38/1048615238.db2.gz MNGDSJCWVDOOSK-WCBMZHEXSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000482486363 1048615626 /nfs/dbraw/zinc/61/56/26/1048615626.db2.gz MNGDSJCWVDOOSK-WPRPVWTQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000482486363 1048615634 /nfs/dbraw/zinc/61/56/34/1048615634.db2.gz MNGDSJCWVDOOSK-WPRPVWTQSA-N 1 2 311.269 4.267 20 0 DIADLO CCOc1ccc(CCNc2cc(C)[nH+]c(C3CCC3)n2)cc1 ZINC001164287372 1048617717 /nfs/dbraw/zinc/61/77/17/1048617717.db2.gz ABFMEXCBPXBZNO-UHFFFAOYSA-N 1 2 311.429 4.106 20 0 DIADLO Cc1nc(N2CC[C@@](C)(F)[C@@H](F)C2)cc(C2CCCCC2)[nH+]1 ZINC001164338482 1048622542 /nfs/dbraw/zinc/62/25/42/1048622542.db2.gz PLIRKCJASVUJQL-DOTOQJQBSA-N 1 2 309.404 4.109 20 0 DIADLO COc1ccc(NCc2[nH]c(C)c(C)[nH+]2)cc1Cc1ccccc1 ZINC000850203745 1048622892 /nfs/dbraw/zinc/62/28/92/1048622892.db2.gz UKPIZRCJPCHMGE-UHFFFAOYSA-N 1 2 321.424 4.238 20 0 DIADLO Cc1[nH]c(CNc2cc(F)c(OC(C)(C)C)c(F)c2)[nH+]c1C ZINC000850242826 1048627037 /nfs/dbraw/zinc/62/70/37/1048627037.db2.gz IAIVQSNKNKUDEO-UHFFFAOYSA-N 1 2 309.360 4.094 20 0 DIADLO Oc1ccc(Nc2ccc[nH+]c2N2CCCC2)c(C(F)(F)F)c1 ZINC001176339364 1048631637 /nfs/dbraw/zinc/63/16/37/1048631637.db2.gz FPPQMHCCMRTNSM-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO CC(=O)OCc1cccc(Cl)c1Nc1ccc(C)[nH+]c1C ZINC001212774499 1048634924 /nfs/dbraw/zinc/63/49/24/1048634924.db2.gz QKQQICAIXPCUIR-UHFFFAOYSA-N 1 2 304.777 4.159 20 0 DIADLO Nc1[nH+]cccc1CSc1nc(-c2ccc(F)cc2)cs1 ZINC001164505210 1048636485 /nfs/dbraw/zinc/63/64/85/1048636485.db2.gz PSNFAYCXRGNGHU-UHFFFAOYSA-N 1 2 317.414 4.219 20 0 DIADLO Cc1cccn2c(CNc3ccc4c(c3)[C@H](O)CCCC4)c[nH+]c12 ZINC000850362731 1048639303 /nfs/dbraw/zinc/63/93/03/1048639303.db2.gz NDHXAOHWCHNQMM-LJQANCHMSA-N 1 2 321.424 4.015 20 0 DIADLO Cc1ccc2oc(C[NH2+]Cc3c(Cl)nc(Cl)n3C)cc2c1 ZINC000850376405 1048644612 /nfs/dbraw/zinc/64/46/12/1048644612.db2.gz IAXHNINHNGXRCE-UHFFFAOYSA-N 1 2 324.211 4.071 20 0 DIADLO CCOC(=O)c1ccc2ccc(Nc3ccc(C)[nH+]c3C)cc2n1 ZINC001203381422 1048650657 /nfs/dbraw/zinc/65/06/57/1048650657.db2.gz XOPCIOZBBWRCQZ-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(C(C)(C)C)n1)c1cc2cnccc2o1 ZINC000850430418 1048654579 /nfs/dbraw/zinc/65/45/79/1048654579.db2.gz PWWGTYSILITKQG-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1cc2ccc(C)cc2[nH]1 ZINC000668098357 1048656640 /nfs/dbraw/zinc/65/66/40/1048656640.db2.gz GGHILAUEONPCRZ-LJQANCHMSA-N 1 2 322.456 4.420 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1cc2ccc(C)cc2[nH]1 ZINC000668098357 1048656654 /nfs/dbraw/zinc/65/66/54/1048656654.db2.gz GGHILAUEONPCRZ-LJQANCHMSA-N 1 2 322.456 4.420 20 0 DIADLO CC(C)(c1ccnc(Cl)c1)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001165063233 1048657832 /nfs/dbraw/zinc/65/78/32/1048657832.db2.gz NAIIZNYHXSYWMK-MRXNPFEDSA-N 1 2 316.832 4.044 20 0 DIADLO CC(C)(c1ccnc(Cl)c1)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001165063233 1048657840 /nfs/dbraw/zinc/65/78/40/1048657840.db2.gz NAIIZNYHXSYWMK-MRXNPFEDSA-N 1 2 316.832 4.044 20 0 DIADLO CCc1cccc(CC)c1NC(=O)Nc1cccc2[nH+]c(C)cn21 ZINC001189738650 1048662041 /nfs/dbraw/zinc/66/20/41/1048662041.db2.gz QVWSYFRFRSSKAU-UHFFFAOYSA-N 1 2 322.412 4.412 20 0 DIADLO COCc1cc[nH+]c(N2CCC3(CCCc4ccccc43)CC2)c1 ZINC001165264928 1048673274 /nfs/dbraw/zinc/67/32/74/1048673274.db2.gz RXPSEFSFFDSKFB-UHFFFAOYSA-N 1 2 322.452 4.103 20 0 DIADLO Cc1cc(N)nc(SCc2cc(Cl)cc3ccccc32)[nH+]1 ZINC001165289139 1048674474 /nfs/dbraw/zinc/67/44/74/1048674474.db2.gz QZVCXOKEIFTPRR-UHFFFAOYSA-N 1 2 315.829 4.466 20 0 DIADLO Cc1nonc1C[NH2+][C@@H](C)c1ccccc1Oc1ccccc1 ZINC000775334456 1048675854 /nfs/dbraw/zinc/67/58/54/1048675854.db2.gz ZPKJKVUFMBVGPZ-ZDUSSCGKSA-N 1 2 309.369 4.021 20 0 DIADLO Cc1c(Cl)cccc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000194494619 1048677982 /nfs/dbraw/zinc/67/79/82/1048677982.db2.gz YWRPGUYDIGVXPX-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO CCc1cccc(C)c1NC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001189949367 1048679484 /nfs/dbraw/zinc/67/94/84/1048679484.db2.gz OPMCOTGUCBPZRB-UHFFFAOYSA-N 1 2 308.385 4.158 20 0 DIADLO CCc1cccc(C)c1NC(=O)Nc1cc[nH+]c(N2CCCC2)c1 ZINC001189948368 1048680090 /nfs/dbraw/zinc/68/00/90/1048680090.db2.gz XMGCXOZNDUBKDX-UHFFFAOYSA-N 1 2 324.428 4.197 20 0 DIADLO Cc1cc(N2CCC3(C=Cc4ccccc43)CC2)nc(C2CC2)[nH+]1 ZINC001165337136 1048684995 /nfs/dbraw/zinc/68/49/95/1048684995.db2.gz GXNIJORAFWOZRQ-UHFFFAOYSA-N 1 2 317.436 4.227 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccccc2-n2cc[nH+]c2)cc1C ZINC001190099682 1048694416 /nfs/dbraw/zinc/69/44/16/1048694416.db2.gz MAQALURQMCDDFG-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO FC(F)(F)C1(c2ccc(NCCCc3ccncc3)[nH+]c2)CC1 ZINC001165525506 1048694969 /nfs/dbraw/zinc/69/49/69/1048694969.db2.gz ZBAFBNBZOSKRJK-UHFFFAOYSA-N 1 2 321.346 4.115 20 0 DIADLO c1cn(-c2cccc(Nc3cccc(OCC4CC4)c3)c2)c[nH+]1 ZINC001176492292 1048696563 /nfs/dbraw/zinc/69/65/63/1048696563.db2.gz XPBHBZZNHQRMMT-UHFFFAOYSA-N 1 2 305.381 4.405 20 0 DIADLO CC(C)c1ccccc1NC(=O)c1ccccc1-n1cc[nH+]c1 ZINC001190075417 1048696878 /nfs/dbraw/zinc/69/68/78/1048696878.db2.gz SNYYIUZLYPUZHI-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO COCc1cc([C@H](C)[NH2+]CC(F)(F)C(C)(C)C)ccc1OC ZINC000850573226 1048699334 /nfs/dbraw/zinc/69/93/34/1048699334.db2.gz XEGJVLVTQUBNPT-LBPRGKRZSA-N 1 2 315.404 4.174 20 0 DIADLO CN(C)c1cc(Cl)[nH+]c(NC2CCC(C(F)(F)F)CC2)c1 ZINC001165592080 1048700561 /nfs/dbraw/zinc/70/05/61/1048700561.db2.gz RYOUDQHBZHYBLX-UHFFFAOYSA-N 1 2 321.774 4.334 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2)n1 ZINC000482898182 1048703026 /nfs/dbraw/zinc/70/30/26/1048703026.db2.gz ATROVNVLJKQSHT-GOSISDBHSA-N 1 2 301.409 4.330 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2)n1 ZINC000482898182 1048703036 /nfs/dbraw/zinc/70/30/36/1048703036.db2.gz ATROVNVLJKQSHT-GOSISDBHSA-N 1 2 301.409 4.330 20 0 DIADLO CCN(CC)C(=O)c1cc(Nc2c[nH+]c(C)cc2C)ccc1F ZINC001176513726 1048703066 /nfs/dbraw/zinc/70/30/66/1048703066.db2.gz APGUWSIUKDYTHK-UHFFFAOYSA-N 1 2 315.392 4.063 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@@H+]1CCO[C@@H](c3ccccc3F)C1)CC2 ZINC000482945907 1048709570 /nfs/dbraw/zinc/70/95/70/1048709570.db2.gz KLQPXBVDSQMERV-RBUKOAKNSA-N 1 2 315.363 4.026 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@H+]1CCO[C@@H](c3ccccc3F)C1)CC2 ZINC000482945907 1048709578 /nfs/dbraw/zinc/70/95/78/1048709578.db2.gz KLQPXBVDSQMERV-RBUKOAKNSA-N 1 2 315.363 4.026 20 0 DIADLO CC(C)c1ccccc1C(=O)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001190263769 1048713643 /nfs/dbraw/zinc/71/36/43/1048713643.db2.gz VKYHGVQTSPNGQO-UHFFFAOYSA-N 1 2 319.408 4.307 20 0 DIADLO c1cnc2c(c1)nsc2Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203719313 1048722059 /nfs/dbraw/zinc/72/20/59/1048722059.db2.gz RWDBPZNLDSJXKC-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1)c1ncco1 ZINC000924783824 1048742656 /nfs/dbraw/zinc/74/26/56/1048742656.db2.gz ZULSQFWDSQJWHU-WDEREUQCSA-N 1 2 314.307 4.028 20 0 DIADLO c1cc(C2CC2)[nH+]c(N2CCC3(CC(OCC4CC4)C3)CC2)c1 ZINC001166377428 1048747873 /nfs/dbraw/zinc/74/78/73/1048747873.db2.gz JSTXKPPABMYHQA-UHFFFAOYSA-N 1 2 312.457 4.135 20 0 DIADLO CC[N@H+](Cc1cn(C(C)(C)C)nn1)Cc1ccc2ccccc2c1 ZINC000483180439 1048749471 /nfs/dbraw/zinc/74/94/71/1048749471.db2.gz KDUSGVHADDIBTO-UHFFFAOYSA-N 1 2 322.456 4.208 20 0 DIADLO CC[N@@H+](Cc1cn(C(C)(C)C)nn1)Cc1ccc2ccccc2c1 ZINC000483180439 1048749485 /nfs/dbraw/zinc/74/94/85/1048749485.db2.gz KDUSGVHADDIBTO-UHFFFAOYSA-N 1 2 322.456 4.208 20 0 DIADLO CC[C@](C)([NH2+]Cc1noc(-c2ccccc2)n1)c1ccccc1 ZINC000775396387 1048753810 /nfs/dbraw/zinc/75/38/10/1048753810.db2.gz SWOIONAYSDDFAX-IBGZPJMESA-N 1 2 307.397 4.152 20 0 DIADLO CCC[C@@]1(C)CCC[N@H+](Cc2nc([C@H](C)SCC)no2)C1 ZINC000483214329 1048758866 /nfs/dbraw/zinc/75/88/66/1048758866.db2.gz DKINZVWUAQCYIG-BBRMVZONSA-N 1 2 311.495 4.286 20 0 DIADLO CCC[C@@]1(C)CCC[N@@H+](Cc2nc([C@H](C)SCC)no2)C1 ZINC000483214329 1048758880 /nfs/dbraw/zinc/75/88/80/1048758880.db2.gz DKINZVWUAQCYIG-BBRMVZONSA-N 1 2 311.495 4.286 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@H+](CCCC)[C@@H](C)c1ccc(C)o1 ZINC001190588821 1048762310 /nfs/dbraw/zinc/76/23/10/1048762310.db2.gz FYIYQVNSJBUQDT-JKSUJKDBSA-N 1 2 309.450 4.483 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@@H+](CCCC)[C@@H](C)c1ccc(C)o1 ZINC001190588821 1048762325 /nfs/dbraw/zinc/76/23/25/1048762325.db2.gz FYIYQVNSJBUQDT-JKSUJKDBSA-N 1 2 309.450 4.483 20 0 DIADLO Cc1nc(N2CC[C@@H](c3ccncc3)C2)cc(C2CCCCC2)[nH+]1 ZINC001166567147 1048764122 /nfs/dbraw/zinc/76/41/22/1048764122.db2.gz BXMYVARGSCNKDP-GOSISDBHSA-N 1 2 322.456 4.222 20 0 DIADLO CC(C)c1cccc(-c2ccc(C(=O)OCc3c[nH+]cn3C)o2)c1 ZINC000776526265 1048766472 /nfs/dbraw/zinc/76/64/72/1048766472.db2.gz XDRLSRSBCFDBBF-UHFFFAOYSA-N 1 2 324.380 4.161 20 0 DIADLO C[C@@H]1CN(c2ccc(Nc3cccc(C4CC4)c3)c[nH+]2)C[C@H](C)O1 ZINC001176724034 1048771751 /nfs/dbraw/zinc/77/17/51/1048771751.db2.gz BDHODWCQNOKJSZ-GASCZTMLSA-N 1 2 323.440 4.316 20 0 DIADLO c1c(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)nnn1C1CCC1 ZINC000668229383 1048772800 /nfs/dbraw/zinc/77/28/00/1048772800.db2.gz GZMGZPLCLXZTSK-LJQANCHMSA-N 1 2 322.456 4.120 20 0 DIADLO c1c(C[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)nnn1C1CCC1 ZINC000668229383 1048772808 /nfs/dbraw/zinc/77/28/08/1048772808.db2.gz GZMGZPLCLXZTSK-LJQANCHMSA-N 1 2 322.456 4.120 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Br)o2)[C@@H]1c1ccccc1 ZINC000483282781 1048773595 /nfs/dbraw/zinc/77/35/95/1048773595.db2.gz CCQNMJYIYQUKLN-NHYWBVRUSA-N 1 2 306.203 4.235 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Br)o2)[C@@H]1c1ccccc1 ZINC000483282781 1048773610 /nfs/dbraw/zinc/77/36/10/1048773610.db2.gz CCQNMJYIYQUKLN-NHYWBVRUSA-N 1 2 306.203 4.235 20 0 DIADLO COc1c(Cl)cccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176749171 1048777496 /nfs/dbraw/zinc/77/74/96/1048777496.db2.gz YKEMGJVOMXNOGU-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO c1ccc(-c2cncc(Nc3ccc[nH+]c3N3CCCC3)c2)cc1 ZINC001176750163 1048777667 /nfs/dbraw/zinc/77/76/67/1048777667.db2.gz RWMNVGOLZSQBAZ-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Brc1ccccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176749037 1048777695 /nfs/dbraw/zinc/77/76/95/1048777695.db2.gz POXDXEBNEVYLIQ-UHFFFAOYSA-N 1 2 318.218 4.188 20 0 DIADLO CC(C)(C)c1cc(Nc2ccc[nH+]c2N2CCCC2)sn1 ZINC001176750526 1048778132 /nfs/dbraw/zinc/77/81/32/1048778132.db2.gz XISICUBQNCPHTN-UHFFFAOYSA-N 1 2 302.447 4.179 20 0 DIADLO c1c(Nc2ccc[nH+]c2N2CCCC2)onc1C1CCCCC1 ZINC001176743815 1048778198 /nfs/dbraw/zinc/77/81/98/1048778198.db2.gz NOIOWSCAQMYLRA-UHFFFAOYSA-N 1 2 312.417 4.461 20 0 DIADLO Brc1sccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176749123 1048778469 /nfs/dbraw/zinc/77/84/69/1048778469.db2.gz WHZOFJVRYSXDNM-UHFFFAOYSA-N 1 2 324.247 4.249 20 0 DIADLO CC(C)(C)c1ccc(N2CC[C@H]2COCc2ccccc2)[nH+]c1 ZINC001166671573 1048778378 /nfs/dbraw/zinc/77/83/78/1048778378.db2.gz ZENXUASJYMMRTN-SFHVURJKSA-N 1 2 310.441 4.175 20 0 DIADLO CC(C)(C)c1ccc(N2CC[C@@H]2COCc2ccccc2)[nH+]c1 ZINC001166671572 1048779372 /nfs/dbraw/zinc/77/93/72/1048779372.db2.gz ZENXUASJYMMRTN-GOSISDBHSA-N 1 2 310.441 4.175 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1nc2ccccc2o1 ZINC000110033185 1048780923 /nfs/dbraw/zinc/78/09/23/1048780923.db2.gz YXOVOPJXRLVOKM-QEEYODRMSA-N 1 2 322.408 4.178 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@H+]1Cc1nc2ccccc2o1 ZINC000110033185 1048780939 /nfs/dbraw/zinc/78/09/39/1048780939.db2.gz YXOVOPJXRLVOKM-QEEYODRMSA-N 1 2 322.408 4.178 20 0 DIADLO c1ccc(-c2cc[nH+]c(N3CCO[C@H](c4ccccc4)C3)c2)cc1 ZINC001166681546 1048782062 /nfs/dbraw/zinc/78/20/62/1048782062.db2.gz NHRQYKQWBAKAAC-FQEVSTJZSA-N 1 2 316.404 4.327 20 0 DIADLO c1cc(Nc2cccc3cc[nH+]cc32)n(Cc2ccccc2)n1 ZINC001176705547 1048782426 /nfs/dbraw/zinc/78/24/26/1048782426.db2.gz GFJDRWJDBUYPGP-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO Cc1ccccc1OCCC[N@@H+]1Cc2cccc(Cl)c2C1 ZINC001176798227 1048786374 /nfs/dbraw/zinc/78/63/74/1048786374.db2.gz NDGOAWMUQNNCKM-UHFFFAOYSA-N 1 2 301.817 4.433 20 0 DIADLO Cc1ccccc1OCCC[N@H+]1Cc2cccc(Cl)c2C1 ZINC001176798227 1048786386 /nfs/dbraw/zinc/78/63/86/1048786386.db2.gz NDGOAWMUQNNCKM-UHFFFAOYSA-N 1 2 301.817 4.433 20 0 DIADLO COc1cc(C)[nH+]c(CSc2nc3cccc(F)c3s2)c1 ZINC001166732079 1048786894 /nfs/dbraw/zinc/78/68/94/1048786894.db2.gz WGYFUVXPYXHHBZ-UHFFFAOYSA-N 1 2 320.414 4.440 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cccc(F)n2)C2CC2)o1 ZINC000851711798 1048795505 /nfs/dbraw/zinc/79/55/05/1048795505.db2.gz GIGFZIUAEAXHMD-LRDDRELGSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cccc(F)n2)C2CC2)o1 ZINC000851711798 1048795512 /nfs/dbraw/zinc/79/55/12/1048795512.db2.gz GIGFZIUAEAXHMD-LRDDRELGSA-N 1 2 300.377 4.102 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2CCSc2ccc(F)cc2F)no1 ZINC000851716202 1048795716 /nfs/dbraw/zinc/79/57/16/1048795716.db2.gz KQPUYAAJURSTMA-OAHLLOKOSA-N 1 2 324.396 4.190 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2CCSc2ccc(F)cc2F)no1 ZINC000851716202 1048795727 /nfs/dbraw/zinc/79/57/27/1048795727.db2.gz KQPUYAAJURSTMA-OAHLLOKOSA-N 1 2 324.396 4.190 20 0 DIADLO CC(C)(C)OC(=O)c1cccc(C[NH+]2Cc3ccccc3C2)c1 ZINC001190856039 1048796711 /nfs/dbraw/zinc/79/67/11/1048796711.db2.gz XMUWOOZBLZNBND-UHFFFAOYSA-N 1 2 309.409 4.158 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1csc(Br)c1)C2 ZINC001190905238 1048804522 /nfs/dbraw/zinc/80/45/22/1048804522.db2.gz XOONTJHOMDLQET-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1csc(Br)c1)C2 ZINC001190905238 1048804550 /nfs/dbraw/zinc/80/45/50/1048804550.db2.gz XOONTJHOMDLQET-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2scnc2Cl)[C@@H]1c1ccccc1 ZINC001191029320 1048824983 /nfs/dbraw/zinc/82/49/83/1048824983.db2.gz GLFGZQRXODHTGI-FZMZJTMJSA-N 1 2 324.902 4.475 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2scnc2Cl)[C@@H]1c1ccccc1 ZINC001191029320 1048824999 /nfs/dbraw/zinc/82/49/99/1048824999.db2.gz GLFGZQRXODHTGI-FZMZJTMJSA-N 1 2 324.902 4.475 20 0 DIADLO CCSc1cc[nH+]c(N(C)Cc2csc(C(C)C)n2)c1 ZINC001167009101 1048829818 /nfs/dbraw/zinc/82/98/18/1048829818.db2.gz LLULCIOVZFTVBH-UHFFFAOYSA-N 1 2 307.488 4.410 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+](Cc2ccsc2)C(C)(C)C)o1 ZINC000852311943 1048833934 /nfs/dbraw/zinc/83/39/34/1048833934.db2.gz PXGNASNRSROGHZ-UHFFFAOYSA-N 1 2 307.463 4.229 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+](Cc2ccsc2)C(C)(C)C)o1 ZINC000852311943 1048833962 /nfs/dbraw/zinc/83/39/62/1048833962.db2.gz PXGNASNRSROGHZ-UHFFFAOYSA-N 1 2 307.463 4.229 20 0 DIADLO CC(C)n1ccc(Nc2ccc3[nH+]cc(Br)n3c2)c1 ZINC001203158299 1048840777 /nfs/dbraw/zinc/84/07/77/1048840777.db2.gz IABCZBAHTLIRAF-UHFFFAOYSA-N 1 2 319.206 4.223 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(Cl)cc(Cl)c2F)CCCO1 ZINC001191047770 1048845329 /nfs/dbraw/zinc/84/53/29/1048845329.db2.gz IIVRXBVTVUBBTN-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(Cl)cc(Cl)c2F)CCCO1 ZINC001191047770 1048845341 /nfs/dbraw/zinc/84/53/41/1048845341.db2.gz IIVRXBVTVUBBTN-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cccc(Cl)n2)cc1F ZINC000852521848 1048846620 /nfs/dbraw/zinc/84/66/20/1048846620.db2.gz VGMYCDQGFIODOJ-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cccc(Cl)n2)cc1F ZINC000852521848 1048846634 /nfs/dbraw/zinc/84/66/34/1048846634.db2.gz VGMYCDQGFIODOJ-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cccnc2Cl)cc1F ZINC000852518520 1048847890 /nfs/dbraw/zinc/84/78/90/1048847890.db2.gz IJTGYPWXSYUTJO-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cccnc2Cl)cc1F ZINC000852518520 1048847905 /nfs/dbraw/zinc/84/79/05/1048847905.db2.gz IJTGYPWXSYUTJO-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)n1 ZINC000852680989 1048854703 /nfs/dbraw/zinc/85/47/03/1048854703.db2.gz JRTRWALSHHUYPX-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)n1 ZINC000852680989 1048854720 /nfs/dbraw/zinc/85/47/20/1048854720.db2.gz JRTRWALSHHUYPX-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](CCSC(F)(F)F)[C@@H](C)CO1 ZINC001191085856 1048863375 /nfs/dbraw/zinc/86/33/75/1048863375.db2.gz URXFSDIEQWSXBC-JSGCOSHPSA-N 1 2 319.392 4.010 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](CCSC(F)(F)F)[C@@H](C)CO1 ZINC001191085856 1048863388 /nfs/dbraw/zinc/86/33/88/1048863388.db2.gz URXFSDIEQWSXBC-JSGCOSHPSA-N 1 2 319.392 4.010 20 0 DIADLO Cc1nocc1C[NH2+]Cc1csc(-c2ccc(Cl)cc2)n1 ZINC001203320714 1048868339 /nfs/dbraw/zinc/86/83/39/1048868339.db2.gz MTOQMTPWCXYUQM-UHFFFAOYSA-N 1 2 319.817 4.050 20 0 DIADLO Cc1cn2c(cccc2Nc2cccc(C(=O)C(F)(F)F)c2)[nH+]1 ZINC001203334686 1048873713 /nfs/dbraw/zinc/87/37/13/1048873713.db2.gz YPYXUMQIBCJDGA-UHFFFAOYSA-N 1 2 319.286 4.131 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@H](C)c3cc(F)cc(F)c3)[nH]c2c1 ZINC000483868235 1048874326 /nfs/dbraw/zinc/87/43/26/1048874326.db2.gz VVKURXBGYZRFJU-LLVKDONJSA-N 1 2 301.340 4.000 20 0 DIADLO CC(C)(C)c1csc(CNc2ccc(-n3cc[nH+]c3)cc2)n1 ZINC001177387425 1048880829 /nfs/dbraw/zinc/88/08/29/1048880829.db2.gz MJBJPMZYKVKDHZ-UHFFFAOYSA-N 1 2 312.442 4.238 20 0 DIADLO Cc1cnn(Cc2ccccc2F)c1Nc1ccc(C)[nH+]c1C ZINC001203370247 1048883328 /nfs/dbraw/zinc/88/33/28/1048883328.db2.gz XYAKQCGJDLHDBA-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO CCOC(=O)Cc1ccc(Cl)c(Nc2ccc(C)[nH+]c2C)c1 ZINC001203381093 1048885292 /nfs/dbraw/zinc/88/52/92/1048885292.db2.gz OYYVTNMWESGWJX-UHFFFAOYSA-N 1 2 318.804 4.201 20 0 DIADLO COc1ccc(Br)c(Nc2ccc(C)[nH+]c2C)c1 ZINC001203372757 1048885996 /nfs/dbraw/zinc/88/59/96/1048885996.db2.gz HEPDNKCLDRUARB-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1ccc(Nc2ccc3c(cnn3[C@@H]3CCCCO3)c2)c(C)[nH+]1 ZINC001203374426 1048886048 /nfs/dbraw/zinc/88/60/48/1048886048.db2.gz JHWMQRRLEMWCBN-IBGZPJMESA-N 1 2 322.412 4.491 20 0 DIADLO Fc1c(F)c(F)c(C[NH+]2CC3CCC(CC3)C2)c(F)c1F ZINC001203373398 1048886083 /nfs/dbraw/zinc/88/60/83/1048886083.db2.gz RCEVZOPNQCIRGF-UHFFFAOYSA-N 1 2 305.290 4.004 20 0 DIADLO Clc1ccccc1C[N@@H+]1CCc2nn(-c3ccccc3)cc2C1 ZINC001203385090 1048886518 /nfs/dbraw/zinc/88/65/18/1048886518.db2.gz JBTRFCRQIAQWEX-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1ccccc1C[N@H+]1CCc2nn(-c3ccccc3)cc2C1 ZINC001203385090 1048886539 /nfs/dbraw/zinc/88/65/39/1048886539.db2.gz JBTRFCRQIAQWEX-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+]([C@H](C)c1nc(-c3ccccc3)no1)C2 ZINC000483990979 1048889190 /nfs/dbraw/zinc/88/91/90/1048889190.db2.gz GPSURZZBBLVBLK-OAHLLOKOSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+]([C@H](C)c1nc(-c3ccccc3)no1)C2 ZINC000483990979 1048889203 /nfs/dbraw/zinc/88/92/03/1048889203.db2.gz GPSURZZBBLVBLK-OAHLLOKOSA-N 1 2 319.408 4.164 20 0 DIADLO C[C@H]1CSCC[N@@H+]1Cc1nc2c(s1)C(C)(C)CC(C)(C)C2 ZINC001191183555 1048894055 /nfs/dbraw/zinc/89/40/55/1048894055.db2.gz SBTSFEHYLGBXMS-LBPRGKRZSA-N 1 2 324.559 4.330 20 0 DIADLO C[C@H]1CSCC[N@H+]1Cc1nc2c(s1)C(C)(C)CC(C)(C)C2 ZINC001191183555 1048894065 /nfs/dbraw/zinc/89/40/65/1048894065.db2.gz SBTSFEHYLGBXMS-LBPRGKRZSA-N 1 2 324.559 4.330 20 0 DIADLO Fc1cccc(C[N@H+]2CC=C(c3ccc(Cl)nc3)CC2)c1F ZINC000773668868 1048895258 /nfs/dbraw/zinc/89/52/58/1048895258.db2.gz JSVFOVQZYWHQFR-UHFFFAOYSA-N 1 2 320.770 4.303 20 0 DIADLO Fc1cccc(C[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)c1F ZINC000773668868 1048895271 /nfs/dbraw/zinc/89/52/71/1048895271.db2.gz JSVFOVQZYWHQFR-UHFFFAOYSA-N 1 2 320.770 4.303 20 0 DIADLO Cn1cc(Nc2ccc(N3CCCCC3)[nH+]c2)c2ccccc21 ZINC001203416215 1048896366 /nfs/dbraw/zinc/89/63/66/1048896366.db2.gz ZQGFXPSHSPSKCV-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO CNc1ccc(Nc2cc(-c3ccccc3Cl)no2)c[nH+]1 ZINC001203448578 1048904280 /nfs/dbraw/zinc/90/42/80/1048904280.db2.gz BCWGZRAOPYMRRI-UHFFFAOYSA-N 1 2 300.749 4.175 20 0 DIADLO CNc1ccc(Nc2ccccc2NC(=O)OC(C)(C)C)c[nH+]1 ZINC001203459184 1048906029 /nfs/dbraw/zinc/90/60/29/1048906029.db2.gz ZIIBWGIOIDXPCM-UHFFFAOYSA-N 1 2 314.389 4.214 20 0 DIADLO CNc1ccc(Nc2ccccc2Oc2ccccc2N)c[nH+]1 ZINC001203459267 1048906806 /nfs/dbraw/zinc/90/68/06/1048906806.db2.gz IMNXNIFYMBZGNA-UHFFFAOYSA-N 1 2 306.369 4.241 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1nc2ccccc2s1 ZINC000111405400 1048910685 /nfs/dbraw/zinc/91/06/85/1048910685.db2.gz AINRBOVLEBAQPY-JTQLQIEISA-N 1 2 304.365 4.425 20 0 DIADLO Cc1cc(Br)c(CNc2c[nH+]c(C)c(C)c2)s1 ZINC001203485049 1048911445 /nfs/dbraw/zinc/91/14/45/1048911445.db2.gz GQXWUDKHGUTPFL-UHFFFAOYSA-N 1 2 311.248 4.443 20 0 DIADLO Cc1ncc(Nc2ccc(N(C)Cc3ccccc3)[nH+]c2)s1 ZINC001203515481 1048915777 /nfs/dbraw/zinc/91/57/77/1048915777.db2.gz KNOFYCHYDQKWCT-UHFFFAOYSA-N 1 2 310.426 4.227 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2ccc(O)cc2)c[nH+]1 ZINC001203516279 1048916767 /nfs/dbraw/zinc/91/67/67/1048916767.db2.gz ZOVUJWSGVZMYIY-UHFFFAOYSA-N 1 2 305.381 4.167 20 0 DIADLO Cc1cccc(N)c1Nc1ccc(N(C)Cc2ccccc2)[nH+]c1 ZINC001203518762 1048916970 /nfs/dbraw/zinc/91/69/70/1048916970.db2.gz OWSISDQMWWFVBL-UHFFFAOYSA-N 1 2 318.424 4.352 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1ccnn1C1CCC1 ZINC001203517261 1048917140 /nfs/dbraw/zinc/91/71/40/1048917140.db2.gz OGBIUZVMERQIKX-UHFFFAOYSA-N 1 2 323.444 4.325 20 0 DIADLO CN(C)c1ccccc1C[NH2+][C@H](c1nccs1)c1ccccc1 ZINC001177580213 1048918063 /nfs/dbraw/zinc/91/80/63/1048918063.db2.gz AVMMJQHBRZXIKQ-SFHVURJKSA-N 1 2 323.465 4.088 20 0 DIADLO COc1cc(CNc2[nH+]c3ccccc3n2C(C)C)ccc1F ZINC001203522653 1048919307 /nfs/dbraw/zinc/91/93/07/1048919307.db2.gz VDEWXZSHGXEWIK-UHFFFAOYSA-N 1 2 313.376 4.377 20 0 DIADLO c1cn(-c2ccc(CSCCC3SCCS3)cc2)c[nH+]1 ZINC000853772011 1048922703 /nfs/dbraw/zinc/92/27/03/1048922703.db2.gz AXQALJCMMLVWND-UHFFFAOYSA-N 1 2 322.524 4.302 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1cnc(C)s1 ZINC001203530758 1048925099 /nfs/dbraw/zinc/92/50/99/1048925099.db2.gz ZBDXEOAEWMJFNT-UHFFFAOYSA-N 1 2 306.822 4.087 20 0 DIADLO CC(C)c1nc([C@@H]2CCCC[N@@H+]2C[C@@H]2CCC(F)(F)C2)no1 ZINC001191382012 1048930789 /nfs/dbraw/zinc/93/07/89/1048930789.db2.gz PAQDEHSHPYEQEI-OLZOCXBDSA-N 1 2 313.392 4.155 20 0 DIADLO CC(C)c1nc([C@@H]2CCCC[N@H+]2C[C@@H]2CCC(F)(F)C2)no1 ZINC001191382012 1048930799 /nfs/dbraw/zinc/93/07/99/1048930799.db2.gz PAQDEHSHPYEQEI-OLZOCXBDSA-N 1 2 313.392 4.155 20 0 DIADLO CCCn1nc(C)c(CNc2[nH]c3ccc(Cl)cc3[nH+]2)c1C ZINC001203573364 1048932363 /nfs/dbraw/zinc/93/23/63/1048932363.db2.gz ZIKJLXDSXQWYIX-UHFFFAOYSA-N 1 2 317.824 4.052 20 0 DIADLO CNc1ccc(C)cc1CNc1[nH]c2ccc(Cl)cc2[nH+]1 ZINC001203573369 1048932508 /nfs/dbraw/zinc/93/25/08/1048932508.db2.gz ZLCMIMHOAVJJCI-UHFFFAOYSA-N 1 2 300.793 4.179 20 0 DIADLO CCn1ccnc1C[NH2+]Cc1ccccc1Oc1ccccc1C ZINC001177728883 1048933214 /nfs/dbraw/zinc/93/32/14/1048933214.db2.gz ACDLXKLUIQCQQW-UHFFFAOYSA-N 1 2 321.424 4.294 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c(C)c1 ZINC001203738989 1048941527 /nfs/dbraw/zinc/94/15/27/1048941527.db2.gz CIVBMATXXIOSTP-LJQANCHMSA-N 1 2 317.379 4.155 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c(C)c1 ZINC001203738989 1048941540 /nfs/dbraw/zinc/94/15/40/1048941540.db2.gz CIVBMATXXIOSTP-LJQANCHMSA-N 1 2 317.379 4.155 20 0 DIADLO COc1ccccc1Cn1ncc(C)c1Nc1cc(C)c[nH+]c1C ZINC001203657081 1048950693 /nfs/dbraw/zinc/95/06/93/1048950693.db2.gz IFEUJXFNXPPZJF-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc3nc(-c4ccccc4)nn3c2)c1 ZINC001203660775 1048951611 /nfs/dbraw/zinc/95/16/11/1048951611.db2.gz LVNWPTKCQPPBCX-UHFFFAOYSA-N 1 2 315.380 4.152 20 0 DIADLO COc1cccc(Br)c1Nc1cc(C)c[nH+]c1C ZINC001203666714 1048952817 /nfs/dbraw/zinc/95/28/17/1048952817.db2.gz CMHCDDHDZTYORL-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO CC(=O)c1c(Br)cccc1Nc1cc(C)c[nH+]c1C ZINC001203663178 1048953594 /nfs/dbraw/zinc/95/35/94/1048953594.db2.gz BGIFZWBSHJURFQ-UHFFFAOYSA-N 1 2 319.202 4.407 20 0 DIADLO Fc1ccc(/C=C\C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)cc1F ZINC001203665920 1048955050 /nfs/dbraw/zinc/95/50/50/1048955050.db2.gz TYRMSWXVQJTWNI-MUURBNQUSA-N 1 2 319.326 4.039 20 0 DIADLO Cc1cc(C)c2cc(NCc3c(C4CCC4)cnn3C)ccc2[nH+]1 ZINC001203675843 1048958437 /nfs/dbraw/zinc/95/84/37/1048958437.db2.gz CSQIZZHQOOVQAY-UHFFFAOYSA-N 1 2 320.440 4.465 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1CCOC2(C1)CCCCCC2 ZINC001191549629 1048963449 /nfs/dbraw/zinc/96/34/49/1048963449.db2.gz FUJMORCKKPIPKW-AWEZNQCLSA-N 1 2 309.400 4.451 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1CCOC2(C1)CCCCCC2 ZINC001191549629 1048963460 /nfs/dbraw/zinc/96/34/60/1048963460.db2.gz FUJMORCKKPIPKW-AWEZNQCLSA-N 1 2 309.400 4.451 20 0 DIADLO c1cc2cncnc2cc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203707738 1048970999 /nfs/dbraw/zinc/97/09/99/1048970999.db2.gz OGPUSHQBNRKBLN-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO Oc1cc(Cl)cc(C[NH2+]Cc2csc(-c3ccco3)n2)c1 ZINC001177999718 1048972959 /nfs/dbraw/zinc/97/29/59/1048972959.db2.gz MXBGJQHLEAUKLC-UHFFFAOYSA-N 1 2 320.801 4.052 20 0 DIADLO O=C1OCc2cc(Nc3ccc([NH+]4CCCCC4)cc3)ccc21 ZINC001203719236 1048975142 /nfs/dbraw/zinc/97/51/42/1048975142.db2.gz KLWBBVCDDZKENC-UHFFFAOYSA-N 1 2 308.381 4.091 20 0 DIADLO c1c(-c2ccccn2)noc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718192 1048975173 /nfs/dbraw/zinc/97/51/73/1048975173.db2.gz VJGFYUSWXMLIGT-UHFFFAOYSA-N 1 2 320.396 4.471 20 0 DIADLO O=C1CCc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc2N1 ZINC001203719201 1048975256 /nfs/dbraw/zinc/97/52/56/1048975256.db2.gz IBOWYFSUWADZQS-UHFFFAOYSA-N 1 2 321.424 4.305 20 0 DIADLO CC(=O)c1cccc(Nc2ccc([NH+]3CCCCC3)cc2)c1O ZINC001203718869 1048975432 /nfs/dbraw/zinc/97/54/32/1048975432.db2.gz GBIMPBVBHSJFNW-UHFFFAOYSA-N 1 2 310.397 4.329 20 0 DIADLO Fc1cc(Nc2ccc([NH+]3CCCCC3)cc2)c(F)c(F)n1 ZINC001203718212 1048976142 /nfs/dbraw/zinc/97/61/42/1048976142.db2.gz WIFWHWKTGWYOOL-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO CC[N@H+](CCCn1c2ccccc2[nH]c1=O)c1ccc(C)cc1C ZINC001191646577 1048976328 /nfs/dbraw/zinc/97/63/28/1048976328.db2.gz PTOMZPPEDDDISW-UHFFFAOYSA-N 1 2 323.440 4.275 20 0 DIADLO CC[N@@H+](CCCn1c2ccccc2[nH]c1=O)c1ccc(C)cc1C ZINC001191646577 1048976345 /nfs/dbraw/zinc/97/63/45/1048976345.db2.gz PTOMZPPEDDDISW-UHFFFAOYSA-N 1 2 323.440 4.275 20 0 DIADLO Cc1cc(Nc2ccc([NH+]3CCCCC3)cc2)n(CC2CC2)n1 ZINC001203719098 1048976645 /nfs/dbraw/zinc/97/66/45/1048976645.db2.gz QQJURQGYZHMLTG-UHFFFAOYSA-N 1 2 310.445 4.335 20 0 DIADLO c1cc2c(ccnc2Nc2ccc([NH+]3CCCCC3)cc2)cn1 ZINC001203717986 1048976709 /nfs/dbraw/zinc/97/67/09/1048976709.db2.gz PROCGQUJRXQHDL-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO COC(=O)Cc1ccccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203719413 1048977159 /nfs/dbraw/zinc/97/71/59/1048977159.db2.gz VNXQXLJRGSYTBG-UHFFFAOYSA-N 1 2 324.424 4.136 20 0 DIADLO Cc1cnc(Nc2ccc([NH+]3CCCCC3)cc2)c(Cl)n1 ZINC001203717611 1048977303 /nfs/dbraw/zinc/97/73/03/1048977303.db2.gz HPXLVXLXWHZEQA-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO O=c1[nH]cc(Cl)cc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203717667 1048977361 /nfs/dbraw/zinc/97/73/61/1048977361.db2.gz KISQVMZFHVOIHG-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO CC(=O)c1cc(Nc2ccc([NH+]3CCCCC3)cc2)cnc1C ZINC001203719667 1048978045 /nfs/dbraw/zinc/97/80/45/1048978045.db2.gz ZSHADEYMYWDTEJ-UHFFFAOYSA-N 1 2 309.413 4.327 20 0 DIADLO CN(C)c1ccc(NCc2ccc(-c3ccc(F)cc3)o2)[nH+]c1 ZINC001178060181 1048979627 /nfs/dbraw/zinc/97/96/27/1048979627.db2.gz OSUCELYVKPQYDK-UHFFFAOYSA-N 1 2 311.360 4.159 20 0 DIADLO O=c1[nH]ccc(Nc2ccc([NH+]3CCCCC3)cc2)c1Cl ZINC001203719627 1048979913 /nfs/dbraw/zinc/97/99/13/1048979913.db2.gz ZEWPUTJNTWFZAH-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO O=C1NCc2cccc(Nc3ccc([NH+]4CCCCC4)cc3)c2N1 ZINC001203724209 1048979936 /nfs/dbraw/zinc/97/99/36/1048979936.db2.gz IYEBBJYNVBJMJW-UHFFFAOYSA-N 1 2 322.412 4.056 20 0 DIADLO O[C@@H]1CCc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc21 ZINC001203726297 1048981559 /nfs/dbraw/zinc/98/15/59/1048981559.db2.gz VWLGDRWYTBVKMR-HXUWFJFHSA-N 1 2 308.425 4.400 20 0 DIADLO C[C@H]1CN(c2ccc([NH2+]CC(C)(C)c3ccccc3)cc2)CCO1 ZINC001178037473 1048982635 /nfs/dbraw/zinc/98/26/35/1048982635.db2.gz LUDFXYDUHPYTNO-KRWDZBQOSA-N 1 2 324.468 4.301 20 0 DIADLO c1ncn(-c2ccccc2Nc2ccc([NH+]3CCCCC3)cc2)n1 ZINC001203725061 1048982704 /nfs/dbraw/zinc/98/27/04/1048982704.db2.gz ZWIFAGIFNWQAPB-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO Clc1cnccc1CNc1[nH+]c2ccccc2n1CC1CC1 ZINC001203740680 1048986949 /nfs/dbraw/zinc/98/69/49/1048986949.db2.gz ONLCDRRGCZIPHD-UHFFFAOYSA-N 1 2 312.804 4.107 20 0 DIADLO CCOc1ccc(CNc2[nH+]c3ccccc3n2CC2CC2)cc1 ZINC001203739424 1048987555 /nfs/dbraw/zinc/98/75/55/1048987555.db2.gz HFVGBAOTRXYYSV-UHFFFAOYSA-N 1 2 321.424 4.457 20 0 DIADLO CN(C)c1cccc(Cl)c1CNc1ccc([NH+](C)C)cc1 ZINC001178123098 1048993396 /nfs/dbraw/zinc/99/33/96/1048993396.db2.gz JONXZORODLVIMM-UHFFFAOYSA-N 1 2 303.837 4.084 20 0 DIADLO CCOc1ccc(CNc2cc(CSCC)cc[nH+]2)cc1 ZINC001178188349 1048996664 /nfs/dbraw/zinc/99/66/64/1048996664.db2.gz WUUGKYLXCRUGSA-UHFFFAOYSA-N 1 2 302.443 4.346 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3cc(Cl)ccc3C2)cc1F ZINC001203792201 1048996823 /nfs/dbraw/zinc/99/68/23/1048996823.db2.gz OGKRDVGAUIIRIM-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(C[N@H+]2CCc3cc(Cl)ccc3C2)cc1F ZINC001203792201 1048996825 /nfs/dbraw/zinc/99/68/25/1048996825.db2.gz OGKRDVGAUIIRIM-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3cccc(Cl)c3C2)cc1F ZINC001203792547 1048997040 /nfs/dbraw/zinc/99/70/40/1048997040.db2.gz VYRKLYWQWBAGLH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(C[N@H+]2CCc3cccc(Cl)c3C2)cc1F ZINC001203792547 1048997047 /nfs/dbraw/zinc/99/70/47/1048997047.db2.gz VYRKLYWQWBAGLH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)cc1F ZINC001203796379 1048998783 /nfs/dbraw/zinc/99/87/83/1048998783.db2.gz TZIGJKQXUSBXAU-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)cc1F ZINC001203796379 1048998799 /nfs/dbraw/zinc/99/87/99/1048998799.db2.gz TZIGJKQXUSBXAU-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO c1cc2n(c1)CC[N@@H+](Cc1cccc(Oc3ccccc3)c1)C2 ZINC001203811356 1049008110 /nfs/dbraw/zinc/00/81/10/1049008110.db2.gz PYEHTAKFQLHCHL-UHFFFAOYSA-N 1 2 304.393 4.296 20 0 DIADLO c1cc2n(c1)CC[N@H+](Cc1cccc(Oc3ccccc3)c1)C2 ZINC001203811356 1049008123 /nfs/dbraw/zinc/00/81/23/1049008123.db2.gz PYEHTAKFQLHCHL-UHFFFAOYSA-N 1 2 304.393 4.296 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1cccc(F)c1Cl ZINC001191870059 1049011996 /nfs/dbraw/zinc/01/19/96/1049011996.db2.gz CHRNQJMFBJWRIF-GFCCVEGCSA-N 1 2 305.780 4.435 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1cccc(F)c1Cl ZINC001191870059 1049012009 /nfs/dbraw/zinc/01/20/09/1049012009.db2.gz CHRNQJMFBJWRIF-GFCCVEGCSA-N 1 2 305.780 4.435 20 0 DIADLO Cc1c[nH+]c2cc(-c3nc(-c4cccc(Cl)c4)no3)ccn12 ZINC000904289354 1049012875 /nfs/dbraw/zinc/01/28/75/1049012875.db2.gz VIMOQPKXYQAFTR-UHFFFAOYSA-N 1 2 310.744 4.013 20 0 DIADLO COc1cc(C[N@@H+]2CCOc3ccccc3[C@@H]2C)ccc1Cl ZINC001191871107 1049013642 /nfs/dbraw/zinc/01/36/42/1049013642.db2.gz MRCLEQZOFYVEOO-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(C[N@H+]2CCOc3ccccc3[C@@H]2C)ccc1Cl ZINC001191871107 1049013657 /nfs/dbraw/zinc/01/36/57/1049013657.db2.gz MRCLEQZOFYVEOO-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO Cc1cccn2c(CNc3cccc(OC(C)(C)C)c3)c[nH+]c12 ZINC001203848019 1049014200 /nfs/dbraw/zinc/01/42/00/1049014200.db2.gz NJPRHBPKBOTBKM-UHFFFAOYSA-N 1 2 309.413 4.432 20 0 DIADLO CC(C)C[C@@H]1CCCC[N@@H+]1Cc1ncsc1Br ZINC001191899553 1049014406 /nfs/dbraw/zinc/01/44/06/1049014406.db2.gz MFFGUVCNYIYJKH-NSHDSACASA-N 1 2 317.296 4.306 20 0 DIADLO CC(C)C[C@@H]1CCCC[N@H+]1Cc1ncsc1Br ZINC001191899553 1049014419 /nfs/dbraw/zinc/01/44/19/1049014419.db2.gz MFFGUVCNYIYJKH-NSHDSACASA-N 1 2 317.296 4.306 20 0 DIADLO COc1cc[nH+]cc1NCc1cc(Cl)cc(C(F)(F)F)c1 ZINC001178259528 1049015006 /nfs/dbraw/zinc/01/50/06/1049015006.db2.gz ROYHFNFYTIKMHQ-UHFFFAOYSA-N 1 2 316.710 4.375 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)cn1 ZINC000338968122 1049016248 /nfs/dbraw/zinc/01/62/48/1049016248.db2.gz LEVDAPQCNQOOIO-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)cn1 ZINC000338968122 1049016263 /nfs/dbraw/zinc/01/62/63/1049016263.db2.gz LEVDAPQCNQOOIO-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)cc1O ZINC001203870555 1049018922 /nfs/dbraw/zinc/01/89/22/1049018922.db2.gz IIEDCBLWPGFMEF-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)cc1O ZINC001203870555 1049018929 /nfs/dbraw/zinc/01/89/29/1049018929.db2.gz IIEDCBLWPGFMEF-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO C[C@@H](Nc1ccc([NH+]2CCCC2)cc1)c1ccc2c(c1)COC2 ZINC000776802292 1049024840 /nfs/dbraw/zinc/02/48/40/1049024840.db2.gz DMZCVBORQDDDNS-OAHLLOKOSA-N 1 2 308.425 4.490 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]([NH2+][C@H](c1ccccc1)C1CCC1)C1CC1 ZINC001192157694 1049044134 /nfs/dbraw/zinc/04/41/34/1049044134.db2.gz IXFLUVWYPPZIIT-MSOLQXFVSA-N 1 2 315.457 4.238 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H](C)c2ccc3ncsc3c2)o1 ZINC000776814879 1049044775 /nfs/dbraw/zinc/04/47/75/1049044775.db2.gz FMIVFYMHLVZERZ-NSHDSACASA-N 1 2 301.415 4.259 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@H](CC(C)C)C1 ZINC001192197876 1049052796 /nfs/dbraw/zinc/05/27/96/1049052796.db2.gz HGKCCODHDFYVCU-RHSMWYFYSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H](CC(C)C)C1 ZINC001192197876 1049052806 /nfs/dbraw/zinc/05/28/06/1049052806.db2.gz HGKCCODHDFYVCU-RHSMWYFYSA-N 1 2 323.864 4.312 20 0 DIADLO Fc1cc(Br)cc2c1CC[N@@H+]([C@H]1C=CCCC1)C2 ZINC001192183110 1049057256 /nfs/dbraw/zinc/05/72/56/1049057256.db2.gz FDAUGGWXCBPHMS-ZDUSSCGKSA-N 1 2 310.210 4.055 20 0 DIADLO Fc1cc(Br)cc2c1CC[N@H+]([C@H]1C=CCCC1)C2 ZINC001192183110 1049057267 /nfs/dbraw/zinc/05/72/67/1049057267.db2.gz FDAUGGWXCBPHMS-ZDUSSCGKSA-N 1 2 310.210 4.055 20 0 DIADLO Cc1ccsc1C[NH+](Cc1cccnc1)Cc1cccnc1 ZINC001204022315 1049062331 /nfs/dbraw/zinc/06/23/31/1049062331.db2.gz XNOQGPUSMCIUQK-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO CCCCn1ncc(NCc2c[nH+]cn2CCC)c1C(C)C ZINC001178619913 1049066469 /nfs/dbraw/zinc/06/64/69/1049066469.db2.gz GPYQJNNAPVBUJP-UHFFFAOYSA-N 1 2 303.454 4.025 20 0 DIADLO Cc1ccc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)c(Cl)c1 ZINC001178639824 1049071359 /nfs/dbraw/zinc/07/13/59/1049071359.db2.gz HUUHGIQRPTULTL-UHFFFAOYSA-N 1 2 317.713 4.495 20 0 DIADLO Fc1cccc(F)c1[C@H]1CCC[N@@H+]1Cc1ccc2c(c1)OCO2 ZINC001204053766 1049075089 /nfs/dbraw/zinc/07/50/89/1049075089.db2.gz HGIALUYHPPWWJN-OAHLLOKOSA-N 1 2 317.335 4.031 20 0 DIADLO Fc1cccc(F)c1[C@H]1CCC[N@H+]1Cc1ccc2c(c1)OCO2 ZINC001204053766 1049075101 /nfs/dbraw/zinc/07/51/01/1049075101.db2.gz HGIALUYHPPWWJN-OAHLLOKOSA-N 1 2 317.335 4.031 20 0 DIADLO Cc1cccc(C[N@@H+]2CCSC[C@H]2c2cccc(Cl)c2)n1 ZINC001204067960 1049077404 /nfs/dbraw/zinc/07/74/04/1049077404.db2.gz OKCWZDPLKCHKPI-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cccc(C[N@H+]2CCSC[C@H]2c2cccc(Cl)c2)n1 ZINC001204067960 1049077412 /nfs/dbraw/zinc/07/74/12/1049077412.db2.gz OKCWZDPLKCHKPI-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cccc(CNc2[nH+]c3cc(Cl)ccc3n2C)c1F ZINC001204078667 1049079883 /nfs/dbraw/zinc/07/98/83/1049079883.db2.gz DCRMNEWUYVPBTP-UHFFFAOYSA-N 1 2 303.768 4.286 20 0 DIADLO C[C@@H](c1nc(-c2ccccc2)no1)[N@@H+]1CC[C@H]1c1ccccc1 ZINC000484922774 1049083200 /nfs/dbraw/zinc/08/32/00/1049083200.db2.gz CRURZBYMGNIELT-YOEHRIQHSA-N 1 2 305.381 4.245 20 0 DIADLO C[C@@H](c1nc(-c2ccccc2)no1)[N@H+]1CC[C@H]1c1ccccc1 ZINC000484922774 1049083211 /nfs/dbraw/zinc/08/32/11/1049083211.db2.gz CRURZBYMGNIELT-YOEHRIQHSA-N 1 2 305.381 4.245 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@@H+](Cc1ccc(F)cc1F)C2 ZINC001192381090 1049092175 /nfs/dbraw/zinc/09/21/75/1049092175.db2.gz UQLMUJUTXNOUID-UHFFFAOYSA-N 1 2 317.379 4.312 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@H+](Cc1ccc(F)cc1F)C2 ZINC001192381090 1049092186 /nfs/dbraw/zinc/09/21/86/1049092186.db2.gz UQLMUJUTXNOUID-UHFFFAOYSA-N 1 2 317.379 4.312 20 0 DIADLO C[C@H]([NH2+]Cc1cn(C)nc1Cl)c1cc(Cl)ccc1Cl ZINC000856768468 1049104307 /nfs/dbraw/zinc/10/43/07/1049104307.db2.gz VQMARRHDCKQCOY-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2cccc(F)c2)s1)c1csnn1 ZINC001178971626 1049115358 /nfs/dbraw/zinc/11/53/58/1049115358.db2.gz IYOZETVKJZSFMC-SNVBAGLBSA-N 1 2 319.430 4.257 20 0 DIADLO Fc1ccc2[nH]ccc2c1Nc1ccc[nH+]c1N1CCCCC1 ZINC001204258162 1049123247 /nfs/dbraw/zinc/12/32/47/1049123247.db2.gz ZNGZQNOSJPQOPP-UHFFFAOYSA-N 1 2 310.376 4.436 20 0 DIADLO CC[N@H+](Cc1snc(OC)c1Cl)Cc1ccccc1C ZINC001204261430 1049123771 /nfs/dbraw/zinc/12/37/71/1049123771.db2.gz FXNUJXJCJDODBB-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CC[N@@H+](Cc1snc(OC)c1Cl)Cc1ccccc1C ZINC001204261430 1049123774 /nfs/dbraw/zinc/12/37/74/1049123774.db2.gz FXNUJXJCJDODBB-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO Cc1cccn2cc(Cc3nc(C4CCCCCC4)no3)[nH+]c12 ZINC000904680460 1049124940 /nfs/dbraw/zinc/12/49/40/1049124940.db2.gz WBGRZTWARTUPEL-UHFFFAOYSA-N 1 2 310.401 4.054 20 0 DIADLO Fc1ccc2[nH]ccc2c1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001204289258 1049130282 /nfs/dbraw/zinc/13/02/82/1049130282.db2.gz HWCGBKUMEQXUIQ-UHFFFAOYSA-N 1 2 306.344 4.295 20 0 DIADLO Brc1ccsc1CNc1c[nH+]cc2c1CCCC2 ZINC001179142739 1049130506 /nfs/dbraw/zinc/13/05/06/1049130506.db2.gz LVMWGVCKFJDJLS-UHFFFAOYSA-N 1 2 323.259 4.397 20 0 DIADLO CCCCCCOc1ccccc1C[N@H+]1CCC(=O)[C@H](F)CC1 ZINC001204297083 1049132568 /nfs/dbraw/zinc/13/25/68/1049132568.db2.gz IDRYTSVTIZQZQA-QGZVFWFLSA-N 1 2 321.436 4.149 20 0 DIADLO CCCCCCOc1ccccc1C[N@@H+]1CCC(=O)[C@H](F)CC1 ZINC001204297083 1049132573 /nfs/dbraw/zinc/13/25/73/1049132573.db2.gz IDRYTSVTIZQZQA-QGZVFWFLSA-N 1 2 321.436 4.149 20 0 DIADLO COc1cccc(Nc2ccc(NCc3ccc(C)cn3)[nH+]c2)c1 ZINC001179164996 1049137858 /nfs/dbraw/zinc/13/78/58/1049137858.db2.gz GWHOBRXPRVTTKN-UHFFFAOYSA-N 1 2 320.396 4.149 20 0 DIADLO CCc1cccc(Cl)c1C[N@H+](CCOC)Cc1ccco1 ZINC001204313519 1049138954 /nfs/dbraw/zinc/13/89/54/1049138954.db2.gz MISCBHIBCNKUGA-UHFFFAOYSA-N 1 2 307.821 4.144 20 0 DIADLO CCc1cccc(Cl)c1C[N@@H+](CCOC)Cc1ccco1 ZINC001204313519 1049138959 /nfs/dbraw/zinc/13/89/59/1049138959.db2.gz MISCBHIBCNKUGA-UHFFFAOYSA-N 1 2 307.821 4.144 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C(C)C)s1)c1ccc(C)c(F)c1 ZINC001192909817 1049146622 /nfs/dbraw/zinc/14/66/22/1049146622.db2.gz MWGHPJLSDKOGHZ-CQSZACIVSA-N 1 2 307.438 4.350 20 0 DIADLO Cc1cn2cc(-c3cc(C4CC4)nn3[C@@H]3CCCCO3)ccc2[nH+]1 ZINC000904782358 1049146838 /nfs/dbraw/zinc/14/68/38/1049146838.db2.gz QKKVLEJXXHXEMG-IBGZPJMESA-N 1 2 322.412 4.083 20 0 DIADLO Fc1cccc(F)c1C[NH2+]Cc1ccsc1C(F)(F)F ZINC001179309227 1049152752 /nfs/dbraw/zinc/15/27/52/1049152752.db2.gz XGNYKBIJJVIWIE-UHFFFAOYSA-N 1 2 307.287 4.335 20 0 DIADLO Cc1ccc2[nH+]c(NCc3ccc(OC(F)F)cc3)[nH]c2c1 ZINC001179443282 1049165777 /nfs/dbraw/zinc/16/57/77/1049165777.db2.gz NOYMCDSOJAMDFD-UHFFFAOYSA-N 1 2 303.312 4.085 20 0 DIADLO Cc1cnc2c(c1)C[N@@H+](Cc1ccc(C(F)(F)F)cc1F)CC2 ZINC001204471511 1049170582 /nfs/dbraw/zinc/17/05/82/1049170582.db2.gz QRLHBXFORZYDRW-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1cnc2c(c1)C[N@H+](Cc1ccc(C(F)(F)F)cc1F)CC2 ZINC001204471511 1049170588 /nfs/dbraw/zinc/17/05/88/1049170588.db2.gz QRLHBXFORZYDRW-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Fc1ccc(Br)cc1C[N@H+]1CCC[C@H](C(F)F)C1 ZINC001204496790 1049175797 /nfs/dbraw/zinc/17/57/97/1049175797.db2.gz PYJAWUWLCRZYRZ-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO Fc1ccc(Br)cc1C[N@@H+]1CCC[C@H](C(F)F)C1 ZINC001204496790 1049175805 /nfs/dbraw/zinc/17/58/05/1049175805.db2.gz PYJAWUWLCRZYRZ-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO CC(C)CCc1noc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)n1 ZINC001193052663 1049176495 /nfs/dbraw/zinc/17/64/95/1049176495.db2.gz CAATVPFMQZMOBV-QGZVFWFLSA-N 1 2 313.445 4.385 20 0 DIADLO CC(C)CCc1noc(C[N@H+]2CCCC[C@@H]2c2ccccc2)n1 ZINC001193052663 1049176500 /nfs/dbraw/zinc/17/65/00/1049176500.db2.gz CAATVPFMQZMOBV-QGZVFWFLSA-N 1 2 313.445 4.385 20 0 DIADLO Fc1cc(C[N@@H+]2CCOc3ccccc3C2)ccc1C(F)F ZINC001204514731 1049178371 /nfs/dbraw/zinc/17/83/71/1049178371.db2.gz BMMALYUEBWGSLT-UHFFFAOYSA-N 1 2 307.315 4.158 20 0 DIADLO Fc1cc(C[N@H+]2CCOc3ccccc3C2)ccc1C(F)F ZINC001204514731 1049178376 /nfs/dbraw/zinc/17/83/76/1049178376.db2.gz BMMALYUEBWGSLT-UHFFFAOYSA-N 1 2 307.315 4.158 20 0 DIADLO Cc1cc(C)c2cc(NCc3cccc4c[nH]nc43)ccc2[nH+]1 ZINC001179589235 1049181363 /nfs/dbraw/zinc/18/13/63/1049181363.db2.gz ZFJJDFTYAYDLBJ-UHFFFAOYSA-N 1 2 302.381 4.340 20 0 DIADLO CCCc1cccc(C[N@@H+]2CCO[C@@H](c3ccccc3F)C2)c1 ZINC001204534445 1049185984 /nfs/dbraw/zinc/18/59/84/1049185984.db2.gz RQIPJKKUUNFPQU-HXUWFJFHSA-N 1 2 313.416 4.352 20 0 DIADLO CCCc1cccc(C[N@H+]2CCO[C@@H](c3ccccc3F)C2)c1 ZINC001204534445 1049185992 /nfs/dbraw/zinc/18/59/92/1049185992.db2.gz RQIPJKKUUNFPQU-HXUWFJFHSA-N 1 2 313.416 4.352 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)ccc1F ZINC001204563895 1049189724 /nfs/dbraw/zinc/18/97/24/1049189724.db2.gz RRCOWSWLFRBANY-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)ccc1F ZINC001204563895 1049189729 /nfs/dbraw/zinc/18/97/29/1049189729.db2.gz RRCOWSWLFRBANY-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1ccc(Cl)nc1 ZINC000857757696 1049196313 /nfs/dbraw/zinc/19/63/13/1049196313.db2.gz PCJUBRCYTSWQHR-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000857757696 1049196322 /nfs/dbraw/zinc/19/63/22/1049196322.db2.gz PCJUBRCYTSWQHR-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1ccc(C[S@](=O)Cc2ccccc2CC(C)C)c(C)[nH+]1 ZINC000905193975 1049199961 /nfs/dbraw/zinc/19/99/61/1049199961.db2.gz FQGKRYUWOJJBOQ-QFIPXVFZSA-N 1 2 315.482 4.346 20 0 DIADLO CCn1cc(C[N@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)nn1 ZINC001204615254 1049200830 /nfs/dbraw/zinc/20/08/30/1049200830.db2.gz GQVIYUFTIXJUHO-INIZCTEOSA-N 1 2 320.440 4.158 20 0 DIADLO CCn1cc(C[N@@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)nn1 ZINC001204615254 1049200841 /nfs/dbraw/zinc/20/08/41/1049200841.db2.gz GQVIYUFTIXJUHO-INIZCTEOSA-N 1 2 320.440 4.158 20 0 DIADLO CCNc1nc(C[N@H+](C)C/C(C)=C\c2ccccc2)cs1 ZINC001193372407 1049204273 /nfs/dbraw/zinc/20/42/73/1049204273.db2.gz CEDDVVNQKODRPI-UVTDQMKNSA-N 1 2 301.459 4.110 20 0 DIADLO CCNc1nc(C[N@@H+](C)C/C(C)=C\c2ccccc2)cs1 ZINC001193372407 1049204289 /nfs/dbraw/zinc/20/42/89/1049204289.db2.gz CEDDVVNQKODRPI-UVTDQMKNSA-N 1 2 301.459 4.110 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2ccc(Cl)nc21)c1c(F)cccc1F ZINC000857902896 1049207435 /nfs/dbraw/zinc/20/74/35/1049207435.db2.gz WUNDMYUSTSFODY-NOZJJQNGSA-N 1 2 308.759 4.351 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccccc2OCc2ccccc2)cs1 ZINC000069784995 1049208457 /nfs/dbraw/zinc/20/84/57/1049208457.db2.gz ORZQMOMWMXFFCB-UHFFFAOYSA-N 1 2 324.449 4.320 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](C/C=C\c2ccc(F)cc2)CCO1 ZINC001204648903 1049210862 /nfs/dbraw/zinc/21/08/62/1049210862.db2.gz XTVLVMGQWHTFHI-MNBNYPOFSA-N 1 2 311.400 4.221 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](C/C=C\c2ccc(F)cc2)CCO1 ZINC001204648903 1049210874 /nfs/dbraw/zinc/21/08/74/1049210874.db2.gz XTVLVMGQWHTFHI-MNBNYPOFSA-N 1 2 311.400 4.221 20 0 DIADLO CC(C)CCCCCCNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001204649209 1049212266 /nfs/dbraw/zinc/21/22/66/1049212266.db2.gz UZHDAIOFYPMLNL-UHFFFAOYSA-N 1 2 302.422 4.062 20 0 DIADLO CCCCCC[C@](C)(CCC)C(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000857948923 1049212377 /nfs/dbraw/zinc/21/23/77/1049212377.db2.gz UATBZEJSBOTYGL-LPHOPBHVSA-N 1 2 319.493 4.091 20 0 DIADLO CCC(C)(C)C1CCC(CC(=O)N[C@@H]2CCn3c[nH+]cc32)CC1 ZINC000857979268 1049214087 /nfs/dbraw/zinc/21/40/87/1049214087.db2.gz VILVSGFGWLBBFZ-UYSNPLJNSA-N 1 2 317.477 4.077 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1c(F)ccc(OC(C)C)c1F ZINC001204662743 1049216894 /nfs/dbraw/zinc/21/68/94/1049216894.db2.gz PPWDNFWWCDCZCG-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](CCCC3CCC3)CCO2)c(Cl)c1 ZINC001193544690 1049219282 /nfs/dbraw/zinc/21/92/82/1049219282.db2.gz ASIQTJJBNDIWDX-QGZVFWFLSA-N 1 2 311.828 4.433 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](CCCC3CCC3)CCO2)c(Cl)c1 ZINC001193544690 1049219289 /nfs/dbraw/zinc/21/92/89/1049219289.db2.gz ASIQTJJBNDIWDX-QGZVFWFLSA-N 1 2 311.828 4.433 20 0 DIADLO O=C(c1cccc2[nH+]ccn21)N(c1ccc(F)cc1)C1CCCC1 ZINC000777004443 1049223835 /nfs/dbraw/zinc/22/38/35/1049223835.db2.gz AIKFQBSTBBCDIM-UHFFFAOYSA-N 1 2 323.371 4.063 20 0 DIADLO CC(C)c1ccc(CC[N@@H+]2C[C@@H](C)O[C@H](C(F)(F)F)C2)cc1 ZINC001179879230 1049225263 /nfs/dbraw/zinc/22/52/63/1049225263.db2.gz YTTJZVMGYBLJRL-CJNGLKHVSA-N 1 2 315.379 4.004 20 0 DIADLO CC(C)c1ccc(CC[N@H+]2C[C@@H](C)O[C@H](C(F)(F)F)C2)cc1 ZINC001179879230 1049225275 /nfs/dbraw/zinc/22/52/75/1049225275.db2.gz YTTJZVMGYBLJRL-CJNGLKHVSA-N 1 2 315.379 4.004 20 0 DIADLO Brc1ccoc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000858239362 1049230399 /nfs/dbraw/zinc/23/03/99/1049230399.db2.gz RKMCEOCWHTVYIK-OAHLLOKOSA-N 1 2 321.218 4.068 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CCC1=O ZINC001204710162 1049236316 /nfs/dbraw/zinc/23/63/16/1049236316.db2.gz CLYPNOVWDQNXOC-UHFFFAOYSA-N 1 2 317.816 4.401 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CCC1=O ZINC001204710162 1049236325 /nfs/dbraw/zinc/23/63/25/1049236325.db2.gz CLYPNOVWDQNXOC-UHFFFAOYSA-N 1 2 317.816 4.401 20 0 DIADLO CCSCC[C@H](C)[N@H+](C)Cc1c(Cl)ccnc1Cl ZINC001179957835 1049248160 /nfs/dbraw/zinc/24/81/60/1049248160.db2.gz STIAAEJEXNCFQJ-JTQLQIEISA-N 1 2 307.290 4.352 20 0 DIADLO CCSCC[C@H](C)[N@@H+](C)Cc1c(Cl)ccnc1Cl ZINC001179957835 1049248167 /nfs/dbraw/zinc/24/81/67/1049248167.db2.gz STIAAEJEXNCFQJ-JTQLQIEISA-N 1 2 307.290 4.352 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2scnc21)c1nc2ccccc2s1 ZINC000858365584 1049249041 /nfs/dbraw/zinc/24/90/41/1049249041.db2.gz PEMIFJSMMORGQA-PWSUYJOCSA-N 1 2 315.467 4.481 20 0 DIADLO CC[C@H](C)[C@@H]([NH2+][C@@H]1CC(C)(C)CCc2ccccc21)C(=O)OC ZINC001193743836 1049252040 /nfs/dbraw/zinc/25/20/40/1049252040.db2.gz VNZYWIIBLOINMY-BMGDILEWSA-N 1 2 317.473 4.268 20 0 DIADLO Cc1c(-c2ccc(OCc3ccccc3)nc2)ccc2[nH+]ccn21 ZINC001204764487 1049256743 /nfs/dbraw/zinc/25/67/43/1049256743.db2.gz FRHZJELADLMSQH-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO CC1(C)C[N@H+](Cc2sc(N3CCCC3)nc2Cl)C1(C)C ZINC001204775291 1049262152 /nfs/dbraw/zinc/26/21/52/1049262152.db2.gz BKEQBHHGLDEOND-UHFFFAOYSA-N 1 2 313.898 4.017 20 0 DIADLO CC1(C)C[N@@H+](Cc2sc(N3CCCC3)nc2Cl)C1(C)C ZINC001204775291 1049262164 /nfs/dbraw/zinc/26/21/64/1049262164.db2.gz BKEQBHHGLDEOND-UHFFFAOYSA-N 1 2 313.898 4.017 20 0 DIADLO Clc1cccc2c1CC[C@@H]2[N@@H+]1CCC=C(Br)C1 ZINC001193819582 1049270384 /nfs/dbraw/zinc/27/03/84/1049270384.db2.gz NNKHRESATRBWFM-AWEZNQCLSA-N 1 2 312.638 4.312 20 0 DIADLO Clc1cccc2c1CC[C@@H]2[N@H+]1CCC=C(Br)C1 ZINC001193819582 1049270398 /nfs/dbraw/zinc/27/03/98/1049270398.db2.gz NNKHRESATRBWFM-AWEZNQCLSA-N 1 2 312.638 4.312 20 0 DIADLO COCC1(C2CCC2)C[NH+](Cc2csc(Cl)c2Cl)C1 ZINC000668514593 1049275909 /nfs/dbraw/zinc/27/59/09/1049275909.db2.gz KQGKOBBCBOJKAH-UHFFFAOYSA-N 1 2 320.285 4.303 20 0 DIADLO COc1nccc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)c1F ZINC001180129399 1049277682 /nfs/dbraw/zinc/27/76/82/1049277682.db2.gz QWXNVIMEAXTULE-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)c1F ZINC001180129399 1049277692 /nfs/dbraw/zinc/27/76/92/1049277692.db2.gz QWXNVIMEAXTULE-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3CCO[C@H](c4ccc(F)cc4)C3)cc21 ZINC001204834120 1049280039 /nfs/dbraw/zinc/28/00/39/1049280039.db2.gz VEEJASLAZROOPP-FQEVSTJZSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3CCO[C@H](c4ccc(F)cc4)C3)cc21 ZINC001204834120 1049280054 /nfs/dbraw/zinc/28/00/54/1049280054.db2.gz VEEJASLAZROOPP-FQEVSTJZSA-N 1 2 324.399 4.189 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(F)(F)F)cs1)c1ccns1 ZINC000858578708 1049281171 /nfs/dbraw/zinc/28/11/71/1049281171.db2.gz XQDARBMYPRXJFV-RQJHMYQMSA-N 1 2 307.366 4.030 20 0 DIADLO Cc1nnc(C[N@@H+](C)Cc2sc3c(cccc3Cl)c2C)o1 ZINC000668520034 1049290105 /nfs/dbraw/zinc/29/01/05/1049290105.db2.gz HTYVFKOPDLRKEH-UHFFFAOYSA-N 1 2 321.833 4.187 20 0 DIADLO Cc1nnc(C[N@H+](C)Cc2sc3c(cccc3Cl)c2C)o1 ZINC000668520034 1049290114 /nfs/dbraw/zinc/29/01/14/1049290114.db2.gz HTYVFKOPDLRKEH-UHFFFAOYSA-N 1 2 321.833 4.187 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3CCCC34CC4)c2)[nH+]c1C ZINC000858739229 1049291842 /nfs/dbraw/zinc/29/18/42/1049291842.db2.gz CVBBIFDYOMCTAC-MRXNPFEDSA-N 1 2 309.413 4.212 20 0 DIADLO CC(C)Cc1ncc(C[NH2+]Cc2nc(C(C)C)cs2)s1 ZINC000162973906 1049301093 /nfs/dbraw/zinc/30/10/93/1049301093.db2.gz WHMDQKAXMIUYPB-UHFFFAOYSA-N 1 2 309.504 4.211 20 0 DIADLO Cc1cc2cc(Nc3ccc[nH+]c3N3CCCCC3)cnc2[nH]1 ZINC001204896764 1049303488 /nfs/dbraw/zinc/30/34/88/1049303488.db2.gz PMLNKNSLVPDTAE-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO C[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1csc2ccccc21 ZINC001180225722 1049309608 /nfs/dbraw/zinc/30/96/08/1049309608.db2.gz GHUJSSSRVNSJIL-NSHDSACASA-N 1 2 321.405 4.269 20 0 DIADLO c1ccc([C@@H]2CCC[N@@H+](Cc3noc(C4CCC4)n3)CC2)cc1 ZINC000859116629 1049314419 /nfs/dbraw/zinc/31/44/19/1049314419.db2.gz KUSWYMNXHXKCAR-MRXNPFEDSA-N 1 2 311.429 4.107 20 0 DIADLO c1ccc([C@@H]2CCC[N@H+](Cc3noc(C4CCC4)n3)CC2)cc1 ZINC000859116629 1049314433 /nfs/dbraw/zinc/31/44/33/1049314433.db2.gz KUSWYMNXHXKCAR-MRXNPFEDSA-N 1 2 311.429 4.107 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2ccncc2Br)c1 ZINC001194083885 1049319195 /nfs/dbraw/zinc/31/91/95/1049319195.db2.gz XXLBIVJZBHUSQB-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2ccncc2Br)c1 ZINC001194083885 1049319206 /nfs/dbraw/zinc/31/92/06/1049319206.db2.gz XXLBIVJZBHUSQB-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO C[N@H+](Cc1ccnn1CC1CC1)Cc1cc(Cl)cc(Cl)c1 ZINC001180239397 1049319519 /nfs/dbraw/zinc/31/95/19/1049319519.db2.gz JFBGTIIIQUANTJ-UHFFFAOYSA-N 1 2 324.255 4.232 20 0 DIADLO C[N@@H+](Cc1ccnn1CC1CC1)Cc1cc(Cl)cc(Cl)c1 ZINC001180239397 1049319531 /nfs/dbraw/zinc/31/95/31/1049319531.db2.gz JFBGTIIIQUANTJ-UHFFFAOYSA-N 1 2 324.255 4.232 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)c1 ZINC001180234872 1049319636 /nfs/dbraw/zinc/31/96/36/1049319636.db2.gz SSALJTINKXXPIM-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)c1 ZINC001180234872 1049319645 /nfs/dbraw/zinc/31/96/45/1049319645.db2.gz SSALJTINKXXPIM-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO FC(F)(F)c1cnc(Cl)cc1Nc1ccn2cc[nH+]c2c1 ZINC001204950900 1049319931 /nfs/dbraw/zinc/31/99/31/1049319931.db2.gz GLZWFROHCAEJHR-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO Fc1ccccc1Oc1ccc(Nc2ccn3cc[nH+]c3c2)cn1 ZINC001204959881 1049323313 /nfs/dbraw/zinc/32/33/13/1049323313.db2.gz ZBSUJYYLGWHIHZ-UHFFFAOYSA-N 1 2 320.327 4.404 20 0 DIADLO Fc1cc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)ccn1 ZINC000859277633 1049326910 /nfs/dbraw/zinc/32/69/10/1049326910.db2.gz ZZWCIRMAFPNZQS-UHFFFAOYSA-N 1 2 312.310 4.175 20 0 DIADLO Fc1cc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)ccn1 ZINC000859277633 1049326925 /nfs/dbraw/zinc/32/69/25/1049326925.db2.gz ZZWCIRMAFPNZQS-UHFFFAOYSA-N 1 2 312.310 4.175 20 0 DIADLO C[C@H]([NH2+]Cc1cc(O)ccc1Cl)c1nc2c(s1)CCCC2 ZINC000859262969 1049326989 /nfs/dbraw/zinc/32/69/89/1049326989.db2.gz VFYSFVSIECTYQX-JTQLQIEISA-N 1 2 322.861 4.232 20 0 DIADLO CC(C)[C@@H]1CC[N@@H+]1Cc1c(F)c(Cl)ccc1Br ZINC001204975346 1049328728 /nfs/dbraw/zinc/32/87/28/1049328728.db2.gz JGBKJGMBAKUYDD-LBPRGKRZSA-N 1 2 320.633 4.472 20 0 DIADLO CC(C)[C@@H]1CC[N@H+]1Cc1c(F)c(Cl)ccc1Br ZINC001204975346 1049328745 /nfs/dbraw/zinc/32/87/45/1049328745.db2.gz JGBKJGMBAKUYDD-LBPRGKRZSA-N 1 2 320.633 4.472 20 0 DIADLO Fc1ccc(Nc2ccn3cc[nH+]c3c2)c(Br)c1F ZINC001204978251 1049329705 /nfs/dbraw/zinc/32/97/05/1049329705.db2.gz RIYKRZHOHAWEEG-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Cc1ccc(Br)c(Nc2ccn3cc[nH+]c3c2)c1 ZINC001204982629 1049330489 /nfs/dbraw/zinc/33/04/89/1049330489.db2.gz AYAUXSYMMZOEJM-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO c1cn2ccc(Nc3cccc(Oc4cccnc4)c3)cc2[nH+]1 ZINC001204998133 1049334504 /nfs/dbraw/zinc/33/45/04/1049334504.db2.gz VBXYJPXVVNPGAN-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO CC(C)([NH2+]Cc1cnc(Cl)s1)c1nc2ccccc2s1 ZINC000859468692 1049334569 /nfs/dbraw/zinc/33/45/69/1049334569.db2.gz TWVZCTOFRWLRTO-UHFFFAOYSA-N 1 2 323.874 4.431 20 0 DIADLO O=C(Nc1ccc(Cn2cc[nH+]c2)cc1)c1ccc(C2CC2)cc1 ZINC001194171241 1049336077 /nfs/dbraw/zinc/33/60/77/1049336077.db2.gz ATRHUSFHSDDZSG-UHFFFAOYSA-N 1 2 317.392 4.061 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H]2CC(C)(C)c3ccccc32)c(C)[nH+]1 ZINC001127005200 1049342844 /nfs/dbraw/zinc/34/28/44/1049342844.db2.gz SGNPTKDZYSZSPU-KRWDZBQOSA-N 1 2 308.425 4.159 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(C(C)(C)CC)cc2)C[C@H](C)[S@]1=O ZINC001194239657 1049347269 /nfs/dbraw/zinc/34/72/69/1049347269.db2.gz FFHXIAZBNLLDDG-QXATTWAWSA-N 1 2 321.530 4.106 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(C(C)(C)CC)cc2)C[C@H](C)[S@]1=O ZINC001194239657 1049347282 /nfs/dbraw/zinc/34/72/82/1049347282.db2.gz FFHXIAZBNLLDDG-QXATTWAWSA-N 1 2 321.530 4.106 20 0 DIADLO CC(C)c1noc([C@@H](C)[NH2+][C@@H](C)c2ccc3ncsc3c2)n1 ZINC000485843524 1049349872 /nfs/dbraw/zinc/34/98/72/1049349872.db2.gz JHDJIFDVQVMKSN-WDEREUQCSA-N 1 2 316.430 4.215 20 0 DIADLO CCCn1cncc1C[N@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC001180403476 1049351641 /nfs/dbraw/zinc/35/16/41/1049351641.db2.gz LCNBBPZAWCZSIA-KSSFIOAISA-N 1 2 313.445 4.174 20 0 DIADLO CCCn1cncc1C[N@@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC001180403476 1049351647 /nfs/dbraw/zinc/35/16/47/1049351647.db2.gz LCNBBPZAWCZSIA-KSSFIOAISA-N 1 2 313.445 4.174 20 0 DIADLO CCOc1ccc(-c2cc(Nc3ccc(C)[nH+]c3C)on2)cc1 ZINC001203362673 1049357243 /nfs/dbraw/zinc/35/72/43/1049357243.db2.gz DBUMSIRCWOGCOX-UHFFFAOYSA-N 1 2 309.369 4.496 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+][C@@H](C)c1ccns1 ZINC000860051754 1049365296 /nfs/dbraw/zinc/36/52/96/1049365296.db2.gz QTYQWFUXHDTEBI-VIFPVBQESA-N 1 2 305.428 4.019 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1c2c(nn1C)CCCC2 ZINC001205078006 1049367016 /nfs/dbraw/zinc/36/70/16/1049367016.db2.gz XHTKRGPWJCAZST-CYBMUJFWSA-N 1 2 317.864 4.145 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1c2c(nn1C)CCCC2 ZINC001205078006 1049367027 /nfs/dbraw/zinc/36/70/27/1049367027.db2.gz XHTKRGPWJCAZST-CYBMUJFWSA-N 1 2 317.864 4.145 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cnn(Cc3ccccc3)c2)c(F)c1 ZINC001180452891 1049367344 /nfs/dbraw/zinc/36/73/44/1049367344.db2.gz QLZMGZBCWMWYJQ-UHFFFAOYSA-N 1 2 323.415 4.011 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cnn(Cc3ccccc3)c2)c(F)c1 ZINC001180452891 1049367354 /nfs/dbraw/zinc/36/73/54/1049367354.db2.gz QLZMGZBCWMWYJQ-UHFFFAOYSA-N 1 2 323.415 4.011 20 0 DIADLO CCOc1ccc(CNc2cc(CSCC)cc[nH+]2)cc1F ZINC000485984721 1049373871 /nfs/dbraw/zinc/37/38/71/1049373871.db2.gz SSLJHOGQERHCLZ-UHFFFAOYSA-N 1 2 320.433 4.485 20 0 DIADLO Oc1ccc(-c2ccccc2Cn2cc[nH+]c2)c(C(F)(F)F)c1 ZINC001205097702 1049375910 /nfs/dbraw/zinc/37/59/10/1049375910.db2.gz GMKGZDJPKWDQSG-UHFFFAOYSA-N 1 2 318.298 4.323 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(O)cc2C(F)(F)F)c1 ZINC001205097856 1049376623 /nfs/dbraw/zinc/37/66/23/1049376623.db2.gz KBEZNCOQJOSRDO-UHFFFAOYSA-N 1 2 318.298 4.479 20 0 DIADLO CN(CCCn1cc[nH+]c1)c1ccc2c(c1)oc1ccccc12 ZINC001194436750 1049377593 /nfs/dbraw/zinc/37/75/93/1049377593.db2.gz XWLICZKLSFZQMH-UHFFFAOYSA-N 1 2 305.381 4.309 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)cc1Cl ZINC001180540985 1049379260 /nfs/dbraw/zinc/37/92/60/1049379260.db2.gz YAQPVHPAKZNFGA-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@H](c3ccccc3)C2)cc1Cl ZINC001180540985 1049379272 /nfs/dbraw/zinc/37/92/72/1049379272.db2.gz YAQPVHPAKZNFGA-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Fc1cccc(C[N@H+](Cc2nc(-c3ccccc3)c[nH]2)C2CC2)c1 ZINC001180558074 1049380104 /nfs/dbraw/zinc/38/01/04/1049380104.db2.gz JEVQWPUDCGZEOU-UHFFFAOYSA-N 1 2 321.399 4.380 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2nc(-c3ccccc3)c[nH]2)C2CC2)c1 ZINC001180558074 1049380120 /nfs/dbraw/zinc/38/01/20/1049380120.db2.gz JEVQWPUDCGZEOU-UHFFFAOYSA-N 1 2 321.399 4.380 20 0 DIADLO CCc1ccc(C2=CC[N@H+](Cc3nccn3C3CC3)CC2)cc1 ZINC001180768883 1049405280 /nfs/dbraw/zinc/40/52/80/1049405280.db2.gz KWULDGSYPJQJLH-UHFFFAOYSA-N 1 2 307.441 4.070 20 0 DIADLO CCc1ccc(C2=CC[N@@H+](Cc3nccn3C3CC3)CC2)cc1 ZINC001180768883 1049405284 /nfs/dbraw/zinc/40/52/84/1049405284.db2.gz KWULDGSYPJQJLH-UHFFFAOYSA-N 1 2 307.441 4.070 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cccnc2)Cc2ccccn2)cc1F ZINC001205228289 1049412662 /nfs/dbraw/zinc/41/26/62/1049412662.db2.gz TXCRGKVIXYCLPF-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cccnc2)Cc2ccccn2)cc1F ZINC001205228289 1049412667 /nfs/dbraw/zinc/41/26/67/1049412667.db2.gz TXCRGKVIXYCLPF-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@](C)(c3ccc(F)cc3)C2)cc1F ZINC001205243391 1049416857 /nfs/dbraw/zinc/41/68/57/1049416857.db2.gz FJRWGCYGMQVACR-LJQANCHMSA-N 1 2 317.379 4.021 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@](C)(c3ccc(F)cc3)C2)cc1F ZINC001205243391 1049416860 /nfs/dbraw/zinc/41/68/60/1049416860.db2.gz FJRWGCYGMQVACR-LJQANCHMSA-N 1 2 317.379 4.021 20 0 DIADLO CC(C)Cc1ccc([C@H](C)C(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001180903633 1049417168 /nfs/dbraw/zinc/41/71/68/1049417168.db2.gz UATQMLHHSGCZBJ-HNNXBMFYSA-N 1 2 321.424 4.275 20 0 DIADLO Cc1cc(CN2CC(C)(C)Oc3ccccc32)c2c([nH+]1)CCCC2 ZINC001205252921 1049418281 /nfs/dbraw/zinc/41/82/81/1049418281.db2.gz BKSYIDWRMMULPE-UHFFFAOYSA-N 1 2 322.452 4.446 20 0 DIADLO COc1cc2c(cc1Cl)C[N@H+](Cc1ccc(F)cc1)CC2 ZINC001194723626 1049422634 /nfs/dbraw/zinc/42/26/34/1049422634.db2.gz LEZCPJASCUSLJE-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc2c(cc1Cl)C[N@@H+](Cc1ccc(F)cc1)CC2 ZINC001194723626 1049422639 /nfs/dbraw/zinc/42/26/39/1049422639.db2.gz LEZCPJASCUSLJE-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Fc1cccc(CCC[N@@H+]2CCn3c(cc4ccccc43)C2)c1 ZINC001194723080 1049422971 /nfs/dbraw/zinc/42/29/71/1049422971.db2.gz FPBPEJBBKTUENO-UHFFFAOYSA-N 1 2 308.400 4.229 20 0 DIADLO Fc1cccc(CCC[N@H+]2CCn3c(cc4ccccc43)C2)c1 ZINC001194723080 1049422978 /nfs/dbraw/zinc/42/29/78/1049422978.db2.gz FPBPEJBBKTUENO-UHFFFAOYSA-N 1 2 308.400 4.229 20 0 DIADLO Cc1oc2ccccc2c1C[NH2+]Cc1nc(-c2ccccc2)no1 ZINC001205299993 1049433006 /nfs/dbraw/zinc/43/30/06/1049433006.db2.gz UDOASAJQXXCIFP-UHFFFAOYSA-N 1 2 319.364 4.081 20 0 DIADLO CC[C@@H](CC1CCCCC1)[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC001205321084 1049438078 /nfs/dbraw/zinc/43/80/78/1049438078.db2.gz XPPURWTVBJDPRG-ZWKOTPCHSA-N 1 2 312.461 4.233 20 0 DIADLO CCCOc1cccc2c(N(C)Cc3cscn3)cc[nH+]c12 ZINC000486568901 1049439303 /nfs/dbraw/zinc/43/93/03/1049439303.db2.gz UXTXMNXDNRFTTO-UHFFFAOYSA-N 1 2 313.426 4.117 20 0 DIADLO Cc1ccc2c(c1)O[C@H](C)CN2Cc1cc(C)[nH+]c2c1CCCC2 ZINC001181072638 1049441921 /nfs/dbraw/zinc/44/19/21/1049441921.db2.gz JJTCGODWHPJVRX-MRXNPFEDSA-N 1 2 322.452 4.365 20 0 DIADLO Cc1cn2cc(-c3ccc(Oc4ccccc4)nc3)ccc2[nH+]1 ZINC001205351009 1049445586 /nfs/dbraw/zinc/44/55/86/1049445586.db2.gz WDOOJLUBZWYDDY-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1ccc(Oc2ccccc2)nc1 ZINC001205350652 1049445875 /nfs/dbraw/zinc/44/58/75/1049445875.db2.gz SCNUGSLQUOJSNK-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC001194890876 1049450659 /nfs/dbraw/zinc/45/06/59/1049450659.db2.gz NEDYZDOPCNZVJG-GXTWGEPZSA-N 1 2 309.475 4.251 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC001194890876 1049450668 /nfs/dbraw/zinc/45/06/68/1049450668.db2.gz NEDYZDOPCNZVJG-GXTWGEPZSA-N 1 2 309.475 4.251 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(Oc2ccccc2)nc1 ZINC001205361312 1049451196 /nfs/dbraw/zinc/45/11/96/1049451196.db2.gz MSFAEBCZDCOLBP-UHFFFAOYSA-N 1 2 317.348 4.197 20 0 DIADLO Cc1ccccc1-c1noc([C@@H](C)[N@H+](C)Cc2ccsc2)n1 ZINC000152926765 1049451695 /nfs/dbraw/zinc/45/16/95/1049451695.db2.gz FLUHEYRCKCHBJG-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccccc1-c1noc([C@@H](C)[N@@H+](C)Cc2ccsc2)n1 ZINC000152926765 1049451705 /nfs/dbraw/zinc/45/17/05/1049451705.db2.gz FLUHEYRCKCHBJG-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC001194974863 1049458565 /nfs/dbraw/zinc/45/85/65/1049458565.db2.gz QNARCWOLMMIHMV-WMZOPIPTSA-N 1 2 315.457 4.336 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC001194974863 1049458569 /nfs/dbraw/zinc/45/85/69/1049458569.db2.gz QNARCWOLMMIHMV-WMZOPIPTSA-N 1 2 315.457 4.336 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC001194974860 1049459176 /nfs/dbraw/zinc/45/91/76/1049459176.db2.gz QNARCWOLMMIHMV-FUHWJXTLSA-N 1 2 315.457 4.336 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC001194974860 1049459186 /nfs/dbraw/zinc/45/91/86/1049459186.db2.gz QNARCWOLMMIHMV-FUHWJXTLSA-N 1 2 315.457 4.336 20 0 DIADLO Clc1cscc1C[N@@H+]1CC2(CCOCC2)[C@H]1c1ccco1 ZINC000668673054 1049462259 /nfs/dbraw/zinc/46/22/59/1049462259.db2.gz GTLUDCNZRARJMF-OAHLLOKOSA-N 1 2 323.845 4.348 20 0 DIADLO Clc1cscc1C[N@H+]1CC2(CCOCC2)[C@H]1c1ccco1 ZINC000668673054 1049462267 /nfs/dbraw/zinc/46/22/67/1049462267.db2.gz GTLUDCNZRARJMF-OAHLLOKOSA-N 1 2 323.845 4.348 20 0 DIADLO CC(C)Oc1ccc[nH+]c1N[C@H](C)CCc1n[nH]c2ccccc12 ZINC001205431850 1049469597 /nfs/dbraw/zinc/46/95/97/1049469597.db2.gz UMLFWGHSCBNZKY-CQSZACIVSA-N 1 2 324.428 4.178 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cc(F)ccc2F)cc1Cl ZINC001195224669 1049499321 /nfs/dbraw/zinc/49/93/21/1049499321.db2.gz MUMWHNTVZOGJAL-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cc(F)ccc2F)cc1Cl ZINC001195224669 1049499329 /nfs/dbraw/zinc/49/93/29/1049499329.db2.gz MUMWHNTVZOGJAL-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccc(C[N@@H+]2Cc3cnc(C)cc3C2)c2ccccc12 ZINC001203995028 1049507163 /nfs/dbraw/zinc/50/71/63/1049507163.db2.gz HSODMQQPUWVIBS-UHFFFAOYSA-N 1 2 304.393 4.068 20 0 DIADLO COc1ccc(C[N@H+]2Cc3cnc(C)cc3C2)c2ccccc12 ZINC001203995028 1049507180 /nfs/dbraw/zinc/50/71/80/1049507180.db2.gz HSODMQQPUWVIBS-UHFFFAOYSA-N 1 2 304.393 4.068 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)Cc2ccsc2)cc1OC ZINC001205629130 1049516683 /nfs/dbraw/zinc/51/66/83/1049516683.db2.gz RZUWJTYULBIWPF-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)Cc2ccsc2)cc1OC ZINC001205629130 1049516693 /nfs/dbraw/zinc/51/66/93/1049516693.db2.gz RZUWJTYULBIWPF-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2cccnc2Br)c1 ZINC001205655917 1049523061 /nfs/dbraw/zinc/52/30/61/1049523061.db2.gz GYZCGCAMXPVNRO-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2cccnc2Br)c1 ZINC001205655917 1049523076 /nfs/dbraw/zinc/52/30/76/1049523076.db2.gz GYZCGCAMXPVNRO-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO C[N@H+](Cc1nc(-c2ccccc2)c[nH]1)Cc1ccc2[nH]ccc2c1 ZINC001205706319 1049536711 /nfs/dbraw/zinc/53/67/11/1049536711.db2.gz FILASYCTDJDQCQ-UHFFFAOYSA-N 1 2 316.408 4.190 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccccc2)c[nH]1)Cc1ccc2[nH]ccc2c1 ZINC001205706319 1049536724 /nfs/dbraw/zinc/53/67/24/1049536724.db2.gz FILASYCTDJDQCQ-UHFFFAOYSA-N 1 2 316.408 4.190 20 0 DIADLO C[N@H+](Cc1cc2cc(Cl)cnc2o1)Cc1c(F)cccc1F ZINC001181946964 1049551498 /nfs/dbraw/zinc/55/14/98/1049551498.db2.gz VJANPVGAFQMHIN-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO C[N@@H+](Cc1cc2cc(Cl)cnc2o1)Cc1c(F)cccc1F ZINC001181946964 1049551514 /nfs/dbraw/zinc/55/15/14/1049551514.db2.gz VJANPVGAFQMHIN-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO Cc1scc(C[N@H+](C)Cc2nc(-c3cccs3)no2)c1C ZINC001205766969 1049558068 /nfs/dbraw/zinc/55/80/68/1049558068.db2.gz UPCPZDCVQZNZCU-UHFFFAOYSA-N 1 2 319.455 4.108 20 0 DIADLO Cc1scc(C[N@@H+](C)Cc2nc(-c3cccs3)no2)c1C ZINC001205766969 1049558079 /nfs/dbraw/zinc/55/80/79/1049558079.db2.gz UPCPZDCVQZNZCU-UHFFFAOYSA-N 1 2 319.455 4.108 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@H]1CC1(C)C ZINC000487547670 1049558541 /nfs/dbraw/zinc/55/85/41/1049558541.db2.gz ALNNULQGHGVKHU-WMLDXEAASA-N 1 2 307.441 4.448 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(Br)cc(C(F)(F)F)c2)[C@H]1C ZINC001182061280 1049566054 /nfs/dbraw/zinc/56/60/54/1049566054.db2.gz CYWVEYJAWSENAG-IUCAKERBSA-N 1 2 322.168 4.308 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(Br)cc(C(F)(F)F)c2)[C@H]1C ZINC001182061280 1049566064 /nfs/dbraw/zinc/56/60/64/1049566064.db2.gz CYWVEYJAWSENAG-IUCAKERBSA-N 1 2 322.168 4.308 20 0 DIADLO CC[C@H]1C[N@H+](Cc2ccc(OC(C)C)c(Cl)c2)[C@H](C)CO1 ZINC001195748553 1049566472 /nfs/dbraw/zinc/56/64/72/1049566472.db2.gz LMGATJCYXHDDEZ-HIFRSBDPSA-N 1 2 311.853 4.127 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2ccc(OC(C)C)c(Cl)c2)[C@H](C)CO1 ZINC001195748553 1049566485 /nfs/dbraw/zinc/56/64/85/1049566485.db2.gz LMGATJCYXHDDEZ-HIFRSBDPSA-N 1 2 311.853 4.127 20 0 DIADLO CCC(F)(F)C[NH2+]Cc1c(-c2ccccc2)nc2sccn21 ZINC000863502406 1049568936 /nfs/dbraw/zinc/56/89/36/1049568936.db2.gz WPIPSFKAHJLQFH-UHFFFAOYSA-N 1 2 321.396 4.198 20 0 DIADLO Cc1ccc(-c2noc([C@H]([NH3+])c3cccc(Cl)c3)n2)cc1C ZINC001205806782 1049569904 /nfs/dbraw/zinc/56/99/04/1049569904.db2.gz STDZOJHGCLLYMV-OAHLLOKOSA-N 1 2 313.788 4.055 20 0 DIADLO CCc1cccc(-c2noc([C@H]([NH3+])c3cccc(Cl)c3)n2)c1 ZINC001205812118 1049570207 /nfs/dbraw/zinc/57/02/07/1049570207.db2.gz LHUMKIGLCJWITB-OAHLLOKOSA-N 1 2 313.788 4.001 20 0 DIADLO Cc1ccc(Nc2nc(Cl)ccc2Br)c(C)[nH+]1 ZINC001203369601 1049572970 /nfs/dbraw/zinc/57/29/70/1049572970.db2.gz ASKSKXLJPNPDKQ-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO C[N@H+](Cc1cscc1Cl)[C@H](CO)c1ccc(Cl)cc1 ZINC001205925428 1049605150 /nfs/dbraw/zinc/60/51/50/1049605150.db2.gz NJZGOBLALYKUHX-CQSZACIVSA-N 1 2 316.253 4.220 20 0 DIADLO C[N@@H+](Cc1cscc1Cl)[C@H](CO)c1ccc(Cl)cc1 ZINC001205925428 1049605154 /nfs/dbraw/zinc/60/51/54/1049605154.db2.gz NJZGOBLALYKUHX-CQSZACIVSA-N 1 2 316.253 4.220 20 0 DIADLO COc1cccc(Cn2nc(C)cc2Nc2ccc(C)[nH+]c2C)c1 ZINC001203369873 1049580490 /nfs/dbraw/zinc/58/04/90/1049580490.db2.gz UUQBIYCCQJSJBW-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO CC(C)OC(=O)[C@H](C)[NH2+][C@@H]1CCCC[C@H]1c1ccccc1Cl ZINC001205849016 1049582095 /nfs/dbraw/zinc/58/20/95/1049582095.db2.gz KUDNBKUDPVDHLJ-JLJPHGGASA-N 1 2 323.864 4.296 20 0 DIADLO Cc1cc(Nc2ccc(C)[nH+]c2C)n(Cc2ccc(F)cc2)n1 ZINC001203370070 1049586942 /nfs/dbraw/zinc/58/69/42/1049586942.db2.gz WKFVXMHWBKCWKT-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1cc(-c2cccs2)on1 ZINC000487987536 1049588741 /nfs/dbraw/zinc/58/87/41/1049588741.db2.gz LMDPYKWIFDEBRC-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1cc(-c2cccs2)on1 ZINC000487987536 1049588753 /nfs/dbraw/zinc/58/87/53/1049588753.db2.gz LMDPYKWIFDEBRC-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO COc1ccc(NCc2cc(C)[nH+]c(C)c2)c(Br)c1 ZINC001205882517 1049592433 /nfs/dbraw/zinc/59/24/33/1049592433.db2.gz LPMIGZBRYAIQRA-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@@H]2c2ccc(F)cc2)cc1Cl ZINC001195954495 1049598431 /nfs/dbraw/zinc/59/84/31/1049598431.db2.gz KHJKWXJDVQBJCM-MRXNPFEDSA-N 1 2 305.780 4.435 20 0 DIADLO COc1ccc(C[N@H+]2CC[C@@H]2c2ccc(F)cc2)cc1Cl ZINC001195954495 1049598448 /nfs/dbraw/zinc/59/84/48/1049598448.db2.gz KHJKWXJDVQBJCM-MRXNPFEDSA-N 1 2 305.780 4.435 20 0 DIADLO C[C@H](Cc1cccc(F)c1)[N@H+](C)Cc1c(Cl)ccnc1F ZINC001182273018 1049599397 /nfs/dbraw/zinc/59/93/97/1049599397.db2.gz YZJJRVUDPRUNAU-LLVKDONJSA-N 1 2 310.775 4.076 20 0 DIADLO C[C@H](Cc1cccc(F)c1)[N@@H+](C)Cc1c(Cl)ccnc1F ZINC001182273018 1049599405 /nfs/dbraw/zinc/59/94/05/1049599405.db2.gz YZJJRVUDPRUNAU-LLVKDONJSA-N 1 2 310.775 4.076 20 0 DIADLO CCCCC[C@H](CC)C(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000775676607 1049601037 /nfs/dbraw/zinc/60/10/37/1049601037.db2.gz VGBWIBSUWOKCKK-KRWDZBQOSA-N 1 2 313.445 4.095 20 0 DIADLO C[N@H+](Cc1cscc1Cl)[C@@H](CO)c1ccc(Cl)cc1 ZINC001205925422 1049605187 /nfs/dbraw/zinc/60/51/87/1049605187.db2.gz NJZGOBLALYKUHX-AWEZNQCLSA-N 1 2 316.253 4.220 20 0 DIADLO C[N@@H+](Cc1cscc1Cl)[C@@H](CO)c1ccc(Cl)cc1 ZINC001205925422 1049605193 /nfs/dbraw/zinc/60/51/93/1049605193.db2.gz NJZGOBLALYKUHX-AWEZNQCLSA-N 1 2 316.253 4.220 20 0 DIADLO CC[N@H+](C/C=C/c1ccc(Cl)cc1)[C@@H](C)C(=O)OC(C)(C)C ZINC001196058183 1049607628 /nfs/dbraw/zinc/60/76/28/1049607628.db2.gz YDUZNUVLYFZDQE-NPQIQWPPSA-N 1 2 323.864 4.405 20 0 DIADLO CC[N@@H+](C/C=C/c1ccc(Cl)cc1)[C@@H](C)C(=O)OC(C)(C)C ZINC001196058183 1049607634 /nfs/dbraw/zinc/60/76/34/1049607634.db2.gz YDUZNUVLYFZDQE-NPQIQWPPSA-N 1 2 323.864 4.405 20 0 DIADLO C[C@@H](Nc1ccc([NH+]2CCCC2)cc1)c1cccc2c1OCO2 ZINC000863987593 1049608547 /nfs/dbraw/zinc/60/85/47/1049608547.db2.gz XFYKYJWOAXFEHY-CQSZACIVSA-N 1 2 310.397 4.189 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc(C(C)(C)O)cc2)ccc1[NH+](C)C ZINC000863986469 1049609154 /nfs/dbraw/zinc/60/91/54/1049609154.db2.gz AITAYRCFROUDTB-OAHLLOKOSA-N 1 2 312.457 4.462 20 0 DIADLO C[C@@]1(F)CCC[N@H+](Cc2ccc(OCC(F)(F)F)c(F)c2)C1 ZINC001205960639 1049610781 /nfs/dbraw/zinc/61/07/81/1049610781.db2.gz WXDYQSFJVRFRRB-CQSZACIVSA-N 1 2 323.305 4.091 20 0 DIADLO C[C@@]1(F)CCC[N@@H+](Cc2ccc(OCC(F)(F)F)c(F)c2)C1 ZINC001205960639 1049610801 /nfs/dbraw/zinc/61/08/01/1049610801.db2.gz WXDYQSFJVRFRRB-CQSZACIVSA-N 1 2 323.305 4.091 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccc(C(C)(C)O)cc1 ZINC000864001532 1049611531 /nfs/dbraw/zinc/61/15/31/1049611531.db2.gz MEFIXKXAWWNOGE-HNNXBMFYSA-N 1 2 324.468 4.470 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccc(C(C)(C)O)cc1 ZINC000864001532 1049611535 /nfs/dbraw/zinc/61/15/35/1049611535.db2.gz MEFIXKXAWWNOGE-HNNXBMFYSA-N 1 2 324.468 4.470 20 0 DIADLO Fc1cccc([C@@H]2COCC[N@@H+]2CC[C@@H]2CCCC2(F)F)c1 ZINC001196142349 1049617661 /nfs/dbraw/zinc/61/76/61/1049617661.db2.gz JQKNCQXZALLILO-HOCLYGCPSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1cccc([C@@H]2COCC[N@H+]2CC[C@@H]2CCCC2(F)F)c1 ZINC001196142349 1049617668 /nfs/dbraw/zinc/61/76/68/1049617668.db2.gz JQKNCQXZALLILO-HOCLYGCPSA-N 1 2 313.363 4.025 20 0 DIADLO Cc1nn(-c2cc(C)ccc2C)c(Cl)c1C[NH+]1CC2(CC2)C1 ZINC000864049699 1049638844 /nfs/dbraw/zinc/63/88/44/1049638844.db2.gz WNGHXVSCIAPNLG-UHFFFAOYSA-N 1 2 315.848 4.047 20 0 DIADLO C[N@H+](Cc1cc2ccc(F)cc2[nH]1)Cc1ccc(F)cc1F ZINC000488349126 1049638995 /nfs/dbraw/zinc/63/89/95/1049638995.db2.gz NJCPLZVMHNJYEO-UHFFFAOYSA-N 1 2 304.315 4.217 20 0 DIADLO C[N@@H+](Cc1cc2ccc(F)cc2[nH]1)Cc1ccc(F)cc1F ZINC000488349126 1049638999 /nfs/dbraw/zinc/63/89/99/1049638999.db2.gz NJCPLZVMHNJYEO-UHFFFAOYSA-N 1 2 304.315 4.217 20 0 DIADLO Cc1ccccc1N(C)Cc1c[nH+]c(N(C)C)c2ccccc12 ZINC001196358804 1049646656 /nfs/dbraw/zinc/64/66/56/1049646656.db2.gz WZOLOMCFPDLVEY-UHFFFAOYSA-N 1 2 305.425 4.246 20 0 DIADLO Cc1ccc2[nH+]cc(CN3CCC(C)(C)c4ccccc43)n2c1 ZINC001206078323 1049648785 /nfs/dbraw/zinc/64/87/85/1049648785.db2.gz UBIMYKMQGLDCRK-UHFFFAOYSA-N 1 2 305.425 4.331 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@H](C3CCCCC3)C2)no1 ZINC001196410928 1049654186 /nfs/dbraw/zinc/65/41/86/1049654186.db2.gz WCCKMRANBKWAGZ-INIZCTEOSA-N 1 2 305.466 4.205 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@H](C3CCCCC3)C2)no1 ZINC001196410928 1049654193 /nfs/dbraw/zinc/65/41/93/1049654193.db2.gz WCCKMRANBKWAGZ-INIZCTEOSA-N 1 2 305.466 4.205 20 0 DIADLO CC(C)(C)[C@H]1C[C@@H](Nc2ccc(N3CCCC3)c[nH+]2)CS1 ZINC000488440018 1049654426 /nfs/dbraw/zinc/65/44/26/1049654426.db2.gz IQHLVCBWPYJOJB-UKRRQHHQSA-N 1 2 305.491 4.014 20 0 DIADLO Fc1cc(-c2ccccc2Cn2cc[nH+]c2)cc(N2CCCC2)c1 ZINC001206120982 1049659118 /nfs/dbraw/zinc/65/91/18/1049659118.db2.gz CNUUASZCFHGZQA-UHFFFAOYSA-N 1 2 321.399 4.338 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+][C@@H](C)c1nnc([C@H](C)CC)[nH]1 ZINC000488501994 1049664136 /nfs/dbraw/zinc/66/41/36/1049664136.db2.gz MCNFAAKVSNXJGN-RDBSUJKOSA-N 1 2 316.449 4.129 20 0 DIADLO Cc1cc(Br)cc(C[NH+]2CC(C)(CC(F)F)C2)c1 ZINC001182556391 1049682548 /nfs/dbraw/zinc/68/25/48/1049682548.db2.gz WGVBUQIGPWEUQT-UHFFFAOYSA-N 1 2 318.205 4.235 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2nnc(-c3ccccc3)s2)CC1 ZINC000645980965 1049683183 /nfs/dbraw/zinc/68/31/83/1049683183.db2.gz WKQMRLWQDKVOCO-UHFFFAOYSA-N 1 2 321.449 4.292 20 0 DIADLO CC(C)(C)OC(=O)[C@@H](Cc1ccccc1)[NH2+]CCCC1CCC1 ZINC001196735369 1049685870 /nfs/dbraw/zinc/68/58/70/1049685870.db2.gz DFYYQWWEJGKALD-GOSISDBHSA-N 1 2 317.473 4.109 20 0 DIADLO COC[C@H]([NH2+]Cc1c(F)cccc1F)c1ccc(Cl)cc1 ZINC000488700811 1049688708 /nfs/dbraw/zinc/68/87/08/1049688708.db2.gz GLFKYFRUGCGYBM-INIZCTEOSA-N 1 2 311.759 4.096 20 0 DIADLO CC(C)(C)OC(=O)C[N@H+](Cc1ccc2occc2c1)C1CCC1 ZINC001182633763 1049691606 /nfs/dbraw/zinc/69/16/06/1049691606.db2.gz GCYHIFRIDCEESI-UHFFFAOYSA-N 1 2 315.413 4.129 20 0 DIADLO CC(C)(C)OC(=O)C[N@@H+](Cc1ccc2occc2c1)C1CCC1 ZINC001182633763 1049691618 /nfs/dbraw/zinc/69/16/18/1049691618.db2.gz GCYHIFRIDCEESI-UHFFFAOYSA-N 1 2 315.413 4.129 20 0 DIADLO COC(=O)[C@@H](c1ccsc1)[N@H+](C)C[C@@H](C)C1CCCCC1 ZINC001196818612 1049692778 /nfs/dbraw/zinc/69/27/78/1049692778.db2.gz LVGNLNKBBUDEFU-CZUORRHYSA-N 1 2 309.475 4.110 20 0 DIADLO COC(=O)[C@@H](c1ccsc1)[N@@H+](C)C[C@@H](C)C1CCCCC1 ZINC001196818612 1049692783 /nfs/dbraw/zinc/69/27/83/1049692783.db2.gz LVGNLNKBBUDEFU-CZUORRHYSA-N 1 2 309.475 4.110 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)cnc1F ZINC001206276635 1049696530 /nfs/dbraw/zinc/69/65/30/1049696530.db2.gz LZLHJNVFNOGPDL-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)cnc1F ZINC001206276635 1049696542 /nfs/dbraw/zinc/69/65/42/1049696542.db2.gz LZLHJNVFNOGPDL-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO FC(F)(F)[C@H]1CC=C(Nc2ccc(N3CCCC3)[nH+]c2)CC1 ZINC001196890160 1049697527 /nfs/dbraw/zinc/69/75/27/1049697527.db2.gz RGNIIRZFMUXJTO-LBPRGKRZSA-N 1 2 311.351 4.340 20 0 DIADLO FC(F)(F)[C@@H]1CC=C(Nc2ccc(N3CCCC3)[nH+]c2)CC1 ZINC001196890159 1049698493 /nfs/dbraw/zinc/69/84/93/1049698493.db2.gz RGNIIRZFMUXJTO-GFCCVEGCSA-N 1 2 311.351 4.340 20 0 DIADLO Cc1cc(C)c2c(c1)N(Cc1cc(C)[nH+]c3c1CCCC3)CCO2 ZINC001182694409 1049701703 /nfs/dbraw/zinc/70/17/03/1049701703.db2.gz UBNCNXWNRBYMPH-UHFFFAOYSA-N 1 2 322.452 4.285 20 0 DIADLO CSC[C@@H]1CCCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000488977518 1049714632 /nfs/dbraw/zinc/71/46/32/1049714632.db2.gz MDEXMRFYPNEETH-GFCCVEGCSA-N 1 2 306.862 4.468 20 0 DIADLO CCCCC[C@@H]1CCCN1C(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000489286934 1049740290 /nfs/dbraw/zinc/74/02/90/1049740290.db2.gz BXASOUBOGODOJO-QGZVFWFLSA-N 1 2 311.429 4.057 20 0 DIADLO CC(C)(C)Oc1ncccc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001206501119 1049745217 /nfs/dbraw/zinc/74/52/17/1049745217.db2.gz FZXISNIGRZXKFP-UHFFFAOYSA-N 1 2 308.385 4.188 20 0 DIADLO CC(C)(C)Oc1ncccc1Nc1ccccc1-n1cc[nH+]c1 ZINC001206501484 1049746278 /nfs/dbraw/zinc/74/62/78/1049746278.db2.gz YNTPBVQQGPSLHR-UHFFFAOYSA-N 1 2 308.385 4.188 20 0 DIADLO CC[C@H]1CN(Cc2c[nH+]cn2C(C)C)c2cccc(Cl)c2O1 ZINC001206512798 1049749062 /nfs/dbraw/zinc/74/90/62/1049749062.db2.gz ALBHPIXPBDSZBQ-AWEZNQCLSA-N 1 2 319.836 4.295 20 0 DIADLO CC[C@H]1C[N@H+](Cc2ccc(Oc3ccccc3)o2)[C@H](C)CO1 ZINC001206523315 1049750423 /nfs/dbraw/zinc/75/04/23/1049750423.db2.gz JHJZCUCLTXULQU-CABCVRRESA-N 1 2 301.386 4.071 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)o2)[C@H](C)CO1 ZINC001206523315 1049750430 /nfs/dbraw/zinc/75/04/30/1049750430.db2.gz JHJZCUCLTXULQU-CABCVRRESA-N 1 2 301.386 4.071 20 0 DIADLO C[C@@H]1c2sccc2CC[N@H+]1Cc1noc2c1CC(C)(C)CC2 ZINC001197431648 1049752996 /nfs/dbraw/zinc/75/29/96/1049752996.db2.gz HRHAWFHGYVHRCC-GFCCVEGCSA-N 1 2 316.470 4.370 20 0 DIADLO C[C@@H]1c2sccc2CC[N@@H+]1Cc1noc2c1CC(C)(C)CC2 ZINC001197431648 1049753003 /nfs/dbraw/zinc/75/30/03/1049753003.db2.gz HRHAWFHGYVHRCC-GFCCVEGCSA-N 1 2 316.470 4.370 20 0 DIADLO FC(F)(F)c1cc(C[NH+]2CCC(C3CCCCC3)CC2)[nH]n1 ZINC001206569785 1049758789 /nfs/dbraw/zinc/75/87/89/1049758789.db2.gz XYULNWITUMNABT-UHFFFAOYSA-N 1 2 315.383 4.221 20 0 DIADLO Fc1nccc(Cl)c1C[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC001206629084 1049773283 /nfs/dbraw/zinc/77/32/83/1049773283.db2.gz OYLASXKSXZITDG-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO Cc1cc(F)cc(C)c1-c1ccc(C[NH+]2CCOCC2)cc1F ZINC001206703598 1049781943 /nfs/dbraw/zinc/78/19/43/1049781943.db2.gz LWJZFCWBDSVCGL-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO Cc1cc2ccc(-c3ccc(C[NH+]4CCOCC4)cc3F)cc2[nH]1 ZINC001206712443 1049782493 /nfs/dbraw/zinc/78/24/93/1049782493.db2.gz NXFJIPZIDBTRQH-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Cc1cc2c(cccc2-c2ccc(C[NH+]3CCOCC3)cc2F)[nH]1 ZINC001206720082 1049783299 /nfs/dbraw/zinc/78/32/99/1049783299.db2.gz XJOKQCHJDRRCJX-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO c1cn(Cc2ccccc2-c2cccc(OCC3CC3)c2)c[nH+]1 ZINC001206769966 1049796409 /nfs/dbraw/zinc/79/64/09/1049796409.db2.gz FNNTZGZDEDNBIM-UHFFFAOYSA-N 1 2 304.393 4.387 20 0 DIADLO Cc1cc(C[N@@H+]2CCSC[C@@H]2c2cccc3ccccc32)no1 ZINC001206822627 1049805335 /nfs/dbraw/zinc/80/53/35/1049805335.db2.gz ZPZWTFWMVGNNIO-LJQANCHMSA-N 1 2 324.449 4.426 20 0 DIADLO Cc1cc(C[N@H+]2CCSC[C@@H]2c2cccc3ccccc32)no1 ZINC001206822627 1049805341 /nfs/dbraw/zinc/80/53/41/1049805341.db2.gz ZPZWTFWMVGNNIO-LJQANCHMSA-N 1 2 324.449 4.426 20 0 DIADLO COc1ccc(-c2cc(C[N@@H+]3CCCC[C@@](C)(F)C3)no2)cc1 ZINC001206825958 1049807270 /nfs/dbraw/zinc/80/72/70/1049807270.db2.gz SGDMRZYGUFQYHW-GOSISDBHSA-N 1 2 318.392 4.064 20 0 DIADLO COc1ccc(-c2cc(C[N@H+]3CCCC[C@@](C)(F)C3)no2)cc1 ZINC001206825958 1049807281 /nfs/dbraw/zinc/80/72/81/1049807281.db2.gz SGDMRZYGUFQYHW-GOSISDBHSA-N 1 2 318.392 4.064 20 0 DIADLO Fc1ccc(-c2cc(C[N@@H+]3CCC[C@H]3c3cccnc3)no2)cc1 ZINC001206833059 1049811664 /nfs/dbraw/zinc/81/16/64/1049811664.db2.gz FQKDFBFNQSVCNR-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(-c2cc(C[N@H+]3CCC[C@H]3c3cccnc3)no2)cc1 ZINC001206833059 1049811674 /nfs/dbraw/zinc/81/16/74/1049811674.db2.gz FQKDFBFNQSVCNR-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO CSc1ccccc1[C@H]1CCC[N@@H+]1Cc1c(F)cncc1F ZINC001206859449 1049814478 /nfs/dbraw/zinc/81/44/78/1049814478.db2.gz BACULBJXCNYHCT-MRXNPFEDSA-N 1 2 320.408 4.419 20 0 DIADLO CSc1ccccc1[C@H]1CCC[N@H+]1Cc1c(F)cncc1F ZINC001206859449 1049814490 /nfs/dbraw/zinc/81/44/90/1049814490.db2.gz BACULBJXCNYHCT-MRXNPFEDSA-N 1 2 320.408 4.419 20 0 DIADLO Cc1ccnc(C[N@@H+]2CCSC[C@H]2c2cccc(Cl)c2)c1 ZINC001206852662 1049814642 /nfs/dbraw/zinc/81/46/42/1049814642.db2.gz DYEUCJRMNZSAIX-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccnc(C[N@H+]2CCSC[C@H]2c2cccc(Cl)c2)c1 ZINC001206852662 1049814661 /nfs/dbraw/zinc/81/46/61/1049814661.db2.gz DYEUCJRMNZSAIX-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccnc(C[N@@H+]2CCSC[C@@H]2c2cccc(Cl)c2)c1 ZINC001206852664 1049815806 /nfs/dbraw/zinc/81/58/06/1049815806.db2.gz DYEUCJRMNZSAIX-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccnc(C[N@H+]2CCSC[C@@H]2c2cccc(Cl)c2)c1 ZINC001206852664 1049815810 /nfs/dbraw/zinc/81/58/10/1049815810.db2.gz DYEUCJRMNZSAIX-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO CCc1ccc(C2CC[NH+](Cc3ncc(Cl)n3C)CC2)cc1 ZINC001207018557 1049821351 /nfs/dbraw/zinc/82/13/51/1049821351.db2.gz PEMWOBGXPANFEB-UHFFFAOYSA-N 1 2 317.864 4.016 20 0 DIADLO CC[C@@H]1CCCC[C@H]1C[NH2+][C@@](CC)(C(=O)OC)c1ccccc1 ZINC001207049637 1049824270 /nfs/dbraw/zinc/82/42/70/1049824270.db2.gz MASKFZVRXNACMW-FUHIMQAGSA-N 1 2 317.473 4.271 20 0 DIADLO c1nc(C[N@H+](Cc2ccccn2)C2CCCCC2)n2ccccc12 ZINC001207057805 1049827148 /nfs/dbraw/zinc/82/71/48/1049827148.db2.gz RGIJJQSQOZOMSB-UHFFFAOYSA-N 1 2 320.440 4.064 20 0 DIADLO c1nc(C[N@@H+](Cc2ccccn2)C2CCCCC2)n2ccccc12 ZINC001207057805 1049827160 /nfs/dbraw/zinc/82/71/60/1049827160.db2.gz RGIJJQSQOZOMSB-UHFFFAOYSA-N 1 2 320.440 4.064 20 0 DIADLO c1[nH+]c(CN2CCC(CCc3ccccc3)CC2)n2ccccc12 ZINC001207050445 1049828522 /nfs/dbraw/zinc/82/85/22/1049828522.db2.gz ACOVCFQWUKPKGR-UHFFFAOYSA-N 1 2 319.452 4.179 20 0 DIADLO CCC[NH+](CCC)Cn1nc(C)n(-c2ccccc2C)c1=S ZINC000913058094 1049833599 /nfs/dbraw/zinc/83/35/99/1049833599.db2.gz OFRXCUDVLQTIBR-UHFFFAOYSA-N 1 2 318.490 4.100 20 0 DIADLO Fc1cccc(OC(F)F)c1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC001207113349 1049837829 /nfs/dbraw/zinc/83/78/29/1049837829.db2.gz ZFKTWQWSNSYFKP-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(OC(F)F)c1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC001207113349 1049837838 /nfs/dbraw/zinc/83/78/38/1049837838.db2.gz ZFKTWQWSNSYFKP-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Cc1cncc(C[N@@H+]2CCSC[C@H]2c2cccc(Cl)c2)c1 ZINC001207160784 1049847485 /nfs/dbraw/zinc/84/74/85/1049847485.db2.gz KCPNMPHQHROQNB-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cncc(C[N@H+]2CCSC[C@H]2c2cccc(Cl)c2)c1 ZINC001207160784 1049847503 /nfs/dbraw/zinc/84/75/03/1049847503.db2.gz KCPNMPHQHROQNB-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@H+](Cc1cnn(C3CCC3)c1)CC2 ZINC001207243902 1049868425 /nfs/dbraw/zinc/86/84/25/1049868425.db2.gz TZJQAVOTPUENKJ-UHFFFAOYSA-N 1 2 315.848 4.128 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@@H+](Cc1cnn(C3CCC3)c1)CC2 ZINC001207243902 1049868435 /nfs/dbraw/zinc/86/84/35/1049868435.db2.gz TZJQAVOTPUENKJ-UHFFFAOYSA-N 1 2 315.848 4.128 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ncc(C(C)(C)C)s2)o1 ZINC000570896763 1049892683 /nfs/dbraw/zinc/89/26/83/1049892683.db2.gz VASYQYJFYCXZGG-YPMHNXCESA-N 1 2 304.459 4.447 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1csc(-c2ccco2)n1 ZINC000586768223 1049895403 /nfs/dbraw/zinc/89/54/03/1049895403.db2.gz DGDQUXLGVCCTNX-UHFFFAOYSA-N 1 2 304.337 4.177 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1csc(-c2ccco2)n1 ZINC000586768223 1049895412 /nfs/dbraw/zinc/89/54/12/1049895412.db2.gz DGDQUXLGVCCTNX-UHFFFAOYSA-N 1 2 304.337 4.177 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCOC[C@H]2c2ccccc2Cl)cc1 ZINC001207518123 1049903239 /nfs/dbraw/zinc/90/32/39/1049903239.db2.gz KUNXXCUZHTURDR-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc(CC[N@H+]2CCOC[C@H]2c2ccccc2Cl)cc1 ZINC001207518123 1049903242 /nfs/dbraw/zinc/90/32/42/1049903242.db2.gz KUNXXCUZHTURDR-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO CCO[C@@H]1C[C@@H](Nc2ccc3[nH+]c(C)cc(C)c3c2)[C@@H]1SC ZINC001207554340 1049909203 /nfs/dbraw/zinc/90/92/03/1049909203.db2.gz UDWRWFBHVOYOSA-KURKYZTESA-N 1 2 316.470 4.173 20 0 DIADLO CCc1cccc(F)c1C[NH2+][C@@H](C)c1nccn1-c1ccccc1 ZINC000570963931 1049915412 /nfs/dbraw/zinc/91/54/12/1049915412.db2.gz XXUWCYLBLNKGQV-HNNXBMFYSA-N 1 2 323.415 4.425 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](CCCC(=O)c2ccccc2)CCO1 ZINC000571032548 1049917716 /nfs/dbraw/zinc/91/77/16/1049917716.db2.gz GEGHWGCZMXIEBJ-OAQYLSRUSA-N 1 2 323.436 4.031 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](CCCC(=O)c2ccccc2)CCO1 ZINC000571032548 1049917719 /nfs/dbraw/zinc/91/77/19/1049917719.db2.gz GEGHWGCZMXIEBJ-OAQYLSRUSA-N 1 2 323.436 4.031 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](CCCC(=O)c2ccccc2)CCO1 ZINC000571032547 1049918452 /nfs/dbraw/zinc/91/84/52/1049918452.db2.gz GEGHWGCZMXIEBJ-NRFANRHFSA-N 1 2 323.436 4.031 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](CCCC(=O)c2ccccc2)CCO1 ZINC000571032547 1049918457 /nfs/dbraw/zinc/91/84/57/1049918457.db2.gz GEGHWGCZMXIEBJ-NRFANRHFSA-N 1 2 323.436 4.031 20 0 DIADLO CC(C)c1nnc(C[NH+]2CCC(c3ccccc3F)CC2)s1 ZINC000571493373 1049934000 /nfs/dbraw/zinc/93/40/00/1049934000.db2.gz HBIBKQUBBQWQBG-UHFFFAOYSA-N 1 2 319.449 4.180 20 0 DIADLO CC(C)CC[C@@H](NC(=O)Nc1ccc2[nH+]ccn2c1)C(C)(C)C ZINC001207826828 1049943515 /nfs/dbraw/zinc/94/35/15/1049943515.db2.gz RTNFHPGGCHMFHM-OAHLLOKOSA-N 1 2 316.449 4.307 20 0 DIADLO C[C@@H]1CC(C)(C)C[C@](C)(NC(=O)Nc2ccc3[nH+]ccn3c2)C1 ZINC001207825507 1049943690 /nfs/dbraw/zinc/94/36/90/1049943690.db2.gz IXBMIJNWRMCBCX-FZKQIMNGSA-N 1 2 314.433 4.061 20 0 DIADLO FC(F)(F)c1n[nH]c2c1CC[N@H+](CC1(c3ccccc3)CC1)C2 ZINC001207840900 1049944358 /nfs/dbraw/zinc/94/43/58/1049944358.db2.gz OJVJLKZUYZPDQJ-OAHLLOKOSA-N 1 2 321.346 4.075 20 0 DIADLO FC(F)(F)c1n[nH]c2c1CC[N@@H+](CC1(c3ccccc3)CC1)C2 ZINC001207840900 1049944362 /nfs/dbraw/zinc/94/43/62/1049944362.db2.gz OJVJLKZUYZPDQJ-OAHLLOKOSA-N 1 2 321.346 4.075 20 0 DIADLO CC(C)CCn1c2ccccc2[nH+]c1NCc1ncccc1F ZINC001207876308 1049948998 /nfs/dbraw/zinc/94/89/98/1049948998.db2.gz PSFWWABEUDDYIK-UHFFFAOYSA-N 1 2 312.392 4.229 20 0 DIADLO Brc1cccc2c(N3CCCCCC3)cc[nH+]c12 ZINC000588159007 1049962535 /nfs/dbraw/zinc/96/25/35/1049962535.db2.gz MBHBBQKYVYNWCU-UHFFFAOYSA-N 1 2 305.219 4.378 20 0 DIADLO Nc1cn(-c2cc[nH+]cc2Cl)c2ccc(Br)cc12 ZINC001212151220 1049970634 /nfs/dbraw/zinc/97/06/34/1049970634.db2.gz RBTMFIUSMFDIDQ-UHFFFAOYSA-N 1 2 322.593 4.024 20 0 DIADLO Fc1cccc(F)c1CC[N@@H+]1CCc2c3ccccc3oc2C1 ZINC001208116991 1049974019 /nfs/dbraw/zinc/97/40/19/1049974019.db2.gz OTEOJEVRYJABPU-UHFFFAOYSA-N 1 2 313.347 4.312 20 0 DIADLO Fc1cccc(F)c1CC[N@H+]1CCc2c3ccccc3oc2C1 ZINC001208116991 1049974021 /nfs/dbraw/zinc/97/40/21/1049974021.db2.gz OTEOJEVRYJABPU-UHFFFAOYSA-N 1 2 313.347 4.312 20 0 DIADLO C[C@@H](CC[N@@H+]1Cc2cnn(C3CCOCC3)c2C1)CC(C)(C)C ZINC001208663315 1049999801 /nfs/dbraw/zinc/99/98/01/1049999801.db2.gz GNHZANHODVZNNP-HNNXBMFYSA-N 1 2 319.493 4.013 20 0 DIADLO C[C@@H](CC[N@H+]1Cc2cnn(C3CCOCC3)c2C1)CC(C)(C)C ZINC001208663315 1049999807 /nfs/dbraw/zinc/99/98/07/1049999807.db2.gz GNHZANHODVZNNP-HNNXBMFYSA-N 1 2 319.493 4.013 20 0 DIADLO Clc1cccc([C@@H]2CCC[N@@H+]2Cc2cn3ccsc3n2)c1 ZINC000588899888 1050007030 /nfs/dbraw/zinc/00/70/30/1050007030.db2.gz HNRMJCUNZNDKEQ-HNNXBMFYSA-N 1 2 317.845 4.386 20 0 DIADLO Clc1cccc([C@@H]2CCC[N@H+]2Cc2cn3ccsc3n2)c1 ZINC000588899888 1050007036 /nfs/dbraw/zinc/00/70/36/1050007036.db2.gz HNRMJCUNZNDKEQ-HNNXBMFYSA-N 1 2 317.845 4.386 20 0 DIADLO c1cc2c(nc[nH+]c2Nc2ccccc2COc2ccccc2)[nH]1 ZINC000588897985 1050007596 /nfs/dbraw/zinc/00/75/96/1050007596.db2.gz WGGANYCXJDUKCD-UHFFFAOYSA-N 1 2 316.364 4.281 20 0 DIADLO Cc1nc([C@H]([NH2+]C[C@H](C)CC(C)C)c2ccc(Cl)cc2)no1 ZINC000572646785 1050038748 /nfs/dbraw/zinc/03/87/48/1050038748.db2.gz KSEZENFXDUQZPW-MLGOLLRUSA-N 1 2 321.852 4.393 20 0 DIADLO F[C@H]1CCC[N@H+](CCCCOCc2ccccc2)CC1(F)F ZINC001209256499 1050047671 /nfs/dbraw/zinc/04/76/71/1050047671.db2.gz IQDZMUVAMOQTNJ-INIZCTEOSA-N 1 2 315.379 4.053 20 0 DIADLO F[C@H]1CCC[N@@H+](CCCCOCc2ccccc2)CC1(F)F ZINC001209256499 1050047676 /nfs/dbraw/zinc/04/76/76/1050047676.db2.gz IQDZMUVAMOQTNJ-INIZCTEOSA-N 1 2 315.379 4.053 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1ccccc1Cl ZINC000589605172 1050047658 /nfs/dbraw/zinc/04/76/58/1050047658.db2.gz QXFYWKZXGSPMRR-RDTXWAMCSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1ccccc1Cl ZINC000589605172 1050047660 /nfs/dbraw/zinc/04/76/60/1050047660.db2.gz QXFYWKZXGSPMRR-RDTXWAMCSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000589600555 1050047793 /nfs/dbraw/zinc/04/77/93/1050047793.db2.gz FPWPLXSPASFJNT-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000589600555 1050047795 /nfs/dbraw/zinc/04/77/95/1050047795.db2.gz FPWPLXSPASFJNT-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO Fc1cccc([C@H]2C[N@H+](CCc3ccccc3Cl)CCO2)c1 ZINC000589600544 1050047859 /nfs/dbraw/zinc/04/78/59/1050047859.db2.gz DHSWPVWWCMAZPG-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1cccc([C@H]2C[N@@H+](CCc3ccccc3Cl)CCO2)c1 ZINC000589600544 1050047861 /nfs/dbraw/zinc/04/78/61/1050047861.db2.gz DHSWPVWWCMAZPG-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Cc1ccccc1C[N@@H+]1CCO[C@H](c2ccc(F)c(Cl)c2)C1 ZINC000589600173 1050050030 /nfs/dbraw/zinc/05/00/30/1050050030.db2.gz OTXZNFMYKWLYBP-SFHVURJKSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1ccccc1C[N@H+]1CCO[C@H](c2ccc(F)c(Cl)c2)C1 ZINC000589600173 1050050034 /nfs/dbraw/zinc/05/00/34/1050050034.db2.gz OTXZNFMYKWLYBP-SFHVURJKSA-N 1 2 319.807 4.361 20 0 DIADLO C[C@H]([NH2+]Cc1n[nH]c2ccccc21)c1ccc2c(c1)CCCC2 ZINC000589637008 1050051305 /nfs/dbraw/zinc/05/13/05/1050051305.db2.gz XVFRKTBYWJTCRO-AWEZNQCLSA-N 1 2 305.425 4.293 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2n[nH]c3ccccc32)C2CC2)cc1 ZINC000589635911 1050051500 /nfs/dbraw/zinc/05/15/00/1050051500.db2.gz UTRZWEIGYMMIJM-SFHVURJKSA-N 1 2 311.816 4.457 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2n[nH]c3ccccc32)C(C)C)cc1 ZINC000589637838 1050051570 /nfs/dbraw/zinc/05/15/70/1050051570.db2.gz FLJRQJLJKYAJGD-LJQANCHMSA-N 1 2 309.413 4.058 20 0 DIADLO Cn1nc(C[NH2+]Cc2cccc(Cl)c2Cl)c2ccccc21 ZINC000589647677 1050053653 /nfs/dbraw/zinc/05/36/53/1050053653.db2.gz UKIYKCWKHNCDOX-UHFFFAOYSA-N 1 2 320.223 4.170 20 0 DIADLO CCCn1c(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)nc2ccccc21 ZINC000589833995 1050060372 /nfs/dbraw/zinc/06/03/72/1050060372.db2.gz NBZLZGBDOROTLQ-ZBFHGGJFSA-N 1 2 323.440 4.453 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nc3ccccc3n2C(F)F)o1 ZINC000589842388 1050060838 /nfs/dbraw/zinc/06/08/38/1050060838.db2.gz PFARBGRQAKFHJC-NSHDSACASA-N 1 2 305.328 4.184 20 0 DIADLO CCc1ccc([C@H](C)C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000589899925 1050065808 /nfs/dbraw/zinc/06/58/08/1050065808.db2.gz ROEDUSMCPRUMDX-HNNXBMFYSA-N 1 2 319.408 4.177 20 0 DIADLO F[C@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1c(Cl)cccc1OC(F)(F)F ZINC001209526670 1050067480 /nfs/dbraw/zinc/06/74/80/1050067480.db2.gz PDIOBIKNLASNKD-AUTRQRHGSA-N 1 2 323.717 4.171 20 0 DIADLO F[C@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1c(Cl)cccc1OC(F)(F)F ZINC001209526670 1050067487 /nfs/dbraw/zinc/06/74/87/1050067487.db2.gz PDIOBIKNLASNKD-AUTRQRHGSA-N 1 2 323.717 4.171 20 0 DIADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1c(Cl)cccc1OC(F)(F)F ZINC001209526671 1050067696 /nfs/dbraw/zinc/06/76/96/1050067696.db2.gz PDIOBIKNLASNKD-HOTUBEGUSA-N 1 2 323.717 4.171 20 0 DIADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1c(Cl)cccc1OC(F)(F)F ZINC001209526671 1050067704 /nfs/dbraw/zinc/06/77/04/1050067704.db2.gz PDIOBIKNLASNKD-HOTUBEGUSA-N 1 2 323.717 4.171 20 0 DIADLO CCc1ccc([C@@H](C)C(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)cc1 ZINC000589941956 1050069018 /nfs/dbraw/zinc/06/90/18/1050069018.db2.gz SAQJXHQIXZTYMR-GFCCVEGCSA-N 1 2 307.397 4.176 20 0 DIADLO Cc1ccc(C[N@H+]2Cc3cc(Br)ccc3C[C@H]2C)[nH]1 ZINC001209577300 1050069413 /nfs/dbraw/zinc/06/94/13/1050069413.db2.gz NJDJAEWTPLBCKF-GFCCVEGCSA-N 1 2 319.246 4.032 20 0 DIADLO Cc1ccc(C[N@@H+]2Cc3cc(Br)ccc3C[C@H]2C)[nH]1 ZINC001209577300 1050069419 /nfs/dbraw/zinc/06/94/19/1050069419.db2.gz NJDJAEWTPLBCKF-GFCCVEGCSA-N 1 2 319.246 4.032 20 0 DIADLO F[C@@H]1C[N@H+](Cc2cccc3[nH]cc(Cl)c32)CCC1(F)F ZINC001209655783 1050074377 /nfs/dbraw/zinc/07/43/77/1050074377.db2.gz CBPHIWJTMYQPMV-GFCCVEGCSA-N 1 2 302.727 4.000 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2cccc3[nH]cc(Cl)c32)CCC1(F)F ZINC001209655783 1050074381 /nfs/dbraw/zinc/07/43/81/1050074381.db2.gz CBPHIWJTMYQPMV-GFCCVEGCSA-N 1 2 302.727 4.000 20 0 DIADLO COc1cc(C[N@H+](Cc2ccco2)C2CC2)c(F)cc1Cl ZINC001209667470 1050075782 /nfs/dbraw/zinc/07/57/82/1050075782.db2.gz JTWGLAMAJNCUOC-UHFFFAOYSA-N 1 2 309.768 4.245 20 0 DIADLO COc1cc(C[N@@H+](Cc2ccco2)C2CC2)c(F)cc1Cl ZINC001209667470 1050075786 /nfs/dbraw/zinc/07/57/86/1050075786.db2.gz JTWGLAMAJNCUOC-UHFFFAOYSA-N 1 2 309.768 4.245 20 0 DIADLO O=C1CC[N@@H+](Cc2cc3cc(Cl)ccc3[nH]2)[C@@H]2CCCC[C@H]12 ZINC001209717991 1050077768 /nfs/dbraw/zinc/07/77/68/1050077768.db2.gz IUSZSJNISJTMQP-DOTOQJQBSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2cc3cc(Cl)ccc3[nH]2)[C@@H]2CCCC[C@H]12 ZINC001209717991 1050077772 /nfs/dbraw/zinc/07/77/72/1050077772.db2.gz IUSZSJNISJTMQP-DOTOQJQBSA-N 1 2 316.832 4.155 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1[nH]nc2ccc(Cl)cc21 ZINC001209751461 1050080756 /nfs/dbraw/zinc/08/07/56/1050080756.db2.gz PMOOWTYEMNRXKS-LBPRGKRZSA-N 1 2 311.816 4.336 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1[nH]nc2ccc(Cl)cc21 ZINC001209751461 1050080762 /nfs/dbraw/zinc/08/07/62/1050080762.db2.gz PMOOWTYEMNRXKS-LBPRGKRZSA-N 1 2 311.816 4.336 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1n[nH]c2ccc(Cl)cc21 ZINC001209751461 1050080767 /nfs/dbraw/zinc/08/07/67/1050080767.db2.gz PMOOWTYEMNRXKS-LBPRGKRZSA-N 1 2 311.816 4.336 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1n[nH]c2ccc(Cl)cc21 ZINC001209751461 1050080773 /nfs/dbraw/zinc/08/07/73/1050080773.db2.gz PMOOWTYEMNRXKS-LBPRGKRZSA-N 1 2 311.816 4.336 20 0 DIADLO CC(C)[N@H+](Cc1cnccn1)Cc1ccc(Cl)cc1Cl ZINC001209787844 1050083940 /nfs/dbraw/zinc/08/39/40/1050083940.db2.gz AEJHGOOOSIGFJD-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO CC(C)[N@@H+](Cc1cnccn1)Cc1ccc(Cl)cc1Cl ZINC001209787844 1050083944 /nfs/dbraw/zinc/08/39/44/1050083944.db2.gz AEJHGOOOSIGFJD-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cc[nH]c1C1CCC1 ZINC000572935036 1050095308 /nfs/dbraw/zinc/09/53/08/1050095308.db2.gz NANAYPCZEPXBAM-UHFFFAOYSA-N 1 2 320.396 4.233 20 0 DIADLO CCCCOC(=O)Nc1ccc(Nc2[nH+]c(C)ccc2O)cc1 ZINC001209913517 1050105370 /nfs/dbraw/zinc/10/53/70/1050105370.db2.gz PMPJRFXGFQCSGH-UHFFFAOYSA-N 1 2 315.373 4.188 20 0 DIADLO COc1ccc(-n2c(C)[nH+]c3ccc(N)cc32)c2ccccc12 ZINC001209924342 1050106429 /nfs/dbraw/zinc/10/64/29/1050106429.db2.gz AUWBIFFSZMLWSN-UHFFFAOYSA-N 1 2 303.365 4.078 20 0 DIADLO Fc1ccc(Nc2ccccc2C[NH+]2CCOCC2)c(Cl)c1 ZINC001209928361 1050108044 /nfs/dbraw/zinc/10/80/44/1050108044.db2.gz AWHIAQBQCIHSJW-UHFFFAOYSA-N 1 2 320.795 4.055 20 0 DIADLO Cc1cc(Nc2ccccc2C[NH+]2CCOCC2)cc(C)c1C ZINC001209930557 1050108180 /nfs/dbraw/zinc/10/81/80/1050108180.db2.gz OJMGVCUMGVAMHC-UHFFFAOYSA-N 1 2 310.441 4.188 20 0 DIADLO CO[C@H](C)c1cccc(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001209949323 1050109916 /nfs/dbraw/zinc/10/99/16/1050109916.db2.gz IQASVDZBZCMFPC-LLVKDONJSA-N 1 2 301.777 4.439 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(C(C)(C)C)on1 ZINC000573047353 1050117627 /nfs/dbraw/zinc/11/76/27/1050117627.db2.gz GZFXDLRKSLJCGG-ZYHUDNBSSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cc(C(C)(C)C)on1 ZINC000573047353 1050117630 /nfs/dbraw/zinc/11/76/30/1050117630.db2.gz GZFXDLRKSLJCGG-ZYHUDNBSSA-N 1 2 304.356 4.135 20 0 DIADLO Cc1cc(Nc2ccc[nH+]c2N2CCCCC2)ccc1N(C)C ZINC001210039845 1050127018 /nfs/dbraw/zinc/12/70/18/1050127018.db2.gz CQFCQHDJXDUKOW-UHFFFAOYSA-N 1 2 310.445 4.190 20 0 DIADLO Cc1cc(Nc2cccc(Cn3cc[nH+]c3)c2)ccc1N(C)C ZINC001210040820 1050127475 /nfs/dbraw/zinc/12/74/75/1050127475.db2.gz CGZFUOHLQSANQM-UHFFFAOYSA-N 1 2 306.413 4.049 20 0 DIADLO Cc1cc(Nc2ccccc2P(C)(C)=O)ccc1[NH+](C)C ZINC001210043052 1050127848 /nfs/dbraw/zinc/12/78/48/1050127848.db2.gz KPHIIWJWABJXCB-UHFFFAOYSA-N 1 2 302.358 4.053 20 0 DIADLO Cc1cc(Br)nc(Nc2ccc3c[nH+]ccc3c2)c1 ZINC001210046133 1050128194 /nfs/dbraw/zinc/12/81/94/1050128194.db2.gz USFMXYXRCQWNII-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO Fc1cnc(Nc2ccc3c[nH+]ccc3c2)c(Br)c1 ZINC001210044564 1050128663 /nfs/dbraw/zinc/12/86/63/1050128663.db2.gz AZXXGOZIYUFNJT-UHFFFAOYSA-N 1 2 318.149 4.275 20 0 DIADLO CCc1noc(C[N@H+](Cc2ccccc2F)C2CCCCC2)n1 ZINC000591377907 1050144180 /nfs/dbraw/zinc/14/41/80/1050144180.db2.gz FIRRDYGUHPUXBL-UHFFFAOYSA-N 1 2 317.408 4.106 20 0 DIADLO CCc1noc(C[N@@H+](Cc2ccccc2F)C2CCCCC2)n1 ZINC000591377907 1050144186 /nfs/dbraw/zinc/14/41/86/1050144186.db2.gz FIRRDYGUHPUXBL-UHFFFAOYSA-N 1 2 317.408 4.106 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646117763 1050145197 /nfs/dbraw/zinc/14/51/97/1050145197.db2.gz QNXYKRDBKVZNLJ-LJQANCHMSA-N 1 2 307.441 4.357 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646117763 1050145206 /nfs/dbraw/zinc/14/52/06/1050145206.db2.gz QNXYKRDBKVZNLJ-LJQANCHMSA-N 1 2 307.441 4.357 20 0 DIADLO Cc1ccc2c(Cl)c(C(=O)Nc3cc[nH+]c(C)c3)sc2c1 ZINC000591421768 1050146889 /nfs/dbraw/zinc/14/68/89/1050146889.db2.gz QSIMMAMQPZAJPS-UHFFFAOYSA-N 1 2 316.813 4.241 20 0 DIADLO Cc1n[nH]cc1[C@H](C)[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000679358540 1050153841 /nfs/dbraw/zinc/15/38/41/1050153841.db2.gz IDOQEMRDDRTJEA-VIFPVBQESA-N 1 2 310.228 4.365 20 0 DIADLO C[C@@H](CC(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2)C1CC1 ZINC000823769897 1050155095 /nfs/dbraw/zinc/15/50/95/1050155095.db2.gz IWZCOQYGZBNYMC-AWEZNQCLSA-N 1 2 323.440 4.261 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1cnc(-c2ccncc2)s1 ZINC000770403469 1050156713 /nfs/dbraw/zinc/15/67/13/1050156713.db2.gz YDLUJFANQPVJRC-UHFFFAOYSA-N 1 2 324.453 4.192 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+]C[C@@H]2C[C@@H]2c2ccccc2)cc1 ZINC000770428017 1050158359 /nfs/dbraw/zinc/15/83/59/1050158359.db2.gz GEFAZZINFMYZGE-PLMTUMEDSA-N 1 2 322.452 4.127 20 0 DIADLO Cc1ccnc(Br)c1Nc1cccc2cc[nH+]cc21 ZINC001210223919 1050165573 /nfs/dbraw/zinc/16/55/73/1050165573.db2.gz IVMUVSHNZAAOCV-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO CCc1c(C)sc(Nc2cccc3cc[nH+]cc32)c1C(N)=O ZINC001210224242 1050165804 /nfs/dbraw/zinc/16/58/04/1050165804.db2.gz UQYWOFRXPYZURJ-UHFFFAOYSA-N 1 2 311.410 4.010 20 0 DIADLO c1cn(-c2ccc(NCc3cnc4ccccc4c3)cc2)c[nH+]1 ZINC000770487054 1050166214 /nfs/dbraw/zinc/16/62/14/1050166214.db2.gz CNMQXSCUJAZXFU-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO COC(=O)c1c(Cl)cccc1Nc1cccc2cc[nH+]cc21 ZINC001210230257 1050167395 /nfs/dbraw/zinc/16/73/95/1050167395.db2.gz BRAIKZJIJAWRHC-UHFFFAOYSA-N 1 2 312.756 4.418 20 0 DIADLO FC(F)(F)Oc1ccncc1Nc1cccc2cc[nH+]cc21 ZINC001210226503 1050167677 /nfs/dbraw/zinc/16/76/77/1050167677.db2.gz ZIHDIPLKQALJBZ-UHFFFAOYSA-N 1 2 305.259 4.272 20 0 DIADLO Nc1c(F)c(F)c(Nc2cccc3cc[nH+]cc32)c(F)c1F ZINC001210231371 1050169676 /nfs/dbraw/zinc/16/96/76/1050169676.db2.gz QRCUSVYXATXOGR-UHFFFAOYSA-N 1 2 307.250 4.117 20 0 DIADLO COC(=O)c1c(C)ccc(Nc2cccc3cc[nH+]cc32)c1F ZINC001210232725 1050169999 /nfs/dbraw/zinc/16/99/99/1050169999.db2.gz OFCYGYDMJHULGD-UHFFFAOYSA-N 1 2 310.328 4.213 20 0 DIADLO FC(F)(F)c1ncccc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001210234333 1050171773 /nfs/dbraw/zinc/17/17/73/1050171773.db2.gz ORPLKKASAXYDCP-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO O=C(CCNc1cc2c3c(c1)CCC[NH+]3CCC2)c1ccccc1 ZINC001170015451 1050175627 /nfs/dbraw/zinc/17/56/27/1050175627.db2.gz ONMHLVIXPHSDGX-UHFFFAOYSA-N 1 2 320.436 4.070 20 0 DIADLO O=C(CC[NH2+]c1cc2c3c(c1)CCCN3CCC2)c1ccccc1 ZINC001170015451 1050175634 /nfs/dbraw/zinc/17/56/34/1050175634.db2.gz ONMHLVIXPHSDGX-UHFFFAOYSA-N 1 2 320.436 4.070 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)c(F)cc1F)c1c(F)cccc1F ZINC000225258564 1050183565 /nfs/dbraw/zinc/18/35/65/1050183565.db2.gz UUXVIOFFWSLHGL-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@H]2/C=C\c2ccccc2)c(F)cn1 ZINC000824136042 1050184166 /nfs/dbraw/zinc/18/41/66/1050184166.db2.gz SUVWAOAVZFIYHC-QWGSZXSUSA-N 1 2 300.352 4.038 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@H]2/C=C\c2ccccc2)c(F)cn1 ZINC000824136042 1050184172 /nfs/dbraw/zinc/18/41/72/1050184172.db2.gz SUVWAOAVZFIYHC-QWGSZXSUSA-N 1 2 300.352 4.038 20 0 DIADLO CCCC(=CC(=O)NCc1ccc(-n2cc[nH+]c2)cc1)CCC ZINC000770709236 1050188662 /nfs/dbraw/zinc/18/86/62/1050188662.db2.gz AAZGNKLRQHHMKA-UHFFFAOYSA-N 1 2 311.429 4.015 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(C3(C(F)(F)F)CC3)cc2)cc1N ZINC001210288021 1050191533 /nfs/dbraw/zinc/19/15/33/1050191533.db2.gz HMQLCNMWQZOBFI-UHFFFAOYSA-N 1 2 307.319 4.310 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(Cl)c(C(F)(F)F)c2)cc1N ZINC001210288327 1050191572 /nfs/dbraw/zinc/19/15/72/1050191572.db2.gz MFQOLKLZPJJFIG-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO FC(F)Oc1ccc(Nc2cc(OC(F)(F)F)cc[nH+]2)cc1 ZINC001210325398 1050203881 /nfs/dbraw/zinc/20/38/81/1050203881.db2.gz ITKCOJSJIUUEJX-UHFFFAOYSA-N 1 2 320.217 4.325 20 0 DIADLO C[C@H](c1csnn1)[NH+]1CCC(c2ccnc3ccccc32)CC1 ZINC000573503031 1050207829 /nfs/dbraw/zinc/20/78/29/1050207829.db2.gz HYORAPYLSFAQNI-CYBMUJFWSA-N 1 2 324.453 4.027 20 0 DIADLO C/C(=C\C(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1Cl ZINC000733968820 1050209450 /nfs/dbraw/zinc/20/94/50/1050209450.db2.gz XPVFYUSDXZUFAI-ZRDIBKRKSA-N 1 2 311.772 4.030 20 0 DIADLO CC(C)COc1ccccc1C[NH2+]Cc1cc(F)cnc1Cl ZINC000824543815 1050225510 /nfs/dbraw/zinc/22/55/10/1050225510.db2.gz PKLHTFVYEZHULL-UHFFFAOYSA-N 1 2 322.811 4.199 20 0 DIADLO Cc1cc2c(ccc(N)c2F)n1-c1ccc(-c2[nH+]ccn2C)cc1 ZINC001210436112 1050245156 /nfs/dbraw/zinc/24/51/56/1050245156.db2.gz SJBQTFKMDKYIEC-UHFFFAOYSA-N 1 2 320.371 4.061 20 0 DIADLO C[C@H]1C[N@H+](Cc2c[nH]c3cccc(F)c23)[C@@H](c2ccccc2)CO1 ZINC001136988668 1050277329 /nfs/dbraw/zinc/27/73/29/1050277329.db2.gz LRHSATFYNMHRTC-IFXJQAMLSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c[nH]c3cccc(F)c23)[C@@H](c2ccccc2)CO1 ZINC001136988668 1050277333 /nfs/dbraw/zinc/27/73/33/1050277333.db2.gz LRHSATFYNMHRTC-IFXJQAMLSA-N 1 2 324.399 4.269 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@@H+]1Cc1coc(C2CC2)n1 ZINC000825215782 1050283963 /nfs/dbraw/zinc/28/39/63/1050283963.db2.gz VZVGXGMMFMQQGU-QGZVFWFLSA-N 1 2 300.377 4.337 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000825215782 1050283983 /nfs/dbraw/zinc/28/39/83/1050283983.db2.gz VZVGXGMMFMQQGU-QGZVFWFLSA-N 1 2 300.377 4.337 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@@H+]1Cc1cc(F)ncc1F ZINC000825215310 1050284098 /nfs/dbraw/zinc/28/40/98/1050284098.db2.gz LWTSJGQABCPXLX-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@H+]1Cc1cc(F)ncc1F ZINC000825215310 1050284112 /nfs/dbraw/zinc/28/41/12/1050284112.db2.gz LWTSJGQABCPXLX-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1c[nH+]cc(NC[C@H](O)c2c(Cl)cccc2Cl)c1C ZINC001170034257 1050288390 /nfs/dbraw/zinc/28/83/90/1050288390.db2.gz SZBCILZGYQHKQA-AWEZNQCLSA-N 1 2 311.212 4.151 20 0 DIADLO CCc1nc(C[N@@H+]2CCCC[C@@H]2c2ccccc2OC)cs1 ZINC000592331620 1050289714 /nfs/dbraw/zinc/28/97/14/1050289714.db2.gz PPSRQNDULOKVPL-MRXNPFEDSA-N 1 2 316.470 4.441 20 0 DIADLO CCc1nc(C[N@H+]2CCCC[C@@H]2c2ccccc2OC)cs1 ZINC000592331620 1050289728 /nfs/dbraw/zinc/28/97/28/1050289728.db2.gz PPSRQNDULOKVPL-MRXNPFEDSA-N 1 2 316.470 4.441 20 0 DIADLO C[N@H+](Cc1nc(C(F)(F)F)c[nH]1)Cc1ccc2ccccc2c1 ZINC001137018958 1050293729 /nfs/dbraw/zinc/29/37/29/1050293729.db2.gz LRJVETZQSAJJED-UHFFFAOYSA-N 1 2 319.330 4.214 20 0 DIADLO C[N@@H+](Cc1nc(C(F)(F)F)c[nH]1)Cc1ccc2ccccc2c1 ZINC001137018958 1050293738 /nfs/dbraw/zinc/29/37/38/1050293738.db2.gz LRJVETZQSAJJED-UHFFFAOYSA-N 1 2 319.330 4.214 20 0 DIADLO Clc1cscc1C[NH2+]Cc1nc(-c2ccncc2)cs1 ZINC000771958720 1050304426 /nfs/dbraw/zinc/30/44/26/1050304426.db2.gz FPZKFEVZTXHMFZ-UHFFFAOYSA-N 1 2 321.858 4.210 20 0 DIADLO CCCCCCc1ccc([C@@H](C)[NH2+][C@H](C)c2ncn(C)n2)cc1 ZINC000783301161 1050309254 /nfs/dbraw/zinc/30/92/54/1050309254.db2.gz ZTTZMBUAYMJMLV-HZPDHXFCSA-N 1 2 314.477 4.350 20 0 DIADLO O=c1[nH]cc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)cc1F ZINC001210598612 1050309774 /nfs/dbraw/zinc/30/97/74/1050309774.db2.gz HLJAYVHUCFLLSB-UHFFFAOYSA-N 1 2 323.249 4.237 20 0 DIADLO Cc1cc(N2CCC[C@H]2c2ccc(F)c(F)c2)nc(C2CC2)[nH+]1 ZINC000734834050 1050323108 /nfs/dbraw/zinc/32/31/08/1050323108.db2.gz ZPKIWTBFBXMNDK-INIZCTEOSA-N 1 2 315.367 4.282 20 0 DIADLO Fc1ccc(C[NH+]2CCC(c3ccccn3)CC2)c(F)c1Cl ZINC001143626265 1050328671 /nfs/dbraw/zinc/32/86/71/1050328671.db2.gz OJDZSFBETDXANV-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Cc1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@](C)(F)[C@@H](F)C2)c1 ZINC001143672621 1050331907 /nfs/dbraw/zinc/33/19/07/1050331907.db2.gz NSWVHVRTCANQTQ-KBPBESRZSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1ccc(C(F)(F)F)c(C[N@H+]2CC[C@](C)(F)[C@@H](F)C2)c1 ZINC001143672621 1050331915 /nfs/dbraw/zinc/33/19/15/1050331915.db2.gz NSWVHVRTCANQTQ-KBPBESRZSA-N 1 2 307.306 4.286 20 0 DIADLO FC(F)(F)Oc1ccc(Cl)cc1C[N@@H+]1CCCC12CC2 ZINC001143699308 1050337544 /nfs/dbraw/zinc/33/75/44/1050337544.db2.gz WLRCRMNAYXKDCF-UHFFFAOYSA-N 1 2 305.727 4.367 20 0 DIADLO FC(F)(F)Oc1ccc(Cl)cc1C[N@H+]1CCCC12CC2 ZINC001143699308 1050337550 /nfs/dbraw/zinc/33/75/50/1050337550.db2.gz WLRCRMNAYXKDCF-UHFFFAOYSA-N 1 2 305.727 4.367 20 0 DIADLO c1cc2cc(Nc3ccc[nH+]c3N3CCCCC3)cnc2s1 ZINC001210691750 1050339567 /nfs/dbraw/zinc/33/95/67/1050339567.db2.gz MXRGVJUVUKDJNN-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO OCC[C@@H]1CCC[N@H+](Cc2c(Cl)cc(Cl)cc2Cl)C1 ZINC001143799882 1050364281 /nfs/dbraw/zinc/36/42/81/1050364281.db2.gz CCYSYVGRDFJZIK-JTQLQIEISA-N 1 2 322.663 4.241 20 0 DIADLO OCC[C@@H]1CCC[N@@H+](Cc2c(Cl)cc(Cl)cc2Cl)C1 ZINC001143799882 1050364290 /nfs/dbraw/zinc/36/42/90/1050364290.db2.gz CCYSYVGRDFJZIK-JTQLQIEISA-N 1 2 322.663 4.241 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(F)ccc(F)c2Br)C2(CC2)C1 ZINC001143824302 1050369132 /nfs/dbraw/zinc/36/91/32/1050369132.db2.gz ZXEHNJUFPJDKAK-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c(F)ccc(F)c2Br)C2(CC2)C1 ZINC001143824302 1050369145 /nfs/dbraw/zinc/36/91/45/1050369145.db2.gz ZXEHNJUFPJDKAK-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO COc1cc(Nc2ccc(-c3ccc(N)cc3)cc2)cc(C)[nH+]1 ZINC001210781232 1050369893 /nfs/dbraw/zinc/36/98/93/1050369893.db2.gz OUMCEZAIPMESCO-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1c(F)ccc(F)c1Br ZINC001143811035 1050369988 /nfs/dbraw/zinc/36/99/88/1050369988.db2.gz CKULWXQKNQRBLT-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1c(F)ccc(F)c1Br ZINC001143811035 1050369996 /nfs/dbraw/zinc/36/99/96/1050369996.db2.gz CKULWXQKNQRBLT-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO COc1cc(Nc2ccc(C(C)=O)cc2C(F)(F)F)cc(C)[nH+]1 ZINC001210783239 1050370645 /nfs/dbraw/zinc/37/06/45/1050370645.db2.gz DKIMZWQFNYTKLT-UHFFFAOYSA-N 1 2 324.302 4.364 20 0 DIADLO CCOc1cccc([C@@H](C)[NH2+]Cc2occc2Br)c1 ZINC000735322123 1050370916 /nfs/dbraw/zinc/37/09/16/1050370916.db2.gz FJTMMXPUHRVLOL-LLVKDONJSA-N 1 2 324.218 4.292 20 0 DIADLO Brc1ccoc1C[NH2+]Cc1cc2ccccc2o1 ZINC000735321019 1050371198 /nfs/dbraw/zinc/37/11/98/1050371198.db2.gz UVFZPCQHXAXFNI-UHFFFAOYSA-N 1 2 306.159 4.078 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1ccnn1CC1CCC1 ZINC000924859348 1050371669 /nfs/dbraw/zinc/37/16/69/1050371669.db2.gz VDQMTGVSNGTCHK-GFCCVEGCSA-N 1 2 321.827 4.327 20 0 DIADLO Cc1nonc1C[N@@H+]1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000735311980 1050372958 /nfs/dbraw/zinc/37/29/58/1050372958.db2.gz ZVJSIFYQZYMAEW-MRXNPFEDSA-N 1 2 305.809 4.149 20 0 DIADLO Cc1nonc1C[N@H+]1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000735311980 1050372970 /nfs/dbraw/zinc/37/29/70/1050372970.db2.gz ZVJSIFYQZYMAEW-MRXNPFEDSA-N 1 2 305.809 4.149 20 0 DIADLO CCOc1c(Cl)ccc(C[NH+]2CCC(C(F)F)CC2)c1F ZINC001143832785 1050374880 /nfs/dbraw/zinc/37/48/80/1050374880.db2.gz KADUZCQYJTUGEZ-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO CC(=O)c1ccncc1Nc1ccc(N(C)C2CCCCC2)[nH+]c1 ZINC001212613050 1050378605 /nfs/dbraw/zinc/37/86/05/1050378605.db2.gz AMZODHMSFYEHHW-UHFFFAOYSA-N 1 2 324.428 4.192 20 0 DIADLO O=C(/C=C/C1CCCCC1)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000735432580 1050392302 /nfs/dbraw/zinc/39/23/02/1050392302.db2.gz MSBXWNGDMRUVOT-RMKNXTFCSA-N 1 2 313.376 4.086 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)c1F ZINC001143886537 1050395831 /nfs/dbraw/zinc/39/58/31/1050395831.db2.gz VVQCMGZKGXHQOY-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCC[C@@H]2c2cccnc2)c1F ZINC001143886537 1050395847 /nfs/dbraw/zinc/39/58/47/1050395847.db2.gz VVQCMGZKGXHQOY-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1F ZINC001143895838 1050401853 /nfs/dbraw/zinc/40/18/53/1050401853.db2.gz JEMLPLVRCUSAON-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCC[C@@H]2c2ccccn2)c1F ZINC001143895838 1050401858 /nfs/dbraw/zinc/40/18/58/1050401858.db2.gz JEMLPLVRCUSAON-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@H]2c2cccnc2)c(F)c1F ZINC001143911186 1050403073 /nfs/dbraw/zinc/40/30/73/1050403073.db2.gz UTHKCGCDCFQTMP-HNNXBMFYSA-N 1 2 318.367 4.096 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@H]2c2cccnc2)c(F)c1F ZINC001143911186 1050403091 /nfs/dbraw/zinc/40/30/91/1050403091.db2.gz UTHKCGCDCFQTMP-HNNXBMFYSA-N 1 2 318.367 4.096 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1ccc(OC)c(F)c1F ZINC001143914947 1050403726 /nfs/dbraw/zinc/40/37/26/1050403726.db2.gz NNOQXMQSHXRQST-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1ccc(OC)c(F)c1F ZINC001143914947 1050403735 /nfs/dbraw/zinc/40/37/35/1050403735.db2.gz NNOQXMQSHXRQST-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC(=O)NCc1cc(Nc2c(C)cc[nH+]c2C(C)C)ccc1F ZINC001210890304 1050407226 /nfs/dbraw/zinc/40/72/26/1050407226.db2.gz GHMPAYKZLSUBJP-UHFFFAOYSA-N 1 2 315.392 4.032 20 0 DIADLO CC(=O)NCc1cc(Nc2ccc3c(C)cc[nH+]c3c2)ccc1F ZINC001210894715 1050409395 /nfs/dbraw/zinc/40/93/95/1050409395.db2.gz HTXPLNQHLDLXHI-UHFFFAOYSA-N 1 2 323.371 4.062 20 0 DIADLO CCOc1ccc(F)c(C[N@H+](C)Cc2ccccc2C)c1F ZINC001143937652 1050410730 /nfs/dbraw/zinc/41/07/30/1050410730.db2.gz VDOXUBFWYQOOJD-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CCOc1ccc(F)c(C[N@@H+](C)Cc2ccccc2C)c1F ZINC001143937652 1050410736 /nfs/dbraw/zinc/41/07/36/1050410736.db2.gz VDOXUBFWYQOOJD-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC[C@H](F)C(F)(F)CC2)c1F ZINC001143946803 1050412819 /nfs/dbraw/zinc/41/28/19/1050412819.db2.gz WITCZVCDBXGTDM-NSHDSACASA-N 1 2 313.697 4.187 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c1F ZINC001143946803 1050412825 /nfs/dbraw/zinc/41/28/25/1050412825.db2.gz WITCZVCDBXGTDM-NSHDSACASA-N 1 2 313.697 4.187 20 0 DIADLO COc1ccc(F)c(C[N@H+]2Cc3ccccc3[C@H](C)C2)c1F ZINC001143970417 1050418860 /nfs/dbraw/zinc/41/88/60/1050418860.db2.gz KAUJUYVFNSHSPH-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c1F ZINC001143970417 1050418868 /nfs/dbraw/zinc/41/88/68/1050418868.db2.gz KAUJUYVFNSHSPH-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2c(F)ccc(OC)c2F)cc1 ZINC001143980224 1050426343 /nfs/dbraw/zinc/42/63/43/1050426343.db2.gz FVEBDYOUHLXWNQ-UHFFFAOYSA-N 1 2 305.368 4.168 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2c(F)ccc(OC)c2F)cc1 ZINC001143980224 1050426349 /nfs/dbraw/zinc/42/63/49/1050426349.db2.gz FVEBDYOUHLXWNQ-UHFFFAOYSA-N 1 2 305.368 4.168 20 0 DIADLO Cc1ccc([C@@H]2CCC[C@H]2OC(=O)C[C@H](C)n2cc[nH+]c2)cc1 ZINC000844480402 1050429087 /nfs/dbraw/zinc/42/90/87/1050429087.db2.gz FKPWRMZHGCWEQK-RYQLBKOJSA-N 1 2 312.413 4.022 20 0 DIADLO Cc1cc(C)c2[nH+]c(N[C@@H]3NC(=O)c4ccccc43)cc(C)c2c1 ZINC001171126415 1050434323 /nfs/dbraw/zinc/43/43/23/1050434323.db2.gz PDLFFUOFBUEINZ-LJQANCHMSA-N 1 2 317.392 4.014 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)OC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000844488890 1050439594 /nfs/dbraw/zinc/43/95/94/1050439594.db2.gz DGMVECCJDYKBLF-OCCSQVGLSA-N 1 2 312.369 4.193 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)cc1F ZINC001144027855 1050444462 /nfs/dbraw/zinc/44/44/62/1050444462.db2.gz XCDIDMZYMHXAGB-NSHDSACASA-N 1 2 323.305 4.138 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)cc1F ZINC001144027855 1050444467 /nfs/dbraw/zinc/44/44/67/1050444467.db2.gz XCDIDMZYMHXAGB-NSHDSACASA-N 1 2 323.305 4.138 20 0 DIADLO CCOc1c(F)cc(C[N@H+](C)Cc2ccccc2F)cc1F ZINC001144027634 1050445557 /nfs/dbraw/zinc/44/55/57/1050445557.db2.gz URAWLAYRZKTTJN-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CCOc1c(F)cc(C[N@@H+](C)Cc2ccccc2F)cc1F ZINC001144027634 1050445566 /nfs/dbraw/zinc/44/55/66/1050445566.db2.gz URAWLAYRZKTTJN-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO Cc1ccc(Nc2cccc([C@@H]3CN4C=CSC4=N3)c2)[nH+]c1 ZINC001211013472 1050447092 /nfs/dbraw/zinc/44/70/92/1050447092.db2.gz ZTZKUDAWFSHSNT-HNNXBMFYSA-N 1 2 308.410 4.064 20 0 DIADLO CN(c1ccc(Nc2cccc(F)n2)c[nH+]1)C1CCCCC1 ZINC001212613182 1050448507 /nfs/dbraw/zinc/44/85/07/1050448507.db2.gz HDXXZQFBNCIADU-UHFFFAOYSA-N 1 2 300.381 4.128 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CC[C@@H](C(F)(F)F)C3)co2)cc1 ZINC000761044858 1050473782 /nfs/dbraw/zinc/47/37/82/1050473782.db2.gz GXHRCDVNSZHNJA-CYBMUJFWSA-N 1 2 310.319 4.034 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CC[C@@H](C(F)(F)F)C3)co2)cc1 ZINC000761044858 1050473793 /nfs/dbraw/zinc/47/37/93/1050473793.db2.gz GXHRCDVNSZHNJA-CYBMUJFWSA-N 1 2 310.319 4.034 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2n[nH]c3ccc(F)cc32)cc1 ZINC001144196517 1050489566 /nfs/dbraw/zinc/48/95/66/1050489566.db2.gz JYUVCKKCEDDAJM-IBGZPJMESA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2n[nH]c3ccc(F)cc32)cc1 ZINC001144196517 1050489570 /nfs/dbraw/zinc/48/95/70/1050489570.db2.gz JYUVCKKCEDDAJM-IBGZPJMESA-N 1 2 309.388 4.348 20 0 DIADLO Fc1ccc2[nH]nc(C[NH+]3CCC(c4cccs4)CC3)c2c1 ZINC001144199612 1050492997 /nfs/dbraw/zinc/49/29/97/1050492997.db2.gz OUFGSKLUHSMIQQ-UHFFFAOYSA-N 1 2 315.417 4.143 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cccc(-c4cccnc4)c3)ccc21 ZINC001211144437 1050497171 /nfs/dbraw/zinc/49/71/71/1050497171.db2.gz MINDXAPIVBLKTG-UHFFFAOYSA-N 1 2 300.365 4.379 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1n[nH]c2ccc(F)cc21 ZINC001144202517 1050497769 /nfs/dbraw/zinc/49/77/69/1050497769.db2.gz SSHNLVJWQOMWQO-LJQANCHMSA-N 1 2 309.388 4.211 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1n[nH]c2ccc(F)cc21 ZINC001144202517 1050497778 /nfs/dbraw/zinc/49/77/78/1050497778.db2.gz SSHNLVJWQOMWQO-LJQANCHMSA-N 1 2 309.388 4.211 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761055708 1050498541 /nfs/dbraw/zinc/49/85/41/1050498541.db2.gz VUVQSMGVQCYPET-SNVBAGLBSA-N 1 2 316.348 4.096 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761055708 1050498549 /nfs/dbraw/zinc/49/85/49/1050498549.db2.gz VUVQSMGVQCYPET-SNVBAGLBSA-N 1 2 316.348 4.096 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(C)cc1OCc1ccccc1 ZINC000574697474 1050507495 /nfs/dbraw/zinc/50/74/95/1050507495.db2.gz KCHKDWONOZRPQS-UHFFFAOYSA-N 1 2 321.424 4.403 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC[C@@H]1c1cc(C)on1 ZINC000786764142 1050515722 /nfs/dbraw/zinc/51/57/22/1050515722.db2.gz RBAWHXVRXTWBRT-MRXNPFEDSA-N 1 2 323.396 4.190 20 0 DIADLO CC(C)(C)OC(=O)Cc1ccc[nH+]c1NCCC1=CCCCC1 ZINC001168771310 1050519767 /nfs/dbraw/zinc/51/97/67/1050519767.db2.gz WPLRAGUHYIMOBF-UHFFFAOYSA-N 1 2 316.445 4.268 20 0 DIADLO CC[N@H+](Cn1nc(-c2ccccc2Cl)oc1=S)C1CCC1 ZINC000738053795 1050523378 /nfs/dbraw/zinc/52/33/78/1050523378.db2.gz MSVGLRCTUQVYIV-UHFFFAOYSA-N 1 2 323.849 4.358 20 0 DIADLO CC[N@@H+](Cn1nc(-c2ccccc2Cl)oc1=S)C1CCC1 ZINC000738053795 1050523387 /nfs/dbraw/zinc/52/33/87/1050523387.db2.gz MSVGLRCTUQVYIV-UHFFFAOYSA-N 1 2 323.849 4.358 20 0 DIADLO CO[C@@H](c1ccccc1)[C@@H](C)Nc1ccc([NH+]2CCCC2)cc1 ZINC000786870839 1050524712 /nfs/dbraw/zinc/52/47/12/1050524712.db2.gz GNPRNMFNYVSWAQ-OXQOHEQNSA-N 1 2 310.441 4.475 20 0 DIADLO CO[C@H](c1ccccc1)[C@@H](C)Nc1ccc2c(c1)CCC[N@H+]2C ZINC000786903603 1050525671 /nfs/dbraw/zinc/52/56/71/1050525671.db2.gz YMNJOGFJCLMELP-QRWLVFNGSA-N 1 2 310.441 4.257 20 0 DIADLO CO[C@H](c1ccccc1)[C@@H](C)Nc1ccc2c(c1)CCC[N@@H+]2C ZINC000786903603 1050525676 /nfs/dbraw/zinc/52/56/76/1050525676.db2.gz YMNJOGFJCLMELP-QRWLVFNGSA-N 1 2 310.441 4.257 20 0 DIADLO CC(C)(C)[C@@H]1CCC[N@H+](Cn2ncn(C(C)(C)C)c2=S)CC1 ZINC000738239394 1050527754 /nfs/dbraw/zinc/52/77/54/1050527754.db2.gz KKQRVOFPBLSVGI-CQSZACIVSA-N 1 2 324.538 4.275 20 0 DIADLO CC(C)(C)[C@@H]1CCC[N@@H+](Cn2ncn(C(C)(C)C)c2=S)CC1 ZINC000738239394 1050527766 /nfs/dbraw/zinc/52/77/66/1050527766.db2.gz KKQRVOFPBLSVGI-CQSZACIVSA-N 1 2 324.538 4.275 20 0 DIADLO Cc1ccc([C@H]2[C@@H](C)CCC[N@@H+]2Cc2ncc(Cl)n2C)cc1 ZINC000738340199 1050531117 /nfs/dbraw/zinc/53/11/17/1050531117.db2.gz KYURLZIVWMDMDX-KBXCAEBGSA-N 1 2 317.864 4.355 20 0 DIADLO Cc1ccc([C@H]2[C@@H](C)CCC[N@H+]2Cc2ncc(Cl)n2C)cc1 ZINC000738340199 1050531126 /nfs/dbraw/zinc/53/11/26/1050531126.db2.gz KYURLZIVWMDMDX-KBXCAEBGSA-N 1 2 317.864 4.355 20 0 DIADLO F[C@H]1CC[N@H+](Cc2ccc3ccccc3c2Br)C1 ZINC001144308006 1050539375 /nfs/dbraw/zinc/53/93/75/1050539375.db2.gz GHPWBSZPMQPGLW-ZDUSSCGKSA-N 1 2 308.194 4.146 20 0 DIADLO F[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2Br)C1 ZINC001144308006 1050539384 /nfs/dbraw/zinc/53/93/84/1050539384.db2.gz GHPWBSZPMQPGLW-ZDUSSCGKSA-N 1 2 308.194 4.146 20 0 DIADLO O=C(CCn1cc[nH+]c1)Nc1cccc(Sc2ccccc2)c1 ZINC000594635876 1050541644 /nfs/dbraw/zinc/54/16/44/1050541644.db2.gz QPBGDTJKTQCHKA-UHFFFAOYSA-N 1 2 323.421 4.063 20 0 DIADLO CCCCOC(=O)C[N@H+](C)[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000746653362 1050560271 /nfs/dbraw/zinc/56/02/71/1050560271.db2.gz TXBZYQFVDMLMMH-GFCCVEGCSA-N 1 2 317.351 4.042 20 0 DIADLO CCCCOC(=O)C[N@@H+](C)[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000746653362 1050560291 /nfs/dbraw/zinc/56/02/91/1050560291.db2.gz TXBZYQFVDMLMMH-GFCCVEGCSA-N 1 2 317.351 4.042 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1c[nH]c3nc(Cl)ccc13)C2 ZINC001144416390 1050569992 /nfs/dbraw/zinc/56/99/92/1050569992.db2.gz IDYNLCKPRHJXDU-UHFFFAOYSA-N 1 2 318.207 4.386 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1c[nH]c3nc(Cl)ccc13)C2 ZINC001144416390 1050570002 /nfs/dbraw/zinc/57/00/02/1050570002.db2.gz IDYNLCKPRHJXDU-UHFFFAOYSA-N 1 2 318.207 4.386 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)s2)nc1 ZINC001144428696 1050576107 /nfs/dbraw/zinc/57/61/07/1050576107.db2.gz YWTQMEYCMHPOLM-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)s2)nc1 ZINC001144428696 1050576118 /nfs/dbraw/zinc/57/61/18/1050576118.db2.gz YWTQMEYCMHPOLM-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO CC(=O)c1cccc(Nc2ccc(N(C)C3CCCCC3)[nH+]c2)n1 ZINC001212614145 1050581429 /nfs/dbraw/zinc/58/14/29/1050581429.db2.gz GREHFBLQCCTHKQ-UHFFFAOYSA-N 1 2 324.428 4.192 20 0 DIADLO COc1nc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc2ccccc21 ZINC001213087845 1050582177 /nfs/dbraw/zinc/58/21/77/1050582177.db2.gz CNCVONWBQCVCBN-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO Fc1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(Cl)c(F)n1 ZINC001213085987 1050582515 /nfs/dbraw/zinc/58/25/15/1050582515.db2.gz BNJMJMODHXPJCZ-UHFFFAOYSA-N 1 2 306.703 4.147 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3cncc(N4CCCCC4)c3)cc2)[nH]1 ZINC001213087963 1050582713 /nfs/dbraw/zinc/58/27/13/1050582713.db2.gz IUYCYQYFWGZOSF-UHFFFAOYSA-N 1 2 319.412 4.206 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3nc(-c4ccncc4)cs3)cc2)[nH]1 ZINC001213085446 1050582941 /nfs/dbraw/zinc/58/29/41/1050582941.db2.gz FTHCUHAXFGUIHU-UHFFFAOYSA-N 1 2 319.393 4.339 20 0 DIADLO Clc1ccc2nncc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)c2c1 ZINC001213086849 1050583210 /nfs/dbraw/zinc/58/32/10/1050583210.db2.gz CQCTULJXTQDGLY-UHFFFAOYSA-N 1 2 321.771 4.417 20 0 DIADLO COc1cc(C(C)=O)ccc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213088783 1050583394 /nfs/dbraw/zinc/58/33/94/1050583394.db2.gz DDHYBEWWLJCZNN-UHFFFAOYSA-N 1 2 307.353 4.032 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3cnc(-c4ccccc4)cn3)cc2)[nH]1 ZINC001213085491 1050583644 /nfs/dbraw/zinc/58/36/44/1050583644.db2.gz IKKBFVOYDSNGNF-UHFFFAOYSA-N 1 2 313.364 4.277 20 0 DIADLO Oc1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(F)cc1Cl ZINC001213088776 1050583922 /nfs/dbraw/zinc/58/39/22/1050583922.db2.gz CVKKAKRZUVRSHT-UHFFFAOYSA-N 1 2 303.724 4.318 20 0 DIADLO C[C@@H]1CCc2cc(N)ccc2N1c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213087965 1050584193 /nfs/dbraw/zinc/58/41/93/1050584193.db2.gz IXKABGDEUVAZBC-CYBMUJFWSA-N 1 2 304.397 4.132 20 0 DIADLO FC(F)Oc1ccccc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213088948 1050585608 /nfs/dbraw/zinc/58/56/08/1050585608.db2.gz LVWHECGLGMYUMF-UHFFFAOYSA-N 1 2 301.296 4.422 20 0 DIADLO COc1cnc2c(cccc2Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213091137 1050585905 /nfs/dbraw/zinc/58/59/05/1050585905.db2.gz YCYWRZPAUFBDHG-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO Nc1cc(F)cc(Cl)c1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213090998 1050586166 /nfs/dbraw/zinc/58/61/66/1050586166.db2.gz QJWPKFGROZSCPI-UHFFFAOYSA-N 1 2 302.740 4.195 20 0 DIADLO FC(F)Oc1cccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213090019 1050586997 /nfs/dbraw/zinc/58/69/97/1050586997.db2.gz PWSCGOISNYNJLD-UHFFFAOYSA-N 1 2 301.296 4.422 20 0 DIADLO Cc1cc(=O)oc2cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)ccc12 ZINC001213089082 1050587114 /nfs/dbraw/zinc/58/71/14/1050587114.db2.gz SUGJBECVYCDRPB-UHFFFAOYSA-N 1 2 317.348 4.235 20 0 DIADLO FC(F)(F)c1nc(Cl)ccc1C[N@@H+]1CCCC2(CC2)C1 ZINC000787310045 1050588976 /nfs/dbraw/zinc/58/89/76/1050588976.db2.gz VKTBCXBOBYERNS-UHFFFAOYSA-N 1 2 304.743 4.130 20 0 DIADLO FC(F)(F)c1nc(Cl)ccc1C[N@H+]1CCCC2(CC2)C1 ZINC000787310045 1050588991 /nfs/dbraw/zinc/58/89/91/1050588991.db2.gz VKTBCXBOBYERNS-UHFFFAOYSA-N 1 2 304.743 4.130 20 0 DIADLO CCOc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)c(OC)c1 ZINC001213118292 1050594020 /nfs/dbraw/zinc/59/40/20/1050594020.db2.gz RSKXWIBXSFTDRI-UHFFFAOYSA-N 1 2 309.369 4.023 20 0 DIADLO Cc1cc(N)ccc1Nc1ccc(N(C)C2CCCCC2)[nH+]c1 ZINC001212614478 1050595312 /nfs/dbraw/zinc/59/53/12/1050595312.db2.gz PNBGUINVRDUVPH-UHFFFAOYSA-N 1 2 310.445 4.485 20 0 DIADLO CCOc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)c(OC)c1 ZINC001213118962 1050595841 /nfs/dbraw/zinc/59/58/41/1050595841.db2.gz FQMCDUWMSJICPJ-UHFFFAOYSA-N 1 2 323.396 4.082 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(C(F)(F)C(F)(F)F)cc1 ZINC000669555595 1050605440 /nfs/dbraw/zinc/60/54/40/1050605440.db2.gz PYKDPGSRPLBXDC-UHFFFAOYSA-N 1 2 319.277 4.169 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1nnc(C2CC2)s1 ZINC000574898385 1050605464 /nfs/dbraw/zinc/60/54/64/1050605464.db2.gz UQXDXHXEQSLVGT-NSHDSACASA-N 1 2 313.426 4.321 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cccnc2C(F)(F)F)cn1 ZINC001144537958 1050610718 /nfs/dbraw/zinc/61/07/18/1050610718.db2.gz CEOYROZLSDLQPQ-OAHLLOKOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cccnc2C(F)(F)F)cn1 ZINC001144537958 1050610726 /nfs/dbraw/zinc/61/07/26/1050610726.db2.gz CEOYROZLSDLQPQ-OAHLLOKOSA-N 1 2 321.346 4.141 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCCC[C@@H]2c2ccccc2)c(F)c1 ZINC001144542395 1050610865 /nfs/dbraw/zinc/61/08/65/1050610865.db2.gz WAJFBOQRUGWUQE-GOSISDBHSA-N 1 2 303.352 4.398 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCCC[C@@H]2c2ccccc2)c(F)c1 ZINC001144542395 1050610873 /nfs/dbraw/zinc/61/08/73/1050610873.db2.gz WAJFBOQRUGWUQE-GOSISDBHSA-N 1 2 303.352 4.398 20 0 DIADLO CC(C)c1cc(N2CCC[C@]3(CC3(F)F)C2)nc(C(C)C)[nH+]1 ZINC000845744984 1050613277 /nfs/dbraw/zinc/61/32/77/1050613277.db2.gz ZEUPVYLIYMEJKK-INIZCTEOSA-N 1 2 309.404 4.349 20 0 DIADLO C[N@H+](Cc1ccc2ccccc2c1)Cc1c(F)cc(O)cc1F ZINC001144560821 1050618308 /nfs/dbraw/zinc/61/83/08/1050618308.db2.gz APIFRLFKGQBMIF-UHFFFAOYSA-N 1 2 313.347 4.456 20 0 DIADLO C[N@@H+](Cc1ccc2ccccc2c1)Cc1c(F)cc(O)cc1F ZINC001144560821 1050618320 /nfs/dbraw/zinc/61/83/20/1050618320.db2.gz APIFRLFKGQBMIF-UHFFFAOYSA-N 1 2 313.347 4.456 20 0 DIADLO FC(F)COc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001213305192 1050623596 /nfs/dbraw/zinc/62/35/96/1050623596.db2.gz QCOMYFFNFCKIRP-UHFFFAOYSA-N 1 2 315.323 4.260 20 0 DIADLO CSc1cc(NC(=O)[C@H](CC(C)C)n2cc[nH+]c2)ccc1C ZINC001144583883 1050624468 /nfs/dbraw/zinc/62/44/68/1050624468.db2.gz XBQJRNALCOBXQU-HNNXBMFYSA-N 1 2 317.458 4.139 20 0 DIADLO CC[C@]1(C)CCC[C@H]1[NH2+]c1ccc(N2CCC(O)CC2)cc1 ZINC000845916540 1050630910 /nfs/dbraw/zinc/63/09/10/1050630910.db2.gz WUEHQBUOWSVOGD-RTBURBONSA-N 1 2 302.462 4.028 20 0 DIADLO CSc1ccccc1[C@H]1CCCN1Cc1[nH+]cn2ccccc12 ZINC001144625628 1050631215 /nfs/dbraw/zinc/63/12/15/1050631215.db2.gz QWDZCNOGPALEQW-QGZVFWFLSA-N 1 2 323.465 4.393 20 0 DIADLO COc1cccc(C(F)(F)F)c1Nc1cccc2[nH+]c(C)cn21 ZINC001213339714 1050633520 /nfs/dbraw/zinc/63/35/20/1050633520.db2.gz WRNQBZSKTRNOFG-UHFFFAOYSA-N 1 2 321.302 4.414 20 0 DIADLO FC1(F)CC2(C[NH+](Cc3cc4ccccc4nc3Cl)C2)C1 ZINC000761115310 1050642413 /nfs/dbraw/zinc/64/24/13/1050642413.db2.gz QZVGDZLVGCNWRU-UHFFFAOYSA-N 1 2 308.759 4.119 20 0 DIADLO C[N@H+](Cc1noc2c1CCCC2)Cc1ccc2ccccc2c1 ZINC000595544463 1050642608 /nfs/dbraw/zinc/64/26/08/1050642608.db2.gz GKMWRKVSBZCVGT-UHFFFAOYSA-N 1 2 306.409 4.339 20 0 DIADLO C[N@@H+](Cc1noc2c1CCCC2)Cc1ccc2ccccc2c1 ZINC000595544463 1050642616 /nfs/dbraw/zinc/64/26/16/1050642616.db2.gz GKMWRKVSBZCVGT-UHFFFAOYSA-N 1 2 306.409 4.339 20 0 DIADLO CN(c1ccc(C(C)(C)C(F)(F)F)cc1)c1[nH+]cccc1N ZINC001213390558 1050646274 /nfs/dbraw/zinc/64/62/74/1050646274.db2.gz IOXCYQJCCNHSBV-UHFFFAOYSA-N 1 2 309.335 4.272 20 0 DIADLO CCCCCC(=O)N[C@H]1CCc2[nH+]c(C3CCCCC3)[nH]c2C1 ZINC000788246013 1050660857 /nfs/dbraw/zinc/66/08/57/1050660857.db2.gz IHUDRNITMBRKEV-HNNXBMFYSA-N 1 2 317.477 4.011 20 0 DIADLO CCCCCC(=O)N[C@H]1CCc2[nH]c(C3CCCCC3)[nH+]c2C1 ZINC000788246013 1050660864 /nfs/dbraw/zinc/66/08/64/1050660864.db2.gz IHUDRNITMBRKEV-HNNXBMFYSA-N 1 2 317.477 4.011 20 0 DIADLO COC(=O)c1oc([C@H](C)[N@@H+]2CC[C@@H]2c2ccc(F)cc2)cc1C ZINC000595701875 1050662049 /nfs/dbraw/zinc/66/20/49/1050662049.db2.gz GWQHSAFMQWJGQZ-SWLSCSKDSA-N 1 2 317.360 4.022 20 0 DIADLO COC(=O)c1oc([C@H](C)[N@H+]2CC[C@@H]2c2ccc(F)cc2)cc1C ZINC000595701875 1050662058 /nfs/dbraw/zinc/66/20/58/1050662058.db2.gz GWQHSAFMQWJGQZ-SWLSCSKDSA-N 1 2 317.360 4.022 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)OCc1cccc(Cl)c1)c1ccccc1 ZINC000741150912 1050662468 /nfs/dbraw/zinc/66/24/68/1050662468.db2.gz PPIHFFISPPJCCQ-KRWDZBQOSA-N 1 2 317.816 4.076 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)OCc1cccc(Cl)c1)c1ccccc1 ZINC000741150912 1050662478 /nfs/dbraw/zinc/66/24/78/1050662478.db2.gz PPIHFFISPPJCCQ-KRWDZBQOSA-N 1 2 317.816 4.076 20 0 DIADLO FC(F)(F)c1cc(Cl)cc(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)c1 ZINC000846112921 1050666207 /nfs/dbraw/zinc/66/62/07/1050666207.db2.gz UZTOCUCZEQHODE-PHIMTYICSA-N 1 2 311.681 4.056 20 0 DIADLO FC(F)(F)c1cc(Cl)cc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)c1 ZINC000846112921 1050666216 /nfs/dbraw/zinc/66/62/16/1050666216.db2.gz UZTOCUCZEQHODE-PHIMTYICSA-N 1 2 311.681 4.056 20 0 DIADLO CC(=O)c1oc2cccnc2c1Nc1cc(C2CC2)c[nH+]c1C ZINC001213495158 1050669376 /nfs/dbraw/zinc/66/93/76/1050669376.db2.gz TUUANMOLCLNTAI-UHFFFAOYSA-N 1 2 307.353 4.355 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cccc(-c2cccc(N)n2)n1 ZINC001213491333 1050669774 /nfs/dbraw/zinc/66/97/74/1050669774.db2.gz HRFUANGNEMMNOM-UHFFFAOYSA-N 1 2 317.396 4.050 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cncc(Br)c1C ZINC001213495208 1050669816 /nfs/dbraw/zinc/66/98/16/1050669816.db2.gz WFPZBMZXOHDRIV-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1cc(Nc2cc(C3CC3)c[nH+]c2C)ncc1Br ZINC001213488750 1050669963 /nfs/dbraw/zinc/66/99/63/1050669963.db2.gz CEINFXJMFXXXDK-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1cnc(Nc2cc(C3CC3)c[nH+]c2C)c(Br)c1 ZINC001213489539 1050670711 /nfs/dbraw/zinc/67/07/11/1050670711.db2.gz QXJFEQKAOKOJIM-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnccc1OC(F)(F)F ZINC001213497263 1050671455 /nfs/dbraw/zinc/67/14/55/1050671455.db2.gz LHQGASNYHFIZMB-UHFFFAOYSA-N 1 2 309.291 4.305 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cc(O)ccc1Br ZINC001213499091 1050672149 /nfs/dbraw/zinc/67/21/49/1050672149.db2.gz BMQQTYYZIWFFJJ-UHFFFAOYSA-N 1 2 319.202 4.479 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2nc(C3CCC3)nn2c1 ZINC001213497599 1050672203 /nfs/dbraw/zinc/67/22/03/1050672203.db2.gz XCKZKHYBHDWPJH-UHFFFAOYSA-N 1 2 319.412 4.321 20 0 DIADLO COc1ccc(-n2nccc2Nc2cc(C3CC3)c[nH+]c2C)cc1 ZINC001213496936 1050672752 /nfs/dbraw/zinc/67/27/52/1050672752.db2.gz FNAMCZRRLRBYES-UHFFFAOYSA-N 1 2 320.396 4.205 20 0 DIADLO Cc1cc(C)c(Nc2cncc(Br)c2Cl)c[nH+]1 ZINC001213505420 1050674005 /nfs/dbraw/zinc/67/40/05/1050674005.db2.gz DVOMHKXKUUBWQY-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO COC(=O)CCc1ccc(Nc2cc(C3CC3)c[nH+]c2C)cc1 ZINC001213501152 1050674436 /nfs/dbraw/zinc/67/44/36/1050674436.db2.gz KDJGCSPEBWNOQV-UHFFFAOYSA-N 1 2 310.397 4.117 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2c(c1)CN(C1CC1)C2=O ZINC001213503478 1050675094 /nfs/dbraw/zinc/67/50/94/1050675094.db2.gz INYRFVZIXSHIJW-UHFFFAOYSA-N 1 2 319.408 4.129 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cc(N)cc(Br)c1 ZINC001213501068 1050675188 /nfs/dbraw/zinc/67/51/88/1050675188.db2.gz GKLXMVAVXFHFCW-UHFFFAOYSA-N 1 2 318.218 4.356 20 0 DIADLO COc1cc(Br)ccc1Nc1c[nH+]c(C)cc1C ZINC001213513598 1050676968 /nfs/dbraw/zinc/67/69/68/1050676968.db2.gz YGVMDQSNFKNUCS-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO CC(=O)c1c(Br)cccc1Nc1c[nH+]c(C)cc1C ZINC001213518232 1050677392 /nfs/dbraw/zinc/67/73/92/1050677392.db2.gz CBCPLLNYTJGXFH-UHFFFAOYSA-N 1 2 319.202 4.407 20 0 DIADLO Cc1cc(C)c(Nc2ccc(Oc3cc[nH]c(=O)c3)cc2)c[nH+]1 ZINC001213518239 1050677509 /nfs/dbraw/zinc/67/75/09/1050677509.db2.gz CJENAKFEVFHRFF-UHFFFAOYSA-N 1 2 307.353 4.335 20 0 DIADLO Cc1cc(C)c(Nc2ccccc2-c2nc(CO)cs2)c[nH+]1 ZINC001213520965 1050678548 /nfs/dbraw/zinc/67/85/48/1050678548.db2.gz MQZUSRLPDMXDGC-UHFFFAOYSA-N 1 2 311.410 4.058 20 0 DIADLO Cc1cc(C)c(Nc2cccc(F)c2OC[C@@H]2CCCO2)c[nH+]1 ZINC001213520386 1050678779 /nfs/dbraw/zinc/67/87/79/1050678779.db2.gz AOXJEPOFNKWMGV-AWEZNQCLSA-N 1 2 316.376 4.139 20 0 DIADLO CCOc1ccc(-c2cc(Nc3c[nH+]cc(C)c3C)on2)cc1 ZINC001213522848 1050679792 /nfs/dbraw/zinc/67/97/92/1050679792.db2.gz HUUDFAOLMBALHH-UHFFFAOYSA-N 1 2 309.369 4.496 20 0 DIADLO COc1cccc(Cn2ncc(C)c2Nc2c[nH+]cc(C)c2C)c1 ZINC001213527493 1050679823 /nfs/dbraw/zinc/67/98/23/1050679823.db2.gz OKYWBDQONDEUMV-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO COc1ccc(C(C)=O)c(Nc2c[nH+]c(C)cc2C)c1Cl ZINC001213518574 1050679861 /nfs/dbraw/zinc/67/98/61/1050679861.db2.gz WIIUAUKZYFYBKO-UHFFFAOYSA-N 1 2 304.777 4.307 20 0 DIADLO Cc1c[nH+]cc(Nc2nc(Cl)ccc2Br)c1C ZINC001213527611 1050679876 /nfs/dbraw/zinc/67/98/76/1050679876.db2.gz VPKOYQXXDVGOES-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO COc1ccc(Br)c(Nc2c[nH+]cc(C)c2C)c1 ZINC001213528321 1050680047 /nfs/dbraw/zinc/68/00/47/1050680047.db2.gz AELVQZBEMHLBCT-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1cc(C)c(Nc2cccc([C@H]3CN4C=CSC4=N3)c2)c[nH+]1 ZINC001213520467 1050680212 /nfs/dbraw/zinc/68/02/12/1050680212.db2.gz BNINIAOUGBLOQT-QGZVFWFLSA-N 1 2 322.437 4.373 20 0 DIADLO CC(C)c1cccc(CNc2cc(CSCCO)cc[nH+]2)c1 ZINC000596025216 1050681288 /nfs/dbraw/zinc/68/12/88/1050681288.db2.gz RRJMJJOJIFFELK-UHFFFAOYSA-N 1 2 316.470 4.043 20 0 DIADLO CCOC(=O)c1cc(Nc2c[nH+]cc(C)c2C)ccc1Cl ZINC001213532308 1050681540 /nfs/dbraw/zinc/68/15/40/1050681540.db2.gz ASLVDNYOVQHTTG-UHFFFAOYSA-N 1 2 304.777 4.272 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc3c(cnn3[C@@H]3CCCCO3)c2)c1C ZINC001213531232 1050682495 /nfs/dbraw/zinc/68/24/95/1050682495.db2.gz XGNLEPPLNPAVSD-IBGZPJMESA-N 1 2 322.412 4.491 20 0 DIADLO Fc1cc(Cl)c(C[N@H+]2CC[C@@H](F)C(F)(F)CC2)cc1F ZINC001144721976 1050684657 /nfs/dbraw/zinc/68/46/57/1050684657.db2.gz JQMPUCJUOGEBFA-GFCCVEGCSA-N 1 2 313.697 4.187 20 0 DIADLO Fc1cc(Cl)c(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)cc1F ZINC001144721976 1050684662 /nfs/dbraw/zinc/68/46/62/1050684662.db2.gz JQMPUCJUOGEBFA-GFCCVEGCSA-N 1 2 313.697 4.187 20 0 DIADLO COC(=O)Cc1cc[nH+]c(N[C@@H](C)c2oc3ccccc3c2C)c1 ZINC000596081055 1050685265 /nfs/dbraw/zinc/68/52/65/1050685265.db2.gz BUVPNDYPYAFPEG-ZDUSSCGKSA-N 1 2 324.380 4.025 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[N@H+](C)Cc1cnc(Cl)cn1 ZINC000788484537 1050690417 /nfs/dbraw/zinc/69/04/17/1050690417.db2.gz ANAFBXRFNWYQAU-LLVKDONJSA-N 1 2 324.881 4.211 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)Cc1cnc(Cl)cn1 ZINC000788484537 1050690419 /nfs/dbraw/zinc/69/04/19/1050690419.db2.gz ANAFBXRFNWYQAU-LLVKDONJSA-N 1 2 324.881 4.211 20 0 DIADLO Clc1ccccc1C[NH2+][C@H]1COCc2cccc(Cl)c21 ZINC000788497054 1050690874 /nfs/dbraw/zinc/69/08/74/1050690874.db2.gz CXCYZFXMNVMPDM-HNNXBMFYSA-N 1 2 308.208 4.355 20 0 DIADLO c1cn(Cc2cccc(Nc3ccccc3N3CCCC3)c2)c[nH+]1 ZINC001213607952 1050694434 /nfs/dbraw/zinc/69/44/34/1050694434.db2.gz IBVDMKJGTYHBJQ-UHFFFAOYSA-N 1 2 318.424 4.275 20 0 DIADLO CC(C)([NH2+]Cc1ncc(C(F)(F)F)s1)c1ccc(F)cc1 ZINC000788512439 1050696634 /nfs/dbraw/zinc/69/66/34/1050696634.db2.gz DSBBPSCNHGZDOF-UHFFFAOYSA-N 1 2 318.339 4.326 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CCSc3c(F)cccc32)c1 ZINC000846213804 1050703382 /nfs/dbraw/zinc/70/33/82/1050703382.db2.gz VBQVVMAABGVNPY-CQSZACIVSA-N 1 2 304.390 4.016 20 0 DIADLO Nc1cc(Cl)ccc1Nc1cc[nH+]c2ccc(Cl)cc12 ZINC001213644576 1050707379 /nfs/dbraw/zinc/70/73/79/1050707379.db2.gz WWQDHJWBJCCQOJ-UHFFFAOYSA-N 1 2 304.180 4.289 20 0 DIADLO Nc1cc(Cl)ccc1Nc1[nH+]cccc1N1CCCCC1 ZINC001213650639 1050709802 /nfs/dbraw/zinc/70/98/02/1050709802.db2.gz LZOPDARMTIGQEX-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@H]2CCc3ccc(Cl)nc32)on1 ZINC000788616120 1050715977 /nfs/dbraw/zinc/71/59/77/1050715977.db2.gz XDZHHITXIOODLT-AWEZNQCLSA-N 1 2 319.836 4.404 20 0 DIADLO Cc1cccc(Nc2ccc3cnn(C(=O)OC(C)(C)C)c3c2)[nH+]1 ZINC001213721767 1050724391 /nfs/dbraw/zinc/72/43/91/1050724391.db2.gz GFCXTWZUBMZUOR-UHFFFAOYSA-N 1 2 324.384 4.267 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@H]3CCc4ccc(Cl)nc43)ccc21 ZINC000788728446 1050734459 /nfs/dbraw/zinc/73/44/59/1050734459.db2.gz NGVCGMXVFAVQPK-HNNXBMFYSA-N 1 2 313.832 4.217 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@H]3CCc4ccc(Cl)nc43)ccc21 ZINC000788728446 1050734470 /nfs/dbraw/zinc/73/44/70/1050734470.db2.gz NGVCGMXVFAVQPK-HNNXBMFYSA-N 1 2 313.832 4.217 20 0 DIADLO Cc1cc(N[C@H]2COCc3cccc(Cl)c32)ccc1[NH+](C)C ZINC000788729986 1050735174 /nfs/dbraw/zinc/73/51/74/1050735174.db2.gz VUFIOKXIWVMUMC-INIZCTEOSA-N 1 2 316.832 4.398 20 0 DIADLO CCCCn1nc(C)c(CNc2cc3cc[nH]c3c[nH+]2)c1Cl ZINC000846776635 1050749518 /nfs/dbraw/zinc/74/95/18/1050749518.db2.gz GDKPLPHRPKFANY-UHFFFAOYSA-N 1 2 317.824 4.133 20 0 DIADLO Clc1ccc(/C=C/C[N@@H+]2CCO[C@@H](c3ccco3)C2)cc1 ZINC000180165188 1050751726 /nfs/dbraw/zinc/75/17/26/1050751726.db2.gz PEYFCJAKEXIYLH-XKKXFUJGSA-N 1 2 303.789 4.020 20 0 DIADLO Clc1ccc(/C=C/C[N@H+]2CCO[C@@H](c3ccco3)C2)cc1 ZINC000180165188 1050751740 /nfs/dbraw/zinc/75/17/40/1050751740.db2.gz PEYFCJAKEXIYLH-XKKXFUJGSA-N 1 2 303.789 4.020 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cnc(Cl)c(F)c2)cc1 ZINC000846769104 1050753758 /nfs/dbraw/zinc/75/37/58/1050753758.db2.gz WJUMGPLKTRCWFQ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cnc(Cl)c(F)c2)cc1 ZINC000846769104 1050753774 /nfs/dbraw/zinc/75/37/74/1050753774.db2.gz WJUMGPLKTRCWFQ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CC(=O)C1CC[NH+]([C@@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000846951863 1050787781 /nfs/dbraw/zinc/78/77/81/1050787781.db2.gz CBLDMSWQBPWZPL-JTQLQIEISA-N 1 2 300.229 4.355 20 0 DIADLO CC(=O)[C@H]1CCC[N@H+](Cc2ccc(C)c(Cl)c2Cl)C1 ZINC001231667042 1050762443 /nfs/dbraw/zinc/76/24/43/1050762443.db2.gz BTZSDWYDPRDCTL-LBPRGKRZSA-N 1 2 300.229 4.103 20 0 DIADLO CC(=O)[C@H]1CCC[N@@H+](Cc2ccc(C)c(Cl)c2Cl)C1 ZINC001231667042 1050762453 /nfs/dbraw/zinc/76/24/53/1050762453.db2.gz BTZSDWYDPRDCTL-LBPRGKRZSA-N 1 2 300.229 4.103 20 0 DIADLO CCC/C=C/C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000847007286 1050796775 /nfs/dbraw/zinc/79/67/75/1050796775.db2.gz DUTDMMFKEMKFNL-UUILKARUSA-N 1 2 309.413 4.181 20 0 DIADLO COc1cc(F)c(Nc2cccc3[nH+]c(C)cn32)cc1Cl ZINC001214058228 1050804946 /nfs/dbraw/zinc/80/49/46/1050804946.db2.gz LHICPJHGDPTCPC-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO Cc1nn(C[N@@H+]2CC[C@H](c3ccccc3)[C@@H](C)C2)c(=S)s1 ZINC000742167981 1050808091 /nfs/dbraw/zinc/80/80/91/1050808091.db2.gz XBTLBPXPGKCOOH-WFASDCNBSA-N 1 2 319.499 4.066 20 0 DIADLO Cc1nn(C[N@H+]2CC[C@H](c3ccccc3)[C@@H](C)C2)c(=S)s1 ZINC000742167981 1050808105 /nfs/dbraw/zinc/80/81/05/1050808105.db2.gz XBTLBPXPGKCOOH-WFASDCNBSA-N 1 2 319.499 4.066 20 0 DIADLO COc1cc(F)c(Nc2cccc(-n3cc[nH+]c3)c2)cc1Cl ZINC001214065372 1050809366 /nfs/dbraw/zinc/80/93/66/1050809366.db2.gz PUCUVJYDYXMSEV-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H]1CCCc2cc(OC(F)F)ccc21 ZINC000180331687 1050810419 /nfs/dbraw/zinc/81/04/19/1050810419.db2.gz IVVRLLFPCUIGTP-MGPLVRAMSA-N 1 2 321.371 4.048 20 0 DIADLO C/C(=C\C(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccc(F)cc1 ZINC000742282836 1050816583 /nfs/dbraw/zinc/81/65/83/1050816583.db2.gz HHJWZHAPAIKIRM-WYMLVPIESA-N 1 2 321.355 4.053 20 0 DIADLO Cc1ccc2c(Nc3c(F)cc(CO)cc3F)cccc2[nH+]1 ZINC001214098997 1050818665 /nfs/dbraw/zinc/81/86/65/1050818665.db2.gz JZHBBJIHLRVRFQ-UHFFFAOYSA-N 1 2 300.308 4.057 20 0 DIADLO Cc1cc(C)c(CNC(=S)Nc2ccc(C(C)C)cc2)c[nH+]1 ZINC000840826586 1050880326 /nfs/dbraw/zinc/88/03/26/1050880326.db2.gz OVSLGKHBFSHIOO-UHFFFAOYSA-N 1 2 313.470 4.308 20 0 DIADLO CSc1cc(Nc2cc(OC(F)(F)F)ccc2O)cc[nH+]1 ZINC001214380549 1050888863 /nfs/dbraw/zinc/88/88/63/1050888863.db2.gz VIHPZAPFUNUBPY-UHFFFAOYSA-N 1 2 316.304 4.151 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccc(Cl)nc2Cl)cc1 ZINC000234934025 1050909508 /nfs/dbraw/zinc/90/95/08/1050909508.db2.gz XFXVXYXHXVTUFZ-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)nc2Cl)cc1 ZINC000234934025 1050909520 /nfs/dbraw/zinc/90/95/20/1050909520.db2.gz XFXVXYXHXVTUFZ-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO C[C@H]1COCCN1c1ccc([NH2+]C[C@H]2CCc3ccccc32)cc1 ZINC000790051594 1050910448 /nfs/dbraw/zinc/91/04/48/1050910448.db2.gz BBABJFKTFVUUAV-FUHWJXTLSA-N 1 2 322.452 4.054 20 0 DIADLO Oc1c(F)cc(Nc2cccc(Cn3cc[nH+]c3)c2)cc1Cl ZINC001214488353 1050919964 /nfs/dbraw/zinc/91/99/64/1050919964.db2.gz DJCZROWAGWDHHM-UHFFFAOYSA-N 1 2 317.751 4.173 20 0 DIADLO CC(C)(C)[C@H]1C[N@H+](Cc2cc3ccccc3nc2Cl)CCO1 ZINC000790425667 1050958232 /nfs/dbraw/zinc/95/82/32/1050958232.db2.gz CKPDTRVVMKQZMT-MRXNPFEDSA-N 1 2 318.848 4.135 20 0 DIADLO CC(C)(C)[C@H]1C[N@@H+](Cc2cc3ccccc3nc2Cl)CCO1 ZINC000790425667 1050958237 /nfs/dbraw/zinc/95/82/37/1050958237.db2.gz CKPDTRVVMKQZMT-MRXNPFEDSA-N 1 2 318.848 4.135 20 0 DIADLO COc1c(F)cc(Nc2[nH+]cccc2C)cc1C(F)(F)F ZINC001214633145 1050967205 /nfs/dbraw/zinc/96/72/05/1050967205.db2.gz GONIRGNLKURVMP-UHFFFAOYSA-N 1 2 300.255 4.300 20 0 DIADLO CC[N@H+](Cc1csc(-c2ccccc2)n1)Cc1ccncc1 ZINC000348128117 1050991502 /nfs/dbraw/zinc/99/15/02/1050991502.db2.gz OBTNKMBROUOOHN-UHFFFAOYSA-N 1 2 309.438 4.227 20 0 DIADLO CC[N@@H+](Cc1csc(-c2ccccc2)n1)Cc1ccncc1 ZINC000348128117 1050991514 /nfs/dbraw/zinc/99/15/14/1050991514.db2.gz OBTNKMBROUOOHN-UHFFFAOYSA-N 1 2 309.438 4.227 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc3ccccc3s2)o1 ZINC000348190052 1051003431 /nfs/dbraw/zinc/00/34/31/1051003431.db2.gz ZUVWRZUISODPCB-WDEREUQCSA-N 1 2 301.415 4.259 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+]Cc1ccsc1Cl)CCC2 ZINC000790991250 1051013909 /nfs/dbraw/zinc/01/39/09/1051013909.db2.gz RUQXNNMKNIRPRJ-ZDUSSCGKSA-N 1 2 309.866 4.346 20 0 DIADLO COc1c(F)cc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC001214971700 1051039900 /nfs/dbraw/zinc/03/99/00/1051039900.db2.gz FATXMLMVFJVKIQ-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1ccc(Cl)nc1 ZINC000773045958 1051040572 /nfs/dbraw/zinc/04/05/72/1051040572.db2.gz KILJIHISMYLZOY-ZETCQYMHSA-N 1 2 318.701 4.142 20 0 DIADLO COc1c(F)cc(Nc2ccc3c(c2)[nH+]cn3C)cc1Cl ZINC001214974325 1051041681 /nfs/dbraw/zinc/04/16/81/1051041681.db2.gz VCQLTWPKQNXBDC-UHFFFAOYSA-N 1 2 305.740 4.118 20 0 DIADLO CC(=O)c1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)c(F)c1F ZINC001214980094 1051042976 /nfs/dbraw/zinc/04/29/76/1051042976.db2.gz DKONFQLBLLIKNC-UHFFFAOYSA-N 1 2 321.714 4.212 20 0 DIADLO CCOc1cc(Nc2ccc(C(C)=O)c(F)c2F)cc(C)[nH+]1 ZINC001214980412 1051043508 /nfs/dbraw/zinc/04/35/08/1051043508.db2.gz MWJZPLOJJPHUGQ-UHFFFAOYSA-N 1 2 306.312 4.013 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1nnc(-c2cccc(F)c2)o1 ZINC000743841196 1051068558 /nfs/dbraw/zinc/06/85/58/1051068558.db2.gz OFWHUGCDPYCVNM-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1nnc(-c2cccc(F)c2)o1 ZINC000743841196 1051068563 /nfs/dbraw/zinc/06/85/63/1051068563.db2.gz OFWHUGCDPYCVNM-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO COCOc1cc(C)c(Nc2cccc(-n3cc[nH+]c3)c2)c(C)c1 ZINC001215163957 1051095930 /nfs/dbraw/zinc/09/59/30/1051095930.db2.gz SCNVIHPXWHRRBQ-UHFFFAOYSA-N 1 2 323.396 4.215 20 0 DIADLO CC(C)Oc1ccc(F)c(Nc2ccn3cc[nH+]c3c2)c1F ZINC001215174550 1051102722 /nfs/dbraw/zinc/10/27/22/1051102722.db2.gz KIBWWTCTJYAROA-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@@H+]1Cn1ccc(C(F)(F)F)n1 ZINC000744141193 1051120488 /nfs/dbraw/zinc/12/04/88/1051120488.db2.gz IRZMEVIRDZAICH-CQSZACIVSA-N 1 2 309.335 4.005 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@H+]1Cn1ccc(C(F)(F)F)n1 ZINC000744141193 1051120492 /nfs/dbraw/zinc/12/04/92/1051120492.db2.gz IRZMEVIRDZAICH-CQSZACIVSA-N 1 2 309.335 4.005 20 0 DIADLO OC1CCN(c2ccc([NH2+]CCC3CCCCC3)cc2)CC1 ZINC000792172099 1051123826 /nfs/dbraw/zinc/12/38/26/1051123826.db2.gz AALGHJQKVOXYSV-UHFFFAOYSA-N 1 2 302.462 4.030 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(-c2ccc(Cl)cc2)o1)c1cccnc1 ZINC000181343342 1051124286 /nfs/dbraw/zinc/12/42/86/1051124286.db2.gz QTEQHSVNNDQENI-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1cccc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)c1F ZINC001215252832 1051134294 /nfs/dbraw/zinc/13/42/94/1051134294.db2.gz PCOQGTUBJSMOGX-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Cc1ccc2cc(NC3CCN(c4cccnc4)CC3)[nH+]cc2c1 ZINC001171466154 1051138276 /nfs/dbraw/zinc/13/82/76/1051138276.db2.gz JFBFPCWLOIBIPZ-UHFFFAOYSA-N 1 2 318.424 4.019 20 0 DIADLO c1ccc(C2(CNc3cc(-c4ccncc4)cc[nH+]3)CC2)cc1 ZINC001171462237 1051141550 /nfs/dbraw/zinc/14/15/50/1051141550.db2.gz WQHIUEIMOKNIIW-UHFFFAOYSA-N 1 2 301.393 4.287 20 0 DIADLO Cc1cc(NCCOC2CCCCC2)[nH+]cc1C(F)(F)F ZINC001171474075 1051149206 /nfs/dbraw/zinc/14/92/06/1051149206.db2.gz WVGUZAROXXMWHO-UHFFFAOYSA-N 1 2 302.340 4.170 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2c(F)cccc2F)CC2CC2)cn1 ZINC001171501572 1051155691 /nfs/dbraw/zinc/15/56/91/1051155691.db2.gz JVDGELMAZGIQJD-UHFFFAOYSA-N 1 2 302.368 4.080 20 0 DIADLO Cc1ccc(C[N@H+](Cc2c(F)cccc2F)CC2CC2)cn1 ZINC001171501572 1051155694 /nfs/dbraw/zinc/15/56/94/1051155694.db2.gz JVDGELMAZGIQJD-UHFFFAOYSA-N 1 2 302.368 4.080 20 0 DIADLO C[C@H](Cc1ccccc1Cl)[NH2+]CC(F)(F)c1ccccn1 ZINC001170257342 1051166341 /nfs/dbraw/zinc/16/63/41/1051166341.db2.gz ZARPSLQZQLAQFJ-GFCCVEGCSA-N 1 2 310.775 4.048 20 0 DIADLO Cc1cc(F)ccc1C[NH2+][C@H](Cc1ccccc1)c1ncco1 ZINC001171567310 1051170591 /nfs/dbraw/zinc/17/05/91/1051170591.db2.gz IXWPUCWECUHMAW-GOSISDBHSA-N 1 2 310.372 4.196 20 0 DIADLO CCSc1nn(C[N@@H+]2CC[C@@H](CC(C)C)C2)c(=S)s1 ZINC000744437878 1051176951 /nfs/dbraw/zinc/17/69/51/1051176951.db2.gz ZLXDHGDVPZYBRW-NSHDSACASA-N 1 2 317.549 4.112 20 0 DIADLO CCSc1nn(C[N@H+]2CC[C@@H](CC(C)C)C2)c(=S)s1 ZINC000744437878 1051176957 /nfs/dbraw/zinc/17/69/57/1051176957.db2.gz ZLXDHGDVPZYBRW-NSHDSACASA-N 1 2 317.549 4.112 20 0 DIADLO COc1cccc2c(NC3CC(C)(C)OC(C)(C)C3)cc[nH+]c12 ZINC001170361027 1051189891 /nfs/dbraw/zinc/18/98/91/1051189891.db2.gz AVFYYUOEQLZYJZ-UHFFFAOYSA-N 1 2 314.429 4.392 20 0 DIADLO Fc1ccc([C@H]2COCC[N@@H+]2C[C@@H]2CCCCC2(F)F)cc1 ZINC001170342461 1051192874 /nfs/dbraw/zinc/19/28/74/1051192874.db2.gz NUVZFAOPWGYGPO-GOEBONIOSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1ccc([C@H]2COCC[N@H+]2C[C@@H]2CCCCC2(F)F)cc1 ZINC001170342461 1051192881 /nfs/dbraw/zinc/19/28/81/1051192881.db2.gz NUVZFAOPWGYGPO-GOEBONIOSA-N 1 2 313.363 4.025 20 0 DIADLO CCCc1nc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cs1 ZINC000792910596 1051226553 /nfs/dbraw/zinc/22/65/53/1051226553.db2.gz FCYIQZQHAIBUMX-WCQYABFASA-N 1 2 319.301 4.111 20 0 DIADLO Cc1nc(C2([NH2+]Cc3c(C)cc(Cl)cc3C)CCCC2)no1 ZINC000181787403 1051206612 /nfs/dbraw/zinc/20/66/12/1051206612.db2.gz VUJLRACFZUDNOZ-UHFFFAOYSA-N 1 2 319.836 4.207 20 0 DIADLO CCN(CC)c1ccc(N[C@@H](C)c2nc(C)sc2C)c[nH+]1 ZINC000037003139 1051216487 /nfs/dbraw/zinc/21/64/87/1051216487.db2.gz GDXYRMCSBNMWHT-NSHDSACASA-N 1 2 304.463 4.174 20 0 DIADLO Cc1ccccc1-n1nccc1CNc1ccc([NH+](C)C)c(C)c1 ZINC000792864139 1051217113 /nfs/dbraw/zinc/21/71/13/1051217113.db2.gz CVTODHFWXPCXSG-UHFFFAOYSA-N 1 2 320.440 4.167 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+][C@@H](C)c1nc(C)sc1C ZINC000037089647 1051220624 /nfs/dbraw/zinc/22/06/24/1051220624.db2.gz CNKPNBSETLEZNN-UWVGGRQHSA-N 1 2 308.422 4.319 20 0 DIADLO CC(C)[C@H]1CCC[C@H]([NH2+]c2ccc(N3CCC(O)CC3)cc2)C1 ZINC000792849932 1051221279 /nfs/dbraw/zinc/22/12/79/1051221279.db2.gz UNOWHDPZHDMJKB-WMZOPIPTSA-N 1 2 316.489 4.274 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)O[C@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000745097882 1051221561 /nfs/dbraw/zinc/22/15/61/1051221561.db2.gz MJWREENURNAHOF-RDTXWAMCSA-N 1 2 315.388 4.123 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)O[C@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000745097882 1051221575 /nfs/dbraw/zinc/22/15/75/1051221575.db2.gz MJWREENURNAHOF-RDTXWAMCSA-N 1 2 315.388 4.123 20 0 DIADLO CCCc1nc(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cs1 ZINC000792910596 1051226540 /nfs/dbraw/zinc/22/65/40/1051226540.db2.gz FCYIQZQHAIBUMX-WCQYABFASA-N 1 2 319.301 4.111 20 0 DIADLO CCCc1nc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cs1 ZINC000792910599 1051227196 /nfs/dbraw/zinc/22/71/96/1051227196.db2.gz FCYIQZQHAIBUMX-YPMHNXCESA-N 1 2 319.301 4.111 20 0 DIADLO CCCc1nc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cs1 ZINC000792910599 1051227211 /nfs/dbraw/zinc/22/72/11/1051227211.db2.gz FCYIQZQHAIBUMX-YPMHNXCESA-N 1 2 319.301 4.111 20 0 DIADLO Cc1cccc(NC(=O)C[N@H+]2CCc3ccc(C(C)C)cc3C2)c1 ZINC001171815238 1051227191 /nfs/dbraw/zinc/22/71/91/1051227191.db2.gz ILLWXBGHSFEKHV-UHFFFAOYSA-N 1 2 322.452 4.115 20 0 DIADLO Cc1cccc(NC(=O)C[N@@H+]2CCc3ccc(C(C)C)cc3C2)c1 ZINC001171815238 1051227204 /nfs/dbraw/zinc/22/72/04/1051227204.db2.gz ILLWXBGHSFEKHV-UHFFFAOYSA-N 1 2 322.452 4.115 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1ncc(-c3ccccc3F)o1)CC2 ZINC001171815871 1051227648 /nfs/dbraw/zinc/22/76/48/1051227648.db2.gz YLYVGWIGYQZUGO-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1ncc(-c3ccccc3F)o1)CC2 ZINC001171815871 1051227657 /nfs/dbraw/zinc/22/76/57/1051227657.db2.gz YLYVGWIGYQZUGO-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO COCc1cc(C)c(Nc2cccc(Cn3cc[nH+]c3)c2)c(C)c1 ZINC001215530321 1051234457 /nfs/dbraw/zinc/23/44/57/1051234457.db2.gz NEXSQTMSRSRYIT-UHFFFAOYSA-N 1 2 321.424 4.438 20 0 DIADLO CCCOc1ccc(F)c(Nc2cccc3[nH+]ccn32)c1F ZINC001215568673 1051249815 /nfs/dbraw/zinc/24/98/15/1051249815.db2.gz SVJYXXYZGKJBRX-UHFFFAOYSA-N 1 2 303.312 4.145 20 0 DIADLO COCc1ccc(Cl)c(Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001215596251 1051262883 /nfs/dbraw/zinc/26/28/83/1051262883.db2.gz HSIZQSAIZZUQTD-UHFFFAOYSA-N 1 2 313.788 4.416 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1ccc(F)c(CO)c1F ZINC001215651306 1051286186 /nfs/dbraw/zinc/28/61/86/1051286186.db2.gz YRMYLCWYVRDSEV-UHFFFAOYSA-N 1 2 306.356 4.103 20 0 DIADLO CC(C)Oc1c(F)cc(F)c(Nc2cccc3[nH+]ccn32)c1F ZINC001212642277 1051308843 /nfs/dbraw/zinc/30/88/43/1051308843.db2.gz PSCXNYGGOUUPFT-UHFFFAOYSA-N 1 2 321.302 4.282 20 0 DIADLO COc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc(C)c1F ZINC001215703053 1051311369 /nfs/dbraw/zinc/31/13/69/1051311369.db2.gz UHCYYUSILQGDNM-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO COc1cc(Nc2[nH+]cccc2N2CCCCC2)cc(C)c1F ZINC001215701914 1051311889 /nfs/dbraw/zinc/31/18/89/1051311889.db2.gz YFTFFGBUYHUUCO-UHFFFAOYSA-N 1 2 315.392 4.272 20 0 DIADLO COc1cc(F)c(Nc2c(C)cc[nH+]c2C(C)C)cc1OC ZINC001215720445 1051321047 /nfs/dbraw/zinc/32/10/47/1051321047.db2.gz ARWYNWJAEMYUEU-UHFFFAOYSA-N 1 2 304.365 4.413 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cc(OC)c(OC)cc2F)cc1 ZINC001215723697 1051322961 /nfs/dbraw/zinc/32/29/61/1051322961.db2.gz SAJQQGMSOABHSP-UHFFFAOYSA-N 1 2 304.365 4.043 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cc(OC)c(OC)cc2F)cc1 ZINC001215723697 1051322973 /nfs/dbraw/zinc/32/29/73/1051322973.db2.gz SAJQQGMSOABHSP-UHFFFAOYSA-N 1 2 304.365 4.043 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)CC(=O)Nc1ccc2ccccc2c1 ZINC000746124726 1051325722 /nfs/dbraw/zinc/32/57/22/1051325722.db2.gz SYNMXNADYBLAFP-CQSZACIVSA-N 1 2 308.381 4.064 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)CC(=O)Nc1ccc2ccccc2c1 ZINC000746124726 1051325729 /nfs/dbraw/zinc/32/57/29/1051325729.db2.gz SYNMXNADYBLAFP-CQSZACIVSA-N 1 2 308.381 4.064 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2sccc2Br)cs1 ZINC000041010679 1051349612 /nfs/dbraw/zinc/34/96/12/1051349612.db2.gz ZCJSKBMEYWDKIL-ZETCQYMHSA-N 1 2 317.277 4.126 20 0 DIADLO CCOc1ccc(Cl)c(Nc2ccc3c(c2)[nH+]cn3C)c1 ZINC001212576468 1051359015 /nfs/dbraw/zinc/35/90/15/1051359015.db2.gz LJSCXGKJEYEVDN-UHFFFAOYSA-N 1 2 301.777 4.369 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cc(Cl)cs1 ZINC000794212057 1051366184 /nfs/dbraw/zinc/36/61/84/1051366184.db2.gz DLUQXIRADBXSMQ-UHFFFAOYSA-N 1 2 317.801 4.352 20 0 DIADLO C[C@@H]1CC[N@H+](Cn2nc(C3CC3)sc2=S)[C@@H]2CCCC[C@H]12 ZINC000746375894 1051387098 /nfs/dbraw/zinc/38/70/98/1051387098.db2.gz YKGSRUJYJKJFFK-MRVWCRGKSA-N 1 2 323.531 4.410 20 0 DIADLO C[C@@H]1CC[N@@H+](Cn2nc(C3CC3)sc2=S)[C@@H]2CCCC[C@H]12 ZINC000746375894 1051387112 /nfs/dbraw/zinc/38/71/12/1051387112.db2.gz YKGSRUJYJKJFFK-MRVWCRGKSA-N 1 2 323.531 4.410 20 0 DIADLO CCCCCC[C@H](CCC)[NH2+][C@@H]1Oc2ccc(CCO)cc2O1 ZINC001172386846 1051390412 /nfs/dbraw/zinc/39/04/12/1051390412.db2.gz HHKCIDOEQQLBRF-QFBILLFUSA-N 1 2 321.461 4.005 20 0 DIADLO Cc1cn2cccc(Nc3ccccc3NC(=O)C(C)(C)C)c2[nH+]1 ZINC001215831825 1051395730 /nfs/dbraw/zinc/39/57/30/1051395730.db2.gz YUMCZCCAECFMCB-UHFFFAOYSA-N 1 2 322.412 4.371 20 0 DIADLO CC(C)(C)C(=O)Nc1ccccc1Nc1ccn2cc[nH+]c2c1 ZINC001215833446 1051397997 /nfs/dbraw/zinc/39/79/97/1051397997.db2.gz IGGGXMCQQUFEEE-UHFFFAOYSA-N 1 2 308.385 4.063 20 0 DIADLO CCO[C@@H]1C[C@H](Nc2cccc(-n3cc[nH+]c3)c2)C12CCCC2 ZINC000390962245 1051405822 /nfs/dbraw/zinc/40/58/22/1051405822.db2.gz ZUJJCSPEPJTFDH-ZWKOTPCHSA-N 1 2 311.429 4.022 20 0 DIADLO Clc1cc2n[nH]cc2c(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001215858272 1051417692 /nfs/dbraw/zinc/41/76/92/1051417692.db2.gz KUGSULZPPRGIRD-UHFFFAOYSA-N 1 2 318.167 4.261 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1ccc(C)c(F)c1 ZINC001168792331 1051423841 /nfs/dbraw/zinc/42/38/41/1051423841.db2.gz BGVYSQOPWQZMID-ABAIWWIYSA-N 1 2 303.381 4.196 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ncc(-c3cccs3)o2)c(C)o1 ZINC000183818684 1051430429 /nfs/dbraw/zinc/43/04/29/1051430429.db2.gz UINRPJMEOWVYLS-NSHDSACASA-N 1 2 302.399 4.464 20 0 DIADLO CC(C)(C)OC(=O)C(C)(C)[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC001172552580 1051434314 /nfs/dbraw/zinc/43/43/14/1051434314.db2.gz GPNZGIAMTPXBGX-HZPDHXFCSA-N 1 2 303.446 4.033 20 0 DIADLO CC(C)(C)CCCCC(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000804289958 1051434586 /nfs/dbraw/zinc/43/45/86/1051434586.db2.gz IAYIDPAPOAFJAL-HNNXBMFYSA-N 1 2 307.482 4.021 20 0 DIADLO COC(=O)c1cc2[nH+]c[nH]c2c(NC(C)(C)c2ccc(C)cc2)c1 ZINC001168807618 1051443568 /nfs/dbraw/zinc/44/35/68/1051443568.db2.gz MASWBNPVXGNMGP-UHFFFAOYSA-N 1 2 323.396 4.005 20 0 DIADLO CC(C)CCOc1ccc(C(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001129594903 1051454157 /nfs/dbraw/zinc/45/41/57/1051454157.db2.gz ZVCTUTGGEXVZSO-UHFFFAOYSA-N 1 2 323.396 4.012 20 0 DIADLO CSc1ncc(Cl)cc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001215917376 1051454531 /nfs/dbraw/zinc/45/45/31/1051454531.db2.gz BXWIHXBFUFGHFZ-UHFFFAOYSA-N 1 2 316.817 4.386 20 0 DIADLO CCN(C)c1ccc(Nc2cc(Cl)cnc2SC)c[nH+]1 ZINC001215917638 1051455202 /nfs/dbraw/zinc/45/52/02/1051455202.db2.gz KIMJONMFZWNDQC-UHFFFAOYSA-N 1 2 308.838 4.052 20 0 DIADLO COc1c(Cl)ccc(Nc2[nH+]c3ccccc3n2C)c1F ZINC001212582685 1051470124 /nfs/dbraw/zinc/47/01/24/1051470124.db2.gz UUYQGTUJKGCWMR-UHFFFAOYSA-N 1 2 305.740 4.118 20 0 DIADLO CC1(C)CC([N@@H+]2Cc3ccccc3C(F)(F)C2)CC(C)(C)O1 ZINC001172654766 1051472626 /nfs/dbraw/zinc/47/26/26/1051472626.db2.gz JBTJSVOYLGBVCQ-UHFFFAOYSA-N 1 2 309.400 4.330 20 0 DIADLO CC1(C)CC([N@H+]2Cc3ccccc3C(F)(F)C2)CC(C)(C)O1 ZINC001172654766 1051472634 /nfs/dbraw/zinc/47/26/34/1051472634.db2.gz JBTJSVOYLGBVCQ-UHFFFAOYSA-N 1 2 309.400 4.330 20 0 DIADLO Fc1ncc(C2CC2)cc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001215957392 1051482241 /nfs/dbraw/zinc/48/22/41/1051482241.db2.gz NOGAUWXTFDFVOW-UHFFFAOYSA-N 1 2 308.360 4.087 20 0 DIADLO c1c(CCNc2cncc(-c3ccccc3)c2)[nH+]c2ccccn12 ZINC001169004785 1051484898 /nfs/dbraw/zinc/48/48/98/1051484898.db2.gz RBUNSNPQVZAAHN-UHFFFAOYSA-N 1 2 314.392 4.051 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1cnc(F)c(-c2ccccc2)c1 ZINC001215961868 1051487328 /nfs/dbraw/zinc/48/73/28/1051487328.db2.gz VUOOERRTPMLDFX-UHFFFAOYSA-N 1 2 318.355 4.117 20 0 DIADLO Cc1cc(OC(C)C)ccc1NCCc1cn2ccccc2[nH+]1 ZINC001169008865 1051487388 /nfs/dbraw/zinc/48/73/88/1051487388.db2.gz JBLDDZZKNKRPDY-UHFFFAOYSA-N 1 2 309.413 4.085 20 0 DIADLO CSc1cc(F)c(Nc2ccc[nH+]c2N2CCCC2)cc1F ZINC001215965411 1051489038 /nfs/dbraw/zinc/48/90/38/1051489038.db2.gz RTAHDBDTSJFYNS-UHFFFAOYSA-N 1 2 321.396 4.426 20 0 DIADLO COc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(C)c1C ZINC001215973790 1051494845 /nfs/dbraw/zinc/49/48/45/1051494845.db2.gz BFOVBYUNCMBJMN-UHFFFAOYSA-N 1 2 307.397 4.300 20 0 DIADLO Cc1ccc(-c2ccccc2)cc1Nc1[nH+]cccc1CCO ZINC001215987795 1051505166 /nfs/dbraw/zinc/50/51/66/1051505166.db2.gz HRCMMFAQPJGROA-UHFFFAOYSA-N 1 2 304.393 4.335 20 0 DIADLO Cc1cc(C)c(CNC(=O)C[C@@H]2C[C@H](C)CC(C)(C)C2)c[nH+]1 ZINC001129842224 1051537179 /nfs/dbraw/zinc/53/71/79/1051537179.db2.gz VSCADMONJOZGOM-BBRMVZONSA-N 1 2 302.462 4.167 20 0 DIADLO Cc1cc(C)c(CNC(=O)C[C@@H]2C[C@@H](C)CC(C)(C)C2)c[nH+]1 ZINC001129842225 1051537414 /nfs/dbraw/zinc/53/74/14/1051537414.db2.gz VSCADMONJOZGOM-CJNGLKHVSA-N 1 2 302.462 4.167 20 0 DIADLO Cc1cc(CNC(=O)[C@@H](CCc2ccccc2)C(C)C)cc(C)[nH+]1 ZINC001129858994 1051541690 /nfs/dbraw/zinc/54/16/90/1051541690.db2.gz WDSNKJOGZIPXNT-FQEVSTJZSA-N 1 2 324.468 4.220 20 0 DIADLO Cc1cc(CNC(=O)c2ccc(-c3ccccc3)cc2)cc(C)[nH+]1 ZINC001129857721 1051541761 /nfs/dbraw/zinc/54/17/61/1051541761.db2.gz CLKHKOJWILWEPY-UHFFFAOYSA-N 1 2 316.404 4.295 20 0 DIADLO C/C(=C/C(=O)NCc1cc(C)[nH+]c(C)c1)c1cccc(Cl)c1 ZINC001129858333 1051542898 /nfs/dbraw/zinc/54/28/98/1051542898.db2.gz KFFRIHKUPOGREO-GHXNOFRVSA-N 1 2 314.816 4.072 20 0 DIADLO Nc1ccc(Nc2ccccc2-n2cc[nH+]c2)cc1C(F)(F)F ZINC001216051278 1051548592 /nfs/dbraw/zinc/54/85/92/1051548592.db2.gz BXMJQEKZUHBBLC-UHFFFAOYSA-N 1 2 318.302 4.217 20 0 DIADLO Cc1cn2cccc(Nc3ccc(N(C)C)c(Cl)c3)c2[nH+]1 ZINC001216060136 1051556564 /nfs/dbraw/zinc/55/65/64/1051556564.db2.gz VGWJHWUMXSEEMS-UHFFFAOYSA-N 1 2 300.793 4.106 20 0 DIADLO Fc1cccc(F)c1C[N@H+](CCOC1CCCCC1)C1CC1 ZINC001169225018 1051557551 /nfs/dbraw/zinc/55/75/51/1051557551.db2.gz KYNASRHMIXZENJ-UHFFFAOYSA-N 1 2 309.400 4.279 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](CCOC1CCCCC1)C1CC1 ZINC001169225018 1051557562 /nfs/dbraw/zinc/55/75/62/1051557562.db2.gz KYNASRHMIXZENJ-UHFFFAOYSA-N 1 2 309.400 4.279 20 0 DIADLO C[C@@H](CSc1ccc(Cl)cc1)[N@@H+]1CCC(F)(F)[C@H](F)C1 ZINC001172874422 1051559376 /nfs/dbraw/zinc/55/93/76/1051559376.db2.gz AYQCYKLBMKDGFM-GXFFZTMASA-N 1 2 323.811 4.500 20 0 DIADLO C[C@@H](CSc1ccc(Cl)cc1)[N@H+]1CCC(F)(F)[C@H](F)C1 ZINC001172874422 1051559393 /nfs/dbraw/zinc/55/93/93/1051559393.db2.gz AYQCYKLBMKDGFM-GXFFZTMASA-N 1 2 323.811 4.500 20 0 DIADLO COc1cccc2c(N[C@H](C3CCC3)C(F)(F)F)cc[nH+]c12 ZINC001169284499 1051569775 /nfs/dbraw/zinc/56/97/75/1051569775.db2.gz KBWHFLVIWOHCCR-OAHLLOKOSA-N 1 2 310.319 4.386 20 0 DIADLO FC(F)(F)[C@H](Nc1cccc(Cc2ccncc2)[nH+]1)C1CCC1 ZINC001169286210 1051572884 /nfs/dbraw/zinc/57/28/84/1051572884.db2.gz KRQNYJUJXDCJPH-MRXNPFEDSA-N 1 2 321.346 4.210 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH+]2CCC(C(C)(C)C)CC2)n1 ZINC000178460920 1051574680 /nfs/dbraw/zinc/57/46/80/1051574680.db2.gz VVWMZQKITXFWTI-LBPRGKRZSA-N 1 2 311.495 4.142 20 0 DIADLO Cc1cc(Cl)c(N)c(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001216093342 1051576589 /nfs/dbraw/zinc/57/65/89/1051576589.db2.gz YJCXGOZSPJQECL-UHFFFAOYSA-N 1 2 307.184 4.275 20 0 DIADLO c1cn(Cc2ccc(Nc3cc(C4CCCC4)no3)cc2)c[nH+]1 ZINC001212692376 1051580745 /nfs/dbraw/zinc/58/07/45/1051580745.db2.gz PVFVXGYLDWBTQO-UHFFFAOYSA-N 1 2 308.385 4.321 20 0 DIADLO Fc1cccc2ncc(Nc3ccc(Cn4cc[nH+]c4)cc3)cc12 ZINC001212695198 1051583192 /nfs/dbraw/zinc/58/31/92/1051583192.db2.gz SPMDHTZXVIVHNF-UHFFFAOYSA-N 1 2 318.355 4.362 20 0 DIADLO Fc1ccc2cc(Nc3ccc(Cn4cc[nH+]c4)cc3)cnc2c1 ZINC001212694874 1051583567 /nfs/dbraw/zinc/58/35/67/1051583567.db2.gz BQUXLZBLUWWFJL-UHFFFAOYSA-N 1 2 318.355 4.362 20 0 DIADLO c1coc(-c2ccc(Nc3ccc(Cn4cc[nH+]c4)cc3)cc2)n1 ZINC001212698966 1051588983 /nfs/dbraw/zinc/58/89/83/1051588983.db2.gz GNKAHEQFNBGDFH-UHFFFAOYSA-N 1 2 316.364 4.330 20 0 DIADLO COc1cc(C)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c(C)c1 ZINC001212697628 1051589052 /nfs/dbraw/zinc/58/90/52/1051589052.db2.gz KJFXRQKLSCBWOU-UHFFFAOYSA-N 1 2 307.397 4.300 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CCCSC(C)(C)C)cc2[nH+]1 ZINC000753908082 1051590413 /nfs/dbraw/zinc/59/04/13/1051590413.db2.gz VLJYUAJLZVHSST-UHFFFAOYSA-N 1 2 305.447 4.122 20 0 DIADLO COc1c(C)[nH+]c(C2CC2)nc1N[C@@H]1C[C@@H](C)c2ccccc21 ZINC001169374302 1051595160 /nfs/dbraw/zinc/59/51/60/1051595160.db2.gz JGBXPMKLOFMJPZ-BDJLRTHQSA-N 1 2 309.413 4.331 20 0 DIADLO Cc1cn2c(cccc2Nc2cccc(-c3ccncc3)c2)[nH+]1 ZINC001216143316 1051599806 /nfs/dbraw/zinc/59/98/06/1051599806.db2.gz AOTXAFMUCNJZSC-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO OCC[C@@H](Nc1ccn2cc[nH+]c2c1)c1cccc2ccccc21 ZINC001169424282 1051611027 /nfs/dbraw/zinc/61/10/27/1051611027.db2.gz HGHQKHMTGNXUJM-LJQANCHMSA-N 1 2 317.392 4.023 20 0 DIADLO CN(C)c1ccc(Nc2cc(F)cc(N3CCCCC3)c2)c[nH+]1 ZINC001216177980 1051613342 /nfs/dbraw/zinc/61/33/42/1051613342.db2.gz QBPUBVBERXXQCF-UHFFFAOYSA-N 1 2 314.408 4.021 20 0 DIADLO CC(C)c1nnc2n1CC[N@H+](C1CCC3(CCCCC3)CC1)C2 ZINC001173119388 1051615064 /nfs/dbraw/zinc/61/50/64/1051615064.db2.gz OZVXRRHHRDWGJN-UHFFFAOYSA-N 1 2 316.493 4.110 20 0 DIADLO CC(C)c1nnc2n1CC[N@@H+](C1CCC3(CCCCC3)CC1)C2 ZINC001173119388 1051615071 /nfs/dbraw/zinc/61/50/71/1051615071.db2.gz OZVXRRHHRDWGJN-UHFFFAOYSA-N 1 2 316.493 4.110 20 0 DIADLO Cc1c(F)cncc1Nc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001216189838 1051623469 /nfs/dbraw/zinc/62/34/69/1051623469.db2.gz AVTXYXZDPJJGFN-UHFFFAOYSA-N 1 2 318.352 4.015 20 0 DIADLO Cc1cc(-c2ccccc2)ccc1Nc1[nH+]cccc1CCO ZINC001216196904 1051626349 /nfs/dbraw/zinc/62/63/49/1051626349.db2.gz LFWPCQNLQLVBIV-UHFFFAOYSA-N 1 2 304.393 4.335 20 0 DIADLO FC(F)COc1ccc(Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC001213305190 1051632700 /nfs/dbraw/zinc/63/27/00/1051632700.db2.gz QACJUZJENUCREN-UHFFFAOYSA-N 1 2 315.323 4.260 20 0 DIADLO COc1cc(Nc2cccc3[nH+]c(C)cn32)ccc1OC(C)C ZINC001216245259 1051651928 /nfs/dbraw/zinc/65/19/28/1051651928.db2.gz YLUHEIGTMRBJBE-UHFFFAOYSA-N 1 2 311.385 4.182 20 0 DIADLO COc1cc(Nc2cccc(-n3cc[nH+]c3)c2)ccc1OC(C)C ZINC001216249953 1051657302 /nfs/dbraw/zinc/65/73/02/1051657302.db2.gz ZSUCGPXUPRLVDW-UHFFFAOYSA-N 1 2 323.396 4.412 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(NC(C)(C)C(=O)OC(C)(C)C)c1 ZINC001169584437 1051658290 /nfs/dbraw/zinc/65/82/90/1051658290.db2.gz OOQMQURWEFRUIO-UHFFFAOYSA-N 1 2 320.477 4.373 20 0 DIADLO CCCC[C@@H](CC(C)C)[N@@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001173262090 1051663008 /nfs/dbraw/zinc/66/30/08/1051663008.db2.gz RZDCCTMRPDIEKS-HOTGVXAUSA-N 1 2 307.482 4.011 20 0 DIADLO CCCC[C@@H](CC(C)C)[N@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001173262090 1051663015 /nfs/dbraw/zinc/66/30/15/1051663015.db2.gz RZDCCTMRPDIEKS-HOTGVXAUSA-N 1 2 307.482 4.011 20 0 DIADLO CCCC[C@@H](CC(C)C)[N@@H+]1CCOC[C@@H]1c1csc(C)n1 ZINC001173261565 1051663936 /nfs/dbraw/zinc/66/39/36/1051663936.db2.gz OYTKUTQWWGRXPS-DOTOQJQBSA-N 1 2 310.507 4.430 20 0 DIADLO CCCC[C@@H](CC(C)C)[N@H+]1CCOC[C@@H]1c1csc(C)n1 ZINC001173261565 1051663945 /nfs/dbraw/zinc/66/39/45/1051663945.db2.gz OYTKUTQWWGRXPS-DOTOQJQBSA-N 1 2 310.507 4.430 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cnc(Br)s2)cc1 ZINC001216268362 1051667012 /nfs/dbraw/zinc/66/70/12/1051667012.db2.gz FXQUKTJHCHTOKV-UHFFFAOYSA-N 1 2 312.236 4.105 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cnc(Br)s2)cc1 ZINC001216268362 1051667021 /nfs/dbraw/zinc/66/70/21/1051667021.db2.gz FXQUKTJHCHTOKV-UHFFFAOYSA-N 1 2 312.236 4.105 20 0 DIADLO CCCc1csc(C[NH2+][C@](C)(CC)c2nc(C)cs2)n1 ZINC000494098084 1051688555 /nfs/dbraw/zinc/68/85/55/1051688555.db2.gz KYGATODMNCEBBQ-OAHLLOKOSA-N 1 2 309.504 4.276 20 0 DIADLO CO[C@@H](C)CNc1ccc2[nH+]c(-c3ccc(Cl)cc3)cn2c1 ZINC001169776836 1051690721 /nfs/dbraw/zinc/69/07/21/1051690721.db2.gz OIWXWUACPHEGBM-LBPRGKRZSA-N 1 2 315.804 4.102 20 0 DIADLO Cc1cc2cc(N[C@@H]3CCO[C@@H](c4ccccc4)C3)[nH+]cc2[nH]1 ZINC001169758981 1051694094 /nfs/dbraw/zinc/69/40/94/1051694094.db2.gz UFOAGTBIQFTPFA-SJLPKXTDSA-N 1 2 307.397 4.204 20 0 DIADLO CC1(C)C[C@H](CNc2ccc3[nH]c(-c4ccccc4)[nH+]c3c2)O1 ZINC001168461300 1051718712 /nfs/dbraw/zinc/71/87/12/1051718712.db2.gz SRIBKUBLLPTIMF-OAHLLOKOSA-N 1 2 307.397 4.209 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1ccc(C(=O)N(C)C)cc1C ZINC001212729745 1051720395 /nfs/dbraw/zinc/72/03/95/1051720395.db2.gz NTDXJUFSLCLFDO-UHFFFAOYSA-N 1 2 311.429 4.267 20 0 DIADLO Fc1ccccc1[C@H]1C[N@H+](Cc2ccc(C(F)F)cc2)CCO1 ZINC000183934980 1051722407 /nfs/dbraw/zinc/72/24/07/1051722407.db2.gz VADLVRGBBOHAKJ-QGZVFWFLSA-N 1 2 321.342 4.337 20 0 DIADLO Fc1ccccc1[C@H]1C[N@@H+](Cc2ccc(C(F)F)cc2)CCO1 ZINC000183934980 1051722421 /nfs/dbraw/zinc/72/24/21/1051722421.db2.gz VADLVRGBBOHAKJ-QGZVFWFLSA-N 1 2 321.342 4.337 20 0 DIADLO Cc1ccc2c(Nc3ccc(C(=O)N(C)C)cc3C)cccc2[nH+]1 ZINC001212732384 1051732185 /nfs/dbraw/zinc/73/21/85/1051732185.db2.gz PFADWIOCYOQRQK-UHFFFAOYSA-N 1 2 319.408 4.297 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2nc(Cl)ccc2Cl)cn1 ZINC000766890961 1051738236 /nfs/dbraw/zinc/73/82/36/1051738236.db2.gz ZNEWLGYMMCXJLS-SNVBAGLBSA-N 1 2 313.232 4.017 20 0 DIADLO Cc1cc(F)cc(-c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)c1 ZINC000761594895 1051752992 /nfs/dbraw/zinc/75/29/92/1051752992.db2.gz QDXCKZQUSIBGDW-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CC[C@@H]3C(C)(C)C)cc2)CCO1 ZINC000806156821 1051759322 /nfs/dbraw/zinc/75/93/22/1051759322.db2.gz KNRCEAPPVLAXEZ-JLSDUUJJSA-N 1 2 302.462 4.148 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCC1(F)F)c1cc(Cl)c(N)c(Cl)c1 ZINC000806179350 1051772778 /nfs/dbraw/zinc/77/27/78/1051772778.db2.gz BOWZVEQQVRBDCY-HQJQHLMTSA-N 1 2 309.187 4.414 20 0 DIADLO C[C@H]1C[C@H](C(C)(C)C)CCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000806289165 1051786569 /nfs/dbraw/zinc/78/65/69/1051786569.db2.gz GLOXNWPSYIGQDI-UONOGXRCSA-N 1 2 314.433 4.013 20 0 DIADLO COc1c(F)cc(SC)cc1Nc1[nH+]c2ccccc2n1C ZINC001216581102 1051821844 /nfs/dbraw/zinc/82/18/44/1051821844.db2.gz XRZGXZFGSYAWHT-UHFFFAOYSA-N 1 2 317.389 4.187 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2ccccc2F)cc[nH+]1 ZINC001173847622 1051821855 /nfs/dbraw/zinc/82/18/55/1051821855.db2.gz FNUKAZLHZIAFEE-UHFFFAOYSA-N 1 2 303.337 4.311 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cccnc2C(F)(F)F)cc1F ZINC001242376215 1051822458 /nfs/dbraw/zinc/82/24/58/1051822458.db2.gz DMGRQPNROIMBPH-UHFFFAOYSA-N 1 2 316.273 4.107 20 0 DIADLO CC(C)Oc1ccc(CSCCn2cc[nH+]c2)cc1Cl ZINC000186560919 1051823494 /nfs/dbraw/zinc/82/34/94/1051823494.db2.gz OJRIPPMCLNPFRN-UHFFFAOYSA-N 1 2 310.850 4.257 20 0 DIADLO CC(C)([NH2+]Cc1cn2ccsc2n1)c1cccc(Cl)c1F ZINC000186888567 1051830140 /nfs/dbraw/zinc/83/01/40/1051830140.db2.gz LOXMECKLVMIZTO-UHFFFAOYSA-N 1 2 323.824 4.213 20 0 DIADLO C[C@H]1C[N@H+](Cc2nnc(-c3cccc(F)c3)o2)[C@@H]1c1ccccc1 ZINC000746490164 1051851101 /nfs/dbraw/zinc/85/11/01/1051851101.db2.gz QZRVYALFKVPBEM-UGSOOPFHSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nnc(-c3cccc(F)c3)o2)[C@@H]1c1ccccc1 ZINC000746490164 1051851104 /nfs/dbraw/zinc/85/11/04/1051851104.db2.gz QZRVYALFKVPBEM-UGSOOPFHSA-N 1 2 323.371 4.069 20 0 DIADLO Cc1cc(C)cc(-c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)c1 ZINC001216658345 1051853480 /nfs/dbraw/zinc/85/34/80/1051853480.db2.gz ZCYJVLXBXZWSAF-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO C/C(=C\c1ccccc1)C[N@@H+](C)[C@H](C)c1nc(C(C)(C)C)no1 ZINC000494232950 1051857430 /nfs/dbraw/zinc/85/74/30/1051857430.db2.gz FALHBXNPOFRAMZ-OKFGHLOFSA-N 1 2 313.445 4.463 20 0 DIADLO C/C(=C\c1ccccc1)C[N@H+](C)[C@H](C)c1nc(C(C)(C)C)no1 ZINC000494232950 1051857439 /nfs/dbraw/zinc/85/74/39/1051857439.db2.gz FALHBXNPOFRAMZ-OKFGHLOFSA-N 1 2 313.445 4.463 20 0 DIADLO Clc1ccc([C@@H]2CCC[N@@H+]2Cc2cn3ccccc3n2)cc1 ZINC000613374028 1051857742 /nfs/dbraw/zinc/85/77/42/1051857742.db2.gz LVZAITZOJKSOCW-KRWDZBQOSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1ccc([C@@H]2CCC[N@H+]2Cc2cn3ccccc3n2)cc1 ZINC000613374028 1051857751 /nfs/dbraw/zinc/85/77/51/1051857751.db2.gz LVZAITZOJKSOCW-KRWDZBQOSA-N 1 2 311.816 4.325 20 0 DIADLO COc1ccc(CSCc2cc[nH+]c(N(C)C)c2)cc1Cl ZINC000767875495 1051860473 /nfs/dbraw/zinc/86/04/73/1051860473.db2.gz PIJKWYCBOKLSIT-UHFFFAOYSA-N 1 2 322.861 4.243 20 0 DIADLO C[C@H](SCc1cc[nH+]c(N(C)C)c1)c1ccc(F)cc1F ZINC000767871605 1051860663 /nfs/dbraw/zinc/86/06/63/1051860663.db2.gz OUXRLSZRHJGZDW-NSHDSACASA-N 1 2 308.397 4.420 20 0 DIADLO Cc1ccccc1O[C@@H]1CC[N@H+](Cc2ccc(F)c(F)c2F)C1 ZINC001137939379 1051866554 /nfs/dbraw/zinc/86/65/54/1051866554.db2.gz UIWMNJRRDCHZHN-CQSZACIVSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1ccccc1O[C@@H]1CC[N@@H+](Cc2ccc(F)c(F)c2F)C1 ZINC001137939379 1051866567 /nfs/dbraw/zinc/86/65/67/1051866567.db2.gz UIWMNJRRDCHZHN-CQSZACIVSA-N 1 2 321.342 4.066 20 0 DIADLO CCCc1csc(C[NH2+][C@@H](C)c2ccccc2OCC)n1 ZINC000494338725 1051874366 /nfs/dbraw/zinc/87/43/66/1051874366.db2.gz LCEQTAAKAICJPP-ZDUSSCGKSA-N 1 2 304.459 4.345 20 0 DIADLO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2coc(C3CC3)n2)cc1 ZINC000768200758 1051895425 /nfs/dbraw/zinc/89/54/25/1051895425.db2.gz PWOMARMNHSMVHS-SFHVURJKSA-N 1 2 312.413 4.288 20 0 DIADLO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2coc(C3CC3)n2)cc1 ZINC000768200758 1051895441 /nfs/dbraw/zinc/89/54/41/1051895441.db2.gz PWOMARMNHSMVHS-SFHVURJKSA-N 1 2 312.413 4.288 20 0 DIADLO Cn1c(Cl)nc(Cl)c1C[N@H+](C)[C@H]1CCCc2ccccc21 ZINC000768193352 1051900626 /nfs/dbraw/zinc/90/06/26/1051900626.db2.gz LSYVBVDDAUMYKB-ZDUSSCGKSA-N 1 2 324.255 4.236 20 0 DIADLO Cn1c(Cl)nc(Cl)c1C[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC000768193352 1051900640 /nfs/dbraw/zinc/90/06/40/1051900640.db2.gz LSYVBVDDAUMYKB-ZDUSSCGKSA-N 1 2 324.255 4.236 20 0 DIADLO Cn1c(Cl)nc(Cl)c1C[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC000768193351 1051901790 /nfs/dbraw/zinc/90/17/90/1051901790.db2.gz LSYVBVDDAUMYKB-CYBMUJFWSA-N 1 2 324.255 4.236 20 0 DIADLO Cn1c(Cl)nc(Cl)c1C[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC000768193351 1051901803 /nfs/dbraw/zinc/90/18/03/1051901803.db2.gz LSYVBVDDAUMYKB-CYBMUJFWSA-N 1 2 324.255 4.236 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2occc2Br)cc1 ZINC000768236768 1051907323 /nfs/dbraw/zinc/90/73/23/1051907323.db2.gz KZVULMHMPJMTIZ-NSHDSACASA-N 1 2 324.218 4.244 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2occc2Br)cc1 ZINC000768236768 1051907332 /nfs/dbraw/zinc/90/73/32/1051907332.db2.gz KZVULMHMPJMTIZ-NSHDSACASA-N 1 2 324.218 4.244 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2cccc(F)c2F)cc[nH+]1 ZINC001173947776 1051912816 /nfs/dbraw/zinc/91/28/16/1051912816.db2.gz UCNZHZQAKGHEEB-UHFFFAOYSA-N 1 2 321.327 4.450 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2cc(F)ccc2F)cc[nH+]1 ZINC001173948805 1051913899 /nfs/dbraw/zinc/91/38/99/1051913899.db2.gz RZAUKCUXEWFYPH-UHFFFAOYSA-N 1 2 321.327 4.450 20 0 DIADLO Cc1cccc(-c2noc(-c3cccc(-c4c[nH+]cn4C)c3)n2)c1 ZINC001217019680 1051931265 /nfs/dbraw/zinc/93/12/65/1051931265.db2.gz SVMXVQHGGPZZTR-UHFFFAOYSA-N 1 2 316.364 4.113 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2cn(C(C)(C)C)nn2)o1 ZINC000191384737 1051972106 /nfs/dbraw/zinc/97/21/06/1051972106.db2.gz WWNFYDLCAVOJCC-INIZCTEOSA-N 1 2 316.449 4.052 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2cn(C(C)(C)C)nn2)o1 ZINC000191384737 1051972126 /nfs/dbraw/zinc/97/21/26/1051972126.db2.gz WWNFYDLCAVOJCC-INIZCTEOSA-N 1 2 316.449 4.052 20 0 DIADLO CCOCC[N@H+](CC)Cn1c(-c2ccccc2)csc1=S ZINC000747455584 1051977553 /nfs/dbraw/zinc/97/75/53/1051977553.db2.gz CXTMUOVXNCEZAT-UHFFFAOYSA-N 1 2 322.499 4.262 20 0 DIADLO CCOCC[N@@H+](CC)Cn1c(-c2ccccc2)csc1=S ZINC000747455584 1051977564 /nfs/dbraw/zinc/97/75/64/1051977564.db2.gz CXTMUOVXNCEZAT-UHFFFAOYSA-N 1 2 322.499 4.262 20 0 DIADLO CC[C@@]1(C)CC(=O)N(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)C1 ZINC000808142663 1051979716 /nfs/dbraw/zinc/97/97/16/1051979716.db2.gz XQYDWZWKUWLYSO-AEFFLSMTSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@@]1(C)CC(=O)N(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)C1 ZINC000808142663 1051979722 /nfs/dbraw/zinc/97/97/22/1051979722.db2.gz XQYDWZWKUWLYSO-AEFFLSMTSA-N 1 2 320.864 4.083 20 0 DIADLO CC(C)Oc1cccc(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001174114877 1051988818 /nfs/dbraw/zinc/98/88/18/1051988818.db2.gz ORCLSJBCTYOKMK-UHFFFAOYSA-N 1 2 307.397 4.462 20 0 DIADLO Cc1cc(C)c(NC(=O)C2(Cc3ccccc3F)CC2)c(C)[nH+]1 ZINC000191821669 1051989697 /nfs/dbraw/zinc/98/96/97/1051989697.db2.gz UAORJNVQRAPREG-UHFFFAOYSA-N 1 2 312.388 4.107 20 0 DIADLO Cc1ccncc1Nc1cc[nH+]c2cc(Br)ccc12 ZINC001174117342 1051990128 /nfs/dbraw/zinc/99/01/28/1051990128.db2.gz XHEJCJZXMOGXFL-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO Cc1cc[nH+]c(Nc2ccc(C(=O)NCc3ccccc3)cc2)c1 ZINC001174073116 1051993380 /nfs/dbraw/zinc/99/33/80/1051993380.db2.gz AOPSWVQXSOORCB-UHFFFAOYSA-N 1 2 317.392 4.064 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2cc3cccc(OC)c3o2)cs1 ZINC000769120410 1051998506 /nfs/dbraw/zinc/99/85/06/1051998506.db2.gz MHDDMLGRNXZIHB-UHFFFAOYSA-N 1 2 316.426 4.092 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2cc3cccc(OC)c3o2)cs1 ZINC000769120410 1051998521 /nfs/dbraw/zinc/99/85/21/1051998521.db2.gz MHDDMLGRNXZIHB-UHFFFAOYSA-N 1 2 316.426 4.092 20 0 DIADLO CC[C@@H](CCc1ccccc1)NC(=O)c1c(C)cc(C)[nH+]c1C ZINC001131236342 1052002209 /nfs/dbraw/zinc/00/22/09/1052002209.db2.gz ZZFDJDKPTNCFBI-SFHVURJKSA-N 1 2 310.441 4.148 20 0 DIADLO CCc1ccccc1NC(=O)COc1cc(C)[nH+]c2ccccc21 ZINC000192193307 1052004613 /nfs/dbraw/zinc/00/46/13/1052004613.db2.gz PUOZXGKPRVOIAQ-UHFFFAOYSA-N 1 2 320.392 4.123 20 0 DIADLO Cn1cnc(C[NH2+][C@H](c2cccs2)c2ccc(Cl)cc2)c1 ZINC000808379607 1052009507 /nfs/dbraw/zinc/00/95/07/1052009507.db2.gz SCVNNGVLYLEBQK-INIZCTEOSA-N 1 2 317.845 4.014 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2ncc(Cl)s2)c1 ZINC000225314368 1052011460 /nfs/dbraw/zinc/01/14/60/1052011460.db2.gz XXYSYVOFZNFTHS-LLVKDONJSA-N 1 2 310.850 4.435 20 0 DIADLO c1cc2cnccc2c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174135569 1052011682 /nfs/dbraw/zinc/01/16/82/1052011682.db2.gz JBDZEVUPAZMHRC-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1ncc(Cl)s1)CCS2 ZINC000225304789 1052011959 /nfs/dbraw/zinc/01/19/59/1052011959.db2.gz IOSBILVIIZWUHL-SNVBAGLBSA-N 1 2 314.838 4.262 20 0 DIADLO Cn1cnc(C[NH2+][C@H](c2ccsc2)c2ccc(Cl)cc2)c1 ZINC000808383006 1052012035 /nfs/dbraw/zinc/01/20/35/1052012035.db2.gz RGCAVIQSYFWZFW-INIZCTEOSA-N 1 2 317.845 4.014 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NCc1sccc1Cl ZINC000192757016 1052019593 /nfs/dbraw/zinc/01/95/93/1052019593.db2.gz JLRVPMSTNADPGR-UHFFFAOYSA-N 1 2 321.833 4.010 20 0 DIADLO Cc1ccc2c(Nc3ccc(C(=O)NC(C)C)cc3)cccc2[nH+]1 ZINC001174149673 1052019823 /nfs/dbraw/zinc/01/98/23/1052019823.db2.gz LBKLHOVFAYTIFP-UHFFFAOYSA-N 1 2 319.408 4.425 20 0 DIADLO CC(C)CC[C@@H]1CCC[C@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001217318131 1052022546 /nfs/dbraw/zinc/02/25/46/1052022546.db2.gz HUBXSQLARUKURH-GOEBONIOSA-N 1 2 314.433 4.061 20 0 DIADLO Cc1ccc2c(ccc(C)c2C(=O)Nc2ccc3[nH+]ccn3c2)c1 ZINC001131309219 1052027158 /nfs/dbraw/zinc/02/71/58/1052027158.db2.gz HIVJZVKRXZQXSW-UHFFFAOYSA-N 1 2 315.376 4.357 20 0 DIADLO C/C(=C/C(=O)Nc1ccc2[nH+]ccn2c1)c1cccc(Cl)c1 ZINC001131309754 1052027345 /nfs/dbraw/zinc/02/73/45/1052027345.db2.gz WMQCZDMFESQGAH-XFXZXTDPSA-N 1 2 311.772 4.030 20 0 DIADLO CCCc1cc[nH+]c(Nc2cccc(C(=O)N3CCCC3)c2)c1 ZINC001174170249 1052031914 /nfs/dbraw/zinc/03/19/14/1052031914.db2.gz MIRXRYPWGLDLGI-UHFFFAOYSA-N 1 2 309.413 4.014 20 0 DIADLO Clc1csc(C[NH2+]Cc2ncc(-c3ccccc3)cn2)c1 ZINC000193210857 1052034681 /nfs/dbraw/zinc/03/46/81/1052034681.db2.gz NBVGPHZJAJEUIB-UHFFFAOYSA-N 1 2 315.829 4.148 20 0 DIADLO Cc1ncc2c(n1)CCC[C@@H]2[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000769412824 1052042885 /nfs/dbraw/zinc/04/28/85/1052042885.db2.gz HFNQTGWLFYBIPG-RISCZKNCSA-N 1 2 316.474 4.093 20 0 DIADLO COc1ccccc1C[N@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000195348907 1052048147 /nfs/dbraw/zinc/04/81/47/1052048147.db2.gz PAFSTRJNBOMDII-CYBMUJFWSA-N 1 2 312.438 4.498 20 0 DIADLO COc1ccccc1C[N@@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000195348907 1052048161 /nfs/dbraw/zinc/04/81/61/1052048161.db2.gz PAFSTRJNBOMDII-CYBMUJFWSA-N 1 2 312.438 4.498 20 0 DIADLO Cc1ccc[nH+]c1Nc1cccc(C(=O)Nc2ccccc2)c1 ZINC001174205704 1052049576 /nfs/dbraw/zinc/04/95/76/1052049576.db2.gz WQLONKGHAKUUTI-UHFFFAOYSA-N 1 2 303.365 4.386 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)n1 ZINC000193546532 1052052635 /nfs/dbraw/zinc/05/26/35/1052052635.db2.gz ZHVFODGVSRSTIR-HNNXBMFYSA-N 1 2 305.397 4.209 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458694 1052060528 /nfs/dbraw/zinc/06/05/28/1052060528.db2.gz YNHISGJGRKFUPH-PXAZEXFGSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458694 1052060538 /nfs/dbraw/zinc/06/05/38/1052060538.db2.gz YNHISGJGRKFUPH-PXAZEXFGSA-N 1 2 300.377 4.274 20 0 DIADLO O=C(c1ccccc1)c1ccc(Nc2ccn3cc[nH+]c3c2)cc1 ZINC001174223258 1052061643 /nfs/dbraw/zinc/06/16/43/1052061643.db2.gz KMFZRPDRVUHLQY-UHFFFAOYSA-N 1 2 313.360 4.309 20 0 DIADLO CC(C)CCCCCC[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000808673128 1052064496 /nfs/dbraw/zinc/06/44/96/1052064496.db2.gz YGULGVUCACCCFG-QGZVFWFLSA-N 1 2 300.450 4.090 20 0 DIADLO Fc1ccc([C@H]2CCCC[N@@H+]2Cc2coc(C3CC3)n2)cc1 ZINC000769512365 1052072726 /nfs/dbraw/zinc/07/27/26/1052072726.db2.gz DFPGTKICHZCARP-QGZVFWFLSA-N 1 2 300.377 4.418 20 0 DIADLO Fc1ccc([C@H]2CCCC[N@H+]2Cc2coc(C3CC3)n2)cc1 ZINC000769512365 1052072738 /nfs/dbraw/zinc/07/27/38/1052072738.db2.gz DFPGTKICHZCARP-QGZVFWFLSA-N 1 2 300.377 4.418 20 0 DIADLO c1cn2c(cccc2-c2nc(-c3ccc4sccc4c3)no2)[nH+]1 ZINC001217500344 1052074293 /nfs/dbraw/zinc/07/42/93/1052074293.db2.gz DAQTUQNQJUMFRO-UHFFFAOYSA-N 1 2 318.361 4.266 20 0 DIADLO Cc1c(Cl)cccc1-c1noc(-c2cccc3[nH+]ccn32)n1 ZINC001217500229 1052075440 /nfs/dbraw/zinc/07/54/40/1052075440.db2.gz VQBSBOSSHWYNDA-UHFFFAOYSA-N 1 2 310.744 4.013 20 0 DIADLO c1c[nH+]c(N2CCCC2)c(Nc2cccc(N3CCCCC3)c2)c1 ZINC001174301839 1052078902 /nfs/dbraw/zinc/07/89/02/1052078902.db2.gz KGKRHSZIIWANLO-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cccc(N4CCCCC4)c3)ccc21 ZINC001174303331 1052080298 /nfs/dbraw/zinc/08/02/98/1052080298.db2.gz UGESGLBGCONQTD-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO COc1ccc2nc(/C=C\c3cccc4[nH+]ccn43)sc2c1 ZINC000769607461 1052087727 /nfs/dbraw/zinc/08/77/27/1052087727.db2.gz KVPZBABBUJTEAS-YVMONPNESA-N 1 2 307.378 4.123 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1nc(C)cs1)c1ccc(Cl)cc1 ZINC000194019815 1052090316 /nfs/dbraw/zinc/09/03/16/1052090316.db2.gz QQMYNQYDPBAIMY-FZMZJTMJSA-N 1 2 310.850 4.143 20 0 DIADLO Cc1ccc2c(Nc3cc(C(F)(F)F)nn3C)cccc2[nH+]1 ZINC001174327461 1052101292 /nfs/dbraw/zinc/10/12/92/1052101292.db2.gz OJGMDJVBROSUEH-UHFFFAOYSA-N 1 2 306.291 4.039 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1cc(F)c(F)c(F)c1 ZINC000769910888 1052120485 /nfs/dbraw/zinc/12/04/85/1052120485.db2.gz JHUUHLQBEVPVJW-ZCFIWIBFSA-N 1 2 306.740 4.065 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H](C)c2ccc(Br)cc2)o1 ZINC000769904438 1052120679 /nfs/dbraw/zinc/12/06/79/1052120679.db2.gz ITGYDRAXGWAMBQ-NSHDSACASA-N 1 2 323.234 4.411 20 0 DIADLO CCn1nc(CNc2ccc3c(c2)CCC[N@H+]3C)c2ccccc21 ZINC000769921601 1052122446 /nfs/dbraw/zinc/12/24/46/1052122446.db2.gz YZAVSFPPKIFABQ-UHFFFAOYSA-N 1 2 320.440 4.051 20 0 DIADLO CCn1nc(CNc2ccc3c(c2)CCC[N@@H+]3C)c2ccccc21 ZINC000769921601 1052122455 /nfs/dbraw/zinc/12/24/55/1052122455.db2.gz YZAVSFPPKIFABQ-UHFFFAOYSA-N 1 2 320.440 4.051 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000769873375 1052124609 /nfs/dbraw/zinc/12/46/09/1052124609.db2.gz LJVJNLJIEMGOHJ-LBPRGKRZSA-N 1 2 311.385 4.051 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(C(F)(F)F)cc3F)ccc21 ZINC001174402611 1052124906 /nfs/dbraw/zinc/12/49/06/1052124906.db2.gz VSXTWVAETZFEAC-UHFFFAOYSA-N 1 2 309.266 4.475 20 0 DIADLO CCCOc1cccc2c(N[C@@H](C)c3cnn(C)c3C)cc[nH+]c12 ZINC000194702008 1052125126 /nfs/dbraw/zinc/12/51/26/1052125126.db2.gz TXUQYVLXGQKLKG-ZDUSSCGKSA-N 1 2 324.428 4.239 20 0 DIADLO c1ccc([C@H]2CCC[C@H](c3nnc(CC4CCCC4)o3)[NH2+]2)cc1 ZINC001217750727 1052132685 /nfs/dbraw/zinc/13/26/85/1052132685.db2.gz WGUALULMVPBALD-IAGOWNOFSA-N 1 2 311.429 4.358 20 0 DIADLO COc1cccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1F ZINC000769984222 1052136829 /nfs/dbraw/zinc/13/68/29/1052136829.db2.gz FMELTSZZYXPUAS-ZDUSSCGKSA-N 1 2 311.360 4.193 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ncc(C(F)(F)F)cn3)ccc21 ZINC001174380368 1052138994 /nfs/dbraw/zinc/13/89/94/1052138994.db2.gz CKZFWRPGZCOYPZ-UHFFFAOYSA-N 1 2 321.306 4.170 20 0 DIADLO CNc1ccnc(Cl)c1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174380859 1052139310 /nfs/dbraw/zinc/13/93/10/1052139310.db2.gz NKXBBGCJIIPULX-UHFFFAOYSA-N 1 2 315.808 4.451 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(c3)COC4=O)ccc21 ZINC001174381226 1052139371 /nfs/dbraw/zinc/13/93/71/1052139371.db2.gz KBNDCJQTEMDDOW-UHFFFAOYSA-N 1 2 307.353 4.031 20 0 DIADLO Cc1nc(Cl)ncc1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174381686 1052140347 /nfs/dbraw/zinc/14/03/47/1052140347.db2.gz OFXBZPYIJBQVCT-UHFFFAOYSA-N 1 2 301.781 4.113 20 0 DIADLO CCOC(=O)c1occc1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174381439 1052141204 /nfs/dbraw/zinc/14/12/04/1052141204.db2.gz GRMFAIZRASLGIY-UHFFFAOYSA-N 1 2 313.357 4.131 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc(O)c(F)c3F)ccc21 ZINC001174381979 1052141353 /nfs/dbraw/zinc/14/13/53/1052141353.db2.gz YJRLRXNQNOOBOY-UHFFFAOYSA-N 1 2 303.312 4.345 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(O)c(F)c(F)c3)ccc21 ZINC001174383729 1052142442 /nfs/dbraw/zinc/14/24/42/1052142442.db2.gz RXWYCRNQFHXHCC-UHFFFAOYSA-N 1 2 303.312 4.345 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc(C4=NCCO4)cc3)ccc21 ZINC001174383714 1052142705 /nfs/dbraw/zinc/14/27/05/1052142705.db2.gz RPGLZVNZWNQCFC-UHFFFAOYSA-N 1 2 320.396 4.138 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc(N4CCCC4)nc3)ccc21 ZINC001174382356 1052143421 /nfs/dbraw/zinc/14/34/21/1052143421.db2.gz LSPMNGILBCDCQM-UHFFFAOYSA-N 1 2 321.428 4.356 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(F)c(O)cc3F)ccc21 ZINC001174382978 1052143725 /nfs/dbraw/zinc/14/37/25/1052143725.db2.gz GMTZGAVRWPLLHR-UHFFFAOYSA-N 1 2 303.312 4.345 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc(C4OCCO4)c3)ccc21 ZINC001174384520 1052145113 /nfs/dbraw/zinc/14/51/13/1052145113.db2.gz YLZHBWNGGGVSEM-UHFFFAOYSA-N 1 2 323.396 4.406 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(c3)[C@H](O)CC4)ccc21 ZINC001174384462 1052145188 /nfs/dbraw/zinc/14/51/88/1052145188.db2.gz GNYDSBZTEZZKHR-LJQANCHMSA-N 1 2 307.397 4.340 20 0 DIADLO Cc1cc(Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)[nH+]c2)c(C)s1 ZINC001174420947 1052151547 /nfs/dbraw/zinc/15/15/47/1052151547.db2.gz LOGOLLVQPALVDP-TXEJJXNPSA-N 1 2 317.458 4.117 20 0 DIADLO c1n[nH]c([C@H]([NH2+]C[C@H]2CCCc3ccccc32)C2CCCCC2)n1 ZINC000494877847 1052156377 /nfs/dbraw/zinc/15/63/77/1052156377.db2.gz LMESHHWXYIOLMN-IEBWSBKVSA-N 1 2 324.472 4.136 20 0 DIADLO c1csc([C@@H]2CCC[N@H+]2Cc2noc(-c3ccccc3)n2)c1 ZINC000053399395 1052158761 /nfs/dbraw/zinc/15/87/61/1052158761.db2.gz XZKOVNITRORZGZ-AWEZNQCLSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc([C@@H]2CCC[N@@H+]2Cc2noc(-c3ccccc3)n2)c1 ZINC000053399395 1052158772 /nfs/dbraw/zinc/15/87/72/1052158772.db2.gz XZKOVNITRORZGZ-AWEZNQCLSA-N 1 2 311.410 4.135 20 0 DIADLO CC(C)(O)c1cccc(Nc2ccc[nH+]c2N2CCCCC2)c1 ZINC001174404327 1052160763 /nfs/dbraw/zinc/16/07/63/1052160763.db2.gz MRMUHTVDCPMKHM-UHFFFAOYSA-N 1 2 311.429 4.043 20 0 DIADLO COc1ccc(Nc2cc[nH+]c3[nH]ccc32)cc1C(F)(F)F ZINC001174410951 1052164451 /nfs/dbraw/zinc/16/44/51/1052164451.db2.gz AGMDADAVQKAORS-UHFFFAOYSA-N 1 2 307.275 4.286 20 0 DIADLO Fc1cc(Br)cc(Nc2cc[nH+]c3[nH]ccc32)c1 ZINC001174411092 1052164698 /nfs/dbraw/zinc/16/46/98/1052164698.db2.gz IWYVJZGWLLTXKK-UHFFFAOYSA-N 1 2 306.138 4.160 20 0 DIADLO CCOC(=O)c1cc(Nc2cc[nH+]c3[nH]ccc32)ccc1Cl ZINC001174414561 1052167043 /nfs/dbraw/zinc/16/70/43/1052167043.db2.gz VTDOYTQCEBGTJA-UHFFFAOYSA-N 1 2 315.760 4.088 20 0 DIADLO O=c1cc(Oc2ccc(Nc3cc[nH+]c4[nH]ccc43)cc2)cc[nH]1 ZINC001174414052 1052167340 /nfs/dbraw/zinc/16/73/40/1052167340.db2.gz UHJKTPRIDREYKN-UHFFFAOYSA-N 1 2 318.336 4.151 20 0 DIADLO CC(C)C[N@H+](Cn1nc(-c2ccc(F)cc2)oc1=S)C1CC1 ZINC000914566836 1052167605 /nfs/dbraw/zinc/16/76/05/1052167605.db2.gz JWXOGTAIXYUZSP-UHFFFAOYSA-N 1 2 321.421 4.090 20 0 DIADLO CC(C)C[N@@H+](Cn1nc(-c2ccc(F)cc2)oc1=S)C1CC1 ZINC000914566836 1052167617 /nfs/dbraw/zinc/16/76/17/1052167617.db2.gz JWXOGTAIXYUZSP-UHFFFAOYSA-N 1 2 321.421 4.090 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(C)n(-c2ccccc2C)c1=S ZINC000914567414 1052170058 /nfs/dbraw/zinc/17/00/58/1052170058.db2.gz XPBDLDSNYRGHGJ-UHFFFAOYSA-N 1 2 318.490 4.100 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(C)n(-c2ccccc2C)c1=S ZINC000914567414 1052170067 /nfs/dbraw/zinc/17/00/67/1052170067.db2.gz XPBDLDSNYRGHGJ-UHFFFAOYSA-N 1 2 318.490 4.100 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1sccc1Cl ZINC000494935095 1052171176 /nfs/dbraw/zinc/17/11/76/1052171176.db2.gz IPNOPVWAHKLBPK-DOMZBBRYSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1sccc1Cl ZINC000494935095 1052171190 /nfs/dbraw/zinc/17/11/90/1052171190.db2.gz IPNOPVWAHKLBPK-DOMZBBRYSA-N 1 2 307.846 4.364 20 0 DIADLO FC(F)(F)Oc1cc[nH+]c(Nc2cccc(N3CCCC3)c2)c1 ZINC001174488044 1052174133 /nfs/dbraw/zinc/17/41/33/1052174133.db2.gz CMIKNLDMGCJGOI-UHFFFAOYSA-N 1 2 323.318 4.324 20 0 DIADLO C[C@@H]1C[N@H+](Cc2sccc2Cl)C[C@H](c2ccccc2)O1 ZINC000494948136 1052178002 /nfs/dbraw/zinc/17/80/02/1052178002.db2.gz LAIVIKYAKRALHV-IUODEOHRSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2sccc2Cl)C[C@H](c2ccccc2)O1 ZINC000494948136 1052178010 /nfs/dbraw/zinc/17/80/10/1052178010.db2.gz LAIVIKYAKRALHV-IUODEOHRSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H](Oc1cc(N)cc[nH+]1)c1c(Cl)ccc(F)c1Cl ZINC001217967826 1052178333 /nfs/dbraw/zinc/17/83/33/1052178333.db2.gz FLKMGHMCAXWEKU-SSDOTTSWSA-N 1 2 301.148 4.250 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(Cl)cs2)C[C@@H](c2ccccc2)O1 ZINC000494955559 1052180833 /nfs/dbraw/zinc/18/08/33/1052180833.db2.gz SQLXMZMZEKYKBZ-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(Cl)cs2)C[C@@H](c2ccccc2)O1 ZINC000494955559 1052180838 /nfs/dbraw/zinc/18/08/38/1052180838.db2.gz SQLXMZMZEKYKBZ-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(Cl)cs2)C[C@H](c2ccccc2)O1 ZINC000494955557 1052181193 /nfs/dbraw/zinc/18/11/93/1052181193.db2.gz SQLXMZMZEKYKBZ-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(Cl)cs2)C[C@H](c2ccccc2)O1 ZINC000494955557 1052181197 /nfs/dbraw/zinc/18/11/97/1052181197.db2.gz SQLXMZMZEKYKBZ-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1cc(Cl)cs1 ZINC000494941858 1052181778 /nfs/dbraw/zinc/18/17/78/1052181778.db2.gz YQNFPODYXMGZEZ-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1cc(Cl)cs1 ZINC000494941858 1052181783 /nfs/dbraw/zinc/18/17/83/1052181783.db2.gz YQNFPODYXMGZEZ-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO Cc1ccc(C)c([C@@H]2C[N@H+](C/C=C/c3ccncc3)[C@@H](C)CO2)c1 ZINC000494960611 1052183983 /nfs/dbraw/zinc/18/39/83/1052183983.db2.gz YARQDVYVLOPGCG-MWZYOKOPSA-N 1 2 322.452 4.174 20 0 DIADLO Cc1ccc(C)c([C@@H]2C[N@@H+](C/C=C/c3ccncc3)[C@@H](C)CO2)c1 ZINC000494960611 1052183987 /nfs/dbraw/zinc/18/39/87/1052183987.db2.gz YARQDVYVLOPGCG-MWZYOKOPSA-N 1 2 322.452 4.174 20 0 DIADLO CC[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccc(F)cn1 ZINC000494970526 1052185643 /nfs/dbraw/zinc/18/56/43/1052185643.db2.gz OBFLZNMRJRIFNL-MRXNPFEDSA-N 1 2 314.408 4.169 20 0 DIADLO CC(C)CC1(C[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)CCC1 ZINC000495069654 1052208210 /nfs/dbraw/zinc/20/82/10/1052208210.db2.gz MPZAYSXYKWQSAU-INIZCTEOSA-N 1 2 304.482 4.232 20 0 DIADLO c1n[nH]c([C@H]([NH2+]CC2(Cc3ccccc3)CC2)C2CCCCC2)n1 ZINC000495081095 1052212693 /nfs/dbraw/zinc/21/26/93/1052212693.db2.gz SQHFSOMYHXPAGF-GOSISDBHSA-N 1 2 324.472 4.039 20 0 DIADLO CC(C)(C[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1)C1CCCC1 ZINC000495088060 1052214151 /nfs/dbraw/zinc/21/41/51/1052214151.db2.gz DEPRTHMXIZFDEX-MRXNPFEDSA-N 1 2 304.482 4.232 20 0 DIADLO Cc1ccc(-c2ccc(O[C@H]3C[NH2+]CC(F)(F)C3)cc2)cc1 ZINC001218275293 1052216711 /nfs/dbraw/zinc/21/67/11/1052216711.db2.gz VXDDEYJAHYTRAF-QGZVFWFLSA-N 1 2 303.352 4.038 20 0 DIADLO C[C@@H](c1ccccc1)c1ccccc1O[C@@H]1C[NH2+]CC(F)(F)C1 ZINC001218280980 1052217439 /nfs/dbraw/zinc/21/74/39/1052217439.db2.gz YOPXAEURKBNWQY-HOCLYGCPSA-N 1 2 317.379 4.214 20 0 DIADLO Nc1cc[nH+]c(O[C@H](c2ccccc2)C(Cl)(Cl)Cl)c1 ZINC001218318703 1052224060 /nfs/dbraw/zinc/22/40/60/1052224060.db2.gz BXSPBUDFYTVYCM-GFCCVEGCSA-N 1 2 317.603 4.154 20 0 DIADLO Nc1[nH+]cccc1O[C@H](c1ccccc1)C(Cl)(Cl)Cl ZINC001218320909 1052225665 /nfs/dbraw/zinc/22/56/65/1052225665.db2.gz ZJCNNNKIDFXDMJ-LLVKDONJSA-N 1 2 317.603 4.154 20 0 DIADLO Nc1[nH+]cccc1O[C@H](/C=C/c1ccccc1)c1ccccc1 ZINC001218354767 1052231224 /nfs/dbraw/zinc/23/12/24/1052231224.db2.gz WQSLWABIWZROLQ-KAUXGEHWSA-N 1 2 302.377 4.497 20 0 DIADLO COc1ccc2cc(CC[C@@H](C)Oc3ccc[nH+]c3N)ccc2c1 ZINC001218490527 1052249719 /nfs/dbraw/zinc/24/97/19/1052249719.db2.gz LOGNSGCRNOGLCW-CQSZACIVSA-N 1 2 322.408 4.226 20 0 DIADLO Cc1cc(C)c(NC(=O)NC[C@@H]2CCC[C@@H](C)[C@H]2C)c(C)[nH+]1 ZINC001219009525 1052267452 /nfs/dbraw/zinc/26/74/52/1052267452.db2.gz CZFDPNGWMDLQTL-XFJVYGCCSA-N 1 2 303.450 4.201 20 0 DIADLO C[C@@H]1CCCN(C(=O)Nc2ccc3[nH+]ccn3c2)c2ccccc21 ZINC001219557267 1052293933 /nfs/dbraw/zinc/29/39/33/1052293933.db2.gz VMKISMLNPZTQQG-CQSZACIVSA-N 1 2 320.396 4.270 20 0 DIADLO Cc1ccc(Br)cc1C[N@@H+]1CCc2sccc2C1 ZINC000313731622 1052301838 /nfs/dbraw/zinc/30/18/38/1052301838.db2.gz BEUPFQXUJCGUGL-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1ccc(Br)cc1C[N@H+]1CCc2sccc2C1 ZINC000313731622 1052301845 /nfs/dbraw/zinc/30/18/45/1052301845.db2.gz BEUPFQXUJCGUGL-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Fc1cc(CNc2ccc(N3CCCCC3)[nH+]c2)ccc1Cl ZINC000315019091 1052328649 /nfs/dbraw/zinc/32/86/49/1052328649.db2.gz VJROAPWOWHVXMM-UHFFFAOYSA-N 1 2 319.811 4.477 20 0 DIADLO C[C@H](c1noc(-c2ccc(-n3cc[nH+]c3)cc2)n1)c1cccs1 ZINC000762195027 1052332568 /nfs/dbraw/zinc/33/25/68/1052332568.db2.gz PBZNVANILVOEJL-LBPRGKRZSA-N 1 2 322.393 4.136 20 0 DIADLO CCCC[N@H+](Cc1noc(CC)n1)[C@H](CC)c1ccccc1 ZINC000303611370 1052334266 /nfs/dbraw/zinc/33/42/66/1052334266.db2.gz LMMONEZYXLZDKN-MRXNPFEDSA-N 1 2 301.434 4.385 20 0 DIADLO CCCC[N@@H+](Cc1noc(CC)n1)[C@H](CC)c1ccccc1 ZINC000303611370 1052334271 /nfs/dbraw/zinc/33/42/71/1052334271.db2.gz LMMONEZYXLZDKN-MRXNPFEDSA-N 1 2 301.434 4.385 20 0 DIADLO CCCCOc1ncccc1C[NH2+][C@@H](C)c1cc(F)ccc1F ZINC000495512386 1052365034 /nfs/dbraw/zinc/36/50/34/1052365034.db2.gz GCQORVILDPNPJV-ZDUSSCGKSA-N 1 2 320.383 4.390 20 0 DIADLO Cc1ccc(-c2nn(C[N@@H+](C)[C@@H](C)C(C)C)c(=S)o2)cc1 ZINC000915208525 1052367100 /nfs/dbraw/zinc/36/71/00/1052367100.db2.gz FMQYBISQJNNVTF-ZDUSSCGKSA-N 1 2 305.447 4.115 20 0 DIADLO Cc1ccc(-c2nn(C[N@H+](C)[C@@H](C)C(C)C)c(=S)o2)cc1 ZINC000915208525 1052367108 /nfs/dbraw/zinc/36/71/08/1052367108.db2.gz FMQYBISQJNNVTF-ZDUSSCGKSA-N 1 2 305.447 4.115 20 0 DIADLO COCc1ccc(C[NH+](C/C=C\Cl)C/C=C\Cl)cc1 ZINC000915260071 1052378788 /nfs/dbraw/zinc/37/87/88/1052378788.db2.gz BNWAZPLFKYWAOW-LAWPVJTFSA-N 1 2 300.229 4.140 20 0 DIADLO CN(C)c1cc(CSCc2cccc(OC(F)F)c2)cc[nH+]1 ZINC000762482007 1052389561 /nfs/dbraw/zinc/38/95/61/1052389561.db2.gz XPWUYWCXOSOWSB-UHFFFAOYSA-N 1 2 324.396 4.182 20 0 DIADLO CC(=O)Nc1cccc([C@@H](C)Nc2ccc([NH+](C)C)cc2C)c1 ZINC000237369895 1052440275 /nfs/dbraw/zinc/44/02/75/1052440275.db2.gz HALODKQBBPEOTI-CQSZACIVSA-N 1 2 311.429 4.193 20 0 DIADLO C(=C/[C@H](OCCn1cc[nH+]c1)c1ccccc1)\c1ccccc1 ZINC001222138247 1052449301 /nfs/dbraw/zinc/44/93/01/1052449301.db2.gz CJOWUTITRQIXIF-SGWGQVFISA-N 1 2 304.393 4.354 20 0 DIADLO Cc1cc(-c2ccc(Cn3cc[nH+]c3)cn2)c(F)cc1Cl ZINC001222226296 1052464902 /nfs/dbraw/zinc/46/49/02/1052464902.db2.gz PYXBILPPWCCWEX-UHFFFAOYSA-N 1 2 301.752 4.094 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1ccc(Cl)nc1 ZINC000915669345 1052467527 /nfs/dbraw/zinc/46/75/27/1052467527.db2.gz DVBPWUIHYUTDLX-UHFFFAOYSA-N 1 2 314.820 4.345 20 0 DIADLO Clc1ccsc1CNC[C@@H](c1ccccc1)[NH+]1CCCC1 ZINC000394062288 1052499803 /nfs/dbraw/zinc/49/98/03/1052499803.db2.gz BBBYKKNJVDICMA-INIZCTEOSA-N 1 2 320.889 4.328 20 0 DIADLO Cc1cc(-c2cc(Cl)cc(Cl)c2)c[nH+]c1N1CCOCC1 ZINC001222593019 1052513783 /nfs/dbraw/zinc/51/37/83/1052513783.db2.gz AJRBYJKQDXQCFQ-UHFFFAOYSA-N 1 2 323.223 4.200 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cc(Cl)cc(Cl)c3)nn2)c1C ZINC001222588896 1052514285 /nfs/dbraw/zinc/51/42/85/1052514285.db2.gz WZBJGTVGBHITHW-UHFFFAOYSA-N 1 2 319.195 4.253 20 0 DIADLO Cn1c[nH+]cc1CO[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC001222595013 1052515550 /nfs/dbraw/zinc/51/55/50/1052515550.db2.gz LQCXBDGMTSSRQY-SFHVURJKSA-N 1 2 312.800 4.380 20 0 DIADLO Fc1ccc(CNc2ccc(N3CCCC3)[nH+]c2)c(F)c1Cl ZINC001168505898 1052542973 /nfs/dbraw/zinc/54/29/73/1052542973.db2.gz ROWSASDFMYHNIZ-UHFFFAOYSA-N 1 2 323.774 4.226 20 0 DIADLO COc1c[nH+]c(NCc2ccc(F)c(Cl)c2F)c2[nH]ccc21 ZINC001168506618 1052548369 /nfs/dbraw/zinc/54/83/69/1052548369.db2.gz YFAXBUMEHABXPM-UHFFFAOYSA-N 1 2 323.730 4.115 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1cccc(-n3cccn3)c1)C2 ZINC000347471398 1052549092 /nfs/dbraw/zinc/54/90/92/1052549092.db2.gz WLARKAKZKPYXQB-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1cccc(-n3cccn3)c1)C2 ZINC000347471398 1052549097 /nfs/dbraw/zinc/54/90/97/1052549097.db2.gz WLARKAKZKPYXQB-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO Cc1cc(CO[C@H](c2ccccc2)c2ccccn2)cc(C)[nH+]1 ZINC001223419632 1052598854 /nfs/dbraw/zinc/59/88/54/1052598854.db2.gz GOUBUXJASUAVPW-HXUWFJFHSA-N 1 2 304.393 4.400 20 0 DIADLO Cc1cc(COCC[C@@H]2COC(C(C)C)(C(C)C)O2)cc(C)[nH+]1 ZINC001223424806 1052599807 /nfs/dbraw/zinc/59/98/07/1052599807.db2.gz NSJFMYOSNIXZEH-GOSISDBHSA-N 1 2 321.461 4.029 20 0 DIADLO Cc1cc(COCc2cc(Cl)cnc2OC(C)C)cc(C)[nH+]1 ZINC001223424150 1052600481 /nfs/dbraw/zinc/60/04/81/1052600481.db2.gz IGVJNTJIBVROFL-UHFFFAOYSA-N 1 2 320.820 4.251 20 0 DIADLO O=C(/C=C\c1ccc(Cl)cc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000916419309 1052607200 /nfs/dbraw/zinc/60/72/00/1052607200.db2.gz VWOLTTGFVHSWLW-TWGQIWQCSA-N 1 2 323.783 4.178 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c(F)c2)n1 ZINC000126637740 1052673040 /nfs/dbraw/zinc/67/30/40/1052673040.db2.gz ZJZIKJVJAIEPSM-CHWSQXEVSA-N 1 2 305.397 4.272 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000127545426 1052698890 /nfs/dbraw/zinc/69/88/90/1052698890.db2.gz DWGGORLWWCYIPN-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000127545426 1052698894 /nfs/dbraw/zinc/69/88/94/1052698894.db2.gz DWGGORLWWCYIPN-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO CCCCC1CCC(NC(=O)NCc2c[nH+]c(C)cc2C)CC1 ZINC001224461679 1052700261 /nfs/dbraw/zinc/70/02/61/1052700261.db2.gz AOIVUOMRJKXFEZ-UHFFFAOYSA-N 1 2 317.477 4.247 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1ccc(F)cc1Br ZINC000127655823 1052701151 /nfs/dbraw/zinc/70/11/51/1052701151.db2.gz BCMPMXCOPLRUMV-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(F)cc1Br ZINC000127655823 1052701156 /nfs/dbraw/zinc/70/11/56/1052701156.db2.gz BCMPMXCOPLRUMV-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000127857864 1052704075 /nfs/dbraw/zinc/70/40/75/1052704075.db2.gz HGFYEYGUIICDSL-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000127857864 1052704079 /nfs/dbraw/zinc/70/40/79/1052704079.db2.gz HGFYEYGUIICDSL-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2nnc(-c3ccc(C)cc3)o2)o1 ZINC000127992617 1052706948 /nfs/dbraw/zinc/70/69/48/1052706948.db2.gz LNZXNWAVRALSFB-AWEZNQCLSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2nnc(-c3ccc(C)cc3)o2)o1 ZINC000127992617 1052706951 /nfs/dbraw/zinc/70/69/51/1052706951.db2.gz LNZXNWAVRALSFB-AWEZNQCLSA-N 1 2 311.385 4.139 20 0 DIADLO CC(C)c1noc(C[N@H+](C2CC2)[C@H]2CCCc3ccccc32)n1 ZINC000067712262 1052710235 /nfs/dbraw/zinc/71/02/35/1052710235.db2.gz MPWYFFNMOLQULI-KRWDZBQOSA-N 1 2 311.429 4.235 20 0 DIADLO CC(C)c1noc(C[N@@H+](C2CC2)[C@H]2CCCc3ccccc32)n1 ZINC000067712262 1052710242 /nfs/dbraw/zinc/71/02/42/1052710242.db2.gz MPWYFFNMOLQULI-KRWDZBQOSA-N 1 2 311.429 4.235 20 0 DIADLO CC(C)C[C@H](c1nc(C(C)(C)c2ccccc2)no1)n1cc[nH+]c1 ZINC000924009310 1052715035 /nfs/dbraw/zinc/71/50/35/1052715035.db2.gz XPIPGGYKOYJABJ-MRXNPFEDSA-N 1 2 324.428 4.228 20 0 DIADLO C[C@H]1CSC(SCc2c[nH+]c(N(C)C)c3ccccc23)=N1 ZINC000917367523 1052722439 /nfs/dbraw/zinc/72/24/39/1052722439.db2.gz ITXFDXKNOVBRMV-NSHDSACASA-N 1 2 317.483 4.025 20 0 DIADLO Cc1nn(C[N@H+](Cc2ccccc2)[C@@H](C)C2CC2)c(=S)s1 ZINC000917438534 1052727466 /nfs/dbraw/zinc/72/74/66/1052727466.db2.gz YDFQIQIHKYMIDD-LBPRGKRZSA-N 1 2 319.499 4.241 20 0 DIADLO Cc1nn(C[N@@H+](Cc2ccccc2)[C@@H](C)C2CC2)c(=S)s1 ZINC000917438534 1052727472 /nfs/dbraw/zinc/72/74/72/1052727472.db2.gz YDFQIQIHKYMIDD-LBPRGKRZSA-N 1 2 319.499 4.241 20 0 DIADLO C[C@@H](Oc1cc[nH+]cc1)c1c(F)cc(Br)cc1F ZINC001225295638 1052769761 /nfs/dbraw/zinc/76/97/61/1052769761.db2.gz NCGMSTFGOSKUDR-MRVPVSSYSA-N 1 2 314.129 4.262 20 0 DIADLO Cc1cc([C@H]2C[N@H+](CCCCC(F)(F)F)CCO2)ccc1F ZINC000129082427 1052774756 /nfs/dbraw/zinc/77/47/56/1052774756.db2.gz OXFQXJCTLHACCZ-OAHLLOKOSA-N 1 2 319.342 4.240 20 0 DIADLO Cc1cc([C@H]2C[N@@H+](CCCCC(F)(F)F)CCO2)ccc1F ZINC000129082427 1052774761 /nfs/dbraw/zinc/77/47/61/1052774761.db2.gz OXFQXJCTLHACCZ-OAHLLOKOSA-N 1 2 319.342 4.240 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000069067567 1052779314 /nfs/dbraw/zinc/77/93/14/1052779314.db2.gz VJFMNZSPCSCHKV-LBPRGKRZSA-N 1 2 300.333 4.267 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000069067567 1052779318 /nfs/dbraw/zinc/77/93/18/1052779318.db2.gz VJFMNZSPCSCHKV-LBPRGKRZSA-N 1 2 300.333 4.267 20 0 DIADLO CCc1cccc(CC)c1NC(=O)C[N@H+](C)[C@H](C)c1ccco1 ZINC000069069370 1052779810 /nfs/dbraw/zinc/77/98/10/1052779810.db2.gz WCKOMQYYBQUITA-CQSZACIVSA-N 1 2 314.429 4.036 20 0 DIADLO CCc1cccc(CC)c1NC(=O)C[N@@H+](C)[C@H](C)c1ccco1 ZINC000069069370 1052779815 /nfs/dbraw/zinc/77/98/15/1052779815.db2.gz WCKOMQYYBQUITA-CQSZACIVSA-N 1 2 314.429 4.036 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@H+](C)Cc1ccn(-c2ccccc2)n1 ZINC000918187209 1052786753 /nfs/dbraw/zinc/78/67/53/1052786753.db2.gz ZAMLIDMRGLELLQ-HNNXBMFYSA-N 1 2 309.388 4.204 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@@H+](C)Cc1ccn(-c2ccccc2)n1 ZINC000918187209 1052786757 /nfs/dbraw/zinc/78/67/57/1052786757.db2.gz ZAMLIDMRGLELLQ-HNNXBMFYSA-N 1 2 309.388 4.204 20 0 DIADLO COc1cc(C)[nH+]c(CSC[C@H](OC)c2ccccc2)c1 ZINC000556112996 1052801545 /nfs/dbraw/zinc/80/15/45/1052801545.db2.gz MGEHWHANUCAPNI-KRWDZBQOSA-N 1 2 303.427 4.020 20 0 DIADLO C[C@H](CC[NH2+][C@@H](c1nnc[nH]1)c1ccc(F)cc1)CC(C)(C)C ZINC000556178687 1052816882 /nfs/dbraw/zinc/81/68/82/1052816882.db2.gz LKHOURISVKAQQQ-CZUORRHYSA-N 1 2 318.440 4.085 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]CC(C)(F)F)c2cccc(Br)c21 ZINC000556230825 1052825665 /nfs/dbraw/zinc/82/56/65/1052825665.db2.gz ATIPAKFTUKGNNS-GZMMTYOYSA-N 1 2 304.178 4.242 20 0 DIADLO Clc1nccc(Nc2cccc(Cn3cc[nH+]c3)c2)c1Cl ZINC001212240043 1052864985 /nfs/dbraw/zinc/86/49/85/1052864985.db2.gz CVUPKXVCMQLKHB-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@@H]1CCCc2ccccc21 ZINC000072058357 1052865793 /nfs/dbraw/zinc/86/57/93/1052865793.db2.gz CYFJVSZFDPLEKG-GOSISDBHSA-N 1 2 317.392 4.135 20 0 DIADLO CCC(CC)[N@H+](Cn1nc(OC(C)C)sc1=S)C1CC1 ZINC000919941411 1052905994 /nfs/dbraw/zinc/90/59/94/1052905994.db2.gz HXJAGAPCLNKOAC-UHFFFAOYSA-N 1 2 315.508 4.072 20 0 DIADLO CCC(CC)[N@@H+](Cn1nc(OC(C)C)sc1=S)C1CC1 ZINC000919941411 1052905996 /nfs/dbraw/zinc/90/59/96/1052905996.db2.gz HXJAGAPCLNKOAC-UHFFFAOYSA-N 1 2 315.508 4.072 20 0 DIADLO CCSc1cccc(C[NH2+]Cc2c(F)ccc(O)c2F)c1 ZINC000556878289 1052892771 /nfs/dbraw/zinc/89/27/71/1052892771.db2.gz LQVXOGMFFCBSES-UHFFFAOYSA-N 1 2 309.381 4.072 20 0 DIADLO CCC/C(C)=C\C(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC000920220407 1052928819 /nfs/dbraw/zinc/92/88/19/1052928819.db2.gz PRROEFBKRMENDL-XXYUJHKVSA-N 1 2 321.490 4.060 20 0 DIADLO CCC/C(C)=C\C(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC000920220407 1052928823 /nfs/dbraw/zinc/92/88/23/1052928823.db2.gz PRROEFBKRMENDL-XXYUJHKVSA-N 1 2 321.490 4.060 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)/C=C\c3ccccc3)c2)[nH+]c1C ZINC000920251949 1052930449 /nfs/dbraw/zinc/93/04/49/1052930449.db2.gz OXBRYMFAMQYRHN-QXMHVHEDSA-N 1 2 317.392 4.345 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)CCc3ccccc3)c2)[nH+]c1C ZINC000920249542 1052930568 /nfs/dbraw/zinc/93/05/68/1052930568.db2.gz ATJNUIFCOSBZMH-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Nc1ccc(Nc2ccccc2)cc1 ZINC000920925756 1052954859 /nfs/dbraw/zinc/95/48/59/1052954859.db2.gz NRFZTIGXGAMCEK-UHFFFAOYSA-N 1 2 320.396 4.046 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+](Cn1cc(Cl)cn1)C1CC1 ZINC000921186878 1052964897 /nfs/dbraw/zinc/96/48/97/1052964897.db2.gz RUPKSAGJLLNHNG-LLVKDONJSA-N 1 2 310.228 4.373 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](Cn1cc(Cl)cn1)C1CC1 ZINC000921186878 1052964901 /nfs/dbraw/zinc/96/49/01/1052964901.db2.gz RUPKSAGJLLNHNG-LLVKDONJSA-N 1 2 310.228 4.373 20 0 DIADLO C/C(=C/C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccc(F)cc1 ZINC000921277928 1052969216 /nfs/dbraw/zinc/96/92/16/1052969216.db2.gz GMILYQAWABKEMM-OWBHPGMISA-N 1 2 321.355 4.053 20 0 DIADLO Cc1nn(C[NH2+]C2(c3ccc(F)cc3)CCCC2)c(=S)s1 ZINC000064433275 1052982808 /nfs/dbraw/zinc/98/28/08/1052982808.db2.gz KENIFGUZMMURPS-UHFFFAOYSA-N 1 2 323.462 4.138 20 0 DIADLO CC(C)c1ccc([C@@H]2CCC[N@@H+]2Cc2nnc(C3CC3)[nH]2)cc1 ZINC000347484919 1052986195 /nfs/dbraw/zinc/98/61/95/1052986195.db2.gz JDVXXMBLGSYDDE-KRWDZBQOSA-N 1 2 310.445 4.143 20 0 DIADLO CC(C)c1ccc([C@@H]2CCC[N@H+]2Cc2nnc(C3CC3)[nH]2)cc1 ZINC000347484919 1052986200 /nfs/dbraw/zinc/98/62/00/1052986200.db2.gz JDVXXMBLGSYDDE-KRWDZBQOSA-N 1 2 310.445 4.143 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2noc(-c3ccccc3)n2)c1 ZINC000615462825 1053019295 /nfs/dbraw/zinc/01/92/95/1053019295.db2.gz KTICQRRQKJQYDN-SFHVURJKSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2noc(-c3ccccc3)n2)c1 ZINC000615462825 1053019298 /nfs/dbraw/zinc/01/92/98/1053019298.db2.gz KTICQRRQKJQYDN-SFHVURJKSA-N 1 2 319.408 4.382 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1cccc(Cl)c1O ZINC000180022119 1053042262 /nfs/dbraw/zinc/04/22/62/1053042262.db2.gz WHOULPDSPZYMDS-GUYCJALGSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1cccc(Cl)c1O ZINC000180022119 1053042263 /nfs/dbraw/zinc/04/22/63/1053042263.db2.gz WHOULPDSPZYMDS-GUYCJALGSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1cccc(Cl)c1O ZINC000180022105 1053042310 /nfs/dbraw/zinc/04/23/10/1053042310.db2.gz WHOULPDSPZYMDS-DYVFJYSZSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1cccc(Cl)c1O ZINC000180022105 1053042315 /nfs/dbraw/zinc/04/23/15/1053042315.db2.gz WHOULPDSPZYMDS-DYVFJYSZSA-N 1 2 317.816 4.008 20 0 DIADLO COc1cc2c(cc1O[C@H]1CCCc3ccccc31)C=[NH+]CC2 ZINC001228091084 1053042655 /nfs/dbraw/zinc/04/26/55/1053042655.db2.gz RMEMZVXYPVLESK-SFHVURJKSA-N 1 2 307.393 4.127 20 0 DIADLO COc1cc2c(cc1O[C@@H]1CCc3cc(C)ccc31)C=[NH+]CC2 ZINC001228088138 1053042696 /nfs/dbraw/zinc/04/26/96/1053042696.db2.gz SHFALZWUQZAJEU-GOSISDBHSA-N 1 2 307.393 4.045 20 0 DIADLO Cc1[nH]c2ccc(O[C@@H](c3ccccc3)c3ccccn3)cc2[nH+]1 ZINC001228326583 1053073511 /nfs/dbraw/zinc/07/35/11/1053073511.db2.gz IXYFQVSHSJEZPZ-FQEVSTJZSA-N 1 2 315.376 4.435 20 0 DIADLO COc1ccc([C@@H](C)Oc2ccc3[nH]c(C)[nH+]c3c2)cc1OC ZINC001228329615 1053075164 /nfs/dbraw/zinc/07/51/64/1053075164.db2.gz PNNLCPJLAVJCOM-LLVKDONJSA-N 1 2 312.369 4.029 20 0 DIADLO COc1ccc(OC)c([C@H](C)Oc2ccc3[nH]c(C)[nH+]c3c2)c1 ZINC001228330164 1053076560 /nfs/dbraw/zinc/07/65/60/1053076560.db2.gz VYDYAZJAVMKKHU-NSHDSACASA-N 1 2 312.369 4.029 20 0 DIADLO Cc1cc(N[C@H](c2ccccc2)[C@@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC000538979104 1053089109 /nfs/dbraw/zinc/08/91/09/1053089109.db2.gz HDWAQEREQSRBQH-SJLPKXTDSA-N 1 2 311.429 4.098 20 0 DIADLO CCCn1cc(CNc2[nH+]c3ccccc3n2C2CCCC2)cn1 ZINC000539708736 1053094449 /nfs/dbraw/zinc/09/44/49/1053094449.db2.gz LLXMFXCVHQIHAK-UHFFFAOYSA-N 1 2 323.444 4.370 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1sccc1OC ZINC000539709200 1053095502 /nfs/dbraw/zinc/09/55/02/1053095502.db2.gz ZZLZHWUGBWOFIG-UHFFFAOYSA-N 1 2 301.415 4.129 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3ccc4ccccc4c3)ccn12 ZINC001350963302 1053123758 /nfs/dbraw/zinc/12/37/58/1053123758.db2.gz YKONGBNBJAZAFI-UHFFFAOYSA-N 1 2 302.333 4.015 20 0 DIADLO Cc1cn(C2CCCCC2)nc1NCc1c[nH+]c2c(C)cccn12 ZINC000543241450 1053130283 /nfs/dbraw/zinc/13/02/83/1053130283.db2.gz DCPBOVHLGOIXIN-UHFFFAOYSA-N 1 2 323.444 4.265 20 0 DIADLO COc1ccccc1OCCN(C)c1cc(C)c2ccccc2[nH+]1 ZINC001317887121 1053137160 /nfs/dbraw/zinc/13/71/60/1053137160.db2.gz YQNGXBXHWFJDIN-UHFFFAOYSA-N 1 2 322.408 4.067 20 0 DIADLO Cc1cc(N2CCCN(c3ccccc3)CC2)[nH+]c2ccccc12 ZINC001317881107 1053137675 /nfs/dbraw/zinc/13/76/75/1053137675.db2.gz VYIBHVPWTWZFBC-UHFFFAOYSA-N 1 2 317.436 4.260 20 0 DIADLO COc1ccc2oc(CNc3ccc4c(c3)CCC[N@H+]4C)cc2c1 ZINC000763486418 1053139229 /nfs/dbraw/zinc/13/92/29/1053139229.db2.gz LGKLFWYQQTWUJT-UHFFFAOYSA-N 1 2 322.408 4.436 20 0 DIADLO COc1ccc2oc(CNc3ccc4c(c3)CCC[N@@H+]4C)cc2c1 ZINC000763486418 1053139234 /nfs/dbraw/zinc/13/92/34/1053139234.db2.gz LGKLFWYQQTWUJT-UHFFFAOYSA-N 1 2 322.408 4.436 20 0 DIADLO CC[C@@H](C)Sc1ccc(NC(=O)[C@@H](C)n2cc[nH+]c2)c(C)c1 ZINC001318081481 1053149016 /nfs/dbraw/zinc/14/90/16/1053149016.db2.gz GOEWVERMIODYEV-ZIAGYGMSSA-N 1 2 317.458 4.282 20 0 DIADLO Fc1cc(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)ccn1 ZINC001351331612 1053165549 /nfs/dbraw/zinc/16/55/49/1053165549.db2.gz XOJOWQOZCRIYIT-UHFFFAOYSA-N 1 2 322.387 4.033 20 0 DIADLO CCO[C@@H]1CCC[N@H+](Cc2cc(Cl)c(F)c(Cl)c2)C1 ZINC001236662041 1053176663 /nfs/dbraw/zinc/17/66/63/1053176663.db2.gz NLBYEQWHRPJUPW-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(F)c(Cl)c2)C1 ZINC001236662041 1053176669 /nfs/dbraw/zinc/17/66/69/1053176669.db2.gz NLBYEQWHRPJUPW-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC001351619033 1053202070 /nfs/dbraw/zinc/20/20/70/1053202070.db2.gz JCDVHDBGCWJWKS-GOSISDBHSA-N 1 2 306.413 4.055 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC001351619033 1053202081 /nfs/dbraw/zinc/20/20/81/1053202081.db2.gz JCDVHDBGCWJWKS-GOSISDBHSA-N 1 2 306.413 4.055 20 0 DIADLO CCCC1CC[NH+](CC(=O)Nc2c(C)cc(C)cc2Cl)CC1 ZINC001318953679 1053206562 /nfs/dbraw/zinc/20/65/62/1053206562.db2.gz NVKSMFUCSHHDAX-UHFFFAOYSA-N 1 2 322.880 4.407 20 0 DIADLO Cc1cc(C)c(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(C)c1 ZINC000090499662 1053233362 /nfs/dbraw/zinc/23/33/62/1053233362.db2.gz CPAMHBBXSGASLG-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1cc(F)c(F)c(F)c1 ZINC000090572516 1053237306 /nfs/dbraw/zinc/23/73/06/1053237306.db2.gz YCHWOYDZKUGVDN-LLVKDONJSA-N 1 2 323.362 4.266 20 0 DIADLO Cc1cc(N(C)[C@H](CCO)c2ccccc2)[nH+]c2ccccc12 ZINC001319439805 1053242922 /nfs/dbraw/zinc/24/29/22/1053242922.db2.gz UKPVLYHFIYJEFB-LJQANCHMSA-N 1 2 306.409 4.103 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1cnc(CC(F)(F)F)s1 ZINC001351948731 1053248769 /nfs/dbraw/zinc/24/87/69/1053248769.db2.gz OYIGIVOALUWEKL-VIFPVBQESA-N 1 2 304.337 4.034 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1cnc(CC(F)(F)F)s1 ZINC001351948731 1053248781 /nfs/dbraw/zinc/24/87/81/1053248781.db2.gz OYIGIVOALUWEKL-VIFPVBQESA-N 1 2 304.337 4.034 20 0 DIADLO Clc1cccc(C2([NH2+]Cc3ccn(-c4ccccc4)n3)CC2)c1 ZINC000091061008 1053250646 /nfs/dbraw/zinc/25/06/46/1053250646.db2.gz ZUBXITBNJDFYLC-UHFFFAOYSA-N 1 2 323.827 4.305 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1ncc(C2CC2)o1 ZINC001319650443 1053259832 /nfs/dbraw/zinc/25/98/32/1053259832.db2.gz YSYYJCCEFMDIBT-UHFFFAOYSA-N 1 2 310.401 4.162 20 0 DIADLO C[C@H](C(=O)Nc1ccc2c(c1)C(C)(C)CC2(C)C)n1cc[nH+]c1 ZINC001319761440 1053271652 /nfs/dbraw/zinc/27/16/52/1053271652.db2.gz AYFOUGKQYFSHEB-CYBMUJFWSA-N 1 2 311.429 4.042 20 0 DIADLO CCc1ccc(Cl)c(CC)c1NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000649501667 1053273725 /nfs/dbraw/zinc/27/37/25/1053273725.db2.gz PDYNBNZIBXIFFZ-LBPRGKRZSA-N 1 2 319.836 4.251 20 0 DIADLO CC[N@H+](Cc1cnc([C@H]2CCCO2)s1)Cc1ccccc1F ZINC001319799428 1053274953 /nfs/dbraw/zinc/27/49/53/1053274953.db2.gz YFEHDWWZDWSZEC-MRXNPFEDSA-N 1 2 320.433 4.156 20 0 DIADLO CC[N@@H+](Cc1cnc([C@H]2CCCO2)s1)Cc1ccccc1F ZINC001319799428 1053274967 /nfs/dbraw/zinc/27/49/67/1053274967.db2.gz YFEHDWWZDWSZEC-MRXNPFEDSA-N 1 2 320.433 4.156 20 0 DIADLO Fc1c(Cl)cccc1C[NH2+]Cc1occc1Br ZINC001319832798 1053277788 /nfs/dbraw/zinc/27/77/88/1053277788.db2.gz UBTHCJPMYSKTAW-UHFFFAOYSA-N 1 2 318.573 4.124 20 0 DIADLO Cc1cc(NC(=O)C=Cc2ccc(C(C)(C)C)cc2)c(C)c[nH+]1 ZINC001127647124 1053279739 /nfs/dbraw/zinc/27/97/39/1053279739.db2.gz JEYCTRAKMKCKTN-DHZHZOJOSA-N 1 2 308.425 4.070 20 0 DIADLO CCCCC[C@H]([NH2+]Cc1nc(CCC)no1)c1ccccc1 ZINC000181742684 1053287086 /nfs/dbraw/zinc/28/70/86/1053287086.db2.gz HHSJMRFJVZYBBD-INIZCTEOSA-N 1 2 301.434 4.433 20 0 DIADLO CC(C)c1nn(C)c(Cl)c1C[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000069753113 1053291223 /nfs/dbraw/zinc/29/12/23/1053291223.db2.gz LXKRTILXLVTBSZ-WCQYABFASA-N 1 2 321.852 4.203 20 0 DIADLO CC(C)c1ocnc1C[N@H+](C)Cc1cccc(Br)c1 ZINC001319997205 1053293186 /nfs/dbraw/zinc/29/31/86/1053293186.db2.gz QCWJWSGEDYJRDV-UHFFFAOYSA-N 1 2 323.234 4.193 20 0 DIADLO CC(C)c1ocnc1C[N@@H+](C)Cc1cccc(Br)c1 ZINC001319997205 1053293197 /nfs/dbraw/zinc/29/31/97/1053293197.db2.gz QCWJWSGEDYJRDV-UHFFFAOYSA-N 1 2 323.234 4.193 20 0 DIADLO COCC[C@@H](Cc1ccco1)Nc1cc(C)c2ccccc2[nH+]1 ZINC001320029317 1053296396 /nfs/dbraw/zinc/29/63/96/1053296396.db2.gz BGZZSKBUNFCWDA-HNNXBMFYSA-N 1 2 310.397 4.196 20 0 DIADLO CCc1oc2ccccc2c1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001320197373 1053313610 /nfs/dbraw/zinc/31/36/10/1053313610.db2.gz HMMGNZHPFILEKN-UHFFFAOYSA-N 1 2 319.364 4.204 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+]Cc1ccc([C@@H]3C[C@H]3C)o1)CCC2 ZINC001320370983 1053329334 /nfs/dbraw/zinc/32/93/34/1053329334.db2.gz FRIZDKZFVKEPDA-KBRIMQKVSA-N 1 2 313.445 4.348 20 0 DIADLO Cc1cc(SCc2cc[nH+]c(N(C)C)c2)c2ccccc2n1 ZINC001320405334 1053331669 /nfs/dbraw/zinc/33/16/69/1053331669.db2.gz JMXXOLHMEPYELR-UHFFFAOYSA-N 1 2 309.438 4.297 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@H](c3cc4ccccc4[nH]3)C2)no1 ZINC000618750941 1053362615 /nfs/dbraw/zinc/36/26/15/1053362615.db2.gz YDNSTIOEBDQQKE-HNNXBMFYSA-N 1 2 324.428 4.054 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@H](c3cc4ccccc4[nH]3)C2)no1 ZINC000618750941 1053362626 /nfs/dbraw/zinc/36/26/26/1053362626.db2.gz YDNSTIOEBDQQKE-HNNXBMFYSA-N 1 2 324.428 4.054 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCCCOC(C)C ZINC001320814644 1053364196 /nfs/dbraw/zinc/36/41/96/1053364196.db2.gz BDTWFUUZXUIREY-UHFFFAOYSA-N 1 2 304.459 4.229 20 0 DIADLO Clc1ccc(CSCc2ccc(-n3cc[nH+]c3)cc2)cn1 ZINC001321022548 1053382916 /nfs/dbraw/zinc/38/29/16/1053382916.db2.gz CSNRNJJCWDCLNV-UHFFFAOYSA-N 1 2 315.829 4.354 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2CCO[C@](C)(c3ccccc3)C2)s1 ZINC000093341742 1053390959 /nfs/dbraw/zinc/39/09/59/1053390959.db2.gz DWEQVYJMVCKNEX-SFHVURJKSA-N 1 2 316.470 4.014 20 0 DIADLO CC(C)c1ncc(C[N@H+]2CCO[C@](C)(c3ccccc3)C2)s1 ZINC000093341742 1053390973 /nfs/dbraw/zinc/39/09/73/1053390973.db2.gz DWEQVYJMVCKNEX-SFHVURJKSA-N 1 2 316.470 4.014 20 0 DIADLO CCCCC[C@H](NC(=O)[C@H](C)Cc1c[nH]c[nH+]1)c1ccccc1 ZINC000847434027 1053399194 /nfs/dbraw/zinc/39/91/94/1053399194.db2.gz RIEIVSZPOOZFEF-QAPCUYQASA-N 1 2 313.445 4.026 20 0 DIADLO CCCCC[C@H](NC(=O)[C@H](C)Cc1c[nH+]c[nH]1)c1ccccc1 ZINC000847434027 1053399199 /nfs/dbraw/zinc/39/91/99/1053399199.db2.gz RIEIVSZPOOZFEF-QAPCUYQASA-N 1 2 313.445 4.026 20 0 DIADLO CCCCC[C@H](NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1)c1ccccc1 ZINC000847434028 1053399249 /nfs/dbraw/zinc/39/92/49/1053399249.db2.gz RIEIVSZPOOZFEF-YJBOKZPZSA-N 1 2 313.445 4.026 20 0 DIADLO CCCCC[C@H](NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1)c1ccccc1 ZINC000847434028 1053399268 /nfs/dbraw/zinc/39/92/68/1053399268.db2.gz RIEIVSZPOOZFEF-YJBOKZPZSA-N 1 2 313.445 4.026 20 0 DIADLO CCC[C@H]([NH2+]Cc1c[nH]c(-c2ccccc2)n1)c1ccccn1 ZINC001200135047 1053407982 /nfs/dbraw/zinc/40/79/82/1053407982.db2.gz FUYTZPIECUGLGA-KRWDZBQOSA-N 1 2 306.413 4.103 20 0 DIADLO CCN(Cc1ccccc1Cl)C(=O)c1c(C)cc(C)[nH+]c1C ZINC001352844189 1053416937 /nfs/dbraw/zinc/41/69/37/1053416937.db2.gz IZOCBRREKFEMOX-UHFFFAOYSA-N 1 2 316.832 4.323 20 0 DIADLO Cc1ncsc1C[N@@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000093530111 1053421948 /nfs/dbraw/zinc/42/19/48/1053421948.db2.gz KUNYPPLWUFQZAN-CQSZACIVSA-N 1 2 324.902 4.395 20 0 DIADLO Cc1ncsc1C[N@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000093530111 1053421958 /nfs/dbraw/zinc/42/19/58/1053421958.db2.gz KUNYPPLWUFQZAN-CQSZACIVSA-N 1 2 324.902 4.395 20 0 DIADLO c1csc(-c2ncc(C[N@@H+]3CCOC4(CCCC4)C3)s2)c1 ZINC000093589143 1053426272 /nfs/dbraw/zinc/42/62/72/1053426272.db2.gz CARQDKHCGWIMID-UHFFFAOYSA-N 1 2 320.483 4.017 20 0 DIADLO c1csc(-c2ncc(C[N@H+]3CCOC4(CCCC4)C3)s2)c1 ZINC000093589143 1053426279 /nfs/dbraw/zinc/42/62/79/1053426279.db2.gz CARQDKHCGWIMID-UHFFFAOYSA-N 1 2 320.483 4.017 20 0 DIADLO C[C@@H](Oc1ccc(-n2cc[nH+]c2)cc1)c1c(F)cccc1F ZINC001229950138 1053438680 /nfs/dbraw/zinc/43/86/80/1053438680.db2.gz HXJUFLIXKLRPDB-GFCCVEGCSA-N 1 2 300.308 4.291 20 0 DIADLO Cc1cccc(OC[C@@H](C)Oc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001229954464 1053438764 /nfs/dbraw/zinc/43/87/64/1053438764.db2.gz PGEJVHOIMLGNRP-MRXNPFEDSA-N 1 2 308.381 4.027 20 0 DIADLO C[C@@H]1CC[C@H](Nc2[nH+]cnc3c2cnn3-c2ccccc2)C[C@@H]1C ZINC000325669974 1053516953 /nfs/dbraw/zinc/51/69/53/1053516953.db2.gz LVDNQOJDKVEELC-ILXRZTDVSA-N 1 2 321.428 4.052 20 0 DIADLO CCc1cccc2c1OCC[C@H]2[NH2+]Cc1csc(C(C)C)n1 ZINC001200280668 1053518563 /nfs/dbraw/zinc/51/85/63/1053518563.db2.gz DCHFNYYFSBTIRW-MRXNPFEDSA-N 1 2 316.470 4.442 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc3c(c2)OCCO3)ccc1[NH+](C)C ZINC000182851753 1053531997 /nfs/dbraw/zinc/53/19/97/1053531997.db2.gz AFPKFFRBKRFCOM-AWEZNQCLSA-N 1 2 312.413 4.005 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H]2CCCc3cn(C(C)C)nc32)oc1C ZINC001322653522 1053532899 /nfs/dbraw/zinc/53/28/99/1053532899.db2.gz WBJKYBAZRFFFDA-BBRMVZONSA-N 1 2 301.434 4.402 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+](CC)Cc2cccc(F)c2)n1 ZINC000152829858 1053534156 /nfs/dbraw/zinc/53/41/56/1053534156.db2.gz QOUGVGSXLBHXNE-CYBMUJFWSA-N 1 2 305.397 4.134 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+](CC)Cc2cccc(F)c2)n1 ZINC000152829858 1053534166 /nfs/dbraw/zinc/53/41/66/1053534166.db2.gz QOUGVGSXLBHXNE-CYBMUJFWSA-N 1 2 305.397 4.134 20 0 DIADLO CCCC[C@H](CC)CNc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC000325972328 1053567857 /nfs/dbraw/zinc/56/78/57/1053567857.db2.gz WKTRBLGFQXMKDD-HNNXBMFYSA-N 1 2 323.444 4.444 20 0 DIADLO CC(C)c1nc(C[NH+]2CCC3(CC2)C(F)(F)C3(F)F)cs1 ZINC000649711115 1053568617 /nfs/dbraw/zinc/56/86/17/1053568617.db2.gz WYJHTPOHYVXGFQ-UHFFFAOYSA-N 1 2 322.371 4.133 20 0 DIADLO CC(C)c1ocnc1C[N@@H+]1[C@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC001323368233 1053577780 /nfs/dbraw/zinc/57/77/80/1053577780.db2.gz SXILZKAUHWSDLM-OLZOCXBDSA-N 1 2 302.393 4.445 20 0 DIADLO CC(C)c1ocnc1C[N@H+]1[C@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC001323368233 1053577787 /nfs/dbraw/zinc/57/77/87/1053577787.db2.gz SXILZKAUHWSDLM-OLZOCXBDSA-N 1 2 302.393 4.445 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2ccc3ccccc3n2)c1 ZINC001323506622 1053586677 /nfs/dbraw/zinc/58/66/77/1053586677.db2.gz YQZUICDFWYJOMS-UHFFFAOYSA-N 1 2 310.422 4.380 20 0 DIADLO Cc1ccc(C[N@H+](CC(=O)c2c(C)[nH]c3ccccc32)C2CC2)o1 ZINC000620109048 1053606316 /nfs/dbraw/zinc/60/63/16/1053606316.db2.gz USBXQFVBXUODBC-UHFFFAOYSA-N 1 2 322.408 4.225 20 0 DIADLO Cc1ccc(C[N@@H+](CC(=O)c2c(C)[nH]c3ccccc32)C2CC2)o1 ZINC000620109048 1053606326 /nfs/dbraw/zinc/60/63/26/1053606326.db2.gz USBXQFVBXUODBC-UHFFFAOYSA-N 1 2 322.408 4.225 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000620128043 1053610063 /nfs/dbraw/zinc/61/00/63/1053610063.db2.gz UKPRFAGVYHSDBM-PJIJBLCYSA-N 1 2 317.379 4.488 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000620128043 1053610070 /nfs/dbraw/zinc/61/00/70/1053610070.db2.gz UKPRFAGVYHSDBM-PJIJBLCYSA-N 1 2 317.379 4.488 20 0 DIADLO COc1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c(F)c1 ZINC000404601979 1053614035 /nfs/dbraw/zinc/61/40/35/1053614035.db2.gz YEAUBHWFDBIIJN-LJQANCHMSA-N 1 2 311.356 4.307 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1cc(C)c3ccccc3[nH+]1)CCO2 ZINC001323984364 1053615931 /nfs/dbraw/zinc/61/59/31/1053615931.db2.gz DDPZUVCRJFOCBR-SFHVURJKSA-N 1 2 320.392 4.488 20 0 DIADLO Cc1cc(C(=O)Nc2cccc(-c3[nH]c(C)c(C)[nH+]3)c2)oc1C ZINC001324026858 1053617208 /nfs/dbraw/zinc/61/72/08/1053617208.db2.gz LONRTXZWWWEBBJ-UHFFFAOYSA-N 1 2 309.369 4.156 20 0 DIADLO Oc1cc2c(cc1O[C@H]1CCc3ccc(Cl)cc31)CC[NH+]=C2 ZINC001230921615 1053625627 /nfs/dbraw/zinc/62/56/27/1053625627.db2.gz PIFZHQUGUKYUEW-KRWDZBQOSA-N 1 2 313.784 4.087 20 0 DIADLO Cc1cc(C)cc([C@H](C)[NH2+]Cc2nnc(C(F)(F)F)s2)c1 ZINC000660198043 1053627279 /nfs/dbraw/zinc/62/72/79/1053627279.db2.gz SIPJDWZACYMSOT-JTQLQIEISA-N 1 2 315.364 4.025 20 0 DIADLO Cc1ccc(NC(=O)C[C@H]2CCCCC2(C)C)c(N(C)C)[nH+]1 ZINC001435645452 1053628360 /nfs/dbraw/zinc/62/83/60/1053628360.db2.gz RJHAKWJFLOGNQN-CQSZACIVSA-N 1 2 303.450 4.001 20 0 DIADLO CC[N@H+](CC(=O)c1c[nH]c2ccccc12)Cc1ccccc1F ZINC001324155507 1053630123 /nfs/dbraw/zinc/63/01/23/1053630123.db2.gz HKMIBDAPZNLWNN-UHFFFAOYSA-N 1 2 310.372 4.012 20 0 DIADLO CC[N@@H+](CC(=O)c1c[nH]c2ccccc12)Cc1ccccc1F ZINC001324155507 1053630130 /nfs/dbraw/zinc/63/01/30/1053630130.db2.gz HKMIBDAPZNLWNN-UHFFFAOYSA-N 1 2 310.372 4.012 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCCN(c2cc(C)c3ccccc3[nH+]2)C1 ZINC001324272016 1053639402 /nfs/dbraw/zinc/63/94/02/1053639402.db2.gz HHJJNTYTANEPKX-INIZCTEOSA-N 1 2 324.346 4.091 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)c2ccc(Cl)s2)c(C)[nH+]1 ZINC001435680342 1053640741 /nfs/dbraw/zinc/64/07/41/1053640741.db2.gz PRNIMMNPWNOVOG-SNVBAGLBSA-N 1 2 308.834 4.213 20 0 DIADLO Cl/C=C(\Cl)C[N@@H+]1CCC[C@@H](c2nc3ccccc3[nH]2)C1 ZINC001324297175 1053641979 /nfs/dbraw/zinc/64/19/79/1053641979.db2.gz IBLSTUOCHNUBIC-HQQGHWSLSA-N 1 2 310.228 4.061 20 0 DIADLO Cl/C=C(\Cl)C[N@H+]1CCC[C@@H](c2nc3ccccc3[nH]2)C1 ZINC001324297175 1053641983 /nfs/dbraw/zinc/64/19/83/1053641983.db2.gz IBLSTUOCHNUBIC-HQQGHWSLSA-N 1 2 310.228 4.061 20 0 DIADLO CCc1ccc(Cl)c(CC)c1NC(=O)CCCn1cc[nH+]c1 ZINC000620409697 1053658125 /nfs/dbraw/zinc/65/81/25/1053658125.db2.gz LQIUUDJCBHWGEO-UHFFFAOYSA-N 1 2 319.836 4.080 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Nc1ccc(Oc2ccccc2)cc1 ZINC000620409299 1053660101 /nfs/dbraw/zinc/66/01/01/1053660101.db2.gz LKMZSKLGZVTART-UHFFFAOYSA-N 1 2 321.380 4.094 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)c(C)o1 ZINC000660200266 1053665271 /nfs/dbraw/zinc/66/52/71/1053665271.db2.gz HFXYNGFUQVUCLK-MRXNPFEDSA-N 1 2 308.372 4.447 20 0 DIADLO Cc1cc(NC(=O)[C@H](C)c2cccc(CC(C)C)c2)c(C)c[nH+]1 ZINC001435756415 1053665871 /nfs/dbraw/zinc/66/58/71/1053665871.db2.gz CVGLAUCBRCBTFG-MRXNPFEDSA-N 1 2 310.441 4.061 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[NH+]1CCN(Cc2ccco2)CC1 ZINC000620480823 1053667889 /nfs/dbraw/zinc/66/78/89/1053667889.db2.gz ICIXJKLQMZXXNH-GOSISDBHSA-N 1 2 318.848 4.202 20 0 DIADLO Fc1cc2c(c(F)c1)CC[C@H]2Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231080331 1053668477 /nfs/dbraw/zinc/66/84/77/1053668477.db2.gz BWXZIAVAYDVECD-QGZVFWFLSA-N 1 2 312.319 4.421 20 0 DIADLO C[C@H](Oc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(F)c(F)c1 ZINC001231081420 1053669266 /nfs/dbraw/zinc/66/92/66/1053669266.db2.gz KYNLLSFZUWBZML-NSHDSACASA-N 1 2 300.308 4.495 20 0 DIADLO Cc1ccc2c(c1)CC[C@H]2Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231078373 1053669344 /nfs/dbraw/zinc/66/93/44/1053669344.db2.gz BJPNRXKQWVWBKU-HXUWFJFHSA-N 1 2 304.393 4.462 20 0 DIADLO c1c[nH+]c(-c2ccc(O[C@H]3CCCN(c4ccccc4)C3)cc2)[nH]1 ZINC001231082071 1053671274 /nfs/dbraw/zinc/67/12/74/1053671274.db2.gz QYHUBXVIIVSVOR-IBGZPJMESA-N 1 2 319.408 4.125 20 0 DIADLO CCCC(=O)[C@H](CCC)Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231082679 1053671330 /nfs/dbraw/zinc/67/13/30/1053671330.db2.gz QOVICFNDRXZTBU-SFHVURJKSA-N 1 2 300.402 4.004 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(O[C@@H](c2cccnc2)C2CC2)cc1 ZINC001231083020 1053671473 /nfs/dbraw/zinc/67/14/73/1053671473.db2.gz AJEABEYWFJWKRH-LJQANCHMSA-N 1 2 305.381 4.012 20 0 DIADLO COc1ccc([C@@H](C)Oc2ccc(-c3c[nH+]cn3C)cc2)cc1 ZINC001231082315 1053671489 /nfs/dbraw/zinc/67/14/89/1053671489.db2.gz PBKGHWQPZVCKML-CQSZACIVSA-N 1 2 308.381 4.236 20 0 DIADLO COc1ccccc1[C@@H](C)Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231082116 1053671837 /nfs/dbraw/zinc/67/18/37/1053671837.db2.gz NOWUAXYSWXLHFY-CQSZACIVSA-N 1 2 308.381 4.236 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)c2cc(Cl)ccc2F)c(C)[nH+]1 ZINC001435799670 1053685715 /nfs/dbraw/zinc/68/57/15/1053685715.db2.gz QFJWQGGRDFTIJF-LLVKDONJSA-N 1 2 320.795 4.290 20 0 DIADLO CCN(Cc1c[nH]c2ccccc12)C(=O)c1c(C)cc(C)[nH+]c1C ZINC001435909771 1053721746 /nfs/dbraw/zinc/72/17/46/1053721746.db2.gz MSJXHOHQJOKRCB-UHFFFAOYSA-N 1 2 321.424 4.150 20 0 DIADLO C[C@H](c1ccccc1Br)[N@H+](C)Cc1ccc(F)nc1 ZINC000189296159 1053728903 /nfs/dbraw/zinc/72/89/03/1053728903.db2.gz SZCOUOOJYZARND-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1ccccc1Br)[N@@H+](C)Cc1ccc(F)nc1 ZINC000189296159 1053728917 /nfs/dbraw/zinc/72/89/17/1053728917.db2.gz SZCOUOOJYZARND-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO Cc1coc(C(=O)Nc2cccc(-c3[nH]c(C)c(C)[nH+]3)c2)c1C ZINC001325859071 1053738769 /nfs/dbraw/zinc/73/87/69/1053738769.db2.gz AICYRSFIIFKEDK-UHFFFAOYSA-N 1 2 309.369 4.156 20 0 DIADLO FC(F)c1cccc(CNc2cc(N3CCCCC3)nc[nH+]2)c1 ZINC001325946148 1053744040 /nfs/dbraw/zinc/74/40/40/1053744040.db2.gz FYBBOUZJFRBOQF-UHFFFAOYSA-N 1 2 318.371 4.017 20 0 DIADLO FC(F)c1cccc(CNc2cc(N3CCCCC3)[nH+]cn2)c1 ZINC001325946148 1053744048 /nfs/dbraw/zinc/74/40/48/1053744048.db2.gz FYBBOUZJFRBOQF-UHFFFAOYSA-N 1 2 318.371 4.017 20 0 DIADLO F[C@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccc(Br)c(Cl)c1 ZINC001231439510 1053754989 /nfs/dbraw/zinc/75/49/89/1053754989.db2.gz WEEPJJWGEYFMRD-KWBADKCTSA-N 1 2 318.617 4.035 20 0 DIADLO F[C@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccc(Br)c(Cl)c1 ZINC001231439510 1053755000 /nfs/dbraw/zinc/75/50/00/1053755000.db2.gz WEEPJJWGEYFMRD-KWBADKCTSA-N 1 2 318.617 4.035 20 0 DIADLO CN(C)c1ccc2cc(C[N@@H+]3CCC(F)(F)[C@@H](F)C3)ccc2c1 ZINC001231440041 1053755130 /nfs/dbraw/zinc/75/51/30/1053755130.db2.gz VASXJEIUJLSKQF-KRWDZBQOSA-N 1 2 322.374 4.085 20 0 DIADLO CN(C)c1ccc2cc(C[N@H+]3CCC(F)(F)[C@@H](F)C3)ccc2c1 ZINC001231440041 1053755138 /nfs/dbraw/zinc/75/51/38/1053755138.db2.gz VASXJEIUJLSKQF-KRWDZBQOSA-N 1 2 322.374 4.085 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)C[C@]1(C)O ZINC001231480410 1053760870 /nfs/dbraw/zinc/76/08/70/1053760870.db2.gz UAKLPKAOMDGZIQ-OTYXRUKQSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)C[C@]1(C)O ZINC001231480410 1053760879 /nfs/dbraw/zinc/76/08/79/1053760879.db2.gz UAKLPKAOMDGZIQ-OTYXRUKQSA-N 1 2 322.663 4.240 20 0 DIADLO CC1(C)CCC(=CC(=O)Nc2cccc(-n3cc[nH+]c3)c2)CC1 ZINC001354088803 1053761585 /nfs/dbraw/zinc/76/15/85/1053761585.db2.gz GWMBFKUSDKEBLN-UHFFFAOYSA-N 1 2 309.413 4.337 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@H]1[C@@H]2CCCCCC[C@@H]21 ZINC001354094990 1053763765 /nfs/dbraw/zinc/76/37/65/1053763765.db2.gz APSYFJCKWIOWRT-PIIMJCKOSA-N 1 2 309.413 4.027 20 0 DIADLO CC[N@H+](Cc1c[nH]c2cccnc12)Cc1c(F)cccc1Cl ZINC001231492804 1053769607 /nfs/dbraw/zinc/76/96/07/1053769607.db2.gz PFGGZHFXZUVGQU-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO CC[N@@H+](Cc1c[nH]c2cccnc12)Cc1c(F)cccc1Cl ZINC001231492804 1053769611 /nfs/dbraw/zinc/76/96/11/1053769611.db2.gz PFGGZHFXZUVGQU-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCc3ccc(Cl)cc3C2)cn1 ZINC001231532154 1053780840 /nfs/dbraw/zinc/78/08/40/1053780840.db2.gz QXWVSUQAOLZQOD-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCc3ccc(Cl)cc3C2)cn1 ZINC001231532154 1053780855 /nfs/dbraw/zinc/78/08/55/1053780855.db2.gz QXWVSUQAOLZQOD-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2cc(Br)c[nH]2)c1 ZINC001231577472 1053789416 /nfs/dbraw/zinc/78/94/16/1053789416.db2.gz WBLWRSAMIIYKEN-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2cc(Br)c[nH]2)c1 ZINC001231577472 1053789425 /nfs/dbraw/zinc/78/94/25/1053789425.db2.gz WBLWRSAMIIYKEN-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO Cc1ccc(-c2ccc(C[N@@H+]3CCC(F)(F)[C@@H](F)C3)cc2)o1 ZINC001231596468 1053796454 /nfs/dbraw/zinc/79/64/54/1053796454.db2.gz VMEZTYHJDCJENT-INIZCTEOSA-N 1 2 309.331 4.434 20 0 DIADLO Cc1ccc(-c2ccc(C[N@H+]3CCC(F)(F)[C@@H](F)C3)cc2)o1 ZINC001231596468 1053796466 /nfs/dbraw/zinc/79/64/66/1053796466.db2.gz VMEZTYHJDCJENT-INIZCTEOSA-N 1 2 309.331 4.434 20 0 DIADLO Cc1ccc(-c2ccc(C[N@@H+]3Cc4cnc(C)cc4C3)cc2)o1 ZINC001231598625 1053798286 /nfs/dbraw/zinc/79/82/86/1053798286.db2.gz ZSCMOGVTIZTUML-UHFFFAOYSA-N 1 2 304.393 4.474 20 0 DIADLO Cc1ccc(-c2ccc(C[N@H+]3Cc4cnc(C)cc4C3)cc2)o1 ZINC001231598625 1053798300 /nfs/dbraw/zinc/79/83/00/1053798300.db2.gz ZSCMOGVTIZTUML-UHFFFAOYSA-N 1 2 304.393 4.474 20 0 DIADLO FC(F)c1cccc(C[NH2+]Cc2ncc(C(F)(F)F)s2)c1 ZINC001326724352 1053799049 /nfs/dbraw/zinc/79/90/49/1053799049.db2.gz HLOIGLXYBVSFSA-UHFFFAOYSA-N 1 2 322.302 4.389 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1ccc(F)cc1Cl)c1ccc(C)o1 ZINC000156411267 1053808656 /nfs/dbraw/zinc/80/86/56/1053808656.db2.gz GUSWMXHDXKZIIO-ABAIWWIYSA-N 1 2 311.784 4.419 20 0 DIADLO CCc1ccc(C[N@H+](Cc2ccccc2)Cc2ccccn2)nc1 ZINC001231638087 1053811961 /nfs/dbraw/zinc/81/19/61/1053811961.db2.gz UHWKUHYFEPRCCV-UHFFFAOYSA-N 1 2 317.436 4.241 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)nc1 ZINC001231638087 1053811987 /nfs/dbraw/zinc/81/19/87/1053811987.db2.gz UHWKUHYFEPRCCV-UHFFFAOYSA-N 1 2 317.436 4.241 20 0 DIADLO CCc1ccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)nc1 ZINC001231642749 1053814014 /nfs/dbraw/zinc/81/40/14/1053814014.db2.gz PHZNOGRXVWMEKJ-QGZVFWFLSA-N 1 2 302.368 4.259 20 0 DIADLO CCc1ccc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)nc1 ZINC001231642749 1053814036 /nfs/dbraw/zinc/81/40/36/1053814036.db2.gz PHZNOGRXVWMEKJ-QGZVFWFLSA-N 1 2 302.368 4.259 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1ccccc1Br)c1ccco1 ZINC000156585723 1053815982 /nfs/dbraw/zinc/81/59/82/1053815982.db2.gz BXXVVRQDJHQTKG-RISCZKNCSA-N 1 2 324.218 4.080 20 0 DIADLO CC1(CCC(=O)Oc2ccc(-c3[nH+]cc4n3CCCC4)cc2)CC1 ZINC001436230286 1053817000 /nfs/dbraw/zinc/81/70/00/1053817000.db2.gz ZJKYDKIWHODDQT-UHFFFAOYSA-N 1 2 324.424 4.372 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2nc(-c3ccccc3)c[nH]2)CCC1 ZINC001326985292 1053818156 /nfs/dbraw/zinc/81/81/56/1053818156.db2.gz SMQGOXWOGWRXLL-UHFFFAOYSA-N 1 2 321.399 4.385 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)s1 ZINC000273255287 1053845213 /nfs/dbraw/zinc/84/52/13/1053845213.db2.gz YUJYLWHJXQUGJV-QMMMGPOBSA-N 1 2 316.257 4.258 20 0 DIADLO COCc1ccc(C[N@H+](Cc2ccccc2)Cc2ccccn2)o1 ZINC001231691137 1053835074 /nfs/dbraw/zinc/83/50/74/1053835074.db2.gz CBYWBNJLGAJJAK-UHFFFAOYSA-N 1 2 322.408 4.023 20 0 DIADLO COCc1ccc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)o1 ZINC001231691137 1053835084 /nfs/dbraw/zinc/83/50/84/1053835084.db2.gz CBYWBNJLGAJJAK-UHFFFAOYSA-N 1 2 322.408 4.023 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCc3cnccc3C2)cc1Cl ZINC001231714803 1053836960 /nfs/dbraw/zinc/83/69/60/1053836960.db2.gz OQLWZILYRNBPDU-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCc3cnccc3C2)cc1Cl ZINC001231714803 1053836981 /nfs/dbraw/zinc/83/69/81/1053836981.db2.gz OQLWZILYRNBPDU-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)Cc2cccs2)c(OC)c1 ZINC001231697189 1053837621 /nfs/dbraw/zinc/83/76/21/1053837621.db2.gz QAUFGZNLWDLAJS-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)Cc2cccs2)c(OC)c1 ZINC001231697189 1053837639 /nfs/dbraw/zinc/83/76/39/1053837639.db2.gz QAUFGZNLWDLAJS-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2oc3ccccc3c2CC)s1 ZINC000273359570 1053845872 /nfs/dbraw/zinc/84/58/72/1053845872.db2.gz CHKHKUBQOZXPFL-LLVKDONJSA-N 1 2 315.442 4.260 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2oc3ccccc3c2C)s1 ZINC000273403578 1053848842 /nfs/dbraw/zinc/84/88/42/1053848842.db2.gz MUDCITZVKRLNIF-LLVKDONJSA-N 1 2 301.415 4.006 20 0 DIADLO CC[C@@H]1CCC[N@@H+]1Cc1cc(Cl)c(O)c(Br)c1 ZINC001231747169 1053850309 /nfs/dbraw/zinc/85/03/09/1053850309.db2.gz KFRDIQZFQNYGFX-SNVBAGLBSA-N 1 2 318.642 4.183 20 0 DIADLO CC[C@@H]1CCC[N@H+]1Cc1cc(Cl)c(O)c(Br)c1 ZINC001231747169 1053850317 /nfs/dbraw/zinc/85/03/17/1053850317.db2.gz KFRDIQZFQNYGFX-SNVBAGLBSA-N 1 2 318.642 4.183 20 0 DIADLO CCOc1ncccc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001231766153 1053852401 /nfs/dbraw/zinc/85/24/01/1053852401.db2.gz VWCXSQQBXWLSSC-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ncccc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001231766153 1053852416 /nfs/dbraw/zinc/85/24/16/1053852416.db2.gz VWCXSQQBXWLSSC-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ncccc1C[N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001231767340 1053854960 /nfs/dbraw/zinc/85/49/60/1053854960.db2.gz SMUFLPIYKRHRHN-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ncccc1C[N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001231767340 1053854971 /nfs/dbraw/zinc/85/49/71/1053854971.db2.gz SMUFLPIYKRHRHN-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO C[C@H]([NH2+]Cc1cn2ccccc2n1)c1cccc(Cl)c1Cl ZINC001200653565 1053855432 /nfs/dbraw/zinc/85/54/32/1053855432.db2.gz CQVKGCOURALCSH-NSHDSACASA-N 1 2 320.223 4.492 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCCC[C@H]1C(=O)OC(C)(C)C ZINC001231785457 1053857058 /nfs/dbraw/zinc/85/70/58/1053857058.db2.gz OVQIHIIDGIJITC-HNNXBMFYSA-N 1 2 321.486 4.105 20 0 DIADLO CSc1ccccc1C[N@H+]1CCCC[C@H]1C(=O)OC(C)(C)C ZINC001231785457 1053857074 /nfs/dbraw/zinc/85/70/74/1053857074.db2.gz OVQIHIIDGIJITC-HNNXBMFYSA-N 1 2 321.486 4.105 20 0 DIADLO Cc1c(F)cccc1C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC001436382126 1053858670 /nfs/dbraw/zinc/85/86/70/1053858670.db2.gz LPLVBOPOHVNARW-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO CN(C)c1[nH+]ccc2cc(NC(=O)c3ccc(CF)cc3)ccc21 ZINC001436381589 1053859605 /nfs/dbraw/zinc/85/96/05/1053859605.db2.gz ITQOURLIWWEZAF-UHFFFAOYSA-N 1 2 323.371 4.023 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(OCC(C)C)cc2)s1 ZINC000274175416 1053860079 /nfs/dbraw/zinc/86/00/79/1053860079.db2.gz IBNGKYIDNBBAPH-CHWSQXEVSA-N 1 2 319.474 4.293 20 0 DIADLO c1cc(-c2ccccc2)oc1C[N@@H+]1CCC[C@H]1c1ncccn1 ZINC001231815515 1053877606 /nfs/dbraw/zinc/87/76/06/1053877606.db2.gz OGBXHUUPCOQWKK-KRWDZBQOSA-N 1 2 305.381 4.074 20 0 DIADLO c1cc(-c2ccccc2)oc1C[N@H+]1CCC[C@H]1c1ncccn1 ZINC001231815515 1053877621 /nfs/dbraw/zinc/87/76/21/1053877621.db2.gz OGBXHUUPCOQWKK-KRWDZBQOSA-N 1 2 305.381 4.074 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1coc(C(C)(C)C)n1 ZINC001354498615 1053883974 /nfs/dbraw/zinc/88/39/74/1053883974.db2.gz HQPPIFHWVSVMDH-WDEREUQCSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1coc(C(C)(C)C)n1 ZINC001354498615 1053883991 /nfs/dbraw/zinc/88/39/91/1053883991.db2.gz HQPPIFHWVSVMDH-WDEREUQCSA-N 1 2 304.356 4.135 20 0 DIADLO Cc1csc2sc(C[N@H+]3CCc4oc(C)nc4C3)c(C)c12 ZINC001231831503 1053885127 /nfs/dbraw/zinc/88/51/27/1053885127.db2.gz ONMJWYGULRDRRU-UHFFFAOYSA-N 1 2 318.467 4.434 20 0 DIADLO Cc1csc2sc(C[N@@H+]3CCc4oc(C)nc4C3)c(C)c12 ZINC001231831503 1053885150 /nfs/dbraw/zinc/88/51/50/1053885150.db2.gz ONMJWYGULRDRRU-UHFFFAOYSA-N 1 2 318.467 4.434 20 0 DIADLO CCOC(=O)C[N@H+](Cc1sc2scc(C)c2c1C)C1CC1 ZINC001231833554 1053885479 /nfs/dbraw/zinc/88/54/79/1053885479.db2.gz ZIJCCXROMXSRMV-UHFFFAOYSA-N 1 2 323.483 4.107 20 0 DIADLO CCOC(=O)C[N@@H+](Cc1sc2scc(C)c2c1C)C1CC1 ZINC001231833554 1053885499 /nfs/dbraw/zinc/88/54/99/1053885499.db2.gz ZIJCCXROMXSRMV-UHFFFAOYSA-N 1 2 323.483 4.107 20 0 DIADLO C[NH+](C)c1ccc(N[C@H](c2ccccc2)c2ccc(F)cn2)cc1 ZINC000183988612 1053897881 /nfs/dbraw/zinc/89/78/81/1053897881.db2.gz QTMFOSZORXGGPH-HXUWFJFHSA-N 1 2 321.399 4.488 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001354541726 1053901867 /nfs/dbraw/zinc/90/18/67/1053901867.db2.gz LBSRAVRJMJEQEO-UHFFFAOYSA-N 1 2 323.396 4.324 20 0 DIADLO Cc1nc2ccccn2c1C[N@@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000158528616 1053905652 /nfs/dbraw/zinc/90/56/52/1053905652.db2.gz CMBSURWQOCTAQM-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1nc2ccccn2c1C[N@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000158528616 1053905668 /nfs/dbraw/zinc/90/56/68/1053905668.db2.gz CMBSURWQOCTAQM-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO C/C(=C\c1ccc(Cl)cc1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001436593611 1053914602 /nfs/dbraw/zinc/91/46/02/1053914602.db2.gz DURMHHMWTKNHJB-ZRDIBKRKSA-N 1 2 311.772 4.030 20 0 DIADLO Cc1nc(N[C@H](C)c2ccc3c(c2)CCC3)c2c([nH+]1)CCCC2 ZINC001472747986 1053921344 /nfs/dbraw/zinc/92/13/44/1053921344.db2.gz KNAAIESANNIAPV-CYBMUJFWSA-N 1 2 307.441 4.326 20 0 DIADLO FC(F)(F)c1cccnc1C[N@@H+]1CCSc2ccccc2C1 ZINC001231965337 1053922310 /nfs/dbraw/zinc/92/23/10/1053922310.db2.gz UNXILSGOFPHLDI-UHFFFAOYSA-N 1 2 324.371 4.208 20 0 DIADLO FC(F)(F)c1cccnc1C[N@H+]1CCSc2ccccc2C1 ZINC001231965337 1053922319 /nfs/dbraw/zinc/92/23/19/1053922319.db2.gz UNXILSGOFPHLDI-UHFFFAOYSA-N 1 2 324.371 4.208 20 0 DIADLO CCC[C@H]1CCCC[N@@H+]1Cc1ncc(Br)cc1F ZINC001231988057 1053931155 /nfs/dbraw/zinc/93/11/55/1053931155.db2.gz LVHUOZCCVHNAKC-LBPRGKRZSA-N 1 2 315.230 4.138 20 0 DIADLO CCC[C@H]1CCCC[N@H+]1Cc1ncc(Br)cc1F ZINC001231988057 1053931170 /nfs/dbraw/zinc/93/11/70/1053931170.db2.gz LVHUOZCCVHNAKC-LBPRGKRZSA-N 1 2 315.230 4.138 20 0 DIADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)cc(C)n1 ZINC001231995213 1053933906 /nfs/dbraw/zinc/93/39/06/1053933906.db2.gz IZFBXXYVVWDZMI-OAQYLSRUSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1cc(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)cc(C)n1 ZINC001231995213 1053933924 /nfs/dbraw/zinc/93/39/24/1053933924.db2.gz IZFBXXYVVWDZMI-OAQYLSRUSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1cc(C(F)(F)F)ccc1C[N@@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001232002403 1053937159 /nfs/dbraw/zinc/93/71/59/1053937159.db2.gz UOTXHYCQNPHYSX-LBPRGKRZSA-N 1 2 311.269 4.193 20 0 DIADLO Cc1cc(C(F)(F)F)ccc1C[N@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001232002403 1053937166 /nfs/dbraw/zinc/93/71/66/1053937166.db2.gz UOTXHYCQNPHYSX-LBPRGKRZSA-N 1 2 311.269 4.193 20 0 DIADLO CCCC[N@H+](Cc1noc(CCC)n1)[C@H](C)c1ccccc1 ZINC000621301448 1053945066 /nfs/dbraw/zinc/94/50/66/1053945066.db2.gz ABQCXTZVUMLSLF-OAHLLOKOSA-N 1 2 301.434 4.385 20 0 DIADLO CCCC[N@@H+](Cc1noc(CCC)n1)[C@H](C)c1ccccc1 ZINC000621301448 1053945073 /nfs/dbraw/zinc/94/50/73/1053945073.db2.gz ABQCXTZVUMLSLF-OAHLLOKOSA-N 1 2 301.434 4.385 20 0 DIADLO CCC[N@H+](CC(=O)c1c[nH]c2ccccc12)Cc1ccccc1F ZINC000621296884 1053945939 /nfs/dbraw/zinc/94/59/39/1053945939.db2.gz PWSVSGITMVQKFT-UHFFFAOYSA-N 1 2 324.399 4.402 20 0 DIADLO CCC[N@@H+](CC(=O)c1c[nH]c2ccccc12)Cc1ccccc1F ZINC000621296884 1053945952 /nfs/dbraw/zinc/94/59/52/1053945952.db2.gz PWSVSGITMVQKFT-UHFFFAOYSA-N 1 2 324.399 4.402 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1nc(Cl)ccc1Br ZINC001232058970 1053950562 /nfs/dbraw/zinc/95/05/62/1053950562.db2.gz ZHIFGHWFLCFQKE-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1nc(Cl)ccc1Br ZINC001232058970 1053950572 /nfs/dbraw/zinc/95/05/72/1053950572.db2.gz ZHIFGHWFLCFQKE-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO Fc1cccc(F)c1[C@H]1CCC[N@@H+]1Cc1cc2ncccc2[nH]1 ZINC001232069347 1053951254 /nfs/dbraw/zinc/95/12/54/1053951254.db2.gz ZFRSMKGVUIWVGR-QGZVFWFLSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1cccc(F)c1[C@H]1CCC[N@H+]1Cc1cc2ncccc2[nH]1 ZINC001232069347 1053951268 /nfs/dbraw/zinc/95/12/68/1053951268.db2.gz ZFRSMKGVUIWVGR-QGZVFWFLSA-N 1 2 313.351 4.178 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(C(F)(F)F)n2)Cc2ccccc21 ZINC001232066573 1053951516 /nfs/dbraw/zinc/95/15/16/1053951516.db2.gz IYNZYQFOJQFCFO-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(C(F)(F)F)n2)Cc2ccccc21 ZINC001232066573 1053951528 /nfs/dbraw/zinc/95/15/28/1053951528.db2.gz IYNZYQFOJQFCFO-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO CCCC[N@H+](CC(=O)Nc1ccccc1)Cc1ccccc1F ZINC000621318571 1053957577 /nfs/dbraw/zinc/95/75/77/1053957577.db2.gz QDEBUZUZQXVNAR-UHFFFAOYSA-N 1 2 314.404 4.067 20 0 DIADLO CCCC[N@@H+](CC(=O)Nc1ccccc1)Cc1ccccc1F ZINC000621318571 1053957588 /nfs/dbraw/zinc/95/75/88/1053957588.db2.gz QDEBUZUZQXVNAR-UHFFFAOYSA-N 1 2 314.404 4.067 20 0 DIADLO CN(C)c1[nH+]cccc1/C=C/c1nc(-c2ccccc2)cs1 ZINC001328936787 1053958710 /nfs/dbraw/zinc/95/87/10/1053958710.db2.gz XSDWXGYGELRERH-ZHACJKMWSA-N 1 2 307.422 4.442 20 0 DIADLO Cc1cc(C)c(CNC(=O)C[C@@H]2C[C@@H](C)c3c2cccc3C)c[nH+]1 ZINC001436735487 1053959070 /nfs/dbraw/zinc/95/90/70/1053959070.db2.gz FEFAXYZHMVZWEG-WBVHZDCISA-N 1 2 322.452 4.304 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)NCc1c[nH+]c(C)cc1C ZINC001436736343 1053960933 /nfs/dbraw/zinc/96/09/33/1053960933.db2.gz IOKFQGWACKCRRW-QGZVFWFLSA-N 1 2 302.462 4.311 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CC[C@@H](F)C(F)(F)CC2)c(Cl)c1 ZINC001232096798 1053962788 /nfs/dbraw/zinc/96/27/88/1053962788.db2.gz HRBJKULZGUTXLS-GFCCVEGCSA-N 1 2 313.697 4.187 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c(Cl)c1 ZINC001232096798 1053962796 /nfs/dbraw/zinc/96/27/96/1053962796.db2.gz HRBJKULZGUTXLS-GFCCVEGCSA-N 1 2 313.697 4.187 20 0 DIADLO CC(C)C[N@H+](Cc1nc(C2CC2)no1)Cc1cccc(Cl)c1 ZINC000621388275 1053964689 /nfs/dbraw/zinc/96/46/89/1053964689.db2.gz WBSCBAZEHOAYNY-UHFFFAOYSA-N 1 2 319.836 4.259 20 0 DIADLO CC(C)C[N@@H+](Cc1nc(C2CC2)no1)Cc1cccc(Cl)c1 ZINC000621388275 1053964700 /nfs/dbraw/zinc/96/47/00/1053964700.db2.gz WBSCBAZEHOAYNY-UHFFFAOYSA-N 1 2 319.836 4.259 20 0 DIADLO Fc1cc(F)c(C[NH+]2CCC(c3cccnc3)CC2)c(Cl)c1 ZINC001232103021 1053965220 /nfs/dbraw/zinc/96/52/20/1053965220.db2.gz BIJIOJQSWDBQFJ-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Fc1ccc(Cl)nc1C[NH+]1CCC(c2ccccc2F)CC1 ZINC001232158676 1053975827 /nfs/dbraw/zinc/97/58/27/1053975827.db2.gz MMOQWSAURHGYCB-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1cn(C)nc1C1CC1 ZINC001232172692 1053977717 /nfs/dbraw/zinc/97/77/17/1053977717.db2.gz ZGDBRWMCUXCJMB-GFCCVEGCSA-N 1 2 303.837 4.144 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1cn(C)nc1C1CC1 ZINC001232172692 1053977726 /nfs/dbraw/zinc/97/77/26/1053977726.db2.gz ZGDBRWMCUXCJMB-GFCCVEGCSA-N 1 2 303.837 4.144 20 0 DIADLO CC[N@H+](Cc1ccccc1)Cc1ncc(C)cc1Br ZINC001232174113 1053979461 /nfs/dbraw/zinc/97/94/61/1053979461.db2.gz UXUCLCDIZKKUGV-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccccc1)Cc1ncc(C)cc1Br ZINC001232174113 1053979472 /nfs/dbraw/zinc/97/94/72/1053979472.db2.gz UXUCLCDIZKKUGV-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO F[C@@H]1C[NH+](Cc2ccccc2-c2ccc(Cl)cc2)C[C@H]1F ZINC001232194965 1053982557 /nfs/dbraw/zinc/98/25/57/1053982557.db2.gz LLCVBQJTAHTGOQ-IAGOWNOFSA-N 1 2 307.771 4.499 20 0 DIADLO Cc1ccc(Cl)c(O[C@@H]2CCC[N@H+](Cc3ccns3)C2)c1 ZINC001232192927 1053983997 /nfs/dbraw/zinc/98/39/97/1053983997.db2.gz GALBMQARZYLLKJ-CYBMUJFWSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1ccc(Cl)c(O[C@@H]2CCC[N@@H+](Cc3ccns3)C2)c1 ZINC001232192927 1053984006 /nfs/dbraw/zinc/98/40/06/1053984006.db2.gz GALBMQARZYLLKJ-CYBMUJFWSA-N 1 2 322.861 4.148 20 0 DIADLO CC[C@@]1(C)CC(=O)N(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)C1 ZINC001329441978 1053989653 /nfs/dbraw/zinc/98/96/53/1053989653.db2.gz CZZACRJQEYKXDC-AEFFLSMTSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@@]1(C)CC(=O)N(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)C1 ZINC001329441978 1053989660 /nfs/dbraw/zinc/98/96/60/1053989660.db2.gz CZZACRJQEYKXDC-AEFFLSMTSA-N 1 2 320.864 4.083 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1ccnc(C(C)(C)C)c1 ZINC001232213806 1053992043 /nfs/dbraw/zinc/99/20/43/1053992043.db2.gz FDVDUWYCEJITOO-UHFFFAOYSA-N 1 2 309.866 4.121 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1ccnc(C(C)(C)C)c1 ZINC001232213806 1053992055 /nfs/dbraw/zinc/99/20/55/1053992055.db2.gz FDVDUWYCEJITOO-UHFFFAOYSA-N 1 2 309.866 4.121 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CCC[C@@H]2c2nccs2)ccn1 ZINC001232217731 1053993207 /nfs/dbraw/zinc/99/32/07/1053993207.db2.gz OHBGYHFFTKOYCG-CQSZACIVSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CCC[C@@H]2c2nccs2)ccn1 ZINC001232217731 1053993216 /nfs/dbraw/zinc/99/32/16/1053993216.db2.gz OHBGYHFFTKOYCG-CQSZACIVSA-N 1 2 301.459 4.173 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cccn2Cc2ccccc2)no1 ZINC001232230857 1053999429 /nfs/dbraw/zinc/99/94/29/1053999429.db2.gz CAQCGDBJNIBXCE-FQEVSTJZSA-N 1 2 321.424 4.170 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cccn2Cc2ccccc2)no1 ZINC001232230857 1053999436 /nfs/dbraw/zinc/99/94/36/1053999436.db2.gz CAQCGDBJNIBXCE-FQEVSTJZSA-N 1 2 321.424 4.170 20 0 DIADLO C[N@H+](Cc1ccnc(C(F)(F)F)c1)Cc1ccccc1Cl ZINC001232240248 1054001939 /nfs/dbraw/zinc/00/19/39/1054001939.db2.gz WMQCZGPBBRLFHH-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccnc(C(F)(F)F)c1)Cc1ccccc1Cl ZINC001232240248 1054001944 /nfs/dbraw/zinc/00/19/44/1054001944.db2.gz WMQCZGPBBRLFHH-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO CCc1cnc(C[NH2+][C@H](c2ccc(F)cc2F)C2CC2)s1 ZINC001200819536 1054004690 /nfs/dbraw/zinc/00/46/90/1054004690.db2.gz BVWKWDOJLJLXPC-INIZCTEOSA-N 1 2 308.397 4.225 20 0 DIADLO COCc1cccc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)n1 ZINC001232259681 1054005732 /nfs/dbraw/zinc/00/57/32/1054005732.db2.gz HOJQUNMTKSVADR-ZDUSSCGKSA-N 1 2 304.821 4.074 20 0 DIADLO COCc1cccc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)n1 ZINC001232259681 1054005751 /nfs/dbraw/zinc/00/57/51/1054005751.db2.gz HOJQUNMTKSVADR-ZDUSSCGKSA-N 1 2 304.821 4.074 20 0 DIADLO Cc1cc(N2Cc3ccc(O)cc3C3(CC3)C2)[nH+]c2ccccc12 ZINC001330071987 1054019244 /nfs/dbraw/zinc/01/92/44/1054019244.db2.gz XSKRYEIEAMJNOC-UHFFFAOYSA-N 1 2 316.404 4.301 20 0 DIADLO Cc1cc(N2C[C@H](C)O[C@@H](CC(F)(F)F)C2)[nH+]c2ccccc12 ZINC001330088543 1054022781 /nfs/dbraw/zinc/02/27/81/1054022781.db2.gz QQQUSMXLLCTTCD-STQMWFEESA-N 1 2 324.346 4.089 20 0 DIADLO CSc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)cn1 ZINC001232331352 1054023494 /nfs/dbraw/zinc/02/34/94/1054023494.db2.gz PKHNAAXDIVVQJC-MRXNPFEDSA-N 1 2 320.408 4.419 20 0 DIADLO CSc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)cn1 ZINC001232331352 1054023507 /nfs/dbraw/zinc/02/35/07/1054023507.db2.gz PKHNAAXDIVVQJC-MRXNPFEDSA-N 1 2 320.408 4.419 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c(C)n1 ZINC001232336030 1054023536 /nfs/dbraw/zinc/02/35/36/1054023536.db2.gz FOKNHXHNIZVDQH-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)c(C)n1 ZINC001232336030 1054023548 /nfs/dbraw/zinc/02/35/48/1054023548.db2.gz FOKNHXHNIZVDQH-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO FC(F)(F)C[C@H]1CCC[N@H+](Cc2nc(-c3ccccc3)c[nH]2)C1 ZINC001330107804 1054025995 /nfs/dbraw/zinc/02/59/95/1054025995.db2.gz HAFLMMFEQCFKHD-CYBMUJFWSA-N 1 2 323.362 4.241 20 0 DIADLO FC(F)(F)C[C@H]1CCC[N@@H+](Cc2nc(-c3ccccc3)c[nH]2)C1 ZINC001330107804 1054026004 /nfs/dbraw/zinc/02/60/04/1054026004.db2.gz HAFLMMFEQCFKHD-CYBMUJFWSA-N 1 2 323.362 4.241 20 0 DIADLO CSc1cc(C)c(C[N@H+](C)Cc2ccc(F)cc2F)cn1 ZINC001232350863 1054027176 /nfs/dbraw/zinc/02/71/76/1054027176.db2.gz XHORVXZXJQPGLK-UHFFFAOYSA-N 1 2 308.397 4.022 20 0 DIADLO CSc1cc(C)c(C[N@@H+](C)Cc2ccc(F)cc2F)cn1 ZINC001232350863 1054027190 /nfs/dbraw/zinc/02/71/90/1054027190.db2.gz XHORVXZXJQPGLK-UHFFFAOYSA-N 1 2 308.397 4.022 20 0 DIADLO CSc1cc(C)c(C[N@H+](C)Cc2ccccc2Cl)cn1 ZINC001232346009 1054027878 /nfs/dbraw/zinc/02/78/78/1054027878.db2.gz LKLRRGWHXMYDFK-UHFFFAOYSA-N 1 2 306.862 4.397 20 0 DIADLO CSc1cc(C)c(C[N@@H+](C)Cc2ccccc2Cl)cn1 ZINC001232346009 1054027891 /nfs/dbraw/zinc/02/78/91/1054027891.db2.gz LKLRRGWHXMYDFK-UHFFFAOYSA-N 1 2 306.862 4.397 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cc(C)ccc2OC(C)C)no1 ZINC001232394050 1054036498 /nfs/dbraw/zinc/03/64/98/1054036498.db2.gz IIFLZKJCODZMHF-GOSISDBHSA-N 1 2 314.429 4.416 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc(C)ccc2OC(C)C)no1 ZINC001232394050 1054036508 /nfs/dbraw/zinc/03/65/08/1054036508.db2.gz IIFLZKJCODZMHF-GOSISDBHSA-N 1 2 314.429 4.416 20 0 DIADLO C[N@H+](Cc1cc2ccccc2[nH]1)Cc1nc2cc(F)ccc2o1 ZINC001330597508 1054042666 /nfs/dbraw/zinc/04/26/66/1054042666.db2.gz ZHFRRLNTEVNTIH-UHFFFAOYSA-N 1 2 309.344 4.080 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2[nH]1)Cc1nc2cc(F)ccc2o1 ZINC001330597508 1054042678 /nfs/dbraw/zinc/04/26/78/1054042678.db2.gz ZHFRRLNTEVNTIH-UHFFFAOYSA-N 1 2 309.344 4.080 20 0 DIADLO CC[N@H+](Cc1ccc(C(F)(F)F)o1)Cc1ccccc1F ZINC001232444658 1054045448 /nfs/dbraw/zinc/04/54/48/1054045448.db2.gz FVSOQMIHGHJIRQ-UHFFFAOYSA-N 1 2 301.283 4.460 20 0 DIADLO CC[N@@H+](Cc1ccc(C(F)(F)F)o1)Cc1ccccc1F ZINC001232444658 1054045462 /nfs/dbraw/zinc/04/54/62/1054045462.db2.gz FVSOQMIHGHJIRQ-UHFFFAOYSA-N 1 2 301.283 4.460 20 0 DIADLO Cc1[nH]c(CN(C)Cc2sc3ccccc3c2Cl)c[nH+]1 ZINC001232464349 1054049448 /nfs/dbraw/zinc/04/94/48/1054049448.db2.gz ZDWWFKDAMKORSL-UHFFFAOYSA-N 1 2 305.834 4.218 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@H](C)c2ccc(F)cc2)nc2ccccc12 ZINC000171102320 1054049418 /nfs/dbraw/zinc/04/94/18/1054049418.db2.gz YFVCBNJKCKUAQP-CQSZACIVSA-N 1 2 309.388 4.270 20 0 DIADLO Cc1nc(C[N@H+](C)[C@H](C)c2ccc(F)cc2)nc2ccccc12 ZINC000171102320 1054049429 /nfs/dbraw/zinc/04/94/29/1054049429.db2.gz YFVCBNJKCKUAQP-CQSZACIVSA-N 1 2 309.388 4.270 20 0 DIADLO Cc1[nH]cc(CN(C)Cc2sc3ccccc3c2Cl)[nH+]1 ZINC001232464349 1054049464 /nfs/dbraw/zinc/04/94/64/1054049464.db2.gz ZDWWFKDAMKORSL-UHFFFAOYSA-N 1 2 305.834 4.218 20 0 DIADLO C[C@H]([NH2+]Cc1csc(CCc2ccccc2)n1)c1ccoc1 ZINC000164384741 1054058348 /nfs/dbraw/zinc/05/83/48/1054058348.db2.gz RYPJDIYTKHLHFO-AWEZNQCLSA-N 1 2 312.438 4.372 20 0 DIADLO C[N@@H+](Cc1cc(F)ccc1N)Cc1ccc(Cl)cc1Cl ZINC001232507761 1054059618 /nfs/dbraw/zinc/05/96/18/1054059618.db2.gz NUVAABDFYFDYOC-UHFFFAOYSA-N 1 2 313.203 4.347 20 0 DIADLO C[N@H+](Cc1cc(F)ccc1N)Cc1ccc(Cl)cc1Cl ZINC001232507761 1054059633 /nfs/dbraw/zinc/05/96/33/1054059633.db2.gz NUVAABDFYFDYOC-UHFFFAOYSA-N 1 2 313.203 4.347 20 0 DIADLO Nc1ccc(F)cc1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001232510659 1054061701 /nfs/dbraw/zinc/06/17/01/1054061701.db2.gz GIGFMBWXRQWVEC-KRWDZBQOSA-N 1 2 306.331 4.023 20 0 DIADLO Nc1ccc(F)cc1C[N@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001232510659 1054061714 /nfs/dbraw/zinc/06/17/14/1054061714.db2.gz GIGFMBWXRQWVEC-KRWDZBQOSA-N 1 2 306.331 4.023 20 0 DIADLO FCc1cccc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)n1 ZINC001232540473 1054066845 /nfs/dbraw/zinc/06/68/45/1054066845.db2.gz GPJZCXRGJRLKED-QGZVFWFLSA-N 1 2 306.331 4.166 20 0 DIADLO FCc1cccc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)n1 ZINC001232540473 1054066853 /nfs/dbraw/zinc/06/68/53/1054066853.db2.gz GPJZCXRGJRLKED-QGZVFWFLSA-N 1 2 306.331 4.166 20 0 DIADLO Cc1nnsc1C[NH2+][C@H](C)c1cc(Cl)sc1Cl ZINC000293389695 1054067361 /nfs/dbraw/zinc/06/73/61/1054067361.db2.gz IVFWVVSLECFTHR-RXMQYKEDSA-N 1 2 308.259 4.066 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cc2ccoc2cn1 ZINC001232556856 1054070381 /nfs/dbraw/zinc/07/03/81/1054070381.db2.gz NGKYIJSZIBLXIW-SFHVURJKSA-N 1 2 322.408 4.311 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cc2ccoc2cn1 ZINC001232556856 1054070396 /nfs/dbraw/zinc/07/03/96/1054070396.db2.gz NGKYIJSZIBLXIW-SFHVURJKSA-N 1 2 322.408 4.311 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2cc(F)cc(F)c2)o1 ZINC000165270273 1054073648 /nfs/dbraw/zinc/07/36/48/1054073648.db2.gz CKZFVMWVMKAQHD-BZNIZROVSA-N 1 2 309.356 4.159 20 0 DIADLO CCOc1ccnc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1 ZINC001232584072 1054074325 /nfs/dbraw/zinc/07/43/25/1054074325.db2.gz WARZJSKFOBEAMK-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccnc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1 ZINC001232584072 1054074336 /nfs/dbraw/zinc/07/43/36/1054074336.db2.gz WARZJSKFOBEAMK-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO C[C@@H](c1nc([C@H]2CCC(C)(C)c3ccccc32)no1)n1cc[nH+]c1 ZINC001331515892 1054080587 /nfs/dbraw/zinc/08/05/87/1054080587.db2.gz TZANMSVKPXLOMR-ZFWWWQNUSA-N 1 2 322.412 4.079 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2c(Cl)ccnc2F)c1 ZINC001232620381 1054084610 /nfs/dbraw/zinc/08/46/10/1054084610.db2.gz QEKMDZZKZWEUDX-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2c(Cl)ccnc2F)c1 ZINC001232620381 1054084623 /nfs/dbraw/zinc/08/46/23/1054084623.db2.gz QEKMDZZKZWEUDX-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)C(=O)C[C@H](C)CC(C)(C)C)c1C ZINC000622037756 1054088631 /nfs/dbraw/zinc/08/86/31/1054088631.db2.gz SOIREKXWDQLXSJ-ZDUSSCGKSA-N 1 2 320.477 4.128 20 0 DIADLO Fc1ccc(Cl)c(Br)c1C[NH+]1C2CCC1CC2 ZINC001232692687 1054103055 /nfs/dbraw/zinc/10/30/55/1054103055.db2.gz BOPBSTKPCYOBGC-UHFFFAOYSA-N 1 2 318.617 4.368 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2Cl)[C@@H](C)C1 ZINC001232704222 1054105479 /nfs/dbraw/zinc/10/54/79/1054105479.db2.gz WGSKVHKTGJTGBF-GXSJLCMTSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2Cl)[C@@H](C)C1 ZINC001232704222 1054105487 /nfs/dbraw/zinc/10/54/87/1054105487.db2.gz WGSKVHKTGJTGBF-GXSJLCMTSA-N 1 2 306.208 4.132 20 0 DIADLO CC[N@H+](Cc1ccnc(Cl)c1C)Cc1cccc(F)c1F ZINC001232755422 1054115414 /nfs/dbraw/zinc/11/54/14/1054115414.db2.gz TUZTVCUSGDVTFU-UHFFFAOYSA-N 1 2 310.775 4.344 20 0 DIADLO CC[N@@H+](Cc1ccnc(Cl)c1C)Cc1cccc(F)c1F ZINC001232755422 1054115420 /nfs/dbraw/zinc/11/54/20/1054115420.db2.gz TUZTVCUSGDVTFU-UHFFFAOYSA-N 1 2 310.775 4.344 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cccc(O)c2Cl)cn1 ZINC001232788759 1054121049 /nfs/dbraw/zinc/12/10/49/1054121049.db2.gz MNTLUXHZSKDIRU-OAHLLOKOSA-N 1 2 302.805 4.086 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cccc(O)c2Cl)cn1 ZINC001232788759 1054121058 /nfs/dbraw/zinc/12/10/58/1054121058.db2.gz MNTLUXHZSKDIRU-OAHLLOKOSA-N 1 2 302.805 4.086 20 0 DIADLO COc1cc(O)cc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c1 ZINC001232806545 1054124777 /nfs/dbraw/zinc/12/47/77/1054124777.db2.gz FISJWTZYIHQVEP-KRWDZBQOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cc(O)cc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)c1 ZINC001232806545 1054124783 /nfs/dbraw/zinc/12/47/83/1054124783.db2.gz FISJWTZYIHQVEP-KRWDZBQOSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1cc(N[C@@H](c2ccccc2)[C@H]2CCCO2)nc(C(C)C)[nH+]1 ZINC000505778196 1054125452 /nfs/dbraw/zinc/12/54/52/1054125452.db2.gz RNGAWIKJQZYEHW-AEFFLSMTSA-N 1 2 311.429 4.241 20 0 DIADLO CCCn1cnc(C[NH+](Cc2ccccc2)Cc2ccccc2)c1 ZINC001232802957 1054125570 /nfs/dbraw/zinc/12/55/70/1054125570.db2.gz IYMSMIVIYGTUMU-UHFFFAOYSA-N 1 2 319.452 4.496 20 0 DIADLO CC(C)c1ccccc1CNc1ccc([NH+]2CCC(O)CC2)cc1 ZINC000848528781 1054126846 /nfs/dbraw/zinc/12/68/46/1054126846.db2.gz OJURZUKCLBEGIY-UHFFFAOYSA-N 1 2 324.468 4.383 20 0 DIADLO Brc1coc(C[N@H+]2CC=C(c3ccccc3)CC2)c1 ZINC001232855245 1054132803 /nfs/dbraw/zinc/13/28/03/1054132803.db2.gz AFDGMFKTNVBOER-UHFFFAOYSA-N 1 2 318.214 4.331 20 0 DIADLO Brc1coc(C[N@@H+]2CC=C(c3ccccc3)CC2)c1 ZINC001232855245 1054132807 /nfs/dbraw/zinc/13/28/07/1054132807.db2.gz AFDGMFKTNVBOER-UHFFFAOYSA-N 1 2 318.214 4.331 20 0 DIADLO Cc1ccc(CC[N@@H+]2CCO[C@H](c3ccc(Cl)s3)C2)cc1 ZINC001332959407 1054133434 /nfs/dbraw/zinc/13/34/34/1054133434.db2.gz WWFWMKQRKHPJIE-HNNXBMFYSA-N 1 2 321.873 4.326 20 0 DIADLO Cc1ccc(CC[N@H+]2CCO[C@H](c3ccc(Cl)s3)C2)cc1 ZINC001332959407 1054133444 /nfs/dbraw/zinc/13/34/44/1054133444.db2.gz WWFWMKQRKHPJIE-HNNXBMFYSA-N 1 2 321.873 4.326 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3c(C)cccc3F)c2)[nH+]c1C ZINC001332943946 1054134140 /nfs/dbraw/zinc/13/41/40/1054134140.db2.gz FCJXILNPHGDRIV-UHFFFAOYSA-N 1 2 323.371 4.393 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2ccc(-c3cccc(F)c3)nc2)C[C@H]1F ZINC001232884373 1054138351 /nfs/dbraw/zinc/13/83/51/1054138351.db2.gz FVLMCUOSKYPRGE-MSOLQXFVSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2ccc(-c3cccc(F)c3)nc2)C[C@H]1F ZINC001232884373 1054138356 /nfs/dbraw/zinc/13/83/56/1054138356.db2.gz FVLMCUOSKYPRGE-MSOLQXFVSA-N 1 2 320.358 4.160 20 0 DIADLO F[C@@H]1C[N@H+](Cc2cncc(-c3ccccc3)c2)CCCC1(F)F ZINC001232899072 1054144516 /nfs/dbraw/zinc/14/45/16/1054144516.db2.gz NMABBEZUJCGRQD-QGZVFWFLSA-N 1 2 320.358 4.318 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2cncc(-c3ccccc3)c2)CCCC1(F)F ZINC001232899072 1054144525 /nfs/dbraw/zinc/14/45/25/1054144525.db2.gz NMABBEZUJCGRQD-QGZVFWFLSA-N 1 2 320.358 4.318 20 0 DIADLO F[C@H]1C[N@H+](Cc2cncc(-c3ccccc3)c2)CCCC1(F)F ZINC001232899071 1054144978 /nfs/dbraw/zinc/14/49/78/1054144978.db2.gz NMABBEZUJCGRQD-KRWDZBQOSA-N 1 2 320.358 4.318 20 0 DIADLO F[C@H]1C[N@@H+](Cc2cncc(-c3ccccc3)c2)CCCC1(F)F ZINC001232899071 1054144984 /nfs/dbraw/zinc/14/49/84/1054144984.db2.gz NMABBEZUJCGRQD-KRWDZBQOSA-N 1 2 320.358 4.318 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc(F)c(O)c1F ZINC001232935570 1054149513 /nfs/dbraw/zinc/14/95/13/1054149513.db2.gz UCZLVKOFNBWLSQ-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Cl)cnc2Br)[C@H](C)C1 ZINC001232961556 1054159556 /nfs/dbraw/zinc/15/95/56/1054159556.db2.gz PIFOKEYHHNUQNB-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Cl)cnc2Br)[C@H](C)C1 ZINC001232961556 1054159560 /nfs/dbraw/zinc/15/95/60/1054159560.db2.gz PIFOKEYHHNUQNB-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO FC(F)SCc1ccc(C[NH2+]Cc2noc3ccccc23)o1 ZINC000848579923 1054160502 /nfs/dbraw/zinc/16/05/02/1054160502.db2.gz RNXBKYURMZIARW-UHFFFAOYSA-N 1 2 324.352 4.166 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232972196 1054162690 /nfs/dbraw/zinc/16/26/90/1054162690.db2.gz VTPZBINJWSQPFO-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232972196 1054162697 /nfs/dbraw/zinc/16/26/97/1054162697.db2.gz VTPZBINJWSQPFO-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cc(F)c1F ZINC001232970192 1054163228 /nfs/dbraw/zinc/16/32/28/1054163228.db2.gz BBJKKCPDAQETJY-OAHLLOKOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)cc(F)c1F ZINC001232970192 1054163229 /nfs/dbraw/zinc/16/32/29/1054163229.db2.gz BBJKKCPDAQETJY-OAHLLOKOSA-N 1 2 307.315 4.147 20 0 DIADLO Cc1ncc(C[NH2+][C@H](c2ccc(C(C)C)cc2)c2cccnc2)o1 ZINC001333618019 1054163983 /nfs/dbraw/zinc/16/39/83/1054163983.db2.gz URGJLZGPPMLKGW-HXUWFJFHSA-N 1 2 321.424 4.381 20 0 DIADLO Cc1nc(C[N@@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@H]2C)c(C)s1 ZINC001333926338 1054177488 /nfs/dbraw/zinc/17/74/88/1054177488.db2.gz LICHJMRIEULIRG-VFVRVIDISA-N 1 2 316.470 4.110 20 0 DIADLO Cc1nc(C[N@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@H]2C)c(C)s1 ZINC001333926338 1054177496 /nfs/dbraw/zinc/17/74/96/1054177496.db2.gz LICHJMRIEULIRG-VFVRVIDISA-N 1 2 316.470 4.110 20 0 DIADLO C[N@H+](Cc1ccc(C(F)(F)F)cc1)Cc1cccc(O)c1F ZINC001233057423 1054179572 /nfs/dbraw/zinc/17/95/72/1054179572.db2.gz MCRSKRKUTNWZHQ-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cc1cccc(O)c1F ZINC001233057423 1054179582 /nfs/dbraw/zinc/17/95/82/1054179582.db2.gz MCRSKRKUTNWZHQ-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO C[C@H](c1cccc2ccccc21)[N@H+](C)Cc1nc2ccccn2n1 ZINC001233074193 1054180815 /nfs/dbraw/zinc/18/08/15/1054180815.db2.gz KVNNYANTAAMDBK-OAHLLOKOSA-N 1 2 316.408 4.076 20 0 DIADLO C[C@H](c1cccc2ccccc21)[N@@H+](C)Cc1nc2ccccn2n1 ZINC001233074193 1054180822 /nfs/dbraw/zinc/18/08/22/1054180822.db2.gz KVNNYANTAAMDBK-OAHLLOKOSA-N 1 2 316.408 4.076 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ccc(Cl)c(Br)n2)[C@H]1C ZINC001233092532 1054186438 /nfs/dbraw/zinc/18/64/38/1054186438.db2.gz MXXYHPGVRJEDCS-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)c(Br)n2)[C@H]1C ZINC001233092532 1054186446 /nfs/dbraw/zinc/18/64/46/1054186446.db2.gz MXXYHPGVRJEDCS-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1ccc(C)c2nc(Cl)c(C[NH+]3CCSCC3)cc12 ZINC001233132186 1054191477 /nfs/dbraw/zinc/19/14/77/1054191477.db2.gz UHTZJJDTGCCSFR-UHFFFAOYSA-N 1 2 306.862 4.054 20 0 DIADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)cnc1C ZINC001233155919 1054191564 /nfs/dbraw/zinc/19/15/64/1054191564.db2.gz JEPQTFUHJFRVQD-OAQYLSRUSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1cc(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)cnc1C ZINC001233155919 1054191568 /nfs/dbraw/zinc/19/15/68/1054191568.db2.gz JEPQTFUHJFRVQD-OAQYLSRUSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1ccc(C)c2nc(Cl)c(C[N@H+]3C[C@@H](F)C[C@H]3C)cc12 ZINC001233132190 1054191608 /nfs/dbraw/zinc/19/16/08/1054191608.db2.gz UJRSMBSEYQYLHA-OCCSQVGLSA-N 1 2 306.812 4.437 20 0 DIADLO Cc1ccc(C)c2nc(Cl)c(C[N@@H+]3C[C@@H](F)C[C@H]3C)cc12 ZINC001233132190 1054191609 /nfs/dbraw/zinc/19/16/09/1054191609.db2.gz UJRSMBSEYQYLHA-OCCSQVGLSA-N 1 2 306.812 4.437 20 0 DIADLO CC(C)Oc1ncc(Cl)cc1C[NH+]1CC(c2ccccc2)C1 ZINC001233166778 1054192997 /nfs/dbraw/zinc/19/29/97/1054192997.db2.gz MJOIWYVVJJYUSJ-UHFFFAOYSA-N 1 2 316.832 4.122 20 0 DIADLO Cc1ccc2c(c1)[C@H]([NH2+][C@H](c1nnc[nH]1)C1CCCCC1)CC2 ZINC000638543254 1054196216 /nfs/dbraw/zinc/19/62/16/1054196216.db2.gz HCUICERUFNBSDN-MSOLQXFVSA-N 1 2 310.445 4.012 20 0 DIADLO CC(C)c1nsc(C[NH2+][C@H](C)c2ccc3ncsc3c2)n1 ZINC001334797830 1054198954 /nfs/dbraw/zinc/19/89/54/1054198954.db2.gz GRCSHGXUWVYXDU-SNVBAGLBSA-N 1 2 318.471 4.122 20 0 DIADLO Fc1c(Cl)ccc(C[NH+]2CCC(OC3CCC3)CC2)c1F ZINC001233207804 1054201658 /nfs/dbraw/zinc/20/16/58/1054201658.db2.gz QJFWVEXBKWOVLM-UHFFFAOYSA-N 1 2 315.791 4.152 20 0 DIADLO Cc1c(Br)ccc(C[N@@H+]2CCc3occc3C2)c1C ZINC001233221873 1054208073 /nfs/dbraw/zinc/20/80/73/1054208073.db2.gz DQOURZQFFMWLCE-UHFFFAOYSA-N 1 2 320.230 4.217 20 0 DIADLO Cc1c(Br)ccc(C[N@H+]2CCc3occc3C2)c1C ZINC001233221873 1054208090 /nfs/dbraw/zinc/20/80/90/1054208090.db2.gz DQOURZQFFMWLCE-UHFFFAOYSA-N 1 2 320.230 4.217 20 0 DIADLO Cc1ccc(Cl)cc1C[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC001233250078 1054215117 /nfs/dbraw/zinc/21/51/17/1054215117.db2.gz UOVWKMFBYKRNPJ-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccc(Cl)cc1C[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC001233250078 1054215131 /nfs/dbraw/zinc/21/51/31/1054215131.db2.gz UOVWKMFBYKRNPJ-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO COc1c(O)cccc1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001233256558 1054215414 /nfs/dbraw/zinc/21/54/14/1054215414.db2.gz JBRXUDXOLUGRQU-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1c(O)cccc1C[N@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001233256558 1054215418 /nfs/dbraw/zinc/21/54/18/1054215418.db2.gz JBRXUDXOLUGRQU-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO CCOC1CC(CCNc2cc(C(C)C)[nH+]c(C(C)C)n2)C1 ZINC000473708871 1054231256 /nfs/dbraw/zinc/23/12/56/1054231256.db2.gz GADVGNVANVQWSL-UHFFFAOYSA-N 1 2 305.466 4.341 20 0 DIADLO Cc1cc(C[NH+]2CCC(=O)CC2)cc(C)c1OCc1ccccc1 ZINC001233328798 1054231941 /nfs/dbraw/zinc/23/19/41/1054231941.db2.gz WBBBJNKHDQVRMM-UHFFFAOYSA-N 1 2 323.436 4.047 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)cc1F ZINC001233343390 1054237955 /nfs/dbraw/zinc/23/79/55/1054237955.db2.gz LIDUNFLSWKEFAG-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@H]2c2cccc(F)c2)cc1F ZINC001233343390 1054237971 /nfs/dbraw/zinc/23/79/71/1054237971.db2.gz LIDUNFLSWKEFAG-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCc3ccccc3[C@H]2C)cc1F ZINC001233340519 1054239661 /nfs/dbraw/zinc/23/96/61/1054239661.db2.gz GJHWQTGHMFGYGP-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCc3ccccc3[C@H]2C)cc1F ZINC001233340519 1054239670 /nfs/dbraw/zinc/23/96/70/1054239670.db2.gz GJHWQTGHMFGYGP-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(C[N@H+](C)[C@@H](C)c2ccccc2OC)cc1F ZINC001233343901 1054242433 /nfs/dbraw/zinc/24/24/33/1054242433.db2.gz FIHHSVOPNGPRCN-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1cc(F)c(C[N@@H+](C)[C@@H](C)c2ccccc2OC)cc1F ZINC001233343901 1054242444 /nfs/dbraw/zinc/24/24/44/1054242444.db2.gz FIHHSVOPNGPRCN-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1cc(F)c(C[N@H+](C)[C@H](C)c2ccccc2OC)cc1F ZINC001233343900 1054243249 /nfs/dbraw/zinc/24/32/49/1054243249.db2.gz FIHHSVOPNGPRCN-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1cc(F)c(C[N@@H+](C)[C@H](C)c2ccccc2OC)cc1F ZINC001233343900 1054243258 /nfs/dbraw/zinc/24/32/58/1054243258.db2.gz FIHHSVOPNGPRCN-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+]1CCc2nc(C)sc2C1 ZINC001233352361 1054245349 /nfs/dbraw/zinc/24/53/49/1054245349.db2.gz ATSCBGTZTSCIHU-UHFFFAOYSA-N 1 2 324.902 4.385 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+]1CCc2nc(C)sc2C1 ZINC001233352361 1054245357 /nfs/dbraw/zinc/24/53/57/1054245357.db2.gz ATSCBGTZTSCIHU-UHFFFAOYSA-N 1 2 324.902 4.385 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+]1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001233350936 1054245376 /nfs/dbraw/zinc/24/53/76/1054245376.db2.gz ZTSFSABWZKNMTD-WFASDCNBSA-N 1 2 323.889 4.396 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+]1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001233350936 1054245384 /nfs/dbraw/zinc/24/53/84/1054245384.db2.gz ZTSFSABWZKNMTD-WFASDCNBSA-N 1 2 323.889 4.396 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c(Cl)c1O ZINC001233397858 1054258477 /nfs/dbraw/zinc/25/84/77/1054258477.db2.gz ODERXYUKLFHHEA-LBPRGKRZSA-N 1 2 317.816 4.174 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c(Cl)ncnc1Cl ZINC001233408089 1054262836 /nfs/dbraw/zinc/26/28/36/1054262836.db2.gz BANKBYFIRSWEJQ-AWEZNQCLSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1c(Cl)ncnc1Cl ZINC001233408089 1054262844 /nfs/dbraw/zinc/26/28/44/1054262844.db2.gz BANKBYFIRSWEJQ-AWEZNQCLSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1c([C@@H](C)Nc2ccc(C)[nH+]c2C)nnn1-c1ccc(C)cc1 ZINC001337322341 1054263756 /nfs/dbraw/zinc/26/37/56/1054263756.db2.gz SNRCJWRNDUILGE-OAHLLOKOSA-N 1 2 321.428 4.069 20 0 DIADLO COc1ccc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)c(Cl)c1O ZINC001233401327 1054264116 /nfs/dbraw/zinc/26/41/16/1054264116.db2.gz VQNXWIGKGUBTTR-LBPRGKRZSA-N 1 2 317.816 4.001 20 0 DIADLO COc1ccc(C[N@H+]2Cc3ccccc3C[C@@H]2C)c(Cl)c1O ZINC001233401327 1054264129 /nfs/dbraw/zinc/26/41/29/1054264129.db2.gz VQNXWIGKGUBTTR-LBPRGKRZSA-N 1 2 317.816 4.001 20 0 DIADLO Cc1ccc(N[C@@H](C)c2nc3ccc(Cl)cc3n2C)c(C)[nH+]1 ZINC001337320020 1054264412 /nfs/dbraw/zinc/26/44/12/1054264412.db2.gz FAQGXPJSBDXFLF-LBPRGKRZSA-N 1 2 314.820 4.412 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1ncoc1C(C)C)[C@@H]2C ZINC001337548147 1054272816 /nfs/dbraw/zinc/27/28/16/1054272816.db2.gz DLXLGKFESDBQRW-ZIAGYGMSSA-N 1 2 314.429 4.314 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1ncoc1C(C)C)[C@@H]2C ZINC001337548147 1054272825 /nfs/dbraw/zinc/27/28/25/1054272825.db2.gz DLXLGKFESDBQRW-ZIAGYGMSSA-N 1 2 314.429 4.314 20 0 DIADLO F[C@H]1C[N@H+](Cc2ccc3nc(Cl)ccc3c2)CCC1(F)F ZINC001233442534 1054273569 /nfs/dbraw/zinc/27/35/69/1054273569.db2.gz WZMNSRKWVSHMJZ-ZDUSSCGKSA-N 1 2 314.738 4.067 20 0 DIADLO F[C@H]1C[N@@H+](Cc2ccc3nc(Cl)ccc3c2)CCC1(F)F ZINC001233442534 1054273580 /nfs/dbraw/zinc/27/35/80/1054273580.db2.gz WZMNSRKWVSHMJZ-ZDUSSCGKSA-N 1 2 314.738 4.067 20 0 DIADLO CC(C)c1ccccc1C[N@H+](C)Cc1nc2ccccc2c(=O)[nH]1 ZINC000848877154 1054278178 /nfs/dbraw/zinc/27/81/78/1054278178.db2.gz QDBYUBLJCWTPQK-UHFFFAOYSA-N 1 2 321.424 4.091 20 0 DIADLO CC(C)c1ccccc1C[N@@H+](C)Cc1nc2ccccc2c(=O)[nH]1 ZINC000848877154 1054278190 /nfs/dbraw/zinc/27/81/90/1054278190.db2.gz QDBYUBLJCWTPQK-UHFFFAOYSA-N 1 2 321.424 4.091 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](Cc1cnc(Cl)n1C)C1CC1 ZINC000848880904 1054281198 /nfs/dbraw/zinc/28/11/98/1054281198.db2.gz KVWXAJQWKVQFHD-LLVKDONJSA-N 1 2 324.255 4.453 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](Cc1cnc(Cl)n1C)C1CC1 ZINC000848880904 1054281212 /nfs/dbraw/zinc/28/12/12/1054281212.db2.gz KVWXAJQWKVQFHD-LLVKDONJSA-N 1 2 324.255 4.453 20 0 DIADLO CC(C)[N@@H+](Cc1ccn(-c2cccc(F)c2)n1)Cc1ccco1 ZINC000622588195 1054296469 /nfs/dbraw/zinc/29/64/69/1054296469.db2.gz VOUFKOAGAVNJFA-UHFFFAOYSA-N 1 2 313.376 4.015 20 0 DIADLO CC(C)[N@H+](Cc1ccn(-c2cccc(F)c2)n1)Cc1ccco1 ZINC000622588195 1054296481 /nfs/dbraw/zinc/29/64/81/1054296481.db2.gz VOUFKOAGAVNJFA-UHFFFAOYSA-N 1 2 313.376 4.015 20 0 DIADLO CC1(C)CC[C@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1 ZINC001356317239 1054317665 /nfs/dbraw/zinc/31/76/65/1054317665.db2.gz QDXTULDFUJLYML-LBPRGKRZSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccc(C(C)C)c(Cl)c2)c[nH+]1 ZINC000622667810 1054331870 /nfs/dbraw/zinc/33/18/70/1054331870.db2.gz UFGJLCSMCYYJAI-UHFFFAOYSA-N 1 2 316.832 4.405 20 0 DIADLO CCCc1cc(C(=O)NCc2c[nH+]c(C)cc2C)ccc1Cl ZINC000622667783 1054332396 /nfs/dbraw/zinc/33/23/96/1054332396.db2.gz SOZHKSRELYNRQB-UHFFFAOYSA-N 1 2 316.832 4.234 20 0 DIADLO CC1CC[NH+](CC(=O)Oc2ccc3oc4ccccc4c3c2)CC1 ZINC001440657208 1054362046 /nfs/dbraw/zinc/36/20/46/1054362046.db2.gz DNWYASJABAWIHK-UHFFFAOYSA-N 1 2 323.392 4.223 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1cccc(C2CC2)c1 ZINC001441182091 1054387318 /nfs/dbraw/zinc/38/73/18/1054387318.db2.gz VYUIPDLARMOZMV-UHFFFAOYSA-N 1 2 303.365 4.002 20 0 DIADLO Clc1ccccc1-c1nnc(-c2ccc(-n3cc[nH+]c3)cc2)o1 ZINC001341455341 1054388536 /nfs/dbraw/zinc/38/85/36/1054388536.db2.gz FORCHGZKUYWAAX-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO CCCCCN(CCCCC)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001441602431 1054394794 /nfs/dbraw/zinc/39/47/94/1054394794.db2.gz GWQGNTTZKSOGBH-UHFFFAOYSA-N 1 2 301.434 4.386 20 0 DIADLO Cn1c2ccc(Nc3nc4c(cccc4F)o3)cc2[nH+]c1C1CC1 ZINC000485973930 1054406642 /nfs/dbraw/zinc/40/66/42/1054406642.db2.gz DFSDPUMLTKXJRJ-UHFFFAOYSA-N 1 2 322.343 4.475 20 0 DIADLO CC(C)c1nc(CNc2[nH+]c3cccc(Cl)c3n2C)cs1 ZINC001342670867 1054427905 /nfs/dbraw/zinc/42/79/05/1054427905.db2.gz CWWYKUCJJLKHNQ-UHFFFAOYSA-N 1 2 320.849 4.419 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)n1 ZINC000172409316 1054428381 /nfs/dbraw/zinc/42/83/81/1054428381.db2.gz ISTBXQBZRGWLTQ-CRAIPNDOSA-N 1 2 315.486 4.143 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)n1 ZINC000172409316 1054428390 /nfs/dbraw/zinc/42/83/90/1054428390.db2.gz ISTBXQBZRGWLTQ-CRAIPNDOSA-N 1 2 315.486 4.143 20 0 DIADLO CCc1nc(C)c(C[NH2+]Cc2c(Cl)oc3ccccc32)o1 ZINC000336847055 1054451274 /nfs/dbraw/zinc/45/12/74/1054451274.db2.gz CLHYJHMNHZSWQV-UHFFFAOYSA-N 1 2 304.777 4.235 20 0 DIADLO CCCCC1CCC(NC(=O)c2c(C)cc(C)[nH+]c2C)CC1 ZINC001357282559 1054452238 /nfs/dbraw/zinc/45/22/38/1054452238.db2.gz UIKYTHSVDYRRFQ-UHFFFAOYSA-N 1 2 302.462 4.486 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@H](F)CC1CCCCC1 ZINC001357289636 1054453219 /nfs/dbraw/zinc/45/32/19/1054453219.db2.gz MYPQVCFCQHNOPR-QGZVFWFLSA-N 1 2 315.392 4.119 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(F)c3ccccc23)c(N(C)C)[nH+]1 ZINC001357395801 1054471185 /nfs/dbraw/zinc/47/11/85/1054471185.db2.gz LNKABJOWBYDMSE-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO CC[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C(C)(C)c1ccccc1 ZINC001444561802 1054479621 /nfs/dbraw/zinc/47/96/21/1054479621.db2.gz QVSATJVRCNOUDA-SFHVURJKSA-N 1 2 321.424 4.049 20 0 DIADLO CC[C@@H](c1ccccc1)N(C(=O)C[C@@H](C)n1cc[nH+]c1)C(C)C ZINC000622977405 1054497709 /nfs/dbraw/zinc/49/77/09/1054497709.db2.gz ZZZCWABTADEFPC-AEFFLSMTSA-N 1 2 313.445 4.223 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@@H]1CCC[C@H]2CCCC[C@@H]21 ZINC001357549324 1054498118 /nfs/dbraw/zinc/49/81/18/1054498118.db2.gz DPQRHVOERJBWHR-AYOQOUSVSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)sc1C ZINC000174434173 1054508404 /nfs/dbraw/zinc/50/84/04/1054508404.db2.gz KEZUUFRBIPMXQM-UHFFFAOYSA-N 1 2 316.401 4.449 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)o1 ZINC000174482392 1054510634 /nfs/dbraw/zinc/51/06/34/1054510634.db2.gz NWWAAQWTVHKQLZ-MAZHCROVSA-N 1 2 303.402 4.036 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)o1 ZINC000174482414 1054510912 /nfs/dbraw/zinc/51/09/12/1054510912.db2.gz NWWAAQWTVHKQLZ-RCBQFDQVSA-N 1 2 303.402 4.036 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccccc1)c1c(F)cccc1Cl ZINC000175021241 1054518731 /nfs/dbraw/zinc/51/87/31/1054518731.db2.gz WLLHOBIFSWMDGP-NEPJUHHUSA-N 1 2 320.795 4.157 20 0 DIADLO CC(C)c1cccc(C(C)C)c1NC(=O)CCc1[nH+]ccn1C ZINC001346305923 1054534107 /nfs/dbraw/zinc/53/41/07/1054534107.db2.gz MTJPLCBSSQKUCJ-UHFFFAOYSA-N 1 2 313.445 4.238 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1sccc1Br ZINC000623120683 1054534447 /nfs/dbraw/zinc/53/44/47/1054534447.db2.gz HDELEKWHLNEOCW-UHFFFAOYSA-N 1 2 316.186 4.285 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1sccc1Br ZINC000623120683 1054534456 /nfs/dbraw/zinc/53/44/56/1054534456.db2.gz HDELEKWHLNEOCW-UHFFFAOYSA-N 1 2 316.186 4.285 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+](CC)CCC(F)(F)F ZINC000623121854 1054535949 /nfs/dbraw/zinc/53/59/49/1054535949.db2.gz PJHSYJGDWWWXFX-UHFFFAOYSA-N 1 2 317.351 4.062 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+](CC)CCC(F)(F)F ZINC000623121854 1054535960 /nfs/dbraw/zinc/53/59/60/1054535960.db2.gz PJHSYJGDWWWXFX-UHFFFAOYSA-N 1 2 317.351 4.062 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@@H]2CCC(=O)c3ccccc32)cc1 ZINC001234588014 1054551566 /nfs/dbraw/zinc/55/15/66/1054551566.db2.gz HXGQVLXBGRCMOC-GOSISDBHSA-N 1 2 309.365 4.145 20 0 DIADLO CCCN(C(=O)CCCn1cc[nH+]c1)[C@H](CC)c1ccccc1 ZINC000623253542 1054551592 /nfs/dbraw/zinc/55/15/92/1054551592.db2.gz FVWHPRFQXIUDGX-GOSISDBHSA-N 1 2 313.445 4.053 20 0 DIADLO CCOC(=[NH2+])c1ccc(OC[C@H](C)OCc2ccccc2)cc1 ZINC001234589314 1054553692 /nfs/dbraw/zinc/55/36/92/1054553692.db2.gz ZMPIJDZEAYHHDJ-HNNXBMFYSA-N 1 2 313.397 4.033 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)n1 ZINC000192552449 1054560162 /nfs/dbraw/zinc/56/01/62/1054560162.db2.gz NTWDZSZBYGIICL-QGZVFWFLSA-N 1 2 319.836 4.307 20 0 DIADLO Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2cc3c[nH+]ccc3[nH]2)c1 ZINC001545693411 1054579514 /nfs/dbraw/zinc/57/95/14/1054579514.db2.gz UITJEUQYFSBATP-IBGZPJMESA-N 1 2 319.408 4.157 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CCC[C@@H](F)CC2)c(Br)c1 ZINC001234734438 1054583437 /nfs/dbraw/zinc/58/34/37/1054583437.db2.gz LRWQRSBWRMNRJX-SECBINFHSA-N 1 2 322.168 4.051 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CCC[C@@H](F)CC2)c(Br)c1 ZINC001234734438 1054583449 /nfs/dbraw/zinc/58/34/49/1054583449.db2.gz LRWQRSBWRMNRJX-SECBINFHSA-N 1 2 322.168 4.051 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CC3CCC2CC3)c(Br)c1 ZINC001234760580 1054586520 /nfs/dbraw/zinc/58/65/20/1054586520.db2.gz NKANQGODGYXKTL-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CC3CCC2CC3)c(Br)c1 ZINC001234760580 1054586535 /nfs/dbraw/zinc/58/65/35/1054586535.db2.gz NKANQGODGYXKTL-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO CCC[C@H](C(=O)Nc1cc(C)[nH+]cc1C)c1ccc(Cl)cc1 ZINC001358141920 1054608792 /nfs/dbraw/zinc/60/87/92/1054608792.db2.gz UWWVPFGEBKIKFT-INIZCTEOSA-N 1 2 316.832 4.296 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1cc(F)cc(F)c1 ZINC000177970570 1054638616 /nfs/dbraw/zinc/63/86/16/1054638616.db2.gz FBVBIQBPRQZVIB-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1c[nH]c(-c2ccccc2F)c1 ZINC001235041971 1054647223 /nfs/dbraw/zinc/64/72/23/1054647223.db2.gz FUGXYVHQXCTSLM-CQSZACIVSA-N 1 2 309.388 4.199 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1c[nH]c(-c2ccccc2F)c1 ZINC001235041971 1054647238 /nfs/dbraw/zinc/64/72/38/1054647238.db2.gz FUGXYVHQXCTSLM-CQSZACIVSA-N 1 2 309.388 4.199 20 0 DIADLO Cc1ccc(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)o1 ZINC000178193950 1054649820 /nfs/dbraw/zinc/64/98/20/1054649820.db2.gz FWPXVKNQCAAVTI-UHFFFAOYSA-N 1 2 307.397 4.400 20 0 DIADLO c1ccc([C@@H]2CCN(c3[nH+]ccc4ccccc43)CCO2)cc1 ZINC001348519273 1054652769 /nfs/dbraw/zinc/65/27/69/1054652769.db2.gz HUVYBCQCKAXIEL-IBGZPJMESA-N 1 2 304.393 4.203 20 0 DIADLO Cc1cn2cc(NC(=O)C[C@H]3C[C@@H](C)CC(C)(C)C3)ccc2[nH+]1 ZINC001358364367 1054665930 /nfs/dbraw/zinc/66/59/30/1054665930.db2.gz WQYYNCWJQBMERH-UKRRQHHQSA-N 1 2 313.445 4.434 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H]3CC[C@@H](c4ccccc4)C3)ccc2[nH+]1 ZINC001358373005 1054669404 /nfs/dbraw/zinc/66/94/04/1054669404.db2.gz QHTPEFVPGPIEFZ-IAGOWNOFSA-N 1 2 319.408 4.165 20 0 DIADLO CC[C@@H](OC(=O)c1ccn2c(C)c[nH+]c2c1)c1ccc(C)cc1 ZINC001358414930 1054676201 /nfs/dbraw/zinc/67/62/01/1054676201.db2.gz MJRAWYHXMUMKHA-QGZVFWFLSA-N 1 2 308.381 4.259 20 0 DIADLO CSc1cc(C)ccc1NC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC001451622261 1054683224 /nfs/dbraw/zinc/68/32/24/1054683224.db2.gz URSDSTKNRAPRSK-UHFFFAOYSA-N 1 2 323.421 4.155 20 0 DIADLO C[N@H+](Cc1cc2cccc(F)c2[nH]1)Cc1ccc(F)cc1F ZINC001235249161 1054692060 /nfs/dbraw/zinc/69/20/60/1054692060.db2.gz PYVDRZUEKWZOOO-UHFFFAOYSA-N 1 2 304.315 4.217 20 0 DIADLO C[N@@H+](Cc1cc2cccc(F)c2[nH]1)Cc1ccc(F)cc1F ZINC001235249161 1054692066 /nfs/dbraw/zinc/69/20/66/1054692066.db2.gz PYVDRZUEKWZOOO-UHFFFAOYSA-N 1 2 304.315 4.217 20 0 DIADLO C[C@@H]1C(=O)CC[N@H+](Cc2cc3cccc(F)c3[nH]2)C12CCCC2 ZINC001235252083 1054692409 /nfs/dbraw/zinc/69/24/09/1054692409.db2.gz YIWONTKIVNZHOU-CYBMUJFWSA-N 1 2 314.404 4.031 20 0 DIADLO C[C@@H]1C(=O)CC[N@@H+](Cc2cc3cccc(F)c3[nH]2)C12CCCC2 ZINC001235252083 1054692416 /nfs/dbraw/zinc/69/24/16/1054692416.db2.gz YIWONTKIVNZHOU-CYBMUJFWSA-N 1 2 314.404 4.031 20 0 DIADLO Cc1ccc(-c2cccc(C[N@@H+](C)Cc3ncccn3)c2)cc1 ZINC001235309008 1054696755 /nfs/dbraw/zinc/69/67/55/1054696755.db2.gz SAWZGELTEAGKET-UHFFFAOYSA-N 1 2 303.409 4.084 20 0 DIADLO Cc1ccc(-c2cccc(C[N@H+](C)Cc3ncccn3)c2)cc1 ZINC001235309008 1054696760 /nfs/dbraw/zinc/69/67/60/1054696760.db2.gz SAWZGELTEAGKET-UHFFFAOYSA-N 1 2 303.409 4.084 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)c(F)cn1 ZINC001235315604 1054700561 /nfs/dbraw/zinc/70/05/61/1054700561.db2.gz IFPVAGGAUYUULS-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@@H]2c2ccccc2F)c(F)cn1 ZINC001235315604 1054700578 /nfs/dbraw/zinc/70/05/78/1054700578.db2.gz IFPVAGGAUYUULS-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1cnc(F)c(C[N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)c1 ZINC001235345014 1054704042 /nfs/dbraw/zinc/70/40/42/1054704042.db2.gz FSNJDQGDUACQKW-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1cnc(F)c(C[N@H+]2CCc3cc(C(F)(F)F)ccc3C2)c1 ZINC001235345014 1054704060 /nfs/dbraw/zinc/70/40/60/1054704060.db2.gz FSNJDQGDUACQKW-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2ccccc2)C(CC)CC)no1 ZINC000179788494 1054704780 /nfs/dbraw/zinc/70/47/80/1054704780.db2.gz LUOXEYOTDNLOPB-SFHVURJKSA-N 1 2 301.434 4.289 20 0 DIADLO Cc1cc(NCc2csc(-c3ccccc3)n2)nc(C2CC2)[nH+]1 ZINC000604756676 1054708254 /nfs/dbraw/zinc/70/82/54/1054708254.db2.gz QZZWYMDRBKYGIA-UHFFFAOYSA-N 1 2 322.437 4.398 20 0 DIADLO C[C@H](CC(=O)Nc1ccccc1Nc1ccccc1)n1cc[nH+]c1 ZINC001546042691 1054713586 /nfs/dbraw/zinc/71/35/86/1054713586.db2.gz UKXPPCXGIXYOEO-OAHLLOKOSA-N 1 2 320.396 4.217 20 0 DIADLO CCOc1cc(O)cc(C[N@@H+]2CCc3c(Cl)cccc3C2)c1 ZINC001235410376 1054714640 /nfs/dbraw/zinc/71/46/40/1054714640.db2.gz QGIWCSLXWXFTOG-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1cc(O)cc(C[N@H+]2CCc3c(Cl)cccc3C2)c1 ZINC001235410376 1054714661 /nfs/dbraw/zinc/71/46/61/1054714661.db2.gz QGIWCSLXWXFTOG-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](C)c2cc(F)ccc2OC)cs1 ZINC000179935192 1054715708 /nfs/dbraw/zinc/71/57/08/1054715708.db2.gz BOUNEWSQZRBGKW-GFCCVEGCSA-N 1 2 322.449 4.484 20 0 DIADLO CCC[C@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccccn1 ZINC000179919389 1054716354 /nfs/dbraw/zinc/71/63/54/1054716354.db2.gz SSHJKIHDTVBMNO-SFHVURJKSA-N 1 2 310.445 4.420 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](c2ccccc2)c2cccc(F)c2)s1 ZINC000179968368 1054721480 /nfs/dbraw/zinc/72/14/80/1054721480.db2.gz PWKJFCQWOROLQZ-SFHVURJKSA-N 1 2 312.413 4.470 20 0 DIADLO COc1ccc2ccccc2c1C[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000921505392 1054727046 /nfs/dbraw/zinc/72/70/46/1054727046.db2.gz XNMJTGIDOFQDDR-UHFFFAOYSA-N 1 2 324.424 4.424 20 0 DIADLO Cc1cccc(C)c1[C@H]1CCCN1C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001453218323 1054731658 /nfs/dbraw/zinc/73/16/58/1054731658.db2.gz AQMTZEVBEKUHRU-GOSISDBHSA-N 1 2 319.408 4.157 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)o1 ZINC000180063935 1054731859 /nfs/dbraw/zinc/73/18/59/1054731859.db2.gz RBJRZLQIGYOWNV-OAHLLOKOSA-N 1 2 310.319 4.243 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cncc(F)c1Cl ZINC001235498793 1054732822 /nfs/dbraw/zinc/73/28/22/1054732822.db2.gz JUQBGPRWQMAYTE-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cncc(F)c1Cl ZINC001235498793 1054732836 /nfs/dbraw/zinc/73/28/36/1054732836.db2.gz JUQBGPRWQMAYTE-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO Cc1ccccc1[C@H]([NH2+]Cc1nc(CC(C)C)no1)C(C)(C)C ZINC000180089108 1054733462 /nfs/dbraw/zinc/73/34/62/1054733462.db2.gz DBGQFWVJDMFCGT-SFHVURJKSA-N 1 2 315.461 4.454 20 0 DIADLO CC(C)c1cnc(NCc2cc[nH+]c(N3CCCCC3)c2)s1 ZINC000498909260 1054733937 /nfs/dbraw/zinc/73/39/37/1054733937.db2.gz LSVJWAQLXLHDFK-UHFFFAOYSA-N 1 2 316.474 4.264 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CC[C@@]1(C)O ZINC001235592615 1054751427 /nfs/dbraw/zinc/75/14/27/1054751427.db2.gz SHPJMEUWIXAGLY-LKFCYVNXSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CC[C@@]1(C)O ZINC001235592615 1054751440 /nfs/dbraw/zinc/75/14/40/1054751440.db2.gz SHPJMEUWIXAGLY-LKFCYVNXSA-N 1 2 322.663 4.240 20 0 DIADLO CCc1ccc([C@@H](NC(=O)c2cccc3[nH+]ccn32)C(C)C)cc1 ZINC001349339873 1054741084 /nfs/dbraw/zinc/74/10/84/1054741084.db2.gz FQGIBFNEFRMUDA-IBGZPJMESA-N 1 2 321.424 4.024 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000180205354 1054744407 /nfs/dbraw/zinc/74/44/07/1054744407.db2.gz GATDCMHPKQJVJM-IBGZPJMESA-N 1 2 320.440 4.142 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000180205354 1054744419 /nfs/dbraw/zinc/74/44/19/1054744419.db2.gz GATDCMHPKQJVJM-IBGZPJMESA-N 1 2 320.440 4.142 20 0 DIADLO c1coc([C@H]([NH2+]Cc2ccnn2C2CCC2)c2ccccc2)c1 ZINC000921508225 1054746076 /nfs/dbraw/zinc/74/60/76/1054746076.db2.gz BFKYVUOQSPIXTK-LJQANCHMSA-N 1 2 307.397 4.080 20 0 DIADLO Clc1cc(C[N@@H+]2CC[C@@]3(CCCO3)C2)cc(Cl)c1Cl ZINC001235590457 1054746886 /nfs/dbraw/zinc/74/68/86/1054746886.db2.gz JIQDDMPSZHIHFL-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1cc(C[N@H+]2CC[C@@]3(CCCO3)C2)cc(Cl)c1Cl ZINC001235590457 1054746897 /nfs/dbraw/zinc/74/68/97/1054746897.db2.gz JIQDDMPSZHIHFL-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1c(Br)cccc1C[N@@H+]1CCC[C@H]2C[C@H]21 ZINC001235609137 1054753761 /nfs/dbraw/zinc/75/37/61/1054753761.db2.gz YUIJSYQERILJSR-JOYOIKCWSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1c(Br)cccc1C[N@H+]1CCC[C@H]2C[C@H]21 ZINC001235609137 1054753777 /nfs/dbraw/zinc/75/37/77/1054753777.db2.gz YUIJSYQERILJSR-JOYOIKCWSA-N 1 2 300.627 4.087 20 0 DIADLO CC(C)(C)[C@H]1CSCC[N@@H+]1Cc1ccc(Cl)nc1Cl ZINC001473749547 1054757025 /nfs/dbraw/zinc/75/70/25/1054757025.db2.gz IHNANCXSBOOTQM-LLVKDONJSA-N 1 2 319.301 4.352 20 0 DIADLO CC(C)(C)[C@H]1CSCC[N@H+]1Cc1ccc(Cl)nc1Cl ZINC001473749547 1054757036 /nfs/dbraw/zinc/75/70/36/1054757036.db2.gz IHNANCXSBOOTQM-LLVKDONJSA-N 1 2 319.301 4.352 20 0 DIADLO Cc1cncc(Br)c1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001235643601 1054758836 /nfs/dbraw/zinc/75/88/36/1054758836.db2.gz VAJPOJKPKDEXPO-MRXNPFEDSA-N 1 2 317.230 4.100 20 0 DIADLO Cc1cncc(Br)c1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC001235643601 1054758848 /nfs/dbraw/zinc/75/88/48/1054758848.db2.gz VAJPOJKPKDEXPO-MRXNPFEDSA-N 1 2 317.230 4.100 20 0 DIADLO FC(F)(F)c1cc(C[NH2+]Cc2ncc(Cl)s2)cs1 ZINC000623778325 1054760504 /nfs/dbraw/zinc/76/05/04/1054760504.db2.gz MEXFEVDCYNCOND-UHFFFAOYSA-N 1 2 312.769 4.167 20 0 DIADLO CCCC[C@H](CC)C(=O)N1CC[NH2+][C@@H](c2ccc(Cl)cc2)C1 ZINC001454259510 1054762226 /nfs/dbraw/zinc/76/22/26/1054762226.db2.gz XPRGGOADGUQTAH-WMLDXEAASA-N 1 2 322.880 4.029 20 0 DIADLO Nc1ccnc(Cl)c1C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC001235674040 1054767708 /nfs/dbraw/zinc/76/77/08/1054767708.db2.gz LAMDZVXKTXICGD-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccnc(Cl)c1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC001235674040 1054767718 /nfs/dbraw/zinc/76/77/18/1054767718.db2.gz LAMDZVXKTXICGD-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2nc3cc(F)ccc3[nH]2)cc1 ZINC001235681370 1054772905 /nfs/dbraw/zinc/77/29/05/1054772905.db2.gz AGGQHJGLZVSABJ-KRWDZBQOSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2nc3cc(F)ccc3[nH]2)cc1 ZINC001235681370 1054772922 /nfs/dbraw/zinc/77/29/22/1054772922.db2.gz AGGQHJGLZVSABJ-KRWDZBQOSA-N 1 2 313.351 4.178 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2cc(Cl)cc(Cl)c2)s1 ZINC000351591091 1054776298 /nfs/dbraw/zinc/77/62/98/1054776298.db2.gz BMNJPIPPQHMZPC-ZETCQYMHSA-N 1 2 302.230 4.004 20 0 DIADLO CCC/C(C)=C/C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001349682079 1054785106 /nfs/dbraw/zinc/78/51/06/1054785106.db2.gz LAILHFFWPQVASS-SFKKXYGYSA-N 1 2 317.477 4.091 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC001235747608 1054794945 /nfs/dbraw/zinc/79/49/45/1054794945.db2.gz SXVUNHUZUSJWNE-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC001235747608 1054794958 /nfs/dbraw/zinc/79/49/58/1054794958.db2.gz SXVUNHUZUSJWNE-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[NH+]1CCC2(CCCO2)CC1 ZINC001235747636 1054798543 /nfs/dbraw/zinc/79/85/43/1054798543.db2.gz TVKSYGSGZPEPLK-UHFFFAOYSA-N 1 2 318.219 4.278 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1cc(-c2ccccc2)n(C)n1 ZINC000623894239 1054803913 /nfs/dbraw/zinc/80/39/13/1054803913.db2.gz NKBYHOWEYXSZKW-OLZOCXBDSA-N 1 2 324.428 4.104 20 0 DIADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1c(C)cc(Br)cc1C ZINC001235787576 1054806743 /nfs/dbraw/zinc/80/67/43/1054806743.db2.gz DMJSSNKDZOGVFS-INIZCTEOSA-N 1 2 324.262 4.009 20 0 DIADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1c(C)cc(Br)cc1C ZINC001235787576 1054806751 /nfs/dbraw/zinc/80/67/51/1054806751.db2.gz DMJSSNKDZOGVFS-INIZCTEOSA-N 1 2 324.262 4.009 20 0 DIADLO Cc1nc(F)ccc1C[N@H+](Cc1ccccc1)Cc1cccnc1 ZINC001235816398 1054813035 /nfs/dbraw/zinc/81/30/35/1054813035.db2.gz SVRAYFGPINQLIU-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+](Cc1ccccc1)Cc1cccnc1 ZINC001235816398 1054813048 /nfs/dbraw/zinc/81/30/48/1054813048.db2.gz SVRAYFGPINQLIU-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO c1nc2c(s1)CCC[C@@H]2[NH2+]Cc1ccccc1OC1CCC1 ZINC000623915382 1054817391 /nfs/dbraw/zinc/81/73/91/1054817391.db2.gz FLFKGJPLAUQQBA-HNNXBMFYSA-N 1 2 314.454 4.242 20 0 DIADLO COc1nccc(C[N@H+]2CC=C(c3ccccc3)CC2)c1Cl ZINC001235840126 1054820068 /nfs/dbraw/zinc/82/00/68/1054820068.db2.gz TXMRMXWYYAOVIM-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1nccc(C[N@@H+]2CC=C(c3ccccc3)CC2)c1Cl ZINC001235840126 1054820082 /nfs/dbraw/zinc/82/00/82/1054820082.db2.gz TXMRMXWYYAOVIM-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO Cn1c2ccccc2[nH+]c1N[C@@H]1CCSc2c(F)cccc21 ZINC000535691837 1054821305 /nfs/dbraw/zinc/82/13/05/1054821305.db2.gz OEYDQRNQMPJJAB-CYBMUJFWSA-N 1 2 313.401 4.361 20 0 DIADLO FC(F)c1ccc(CNc2[nH+]c3ccccc3n2C2CC2)cn1 ZINC000630953116 1054823761 /nfs/dbraw/zinc/82/37/61/1054823761.db2.gz CEUUJGRQLINTAF-UHFFFAOYSA-N 1 2 314.339 4.316 20 0 DIADLO Cc1nc2cc(C[N@@H+]3CCC[C@H]3c3nccs3)ccc2s1 ZINC001235864487 1054825325 /nfs/dbraw/zinc/82/53/25/1054825325.db2.gz ZJYMFDLBVNVICB-AWEZNQCLSA-N 1 2 315.467 4.398 20 0 DIADLO Cc1nc2cc(C[N@H+]3CCC[C@H]3c3nccs3)ccc2s1 ZINC001235864487 1054825339 /nfs/dbraw/zinc/82/53/39/1054825339.db2.gz ZJYMFDLBVNVICB-AWEZNQCLSA-N 1 2 315.467 4.398 20 0 DIADLO CCOc1cc(Cl)ccc1C[NH2+][C@H](C)c1nc(C)cs1 ZINC000623923905 1054828072 /nfs/dbraw/zinc/82/80/72/1054828072.db2.gz NZZNKSIEMGTOMD-LLVKDONJSA-N 1 2 310.850 4.354 20 0 DIADLO CC[C@H]([NH2+]CCc1ccc(C(C)(C)C)cc1)C(=O)OC(C)(C)C ZINC001474595538 1054836723 /nfs/dbraw/zinc/83/67/23/1054836723.db2.gz VPAXSGUWQXFUEU-KRWDZBQOSA-N 1 2 319.489 4.237 20 0 DIADLO COC[C@H]([NH2+][C@H]1CCCc2scnc21)c1cccc(Cl)c1 ZINC000623985394 1054840054 /nfs/dbraw/zinc/84/00/54/1054840054.db2.gz OXYOSKCWCAQELT-KBPBESRZSA-N 1 2 322.861 4.151 20 0 DIADLO COC[C@@H]([NH2+][C@H]1CCCc2scnc21)c1cccc(Cl)c1 ZINC000623985396 1054840267 /nfs/dbraw/zinc/84/02/67/1054840267.db2.gz OXYOSKCWCAQELT-UONOGXRCSA-N 1 2 322.861 4.151 20 0 DIADLO C[C@H](CC(=O)Oc1ccc(Cl)c2ccccc12)n1cc[nH+]c1 ZINC001349984228 1054840949 /nfs/dbraw/zinc/84/09/49/1054840949.db2.gz HYKHPCMDBMURGZ-GFCCVEGCSA-N 1 2 314.772 4.246 20 0 DIADLO Fc1cc2c(c(F)c1F)[C@@H]([NH2+][C@@H]1CCCc3scnc31)CC2 ZINC000623996133 1054851385 /nfs/dbraw/zinc/85/13/85/1054851385.db2.gz UTPKWRBYFVXISK-WDEREUQCSA-N 1 2 324.371 4.215 20 0 DIADLO C[C@H](CC(=O)Oc1ccc2oc3ccccc3c2c1)n1cc[nH+]c1 ZINC001350120351 1054870909 /nfs/dbraw/zinc/87/09/09/1054870909.db2.gz GKMAECWNXNZYHR-CYBMUJFWSA-N 1 2 320.348 4.339 20 0 DIADLO C[C@H]([NH2+]Cc1c(Cl)oc2ccccc21)c1cc2n(n1)CCC2 ZINC000624109282 1054879993 /nfs/dbraw/zinc/87/99/93/1054879993.db2.gz RYCVRSSWLQFQHR-NSHDSACASA-N 1 2 315.804 4.080 20 0 DIADLO C[C@H]([NH2+][C@@H](CCc1ccccc1)C(F)F)c1cccc(CO)c1 ZINC000624125066 1054884744 /nfs/dbraw/zinc/88/47/44/1054884744.db2.gz SBSNJXAVHFFRGO-KSSFIOAISA-N 1 2 319.395 4.096 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1c(F)cc(F)c(O)c1F ZINC001235998502 1054885287 /nfs/dbraw/zinc/88/52/87/1054885287.db2.gz OCDPDQZQZWNWLR-UHFFFAOYSA-N 1 2 322.330 4.170 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]C2c3ccccc3-c3ccccc32)s1 ZINC000353565264 1054906645 /nfs/dbraw/zinc/90/66/45/1054906645.db2.gz AOSXPSRVCROXRO-NSHDSACASA-N 1 2 307.422 4.267 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nccn1C(C)C)c1ccc(F)cc1F ZINC000181643035 1054927247 /nfs/dbraw/zinc/92/72/47/1054927247.db2.gz FQZTYCKQUGMHBT-QGZVFWFLSA-N 1 2 307.388 4.229 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2cnoc2C)s1 ZINC000181659639 1054927686 /nfs/dbraw/zinc/92/76/86/1054927686.db2.gz CQHPVKOKIFVAMB-UHFFFAOYSA-N 1 2 302.399 4.148 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2cnoc2C)s1 ZINC000181659639 1054927701 /nfs/dbraw/zinc/92/77/01/1054927701.db2.gz CQHPVKOKIFVAMB-UHFFFAOYSA-N 1 2 302.399 4.148 20 0 DIADLO Cc1ccccc1NC(=O)C[NH2+][C@H](C)c1c(F)cccc1Cl ZINC000181734838 1054931393 /nfs/dbraw/zinc/93/13/93/1054931393.db2.gz JHHAIYRYCOFKMH-GFCCVEGCSA-N 1 2 320.795 4.077 20 0 DIADLO CC(C)[N@@H+](Cc1ccc(Cl)cc1Cl)Cc1cccnc1N ZINC001236092601 1054941102 /nfs/dbraw/zinc/94/11/02/1054941102.db2.gz NFTSUFWKNOQPTJ-UHFFFAOYSA-N 1 2 324.255 4.381 20 0 DIADLO CC(C)[N@H+](Cc1ccc(Cl)cc1Cl)Cc1cccnc1N ZINC001236092601 1054941113 /nfs/dbraw/zinc/94/11/13/1054941113.db2.gz NFTSUFWKNOQPTJ-UHFFFAOYSA-N 1 2 324.255 4.381 20 0 DIADLO Nc1ccc2c(c1)CC[N@@H+](Cc1cccc(Cl)c1Cl)C2 ZINC001236105821 1054948903 /nfs/dbraw/zinc/94/89/03/1054948903.db2.gz RSDYVOHLDXNDMW-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1ccc2c(c1)CC[N@H+](Cc1cccc(Cl)c1Cl)C2 ZINC001236105821 1054948915 /nfs/dbraw/zinc/94/89/15/1054948915.db2.gz RSDYVOHLDXNDMW-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO CCCc1noc(C[NH2+][C@H](CC2CCCC2)c2ccccc2)n1 ZINC000181939578 1054949641 /nfs/dbraw/zinc/94/96/41/1054949641.db2.gz VZMUIFQXMZRAMS-QGZVFWFLSA-N 1 2 313.445 4.433 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)n1 ZINC000182094881 1054960479 /nfs/dbraw/zinc/96/04/79/1054960479.db2.gz OCWIPHQIKDBWKF-ZDUSSCGKSA-N 1 2 319.474 4.373 20 0 DIADLO Nc1ccc(Cl)nc1C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001236152506 1054970836 /nfs/dbraw/zinc/97/08/36/1054970836.db2.gz RDLQJSVPJYRNGC-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccc(Cl)nc1C[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001236152506 1054970837 /nfs/dbraw/zinc/97/08/37/1054970837.db2.gz RDLQJSVPJYRNGC-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nc(Cl)ccc1C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001236152505 1054970971 /nfs/dbraw/zinc/97/09/71/1054970971.db2.gz RAUAOKYEGXVAHU-CQSZACIVSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nc(Cl)ccc1C[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001236152505 1054970981 /nfs/dbraw/zinc/97/09/81/1054970981.db2.gz RAUAOKYEGXVAHU-CQSZACIVSA-N 1 2 322.239 4.308 20 0 DIADLO CCO[C@@H](C)c1nc(C[NH2+][C@H](CC)c2c(C)noc2C)cs1 ZINC000182407278 1054984682 /nfs/dbraw/zinc/98/46/82/1054984682.db2.gz CXNHWEFSCYENMV-GXTWGEPZSA-N 1 2 323.462 4.086 20 0 DIADLO CCO[C@H](C)c1nc(C[NH2+][C@@H](CC)c2c(C)noc2C)cs1 ZINC000182407226 1054986159 /nfs/dbraw/zinc/98/61/59/1054986159.db2.gz CXNHWEFSCYENMV-OCCSQVGLSA-N 1 2 323.462 4.086 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](CC)c2c(C)noc2C)cs1 ZINC000182404389 1054986181 /nfs/dbraw/zinc/98/61/81/1054986181.db2.gz FQMOHDZMBLYLJK-AWEZNQCLSA-N 1 2 307.463 4.331 20 0 DIADLO Clc1cnc(C[N@@H+]2CC[C@H](Nc3ccccc3)C2)c(Cl)c1 ZINC000182642812 1055000321 /nfs/dbraw/zinc/00/03/21/1055000321.db2.gz MTDRWWGYZSXKQC-AWEZNQCLSA-N 1 2 322.239 4.075 20 0 DIADLO Clc1cnc(C[N@H+]2CC[C@H](Nc3ccccc3)C2)c(Cl)c1 ZINC000182642812 1055000336 /nfs/dbraw/zinc/00/03/36/1055000336.db2.gz MTDRWWGYZSXKQC-AWEZNQCLSA-N 1 2 322.239 4.075 20 0 DIADLO CCC[C@@H](C)C[NH2+][C@@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000182681350 1055004409 /nfs/dbraw/zinc/00/44/09/1055004409.db2.gz FYAIFMOFFNVYTB-IAQYHMDHSA-N 1 2 307.825 4.147 20 0 DIADLO Fc1cc(N[C@@H]2CCCOc3ccccc32)ccc1-n1cc[nH+]c1 ZINC000182909394 1055016298 /nfs/dbraw/zinc/01/62/98/1055016298.db2.gz YQZLSYLDNBMMRI-QGZVFWFLSA-N 1 2 323.371 4.337 20 0 DIADLO COc1ccccc1[C@H](C)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000182909200 1055016584 /nfs/dbraw/zinc/01/65/84/1055016584.db2.gz ZOZLVJYLICXYRY-ZDUSSCGKSA-N 1 2 311.360 4.193 20 0 DIADLO COc1ccc2c(c1)[C@H](Nc1ccc(-n3cc[nH+]c3)c(F)c1)CC2 ZINC000182911906 1055016969 /nfs/dbraw/zinc/01/69/69/1055016969.db2.gz DCIWYKVOKHJGCB-GOSISDBHSA-N 1 2 323.371 4.119 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1c(F)cc(C)cc1OC ZINC001236229433 1055018896 /nfs/dbraw/zinc/01/88/96/1055018896.db2.gz FSVGVNKZIYULST-UHFFFAOYSA-N 1 2 312.344 4.004 20 0 DIADLO COc1cc(C)cc(F)c1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001236230817 1055022679 /nfs/dbraw/zinc/02/26/79/1055022679.db2.gz UNQMPURFZITZMH-UHFFFAOYSA-N 1 2 309.331 4.150 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2ncc(C(C)C)s2)cc1 ZINC000182976372 1055022998 /nfs/dbraw/zinc/02/29/98/1055022998.db2.gz ICESRKXGBFRQAM-ZDUSSCGKSA-N 1 2 304.459 4.468 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2ncc(C(C)C)s2)cc1 ZINC000182976372 1055023012 /nfs/dbraw/zinc/02/30/12/1055023012.db2.gz ICESRKXGBFRQAM-ZDUSSCGKSA-N 1 2 304.459 4.468 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C)c1nccn1C ZINC000183117634 1055029273 /nfs/dbraw/zinc/02/92/73/1055029273.db2.gz XORIUPQTKZXTFX-XHDPSFHLSA-N 1 2 307.388 4.136 20 0 DIADLO FC(F)(F)[C@@H]1CC=C(c2ccc(Cn3cc[nH+]c3)cn2)CC1 ZINC001236252317 1055035861 /nfs/dbraw/zinc/03/58/61/1055035861.db2.gz PCGAAQOIKAEELS-CQSZACIVSA-N 1 2 307.319 4.072 20 0 DIADLO O=C(/C=C/C1CCCCCC1)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC001535996812 1055037252 /nfs/dbraw/zinc/03/72/52/1055037252.db2.gz VCUUQKSYWLIDOY-FMIVXFBMSA-N 1 2 323.440 4.015 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2ccccc2F)c2ccccc2)nc1 ZINC000183292495 1055039449 /nfs/dbraw/zinc/03/94/49/1055039449.db2.gz NKVYJJRPKAOWAS-LJQANCHMSA-N 1 2 310.347 4.239 20 0 DIADLO Cc1ccc(C)c(-c2cccc(Cl)c2C[NH+]2CCOCC2)c1 ZINC001236267162 1055045102 /nfs/dbraw/zinc/04/51/02/1055045102.db2.gz QNPRBUNMWWPWTF-UHFFFAOYSA-N 1 2 315.844 4.456 20 0 DIADLO C/C(=C\c1ccccc1Cl)C(=O)NCc1c[nH+]c(C)cc1C ZINC001536109229 1055048592 /nfs/dbraw/zinc/04/85/92/1055048592.db2.gz IYSSCVSWORMCBO-UKTHLTGXSA-N 1 2 314.816 4.072 20 0 DIADLO CCCOc1c(F)c(F)c(-c2cccc3[nH+]ccn32)c(F)c1F ZINC001236326588 1055059370 /nfs/dbraw/zinc/05/93/70/1055059370.db2.gz HUNXDFOPQNRAEG-UHFFFAOYSA-N 1 2 324.277 4.347 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1ccc(F)c(OC(C)C)c1F ZINC001236345601 1055070290 /nfs/dbraw/zinc/07/02/90/1055070290.db2.gz ZDRFXUBEYKHYET-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Cc1cc(Cl)c(C[N@@H+]2CCc3c(N)cccc3C2)c(Cl)c1 ZINC001236365113 1055074493 /nfs/dbraw/zinc/07/44/93/1055074493.db2.gz DDYLJTGVMWMZEL-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO Cc1cc(Cl)c(C[N@H+]2CCc3c(N)cccc3C2)c(Cl)c1 ZINC001236365113 1055074510 /nfs/dbraw/zinc/07/45/10/1055074510.db2.gz DDYLJTGVMWMZEL-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1cccc(C(F)(F)F)c1 ZINC000367617455 1055079658 /nfs/dbraw/zinc/07/96/58/1055079658.db2.gz NITDJDBGZBXJOD-IINYFYTJSA-N 1 2 309.335 4.157 20 0 DIADLO COc1cc(OC(F)(F)F)ccc1-c1ccc2[nH+]ccn2c1C ZINC001236392113 1055090749 /nfs/dbraw/zinc/09/07/49/1055090749.db2.gz OIZPAFMQSCSXOH-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2nc3ccccc3s2)C2CC2)s1 ZINC000185290418 1055091191 /nfs/dbraw/zinc/09/11/91/1055091191.db2.gz TVYKFKAVFXLIOI-OAHLLOKOSA-N 1 2 315.467 4.302 20 0 DIADLO c1csc(C2([NH2+]Cc3nc(-c4ccccc4)c[nH]3)CCCC2)n1 ZINC000194317587 1055120828 /nfs/dbraw/zinc/12/08/28/1055120828.db2.gz NMUZQAVAPNXCOP-UHFFFAOYSA-N 1 2 324.453 4.092 20 0 DIADLO c1cn(-c2ccc(CNc3nccc4sccc43)cc2)c[nH+]1 ZINC000194557378 1055130008 /nfs/dbraw/zinc/13/00/08/1055130008.db2.gz ZZYWXTYUSZXQGS-UHFFFAOYSA-N 1 2 306.394 4.094 20 0 DIADLO CC1CCC(N(C(=O)c2ccc(-n3cc[nH+]c3)cc2)C2CC2)CC1 ZINC000194966819 1055141428 /nfs/dbraw/zinc/14/14/28/1055141428.db2.gz RHUDCXUASWZVEW-UHFFFAOYSA-N 1 2 323.440 4.056 20 0 DIADLO Cc1cc(CNC(=O)[C@@](C)(Cc2ccccc2)C(C)C)cc(C)[nH+]1 ZINC001536666041 1055150633 /nfs/dbraw/zinc/15/06/33/1055150633.db2.gz IWMUJXYJBLGMEB-NRFANRHFSA-N 1 2 324.468 4.220 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cncc(OCc2ccccc2)c1 ZINC001236573049 1055195638 /nfs/dbraw/zinc/19/56/38/1055195638.db2.gz GJCCAAMHHSSWKV-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO CCCOC1CC[NH+](Cc2c(C)cc(Cl)nc2Cl)CC1 ZINC001236604738 1055203801 /nfs/dbraw/zinc/20/38/01/1055203801.db2.gz LRNATBGEGBVVEQ-UHFFFAOYSA-N 1 2 317.260 4.088 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cnc(Cl)c(C(F)(F)F)c1 ZINC001236635425 1055208883 /nfs/dbraw/zinc/20/88/83/1055208883.db2.gz MHZVYAUIMBGGQZ-VHSXEESVSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cnc(Cl)c(C(F)(F)F)c1 ZINC001236635425 1055208889 /nfs/dbraw/zinc/20/88/89/1055208889.db2.gz MHZVYAUIMBGGQZ-VHSXEESVSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)C2(CC2)C1 ZINC001236631205 1055210422 /nfs/dbraw/zinc/21/04/22/1055210422.db2.gz IEZIMXCXVKJFQB-SECBINFHSA-N 1 2 304.743 4.128 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)C2(CC2)C1 ZINC001236631205 1055210428 /nfs/dbraw/zinc/21/04/28/1055210428.db2.gz IEZIMXCXVKJFQB-SECBINFHSA-N 1 2 304.743 4.128 20 0 DIADLO Fc1c(Cl)cc(C[N@@H+]2CC[C@H]3CCCO[C@H]3C2)cc1Cl ZINC001236651536 1055211948 /nfs/dbraw/zinc/21/19/48/1055211948.db2.gz LJRCEIHRXKGMJM-RISCZKNCSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1c(Cl)cc(C[N@H+]2CC[C@H]3CCCO[C@H]3C2)cc1Cl ZINC001236651536 1055211956 /nfs/dbraw/zinc/21/19/56/1055211956.db2.gz LJRCEIHRXKGMJM-RISCZKNCSA-N 1 2 318.219 4.133 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(Cl)c(F)c(Cl)c2)CCCO1 ZINC001236660997 1055218914 /nfs/dbraw/zinc/21/89/14/1055218914.db2.gz HLNGXJIKUSXOQB-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(Cl)c(F)c(Cl)c2)CCCO1 ZINC001236660997 1055218921 /nfs/dbraw/zinc/21/89/21/1055218921.db2.gz HLNGXJIKUSXOQB-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2Cc2cccc3sccc32)no1 ZINC001236688378 1055229860 /nfs/dbraw/zinc/22/98/60/1055229860.db2.gz BIKUJGPLNBSMIM-HNNXBMFYSA-N 1 2 313.426 4.320 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2Cc2cccc3sccc32)no1 ZINC001236688378 1055229871 /nfs/dbraw/zinc/22/98/71/1055229871.db2.gz BIKUJGPLNBSMIM-HNNXBMFYSA-N 1 2 313.426 4.320 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(F)c(O)c1 ZINC001236708755 1055238602 /nfs/dbraw/zinc/23/86/02/1055238602.db2.gz SWFKTZKNSCDBOE-QGZVFWFLSA-N 1 2 315.388 4.015 20 0 DIADLO COC(=O)c1cc(Cl)cc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1 ZINC001236777014 1055255234 /nfs/dbraw/zinc/25/52/34/1055255234.db2.gz ZXGLNTAUQXKRPD-QGZVFWFLSA-N 1 2 315.800 4.074 20 0 DIADLO COC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@@H]2c2ccccc2)c1 ZINC001236777014 1055255245 /nfs/dbraw/zinc/25/52/45/1055255245.db2.gz ZXGLNTAUQXKRPD-QGZVFWFLSA-N 1 2 315.800 4.074 20 0 DIADLO COc1cc(C[N@H+](C)Cc2cccc(Cl)c2)c(F)cc1F ZINC001236820716 1055276363 /nfs/dbraw/zinc/27/63/63/1055276363.db2.gz HUYSCHQEAWOHNM-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2cccc(Cl)c2)c(F)cc1F ZINC001236820716 1055276378 /nfs/dbraw/zinc/27/63/78/1055276378.db2.gz HUYSCHQEAWOHNM-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccc(C)nc2)c(F)cc1F ZINC001236833219 1055282360 /nfs/dbraw/zinc/28/23/60/1055282360.db2.gz ZOBKQHMEQNIOMD-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccc(C)nc2)c(F)cc1F ZINC001236833219 1055282371 /nfs/dbraw/zinc/28/23/71/1055282371.db2.gz ZOBKQHMEQNIOMD-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c(F)cc1F ZINC001236834346 1055285494 /nfs/dbraw/zinc/28/54/94/1055285494.db2.gz JQNQFYNHRNSMRF-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c(F)cc1F ZINC001236834346 1055285503 /nfs/dbraw/zinc/28/55/03/1055285503.db2.gz JQNQFYNHRNSMRF-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1c(CNc2ccc3c([nH+]2)CCOC3)cccc1C(F)(F)F ZINC001168534594 1055286359 /nfs/dbraw/zinc/28/63/59/1055286359.db2.gz KJAHCGYZUYGOLO-UHFFFAOYSA-N 1 2 322.330 4.094 20 0 DIADLO CCOc1cncc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1 ZINC001236840284 1055287394 /nfs/dbraw/zinc/28/73/94/1055287394.db2.gz LBPRMYDDFGAVLA-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cncc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1 ZINC001236840284 1055287406 /nfs/dbraw/zinc/28/74/06/1055287406.db2.gz LBPRMYDDFGAVLA-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cncc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c1 ZINC001236846199 1055290113 /nfs/dbraw/zinc/29/01/13/1055290113.db2.gz UORIHGPBSJKBJF-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cncc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)c1 ZINC001236846199 1055290120 /nfs/dbraw/zinc/29/01/20/1055290120.db2.gz UORIHGPBSJKBJF-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@@H](F)CC2)cc(Br)c1F ZINC001236848835 1055293256 /nfs/dbraw/zinc/29/32/56/1055293256.db2.gz UMYDKFUJWJRTGS-SNVBAGLBSA-N 1 2 322.168 4.051 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@@H](F)CC2)cc(Br)c1F ZINC001236848835 1055293270 /nfs/dbraw/zinc/29/32/70/1055293270.db2.gz UMYDKFUJWJRTGS-SNVBAGLBSA-N 1 2 322.168 4.051 20 0 DIADLO Brc1ccc2c(c1)C[N@@H+](CCCc1ccsc1)C2 ZINC000765059627 1055322260 /nfs/dbraw/zinc/32/22/60/1055322260.db2.gz ZDAFJEWDPHRWPF-UHFFFAOYSA-N 1 2 322.271 4.459 20 0 DIADLO Brc1ccc2c(c1)C[N@H+](CCCc1ccsc1)C2 ZINC000765059627 1055322275 /nfs/dbraw/zinc/32/22/75/1055322275.db2.gz ZDAFJEWDPHRWPF-UHFFFAOYSA-N 1 2 322.271 4.459 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cn2ccc(-c3cccs3)n2)n1 ZINC000765105776 1055327002 /nfs/dbraw/zinc/32/70/02/1055327002.db2.gz MZXFZTWMMTVDOT-KRWDZBQOSA-N 1 2 324.453 4.110 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cn2ccc(-c3cccs3)n2)n1 ZINC000765105776 1055327019 /nfs/dbraw/zinc/32/70/19/1055327019.db2.gz MZXFZTWMMTVDOT-KRWDZBQOSA-N 1 2 324.453 4.110 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cn2ccc(-c3cccs3)n2)n1 ZINC000765105779 1055328415 /nfs/dbraw/zinc/32/84/15/1055328415.db2.gz MZXFZTWMMTVDOT-QGZVFWFLSA-N 1 2 324.453 4.110 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cn2ccc(-c3cccs3)n2)n1 ZINC000765105779 1055328432 /nfs/dbraw/zinc/32/84/32/1055328432.db2.gz MZXFZTWMMTVDOT-QGZVFWFLSA-N 1 2 324.453 4.110 20 0 DIADLO C[N@H+](Cc1ccno1)Cc1ccc(-c2ccc(Cl)cc2)nc1 ZINC001237021980 1055342593 /nfs/dbraw/zinc/34/25/93/1055342593.db2.gz YOJKRZXKVMFQSW-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1ccno1)Cc1ccc(-c2ccc(Cl)cc2)nc1 ZINC001237021980 1055342604 /nfs/dbraw/zinc/34/26/04/1055342604.db2.gz YOJKRZXKVMFQSW-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO Cc1c(CNc2ccc(N(C)C)c[nH+]2)cccc1C(F)(F)F ZINC001168538226 1055343448 /nfs/dbraw/zinc/34/34/48/1055343448.db2.gz ASPAVRQAKBCNJQ-UHFFFAOYSA-N 1 2 309.335 4.087 20 0 DIADLO CNc1ccc(Nc2c(Cl)cc(C(C)=O)cc2Cl)c[nH+]1 ZINC001203456477 1055352436 /nfs/dbraw/zinc/35/24/36/1055352436.db2.gz FPGYVNNLKMBZOK-UHFFFAOYSA-N 1 2 310.184 4.376 20 0 DIADLO Cc1cc(C)c(C(=O)N(C)[C@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC001537555317 1055358403 /nfs/dbraw/zinc/35/84/03/1055358403.db2.gz YRMMZUPVLWOVOB-CQSZACIVSA-N 1 2 316.832 4.493 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1cccc(OC(C)(C)C)c1)C2 ZINC001237107695 1055375128 /nfs/dbraw/zinc/37/51/28/1055375128.db2.gz YLRRRDSBHZDSEY-UHFFFAOYSA-N 1 2 311.425 4.388 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1cccc(OC(C)(C)C)c1)C2 ZINC001237107695 1055375139 /nfs/dbraw/zinc/37/51/39/1055375139.db2.gz YLRRRDSBHZDSEY-UHFFFAOYSA-N 1 2 311.425 4.388 20 0 DIADLO Clc1cccc2c(C[N@@H+]3CCC[C@@H]3c3ncccn3)ccnc12 ZINC001237156292 1055386795 /nfs/dbraw/zinc/38/67/95/1055386795.db2.gz ZVNMENGZUKYZFJ-MRXNPFEDSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1cccc2c(C[N@H+]3CCC[C@@H]3c3ncccn3)ccnc12 ZINC001237156292 1055386809 /nfs/dbraw/zinc/38/68/09/1055386809.db2.gz ZVNMENGZUKYZFJ-MRXNPFEDSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1cccc2c(C[N@@H+]3CCC[C@H]3c3ncccn3)ccnc12 ZINC001237156290 1055388270 /nfs/dbraw/zinc/38/82/70/1055388270.db2.gz ZVNMENGZUKYZFJ-INIZCTEOSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1cccc2c(C[N@H+]3CCC[C@H]3c3ncccn3)ccnc12 ZINC001237156290 1055388287 /nfs/dbraw/zinc/38/82/87/1055388287.db2.gz ZVNMENGZUKYZFJ-INIZCTEOSA-N 1 2 324.815 4.015 20 0 DIADLO COc1nc(Cl)ccc1C[N@H+](C)Cc1cccc(Cl)c1 ZINC001237243771 1055408092 /nfs/dbraw/zinc/40/80/92/1055408092.db2.gz HGYQUWKVZLLDLF-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1nc(Cl)ccc1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001237245771 1055407457 /nfs/dbraw/zinc/40/74/57/1055407457.db2.gz XZLKARWXZJMYGF-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nc(Cl)ccc1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001237245771 1055407463 /nfs/dbraw/zinc/40/74/63/1055407463.db2.gz XZLKARWXZJMYGF-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nc(Cl)ccc1C[N@@H+](C)Cc1cccc(Cl)c1 ZINC001237243771 1055408102 /nfs/dbraw/zinc/40/81/02/1055408102.db2.gz HGYQUWKVZLLDLF-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc2nccc(Cl)c2c1 ZINC001237273592 1055412476 /nfs/dbraw/zinc/41/24/76/1055412476.db2.gz UJEZWPVSICCVQQ-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccc2nccc(Cl)c2c1 ZINC001237273592 1055412481 /nfs/dbraw/zinc/41/24/81/1055412481.db2.gz UJEZWPVSICCVQQ-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc(C(F)F)c(OC)c1)C2 ZINC001237281268 1055414876 /nfs/dbraw/zinc/41/48/76/1055414876.db2.gz TYNSBKRAKIMBBZ-UHFFFAOYSA-N 1 2 319.351 4.157 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc(C(F)F)c(OC)c1)C2 ZINC001237281268 1055414886 /nfs/dbraw/zinc/41/48/86/1055414886.db2.gz TYNSBKRAKIMBBZ-UHFFFAOYSA-N 1 2 319.351 4.157 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc(Cl)c(Cl)c3)cc2[nH+]1 ZINC000010895998 1055420010 /nfs/dbraw/zinc/42/00/10/1055420010.db2.gz FVPRAWXXICGJQU-UHFFFAOYSA-N 1 2 320.179 4.430 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccncc2C(F)(F)F)cn1 ZINC001237295994 1055421795 /nfs/dbraw/zinc/42/17/95/1055421795.db2.gz VIEUNLFVSKMMJE-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccncc2C(F)(F)F)cn1 ZINC001237295994 1055421804 /nfs/dbraw/zinc/42/18/04/1055421804.db2.gz VIEUNLFVSKMMJE-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO CC(=O)C1CC[NH+](Cc2c(Cl)ccc(C)c2Cl)CC1 ZINC001237329328 1055429231 /nfs/dbraw/zinc/42/92/31/1055429231.db2.gz CHKKXHMBIACJMZ-UHFFFAOYSA-N 1 2 300.229 4.103 20 0 DIADLO FC(F)c1ccc(NC2CCN(c3cccc[nH+]3)CC2)cc1 ZINC000386207754 1055433673 /nfs/dbraw/zinc/43/36/73/1055433673.db2.gz GRXFXCVNZGYUMT-UHFFFAOYSA-N 1 2 303.356 4.100 20 0 DIADLO CC(C)c1ccc([C@H](Nc2[nH+]cnc3c2cnn3C)C(C)C)cc1 ZINC000014267645 1055433911 /nfs/dbraw/zinc/43/39/11/1055433911.db2.gz PELHHBZXYFKATJ-QGZVFWFLSA-N 1 2 323.444 4.296 20 0 DIADLO CC[N@H+](Cc1ccc(C)cc1)Cc1cnccc1Br ZINC001237389276 1055446128 /nfs/dbraw/zinc/44/61/28/1055446128.db2.gz NFXRRCYPXIZXQY-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccc(C)cc1)Cc1cnccc1Br ZINC001237389276 1055446131 /nfs/dbraw/zinc/44/61/31/1055446131.db2.gz NFXRRCYPXIZXQY-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC1(C)C[N@H+](Cc2c(Cl)cc(F)cc2Cl)CCCO1 ZINC001237597026 1055482815 /nfs/dbraw/zinc/48/28/15/1055482815.db2.gz NUDLKXQUCZVRJZ-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(Cl)cc(F)cc2Cl)CCCO1 ZINC001237597026 1055482818 /nfs/dbraw/zinc/48/28/18/1055482818.db2.gz NUDLKXQUCZVRJZ-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO Fc1ccccc1[C@H]1CCCC[N@@H+]1Cc1cc2ccccn2n1 ZINC001237443499 1055453162 /nfs/dbraw/zinc/45/31/62/1055453162.db2.gz UNZIUDZXTCMMHN-LJQANCHMSA-N 1 2 309.388 4.201 20 0 DIADLO Fc1ccccc1[C@H]1CCCC[N@H+]1Cc1cc2ccccn2n1 ZINC001237443499 1055453164 /nfs/dbraw/zinc/45/31/64/1055453164.db2.gz UNZIUDZXTCMMHN-LJQANCHMSA-N 1 2 309.388 4.201 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1cn2cc(Cl)ccc2n1 ZINC000016420980 1055455331 /nfs/dbraw/zinc/45/53/31/1055455331.db2.gz MVPMZBYASWKQAK-LLVKDONJSA-N 1 2 317.845 4.169 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1cn2cc(Cl)ccc2n1 ZINC000016420980 1055455338 /nfs/dbraw/zinc/45/53/38/1055455338.db2.gz MVPMZBYASWKQAK-LLVKDONJSA-N 1 2 317.845 4.169 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1c(F)ccc(Br)c1F ZINC000230341222 1055455822 /nfs/dbraw/zinc/45/58/22/1055455822.db2.gz NVCPTAVVMRCEIY-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1c(F)ccc(Br)c1F ZINC000230341222 1055455827 /nfs/dbraw/zinc/45/58/27/1055455827.db2.gz NVCPTAVVMRCEIY-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO Cc1cccc(-c2cccc(C(=O)Nc3c(C)c[nH+]cc3C)c2)c1 ZINC001537891611 1055468734 /nfs/dbraw/zinc/46/87/34/1055468734.db2.gz JXCJVPMGKSDRTF-UHFFFAOYSA-N 1 2 316.404 4.348 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cccc(-c3ccccc3)n1)C2 ZINC001237545983 1055473081 /nfs/dbraw/zinc/47/30/81/1055473081.db2.gz HELCHABMIUXWTB-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cccc(-c3ccccc3)n1)C2 ZINC001237545983 1055473088 /nfs/dbraw/zinc/47/30/88/1055473088.db2.gz HELCHABMIUXWTB-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO Cc1cc(NCc2cnc3ccccc3c2)ccc1-n1cc[nH+]c1 ZINC001620854239 1055482487 /nfs/dbraw/zinc/48/24/87/1055482487.db2.gz WIGQEVJIIGUMPJ-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO CCCO[C@@H]1CC[N@H+](Cc2c(Cl)cc(F)cc2Cl)C1 ZINC001237597273 1055483167 /nfs/dbraw/zinc/48/31/67/1055483167.db2.gz QDSFTJDLPUQEBJ-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@@H]1CC[N@@H+](Cc2c(Cl)cc(F)cc2Cl)C1 ZINC001237597273 1055483175 /nfs/dbraw/zinc/48/31/75/1055483175.db2.gz QDSFTJDLPUQEBJ-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO Cc1cc(NCc2ccc3cc[nH]c3c2)ccc1-n1cc[nH+]c1 ZINC001620854109 1055483459 /nfs/dbraw/zinc/48/34/59/1055483459.db2.gz QJYBMLHAHXLVDK-UHFFFAOYSA-N 1 2 302.381 4.274 20 0 DIADLO CC(C)c1cc(Br)ccc1C[N@@H+]1CC[C@H](F)C1 ZINC001237733903 1055517647 /nfs/dbraw/zinc/51/76/47/1055517647.db2.gz XHCOSDGMPWBHKC-ZDUSSCGKSA-N 1 2 300.215 4.116 20 0 DIADLO CC(C)c1cc(Br)ccc1C[N@H+]1CC[C@H](F)C1 ZINC001237733903 1055517653 /nfs/dbraw/zinc/51/76/53/1055517653.db2.gz XHCOSDGMPWBHKC-ZDUSSCGKSA-N 1 2 300.215 4.116 20 0 DIADLO Cc1cc(CNc2ccc(N3CCCCC3)[nH+]c2)cnc1Cl ZINC001620869194 1055495525 /nfs/dbraw/zinc/49/55/25/1055495525.db2.gz JETWVAABYZFXIZ-UHFFFAOYSA-N 1 2 316.836 4.041 20 0 DIADLO Fc1ccc(CNc2ccc(N3CCCCC3)[nH+]c2)c(F)c1F ZINC001620869135 1055496312 /nfs/dbraw/zinc/49/63/12/1055496312.db2.gz FPYAEDQMRZESCP-UHFFFAOYSA-N 1 2 321.346 4.101 20 0 DIADLO CCc1[nH]ncc1C[N@@H+]1CC[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001237658790 1055496983 /nfs/dbraw/zinc/49/69/83/1055496983.db2.gz LJHPBTAISPDAHY-LBPRGKRZSA-N 1 2 324.255 4.268 20 0 DIADLO CCc1[nH]ncc1C[N@H+]1CC[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001237658790 1055496988 /nfs/dbraw/zinc/49/69/88/1055496988.db2.gz LJHPBTAISPDAHY-LBPRGKRZSA-N 1 2 324.255 4.268 20 0 DIADLO CCCOc1ccc(C[NH2+]Cc2nc(C(C)(C)C)co2)cc1 ZINC000921546455 1055499987 /nfs/dbraw/zinc/49/99/87/1055499987.db2.gz DSGBPVIJCOEFCP-UHFFFAOYSA-N 1 2 302.418 4.051 20 0 DIADLO Cc1cc(C)c(Cl)c(C[N@@H+]2CCC(=O)[C@H]3CCCC[C@H]32)c1 ZINC001237698965 1055506071 /nfs/dbraw/zinc/50/60/71/1055506071.db2.gz SEFSICWEBNKILU-JKSUJKDBSA-N 1 2 305.849 4.290 20 0 DIADLO Cc1cc(C)c(Cl)c(C[N@H+]2CCC(=O)[C@H]3CCCC[C@H]32)c1 ZINC001237698965 1055506079 /nfs/dbraw/zinc/50/60/79/1055506079.db2.gz SEFSICWEBNKILU-JKSUJKDBSA-N 1 2 305.849 4.290 20 0 DIADLO CCc1cc(C[N@@H+]2CCC(=O)[C@H]3CCCC[C@@H]32)ccc1Cl ZINC001237739432 1055518302 /nfs/dbraw/zinc/51/83/02/1055518302.db2.gz YGSPELGQUQLDAI-RDJZCZTQSA-N 1 2 305.849 4.236 20 0 DIADLO CCc1cc(C[N@H+]2CCC(=O)[C@H]3CCCC[C@@H]32)ccc1Cl ZINC001237739432 1055518314 /nfs/dbraw/zinc/51/83/14/1055518314.db2.gz YGSPELGQUQLDAI-RDJZCZTQSA-N 1 2 305.849 4.236 20 0 DIADLO CC(C)c1cc(Br)ccc1C[N@H+](C)Cc1ccon1 ZINC001237735790 1055518422 /nfs/dbraw/zinc/51/84/22/1055518422.db2.gz LMLDAWQXCJSZOY-UHFFFAOYSA-N 1 2 323.234 4.193 20 0 DIADLO CC(C)c1cc(Br)ccc1C[N@@H+](C)Cc1ccon1 ZINC001237735790 1055518430 /nfs/dbraw/zinc/51/84/30/1055518430.db2.gz LMLDAWQXCJSZOY-UHFFFAOYSA-N 1 2 323.234 4.193 20 0 DIADLO C[N@H+](Cc1cc(-c2cccc(Cl)c2)no1)Cc1ccccn1 ZINC001237767724 1055527761 /nfs/dbraw/zinc/52/77/61/1055527761.db2.gz QIXFVNCKCWEEEZ-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1cc(-c2cccc(Cl)c2)no1)Cc1ccccn1 ZINC001237767724 1055527773 /nfs/dbraw/zinc/52/77/73/1055527773.db2.gz QIXFVNCKCWEEEZ-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO Clc1cccc(-c2cc(C[N@@H+]3CCc4occc4C3)on2)c1 ZINC001237775952 1055529069 /nfs/dbraw/zinc/52/90/69/1055529069.db2.gz CUDQKUSQXSRNBB-UHFFFAOYSA-N 1 2 314.772 4.146 20 0 DIADLO Clc1cccc(-c2cc(C[N@H+]3CCc4occc4C3)on2)c1 ZINC001237775952 1055529082 /nfs/dbraw/zinc/52/90/82/1055529082.db2.gz CUDQKUSQXSRNBB-UHFFFAOYSA-N 1 2 314.772 4.146 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(F)c(C)n1 ZINC001237821874 1055537267 /nfs/dbraw/zinc/53/72/67/1055537267.db2.gz GGJIOWAAFWQPLY-GOSISDBHSA-N 1 2 314.404 4.013 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(F)c(C)n1 ZINC001237821874 1055537279 /nfs/dbraw/zinc/53/72/79/1055537279.db2.gz GGJIOWAAFWQPLY-GOSISDBHSA-N 1 2 314.404 4.013 20 0 DIADLO CCc1ncc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)s1 ZINC001237830090 1055540468 /nfs/dbraw/zinc/54/04/68/1055540468.db2.gz FNLZGKJEGAPUES-AWEZNQCLSA-N 1 2 308.397 4.321 20 0 DIADLO CCc1ncc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)s1 ZINC001237830090 1055540477 /nfs/dbraw/zinc/54/04/77/1055540477.db2.gz FNLZGKJEGAPUES-AWEZNQCLSA-N 1 2 308.397 4.321 20 0 DIADLO CCOc1cc(F)cc(C[N@H+](C)Cc2ccc(F)cc2F)c1 ZINC001237920833 1055557739 /nfs/dbraw/zinc/55/77/39/1055557739.db2.gz OPZOTFGYWMJXCW-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CCOc1cc(F)cc(C[N@@H+](C)Cc2ccc(F)cc2F)c1 ZINC001237920833 1055557748 /nfs/dbraw/zinc/55/77/48/1055557748.db2.gz OPZOTFGYWMJXCW-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC(C)Oc1cccc(NCc2cc(-n3cc[nH+]c3)cs2)c1 ZINC001620945523 1055561841 /nfs/dbraw/zinc/56/18/41/1055561841.db2.gz IVIUNNLGMYRIMR-UHFFFAOYSA-N 1 2 313.426 4.333 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(C(F)(F)F)s2)CCC1(F)F ZINC001237942109 1055563611 /nfs/dbraw/zinc/56/36/11/1055563611.db2.gz BTTDKJYCHJMKEB-UHFFFAOYSA-N 1 2 314.323 4.029 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(C(F)(F)F)s2)CCC1(F)F ZINC001237942109 1055563614 /nfs/dbraw/zinc/56/36/14/1055563614.db2.gz BTTDKJYCHJMKEB-UHFFFAOYSA-N 1 2 314.323 4.029 20 0 DIADLO C[N@H+](C/C=C/c1ccccc1)Cc1cnc(C(F)(F)F)s1 ZINC001237953285 1055564425 /nfs/dbraw/zinc/56/44/25/1055564425.db2.gz XERNEZJBEDVUCX-VMPITWQZSA-N 1 2 312.360 4.307 20 0 DIADLO C[N@@H+](C/C=C/c1ccccc1)Cc1cnc(C(F)(F)F)s1 ZINC001237953285 1055564440 /nfs/dbraw/zinc/56/44/40/1055564440.db2.gz XERNEZJBEDVUCX-VMPITWQZSA-N 1 2 312.360 4.307 20 0 DIADLO Cc1sccc1CN1CC[NH+]([C@@H](C)c2ccc(F)cc2)CC1 ZINC001237976817 1055571317 /nfs/dbraw/zinc/57/13/17/1055571317.db2.gz UNXCANTYFFCJLG-AWEZNQCLSA-N 1 2 318.461 4.074 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2csc(-c3ccc(O)cc3)n2)C1 ZINC001237985015 1055572163 /nfs/dbraw/zinc/57/21/63/1055572163.db2.gz HWYWROATEDPMDT-KRWDZBQOSA-N 1 2 320.433 4.230 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2csc(-c3ccc(O)cc3)n2)C1 ZINC001237985015 1055572172 /nfs/dbraw/zinc/57/21/72/1055572172.db2.gz HWYWROATEDPMDT-KRWDZBQOSA-N 1 2 320.433 4.230 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(F)c(O)c(Cl)c2)CCC1(F)F ZINC001237984924 1055572263 /nfs/dbraw/zinc/57/22/63/1055572263.db2.gz SCSWLALCKOAUDD-VIFPVBQESA-N 1 2 307.743 4.052 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(F)c(O)c(Cl)c2)CCC1(F)F ZINC001237984924 1055572274 /nfs/dbraw/zinc/57/22/74/1055572274.db2.gz SCSWLALCKOAUDD-VIFPVBQESA-N 1 2 307.743 4.052 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC001237997361 1055576145 /nfs/dbraw/zinc/57/61/45/1055576145.db2.gz DJRSRSOPRQOSGP-SJCJKPOMSA-N 1 2 303.837 4.371 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[N@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC001237997361 1055576154 /nfs/dbraw/zinc/57/61/54/1055576154.db2.gz DJRSRSOPRQOSGP-SJCJKPOMSA-N 1 2 303.837 4.371 20 0 DIADLO Oc1c(F)cc(C[N@@H+]2CCCc3ccccc3C2)cc1Cl ZINC001237997138 1055577047 /nfs/dbraw/zinc/57/70/47/1055577047.db2.gz MAMQKDCRGAZNHE-UHFFFAOYSA-N 1 2 305.780 4.133 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CCCc3ccccc3C2)cc1Cl ZINC001237997138 1055577060 /nfs/dbraw/zinc/57/70/60/1055577060.db2.gz MAMQKDCRGAZNHE-UHFFFAOYSA-N 1 2 305.780 4.133 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)cc1Cl ZINC001237990428 1055578322 /nfs/dbraw/zinc/57/83/22/1055578322.db2.gz SLIJWUXPUWWWMB-CQSZACIVSA-N 1 2 319.807 4.249 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237992271 1055578473 /nfs/dbraw/zinc/57/84/73/1055578473.db2.gz IYFFVLCIVQBLKF-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[N@@H+]1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001238002848 1055580757 /nfs/dbraw/zinc/58/07/57/1055580757.db2.gz FMJDBJCFRVZBJZ-BETUJISGSA-N 1 2 323.827 4.303 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[N@H+]1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001238002848 1055580768 /nfs/dbraw/zinc/58/07/68/1055580768.db2.gz FMJDBJCFRVZBJZ-BETUJISGSA-N 1 2 323.827 4.303 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001238000113 1055582690 /nfs/dbraw/zinc/58/26/90/1055582690.db2.gz ICKCQFZJPNOFNG-OLZOCXBDSA-N 1 2 303.837 4.228 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[N@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001238000113 1055582696 /nfs/dbraw/zinc/58/26/96/1055582696.db2.gz ICKCQFZJPNOFNG-OLZOCXBDSA-N 1 2 303.837 4.228 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237998955 1055582725 /nfs/dbraw/zinc/58/27/25/1055582725.db2.gz YOWOQCQDGZNABZ-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237998955 1055582735 /nfs/dbraw/zinc/58/27/35/1055582735.db2.gz YOWOQCQDGZNABZ-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO Clc1cncc(C[NH+]2CCC(c3ccccn3)CC2)c1Cl ZINC001238009112 1055583562 /nfs/dbraw/zinc/58/35/62/1055583562.db2.gz RFEDOKUGPGMJNS-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cnc(F)cc1Cl ZINC001238023534 1055587437 /nfs/dbraw/zinc/58/74/37/1055587437.db2.gz KCDIBBUYLFHUSH-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1cnc(F)cc1Cl ZINC001238023534 1055587464 /nfs/dbraw/zinc/58/74/64/1055587464.db2.gz KCDIBBUYLFHUSH-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCCC[C@@H](F)C3)cs2)cc1 ZINC001238037794 1055591937 /nfs/dbraw/zinc/59/19/37/1055591937.db2.gz TXHOETMFOXSGAZ-OAHLLOKOSA-N 1 2 304.434 4.443 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCCC[C@@H](F)C3)cs2)cc1 ZINC001238037794 1055591947 /nfs/dbraw/zinc/59/19/47/1055591947.db2.gz TXHOETMFOXSGAZ-OAHLLOKOSA-N 1 2 304.434 4.443 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC001595395117 1055594593 /nfs/dbraw/zinc/59/45/93/1055594593.db2.gz DLRSYHJGKMGTMR-UHFFFAOYSA-N 1 2 323.396 4.324 20 0 DIADLO Fc1cc(Br)c(F)c(C[N@H+]2CCC[C@H](F)CC2)c1 ZINC001238071610 1055600600 /nfs/dbraw/zinc/60/06/00/1055600600.db2.gz RJOBXORBAMCNDF-JTQLQIEISA-N 1 2 322.168 4.051 20 0 DIADLO Fc1cc(Br)c(F)c(C[N@@H+]2CCC[C@H](F)CC2)c1 ZINC001238071610 1055600608 /nfs/dbraw/zinc/60/06/08/1055600608.db2.gz RJOBXORBAMCNDF-JTQLQIEISA-N 1 2 322.168 4.051 20 0 DIADLO CC(C)CCC1CCN(C(=O)[C@H](CC(C)C)n2cc[nH+]c2)CC1 ZINC001595502957 1055604978 /nfs/dbraw/zinc/60/49/78/1055604978.db2.gz JJWUEPYXKCBYJN-SFHVURJKSA-N 1 2 319.493 4.145 20 0 DIADLO COc1cnc(F)c(C[N@H+](Cc2cccc(C)c2C)C2CC2)c1 ZINC001238125292 1055609607 /nfs/dbraw/zinc/60/96/07/1055609607.db2.gz HRPZXFLRDBBSCV-UHFFFAOYSA-N 1 2 314.404 4.011 20 0 DIADLO COc1cnc(F)c(C[N@@H+](Cc2cccc(C)c2C)C2CC2)c1 ZINC001238125292 1055609614 /nfs/dbraw/zinc/60/96/14/1055609614.db2.gz HRPZXFLRDBBSCV-UHFFFAOYSA-N 1 2 314.404 4.011 20 0 DIADLO Cc1ccc(O)cc1C[N@@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001238106466 1055610221 /nfs/dbraw/zinc/61/02/21/1055610221.db2.gz KPVHPOQXOIEWDO-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO Cc1ccc(O)cc1C[N@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001238106466 1055610230 /nfs/dbraw/zinc/61/02/30/1055610230.db2.gz KPVHPOQXOIEWDO-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO C[C@H]1CC(C)(C)c2cccc(NC(=O)CCCn3cc[nH+]c3)c21 ZINC001538362963 1055610971 /nfs/dbraw/zinc/61/09/71/1055610971.db2.gz MTLUSHGNCXQQRV-AWEZNQCLSA-N 1 2 311.429 4.087 20 0 DIADLO Oc1cc(F)c(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)cc1Cl ZINC001238150058 1055611784 /nfs/dbraw/zinc/61/17/84/1055611784.db2.gz QCKHUCIHFLILMM-GFCCVEGCSA-N 1 2 315.791 4.289 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@@H](c3ccccc3)C2)cc1Cl ZINC001238144848 1055611833 /nfs/dbraw/zinc/61/18/33/1055611833.db2.gz YDJBCGJEWAORIK-CYBMUJFWSA-N 1 2 305.780 4.174 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@@H](c3ccccc3)C2)cc1Cl ZINC001238144848 1055611838 /nfs/dbraw/zinc/61/18/38/1055611838.db2.gz YDJBCGJEWAORIK-CYBMUJFWSA-N 1 2 305.780 4.174 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)cc1Cl ZINC001238156621 1055615252 /nfs/dbraw/zinc/61/52/52/1055615252.db2.gz UOSGLMCLFHHSEO-TXEJJXNPSA-N 1 2 317.791 4.271 20 0 DIADLO Oc1cc(F)c(C[N@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)cc1Cl ZINC001238156621 1055615259 /nfs/dbraw/zinc/61/52/59/1055615259.db2.gz UOSGLMCLFHHSEO-TXEJJXNPSA-N 1 2 317.791 4.271 20 0 DIADLO Cc1c(Cl)c(Br)ccc1C[NH+]1CC2(CCC2)C1 ZINC001238215890 1055622088 /nfs/dbraw/zinc/62/20/88/1055622088.db2.gz OSCJCKATFSKQFL-UHFFFAOYSA-N 1 2 314.654 4.397 20 0 DIADLO Cc1ccc(Br)c(C[NH+]2CC3(CCC3)C2)c1Cl ZINC001238280291 1055634591 /nfs/dbraw/zinc/63/45/91/1055634591.db2.gz GZJPJBVQUUMECW-UHFFFAOYSA-N 1 2 314.654 4.397 20 0 DIADLO C[N@H+](Cc1c(F)c(F)ccc1OCc1ccccc1)C1CC1 ZINC001238295377 1055635511 /nfs/dbraw/zinc/63/55/11/1055635511.db2.gz AKSXWOCKZNTWTF-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO C[N@@H+](Cc1c(F)c(F)ccc1OCc1ccccc1)C1CC1 ZINC001238295377 1055635517 /nfs/dbraw/zinc/63/55/17/1055635517.db2.gz AKSXWOCKZNTWTF-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cnc3ccccn23)c(F)cc1Cl ZINC001238297814 1055636558 /nfs/dbraw/zinc/63/65/58/1055636558.db2.gz CTAZQFBTKFIQIG-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cnc3ccccn23)c(F)cc1Cl ZINC001238297814 1055636563 /nfs/dbraw/zinc/63/65/63/1055636563.db2.gz CTAZQFBTKFIQIG-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1c(Br)ccc(O)c1F ZINC001238307896 1055637763 /nfs/dbraw/zinc/63/77/63/1055637763.db2.gz YNYMQXUDOVJNOQ-NXEZZACHSA-N 1 2 316.214 4.057 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1cccc(F)c1OC(C)C ZINC001238320521 1055639240 /nfs/dbraw/zinc/63/92/40/1055639240.db2.gz SYPHTECJVHLYAF-UHFFFAOYSA-N 1 2 317.404 4.254 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1cccc(F)c1OC(C)C ZINC001238320521 1055639243 /nfs/dbraw/zinc/63/92/43/1055639243.db2.gz SYPHTECJVHLYAF-UHFFFAOYSA-N 1 2 317.404 4.254 20 0 DIADLO Fc1cccc(C[NH+]2CC(C(F)F)C2)c1OCc1ccccc1 ZINC001238333363 1055641474 /nfs/dbraw/zinc/64/14/74/1055641474.db2.gz BKQRDYAITYNYLG-UHFFFAOYSA-N 1 2 321.342 4.102 20 0 DIADLO CCCCC[C@@H]1CCCN1C(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001595874053 1055643433 /nfs/dbraw/zinc/64/34/33/1055643433.db2.gz IZKSQFQEHOBNDO-SJORKVTESA-N 1 2 305.466 4.042 20 0 DIADLO Clc1c(C[N@@H+]2CCC23CCCC3)ccnc1Br ZINC001238371690 1055649053 /nfs/dbraw/zinc/64/90/53/1055649053.db2.gz ZJBQEJVYTDSBFG-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Clc1c(C[N@H+]2CCC23CCCC3)ccnc1Br ZINC001238371690 1055649062 /nfs/dbraw/zinc/64/90/62/1055649062.db2.gz ZJBQEJVYTDSBFG-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3sccc3[C@H]2c2cccs2)on1 ZINC000032774587 1055654216 /nfs/dbraw/zinc/65/42/16/1055654216.db2.gz SHVMNLXAZYMCCS-INIZCTEOSA-N 1 2 316.451 4.254 20 0 DIADLO Cc1cc(C[N@H+]2CCc3sccc3[C@H]2c2cccs2)on1 ZINC000032774587 1055654223 /nfs/dbraw/zinc/65/42/23/1055654223.db2.gz SHVMNLXAZYMCCS-INIZCTEOSA-N 1 2 316.451 4.254 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1cccc(OC(C)C)c1F ZINC001238423890 1055656195 /nfs/dbraw/zinc/65/61/95/1055656195.db2.gz FVGQVCLYFVMOJA-UHFFFAOYSA-N 1 2 317.404 4.254 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1cccc(OC(C)C)c1F ZINC001238423890 1055656200 /nfs/dbraw/zinc/65/62/00/1055656200.db2.gz FVGQVCLYFVMOJA-UHFFFAOYSA-N 1 2 317.404 4.254 20 0 DIADLO CC[N@H+](Cc1cc(C)c(Cl)cn1)Cc1cccc(F)c1F ZINC001238431348 1055657714 /nfs/dbraw/zinc/65/77/14/1055657714.db2.gz XLLHZFYZODIDNZ-UHFFFAOYSA-N 1 2 310.775 4.344 20 0 DIADLO CC[N@@H+](Cc1cc(C)c(Cl)cn1)Cc1cccc(F)c1F ZINC001238431348 1055657717 /nfs/dbraw/zinc/65/77/17/1055657717.db2.gz XLLHZFYZODIDNZ-UHFFFAOYSA-N 1 2 310.775 4.344 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCc3sccc3C2)c(F)c1 ZINC001238441059 1055660148 /nfs/dbraw/zinc/66/01/48/1055660148.db2.gz NVGJQAAWAJOXGP-UHFFFAOYSA-N 1 2 305.418 4.233 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCc3sccc3C2)c(F)c1 ZINC001238441059 1055660158 /nfs/dbraw/zinc/66/01/58/1055660158.db2.gz NVGJQAAWAJOXGP-UHFFFAOYSA-N 1 2 305.418 4.233 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ncc(C)cc2C)on1 ZINC001238440998 1055660353 /nfs/dbraw/zinc/66/03/53/1055660353.db2.gz NFJWLFFJBKANHF-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2ncc(C)cc2C)on1 ZINC001238440998 1055660357 /nfs/dbraw/zinc/66/03/57/1055660357.db2.gz NFJWLFFJBKANHF-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO COc1cc(C[N@H+](C)[C@H](C)c2ccccc2Cl)cnc1F ZINC001238461174 1055665186 /nfs/dbraw/zinc/66/51/86/1055665186.db2.gz CADAOUJXAUWMAI-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1cc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)cnc1F ZINC001238461174 1055665194 /nfs/dbraw/zinc/66/51/94/1055665194.db2.gz CADAOUJXAUWMAI-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+]1CCc2sccc2C1 ZINC000040040835 1055666544 /nfs/dbraw/zinc/66/65/44/1055666544.db2.gz CLRIXAXIEJSZKZ-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+]1CCc2sccc2C1 ZINC000040040835 1055666556 /nfs/dbraw/zinc/66/65/56/1055666556.db2.gz CLRIXAXIEJSZKZ-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO CC[N@H+](Cc1cncc(OC(C)C)c1)Cc1cccc(F)c1F ZINC001238464144 1055666746 /nfs/dbraw/zinc/66/67/46/1055666746.db2.gz DSSZPDOFEHZMDY-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO CC[N@@H+](Cc1cncc(OC(C)C)c1)Cc1cccc(F)c1F ZINC001238464144 1055666751 /nfs/dbraw/zinc/66/67/51/1055666751.db2.gz DSSZPDOFEHZMDY-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC001538636199 1055678949 /nfs/dbraw/zinc/67/89/49/1055678949.db2.gz SBNQLAWRUZNFRA-CQSZACIVSA-N 1 2 321.380 4.019 20 0 DIADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC001538636199 1055678958 /nfs/dbraw/zinc/67/89/58/1055678958.db2.gz SBNQLAWRUZNFRA-CQSZACIVSA-N 1 2 321.380 4.019 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc(F)c(-c2ccncc2)c1 ZINC001238553987 1055684910 /nfs/dbraw/zinc/68/49/10/1055684910.db2.gz BUBAGZRGEDRRPO-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccc(F)c(-c2ccncc2)c1 ZINC001238553987 1055684917 /nfs/dbraw/zinc/68/49/17/1055684917.db2.gz BUBAGZRGEDRRPO-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@@](C)(F)[C@@H](F)C2)cnc1-c1ccccc1 ZINC001238605234 1055694746 /nfs/dbraw/zinc/69/47/46/1055694746.db2.gz CDXHNBOEBFMECX-PKOBYXMFSA-N 1 2 316.395 4.329 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@@](C)(F)[C@@H](F)C2)cnc1-c1ccccc1 ZINC001238605234 1055694749 /nfs/dbraw/zinc/69/47/49/1055694749.db2.gz CDXHNBOEBFMECX-PKOBYXMFSA-N 1 2 316.395 4.329 20 0 DIADLO Cc1cnc(-c2ccccc2)c(C[N@@H+]2Cc3cnc(C)cc3C2)c1 ZINC001238617854 1055698071 /nfs/dbraw/zinc/69/80/71/1055698071.db2.gz ALJSIMYHENNVNA-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1cnc(-c2ccccc2)c(C[N@H+]2Cc3cnc(C)cc3C2)c1 ZINC001238617854 1055698073 /nfs/dbraw/zinc/69/80/73/1055698073.db2.gz ALJSIMYHENNVNA-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO C[C@@H]1CC[C@@](C)(/C=C\C(=O)Nc2ccn3cc[nH+]c3c2)C1(C)C ZINC001596391616 1055703817 /nfs/dbraw/zinc/70/38/17/1055703817.db2.gz MAJPKGRZVLFSET-JDXLCQIMSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2nc3ccccc3o2)cnc1C1CC1 ZINC001238628261 1055703789 /nfs/dbraw/zinc/70/37/89/1055703789.db2.gz OQKVRPUQCJZVDS-UHFFFAOYSA-N 1 2 307.397 4.041 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2nc3ccccc3o2)cnc1C1CC1 ZINC001238628261 1055703800 /nfs/dbraw/zinc/70/38/00/1055703800.db2.gz OQKVRPUQCJZVDS-UHFFFAOYSA-N 1 2 307.397 4.041 20 0 DIADLO C=Cc1ccc(CNc2[nH+]cccc2CC(=O)OC(C)(C)C)cc1 ZINC001168576139 1055704043 /nfs/dbraw/zinc/70/40/43/1055704043.db2.gz STDDEBBDFYFCMS-UHFFFAOYSA-N 1 2 324.424 4.221 20 0 DIADLO Cc1cc(C)cc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)c1 ZINC001565581746 1055711659 /nfs/dbraw/zinc/71/16/59/1055711659.db2.gz SRYRFBGPGHKERL-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO CC1=C(Br)C[N@H+](C/C=C\c2ccc(F)cc2)CC1 ZINC001621288819 1055715703 /nfs/dbraw/zinc/71/57/03/1055715703.db2.gz VGTLXYHWBPINBD-IHWYPQMZSA-N 1 2 310.210 4.214 20 0 DIADLO CC1=C(Br)C[N@@H+](C/C=C\c2ccc(F)cc2)CC1 ZINC001621288819 1055715714 /nfs/dbraw/zinc/71/57/14/1055715714.db2.gz VGTLXYHWBPINBD-IHWYPQMZSA-N 1 2 310.210 4.214 20 0 DIADLO O=C(C[N@H+](Cc1cccs1)C1CC1)Nc1ccc(Cl)cc1 ZINC000044898040 1055715795 /nfs/dbraw/zinc/71/57/95/1055715795.db2.gz VLLCATITOARMQC-UHFFFAOYSA-N 1 2 320.845 4.005 20 0 DIADLO O=C(C[N@@H+](Cc1cccs1)C1CC1)Nc1ccc(Cl)cc1 ZINC000044898040 1055715802 /nfs/dbraw/zinc/71/58/02/1055715802.db2.gz VLLCATITOARMQC-UHFFFAOYSA-N 1 2 320.845 4.005 20 0 DIADLO CSc1ccc(Cl)cc1C[N@@H+]1CCc2ncc(C)cc2C1 ZINC001238682304 1055719312 /nfs/dbraw/zinc/71/93/12/1055719312.db2.gz WETQTNIGJKIIAF-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CSc1ccc(Cl)cc1C[N@H+]1CCc2ncc(C)cc2C1 ZINC001238682304 1055719327 /nfs/dbraw/zinc/71/93/27/1055719327.db2.gz WETQTNIGJKIIAF-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CC(C)C[C@H](C(=O)N1CC[C@H](C)c2ccccc21)n1cc[nH+]c1 ZINC001596529487 1055721046 /nfs/dbraw/zinc/72/10/46/1055721046.db2.gz ZOMIWDOIMKUIHA-MAUKXSAKSA-N 1 2 311.429 4.011 20 0 DIADLO Cc1ccccc1[C@@H](CC(C)C)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001565728757 1055722632 /nfs/dbraw/zinc/72/26/32/1055722632.db2.gz DSKTWWUYHXTFHX-GOSISDBHSA-N 1 2 321.424 4.389 20 0 DIADLO CC[C@@H](C)c1ccccc1Nc1ccc[nH+]c1N1CCOCC1 ZINC001212358231 1055729959 /nfs/dbraw/zinc/72/99/59/1055729959.db2.gz ABIWGBRDWCZQDZ-OAHLLOKOSA-N 1 2 311.429 4.175 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000105493929 1055731483 /nfs/dbraw/zinc/73/14/83/1055731483.db2.gz CZZHYRLXEMZXFW-QGZVFWFLSA-N 1 2 303.837 4.393 20 0 DIADLO Cc1ncccc1C[N@@H+](C)Cc1ccc(F)c(F)c1OC(C)C ZINC001238748879 1055738997 /nfs/dbraw/zinc/73/89/97/1055738997.db2.gz YNIKRWOZWFSTHG-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO Cc1ncccc1C[N@H+](C)Cc1ccc(F)c(F)c1OC(C)C ZINC001238748879 1055739009 /nfs/dbraw/zinc/73/90/09/1055739009.db2.gz YNIKRWOZWFSTHG-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO COc1cc(C)c(C)cc1C[N@H+](C)Cc1nc2ccccc2o1 ZINC001238768450 1055744206 /nfs/dbraw/zinc/74/42/06/1055744206.db2.gz WKAQMECMIAFIHI-UHFFFAOYSA-N 1 2 310.397 4.085 20 0 DIADLO COc1cc(C)c(C)cc1C[N@@H+](C)Cc1nc2ccccc2o1 ZINC001238768450 1055744216 /nfs/dbraw/zinc/74/42/16/1055744216.db2.gz WKAQMECMIAFIHI-UHFFFAOYSA-N 1 2 310.397 4.085 20 0 DIADLO Fc1ccc(C[N@@H+]2CCCCC23CC3)c(Br)c1F ZINC001238769608 1055745187 /nfs/dbraw/zinc/74/51/87/1055745187.db2.gz FKZVBQAJOHLAKI-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1ccc(C[N@H+]2CCCCC23CC3)c(Br)c1F ZINC001238769608 1055745200 /nfs/dbraw/zinc/74/52/00/1055745200.db2.gz FKZVBQAJOHLAKI-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO COc1cc(C)c(C)cc1C[N@H+](C)Cc1cccc(F)c1F ZINC001238771413 1055747472 /nfs/dbraw/zinc/74/74/72/1055747472.db2.gz YTNRRUAFBAPPAS-UHFFFAOYSA-N 1 2 305.368 4.222 20 0 DIADLO COc1cc(C)c(C)cc1C[N@@H+](C)Cc1cccc(F)c1F ZINC001238771413 1055747478 /nfs/dbraw/zinc/74/74/78/1055747478.db2.gz YTNRRUAFBAPPAS-UHFFFAOYSA-N 1 2 305.368 4.222 20 0 DIADLO Cc1cc(F)cc(C[N@@H+]2CCc3c(O)cccc3C2)c1Cl ZINC001238778523 1055750747 /nfs/dbraw/zinc/75/07/47/1055750747.db2.gz YYPWCDXQILXKGN-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Cc1cc(F)cc(C[N@H+]2CCc3c(O)cccc3C2)c1Cl ZINC001238778523 1055750758 /nfs/dbraw/zinc/75/07/58/1055750758.db2.gz YYPWCDXQILXKGN-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Cc1cc(OC(C)C)ncc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001238824990 1055754957 /nfs/dbraw/zinc/75/49/57/1055754957.db2.gz AYCUJFAIOUIZIV-UHFFFAOYSA-N 1 2 307.397 4.245 20 0 DIADLO CC(C)c1ccccc1NC(=O)[C@@H]1CCCN(c2cccc[nH+]2)C1 ZINC000047410493 1055756846 /nfs/dbraw/zinc/75/68/46/1055756846.db2.gz PBSGGUKAJNLVGH-MRXNPFEDSA-N 1 2 323.440 4.060 20 0 DIADLO Cc1cn2cc(-c3ccnc(Oc4ccccc4)c3)ccc2[nH+]1 ZINC001238841842 1055763369 /nfs/dbraw/zinc/76/33/69/1055763369.db2.gz IRLHZESYIYILMU-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)nn1C ZINC000282162669 1055765024 /nfs/dbraw/zinc/76/50/24/1055765024.db2.gz LTOCDNLWXFMEFT-WDEREUQCSA-N 1 2 312.244 4.447 20 0 DIADLO Cc1ccc2cccc(Nc3ccc[nH+]c3N3CCOCC3)c2c1 ZINC001212364208 1055768173 /nfs/dbraw/zinc/76/81/73/1055768173.db2.gz ATDAHQMSQMRYIH-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO Cc1c(-c2ccnc(Oc3ccccc3)c2)ccc2[nH+]ccn21 ZINC001238854225 1055768972 /nfs/dbraw/zinc/76/89/72/1055768972.db2.gz WMTVOFPMFZWCOG-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO Cc1cc2ccccc2cc1Nc1ccc[nH+]c1N1CCOCC1 ZINC001212366366 1055774955 /nfs/dbraw/zinc/77/49/55/1055774955.db2.gz MIPPENUZXQVZNA-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO CCCNc1cc(C)[nH+]c(-c2ccc(OC)c(OC(C)C)c2)n1 ZINC001238925398 1055791514 /nfs/dbraw/zinc/79/15/14/1055791514.db2.gz YHIARHDTWHQQOT-UHFFFAOYSA-N 1 2 315.417 4.070 20 0 DIADLO COc1ccc(-c2cc3[nH]c[nH+]c3cc2OC)cc1OC(C)C ZINC001238931519 1055795300 /nfs/dbraw/zinc/79/53/00/1055795300.db2.gz CKMVXPJSWQMRRG-UHFFFAOYSA-N 1 2 312.369 4.034 20 0 DIADLO C[C@H]1CO[C@@H](C(F)(F)F)C[N@@H+]1Cc1csc2ccccc12 ZINC000671712832 1055805579 /nfs/dbraw/zinc/80/55/79/1055805579.db2.gz JEPZDGHDXZBWCK-IINYFYTJSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@H]1CO[C@@H](C(F)(F)F)C[N@H+]1Cc1csc2ccccc12 ZINC000671712832 1055805588 /nfs/dbraw/zinc/80/55/88/1055805588.db2.gz JEPZDGHDXZBWCK-IINYFYTJSA-N 1 2 315.360 4.053 20 0 DIADLO CCCCOc1ncc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1C ZINC001238965961 1055807336 /nfs/dbraw/zinc/80/73/36/1055807336.db2.gz RMCZPDOORPEFBT-UHFFFAOYSA-N 1 2 321.424 4.481 20 0 DIADLO C[N@H+](CCOc1ccc(Cl)cc1)Cc1ncc(C(C)(C)C)o1 ZINC000058733135 1055814623 /nfs/dbraw/zinc/81/46/23/1055814623.db2.gz BJKAQMDSZVDEOP-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO C[N@@H+](CCOc1ccc(Cl)cc1)Cc1ncc(C(C)(C)C)o1 ZINC000058733135 1055814638 /nfs/dbraw/zinc/81/46/38/1055814638.db2.gz BJKAQMDSZVDEOP-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO C[C@@H]1CCCC[C@H]1OCC[NH+](Cc1ccco1)Cc1ccco1 ZINC000058932468 1055819888 /nfs/dbraw/zinc/81/98/88/1055819888.db2.gz AHOWQXWCBVWERP-VQIMIIECSA-N 1 2 317.429 4.470 20 0 DIADLO Cc1cc(C)c(CNC(=O)C2=C(c3ccccc3)CCCC2)c[nH+]1 ZINC001597403028 1055825329 /nfs/dbraw/zinc/82/53/29/1055825329.db2.gz NCMNTHQTXWLOMS-UHFFFAOYSA-N 1 2 320.436 4.342 20 0 DIADLO Cc1nnc(-c2ccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)cc2)o1 ZINC001239020271 1055825825 /nfs/dbraw/zinc/82/58/25/1055825825.db2.gz OVTJKGVFDPEGLT-UHFFFAOYSA-N 1 2 302.337 4.102 20 0 DIADLO Cc1ccc(C(=O)Nc2cc(N(C)C)cc[nH+]2)c(Cl)c1Cl ZINC001597488045 1055839094 /nfs/dbraw/zinc/83/90/94/1055839094.db2.gz YVCSCENGKDKBKR-UHFFFAOYSA-N 1 2 324.211 4.015 20 0 DIADLO Cc1ccc2[nH+]c(CSc3nc4ccccc4nc3C)cn2c1 ZINC000028192473 1055839412 /nfs/dbraw/zinc/83/94/12/1055839412.db2.gz WSZTZMXTVWJHQU-UHFFFAOYSA-N 1 2 320.421 4.187 20 0 DIADLO CC(C)c1ccc(-c2nc(C[NH+]3CCSCC3)cs2)cc1 ZINC000061283456 1055863781 /nfs/dbraw/zinc/86/37/81/1055863781.db2.gz YPJWSBGDDIMZKH-UHFFFAOYSA-N 1 2 318.511 4.482 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1ccc(OC(F)(F)F)cc1O ZINC001214389992 1055865562 /nfs/dbraw/zinc/86/55/62/1055865562.db2.gz QJXDPCAEXDWUQC-UHFFFAOYSA-N 1 2 312.291 4.300 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cc(Cl)cnc1OC(C)C ZINC001239322930 1055869651 /nfs/dbraw/zinc/86/96/51/1055869651.db2.gz QHBCLODEHQVXRO-UHFFFAOYSA-N 1 2 301.777 4.145 20 0 DIADLO CCc1ccc(-c2noc(C[N@H+](C)Cc3ccccc3C)n2)cc1 ZINC000061760213 1055871519 /nfs/dbraw/zinc/87/15/19/1055871519.db2.gz PYBZCMFLPCCETD-UHFFFAOYSA-N 1 2 321.424 4.239 20 0 DIADLO CCc1ccc(-c2noc(C[N@@H+](C)Cc3ccccc3C)n2)cc1 ZINC000061760213 1055871525 /nfs/dbraw/zinc/87/15/25/1055871525.db2.gz PYBZCMFLPCCETD-UHFFFAOYSA-N 1 2 321.424 4.239 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1cscc1Br ZINC000347604542 1055875071 /nfs/dbraw/zinc/87/50/71/1055875071.db2.gz DMCRUDGDKYYTBK-UHFFFAOYSA-N 1 2 302.262 4.204 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1cscc1Br ZINC000347604542 1055875078 /nfs/dbraw/zinc/87/50/78/1055875078.db2.gz DMCRUDGDKYYTBK-UHFFFAOYSA-N 1 2 302.262 4.204 20 0 DIADLO CCC(C)(C)c1ccc(C(=O)NCc2c[nH]c(C(C)C)[nH+]2)cc1 ZINC001597811405 1055878110 /nfs/dbraw/zinc/87/81/10/1055878110.db2.gz DYKSFHOVAHZVDA-UHFFFAOYSA-N 1 2 313.445 4.151 20 0 DIADLO CCC(C)(C)c1ccc(C(=O)NCc2c[nH+]c(C(C)C)[nH]2)cc1 ZINC001597811405 1055878119 /nfs/dbraw/zinc/87/81/19/1055878119.db2.gz DYKSFHOVAHZVDA-UHFFFAOYSA-N 1 2 313.445 4.151 20 0 DIADLO CCO[C@H](C)c1noc(C[NH2+][C@@H](CC(C)C)c2cccs2)n1 ZINC000347611665 1055881648 /nfs/dbraw/zinc/88/16/48/1055881648.db2.gz NEHCPAIJRYLKFZ-OLZOCXBDSA-N 1 2 323.462 4.106 20 0 DIADLO Cc1c(-c2cccc(C(=O)C(F)(F)F)c2)ccc2[nH+]ccn21 ZINC001239391271 1055885942 /nfs/dbraw/zinc/88/59/42/1055885942.db2.gz AZEFWEQJZNFKGG-UHFFFAOYSA-N 1 2 304.271 4.055 20 0 DIADLO COC(=O)c1cc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)oc1C ZINC000347619780 1055893502 /nfs/dbraw/zinc/89/35/02/1055893502.db2.gz QUTZLDSMMUHUDH-HNNXBMFYSA-N 1 2 319.426 4.019 20 0 DIADLO COC(=O)c1cc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)oc1C ZINC000347619780 1055893509 /nfs/dbraw/zinc/89/35/09/1055893509.db2.gz QUTZLDSMMUHUDH-HNNXBMFYSA-N 1 2 319.426 4.019 20 0 DIADLO COC(=O)c1cc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)oc1C ZINC000347619781 1055893540 /nfs/dbraw/zinc/89/35/40/1055893540.db2.gz QUTZLDSMMUHUDH-OAHLLOKOSA-N 1 2 319.426 4.019 20 0 DIADLO COC(=O)c1cc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)oc1C ZINC000347619781 1055893546 /nfs/dbraw/zinc/89/35/46/1055893546.db2.gz QUTZLDSMMUHUDH-OAHLLOKOSA-N 1 2 319.426 4.019 20 0 DIADLO Fc1ccc(-c2ccc(-c3ccc(-n4cc[nH+]c4)cc3)nn2)cc1 ZINC001239474030 1055898533 /nfs/dbraw/zinc/89/85/33/1055898533.db2.gz YQAAHUKPMWGJNI-UHFFFAOYSA-N 1 2 316.339 4.135 20 0 DIADLO CCc1nnc(C[N@H+]2CC=C(c3cccc4ccccc43)CC2)o1 ZINC000063762560 1055901179 /nfs/dbraw/zinc/90/11/79/1055901179.db2.gz AFAGCQUPDTXMOZ-UHFFFAOYSA-N 1 2 319.408 4.075 20 0 DIADLO CCc1nnc(C[N@@H+]2CC=C(c3cccc4ccccc43)CC2)o1 ZINC000063762560 1055901194 /nfs/dbraw/zinc/90/11/94/1055901194.db2.gz AFAGCQUPDTXMOZ-UHFFFAOYSA-N 1 2 319.408 4.075 20 0 DIADLO COc1ccc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)cc1 ZINC001239486993 1055903783 /nfs/dbraw/zinc/90/37/83/1055903783.db2.gz YWJZTFBPKZBPSK-UHFFFAOYSA-N 1 2 320.392 4.005 20 0 DIADLO COc1ccc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)cc1 ZINC001239486993 1055903793 /nfs/dbraw/zinc/90/37/93/1055903793.db2.gz YWJZTFBPKZBPSK-UHFFFAOYSA-N 1 2 320.392 4.005 20 0 DIADLO CC[N@H+](Cc1nc(CCC(C)C)no1)[C@@H](C)c1ccc(F)cc1 ZINC000064515288 1055920304 /nfs/dbraw/zinc/92/03/04/1055920304.db2.gz PNWFDEQTZJKHJM-AWEZNQCLSA-N 1 2 319.424 4.380 20 0 DIADLO CC[N@@H+](Cc1nc(CCC(C)C)no1)[C@@H](C)c1ccc(F)cc1 ZINC000064515288 1055920318 /nfs/dbraw/zinc/92/03/18/1055920318.db2.gz PNWFDEQTZJKHJM-AWEZNQCLSA-N 1 2 319.424 4.380 20 0 DIADLO C[C@@H]1CC[C@H](C)[N@H+](Cc2ncc(Br)cc2Cl)C1 ZINC001615640241 1055925091 /nfs/dbraw/zinc/92/50/91/1055925091.db2.gz UEKIMBKPRZYKKO-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[C@H](C)[N@@H+](Cc2ncc(Br)cc2Cl)C1 ZINC001615640241 1055925097 /nfs/dbraw/zinc/92/50/97/1055925097.db2.gz UEKIMBKPRZYKKO-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO CCCCc1nc(C[N@H+](Cc2ccccc2)[C@@H](C)C2CC2)no1 ZINC000064931914 1055932139 /nfs/dbraw/zinc/93/21/39/1055932139.db2.gz YSDGTWNQMYUIGF-HNNXBMFYSA-N 1 2 313.445 4.213 20 0 DIADLO CCCCc1nc(C[N@@H+](Cc2ccccc2)[C@@H](C)C2CC2)no1 ZINC000064931914 1055932150 /nfs/dbraw/zinc/93/21/50/1055932150.db2.gz YSDGTWNQMYUIGF-HNNXBMFYSA-N 1 2 313.445 4.213 20 0 DIADLO CC(C)(C)C1CCC(=CC(=O)Nc2ccc3[nH+]ccn3c2)CC1 ZINC001539936057 1055935199 /nfs/dbraw/zinc/93/51/99/1055935199.db2.gz YSYVXRNIVPEZSG-UHFFFAOYSA-N 1 2 311.429 4.436 20 0 DIADLO Fc1ccc(C[NH2+][C@H](c2ccccc2)c2cccnc2)c(F)c1 ZINC001649083899 1055936803 /nfs/dbraw/zinc/93/68/03/1055936803.db2.gz JATUDJOMFANSMV-LJQANCHMSA-N 1 2 310.347 4.239 20 0 DIADLO Cc1c[nH]c(C[NH2+]Cc2ccccc2Oc2ccccc2C)n1 ZINC001620777501 1055944799 /nfs/dbraw/zinc/94/47/99/1055944799.db2.gz XAFHRECXWXAQDC-UHFFFAOYSA-N 1 2 307.397 4.109 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc(Cl)c3cccnc13)C2 ZINC001620499563 1055958024 /nfs/dbraw/zinc/95/80/24/1055958024.db2.gz WARDWZDXIKJMFY-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc(Cl)c3cccnc13)C2 ZINC001620499563 1055958034 /nfs/dbraw/zinc/95/80/34/1055958034.db2.gz WARDWZDXIKJMFY-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO Fc1c(Br)cccc1CNc1cc2cc[nH]c2c[nH+]1 ZINC001620988024 1055960007 /nfs/dbraw/zinc/96/00/07/1055960007.db2.gz IYBLDRVTCPTQOA-UHFFFAOYSA-N 1 2 320.165 4.077 20 0 DIADLO O=C(C[NH+]1CCC(c2ccc(F)cc2)CC1)c1ccccc1F ZINC001620507083 1055963155 /nfs/dbraw/zinc/96/31/55/1055963155.db2.gz XULMGOVQXFTULQ-UHFFFAOYSA-N 1 2 315.363 4.027 20 0 DIADLO Cl/C=C(\Cl)C[N@@H+]1CCCSC[C@@H]1c1ccccc1 ZINC001620543154 1055964524 /nfs/dbraw/zinc/96/45/24/1055964524.db2.gz UGWWNODONMHYPV-RNQWEJQRSA-N 1 2 302.270 4.486 20 0 DIADLO Cl/C=C(\Cl)C[N@H+]1CCCSC[C@@H]1c1ccccc1 ZINC001620543154 1055964531 /nfs/dbraw/zinc/96/45/31/1055964531.db2.gz UGWWNODONMHYPV-RNQWEJQRSA-N 1 2 302.270 4.486 20 0 DIADLO Cl/C=C(\Cl)C[N@@H+]1CCCSC[C@H]1c1ccccc1 ZINC001620543156 1055964551 /nfs/dbraw/zinc/96/45/51/1055964551.db2.gz UGWWNODONMHYPV-XXYUJHKVSA-N 1 2 302.270 4.486 20 0 DIADLO Cl/C=C(\Cl)C[N@H+]1CCCSC[C@H]1c1ccccc1 ZINC001620543156 1055964560 /nfs/dbraw/zinc/96/45/60/1055964560.db2.gz UGWWNODONMHYPV-XXYUJHKVSA-N 1 2 302.270 4.486 20 0 DIADLO FCCCCC[N@@H+]1CCc2ccc(Br)c(F)c2C1 ZINC001620590764 1055971020 /nfs/dbraw/zinc/97/10/20/1055971020.db2.gz DMHMKOXOIUQBLG-UHFFFAOYSA-N 1 2 318.205 4.086 20 0 DIADLO FCCCCC[N@H+]1CCc2ccc(Br)c(F)c2C1 ZINC001620590764 1055971025 /nfs/dbraw/zinc/97/10/25/1055971025.db2.gz DMHMKOXOIUQBLG-UHFFFAOYSA-N 1 2 318.205 4.086 20 0 DIADLO COCc1ccc(C[NH2+][C@@H](CCc2ccccc2)C(F)F)cc1 ZINC001621006182 1055972955 /nfs/dbraw/zinc/97/29/55/1055972955.db2.gz ABDRANWZXKCZDJ-SFHVURJKSA-N 1 2 319.395 4.189 20 0 DIADLO c1ccc(Nc2ccc(NCc3cnc(C4CC4)nc3)[nH+]c2)cc1 ZINC001621012838 1055977378 /nfs/dbraw/zinc/97/73/78/1055977378.db2.gz HLMOYKNCXJXLRX-UHFFFAOYSA-N 1 2 317.396 4.105 20 0 DIADLO Cc1ccccc1C(F)(F)C[NH2+]Cc1ccc2[nH]ccc2c1 ZINC001621018939 1055985124 /nfs/dbraw/zinc/98/51/24/1055985124.db2.gz REJIFCCAGBDIHI-UHFFFAOYSA-N 1 2 300.352 4.358 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1sccc1C1CC1 ZINC000067144819 1055986956 /nfs/dbraw/zinc/98/69/56/1055986956.db2.gz GNNZTNKAGQSSHT-UHFFFAOYSA-N 1 2 309.394 4.064 20 0 DIADLO Clc1cnc(C[NH2+]Cc2ccnc(-c3ccccc3)c2)s1 ZINC001621025316 1055991082 /nfs/dbraw/zinc/99/10/82/1055991082.db2.gz KFIYGIPVXSTDOJ-UHFFFAOYSA-N 1 2 315.829 4.148 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+]Cc2ccn(C(C)C)n2)c1Cl ZINC001620803976 1055999467 /nfs/dbraw/zinc/99/94/67/1055999467.db2.gz NFGWBVGCORTISL-UHFFFAOYSA-N 1 2 312.244 4.369 20 0 DIADLO Cc1ccc2[nH+]c(NCc3cscc3Br)[nH]c2c1 ZINC001621045684 1056003545 /nfs/dbraw/zinc/00/35/45/1056003545.db2.gz DCRXIOVNPMVQPL-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO COc1ccc(C(C)C)cc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001239658462 1056005959 /nfs/dbraw/zinc/00/59/59/1056005959.db2.gz SGQAZHMXFYZXTB-UHFFFAOYSA-N 1 2 310.319 4.482 20 0 DIADLO Cc1ccc2[nH+]c(NCc3cnc4c(F)cccc4c3)[nH]c2c1 ZINC001621045848 1056006423 /nfs/dbraw/zinc/00/64/23/1056006423.db2.gz JZZQMMOQZIYNFJ-UHFFFAOYSA-N 1 2 306.344 4.171 20 0 DIADLO CN(Cc1ccccc1)c1ccc(-c2ccc3[nH+]ccn3c2)cn1 ZINC001239659725 1056007789 /nfs/dbraw/zinc/00/77/89/1056007789.db2.gz ARIAXCMNINNLIH-UHFFFAOYSA-N 1 2 314.392 4.033 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000072575191 1056029711 /nfs/dbraw/zinc/02/97/11/1056029711.db2.gz FOVVFMFPPPANPF-IRXDYDNUSA-N 1 2 317.477 4.112 20 0 DIADLO Clc1cccc(C[NH2+][C@H](c2ccccc2)c2ccccn2)n1 ZINC000072556826 1056030796 /nfs/dbraw/zinc/03/07/96/1056030796.db2.gz BIGAXTHPYAAZFH-GOSISDBHSA-N 1 2 309.800 4.009 20 0 DIADLO COc1cccc(OC)c1C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC001621328009 1056034474 /nfs/dbraw/zinc/03/44/74/1056034474.db2.gz IPWRACGEJFDIBG-MRXNPFEDSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cccc(OC)c1C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC001621328009 1056034487 /nfs/dbraw/zinc/03/44/87/1056034487.db2.gz IPWRACGEJFDIBG-MRXNPFEDSA-N 1 2 317.816 4.304 20 0 DIADLO CCCCC1(NC(=O)C[N@H+](CC)Cc2ccccc2Cl)CC1 ZINC001606607874 1056038230 /nfs/dbraw/zinc/03/82/30/1056038230.db2.gz BRKJYCSHOHFPFL-UHFFFAOYSA-N 1 2 322.880 4.001 20 0 DIADLO CCCCC1(NC(=O)C[N@@H+](CC)Cc2ccccc2Cl)CC1 ZINC001606607874 1056038241 /nfs/dbraw/zinc/03/82/41/1056038241.db2.gz BRKJYCSHOHFPFL-UHFFFAOYSA-N 1 2 322.880 4.001 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000073778337 1056048536 /nfs/dbraw/zinc/04/85/36/1056048536.db2.gz FOHIJOWJLIOVFW-KRWDZBQOSA-N 1 2 321.852 4.408 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC001583271622 1056051640 /nfs/dbraw/zinc/05/16/40/1056051640.db2.gz KFJQMFNXZMLUCR-LBPRGKRZSA-N 1 2 302.805 4.151 20 0 DIADLO Cc1cc(-c2cncc(Oc3ccccc3)c2)cn2cc[nH+]c12 ZINC001239751430 1056057357 /nfs/dbraw/zinc/05/73/57/1056057357.db2.gz HLJUOCJSOWWQOF-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ccc(F)s3)c2)[nH+]c1C ZINC001583354490 1056069686 /nfs/dbraw/zinc/06/96/86/1056069686.db2.gz BXQWNEZKIBPXCS-UHFFFAOYSA-N 1 2 315.373 4.146 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cnc2ccccc2c1 ZINC001239794622 1056077269 /nfs/dbraw/zinc/07/72/69/1056077269.db2.gz KRUDKBVQPMUOHO-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1ccc(F)c2occc21 ZINC001540803746 1056078662 /nfs/dbraw/zinc/07/86/62/1056078662.db2.gz UOMISCLCNKKKLT-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO Cc1cc(C)c(C(=O)N(C)Cc2csc3ccccc23)c(C)[nH+]1 ZINC001540798244 1056079838 /nfs/dbraw/zinc/07/98/38/1056079838.db2.gz RRRDGBAXERKSEV-UHFFFAOYSA-N 1 2 324.449 4.494 20 0 DIADLO COc1ccsc1[C@@H](C)Nc1ccc2c(c1)CCC[N@H+]2C ZINC000186271515 1056082941 /nfs/dbraw/zinc/08/29/41/1056082941.db2.gz BEMTYEHHFVXRAI-GFCCVEGCSA-N 1 2 302.443 4.312 20 0 DIADLO COc1ccsc1[C@@H](C)Nc1ccc2c(c1)CCC[N@@H+]2C ZINC000186271515 1056082952 /nfs/dbraw/zinc/08/29/52/1056082952.db2.gz BEMTYEHHFVXRAI-GFCCVEGCSA-N 1 2 302.443 4.312 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2noc(-c3ccsc3)n2)cc1 ZINC000127145219 1056083734 /nfs/dbraw/zinc/08/37/34/1056083734.db2.gz FJFZRIFXGCHKHO-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2noc(-c3ccsc3)n2)cc1 ZINC000127145219 1056083747 /nfs/dbraw/zinc/08/37/47/1056083747.db2.gz FJFZRIFXGCHKHO-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(-c2ncnc3c2C[N@H+](Cc2ccccc2)C3)c(C)c1 ZINC001239811878 1056085401 /nfs/dbraw/zinc/08/54/01/1056085401.db2.gz XBMVNIFZGNSVIX-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1ccc(-c2ncnc3c2C[N@@H+](Cc2ccccc2)C3)c(C)c1 ZINC001239811878 1056085418 /nfs/dbraw/zinc/08/54/18/1056085418.db2.gz XBMVNIFZGNSVIX-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1ccc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)cc1F ZINC001239824875 1056091470 /nfs/dbraw/zinc/09/14/70/1056091470.db2.gz LKZVYMYXODSKPH-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO Cc1ccc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)cc1F ZINC001239824875 1056091484 /nfs/dbraw/zinc/09/14/84/1056091484.db2.gz LKZVYMYXODSKPH-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO Cc1cc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)c(C)s1 ZINC001212387365 1056093467 /nfs/dbraw/zinc/09/34/67/1056093467.db2.gz ASTNRSCJRXJRNQ-UHFFFAOYSA-N 1 2 322.393 4.268 20 0 DIADLO Cc1csc(C[NH2+][C@H](c2ccccc2)c2cccc(F)c2)n1 ZINC000088536708 1056105939 /nfs/dbraw/zinc/10/59/39/1056105939.db2.gz XOOJNRZCCPPUGB-GOSISDBHSA-N 1 2 312.413 4.470 20 0 DIADLO CCC[C@@H](CC)C(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC001542205291 1056110342 /nfs/dbraw/zinc/11/03/42/1056110342.db2.gz WTDCRPWNNAVCJZ-ZIAGYGMSSA-N 1 2 323.506 4.140 20 0 DIADLO CCC[C@@H](CC)C(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC001542205291 1056110351 /nfs/dbraw/zinc/11/03/51/1056110351.db2.gz WTDCRPWNNAVCJZ-ZIAGYGMSSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccc(SC(C)(C)C)cc1C ZINC001542638027 1056148021 /nfs/dbraw/zinc/14/80/21/1056148021.db2.gz SNIOLIZSNIQJCW-UHFFFAOYSA-N 1 2 317.458 4.098 20 0 DIADLO Cc1cc(-c2ccc(C(=O)NC3CCCCC3)cc2)cc(C)[nH+]1 ZINC001239917259 1056157443 /nfs/dbraw/zinc/15/74/43/1056157443.db2.gz ZVCNCGGFJOHPFD-UHFFFAOYSA-N 1 2 308.425 4.428 20 0 DIADLO Cc1cc(NC(=O)C[C@@H]2CCCC[C@H]2C)ccc1-n1cc[nH+]c1 ZINC001542875782 1056159992 /nfs/dbraw/zinc/15/99/92/1056159992.db2.gz TYZGVQAVTGDVSL-ZBFHGGJFSA-N 1 2 311.429 4.336 20 0 DIADLO Cc1cccc([C@H](C)C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)c1 ZINC001542875385 1056160856 /nfs/dbraw/zinc/16/08/56/1056160856.db2.gz FAFWWDVHLURMBG-INIZCTEOSA-N 1 2 319.408 4.231 20 0 DIADLO Cc1cc(NC(=O)[C@@H](C)CC2CCCC2)ccc1-n1cc[nH+]c1 ZINC001542875898 1056160932 /nfs/dbraw/zinc/16/09/32/1056160932.db2.gz WZAXMUZMWQEWSI-HNNXBMFYSA-N 1 2 311.429 4.336 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C[C@@H](C)c3ccco3)cc2)[nH+]c1C ZINC000921652302 1056164836 /nfs/dbraw/zinc/16/48/36/1056164836.db2.gz HKMOKQODRRRQCD-GFCCVEGCSA-N 1 2 323.396 4.419 20 0 DIADLO CC[C@@H](CC(F)F)C(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1 ZINC000921656146 1056166965 /nfs/dbraw/zinc/16/69/65/1056166965.db2.gz LQVHOZVKMAXFMM-LBPRGKRZSA-N 1 2 321.371 4.313 20 0 DIADLO CCCc1[nH]ccc1C(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1 ZINC000921657051 1056168799 /nfs/dbraw/zinc/16/87/99/1056168799.db2.gz WHHIBEXIHKJRHP-UHFFFAOYSA-N 1 2 322.412 4.226 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H](C)Cc3ccco3)cc2)[nH+]c1C ZINC000921656798 1056168831 /nfs/dbraw/zinc/16/88/31/1056168831.db2.gz XSOSNFSNKKGPCD-GFCCVEGCSA-N 1 2 323.396 4.104 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3ncoc3C(C)C)cc2)[nH+]c1C ZINC000921660651 1056171448 /nfs/dbraw/zinc/17/14/48/1056171448.db2.gz BLBVXUHTBZGIIX-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO CCCCCC[C@@H](C)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001611875596 1056203762 /nfs/dbraw/zinc/20/37/62/1056203762.db2.gz ZYILQXGWZBNEMQ-CYBMUJFWSA-N 1 2 303.454 4.352 20 0 DIADLO CCCOc1ccc(-c2ccc3[nH+]ccn3c2C)c(F)c1F ZINC001239976707 1056213910 /nfs/dbraw/zinc/21/39/10/1056213910.db2.gz MJPYCPQVENVFKL-UHFFFAOYSA-N 1 2 302.324 4.377 20 0 DIADLO CC(C)=C(C)CC(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC001543432906 1056218433 /nfs/dbraw/zinc/21/84/33/1056218433.db2.gz NOKIUNYZYRBNPC-CYBMUJFWSA-N 1 2 321.490 4.060 20 0 DIADLO CC(C)=C(C)CC(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC001543432906 1056218450 /nfs/dbraw/zinc/21/84/50/1056218450.db2.gz NOKIUNYZYRBNPC-CYBMUJFWSA-N 1 2 321.490 4.060 20 0 DIADLO CSc1ccc(F)cc1CNc1nc(C)[nH+]c2c1CCCC2 ZINC001612027409 1056224845 /nfs/dbraw/zinc/22/48/45/1056224845.db2.gz CCVNIUKDYWFCCX-UHFFFAOYSA-N 1 2 317.433 4.137 20 0 DIADLO CC[N@H+](CC(=O)N(C)[C@H](C)C(C)(C)C)Cc1ccccc1Cl ZINC001583989506 1056229604 /nfs/dbraw/zinc/22/96/04/1056229604.db2.gz MDQLJCVKDNDTDP-CQSZACIVSA-N 1 2 324.896 4.055 20 0 DIADLO CC[N@@H+](CC(=O)N(C)[C@H](C)C(C)(C)C)Cc1ccccc1Cl ZINC001583989506 1056229617 /nfs/dbraw/zinc/22/96/17/1056229617.db2.gz MDQLJCVKDNDTDP-CQSZACIVSA-N 1 2 324.896 4.055 20 0 DIADLO Cc1cc(NC[C@H](c2cccnc2)C(C)C)nc(C2CCC2)[nH+]1 ZINC001612073536 1056233328 /nfs/dbraw/zinc/23/33/28/1056233328.db2.gz JXFFFHSATCFACU-KRWDZBQOSA-N 1 2 310.445 4.299 20 0 DIADLO CCOc1cc(C)ccc1CNc1cc(C)[nH+]c(C2CCC2)n1 ZINC001612128042 1056242915 /nfs/dbraw/zinc/24/29/15/1056242915.db2.gz PUADYPDFQABSBW-UHFFFAOYSA-N 1 2 311.429 4.372 20 0 DIADLO CC(C)[C@H]1CC[C@H](C(=O)Nc2ccccc2-n2cc[nH+]c2)CC1 ZINC001543547901 1056247374 /nfs/dbraw/zinc/24/73/74/1056247374.db2.gz YZCUKLWTMIPCEJ-WKILWMFISA-N 1 2 311.429 4.273 20 0 DIADLO Cc1ccc(CC2CCN(c3nc(C)[nH+]c(C)c3C)CC2)cc1 ZINC001612182312 1056250644 /nfs/dbraw/zinc/25/06/44/1056250644.db2.gz ZJBSEQHFKKDLAN-UHFFFAOYSA-N 1 2 309.457 4.169 20 0 DIADLO CC(C)C1(C)CCN(c2nc3ccccc3n3c[nH+]cc23)CC1 ZINC001612278528 1056265818 /nfs/dbraw/zinc/26/58/18/1056265818.db2.gz FQJUKSBSXZBCKX-UHFFFAOYSA-N 1 2 308.429 4.145 20 0 DIADLO Cc1cc(NCCC2C[C@H](C)O[C@@H](C)C2)nc(C2CCC2)[nH+]1 ZINC001612294816 1056267505 /nfs/dbraw/zinc/26/75/05/1056267505.db2.gz SNVYSUJUSZVDTO-KBPBESRZSA-N 1 2 303.450 4.058 20 0 DIADLO Cc1cc(CNC(=O)/C=C\[C@]2(C)CC[C@@H](C)C2(C)C)cc(C)[nH+]1 ZINC001584183450 1056279242 /nfs/dbraw/zinc/27/92/42/1056279242.db2.gz GPBMNVFYUAMREO-JDGWVLRBSA-N 1 2 314.473 4.333 20 0 DIADLO Cc1cc(NCC[C@]2(C)CC2(Cl)Cl)nc(C2CC2)[nH+]1 ZINC001612388487 1056280842 /nfs/dbraw/zinc/28/08/42/1056280842.db2.gz GXTKFEWVTQOVGK-CYBMUJFWSA-N 1 2 300.233 4.048 20 0 DIADLO Cc1cc(C)c(NC(=O)CCC[N@@H+]2CCC[C@H]2C(F)F)c(C)c1 ZINC000353171287 1056289491 /nfs/dbraw/zinc/28/94/91/1056289491.db2.gz HZNQPXYIOVCIII-HNNXBMFYSA-N 1 2 324.415 4.060 20 0 DIADLO Cc1cc(C)c(NC(=O)CCC[N@H+]2CCC[C@H]2C(F)F)c(C)c1 ZINC000353171287 1056289508 /nfs/dbraw/zinc/28/95/08/1056289508.db2.gz HZNQPXYIOVCIII-HNNXBMFYSA-N 1 2 324.415 4.060 20 0 DIADLO CCC(C)(C)[C@H](C)Nc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC001612600816 1056309567 /nfs/dbraw/zinc/30/95/67/1056309567.db2.gz USFCGTQESLISFV-ZDUSSCGKSA-N 1 2 309.417 4.052 20 0 DIADLO Cc1cc(N[C@@H]2CCNc3ccccc32)[nH+]cc1C(F)(F)F ZINC001168640043 1056312068 /nfs/dbraw/zinc/31/20/68/1056312068.db2.gz WUOLDOSSLGVVSB-CQSZACIVSA-N 1 2 307.319 4.378 20 0 DIADLO Cc1cc(N[C@@H](C)COCC2CCCCC2)nc(C2CC2)[nH+]1 ZINC001612945787 1056341419 /nfs/dbraw/zinc/34/14/19/1056341419.db2.gz NBWAXRFRWRNJRO-AWEZNQCLSA-N 1 2 303.450 4.060 20 0 DIADLO CC(C)c1cc(N2CCO[C@@H](C(C)(C)C)CC2)nc(C(C)C)[nH+]1 ZINC001613073181 1056350284 /nfs/dbraw/zinc/35/02/84/1056350284.db2.gz UGPDVIGJXJZSET-MRXNPFEDSA-N 1 2 319.493 4.365 20 0 DIADLO CCCc1occc1C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC001544055891 1056351945 /nfs/dbraw/zinc/35/19/45/1056351945.db2.gz QKBSDDGXJUPZHW-UHFFFAOYSA-N 1 2 323.396 4.099 20 0 DIADLO c1[nH+]c(SC[C@H]2CC3(CO2)CCCCC3)n2ccccc12 ZINC001613234120 1056361581 /nfs/dbraw/zinc/36/15/81/1056361581.db2.gz FBLZENMWQFIONW-OAHLLOKOSA-N 1 2 302.443 4.166 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2cscn2)c2ccccc2)cc1 ZINC000057621450 1056367749 /nfs/dbraw/zinc/36/77/49/1056367749.db2.gz NVLHNZWNWFCVOP-GOSISDBHSA-N 1 2 310.422 4.031 20 0 DIADLO CCCN(C(=O)c1cc2c[nH+]ccc2[nH]1)[C@H]1CCc2ccccc21 ZINC001544159406 1056372830 /nfs/dbraw/zinc/37/28/30/1056372830.db2.gz PFWRBPDMBSJWQZ-IBGZPJMESA-N 1 2 319.408 4.103 20 0 DIADLO CCc1ccc(-c2ccc(-c3ccc4[nH+]ccn4c3)nn2)cc1 ZINC001240217617 1056375279 /nfs/dbraw/zinc/37/52/79/1056375279.db2.gz SGAMAKREXSHICI-UHFFFAOYSA-N 1 2 300.365 4.021 20 0 DIADLO c1cn2cc(-c3nc(N4CCCC4)cc4ccccc43)ccc2[nH+]1 ZINC001240216651 1056375961 /nfs/dbraw/zinc/37/59/61/1056375961.db2.gz KHMCJYVOOXAQRO-UHFFFAOYSA-N 1 2 314.392 4.150 20 0 DIADLO c1cc(C2CCCCC2)ccc1SCC[NH+]1CCOCC1 ZINC001613479770 1056382361 /nfs/dbraw/zinc/38/23/61/1056382361.db2.gz UGRMVFQKPHMYOT-UHFFFAOYSA-N 1 2 305.487 4.159 20 0 DIADLO COc1cccc(SCc2ccc(-n3cc[nH+]c3)cc2C)c1 ZINC001613466992 1056382544 /nfs/dbraw/zinc/38/25/44/1056382544.db2.gz HNNMSFKHQZRQPP-UHFFFAOYSA-N 1 2 310.422 4.482 20 0 DIADLO CCCc1cc(N[C@H]2CCCc3cccnc32)nc(CCC)[nH+]1 ZINC001168655336 1056386202 /nfs/dbraw/zinc/38/62/02/1056386202.db2.gz DFQNFCJZMQVRMK-INIZCTEOSA-N 1 2 310.445 4.266 20 0 DIADLO Fc1ccccc1COc1cccc(-c2nc3[nH]ccc3c[nH+]2)c1 ZINC001240263595 1056398442 /nfs/dbraw/zinc/39/84/42/1056398442.db2.gz YFZSGDSKKKZGIT-UHFFFAOYSA-N 1 2 319.339 4.295 20 0 DIADLO Fc1ccc(COc2ccc(-c3nc4[nH]ccc4c[nH+]3)cc2)cc1 ZINC001240278257 1056407998 /nfs/dbraw/zinc/40/79/98/1056407998.db2.gz MHOCJHYCXCQNSW-UHFFFAOYSA-N 1 2 319.339 4.295 20 0 DIADLO Cc1ccc(-c2ccc(OCc3ccc(F)cc3)cc2)[nH+]c1N ZINC001240279261 1056408967 /nfs/dbraw/zinc/40/89/67/1056408967.db2.gz NGTQVAQXNCSEMF-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO C/C(=C\c1ccc(C)cc1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001544349937 1056411640 /nfs/dbraw/zinc/41/16/40/1056411640.db2.gz GUJCWDMUTWPQJK-FYWRMAATSA-N 1 2 317.392 4.427 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc3ncsc3c2)cc1F ZINC001240348021 1056440934 /nfs/dbraw/zinc/44/09/34/1056440934.db2.gz YXTVBMVWUOPJHV-UHFFFAOYSA-N 1 2 304.365 4.303 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](c2cccc(Cl)c2)c2ccccn2)cn1 ZINC000156238066 1056447005 /nfs/dbraw/zinc/44/70/05/1056447005.db2.gz JSBULQNCQCUXES-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO Cn1cc(-c2ccc(-c3ccc(F)c(-n4cc[nH+]c4)c3)cc2)cn1 ZINC001240366440 1056452439 /nfs/dbraw/zinc/45/24/39/1056452439.db2.gz CHIDFFKRBFHNMY-UHFFFAOYSA-N 1 2 318.355 4.079 20 0 DIADLO CC(C)n1cnc2cc(-c3ccc(-n4cc[nH+]c4)cc3)ccc21 ZINC001240369777 1056455237 /nfs/dbraw/zinc/45/52/37/1056455237.db2.gz RTNUSAIUTRXKPL-UHFFFAOYSA-N 1 2 302.381 4.470 20 0 DIADLO CC[C@H]1c2ccsc2CC[N@H+]1Cc1nc2c(o1)CCCC2 ZINC001615148511 1056470651 /nfs/dbraw/zinc/47/06/51/1056470651.db2.gz IZWPCFJJFOATQT-AWEZNQCLSA-N 1 2 302.443 4.124 20 0 DIADLO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1nc2c(o1)CCCC2 ZINC001615148511 1056470665 /nfs/dbraw/zinc/47/06/65/1056470665.db2.gz IZWPCFJJFOATQT-AWEZNQCLSA-N 1 2 302.443 4.124 20 0 DIADLO CCc1nc([C@H]2CCCC[N@@H+]2CC/C=C/c2ccccc2)no1 ZINC001615215705 1056478153 /nfs/dbraw/zinc/47/81/53/1056478153.db2.gz ZBLUAEKCFRQNQY-USAXFFIDSA-N 1 2 311.429 4.263 20 0 DIADLO CCc1nc([C@H]2CCCC[N@H+]2CC/C=C/c2ccccc2)no1 ZINC001615215705 1056478156 /nfs/dbraw/zinc/47/81/56/1056478156.db2.gz ZBLUAEKCFRQNQY-USAXFFIDSA-N 1 2 311.429 4.263 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@@H+]2CC=C(Cl)Cl)cc1 ZINC001615484328 1056521464 /nfs/dbraw/zinc/52/14/64/1056521464.db2.gz FHZWPXDTNWAUGO-CYBMUJFWSA-N 1 2 302.270 4.404 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@H+]2CC=C(Cl)Cl)cc1 ZINC001615484328 1056521477 /nfs/dbraw/zinc/52/14/77/1056521477.db2.gz FHZWPXDTNWAUGO-CYBMUJFWSA-N 1 2 302.270 4.404 20 0 DIADLO CC[C@H]1CCCCN1C(=O)C[N@H+](C)[C@H](C)c1ccccc1Cl ZINC000251650221 1056527021 /nfs/dbraw/zinc/52/70/21/1056527021.db2.gz GKYLIDMSPUNUGW-CABCVRRESA-N 1 2 322.880 4.124 20 0 DIADLO CC[C@H]1CCCCN1C(=O)C[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC000251650221 1056527033 /nfs/dbraw/zinc/52/70/33/1056527033.db2.gz GKYLIDMSPUNUGW-CABCVRRESA-N 1 2 322.880 4.124 20 0 DIADLO Cc1cc2cc(-c3c[nH+]c(N4CCCCC4)cc3C)cnc2[nH]1 ZINC001240483943 1056532094 /nfs/dbraw/zinc/53/20/94/1056532094.db2.gz QACZANNSCSCVQD-UHFFFAOYSA-N 1 2 306.413 4.232 20 0 DIADLO Cc1ccc(C)c(-c2ccc(-c3ccn4cc[nH+]c4c3)nn2)c1 ZINC001240503889 1056540651 /nfs/dbraw/zinc/54/06/51/1056540651.db2.gz HQRXBOMDVPJCQL-UHFFFAOYSA-N 1 2 300.365 4.075 20 0 DIADLO CC(C)C[C@H](C(=O)N1CCCC[C@@H]1CC1CCC1)n1cc[nH+]c1 ZINC001585376827 1056541094 /nfs/dbraw/zinc/54/10/94/1056541094.db2.gz WIXHRSWMYBVSFH-QZTJIDSGSA-N 1 2 317.477 4.042 20 0 DIADLO CCc1ccc([C@H]2COCC[N@@H+]2CC/C=C\c2ccccc2)o1 ZINC001615583683 1056541557 /nfs/dbraw/zinc/54/15/57/1056541557.db2.gz NJUBWQWEBUBSPG-FUKWUPMWSA-N 1 2 311.425 4.319 20 0 DIADLO CCc1ccc([C@H]2COCC[N@H+]2CC/C=C\c2ccccc2)o1 ZINC001615583683 1056541574 /nfs/dbraw/zinc/54/15/74/1056541574.db2.gz NJUBWQWEBUBSPG-FUKWUPMWSA-N 1 2 311.425 4.319 20 0 DIADLO Fc1ccc(COc2cccnc2-c2ccn3cc[nH+]c3c2)cc1 ZINC001240504489 1056542062 /nfs/dbraw/zinc/54/20/62/1056542062.db2.gz PZEDSDBKLXSCCY-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO Cc1nc(OCc2ccccc2)ccc1-c1ccn2cc[nH+]c2c1 ZINC001240508643 1056543837 /nfs/dbraw/zinc/54/38/37/1056543837.db2.gz HAMJGXAXFZHKBN-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO Cc1ccnc(-c2cc(C)cc(-c3ccn4cc[nH+]c4c3)n2)c1 ZINC001240511168 1056545021 /nfs/dbraw/zinc/54/50/21/1056545021.db2.gz AQBXKTWZVLCGLP-UHFFFAOYSA-N 1 2 300.365 4.075 20 0 DIADLO CCOC(=O)[C@H](CC)c1ccc(-c2ccn3cc[nH+]c3c2)cc1 ZINC001240512374 1056547159 /nfs/dbraw/zinc/54/71/59/1056547159.db2.gz TZSSCBQHOOKCRP-QGZVFWFLSA-N 1 2 308.381 4.058 20 0 DIADLO Cc1ccc(Nc2cc(F)c(OC(F)F)c(F)c2)c(C)[nH+]1 ZINC001212443965 1056548088 /nfs/dbraw/zinc/54/80/88/1056548088.db2.gz WICKQNAXXJTHTK-UHFFFAOYSA-N 1 2 300.255 4.322 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2cc(Cl)n(C)n2)o1 ZINC001615630627 1056550575 /nfs/dbraw/zinc/55/05/75/1056550575.db2.gz NVMBWMHGMBJLPB-CQSZACIVSA-N 1 2 307.825 4.092 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2cc(Cl)n(C)n2)o1 ZINC001615630627 1056550585 /nfs/dbraw/zinc/55/05/85/1056550585.db2.gz NVMBWMHGMBJLPB-CQSZACIVSA-N 1 2 307.825 4.092 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cccc(N3CCCC3)c2)c1 ZINC001240536492 1056559838 /nfs/dbraw/zinc/55/98/38/1056559838.db2.gz DDMYYRHOYGOIQL-UHFFFAOYSA-N 1 2 303.409 4.354 20 0 DIADLO Cc1cc(C)c(Nc2cc(F)c(OC(F)F)c(F)c2)c[nH+]1 ZINC001212444949 1056564623 /nfs/dbraw/zinc/56/46/23/1056564623.db2.gz IPKKLIRRYOAJMP-UHFFFAOYSA-N 1 2 300.255 4.322 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(Br)cc(F)c1F ZINC001615713103 1056566987 /nfs/dbraw/zinc/56/69/87/1056566987.db2.gz GQYRBQOEWWKVHV-AOOOYVTPSA-N 1 2 318.205 4.490 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cc(Br)cc(F)c1F ZINC001615713103 1056566994 /nfs/dbraw/zinc/56/69/94/1056566994.db2.gz GQYRBQOEWWKVHV-AOOOYVTPSA-N 1 2 318.205 4.490 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(Br)s1 ZINC001615726323 1056571271 /nfs/dbraw/zinc/57/12/71/1056571271.db2.gz SWNSZPBOSDMAFV-NSHDSACASA-N 1 2 322.271 4.457 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ccc(Br)s1 ZINC001615726323 1056571287 /nfs/dbraw/zinc/57/12/87/1056571287.db2.gz SWNSZPBOSDMAFV-NSHDSACASA-N 1 2 322.271 4.457 20 0 DIADLO Cn1c(C[NH2+]Cc2c(F)c(F)cc(F)c2F)cc2ccccc21 ZINC001620828782 1056571372 /nfs/dbraw/zinc/57/13/72/1056571372.db2.gz CJZNIKWPXLYYDI-UHFFFAOYSA-N 1 2 322.305 4.025 20 0 DIADLO c1cc2cc(NCc3cnc(-c4ccccc4)s3)[nH+]cc2[nH]1 ZINC000672228604 1056573321 /nfs/dbraw/zinc/57/33/21/1056573321.db2.gz WMNSPFYBGPBDOH-UHFFFAOYSA-N 1 2 306.394 4.299 20 0 DIADLO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)Cc1ncccc1F ZINC001621184282 1056579617 /nfs/dbraw/zinc/57/96/17/1056579617.db2.gz MLZCAEYMKGDVES-NSHDSACASA-N 1 2 312.310 4.433 20 0 DIADLO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)Cc1ncccc1F ZINC001621184282 1056579625 /nfs/dbraw/zinc/57/96/25/1056579625.db2.gz MLZCAEYMKGDVES-NSHDSACASA-N 1 2 312.310 4.433 20 0 DIADLO CCc1nc(N2CCCC[C@@H]2c2ccccc2OC)cc(C)[nH+]1 ZINC000672244115 1056587636 /nfs/dbraw/zinc/58/76/36/1056587636.db2.gz HTPVFSNQIQDRKG-MRXNPFEDSA-N 1 2 311.429 4.088 20 0 DIADLO Cn1nc(CNc2cc[nH+]c3c(Cl)cccc23)c2ccccc21 ZINC000672251017 1056588735 /nfs/dbraw/zinc/58/87/35/1056588735.db2.gz RDCLZCOPNXCLPX-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(N3CCCCC3)nc2)cc1 ZINC001240585894 1056593578 /nfs/dbraw/zinc/59/35/78/1056593578.db2.gz URALUKYHKCHYHV-UHFFFAOYSA-N 1 2 318.424 4.139 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2ccc(N3CCCCC3)nc2)cc1 ZINC001240585695 1056594103 /nfs/dbraw/zinc/59/41/03/1056594103.db2.gz PFNMMCQJGHNFJS-UHFFFAOYSA-N 1 2 309.413 4.101 20 0 DIADLO Cc1cc(F)cc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c1 ZINC001240597138 1056603391 /nfs/dbraw/zinc/60/33/91/1056603391.db2.gz LOXDAVNYGOTZAY-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO Cc1cc(F)cc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c1 ZINC001240597138 1056603397 /nfs/dbraw/zinc/60/33/97/1056603397.db2.gz LOXDAVNYGOTZAY-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO OC[C@H]1c2ccccc2CC[N@H+]1Cc1cccc(Cl)c1Cl ZINC001616058758 1056609366 /nfs/dbraw/zinc/60/93/66/1056609366.db2.gz AOPFLSCTLWDMOD-INIZCTEOSA-N 1 2 322.235 4.085 20 0 DIADLO OC[C@H]1c2ccccc2CC[N@@H+]1Cc1cccc(Cl)c1Cl ZINC001616058758 1056609369 /nfs/dbraw/zinc/60/93/69/1056609369.db2.gz AOPFLSCTLWDMOD-INIZCTEOSA-N 1 2 322.235 4.085 20 0 DIADLO CCC[C@@H]1CCC[N@@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001616158816 1056616106 /nfs/dbraw/zinc/61/61/06/1056616106.db2.gz KARLGLLVUCJLTH-CZUORRHYSA-N 1 2 309.837 4.066 20 0 DIADLO CCC[C@@H]1CCC[N@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001616158816 1056616114 /nfs/dbraw/zinc/61/61/14/1056616114.db2.gz KARLGLLVUCJLTH-CZUORRHYSA-N 1 2 309.837 4.066 20 0 DIADLO CC(C)C[C@@H]1CCC[N@H+](Cc2noc(C3CCCCC3)n2)C1 ZINC001616323272 1056634522 /nfs/dbraw/zinc/63/45/22/1056634522.db2.gz UAPBIKNZFDWVFL-HNNXBMFYSA-N 1 2 305.466 4.375 20 0 DIADLO CC(C)C[C@@H]1CCC[N@@H+](Cc2noc(C3CCCCC3)n2)C1 ZINC001616323272 1056634530 /nfs/dbraw/zinc/63/45/30/1056634530.db2.gz UAPBIKNZFDWVFL-HNNXBMFYSA-N 1 2 305.466 4.375 20 0 DIADLO CCSc1ccccc1C[N@H+](CC(=O)OC(C)(C)C)C(C)C ZINC001616383287 1056647054 /nfs/dbraw/zinc/64/70/54/1056647054.db2.gz ZASKNJGPLIKYDI-UHFFFAOYSA-N 1 2 323.502 4.351 20 0 DIADLO CCSc1ccccc1C[N@@H+](CC(=O)OC(C)(C)C)C(C)C ZINC001616383287 1056647056 /nfs/dbraw/zinc/64/70/56/1056647056.db2.gz ZASKNJGPLIKYDI-UHFFFAOYSA-N 1 2 323.502 4.351 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](Cc3ccccn3)C(C)C)co2)cc1 ZINC000076777125 1056656309 /nfs/dbraw/zinc/65/63/09/1056656309.db2.gz RTMSZPPLQWCIKM-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](Cc3ccccn3)C(C)C)co2)cc1 ZINC000076777125 1056656318 /nfs/dbraw/zinc/65/63/18/1056656318.db2.gz RTMSZPPLQWCIKM-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO c1coc([C@H]2CCCCC[N@H+]2Cc2cn3ccsc3n2)c1 ZINC000076804958 1056658770 /nfs/dbraw/zinc/65/87/70/1056658770.db2.gz REBNDOOCHFRCDA-CQSZACIVSA-N 1 2 301.415 4.106 20 0 DIADLO c1coc([C@H]2CCCCC[N@@H+]2Cc2cn3ccsc3n2)c1 ZINC000076804958 1056658775 /nfs/dbraw/zinc/65/87/75/1056658775.db2.gz REBNDOOCHFRCDA-CQSZACIVSA-N 1 2 301.415 4.106 20 0 DIADLO CCc1c(C)cc(-c2ccc(-n3c[nH+]c(C)c3C)nn2)cc1C ZINC001240739355 1056670283 /nfs/dbraw/zinc/67/02/83/1056670283.db2.gz HJJQYFCBCAEHFT-UHFFFAOYSA-N 1 2 306.413 4.125 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccc(N3CCOCC3)cc2)c1 ZINC001240768483 1056690453 /nfs/dbraw/zinc/69/04/53/1056690453.db2.gz SLCTXUTXIQEVTO-UHFFFAOYSA-N 1 2 324.468 4.345 20 0 DIADLO Cc1ccccc1[C@H]([NH2+][C@@H](C(=O)OC(C)(C)C)C1CC1)C1CC1 ZINC001616637342 1056692440 /nfs/dbraw/zinc/69/24/40/1056692440.db2.gz VJTLJQBNNSVNFI-QZTJIDSGSA-N 1 2 315.457 4.156 20 0 DIADLO CCCCOC(=O)[C@@H](C)[NH2+][C@@H](CC)C(C)(C)c1ccccc1 ZINC001616645835 1056693706 /nfs/dbraw/zinc/69/37/06/1056693706.db2.gz NICRJEFUHRAVBY-WBVHZDCISA-N 1 2 305.462 4.064 20 0 DIADLO CC(C)(C)CN(Cc1ccccc1)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001616768375 1056713102 /nfs/dbraw/zinc/71/31/02/1056713102.db2.gz BSPZLLKTGBTBHI-UHFFFAOYSA-N 1 2 321.424 4.251 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+][C@H](CCO)c2ccco2)c1Cl ZINC000922007087 1056729675 /nfs/dbraw/zinc/72/96/75/1056729675.db2.gz FWXAPRUCVIISJO-CYBMUJFWSA-N 1 2 314.212 4.108 20 0 DIADLO CC[C@@]1(C)COCC[N@@H+]1Cc1ccc(OC(C)C)c(Cl)c1 ZINC001616888237 1056734083 /nfs/dbraw/zinc/73/40/83/1056734083.db2.gz VUTPGMYMDFIIFQ-KRWDZBQOSA-N 1 2 311.853 4.128 20 0 DIADLO CC[C@@]1(C)COCC[N@H+]1Cc1ccc(OC(C)C)c(Cl)c1 ZINC001616888237 1056734096 /nfs/dbraw/zinc/73/40/96/1056734096.db2.gz VUTPGMYMDFIIFQ-KRWDZBQOSA-N 1 2 311.853 4.128 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@H+]1Cc1ccc2c(c1)CCC2 ZINC001616898453 1056735890 /nfs/dbraw/zinc/73/58/90/1056735890.db2.gz BYTUDEYCWGSVIA-CYBMUJFWSA-N 1 2 300.833 4.207 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@@H+]1Cc1ccc2c(c1)CCC2 ZINC001616898453 1056735898 /nfs/dbraw/zinc/73/58/98/1056735898.db2.gz BYTUDEYCWGSVIA-CYBMUJFWSA-N 1 2 300.833 4.207 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1ccc(Oc2cccnc2)cc1 ZINC001240880813 1056737493 /nfs/dbraw/zinc/73/74/93/1056737493.db2.gz NLSIQTWNENJMAI-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+][C@@H]1CCCC1(F)F ZINC000672622448 1056737993 /nfs/dbraw/zinc/73/79/93/1056737993.db2.gz IXBPQFBMJWYZSI-GXFFZTMASA-N 1 2 323.412 4.352 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc(OCC(F)(F)F)cc1 ZINC000672621857 1056740118 /nfs/dbraw/zinc/74/01/18/1056740118.db2.gz MCVLSIOZQICEJF-GXFFZTMASA-N 1 2 323.305 4.466 20 0 DIADLO Clc1cccc(Cl)c1N1CC[NH+]([C@H]2C=CCCC2)CC1 ZINC001617024012 1056760435 /nfs/dbraw/zinc/76/04/35/1056760435.db2.gz PPARGAMEIQFHCM-ZDUSSCGKSA-N 1 2 311.256 4.224 20 0 DIADLO CC(C)c1nsc(C[NH2+][C@@H](C)c2ccc(Cl)s2)n1 ZINC001617055773 1056767494 /nfs/dbraw/zinc/76/74/94/1056767494.db2.gz LUBVUUUDYMGCGP-QMMMGPOBSA-N 1 2 301.868 4.227 20 0 DIADLO CCCc1cc(N[C@H](C)CCCC(C)(C)O)nc(CCC)[nH+]1 ZINC001168700578 1056781669 /nfs/dbraw/zinc/78/16/69/1056781669.db2.gz ZEYDYTVFLAKNQV-CQSZACIVSA-N 1 2 307.482 4.123 20 0 DIADLO Fc1cccc(F)c1C[N@H+](C[C@@H]1CCC2(CCC2)O1)C1CC1 ZINC001617169348 1056787232 /nfs/dbraw/zinc/78/72/32/1056787232.db2.gz SMACGGUAKGEIEE-AWEZNQCLSA-N 1 2 307.384 4.031 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](C[C@@H]1CCC2(CCC2)O1)C1CC1 ZINC001617169348 1056787242 /nfs/dbraw/zinc/78/72/42/1056787242.db2.gz SMACGGUAKGEIEE-AWEZNQCLSA-N 1 2 307.384 4.031 20 0 DIADLO Cc1ccc(-c2ccc(C[NH+]3CCOCC3)cn2)c2ccccc12 ZINC001241004367 1056807616 /nfs/dbraw/zinc/80/76/16/1056807616.db2.gz MANQDOYLTWHOHE-UHFFFAOYSA-N 1 2 318.420 4.042 20 0 DIADLO CC[N@H+](CC(=O)NC1CCCCCC1)Cc1ccccc1Cl ZINC001586809742 1056810377 /nfs/dbraw/zinc/81/03/77/1056810377.db2.gz UXMIOHXGDUMYNX-UHFFFAOYSA-N 1 2 322.880 4.001 20 0 DIADLO CC[N@@H+](CC(=O)NC1CCCCCC1)Cc1ccccc1Cl ZINC001586809742 1056810386 /nfs/dbraw/zinc/81/03/86/1056810386.db2.gz UXMIOHXGDUMYNX-UHFFFAOYSA-N 1 2 322.880 4.001 20 0 DIADLO CSc1cccc(F)c1C[NH2+]Cc1cc(C)cnc1Cl ZINC000922122427 1056825805 /nfs/dbraw/zinc/82/58/05/1056825805.db2.gz MSBXLXKAADATGU-UHFFFAOYSA-N 1 2 310.825 4.194 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2ccc3sccc3c2)n1 ZINC000922136049 1056836292 /nfs/dbraw/zinc/83/62/92/1056836292.db2.gz YHSJNNRDEGETQJ-UHFFFAOYSA-N 1 2 300.427 4.477 20 0 DIADLO Cc1ccc(F)cc1NC(=O)C[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC001586961444 1056840452 /nfs/dbraw/zinc/84/04/52/1056840452.db2.gz WDTSZCQIJUVVAC-MRXNPFEDSA-N 1 2 323.371 4.018 20 0 DIADLO COc1ccc(-c2ccc(-c3c[nH+]cn3C)cc2)c(F)c1F ZINC001241044816 1056842284 /nfs/dbraw/zinc/84/22/84/1056842284.db2.gz HHDLMTPQGLMANB-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO CCOc1ccc(-c2nc3[nH]c(C)cc3c[nH+]2)cc1C(F)(F)F ZINC001241054562 1056851151 /nfs/dbraw/zinc/85/11/51/1056851151.db2.gz WXRGQKKRQKWEGP-UHFFFAOYSA-N 1 2 321.302 4.302 20 0 DIADLO CCOc1ccc(-c2ccc3[nH+]ccn3c2)cc1C(F)(F)F ZINC001241055593 1056852596 /nfs/dbraw/zinc/85/25/96/1056852596.db2.gz XTMZIRSGBNPUSD-UHFFFAOYSA-N 1 2 306.287 4.419 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@H]2CCCc3c(F)cc(F)cc32)n1 ZINC000922150336 1056853208 /nfs/dbraw/zinc/85/32/08/1056853208.db2.gz RMQRKQYGVYAFST-HNNXBMFYSA-N 1 2 320.383 4.418 20 0 DIADLO Fc1ccc([C@@H]([NH2+][C@@H]2CCCc3[nH]ncc32)C2CC2)cc1Cl ZINC000453309399 1056879919 /nfs/dbraw/zinc/87/99/19/1056879919.db2.gz DURHFSFYGPPSIF-WBVHZDCISA-N 1 2 319.811 4.321 20 0 DIADLO C[C@H](C[N@@H+]1CCOC[C@H]1c1ccco1)c1cccc(Cl)c1 ZINC000682155328 1056891454 /nfs/dbraw/zinc/89/14/54/1056891454.db2.gz ULWDIJUDQITHFC-CJNGLKHVSA-N 1 2 305.805 4.110 20 0 DIADLO C[C@H](C[N@H+]1CCOC[C@H]1c1ccco1)c1cccc(Cl)c1 ZINC000682155328 1056891459 /nfs/dbraw/zinc/89/14/59/1056891459.db2.gz ULWDIJUDQITHFC-CJNGLKHVSA-N 1 2 305.805 4.110 20 0 DIADLO FC(F)(F)[C@@H]1CC[C@H](C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)O1 ZINC001617868249 1056893125 /nfs/dbraw/zinc/89/31/25/1056893125.db2.gz NDBAUHGAGHDSFU-RDBSUJKOSA-N 1 2 319.754 4.197 20 0 DIADLO FC(F)(F)[C@@H]1CC[C@H](C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)O1 ZINC001617868249 1056893137 /nfs/dbraw/zinc/89/31/37/1056893137.db2.gz NDBAUHGAGHDSFU-RDBSUJKOSA-N 1 2 319.754 4.197 20 0 DIADLO CCOc1ccc(F)cc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001241104599 1056896164 /nfs/dbraw/zinc/89/61/64/1056896164.db2.gz FJGKQFKPOLZJNU-UHFFFAOYSA-N 1 2 309.331 4.231 20 0 DIADLO Cc1cc(C[NH2+]Cc2cccc(OCC3CCCCC3)c2)no1 ZINC000066875232 1056897796 /nfs/dbraw/zinc/89/77/96/1056897796.db2.gz QZMJOPMUUZDFHV-UHFFFAOYSA-N 1 2 314.429 4.232 20 0 DIADLO CCOc1ccc(F)cc1-c1ccc(-n2cc[nH+]c2)cc1OC ZINC001241105291 1056897660 /nfs/dbraw/zinc/89/76/60/1056897660.db2.gz OPUUBZMKZXTYDD-UHFFFAOYSA-N 1 2 312.344 4.086 20 0 DIADLO Cc1ccccc1CC[N@@H+](C)Cc1c(Cl)cncc1Cl ZINC001618160369 1056928237 /nfs/dbraw/zinc/92/82/37/1056928237.db2.gz RUIHWGYYVSRHJX-UHFFFAOYSA-N 1 2 309.240 4.371 20 0 DIADLO Cc1ccccc1CC[N@H+](C)Cc1c(Cl)cncc1Cl ZINC001618160369 1056928249 /nfs/dbraw/zinc/92/82/49/1056928249.db2.gz RUIHWGYYVSRHJX-UHFFFAOYSA-N 1 2 309.240 4.371 20 0 DIADLO CCOC(=O)C(CC)(CC)[NH2+]CCSc1ccc(C)c(C)c1 ZINC001618209638 1056933797 /nfs/dbraw/zinc/93/37/97/1056933797.db2.gz XLMXCBGAQGUCHP-UHFFFAOYSA-N 1 2 323.502 4.107 20 0 DIADLO Cc1ccc(-c2cc(F)cc(OCc3ccccc3)c2)[nH+]c1N ZINC001241160284 1056935942 /nfs/dbraw/zinc/93/59/42/1056935942.db2.gz ZAUVSJBZZYEAFC-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO CCOc1cc(-c2ccn3cc(N)[nH+]c3c2)cc(C(F)(F)F)c1 ZINC001241163466 1056938189 /nfs/dbraw/zinc/93/81/89/1056938189.db2.gz RLERXJUNCNIZDL-UHFFFAOYSA-N 1 2 321.302 4.001 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(Cl)c(C)c1Cl ZINC000922164083 1056939150 /nfs/dbraw/zinc/93/91/50/1056939150.db2.gz IKIJHCFMDPPUOS-LLVKDONJSA-N 1 2 312.244 4.369 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCn3c(cc4ccccc43)C2)cc1F ZINC001618243411 1056939838 /nfs/dbraw/zinc/93/98/38/1056939838.db2.gz XEVWIONURJALOZ-UHFFFAOYSA-N 1 2 308.400 4.495 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)c1Cl ZINC000922163564 1056939898 /nfs/dbraw/zinc/93/98/98/1056939898.db2.gz CEFSDOUCDBRLOK-NOZJJQNGSA-N 1 2 310.228 4.294 20 0 DIADLO Cc1ccc(C[N@H+]2CCCn3c(cc4ccccc43)C2)cc1F ZINC001618243411 1056939851 /nfs/dbraw/zinc/93/98/51/1056939851.db2.gz XEVWIONURJALOZ-UHFFFAOYSA-N 1 2 308.400 4.495 20 0 DIADLO c1ccc([C@@H]2CSCC[N@H+]2Cc2nc3ccccc3o2)cc1 ZINC000115561299 1056942123 /nfs/dbraw/zinc/94/21/23/1056942123.db2.gz HFYYHNGIBKEZIZ-INIZCTEOSA-N 1 2 310.422 4.118 20 0 DIADLO c1ccc([C@@H]2CSCC[N@@H+]2Cc2nc3ccccc3o2)cc1 ZINC000115561299 1056942130 /nfs/dbraw/zinc/94/21/30/1056942130.db2.gz HFYYHNGIBKEZIZ-INIZCTEOSA-N 1 2 310.422 4.118 20 0 DIADLO COc1cccc(OC)c1-c1ccccc1-c1cc[nH+]c(N)c1 ZINC001241175632 1056945981 /nfs/dbraw/zinc/94/59/81/1056945981.db2.gz HLWALHMJKWKBRM-UHFFFAOYSA-N 1 2 306.365 4.015 20 0 DIADLO CCOc1ccc(-c2ccc(-c3c[nH+]cn3C)cc2)c(F)c1F ZINC001241179466 1056948270 /nfs/dbraw/zinc/94/82/70/1056948270.db2.gz KWSDYILXGPBNJF-UHFFFAOYSA-N 1 2 314.335 4.431 20 0 DIADLO CCOc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c(F)c1F ZINC001241179179 1056948379 /nfs/dbraw/zinc/94/83/79/1056948379.db2.gz ZVOODJHRSYTPBO-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO C/C(=C\C=C\[NH3+])c1cc(F)c(OCc2ccccc2)cc1F ZINC001241181624 1056950377 /nfs/dbraw/zinc/95/03/77/1056950377.db2.gz ULTXVGAWSJRYQY-PMHYKQBESA-N 1 2 301.336 4.420 20 0 DIADLO CC(C)[N@H+](Cc1coc(-c2ccccc2)n1)Cc1ccccn1 ZINC000079915308 1056954320 /nfs/dbraw/zinc/95/43/20/1056954320.db2.gz KLBRVBJMNMWVJN-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO CC(C)[N@@H+](Cc1coc(-c2ccccc2)n1)Cc1ccccn1 ZINC000079915308 1056954326 /nfs/dbraw/zinc/95/43/26/1056954326.db2.gz KLBRVBJMNMWVJN-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1cccc(O[C@H]2CCCCO2)c1 ZINC001241212389 1056961903 /nfs/dbraw/zinc/96/19/03/1056961903.db2.gz HDTZDZCLVXOQRV-IBGZPJMESA-N 1 2 324.380 4.144 20 0 DIADLO Cc1c(-c2cccc(O[C@H]3CCCCO3)c2)ccc2[nH+]ccn21 ZINC001241217041 1056965144 /nfs/dbraw/zinc/96/51/44/1056965144.db2.gz JMQRVORBANECJG-IBGZPJMESA-N 1 2 308.381 4.215 20 0 DIADLO COC(=[NH2+])c1cccc(-c2cccc(O[C@H]3CCCCO3)c2)c1 ZINC001241217092 1056965214 /nfs/dbraw/zinc/96/52/14/1056965214.db2.gz UURJJWUFHBEIPA-SFHVURJKSA-N 1 2 311.381 4.231 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc(F)c1 ZINC000116185181 1056967270 /nfs/dbraw/zinc/96/72/70/1056967270.db2.gz YHOJJQVACMMIRD-CYBMUJFWSA-N 1 2 323.371 4.348 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cc(OCc2ccccc2)ccn1 ZINC001241232931 1056971151 /nfs/dbraw/zinc/97/11/51/1056971151.db2.gz AEMNFLYYMUVQGF-UHFFFAOYSA-N 1 2 319.408 4.097 20 0 DIADLO Cc1ccc(F)c2cc(C)c(-c3c[nH+]c(N(C)C)cc3C)nc12 ZINC001241233216 1056971576 /nfs/dbraw/zinc/97/15/76/1056971576.db2.gz JJEUKDIAVJRVIQ-UHFFFAOYSA-N 1 2 309.388 4.427 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cc(C2CCCCC2)nc(C)n1 ZINC001241235992 1056973085 /nfs/dbraw/zinc/97/30/85/1056973085.db2.gz ZBKVKLDZNZKXSX-UHFFFAOYSA-N 1 2 310.445 4.269 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)n1 ZINC000080471993 1056973235 /nfs/dbraw/zinc/97/32/35/1056973235.db2.gz CNTCVIQXOMCPCW-XHDPSFHLSA-N 1 2 305.397 4.345 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cc(-c2ccccc2)cnc1F ZINC001241244263 1056977524 /nfs/dbraw/zinc/97/75/24/1056977524.db2.gz ZVWOFIKBEQYZBL-UHFFFAOYSA-N 1 2 307.372 4.324 20 0 DIADLO Cc1cc(-c2ncnc3c2C[N@H+](Cc2ccccc2)C3)ccc1F ZINC001241279140 1056993688 /nfs/dbraw/zinc/99/36/88/1056993688.db2.gz UQUAQLVZSBTMAF-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO Cc1cc(-c2ncnc3c2C[N@@H+](Cc2ccccc2)C3)ccc1F ZINC001241279140 1056993692 /nfs/dbraw/zinc/99/36/92/1056993692.db2.gz UQUAQLVZSBTMAF-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO CCOc1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c(F)c1 ZINC001241276823 1056993756 /nfs/dbraw/zinc/99/37/56/1056993756.db2.gz HGIZDEKFIBVRHL-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO CC(C)OC(=O)c1ccc(-c2ccccc2Cn2cc[nH+]c2)cc1 ZINC001241285316 1056996318 /nfs/dbraw/zinc/99/63/18/1056996318.db2.gz SERPYGDNWITQPA-UHFFFAOYSA-N 1 2 320.392 4.164 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(C(=O)OC(C)C)cc2)c1 ZINC001241284969 1056996383 /nfs/dbraw/zinc/99/63/83/1056996383.db2.gz NLFUMBQRYIOSMH-UHFFFAOYSA-N 1 2 311.381 4.281 20 0 DIADLO CN(C)c1cc(-c2ccc(C(F)(F)F)c(Cl)c2)cc[nH+]1 ZINC001241287467 1056998030 /nfs/dbraw/zinc/99/80/30/1056998030.db2.gz GKCNGGMIDMRCMX-UHFFFAOYSA-N 1 2 300.711 4.487 20 0 DIADLO CC(=O)c1ccc(F)c(-c2c[nH+]c(N3CCCCC3)cc2C)c1 ZINC001241300553 1057003857 /nfs/dbraw/zinc/00/38/57/1057003857.db2.gz YROGZNOYZSGYIR-UHFFFAOYSA-N 1 2 312.388 4.389 20 0 DIADLO CCOc1ccc(F)c(F)c1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001241310074 1057008426 /nfs/dbraw/zinc/00/84/26/1057008426.db2.gz PEBLKNUVQOOKOL-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO CCOc1ccc(F)c(F)c1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001241310960 1057009056 /nfs/dbraw/zinc/00/90/56/1057009056.db2.gz CEWVYYUNNTXJBP-UHFFFAOYSA-N 1 2 318.298 4.355 20 0 DIADLO CCOc1cc(F)ccc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001241321542 1057013598 /nfs/dbraw/zinc/01/35/98/1057013598.db2.gz XKPJJOBJVVYUCQ-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+]Cc2nccc3c2CCCC3)s1 ZINC000922463260 1057026104 /nfs/dbraw/zinc/02/61/04/1057026104.db2.gz MFGKZMHDPKOSED-UHFFFAOYSA-N 1 2 315.486 4.004 20 0 DIADLO CC(C)(/C=C\Cl)[NH2+]Cc1csc(COc2ccccc2)n1 ZINC000922649842 1057044253 /nfs/dbraw/zinc/04/42/53/1057044253.db2.gz ZMBBBGHGNXGWSR-HJWRWDBZSA-N 1 2 322.861 4.343 20 0 DIADLO Cc1[nH]c(CN[C@H](C)c2cc(Cl)cc(Cl)c2F)[nH+]c1C ZINC000922669898 1057046849 /nfs/dbraw/zinc/04/68/49/1057046849.db2.gz FDBXLVDHANAVSH-SECBINFHSA-N 1 2 316.207 4.323 20 0 DIADLO FC(F)Oc1ccc(C[NH2+][C@H]2CCCC2(F)F)cc1Cl ZINC000673617882 1057063229 /nfs/dbraw/zinc/06/32/29/1057063229.db2.gz MNRMEWPMNUFPBX-NSHDSACASA-N 1 2 311.706 4.219 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@H]2CCCc3cccnc32)c(Cl)c1 ZINC000922882589 1057073342 /nfs/dbraw/zinc/07/33/42/1057073342.db2.gz AJLLSRRACNFKBK-INIZCTEOSA-N 1 2 304.796 4.350 20 0 DIADLO COc1c(F)ccc(-c2ccc(-n3cc[nH+]c3)cc2)c1Cl ZINC001241505403 1057077855 /nfs/dbraw/zinc/07/78/55/1057077855.db2.gz QFHOLUAMYZHXFU-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO Cc1cc(C[NH2+][C@@H]2C[C@@H](c3ccccc3)Oc3ccccc32)no1 ZINC000922886638 1057085937 /nfs/dbraw/zinc/08/59/37/1057085937.db2.gz PLTSWYWJKRZFKP-QUCCMNQESA-N 1 2 320.392 4.338 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1)[N@H+](C)Cc1noc(C2CCC2)n1 ZINC000625176194 1057096158 /nfs/dbraw/zinc/09/61/58/1057096158.db2.gz GWBCEOPTERWXPQ-GFCCVEGCSA-N 1 2 319.836 4.054 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1noc(C2CCC2)n1 ZINC000625176194 1057096171 /nfs/dbraw/zinc/09/61/71/1057096171.db2.gz GWBCEOPTERWXPQ-GFCCVEGCSA-N 1 2 319.836 4.054 20 0 DIADLO Cc1ccc(C(C)(C)C[N@H+](C)Cc2noc(C3CCC3)n2)cc1 ZINC000625187506 1057098665 /nfs/dbraw/zinc/09/86/65/1057098665.db2.gz CWNYQUBJOQYSSE-UHFFFAOYSA-N 1 2 313.445 4.055 20 0 DIADLO Cc1ccc(C(C)(C)C[N@@H+](C)Cc2noc(C3CCC3)n2)cc1 ZINC000625187506 1057098674 /nfs/dbraw/zinc/09/86/74/1057098674.db2.gz CWNYQUBJOQYSSE-UHFFFAOYSA-N 1 2 313.445 4.055 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccncc2Br)[C@@H]1c1ccccc1 ZINC000625210053 1057099983 /nfs/dbraw/zinc/09/99/83/1057099983.db2.gz AVBVQPAQZLAPNS-LRDDRELGSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccncc2Br)[C@@H]1c1ccccc1 ZINC000625210053 1057099986 /nfs/dbraw/zinc/09/99/86/1057099986.db2.gz AVBVQPAQZLAPNS-LRDDRELGSA-N 1 2 317.230 4.037 20 0 DIADLO Cc1ccc(C)c([C@H]2CCC[N@@H+]2Cc2noc(C3CCC3)n2)c1 ZINC000625217314 1057101523 /nfs/dbraw/zinc/10/15/23/1057101523.db2.gz FULVMOYCQKKLHE-QGZVFWFLSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1ccc(C)c([C@H]2CCC[N@H+]2Cc2noc(C3CCC3)n2)c1 ZINC000625217314 1057101528 /nfs/dbraw/zinc/10/15/28/1057101528.db2.gz FULVMOYCQKKLHE-QGZVFWFLSA-N 1 2 311.429 4.291 20 0 DIADLO Fc1ccccc1-c1nc(C[N@@H+]2CCC[C@H]2c2ccccn2)co1 ZINC000625220306 1057102807 /nfs/dbraw/zinc/10/28/07/1057102807.db2.gz GEYLRBXZNAWBQX-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccccc1-c1nc(C[N@H+]2CCC[C@H]2c2ccccn2)co1 ZINC000625220306 1057102809 /nfs/dbraw/zinc/10/28/09/1057102809.db2.gz GEYLRBXZNAWBQX-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2cc(O)ccc2Cl)sc1C ZINC000625257750 1057107878 /nfs/dbraw/zinc/10/78/78/1057107878.db2.gz UCPCDDRLRLZYQM-UHFFFAOYSA-N 1 2 310.850 4.144 20 0 DIADLO CCNC(=O)c1ccc(-c2cc([NH+](CC)CC)ccc2C)cc1 ZINC001241617703 1057111805 /nfs/dbraw/zinc/11/18/05/1057111805.db2.gz CROXLZGUOWEYQU-UHFFFAOYSA-N 1 2 310.441 4.258 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ccccn2)Cc2cccc(C)n2)c1 ZINC000348540935 1057141946 /nfs/dbraw/zinc/14/19/46/1057141946.db2.gz OITILLWJTZMCRF-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ccccn2)Cc2cccc(C)n2)c1 ZINC000348540935 1057141952 /nfs/dbraw/zinc/14/19/52/1057141952.db2.gz OITILLWJTZMCRF-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1csc([C@H](C)OC)n1 ZINC000673856156 1057142979 /nfs/dbraw/zinc/14/29/79/1057142979.db2.gz KMPRSGSGEYIGBX-SUMWQHHRSA-N 1 2 316.470 4.360 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1csc([C@H](C)OC)n1 ZINC000673856156 1057142981 /nfs/dbraw/zinc/14/29/81/1057142981.db2.gz KMPRSGSGEYIGBX-SUMWQHHRSA-N 1 2 316.470 4.360 20 0 DIADLO COCc1ccc(SCc2[nH+]cc(C)c(OC)c2C)cc1 ZINC000673892669 1057146420 /nfs/dbraw/zinc/14/64/20/1057146420.db2.gz LGSVFFOYGLOMKB-UHFFFAOYSA-N 1 2 303.427 4.146 20 0 DIADLO CCC[N@H+](Cc1nncs1)[C@H](C)c1cc2ccccc2o1 ZINC000929334280 1057172741 /nfs/dbraw/zinc/17/27/41/1057172741.db2.gz VEASDUSSKMVARM-GFCCVEGCSA-N 1 2 301.415 4.258 20 0 DIADLO CCC[N@@H+](Cc1nncs1)[C@H](C)c1cc2ccccc2o1 ZINC000929334280 1057172743 /nfs/dbraw/zinc/17/27/43/1057172743.db2.gz VEASDUSSKMVARM-GFCCVEGCSA-N 1 2 301.415 4.258 20 0 DIADLO CCC[N@H+](Cc1nncs1)[C@@H](C)c1cc2ccccc2o1 ZINC000929334288 1057172760 /nfs/dbraw/zinc/17/27/60/1057172760.db2.gz VEASDUSSKMVARM-LBPRGKRZSA-N 1 2 301.415 4.258 20 0 DIADLO CCC[N@@H+](Cc1nncs1)[C@@H](C)c1cc2ccccc2o1 ZINC000929334288 1057172763 /nfs/dbraw/zinc/17/27/63/1057172763.db2.gz VEASDUSSKMVARM-LBPRGKRZSA-N 1 2 301.415 4.258 20 0 DIADLO Cn1c2ccccc2nc1C[N@@H+]1CC(C)(C)[C@@H]1c1ccccc1 ZINC000674010100 1057177601 /nfs/dbraw/zinc/17/76/01/1057177601.db2.gz PFOYBEXUVNYWNM-IBGZPJMESA-N 1 2 305.425 4.156 20 0 DIADLO Cn1c2ccccc2nc1C[N@H+]1CC(C)(C)[C@@H]1c1ccccc1 ZINC000674010100 1057177603 /nfs/dbraw/zinc/17/76/03/1057177603.db2.gz PFOYBEXUVNYWNM-IBGZPJMESA-N 1 2 305.425 4.156 20 0 DIADLO Cc1[nH]c2ccccc2c1C(=O)C[N@@H+]1CC[C@H]1c1cccc(F)c1 ZINC000674013906 1057177621 /nfs/dbraw/zinc/17/76/21/1057177621.db2.gz UYBATIFZCKBTRX-SFHVURJKSA-N 1 2 322.383 4.245 20 0 DIADLO Cc1[nH]c2ccccc2c1C(=O)C[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000674013906 1057177622 /nfs/dbraw/zinc/17/76/22/1057177622.db2.gz UYBATIFZCKBTRX-SFHVURJKSA-N 1 2 322.383 4.245 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cnn(C3CCCCC3)c2)cc1 ZINC001241841610 1057185490 /nfs/dbraw/zinc/18/54/90/1057185490.db2.gz UDDHTASDVLRTJS-UHFFFAOYSA-N 1 2 306.413 4.456 20 0 DIADLO Cc1cccc(N2CC[NH+]([C@H](C)c3c(F)cccc3F)CC2)c1 ZINC000059373911 1057192467 /nfs/dbraw/zinc/19/24/67/1057192467.db2.gz YFLCUNNLYKDKSP-OAHLLOKOSA-N 1 2 316.395 4.156 20 0 DIADLO COc1ccccc1C[N@H+](Cc1cccc(F)c1F)C1CC1 ZINC000059389809 1057192502 /nfs/dbraw/zinc/19/25/02/1057192502.db2.gz QQOXOBRBKSCDJI-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1cccc(F)c1F)C1CC1 ZINC000059389809 1057192505 /nfs/dbraw/zinc/19/25/05/1057192505.db2.gz QQOXOBRBKSCDJI-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO O=C(C[N@H+]1CCC[C@H]1c1ccccc1Cl)Nc1ccccc1 ZINC000059390488 1057192555 /nfs/dbraw/zinc/19/25/55/1057192555.db2.gz GTQYQAAXQMLIKF-KRWDZBQOSA-N 1 2 314.816 4.116 20 0 DIADLO O=C(C[N@@H+]1CCC[C@H]1c1ccccc1Cl)Nc1ccccc1 ZINC000059390488 1057192559 /nfs/dbraw/zinc/19/25/59/1057192559.db2.gz GTQYQAAXQMLIKF-KRWDZBQOSA-N 1 2 314.816 4.116 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc3scnc3c2)cc1F ZINC001241871530 1057197763 /nfs/dbraw/zinc/19/77/63/1057197763.db2.gz TYMPDLFTEDZCKL-UHFFFAOYSA-N 1 2 304.365 4.303 20 0 DIADLO COc1cc(Cl)ccc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001241889178 1057201788 /nfs/dbraw/zinc/20/17/88/1057201788.db2.gz MQOIZWCRHRLVMG-UHFFFAOYSA-N 1 2 302.683 4.012 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(F)c4ccccc43)nn2)c1C ZINC001241900820 1057204955 /nfs/dbraw/zinc/20/49/55/1057204955.db2.gz QXPAWRXOEYNFEZ-UHFFFAOYSA-N 1 2 318.355 4.238 20 0 DIADLO CCCCOC(=O)Nc1ccc(-c2nc3[nH]c(C)cc3c[nH+]2)cc1 ZINC001241924282 1057213321 /nfs/dbraw/zinc/21/33/21/1057213321.db2.gz YZXQBLVOTLJUNZ-UHFFFAOYSA-N 1 2 324.384 4.234 20 0 DIADLO C=Cc1cccc(-c2ncnc3c2C[N@H+](Cc2ccccc2)C3)c1 ZINC001241945276 1057220616 /nfs/dbraw/zinc/22/06/16/1057220616.db2.gz BJRLZVMAQHIJRT-UHFFFAOYSA-N 1 2 313.404 4.302 20 0 DIADLO C=Cc1cccc(-c2ncnc3c2C[N@@H+](Cc2ccccc2)C3)c1 ZINC001241945276 1057220620 /nfs/dbraw/zinc/22/06/20/1057220620.db2.gz BJRLZVMAQHIJRT-UHFFFAOYSA-N 1 2 313.404 4.302 20 0 DIADLO C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1n[nH]c2ccccc21 ZINC000674336033 1057232236 /nfs/dbraw/zinc/23/22/36/1057232236.db2.gz WSGXBYRIHBTPBR-BLVKFPJESA-N 1 2 309.388 4.115 20 0 DIADLO CCOC(=O)C1(c2ccc(-c3cc(C)[nH+]c(C)c3)cc2)CCC1 ZINC001241993188 1057232425 /nfs/dbraw/zinc/23/24/25/1057232425.db2.gz HINBHUZNHFUCST-UHFFFAOYSA-N 1 2 309.409 4.350 20 0 DIADLO COC(=O)C1(c2ccc(-c3cc(C)[nH+]c(C)c3)cc2)CCCC1 ZINC001241993793 1057233544 /nfs/dbraw/zinc/23/35/44/1057233544.db2.gz PKMYSKUXLCAFML-UHFFFAOYSA-N 1 2 309.409 4.350 20 0 DIADLO CSc1c(F)cccc1-c1ccccc1C[NH+]1CCOCC1 ZINC001241996045 1057233942 /nfs/dbraw/zinc/23/39/42/1057233942.db2.gz WNVQPXHKRIVBEQ-UHFFFAOYSA-N 1 2 317.429 4.047 20 0 DIADLO CCOC(=O)c1cc2ccc(-c3cc(C)[nH+]c(C)c3)cc2cn1 ZINC001241996381 1057234885 /nfs/dbraw/zinc/23/48/85/1057234885.db2.gz ZRXCGHGGMZYNAD-UHFFFAOYSA-N 1 2 306.365 4.090 20 0 DIADLO CC(C)c1cnc(C[N@H+](C)Cc2ccc(Br)cc2)o1 ZINC000700847213 1057235672 /nfs/dbraw/zinc/23/56/72/1057235672.db2.gz HLEXWTBIVHHIFK-UHFFFAOYSA-N 1 2 323.234 4.193 20 0 DIADLO CC(C)c1cnc(C[N@@H+](C)Cc2ccc(Br)cc2)o1 ZINC000700847213 1057235676 /nfs/dbraw/zinc/23/56/76/1057235676.db2.gz HLEXWTBIVHHIFK-UHFFFAOYSA-N 1 2 323.234 4.193 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2noc3c2CCCC3)c1 ZINC000171733895 1057239180 /nfs/dbraw/zinc/23/91/80/1057239180.db2.gz LTFAICLANXIUOW-KRWDZBQOSA-N 1 2 300.377 4.030 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2noc3c2CCCC3)c1 ZINC000171733895 1057239187 /nfs/dbraw/zinc/23/91/87/1057239187.db2.gz LTFAICLANXIUOW-KRWDZBQOSA-N 1 2 300.377 4.030 20 0 DIADLO C[N@H+](CCCCCc1cc(-c2ccccc2)no1)CC(F)F ZINC000171991813 1057245973 /nfs/dbraw/zinc/24/59/73/1057245973.db2.gz IGYFJJBXTXTTJB-UHFFFAOYSA-N 1 2 308.372 4.251 20 0 DIADLO C[N@@H+](CCCCCc1cc(-c2ccccc2)no1)CC(F)F ZINC000171991813 1057245976 /nfs/dbraw/zinc/24/59/76/1057245976.db2.gz IGYFJJBXTXTTJB-UHFFFAOYSA-N 1 2 308.372 4.251 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1nnc(-c2cccs2)c2ccccc21 ZINC001242078186 1057256314 /nfs/dbraw/zinc/25/63/14/1057256314.db2.gz DXWXBIOWWRHWPJ-UHFFFAOYSA-N 1 2 318.405 4.311 20 0 DIADLO CCOc1ccc(C[N@H+](CC)Cc2ccccc2Cl)nc1 ZINC000674860164 1057292774 /nfs/dbraw/zinc/29/27/74/1057292774.db2.gz GBGVFCGMWPTCRH-UHFFFAOYSA-N 1 2 304.821 4.156 20 0 DIADLO CCOc1ccc(C[N@@H+](CC)Cc2ccccc2Cl)nc1 ZINC000674860164 1057292776 /nfs/dbraw/zinc/29/27/76/1057292776.db2.gz GBGVFCGMWPTCRH-UHFFFAOYSA-N 1 2 304.821 4.156 20 0 DIADLO Cc1cc(Cl)cc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c1F ZINC001242223953 1057299693 /nfs/dbraw/zinc/29/96/93/1057299693.db2.gz JXFXBQKGLHHIOZ-UHFFFAOYSA-N 1 2 304.674 4.451 20 0 DIADLO CCOC(=O)Cc1cccc(Nc2cccc(C3CCC3)[nH+]2)c1 ZINC001212525086 1057300069 /nfs/dbraw/zinc/30/00/69/1057300069.db2.gz QFQJLYVDVYDQMR-UHFFFAOYSA-N 1 2 310.397 4.198 20 0 DIADLO C[N@H+](Cc1ccc(C(F)(F)F)cc1)Cc1ccncc1Cl ZINC000173458637 1057306458 /nfs/dbraw/zinc/30/64/58/1057306458.db2.gz ZQRQOXMLZNOMCY-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cc1ccncc1Cl ZINC000173458637 1057306460 /nfs/dbraw/zinc/30/64/60/1057306460.db2.gz ZQRQOXMLZNOMCY-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO CCOc1cc(Nc2cccc3[nH+]c(C)cn32)c(F)cc1F ZINC001212528809 1057313936 /nfs/dbraw/zinc/31/39/36/1057313936.db2.gz PHTFJLVLCKIYFU-UHFFFAOYSA-N 1 2 303.312 4.063 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1cc(F)ccc1F ZINC000675089108 1057314962 /nfs/dbraw/zinc/31/49/62/1057314962.db2.gz NLBTVDKTRZTDKT-RFAUZJTJSA-N 1 2 309.743 4.403 20 0 DIADLO COc1ccc(C[NH2+][C@H]2COc3c2cccc3Cl)c(Cl)c1 ZINC000675103452 1057316096 /nfs/dbraw/zinc/31/60/96/1057316096.db2.gz SVOHWOJKRZLSRW-HNNXBMFYSA-N 1 2 324.207 4.225 20 0 DIADLO CC(C)(CNc1cc(C(F)(F)F)cc[nH+]1)[C@H]1CCCCO1 ZINC000675154220 1057322070 /nfs/dbraw/zinc/32/20/70/1057322070.db2.gz PKXBREYIIMJICZ-GFCCVEGCSA-N 1 2 302.340 4.108 20 0 DIADLO CCC(CC)(CC)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000675441896 1057367090 /nfs/dbraw/zinc/36/70/90/1057367090.db2.gz SWJAVBZYXUKTKU-UHFFFAOYSA-N 1 2 303.381 4.166 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nccn1C)c1ccc(Oc2ccccc2)cn1 ZINC000658340192 1057380489 /nfs/dbraw/zinc/38/04/89/1057380489.db2.gz ZDONLKGQFDCMMO-CABCVRRESA-N 1 2 322.412 4.019 20 0 DIADLO Cc1nc(N2CCC[C@H](c3cc4ccccc4[nH]3)C2)c(C)c(C)[nH+]1 ZINC000675548334 1057387379 /nfs/dbraw/zinc/38/73/79/1057387379.db2.gz MGQYEFLRANTRQI-KRWDZBQOSA-N 1 2 320.440 4.267 20 0 DIADLO CCC[C@@H](C)C[N@@H+]1CCOC[C@@H]1c1nc2ccccc2s1 ZINC000503064745 1057399140 /nfs/dbraw/zinc/39/91/40/1057399140.db2.gz UVITYEYDBVILHO-UKRRQHHQSA-N 1 2 304.459 4.106 20 0 DIADLO CCC[C@@H](C)C[N@H+]1CCOC[C@@H]1c1nc2ccccc2s1 ZINC000503064745 1057399144 /nfs/dbraw/zinc/39/91/44/1057399144.db2.gz UVITYEYDBVILHO-UKRRQHHQSA-N 1 2 304.459 4.106 20 0 DIADLO COc1cc(F)c(F)cc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001242579840 1057413467 /nfs/dbraw/zinc/41/34/67/1057413467.db2.gz ZOVOZYWBASKLJP-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@H]2CCOc3c(Cl)cccc32)n1 ZINC000675809397 1057417461 /nfs/dbraw/zinc/41/74/61/1057417461.db2.gz HWTUBZGZFUHDLY-GWCFXTLKSA-N 1 2 308.834 4.279 20 0 DIADLO CCC1(CC)CCC([NH2+][C@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000675965037 1057438374 /nfs/dbraw/zinc/43/83/74/1057438374.db2.gz KTVFCYGRWTYLPB-KRWDZBQOSA-N 1 2 312.461 4.233 20 0 DIADLO CCO[C@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2OC)C1 ZINC000676414284 1057470518 /nfs/dbraw/zinc/47/05/18/1057470518.db2.gz RYUXYICZJFWAQF-ZDUSSCGKSA-N 1 2 318.244 4.003 20 0 DIADLO CCO[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2OC)C1 ZINC000676414284 1057470521 /nfs/dbraw/zinc/47/05/21/1057470521.db2.gz RYUXYICZJFWAQF-ZDUSSCGKSA-N 1 2 318.244 4.003 20 0 DIADLO Clc1cscc1C[NH2+][C@@H]1COc2c1cccc2Cl ZINC000676419516 1057471815 /nfs/dbraw/zinc/47/18/15/1057471815.db2.gz OLVGBJSQDSRDDN-GFCCVEGCSA-N 1 2 300.210 4.278 20 0 DIADLO Cc1ccc([C@@H](CNCc2cscc2Cl)[NH+]2CCCC2)o1 ZINC000676416565 1057472234 /nfs/dbraw/zinc/47/22/34/1057472234.db2.gz OREMHDWQIQZAPK-OAHLLOKOSA-N 1 2 324.877 4.230 20 0 DIADLO CCCCOc1ncccc1C[NH2+][C@H](C)c1nc(C)sc1C ZINC000676488398 1057478643 /nfs/dbraw/zinc/47/86/43/1057478643.db2.gz FYHFIGHFWRTHDL-GFCCVEGCSA-N 1 2 319.474 4.185 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000708692873 1057501364 /nfs/dbraw/zinc/50/13/64/1057501364.db2.gz LUSCGWVWKXCFSD-NSHDSACASA-N 1 2 313.150 4.163 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000708692873 1057501368 /nfs/dbraw/zinc/50/13/68/1057501368.db2.gz LUSCGWVWKXCFSD-NSHDSACASA-N 1 2 313.150 4.163 20 0 DIADLO c1ccc(N2CCCCC2)c(-c2cc[nH+]c(N3CCCC3)c2)c1 ZINC001242875200 1057509240 /nfs/dbraw/zinc/50/92/40/1057509240.db2.gz SYXQGISJMIJDOO-UHFFFAOYSA-N 1 2 307.441 4.339 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+]Cc3cc(C4CC4)n(C)n3)o2)cc1 ZINC000922956108 1057516581 /nfs/dbraw/zinc/51/65/81/1057516581.db2.gz YGHFDFGNRAOFRZ-UHFFFAOYSA-N 1 2 321.424 4.156 20 0 DIADLO CCc1onc(C)c1C[NH2+]Cc1cc(Cl)sc1Cl ZINC000922984975 1057519078 /nfs/dbraw/zinc/51/90/78/1057519078.db2.gz SZHILWSWPYTHEO-UHFFFAOYSA-N 1 2 305.230 4.204 20 0 DIADLO CCOc1ccc(F)c(-c2ccc(-n3cc[nH+]c3)cc2OC)c1 ZINC001242938590 1057524587 /nfs/dbraw/zinc/52/45/87/1057524587.db2.gz VFDMKASEPMABRQ-UHFFFAOYSA-N 1 2 312.344 4.086 20 0 DIADLO FC(F)(F)c1ccc(-c2cc(-n3cc[nH+]c3)ccn2)c(Cl)n1 ZINC001243035477 1057552811 /nfs/dbraw/zinc/55/28/11/1057552811.db2.gz GNVXSMQBOWGJGW-UHFFFAOYSA-N 1 2 324.693 4.002 20 0 DIADLO CSc1cccc(F)c1C[NH2+][C@@H](C)c1nc(C)sc1C ZINC000671764870 1057559483 /nfs/dbraw/zinc/55/94/83/1057559483.db2.gz ZWJHRLUFHIIJFN-VIFPVBQESA-N 1 2 310.463 4.472 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cccc(OC(F)(F)F)c2)nc1 ZINC001243071904 1057563595 /nfs/dbraw/zinc/56/35/95/1057563595.db2.gz ISNAJRFBAHSYIV-UHFFFAOYSA-N 1 2 319.286 4.048 20 0 DIADLO Cn1c[nH+]cc1-c1ccc2c(c1)N(c1ccccc1)C(=O)C2(C)C ZINC001243072194 1057563615 /nfs/dbraw/zinc/56/36/15/1057563615.db2.gz LLTAAHJFXYQCEF-UHFFFAOYSA-N 1 2 317.392 4.043 20 0 DIADLO Clc1ccc(-c2ccccc2Cn2cc[nH+]c2)c(Cl)n1 ZINC001243086132 1057566619 /nfs/dbraw/zinc/56/66/19/1057566619.db2.gz OQFHQYFGLGMIPI-UHFFFAOYSA-N 1 2 304.180 4.300 20 0 DIADLO Cc1ccc(OC(C)C)c(-c2cc(N)c(C(F)(F)F)c[nH+]2)c1 ZINC001243089028 1057568339 /nfs/dbraw/zinc/56/83/39/1057568339.db2.gz UNVUNPVIYMZHGN-UHFFFAOYSA-N 1 2 310.319 4.445 20 0 DIADLO Cc1cc2cc(-c3cc(F)ccc3C[NH+]3CCOCC3)ccc2[nH]1 ZINC001243100983 1057573346 /nfs/dbraw/zinc/57/33/46/1057573346.db2.gz ARVVDHLOKDBRTH-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO FC(F)Oc1ccc(Cl)cc1CSCCn1cc[nH+]c1 ZINC000611183162 1057584017 /nfs/dbraw/zinc/58/40/17/1057584017.db2.gz IAHMEWMNGOVVRZ-UHFFFAOYSA-N 1 2 318.776 4.071 20 0 DIADLO CSc1ncc(-c2c[nH+]c(N3CCCCC3)cc2C)cc1C ZINC001243146584 1057586375 /nfs/dbraw/zinc/58/63/75/1057586375.db2.gz BZHLCASLXHHFJA-UHFFFAOYSA-N 1 2 313.470 4.473 20 0 DIADLO Cc1cn2cc(-c3ccccc3NC(=O)C(C)(C)C)ccc2[nH+]1 ZINC001243176219 1057593526 /nfs/dbraw/zinc/59/35/26/1057593526.db2.gz GQKVRULZVWKTMA-UHFFFAOYSA-N 1 2 307.397 4.294 20 0 DIADLO Cc1cc(C(C)(C)C)cc2c1OCCC[C@@H]2[NH2+]Cc1cocn1 ZINC000611473942 1057602393 /nfs/dbraw/zinc/60/23/93/1057602393.db2.gz DAOOCOFVYBJUHF-KRWDZBQOSA-N 1 2 314.429 4.284 20 0 DIADLO C[C@H]1c2cc(F)cc(F)c2CC[N@H+]1Cc1scnc1C1CC1 ZINC000494927644 1057618561 /nfs/dbraw/zinc/61/85/61/1057618561.db2.gz CELWSYUKEPPFQS-JTQLQIEISA-N 1 2 320.408 4.418 20 0 DIADLO C[C@H]1c2cc(F)cc(F)c2CC[N@@H+]1Cc1scnc1C1CC1 ZINC000494927644 1057618567 /nfs/dbraw/zinc/61/85/67/1057618567.db2.gz CELWSYUKEPPFQS-JTQLQIEISA-N 1 2 320.408 4.418 20 0 DIADLO Fc1ccc(C[N@H+](Cc2scnc2C2CC2)C2CC2)c(F)c1 ZINC000495050850 1057621574 /nfs/dbraw/zinc/62/15/74/1057621574.db2.gz MWOIGMLQRARZKT-UHFFFAOYSA-N 1 2 320.408 4.463 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2scnc2C2CC2)C2CC2)c(F)c1 ZINC000495050850 1057621577 /nfs/dbraw/zinc/62/15/77/1057621577.db2.gz MWOIGMLQRARZKT-UHFFFAOYSA-N 1 2 320.408 4.463 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2ncc[nH]2)c(O[C@@H](C)CC(C)C)c1 ZINC000513690875 1057622925 /nfs/dbraw/zinc/62/29/25/1057622925.db2.gz NJZYRBKQINCDHT-JKSUJKDBSA-N 1 2 315.461 4.382 20 0 DIADLO COc1ccc([C@H]([NH2+][C@H](C)c2ncc[nH]2)c2ccc(C)cc2)cc1 ZINC000513713731 1057623227 /nfs/dbraw/zinc/62/32/27/1057623227.db2.gz SJHXBWLENBOKBP-DNVCBOLYSA-N 1 2 321.424 4.167 20 0 DIADLO CCCCOc1cccc(F)c1-c1c[nH+]c(N(C)C)cc1C ZINC001243271989 1057629908 /nfs/dbraw/zinc/62/99/08/1057629908.db2.gz GIBRQJZRWAOABA-UHFFFAOYSA-N 1 2 302.393 4.441 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccccc2OC(F)F)c(C)s1 ZINC000020556275 1057638103 /nfs/dbraw/zinc/63/81/03/1057638103.db2.gz WLFPMCLUZAFYIZ-VIFPVBQESA-N 1 2 312.385 4.212 20 0 DIADLO COc1c(F)c(F)ccc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001243304330 1057640986 /nfs/dbraw/zinc/64/09/86/1057640986.db2.gz BXKIJQUFLKXMRK-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO COc1cccc(OC)c1-c1ccccc1-c1ccc(C)c(N)[nH+]1 ZINC001243329833 1057648438 /nfs/dbraw/zinc/64/84/38/1057648438.db2.gz MDXMLPRJAAHPAQ-UHFFFAOYSA-N 1 2 320.392 4.323 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2coc(C3CC3)n2)cc1 ZINC000727467335 1057655096 /nfs/dbraw/zinc/65/50/96/1057655096.db2.gz SNPWRYQODYKVHB-CYBMUJFWSA-N 1 2 300.402 4.190 20 0 DIADLO C[C@H](CC(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C)C1CCCCC1 ZINC000727492045 1057655688 /nfs/dbraw/zinc/65/56/88/1057655688.db2.gz UCCKZOOSFXUCAH-NVXWUHKLSA-N 1 2 319.493 4.021 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2coc(C3CC3)n2)cc1 ZINC000727467336 1057655755 /nfs/dbraw/zinc/65/57/55/1057655755.db2.gz SNPWRYQODYKVHB-ZDUSSCGKSA-N 1 2 300.402 4.190 20 0 DIADLO CCCCCC[C@H](C)CC(=O)Nc1nc2c(s1)C[N@H+](C)CC2 ZINC000727673892 1057664435 /nfs/dbraw/zinc/66/44/35/1057664435.db2.gz ZJVHTGJCTSVESW-ZDUSSCGKSA-N 1 2 323.506 4.066 20 0 DIADLO CCCCCC[C@H](C)CC(=O)Nc1nc2c(s1)C[N@@H+](C)CC2 ZINC000727673892 1057664442 /nfs/dbraw/zinc/66/44/42/1057664442.db2.gz ZJVHTGJCTSVESW-ZDUSSCGKSA-N 1 2 323.506 4.066 20 0 DIADLO CCCOc1ccc(F)cc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001243400117 1057671653 /nfs/dbraw/zinc/67/16/53/1057671653.db2.gz LIGCKKMLFFIKCP-UHFFFAOYSA-N 1 2 314.282 4.278 20 0 DIADLO C[N@H+]1Cc2ccccc2[C@@H](NCc2cccc(Cl)c2Cl)C1 ZINC000536054019 1057673627 /nfs/dbraw/zinc/67/36/27/1057673627.db2.gz RQDHFWJVHPHTCW-INIZCTEOSA-N 1 2 321.251 4.270 20 0 DIADLO C[N@@H+]1Cc2ccccc2[C@@H](NCc2cccc(Cl)c2Cl)C1 ZINC000536054019 1057673632 /nfs/dbraw/zinc/67/36/32/1057673632.db2.gz RQDHFWJVHPHTCW-INIZCTEOSA-N 1 2 321.251 4.270 20 0 DIADLO C[N@H+]1Cc2ccccc2[C@H](NCc2ccc(Cl)cc2Cl)C1 ZINC000535264508 1057673765 /nfs/dbraw/zinc/67/37/65/1057673765.db2.gz DXVHMVSBAVXGEF-QGZVFWFLSA-N 1 2 321.251 4.270 20 0 DIADLO C[N@@H+]1Cc2ccccc2[C@H](NCc2ccc(Cl)cc2Cl)C1 ZINC000535264508 1057673768 /nfs/dbraw/zinc/67/37/68/1057673768.db2.gz DXVHMVSBAVXGEF-QGZVFWFLSA-N 1 2 321.251 4.270 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(Cc2cccc(F)c2)oc1=S ZINC000727816226 1057675314 /nfs/dbraw/zinc/67/53/14/1057675314.db2.gz CGIVMAZREZUHSY-UHFFFAOYSA-N 1 2 323.437 4.015 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(Cc2cccc(F)c2)oc1=S ZINC000727816226 1057675320 /nfs/dbraw/zinc/67/53/20/1057675320.db2.gz CGIVMAZREZUHSY-UHFFFAOYSA-N 1 2 323.437 4.015 20 0 DIADLO Cc1cc(-c2cc(F)c(F)cc2OC(C)C)cn2cc[nH+]c12 ZINC001243414165 1057675895 /nfs/dbraw/zinc/67/58/95/1057675895.db2.gz ZBOZSTWGXUBYDR-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO CC[C@H](c1nn(C[N@H+](C)CC2CC2)c(=S)o1)c1ccccc1 ZINC000727818499 1057676839 /nfs/dbraw/zinc/67/68/39/1057676839.db2.gz CUXWWXSRKBDOCP-HNNXBMFYSA-N 1 2 317.458 4.047 20 0 DIADLO CC[C@H](c1nn(C[N@@H+](C)CC2CC2)c(=S)o1)c1ccccc1 ZINC000727818499 1057676842 /nfs/dbraw/zinc/67/68/42/1057676842.db2.gz CUXWWXSRKBDOCP-HNNXBMFYSA-N 1 2 317.458 4.047 20 0 DIADLO CC[C@@H](c1nn(C[N@H+](C)CC2CC2)c(=S)o1)c1ccccc1 ZINC000727818500 1057677057 /nfs/dbraw/zinc/67/70/57/1057677057.db2.gz CUXWWXSRKBDOCP-OAHLLOKOSA-N 1 2 317.458 4.047 20 0 DIADLO CC[C@@H](c1nn(C[N@@H+](C)CC2CC2)c(=S)o1)c1ccccc1 ZINC000727818500 1057677062 /nfs/dbraw/zinc/67/70/62/1057677062.db2.gz CUXWWXSRKBDOCP-OAHLLOKOSA-N 1 2 317.458 4.047 20 0 DIADLO CC[C@@H]1CCC[N@@H+]1Cn1nc(-c2ccccc2C)oc1=S ZINC000727824780 1057677463 /nfs/dbraw/zinc/67/74/63/1057677463.db2.gz RNXWEWMKUUCOIY-CYBMUJFWSA-N 1 2 303.431 4.013 20 0 DIADLO CC[C@@H]1CCC[N@H+]1Cn1nc(-c2ccccc2C)oc1=S ZINC000727824780 1057677466 /nfs/dbraw/zinc/67/74/66/1057677466.db2.gz RNXWEWMKUUCOIY-CYBMUJFWSA-N 1 2 303.431 4.013 20 0 DIADLO CC[C@@H](c1nn(C[N@@H+]2CC[C@@H](C)C2)c(=S)o1)c1ccccc1 ZINC000727823651 1057677497 /nfs/dbraw/zinc/67/74/97/1057677497.db2.gz WKIUSPVNNBDRDM-UKRRQHHQSA-N 1 2 317.458 4.047 20 0 DIADLO CC[C@@H](c1nn(C[N@H+]2CC[C@@H](C)C2)c(=S)o1)c1ccccc1 ZINC000727823651 1057677500 /nfs/dbraw/zinc/67/75/00/1057677500.db2.gz WKIUSPVNNBDRDM-UKRRQHHQSA-N 1 2 317.458 4.047 20 0 DIADLO Nc1cn2ccc(-c3ccc(CNc4ccccc4)cc3)cc2[nH+]1 ZINC001243441366 1057685212 /nfs/dbraw/zinc/68/52/12/1057685212.db2.gz ZOUQHMAVPMZKCA-UHFFFAOYSA-N 1 2 314.392 4.196 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCSc2c(F)cccc21)c1c(F)cncc1F ZINC000285731384 1057686525 /nfs/dbraw/zinc/68/65/25/1057686525.db2.gz QTUGBYVTAIHUFO-LKFCYVNXSA-N 1 2 324.371 4.387 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCSc2c(F)cccc21)c1c(F)cncc1F ZINC000285731401 1057686687 /nfs/dbraw/zinc/68/66/87/1057686687.db2.gz QTUGBYVTAIHUFO-YMTOWFKASA-N 1 2 324.371 4.387 20 0 DIADLO CC(C)c1cc(C[NH2+][C@H](C)c2ccccc2Br)on1 ZINC000169224285 1057690873 /nfs/dbraw/zinc/69/08/73/1057690873.db2.gz HOZKRITXBXMKKF-LLVKDONJSA-N 1 2 323.234 4.411 20 0 DIADLO Nc1[nH+]cccc1-c1ccc(-c2noc(C3CCCCC3)n2)cc1 ZINC001243476558 1057691155 /nfs/dbraw/zinc/69/11/55/1057691155.db2.gz UCRBLYVAGKLJON-UHFFFAOYSA-N 1 2 320.396 4.429 20 0 DIADLO Nc1[nH+]cccc1-c1cc(F)c(F)c(OCc2ccccc2)c1 ZINC001243477024 1057691467 /nfs/dbraw/zinc/69/14/67/1057691467.db2.gz HFBSMXRNNQSXRT-UHFFFAOYSA-N 1 2 312.319 4.188 20 0 DIADLO Cc1ccsc1-c1nn(C[N@@H+](C)C2CCCC2)c(=S)o1 ZINC000730253229 1057709317 /nfs/dbraw/zinc/70/93/17/1057709317.db2.gz UBFYZYSHCTXWLP-UHFFFAOYSA-N 1 2 309.460 4.074 20 0 DIADLO Cc1ccsc1-c1nn(C[N@H+](C)C2CCCC2)c(=S)o1 ZINC000730253229 1057709318 /nfs/dbraw/zinc/70/93/18/1057709318.db2.gz UBFYZYSHCTXWLP-UHFFFAOYSA-N 1 2 309.460 4.074 20 0 DIADLO CC[N@H+](CC(C)C)Cn1nc(-c2sccc2C)oc1=S ZINC000730250960 1057709765 /nfs/dbraw/zinc/70/97/65/1057709765.db2.gz DXSVFOUBEKLIHP-UHFFFAOYSA-N 1 2 311.476 4.178 20 0 DIADLO CC[N@@H+](CC(C)C)Cn1nc(-c2sccc2C)oc1=S ZINC000730250960 1057709769 /nfs/dbraw/zinc/70/97/69/1057709769.db2.gz DXSVFOUBEKLIHP-UHFFFAOYSA-N 1 2 311.476 4.178 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(F)cc(SC)c1 ZINC001243562743 1057714725 /nfs/dbraw/zinc/71/47/25/1057714725.db2.gz TZQFHCFZZJEZCG-UHFFFAOYSA-N 1 2 314.385 4.409 20 0 DIADLO CCCCCCC(=O)NCc1cc[nH+]c(N2CCCCCC2)c1 ZINC000730507112 1057716830 /nfs/dbraw/zinc/71/68/30/1057716830.db2.gz YDILLURBNJKXEZ-UHFFFAOYSA-N 1 2 317.477 4.049 20 0 DIADLO NC(Cc1cccs1)=[NH+]OCc1ccc(Cl)cc1Cl ZINC000731028451 1057733459 /nfs/dbraw/zinc/73/34/59/1057733459.db2.gz FDOSQZQBCLSOLJ-UHFFFAOYSA-N 1 2 315.225 4.296 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(-c4ccsc4)nn3)cc2)c[nH+]1 ZINC001243655997 1057745355 /nfs/dbraw/zinc/74/53/55/1057745355.db2.gz JTBYUORFYMEXME-UHFFFAOYSA-N 1 2 318.405 4.117 20 0 DIADLO Fc1ccc2ccnc(-c3ccc(Cn4cc[nH+]c4)cc3)c2c1 ZINC001243656031 1057745549 /nfs/dbraw/zinc/74/55/49/1057745549.db2.gz GMSFAOQIJHBUFE-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO CCc1cc2ncnc(-c3ccc(Cn4cc[nH+]c4)cc3)c2s1 ZINC001243655847 1057745606 /nfs/dbraw/zinc/74/56/06/1057745606.db2.gz CESBYBWIRXECJP-UHFFFAOYSA-N 1 2 320.421 4.166 20 0 DIADLO CC(C)C(=O)Nc1cccc(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243657788 1057746047 /nfs/dbraw/zinc/74/60/47/1057746047.db2.gz PNHZKJXGYYRRMK-UHFFFAOYSA-N 1 2 319.408 4.193 20 0 DIADLO Fc1cc(C(F)(F)F)cnc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243658410 1057746196 /nfs/dbraw/zinc/74/61/96/1057746196.db2.gz XPWAJCDNIXVESJ-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO Cc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)cnc1OC(C)C ZINC001243658144 1057746374 /nfs/dbraw/zinc/74/63/74/1057746374.db2.gz DVKUNGUDMVZGGL-UHFFFAOYSA-N 1 2 307.397 4.089 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(-c4ccncc4)cn3)cc2)c[nH+]1 ZINC001243657588 1057746518 /nfs/dbraw/zinc/74/65/18/1057746518.db2.gz OUDNPTQFYUBAJJ-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO c1cn(Cc2ccc(-c3ccnc4[nH]c(C5CC5)cc43)cc2)c[nH+]1 ZINC001243658110 1057746633 /nfs/dbraw/zinc/74/66/33/1057746633.db2.gz CTJCOJHMGSBRBY-UHFFFAOYSA-N 1 2 314.392 4.352 20 0 DIADLO Fc1cc2ncccc2c(F)c1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243659060 1057747257 /nfs/dbraw/zinc/74/72/57/1057747257.db2.gz ZUDWZPHKJJICBD-UHFFFAOYSA-N 1 2 321.330 4.425 20 0 DIADLO COc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c2ccncc12 ZINC001243660259 1057747267 /nfs/dbraw/zinc/74/72/67/1057747267.db2.gz SJYHJQXSYPVOPN-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO CCOC(=O)c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1C ZINC001243659583 1057747320 /nfs/dbraw/zinc/74/73/20/1057747320.db2.gz VTSMCMCBLHPTTE-UHFFFAOYSA-N 1 2 320.392 4.084 20 0 DIADLO Cc1cc2c(cccc2-c2ccc(Cn3cc[nH+]c3)cc2)n1C ZINC001243659691 1057747351 /nfs/dbraw/zinc/74/73/51/1057747351.db2.gz AELYCGLUHZXBED-UHFFFAOYSA-N 1 2 301.393 4.399 20 0 DIADLO COCc1cc(C)c(-c2ccc(Cn3cc[nH+]c3)cc2)c(C)c1 ZINC001243660693 1057747515 /nfs/dbraw/zinc/74/75/15/1057747515.db2.gz UVIJCTSFWKDGJL-UHFFFAOYSA-N 1 2 306.409 4.362 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)Oc1ccc(SC)cc1)c1ccccc1 ZINC000731598547 1057749019 /nfs/dbraw/zinc/74/90/19/1057749019.db2.gz MIIRYNOTZBVOQM-KRWDZBQOSA-N 1 2 315.438 4.007 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)Oc1ccc(SC)cc1)c1ccccc1 ZINC000731598547 1057749021 /nfs/dbraw/zinc/74/90/21/1057749021.db2.gz MIIRYNOTZBVOQM-KRWDZBQOSA-N 1 2 315.438 4.007 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cn1ccc(-c2ccccc2)n1 ZINC000731657109 1057750388 /nfs/dbraw/zinc/75/03/88/1057750388.db2.gz ACDRTWYIMXOJOM-UHFFFAOYSA-N 1 2 317.845 4.355 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cn1ccc(-c2ccccc2)n1 ZINC000731657109 1057750389 /nfs/dbraw/zinc/75/03/89/1057750389.db2.gz ACDRTWYIMXOJOM-UHFFFAOYSA-N 1 2 317.845 4.355 20 0 DIADLO CC[C@H](C)C[N@H+](C)Cn1nc(-c2ccccc2C)oc1=S ZINC000732183930 1057769152 /nfs/dbraw/zinc/76/91/52/1057769152.db2.gz VPQRKXVBZAQURL-LBPRGKRZSA-N 1 2 305.447 4.116 20 0 DIADLO CC[C@H](C)C[N@@H+](C)Cn1nc(-c2ccccc2C)oc1=S ZINC000732183930 1057769154 /nfs/dbraw/zinc/76/91/54/1057769154.db2.gz VPQRKXVBZAQURL-LBPRGKRZSA-N 1 2 305.447 4.116 20 0 DIADLO COc1ccc(-c2cccc(-c3c[nH+]cn3C)c2)cc1SC ZINC001243748864 1057769628 /nfs/dbraw/zinc/76/96/28/1057769628.db2.gz JTYGPQJGTOAMBJ-UHFFFAOYSA-N 1 2 310.422 4.485 20 0 DIADLO Cc1nc(OCC(C)C)ccc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001243799464 1057782046 /nfs/dbraw/zinc/78/20/46/1057782046.db2.gz PIZFXIIPRPGTRK-UHFFFAOYSA-N 1 2 321.424 4.492 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1ccc(Br)cc1F ZINC001243803822 1057783124 /nfs/dbraw/zinc/78/31/24/1057783124.db2.gz CCZHPDNRJUBHJM-UHFFFAOYSA-N 1 2 305.150 4.211 20 0 DIADLO Cc1cc(-c2ccc(Br)cc2F)c2[nH+]ccn2c1 ZINC001243805058 1057783994 /nfs/dbraw/zinc/78/39/94/1057783994.db2.gz JQSGTYPXXITVBV-UHFFFAOYSA-N 1 2 305.150 4.211 20 0 DIADLO Nc1cc(-c2cc(F)cc(F)c2Cl)[nH+]cc1C(F)(F)F ZINC001243829003 1057789462 /nfs/dbraw/zinc/78/94/62/1057789462.db2.gz FPPBXAKMEBNZOD-UHFFFAOYSA-N 1 2 308.637 4.281 20 0 DIADLO Cc1ccc2ccc(-c3cc[nH+]c(N4CCOCC4)c3)cc2c1 ZINC001243902605 1057802438 /nfs/dbraw/zinc/80/24/38/1057802438.db2.gz IYBUINCLNHCPJN-UHFFFAOYSA-N 1 2 304.393 4.047 20 0 DIADLO Fc1cc(-c2ccc(-n3cc[nH+]c3)cc2)cc(C(F)(F)F)n1 ZINC001243911537 1057804033 /nfs/dbraw/zinc/80/40/33/1057804033.db2.gz LADRQMMYOOWXPU-UHFFFAOYSA-N 1 2 307.250 4.092 20 0 DIADLO COCC[N@H+](Cc1ncc(C(C)C)o1)[C@@H](C)c1ccccc1 ZINC000733308502 1057810792 /nfs/dbraw/zinc/81/07/92/1057810792.db2.gz KUUGZBOZGSWQJM-HNNXBMFYSA-N 1 2 302.418 4.008 20 0 DIADLO COCC[N@@H+](Cc1ncc(C(C)C)o1)[C@@H](C)c1ccccc1 ZINC000733308502 1057810796 /nfs/dbraw/zinc/81/07/96/1057810796.db2.gz KUUGZBOZGSWQJM-HNNXBMFYSA-N 1 2 302.418 4.008 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ncc(C(C)C)o1)CCC2 ZINC000733310785 1057812222 /nfs/dbraw/zinc/81/22/22/1057812222.db2.gz WQJQPKPNFBUCRX-CYBMUJFWSA-N 1 2 305.447 4.072 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1ncc(C(C)C)o1)CCC2 ZINC000733310785 1057812228 /nfs/dbraw/zinc/81/22/28/1057812228.db2.gz WQJQPKPNFBUCRX-CYBMUJFWSA-N 1 2 305.447 4.072 20 0 DIADLO COc1ccc(-c2cc(C)cn3cc[nH+]c23)c(C(F)(F)F)c1 ZINC001243945113 1057816455 /nfs/dbraw/zinc/81/64/55/1057816455.db2.gz HVJJAPKCOAWXTJ-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Cc1sc2nc(C(F)(F)F)nc(C3=C[NH2+]CCC3)c2c1C ZINC001243949641 1057817387 /nfs/dbraw/zinc/81/73/87/1057817387.db2.gz WPTFOVQJIGKTNM-UHFFFAOYSA-N 1 2 313.348 4.051 20 0 DIADLO Cc1nc2sc(-c3ccccc3)cc2c(C2=C[NH2+]CCC2)n1 ZINC001243949139 1057817548 /nfs/dbraw/zinc/81/75/48/1057817548.db2.gz SBCIXCRYAYPOPH-UHFFFAOYSA-N 1 2 307.422 4.391 20 0 DIADLO Nc1cn2ccc(-c3c(Cl)cccc3C(F)(F)F)cc2[nH+]1 ZINC001243967961 1057823104 /nfs/dbraw/zinc/82/31/04/1057823104.db2.gz DZYWFGKXMQHSEA-UHFFFAOYSA-N 1 2 311.694 4.256 20 0 DIADLO Cc1noc(-c2ccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)cc2F)n1 ZINC001243976354 1057826563 /nfs/dbraw/zinc/82/65/63/1057826563.db2.gz OQBCGUXRQLIDFH-UHFFFAOYSA-N 1 2 320.327 4.241 20 0 DIADLO CCOC(=O)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1C ZINC001243977769 1057826985 /nfs/dbraw/zinc/82/69/85/1057826985.db2.gz WIJJHYDVKISCIZ-UHFFFAOYSA-N 1 2 306.365 4.229 20 0 DIADLO COC(=O)c1ccc(C2CC2)c(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001243982996 1057828703 /nfs/dbraw/zinc/82/87/03/1057828703.db2.gz WKEZTJMXSXSXQF-UHFFFAOYSA-N 1 2 318.376 4.408 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2cc(C)c(C(=O)OC)c(C)c2)c1 ZINC001244008747 1057837431 /nfs/dbraw/zinc/83/74/31/1057837431.db2.gz ZIMORMFTZGKTTD-UHFFFAOYSA-N 1 2 311.381 4.119 20 0 DIADLO FC(F)COc1ccc(-c2ccccc2Cn2cc[nH+]c2)cc1 ZINC001244066227 1057855861 /nfs/dbraw/zinc/85/58/61/1057855861.db2.gz HKYINQXEXCOUDI-UHFFFAOYSA-N 1 2 314.335 4.242 20 0 DIADLO COc1cccc(C(F)(F)F)c1-c1cc(C)c2[nH+]ccn2c1 ZINC001244082223 1057862496 /nfs/dbraw/zinc/86/24/96/1057862496.db2.gz VSMNUOTXJHXUDB-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3c(C)cc(C4CC4)cc3F)nn2)c1C ZINC001244122716 1057876811 /nfs/dbraw/zinc/87/68/11/1057876811.db2.gz CHXBOGHZHWANFY-UHFFFAOYSA-N 1 2 322.387 4.271 20 0 DIADLO Cc1cc(C2CC2)cc(F)c1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001244124943 1057877581 /nfs/dbraw/zinc/87/75/81/1057877581.db2.gz VVWBDEVXMQQNQE-UHFFFAOYSA-N 1 2 307.372 4.318 20 0 DIADLO COc1cc(-c2cc[nH+]c(N(C)C)c2)ccc1-c1ccccc1 ZINC001244142527 1057884774 /nfs/dbraw/zinc/88/47/74/1057884774.db2.gz UNXPNADEWARLOL-UHFFFAOYSA-N 1 2 304.393 4.490 20 0 DIADLO COCc1ccc(C)c(-c2cc(F)c(C[NH+](C)C)c(F)c2)c1 ZINC001244171596 1057891092 /nfs/dbraw/zinc/89/10/92/1057891092.db2.gz ILUZORRKHFVDRD-UHFFFAOYSA-N 1 2 305.368 4.148 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccccc2N2CCCC2)c1 ZINC001244181830 1057893130 /nfs/dbraw/zinc/89/31/30/1057893130.db2.gz DNYDSKODTFRWGP-UHFFFAOYSA-N 1 2 303.409 4.354 20 0 DIADLO Fc1cc(N2CCCCC2)ccc1-c1cc(-n2ccnc2)cc[nH+]1 ZINC001244262586 1057915126 /nfs/dbraw/zinc/91/51/26/1057915126.db2.gz ASDREFIYNMINHC-UHFFFAOYSA-N 1 2 322.387 4.064 20 0 DIADLO Cc1cn2cc(-c3ccc(N4CCCCC4)cc3F)ccc2[nH+]1 ZINC001244264223 1057915713 /nfs/dbraw/zinc/91/57/13/1057915713.db2.gz DLNJSDPVTDBYQF-UHFFFAOYSA-N 1 2 309.388 4.439 20 0 DIADLO Cc1cc(-c2ccc(N3CCCCC3)cc2F)c2[nH+]ccn2c1 ZINC001244265303 1057916421 /nfs/dbraw/zinc/91/64/21/1057916421.db2.gz XGSUQRMUYGAGKZ-UHFFFAOYSA-N 1 2 309.388 4.439 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1ccc(N2CCCCC2)cc1F ZINC001244265324 1057916462 /nfs/dbraw/zinc/91/64/62/1057916462.db2.gz YMKGQLWQIWJYDN-UHFFFAOYSA-N 1 2 309.388 4.439 20 0 DIADLO COC(=[NH2+])c1cccc(-c2ccc(N3CCCCC3)cc2F)c1 ZINC001244265564 1057917080 /nfs/dbraw/zinc/91/70/80/1057917080.db2.gz GDCWQCLKLBEISL-UHFFFAOYSA-N 1 2 312.388 4.455 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(N3CCCC3)cc2F)c1 ZINC001244269319 1057918205 /nfs/dbraw/zinc/91/82/05/1057918205.db2.gz ACTAQDLXIPEJAK-UHFFFAOYSA-N 1 2 312.388 4.455 20 0 DIADLO Fc1cc(N2CCCC2)ccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001244269661 1057918266 /nfs/dbraw/zinc/91/82/66/1057918266.db2.gz ICNXMDVEZGYQGP-UHFFFAOYSA-N 1 2 321.399 4.338 20 0 DIADLO Cc1cc(C2CC2)ccc1-c1c[nH+]c(N2CCOCC2)c(C)c1 ZINC001244275411 1057921085 /nfs/dbraw/zinc/92/10/85/1057921085.db2.gz CVANHTNQEAWDCO-UHFFFAOYSA-N 1 2 308.425 4.079 20 0 DIADLO Nc1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc1C(F)(F)F ZINC001244375658 1057946367 /nfs/dbraw/zinc/94/63/67/1057946367.db2.gz BMRPQOVEBLIFQB-UHFFFAOYSA-N 1 2 321.277 4.279 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc(Cl)c3c[nH]nc32)cc1F ZINC001244401334 1057951176 /nfs/dbraw/zinc/95/11/76/1057951176.db2.gz MDYHNQHSYOSGPD-UHFFFAOYSA-N 1 2 321.758 4.223 20 0 DIADLO COCOc1ccc(C)cc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001244408794 1057952919 /nfs/dbraw/zinc/95/29/19/1057952919.db2.gz CWCQERJFENOMEB-UHFFFAOYSA-N 1 2 308.381 4.045 20 0 DIADLO CN(C)c1ccc(-c2ccccc2Cn2cc[nH+]c2)cc1Cl ZINC001244413871 1057954352 /nfs/dbraw/zinc/95/43/52/1057954352.db2.gz DECLGEKXOYYMAO-UHFFFAOYSA-N 1 2 311.816 4.318 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2ccc(Cl)c(C(C)C)c2)cc1 ZINC001244438624 1057958038 /nfs/dbraw/zinc/95/80/38/1057958038.db2.gz FNPGSAOMUAHDEP-KRWDZBQOSA-N 1 2 317.816 4.303 20 0 DIADLO Cc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)cc1OC(C)C ZINC001244447120 1057960876 /nfs/dbraw/zinc/96/08/76/1057960876.db2.gz PIMMUUVMOFZMOF-UHFFFAOYSA-N 1 2 307.397 4.089 20 0 DIADLO CSc1ccc(-c2nc3[nH]ccc3c[nH+]2)cc1C(F)(F)F ZINC001244493477 1057974817 /nfs/dbraw/zinc/97/48/17/1057974817.db2.gz RTLCTJDMIFEENJ-UHFFFAOYSA-N 1 2 309.316 4.317 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001244512358 1057981966 /nfs/dbraw/zinc/98/19/66/1057981966.db2.gz SACGVHWCAFJOJZ-UHFFFAOYSA-N 1 2 322.170 4.439 20 0 DIADLO Cc1cc(-c2cc[nH+]c(N3CCCCC3)c2)cc(Cl)c1O ZINC001244538595 1057990050 /nfs/dbraw/zinc/99/00/50/1057990050.db2.gz NOGMVFDHRITLLJ-UHFFFAOYSA-N 1 2 302.805 4.406 20 0 DIADLO Oc1ccc(Cl)c(-c2ccccc2Cn2cc[nH+]c2)c1F ZINC001244541262 1057991552 /nfs/dbraw/zinc/99/15/52/1057991552.db2.gz APDXFGUXGADBGA-UHFFFAOYSA-N 1 2 302.736 4.097 20 0 DIADLO OCc1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1C(F)(F)F ZINC001244588386 1058003489 /nfs/dbraw/zinc/00/34/89/1058003489.db2.gz RYRPTUFVWBZYSB-UHFFFAOYSA-N 1 2 318.298 4.255 20 0 DIADLO COC(=O)c1ccc(-c2c(C)cc[nH+]c2C)cc1C(F)(F)F ZINC001244599396 1058005335 /nfs/dbraw/zinc/00/53/35/1058005335.db2.gz KUFRYSPFFDIUPH-UHFFFAOYSA-N 1 2 309.287 4.171 20 0 DIADLO CCCOc1cc(-c2ccc(-n3cc[nH+]c3)cc2)c(Cl)cn1 ZINC001244604332 1058006486 /nfs/dbraw/zinc/00/64/86/1058006486.db2.gz FCPCSUGHZHAETO-UHFFFAOYSA-N 1 2 313.788 4.377 20 0 DIADLO C[N@@H+]1CCCC[C@H]1c1ccc(-c2ccc(Cl)c(O)c2F)nc1 ZINC001244631891 1058014558 /nfs/dbraw/zinc/01/45/58/1058014558.db2.gz XVZDURXAFCTXFW-HNNXBMFYSA-N 1 2 320.795 4.404 20 0 DIADLO C[N@H+]1CCCC[C@H]1c1ccc(-c2ccc(Cl)c(O)c2F)nc1 ZINC001244631891 1058014562 /nfs/dbraw/zinc/01/45/62/1058014562.db2.gz XVZDURXAFCTXFW-HNNXBMFYSA-N 1 2 320.795 4.404 20 0 DIADLO Oc1c(Cl)ccc(-c2ccc(C[NH+]3CCCCC3)cn2)c1F ZINC001244633862 1058016339 /nfs/dbraw/zinc/01/63/39/1058016339.db2.gz OWNCTURQUDPQGE-UHFFFAOYSA-N 1 2 320.795 4.233 20 0 DIADLO FC(F)(F)Oc1cc(-c2nc3[nH]ccc3c[nH+]2)ccc1Cl ZINC001244672375 1058023506 /nfs/dbraw/zinc/02/35/06/1058023506.db2.gz YABDQPZWTHUXEC-UHFFFAOYSA-N 1 2 313.666 4.129 20 0 DIADLO COc1c(F)cc(-c2cc[nH+]c(N3CCCC3)c2)cc1Cl ZINC001244699756 1058029776 /nfs/dbraw/zinc/02/97/76/1058029776.db2.gz XVDJCGCISHRXFO-UHFFFAOYSA-N 1 2 306.768 4.150 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc(F)cc(N(C)C)c1 ZINC001244799433 1058048980 /nfs/dbraw/zinc/04/89/80/1058048980.db2.gz YDLSENQODNYZBS-UHFFFAOYSA-N 1 2 313.420 4.252 20 0 DIADLO Cc1cc(C2=CC[C@H](OC(=O)c3ccccc3)CC2)cc(C)[nH+]1 ZINC001244804069 1058050079 /nfs/dbraw/zinc/05/00/79/1058050079.db2.gz IMECCZMHTFLTNW-IBGZPJMESA-N 1 2 307.393 4.491 20 0 DIADLO O=C(O[C@H]1CC=C(c2cccc3[nH+]ccn32)CC1)c1ccccc1 ZINC001244804134 1058050089 /nfs/dbraw/zinc/05/00/89/1058050089.db2.gz JBTGDGCQQSDJRD-KRWDZBQOSA-N 1 2 318.376 4.127 20 0 DIADLO Cc1cc(C)c(C2=CC[C@H](OC(=O)c3ccccc3)CC2)c[nH+]1 ZINC001244808243 1058051088 /nfs/dbraw/zinc/05/10/88/1058051088.db2.gz WVGXNUNTBBUTIU-SFHVURJKSA-N 1 2 307.393 4.491 20 0 DIADLO Cc1cc2c(cccc2-c2cccc(C[NH+]3CCOCC3)c2F)[nH]1 ZINC001244855278 1058058549 /nfs/dbraw/zinc/05/85/49/1058058549.db2.gz QSDQTLCEWMBWOO-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc(OC(C)C)c(OC)c1 ZINC001244888203 1058066259 /nfs/dbraw/zinc/06/62/59/1058066259.db2.gz MSKZWFHPSFKKBG-UHFFFAOYSA-N 1 2 312.369 4.034 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(CO)c(C)c2Cl)c1 ZINC001244969490 1058083087 /nfs/dbraw/zinc/08/30/87/1058083087.db2.gz KXYMAGRUFZEUIA-UHFFFAOYSA-N 1 2 303.789 4.170 20 0 DIADLO CNc1cc(-c2ccc(-c3nc4ccccc4[nH]3)cc2)cc[nH+]1 ZINC001244974242 1058084074 /nfs/dbraw/zinc/08/40/74/1058084074.db2.gz ZWUYBISCQCAUIC-UHFFFAOYSA-N 1 2 300.365 4.334 20 0 DIADLO CCOC(=O)c1ccc(-c2cc[nH+]c(NC)c2)c2ccccc12 ZINC001244976575 1058084244 /nfs/dbraw/zinc/08/42/44/1058084244.db2.gz PUXCRRFRBIRPDF-UHFFFAOYSA-N 1 2 306.365 4.120 20 0 DIADLO CNc1cc(-c2ccc(NC(=O)Oc3ccccc3)cc2)cc[nH+]1 ZINC001244978654 1058084568 /nfs/dbraw/zinc/08/45/68/1058084568.db2.gz XRQPCUULVQJRLY-UHFFFAOYSA-N 1 2 319.364 4.401 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cc(C)c(C)cc1OC(C)C ZINC001245031138 1058098575 /nfs/dbraw/zinc/09/85/75/1058098575.db2.gz FLDSUMIUTRFLQC-UHFFFAOYSA-N 1 2 310.397 4.414 20 0 DIADLO COc1cc(-c2c[nH+]c(N3CCCCC3)cc2C)c(Cl)cn1 ZINC001245040377 1058100493 /nfs/dbraw/zinc/10/04/93/1058100493.db2.gz QKMKUEIQYPLBHU-UHFFFAOYSA-N 1 2 317.820 4.104 20 0 DIADLO Cn1ccc2c1cc[nH+]c2-c1cccc(OC(F)(F)F)c1F ZINC001245173918 1058123293 /nfs/dbraw/zinc/12/32/93/1058123293.db2.gz KXFQRRYWSVLPRB-UHFFFAOYSA-N 1 2 310.250 4.278 20 0 DIADLO COc1ccnc2ccc(-c3c[nH+]cn3Cc3ccccc3)cc21 ZINC001245196439 1058125797 /nfs/dbraw/zinc/12/57/97/1058125797.db2.gz DZKMKZBOOLWXIP-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Fc1ccc(-c2c[nH+]cn2Cc2ccccc2)c2cccnc12 ZINC001245197438 1058126252 /nfs/dbraw/zinc/12/62/52/1058126252.db2.gz TUNDWTYVZYJNDR-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO Cc1[nH]c2ncc(-c3c[nH+]cn3Cc3ccccc3)cc2c1C ZINC001245197105 1058126280 /nfs/dbraw/zinc/12/62/80/1058126280.db2.gz LYUGQZZXNYOSCT-UHFFFAOYSA-N 1 2 302.381 4.092 20 0 DIADLO CC(=O)Nc1c(C)cc(-c2c[nH+]cn2Cc2ccccc2)cc1C ZINC001245199597 1058126846 /nfs/dbraw/zinc/12/68/46/1058126846.db2.gz XBTYJLHKPBLQJX-UHFFFAOYSA-N 1 2 319.408 4.174 20 0 DIADLO COCc1cc(C)c(-c2c[nH+]cn2Cc2ccccc2)c(C)c1 ZINC001245201568 1058127104 /nfs/dbraw/zinc/12/71/04/1058127104.db2.gz KJJVWDINPHMCKA-UHFFFAOYSA-N 1 2 306.409 4.362 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccnc(OCC3CCC3)c2)c1 ZINC001245242371 1058134225 /nfs/dbraw/zinc/13/42/25/1058134225.db2.gz PPHDMYZMQJUAGM-UHFFFAOYSA-N 1 2 319.408 4.328 20 0 DIADLO Cc1cccc2[nH]c(-c3cc(F)c(C[NH+](C)C)c(F)c3)cc21 ZINC001245347771 1058149217 /nfs/dbraw/zinc/14/92/17/1058149217.db2.gz RDFPXNXLYOOUIX-UHFFFAOYSA-N 1 2 300.352 4.483 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccncc2C(F)(F)F)cc1F ZINC001245446967 1058168098 /nfs/dbraw/zinc/16/80/98/1058168098.db2.gz NDWXYMMOQKOROZ-UHFFFAOYSA-N 1 2 316.273 4.107 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cccc(Br)c1F ZINC001245484002 1058178837 /nfs/dbraw/zinc/17/88/37/1058178837.db2.gz LODQXWRQNHEQGL-UHFFFAOYSA-N 1 2 309.182 4.025 20 0 DIADLO CC1(C)CCC(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)CC1 ZINC001527648870 1058194731 /nfs/dbraw/zinc/19/47/31/1058194731.db2.gz LIEUXYOTUZLCKA-UHFFFAOYSA-N 1 2 315.392 4.166 20 0 DIADLO Cc1cc(-c2ncnc3scc(-c4cccs4)c32)c[nH+]c1N ZINC001245535973 1058214968 /nfs/dbraw/zinc/21/49/68/1058214968.db2.gz JEZVYANQPSYVTC-UHFFFAOYSA-N 1 2 324.434 4.372 20 0 DIADLO Cc1c(C)n(C2CCCC2)c2ncnc(-c3c[nH+]c(N)c(C)c3)c12 ZINC001245536407 1058215533 /nfs/dbraw/zinc/21/55/33/1058215533.db2.gz KHOQCVAOYLZSPO-UHFFFAOYSA-N 1 2 321.428 4.116 20 0 DIADLO Cc1cc(-c2nc(-c3ccsc3)nc3ccccc32)c[nH+]c1N ZINC001245537831 1058216118 /nfs/dbraw/zinc/21/61/18/1058216118.db2.gz IZZYDQYLLQKXOM-UHFFFAOYSA-N 1 2 318.405 4.311 20 0 DIADLO CCOc1c(F)cc(-c2c[nH+]c(N)c(C)c2)cc1C(F)(F)F ZINC001245541733 1058218701 /nfs/dbraw/zinc/21/87/01/1058218701.db2.gz XNLVQTKQNMAANF-UHFFFAOYSA-N 1 2 314.282 4.196 20 0 DIADLO Cc1cc(-c2ccc3[nH]c(-c4ccccc4)nc3c2)c[nH+]c1N ZINC001245539006 1058219891 /nfs/dbraw/zinc/21/98/91/1058219891.db2.gz CMFAPGUFMCBXAY-UHFFFAOYSA-N 1 2 300.365 4.183 20 0 DIADLO Cc1cc(-c2ccc3nc(-c4ccccc4)[nH]c3c2)c[nH+]c1N ZINC001245539006 1058219907 /nfs/dbraw/zinc/21/99/07/1058219907.db2.gz CMFAPGUFMCBXAY-UHFFFAOYSA-N 1 2 300.365 4.183 20 0 DIADLO COC(=O)c1cc(-c2cccc(-c3c[nH+]cn3C)c2)c(C)cc1C ZINC001245553274 1058225710 /nfs/dbraw/zinc/22/57/10/1058225710.db2.gz GPQWVIRDGDQAMO-UHFFFAOYSA-N 1 2 320.392 4.158 20 0 DIADLO Cc1nc(C)c(C[N@@H+]2CCCC[C@H]2c2nc(C)c(C)s2)o1 ZINC001548829789 1058264266 /nfs/dbraw/zinc/26/42/66/1058264266.db2.gz YIQKFUBUUZLPHY-AWEZNQCLSA-N 1 2 305.447 4.092 20 0 DIADLO Cc1nc(C)c(C[N@H+]2CCCC[C@H]2c2nc(C)c(C)s2)o1 ZINC001548829789 1058264280 /nfs/dbraw/zinc/26/42/80/1058264280.db2.gz YIQKFUBUUZLPHY-AWEZNQCLSA-N 1 2 305.447 4.092 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2Cc2cc(C3CC3)no2)sc1C ZINC001549220514 1058286224 /nfs/dbraw/zinc/28/62/24/1058286224.db2.gz AILNYGZMTYQSHN-INIZCTEOSA-N 1 2 317.458 4.353 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2Cc2cc(C3CC3)no2)sc1C ZINC001549220514 1058286239 /nfs/dbraw/zinc/28/62/39/1058286239.db2.gz AILNYGZMTYQSHN-INIZCTEOSA-N 1 2 317.458 4.353 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccc3c(c2)C(=O)N(C)C3)c1 ZINC001245651954 1058310945 /nfs/dbraw/zinc/31/09/45/1058310945.db2.gz XLELTKULXUTQMV-UHFFFAOYSA-N 1 2 308.425 4.094 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2nc(C)c(C)s2)sn1 ZINC001550058209 1058320636 /nfs/dbraw/zinc/32/06/36/1058320636.db2.gz IPTPFTVQIPINMK-CQSZACIVSA-N 1 2 307.488 4.252 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2nc(C)c(C)s2)sn1 ZINC001550058209 1058320647 /nfs/dbraw/zinc/32/06/47/1058320647.db2.gz IPTPFTVQIPINMK-CQSZACIVSA-N 1 2 307.488 4.252 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C3CCC(F)CC3)cc2)[nH+]c1C ZINC001550419989 1058339626 /nfs/dbraw/zinc/33/96/26/1058339626.db2.gz NTKRVHGCSWLYOL-UHFFFAOYSA-N 1 2 315.392 4.160 20 0 DIADLO C[C@@H]([NH2+][C@H]1CC(C)(C)Oc2ccc(F)cc21)c1ncccc1F ZINC001550704080 1058354239 /nfs/dbraw/zinc/35/42/39/1058354239.db2.gz OKIYUODMBNYDPN-ABAIWWIYSA-N 1 2 318.367 4.313 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)Cc2ccc3cc[nH]c3c2)c(C)[nH+]1 ZINC001562901457 1058357502 /nfs/dbraw/zinc/35/75/02/1058357502.db2.gz PKYJZCZPWBNBSD-UHFFFAOYSA-N 1 2 322.412 4.152 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C)c3cccc4ccccc43)ccn12 ZINC001518600089 1058357677 /nfs/dbraw/zinc/35/76/77/1058357677.db2.gz ZYMKBPBMJNOTFS-UHFFFAOYSA-N 1 2 315.376 4.073 20 0 DIADLO Cc1cc(N2CC[C@@H](c3ccccc3)O[C@@H](C)C2)nc(C2CC2)[nH+]1 ZINC001551229499 1058382451 /nfs/dbraw/zinc/38/24/51/1058382451.db2.gz UWAWYIDCBKOPAH-YJBOKZPZSA-N 1 2 323.440 4.019 20 0 DIADLO COc1cc(-c2cn3cc[nH+]c3cc2C)ccc1OC(F)(F)F ZINC001245714705 1058387074 /nfs/dbraw/zinc/38/70/74/1058387074.db2.gz MYOQSDSLNFMVMN-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO COc1cc(-c2ccc3[nH+]ccn3c2C)ccc1OC(F)(F)F ZINC001245716709 1058389934 /nfs/dbraw/zinc/38/99/34/1058389934.db2.gz UFXNWZAPCRZVIK-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)CC(C)(C)C2CC2)[nH+]c1C ZINC001551737389 1058408850 /nfs/dbraw/zinc/40/88/50/1058408850.db2.gz DEZNJRQNBDVBSS-UHFFFAOYSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2CCCC[C@@H]2F)[nH+]c1C ZINC001551740835 1058409702 /nfs/dbraw/zinc/40/97/02/1058409702.db2.gz OGRYSWKNFJJZHI-HIFRSBDPSA-N 1 2 315.392 4.160 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C2CCC(F)CC2)[nH+]c1C ZINC001551743516 1058410585 /nfs/dbraw/zinc/41/05/85/1058410585.db2.gz VRWJTDSTNYRZOU-UHFFFAOYSA-N 1 2 315.392 4.160 20 0 DIADLO C[C@@H]1CCC[C@]1(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001519381974 1058423866 /nfs/dbraw/zinc/42/38/66/1058423866.db2.gz RPCBOORSJFNYDP-PXAZEXFGSA-N 1 2 317.820 4.291 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1-c1cc(-n2cc[nH+]c2)ccn1 ZINC001245744093 1058425073 /nfs/dbraw/zinc/42/50/73/1058425073.db2.gz DUPLJAAQSNXGBG-UHFFFAOYSA-N 1 2 308.143 4.380 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC(c3ccccc3C)CC2)c(C)[nH+]1 ZINC001528457907 1058428448 /nfs/dbraw/zinc/42/84/48/1058428448.db2.gz AGLOJGAWFBAIDR-UHFFFAOYSA-N 1 2 322.452 4.335 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H]3CC[C@H]4CCCC[C@H]4C3)ccc2[nH+]1 ZINC001519733595 1058468957 /nfs/dbraw/zinc/46/89/57/1058468957.db2.gz VPZPZTFVMIQWEP-OWCLPIDISA-N 1 2 311.429 4.188 20 0 DIADLO COc1c(F)c(Cl)ccc1-c1ccccc1Cn1cc[nH+]c1 ZINC001245801389 1058483680 /nfs/dbraw/zinc/48/36/80/1058483680.db2.gz CBQIHFQMMHCASZ-UHFFFAOYSA-N 1 2 316.763 4.400 20 0 DIADLO CC[C@@H](C)CCC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001528669067 1058484281 /nfs/dbraw/zinc/48/42/81/1058484281.db2.gz LIIBVSDMUQFQRZ-GFCCVEGCSA-N 1 2 305.809 4.291 20 0 DIADLO COc1c(F)c(Cl)ccc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001245804050 1058488546 /nfs/dbraw/zinc/48/85/46/1058488546.db2.gz VHODBPNXPVSOKF-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO COc1cc(-c2ccc(C)c(N)[nH+]2)ccc1Oc1ccccc1 ZINC001245819622 1058508593 /nfs/dbraw/zinc/50/85/93/1058508593.db2.gz NPRQWDBXPAYLQQ-UHFFFAOYSA-N 1 2 306.365 4.440 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)c2ccoc2C2CC2)[nH+]c1C ZINC001553987763 1058510878 /nfs/dbraw/zinc/51/08/78/1058510878.db2.gz JNIGDMZPPFLDTM-UHFFFAOYSA-N 1 2 321.380 4.416 20 0 DIADLO CCn1ccc(C(=O)Nc2ccccc2-c2[nH]c(C)c(C)[nH+]2)c1C ZINC001553989298 1058513378 /nfs/dbraw/zinc/51/33/78/1058513378.db2.gz POWTZTHOMCFZOZ-UHFFFAOYSA-N 1 2 322.412 4.076 20 0 DIADLO Cc1ccc(NC(=S)Nc2ccn3cc[nH+]c3c2)cc1Cl ZINC001245823906 1058515334 /nfs/dbraw/zinc/51/53/34/1058515334.db2.gz VTXURBXFLYEASU-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2c(F)ccc(O)c2Cl)cc1 ZINC001245831111 1058529007 /nfs/dbraw/zinc/52/90/07/1058529007.db2.gz DKQPYEZGBLICOK-UHFFFAOYSA-N 1 2 302.736 4.252 20 0 DIADLO CC1=C(C)C[C@](C)(C(=O)NCc2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001528835057 1058535102 /nfs/dbraw/zinc/53/51/02/1058535102.db2.gz GHFDCBVTDJEVMS-HXUWFJFHSA-N 1 2 323.440 4.015 20 0 DIADLO Oc1ccc(F)c(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1Cl ZINC001245834566 1058539585 /nfs/dbraw/zinc/53/95/85/1058539585.db2.gz JZZCZIDEYFQPGX-UHFFFAOYSA-N 1 2 306.699 4.177 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2c(F)ccc(O)c2Cl)cc1F ZINC001245836054 1058541247 /nfs/dbraw/zinc/54/12/47/1058541247.db2.gz WVNCXMFWJVRYDN-UHFFFAOYSA-N 1 2 315.722 4.192 20 0 DIADLO CCCc1ccc(CCCC(=O)NCc2c[nH+]c(C)cc2C)cc1 ZINC001528920942 1058553574 /nfs/dbraw/zinc/55/35/74/1058553574.db2.gz ZRVXASWSWGKOLZ-UHFFFAOYSA-N 1 2 324.468 4.290 20 0 DIADLO CC[C@@H](Cc1cccc(C)c1)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001528982298 1058569091 /nfs/dbraw/zinc/56/90/91/1058569091.db2.gz FZPUANQEYFKQFR-KRWDZBQOSA-N 1 2 321.424 4.159 20 0 DIADLO Cn1cc[nH+]c1CCC(=O)Nc1cccc(C2CCCCC2)c1 ZINC001520352468 1058591181 /nfs/dbraw/zinc/59/11/81/1058591181.db2.gz MQHXKAXDSFDQJT-UHFFFAOYSA-N 1 2 311.429 4.039 20 0 DIADLO COc1ccc(F)c(-c2ccc(Cn3cc[nH+]c3)cc2)c1Cl ZINC001245885946 1058597580 /nfs/dbraw/zinc/59/75/80/1058597580.db2.gz HXTJAKFAHHMFKH-UHFFFAOYSA-N 1 2 316.763 4.400 20 0 DIADLO Cc1c(C(=O)NCc2cc(C)[nH+]c(C)c2)oc2c1c(C)ccc2C ZINC001529383912 1058693634 /nfs/dbraw/zinc/69/36/34/1058693634.db2.gz AFKWLJGHQFHCHR-UHFFFAOYSA-N 1 2 322.408 4.300 20 0 DIADLO O=C(N[C@@H](C1CCC1)C1CCCCC1)c1cc2c[nH+]ccc2[nH]1 ZINC001557174742 1058710886 /nfs/dbraw/zinc/71/08/86/1058710886.db2.gz JNGNFPKZYYMCDK-GOSISDBHSA-N 1 2 311.429 4.042 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C2CCC2)C2CCCCC2)c(C)[nH+]1 ZINC001529691144 1058800189 /nfs/dbraw/zinc/80/01/89/1058800189.db2.gz PBLHCSXUGIKVAM-LJQANCHMSA-N 1 2 314.473 4.486 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)C[C@H](C)C2CCCCC2)[nH+]c1C ZINC001558350995 1058862332 /nfs/dbraw/zinc/86/23/32/1058862332.db2.gz DPEOOJCFCOMILT-SUMWQHHRSA-N 1 2 317.477 4.297 20 0 DIADLO Cc1nc(NCc2ccc(OC(C)C)cc2)c2c([nH+]1)CCCC2 ZINC001559060934 1058956852 /nfs/dbraw/zinc/95/68/52/1058956852.db2.gz KVKYSFRILXEBMG-UHFFFAOYSA-N 1 2 311.429 4.063 20 0 DIADLO CCc1cc(N[C@H](c2nc3ccccc3[nH]2)C(C)C)nc(CC)[nH+]1 ZINC001559093758 1058984093 /nfs/dbraw/zinc/98/40/93/1058984093.db2.gz OHTWNAQQJMABSF-SFHVURJKSA-N 1 2 323.444 4.287 20 0 DIADLO Cc1nc(N2CCC[C@H](C(C)(C)C)CC2)c2c([nH+]1)CCCC2 ZINC001559105939 1058991981 /nfs/dbraw/zinc/99/19/81/1058991981.db2.gz HXFOMQJAKCRVSQ-HNNXBMFYSA-N 1 2 301.478 4.316 20 0 DIADLO CCc1nc([C@@H](C)Nc2cc(C)[nH+]c(C3CCC3)n2)cs1 ZINC001559108221 1058994637 /nfs/dbraw/zinc/99/46/37/1058994637.db2.gz FIASZGNGYZLWKY-LLVKDONJSA-N 1 2 302.447 4.245 20 0 DIADLO CCc1cc(N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)nc(CC)[nH+]1 ZINC001559109440 1058994750 /nfs/dbraw/zinc/99/47/50/1058994750.db2.gz TWMFLYMKUZQQBJ-ZFWWWQNUSA-N 1 2 313.420 4.123 20 0 DIADLO CCc1cc(N[C@H]2CCCc3ccc(OC)cc32)nc(CC)[nH+]1 ZINC001559144712 1059033925 /nfs/dbraw/zinc/03/39/25/1059033925.db2.gz WLXRIJGRYCVTJK-KRWDZBQOSA-N 1 2 311.429 4.100 20 0 DIADLO Cc1ccccc1[C@@H]1C[C@@H](Nc2nc(C)[nH+]c3c2CCCC3)C1 ZINC001559179565 1059063358 /nfs/dbraw/zinc/06/33/58/1059063358.db2.gz XYYLSJFZOSOGCE-WKILWMFISA-N 1 2 307.441 4.330 20 0 DIADLO COc1ccccc1C[C@H](C)Nc1cc(C)[nH+]c(C2CCC2)n1 ZINC001559179809 1059063970 /nfs/dbraw/zinc/06/39/70/1059063970.db2.gz KHIDJRUAQVDNNH-ZDUSSCGKSA-N 1 2 311.429 4.104 20 0 DIADLO Cc1ccc([C@@H]2CCN(c3nc(C)[nH+]c4c3CCCC4)C2)c(C)c1 ZINC001559184036 1059068717 /nfs/dbraw/zinc/06/87/17/1059068717.db2.gz RUAJDYFRDUNJNL-QGZVFWFLSA-N 1 2 321.468 4.275 20 0 DIADLO CC(C)c1cc(NC[C@@]2(O)CCCC2(C)C)nc(C(C)C)[nH+]1 ZINC001559198860 1059079797 /nfs/dbraw/zinc/07/97/97/1059079797.db2.gz ZEOQUPYAPHEXCM-SFHVURJKSA-N 1 2 305.466 4.077 20 0 DIADLO CCc1cc(N(C)[C@@H](CC)c2ccccc2OC)nc(CC)[nH+]1 ZINC001559203909 1059084246 /nfs/dbraw/zinc/08/42/46/1059084246.db2.gz LCGSMFIUVAGEPQ-INIZCTEOSA-N 1 2 313.445 4.198 20 0 DIADLO Cc1cc(N[C@H](C)CCCc2cccnc2)nc(C2CCC2)[nH+]1 ZINC001559209330 1059088524 /nfs/dbraw/zinc/08/85/24/1059088524.db2.gz WMKHMPGUPAKGGB-CQSZACIVSA-N 1 2 310.445 4.271 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3cccc(C(C)(F)F)c3)ccn12 ZINC001522494768 1059104944 /nfs/dbraw/zinc/10/49/44/1059104944.db2.gz VJVNEYJFRUOLLS-UHFFFAOYSA-N 1 2 315.323 4.007 20 0 DIADLO Cc1nc(NCC(F)(F)c2cccc(F)c2)c2c([nH+]1)CCCC2 ZINC001559230430 1059106487 /nfs/dbraw/zinc/10/64/87/1059106487.db2.gz CEUOIXKZUQCZHM-UHFFFAOYSA-N 1 2 321.346 4.007 20 0 DIADLO CC(C)c1cc(N[C@H]2Cc3ccccc3N(C)C2)nc(C(C)C)[nH+]1 ZINC001559257988 1059126903 /nfs/dbraw/zinc/12/69/03/1059126903.db2.gz MZDWVVWTVMPXOX-INIZCTEOSA-N 1 2 324.472 4.196 20 0 DIADLO CC[C@@H](Nc1cc(C)[nH+]c(C2CC2)n1)c1cc(F)ccc1OC ZINC001559284118 1059141093 /nfs/dbraw/zinc/14/10/93/1059141093.db2.gz OHTXNXPZJWKFRN-OAHLLOKOSA-N 1 2 315.392 4.373 20 0 DIADLO Cc1cc(N)nc(SCc2cc(Cl)sc2Cl)[nH+]1 ZINC001559342901 1059174131 /nfs/dbraw/zinc/17/41/31/1059174131.db2.gz XKEDAEWYOUXJHN-UHFFFAOYSA-N 1 2 306.243 4.028 20 0 DIADLO CCCSc1ccc2nc([C@@H]3Cc4ccccc4C[NH2+]3)[nH]c2c1 ZINC001247021609 1059251322 /nfs/dbraw/zinc/25/13/22/1059251322.db2.gz WZGDYUJSICIYIE-SFHVURJKSA-N 1 2 323.465 4.452 20 0 DIADLO CCc1nnc(C[N@@H+]2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)[nH]1 ZINC001559487160 1059260952 /nfs/dbraw/zinc/26/09/52/1059260952.db2.gz UAQDAOYNKLLLPN-MRXNPFEDSA-N 1 2 312.461 4.002 20 0 DIADLO CCc1nnc(C[N@H+]2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)[nH]1 ZINC001559487160 1059260974 /nfs/dbraw/zinc/26/09/74/1059260974.db2.gz UAQDAOYNKLLLPN-MRXNPFEDSA-N 1 2 312.461 4.002 20 0 DIADLO Cc1ccc(-c2ccccc2)c(-c2noc(Cc3c[nH]c[nH+]3)n2)c1 ZINC001247138236 1059310554 /nfs/dbraw/zinc/31/05/54/1059310554.db2.gz RQKMVKYONKEGNN-UHFFFAOYSA-N 1 2 316.364 4.026 20 0 DIADLO CCOC(=O)C[N@H+](C)[C@H](C)c1ccc(Oc2ccccc2)cc1 ZINC001559519059 1059316209 /nfs/dbraw/zinc/31/62/09/1059316209.db2.gz QQRHYTJZLFRUTH-OAHLLOKOSA-N 1 2 313.397 4.035 20 0 DIADLO CCOC(=O)C[N@@H+](C)[C@H](C)c1ccc(Oc2ccccc2)cc1 ZINC001559519059 1059316233 /nfs/dbraw/zinc/31/62/33/1059316233.db2.gz QQRHYTJZLFRUTH-OAHLLOKOSA-N 1 2 313.397 4.035 20 0 DIADLO CC[C@@H]1C[N@H+]([C@H](C)c2cccc(Br)c2)C[C@H](C)O1 ZINC001559544792 1059351223 /nfs/dbraw/zinc/35/12/23/1059351223.db2.gz HMVNQVMUZURIAP-YWPYICTPSA-N 1 2 312.251 4.009 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@H](C)c2cccc(Br)c2)C[C@H](C)O1 ZINC001559544792 1059351205 /nfs/dbraw/zinc/35/12/05/1059351205.db2.gz HMVNQVMUZURIAP-YWPYICTPSA-N 1 2 312.251 4.009 20 0 DIADLO CCCCc1ccc(-c2noc([C@@H]3CCCc4[nH]c[nH+]c43)n2)cc1 ZINC001247272755 1059363668 /nfs/dbraw/zinc/36/36/68/1059363668.db2.gz NUFZVMFWXJMGCL-OAHLLOKOSA-N 1 2 322.412 4.271 20 0 DIADLO C[C@H]1CC[C@H](c2nc(-c3ccccc3-n3cc[nH+]c3)no2)CC1 ZINC001247359090 1059397528 /nfs/dbraw/zinc/39/75/28/1059397528.db2.gz VDGZWFURPIMOGD-HDJSIYSDSA-N 1 2 308.385 4.216 20 0 DIADLO COc1cc(C)[nH+]c(CN2CC[C@H](C)C[C@H]2c2ccc(C)o2)c1 ZINC001559569552 1059403169 /nfs/dbraw/zinc/40/31/69/1059403169.db2.gz BFIPYMHWNJVSAV-UGSOOPFHSA-N 1 2 314.429 4.273 20 0 DIADLO CCc1cnc(C[N@@H+](C)C[C@@H]2CCC3(CCCCCC3)O2)s1 ZINC001559578488 1059411878 /nfs/dbraw/zinc/41/18/78/1059411878.db2.gz YDZXRUCFTKUCIA-HNNXBMFYSA-N 1 2 322.518 4.409 20 0 DIADLO CCc1cnc(C[N@H+](C)C[C@@H]2CCC3(CCCCCC3)O2)s1 ZINC001559578488 1059411868 /nfs/dbraw/zinc/41/18/68/1059411868.db2.gz YDZXRUCFTKUCIA-HNNXBMFYSA-N 1 2 322.518 4.409 20 0 DIADLO CC1(C)CO[C@@H](C[N@@H+]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001559590283 1059425791 /nfs/dbraw/zinc/42/57/91/1059425791.db2.gz JVNTZDOUYKFRPZ-CYBMUJFWSA-N 1 2 314.256 4.167 20 0 DIADLO CC1(C)CO[C@@H](C[N@H+]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001559590283 1059425796 /nfs/dbraw/zinc/42/57/96/1059425796.db2.gz JVNTZDOUYKFRPZ-CYBMUJFWSA-N 1 2 314.256 4.167 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC001559603284 1059436553 /nfs/dbraw/zinc/43/65/53/1059436553.db2.gz QCVVCWCIEQTYJO-OLZOCXBDSA-N 1 2 309.837 4.207 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC001559603284 1059436566 /nfs/dbraw/zinc/43/65/66/1059436566.db2.gz QCVVCWCIEQTYJO-OLZOCXBDSA-N 1 2 309.837 4.207 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@H+]1Cc1ccccc1OC(F)F ZINC001559623457 1059453495 /nfs/dbraw/zinc/45/34/95/1059453495.db2.gz WKFSCGCGADJWFH-ZDUSSCGKSA-N 1 2 319.351 4.244 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1ccccc1OC(F)F ZINC001559623457 1059453502 /nfs/dbraw/zinc/45/35/02/1059453502.db2.gz WKFSCGCGADJWFH-ZDUSSCGKSA-N 1 2 319.351 4.244 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1sccc1C(F)F ZINC001524207273 1059467490 /nfs/dbraw/zinc/46/74/90/1059467490.db2.gz JQHAWIZLEWGEKY-UHFFFAOYSA-N 1 2 319.336 4.124 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@@H](CC(C)C)C1 ZINC001559649346 1059475157 /nfs/dbraw/zinc/47/51/57/1059475157.db2.gz DOLSWWDYLVHWNM-YOEHRIQHSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@@H](CC(C)C)C1 ZINC001559649346 1059475167 /nfs/dbraw/zinc/47/51/67/1059475167.db2.gz DOLSWWDYLVHWNM-YOEHRIQHSA-N 1 2 323.864 4.312 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1ccnc(Cl)c1 ZINC001559658820 1059490589 /nfs/dbraw/zinc/49/05/89/1059490589.db2.gz SKVBENBWFCDCQM-NEPJUHHUSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1ccnc(Cl)c1 ZINC001559658820 1059490599 /nfs/dbraw/zinc/49/05/99/1059490599.db2.gz SKVBENBWFCDCQM-NEPJUHHUSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1COCCC[N@@H+]1Cc1nc2c(s1)C(C)(C)CC(C)(C)C2 ZINC001559662994 1059492096 /nfs/dbraw/zinc/49/20/96/1059492096.db2.gz PGHKMYSILJJOLP-CYBMUJFWSA-N 1 2 322.518 4.004 20 0 DIADLO C[C@@H]1COCCC[N@H+]1Cc1nc2c(s1)C(C)(C)CC(C)(C)C2 ZINC001559662994 1059492115 /nfs/dbraw/zinc/49/21/15/1059492115.db2.gz PGHKMYSILJJOLP-CYBMUJFWSA-N 1 2 322.518 4.004 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCc2c(F)cc(F)cc2C1 ZINC001559667601 1059495947 /nfs/dbraw/zinc/49/59/47/1059495947.db2.gz AFIZKSXZZFWIDD-UHFFFAOYSA-N 1 2 316.395 4.350 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCc2c(F)cc(F)cc2C1 ZINC001559667601 1059495955 /nfs/dbraw/zinc/49/59/55/1059495955.db2.gz AFIZKSXZZFWIDD-UHFFFAOYSA-N 1 2 316.395 4.350 20 0 DIADLO Fc1cccc(F)c1C[N@@H+]1CC[C@@H](Oc2ccccc2Cl)C1 ZINC001559670804 1059496412 /nfs/dbraw/zinc/49/64/12/1059496412.db2.gz UMHHYMFFFLJHIW-GFCCVEGCSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1cccc(F)c1C[N@H+]1CC[C@@H](Oc2ccccc2Cl)C1 ZINC001559670804 1059496420 /nfs/dbraw/zinc/49/64/20/1059496420.db2.gz UMHHYMFFFLJHIW-GFCCVEGCSA-N 1 2 323.770 4.272 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1C[C@H](C)CC(C)(C)C1 ZINC001559675255 1059503457 /nfs/dbraw/zinc/50/34/57/1059503457.db2.gz DOWZLANODGRSCA-CJNGLKHVSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1C[C@H](C)CC(C)(C)C1 ZINC001559675255 1059503480 /nfs/dbraw/zinc/50/34/80/1059503480.db2.gz DOWZLANODGRSCA-CJNGLKHVSA-N 1 2 323.864 4.312 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(C2CC2)n1)c1ccccc1OC(F)F ZINC001559697336 1059524796 /nfs/dbraw/zinc/52/47/96/1059524796.db2.gz AELQJHPNYZUIGU-SNVBAGLBSA-N 1 2 324.396 4.473 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1ccc(-c2ncco2)cc1F ZINC001559722462 1059549714 /nfs/dbraw/zinc/54/97/14/1059549714.db2.gz SOAXJUIMMLTHFT-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccc(-c2ncco2)cc1F ZINC001559722462 1059549730 /nfs/dbraw/zinc/54/97/30/1059549730.db2.gz SOAXJUIMMLTHFT-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO CCC(C)(C)c1ccccc1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001524628261 1059558158 /nfs/dbraw/zinc/55/81/58/1059558158.db2.gz FLTXQPGZDJJJJQ-UHFFFAOYSA-N 1 2 307.397 4.274 20 0 DIADLO O=C(Oc1ccc2ccccc2c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC001524683094 1059577392 /nfs/dbraw/zinc/57/73/92/1059577392.db2.gz LFCCXFZDFWOJLF-UHFFFAOYSA-N 1 2 314.344 4.245 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@H]1CC[C@H](C2CCC2)CC1 ZINC001532357841 1059603726 /nfs/dbraw/zinc/60/37/26/1059603726.db2.gz IUUNUKCVRJTLSE-QAQDUYKDSA-N 1 2 323.440 4.417 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)C1CCC(C2CC2)CC1 ZINC001532357520 1059603779 /nfs/dbraw/zinc/60/37/79/1059603779.db2.gz FSZXAQMIJHCCAI-UHFFFAOYSA-N 1 2 309.413 4.027 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)cc1 ZINC001559768353 1059604835 /nfs/dbraw/zinc/60/48/35/1059604835.db2.gz FKCNPIHCBWZONQ-LJQANCHMSA-N 1 2 317.379 4.101 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)cc1 ZINC001559768353 1059604843 /nfs/dbraw/zinc/60/48/43/1059604843.db2.gz FKCNPIHCBWZONQ-LJQANCHMSA-N 1 2 317.379 4.101 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1cccc(C)c1Br ZINC001559862379 1059682609 /nfs/dbraw/zinc/68/26/09/1059682609.db2.gz NXWZBLSGJRERAC-UHFFFAOYSA-N 1 2 308.219 4.291 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1cccc(C)c1Br ZINC001559862379 1059682604 /nfs/dbraw/zinc/68/26/04/1059682604.db2.gz NXWZBLSGJRERAC-UHFFFAOYSA-N 1 2 308.219 4.291 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](Cc1cnns1)Cc1ccccc1 ZINC001559863389 1059686926 /nfs/dbraw/zinc/68/69/26/1059686926.db2.gz YZTALHUEFZBXOR-OAHLLOKOSA-N 1 2 309.438 4.302 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](Cc1cnns1)Cc1ccccc1 ZINC001559863389 1059686932 /nfs/dbraw/zinc/68/69/32/1059686932.db2.gz YZTALHUEFZBXOR-OAHLLOKOSA-N 1 2 309.438 4.302 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001559876359 1059696583 /nfs/dbraw/zinc/69/65/83/1059696583.db2.gz TYLAIRXMHDUURM-OLZOCXBDSA-N 1 2 303.352 4.309 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001559876359 1059696589 /nfs/dbraw/zinc/69/65/89/1059696589.db2.gz TYLAIRXMHDUURM-OLZOCXBDSA-N 1 2 303.352 4.309 20 0 DIADLO CCCc1ccc(C[N@H+]([C@H](C)C(=O)OC(C)(C)C)C2CC2)cc1 ZINC001559901226 1059716848 /nfs/dbraw/zinc/71/68/48/1059716848.db2.gz MWNXYPPEAJZPCJ-OAHLLOKOSA-N 1 2 317.473 4.334 20 0 DIADLO CCCc1ccc(C[N@@H+]([C@H](C)C(=O)OC(C)(C)C)C2CC2)cc1 ZINC001559901226 1059716865 /nfs/dbraw/zinc/71/68/65/1059716865.db2.gz MWNXYPPEAJZPCJ-OAHLLOKOSA-N 1 2 317.473 4.334 20 0 DIADLO CC[N@H+](Cc1c(F)c(F)c(F)c(F)c1F)C1CC(C)(C)C1 ZINC001559905022 1059719278 /nfs/dbraw/zinc/71/92/78/1059719278.db2.gz OXIOXPXBDNYPSF-UHFFFAOYSA-N 1 2 307.306 4.393 20 0 DIADLO CC[N@@H+](Cc1c(F)c(F)c(F)c(F)c1F)C1CC(C)(C)C1 ZINC001559905022 1059719294 /nfs/dbraw/zinc/71/92/94/1059719294.db2.gz OXIOXPXBDNYPSF-UHFFFAOYSA-N 1 2 307.306 4.393 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1csc(Br)c1)C2 ZINC001559925652 1059740314 /nfs/dbraw/zinc/74/03/14/1059740314.db2.gz YUSJNWZCCNVPHM-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1csc(Br)c1)C2 ZINC001559925652 1059740331 /nfs/dbraw/zinc/74/03/31/1059740331.db2.gz YUSJNWZCCNVPHM-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2nccc(Cl)c2Cl)CC1 ZINC001559937606 1059745892 /nfs/dbraw/zinc/74/58/92/1059745892.db2.gz HSQMYEVODSVFLT-UHFFFAOYSA-N 1 2 307.224 4.476 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CCc2ccc(Cl)cc2[C@H](C)C1 ZINC001559966404 1059771873 /nfs/dbraw/zinc/77/18/73/1059771873.db2.gz ZFQLKMGFABOEOT-KGLIPLIRSA-N 1 2 323.864 4.033 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CCc2ccc(Cl)cc2[C@H](C)C1 ZINC001559966404 1059771891 /nfs/dbraw/zinc/77/18/91/1059771891.db2.gz ZFQLKMGFABOEOT-KGLIPLIRSA-N 1 2 323.864 4.033 20 0 DIADLO C[C@H]1C[N@H+](CCc2c(Cl)cccc2Cl)C2(CCC2)CO1 ZINC001559967938 1059775657 /nfs/dbraw/zinc/77/56/57/1059775657.db2.gz OWWRJIMGHRDSSO-LBPRGKRZSA-N 1 2 314.256 4.179 20 0 DIADLO C[C@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)C2(CCC2)CO1 ZINC001559967938 1059775672 /nfs/dbraw/zinc/77/56/72/1059775672.db2.gz OWWRJIMGHRDSSO-LBPRGKRZSA-N 1 2 314.256 4.179 20 0 DIADLO CCCCc1ccc(-c2noc(C[NH2+]Cc3ccccc3)n2)cc1 ZINC001248301490 1059778098 /nfs/dbraw/zinc/77/80/98/1059778098.db2.gz CHCCNFOBEGBNPF-UHFFFAOYSA-N 1 2 321.424 4.369 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2Cc3ccccc3NC(=O)[C@@H]2C)cc1 ZINC001559989753 1059798103 /nfs/dbraw/zinc/79/81/03/1059798103.db2.gz XEWDBRXMOIJCNT-INIZCTEOSA-N 1 2 322.452 4.228 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2Cc3ccccc3NC(=O)[C@@H]2C)cc1 ZINC001559989753 1059798125 /nfs/dbraw/zinc/79/81/25/1059798125.db2.gz XEWDBRXMOIJCNT-INIZCTEOSA-N 1 2 322.452 4.228 20 0 DIADLO Fc1cccc([C@H]2COCC[N@@H+]2CCSC2CCCCC2)c1 ZINC001560002239 1059808121 /nfs/dbraw/zinc/80/81/21/1059808121.db2.gz JRRRBZMYEJWWRV-GOSISDBHSA-N 1 2 323.477 4.265 20 0 DIADLO Fc1cccc([C@H]2COCC[N@H+]2CCSC2CCCCC2)c1 ZINC001560002239 1059808145 /nfs/dbraw/zinc/80/81/45/1059808145.db2.gz JRRRBZMYEJWWRV-GOSISDBHSA-N 1 2 323.477 4.265 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC001560012567 1059818489 /nfs/dbraw/zinc/81/84/89/1059818489.db2.gz YQKRJXQLSNJSQT-PBHICJAKSA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@H+]1CCC[C@@H](C2CCC2)C1 ZINC001560012567 1059818515 /nfs/dbraw/zinc/81/85/15/1059818515.db2.gz YQKRJXQLSNJSQT-PBHICJAKSA-N 1 2 321.848 4.066 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2cccc(Cl)c2Cl)c(C)[nH+]1 ZINC001533168297 1059818665 /nfs/dbraw/zinc/81/86/65/1059818665.db2.gz OPQVQOAKRLPUAU-UHFFFAOYSA-N 1 2 323.223 4.244 20 0 DIADLO C[C@H](CC(=O)Nc1ccccc1Cc1ccccc1)n1cc[nH+]c1 ZINC001525312817 1059829239 /nfs/dbraw/zinc/82/92/39/1059829239.db2.gz SRSDYQMNSJWKLG-MRXNPFEDSA-N 1 2 319.408 4.064 20 0 DIADLO Cc1cccc2[nH]c(Nc3ccccc3C[NH+]3CCOCC3)cc21 ZINC001248437185 1059832783 /nfs/dbraw/zinc/83/27/83/1059832783.db2.gz DSTDIVWQPRIDNB-UHFFFAOYSA-N 1 2 321.424 4.052 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@H+](Cc2cccc(Cl)n2)C1 ZINC001560081927 1059893086 /nfs/dbraw/zinc/89/30/86/1059893086.db2.gz QBCJEDQEUIUWCG-KRWDZBQOSA-N 1 2 304.796 4.196 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@@H+](Cc2cccc(Cl)n2)C1 ZINC001560081927 1059893104 /nfs/dbraw/zinc/89/31/04/1059893104.db2.gz QBCJEDQEUIUWCG-KRWDZBQOSA-N 1 2 304.796 4.196 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1nccc(Cl)c1Cl ZINC001560085569 1059899812 /nfs/dbraw/zinc/89/98/12/1059899812.db2.gz FBTHNMZBINOILD-SNVBAGLBSA-N 1 2 311.212 4.248 20 0 DIADLO C[C@@]1(C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C=CCC1 ZINC001525473872 1059906222 /nfs/dbraw/zinc/90/62/22/1059906222.db2.gz AJLTZIQSRRUINF-HXUWFJFHSA-N 1 2 321.424 4.181 20 0 DIADLO Cc1cccc(Br)c1C[N@@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001248603293 1059909192 /nfs/dbraw/zinc/90/91/92/1059909192.db2.gz GUHADJPOQQSDLY-UONOGXRCSA-N 1 2 318.205 4.030 20 0 DIADLO Cc1cccc(Br)c1C[N@H+]1CC[C@@](C)(F)[C@@H](F)C1 ZINC001248603293 1059909212 /nfs/dbraw/zinc/90/92/12/1059909212.db2.gz GUHADJPOQQSDLY-UONOGXRCSA-N 1 2 318.205 4.030 20 0 DIADLO CC(C)(C)[C@H]1CSCC[N@@H+]1Cc1c(Cl)cncc1Cl ZINC001560101296 1059913153 /nfs/dbraw/zinc/91/31/53/1059913153.db2.gz IDKORQSZXOVFII-CYBMUJFWSA-N 1 2 319.301 4.352 20 0 DIADLO CC(C)(C)[C@H]1CSCC[N@H+]1Cc1c(Cl)cncc1Cl ZINC001560101296 1059913171 /nfs/dbraw/zinc/91/31/71/1059913171.db2.gz IDKORQSZXOVFII-CYBMUJFWSA-N 1 2 319.301 4.352 20 0 DIADLO COc1c(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)ccc(Cl)c1Cl ZINC001248628056 1059917659 /nfs/dbraw/zinc/91/76/59/1059917659.db2.gz KMOOHDDTLSDSOL-VIFPVBQESA-N 1 2 324.198 4.479 20 0 DIADLO COc1c(C[N@H+]2CCC(F)(F)[C@@H](C)C2)ccc(Cl)c1Cl ZINC001248628056 1059917673 /nfs/dbraw/zinc/91/76/73/1059917673.db2.gz KMOOHDDTLSDSOL-VIFPVBQESA-N 1 2 324.198 4.479 20 0 DIADLO COC[C@@H]1CCCC[N@@H+]1Cc1ccc(Cl)c(Cl)c1OC ZINC001248628535 1059918275 /nfs/dbraw/zinc/91/82/75/1059918275.db2.gz QAWGBEZFOKZNNM-LBPRGKRZSA-N 1 2 318.244 4.003 20 0 DIADLO COC[C@@H]1CCCC[N@H+]1Cc1ccc(Cl)c(Cl)c1OC ZINC001248628535 1059918294 /nfs/dbraw/zinc/91/82/94/1059918294.db2.gz QAWGBEZFOKZNNM-LBPRGKRZSA-N 1 2 318.244 4.003 20 0 DIADLO CC(=O)C[N@@H+](C)Cc1ccccc1Oc1cc(Cl)ccc1C ZINC001560112257 1059919690 /nfs/dbraw/zinc/91/96/90/1059919690.db2.gz XQCRGTFHJYXYSO-UHFFFAOYSA-N 1 2 317.816 4.462 20 0 DIADLO CC(=O)C[N@H+](C)Cc1ccccc1Oc1cc(Cl)ccc1C ZINC001560112257 1059919695 /nfs/dbraw/zinc/91/96/95/1059919695.db2.gz XQCRGTFHJYXYSO-UHFFFAOYSA-N 1 2 317.816 4.462 20 0 DIADLO CCO[C@@H]1CCC[N@H+](Cc2ccc(Cl)c(Cl)c2OC)C1 ZINC001248637282 1059921145 /nfs/dbraw/zinc/92/11/45/1059921145.db2.gz KVFJWTZXMGHXML-GFCCVEGCSA-N 1 2 318.244 4.003 20 0 DIADLO CCO[C@@H]1CCC[N@@H+](Cc2ccc(Cl)c(Cl)c2OC)C1 ZINC001248637282 1059921154 /nfs/dbraw/zinc/92/11/54/1059921154.db2.gz KVFJWTZXMGHXML-GFCCVEGCSA-N 1 2 318.244 4.003 20 0 DIADLO C[N@H+](CC(F)(F)C(F)F)C1(Cc2ccccc2)CCCC1 ZINC001560123152 1059924481 /nfs/dbraw/zinc/92/44/81/1059924481.db2.gz PZPZMZNKKCPOTA-UHFFFAOYSA-N 1 2 303.343 4.374 20 0 DIADLO C[N@@H+](CC(F)(F)C(F)F)C1(Cc2ccccc2)CCCC1 ZINC001560123152 1059924499 /nfs/dbraw/zinc/92/44/99/1059924499.db2.gz PZPZMZNKKCPOTA-UHFFFAOYSA-N 1 2 303.343 4.374 20 0 DIADLO Fc1c(Br)ccc(C[N@@H+]2CCCC23CCC3)c1F ZINC001560164481 1059956015 /nfs/dbraw/zinc/95/60/15/1059956015.db2.gz YUDBZSUUPHRPCZ-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1c(Br)ccc(C[N@H+]2CCCC23CCC3)c1F ZINC001560164481 1059956033 /nfs/dbraw/zinc/95/60/33/1059956033.db2.gz YUDBZSUUPHRPCZ-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO CCc1cccc(C)c1NC(=S)Nc1ccn2cc[nH+]c2c1 ZINC001248735451 1059959975 /nfs/dbraw/zinc/95/99/75/1059959975.db2.gz QYSKWGLCTLDARJ-UHFFFAOYSA-N 1 2 310.426 4.014 20 0 DIADLO CCC(CC)C[N@H+](CC)Cn1nc(NC(C)C)sc1=S ZINC001248746960 1059961955 /nfs/dbraw/zinc/96/19/55/1059961955.db2.gz MIHFXHSZWRLAKD-UHFFFAOYSA-N 1 2 316.540 4.210 20 0 DIADLO CCC(CC)C[N@@H+](CC)Cn1nc(NC(C)C)sc1=S ZINC001248746960 1059961981 /nfs/dbraw/zinc/96/19/81/1059961981.db2.gz MIHFXHSZWRLAKD-UHFFFAOYSA-N 1 2 316.540 4.210 20 0 DIADLO CC(C)(C)c1nnc(C[NH+]2CCC(CC3CCCCC3)CC2)[nH]1 ZINC001560180365 1059968836 /nfs/dbraw/zinc/96/88/36/1059968836.db2.gz BMXRJAIJGBNYRE-UHFFFAOYSA-N 1 2 318.509 4.285 20 0 DIADLO CCc1nnc(C[NH+]2CCC(CC3CCCCC3)CC2)s1 ZINC001560181572 1059970577 /nfs/dbraw/zinc/97/05/77/1059970577.db2.gz WQBFLJNWDYVUCH-UHFFFAOYSA-N 1 2 307.507 4.283 20 0 DIADLO COc1nccc(Cl)c1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001248794425 1059983408 /nfs/dbraw/zinc/98/34/08/1059983408.db2.gz OCOQWUJCXRJXSR-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(Cl)c1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001248794425 1059983425 /nfs/dbraw/zinc/98/34/25/1059983425.db2.gz OCOQWUJCXRJXSR-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO Oc1ccc2c(c1)CC[N@@H+](Cc1cnc3ccccc3c1Cl)C2 ZINC001248811444 1059992956 /nfs/dbraw/zinc/99/29/56/1059992956.db2.gz XTMRIIYDPPSMSK-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1ccc2c(c1)CC[N@H+](Cc1cnc3ccccc3c1Cl)C2 ZINC001248811444 1059992972 /nfs/dbraw/zinc/99/29/72/1059992972.db2.gz XTMRIIYDPPSMSK-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cnc2ccccc2c1Cl ZINC001248813310 1059994027 /nfs/dbraw/zinc/99/40/27/1059994027.db2.gz QXFBDTICXRNQNF-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cnc2ccccc2c1Cl ZINC001248813310 1059994050 /nfs/dbraw/zinc/99/40/50/1059994050.db2.gz QXFBDTICXRNQNF-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO Fc1ccc(C[N@@H+]2Cc3ccc(Cl)cc3C2)c2[nH]ccc21 ZINC001248818474 1059995910 /nfs/dbraw/zinc/99/59/10/1059995910.db2.gz NOHKNVAXRQPJAC-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO Fc1ccc(C[N@H+]2Cc3ccc(Cl)cc3C2)c2[nH]ccc21 ZINC001248818474 1059995933 /nfs/dbraw/zinc/99/59/33/1059995933.db2.gz NOHKNVAXRQPJAC-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO COc1ccc(C)cc1C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC001560246835 1060008052 /nfs/dbraw/zinc/00/80/52/1060008052.db2.gz RMAMJQLFDLDYGX-NRFANRHFSA-N 1 2 318.420 4.278 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)cc1C ZINC001533835791 1060035779 /nfs/dbraw/zinc/03/57/79/1060035779.db2.gz TXWYWRNRFYXNMS-UHFFFAOYSA-N 1 2 319.408 4.170 20 0 DIADLO Cc1ccc(C[NH2+][C@H](COCC(C)C)c2ccco2)c(F)c1 ZINC001560304876 1060093375 /nfs/dbraw/zinc/09/33/75/1060093375.db2.gz GJLJTNAHLHGCGS-QGZVFWFLSA-N 1 2 305.393 4.231 20 0 DIADLO CC[N@H+](Cc1ccc(C(F)(F)F)cc1)Cc1nc(C)cc(C)n1 ZINC001248982461 1060100645 /nfs/dbraw/zinc/10/06/45/1060100645.db2.gz DSBKXXIXHOQEPI-UHFFFAOYSA-N 1 2 323.362 4.134 20 0 DIADLO CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cc1nc(C)cc(C)n1 ZINC001248982461 1060100662 /nfs/dbraw/zinc/10/06/62/1060100662.db2.gz DSBKXXIXHOQEPI-UHFFFAOYSA-N 1 2 323.362 4.134 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c(Cl)nc1C ZINC001249020215 1060111892 /nfs/dbraw/zinc/11/18/92/1060111892.db2.gz UWNBTWVIMVVUAA-GFCCVEGCSA-N 1 2 306.759 4.126 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)c(Cl)nc1C ZINC001249020215 1060111911 /nfs/dbraw/zinc/11/19/11/1060111911.db2.gz UWNBTWVIMVVUAA-GFCCVEGCSA-N 1 2 306.759 4.126 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2sc(Cl)c3ccccc32)CCC1=O ZINC001249051306 1060130796 /nfs/dbraw/zinc/13/07/96/1060130796.db2.gz PLVYCQUVUFSHSB-LLVKDONJSA-N 1 2 307.846 4.356 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2sc(Cl)c3ccccc32)CCC1=O ZINC001249051306 1060130804 /nfs/dbraw/zinc/13/08/04/1060130804.db2.gz PLVYCQUVUFSHSB-LLVKDONJSA-N 1 2 307.846 4.356 20 0 DIADLO [NH3+][C@H](c1nc(-c2cccc(Cl)c2)no1)c1cccc(Cl)c1 ZINC001249067612 1060141957 /nfs/dbraw/zinc/14/19/57/1060141957.db2.gz OXAANZHPFDACDF-ZDUSSCGKSA-N 1 2 320.179 4.092 20 0 DIADLO CCOC(=O)[C@@H]1CCC[N@@H+]1Cc1sc(Cl)c2ccccc21 ZINC001249068019 1060143451 /nfs/dbraw/zinc/14/34/51/1060143451.db2.gz QVJRTDAWGISUMX-ZDUSSCGKSA-N 1 2 323.845 4.082 20 0 DIADLO CCOC(=O)[C@@H]1CCC[N@H+]1Cc1sc(Cl)c2ccccc21 ZINC001249068019 1060143462 /nfs/dbraw/zinc/14/34/62/1060143462.db2.gz QVJRTDAWGISUMX-ZDUSSCGKSA-N 1 2 323.845 4.082 20 0 DIADLO COc1cccc(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)c1 ZINC001560383459 1060169140 /nfs/dbraw/zinc/16/91/40/1060169140.db2.gz CLOJNMYKDVARNL-UHFFFAOYSA-N 1 2 313.788 4.146 20 0 DIADLO CC(C)(C)c1ccc(-c2noc([C@H]3[NH2+]Cc4ccccc43)n2)cc1 ZINC001249134031 1060169325 /nfs/dbraw/zinc/16/93/25/1060169325.db2.gz YGAHDENGJGTWAF-KRWDZBQOSA-N 1 2 319.408 4.227 20 0 DIADLO CN(C)c1ccc(NCc2cc(Cl)sc2Cl)[nH+]c1 ZINC001560382299 1060169284 /nfs/dbraw/zinc/16/92/84/1060169284.db2.gz RRNJKRNIXZYFGS-UHFFFAOYSA-N 1 2 302.230 4.128 20 0 DIADLO CN(C)c1ccc(NCc2ccc(-c3ccccc3F)o2)[nH+]c1 ZINC001560382360 1060169531 /nfs/dbraw/zinc/16/95/31/1060169531.db2.gz WUMFKJFZZJSFRS-UHFFFAOYSA-N 1 2 311.360 4.159 20 0 DIADLO CC(C)(C)c1ccc(-c2noc([C@@H]3[NH2+]Cc4ccccc43)n2)cc1 ZINC001249134033 1060170060 /nfs/dbraw/zinc/17/00/60/1060170060.db2.gz YGAHDENGJGTWAF-QGZVFWFLSA-N 1 2 319.408 4.227 20 0 DIADLO Fc1cc(NCc2cc3ccncc3s2)ccc1-n1cc[nH+]c1 ZINC001560387069 1060175237 /nfs/dbraw/zinc/17/52/37/1060175237.db2.gz UFRKXEHMOAVCRS-UHFFFAOYSA-N 1 2 324.384 4.233 20 0 DIADLO CCN(CC)c1ccc(NCc2ccc(CSC)cc2)c[nH+]1 ZINC001560407071 1060192762 /nfs/dbraw/zinc/19/27/62/1060192762.db2.gz DNSJISFPFKEBQF-UHFFFAOYSA-N 1 2 315.486 4.403 20 0 DIADLO CC[C@H](C)n1nc(NCc2cc(C)[nH+]c3c2CCCC3)cc1C ZINC001560415717 1060199438 /nfs/dbraw/zinc/19/94/38/1060199438.db2.gz YFDBCIZEXBUHQQ-AWEZNQCLSA-N 1 2 312.461 4.357 20 0 DIADLO Cc1cc(F)ccc1-c1noc([C@@H]2CC[N@@H+]2Cc2ccccc2)n1 ZINC001249256131 1060206091 /nfs/dbraw/zinc/20/60/91/1060206091.db2.gz OFTSXWZVIPAQEO-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cc(F)ccc1-c1noc([C@@H]2CC[N@H+]2Cc2ccccc2)n1 ZINC001249256131 1060206113 /nfs/dbraw/zinc/20/61/13/1060206113.db2.gz OFTSXWZVIPAQEO-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+]Cc2cccc(Oc3ccccc3)c2)[nH]1 ZINC001560426047 1060213191 /nfs/dbraw/zinc/21/31/91/1060213191.db2.gz NUMALPYJIVKNFP-CQSZACIVSA-N 1 2 322.412 4.010 20 0 DIADLO C[N@H+](C/C=C/c1ccccc1)Cc1csc(-c2ccncc2)n1 ZINC001249299424 1060213423 /nfs/dbraw/zinc/21/34/23/1060213423.db2.gz SFGBNLNKLRDZNB-VMPITWQZSA-N 1 2 321.449 4.350 20 0 DIADLO C[N@@H+](C/C=C/c1ccccc1)Cc1csc(-c2ccncc2)n1 ZINC001249299424 1060213443 /nfs/dbraw/zinc/21/34/43/1060213443.db2.gz SFGBNLNKLRDZNB-VMPITWQZSA-N 1 2 321.449 4.350 20 0 DIADLO F[C@H]1CCCC[N@H+](Cc2coc(-c3ccc(Cl)cc3)n2)C1 ZINC001249372415 1060228712 /nfs/dbraw/zinc/22/87/12/1060228712.db2.gz NUEACPRANJVKID-AWEZNQCLSA-N 1 2 308.784 4.319 20 0 DIADLO F[C@H]1CCCC[N@@H+](Cc2coc(-c3ccc(Cl)cc3)n2)C1 ZINC001249372415 1060228730 /nfs/dbraw/zinc/22/87/30/1060228730.db2.gz NUEACPRANJVKID-AWEZNQCLSA-N 1 2 308.784 4.319 20 0 DIADLO CC[N@H+](Cc1nc2ccc(OC)cc2[nH]1)Cc1ccc(C)c(C)c1 ZINC001249415456 1060240059 /nfs/dbraw/zinc/24/00/59/1060240059.db2.gz ZNRKJHWHPNAUBH-UHFFFAOYSA-N 1 2 323.440 4.210 20 0 DIADLO CC[N@@H+](Cc1nc2ccc(OC)cc2[nH]1)Cc1ccc(C)c(C)c1 ZINC001249415456 1060240078 /nfs/dbraw/zinc/24/00/78/1060240078.db2.gz ZNRKJHWHPNAUBH-UHFFFAOYSA-N 1 2 323.440 4.210 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccc2nc(C(F)F)sc2c1 ZINC001560463804 1060255640 /nfs/dbraw/zinc/25/56/40/1060255640.db2.gz GEVIXEGSJUSHLF-UHFFFAOYSA-N 1 2 322.384 4.453 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1cc(C(C)(C)C)c[nH]1 ZINC001249479531 1060263931 /nfs/dbraw/zinc/26/39/31/1060263931.db2.gz HIWRVEQAUMICAA-UHFFFAOYSA-N 1 2 312.457 4.406 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1cc(C(C)(C)C)c[nH]1 ZINC001249479531 1060263948 /nfs/dbraw/zinc/26/39/48/1060263948.db2.gz HIWRVEQAUMICAA-UHFFFAOYSA-N 1 2 312.457 4.406 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+]2CCCC[C@](C)(F)C2)cn1 ZINC001249512421 1060270709 /nfs/dbraw/zinc/27/07/09/1060270709.db2.gz OYDPVJMCJFPMGW-AWEZNQCLSA-N 1 2 304.331 4.123 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+]2CCCC[C@](C)(F)C2)cn1 ZINC001249512421 1060270728 /nfs/dbraw/zinc/27/07/28/1060270728.db2.gz OYDPVJMCJFPMGW-AWEZNQCLSA-N 1 2 304.331 4.123 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+]2CCc3ccsc3C2)cn1 ZINC001249514655 1060272415 /nfs/dbraw/zinc/27/24/15/1060272415.db2.gz TYWIWQMVCGYSNF-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+]2CCc3ccsc3C2)cn1 ZINC001249514655 1060272437 /nfs/dbraw/zinc/27/24/37/1060272437.db2.gz TYWIWQMVCGYSNF-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1[nH+]c(NC/C=C\c2ccc(F)cc2)ccc1-c1cnn(C)c1 ZINC001560482633 1060273502 /nfs/dbraw/zinc/27/35/02/1060273502.db2.gz XKCTVGJLTAOUKC-ARJAWSKDSA-N 1 2 322.387 4.055 20 0 DIADLO Cc1cc(C[NH+]2CCC(Oc3cccc(Cl)c3)CC2)ns1 ZINC001249581887 1060299574 /nfs/dbraw/zinc/29/95/74/1060299574.db2.gz PDXJVMBUVAOOCA-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1cc(C[NH+]2CCC(Oc3ccccc3Cl)CC2)ns1 ZINC001249582708 1060300399 /nfs/dbraw/zinc/30/03/99/1060300399.db2.gz WMZTURBBHSRUMZ-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO CC[N@H+](Cc1cc(C)sn1)Cc1cccc(C(F)(F)F)c1 ZINC001249590010 1060306955 /nfs/dbraw/zinc/30/69/55/1060306955.db2.gz DMGVSTZTPXUUKN-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CC[N@@H+](Cc1cc(C)sn1)Cc1cccc(C(F)(F)F)c1 ZINC001249590010 1060306975 /nfs/dbraw/zinc/30/69/75/1060306975.db2.gz DMGVSTZTPXUUKN-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CSc1cccc(Nc2ccc(NCc3ccon3)[nH+]c2)c1 ZINC001560526171 1060326315 /nfs/dbraw/zinc/32/63/15/1060326315.db2.gz FYJMGCPTJXTXJP-UHFFFAOYSA-N 1 2 312.398 4.147 20 0 DIADLO COc1ccc(C[NH2+][C@H](CCc2ccccc2)C(F)F)c(C)c1 ZINC001560534356 1060336588 /nfs/dbraw/zinc/33/65/88/1060336588.db2.gz XYAZTFHPYOZBOZ-GOSISDBHSA-N 1 2 319.395 4.360 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)c(C)[nH+]1 ZINC001526806570 1060343441 /nfs/dbraw/zinc/34/34/41/1060343441.db2.gz YOIFPVCPRBWLSC-MSOLQXFVSA-N 1 2 308.425 4.214 20 0 DIADLO c1nc(C2CC2)oc1CNc1ccc(Nc2ccccc2)c[nH+]1 ZINC001560539007 1060343380 /nfs/dbraw/zinc/34/33/80/1060343380.db2.gz LKMHWOHBKJODOX-UHFFFAOYSA-N 1 2 306.369 4.303 20 0 DIADLO CCCOc1ccc(C[NH2+]CC(F)(F)C(C)(C)C)cc1OC ZINC001560541997 1060348935 /nfs/dbraw/zinc/34/89/35/1060348935.db2.gz PTCSVFRAPDRMFD-UHFFFAOYSA-N 1 2 315.404 4.255 20 0 DIADLO Cc1cc(C)c(NC(=S)Nc2cccc3[nH+]ccn32)c(C)c1 ZINC001249719103 1060368069 /nfs/dbraw/zinc/36/80/69/1060368069.db2.gz QGARVTPSNSKWRR-UHFFFAOYSA-N 1 2 310.426 4.068 20 0 DIADLO CCCOc1ccc(CNc2c[nH+]c(C)c(C)c2)cc1OCC ZINC001560571179 1060384345 /nfs/dbraw/zinc/38/43/45/1060384345.db2.gz JKFRWLVYOYIZEG-UHFFFAOYSA-N 1 2 314.429 4.498 20 0 DIADLO Fc1ccc(/C=C/C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)c(F)c1 ZINC001560588473 1060401028 /nfs/dbraw/zinc/40/10/28/1060401028.db2.gz XSBAEJNAQVMDAS-NDIJEHHESA-N 1 2 319.326 4.039 20 0 DIADLO Cc1cc(C)c2cc(NCc3cccc4c3OCO4)ccc2[nH+]1 ZINC001560590108 1060402364 /nfs/dbraw/zinc/40/23/64/1060402364.db2.gz MPIZSPFQPRUEGJ-UHFFFAOYSA-N 1 2 306.365 4.192 20 0 DIADLO Cc1cc(C)c2cc(NCc3ccnn3C3CCC3)ccc2[nH+]1 ZINC001560589799 1060402906 /nfs/dbraw/zinc/40/29/06/1060402906.db2.gz BVWSDTZQAHZESO-UHFFFAOYSA-N 1 2 306.413 4.385 20 0 DIADLO COc1cc(C[N@@H+]2C[C@@H](C)CC23CC3)c(F)c(F)c1Cl ZINC001249803728 1060407276 /nfs/dbraw/zinc/40/72/76/1060407276.db2.gz HQTHBJSJZMKQQO-VIFPVBQESA-N 1 2 301.764 4.001 20 0 DIADLO COc1cc(C[N@H+]2C[C@@H](C)CC23CC3)c(F)c(F)c1Cl ZINC001249803728 1060407281 /nfs/dbraw/zinc/40/72/81/1060407281.db2.gz HQTHBJSJZMKQQO-VIFPVBQESA-N 1 2 301.764 4.001 20 0 DIADLO COc1cc(C[N@@H+]2CC3CCC2CC3)c(F)c(F)c1Cl ZINC001249801633 1060408228 /nfs/dbraw/zinc/40/82/28/1060408228.db2.gz MPBOQDAKCZEQSS-UHFFFAOYSA-N 1 2 301.764 4.001 20 0 DIADLO COc1cc(C[N@H+]2CC3CCC2CC3)c(F)c(F)c1Cl ZINC001249801633 1060408234 /nfs/dbraw/zinc/40/82/34/1060408234.db2.gz MPBOQDAKCZEQSS-UHFFFAOYSA-N 1 2 301.764 4.001 20 0 DIADLO Cc1cc(CNc2cccc(-c3cc[nH]n3)c2)c2c([nH+]1)CCCC2 ZINC001560602381 1060417241 /nfs/dbraw/zinc/41/72/41/1060417241.db2.gz OCFILIDWSXJAIW-UHFFFAOYSA-N 1 2 318.424 4.271 20 0 DIADLO Cc1cc(CNc2ccc3c(c2)C[C@@H](C)O3)c2c([nH+]1)CCCC2 ZINC001560604865 1060419482 /nfs/dbraw/zinc/41/94/82/1060419482.db2.gz MSNCISSFSGFJRS-CQSZACIVSA-N 1 2 308.425 4.204 20 0 DIADLO Cc1cccc2c(C(=O)Nc3cccc(-n4cc[nH+]c4)c3)coc21 ZINC001527041882 1060420029 /nfs/dbraw/zinc/42/00/29/1060420029.db2.gz HARPTBGOMJRUDL-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO Cc1c(F)cc(Br)c(C[NH+]2CCCCC2)c1F ZINC001249864092 1060432853 /nfs/dbraw/zinc/43/28/53/1060432853.db2.gz KDSZSIVBAIEJHR-UHFFFAOYSA-N 1 2 304.178 4.022 20 0 DIADLO CCC[N@@H+](C)Cc1c(F)ccc(SC)c1Br ZINC001249878449 1060439684 /nfs/dbraw/zinc/43/96/84/1060439684.db2.gz WZBKEYBRCNUUII-UHFFFAOYSA-N 1 2 306.244 4.152 20 0 DIADLO CCC[N@H+](C)Cc1c(F)ccc(SC)c1Br ZINC001249878449 1060439678 /nfs/dbraw/zinc/43/96/78/1060439678.db2.gz WZBKEYBRCNUUII-UHFFFAOYSA-N 1 2 306.244 4.152 20 0 DIADLO Cc1c(F)cc(Br)c(C[NH+]2C3CCC2CC3)c1F ZINC001249876735 1060440222 /nfs/dbraw/zinc/44/02/22/1060440222.db2.gz SJUNDBWLYRCEJX-UHFFFAOYSA-N 1 2 316.189 4.163 20 0 DIADLO COc1ccc2[nH]c(Nc3ccccc3-n3cc[nH+]c3)cc2c1 ZINC001249884106 1060444732 /nfs/dbraw/zinc/44/47/32/1060444732.db2.gz OZHGXHJBDSDMEL-UHFFFAOYSA-N 1 2 304.353 4.106 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1C[C@@H](C)C[C@@H]1c1ccccc1F ZINC001560641883 1060460201 /nfs/dbraw/zinc/46/02/01/1060460201.db2.gz DJWHICPERLECMO-SWLSCSKDSA-N 1 2 321.827 4.279 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1F ZINC001560641883 1060460210 /nfs/dbraw/zinc/46/02/10/1060460210.db2.gz DJWHICPERLECMO-SWLSCSKDSA-N 1 2 321.827 4.279 20 0 DIADLO CC(C)(C)C1CCC(=CC(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC001535108378 1060463869 /nfs/dbraw/zinc/46/38/69/1060463869.db2.gz RFTAFNBFQWGUEA-UHFFFAOYSA-N 1 2 311.429 4.436 20 0 DIADLO Cc1ccccc1C1(C(=O)Nc2ccn3cc[nH+]c3c2)CCCC1 ZINC001535115190 1060464009 /nfs/dbraw/zinc/46/40/09/1060464009.db2.gz FGAOXRRIWAIOPO-UHFFFAOYSA-N 1 2 319.408 4.093 20 0 DIADLO O=C(Cc1ccn2cc[nH+]c2c1)c1ccc(-c2ccccc2)cc1 ZINC001249907556 1060471487 /nfs/dbraw/zinc/47/14/87/1060471487.db2.gz LOMLZURXVWVPKB-UHFFFAOYSA-N 1 2 312.372 4.427 20 0 DIADLO CC(C)C[N@H+](Cc1cn(C2CC2)cn1)Cc1ccccc1F ZINC001560652091 1060473123 /nfs/dbraw/zinc/47/31/23/1060473123.db2.gz OCGVMIWNDMDOLX-UHFFFAOYSA-N 1 2 301.409 4.015 20 0 DIADLO CC(C)C[N@@H+](Cc1cn(C2CC2)cn1)Cc1ccccc1F ZINC001560652091 1060473128 /nfs/dbraw/zinc/47/31/28/1060473128.db2.gz OCGVMIWNDMDOLX-UHFFFAOYSA-N 1 2 301.409 4.015 20 0 DIADLO CNc1ccc(CC(=O)c2ccc(-c3ccccc3)cc2)c[nH+]1 ZINC001249908540 1060474436 /nfs/dbraw/zinc/47/44/36/1060474436.db2.gz WOZNTOAXQKJYAT-UHFFFAOYSA-N 1 2 302.377 4.216 20 0 DIADLO Cc1[nH]nc(C[N@@H+]2CCCCC[C@@H]2/C=C/c2ccccc2)c1C ZINC001560649055 1060475195 /nfs/dbraw/zinc/47/51/95/1060475195.db2.gz YZHXIVVIPPADDD-JXOMPUQVSA-N 1 2 309.457 4.485 20 0 DIADLO Cc1[nH]nc(C[N@H+]2CCCCC[C@@H]2/C=C/c2ccccc2)c1C ZINC001560649055 1060475199 /nfs/dbraw/zinc/47/51/99/1060475199.db2.gz YZHXIVVIPPADDD-JXOMPUQVSA-N 1 2 309.457 4.485 20 0 DIADLO COc1cc(C[N@@H+]2Cc3ccccc3C(C)(C)C2)cnc1Cl ZINC001249931301 1060489411 /nfs/dbraw/zinc/48/94/11/1060489411.db2.gz INZQTXGDRFXFMK-UHFFFAOYSA-N 1 2 316.832 4.037 20 0 DIADLO COc1cc(C[N@H+]2Cc3ccccc3C(C)(C)C2)cnc1Cl ZINC001249931301 1060489418 /nfs/dbraw/zinc/48/94/18/1060489418.db2.gz INZQTXGDRFXFMK-UHFFFAOYSA-N 1 2 316.832 4.037 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@@]2(C1)CCCCO2 ZINC001249934687 1060493615 /nfs/dbraw/zinc/49/36/15/1060493615.db2.gz XZTZKTFNFQJULG-OAHLLOKOSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@@]2(C1)CCCCO2 ZINC001249934687 1060493624 /nfs/dbraw/zinc/49/36/24/1060493624.db2.gz XZTZKTFNFQJULG-OAHLLOKOSA-N 1 2 318.219 4.278 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2F)[C@@H](C)C1 ZINC001249944391 1060496595 /nfs/dbraw/zinc/49/65/95/1060496595.db2.gz XPKMNUFQUXCGMI-CABZTGNLSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)[C@@H](C)C1 ZINC001249944391 1060496606 /nfs/dbraw/zinc/49/66/06/1060496606.db2.gz XPKMNUFQUXCGMI-CABZTGNLSA-N 1 2 306.208 4.132 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2c(Cl)ccnc2F)CC2CC2)cc1 ZINC001560673144 1060504473 /nfs/dbraw/zinc/50/44/73/1060504473.db2.gz GMVIGMLNKOGXHX-UHFFFAOYSA-N 1 2 322.786 4.425 20 0 DIADLO Fc1ccc(C[N@H+](Cc2c(Cl)ccnc2F)CC2CC2)cc1 ZINC001560673144 1060504494 /nfs/dbraw/zinc/50/44/94/1060504494.db2.gz GMVIGMLNKOGXHX-UHFFFAOYSA-N 1 2 322.786 4.425 20 0 DIADLO C[C@H]1[N@H+](CCCc2c(Cl)cccc2Cl)CCOC1(C)C ZINC001560687664 1060537745 /nfs/dbraw/zinc/53/77/45/1060537745.db2.gz NNVKYXZLHLMNHS-GFCCVEGCSA-N 1 2 316.272 4.425 20 0 DIADLO C[C@H]1[N@@H+](CCCc2c(Cl)cccc2Cl)CCOC1(C)C ZINC001560687664 1060537767 /nfs/dbraw/zinc/53/77/67/1060537767.db2.gz NNVKYXZLHLMNHS-GFCCVEGCSA-N 1 2 316.272 4.425 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1cccc(F)c1N ZINC001560693714 1060543904 /nfs/dbraw/zinc/54/39/04/1060543904.db2.gz FVTUXORCCPNMFS-LLVKDONJSA-N 1 2 315.417 4.211 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cccc(F)c1N ZINC001560693714 1060543922 /nfs/dbraw/zinc/54/39/22/1060543922.db2.gz FVTUXORCCPNMFS-LLVKDONJSA-N 1 2 315.417 4.211 20 0 DIADLO c1cn(-c2cccc(NC[C@@H]3CCc4ccccc4C3)c2)c[nH+]1 ZINC001560703782 1060560963 /nfs/dbraw/zinc/56/09/63/1060560963.db2.gz MQSJQCHEMQTORY-MRXNPFEDSA-N 1 2 303.409 4.089 20 0 DIADLO COc1ccc([C@@H](C)[C@H](C)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC001560703970 1060562504 /nfs/dbraw/zinc/56/25/04/1060562504.db2.gz UCHUGCCNTMQHIJ-HOTGVXAUSA-N 1 2 321.424 4.485 20 0 DIADLO CCn1ccc(C[N@H+](C)[C@H](c2ccccc2)c2ccc(F)cc2)n1 ZINC001560728559 1060592281 /nfs/dbraw/zinc/59/22/81/1060592281.db2.gz XFLNGNFYJDHFII-HXUWFJFHSA-N 1 2 323.415 4.264 20 0 DIADLO CCn1ccc(C[N@@H+](C)[C@H](c2ccccc2)c2ccc(F)cc2)n1 ZINC001560728559 1060592293 /nfs/dbraw/zinc/59/22/93/1060592293.db2.gz XFLNGNFYJDHFII-HXUWFJFHSA-N 1 2 323.415 4.264 20 0 DIADLO COc1cc(OC)c(Nc2cccn3cc(C)[nH+]c23)cc1Cl ZINC001250092989 1060602625 /nfs/dbraw/zinc/60/26/25/1060602625.db2.gz MWOFQJFPSQAIRD-UHFFFAOYSA-N 1 2 317.776 4.057 20 0 DIADLO COc1c(Cl)ccc(F)c1Nc1ccccc1-n1cc[nH+]c1 ZINC001250102840 1060611964 /nfs/dbraw/zinc/61/19/64/1060611964.db2.gz RVNUNQUTYRKSMF-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO Cc1cc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)cnc1F ZINC001560746597 1060614352 /nfs/dbraw/zinc/61/43/52/1060614352.db2.gz HPMNGSYZQQIWLI-UHFFFAOYSA-N 1 2 316.807 4.472 20 0 DIADLO Cc1cc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)cnc1F ZINC001560746597 1060614374 /nfs/dbraw/zinc/61/43/74/1060614374.db2.gz HPMNGSYZQQIWLI-UHFFFAOYSA-N 1 2 316.807 4.472 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@H+](C)C/C(C)=C\c1ccccc1 ZINC001560755294 1060620025 /nfs/dbraw/zinc/62/00/25/1060620025.db2.gz FGZFPXBRVZQCLO-RAXLEYEMSA-N 1 2 303.837 4.161 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@@H+](C)C/C(C)=C\c1ccccc1 ZINC001560755294 1060620039 /nfs/dbraw/zinc/62/00/39/1060620039.db2.gz FGZFPXBRVZQCLO-RAXLEYEMSA-N 1 2 303.837 4.161 20 0 DIADLO C/C(=C/c1ccccc1)C[N@@H+](C)Cc1ccc(O)c(F)c1F ZINC001560755740 1060622484 /nfs/dbraw/zinc/62/24/84/1060622484.db2.gz RKQGNRGMUTULKO-RAXLEYEMSA-N 1 2 303.352 4.206 20 0 DIADLO C/C(=C/c1ccccc1)C[N@H+](C)Cc1ccc(O)c(F)c1F ZINC001560755740 1060622493 /nfs/dbraw/zinc/62/24/93/1060622493.db2.gz RKQGNRGMUTULKO-RAXLEYEMSA-N 1 2 303.352 4.206 20 0 DIADLO CSc1ccc(F)c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001250120088 1060627526 /nfs/dbraw/zinc/62/75/26/1060627526.db2.gz XMFXABIYPCZWEJ-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@@H+]2CCC[C@@H](C(F)F)C2)c(F)c1 ZINC001250148374 1060644680 /nfs/dbraw/zinc/64/46/80/1060644680.db2.gz SMWADWFDNLOKPR-LLVKDONJSA-N 1 2 319.342 4.229 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@H+]2CCC[C@@H](C(F)F)C2)c(F)c1 ZINC001250148374 1060644691 /nfs/dbraw/zinc/64/46/91/1060644691.db2.gz SMWADWFDNLOKPR-LLVKDONJSA-N 1 2 319.342 4.229 20 0 DIADLO CCC[C@H](Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1)C1CCC1 ZINC001560798840 1060658766 /nfs/dbraw/zinc/65/87/66/1060658766.db2.gz QKKSJMFZJNRPAK-DAYGRLMNSA-N 1 2 317.477 4.076 20 0 DIADLO COc1cccc(OC)c1C[N@H+](C)Cc1ccccc1SC ZINC001560798372 1060659319 /nfs/dbraw/zinc/65/93/19/1060659319.db2.gz FOESSVVDPKQZCY-UHFFFAOYSA-N 1 2 317.454 4.058 20 0 DIADLO COc1cccc(OC)c1C[N@@H+](C)Cc1ccccc1SC ZINC001560798372 1060659329 /nfs/dbraw/zinc/65/93/29/1060659329.db2.gz FOESSVVDPKQZCY-UHFFFAOYSA-N 1 2 317.454 4.058 20 0 DIADLO CCCC(CCC)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001560799258 1060660118 /nfs/dbraw/zinc/66/01/18/1060660118.db2.gz ZOTLLZATLCKWNA-GJZGRUSLSA-N 1 2 305.466 4.076 20 0 DIADLO CCCC(CCC)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)[nH+]c1 ZINC001560799259 1060660850 /nfs/dbraw/zinc/66/08/50/1060660850.db2.gz ZOTLLZATLCKWNA-HUUCEWRRSA-N 1 2 305.466 4.076 20 0 DIADLO COc1c(F)c(Cl)ccc1Nc1[nH+]c2ccccc2n1C ZINC001250188597 1060665004 /nfs/dbraw/zinc/66/50/04/1060665004.db2.gz AGSPWHFYBDLSMZ-UHFFFAOYSA-N 1 2 305.740 4.118 20 0 DIADLO COc1c(F)c(Cl)ccc1Nc1cccc2[nH+]c(C)cn21 ZINC001250190256 1060668027 /nfs/dbraw/zinc/66/80/27/1060668027.db2.gz SVVZDDNYHKHQTA-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO CCNc1ccccc1C[N@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC001560815670 1060673678 /nfs/dbraw/zinc/67/36/78/1060673678.db2.gz JXTWKSXFGBURSG-UHFFFAOYSA-N 1 2 320.440 4.141 20 0 DIADLO CCNc1ccccc1C[N@@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC001560815670 1060673683 /nfs/dbraw/zinc/67/36/83/1060673683.db2.gz JXTWKSXFGBURSG-UHFFFAOYSA-N 1 2 320.440 4.141 20 0 DIADLO Cc1nc(Cc2ccc(N(C)Cc3ccccc3)[nH+]c2)cs1 ZINC001250196902 1060675620 /nfs/dbraw/zinc/67/56/20/1060675620.db2.gz PAVKZFXUMIDBCP-UHFFFAOYSA-N 1 2 309.438 4.074 20 0 DIADLO Fc1cc(C[NH+]2CC=CC2)cc(Cl)c1OCc1ccccc1 ZINC001250205747 1060684835 /nfs/dbraw/zinc/68/48/35/1060684835.db2.gz FYMIDLULCNZESN-UHFFFAOYSA-N 1 2 317.791 4.430 20 0 DIADLO Clc1ccc([C@@H]2CC[N@@H+]2Cc2cnn(C3CCC3)c2)cc1 ZINC001560827120 1060686240 /nfs/dbraw/zinc/68/62/40/1060686240.db2.gz HJQWWYCILNQXDA-KRWDZBQOSA-N 1 2 301.821 4.209 20 0 DIADLO Clc1ccc([C@@H]2CC[N@H+]2Cc2cnn(C3CCC3)c2)cc1 ZINC001560827120 1060686250 /nfs/dbraw/zinc/68/62/50/1060686250.db2.gz HJQWWYCILNQXDA-KRWDZBQOSA-N 1 2 301.821 4.209 20 0 DIADLO Fc1ccc(F)c(Cc2ccc(N3CCCCC3)[nH+]c2)c1F ZINC001250216878 1060696301 /nfs/dbraw/zinc/69/63/01/1060696301.db2.gz YGUJDYONNSIZNL-UHFFFAOYSA-N 1 2 306.331 4.080 20 0 DIADLO CCOc1c(F)cc(Nc2ccc(N(C)C)[nH+]c2)cc1Cl ZINC001250218107 1060696838 /nfs/dbraw/zinc/69/68/38/1060696838.db2.gz KZGCYZMOKLLXTK-UHFFFAOYSA-N 1 2 309.772 4.082 20 0 DIADLO CCOc1nccc(Nc2ccccc2-n2cc[nH+]c2)c1Cl ZINC001250248356 1060727198 /nfs/dbraw/zinc/72/71/98/1060727198.db2.gz ZZDWLIIHTZJWTC-UHFFFAOYSA-N 1 2 314.776 4.063 20 0 DIADLO CCCCO[C@@H]1C[C@H]([NH2+]CC(F)(F)c2ccccc2)C1(C)C ZINC001560871041 1060733251 /nfs/dbraw/zinc/73/32/51/1060733251.db2.gz WXEVNSCCZPIXHL-JKSUJKDBSA-N 1 2 311.416 4.352 20 0 DIADLO COc1ccc(F)c(Nc2ccc3c(c2)[nH+]cn3C)c1Cl ZINC001250308812 1060773470 /nfs/dbraw/zinc/77/34/70/1060773470.db2.gz OCPHRVBAHMUZEW-UHFFFAOYSA-N 1 2 305.740 4.118 20 0 DIADLO FC(F)(F)c1cc(CCn2cc[nH+]c2)cc(C(F)(F)F)c1 ZINC001250316149 1060776154 /nfs/dbraw/zinc/77/61/54/1060776154.db2.gz CBCCCRCJTUWLNO-UHFFFAOYSA-N 1 2 308.225 4.163 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+](C)[C@@H](C)CSc1ccccc1 ZINC001560919779 1060781651 /nfs/dbraw/zinc/78/16/51/1060781651.db2.gz MZTLOSYGSCSRKM-ZDUSSCGKSA-N 1 2 323.893 4.169 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+](C)[C@@H](C)CSc1ccccc1 ZINC001560919779 1060781662 /nfs/dbraw/zinc/78/16/62/1060781662.db2.gz MZTLOSYGSCSRKM-ZDUSSCGKSA-N 1 2 323.893 4.169 20 0 DIADLO CCOc1nccc(C[N@@H+]2CC[C@H]2c2ccccc2)c1Cl ZINC001250385841 1060792318 /nfs/dbraw/zinc/79/23/18/1060792318.db2.gz WEGPWAIBJZSTTI-HNNXBMFYSA-N 1 2 302.805 4.081 20 0 DIADLO CCOc1nccc(C[N@H+]2CC[C@H]2c2ccccc2)c1Cl ZINC001250385841 1060792331 /nfs/dbraw/zinc/79/23/31/1060792331.db2.gz WEGPWAIBJZSTTI-HNNXBMFYSA-N 1 2 302.805 4.081 20 0 DIADLO CCOc1nccc(C[N@H+](CC)Cc2cccc(F)c2)c1Cl ZINC001250385448 1060793225 /nfs/dbraw/zinc/79/32/25/1060793225.db2.gz NJABCKGZZKAORE-UHFFFAOYSA-N 1 2 322.811 4.295 20 0 DIADLO CCOc1nccc(C[N@@H+](CC)Cc2cccc(F)c2)c1Cl ZINC001250385448 1060793235 /nfs/dbraw/zinc/79/32/35/1060793235.db2.gz NJABCKGZZKAORE-UHFFFAOYSA-N 1 2 322.811 4.295 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cncc(Br)c2Cl)[C@H](C)C1 ZINC001250464719 1060822370 /nfs/dbraw/zinc/82/23/70/1060822370.db2.gz JALFIIZOJCQWJT-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cncc(Br)c2Cl)[C@H](C)C1 ZINC001250464719 1060822384 /nfs/dbraw/zinc/82/23/84/1060822384.db2.gz JALFIIZOJCQWJT-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO COC[C@H](CC(C)(C)C)[NH2+]CC(F)(F)c1cc(F)cc(F)c1 ZINC001560985228 1060848873 /nfs/dbraw/zinc/84/88/73/1060848873.db2.gz UUBLXQGXDHPQOK-AWEZNQCLSA-N 1 2 321.358 4.097 20 0 DIADLO COC(=O)c1oc(CNc2ccc3[nH+]c(C)cc(C)c3c2)cc1C ZINC001561007915 1060865374 /nfs/dbraw/zinc/86/53/74/1060865374.db2.gz KCDBKBVUJIDJQA-UHFFFAOYSA-N 1 2 324.380 4.152 20 0 DIADLO Clc1ccc([C@@H]2C[C@H]2c2[nH]c3cc4c(cc3[nH+]2)OCC4)cc1 ZINC001250537185 1060883561 /nfs/dbraw/zinc/88/35/61/1060883561.db2.gz HPNDIQOGRCCZLD-UONOGXRCSA-N 1 2 310.784 4.422 20 0 DIADLO Fc1ccc([C@H]2CC[N@@H+]2Cc2cc(Cl)cc3c2OCC3)cc1 ZINC001561035344 1060888374 /nfs/dbraw/zinc/88/83/74/1060888374.db2.gz UOWMTWUWBAGOTL-QGZVFWFLSA-N 1 2 317.791 4.361 20 0 DIADLO Fc1ccc([C@H]2CC[N@H+]2Cc2cc(Cl)cc3c2OCC3)cc1 ZINC001561035344 1060888383 /nfs/dbraw/zinc/88/83/83/1060888383.db2.gz UOWMTWUWBAGOTL-QGZVFWFLSA-N 1 2 317.791 4.361 20 0 DIADLO CCCOc1cc2[nH]c([C@@H]3CCCOC3)[nH+]c2cc1OCCC ZINC001250551605 1060890645 /nfs/dbraw/zinc/89/06/45/1060890645.db2.gz QKJHAKJMYLQPKB-CYBMUJFWSA-N 1 2 318.417 4.035 20 0 DIADLO COc1cc2[nH+]c(CCc3cccc(F)c3)[nH]c2cc1Cl ZINC001250554175 1060893488 /nfs/dbraw/zinc/89/34/88/1060893488.db2.gz VUAOBAWXPLKIEW-UHFFFAOYSA-N 1 2 304.752 4.149 20 0 DIADLO Cc1ccc(-c2cccc(Cl)c2C[NH+]2CCOCC2)cc1 ZINC001250563365 1060901424 /nfs/dbraw/zinc/90/14/24/1060901424.db2.gz OOOKOTJZBFYXRU-UHFFFAOYSA-N 1 2 301.817 4.148 20 0 DIADLO FC(F)(F)c1ccccc1Cc1[nH]c2cc3c(cc2[nH+]1)OCC3 ZINC001250606891 1060935496 /nfs/dbraw/zinc/93/54/96/1060935496.db2.gz JEPWXTRGVJJXRK-UHFFFAOYSA-N 1 2 318.298 4.107 20 0 DIADLO CCc1cccc(F)c1C[N@@H+]1CCC(C)=C(Br)C1 ZINC001462156295 1060980180 /nfs/dbraw/zinc/98/01/80/1060980180.db2.gz QGRRQZZZHAUMPL-UHFFFAOYSA-N 1 2 312.226 4.263 20 0 DIADLO CCc1cccc(F)c1C[N@H+]1CCC(C)=C(Br)C1 ZINC001462156295 1060980200 /nfs/dbraw/zinc/98/02/00/1060980200.db2.gz QGRRQZZZHAUMPL-UHFFFAOYSA-N 1 2 312.226 4.263 20 0 DIADLO Fc1cc2[nH]c(-c3cc4ccccc4[nH]3)nc2cc1-n1cc[nH+]c1 ZINC001250649360 1060992036 /nfs/dbraw/zinc/99/20/36/1060992036.db2.gz PVMPHVOGGSXYMT-UHFFFAOYSA-N 1 2 317.327 4.036 20 0 DIADLO C/C=C/C[C@H]([NH2+][C@H](C)[C@@H](C)c1ccc(Cl)cc1)C(=O)OCC ZINC001462194086 1061014670 /nfs/dbraw/zinc/01/46/70/1061014670.db2.gz WRNNYXPCVPTAOA-XCECCGRFSA-N 1 2 323.864 4.320 20 0 DIADLO COc1c(C)c[nH+]c(CN2CCCc3c(C)ccc(F)c32)c1C ZINC001473248800 1061023810 /nfs/dbraw/zinc/02/38/10/1061023810.db2.gz XRYNKYVXBBDBPT-UHFFFAOYSA-N 1 2 314.404 4.107 20 0 DIADLO COc1ccc(C[N@@H+]2CCOc3ccccc3[C@H]2C)cc1Cl ZINC001473249903 1061027031 /nfs/dbraw/zinc/02/70/31/1061027031.db2.gz XQLLEWQUSBQXRZ-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(C[N@H+]2CCOc3ccccc3[C@H]2C)cc1Cl ZINC001473249903 1061027050 /nfs/dbraw/zinc/02/70/50/1061027050.db2.gz XQLLEWQUSBQXRZ-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(C)[nH+]c(CN(c2ccc(F)cc2)C2CCCC2)c1 ZINC001473252283 1061028008 /nfs/dbraw/zinc/02/80/08/1061028008.db2.gz VQNRWWVUQFZBBL-UHFFFAOYSA-N 1 2 314.404 4.487 20 0 DIADLO CSc1ccc2nc(-c3ccc(-n4cc[nH+]c4C)cc3)[nH]c2c1 ZINC001250705477 1061030076 /nfs/dbraw/zinc/03/00/76/1061030076.db2.gz YFGAJBUFXREJEX-UHFFFAOYSA-N 1 2 320.421 4.446 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)nc1Cl ZINC001473256721 1061035409 /nfs/dbraw/zinc/03/54/09/1061035409.db2.gz RKSAVXWRNUMROS-SFHVURJKSA-N 1 2 323.827 4.318 20 0 DIADLO c1cc(N2CCCC2)cc2[nH+]c(-c3ccc4c(c3)CCCO4)[nH]c12 ZINC001250716583 1061038648 /nfs/dbraw/zinc/03/86/48/1061038648.db2.gz UJIHKSHPHLEYLO-UHFFFAOYSA-N 1 2 319.408 4.155 20 0 DIADLO CCCCc1ccc([C@H]([NH2+]Cc2cnsn2)C(C)C)cc1 ZINC001473292908 1061060879 /nfs/dbraw/zinc/06/08/79/1061060879.db2.gz UCAVKQHPSKMZQN-QGZVFWFLSA-N 1 2 303.475 4.368 20 0 DIADLO CCn1c2ccc(C)cc2nc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001250772142 1061062547 /nfs/dbraw/zinc/06/25/47/1061062547.db2.gz NYZPYMQZUWYWJK-UHFFFAOYSA-N 1 2 302.381 4.217 20 0 DIADLO Fc1cc2nc(-c3ccc(-n4cc[nH+]c4)cc3)[nH]c2cc1Cl ZINC001250772165 1061063478 /nfs/dbraw/zinc/06/34/78/1061063478.db2.gz PBZPGHDXULVYIX-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO CO[C@@H]1CCC[C@H](Nc2ccc(-n3c[nH+]c(C)c3C)cc2)CC1 ZINC001462290168 1061080172 /nfs/dbraw/zinc/08/01/72/1061080172.db2.gz FSPPUBWHOIAXJI-QFBILLFUSA-N 1 2 313.445 4.249 20 0 DIADLO Cc1[nH+]ccn1-c1ccccc1-c1nc2cc(C)cc(C)c2[nH]1 ZINC001250836398 1061087514 /nfs/dbraw/zinc/08/75/14/1061087514.db2.gz HWGRYTNXFICKKM-UHFFFAOYSA-N 1 2 302.381 4.341 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3cccc(-c4nccs4)c3)[nH+]c2c1 ZINC001250863447 1061100350 /nfs/dbraw/zinc/10/03/50/1061100350.db2.gz DGLXHSFEDRCQAD-UHFFFAOYSA-N 1 2 320.421 4.419 20 0 DIADLO CCCCCOC1C[NH+](Cc2cc3cccc(CC)c3o2)C1 ZINC001462318957 1061102891 /nfs/dbraw/zinc/10/28/91/1061102891.db2.gz CIYQRNMAPBEYFK-UHFFFAOYSA-N 1 2 301.430 4.386 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](C/C=C\c1cccc(F)c1)C1CC1 ZINC001462339271 1061115567 /nfs/dbraw/zinc/11/55/67/1061115567.db2.gz XQEBEHRQHHEXNY-QPBFKRLHSA-N 1 2 319.420 4.034 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](C/C=C\c1cccc(F)c1)C1CC1 ZINC001462339271 1061115574 /nfs/dbraw/zinc/11/55/74/1061115574.db2.gz XQEBEHRQHHEXNY-QPBFKRLHSA-N 1 2 319.420 4.034 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1c(F)cccc1F)[C@H]2C ZINC001473370743 1061118340 /nfs/dbraw/zinc/11/83/40/1061118340.db2.gz ANOOJXBFBFUJPT-STQMWFEESA-N 1 2 317.379 4.481 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1c(F)cccc1F)[C@H]2C ZINC001473370743 1061118346 /nfs/dbraw/zinc/11/83/46/1061118346.db2.gz ANOOJXBFBFUJPT-STQMWFEESA-N 1 2 317.379 4.481 20 0 DIADLO Oc1cc(Cl)cc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c1 ZINC001250905608 1061120185 /nfs/dbraw/zinc/12/01/85/1061120185.db2.gz FNRLZQJXTXOOLE-UHFFFAOYSA-N 1 2 313.788 4.189 20 0 DIADLO CC[C@@]1(C)C[N@@H+]([C@H](C)c2ccccc2Br)CCO1 ZINC001473389175 1061129393 /nfs/dbraw/zinc/12/93/93/1061129393.db2.gz KLHGGWJDXWFYOK-DOMZBBRYSA-N 1 2 312.251 4.011 20 0 DIADLO CC[C@@]1(C)C[N@H+]([C@H](C)c2ccccc2Br)CCO1 ZINC001473389175 1061129396 /nfs/dbraw/zinc/12/93/96/1061129396.db2.gz KLHGGWJDXWFYOK-DOMZBBRYSA-N 1 2 312.251 4.011 20 0 DIADLO c1cn2ccc(-c3nc4ccccc4n3Cc3ccccc3)cc2[nH+]1 ZINC001250928121 1061129672 /nfs/dbraw/zinc/12/96/72/1061129672.db2.gz XBKNWTGBWXRWJD-UHFFFAOYSA-N 1 2 324.387 4.399 20 0 DIADLO COc1cc(Cl)cc2[nH]c(-c3cccc(-n4cc[nH+]c4)c3)nc21 ZINC001250940453 1061136340 /nfs/dbraw/zinc/13/63/40/1061136340.db2.gz MAHMZACNUBAMPW-UHFFFAOYSA-N 1 2 324.771 4.078 20 0 DIADLO Cn1c2ccc(Cl)cc2nc1-c1cccc(-n2cc[nH+]c2)c1 ZINC001250940246 1061136607 /nfs/dbraw/zinc/13/66/07/1061136607.db2.gz HQQZWRSXIFFLNO-UHFFFAOYSA-N 1 2 308.772 4.079 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(F)cc(Cl)c2)CC2(CCCCC2)O1 ZINC001462391216 1061146612 /nfs/dbraw/zinc/14/66/12/1061146612.db2.gz LGHAFKQXRJNEPA-CYBMUJFWSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(F)cc(Cl)c2)CC2(CCCCC2)O1 ZINC001462391216 1061146616 /nfs/dbraw/zinc/14/66/16/1061146616.db2.gz LGHAFKQXRJNEPA-CYBMUJFWSA-N 1 2 311.828 4.403 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1ccc(C(C)(C)C)cc1)C(C)C)C(=O)OC ZINC001473419941 1061150272 /nfs/dbraw/zinc/15/02/72/1061150272.db2.gz WFXOCRSHNJPTJC-DLBZAZTESA-N 1 2 305.462 4.222 20 0 DIADLO Cc1cc(F)cc2c1C[N@H+](Cc1cc(F)ccc1Cl)CC2 ZINC001473418296 1061151595 /nfs/dbraw/zinc/15/15/95/1061151595.db2.gz FRMBENWTBZTFNN-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO Cc1cc(F)cc2c1C[N@@H+](Cc1cc(F)ccc1Cl)CC2 ZINC001473418296 1061151601 /nfs/dbraw/zinc/15/16/01/1061151601.db2.gz FRMBENWTBZTFNN-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@](F)(c3ccccc3C)C2)cc(Cl)n1 ZINC001473422311 1061152680 /nfs/dbraw/zinc/15/26/80/1061152680.db2.gz PCIWNFCAUXDTBX-GOSISDBHSA-N 1 2 318.823 4.423 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@](F)(c3ccccc3C)C2)cc(Cl)n1 ZINC001473422311 1061152691 /nfs/dbraw/zinc/15/26/91/1061152691.db2.gz PCIWNFCAUXDTBX-GOSISDBHSA-N 1 2 318.823 4.423 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@@](F)(c3ccccc3C)C2)cc(Cl)n1 ZINC001473422312 1061153515 /nfs/dbraw/zinc/15/35/15/1061153515.db2.gz PCIWNFCAUXDTBX-SFHVURJKSA-N 1 2 318.823 4.423 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@@](F)(c3ccccc3C)C2)cc(Cl)n1 ZINC001473422312 1061153522 /nfs/dbraw/zinc/15/35/22/1061153522.db2.gz PCIWNFCAUXDTBX-SFHVURJKSA-N 1 2 318.823 4.423 20 0 DIADLO CCOc1ccc2nc(-c3ccc4[nH+]ccn4c3)n(C3CC3)c2c1 ZINC001250978338 1061158368 /nfs/dbraw/zinc/15/83/68/1061158368.db2.gz IBEMFYKYJMDIOR-UHFFFAOYSA-N 1 2 318.380 4.085 20 0 DIADLO Cc1c(F)cc(F)cc1-c1[nH]c2ccc(N3CCCC3)cc2[nH+]1 ZINC001250991019 1061169612 /nfs/dbraw/zinc/16/96/12/1061169612.db2.gz CQQHNFQGIBDPCD-UHFFFAOYSA-N 1 2 313.351 4.417 20 0 DIADLO CCc1cccc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)c1 ZINC001251000423 1061176381 /nfs/dbraw/zinc/17/63/81/1061176381.db2.gz HAMQCVCEEBOTMU-UHFFFAOYSA-N 1 2 306.344 4.117 20 0 DIADLO CC(C)(C)CNC(=O)C[N@@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001473473654 1061180189 /nfs/dbraw/zinc/18/01/89/1061180189.db2.gz OGDMYFYLEIITGT-MRXNPFEDSA-N 1 2 322.880 4.029 20 0 DIADLO CC(C)(C)CNC(=O)C[N@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001473473654 1061180195 /nfs/dbraw/zinc/18/01/95/1061180195.db2.gz OGDMYFYLEIITGT-MRXNPFEDSA-N 1 2 322.880 4.029 20 0 DIADLO Fc1cc2[nH]c(-c3cccc4cc[nH]c43)nc2cc1-n1cc[nH+]c1 ZINC001251010000 1061180373 /nfs/dbraw/zinc/18/03/73/1061180373.db2.gz DUMHFQVFLNZEQB-UHFFFAOYSA-N 1 2 317.327 4.036 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc(C)cc1Cl)CCO2 ZINC001473479604 1061182541 /nfs/dbraw/zinc/18/25/41/1061182541.db2.gz QCYZXQNYXOBCDE-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc(C)cc1Cl)CCO2 ZINC001473479604 1061182548 /nfs/dbraw/zinc/18/25/48/1061182548.db2.gz QCYZXQNYXOBCDE-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO CCc1ccc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)s1 ZINC001251017706 1061185206 /nfs/dbraw/zinc/18/52/06/1061185206.db2.gz FADIQEVBJMWLGT-UHFFFAOYSA-N 1 2 312.373 4.179 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)C[C@H]2OCCc3ccccc32)c1F ZINC001473487301 1061188416 /nfs/dbraw/zinc/18/84/16/1061188416.db2.gz JTCAKPMUGLFKSP-GOSISDBHSA-N 1 2 317.379 4.019 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)C[C@H]2OCCc3ccccc32)c1F ZINC001473487301 1061188427 /nfs/dbraw/zinc/18/84/27/1061188427.db2.gz JTCAKPMUGLFKSP-GOSISDBHSA-N 1 2 317.379 4.019 20 0 DIADLO Cc1cccc2c1CC(C)(C)[N@H+](Cc1nnc(C(C)C)s1)C2 ZINC001473493985 1061190256 /nfs/dbraw/zinc/19/02/56/1061190256.db2.gz MIZJIWDKWPQXOU-UHFFFAOYSA-N 1 2 315.486 4.307 20 0 DIADLO Cc1cccc2c1CC(C)(C)[N@@H+](Cc1nnc(C(C)C)s1)C2 ZINC001473493985 1061190265 /nfs/dbraw/zinc/19/02/65/1061190265.db2.gz MIZJIWDKWPQXOU-UHFFFAOYSA-N 1 2 315.486 4.307 20 0 DIADLO CC(C)CCO[C@@H]1CC[N@H+](Cc2c(F)ccc(F)c2Cl)C1 ZINC001462471066 1061192647 /nfs/dbraw/zinc/19/26/47/1061192647.db2.gz WDSISISPLGLQOZ-GFCCVEGCSA-N 1 2 317.807 4.255 20 0 DIADLO CC(C)CCO[C@@H]1CC[N@@H+](Cc2c(F)ccc(F)c2Cl)C1 ZINC001462471066 1061192658 /nfs/dbraw/zinc/19/26/58/1061192658.db2.gz WDSISISPLGLQOZ-GFCCVEGCSA-N 1 2 317.807 4.255 20 0 DIADLO Oc1ccc(C[NH2+]Cc2csc(C(F)(F)F)c2)c(F)c1F ZINC001462484840 1061205086 /nfs/dbraw/zinc/20/50/86/1061205086.db2.gz MCMYHNYXNUIGKL-UHFFFAOYSA-N 1 2 323.286 4.041 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)/C=C3\CC[C@@H](C)C3)cc2)[nH+]c1C ZINC001455244737 1061213130 /nfs/dbraw/zinc/21/31/30/1061213130.db2.gz ALIYUMROTZTJBQ-PKVLTRFUSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C=C3CC[C@@H](C)C3)cc2)[nH+]c1C ZINC001455244737 1061213149 /nfs/dbraw/zinc/21/31/49/1061213149.db2.gz ALIYUMROTZTJBQ-PKVLTRFUSA-N 1 2 309.413 4.378 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC001473530088 1061226726 /nfs/dbraw/zinc/22/67/26/1061226726.db2.gz CJJDEMQCMDHZFK-FUHWJXTLSA-N 1 2 315.457 4.336 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC001473530088 1061226746 /nfs/dbraw/zinc/22/67/46/1061226746.db2.gz CJJDEMQCMDHZFK-FUHWJXTLSA-N 1 2 315.457 4.336 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1nc2c(cccc2Oc2ccccc2)[nH]1 ZINC001251091616 1061231505 /nfs/dbraw/zinc/23/15/05/1061231505.db2.gz KBYAIPBRGYYWLM-UHFFFAOYSA-N 1 2 316.364 4.308 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1nc2cc(Cl)ccc2n1CC1CC1 ZINC001251091386 1061232328 /nfs/dbraw/zinc/23/23/28/1061232328.db2.gz FUUOZMKNUAXPTM-UHFFFAOYSA-N 1 2 312.804 4.052 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1nc2ccc(F)cc2n1C1CCCC1 ZINC001251091519 1061233512 /nfs/dbraw/zinc/23/35/12/1061233512.db2.gz GJGTZVYOSAETGC-UHFFFAOYSA-N 1 2 310.376 4.243 20 0 DIADLO c1nc2ccc(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)cc2s1 ZINC001251190144 1061264850 /nfs/dbraw/zinc/26/48/50/1061264850.db2.gz CMBUTPWGUDNFLP-UHFFFAOYSA-N 1 2 320.421 4.440 20 0 DIADLO Clc1cccc(CC[N@@H+]2CCOC[C@@H]2C2CCC2)c1Cl ZINC001473579397 1061268654 /nfs/dbraw/zinc/26/86/54/1061268654.db2.gz DLYFUBOJNWUUML-OAHLLOKOSA-N 1 2 314.256 4.037 20 0 DIADLO Clc1cccc(CC[N@H+]2CCOC[C@@H]2C2CCC2)c1Cl ZINC001473579397 1061268670 /nfs/dbraw/zinc/26/86/70/1061268670.db2.gz DLYFUBOJNWUUML-OAHLLOKOSA-N 1 2 314.256 4.037 20 0 DIADLO Fc1cccc(C2CC[NH+](CC=C(Cl)Cl)CC2)c1F ZINC001473584712 1061271359 /nfs/dbraw/zinc/27/13/59/1061271359.db2.gz ZYQYDDAECQDBBO-UHFFFAOYSA-N 1 2 306.183 4.463 20 0 DIADLO Cc1ccc(C[N@@H+](CCCC(C)C)Cc2cnn(C)c2Cl)o1 ZINC001462586351 1061279275 /nfs/dbraw/zinc/27/92/75/1061279275.db2.gz OSOTXKRNGRFMNE-UHFFFAOYSA-N 1 2 323.868 4.413 20 0 DIADLO Cc1ccc(C[N@H+](CCCC(C)C)Cc2cnn(C)c2Cl)o1 ZINC001462586351 1061279292 /nfs/dbraw/zinc/27/92/92/1061279292.db2.gz OSOTXKRNGRFMNE-UHFFFAOYSA-N 1 2 323.868 4.413 20 0 DIADLO C[C@H]1C[N@H+](Cc2nc3ccccc3s2)CC2(CCCCC2)O1 ZINC001473596450 1061279908 /nfs/dbraw/zinc/27/99/08/1061279908.db2.gz AZTTXYVKJZAUCY-AWEZNQCLSA-N 1 2 316.470 4.220 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nc3ccccc3s2)CC2(CCCCC2)O1 ZINC001473596450 1061279931 /nfs/dbraw/zinc/27/99/31/1061279931.db2.gz AZTTXYVKJZAUCY-AWEZNQCLSA-N 1 2 316.470 4.220 20 0 DIADLO Fc1cc2[nH]c(-c3ccc(C4CC4)cc3)nc2cc1-n1cc[nH+]c1 ZINC001251242879 1061288641 /nfs/dbraw/zinc/28/86/41/1061288641.db2.gz ZIDCMLAITSLEOQ-UHFFFAOYSA-N 1 2 318.355 4.432 20 0 DIADLO CCCC[N@H+](Cc1cnn(C)c1Cl)Cc1c(C)oc(C)c1C ZINC001462604857 1061291104 /nfs/dbraw/zinc/29/11/04/1061291104.db2.gz SYHMXYBPJAWWIL-UHFFFAOYSA-N 1 2 323.868 4.394 20 0 DIADLO CCCC[N@@H+](Cc1cnn(C)c1Cl)Cc1c(C)oc(C)c1C ZINC001462604857 1061291123 /nfs/dbraw/zinc/29/11/23/1061291123.db2.gz SYHMXYBPJAWWIL-UHFFFAOYSA-N 1 2 323.868 4.394 20 0 DIADLO Fc1cc2[nH]c(-c3ccsc3Cl)nc2cc1-n1cc[nH+]c1 ZINC001251254961 1061292632 /nfs/dbraw/zinc/29/26/32/1061292632.db2.gz DFQPSOVJJHBDIJ-UHFFFAOYSA-N 1 2 318.764 4.270 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@@H+](Cc1ccc(Cl)nc1)CC2 ZINC001473623471 1061294605 /nfs/dbraw/zinc/29/46/05/1061294605.db2.gz ATJSBCXRZNVPDF-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@H+](Cc1ccc(Cl)nc1)CC2 ZINC001473623471 1061294621 /nfs/dbraw/zinc/29/46/21/1061294621.db2.gz ATJSBCXRZNVPDF-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO Cc1cc2[nH]c(-c3cccc4[nH+]ccn43)nc2cc1C(F)(F)F ZINC001251326260 1061316085 /nfs/dbraw/zinc/31/60/85/1061316085.db2.gz DVJWTFSSHRMKPN-UHFFFAOYSA-N 1 2 316.286 4.205 20 0 DIADLO Cc1cnccc1C[N@H+]1CCO[C@@H](c2cccc(Cl)c2)[C@@H]1C ZINC001473656873 1061319724 /nfs/dbraw/zinc/31/97/24/1061319724.db2.gz ZZNULPSBUDMOQH-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cnccc1C[N@@H+]1CCO[C@@H](c2cccc(Cl)c2)[C@@H]1C ZINC001473656873 1061319742 /nfs/dbraw/zinc/31/97/42/1061319742.db2.gz ZZNULPSBUDMOQH-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cc(CNC(=O)N[C@H]2CCCCC23CCCC3)cc(C)[nH+]1 ZINC001251336467 1061321399 /nfs/dbraw/zinc/32/13/99/1061321399.db2.gz BURRNBHVPXYRQO-KRWDZBQOSA-N 1 2 315.461 4.001 20 0 DIADLO CO[C@@H](CC(C)C)C[N@H+](C)[C@H](CCc1ccccc1)C(F)F ZINC001473691272 1061349909 /nfs/dbraw/zinc/34/99/09/1061349909.db2.gz GBVZMTQEVBQWIL-DLBZAZTESA-N 1 2 313.432 4.246 20 0 DIADLO CO[C@@H](CC(C)C)C[N@@H+](C)[C@H](CCc1ccccc1)C(F)F ZINC001473691272 1061349925 /nfs/dbraw/zinc/34/99/25/1061349925.db2.gz GBVZMTQEVBQWIL-DLBZAZTESA-N 1 2 313.432 4.246 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(-c2ccccc2F)n1)c1ccns1 ZINC001473695056 1061353041 /nfs/dbraw/zinc/35/30/41/1061353041.db2.gz ZSSBXTZKFKGGJQ-SNVBAGLBSA-N 1 2 319.430 4.257 20 0 DIADLO CC(C)(C)OC(=O)[C@@H](Cc1ccccc1)[NH2+]CC1CCCCC1 ZINC001473698929 1061356286 /nfs/dbraw/zinc/35/62/86/1061356286.db2.gz XGHIYHYXSDYUKU-GOSISDBHSA-N 1 2 317.473 4.109 20 0 DIADLO FC(F)(F)SCC[N@@H+]1CCC[C@@](F)(c2ccccc2)C1 ZINC001473730180 1061374640 /nfs/dbraw/zinc/37/46/40/1061374640.db2.gz NOBKADDZANFTHI-ZDUSSCGKSA-N 1 2 307.356 4.200 20 0 DIADLO FC(F)(F)SCC[N@H+]1CCC[C@@](F)(c2ccccc2)C1 ZINC001473730180 1061374656 /nfs/dbraw/zinc/37/46/56/1061374656.db2.gz NOBKADDZANFTHI-ZDUSSCGKSA-N 1 2 307.356 4.200 20 0 DIADLO Cn1c2ccccc2nc1-c1ccc(-n2cc[nH+]c2)cc1Cl ZINC001251507798 1061383248 /nfs/dbraw/zinc/38/32/48/1061383248.db2.gz SRKIMKLIXJXOEW-UHFFFAOYSA-N 1 2 308.772 4.079 20 0 DIADLO Cl/C=C(\Cl)C[N@@H+]1CCC[C@@H](c2nc3c(s2)CCC3)C1 ZINC001473805350 1061413709 /nfs/dbraw/zinc/41/37/09/1061413709.db2.gz CUOAABWONJPWCJ-PAKSIRSJSA-N 1 2 317.285 4.130 20 0 DIADLO Cl/C=C(\Cl)C[N@H+]1CCC[C@@H](c2nc3c(s2)CCC3)C1 ZINC001473805350 1061413715 /nfs/dbraw/zinc/41/37/15/1061413715.db2.gz CUOAABWONJPWCJ-PAKSIRSJSA-N 1 2 317.285 4.130 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@H]3CCCc4cc(F)ccc43)ccn12 ZINC001457268360 1061431130 /nfs/dbraw/zinc/43/11/30/1061431130.db2.gz HXULURQNBGUNHH-KRWDZBQOSA-N 1 2 324.355 4.016 20 0 DIADLO Cc1cccnc1[C@H](C)[NH2+]Cc1csc(CCC(C)C)n1 ZINC001473880051 1061448472 /nfs/dbraw/zinc/44/84/72/1061448472.db2.gz QLWWRHYOMCOBMF-AWEZNQCLSA-N 1 2 303.475 4.286 20 0 DIADLO CC(C)(C)[C@@H]1CC[N@H+](Cc2nc(Cl)ccc2Cl)CCO1 ZINC001473896500 1061452451 /nfs/dbraw/zinc/45/24/51/1061452451.db2.gz CQTJQYKVMHKVCB-ZDUSSCGKSA-N 1 2 317.260 4.025 20 0 DIADLO CC(C)(C)[C@@H]1CC[N@@H+](Cc2nc(Cl)ccc2Cl)CCO1 ZINC001473896500 1061452459 /nfs/dbraw/zinc/45/24/59/1061452459.db2.gz CQTJQYKVMHKVCB-ZDUSSCGKSA-N 1 2 317.260 4.025 20 0 DIADLO Cc1cc(CNc2ccc([NH+](C)C)cc2C)c2c(n1)CCCC2 ZINC001473943798 1061485998 /nfs/dbraw/zinc/48/59/98/1061485998.db2.gz PVYOGSBLBZOXMK-UHFFFAOYSA-N 1 2 309.457 4.255 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1C[C@H]1c1ccsc1 ZINC001457782703 1061500677 /nfs/dbraw/zinc/50/06/77/1061500677.db2.gz QNBAMQHZXBZVLO-LSDHHAIUSA-N 1 2 323.421 4.189 20 0 DIADLO CCOc1cccc(F)c1C[NH2+]Cc1cc(Cl)ccc1OC ZINC001473962634 1061504333 /nfs/dbraw/zinc/50/43/33/1061504333.db2.gz PGJMOKMFNFJCSS-UHFFFAOYSA-N 1 2 323.795 4.176 20 0 DIADLO Cc1cc(CNC(=O)N[C@H]2CCCC[C@@H]2C(C)(C)C)cc(C)[nH+]1 ZINC001252017686 1061555742 /nfs/dbraw/zinc/55/57/42/1061555742.db2.gz KENVJOCYAYWPSA-IRXDYDNUSA-N 1 2 317.477 4.103 20 0 DIADLO Cc1c2cc(F)ccc2oc1C[NH2+]Cc1nc2ccccc2o1 ZINC001474016618 1061558098 /nfs/dbraw/zinc/55/80/98/1061558098.db2.gz UXZJYSDWMVJSOV-UHFFFAOYSA-N 1 2 310.328 4.311 20 0 DIADLO CCc1cc(N[C@H](C)c2cccc(OC(F)F)c2)nc(CC)[nH+]1 ZINC001458103430 1061572038 /nfs/dbraw/zinc/57/20/38/1061572038.db2.gz DQVWEPWELZATQF-LLVKDONJSA-N 1 2 321.371 4.376 20 0 DIADLO Cc1cc(N[C@@H]2CCCOc3ccccc32)nc(C2CCC2)[nH+]1 ZINC001458148245 1061598356 /nfs/dbraw/zinc/59/83/56/1061598356.db2.gz QBJUXYRURPVLIC-MRXNPFEDSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1cc(NCCc2csc(C(C)C)n2)nc(C2CCC2)[nH+]1 ZINC001458148970 1061599846 /nfs/dbraw/zinc/59/98/46/1061599846.db2.gz AIXKDROAQQIMLH-UHFFFAOYSA-N 1 2 316.474 4.287 20 0 DIADLO Cc1ncc(-c2ccc(NCc3c[nH+]c4ccc(C)cn34)cc2)o1 ZINC001474051773 1061600955 /nfs/dbraw/zinc/60/09/55/1061600955.db2.gz LDBYAFLYJTYRSG-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO C[C@@H](CN(C)c1nc2ccccc2n2c[nH+]cc12)c1ccccc1 ZINC001458155684 1061604085 /nfs/dbraw/zinc/60/40/85/1061604085.db2.gz DJYPUZMQEYCBCT-HNNXBMFYSA-N 1 2 316.408 4.122 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3ccc4c(c3)CC(C)(C)O4)ccc21 ZINC001474060524 1061608445 /nfs/dbraw/zinc/60/84/45/1061608445.db2.gz MQXSIKYGFOZMNG-UHFFFAOYSA-N 1 2 322.452 4.395 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3ccc4c(c3)CC(C)(C)O4)ccc21 ZINC001474060524 1061608458 /nfs/dbraw/zinc/60/84/58/1061608458.db2.gz MQXSIKYGFOZMNG-UHFFFAOYSA-N 1 2 322.452 4.395 20 0 DIADLO COc1ccccc1/C=C\CNc1ccc([NH+]2CCCC2)cc1 ZINC001474063089 1061610712 /nfs/dbraw/zinc/61/07/12/1061610712.db2.gz PHMNYXXEYMNIFQ-VURMDHGXSA-N 1 2 308.425 4.421 20 0 DIADLO CCCOc1cc(F)ccc1NCc1c[nH+]c2c(C)cccn12 ZINC001474065029 1061610746 /nfs/dbraw/zinc/61/07/46/1061610746.db2.gz IFCUOQNOLFGEPB-UHFFFAOYSA-N 1 2 313.376 4.183 20 0 DIADLO Cc1cc(NCc2ccc(C(F)F)nc2)ccc1-n1cc[nH+]c1 ZINC001474063218 1061610898 /nfs/dbraw/zinc/61/08/98/1061610898.db2.gz ACRWJEZJKQSRHT-UHFFFAOYSA-N 1 2 314.339 4.125 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cc3ccccc3n2C)c1 ZINC001474070886 1061615676 /nfs/dbraw/zinc/61/56/76/1061615676.db2.gz LXKWSZYGJYWCSQ-UHFFFAOYSA-N 1 2 311.454 4.439 20 0 DIADLO Cc1cc(N2CCc3c(Cl)cccc3C2)nc(C2CCC2)[nH+]1 ZINC001458193450 1061623552 /nfs/dbraw/zinc/62/35/52/1061623552.db2.gz HUIFKDFYPZYUOF-UHFFFAOYSA-N 1 2 313.832 4.269 20 0 DIADLO c1cc2cccc(CNc3ccc(N4CCCCC4)[nH+]c3)c2o1 ZINC001474078807 1061624400 /nfs/dbraw/zinc/62/44/00/1061624400.db2.gz XHUYJZJNXHXPLO-UHFFFAOYSA-N 1 2 307.397 4.430 20 0 DIADLO CC1CC[NH+](c2ccc(Nc3cncc(Cl)n3)cc2)CC1 ZINC001458203976 1061630142 /nfs/dbraw/zinc/63/01/42/1061630142.db2.gz QQJCSYKXBTVYSN-UHFFFAOYSA-N 1 2 302.809 4.110 20 0 DIADLO Cc1nc(NC[C@H](C)Sc2ccccc2)c2c([nH+]1)CCCC2 ZINC001458223048 1061642253 /nfs/dbraw/zinc/64/22/53/1061642253.db2.gz YHSMKLMHUXBWOE-ZDUSSCGKSA-N 1 2 313.470 4.257 20 0 DIADLO COc1cc(CNc2c[nH+]ccc2OC(C)(C)C)ccc1C ZINC001474097929 1061643330 /nfs/dbraw/zinc/64/33/30/1061643330.db2.gz PSJSPRHAGLYICI-UHFFFAOYSA-N 1 2 300.402 4.188 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NCc1ccc2c(c1)CC(C)(C)O2 ZINC001474115915 1061664149 /nfs/dbraw/zinc/66/41/49/1061664149.db2.gz ZVUUHWHBHYGPQR-UHFFFAOYSA-N 1 2 312.413 4.194 20 0 DIADLO CCc1cc(N[C@H]2CCCOc3cc(F)ccc32)nc(CC)[nH+]1 ZINC001458292003 1061678862 /nfs/dbraw/zinc/67/88/62/1061678862.db2.gz SZMBJYWJZOSUBH-HNNXBMFYSA-N 1 2 315.392 4.066 20 0 DIADLO CC(C)c1cc(N[C@H](CO)CC2CCCC2)nc(C(C)C)[nH+]1 ZINC001458332501 1061702022 /nfs/dbraw/zinc/70/20/22/1061702022.db2.gz AZOVCFZFCPQYHJ-HNNXBMFYSA-N 1 2 305.466 4.077 20 0 DIADLO FC1(F)CCC(CNc2nc3ccccc3n3c[nH+]cc23)CC1 ZINC001458338527 1061707611 /nfs/dbraw/zinc/70/76/11/1061707611.db2.gz PSMOSEFLXOOUOH-UHFFFAOYSA-N 1 2 316.355 4.120 20 0 DIADLO CCc1cc(Nc2nc3ccccc3n3c[nH+]cc23)ccc1F ZINC001458363794 1061724533 /nfs/dbraw/zinc/72/45/33/1061724533.db2.gz POXZTKVVYNDUTJ-UHFFFAOYSA-N 1 2 306.344 4.328 20 0 DIADLO CC(C)(C)c1ccc(-c2nnc([C@@H]3CCCc4[nH]c[nH+]c43)o2)cc1 ZINC001252812828 1061727189 /nfs/dbraw/zinc/72/71/89/1061727189.db2.gz KHYDDIDIDIZMMG-CQSZACIVSA-N 1 2 322.412 4.225 20 0 DIADLO CC(C)(C)c1ccc(C2=NNC(=c3ccnc4c3=CC=[NH+]4)O2)cc1 ZINC001252823027 1061731288 /nfs/dbraw/zinc/73/12/88/1061731288.db2.gz KMJXFRCDHQTUES-OAHLLOKOSA-N 1 2 318.380 4.054 20 0 DIADLO CC(C)=CCC[C@H](C)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001458389008 1061735371 /nfs/dbraw/zinc/73/53/71/1061735371.db2.gz RXTHKOSBYTVINI-ZDUSSCGKSA-N 1 2 301.438 4.128 20 0 DIADLO CO[C@@H]1C[C@@H](Nc2cc(C(C)C)[nH+]c(C(C)C)n2)C12CCC2 ZINC001458428246 1061757636 /nfs/dbraw/zinc/75/76/36/1061757636.db2.gz IORPJUAEYUYNRT-HUUCEWRRSA-N 1 2 303.450 4.093 20 0 DIADLO Cc1[nH+]cc(CNc2cncc(C(F)F)c2)n1-c1ccccc1 ZINC001474243344 1061809972 /nfs/dbraw/zinc/80/99/72/1061809972.db2.gz GPQSFCDERSIELD-UHFFFAOYSA-N 1 2 314.339 4.125 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1nc2c(s1)CCCC2 ZINC001474245255 1061811226 /nfs/dbraw/zinc/81/12/26/1061811226.db2.gz NCPFFUCVHSNNEP-UHFFFAOYSA-N 1 2 319.499 4.282 20 0 DIADLO CC(C)c1cc(N[C@@H](C2CCC2)[C@@H]2CCCO2)nc(C(C)C)[nH+]1 ZINC001458521798 1061818729 /nfs/dbraw/zinc/81/87/29/1061818729.db2.gz ZVXORYQLHWQDIL-WMZOPIPTSA-N 1 2 317.477 4.483 20 0 DIADLO F[C@H]1COc2ccccc2[C@H]1[NH2+]Cc1csc2ccccc12 ZINC001474266835 1061832028 /nfs/dbraw/zinc/83/20/28/1061832028.db2.gz ZYVVLXIHVQKEPY-MAUKXSAKSA-N 1 2 313.397 4.463 20 0 DIADLO Fc1cccc2oc(N[C@@H](Cn3cc[nH+]c3)c3ccccc3)nc21 ZINC001458553446 1061834178 /nfs/dbraw/zinc/83/41/78/1061834178.db2.gz AEPMZEBAJZNSHS-HNNXBMFYSA-N 1 2 322.343 4.017 20 0 DIADLO Cc1ccc(CNc2cc(C)[nH+]c(C3CCC3)n2)c(Cl)n1 ZINC001458559468 1061836757 /nfs/dbraw/zinc/83/67/57/1061836757.db2.gz JYYZQNMLXSMJTE-UHFFFAOYSA-N 1 2 302.809 4.021 20 0 DIADLO Cc1cc(NCCc2cnc3ccccc3c2)nc(C2CCC2)[nH+]1 ZINC001458577084 1061846137 /nfs/dbraw/zinc/84/61/37/1061846137.db2.gz DHWKJWIPYIUJPU-UHFFFAOYSA-N 1 2 318.424 4.255 20 0 DIADLO Cc1cc(NC(=O)NC(C)(C)CC2CCCCCC2)c(C)c[nH+]1 ZINC001465948756 1061847474 /nfs/dbraw/zinc/84/74/74/1061847474.db2.gz NFNDXYITQZKSAF-UHFFFAOYSA-N 1 2 317.477 4.381 20 0 DIADLO Cc1cc(NC(=O)C[C@H](C)n2cc[nH+]c2)ccc1-c1ccccc1 ZINC001458630800 1061861820 /nfs/dbraw/zinc/86/18/20/1061861820.db2.gz MVHZCFZHWMXNQY-INIZCTEOSA-N 1 2 319.408 4.448 20 0 DIADLO Cc1cc(NC[C@@H](O)c2ccc(F)c(F)c2)c2ccsc2[nH+]1 ZINC001253349438 1061875606 /nfs/dbraw/zinc/87/56/06/1061875606.db2.gz CHMQXPGIYZUZKX-OAHLLOKOSA-N 1 2 320.364 4.028 20 0 DIADLO CCc1ccc2c(c1)CN(c1cc(C)[nH+]c(C3CCC3)n1)CC2 ZINC001458722797 1061885363 /nfs/dbraw/zinc/88/53/63/1061885363.db2.gz CMCILXODDFYUCE-UHFFFAOYSA-N 1 2 307.441 4.178 20 0 DIADLO c1[nH+]c(SCCSCc2ccccc2)n2ccccc12 ZINC001458795855 1061905774 /nfs/dbraw/zinc/90/57/74/1061905774.db2.gz YHZHAWGGKAZRFM-UHFFFAOYSA-N 1 2 300.452 4.360 20 0 DIADLO Fc1cc(Br)cc(F)c1C[N@@H+]1CCC[C@H]1C1CC1 ZINC001474335685 1061927704 /nfs/dbraw/zinc/92/77/04/1061927704.db2.gz CNALJMBIOXFWRC-AWEZNQCLSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(Br)cc(F)c1C[N@H+]1CCC[C@H]1C1CC1 ZINC001474335685 1061927729 /nfs/dbraw/zinc/92/77/29/1061927729.db2.gz CNALJMBIOXFWRC-AWEZNQCLSA-N 1 2 316.189 4.102 20 0 DIADLO c1cc(CSC2CCCCC2)cc(C[NH+]2CCOCC2)c1 ZINC001458837311 1061917737 /nfs/dbraw/zinc/91/77/37/1061917737.db2.gz QSOWIMIGESXDGW-UHFFFAOYSA-N 1 2 305.487 4.085 20 0 DIADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1ccsc1C(F)(F)F ZINC001474331361 1061924052 /nfs/dbraw/zinc/92/40/52/1061924052.db2.gz SUYNXJGATHAOGG-UHFFFAOYSA-N 1 2 322.783 4.391 20 0 DIADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1ccsc1C(F)(F)F ZINC001474331361 1061924074 /nfs/dbraw/zinc/92/40/74/1061924074.db2.gz SUYNXJGATHAOGG-UHFFFAOYSA-N 1 2 322.783 4.391 20 0 DIADLO c1cc(C[N@H+](Cc2ccccc2)Cc2cccc3c2CCC3)n[nH]1 ZINC001474335511 1061927943 /nfs/dbraw/zinc/92/79/43/1061927943.db2.gz WXMBXNWJVWIARK-UHFFFAOYSA-N 1 2 317.436 4.101 20 0 DIADLO c1cc(C[N@@H+](Cc2ccccc2)Cc2cccc3c2CCC3)n[nH]1 ZINC001474335511 1061927967 /nfs/dbraw/zinc/92/79/67/1061927967.db2.gz WXMBXNWJVWIARK-UHFFFAOYSA-N 1 2 317.436 4.101 20 0 DIADLO Cc1nn(-c2cccc(C)c2)cc1C[NH+]1Cc2ccccc2C1 ZINC001474336835 1061932340 /nfs/dbraw/zinc/93/23/40/1061932340.db2.gz NZBIXNRBQUGXQU-UHFFFAOYSA-N 1 2 303.409 4.005 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CC(C)(C)[C@H]3c3ccccc3)cn2c1 ZINC001474340976 1061940690 /nfs/dbraw/zinc/94/06/90/1061940690.db2.gz FFWSSIMHYULXKM-LJQANCHMSA-N 1 2 305.425 4.226 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CC(C)(C)[C@H]3c3ccccc3)cn2c1 ZINC001474340976 1061940710 /nfs/dbraw/zinc/94/07/10/1061940710.db2.gz FFWSSIMHYULXKM-LJQANCHMSA-N 1 2 305.425 4.226 20 0 DIADLO Clc1cccc(-c2nnc(-c3ccccc3-n3cc[nH+]c3)o2)c1 ZINC001253807027 1061986947 /nfs/dbraw/zinc/98/69/47/1061986947.db2.gz QVTXSTGDYXQGGH-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](Cc1nc(CO)cs1)C1CC1 ZINC001474363278 1061990525 /nfs/dbraw/zinc/99/05/25/1061990525.db2.gz HTCMLUCOFMDVSS-NSHDSACASA-N 1 2 322.861 4.014 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](Cc1nc(CO)cs1)C1CC1 ZINC001474363278 1061990551 /nfs/dbraw/zinc/99/05/51/1061990551.db2.gz HTCMLUCOFMDVSS-NSHDSACASA-N 1 2 322.861 4.014 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1cnn(CC2CCC2)c1 ZINC001474364999 1061996596 /nfs/dbraw/zinc/99/65/96/1061996596.db2.gz SEIIQFONDBZEJY-ZDUSSCGKSA-N 1 2 319.399 4.154 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cnn(CC2CCC2)c1 ZINC001474364999 1061996612 /nfs/dbraw/zinc/99/66/12/1061996612.db2.gz SEIIQFONDBZEJY-ZDUSSCGKSA-N 1 2 319.399 4.154 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@H](C)Cc2ccsc2)c(C)[nH+]1 ZINC001466754844 1061999853 /nfs/dbraw/zinc/99/98/53/1061999853.db2.gz IJVREDBADPTSRE-CYBMUJFWSA-N 1 2 317.458 4.163 20 0 DIADLO Cc1ccsc1C[N@@H+]1CCO[C@H](c2ccc(Cl)s2)C1 ZINC001254018585 1062011242 /nfs/dbraw/zinc/01/12/42/1062011242.db2.gz MDKGVPNDJCYMFV-NSHDSACASA-N 1 2 313.875 4.345 20 0 DIADLO Cc1ccsc1C[N@H+]1CCO[C@H](c2ccc(Cl)s2)C1 ZINC001254018585 1062011252 /nfs/dbraw/zinc/01/12/52/1062011252.db2.gz MDKGVPNDJCYMFV-NSHDSACASA-N 1 2 313.875 4.345 20 0 DIADLO CCC[N@H+](Cc1c(Cl)ncn1CC)Cc1ccc(F)cc1 ZINC001474377647 1062018026 /nfs/dbraw/zinc/01/80/26/1062018026.db2.gz OSFIOVXJOQRSJS-UHFFFAOYSA-N 1 2 309.816 4.108 20 0 DIADLO CCC[N@@H+](Cc1c(Cl)ncn1CC)Cc1ccc(F)cc1 ZINC001474377647 1062018046 /nfs/dbraw/zinc/01/80/46/1062018046.db2.gz OSFIOVXJOQRSJS-UHFFFAOYSA-N 1 2 309.816 4.108 20 0 DIADLO Cc1cccc2[nH]c(CNc3cccc(-n4cc[nH+]c4)c3)cc21 ZINC001474386417 1062033300 /nfs/dbraw/zinc/03/33/00/1062033300.db2.gz CSIDHKOQADXYEW-UHFFFAOYSA-N 1 2 302.381 4.274 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1cc2c(cc[nH]c2=O)o1 ZINC001474401431 1062056835 /nfs/dbraw/zinc/05/68/35/1062056835.db2.gz NMVPKBMUKPXWQD-NSHDSACASA-N 1 2 316.788 4.380 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1cc2c(cc[nH]c2=O)o1 ZINC001474401431 1062056860 /nfs/dbraw/zinc/05/68/60/1062056860.db2.gz NMVPKBMUKPXWQD-NSHDSACASA-N 1 2 316.788 4.380 20 0 DIADLO Cc1ccnc(C[N@@H+](C)[C@@H](C)c2ccccc2)c1Br ZINC001474409648 1062072348 /nfs/dbraw/zinc/07/23/48/1062072348.db2.gz HFXPSRANHPHTRL-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccnc(C[N@H+](C)[C@@H](C)c2ccccc2)c1Br ZINC001474409648 1062072370 /nfs/dbraw/zinc/07/23/70/1062072370.db2.gz HFXPSRANHPHTRL-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO c1csc(C[NH+](Cc2cccs2)Cc2ccns2)c1 ZINC001474411495 1062078090 /nfs/dbraw/zinc/07/80/90/1062078090.db2.gz KPCAZWULUJISHT-UHFFFAOYSA-N 1 2 306.481 4.469 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(Oc2ccccc2)o1 ZINC001474411633 1062078634 /nfs/dbraw/zinc/07/86/34/1062078634.db2.gz DDZYRCIPZYNBOH-GJZGRUSLSA-N 1 2 301.386 4.071 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(Oc2ccccc2)o1 ZINC001474411633 1062078656 /nfs/dbraw/zinc/07/86/56/1062078656.db2.gz DDZYRCIPZYNBOH-GJZGRUSLSA-N 1 2 301.386 4.071 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3nccn3C3CC3)CC2)cc1 ZINC001474414341 1062081846 /nfs/dbraw/zinc/08/18/46/1062081846.db2.gz ZGVKKMZDEZQDDT-UHFFFAOYSA-N 1 2 313.832 4.161 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3nccn3C3CC3)CC2)cc1 ZINC001474414341 1062081865 /nfs/dbraw/zinc/08/18/65/1062081865.db2.gz ZGVKKMZDEZQDDT-UHFFFAOYSA-N 1 2 313.832 4.161 20 0 DIADLO COc1ccccc1C[N@H+](Cc1cc(F)ccc1F)C1CC1 ZINC001459314035 1062085239 /nfs/dbraw/zinc/08/52/39/1062085239.db2.gz QGTLYTVCHLEOKE-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1cc(F)ccc1F)C1CC1 ZINC001459314035 1062085267 /nfs/dbraw/zinc/08/52/67/1062085267.db2.gz QGTLYTVCHLEOKE-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO Cc1ccc2c(c1)N(Cc1cc(C)[nH+]c3c1CCCC3)C[C@@H](C)O2 ZINC001474423191 1062096776 /nfs/dbraw/zinc/09/67/76/1062096776.db2.gz WYMJYFYJRHDHRW-MRXNPFEDSA-N 1 2 322.452 4.365 20 0 DIADLO Cc1cc(CN2C[C@H](C)Oc3c(Cl)cccc32)cc(C)[nH+]1 ZINC001474486368 1062164700 /nfs/dbraw/zinc/16/47/00/1062164700.db2.gz KSBMLOKANOJVAC-ZDUSSCGKSA-N 1 2 302.805 4.139 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@@H+]2CCCSC(C)(C)C)o1 ZINC001459531823 1062189714 /nfs/dbraw/zinc/18/97/14/1062189714.db2.gz MFJSOEVYPFKKGK-HNNXBMFYSA-N 1 2 311.491 4.137 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@H+]2CCCSC(C)(C)C)o1 ZINC001459531823 1062189726 /nfs/dbraw/zinc/18/97/26/1062189726.db2.gz MFJSOEVYPFKKGK-HNNXBMFYSA-N 1 2 311.491 4.137 20 0 DIADLO CC(C)[C@@H]1[C@@H](C(C)C)C[N@@H+]1Cc1ncc(Br)s1 ZINC001474521655 1062205636 /nfs/dbraw/zinc/20/56/36/1062205636.db2.gz OHYVVCQZQPNVQW-ZWNOBZJWSA-N 1 2 317.296 4.018 20 0 DIADLO CC(C)[C@@H]1[C@@H](C(C)C)C[N@H+]1Cc1ncc(Br)s1 ZINC001474521655 1062205654 /nfs/dbraw/zinc/20/56/54/1062205654.db2.gz OHYVVCQZQPNVQW-ZWNOBZJWSA-N 1 2 317.296 4.018 20 0 DIADLO Clc1sc(C[N@@H+]2CC[C@H]2C2CC2)cc1Br ZINC001474536355 1062222581 /nfs/dbraw/zinc/22/25/81/1062222581.db2.gz GKSKXLLBJCUUML-JTQLQIEISA-N 1 2 306.656 4.148 20 0 DIADLO Clc1sc(C[N@H+]2CC[C@H]2C2CC2)cc1Br ZINC001474536355 1062222600 /nfs/dbraw/zinc/22/26/00/1062222600.db2.gz GKSKXLLBJCUUML-JTQLQIEISA-N 1 2 306.656 4.148 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1)Nc1ccc(N2CCCC2)c[nH+]1 ZINC001474592022 1062305363 /nfs/dbraw/zinc/30/53/63/1062305363.db2.gz TVKKKHAIERMEIQ-AWEZNQCLSA-N 1 2 315.848 4.378 20 0 DIADLO COc1c(C)c[nH+]c(CN2c3ccccc3SC[C@@H]2C)c1C ZINC001459705886 1062324700 /nfs/dbraw/zinc/32/47/00/1062324700.db2.gz SXZQQNVDGAZBNH-ZDUSSCGKSA-N 1 2 314.454 4.208 20 0 DIADLO COc1cccc(Nc2ccc(NCCSC(C)C)[nH+]c2)c1 ZINC001474630143 1062353992 /nfs/dbraw/zinc/35/39/92/1062353992.db2.gz GDCKTNMEIYWDRL-UHFFFAOYSA-N 1 2 317.458 4.387 20 0 DIADLO CCc1cccc2cc(C[N@@H+]3C[C@@H](C)O[C@@](C)(C(F)F)C3)oc21 ZINC001474636604 1062360083 /nfs/dbraw/zinc/36/00/83/1062360083.db2.gz QWFNQTNSPPQSMT-KZULUSFZSA-N 1 2 323.383 4.240 20 0 DIADLO CCc1cccc2cc(C[N@H+]3C[C@@H](C)O[C@@](C)(C(F)F)C3)oc21 ZINC001474636604 1062360099 /nfs/dbraw/zinc/36/00/99/1062360099.db2.gz QWFNQTNSPPQSMT-KZULUSFZSA-N 1 2 323.383 4.240 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)c(C)o1 ZINC001474658456 1062392441 /nfs/dbraw/zinc/39/24/41/1062392441.db2.gz LYAPNFBNEIPPQB-UHFFFAOYSA-N 1 2 309.331 4.474 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)c(C)o1 ZINC001474658456 1062392463 /nfs/dbraw/zinc/39/24/63/1062392463.db2.gz LYAPNFBNEIPPQB-UHFFFAOYSA-N 1 2 309.331 4.474 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC001459786948 1062400800 /nfs/dbraw/zinc/40/08/00/1062400800.db2.gz HTWGGKJNDIEZRF-JXFKEZNVSA-N 1 2 323.436 4.128 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC001459786948 1062400806 /nfs/dbraw/zinc/40/08/06/1062400806.db2.gz HTWGGKJNDIEZRF-JXFKEZNVSA-N 1 2 323.436 4.128 20 0 DIADLO C[C@@H]([NH2+]CC1(c2cccc(Cl)c2)CCC1)C(=O)OC(C)(C)C ZINC001474672222 1062402781 /nfs/dbraw/zinc/40/27/81/1062402781.db2.gz SEVCMQZDFWWDBH-CYBMUJFWSA-N 1 2 323.864 4.082 20 0 DIADLO CCSCc1ccc[nH+]c1NC1CCC2(CCCO2)CC1 ZINC001474680313 1062410721 /nfs/dbraw/zinc/41/07/21/1062410721.db2.gz VQHSCMLDCBVYFT-UHFFFAOYSA-N 1 2 306.475 4.238 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)nn1)c1cccc(Cl)c1Cl ZINC001459868516 1062459448 /nfs/dbraw/zinc/45/94/48/1062459448.db2.gz JOORNISLNUDJID-QMMMGPOBSA-N 1 2 316.619 4.288 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H]2CCOc3c(F)cccc32)cs1 ZINC001255539779 1062479209 /nfs/dbraw/zinc/47/92/09/1062479209.db2.gz QCTMIVOSBLXTAE-AWEZNQCLSA-N 1 2 306.406 4.019 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)[C@@H](C)CC(F)(F)F ZINC001255665478 1062508850 /nfs/dbraw/zinc/50/88/50/1062508850.db2.gz YJHUZSOJBGRTOK-JSGCOSHPSA-N 1 2 301.352 4.311 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)[C@@H](C)CC(F)(F)F ZINC001255665478 1062508872 /nfs/dbraw/zinc/50/88/72/1062508872.db2.gz YJHUZSOJBGRTOK-JSGCOSHPSA-N 1 2 301.352 4.311 20 0 DIADLO FC(F)(F)c1cccc([C@]2(F)CC[N@H+](C/C=C\Cl)C2)c1 ZINC001460003216 1062562251 /nfs/dbraw/zinc/56/22/51/1062562251.db2.gz NWUXPZCXCZJUFS-XYRDXQRHSA-N 1 2 307.718 4.328 20 0 DIADLO FC(F)(F)c1cccc([C@]2(F)CC[N@@H+](C/C=C\Cl)C2)c1 ZINC001460003216 1062562274 /nfs/dbraw/zinc/56/22/74/1062562274.db2.gz NWUXPZCXCZJUFS-XYRDXQRHSA-N 1 2 307.718 4.328 20 0 DIADLO CCOC(=O)[C@H](CC)[NH2+][C@@H]1CC(C)(C)CCc2ccccc21 ZINC001460009212 1062567590 /nfs/dbraw/zinc/56/75/90/1062567590.db2.gz WWVUDXXFOGWBQO-DLBZAZTESA-N 1 2 303.446 4.022 20 0 DIADLO Cc1coc2ccc(NC(=O)NCc3c[nH+]c(C)cc3C)cc12 ZINC001476438667 1062658578 /nfs/dbraw/zinc/65/85/78/1062658578.db2.gz YEGWRCMZLLVBDK-UHFFFAOYSA-N 1 2 309.369 4.075 20 0 DIADLO FC(F)(F)c1nc([C@H]2CCCC[N@@H+]2C2CCCCCC2)no1 ZINC001255891525 1062659110 /nfs/dbraw/zinc/65/91/10/1062659110.db2.gz XUYYMGOJCFNYGH-GFCCVEGCSA-N 1 2 317.355 4.338 20 0 DIADLO FC(F)(F)c1nc([C@H]2CCCC[N@H+]2C2CCCCCC2)no1 ZINC001255891525 1062659120 /nfs/dbraw/zinc/65/91/20/1062659120.db2.gz XUYYMGOJCFNYGH-GFCCVEGCSA-N 1 2 317.355 4.338 20 0 DIADLO CC(C)C[C@H](C(=O)NC[C@]1(C)CC[C@H](C)C1(C)C)n1cc[nH+]c1 ZINC001469941724 1062665743 /nfs/dbraw/zinc/66/57/43/1062665743.db2.gz VCHBMFUGBUMSON-FCEWJHQRSA-N 1 2 319.493 4.049 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC001460201467 1062696872 /nfs/dbraw/zinc/69/68/72/1062696872.db2.gz HUMKBFNKDZHXJI-DOTOQJQBSA-N 1 2 315.457 4.334 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC001460201467 1062696878 /nfs/dbraw/zinc/69/68/78/1062696878.db2.gz HUMKBFNKDZHXJI-DOTOQJQBSA-N 1 2 315.457 4.334 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CC(C)(C)C[C@H]1C ZINC001460253656 1062733445 /nfs/dbraw/zinc/73/34/45/1062733445.db2.gz YPUKQZSNDHAJMR-IUODEOHRSA-N 1 2 309.837 4.065 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CC(C)(C)C[C@H]1C ZINC001460253656 1062733463 /nfs/dbraw/zinc/73/34/63/1062733463.db2.gz YPUKQZSNDHAJMR-IUODEOHRSA-N 1 2 309.837 4.065 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CC(C)(C)C[C@@H]1C ZINC001460253657 1062734220 /nfs/dbraw/zinc/73/42/20/1062734220.db2.gz YPUKQZSNDHAJMR-SWLSCSKDSA-N 1 2 309.837 4.065 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CC(C)(C)C[C@@H]1C ZINC001460253657 1062734235 /nfs/dbraw/zinc/73/42/35/1062734235.db2.gz YPUKQZSNDHAJMR-SWLSCSKDSA-N 1 2 309.837 4.065 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CC(C)(C)C[C@H]1C ZINC001460253654 1062736148 /nfs/dbraw/zinc/73/61/48/1062736148.db2.gz YPUKQZSNDHAJMR-DOMZBBRYSA-N 1 2 309.837 4.065 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CC(C)(C)C[C@H]1C ZINC001460253654 1062736177 /nfs/dbraw/zinc/73/61/77/1062736177.db2.gz YPUKQZSNDHAJMR-DOMZBBRYSA-N 1 2 309.837 4.065 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCc1ccc(F)cn1 ZINC001256183018 1062742116 /nfs/dbraw/zinc/74/21/16/1062742116.db2.gz AGLVBVDKEICOJW-UHFFFAOYSA-N 1 2 313.401 4.148 20 0 DIADLO Fc1c(F)c(F)c(C[N@@H+]2CC[C@@H](C3CCCC3)C2)c(F)c1F ZINC001460270253 1062746624 /nfs/dbraw/zinc/74/66/24/1062746624.db2.gz ITTVZCGOCWJRBD-SNVBAGLBSA-N 1 2 319.317 4.394 20 0 DIADLO Fc1c(F)c(F)c(C[N@H+]2CC[C@@H](C3CCCC3)C2)c(F)c1F ZINC001460270253 1062746639 /nfs/dbraw/zinc/74/66/39/1062746639.db2.gz ITTVZCGOCWJRBD-SNVBAGLBSA-N 1 2 319.317 4.394 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CN1C[C@H](C)c2ccccc21 ZINC001460283642 1062754578 /nfs/dbraw/zinc/75/45/78/1062754578.db2.gz IQLUABZSSQKMLT-INIZCTEOSA-N 1 2 303.409 4.304 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CN1C[C@@H](C)c2ccccc21 ZINC001460283649 1062755248 /nfs/dbraw/zinc/75/52/48/1062755248.db2.gz IQLUABZSSQKMLT-MRXNPFEDSA-N 1 2 303.409 4.304 20 0 DIADLO C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1Cc2ccccc2NC(=O)C1 ZINC001460301259 1062768846 /nfs/dbraw/zinc/76/88/46/1062768846.db2.gz CCAYUCBCIRENMS-OAHLLOKOSA-N 1 2 322.452 4.499 20 0 DIADLO C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1Cc2ccccc2NC(=O)C1 ZINC001460301259 1062768866 /nfs/dbraw/zinc/76/88/66/1062768866.db2.gz CCAYUCBCIRENMS-OAHLLOKOSA-N 1 2 322.452 4.499 20 0 DIADLO CCSc1ccccc1C[N@H+](C)[C@@H](CC)C(=O)OC(C)(C)C ZINC001460336846 1062788487 /nfs/dbraw/zinc/78/84/87/1062788487.db2.gz WXDIUHTUBBLGJX-HNNXBMFYSA-N 1 2 323.502 4.351 20 0 DIADLO CCSc1ccccc1C[N@@H+](C)[C@@H](CC)C(=O)OC(C)(C)C ZINC001460336846 1062788507 /nfs/dbraw/zinc/78/85/07/1062788507.db2.gz WXDIUHTUBBLGJX-HNNXBMFYSA-N 1 2 323.502 4.351 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@@H+]1CCc2ccc(C(C)C)cc2C1 ZINC001460368726 1062818492 /nfs/dbraw/zinc/81/84/92/1062818492.db2.gz ZIVHXIWFWNTBKZ-GOSISDBHSA-N 1 2 317.473 4.288 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@H+]1CCc2ccc(C(C)C)cc2C1 ZINC001460368726 1062818518 /nfs/dbraw/zinc/81/85/18/1062818518.db2.gz ZIVHXIWFWNTBKZ-GOSISDBHSA-N 1 2 317.473 4.288 20 0 DIADLO CC[C@H]1C[N@H+](CCc2cccc(Cl)c2Cl)[C@@H](CC)CO1 ZINC001460371931 1062818646 /nfs/dbraw/zinc/81/86/46/1062818646.db2.gz RGERLBXUOBCPFV-KBPBESRZSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)[C@@H](CC)CO1 ZINC001460371931 1062818672 /nfs/dbraw/zinc/81/86/72/1062818672.db2.gz RGERLBXUOBCPFV-KBPBESRZSA-N 1 2 316.272 4.425 20 0 DIADLO CCC1(CC)CCC[N@@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001460414449 1062845195 /nfs/dbraw/zinc/84/51/95/1062845195.db2.gz HGLMKPYLNZAPEM-MRXNPFEDSA-N 1 2 323.864 4.456 20 0 DIADLO CCC1(CC)CCC[N@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001460414449 1062845220 /nfs/dbraw/zinc/84/52/20/1062845220.db2.gz HGLMKPYLNZAPEM-MRXNPFEDSA-N 1 2 323.864 4.456 20 0 DIADLO CC(C)(CC[N@@H+]1CCOC[C@H]1c1cc(F)cc(F)c1)C1CC1 ZINC001460438679 1062856504 /nfs/dbraw/zinc/85/65/04/1062856504.db2.gz ABFOTZZIMOZYNQ-KRWDZBQOSA-N 1 2 309.400 4.164 20 0 DIADLO CC(C)(CC[N@H+]1CCOC[C@H]1c1cc(F)cc(F)c1)C1CC1 ZINC001460438679 1062856521 /nfs/dbraw/zinc/85/65/21/1062856521.db2.gz ABFOTZZIMOZYNQ-KRWDZBQOSA-N 1 2 309.400 4.164 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC001460470773 1062870137 /nfs/dbraw/zinc/87/01/37/1062870137.db2.gz VKUCBLZIDBTRJQ-ZETOZRRWSA-N 1 2 303.780 4.146 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC001460470773 1062870156 /nfs/dbraw/zinc/87/01/56/1062870156.db2.gz VKUCBLZIDBTRJQ-ZETOZRRWSA-N 1 2 303.780 4.146 20 0 DIADLO Cc1ccc(-c2nnc([C@H]3CCC[N@@H+]3Cc3ccco3)o2)cc1C ZINC001256555219 1062873014 /nfs/dbraw/zinc/87/30/14/1062873014.db2.gz MWDPHMUIJADTJJ-QGZVFWFLSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1ccc(-c2nnc([C@H]3CCC[N@H+]3Cc3ccco3)o2)cc1C ZINC001256555219 1062873032 /nfs/dbraw/zinc/87/30/32/1062873032.db2.gz MWDPHMUIJADTJJ-QGZVFWFLSA-N 1 2 323.396 4.284 20 0 DIADLO CC(C)c1cccc(C[N@@H+]2C[C@@H](C)O[C@H](CC(F)(F)F)C2)c1 ZINC001460487608 1062876399 /nfs/dbraw/zinc/87/63/99/1062876399.db2.gz WZFAINBKUUGODZ-CZUORRHYSA-N 1 2 315.379 4.352 20 0 DIADLO CC(C)c1cccc(C[N@H+]2C[C@@H](C)O[C@H](CC(F)(F)F)C2)c1 ZINC001460487608 1062876412 /nfs/dbraw/zinc/87/64/12/1062876412.db2.gz WZFAINBKUUGODZ-CZUORRHYSA-N 1 2 315.379 4.352 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCOc2ccc(O)cc2C1 ZINC001460495434 1062883779 /nfs/dbraw/zinc/88/37/79/1062883779.db2.gz PWHAELVTHVMDGU-LBPRGKRZSA-N 1 2 303.789 4.001 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCOc2ccc(O)cc2C1 ZINC001460495434 1062883800 /nfs/dbraw/zinc/88/38/00/1062883800.db2.gz PWHAELVTHVMDGU-LBPRGKRZSA-N 1 2 303.789 4.001 20 0 DIADLO Cc1ccc(-c2nnc([C@H]3CC[N@@H+]3Cc3ccccc3)o2)cc1C ZINC001256577016 1062898814 /nfs/dbraw/zinc/89/88/14/1062898814.db2.gz JDBHJGOISFKOAM-GOSISDBHSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1ccc(-c2nnc([C@H]3CC[N@H+]3Cc3ccccc3)o2)cc1C ZINC001256577016 1062898827 /nfs/dbraw/zinc/89/88/27/1062898827.db2.gz JDBHJGOISFKOAM-GOSISDBHSA-N 1 2 319.408 4.300 20 0 DIADLO CCC(CC)CCC[N@H+](C)[C@@H](C(=O)OC)c1ccc(F)cc1 ZINC001460526594 1062900117 /nfs/dbraw/zinc/90/01/17/1062900117.db2.gz CTSLLFGETFABQK-QGZVFWFLSA-N 1 2 309.425 4.188 20 0 DIADLO CCC(CC)CCC[N@@H+](C)[C@@H](C(=O)OC)c1ccc(F)cc1 ZINC001460526594 1062900139 /nfs/dbraw/zinc/90/01/39/1062900139.db2.gz CTSLLFGETFABQK-QGZVFWFLSA-N 1 2 309.425 4.188 20 0 DIADLO CC(C)C[C@@H](C(=O)N(C)C[C@H](C)C1CCCCC1)n1cc[nH+]c1 ZINC001471014037 1062907162 /nfs/dbraw/zinc/90/71/62/1062907162.db2.gz PEIMKEPZNZNNGO-WMZOPIPTSA-N 1 2 319.493 4.145 20 0 DIADLO CC[NH+](CC)[C@@H](c1nnc([C@H]2C[C@@H]2C)o1)c1ccc(Cl)cc1 ZINC001256683217 1062946045 /nfs/dbraw/zinc/94/60/45/1062946045.db2.gz OBBQEIUCHDAWBF-TUKIKUTGSA-N 1 2 319.836 4.278 20 0 DIADLO Cc1cc(CNC(=O)N[C@@H]2CCC[C@@H]2CCC(C)C)cc(C)[nH+]1 ZINC001477774423 1062968475 /nfs/dbraw/zinc/96/84/75/1062968475.db2.gz YVBDYGMWYKTQRM-QZTJIDSGSA-N 1 2 317.477 4.103 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@H+](Cc1cc(C3CC3)no1)CC2 ZINC001460665091 1062974158 /nfs/dbraw/zinc/97/41/58/1062974158.db2.gz HJVXZDYRQJPRHI-UHFFFAOYSA-N 1 2 302.805 4.072 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@@H+](Cc1cc(C3CC3)no1)CC2 ZINC001460665091 1062974182 /nfs/dbraw/zinc/97/41/82/1062974182.db2.gz HJVXZDYRQJPRHI-UHFFFAOYSA-N 1 2 302.805 4.072 20 0 DIADLO C/C(=C\c1cccc(Cl)c1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001460691873 1062990993 /nfs/dbraw/zinc/99/09/93/1062990993.db2.gz QQPZIXIMPXAGGK-FMIVXFBMSA-N 1 2 311.772 4.030 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)Cc3ccc(F)cc3)cc2)[nH+]c1C ZINC001471592681 1063006503 /nfs/dbraw/zinc/00/65/03/1063006503.db2.gz GKSZWKSUUJYRRQ-UHFFFAOYSA-N 1 2 323.371 4.014 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)C/C=C/c2ccc(C)cc2)[nH+]c1C ZINC001471859759 1063027449 /nfs/dbraw/zinc/02/74/49/1063027449.db2.gz SLCKGQYEQQMUMP-MJICGBHWSA-N 1 2 323.440 4.102 20 0 DIADLO C[C@]1([NH2+]Cc2nccc(Cl)c2Cl)CCOc2ccccc21 ZINC001460823075 1063085215 /nfs/dbraw/zinc/08/52/15/1063085215.db2.gz FUJUJKMWRJSAGW-INIZCTEOSA-N 1 2 323.223 4.176 20 0 DIADLO CC(C)c1occc1C(=O)N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC001472532952 1063097059 /nfs/dbraw/zinc/09/70/59/1063097059.db2.gz NQPHBEWADQJLKI-AWEZNQCLSA-N 1 2 323.396 4.080 20 0 DIADLO CC(C)C[C@@H](C)CC(=O)N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC001472532982 1063097424 /nfs/dbraw/zinc/09/74/24/1063097424.db2.gz OFAWVQZYURTMBZ-CVEARBPZSA-N 1 2 313.445 4.122 20 0 DIADLO C=Cc1ccc(C(=O)N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001472532746 1063098019 /nfs/dbraw/zinc/09/80/19/1063098019.db2.gz KPWNKVDLAVFYJV-HNNXBMFYSA-N 1 2 317.392 4.006 20 0 DIADLO Cl/C=C(\Cl)C[N@@H+]1CCC[C@@]2(C=Cc3ccccc3O2)C1 ZINC001460862327 1063105807 /nfs/dbraw/zinc/10/58/07/1063105807.db2.gz VKOMINSJECUZCC-SCOADAFUSA-N 1 2 310.224 4.246 20 0 DIADLO Cl/C=C(\Cl)C[N@H+]1CCC[C@@]2(C=Cc3ccccc3O2)C1 ZINC001460862327 1063105813 /nfs/dbraw/zinc/10/58/13/1063105813.db2.gz VKOMINSJECUZCC-SCOADAFUSA-N 1 2 310.224 4.246 20 0 DIADLO Cc1cc(N2CCC(c3ccc(O)cc3)CC2)nc(C2CCC2)[nH+]1 ZINC001472652585 1063122350 /nfs/dbraw/zinc/12/23/50/1063122350.db2.gz FOIXGDXPQOEMKO-UHFFFAOYSA-N 1 2 323.440 4.142 20 0 DIADLO CCc1cc(N[C@H](C)COc2c(C)cccc2C)nc(CC)[nH+]1 ZINC001472672309 1063136428 /nfs/dbraw/zinc/13/64/28/1063136428.db2.gz HXUVLBZPDRETDC-OAHLLOKOSA-N 1 2 313.445 4.098 20 0 DIADLO CCOc1cccc([C@H](C)Nc2nc(C)[nH+]c3c2CCCC3)c1 ZINC001472675536 1063141947 /nfs/dbraw/zinc/14/19/47/1063141947.db2.gz QRHNQYZAPHGMFK-ZDUSSCGKSA-N 1 2 311.429 4.236 20 0 DIADLO CCc1cc(N2CCC[C@@H]2c2ccc(F)c(F)c2)nc(CC)[nH+]1 ZINC001472696607 1063159325 /nfs/dbraw/zinc/15/93/25/1063159325.db2.gz MTAQVOMGRDFVMD-MRXNPFEDSA-N 1 2 317.383 4.221 20 0 DIADLO CCc1cc(N[C@@H](C)c2ncc(-c3ccccc3)o2)nc(CC)[nH+]1 ZINC001472702876 1063164224 /nfs/dbraw/zinc/16/42/24/1063164224.db2.gz AKURQAYUVAVKQZ-ZDUSSCGKSA-N 1 2 322.412 4.430 20 0 DIADLO CCc1ccc2c(c1)C[N@@H+](Cc1c(F)ccc(C)c1F)CC2 ZINC001460982255 1063169359 /nfs/dbraw/zinc/16/93/59/1063169359.db2.gz SXOLFXVMKFWBIK-UHFFFAOYSA-N 1 2 301.380 4.394 20 0 DIADLO CCc1ccc2c(c1)C[N@H+](Cc1c(F)ccc(C)c1F)CC2 ZINC001460982255 1063169369 /nfs/dbraw/zinc/16/93/69/1063169369.db2.gz SXOLFXVMKFWBIK-UHFFFAOYSA-N 1 2 301.380 4.394 20 0 DIADLO CCc1nc(N2CCc3cc(-c4ccccc4)oc3C2)cc(C)[nH+]1 ZINC001472714193 1063174097 /nfs/dbraw/zinc/17/40/97/1063174097.db2.gz KBPHGGFHOOMIBO-UHFFFAOYSA-N 1 2 319.408 4.170 20 0 DIADLO Clc1ccc(C[NH2+]Cc2cccnc2Cl)c(Cl)c1 ZINC001460999293 1063174914 /nfs/dbraw/zinc/17/49/14/1063174914.db2.gz MKAKZQWIAIQOSK-UHFFFAOYSA-N 1 2 301.604 4.332 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(S[C@H](C)c3cccc(OC)c3)c12 ZINC001472725937 1063188281 /nfs/dbraw/zinc/18/82/81/1063188281.db2.gz TZOVXVVNTVGSGK-LLVKDONJSA-N 1 2 313.426 4.382 20 0 DIADLO CCC[C@@H](CC1CCCC1)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001461012686 1063189134 /nfs/dbraw/zinc/18/91/34/1063189134.db2.gz YRYNZEWEEREYJD-SFHVURJKSA-N 1 2 302.462 4.311 20 0 DIADLO CC[C@@H](C)n1nc(Nc2nc3ccccc3n3c[nH+]cc23)cc1C ZINC001472741670 1063199478 /nfs/dbraw/zinc/19/94/78/1063199478.db2.gz JDUUFAZCMADHQX-GFCCVEGCSA-N 1 2 320.400 4.102 20 0 DIADLO CCC[C@H](C)[N@@H+]1CCn2cc(-c3ccc(F)cc3)nc2C1(C)C ZINC001257323494 1063205082 /nfs/dbraw/zinc/20/50/82/1063205082.db2.gz CJEVVKDJIAQWRJ-AWEZNQCLSA-N 1 2 315.436 4.429 20 0 DIADLO CCC[C@H](C)[N@H+]1CCn2cc(-c3ccc(F)cc3)nc2C1(C)C ZINC001257323494 1063205104 /nfs/dbraw/zinc/20/51/04/1063205104.db2.gz CJEVVKDJIAQWRJ-AWEZNQCLSA-N 1 2 315.436 4.429 20 0 DIADLO Cc1cc(NC[C@@H]2CCC3(CCCCC3)O2)nc(C2CCC2)[nH+]1 ZINC001472757803 1063212491 /nfs/dbraw/zinc/21/24/91/1063212491.db2.gz XDKBRUWNEZJPFR-INIZCTEOSA-N 1 2 315.461 4.346 20 0 DIADLO CCOc1cccc([C@@H]2C[C@H]2Nc2cc(C)[nH+]c(C3CC3)n2)c1 ZINC001472768554 1063218856 /nfs/dbraw/zinc/21/88/56/1063218856.db2.gz NDUDJGGMUYDYLF-DLBZAZTESA-N 1 2 309.413 4.029 20 0 DIADLO CCc1cc(N2CC[C@@H]2c2ccc(Cl)cc2)nc(CC)[nH+]1 ZINC001472778358 1063227795 /nfs/dbraw/zinc/22/77/95/1063227795.db2.gz FSLCVGAPELVONR-OAHLLOKOSA-N 1 2 301.821 4.206 20 0 DIADLO OC1CC[NH+](c2ccc(NCc3ccccc3C3CC3)cc2)CC1 ZINC001461069893 1063231672 /nfs/dbraw/zinc/23/16/72/1063231672.db2.gz UENSWDRTBGLPQL-UHFFFAOYSA-N 1 2 322.452 4.137 20 0 DIADLO COc1cc(CNc2ccc([NH+](C)C)cc2C)ccc1Cl ZINC001461071560 1063233524 /nfs/dbraw/zinc/23/35/24/1063233524.db2.gz JRGNZJSNLDKSME-UHFFFAOYSA-N 1 2 304.821 4.335 20 0 DIADLO Cn1c(CNc2ccc(N3CCCCC3)c[nH+]2)cc2ccccc21 ZINC001461081632 1063242013 /nfs/dbraw/zinc/24/20/13/1063242013.db2.gz GMYBFOZEKFFVEU-UHFFFAOYSA-N 1 2 320.440 4.176 20 0 DIADLO FC(F)(CNc1nc2ccccc2n2c[nH+]cc12)c1ccccc1 ZINC001472797652 1063245145 /nfs/dbraw/zinc/24/51/45/1063245145.db2.gz HNDPOZYIDVQRNA-UHFFFAOYSA-N 1 2 324.334 4.086 20 0 DIADLO CC(C)c1cc(NCC(C)(C)C2(O)CCCC2)nc(C(C)C)[nH+]1 ZINC001472806817 1063253260 /nfs/dbraw/zinc/25/32/60/1063253260.db2.gz HXWNUBYQYAEXKC-UHFFFAOYSA-N 1 2 319.493 4.467 20 0 DIADLO CC[C@H](Nc1nc(C)[nH+]c(C)c1Br)[C@H]1CC1(C)C ZINC001472809170 1063254315 /nfs/dbraw/zinc/25/43/15/1063254315.db2.gz LFIKLQQYAVJTKJ-MNOVXSKESA-N 1 2 312.255 4.093 20 0 DIADLO CC(C)c1cc(N[C@H]2C[C@@H](OC(C)(C)C)C2)nc(C(C)C)[nH+]1 ZINC001472815347 1063258912 /nfs/dbraw/zinc/25/89/12/1063258912.db2.gz XBISSIGBKZATOO-OKILXGFUSA-N 1 2 305.466 4.481 20 0 DIADLO CC(C)(C)C[C@@H]1C[C@H]1Nc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC001472824766 1063266980 /nfs/dbraw/zinc/26/69/80/1063266980.db2.gz KKTXCZVJZOOONN-XJKSGUPXSA-N 1 2 321.428 4.052 20 0 DIADLO CC[C@H](OCCNc1cc(C)[nH+]c(C2CC2)n1)c1ccccc1 ZINC001472823754 1063267499 /nfs/dbraw/zinc/26/74/99/1063267499.db2.gz MWSNNQDZVTWMGX-KRWDZBQOSA-N 1 2 311.429 4.242 20 0 DIADLO COc1ccccc1[C@@H]1C[C@H]1Nc1cc(C)[nH+]c(C2CCC2)n1 ZINC001472833378 1063271890 /nfs/dbraw/zinc/27/18/90/1063271890.db2.gz LEECBGPFBMMRFR-JKSUJKDBSA-N 1 2 309.413 4.029 20 0 DIADLO CCC[C@H](C)CC[C@H](C)[N@@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001257480106 1063300337 /nfs/dbraw/zinc/30/03/37/1063300337.db2.gz TZSMGWVAIZIDTR-HRCADAONSA-N 1 2 307.482 4.011 20 0 DIADLO CCC[C@H](C)CC[C@H](C)[N@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001257480106 1063300344 /nfs/dbraw/zinc/30/03/44/1063300344.db2.gz TZSMGWVAIZIDTR-HRCADAONSA-N 1 2 307.482 4.011 20 0 DIADLO c1[nH+]cn2c1c(NC[C@H]1CCC=CCCC1)nc1ccccc12 ZINC001472898830 1063306808 /nfs/dbraw/zinc/30/68/08/1063306808.db2.gz NQKLILQCPRRXCZ-HNNXBMFYSA-N 1 2 306.413 4.431 20 0 DIADLO CCCCn1c(SCCC2CCC2)nnc1[C@@H](CC)[NH+](C)C ZINC001472913032 1063312871 /nfs/dbraw/zinc/31/28/71/1063312871.db2.gz MGMRIBFYGBKWTN-OAHLLOKOSA-N 1 2 324.538 4.373 20 0 DIADLO c1ccc(C[N@@H+]2CCCC[C@@H]2c2nnc(C3CCCC3)o2)cc1 ZINC001257537053 1063329685 /nfs/dbraw/zinc/32/96/85/1063329685.db2.gz CUYWQHSMKCOYLI-QGZVFWFLSA-N 1 2 311.429 4.454 20 0 DIADLO c1ccc(C[N@H+]2CCCC[C@@H]2c2nnc(C3CCCC3)o2)cc1 ZINC001257537053 1063329699 /nfs/dbraw/zinc/32/96/99/1063329699.db2.gz CUYWQHSMKCOYLI-QGZVFWFLSA-N 1 2 311.429 4.454 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+]Cc3cccc(Cl)c3Cl)nc2c1 ZINC001461264143 1063374007 /nfs/dbraw/zinc/37/40/07/1063374007.db2.gz MNRYHOFCIREVPG-UHFFFAOYSA-N 1 2 320.223 4.468 20 0 DIADLO Cc1ccc2nc(C[NH2+]Cc3cccc(Cl)c3Cl)[nH]c2c1 ZINC001461264143 1063374029 /nfs/dbraw/zinc/37/40/29/1063374029.db2.gz MNRYHOFCIREVPG-UHFFFAOYSA-N 1 2 320.223 4.468 20 0 DIADLO CC(C)(C)c1cn(Cc2csc(-c3cccs3)n2)c[nH+]1 ZINC001473069473 1063384315 /nfs/dbraw/zinc/38/43/15/1063384315.db2.gz CDPFESZHKIDDAE-UHFFFAOYSA-N 1 2 303.456 4.414 20 0 DIADLO COc1ccc(C[NH2+][C@@H](c2ccccc2)c2cccc(F)c2)o1 ZINC001461287887 1063391159 /nfs/dbraw/zinc/39/11/59/1063391159.db2.gz XSIJZOUWTWFAAN-IBGZPJMESA-N 1 2 311.356 4.307 20 0 DIADLO Cc1cn(C)nc1C[N@H+](Cc1ccc(Cl)c(Cl)c1)C1CC1 ZINC001473115609 1063416898 /nfs/dbraw/zinc/41/68/98/1063416898.db2.gz KMCGSVKFIUUCGB-UHFFFAOYSA-N 1 2 324.255 4.200 20 0 DIADLO Cc1cn(C)nc1C[N@@H+](Cc1ccc(Cl)c(Cl)c1)C1CC1 ZINC001473115609 1063416907 /nfs/dbraw/zinc/41/69/07/1063416907.db2.gz KMCGSVKFIUUCGB-UHFFFAOYSA-N 1 2 324.255 4.200 20 0 DIADLO Cc1nn(C(C)C)c(C)c1CNc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001461332173 1063425184 /nfs/dbraw/zinc/42/51/84/1063425184.db2.gz OMKKGFOAPMOZNW-UHFFFAOYSA-N 1 2 323.444 4.187 20 0 DIADLO COc1ncccc1C[N@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC001473148827 1063453648 /nfs/dbraw/zinc/45/36/48/1063453648.db2.gz IYUPVLZEBWWHFV-CYBMUJFWSA-N 1 2 316.832 4.469 20 0 DIADLO COc1ncccc1C[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC001473148827 1063453653 /nfs/dbraw/zinc/45/36/53/1063453653.db2.gz IYUPVLZEBWWHFV-CYBMUJFWSA-N 1 2 316.832 4.469 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+]Cc1ccccc1Cl)CCC2 ZINC001461379589 1063459000 /nfs/dbraw/zinc/45/90/00/1063459000.db2.gz FTHZEELJNOYCPW-MRXNPFEDSA-N 1 2 303.837 4.285 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+]Cc1ccccc1Cl)CCC2 ZINC001461379587 1063460130 /nfs/dbraw/zinc/46/01/30/1063460130.db2.gz FTHZEELJNOYCPW-INIZCTEOSA-N 1 2 303.837 4.285 20 0 DIADLO CCc1cccc(C[N@@H+]2CCO[C@@H](c3ccccc3Cl)C2)c1 ZINC001473158157 1063463909 /nfs/dbraw/zinc/46/39/09/1063463909.db2.gz GTGHQRNOHUYBER-LJQANCHMSA-N 1 2 315.844 4.476 20 0 DIADLO CCc1cccc(C[N@H+]2CCO[C@@H](c3ccccc3Cl)C2)c1 ZINC001473158157 1063463935 /nfs/dbraw/zinc/46/39/35/1063463935.db2.gz GTGHQRNOHUYBER-LJQANCHMSA-N 1 2 315.844 4.476 20 0 DIADLO Oc1ccc(Cl)c(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC001473168982 1063473489 /nfs/dbraw/zinc/47/34/89/1063473489.db2.gz UJFXBHHXXSQAOP-KRWDZBQOSA-N 1 2 319.857 4.336 20 0 DIADLO Oc1ccc(Cl)c(C[N@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC001473168982 1063473495 /nfs/dbraw/zinc/47/34/95/1063473495.db2.gz UJFXBHHXXSQAOP-KRWDZBQOSA-N 1 2 319.857 4.336 20 0 DIADLO Cc1cc([NH+](C)C)cc(C)c1N[C@@H]1CCc2cccnc2CC1 ZINC001461413335 1063481130 /nfs/dbraw/zinc/48/11/30/1063481130.db2.gz AJFADYHOAJBTSF-QGZVFWFLSA-N 1 2 309.457 4.124 20 0 DIADLO CCCC1CCC(CNc2cc(CSCCO)cc[nH+]2)CC1 ZINC001461417389 1063486114 /nfs/dbraw/zinc/48/61/14/1063486114.db2.gz OKHTWOWGCDUHGL-UHFFFAOYSA-N 1 2 322.518 4.326 20 0 DIADLO CC(C)C[C@H](C)C[C@H](C)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258070327 1063496967 /nfs/dbraw/zinc/49/69/67/1063496967.db2.gz PBOVWWLTAPSCDT-STQMWFEESA-N 1 2 317.399 4.178 20 0 DIADLO CC(C)C[C@H](C)C[C@H](C)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258070327 1063496973 /nfs/dbraw/zinc/49/69/73/1063496973.db2.gz PBOVWWLTAPSCDT-STQMWFEESA-N 1 2 317.399 4.178 20 0 DIADLO FC(F)(C[NH2+]Cc1cc2ccncc2s1)c1ccccc1 ZINC001461543240 1063571398 /nfs/dbraw/zinc/57/13/98/1063571398.db2.gz OCQFCHWBZBNYBZ-UHFFFAOYSA-N 1 2 304.365 4.178 20 0 DIADLO C[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(F)c2ccccc21 ZINC001461554764 1063581045 /nfs/dbraw/zinc/58/10/45/1063581045.db2.gz UIBCTPVNQBYAIN-NSHDSACASA-N 1 2 317.795 4.217 20 0 DIADLO C[C@H](CC(C)(C)SCc1ccco1)[N@H+]1CCC(F)(F)C1 ZINC001258306897 1063603225 /nfs/dbraw/zinc/60/32/25/1063603225.db2.gz VWUQPTCXRRCLGY-GFCCVEGCSA-N 1 2 303.418 4.411 20 0 DIADLO C[C@H](CC(C)(C)SCc1ccco1)[N@@H+]1CCC(F)(F)C1 ZINC001258306897 1063603219 /nfs/dbraw/zinc/60/32/19/1063603219.db2.gz VWUQPTCXRRCLGY-GFCCVEGCSA-N 1 2 303.418 4.411 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N[C@H](c3ccccc3)C(C)(C)C)ccn12 ZINC001514727134 1063606973 /nfs/dbraw/zinc/60/69/73/1063606973.db2.gz WXTDFQFIYAQYAE-GOSISDBHSA-N 1 2 321.424 4.160 20 0 DIADLO FC(F)(F)Oc1cccc(CNc2c[nH+]cc3c2CCCC3)c1 ZINC001461625737 1063621718 /nfs/dbraw/zinc/62/17/18/1063621718.db2.gz BDGJZSHIFYMJMA-UHFFFAOYSA-N 1 2 322.330 4.471 20 0 DIADLO Oc1cc(CNc2c[nH+]cc3c2CCCC3)cc(C(F)(F)F)c1 ZINC001461628184 1063623076 /nfs/dbraw/zinc/62/30/76/1063623076.db2.gz FSFKOYJATUAPGY-UHFFFAOYSA-N 1 2 322.330 4.297 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Oc1cccc(C2CCCCC2)c1 ZINC001461630879 1063623950 /nfs/dbraw/zinc/62/39/50/1063623950.db2.gz JZYDDGHPEWTUPY-UHFFFAOYSA-N 1 2 312.413 4.317 20 0 DIADLO CCCCC(CCCC)[N@@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001258386330 1063628920 /nfs/dbraw/zinc/62/89/20/1063628920.db2.gz XCBDEYZBDCLWSU-HNNXBMFYSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCC(CCCC)[N@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001258386330 1063628925 /nfs/dbraw/zinc/62/89/25/1063628925.db2.gz XCBDEYZBDCLWSU-HNNXBMFYSA-N 1 2 307.482 4.155 20 0 DIADLO Fc1ccc(C(F)(F)C[NH2+]Cc2cccc3ccoc32)cc1 ZINC001461659791 1063643152 /nfs/dbraw/zinc/64/31/52/1063643152.db2.gz LBRPXJPYNZKCEE-UHFFFAOYSA-N 1 2 305.299 4.454 20 0 DIADLO CCCCC[C@@H](CC)[N@@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001258441304 1063657232 /nfs/dbraw/zinc/65/72/32/1063657232.db2.gz HYBWSUPOQQBDAR-HZPDHXFCSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCC[C@@H](CC)[N@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001258441304 1063657246 /nfs/dbraw/zinc/65/72/46/1063657246.db2.gz HYBWSUPOQQBDAR-HZPDHXFCSA-N 1 2 307.482 4.155 20 0 DIADLO COc1ccc(CNc2[nH]c3cc(C)ccc3[nH+]2)cc1Cl ZINC001461707641 1063672286 /nfs/dbraw/zinc/67/22/86/1063672286.db2.gz DFEXZSAATHHEST-UHFFFAOYSA-N 1 2 301.777 4.145 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cccc(Cl)c1N ZINC001461714115 1063673909 /nfs/dbraw/zinc/67/39/09/1063673909.db2.gz XLNMIOKAESUNIK-UHFFFAOYSA-N 1 2 307.850 4.182 20 0 DIADLO Cc1nn(-c2ccccc2)c(C)c1CNc1c[nH+]c(C)c(C)c1 ZINC001461716928 1063675903 /nfs/dbraw/zinc/67/59/03/1063675903.db2.gz RMUSIHCZTLRRLP-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1cccc2c1OCC2 ZINC001461723313 1063677934 /nfs/dbraw/zinc/67/79/34/1063677934.db2.gz AFEUQFNXTAINIG-UHFFFAOYSA-N 1 2 307.397 4.164 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1ccc2nccnc2c1 ZINC001461723967 1063680471 /nfs/dbraw/zinc/68/04/71/1063680471.db2.gz IGNXKZODKJGFNX-UHFFFAOYSA-N 1 2 317.396 4.173 20 0 DIADLO Cc1ncc(CNc2[nH+]c3ccccc3n2CCC(C)C)s1 ZINC001461731124 1063683830 /nfs/dbraw/zinc/68/38/30/1063683830.db2.gz WQWJVRNPKQEVDM-UHFFFAOYSA-N 1 2 314.458 4.459 20 0 DIADLO Cc1cccn2c(CNc3cccc4c(C)nccc34)c[nH+]c12 ZINC001461754106 1063697818 /nfs/dbraw/zinc/69/78/18/1063697818.db2.gz XHYGWBQXCPKMRX-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO Cc1cc(C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)ccc1Cl ZINC001461755227 1063698589 /nfs/dbraw/zinc/69/85/89/1063698589.db2.gz RITAKNHPSOOJEJ-DOTOQJQBSA-N 1 2 305.780 4.210 20 0 DIADLO Clc1cscc1C[NH2+]Cc1cnc(-c2ccccc2)[nH]1 ZINC001461756896 1063699573 /nfs/dbraw/zinc/69/95/73/1063699573.db2.gz WVBVRMNKODTPKR-UHFFFAOYSA-N 1 2 303.818 4.081 20 0 DIADLO COC(=O)[C@@H]([NH2+][C@H]1CCC(C)(C)C1)c1cccc2ccccc21 ZINC001258596266 1063699910 /nfs/dbraw/zinc/69/99/10/1063699910.db2.gz GOCVFUJEMGAFMC-YJBOKZPZSA-N 1 2 311.425 4.222 20 0 DIADLO CC1(C)CC[C@@H]([N@@H+]2CCCC[C@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258604390 1063705216 /nfs/dbraw/zinc/70/52/16/1063705216.db2.gz CAZWQAFJCYOBQY-MNOVXSKESA-N 1 2 317.355 4.194 20 0 DIADLO CC1(C)CC[C@@H]([N@H+]2CCCC[C@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258604390 1063705225 /nfs/dbraw/zinc/70/52/25/1063705225.db2.gz CAZWQAFJCYOBQY-MNOVXSKESA-N 1 2 317.355 4.194 20 0 DIADLO c1nc(C[NH2+][C@@H]2C[C@@H](c3ccccc3)Oc3ccccc32)cs1 ZINC001461794966 1063722846 /nfs/dbraw/zinc/72/28/46/1063722846.db2.gz YKDFZXLTYQQWPE-MJGOQNOKSA-N 1 2 322.433 4.498 20 0 DIADLO CCCCC[C@@H](CCC)[NH2+][C@H](C(=O)OC)[C@@H](C)OC(C)(C)C ZINC001258664447 1063733771 /nfs/dbraw/zinc/73/37/71/1063733771.db2.gz KITFBPFNWXMWKE-OAGGEKHMSA-N 1 2 315.498 4.070 20 0 DIADLO Cc1ccc(CNc2[nH+]c3cc(Cl)ccc3n2C)cc1F ZINC001461821528 1063735066 /nfs/dbraw/zinc/73/50/66/1063735066.db2.gz DBLFGIXXUWITGC-UHFFFAOYSA-N 1 2 303.768 4.286 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1Cl)[N@@H+]1Cc2cccnc2C1 ZINC001258677855 1063745030 /nfs/dbraw/zinc/74/50/30/1063745030.db2.gz IRFVYQXAXJMGTN-LLVKDONJSA-N 1 2 307.224 4.335 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1Cl)[N@H+]1Cc2cccnc2C1 ZINC001258677855 1063745038 /nfs/dbraw/zinc/74/50/38/1063745038.db2.gz IRFVYQXAXJMGTN-LLVKDONJSA-N 1 2 307.224 4.335 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1Cl)[NH+]1CC2(C1)CCCCO2 ZINC001258678960 1063747056 /nfs/dbraw/zinc/74/70/56/1063747056.db2.gz XBFDOPRHESWKFZ-LBPRGKRZSA-N 1 2 314.256 4.179 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1Cl)[N@@H+]1CCC(=O)C(C)(C)C1 ZINC001258684140 1063748214 /nfs/dbraw/zinc/74/82/14/1063748214.db2.gz OKGLNMJLGGZBSY-NSHDSACASA-N 1 2 314.256 4.225 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1Cl)[N@H+]1CCC(=O)C(C)(C)C1 ZINC001258684140 1063748222 /nfs/dbraw/zinc/74/82/22/1063748222.db2.gz OKGLNMJLGGZBSY-NSHDSACASA-N 1 2 314.256 4.225 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1Cl)[N@@H+]1Cc2ccncc2C1 ZINC001258682104 1063749897 /nfs/dbraw/zinc/74/98/97/1063749897.db2.gz KHGCPKZELHBYIN-LLVKDONJSA-N 1 2 307.224 4.335 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1Cl)[N@H+]1Cc2ccncc2C1 ZINC001258682104 1063749912 /nfs/dbraw/zinc/74/99/12/1063749912.db2.gz KHGCPKZELHBYIN-LLVKDONJSA-N 1 2 307.224 4.335 20 0 DIADLO Fc1cccc(/C=C\C[N@@H+]2CCc3c(F)ccc(F)c3C2)c1 ZINC001461869311 1063763950 /nfs/dbraw/zinc/76/39/50/1063763950.db2.gz GPYMUAWNUKTPAN-RQOWECAXSA-N 1 2 303.327 4.175 20 0 DIADLO Fc1cccc(/C=C\C[N@H+]2CCc3c(F)ccc(F)c3C2)c1 ZINC001461869311 1063763957 /nfs/dbraw/zinc/76/39/57/1063763957.db2.gz GPYMUAWNUKTPAN-RQOWECAXSA-N 1 2 303.327 4.175 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3cc(-c4ccccc4)oc3C2)cnc1F ZINC001461880093 1063769341 /nfs/dbraw/zinc/76/93/41/1063769341.db2.gz IYWFWQJWYHMQTC-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1cc(C[N@H+]2CCc3cc(-c4ccccc4)oc3C2)cnc1F ZINC001461880093 1063769355 /nfs/dbraw/zinc/76/93/55/1063769355.db2.gz IYWFWQJWYHMQTC-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2C[C@@H](C)S[C@@H](C)C2)cc1Cl ZINC001461893814 1063782172 /nfs/dbraw/zinc/78/21/72/1063782172.db2.gz BELUUTVONVPLFY-AOOOYVTPSA-N 1 2 320.285 4.328 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2C[C@@H](C)S[C@@H](C)C2)cc1Cl ZINC001461893814 1063782180 /nfs/dbraw/zinc/78/21/80/1063782180.db2.gz BELUUTVONVPLFY-AOOOYVTPSA-N 1 2 320.285 4.328 20 0 DIADLO Fc1cccc([C@@H]2C[N@H+](CCc3cccc(Cl)c3)CCO2)c1 ZINC001461907931 1063792269 /nfs/dbraw/zinc/79/22/69/1063792269.db2.gz IALLXKISFJWSPV-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1cccc([C@@H]2C[N@@H+](CCc3cccc(Cl)c3)CCO2)c1 ZINC001461907931 1063792274 /nfs/dbraw/zinc/79/22/74/1063792274.db2.gz IALLXKISFJWSPV-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Cc1ccc(-c2nnc([C@H]3CC[N@@H+]3Cc3ccccc3)o2)cc1F ZINC001258765980 1063813415 /nfs/dbraw/zinc/81/34/15/1063813415.db2.gz QLRMXQMRLHZJMM-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc(-c2nnc([C@H]3CC[N@H+]3Cc3ccccc3)o2)cc1F ZINC001258765980 1063813430 /nfs/dbraw/zinc/81/34/30/1063813430.db2.gz QLRMXQMRLHZJMM-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Clc1nccc2cc(C[N@@H+]3CCOC4(CCCC4)C3)sc21 ZINC001461932514 1063816572 /nfs/dbraw/zinc/81/65/72/1063816572.db2.gz FSIVIGJLKLNAAG-UHFFFAOYSA-N 1 2 322.861 4.095 20 0 DIADLO Clc1nccc2cc(C[N@H+]3CCOC4(CCCC4)C3)sc21 ZINC001461932514 1063816577 /nfs/dbraw/zinc/81/65/77/1063816577.db2.gz FSIVIGJLKLNAAG-UHFFFAOYSA-N 1 2 322.861 4.095 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@@H](c3ccccc3C)OC[C@@H]2C)o1 ZINC001461936976 1063822618 /nfs/dbraw/zinc/82/26/18/1063822618.db2.gz SZUHNMFCPCACTR-YOEHRIQHSA-N 1 2 317.454 4.272 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@@H](c3ccccc3C)OC[C@@H]2C)o1 ZINC001461936976 1063822629 /nfs/dbraw/zinc/82/26/29/1063822629.db2.gz SZUHNMFCPCACTR-YOEHRIQHSA-N 1 2 317.454 4.272 20 0 DIADLO Cc1nn(C)c(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2C)c1Cl ZINC001461938198 1063822917 /nfs/dbraw/zinc/82/29/17/1063822917.db2.gz LSKHCTTUTFEAAI-AWEZNQCLSA-N 1 2 305.853 4.192 20 0 DIADLO Cc1nn(C)c(C[N@H+](C)[C@@H](C)c2ccc(C)cc2C)c1Cl ZINC001461938198 1063822932 /nfs/dbraw/zinc/82/29/32/1063822932.db2.gz LSKHCTTUTFEAAI-AWEZNQCLSA-N 1 2 305.853 4.192 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)sn1 ZINC001461936951 1063825016 /nfs/dbraw/zinc/82/50/16/1063825016.db2.gz DIECNSCOABOIOV-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)sn1 ZINC001461936951 1063825029 /nfs/dbraw/zinc/82/50/29/1063825029.db2.gz DIECNSCOABOIOV-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO CCc1nc(C[N@H+](C)[C@H](C)c2nccc3ccccc32)cs1 ZINC001461967321 1063845176 /nfs/dbraw/zinc/84/51/76/1063845176.db2.gz BJAKSBMVFWRPDP-CYBMUJFWSA-N 1 2 311.454 4.447 20 0 DIADLO CCc1nc(C[N@@H+](C)[C@H](C)c2nccc3ccccc32)cs1 ZINC001461967321 1063845189 /nfs/dbraw/zinc/84/51/89/1063845189.db2.gz BJAKSBMVFWRPDP-CYBMUJFWSA-N 1 2 311.454 4.447 20 0 DIADLO C[C@@H]1CCC[C@H]([N@@H+]2CCCC[C@@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258824757 1063850815 /nfs/dbraw/zinc/85/08/15/1063850815.db2.gz XAWJXVJYQXAQJJ-GRYCIOLGSA-N 1 2 317.355 4.194 20 0 DIADLO C[C@@H]1CCC[C@H]([N@H+]2CCCC[C@@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258824757 1063850832 /nfs/dbraw/zinc/85/08/32/1063850832.db2.gz XAWJXVJYQXAQJJ-GRYCIOLGSA-N 1 2 317.355 4.194 20 0 DIADLO COc1cnc(F)c(C[N@H+](C)[C@H](C)c2cc3ccccc3o2)c1 ZINC001462035929 1063894045 /nfs/dbraw/zinc/89/40/45/1063894045.db2.gz LOCKKIKYVSXZSS-GFCCVEGCSA-N 1 2 314.360 4.169 20 0 DIADLO COc1cnc(F)c(C[N@@H+](C)[C@H](C)c2cc3ccccc3o2)c1 ZINC001462035929 1063894063 /nfs/dbraw/zinc/89/40/63/1063894063.db2.gz LOCKKIKYVSXZSS-GFCCVEGCSA-N 1 2 314.360 4.169 20 0 DIADLO COC1(C[N@@H+]2CCn3c(cc4cc(Cl)ccc43)C2)CCCC1 ZINC001462093969 1063925673 /nfs/dbraw/zinc/92/56/73/1063925673.db2.gz VEERCIHGAWCODH-UHFFFAOYSA-N 1 2 318.848 4.070 20 0 DIADLO COC1(C[N@H+]2CCn3c(cc4cc(Cl)ccc43)C2)CCCC1 ZINC001462093969 1063925685 /nfs/dbraw/zinc/92/56/85/1063925685.db2.gz VEERCIHGAWCODH-UHFFFAOYSA-N 1 2 318.848 4.070 20 0 DIADLO CC[NH+](CC)[C@@H](C(=O)Oc1ccc(Cl)cc1)c1ccccc1 ZINC001264195984 1064032270 /nfs/dbraw/zinc/03/22/70/1064032270.db2.gz KPYXOUPKDKZAJH-QGZVFWFLSA-N 1 2 317.816 4.329 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@H]1[C@@H]2CCCCCC[C@@H]21 ZINC001264340409 1064078827 /nfs/dbraw/zinc/07/88/27/1064078827.db2.gz TXPMOCMICRVHLN-PIIMJCKOSA-N 1 2 309.413 4.027 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)C1[C@@H]2CCCCCC[C@@H]12 ZINC001264340407 1064079138 /nfs/dbraw/zinc/07/91/38/1064079138.db2.gz TXPMOCMICRVHLN-IAGOWNOFSA-N 1 2 309.413 4.027 20 0 DIADLO CC1(C)CCCC[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001264719902 1064123868 /nfs/dbraw/zinc/12/38/68/1064123868.db2.gz SGMKAXBZGLWRRY-AWEZNQCLSA-N 1 2 315.392 4.166 20 0 DIADLO C[C@@H]1CC[C@@H](CC(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1 ZINC001264831234 1064145071 /nfs/dbraw/zinc/14/50/71/1064145071.db2.gz PEUPWZCSTDOYPD-CHWSQXEVSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(C)c4ccccc34)ccc2[nH+]1 ZINC001264857942 1064151625 /nfs/dbraw/zinc/15/16/25/1064151625.db2.gz NTAJVVCIHZYKFA-UHFFFAOYSA-N 1 2 315.376 4.357 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@@H](c3ccccc3)[C@H](C)C2)c(C)[nH+]1 ZINC001265476310 1064234453 /nfs/dbraw/zinc/23/44/53/1064234453.db2.gz ZOCYBZDNEVVFBA-DNVCBOLYSA-N 1 2 322.452 4.273 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(Br)c(F)c2F)C[C@@H]1C ZINC000701278918 1064244813 /nfs/dbraw/zinc/24/48/13/1064244813.db2.gz CKXNGZNSABFPDK-ZJUUUORDSA-N 1 2 318.205 4.205 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(Br)c(F)c2F)C[C@@H]1C ZINC000701278918 1064244803 /nfs/dbraw/zinc/24/48/03/1064244803.db2.gz CKXNGZNSABFPDK-ZJUUUORDSA-N 1 2 318.205 4.205 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1ccc(Br)c(F)c1F ZINC000701283708 1064244874 /nfs/dbraw/zinc/24/48/74/1064244874.db2.gz SFNMCKRQGDUOOZ-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1ccc(Br)c(F)c1F ZINC000701283708 1064244877 /nfs/dbraw/zinc/24/48/77/1064244877.db2.gz SFNMCKRQGDUOOZ-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO CCc1ccc([C@@H](NC(=O)c2cc3c[nH+]ccc3[nH]2)C(C)C)cc1 ZINC001290485076 1064696230 /nfs/dbraw/zinc/69/62/30/1064696230.db2.gz XEGYJZXUMQUHJI-IBGZPJMESA-N 1 2 321.424 4.252 20 0 DIADLO CCCN(CC1CCCCC1)C(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001291973522 1064752877 /nfs/dbraw/zinc/75/28/77/1064752877.db2.gz MJXWJCTUWQTGRU-SFHVURJKSA-N 1 2 319.493 4.289 20 0 DIADLO Cc1cc(Sc2ccccc2)ccc1NC(=O)Cc1[nH]cc[nH+]1 ZINC001291992103 1064753899 /nfs/dbraw/zinc/75/38/99/1064753899.db2.gz MHYHXBOVGCMALH-UHFFFAOYSA-N 1 2 323.421 4.051 20 0 DIADLO O=C(Cc1cccc(C2CC2)c1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001292296991 1064767403 /nfs/dbraw/zinc/76/74/03/1064767403.db2.gz COBIWDMFUQBYON-UHFFFAOYSA-N 1 2 317.392 4.135 20 0 DIADLO CC1(C)C2CCC1(C(=O)Nc1ccc(-c3[nH]cc[nH+]3)cc1)CC2 ZINC001292300281 1064767533 /nfs/dbraw/zinc/76/75/33/1064767533.db2.gz ZLKDCUIUHWLWDA-UHFFFAOYSA-N 1 2 309.413 4.232 20 0 DIADLO Cc1cccc(C)c1NC(=O)C[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC001294166162 1064852814 /nfs/dbraw/zinc/85/28/14/1064852814.db2.gz GYUKJKQAUZVGRQ-QGZVFWFLSA-N 1 2 319.408 4.187 20 0 DIADLO CC(C)C[C@@H](C(=O)NCC1(CC(C)C)CCCC1)n1cc[nH+]c1 ZINC001294660578 1064879729 /nfs/dbraw/zinc/87/97/29/1064879729.db2.gz RYCZHQDJROSIFG-KRWDZBQOSA-N 1 2 319.493 4.193 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C3CCc4ccccc4CC3)cc2[nH+]1 ZINC001294768762 1064884781 /nfs/dbraw/zinc/88/47/81/1064884781.db2.gz OGLHWXMFBIVYRI-UHFFFAOYSA-N 1 2 319.408 4.005 20 0 DIADLO CCCCCC[C@@](C)(CC)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC001301547296 1065067875 /nfs/dbraw/zinc/06/78/75/1065067875.db2.gz IHFDBSORCANJFI-GOSISDBHSA-N 1 2 307.482 4.121 20 0 DIADLO CCC[C@](C)(CC)C(=O)N1CC[NH2+][C@@H](c2ccc(Cl)cc2)C1 ZINC001301662165 1065070182 /nfs/dbraw/zinc/07/01/82/1065070182.db2.gz NXVXNFGHMXAHPI-AEFFLSMTSA-N 1 2 322.880 4.029 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H](C)c3ccco3)cc2)[nH+]c1C ZINC001303123374 1065107974 /nfs/dbraw/zinc/10/79/74/1065107974.db2.gz YGLXWFNFWPADPV-NSHDSACASA-N 1 2 309.369 4.029 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)/C=C\c3ccsc3)cc2)[nH+]c1C ZINC001303121513 1065108530 /nfs/dbraw/zinc/10/85/30/1065108530.db2.gz ASTZCLLXDHLIPE-BAQGIRSFSA-N 1 2 323.421 4.407 20 0 DIADLO CCCC(=CC(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1)CCC ZINC001303609149 1065119185 /nfs/dbraw/zinc/11/91/85/1065119185.db2.gz QKTGKULFAIGXSR-MRXNPFEDSA-N 1 2 303.450 4.217 20 0 DIADLO CCCC(=CC(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1)CCC ZINC001303609148 1065120036 /nfs/dbraw/zinc/12/00/36/1065120036.db2.gz QKTGKULFAIGXSR-INIZCTEOSA-N 1 2 303.450 4.217 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C[C@@H](C)c1ccco1 ZINC001306837603 1065195575 /nfs/dbraw/zinc/19/55/75/1065195575.db2.gz JVFMRMZCRXPRKI-CYBMUJFWSA-N 1 2 309.369 4.110 20 0 DIADLO CC(C)c1cc(NCCc2nc3ccccc3[nH]2)nc(C(C)C)[nH+]1 ZINC001306917025 1065204085 /nfs/dbraw/zinc/20/40/85/1065204085.db2.gz BJGJSQMBZLZAFV-UHFFFAOYSA-N 1 2 323.444 4.254 20 0 DIADLO Cc1cc(NCCCOCc2ccccc2)nc(C2CCC2)[nH+]1 ZINC001306919423 1065205230 /nfs/dbraw/zinc/20/52/30/1065205230.db2.gz YOLHVJCWXNOYPN-UHFFFAOYSA-N 1 2 311.429 4.071 20 0 DIADLO CCc1cc(NCCc2ccc3ccccc3c2)nc(CC)[nH+]1 ZINC001306927090 1065208501 /nfs/dbraw/zinc/20/85/01/1065208501.db2.gz FDGZKLKAGOQBGP-UHFFFAOYSA-N 1 2 305.425 4.409 20 0 DIADLO Cc1ccc([C@@H](C)Nc2nc3ccccc3n3c[nH+]cc23)cc1 ZINC001306937766 1065212479 /nfs/dbraw/zinc/21/24/79/1065212479.db2.gz SEQXSKTZGFARLH-CQSZACIVSA-N 1 2 302.381 4.364 20 0 DIADLO CC[C@@H](Nc1nc2ccccc2n2c[nH+]cc12)c1nc(C)cs1 ZINC001306962410 1065223637 /nfs/dbraw/zinc/22/36/37/1065223637.db2.gz PCUZBSCYDWRTKC-GFCCVEGCSA-N 1 2 323.425 4.211 20 0 DIADLO CCO[C@H]1C[C@H](N(C)c2cc(CC)[nH+]c(CC)n2)C1(CC)CC ZINC001306990049 1065237942 /nfs/dbraw/zinc/23/79/42/1065237942.db2.gz NGLVXBLLRSHENM-HOTGVXAUSA-N 1 2 319.493 4.021 20 0 DIADLO CCCCO[C@H]1C[C@H](Nc2cc(C)[nH+]c(C3CCC3)n2)C1(C)C ZINC001306989129 1065238041 /nfs/dbraw/zinc/23/80/41/1065238041.db2.gz AUQCYYBIDMPRAI-HOTGVXAUSA-N 1 2 317.477 4.448 20 0 DIADLO CCS[C@@H]1CCCC[C@H]1Nc1nc(C)[nH+]c2c1CCCC2 ZINC001306992540 1065239778 /nfs/dbraw/zinc/23/97/78/1065239778.db2.gz BXFIVZFRQFKOCF-HZPDHXFCSA-N 1 2 305.491 4.140 20 0 DIADLO COCCC1(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)CCC1 ZINC001306991227 1065240413 /nfs/dbraw/zinc/24/04/13/1065240413.db2.gz AUEXBCVLZQRWIU-UHFFFAOYSA-N 1 2 305.466 4.342 20 0 DIADLO CCc1cc(Nc2ccc([N@@H+]3CCCC[C@@H]3C)cc2C)ncn1 ZINC001307001633 1065244892 /nfs/dbraw/zinc/24/48/92/1065244892.db2.gz ZSCALKDHWCPJKT-HNNXBMFYSA-N 1 2 310.445 4.470 20 0 DIADLO CCc1cc(Nc2ccc([N@H+]3CCCC[C@@H]3C)cc2C)ncn1 ZINC001307001633 1065244904 /nfs/dbraw/zinc/24/49/04/1065244904.db2.gz ZSCALKDHWCPJKT-HNNXBMFYSA-N 1 2 310.445 4.470 20 0 DIADLO CO[C@@H]1[C@H](C)[C@H](Nc2cc(C(C)C)[nH+]c(C(C)C)n2)C1(C)C ZINC001307079536 1065251997 /nfs/dbraw/zinc/25/19/97/1065251997.db2.gz XWVUPRXMHFOYOI-UHOFOFEASA-N 1 2 305.466 4.195 20 0 DIADLO CCc1cc(N2CCc3c(F)cc(F)cc3[C@@H]2C)nc(CC)[nH+]1 ZINC001307090466 1065257902 /nfs/dbraw/zinc/25/79/02/1065257902.db2.gz KOROGJHEMYSUBC-NSHDSACASA-N 1 2 317.383 4.003 20 0 DIADLO CCc1cc(N2CCc3c(F)cc(F)cc3[C@H]2C)nc(CC)[nH+]1 ZINC001307090465 1065257948 /nfs/dbraw/zinc/25/79/48/1065257948.db2.gz KOROGJHEMYSUBC-LLVKDONJSA-N 1 2 317.383 4.003 20 0 DIADLO CCc1cc(N(CC)Cc2c[nH]c3ccccc23)nc(CC)[nH+]1 ZINC001307093501 1065260182 /nfs/dbraw/zinc/26/01/82/1065260182.db2.gz CBRIVWHZYIVGRV-UHFFFAOYSA-N 1 2 308.429 4.109 20 0 DIADLO CC[C@H]1CCC[C@H]1CNc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC001307123651 1065273188 /nfs/dbraw/zinc/27/31/88/1065273188.db2.gz ODSGVUFEFFXREC-GJZGRUSLSA-N 1 2 321.428 4.054 20 0 DIADLO Cc1cc(N2CC[C@H](c3ccccc3)C2(C)C)nc(C2CC2)[nH+]1 ZINC001307146823 1065283962 /nfs/dbraw/zinc/28/39/62/1065283962.db2.gz TWTZNDVAHAERTA-QGZVFWFLSA-N 1 2 307.441 4.435 20 0 DIADLO Cc1cc(C)cc(CNc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001307172393 1065293815 /nfs/dbraw/zinc/29/38/15/1065293815.db2.gz NFPHDYKUYHPTBN-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO CC[C@@H](Nc1cc(C(C)C)[nH+]c(C(C)C)n1)[C@@H]1CCCOC1 ZINC001307196170 1065300520 /nfs/dbraw/zinc/30/05/20/1065300520.db2.gz XMGZYXCEHCDBMJ-HUUCEWRRSA-N 1 2 305.466 4.341 20 0 DIADLO CC(=O)c1ccc(OCc2c[nH+]c(N(C)C)c3ccccc23)cc1 ZINC001307255209 1065314701 /nfs/dbraw/zinc/31/47/01/1065314701.db2.gz MXFBXFIOQDGHGV-UHFFFAOYSA-N 1 2 320.392 4.082 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cc(F)ccc2Cl)cc1F ZINC001307412576 1065375865 /nfs/dbraw/zinc/37/58/65/1065375865.db2.gz HISCECVFUDZMQE-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cc(F)ccc2Cl)cc1F ZINC001307412576 1065375879 /nfs/dbraw/zinc/37/58/79/1065375879.db2.gz HISCECVFUDZMQE-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO Fc1ccc(OC2CC[NH+](CC=C(Cl)Cl)CC2)c(F)c1 ZINC001307418468 1065380292 /nfs/dbraw/zinc/38/02/92/1065380292.db2.gz JKCWMAJJRHOHPP-UHFFFAOYSA-N 1 2 322.182 4.127 20 0 DIADLO COCC[N@H+](Cc1ccc(C)cc1C)Cc1c(F)cccc1F ZINC001307435810 1065398023 /nfs/dbraw/zinc/39/80/23/1065398023.db2.gz QUSJTRXVXIMRJV-UHFFFAOYSA-N 1 2 319.395 4.230 20 0 DIADLO COCC[N@@H+](Cc1ccc(C)cc1C)Cc1c(F)cccc1F ZINC001307435810 1065398029 /nfs/dbraw/zinc/39/80/29/1065398029.db2.gz QUSJTRXVXIMRJV-UHFFFAOYSA-N 1 2 319.395 4.230 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@@H](C)CC1 ZINC001307441229 1065401553 /nfs/dbraw/zinc/40/15/53/1065401553.db2.gz YKGJXLWHZZLBES-CZUORRHYSA-N 1 2 309.837 4.066 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H](C)CC1 ZINC001307441229 1065401555 /nfs/dbraw/zinc/40/15/55/1065401555.db2.gz YKGJXLWHZZLBES-CZUORRHYSA-N 1 2 309.837 4.066 20 0 DIADLO C[C@H]1c2c(Cl)cc(Cl)cc2CC[N@H+]1CCOCC1CC1 ZINC001307519395 1065459953 /nfs/dbraw/zinc/45/99/53/1065459953.db2.gz DWWYRFGDNMXFQY-NSHDSACASA-N 1 2 314.256 4.339 20 0 DIADLO C[C@H]1c2c(Cl)cc(Cl)cc2CC[N@@H+]1CCOCC1CC1 ZINC001307519395 1065459960 /nfs/dbraw/zinc/45/99/60/1065459960.db2.gz DWWYRFGDNMXFQY-NSHDSACASA-N 1 2 314.256 4.339 20 0 DIADLO Fc1ccc2c(c1)CC[N@@H+](Cc1ccccc1C(F)(F)F)C2 ZINC001307591062 1065500486 /nfs/dbraw/zinc/50/04/86/1065500486.db2.gz DOHJLACOHQPFIJ-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Fc1ccc2c(c1)CC[N@H+](Cc1ccccc1C(F)(F)F)C2 ZINC001307591062 1065500497 /nfs/dbraw/zinc/50/04/97/1065500497.db2.gz DOHJLACOHQPFIJ-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)c(F)c2)C[C@H](C)O1 ZINC001307621115 1065522862 /nfs/dbraw/zinc/52/28/62/1065522862.db2.gz GVHWTAUVZKSENA-GASCZTMLSA-N 1 2 315.388 4.227 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Oc3ccccc3)c(F)c2)C[C@H](C)O1 ZINC001307621115 1065522870 /nfs/dbraw/zinc/52/28/70/1065522870.db2.gz GVHWTAUVZKSENA-GASCZTMLSA-N 1 2 315.388 4.227 20 0 DIADLO CC1=CC[N@H+](Cc2cccc(Cl)c2Br)CC1 ZINC001307650663 1065542129 /nfs/dbraw/zinc/54/21/29/1065542129.db2.gz AKBBLAABLVGIIW-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO CC1=CC[N@@H+](Cc2cccc(Cl)c2Br)CC1 ZINC001307650663 1065542144 /nfs/dbraw/zinc/54/21/44/1065542144.db2.gz AKBBLAABLVGIIW-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO C[N@H+](Cc1ccccc1F)[C@@]1(c2ccccc2)CCCCC1=O ZINC001307689900 1065563576 /nfs/dbraw/zinc/56/35/76/1065563576.db2.gz OWMLELDTHIBICN-HXUWFJFHSA-N 1 2 311.400 4.296 20 0 DIADLO C[N@@H+](Cc1ccccc1F)[C@@]1(c2ccccc2)CCCCC1=O ZINC001307689900 1065563581 /nfs/dbraw/zinc/56/35/81/1065563581.db2.gz OWMLELDTHIBICN-HXUWFJFHSA-N 1 2 311.400 4.296 20 0 DIADLO CCc1ccc(N(Cc2cc(OC)cc(C)[nH+]2)CC2CC2)cc1 ZINC001307781531 1065618651 /nfs/dbraw/zinc/61/86/51/1065618651.db2.gz MZHIGPRSXFIXIA-UHFFFAOYSA-N 1 2 310.441 4.378 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccn2)Cc2ccccc2C)sn1 ZINC001307795736 1065625365 /nfs/dbraw/zinc/62/53/65/1065625365.db2.gz JHGFXGZCKNRLAY-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccn2)Cc2ccccc2C)sn1 ZINC001307795736 1065625372 /nfs/dbraw/zinc/62/53/72/1065625372.db2.gz JHGFXGZCKNRLAY-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](Cc1ccccc1C1CC1)C1CC1 ZINC001307833478 1065643820 /nfs/dbraw/zinc/64/38/20/1065643820.db2.gz MZIUMSHKNRBTKO-AWEZNQCLSA-N 1 2 315.457 4.259 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](Cc1ccccc1C1CC1)C1CC1 ZINC001307833478 1065643825 /nfs/dbraw/zinc/64/38/25/1065643825.db2.gz MZIUMSHKNRBTKO-AWEZNQCLSA-N 1 2 315.457 4.259 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2F)CC2(CCCCC2)O1 ZINC001307884829 1065667789 /nfs/dbraw/zinc/66/77/89/1065667789.db2.gz FCYXVXHXHNMVDW-CYBMUJFWSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2F)CC2(CCCCC2)O1 ZINC001307884829 1065667795 /nfs/dbraw/zinc/66/77/95/1065667795.db2.gz FCYXVXHXHNMVDW-CYBMUJFWSA-N 1 2 311.828 4.403 20 0 DIADLO Clc1cc(Cl)c2nc(C[N@@H+]3CCC34CCCC4)cn2c1 ZINC001307906413 1065676526 /nfs/dbraw/zinc/67/65/26/1065676526.db2.gz YXAXCEBHVSIGCN-UHFFFAOYSA-N 1 2 310.228 4.160 20 0 DIADLO Clc1cc(Cl)c2nc(C[N@H+]3CCC34CCCC4)cn2c1 ZINC001307906413 1065676531 /nfs/dbraw/zinc/67/65/31/1065676531.db2.gz YXAXCEBHVSIGCN-UHFFFAOYSA-N 1 2 310.228 4.160 20 0 DIADLO FC(F)[C@@H]([NH2+]Cc1ccc(-n2ccnc2)cc1)C1CCCCC1 ZINC001307944930 1065693124 /nfs/dbraw/zinc/69/31/24/1065693124.db2.gz MVVACGVXCXRTSP-KRWDZBQOSA-N 1 2 319.399 4.176 20 0 DIADLO OCCCCCCC[NH2+][C@H](c1cccc(Cl)c1)C(F)F ZINC001308029449 1065730711 /nfs/dbraw/zinc/73/07/11/1065730711.db2.gz KLUMPDJTMXUMCL-CQSZACIVSA-N 1 2 305.796 4.179 20 0 DIADLO CCc1ccc2c(c1)CC[N@@H+](Cc1nc(C)c3ccccc3n1)C2 ZINC001308169424 1065788230 /nfs/dbraw/zinc/78/82/30/1065788230.db2.gz BUTAVAQMYJLTOB-UHFFFAOYSA-N 1 2 317.436 4.059 20 0 DIADLO CCc1ccc2c(c1)CC[N@H+](Cc1nc(C)c3ccccc3n1)C2 ZINC001308169424 1065788243 /nfs/dbraw/zinc/78/82/43/1065788243.db2.gz BUTAVAQMYJLTOB-UHFFFAOYSA-N 1 2 317.436 4.059 20 0 DIADLO c1c2cnccc2oc1C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC001308181072 1065791113 /nfs/dbraw/zinc/79/11/13/1065791113.db2.gz SCNDFCQXTSQUIF-FQEVSTJZSA-N 1 2 315.376 4.102 20 0 DIADLO CCc1nc(C[NH2+][C@H](c2nc3ccccc3[nH]2)C(C)C)cs1 ZINC001308201534 1065810481 /nfs/dbraw/zinc/81/04/81/1065810481.db2.gz LBHBVCWOPVTCIA-INIZCTEOSA-N 1 2 314.458 4.069 20 0 DIADLO CCc1[nH]nc(Cl)c1C[NH2+]Cc1c(Cl)cccc1Cl ZINC001308229587 1065835920 /nfs/dbraw/zinc/83/59/20/1065835920.db2.gz ITYWHHRTRJCQHG-UHFFFAOYSA-N 1 2 318.635 4.222 20 0 DIADLO CC(C)Cc1ccc(CNc2ccc(N3CCCCC3)[nH+]c2)cn1 ZINC001308339246 1065923498 /nfs/dbraw/zinc/92/34/98/1065923498.db2.gz IIGWEUTUMFJUAB-UHFFFAOYSA-N 1 2 324.472 4.278 20 0 DIADLO Fc1cccc(/C=C/CNc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001308339491 1065924663 /nfs/dbraw/zinc/92/46/63/1065924663.db2.gz RSBAWCAENDTNJT-FNORWQNLSA-N 1 2 311.404 4.336 20 0 DIADLO Cc1cccn2c(CN[C@@H](CC(C)(C)C)C(F)(F)F)c[nH+]c12 ZINC001308353730 1065934899 /nfs/dbraw/zinc/93/48/99/1065934899.db2.gz TWUBXDXGARNJJW-ZDUSSCGKSA-N 1 2 313.367 4.099 20 0 DIADLO Clc1cc(Cl)cc(CNC[C@H]2CCCC[N@@H+]2C2CC2)c1 ZINC001308395270 1065961778 /nfs/dbraw/zinc/96/17/78/1065961778.db2.gz LUROSKSRDGXTRN-MRXNPFEDSA-N 1 2 313.272 4.100 20 0 DIADLO Clc1cc(Cl)cc(CNC[C@H]2CCCC[N@H+]2C2CC2)c1 ZINC001308395270 1065961787 /nfs/dbraw/zinc/96/17/87/1065961787.db2.gz LUROSKSRDGXTRN-MRXNPFEDSA-N 1 2 313.272 4.100 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nccn2-c2ccccc2)c(F)c1 ZINC001308420964 1065977265 /nfs/dbraw/zinc/97/72/65/1065977265.db2.gz MWWVQODIAHZJPN-HNNXBMFYSA-N 1 2 309.388 4.171 20 0 DIADLO Cc1cc(CNc2ccc(Oc3cccnc3)cc2)cc(C)[nH+]1 ZINC001308426743 1065979757 /nfs/dbraw/zinc/97/97/57/1065979757.db2.gz VLXHDMXNKGIEMU-UHFFFAOYSA-N 1 2 305.381 4.498 20 0 DIADLO CC(C)(C)C(F)(F)C[NH2+]Cc1cccc(OC(F)(F)F)c1 ZINC001308471650 1066011624 /nfs/dbraw/zinc/01/16/24/1066011624.db2.gz QNQZIGJKGORWFO-UHFFFAOYSA-N 1 2 311.294 4.356 20 0 DIADLO Cc1nc(F)ccc1CNc1ccc(Nc2ccccc2)c[nH+]1 ZINC001308473079 1066012017 /nfs/dbraw/zinc/01/20/17/1066012017.db2.gz WWWBLPRUTVCTEO-UHFFFAOYSA-N 1 2 308.360 4.280 20 0 DIADLO Cc1ccc(C[NH2+]Cc2oc3ccccc3c2Br)o1 ZINC001308478899 1066019109 /nfs/dbraw/zinc/01/91/09/1066019109.db2.gz IKRURROHLFDPSC-UHFFFAOYSA-N 1 2 320.186 4.387 20 0 DIADLO Cc1cc(NCc2ccccc2OCc2cccnc2)c[nH+]c1C ZINC001308503712 1066032907 /nfs/dbraw/zinc/03/29/07/1066032907.db2.gz RNRFKMVASMRSIU-UHFFFAOYSA-N 1 2 319.408 4.285 20 0 DIADLO COc1cccc2[nH]c(NCc3ccc4ccccc4c3)[nH+]c21 ZINC001308507944 1066035062 /nfs/dbraw/zinc/03/50/62/1066035062.db2.gz MOAOUGBSUWCPMK-UHFFFAOYSA-N 1 2 303.365 4.337 20 0 DIADLO CC(C)[N@H+](Cc1ccnn1CC1CCC1)Cc1ccccc1F ZINC001308570040 1066082489 /nfs/dbraw/zinc/08/24/89/1066082489.db2.gz CBQIVPYYZHROKT-UHFFFAOYSA-N 1 2 315.436 4.233 20 0 DIADLO CC(C)[N@@H+](Cc1ccnn1CC1CCC1)Cc1ccccc1F ZINC001308570040 1066082502 /nfs/dbraw/zinc/08/25/02/1066082502.db2.gz CBQIVPYYZHROKT-UHFFFAOYSA-N 1 2 315.436 4.233 20 0 DIADLO CC1(C)C[N@H+](Cc2nc(-c3ccccc3)c[nH]2)Cc2ccccc21 ZINC001308578176 1066094907 /nfs/dbraw/zinc/09/49/07/1066094907.db2.gz ZCZNFBFUMFVJCN-UHFFFAOYSA-N 1 2 317.436 4.370 20 0 DIADLO CC1(C)C[N@@H+](Cc2nc(-c3ccccc3)c[nH]2)Cc2ccccc21 ZINC001308578176 1066094917 /nfs/dbraw/zinc/09/49/17/1066094917.db2.gz ZCZNFBFUMFVJCN-UHFFFAOYSA-N 1 2 317.436 4.370 20 0 DIADLO Cc1nn(-c2ccccc2Cl)cc1C[NH+]1Cc2ccccc2C1 ZINC001308586634 1066101909 /nfs/dbraw/zinc/10/19/09/1066101909.db2.gz QCTIWGIWLQHVIK-UHFFFAOYSA-N 1 2 323.827 4.350 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Oc3ccccc3)o2)CC(C)(C)O1 ZINC001308593307 1066106068 /nfs/dbraw/zinc/10/60/68/1066106068.db2.gz QZPZVFPQPVCPBB-AWEZNQCLSA-N 1 2 301.386 4.071 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)o2)CC(C)(C)O1 ZINC001308593307 1066106072 /nfs/dbraw/zinc/10/60/72/1066106072.db2.gz QZPZVFPQPVCPBB-AWEZNQCLSA-N 1 2 301.386 4.071 20 0 DIADLO CCCC[N@H+](Cc1cn(C)nc1Cl)[C@@H](C)c1ccc(C)o1 ZINC001308624205 1066123212 /nfs/dbraw/zinc/12/32/12/1066123212.db2.gz KXNJMACQAASLAQ-ZDUSSCGKSA-N 1 2 309.841 4.338 20 0 DIADLO CCCC[N@@H+](Cc1cn(C)nc1Cl)[C@@H](C)c1ccc(C)o1 ZINC001308624205 1066123215 /nfs/dbraw/zinc/12/32/15/1066123215.db2.gz KXNJMACQAASLAQ-ZDUSSCGKSA-N 1 2 309.841 4.338 20 0 DIADLO CC(C)[C@H]1C[N@H+](CCCc2c(Cl)cccc2Cl)CCO1 ZINC001308639435 1066132470 /nfs/dbraw/zinc/13/24/70/1066132470.db2.gz BZLJWMHIEMWCCU-MRXNPFEDSA-N 1 2 316.272 4.283 20 0 DIADLO CC(C)[C@H]1C[N@@H+](CCCc2c(Cl)cccc2Cl)CCO1 ZINC001308639435 1066132474 /nfs/dbraw/zinc/13/24/74/1066132474.db2.gz BZLJWMHIEMWCCU-MRXNPFEDSA-N 1 2 316.272 4.283 20 0 DIADLO COc1cc([NH2+]CC(C(C)C)C(C)C)c(OC)c(C)c1OC ZINC001308718892 1066197472 /nfs/dbraw/zinc/19/74/72/1066197472.db2.gz ZOAATWBKMODFKT-UHFFFAOYSA-N 1 2 309.450 4.361 20 0 DIADLO CC[C@]1(C)CCC[C@@H]1Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)[nH+]c1 ZINC001308732614 1066206108 /nfs/dbraw/zinc/20/61/08/1066206108.db2.gz SIDHKMNGZKJHPM-IIHSZXCVSA-N 1 2 317.477 4.076 20 0 DIADLO COc1cccc(-c2csc(C[N@@H+]3CCC[C@](C)(F)C3)n2)c1 ZINC001308781567 1066256056 /nfs/dbraw/zinc/25/60/56/1066256056.db2.gz HOWOVNDXUAICMV-KRWDZBQOSA-N 1 2 320.433 4.143 20 0 DIADLO COc1cccc(-c2csc(C[N@H+]3CCC[C@](C)(F)C3)n2)c1 ZINC001308781567 1066256071 /nfs/dbraw/zinc/25/60/71/1066256071.db2.gz HOWOVNDXUAICMV-KRWDZBQOSA-N 1 2 320.433 4.143 20 0 DIADLO CCCn1c[nH+]cc1CNc1cc(C(F)(F)F)c(F)cc1C ZINC001308805683 1066281234 /nfs/dbraw/zinc/28/12/34/1066281234.db2.gz YLAPBFCJLBPPNJ-UHFFFAOYSA-N 1 2 315.314 4.372 20 0 DIADLO CCCc1cccc(C[NH+]2CC(OCCCc3ccccc3)C2)c1 ZINC001308807894 1066283459 /nfs/dbraw/zinc/28/34/59/1066283459.db2.gz BLMRFZRRMKGRLW-UHFFFAOYSA-N 1 2 323.480 4.473 20 0 DIADLO CC[N@H+](Cc1nc2c(s1)C[C@H](C)CC2)Cc1occc1C ZINC001308822249 1066296691 /nfs/dbraw/zinc/29/66/91/1066296691.db2.gz BFGCSACHQTXIDL-GFCCVEGCSA-N 1 2 304.459 4.191 20 0 DIADLO CC[N@@H+](Cc1nc2c(s1)C[C@H](C)CC2)Cc1occc1C ZINC001308822249 1066296707 /nfs/dbraw/zinc/29/67/07/1066296707.db2.gz BFGCSACHQTXIDL-GFCCVEGCSA-N 1 2 304.459 4.191 20 0 DIADLO Fc1cccc(C2CC(Nc3ccc(N4CCCC4)c[nH+]3)C2)c1 ZINC001308829614 1066305163 /nfs/dbraw/zinc/30/51/63/1066305163.db2.gz BWQGGPWMHBDFNC-UHFFFAOYSA-N 1 2 311.404 4.179 20 0 DIADLO Fc1nccc(Cl)c1C[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC001308866604 1066347136 /nfs/dbraw/zinc/34/71/36/1066347136.db2.gz FYNIDJHMAPAFGB-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO Cc1ccc(CC2C[NH+](Cc3cncc(Cl)c3Cl)C2)cc1 ZINC001308867194 1066349975 /nfs/dbraw/zinc/34/99/75/1066349975.db2.gz LIBJTXKZNLYJHM-UHFFFAOYSA-N 1 2 321.251 4.371 20 0 DIADLO CCCSC[C@@H](C)[NH2+]CC(F)(F)c1cc(F)cc(F)c1 ZINC001308917467 1066396336 /nfs/dbraw/zinc/39/63/36/1066396336.db2.gz IIWNBMXGWLIEAU-SNVBAGLBSA-N 1 2 309.372 4.178 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2c(F)ccc(F)c2Cl)C1 ZINC001308928165 1066403169 /nfs/dbraw/zinc/40/31/69/1066403169.db2.gz NHFYFLDCHMOUPP-GFCCVEGCSA-N 1 2 313.697 4.393 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2c(F)ccc(F)c2Cl)C1 ZINC001308928165 1066403175 /nfs/dbraw/zinc/40/31/75/1066403175.db2.gz NHFYFLDCHMOUPP-GFCCVEGCSA-N 1 2 313.697 4.393 20 0 DIADLO COC(=O)[C@@H]([NH2+]C[C@@H](C)C(C)(C)C)c1cccc2ccccc21 ZINC001308940020 1066410267 /nfs/dbraw/zinc/41/02/67/1066410267.db2.gz MNRYXCPYJCUHEU-KDOFPFPSSA-N 1 2 313.441 4.326 20 0 DIADLO CC(C)n1c[nH+]cc1CN[C@@H](c1cccc(Cl)c1)C(F)F ZINC001308939898 1066410369 /nfs/dbraw/zinc/41/03/69/1066410369.db2.gz SBPCVVMOMWCUEK-AWEZNQCLSA-N 1 2 313.779 4.213 20 0 DIADLO CCCC[C@H](CCC)NC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001310256222 1066505259 /nfs/dbraw/zinc/50/52/59/1066505259.db2.gz TWWGPCPSZJKYQK-AWEZNQCLSA-N 1 2 302.422 4.123 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2c3ccccc3CC[C@@H]2C)c(C)[nH+]1 ZINC001310833689 1066567046 /nfs/dbraw/zinc/56/70/46/1066567046.db2.gz CWOALOUKQWIKKN-HXPMCKFVSA-N 1 2 323.440 4.452 20 0 DIADLO COc1ccc([C@H](Nc2cccc[nH+]2)c2ccccc2OC)cc1 ZINC000130648594 334929903 /nfs/dbraw/zinc/92/99/03/334929903.db2.gz YEXHEOGIJDTPDO-FQEVSTJZSA-N 1 2 320.392 4.300 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](Cc1nccn1C)C1CC1 ZINC000076745487 185038914 /nfs/dbraw/zinc/03/89/14/185038914.db2.gz RGKPKYYYIUQMNI-LBPRGKRZSA-N 1 2 323.362 4.165 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](Cc1nccn1C)C1CC1 ZINC000076745487 185038916 /nfs/dbraw/zinc/03/89/16/185038916.db2.gz RGKPKYYYIUQMNI-LBPRGKRZSA-N 1 2 323.362 4.165 20 0 DIADLO COc1ccc(C[NH2+][C@H](C)c2csc(C(C)C)n2)c(OC)c1 ZINC000076900721 185052135 /nfs/dbraw/zinc/05/21/35/185052135.db2.gz UUOXGCKQKQZITI-GFCCVEGCSA-N 1 2 320.458 4.135 20 0 DIADLO COc1ccc(C[NH2+][C@@H](C)c2csc(C(C)C)n2)c(OC)c1 ZINC000076900727 185052164 /nfs/dbraw/zinc/05/21/64/185052164.db2.gz UUOXGCKQKQZITI-LBPRGKRZSA-N 1 2 320.458 4.135 20 0 DIADLO CC(C)c1noc([C@@H](C)[NH2+][C@H](C)c2ccc3c(c2)CCCC3)n1 ZINC000079291100 185163572 /nfs/dbraw/zinc/16/35/72/185163572.db2.gz CNABWMNDTNFPQN-ZIAGYGMSSA-N 1 2 313.445 4.484 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)C)no2)cc1 ZINC000079304732 185164114 /nfs/dbraw/zinc/16/41/14/185164114.db2.gz TUTRNZHJFLSZMQ-KGLIPLIRSA-N 1 2 317.433 4.392 20 0 DIADLO FC(F)(F)C1CC[NH+](Cc2nc(Cl)ccc2Cl)CC1 ZINC000088420055 185249565 /nfs/dbraw/zinc/24/95/65/185249565.db2.gz BBDDRLKSRCEHHF-UHFFFAOYSA-N 1 2 313.150 4.163 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1nc(C3CC3)cs1)CCCO2 ZINC000090459850 185297739 /nfs/dbraw/zinc/29/77/39/185297739.db2.gz UWSOUCFNMCQSPE-CQSZACIVSA-N 1 2 318.417 4.163 20 0 DIADLO c1c[nH+]c([C@@H]2CCCCN2Cc2nc(-c3ccccc3)cs2)[nH]1 ZINC000092729166 185336439 /nfs/dbraw/zinc/33/64/39/185336439.db2.gz TWCKCHDAHCMRHA-INIZCTEOSA-N 1 2 324.453 4.260 20 0 DIADLO Cc1ccc(-c2nc(C[NH+]3CC(C)(C)OC(C)(C)C3)co2)cc1 ZINC000442897601 338439005 /nfs/dbraw/zinc/43/90/05/338439005.db2.gz YIYLFHPFSCWIDU-UHFFFAOYSA-N 1 2 314.429 4.039 20 0 DIADLO Cc1cc(N2CCCC[C@@H]2c2nccs2)nc(C(C)C)[nH+]1 ZINC000133940340 334973936 /nfs/dbraw/zinc/97/39/36/334973936.db2.gz BDMZLCXEIDEJSS-CYBMUJFWSA-N 1 2 302.447 4.097 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(C)o1)c1nc(C(F)(F)F)cs1 ZINC000072926709 191252063 /nfs/dbraw/zinc/25/20/63/191252063.db2.gz SYJIABPWJWJIRX-SNVBAGLBSA-N 1 2 304.337 4.304 20 0 DIADLO Cc1cccn2cc(CNc3cccc(C(F)(F)F)c3)[nH+]c12 ZINC000005588643 181261220 /nfs/dbraw/zinc/26/12/20/181261220.db2.gz VSCGJDLDRGASPJ-UHFFFAOYSA-N 1 2 305.303 4.274 20 0 DIADLO Cc1nc(C[N@@H+](Cc2cccs2)C[C@@H]2CCCO2)sc1C ZINC000081646024 192305797 /nfs/dbraw/zinc/30/57/97/192305797.db2.gz ISPAQVKZKJCHQL-AWEZNQCLSA-N 1 2 322.499 4.003 20 0 DIADLO Cc1nc(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)sc1C ZINC000081646024 192305800 /nfs/dbraw/zinc/30/58/00/192305800.db2.gz ISPAQVKZKJCHQL-AWEZNQCLSA-N 1 2 322.499 4.003 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2n1C)c1cccc(F)c1F ZINC000091409480 193051515 /nfs/dbraw/zinc/05/15/15/193051515.db2.gz GXMIHXPIYABVET-NEPJUHHUSA-N 1 2 315.367 4.263 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2nc3c(s2)CCCC3)cs1 ZINC000091723596 193097070 /nfs/dbraw/zinc/09/70/70/193097070.db2.gz IXMTUTXFDQPLHB-QWRGUYRKSA-N 1 2 321.515 4.453 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2nc3c(s2)CCCC3)cs1 ZINC000091723594 193097170 /nfs/dbraw/zinc/09/71/70/193097170.db2.gz IXMTUTXFDQPLHB-MNOVXSKESA-N 1 2 321.515 4.453 20 0 DIADLO Cc1ccc(C[C@@H]([NH2+][C@H](C)c2nccs2)c2ccccn2)cc1 ZINC000091725247 193098463 /nfs/dbraw/zinc/09/84/63/193098463.db2.gz DXQBJQSODOSKLE-CRAIPNDOSA-N 1 2 323.465 4.481 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)[C@H](C)c1ccncc1 ZINC000091986640 193137606 /nfs/dbraw/zinc/13/76/06/193137606.db2.gz LZCWBNPHBZKRBI-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)[C@H](C)c1ccncc1 ZINC000091986640 193137608 /nfs/dbraw/zinc/13/76/08/193137608.db2.gz LZCWBNPHBZKRBI-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1csc(-c2ccccn2)n1 ZINC000092224859 193176237 /nfs/dbraw/zinc/17/62/37/193176237.db2.gz LNJKPLPTXLKHRW-KRWDZBQOSA-N 1 2 324.453 4.183 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1csc(-c2ccccn2)n1 ZINC000092224859 193176238 /nfs/dbraw/zinc/17/62/38/193176238.db2.gz LNJKPLPTXLKHRW-KRWDZBQOSA-N 1 2 324.453 4.183 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1csc(-c2ccccn2)n1 ZINC000092224860 193176472 /nfs/dbraw/zinc/17/64/72/193176472.db2.gz LNJKPLPTXLKHRW-QGZVFWFLSA-N 1 2 324.453 4.183 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1csc(-c2ccccn2)n1 ZINC000092224860 193176474 /nfs/dbraw/zinc/17/64/74/193176474.db2.gz LNJKPLPTXLKHRW-QGZVFWFLSA-N 1 2 324.453 4.183 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000092223906 193176762 /nfs/dbraw/zinc/17/67/62/193176762.db2.gz MPXFMZSDBRCRME-NSHDSACASA-N 1 2 315.364 4.140 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000092223906 193176764 /nfs/dbraw/zinc/17/67/64/193176764.db2.gz MPXFMZSDBRCRME-NSHDSACASA-N 1 2 315.364 4.140 20 0 DIADLO C[N@H+](Cc1csc(-c2ccoc2)n1)Cc1ccccc1F ZINC000170983373 335012119 /nfs/dbraw/zinc/01/21/19/335012119.db2.gz HUQYYZNLANWXRX-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1csc(-c2ccoc2)n1)Cc1ccccc1F ZINC000170983373 335012120 /nfs/dbraw/zinc/01/21/20/335012120.db2.gz HUQYYZNLANWXRX-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1csc(-c2ccsc2)n1 ZINC000093236250 193220376 /nfs/dbraw/zinc/22/03/76/193220376.db2.gz OCFHDWRHLOVJRL-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1csc(-c2ccsc2)n1 ZINC000093236250 193220378 /nfs/dbraw/zinc/22/03/78/193220378.db2.gz OCFHDWRHLOVJRL-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO O=C(CCC[N@@H+]1CCc2c3ccccc3[nH]c2C1)c1ccccc1 ZINC000013526513 181857900 /nfs/dbraw/zinc/85/79/00/181857900.db2.gz SJUGUCWHNWWFDF-UHFFFAOYSA-N 1 2 318.420 4.189 20 0 DIADLO O=C(CCC[N@H+]1CCc2c3ccccc3[nH]c2C1)c1ccccc1 ZINC000013526513 181857902 /nfs/dbraw/zinc/85/79/02/181857902.db2.gz SJUGUCWHNWWFDF-UHFFFAOYSA-N 1 2 318.420 4.189 20 0 DIADLO CCSc1cccc(C(=O)Nc2ccc3[nH+]c(C)cn3c2)c1 ZINC000343308804 335033087 /nfs/dbraw/zinc/03/30/87/335033087.db2.gz VEMTXXWKOHJCOZ-UHFFFAOYSA-N 1 2 311.410 4.007 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccccc2Br)cs1 ZINC000042419252 183268131 /nfs/dbraw/zinc/26/81/31/183268131.db2.gz KJOARWBOSQMEPW-VIFPVBQESA-N 1 2 311.248 4.065 20 0 DIADLO Cc1cc(OCCCO[C@@H]2CCCCO2)c2cccc(C)c2[nH+]1 ZINC000563838155 335037705 /nfs/dbraw/zinc/03/77/05/335037705.db2.gz XECQCTPMUJLTMI-GOSISDBHSA-N 1 2 315.413 4.164 20 0 DIADLO CCCC[C@H](C)N(CCCC)C(=O)c1ccc2[nH+]ccn2c1 ZINC000563835510 335038503 /nfs/dbraw/zinc/03/85/03/335038503.db2.gz LKDMDSSARPCITO-HNNXBMFYSA-N 1 2 301.434 4.155 20 0 DIADLO CCC(CC)([NH2+]Cc1noc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000103480384 193936595 /nfs/dbraw/zinc/93/65/95/193936595.db2.gz QHKMNXBTXSAWHE-UHFFFAOYSA-N 1 2 319.836 4.406 20 0 DIADLO Fc1ccc(-c2noc(C[NH2+]C3(c4ccccc4)CCC3)n2)cc1 ZINC000104665171 194022188 /nfs/dbraw/zinc/02/21/88/194022188.db2.gz FFBBIYLHMKMHFU-UHFFFAOYSA-N 1 2 323.371 4.045 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCC2)no1 ZINC000104706602 194030238 /nfs/dbraw/zinc/03/02/38/194030238.db2.gz DXDYUPXWHQOGKV-GOSISDBHSA-N 1 2 317.408 4.182 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@@H](c2ccccc2)C(C)(C)C)n1 ZINC000064938730 184306876 /nfs/dbraw/zinc/30/68/76/184306876.db2.gz QJXQXOSXCCATCG-KRWDZBQOSA-N 1 2 301.434 4.145 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1csc(-c2ccsc2)n1 ZINC000065603072 184370896 /nfs/dbraw/zinc/37/08/96/184370896.db2.gz ZRUCOVDFTGQNBN-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1csc(-c2ccsc2)n1 ZINC000065603072 184370897 /nfs/dbraw/zinc/37/08/97/184370897.db2.gz ZRUCOVDFTGQNBN-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO C[C@@H]1CC[C@@H](C)N1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000135816055 335047493 /nfs/dbraw/zinc/04/74/93/335047493.db2.gz VKMIKOUYWFERLK-ZIAGYGMSSA-N 1 2 311.385 4.279 20 0 DIADLO Cc1ccc(N[C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)c[nH+]1 ZINC000272164380 130004146 /nfs/dbraw/zinc/00/41/46/130004146.db2.gz CAOZIULSWHEURF-AWEZNQCLSA-N 1 2 312.417 4.093 20 0 DIADLO COCC[C@H]([NH2+][C@@H](C)c1nc2c(s1)CCCC2)c1ccco1 ZINC000272540120 130038899 /nfs/dbraw/zinc/03/88/99/130038899.db2.gz KNBZVKREFMMWPX-STQMWFEESA-N 1 2 320.458 4.043 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2cc(Cl)cc3c2OCC3)s1 ZINC000272891901 130072144 /nfs/dbraw/zinc/07/21/44/130072144.db2.gz XWBFCJBDHAKJOK-UHFFFAOYSA-N 1 2 322.861 4.065 20 0 DIADLO Cc1nnc([C@H](C)[N@H+](C)Cc2csc3ccccc23)s1 ZINC000273177101 130094548 /nfs/dbraw/zinc/09/45/48/130094548.db2.gz HQIGOSYWXXHDDH-JTQLQIEISA-N 1 2 303.456 4.254 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+](C)Cc2csc3ccccc23)s1 ZINC000273177101 130094550 /nfs/dbraw/zinc/09/45/50/130094550.db2.gz HQIGOSYWXXHDDH-JTQLQIEISA-N 1 2 303.456 4.254 20 0 DIADLO CCC(CC)n1ccc(C[NH2+]C(C)(C)c2ncc(C)s2)n1 ZINC000273248434 130100222 /nfs/dbraw/zinc/10/02/22/130100222.db2.gz COUKNDYTANQIHV-UHFFFAOYSA-N 1 2 306.479 4.034 20 0 DIADLO Fc1ccc(C[N@@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1 ZINC000273371630 130113105 /nfs/dbraw/zinc/11/31/05/130113105.db2.gz PWSLPDKRQZWQNT-INIZCTEOSA-N 1 2 315.392 4.203 20 0 DIADLO Fc1ccc(C[N@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1 ZINC000273371630 130113106 /nfs/dbraw/zinc/11/31/06/130113106.db2.gz PWSLPDKRQZWQNT-INIZCTEOSA-N 1 2 315.392 4.203 20 0 DIADLO Cc1c([C@@H](C)[NH2+]Cc2csc(C3CCCCC3)n2)cnn1C ZINC000273399045 130117240 /nfs/dbraw/zinc/11/72/40/130117240.db2.gz LVMLGJBXGGNFTL-GFCCVEGCSA-N 1 2 318.490 4.084 20 0 DIADLO c1cn(Cc2cccc(-c3noc(C4CCCCC4)n3)c2)c[nH+]1 ZINC000273748289 130160301 /nfs/dbraw/zinc/16/03/01/130160301.db2.gz NBCYUHABQSBRQR-UHFFFAOYSA-N 1 2 308.385 4.029 20 0 DIADLO Cc1noc(C[NH2+][C@@H](C)c2ccc(Cl)c3ccccc32)n1 ZINC000274069664 130202768 /nfs/dbraw/zinc/20/27/68/130202768.db2.gz BWMASMWUXLVYTD-JTQLQIEISA-N 1 2 301.777 4.035 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2sc(C(C)C)nc2C)s1 ZINC000274146784 130210908 /nfs/dbraw/zinc/21/09/08/130210908.db2.gz DVPBUJHFPKAFEW-WCBMZHEXSA-N 1 2 310.492 4.147 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(OC(C)(C)C)cc2)s1 ZINC000274280277 130223960 /nfs/dbraw/zinc/22/39/60/130223960.db2.gz JPUPIDQTGHHZKN-RYUDHWBXSA-N 1 2 319.474 4.436 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cncc(F)c1)c1nc(C(F)(F)F)cs1 ZINC000274409663 130232108 /nfs/dbraw/zinc/23/21/08/130232108.db2.gz RPYJLCAOQAYJFV-JGVFFNPUSA-N 1 2 319.327 4.108 20 0 DIADLO CCn1nc(C[NH2+][C@H](C)c2c(F)cccc2F)c2ccccc21 ZINC000274465543 130238515 /nfs/dbraw/zinc/23/85/15/130238515.db2.gz UIRBQJGCBFYLDZ-GFCCVEGCSA-N 1 2 315.367 4.185 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cccc(O)c1)c1nc(C(F)(F)F)cs1 ZINC000274589004 130246789 /nfs/dbraw/zinc/24/67/89/130246789.db2.gz JRSFKDURDSHNPR-IUCAKERBSA-N 1 2 316.348 4.279 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(F)(F)F)cs1)c1cccc(O)c1 ZINC000274589001 130247200 /nfs/dbraw/zinc/24/72/00/130247200.db2.gz JRSFKDURDSHNPR-BDAKNGLRSA-N 1 2 316.348 4.279 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cccc(O)c1)c1nc(C(F)(F)F)cs1 ZINC000274589002 130247728 /nfs/dbraw/zinc/24/77/28/130247728.db2.gz JRSFKDURDSHNPR-DTWKUNHWSA-N 1 2 316.348 4.279 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@@H](C)c2ccc(Cl)cn2)on1 ZINC000274822214 130265214 /nfs/dbraw/zinc/26/52/14/130265214.db2.gz BSUHLQIMUUPXSR-NSHDSACASA-N 1 2 307.825 4.477 20 0 DIADLO Fc1cc(Cl)cc(C[NH2+]Cc2nc(C(F)(F)F)cs2)c1 ZINC000274979352 130279613 /nfs/dbraw/zinc/27/96/13/130279613.db2.gz JLBBCILIAPNJBI-UHFFFAOYSA-N 1 2 324.730 4.244 20 0 DIADLO Cc1nc([C@H]2CCCN2c2cc(C(F)(F)F)cc[nH+]2)cs1 ZINC000275004737 130283439 /nfs/dbraw/zinc/28/34/39/130283439.db2.gz HGQNQLKRWAMQMR-GFCCVEGCSA-N 1 2 313.348 4.207 20 0 DIADLO O=C(Nc1cccc2c1CN(c1cccc[nH+]1)C2)C1=CCCCC1 ZINC000275684350 130364297 /nfs/dbraw/zinc/36/42/97/130364297.db2.gz ZTMTYDCRYYJUQV-UHFFFAOYSA-N 1 2 319.408 4.041 20 0 DIADLO CC(C)C(C)(C)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000275928499 130412368 /nfs/dbraw/zinc/41/23/68/130412368.db2.gz ZKHYHEYUKSQFSD-UHFFFAOYSA-N 1 2 323.440 4.223 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(OCC3CC3)c(F)c2)no1 ZINC000284023616 131041743 /nfs/dbraw/zinc/04/17/43/131041743.db2.gz IWSCGOIWCWNECI-QWHCGFSZSA-N 1 2 318.392 4.323 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+][C@H](C)c2nnc(C)s2)cc1 ZINC000284329932 131070147 /nfs/dbraw/zinc/07/01/47/131070147.db2.gz MGKDHOQBORFWPG-QWHCGFSZSA-N 1 2 319.474 4.437 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](CC(F)(F)F)c2ccc(F)cc2)no1 ZINC000284882055 131119524 /nfs/dbraw/zinc/11/95/24/131119524.db2.gz BJQQTCZVQPCHQS-IINYFYTJSA-N 1 2 316.298 4.466 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccccc2OCCC(C)C)no1 ZINC000285445604 131169733 /nfs/dbraw/zinc/16/97/33/131169733.db2.gz ZFUSWGSJFYCHQO-HNNXBMFYSA-N 1 2 302.418 4.259 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000285490552 131173108 /nfs/dbraw/zinc/17/31/08/131173108.db2.gz WRWVOUSQAVTXLP-SFHVURJKSA-N 1 2 322.412 4.100 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000285490552 131173109 /nfs/dbraw/zinc/17/31/09/131173109.db2.gz WRWVOUSQAVTXLP-SFHVURJKSA-N 1 2 322.412 4.100 20 0 DIADLO Cc1noc([C@H]2CCCC[N@@H+]2Cc2cccc(C(F)F)c2)n1 ZINC000285609090 131186347 /nfs/dbraw/zinc/18/63/47/131186347.db2.gz KDROQCQVRKFVTR-CQSZACIVSA-N 1 2 307.344 4.043 20 0 DIADLO Cc1noc([C@H]2CCCC[N@H+]2Cc2cccc(C(F)F)c2)n1 ZINC000285609090 131186348 /nfs/dbraw/zinc/18/63/48/131186348.db2.gz KDROQCQVRKFVTR-CQSZACIVSA-N 1 2 307.344 4.043 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCCC2)c1c(F)cncc1F ZINC000285745254 131198454 /nfs/dbraw/zinc/19/84/54/131198454.db2.gz RPILMHGJNGAANB-ZJUUUORDSA-N 1 2 323.412 4.107 20 0 DIADLO CC(C)c1ccoc1C(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000285778996 131201621 /nfs/dbraw/zinc/20/16/21/131201621.db2.gz WQXYQPNOMYEEEU-UHFFFAOYSA-N 1 2 323.396 4.419 20 0 DIADLO Cc1oc(C(C)C)nc1C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000286028115 131216701 /nfs/dbraw/zinc/21/67/01/131216701.db2.gz SDRSGNJBLFVCKH-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO CC(=O)Nc1cccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000286322524 131230298 /nfs/dbraw/zinc/23/02/98/131230298.db2.gz YAHYIGVUSNOXQS-KRWDZBQOSA-N 1 2 312.417 4.102 20 0 DIADLO C[C@@H]([NH2+]Cc1ccncc1OCCC(C)(C)C)c1nccs1 ZINC000287139359 131265851 /nfs/dbraw/zinc/26/58/51/131265851.db2.gz APZIRRFXAHEQKO-CYBMUJFWSA-N 1 2 319.474 4.204 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1C[C@@H](C)CC[C@H]1c1ccccc1 ZINC000287214660 131268883 /nfs/dbraw/zinc/26/88/83/131268883.db2.gz UYSOTTKURFUFSE-KSSFIOAISA-N 1 2 309.413 4.395 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)Nc3c(C)cc[nH+]c3C)C2)cc1 ZINC000287399012 131278661 /nfs/dbraw/zinc/27/86/61/131278661.db2.gz DKYSFZZBHIKIKT-CRAIPNDOSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCc2c(cccc2C(C)C)C1 ZINC000287464321 131281739 /nfs/dbraw/zinc/28/17/39/131281739.db2.gz IYQUWDFIJLGABU-UHFFFAOYSA-N 1 2 323.440 4.412 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](C)c1ccccc1Cl ZINC000287588934 131289209 /nfs/dbraw/zinc/28/92/09/131289209.db2.gz RIPYVUYAYUBFBW-NSHDSACASA-N 1 2 303.793 4.235 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(Cc1ccccc1F)C1CC1 ZINC000287593732 131289621 /nfs/dbraw/zinc/28/96/21/131289621.db2.gz RQCCXHKDAALZCF-UHFFFAOYSA-N 1 2 313.376 4.034 20 0 DIADLO Cc1ccc([C@H](NC(=O)Nc2c(C)cc[nH+]c2C)C2CC2)cc1 ZINC000287623355 131290843 /nfs/dbraw/zinc/29/08/43/131290843.db2.gz UHGVLFLWBMFTBE-SFHVURJKSA-N 1 2 309.413 4.280 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](C)c1cccc(Cl)c1 ZINC000287629139 131291035 /nfs/dbraw/zinc/29/10/35/131291035.db2.gz UTYQSVDIWLMRSE-LLVKDONJSA-N 1 2 303.793 4.235 20 0 DIADLO Cc1ccc([C@@H](NC(=O)Nc2c(C)cc[nH+]c2C)C2CC2)cc1 ZINC000287623351 131291212 /nfs/dbraw/zinc/29/12/12/131291212.db2.gz UHGVLFLWBMFTBE-GOSISDBHSA-N 1 2 309.413 4.280 20 0 DIADLO CC[C@H](c1ccncc1)N(CC)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287640042 131291974 /nfs/dbraw/zinc/29/19/74/131291974.db2.gz VPLYZRRYWQXAIV-MRXNPFEDSA-N 1 2 312.417 4.099 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000287675838 131294107 /nfs/dbraw/zinc/29/41/07/131294107.db2.gz VZJGHEQVMHXPSM-UWVGGRQHSA-N 1 2 315.364 4.277 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3ocnc3C3CC3)cc2[nH+]1 ZINC000288206673 131316031 /nfs/dbraw/zinc/31/60/31/131316031.db2.gz CTFMYYCFDWLJKG-UHFFFAOYSA-N 1 2 324.384 4.023 20 0 DIADLO Clc1oc2ccccc2c1C[NH2+]Cc1noc2c1CCCC2 ZINC000288519150 131328821 /nfs/dbraw/zinc/32/88/21/131328821.db2.gz UKZWVQBJUGKBRD-UHFFFAOYSA-N 1 2 316.788 4.243 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1csc(C)n1)c1cccc(Cl)c1 ZINC000288581282 131331929 /nfs/dbraw/zinc/33/19/29/131331929.db2.gz AANDOLMSNKQFJQ-YGRLFVJLSA-N 1 2 310.850 4.143 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1csc(C(C)(C)C)n1 ZINC000288710744 131336522 /nfs/dbraw/zinc/33/65/22/131336522.db2.gz ZGHWKGMOTVFJCB-NHYWBVRUSA-N 1 2 302.443 4.052 20 0 DIADLO C[C@H](O)c1ncc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)s1 ZINC000288952739 131347555 /nfs/dbraw/zinc/34/75/55/131347555.db2.gz AGOYBOIHJSWVSC-QWRGUYRKSA-N 1 2 310.850 4.043 20 0 DIADLO C[C@H](O)c1ncc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)s1 ZINC000288952739 131347557 /nfs/dbraw/zinc/34/75/57/131347557.db2.gz AGOYBOIHJSWVSC-QWRGUYRKSA-N 1 2 310.850 4.043 20 0 DIADLO Cc1cnn(C)c1C[NH+](Cc1cccs1)Cc1cccs1 ZINC000289174897 131363740 /nfs/dbraw/zinc/36/37/40/131363740.db2.gz SGPMKKXTYVBOMB-UHFFFAOYSA-N 1 2 317.483 4.054 20 0 DIADLO Cc1ncc(C[N@H+](Cc2cccnc2)Cc2ccccc2C)s1 ZINC000289188082 131364612 /nfs/dbraw/zinc/36/46/12/131364612.db2.gz BEHOBAFJUGAHOW-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2cccnc2)Cc2ccccc2C)s1 ZINC000289188082 131364613 /nfs/dbraw/zinc/36/46/13/131364613.db2.gz BEHOBAFJUGAHOW-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(-c3ccsc3)n2)CCC1(F)F ZINC000289359829 131377652 /nfs/dbraw/zinc/37/76/52/131377652.db2.gz AEDCIZHZLOUCLK-JTQLQIEISA-N 1 2 314.426 4.349 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(-c3ccsc3)n2)CCC1(F)F ZINC000289359829 131377653 /nfs/dbraw/zinc/37/76/53/131377653.db2.gz AEDCIZHZLOUCLK-JTQLQIEISA-N 1 2 314.426 4.349 20 0 DIADLO Cc1csc(C[N@H+](CCc2ccccc2)Cc2ccncc2)n1 ZINC000289415867 131384820 /nfs/dbraw/zinc/38/48/20/131384820.db2.gz ILCBJEDXMQAZEL-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO Cc1csc(C[N@@H+](CCc2ccccc2)Cc2ccncc2)n1 ZINC000289415867 131384822 /nfs/dbraw/zinc/38/48/22/131384822.db2.gz ILCBJEDXMQAZEL-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1cccnc1)c1ccncc1F ZINC000340472260 131844611 /nfs/dbraw/zinc/84/46/11/131844611.db2.gz HPQZJHPZBHNSBG-KUHUBIRLSA-N 1 2 307.372 4.056 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccccc2OCCC(C)C)s1 ZINC000295165605 131888028 /nfs/dbraw/zinc/88/80/28/131888028.db2.gz KWTZPIUVVCBSPH-UHFFFAOYSA-N 1 2 304.459 4.166 20 0 DIADLO Cc1csc(-c2ccc(N[C@@H]3C[C@H](C)n4cc[nH+]c43)cc2)n1 ZINC000296419006 131962091 /nfs/dbraw/zinc/96/20/91/131962091.db2.gz LJNDXJANCBWLCH-SWLSCSKDSA-N 1 2 310.426 4.433 20 0 DIADLO Cc1nc(-c2cccc(N[C@@H]3C[C@@H](C)n4cc[nH+]c43)c2)oc1C ZINC000296774481 131986282 /nfs/dbraw/zinc/98/62/82/131986282.db2.gz KPUFTQUIOLFSES-BDJLRTHQSA-N 1 2 308.385 4.273 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1[C@H](C)C[C@H](c2ccccc2)[C@@H]1C ZINC000297197423 132003781 /nfs/dbraw/zinc/00/37/81/132003781.db2.gz XQIIWAGUPPAZID-HFTRVMKXSA-N 1 2 323.440 4.497 20 0 DIADLO Clc1cccc(Cl)c1[C@H]([NH2+][C@@H]1CCn2ccnc21)C1CC1 ZINC000297357400 132012200 /nfs/dbraw/zinc/01/22/00/132012200.db2.gz POYCNSLIHJJCEB-UKRRQHHQSA-N 1 2 322.239 4.376 20 0 DIADLO Cc1cc(-c2noc([C@@H](C)[NH2+]Cc3ccsc3)n2)ccc1F ZINC000298886790 132081730 /nfs/dbraw/zinc/08/17/30/132081730.db2.gz SEMTUAQWXOKCGH-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)no1 ZINC000299040310 132086898 /nfs/dbraw/zinc/08/68/98/132086898.db2.gz CAMKNABULXVGHJ-HNNXBMFYSA-N 1 2 305.397 4.209 20 0 DIADLO CC(C)C[N@H+](Cc1nccn1C(F)F)Cc1ccccc1F ZINC000299371692 132101277 /nfs/dbraw/zinc/10/12/77/132101277.db2.gz FJDRVKZHJYZZJC-UHFFFAOYSA-N 1 2 311.351 4.076 20 0 DIADLO CC(C)C[N@@H+](Cc1nccn1C(F)F)Cc1ccccc1F ZINC000299371692 132101278 /nfs/dbraw/zinc/10/12/78/132101278.db2.gz FJDRVKZHJYZZJC-UHFFFAOYSA-N 1 2 311.351 4.076 20 0 DIADLO CC[N@H+](Cc1nnc(-c2ccco2)o1)Cc1ccc(Cl)cc1 ZINC000299372634 132101767 /nfs/dbraw/zinc/10/17/67/132101767.db2.gz GZDYMBLVMZHONO-UHFFFAOYSA-N 1 2 317.776 4.005 20 0 DIADLO CC[N@@H+](Cc1nnc(-c2ccco2)o1)Cc1ccc(Cl)cc1 ZINC000299372634 132101768 /nfs/dbraw/zinc/10/17/68/132101768.db2.gz GZDYMBLVMZHONO-UHFFFAOYSA-N 1 2 317.776 4.005 20 0 DIADLO c1coc(-c2noc(-c3ccccc3Oc3cc[nH+]cc3)n2)c1 ZINC000340660503 132122401 /nfs/dbraw/zinc/12/24/01/132122401.db2.gz UBFODBBCXOKDTL-UHFFFAOYSA-N 1 2 305.293 4.184 20 0 DIADLO C[C@@H]1CCC[C@H](C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)C1 ZINC000340670192 132139070 /nfs/dbraw/zinc/13/90/70/132139070.db2.gz XENSIYWZQKEJKC-OCCSQVGLSA-N 1 2 311.429 4.216 20 0 DIADLO Cc1cc(N)nc(SCc2csc(C3CCCCC3)n2)[nH+]1 ZINC000042153336 132149469 /nfs/dbraw/zinc/14/94/69/132149469.db2.gz RYRUXUUTFZMFAE-UHFFFAOYSA-N 1 2 320.487 4.164 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2cccc(C(F)(F)F)c2)C(C)C)nc1 ZINC000340688440 132154363 /nfs/dbraw/zinc/15/43/63/132154363.db2.gz UYZWIPSTRWHVTB-UHFFFAOYSA-N 1 2 323.362 4.214 20 0 DIADLO Cc1cnc(C[N@H+](Cc2cccc(C(F)(F)F)c2)C(C)C)nc1 ZINC000340688440 132154365 /nfs/dbraw/zinc/15/43/65/132154365.db2.gz UYZWIPSTRWHVTB-UHFFFAOYSA-N 1 2 323.362 4.214 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2ncc(C3CC3)o2)o1 ZINC000340691038 132157567 /nfs/dbraw/zinc/15/75/67/132157567.db2.gz NXORZOMOCMXREB-SWLSCSKDSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2ncc(C3CC3)o2)o1 ZINC000340691038 132157568 /nfs/dbraw/zinc/15/75/68/132157568.db2.gz NXORZOMOCMXREB-SWLSCSKDSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1cn2c([nH+]1)[C@H](CNc1nc3ccccc3cc1C)CCC2 ZINC000533560906 435245531 /nfs/dbraw/zinc/24/55/31/435245531.db2.gz MCKSBPLCNVHZNQ-INIZCTEOSA-N 1 2 306.413 4.038 20 0 DIADLO CCc1cccc2c1OCC[C@H]2Nc1[nH+]c2ccccc2n1C ZINC000535691945 435343723 /nfs/dbraw/zinc/34/37/23/435343723.db2.gz QUXJWOFXIUUYEH-OAHLLOKOSA-N 1 2 307.397 4.071 20 0 DIADLO CCO[C@H]1C[C@H](Nc2ccc3cc(OC)ccc3[nH+]2)C12CCC2 ZINC000608088376 435350127 /nfs/dbraw/zinc/35/01/27/435350127.db2.gz OTSLWLIKPPBHOI-IRXDYDNUSA-N 1 2 312.413 4.003 20 0 DIADLO COc1ccc2[nH+]c(N[C@H](C)CCc3cccn3C)ccc2c1 ZINC000608090814 435352322 /nfs/dbraw/zinc/35/23/22/435352322.db2.gz GICSFJKACWQRHG-CQSZACIVSA-N 1 2 309.413 4.015 20 0 DIADLO Cc1csc([C@@H](C)Nc2[nH+]c(C(C)C)nc3[nH]ccc32)n1 ZINC000631096415 435401310 /nfs/dbraw/zinc/40/13/10/435401310.db2.gz RKYRMHWTIBFWGT-SNVBAGLBSA-N 1 2 301.419 4.019 20 0 DIADLO c1sc(NCc2cn3ccccc3[nH+]2)nc1-c1ccccc1 ZINC000519329671 435679992 /nfs/dbraw/zinc/67/99/92/435679992.db2.gz FLHMNHZOVMFXBE-UHFFFAOYSA-N 1 2 306.394 4.070 20 0 DIADLO c1cn(Cc2ccc(-c3nc(C4CCCCCC4)no3)cc2)c[nH+]1 ZINC000570682959 332800026 /nfs/dbraw/zinc/80/00/26/332800026.db2.gz FXQGVDYXJRXGIO-UHFFFAOYSA-N 1 2 322.412 4.419 20 0 DIADLO CC(C)=CCC[C@H](C)CC(=O)N1CC(C)(C)[C@@H]1c1[nH+]ccn1C ZINC000570684355 332800415 /nfs/dbraw/zinc/80/04/15/332800415.db2.gz CJTZTGPZHDQDJP-RDJZCZTQSA-N 1 2 317.477 4.102 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc([C@@H]2CC[C@H](C)C2)n1 ZINC000570768870 332813349 /nfs/dbraw/zinc/81/33/49/332813349.db2.gz SNZNFYTZKMQFIE-UONOGXRCSA-N 1 2 324.428 4.495 20 0 DIADLO Cc1ccc(C(=O)N(C)[C@@H](C)C2(C)CC2)cc1Oc1cc[nH+]cc1 ZINC000175617039 332898943 /nfs/dbraw/zinc/89/89/43/332898943.db2.gz JCIUJINJSWNKEE-HNNXBMFYSA-N 1 2 324.424 4.443 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CCc3c(Cl)cccc3C2)c1 ZINC000530697187 331618966 /nfs/dbraw/zinc/61/89/66/331618966.db2.gz VWRZZXCRALBKOV-UHFFFAOYSA-N 1 2 312.722 4.317 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3coc(-c4ccccc4)n3)CC2)cc1 ZINC000530774127 331625308 /nfs/dbraw/zinc/62/53/08/331625308.db2.gz MCPYWKSXHKRWQS-UHFFFAOYSA-N 1 2 308.356 4.260 20 0 DIADLO Cc1ccc(NC(=O)COc2cc(C(C)C)ccc2C)c(C)[nH+]1 ZINC000530796615 331626829 /nfs/dbraw/zinc/62/68/29/331626829.db2.gz IOYCKDOORNTQFL-UHFFFAOYSA-N 1 2 312.413 4.148 20 0 DIADLO CC1(C)CCN1C(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000530848169 331629643 /nfs/dbraw/zinc/62/96/43/331629643.db2.gz GZPHRDMOMYJYAK-UHFFFAOYSA-N 1 2 316.788 4.152 20 0 DIADLO Fc1ccc(C[C@@H]2CCCCN2c2cc[nH+]c(C3CC3)n2)cc1 ZINC000530915506 331635331 /nfs/dbraw/zinc/63/53/31/331635331.db2.gz NHGDUFKDNJFZGW-KRWDZBQOSA-N 1 2 311.404 4.095 20 0 DIADLO CC[C@H]1CCCC[C@@H]1c1noc(CCc2[nH]c3ccccc3[nH+]2)n1 ZINC000556384697 331685121 /nfs/dbraw/zinc/68/51/21/331685121.db2.gz DFWBDAAEYSVWCG-KBPBESRZSA-N 1 2 324.428 4.415 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2cc(C)ccc2s1)c1nccs1 ZINC000528439239 331688030 /nfs/dbraw/zinc/68/80/30/331688030.db2.gz GIOMPQTUNRMKDK-NSHDSACASA-N 1 2 303.456 4.302 20 0 DIADLO Cn1c2ccc(NC(=O)c3cccs3)cc2[nH+]c1C(C)(C)C ZINC000536316190 331696972 /nfs/dbraw/zinc/69/69/72/331696972.db2.gz TZFCFEUPHHVEBH-UHFFFAOYSA-N 1 2 313.426 4.185 20 0 DIADLO Cn1c2ccc(Nc3ncc(Cl)cn3)cc2[nH+]c1C(C)(C)C ZINC000536338213 331698174 /nfs/dbraw/zinc/69/81/74/331698174.db2.gz DFBXJHRKGCWIAP-UHFFFAOYSA-N 1 2 315.808 4.058 20 0 DIADLO O=C(C/C=C\c1ccccc1F)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000255123573 331709387 /nfs/dbraw/zinc/70/93/87/331709387.db2.gz DVELXCSJLLXRRL-HYXAFXHYSA-N 1 2 321.355 4.258 20 0 DIADLO O=C(C/C=C/c1ccccc1F)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000176221293 332927951 /nfs/dbraw/zinc/92/79/51/332927951.db2.gz TXSLQIJZDZASCJ-GQCTYLIASA-N 1 2 321.355 4.258 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)c(C)[nH+]1 ZINC000176204939 332928809 /nfs/dbraw/zinc/92/88/09/332928809.db2.gz ANEZADCEPMFDCA-LSDHHAIUSA-N 1 2 300.789 4.094 20 0 DIADLO c1[nH+]c(-c2cccc(N[C@H]3CCC[C@H]4C[C@H]43)c2)n2c1CCCC2 ZINC000556934211 331756049 /nfs/dbraw/zinc/75/60/49/331756049.db2.gz QQWCYECVMYQOPS-KYNGSXCRSA-N 1 2 307.441 4.487 20 0 DIADLO Cc1ccc2nc(/C=C\c3[nH+]ccn3CC(F)(F)F)ccc2c1 ZINC000255504814 331758877 /nfs/dbraw/zinc/75/88/77/331758877.db2.gz XWBNASJRVYWODF-ALCCZGGFSA-N 1 2 317.314 4.472 20 0 DIADLO CC(C)(C)c1csc(C[NH2+]Cc2ccsc2Cl)n1 ZINC000312876425 331770572 /nfs/dbraw/zinc/77/05/72/331770572.db2.gz LVUHTWAMKLYINZ-UHFFFAOYSA-N 1 2 300.880 4.445 20 0 DIADLO CC(C)CCc1noc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)n1 ZINC000557539994 331798871 /nfs/dbraw/zinc/79/88/71/331798871.db2.gz VRWUKWHCLVGWHX-UHFFFAOYSA-N 1 2 319.836 4.091 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc([C@H]2CC23CCCC3)n1 ZINC000584152010 331844454 /nfs/dbraw/zinc/84/44/54/331844454.db2.gz WIJOPBQVGIHKOY-CQSZACIVSA-N 1 2 322.412 4.018 20 0 DIADLO CC/C=C/CCSC[C@H](O)Cn1c[nH+]c2cc(C)c(C)cc21 ZINC000558104944 331876752 /nfs/dbraw/zinc/87/67/52/331876752.db2.gz OZGQYIDUICMEQP-SQRWCISFSA-N 1 2 318.486 4.104 20 0 DIADLO CC/C=C\CCSC[C@@H](O)Cn1c[nH+]c2cc(C)c(C)cc21 ZINC000558104942 331877011 /nfs/dbraw/zinc/87/70/11/331877011.db2.gz OZGQYIDUICMEQP-KJPDOMRESA-N 1 2 318.486 4.104 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+][C@H](C)c1nccn1-c1ccccc1 ZINC000558260342 331890638 /nfs/dbraw/zinc/89/06/38/331890638.db2.gz XRSICHPUIQKVNC-JKSUJKDBSA-N 1 2 320.440 4.242 20 0 DIADLO CCc1nc(C[NH2+][C@@H](c2ccc(C(C)(C)C)cc2)C(C)C)no1 ZINC000558742884 331940907 /nfs/dbraw/zinc/94/09/07/331940907.db2.gz NYTRNRQIBAPRGX-GOSISDBHSA-N 1 2 315.461 4.416 20 0 DIADLO C[C@H]([NH2+]Cc1noc2ccccc21)c1nc2c(s1)CCCC2 ZINC000580095550 332938860 /nfs/dbraw/zinc/93/88/60/332938860.db2.gz YFEZSVLIRNPHEQ-NSHDSACASA-N 1 2 313.426 4.014 20 0 DIADLO CC1(C)C[N@H+](CCCCC(F)(F)F)C[C@](C)(C(F)(F)F)O1 ZINC000559312762 332023931 /nfs/dbraw/zinc/02/39/31/332023931.db2.gz LYXSEDHEWYOTJA-LLVKDONJSA-N 1 2 321.305 4.151 20 0 DIADLO CC1(C)C[N@@H+](CCCCC(F)(F)F)C[C@](C)(C(F)(F)F)O1 ZINC000559312762 332023933 /nfs/dbraw/zinc/02/39/33/332023933.db2.gz LYXSEDHEWYOTJA-LLVKDONJSA-N 1 2 321.305 4.151 20 0 DIADLO Cc1cc(N2CC[C@@](F)(c3ccccc3C)C2)nc(C2CC2)[nH+]1 ZINC000409670208 332046250 /nfs/dbraw/zinc/04/62/50/332046250.db2.gz RANVDPROBCXSNT-IBGZPJMESA-N 1 2 311.404 4.046 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CC3CC(c4ccccc4)C3)cc2[nH+]1 ZINC000409824451 332058467 /nfs/dbraw/zinc/05/84/67/332058467.db2.gz PFUYARBPLGUMJC-UHFFFAOYSA-N 1 2 319.408 4.394 20 0 DIADLO C[C@@H](CSCCn1cc[nH+]c1)c1ccc(C(F)(F)F)cc1 ZINC000409862128 332060149 /nfs/dbraw/zinc/06/01/49/332060149.db2.gz NERODTXFPKLZBI-LBPRGKRZSA-N 1 2 314.376 4.439 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(-c3cccc(F)c3C)o2)no1 ZINC000092254176 332119714 /nfs/dbraw/zinc/11/97/14/332119714.db2.gz GDPLUALDTISPLI-UHFFFAOYSA-N 1 2 314.360 4.323 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(-c3cccc(F)c3C)o2)no1 ZINC000092254176 332119716 /nfs/dbraw/zinc/11/97/16/332119716.db2.gz GDPLUALDTISPLI-UHFFFAOYSA-N 1 2 314.360 4.323 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc3ccccc3c2)[C@@H](c2ccccc2)CO1 ZINC000410394729 332121844 /nfs/dbraw/zinc/12/18/44/332121844.db2.gz DSZAELPKCXSVEH-IIBYNOLFSA-N 1 2 318.420 4.197 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc3ccccc3c2)[C@@H](c2ccccc2)CO1 ZINC000410394729 332121847 /nfs/dbraw/zinc/12/18/47/332121847.db2.gz DSZAELPKCXSVEH-IIBYNOLFSA-N 1 2 318.420 4.197 20 0 DIADLO CCn1ccnc1C[NH2+][C@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000569533342 332127621 /nfs/dbraw/zinc/12/76/21/332127621.db2.gz FPFFPCZNHOIICI-INIZCTEOSA-N 1 2 324.255 4.451 20 0 DIADLO CCn1cc(C[N@H+](Cc2ccco2)Cc2ccc(C)s2)cn1 ZINC000092536764 332128139 /nfs/dbraw/zinc/12/81/39/332128139.db2.gz PZHUMWLJTQJFOL-UHFFFAOYSA-N 1 2 315.442 4.068 20 0 DIADLO CCn1cc(C[N@@H+](Cc2ccco2)Cc2ccc(C)s2)cn1 ZINC000092536764 332128140 /nfs/dbraw/zinc/12/81/40/332128140.db2.gz PZHUMWLJTQJFOL-UHFFFAOYSA-N 1 2 315.442 4.068 20 0 DIADLO Cc1nc([C@H]([NH2+]C[C@@H]2CCC[C@H](C)C2)c2ccccc2F)no1 ZINC000092565701 332133475 /nfs/dbraw/zinc/13/34/75/332133475.db2.gz HIOFJPJZSOFTPT-DXCKQFNASA-N 1 2 317.408 4.022 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CC[C@@]4(C)[C@@H](C3)C4(F)F)cs2)o1 ZINC000428714444 332163592 /nfs/dbraw/zinc/16/35/92/332163592.db2.gz VMINJAZBHMYTRV-HIFRSBDPSA-N 1 2 324.396 4.189 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CC[C@@]4(C)[C@@H](C3)C4(F)F)cs2)o1 ZINC000428714444 332163593 /nfs/dbraw/zinc/16/35/93/332163593.db2.gz VMINJAZBHMYTRV-HIFRSBDPSA-N 1 2 324.396 4.189 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc(C)cc2F)[nH+]1 ZINC000427183528 332182239 /nfs/dbraw/zinc/18/22/39/332182239.db2.gz CWNCQPKHNIZYBE-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO O=C(Nc1cc(Cl)c(F)c(Cl)c1)c1ccc2[nH+]ccn2c1 ZINC000427190364 332182894 /nfs/dbraw/zinc/18/28/94/332182894.db2.gz UCRCNZUZXNOORO-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO CCCc1csc(C[N@H+](Cc2ccc(OC)cc2)C2CC2)n1 ZINC000426057425 335094027 /nfs/dbraw/zinc/09/40/27/335094027.db2.gz IXAOMUNVGAKMFI-UHFFFAOYSA-N 1 2 316.470 4.269 20 0 DIADLO CCCc1csc(C[N@@H+](Cc2ccc(OC)cc2)C2CC2)n1 ZINC000426057425 335094029 /nfs/dbraw/zinc/09/40/29/335094029.db2.gz IXAOMUNVGAKMFI-UHFFFAOYSA-N 1 2 316.470 4.269 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccccc1C(F)(F)F ZINC000367518895 332233756 /nfs/dbraw/zinc/23/37/56/332233756.db2.gz KUCANGCIKXDNEW-YGRLFVJLSA-N 1 2 309.335 4.157 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1CCC[C@H]1c1nccs1 ZINC000370779750 332249039 /nfs/dbraw/zinc/24/90/39/332249039.db2.gz APCHDCGGCKGBMJ-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1CCC[C@H]1c1nccs1 ZINC000370779750 332249041 /nfs/dbraw/zinc/24/90/41/332249041.db2.gz APCHDCGGCKGBMJ-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cc(C[N@H+](C)Cc2cccc(Cl)c2Cl)ccn1 ZINC000536475975 332250874 /nfs/dbraw/zinc/25/08/74/332250874.db2.gz LLXNCWHFWIVAGG-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)ccn1 ZINC000536475975 332250875 /nfs/dbraw/zinc/25/08/75/332250875.db2.gz LLXNCWHFWIVAGG-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1ccc2nc(C[N@@H+](C)Cc3ccc(Cl)c(F)c3)cn2c1 ZINC000536488730 332252393 /nfs/dbraw/zinc/25/23/93/332252393.db2.gz RNZXJRKUPMUQMU-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1ccc2nc(C[N@H+](C)Cc3ccc(Cl)c(F)c3)cn2c1 ZINC000536488730 332252395 /nfs/dbraw/zinc/25/23/95/332252395.db2.gz RNZXJRKUPMUQMU-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+][C@H](C)c3nnc(C(C)C)[nH]3)o2)cc1 ZINC000536498935 332253113 /nfs/dbraw/zinc/25/31/13/332253113.db2.gz PAZRLOVOXJIABD-CQSZACIVSA-N 1 2 324.428 4.347 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)[C@@H]1CC12CCCC2 ZINC000531092517 332256558 /nfs/dbraw/zinc/25/65/58/332256558.db2.gz QEIRNOKEBJGODU-KRWDZBQOSA-N 1 2 308.381 4.393 20 0 DIADLO Cc1ccncc1C[NH2+][C@H](c1cccc(Cl)c1)c1ccccn1 ZINC000370883615 332277626 /nfs/dbraw/zinc/27/76/26/332277626.db2.gz NALTVUNHEJHAIP-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO Cc1ccncc1C[NH2+][C@@H](c1cccc(Cl)c1)c1ccccn1 ZINC000370883614 332277628 /nfs/dbraw/zinc/27/76/28/332277628.db2.gz NALTVUNHEJHAIP-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO CCCC[C@@H](CCC)C[NH2+][C@@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000559774794 332279915 /nfs/dbraw/zinc/27/99/15/332279915.db2.gz YTCOVPCLJKFSHX-RHSMWYFYSA-N 1 2 318.440 4.229 20 0 DIADLO C[C@H](Nc1cccc([NH+]2CCCCCC2)c1)[C@@]1(C)CCCO1 ZINC000559835887 332284255 /nfs/dbraw/zinc/28/42/55/332284255.db2.gz NZHLCURRQKYGKK-QFBILLFUSA-N 1 2 302.462 4.437 20 0 DIADLO CCn1cc[nH+]c1CNc1ccc2nc(C(F)F)sc2c1 ZINC000560504478 332347450 /nfs/dbraw/zinc/34/74/50/332347450.db2.gz NOAKQTLCTQJVNN-UHFFFAOYSA-N 1 2 308.357 4.062 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+][C@@H](COCC(C)C)c2ccco2)c1 ZINC000560530352 332352596 /nfs/dbraw/zinc/35/25/96/332352596.db2.gz YAGYBCGWESJBQO-WBVHZDCISA-N 1 2 302.418 4.048 20 0 DIADLO C[N@H+](Cc1nc2ccccc2o1)Cc1ccccc1OC(F)F ZINC000097493199 332363249 /nfs/dbraw/zinc/36/32/49/332363249.db2.gz WKYPZHMCHKOZMN-UHFFFAOYSA-N 1 2 318.323 4.061 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2o1)Cc1ccccc1OC(F)F ZINC000097493199 332363251 /nfs/dbraw/zinc/36/32/51/332363251.db2.gz WKYPZHMCHKOZMN-UHFFFAOYSA-N 1 2 318.323 4.061 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc2[nH]ccc21)c1noc(-c2ccccc2)n1 ZINC000153234529 332365004 /nfs/dbraw/zinc/36/50/04/332365004.db2.gz DQVURTWLKATBIJ-CYBMUJFWSA-N 1 2 318.380 4.069 20 0 DIADLO Cc1ccc(Cl)c(O[C@@H](C)C(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000425588089 335107743 /nfs/dbraw/zinc/10/77/43/335107743.db2.gz POBPZFKCZNJTFE-ZDUSSCGKSA-N 1 2 318.804 4.066 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)CCCOc1ccc(Cl)cc1 ZINC000425589078 335108002 /nfs/dbraw/zinc/10/80/02/335108002.db2.gz RZHRCRDCQZKOQX-UHFFFAOYSA-N 1 2 318.804 4.150 20 0 DIADLO CC[N@H+](Cc1ccccc1Br)Cc1ncccc1C ZINC000560841750 332389750 /nfs/dbraw/zinc/38/97/50/332389750.db2.gz RXOUJWGJXZOWKT-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccccc1Br)Cc1ncccc1C ZINC000560841750 332389751 /nfs/dbraw/zinc/38/97/51/332389751.db2.gz RXOUJWGJXZOWKT-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC1(CC(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)CC1 ZINC000425567485 335103849 /nfs/dbraw/zinc/10/38/49/335103849.db2.gz IYNOUKZVBGBNTN-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO CC[C@@H](Sc1ccccc1)C(=O)Nc1c(C)cc[nH+]c1C ZINC000425590688 335108671 /nfs/dbraw/zinc/10/86/71/335108671.db2.gz XDBCGJXUGSZOMP-OAHLLOKOSA-N 1 2 300.427 4.208 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2)C1CCC1 ZINC000425571635 335104576 /nfs/dbraw/zinc/10/45/76/335104576.db2.gz NEPCZQQHQXCXJL-AWEZNQCLSA-N 1 2 323.440 4.261 20 0 DIADLO COc1cccc([C@@H](C)Nc2[nH+]ccc(C)c2Br)c1 ZINC000561127052 332414147 /nfs/dbraw/zinc/41/41/47/332414147.db2.gz OMJASXIQFUWBPO-LLVKDONJSA-N 1 2 321.218 4.334 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccc(CCC(F)(F)F)cc1 ZINC000425577336 335105656 /nfs/dbraw/zinc/10/56/56/335105656.db2.gz AOIQWMWHMAPNIS-UHFFFAOYSA-N 1 2 322.330 4.446 20 0 DIADLO Cc1[nH+]cccc1Cc1noc(CC[C@@H](C)c2ccccc2)n1 ZINC000561295960 332434563 /nfs/dbraw/zinc/43/45/63/332434563.db2.gz ZNKTZJVAAMTUPP-CQSZACIVSA-N 1 2 307.397 4.100 20 0 DIADLO CC(C)=CCOc1cccc(CC(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000425580052 335106004 /nfs/dbraw/zinc/10/60/04/335106004.db2.gz DXAQBKIGLBVQMQ-UHFFFAOYSA-N 1 2 324.424 4.225 20 0 DIADLO Cc1n[nH]cc1C1CCN(c2cc(C)[nH+]c3c(F)cccc23)CC1 ZINC000561322051 332437069 /nfs/dbraw/zinc/43/70/69/332437069.db2.gz HVKWDUVTKPVKQI-UHFFFAOYSA-N 1 2 324.403 4.098 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)CCCc1ccccc1Cl ZINC000425580050 335106165 /nfs/dbraw/zinc/10/61/65/335106165.db2.gz DWZPTTGIFJJJOS-UHFFFAOYSA-N 1 2 302.805 4.313 20 0 DIADLO CC(C)c1nc(N2CCC[C@@H]2[C@H]2CCCO2)cc(C(C)(C)C)[nH+]1 ZINC000561319083 332437544 /nfs/dbraw/zinc/43/75/44/332437544.db2.gz AWVJLXXUWZBBPP-HUUCEWRRSA-N 1 2 317.477 4.045 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000425583454 335106704 /nfs/dbraw/zinc/10/67/04/335106704.db2.gz ABBVYROISFXOHU-NWDGAFQWSA-N 1 2 318.779 4.233 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1ccc(C)cc1)c1ccco1 ZINC000151108273 332518114 /nfs/dbraw/zinc/51/81/14/332518114.db2.gz IYPUVHBBIQMOFM-HXUWFJFHSA-N 1 2 307.393 4.476 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+][C@H]1COc2ccc(Cl)cc21 ZINC000427866043 332550462 /nfs/dbraw/zinc/55/04/62/332550462.db2.gz JSSXEVSEOYCEEC-AWEZNQCLSA-N 1 2 312.171 4.356 20 0 DIADLO Cc1cc(NC(=O)N2C[C@H](C)CC[C@H]2c2ccccc2)c(C)c[nH+]1 ZINC000562250203 332564116 /nfs/dbraw/zinc/56/41/16/332564116.db2.gz OGMGBPVALHBFAU-KUHUBIRLSA-N 1 2 323.440 4.125 20 0 DIADLO CSC[C@H](C)[NH2+][C@H](c1cccc(OC(C)C)c1)C(F)F ZINC000562449956 332594552 /nfs/dbraw/zinc/59/45/52/332594552.db2.gz CVBJPJRZROKYKP-SMDDNHRTSA-N 1 2 303.418 4.121 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H](C)c1ccc(F)cc1F ZINC000169283716 332627105 /nfs/dbraw/zinc/62/71/05/332627105.db2.gz JCMIELOMTSPJTP-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO CCn1c(SCCc2cccc(C)[nH+]2)nnc1-c1ccccc1 ZINC000570042774 332705915 /nfs/dbraw/zinc/70/59/15/332705915.db2.gz XIVDHGIWZXOOOU-UHFFFAOYSA-N 1 2 324.453 4.003 20 0 DIADLO Cc1ccsc1-c1noc(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC000570090249 332710733 /nfs/dbraw/zinc/71/07/33/332710733.db2.gz JLAJXSFNFXOGIF-UHFFFAOYSA-N 1 2 322.393 4.018 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)NC(=O)Nc1cccc2ccsc21 ZINC000570488837 332762047 /nfs/dbraw/zinc/76/20/47/332762047.db2.gz MNCWPAFFALXQDG-NSHDSACASA-N 1 2 314.414 4.000 20 0 DIADLO COc1ccc([C@@H](C)Nc2cc(C)[nH+]c(C(C)C)n2)cc1OC ZINC000301075219 332969658 /nfs/dbraw/zinc/96/96/58/332969658.db2.gz FRFRXLXZXIFZBG-CYBMUJFWSA-N 1 2 315.417 4.099 20 0 DIADLO Cc1ccc2cc(C(=O)Nc3c(C)cc(C)[nH+]c3C)ccc2n1 ZINC000178866368 333021754 /nfs/dbraw/zinc/02/17/54/333021754.db2.gz VNXYDOMAYCAYHO-UHFFFAOYSA-N 1 2 305.381 4.116 20 0 DIADLO C[C@H]([NH2+]Cc1csc(Cc2ccccc2)n1)c1cccc(O)c1 ZINC000181501222 333029970 /nfs/dbraw/zinc/02/99/70/333029970.db2.gz PSMHDICQRBEERV-AWEZNQCLSA-N 1 2 324.449 4.290 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2ccc(F)cc2)n1)c1cccc(O)c1 ZINC000181512794 333030586 /nfs/dbraw/zinc/03/05/86/333030586.db2.gz QUSWFGQDSOFTJU-LBPRGKRZSA-N 1 2 312.344 4.037 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[NH2+][C@H](C)c3cccc(O)c3)o2)cc1 ZINC000181550810 333030927 /nfs/dbraw/zinc/03/09/27/333030927.db2.gz OIEWPWCZULVALD-ZIAGYGMSSA-N 1 2 323.396 4.162 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)c1sccc1-c1ccccc1 ZINC000460345993 333066057 /nfs/dbraw/zinc/06/60/57/333066057.db2.gz JAYUOTDCZQMJSY-UHFFFAOYSA-N 1 2 319.389 4.315 20 0 DIADLO Cc1cc[nH+]c(NCCc2nc(C(F)(F)F)cs2)c1Cl ZINC000460412348 333081115 /nfs/dbraw/zinc/08/11/15/333081115.db2.gz MPNVTUJMPIQKNE-UHFFFAOYSA-N 1 2 321.755 4.173 20 0 DIADLO CC[C@@H](C)[C@H]1CCCCN1c1cc(C)[nH+]c(-c2ccncc2)n1 ZINC000462695675 333082426 /nfs/dbraw/zinc/08/24/26/333082426.db2.gz IFXAVPXDJKAJSU-RHSMWYFYSA-N 1 2 310.445 4.252 20 0 DIADLO CC[C@H](C)[C@H]1CCCCN1c1cc(C)[nH+]c(-c2ccncc2)n1 ZINC000462695690 333082455 /nfs/dbraw/zinc/08/24/55/333082455.db2.gz IFXAVPXDJKAJSU-WMLDXEAASA-N 1 2 310.445 4.252 20 0 DIADLO Clc1ccc(/C=C/C[N@@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000526056819 333107848 /nfs/dbraw/zinc/10/78/48/333107848.db2.gz KFXNQKRHEKGSRZ-WZHGYECESA-N 1 2 319.857 4.488 20 0 DIADLO Clc1ccc(/C=C/C[N@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000526056819 333107850 /nfs/dbraw/zinc/10/78/50/333107850.db2.gz KFXNQKRHEKGSRZ-WZHGYECESA-N 1 2 319.857 4.488 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)Oc1cccc(C(C)C)c1 ZINC000425591541 335124627 /nfs/dbraw/zinc/12/46/27/335124627.db2.gz ZXSBTEBBOSGSMU-HNNXBMFYSA-N 1 2 312.413 4.228 20 0 DIADLO CC[C@@H](Nc1cccc(OCCC(C)C)c1)c1[nH+]ccn1C ZINC000180318115 333160776 /nfs/dbraw/zinc/16/07/76/333160776.db2.gz KRABEVIIODZAHW-QGZVFWFLSA-N 1 2 301.434 4.408 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nc(CC(C)C)no1)c1ccc(F)cc1F ZINC000181673569 333171321 /nfs/dbraw/zinc/17/13/21/333171321.db2.gz KWGIXGBZJUFQKV-OAHLLOKOSA-N 1 2 323.387 4.177 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@@H+]1CCCC2(CCCC2)C1 ZINC000445870515 333188289 /nfs/dbraw/zinc/18/82/89/333188289.db2.gz BBCBVRMXYQSJNG-UHFFFAOYSA-N 1 2 303.450 4.274 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@H+]1CCCC2(CCCC2)C1 ZINC000445870515 333188291 /nfs/dbraw/zinc/18/82/91/333188291.db2.gz BBCBVRMXYQSJNG-UHFFFAOYSA-N 1 2 303.450 4.274 20 0 DIADLO CC1(Cc2noc(-c3cccc(Cn4cc[nH+]c4)c3)n2)CCCC1 ZINC000582054890 333190697 /nfs/dbraw/zinc/19/06/97/333190697.db2.gz HUOZNRZWUTZEJO-UHFFFAOYSA-N 1 2 322.412 4.104 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)o1 ZINC000318802060 333211643 /nfs/dbraw/zinc/21/16/43/333211643.db2.gz MSUGXMAIQYKEAU-QWRGUYRKSA-N 1 2 314.307 4.293 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccc(F)c(C(F)(F)F)c1 ZINC000318825317 333214814 /nfs/dbraw/zinc/21/48/14/333214814.db2.gz DKZVEUNEEUQQFB-UHFFFAOYSA-N 1 2 312.266 4.109 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)s1 ZINC000273111053 333218018 /nfs/dbraw/zinc/21/80/18/333218018.db2.gz GGXNRNGZQKNZOP-MRVPVSSYSA-N 1 2 316.257 4.258 20 0 DIADLO Clc1ccc(C2([NH2+][C@@H]3CCCc4[nH]ncc43)CCC2)cc1 ZINC000368609534 333241854 /nfs/dbraw/zinc/24/18/54/333241854.db2.gz YYXPJBCRLPCNAH-OAHLLOKOSA-N 1 2 301.821 4.110 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc(-c2ccsc2)n1 ZINC000497429911 333250285 /nfs/dbraw/zinc/25/02/85/333250285.db2.gz BCDZOOLJMBSXOQ-UHFFFAOYSA-N 1 2 324.409 4.320 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000497590747 333266474 /nfs/dbraw/zinc/26/64/74/333266474.db2.gz MZHXZZPZCWMGPJ-XIKOKIGWSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000497590747 333266476 /nfs/dbraw/zinc/26/64/76/333266476.db2.gz MZHXZZPZCWMGPJ-XIKOKIGWSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1nc2c(s1)CCC2 ZINC000497694773 333279146 /nfs/dbraw/zinc/27/91/46/333279146.db2.gz YWDBDFHDSWYBMV-GMXVVIOVSA-N 1 2 302.443 4.199 20 0 DIADLO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1nc2c(s1)CCC2 ZINC000497694774 333279189 /nfs/dbraw/zinc/27/91/89/333279189.db2.gz YWDBDFHDSWYBMV-GVXVVHGQSA-N 1 2 302.443 4.199 20 0 DIADLO Cc1cc[nH+]c(NCc2csc(Br)c2)c1Cl ZINC000390464204 333282451 /nfs/dbraw/zinc/28/24/51/333282451.db2.gz HDSXHCUZDPWDBZ-UHFFFAOYSA-N 1 2 317.639 4.480 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+]2CCOC[C@H]2c2ccccc2)c1 ZINC000525781240 333305777 /nfs/dbraw/zinc/30/57/77/333305777.db2.gz OLIPBANQVJXDGT-FQEVSTJZSA-N 1 2 311.425 4.047 20 0 DIADLO CC(C)Oc1cccc(C[N@H+]2CCOC[C@H]2c2ccccc2)c1 ZINC000525781240 333305779 /nfs/dbraw/zinc/30/57/79/333305779.db2.gz OLIPBANQVJXDGT-FQEVSTJZSA-N 1 2 311.425 4.047 20 0 DIADLO Cc1cc(NCc2cn3ccccc3[nH+]2)ccc1Br ZINC000020045498 333305790 /nfs/dbraw/zinc/30/57/90/333305790.db2.gz UMFLEMLZFDBNTO-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO CSc1cc(C[NH2+][C@@H](CCc2ccccc2)C(F)F)ccn1 ZINC000498918785 333318770 /nfs/dbraw/zinc/31/87/70/333318770.db2.gz RTUIUSQLFWYJIL-HNNXBMFYSA-N 1 2 322.424 4.160 20 0 DIADLO CCc1nnc([C@H](C)[N@H+](C)Cc2ccc(Cl)c(Cl)c2)o1 ZINC000111193325 333328844 /nfs/dbraw/zinc/32/88/44/333328844.db2.gz VHXBTUHRIMUVOG-VIFPVBQESA-N 1 2 314.216 4.132 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)o1 ZINC000111193325 333328845 /nfs/dbraw/zinc/32/88/45/333328845.db2.gz VHXBTUHRIMUVOG-VIFPVBQESA-N 1 2 314.216 4.132 20 0 DIADLO O[C@@]1(CNc2ccc3ccccc3[nH+]2)CCC[C@@H](C(F)(F)F)C1 ZINC000186727427 333377369 /nfs/dbraw/zinc/37/73/69/333377369.db2.gz MFKRDWCEVCMSIJ-CJNGLKHVSA-N 1 2 324.346 4.130 20 0 DIADLO Clc1cccc(Cl)c1[C@@H]([NH2+]Cc1cnccn1)C1CC1 ZINC000563118023 333393033 /nfs/dbraw/zinc/39/30/33/333393033.db2.gz JGWAAMHOBWLERW-HNNXBMFYSA-N 1 2 308.212 4.024 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(C2CC3(CCC3)C2)n1 ZINC000563122951 333394369 /nfs/dbraw/zinc/39/43/69/333394369.db2.gz NFGKRQAPLSJNBY-UHFFFAOYSA-N 1 2 322.412 4.078 20 0 DIADLO COc1ccc(Br)cc1CNc1ccc(C)[nH+]c1C ZINC000094664360 333455540 /nfs/dbraw/zinc/45/55/40/333455540.db2.gz AGVVBAQJDXNCIW-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)s1 ZINC000274146443 333467080 /nfs/dbraw/zinc/46/70/80/333467080.db2.gz DUNHQOXVRSOKKH-IUCAKERBSA-N 1 2 315.364 4.277 20 0 DIADLO Cc1ccc(NC(=O)N[C@H](c2ccccc2)C(F)(F)F)c(C)[nH+]1 ZINC000531522829 333533094 /nfs/dbraw/zinc/53/30/94/333533094.db2.gz PPJKBLVPRFYNRN-CQSZACIVSA-N 1 2 323.318 4.124 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cc(F)ccc3OC(C)C)cn2c1 ZINC000531605173 333540017 /nfs/dbraw/zinc/54/00/17/333540017.db2.gz NYRGGECCIDRLBR-UHFFFAOYSA-N 1 2 313.376 4.181 20 0 DIADLO Cc1nc(C[NH2+][C@@H]2CC(C)(C)Cc3occc32)nc2ccccc12 ZINC000531707703 333548573 /nfs/dbraw/zinc/54/85/73/333548573.db2.gz NHCADXWGWYIGKS-QGZVFWFLSA-N 1 2 321.424 4.335 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCO[C@H](c2ccccc2)C1 ZINC000531758325 333555824 /nfs/dbraw/zinc/55/58/24/333555824.db2.gz IGFLUUAVJCCSJU-IBGZPJMESA-N 1 2 304.393 4.121 20 0 DIADLO CC(C)c1cc(N2CCc3ccsc3C2)nc(C(C)C)[nH+]1 ZINC000534146875 333563059 /nfs/dbraw/zinc/56/30/59/333563059.db2.gz OASBSBJHXVKZEH-UHFFFAOYSA-N 1 2 301.459 4.348 20 0 DIADLO CCC[C@H]([NH2+]Cc1nc(=O)c2sccc2[nH]1)C1CCCCC1 ZINC000411497790 333682554 /nfs/dbraw/zinc/68/25/54/333682554.db2.gz ZQEOXKPRIWAVGV-ZDUSSCGKSA-N 1 2 319.474 4.236 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)o1 ZINC000430032083 333712599 /nfs/dbraw/zinc/71/25/99/333712599.db2.gz FENQCDDTDCLUBF-WCBMZHEXSA-N 1 2 313.294 4.249 20 0 DIADLO CC[C@H](C)CCC(=O)NCc1ccc2c(c1)[nH+]c(C)n2C1CC1 ZINC000412327510 333747615 /nfs/dbraw/zinc/74/76/15/333747615.db2.gz DAPAWJDJNUWPNY-ZDUSSCGKSA-N 1 2 313.445 4.122 20 0 DIADLO Cc1ccc(C(=O)N2CC(C)(C)C[C@H]2C)cc1Oc1cc[nH+]cc1 ZINC000412786307 333798975 /nfs/dbraw/zinc/79/89/75/333798975.db2.gz VMPKVYWCIJXTRK-OAHLLOKOSA-N 1 2 324.424 4.443 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)o1 ZINC000343380602 335160587 /nfs/dbraw/zinc/16/05/87/335160587.db2.gz KYFHIRXFECQPNA-PSHZPRKYSA-N 1 2 319.836 4.333 20 0 DIADLO CC[C@@H](C)CS[C@@H](C)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000413002854 333824843 /nfs/dbraw/zinc/82/48/43/333824843.db2.gz VGKMUNAHMAEVEM-OLZOCXBDSA-N 1 2 317.458 4.183 20 0 DIADLO C[C@H]([NH2+]Cc1nccc(C(F)(F)F)n1)c1cc2ccccc2o1 ZINC000414235469 333917091 /nfs/dbraw/zinc/91/70/91/333917091.db2.gz HARVKGKJUBAORP-JTQLQIEISA-N 1 2 321.302 4.092 20 0 DIADLO CCn1ccc(C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)n1 ZINC000414210286 333922092 /nfs/dbraw/zinc/92/20/92/333922092.db2.gz OGQFPBXHDKSQDH-NSHDSACASA-N 1 2 303.793 4.153 20 0 DIADLO Cc1ccc(Br)c(C[NH2+][C@@H](C)c2nccs2)c1 ZINC000414273367 333932007 /nfs/dbraw/zinc/93/20/07/333932007.db2.gz ZCNFPEYKEWAZAW-JTQLQIEISA-N 1 2 311.248 4.065 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1csnn1)c1cc(Cl)ccc1OC ZINC000414308026 333936578 /nfs/dbraw/zinc/93/65/78/333936578.db2.gz SGWOJYZTCIINIX-BXKDBHETSA-N 1 2 311.838 4.002 20 0 DIADLO c1ccc2c(c1)-c1ccccc1C2[NH2+]Cc1nnc(C2CC2)s1 ZINC000414334511 333941528 /nfs/dbraw/zinc/94/15/28/333941528.db2.gz XHILLWOEDBTQMO-UHFFFAOYSA-N 1 2 319.433 4.275 20 0 DIADLO CCN(CC)c1ccc(N[C@H](c2cncc(F)c2)C2CC2)c[nH+]1 ZINC000343491367 335169030 /nfs/dbraw/zinc/16/90/30/335169030.db2.gz POPHBBAGLQUSOD-SFHVURJKSA-N 1 2 314.408 4.025 20 0 DIADLO c1nc(C[NH+]2CC(Cc3ccccc3)(c3ccccc3)C2)cs1 ZINC000414476472 333992041 /nfs/dbraw/zinc/99/20/41/333992041.db2.gz JZBGRPUQJQQTNR-UHFFFAOYSA-N 1 2 320.461 4.139 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+][C@@H](C)c3csnn3)s2)cc1 ZINC000414533332 334009815 /nfs/dbraw/zinc/00/98/15/334009815.db2.gz BHLQQBGYZAMCRD-LBPRGKRZSA-N 1 2 315.467 4.426 20 0 DIADLO CCc1ccc(-c2ccc(C[NH2+][C@@H](C)c3csnn3)o2)cc1 ZINC000414545633 334014271 /nfs/dbraw/zinc/01/42/71/334014271.db2.gz FJRMFKHWPMYUSY-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO Cc1c(F)cccc1-c1ccc(C[NH2+][C@@H](C)c2csnn2)o1 ZINC000414552540 334015826 /nfs/dbraw/zinc/01/58/26/334015826.db2.gz RKRYTWBWSNHOIU-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](CC(C)(C)C)c2ccccc2)no1 ZINC000271764294 334026549 /nfs/dbraw/zinc/02/65/49/334026549.db2.gz MYZJZMKSNFFFDF-OAHLLOKOSA-N 1 2 301.434 4.460 20 0 DIADLO Cc1csc(C[NH2+][C@H](C)c2nc3ccccc3n2C(F)F)n1 ZINC000271877900 334027932 /nfs/dbraw/zinc/02/79/32/334027932.db2.gz SBAHHBMWYPCZRY-SNVBAGLBSA-N 1 2 322.384 4.047 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCOc2cc(Cl)ccc21)c1cscn1 ZINC000271913479 334028632 /nfs/dbraw/zinc/02/86/32/334028632.db2.gz YIOABHLQMXEWNM-GWCFXTLKSA-N 1 2 308.834 4.361 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc(-c3ccccc3)ns2)c(C)[nH+]1 ZINC000437286427 334041188 /nfs/dbraw/zinc/04/11/88/334041188.db2.gz CHPRLJFUBUNBHC-UHFFFAOYSA-N 1 2 323.421 4.383 20 0 DIADLO CC[N@H+](Cc1c(Cl)cnn1C)Cc1ccc2ccccc2c1 ZINC000437596362 334056115 /nfs/dbraw/zinc/05/61/15/334056115.db2.gz XIXAXMRKOHVLQV-UHFFFAOYSA-N 1 2 313.832 4.249 20 0 DIADLO CC[N@@H+](Cc1c(Cl)cnn1C)Cc1ccc2ccccc2c1 ZINC000437596362 334056117 /nfs/dbraw/zinc/05/61/17/334056117.db2.gz XIXAXMRKOHVLQV-UHFFFAOYSA-N 1 2 313.832 4.249 20 0 DIADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccccc1SC1CCCC1 ZINC000276518946 334080714 /nfs/dbraw/zinc/08/07/14/334080714.db2.gz CITXJWIQYOJUGQ-MDZDMXLPSA-N 1 2 313.426 4.096 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2cccc(F)c2F)[nH]1 ZINC000277071361 334086487 /nfs/dbraw/zinc/08/64/87/334086487.db2.gz DZCPQWKXLWKGCC-HBNTYKKESA-N 1 2 308.376 4.008 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+](C)[C@H](C)c1c(F)cccc1F ZINC000343508357 335173038 /nfs/dbraw/zinc/17/30/38/335173038.db2.gz HVWCEGXYWKVBRP-CYBMUJFWSA-N 1 2 307.388 4.244 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+](C)[C@H](C)c1c(F)cccc1F ZINC000343508357 335173039 /nfs/dbraw/zinc/17/30/39/335173039.db2.gz HVWCEGXYWKVBRP-CYBMUJFWSA-N 1 2 307.388 4.244 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000343559646 335177948 /nfs/dbraw/zinc/17/79/48/335177948.db2.gz YAMHLVKOLNAVFO-ZDUSSCGKSA-N 1 2 307.388 4.244 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000343559646 335177949 /nfs/dbraw/zinc/17/79/49/335177949.db2.gz YAMHLVKOLNAVFO-ZDUSSCGKSA-N 1 2 307.388 4.244 20 0 DIADLO C[C@@H](CSCc1cn2cc(Cl)ccc2[nH+]1)C(F)(F)F ZINC000439026336 334145754 /nfs/dbraw/zinc/14/57/54/334145754.db2.gz IKFQEHZPCNXBEB-QMMMGPOBSA-N 1 2 308.756 4.419 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2F)cc1O ZINC000289844036 334168454 /nfs/dbraw/zinc/16/84/54/334168454.db2.gz QUUQDTFTNZLFPG-GHMZBOCLSA-N 1 2 307.340 4.091 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](c2ccc(F)cc2)C(C)C)c(C)[nH+]1 ZINC000534474739 334271716 /nfs/dbraw/zinc/27/17/16/334271716.db2.gz NSIOOJJAFJNLQB-QGZVFWFLSA-N 1 2 300.377 4.216 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1ccc(F)c(C(F)(F)F)c1 ZINC000293598367 334199611 /nfs/dbraw/zinc/19/96/11/334199611.db2.gz JBLPNEXDEWOXHX-UHFFFAOYSA-N 1 2 316.298 4.027 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1ccc(F)c(C(F)(F)F)c1 ZINC000293598367 334199612 /nfs/dbraw/zinc/19/96/12/334199612.db2.gz JBLPNEXDEWOXHX-UHFFFAOYSA-N 1 2 316.298 4.027 20 0 DIADLO CC(F)(F)CCCNC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000295466182 334223718 /nfs/dbraw/zinc/22/37/18/334223718.db2.gz HNWWQRDRQBZIFT-UHFFFAOYSA-N 1 2 320.339 4.039 20 0 DIADLO CC1(C)C[C@H]([NH2+]Cc2ncc(C(F)(F)F)cn2)c2ccccc21 ZINC000296390885 334233550 /nfs/dbraw/zinc/23/35/50/334233550.db2.gz KBGVRYJVSOZRSU-AWEZNQCLSA-N 1 2 321.346 4.008 20 0 DIADLO CC(C)n1cc[nH+]c1CN(Cc1ccco1)Cc1cccs1 ZINC000299651427 334256840 /nfs/dbraw/zinc/25/68/40/334256840.db2.gz YDXYWPGWIQYOKO-UHFFFAOYSA-N 1 2 315.442 4.321 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)nc1 ZINC000514093003 334270901 /nfs/dbraw/zinc/27/09/01/334270901.db2.gz DBLYXWLUXSHNOP-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)nc1 ZINC000514093003 334270903 /nfs/dbraw/zinc/27/09/03/334270903.db2.gz DBLYXWLUXSHNOP-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[NH+]1CCN(Cc2ccsc2)CC1 ZINC000534522134 334278689 /nfs/dbraw/zinc/27/86/89/334278689.db2.gz WDOCJEQQJORTOF-CQSZACIVSA-N 1 2 320.889 4.280 20 0 DIADLO CC(C)(C)c1csc(C[N@H+]2CC=C(C(F)(F)F)CC2)n1 ZINC000534545176 334282414 /nfs/dbraw/zinc/28/24/14/334282414.db2.gz DKKODHUWUWSNGD-UHFFFAOYSA-N 1 2 304.381 4.135 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+]2CC=C(C(F)(F)F)CC2)n1 ZINC000534545176 334282415 /nfs/dbraw/zinc/28/24/15/334282415.db2.gz DKKODHUWUWSNGD-UHFFFAOYSA-N 1 2 304.381 4.135 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2ccc(Cl)s2)c2ncc[nH]2)cc1 ZINC000187862195 334298629 /nfs/dbraw/zinc/29/86/29/334298629.db2.gz MCFIHFAPSNIDGY-CQSZACIVSA-N 1 2 321.808 4.143 20 0 DIADLO Fc1ccc([C@@H](NCc2ccc(Cl)s2)c2[nH]cc[nH+]2)cc1 ZINC000187862195 334298630 /nfs/dbraw/zinc/29/86/30/334298630.db2.gz MCFIHFAPSNIDGY-CQSZACIVSA-N 1 2 321.808 4.143 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+](CC(=O)OC(C)(C)C)C1CC1 ZINC000110985103 334298951 /nfs/dbraw/zinc/29/89/51/334298951.db2.gz KOJKHFBQXNVWHZ-GFCCVEGCSA-N 1 2 309.837 4.207 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](CC(=O)OC(C)(C)C)C1CC1 ZINC000110985103 334298953 /nfs/dbraw/zinc/29/89/53/334298953.db2.gz KOJKHFBQXNVWHZ-GFCCVEGCSA-N 1 2 309.837 4.207 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)cc1 ZINC000531943821 334299966 /nfs/dbraw/zinc/29/99/66/334299966.db2.gz CLMSFQLFOUURCE-QFBILLFUSA-N 1 2 305.425 4.169 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000111239193 334312365 /nfs/dbraw/zinc/31/23/65/334312365.db2.gz JQMSHMBGUHQAGW-LBPRGKRZSA-N 1 2 304.459 4.339 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000111239193 334312366 /nfs/dbraw/zinc/31/23/66/334312366.db2.gz JQMSHMBGUHQAGW-LBPRGKRZSA-N 1 2 304.459 4.339 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2cc(F)cc(F)c2)nc2ccccc12 ZINC000531962401 334320287 /nfs/dbraw/zinc/32/02/87/334320287.db2.gz LDVBNZBAJDJRPW-LLVKDONJSA-N 1 2 313.351 4.067 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccccc2Cl)C[C@H](c2ccc(F)cc2)O1 ZINC000303840371 334336352 /nfs/dbraw/zinc/33/63/52/334336352.db2.gz BNZHRFRDJRFSJB-SCLBCKFNSA-N 1 2 319.807 4.441 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccccc2Cl)C[C@H](c2ccc(F)cc2)O1 ZINC000303840371 334336353 /nfs/dbraw/zinc/33/63/53/334336353.db2.gz BNZHRFRDJRFSJB-SCLBCKFNSA-N 1 2 319.807 4.441 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccccc2F)C2CCCCC2)nc1 ZINC000534841139 334339305 /nfs/dbraw/zinc/33/93/05/334339305.db2.gz OIJSXDJBWIJJAP-UHFFFAOYSA-N 1 2 313.420 4.259 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccccc2F)C2CCCCC2)nc1 ZINC000534841139 334339307 /nfs/dbraw/zinc/33/93/07/334339307.db2.gz OIJSXDJBWIJJAP-UHFFFAOYSA-N 1 2 313.420 4.259 20 0 DIADLO Cc1cc(OCCSCCn2cc[nH+]c2)ccc1C(C)C ZINC000534867032 334342196 /nfs/dbraw/zinc/34/21/96/334342196.db2.gz XAKDXWSVZVKPCJ-UHFFFAOYSA-N 1 2 304.459 4.127 20 0 DIADLO CCCCc1noc(C[N@@H+]2CCCC[C@@H]2c2ccc(C)cc2)n1 ZINC000303931976 334346256 /nfs/dbraw/zinc/34/62/56/334346256.db2.gz QVLCYINTRCTCKJ-QGZVFWFLSA-N 1 2 313.445 4.448 20 0 DIADLO CCCCc1noc(C[N@H+]2CCCC[C@@H]2c2ccc(C)cc2)n1 ZINC000303931976 334346257 /nfs/dbraw/zinc/34/62/57/334346257.db2.gz QVLCYINTRCTCKJ-QGZVFWFLSA-N 1 2 313.445 4.448 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Cl)cc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000303927319 334347375 /nfs/dbraw/zinc/34/73/75/334347375.db2.gz PYXDCZDIWTUAJH-UGSOOPFHSA-N 1 2 319.807 4.441 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Cl)cc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000303927319 334347377 /nfs/dbraw/zinc/34/73/77/334347377.db2.gz PYXDCZDIWTUAJH-UGSOOPFHSA-N 1 2 319.807 4.441 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Cl)cc2)C[C@H](c2ccc(F)cc2)O1 ZINC000303927317 334347572 /nfs/dbraw/zinc/34/75/72/334347572.db2.gz PYXDCZDIWTUAJH-SCLBCKFNSA-N 1 2 319.807 4.441 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Cl)cc2)C[C@H](c2ccc(F)cc2)O1 ZINC000303927317 334347573 /nfs/dbraw/zinc/34/75/73/334347573.db2.gz PYXDCZDIWTUAJH-SCLBCKFNSA-N 1 2 319.807 4.441 20 0 DIADLO COc1ccc(COc2ccccc2-n2cc[nH+]c2)cc1Cl ZINC000534996551 334353203 /nfs/dbraw/zinc/35/32/03/334353203.db2.gz OQLOXQVSCVYVFC-UHFFFAOYSA-N 1 2 314.772 4.113 20 0 DIADLO CCSc1cccc(C(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)c1 ZINC000535012419 334356134 /nfs/dbraw/zinc/35/61/34/334356134.db2.gz PJMFYJGBSIQHAJ-UHFFFAOYSA-N 1 2 323.421 4.441 20 0 DIADLO Fc1ccc(Br)cc1C[NH+]1CCC(C(F)F)CC1 ZINC000531982759 334356676 /nfs/dbraw/zinc/35/66/76/334356676.db2.gz XUWFAFLIBCRAEC-UHFFFAOYSA-N 1 2 322.168 4.065 20 0 DIADLO Cc1ccc(C)c([C@@H]2CCCN2C(=O)Nc2cc(C)[nH+]cc2C)c1 ZINC000535061910 334361898 /nfs/dbraw/zinc/36/18/98/334361898.db2.gz MYSOUULSDYQHDZ-IBGZPJMESA-N 1 2 323.440 4.106 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000535062970 334362100 /nfs/dbraw/zinc/36/21/00/334362100.db2.gz AAOZLSJRUPXRJZ-ZFWWWQNUSA-N 1 2 308.491 4.190 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000535062970 334362102 /nfs/dbraw/zinc/36/21/02/334362102.db2.gz AAOZLSJRUPXRJZ-ZFWWWQNUSA-N 1 2 308.491 4.190 20 0 DIADLO C[C@H]([NH2+]Cc1ccnc(OC2CCCCC2)c1)c1cscn1 ZINC000535065428 334362637 /nfs/dbraw/zinc/36/26/37/334362637.db2.gz RMQCYTOEPRTFKL-ZDUSSCGKSA-N 1 2 317.458 4.100 20 0 DIADLO Cc1cc(N2CCC[C@@H]2C2CCCC2)nc(-c2ccncc2)[nH+]1 ZINC000112075409 334364244 /nfs/dbraw/zinc/36/42/44/334364244.db2.gz CULAUZRDXXWGJC-QGZVFWFLSA-N 1 2 308.429 4.006 20 0 DIADLO CCCOc1cccc(C[N@H+](C)Cc2csc(CC)n2)c1 ZINC000535085293 334366978 /nfs/dbraw/zinc/36/69/78/334366978.db2.gz DHPCVGSFZZBDAU-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO CCCOc1cccc(C[N@@H+](C)Cc2csc(CC)n2)c1 ZINC000535085293 334366979 /nfs/dbraw/zinc/36/69/79/334366979.db2.gz DHPCVGSFZZBDAU-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO CC(C)[N@@H+](Cc1ccc(OCC(F)(F)F)cc1)CC(F)F ZINC000532013586 334374095 /nfs/dbraw/zinc/37/40/95/334374095.db2.gz JHDBSBHOYOABEW-UHFFFAOYSA-N 1 2 311.294 4.103 20 0 DIADLO CC(C)[N@H+](Cc1ccc(OCC(F)(F)F)cc1)CC(F)F ZINC000532013586 334374096 /nfs/dbraw/zinc/37/40/96/334374096.db2.gz JHDBSBHOYOABEW-UHFFFAOYSA-N 1 2 311.294 4.103 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@@H+]2Cc2cc3ccccc3o2)o1 ZINC000532013782 334374341 /nfs/dbraw/zinc/37/43/41/334374341.db2.gz REZGMYLLQHNXOD-KRWDZBQOSA-N 1 2 311.381 4.162 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@H+]2Cc2cc3ccccc3o2)o1 ZINC000532013782 334374342 /nfs/dbraw/zinc/37/43/42/334374342.db2.gz REZGMYLLQHNXOD-KRWDZBQOSA-N 1 2 311.381 4.162 20 0 DIADLO Cc1ccnc(C[NH2+][C@H](c2ccccc2)c2cccc(Cl)c2)n1 ZINC000535137924 334374656 /nfs/dbraw/zinc/37/46/56/334374656.db2.gz KTXTYWCXHXXKOG-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)Cc2cccc(Cl)c2)c(C)[nH+]1 ZINC000535206649 334380287 /nfs/dbraw/zinc/38/02/87/334380287.db2.gz MGTPZKIFAJJLSD-GFCCVEGCSA-N 1 2 316.832 4.478 20 0 DIADLO Cc1ccnc(C[N@H+](Cc2ccccc2Cl)C2CCCC2)n1 ZINC000535207370 334380308 /nfs/dbraw/zinc/38/03/08/334380308.db2.gz QDOGFNXRDKPXJS-UHFFFAOYSA-N 1 2 315.848 4.383 20 0 DIADLO Cc1ccnc(C[N@@H+](Cc2ccccc2Cl)C2CCCC2)n1 ZINC000535207370 334380309 /nfs/dbraw/zinc/38/03/09/334380309.db2.gz QDOGFNXRDKPXJS-UHFFFAOYSA-N 1 2 315.848 4.383 20 0 DIADLO Cc1ccc(NC(=O)NCc2cccc(Cl)c2Cl)c(C)[nH+]1 ZINC000532033802 334381400 /nfs/dbraw/zinc/38/14/00/334381400.db2.gz SHGMDHFLKRNWQB-UHFFFAOYSA-N 1 2 324.211 4.327 20 0 DIADLO Cc1ccc(C2CCN(c3ccc4ccc(F)cc4n3)CC2)c[nH+]1 ZINC000340811050 334387141 /nfs/dbraw/zinc/38/71/41/334387141.db2.gz BXLOZZOTXUKKOE-UHFFFAOYSA-N 1 2 321.399 4.461 20 0 DIADLO CC(C)Cn1cc(C[N@H+](Cc2ccco2)Cc2ccccc2)cn1 ZINC000340905779 334396506 /nfs/dbraw/zinc/39/65/06/334396506.db2.gz CVRBTVRPPQWZRR-UHFFFAOYSA-N 1 2 323.440 4.335 20 0 DIADLO CC(C)Cn1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2)cn1 ZINC000340905779 334396507 /nfs/dbraw/zinc/39/65/07/334396507.db2.gz CVRBTVRPPQWZRR-UHFFFAOYSA-N 1 2 323.440 4.335 20 0 DIADLO FC(F)c1ccnc(CNc2cc[nH+]c3c(Cl)cccc23)n1 ZINC000340997483 334398562 /nfs/dbraw/zinc/39/85/62/334398562.db2.gz QSDCVWHENBSJDS-UHFFFAOYSA-N 1 2 320.730 4.228 20 0 DIADLO CC(C)c1cc(N(Cc2ccccn2)C2CC2)nc(C(C)C)[nH+]1 ZINC000341254588 334425643 /nfs/dbraw/zinc/42/56/43/334425643.db2.gz AIVDYKDPMOGLLX-UHFFFAOYSA-N 1 2 310.445 4.287 20 0 DIADLO Brc1cnc(C[NH+]2CCC3(CCCC3)CC2)s1 ZINC000341313635 334434288 /nfs/dbraw/zinc/43/42/88/334434288.db2.gz ODQKTYCFLGZVQF-UHFFFAOYSA-N 1 2 315.280 4.062 20 0 DIADLO CC[C@@H](C)n1ncc(NCc2cn3cc(C)ccc3[nH+]2)c1C1CC1 ZINC000341397437 334438872 /nfs/dbraw/zinc/43/88/72/334438872.db2.gz QXQNZASHNHVFIH-CQSZACIVSA-N 1 2 323.444 4.300 20 0 DIADLO CC[C@H]([NH2+]Cc1csc([C@H](C)OC)n1)c1ccccc1OC ZINC000341661979 334463717 /nfs/dbraw/zinc/46/37/17/334463717.db2.gz SFANFVZXRGZBBI-WFASDCNBSA-N 1 2 320.458 4.100 20 0 DIADLO Cc1noc(C[NH2+][C@H](C)c2ccccc2Oc2ccccc2)n1 ZINC000341634966 334467167 /nfs/dbraw/zinc/46/71/67/334467167.db2.gz DTSGUJBJVHTQMI-CYBMUJFWSA-N 1 2 309.369 4.021 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)cs1 ZINC000341879642 334489065 /nfs/dbraw/zinc/48/90/65/334489065.db2.gz OJQKAYNABRWIOH-NSHDSACASA-N 1 2 322.861 4.283 20 0 DIADLO COc1cc[nH+]cc1CSCc1cc(-c2cccs2)on1 ZINC000341971210 334498378 /nfs/dbraw/zinc/49/83/78/334498378.db2.gz QPUSFFFOUYCFRL-UHFFFAOYSA-N 1 2 318.423 4.240 20 0 DIADLO Fc1cc(C(F)(F)F)c(F)cc1CSCCn1cc[nH+]c1 ZINC000342058600 334505734 /nfs/dbraw/zinc/50/57/34/334505734.db2.gz JXRPWFBTEXEFSS-UHFFFAOYSA-N 1 2 322.302 4.114 20 0 DIADLO CCN(Cc1c[nH]c2ccccc12)c1cc(C)[nH+]c(C2CC2)n1 ZINC000443500744 338452910 /nfs/dbraw/zinc/45/29/10/338452910.db2.gz NDNABARLPGURMW-UHFFFAOYSA-N 1 2 306.413 4.170 20 0 DIADLO Cc1ccc(C2CCN(c3ncc(Cl)cc3Cl)CC2)c[nH+]1 ZINC000342841566 334581627 /nfs/dbraw/zinc/58/16/27/334581627.db2.gz OUNASXPQCWHQJR-UHFFFAOYSA-N 1 2 322.239 4.476 20 0 DIADLO CC[C@@H]([NH2+]Cc1nccn1CC(C)C)c1cc(F)ccc1F ZINC000164781974 334666771 /nfs/dbraw/zinc/66/67/71/334666771.db2.gz PVUNZKXMBDXJEE-MRXNPFEDSA-N 1 2 307.388 4.058 20 0 DIADLO CSc1cccc(N[C@@H](c2[nH]cc[nH+]2)c2ccc(F)cc2)c1 ZINC000188312059 334684707 /nfs/dbraw/zinc/68/47/07/334684707.db2.gz DYHQZBHRZCYTST-MRXNPFEDSA-N 1 2 313.401 4.472 20 0 DIADLO CC[C@@H](CNC(=O)Nc1c(C)cc(C)[nH+]c1C)CC(F)(F)F ZINC000417136837 334694954 /nfs/dbraw/zinc/69/49/54/334694954.db2.gz JKEHFDDKKVQTCP-GFCCVEGCSA-N 1 2 317.355 4.107 20 0 DIADLO CC1(C)C[NH+](Cc2nc(-c3ccccc3)cs2)CC(C)(C)O1 ZINC000443855709 338461633 /nfs/dbraw/zinc/46/16/33/338461633.db2.gz QTFTVYXPYBVUNL-UHFFFAOYSA-N 1 2 316.470 4.200 20 0 DIADLO FC(F)[C@@H](CCc1ccccc1)[NH2+][C@@H]1COCc2ccccc21 ZINC000417360001 334724021 /nfs/dbraw/zinc/72/40/21/334724021.db2.gz JJCXZQDBDFXFOI-QZTJIDSGSA-N 1 2 317.379 4.114 20 0 DIADLO FC(F)[C@H](CCc1ccccc1)[NH2+][C@@H]1COCc2ccccc21 ZINC000417360003 334724340 /nfs/dbraw/zinc/72/43/40/334724340.db2.gz JJCXZQDBDFXFOI-ZWKOTPCHSA-N 1 2 317.379 4.114 20 0 DIADLO CC(C)n1c[nH+]cc1CN(C)[C@H](C)c1nc2ccccc2s1 ZINC000425323642 334735090 /nfs/dbraw/zinc/73/50/90/334735090.db2.gz LDAKGSBKRXKOSX-CYBMUJFWSA-N 1 2 314.458 4.267 20 0 DIADLO CC(C)n1c[nH+]cc1CN(C)Cc1c(Cl)cccc1Cl ZINC000425329299 334769802 /nfs/dbraw/zinc/76/98/02/334769802.db2.gz SUMSAKZFHNWZOY-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2c(C)cc(C(C)(C)C)cc2C)no1 ZINC000330625651 334798144 /nfs/dbraw/zinc/79/81/44/334798144.db2.gz HUZYWRYSBXQTOD-UHFFFAOYSA-N 1 2 315.461 4.317 20 0 DIADLO CS[C@@H]1CC[C@H]1Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000425344950 334803926 /nfs/dbraw/zinc/80/39/26/334803926.db2.gz UVHFFIGLDQRMNX-IAGOWNOFSA-N 1 2 313.470 4.192 20 0 DIADLO Cc1ccc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)o1 ZINC000444007009 338466780 /nfs/dbraw/zinc/46/67/80/338466780.db2.gz DKFCLBRPDUJQMB-UHFFFAOYSA-N 1 2 307.397 4.400 20 0 DIADLO Fc1cncc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)c1 ZINC000444016605 338467220 /nfs/dbraw/zinc/46/72/20/338467220.db2.gz MISJJPVOSAPTQP-UHFFFAOYSA-N 1 2 322.387 4.033 20 0 DIADLO C[C@@H](C1CC1)n1cc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)cn1 ZINC000563693992 334860573 /nfs/dbraw/zinc/86/05/73/334860573.db2.gz UTYYMYZXWPCPPQ-GUYCJALGSA-N 1 2 313.449 4.311 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2cc(F)ccc2Cl)C2CC2)n1 ZINC000189353021 334892606 /nfs/dbraw/zinc/89/26/06/334892606.db2.gz CAZJWRQURYVMHC-CQSZACIVSA-N 1 2 310.825 4.485 20 0 DIADLO C[C@H](Sc1[nH+]cc2ccccn21)c1nccn1-c1ccccc1 ZINC000343843812 335196960 /nfs/dbraw/zinc/19/69/60/335196960.db2.gz TVHGHNNHZGJZRQ-AWEZNQCLSA-N 1 2 320.421 4.373 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)o1 ZINC000343853366 335197429 /nfs/dbraw/zinc/19/74/29/335197429.db2.gz HTJBOCCQOGWWGB-IUCAKERBSA-N 1 2 304.337 4.475 20 0 DIADLO COc1cc[nH+]cc1CSc1nc2cc(Cl)ccc2o1 ZINC000343833925 335200509 /nfs/dbraw/zinc/20/05/09/335200509.db2.gz GRTXQDIGZGAZOE-UHFFFAOYSA-N 1 2 306.774 4.177 20 0 DIADLO Cc1cn2cc(NC(=O)c3[nH]c4ccccc4c3Cl)ccc2[nH+]1 ZINC000343837462 335200698 /nfs/dbraw/zinc/20/06/98/335200698.db2.gz UBAOGVZMYBDAIZ-UHFFFAOYSA-N 1 2 324.771 4.030 20 0 DIADLO Cc1ccc([C@H]2CCN(C(=O)Nc3ccc(C)[nH+]c3C)C2)c(C)c1 ZINC000344040862 335211532 /nfs/dbraw/zinc/21/15/32/335211532.db2.gz FAZWBZQACCIQIC-KRWDZBQOSA-N 1 2 323.440 4.337 20 0 DIADLO c1cc2c(s1)CC[N@@H+](Cc1csc(C3CCCC3)n1)C2 ZINC000344064662 335214515 /nfs/dbraw/zinc/21/45/15/335214515.db2.gz PZWIWBDKDFPSMN-UHFFFAOYSA-N 1 2 304.484 4.421 20 0 DIADLO c1cc2c(s1)CC[N@H+](Cc1csc(C3CCCC3)n1)C2 ZINC000344064662 335214516 /nfs/dbraw/zinc/21/45/16/335214516.db2.gz PZWIWBDKDFPSMN-UHFFFAOYSA-N 1 2 304.484 4.421 20 0 DIADLO COc1cc[nH+]cc1CSCc1cccc(OC(F)F)c1 ZINC000344141868 335221174 /nfs/dbraw/zinc/22/11/74/335221174.db2.gz QFMIIKZKDGUVII-UHFFFAOYSA-N 1 2 311.353 4.125 20 0 DIADLO Cn1c2ccc(NC(=O)CC(C)(C)C3CC3)cc2[nH+]c1C1CC1 ZINC000344197490 335224179 /nfs/dbraw/zinc/22/41/79/335224179.db2.gz MMYHUFBOLYRILN-UHFFFAOYSA-N 1 2 311.429 4.216 20 0 DIADLO Fc1cccc(-c2nc(C[N@@H+]3CCCc4occc4C3)co2)c1 ZINC000344242787 335231557 /nfs/dbraw/zinc/23/15/57/335231557.db2.gz ZHKZQRQTMUBRTA-UHFFFAOYSA-N 1 2 312.344 4.022 20 0 DIADLO Fc1cccc(-c2nc(C[N@H+]3CCCc4occc4C3)co2)c1 ZINC000344242787 335231558 /nfs/dbraw/zinc/23/15/58/335231558.db2.gz ZHKZQRQTMUBRTA-UHFFFAOYSA-N 1 2 312.344 4.022 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3ccc(C)nc3C)cc2[nH+]1 ZINC000344330164 335241457 /nfs/dbraw/zinc/24/14/57/335241457.db2.gz NOFLDMHCBGRDNE-UHFFFAOYSA-N 1 2 322.412 4.170 20 0 DIADLO CC(C)c1cnc(CNc2c[nH+]ccc2OC(C)(C)C)s1 ZINC000344321274 335245322 /nfs/dbraw/zinc/24/53/22/335245322.db2.gz FETHVOMNYUBUPZ-UHFFFAOYSA-N 1 2 305.447 4.451 20 0 DIADLO CC(C)n1cc[nH+]c1CN1CC[C@@H](C)Sc2ccccc21 ZINC000344437153 335253971 /nfs/dbraw/zinc/25/39/71/335253971.db2.gz OZNATHVVJSXJKX-CQSZACIVSA-N 1 2 301.459 4.355 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2ccc(Cl)c(Cl)c2)s1 ZINC000344632441 335265467 /nfs/dbraw/zinc/26/54/67/335265467.db2.gz TUSDUEIYFIZPNO-UHFFFAOYSA-N 1 2 316.257 4.258 20 0 DIADLO CCn1c(C)nnc1C[N@H+](C)[C@H](c1ccccc1Cl)C(C)C ZINC000113256684 335284186 /nfs/dbraw/zinc/28/41/86/335284186.db2.gz JPUSNUQDMMQWSL-KRWDZBQOSA-N 1 2 320.868 4.089 20 0 DIADLO CCn1c(C)nnc1C[N@@H+](C)[C@H](c1ccccc1Cl)C(C)C ZINC000113256684 335284188 /nfs/dbraw/zinc/28/41/88/335284188.db2.gz JPUSNUQDMMQWSL-KRWDZBQOSA-N 1 2 320.868 4.089 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCS[C@@H](C)[C@@H]3C)cs2)o1 ZINC000345111799 335299027 /nfs/dbraw/zinc/29/90/27/335299027.db2.gz OMYDWMGQFHACDD-RYUDHWBXSA-N 1 2 308.472 4.037 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCS[C@@H](C)[C@@H]3C)cs2)o1 ZINC000345111799 335299028 /nfs/dbraw/zinc/29/90/28/335299028.db2.gz OMYDWMGQFHACDD-RYUDHWBXSA-N 1 2 308.472 4.037 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCS[C@@H](C)[C@H]3C)cs2)o1 ZINC000345111795 335299077 /nfs/dbraw/zinc/29/90/77/335299077.db2.gz OMYDWMGQFHACDD-NEPJUHHUSA-N 1 2 308.472 4.037 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCS[C@@H](C)[C@H]3C)cs2)o1 ZINC000345111795 335299079 /nfs/dbraw/zinc/29/90/79/335299079.db2.gz OMYDWMGQFHACDD-NEPJUHHUSA-N 1 2 308.472 4.037 20 0 DIADLO Cc1sc(Cc2[nH+]ccn2Cc2ccccc2)nc1C1CC1 ZINC000345346823 335319423 /nfs/dbraw/zinc/31/94/23/335319423.db2.gz NBYOIKBKWUAXDW-UHFFFAOYSA-N 1 2 309.438 4.165 20 0 DIADLO Cc1ccc(-n2cc(NCc3ccc(C)[nH+]c3C)cn2)c(C)c1 ZINC000345365178 335320762 /nfs/dbraw/zinc/32/07/62/335320762.db2.gz JPNGCFGBYIBOBV-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO CC(C)n1cc[nH+]c1CNc1ccc(Oc2cccnc2)cc1 ZINC000345532248 335331368 /nfs/dbraw/zinc/33/13/68/335331368.db2.gz FBFDUQSCOHMNPG-UHFFFAOYSA-N 1 2 308.385 4.263 20 0 DIADLO Cc1cc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)ccc1Cl ZINC000345683263 335341388 /nfs/dbraw/zinc/34/13/88/335341388.db2.gz ZYUMKFLCLDYSLM-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO COc1cc[nH+]cc1NC(=O)C[C@H]1C[C@H](C(C)C)c2ccccc21 ZINC000345739841 335346984 /nfs/dbraw/zinc/34/69/84/335346984.db2.gz KJOFPNXFQFVJPA-RHSMWYFYSA-N 1 2 324.424 4.346 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2ccc(F)cn2)C2CC2)o1 ZINC000345775986 335350636 /nfs/dbraw/zinc/35/06/36/335350636.db2.gz RSTUJTZVGFVNIU-PXAZEXFGSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2ccc(F)cn2)C2CC2)o1 ZINC000345775986 335350637 /nfs/dbraw/zinc/35/06/37/335350637.db2.gz RSTUJTZVGFVNIU-PXAZEXFGSA-N 1 2 300.377 4.102 20 0 DIADLO CSC1(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)CCC1 ZINC000345969060 335364795 /nfs/dbraw/zinc/36/47/95/335364795.db2.gz FAGXBKWQEFZSSS-UHFFFAOYSA-N 1 2 314.410 4.098 20 0 DIADLO CCc1cnc(C[N@H+]2CC=C(c3cccc(OC)c3)CC2)s1 ZINC000346166976 335384470 /nfs/dbraw/zinc/38/44/70/335384470.db2.gz JMCGUJSJNCYDAG-UHFFFAOYSA-N 1 2 314.454 4.003 20 0 DIADLO CCc1cnc(C[N@@H+]2CC=C(c3cccc(OC)c3)CC2)s1 ZINC000346166976 335384472 /nfs/dbraw/zinc/38/44/72/335384472.db2.gz JMCGUJSJNCYDAG-UHFFFAOYSA-N 1 2 314.454 4.003 20 0 DIADLO CCc1cnc(C[N@H+](C)[C@H]2CCCc3nc(CC)sc32)s1 ZINC000346225673 335386076 /nfs/dbraw/zinc/38/60/76/335386076.db2.gz SBGUPZZMONYFGV-ZDUSSCGKSA-N 1 2 321.515 4.234 20 0 DIADLO CCc1cnc(C[N@@H+](C)[C@H]2CCCc3nc(CC)sc32)s1 ZINC000346225673 335386077 /nfs/dbraw/zinc/38/60/77/335386077.db2.gz SBGUPZZMONYFGV-ZDUSSCGKSA-N 1 2 321.515 4.234 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)C2CCC(F)(F)CC2)[nH+]1 ZINC000366937323 335391311 /nfs/dbraw/zinc/39/13/11/335391311.db2.gz BTDMWGFBUJRTSB-UHFFFAOYSA-N 1 2 319.355 4.149 20 0 DIADLO CC[C@@H](NC(=O)c1ccc(C(C)C)c(Cl)c1)c1[nH]cc[nH+]1 ZINC000346251696 335394677 /nfs/dbraw/zinc/39/46/77/335394677.db2.gz LAGVGWDQPZFIRG-CQSZACIVSA-N 1 2 305.809 4.068 20 0 DIADLO CCS[C@H](C)c1noc(-c2cc(C)ccc2-n2cc[nH+]c2)n1 ZINC000346870019 335451375 /nfs/dbraw/zinc/45/13/75/335451375.db2.gz DKHRAQHFPOAFND-GFCCVEGCSA-N 1 2 314.414 4.045 20 0 DIADLO COc1ccncc1C[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC000346928745 335455392 /nfs/dbraw/zinc/45/53/92/335455392.db2.gz XSBISYVLIVESMF-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO CCOc1ccc([C@@H](C)Nc2ccc(C)[nH+]c2)cc1OCC ZINC000347140245 335472914 /nfs/dbraw/zinc/47/29/14/335472914.db2.gz ZWZLOYLORLIFFK-CQSZACIVSA-N 1 2 300.402 4.361 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1Cl)c1csnn1 ZINC000398356547 335646502 /nfs/dbraw/zinc/64/65/02/335646502.db2.gz ZTXIRYHQEAUXGR-YUMQZZPRSA-N 1 2 302.230 4.257 20 0 DIADLO CC(C)c1cc(N2CCC[C@]3(CCCOC3)C2)nc(C(C)C)[nH+]1 ZINC000535593504 335657220 /nfs/dbraw/zinc/65/72/20/335657220.db2.gz VWKMGCYSJACHSE-IBGZPJMESA-N 1 2 317.477 4.120 20 0 DIADLO CC(C)COc1ccccc1C[NH2+]Cc1ncc(Cl)s1 ZINC000349707672 335693487 /nfs/dbraw/zinc/69/34/87/335693487.db2.gz WYMJCBKPOOXXHV-UHFFFAOYSA-N 1 2 310.850 4.121 20 0 DIADLO CCCOc1cccc2c(N(C)Cc3cccnc3)cc[nH+]c12 ZINC000350340178 335747178 /nfs/dbraw/zinc/74/71/78/335747178.db2.gz CGGFGDOWKGNUQE-UHFFFAOYSA-N 1 2 307.397 4.055 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)no1 ZINC000097079502 335839466 /nfs/dbraw/zinc/83/94/66/335839466.db2.gz RFEIHHKSNTWZNL-QGZVFWFLSA-N 1 2 319.424 4.428 20 0 DIADLO CCN(Cc1cn2cc(Cl)ccc2[nH+]1)c1ccccc1OC ZINC000519658034 335886005 /nfs/dbraw/zinc/88/60/05/335886005.db2.gz SHNJUKWQALMTPM-UHFFFAOYSA-N 1 2 315.804 4.023 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@H](C)c2ccc(F)cc2)c(C)[nH+]1 ZINC000520507674 335984999 /nfs/dbraw/zinc/98/49/99/335984999.db2.gz ITPFTEGJYBJNJE-NSHDSACASA-N 1 2 300.377 4.278 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1CC12CCCCC2 ZINC000520684903 336015451 /nfs/dbraw/zinc/01/54/51/336015451.db2.gz RIXVEHOCIGQDLC-HNNXBMFYSA-N 1 2 309.413 4.294 20 0 DIADLO CCc1nocc1C[N@H+](Cc1cccc(C)c1)Cc1ccccn1 ZINC000351394540 336031872 /nfs/dbraw/zinc/03/18/72/336031872.db2.gz FRAQDFYIBGUJLA-UHFFFAOYSA-N 1 2 321.424 4.143 20 0 DIADLO CCc1nocc1C[N@@H+](Cc1cccc(C)c1)Cc1ccccn1 ZINC000351394540 336031874 /nfs/dbraw/zinc/03/18/74/336031874.db2.gz FRAQDFYIBGUJLA-UHFFFAOYSA-N 1 2 321.424 4.143 20 0 DIADLO c1nc(C2CCC2)sc1C[N@@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000351572835 336046091 /nfs/dbraw/zinc/04/60/91/336046091.db2.gz GJJDZBRLWJGDGF-KRWDZBQOSA-N 1 2 320.502 4.192 20 0 DIADLO c1nc(C2CCC2)sc1C[N@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000351572835 336046092 /nfs/dbraw/zinc/04/60/92/336046092.db2.gz GJJDZBRLWJGDGF-KRWDZBQOSA-N 1 2 320.502 4.192 20 0 DIADLO Cc1ccc(CC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)s1 ZINC000351596832 336048641 /nfs/dbraw/zinc/04/86/41/336048641.db2.gz WPWBWJTXQYUDBM-UHFFFAOYSA-N 1 2 324.405 4.425 20 0 DIADLO CC[N@H+](Cc1nccn1C(F)F)Cc1ccc2ccccc2c1 ZINC000351618632 336050984 /nfs/dbraw/zinc/05/09/84/336050984.db2.gz BCZDUSOTWUSUJO-UHFFFAOYSA-N 1 2 315.367 4.454 20 0 DIADLO CC[N@@H+](Cc1nccn1C(F)F)Cc1ccc2ccccc2c1 ZINC000351618632 336050986 /nfs/dbraw/zinc/05/09/86/336050986.db2.gz BCZDUSOTWUSUJO-UHFFFAOYSA-N 1 2 315.367 4.454 20 0 DIADLO Cc1n[nH]cc1C[N@H+](Cc1ccccc1)Cc1ccccc1F ZINC000351674024 336056855 /nfs/dbraw/zinc/05/68/55/336056855.db2.gz SFBDUXZXTVCGTJ-UHFFFAOYSA-N 1 2 309.388 4.060 20 0 DIADLO Cc1n[nH]cc1C[N@@H+](Cc1ccccc1)Cc1ccccc1F ZINC000351674024 336056856 /nfs/dbraw/zinc/05/68/56/336056856.db2.gz SFBDUXZXTVCGTJ-UHFFFAOYSA-N 1 2 309.388 4.060 20 0 DIADLO CC[C@](C)([NH2+]Cc1cccc(OC(C)(C)C)n1)c1nccs1 ZINC000351703749 336060117 /nfs/dbraw/zinc/06/01/17/336060117.db2.gz QRCBAZDRHQCOGJ-KRWDZBQOSA-N 1 2 319.474 4.130 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2cccc(OC(C)(C)C)n2)n1 ZINC000351702770 336060242 /nfs/dbraw/zinc/06/02/42/336060242.db2.gz DGNLGEALUPMBEW-UHFFFAOYSA-N 1 2 319.474 4.049 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1nc2ccccc2s1 ZINC000029189068 336068908 /nfs/dbraw/zinc/06/89/08/336068908.db2.gz PECPYJRSRACPFX-LLVKDONJSA-N 1 2 300.452 4.477 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1nc2ccccc2s1 ZINC000029189068 336068909 /nfs/dbraw/zinc/06/89/09/336068909.db2.gz PECPYJRSRACPFX-LLVKDONJSA-N 1 2 300.452 4.477 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3[nH]c4ccc(F)cc4c3C2)s1 ZINC000351819769 336070272 /nfs/dbraw/zinc/07/02/72/336070272.db2.gz LRZYNQJCJGXVHZ-UHFFFAOYSA-N 1 2 300.402 4.235 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3[nH]c4ccc(F)cc4c3C2)s1 ZINC000351819769 336070273 /nfs/dbraw/zinc/07/02/73/336070273.db2.gz LRZYNQJCJGXVHZ-UHFFFAOYSA-N 1 2 300.402 4.235 20 0 DIADLO Cc1ccsc1C[N@@H+]1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000351824851 336070548 /nfs/dbraw/zinc/07/05/48/336070548.db2.gz UHRGDDBLKAVXQB-UHFFFAOYSA-N 1 2 300.402 4.235 20 0 DIADLO Cc1ccsc1C[N@H+]1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000351824851 336070549 /nfs/dbraw/zinc/07/05/49/336070549.db2.gz UHRGDDBLKAVXQB-UHFFFAOYSA-N 1 2 300.402 4.235 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1cccn1C1CCCC1 ZINC000351845866 336073204 /nfs/dbraw/zinc/07/32/04/336073204.db2.gz NINCSKFVEGZOTH-UHFFFAOYSA-N 1 2 320.396 4.041 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cccn1C1CCCC1 ZINC000351853529 336073591 /nfs/dbraw/zinc/07/35/91/336073591.db2.gz OQOWFMVJBKFZDG-UHFFFAOYSA-N 1 2 320.396 4.041 20 0 DIADLO CCc1ccc([C@H]2CCC[N@@H+]2[C@@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331403823 336134855 /nfs/dbraw/zinc/13/48/55/336134855.db2.gz NSPHKJUDNONMJR-GXTWGEPZSA-N 1 2 317.433 4.421 20 0 DIADLO CCc1ccc([C@H]2CCC[N@H+]2[C@@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331403823 336134856 /nfs/dbraw/zinc/13/48/56/336134856.db2.gz NSPHKJUDNONMJR-GXTWGEPZSA-N 1 2 317.433 4.421 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(=O)c2sccc2[nH]1)[C@H](C)C1CCCCC1 ZINC000332120624 336159464 /nfs/dbraw/zinc/15/94/64/336159464.db2.gz YVBIBWDWPHXNNA-NWDGAFQWSA-N 1 2 319.474 4.091 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2CCCc3ccccc32)c(C)[nH+]1 ZINC000332181747 336161700 /nfs/dbraw/zinc/16/17/00/336161700.db2.gz VTROXPFYZWRUJB-KRWDZBQOSA-N 1 2 309.413 4.206 20 0 DIADLO Cc1ccc([C@@H](C)NC(=O)Nc2c(C)cc[nH+]c2C)cc1F ZINC000351937253 336181570 /nfs/dbraw/zinc/18/15/70/336181570.db2.gz PEXLIQUZJMRXOW-GFCCVEGCSA-N 1 2 301.365 4.029 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1sccc1Cl ZINC000351960375 336183262 /nfs/dbraw/zinc/18/32/62/336183262.db2.gz TYEPYKXXNQPONX-UHFFFAOYSA-N 1 2 303.774 4.044 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)Cc1ccc(F)c(Cl)c1 ZINC000351942062 336184256 /nfs/dbraw/zinc/18/42/56/336184256.db2.gz AICPHXROPBDKBW-UHFFFAOYSA-N 1 2 321.783 4.155 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000351983988 336185814 /nfs/dbraw/zinc/18/58/14/336185814.db2.gz WATYNTHBWIZIPI-SECBINFHSA-N 1 2 314.788 4.064 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000351983988 336185816 /nfs/dbraw/zinc/18/58/16/336185816.db2.gz WATYNTHBWIZIPI-SECBINFHSA-N 1 2 314.788 4.064 20 0 DIADLO Cc1csc([C@@H]2CCCC[N@@H+]2Cc2cc(O)cc(F)c2)n1 ZINC000352001437 336187454 /nfs/dbraw/zinc/18/74/54/336187454.db2.gz GBIOTCLVZGVVLV-HNNXBMFYSA-N 1 2 306.406 4.023 20 0 DIADLO Cc1csc([C@@H]2CCCC[N@H+]2Cc2cc(O)cc(F)c2)n1 ZINC000352001437 336187456 /nfs/dbraw/zinc/18/74/56/336187456.db2.gz GBIOTCLVZGVVLV-HNNXBMFYSA-N 1 2 306.406 4.023 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1ncc(Cl)s1)CCC2 ZINC000352002583 336187874 /nfs/dbraw/zinc/18/78/74/336187874.db2.gz MHZRGJDTLSXYSF-SNVBAGLBSA-N 1 2 313.879 4.071 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ncc(Cl)s1)CCC2 ZINC000352002583 336187876 /nfs/dbraw/zinc/18/78/76/336187876.db2.gz MHZRGJDTLSXYSF-SNVBAGLBSA-N 1 2 313.879 4.071 20 0 DIADLO COCC[N@H+](Cc1ncc(Cl)s1)[C@H](C)c1ccccc1 ZINC000352010593 336188478 /nfs/dbraw/zinc/18/84/78/336188478.db2.gz GUPBKJUDUZHDGQ-GFCCVEGCSA-N 1 2 310.850 4.006 20 0 DIADLO COCC[N@@H+](Cc1ncc(Cl)s1)[C@H](C)c1ccccc1 ZINC000352010593 336188480 /nfs/dbraw/zinc/18/84/80/336188480.db2.gz GUPBKJUDUZHDGQ-GFCCVEGCSA-N 1 2 310.850 4.006 20 0 DIADLO Cc1nc(C[N@H+]2CC=C(c3c(F)cccc3F)CC2)sc1C ZINC000352021992 336189701 /nfs/dbraw/zinc/18/97/01/336189701.db2.gz NMRIFBZQVNWLHC-UHFFFAOYSA-N 1 2 320.408 4.327 20 0 DIADLO Cc1nc(C[N@@H+]2CC=C(c3c(F)cccc3F)CC2)sc1C ZINC000352021992 336189702 /nfs/dbraw/zinc/18/97/02/336189702.db2.gz NMRIFBZQVNWLHC-UHFFFAOYSA-N 1 2 320.408 4.327 20 0 DIADLO Cc1ccc(CNc2cc(-c3ccnn3C)ccc2C)c(C)[nH+]1 ZINC000352034445 336190804 /nfs/dbraw/zinc/19/08/04/336190804.db2.gz BUFIBHLNVOCUFL-UHFFFAOYSA-N 1 2 306.413 4.019 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)cs1 ZINC000352431636 336218240 /nfs/dbraw/zinc/21/82/40/336218240.db2.gz MLVVLKHWPKGFNM-DOTOQJQBSA-N 1 2 320.502 4.019 20 0 DIADLO CCCCc1nc(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)cs1 ZINC000352431636 336218241 /nfs/dbraw/zinc/21/82/41/336218241.db2.gz MLVVLKHWPKGFNM-DOTOQJQBSA-N 1 2 320.502 4.019 20 0 DIADLO Fc1cccc(Cl)c1C[N@@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000352439167 336218830 /nfs/dbraw/zinc/21/88/30/336218830.db2.gz KHJMZRDTIVOYQB-HOTGVXAUSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cccc(Cl)c1C[N@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000352439167 336218831 /nfs/dbraw/zinc/21/88/31/336218831.db2.gz KHJMZRDTIVOYQB-HOTGVXAUSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)c1 ZINC000352449279 336219700 /nfs/dbraw/zinc/21/97/00/336219700.db2.gz YLGGXZLBOSFIEX-HZPDHXFCSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)c1 ZINC000352449279 336219701 /nfs/dbraw/zinc/21/97/01/336219701.db2.gz YLGGXZLBOSFIEX-HZPDHXFCSA-N 1 2 309.812 4.013 20 0 DIADLO CC[C@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccc(F)cn1 ZINC000352556179 336224396 /nfs/dbraw/zinc/22/43/96/336224396.db2.gz WLSBSRAUMNIJBD-ZDUSSCGKSA-N 1 2 317.389 4.178 20 0 DIADLO CC1(C)C[C@H]1CNC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000352597504 336226208 /nfs/dbraw/zinc/22/62/08/336226208.db2.gz JRIMAQLOJLEPCL-ZDUSSCGKSA-N 1 2 311.385 4.042 20 0 DIADLO Cc1ccc(C(=O)CCCCC(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000352730002 336232871 /nfs/dbraw/zinc/23/28/71/336232871.db2.gz PQLJVZNSLQROAS-UHFFFAOYSA-N 1 2 324.424 4.389 20 0 DIADLO C[C@@H]1CCC[C@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000352764193 336233753 /nfs/dbraw/zinc/23/37/53/336233753.db2.gz VFVWFDNDBIZHKJ-ZBFHGGJFSA-N 1 2 310.397 4.182 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccccc2)c2ccccn2)sc1C ZINC000352782281 336236229 /nfs/dbraw/zinc/23/62/29/336236229.db2.gz HBQFCOQERADINZ-GOSISDBHSA-N 1 2 309.438 4.034 20 0 DIADLO c1coc(C[N@H+](Cc2cn3ccsc3n2)Cc2ccccc2)c1 ZINC000352799333 336238008 /nfs/dbraw/zinc/23/80/08/336238008.db2.gz QUNKGOLBZLDTFS-UHFFFAOYSA-N 1 2 323.421 4.191 20 0 DIADLO c1coc(C[N@@H+](Cc2cn3ccsc3n2)Cc2ccccc2)c1 ZINC000352799333 336238009 /nfs/dbraw/zinc/23/80/09/336238009.db2.gz QUNKGOLBZLDTFS-UHFFFAOYSA-N 1 2 323.421 4.191 20 0 DIADLO C[C@H]1CC[C@@H](c2ccccc2)[N@H+](Cc2nccn2C(F)F)C1 ZINC000352799196 336238576 /nfs/dbraw/zinc/23/85/76/336238576.db2.gz FQPLJCZLHBVVPY-ZFWWWQNUSA-N 1 2 305.372 4.251 20 0 DIADLO C[C@H]1CC[C@@H](c2ccccc2)[N@@H+](Cc2nccn2C(F)F)C1 ZINC000352799196 336238577 /nfs/dbraw/zinc/23/85/77/336238577.db2.gz FQPLJCZLHBVVPY-ZFWWWQNUSA-N 1 2 305.372 4.251 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2)C[C@@H](c2ccsc2)O1 ZINC000532352204 336243787 /nfs/dbraw/zinc/24/37/87/336243787.db2.gz SGMHVIYEXXZLCG-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2)C[C@@H](c2ccsc2)O1 ZINC000532352204 336243788 /nfs/dbraw/zinc/24/37/88/336243788.db2.gz SGMHVIYEXXZLCG-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO CCc1cc(C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)sc1C ZINC000103967306 336244104 /nfs/dbraw/zinc/24/41/04/336244104.db2.gz QTDBRJMZINTCHF-UHFFFAOYSA-N 1 2 311.410 4.261 20 0 DIADLO CCc1cc(C[NH2+][C@@H](C)c2cc(Cl)sc2Cl)on1 ZINC000532520217 336253408 /nfs/dbraw/zinc/25/34/08/336253408.db2.gz CGKXOISLMQGRJL-ZETCQYMHSA-N 1 2 305.230 4.456 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cc(F)ccc1F ZINC000192751940 336260578 /nfs/dbraw/zinc/26/05/78/336260578.db2.gz VINSLQNCMNQOMY-LBPRGKRZSA-N 1 2 303.356 4.133 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)cc1C ZINC000580389130 336263281 /nfs/dbraw/zinc/26/32/81/336263281.db2.gz MBVOLDHFKFWOAQ-XLIONFOSSA-N 1 2 319.452 4.477 20 0 DIADLO COc1cccc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)n1 ZINC000532655939 336266025 /nfs/dbraw/zinc/26/60/25/336266025.db2.gz GFZMTMHJPYHDLK-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1cccc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)n1 ZINC000532655939 336266026 /nfs/dbraw/zinc/26/60/26/336266026.db2.gz GFZMTMHJPYHDLK-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@H]2c2ccsc2)cc1Cl ZINC000532779558 336270850 /nfs/dbraw/zinc/27/08/50/336270850.db2.gz VAEJQYGWYBBSIR-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@H]2c2ccsc2)cc1Cl ZINC000532779558 336270851 /nfs/dbraw/zinc/27/08/51/336270851.db2.gz VAEJQYGWYBBSIR-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO C[C@H](c1ccccc1Br)[N@H+](C)Cc1ccccn1 ZINC000104948890 336271941 /nfs/dbraw/zinc/27/19/41/336271941.db2.gz SFHWXDLMBZAIBW-GFCCVEGCSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@H](c1ccccc1Br)[N@@H+](C)Cc1ccccn1 ZINC000104948890 336271942 /nfs/dbraw/zinc/27/19/42/336271942.db2.gz SFHWXDLMBZAIBW-GFCCVEGCSA-N 1 2 305.219 4.037 20 0 DIADLO CC1(C)Cc2cccc(CNc3cccc(-n4cc[nH+]c4)c3)c2O1 ZINC000324974464 336276134 /nfs/dbraw/zinc/27/61/34/336276134.db2.gz QNOISMFJNLTMIY-UHFFFAOYSA-N 1 2 319.408 4.198 20 0 DIADLO Fc1cccc(-c2ccc(C[NH2+]Cc3ncccc3F)o2)c1F ZINC000526991163 336278051 /nfs/dbraw/zinc/27/80/51/336278051.db2.gz KEQMVGKTOVMYEW-UHFFFAOYSA-N 1 2 318.298 4.049 20 0 DIADLO COc1ccc(C)cc1N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000192902763 336283164 /nfs/dbraw/zinc/28/31/64/336283164.db2.gz FREYEXJSDNQJHB-HNNXBMFYSA-N 1 2 307.397 4.362 20 0 DIADLO COc1ccc([C@@H]2CCCN2c2cc(C)[nH+]c(C(C)C)n2)cc1 ZINC000301056917 336287533 /nfs/dbraw/zinc/28/75/33/336287533.db2.gz IDNLZXQINSRBRE-KRWDZBQOSA-N 1 2 311.429 4.259 20 0 DIADLO c1ccc2nc(NCc3cc[nH+]c(N4CCCCC4)c3)ccc2c1 ZINC000301089297 336289402 /nfs/dbraw/zinc/28/94/02/336289402.db2.gz KCDBMZCPBICSIM-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO CSc1ccc(CNc2cc(C)[nH+]c(-c3cccnc3)n2)cc1 ZINC000301093141 336289598 /nfs/dbraw/zinc/28/95/98/336289598.db2.gz MDQWLPCTTCXFOD-UHFFFAOYSA-N 1 2 322.437 4.181 20 0 DIADLO Cc1cc(NCc2coc(-c3cccs3)n2)nc(C(C)C)[nH+]1 ZINC000301096235 336289823 /nfs/dbraw/zinc/28/98/23/336289823.db2.gz PBBAVKHNZQOINV-UHFFFAOYSA-N 1 2 314.414 4.237 20 0 DIADLO Fc1cc(CNc2ccc3ccccc3n2)ccc1-n1cc[nH+]c1 ZINC000301108187 336290391 /nfs/dbraw/zinc/29/03/91/336290391.db2.gz RYURDVDPTANOHN-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO Cc1cc(NCCCc2cccc(F)c2)nc(-c2cccnc2)[nH+]1 ZINC000301199125 336294502 /nfs/dbraw/zinc/29/45/02/336294502.db2.gz LTWDERKGWZAIPU-UHFFFAOYSA-N 1 2 322.387 4.031 20 0 DIADLO Fc1ccc(SCCCNc2cc[nH+]c(C3CC3)n2)cc1 ZINC000301241780 336296317 /nfs/dbraw/zinc/29/63/17/336296317.db2.gz MREFGCIAVOGJOD-UHFFFAOYSA-N 1 2 303.406 4.087 20 0 DIADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1ccc(Br)cc1 ZINC000301257351 336297183 /nfs/dbraw/zinc/29/71/83/336297183.db2.gz RIEXIPMYECGLFJ-JTQLQIEISA-N 1 2 318.218 4.290 20 0 DIADLO Cc1cc(NCc2ccc(-c3nc4ccccc4s3)o2)nc[nH+]1 ZINC000301286832 336298895 /nfs/dbraw/zinc/29/88/95/336298895.db2.gz ZOTVEQPDKDMTOI-UHFFFAOYSA-N 1 2 322.393 4.267 20 0 DIADLO Cc1cc(NC[C@H](C)Cc2cccs2)nc(-c2cccnc2)[nH+]1 ZINC000301427593 336306075 /nfs/dbraw/zinc/30/60/75/336306075.db2.gz PLNSJDLXVCPDMR-CYBMUJFWSA-N 1 2 324.453 4.199 20 0 DIADLO c1nc(NCCc2cn3ccccc3[nH+]2)sc1-c1ccccc1 ZINC000301448127 336307371 /nfs/dbraw/zinc/30/73/71/336307371.db2.gz RGJCOWMQVBGBLV-UHFFFAOYSA-N 1 2 320.421 4.112 20 0 DIADLO c1c2c(oc1-c1ccccc1)CN(c1cc[nH+]c(C3CC3)n1)CC2 ZINC000301453269 336307800 /nfs/dbraw/zinc/30/78/00/336307800.db2.gz AZDVAVZBTSJSDU-UHFFFAOYSA-N 1 2 317.392 4.177 20 0 DIADLO COc1ccc([C@@H]2CCCN2c2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000301458285 336308119 /nfs/dbraw/zinc/30/81/19/336308119.db2.gz XUNDUECVZKXGDN-HNNXBMFYSA-N 1 2 322.330 4.451 20 0 DIADLO COc1cccc(F)c1[C@H](C)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000301460894 336308196 /nfs/dbraw/zinc/30/81/96/336308196.db2.gz NYXOKLOACAFYNB-LBPRGKRZSA-N 1 2 303.381 4.229 20 0 DIADLO COc1ccc([C@H](C)Nc2cc[nH+]c(C(C)(C)C)n2)cc1F ZINC000301500801 336310773 /nfs/dbraw/zinc/31/07/73/336310773.db2.gz DQKIQIYYCZVWTO-NSHDSACASA-N 1 2 303.381 4.095 20 0 DIADLO COc1ccc([C@H](C)Nc2cc(C(F)(F)F)cc[nH+]2)cc1F ZINC000301508585 336311335 /nfs/dbraw/zinc/31/13/35/336311335.db2.gz DLJXBBRMDDCPSL-VIFPVBQESA-N 1 2 314.282 4.421 20 0 DIADLO CC(C)c1nc(CCNc2cc(C(F)(F)F)cc[nH+]2)cs1 ZINC000301516720 336311884 /nfs/dbraw/zinc/31/18/84/336311884.db2.gz LWSWITDRTMPKIH-UHFFFAOYSA-N 1 2 315.364 4.335 20 0 DIADLO COc1cccc(F)c1[C@@H](C)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000301561402 336315006 /nfs/dbraw/zinc/31/50/06/336315006.db2.gz OSHWWEXIXVCIMI-SECBINFHSA-N 1 2 314.282 4.421 20 0 DIADLO Cc1nc(N(Cc2ccco2)Cc2ccco2)c2c([nH+]1)CCCC2 ZINC000301571415 336315651 /nfs/dbraw/zinc/31/56/51/336315651.db2.gz OCVYPSFGNUYDEM-UHFFFAOYSA-N 1 2 323.396 4.057 20 0 DIADLO Cc1ccc(-c2csc(CN3CCC[C@@H]3c3[nH]cc[nH+]3)n2)cc1 ZINC000367138822 336315700 /nfs/dbraw/zinc/31/57/00/336315700.db2.gz SHOKZTNLEWJCBN-MRXNPFEDSA-N 1 2 324.453 4.179 20 0 DIADLO COc1cccc([C@@H]2CCCN2c2cc(C(F)(F)F)cc[nH+]2)c1 ZINC000301607391 336317935 /nfs/dbraw/zinc/31/79/35/336317935.db2.gz ZFCFDYPUDNGDMU-HNNXBMFYSA-N 1 2 322.330 4.451 20 0 DIADLO C[C@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1ccccc1-n1cccn1 ZINC000301622603 336318946 /nfs/dbraw/zinc/31/89/46/336318946.db2.gz FVTAUJWKMYHUEY-AWEZNQCLSA-N 1 2 321.428 4.133 20 0 DIADLO COCc1ccccc1CNc1cc(C)[nH+]c2c(F)cccc12 ZINC000301657914 336321142 /nfs/dbraw/zinc/32/11/42/336321142.db2.gz IIRIKTSVNYDNQL-UHFFFAOYSA-N 1 2 310.372 4.441 20 0 DIADLO Cc1cc(NC[C@@](C)(O)c2ccsc2)c2cccc(F)c2[nH+]1 ZINC000301670267 336322334 /nfs/dbraw/zinc/32/23/34/336322334.db2.gz NLWFCIFDLSIQLC-QGZVFWFLSA-N 1 2 316.401 4.063 20 0 DIADLO Cc1cc(NC[C@@H](O)c2ccccc2C)c2cccc(F)c2[nH+]1 ZINC000301679636 336322973 /nfs/dbraw/zinc/32/29/73/336322973.db2.gz RLHLRKBVSHQGFN-GOSISDBHSA-N 1 2 310.372 4.136 20 0 DIADLO COCCOc1cccc(CNc2[nH+]c3ccccc3cc2C)c1 ZINC000301697986 336324126 /nfs/dbraw/zinc/32/41/26/336324126.db2.gz OAOSQATZVXAFBH-UHFFFAOYSA-N 1 2 322.408 4.181 20 0 DIADLO CCOc1ccccc1C1=CCN(c2nc(C)[nH+]c(C)c2C)CC1 ZINC000301715171 336325155 /nfs/dbraw/zinc/32/51/55/336325155.db2.gz ZTGLNRNWFGLJFL-UHFFFAOYSA-N 1 2 323.440 4.094 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NCCc2cc3ccccc3[nH]2)c1 ZINC000301733686 336326342 /nfs/dbraw/zinc/32/63/42/336326342.db2.gz GDWUACHHNNRPRD-UHFFFAOYSA-N 1 2 305.303 4.236 20 0 DIADLO O[C@H](c1ccccc1)C1(CNc2ccc3ccccc3[nH+]2)CC1 ZINC000301791287 336330233 /nfs/dbraw/zinc/33/02/33/336330233.db2.gz NQRUVKBRCMSLGR-LJQANCHMSA-N 1 2 304.393 4.161 20 0 DIADLO CC(C)(CO)[C@@H](CNc1ccc2ccccc2[nH+]1)c1ccccc1 ZINC000301798050 336330547 /nfs/dbraw/zinc/33/05/47/336330547.db2.gz UZOISTZWDMRDDH-SFHVURJKSA-N 1 2 320.436 4.449 20 0 DIADLO CC(C)c1cc(N2CC[C@@H](Nc3ccccc3)C2)nc(C(C)C)[nH+]1 ZINC000301797776 336330656 /nfs/dbraw/zinc/33/06/56/336330656.db2.gz AUMTXJRHFIZWBJ-QGZVFWFLSA-N 1 2 324.472 4.414 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CCS[C@@H](c3ccccc3)C2)c1 ZINC000301802739 336331087 /nfs/dbraw/zinc/33/10/87/336331087.db2.gz UBUWXXFCCCVMPW-CQSZACIVSA-N 1 2 324.371 4.395 20 0 DIADLO C[C@H](Nc1cc(C(F)(F)F)cc[nH+]1)[C@H]1COc2ccccc21 ZINC000301825811 336332589 /nfs/dbraw/zinc/33/25/89/336332589.db2.gz IVYYLYGILOLLBK-GXFFZTMASA-N 1 2 308.303 4.077 20 0 DIADLO Cc1ccc([C@H](C)Nc2[nH+]cnc3c2cnn3C(C)(C)C)cc1 ZINC000301851916 336334214 /nfs/dbraw/zinc/33/42/14/336334214.db2.gz ARGFRWWFYJCCLE-ZDUSSCGKSA-N 1 2 309.417 4.063 20 0 DIADLO Cc1nc(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)sc1C ZINC000301867791 336335192 /nfs/dbraw/zinc/33/51/92/336335192.db2.gz NSWJBSYIVZXVEZ-UHFFFAOYSA-N 1 2 304.463 4.409 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CCc3ccc(Cl)cc3C2)c1 ZINC000301868582 336335198 /nfs/dbraw/zinc/33/51/98/336335198.db2.gz OFVZDIMUTDJHGV-UHFFFAOYSA-N 1 2 312.722 4.317 20 0 DIADLO Cc1ccc([C@H](C)Nc2[nH+]cnc3c2cnn3C(C)(C)C)s1 ZINC000301878835 336335860 /nfs/dbraw/zinc/33/58/60/336335860.db2.gz JKYRUVOKUGORAE-NSHDSACASA-N 1 2 315.446 4.124 20 0 DIADLO O[C@H](CNc1ccc2ccccc2[nH+]1)c1ccc(Cl)c(F)c1 ZINC000301885493 336336324 /nfs/dbraw/zinc/33/63/24/336336324.db2.gz OTBQZNCNSTURBA-MRXNPFEDSA-N 1 2 316.763 4.173 20 0 DIADLO Fc1cccc([C@H]2C[N@H+](Cc3coc4ccccc34)CCO2)c1 ZINC000514101174 336337587 /nfs/dbraw/zinc/33/75/87/336337587.db2.gz ZEYSFWDRNBPMBO-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO Fc1cccc([C@H]2C[N@@H+](Cc3coc4ccccc34)CCO2)c1 ZINC000514101174 336337588 /nfs/dbraw/zinc/33/75/88/336337588.db2.gz ZEYSFWDRNBPMBO-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO Cc1cc([NH+]2CCCC2)ccc1Nc1ccc(C(F)(F)F)nn1 ZINC000301916442 336337957 /nfs/dbraw/zinc/33/79/57/336337957.db2.gz JDOWDZCNRYRAPM-UHFFFAOYSA-N 1 2 322.334 4.148 20 0 DIADLO CC(C)c1nc(N[C@@H]2CCCOc3c(F)cccc32)cc[nH+]1 ZINC000302014363 336343192 /nfs/dbraw/zinc/34/31/92/336343192.db2.gz BLFQWJYQKZLIEZ-CQSZACIVSA-N 1 2 301.365 4.065 20 0 DIADLO Cc1nc2c(s1)[C@H](Nc1cc(C(F)(F)F)cc[nH+]1)CCC2 ZINC000302043875 336345089 /nfs/dbraw/zinc/34/50/89/336345089.db2.gz SPDYAWWGBYYSIZ-LLVKDONJSA-N 1 2 313.348 4.355 20 0 DIADLO CC(=O)c1ccc(CNc2[nH+]c3ccccc3cc2C)nc1C ZINC000302075115 336347231 /nfs/dbraw/zinc/34/72/31/336347231.db2.gz XNTGDLQNHSHKOG-UHFFFAOYSA-N 1 2 305.381 4.061 20 0 DIADLO Cc1cnc([C@H](C)CNc2cc(C(F)(F)F)cc[nH+]2)s1 ZINC000302159071 336351410 /nfs/dbraw/zinc/35/14/10/336351410.db2.gz XLPCKXWXOSLAEN-MRVPVSSYSA-N 1 2 301.337 4.081 20 0 DIADLO Cc1cc(N(C)C[C@H](C)c2nccs2)c2cccc(F)c2[nH+]1 ZINC000302161219 336351690 /nfs/dbraw/zinc/35/16/90/336351690.db2.gz NYRZYAVHHZFPQQ-NSHDSACASA-N 1 2 315.417 4.379 20 0 DIADLO Cc1cc(NCc2ccc(OCc3ccccc3F)cc2)nc[nH+]1 ZINC000302186598 336352998 /nfs/dbraw/zinc/35/29/98/336352998.db2.gz IIYFXZZYWGYOLJ-UHFFFAOYSA-N 1 2 323.371 4.115 20 0 DIADLO CC(C)c1nc(N2CC=C(c3c(F)cccc3F)CC2)cc[nH+]1 ZINC000302251078 336356190 /nfs/dbraw/zinc/35/61/90/336356190.db2.gz NBOANJHTHMXWRM-UHFFFAOYSA-N 1 2 315.367 4.172 20 0 DIADLO FC(F)(F)[C@@H](CNc1cc[nH+]c(C2CC2)n1)c1ccccc1 ZINC000302351201 336357514 /nfs/dbraw/zinc/35/75/14/336357514.db2.gz BADFTSKLPMAORO-ZDUSSCGKSA-N 1 2 307.319 4.112 20 0 DIADLO Fc1cccc([C@H]2C[N@H+](Cc3cc4ccccc4o3)CCO2)c1 ZINC000514105728 336357747 /nfs/dbraw/zinc/35/77/47/336357747.db2.gz SWANOCOJKHMHKM-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO Fc1cccc([C@H]2C[N@@H+](Cc3cc4ccccc4o3)CCO2)c1 ZINC000514105728 336357748 /nfs/dbraw/zinc/35/77/48/336357748.db2.gz SWANOCOJKHMHKM-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO COc1cccc2c(N[C@@H](C)c3nc4ccccc4[nH]3)cc[nH+]c12 ZINC000302462622 336359237 /nfs/dbraw/zinc/35/92/37/336359237.db2.gz RSXLOLLVGAJQPV-LBPRGKRZSA-N 1 2 318.380 4.293 20 0 DIADLO COc1cccc2c(N[C@@H]3CCOC4(CCCC4)C3)cc[nH+]c12 ZINC000302566472 336361826 /nfs/dbraw/zinc/36/18/26/336361826.db2.gz WNCRNPFNKUEZPA-CQSZACIVSA-N 1 2 312.413 4.147 20 0 DIADLO Fc1cccc2c(NCc3ccc(-n4cc[nH+]c4)cc3)ccnc12 ZINC000302632522 336363078 /nfs/dbraw/zinc/36/30/78/336363078.db2.gz CHMJQRJYTQWCQB-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]C1(c2nccs2)CCCC1 ZINC000514115021 336368426 /nfs/dbraw/zinc/36/84/26/336368426.db2.gz NGHVZLCPWQLPKV-UHFFFAOYSA-N 1 2 322.861 4.364 20 0 DIADLO CNc1nc(CNc2cc(C(C)(C)C)[nH+]c(C(C)C)n2)cs1 ZINC000302785723 336369035 /nfs/dbraw/zinc/36/90/35/336369035.db2.gz VSJQBACSHDTLIZ-UHFFFAOYSA-N 1 2 319.478 4.008 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCc1ccc(OC(F)F)cn1 ZINC000302824049 336370758 /nfs/dbraw/zinc/37/07/58/336370758.db2.gz LKKXOKATRICNGH-UHFFFAOYSA-N 1 2 315.323 4.152 20 0 DIADLO CC(C)c1nc(N[C@H]2CCOC(C)(C)C2)cc(C(C)(C)C)[nH+]1 ZINC000302862283 336372336 /nfs/dbraw/zinc/37/23/36/336372336.db2.gz WBILWFWKSLPBMF-ZDUSSCGKSA-N 1 2 305.466 4.267 20 0 DIADLO O=C(Nc1ccc(F)cc1)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000352914680 336376762 /nfs/dbraw/zinc/37/67/62/336376762.db2.gz YGFAYFRCZSQDHI-UHFFFAOYSA-N 1 2 308.312 4.265 20 0 DIADLO Cn1ccnc1[C@H]([NH2+]Cc1ccc(Oc2ccccc2)o1)C1CC1 ZINC000353036228 336385823 /nfs/dbraw/zinc/38/58/23/336385823.db2.gz QTNUTRGEKROKKD-GOSISDBHSA-N 1 2 323.396 4.046 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+]Cc2ccc(C)cc2Cl)[nH]1 ZINC000514609239 336386202 /nfs/dbraw/zinc/38/62/02/336386202.db2.gz OKOZXQXXKHYIBY-RYUDHWBXSA-N 1 2 306.841 4.131 20 0 DIADLO FC(F)C1([NH2+]Cc2cnc([C@@H]3CCCO3)s2)CCCCC1 ZINC000353038383 336386783 /nfs/dbraw/zinc/38/67/83/336386783.db2.gz MQTOQKYRHILCMA-LBPRGKRZSA-N 1 2 316.417 4.052 20 0 DIADLO C[C@@H]([NH2+]Cc1nnsc1Cl)c1ccc(F)c2ccccc21 ZINC000514631514 336386918 /nfs/dbraw/zinc/38/69/18/336386918.db2.gz WKDNPKDUXSETSQ-SECBINFHSA-N 1 2 321.808 4.335 20 0 DIADLO Cc1cc(C[NH2+]C2(c3c(Cl)cccc3Cl)CCC2)n(C)n1 ZINC000418025921 336390441 /nfs/dbraw/zinc/39/04/41/336390441.db2.gz FASQBQFYEAROIJ-UHFFFAOYSA-N 1 2 324.255 4.204 20 0 DIADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1nc(C(C)(C)C)cs1 ZINC000110586606 336396889 /nfs/dbraw/zinc/39/68/89/336396889.db2.gz VAFRSTGWOYAMPI-JTQLQIEISA-N 1 2 302.447 4.281 20 0 DIADLO CSc1cccc(NC(=O)Nc2ccn3cc[nH+]c3c2)c1C ZINC000353332490 336412211 /nfs/dbraw/zinc/41/22/11/336412211.db2.gz SHXOXWRWAVWZEH-UHFFFAOYSA-N 1 2 312.398 4.009 20 0 DIADLO CCOc1cc(C[NH+]2Cc3ccccc3C2)ccc1OC(F)F ZINC000353395120 336415111 /nfs/dbraw/zinc/41/51/11/336415111.db2.gz OPGIPVCUPTYNQM-UHFFFAOYSA-N 1 2 319.351 4.203 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H](C)c2cc(C)on2)ccc1OC(C)C ZINC000353410314 336416004 /nfs/dbraw/zinc/41/60/04/336416004.db2.gz HBVOLMYNOMSSQM-UONOGXRCSA-N 1 2 318.417 4.191 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cnc2ccsc2c1 ZINC000353931747 336449414 /nfs/dbraw/zinc/44/94/14/336449414.db2.gz JRKCMCHJJRSLKE-ZJUUUORDSA-N 1 2 319.380 4.381 20 0 DIADLO Cc1cnn(-c2ccc(NCCCc3ccc(C)[nH+]c3)cc2F)c1 ZINC000353945368 336450451 /nfs/dbraw/zinc/45/04/51/336450451.db2.gz QFHXZSULKLHRNG-UHFFFAOYSA-N 1 2 324.403 4.068 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc(F)cn1 ZINC000354028226 336455193 /nfs/dbraw/zinc/45/51/93/336455193.db2.gz GMZOPWPEGPAFLB-SFHVURJKSA-N 1 2 316.424 4.019 20 0 DIADLO CCCOc1cccc2c(NCc3ccc(F)cn3)cc[nH+]c12 ZINC000354154683 336461823 /nfs/dbraw/zinc/46/18/23/336461823.db2.gz DITKESYISJKMKW-UHFFFAOYSA-N 1 2 311.360 4.170 20 0 DIADLO c1cn2c(cccc2CNc2cccc(Oc3ccccn3)c2)[nH+]1 ZINC000354745501 336480958 /nfs/dbraw/zinc/48/09/58/336480958.db2.gz XTMUGSGSKSCBKI-UHFFFAOYSA-N 1 2 316.364 4.134 20 0 DIADLO CCOCCC1(CNc2[nH+]ccc3ccc(F)cc32)CCC1 ZINC000354880302 336486271 /nfs/dbraw/zinc/48/62/71/336486271.db2.gz DFCUHBVBNHBFKQ-UHFFFAOYSA-N 1 2 302.393 4.383 20 0 DIADLO C[C@H](Nc1[nH+]ccc2ccc(F)cc21)[C@@H]1COc2ccccc21 ZINC000354883149 336486391 /nfs/dbraw/zinc/48/63/91/336486391.db2.gz JCDICBOXODZDSF-SJCJKPOMSA-N 1 2 308.356 4.351 20 0 DIADLO CCSc1ccccc1[C@H](C)[NH2+][C@@H](C)c1nnc(C)s1 ZINC000354973032 336489648 /nfs/dbraw/zinc/48/96/48/336489648.db2.gz VXYHORJSLGEVMW-QWRGUYRKSA-N 1 2 307.488 4.370 20 0 DIADLO Cc1ccc(Cc2noc([C@@H](C)c3cc4ccccc4o3)n2)c[nH+]1 ZINC000356104736 336535777 /nfs/dbraw/zinc/53/57/77/336535777.db2.gz BEFGJCXSRWBLOF-ZDUSSCGKSA-N 1 2 319.364 4.262 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H](C)c2ncc(C)o2)ccc1OC(C)C ZINC000356270524 336543551 /nfs/dbraw/zinc/54/35/51/336543551.db2.gz GAWICGLTNSJWLM-KBPBESRZSA-N 1 2 318.417 4.191 20 0 DIADLO CC(C)Sc1cccc(Cl)c1CN1CCn2c[nH+]cc2C1 ZINC000356288003 336544399 /nfs/dbraw/zinc/54/43/99/336544399.db2.gz VLSVVBPPKOYKKI-UHFFFAOYSA-N 1 2 321.877 4.053 20 0 DIADLO C[C@@H](CC1CCCCC1)C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000114322298 336551779 /nfs/dbraw/zinc/55/17/79/336551779.db2.gz MDMYKAXNJCEPLP-HOCLYGCPSA-N 1 2 303.450 4.070 20 0 DIADLO O=C(C1CCC(c2ccccc2)CC1)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000357134188 336574738 /nfs/dbraw/zinc/57/47/38/336574738.db2.gz XPMSJRMDHNKOOF-ABHNRTSZSA-N 1 2 323.440 4.047 20 0 DIADLO COCc1cc(N(C)Cc2ccoc2C)c2cc(F)ccc2[nH+]1 ZINC000357169490 336575766 /nfs/dbraw/zinc/57/57/66/336575766.db2.gz IEJPYKUNLRAQDF-UHFFFAOYSA-N 1 2 314.360 4.058 20 0 DIADLO COCc1cc(N2CCC[C@H](C)CC2)c2cc(F)ccc2[nH+]1 ZINC000357232735 336577604 /nfs/dbraw/zinc/57/76/04/336577604.db2.gz XXACNAPOAWEOPI-ZDUSSCGKSA-N 1 2 302.393 4.147 20 0 DIADLO COCc1cc(N2CC[C@H](C)C(F)(F)C2)c2cc(F)ccc2[nH+]1 ZINC000357659739 336593616 /nfs/dbraw/zinc/59/36/16/336593616.db2.gz JTOSHNUYZYLJIY-NSHDSACASA-N 1 2 324.346 4.002 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)cs1 ZINC000358014038 336606036 /nfs/dbraw/zinc/60/60/36/336606036.db2.gz BJWLQFLJRUHATO-GOPGUHFVSA-N 1 2 320.433 4.162 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C(C)C)s1)c1ccc(F)cc1F ZINC000358291765 336622013 /nfs/dbraw/zinc/62/20/13/336622013.db2.gz UJVNSJQGOHNKGL-ZDUSSCGKSA-N 1 2 311.401 4.181 20 0 DIADLO CC(C)c1cnc(SCc2ccc(-n3cc[nH+]c3)cc2)n1C ZINC000358518544 336633348 /nfs/dbraw/zinc/63/33/48/336633348.db2.gz WGZJOWAEZDUYDN-UHFFFAOYSA-N 1 2 312.442 4.022 20 0 DIADLO Cc1ccc(CSc2nccn2Cc2ccccc2)c(C)[nH+]1 ZINC000358609529 336636684 /nfs/dbraw/zinc/63/66/84/336636684.db2.gz OYCVBDSZQLQMBK-UHFFFAOYSA-N 1 2 309.438 4.236 20 0 DIADLO Cc1ccc(N[C@@H]2CCCc3nn(-c4ccccc4)cc32)c[nH+]1 ZINC000358984275 336651179 /nfs/dbraw/zinc/65/11/79/336651179.db2.gz IUZPFTFUQJSLOI-GOSISDBHSA-N 1 2 304.397 4.065 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+][C@H](C)c2nc(CC)no2)cc1 ZINC000114751789 336671265 /nfs/dbraw/zinc/67/12/65/336671265.db2.gz FFHKGVHMILTNNA-NWDGAFQWSA-N 1 2 305.447 4.156 20 0 DIADLO Cc1ccc(C(=O)N(C)[C@@H](C)C(C)C)cc1Oc1cc[nH+]cc1 ZINC000359410292 336671709 /nfs/dbraw/zinc/67/17/09/336671709.db2.gz IBTOGAWRCOQRGS-HNNXBMFYSA-N 1 2 312.413 4.299 20 0 DIADLO FC(F)(F)c1csc(C[NH2+]Cc2ccsc2Cl)n1 ZINC000359727227 336685359 /nfs/dbraw/zinc/68/53/59/336685359.db2.gz GFTWAZDWXXONTB-UHFFFAOYSA-N 1 2 312.769 4.167 20 0 DIADLO Fc1cc2cccnc2c(CNc2c[nH+]c3c(c2)CCCC3)c1 ZINC000359815303 336688591 /nfs/dbraw/zinc/68/85/91/336688591.db2.gz DTFSWVWNMAYBDL-UHFFFAOYSA-N 1 2 307.372 4.260 20 0 DIADLO Cc1ccc(NC(=O)N[C@@]2(C)CCCc3ccccc32)c(C)[nH+]1 ZINC000360015301 336697751 /nfs/dbraw/zinc/69/77/51/336697751.db2.gz IRSCQRWSZYHDKK-IBGZPJMESA-N 1 2 309.413 4.072 20 0 DIADLO Cc1[nH]c(C(=O)N[C@H](C)c2ccc(Cl)c3ccccc32)c[nH+]1 ZINC000361033192 336734385 /nfs/dbraw/zinc/73/43/85/336734385.db2.gz SIRNQPYKPDBRLC-SNVBAGLBSA-N 1 2 313.788 4.016 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H]2CCOc3c(F)ccc(F)c32)c(C)o1 ZINC000361177128 336742331 /nfs/dbraw/zinc/74/23/31/336742331.db2.gz GUDHIZTYJATLHL-ZUZCIYMTSA-N 1 2 307.340 4.349 20 0 DIADLO CCC[C@H]([NH2+][C@H]1CCOc2c(F)ccc(F)c21)c1ccccn1 ZINC000361185747 336743183 /nfs/dbraw/zinc/74/31/83/336743183.db2.gz HUTAEVDCBZYSFV-HOTGVXAUSA-N 1 2 318.367 4.314 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@@H]2CCOc3c(F)ccc(F)c32)o1 ZINC000361190120 336743665 /nfs/dbraw/zinc/74/36/65/336743665.db2.gz YBEAMQYGFBLERZ-QMTHXVAHSA-N 1 2 307.340 4.295 20 0 DIADLO Fc1ccc(C[NH2+]Cc2ncoc2-c2ccccc2)c(Cl)c1 ZINC000361286030 336748667 /nfs/dbraw/zinc/74/86/67/336748667.db2.gz DAKMPCNFMLNOLM-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO O=C(C/C=C\c1cccc(F)c1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000362900543 336814204 /nfs/dbraw/zinc/81/42/04/336814204.db2.gz KRXBRKGGKXKRGN-RQOWECAXSA-N 1 2 321.355 4.053 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ccccc3F)c2)[nH+]c1C ZINC000363185821 336819983 /nfs/dbraw/zinc/81/99/83/336819983.db2.gz GQJSADLWDPSGDH-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@H](C)c2nccn2-c2ccccc2)n1 ZINC000367855493 336831054 /nfs/dbraw/zinc/83/10/54/336831054.db2.gz HVZGBSOHTZUUOP-ZIAGYGMSSA-N 1 2 312.442 4.049 20 0 DIADLO Cc1cc(NC(=O)N(C)[C@H](C)c2ccc(Cl)cc2)cc[nH+]1 ZINC000119430996 336889788 /nfs/dbraw/zinc/88/97/88/336889788.db2.gz XJWYYEYDILOBHX-GFCCVEGCSA-N 1 2 303.793 4.268 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)N1C[C@H]2CCCC[C@H]21 ZINC000370730708 336892242 /nfs/dbraw/zinc/89/22/42/336892242.db2.gz QACBOWDKYTVOTE-RDTXWAMCSA-N 1 2 323.396 4.280 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2ccccc2Cl)[nH+]1 ZINC000371247952 336898511 /nfs/dbraw/zinc/89/85/11/336898511.db2.gz SEFRAIGPLXNCAU-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cc3c(s2)CCC3)[nH+]1 ZINC000371246948 336898536 /nfs/dbraw/zinc/89/85/36/336898536.db2.gz IWJABBBIDBRBHR-UHFFFAOYSA-N 1 2 323.421 4.188 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)C=CC2CCCCC2)[nH+]1 ZINC000371254212 336898655 /nfs/dbraw/zinc/89/86/55/336898655.db2.gz SYLPBANDIXEQNB-VAWYXSNFSA-N 1 2 309.413 4.460 20 0 DIADLO Cn1ccc(C[NH2+][C@@H](c2cccs2)c2ccc(Cl)cc2)n1 ZINC000371544644 336907621 /nfs/dbraw/zinc/90/76/21/336907621.db2.gz YAVOSVKWXFTOKG-MRXNPFEDSA-N 1 2 317.845 4.014 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000371646705 336909913 /nfs/dbraw/zinc/90/99/13/336909913.db2.gz GWOWNGNXABDKKD-JKSUJKDBSA-N 1 2 305.466 4.112 20 0 DIADLO CC(C)(C)c1nc(C[NH+]2CCC(OC3CCCC3)CC2)cs1 ZINC000121132129 336931817 /nfs/dbraw/zinc/93/18/17/336931817.db2.gz NDOQVPJKNSXUTF-UHFFFAOYSA-N 1 2 322.518 4.364 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc(F)cc2C)[nH+]1 ZINC000372766114 336939013 /nfs/dbraw/zinc/93/90/13/336939013.db2.gz LGFSKRPVNRSKCU-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1CCC[C@H](c2ccccc2)CC1 ZINC000121815918 336980814 /nfs/dbraw/zinc/98/08/14/336980814.db2.gz ULOPSUGNCSAXQJ-KRWDZBQOSA-N 1 2 309.413 4.192 20 0 DIADLO CC[C@@H](NC(=O)Nc1cc[nH+]cc1C)c1cccc(Cl)c1 ZINC000121939890 336987150 /nfs/dbraw/zinc/98/71/50/336987150.db2.gz IFPTVRCLCATLRZ-CQSZACIVSA-N 1 2 303.793 4.316 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](c2cnn(C)c2)c2ccccc2)oc1C ZINC000374346086 336987871 /nfs/dbraw/zinc/98/78/71/336987871.db2.gz PRZDEWWDVLXWTJ-IFXJQAMLSA-N 1 2 309.413 4.070 20 0 DIADLO CC[C@H](Nc1cc[nH+]c2c(OC)cccc12)c1c(C)noc1C ZINC000193489187 337014348 /nfs/dbraw/zinc/01/43/48/337014348.db2.gz LZYGMFRIAAKHIP-AWEZNQCLSA-N 1 2 311.385 4.411 20 0 DIADLO COCCC[C@@H](C)Nc1cccc(-c2cn3c([nH+]2)CCCC3)c1 ZINC000376167506 337028689 /nfs/dbraw/zinc/02/86/89/337028689.db2.gz RLURTQXKANRZSA-OAHLLOKOSA-N 1 2 313.445 4.113 20 0 DIADLO Cc1ccc(-c2nc(CN3CCC[C@@H]3c3[nH]cc[nH+]3)cs2)cc1 ZINC000376493654 337034875 /nfs/dbraw/zinc/03/48/75/337034875.db2.gz AWYNPKPTCYXEGG-MRXNPFEDSA-N 1 2 324.453 4.179 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000376551024 337036535 /nfs/dbraw/zinc/03/65/35/337036535.db2.gz AJAORZSSDQEOLY-SMDDNHRTSA-N 1 2 322.239 4.367 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000376551024 337036536 /nfs/dbraw/zinc/03/65/36/337036536.db2.gz AJAORZSSDQEOLY-SMDDNHRTSA-N 1 2 322.239 4.367 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC2(CCCCC2)CC1 ZINC000376591963 337037476 /nfs/dbraw/zinc/03/74/76/337037476.db2.gz GVVPWCZLIANJMZ-UHFFFAOYSA-N 1 2 301.434 4.277 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)cc1F)c1nccn1-c1ccccc1 ZINC000376606964 337037899 /nfs/dbraw/zinc/03/78/99/337037899.db2.gz SNKCAHNHJNEEIX-CYBMUJFWSA-N 1 2 313.351 4.001 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@@H](c2ccccc2)C[C@@H]1C ZINC000376638851 337038684 /nfs/dbraw/zinc/03/86/84/337038684.db2.gz CUVNBQYPVJVJFZ-MAUKXSAKSA-N 1 2 323.440 4.498 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1cncs1 ZINC000123172164 337038722 /nfs/dbraw/zinc/03/87/22/337038722.db2.gz KDZMFMZYTKDIBM-RISCZKNCSA-N 1 2 301.440 4.040 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000376644997 337038861 /nfs/dbraw/zinc/03/88/61/337038861.db2.gz UQGHTTPWNSWGOM-QAPCUYQASA-N 1 2 323.440 4.356 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@@H](C)c1ccc(F)cc1F ZINC000425595476 337040956 /nfs/dbraw/zinc/04/09/56/337040956.db2.gz HXLMRPHYZFZHTH-LLVKDONJSA-N 1 2 304.340 4.109 20 0 DIADLO CCCCSCCC(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000376789846 337041194 /nfs/dbraw/zinc/04/11/94/337041194.db2.gz NLDYJNUUHMSKIH-UHFFFAOYSA-N 1 2 317.458 4.247 20 0 DIADLO C[C@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1cncc(F)c1 ZINC000123283292 337041963 /nfs/dbraw/zinc/04/19/63/337041963.db2.gz KEGHRQYLGRJIGH-LRDDRELGSA-N 1 2 313.401 4.117 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)C[C@@H]1CCC[C@H](C)C1 ZINC000377228252 337048953 /nfs/dbraw/zinc/04/89/53/337048953.db2.gz ZYZOWUNHRBRGIH-BBWFWOEESA-N 1 2 317.477 4.173 20 0 DIADLO C[C@H]1Oc2cc(F)ccc2[C@@H]1[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000377383996 337051465 /nfs/dbraw/zinc/05/14/65/337051465.db2.gz UBJSYKBAXKBTBX-KZULUSFZSA-N 1 2 324.355 4.093 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H]2c3ccc(F)cc3O[C@H]2C)s1 ZINC000377384684 337051491 /nfs/dbraw/zinc/05/14/91/337051491.db2.gz XRUVBLOBTPCHRV-MGPLVRAMSA-N 1 2 306.406 4.017 20 0 DIADLO Cc1cccc([C@@H](c2noc(Cc3ccc(C)[nH+]c3)n2)C(C)C)c1 ZINC000582453215 337054088 /nfs/dbraw/zinc/05/40/88/337054088.db2.gz ZFFKBQVOEZQTIM-IBGZPJMESA-N 1 2 321.424 4.460 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000377787078 337061102 /nfs/dbraw/zinc/06/11/02/337061102.db2.gz RZVHQRMGCNPISI-YCPHGPKFSA-N 1 2 318.461 4.067 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000377787078 337061103 /nfs/dbraw/zinc/06/11/03/337061103.db2.gz RZVHQRMGCNPISI-YCPHGPKFSA-N 1 2 318.461 4.067 20 0 DIADLO Cc1cc([C@@H](C)Nc2cccc(-c3cn4c([nH+]3)CCCC4)c2)no1 ZINC000377816727 337061801 /nfs/dbraw/zinc/06/18/01/337061801.db2.gz KXKHHGXHTGGEDR-CQSZACIVSA-N 1 2 322.412 4.356 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)no1 ZINC000377873529 337063114 /nfs/dbraw/zinc/06/31/14/337063114.db2.gz JQUKLXFINWENCB-MRXNPFEDSA-N 1 2 300.402 4.015 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)no1 ZINC000377873529 337063115 /nfs/dbraw/zinc/06/31/15/337063115.db2.gz JQUKLXFINWENCB-MRXNPFEDSA-N 1 2 300.402 4.015 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000378082629 337066175 /nfs/dbraw/zinc/06/61/75/337066175.db2.gz IFZWEJCOYDBWSS-OAHLLOKOSA-N 1 2 305.466 4.112 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000378082629 337066176 /nfs/dbraw/zinc/06/61/76/337066176.db2.gz IFZWEJCOYDBWSS-OAHLLOKOSA-N 1 2 305.466 4.112 20 0 DIADLO CCCCCC[C@](C)(CCC)C(=O)N1CCn2c[nH+]cc2C1 ZINC000378091784 337066296 /nfs/dbraw/zinc/06/62/96/337066296.db2.gz IQWQBVHGDRMLGZ-SFHVURJKSA-N 1 2 305.466 4.002 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ncoc2-c2ccccc2)o1 ZINC000378153532 337067259 /nfs/dbraw/zinc/06/72/59/337067259.db2.gz JMYPSWFIDUYMDN-CJNGLKHVSA-N 1 2 308.381 4.348 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2CCCc3sccc32)c(C)[nH+]1 ZINC000378194376 337068121 /nfs/dbraw/zinc/06/81/21/337068121.db2.gz JBSUFHSQXFZSNB-AWEZNQCLSA-N 1 2 300.427 4.127 20 0 DIADLO CC(C)(C)c1csc(C2CC[NH+](Cc3nccs3)CC2)n1 ZINC000378250961 337068722 /nfs/dbraw/zinc/06/87/22/337068722.db2.gz JOYNILNHFAHQIH-UHFFFAOYSA-N 1 2 321.515 4.277 20 0 DIADLO Fc1ccc(CNc2cccc3c2CN(c2cccc[nH+]2)C3)cc1 ZINC000378267237 337068985 /nfs/dbraw/zinc/06/89/85/337068985.db2.gz CWDVIMLVBKHNGS-UHFFFAOYSA-N 1 2 319.383 4.353 20 0 DIADLO Cc1c(C(=O)N2CCC[C@H]2c2[nH]cc[nH+]2)oc2c1c(C)ccc2C ZINC000378412057 337072164 /nfs/dbraw/zinc/07/21/64/337072164.db2.gz YGRLCPALYUUAGR-AWEZNQCLSA-N 1 2 323.396 4.058 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+]([C@@H](C)c2nc3ccccc3o2)CCO1 ZINC000378483562 337074089 /nfs/dbraw/zinc/07/40/89/337074089.db2.gz ITALRBGTRWUBOZ-KXBFYZLASA-N 1 2 322.408 4.271 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+]([C@@H](C)c2nc3ccccc3o2)CCO1 ZINC000378483562 337074090 /nfs/dbraw/zinc/07/40/90/337074090.db2.gz ITALRBGTRWUBOZ-KXBFYZLASA-N 1 2 322.408 4.271 20 0 DIADLO Brc1ccc([C@H]2CCC[N@@H+]2Cc2ccncc2)s1 ZINC000378649521 337077715 /nfs/dbraw/zinc/07/77/15/337077715.db2.gz MPUYNTYFYNIIGN-GFCCVEGCSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc([C@H]2CCC[N@H+]2Cc2ccncc2)s1 ZINC000378649521 337077716 /nfs/dbraw/zinc/07/77/16/337077716.db2.gz MPUYNTYFYNIIGN-GFCCVEGCSA-N 1 2 323.259 4.243 20 0 DIADLO COc1cc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)ccc1Cl ZINC000193843739 337079561 /nfs/dbraw/zinc/07/95/61/337079561.db2.gz KUWFGFRCGGWPHN-MRXNPFEDSA-N 1 2 313.788 4.273 20 0 DIADLO C=Cn1cc(C[N@@H+](Cc2ccco2)Cc2ccc(C)s2)cn1 ZINC000193805596 337080265 /nfs/dbraw/zinc/08/02/65/337080265.db2.gz ZHBVWAFLEOTWKS-UHFFFAOYSA-N 1 2 313.426 4.149 20 0 DIADLO C=Cn1cc(C[N@H+](Cc2ccco2)Cc2ccc(C)s2)cn1 ZINC000193805596 337080266 /nfs/dbraw/zinc/08/02/66/337080266.db2.gz ZHBVWAFLEOTWKS-UHFFFAOYSA-N 1 2 313.426 4.149 20 0 DIADLO Fc1cc(C[NH2+]Cc2ncoc2-c2ccccc2)cc(F)c1F ZINC000360038708 337084142 /nfs/dbraw/zinc/08/41/42/337084142.db2.gz WHBXFKYKYJFICC-UHFFFAOYSA-N 1 2 318.298 4.049 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccc(C(F)(F)F)cc1C ZINC000425596401 337089198 /nfs/dbraw/zinc/08/91/98/337089198.db2.gz NCQYZNRQPXTLKE-UHFFFAOYSA-N 1 2 308.303 4.278 20 0 DIADLO CC(C)c1nc(N[C@@H](c2ccccc2)c2cccnc2)cc[nH+]1 ZINC000171925903 337090422 /nfs/dbraw/zinc/09/04/22/337090422.db2.gz MFZNVPUYKQOCHV-SFHVURJKSA-N 1 2 304.397 4.197 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H]2CCC(C)=C(C)C2)[nH+]1 ZINC000582609348 337113481 /nfs/dbraw/zinc/11/34/81/337113481.db2.gz JCFLKFINPOLXNE-OAHLLOKOSA-N 1 2 309.413 4.460 20 0 DIADLO CS[C@H](C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000172532699 337129970 /nfs/dbraw/zinc/12/99/70/337129970.db2.gz NAZGVZYTMZLISZ-INIZCTEOSA-N 1 2 323.421 4.120 20 0 DIADLO Cc1cc2cc(C(=O)N3CCCC[C@H]3c3[nH]cc[nH+]3)oc2cc1C ZINC000172930855 337132418 /nfs/dbraw/zinc/13/24/18/337132418.db2.gz RQCYYLBBBUHGJF-HNNXBMFYSA-N 1 2 323.396 4.140 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1ncc(-c2ccccc2)o1 ZINC000174059009 337139065 /nfs/dbraw/zinc/13/90/65/337139065.db2.gz CFIXYMCQNYFBBM-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)cc1F)c1ncc(-c2ccccc2)o1 ZINC000174014630 337140623 /nfs/dbraw/zinc/14/06/23/337140623.db2.gz XUAJNMDVCPEWIM-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](Cc2ccccc2)C(C)C)cs1 ZINC000175075816 337144255 /nfs/dbraw/zinc/14/42/55/337144255.db2.gz DFUPZJCOYOJSGT-AWEZNQCLSA-N 1 2 304.459 4.261 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](Cc2ccccc2)C(C)C)cs1 ZINC000175075816 337144256 /nfs/dbraw/zinc/14/42/56/337144256.db2.gz DFUPZJCOYOJSGT-AWEZNQCLSA-N 1 2 304.459 4.261 20 0 DIADLO Cc1ccc2oc(SCc3ccc(-n4cc[nH+]c4)nc3)nc2c1 ZINC000175940766 337148853 /nfs/dbraw/zinc/14/88/53/337148853.db2.gz QKUSGXOSYJPTJL-UHFFFAOYSA-N 1 2 322.393 4.009 20 0 DIADLO Cc1ccc(NC(=O)N(C)CCc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000176727115 337151886 /nfs/dbraw/zinc/15/18/86/337151886.db2.gz DNPGODDRRLKHKO-UHFFFAOYSA-N 1 2 317.820 4.058 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1)c1noc(-c2ccccc2)n1 ZINC000178486652 337163060 /nfs/dbraw/zinc/16/30/60/337163060.db2.gz KQCIOQYSHYBUJF-QWHCGFSZSA-N 1 2 311.360 4.288 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)no1 ZINC000179527312 337169986 /nfs/dbraw/zinc/16/99/86/337169986.db2.gz ANJQKWJWAIZRGB-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)no1 ZINC000179527312 337169987 /nfs/dbraw/zinc/16/99/87/337169987.db2.gz ANJQKWJWAIZRGB-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2ccc(F)cc21)c1nc(C(C)(C)C)no1 ZINC000179754902 337171675 /nfs/dbraw/zinc/17/16/75/337171675.db2.gz GFGZYDDBDDQDED-NHYWBVRUSA-N 1 2 317.408 4.234 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@H](CC)c2ccccc2F)o1 ZINC000180631525 337176737 /nfs/dbraw/zinc/17/67/37/337176737.db2.gz BLJZOBMNLIOOAI-IAGOWNOFSA-N 1 2 305.393 4.410 20 0 DIADLO CC[C@@H]([NH2+][C@@H]1CCCn2nc(C(C)C)nc21)c1ccccc1F ZINC000180745157 337177652 /nfs/dbraw/zinc/17/76/52/337177652.db2.gz ATBWXTULGOGYDC-HZPDHXFCSA-N 1 2 316.424 4.116 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)no1 ZINC000180911997 337178542 /nfs/dbraw/zinc/17/85/42/337178542.db2.gz NOMCBPWJFHMUOJ-CQSZACIVSA-N 1 2 322.412 4.106 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@@H](CC2CCC2)c2ccccc2)n1 ZINC000181351459 337181496 /nfs/dbraw/zinc/18/14/96/337181496.db2.gz YIRFQYJBDRWNQR-KRWDZBQOSA-N 1 2 313.445 4.289 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nc(-c3ccsc3)no2)cc1F ZINC000181346053 337181547 /nfs/dbraw/zinc/18/15/47/337181547.db2.gz NCBZLWQEKIEQDS-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1cc(Cl)c(C(=O)N2CCCC[C@@H]2c2[nH]cc[nH+]2)cc1C ZINC000181882481 337185120 /nfs/dbraw/zinc/18/51/20/337185120.db2.gz KXQSJBTZCWZHOB-OAHLLOKOSA-N 1 2 317.820 4.047 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nc(-c3ccc(F)cc3)no2)cc1 ZINC000182341736 337188028 /nfs/dbraw/zinc/18/80/28/337188028.db2.gz ZSEUQMVFTPRKDG-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@H](C)c1nc(C2CC2)no1 ZINC000183534984 337192185 /nfs/dbraw/zinc/19/21/85/337192185.db2.gz LDMTZRKXIBVQDB-VXGBXAGGSA-N 1 2 311.385 4.413 20 0 DIADLO CCc1noc(CC)c1C[NH2+]Cc1c(F)cc(C)cc1Cl ZINC000459442359 337193117 /nfs/dbraw/zinc/19/31/17/337193117.db2.gz ZTDQEJPNZMRVMU-UHFFFAOYSA-N 1 2 310.800 4.190 20 0 DIADLO Cc1ccc(C[NH2+][C@H](c2nccs2)c2ccccc2)c(C)n1 ZINC000184442099 337197293 /nfs/dbraw/zinc/19/72/93/337197293.db2.gz SRMXQDZYCIEOJJ-KRWDZBQOSA-N 1 2 309.438 4.034 20 0 DIADLO Cc1cncc([C@@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)c1 ZINC000184329610 337197934 /nfs/dbraw/zinc/19/79/34/337197934.db2.gz ZDVAPPGSMDOSPX-PBHICJAKSA-N 1 2 309.438 4.287 20 0 DIADLO Cc1cnn(-c2ccc(C)cc2NCc2ccc(C)[nH+]c2C)c1 ZINC000184493681 337199014 /nfs/dbraw/zinc/19/90/14/337199014.db2.gz WSABTYYTAMKLCF-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO Cc1ccc(CSCc2nc3ccccc3nc2C)c(C)[nH+]1 ZINC000184804720 337200270 /nfs/dbraw/zinc/20/02/70/337200270.db2.gz GGEOFEXPQQUQBZ-UHFFFAOYSA-N 1 2 309.438 4.383 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(F)c1F)c1ncc(-c2ccccc2)o1 ZINC000184891767 337200728 /nfs/dbraw/zinc/20/07/28/337200728.db2.gz NQYRCVKCTSGTQQ-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO Cc1ccc(COc2cccc(NC(=O)c3ccco3)c2)c(C)[nH+]1 ZINC000185372295 337204532 /nfs/dbraw/zinc/20/45/32/337204532.db2.gz ADKSSSOAWBUVGF-UHFFFAOYSA-N 1 2 322.364 4.123 20 0 DIADLO CC(C)n1ccc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)n1 ZINC000582864369 337209048 /nfs/dbraw/zinc/20/90/48/337209048.db2.gz DKPIVQXHMVNREH-UHFFFAOYSA-N 1 2 311.385 4.139 20 0 DIADLO CC(C)n1ccc(C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)n1 ZINC000582922665 337218002 /nfs/dbraw/zinc/21/80/02/337218002.db2.gz IBRVPSAARLLQKH-UHFFFAOYSA-N 1 2 313.376 4.153 20 0 DIADLO CC(C)c1cccc(C(C)C)c1NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000582973273 337224945 /nfs/dbraw/zinc/22/49/45/337224945.db2.gz UCVJOGAXJWRCDU-CQSZACIVSA-N 1 2 313.445 4.474 20 0 DIADLO CC(C)c1cccc(C(C)C)c1NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000582973273 337224946 /nfs/dbraw/zinc/22/49/46/337224946.db2.gz UCVJOGAXJWRCDU-CQSZACIVSA-N 1 2 313.445 4.474 20 0 DIADLO Cc1coc(C)c1C(=O)Nc1ccc2c(c1)[nH+]c1n2CCCCC1 ZINC000583156838 337247743 /nfs/dbraw/zinc/24/77/43/337247743.db2.gz ILPGNXKTEYXNDI-UHFFFAOYSA-N 1 2 323.396 4.225 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000532902077 337252157 /nfs/dbraw/zinc/25/21/57/337252157.db2.gz ONHAJQZNSISJOF-VXGBXAGGSA-N 1 2 305.447 4.327 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@@H]1c1cccs1 ZINC000532902077 337252158 /nfs/dbraw/zinc/25/21/58/337252158.db2.gz ONHAJQZNSISJOF-VXGBXAGGSA-N 1 2 305.447 4.327 20 0 DIADLO C[C@H]1C[NH+](Cc2nc(-c3ccccc3Cl)cs2)C[C@H](C)O1 ZINC000186459161 337256336 /nfs/dbraw/zinc/25/63/36/337256336.db2.gz OMCLQMGJSRHYOZ-RYUDHWBXSA-N 1 2 322.861 4.073 20 0 DIADLO Cc1ccc(C(=O)N2CCCC[C@@H](C)C2)cc1Oc1cc[nH+]cc1 ZINC000186475466 337256464 /nfs/dbraw/zinc/25/64/64/337256464.db2.gz FTQZMDHGVOPMEI-OAHLLOKOSA-N 1 2 324.424 4.445 20 0 DIADLO Cc1c[nH+]cc(CCc2nc(C(C)(C)Cc3ccccc3)no2)c1 ZINC000583180215 337256897 /nfs/dbraw/zinc/25/68/97/337256897.db2.gz QJIADAFCZCUNAW-UHFFFAOYSA-N 1 2 321.424 4.079 20 0 DIADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1nc(-c2ccccc2Cl)cs1 ZINC000186502535 337257103 /nfs/dbraw/zinc/25/71/03/337257103.db2.gz SNESNXGFBFZQIL-NEPJUHHUSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1nc(-c2ccccc2Cl)cs1 ZINC000186502535 337257104 /nfs/dbraw/zinc/25/71/04/337257104.db2.gz SNESNXGFBFZQIL-NEPJUHHUSA-N 1 2 322.861 4.073 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[S@](=O)Cc1ccc(C)[nH+]c1C ZINC000187160317 337263424 /nfs/dbraw/zinc/26/34/24/337263424.db2.gz KBIIIHHLZHLOQF-LAUBAEHRSA-N 1 2 305.418 4.238 20 0 DIADLO Cc1ccc(C[S@@](=O)[C@H]2CCc3c2cccc3Cl)c(C)[nH+]1 ZINC000187174102 337263476 /nfs/dbraw/zinc/26/34/76/337263476.db2.gz VAJGCODRDQMAAV-LAUBAEHRSA-N 1 2 319.857 4.288 20 0 DIADLO Cc1ccc(C[S@](=O)[C@H]2CCc3c2cccc3Cl)c(C)[nH+]1 ZINC000187174119 337263506 /nfs/dbraw/zinc/26/35/06/337263506.db2.gz VAJGCODRDQMAAV-UWJYYQICSA-N 1 2 319.857 4.288 20 0 DIADLO Cc1ccc(C[S@](=O)[C@H](C)c2cccc(Cl)c2)c(C)[nH+]1 ZINC000187171616 337263512 /nfs/dbraw/zinc/26/35/12/337263512.db2.gz VPYCFMBTOLZZSN-XCLFUZPHSA-N 1 2 307.846 4.362 20 0 DIADLO CC[C@@H]1[C@H](C)CCN1C(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000187480031 337266182 /nfs/dbraw/zinc/26/61/82/337266182.db2.gz WFIVWEUJJZZQKI-RDTXWAMCSA-N 1 2 324.424 4.443 20 0 DIADLO Cc1cc(C)n(-c2ccc(NCc3ccc(C)[nH+]c3C)cc2F)n1 ZINC000187722105 337269523 /nfs/dbraw/zinc/26/95/23/337269523.db2.gz VPRYLSGLWBGZBZ-UHFFFAOYSA-N 1 2 324.403 4.252 20 0 DIADLO CCCC(=O)Nc1cccc(NCc2ccc(C)[nH+]c2C)c1C ZINC000187726444 337269597 /nfs/dbraw/zinc/26/95/97/337269597.db2.gz DNCNQGDPPNSCOV-UHFFFAOYSA-N 1 2 311.429 4.358 20 0 DIADLO Cc1c(Cl)cc(NC(=O)C[C@H](C)n2cc[nH+]c2)cc1Cl ZINC000583206611 337270908 /nfs/dbraw/zinc/27/09/08/337270908.db2.gz LACJSWPYTCXGDC-VIFPVBQESA-N 1 2 312.200 4.088 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2ccc(C3CC3)cc2)c2ncc[nH]2)cc1 ZINC000188733384 337274619 /nfs/dbraw/zinc/27/46/19/337274619.db2.gz CIELKLNDFCVIEC-LJQANCHMSA-N 1 2 321.399 4.305 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2csc(C)n2)cc1Cl ZINC000189751257 337282430 /nfs/dbraw/zinc/28/24/30/337282430.db2.gz UKLIZGDAZLJYIX-OAHLLOKOSA-N 1 2 322.861 4.451 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2csc(C)n2)cc1Cl ZINC000189751257 337282431 /nfs/dbraw/zinc/28/24/31/337282431.db2.gz UKLIZGDAZLJYIX-OAHLLOKOSA-N 1 2 322.861 4.451 20 0 DIADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2cnc(CC(C)C)s2)cs1 ZINC000189932891 337283982 /nfs/dbraw/zinc/28/39/82/337283982.db2.gz ROLUDKNCCHQOCA-HNNXBMFYSA-N 1 2 321.515 4.444 20 0 DIADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2cnc(CC(C)C)s2)cs1 ZINC000189932891 337283983 /nfs/dbraw/zinc/28/39/83/337283983.db2.gz ROLUDKNCCHQOCA-HNNXBMFYSA-N 1 2 321.515 4.444 20 0 DIADLO O=[S@@](CCCC1CCCC1)Cc1cn2cc(Cl)ccc2[nH+]1 ZINC000190816781 337290046 /nfs/dbraw/zinc/29/00/46/337290046.db2.gz IOJQNPHACXVXAN-NRFANRHFSA-N 1 2 324.877 4.207 20 0 DIADLO O=[S@](CCCC1CCCC1)Cc1cn2cc(Cl)ccc2[nH+]1 ZINC000190816797 337290137 /nfs/dbraw/zinc/29/01/37/337290137.db2.gz IOJQNPHACXVXAN-OAQYLSRUSA-N 1 2 324.877 4.207 20 0 DIADLO CC(C)N(C)c1ccc(CNc2cccc3cnccc32)c[nH+]1 ZINC000190812881 337291091 /nfs/dbraw/zinc/29/10/91/337291091.db2.gz JPVOIOYASCYCND-UHFFFAOYSA-N 1 2 306.413 4.087 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H]2CCOc3c(F)cccc32)s1 ZINC000191120410 337294270 /nfs/dbraw/zinc/29/42/70/337294270.db2.gz XZKYSNOKOKXECQ-ZDUSSCGKSA-N 1 2 306.406 4.019 20 0 DIADLO c1csc(C[N@H+](Cc2nccn2-c2ccccc2)C2CC2)c1 ZINC000191224840 337295058 /nfs/dbraw/zinc/29/50/58/337295058.db2.gz HNTHGACVMOJIAQ-UHFFFAOYSA-N 1 2 309.438 4.098 20 0 DIADLO c1csc(C[N@@H+](Cc2nccn2-c2ccccc2)C2CC2)c1 ZINC000191224840 337295059 /nfs/dbraw/zinc/29/50/59/337295059.db2.gz HNTHGACVMOJIAQ-UHFFFAOYSA-N 1 2 309.438 4.098 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1nccn1C(F)F ZINC000191676461 337298597 /nfs/dbraw/zinc/29/85/97/337298597.db2.gz NMLDYMUYWBXUBY-LLVKDONJSA-N 1 2 305.328 4.184 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1nccn1C(F)F ZINC000191724013 337299608 /nfs/dbraw/zinc/29/96/08/337299608.db2.gz NMLDYMUYWBXUBY-NSHDSACASA-N 1 2 305.328 4.184 20 0 DIADLO Cc1nc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)cs1 ZINC000191781044 337300139 /nfs/dbraw/zinc/30/01/39/337300139.db2.gz OGNNAVDDZFCPDZ-UHFFFAOYSA-N 1 2 314.376 4.406 20 0 DIADLO Cc1nc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)cs1 ZINC000191781044 337300140 /nfs/dbraw/zinc/30/01/40/337300140.db2.gz OGNNAVDDZFCPDZ-UHFFFAOYSA-N 1 2 314.376 4.406 20 0 DIADLO C[C@H]([NH2+]Cc1ncccn1)c1ccc(Oc2ccccc2)cc1 ZINC000192155448 337303530 /nfs/dbraw/zinc/30/35/30/337303530.db2.gz MNTUTOOOYYFODB-HNNXBMFYSA-N 1 2 305.381 4.120 20 0 DIADLO Cc1cc(NC(=O)Nc2ccc(Oc3cc[nH+]cc3)c(C)c2)no1 ZINC000192580533 337306451 /nfs/dbraw/zinc/30/64/51/337306451.db2.gz UZZXKHJFXIGMOO-UHFFFAOYSA-N 1 2 324.340 4.123 20 0 DIADLO c1csc([C@@H]2CCC[N@H+]2Cc2noc(-c3ccsc3)n2)c1 ZINC000193030044 337308956 /nfs/dbraw/zinc/30/89/56/337308956.db2.gz KRMFMSQFKVHRFN-LBPRGKRZSA-N 1 2 317.439 4.197 20 0 DIADLO c1csc([C@@H]2CCC[N@@H+]2Cc2noc(-c3ccsc3)n2)c1 ZINC000193030044 337308957 /nfs/dbraw/zinc/30/89/57/337308957.db2.gz KRMFMSQFKVHRFN-LBPRGKRZSA-N 1 2 317.439 4.197 20 0 DIADLO Cc1ccc(-c2noc(C3=CCCCCC3)n2)c(N2CCCC2)[nH+]1 ZINC000583718567 337318441 /nfs/dbraw/zinc/31/84/41/337318441.db2.gz SQULQICIXPVOKI-UHFFFAOYSA-N 1 2 324.428 4.388 20 0 DIADLO Cc1ccc(NC(=O)NC[C@@H](c2ccccc2)C2CC2)c(C)[nH+]1 ZINC000583789925 337333443 /nfs/dbraw/zinc/33/34/43/337333443.db2.gz CFFKPSPGHCUKRH-KRWDZBQOSA-N 1 2 309.413 4.014 20 0 DIADLO CCc1cc(N2CCC(C)(C3CC3)CC2)nc(-c2ccncc2)[nH+]1 ZINC000584522506 337355075 /nfs/dbraw/zinc/35/50/75/337355075.db2.gz MRWCZNDRFUUAKK-UHFFFAOYSA-N 1 2 322.456 4.118 20 0 DIADLO Cc1cccn2c(CN3CC[C@H]3c3ccc(Cl)cc3)c[nH+]c12 ZINC000583887987 337384156 /nfs/dbraw/zinc/38/41/56/337384156.db2.gz NCEIJEJKOUICKD-KRWDZBQOSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1cccn2c(C[N@@H+]3CC[C@H]3c3ccc(Cl)cc3)cnc12 ZINC000583887987 337384157 /nfs/dbraw/zinc/38/41/57/337384157.db2.gz NCEIJEJKOUICKD-KRWDZBQOSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1cccn2c(C[N@H+]3CC[C@H]3c3ccc(Cl)cc3)cnc12 ZINC000583887987 337384158 /nfs/dbraw/zinc/38/41/58/337384158.db2.gz NCEIJEJKOUICKD-KRWDZBQOSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1nc(C[N@@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)oc1C ZINC000108385343 337387901 /nfs/dbraw/zinc/38/79/01/337387901.db2.gz LNTZCBPDGNDOQK-GOSISDBHSA-N 1 2 309.413 4.500 20 0 DIADLO Cc1nc(C[N@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)oc1C ZINC000108385343 337387902 /nfs/dbraw/zinc/38/79/02/337387902.db2.gz LNTZCBPDGNDOQK-GOSISDBHSA-N 1 2 309.413 4.500 20 0 DIADLO CC[C@@H](C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000030609243 337390298 /nfs/dbraw/zinc/39/02/98/337390298.db2.gz KQFKJQKZJWNTJG-GOSISDBHSA-N 1 2 305.381 4.005 20 0 DIADLO CC(C)C(=O)Nc1ccc(N[C@H]2CCc3ccc[nH+]c3CC2)cc1 ZINC000520792326 337390917 /nfs/dbraw/zinc/39/09/17/337390917.db2.gz VEJFBMMLDWNUOR-INIZCTEOSA-N 1 2 323.440 4.036 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000114322379 337391461 /nfs/dbraw/zinc/39/14/61/337391461.db2.gz YOQCHIKLWVWGSY-QGZVFWFLSA-N 1 2 317.477 4.043 20 0 DIADLO C[C@H]1CCC[C@H](OCc2cccc(NCc3c[nH+]cn3C)c2)C1 ZINC000123860708 337401907 /nfs/dbraw/zinc/40/19/07/337401907.db2.gz KUFCZZHQTCDIRM-KXBFYZLASA-N 1 2 313.445 4.128 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@@H]1CCCc2sccc21 ZINC000125527796 337412468 /nfs/dbraw/zinc/41/24/68/337412468.db2.gz AFSNGXYRGJSXOP-OAHLLOKOSA-N 1 2 323.421 4.197 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)o1 ZINC000044567181 337417023 /nfs/dbraw/zinc/41/70/23/337417023.db2.gz ULAYVXQDYUBBAO-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO Cc1nc(-c2cc([C@@H](C)[NH2+]Cc3cscn3)cs2)cs1 ZINC000127340395 337420294 /nfs/dbraw/zinc/42/02/94/337420294.db2.gz YOQQPMIAJPQKOL-SECBINFHSA-N 1 2 321.496 4.487 20 0 DIADLO C[C@H]([NH2+][C@H](c1nccn1C)c1cccc(F)c1)c1cccs1 ZINC000128403263 337425243 /nfs/dbraw/zinc/42/52/43/337425243.db2.gz NIQGUYIWOSQKQG-LRDDRELGSA-N 1 2 315.417 4.061 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@@H](c2nccn2C)c2cccc(F)c2)cc1 ZINC000128539153 337425700 /nfs/dbraw/zinc/42/57/00/337425700.db2.gz ZSWSMYPERREBMC-HNAYVOBHSA-N 1 2 323.415 4.308 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@@H](C)c1ccncc1)c1ccco1 ZINC000130729476 337434111 /nfs/dbraw/zinc/43/41/11/337434111.db2.gz UFEGSDBKVAJUCM-IFXJQAMLSA-N 1 2 308.381 4.123 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C(=O)Nc2ccccc2)c2ccccc2)o1 ZINC000062422020 337460118 /nfs/dbraw/zinc/46/01/18/337460118.db2.gz NUJQCWHXBINQBL-IBGZPJMESA-N 1 2 320.392 4.058 20 0 DIADLO C[C@@H]([NH2+]Cc1cnn(-c2ccccc2)c1)c1c(F)cccc1F ZINC000322118886 337464980 /nfs/dbraw/zinc/46/49/80/337464980.db2.gz QUWUGHJBIMXJBV-CYBMUJFWSA-N 1 2 313.351 4.001 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2ccc(C(C)=O)cc2)c1 ZINC000419454340 337485079 /nfs/dbraw/zinc/48/50/79/337485079.db2.gz MCQNMUPWBGVXLD-UHFFFAOYSA-N 1 2 301.411 4.035 20 0 DIADLO C[C@@H](c1ccc(CSCCn2cc[nH+]c2)cc1)C(F)(F)F ZINC000419526234 337488137 /nfs/dbraw/zinc/48/81/37/337488137.db2.gz ZQVQNMGENNKMOB-LBPRGKRZSA-N 1 2 314.376 4.482 20 0 DIADLO Cc1ccc(C[C@H](C)c2nc(Cc3ccc[nH+]c3C)no2)cc1 ZINC000420509172 337505736 /nfs/dbraw/zinc/50/57/36/337505736.db2.gz CECSTNPAQJMVON-AWEZNQCLSA-N 1 2 307.397 4.018 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](CC(F)F)c1ccccc1 ZINC000421107491 337521738 /nfs/dbraw/zinc/52/17/38/337521738.db2.gz ITTZEWNEFDTAOK-CQSZACIVSA-N 1 2 319.355 4.216 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)nn1C ZINC000421329963 337526780 /nfs/dbraw/zinc/52/67/80/337526780.db2.gz WNYPDHSBWJQLIW-MRXNPFEDSA-N 1 2 323.843 4.398 20 0 DIADLO Cc1c(Cl)c(C[NH2+]C(C)(C)c2cccc(Cl)c2)nn1C ZINC000421369535 337532866 /nfs/dbraw/zinc/53/28/66/337532866.db2.gz VZLPBERQPJSSDX-UHFFFAOYSA-N 1 2 312.244 4.060 20 0 DIADLO Cc1ccc(C(=O)Nc2cccnc2C)cc1Oc1cc[nH+]cc1 ZINC000073355293 337549848 /nfs/dbraw/zinc/54/98/48/337549848.db2.gz JAEPOFJDZMHBAX-UHFFFAOYSA-N 1 2 319.364 4.138 20 0 DIADLO Cc1ccc(C2CCN(c3[nH+]ccc4cc(F)ccc43)CC2)cn1 ZINC000571911782 337582698 /nfs/dbraw/zinc/58/26/98/337582698.db2.gz FOOLSVAPUXKUPS-UHFFFAOYSA-N 1 2 321.399 4.461 20 0 DIADLO Cc1ccc(SCC(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000161805052 337597419 /nfs/dbraw/zinc/59/74/19/337597419.db2.gz BHXOTXBQKCHHHC-UHFFFAOYSA-N 1 2 323.421 4.116 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(F)cc1Cl ZINC000161821866 337597662 /nfs/dbraw/zinc/59/76/62/337597662.db2.gz MVZBVHDFLJFZFN-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO Cn1c(CNc2ccc(-c3ccccc3)c[nH+]2)nc2ccccc21 ZINC000162222292 337611004 /nfs/dbraw/zinc/61/10/04/337611004.db2.gz FDDRSLLXUIGVRA-UHFFFAOYSA-N 1 2 314.392 4.247 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCOc2c(F)ccc(F)c21)c1ccncc1Cl ZINC000421852813 337650006 /nfs/dbraw/zinc/65/00/06/337650006.db2.gz HXVKQAHPMIRJCS-LKFCYVNXSA-N 1 2 324.758 4.188 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1OC)c1ccc(C)o1 ZINC000421833279 337651730 /nfs/dbraw/zinc/65/17/30/337651730.db2.gz NPIJUFORUUXLAT-DOMZBBRYSA-N 1 2 323.820 4.288 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1cc(C2CC2)nc2ccc(F)cc21 ZINC000080111396 337660355 /nfs/dbraw/zinc/66/03/55/337660355.db2.gz UHMSNYIMCUQMIF-UHFFFAOYSA-N 1 2 321.355 4.207 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CS[C@@H]1CCN(C(C)(C)C)C1=O ZINC000424125407 337749584 /nfs/dbraw/zinc/74/95/84/337749584.db2.gz QZSQMRSZKBWBKS-MRXNPFEDSA-N 1 2 320.502 4.146 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](CO)c2c(F)cccc2F)cc(C)c1F ZINC000536869711 337751884 /nfs/dbraw/zinc/75/18/84/337751884.db2.gz MCRGNVDZTGRMLY-WBMJQRKESA-N 1 2 323.358 4.105 20 0 DIADLO COCCC1CC[NH+]([C@H](CCc2ccccc2)C(F)F)CC1 ZINC000527935619 337776937 /nfs/dbraw/zinc/77/69/37/337776937.db2.gz MNUUKDOTWYLKMP-QGZVFWFLSA-N 1 2 311.416 4.001 20 0 DIADLO C[C@H](Nc1cccc(C2CCOCC2)c1)c1cn2ccccc2[nH+]1 ZINC000527994321 337778559 /nfs/dbraw/zinc/77/85/59/337778559.db2.gz ILNKQHYPDUVJMF-HNNXBMFYSA-N 1 2 321.424 4.401 20 0 DIADLO COc1c(C)c[nH+]c(CN[C@H](c2ccccc2)C(F)(F)F)c1C ZINC000533021083 337805867 /nfs/dbraw/zinc/80/58/67/337805867.db2.gz VONYSVGRSNVPOC-MRXNPFEDSA-N 1 2 324.346 4.100 20 0 DIADLO O=C(Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1ccsc1 ZINC000044567762 337811387 /nfs/dbraw/zinc/81/13/87/337811387.db2.gz OQIHUXIALDSPDZ-UHFFFAOYSA-N 1 2 323.421 4.200 20 0 DIADLO Cc1c(C(=O)Nc2cc[nH+]cc2C)sc2cccc(F)c12 ZINC000107289848 337828458 /nfs/dbraw/zinc/82/84/58/337828458.db2.gz DPQFUUXLHWFVAB-UHFFFAOYSA-N 1 2 300.358 4.305 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1nc(C)c2ccccc2n1)C(C)C ZINC000118840737 337851946 /nfs/dbraw/zinc/85/19/46/337851946.db2.gz GNBSTZLRXQBFCC-IBGZPJMESA-N 1 2 320.440 4.129 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@H]2c2cccc(C)c2C)cc[nH+]1 ZINC000119354674 337857143 /nfs/dbraw/zinc/85/71/43/337857143.db2.gz UCGJLIAXILWGGM-SFHVURJKSA-N 1 2 309.413 4.376 20 0 DIADLO c1csc(C[NH+](Cc2cccs2)Cc2cncs2)c1 ZINC000120083631 337870252 /nfs/dbraw/zinc/87/02/52/337870252.db2.gz DWPAFEUQZZDABV-UHFFFAOYSA-N 1 2 306.481 4.469 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@H](CC(C)C)c1cccs1 ZINC000121072713 337885464 /nfs/dbraw/zinc/88/54/64/337885464.db2.gz CHYUKEQLOWIBQK-CQSZACIVSA-N 1 2 303.431 4.360 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccccc1Cl ZINC000537085628 337887875 /nfs/dbraw/zinc/88/78/75/337887875.db2.gz JOMXLFKVQAUQHK-OAHLLOKOSA-N 1 2 305.809 4.087 20 0 DIADLO Cc1cccc([C@H](C)[NH2+]Cc2noc(Cc3ccccc3)n2)c1C ZINC000537088685 337888319 /nfs/dbraw/zinc/88/83/19/337888319.db2.gz SJWSBKOCXOXZKD-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO Clc1ccc(CN2CCc3c([nH+]cn3-c3ccccc3)C2)cc1 ZINC000537588941 337946044 /nfs/dbraw/zinc/94/60/44/337946044.db2.gz UBGKJBSTVJBYFX-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO CCc1cc(N2CC[C@@H](C)C3(CCC3)C2)nc(-c2ccncc2)[nH+]1 ZINC000537826501 337962822 /nfs/dbraw/zinc/96/28/22/337962822.db2.gz JZBQPSLMUNJMCT-OAHLLOKOSA-N 1 2 322.456 4.118 20 0 DIADLO COC[C@@H]([NH2+]C(c1ccccc1)c1ccccc1)c1ccco1 ZINC000514244298 337967844 /nfs/dbraw/zinc/96/78/44/337967844.db2.gz GENXGAZDJMNZKT-GOSISDBHSA-N 1 2 307.393 4.346 20 0 DIADLO CC(C)c1cc(N2CC(C)(C)[C@@H]2[C@@H]2CCCO2)nc(C(C)C)[nH+]1 ZINC000514832869 337972597 /nfs/dbraw/zinc/97/25/97/337972597.db2.gz SHEQTSGYJDPSGM-RDJZCZTQSA-N 1 2 317.477 4.117 20 0 DIADLO CCCCN(C(=O)c1ccc2[nH+]ccn2c1)[C@H]1CCC[C@H](C)C1 ZINC000515245058 337982910 /nfs/dbraw/zinc/98/29/10/337982910.db2.gz YYYRIJCJMOEZBM-RDJZCZTQSA-N 1 2 313.445 4.155 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cc(Cl)cc4cccnc43)cn2c1 ZINC000516098196 338004470 /nfs/dbraw/zinc/00/44/70/338004470.db2.gz LOGDQYXKPRADCM-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO Cc1cc(C)c([C@H](C)Sc2[nH+]cnc3c2cnn3C)c(C)c1 ZINC000516147761 338005443 /nfs/dbraw/zinc/00/54/43/338005443.db2.gz WLGXURMAHHXRQI-ZDUSSCGKSA-N 1 2 312.442 4.142 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@H]2CCC[C@H]2c2ccccc2)n1 ZINC000516169332 338007053 /nfs/dbraw/zinc/00/70/53/338007053.db2.gz OWZJTXIQEBUVFO-ROUUACIJSA-N 1 2 319.408 4.415 20 0 DIADLO Cc1cc[nH+]c(NC[C@H]2CC[C@H](c3ccccc3)O2)c1Cl ZINC000516268873 338009216 /nfs/dbraw/zinc/00/92/16/338009216.db2.gz XYPQRDPNQJTZML-HUUCEWRRSA-N 1 2 302.805 4.376 20 0 DIADLO CC(C)c1ccccc1N(C)C(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000516512319 338014226 /nfs/dbraw/zinc/01/42/26/338014226.db2.gz NPKPENXDLSFEFM-UHFFFAOYSA-N 1 2 319.408 4.272 20 0 DIADLO C[C@@H](c1ccc(Oc2ccccc2)cc1)[N@H+](C)Cc1nccn1C ZINC000445454201 338017114 /nfs/dbraw/zinc/01/71/14/338017114.db2.gz YSMOOCBBVVGSAD-INIZCTEOSA-N 1 2 321.424 4.405 20 0 DIADLO C[C@@H](c1ccc(Oc2ccccc2)cc1)[N@@H+](C)Cc1nccn1C ZINC000445454201 338017115 /nfs/dbraw/zinc/01/71/15/338017115.db2.gz YSMOOCBBVVGSAD-INIZCTEOSA-N 1 2 321.424 4.405 20 0 DIADLO CCCCC[C@@H]1CCCN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000426107446 338020604 /nfs/dbraw/zinc/02/06/04/338020604.db2.gz YFFPAFQLLZEWBC-MRXNPFEDSA-N 1 2 314.433 4.219 20 0 DIADLO CSC1(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)CCC1 ZINC000426124112 338020783 /nfs/dbraw/zinc/02/07/83/338020783.db2.gz QXNXBONBNYXMHA-UHFFFAOYSA-N 1 2 314.410 4.098 20 0 DIADLO Cc1ccc(Cc2noc(-c3ccc(C(C)(F)F)cc3)n2)c[nH+]1 ZINC000426394176 338030223 /nfs/dbraw/zinc/03/02/23/338030223.db2.gz IHTDTYKHRMFWCW-UHFFFAOYSA-N 1 2 315.323 4.143 20 0 DIADLO COCC(C)(C)C[NH2+]c1ccc(C)cc1OCC(F)(F)F ZINC000426413095 338031037 /nfs/dbraw/zinc/03/10/37/338031037.db2.gz VGELNIJLVUJSTI-UHFFFAOYSA-N 1 2 305.340 4.021 20 0 DIADLO COc1cc(C)cc(NCc2c[nH+]c3ccc(Cl)cn23)c1C ZINC000426544568 338034427 /nfs/dbraw/zinc/03/44/27/338034427.db2.gz NWKWWELUBSJRQP-UHFFFAOYSA-N 1 2 315.804 4.225 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2ccc(C(C)(C)C)cc2)c(C)[nH+]1 ZINC000428172943 338041855 /nfs/dbraw/zinc/04/18/55/338041855.db2.gz XFVRHQRHYCNJII-UHFFFAOYSA-N 1 2 310.441 4.486 20 0 DIADLO Cc1c[nH]cc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(C)c1 ZINC000428210581 338042447 /nfs/dbraw/zinc/04/24/47/338042447.db2.gz RPRGRCREZHYSAP-UHFFFAOYSA-N 1 2 307.353 4.071 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@@H+]2Cc2nnc(C(C)C)[nH]2)o1 ZINC000428235548 338043713 /nfs/dbraw/zinc/04/37/13/338043713.db2.gz BVKWSZGBJXTPEI-OAHLLOKOSA-N 1 2 316.449 4.201 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@H+]2Cc2nnc(C(C)C)[nH]2)o1 ZINC000428235548 338043714 /nfs/dbraw/zinc/04/37/14/338043714.db2.gz BVKWSZGBJXTPEI-OAHLLOKOSA-N 1 2 316.449 4.201 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@@H](C)OC[C@H]1c1ccccc1 ZINC000428245148 338044129 /nfs/dbraw/zinc/04/41/29/338044129.db2.gz LUGYJEFAVYLWQO-PBHICJAKSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@@H](C)OC[C@H]1c1ccccc1 ZINC000428245148 338044130 /nfs/dbraw/zinc/04/41/30/338044130.db2.gz LUGYJEFAVYLWQO-PBHICJAKSA-N 1 2 314.429 4.068 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2nnc(C(C)C)[nH]2)o1 ZINC000428244580 338044205 /nfs/dbraw/zinc/04/42/05/338044205.db2.gz IRXUHDSSKWROCU-UKRRQHHQSA-N 1 2 316.449 4.057 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2nnc(C(C)C)[nH]2)o1 ZINC000428244580 338044206 /nfs/dbraw/zinc/04/42/06/338044206.db2.gz IRXUHDSSKWROCU-UKRRQHHQSA-N 1 2 316.449 4.057 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NCCSCc2ccccc2)c1 ZINC000428271006 338045012 /nfs/dbraw/zinc/04/50/12/338045012.db2.gz XDUHBVXYAIEHPJ-UHFFFAOYSA-N 1 2 323.465 4.432 20 0 DIADLO CC(C)Sc1cccc(Cl)c1CN(C)Cc1[nH+]ccn1C ZINC000428274280 338045209 /nfs/dbraw/zinc/04/52/09/338045209.db2.gz BQPYPZBFSBZKPW-UHFFFAOYSA-N 1 2 323.893 4.206 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)Oc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000428311046 338046709 /nfs/dbraw/zinc/04/67/09/338046709.db2.gz PSWPJVOBKDIGGF-ZDUSSCGKSA-N 1 2 318.804 4.066 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2cc(C)ccc2OC(F)F)n1 ZINC000428343400 338048080 /nfs/dbraw/zinc/04/80/80/338048080.db2.gz BPUPANAFAJCAAK-LLVKDONJSA-N 1 2 312.385 4.212 20 0 DIADLO Cc1cnc([C@H](C)[N@H+](C)Cc2cccc(Cl)c2Cl)cn1 ZINC000428361263 338048876 /nfs/dbraw/zinc/04/88/76/338048876.db2.gz KIKDHPBZLWJUPN-NSHDSACASA-N 1 2 310.228 4.285 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+](C)Cc2cccc(Cl)c2Cl)cn1 ZINC000428361263 338048877 /nfs/dbraw/zinc/04/88/77/338048877.db2.gz KIKDHPBZLWJUPN-NSHDSACASA-N 1 2 310.228 4.285 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+](C)Cc2cccc(Cl)c2Cl)cn1 ZINC000428361260 338048915 /nfs/dbraw/zinc/04/89/15/338048915.db2.gz KIKDHPBZLWJUPN-LLVKDONJSA-N 1 2 310.228 4.285 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+](C)Cc2cccc(Cl)c2Cl)cn1 ZINC000428361260 338048916 /nfs/dbraw/zinc/04/89/16/338048916.db2.gz KIKDHPBZLWJUPN-LLVKDONJSA-N 1 2 310.228 4.285 20 0 DIADLO CCCc1nc(C)c(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)o1 ZINC000428459498 338053103 /nfs/dbraw/zinc/05/31/03/338053103.db2.gz FDUTVEKZUMJLML-LBPRGKRZSA-N 1 2 308.372 4.407 20 0 DIADLO CCCc1nc(C)c(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)o1 ZINC000428459498 338053104 /nfs/dbraw/zinc/05/31/04/338053104.db2.gz FDUTVEKZUMJLML-LBPRGKRZSA-N 1 2 308.372 4.407 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1oc(C(C)C)nc1C ZINC000428465975 338053626 /nfs/dbraw/zinc/05/36/26/338053626.db2.gz UMCUUWSXQUZDAK-UHFFFAOYSA-N 1 2 322.836 4.400 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1oc(C(C)C)nc1C ZINC000428465975 338053627 /nfs/dbraw/zinc/05/36/27/338053627.db2.gz UMCUUWSXQUZDAK-UHFFFAOYSA-N 1 2 322.836 4.400 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ccccc2F)ncn1 ZINC000428467807 338053774 /nfs/dbraw/zinc/05/37/74/338053774.db2.gz KKFVRLKDMVNMSK-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2ccccc2F)ncn1 ZINC000428467807 338053775 /nfs/dbraw/zinc/05/37/75/338053775.db2.gz KKFVRLKDMVNMSK-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1nc(C[N@@H+](C)C[C@@H](OC(C)C)c2ccccc2)cs1 ZINC000428473609 338054184 /nfs/dbraw/zinc/05/41/84/338054184.db2.gz NGDHYQUECNCVEB-QGZVFWFLSA-N 1 2 304.459 4.050 20 0 DIADLO Cc1nc(C[N@H+](C)C[C@@H](OC(C)C)c2ccccc2)cs1 ZINC000428473609 338054185 /nfs/dbraw/zinc/05/41/85/338054185.db2.gz NGDHYQUECNCVEB-QGZVFWFLSA-N 1 2 304.459 4.050 20 0 DIADLO Cc1nc(N2CCc3c(Cl)cc(Cl)cc3[C@H]2C)cc[nH+]1 ZINC000428687261 338058628 /nfs/dbraw/zinc/05/86/28/338058628.db2.gz DFUGJICCMIZXJL-SECBINFHSA-N 1 2 308.212 4.216 20 0 DIADLO Clc1ccc(C2CC[NH+](Cc3ncccn3)CC2)c(Cl)c1 ZINC000428707168 338059020 /nfs/dbraw/zinc/05/90/20/338059020.db2.gz GYSIDMCWTBBOPI-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO CCCc1nc(C)c(C[N@@H+]2CCCn3c(cc4ccccc43)C2)o1 ZINC000428982658 338067546 /nfs/dbraw/zinc/06/75/46/338067546.db2.gz UCVMHMVNCSACER-UHFFFAOYSA-N 1 2 323.440 4.296 20 0 DIADLO CCCc1nc(C)c(C[N@H+]2CCCn3c(cc4ccccc43)C2)o1 ZINC000428982658 338067547 /nfs/dbraw/zinc/06/75/47/338067547.db2.gz UCVMHMVNCSACER-UHFFFAOYSA-N 1 2 323.440 4.296 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000429404254 338079761 /nfs/dbraw/zinc/07/97/61/338079761.db2.gz LWMYOTUTPYAXFM-CQSZACIVSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000429404254 338079762 /nfs/dbraw/zinc/07/97/62/338079762.db2.gz LWMYOTUTPYAXFM-CQSZACIVSA-N 1 2 311.385 4.139 20 0 DIADLO C[N@H+](Cc1cn2c(n1)CCCC2)Cc1ccc(Cl)c(Cl)c1 ZINC000429545804 338083650 /nfs/dbraw/zinc/08/36/50/338083650.db2.gz FZQVUDMVYYTZJZ-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO C[N@@H+](Cc1cn2c(n1)CCCC2)Cc1ccc(Cl)c(Cl)c1 ZINC000429545804 338083651 /nfs/dbraw/zinc/08/36/51/338083651.db2.gz FZQVUDMVYYTZJZ-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO CN(Cc1cn2c([nH+]1)CCCC2)Cc1ccc(Cl)c(Cl)c1 ZINC000429545804 338083652 /nfs/dbraw/zinc/08/36/52/338083652.db2.gz FZQVUDMVYYTZJZ-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2cc(C(C)(C)C)on2)sc1C ZINC000429699873 338087700 /nfs/dbraw/zinc/08/77/00/338087700.db2.gz QWFNPYONBWYJEI-UHFFFAOYSA-N 1 2 307.463 4.070 20 0 DIADLO COc1ccc(C[N@H+](Cc2cc(C(C)(C)C)on2)C2CC2)cc1 ZINC000429718923 338088304 /nfs/dbraw/zinc/08/83/04/338088304.db2.gz BUNZNDLJJWNOJW-UHFFFAOYSA-N 1 2 314.429 4.145 20 0 DIADLO COc1ccc(C[N@@H+](Cc2cc(C(C)(C)C)on2)C2CC2)cc1 ZINC000429718923 338088305 /nfs/dbraw/zinc/08/83/05/338088305.db2.gz BUNZNDLJJWNOJW-UHFFFAOYSA-N 1 2 314.429 4.145 20 0 DIADLO C=Cc1ccc(C(=O)N(Cc2[nH]cc[nH+]2)c2cccc(F)c2)cc1 ZINC000429818504 338090633 /nfs/dbraw/zinc/09/06/33/338090633.db2.gz HJQOQTQWNKXXNX-UHFFFAOYSA-N 1 2 321.355 4.039 20 0 DIADLO CCOC1(C)CC[NH+](Cc2csc(Cl)c2Cl)CC1 ZINC000430091046 338095849 /nfs/dbraw/zinc/09/58/49/338095849.db2.gz VDTGOXFFRCQLJD-UHFFFAOYSA-N 1 2 308.274 4.446 20 0 DIADLO CC1(C)C[N@H+](Cc2ccccc2OC(F)F)[C@H]1c1cccnc1 ZINC000430100950 338096586 /nfs/dbraw/zinc/09/65/86/338096586.db2.gz BPTDSURRAIVKBR-INIZCTEOSA-N 1 2 318.367 4.266 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccccc2OC(F)F)[C@H]1c1cccnc1 ZINC000430100950 338096587 /nfs/dbraw/zinc/09/65/87/338096587.db2.gz BPTDSURRAIVKBR-INIZCTEOSA-N 1 2 318.367 4.266 20 0 DIADLO COc1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccnc2)cc1Cl ZINC000430105179 338096923 /nfs/dbraw/zinc/09/69/23/338096923.db2.gz OHOOHFFRPWGFAQ-KRWDZBQOSA-N 1 2 316.832 4.327 20 0 DIADLO COc1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)cc1Cl ZINC000430105179 338096924 /nfs/dbraw/zinc/09/69/24/338096924.db2.gz OHOOHFFRPWGFAQ-KRWDZBQOSA-N 1 2 316.832 4.327 20 0 DIADLO CCc1occc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000430406137 338106556 /nfs/dbraw/zinc/10/65/56/338106556.db2.gz UWKKWMLLJKFVGK-UHFFFAOYSA-N 1 2 308.337 4.282 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)c(C)o1 ZINC000430747670 338113417 /nfs/dbraw/zinc/11/34/17/338113417.db2.gz NHIMQIAAVAWSRA-QMMMGPOBSA-N 1 2 301.283 4.304 20 0 DIADLO CCC[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccccn1 ZINC000430750811 338113486 /nfs/dbraw/zinc/11/34/86/338113486.db2.gz PMSKJULLGZQWDV-CYBMUJFWSA-N 1 2 312.310 4.269 20 0 DIADLO CC[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccc(F)cn1 ZINC000430749277 338113508 /nfs/dbraw/zinc/11/35/08/338113508.db2.gz ULULQCKZESWHJA-GFCCVEGCSA-N 1 2 316.273 4.018 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1cccc(F)c1F ZINC000430748919 338113517 /nfs/dbraw/zinc/11/35/17/338113517.db2.gz SBSUHWWTEBHZNM-SSDOTTSWSA-N 1 2 319.248 4.372 20 0 DIADLO CCCc1csc(CN2CCCC[C@@H]2c2[nH+]ccn2CC)n1 ZINC000430872968 338117740 /nfs/dbraw/zinc/11/77/40/338117740.db2.gz NTAYQYHJXWDDMR-OAHLLOKOSA-N 1 2 318.490 4.039 20 0 DIADLO COCCOCc1ccc(-c2[nH]c3c([nH+]2)c(C)ccc3C)cc1 ZINC000430930385 338119036 /nfs/dbraw/zinc/11/90/36/338119036.db2.gz ADKRJMJWMFYISF-UHFFFAOYSA-N 1 2 310.397 4.010 20 0 DIADLO Cc1ccc([C@H]2CCCN2c2[nH+]c3ccc(F)cc3n2C)s1 ZINC000431410004 338130021 /nfs/dbraw/zinc/13/00/21/338130021.db2.gz LIURRQPDQYPRFX-CQSZACIVSA-N 1 2 315.417 4.424 20 0 DIADLO CCc1ccc([C@@H]2CCN(c3cc[nH+]c4ccncc43)C2)cc1 ZINC000431508889 338132804 /nfs/dbraw/zinc/13/28/04/338132804.db2.gz SLWPKPGZJDEIAF-QGZVFWFLSA-N 1 2 303.409 4.186 20 0 DIADLO CC[C@@H]1CCC[C@H]1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000162836350 338137792 /nfs/dbraw/zinc/13/77/92/338137792.db2.gz DQLRFDHXHKGEIS-RDTXWAMCSA-N 1 2 310.397 4.182 20 0 DIADLO CCN(c1ccccc1)c1cc(N[C@@H](C)c2ccccn2)[nH+]cn1 ZINC000432137735 338146814 /nfs/dbraw/zinc/14/68/14/338146814.db2.gz FZKMXQCSSBKFBH-HNNXBMFYSA-N 1 2 319.412 4.203 20 0 DIADLO Fc1ccc(C[NH2+]Cc2cn3ccccc3n2)c(Cl)c1Cl ZINC000432229342 338149143 /nfs/dbraw/zinc/14/91/43/338149143.db2.gz PPVIMXQLQGMHKM-UHFFFAOYSA-N 1 2 324.186 4.070 20 0 DIADLO COc1cnccc1[C@@H](C)[NH2+]Cc1csc(Cl)c1Cl ZINC000432236420 338149588 /nfs/dbraw/zinc/14/95/88/338149588.db2.gz UMCCMTGCXGUPHE-MRVPVSSYSA-N 1 2 317.241 4.309 20 0 DIADLO CC(C)Cn1ccnc1C[NH2+]Cc1csc(Cl)c1Cl ZINC000432243149 338150315 /nfs/dbraw/zinc/15/03/15/338150315.db2.gz SLCJRGOKJJRKIV-UHFFFAOYSA-N 1 2 318.273 4.197 20 0 DIADLO CC(C)Cn1cc[nH+]c1CNCc1csc(Cl)c1Cl ZINC000432243149 338150316 /nfs/dbraw/zinc/15/03/16/338150316.db2.gz SLCJRGOKJJRKIV-UHFFFAOYSA-N 1 2 318.273 4.197 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)sc1C ZINC000432250150 338150851 /nfs/dbraw/zinc/15/08/51/338150851.db2.gz ITOZGGOLRVBNPQ-UHFFFAOYSA-N 1 2 319.232 4.496 20 0 DIADLO COC[C@H]([NH2+]Cc1csc(Cl)c1Cl)c1ccco1 ZINC000432252718 338151061 /nfs/dbraw/zinc/15/10/61/338151061.db2.gz ZSSANMZUZPLTSM-VIFPVBQESA-N 1 2 306.214 4.125 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCc4sccc4C3)sc2c1 ZINC000432744868 338165934 /nfs/dbraw/zinc/16/59/34/338165934.db2.gz NZBMYEMYBALCRP-UHFFFAOYSA-N 1 2 304.415 4.055 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCc4sccc4C3)sc2c1 ZINC000432744868 338165935 /nfs/dbraw/zinc/16/59/35/338165935.db2.gz NZBMYEMYBALCRP-UHFFFAOYSA-N 1 2 304.415 4.055 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2ccc(C(F)(F)F)s2)s1 ZINC000432746939 338166002 /nfs/dbraw/zinc/16/60/02/338166002.db2.gz GOAQMUJSBZAZEY-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2ccc(C(F)(F)F)s2)s1 ZINC000432746939 338166003 /nfs/dbraw/zinc/16/60/03/338166003.db2.gz GOAQMUJSBZAZEY-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCc4ccc(F)cc4C3)sc2c1 ZINC000432752775 338166458 /nfs/dbraw/zinc/16/64/58/338166458.db2.gz OXPJWWGAMHEQOC-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCc4ccc(F)cc4C3)sc2c1 ZINC000432752775 338166459 /nfs/dbraw/zinc/16/64/59/338166459.db2.gz OXPJWWGAMHEQOC-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nnc(C(C)(C)C)[nH]1)c1ccccc1Cl ZINC000432841967 338170366 /nfs/dbraw/zinc/17/03/66/338170366.db2.gz SJQNVFMTYNZUEV-HNNXBMFYSA-N 1 2 320.868 4.243 20 0 DIADLO Cc1cnc(C2CCN(c3cc(C)[nH+]c(C(C)C)n3)CC2)s1 ZINC000432864071 338171215 /nfs/dbraw/zinc/17/12/15/338171215.db2.gz GSRLWRUTBXHJOS-UHFFFAOYSA-N 1 2 316.474 4.057 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432919569 338173039 /nfs/dbraw/zinc/17/30/39/338173039.db2.gz UQYLLJGAKQELGR-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432919569 338173040 /nfs/dbraw/zinc/17/30/40/338173040.db2.gz UQYLLJGAKQELGR-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO CC[C@@]1(CO)CCC[N@H+](Cc2csc(Cl)c2Cl)C1 ZINC000432920258 338173071 /nfs/dbraw/zinc/17/30/71/338173071.db2.gz XTDQEWWIGORVGW-CYBMUJFWSA-N 1 2 308.274 4.039 20 0 DIADLO CC[C@@]1(CO)CCC[N@@H+](Cc2csc(Cl)c2Cl)C1 ZINC000432920258 338173072 /nfs/dbraw/zinc/17/30/72/338173072.db2.gz XTDQEWWIGORVGW-CYBMUJFWSA-N 1 2 308.274 4.039 20 0 DIADLO CC[C@@]1(CO)CCC[N@H+](Cc2ccc(F)c(Cl)c2Cl)C1 ZINC000432919538 338173082 /nfs/dbraw/zinc/17/30/82/338173082.db2.gz ULBACTNBLLUAPS-OAHLLOKOSA-N 1 2 320.235 4.117 20 0 DIADLO CC[C@@]1(CO)CCC[N@@H+](Cc2ccc(F)c(Cl)c2Cl)C1 ZINC000432919538 338173083 /nfs/dbraw/zinc/17/30/83/338173083.db2.gz ULBACTNBLLUAPS-OAHLLOKOSA-N 1 2 320.235 4.117 20 0 DIADLO Cc1ccc([C@@]2(C)CCN(c3cc[nH+]c4ccncc43)C2)cc1 ZINC000432926526 338173472 /nfs/dbraw/zinc/17/34/72/338173472.db2.gz GWCKBDQSDJWKPV-FQEVSTJZSA-N 1 2 303.409 4.106 20 0 DIADLO CCc1ccc([C@@H]2CCN(C(=O)Nc3ccc(C)[nH+]c3C)C2)cc1 ZINC000433018593 338176510 /nfs/dbraw/zinc/17/65/10/338176510.db2.gz FGBHLPRZGBFMTA-GOSISDBHSA-N 1 2 323.440 4.282 20 0 DIADLO CSc1ccc(OCC[NH2+][C@H](c2ccccc2)C(F)F)cc1 ZINC000433047300 338178389 /nfs/dbraw/zinc/17/83/89/338178389.db2.gz RUURIDRAOSLSMO-MRXNPFEDSA-N 1 2 323.408 4.383 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3ncc(C(F)(F)F)s3)CC2)cc1 ZINC000433300895 338190293 /nfs/dbraw/zinc/19/02/93/338190293.db2.gz FNRZCDQKXVRFDT-UHFFFAOYSA-N 1 2 316.323 4.080 20 0 DIADLO Fc1cc(NCc2c[nH+]c3ccc(Cl)cn23)ccc1Cl ZINC000433305152 338190617 /nfs/dbraw/zinc/19/06/17/338190617.db2.gz MUPXMESNXMNEBP-UHFFFAOYSA-N 1 2 310.159 4.392 20 0 DIADLO Cc1nc(N2CCc3cc(Cl)cc(Cl)c3[C@@H]2C)cc[nH+]1 ZINC000433624930 338198634 /nfs/dbraw/zinc/19/86/34/338198634.db2.gz NYEHVZRQGCVNAF-VIFPVBQESA-N 1 2 308.212 4.216 20 0 DIADLO CCC1(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CCC1 ZINC000433683618 338199583 /nfs/dbraw/zinc/19/95/83/338199583.db2.gz OKAAYQNMYWOMFZ-UHFFFAOYSA-N 1 2 303.793 4.045 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000433782943 338201692 /nfs/dbraw/zinc/20/16/92/338201692.db2.gz LRFIOQOHPLINEH-ABAIWWIYSA-N 1 2 307.825 4.333 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CC[C@H](CC(F)(F)F)C1 ZINC000433813905 338202730 /nfs/dbraw/zinc/20/27/30/338202730.db2.gz FZJUNVJLSHGMSE-GFCCVEGCSA-N 1 2 324.346 4.331 20 0 DIADLO CC(C)(C)c1ccccc1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000433834880 338203098 /nfs/dbraw/zinc/20/30/98/338203098.db2.gz FMGSVLZUZOXLLD-UHFFFAOYSA-N 1 2 319.408 4.422 20 0 DIADLO CCC1(C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)CCC1 ZINC000433877395 338204139 /nfs/dbraw/zinc/20/41/39/338204139.db2.gz LRSOIAYKFMBEIZ-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO CC(C)n1ncnc1C[N@@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000434510685 338218947 /nfs/dbraw/zinc/21/89/47/338218947.db2.gz NXAYXUZMBSUPKR-MRXNPFEDSA-N 1 2 318.852 4.240 20 0 DIADLO CC(C)n1ncnc1C[N@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000434510685 338218948 /nfs/dbraw/zinc/21/89/48/338218948.db2.gz NXAYXUZMBSUPKR-MRXNPFEDSA-N 1 2 318.852 4.240 20 0 DIADLO CCCCc1noc(C[N@H+](C)[C@@H](c2ccc(F)cc2)C(C)C)n1 ZINC000434612270 338221143 /nfs/dbraw/zinc/22/11/43/338221143.db2.gz QANXJNOZGLFNEV-GOSISDBHSA-N 1 2 319.424 4.380 20 0 DIADLO CCCCc1noc(C[N@@H+](C)[C@@H](c2ccc(F)cc2)C(C)C)n1 ZINC000434612270 338221144 /nfs/dbraw/zinc/22/11/44/338221144.db2.gz QANXJNOZGLFNEV-GOSISDBHSA-N 1 2 319.424 4.380 20 0 DIADLO C[C@@H]([NH2+]Cc1cocn1)c1cccc(OCc2ccccc2)c1 ZINC000434791815 338225735 /nfs/dbraw/zinc/22/57/35/338225735.db2.gz FJWLIKKPYRTQHU-OAHLLOKOSA-N 1 2 308.381 4.104 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)c(Cl)c1OC ZINC000434979689 338228481 /nfs/dbraw/zinc/22/84/81/338228481.db2.gz WASBVLXAURAANM-HNNXBMFYSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(C[N@H+]2CC[C@H]2c2ccccc2)c(Cl)c1OC ZINC000434979689 338228482 /nfs/dbraw/zinc/22/84/82/338228482.db2.gz WASBVLXAURAANM-HNNXBMFYSA-N 1 2 317.816 4.304 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1ncc(C(F)(F)F)s1 ZINC000434988552 338229225 /nfs/dbraw/zinc/22/92/25/338229225.db2.gz UEJBYXOFWXAZRQ-UHFFFAOYSA-N 1 2 318.339 4.241 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1ncc(C(F)(F)F)s1 ZINC000434988552 338229226 /nfs/dbraw/zinc/22/92/26/338229226.db2.gz UEJBYXOFWXAZRQ-UHFFFAOYSA-N 1 2 318.339 4.241 20 0 DIADLO CC(C)(C)C1CC[NH+](Cc2ncc(C(F)(F)F)s2)CC1 ZINC000434988784 338229253 /nfs/dbraw/zinc/22/92/53/338229253.db2.gz WKXLENKQCYXEPD-UHFFFAOYSA-N 1 2 306.397 4.420 20 0 DIADLO Oc1ccc(Br)c(C[N@@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000434989074 338229321 /nfs/dbraw/zinc/22/93/21/338229321.db2.gz ZLCYFRNZNQOWFH-MRXNPFEDSA-N 1 2 318.214 4.102 20 0 DIADLO Oc1ccc(Br)c(C[N@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000434989074 338229322 /nfs/dbraw/zinc/22/93/22/338229322.db2.gz ZLCYFRNZNQOWFH-MRXNPFEDSA-N 1 2 318.214 4.102 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)s1 ZINC000435126305 338232386 /nfs/dbraw/zinc/23/23/86/338232386.db2.gz LMVLCLSWUMQLRY-AWEZNQCLSA-N 1 2 316.392 4.484 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)s1 ZINC000435126305 338232387 /nfs/dbraw/zinc/23/23/87/338232387.db2.gz LMVLCLSWUMQLRY-AWEZNQCLSA-N 1 2 316.392 4.484 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1ncc(C(F)(F)F)s1 ZINC000435125116 338232458 /nfs/dbraw/zinc/23/24/58/338232458.db2.gz VCRFBMMWOBUXEJ-VIFPVBQESA-N 1 2 318.339 4.494 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ncc(C(F)(F)F)s1 ZINC000435125116 338232459 /nfs/dbraw/zinc/23/24/59/338232459.db2.gz VCRFBMMWOBUXEJ-VIFPVBQESA-N 1 2 318.339 4.494 20 0 DIADLO C[N@H+](CCCc1ccccc1)Cc1ncc(C(F)(F)F)s1 ZINC000435129211 338232679 /nfs/dbraw/zinc/23/26/79/338232679.db2.gz LQDMLRRAMSUKMT-UHFFFAOYSA-N 1 2 314.376 4.227 20 0 DIADLO C[N@@H+](CCCc1ccccc1)Cc1ncc(C(F)(F)F)s1 ZINC000435129211 338232680 /nfs/dbraw/zinc/23/26/80/338232680.db2.gz LQDMLRRAMSUKMT-UHFFFAOYSA-N 1 2 314.376 4.227 20 0 DIADLO CSc1ccc2[nH]c(-c3cc(-n4cc[nH+]c4)cs3)nc2c1 ZINC000435684264 338245207 /nfs/dbraw/zinc/24/52/07/338245207.db2.gz UNEOEBNOYJZWNH-UHFFFAOYSA-N 1 2 312.423 4.199 20 0 DIADLO CSc1ccc2nc(-c3cc(-n4cc[nH+]c4)cs3)[nH]c2c1 ZINC000435684264 338245208 /nfs/dbraw/zinc/24/52/08/338245208.db2.gz UNEOEBNOYJZWNH-UHFFFAOYSA-N 1 2 312.423 4.199 20 0 DIADLO O=C(CCC1CC1)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436163304 338260172 /nfs/dbraw/zinc/26/01/72/338260172.db2.gz VSIVVSHEYQDPIR-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO CC[C@@]1(C)C[C@H]1C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436188712 338261235 /nfs/dbraw/zinc/26/12/35/338261235.db2.gz RZMNJRXHCBEAOR-PXNSSMCTSA-N 1 2 323.440 4.261 20 0 DIADLO Fc1cccc2[nH]c(CNc3ccc(-n4cc[nH+]c4)c(F)c3)cc21 ZINC000436310327 338268378 /nfs/dbraw/zinc/26/83/78/338268378.db2.gz WVTGWCPQKGBQQP-UHFFFAOYSA-N 1 2 324.334 4.244 20 0 DIADLO COc1cccc2c(NCc3nc4cc(C)ccc4[nH]3)cc[nH+]c12 ZINC000436456270 338272736 /nfs/dbraw/zinc/27/27/36/338272736.db2.gz ZNISECICAGQSOB-UHFFFAOYSA-N 1 2 318.380 4.040 20 0 DIADLO COc1cccc2c(NCc3nc4ccc(C)cc4[nH]3)cc[nH+]c12 ZINC000436456270 338272737 /nfs/dbraw/zinc/27/27/37/338272737.db2.gz ZNISECICAGQSOB-UHFFFAOYSA-N 1 2 318.380 4.040 20 0 DIADLO COc1cccc2c(N[C@@H]3CCO[C@H](C(C)(C)C)C3)cc[nH+]c12 ZINC000436460122 338272900 /nfs/dbraw/zinc/27/29/00/338272900.db2.gz MXMCMIUSQXZIDM-DYVFJYSZSA-N 1 2 314.429 4.249 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@H](C)[C@@H]3CCCC[C@@H]32)c(C)[nH+]1 ZINC000436488233 338274045 /nfs/dbraw/zinc/27/40/45/338274045.db2.gz DNHUESHJOCDYTI-RCBQFDQVSA-N 1 2 301.434 4.049 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)Cc2ccc(Cl)s2)c(C)[nH+]1 ZINC000436489049 338274071 /nfs/dbraw/zinc/27/40/71/338274071.db2.gz FLQRZRWAYGFSLO-UHFFFAOYSA-N 1 2 323.849 4.386 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C)c2ccc(F)c(F)c2)c(C)[nH+]1 ZINC000436491062 338274161 /nfs/dbraw/zinc/27/41/61/338274161.db2.gz HMBGNICOMFWFCN-NSHDSACASA-N 1 2 319.355 4.168 20 0 DIADLO CC[C@H](c1ccncc1)N(C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000436492018 338274168 /nfs/dbraw/zinc/27/41/68/338274168.db2.gz JFTRSMOEFHLLHP-MRXNPFEDSA-N 1 2 312.417 4.017 20 0 DIADLO Cc1cccc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)c1O ZINC000436544441 338276227 /nfs/dbraw/zinc/27/62/27/338276227.db2.gz JJGSNMAFLBFGPA-UHFFFAOYSA-N 1 2 320.348 4.140 20 0 DIADLO Cc1cn[nH]c1C[N@H+](Cc1ccccc1)[C@H](C)c1ccccc1 ZINC000436651531 338281548 /nfs/dbraw/zinc/28/15/48/338281548.db2.gz GFAVQETWKADNJO-QGZVFWFLSA-N 1 2 305.425 4.482 20 0 DIADLO Cc1cn[nH]c1C[N@@H+](Cc1ccccc1)[C@H](C)c1ccccc1 ZINC000436651531 338281549 /nfs/dbraw/zinc/28/15/49/338281549.db2.gz GFAVQETWKADNJO-QGZVFWFLSA-N 1 2 305.425 4.482 20 0 DIADLO CCCCCc1ccc([C@@H](CC)[NH2+][C@@H](C)c2ncn(C)n2)cc1 ZINC000437057675 338298952 /nfs/dbraw/zinc/29/89/52/338298952.db2.gz VOSDSRKDTGHLTC-MAUKXSAKSA-N 1 2 314.477 4.350 20 0 DIADLO CCCCCc1ccc([C@H](CC)[NH2+][C@@H](C)c2ncn(C)n2)cc1 ZINC000437057680 338299048 /nfs/dbraw/zinc/29/90/48/338299048.db2.gz VOSDSRKDTGHLTC-YJBOKZPZSA-N 1 2 314.477 4.350 20 0 DIADLO Fc1cccc2c1OCC[C@H]2[NH2+][C@H](Cc1ccccc1)C(F)F ZINC000437076859 338299509 /nfs/dbraw/zinc/29/95/09/338299509.db2.gz NCNXNFVBUSUBMA-HZPDHXFCSA-N 1 2 321.342 4.115 20 0 DIADLO Fc1ccccc1CSCc1[nH+]ccn1CC(F)(F)F ZINC000437272710 338305670 /nfs/dbraw/zinc/30/56/70/338305670.db2.gz DLIYHKPSQUIURJ-UHFFFAOYSA-N 1 2 304.312 4.018 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)Cc1c(Cl)cnn1C ZINC000437578370 338314188 /nfs/dbraw/zinc/31/41/88/338314188.db2.gz OGLUJPANYMAZSU-UHFFFAOYSA-N 1 2 317.820 4.014 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)Cc1c(Cl)cnn1C ZINC000437578370 338314189 /nfs/dbraw/zinc/31/41/89/338314189.db2.gz OGLUJPANYMAZSU-UHFFFAOYSA-N 1 2 317.820 4.014 20 0 DIADLO C[N@H+](Cc1cc2c(cccc2F)[nH]1)Cc1ccc(F)cc1F ZINC000437589864 338315283 /nfs/dbraw/zinc/31/52/83/338315283.db2.gz LCABLHAJOFUEAM-UHFFFAOYSA-N 1 2 304.315 4.217 20 0 DIADLO C[N@@H+](Cc1cc2c(cccc2F)[nH]1)Cc1ccc(F)cc1F ZINC000437589864 338315284 /nfs/dbraw/zinc/31/52/84/338315284.db2.gz LCABLHAJOFUEAM-UHFFFAOYSA-N 1 2 304.315 4.217 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1COc1ccc2ncccc2c1 ZINC000437618474 338316372 /nfs/dbraw/zinc/31/63/72/338316372.db2.gz YMUQOWOWVOGESR-UHFFFAOYSA-N 1 2 315.376 4.059 20 0 DIADLO Cc1ccc(NC(=O)c2ncsc2-c2ccccc2)c(C)[nH+]1 ZINC000437882297 338324118 /nfs/dbraw/zinc/32/41/18/338324118.db2.gz HMACTZKTOASZDG-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO C[C@H](Cc1ccccc1F)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000438083204 338330371 /nfs/dbraw/zinc/33/03/71/338330371.db2.gz WWZVXPNMMKYCEX-CQSZACIVSA-N 1 2 309.388 4.269 20 0 DIADLO CC(C)CCc1noc([C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2)n1 ZINC000438246240 338337874 /nfs/dbraw/zinc/33/78/74/338337874.db2.gz ZEGJVLMEIJWRKC-INIZCTEOSA-N 1 2 317.408 4.134 20 0 DIADLO CC(C)CCc1noc([C@@H]2CCC[N@H+]2Cc2ccc(F)cc2)n1 ZINC000438246240 338337875 /nfs/dbraw/zinc/33/78/75/338337875.db2.gz ZEGJVLMEIJWRKC-INIZCTEOSA-N 1 2 317.408 4.134 20 0 DIADLO CSc1ccccc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438298862 338338977 /nfs/dbraw/zinc/33/89/77/338338977.db2.gz ATCUBPNLLTWWPV-UHFFFAOYSA-N 1 2 309.438 4.265 20 0 DIADLO CCc1cc(NCc2c[nH+]cn2Cc2ccccc2)ccc1C ZINC000438313085 338339338 /nfs/dbraw/zinc/33/93/38/338339338.db2.gz SGMGLDSMSMNUAX-UHFFFAOYSA-N 1 2 305.425 4.414 20 0 DIADLO CC(C)Oc1ccccc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438315245 338339378 /nfs/dbraw/zinc/33/93/78/338339378.db2.gz RTKARQXOBBWNHW-UHFFFAOYSA-N 1 2 321.424 4.331 20 0 DIADLO Fc1ccccc1-c1ccc(C[N@@H+]2CCc3ncsc3C2)o1 ZINC000438350987 338340863 /nfs/dbraw/zinc/34/08/63/338340863.db2.gz ZRBYPLKGFCFJCW-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1ccccc1-c1ccc(C[N@H+]2CCc3ncsc3C2)o1 ZINC000438350987 338340864 /nfs/dbraw/zinc/34/08/64/338340864.db2.gz ZRBYPLKGFCFJCW-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+][C@@H]1CCOc2c(F)cccc21 ZINC000438476722 338345342 /nfs/dbraw/zinc/34/53/42/338345342.db2.gz GYXWCXNOUPGELJ-OAHLLOKOSA-N 1 2 309.743 4.232 20 0 DIADLO Cc1cccnc1C[N@H+]1C[C@@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000438554728 338347966 /nfs/dbraw/zinc/34/79/66/338347966.db2.gz VVZUOGTXPYKYPL-KSSFIOAISA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cccnc1C[N@@H+]1C[C@@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000438554728 338347967 /nfs/dbraw/zinc/34/79/67/338347967.db2.gz VVZUOGTXPYKYPL-KSSFIOAISA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H](c3cccc(Cl)c3)OC[C@H]2C)o1 ZINC000438555347 338347985 /nfs/dbraw/zinc/34/79/85/338347985.db2.gz QVPFOOZVLHRQRQ-PXAZEXFGSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H](c3cccc(Cl)c3)OC[C@H]2C)o1 ZINC000438555347 338347986 /nfs/dbraw/zinc/34/79/86/338347986.db2.gz QVPFOOZVLHRQRQ-PXAZEXFGSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1c(F)cccc1NC(=O)CCn1cc[nH+]c1-c1ccccc1 ZINC000438829949 338353030 /nfs/dbraw/zinc/35/30/30/338353030.db2.gz SNCRPAYHDJUCBX-UHFFFAOYSA-N 1 2 323.371 4.026 20 0 DIADLO Cc1[nH]c(C(=O)N[C@@H](CC(C)(C)C)c2ccc(Cl)cc2)c[nH+]1 ZINC000439315130 338366673 /nfs/dbraw/zinc/36/66/73/338366673.db2.gz HTHZQWXNYQPKDC-AWEZNQCLSA-N 1 2 319.836 4.279 20 0 DIADLO CCC[C@H]([NH2+][C@@H](C)c1ccc(SCC)cc1)C(=O)OCC ZINC000439595718 338373874 /nfs/dbraw/zinc/37/38/74/338373874.db2.gz YFJYIYPHYHTOEV-BBRMVZONSA-N 1 2 309.475 4.181 20 0 DIADLO C[C@H](C(=O)Nc1cccc2[nH+]ccn21)c1ccc2ccccc2c1 ZINC000439736910 338376934 /nfs/dbraw/zinc/37/69/34/338376934.db2.gz SIVKNYJZZKGQKB-AWEZNQCLSA-N 1 2 315.376 4.230 20 0 DIADLO Cc1ccc(C(=O)NCC2(C(C)C)CC2)cc1Oc1cc[nH+]cc1 ZINC000439818645 338379119 /nfs/dbraw/zinc/37/91/19/338379119.db2.gz GSSQKOOAVMRQBZ-UHFFFAOYSA-N 1 2 324.424 4.348 20 0 DIADLO CC[C@@H](F)C[NH2+][C@@H](c1nc2ccccc2n1C)c1ccccc1 ZINC000440518434 338388924 /nfs/dbraw/zinc/38/89/24/338388924.db2.gz KDNKFKVUMSGNFV-CRAIPNDOSA-N 1 2 311.404 4.000 20 0 DIADLO COc1cccc2c(N3CCC[C@@H](C(F)(F)F)[C@@H]3C)cc[nH+]c12 ZINC000440643687 338394037 /nfs/dbraw/zinc/39/40/37/338394037.db2.gz ABEDVWXZSPIBAX-WCQYABFASA-N 1 2 324.346 4.411 20 0 DIADLO COC[C@H](Nc1cc[nH+]c2c(OC)cccc12)c1ccccc1 ZINC000440652300 338394325 /nfs/dbraw/zinc/39/43/25/338394325.db2.gz ROQXVUDQBFQMRG-KRWDZBQOSA-N 1 2 308.381 4.043 20 0 DIADLO CO[C@@H]1CCN(c2cc(C(C)(C)C)[nH+]c(C(C)(C)C)n2)[C@@H](C)C1 ZINC000440669275 338394864 /nfs/dbraw/zinc/39/48/64/338394864.db2.gz DUZAPGDAXOAULB-UONOGXRCSA-N 1 2 319.493 4.075 20 0 DIADLO CC[C@H](F)C[N@@H+]1CCC[C@H]1c1nc(-c2cccc(C)c2)c[nH]1 ZINC000440778121 338397223 /nfs/dbraw/zinc/39/72/23/338397223.db2.gz AGRPMMGWPHKHJH-RDJZCZTQSA-N 1 2 301.409 4.270 20 0 DIADLO CC[C@H](F)C[N@H+]1CCC[C@H]1c1nc(-c2cccc(C)c2)c[nH]1 ZINC000440778121 338397224 /nfs/dbraw/zinc/39/72/24/338397224.db2.gz AGRPMMGWPHKHJH-RDJZCZTQSA-N 1 2 301.409 4.270 20 0 DIADLO CC[N@H+](CCCNC(=O)Nc1ccc(C)s1)c1ccccc1 ZINC000440848789 338398606 /nfs/dbraw/zinc/39/86/06/338398606.db2.gz WKIXRVKGDWWJRL-UHFFFAOYSA-N 1 2 317.458 4.095 20 0 DIADLO CC[N@@H+](CCCNC(=O)Nc1ccc(C)s1)c1ccccc1 ZINC000440848789 338398607 /nfs/dbraw/zinc/39/86/07/338398607.db2.gz WKIXRVKGDWWJRL-UHFFFAOYSA-N 1 2 317.458 4.095 20 0 DIADLO Cc1[nH]c2ccccc2c1C(=O)C[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000440903366 338399629 /nfs/dbraw/zinc/39/96/29/338399629.db2.gz AAUUZSYQRJMHGF-CQSZACIVSA-N 1 2 322.408 4.478 20 0 DIADLO Cc1[nH]c2ccccc2c1C(=O)C[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000440903366 338399630 /nfs/dbraw/zinc/39/96/30/338399630.db2.gz AAUUZSYQRJMHGF-CQSZACIVSA-N 1 2 322.408 4.478 20 0 DIADLO Cc1ccc(Cl)c(N(Cc2[nH]cc[nH+]2)C(=O)[C@@H](C)C(C)C)c1 ZINC000440908118 338399742 /nfs/dbraw/zinc/39/97/42/338399742.db2.gz YYAMCETWWSOACD-ZDUSSCGKSA-N 1 2 319.836 4.197 20 0 DIADLO Cc1nc(-c2ccc(C(=O)Nc3ccc(C)[nH+]c3C)cc2)cs1 ZINC000441081351 338402149 /nfs/dbraw/zinc/40/21/49/338402149.db2.gz UYBFJXZHUJNELR-UHFFFAOYSA-N 1 2 323.421 4.383 20 0 DIADLO Cc1ccc(NC(=O)CCCc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000446418348 338527669 /nfs/dbraw/zinc/52/76/69/338527669.db2.gz HCVCTAOMPTYEJQ-UHFFFAOYSA-N 1 2 302.805 4.313 20 0 DIADLO Cc1ccc(NC(=O)COc2ccccc2C(C)(C)C)c(C)[nH+]1 ZINC000446420838 338527800 /nfs/dbraw/zinc/52/78/00/338527800.db2.gz YGMSMYRZDFSPJF-UHFFFAOYSA-N 1 2 312.413 4.013 20 0 DIADLO Cc1ccc(NC(=O)NCCc2ccc3ccccc3c2)c(C)[nH+]1 ZINC000447169907 338546815 /nfs/dbraw/zinc/54/68/15/338546815.db2.gz XSEVPAFNWXLHBW-UHFFFAOYSA-N 1 2 319.408 4.216 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)c(C)[nH+]1 ZINC000447176307 338546896 /nfs/dbraw/zinc/54/68/96/338546896.db2.gz MVKFFSSFEGBALE-ARFHVFGLSA-N 1 2 301.434 4.179 20 0 DIADLO CC(C)(C)c1csc(COc2cccc(-n3cc[nH+]c3)c2)n1 ZINC000447368974 338550757 /nfs/dbraw/zinc/55/07/57/338550757.db2.gz ROWDRGIGSHMFIT-UHFFFAOYSA-N 1 2 313.426 4.205 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2ncc(C(C)(C)C)s2)C2CC2)s1 ZINC000447944618 338572471 /nfs/dbraw/zinc/57/24/71/338572471.db2.gz SCIMTEIABQRFKJ-AWEZNQCLSA-N 1 2 321.515 4.446 20 0 DIADLO Cc1cccc(C[NH2+][C@@H](COCC(C)C)c2ccco2)c1F ZINC000449106077 338594092 /nfs/dbraw/zinc/59/40/92/338594092.db2.gz GFLPJXMFXIAFIO-INIZCTEOSA-N 1 2 305.393 4.231 20 0 DIADLO Cn1cc[nH+]c1[C@@H]1N(Cc2ccccc2C(F)(F)F)CC1(C)C ZINC000449410780 338621918 /nfs/dbraw/zinc/62/19/18/338621918.db2.gz AJPJWCHEXUWYAD-AWEZNQCLSA-N 1 2 323.362 4.022 20 0 DIADLO CCN(C)c1ccc(CNc2ccccc2C(C)(F)F)c[nH+]1 ZINC000449472700 338628176 /nfs/dbraw/zinc/62/81/76/338628176.db2.gz QJAZDDYCMIKFIZ-UHFFFAOYSA-N 1 2 305.372 4.262 20 0 DIADLO CSCc1cnc(C[NH+]2CC(c3ccc(Cl)cc3)C2)s1 ZINC000449557695 338637505 /nfs/dbraw/zinc/63/75/05/338637505.db2.gz SFBMLBSTUHRLNN-UHFFFAOYSA-N 1 2 324.902 4.259 20 0 DIADLO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3)cc2F)c2nccn21 ZINC000449574283 338639321 /nfs/dbraw/zinc/63/93/21/338639321.db2.gz UILDVUFTTOYOHJ-LIRRHRJNSA-N 1 2 321.399 4.485 20 0 DIADLO CCc1ncc(C[NH2+]Cc2cc(C(F)(F)F)ccc2Cl)o1 ZINC000449609571 338640663 /nfs/dbraw/zinc/64/06/63/338640663.db2.gz NRHDDIOEOYOSRI-UHFFFAOYSA-N 1 2 318.726 4.199 20 0 DIADLO COc1cccc2c1cc[nH+]c2N[C@H]1CCCC12CCOCC2 ZINC000450507291 338688545 /nfs/dbraw/zinc/68/85/45/338688545.db2.gz QNDUBHTVSGEUEB-KRWDZBQOSA-N 1 2 312.413 4.005 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ncc(-c2ccccc2)o1 ZINC000451182483 338725027 /nfs/dbraw/zinc/72/50/27/338725027.db2.gz XQMLZWPAVZWQDD-SUMWQHHRSA-N 1 2 320.392 4.385 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)o1 ZINC000451351507 338730738 /nfs/dbraw/zinc/73/07/38/338730738.db2.gz FMHGFDIMOOXAEB-OAHLLOKOSA-N 1 2 323.799 4.226 20 0 DIADLO COc1ccc(OC)c([C@@H](C)[NH2+]Cc2c(F)cccc2Cl)c1 ZINC000194809234 338760084 /nfs/dbraw/zinc/76/00/84/338760084.db2.gz SGSYMEBHYAYYSS-LLVKDONJSA-N 1 2 323.795 4.347 20 0 DIADLO Cc1c(C(=O)Nc2c[nH+]c3n2CCCC3)oc2c1c(C)ccc2C ZINC000452336183 338764084 /nfs/dbraw/zinc/76/40/84/338764084.db2.gz UNINGCNUZSCBQR-UHFFFAOYSA-N 1 2 323.396 4.143 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@H](C)c1cccc(O)c1)c1ccco1 ZINC000194876522 338772284 /nfs/dbraw/zinc/77/22/84/338772284.db2.gz BTQNBHNDQGLBIE-RHSMWYFYSA-N 1 2 303.402 4.050 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@H](C)c1cccc(O)c1)c1ccco1 ZINC000194876512 338772348 /nfs/dbraw/zinc/77/23/48/338772348.db2.gz BTQNBHNDQGLBIE-PBHICJAKSA-N 1 2 303.402 4.050 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CNc1cccc(C[S@@](C)=O)c1 ZINC000453076943 338790863 /nfs/dbraw/zinc/79/08/63/338790863.db2.gz ARSPAKLNHFUPQT-JOCHJYFZSA-N 1 2 316.470 4.004 20 0 DIADLO CC(C)CCn1ncc(N[C@H]2C[C@@H](C)n3cc[nH+]c32)c1C(C)C ZINC000453209003 338808209 /nfs/dbraw/zinc/80/82/09/338808209.db2.gz KXDJLGPQCBHGLS-CABCVRRESA-N 1 2 315.465 4.367 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1ccc(OC)c(Br)c1)C(F)F ZINC000453231982 338811575 /nfs/dbraw/zinc/81/15/75/338811575.db2.gz FVTCPEPJLJAXLD-LDYMZIIASA-N 1 2 322.193 4.152 20 0 DIADLO CC[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1cc(Cl)ccc1OC ZINC000453361290 338831503 /nfs/dbraw/zinc/83/15/03/338831503.db2.gz QUAJKQKHVQNLCO-UGFHNGPFSA-N 1 2 319.836 4.292 20 0 DIADLO C[C@H](CC(C)(C)C)NC(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000454714556 338870387 /nfs/dbraw/zinc/87/03/87/338870387.db2.gz FVURSFHYSAOHMX-CYBMUJFWSA-N 1 2 314.433 4.033 20 0 DIADLO Cc1ccc(NC(=O)N2[C@H](C)C[C@@H](c3ccccc3)[C@H]2C)c(C)[nH+]1 ZINC000455047042 338879604 /nfs/dbraw/zinc/87/96/04/338879604.db2.gz OVODRHHSKFBWPY-QGPMSJSTSA-N 1 2 323.440 4.497 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@H](C)c2ccccc2F)c(C)[nH+]1 ZINC000455478852 338895808 /nfs/dbraw/zinc/89/58/08/338895808.db2.gz MYWXRPGGLDEXNN-CQSZACIVSA-N 1 2 315.392 4.371 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC[C@@H](C)c2ccccc2)c(C)[nH+]1 ZINC000455489091 338896270 /nfs/dbraw/zinc/89/62/70/338896270.db2.gz VJHCIFINVNERMO-CYBMUJFWSA-N 1 2 311.429 4.322 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCCC3(CCCC3)C2)c(C)[nH+]1 ZINC000455543035 338898388 /nfs/dbraw/zinc/89/83/88/338898388.db2.gz ZRRCHKGLJVTLHE-UHFFFAOYSA-N 1 2 301.434 4.195 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456360818 338927650 /nfs/dbraw/zinc/92/76/50/338927650.db2.gz DGZAVOBBMNRVNV-IMJJTQAJSA-N 1 2 303.450 4.002 20 0 DIADLO CC(C)[C@H](CC1CCCCC1)C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456377482 338928167 /nfs/dbraw/zinc/92/81/67/338928167.db2.gz KZGGUUAQVZXIIC-PVAVHDDUSA-N 1 2 317.477 4.248 20 0 DIADLO CCCCCN(C(=O)N[C@@H](C)c1[nH+]ccn1CC)[C@H](C)CCC ZINC000459053754 339012256 /nfs/dbraw/zinc/01/22/56/339012256.db2.gz HKQKGXYJFZTXEH-CVEARBPZSA-N 1 2 322.497 4.354 20 0 DIADLO c1coc(C[N@H+](Cc2ccccc2)Cc2cnc(C3CC3)nc2)c1 ZINC000459280150 339018999 /nfs/dbraw/zinc/01/89/99/339018999.db2.gz ATOXNVPXDAIBKH-UHFFFAOYSA-N 1 2 319.408 4.149 20 0 DIADLO c1coc(C[N@@H+](Cc2ccccc2)Cc2cnc(C3CC3)nc2)c1 ZINC000459280150 339019000 /nfs/dbraw/zinc/01/90/00/339019000.db2.gz ATOXNVPXDAIBKH-UHFFFAOYSA-N 1 2 319.408 4.149 20 0 DIADLO CC(C)OC1CC([N@@H+]2CCc3[nH]c4ccc(Cl)cc4c3C2)C1 ZINC000459367565 339025019 /nfs/dbraw/zinc/02/50/19/339025019.db2.gz MJXNWVMMIYKESZ-UHFFFAOYSA-N 1 2 318.848 4.135 20 0 DIADLO CC(C)OC1CC([N@H+]2CCc3[nH]c4ccc(Cl)cc4c3C2)C1 ZINC000459367565 339025020 /nfs/dbraw/zinc/02/50/20/339025020.db2.gz MJXNWVMMIYKESZ-UHFFFAOYSA-N 1 2 318.848 4.135 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NCc2cc(C)on2)c1 ZINC000459369598 339025111 /nfs/dbraw/zinc/02/51/11/339025111.db2.gz ZDVOGGDRUFYMMR-UHFFFAOYSA-N 1 2 310.401 4.259 20 0 DIADLO COCc1cc(C[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)no1 ZINC000459405467 339027323 /nfs/dbraw/zinc/02/73/23/339027323.db2.gz KIBWBZAEOHWNRF-ZDUSSCGKSA-N 1 2 320.458 4.172 20 0 DIADLO COc1ccc(NC(=O)Nc2c(C)cc[nH+]c2C)cc1SC ZINC000459550299 339035151 /nfs/dbraw/zinc/03/51/51/339035151.db2.gz IDZBXBOQJCHUNB-UHFFFAOYSA-N 1 2 317.414 4.073 20 0 DIADLO FCC(CF)[NH2+]C/C=C\c1ccc(OCc2ccccc2)cc1 ZINC000459573106 339036775 /nfs/dbraw/zinc/03/67/75/339036775.db2.gz ROJHDLBHOHYKPQ-DAXSKMNVSA-N 1 2 317.379 4.176 20 0 DIADLO CCCn1c(C)nnc1C[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459589356 339037598 /nfs/dbraw/zinc/03/75/98/339037598.db2.gz YKVQVYSXSYTMAX-IBGZPJMESA-N 1 2 324.472 4.114 20 0 DIADLO CCCn1c(C)nnc1C[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459589356 339037599 /nfs/dbraw/zinc/03/75/99/339037599.db2.gz YKVQVYSXSYTMAX-IBGZPJMESA-N 1 2 324.472 4.114 20 0 DIADLO CC1(CC(F)(F)F)C[NH+](Cc2ccccc2OC(F)F)C1 ZINC000459632087 339039284 /nfs/dbraw/zinc/03/92/84/339039284.db2.gz DMSUAOVNJANNEL-UHFFFAOYSA-N 1 2 309.278 4.062 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2c1c(F)ccc2F)c1nc2c(s1)CCC2 ZINC000459630669 339039388 /nfs/dbraw/zinc/03/93/88/339039388.db2.gz IYLZKSORPTVTIK-OTYXRUKQSA-N 1 2 320.408 4.248 20 0 DIADLO COc1ccc(Cl)c(C[NH2+][C@@H](C)c2nc3c(s2)CCC3)c1 ZINC000459634846 339039468 /nfs/dbraw/zinc/03/94/68/339039468.db2.gz SSOPCSDVRBGKOU-JTQLQIEISA-N 1 2 322.861 4.145 20 0 DIADLO CC1(CC(F)(F)F)C[NH+](Cc2cc3ccc(F)cc3[nH]2)C1 ZINC000459637760 339039719 /nfs/dbraw/zinc/03/97/19/339039719.db2.gz MBAQENKGTLOFGP-UHFFFAOYSA-N 1 2 300.299 4.081 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1nc2ccc(F)cc2o1 ZINC000459683697 339042974 /nfs/dbraw/zinc/04/29/74/339042974.db2.gz BCNDSTXMZXVAEV-LBPRGKRZSA-N 1 2 314.360 4.135 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)nn1 ZINC000459725128 339044529 /nfs/dbraw/zinc/04/45/29/339044529.db2.gz XELPNLFKJLNOMV-IBGZPJMESA-N 1 2 324.472 4.366 20 0 DIADLO CC(C)n1cc(C[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)nn1 ZINC000459725128 339044530 /nfs/dbraw/zinc/04/45/30/339044530.db2.gz XELPNLFKJLNOMV-IBGZPJMESA-N 1 2 324.472 4.366 20 0 DIADLO Cc1nc([C@H](C)[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)no1 ZINC000459744844 339045689 /nfs/dbraw/zinc/04/56/89/339045689.db2.gz MKELKERVYMLGNF-WMLDXEAASA-N 1 2 311.429 4.446 20 0 DIADLO Cc1nc([C@H](C)[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)no1 ZINC000459744844 339045690 /nfs/dbraw/zinc/04/56/90/339045690.db2.gz MKELKERVYMLGNF-WMLDXEAASA-N 1 2 311.429 4.446 20 0 DIADLO CCCCC[S@](=O)CCCCCn1c(C)[nH+]c2ccccc21 ZINC000461798383 339067284 /nfs/dbraw/zinc/06/72/84/339067284.db2.gz SLSDMONPYZPVHQ-QFIPXVFZSA-N 1 2 320.502 4.454 20 0 DIADLO CCOc1ccc([C@H](Nc2cc[nH+]c(C)n2)c2ccccc2)cc1 ZINC000462373154 339077200 /nfs/dbraw/zinc/07/72/00/339077200.db2.gz VHYYFXRIRQJOGC-HXUWFJFHSA-N 1 2 319.408 4.385 20 0 DIADLO Cc1nc(N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cc[nH+]1 ZINC000462779786 339088206 /nfs/dbraw/zinc/08/82/06/339088206.db2.gz UZDKWKYUBXCIET-AWEZNQCLSA-N 1 2 308.212 4.433 20 0 DIADLO Oc1cccc2c1CCC[C@H]2Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000462797175 339089352 /nfs/dbraw/zinc/08/93/52/339089352.db2.gz BOZCXFDGXVOJRH-GOSISDBHSA-N 1 2 323.440 4.267 20 0 DIADLO Cc1ccc2[nH+]c(CN[C@@H](c3ccccc3)C(F)(F)F)cn2c1 ZINC000462810512 339090860 /nfs/dbraw/zinc/09/08/60/339090860.db2.gz DBDJLCDFNHLYFP-INIZCTEOSA-N 1 2 319.330 4.036 20 0 DIADLO c1cc2c(cccc2C[N@@H+]2CCn3c(cc4ccccc43)C2)[nH]1 ZINC000462824767 339092375 /nfs/dbraw/zinc/09/23/75/339092375.db2.gz HFLJXZJGIIWPFD-UHFFFAOYSA-N 1 2 301.393 4.138 20 0 DIADLO c1cc2c(cccc2C[N@H+]2CCn3c(cc4ccccc43)C2)[nH]1 ZINC000462824767 339092376 /nfs/dbraw/zinc/09/23/76/339092376.db2.gz HFLJXZJGIIWPFD-UHFFFAOYSA-N 1 2 301.393 4.138 20 0 DIADLO c1cc2cccc(C[N@@H+]3CCn4c(cc5ccccc54)C3)c2[nH]1 ZINC000462828175 339092786 /nfs/dbraw/zinc/09/27/86/339092786.db2.gz URRWNBNEHAEWOT-UHFFFAOYSA-N 1 2 301.393 4.138 20 0 DIADLO c1cc2cccc(C[N@H+]3CCn4c(cc5ccccc54)C3)c2[nH]1 ZINC000462828175 339092787 /nfs/dbraw/zinc/09/27/87/339092787.db2.gz URRWNBNEHAEWOT-UHFFFAOYSA-N 1 2 301.393 4.138 20 0 DIADLO CCCC[C@H](COC)Nc1ccc(-n2c[nH+]c(C)c2C)cc1 ZINC000463009767 339100272 /nfs/dbraw/zinc/10/02/72/339100272.db2.gz JTNXPHFKFVZBKY-QGZVFWFLSA-N 1 2 301.434 4.106 20 0 DIADLO CC(C)C[C@H](C)CC(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000463031248 339101825 /nfs/dbraw/zinc/10/18/25/339101825.db2.gz FJWSIRFZMVBFAS-JKSUJKDBSA-N 1 2 322.518 4.026 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@@H]3CS[C@@H](C(C)C)C3)cc2)c1C ZINC000463032665 339101942 /nfs/dbraw/zinc/10/19/42/339101942.db2.gz ISJBSIXOKFRGTO-FUHWJXTLSA-N 1 2 315.486 4.431 20 0 DIADLO CCCC(CCC)C(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000463035682 339102083 /nfs/dbraw/zinc/10/20/83/339102083.db2.gz IVXFGDMMEOBVTR-OAHLLOKOSA-N 1 2 322.518 4.170 20 0 DIADLO CC[C@H](CC(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1)C(C)C ZINC000463040384 339102751 /nfs/dbraw/zinc/10/27/51/339102751.db2.gz VGRWTNUDDNMRJY-HZPDHXFCSA-N 1 2 322.518 4.026 20 0 DIADLO CCC[C@@H](C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1)C(C)C ZINC000463044815 339102833 /nfs/dbraw/zinc/10/28/33/339102833.db2.gz SYAGIOSOMIWSBK-DOTOQJQBSA-N 1 2 322.518 4.026 20 0 DIADLO Cc1cc(N2C[C@@H](C)C[C@@H]2c2cccc(F)c2)nc(C2CC2)[nH+]1 ZINC000463077353 339104772 /nfs/dbraw/zinc/10/47/72/339104772.db2.gz OOWJNAXKHBXWHA-YVEFUNNKSA-N 1 2 311.404 4.389 20 0 DIADLO Cc1cc(N2C[C@H](C)C[C@H]2c2cccc(F)c2)nc(C2CC2)[nH+]1 ZINC000463077350 339104781 /nfs/dbraw/zinc/10/47/81/339104781.db2.gz OOWJNAXKHBXWHA-PXAZEXFGSA-N 1 2 311.404 4.389 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cncc(C(F)(F)F)c2)[C@H]1c1ccccc1 ZINC000463098731 339105698 /nfs/dbraw/zinc/10/56/98/339105698.db2.gz ZRKYTHCKYKLJQN-MLGOLLRUSA-N 1 2 306.331 4.293 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cncc(C(F)(F)F)c2)[C@H]1c1ccccc1 ZINC000463098731 339105699 /nfs/dbraw/zinc/10/56/99/339105699.db2.gz ZRKYTHCKYKLJQN-MLGOLLRUSA-N 1 2 306.331 4.293 20 0 DIADLO FC(F)C1([NH2+]Cc2cncc(C(F)(F)F)c2)CCCCC1 ZINC000463204726 339109272 /nfs/dbraw/zinc/10/92/72/339109272.db2.gz OEVFLEVDHTXNGB-UHFFFAOYSA-N 1 2 308.294 4.158 20 0 DIADLO CC(C)[C@@H](C)SCc1cn2cc(Br)ccc2[nH+]1 ZINC000463231667 339110705 /nfs/dbraw/zinc/11/07/05/339110705.db2.gz NPRUMVHYMXAODP-SNVBAGLBSA-N 1 2 313.264 4.375 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NC(=O)CCCC2CCCC2)c1 ZINC000463294996 339113861 /nfs/dbraw/zinc/11/38/61/339113861.db2.gz XETNOHSBBWATOG-UHFFFAOYSA-N 1 2 311.429 4.386 20 0 DIADLO COc1cccc([C@@H](C)[N@@H+]2CCn3c(cc4ccccc43)C2)c1 ZINC000463416621 339117040 /nfs/dbraw/zinc/11/70/40/339117040.db2.gz MHXUXYRBXZTZSB-OAHLLOKOSA-N 1 2 306.409 4.227 20 0 DIADLO COc1cccc([C@@H](C)[N@H+]2CCn3c(cc4ccccc43)C2)c1 ZINC000463416621 339117041 /nfs/dbraw/zinc/11/70/41/339117041.db2.gz MHXUXYRBXZTZSB-OAHLLOKOSA-N 1 2 306.409 4.227 20 0 DIADLO Cc1nc(N2CCc3cc(Cl)c(Cl)cc3[C@H]2C)cc[nH+]1 ZINC000463476008 339119151 /nfs/dbraw/zinc/11/91/51/339119151.db2.gz NGUGAMNPKXQXJG-SECBINFHSA-N 1 2 308.212 4.216 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nc(-c3ccccc3)no2)[C@@H](c2ccco2)C1 ZINC000464854255 339158196 /nfs/dbraw/zinc/15/81/96/339158196.db2.gz OENDRKBKKUYXAM-GDBMZVCRSA-N 1 2 323.396 4.303 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nc(-c3ccccc3)no2)[C@@H](c2ccco2)C1 ZINC000464854255 339158197 /nfs/dbraw/zinc/15/81/97/339158197.db2.gz OENDRKBKKUYXAM-GDBMZVCRSA-N 1 2 323.396 4.303 20 0 DIADLO CC(C)CCc1noc(C[N@@H+]2CC[C@H](C)C[C@H]2c2ccco2)n1 ZINC000464863099 339158729 /nfs/dbraw/zinc/15/87/29/339158729.db2.gz ZOPWAMDQUKIWKO-GJZGRUSLSA-N 1 2 317.433 4.224 20 0 DIADLO CC(C)CCc1noc(C[N@H+]2CC[C@H](C)C[C@H]2c2ccco2)n1 ZINC000464863099 339158730 /nfs/dbraw/zinc/15/87/30/339158730.db2.gz ZOPWAMDQUKIWKO-GJZGRUSLSA-N 1 2 317.433 4.224 20 0 DIADLO Cc1cc(NC[C@@]2(C)CCO[C@@H]2C2CC2)c2cccc(F)c2[nH+]1 ZINC000466630784 339211059 /nfs/dbraw/zinc/21/10/59/339211059.db2.gz KMIXRWIIRNVZTR-RTBURBONSA-N 1 2 314.404 4.299 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1nc2ccc(F)cc2o1 ZINC000466813950 339217883 /nfs/dbraw/zinc/21/78/83/339217883.db2.gz QHSQOJWCTXFISA-SNVBAGLBSA-N 1 2 302.374 4.148 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1nc2ccc(F)cc2o1 ZINC000466813950 339217884 /nfs/dbraw/zinc/21/78/84/339217884.db2.gz QHSQOJWCTXFISA-SNVBAGLBSA-N 1 2 302.374 4.148 20 0 DIADLO COC(=O)[C@@H](c1ccccc1C)[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000466829577 339218450 /nfs/dbraw/zinc/21/84/50/339218450.db2.gz WGPQWSMFEBFDDQ-IAGOWNOFSA-N 1 2 315.438 4.108 20 0 DIADLO COC(=O)[C@@H](c1ccccc1C)[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000466829577 339218451 /nfs/dbraw/zinc/21/84/51/339218451.db2.gz WGPQWSMFEBFDDQ-IAGOWNOFSA-N 1 2 315.438 4.108 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCc4c(Cl)cccc4C3)oc2c1 ZINC000466962276 339222847 /nfs/dbraw/zinc/22/28/47/339222847.db2.gz CCMGNHDVIBNYFC-UHFFFAOYSA-N 1 2 316.763 4.179 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCc4c(Cl)cccc4C3)oc2c1 ZINC000466962276 339222848 /nfs/dbraw/zinc/22/28/48/339222848.db2.gz CCMGNHDVIBNYFC-UHFFFAOYSA-N 1 2 316.763 4.179 20 0 DIADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@H](Nc2ccc3n[nH]cc3c2)C1 ZINC000467352936 339233404 /nfs/dbraw/zinc/23/34/04/339233404.db2.gz IQUBAAZBFQPJJY-ZBFHGGJFSA-N 1 2 306.413 4.405 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@H](CO)c2cccc(Cl)c2F)o1 ZINC000467415500 339237409 /nfs/dbraw/zinc/23/74/09/339237409.db2.gz YPUAUJDVGPOERJ-IINYFYTJSA-N 1 2 311.784 4.019 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)cc1F ZINC000467742526 339245303 /nfs/dbraw/zinc/24/53/03/339245303.db2.gz WACKVAAACKTWRO-VIFPVBQESA-N 1 2 318.339 4.460 20 0 DIADLO FC(F)Oc1ccccc1COc1cccc(-n2cc[nH+]c2)c1 ZINC000467787673 339246714 /nfs/dbraw/zinc/24/67/14/339246714.db2.gz KLMYJQGLGOURCL-UHFFFAOYSA-N 1 2 316.307 4.053 20 0 DIADLO C[C@H](C(=O)Nc1ccc[nH+]c1N(C)C)c1ccc2ccccc2c1 ZINC000467931116 339249580 /nfs/dbraw/zinc/24/95/80/339249580.db2.gz VMCUUOMMVKXZPW-AWEZNQCLSA-N 1 2 319.408 4.043 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@H](c3cccc(Cl)c3)C2)o1 ZINC000468698288 339269104 /nfs/dbraw/zinc/26/91/04/339269104.db2.gz IBKOLQFAVXMSFI-KRWDZBQOSA-N 1 2 305.805 4.069 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@H](c3cccc(Cl)c3)C2)o1 ZINC000468698288 339269105 /nfs/dbraw/zinc/26/91/05/339269105.db2.gz IBKOLQFAVXMSFI-KRWDZBQOSA-N 1 2 305.805 4.069 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC(C(F)F)CC1 ZINC000468713882 339269314 /nfs/dbraw/zinc/26/93/14/339269314.db2.gz ILYZDQVUZRMUQN-UHFFFAOYSA-N 1 2 306.356 4.033 20 0 DIADLO CCC(CC)CC(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC000468776929 339270615 /nfs/dbraw/zinc/27/06/15/339270615.db2.gz BMEJLWWVCULPRT-CYBMUJFWSA-N 1 2 323.506 4.140 20 0 DIADLO CCC(CC)CC(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000468776929 339270616 /nfs/dbraw/zinc/27/06/16/339270616.db2.gz BMEJLWWVCULPRT-CYBMUJFWSA-N 1 2 323.506 4.140 20 0 DIADLO CC(C)CO[C@H]1CC[N@H+](Cc2csc(C3CCCCC3)n2)C1 ZINC000469093432 339279876 /nfs/dbraw/zinc/27/98/76/339279876.db2.gz WIYRBTRGWVGRNZ-KRWDZBQOSA-N 1 2 322.518 4.438 20 0 DIADLO CC(C)CO[C@H]1CC[N@@H+](Cc2csc(C3CCCCC3)n2)C1 ZINC000469093432 339279877 /nfs/dbraw/zinc/27/98/77/339279877.db2.gz WIYRBTRGWVGRNZ-KRWDZBQOSA-N 1 2 322.518 4.438 20 0 DIADLO Cc1[nH+]c2ccccn2c1CN1CCCSc2ccccc21 ZINC000469121234 339280780 /nfs/dbraw/zinc/28/07/80/339280780.db2.gz YTVPAHUQBMFUOB-UHFFFAOYSA-N 1 2 309.438 4.145 20 0 DIADLO COC(C)(C)CC[NH2+]c1ccc(C)cc1OCC(F)(F)F ZINC000469327729 339286247 /nfs/dbraw/zinc/28/62/47/339286247.db2.gz ZZMMTAMFEKIPOY-UHFFFAOYSA-N 1 2 305.340 4.163 20 0 DIADLO Cc1[nH+]c2ccccn2c1CN(Cc1ccco1)c1ccccc1 ZINC000469334507 339286279 /nfs/dbraw/zinc/28/62/79/339286279.db2.gz WCGUNGCTJIHGQY-UHFFFAOYSA-N 1 2 317.392 4.443 20 0 DIADLO CCC1(CC)C[N@@H+]([C@@H](C)c2cccc(Cl)c2)CC[S@]1=O ZINC000469443240 339289418 /nfs/dbraw/zinc/28/94/18/339289418.db2.gz UHIIMNJRBVHWEP-RNODOKPDSA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@H+]([C@@H](C)c2cccc(Cl)c2)CC[S@]1=O ZINC000469443240 339289419 /nfs/dbraw/zinc/28/94/19/339289419.db2.gz UHIIMNJRBVHWEP-RNODOKPDSA-N 1 2 313.894 4.024 20 0 DIADLO Cn1nccc1C[N@@H+]1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000469514956 339292192 /nfs/dbraw/zinc/29/21/92/339292192.db2.gz FBMLZSAUZCGLDV-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1nccc1C[N@H+]1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000469514956 339292193 /nfs/dbraw/zinc/29/21/93/339292193.db2.gz FBMLZSAUZCGLDV-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO CCc1cccc(C[N@H+](C)Cc2nc(C(F)(F)F)cs2)c1 ZINC000469727654 339296915 /nfs/dbraw/zinc/29/69/15/339296915.db2.gz GVXRREGJLGVSHV-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO CCc1cccc(C[N@@H+](C)Cc2nc(C(F)(F)F)cs2)c1 ZINC000469727654 339296916 /nfs/dbraw/zinc/29/69/16/339296916.db2.gz GVXRREGJLGVSHV-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO Fc1ccc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)nc1 ZINC000469758421 339297971 /nfs/dbraw/zinc/29/79/71/339297971.db2.gz QWYPEEVSONRLCH-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Fc1ccc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)nc1 ZINC000469758421 339297972 /nfs/dbraw/zinc/29/79/72/339297972.db2.gz QWYPEEVSONRLCH-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO CCCC(C)(C)CC(=O)N1CCC(CCCn2cc[nH+]c2)CC1 ZINC000469773759 339298705 /nfs/dbraw/zinc/29/87/05/339298705.db2.gz BCIKXZDLQGWXDE-UHFFFAOYSA-N 1 2 319.493 4.118 20 0 DIADLO C[C@@H]1C[N@H+](CCO[C@@H]2CCCC[C@@H]2C)C[C@@H](c2ccsc2)O1 ZINC000470200037 339313992 /nfs/dbraw/zinc/31/39/92/339313992.db2.gz IVZLLPWFLIHYEW-IDCNUPLLSA-N 1 2 323.502 4.105 20 0 DIADLO C[C@@H]1C[N@@H+](CCO[C@@H]2CCCC[C@@H]2C)C[C@@H](c2ccsc2)O1 ZINC000470200037 339313993 /nfs/dbraw/zinc/31/39/93/339313993.db2.gz IVZLLPWFLIHYEW-IDCNUPLLSA-N 1 2 323.502 4.105 20 0 DIADLO CC[C@H](NC(=O)c1ccc(C2CCCCC2)cc1)c1[nH]cc[nH+]1 ZINC000470701114 339325373 /nfs/dbraw/zinc/32/53/73/339325373.db2.gz KXOAYYQCFKEFNL-KRWDZBQOSA-N 1 2 311.429 4.339 20 0 DIADLO FC(F)c1cccc(C[N@@H+]2CCOC[C@H]2c2ccccc2)c1 ZINC000470759112 339326818 /nfs/dbraw/zinc/32/68/18/339326818.db2.gz BQLRZZNHFGRIIE-KRWDZBQOSA-N 1 2 303.352 4.198 20 0 DIADLO FC(F)c1cccc(C[N@H+]2CCOC[C@H]2c2ccccc2)c1 ZINC000470759112 339326819 /nfs/dbraw/zinc/32/68/19/339326819.db2.gz BQLRZZNHFGRIIE-KRWDZBQOSA-N 1 2 303.352 4.198 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@@H+]1C[C@@H](C)O[C@H](C2CC2)C1 ZINC000470910539 339331131 /nfs/dbraw/zinc/33/11/31/339331131.db2.gz ILBUEQUHIXZHQM-HSMVNMDESA-N 1 2 324.262 4.009 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@H+]1C[C@@H](C)O[C@H](C2CC2)C1 ZINC000470910539 339331132 /nfs/dbraw/zinc/33/11/32/339331132.db2.gz ILBUEQUHIXZHQM-HSMVNMDESA-N 1 2 324.262 4.009 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1coc(-c2cccs2)n1 ZINC000470942056 339331947 /nfs/dbraw/zinc/33/19/47/339331947.db2.gz AJFPCNIXPIJBBV-MWLCHTKSSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1coc(-c2cccs2)n1 ZINC000470942056 339331948 /nfs/dbraw/zinc/33/19/48/339331948.db2.gz AJFPCNIXPIJBBV-MWLCHTKSSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1csc(-c2ccoc2)n1 ZINC000470954386 339332674 /nfs/dbraw/zinc/33/26/74/339332674.db2.gz YQNHZUYFSMYXEA-CABZTGNLSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1csc(-c2ccoc2)n1 ZINC000470954386 339332675 /nfs/dbraw/zinc/33/26/75/339332675.db2.gz YQNHZUYFSMYXEA-CABZTGNLSA-N 1 2 316.348 4.176 20 0 DIADLO Cc1ccc(-c2nnc(C[N@H+]3C[C@@H](C)[C@H]3c3ccccc3)o2)cc1 ZINC000471029523 339335085 /nfs/dbraw/zinc/33/50/85/339335085.db2.gz QJMAHCSCFXLYDC-BEFAXECRSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccc(-c2nnc(C[N@@H+]3C[C@@H](C)[C@H]3c3ccccc3)o2)cc1 ZINC000471029523 339335086 /nfs/dbraw/zinc/33/50/86/339335086.db2.gz QJMAHCSCFXLYDC-BEFAXECRSA-N 1 2 319.408 4.238 20 0 DIADLO Brc1csc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000471174522 339339568 /nfs/dbraw/zinc/33/95/68/339339568.db2.gz YJSBTLOGWBTWJQ-CQSZACIVSA-N 1 2 308.244 4.458 20 0 DIADLO Brc1csc(C[N@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000471174522 339339569 /nfs/dbraw/zinc/33/95/69/339339569.db2.gz YJSBTLOGWBTWJQ-CQSZACIVSA-N 1 2 308.244 4.458 20 0 DIADLO CCc1cncc(C(=O)Nc2ccc3[nH]c(C(C)(C)C)[nH+]c3c2)c1 ZINC000471298424 339342209 /nfs/dbraw/zinc/34/22/09/339342209.db2.gz ZWBWBYMSUMQLKC-UHFFFAOYSA-N 1 2 322.412 4.070 20 0 DIADLO COc1ccsc1[C@@H](C)Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000471580289 339348101 /nfs/dbraw/zinc/34/81/01/339348101.db2.gz HNUCANQSENVUAC-CYBMUJFWSA-N 1 2 317.458 4.315 20 0 DIADLO CSc1cccc(C)c1NCc1[nH+]ccn1CC(F)(F)F ZINC000471958219 339358257 /nfs/dbraw/zinc/35/82/57/339358257.db2.gz MEISRAMUDPHKQW-UHFFFAOYSA-N 1 2 315.364 4.088 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(F)c(Cl)c1 ZINC000472070017 339360647 /nfs/dbraw/zinc/36/06/47/339360647.db2.gz MRDGVEAEXKSTLM-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO Clc1cnc(C[NH2+]Cc2ccccc2OC2CCCC2)s1 ZINC000472049366 339360900 /nfs/dbraw/zinc/36/09/00/339360900.db2.gz QPVKAIUXWWYBGD-UHFFFAOYSA-N 1 2 322.861 4.408 20 0 DIADLO Cc1noc(C)c1C(C)C[NH2+]Cc1cc2c(ccc(C)c2C)[nH]1 ZINC000472076329 339362843 /nfs/dbraw/zinc/36/28/43/339362843.db2.gz RWEZDDITCXDBQR-GFCCVEGCSA-N 1 2 311.429 4.283 20 0 DIADLO Fc1cccc(Cl)c1CCC[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000472589776 339374685 /nfs/dbraw/zinc/37/46/85/339374685.db2.gz OQHVIJYMFVAETG-QGZVFWFLSA-N 1 2 323.795 4.078 20 0 DIADLO Fc1cccc(Cl)c1CCC[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000472589776 339374686 /nfs/dbraw/zinc/37/46/86/339374686.db2.gz OQHVIJYMFVAETG-QGZVFWFLSA-N 1 2 323.795 4.078 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CCO[C@H](c4ccccc4)C3)cc2c1C ZINC000473139781 339382401 /nfs/dbraw/zinc/38/24/01/339382401.db2.gz JYNRRYCWLREQTQ-NRFANRHFSA-N 1 2 320.436 4.358 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CCO[C@H](c4ccccc4)C3)cc2c1C ZINC000473139781 339382402 /nfs/dbraw/zinc/38/24/02/339382402.db2.gz JYNRRYCWLREQTQ-NRFANRHFSA-N 1 2 320.436 4.358 20 0 DIADLO Clc1cnc(C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)s1 ZINC000473143411 339382449 /nfs/dbraw/zinc/38/24/49/339382449.db2.gz XTFMBZSQBYYERR-NSHDSACASA-N 1 2 313.253 4.439 20 0 DIADLO Clc1cnc(C[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)s1 ZINC000473143411 339382450 /nfs/dbraw/zinc/38/24/50/339382450.db2.gz XTFMBZSQBYYERR-NSHDSACASA-N 1 2 313.253 4.439 20 0 DIADLO CCn1nc(C[N@H+](C)Cc2ccc(Cl)s2)c2ccccc21 ZINC000473144064 339382659 /nfs/dbraw/zinc/38/26/59/339382659.db2.gz YNBWDFIKROQYEM-UHFFFAOYSA-N 1 2 319.861 4.403 20 0 DIADLO CCn1nc(C[N@@H+](C)Cc2ccc(Cl)s2)c2ccccc21 ZINC000473144064 339382660 /nfs/dbraw/zinc/38/26/60/339382660.db2.gz YNBWDFIKROQYEM-UHFFFAOYSA-N 1 2 319.861 4.403 20 0 DIADLO CC(C)[C@H](NC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1)c1[nH]cc[nH+]1 ZINC000473295974 339384306 /nfs/dbraw/zinc/38/43/06/339384306.db2.gz MKQPDCIBNNOULM-FMKPAKJESA-N 1 2 305.466 4.076 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CC(C)(C)Cc1ccc(Cl)cc1 ZINC000473577266 339388317 /nfs/dbraw/zinc/38/83/17/339388317.db2.gz LZSCAQNLVYUYPE-UHFFFAOYSA-N 1 2 316.832 4.063 20 0 DIADLO CCc1[nH+]c(C)ccc1OCc1ccc(SC)c(OC)c1 ZINC000473679800 339390159 /nfs/dbraw/zinc/39/01/59/339390159.db2.gz IVFJVFBWDUXASM-UHFFFAOYSA-N 1 2 303.427 4.262 20 0 DIADLO Cc1cccc2[nH+]c(CSCCCCOC(C)(C)C)cn21 ZINC000473780539 339391868 /nfs/dbraw/zinc/39/18/68/339391868.db2.gz JWIPSUFZWXGTMQ-UHFFFAOYSA-N 1 2 306.475 4.471 20 0 DIADLO Cc1ccc(CCCNc2cccc(OC(F)(F)F)c2)c[nH+]1 ZINC000474395740 339412356 /nfs/dbraw/zinc/41/23/56/339412356.db2.gz VDEKSMLKHMEKNB-UHFFFAOYSA-N 1 2 310.319 4.333 20 0 DIADLO COc1cccc(C=C2CCN(c3nc(C)[nH+]c(C)c3C)CC2)c1 ZINC000474772379 339425427 /nfs/dbraw/zinc/42/54/27/339425427.db2.gz DJCTYQPUOJZQTN-UHFFFAOYSA-N 1 2 323.440 4.094 20 0 DIADLO CCc1c[nH+]ccc1[C@@H](C)C1CCN(C(=O)C(C)(C)C)CC1 ZINC000498389411 339498852 /nfs/dbraw/zinc/49/88/52/339498852.db2.gz HEZAAUQAANOWAS-AWEZNQCLSA-N 1 2 302.462 4.032 20 0 DIADLO C[C@@H]1CC(C)(C)N(C(=O)c2ccc3[nH+]ccn3c2)c2ccccc21 ZINC000479269560 339530260 /nfs/dbraw/zinc/53/02/60/339530260.db2.gz CJLPSCADOBYBGZ-CQSZACIVSA-N 1 2 319.408 4.267 20 0 DIADLO Cn1cc2c(n1)CCC[C@@H]2Nc1cccc([NH+]2CCCCCC2)c1 ZINC000479432710 339534922 /nfs/dbraw/zinc/53/49/22/339534922.db2.gz RZRSURUGNPVYQI-IBGZPJMESA-N 1 2 324.472 4.290 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@H](CO)c2c(Cl)cccc2Cl)o1 ZINC000479547197 339540464 /nfs/dbraw/zinc/54/04/64/339540464.db2.gz YABZFNZFYIILLD-GXFFZTMASA-N 1 2 314.212 4.279 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@@H](CO)c2c(Cl)cccc2Cl)o1 ZINC000479547196 339540545 /nfs/dbraw/zinc/54/05/45/339540545.db2.gz YABZFNZFYIILLD-GWCFXTLKSA-N 1 2 314.212 4.279 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccc(Cl)cn1 ZINC000480174671 339562140 /nfs/dbraw/zinc/56/21/40/339562140.db2.gz TWYKJRGZGCKIHH-CYBMUJFWSA-N 1 2 316.836 4.293 20 0 DIADLO COc1cccc2c(N3CC[C@H](C(F)(F)F)[C@H]3C)cc[nH+]c12 ZINC000480547696 339576902 /nfs/dbraw/zinc/57/69/02/339576902.db2.gz CUHBLDOAVGNREF-PWSUYJOCSA-N 1 2 310.319 4.021 20 0 DIADLO CO[C@]1(C)CCCN(c2cc(C)[nH+]c3c(F)cccc23)CC1 ZINC000480830678 339588516 /nfs/dbraw/zinc/58/85/16/339588516.db2.gz UGFWGTXGRDERQF-GOSISDBHSA-N 1 2 302.393 4.078 20 0 DIADLO O=C(NCC1CCCC1)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000482115705 339623682 /nfs/dbraw/zinc/62/36/82/339623682.db2.gz VQDIHTOJUYYYIN-UHFFFAOYSA-N 1 2 311.385 4.186 20 0 DIADLO C/C(=C/c1ccccc1)C[NH2+]Cc1noc(-c2ccccc2C)n1 ZINC000483307433 339660758 /nfs/dbraw/zinc/66/07/58/339660758.db2.gz KVEAXZQREGYLDY-QINSGFPZSA-N 1 2 319.408 4.238 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)cn1)c1cc(Cl)sc1Cl ZINC000484825318 339693979 /nfs/dbraw/zinc/69/39/79/339693979.db2.gz VFTFYQXDDLMCJT-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO CC(C)(C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1)C1CC1 ZINC000485380592 339702375 /nfs/dbraw/zinc/70/23/75/339702375.db2.gz GXQBTFUTSBJRAC-UHFFFAOYSA-N 1 2 323.440 4.261 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCc1ccc(-c2ccccc2)o1 ZINC000485478307 339704018 /nfs/dbraw/zinc/70/40/18/339704018.db2.gz UGENINORUSBRDF-UHFFFAOYSA-N 1 2 321.380 4.280 20 0 DIADLO CC[C@@H](C)c1ccccc1OCC(=O)Nc1c(C)cc[nH+]c1C ZINC000485492699 339704461 /nfs/dbraw/zinc/70/44/61/339704461.db2.gz OKGPKLWMWWUBCH-CYBMUJFWSA-N 1 2 312.413 4.229 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCC[C@@H](C(C)C)CC1 ZINC000485628689 339707603 /nfs/dbraw/zinc/70/76/03/339707603.db2.gz HJANYQYAQYSNPS-HZPDHXFCSA-N 1 2 303.450 4.425 20 0 DIADLO FC1=CCCN(c2cc[nH+]c3c(Br)cccc23)C1 ZINC000485974416 339717503 /nfs/dbraw/zinc/71/75/03/339717503.db2.gz GMSSNVWHBDDGDA-UHFFFAOYSA-N 1 2 307.166 4.061 20 0 DIADLO CCOc1cccc(-c2cccc(NCc3cccn3C)[nH+]2)c1 ZINC000486373259 339726180 /nfs/dbraw/zinc/72/61/80/339726180.db2.gz ILIZGMUONRGLIP-UHFFFAOYSA-N 1 2 307.397 4.098 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1cccc2cc[nH]c21)C(=O)OC(C)(C)C ZINC000486450104 339727524 /nfs/dbraw/zinc/72/75/24/339727524.db2.gz UFHFVXRIMFIXBE-INIZCTEOSA-N 1 2 316.445 4.014 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)N(c3cc[nH+]c4ccncc43)C2)cc1 ZINC000486475460 339727993 /nfs/dbraw/zinc/72/79/93/339727993.db2.gz BZSWNXYFJDRFKU-WBVHZDCISA-N 1 2 303.409 4.321 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc(C)c(OC(C)C)c3)n2c1 ZINC000487217160 339746641 /nfs/dbraw/zinc/74/66/41/339746641.db2.gz RGAAQXNQKPPPPV-UHFFFAOYSA-N 1 2 309.413 4.350 20 0 DIADLO c1ccc(COc2cncc(C[NH+]3Cc4ccccc4C3)c2)cc1 ZINC000487919033 339765809 /nfs/dbraw/zinc/76/58/09/339765809.db2.gz OUZRSUCBDKQDNT-UHFFFAOYSA-N 1 2 316.404 4.176 20 0 DIADLO CC(C)(C)[C@H]1C[C@H](Nc2ccc(-n3cc[nH+]c3)c(F)c2)CS1 ZINC000488314720 339776727 /nfs/dbraw/zinc/77/67/27/339776727.db2.gz CCDFMABAJPLLHH-XJKSGUPXSA-N 1 2 319.449 4.344 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000488789552 339793582 /nfs/dbraw/zinc/79/35/82/339793582.db2.gz VAVYTYLLGKRXCC-VYDXJSESSA-N 1 2 323.440 4.063 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c(C)n1 ZINC000490061359 339824907 /nfs/dbraw/zinc/82/49/07/339824907.db2.gz KLJIQYZHPZPMNE-JTQLQIEISA-N 1 2 315.364 4.025 20 0 DIADLO CCOC(=O)[C@H]([NH2+][C@H](C)CCCC(F)(F)F)c1ccccc1 ZINC000492440866 339900702 /nfs/dbraw/zinc/90/07/02/339900702.db2.gz NENPYKRPJNLAGH-TZMCWYRMSA-N 1 2 317.351 4.002 20 0 DIADLO FC(F)[C@@H](CCc1ccccc1)[NH2+][C@H](c1cccnc1)C1CC1 ZINC000498765968 340022894 /nfs/dbraw/zinc/02/28/94/340022894.db2.gz DYRIXNIIHLEUJJ-MSOLQXFVSA-N 1 2 316.395 4.389 20 0 DIADLO FC(F)[C@H](CCc1ccccc1)[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000498765971 340022978 /nfs/dbraw/zinc/02/29/78/340022978.db2.gz DYRIXNIIHLEUJJ-ZWKOTPCHSA-N 1 2 316.395 4.389 20 0 DIADLO Cc1cc(N(Cc2ccccc2)Cc2ccc(F)cc2)nc[nH+]1 ZINC000498990556 340027511 /nfs/dbraw/zinc/02/75/11/340027511.db2.gz SOMNRMNTZKJSCN-UHFFFAOYSA-N 1 2 307.372 4.131 20 0 DIADLO COc1ccc(CC[N@@H+](Cc2ccccc2)CC(F)F)cc1 ZINC000499124628 340030326 /nfs/dbraw/zinc/03/03/26/340030326.db2.gz AVCQEJQZJRCMAQ-UHFFFAOYSA-N 1 2 305.368 4.005 20 0 DIADLO COc1ccc(CC[N@H+](Cc2ccccc2)CC(F)F)cc1 ZINC000499124628 340030327 /nfs/dbraw/zinc/03/03/27/340030327.db2.gz AVCQEJQZJRCMAQ-UHFFFAOYSA-N 1 2 305.368 4.005 20 0 DIADLO c1ccc2c(c1)[nH]c1c2C[N@H+](Cc2cnc3ccccc3c2)CC1 ZINC000499521880 340038566 /nfs/dbraw/zinc/03/85/66/340038566.db2.gz IOIHQWOJPROTBG-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO c1ccc2c(c1)[nH]c1c2C[N@@H+](Cc2cnc3ccccc3c2)CC1 ZINC000499521880 340038567 /nfs/dbraw/zinc/03/85/67/340038567.db2.gz IOIHQWOJPROTBG-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO OC[C@H]([NH2+]Cc1cc2ccccc2o1)c1cccc(Cl)c1F ZINC000499956938 340047660 /nfs/dbraw/zinc/04/76/60/340047660.db2.gz RXDXLXHBJOFXCO-HNNXBMFYSA-N 1 2 319.763 4.049 20 0 DIADLO CCCCCN(CCCCC)C(=O)Cc1cn2ccccc2[nH+]1 ZINC000500041400 340049083 /nfs/dbraw/zinc/04/90/83/340049083.db2.gz IOCVZLGTELBPBT-UHFFFAOYSA-N 1 2 315.461 4.086 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@@H+]1Cc1c(Cl)cccc1Cl ZINC000500399865 340056718 /nfs/dbraw/zinc/05/67/18/340056718.db2.gz UJEGBFJZUFTQAQ-MRXNPFEDSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@H+]1Cc1c(Cl)cccc1Cl ZINC000500399865 340056719 /nfs/dbraw/zinc/05/67/19/340056719.db2.gz UJEGBFJZUFTQAQ-MRXNPFEDSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@@H+]1Cc1c(Cl)cccc1Cl ZINC000500399864 340056859 /nfs/dbraw/zinc/05/68/59/340056859.db2.gz UJEGBFJZUFTQAQ-INIZCTEOSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@H+]1Cc1c(Cl)cccc1Cl ZINC000500399864 340056860 /nfs/dbraw/zinc/05/68/60/340056860.db2.gz UJEGBFJZUFTQAQ-INIZCTEOSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@@H+]1Cc1ccc(Cl)c(Cl)c1 ZINC000500400916 340057006 /nfs/dbraw/zinc/05/70/06/340057006.db2.gz UMCVMQGTSRVANL-INIZCTEOSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@H+]1Cc1ccc(Cl)c(Cl)c1 ZINC000500400916 340057007 /nfs/dbraw/zinc/05/70/07/340057007.db2.gz UMCVMQGTSRVANL-INIZCTEOSA-N 1 2 324.255 4.454 20 0 DIADLO CCc1cc(OC)ccc1CNc1cccc(-c2[nH+]ccn2C)c1 ZINC000500408061 340057228 /nfs/dbraw/zinc/05/72/28/340057228.db2.gz XBKJIMULOXFTAE-UHFFFAOYSA-N 1 2 321.424 4.270 20 0 DIADLO CCCCOc1ccc(C[NH2+]C2(C(F)F)CC2)cc1OCC ZINC000500483841 340060280 /nfs/dbraw/zinc/06/02/80/340060280.db2.gz GAYZSPWXYUZBMC-UHFFFAOYSA-N 1 2 313.388 4.152 20 0 DIADLO Cc1nc(C[N@H+](C)CCSc2ccc(C)c(C)c2)cs1 ZINC000500479542 340060305 /nfs/dbraw/zinc/06/03/05/340060305.db2.gz PIPPSPLWFUOJGO-UHFFFAOYSA-N 1 2 306.500 4.292 20 0 DIADLO Cc1nc(C[N@@H+](C)CCSc2ccc(C)c(C)c2)cs1 ZINC000500479542 340060306 /nfs/dbraw/zinc/06/03/06/340060306.db2.gz PIPPSPLWFUOJGO-UHFFFAOYSA-N 1 2 306.500 4.292 20 0 DIADLO Cc1cc(C[NH2+]C2(C(F)F)CC2)ccc1Oc1cccnc1 ZINC000500512945 340061351 /nfs/dbraw/zinc/06/13/51/340061351.db2.gz LETSHEFRDIBLAM-UHFFFAOYSA-N 1 2 304.340 4.070 20 0 DIADLO C[C@H]1COC[C@@H](c2ccccc2)[N@@H+]1Cc1ccc2ccccc2n1 ZINC000501029939 340072745 /nfs/dbraw/zinc/07/27/45/340072745.db2.gz UYNWHYFQAZQIHZ-KKSFZXQISA-N 1 2 318.420 4.197 20 0 DIADLO C[C@H]1COC[C@@H](c2ccccc2)[N@H+]1Cc1ccc2ccccc2n1 ZINC000501029939 340072746 /nfs/dbraw/zinc/07/27/46/340072746.db2.gz UYNWHYFQAZQIHZ-KKSFZXQISA-N 1 2 318.420 4.197 20 0 DIADLO C[C@H]1COC[C@H](c2ccccc2)[N@@H+]1Cc1ccc2ccccc2n1 ZINC000501029936 340072762 /nfs/dbraw/zinc/07/27/62/340072762.db2.gz UYNWHYFQAZQIHZ-HRAATJIYSA-N 1 2 318.420 4.197 20 0 DIADLO C[C@H]1COC[C@H](c2ccccc2)[N@H+]1Cc1ccc2ccccc2n1 ZINC000501029936 340072763 /nfs/dbraw/zinc/07/27/63/340072763.db2.gz UYNWHYFQAZQIHZ-HRAATJIYSA-N 1 2 318.420 4.197 20 0 DIADLO CCC[C@@H](C)[N@@H+]1CCO[C@@H](c2cccc(Br)c2)C1 ZINC000501143342 340075051 /nfs/dbraw/zinc/07/50/51/340075051.db2.gz RCRCLTMYXJPZOF-IUODEOHRSA-N 1 2 312.251 4.011 20 0 DIADLO CCC[C@@H](C)[N@H+]1CCO[C@@H](c2cccc(Br)c2)C1 ZINC000501143342 340075052 /nfs/dbraw/zinc/07/50/52/340075052.db2.gz RCRCLTMYXJPZOF-IUODEOHRSA-N 1 2 312.251 4.011 20 0 DIADLO CCC[N@H+](CCOc1ccc(C(F)(F)F)cc1)CC(F)F ZINC000501331056 340078688 /nfs/dbraw/zinc/07/86/88/340078688.db2.gz SIPFZZYVPGZQRJ-UHFFFAOYSA-N 1 2 311.294 4.061 20 0 DIADLO CCC[N@@H+](CCOc1ccc(C(F)(F)F)cc1)CC(F)F ZINC000501331056 340078689 /nfs/dbraw/zinc/07/86/89/340078689.db2.gz SIPFZZYVPGZQRJ-UHFFFAOYSA-N 1 2 311.294 4.061 20 0 DIADLO COCC[C@@H]1CCC[C@@H]1[NH2+]c1ccc(N2CCCC2)cc1C ZINC000502369455 340100926 /nfs/dbraw/zinc/10/09/26/340100926.db2.gz YAMZCGQARBVNKE-LPHOPBHVSA-N 1 2 302.462 4.212 20 0 DIADLO COCC[C@H]1CCC[C@H]1[NH2+]c1ccc(N2CCCC2)cc1C ZINC000502369457 340100952 /nfs/dbraw/zinc/10/09/52/340100952.db2.gz YAMZCGQARBVNKE-VQIMIIECSA-N 1 2 302.462 4.212 20 0 DIADLO COCC[C@@H]1CCC[C@H]1[NH2+]c1ccc(N2CCCC2)cc1C ZINC000502369456 340100987 /nfs/dbraw/zinc/10/09/87/340100987.db2.gz YAMZCGQARBVNKE-QFBILLFUSA-N 1 2 302.462 4.212 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)C1C2CC3CC(C2)CC1C3 ZINC000502408784 340102200 /nfs/dbraw/zinc/10/22/00/340102200.db2.gz DUHKJMZCALFWKH-UHFFFAOYSA-N 1 2 321.424 4.088 20 0 DIADLO CC(C)c1noc([C@H](C)[NH2+][C@@H](c2ccc(F)cc2)C(C)C)n1 ZINC000502488738 340105922 /nfs/dbraw/zinc/10/59/22/340105922.db2.gz SCGIFEXSXIVHHT-SWLSCSKDSA-N 1 2 305.397 4.380 20 0 DIADLO CC[C@@H]1C[C@]1([NH2+]Cc1nc(C(C)(C)C)no1)c1cccc(C)c1 ZINC000502544289 340107362 /nfs/dbraw/zinc/10/73/62/340107362.db2.gz SNHAUPRYVKPDTF-AUUYWEPGSA-N 1 2 313.445 4.091 20 0 DIADLO CCCCc1nc(C[NH2+][C@]2(c3cccc(C)c3)C[C@@H]2CC)no1 ZINC000502552499 340107653 /nfs/dbraw/zinc/10/76/53/340107653.db2.gz QGEOPMROGPMNRW-HNAYVOBHSA-N 1 2 313.445 4.136 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cc2c(s1)CCCC2 ZINC000502576267 340108286 /nfs/dbraw/zinc/10/82/86/340108286.db2.gz MGOIOYZEMSUSHE-UHFFFAOYSA-N 1 2 323.421 4.269 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc2c(c1)CCCC2 ZINC000502747436 340112819 /nfs/dbraw/zinc/11/28/19/340112819.db2.gz KFKOPRAVTVWSSO-UHFFFAOYSA-N 1 2 317.392 4.208 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+]2CC[C@@](F)(c3cc(C)cc(F)c3)C2)o1 ZINC000502887495 340115558 /nfs/dbraw/zinc/11/55/58/340115558.db2.gz MAYHBYZFFGBCNC-GUYCJALGSA-N 1 2 306.356 4.062 20 0 DIADLO Cc1cnc([C@H](C)[N@H+]2CC[C@@](F)(c3cc(C)cc(F)c3)C2)o1 ZINC000502887495 340115559 /nfs/dbraw/zinc/11/55/59/340115559.db2.gz MAYHBYZFFGBCNC-GUYCJALGSA-N 1 2 306.356 4.062 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+]([C@H](C)c2nc(C(C)C)no2)C1 ZINC000502893863 340115863 /nfs/dbraw/zinc/11/58/63/340115863.db2.gz SRHSBEHKUGSWHW-KDOFPFPSSA-N 1 2 317.408 4.133 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+]([C@H](C)c2nc(C(C)C)no2)C1 ZINC000502893863 340115864 /nfs/dbraw/zinc/11/58/64/340115864.db2.gz SRHSBEHKUGSWHW-KDOFPFPSSA-N 1 2 317.408 4.133 20 0 DIADLO CC[C@H](C)[C@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000503037471 340119089 /nfs/dbraw/zinc/11/90/89/340119089.db2.gz GXNJSAYYWDARLS-RYUDHWBXSA-N 1 2 305.809 4.146 20 0 DIADLO c1ccc2sc([C@@H]3COCC[N@H+]3C[C@@H]3CC=CCC3)nc2c1 ZINC000503037883 340119399 /nfs/dbraw/zinc/11/93/99/340119399.db2.gz YPZOSSMGKWCBTO-ZBFHGGJFSA-N 1 2 314.454 4.026 20 0 DIADLO c1ccc2sc([C@@H]3COCC[N@@H+]3C[C@@H]3CC=CCC3)nc2c1 ZINC000503037883 340119400 /nfs/dbraw/zinc/11/94/00/340119400.db2.gz YPZOSSMGKWCBTO-ZBFHGGJFSA-N 1 2 314.454 4.026 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2CC=CCC2)c[nH+]c1N1CCCC[C@@H]1C ZINC000503185274 340122879 /nfs/dbraw/zinc/12/28/79/340122879.db2.gz QWJHZAGJTVVXDO-JKSUJKDBSA-N 1 2 313.445 4.064 20 0 DIADLO CC(=O)c1ccc(Nc2c[nH+]c(N3CCCC[C@H]3C)c(C)c2)nc1 ZINC000503274318 340124529 /nfs/dbraw/zinc/12/45/29/340124529.db2.gz ITBTZXVNRAKSMA-CQSZACIVSA-N 1 2 324.428 4.110 20 0 DIADLO CCCOc1cccc2c(N[C@@H]3C[C@H]4OCCC[C@@H]34)cc[nH+]c12 ZINC000503575673 340131399 /nfs/dbraw/zinc/13/13/99/340131399.db2.gz IJCDZKCNYRHYOV-FDQGKXFDSA-N 1 2 312.413 4.003 20 0 DIADLO Cc1cc(Br)cc2c1[C@H]([NH2+]C1(C(F)F)CC1)CC2 ZINC000503861083 340135368 /nfs/dbraw/zinc/13/53/68/340135368.db2.gz WGUBOVJSNGWBSU-LLVKDONJSA-N 1 2 316.189 4.132 20 0 DIADLO C[C@@H]([NH2+]C1(C(F)F)CC1)c1ccc(SCC(F)F)cc1 ZINC000503868899 340135401 /nfs/dbraw/zinc/13/54/01/340135401.db2.gz CVAFNBWPSCVMJL-SECBINFHSA-N 1 2 307.356 4.492 20 0 DIADLO Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)Nc2cc[nH+]c(C)c2)cc1 ZINC000504161568 340142193 /nfs/dbraw/zinc/14/21/93/340142193.db2.gz FVXVGXSKNSBSIO-KXBFYZLASA-N 1 2 323.440 4.125 20 0 DIADLO Cc1cc(NC(=O)N[C@@H](C)c2cccc(Cl)c2Cl)cc[nH+]1 ZINC000504171500 340142445 /nfs/dbraw/zinc/14/24/45/340142445.db2.gz XXWLHLDYPBXVJI-JTQLQIEISA-N 1 2 324.211 4.001 20 0 DIADLO CCN(Cc1ccc2ccccc2c1)C(=O)Nc1cc[nH+]cc1C ZINC000504177290 340142546 /nfs/dbraw/zinc/14/25/46/340142546.db2.gz PTMQATWGLKMMBZ-UHFFFAOYSA-N 1 2 319.408 4.019 20 0 DIADLO C[NH+](C)[C@@H](c1nc(-c2ccsc2)no1)c1cccc(Cl)c1 ZINC000504235634 340143621 /nfs/dbraw/zinc/14/36/21/340143621.db2.gz KTBFKCKDHUIBJM-CYBMUJFWSA-N 1 2 319.817 4.103 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)[C@@H]1CCCc2ccccc21 ZINC000504677869 340150927 /nfs/dbraw/zinc/15/09/27/340150927.db2.gz QRZGKWDVHGSRAP-MRXNPFEDSA-N 1 2 324.424 4.318 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)[C@H]1CC12CCCCC2 ZINC000504699150 340151357 /nfs/dbraw/zinc/15/13/57/340151357.db2.gz FEGALJQTGNHCHE-CYBMUJFWSA-N 1 2 302.418 4.168 20 0 DIADLO Cc1cc(Cl)cc(C(=O)Nc2c[nH+]ccc2OC(C)(C)C)c1 ZINC000504692645 340151379 /nfs/dbraw/zinc/15/13/79/340151379.db2.gz TVRWFOIZSPENBW-UHFFFAOYSA-N 1 2 318.804 4.473 20 0 DIADLO CC(C)CCc1noc(/C=C\c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000505056225 340160174 /nfs/dbraw/zinc/16/01/74/340160174.db2.gz XAPBRODMVFLLPD-POHAHGRESA-N 1 2 308.385 4.014 20 0 DIADLO Cn1c2ccc(Cl)cc2nc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000505291787 340165784 /nfs/dbraw/zinc/16/57/84/340165784.db2.gz YYKCWMYJVCZLJN-MRXNPFEDSA-N 1 2 311.816 4.174 20 0 DIADLO Cn1c2ccc(Cl)cc2nc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000505291787 340165785 /nfs/dbraw/zinc/16/57/85/340165785.db2.gz YYKCWMYJVCZLJN-MRXNPFEDSA-N 1 2 311.816 4.174 20 0 DIADLO Cc1ccc(NC(=O)N[C@H](c2ccc(F)cc2)C(C)C)c(C)[nH+]1 ZINC000505399793 340167664 /nfs/dbraw/zinc/16/76/64/340167664.db2.gz MUICTAKBZPTDRC-KRWDZBQOSA-N 1 2 315.392 4.356 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1csc(-c2ccc(C)cc2)n1 ZINC000505596729 340172144 /nfs/dbraw/zinc/17/21/44/340172144.db2.gz NFQBNQRIXZVDGX-YOEHRIQHSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1csc(-c2ccc(C)cc2)n1 ZINC000505596729 340172145 /nfs/dbraw/zinc/17/21/45/340172145.db2.gz NFQBNQRIXZVDGX-YOEHRIQHSA-N 1 2 316.470 4.118 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+]3CCn4cccc4[C@@H]3C)s2)cc1 ZINC000505630510 340173503 /nfs/dbraw/zinc/17/35/03/340173503.db2.gz BSVUPXHIAUQGQC-HNNXBMFYSA-N 1 2 323.465 4.497 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+]3CCn4cccc4[C@@H]3C)s2)cc1 ZINC000505630510 340173504 /nfs/dbraw/zinc/17/35/04/340173504.db2.gz BSVUPXHIAUQGQC-HNNXBMFYSA-N 1 2 323.465 4.497 20 0 DIADLO C[N@H+](Cc1ccccc1F)Cc1c(F)cccc1N1CCCC1 ZINC000505635570 340173826 /nfs/dbraw/zinc/17/38/26/340173826.db2.gz KCTDMOLLAXWVGT-UHFFFAOYSA-N 1 2 316.395 4.197 20 0 DIADLO C[N@@H+](Cc1ccccc1F)Cc1c(F)cccc1N1CCCC1 ZINC000505635570 340173827 /nfs/dbraw/zinc/17/38/27/340173827.db2.gz KCTDMOLLAXWVGT-UHFFFAOYSA-N 1 2 316.395 4.197 20 0 DIADLO COc1ccc2ccccc2c1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000505654883 340174257 /nfs/dbraw/zinc/17/42/57/340174257.db2.gz BIJXFDTVZRTVNL-HNNXBMFYSA-N 1 2 306.409 4.227 20 0 DIADLO COc1ccc2ccccc2c1C[N@H+]1CCn2cccc2[C@@H]1C ZINC000505654883 340174258 /nfs/dbraw/zinc/17/42/58/340174258.db2.gz BIJXFDTVZRTVNL-HNNXBMFYSA-N 1 2 306.409 4.227 20 0 DIADLO CC(C)(C)c1[nH]c2ccc(NC(=O)c3occ4c3CCC4)cc2[nH+]1 ZINC000505881671 340180522 /nfs/dbraw/zinc/18/05/22/340180522.db2.gz QATYPZMHYLKXCK-UHFFFAOYSA-N 1 2 323.396 4.194 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)no1 ZINC000505885466 340180801 /nfs/dbraw/zinc/18/08/01/340180801.db2.gz RNSYASQHAYPAGZ-GZKZCVOOSA-N 1 2 311.429 4.090 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)no1 ZINC000505885466 340180802 /nfs/dbraw/zinc/18/08/02/340180802.db2.gz RNSYASQHAYPAGZ-GZKZCVOOSA-N 1 2 311.429 4.090 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nccn2Cc2ccccc2)c(C)c1 ZINC000506017652 340183417 /nfs/dbraw/zinc/18/34/17/340183417.db2.gz TYDOEVYCIHAHOJ-UHFFFAOYSA-N 1 2 319.452 4.180 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nccn2Cc2ccccc2)c(C)c1 ZINC000506017652 340183418 /nfs/dbraw/zinc/18/34/18/340183418.db2.gz TYDOEVYCIHAHOJ-UHFFFAOYSA-N 1 2 319.452 4.180 20 0 DIADLO C[N@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1ccc(Cl)s1 ZINC000506084430 340185218 /nfs/dbraw/zinc/18/52/18/340185218.db2.gz BIPDKEVYRJDXLI-UHFFFAOYSA-N 1 2 317.845 4.424 20 0 DIADLO C[N@@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1ccc(Cl)s1 ZINC000506084430 340185219 /nfs/dbraw/zinc/18/52/19/340185219.db2.gz BIPDKEVYRJDXLI-UHFFFAOYSA-N 1 2 317.845 4.424 20 0 DIADLO C[N@@H+](Cc1c[nH]c(-c2ccccc2)n1)Cc1ccc(Cl)s1 ZINC000506084430 340185220 /nfs/dbraw/zinc/18/52/20/340185220.db2.gz BIPDKEVYRJDXLI-UHFFFAOYSA-N 1 2 317.845 4.424 20 0 DIADLO C[N@H+](Cc1c[nH]c(-c2ccccc2)n1)Cc1ccc(Cl)s1 ZINC000506084430 340185221 /nfs/dbraw/zinc/18/52/21/340185221.db2.gz BIPDKEVYRJDXLI-UHFFFAOYSA-N 1 2 317.845 4.424 20 0 DIADLO C[N@H+](Cc1cc(-c2ccccc2)n[nH]1)Cc1ccc(Cl)s1 ZINC000506101778 340185814 /nfs/dbraw/zinc/18/58/14/340185814.db2.gz TZBUSSKFMBELAU-UHFFFAOYSA-N 1 2 317.845 4.424 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccccc2)n[nH]1)Cc1ccc(Cl)s1 ZINC000506101778 340185815 /nfs/dbraw/zinc/18/58/15/340185815.db2.gz TZBUSSKFMBELAU-UHFFFAOYSA-N 1 2 317.845 4.424 20 0 DIADLO Fc1cccc(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)c1 ZINC000506129576 340186437 /nfs/dbraw/zinc/18/64/37/340186437.db2.gz AEVJFVHLFFNSJV-HXUWFJFHSA-N 1 2 306.384 4.232 20 0 DIADLO Fc1cccc(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)c1 ZINC000506129576 340186438 /nfs/dbraw/zinc/18/64/38/340186438.db2.gz AEVJFVHLFFNSJV-HXUWFJFHSA-N 1 2 306.384 4.232 20 0 DIADLO C[N@H+](Cc1ccc(F)c(F)c1)Cc1cc(F)c(F)cc1F ZINC000506235844 340189540 /nfs/dbraw/zinc/18/95/40/340189540.db2.gz XAVFEIKYFOINQS-UHFFFAOYSA-N 1 2 301.258 4.014 20 0 DIADLO C[N@@H+](Cc1ccc(F)c(F)c1)Cc1cc(F)c(F)cc1F ZINC000506235844 340189541 /nfs/dbraw/zinc/18/95/41/340189541.db2.gz XAVFEIKYFOINQS-UHFFFAOYSA-N 1 2 301.258 4.014 20 0 DIADLO Oc1ccc(C2=CC[N@H+](Cc3cc(F)c(F)cc3F)CC2)cc1 ZINC000506295003 340191342 /nfs/dbraw/zinc/19/13/42/340191342.db2.gz MVTUXXIGIXHXJT-UHFFFAOYSA-N 1 2 319.326 4.099 20 0 DIADLO Oc1ccc(C2=CC[N@@H+](Cc3cc(F)c(F)cc3F)CC2)cc1 ZINC000506295003 340191343 /nfs/dbraw/zinc/19/13/43/340191343.db2.gz MVTUXXIGIXHXJT-UHFFFAOYSA-N 1 2 319.326 4.099 20 0 DIADLO Clc1ccc(C[N@@H+]2CCCN(Cc3ccsc3)CC2)cc1 ZINC000506310118 340191892 /nfs/dbraw/zinc/19/18/92/340191892.db2.gz PTWKLLBNHFAHDF-UHFFFAOYSA-N 1 2 320.889 4.109 20 0 DIADLO Clc1ccc(C[N@H+]2CCCN(Cc3ccsc3)CC2)cc1 ZINC000506310118 340191893 /nfs/dbraw/zinc/19/18/93/340191893.db2.gz PTWKLLBNHFAHDF-UHFFFAOYSA-N 1 2 320.889 4.109 20 0 DIADLO C[N@H+](Cc1nc2ccccc2[nH]1)Cc1ccccc1C(F)(F)F ZINC000506323362 340192103 /nfs/dbraw/zinc/19/21/03/340192103.db2.gz DBKYGKUHJSTNLX-UHFFFAOYSA-N 1 2 319.330 4.214 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2[nH]1)Cc1ccccc1C(F)(F)F ZINC000506323362 340192104 /nfs/dbraw/zinc/19/21/04/340192104.db2.gz DBKYGKUHJSTNLX-UHFFFAOYSA-N 1 2 319.330 4.214 20 0 DIADLO CC(C)Cc1ncc(C[N@H+](C)Cc2ccc(F)cc2F)s1 ZINC000506369089 340193339 /nfs/dbraw/zinc/19/33/39/340193339.db2.gz KNMXSSWARTVKLY-UHFFFAOYSA-N 1 2 310.413 4.252 20 0 DIADLO CC(C)Cc1ncc(C[N@@H+](C)Cc2ccc(F)cc2F)s1 ZINC000506369089 340193340 /nfs/dbraw/zinc/19/33/40/340193340.db2.gz KNMXSSWARTVKLY-UHFFFAOYSA-N 1 2 310.413 4.252 20 0 DIADLO C[C@H]1CCc2nc(C[N@H+](Cc3cccs3)C3CC3)sc2C1 ZINC000506614487 340197696 /nfs/dbraw/zinc/19/76/96/340197696.db2.gz HYKQQRZAGYGMDN-LBPRGKRZSA-N 1 2 318.511 4.494 20 0 DIADLO C[C@H]1CCc2nc(C[N@@H+](Cc3cccs3)C3CC3)sc2C1 ZINC000506614487 340197697 /nfs/dbraw/zinc/19/76/97/340197697.db2.gz HYKQQRZAGYGMDN-LBPRGKRZSA-N 1 2 318.511 4.494 20 0 DIADLO COc1cc(C)[nH+]c(COc2ccnc3c(Cl)cccc23)c1 ZINC000506724688 340200138 /nfs/dbraw/zinc/20/01/38/340200138.db2.gz CXUNKGDBMQEAET-UHFFFAOYSA-N 1 2 314.772 4.179 20 0 DIADLO COc1ccc(OC)c([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)o2)c1 ZINC000506730676 340200361 /nfs/dbraw/zinc/20/03/61/340200361.db2.gz NQAFJHQJAMZFSS-HNNXBMFYSA-N 1 2 321.804 4.287 20 0 DIADLO COc1ccc(OC)c([C@@H]2CCC[N@H+]2Cc2ccc(Cl)o2)c1 ZINC000506730676 340200362 /nfs/dbraw/zinc/20/03/62/340200362.db2.gz NQAFJHQJAMZFSS-HNNXBMFYSA-N 1 2 321.804 4.287 20 0 DIADLO C[N@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1cccc(Cl)c1 ZINC000506805208 340202059 /nfs/dbraw/zinc/20/20/59/340202059.db2.gz LASABIQGAWDLCK-UHFFFAOYSA-N 1 2 311.816 4.362 20 0 DIADLO C[N@@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1cccc(Cl)c1 ZINC000506805208 340202060 /nfs/dbraw/zinc/20/20/60/340202060.db2.gz LASABIQGAWDLCK-UHFFFAOYSA-N 1 2 311.816 4.362 20 0 DIADLO COCc1ccc(C[N@H+](C)Cc2cccc(Cl)c2Cl)o1 ZINC000506807092 340202162 /nfs/dbraw/zinc/20/21/62/340202162.db2.gz QCRDJNORJKPBOT-UHFFFAOYSA-N 1 2 314.212 4.365 20 0 DIADLO COCc1ccc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)o1 ZINC000506807092 340202163 /nfs/dbraw/zinc/20/21/63/340202163.db2.gz QCRDJNORJKPBOT-UHFFFAOYSA-N 1 2 314.212 4.365 20 0 DIADLO C[C@H](C(=O)Nc1ccn2cc[nH+]c2c1)c1ccc2ccccc2c1 ZINC000506889012 340203138 /nfs/dbraw/zinc/20/31/38/340203138.db2.gz CXVMWISOLQBDPB-AWEZNQCLSA-N 1 2 315.376 4.230 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@H]2c2ccsc2)nc1 ZINC000507174533 340211149 /nfs/dbraw/zinc/21/11/49/340211149.db2.gz RZFAHCZWUWARQI-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO CCCN(CC)C(=O)Nc1c[nH+]c(N2CCCC[C@H]2C)c(C)c1 ZINC000506984767 340204664 /nfs/dbraw/zinc/20/46/64/340204664.db2.gz MSOCFACMJACSCJ-OAHLLOKOSA-N 1 2 318.465 4.033 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@H]2c2ccsc2)nc1 ZINC000507174533 340211150 /nfs/dbraw/zinc/21/11/50/340211150.db2.gz RZFAHCZWUWARQI-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2c(F)ccc(O)c2F)c1 ZINC000507077670 340206672 /nfs/dbraw/zinc/20/66/72/340206672.db2.gz MGPOJZGZSABBDG-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2c(F)ccc(O)c2F)c1 ZINC000507077670 340206673 /nfs/dbraw/zinc/20/66/73/340206673.db2.gz MGPOJZGZSABBDG-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO CCOC1CC(CSCc2ccc(-n3cc[nH+]c3)cc2C)C1 ZINC000507116620 340208156 /nfs/dbraw/zinc/20/81/56/340208156.db2.gz MOXVESFENQVTQQ-UHFFFAOYSA-N 1 2 316.470 4.229 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@@H]2c2ccsc2)nc1 ZINC000507174534 340211142 /nfs/dbraw/zinc/21/11/42/340211142.db2.gz RZFAHCZWUWARQI-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@@H]2c2ccsc2)nc1 ZINC000507174534 340211143 /nfs/dbraw/zinc/21/11/43/340211143.db2.gz RZFAHCZWUWARQI-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1cccn2c(CN(C)[C@H](C)c3c(F)cccc3F)c[nH+]c12 ZINC000507190510 340212126 /nfs/dbraw/zinc/21/21/26/340212126.db2.gz LRPMCATVMAWSCX-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1cccn2c(CN(C)[C@@H](C)c3c(F)cccc3F)c[nH+]c12 ZINC000507190511 340212252 /nfs/dbraw/zinc/21/22/52/340212252.db2.gz LRPMCATVMAWSCX-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO COCc1nc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000507203092 340212922 /nfs/dbraw/zinc/21/29/22/340212922.db2.gz LKBIPJQWFHHPFW-NSHDSACASA-N 1 2 310.850 4.136 20 0 DIADLO COCc1nc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000507203092 340212923 /nfs/dbraw/zinc/21/29/23/340212923.db2.gz LKBIPJQWFHHPFW-NSHDSACASA-N 1 2 310.850 4.136 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1nc2ccccc2n1C ZINC000507222875 340214534 /nfs/dbraw/zinc/21/45/34/340214534.db2.gz XEWCLZNCFVVCOB-ZDUSSCGKSA-N 1 2 313.832 4.420 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1nc2ccccc2n1C ZINC000507222875 340214535 /nfs/dbraw/zinc/21/45/35/340214535.db2.gz XEWCLZNCFVVCOB-ZDUSSCGKSA-N 1 2 313.832 4.420 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)CC1=Cc2ccccc2OC1 ZINC000507246915 340215484 /nfs/dbraw/zinc/21/54/84/340215484.db2.gz KUFJYNPKUOWJAD-ZDUSSCGKSA-N 1 2 315.363 4.434 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)CC1=Cc2ccccc2OC1 ZINC000507246915 340215485 /nfs/dbraw/zinc/21/54/85/340215485.db2.gz KUFJYNPKUOWJAD-ZDUSSCGKSA-N 1 2 315.363 4.434 20 0 DIADLO CCC[N@H+](Cc1conc1CC)Cc1c(F)cccc1Cl ZINC000507317730 340216987 /nfs/dbraw/zinc/21/69/87/340216987.db2.gz KBUFUGBLZJTFBZ-UHFFFAOYSA-N 1 2 310.800 4.442 20 0 DIADLO CCC[N@@H+](Cc1conc1CC)Cc1c(F)cccc1Cl ZINC000507317730 340216988 /nfs/dbraw/zinc/21/69/88/340216988.db2.gz KBUFUGBLZJTFBZ-UHFFFAOYSA-N 1 2 310.800 4.442 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3)C2)o1 ZINC000507360177 340217884 /nfs/dbraw/zinc/21/78/84/340217884.db2.gz RDXGAEGPVYDHLT-OMWUSAIZSA-N 1 2 315.388 4.116 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3)C2)o1 ZINC000507360177 340217885 /nfs/dbraw/zinc/21/78/85/340217885.db2.gz RDXGAEGPVYDHLT-OMWUSAIZSA-N 1 2 315.388 4.116 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+][C@@H](COCC(C)C)c1ccco1 ZINC000507469179 340221194 /nfs/dbraw/zinc/22/11/94/340221194.db2.gz JSAHYTXQSADDEP-RDJZCZTQSA-N 1 2 316.445 4.302 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000507474632 340221662 /nfs/dbraw/zinc/22/16/62/340221662.db2.gz YBRYTUGDZZQRLO-IIBYNOLFSA-N 1 2 317.436 4.479 20 0 DIADLO C[C@@H](Nc1cccc([NH+]2CCCCCC2)c1)[C@H]1CCCOC1 ZINC000507480626 340221818 /nfs/dbraw/zinc/22/18/18/340221818.db2.gz PGYVCBWZNPYXBU-SJORKVTESA-N 1 2 302.462 4.294 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+]Cc1cc(C(CC)CC)no1 ZINC000507489902 340222512 /nfs/dbraw/zinc/22/25/12/340222512.db2.gz YTWSQSCZUFTLPE-ZDUSSCGKSA-N 1 2 301.434 4.386 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+][C@H](C)c1c(F)cccc1OC ZINC000507499783 340222903 /nfs/dbraw/zinc/22/29/03/340222903.db2.gz ZUASVLSWLSEYII-OLZOCXBDSA-N 1 2 302.393 4.204 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+][C@@H](C)c1c(F)cccc1OC ZINC000507499784 340222947 /nfs/dbraw/zinc/22/29/47/340222947.db2.gz ZUASVLSWLSEYII-QWHCGFSZSA-N 1 2 302.393 4.204 20 0 DIADLO Fc1cc(F)cc(C[N@@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)c1 ZINC000507667945 340227882 /nfs/dbraw/zinc/22/78/82/340227882.db2.gz XSCRZLOVSPNASP-KRWDZBQOSA-N 1 2 323.770 4.192 20 0 DIADLO Fc1cc(F)cc(C[N@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)c1 ZINC000507667945 340227883 /nfs/dbraw/zinc/22/78/83/340227883.db2.gz XSCRZLOVSPNASP-KRWDZBQOSA-N 1 2 323.770 4.192 20 0 DIADLO CCc1nc(C[N@@H+]2CCC[C@H]2c2ccc(C(C)(C)C)cc2)no1 ZINC000507720890 340229372 /nfs/dbraw/zinc/22/93/72/340229372.db2.gz XWABDUNYTDZJDD-INIZCTEOSA-N 1 2 313.445 4.267 20 0 DIADLO CCc1nc(C[N@H+]2CCC[C@H]2c2ccc(C(C)(C)C)cc2)no1 ZINC000507720890 340229373 /nfs/dbraw/zinc/22/93/73/340229373.db2.gz XWABDUNYTDZJDD-INIZCTEOSA-N 1 2 313.445 4.267 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NC(=O)C(C2CCC2)C2CCC2)c1 ZINC000507718676 340229381 /nfs/dbraw/zinc/22/93/81/340229381.db2.gz PBJMLTDHZMPTLV-UHFFFAOYSA-N 1 2 323.440 4.242 20 0 DIADLO CCc1ccc(C2=CC[N@H+](Cc3ccn(C(F)F)n3)CC2)cc1 ZINC000507728492 340229755 /nfs/dbraw/zinc/22/97/55/340229755.db2.gz ZCVIKZLPLSRTQD-UHFFFAOYSA-N 1 2 317.383 4.130 20 0 DIADLO CCc1ccc(C2=CC[N@@H+](Cc3ccn(C(F)F)n3)CC2)cc1 ZINC000507728492 340229756 /nfs/dbraw/zinc/22/97/56/340229756.db2.gz ZCVIKZLPLSRTQD-UHFFFAOYSA-N 1 2 317.383 4.130 20 0 DIADLO CC[N@H+](Cc1cnn(C)c1)Cc1ccc(-c2ccccc2)cc1F ZINC000507789455 340231510 /nfs/dbraw/zinc/23/15/10/340231510.db2.gz ADIRGPVUBNZNBW-UHFFFAOYSA-N 1 2 323.415 4.248 20 0 DIADLO CC[N@@H+](Cc1cnn(C)c1)Cc1ccc(-c2ccccc2)cc1F ZINC000507789455 340231511 /nfs/dbraw/zinc/23/15/11/340231511.db2.gz ADIRGPVUBNZNBW-UHFFFAOYSA-N 1 2 323.415 4.248 20 0 DIADLO CCc1ccc(C[NH2+][C@@H]2CCCc3cn(C4CCCC4)nc32)o1 ZINC000507905737 340235589 /nfs/dbraw/zinc/23/55/89/340235589.db2.gz ZIRUNQXFHXEJTF-GOSISDBHSA-N 1 2 313.445 4.321 20 0 DIADLO COc1ccc(C)cc1C[NH2+][C@@H](COCC(C)C)c1ccco1 ZINC000507931163 340236011 /nfs/dbraw/zinc/23/60/11/340236011.db2.gz QTXHDIHWKKLXSQ-KRWDZBQOSA-N 1 2 317.429 4.100 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1OC)Cc1c(F)cccc1F ZINC000508039450 340237958 /nfs/dbraw/zinc/23/79/58/340237958.db2.gz HZSINPDSVDMXRQ-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1OC)Cc1c(F)cccc1F ZINC000508039450 340237959 /nfs/dbraw/zinc/23/79/59/340237959.db2.gz HZSINPDSVDMXRQ-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c(F)ccc(O)c1F ZINC000508187900 340240200 /nfs/dbraw/zinc/24/02/00/340240200.db2.gz RYWQWAKJFGNXAF-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1c(F)ccc(O)c1F ZINC000508187900 340240201 /nfs/dbraw/zinc/24/02/01/340240201.db2.gz RYWQWAKJFGNXAF-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO CC[C@H](C)[C@H](C(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000508520349 340245628 /nfs/dbraw/zinc/24/56/28/340245628.db2.gz GMVOACXBIWJMTH-LIRRHRJNSA-N 1 2 321.424 4.411 20 0 DIADLO C[N@H+](Cc1cc2ccccc2o1)Cc1c(F)ccc(O)c1F ZINC000508777437 340253070 /nfs/dbraw/zinc/25/30/70/340253070.db2.gz DMWGZMIKTADBET-UHFFFAOYSA-N 1 2 303.308 4.049 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2o1)Cc1c(F)ccc(O)c1F ZINC000508777437 340253071 /nfs/dbraw/zinc/25/30/71/340253071.db2.gz DMWGZMIKTADBET-UHFFFAOYSA-N 1 2 303.308 4.049 20 0 DIADLO CCn1nccc1C[N@H+](Cc1ccccc1)Cc1ccc(F)cc1 ZINC000508829523 340253763 /nfs/dbraw/zinc/25/37/63/340253763.db2.gz RIHIVVZAPTVMPB-UHFFFAOYSA-N 1 2 323.415 4.245 20 0 DIADLO CCn1nccc1C[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1 ZINC000508829523 340253764 /nfs/dbraw/zinc/25/37/64/340253764.db2.gz RIHIVVZAPTVMPB-UHFFFAOYSA-N 1 2 323.415 4.245 20 0 DIADLO CC[C@@]1(C)COCC[N@@H+]1Cc1nc(-c2ccc(C)cc2)cs1 ZINC000509023586 340258594 /nfs/dbraw/zinc/25/85/94/340258594.db2.gz RBXFZFILGWKZIT-SFHVURJKSA-N 1 2 316.470 4.119 20 0 DIADLO CC[C@@]1(C)COCC[N@H+]1Cc1nc(-c2ccc(C)cc2)cs1 ZINC000509023586 340258595 /nfs/dbraw/zinc/25/85/95/340258595.db2.gz RBXFZFILGWKZIT-SFHVURJKSA-N 1 2 316.470 4.119 20 0 DIADLO O=C(Nc1ccc(F)cc1)c1ccccc1Oc1cc[nH+]cc1 ZINC000509030271 340258742 /nfs/dbraw/zinc/25/87/42/340258742.db2.gz BMYSVBFBLSKTPX-UHFFFAOYSA-N 1 2 308.312 4.265 20 0 DIADLO C[C@H](NC(=O)c1ccccc1Oc1cc[nH+]cc1)c1ccccc1 ZINC000509028693 340258810 /nfs/dbraw/zinc/25/88/10/340258810.db2.gz FXVUPXMIBYGKRP-HNNXBMFYSA-N 1 2 318.376 4.365 20 0 DIADLO CC[C@@H]([NH2+][C@H](CC(C)C)C(=O)OC)c1ccc(Cl)s1 ZINC000509032193 340258911 /nfs/dbraw/zinc/25/89/11/340258911.db2.gz MRSMTVZHAJTIAG-GHMZBOCLSA-N 1 2 303.855 4.030 20 0 DIADLO Clc1ccccc1[C@H]1C[N@H+](C/C=C/c2ccccc2)CCO1 ZINC000509048409 340259449 /nfs/dbraw/zinc/25/94/49/340259449.db2.gz NEZTWQFKAXOFTJ-MBNRZODZSA-N 1 2 313.828 4.427 20 0 DIADLO Clc1ccccc1[C@H]1C[N@@H+](C/C=C/c2ccccc2)CCO1 ZINC000509048409 340259450 /nfs/dbraw/zinc/25/94/50/340259450.db2.gz NEZTWQFKAXOFTJ-MBNRZODZSA-N 1 2 313.828 4.427 20 0 DIADLO Cc1ccccc1OCC[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000509056523 340259762 /nfs/dbraw/zinc/25/97/62/340259762.db2.gz KALLXNJHVRWBAJ-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO Cc1ccccc1OCC[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000509056523 340259763 /nfs/dbraw/zinc/25/97/63/340259763.db2.gz KALLXNJHVRWBAJ-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)[C@H]1C ZINC000509120730 340261664 /nfs/dbraw/zinc/26/16/64/340261664.db2.gz FVLZYPKOIWVHGS-VKJFTORMSA-N 1 2 324.424 4.428 20 0 DIADLO C[C@@H]1CCC[C@@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)[C@H]1C ZINC000509120729 340261727 /nfs/dbraw/zinc/26/17/27/340261727.db2.gz FVLZYPKOIWVHGS-RVKKMQEKSA-N 1 2 324.424 4.428 20 0 DIADLO C[C@@H]1CCC[C@@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)[C@@H]1C ZINC000509120726 340261731 /nfs/dbraw/zinc/26/17/31/340261731.db2.gz FVLZYPKOIWVHGS-IIDMSEBBSA-N 1 2 324.424 4.428 20 0 DIADLO C[C@H]1CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C[C@H](C)C1 ZINC000509189771 340263428 /nfs/dbraw/zinc/26/34/28/340263428.db2.gz IBLVDFPJBSIEBR-JKSUJKDBSA-N 1 2 324.424 4.382 20 0 DIADLO CC[C@H](C)[C@H]([NH2+]Cc1cccc2[nH]ccc21)C(=O)OC(C)(C)C ZINC000509236477 340264316 /nfs/dbraw/zinc/26/43/16/340264316.db2.gz WXUGPDHTZKWIIH-GUYCJALGSA-N 1 2 316.445 4.014 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+]3C[C@@H](C)OC(C)(C)C3)n2)cc1 ZINC000509279690 340265287 /nfs/dbraw/zinc/26/52/87/340265287.db2.gz QVCNBMMPKFHBCE-CQSZACIVSA-N 1 2 316.470 4.118 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+]3C[C@@H](C)OC(C)(C)C3)n2)cc1 ZINC000509279690 340265288 /nfs/dbraw/zinc/26/52/88/340265288.db2.gz QVCNBMMPKFHBCE-CQSZACIVSA-N 1 2 316.470 4.118 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+]3C[C@H](C)OC(C)(C)C3)n2)cc1 ZINC000509279689 340265346 /nfs/dbraw/zinc/26/53/46/340265346.db2.gz QVCNBMMPKFHBCE-AWEZNQCLSA-N 1 2 316.470 4.118 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+]3C[C@H](C)OC(C)(C)C3)n2)cc1 ZINC000509279689 340265347 /nfs/dbraw/zinc/26/53/47/340265347.db2.gz QVCNBMMPKFHBCE-AWEZNQCLSA-N 1 2 316.470 4.118 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+]2CCc3cc(F)ccc3C2)n1 ZINC000509467838 340270403 /nfs/dbraw/zinc/27/04/03/340270403.db2.gz CKUYVDYNQJUESP-UHFFFAOYSA-N 1 2 304.434 4.138 20 0 DIADLO CC(C)(C)c1csc(C[N@H+]2CCc3cc(F)ccc3C2)n1 ZINC000509467838 340270404 /nfs/dbraw/zinc/27/04/04/340270404.db2.gz CKUYVDYNQJUESP-UHFFFAOYSA-N 1 2 304.434 4.138 20 0 DIADLO CC1=C(c2ccco2)CN(c2cc(C(F)(F)F)cc[nH+]2)CC1 ZINC000509484815 340271160 /nfs/dbraw/zinc/27/11/60/340271160.db2.gz FOJGSSGFPNWTGH-UHFFFAOYSA-N 1 2 308.303 4.377 20 0 DIADLO FCCCC[N@@H+]1CCc2c(Br)ccc(Cl)c2C1 ZINC000509609312 340274668 /nfs/dbraw/zinc/27/46/68/340274668.db2.gz QPGDPEOFWJATFW-UHFFFAOYSA-N 1 2 320.633 4.210 20 0 DIADLO FCCCC[N@H+]1CCc2c(Br)ccc(Cl)c2C1 ZINC000509609312 340274669 /nfs/dbraw/zinc/27/46/69/340274669.db2.gz QPGDPEOFWJATFW-UHFFFAOYSA-N 1 2 320.633 4.210 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2nc(-c3ccc(C)cc3)cs2)C[C@@H](C)O1 ZINC000509681012 340276808 /nfs/dbraw/zinc/27/68/08/340276808.db2.gz CNOWDSOGPRZMPY-GDBMZVCRSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2nc(-c3ccc(C)cc3)cs2)C[C@@H](C)O1 ZINC000509681012 340276809 /nfs/dbraw/zinc/27/68/09/340276809.db2.gz CNOWDSOGPRZMPY-GDBMZVCRSA-N 1 2 316.470 4.118 20 0 DIADLO FCCCC[N@@H+]1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000509698434 340277414 /nfs/dbraw/zinc/27/74/14/340277414.db2.gz NXKLQIBAYPTVIA-CQSZACIVSA-N 1 2 324.198 4.256 20 0 DIADLO FCCCC[N@H+]1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000509698434 340277415 /nfs/dbraw/zinc/27/74/15/340277415.db2.gz NXKLQIBAYPTVIA-CQSZACIVSA-N 1 2 324.198 4.256 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)c1ccccc1Oc1ccccc1 ZINC000509754458 340278453 /nfs/dbraw/zinc/27/84/53/340278453.db2.gz GXERZTMLOHZNKW-UHFFFAOYSA-N 1 2 318.376 4.111 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)c1cccc(Oc2ccccc2)c1 ZINC000509778245 340279007 /nfs/dbraw/zinc/27/90/07/340279007.db2.gz ULRFPTOJVVJREA-UHFFFAOYSA-N 1 2 318.376 4.111 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(-c2cccc(C)c2)n1 ZINC000509833253 340281136 /nfs/dbraw/zinc/28/11/36/340281136.db2.gz HUXOBHXUKRKORV-UHFFFAOYSA-N 1 2 318.380 4.005 20 0 DIADLO C[C@H]1C[C@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)C[C@@H](C)C1 ZINC000509989135 340284755 /nfs/dbraw/zinc/28/47/55/340284755.db2.gz LGNBFFYYLKNROV-ZSHCYNCHSA-N 1 2 324.424 4.428 20 0 DIADLO CC(C)C[C@H]1CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000510061603 340286857 /nfs/dbraw/zinc/28/68/57/340286857.db2.gz SLPKVKAJAQXSMW-MRXNPFEDSA-N 1 2 324.424 4.382 20 0 DIADLO FC(F)C1([NH2+]Cc2cc(-c3ccccc3)no2)CCCCC1 ZINC000510114683 340289311 /nfs/dbraw/zinc/28/93/11/340289311.db2.gz WPHVUGGVPHXREE-UHFFFAOYSA-N 1 2 306.356 4.399 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)C(C1CCC1)C1CCC1 ZINC000510872340 340313509 /nfs/dbraw/zinc/31/35/09/340313509.db2.gz PCCNYHQMJJLTCS-UHFFFAOYSA-N 1 2 309.413 4.232 20 0 DIADLO Cn1nccc1C1=CC[N@H+](Cc2ccc(Cl)cc2Cl)CC1 ZINC000511075488 340320032 /nfs/dbraw/zinc/32/00/32/340320032.db2.gz ZGAJPPLXBUIGGU-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1nccc1C1=CC[N@@H+](Cc2ccc(Cl)cc2Cl)CC1 ZINC000511075488 340320033 /nfs/dbraw/zinc/32/00/33/340320033.db2.gz ZGAJPPLXBUIGGU-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[N@@H+]1CCC=C(c2ccco2)C1 ZINC000511075624 340320077 /nfs/dbraw/zinc/32/00/77/340320077.db2.gz SIXAMTVPADHGKN-UHFFFAOYSA-N 1 2 324.424 4.131 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[N@H+]1CCC=C(c2ccco2)C1 ZINC000511075624 340320078 /nfs/dbraw/zinc/32/00/78/340320078.db2.gz SIXAMTVPADHGKN-UHFFFAOYSA-N 1 2 324.424 4.131 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC=C(c3ccco3)C2)cs1 ZINC000511106192 340320928 /nfs/dbraw/zinc/32/09/28/340320928.db2.gz LJHXMVBIRLSJNH-UHFFFAOYSA-N 1 2 302.443 4.368 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC=C(c3ccco3)C2)cs1 ZINC000511106192 340320929 /nfs/dbraw/zinc/32/09/29/340320929.db2.gz LJHXMVBIRLSJNH-UHFFFAOYSA-N 1 2 302.443 4.368 20 0 DIADLO C[C@@H]1C[C@@H](C)[C@@H](C)N(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000511290563 340324893 /nfs/dbraw/zinc/32/48/93/340324893.db2.gz YEZYSBZVCJRZMJ-BZUAXINKSA-N 1 2 324.424 4.381 20 0 DIADLO COC(=O)c1cccc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c1 ZINC000511605134 340332153 /nfs/dbraw/zinc/33/21/53/340332153.db2.gz PBJLJEKZXOLQPG-KRWDZBQOSA-N 1 2 315.800 4.074 20 0 DIADLO COC(=O)c1cccc(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)c1 ZINC000511605134 340332154 /nfs/dbraw/zinc/33/21/54/340332154.db2.gz PBJLJEKZXOLQPG-KRWDZBQOSA-N 1 2 315.800 4.074 20 0 DIADLO CCOc1cccc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)n1 ZINC000511610251 340332194 /nfs/dbraw/zinc/33/21/94/340332194.db2.gz LMAXEFXANIFSSG-MRXNPFEDSA-N 1 2 302.805 4.081 20 0 DIADLO CCOc1cccc(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)n1 ZINC000511610251 340332195 /nfs/dbraw/zinc/33/21/95/340332195.db2.gz LMAXEFXANIFSSG-MRXNPFEDSA-N 1 2 302.805 4.081 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@H+](C)CCC(F)(F)F ZINC000511748783 340336963 /nfs/dbraw/zinc/33/69/63/340336963.db2.gz UEFAOFSRUDSNJV-UHFFFAOYSA-N 1 2 316.150 4.386 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@@H+](C)CCC(F)(F)F ZINC000511748783 340336964 /nfs/dbraw/zinc/33/69/64/340336964.db2.gz UEFAOFSRUDSNJV-UHFFFAOYSA-N 1 2 316.150 4.386 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2csc(-c3ccc(C)cc3)n2)C[C@@H](C)O1 ZINC000511855806 340340506 /nfs/dbraw/zinc/34/05/06/340340506.db2.gz QWHXOPKKEBCHOH-RHSMWYFYSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2csc(-c3ccc(C)cc3)n2)C[C@@H](C)O1 ZINC000511855806 340340507 /nfs/dbraw/zinc/34/05/07/340340507.db2.gz QWHXOPKKEBCHOH-RHSMWYFYSA-N 1 2 316.470 4.118 20 0 DIADLO COc1ccc(CSCc2cn3cccc(C)c3[nH+]2)cc1F ZINC000511935091 340343286 /nfs/dbraw/zinc/34/32/86/340343286.db2.gz RLWJECMHXIECNA-UHFFFAOYSA-N 1 2 316.401 4.224 20 0 DIADLO CCCCCOc1ccc(C[N@H+](C)Cc2cscn2)cc1 ZINC000512066430 340347319 /nfs/dbraw/zinc/34/73/19/340347319.db2.gz FDNPRHPRWSGWCV-UHFFFAOYSA-N 1 2 304.459 4.344 20 0 DIADLO CCCCCOc1ccc(C[N@@H+](C)Cc2cscn2)cc1 ZINC000512066430 340347320 /nfs/dbraw/zinc/34/73/20/340347320.db2.gz FDNPRHPRWSGWCV-UHFFFAOYSA-N 1 2 304.459 4.344 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NCc2c(C)cnn2C)c1 ZINC000512075055 340347774 /nfs/dbraw/zinc/34/77/74/340347774.db2.gz VZNFMDHDUPZSSA-UHFFFAOYSA-N 1 2 323.444 4.004 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1nc(C(C)(C)C)cs1)CCO2 ZINC000512241905 340353711 /nfs/dbraw/zinc/35/37/11/340353711.db2.gz HUEMGHRAKQDQHB-UHFFFAOYSA-N 1 2 316.470 4.144 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1nc(C(C)(C)C)cs1)CCO2 ZINC000512241905 340353712 /nfs/dbraw/zinc/35/37/12/340353712.db2.gz HUEMGHRAKQDQHB-UHFFFAOYSA-N 1 2 316.470 4.144 20 0 DIADLO CC(C)CCc1noc(C[N@H+]([C@H](C)c2ccccc2)C2CC2)n1 ZINC000512277918 340355139 /nfs/dbraw/zinc/35/51/39/340355139.db2.gz NIMKUSFDQRMTAF-OAHLLOKOSA-N 1 2 313.445 4.384 20 0 DIADLO CC(C)CCc1noc(C[N@@H+]([C@H](C)c2ccccc2)C2CC2)n1 ZINC000512277918 340355140 /nfs/dbraw/zinc/35/51/40/340355140.db2.gz NIMKUSFDQRMTAF-OAHLLOKOSA-N 1 2 313.445 4.384 20 0 DIADLO CCCCOc1ccc(C[N@@H+]2CCCC[C@H]2c2ncc[nH]2)cc1 ZINC000512485082 340363591 /nfs/dbraw/zinc/36/35/91/340363591.db2.gz FJADGVJNJZFXFV-SFHVURJKSA-N 1 2 313.445 4.316 20 0 DIADLO CCCCOc1ccc(C[N@H+]2CCCC[C@H]2c2ncc[nH]2)cc1 ZINC000512485082 340363592 /nfs/dbraw/zinc/36/35/92/340363592.db2.gz FJADGVJNJZFXFV-SFHVURJKSA-N 1 2 313.445 4.316 20 0 DIADLO CC(C)(C)c1ccc(C[N@@H+]2CCCC[C@H]2c2ncc[nH]2)s1 ZINC000512487082 340363643 /nfs/dbraw/zinc/36/36/43/340363643.db2.gz PWVNIIAOPHHSFQ-AWEZNQCLSA-N 1 2 303.475 4.496 20 0 DIADLO CC(C)(C)c1ccc(C[N@H+]2CCCC[C@H]2c2ncc[nH]2)s1 ZINC000512487082 340363644 /nfs/dbraw/zinc/36/36/44/340363644.db2.gz PWVNIIAOPHHSFQ-AWEZNQCLSA-N 1 2 303.475 4.496 20 0 DIADLO CCCCCc1[nH+]c2ccccc2n1C[C@](C)(O)C(F)(F)F ZINC000512807728 340378488 /nfs/dbraw/zinc/37/84/88/340378488.db2.gz JUDSWBQTGJACOI-HNNXBMFYSA-N 1 2 314.351 4.082 20 0 DIADLO COc1cc(C)c(C[NH2+]C2(C(F)F)CCCCC2)cc1OC ZINC000512896836 340383215 /nfs/dbraw/zinc/38/32/15/340383215.db2.gz WSXOSHJYHQVXJU-UHFFFAOYSA-N 1 2 313.388 4.070 20 0 DIADLO Cc1ncsc1C[N@@H+]1CCc2c(Cl)c(Cl)ccc2C1 ZINC000513111828 340393714 /nfs/dbraw/zinc/39/37/14/340393714.db2.gz NMXWXSGRMXHHTQ-UHFFFAOYSA-N 1 2 313.253 4.317 20 0 DIADLO Cc1ncsc1C[N@H+]1CCc2c(Cl)c(Cl)ccc2C1 ZINC000513111828 340393715 /nfs/dbraw/zinc/39/37/15/340393715.db2.gz NMXWXSGRMXHHTQ-UHFFFAOYSA-N 1 2 313.253 4.317 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@@H+]1Cc1cc[nH]n1 ZINC000513138372 340394856 /nfs/dbraw/zinc/39/48/56/340394856.db2.gz GZDRLDKJRUPINZ-HNNXBMFYSA-N 1 2 309.335 4.156 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@H+]1Cc1cc[nH]n1 ZINC000513138372 340394857 /nfs/dbraw/zinc/39/48/57/340394857.db2.gz GZDRLDKJRUPINZ-HNNXBMFYSA-N 1 2 309.335 4.156 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC2)c1nc(C(C)(C)C)no1 ZINC000513195414 340396464 /nfs/dbraw/zinc/39/64/64/340396464.db2.gz BHVSCQFMWICVOL-QWHCGFSZSA-N 1 2 313.445 4.268 20 0 DIADLO C[C@@H](C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)c1cccnc1 ZINC000174808248 340396568 /nfs/dbraw/zinc/39/65/68/340396568.db2.gz WJWOQYSXHNLWNU-CQSZACIVSA-N 1 2 319.364 4.011 20 0 DIADLO CCCCN(C(=O)CCn1cc[nH+]c1)[C@@H](CC)c1ccccc1 ZINC000513228121 340398350 /nfs/dbraw/zinc/39/83/50/340398350.db2.gz UWQSEGMREHSDAV-SFHVURJKSA-N 1 2 313.445 4.053 20 0 DIADLO CCCOc1ccc(Cl)cc1C(=O)Nc1cc[nH+]cc1C ZINC000176547931 340428368 /nfs/dbraw/zinc/42/83/68/340428368.db2.gz YLVHBPBNFKLZCH-UHFFFAOYSA-N 1 2 304.777 4.085 20 0 DIADLO Fc1c(Cl)cccc1NCc1[nH+]ccn1Cc1ccccc1 ZINC000176904483 340433674 /nfs/dbraw/zinc/43/36/74/340433674.db2.gz YXFZJXJKXGTHRB-UHFFFAOYSA-N 1 2 315.779 4.336 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1cccc(F)c1F ZINC000516933769 340459019 /nfs/dbraw/zinc/45/90/19/340459019.db2.gz YXYYBBRPJIPCRN-YMTOWFKASA-N 1 2 309.743 4.403 20 0 DIADLO CC[C@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)C(C)C ZINC000517163695 340464736 /nfs/dbraw/zinc/46/47/36/340464736.db2.gz PCFRCTLHHDTCHX-CYBMUJFWSA-N 1 2 303.381 4.022 20 0 DIADLO Cc1ccc(-c2nnc(SCc3ccc(C)[nH+]c3C)o2)cc1 ZINC000186420208 340512471 /nfs/dbraw/zinc/51/24/71/340512471.db2.gz GRCSYSDXMFLWEZ-UHFFFAOYSA-N 1 2 311.410 4.349 20 0 DIADLO CCn1c(SCc2ccc(C)[nH+]c2C)nnc1-c1ccccc1 ZINC000187313843 340519014 /nfs/dbraw/zinc/51/90/14/340519014.db2.gz SGGFQNKRDZPSIX-UHFFFAOYSA-N 1 2 324.453 4.269 20 0 DIADLO Cc1cc(OCC(=O)Nc2cccc(C)c2C)c2ccccc2[nH+]1 ZINC000192193445 340564313 /nfs/dbraw/zinc/56/43/13/340564313.db2.gz GOJKQELICMVOQP-UHFFFAOYSA-N 1 2 320.392 4.178 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1ncc(Cl)s1)CCS2 ZINC000225304752 340566569 /nfs/dbraw/zinc/56/65/69/340566569.db2.gz IOSBILVIIZWUHL-JTQLQIEISA-N 1 2 314.838 4.262 20 0 DIADLO Cc1cc(NC(=O)c2cccs2)ccc1Oc1cc[nH+]cc1 ZINC000193188529 340573830 /nfs/dbraw/zinc/57/38/30/340573830.db2.gz LDLRVTKLVBKIPD-UHFFFAOYSA-N 1 2 310.378 4.496 20 0 DIADLO C[C@@H](N(C)C(=O)c1cccc(Oc2cc[nH+]cc2)c1)C(C)(C)C ZINC000522140744 340577295 /nfs/dbraw/zinc/57/72/95/340577295.db2.gz HQWPYQPOKFLNOL-CQSZACIVSA-N 1 2 312.413 4.381 20 0 DIADLO CCSc1ccccc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000522862308 340608395 /nfs/dbraw/zinc/60/83/95/340608395.db2.gz KZJGDEZJRXNMIO-UHFFFAOYSA-N 1 2 323.421 4.441 20 0 DIADLO Cc1cc(N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)nc(C2CC2)[nH+]1 ZINC000524067898 340646951 /nfs/dbraw/zinc/64/69/51/340646951.db2.gz NLNXEDNTMKHTTA-CJNGLKHVSA-N 1 2 311.404 4.184 20 0 DIADLO CCOc1cc(CNc2ccc[nH+]c2C)ccc1OC(F)F ZINC000316777763 340695843 /nfs/dbraw/zinc/69/58/43/340695843.db2.gz VFCLSTPJPHQADN-UHFFFAOYSA-N 1 2 308.328 4.002 20 0 DIADLO CCCCS(=O)(=O)Nc1ccc([NH2+][C@H](C)C2CCCC2)cc1 ZINC000525981754 340706305 /nfs/dbraw/zinc/70/63/05/340706305.db2.gz FXTUBAUOIGPKMB-CQSZACIVSA-N 1 2 324.490 4.219 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]Cc2ccc(C(F)F)cc2)cs1 ZINC000525988956 340707565 /nfs/dbraw/zinc/70/75/65/340707565.db2.gz XDFAOMUOCCJRKS-JTQLQIEISA-N 1 2 312.385 4.078 20 0 DIADLO CC1(C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)CCC(F)(F)CC1 ZINC000528410640 340717299 /nfs/dbraw/zinc/71/72/99/340717299.db2.gz UMQKBRIUQRCQKZ-UHFFFAOYSA-N 1 2 319.355 4.231 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(CC(C)C)no1)c1cc(C)ccc1C ZINC000528802162 340735045 /nfs/dbraw/zinc/73/50/45/340735045.db2.gz RIUJPXBYCADLBA-MRXNPFEDSA-N 1 2 301.434 4.126 20 0 DIADLO Cc1cocc1C(=O)Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000528922544 340739474 /nfs/dbraw/zinc/73/94/74/340739474.db2.gz XEZXODOAVZGZBB-UHFFFAOYSA-N 1 2 311.385 4.025 20 0 DIADLO O=C(Nc1cccc(C2CCCCC2)c1)[C@H]1CCc2[nH+]ccn2C1 ZINC000529650654 340766801 /nfs/dbraw/zinc/76/68/01/340766801.db2.gz UKAHHYHEHGDGHU-KRWDZBQOSA-N 1 2 323.440 4.132 20 0 DIADLO CCC(CC)[C@@H]([NH2+]Cc1nnsc1Cl)c1ccccc1 ZINC000538151969 340811538 /nfs/dbraw/zinc/81/15/38/340811538.db2.gz XWCCUVHRAVBYBO-CQSZACIVSA-N 1 2 309.866 4.459 20 0 DIADLO FC(F)(F)[C@H]1CCC[C@@H](Nc2cccc(-n3cc[nH+]c3)c2)C1 ZINC000125967611 340818164 /nfs/dbraw/zinc/81/81/64/340818164.db2.gz GSXJWDWQXXBSSZ-QWHCGFSZSA-N 1 2 309.335 4.405 20 0 DIADLO c1c[nH]c([C@@H]([NH2+][C@H]2CCSc3ccccc32)c2ccccc2)n1 ZINC000127804528 340856578 /nfs/dbraw/zinc/85/65/78/340856578.db2.gz BZKBOKNYIKUREJ-WMZOPIPTSA-N 1 2 321.449 4.326 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc(C)c1F ZINC000128158108 340861429 /nfs/dbraw/zinc/86/14/29/340861429.db2.gz XOIICWKWKDZTMP-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO Cc1cc(C)c(CC(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)c(C)c1 ZINC000539111289 340873895 /nfs/dbraw/zinc/87/38/95/340873895.db2.gz NBDPZSRKPIWNKO-UHFFFAOYSA-N 1 2 319.408 4.183 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1nc(C(C)(C)C)no1 ZINC000539227042 340877519 /nfs/dbraw/zinc/87/75/19/340877519.db2.gz XTGVUIYZLOCZRG-ZDUSSCGKSA-N 1 2 317.433 4.005 20 0 DIADLO Fc1ccccc1-c1cnc(C[NH2+]C2(c3ccccc3)CC2)o1 ZINC000539255608 340878592 /nfs/dbraw/zinc/87/85/92/340878592.db2.gz NEWRNXMVXURBNG-UHFFFAOYSA-N 1 2 308.356 4.260 20 0 DIADLO Cc1ccc(NC(=O)Nc2ncc(-c3ccccc3)s2)c(C)[nH+]1 ZINC000128689473 340907292 /nfs/dbraw/zinc/90/72/92/340907292.db2.gz HTOXCEUSSCCPKX-UHFFFAOYSA-N 1 2 324.409 4.466 20 0 DIADLO CCOCc1cccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000128747438 340911504 /nfs/dbraw/zinc/91/15/04/340911504.db2.gz JLZFCDOWYDSNQU-GOSISDBHSA-N 1 2 307.397 4.148 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1ccn(C(C)C)n1 ZINC000540327854 340927068 /nfs/dbraw/zinc/92/70/68/340927068.db2.gz UXYWNTYUENTACI-HNNXBMFYSA-N 1 2 301.434 4.102 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2ccccc2Oc2ccccc2)nc1 ZINC000540355244 340928228 /nfs/dbraw/zinc/92/82/28/340928228.db2.gz WQOYZKDYFHTZPT-MRXNPFEDSA-N 1 2 319.408 4.428 20 0 DIADLO CC[C@@H](C)[C@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000540386187 340928960 /nfs/dbraw/zinc/92/89/60/340928960.db2.gz PBXIVIXFGXADND-BZNIZROVSA-N 1 2 319.836 4.477 20 0 DIADLO CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1nc(-c2ccccc2)no1 ZINC000541195457 340961186 /nfs/dbraw/zinc/96/11/86/340961186.db2.gz VWYJYPAXMZZJNH-KGLIPLIRSA-N 1 2 322.412 4.106 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2)CCN1c1cc[nH+]c2ccncc21 ZINC000541206881 340961758 /nfs/dbraw/zinc/96/17/58/340961758.db2.gz DBURTTTZOFCKQO-DOTOQJQBSA-N 1 2 303.409 4.402 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2)CCN1c1cc[nH+]c2ccncc21 ZINC000541206886 340961772 /nfs/dbraw/zinc/96/17/72/340961772.db2.gz DBURTTTZOFCKQO-WBVHZDCISA-N 1 2 303.409 4.402 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(-c2ccoc2)no1)c1ccc(Cl)s1 ZINC000541629705 340978628 /nfs/dbraw/zinc/97/86/28/340978628.db2.gz JXZYEHYBGXIYPY-SNVBAGLBSA-N 1 2 323.805 4.285 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]Cc2ncc(Cl)cc2Cl)cn1 ZINC000541642923 340979260 /nfs/dbraw/zinc/97/92/60/340979260.db2.gz MUEWNTHLSCJRND-JTQLQIEISA-N 1 2 313.232 4.017 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)C12CCC(CC1)C2 ZINC000542231251 341001285 /nfs/dbraw/zinc/00/12/85/341001285.db2.gz NYIZQEHVGYOZCO-UHFFFAOYSA-N 1 2 308.381 4.393 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@@H+](Cc1ncc(CC)s1)C2 ZINC000542468549 341008670 /nfs/dbraw/zinc/00/86/70/341008670.db2.gz FSHGWTHZYIIRBM-UHFFFAOYSA-N 1 2 316.470 4.053 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@H+](Cc1ncc(CC)s1)C2 ZINC000542468549 341008671 /nfs/dbraw/zinc/00/86/71/341008671.db2.gz FSHGWTHZYIIRBM-UHFFFAOYSA-N 1 2 316.470 4.053 20 0 DIADLO c1csc(-c2cnc(C[NH2+][C@@H](c3cccnc3)C3CC3)o2)c1 ZINC000542518772 341011699 /nfs/dbraw/zinc/01/16/99/341011699.db2.gz XKSKADIZDPCLQB-QGZVFWFLSA-N 1 2 311.410 4.039 20 0 DIADLO CC(C)c1cc(N2CCC3(CCOCC3)[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000542524418 341012109 /nfs/dbraw/zinc/01/21/09/341012109.db2.gz AXMYVWSGLLLVGD-HNNXBMFYSA-N 1 2 317.477 4.119 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2c(C)cc(C(C)(C)C)cc2C)o1 ZINC000542620352 341015209 /nfs/dbraw/zinc/01/52/09/341015209.db2.gz MCEAUHYLJFUDJU-CYBMUJFWSA-N 1 2 301.434 4.143 20 0 DIADLO CCOc1cccc2cc([C@@H](C)[NH2+][C@H](C)c3ccon3)oc21 ZINC000542698549 341017671 /nfs/dbraw/zinc/01/76/71/341017671.db2.gz WFHJWJQVHFWPAP-VXGBXAGGSA-N 1 2 300.358 4.231 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CC=C(C(F)(F)F)CC2)c(F)c1 ZINC000542700615 341017990 /nfs/dbraw/zinc/01/79/90/341017990.db2.gz SYNGJHQPQMGHIZ-OWOJBTEDSA-N 1 2 303.274 4.172 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CC=C(C(F)(F)F)CC2)c(F)c1 ZINC000542700615 341017991 /nfs/dbraw/zinc/01/79/91/341017991.db2.gz SYNGJHQPQMGHIZ-OWOJBTEDSA-N 1 2 303.274 4.172 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)c1ccon1 ZINC000542715745 341018731 /nfs/dbraw/zinc/01/87/31/341018731.db2.gz ZXMWYWKNEQGDIQ-QMMMGPOBSA-N 1 2 304.699 4.198 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2nnsc2Cl)C(C)C)cc1 ZINC000071122843 341022754 /nfs/dbraw/zinc/02/27/54/341022754.db2.gz QNBCEXMAMRMEDU-CQSZACIVSA-N 1 2 309.866 4.241 20 0 DIADLO CC(C)(C)C[N@@H+]1CCO[C@H](c2ccccc2C(F)(F)F)C1 ZINC000542853995 341023779 /nfs/dbraw/zinc/02/37/79/341023779.db2.gz LHSHXVKWWDWJHE-AWEZNQCLSA-N 1 2 301.352 4.125 20 0 DIADLO CC(C)(C)C[N@H+]1CCO[C@H](c2ccccc2C(F)(F)F)C1 ZINC000542853995 341023780 /nfs/dbraw/zinc/02/37/80/341023780.db2.gz LHSHXVKWWDWJHE-AWEZNQCLSA-N 1 2 301.352 4.125 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CCOCC2(CC2)C1 ZINC000542986478 341027768 /nfs/dbraw/zinc/02/77/68/341027768.db2.gz WEMFBGOFZDJFLG-LLVKDONJSA-N 1 2 300.229 4.167 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCOCC2(CC2)C1 ZINC000542986478 341027769 /nfs/dbraw/zinc/02/77/69/341027769.db2.gz WEMFBGOFZDJFLG-LLVKDONJSA-N 1 2 300.229 4.167 20 0 DIADLO CC(C)Cn1cc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)cn1 ZINC000543058285 341029604 /nfs/dbraw/zinc/02/96/04/341029604.db2.gz KTEUGLRPDCUUQQ-AWEZNQCLSA-N 1 2 305.853 4.386 20 0 DIADLO CC(C)Cn1cc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)cn1 ZINC000543058285 341029605 /nfs/dbraw/zinc/02/96/05/341029605.db2.gz KTEUGLRPDCUUQQ-AWEZNQCLSA-N 1 2 305.853 4.386 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@@H+]2Cc3ccccc3[C@H]2C)cc1F ZINC000543060563 341029814 /nfs/dbraw/zinc/02/98/14/341029814.db2.gz KHDQPSZTBBBRIM-ZIAGYGMSSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@H+]2Cc3ccccc3[C@H]2C)cc1F ZINC000543060563 341029815 /nfs/dbraw/zinc/02/98/15/341029815.db2.gz KHDQPSZTBBBRIM-ZIAGYGMSSA-N 1 2 312.388 4.038 20 0 DIADLO CCc1cccc(CC)c1NC(=O)C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000543061345 341029870 /nfs/dbraw/zinc/02/98/70/341029870.db2.gz JMXGLZKDYFMTIA-HNNXBMFYSA-N 1 2 322.452 4.327 20 0 DIADLO CCc1cccc(CC)c1NC(=O)C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000543061345 341029871 /nfs/dbraw/zinc/02/98/71/341029871.db2.gz JMXGLZKDYFMTIA-HNNXBMFYSA-N 1 2 322.452 4.327 20 0 DIADLO C[C@H](C(=O)Nc1cccc(Cl)c1)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000543061724 341029976 /nfs/dbraw/zinc/02/99/76/341029976.db2.gz OUGDKALBTDCNEY-CHWSQXEVSA-N 1 2 314.816 4.244 20 0 DIADLO C[C@H](C(=O)Nc1cccc(Cl)c1)[N@H+]1Cc2ccccc2[C@H]1C ZINC000543061724 341029977 /nfs/dbraw/zinc/02/99/77/341029977.db2.gz OUGDKALBTDCNEY-CHWSQXEVSA-N 1 2 314.816 4.244 20 0 DIADLO CCc1cnc(C[N@@H+]2[C@H](C)Cc3cc(OC)ccc3[C@H]2C)s1 ZINC000543414999 341043282 /nfs/dbraw/zinc/04/32/82/341043282.db2.gz VLMZBUTXPKFBGA-CHWSQXEVSA-N 1 2 316.470 4.222 20 0 DIADLO CCc1cnc(C[N@H+]2[C@H](C)Cc3cc(OC)ccc3[C@H]2C)s1 ZINC000543414999 341043283 /nfs/dbraw/zinc/04/32/83/341043283.db2.gz VLMZBUTXPKFBGA-CHWSQXEVSA-N 1 2 316.470 4.222 20 0 DIADLO CC(C)c1cnc(N2CCc3c([nH+]cn3-c3ccccc3)C2)s1 ZINC000543437153 341044462 /nfs/dbraw/zinc/04/44/62/341044462.db2.gz RRCPLWWHRUUHLE-UHFFFAOYSA-N 1 2 324.453 4.015 20 0 DIADLO c1csc([C@@H]([NH2+]Cc2noc(-c3ccccc3)n2)C2CC2)c1 ZINC000543448308 341045292 /nfs/dbraw/zinc/04/52/92/341045292.db2.gz KLKAVNLMTKSAPF-INIZCTEOSA-N 1 2 311.410 4.039 20 0 DIADLO Cc1ccc(-c2cnc(C[NH2+][C@H](C)c3cnn(C(C)C)c3)o2)cc1 ZINC000543504906 341047702 /nfs/dbraw/zinc/04/77/02/341047702.db2.gz DVZQXROPVPWUIG-OAHLLOKOSA-N 1 2 324.428 4.278 20 0 DIADLO COc1ccc2oc([C@H](C)[NH2+][C@H](C)c3ncc(C)o3)c(C)c2c1 ZINC000543510965 341048160 /nfs/dbraw/zinc/04/81/60/341048160.db2.gz XBHGCAQYRNYHJH-QWHCGFSZSA-N 1 2 314.385 4.458 20 0 DIADLO CC[C@@H]([NH2+][C@@H](c1ccccc1)c1ccc(F)cc1)c1ccn(C)n1 ZINC000543603342 341050783 /nfs/dbraw/zinc/05/07/83/341050783.db2.gz VZDUJTUNSQUMTM-QUCCMNQESA-N 1 2 323.415 4.390 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1C[N@@H+]([C@@H]2C=CCCC2)CCO1 ZINC000543806882 341059835 /nfs/dbraw/zinc/05/98/35/341059835.db2.gz DSFSWEBXDGIFHE-CZUORRHYSA-N 1 2 311.347 4.187 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1C[N@H+]([C@@H]2C=CCCC2)CCO1 ZINC000543806882 341059836 /nfs/dbraw/zinc/05/98/36/341059836.db2.gz DSFSWEBXDGIFHE-CZUORRHYSA-N 1 2 311.347 4.187 20 0 DIADLO CCc1ccc([C@H](CO)[NH2+]Cc2c(Cl)cccc2Cl)cc1 ZINC000543842825 341061285 /nfs/dbraw/zinc/06/12/85/341061285.db2.gz NEZBQBHGFZPEBP-KRWDZBQOSA-N 1 2 324.251 4.379 20 0 DIADLO Cc1cc(Cl)cc(C)c1CNc1ccc(-c2cncnc2)c[nH+]1 ZINC000543995874 341065635 /nfs/dbraw/zinc/06/56/35/341065635.db2.gz BPBSMTOEWHTHCO-UHFFFAOYSA-N 1 2 324.815 4.421 20 0 DIADLO CCc1cccc(Cl)c1CNc1ccc(-c2cncnc2)c[nH+]1 ZINC000543997418 341065674 /nfs/dbraw/zinc/06/56/74/341065674.db2.gz YHDMQUNCPZZMEU-UHFFFAOYSA-N 1 2 324.815 4.367 20 0 DIADLO CC(C)[C@H]1CCC[N@H+](Cc2ncc(Br)s2)CC1 ZINC000544022270 341066979 /nfs/dbraw/zinc/06/69/79/341066979.db2.gz MOMCAWMCBKQSKH-NSHDSACASA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)[C@H]1CCC[N@@H+](Cc2ncc(Br)s2)CC1 ZINC000544022270 341066980 /nfs/dbraw/zinc/06/69/80/341066980.db2.gz MOMCAWMCBKQSKH-NSHDSACASA-N 1 2 317.296 4.164 20 0 DIADLO C[N@H+](Cc1nc2cc(F)ccc2o1)Cc1ccccc1Cl ZINC000131263944 341071066 /nfs/dbraw/zinc/07/10/66/341071066.db2.gz RPTXLKLKEZJYBL-UHFFFAOYSA-N 1 2 304.752 4.252 20 0 DIADLO C[N@@H+](Cc1nc2cc(F)ccc2o1)Cc1ccccc1Cl ZINC000131263944 341071067 /nfs/dbraw/zinc/07/10/67/341071067.db2.gz RPTXLKLKEZJYBL-UHFFFAOYSA-N 1 2 304.752 4.252 20 0 DIADLO Cc1cccn2cc(-c3ccc(N[C@H](C)[C@@H]4CCCO4)cc3)[nH+]c12 ZINC000544387138 341079733 /nfs/dbraw/zinc/07/97/33/341079733.db2.gz HQSPKLPPKAHTTK-BEFAXECRSA-N 1 2 321.424 4.289 20 0 DIADLO Cc1cccn2cc(-c3ccc(N[C@@H](C)[C@H]4CCCO4)cc3)[nH+]c12 ZINC000544387140 341079800 /nfs/dbraw/zinc/07/98/00/341079800.db2.gz HQSPKLPPKAHTTK-HNAYVOBHSA-N 1 2 321.424 4.289 20 0 DIADLO COCC[C@H]([NH2+]Cc1c(F)cccc1Cl)c1ccc(C)o1 ZINC000544470467 341083577 /nfs/dbraw/zinc/08/35/77/341083577.db2.gz OKCSKAAOIOSODO-HNNXBMFYSA-N 1 2 311.784 4.248 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(OCc2ccccc2)c1)c1ccon1 ZINC000544617283 341089554 /nfs/dbraw/zinc/08/95/54/341089554.db2.gz MIJHIYOJUMGESE-HNNXBMFYSA-N 1 2 308.381 4.104 20 0 DIADLO Cc1ccc(-c2cnc(C[NH2+]C(C)(C)c3ccc(C)nc3)o2)cc1 ZINC000544758570 341093072 /nfs/dbraw/zinc/09/30/72/341093072.db2.gz FFTNTVKRMGCWAX-UHFFFAOYSA-N 1 2 321.424 4.378 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3ccc(C(C)C)s3)ccc2n1C ZINC000544855102 341096562 /nfs/dbraw/zinc/09/65/62/341096562.db2.gz ZEQZHDAYTZGION-UHFFFAOYSA-N 1 2 313.426 4.319 20 0 DIADLO C[C@@H](c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1)C(C)(C)C ZINC000544953896 341101019 /nfs/dbraw/zinc/10/10/19/341101019.db2.gz LSRVOEWPDJUVGS-ZDUSSCGKSA-N 1 2 310.401 4.131 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@@H](c1ccccc1)C1CC1 ZINC000131661829 341106963 /nfs/dbraw/zinc/10/69/63/341106963.db2.gz IXTGZPXUSXJBQB-SFHVURJKSA-N 1 2 317.392 4.209 20 0 DIADLO CC(C)[C@@H](CC1CCCCC1)c1nc(Cc2c[nH+]cn2C)no1 ZINC000545136144 341109906 /nfs/dbraw/zinc/10/99/06/341109906.db2.gz WKCFDYJNWDIZEA-MRXNPFEDSA-N 1 2 316.449 4.104 20 0 DIADLO CC[C@H]([NH2+][C@@H]1COc2ccc(F)cc21)c1cc(F)ccc1F ZINC000545235837 341116303 /nfs/dbraw/zinc/11/63/03/341116303.db2.gz OSSQAFOIPOGLHK-JKSUJKDBSA-N 1 2 307.315 4.278 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCc4ccsc4C3)cs2)cs1 ZINC000132563184 341127444 /nfs/dbraw/zinc/12/74/44/341127444.db2.gz JVWDQDKAHFLBNV-UHFFFAOYSA-N 1 2 318.492 4.491 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCc4ccsc4C3)cs2)cs1 ZINC000132563184 341127445 /nfs/dbraw/zinc/12/74/45/341127445.db2.gz JVWDQDKAHFLBNV-UHFFFAOYSA-N 1 2 318.492 4.491 20 0 DIADLO Cc1cccc(C)c1[C@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000545517544 341128027 /nfs/dbraw/zinc/12/80/27/341128027.db2.gz UTBIWWGNMAXXSV-KBPBESRZSA-N 1 2 301.434 4.396 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@H](C)c2c(C)cccc2C)n1 ZINC000545519213 341128251 /nfs/dbraw/zinc/12/82/51/341128251.db2.gz GHKRHMVGFJANRB-KGLIPLIRSA-N 1 2 319.474 4.351 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@@H](C)c2c(C)cccc2C)n1 ZINC000545519214 341128277 /nfs/dbraw/zinc/12/82/77/341128277.db2.gz GHKRHMVGFJANRB-UONOGXRCSA-N 1 2 319.474 4.351 20 0 DIADLO Cc1ccc(Cc2noc(Cc3cccc4ccccc43)n2)c[nH+]1 ZINC000545632995 341133982 /nfs/dbraw/zinc/13/39/82/341133982.db2.gz AFDKGJQHQLUOCQ-UHFFFAOYSA-N 1 2 315.376 4.108 20 0 DIADLO Cc1ccc(Cc2noc([C@@H](C)CCCc3ccccc3)n2)c[nH+]1 ZINC000545631883 341133999 /nfs/dbraw/zinc/13/39/99/341133999.db2.gz HGXVJKUJNJSJNJ-HNNXBMFYSA-N 1 2 321.424 4.490 20 0 DIADLO Cc1ccc(Cc2noc(C[C@H]3CCCc4ccccc43)n2)c[nH+]1 ZINC000545632241 341134009 /nfs/dbraw/zinc/13/40/09/341134009.db2.gz MMNMPDGRJBWTEY-QGZVFWFLSA-N 1 2 319.408 4.026 20 0 DIADLO COCc1nc(COc2cc(C)[nH+]c3c(C)cccc23)cs1 ZINC000546181639 341156375 /nfs/dbraw/zinc/15/63/75/341156375.db2.gz XNLLQSFMNVYPFG-UHFFFAOYSA-N 1 2 314.410 4.034 20 0 DIADLO CC1CCC(c2noc(-c3ccc(Cn4cc[nH+]c4)cc3)n2)CC1 ZINC000546351974 341164707 /nfs/dbraw/zinc/16/47/07/341164707.db2.gz LYDRAWHMCDIKBO-UHFFFAOYSA-N 1 2 322.412 4.275 20 0 DIADLO C[C@H](c1noc(CCn2c3ccccc3[nH+]c2C2CC2)n1)C1CC1 ZINC000546516676 341171853 /nfs/dbraw/zinc/17/18/53/341171853.db2.gz HORQCYXPQSZMCA-LBPRGKRZSA-N 1 2 322.412 4.053 20 0 DIADLO C[C@@H](c1noc(CCn2c3ccccc3[nH+]c2C2CC2)n1)C1CC1 ZINC000546516675 341171884 /nfs/dbraw/zinc/17/18/84/341171884.db2.gz HORQCYXPQSZMCA-GFCCVEGCSA-N 1 2 322.412 4.053 20 0 DIADLO Cc1ccc(C(=O)N2C[C@H](C)CC[C@@H]2C)cc1Oc1cc[nH+]cc1 ZINC000075285102 341173897 /nfs/dbraw/zinc/17/38/97/341173897.db2.gz BMIJKDMNSIUYRC-ZBFHGGJFSA-N 1 2 324.424 4.443 20 0 DIADLO C[C@H](c1nc(-c2cccs2)no1)[N@H+](C)Cc1ccccc1F ZINC000075608335 341179561 /nfs/dbraw/zinc/17/95/61/341179561.db2.gz SSUHDMHDBHEEAH-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO C[C@H](c1nc(-c2cccs2)no1)[N@@H+](C)Cc1ccccc1F ZINC000075608335 341179562 /nfs/dbraw/zinc/17/95/62/341179562.db2.gz SSUHDMHDBHEEAH-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO Clc1cnccc1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC000075746237 341181770 /nfs/dbraw/zinc/18/17/70/341181770.db2.gz FCAMFUGOHIYQDZ-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cnccc1C[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC000075746237 341181771 /nfs/dbraw/zinc/18/17/71/341181771.db2.gz FCAMFUGOHIYQDZ-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccncc2Cl)s1 ZINC000075766938 341182326 /nfs/dbraw/zinc/18/23/26/341182326.db2.gz KXMZKWNBMOHBQD-LLVKDONJSA-N 1 2 309.866 4.255 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccncc2Cl)s1 ZINC000075766938 341182327 /nfs/dbraw/zinc/18/23/27/341182327.db2.gz KXMZKWNBMOHBQD-LLVKDONJSA-N 1 2 309.866 4.255 20 0 DIADLO CC(C)c1ccc(-c2nc(Cc3cn4ccccc4[nH+]3)no2)s1 ZINC000547010529 341191477 /nfs/dbraw/zinc/19/14/77/341191477.db2.gz CMTCMXUKUZBJOU-UHFFFAOYSA-N 1 2 324.409 4.160 20 0 DIADLO Cc1ccc(Cc2nc(Cc3ccc(C(C)C)cc3)no2)c[nH+]1 ZINC000547034271 341193042 /nfs/dbraw/zinc/19/30/42/341193042.db2.gz MUWJHCMZXPKQBF-UHFFFAOYSA-N 1 2 307.397 4.078 20 0 DIADLO Cc1ccc2[nH+]c(CNc3ccccc3OCC3CC3)cn2c1 ZINC000133968944 341203292 /nfs/dbraw/zinc/20/32/92/341203292.db2.gz PJKWBPDZSOFRIE-UHFFFAOYSA-N 1 2 307.397 4.044 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(-c2ccc(C)cc2)n1 ZINC000547302111 341204133 /nfs/dbraw/zinc/20/41/33/341204133.db2.gz PCWBJPFSXJOXQD-UHFFFAOYSA-N 1 2 318.380 4.005 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(s1)C[C@H](C)CC2)c1ccc(F)cc1F ZINC000134196406 341209107 /nfs/dbraw/zinc/20/91/07/341209107.db2.gz IDCDODPMQMHNEJ-GHMZBOCLSA-N 1 2 322.424 4.397 20 0 DIADLO COCC[C@H](C)Nc1ccc(-c2cn3cccc(C)c3[nH+]2)cc1 ZINC000547367627 341209209 /nfs/dbraw/zinc/20/92/09/341209209.db2.gz IDVKTOQJQBPHBU-HNNXBMFYSA-N 1 2 309.413 4.147 20 0 DIADLO COc1cc(Oc2ccccc2)ccc1[NH2+]CCCCCO ZINC000134663916 341221345 /nfs/dbraw/zinc/22/13/45/341221345.db2.gz VEXDSOJRHOKUSS-UHFFFAOYSA-N 1 2 301.386 4.062 20 0 DIADLO CC(C)(C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1)c1cccc(F)c1 ZINC000134816353 341224608 /nfs/dbraw/zinc/22/46/08/341224608.db2.gz KHXAQXZCAQKWBX-UHFFFAOYSA-N 1 2 323.371 4.132 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1nc(C)c2ccccc2n1 ZINC000547770713 341231644 /nfs/dbraw/zinc/23/16/44/341231644.db2.gz NMICUHQGOVYMME-UHFFFAOYSA-N 1 2 323.465 4.292 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1nc(C)c2ccccc2n1 ZINC000547770713 341231645 /nfs/dbraw/zinc/23/16/45/341231645.db2.gz NMICUHQGOVYMME-UHFFFAOYSA-N 1 2 323.465 4.292 20 0 DIADLO CC[C@H](C[N@H+](CC)Cc1nnsc1Cl)c1ccccc1 ZINC000547841827 341236947 /nfs/dbraw/zinc/23/69/47/341236947.db2.gz AMSLVIHNPLQMFC-GFCCVEGCSA-N 1 2 309.866 4.207 20 0 DIADLO CC[C@H](C[N@@H+](CC)Cc1nnsc1Cl)c1ccccc1 ZINC000547841827 341236948 /nfs/dbraw/zinc/23/69/48/341236948.db2.gz AMSLVIHNPLQMFC-GFCCVEGCSA-N 1 2 309.866 4.207 20 0 DIADLO CC[C@@]1(C)COCC[N@@H+]1Cc1csc(-c2ccc(C)cc2)n1 ZINC000547849028 341237519 /nfs/dbraw/zinc/23/75/19/341237519.db2.gz WLPPKUNWGQHQJR-SFHVURJKSA-N 1 2 316.470 4.119 20 0 DIADLO CC[C@@]1(C)COCC[N@H+]1Cc1csc(-c2ccc(C)cc2)n1 ZINC000547849028 341237520 /nfs/dbraw/zinc/23/75/20/341237520.db2.gz WLPPKUNWGQHQJR-SFHVURJKSA-N 1 2 316.470 4.119 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000547972520 341241465 /nfs/dbraw/zinc/24/14/65/341241465.db2.gz KDYFSRMRUJXUKE-KPZWWZAWSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000547972520 341241466 /nfs/dbraw/zinc/24/14/66/341241466.db2.gz KDYFSRMRUJXUKE-KPZWWZAWSA-N 1 2 321.342 4.238 20 0 DIADLO Cc1cccnc1C[N@@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000548623220 341267477 /nfs/dbraw/zinc/26/74/77/341267477.db2.gz BJOSXLNPRJPKLI-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cccnc1C[N@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000548623220 341267478 /nfs/dbraw/zinc/26/74/78/341267478.db2.gz BJOSXLNPRJPKLI-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000548628464 341267817 /nfs/dbraw/zinc/26/78/17/341267817.db2.gz FFLYMBGGGFLRKT-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccccc1)[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000548628464 341267818 /nfs/dbraw/zinc/26/78/18/341267818.db2.gz FFLYMBGGGFLRKT-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H]1C[C@H](C)[NH+]1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000548754181 341272397 /nfs/dbraw/zinc/27/23/97/341272397.db2.gz VYURXTYPLYTFEN-RYUDHWBXSA-N 1 2 322.861 4.358 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@@H+]1CC[C@H](OC(F)F)C1 ZINC000549080766 341285662 /nfs/dbraw/zinc/28/56/62/341285662.db2.gz FUNOIGGWBZTDEW-WPRPVWTQSA-N 1 2 310.171 4.368 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@H+]1CC[C@H](OC(F)F)C1 ZINC000549080766 341285663 /nfs/dbraw/zinc/28/56/63/341285663.db2.gz FUNOIGGWBZTDEW-WPRPVWTQSA-N 1 2 310.171 4.368 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000549180378 341288021 /nfs/dbraw/zinc/28/80/21/341288021.db2.gz LRMMPEBDASQSSF-SUMWQHHRSA-N 1 2 304.796 4.367 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000549180378 341288022 /nfs/dbraw/zinc/28/80/22/341288022.db2.gz LRMMPEBDASQSSF-SUMWQHHRSA-N 1 2 304.796 4.367 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000549180369 341288081 /nfs/dbraw/zinc/28/80/81/341288081.db2.gz LRMMPEBDASQSSF-CXAGYDPISA-N 1 2 304.796 4.367 20 0 DIADLO C[C@H](c1ccccn1)[N@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000549180369 341288082 /nfs/dbraw/zinc/28/80/82/341288082.db2.gz LRMMPEBDASQSSF-CXAGYDPISA-N 1 2 304.796 4.367 20 0 DIADLO CN(C)C[C@H]([NH2+]Cc1cccc(F)c1F)c1ccc(Cl)cc1 ZINC000549266375 341290015 /nfs/dbraw/zinc/29/00/15/341290015.db2.gz ABTHPUVIYZLNKK-INIZCTEOSA-N 1 2 324.802 4.011 20 0 DIADLO CN(C)C[C@@H]([NH2+]Cc1cccc(F)c1F)c1ccc(Cl)cc1 ZINC000549266376 341290042 /nfs/dbraw/zinc/29/00/42/341290042.db2.gz ABTHPUVIYZLNKK-MRXNPFEDSA-N 1 2 324.802 4.011 20 0 DIADLO FC(F)O[C@H]1CC[N@H+](Cc2csc(C3CCCCC3)n2)C1 ZINC000549410158 341293831 /nfs/dbraw/zinc/29/38/31/341293831.db2.gz WLRXCPUBDIGIBH-ZDUSSCGKSA-N 1 2 316.417 4.004 20 0 DIADLO FC(F)O[C@H]1CC[N@@H+](Cc2csc(C3CCCCC3)n2)C1 ZINC000549410158 341293832 /nfs/dbraw/zinc/29/38/32/341293832.db2.gz WLRXCPUBDIGIBH-ZDUSSCGKSA-N 1 2 316.417 4.004 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2ccccc2C(F)(F)F)sc1C ZINC000081647885 341300557 /nfs/dbraw/zinc/30/05/57/341300557.db2.gz QVGBODGJEKVHOE-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2ccccc2C(F)(F)F)sc1C ZINC000081647885 341300558 /nfs/dbraw/zinc/30/05/58/341300558.db2.gz QVGBODGJEKVHOE-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1nc(C)c(C)s1 ZINC000081648818 341300760 /nfs/dbraw/zinc/30/07/60/341300760.db2.gz XLRAVTFKYKLUQS-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1nc(C)c(C)s1 ZINC000081648818 341300761 /nfs/dbraw/zinc/30/07/61/341300761.db2.gz XLRAVTFKYKLUQS-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000245539860 341300776 /nfs/dbraw/zinc/30/07/76/341300776.db2.gz HZSKNZUJLNISNM-CLCXKQKWSA-N 1 2 322.408 4.351 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000245539860 341300777 /nfs/dbraw/zinc/30/07/77/341300777.db2.gz HZSKNZUJLNISNM-CLCXKQKWSA-N 1 2 322.408 4.351 20 0 DIADLO Cc1csc(C[N@@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)n1 ZINC000081649270 341300792 /nfs/dbraw/zinc/30/07/92/341300792.db2.gz REFLUKVBVAZVCS-NHYWBVRUSA-N 1 2 302.443 4.333 20 0 DIADLO Cc1csc(C[N@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)n1 ZINC000081649270 341300793 /nfs/dbraw/zinc/30/07/93/341300793.db2.gz REFLUKVBVAZVCS-NHYWBVRUSA-N 1 2 302.443 4.333 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(C2CCC2)cc1)c1nc(C(C)(C)C)no1 ZINC000549760960 341302435 /nfs/dbraw/zinc/30/24/35/341302435.db2.gz NWLRKEGZLFVRBY-ZDUSSCGKSA-N 1 2 313.445 4.485 20 0 DIADLO C[N@H+](CC(F)F)CC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000549801846 341303305 /nfs/dbraw/zinc/30/33/05/341303305.db2.gz CNIOMCZQPDIAFG-UHFFFAOYSA-N 1 2 311.322 4.294 20 0 DIADLO C[N@@H+](CC(F)F)CC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000549801846 341303306 /nfs/dbraw/zinc/30/33/06/341303306.db2.gz CNIOMCZQPDIAFG-UHFFFAOYSA-N 1 2 311.322 4.294 20 0 DIADLO Cc1ncccc1C[N@@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000549821888 341304211 /nfs/dbraw/zinc/30/42/11/341304211.db2.gz HKITTWWCHXGVBH-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ncccc1C[N@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000549821888 341304212 /nfs/dbraw/zinc/30/42/12/341304212.db2.gz HKITTWWCHXGVBH-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Fc1cccc([C@@H]2CCN(c3cc(C(F)(F)F)cc[nH+]3)C2)c1 ZINC000549921201 341306623 /nfs/dbraw/zinc/30/66/23/341306623.db2.gz RVUNCIPAOPCZII-GFCCVEGCSA-N 1 2 310.294 4.233 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)[C@@H]1C ZINC000549924334 341306939 /nfs/dbraw/zinc/30/69/39/341306939.db2.gz WQRUNRBIUGCJBF-VXGBXAGGSA-N 1 2 306.862 4.228 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)[C@@H]1C ZINC000549924334 341306940 /nfs/dbraw/zinc/30/69/40/341306940.db2.gz WQRUNRBIUGCJBF-VXGBXAGGSA-N 1 2 306.862 4.228 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1c(F)cccc1Cl ZINC000549999291 341308491 /nfs/dbraw/zinc/30/84/91/341308491.db2.gz ZDSJZLNVOJRLHK-MRXNPFEDSA-N 1 2 321.827 4.423 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1ccc(F)cc1Cl ZINC000549999209 341308516 /nfs/dbraw/zinc/30/85/16/341308516.db2.gz WECSIELDJWAOFF-MRXNPFEDSA-N 1 2 321.827 4.423 20 0 DIADLO Cc1nc(C[N@@H+]2CCCCC[C@@H]2Cc2ccccc2Cl)no1 ZINC000550264798 341313756 /nfs/dbraw/zinc/31/37/56/341313756.db2.gz KFJICVJEZKBTKF-OAHLLOKOSA-N 1 2 319.836 4.019 20 0 DIADLO Cc1nc(C[N@H+]2CCCCC[C@@H]2Cc2ccccc2Cl)no1 ZINC000550264798 341313757 /nfs/dbraw/zinc/31/37/57/341313757.db2.gz KFJICVJEZKBTKF-OAHLLOKOSA-N 1 2 319.836 4.019 20 0 DIADLO CC(C)C(=O)Nc1cccc(N[C@H](C)c2cn3ccccc3[nH+]2)c1 ZINC000550921589 341326825 /nfs/dbraw/zinc/32/68/25/341326825.db2.gz TYJMIOFHDXVJIN-CQSZACIVSA-N 1 2 322.412 4.102 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccncc1F)c1nc(C(C)(C)C)cs1 ZINC000551030386 341329656 /nfs/dbraw/zinc/32/96/56/341329656.db2.gz NMIXMQDMKMCNHN-WDEREUQCSA-N 1 2 307.438 4.387 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccncc1F)c1nc(C(C)(C)C)cs1 ZINC000551030385 341329681 /nfs/dbraw/zinc/32/96/81/341329681.db2.gz NMIXMQDMKMCNHN-QWRGUYRKSA-N 1 2 307.438 4.387 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccncc1F)c1nc(C(C)(C)C)cs1 ZINC000551030383 341329705 /nfs/dbraw/zinc/32/97/05/341329705.db2.gz NMIXMQDMKMCNHN-GHMZBOCLSA-N 1 2 307.438 4.387 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCc3ccccc3C2)c2ccccn21 ZINC000551328673 341338684 /nfs/dbraw/zinc/33/86/84/341338684.db2.gz HGJKQOIGDKUZFJ-UHFFFAOYSA-N 1 2 305.425 4.016 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCc3ccccc3C2)c2ccccn21 ZINC000551328673 341338685 /nfs/dbraw/zinc/33/86/85/341338685.db2.gz HGJKQOIGDKUZFJ-UHFFFAOYSA-N 1 2 305.425 4.016 20 0 DIADLO CCCc1nc(C[NH+]2CCC(CC(F)(F)F)CC2)cs1 ZINC000551406401 341340796 /nfs/dbraw/zinc/34/07/96/341340796.db2.gz KKLDDRVVPOCNPJ-UHFFFAOYSA-N 1 2 306.397 4.260 20 0 DIADLO C[NH+](C)[C@@H](c1nc(CC2CCCC2)no1)c1cccc(Cl)c1 ZINC000551511000 341343343 /nfs/dbraw/zinc/34/33/43/341343343.db2.gz SOHYRIDDCGHSLC-MRXNPFEDSA-N 1 2 319.836 4.107 20 0 DIADLO CC[C@H]1CCCC[C@@H]1c1noc(Cn2c(C)[nH+]c3ccccc32)n1 ZINC000551536069 341344643 /nfs/dbraw/zinc/34/46/43/341344643.db2.gz PCTQYZVVROLLEC-GJZGRUSLSA-N 1 2 324.428 4.460 20 0 DIADLO Cc1noc(C(C)(C)[NH2+]Cc2ccc(C3CCCCC3)cc2)n1 ZINC000551716680 341349931 /nfs/dbraw/zinc/34/99/31/341349931.db2.gz OFONAFMWOGGTHI-UHFFFAOYSA-N 1 2 313.445 4.451 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(-c2ccccc2)s1)c1cscn1 ZINC000551917704 341354916 /nfs/dbraw/zinc/35/49/16/341354916.db2.gz YNXOUVYLZZBMSF-LLVKDONJSA-N 1 2 301.440 4.117 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000247184147 341361869 /nfs/dbraw/zinc/36/18/69/341361869.db2.gz WABMCHABKZVVJI-LRTDBIEQSA-N 1 2 321.873 4.270 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000247184147 341361870 /nfs/dbraw/zinc/36/18/70/341361870.db2.gz WABMCHABKZVVJI-LRTDBIEQSA-N 1 2 321.873 4.270 20 0 DIADLO CC(C)(C)n1cc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)cn1 ZINC000552067516 341366992 /nfs/dbraw/zinc/36/69/92/341366992.db2.gz NGJMMLWNQLSWHO-OAHLLOKOSA-N 1 2 301.438 4.095 20 0 DIADLO Cc1nc([C@H]([NH2+][C@@H]2CC[C@H]2C(C)C)c2ccc(Cl)cc2)no1 ZINC000552070894 341367538 /nfs/dbraw/zinc/36/75/38/341367538.db2.gz IHKFZKHVEWWKIX-ARFHVFGLSA-N 1 2 319.836 4.145 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CC4(CCC4)[C@H]3c3ccccc3)cn2c1 ZINC000552085984 341368586 /nfs/dbraw/zinc/36/85/86/341368586.db2.gz UDNYOKUYEDNJLI-HXUWFJFHSA-N 1 2 317.436 4.370 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CC4(CCC4)[C@H]3c3ccccc3)cn2c1 ZINC000552085984 341368587 /nfs/dbraw/zinc/36/85/87/341368587.db2.gz UDNYOKUYEDNJLI-HXUWFJFHSA-N 1 2 317.436 4.370 20 0 DIADLO Cc1ccc(-c2noc(C[N@@H+]([C@@H](C)c3ccco3)C3CC3)n2)cc1 ZINC000086233005 341379670 /nfs/dbraw/zinc/37/96/70/341379670.db2.gz IJEBKMVSLCHJDP-AWEZNQCLSA-N 1 2 323.396 4.364 20 0 DIADLO Cc1ccc(-c2noc(C[N@H+]([C@@H](C)c3ccco3)C3CC3)n2)cc1 ZINC000086233005 341379671 /nfs/dbraw/zinc/37/96/71/341379671.db2.gz IJEBKMVSLCHJDP-AWEZNQCLSA-N 1 2 323.396 4.364 20 0 DIADLO CCC[C@H](C)C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000552529522 341397579 /nfs/dbraw/zinc/39/75/79/341397579.db2.gz QLXDGZNMMLLJSH-AWEZNQCLSA-N 1 2 311.429 4.261 20 0 DIADLO Cc1cccc(C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)c1 ZINC000089870512 341410271 /nfs/dbraw/zinc/41/02/71/341410271.db2.gz NDQZEMBXWNZMJM-UHFFFAOYSA-N 1 2 305.381 4.011 20 0 DIADLO CC(C)(C)CCCCC(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000553459189 341429555 /nfs/dbraw/zinc/42/95/55/341429555.db2.gz FQFHTJVRBCNJMS-UHFFFAOYSA-N 1 2 313.445 4.095 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](c1cccs1)C1CC1 ZINC000554388192 341452873 /nfs/dbraw/zinc/45/28/73/341452873.db2.gz QXDXPJANNXJJOL-OAHLLOKOSA-N 1 2 301.415 4.033 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](c1ccccc1)C(F)(F)F ZINC000554387797 341452957 /nfs/dbraw/zinc/45/29/57/341452957.db2.gz JBSTYHNFDIAAPM-CQSZACIVSA-N 1 2 323.318 4.124 20 0 DIADLO Cc1cc[nH+]cc1CCCNc1ccc2nc(C3CC3)oc2c1 ZINC000554860269 341467104 /nfs/dbraw/zinc/46/71/04/341467104.db2.gz CDXXKYXWWGXDMQ-UHFFFAOYSA-N 1 2 307.397 4.453 20 0 DIADLO CCc1[nH+]c(C(C)C)ccc1Cn1cnc(-c2ccccc2)n1 ZINC000555010560 341472787 /nfs/dbraw/zinc/47/27/87/341472787.db2.gz HFWWPTQLOAVPKA-UHFFFAOYSA-N 1 2 306.413 4.074 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC000555550050 341484882 /nfs/dbraw/zinc/48/48/82/341484882.db2.gz HAHAFIKTVHJXOL-LLVKDONJSA-N 1 2 322.449 4.439 20 0 DIADLO CC(C)Oc1cccc([C@@H]([NH2+]C[C@@H]2CCCS2)C(F)F)c1 ZINC000556260539 341499725 /nfs/dbraw/zinc/49/97/25/341499725.db2.gz FJFNUMXMMFONKM-LSDHHAIUSA-N 1 2 315.429 4.265 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+]C[C@@H]2CCCS2)C(F)F)c1 ZINC000556260531 341499754 /nfs/dbraw/zinc/49/97/54/341499754.db2.gz FJFNUMXMMFONKM-GJZGRUSLSA-N 1 2 315.429 4.265 20 0 DIADLO CCc1cnc(COc2ccc(-c3[nH+]cc4n3CCCC4)cc2)o1 ZINC000556283839 341500648 /nfs/dbraw/zinc/50/06/48/341500648.db2.gz BCLGICPNYVWUIY-UHFFFAOYSA-N 1 2 323.396 4.016 20 0 DIADLO Cc1ccccc1-c1nc(C[NH2+]Cc2cccc(C3CC3)c2)no1 ZINC000564648824 341506032 /nfs/dbraw/zinc/50/60/32/341506032.db2.gz ZSNUZYGFWJOCMR-UHFFFAOYSA-N 1 2 319.408 4.212 20 0 DIADLO Cc1nnsc1C[NH+](Cc1cccs1)Cc1cccs1 ZINC000565045474 341515660 /nfs/dbraw/zinc/51/56/60/341515660.db2.gz CAADXBOMQWHINO-UHFFFAOYSA-N 1 2 321.496 4.172 20 0 DIADLO Cc1ccccc1[C@H](C)c1noc([C@H](c2ccccc2)[NH+](C)C)n1 ZINC000565330382 341523865 /nfs/dbraw/zinc/52/38/65/341523865.db2.gz GQLLDHFKSPKIRH-YJBOKZPZSA-N 1 2 321.424 4.181 20 0 DIADLO C[NH+](C)[C@H](c1nc(C2CCCC2)no1)c1ccc(Cl)cc1 ZINC000565608329 341532603 /nfs/dbraw/zinc/53/26/03/341532603.db2.gz GRXBTRBCVQSDJL-AWEZNQCLSA-N 1 2 305.809 4.032 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H]2c2nc(CCc3[nH+]cccc3C)no2)cc1 ZINC000566097230 341547646 /nfs/dbraw/zinc/54/76/46/341547646.db2.gz GOALDLXTNITQTH-IRXDYDNUSA-N 1 2 319.408 4.138 20 0 DIADLO Cc1ccccc1[C@@H](CC(C)C)NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000567392445 341600886 /nfs/dbraw/zinc/60/08/86/341600886.db2.gz RBSLRJWBJPWQLG-FUHWJXTLSA-N 1 2 313.445 4.046 20 0 DIADLO CCc1cccc(C[NH2+][C@H](c2nccn2C)c2ccc(F)cc2)c1 ZINC000567741125 341630811 /nfs/dbraw/zinc/63/08/11/341630811.db2.gz LHZDYZBBMKYSET-IBGZPJMESA-N 1 2 323.415 4.001 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H]2C[C@H](C)Sc3sccc32)s1 ZINC000274140700 341641084 /nfs/dbraw/zinc/64/10/84/341641084.db2.gz DCKVWYGELASDKH-LAEOZQHASA-N 1 2 311.501 4.184 20 0 DIADLO CCC[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccccn1 ZINC000158937938 341666602 /nfs/dbraw/zinc/66/66/02/341666602.db2.gz XJWRTEGCQYICDD-KRWDZBQOSA-N 1 2 307.397 4.368 20 0 DIADLO Cc1cccn2cc(Cc3noc([C@H](C)CC(C)(C)C)n3)[nH+]c12 ZINC000574556760 341762097 /nfs/dbraw/zinc/76/20/97/341762097.db2.gz ZIRRNDYZNWABOT-CYBMUJFWSA-N 1 2 312.417 4.156 20 0 DIADLO CCCC[C@H](C)c1nc(CCn2c(C)[nH+]c3ccccc32)no1 ZINC000575051630 341773950 /nfs/dbraw/zinc/77/39/50/341773950.db2.gz YYJJVCOHYKBWNA-ZDUSSCGKSA-N 1 2 312.417 4.264 20 0 DIADLO Clc1ccc(-c2nc(C[NH+]3CCSCC3)cs2)cc1 ZINC000171627904 341781607 /nfs/dbraw/zinc/78/16/07/341781607.db2.gz CZSKBIZDIUBNQO-UHFFFAOYSA-N 1 2 310.875 4.012 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CCCC2)no1)c1ccc(C2CC2)cc1 ZINC000577209068 341897337 /nfs/dbraw/zinc/89/73/37/341897337.db2.gz BFANYXOJHKZCGN-CYBMUJFWSA-N 1 2 311.429 4.455 20 0 DIADLO Cc1ccc[nH+]c1CCc1noc([C@@H]2C[C@@]2(C)c2ccccc2)n1 ZINC000577262540 341901020 /nfs/dbraw/zinc/90/10/20/341901020.db2.gz HJAKNOAKFHOCRS-JXFKEZNVSA-N 1 2 319.408 4.003 20 0 DIADLO Cc1cc(NC(=O)N2CC(C)(C)C[C@@H]2c2ccccc2)c(C)c[nH+]1 ZINC000577505803 341913877 /nfs/dbraw/zinc/91/38/77/341913877.db2.gz MKLZWTKXBUXJLG-GOSISDBHSA-N 1 2 323.440 4.125 20 0 DIADLO CC(C)C[C@H]1CCCCCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000577564346 341918146 /nfs/dbraw/zinc/91/81/46/341918146.db2.gz BBFGYXAHCJROQX-MRXNPFEDSA-N 1 2 314.433 4.157 20 0 DIADLO CCc1[nH]ccc1C(=O)Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000577780720 341936414 /nfs/dbraw/zinc/93/64/14/341936414.db2.gz LHILVCXVHZIMFW-UHFFFAOYSA-N 1 2 324.428 4.014 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc([C@H](C)CC(C)C)n1 ZINC000577798828 341937287 /nfs/dbraw/zinc/93/72/87/341937287.db2.gz HGEDXAVPTITNAM-CYBMUJFWSA-N 1 2 312.417 4.120 20 0 DIADLO CCCCn1c(SC2CCCC2)nnc1[C@@H](CC)[NH+](C)C ZINC000176539870 517574887 /nfs/dbraw/zinc/57/48/87/517574887.db2.gz IZHNGHMQSGQALQ-CQSZACIVSA-N 1 2 310.511 4.126 20 0 DIADLO COC(=O)c1ccccc1-c1ccc(CNc2ccc[nH+]c2C)o1 ZINC000360893926 518031002 /nfs/dbraw/zinc/03/10/02/518031002.db2.gz KAETYULTBPXSRS-UHFFFAOYSA-N 1 2 322.364 4.049 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@@H](C(C)C)[C@@H]2C(C)C)c(C)[nH+]1 ZINC000455493271 518186786 /nfs/dbraw/zinc/18/67/86/518186786.db2.gz CFASDLRSUOPVHS-RDJZCZTQSA-N 1 2 303.450 4.151 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)/C=C\c1ccsc1 ZINC000493548845 518188128 /nfs/dbraw/zinc/18/81/28/518188128.db2.gz HOIMNAHTMDASQU-HYXAFXHYSA-N 1 2 309.394 4.099 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@H](Cc3ccccc3)C2)c(C)[nH+]1 ZINC000447178180 518189286 /nfs/dbraw/zinc/18/92/86/518189286.db2.gz QNBRSTADBBQNPO-GOSISDBHSA-N 1 2 323.440 4.185 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c1C ZINC000115602710 518190630 /nfs/dbraw/zinc/19/06/30/518190630.db2.gz AJEJJGGYKCFJKN-KGLIPLIRSA-N 1 2 301.434 4.396 20 0 DIADLO O=C(N[C@@H]1CC12CCCCC2)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000538894813 518200336 /nfs/dbraw/zinc/20/03/36/518200336.db2.gz WSIHRSBEWLRUMS-GOSISDBHSA-N 1 2 322.408 4.327 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1ccc(-n2cccn2)cc1 ZINC000338331509 518899746 /nfs/dbraw/zinc/89/97/46/518899746.db2.gz LLZBFDSBNCLJEN-UHFFFAOYSA-N 1 2 322.412 4.057 20 0 DIADLO CC[C@@H](CC(F)F)C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000457500353 519088324 /nfs/dbraw/zinc/08/83/24/519088324.db2.gz CJYLDYWFABRIDJ-LBPRGKRZSA-N 1 2 320.339 4.494 20 0 DIADLO CC(C)Cc1ncc(C[NH2+]Cc2c(F)cc(F)cc2F)s1 ZINC000339523255 519462566 /nfs/dbraw/zinc/46/25/66/519462566.db2.gz JUQDGBCDIXJEMC-UHFFFAOYSA-N 1 2 314.376 4.049 20 0 DIADLO CC(C)CCc1nc(C[NH2+][C@H](C)c2ccncc2F)cs1 ZINC000338358507 519698048 /nfs/dbraw/zinc/69/80/48/519698048.db2.gz QXNXUDOWUMXTEW-GFCCVEGCSA-N 1 2 307.438 4.117 20 0 DIADLO CC(C)[C@@H](C)N(C)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000264870221 519791075 /nfs/dbraw/zinc/79/10/75/519791075.db2.gz VQKGQJPCPNNWOK-CQSZACIVSA-N 1 2 313.401 4.382 20 0 DIADLO CC(C)[C@@H](C)Nc1cccc(C[N@H+](C)Cc2cscn2)c1 ZINC000191453499 519792424 /nfs/dbraw/zinc/79/24/24/519792424.db2.gz COGXBNDLMXJWJN-CQSZACIVSA-N 1 2 303.475 4.232 20 0 DIADLO CC(C)[C@@H](C)Nc1cccc(C[N@@H+](C)Cc2cscn2)c1 ZINC000191453499 519792425 /nfs/dbraw/zinc/79/24/25/519792425.db2.gz COGXBNDLMXJWJN-CQSZACIVSA-N 1 2 303.475 4.232 20 0 DIADLO CC(C)c1nc([C@H]2CCC[N@@H+]2Cc2ccc3ncccc3c2)no1 ZINC000127804831 519868661 /nfs/dbraw/zinc/86/86/61/519868661.db2.gz AFQGGAHEHMNRFR-QGZVFWFLSA-N 1 2 322.412 4.078 20 0 DIADLO CC(C)c1nc([C@H]2CCC[N@H+]2Cc2ccc3ncccc3c2)no1 ZINC000127804831 519868662 /nfs/dbraw/zinc/86/86/62/519868662.db2.gz AFQGGAHEHMNRFR-QGZVFWFLSA-N 1 2 322.412 4.078 20 0 DIADLO CC(C)c1nc(N[C@@H](c2nccs2)c2ccccc2)cc[nH+]1 ZINC000110541129 519878360 /nfs/dbraw/zinc/87/83/60/519878360.db2.gz QZCYNHFHHIWEBR-OAHLLOKOSA-N 1 2 310.426 4.258 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](C)c2ccc(-c3cccnc3)cc2)n1 ZINC000181285713 519904615 /nfs/dbraw/zinc/90/46/15/519904615.db2.gz QTZOFZPTKBGSHV-CQSZACIVSA-N 1 2 322.412 4.106 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)n1 ZINC000180286431 519905004 /nfs/dbraw/zinc/90/50/04/519905004.db2.gz XFEXRKPCJDIPED-KRWDZBQOSA-N 1 2 317.408 4.353 20 0 DIADLO CCN(C(=O)Nc1ccc(C)[nH+]c1C)[C@@H](C)Cc1ccsc1 ZINC000189112638 519996244 /nfs/dbraw/zinc/99/62/44/519996244.db2.gz TXSBDLWCXURCCH-ZDUSSCGKSA-N 1 2 317.458 4.245 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)n1 ZINC000265233991 520002579 /nfs/dbraw/zinc/00/25/79/520002579.db2.gz CWGXZDNPURLSSM-FQEVSTJZSA-N 1 2 323.415 4.482 20 0 DIADLO CC(C)n1cc[nH+]c1CN(Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000337349985 520026748 /nfs/dbraw/zinc/02/67/48/520026748.db2.gz RBJMTFNFCMNSHQ-WMLDXEAASA-N 1 2 313.445 4.345 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC000107299237 520029459 /nfs/dbraw/zinc/02/94/59/520029459.db2.gz JIVUQVFZYUXYPK-INIZCTEOSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000107299237 520029466 /nfs/dbraw/zinc/02/94/66/520029466.db2.gz JIVUQVFZYUXYPK-INIZCTEOSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1nccc1C[N@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000337138572 520097456 /nfs/dbraw/zinc/09/74/56/520097456.db2.gz QTJKQVOYLAKWHO-RDTXWAMCSA-N 1 2 313.445 4.345 20 0 DIADLO CC(C)n1nccc1C[N@@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000337138572 520097463 /nfs/dbraw/zinc/09/74/63/520097463.db2.gz QTJKQVOYLAKWHO-RDTXWAMCSA-N 1 2 313.445 4.345 20 0 DIADLO CC1(C)CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)CC1 ZINC000338194599 520375951 /nfs/dbraw/zinc/37/59/51/520375951.db2.gz AHPGEQCKHMFJSR-UHFFFAOYSA-N 1 2 310.397 4.136 20 0 DIADLO CCCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1ccon1 ZINC000181718814 520485819 /nfs/dbraw/zinc/48/58/19/520485819.db2.gz GIVGDAJYDPMKLU-KRWDZBQOSA-N 1 2 302.418 4.340 20 0 DIADLO CCCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nnc(C)o1 ZINC000181719969 520486158 /nfs/dbraw/zinc/48/61/58/520486158.db2.gz YCSVWMQBQBKZFI-INIZCTEOSA-N 1 2 317.433 4.044 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ccn(C(C)C)n1)c1ccc(F)cc1F ZINC000181677500 520783018 /nfs/dbraw/zinc/78/30/18/520783018.db2.gz QUATZCUVXRUGLV-QGZVFWFLSA-N 1 2 307.388 4.373 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nnc(C(C)C)o1)c1ccc(F)cc1F ZINC000181666259 520785549 /nfs/dbraw/zinc/78/55/49/520785549.db2.gz LBNSCDZTPDQXJA-CQSZACIVSA-N 1 2 309.360 4.102 20 0 DIADLO CCN(CC1CCC1)C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000337997658 520975336 /nfs/dbraw/zinc/97/53/36/520975336.db2.gz SQRWVJSETKSNTB-UHFFFAOYSA-N 1 2 310.397 4.136 20 0 DIADLO CCC[C@H](C)CC(=O)NCc1ccc2c(c1)[nH+]c(C)n2C1CC1 ZINC000339294471 521013568 /nfs/dbraw/zinc/01/35/68/521013568.db2.gz VIDWTHFQZNDGOR-ZDUSSCGKSA-N 1 2 313.445 4.122 20 0 DIADLO CCCC[C@@H]([NH2+]Cc1nc(CCC)no1)c1ccc(OC)cc1 ZINC000182138029 521101219 /nfs/dbraw/zinc/10/12/19/521101219.db2.gz MCVMYZGLDAYFPN-MRXNPFEDSA-N 1 2 317.433 4.052 20 0 DIADLO CCCC[C@@H]([NH2+]Cc1noc(C(C)C)n1)c1ccc(OC)cc1 ZINC000182147152 521101572 /nfs/dbraw/zinc/10/15/72/521101572.db2.gz VRVSEBUMPDTOAD-MRXNPFEDSA-N 1 2 317.433 4.223 20 0 DIADLO CCCC[C@@H]([NH2+]Cc1noc(CCC)n1)c1ccc(OC)cc1 ZINC000182144873 521102350 /nfs/dbraw/zinc/10/23/50/521102350.db2.gz HRWXMSOHASXVIG-MRXNPFEDSA-N 1 2 317.433 4.052 20 0 DIADLO CCCC[C@@H]([NH2+]Cc1nnc(C(C)C)o1)c1ccc(OC)cc1 ZINC000182151567 521102580 /nfs/dbraw/zinc/10/25/80/521102580.db2.gz GNJAIWXMGHHFRG-MRXNPFEDSA-N 1 2 317.433 4.223 20 0 DIADLO CCC[C@H]([NH2+]Cc1cn[nH]c1C)c1cccc(C(F)(F)F)c1 ZINC000237029192 521160402 /nfs/dbraw/zinc/16/04/02/521160402.db2.gz IWTAFWCWPRDMCY-HNNXBMFYSA-N 1 2 311.351 4.368 20 0 DIADLO CCCc1ccccc1NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000130713274 521436665 /nfs/dbraw/zinc/43/66/65/521436665.db2.gz HOHVTMNKWXDZOA-INIZCTEOSA-N 1 2 312.417 4.121 20 0 DIADLO CCCc1ccccc1NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000130713036 521437821 /nfs/dbraw/zinc/43/78/21/521437821.db2.gz HOHVTMNKWXDZOA-MRXNPFEDSA-N 1 2 312.417 4.121 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)no1 ZINC000182574185 521516168 /nfs/dbraw/zinc/51/61/68/521516168.db2.gz QWGWLXDEOFWEPF-KRWDZBQOSA-N 1 2 319.836 4.307 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)no1 ZINC000180020957 521516670 /nfs/dbraw/zinc/51/66/70/521516670.db2.gz NOZTUKKSKRZPQT-PZSREKOKSA-N 1 2 319.836 4.162 20 0 DIADLO CCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1ncc(C)o1 ZINC000181267760 521575984 /nfs/dbraw/zinc/57/59/84/521575984.db2.gz YLFYMDZJPKYBPM-MRXNPFEDSA-N 1 2 302.418 4.259 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)n1 ZINC000180022997 521586072 /nfs/dbraw/zinc/58/60/72/521586072.db2.gz BURCSPMMVGTCNM-YLVFBTJISA-N 1 2 319.836 4.162 20 0 DIADLO CCCn1c(C)nnc1C[N@H+](C1CC1)[C@@H]1CCCc2ccccc21 ZINC000161994074 521622015 /nfs/dbraw/zinc/62/20/15/521622015.db2.gz HERLKBUMWHQLSC-LJQANCHMSA-N 1 2 324.472 4.039 20 0 DIADLO CCCn1c(C)nnc1C[N@@H+](C1CC1)[C@@H]1CCCc2ccccc21 ZINC000161994074 521622018 /nfs/dbraw/zinc/62/20/18/521622018.db2.gz HERLKBUMWHQLSC-LJQANCHMSA-N 1 2 324.472 4.039 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+]2CC=C(C(C)(C)C)CC2)n1 ZINC000336844778 521721797 /nfs/dbraw/zinc/72/17/97/521721797.db2.gz RWLXFICWUXZZQD-LBPRGKRZSA-N 1 2 309.479 4.062 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+]2CC=C(C(C)(C)C)CC2)n1 ZINC000336844778 521721798 /nfs/dbraw/zinc/72/17/98/521721798.db2.gz RWLXFICWUXZZQD-LBPRGKRZSA-N 1 2 309.479 4.062 20 0 DIADLO CCc1cnc(C[NH2+][C@@H]2CC(C)(C)Oc3cc(F)ccc32)s1 ZINC000130532090 522039627 /nfs/dbraw/zinc/03/96/27/522039627.db2.gz QQNSJOVEZLHOJQ-CQSZACIVSA-N 1 2 320.433 4.237 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)no1 ZINC000181811751 522351698 /nfs/dbraw/zinc/35/16/98/522351698.db2.gz BKRCIZPHBJQIFH-CQSZACIVSA-N 1 2 323.396 4.275 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CCCOc3c(Cl)cccc32)cs1 ZINC000156415688 522354031 /nfs/dbraw/zinc/35/40/31/522354031.db2.gz YVONXPANKQQJEM-AWEZNQCLSA-N 1 2 322.861 4.362 20 0 DIADLO CCc1nc([C@@H](C)Nc2cc(C(F)(F)F)cc[nH+]2)cs1 ZINC000267426398 522426628 /nfs/dbraw/zinc/42/66/28/522426628.db2.gz VQDAIZWEPIQQFG-MRVPVSSYSA-N 1 2 301.337 4.292 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2cc(C)ccc2OC)cs1 ZINC000162338777 522453020 /nfs/dbraw/zinc/45/30/20/522453020.db2.gz ITTUSBDUEXWSSJ-OLZOCXBDSA-N 1 2 304.459 4.434 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C(C)(C)C)s1)c1ccc(F)cc1 ZINC000268207412 522674737 /nfs/dbraw/zinc/67/47/37/522674737.db2.gz PODOXGXGUOTWKD-ZDUSSCGKSA-N 1 2 307.438 4.216 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](CCc2ccccc2)c2ccccc2)o1 ZINC000180374432 522742464 /nfs/dbraw/zinc/74/24/64/522742464.db2.gz USJBGXQYZSZIOM-SFHVURJKSA-N 1 2 321.424 4.096 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](CC2CCCCC2)c2ccccc2)o1 ZINC000181824830 522742968 /nfs/dbraw/zinc/74/29/68/522742968.db2.gz WDCQGGGEYZJXBS-KRWDZBQOSA-N 1 2 313.445 4.433 20 0 DIADLO COC[C@H]([NH2+]Cc1nc(C(C)C)cs1)c1ccc(Cl)cc1 ZINC000194084860 522754974 /nfs/dbraw/zinc/75/49/74/522754974.db2.gz XIILKWPPEWPNCV-AWEZNQCLSA-N 1 2 324.877 4.397 20 0 DIADLO COc1cc([C@@H](C)[NH2+]Cc2cscn2)ccc1OCC(C)C ZINC000237257496 522907514 /nfs/dbraw/zinc/90/75/14/522907514.db2.gz VHOVRGQTHDPSSW-CYBMUJFWSA-N 1 2 320.458 4.037 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)n1 ZINC000180018503 522907572 /nfs/dbraw/zinc/90/75/72/522907572.db2.gz QRUHQRMCBXRDMU-KYXHQGGESA-N 1 2 319.836 4.333 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nc([C@@H](C)OC)no1 ZINC000267019290 522930994 /nfs/dbraw/zinc/93/09/94/522930994.db2.gz JVTCQTYHLKQMLP-BXUZGUMPSA-N 1 2 323.824 4.014 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nc([C@@H](C)OC)no1 ZINC000267019290 522931001 /nfs/dbraw/zinc/93/10/01/522931001.db2.gz JVTCQTYHLKQMLP-BXUZGUMPSA-N 1 2 323.824 4.014 20 0 DIADLO CC[C@@H]([NH2+][C@H](COC)c1ccc(C)o1)c1cc(F)ccc1F ZINC000156412422 522945272 /nfs/dbraw/zinc/94/52/72/522945272.db2.gz JWHDZDRHBOAVRF-HZPDHXFCSA-N 1 2 309.356 4.295 20 0 DIADLO CC[C@@H](Nc1cc(C)ccc1Br)c1[nH+]ccn1C ZINC000180093108 522953319 /nfs/dbraw/zinc/95/33/19/522953319.db2.gz BVFZAOIYMGMBKR-GFCCVEGCSA-N 1 2 308.223 4.054 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ncc(C(C)(C)C)o2)o1 ZINC000130830636 523015338 /nfs/dbraw/zinc/01/53/38/523015338.db2.gz CPTIIAUXQOXXRX-AWEZNQCLSA-N 1 2 318.417 4.049 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ncc(C(C)(C)C)o2)o1 ZINC000130830636 523015346 /nfs/dbraw/zinc/01/53/46/523015346.db2.gz CPTIIAUXQOXXRX-AWEZNQCLSA-N 1 2 318.417 4.049 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1csc(-c2ccco2)n1 ZINC000130144211 523119872 /nfs/dbraw/zinc/11/98/72/523119872.db2.gz GGYXQLQPILLBNZ-HNNXBMFYSA-N 1 2 313.426 4.381 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1csc(-c2ccco2)n1 ZINC000130144211 523119879 /nfs/dbraw/zinc/11/98/79/523119879.db2.gz GGYXQLQPILLBNZ-HNNXBMFYSA-N 1 2 313.426 4.381 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]Cc2cc(C)cc(Cl)c2)cs1 ZINC000339294548 523472437 /nfs/dbraw/zinc/47/24/37/523472437.db2.gz TWGKLQNIRZRNIG-NSHDSACASA-N 1 2 310.850 4.102 20 0 DIADLO C[N@H+](Cc1csc(-c2ccoc2)n1)Cc1ccc(F)c(F)c1 ZINC000108357932 523523285 /nfs/dbraw/zinc/52/32/85/523523285.db2.gz BJVFHZUQJOEXSB-UHFFFAOYSA-N 1 2 320.364 4.313 20 0 DIADLO C[N@@H+](Cc1csc(-c2ccoc2)n1)Cc1ccc(F)c(F)c1 ZINC000108357932 523523291 /nfs/dbraw/zinc/52/32/91/523523291.db2.gz BJVFHZUQJOEXSB-UHFFFAOYSA-N 1 2 320.364 4.313 20 0 DIADLO CCn1ccnc1C[N@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000102768122 523525467 /nfs/dbraw/zinc/52/54/67/523525467.db2.gz XLZYAXCSGNFDJS-CYBMUJFWSA-N 1 2 303.837 4.282 20 0 DIADLO CCn1ccnc1C[N@@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000102768122 523525473 /nfs/dbraw/zinc/52/54/73/523525473.db2.gz XLZYAXCSGNFDJS-CYBMUJFWSA-N 1 2 303.837 4.282 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)nc1 ZINC000338279090 524015414 /nfs/dbraw/zinc/01/54/14/524015414.db2.gz IKAASCCWSZEFKQ-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)nc1 ZINC000338279090 524015417 /nfs/dbraw/zinc/01/54/17/524015417.db2.gz IKAASCCWSZEFKQ-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2ccc3ccccc3n2)o1 ZINC000178801725 524032241 /nfs/dbraw/zinc/03/22/41/524032241.db2.gz OFSYAPVEZFOJMK-IFXJQAMLSA-N 1 2 324.424 4.429 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2ccc(OC)cc2F)o1 ZINC000165212537 524032436 /nfs/dbraw/zinc/03/24/36/524032436.db2.gz OUHGEPKWTXAFDB-YVEFUNNKSA-N 1 2 321.392 4.028 20 0 DIADLO C[C@@H]1CCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)CC1 ZINC000337811251 524212941 /nfs/dbraw/zinc/21/29/41/524212941.db2.gz MJSIMOYMPOTWIE-OAHLLOKOSA-N 1 2 310.397 4.136 20 0 DIADLO C[C@H]1CCN(C(=O)c2ccc(Oc3cc[nH+]cc3)c(Cl)c2)C1 ZINC000265095851 524269252 /nfs/dbraw/zinc/26/92/52/524269252.db2.gz FBRRMRQRBXOWEO-LBPRGKRZSA-N 1 2 316.788 4.009 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(-c3ccco3)nc2C)c(C)[nH+]1 ZINC000338188353 524303816 /nfs/dbraw/zinc/30/38/16/524303816.db2.gz DWRKYURBJVZPBH-UHFFFAOYSA-N 1 2 321.380 4.223 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+][C@@H](C)c1nc2ccccc2o1 ZINC000182066671 524335334 /nfs/dbraw/zinc/33/53/34/524335334.db2.gz WBRYTOGAYATHIU-RYUDHWBXSA-N 1 2 314.360 4.387 20 0 DIADLO C[C@H]1CC[C@H](N(C)C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000338203156 524412971 /nfs/dbraw/zinc/41/29/71/524412971.db2.gz HMMOGYXOKCNJCF-GJZGRUSLSA-N 1 2 310.397 4.135 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1csc(-c2ccoc2)n1 ZINC000108356183 524437171 /nfs/dbraw/zinc/43/71/71/524437171.db2.gz GSLJRHAJKMNJAS-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1csc(-c2ccoc2)n1 ZINC000108356183 524437183 /nfs/dbraw/zinc/43/71/83/524437183.db2.gz GSLJRHAJKMNJAS-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2nc(Cc3ccccc3)no2)c1 ZINC000182922841 524462684 /nfs/dbraw/zinc/46/26/84/524462684.db2.gz PZHMJEWILMONIU-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO COc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nnc(C(C)C)o1 ZINC000181705090 524730494 /nfs/dbraw/zinc/73/04/94/524730494.db2.gz NOGINMCZPZEDEC-OAHLLOKOSA-N 1 2 317.433 4.079 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+][C@@H](C)c1noc(-c2ccccc2)n1 ZINC000124338838 524784314 /nfs/dbraw/zinc/78/43/14/524784314.db2.gz PCVKJQPYORBASL-KBPBESRZSA-N 1 2 323.396 4.157 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000124499619 524831956 /nfs/dbraw/zinc/83/19/56/524831956.db2.gz FDDNHVLAKTWBMR-HUUCEWRRSA-N 1 2 307.397 4.457 20 0 DIADLO C[C@H]1C[C@H]1[C@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000180027321 524965956 /nfs/dbraw/zinc/96/59/56/524965956.db2.gz HVAYRIJNDZYEIR-DRZCJDIDSA-N 1 2 317.820 4.087 20 0 DIADLO Cc1ccccc1-c1noc([C@@H](C)[NH2+][C@H](C)c2cccc(O)c2)n1 ZINC000181531868 525021844 /nfs/dbraw/zinc/02/18/44/525021844.db2.gz QTUOJWSRXCUDJR-ZIAGYGMSSA-N 1 2 323.396 4.162 20 0 DIADLO Cc1ccccc1-c1noc([C@H](C)[NH2+][C@H](C)c2cccc(O)c2)n1 ZINC000181531883 525023324 /nfs/dbraw/zinc/02/33/24/525023324.db2.gz QTUOJWSRXCUDJR-KGLIPLIRSA-N 1 2 323.396 4.162 20 0 DIADLO Cc1cc(N(Cc2cccs2)C2CC2)nc(-c2ccncc2)[nH+]1 ZINC000112964297 525033093 /nfs/dbraw/zinc/03/30/93/525033093.db2.gz KGLCQXCURFCHOD-UHFFFAOYSA-N 1 2 322.437 4.078 20 0 DIADLO Cc1cc(N2CC=C(c3ccccc3C(F)(F)F)CC2)nc[nH+]1 ZINC000154744145 525051571 /nfs/dbraw/zinc/05/15/71/525051571.db2.gz LEDUWTJKLKHUIL-UHFFFAOYSA-N 1 2 319.330 4.098 20 0 DIADLO Cc1ccc(NC(=O)N(Cc2ccc(F)cc2)C(C)C)c(C)[nH+]1 ZINC000268023925 525116408 /nfs/dbraw/zinc/11/64/08/525116408.db2.gz LOIIMBUILUFILE-UHFFFAOYSA-N 1 2 315.392 4.280 20 0 DIADLO C[C@@H]1C[C@@H]1[C@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000180027279 525333459 /nfs/dbraw/zinc/33/34/59/525333459.db2.gz HVAYRIJNDZYEIR-FUEDEBDSSA-N 1 2 317.820 4.087 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000124456403 525336774 /nfs/dbraw/zinc/33/67/74/525336774.db2.gz HRODIMLDEBOUGK-UONOGXRCSA-N 1 2 323.396 4.157 20 0 DIADLO C[C@H]([NH2+]Cc1cscn1)c1nc(-c2ccccc2)cs1 ZINC000107321898 525482213 /nfs/dbraw/zinc/48/22/13/525482213.db2.gz GJWXHLIMKSIROL-NSHDSACASA-N 1 2 301.440 4.117 20 0 DIADLO C[C@H]([NH2+]Cc1csc(C2CCCC2)n1)c1cccc(O)c1 ZINC000181516407 525482347 /nfs/dbraw/zinc/48/23/47/525482347.db2.gz ZBLPSGLMEVZDAA-LBPRGKRZSA-N 1 2 302.443 4.357 20 0 DIADLO C[C@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1ccc2ccccc2c1 ZINC000181507160 525496692 /nfs/dbraw/zinc/49/66/92/525496692.db2.gz DGTGFWAJLYVLDX-ZDUSSCGKSA-N 1 2 309.413 4.371 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccncc1F)c1ncc(-c2ccccc2)o1 ZINC000338348902 525537041 /nfs/dbraw/zinc/53/70/41/525537041.db2.gz XBBPYUBIYONCLE-STQMWFEESA-N 1 2 311.360 4.288 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(Cl)s1)c1c(F)cccc1Cl ZINC000181744629 525551725 /nfs/dbraw/zinc/55/17/25/525551725.db2.gz SJOYTAAQTREKGA-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO C[C@@H]([NH2+]Cc1nccn1C(F)F)c1cc(Cl)ccc1Cl ZINC000161847707 525560755 /nfs/dbraw/zinc/56/07/55/525560755.db2.gz XTQDKRQHDUEROG-MRVPVSSYSA-N 1 2 320.170 4.436 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1Br)c1cscn1 ZINC000162295440 525613687 /nfs/dbraw/zinc/61/36/87/525613687.db2.gz CDNLQSAWOMDDHE-VHSXEESVSA-N 1 2 311.248 4.317 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1noc(-c2ccccc2)n1 ZINC000124303849 525652449 /nfs/dbraw/zinc/65/24/49/525652449.db2.gz VRECXTYUURBZLK-CXAGYDPISA-N 1 2 305.381 4.075 20 0 DIADLO Cc1ccc(-c2cnc(C[NH2+][C@H](C)c3ccncc3F)o2)cc1 ZINC000338341821 525773745 /nfs/dbraw/zinc/77/37/45/525773745.db2.gz LEGMSBSZZWSQBT-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)C=Cc2cccc(F)c2)[nH+]1 ZINC000366353247 525962683 /nfs/dbraw/zinc/96/26/83/525962683.db2.gz DARQIURDODOMBE-MDZDMXLPSA-N 1 2 321.355 4.176 20 0 DIADLO Cc1cnc(C[N@@H+](C)Cc2ccccc2C(F)(F)F)s1 ZINC000180416164 526006269 /nfs/dbraw/zinc/00/62/69/526006269.db2.gz SAOQATOEPKLALX-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1cnc(C[N@H+](C)Cc2ccccc2C(F)(F)F)s1 ZINC000180416164 526006276 /nfs/dbraw/zinc/00/62/76/526006276.db2.gz SAOQATOEPKLALX-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2c(Cl)cccc2N2CCCC2)o1 ZINC000337268362 526125534 /nfs/dbraw/zinc/12/55/34/526125534.db2.gz XNJVXIBQLWVKEW-CYBMUJFWSA-N 1 2 319.836 4.087 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2c(Cl)cccc2N2CCCC2)o1 ZINC000337268363 526156153 /nfs/dbraw/zinc/15/61/53/526156153.db2.gz XNJVXIBQLWVKEW-ZDUSSCGKSA-N 1 2 319.836 4.087 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CC1CCC(C(F)(F)F)CC1 ZINC000183103774 526236964 /nfs/dbraw/zinc/23/69/64/526236964.db2.gz UUTKTHAGGKLDEX-UHFFFAOYSA-N 1 2 300.324 4.087 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CCSc1ccc(Cl)cc1 ZINC000107292221 526237308 /nfs/dbraw/zinc/23/73/08/526237308.db2.gz ATPAFUVZQJAUSK-UHFFFAOYSA-N 1 2 306.818 4.164 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@@H](Sc1ccccc1)C(C)C ZINC000107293650 526239988 /nfs/dbraw/zinc/23/99/88/526239988.db2.gz WJYYKLICXCWYQN-INIZCTEOSA-N 1 2 300.427 4.145 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000107290714 526240542 /nfs/dbraw/zinc/24/05/42/526240542.db2.gz VLACHBBZZNIWBN-ZIAGYGMSSA-N 1 2 320.314 4.151 20 0 DIADLO FC1(c2ccc(Cl)cc2)CC[NH+](Cc2nccs2)CC1 ZINC000337219030 526279685 /nfs/dbraw/zinc/27/96/85/526279685.db2.gz KMKIQMNOTWYHIO-UHFFFAOYSA-N 1 2 310.825 4.257 20 0 DIADLO Fc1c(Cl)cccc1CNc1cccc(-n2cc[nH+]c2)c1 ZINC000157534822 526291939 /nfs/dbraw/zinc/29/19/39/526291939.db2.gz IKLUUAQKQZPFTP-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO Cc1csc(C2([NH2+]Cc3nc4ccccc4s3)CCC2)n1 ZINC000265551114 526326346 /nfs/dbraw/zinc/32/63/46/526326346.db2.gz YQTSEYNUPKTDJU-UHFFFAOYSA-N 1 2 315.467 4.230 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cnc(-c4ccccc4)[nH]3)CCC2)n1 ZINC000267852450 526326929 /nfs/dbraw/zinc/32/69/29/526326929.db2.gz CIFQJWFIHGXSMS-UHFFFAOYSA-N 1 2 324.453 4.011 20 0 DIADLO c1ccc([C@H](CC2CCCC2)[NH2+]Cc2nc(C3CC3)no2)cc1 ZINC000181942532 526496725 /nfs/dbraw/zinc/49/67/25/526496725.db2.gz MYPNYUXFHWZEDL-KRWDZBQOSA-N 1 2 311.429 4.358 20 0 DIADLO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]Cc1cocn1 ZINC000182062934 526575618 /nfs/dbraw/zinc/57/56/18/526575618.db2.gz KPHFJENXVVGEBC-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]Cc1ccon1 ZINC000158324560 526576181 /nfs/dbraw/zinc/57/61/81/526576181.db2.gz SBPLCGRMHPDVLE-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO Cc1nc(-c2cccs2)sc1C(=O)Nc1cc[nH+]cc1C ZINC000107293155 526615964 /nfs/dbraw/zinc/61/59/64/526615964.db2.gz PUMITHARIKDLMF-UHFFFAOYSA-N 1 2 315.423 4.136 20 0 DIADLO c1snnc1C[NH2+][C@@H](CCCc1ccccc1)c1ccccc1 ZINC000182123948 526635619 /nfs/dbraw/zinc/63/56/19/526635619.db2.gz XDMNQQZUMCLNCJ-IBGZPJMESA-N 1 2 323.465 4.392 20 0 DIADLO Cc1occc1CN(C)C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000338163891 526821330 /nfs/dbraw/zinc/82/13/30/526821330.db2.gz WFYVNWWTIIEEBU-UHFFFAOYSA-N 1 2 322.364 4.048 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)oc1C ZINC000181628169 526890341 /nfs/dbraw/zinc/89/03/41/526890341.db2.gz YVJMKAGAWJXPSR-INIZCTEOSA-N 1 2 308.372 4.447 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccc(OCC3CC3)c(F)c2)oc1C ZINC000181588458 526892617 /nfs/dbraw/zinc/89/26/17/526892617.db2.gz CUSYUOZPTKEPSN-GFCCVEGCSA-N 1 2 318.392 4.070 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](C)Cc2ccccc2SC)cs1 ZINC000272954505 536505711 /nfs/dbraw/zinc/50/57/11/536505711.db2.gz VOZANIMAYSXQFM-GFCCVEGCSA-N 1 2 322.499 4.204 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](C)Cc2ccccc2SC)cs1 ZINC000272954505 536505714 /nfs/dbraw/zinc/50/57/14/536505714.db2.gz VOZANIMAYSXQFM-GFCCVEGCSA-N 1 2 322.499 4.204 20 0 DIADLO Cc1ncc(C[N@@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)s1 ZINC000338366691 527258472 /nfs/dbraw/zinc/25/84/72/527258472.db2.gz CEAKKORANGCARR-HNNXBMFYSA-N 1 2 310.825 4.176 20 0 DIADLO Cc1ncc(C[N@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)s1 ZINC000338366691 527258477 /nfs/dbraw/zinc/25/84/77/527258477.db2.gz CEAKKORANGCARR-HNNXBMFYSA-N 1 2 310.825 4.176 20 0 DIADLO Cn1c[nH+]cc1CNc1cccc(Cl)c1SCC(F)F ZINC000126633158 527510563 /nfs/dbraw/zinc/51/05/63/527510563.db2.gz FHUOCIUXYSNJNG-UHFFFAOYSA-N 1 2 317.792 4.043 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CCC(OC3CCCC3)CC2)c1 ZINC000267383521 527688194 /nfs/dbraw/zinc/68/81/94/527688194.db2.gz LXWKVUTYLVTXMK-UHFFFAOYSA-N 1 2 314.351 4.028 20 0 DIADLO CC(C)c1[nH]ccc1C(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000285875934 535319957 /nfs/dbraw/zinc/31/99/57/535319957.db2.gz WGCALOJLWKCOKH-UHFFFAOYSA-N 1 2 322.412 4.155 20 0 DIADLO CCOc1ccc(C[N@H+](Cc2nccn2C(F)F)C(C)C)cc1 ZINC000299346492 535717277 /nfs/dbraw/zinc/71/72/77/535717277.db2.gz AZPTUHOHASRPEB-UHFFFAOYSA-N 1 2 323.387 4.088 20 0 DIADLO CCOc1ccc(C[N@@H+](Cc2nccn2C(F)F)C(C)C)cc1 ZINC000299346492 535717282 /nfs/dbraw/zinc/71/72/82/535717282.db2.gz AZPTUHOHASRPEB-UHFFFAOYSA-N 1 2 323.387 4.088 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](c1ccccc1)c1ccc(F)cc1 ZINC000296135397 536118057 /nfs/dbraw/zinc/11/80/57/536118057.db2.gz VYBJBPKRRDKEJA-DNVCBOLYSA-N 1 2 323.415 4.482 20 0 DIADLO COCC[C@@H]([NH2+][C@@H](C)c1csc(C(C)C)n1)c1ccco1 ZINC000274428573 536807247 /nfs/dbraw/zinc/80/72/47/536807247.db2.gz JMWIXBWRPKNXIQ-QWHCGFSZSA-N 1 2 308.447 4.288 20 0 DIADLO Cc1ccnc(C[NH2+][C@H](C)c2ccsc2)c1Br ZINC000865559559 1043112832 /nfs/dbraw/zinc/11/28/32/1043112832.db2.gz VCNIJJZEOIUSFX-SNVBAGLBSA-N 1 2 311.248 4.065 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2Cl)[C@H](C)C1 ZINC001232704223 1054104562 /nfs/dbraw/zinc/10/45/62/1054104562.db2.gz WGSKVHKTGJTGBF-KOLCDFICSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2Cl)[C@H](C)C1 ZINC001232704223 1054104571 /nfs/dbraw/zinc/10/45/71/1054104571.db2.gz WGSKVHKTGJTGBF-KOLCDFICSA-N 1 2 306.208 4.132 20 0 DIADLO C[C@H](C[N@@H+]1CCc2cc(Br)ccc2C1)C(F)(F)F ZINC000484004427 1063896724 /nfs/dbraw/zinc/89/67/24/1063896724.db2.gz AKVCRYBKNHZHKV-SECBINFHSA-N 1 2 322.168 4.006 20 0 DIADLO C[C@H](C[N@H+]1CCc2cc(Br)ccc2C1)C(F)(F)F ZINC000484004427 1063896738 /nfs/dbraw/zinc/89/67/38/1063896738.db2.gz AKVCRYBKNHZHKV-SECBINFHSA-N 1 2 322.168 4.006 20 0 DIADLO CCC1CC[NH+](Cc2cc(Br)cc(F)c2F)CC1 ZINC001307458324 1065412296 /nfs/dbraw/zinc/41/22/96/1065412296.db2.gz HJJUIEWJIHKZIN-UHFFFAOYSA-N 1 2 318.205 4.349 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2cc(C(C)=O)no2)o1 ZINC000574886958 1035527749 /nfs/dbraw/zinc/52/77/49/1035527749.db2.gz AXNDBEBRCDGMTJ-SJKOYZFVSA-N 1 2 316.401 4.006 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2cc(C(C)=O)no2)o1 ZINC000574886958 1035527756 /nfs/dbraw/zinc/52/77/56/1035527756.db2.gz AXNDBEBRCDGMTJ-SJKOYZFVSA-N 1 2 316.401 4.006 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@H]2c2ccncc2)cs1 ZINC000153999654 1035673306 /nfs/dbraw/zinc/67/33/06/1035673306.db2.gz ZFBBXBDIQSLPCR-INIZCTEOSA-N 1 2 301.459 4.218 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@H]2c2ccncc2)cs1 ZINC000153999654 1035673310 /nfs/dbraw/zinc/67/33/10/1035673310.db2.gz ZFBBXBDIQSLPCR-INIZCTEOSA-N 1 2 301.459 4.218 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)cs1 ZINC000064621237 1035703322 /nfs/dbraw/zinc/70/33/22/1035703322.db2.gz LPCSLGCCVUGZIO-GOSISDBHSA-N 1 2 312.413 4.470 20 0 DIADLO COc1cc(F)c(C[N@H+]([C@@H](C)c2ccco2)C2CC2)cc1OC ZINC000579841522 1035794436 /nfs/dbraw/zinc/79/44/36/1035794436.db2.gz FNNDBPZVKCDEBH-LBPRGKRZSA-N 1 2 319.376 4.162 20 0 DIADLO COc1cc(F)c(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)cc1OC ZINC000579841522 1035794449 /nfs/dbraw/zinc/79/44/49/1035794449.db2.gz FNNDBPZVKCDEBH-LBPRGKRZSA-N 1 2 319.376 4.162 20 0 DIADLO C[N@H+](Cc1ncc(-c2cccs2)o1)Cc1cccc(F)c1 ZINC000109130155 1035808073 /nfs/dbraw/zinc/80/80/73/1035808073.db2.gz IWDZHCBQQRFMRV-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1ncc(-c2cccs2)o1)Cc1cccc(F)c1 ZINC000109130155 1035808090 /nfs/dbraw/zinc/80/80/90/1035808090.db2.gz IWDZHCBQQRFMRV-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO CCOc1cccc(Cl)c1C[NH2+]C(C)(C)c1c(C)noc1C ZINC000579850045 1035819782 /nfs/dbraw/zinc/81/97/82/1035819782.db2.gz LASLKJRMVGNOIM-UHFFFAOYSA-N 1 2 322.836 4.368 20 0 DIADLO CCC[C@H]([NH2+]Cc1nccn1C)c1ccc(Cl)cc1Cl ZINC000339674853 1035912115 /nfs/dbraw/zinc/91/21/15/1035912115.db2.gz CLLDDWGFNIYPGE-AWEZNQCLSA-N 1 2 312.244 4.358 20 0 DIADLO Cc1cc(C)c(C(=O)NCC(C)(C)C2CCCCC2)c(C)[nH+]1 ZINC001266324351 1035939161 /nfs/dbraw/zinc/93/91/61/1035939161.db2.gz GDYFBFORTDPLEY-UHFFFAOYSA-N 1 2 302.462 4.343 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nnc2n1CCCCC2)c1ccc(Cl)s1 ZINC000037140687 1035951395 /nfs/dbraw/zinc/95/13/95/1035951395.db2.gz CHZQBOARMQPVET-MNOVXSKESA-N 1 2 324.881 4.131 20 0 DIADLO CC1=C(C(=O)Nc2cccc3c2CN(c2cccc[nH+]2)C3)CCC1 ZINC000339848194 1035989802 /nfs/dbraw/zinc/98/98/02/1035989802.db2.gz UMXTXEZFPAKQMU-UHFFFAOYSA-N 1 2 319.408 4.041 20 0 DIADLO Cc1nc(N(Cc2ccccn2)C2CCCCC2)c(C)c(C)[nH+]1 ZINC001167100553 1036035245 /nfs/dbraw/zinc/03/52/45/1036035245.db2.gz VGIGIGNNPYMVQW-UHFFFAOYSA-N 1 2 310.445 4.136 20 0 DIADLO COc1ccc(C)[nH+]c1N(Cc1ccccn1)C1CCCCC1 ZINC001167102105 1036050508 /nfs/dbraw/zinc/05/05/08/1036050508.db2.gz LQYQESPBYFSHHJ-UHFFFAOYSA-N 1 2 311.429 4.133 20 0 DIADLO COc1ccccc1[C@H](C)N(C)c1cc(CSC)cc[nH+]1 ZINC001167106807 1036088886 /nfs/dbraw/zinc/08/88/86/1036088886.db2.gz JTJYJQVICDMFNS-ZDUSSCGKSA-N 1 2 302.443 4.151 20 0 DIADLO COc1ccccc1[C@@H](C)N(C)c1cc(CSC)cc[nH+]1 ZINC001167106806 1036090057 /nfs/dbraw/zinc/09/00/57/1036090057.db2.gz JTJYJQVICDMFNS-CYBMUJFWSA-N 1 2 302.443 4.151 20 0 DIADLO Cc1nn(C)c(C)c1Nc1cc[nH+]c2cc(C(F)(F)F)ccc12 ZINC000443667098 1036106882 /nfs/dbraw/zinc/10/68/82/1036106882.db2.gz VVKVNKPMOYHVMY-UHFFFAOYSA-N 1 2 320.318 4.348 20 0 DIADLO Cc1ccc(N2CC[NH+](Cc3ccc(Cl)s3)CC2)cc1 ZINC001204438109 1036114855 /nfs/dbraw/zinc/11/48/55/1036114855.db2.gz HZEGGBILDDPPAO-UHFFFAOYSA-N 1 2 306.862 4.032 20 0 DIADLO Clc1cnc(NCc2ccccc2-n2cc[nH+]c2)c(Cl)c1 ZINC000340017479 1036117432 /nfs/dbraw/zinc/11/74/32/1036117432.db2.gz YBMJBSYCJOVWHS-UHFFFAOYSA-N 1 2 319.195 4.186 20 0 DIADLO Cc1ccc(F)c2cc(C)c(N3CCC(n4cc[nH+]c4)CC3)nc12 ZINC001167126236 1036140538 /nfs/dbraw/zinc/14/05/38/1036140538.db2.gz TUDJSCNIAZULSG-UHFFFAOYSA-N 1 2 324.403 4.029 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCOC[C@H]2c2ccccc2)cc1F ZINC000579885925 1036153290 /nfs/dbraw/zinc/15/32/90/1036153290.db2.gz RLVKQXXPQASKMW-PXPVJAHISA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCOC[C@H]2c2ccccc2)cc1F ZINC000579885925 1036153294 /nfs/dbraw/zinc/15/32/94/1036153294.db2.gz RLVKQXXPQASKMW-PXPVJAHISA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCOC[C@H]2c2ccccc2)cc1F ZINC000579885923 1036153650 /nfs/dbraw/zinc/15/36/50/1036153650.db2.gz RLVKQXXPQASKMW-HMECNJMJSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCOC[C@H]2c2ccccc2)cc1F ZINC000579885923 1036153662 /nfs/dbraw/zinc/15/36/62/1036153662.db2.gz RLVKQXXPQASKMW-HMECNJMJSA-N 1 2 315.363 4.052 20 0 DIADLO CC(C)c1cc(C[NH2+]Cc2csc(Cl)c2Cl)on1 ZINC000683343093 1036176289 /nfs/dbraw/zinc/17/62/89/1036176289.db2.gz ZPYPGVMQFLRHRN-UHFFFAOYSA-N 1 2 305.230 4.456 20 0 DIADLO CC(C)c1ccc(N2CCO[C@](C)(c3ccc(F)cc3)C2)[nH+]c1 ZINC001167140394 1036178003 /nfs/dbraw/zinc/17/80/03/1036178003.db2.gz YUFFEMQJGZQTBU-IBGZPJMESA-N 1 2 314.404 4.096 20 0 DIADLO Cc1ccc(C[N@H+](Cc2nc(C3CCC3)no2)C(C)C)s1 ZINC001167157336 1036225479 /nfs/dbraw/zinc/22/54/79/1036225479.db2.gz JATLWIZTHVFGRI-UHFFFAOYSA-N 1 2 305.447 4.118 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2nc(C3CCC3)no2)C(C)C)s1 ZINC001167157336 1036225496 /nfs/dbraw/zinc/22/54/96/1036225496.db2.gz JATLWIZTHVFGRI-UHFFFAOYSA-N 1 2 305.447 4.118 20 0 DIADLO COc1c(Cl)cccc1C[N@H+](C)Cc1ccc(F)cc1F ZINC001140062233 1036239911 /nfs/dbraw/zinc/23/99/11/1036239911.db2.gz OHKQKRGNEKSVPR-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1c(Cl)cccc1C[N@@H+](C)Cc1ccc(F)cc1F ZINC001140062233 1036239920 /nfs/dbraw/zinc/23/99/20/1036239920.db2.gz OHKQKRGNEKSVPR-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CCC[N@H+](Cc1cnn(CC)n1)[C@H](C)c1cc2ccccc2o1 ZINC001167179443 1036246011 /nfs/dbraw/zinc/24/60/11/1036246011.db2.gz ZVXDIQNCVIHYQR-CQSZACIVSA-N 1 2 312.417 4.017 20 0 DIADLO CCC[N@@H+](Cc1cnn(CC)n1)[C@H](C)c1cc2ccccc2o1 ZINC001167179443 1036246023 /nfs/dbraw/zinc/24/60/23/1036246023.db2.gz ZVXDIQNCVIHYQR-CQSZACIVSA-N 1 2 312.417 4.017 20 0 DIADLO Clc1snnc1C[NH2+][C@@H](c1ccccc1)C1CCCC1 ZINC000109801211 1036260802 /nfs/dbraw/zinc/26/08/02/1036260802.db2.gz JJMBZAIIQMDNNN-AWEZNQCLSA-N 1 2 307.850 4.213 20 0 DIADLO Cc1ncc([C@H](C)[N@H+](C)Cc2cc(Cl)ccc2F)c(C)n1 ZINC000639107946 1036284978 /nfs/dbraw/zinc/28/49/78/1036284978.db2.gz VBAJIIMFYMNASI-NSHDSACASA-N 1 2 307.800 4.079 20 0 DIADLO Cc1ncc([C@H](C)[N@@H+](C)Cc2cc(Cl)ccc2F)c(C)n1 ZINC000639107946 1036284998 /nfs/dbraw/zinc/28/49/98/1036284998.db2.gz VBAJIIMFYMNASI-NSHDSACASA-N 1 2 307.800 4.079 20 0 DIADLO COc1cc(C)c(Nc2ccc([NH+](C)C)c(C)c2)cc1OC ZINC001210042196 1036366493 /nfs/dbraw/zinc/36/64/93/1036366493.db2.gz WXNPAGPFUSEPLS-UHFFFAOYSA-N 1 2 300.402 4.130 20 0 DIADLO Fc1cccc([C@@H]2CC[N@@H+]2Cc2ccc(C(F)(F)F)cn2)c1 ZINC000683522981 1036438092 /nfs/dbraw/zinc/43/80/92/1036438092.db2.gz ZLXJPZKYNRJQNO-HNNXBMFYSA-N 1 2 310.294 4.187 20 0 DIADLO Fc1cccc([C@@H]2CC[N@H+]2Cc2ccc(C(F)(F)F)cn2)c1 ZINC000683522981 1036438095 /nfs/dbraw/zinc/43/80/95/1036438095.db2.gz ZLXJPZKYNRJQNO-HNNXBMFYSA-N 1 2 310.294 4.187 20 0 DIADLO Cc1cc(NC(=O)Cc2coc3cc(C)c(C(C)C)cc23)cc[nH+]1 ZINC000683542861 1036449883 /nfs/dbraw/zinc/44/98/83/1036449883.db2.gz WPIUZMMWHMHHBS-UHFFFAOYSA-N 1 2 322.408 4.171 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1cc(O)ccc1Cl ZINC000625299172 1036472427 /nfs/dbraw/zinc/47/24/27/1036472427.db2.gz UOCJIXIBLIQCBE-JTQLQIEISA-N 1 2 309.768 4.044 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCn2ccnc21)c1ccc(Cl)cc1Cl ZINC000655693278 1036482942 /nfs/dbraw/zinc/48/29/42/1036482942.db2.gz WIRFCBSYFLKLHN-HZMBPMFUSA-N 1 2 310.228 4.376 20 0 DIADLO CCCC[N@H+](Cc1cc(OC)ns1)Cc1ccccc1F ZINC001167294333 1036485173 /nfs/dbraw/zinc/48/51/73/1036485173.db2.gz NAFLGJLYBBXYTF-UHFFFAOYSA-N 1 2 308.422 4.093 20 0 DIADLO CCCC[N@@H+](Cc1cc(OC)ns1)Cc1ccccc1F ZINC001167294333 1036485178 /nfs/dbraw/zinc/48/51/78/1036485178.db2.gz NAFLGJLYBBXYTF-UHFFFAOYSA-N 1 2 308.422 4.093 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2cccc(F)c2O)cc[nH+]1 ZINC001210195673 1036492038 /nfs/dbraw/zinc/49/20/38/1036492038.db2.gz JVEDUMLACKRAIM-UHFFFAOYSA-N 1 2 319.336 4.017 20 0 DIADLO Fc1cc(-c2ccccc2)ccc1C[NH2+][C@@H]1CCCn2ccnc21 ZINC000655770439 1036526673 /nfs/dbraw/zinc/52/66/73/1036526673.db2.gz KHDOBNQHDSRIEM-LJQANCHMSA-N 1 2 321.399 4.314 20 0 DIADLO Oc1cccc(Br)c1Nc1cccc2cc[nH+]cc21 ZINC001210229998 1036545160 /nfs/dbraw/zinc/54/51/60/1036545160.db2.gz GBHOAHODSJTIFE-UHFFFAOYSA-N 1 2 315.170 4.447 20 0 DIADLO Cc1cc(Nc2cc(Br)cn3cc[nH+]c23)c(C)o1 ZINC001210279329 1036578282 /nfs/dbraw/zinc/57/82/82/1036578282.db2.gz PNULJIMIGYKXLI-UHFFFAOYSA-N 1 2 306.163 4.050 20 0 DIADLO CC(=O)c1sc(C(C)(C)C)cc1Nc1c[nH+]c(C)c(N)c1 ZINC001210287060 1036590289 /nfs/dbraw/zinc/59/02/89/1036590289.db2.gz KRSIXBFJSUNXGR-UHFFFAOYSA-N 1 2 303.431 4.277 20 0 DIADLO CCCOc1ccc(CNc2cccc[nH+]2)c(OCCC)c1 ZINC001648855703 1036645480 /nfs/dbraw/zinc/64/54/80/1036645480.db2.gz FQQBIVFYOFCIEA-UHFFFAOYSA-N 1 2 300.402 4.271 20 0 DIADLO CC(C)c1nc2cc(NCc3cccc4[nH+]ccn43)ccc2o1 ZINC001648869912 1036664952 /nfs/dbraw/zinc/66/49/52/1036664952.db2.gz FOYIZSCIIUWYID-UHFFFAOYSA-N 1 2 306.369 4.211 20 0 DIADLO Fc1ccc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)cc1F ZINC000072671436 1036695646 /nfs/dbraw/zinc/69/56/46/1036695646.db2.gz DWSYDLKNMZKCHU-IBGZPJMESA-N 1 2 310.347 4.239 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2c(F)c(F)cc(F)c2F)c(C)o1 ZINC000683692481 1036716556 /nfs/dbraw/zinc/71/65/56/1036716556.db2.gz SONANLKAZHNERU-QMMMGPOBSA-N 1 2 301.283 4.304 20 0 DIADLO CC[C@@H](C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000047514662 1036780033 /nfs/dbraw/zinc/78/00/33/1036780033.db2.gz OHKKYOLNJUGESP-GOSISDBHSA-N 1 2 305.381 4.005 20 0 DIADLO Fc1cccc(-c2cnc(C[N@@H+]3CCC[C@H]3c3ccccn3)o2)c1 ZINC000530962331 1036795259 /nfs/dbraw/zinc/79/52/59/1036795259.db2.gz NQOBQMVLELJUPN-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1cccc(-c2cnc(C[N@H+]3CCC[C@H]3c3ccccn3)o2)c1 ZINC000530962331 1036795275 /nfs/dbraw/zinc/79/52/75/1036795275.db2.gz NQOBQMVLELJUPN-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Nc1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000315165071 1036811260 /nfs/dbraw/zinc/81/12/60/1036811260.db2.gz RLUOMMUQHGOZMZ-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000315165071 1036811276 /nfs/dbraw/zinc/81/12/76/1036811276.db2.gz RLUOMMUQHGOZMZ-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO CC[N@H+](Cc1ccc(C(F)(F)F)cc1)Cc1ncccc1F ZINC001207036486 1036836532 /nfs/dbraw/zinc/83/65/32/1036836532.db2.gz YAPAZJUYUYRSDB-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cc1ncccc1F ZINC001207036486 1036836549 /nfs/dbraw/zinc/83/65/49/1036836549.db2.gz YAPAZJUYUYRSDB-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Br)c(Cl)s1)c1ccon1 ZINC000309754937 1036929851 /nfs/dbraw/zinc/92/98/51/1036929851.db2.gz HKOIZTCCOZBFPN-ZCFIWIBFSA-N 1 2 321.627 4.003 20 0 DIADLO CO[C@@H](c1ccccc1)[C@@H](C)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000683816070 1036963269 /nfs/dbraw/zinc/96/32/69/1036963269.db2.gz IZGOLCZGGFYTCV-DNVCBOLYSA-N 1 2 307.397 4.060 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@@H](CC(F)(F)F)c2ccc(F)cc2)o1 ZINC000683900345 1037078637 /nfs/dbraw/zinc/07/86/37/1037078637.db2.gz UBUJOZDJAYDEAB-ZDUSSCGKSA-N 1 2 316.298 4.214 20 0 DIADLO C[C@H]([NH2+]Cc1cc2ccccc2[nH]1)c1nc(C2CCCCC2)no1 ZINC000683928717 1037116781 /nfs/dbraw/zinc/11/67/81/1037116781.db2.gz AJIBIUGNVKJGAA-ZDUSSCGKSA-N 1 2 324.428 4.449 20 0 DIADLO FC(F)(F)c1cnc(C[NH2+]Cc2cc3ccccc3o2)s1 ZINC000683928284 1037116855 /nfs/dbraw/zinc/11/68/55/1037116855.db2.gz ZJTWIQHJPCKDKF-UHFFFAOYSA-N 1 2 312.316 4.198 20 0 DIADLO Fc1cc(F)c(F)c(C[NH2+]Cc2cc3ccccc3[nH]2)c1F ZINC000683928305 1037117066 /nfs/dbraw/zinc/11/70/66/1037117066.db2.gz AFOQKFVAZGZGCK-UHFFFAOYSA-N 1 2 308.278 4.014 20 0 DIADLO COc1cccc2c(N3CCC(OC(C)(C)C)CC3)cc[nH+]c12 ZINC000275903011 1037183171 /nfs/dbraw/zinc/18/31/71/1037183171.db2.gz ZWIQVSGTFAALBB-UHFFFAOYSA-N 1 2 314.429 4.027 20 0 DIADLO CCOc1cc[nH+]cc1Nc1ccc(C(F)(F)F)nc1Cl ZINC001211199013 1037196214 /nfs/dbraw/zinc/19/62/14/1037196214.db2.gz DYQRRNHUEQTSCI-UHFFFAOYSA-N 1 2 317.698 4.291 20 0 DIADLO O=C(C/C=C\c1ccccc1F)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000255605849 1037204794 /nfs/dbraw/zinc/20/47/94/1037204794.db2.gz AHQXOEMYXAZIEL-UTCJRWHESA-N 1 2 321.355 4.053 20 0 DIADLO CC(C)n1c[nH+]cc1CN(C)Cc1ccc(Cl)cc1Cl ZINC000644900315 1037230532 /nfs/dbraw/zinc/23/05/32/1037230532.db2.gz ITDRMPASRVCLJR-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3ccccc3[nH]2)[C@H](c2ccccc2)CO1 ZINC000684021328 1037243312 /nfs/dbraw/zinc/24/33/12/1037243312.db2.gz OARFMFSEBHWZNJ-YWZLYKJASA-N 1 2 306.409 4.130 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)[C@H](c2ccccc2)CO1 ZINC000684021328 1037243328 /nfs/dbraw/zinc/24/33/28/1037243328.db2.gz OARFMFSEBHWZNJ-YWZLYKJASA-N 1 2 306.409 4.130 20 0 DIADLO Cc1noc([C@@H]2CCCC[N@@H+]2Cc2c(C)cc(Cl)cc2C)n1 ZINC000580677175 1037244424 /nfs/dbraw/zinc/24/44/24/1037244424.db2.gz NASFFCDXHOYWRH-INIZCTEOSA-N 1 2 319.836 4.375 20 0 DIADLO Cc1noc([C@@H]2CCCC[N@H+]2Cc2c(C)cc(Cl)cc2C)n1 ZINC000580677175 1037244435 /nfs/dbraw/zinc/24/44/35/1037244435.db2.gz NASFFCDXHOYWRH-INIZCTEOSA-N 1 2 319.836 4.375 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3ccccc3[nH]2)[C@@H](c2ccccc2)CO1 ZINC000684021325 1037246161 /nfs/dbraw/zinc/24/61/61/1037246161.db2.gz OARFMFSEBHWZNJ-FOIQADDNSA-N 1 2 306.409 4.130 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)[C@@H](c2ccccc2)CO1 ZINC000684021325 1037246168 /nfs/dbraw/zinc/24/61/68/1037246168.db2.gz OARFMFSEBHWZNJ-FOIQADDNSA-N 1 2 306.409 4.130 20 0 DIADLO CC(C)[C@@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1nc(C2CC2)no1 ZINC000089670915 1037259546 /nfs/dbraw/zinc/25/95/46/1037259546.db2.gz IPXQVUOPUDTHDN-HZPDHXFCSA-N 1 2 315.392 4.060 20 0 DIADLO Cc1nocc1C[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1F ZINC000692301920 1037286492 /nfs/dbraw/zinc/28/64/92/1037286492.db2.gz GWABBOJBEWBQPJ-MRVPVSSYSA-N 1 2 303.164 4.280 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](Cc2cc(F)cc(F)c2)[C@@H](C)CO1 ZINC001167438465 1037351691 /nfs/dbraw/zinc/35/16/91/1037351691.db2.gz ODFHIUDESVVKAH-IFXJQAMLSA-N 1 2 317.379 4.235 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2cc(F)cc(F)c2)[C@@H](C)CO1 ZINC001167438465 1037351709 /nfs/dbraw/zinc/35/17/09/1037351709.db2.gz ODFHIUDESVVKAH-IFXJQAMLSA-N 1 2 317.379 4.235 20 0 DIADLO Cc1c[nH+]cc(Nc2cc(Cl)cnc2Br)c1C ZINC001213524934 1037379107 /nfs/dbraw/zinc/37/91/07/1037379107.db2.gz JVOUAISDXBMNDJ-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO CCCC1(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CCC1 ZINC001125480463 1037382126 /nfs/dbraw/zinc/38/21/26/1037382126.db2.gz MPALRUNXTNHWMB-UHFFFAOYSA-N 1 2 317.820 4.435 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](C)c2ccc3c(c2)CCCC3)n1 ZINC000128663177 1037519545 /nfs/dbraw/zinc/51/95/45/1037519545.db2.gz KRMOPJIZQOIQKE-CQSZACIVSA-N 1 2 313.445 4.142 20 0 DIADLO C=C/C(C)=C\CC(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000684190254 1037521217 /nfs/dbraw/zinc/52/12/17/1037521217.db2.gz AYOLYBBNAINVIC-CHHVJCJISA-N 1 2 321.424 4.347 20 0 DIADLO CCSc1nn(C[N@H+]2CCC[C@H](C(C)C)C2)c(=S)s1 ZINC000780494936 1037529256 /nfs/dbraw/zinc/52/92/56/1037529256.db2.gz FWFWHRPBFAFXJX-NSHDSACASA-N 1 2 317.549 4.112 20 0 DIADLO CCSc1nn(C[N@@H+]2CCC[C@H](C(C)C)C2)c(=S)s1 ZINC000780494936 1037529240 /nfs/dbraw/zinc/52/92/40/1037529240.db2.gz FWFWHRPBFAFXJX-NSHDSACASA-N 1 2 317.549 4.112 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)o1 ZINC000068828400 1037556933 /nfs/dbraw/zinc/55/69/33/1037556933.db2.gz WKHRSMSHGMAMMA-UHFFFAOYSA-N 1 2 319.836 4.190 20 0 DIADLO CCN(C(=O)C[C@H](C)n1cc[nH+]c1)c1cccc2ccccc21 ZINC000581373109 1037562492 /nfs/dbraw/zinc/56/24/92/1037562492.db2.gz JRGKBULKOVLYBW-HNNXBMFYSA-N 1 2 307.397 4.041 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2cccc(-c3ccccc3)c2)no1 ZINC000581515918 1037705529 /nfs/dbraw/zinc/70/55/29/1037705529.db2.gz ONFJPUSUNDGVIV-LJQANCHMSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2cccc(-c3ccccc3)c2)no1 ZINC000581515918 1037705537 /nfs/dbraw/zinc/70/55/37/1037705537.db2.gz ONFJPUSUNDGVIV-LJQANCHMSA-N 1 2 319.408 4.382 20 0 DIADLO CCc1cc(C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cn2)on1 ZINC000581530533 1037715537 /nfs/dbraw/zinc/71/55/37/1037715537.db2.gz WPXHGMSOANCNPE-AWEZNQCLSA-N 1 2 323.396 4.275 20 0 DIADLO CCOc1cc(C[NH2+]C2(C(F)F)CCCC2)cc(Cl)c1O ZINC000656626536 1037716103 /nfs/dbraw/zinc/71/61/03/1037716103.db2.gz YKYBBXKGTTWZIX-UHFFFAOYSA-N 1 2 319.779 4.112 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)o1 ZINC000341220647 1037764589 /nfs/dbraw/zinc/76/45/89/1037764589.db2.gz NXZSUPMWZVHWGB-NXEZZACHSA-N 1 2 313.323 4.063 20 0 DIADLO CCc1ccc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)nc1 ZINC000581620515 1037789037 /nfs/dbraw/zinc/78/90/37/1037789037.db2.gz ZLVHKUHHUOGXLC-LBPRGKRZSA-N 1 2 302.368 4.042 20 0 DIADLO CCc1ccc(C[N@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)nc1 ZINC000581620515 1037789054 /nfs/dbraw/zinc/78/90/54/1037789054.db2.gz ZLVHKUHHUOGXLC-LBPRGKRZSA-N 1 2 302.368 4.042 20 0 DIADLO FC(F)(F)CC1C[NH+](Cc2nc(-c3ccccc3)cs2)C1 ZINC000656686800 1037792049 /nfs/dbraw/zinc/79/20/49/1037792049.db2.gz XQHBUJYGPCCCCR-UHFFFAOYSA-N 1 2 312.360 4.194 20 0 DIADLO Cc1ncc(CN(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)s1 ZINC000341256005 1037814850 /nfs/dbraw/zinc/81/48/50/1037814850.db2.gz CSIHLHSRFPPGPF-UHFFFAOYSA-N 1 2 304.463 4.125 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2CCCCC[C@@H]2c2ccncc2)n1 ZINC000891440450 1037818566 /nfs/dbraw/zinc/81/85/66/1037818566.db2.gz MDFFOQPXSNGBDS-MRXNPFEDSA-N 1 2 313.445 4.484 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2CCCCC[C@@H]2c2ccncc2)n1 ZINC000891440450 1037818578 /nfs/dbraw/zinc/81/85/78/1037818578.db2.gz MDFFOQPXSNGBDS-MRXNPFEDSA-N 1 2 313.445 4.484 20 0 DIADLO CC(C)c1cc(N2CCC(OCC3CC3)CC2)nc(C(C)C)[nH+]1 ZINC000341260660 1037819692 /nfs/dbraw/zinc/81/96/92/1037819692.db2.gz PCJXMUCDAWEHKB-UHFFFAOYSA-N 1 2 317.477 4.119 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)o1 ZINC000076292817 1037823516 /nfs/dbraw/zinc/82/35/16/1037823516.db2.gz RWGUPZIKBGVTKL-HNNXBMFYSA-N 1 2 305.397 4.209 20 0 DIADLO CC(C)[N@H+](Cc1nc2ccc(F)cc2s1)Cc1ccccn1 ZINC000581644783 1037830055 /nfs/dbraw/zinc/83/00/55/1037830055.db2.gz OKRUHJUCNAULFN-UHFFFAOYSA-N 1 2 315.417 4.241 20 0 DIADLO CC(C)[N@@H+](Cc1nc2ccc(F)cc2s1)Cc1ccccn1 ZINC000581644783 1037830064 /nfs/dbraw/zinc/83/00/64/1037830064.db2.gz OKRUHJUCNAULFN-UHFFFAOYSA-N 1 2 315.417 4.241 20 0 DIADLO c1coc(-c2ncc(CNc3c[nH+]cc4c3CCCC4)s2)c1 ZINC000656776405 1037860883 /nfs/dbraw/zinc/86/08/83/1037860883.db2.gz LOXGNJMXBISQEF-UHFFFAOYSA-N 1 2 311.410 4.289 20 0 DIADLO c1csc(-c2n[nH]cc2CNc2c[nH+]cc3c2CCCC3)c1 ZINC000656776404 1037862626 /nfs/dbraw/zinc/86/26/26/1037862626.db2.gz LNGQHVIESGDFNI-UHFFFAOYSA-N 1 2 310.426 4.024 20 0 DIADLO FC(F)(F)c1cnc(CNc2c[nH+]cc3c2CCCC3)s1 ZINC000656776980 1037864367 /nfs/dbraw/zinc/86/43/67/1037864367.db2.gz WYQGLMRPVQFVFL-UHFFFAOYSA-N 1 2 313.348 4.048 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2csc(C(F)(F)F)c2)s1 ZINC000926163343 1037880074 /nfs/dbraw/zinc/88/00/74/1037880074.db2.gz HCCFSDWHPRBGIJ-NKWVEPMBSA-N 1 2 321.393 4.339 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000891515461 1038004797 /nfs/dbraw/zinc/00/47/97/1038004797.db2.gz GMVMVJBTWACEKR-GFCCVEGCSA-N 1 2 315.417 4.332 20 0 DIADLO Cc1cc(F)ncc1C[N@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000891515461 1038004818 /nfs/dbraw/zinc/00/48/18/1038004818.db2.gz GMVMVJBTWACEKR-GFCCVEGCSA-N 1 2 315.417 4.332 20 0 DIADLO CCOc1cccc(/C=[NH+]/CCCSc2ccccc2)c1O ZINC000060804350 1038027478 /nfs/dbraw/zinc/02/74/78/1038027478.db2.gz IAWKDJPFWBIAPB-XMHGGMMESA-N 1 2 315.438 4.392 20 0 DIADLO Cc1ncc([C@H](C)[NH2+][C@@H](COCC(C)C)c2ccco2)s1 ZINC000090406793 1038034967 /nfs/dbraw/zinc/03/49/67/1038034967.db2.gz JJLOYXAWJMMDHB-JSGCOSHPSA-N 1 2 308.447 4.109 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)o1 ZINC000341448688 1038036174 /nfs/dbraw/zinc/03/61/74/1038036174.db2.gz BYSFTJXAMXVIGS-AWEZNQCLSA-N 1 2 305.397 4.038 20 0 DIADLO Clc1ccc(-c2nc(CSCCn3cc[nH+]c3)co2)cc1 ZINC000341490087 1038059948 /nfs/dbraw/zinc/05/99/48/1038059948.db2.gz DJRMMHZQANZHCM-UHFFFAOYSA-N 1 2 319.817 4.125 20 0 DIADLO Cc1cc(N(C)[C@H](C)c2ccc(F)c(F)c2)nc(C2CC2)[nH+]1 ZINC000341511232 1038065914 /nfs/dbraw/zinc/06/59/14/1038065914.db2.gz ZXAADXNUAHPQDH-LLVKDONJSA-N 1 2 303.356 4.138 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC001143404424 1038128464 /nfs/dbraw/zinc/12/84/64/1038128464.db2.gz NACHRUWVDBRCPI-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC001143404424 1038128471 /nfs/dbraw/zinc/12/84/71/1038128471.db2.gz NACHRUWVDBRCPI-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1c(C[NH2+]Cc2ncc(Cl)s2)oc2ccc(F)cc12 ZINC000349561477 1038158969 /nfs/dbraw/zinc/15/89/69/1038158969.db2.gz AKRFBDCWHGJELT-UHFFFAOYSA-N 1 2 310.781 4.280 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1cnn(-c2ccccc2)c1)C1CC1 ZINC000341597771 1038169953 /nfs/dbraw/zinc/16/99/53/1038169953.db2.gz ZDEBEFHMWVDUKP-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1cnn(-c2ccccc2)c1)C1CC1 ZINC000341597771 1038169962 /nfs/dbraw/zinc/16/99/62/1038169962.db2.gz ZDEBEFHMWVDUKP-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)n1 ZINC000891796359 1038201341 /nfs/dbraw/zinc/20/13/41/1038201341.db2.gz MROZLONIRSEXII-HNNXBMFYSA-N 1 2 300.402 4.015 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)n1 ZINC000891796359 1038201357 /nfs/dbraw/zinc/20/13/57/1038201357.db2.gz MROZLONIRSEXII-HNNXBMFYSA-N 1 2 300.402 4.015 20 0 DIADLO CCC[C@H](CC1CCCCC1)C(=O)NCCCCn1cc[nH+]c1 ZINC000603471026 1038216786 /nfs/dbraw/zinc/21/67/86/1038216786.db2.gz JRIRBMYYQJBWPB-GOSISDBHSA-N 1 2 319.493 4.166 20 0 DIADLO CN(Cc1nccn1C(F)F)c1cc[nH+]c2c(Cl)cccc12 ZINC000341739936 1038256678 /nfs/dbraw/zinc/25/66/78/1038256678.db2.gz BNCGMCFZIUWUDT-UHFFFAOYSA-N 1 2 322.746 4.116 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+][C@@H](C)c2nnc(CC)o2)cc1 ZINC000341803902 1038271371 /nfs/dbraw/zinc/27/13/71/1038271371.db2.gz NRAGIYPGMFCRSR-NEPJUHHUSA-N 1 2 305.447 4.156 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)c1sccc1-c1ccccc1 ZINC000603808931 1038285035 /nfs/dbraw/zinc/28/50/35/1038285035.db2.gz OLVJSGDTZNDZIH-UHFFFAOYSA-N 1 2 319.389 4.315 20 0 DIADLO Cc1c(C(=O)Nc2ccc3[nH+]ccn3c2)oc2c1c(C)ccc2C ZINC000603809238 1038285127 /nfs/dbraw/zinc/28/51/27/1038285127.db2.gz WEGKGAOBACHVET-UHFFFAOYSA-N 1 2 319.364 4.258 20 0 DIADLO C[N@H+](Cc1ccc(C(F)(F)F)cn1)Cc1ccccc1Cl ZINC000341836700 1038289254 /nfs/dbraw/zinc/28/92/54/1038289254.db2.gz SSJJWEXUEASZGJ-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccc(C(F)(F)F)cn1)Cc1ccccc1Cl ZINC000341836700 1038289263 /nfs/dbraw/zinc/28/92/63/1038289263.db2.gz SSJJWEXUEASZGJ-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccccc2)no1)c1ccc(C2CC2)cc1 ZINC000581993224 1038293628 /nfs/dbraw/zinc/29/36/28/1038293628.db2.gz DEUOXKRBBQBXIW-AWEZNQCLSA-N 1 2 319.408 4.465 20 0 DIADLO Cc1ccc2c(C(=O)Nc3ccc4[nH+]ccn4c3)csc2c1 ZINC000684574504 1038295501 /nfs/dbraw/zinc/29/55/01/1038295501.db2.gz CVXJJKJIUFSBRP-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2ncc(-c3cccs3)o2)s1 ZINC000639995101 1038309741 /nfs/dbraw/zinc/30/97/41/1038309741.db2.gz QXEAOWHSJGEAML-SECBINFHSA-N 1 2 305.428 4.019 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccccc1C(F)(F)F ZINC000341996612 1038363101 /nfs/dbraw/zinc/36/31/01/1038363101.db2.gz HMPQXJGXAIJEKG-SNVBAGLBSA-N 1 2 310.319 4.422 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2cc(C)ccc2OC)[nH]1 ZINC000277075715 1038363577 /nfs/dbraw/zinc/36/35/77/1038363577.db2.gz FIMDODTXRUGDOY-BFHYXJOUSA-N 1 2 316.449 4.047 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@](F)(c3cc(F)cc(F)c3)C2)c(C)n1 ZINC000341999891 1038366664 /nfs/dbraw/zinc/36/66/64/1038366664.db2.gz VQSKNXDFALSDDN-GOSISDBHSA-N 1 2 320.358 4.047 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@](F)(c3cc(F)cc(F)c3)C2)c(C)n1 ZINC000341999891 1038366677 /nfs/dbraw/zinc/36/66/77/1038366677.db2.gz VQSKNXDFALSDDN-GOSISDBHSA-N 1 2 320.358 4.047 20 0 DIADLO CC(C)C[N@H+](Cc1ncccn1)[C@H](C)c1ccccc1Cl ZINC000342045564 1038370316 /nfs/dbraw/zinc/37/03/16/1038370316.db2.gz JCCKZVMNZXHNRJ-CQSZACIVSA-N 1 2 303.837 4.349 20 0 DIADLO CC(C)C[N@@H+](Cc1ncccn1)[C@H](C)c1ccccc1Cl ZINC000342045564 1038370328 /nfs/dbraw/zinc/37/03/28/1038370328.db2.gz JCCKZVMNZXHNRJ-CQSZACIVSA-N 1 2 303.837 4.349 20 0 DIADLO CSc1ccc(C)c(NC(=O)[C@H](CC(C)C)n2cc[nH+]c2)c1 ZINC000635769030 1038375408 /nfs/dbraw/zinc/37/54/08/1038375408.db2.gz CUHIWIVOPZKMQO-INIZCTEOSA-N 1 2 317.458 4.139 20 0 DIADLO CCn1c2ccccc2c2cc(C[N@H+](C)Cc3cnc[nH]3)ccc21 ZINC000684615789 1038390812 /nfs/dbraw/zinc/39/08/12/1038390812.db2.gz DNMRGPFZHFSHTM-UHFFFAOYSA-N 1 2 318.424 4.170 20 0 DIADLO CCn1c2ccccc2c2cc(C[N@@H+](C)Cc3cnc[nH]3)ccc21 ZINC000684615789 1038390824 /nfs/dbraw/zinc/39/08/24/1038390824.db2.gz DNMRGPFZHFSHTM-UHFFFAOYSA-N 1 2 318.424 4.170 20 0 DIADLO Cc1cccc([C@H](C)Nc2cc(N3CCCCC3)[nH+]cn2)c1C ZINC000604380453 1038410267 /nfs/dbraw/zinc/41/02/67/1038410267.db2.gz SRUYYWUEJAESDC-INIZCTEOSA-N 1 2 310.445 4.257 20 0 DIADLO Cc1cccc([C@H](C)Nc2cc(N3CCCCC3)nc[nH+]2)c1C ZINC000604380453 1038410261 /nfs/dbraw/zinc/41/02/61/1038410261.db2.gz SRUYYWUEJAESDC-INIZCTEOSA-N 1 2 310.445 4.257 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1coc(-c2c(F)cccc2F)n1 ZINC000151330741 1038436384 /nfs/dbraw/zinc/43/63/84/1038436384.db2.gz UQPGDHQNXNVSRW-NSHDSACASA-N 1 2 318.323 4.406 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1coc(-c2c(F)cccc2F)n1 ZINC000151330741 1038436394 /nfs/dbraw/zinc/43/63/94/1038436394.db2.gz UQPGDHQNXNVSRW-NSHDSACASA-N 1 2 318.323 4.406 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2ccc(F)c(F)c2)[nH]1 ZINC000277207858 1038452402 /nfs/dbraw/zinc/45/24/02/1038452402.db2.gz KAXGSDSDYFSBNF-AXFHLTTASA-N 1 2 308.376 4.008 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nnc([C@@H](C)CC)[nH]1)c1cc(F)ccc1F ZINC000277232755 1038460564 /nfs/dbraw/zinc/46/05/64/1038460564.db2.gz MJOWPZPNZKHEMF-ZIBATOQPSA-N 1 2 322.403 4.398 20 0 DIADLO CCCC[C@@H](CC)CC(=O)NCc1cccc(-n2cc[nH+]c2)c1 ZINC000604944612 1038466720 /nfs/dbraw/zinc/46/67/20/1038466720.db2.gz MYEQHENTQUSGPY-MRXNPFEDSA-N 1 2 313.445 4.095 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccco1 ZINC000101597116 1038471454 /nfs/dbraw/zinc/47/14/54/1038471454.db2.gz VPTVFOLBMBRXQL-INIZCTEOSA-N 1 2 309.356 4.061 20 0 DIADLO CCCC[C@H](CC)CC(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC000604975528 1038472002 /nfs/dbraw/zinc/47/20/02/1038472002.db2.gz DKZJYYMGUJWABU-INIZCTEOSA-N 1 2 320.477 4.272 20 0 DIADLO C[N@H+](CC/C=C\c1ccc(Br)cc1)CC(F)F ZINC000604998005 1038475831 /nfs/dbraw/zinc/47/58/31/1038475831.db2.gz ZBOXVRSBHMUUIT-RQOWECAXSA-N 1 2 304.178 4.049 20 0 DIADLO C[N@@H+](CC/C=C\c1ccc(Br)cc1)CC(F)F ZINC000604998005 1038475839 /nfs/dbraw/zinc/47/58/39/1038475839.db2.gz ZBOXVRSBHMUUIT-RQOWECAXSA-N 1 2 304.178 4.049 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2c(F)cncc2F)C1 ZINC001167503758 1038479773 /nfs/dbraw/zinc/47/97/73/1038479773.db2.gz DNUMUYXMYHAUHJ-GTNSWQLSSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2c(F)cncc2F)C1 ZINC001167503758 1038479777 /nfs/dbraw/zinc/47/97/77/1038479777.db2.gz DNUMUYXMYHAUHJ-GTNSWQLSSA-N 1 2 306.331 4.082 20 0 DIADLO CCN(C(=O)c1cccc(-n2cc[nH+]c2)c1)c1cccc(C)c1C ZINC000605083144 1038485034 /nfs/dbraw/zinc/48/50/34/1038485034.db2.gz UYYGXJBDVCGHEH-UHFFFAOYSA-N 1 2 319.408 4.156 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2csc(Cl)c2)[nH]1 ZINC000277298861 1038491087 /nfs/dbraw/zinc/49/10/87/1038491087.db2.gz RVBULWMAXNZXEP-LPEHRKFASA-N 1 2 312.870 4.445 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H]2CC(C)(C)Cc3occc32)[nH]1 ZINC000277296334 1038491375 /nfs/dbraw/zinc/49/13/75/1038491375.db2.gz RPQANIJXUVIPMB-OUCADQQQSA-N 1 2 316.449 4.276 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)c(C)n1 ZINC000684677781 1038496115 /nfs/dbraw/zinc/49/61/15/1038496115.db2.gz OCEOOBYVOMYLPR-SECBINFHSA-N 1 2 312.310 4.106 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cccnc3Cl)CCCC2)n1 ZINC000171842657 1038497116 /nfs/dbraw/zinc/49/71/16/1038497116.db2.gz XNIJFOIHKBZLQR-UHFFFAOYSA-N 1 2 307.850 4.059 20 0 DIADLO CCn1cc(C[NH2+]Cc2c(Cl)ccc(Cl)c2Cl)cn1 ZINC000605322409 1038507099 /nfs/dbraw/zinc/50/70/99/1038507099.db2.gz JOHDVSOBKXMSDC-UHFFFAOYSA-N 1 2 318.635 4.153 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2csc(Cc3ccccc3)n2)[C@H]1C ZINC000605317125 1038509792 /nfs/dbraw/zinc/50/97/92/1038509792.db2.gz TUXVBEOLYMLKRE-KBPBESRZSA-N 1 2 318.511 4.060 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2csc(Cc3ccccc3)n2)[C@H]1C ZINC000605317125 1038509800 /nfs/dbraw/zinc/50/98/00/1038509800.db2.gz TUXVBEOLYMLKRE-KBPBESRZSA-N 1 2 318.511 4.060 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)s2)[nH]1 ZINC000277350250 1038515734 /nfs/dbraw/zinc/51/57/34/1038515734.db2.gz VOUDUDVQZPZYNT-GUBZILKMSA-N 1 2 312.870 4.445 20 0 DIADLO FC(F)(F)c1ccccc1COc1ccccc1-n1cc[nH+]c1 ZINC000605434228 1038516219 /nfs/dbraw/zinc/51/62/19/1038516219.db2.gz PKEPHOQYEMQMSR-UHFFFAOYSA-N 1 2 318.298 4.470 20 0 DIADLO FC(F)Oc1cccc(COc2ccccc2-n2cc[nH+]c2)c1 ZINC000605434177 1038516256 /nfs/dbraw/zinc/51/62/56/1038516256.db2.gz JOHLEFJSBULYEF-UHFFFAOYSA-N 1 2 316.307 4.053 20 0 DIADLO Cc1ccc(F)c(C[NH2+][C@@H](C)c2nccn2-c2ccccc2)c1 ZINC000342298364 1038521444 /nfs/dbraw/zinc/52/14/44/1038521444.db2.gz SHXDBIMVZWKFNX-HNNXBMFYSA-N 1 2 309.388 4.171 20 0 DIADLO C[C@@H]([NH2+]Cc1ccsc1Cl)c1nccn1-c1ccccc1 ZINC000342326343 1038536372 /nfs/dbraw/zinc/53/63/72/1038536372.db2.gz YFRITOCVMIBYEI-GFCCVEGCSA-N 1 2 317.845 4.438 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1ccc(F)c(F)c1F ZINC000657315896 1038557704 /nfs/dbraw/zinc/55/77/04/1038557704.db2.gz SQSVQNKRUHRBSL-VIFPVBQESA-N 1 2 313.294 4.102 20 0 DIADLO Cc1cn2cc(NC(=O)CC/C=C\c3ccccc3)ccc2[nH+]1 ZINC000606188053 1038569547 /nfs/dbraw/zinc/56/95/47/1038569547.db2.gz OKNWPTVEGPKEJR-UITAMQMPSA-N 1 2 305.381 4.075 20 0 DIADLO Cc1cc(NC(=O)C[C@H](c2[nH]cc[nH+]2)c2ccccc2)ccc1F ZINC000342408138 1038575219 /nfs/dbraw/zinc/57/52/19/1038575219.db2.gz AQRDPUOMWNSNPK-INIZCTEOSA-N 1 2 323.371 4.018 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](Cc1nc2cc(F)ccc2o1)C1CC1 ZINC000152205858 1038586571 /nfs/dbraw/zinc/58/65/71/1038586571.db2.gz FRUYIIUVQQQTDY-NSHDSACASA-N 1 2 300.333 4.286 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](Cc1nc2cc(F)ccc2o1)C1CC1 ZINC000152205858 1038586575 /nfs/dbraw/zinc/58/65/75/1038586575.db2.gz FRUYIIUVQQQTDY-NSHDSACASA-N 1 2 300.333 4.286 20 0 DIADLO CCc1ccc(C[N@H+](Cc2c(C)nn(C)c2Cl)C2CC2)cc1 ZINC000072089821 1038587730 /nfs/dbraw/zinc/58/77/30/1038587730.db2.gz RPRKLCBCITXZQL-UHFFFAOYSA-N 1 2 317.864 4.109 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2c(C)nn(C)c2Cl)C2CC2)cc1 ZINC000072089821 1038587733 /nfs/dbraw/zinc/58/77/33/1038587733.db2.gz RPRKLCBCITXZQL-UHFFFAOYSA-N 1 2 317.864 4.109 20 0 DIADLO CCCc1nc(C[N@@H+]2CCC[C@@H](C)[C@@H]2c2ccc(C)cc2)no1 ZINC000606452250 1038605024 /nfs/dbraw/zinc/60/50/24/1038605024.db2.gz QBYGSSRPBRVIJE-DNVCBOLYSA-N 1 2 313.445 4.304 20 0 DIADLO CCCc1nc(C[N@H+]2CCC[C@@H](C)[C@@H]2c2ccc(C)cc2)no1 ZINC000606452250 1038605027 /nfs/dbraw/zinc/60/50/27/1038605027.db2.gz QBYGSSRPBRVIJE-DNVCBOLYSA-N 1 2 313.445 4.304 20 0 DIADLO Cc1nc(C[NH2+]Cc2cccn2CCC(C)C)nc2ccccc12 ZINC000606469701 1038607279 /nfs/dbraw/zinc/60/72/79/1038607279.db2.gz IEJRKEHRYFBTPD-UHFFFAOYSA-N 1 2 322.456 4.076 20 0 DIADLO Cc1cn2cc(NC(=O)NCc3ccc(C(C)C)cc3)ccc2[nH+]1 ZINC000606569326 1038613765 /nfs/dbraw/zinc/61/37/65/1038613765.db2.gz MSBSKWAHJWRZLU-UHFFFAOYSA-N 1 2 322.412 4.088 20 0 DIADLO CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000606570162 1038614572 /nfs/dbraw/zinc/61/45/72/1038614572.db2.gz YWOZYDIWZUNJKH-CJNGLKHVSA-N 1 2 314.433 4.075 20 0 DIADLO CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606582823 1038615573 /nfs/dbraw/zinc/61/55/73/1038615573.db2.gz FOQFLDBEPUPAJO-SFHVURJKSA-N 1 2 322.412 4.195 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)N1CCCCC[C@H]1c1ccco1 ZINC000606583055 1038615777 /nfs/dbraw/zinc/61/57/77/1038615777.db2.gz NTEIKIHKGKWGRE-HNNXBMFYSA-N 1 2 324.384 4.077 20 0 DIADLO Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc3[nH+]ccn3c2)c1 ZINC000606584161 1038616325 /nfs/dbraw/zinc/61/63/25/1038616325.db2.gz DZNVEMGFXBQGJG-KRWDZBQOSA-N 1 2 320.396 4.012 20 0 DIADLO CC[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1nccs1 ZINC000657371132 1038617347 /nfs/dbraw/zinc/61/73/47/1038617347.db2.gz NZOGJUMNGGSIPV-CYBMUJFWSA-N 1 2 306.406 4.064 20 0 DIADLO CC(C)CO[C@H]1CC[N@H+](Cc2csc(C3CCCC3)n2)C1 ZINC000119744665 1038634395 /nfs/dbraw/zinc/63/43/95/1038634395.db2.gz IMPOWZCKXVXCHK-INIZCTEOSA-N 1 2 308.491 4.048 20 0 DIADLO CC(C)CO[C@H]1CC[N@@H+](Cc2csc(C3CCCC3)n2)C1 ZINC000119744665 1038634397 /nfs/dbraw/zinc/63/43/97/1038634397.db2.gz IMPOWZCKXVXCHK-INIZCTEOSA-N 1 2 308.491 4.048 20 0 DIADLO FC(F)(F)[C@H]1C[N@H+](CCCc2cccc3ccccc32)CCO1 ZINC000606901987 1038637941 /nfs/dbraw/zinc/63/79/41/1038637941.db2.gz SWMOTIVEGSRDRY-QGZVFWFLSA-N 1 2 323.358 4.036 20 0 DIADLO FC(F)(F)[C@H]1C[N@@H+](CCCc2cccc3ccccc32)CCO1 ZINC000606901987 1038637942 /nfs/dbraw/zinc/63/79/42/1038637942.db2.gz SWMOTIVEGSRDRY-QGZVFWFLSA-N 1 2 323.358 4.036 20 0 DIADLO C[N@H+](CCSc1cc(Cl)ccc1Cl)Cc1ccon1 ZINC000606901591 1038638171 /nfs/dbraw/zinc/63/81/71/1038638171.db2.gz IANRYCNFSTUPCV-UHFFFAOYSA-N 1 2 317.241 4.206 20 0 DIADLO C[N@@H+](CCSc1cc(Cl)ccc1Cl)Cc1ccon1 ZINC000606901591 1038638176 /nfs/dbraw/zinc/63/81/76/1038638176.db2.gz IANRYCNFSTUPCV-UHFFFAOYSA-N 1 2 317.241 4.206 20 0 DIADLO C[C@@H](c1ccc2ccccc2c1)[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000606904636 1038639342 /nfs/dbraw/zinc/63/93/42/1038639342.db2.gz OBYCQMDHVAVYRC-LRDDRELGSA-N 1 2 309.331 4.164 20 0 DIADLO C[C@@H](c1ccc2ccccc2c1)[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000606904636 1038639347 /nfs/dbraw/zinc/63/93/47/1038639347.db2.gz OBYCQMDHVAVYRC-LRDDRELGSA-N 1 2 309.331 4.164 20 0 DIADLO COc1cccc2c1CC[N@H+](Cc1cccc(F)c1Cl)C2 ZINC001140563978 1038652100 /nfs/dbraw/zinc/65/21/00/1038652100.db2.gz NCAYVMKSJGNVKY-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc2c1CC[N@@H+](Cc1cccc(F)c1Cl)C2 ZINC001140563978 1038652102 /nfs/dbraw/zinc/65/21/02/1038652102.db2.gz NCAYVMKSJGNVKY-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccn(-c3cccc(F)c3)n2)[C@H]1c1ccccc1 ZINC001167577684 1038679008 /nfs/dbraw/zinc/67/90/08/1038679008.db2.gz VCYQXDRIHUYZPA-MGPUTAFESA-N 1 2 321.399 4.204 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccn(-c3cccc(F)c3)n2)[C@H]1c1ccccc1 ZINC001167577684 1038679014 /nfs/dbraw/zinc/67/90/14/1038679014.db2.gz VCYQXDRIHUYZPA-MGPUTAFESA-N 1 2 321.399 4.204 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccccc2C(F)(F)F)c(C)[nH+]1 ZINC000097039891 1038684396 /nfs/dbraw/zinc/68/43/96/1038684396.db2.gz ZZFJMTLFHUERDH-UHFFFAOYSA-N 1 2 308.303 4.278 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(OC(F)(F)F)cc2)c(C)[nH+]1 ZINC000097039978 1038684568 /nfs/dbraw/zinc/68/45/68/1038684568.db2.gz OFMIKWCCZMIBDA-UHFFFAOYSA-N 1 2 324.302 4.158 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1coc(-c2ccccc2F)n1 ZINC000625981331 1038687828 /nfs/dbraw/zinc/68/78/28/1038687828.db2.gz OSOJEDHCDPAPMK-NSHDSACASA-N 1 2 310.319 4.100 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1coc(-c2ccccc2F)n1 ZINC000625981331 1038687832 /nfs/dbraw/zinc/68/78/32/1038687832.db2.gz OSOJEDHCDPAPMK-NSHDSACASA-N 1 2 310.319 4.100 20 0 DIADLO C[C@@H]1CCC[C@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1 ZINC000607484603 1038688324 /nfs/dbraw/zinc/68/83/24/1038688324.db2.gz HEOVNWLDFIPWEV-OLZOCXBDSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1cnc(C[N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)s1 ZINC000626007870 1038701786 /nfs/dbraw/zinc/70/17/86/1038701786.db2.gz XXYKBANAKQVSJO-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1cnc(C[N@H+]2CCc3cc(C(F)(F)F)ccc3C2)s1 ZINC000626007870 1038701791 /nfs/dbraw/zinc/70/17/91/1038701791.db2.gz XXYKBANAKQVSJO-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1[nH]c(CNc2cc(Cl)cc(Br)c2)[nH+]c1C ZINC000657486750 1038723066 /nfs/dbraw/zinc/72/30/66/1038723066.db2.gz ARHBSXKGQKOAQV-UHFFFAOYSA-N 1 2 314.614 4.055 20 0 DIADLO CCc1ccc(C[N@H+](Cc2ncc(COC)s2)C2CC2)cc1 ZINC000342696100 1038724877 /nfs/dbraw/zinc/72/48/77/1038724877.db2.gz AILJBPFZMGFHNC-UHFFFAOYSA-N 1 2 316.470 4.017 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2ncc(COC)s2)C2CC2)cc1 ZINC000342696100 1038724883 /nfs/dbraw/zinc/72/48/83/1038724883.db2.gz AILJBPFZMGFHNC-UHFFFAOYSA-N 1 2 316.470 4.017 20 0 DIADLO FC(F)C[N@@H+](Cc1ccccc1)C[C@@H]1CCCC12CCOCC2 ZINC001167589351 1038726278 /nfs/dbraw/zinc/72/62/78/1038726278.db2.gz CQSFZSKDMOUADE-KRWDZBQOSA-N 1 2 323.427 4.351 20 0 DIADLO FC(F)C[N@H+](Cc1ccccc1)C[C@@H]1CCCC12CCOCC2 ZINC001167589351 1038726286 /nfs/dbraw/zinc/72/62/86/1038726286.db2.gz CQSFZSKDMOUADE-KRWDZBQOSA-N 1 2 323.427 4.351 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cccc(OCC(C)C)c2)c(C)[nH+]1 ZINC000097213837 1038737684 /nfs/dbraw/zinc/73/76/84/1038737684.db2.gz YOPIZRITENNTBL-UHFFFAOYSA-N 1 2 312.413 4.294 20 0 DIADLO Cc1cn2cc(NC(=O)CC[C@H]3CCc4ccccc43)ccc2[nH+]1 ZINC001125612624 1038746853 /nfs/dbraw/zinc/74/68/53/1038746853.db2.gz CIGZMCOPRDUNHV-MRXNPFEDSA-N 1 2 319.408 4.091 20 0 DIADLO Cc1cn2cc(NC(=O)[C@H]3CC[C@H](C4CCC4)CC3)ccc2[nH+]1 ZINC001125612981 1038748167 /nfs/dbraw/zinc/74/81/67/1038748167.db2.gz DBDYXZYDYNTHNC-WKILWMFISA-N 1 2 311.429 4.188 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(C4=CCCC4)cc3)ccc2[nH+]1 ZINC001125613663 1038750457 /nfs/dbraw/zinc/75/04/57/1038750457.db2.gz LPUHYAKJHLBDSC-UHFFFAOYSA-N 1 2 317.392 4.462 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1cc2cccc(F)c2o1 ZINC000607886609 1038753844 /nfs/dbraw/zinc/75/38/44/1038753844.db2.gz IDFGWOXBSDZUQA-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cc2cccc(F)c2o1 ZINC000607897006 1038754974 /nfs/dbraw/zinc/75/49/74/1038754974.db2.gz LDDBDVSTDBSJLY-UHFFFAOYSA-N 1 2 321.311 4.214 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1nc(C3CC3)cs1)CCC2 ZINC000342744407 1038755380 /nfs/dbraw/zinc/75/53/80/1038755380.db2.gz YCMUSJIISLRGIA-AWEZNQCLSA-N 1 2 319.499 4.295 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1nc(C3CC3)cs1)CCC2 ZINC000342744407 1038755388 /nfs/dbraw/zinc/75/53/88/1038755388.db2.gz YCMUSJIISLRGIA-AWEZNQCLSA-N 1 2 319.499 4.295 20 0 DIADLO Cc1ccc(F)c(C[NH2+][C@H](c2ccccc2)c2ccccn2)c1 ZINC000116912233 1038762343 /nfs/dbraw/zinc/76/23/43/1038762343.db2.gz LNDKVXXHAUNNRD-HXUWFJFHSA-N 1 2 306.384 4.408 20 0 DIADLO Cc1c[nH+]c(CN2Cc3ccccc3C[C@H]2c2ccccc2)n1C ZINC000342797189 1038794535 /nfs/dbraw/zinc/79/45/35/1038794535.db2.gz FDRJSAHHUNMMDS-FQEVSTJZSA-N 1 2 317.436 4.028 20 0 DIADLO Cc1cnc(C[N@@H+]2Cc3ccccc3C[C@H]2c2ccccc2)n1C ZINC000342797189 1038794552 /nfs/dbraw/zinc/79/45/52/1038794552.db2.gz FDRJSAHHUNMMDS-FQEVSTJZSA-N 1 2 317.436 4.028 20 0 DIADLO Cc1cnc(C[N@H+]2Cc3ccccc3C[C@H]2c2ccccc2)n1C ZINC000342797189 1038794566 /nfs/dbraw/zinc/79/45/66/1038794566.db2.gz FDRJSAHHUNMMDS-FQEVSTJZSA-N 1 2 317.436 4.028 20 0 DIADLO COc1ccc2cc(NCc3c(F)cccc3OC)[nH+]cc2c1 ZINC001167606894 1038818931 /nfs/dbraw/zinc/81/89/31/1038818931.db2.gz UMPASVMDOQPKPD-UHFFFAOYSA-N 1 2 312.344 4.003 20 0 DIADLO Cc1ccc(-c2nc(C[NH+]3C[C@H](C)S[C@@H](C)C3)cs2)o1 ZINC000075891759 1038819756 /nfs/dbraw/zinc/81/97/56/1038819756.db2.gz RLWACAJGFMHEBS-RYUDHWBXSA-N 1 2 308.472 4.037 20 0 DIADLO CC[C@H]1C[N@H+](Cc2csc(-c3cccs3)n2)CCS1 ZINC000608510556 1038871971 /nfs/dbraw/zinc/87/19/71/1038871971.db2.gz LEENFQMQZDJNLJ-LBPRGKRZSA-N 1 2 310.513 4.199 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2csc(-c3cccs3)n2)CCS1 ZINC000608510556 1038871990 /nfs/dbraw/zinc/87/19/90/1038871990.db2.gz LEENFQMQZDJNLJ-LBPRGKRZSA-N 1 2 310.513 4.199 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@H](C)OC[C@H]2c2ccccc2)cc1 ZINC000608511017 1038872924 /nfs/dbraw/zinc/87/29/24/1038872924.db2.gz LVUDWJCJRPTZRO-KXBFYZLASA-N 1 2 313.466 4.371 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@H](C)OC[C@H]2c2ccccc2)cc1 ZINC000608511017 1038872946 /nfs/dbraw/zinc/87/29/46/1038872946.db2.gz LVUDWJCJRPTZRO-KXBFYZLASA-N 1 2 313.466 4.371 20 0 DIADLO c1cc(-c2nc(C[NH+]3CCC(C4CCCC4)CC3)no2)cs1 ZINC000608501843 1038873933 /nfs/dbraw/zinc/87/39/33/1038873933.db2.gz AIDBPRXALAETNL-UHFFFAOYSA-N 1 2 317.458 4.200 20 0 DIADLO CCC[C@H]1CCCC[N@@H+]1Cc1nc(Br)cs1 ZINC001137779873 1038878181 /nfs/dbraw/zinc/87/81/81/1038878181.db2.gz QOPQUOHDDLWYBS-JTQLQIEISA-N 1 2 303.269 4.060 20 0 DIADLO CCC[C@H]1CCCC[N@H+]1Cc1nc(Br)cs1 ZINC001137779873 1038878197 /nfs/dbraw/zinc/87/81/97/1038878197.db2.gz QOPQUOHDDLWYBS-JTQLQIEISA-N 1 2 303.269 4.060 20 0 DIADLO CCc1cc2c(ncnc2Oc2cccc(-n3cc[nH+]c3)c2)s1 ZINC000077982113 1038878282 /nfs/dbraw/zinc/87/82/82/1038878282.db2.gz YCJSQLFULMEEHP-UHFFFAOYSA-N 1 2 322.393 4.232 20 0 DIADLO CC(C)[C@@H]1CCC[N@@H+]1Cn1nc(-c2cccs2)oc1=S ZINC000063858877 1038898735 /nfs/dbraw/zinc/89/87/35/1038898735.db2.gz ZEEDBZSHUPDPAD-NSHDSACASA-N 1 2 309.460 4.012 20 0 DIADLO CC(C)[C@@H]1CCC[N@H+]1Cn1nc(-c2cccs2)oc1=S ZINC000063858877 1038898742 /nfs/dbraw/zinc/89/87/42/1038898742.db2.gz ZEEDBZSHUPDPAD-NSHDSACASA-N 1 2 309.460 4.012 20 0 DIADLO CC1(C)[C@@H]2C[N@@H+](Cc3c(Cl)cc(Cl)nc3Cl)C[C@@H]21 ZINC001232852462 1038904376 /nfs/dbraw/zinc/90/43/76/1038904376.db2.gz WVLGSEQJKNLGIV-DTORHVGOSA-N 1 2 305.636 4.130 20 0 DIADLO CC1(C)[C@@H]2C[N@H+](Cc3c(Cl)cc(Cl)nc3Cl)C[C@@H]21 ZINC001232852462 1038904398 /nfs/dbraw/zinc/90/43/98/1038904398.db2.gz WVLGSEQJKNLGIV-DTORHVGOSA-N 1 2 305.636 4.130 20 0 DIADLO C[C@H]([NH2+]Cc1cc2ccccc2s1)c1nc(C(C)(C)C)no1 ZINC000237539198 1038924605 /nfs/dbraw/zinc/92/46/05/1038924605.db2.gz WOTSDMIDHMQVOP-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3cnn(Cc4ccccc4)c3)cc2)[nH]1 ZINC001213085558 1038925259 /nfs/dbraw/zinc/92/52/59/1038925259.db2.gz LDLHPKCTCYWKBR-UHFFFAOYSA-N 1 2 315.380 4.065 20 0 DIADLO COc1cc(NCc2cc[nH+]c(N)c2)ccc1Oc1ccccc1 ZINC001167618698 1038937517 /nfs/dbraw/zinc/93/75/17/1038937517.db2.gz MRSSHCUWAQGVBW-UHFFFAOYSA-N 1 2 321.380 4.077 20 0 DIADLO Cc1cccc2nc(C[N@@H+](C)Cc3ccc(Cl)c(F)c3)cn21 ZINC000342868337 1038940675 /nfs/dbraw/zinc/94/06/75/1038940675.db2.gz MBJIAZRCGNHZIS-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1cccc2nc(C[N@H+](C)Cc3ccc(Cl)c(F)c3)cn21 ZINC000342868337 1038940685 /nfs/dbraw/zinc/94/06/85/1038940685.db2.gz MBJIAZRCGNHZIS-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3cc(-c4cccnc4)ccn3)cc2)[nH]1 ZINC001213085688 1038953137 /nfs/dbraw/zinc/95/31/37/1038953137.db2.gz ROXASFMRXJTTSU-UHFFFAOYSA-N 1 2 313.364 4.277 20 0 DIADLO CCCCc1nc(C[N@H+](C)Cc2cccc(N(C)C)c2)cs1 ZINC000534106500 1038985960 /nfs/dbraw/zinc/98/59/60/1038985960.db2.gz UHDNVTWMQJIVEV-UHFFFAOYSA-N 1 2 317.502 4.184 20 0 DIADLO CCCCc1nc(C[N@@H+](C)Cc2cccc(N(C)C)c2)cs1 ZINC000534106500 1038985980 /nfs/dbraw/zinc/98/59/80/1038985980.db2.gz UHDNVTWMQJIVEV-UHFFFAOYSA-N 1 2 317.502 4.184 20 0 DIADLO CCNc1ccnc(Cl)c1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213086023 1038991519 /nfs/dbraw/zinc/99/15/19/1038991519.db2.gz DILQWFGIIFVUDK-UHFFFAOYSA-N 1 2 313.792 4.301 20 0 DIADLO C[N@H+](Cc1cc(-c2ccco2)on1)Cc1ccc(Cl)c(F)c1 ZINC000534228618 1039007844 /nfs/dbraw/zinc/00/78/44/1039007844.db2.gz BSMCOPHWAZDJKE-UHFFFAOYSA-N 1 2 320.751 4.359 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccco2)on1)Cc1ccc(Cl)c(F)c1 ZINC000534228618 1039007854 /nfs/dbraw/zinc/00/78/54/1039007854.db2.gz BSMCOPHWAZDJKE-UHFFFAOYSA-N 1 2 320.751 4.359 20 0 DIADLO CCSc1ccc(Cl)cc1C(=O)Nc1cc(C)[nH+]cc1C ZINC000534299901 1039021216 /nfs/dbraw/zinc/02/12/16/1039021216.db2.gz JUTSLBQYQVGQBV-UHFFFAOYSA-N 1 2 320.845 4.138 20 0 DIADLO Cc1ccc(NC(=O)C[NH+]2CCC(CC(C)C)CC2)c(Cl)c1 ZINC001167635577 1039021479 /nfs/dbraw/zinc/02/14/79/1039021479.db2.gz NDXZFRXQPYXEGO-UHFFFAOYSA-N 1 2 322.880 4.345 20 0 DIADLO Cc1cc(NC(=O)N(C)[C@H](C)c2cc3ccccc3o2)c(C)c[nH+]1 ZINC000534325309 1039026212 /nfs/dbraw/zinc/02/62/12/1039026212.db2.gz MBRNDOUSOYQIGS-CQSZACIVSA-N 1 2 323.396 4.091 20 0 DIADLO COCc1cnc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)s1 ZINC000342930994 1039028065 /nfs/dbraw/zinc/02/80/65/1039028065.db2.gz JCOIEFADOJFWSM-BLLLJJGKSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1cnc(C[N@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)s1 ZINC000342930994 1039028085 /nfs/dbraw/zinc/02/80/85/1039028085.db2.gz JCOIEFADOJFWSM-BLLLJJGKSA-N 1 2 320.433 4.012 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@@H](C)c2cccnc2Cl)on1 ZINC000121154966 1039033830 /nfs/dbraw/zinc/03/38/30/1039033830.db2.gz STPIKKMUVIEBAG-NSHDSACASA-N 1 2 307.825 4.477 20 0 DIADLO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@H](C)c1nc(C)cs1 ZINC000091318673 1039042146 /nfs/dbraw/zinc/04/21/46/1039042146.db2.gz GAXNBJGSCRTXIG-QWHCGFSZSA-N 1 2 314.458 4.233 20 0 DIADLO CCc1nc(C[N@@H+]2CCC[C@@H]2CC(=O)c2cccs2)cs1 ZINC000121818457 1039069847 /nfs/dbraw/zinc/06/98/47/1039069847.db2.gz KZEIIIONJHWZAI-CYBMUJFWSA-N 1 2 320.483 4.004 20 0 DIADLO CCc1nc(C[N@H+]2CCC[C@@H]2CC(=O)c2cccs2)cs1 ZINC000121818457 1039069857 /nfs/dbraw/zinc/06/98/57/1039069857.db2.gz KZEIIIONJHWZAI-CYBMUJFWSA-N 1 2 320.483 4.004 20 0 DIADLO CCCn1c(C)nn(C[N@H+](Cc2ccccc2)C(C)C)c1=S ZINC000089649184 1039072822 /nfs/dbraw/zinc/07/28/22/1039072822.db2.gz BDLNOEFLXXVPCD-UHFFFAOYSA-N 1 2 318.490 4.001 20 0 DIADLO CCCn1c(C)nn(C[N@@H+](Cc2ccccc2)C(C)C)c1=S ZINC000089649184 1039072840 /nfs/dbraw/zinc/07/28/40/1039072840.db2.gz BDLNOEFLXXVPCD-UHFFFAOYSA-N 1 2 318.490 4.001 20 0 DIADLO CC[C@H](C)[C@H](C(=O)NCc1c[nH+]c(C)cc1C)c1ccccc1 ZINC000456826209 1039083806 /nfs/dbraw/zinc/08/38/06/1039083806.db2.gz AGWCNUNPNDBBRE-LIRRHRJNSA-N 1 2 310.441 4.145 20 0 DIADLO FC(F)(F)c1ncccc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213086795 1039111409 /nfs/dbraw/zinc/11/14/09/1039111409.db2.gz ALKBKNVVUNXOAN-UHFFFAOYSA-N 1 2 304.275 4.234 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1nc2c(s1)CCCC2 ZINC000091724596 1039111804 /nfs/dbraw/zinc/11/18/04/1039111804.db2.gz LWYVLNRVNNFYQY-KOLCDFICSA-N 1 2 305.447 4.039 20 0 DIADLO CC(C)[C@@H]([NH2+][C@H]1CCCC1(F)F)c1ccc2[nH]c(=O)oc2c1 ZINC000672621896 1039130286 /nfs/dbraw/zinc/13/02/86/1039130286.db2.gz NDFDUZKGIZZNQI-UONOGXRCSA-N 1 2 310.344 4.008 20 0 DIADLO Clc1cscc1C[NH2+]Cc1ccc(Br)o1 ZINC000308887924 1039186253 /nfs/dbraw/zinc/18/62/53/1039186253.db2.gz UZOXSRDARYBFLY-UHFFFAOYSA-N 1 2 306.612 4.047 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1nc(-c2ccc(C)cc2)no1 ZINC000248101585 1039200289 /nfs/dbraw/zinc/20/02/89/1039200289.db2.gz PLPDIXXEXKCGEI-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1nc(-c2ccc(C)cc2)no1 ZINC000248101585 1039200303 /nfs/dbraw/zinc/20/03/03/1039200303.db2.gz PLPDIXXEXKCGEI-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO C[C@H](C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)C1CCC1 ZINC000457757169 1039204822 /nfs/dbraw/zinc/20/48/22/1039204822.db2.gz LLFZAKIUXUNLKY-AWEZNQCLSA-N 1 2 323.440 4.261 20 0 DIADLO CCCOc1cccc2c(NCc3cc(C)nc(C)n3)cc[nH+]c12 ZINC000343139770 1039233389 /nfs/dbraw/zinc/23/33/89/1039233389.db2.gz LSZHIESVBRHTNZ-UHFFFAOYSA-N 1 2 322.412 4.043 20 0 DIADLO C[C@H](Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)c1ccncc1 ZINC000278183084 1039257492 /nfs/dbraw/zinc/25/74/92/1039257492.db2.gz BQBVRBRKNHVSSM-HNNXBMFYSA-N 1 2 318.424 4.455 20 0 DIADLO Cn1cc(-c2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2)cn1 ZINC001213088313 1039301927 /nfs/dbraw/zinc/30/19/27/1039301927.db2.gz YWADCUAHVDBCSM-UHFFFAOYSA-N 1 2 315.380 4.221 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1ccc(N3CCCCC3)c[nH+]1)CC2 ZINC000539627289 1039304690 /nfs/dbraw/zinc/30/46/90/1039304690.db2.gz PNINWUCJULBHOC-IBGZPJMESA-N 1 2 323.440 4.180 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3nc4c(s3)CCC4)CCC2)c(F)c1 ZINC000093111618 1039320216 /nfs/dbraw/zinc/32/02/16/1039320216.db2.gz IQWNQORTVBMLTM-UHFFFAOYSA-N 1 2 320.408 4.079 20 0 DIADLO Clc1cnc(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)c(Cl)c1 ZINC000539720159 1039325436 /nfs/dbraw/zinc/32/54/36/1039325436.db2.gz CDVIZKMBJAJWQV-KBPBESRZSA-N 1 2 317.285 4.248 20 0 DIADLO Clc1cnc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c(Cl)c1 ZINC000539720159 1039325449 /nfs/dbraw/zinc/32/54/49/1039325449.db2.gz CDVIZKMBJAJWQV-KBPBESRZSA-N 1 2 317.285 4.248 20 0 DIADLO CCC[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccccn1 ZINC000539736738 1039327045 /nfs/dbraw/zinc/32/70/45/1039327045.db2.gz DMZCJNHKJOCGKF-SFHVURJKSA-N 1 2 310.445 4.420 20 0 DIADLO c1cc(N2CCCCC2)ccc1[NH2+][C@H]1CCCC12CCOCC2 ZINC000324004182 1039335197 /nfs/dbraw/zinc/33/51/97/1039335197.db2.gz JSFVBLYIZKZFHK-IBGZPJMESA-N 1 2 314.473 4.438 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000536039399 1039340278 /nfs/dbraw/zinc/34/02/78/1039340278.db2.gz PXNCGDLAEHPKEQ-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000536039399 1039340291 /nfs/dbraw/zinc/34/02/91/1039340291.db2.gz PXNCGDLAEHPKEQ-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)s1 ZINC000539838713 1039355246 /nfs/dbraw/zinc/35/52/46/1039355246.db2.gz OOJWYRBNLLMOEQ-QGZVFWFLSA-N 1 2 323.408 4.162 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)s1 ZINC000539838713 1039355265 /nfs/dbraw/zinc/35/52/65/1039355265.db2.gz OOJWYRBNLLMOEQ-QGZVFWFLSA-N 1 2 323.408 4.162 20 0 DIADLO C[N@@H+](Cc1cc[nH]n1)Cc1ccc(-c2ccccc2Cl)s1 ZINC000539831438 1039361392 /nfs/dbraw/zinc/36/13/92/1039361392.db2.gz DFMMNTROTCISGT-UHFFFAOYSA-N 1 2 317.845 4.424 20 0 DIADLO C[N@H+](Cc1cc[nH]n1)Cc1ccc(-c2ccccc2Cl)s1 ZINC000539831438 1039361401 /nfs/dbraw/zinc/36/14/01/1039361401.db2.gz DFMMNTROTCISGT-UHFFFAOYSA-N 1 2 317.845 4.424 20 0 DIADLO Cc1nc(C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)cs1 ZINC000780508602 1039366388 /nfs/dbraw/zinc/36/63/88/1039366388.db2.gz IXHDDOBNWQPTAB-UHFFFAOYSA-N 1 2 320.767 4.414 20 0 DIADLO CCCOc1ccc(C[N@@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000539849957 1039367696 /nfs/dbraw/zinc/36/76/96/1039367696.db2.gz RXWNKBWKKSPWJC-SFHVURJKSA-N 1 2 317.454 4.110 20 0 DIADLO CCCOc1ccc(C[N@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000539849957 1039367715 /nfs/dbraw/zinc/36/77/15/1039367715.db2.gz RXWNKBWKKSPWJC-SFHVURJKSA-N 1 2 317.454 4.110 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)cc1F ZINC000539851013 1039375722 /nfs/dbraw/zinc/37/57/22/1039375722.db2.gz WHUDBEGTZFOYPG-GUYCJALGSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)cc1F ZINC000539851013 1039375739 /nfs/dbraw/zinc/37/57/39/1039375739.db2.gz WHUDBEGTZFOYPG-GUYCJALGSA-N 1 2 305.418 4.158 20 0 DIADLO COc1ccc2cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)ccc2n1 ZINC001213090178 1039418799 /nfs/dbraw/zinc/41/87/99/1039418799.db2.gz YBCVJLHDKKQAQC-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1nc(-c2ccccc2)cs1 ZINC000540163047 1039429589 /nfs/dbraw/zinc/42/95/89/1039429589.db2.gz JDVYSRPCICTBKB-WFASDCNBSA-N 1 2 324.453 4.261 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1nc(-c2ccccc2)cs1 ZINC000540163047 1039429600 /nfs/dbraw/zinc/42/96/00/1039429600.db2.gz JDVYSRPCICTBKB-WFASDCNBSA-N 1 2 324.453 4.261 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1nc(-c2ccccc2)cs1 ZINC000540163046 1039430894 /nfs/dbraw/zinc/43/08/94/1039430894.db2.gz JDVYSRPCICTBKB-SWLSCSKDSA-N 1 2 324.453 4.261 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1nc(-c2ccccc2)cs1 ZINC000540163046 1039430901 /nfs/dbraw/zinc/43/09/01/1039430901.db2.gz JDVYSRPCICTBKB-SWLSCSKDSA-N 1 2 324.453 4.261 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C2CC2)ccc1F)c1cc2n(n1)CCCC2 ZINC000647305353 1039434051 /nfs/dbraw/zinc/43/40/51/1039434051.db2.gz HBJMNXMYJHYRIE-CYBMUJFWSA-N 1 2 313.420 4.087 20 0 DIADLO O[C@@H]1CCCc2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc21 ZINC001213090738 1039470273 /nfs/dbraw/zinc/47/02/73/1039470273.db2.gz DLUNEWPYZMPOQI-GOSISDBHSA-N 1 2 305.381 4.190 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)cccc2F)o1 ZINC000130855622 1039478504 /nfs/dbraw/zinc/47/85/04/1039478504.db2.gz OKTZCOFWOCDJAA-MRXNPFEDSA-N 1 2 307.340 4.041 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2c(F)cccc2F)o1 ZINC000130855622 1039478509 /nfs/dbraw/zinc/47/85/09/1039478509.db2.gz OKTZCOFWOCDJAA-MRXNPFEDSA-N 1 2 307.340 4.041 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2ccccc2Oc2ccccc2)nc1 ZINC000540355242 1039479203 /nfs/dbraw/zinc/47/92/03/1039479203.db2.gz WQOYZKDYFHTZPT-INIZCTEOSA-N 1 2 319.408 4.428 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccccc2OC(C)C)c(C)s1 ZINC000540328170 1039479428 /nfs/dbraw/zinc/47/94/28/1039479428.db2.gz MRQCLLRIWDTNQP-LBPRGKRZSA-N 1 2 304.459 4.398 20 0 DIADLO c1coc(-c2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2)n1 ZINC001213090876 1039481098 /nfs/dbraw/zinc/48/10/98/1039481098.db2.gz KPQBMEWBYIWQQH-UHFFFAOYSA-N 1 2 302.337 4.475 20 0 DIADLO CC[C@H](C)[C@@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000540386188 1039482860 /nfs/dbraw/zinc/48/28/60/1039482860.db2.gz PBXIVIXFGXADND-MEDUHNTESA-N 1 2 319.836 4.477 20 0 DIADLO Cc1nc(-c2ccc([C@@H](C)[NH2+]Cc3ncc(C)cn3)cc2)cs1 ZINC000540378661 1039485711 /nfs/dbraw/zinc/48/57/11/1039485711.db2.gz BGNMZDCPZPOGFG-CYBMUJFWSA-N 1 2 324.453 4.068 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000540393504 1039486542 /nfs/dbraw/zinc/48/65/42/1039486542.db2.gz MDCNLSNCOLUFOO-HNNXBMFYSA-N 1 2 319.836 4.477 20 0 DIADLO Cc1cc(C[NH2+][C@@H](COCc2ccccc2)c2ccccc2)no1 ZINC000540457797 1039499067 /nfs/dbraw/zinc/49/90/67/1039499067.db2.gz BSFQFNXGJRWURK-FQEVSTJZSA-N 1 2 322.408 4.031 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@@H](C)c2ccc(C(F)(F)F)cc2)[nH]c1C ZINC000628138756 1039504192 /nfs/dbraw/zinc/50/41/92/1039504192.db2.gz OACAUOQKOYUGDC-LBPRGKRZSA-N 1 2 311.351 4.238 20 0 DIADLO Cc1nc(C[N@H+](C)[C@@H](C)c2ccc(C(F)(F)F)cc2)[nH]c1C ZINC000628138756 1039504201 /nfs/dbraw/zinc/50/42/01/1039504201.db2.gz OACAUOQKOYUGDC-LBPRGKRZSA-N 1 2 311.351 4.238 20 0 DIADLO Cc1[nH]c(CN(C)[C@@H](C)c2ccc(C(F)(F)F)cc2)[nH+]c1C ZINC000628138756 1039504218 /nfs/dbraw/zinc/50/42/18/1039504218.db2.gz OACAUOQKOYUGDC-LBPRGKRZSA-N 1 2 311.351 4.238 20 0 DIADLO CC(C)C[C@@H]1COCC[N@@H+]1Cc1ncc(-c2ccccc2)s1 ZINC000540506130 1039506668 /nfs/dbraw/zinc/50/66/68/1039506668.db2.gz URZZPYXCJOLGSJ-MRXNPFEDSA-N 1 2 316.470 4.057 20 0 DIADLO CC(C)C[C@@H]1COCC[N@H+]1Cc1ncc(-c2ccccc2)s1 ZINC000540506130 1039506679 /nfs/dbraw/zinc/50/66/79/1039506679.db2.gz URZZPYXCJOLGSJ-MRXNPFEDSA-N 1 2 316.470 4.057 20 0 DIADLO C[C@@H]1CSCC[N@@H+]1Cc1ccc(Cl)cc1Br ZINC000583998990 1039543106 /nfs/dbraw/zinc/54/31/06/1039543106.db2.gz ROZLGTXFIIPFRI-SECBINFHSA-N 1 2 320.683 4.040 20 0 DIADLO C[C@@H]1CSCC[N@H+]1Cc1ccc(Cl)cc1Br ZINC000583998990 1039543119 /nfs/dbraw/zinc/54/31/19/1039543119.db2.gz ROZLGTXFIIPFRI-SECBINFHSA-N 1 2 320.683 4.040 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2ccn(C3CCCC3)n2)c1 ZINC000540726024 1039555343 /nfs/dbraw/zinc/55/53/43/1039555343.db2.gz LERVWHYFDIRKAZ-UHFFFAOYSA-N 1 2 317.458 4.144 20 0 DIADLO CCc1cnc(C[N@H+](CCc2ccc(C)cc2)Cc2ccco2)o1 ZINC000525682722 1039561382 /nfs/dbraw/zinc/56/13/82/1039561382.db2.gz DIWSJGSWMJHDPH-UHFFFAOYSA-N 1 2 324.424 4.383 20 0 DIADLO CCc1cnc(C[N@@H+](CCc2ccc(C)cc2)Cc2ccco2)o1 ZINC000525682722 1039561400 /nfs/dbraw/zinc/56/14/00/1039561400.db2.gz DIWSJGSWMJHDPH-UHFFFAOYSA-N 1 2 324.424 4.383 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+](C)CCC(=O)c1ccc(F)cc1 ZINC000540823057 1039574830 /nfs/dbraw/zinc/57/48/30/1039574830.db2.gz SDUVVAGBXDLBJW-GFCCVEGCSA-N 1 2 321.342 4.370 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)CCC(=O)c1ccc(F)cc1 ZINC000540823057 1039574854 /nfs/dbraw/zinc/57/48/54/1039574854.db2.gz SDUVVAGBXDLBJW-GFCCVEGCSA-N 1 2 321.342 4.370 20 0 DIADLO CCOc1ccc([C@@H]([NH2+]Cc2cnc(C)o2)c2ccccc2)cc1 ZINC000628206906 1039594414 /nfs/dbraw/zinc/59/44/14/1039594414.db2.gz YJIJHIZQJVLDMB-FQEVSTJZSA-N 1 2 322.408 4.261 20 0 DIADLO C[N@H+](Cc1cnc(C2CCCCC2)s1)Cc1cccnc1 ZINC000540962381 1039600230 /nfs/dbraw/zinc/60/02/30/1039600230.db2.gz QQRNOETURAXDHB-UHFFFAOYSA-N 1 2 301.459 4.218 20 0 DIADLO C[N@@H+](Cc1cnc(C2CCCCC2)s1)Cc1cccnc1 ZINC000540962381 1039600251 /nfs/dbraw/zinc/60/02/51/1039600251.db2.gz QQRNOETURAXDHB-UHFFFAOYSA-N 1 2 301.459 4.218 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1c[nH]nc1-c1cccs1 ZINC000158917356 1039606645 /nfs/dbraw/zinc/60/66/45/1039606645.db2.gz DEZIMLSDJHFFEC-UHFFFAOYSA-N 1 2 323.425 4.120 20 0 DIADLO CCC[NH+](CCC)Cn1nc(-c2ccc(C)cc2)n(C)c1=S ZINC000935193919 1039617695 /nfs/dbraw/zinc/61/76/95/1039617695.db2.gz YYBRRYKLQLNESZ-UHFFFAOYSA-N 1 2 318.490 4.006 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2ncc(C(F)(F)F)s2)cc1 ZINC000278694983 1039654893 /nfs/dbraw/zinc/65/48/93/1039654893.db2.gz QIMIOYANHHFYAO-SECBINFHSA-N 1 2 316.348 4.021 20 0 DIADLO CC[N@H+](Cc1ccc(CO)o1)Cc1ccc(Cl)cc1Cl ZINC001140684033 1039670077 /nfs/dbraw/zinc/67/00/77/1039670077.db2.gz DZVPTGUJKMBFPI-UHFFFAOYSA-N 1 2 314.212 4.101 20 0 DIADLO CC[N@@H+](Cc1ccc(CO)o1)Cc1ccc(Cl)cc1Cl ZINC001140684033 1039670086 /nfs/dbraw/zinc/67/00/86/1039670086.db2.gz DZVPTGUJKMBFPI-UHFFFAOYSA-N 1 2 314.212 4.101 20 0 DIADLO Cc1ccc(C(C)(C)[NH2+]Cc2ncc(Cl)cc2Cl)cn1 ZINC000353565657 1039690942 /nfs/dbraw/zinc/69/09/42/1039690942.db2.gz BKYOUJBNKVTTEW-UHFFFAOYSA-N 1 2 310.228 4.117 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1ccc(F)cc1F ZINC000169283646 1039709123 /nfs/dbraw/zinc/70/91/23/1039709123.db2.gz JCMIELOMTSPJTP-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@H](c2ccccc2)C(C)C)n1 ZINC000136294977 1039733583 /nfs/dbraw/zinc/73/35/83/1039733583.db2.gz XLAUJLQAFVRMQM-BBRMVZONSA-N 1 2 319.474 4.371 20 0 DIADLO CCc1noc([C@@H](C)[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)n1 ZINC000083423021 1039734326 /nfs/dbraw/zinc/73/43/26/1039734326.db2.gz JLCPZDQWRYTFJV-GFCCVEGCSA-N 1 2 317.820 4.136 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)n1 ZINC000083423021 1039734340 /nfs/dbraw/zinc/73/43/40/1039734340.db2.gz JLCPZDQWRYTFJV-GFCCVEGCSA-N 1 2 317.820 4.136 20 0 DIADLO Cc1ccc(F)cc1NC(=O)[C@@H](C)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000542132822 1039798469 /nfs/dbraw/zinc/79/84/69/1039798469.db2.gz JMRAXCBHXYTELU-ZIAGYGMSSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(F)cc1NC(=O)[C@@H](C)[N@H+]1Cc2ccccc2[C@H]1C ZINC000542132822 1039798484 /nfs/dbraw/zinc/79/84/84/1039798484.db2.gz JMRAXCBHXYTELU-ZIAGYGMSSA-N 1 2 312.388 4.038 20 0 DIADLO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cc1ncc(Br)s1 ZINC000542156137 1039803701 /nfs/dbraw/zinc/80/37/01/1039803701.db2.gz XKRLGKSOEFFMFW-WDEREUQCSA-N 1 2 317.296 4.306 20 0 DIADLO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1ncc(Br)s1 ZINC000542156137 1039803715 /nfs/dbraw/zinc/80/37/15/1039803715.db2.gz XKRLGKSOEFFMFW-WDEREUQCSA-N 1 2 317.296 4.306 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](C)C/C(C)=C/c2ccccc2)cs1 ZINC000091868487 1039860150 /nfs/dbraw/zinc/86/01/50/1039860150.db2.gz BVHMYTDUYKRUBW-IPJDOKCGSA-N 1 2 316.470 4.386 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](C)C/C(C)=C/c2ccccc2)cs1 ZINC000091868487 1039860178 /nfs/dbraw/zinc/86/01/78/1039860178.db2.gz BVHMYTDUYKRUBW-IPJDOKCGSA-N 1 2 316.470 4.386 20 0 DIADLO Fc1cc(C2CC2)ccc1C[NH2+]Cc1c[nH]c(-c2ccccc2)n1 ZINC000491587431 1039866167 /nfs/dbraw/zinc/86/61/67/1039866167.db2.gz XXOPHRSXVLUNGL-UHFFFAOYSA-N 1 2 321.399 4.383 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2cccc(Cl)c2)no1)c1ccsc1 ZINC000669937749 1039867584 /nfs/dbraw/zinc/86/75/84/1039867584.db2.gz QXSHULORQLZJPF-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(-c2ccc(F)cc2)o1)c1ccsc1 ZINC000669938665 1039876608 /nfs/dbraw/zinc/87/66/08/1039876608.db2.gz UMWKGZGJTDBSBL-NSHDSACASA-N 1 2 302.374 4.393 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)cn1)c1nc(C(C)(C)C)cs1 ZINC000092747202 1039883500 /nfs/dbraw/zinc/88/35/00/1039883500.db2.gz JCOFYWDAFDOJNW-GHMZBOCLSA-N 1 2 307.438 4.387 20 0 DIADLO CC(C)[N@H+](Cc1csc(-c2ccccn2)n1)Cc1cccnc1 ZINC000093225710 1039898506 /nfs/dbraw/zinc/89/85/06/1039898506.db2.gz VAGHUTWXSOQWLM-UHFFFAOYSA-N 1 2 324.453 4.011 20 0 DIADLO CC(C)[N@@H+](Cc1csc(-c2ccccn2)n1)Cc1cccnc1 ZINC000093225710 1039898526 /nfs/dbraw/zinc/89/85/26/1039898526.db2.gz VAGHUTWXSOQWLM-UHFFFAOYSA-N 1 2 324.453 4.011 20 0 DIADLO CCc1nnc([C@H](C)[N@H+]2CC=C(c3ccc(CC)cc3)CC2)o1 ZINC000093262914 1039898773 /nfs/dbraw/zinc/89/87/73/1039898773.db2.gz IPHAPNKFVNLZBB-AWEZNQCLSA-N 1 2 311.429 4.045 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+]2CC=C(c3ccc(CC)cc3)CC2)o1 ZINC000093262914 1039898798 /nfs/dbraw/zinc/89/87/98/1039898798.db2.gz IPHAPNKFVNLZBB-AWEZNQCLSA-N 1 2 311.429 4.045 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+]2CC=C(c3ccc(CC)cc3)CC2)o1 ZINC000093262915 1039901092 /nfs/dbraw/zinc/90/10/92/1039901092.db2.gz IPHAPNKFVNLZBB-CQSZACIVSA-N 1 2 311.429 4.045 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+]2CC=C(c3ccc(CC)cc3)CC2)o1 ZINC000093262915 1039901103 /nfs/dbraw/zinc/90/11/03/1039901103.db2.gz IPHAPNKFVNLZBB-CQSZACIVSA-N 1 2 311.429 4.045 20 0 DIADLO Fc1ccc2oc(C[N@@H+]3CCO[C@H](c4ccsc4)C3)cc2c1 ZINC000093768162 1039902824 /nfs/dbraw/zinc/90/28/24/1039902824.db2.gz DDPITHSUTOMRBM-KRWDZBQOSA-N 1 2 317.385 4.207 20 0 DIADLO Fc1ccc2oc(C[N@H+]3CCO[C@H](c4ccsc4)C3)cc2c1 ZINC000093768162 1039902837 /nfs/dbraw/zinc/90/28/37/1039902837.db2.gz DDPITHSUTOMRBM-KRWDZBQOSA-N 1 2 317.385 4.207 20 0 DIADLO CCCc1csc(CNc2cc(CSCC)cc[nH+]2)n1 ZINC000492148690 1039925088 /nfs/dbraw/zinc/92/50/88/1039925088.db2.gz BYLRCLRBJUDEJL-UHFFFAOYSA-N 1 2 307.488 4.356 20 0 DIADLO CC(C)(C)c1ncc2c(n1)CC[N@@H+](Cc1cc3ccccc3o1)C2 ZINC000139490915 1039929193 /nfs/dbraw/zinc/92/91/93/1039929193.db2.gz ZERUKZRMPUTZHJ-UHFFFAOYSA-N 1 2 321.424 4.079 20 0 DIADLO CC(C)(C)c1ncc2c(n1)CC[N@H+](Cc1cc3ccccc3o1)C2 ZINC000139490915 1039929207 /nfs/dbraw/zinc/92/92/07/1039929207.db2.gz ZERUKZRMPUTZHJ-UHFFFAOYSA-N 1 2 321.424 4.079 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C\c2ccc3[nH]ccc3c2)c(C)[nH+]1 ZINC000492279593 1039942858 /nfs/dbraw/zinc/94/28/58/1039942858.db2.gz SSRPYUUZQYOCDQ-ALCCZGGFSA-N 1 2 305.381 4.140 20 0 DIADLO C[C@H](c1ccco1)[N@H+](Cc1cn2cc(Cl)ccc2n1)C1CC1 ZINC000175679434 1040044258 /nfs/dbraw/zinc/04/42/58/1040044258.db2.gz JLOAUTZMULYPLP-GFCCVEGCSA-N 1 2 315.804 4.306 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](Cc1cn2cc(Cl)ccc2n1)C1CC1 ZINC000175679434 1040044275 /nfs/dbraw/zinc/04/42/75/1040044275.db2.gz JLOAUTZMULYPLP-GFCCVEGCSA-N 1 2 315.804 4.306 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nc2c(s1)CCCC2 ZINC000685470013 1040068409 /nfs/dbraw/zinc/06/84/09/1040068409.db2.gz FIDPMIFWXKZOOI-OAHLLOKOSA-N 1 2 301.459 4.000 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nc2c(s1)CCCC2 ZINC000685470013 1040068428 /nfs/dbraw/zinc/06/84/28/1040068428.db2.gz FIDPMIFWXKZOOI-OAHLLOKOSA-N 1 2 301.459 4.000 20 0 DIADLO CC1(C)C[N@H+](Cc2nc3c(s2)CCC3)[C@H]1c1cccs1 ZINC000685473633 1040070012 /nfs/dbraw/zinc/07/00/12/1040070012.db2.gz YQXFGXLGXUXJNS-HNNXBMFYSA-N 1 2 304.484 4.276 20 0 DIADLO CC1(C)C[N@@H+](Cc2nc3c(s2)CCC3)[C@H]1c1cccs1 ZINC000685473633 1040070029 /nfs/dbraw/zinc/07/00/29/1040070029.db2.gz YQXFGXLGXUXJNS-HNNXBMFYSA-N 1 2 304.484 4.276 20 0 DIADLO CC[N@H+](Cc1coc(C(C)(C)C)n1)[C@@H](C)c1cccc(O)c1 ZINC000929792979 1040076383 /nfs/dbraw/zinc/07/63/83/1040076383.db2.gz SANYNDZOSUUPCO-ZDUSSCGKSA-N 1 2 302.418 4.261 20 0 DIADLO CC[N@@H+](Cc1coc(C(C)(C)C)n1)[C@@H](C)c1cccc(O)c1 ZINC000929792979 1040076401 /nfs/dbraw/zinc/07/64/01/1040076401.db2.gz SANYNDZOSUUPCO-ZDUSSCGKSA-N 1 2 302.418 4.261 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2ccc(F)cc2Cl)C2CC2)s1 ZINC000136225871 1040080827 /nfs/dbraw/zinc/08/08/27/1040080827.db2.gz UXSZBDGDAZEEED-CQSZACIVSA-N 1 2 310.825 4.485 20 0 DIADLO Cc1csc(C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)n1 ZINC000115611232 1040106669 /nfs/dbraw/zinc/10/66/69/1040106669.db2.gz CRHQQSAUAHYPRK-UHFFFAOYSA-N 1 2 316.401 4.449 20 0 DIADLO CCC[C@@H]([NH2+][C@H]1COCc2ccccc21)c1ncccc1Cl ZINC000926600911 1040114769 /nfs/dbraw/zinc/11/47/69/1040114769.db2.gz MFNBMOVJLTZEDV-SJORKVTESA-N 1 2 316.832 4.437 20 0 DIADLO CCC[C@@H]([NH2+][C@@H]1COCc2ccccc21)c1ncccc1Cl ZINC000926600909 1040115803 /nfs/dbraw/zinc/11/58/03/1040115803.db2.gz MFNBMOVJLTZEDV-IAGOWNOFSA-N 1 2 316.832 4.437 20 0 DIADLO Cc1cccc(COc2ccc([C@H](C)[NH2+]Cc3c[nH]cn3)cc2)c1 ZINC000171769910 1040117227 /nfs/dbraw/zinc/11/72/27/1040117227.db2.gz CITBCJQAVCHHKE-INIZCTEOSA-N 1 2 321.424 4.148 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)o1 ZINC000685572655 1040140119 /nfs/dbraw/zinc/14/01/19/1040140119.db2.gz XDPKNYLXEVVUHB-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1ncccc1COc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000685584969 1040144820 /nfs/dbraw/zinc/14/48/20/1040144820.db2.gz ZJMROVKSPHGARJ-UHFFFAOYSA-N 1 2 319.408 4.169 20 0 DIADLO Cc1cn[nH]c1C[NH2+]Cc1ccc(C)cc1O[C@H](C)CC(C)C ZINC000685618501 1040162305 /nfs/dbraw/zinc/16/23/05/1040162305.db2.gz DHFFKSQMWDADGA-MRXNPFEDSA-N 1 2 315.461 4.130 20 0 DIADLO Cc1c[nH]nc1C[NH2+]Cc1ccc(C)cc1O[C@H](C)CC(C)C ZINC000685618501 1040162311 /nfs/dbraw/zinc/16/23/11/1040162311.db2.gz DHFFKSQMWDADGA-MRXNPFEDSA-N 1 2 315.461 4.130 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1Cl)c1cn2c(n1)CCCC2 ZINC000924524193 1040198689 /nfs/dbraw/zinc/19/86/89/1040198689.db2.gz JQOHNSAELLZWPM-STQMWFEESA-N 1 2 303.837 4.285 20 0 DIADLO CCN(CC)c1ccc(N[C@H](C)c2cc3cnccc3o2)c[nH+]1 ZINC000657954968 1040212836 /nfs/dbraw/zinc/21/28/36/1040212836.db2.gz XTYMQXBWXJMDKM-CYBMUJFWSA-N 1 2 310.401 4.242 20 0 DIADLO CCN(CC)c1ccc(N[C@@H](C)c2cc3cnccc3o2)c[nH+]1 ZINC000657954971 1040213927 /nfs/dbraw/zinc/21/39/27/1040213927.db2.gz XTYMQXBWXJMDKM-ZDUSSCGKSA-N 1 2 310.401 4.242 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccc(C(F)F)nc1 ZINC000658014279 1040260583 /nfs/dbraw/zinc/26/05/83/1040260583.db2.gz XFWBJQPGPGRGBJ-RKDXNWHRSA-N 1 2 313.298 4.104 20 0 DIADLO CC(C)Cc1ccc(C[N@H+](C)Cc2nccn2C(F)F)cc1 ZINC000101726337 1040388251 /nfs/dbraw/zinc/38/82/51/1040388251.db2.gz HEDHQWUXMSHTLE-UHFFFAOYSA-N 1 2 307.388 4.109 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+](C)Cc2nccn2C(F)F)cc1 ZINC000101726337 1040388277 /nfs/dbraw/zinc/38/82/77/1040388277.db2.gz HEDHQWUXMSHTLE-UHFFFAOYSA-N 1 2 307.388 4.109 20 0 DIADLO Cc1ccc2sc(C(=O)Nc3ccc4[nH+]ccn4c3)cc2c1 ZINC000685734090 1040487658 /nfs/dbraw/zinc/48/76/58/1040487658.db2.gz OIQCBZWFAURTQY-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO Cc1ccc(F)c(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000278784213 1040517371 /nfs/dbraw/zinc/51/73/71/1040517371.db2.gz PZZZHEUVKKERSX-SECBINFHSA-N 1 2 318.339 4.460 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)[nH]n1 ZINC000442847846 1040521642 /nfs/dbraw/zinc/52/16/42/1040521642.db2.gz DNNOXIJFLAWFPE-CQSZACIVSA-N 1 2 309.335 4.156 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCCC[C@@H]2c2ccccc2)[nH]n1 ZINC000442847846 1040521654 /nfs/dbraw/zinc/52/16/54/1040521654.db2.gz DNNOXIJFLAWFPE-CQSZACIVSA-N 1 2 309.335 4.156 20 0 DIADLO COc1cccc(Cl)c1C[N@H+](C)CCC(=O)c1cccs1 ZINC001140730554 1040521733 /nfs/dbraw/zinc/52/17/33/1040521733.db2.gz PCAFVBUOTKCLLV-UHFFFAOYSA-N 1 2 323.845 4.115 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+](C)CCC(=O)c1cccs1 ZINC001140730554 1040521748 /nfs/dbraw/zinc/52/17/48/1040521748.db2.gz PCAFVBUOTKCLLV-UHFFFAOYSA-N 1 2 323.845 4.115 20 0 DIADLO CCCCc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000023890140 1040525918 /nfs/dbraw/zinc/52/59/18/1040525918.db2.gz QSKISCHRPHLMEH-UHFFFAOYSA-N 1 2 319.408 4.467 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1cn2c(n1)CCCC2 ZINC000924535302 1040536746 /nfs/dbraw/zinc/53/67/46/1040536746.db2.gz LSARCVUDVWOPKP-LLVKDONJSA-N 1 2 324.255 4.377 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000924540758 1040572564 /nfs/dbraw/zinc/57/25/64/1040572564.db2.gz GKDOXENAUGERTE-YUMQZZPRSA-N 1 2 300.189 4.097 20 0 DIADLO CC(C)C[N@@H+](C)Cn1nc(-c2ccc(Cl)cc2)oc1=S ZINC000065943641 1040610897 /nfs/dbraw/zinc/61/08/97/1040610897.db2.gz VNROHIJSHACEPS-UHFFFAOYSA-N 1 2 311.838 4.071 20 0 DIADLO CC(C)C[N@H+](C)Cn1nc(-c2ccc(Cl)cc2)oc1=S ZINC000065943641 1040610887 /nfs/dbraw/zinc/61/08/87/1040610887.db2.gz VNROHIJSHACEPS-UHFFFAOYSA-N 1 2 311.838 4.071 20 0 DIADLO C#CC[N@@H+](Cc1ccc(F)cc1)Cc1cc(Cl)nc(Cl)c1 ZINC000065957894 1040628126 /nfs/dbraw/zinc/62/81/26/1040628126.db2.gz XBFIIFJEOYCSOT-UHFFFAOYSA-N 1 2 323.198 4.163 20 0 DIADLO C#CC[N@H+](Cc1ccc(F)cc1)Cc1cc(Cl)nc(Cl)c1 ZINC000065957894 1040628135 /nfs/dbraw/zinc/62/81/35/1040628135.db2.gz XBFIIFJEOYCSOT-UHFFFAOYSA-N 1 2 323.198 4.163 20 0 DIADLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000570149266 1040652871 /nfs/dbraw/zinc/65/28/71/1040652871.db2.gz WXOMVNXSPZJGRH-NEPJUHHUSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000570149266 1040652881 /nfs/dbraw/zinc/65/28/81/1040652881.db2.gz WXOMVNXSPZJGRH-NEPJUHHUSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCC1(F)F)c1cc(Br)cs1 ZINC000309506256 1040709907 /nfs/dbraw/zinc/70/99/07/1040709907.db2.gz BZRGLFOZZWAIER-XVKPBYJWSA-N 1 2 310.207 4.349 20 0 DIADLO Cc1cn[nH]c1C[N@H+](Cc1ccccc1)Cc1ccccc1C ZINC000685834101 1040771276 /nfs/dbraw/zinc/77/12/76/1040771276.db2.gz MZZCIMWFFSYSPD-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO Cc1cn[nH]c1C[N@@H+](Cc1ccccc1)Cc1ccccc1C ZINC000685834101 1040771293 /nfs/dbraw/zinc/77/12/93/1040771293.db2.gz MZZCIMWFFSYSPD-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO Cc1cccc(N2CC[NH+](Cc3cscc3Cl)CC2)c1C ZINC001204618266 1040788537 /nfs/dbraw/zinc/78/85/37/1040788537.db2.gz OYMIIRYFYKUFAE-UHFFFAOYSA-N 1 2 320.889 4.341 20 0 DIADLO CN(C)c1cc(Cl)cc(Cl)c1C[NH+]1CCC(F)(F)CC1 ZINC000685845933 1040788810 /nfs/dbraw/zinc/78/88/10/1040788810.db2.gz BKQSLNPQZNLSGR-UHFFFAOYSA-N 1 2 323.214 4.291 20 0 DIADLO Cc1cc(-c2noc([C@H](CC(C)C)n3cc[nH+]c3)n2)ccc1F ZINC000923783372 1040797495 /nfs/dbraw/zinc/79/74/95/1040797495.db2.gz GDEUFXQRFPBUQB-HNNXBMFYSA-N 1 2 314.364 4.016 20 0 DIADLO C[C@H]([NH2+]C(c1ccccc1)c1ccccc1)c1cc2n(n1)CCC2 ZINC000414059287 1040799203 /nfs/dbraw/zinc/79/92/03/1040799203.db2.gz VZVZHKJDSVYOEX-INIZCTEOSA-N 1 2 317.436 4.270 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2ccsc2Br)o1 ZINC000282389336 1040922324 /nfs/dbraw/zinc/92/23/24/1040922324.db2.gz JSUNFXPCOSBTBW-VIFPVBQESA-N 1 2 300.221 4.263 20 0 DIADLO CC[N@H+](Cc1nccn1C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000171109730 1040967740 /nfs/dbraw/zinc/96/77/40/1040967740.db2.gz MLVQMZPDXXYLRK-GFCCVEGCSA-N 1 2 311.351 4.022 20 0 DIADLO CC[N@@H+](Cc1nccn1C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000171109730 1040967764 /nfs/dbraw/zinc/96/77/64/1040967764.db2.gz MLVQMZPDXXYLRK-GFCCVEGCSA-N 1 2 311.351 4.022 20 0 DIADLO C[N@H+](Cc1cn2ccccc2n1)Cc1cc(Cl)cc(Cl)c1 ZINC000613462820 1040970708 /nfs/dbraw/zinc/97/07/08/1040970708.db2.gz ZYWJBMXBAIWOLR-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1cn2ccccc2n1)Cc1cc(Cl)cc(Cl)c1 ZINC000613462820 1040970728 /nfs/dbraw/zinc/97/07/28/1040970728.db2.gz ZYWJBMXBAIWOLR-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2csc([C@@H](C)OC)n2)cc1 ZINC000175023791 1041021654 /nfs/dbraw/zinc/02/16/54/1041021654.db2.gz GCHDIZHGKDNNNM-QWHCGFSZSA-N 1 2 320.458 4.052 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2csc([C@@H](C)OC)n2)cc1 ZINC000175023791 1041021668 /nfs/dbraw/zinc/02/16/68/1041021668.db2.gz GCHDIZHGKDNNNM-QWHCGFSZSA-N 1 2 320.458 4.052 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@]23CCCc2ccccc23)c(C)[nH+]1 ZINC000175102257 1041033066 /nfs/dbraw/zinc/03/30/66/1041033066.db2.gz XNYAOQCQVHCUKB-NQIIRXRSSA-N 1 2 320.436 4.240 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nccc(C(F)(F)F)n2)c(C)s1 ZINC000414271228 1041067680 /nfs/dbraw/zinc/06/76/80/1041067680.db2.gz ZKLAVKGCYNGSEO-SECBINFHSA-N 1 2 315.364 4.025 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(OC(C)(C)C)cc1)c1csnn1 ZINC000414292236 1041090324 /nfs/dbraw/zinc/09/03/24/1041090324.db2.gz BVWJDUCAWNVRJS-NWDGAFQWSA-N 1 2 305.447 4.127 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2c1ccc(Cl)c2Cl)c1csnn1 ZINC000414298000 1041093306 /nfs/dbraw/zinc/09/33/06/1041093306.db2.gz IHXMHLPJOZCBKB-WRWORJQWSA-N 1 2 314.241 4.183 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2c1ccc(Cl)c2Cl)c1csnn1 ZINC000414297997 1041094270 /nfs/dbraw/zinc/09/42/70/1041094270.db2.gz IHXMHLPJOZCBKB-CPCISQLKSA-N 1 2 314.241 4.183 20 0 DIADLO CCCCCC[C@@H](CC)[NH2+][C@H](C(=O)OC)[C@@H](C)OC(C)(C)C ZINC001170578777 1041158607 /nfs/dbraw/zinc/15/86/07/1041158607.db2.gz KIWCPJDXOWHVLV-OAGGEKHMSA-N 1 2 315.498 4.070 20 0 DIADLO Cc1cc(C)c(NC(=O)CCc2cn(C)c3ccccc23)c(C)[nH+]1 ZINC000176392226 1041160899 /nfs/dbraw/zinc/16/08/99/1041160899.db2.gz UEKKOKFWQQEBTK-UHFFFAOYSA-N 1 2 321.424 4.070 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@H](F)C2)c(C(F)(F)F)c1 ZINC001143473903 1041175783 /nfs/dbraw/zinc/17/57/83/1041175783.db2.gz SCJSPDBZAKHGJW-LBPRGKRZSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@H](F)C2)c(C(F)(F)F)c1 ZINC001143473903 1041175791 /nfs/dbraw/zinc/17/57/91/1041175791.db2.gz SCJSPDBZAKHGJW-LBPRGKRZSA-N 1 2 305.315 4.038 20 0 DIADLO CCCCn1c(S[C@H]2C=CCCC2)nnc1[C@H](CC)[NH+](C)C ZINC000176537520 1041183145 /nfs/dbraw/zinc/18/31/45/1041183145.db2.gz CLNVFUSWUCASFP-GJZGRUSLSA-N 1 2 322.522 4.292 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)n1 ZINC000176894102 1041219213 /nfs/dbraw/zinc/21/92/13/1041219213.db2.gz AMIYMCFRIWUTSM-SNVBAGLBSA-N 1 2 306.397 4.215 20 0 DIADLO CC(C)(C)c1csc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)n1 ZINC000176894102 1041219231 /nfs/dbraw/zinc/21/92/31/1041219231.db2.gz AMIYMCFRIWUTSM-SNVBAGLBSA-N 1 2 306.397 4.215 20 0 DIADLO CC(C)(C)[C@@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc(F)cc1 ZINC000375894964 1041226262 /nfs/dbraw/zinc/22/62/62/1041226262.db2.gz IBZHQRXWOMZILJ-WBVHZDCISA-N 1 2 301.409 4.303 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)c1C ZINC001140862602 1041286555 /nfs/dbraw/zinc/28/65/55/1041286555.db2.gz HKXWWSCZKJPTSW-UHFFFAOYSA-N 1 2 308.347 4.209 20 0 DIADLO Cc1c[nH]c(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)c1C ZINC001140862602 1041286561 /nfs/dbraw/zinc/28/65/61/1041286561.db2.gz HKXWWSCZKJPTSW-UHFFFAOYSA-N 1 2 308.347 4.209 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](c2c(Cl)cccc2Cl)C2CC2)cn1 ZINC000810023339 1041293425 /nfs/dbraw/zinc/29/34/25/1041293425.db2.gz JXYJPJFPMOIAIE-MRXNPFEDSA-N 1 2 322.239 4.333 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+]1CCOc2ccccc2C1 ZINC000613565326 1041316066 /nfs/dbraw/zinc/31/60/66/1041316066.db2.gz JCZPIUNXXCCQHM-UHFFFAOYSA-N 1 2 320.392 4.045 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+]1CCOc2ccccc2C1 ZINC000613565326 1041316076 /nfs/dbraw/zinc/31/60/76/1041316076.db2.gz JCZPIUNXXCCQHM-UHFFFAOYSA-N 1 2 320.392 4.045 20 0 DIADLO CSc1ccc(CNc2ccc3c(c2)CCC[N@H+]3C)s1 ZINC000810149181 1041324403 /nfs/dbraw/zinc/32/44/03/1041324403.db2.gz ANIPSVPHXADHOZ-UHFFFAOYSA-N 1 2 304.484 4.465 20 0 DIADLO CSc1ccc(CNc2ccc3c(c2)CCC[N@@H+]3C)s1 ZINC000810149181 1041324415 /nfs/dbraw/zinc/32/44/15/1041324415.db2.gz ANIPSVPHXADHOZ-UHFFFAOYSA-N 1 2 304.484 4.465 20 0 DIADLO CCCCCC[C@@H](CC)[N@@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001170600064 1041330255 /nfs/dbraw/zinc/33/02/55/1041330255.db2.gz QRURDTRRJXPHAA-JKSUJKDBSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCCC[C@@H](CC)[N@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001170600064 1041330264 /nfs/dbraw/zinc/33/02/64/1041330264.db2.gz QRURDTRRJXPHAA-JKSUJKDBSA-N 1 2 307.482 4.155 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C1(F)CCCCC1 ZINC000810273669 1041362003 /nfs/dbraw/zinc/36/20/03/1041362003.db2.gz UQOHYIDBGHCPQE-UHFFFAOYSA-N 1 2 321.783 4.137 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2nccn2C2CC2)c2ccccc2)cc1 ZINC000892714294 1041369430 /nfs/dbraw/zinc/36/94/30/1041369430.db2.gz LYJSFZZAGZEUTK-HXUWFJFHSA-N 1 2 321.399 4.236 20 0 DIADLO COCC[N@H+](Cc1cccs1)Cc1nsc2ccccc12 ZINC000659817213 1041377696 /nfs/dbraw/zinc/37/76/96/1041377696.db2.gz ZGWSKOGNSATBKN-UHFFFAOYSA-N 1 2 318.467 4.006 20 0 DIADLO COCC[N@@H+](Cc1cccs1)Cc1nsc2ccccc12 ZINC000659817213 1041377706 /nfs/dbraw/zinc/37/77/06/1041377706.db2.gz ZGWSKOGNSATBKN-UHFFFAOYSA-N 1 2 318.467 4.006 20 0 DIADLO Cc1ccccc1C[N@H+](Cc1cncc(F)c1)Cc1ccccn1 ZINC001170605534 1041384760 /nfs/dbraw/zinc/38/47/60/1041384760.db2.gz UHIPNCFYBGKSIU-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ccccc1C[N@@H+](Cc1cncc(F)c1)Cc1ccccn1 ZINC001170605534 1041384773 /nfs/dbraw/zinc/38/47/73/1041384773.db2.gz UHIPNCFYBGKSIU-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2ccc(OC(C)(C)C)cc2)s1 ZINC000892721838 1041385442 /nfs/dbraw/zinc/38/54/42/1041385442.db2.gz ANIWBKPOMWHDBU-UHFFFAOYSA-N 1 2 319.474 4.129 20 0 DIADLO C[N@H+](Cc1cc(C2CC2)no1)Cc1ccc(Cl)c(Cl)c1 ZINC000659831051 1041389026 /nfs/dbraw/zinc/38/90/26/1041389026.db2.gz NSKTULFEYQPLNJ-UHFFFAOYSA-N 1 2 311.212 4.491 20 0 DIADLO C[N@@H+](Cc1cc(C2CC2)no1)Cc1ccc(Cl)c(Cl)c1 ZINC000659831051 1041389038 /nfs/dbraw/zinc/38/90/38/1041389038.db2.gz NSKTULFEYQPLNJ-UHFFFAOYSA-N 1 2 311.212 4.491 20 0 DIADLO c1cn(C2CC2)c(C[NH2+]Cc2ccccc2Oc2ccccc2)n1 ZINC000892756660 1041395388 /nfs/dbraw/zinc/39/53/88/1041395388.db2.gz FMGITTZBWWNMFN-UHFFFAOYSA-N 1 2 319.408 4.300 20 0 DIADLO CCOc1ccc(F)c(F)c1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC001143493810 1041417338 /nfs/dbraw/zinc/41/73/38/1041417338.db2.gz LSCUAPIMLCUHFJ-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(F)c(F)c1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC001143493810 1041417351 /nfs/dbraw/zinc/41/73/51/1041417351.db2.gz LSCUAPIMLCUHFJ-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO FC(F)(F)c1nnc(C[N@@H+]2CCC[C@@H]2C2CCCCC2)s1 ZINC000659846022 1041438676 /nfs/dbraw/zinc/43/86/76/1041438676.db2.gz NTXCGTNKPVOUGW-LLVKDONJSA-N 1 2 319.396 4.102 20 0 DIADLO FC(F)(F)c1nnc(C[N@H+]2CCC[C@@H]2C2CCCCC2)s1 ZINC000659846022 1041438681 /nfs/dbraw/zinc/43/86/81/1041438681.db2.gz NTXCGTNKPVOUGW-LLVKDONJSA-N 1 2 319.396 4.102 20 0 DIADLO CC(C)Cc1ccc(C[NH2+]Cc2coc(-c3ccccc3)n2)cn1 ZINC000892955378 1041438713 /nfs/dbraw/zinc/43/87/13/1041438713.db2.gz FIBADTKGLLXNTQ-UHFFFAOYSA-N 1 2 321.424 4.225 20 0 DIADLO CCOc1ccc(C[NH2+][C@@H](C)c2nc3ccccc3s2)o1 ZINC000892981960 1041446984 /nfs/dbraw/zinc/44/69/84/1041446984.db2.gz WFNQIFDUYVJOLW-NSHDSACASA-N 1 2 302.399 4.139 20 0 DIADLO C[C@H]([NH2+]Cc1nccn1C1CC1)c1cccc(Cl)c1Cl ZINC000892995407 1041452973 /nfs/dbraw/zinc/45/29/73/1041452973.db2.gz QZWARELGMLRJAS-JTQLQIEISA-N 1 2 310.228 4.376 20 0 DIADLO C[C@H](c1cccs1)[N@H+](Cc1cn(C)cn1)Cc1ccccc1 ZINC000659859894 1041464092 /nfs/dbraw/zinc/46/40/92/1041464092.db2.gz PLMSGCPCXIMFJX-OAHLLOKOSA-N 1 2 311.454 4.245 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](Cc1cn(C)cn1)Cc1ccccc1 ZINC000659859894 1041464097 /nfs/dbraw/zinc/46/40/97/1041464097.db2.gz PLMSGCPCXIMFJX-OAHLLOKOSA-N 1 2 311.454 4.245 20 0 DIADLO CCOc1ccc(F)c(F)c1C[N@H+](CC)Cc1cccs1 ZINC001143497677 1041464517 /nfs/dbraw/zinc/46/45/17/1041464517.db2.gz RQOWEYUYBARODP-UHFFFAOYSA-N 1 2 311.397 4.447 20 0 DIADLO CCOc1ccc(F)c(F)c1C[N@@H+](CC)Cc1cccs1 ZINC001143497677 1041464520 /nfs/dbraw/zinc/46/45/20/1041464520.db2.gz RQOWEYUYBARODP-UHFFFAOYSA-N 1 2 311.397 4.447 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)[nH]c1C ZINC000565242774 1041467527 /nfs/dbraw/zinc/46/75/27/1041467527.db2.gz SBBHQGDPZUHILR-MRXNPFEDSA-N 1 2 307.388 4.182 20 0 DIADLO Cc1[nH]c(CN[C@H](c2ccc(F)cc2F)C(C)(C)C)[nH+]c1C ZINC000565242774 1041467533 /nfs/dbraw/zinc/46/75/33/1041467533.db2.gz SBBHQGDPZUHILR-MRXNPFEDSA-N 1 2 307.388 4.182 20 0 DIADLO ClC1(Cl)C[C@@H]1C[N@@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000747668207 1041473231 /nfs/dbraw/zinc/47/32/31/1041473231.db2.gz AHBOHGVUHJTWOX-GDBMZVCRSA-N 1 2 321.251 4.087 20 0 DIADLO ClC1(Cl)C[C@@H]1C[N@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000747668207 1041473235 /nfs/dbraw/zinc/47/32/35/1041473235.db2.gz AHBOHGVUHJTWOX-GDBMZVCRSA-N 1 2 321.251 4.087 20 0 DIADLO Cc1cc(C)c(C(=O)N(C)[C@@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC001132583782 1041476535 /nfs/dbraw/zinc/47/65/35/1041476535.db2.gz YRMMZUPVLWOVOB-AWEZNQCLSA-N 1 2 316.832 4.493 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2ccc(-c3cccnc3)cc2)s1 ZINC000893073626 1041477150 /nfs/dbraw/zinc/47/71/50/1041477150.db2.gz MUUCTVUSLPYLKK-UHFFFAOYSA-N 1 2 324.453 4.013 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)NC[C@H]1c2ccccc2C[N@H+]1C ZINC001132625159 1041483549 /nfs/dbraw/zinc/48/35/49/1041483549.db2.gz ZIUXDCKJHNBGMA-APWZRJJASA-N 1 2 316.489 4.286 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)NC[C@H]1c2ccccc2C[N@@H+]1C ZINC001132625159 1041483554 /nfs/dbraw/zinc/48/35/54/1041483554.db2.gz ZIUXDCKJHNBGMA-APWZRJJASA-N 1 2 316.489 4.286 20 0 DIADLO COc1ccc(C[N@H+](Cc2csc(C(C)C)n2)C2CC2)cc1 ZINC000051254757 1041522218 /nfs/dbraw/zinc/52/22/18/1041522218.db2.gz XCMXZJFNCHMZFO-UHFFFAOYSA-N 1 2 316.470 4.440 20 0 DIADLO COc1ccc(C[N@@H+](Cc2csc(C(C)C)n2)C2CC2)cc1 ZINC000051254757 1041522225 /nfs/dbraw/zinc/52/22/25/1041522225.db2.gz XCMXZJFNCHMZFO-UHFFFAOYSA-N 1 2 316.470 4.440 20 0 DIADLO c1ccc2c(c1)CC(C[NH2+]c1ccc(N3CCSCC3)cc1)C2 ZINC000811471331 1041525546 /nfs/dbraw/zinc/52/55/46/1041525546.db2.gz OFNUASQWCZALHE-UHFFFAOYSA-N 1 2 324.493 4.067 20 0 DIADLO C[N@H+](Cc1cc(-c2ccc(F)cc2)no1)Cc1ccccc1F ZINC000042122118 1041576866 /nfs/dbraw/zinc/57/68/66/1041576866.db2.gz QXEFTWQKKMMKJZ-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccc(F)cc2)no1)Cc1ccccc1F ZINC000042122118 1041576876 /nfs/dbraw/zinc/57/68/76/1041576876.db2.gz QXEFTWQKKMMKJZ-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO Cc1nc([C@H]2CCCN2c2cc(C)[nH+]c(C3CCC3)n2)cs1 ZINC000893246322 1041579436 /nfs/dbraw/zinc/57/94/36/1041579436.db2.gz WVYFLCMXKAGWOU-OAHLLOKOSA-N 1 2 314.458 4.159 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000660033100 1041588770 /nfs/dbraw/zinc/58/87/70/1041588770.db2.gz XZKVIPAYSMPPBY-AWEZNQCLSA-N 1 2 310.319 4.092 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000660033100 1041588773 /nfs/dbraw/zinc/58/87/73/1041588773.db2.gz XZKVIPAYSMPPBY-AWEZNQCLSA-N 1 2 310.319 4.092 20 0 DIADLO COc1cccc(C[NH2+]C(C)(C)c2nc(C)cs2)c1Cl ZINC000660078898 1041601481 /nfs/dbraw/zinc/60/14/81/1041601481.db2.gz WUTVAHWCZUBCQQ-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO Cc1cc(NC(=O)[C@H]2C[C@@H]2c2ccc(C(F)(F)F)cc2)cc[nH+]1 ZINC000010634831 1041606368 /nfs/dbraw/zinc/60/63/68/1041606368.db2.gz VLWXWFMMCBAIDF-CABCVRRESA-N 1 2 320.314 4.151 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@@H+]2CCC[C@H]2c2ccncc2)c1 ZINC000660135668 1041625737 /nfs/dbraw/zinc/62/57/37/1041625737.db2.gz BIVCLWLAEZWQTK-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@H+]2CCC[C@H]2c2ccncc2)c1 ZINC000660135668 1041625741 /nfs/dbraw/zinc/62/57/41/1041625741.db2.gz BIVCLWLAEZWQTK-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c1OC(F)F ZINC000660135963 1041626062 /nfs/dbraw/zinc/62/60/62/1041626062.db2.gz GEBLBSWAXSPFNB-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(C[N@H+]2CCC[C@@H]2c2ccncc2)c1OC(F)F ZINC000660135963 1041626067 /nfs/dbraw/zinc/62/60/67/1041626067.db2.gz GEBLBSWAXSPFNB-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c1OC(F)F ZINC000660138335 1041626776 /nfs/dbraw/zinc/62/67/76/1041626776.db2.gz SLXUJSYJLPSGCM-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(C[N@H+]2CCC[C@@H]2c2cccnc2)c1OC(F)F ZINC000660138335 1041626779 /nfs/dbraw/zinc/62/67/79/1041626779.db2.gz SLXUJSYJLPSGCM-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Cc1ccc(C[S@](=O)[C@H](C)c2ccc3c(c2)CCC3)c(C)[nH+]1 ZINC000417160644 1041639159 /nfs/dbraw/zinc/63/91/59/1041639159.db2.gz HZWJKPRVQALMJR-QRQCRPRQSA-N 1 2 313.466 4.197 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+]Cc2coc(C)n2)cc1OC ZINC000660187586 1041656388 /nfs/dbraw/zinc/65/63/88/1041656388.db2.gz OASLXOFMHUQXEQ-ZDUSSCGKSA-N 1 2 318.417 4.021 20 0 DIADLO c1c2ccccc2n2c1C[N@H+](CCCOCc1ccccc1)CC2 ZINC001170690272 1041657937 /nfs/dbraw/zinc/65/79/37/1041657937.db2.gz GKEIQBWMTLJWSQ-UHFFFAOYSA-N 1 2 320.436 4.064 20 0 DIADLO c1c2ccccc2n2c1C[N@@H+](CCCOCc1ccccc1)CC2 ZINC001170690272 1041657948 /nfs/dbraw/zinc/65/79/48/1041657948.db2.gz GKEIQBWMTLJWSQ-UHFFFAOYSA-N 1 2 320.436 4.064 20 0 DIADLO COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nc(C)oc1C ZINC000660200011 1041663088 /nfs/dbraw/zinc/66/30/88/1041663088.db2.gz GGANBWCJMAIWTR-INIZCTEOSA-N 1 2 302.418 4.177 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1OC(C)C ZINC000584761988 1041665427 /nfs/dbraw/zinc/66/54/27/1041665427.db2.gz IVWBYUPVCQUSBS-LSDHHAIUSA-N 1 2 301.434 4.102 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1cc2cccc(Cl)c2s1 ZINC001133685789 1041691385 /nfs/dbraw/zinc/69/13/85/1041691385.db2.gz DTNRADNPNRYDQG-UHFFFAOYSA-N 1 2 316.813 4.241 20 0 DIADLO CC[C@@H]([NH2+]Cc1nsc2ccccc12)c1c(C)noc1C ZINC000660258515 1041693576 /nfs/dbraw/zinc/69/35/76/1041693576.db2.gz FDCLSUCWYXPRIK-CYBMUJFWSA-N 1 2 301.415 4.142 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2sc(-c3ccccc3)nc2C)co1 ZINC000660264760 1041696078 /nfs/dbraw/zinc/69/60/78/1041696078.db2.gz ZMIFGGARUWXQTN-NSHDSACASA-N 1 2 313.426 4.266 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cc(F)ccc2OC(F)F)s1 ZINC000660269798 1041697624 /nfs/dbraw/zinc/69/76/24/1041697624.db2.gz ORMRDVBCUCSDRN-VIFPVBQESA-N 1 2 316.348 4.043 20 0 DIADLO C[C@@H](OCCn1cc[nH+]c1)c1c(Cl)ccc(F)c1Cl ZINC001222129395 1041709052 /nfs/dbraw/zinc/70/90/52/1041709052.db2.gz OJMFCAJPBOXKTJ-SECBINFHSA-N 1 2 303.164 4.107 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc(Cl)c(F)c1)CC2 ZINC001137649348 1041726882 /nfs/dbraw/zinc/72/68/82/1041726882.db2.gz BXBAUCJUUMKKCM-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc(Cl)c(F)c1)CC2 ZINC001137649348 1041726890 /nfs/dbraw/zinc/72/68/90/1041726890.db2.gz BXBAUCJUUMKKCM-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CCc1nc(C)c([C@@H](C)[NH2+][C@@H]2COc3cc(F)cc(F)c32)s1 ZINC000364311236 1041740035 /nfs/dbraw/zinc/74/00/35/1041740035.db2.gz JQEHIEYRPZWFHN-PRHODGIISA-N 1 2 324.396 4.076 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccccc1Oc1cccnc1 ZINC000109390277 1041743629 /nfs/dbraw/zinc/74/36/29/1041743629.db2.gz LXUBBPIKWUASKN-MRXNPFEDSA-N 1 2 319.408 4.252 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccccc1Oc1cccnc1 ZINC000109390277 1041743637 /nfs/dbraw/zinc/74/36/37/1041743637.db2.gz LXUBBPIKWUASKN-MRXNPFEDSA-N 1 2 319.408 4.252 20 0 DIADLO CCc1ccc(C[N@H+](C)[C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000105732433 1041749534 /nfs/dbraw/zinc/74/95/34/1041749534.db2.gz ZPEUWDLPYNDPIY-CYBMUJFWSA-N 1 2 301.434 4.123 20 0 DIADLO CCc1ccc(C[N@@H+](C)[C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000105732433 1041749543 /nfs/dbraw/zinc/74/95/43/1041749543.db2.gz ZPEUWDLPYNDPIY-CYBMUJFWSA-N 1 2 301.434 4.123 20 0 DIADLO C[C@H]1CCC[C@@H]([N@H+](C)Cn2nc(-c3ccccc3)[nH]c2=S)C1 ZINC000025484842 1041753504 /nfs/dbraw/zinc/75/35/04/1041753504.db2.gz XXTGBNQVAWSGIW-DZGCQCFKSA-N 1 2 316.474 4.076 20 0 DIADLO C[C@H]1CCC[C@@H]([N@@H+](C)Cn2nc(-c3ccccc3)[nH]c2=S)C1 ZINC000025484842 1041753512 /nfs/dbraw/zinc/75/35/12/1041753512.db2.gz XXTGBNQVAWSGIW-DZGCQCFKSA-N 1 2 316.474 4.076 20 0 DIADLO C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ncco1 ZINC000925680777 1041768144 /nfs/dbraw/zinc/76/81/44/1041768144.db2.gz UHTOOFDTQNAVDO-IINYFYTJSA-N 1 2 310.319 4.495 20 0 DIADLO Fc1ccc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c(Cl)c1Cl ZINC000652064332 1041771374 /nfs/dbraw/zinc/77/13/74/1041771374.db2.gz LKXAWVCNQBRLHK-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1ccc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c(Cl)c1Cl ZINC000652064332 1041771377 /nfs/dbraw/zinc/77/13/77/1041771377.db2.gz LKXAWVCNQBRLHK-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CCC[C@H](c3ncccc3C)C2)c1 ZINC000652067696 1041773117 /nfs/dbraw/zinc/77/31/17/1041773117.db2.gz DGZSIGFNMUUTBV-IRXDYDNUSA-N 1 2 311.429 4.070 20 0 DIADLO Cc1nc(C[NH2+][C@H](CC(F)(F)F)c2ccccc2C)c(C)o1 ZINC000660423139 1041784515 /nfs/dbraw/zinc/78/45/15/1041784515.db2.gz JIUQXIDEIGVPRC-CQSZACIVSA-N 1 2 312.335 4.383 20 0 DIADLO Cc1nc(C[NH2+][C@@H](CC(F)(F)F)c2ccccc2C)c(C)o1 ZINC000660423138 1041784571 /nfs/dbraw/zinc/78/45/71/1041784571.db2.gz JIUQXIDEIGVPRC-AWEZNQCLSA-N 1 2 312.335 4.383 20 0 DIADLO C[C@H](Nc1ccc(C2(C(F)(F)F)CC2)c[nH+]1)c1cccc(N)c1 ZINC001170734804 1041795459 /nfs/dbraw/zinc/79/54/59/1041795459.db2.gz WMPZHOGRDUQBDG-NSHDSACASA-N 1 2 321.346 4.431 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CC[C@H](F)C(F)(F)CC2)c1Cl ZINC001137999427 1041803786 /nfs/dbraw/zinc/80/37/86/1041803786.db2.gz HGFQXOBXBRNUSN-NSHDSACASA-N 1 2 313.697 4.187 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c1Cl ZINC001137999427 1041803793 /nfs/dbraw/zinc/80/37/93/1041803793.db2.gz HGFQXOBXBRNUSN-NSHDSACASA-N 1 2 313.697 4.187 20 0 DIADLO c1coc([C@H]2C[N@H+](Cc3ccc(-c4ccccc4)o3)CCO2)c1 ZINC000093841130 1041825111 /nfs/dbraw/zinc/82/51/11/1041825111.db2.gz ZWJXLLUDYBKBMW-LJQANCHMSA-N 1 2 309.365 4.113 20 0 DIADLO c1coc([C@H]2C[N@@H+](Cc3ccc(-c4ccccc4)o3)CCO2)c1 ZINC000093841130 1041825117 /nfs/dbraw/zinc/82/51/17/1041825117.db2.gz ZWJXLLUDYBKBMW-LJQANCHMSA-N 1 2 309.365 4.113 20 0 DIADLO c1coc([C@@H]([NH2+][C@@H]2CCCc3cccnc32)c2ccccc2)c1 ZINC000320734696 1041840314 /nfs/dbraw/zinc/84/03/14/1041840314.db2.gz AIAQROPRIFLUCE-XLIONFOSSA-N 1 2 304.393 4.431 20 0 DIADLO Clc1cnc(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)c(Cl)c1 ZINC000660626145 1041845203 /nfs/dbraw/zinc/84/52/03/1041845203.db2.gz HCZWLXDDUCVRQH-GFCCVEGCSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1cnc(C[N@H+]2CCC[C@@H](c3ccccn3)C2)c(Cl)c1 ZINC000660626145 1041845207 /nfs/dbraw/zinc/84/52/07/1041845207.db2.gz HCZWLXDDUCVRQH-GFCCVEGCSA-N 1 2 322.239 4.163 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)[nH]1 ZINC000660767391 1041858813 /nfs/dbraw/zinc/85/88/13/1041858813.db2.gz QVZOXORYCPQSKK-YOEHRIQHSA-N 1 2 310.445 4.045 20 0 DIADLO CCc1nnc([C@H](C)[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)[nH]1 ZINC000660767391 1041858819 /nfs/dbraw/zinc/85/88/19/1041858819.db2.gz QVZOXORYCPQSKK-YOEHRIQHSA-N 1 2 310.445 4.045 20 0 DIADLO CCCC[C@@H](CC)C[N@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660764373 1041860503 /nfs/dbraw/zinc/86/05/03/1041860503.db2.gz OBKYMFMVARUXDC-NVXWUHKLSA-N 1 2 300.450 4.042 20 0 DIADLO CCCC[C@@H](CC)C[N@@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660764373 1041860509 /nfs/dbraw/zinc/86/05/09/1041860509.db2.gz OBKYMFMVARUXDC-NVXWUHKLSA-N 1 2 300.450 4.042 20 0 DIADLO CCc1cc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)on1 ZINC000651664677 1041870806 /nfs/dbraw/zinc/87/08/06/1041870806.db2.gz XXCZLJDUYADYMO-AWEZNQCLSA-N 1 2 307.397 4.150 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CCc3ccc(F)c(Cl)c32)cs1 ZINC000651702357 1041885631 /nfs/dbraw/zinc/88/56/31/1041885631.db2.gz RGUVGKOPEDHFPT-GFCCVEGCSA-N 1 2 310.825 4.275 20 0 DIADLO CC(C)c1cc(C[NH2+][C@H]2CCc3ccc(F)c(Cl)c32)on1 ZINC000651709919 1041888833 /nfs/dbraw/zinc/88/88/33/1041888833.db2.gz MLVUTVSSDGTKIG-ZDUSSCGKSA-N 1 2 308.784 4.368 20 0 DIADLO CC(C)(C)c1noc(C[N@H+](Cc2ccsc2)C(C)(C)C)n1 ZINC000661137829 1041894403 /nfs/dbraw/zinc/89/44/03/1041894403.db2.gz VHZKSGYPHHNCJZ-UHFFFAOYSA-N 1 2 307.463 4.229 20 0 DIADLO CC(C)(C)c1noc(C[N@@H+](Cc2ccsc2)C(C)(C)C)n1 ZINC000661137829 1041894406 /nfs/dbraw/zinc/89/44/06/1041894406.db2.gz VHZKSGYPHHNCJZ-UHFFFAOYSA-N 1 2 307.463 4.229 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2)cn1)c1ccco1 ZINC000651729198 1041895480 /nfs/dbraw/zinc/89/54/80/1041895480.db2.gz YWVFIAQHTTYPCG-KXBFYZLASA-N 1 2 322.408 4.380 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2)cn1)c1ccco1 ZINC000651729197 1041896225 /nfs/dbraw/zinc/89/62/25/1041896225.db2.gz YWVFIAQHTTYPCG-HNAYVOBHSA-N 1 2 322.408 4.380 20 0 DIADLO c1coc(-c2nc(C[NH+]3CCC(c4ccco4)CC3)cs2)c1 ZINC000661162670 1041897041 /nfs/dbraw/zinc/89/70/41/1041897041.db2.gz DHNMLQFLLPTQKC-UHFFFAOYSA-N 1 2 314.410 4.376 20 0 DIADLO CC[C@H]([NH2+]Cc1ncc(CSC)s1)c1ccccc1OC ZINC000815115434 1041914650 /nfs/dbraw/zinc/91/46/50/1041914650.db2.gz ZUGPNJPGNNBUGB-AWEZNQCLSA-N 1 2 322.499 4.256 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+]Cc1c(F)cc(F)cc1F ZINC000815152785 1041919544 /nfs/dbraw/zinc/91/95/44/1041919544.db2.gz WOAXUBSQKXTMIL-UHFFFAOYSA-N 1 2 315.722 4.056 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1ccc(-c2ccccc2)cn1 ZINC000651822512 1041923679 /nfs/dbraw/zinc/92/36/79/1041923679.db2.gz AAOYZPMNMALXIH-CVEARBPZSA-N 1 2 320.440 4.377 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1nnc(C(C)(C)C)o1)C(C)(C)C2 ZINC000815186595 1041927712 /nfs/dbraw/zinc/92/77/12/1041927712.db2.gz QJNDYKJQMNQGNK-UHFFFAOYSA-N 1 2 313.445 4.012 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1nnc(C(C)(C)C)o1)C(C)(C)C2 ZINC000815186595 1041927721 /nfs/dbraw/zinc/92/77/21/1041927721.db2.gz QJNDYKJQMNQGNK-UHFFFAOYSA-N 1 2 313.445 4.012 20 0 DIADLO FC(F)(F)c1csc(C[NH+]2CCC(C3CCC3)CC2)n1 ZINC000661375201 1041928692 /nfs/dbraw/zinc/92/86/92/1041928692.db2.gz WSMAEOQGJBNHKT-UHFFFAOYSA-N 1 2 304.381 4.174 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1cc2ccccc2c(Cl)n1 ZINC000815171011 1041930277 /nfs/dbraw/zinc/93/02/77/1041930277.db2.gz ISHRKUZKOCHDGG-UHFFFAOYSA-N 1 2 315.804 4.071 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1cc2ccccc2c(Cl)n1 ZINC000815171011 1041930288 /nfs/dbraw/zinc/93/02/88/1041930288.db2.gz ISHRKUZKOCHDGG-UHFFFAOYSA-N 1 2 315.804 4.071 20 0 DIADLO C[C@@H]([NH2+]Cc1c[nH]cn1)c1ccc(O[C@@H](C)c2ccccc2)cc1 ZINC000661460024 1041940784 /nfs/dbraw/zinc/94/07/84/1041940784.db2.gz XMXNXWUBJZRRJL-CVEARBPZSA-N 1 2 321.424 4.401 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](c2ccccc2F)C(C)C)cs1 ZINC000661489139 1041943972 /nfs/dbraw/zinc/94/39/72/1041943972.db2.gz ZXPFYWGJZCYKHH-LRDDRELGSA-N 1 2 322.449 4.477 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cnc(-c2ccccc2)nc1 ZINC000613794602 1041944786 /nfs/dbraw/zinc/94/47/86/1041944786.db2.gz VRUFIVOCQNBDFY-HNNXBMFYSA-N 1 2 321.399 4.476 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cnc(-c2ccccc2)nc1 ZINC000613794602 1041944796 /nfs/dbraw/zinc/94/47/96/1041944796.db2.gz VRUFIVOCQNBDFY-HNNXBMFYSA-N 1 2 321.399 4.476 20 0 DIADLO Cc1cc(F)c(C[NH+]2CCC3(CC2)C(F)(F)C3(F)F)c(F)c1 ZINC000651900168 1041946844 /nfs/dbraw/zinc/94/68/44/1041946844.db2.gz GLPRBPKQEPAZAR-UHFFFAOYSA-N 1 2 323.280 4.140 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)c1ccc(C2CCCC2)cc1 ZINC001126097412 1041947875 /nfs/dbraw/zinc/94/78/75/1041947875.db2.gz MPUQKLDZNDHJHO-UHFFFAOYSA-N 1 2 305.381 4.244 20 0 DIADLO CCCc1cc(C(=O)Nc2cccc3[nH+]ccn32)ccc1Cl ZINC001126097524 1041947984 /nfs/dbraw/zinc/94/79/84/1041947984.db2.gz OWKUHXFQGNRNST-UHFFFAOYSA-N 1 2 313.788 4.193 20 0 DIADLO CC(C)CCCCCC[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000815552463 1041961158 /nfs/dbraw/zinc/96/11/58/1041961158.db2.gz BUPMYNDKJOMBOM-OAHLLOKOSA-N 1 2 306.479 4.152 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(NCc2ccc3c(c2)CCO3)c1 ZINC001167781757 1041970440 /nfs/dbraw/zinc/97/04/40/1041970440.db2.gz LYXRKWFYQHFKJR-UHFFFAOYSA-N 1 2 310.441 4.388 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(F)cc1 ZINC000652204090 1041975102 /nfs/dbraw/zinc/97/51/02/1041975102.db2.gz FTKGRWXFXVEIJG-HNNXBMFYSA-N 1 2 309.816 4.090 20 0 DIADLO C[C@H]([NH2+]C1(c2ccccc2Cl)CCC1)c1cc2n(n1)CCC2 ZINC000652216712 1041978312 /nfs/dbraw/zinc/97/83/12/1041978312.db2.gz DJZRIPUATWAHGE-ZDUSSCGKSA-N 1 2 315.848 4.213 20 0 DIADLO CC1(C)CO[C@H](c2cccc(Cl)c2)C[N@@H+]1Cc1ccncc1 ZINC000661740730 1041983872 /nfs/dbraw/zinc/98/38/72/1041983872.db2.gz ROEQDHOQFYAWMB-KRWDZBQOSA-N 1 2 316.832 4.087 20 0 DIADLO CC1(C)CO[C@H](c2cccc(Cl)c2)C[N@H+]1Cc1ccncc1 ZINC000661740730 1041983875 /nfs/dbraw/zinc/98/38/75/1041983875.db2.gz ROEQDHOQFYAWMB-KRWDZBQOSA-N 1 2 316.832 4.087 20 0 DIADLO CC1(C)CO[C@@H](c2cccc(Cl)c2)C[N@@H+]1Cc1ccncc1 ZINC000661740733 1041984182 /nfs/dbraw/zinc/98/41/82/1041984182.db2.gz ROEQDHOQFYAWMB-QGZVFWFLSA-N 1 2 316.832 4.087 20 0 DIADLO CC1(C)CO[C@@H](c2cccc(Cl)c2)C[N@H+]1Cc1ccncc1 ZINC000661740733 1041984188 /nfs/dbraw/zinc/98/41/88/1041984188.db2.gz ROEQDHOQFYAWMB-QGZVFWFLSA-N 1 2 316.832 4.087 20 0 DIADLO c1ccc(COc2cc(NCOc3ccccc3)cc[nH+]2)cc1 ZINC001170803444 1041997160 /nfs/dbraw/zinc/99/71/60/1041997160.db2.gz GUTVAQWCLJJTDS-UHFFFAOYSA-N 1 2 306.365 4.109 20 0 DIADLO CCCC[N@H+](Cc1cc(C)n(C)n1)Cc1ccccc1Cl ZINC000487363039 1041998586 /nfs/dbraw/zinc/99/85/86/1041998586.db2.gz FJGBRHILPJZJMN-UHFFFAOYSA-N 1 2 305.853 4.184 20 0 DIADLO CCCC[N@@H+](Cc1cc(C)n(C)n1)Cc1ccccc1Cl ZINC000487363039 1041998594 /nfs/dbraw/zinc/99/85/94/1041998594.db2.gz FJGBRHILPJZJMN-UHFFFAOYSA-N 1 2 305.853 4.184 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2sc(C(C)(C)C)nc2C)c1 ZINC000652330585 1042009437 /nfs/dbraw/zinc/00/94/37/1042009437.db2.gz KDGVOJSYWKBRLW-LLVKDONJSA-N 1 2 319.474 4.464 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2ccc(OC(F)F)cc2)c1 ZINC000652329912 1042010128 /nfs/dbraw/zinc/01/01/28/1042010128.db2.gz NUGCJOOJNICOTA-NSHDSACASA-N 1 2 308.328 4.003 20 0 DIADLO O=C1CCCC12CC[NH+](Cc1csc(C3CCCC3)n1)CC2 ZINC000661954873 1042028788 /nfs/dbraw/zinc/02/87/88/1042028788.db2.gz PWAYZQYDEKAAOI-UHFFFAOYSA-N 1 2 318.486 4.136 20 0 DIADLO CSCc1cnc(C[N@H+]2Cc3ccccc3[C@H](C)C2)s1 ZINC000816482405 1042056656 /nfs/dbraw/zinc/05/66/56/1042056656.db2.gz DSDSQVXNKFRIEL-GFCCVEGCSA-N 1 2 304.484 4.125 20 0 DIADLO CSCc1cnc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)s1 ZINC000816482405 1042056658 /nfs/dbraw/zinc/05/66/58/1042056658.db2.gz DSDSQVXNKFRIEL-GFCCVEGCSA-N 1 2 304.484 4.125 20 0 DIADLO CCCC[N@H+](Cc1cnn(C)c1Cl)[C@H](C)c1ccc(C)o1 ZINC000816490857 1042057998 /nfs/dbraw/zinc/05/79/98/1042057998.db2.gz LIOQINQKFCUKAK-CYBMUJFWSA-N 1 2 309.841 4.338 20 0 DIADLO CCCC[N@@H+](Cc1cnn(C)c1Cl)[C@H](C)c1ccc(C)o1 ZINC000816490857 1042058006 /nfs/dbraw/zinc/05/80/06/1042058006.db2.gz LIOQINQKFCUKAK-CYBMUJFWSA-N 1 2 309.841 4.338 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+]1CC[C@@H]1c1ccc(Br)cc1 ZINC000662098054 1042064438 /nfs/dbraw/zinc/06/44/38/1042064438.db2.gz DTUHADYBHCPOPE-BLLLJJGKSA-N 1 2 317.230 4.352 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+]1CC[C@@H]1c1ccc(Br)cc1 ZINC000662098054 1042064444 /nfs/dbraw/zinc/06/44/44/1042064444.db2.gz DTUHADYBHCPOPE-BLLLJJGKSA-N 1 2 317.230 4.352 20 0 DIADLO FC1(F)CC[NH+](Cc2ccc(Sc3ccccn3)o2)CC1 ZINC000816596941 1042071533 /nfs/dbraw/zinc/07/15/33/1042071533.db2.gz XVRJTGWZOMDUAL-UHFFFAOYSA-N 1 2 310.369 4.057 20 0 DIADLO Fc1c(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)ccnc1Cl ZINC000817412136 1042108608 /nfs/dbraw/zinc/10/86/08/1042108608.db2.gz DMWYORDBALXZJG-VIFPVBQESA-N 1 2 310.722 4.039 20 0 DIADLO Fc1c(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)ccnc1Cl ZINC000817412136 1042108611 /nfs/dbraw/zinc/10/86/11/1042108611.db2.gz DMWYORDBALXZJG-VIFPVBQESA-N 1 2 310.722 4.039 20 0 DIADLO CC(C)c1cccc(C[NH2+][C@H](c2nccn2C)c2ccccc2)c1 ZINC000663314271 1042109598 /nfs/dbraw/zinc/10/95/98/1042109598.db2.gz COOJIIGYMYIEQN-FQEVSTJZSA-N 1 2 319.452 4.423 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CC[C@@H]4C[C@@H]4C3)c2)[nH+]c1C ZINC000817522433 1042111914 /nfs/dbraw/zinc/11/19/14/1042111914.db2.gz IDXTUZTWSUQQAI-FVQBIDKESA-N 1 2 309.413 4.068 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@H](C)c1ccncc1Cl)CCC2 ZINC000817584800 1042118411 /nfs/dbraw/zinc/11/84/11/1042118411.db2.gz FXONCPZPYBANHG-MLGOLLRUSA-N 1 2 318.852 4.241 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2cccc(Cl)c2)cs1 ZINC000165247214 1042125899 /nfs/dbraw/zinc/12/58/99/1042125899.db2.gz ZVHGKVQMAKMODY-QWRGUYRKSA-N 1 2 310.850 4.355 20 0 DIADLO O=C(Cc1c[nH]c[nH+]1)Nc1ccc(-c2cc3ccccc3o2)cc1 ZINC001136025040 1042127389 /nfs/dbraw/zinc/12/73/89/1042127389.db2.gz UATCRHKYKJWVNP-UHFFFAOYSA-N 1 2 317.348 4.004 20 0 DIADLO CCc1nc(C[N@@H+]2CCC[C@@H]2c2cccc3ccccc32)no1 ZINC000067460378 1042141609 /nfs/dbraw/zinc/14/16/09/1042141609.db2.gz DNTOSHSBJAFCBF-QGZVFWFLSA-N 1 2 307.397 4.122 20 0 DIADLO CCc1nc(C[N@H+]2CCC[C@@H]2c2cccc3ccccc32)no1 ZINC000067460378 1042141612 /nfs/dbraw/zinc/14/16/12/1042141612.db2.gz DNTOSHSBJAFCBF-QGZVFWFLSA-N 1 2 307.397 4.122 20 0 DIADLO CC(C)Oc1c(F)cc(NCc2c[nH+]cn2C(C)C)cc1F ZINC000818203925 1042143556 /nfs/dbraw/zinc/14/35/56/1042143556.db2.gz MZRMTNUHDDHAIW-UHFFFAOYSA-N 1 2 309.360 4.142 20 0 DIADLO O=C(CCc1ccc2ccccc2c1)Nc1ccc2[nH+]ccn2c1 ZINC000603809124 1042161298 /nfs/dbraw/zinc/16/12/98/1042161298.db2.gz OVAISZYTQIAZJH-UHFFFAOYSA-N 1 2 315.376 4.059 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1nc(CCC(C)C)no1 ZINC000603967953 1042166775 /nfs/dbraw/zinc/16/67/75/1042166775.db2.gz KTUVEKJMFWTNNA-KRWDZBQOSA-N 1 2 313.445 4.168 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1nc(CCC(C)C)no1 ZINC000603967953 1042166778 /nfs/dbraw/zinc/16/67/78/1042166778.db2.gz KTUVEKJMFWTNNA-KRWDZBQOSA-N 1 2 313.445 4.168 20 0 DIADLO CCn1nccc1C[NH2+][C@@H](C)c1cc(Cl)sc1Cl ZINC000663467658 1042180826 /nfs/dbraw/zinc/18/08/26/1042180826.db2.gz LNPXBSKDIVXEQC-QMMMGPOBSA-N 1 2 304.246 4.122 20 0 DIADLO CCN(C(=O)[C@H](CC(C)C)n1cc[nH+]c1)c1cccc(C)c1C ZINC001136389221 1042234269 /nfs/dbraw/zinc/23/42/69/1042234269.db2.gz QXFQJMZJIWXZOU-SFHVURJKSA-N 1 2 313.445 4.140 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3C[C@H]3CC(C)C)c2)[nH+]c1C ZINC001136399390 1042237410 /nfs/dbraw/zinc/23/74/10/1042237410.db2.gz WZRPWMBKZSUONT-NVXWUHKLSA-N 1 2 311.429 4.314 20 0 DIADLO C[C@@H](CCCC(F)(F)F)[NH2+]c1ccc(N2CCOCC2)cc1 ZINC000317675521 1042240386 /nfs/dbraw/zinc/24/03/86/1042240386.db2.gz CFCXIQSKCJYVPP-ZDUSSCGKSA-N 1 2 316.367 4.056 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2ccccc2OC(F)(F)F)n1 ZINC000080274337 1042243046 /nfs/dbraw/zinc/24/30/46/1042243046.db2.gz XUTUXPKGGAROGN-JTQLQIEISA-N 1 2 316.348 4.201 20 0 DIADLO Cc1ccccc1[C@H](C)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001136459224 1042255149 /nfs/dbraw/zinc/25/51/49/1042255149.db2.gz MCAUSKWYRYROCX-AWEZNQCLSA-N 1 2 305.381 4.127 20 0 DIADLO CCOc1ccccc1C[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000279045009 1042263468 /nfs/dbraw/zinc/26/34/68/1042263468.db2.gz CXDYWSONNSXTCE-UHFFFAOYSA-N 1 2 304.459 4.129 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc(C)c(C)c3)CCCCCC2)no1 ZINC000585817231 1042265629 /nfs/dbraw/zinc/26/56/29/1042265629.db2.gz DUHJCNXWORWIQT-UHFFFAOYSA-N 1 2 313.445 4.334 20 0 DIADLO Cc1cccc([C@@H]2CCCN2c2cc(C(F)(F)F)cc(C)[nH+]2)n1 ZINC000663722378 1042299810 /nfs/dbraw/zinc/29/98/10/1042299810.db2.gz PGNYVEXCDIPETA-HNNXBMFYSA-N 1 2 321.346 4.454 20 0 DIADLO C[N@H+](Cc1cscn1)Cc1cccc(NCC2(C)CCC2)c1 ZINC000434778063 1042306504 /nfs/dbraw/zinc/30/65/04/1042306504.db2.gz ROBPAUBVKLXYHK-UHFFFAOYSA-N 1 2 315.486 4.377 20 0 DIADLO C[N@@H+](Cc1cscn1)Cc1cccc(NCC2(C)CCC2)c1 ZINC000434778063 1042306511 /nfs/dbraw/zinc/30/65/11/1042306511.db2.gz ROBPAUBVKLXYHK-UHFFFAOYSA-N 1 2 315.486 4.377 20 0 DIADLO Clc1cccc(Cl)c1C[N@H+](C[C@H]1CCCO1)C1CC1 ZINC000621285490 1042308899 /nfs/dbraw/zinc/30/88/99/1042308899.db2.gz UZMJKMUTBLXMFA-GFCCVEGCSA-N 1 2 300.229 4.137 20 0 DIADLO Clc1cccc(Cl)c1C[N@@H+](C[C@H]1CCCO1)C1CC1 ZINC000621285490 1042308903 /nfs/dbraw/zinc/30/89/03/1042308903.db2.gz UZMJKMUTBLXMFA-GFCCVEGCSA-N 1 2 300.229 4.137 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)c(C)n1 ZINC000163190032 1042309919 /nfs/dbraw/zinc/30/99/19/1042309919.db2.gz WMZYNLVTLYODPC-KUHUBIRLSA-N 1 2 307.397 4.127 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(F)(F)F)cs1)c1cncs1 ZINC000279492090 1042318521 /nfs/dbraw/zinc/31/85/21/1042318521.db2.gz LTXVTWFBOBXWDS-RQJHMYQMSA-N 1 2 307.366 4.030 20 0 DIADLO CC[C@@H]([NH2+]Cc1sccc1Br)c1nccs1 ZINC000070732899 1042318963 /nfs/dbraw/zinc/31/89/63/1042318963.db2.gz YDFKTZYFPPVRTI-SECBINFHSA-N 1 2 317.277 4.208 20 0 DIADLO Fc1c(C[N@@H+]2CCCCC[C@@H]2c2ccncc2)ccnc1Cl ZINC000823375328 1042322885 /nfs/dbraw/zinc/32/28/85/1042322885.db2.gz LSCASNGDIYQFAS-OAHLLOKOSA-N 1 2 319.811 4.386 20 0 DIADLO Fc1c(C[N@H+]2CCCCC[C@@H]2c2ccncc2)ccnc1Cl ZINC000823375328 1042322891 /nfs/dbraw/zinc/32/28/91/1042322891.db2.gz LSCASNGDIYQFAS-OAHLLOKOSA-N 1 2 319.811 4.386 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1ccnc(Cl)c1F ZINC000823395010 1042323747 /nfs/dbraw/zinc/32/37/47/1042323747.db2.gz IKIAXTZPRMRMJC-VIFPVBQESA-N 1 2 314.738 4.345 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccnc(Cl)c1F ZINC000823395010 1042323756 /nfs/dbraw/zinc/32/37/56/1042323756.db2.gz IKIAXTZPRMRMJC-VIFPVBQESA-N 1 2 314.738 4.345 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](CC(F)(F)F)c2ccccc2)nn1C ZINC000337532097 1042324445 /nfs/dbraw/zinc/32/44/45/1042324445.db2.gz VVRXOPKGZZVDKW-SWLSCSKDSA-N 1 2 311.351 4.073 20 0 DIADLO CC[N@H+](Cc1ccnc(Cl)c1F)[C@@H](C)c1cccc(O)c1 ZINC000823409270 1042325489 /nfs/dbraw/zinc/32/54/89/1042325489.db2.gz WOIWUGISFDUUSX-NSHDSACASA-N 1 2 308.784 4.163 20 0 DIADLO CC[N@@H+](Cc1ccnc(Cl)c1F)[C@@H](C)c1cccc(O)c1 ZINC000823409270 1042325495 /nfs/dbraw/zinc/32/54/95/1042325495.db2.gz WOIWUGISFDUUSX-NSHDSACASA-N 1 2 308.784 4.163 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2cc(F)ncc2F)C1 ZINC000823459173 1042326825 /nfs/dbraw/zinc/32/68/25/1042326825.db2.gz RCTIHAIUJFEMNR-BZNIZROVSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2cc(F)ncc2F)C1 ZINC000823459173 1042326833 /nfs/dbraw/zinc/32/68/33/1042326833.db2.gz RCTIHAIUJFEMNR-BZNIZROVSA-N 1 2 306.331 4.082 20 0 DIADLO Cc1[nH+]cc(CNc2cnc(Cl)cc2C)n1-c1ccccc1 ZINC000319051239 1042330813 /nfs/dbraw/zinc/33/08/13/1042330813.db2.gz MVIVGVCTCAUQNP-UHFFFAOYSA-N 1 2 312.804 4.150 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)o1 ZINC000112543390 1042340829 /nfs/dbraw/zinc/34/08/29/1042340829.db2.gz MQKYMJOSHQYGRD-RYUDHWBXSA-N 1 2 305.447 4.290 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1csc(C)n1)c1ccc(Cl)cc1 ZINC000279823519 1042344948 /nfs/dbraw/zinc/34/49/48/1042344948.db2.gz YJPBCXBCCAYXTJ-HZMBPMFUSA-N 1 2 310.850 4.143 20 0 DIADLO CCc1c(C)sc(Nc2cc(C3CC3)c[nH+]c2C)c1C(N)=O ZINC001213492142 1042366891 /nfs/dbraw/zinc/36/68/91/1042366891.db2.gz XAKCOGLCFHLEQM-UHFFFAOYSA-N 1 2 315.442 4.042 20 0 DIADLO Cc1nccc(Br)c1Nc1cc(C2CC2)c[nH+]c1C ZINC001213495253 1042367896 /nfs/dbraw/zinc/36/78/96/1042367896.db2.gz YJTCXVBXLOONBL-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cscc2Br)cc1 ZINC000709872683 1042383181 /nfs/dbraw/zinc/38/31/81/1042383181.db2.gz WNRFCPNQIGRZHG-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO Fc1ccc(Br)cc1C[NH2+]Cc1ccc(Cl)o1 ZINC000041063343 1042392797 /nfs/dbraw/zinc/39/27/97/1042392797.db2.gz OUWWTDMZWWOURV-UHFFFAOYSA-N 1 2 318.573 4.124 20 0 DIADLO CC[N@H+](Cc1csc(C2CCCCC2)n1)C[C@@H]1CCCO1 ZINC000051555027 1042377585 /nfs/dbraw/zinc/37/75/85/1042377585.db2.gz ZJMAXTLERQNGIF-INIZCTEOSA-N 1 2 308.491 4.192 20 0 DIADLO CC[N@@H+](Cc1csc(C2CCCCC2)n1)C[C@@H]1CCCO1 ZINC000051555027 1042377580 /nfs/dbraw/zinc/37/75/80/1042377580.db2.gz ZJMAXTLERQNGIF-INIZCTEOSA-N 1 2 308.491 4.192 20 0 DIADLO Fc1cc(C[NH2+]Cc2cc(-c3ccccc3)on2)ccc1Cl ZINC000237853762 1042381095 /nfs/dbraw/zinc/38/10/95/1042381095.db2.gz PHTGZENTSPOVHX-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cscc2Br)cc1 ZINC000709872683 1042383175 /nfs/dbraw/zinc/38/31/75/1042383175.db2.gz WNRFCPNQIGRZHG-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO COc1ccc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)o1 ZINC000894061016 1042405714 /nfs/dbraw/zinc/40/57/14/1042405714.db2.gz ZTBTXGZYOBBFNU-UHFFFAOYSA-N 1 2 323.396 4.100 20 0 DIADLO C[C@@H]1C[N@@H+]([C@H]2C[C@H]2c2cccc(F)c2)C[C@H](c2ccsc2)O1 ZINC000411313756 1042438959 /nfs/dbraw/zinc/43/89/59/1042438959.db2.gz CEJNFKJLURKOFY-PBZHRCKQSA-N 1 2 317.429 4.205 20 0 DIADLO C[C@@H]1C[N@H+]([C@H]2C[C@H]2c2cccc(F)c2)C[C@H](c2ccsc2)O1 ZINC000411313756 1042438963 /nfs/dbraw/zinc/43/89/63/1042438963.db2.gz CEJNFKJLURKOFY-PBZHRCKQSA-N 1 2 317.429 4.205 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccccc2Oc2ccccc2)[nH]1 ZINC000411447067 1042447014 /nfs/dbraw/zinc/44/70/14/1042447014.db2.gz BJRXQSFERLJLQQ-KGLIPLIRSA-N 1 2 322.412 4.317 20 0 DIADLO Cc1cc(Cl)cc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000645159786 1042448542 /nfs/dbraw/zinc/44/85/42/1042448542.db2.gz OFAXSMWTZBORMI-NSHDSACASA-N 1 2 307.825 4.180 20 0 DIADLO CCOc1cc(F)c(F)cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001211801000 1042453929 /nfs/dbraw/zinc/45/39/29/1042453929.db2.gz OOCWHBAQDLLECS-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO CCOc1cc(F)c(F)cc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001211798703 1042454343 /nfs/dbraw/zinc/45/43/43/1042454343.db2.gz CFFJWUHDTIHYQW-UHFFFAOYSA-N 1 2 323.730 4.408 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc(Cl)c2cccnc12 ZINC000051960242 1042457282 /nfs/dbraw/zinc/45/72/82/1042457282.db2.gz JRBPAUXIEWUPIH-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccc(Cl)c2cccnc12 ZINC000051960242 1042457286 /nfs/dbraw/zinc/45/72/86/1042457286.db2.gz JRBPAUXIEWUPIH-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cn2cc(Cl)ccc2n1 ZINC000052073710 1042466274 /nfs/dbraw/zinc/46/62/74/1042466274.db2.gz SOBKESLSYOJURQ-LBPRGKRZSA-N 1 2 317.795 4.320 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cn2cc(Cl)ccc2n1 ZINC000052073710 1042466277 /nfs/dbraw/zinc/46/62/77/1042466277.db2.gz SOBKESLSYOJURQ-LBPRGKRZSA-N 1 2 317.795 4.320 20 0 DIADLO CCC(C)(C)NC(=O)C[N@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000614329945 1042466833 /nfs/dbraw/zinc/46/68/33/1042466833.db2.gz VITMKDANKJGVFF-ZDUSSCGKSA-N 1 2 322.880 4.170 20 0 DIADLO CCC(C)(C)NC(=O)C[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000614329945 1042466836 /nfs/dbraw/zinc/46/68/36/1042466836.db2.gz VITMKDANKJGVFF-ZDUSSCGKSA-N 1 2 322.880 4.170 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@@H](Oc3ccccc3)C2)o1 ZINC000419324886 1042470496 /nfs/dbraw/zinc/47/04/96/1042470496.db2.gz JSUCNIKRPYFLLW-MRXNPFEDSA-N 1 2 314.429 4.016 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@@H](Oc3ccccc3)C2)o1 ZINC000419324886 1042470513 /nfs/dbraw/zinc/47/05/13/1042470513.db2.gz JSUCNIKRPYFLLW-MRXNPFEDSA-N 1 2 314.429 4.016 20 0 DIADLO Fc1cccc(C[N@H+](Cc2nnc(-c3ccccc3)o2)C2CC2)c1 ZINC000052161669 1042476915 /nfs/dbraw/zinc/47/69/15/1042476915.db2.gz COUTZMQGLRUKHR-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2nnc(-c3ccccc3)o2)C2CC2)c1 ZINC000052161669 1042476917 /nfs/dbraw/zinc/47/69/17/1042476917.db2.gz COUTZMQGLRUKHR-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H]1CCCc2scnc21 ZINC000623866871 1042480789 /nfs/dbraw/zinc/48/07/89/1042480789.db2.gz IPWLFDAGSZVAOB-ZWNOBZJWSA-N 1 2 306.406 4.019 20 0 DIADLO O=C(Nc1cccc(CNc2cccc[nH+]2)c1)c1ccc(F)cc1 ZINC000052489155 1042481641 /nfs/dbraw/zinc/48/16/41/1042481641.db2.gz UZNBFYANBSURRF-UHFFFAOYSA-N 1 2 321.355 4.085 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@H](C)c1cc(O)cc(F)c1)c1ccco1 ZINC000924889001 1042487291 /nfs/dbraw/zinc/48/72/91/1042487291.db2.gz JGPBAMWVOCVSTQ-DYVFJYSZSA-N 1 2 321.392 4.189 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(-c3ccco3)on2)c1 ZINC000052455103 1042490423 /nfs/dbraw/zinc/49/04/23/1042490423.db2.gz PTJKKFATDYMCSY-INIZCTEOSA-N 1 2 312.344 4.411 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2cc(-c3ccco3)on2)c1 ZINC000052455103 1042490427 /nfs/dbraw/zinc/49/04/27/1042490427.db2.gz PTJKKFATDYMCSY-INIZCTEOSA-N 1 2 312.344 4.411 20 0 DIADLO COc1ccccc1C[N@@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001203434301 1042503896 /nfs/dbraw/zinc/50/38/96/1042503896.db2.gz HSWGCFLACCTCTJ-UHFFFAOYSA-N 1 2 321.342 4.272 20 0 DIADLO COc1ccccc1C[N@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001203434301 1042503900 /nfs/dbraw/zinc/50/39/00/1042503900.db2.gz HSWGCFLACCTCTJ-UHFFFAOYSA-N 1 2 321.342 4.272 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+][C@H](C)c1cn(C(C)C)nn1 ZINC000924894884 1042508613 /nfs/dbraw/zinc/50/86/13/1042508613.db2.gz BIAWECYQIZQYOW-ZBFHGGJFSA-N 1 2 316.449 4.060 20 0 DIADLO CCC(CC)CO[C@H]1CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC001204940339 1042512110 /nfs/dbraw/zinc/51/21/10/1042512110.db2.gz ZSSVSMAXZCFFIU-ZDUSSCGKSA-N 1 2 316.898 4.214 20 0 DIADLO CCC(CC)CO[C@H]1CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC001204940339 1042512113 /nfs/dbraw/zinc/51/21/13/1042512113.db2.gz ZSSVSMAXZCFFIU-ZDUSSCGKSA-N 1 2 316.898 4.214 20 0 DIADLO C[N@@H+](Cc1cnn(-c2ccccc2)c1)Cc1ccc(Cl)s1 ZINC000052916798 1042524022 /nfs/dbraw/zinc/52/40/22/1042524022.db2.gz ZFDLJIYVKLPLAA-UHFFFAOYSA-N 1 2 317.845 4.219 20 0 DIADLO C[N@H+](Cc1cnn(-c2ccccc2)c1)Cc1ccc(Cl)s1 ZINC000052916798 1042524027 /nfs/dbraw/zinc/52/40/27/1042524027.db2.gz ZFDLJIYVKLPLAA-UHFFFAOYSA-N 1 2 317.845 4.219 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3cc[nH]n3)CC2)cc1Cl ZINC000513375656 1042537409 /nfs/dbraw/zinc/53/74/09/1042537409.db2.gz DSZFXDVZBYXSIC-UHFFFAOYSA-N 1 2 308.212 4.006 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3cc[nH]n3)CC2)cc1Cl ZINC000513375656 1042537413 /nfs/dbraw/zinc/53/74/13/1042537413.db2.gz DSZFXDVZBYXSIC-UHFFFAOYSA-N 1 2 308.212 4.006 20 0 DIADLO Cc1ccc(C)c(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)c1 ZINC000513400353 1042538617 /nfs/dbraw/zinc/53/86/17/1042538617.db2.gz CDURETJMZUMTEF-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO Cc1ccc(C)c(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)c1 ZINC000513400353 1042538619 /nfs/dbraw/zinc/53/86/19/1042538619.db2.gz CDURETJMZUMTEF-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO CCn1cc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)cn1 ZINC000513473489 1042546042 /nfs/dbraw/zinc/54/60/42/1042546042.db2.gz YNJWDTUKSDEXKW-UHFFFAOYSA-N 1 2 319.399 4.126 20 0 DIADLO CCn1cc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)cn1 ZINC000513473489 1042546046 /nfs/dbraw/zinc/54/60/46/1042546046.db2.gz YNJWDTUKSDEXKW-UHFFFAOYSA-N 1 2 319.399 4.126 20 0 DIADLO Cc1nc(C(C)C)oc1CNc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC000647843555 1042547705 /nfs/dbraw/zinc/54/77/05/1042547705.db2.gz WTUNQTYWOBOPLJ-UHFFFAOYSA-N 1 2 316.449 4.177 20 0 DIADLO Cc1cccn2cc(C[NH2+]Cc3cc(Cl)ccc3Cl)nc12 ZINC000513499730 1042548910 /nfs/dbraw/zinc/54/89/10/1042548910.db2.gz IITHFURFZCDHHK-UHFFFAOYSA-N 1 2 320.223 4.239 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+]C(C)(C)c1nc(C)cs1 ZINC000280242301 1042567923 /nfs/dbraw/zinc/56/79/23/1042567923.db2.gz NNQGUOYJGNYWKQ-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO CC[C@](C)([NH2+]Cc1ccc(Cl)cc1OC)c1nccs1 ZINC000280321043 1042570315 /nfs/dbraw/zinc/57/03/15/1042570315.db2.gz YGPYXRUBXSQUTB-HNNXBMFYSA-N 1 2 310.850 4.220 20 0 DIADLO Cc1cc(C)c(CNC(=O)N(C)[C@@H]2CCC[C@H]2C(C)(C)C)c[nH+]1 ZINC000419510824 1042585669 /nfs/dbraw/zinc/58/56/69/1042585669.db2.gz WKFIZHGMYKCYED-IAGOWNOFSA-N 1 2 317.477 4.055 20 0 DIADLO Cc1cc(C[NH2+]Cc2noc3c2CCCC3)ccc1C(F)(F)F ZINC000414445590 1042596553 /nfs/dbraw/zinc/59/65/53/1042596553.db2.gz SNWCIYLQMLBIRQ-UHFFFAOYSA-N 1 2 324.346 4.170 20 0 DIADLO Cc1cc(CNC(=O)N[C@@H](c2ccccc2)C2CCC2)cc(C)[nH+]1 ZINC000420788589 1042613192 /nfs/dbraw/zinc/61/31/92/1042613192.db2.gz GIKNCWQVIYGKEB-IBGZPJMESA-N 1 2 323.440 4.039 20 0 DIADLO FC(F)(F)C[C@H]1CCC[N@H+](Cc2ccn(C3CCCC3)n2)C1 ZINC000420947013 1042616700 /nfs/dbraw/zinc/61/67/00/1042616700.db2.gz MJSLIFSKBFBFBY-CYBMUJFWSA-N 1 2 315.383 4.163 20 0 DIADLO FC(F)(F)C[C@H]1CCC[N@@H+](Cc2ccn(C3CCCC3)n2)C1 ZINC000420947013 1042616702 /nfs/dbraw/zinc/61/67/02/1042616702.db2.gz MJSLIFSKBFBFBY-CYBMUJFWSA-N 1 2 315.383 4.163 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)no1 ZINC000420947922 1042617047 /nfs/dbraw/zinc/61/70/47/1042617047.db2.gz NKDLOBBXVVZNLZ-NSHDSACASA-N 1 2 304.356 4.137 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)no1 ZINC000420947922 1042617051 /nfs/dbraw/zinc/61/70/51/1042617051.db2.gz NKDLOBBXVVZNLZ-NSHDSACASA-N 1 2 304.356 4.137 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)o1 ZINC000420955643 1042618040 /nfs/dbraw/zinc/61/80/40/1042618040.db2.gz WSQMLZXTVNHFPL-NSHDSACASA-N 1 2 304.356 4.137 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)o1 ZINC000420955643 1042618042 /nfs/dbraw/zinc/61/80/42/1042618042.db2.gz WSQMLZXTVNHFPL-NSHDSACASA-N 1 2 304.356 4.137 20 0 DIADLO CCO[C@@H](C)c1noc(C[N@H+](C(C)C)[C@@H](C)c2ccsc2)n1 ZINC000421004884 1042621004 /nfs/dbraw/zinc/62/10/04/1042621004.db2.gz ITJNAJYDWCNFNB-STQMWFEESA-N 1 2 323.462 4.200 20 0 DIADLO CCO[C@@H](C)c1noc(C[N@@H+](C(C)C)[C@@H](C)c2ccsc2)n1 ZINC000421004884 1042621006 /nfs/dbraw/zinc/62/10/06/1042621006.db2.gz ITJNAJYDWCNFNB-STQMWFEESA-N 1 2 323.462 4.200 20 0 DIADLO CC(C)[N@H+](Cc1nnc(C2CCC2)n1C)[C@@H](C)c1ccsc1 ZINC000421020594 1042622428 /nfs/dbraw/zinc/62/24/28/1042622428.db2.gz ZQNIVYPLVWVOEJ-ZDUSSCGKSA-N 1 2 318.490 4.116 20 0 DIADLO CC(C)[N@@H+](Cc1nnc(C2CCC2)n1C)[C@@H](C)c1ccsc1 ZINC000421020594 1042622431 /nfs/dbraw/zinc/62/24/31/1042622431.db2.gz ZQNIVYPLVWVOEJ-ZDUSSCGKSA-N 1 2 318.490 4.116 20 0 DIADLO CCCCc1noc(C[N@H+](C(C)C)[C@@H](C)c2ccsc2)n1 ZINC000421019399 1042622826 /nfs/dbraw/zinc/62/28/26/1042622826.db2.gz XXYNVAQBWZEQED-ZDUSSCGKSA-N 1 2 307.463 4.445 20 0 DIADLO CCCCc1noc(C[N@@H+](C(C)C)[C@@H](C)c2ccsc2)n1 ZINC000421019399 1042622830 /nfs/dbraw/zinc/62/28/30/1042622830.db2.gz XXYNVAQBWZEQED-ZDUSSCGKSA-N 1 2 307.463 4.445 20 0 DIADLO CC(C)[N@H+](Cc1nnc(C2CCC2)n1C)[C@H](C)c1ccsc1 ZINC000421020593 1042622877 /nfs/dbraw/zinc/62/28/77/1042622877.db2.gz ZQNIVYPLVWVOEJ-CYBMUJFWSA-N 1 2 318.490 4.116 20 0 DIADLO CC(C)[N@@H+](Cc1nnc(C2CCC2)n1C)[C@H](C)c1ccsc1 ZINC000421020593 1042622878 /nfs/dbraw/zinc/62/28/78/1042622878.db2.gz ZQNIVYPLVWVOEJ-CYBMUJFWSA-N 1 2 318.490 4.116 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H](c2ccc(F)cc2)C2CCC2)nn1C ZINC000421330599 1042630821 /nfs/dbraw/zinc/63/08/21/1042630821.db2.gz YEQNIMNNURGRBN-KRWDZBQOSA-N 1 2 321.827 4.152 20 0 DIADLO CC(C)(C)OC(=O)c1ccsc1Nc1ccn2cc[nH+]c2c1 ZINC001204959480 1042640024 /nfs/dbraw/zinc/64/00/24/1042640024.db2.gz OFSZNBFDABFWSS-UHFFFAOYSA-N 1 2 315.398 4.095 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](CC(C)(C)C)c2ccccc2)n1 ZINC000271749417 1042667423 /nfs/dbraw/zinc/66/74/23/1042667423.db2.gz KIXHJRZWQOWYOB-HNNXBMFYSA-N 1 2 301.434 4.460 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](CC(C)(C)C)c2ccccc2)o1 ZINC000271779723 1042668084 /nfs/dbraw/zinc/66/80/84/1042668084.db2.gz OWFPXPNAPFKHDZ-OAHLLOKOSA-N 1 2 301.434 4.460 20 0 DIADLO CCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nnc(C)s1 ZINC000271767908 1042668243 /nfs/dbraw/zinc/66/82/43/1042668243.db2.gz HUQMOCBHATWXDC-HNNXBMFYSA-N 1 2 319.474 4.122 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1cccc(OC(F)F)c1 ZINC000271834359 1042669395 /nfs/dbraw/zinc/66/93/95/1042669395.db2.gz XJKQHZFWAQGMGV-LLVKDONJSA-N 1 2 324.371 4.424 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@H](C)c2cccc(F)c2F)n1 ZINC000271820077 1042669477 /nfs/dbraw/zinc/66/94/77/1042669477.db2.gz UATSEDLFFQDHBB-GFCCVEGCSA-N 1 2 307.388 4.373 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1nncn1C)c1cc2c(ccc3ccccc23)o1 ZINC000271863414 1042671027 /nfs/dbraw/zinc/67/10/27/1042671027.db2.gz KUXBKWKEAOPMAN-STQMWFEESA-N 1 2 320.396 4.126 20 0 DIADLO Cc1csc(C2([NH2+][C@@H](C)c3cccc(F)c3F)CCC2)n1 ZINC000271921309 1042672393 /nfs/dbraw/zinc/67/23/93/1042672393.db2.gz BHICZLAHCXQPNZ-NSHDSACASA-N 1 2 308.397 4.460 20 0 DIADLO CSc1cccc(NC2CCN(c3cccc[nH+]3)CC2)c1C ZINC000271995237 1042674587 /nfs/dbraw/zinc/67/45/87/1042674587.db2.gz JKMGXJRQIWTFON-UHFFFAOYSA-N 1 2 313.470 4.193 20 0 DIADLO Cc1cc([C@H]([NH2+][C@H](C)c2nc(C3CC3)no2)C2CC2)ccc1F ZINC000272055856 1042676344 /nfs/dbraw/zinc/67/63/44/1042676344.db2.gz HBAIKCDZWVZBGR-BDJLRTHQSA-N 1 2 315.392 4.196 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2ccc(C(C)C)cc2)c2cccnc2)on1 ZINC000924959252 1042693820 /nfs/dbraw/zinc/69/38/20/1042693820.db2.gz JGLMFYKEQXITDQ-FQEVSTJZSA-N 1 2 321.424 4.381 20 0 DIADLO c1ccc([C@H](C[C@H]2CCOC2)Nc2ccc3c(c2)CC[NH2+]3)cc1 ZINC000423215538 1042701262 /nfs/dbraw/zinc/70/12/62/1042701262.db2.gz MYABNKPRYXVJRY-QRWLVFNGSA-N 1 2 308.425 4.234 20 0 DIADLO COC[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1cccc(Cl)c1 ZINC000423219514 1042701309 /nfs/dbraw/zinc/70/13/09/1042701309.db2.gz UAOVXOXQFKOSOT-KRWDZBQOSA-N 1 2 302.805 4.108 20 0 DIADLO Fc1cc2c(c(F)c1F)[C@H](Nc1ccc3c(c1)CC[NH2+]3)CC2 ZINC000423217864 1042701540 /nfs/dbraw/zinc/70/15/40/1042701540.db2.gz QTEAVMLVKFEYOT-CQSZACIVSA-N 1 2 304.315 4.171 20 0 DIADLO CCCCn1ncc(NCc2c[nH+]cn2C(C)C)c1C(C)C ZINC000424192816 1042728945 /nfs/dbraw/zinc/72/89/45/1042728945.db2.gz PULWQHWMMTVJRV-UHFFFAOYSA-N 1 2 303.454 4.196 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1ccc(OC)cc1Cl)c1ccc(C)o1 ZINC000424289173 1042731736 /nfs/dbraw/zinc/73/17/36/1042731736.db2.gz AFKRGAKDBVYIOV-MLGOLLRUSA-N 1 2 323.820 4.288 20 0 DIADLO CC(C)(CCC(=O)Nc1cccc2[nH+]ccn21)c1ccccc1 ZINC000513941477 1042763610 /nfs/dbraw/zinc/76/36/10/1042763610.db2.gz CJFKZAGLLKFYOJ-UHFFFAOYSA-N 1 2 307.397 4.031 20 0 DIADLO C[N@H+](CCC(F)(F)F)Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000514002479 1042766277 /nfs/dbraw/zinc/76/62/77/1042766277.db2.gz XNBCXFMWTNMHRA-UHFFFAOYSA-N 1 2 318.726 4.379 20 0 DIADLO C[N@@H+](CCC(F)(F)F)Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000514002479 1042766284 /nfs/dbraw/zinc/76/62/84/1042766284.db2.gz XNBCXFMWTNMHRA-UHFFFAOYSA-N 1 2 318.726 4.379 20 0 DIADLO CC(C)[C@@H]1[N@H+](Cc2cnc(C(F)(F)F)s2)CC12CCC2 ZINC000430087378 1042778863 /nfs/dbraw/zinc/77/88/63/1042778863.db2.gz HBKLKHNOZNZJMT-NSHDSACASA-N 1 2 304.381 4.172 20 0 DIADLO CC(C)[C@@H]1[N@@H+](Cc2cnc(C(F)(F)F)s2)CC12CCC2 ZINC000430087378 1042778866 /nfs/dbraw/zinc/77/88/66/1042778866.db2.gz HBKLKHNOZNZJMT-NSHDSACASA-N 1 2 304.381 4.172 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H](C)c1cccs1 ZINC000366594752 1042779450 /nfs/dbraw/zinc/77/94/50/1042779450.db2.gz ZSGIRQVDLROIDB-LBPRGKRZSA-N 1 2 311.410 4.189 20 0 DIADLO CC(C)(C)c1coc(C[NH+]2CCC(CC(F)(F)F)CC2)n1 ZINC000894305729 1042789661 /nfs/dbraw/zinc/78/96/61/1042789661.db2.gz HVHHSFJWKJZEIF-UHFFFAOYSA-N 1 2 304.356 4.137 20 0 DIADLO CN(C)C[C@H]([NH2+]Cc1cccc(Cl)c1F)c1ccc(F)cc1 ZINC000514814920 1042792862 /nfs/dbraw/zinc/79/28/62/1042792862.db2.gz ZUXNFVYFKJGFLB-INIZCTEOSA-N 1 2 324.802 4.011 20 0 DIADLO C[N@H+](Cc1noc(-c2ccccc2)n1)[C@@H]1CCCc2ccccc21 ZINC000514849605 1042793940 /nfs/dbraw/zinc/79/39/40/1042793940.db2.gz IIASPPVZOWIMQD-GOSISDBHSA-N 1 2 319.408 4.246 20 0 DIADLO C[N@@H+](Cc1noc(-c2ccccc2)n1)[C@@H]1CCCc2ccccc21 ZINC000514849605 1042793944 /nfs/dbraw/zinc/79/39/44/1042793944.db2.gz IIASPPVZOWIMQD-GOSISDBHSA-N 1 2 319.408 4.246 20 0 DIADLO CC(C)n1cncc1C[N@H+]1CC=C(c2c(F)cccc2F)CC1 ZINC000425338415 1042794537 /nfs/dbraw/zinc/79/45/37/1042794537.db2.gz PHUNKRDQIWWSFN-UHFFFAOYSA-N 1 2 317.383 4.032 20 0 DIADLO CC(C)n1cncc1C[N@@H+]1CC=C(c2c(F)cccc2F)CC1 ZINC000425338415 1042794544 /nfs/dbraw/zinc/79/45/44/1042794544.db2.gz PHUNKRDQIWWSFN-UHFFFAOYSA-N 1 2 317.383 4.032 20 0 DIADLO CC(C)n1cncc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC000425341868 1042795530 /nfs/dbraw/zinc/79/55/30/1042795530.db2.gz FFLUWXNOHHBLSJ-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1cncc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC000425341868 1042795534 /nfs/dbraw/zinc/79/55/34/1042795534.db2.gz FFLUWXNOHHBLSJ-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)(C)[C@@H]([NH2+]Cc1nc(C(F)F)no1)c1ccc(F)cc1 ZINC000425427897 1042821463 /nfs/dbraw/zinc/82/14/63/1042821463.db2.gz TWKDQMHNOMVYMY-LBPRGKRZSA-N 1 2 313.323 4.023 20 0 DIADLO CC(C)c1cc(N2CCC3(CCCC3=O)CC2)nc(C(C)C)[nH+]1 ZINC000664516313 1042823252 /nfs/dbraw/zinc/82/32/52/1042823252.db2.gz PVBJMEDQMQCVOW-UHFFFAOYSA-N 1 2 315.461 4.063 20 0 DIADLO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1nc(C)sc1C ZINC000425515767 1042834128 /nfs/dbraw/zinc/83/41/28/1042834128.db2.gz TXCQSJRDZDGXPX-UHFFFAOYSA-N 1 2 324.877 4.447 20 0 DIADLO COc1c(F)cc(F)cc1C[N@@H+]1CCC[C@H]1c1ccc(C)nc1 ZINC001143563064 1042857072 /nfs/dbraw/zinc/85/70/72/1042857072.db2.gz LFDXAOKPIMJHIG-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1c(F)cc(F)cc1C[N@H+]1CCC[C@H]1c1ccc(C)nc1 ZINC001143563064 1042857078 /nfs/dbraw/zinc/85/70/78/1042857078.db2.gz LFDXAOKPIMJHIG-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(-c2ccc(F)cc2)[nH]1)c1cccc(C)c1 ZINC000516883120 1042858566 /nfs/dbraw/zinc/85/85/66/1042858566.db2.gz JRQMSOOPNCOZCB-QGZVFWFLSA-N 1 2 324.403 4.160 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(-c2ccc(F)cc2)n[nH]1)c1cccc(C)c1 ZINC000516883120 1042858569 /nfs/dbraw/zinc/85/85/69/1042858569.db2.gz JRQMSOOPNCOZCB-QGZVFWFLSA-N 1 2 324.403 4.160 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cc(F)cc(F)c1OC ZINC001143563304 1042864201 /nfs/dbraw/zinc/86/42/01/1042864201.db2.gz UTFRMEMBNORDDP-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1cc(F)cc(F)c1OC ZINC001143563304 1042864206 /nfs/dbraw/zinc/86/42/06/1042864206.db2.gz UTFRMEMBNORDDP-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO Clc1cccc2cc(C[NH+]3CCSCC3)c(Cl)nc12 ZINC001141544357 1042867001 /nfs/dbraw/zinc/86/70/01/1042867001.db2.gz WVHPVCJPXKIRFH-UHFFFAOYSA-N 1 2 313.253 4.090 20 0 DIADLO Cc1cccn2cc(Cc3noc([C@H]4CCCC5(CC5)C4)n3)[nH+]c12 ZINC000664777927 1042934565 /nfs/dbraw/zinc/93/45/65/1042934565.db2.gz TYPTUBCWJNVNFU-AWEZNQCLSA-N 1 2 322.412 4.054 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(-c3ccccc3)no2)[C@@H]1c1cccnc1 ZINC000664825436 1042965433 /nfs/dbraw/zinc/96/54/33/1042965433.db2.gz JGZDCAGSUXOOOZ-LJQANCHMSA-N 1 2 319.408 4.320 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(-c3ccccc3)no2)[C@@H]1c1cccnc1 ZINC000664825436 1042965436 /nfs/dbraw/zinc/96/54/36/1042965436.db2.gz JGZDCAGSUXOOOZ-LJQANCHMSA-N 1 2 319.408 4.320 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1c(C)nsc1C ZINC000647955803 1042969465 /nfs/dbraw/zinc/96/94/65/1042969465.db2.gz DVRWEMWPQOQCBJ-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1c(C)nsc1C ZINC000647955803 1042969467 /nfs/dbraw/zinc/96/94/67/1042969467.db2.gz DVRWEMWPQOQCBJ-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO CCOc1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccncc2)c(F)c1 ZINC001143575161 1042974374 /nfs/dbraw/zinc/97/43/74/1042974374.db2.gz PXGWYCVQFRCGNC-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(F)c(C[N@H+]2CCC[C@H]2c2ccncc2)c(F)c1 ZINC001143575161 1042974378 /nfs/dbraw/zinc/97/43/78/1042974378.db2.gz PXGWYCVQFRCGNC-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1c(F)c(F)c(F)c(F)c1F ZINC000729473988 1042984631 /nfs/dbraw/zinc/98/46/31/1042984631.db2.gz ARSMATBCXCRLNU-VIFPVBQESA-N 1 2 307.306 4.393 20 0 DIADLO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1c(F)c(F)c(F)c(F)c1F ZINC000729473988 1042984634 /nfs/dbraw/zinc/98/46/34/1042984634.db2.gz ARSMATBCXCRLNU-VIFPVBQESA-N 1 2 307.306 4.393 20 0 DIADLO Fc1cncc([C@@H]([NH2+]Cc2cc(-c3ccccc3)on2)C2CC2)c1 ZINC000519737549 1043000917 /nfs/dbraw/zinc/00/09/17/1043000917.db2.gz SPUNBAIBOVIOPA-IBGZPJMESA-N 1 2 323.371 4.117 20 0 DIADLO CCCC[N@@H+]1CCc2[nH]c3c(cccc3Br)c2C1 ZINC000729481373 1043008904 /nfs/dbraw/zinc/00/89/04/1043008904.db2.gz AOABBSSBTQVZMD-UHFFFAOYSA-N 1 2 307.235 4.089 20 0 DIADLO CCCC[N@H+]1CCc2[nH]c3c(cccc3Br)c2C1 ZINC000729481373 1043008909 /nfs/dbraw/zinc/00/89/09/1043008909.db2.gz AOABBSSBTQVZMD-UHFFFAOYSA-N 1 2 307.235 4.089 20 0 DIADLO CCC[N@H+](Cc1cc(C)no1)Cc1ccccc1Br ZINC000519906752 1043009863 /nfs/dbraw/zinc/00/98/63/1043009863.db2.gz SXCZHZKVOWDDBN-UHFFFAOYSA-N 1 2 323.234 4.158 20 0 DIADLO CCC[N@@H+](Cc1cc(C)no1)Cc1ccccc1Br ZINC000519906752 1043009868 /nfs/dbraw/zinc/00/98/68/1043009868.db2.gz SXCZHZKVOWDDBN-UHFFFAOYSA-N 1 2 323.234 4.158 20 0 DIADLO Cc1cc(C)c(NC(=O)COc2ccccc2C(C)C)c(C)[nH+]1 ZINC000519963812 1043011821 /nfs/dbraw/zinc/01/18/21/1043011821.db2.gz OQCCSLYQWUVOOL-UHFFFAOYSA-N 1 2 312.413 4.148 20 0 DIADLO Cc1ccc(S[C@H](C)C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000519963859 1043012072 /nfs/dbraw/zinc/01/20/72/1043012072.db2.gz WYCVAWHLFFRLGH-OAHLLOKOSA-N 1 2 314.454 4.435 20 0 DIADLO C[N@H+](Cc1nc(-c2ccccc2)c[nH]1)[C@H]1CCc2ccc(F)cc21 ZINC000441028020 1043017078 /nfs/dbraw/zinc/01/70/78/1043017078.db2.gz KXEUXPPEAWTVOP-IBGZPJMESA-N 1 2 321.399 4.335 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccccc2)c[nH]1)[C@H]1CCc2ccc(F)cc21 ZINC000441028020 1043017081 /nfs/dbraw/zinc/01/70/81/1043017081.db2.gz KXEUXPPEAWTVOP-IBGZPJMESA-N 1 2 321.399 4.335 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ccccc2C)no1 ZINC000520172382 1043021390 /nfs/dbraw/zinc/02/13/90/1043021390.db2.gz DYTXVKGWPFBFAL-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2ccccc2C)no1 ZINC000520172382 1043021395 /nfs/dbraw/zinc/02/13/95/1043021395.db2.gz DYTXVKGWPFBFAL-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Cc1ccc2nc(C[N@H+](Cc3ccccc3F)C(C)C)cn2c1 ZINC000520173413 1043021810 /nfs/dbraw/zinc/02/18/10/1043021810.db2.gz JHBJCPBPGWUUOJ-UHFFFAOYSA-N 1 2 311.404 4.192 20 0 DIADLO Cc1ccc2nc(C[N@@H+](Cc3ccccc3F)C(C)C)cn2c1 ZINC000520173413 1043021813 /nfs/dbraw/zinc/02/18/13/1043021813.db2.gz JHBJCPBPGWUUOJ-UHFFFAOYSA-N 1 2 311.404 4.192 20 0 DIADLO CCC[N@H+](Cc1nc(CCC(C)C)no1)Cc1ccc(F)cc1 ZINC000520173322 1043022083 /nfs/dbraw/zinc/02/20/83/1043022083.db2.gz FCMXSQUJWNUXIA-UHFFFAOYSA-N 1 2 319.424 4.210 20 0 DIADLO CCC[N@@H+](Cc1nc(CCC(C)C)no1)Cc1ccc(F)cc1 ZINC000520173322 1043022089 /nfs/dbraw/zinc/02/20/89/1043022089.db2.gz FCMXSQUJWNUXIA-UHFFFAOYSA-N 1 2 319.424 4.210 20 0 DIADLO Fc1ccc(-n2ccc(C[N@H+](Cc3ccccc3)C3CC3)n2)cc1 ZINC000441246396 1043029843 /nfs/dbraw/zinc/02/98/43/1043029843.db2.gz OTRKDXJVWCCUAI-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO Fc1ccc(-n2ccc(C[N@@H+](Cc3ccccc3)C3CC3)n2)cc1 ZINC000441246396 1043029847 /nfs/dbraw/zinc/02/98/47/1043029847.db2.gz OTRKDXJVWCCUAI-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO CC(C)C[C@@H]1CCC[N@H+](Cc2ncc(Br)s2)C1 ZINC000520277716 1043031126 /nfs/dbraw/zinc/03/11/26/1043031126.db2.gz QXONRYYUUXTKGH-NSHDSACASA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)C[C@@H]1CCC[N@@H+](Cc2ncc(Br)s2)C1 ZINC000520277716 1043031128 /nfs/dbraw/zinc/03/11/28/1043031128.db2.gz QXONRYYUUXTKGH-NSHDSACASA-N 1 2 317.296 4.164 20 0 DIADLO CCCCc1noc(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccc(F)c2)n1 ZINC000441345084 1043039479 /nfs/dbraw/zinc/03/94/79/1043039479.db2.gz ZRKCLSBWRXRTFH-BBRMVZONSA-N 1 2 317.408 4.134 20 0 DIADLO CCCCc1noc(C[N@H+]2C[C@@H](C)C[C@H]2c2cccc(F)c2)n1 ZINC000441345084 1043039483 /nfs/dbraw/zinc/03/94/83/1043039483.db2.gz ZRKCLSBWRXRTFH-BBRMVZONSA-N 1 2 317.408 4.134 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(Cc3ccccc3)no2)cc1 ZINC000173971841 1043058100 /nfs/dbraw/zinc/05/81/00/1043058100.db2.gz QYTCPKQHBXYBSO-HOTGVXAUSA-N 1 2 321.424 4.381 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](Cc2ccco2)C2CCCC2)cs1 ZINC000175104724 1043075757 /nfs/dbraw/zinc/07/57/57/1043075757.db2.gz SYPSCPUIDAWESB-ZDUSSCGKSA-N 1 2 320.458 4.388 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](Cc2ccco2)C2CCCC2)cs1 ZINC000175104724 1043075764 /nfs/dbraw/zinc/07/57/64/1043075764.db2.gz SYPSCPUIDAWESB-ZDUSSCGKSA-N 1 2 320.458 4.388 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2cccnc2F)c2ccccc2)cc1 ZINC000794836521 1043083605 /nfs/dbraw/zinc/08/36/05/1043083605.db2.gz QMDMERHTDQTUHT-SFHVURJKSA-N 1 2 310.347 4.239 20 0 DIADLO FC(F)c1ccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000188472300 1043086631 /nfs/dbraw/zinc/08/66/31/1043086631.db2.gz IUGDEACIXRDOKD-MRXNPFEDSA-N 1 2 313.351 4.227 20 0 DIADLO CN(C)C(=O)Sc1cccc(Cn2c[nH+]c(C(C)(C)C)c2)c1 ZINC000865375901 1043087878 /nfs/dbraw/zinc/08/78/78/1043087878.db2.gz PVYNLSTYMDDLIM-UHFFFAOYSA-N 1 2 317.458 4.003 20 0 DIADLO Cc1oc(-c2cccs2)nc1Cn1c[nH+]c(C(C)(C)C)c1 ZINC000865376090 1043089001 /nfs/dbraw/zinc/08/90/01/1043089001.db2.gz YPIIMJWWIKNPLS-UHFFFAOYSA-N 1 2 301.415 4.254 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC000865374279 1043088827 /nfs/dbraw/zinc/08/88/27/1043088827.db2.gz APDJIFMUOOOMLU-UHFFFAOYSA-N 1 2 313.445 4.251 20 0 DIADLO CCOc1cc(F)cc(C[NH2+][C@H](C)c2csc(CC)n2)c1 ZINC000865459105 1043101709 /nfs/dbraw/zinc/10/17/09/1043101709.db2.gz XYIBQRLBSDTAJL-LLVKDONJSA-N 1 2 308.422 4.094 20 0 DIADLO CCc1noc(C)c1C[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC000330862308 1043101713 /nfs/dbraw/zinc/10/17/13/1043101713.db2.gz QFUATZDKJDVEEF-SNVBAGLBSA-N 1 2 307.463 4.150 20 0 DIADLO c1cc(C[NH2+]Cc2nnc(C3CC3)s2)cc(CC2CCC2)c1 ZINC000865604008 1043117075 /nfs/dbraw/zinc/11/70/75/1043117075.db2.gz QSESEYLOUHXXQP-UHFFFAOYSA-N 1 2 313.470 4.048 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccccc2)no1)[C@H](C)c1cccc(O)c1 ZINC000178375128 1043127357 /nfs/dbraw/zinc/12/73/57/1043127357.db2.gz INVCKUZPNYWEFY-CQSZACIVSA-N 1 2 323.396 4.025 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccccc2)no1)[C@H](C)c1cccc(O)c1 ZINC000178375128 1043127362 /nfs/dbraw/zinc/12/73/62/1043127362.db2.gz INVCKUZPNYWEFY-CQSZACIVSA-N 1 2 323.396 4.025 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2ccc3ccccc3n2)o1 ZINC000178801757 1043136353 /nfs/dbraw/zinc/13/63/53/1043136353.db2.gz OFSYAPVEZFOJMK-KUHUBIRLSA-N 1 2 324.424 4.429 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2ccc3ccccc3n2)o1 ZINC000178801737 1043137346 /nfs/dbraw/zinc/13/73/46/1043137346.db2.gz OFSYAPVEZFOJMK-LIRRHRJNSA-N 1 2 324.424 4.429 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2ccc(Cl)cc2F)o1 ZINC000189185910 1043143651 /nfs/dbraw/zinc/14/36/51/1043143651.db2.gz PPTYRZFDWJIROQ-HNNXBMFYSA-N 1 2 311.784 4.112 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(CCc2ccccc2)n1)c1ccncc1 ZINC000179389709 1043144966 /nfs/dbraw/zinc/14/49/66/1043144966.db2.gz LGDRQHRVEGKMCJ-OAHLLOKOSA-N 1 2 323.465 4.174 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(CCc2ccccc2)n1)c1ccccn1 ZINC000179475498 1043146776 /nfs/dbraw/zinc/14/67/76/1043146776.db2.gz YSFNFHLTMFMUSO-OAHLLOKOSA-N 1 2 323.465 4.174 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]C2(c3cccc(Cl)c3)CC2)cs1 ZINC000179671690 1043148672 /nfs/dbraw/zinc/14/86/72/1043148672.db2.gz VIAKBWZSEMMWRC-LLVKDONJSA-N 1 2 322.861 4.283 20 0 DIADLO Cc1ncsc1C[N@@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000179734536 1043150185 /nfs/dbraw/zinc/15/01/85/1043150185.db2.gz PUAASROGPJPDTH-NSHDSACASA-N 1 2 303.456 4.254 20 0 DIADLO Cc1ncsc1C[N@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000179734536 1043150190 /nfs/dbraw/zinc/15/01/90/1043150190.db2.gz PUAASROGPJPDTH-NSHDSACASA-N 1 2 303.456 4.254 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](CC(C)(C)C)c2ccc(Cl)cc2)o1 ZINC000179711119 1043150282 /nfs/dbraw/zinc/15/02/82/1043150282.db2.gz PMGLDQDSKPLJDR-AWEZNQCLSA-N 1 2 307.825 4.299 20 0 DIADLO Cc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nc(C(C)C)no1 ZINC000183241673 1043159515 /nfs/dbraw/zinc/15/95/15/1043159515.db2.gz HBPUREFKPPTWGQ-MRXNPFEDSA-N 1 2 301.434 4.378 20 0 DIADLO F[C@@H]1COc2ccccc2[C@@H]1[NH2+][C@@H]1CCSc2ccccc21 ZINC000866233239 1043163870 /nfs/dbraw/zinc/16/38/70/1043163870.db2.gz UBYWYXHXXHAFKB-RKVPGOIHSA-N 1 2 315.413 4.285 20 0 DIADLO C[C@H](Nc1[nH+]ccc2cc(C(F)(F)F)ccc21)c1ccnn1C ZINC000866252256 1043165916 /nfs/dbraw/zinc/16/59/16/1043165916.db2.gz HYGZXCLVEMNJQP-JTQLQIEISA-N 1 2 320.318 4.160 20 0 DIADLO O[C@H](c1ccccc1)C1(CNc2cc(C(F)(F)F)cc[nH+]2)CC1 ZINC000129891858 1043167772 /nfs/dbraw/zinc/16/77/72/1043167772.db2.gz XHQSBCCHRVBLHF-OAHLLOKOSA-N 1 2 322.330 4.026 20 0 DIADLO Cc1cccc([C@H](C)[NH2+]Cc2noc(-c3ccsc3)n2)c1C ZINC000183736876 1043170066 /nfs/dbraw/zinc/17/00/66/1043170066.db2.gz JFZIYACFVWUKQN-ZDUSSCGKSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1cncc([C@@H]2CCCN2c2[nH+]ccc3cc(F)ccc32)c1 ZINC000866275554 1043171464 /nfs/dbraw/zinc/17/14/64/1043171464.db2.gz CGWVFFBGKAJUTN-SFHVURJKSA-N 1 2 307.372 4.419 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@H](C)c2cc3ccccc3s2)n1 ZINC000184358614 1043183063 /nfs/dbraw/zinc/18/30/63/1043183063.db2.gz FBSCZMXCSBEULI-GHMZBOCLSA-N 1 2 301.415 4.259 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](C)c2cc3ccccc3s2)n1 ZINC000184365618 1043183104 /nfs/dbraw/zinc/18/31/04/1043183104.db2.gz CSUBCBOOKBTTFB-LBPRGKRZSA-N 1 2 315.442 4.478 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](C)c2cc3ccccc3s2)n1 ZINC000184351528 1043183661 /nfs/dbraw/zinc/18/36/61/1043183661.db2.gz DNVDTHOVWOYGRU-LLVKDONJSA-N 1 2 301.415 4.259 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cc(-c3ccc(C)cc3)no2)s1 ZINC000184983193 1043193307 /nfs/dbraw/zinc/19/33/07/1043193307.db2.gz IBYPHEMBCLNRHN-ZDUSSCGKSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1C(=O)OC(C)(C)C)c1ccco1 ZINC000866484485 1043208576 /nfs/dbraw/zinc/20/85/76/1043208576.db2.gz WWSWWWCYRRCSGU-CYBMUJFWSA-N 1 2 301.386 4.086 20 0 DIADLO C[C@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1ccc(F)c(F)c1 ZINC000186057815 1043213271 /nfs/dbraw/zinc/21/32/71/1043213271.db2.gz YJSGZRPVRSIBIA-NSHDSACASA-N 1 2 324.371 4.119 20 0 DIADLO COc1ccsc1[C@@H](C)[NH2+]Cc1csc(-c2ccco2)n1 ZINC000186197487 1043217179 /nfs/dbraw/zinc/21/71/79/1043217179.db2.gz KLTOLMRLQSVNFA-SNVBAGLBSA-N 1 2 320.439 4.324 20 0 DIADLO C[C@@H]([NH2+][C@@H](CCO)c1ccco1)c1cc(Cl)sc1Cl ZINC000186563089 1043230038 /nfs/dbraw/zinc/23/00/38/1043230038.db2.gz LDSYKIDITXJPJZ-SCZZXKLOSA-N 1 2 320.241 4.422 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2c(C)noc2C)s1 ZINC000053079127 1043239334 /nfs/dbraw/zinc/23/93/34/1043239334.db2.gz UZIJUAOMFBNCGJ-UHFFFAOYSA-N 1 2 316.426 4.457 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2c(C)noc2C)s1 ZINC000053079127 1043239347 /nfs/dbraw/zinc/23/93/47/1043239347.db2.gz UZIJUAOMFBNCGJ-UHFFFAOYSA-N 1 2 316.426 4.457 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(-c2ccc(F)cc2)oc1=S ZINC000867480489 1043251797 /nfs/dbraw/zinc/25/17/97/1043251797.db2.gz DFGCMSYGZKHUQO-UHFFFAOYSA-N 1 2 309.410 4.091 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(-c2ccc(F)cc2)oc1=S ZINC000867480489 1043251803 /nfs/dbraw/zinc/25/18/03/1043251803.db2.gz DFGCMSYGZKHUQO-UHFFFAOYSA-N 1 2 309.410 4.091 20 0 DIADLO Cc1cccc(C)c1OC[C@@H]([NH2+]Cc1cocn1)c1ccccc1 ZINC000192324541 1043268993 /nfs/dbraw/zinc/26/89/93/1043268993.db2.gz KUAYCYOCFGQYTC-LJQANCHMSA-N 1 2 322.408 4.201 20 0 DIADLO CCCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1cocn1 ZINC000192321596 1043269368 /nfs/dbraw/zinc/26/93/68/1043269368.db2.gz BSHVXRWJIVSJOS-QGZVFWFLSA-N 1 2 302.418 4.340 20 0 DIADLO c1csc(-c2nc(C[NH2+][C@H]3CCCc4occc43)co2)c1 ZINC000192738359 1043275435 /nfs/dbraw/zinc/27/54/35/1043275435.db2.gz VKEIOFBUOGJHSI-ZDUSSCGKSA-N 1 2 300.383 4.163 20 0 DIADLO Cc1nc(SCc2cc[nH+]c(N)c2)n(C2CCCCC2)c1C ZINC000193074520 1043279304 /nfs/dbraw/zinc/27/93/04/1043279304.db2.gz UQRFJVXXHKBGEE-UHFFFAOYSA-N 1 2 316.474 4.275 20 0 DIADLO c1cn(C2CC2)c(C[N@@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)n1 ZINC000895123586 1043282055 /nfs/dbraw/zinc/28/20/55/1043282055.db2.gz DAIDBJMQVUIXGR-IBGZPJMESA-N 1 2 305.425 4.111 20 0 DIADLO c1cn(C2CC2)c(C[N@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)n1 ZINC000895123586 1043282058 /nfs/dbraw/zinc/28/20/58/1043282058.db2.gz DAIDBJMQVUIXGR-IBGZPJMESA-N 1 2 305.425 4.111 20 0 DIADLO Clc1cc(Nc2ccn3cc[nH+]c3c2)ccc1Br ZINC001204977890 1043282719 /nfs/dbraw/zinc/28/27/19/1043282719.db2.gz MNCQAAPICNASDQ-UHFFFAOYSA-N 1 2 322.593 4.494 20 0 DIADLO COC[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(Cl)cc1 ZINC000193677344 1043285852 /nfs/dbraw/zinc/28/58/52/1043285852.db2.gz NJAMJXNXZSOQFL-CQSZACIVSA-N 1 2 322.861 4.151 20 0 DIADLO C[C@H](CC[NH2+]c1ccc(N2CCC(O)CC2)cc1)c1ccccc1 ZINC000194094862 1043287724 /nfs/dbraw/zinc/28/77/24/1043287724.db2.gz WLDACCSVRLIJCL-QGZVFWFLSA-N 1 2 324.468 4.253 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1cccnc1Cl ZINC000122433034 1043304305 /nfs/dbraw/zinc/30/43/05/1043304305.db2.gz LDRDICZHGOULLM-MNOVXSKESA-N 1 2 308.784 4.295 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H](C)c1cccnc1Cl ZINC000122433140 1043304375 /nfs/dbraw/zinc/30/43/75/1043304375.db2.gz LDRDICZHGOULLM-WDEREUQCSA-N 1 2 308.784 4.295 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C(C)(C)C)s1)c1ccc(F)cc1 ZINC000268207411 1043315558 /nfs/dbraw/zinc/31/55/58/1043315558.db2.gz PODOXGXGUOTWKD-CYBMUJFWSA-N 1 2 307.438 4.216 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](CC(C)C)c2ccccn2)cs1 ZINC000269040168 1043352847 /nfs/dbraw/zinc/35/28/47/1043352847.db2.gz GIACGQLSKQUHAJ-BBRMVZONSA-N 1 2 319.474 4.123 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H]2CC(C)(C)Cc3occc32)cs1 ZINC000269087703 1043357210 /nfs/dbraw/zinc/35/72/10/1043357210.db2.gz PWDSVZWAOFOXFH-RISCZKNCSA-N 1 2 320.458 4.247 20 0 DIADLO CC1(C(=O)Nc2cccc3c2CN(c2cccc[nH+]2)C3)CCCC1 ZINC000270175599 1043380170 /nfs/dbraw/zinc/38/01/70/1043380170.db2.gz AUMGXXDLKMJHDP-UHFFFAOYSA-N 1 2 321.424 4.121 20 0 DIADLO C[C@@H](c1nc2ccccc2c(=O)[nH]1)[N@H+]1CC=C(C(C)(C)C)CC1 ZINC000270352714 1043384322 /nfs/dbraw/zinc/38/43/22/1043384322.db2.gz ICEJHPLIFIFBGN-ZDUSSCGKSA-N 1 2 311.429 4.075 20 0 DIADLO C[C@@H](c1nc2ccccc2c(=O)[nH]1)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000270352714 1043384331 /nfs/dbraw/zinc/38/43/31/1043384331.db2.gz ICEJHPLIFIFBGN-ZDUSSCGKSA-N 1 2 311.429 4.075 20 0 DIADLO COC[C@@H]([NH2+]Cc1c(Cl)oc2ccccc21)c1ccco1 ZINC000270544212 1043390500 /nfs/dbraw/zinc/39/05/00/1043390500.db2.gz YYOWQPQQFVTEJG-CYBMUJFWSA-N 1 2 305.761 4.157 20 0 DIADLO Clc1ccc(C2([NH2+]Cc3ncc(C4CC4)o3)CCC2)cc1 ZINC000270566461 1043391563 /nfs/dbraw/zinc/39/15/63/1043391563.db2.gz ZEMVMODGWCGFMX-UHFFFAOYSA-N 1 2 302.805 4.374 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cnc([C@@H]2CCCO2)s1 ZINC000271051799 1043398491 /nfs/dbraw/zinc/39/84/91/1043398491.db2.gz PUAAIAPVSUWDMC-WBMJQRKESA-N 1 2 320.433 4.327 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cnc([C@@H]2CCCO2)s1 ZINC000271051799 1043398500 /nfs/dbraw/zinc/39/85/00/1043398500.db2.gz PUAAIAPVSUWDMC-WBMJQRKESA-N 1 2 320.433 4.327 20 0 DIADLO Cc1ccc(C[C@H]([NH2+][C@@H](C)c2cscn2)c2ccccn2)cc1 ZINC000271067924 1043402095 /nfs/dbraw/zinc/40/20/95/1043402095.db2.gz DKENBZFSVZAWPW-YJBOKZPZSA-N 1 2 323.465 4.481 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](Cc1cnc([C@H]2CCCO2)s1)C1CC1 ZINC000271153392 1043404663 /nfs/dbraw/zinc/40/46/63/1043404663.db2.gz UZLCZMRSOCAZFC-BLLLJJGKSA-N 1 2 318.442 4.313 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](Cc1cnc([C@H]2CCCO2)s1)C1CC1 ZINC000271153392 1043404672 /nfs/dbraw/zinc/40/46/72/1043404672.db2.gz UZLCZMRSOCAZFC-BLLLJJGKSA-N 1 2 318.442 4.313 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)on1 ZINC000925265084 1043405078 /nfs/dbraw/zinc/40/50/78/1043405078.db2.gz QLXKCHXNSGGETQ-HWPZZCPQSA-N 1 2 324.371 4.399 20 0 DIADLO CC(C)[C@@H]([NH2+][C@H](C)c1cscn1)c1nc2ccccc2[nH]1 ZINC000271190992 1043406382 /nfs/dbraw/zinc/40/63/82/1043406382.db2.gz XOCVOJPLEJLPRM-IAQYHMDHSA-N 1 2 300.431 4.067 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H](C)c1cscn1)c1nc2ccccc2[nH]1 ZINC000271190995 1043406602 /nfs/dbraw/zinc/40/66/02/1043406602.db2.gz XOCVOJPLEJLPRM-NHYWBVRUSA-N 1 2 300.431 4.067 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1ccc(Cl)cc1Cl ZINC000271430961 1043416090 /nfs/dbraw/zinc/41/60/90/1043416090.db2.gz BBZBJDSPYTUQOC-XPTSAGLGSA-N 1 2 310.228 4.445 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1ccc(Cl)cc1Cl ZINC000271430961 1043416093 /nfs/dbraw/zinc/41/60/93/1043416093.db2.gz BBZBJDSPYTUQOC-XPTSAGLGSA-N 1 2 310.228 4.445 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1cc(Cl)ccc1Cl ZINC000271446009 1043418807 /nfs/dbraw/zinc/41/88/07/1043418807.db2.gz CYGGKSIFRDVDEU-OTYXRUKQSA-N 1 2 310.228 4.445 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1cc(Cl)ccc1Cl ZINC000271446009 1043418818 /nfs/dbraw/zinc/41/88/18/1043418818.db2.gz CYGGKSIFRDVDEU-OTYXRUKQSA-N 1 2 310.228 4.445 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1cn2c(n1)CCCC2)c1cc(F)ccc1F ZINC000925454782 1043419585 /nfs/dbraw/zinc/41/95/85/1043419585.db2.gz ZOWCPODONZEWCX-LRDDRELGSA-N 1 2 319.399 4.300 20 0 DIADLO C[C@@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1ccc(Cl)cc1 ZINC000271485393 1043423764 /nfs/dbraw/zinc/42/37/64/1043423764.db2.gz OERUKIQJFDTMFR-BMIGLBTASA-N 1 2 311.759 4.002 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+][C@@H](C)c1cccc(O)c1F ZINC000872024394 1043423561 /nfs/dbraw/zinc/42/35/61/1043423561.db2.gz AGCHUWBHGZQBRZ-QWRGUYRKSA-N 1 2 307.340 4.091 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+][C@@H](C)c2nnc(C(C)C)[nH]2)cc1F ZINC000271473467 1043424657 /nfs/dbraw/zinc/42/46/57/1043424657.db2.gz ISEVVNVPLGMNNL-MNOVXSKESA-N 1 2 322.453 4.201 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000271472405 1043424844 /nfs/dbraw/zinc/42/48/44/1043424844.db2.gz HPVAUNVLZYQPSI-XHDPSFHLSA-N 1 2 319.836 4.190 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2ccccc2SC)[nH]1 ZINC000442859785 1043436031 /nfs/dbraw/zinc/43/60/31/1043436031.db2.gz REWXUUIMUNWBPJ-XQQFMLRXSA-N 1 2 318.490 4.452 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2ccccc2SC)[nH]1 ZINC000442859783 1043437070 /nfs/dbraw/zinc/43/70/70/1043437070.db2.gz REWXUUIMUNWBPJ-AVGNSLFASA-N 1 2 318.490 4.452 20 0 DIADLO CC[C@H](CCC(F)(F)F)[NH2+]c1ccc(N2CCOCC2)cc1 ZINC000872055722 1043439859 /nfs/dbraw/zinc/43/98/59/1043439859.db2.gz KFFOSPVTRHZWHT-CYBMUJFWSA-N 1 2 316.367 4.056 20 0 DIADLO CC[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000271588599 1043440793 /nfs/dbraw/zinc/44/07/93/1043440793.db2.gz SSIIROMBZGSARW-WDEREUQCSA-N 1 2 315.244 4.195 20 0 DIADLO CC[C@@H]1CC[C@H](C)[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000271588599 1043440803 /nfs/dbraw/zinc/44/08/03/1043440803.db2.gz SSIIROMBZGSARW-WDEREUQCSA-N 1 2 315.244 4.195 20 0 DIADLO CCSCc1cc[nH+]c(N[C@@H]2CCOC3(CCCC3)C2)c1 ZINC000872058162 1043441110 /nfs/dbraw/zinc/44/11/10/1043441110.db2.gz OFYMWAIOUNSMHH-OAHLLOKOSA-N 1 2 306.475 4.238 20 0 DIADLO COC(=O)c1oc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2F)cc1C ZINC000271650406 1043445070 /nfs/dbraw/zinc/44/50/70/1043445070.db2.gz FCMSMGUWAUVQEO-GHMZBOCLSA-N 1 2 323.339 4.065 20 0 DIADLO COC(=O)c1oc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2F)cc1C ZINC000271650409 1043446510 /nfs/dbraw/zinc/44/65/10/1043446510.db2.gz FCMSMGUWAUVQEO-WDEREUQCSA-N 1 2 323.339 4.065 20 0 DIADLO CC1(C)C[NH+](Cc2csc(-c3ccsc3)n2)CC(C)(C)O1 ZINC000442894668 1043451975 /nfs/dbraw/zinc/45/19/75/1043451975.db2.gz RWWNWFKFNWLODQ-UHFFFAOYSA-N 1 2 322.499 4.261 20 0 DIADLO FCc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1 ZINC000777572492 1043456460 /nfs/dbraw/zinc/45/64/60/1043456460.db2.gz KQGWQLOEUPQOJD-GOSISDBHSA-N 1 2 321.342 4.008 20 0 DIADLO FCc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1 ZINC000777572492 1043456470 /nfs/dbraw/zinc/45/64/70/1043456470.db2.gz KQGWQLOEUPQOJD-GOSISDBHSA-N 1 2 321.342 4.008 20 0 DIADLO FCc1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)cc1 ZINC000777572493 1043457285 /nfs/dbraw/zinc/45/72/85/1043457285.db2.gz KQGWQLOEUPQOJD-SFHVURJKSA-N 1 2 321.342 4.008 20 0 DIADLO FCc1ccc(C[N@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)cc1 ZINC000777572493 1043457288 /nfs/dbraw/zinc/45/72/88/1043457288.db2.gz KQGWQLOEUPQOJD-SFHVURJKSA-N 1 2 321.342 4.008 20 0 DIADLO Clc1ccnc2c1CC[C@@H]2Nc1ccc([NH+]2CCCC2)cc1 ZINC000925726402 1043457431 /nfs/dbraw/zinc/45/74/31/1043457431.db2.gz HXJQIQVQRRWRBP-KRWDZBQOSA-N 1 2 313.832 4.435 20 0 DIADLO Cc1cc(C)c([C@@H](C)[NH2+]Cc2nnc(-c3ccccc3)[nH]2)cc1C ZINC000777573610 1043461927 /nfs/dbraw/zinc/46/19/27/1043461927.db2.gz CJYYXXIGCAOZKD-MRXNPFEDSA-N 1 2 320.440 4.248 20 0 DIADLO Cc1cc(C)c([C@@H](C)[NH2+]Cc2nc(-c3ccccc3)n[nH]2)cc1C ZINC000777573610 1043461935 /nfs/dbraw/zinc/46/19/35/1043461935.db2.gz CJYYXXIGCAOZKD-MRXNPFEDSA-N 1 2 320.440 4.248 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nc(-c3ccncc3)cs2)oc1C ZINC000872122629 1043466664 /nfs/dbraw/zinc/46/66/64/1043466664.db2.gz XKQADKJNMGEVGJ-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@@H](Nc1cccc(N2CCCCC2)c1)c1cn2c([nH+]1)CCCC2 ZINC000925773403 1043469948 /nfs/dbraw/zinc/46/99/48/1043469948.db2.gz NBAHMPNXHABPNU-MRXNPFEDSA-N 1 2 324.472 4.383 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(C(F)(F)F)nc2)cs1 ZINC000872130312 1043471597 /nfs/dbraw/zinc/47/15/97/1043471597.db2.gz KQFWLQSFUZKNIY-RKDXNWHRSA-N 1 2 315.364 4.277 20 0 DIADLO c1cn(Cc2ccc(N[C@@H]3CC[C@@H](c4ccccc4)C3)nc2)c[nH+]1 ZINC000348836425 1043472493 /nfs/dbraw/zinc/47/24/93/1043472493.db2.gz WDJNEHMJTWTURN-RTBURBONSA-N 1 2 318.424 4.075 20 0 DIADLO Brc1cscc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000348918884 1043480827 /nfs/dbraw/zinc/48/08/27/1043480827.db2.gz DETHPPFLGWCIBP-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cscc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000348918884 1043480834 /nfs/dbraw/zinc/48/08/34/1043480834.db2.gz DETHPPFLGWCIBP-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO C[C@@H]1CC[C@@H]([NH2+]Cc2nnc(-c3ccccc3)[nH]2)c2ccccc21 ZINC000777576630 1043482597 /nfs/dbraw/zinc/48/25/97/1043482597.db2.gz XFTDJAFKKBSSSW-RDTXWAMCSA-N 1 2 318.424 4.200 20 0 DIADLO Cc1ccc(-n2cc[nH+]c2)c(-c2nc(CC3=CCCCC3)no2)c1 ZINC000558302684 1043484480 /nfs/dbraw/zinc/48/44/80/1043484480.db2.gz ZCEOCTSSBBXIBE-UHFFFAOYSA-N 1 2 320.396 4.274 20 0 DIADLO CCCCc1nc(C[N@H+](CCC)[C@@H]2CCc3ccccc32)no1 ZINC000521819644 1043484995 /nfs/dbraw/zinc/48/49/95/1043484995.db2.gz DMQMXSMBXFJBJR-QGZVFWFLSA-N 1 2 313.445 4.312 20 0 DIADLO CCCCc1nc(C[N@@H+](CCC)[C@@H]2CCc3ccccc32)no1 ZINC000521819644 1043485002 /nfs/dbraw/zinc/48/50/02/1043485002.db2.gz DMQMXSMBXFJBJR-QGZVFWFLSA-N 1 2 313.445 4.312 20 0 DIADLO Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]Cc1nnc(-c2ccccc2)[nH]1 ZINC000777578005 1043485149 /nfs/dbraw/zinc/48/51/49/1043485149.db2.gz GIVZZWHNKWMAQR-YOEHRIQHSA-N 1 2 318.424 4.118 20 0 DIADLO CCC(CC)c1noc([C@@H]([NH3+])c2cccc(C(F)(F)F)c2)n1 ZINC000872176273 1043485636 /nfs/dbraw/zinc/48/56/36/1043485636.db2.gz XQQYYOUAZFXQRM-LBPRGKRZSA-N 1 2 313.323 4.040 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2nnc(-c3ccccc3)[nH]2)C2CC2)cc1 ZINC000777578988 1043489237 /nfs/dbraw/zinc/48/92/37/1043489237.db2.gz PHXXKJUGJSGCQP-IBGZPJMESA-N 1 2 318.424 4.021 20 0 DIADLO C[C@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1ccnnc1 ZINC000925909312 1043491094 /nfs/dbraw/zinc/49/10/94/1043491094.db2.gz FLBGNQSMHINDOG-JTQLQIEISA-N 1 2 308.212 4.123 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)C1(Cl)CC1 ZINC000925940874 1043497142 /nfs/dbraw/zinc/49/71/42/1043497142.db2.gz UGIGIKIEOWEOEW-CYBMUJFWSA-N 1 2 313.832 4.174 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc(C(F)(F)F)nc2)nc(C2CC2)[nH+]1 ZINC000872767504 1043508107 /nfs/dbraw/zinc/50/81/07/1043508107.db2.gz CFFHIYLDPVCXTI-JTQLQIEISA-N 1 2 322.334 4.249 20 0 DIADLO CC[C@H](NC(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccc(C)cc1 ZINC000349456100 1043508743 /nfs/dbraw/zinc/50/87/43/1043508743.db2.gz RKSQNODSMLQEFJ-KRWDZBQOSA-N 1 2 322.412 4.224 20 0 DIADLO Cc1cc(C(F)(F)F)ccc1C[N@H+](C)Cc1nccs1 ZINC000191076259 1043512378 /nfs/dbraw/zinc/51/23/78/1043512378.db2.gz KXXHJFAIQVLCSY-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1cc(C(F)(F)F)ccc1C[N@@H+](C)Cc1nccs1 ZINC000191076259 1043512392 /nfs/dbraw/zinc/51/23/92/1043512392.db2.gz KXXHJFAIQVLCSY-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1nn(-c2ccc(Cl)cc2)cc1C[N@H+](C)Cc1ccco1 ZINC000349584928 1043514331 /nfs/dbraw/zinc/51/43/31/1043514331.db2.gz HMOHOMHIZDNKMJ-UHFFFAOYSA-N 1 2 315.804 4.059 20 0 DIADLO Cc1nn(-c2ccc(Cl)cc2)cc1C[N@@H+](C)Cc1ccco1 ZINC000349584928 1043514336 /nfs/dbraw/zinc/51/43/36/1043514336.db2.gz HMOHOMHIZDNKMJ-UHFFFAOYSA-N 1 2 315.804 4.059 20 0 DIADLO FC(F)(F)c1ccc(C[NH2+]Cc2ncc(Cl)s2)s1 ZINC000873154440 1043518518 /nfs/dbraw/zinc/51/85/18/1043518518.db2.gz DHPUNGOFDOIDKN-UHFFFAOYSA-N 1 2 312.769 4.167 20 0 DIADLO CC1(C)CCc2cc(C[NH2+]Cc3ncc(Cl)s3)ccc2O1 ZINC000873164894 1043522216 /nfs/dbraw/zinc/52/22/16/1043522216.db2.gz GKORKIHNLIUZBS-UHFFFAOYSA-N 1 2 322.861 4.190 20 0 DIADLO FC(F)(C[NH2+][C@H](c1cccnc1)C1CCC1)c1ccccc1 ZINC000558507623 1043524620 /nfs/dbraw/zinc/52/46/20/1043524620.db2.gz NSKOMGKFSHMLPI-KRWDZBQOSA-N 1 2 302.368 4.304 20 0 DIADLO CCCc1nc(C[N@@H+]2CC3(CCCC3)OC(C)(C)C2)cs1 ZINC000443317035 1043528453 /nfs/dbraw/zinc/52/84/53/1043528453.db2.gz GEKQMDDXJQWEFD-UHFFFAOYSA-N 1 2 308.491 4.019 20 0 DIADLO CCCc1nc(C[N@H+]2CC3(CCCC3)OC(C)(C)C2)cs1 ZINC000443317035 1043528464 /nfs/dbraw/zinc/52/84/64/1043528464.db2.gz GEKQMDDXJQWEFD-UHFFFAOYSA-N 1 2 308.491 4.019 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CC3(CCCC3)OC(C)(C)C2)n1 ZINC000443334387 1043529719 /nfs/dbraw/zinc/52/97/19/1043529719.db2.gz MBHABXSVFUPKDQ-UHFFFAOYSA-N 1 2 319.493 4.168 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CC3(CCCC3)OC(C)(C)C2)n1 ZINC000443334387 1043529728 /nfs/dbraw/zinc/52/97/28/1043529728.db2.gz MBHABXSVFUPKDQ-UHFFFAOYSA-N 1 2 319.493 4.168 20 0 DIADLO C[C@H](N[C@@H](CC(C)(C)C)C(F)(F)F)c1cn2c([nH+]1)CCCC2 ZINC000926109544 1043530065 /nfs/dbraw/zinc/53/00/65/1043530065.db2.gz LTHZGAUZISMFNW-AAEUAGOBSA-N 1 2 317.399 4.237 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@@H]1CCCOc2c(F)cccc21 ZINC000926111835 1043530839 /nfs/dbraw/zinc/53/08/39/1043530839.db2.gz KIGIEEYKUHTZAG-CABCVRRESA-N 1 2 316.376 4.003 20 0 DIADLO C[N@H+](Cc1ccco1)Cc1ccc(Sc2ccccn2)o1 ZINC000350281566 1043543389 /nfs/dbraw/zinc/54/33/89/1043543389.db2.gz ZMRQMWLTJFKTRI-UHFFFAOYSA-N 1 2 300.383 4.051 20 0 DIADLO C[N@@H+](Cc1ccco1)Cc1ccc(Sc2ccccn2)o1 ZINC000350281566 1043543397 /nfs/dbraw/zinc/54/33/97/1043543397.db2.gz ZMRQMWLTJFKTRI-UHFFFAOYSA-N 1 2 300.383 4.051 20 0 DIADLO C[N@@H+](Cc1ccoc1)Cc1ccc(Sc2ccccn2)o1 ZINC000350663182 1043549902 /nfs/dbraw/zinc/54/99/02/1043549902.db2.gz USQPNEUDPWCXDW-UHFFFAOYSA-N 1 2 300.383 4.051 20 0 DIADLO C[N@H+](Cc1ccoc1)Cc1ccc(Sc2ccccn2)o1 ZINC000350663182 1043549912 /nfs/dbraw/zinc/54/99/12/1043549912.db2.gz USQPNEUDPWCXDW-UHFFFAOYSA-N 1 2 300.383 4.051 20 0 DIADLO FC(F)C1CCC(Nc2ccc(N3CCCCC3)c[nH+]2)CC1 ZINC000442860219 1043550173 /nfs/dbraw/zinc/55/01/73/1043550173.db2.gz KVFDFRGSTKJQQC-UHFFFAOYSA-N 1 2 309.404 4.308 20 0 DIADLO CCc1nocc1C[N@H+](Cc1ccco1)Cc1ccc(C)s1 ZINC000350718108 1043551336 /nfs/dbraw/zinc/55/13/36/1043551336.db2.gz CWOQPKLZBZDTMN-UHFFFAOYSA-N 1 2 316.426 4.402 20 0 DIADLO CCc1nocc1C[N@@H+](Cc1ccco1)Cc1ccc(C)s1 ZINC000350718108 1043551347 /nfs/dbraw/zinc/55/13/47/1043551347.db2.gz CWOQPKLZBZDTMN-UHFFFAOYSA-N 1 2 316.426 4.402 20 0 DIADLO COc1ccc2cc([C@@H](C)[NH2+][C@@H](C)c3csnn3)ccc2c1 ZINC000398429338 1043560239 /nfs/dbraw/zinc/56/02/39/1043560239.db2.gz UEYQSTILHKKPDF-NEPJUHHUSA-N 1 2 313.426 4.112 20 0 DIADLO Cc1c(N[C@H](C)c2cn3c([nH+]2)CCCC3)cnn1C1CCCC1 ZINC000926292500 1043560866 /nfs/dbraw/zinc/56/08/66/1043560866.db2.gz KMYLJPBRHKGNRC-CYBMUJFWSA-N 1 2 313.449 4.013 20 0 DIADLO Cc1cccc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3n2C)n1 ZINC000558679259 1043572192 /nfs/dbraw/zinc/57/21/92/1043572192.db2.gz OQPPEQWKWYERPW-IBGZPJMESA-N 1 2 320.440 4.004 20 0 DIADLO Cc1cccc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3n2C)n1 ZINC000558679259 1043572202 /nfs/dbraw/zinc/57/22/02/1043572202.db2.gz OQPPEQWKWYERPW-IBGZPJMESA-N 1 2 320.440 4.004 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2c(C)oc3ccccc32)s1 ZINC000926461862 1043581207 /nfs/dbraw/zinc/58/12/07/1043581207.db2.gz SURPUABZGNTJNO-JTQLQIEISA-N 1 2 301.415 4.006 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(C2CCCC2)s1)c1c(F)cncc1F ZINC000353144464 1043588957 /nfs/dbraw/zinc/58/89/57/1043588957.db2.gz VAMFZUQXTNIWTO-SNVBAGLBSA-N 1 2 323.412 4.325 20 0 DIADLO COCc1nc(C[NH2+][C@@H](C)c2cc3cccc(F)c3o2)cs1 ZINC000353210500 1043590384 /nfs/dbraw/zinc/59/03/84/1043590384.db2.gz XDVNHBGLQOVKQT-JTQLQIEISA-N 1 2 320.389 4.026 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2cc3ccccc3c(OC)c2)co1 ZINC000926535472 1043595192 /nfs/dbraw/zinc/59/51/92/1043595192.db2.gz AJTISWLZGMAWIA-ZDUSSCGKSA-N 1 2 310.397 4.250 20 0 DIADLO CCCc1ncc(C[NH2+][C@@H](c2ccc(C)cc2)c2cccnc2)o1 ZINC000926536691 1043596248 /nfs/dbraw/zinc/59/62/48/1043596248.db2.gz GYLPTZFRXDHNCS-FQEVSTJZSA-N 1 2 321.424 4.210 20 0 DIADLO CCc1ncc(C[NH2+][C@H](c2ccc(CC)cc2)c2cccnc2)o1 ZINC000926541364 1043596425 /nfs/dbraw/zinc/59/64/25/1043596425.db2.gz OWHQDYIMZWVAGY-HXUWFJFHSA-N 1 2 321.424 4.074 20 0 DIADLO CCc1ncc(C[NH2+][C@@H](c2ccc(CC)cc2)c2cccnc2)o1 ZINC000926541362 1043597459 /nfs/dbraw/zinc/59/74/59/1043597459.db2.gz OWHQDYIMZWVAGY-FQEVSTJZSA-N 1 2 321.424 4.074 20 0 DIADLO COc1ccnc([C@H](C)[NH2+]C2(c3ccccc3Cl)CC2)c1 ZINC000926625656 1043609477 /nfs/dbraw/zinc/60/94/77/1043609477.db2.gz CRCJCBAEBHVGCV-LBPRGKRZSA-N 1 2 302.805 4.084 20 0 DIADLO C[C@@H]1C[N@H+](CCCCC(F)(F)F)C[C@@H](c2ccc(F)cc2)O1 ZINC000443598649 1043611939 /nfs/dbraw/zinc/61/19/39/1043611939.db2.gz AUWQKEBIFCJZMF-DOMZBBRYSA-N 1 2 319.342 4.320 20 0 DIADLO C[C@@H]1C[N@@H+](CCCCC(F)(F)F)C[C@@H](c2ccc(F)cc2)O1 ZINC000443598649 1043611944 /nfs/dbraw/zinc/61/19/44/1043611944.db2.gz AUWQKEBIFCJZMF-DOMZBBRYSA-N 1 2 319.342 4.320 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+]2CCc3ccsc3C2)s1 ZINC000353550079 1043616830 /nfs/dbraw/zinc/61/68/30/1043616830.db2.gz QDUHBXZJKIQKGX-UHFFFAOYSA-N 1 2 318.389 4.090 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+]2CCc3ccsc3C2)s1 ZINC000353550079 1043616836 /nfs/dbraw/zinc/61/68/36/1043616836.db2.gz QDUHBXZJKIQKGX-UHFFFAOYSA-N 1 2 318.389 4.090 20 0 DIADLO CCC[N@H+](Cc1nc(C2CCCC2)no1)Cc1ccc(F)cc1 ZINC000443620490 1043623027 /nfs/dbraw/zinc/62/30/27/1043623027.db2.gz DOBXWUFEVQKZDG-UHFFFAOYSA-N 1 2 317.408 4.279 20 0 DIADLO CCC[N@@H+](Cc1nc(C2CCCC2)no1)Cc1ccc(F)cc1 ZINC000443620490 1043623036 /nfs/dbraw/zinc/62/30/36/1043623036.db2.gz DOBXWUFEVQKZDG-UHFFFAOYSA-N 1 2 317.408 4.279 20 0 DIADLO FC(F)(F)c1nc(CNc2c[nH+]cc3c2CCCC3)cs1 ZINC000895307256 1043629021 /nfs/dbraw/zinc/62/90/21/1043629021.db2.gz BOALEGFOBONKNL-UHFFFAOYSA-N 1 2 313.348 4.048 20 0 DIADLO F[C@H]1CCC2(C1)CC[NH+](Cc1nc(C(F)(F)F)cs1)CC2 ZINC001141764131 1043631810 /nfs/dbraw/zinc/63/18/10/1043631810.db2.gz UPMQYLYACYDLJY-JTQLQIEISA-N 1 2 322.371 4.266 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(C3CCC3)s2)[C@H]1c1ccncc1 ZINC000353697164 1043634298 /nfs/dbraw/zinc/63/42/98/1043634298.db2.gz FJDCBWKLMIYLFR-INIZCTEOSA-N 1 2 313.470 4.389 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(C3CCC3)s2)[C@H]1c1ccncc1 ZINC000353697164 1043634303 /nfs/dbraw/zinc/63/43/03/1043634303.db2.gz FJDCBWKLMIYLFR-INIZCTEOSA-N 1 2 313.470 4.389 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000125531439 1043635866 /nfs/dbraw/zinc/63/58/66/1043635866.db2.gz DEZCSFGJHHRONO-RCCFBDPRSA-N 1 2 319.493 4.289 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000125530990 1043635914 /nfs/dbraw/zinc/63/59/14/1043635914.db2.gz DEZCSFGJHHRONO-OKZBNKHCSA-N 1 2 319.493 4.289 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2cc(C3CC3)no2)c2cccnc2)cc1 ZINC000926868599 1043645631 /nfs/dbraw/zinc/64/56/31/1043645631.db2.gz JZFCXZYKXJIKBR-HXUWFJFHSA-N 1 2 319.408 4.135 20 0 DIADLO Fc1ccc(F)c2c1CC[C@H]2[NH2+]Cc1nc2c(s1)CCCC2 ZINC000926917455 1043656360 /nfs/dbraw/zinc/65/63/60/1043656360.db2.gz AXZKVNFGAWHXQT-CQSZACIVSA-N 1 2 320.408 4.077 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccccc1OC ZINC000353924526 1043659991 /nfs/dbraw/zinc/65/99/91/1043659991.db2.gz SKWWTIBFZYNCKO-IAQYHMDHSA-N 1 2 306.356 4.170 20 0 DIADLO CSCc1ccc(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000353980227 1043669842 /nfs/dbraw/zinc/66/98/42/1043669842.db2.gz AKXQNDGLKKDQTI-SFHVURJKSA-N 1 2 323.465 4.152 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2CCCc3cccnc32)cs1 ZINC000927063603 1043677166 /nfs/dbraw/zinc/67/71/66/1043677166.db2.gz HTBQKMRDXLBFPY-JSGCOSHPSA-N 1 2 301.459 4.390 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@@H](c2ccc(F)cn2)C(C)C)c(F)c1 ZINC000927095256 1043685097 /nfs/dbraw/zinc/68/50/97/1043685097.db2.gz YGXIMISWYWAGQW-QGZVFWFLSA-N 1 2 308.347 4.294 20 0 DIADLO CC(C)CCCCCC(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927089452 1043685128 /nfs/dbraw/zinc/68/51/28/1043685128.db2.gz ALNBMYCORVOEPC-UHFFFAOYSA-N 1 2 317.477 4.091 20 0 DIADLO Cc1ccc2cc([C@H](C)[NH2+]Cc3cc(C4CC4)n(C)n3)oc2c1 ZINC000927109708 1043689496 /nfs/dbraw/zinc/68/94/96/1043689496.db2.gz VZCXHTXMYUXCBM-ZDUSSCGKSA-N 1 2 309.413 4.203 20 0 DIADLO Fc1ccccc1-c1noc([C@@H]2CCC[C@H](c3ccccc3)[NH2+]2)n1 ZINC001211883782 1043695594 /nfs/dbraw/zinc/69/55/94/1043695594.db2.gz BXDKFIVKIWZDOA-SJORKVTESA-N 1 2 323.371 4.432 20 0 DIADLO Brc1ncccc1C[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000876579609 1043697632 /nfs/dbraw/zinc/69/76/32/1043697632.db2.gz ISFYIQAISDLELA-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ncccc1C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000876579609 1043697644 /nfs/dbraw/zinc/69/76/44/1043697644.db2.gz ISFYIQAISDLELA-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccccc2CC(F)(F)F)no1 ZINC000876593829 1043700022 /nfs/dbraw/zinc/70/00/22/1043700022.db2.gz YJKJDSXUOHEOSM-INIZCTEOSA-N 1 2 324.346 4.425 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccccc2CC(F)(F)F)no1 ZINC000876593829 1043700037 /nfs/dbraw/zinc/70/00/37/1043700037.db2.gz YJKJDSXUOHEOSM-INIZCTEOSA-N 1 2 324.346 4.425 20 0 DIADLO CC(C)CO[C@H](C)c1noc(C[N@H+](C)[C@@H]2C=CCCCCC2)n1 ZINC000559105527 1043700518 /nfs/dbraw/zinc/70/05/18/1043700518.db2.gz CEXRFWIDLVZGDT-HZPDHXFCSA-N 1 2 321.465 4.124 20 0 DIADLO CC(C)CO[C@H](C)c1noc(C[N@@H+](C)[C@@H]2C=CCCCCC2)n1 ZINC000559105527 1043700529 /nfs/dbraw/zinc/70/05/29/1043700529.db2.gz CEXRFWIDLVZGDT-HZPDHXFCSA-N 1 2 321.465 4.124 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cnc3c(F)cccc3c2)no1 ZINC000876593057 1043700524 /nfs/dbraw/zinc/70/05/24/1043700524.db2.gz UAZMHTXAZLRUHA-KRWDZBQOSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cnc3c(F)cccc3c2)no1 ZINC000876593057 1043700535 /nfs/dbraw/zinc/70/05/35/1043700535.db2.gz UAZMHTXAZLRUHA-KRWDZBQOSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cnc3c(F)cccc3c2)no1 ZINC000876593060 1043701064 /nfs/dbraw/zinc/70/10/64/1043701064.db2.gz UAZMHTXAZLRUHA-QGZVFWFLSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cnc3c(F)cccc3c2)no1 ZINC000876593060 1043701082 /nfs/dbraw/zinc/70/10/82/1043701082.db2.gz UAZMHTXAZLRUHA-QGZVFWFLSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2ccc(Cl)nn2)o1 ZINC000876754069 1043707401 /nfs/dbraw/zinc/70/74/01/1043707401.db2.gz MDIQYYJCCJZWIE-CQSZACIVSA-N 1 2 305.809 4.149 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2ccc(Cl)nn2)o1 ZINC000876754069 1043707414 /nfs/dbraw/zinc/70/74/14/1043707414.db2.gz MDIQYYJCCJZWIE-CQSZACIVSA-N 1 2 305.809 4.149 20 0 DIADLO Fc1ccc(C[C@@H]2CCC[N@H+](Cc3ncc(Cl)s3)C2)cc1 ZINC001137112139 1043709713 /nfs/dbraw/zinc/70/97/13/1043709713.db2.gz UIJGSZJIPGAHQI-ZDUSSCGKSA-N 1 2 324.852 4.390 20 0 DIADLO Fc1ccc(C[C@@H]2CCC[N@@H+](Cc3ncc(Cl)s3)C2)cc1 ZINC001137112139 1043709721 /nfs/dbraw/zinc/70/97/21/1043709721.db2.gz UIJGSZJIPGAHQI-ZDUSSCGKSA-N 1 2 324.852 4.390 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cc(F)cc(F)c1F ZINC001137873581 1043719625 /nfs/dbraw/zinc/71/96/25/1043719625.db2.gz LEMIQDDTZANMSG-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1cc(F)cc(F)c1F ZINC001137873581 1043719637 /nfs/dbraw/zinc/71/96/37/1043719637.db2.gz LEMIQDDTZANMSG-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO CCC[N@H+](Cc1nnc(CC)[nH]1)[C@@H](C)c1cc2ccccc2o1 ZINC000354808464 1043721423 /nfs/dbraw/zinc/72/14/23/1043721423.db2.gz QQVPXBPCOQURBK-ZDUSSCGKSA-N 1 2 312.417 4.087 20 0 DIADLO CCC[N@@H+](Cc1nnc(CC)[nH]1)[C@@H](C)c1cc2ccccc2o1 ZINC000354808464 1043721438 /nfs/dbraw/zinc/72/14/38/1043721438.db2.gz QQVPXBPCOQURBK-ZDUSSCGKSA-N 1 2 312.417 4.087 20 0 DIADLO O=C(c1ccc(C2CCCC2)cc1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000354799390 1043721974 /nfs/dbraw/zinc/72/19/74/1043721974.db2.gz PCBQNWPOZWDXRG-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO O=C(c1ccc(C2CCCC2)cc1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000354799390 1043721982 /nfs/dbraw/zinc/72/19/82/1043721982.db2.gz PCBQNWPOZWDXRG-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO Cc1cc(N[C@H]2CCc3c2cc(F)cc3F)ccc1[NH+](C)C ZINC000777643262 1043725647 /nfs/dbraw/zinc/72/56/47/1043725647.db2.gz LZPZEKMEECRLPK-KRWDZBQOSA-N 1 2 302.368 4.439 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1nc(Cl)cs1 ZINC000876937577 1043726405 /nfs/dbraw/zinc/72/64/05/1043726405.db2.gz YQRFYENGHNUVEH-NSHDSACASA-N 1 2 310.850 4.435 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nc(Cl)cs1)c1nc2ccccc2[nH]1 ZINC000876985981 1043730020 /nfs/dbraw/zinc/73/00/20/1043730020.db2.gz WCQPMIUIXFYXNA-CQSZACIVSA-N 1 2 320.849 4.160 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H]2C[C@@H](C)Sc3sccc32)s1 ZINC000354961879 1043730792 /nfs/dbraw/zinc/73/07/92/1043730792.db2.gz DCKVWYGELASDKH-VHSKPIJISA-N 1 2 311.501 4.184 20 0 DIADLO c1ccc(-c2nc(C[NH2+][C@@H](c3ccccc3)C3CCC3)no2)cc1 ZINC000114719082 1043734734 /nfs/dbraw/zinc/73/47/34/1043734734.db2.gz JLQKWSDHERSCSJ-IBGZPJMESA-N 1 2 319.408 4.368 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(Cl)cs1)c1ccc(F)cc1Cl ZINC000877054152 1043740115 /nfs/dbraw/zinc/74/01/15/1043740115.db2.gz FNNLCYXZAVEVDQ-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO Clc1csc(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)n1 ZINC000877094943 1043741681 /nfs/dbraw/zinc/74/16/81/1043741681.db2.gz OFMQZDHPUHWOPF-GFCCVEGCSA-N 1 2 320.845 4.333 20 0 DIADLO CCO[P@@](C)(=O)CC[C@H](C)Nc1c[nH+]c2c(c1)CCCC2 ZINC000877194842 1043753759 /nfs/dbraw/zinc/75/37/59/1043753759.db2.gz CYJYBFWLEVZWNK-YEJXKQKISA-N 1 2 310.378 4.095 20 0 DIADLO CCO[P@@](C)(=O)CC[C@@H](C)Nc1c[nH+]c2c(c1)CCCC2 ZINC000877194841 1043753877 /nfs/dbraw/zinc/75/38/77/1043753877.db2.gz CYJYBFWLEVZWNK-LRTDBIEQSA-N 1 2 310.378 4.095 20 0 DIADLO C[C@@H](Cc1ccsc1)[NH2+]c1ccc(N2CCOC[C@H]2C)cc1 ZINC000777691607 1043755792 /nfs/dbraw/zinc/75/57/92/1043755792.db2.gz DBROEANEQOCOBU-LSDHHAIUSA-N 1 2 316.470 4.016 20 0 DIADLO C[C@H](Cc1ccsc1)[NH2+]c1ccc(N2CCOC[C@@H]2C)cc1 ZINC000777691587 1043757565 /nfs/dbraw/zinc/75/75/65/1043757565.db2.gz DBROEANEQOCOBU-CABCVRRESA-N 1 2 316.470 4.016 20 0 DIADLO CC(C)=CCC[C@H](C)[NH2+]c1ccc(N2CCO[C@H](C)C2)cc1 ZINC000777693856 1043760291 /nfs/dbraw/zinc/76/02/91/1043760291.db2.gz NWKVBUQMBGTGIZ-DLBZAZTESA-N 1 2 302.462 4.459 20 0 DIADLO CCC[N@H+](Cc1nc(Cl)cs1)[C@H]1CCCc2cccnc21 ZINC000877412276 1043761875 /nfs/dbraw/zinc/76/18/75/1043761875.db2.gz UGEKEIRULYPUFP-ZDUSSCGKSA-N 1 2 321.877 4.481 20 0 DIADLO CCC[N@@H+](Cc1nc(Cl)cs1)[C@H]1CCCc2cccnc21 ZINC000877412276 1043761882 /nfs/dbraw/zinc/76/18/82/1043761882.db2.gz UGEKEIRULYPUFP-ZDUSSCGKSA-N 1 2 321.877 4.481 20 0 DIADLO CC1(C)Cc2cccc(CNc3ccc(-n4cc[nH+]c4)cc3)c2O1 ZINC000355340524 1043762217 /nfs/dbraw/zinc/76/22/17/1043762217.db2.gz UUQUXVVSPFRKAR-UHFFFAOYSA-N 1 2 319.408 4.198 20 0 DIADLO Cc1cc(C[NH2+][C@H](CF)c2ccc(F)cc2)c2c(n1)CCCC2 ZINC000895853194 1043766680 /nfs/dbraw/zinc/76/66/80/1043766680.db2.gz MEALFQKHCVJXRF-LJQANCHMSA-N 1 2 316.395 4.208 20 0 DIADLO Clc1ccc(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)nn1 ZINC000877579539 1043776094 /nfs/dbraw/zinc/77/60/94/1043776094.db2.gz VDEVRBQHUQWKOY-QGZVFWFLSA-N 1 2 313.832 4.247 20 0 DIADLO Clc1ccc(C[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)nn1 ZINC000877579539 1043776104 /nfs/dbraw/zinc/77/61/04/1043776104.db2.gz VDEVRBQHUQWKOY-QGZVFWFLSA-N 1 2 313.832 4.247 20 0 DIADLO Fc1ccc2occ(C[N@@H+]3CCO[C@H](c4ccccc4)C3)c2c1 ZINC001141852688 1043778477 /nfs/dbraw/zinc/77/84/77/1043778477.db2.gz NXVPYNRKXARTLO-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccc2occ(C[N@H+]3CCO[C@H](c4ccccc4)C3)c2c1 ZINC001141852688 1043778485 /nfs/dbraw/zinc/77/84/85/1043778485.db2.gz NXVPYNRKXARTLO-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)Oc2cccc(Cl)c2)c(C)[nH+]1 ZINC000097040243 1043781162 /nfs/dbraw/zinc/78/11/62/1043781162.db2.gz ISRYFFXIASODRM-ZDUSSCGKSA-N 1 2 318.804 4.066 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cccc(C(F)(F)F)c2)c(C)[nH+]1 ZINC000097039894 1043781619 /nfs/dbraw/zinc/78/16/19/1043781619.db2.gz SGEYLVGVFXTPBM-UHFFFAOYSA-N 1 2 308.303 4.278 20 0 DIADLO Fc1ccc2occ(C[N@@H+]3CCc4cc(F)c(F)cc4C3)c2c1 ZINC001141858533 1043783473 /nfs/dbraw/zinc/78/34/73/1043783473.db2.gz QAEXYFYLKIGFIV-UHFFFAOYSA-N 1 2 317.310 4.408 20 0 DIADLO Fc1ccc2occ(C[N@H+]3CCc4cc(F)c(F)cc4C3)c2c1 ZINC001141858533 1043783487 /nfs/dbraw/zinc/78/34/87/1043783487.db2.gz QAEXYFYLKIGFIV-UHFFFAOYSA-N 1 2 317.310 4.408 20 0 DIADLO CC(C)([NH2+]Cc1ccc(F)nc1)c1nc2cc(Cl)ccc2o1 ZINC000877669174 1043787332 /nfs/dbraw/zinc/78/73/32/1043787332.db2.gz WRUMDJHORVRMAQ-UHFFFAOYSA-N 1 2 319.767 4.040 20 0 DIADLO CSC1CC[NH+](Cc2ccc(Cl)nc2C(F)(F)F)CC1 ZINC000877663825 1043787551 /nfs/dbraw/zinc/78/75/51/1043787551.db2.gz ZWIUYALLOXNREH-UHFFFAOYSA-N 1 2 324.799 4.081 20 0 DIADLO Cc1ccc(C[NH2+]C(C)(C)c2nc3cc(Cl)ccc3o2)nc1 ZINC000877668443 1043788327 /nfs/dbraw/zinc/78/83/27/1043788327.db2.gz IPVZYZNUFOMHDM-UHFFFAOYSA-N 1 2 315.804 4.210 20 0 DIADLO CC(C)n1ccnc1C[NH2+][C@H](C)c1cc2cccc(F)c2o1 ZINC000355768382 1043788794 /nfs/dbraw/zinc/78/87/94/1043788794.db2.gz GZBZRCAOHOHLPA-GFCCVEGCSA-N 1 2 301.365 4.200 20 0 DIADLO Cc1occc1C[NH2+]C(C)(C)c1nc2cc(Cl)ccc2o1 ZINC000877668843 1043789147 /nfs/dbraw/zinc/78/91/47/1043789147.db2.gz PWLUTGDHRRHCJT-UHFFFAOYSA-N 1 2 304.777 4.408 20 0 DIADLO Cc1nnsc1[C@H](C)[N@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000929137774 1043794815 /nfs/dbraw/zinc/79/48/15/1043794815.db2.gz BMJHPHLVXZHTKB-JTQLQIEISA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nnsc1[C@H](C)[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000929137774 1043794827 /nfs/dbraw/zinc/79/48/27/1043794827.db2.gz BMJHPHLVXZHTKB-JTQLQIEISA-N 1 2 315.364 4.058 20 0 DIADLO CC(C)c1cc([C@@H]2CCC[N@H+](Cc3nc(Cl)cs3)C2)[nH]n1 ZINC000877783883 1043797072 /nfs/dbraw/zinc/79/70/72/1043797072.db2.gz JNHIJKJQAKCLPN-LLVKDONJSA-N 1 2 324.881 4.023 20 0 DIADLO CC(C)c1cc([C@@H]2CCC[N@@H+](Cc3nc(Cl)cs3)C2)[nH]n1 ZINC000877783883 1043797086 /nfs/dbraw/zinc/79/70/86/1043797086.db2.gz JNHIJKJQAKCLPN-LLVKDONJSA-N 1 2 324.881 4.023 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H](C)c1ncccn1 ZINC000929318964 1043806959 /nfs/dbraw/zinc/80/69/59/1043806959.db2.gz GTSCFVOHHSKSBI-NSHDSACASA-N 1 2 310.228 4.367 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H](C)c1ncccn1 ZINC000929318964 1043806980 /nfs/dbraw/zinc/80/69/80/1043806980.db2.gz GTSCFVOHHSKSBI-NSHDSACASA-N 1 2 310.228 4.367 20 0 DIADLO FC(F)(F)c1coc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000877900545 1043818460 /nfs/dbraw/zinc/81/84/60/1043818460.db2.gz BJPXQWLDGOOIFC-QMMMGPOBSA-N 1 2 301.230 4.073 20 0 DIADLO FC(F)(F)c1coc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000877900545 1043818474 /nfs/dbraw/zinc/81/84/74/1043818474.db2.gz BJPXQWLDGOOIFC-QMMMGPOBSA-N 1 2 301.230 4.073 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2nc3c(o2)CCCC3)cc1 ZINC000877914541 1043821497 /nfs/dbraw/zinc/82/14/97/1043821497.db2.gz AXAXETMKOMFQEC-INIZCTEOSA-N 1 2 300.377 4.030 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2nc3c(o2)CCCC3)cc1 ZINC000877914541 1043821513 /nfs/dbraw/zinc/82/15/13/1043821513.db2.gz AXAXETMKOMFQEC-INIZCTEOSA-N 1 2 300.377 4.030 20 0 DIADLO c1[nH+]cn2c1CN(Cc1ccc(Sc3ccccc3)cc1)CC2 ZINC000356284311 1043828287 /nfs/dbraw/zinc/82/82/87/1043828287.db2.gz OUFRAYYMDHVARI-UHFFFAOYSA-N 1 2 321.449 4.050 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ncc(C)o2)cc1OCC ZINC000356267902 1043828331 /nfs/dbraw/zinc/82/83/31/1043828331.db2.gz MRYBFKWNHADKMH-KBPBESRZSA-N 1 2 318.417 4.192 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1coc(C(C)(C)C)n1)CCC2 ZINC000929975365 1043863678 /nfs/dbraw/zinc/86/36/78/1043863678.db2.gz FPDVTKKJDMXFJJ-CQSZACIVSA-N 1 2 319.474 4.246 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1coc(C(C)(C)C)n1)CCC2 ZINC000929975365 1043863685 /nfs/dbraw/zinc/86/36/85/1043863685.db2.gz FPDVTKKJDMXFJJ-CQSZACIVSA-N 1 2 319.474 4.246 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ncccc2Br)ccc1F ZINC000878372515 1043883773 /nfs/dbraw/zinc/88/37/73/1043883773.db2.gz KWAZUJGQMNVPES-LLVKDONJSA-N 1 2 323.209 4.142 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3F)s2)n1 ZINC000356858877 1043884039 /nfs/dbraw/zinc/88/40/39/1043884039.db2.gz CTMXKKIKACQBRD-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO Cc1c2ccccc2oc1[C@H]([NH2+]Cc1nncs1)C(C)C ZINC000930222810 1043898433 /nfs/dbraw/zinc/89/84/33/1043898433.db2.gz ROEMMXGLBLRMCA-OAHLLOKOSA-N 1 2 301.415 4.080 20 0 DIADLO CC[C@@H](C)[N@H+](Cc1ncn(-c2ccccc2)n1)Cc1ccccc1 ZINC000356954926 1043899725 /nfs/dbraw/zinc/89/97/25/1043899725.db2.gz CHKPFHGZXZEYJJ-QGZVFWFLSA-N 1 2 320.440 4.068 20 0 DIADLO CC[C@@H](C)[N@@H+](Cc1ncn(-c2ccccc2)n1)Cc1ccccc1 ZINC000356954926 1043899745 /nfs/dbraw/zinc/89/97/45/1043899745.db2.gz CHKPFHGZXZEYJJ-QGZVFWFLSA-N 1 2 320.440 4.068 20 0 DIADLO Cc1cnc([C@H](C)[N@H+](C)Cc2cccc(OC(F)(F)F)c2)o1 ZINC000356992920 1043904343 /nfs/dbraw/zinc/90/43/43/1043904343.db2.gz WVGQNTQGKWYYTO-NSHDSACASA-N 1 2 314.307 4.075 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+](C)Cc2cccc(OC(F)(F)F)c2)o1 ZINC000356992920 1043904353 /nfs/dbraw/zinc/90/43/53/1043904353.db2.gz WVGQNTQGKWYYTO-NSHDSACASA-N 1 2 314.307 4.075 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+](C)Cc2cccc(OC(F)(F)F)c2)o1 ZINC000356992919 1043904619 /nfs/dbraw/zinc/90/46/19/1043904619.db2.gz WVGQNTQGKWYYTO-LLVKDONJSA-N 1 2 314.307 4.075 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+](C)Cc2cccc(OC(F)(F)F)c2)o1 ZINC000356992919 1043904627 /nfs/dbraw/zinc/90/46/27/1043904627.db2.gz WVGQNTQGKWYYTO-LLVKDONJSA-N 1 2 314.307 4.075 20 0 DIADLO Cc1ccc2c(ccc(C)c2C[N@@H+](C)Cc2nncn2C(C)C)c1 ZINC000878644992 1043907980 /nfs/dbraw/zinc/90/79/80/1043907980.db2.gz FVBUEPBTSZWCIE-UHFFFAOYSA-N 1 2 322.456 4.261 20 0 DIADLO Cc1ccc2c(ccc(C)c2C[N@H+](C)Cc2nncn2C(C)C)c1 ZINC000878644992 1043907994 /nfs/dbraw/zinc/90/79/94/1043907994.db2.gz FVBUEPBTSZWCIE-UHFFFAOYSA-N 1 2 322.456 4.261 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(OCC3CC3)cc2)c(C)[nH+]1 ZINC000098102319 1043908629 /nfs/dbraw/zinc/90/86/29/1043908629.db2.gz XHNFCJIDLAOORB-UHFFFAOYSA-N 1 2 310.397 4.048 20 0 DIADLO C[C@H](c1noc(-c2cccc(-n3cc[nH+]c3)c2)n1)c1cccs1 ZINC000357019634 1043909542 /nfs/dbraw/zinc/90/95/42/1043909542.db2.gz OTXXKVCVTHPKPY-LBPRGKRZSA-N 1 2 322.393 4.136 20 0 DIADLO COc1ccccc1[C@@H](CC(C)C)[NH2+][C@@H](C)c1cc(C)on1 ZINC000290035783 1043911819 /nfs/dbraw/zinc/91/18/19/1043911819.db2.gz BEUFQHXIEDBNQD-WMLDXEAASA-N 1 2 302.418 4.430 20 0 DIADLO Fc1ccc2nc(C[NH+]3CCC(CC(F)(F)F)CC3)oc2c1 ZINC000561293762 1043922618 /nfs/dbraw/zinc/92/26/18/1043922618.db2.gz KOLTXYCAINQOIO-UHFFFAOYSA-N 1 2 316.298 4.131 20 0 DIADLO CCc1ccc(C[N@H+](Cc2nc(-c3ccoc3)no2)C2CC2)cc1 ZINC000357245562 1043932839 /nfs/dbraw/zinc/93/28/39/1043932839.db2.gz MJOAFTNJIIPODM-UHFFFAOYSA-N 1 2 323.396 4.057 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2nc(-c3ccoc3)no2)C2CC2)cc1 ZINC000357245562 1043932846 /nfs/dbraw/zinc/93/28/46/1043932846.db2.gz MJOAFTNJIIPODM-UHFFFAOYSA-N 1 2 323.396 4.057 20 0 DIADLO CCCCn1nc(C)c(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)c1Cl ZINC000127451433 1043935148 /nfs/dbraw/zinc/93/51/48/1043935148.db2.gz YWFMPSNMCCPZRQ-MRXNPFEDSA-N 1 2 320.868 4.310 20 0 DIADLO CCCCn1nc(C)c(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c1Cl ZINC000127451433 1043935151 /nfs/dbraw/zinc/93/51/51/1043935151.db2.gz YWFMPSNMCCPZRQ-MRXNPFEDSA-N 1 2 320.868 4.310 20 0 DIADLO CCCCn1nc(C)c(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)c1Cl ZINC000127451671 1043936508 /nfs/dbraw/zinc/93/65/08/1043936508.db2.gz YWFMPSNMCCPZRQ-INIZCTEOSA-N 1 2 320.868 4.310 20 0 DIADLO CCCCn1nc(C)c(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c1Cl ZINC000127451671 1043936519 /nfs/dbraw/zinc/93/65/19/1043936519.db2.gz YWFMPSNMCCPZRQ-INIZCTEOSA-N 1 2 320.868 4.310 20 0 DIADLO CC(C)([NH2+]Cc1scnc1Cl)c1nc2ccccc2s1 ZINC000879033619 1043938398 /nfs/dbraw/zinc/93/83/98/1043938398.db2.gz PODWIZVBPBMERE-UHFFFAOYSA-N 1 2 323.874 4.431 20 0 DIADLO Cc1cc(Cl)cc(C(=O)Nc2ccccc2-n2cc[nH+]c2)c1 ZINC000357336917 1043942340 /nfs/dbraw/zinc/94/23/40/1043942340.db2.gz RHTYUUPRFOFURD-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc2c(o1)CCCC2)c1ccc(F)cc1 ZINC000879129406 1043946639 /nfs/dbraw/zinc/94/66/39/1043946639.db2.gz XILWABJICRYWAW-SFHVURJKSA-N 1 2 302.393 4.108 20 0 DIADLO Cc1ccnc(C[NH2+]C(C)(C)c2nc3cc(Cl)ccc3o2)c1 ZINC000879158798 1043948240 /nfs/dbraw/zinc/94/82/40/1043948240.db2.gz DQZXDKYYEDHCME-UHFFFAOYSA-N 1 2 315.804 4.210 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc(F)c(Cl)cc2F)c(C)[nH+]1 ZINC000179232006 1043949512 /nfs/dbraw/zinc/94/95/12/1043949512.db2.gz BPEDRTSKPSSSQJ-UHFFFAOYSA-N 1 2 310.731 4.191 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@H](C)c2ccc(F)cc2F)c(C)[nH+]1 ZINC000179240207 1043951053 /nfs/dbraw/zinc/95/10/53/1043951053.db2.gz FAABVLAHZKADDR-JTQLQIEISA-N 1 2 318.367 4.417 20 0 DIADLO Clc1cccc2c(NCc3ccc4cc[nH]c4n3)cc[nH+]c12 ZINC000357579248 1043964902 /nfs/dbraw/zinc/96/49/02/1043964902.db2.gz JIIOBGDCJQSLKH-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1cc(C)on1 ZINC000290578346 1043965248 /nfs/dbraw/zinc/96/52/48/1043965248.db2.gz FSKIGPWMBAQYML-HIFRSBDPSA-N 1 2 302.418 4.320 20 0 DIADLO Fc1ccc(-c2cc(C[N@H+](Cc3ccccn3)C3CC3)on2)cc1 ZINC000357615978 1043969939 /nfs/dbraw/zinc/96/99/39/1043969939.db2.gz VYGYCFYXQNHJJZ-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1ccc(-c2cc(C[N@@H+](Cc3ccccn3)C3CC3)on2)cc1 ZINC000357615978 1043969943 /nfs/dbraw/zinc/96/99/43/1043969943.db2.gz VYGYCFYXQNHJJZ-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Cc1nnsc1[C@@H](C)[N@@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000930966519 1043978947 /nfs/dbraw/zinc/97/89/47/1043978947.db2.gz PWWXTYRMDFQUHZ-IUODEOHRSA-N 1 2 303.431 4.118 20 0 DIADLO Cc1nnsc1[C@@H](C)[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000930966519 1043978957 /nfs/dbraw/zinc/97/89/57/1043978957.db2.gz PWWXTYRMDFQUHZ-IUODEOHRSA-N 1 2 303.431 4.118 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@@H](C)c2cc3cnccc3o2)n1 ZINC000879715170 1043984460 /nfs/dbraw/zinc/98/44/60/1043984460.db2.gz QNNBOUATYBWAHY-ZDUSSCGKSA-N 1 2 312.417 4.236 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@H](C)c2cc3cnccc3o2)n1 ZINC000879715169 1043984739 /nfs/dbraw/zinc/98/47/39/1043984739.db2.gz QNNBOUATYBWAHY-CYBMUJFWSA-N 1 2 312.417 4.236 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C(C)C)s1)c1cc(C)ccc1OC ZINC000357780216 1043984865 /nfs/dbraw/zinc/98/48/65/1043984865.db2.gz VFCMDNJHCDGREI-CQSZACIVSA-N 1 2 319.474 4.219 20 0 DIADLO Fc1cc(C[NH+]2CCC3(CC3)CC2)c(F)cc1Br ZINC001141910167 1043993846 /nfs/dbraw/zinc/99/38/46/1043993846.db2.gz KVVVBVBTCGTQJZ-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO COc1ccc(C(C)(C)[NH2+]Cc2coc(C(C)(C)C)n2)cc1F ZINC000931179503 1043999968 /nfs/dbraw/zinc/99/99/68/1043999968.db2.gz IZTZWOMIKNGPLQ-UHFFFAOYSA-N 1 2 320.408 4.145 20 0 DIADLO CC(C)c1cc([C@@H]2CCC[N@H+](C/C(Cl)=C\Cl)C2)[nH]n1 ZINC000879920102 1044001436 /nfs/dbraw/zinc/00/14/36/1044001436.db2.gz WCRRWUARVPQRHK-LAPSENCUSA-N 1 2 302.249 4.032 20 0 DIADLO CC(C)c1cc([C@@H]2CCC[N@@H+](C/C(Cl)=C\Cl)C2)[nH]n1 ZINC000879920102 1044001448 /nfs/dbraw/zinc/00/14/48/1044001448.db2.gz WCRRWUARVPQRHK-LAPSENCUSA-N 1 2 302.249 4.032 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@H](F)CC2)c(F)cc1Br ZINC001141910859 1044001581 /nfs/dbraw/zinc/00/15/81/1044001581.db2.gz YXJSFWGMWKIFMN-JTQLQIEISA-N 1 2 322.168 4.051 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@H](F)CC2)c(F)cc1Br ZINC001141910859 1044001590 /nfs/dbraw/zinc/00/15/90/1044001590.db2.gz YXJSFWGMWKIFMN-JTQLQIEISA-N 1 2 322.168 4.051 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2ncc(Cl)cc2Cl)C1 ZINC000880002584 1044003976 /nfs/dbraw/zinc/00/39/76/1044003976.db2.gz MAMXEZUWBDTGSJ-LLVKDONJSA-N 1 2 313.150 4.163 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ncc(Cl)cc2Cl)C1 ZINC000880002584 1044003988 /nfs/dbraw/zinc/00/39/88/1044003988.db2.gz MAMXEZUWBDTGSJ-LLVKDONJSA-N 1 2 313.150 4.163 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2coc(-c3cccs3)n2)C1 ZINC000880001073 1044004408 /nfs/dbraw/zinc/00/44/08/1044004408.db2.gz PLMPAFOLODCJTE-ZDUSSCGKSA-N 1 2 316.348 4.177 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2coc(-c3cccs3)n2)C1 ZINC000880001073 1044004420 /nfs/dbraw/zinc/00/44/20/1044004420.db2.gz PLMPAFOLODCJTE-ZDUSSCGKSA-N 1 2 316.348 4.177 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2cc(-c3cccs3)on2)C1 ZINC000880000894 1044004919 /nfs/dbraw/zinc/00/49/19/1044004919.db2.gz ZGHVTAVHZTVMLU-CYBMUJFWSA-N 1 2 316.348 4.177 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cc(-c3cccs3)on2)C1 ZINC000880000894 1044004934 /nfs/dbraw/zinc/00/49/34/1044004934.db2.gz ZGHVTAVHZTVMLU-CYBMUJFWSA-N 1 2 316.348 4.177 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2nc(-c3cccs3)no2)s1 ZINC000561969905 1044039072 /nfs/dbraw/zinc/03/90/72/1044039072.db2.gz YBVUHNIZVUXOFY-UHFFFAOYSA-N 1 2 319.455 4.054 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2nc(-c3cccs3)no2)s1 ZINC000561969905 1044039084 /nfs/dbraw/zinc/03/90/84/1044039084.db2.gz YBVUHNIZVUXOFY-UHFFFAOYSA-N 1 2 319.455 4.054 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+][C@@H](c1cccc(F)c1)c1ccccn1 ZINC000358241792 1044039367 /nfs/dbraw/zinc/03/93/67/1044039367.db2.gz TYQDLPUPWYMWBJ-QRWLVFNGSA-N 1 2 321.399 4.364 20 0 DIADLO CC(C)c1nnc([C@H](C)[NH2+][C@H]2C[C@@H](C)Sc3sccc32)[nH]1 ZINC000358249878 1044042112 /nfs/dbraw/zinc/04/21/12/1044042112.db2.gz JSIZSZVWUDLCAE-SCVCMEIPSA-N 1 2 322.503 4.266 20 0 DIADLO CCCOc1ccc([C@@H](C)[NH2+]Cc2nnc(C(C)C)s2)cc1 ZINC000358300411 1044049663 /nfs/dbraw/zinc/04/96/63/1044049663.db2.gz OYJTVCPVQQUXLC-CYBMUJFWSA-N 1 2 319.474 4.301 20 0 DIADLO Clc1cccnc1SCc1ccc(-n2cc[nH+]c2)cc1 ZINC000358322715 1044054418 /nfs/dbraw/zinc/05/44/18/1044054418.db2.gz RZVJUHDHARTRGS-UHFFFAOYSA-N 1 2 301.802 4.213 20 0 DIADLO COc1cc2c(cc1F)C[N@H+](Cc1ccc(SC)s1)CC2 ZINC000562211812 1044085858 /nfs/dbraw/zinc/08/58/58/1044085858.db2.gz GEZFTJWPITVPQK-UHFFFAOYSA-N 1 2 323.458 4.176 20 0 DIADLO COc1cc2c(cc1F)C[N@@H+](Cc1ccc(SC)s1)CC2 ZINC000562211812 1044085873 /nfs/dbraw/zinc/08/58/73/1044085873.db2.gz GEZFTJWPITVPQK-UHFFFAOYSA-N 1 2 323.458 4.176 20 0 DIADLO CCCCc1nc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)cs1 ZINC000358835537 1044103552 /nfs/dbraw/zinc/10/35/52/1044103552.db2.gz YNMPTSRLUFMBDM-WMLDXEAASA-N 1 2 315.486 4.464 20 0 DIADLO CCCCc1nc(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)cs1 ZINC000358835537 1044103554 /nfs/dbraw/zinc/10/35/54/1044103554.db2.gz YNMPTSRLUFMBDM-WMLDXEAASA-N 1 2 315.486 4.464 20 0 DIADLO Fc1ccc(C[N@@H+]2CCc3cc(-c4ccccc4)oc3C2)nc1 ZINC000346470162 1044106502 /nfs/dbraw/zinc/10/65/02/1044106502.db2.gz NEKCJRBANIJUGB-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1ccc(C[N@H+]2CCc3cc(-c4ccccc4)oc3C2)nc1 ZINC000346470162 1044106509 /nfs/dbraw/zinc/10/65/09/1044106509.db2.gz NEKCJRBANIJUGB-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO CCCCn1cc(C[NH2+][C@@H](C)c2csc(C(C)C)n2)c(C)n1 ZINC000346520432 1044110576 /nfs/dbraw/zinc/11/05/76/1044110576.db2.gz IJIMLOZFTCXUIQ-AWEZNQCLSA-N 1 2 320.506 4.422 20 0 DIADLO Cc1ccccc1-c1cnc(C[NH2+][C@H](c2ccccn2)C2CC2)o1 ZINC000932380815 1044122137 /nfs/dbraw/zinc/12/21/37/1044122137.db2.gz WQJAFSSLPXJQRB-FQEVSTJZSA-N 1 2 319.408 4.286 20 0 DIADLO FC(F)c1ccc(C[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)cc1 ZINC000292110979 1044137504 /nfs/dbraw/zinc/13/75/04/1044137504.db2.gz KFECHLGVWHYWIF-HNNXBMFYSA-N 1 2 320.387 4.154 20 0 DIADLO C[C@H](CCNc1ccccc1C[NH+]1CCOCC1)c1ccccc1 ZINC000562612817 1044137505 /nfs/dbraw/zinc/13/75/05/1044137505.db2.gz OCVKWFZMJIOUAC-GOSISDBHSA-N 1 2 324.468 4.125 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2C)n1 ZINC000932566043 1044143755 /nfs/dbraw/zinc/14/37/55/1044143755.db2.gz XPHLQYIPWABFCE-QWHCGFSZSA-N 1 2 305.397 4.272 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@@H](C)c2ccc(OC)c(C)c2)n1 ZINC000932576309 1044146241 /nfs/dbraw/zinc/14/62/41/1044146241.db2.gz QFPKEOSHHVPZDC-UONOGXRCSA-N 1 2 317.433 4.141 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H](C)c3cc4ccccc4o3)cc2[nH+]1 ZINC000359306972 1044152404 /nfs/dbraw/zinc/15/24/04/1044152404.db2.gz NRKNEUAQMBMHPD-NSHDSACASA-N 1 2 319.364 4.360 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2cnc(C(F)(F)F)s2)CC1 ZINC000444006185 1044152540 /nfs/dbraw/zinc/15/25/40/1044152540.db2.gz WIAYFRWLIVCRNV-UHFFFAOYSA-N 1 2 316.323 4.080 20 0 DIADLO Cc1oc2ccccc2c1C[NH2+][C@@H](c1nnc[nH]1)C1CCCCC1 ZINC000292287222 1044158462 /nfs/dbraw/zinc/15/84/62/1044158462.db2.gz VAJPAAMZCBLEJD-GOSISDBHSA-N 1 2 324.428 4.271 20 0 DIADLO CC(C)[N@H+](Cc1ncnn1C(C)(C)C)[C@@H](C)c1ccccc1 ZINC000292276515 1044158568 /nfs/dbraw/zinc/15/85/68/1044158568.db2.gz SOGMYRGZSRIBIF-HNNXBMFYSA-N 1 2 300.450 4.005 20 0 DIADLO CC(C)[N@@H+](Cc1ncnn1C(C)(C)C)[C@@H](C)c1ccccc1 ZINC000292276515 1044158572 /nfs/dbraw/zinc/15/85/72/1044158572.db2.gz SOGMYRGZSRIBIF-HNNXBMFYSA-N 1 2 300.450 4.005 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000359423341 1044165626 /nfs/dbraw/zinc/16/56/26/1044165626.db2.gz VQDSLJTYNWNCOE-UHFFFAOYSA-N 1 2 321.380 4.223 20 0 DIADLO CC(C)n1cnnc1C[N@H+](C)[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000292368553 1044166193 /nfs/dbraw/zinc/16/61/93/1044166193.db2.gz IRIMOAFEHQYRET-HNNXBMFYSA-N 1 2 314.477 4.350 20 0 DIADLO CC(C)n1cnnc1C[N@@H+](C)[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000292368553 1044166199 /nfs/dbraw/zinc/16/61/99/1044166199.db2.gz IRIMOAFEHQYRET-HNNXBMFYSA-N 1 2 314.477 4.350 20 0 DIADLO CC(C)n1cnnc1C[N@H+](C)[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000292368556 1044166212 /nfs/dbraw/zinc/16/62/12/1044166212.db2.gz IRIMOAFEHQYRET-OAHLLOKOSA-N 1 2 314.477 4.350 20 0 DIADLO CC(C)n1cnnc1C[N@@H+](C)[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000292368556 1044166214 /nfs/dbraw/zinc/16/62/14/1044166214.db2.gz IRIMOAFEHQYRET-OAHLLOKOSA-N 1 2 314.477 4.350 20 0 DIADLO Fc1cccc(-c2cnc(C[N@@H+]3CCC[C@H]3c3cccnc3)o2)c1 ZINC000346965175 1044177616 /nfs/dbraw/zinc/17/76/16/1044177616.db2.gz BEDKYIBMSIQKLU-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1cccc(-c2cnc(C[N@H+]3CCC[C@H]3c3cccnc3)o2)c1 ZINC000346965175 1044177622 /nfs/dbraw/zinc/17/76/22/1044177622.db2.gz BEDKYIBMSIQKLU-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO c1oc(-c2ccccc2)nc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000346966946 1044178065 /nfs/dbraw/zinc/17/80/65/1044178065.db2.gz KFDXZDAUQZADHQ-GOSISDBHSA-N 1 2 305.381 4.074 20 0 DIADLO c1oc(-c2ccccc2)nc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000346966946 1044178072 /nfs/dbraw/zinc/17/80/72/1044178072.db2.gz KFDXZDAUQZADHQ-GOSISDBHSA-N 1 2 305.381 4.074 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCC[C@@H]3c3cccnc3)cs2)co1 ZINC000346999296 1044179392 /nfs/dbraw/zinc/17/93/92/1044179392.db2.gz QCENOOAGPIZZAJ-MRXNPFEDSA-N 1 2 311.410 4.135 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCC[C@@H]3c3cccnc3)cs2)co1 ZINC000346999296 1044179398 /nfs/dbraw/zinc/17/93/98/1044179398.db2.gz QCENOOAGPIZZAJ-MRXNPFEDSA-N 1 2 311.410 4.135 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)s1 ZINC000346975871 1044180049 /nfs/dbraw/zinc/18/00/49/1044180049.db2.gz QDIOBCZBELTRDT-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@@H]2c2cccnc2)s1 ZINC000346975871 1044180056 /nfs/dbraw/zinc/18/00/56/1044180056.db2.gz QDIOBCZBELTRDT-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC[C@H]2c2cccnc2)cs1 ZINC000346982891 1044180420 /nfs/dbraw/zinc/18/04/20/1044180420.db2.gz OJZQQJYGXXSUHQ-KRWDZBQOSA-N 1 2 315.486 4.464 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC[C@H]2c2cccnc2)cs1 ZINC000346982891 1044180426 /nfs/dbraw/zinc/18/04/26/1044180426.db2.gz OJZQQJYGXXSUHQ-KRWDZBQOSA-N 1 2 315.486 4.464 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@@H]2c2cccnc2)cs1 ZINC000346991791 1044182686 /nfs/dbraw/zinc/18/26/86/1044182686.db2.gz XMFOREPJAFABTH-MRXNPFEDSA-N 1 2 301.459 4.218 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@@H]2c2cccnc2)cs1 ZINC000346991791 1044182679 /nfs/dbraw/zinc/18/26/79/1044182679.db2.gz XMFOREPJAFABTH-MRXNPFEDSA-N 1 2 301.459 4.218 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nncn1C(C)C ZINC000292550999 1044182971 /nfs/dbraw/zinc/18/29/71/1044182971.db2.gz YONQQOJEYDWSSY-HNNXBMFYSA-N 1 2 306.841 4.096 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nncn1C(C)C ZINC000292550999 1044182977 /nfs/dbraw/zinc/18/29/77/1044182977.db2.gz YONQQOJEYDWSSY-HNNXBMFYSA-N 1 2 306.841 4.096 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@@H](c3cncc(F)c3)C3CC3)ccc21 ZINC000281759419 1044189095 /nfs/dbraw/zinc/18/90/95/1044189095.db2.gz WGYBXAWIQYNURS-LJQANCHMSA-N 1 2 311.404 4.166 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@@H](c3cncc(F)c3)C3CC3)ccc21 ZINC000281759419 1044189100 /nfs/dbraw/zinc/18/91/00/1044189100.db2.gz WGYBXAWIQYNURS-LJQANCHMSA-N 1 2 311.404 4.166 20 0 DIADLO CC1CCC(CC(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)CC1 ZINC000359694701 1044191663 /nfs/dbraw/zinc/19/16/63/1044191663.db2.gz LZQPMMLDAWMPQX-UHFFFAOYSA-N 1 2 315.392 4.166 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2ccsc2Cl)sc1C ZINC000359735411 1044194616 /nfs/dbraw/zinc/19/46/16/1044194616.db2.gz YGYWRQQVOUPFHG-UHFFFAOYSA-N 1 2 300.880 4.500 20 0 DIADLO Clc1nc2ccccn2c1C[N@H+](Cc1cccs1)C1CC1 ZINC000130238432 1044195253 /nfs/dbraw/zinc/19/52/53/1044195253.db2.gz GTUYOIQSOMHWGB-UHFFFAOYSA-N 1 2 317.845 4.214 20 0 DIADLO Clc1nc2ccccn2c1C[N@@H+](Cc1cccs1)C1CC1 ZINC000130238432 1044195256 /nfs/dbraw/zinc/19/52/56/1044195256.db2.gz GTUYOIQSOMHWGB-UHFFFAOYSA-N 1 2 317.845 4.214 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@H+](C)Cc1cccc(=O)[nH]1 ZINC000933397614 1044196528 /nfs/dbraw/zinc/19/65/28/1044196528.db2.gz FWPNRNPJVJCMJQ-JTQLQIEISA-N 1 2 311.212 4.287 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@@H+](C)Cc1cccc(=O)[nH]1 ZINC000933397614 1044196533 /nfs/dbraw/zinc/19/65/33/1044196533.db2.gz FWPNRNPJVJCMJQ-JTQLQIEISA-N 1 2 311.212 4.287 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+]Cc1nc(C(C)C)c[nH]1 ZINC000883037699 1044215879 /nfs/dbraw/zinc/21/58/79/1044215879.db2.gz ICSUYYRJZTYUNA-OAHLLOKOSA-N 1 2 315.461 4.309 20 0 DIADLO Cc1ccc2[nH]c(C(=O)Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2c1 ZINC000522864326 1044227338 /nfs/dbraw/zinc/22/73/38/1044227338.db2.gz KWZFQWYCVCVGNG-UHFFFAOYSA-N 1 2 316.364 4.119 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+][C@H](C)c1cncs1 ZINC000934201342 1044231613 /nfs/dbraw/zinc/23/16/13/1044231613.db2.gz REQHIXTYGDPMQO-SECBINFHSA-N 1 2 305.428 4.019 20 0 DIADLO CC[C@H]([NH2+]Cc1csc(N(C)C)n1)c1sccc1Cl ZINC000883195266 1044232374 /nfs/dbraw/zinc/23/23/74/1044232374.db2.gz OUGNYTBFHPLWIE-NSHDSACASA-N 1 2 315.895 4.165 20 0 DIADLO Cc1nnsc1C[N@@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC000563218832 1044233576 /nfs/dbraw/zinc/23/35/76/1044233576.db2.gz XDIYVXREYVKBJB-AWEZNQCLSA-N 1 2 307.850 4.227 20 0 DIADLO Cc1nnsc1C[N@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC000563218832 1044233589 /nfs/dbraw/zinc/23/35/89/1044233589.db2.gz XDIYVXREYVKBJB-AWEZNQCLSA-N 1 2 307.850 4.227 20 0 DIADLO CCCCc1nc(COc2ccccc2-n2cc[nH+]c2)cs1 ZINC000522891559 1044235205 /nfs/dbraw/zinc/23/52/05/1044235205.db2.gz LXFSKHSVYDOZTP-UHFFFAOYSA-N 1 2 313.426 4.250 20 0 DIADLO c1cn(-c2ccccc2OCc2coc(-c3ccccc3)n2)c[nH+]1 ZINC000522893265 1044237250 /nfs/dbraw/zinc/23/72/50/1044237250.db2.gz FVXCTMXMCUXNCD-UHFFFAOYSA-N 1 2 317.348 4.106 20 0 DIADLO COc1ccc(C2CC2)cc1C[NH2+]Cc1ncc(C(C)C)s1 ZINC000883258365 1044248557 /nfs/dbraw/zinc/24/85/57/1044248557.db2.gz YKKFROMTADLVGL-UHFFFAOYSA-N 1 2 316.470 4.442 20 0 DIADLO COc1ccc(C2CC2)cc1C[NH2+][C@H](C)c1nc(C)sc1C ZINC000883265681 1044252177 /nfs/dbraw/zinc/25/21/77/1044252177.db2.gz HUTRJKNSUGAZCY-LLVKDONJSA-N 1 2 316.470 4.497 20 0 DIADLO COc1ccc(C2CC2)cc1C[NH2+][C@H]1CCCc2scnc21 ZINC000883266582 1044254310 /nfs/dbraw/zinc/25/43/10/1044254310.db2.gz DQCNHSUZHNKPRX-HNNXBMFYSA-N 1 2 314.454 4.196 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2coc3cc(F)ccc23)c(C)[nH+]1 ZINC000360329416 1044260506 /nfs/dbraw/zinc/26/05/06/1044260506.db2.gz MUDHPWUJKHOMPT-UHFFFAOYSA-N 1 2 312.344 4.073 20 0 DIADLO Cc1ccc(C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)c(Cl)n1 ZINC000883301737 1044263985 /nfs/dbraw/zinc/26/39/85/1044263985.db2.gz HRSVYBLNBJPWNX-HNNXBMFYSA-N 1 2 318.852 4.178 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2ccc(Cl)cc2F)s1 ZINC000293320885 1044270441 /nfs/dbraw/zinc/27/04/41/1044270441.db2.gz QYIUNRUUJBLAAV-UHFFFAOYSA-N 1 2 316.854 4.088 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)[nH]1 ZINC000293383913 1044278893 /nfs/dbraw/zinc/27/88/93/1044278893.db2.gz ZYAOWMBYBITCJW-HNNXBMFYSA-N 1 2 322.403 4.083 20 0 DIADLO C[C@H]([NH2+][C@H]1c2ccccc2CC[C@H]1F)c1cccnc1Cl ZINC000883375953 1044287433 /nfs/dbraw/zinc/28/74/33/1044287433.db2.gz CJCWHRTTXOQQRY-XZJROXQQSA-N 1 2 304.796 4.411 20 0 DIADLO FCc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)cc1 ZINC000778280082 1044290841 /nfs/dbraw/zinc/29/08/41/1044290841.db2.gz GOJNRHWNCRKWAH-GOSISDBHSA-N 1 2 321.342 4.008 20 0 DIADLO FCc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)cc1 ZINC000778280082 1044290852 /nfs/dbraw/zinc/29/08/52/1044290852.db2.gz GOJNRHWNCRKWAH-GOSISDBHSA-N 1 2 321.342 4.008 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@H]1[NH2+]Cc1cnc(C2CC2)s1 ZINC000883382962 1044295511 /nfs/dbraw/zinc/29/55/11/1044295511.db2.gz QSGFAZMAWYGLNU-HZPDHXFCSA-N 1 2 302.418 4.136 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+]2CC=C(c3cccc(Cl)c3)CC2)o1 ZINC000360725510 1044305810 /nfs/dbraw/zinc/30/58/10/1044305810.db2.gz LGDXULCVDABWOX-GFCCVEGCSA-N 1 2 317.820 4.136 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)o1 ZINC000360725510 1044305823 /nfs/dbraw/zinc/30/58/23/1044305823.db2.gz LGDXULCVDABWOX-GFCCVEGCSA-N 1 2 317.820 4.136 20 0 DIADLO CC1(C)Nc2ccccc2[C@@H]1[NH2+]Cc1c(Cl)cncc1Cl ZINC000883464738 1044310162 /nfs/dbraw/zinc/31/01/62/1044310162.db2.gz VIKABRXGVSZTRI-HNNXBMFYSA-N 1 2 322.239 4.423 20 0 DIADLO CCc1nc(C(C)C)ccc1C[NH2+][C@H](C)c1c(F)cncc1F ZINC000293676306 1044312567 /nfs/dbraw/zinc/31/25/67/1044312567.db2.gz VCYYILJPSDWCSU-GFCCVEGCSA-N 1 2 319.399 4.291 20 0 DIADLO CC[C@](C)([NH2+]Cc1cccc(O)c1Cl)c1nc(C)cs1 ZINC000293694108 1044314826 /nfs/dbraw/zinc/31/48/26/1044314826.db2.gz WNBTVWQHADBYFL-HNNXBMFYSA-N 1 2 310.850 4.226 20 0 DIADLO Cc1ccc2c(Nc3cncc(Br)c3)cccc2[nH+]1 ZINC001212794867 1044315065 /nfs/dbraw/zinc/31/50/65/1044315065.db2.gz AKYYZNOQSULSFS-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO CCC[NH+](CCC)Cn1nc(-c2ccccc2C)oc1=S ZINC000935193421 1044318389 /nfs/dbraw/zinc/31/83/89/1044318389.db2.gz SZUAYSAHPLLUSS-UHFFFAOYSA-N 1 2 305.447 4.261 20 0 DIADLO Cc1ccc2c(Nc3cnc4cc(C5CC5)nn4c3)cccc2[nH+]1 ZINC001212796297 1044325755 /nfs/dbraw/zinc/32/57/55/1044325755.db2.gz WTBJEMBONWTYTG-UHFFFAOYSA-N 1 2 315.380 4.207 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)cn1 ZINC000360974958 1044340052 /nfs/dbraw/zinc/34/00/52/1044340052.db2.gz LCUJNVWNLMXYQA-GOSISDBHSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)cn1 ZINC000360974958 1044340069 /nfs/dbraw/zinc/34/00/69/1044340069.db2.gz LCUJNVWNLMXYQA-GOSISDBHSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1ccc2c(Nc3ccccc3-n3ccnc3)cccc2[nH+]1 ZINC001212796904 1044349110 /nfs/dbraw/zinc/34/91/10/1044349110.db2.gz LTVGHSLHXHKWJO-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO Cc1nc(N[C@H](COCc2ccccc2)c2ccccc2)cc[nH+]1 ZINC000361043036 1044351920 /nfs/dbraw/zinc/35/19/20/1044351920.db2.gz DPBITGBEYLTOHD-LJQANCHMSA-N 1 2 319.408 4.155 20 0 DIADLO C[C@H](c1nnc(-c2ccccc2)o1)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000361075512 1044355822 /nfs/dbraw/zinc/35/58/22/1044355822.db2.gz ZHZMXNJKYOAWKF-UONOGXRCSA-N 1 2 305.381 4.374 20 0 DIADLO C[C@H](c1nnc(-c2ccccc2)o1)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000361075512 1044355835 /nfs/dbraw/zinc/35/58/35/1044355835.db2.gz ZHZMXNJKYOAWKF-UONOGXRCSA-N 1 2 305.381 4.374 20 0 DIADLO Cc1ccc2c(Nc3ccc(OC4COC4)c(F)c3)cccc2[nH+]1 ZINC001212797760 1044369886 /nfs/dbraw/zinc/36/98/86/1044369886.db2.gz IMQSDAIYJLYHKT-UHFFFAOYSA-N 1 2 324.355 4.204 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ncc(CSC)s1 ZINC000294077128 1044376333 /nfs/dbraw/zinc/37/63/33/1044376333.db2.gz LCNWIMAOCIFRAA-LBPRGKRZSA-N 1 2 322.499 4.174 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@H]2CCOc3c(F)ccc(F)c32)o1 ZINC000361236897 1044376878 /nfs/dbraw/zinc/37/68/78/1044376878.db2.gz MDLNNJJNBWFUAR-HCKVZZMMSA-N 1 2 319.351 4.295 20 0 DIADLO CC[C@@H]1C[C@H](CNc2ccc(-n3c[nH+]c(C)c3C)cc2)CCO1 ZINC000361252158 1044380812 /nfs/dbraw/zinc/38/08/12/1044380812.db2.gz PXYLSDZGVYCPHC-VQIMIIECSA-N 1 2 313.445 4.106 20 0 DIADLO FC(F)(F)c1cncc(C[N@@H+]2CCC[C@H]2c2ccsc2)c1 ZINC000361300581 1044387193 /nfs/dbraw/zinc/38/71/93/1044387193.db2.gz SBLVBLNLSFZCMH-AWEZNQCLSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cncc(C[N@H+]2CCC[C@H]2c2ccsc2)c1 ZINC000361300581 1044387206 /nfs/dbraw/zinc/38/72/06/1044387206.db2.gz SBLVBLNLSFZCMH-AWEZNQCLSA-N 1 2 312.360 4.499 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2nc(C3CCC3)no2)C2CC2)cc1 ZINC000639561386 1044395103 /nfs/dbraw/zinc/39/51/03/1044395103.db2.gz GNKUVVRGLZQWHM-INIZCTEOSA-N 1 2 317.820 4.231 20 0 DIADLO Fc1ccc([C@@H]2C[C@H]2Nc2cc(-c3ccncc3)cc[nH+]2)cc1F ZINC001168064422 1044395470 /nfs/dbraw/zinc/39/54/70/1044395470.db2.gz AWJRAGFGUWBELV-MAUKXSAKSA-N 1 2 323.346 4.390 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](Cc1ccccc1)Cc1ncccn1 ZINC000361402059 1044401554 /nfs/dbraw/zinc/40/15/54/1044401554.db2.gz GEYMMQWUSMLKTM-KRWDZBQOSA-N 1 2 303.409 4.240 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1)Cc1ncccn1 ZINC000361402059 1044401560 /nfs/dbraw/zinc/40/15/60/1044401560.db2.gz GEYMMQWUSMLKTM-KRWDZBQOSA-N 1 2 303.409 4.240 20 0 DIADLO COc1nc2ccccc2cc1C[N@@H+]1Cc2cccc(C)c2C1 ZINC001137201462 1044407930 /nfs/dbraw/zinc/40/79/30/1044407930.db2.gz XWILQDBXGRGBGJ-UHFFFAOYSA-N 1 2 304.393 4.068 20 0 DIADLO COc1nc2ccccc2cc1C[N@H+]1Cc2cccc(C)c2C1 ZINC001137201462 1044407935 /nfs/dbraw/zinc/40/79/35/1044407935.db2.gz XWILQDBXGRGBGJ-UHFFFAOYSA-N 1 2 304.393 4.068 20 0 DIADLO COc1ccncc1C[NH2+][C@H](C)c1cc(Cl)sc1Cl ZINC000294364603 1044412585 /nfs/dbraw/zinc/41/25/85/1044412585.db2.gz QPFLBCVJUPIKDC-MRVPVSSYSA-N 1 2 317.241 4.309 20 0 DIADLO CC(C)n1ccnc1C[N@H+](C)[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000361579957 1044420340 /nfs/dbraw/zinc/42/03/40/1044420340.db2.gz YLSVEALRQPWTCO-QWHCGFSZSA-N 1 2 303.372 4.017 20 0 DIADLO CC(C)n1ccnc1C[N@@H+](C)[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000361579957 1044420348 /nfs/dbraw/zinc/42/03/48/1044420348.db2.gz YLSVEALRQPWTCO-QWHCGFSZSA-N 1 2 303.372 4.017 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1nccn1-c1ccccc1 ZINC000361607660 1044424275 /nfs/dbraw/zinc/42/42/75/1044424275.db2.gz DAOAEFGRWMXEFK-DZGCQCFKSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1nccn1-c1ccccc1 ZINC000361607660 1044424284 /nfs/dbraw/zinc/42/42/84/1044424284.db2.gz DAOAEFGRWMXEFK-DZGCQCFKSA-N 1 2 323.362 4.035 20 0 DIADLO CCC[C@@](C)(CC)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000565447598 1044434659 /nfs/dbraw/zinc/43/46/59/1044434659.db2.gz LEIQNDRCSWZUKH-LJQANCHMSA-N 1 2 324.428 4.449 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1ccc([NH+]3CCCC3)cc1)CC2 ZINC000320864776 1044451221 /nfs/dbraw/zinc/45/12/21/1044451221.db2.gz YOSIUWKKXYIELH-FQEVSTJZSA-N 1 2 308.425 4.395 20 0 DIADLO Cc1ccc2c(Nc3cc(F)cc(F)c3CO)cccc2[nH+]1 ZINC001212798769 1044451826 /nfs/dbraw/zinc/45/18/26/1044451826.db2.gz ROYLZNGSRUFCMV-UHFFFAOYSA-N 1 2 300.308 4.057 20 0 DIADLO c1cn(Cc2ccc(-c3nc(C4CCCCC4)no3)cc2)c[nH+]1 ZINC000113712113 1044453618 /nfs/dbraw/zinc/45/36/18/1044453618.db2.gz XIDWSCCDVYKSLZ-UHFFFAOYSA-N 1 2 308.385 4.029 20 0 DIADLO CCCc1nc(C[N@H+](C)[C@H]2CCCc3nc(C)sc32)cs1 ZINC000114722417 1044456661 /nfs/dbraw/zinc/45/66/61/1044456661.db2.gz PLRMNIMZHRLFMI-AWEZNQCLSA-N 1 2 321.515 4.370 20 0 DIADLO CCCc1nc(C[N@@H+](C)[C@H]2CCCc3nc(C)sc32)cs1 ZINC000114722417 1044456667 /nfs/dbraw/zinc/45/66/67/1044456667.db2.gz PLRMNIMZHRLFMI-AWEZNQCLSA-N 1 2 321.515 4.370 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)n1 ZINC000114745680 1044459626 /nfs/dbraw/zinc/45/96/26/1044459626.db2.gz AEEIUDSZDGMWTA-NXEZZACHSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1ccccc1[C@H](NC(=O)C[C@H](C)n1cc[nH+]c1)C(C)(C)C ZINC000565894568 1044461756 /nfs/dbraw/zinc/46/17/56/1044461756.db2.gz KALFWOTYGHUFEM-YJBOKZPZSA-N 1 2 313.445 4.046 20 0 DIADLO CC(C)c1nnc(C[NH2+]C(C)(C)c2ccc(Cl)cc2)s1 ZINC000294862065 1044466624 /nfs/dbraw/zinc/46/66/24/1044466624.db2.gz DFLBQECIRDJIJL-UHFFFAOYSA-N 1 2 309.866 4.340 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000294894130 1044468665 /nfs/dbraw/zinc/46/86/65/1044468665.db2.gz GOQVYXYALANADB-OAQYLSRUSA-N 1 2 321.873 4.018 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000294894130 1044468671 /nfs/dbraw/zinc/46/86/71/1044468671.db2.gz GOQVYXYALANADB-OAQYLSRUSA-N 1 2 321.873 4.018 20 0 DIADLO CC(C)C[C@@H](c1nc([C@H](C)c2cccs2)no1)n1cc[nH+]c1 ZINC000923907058 1044472993 /nfs/dbraw/zinc/47/29/93/1044472993.db2.gz LOWHFNKAYXGXKF-OLZOCXBDSA-N 1 2 316.430 4.115 20 0 DIADLO Cc1nnc(C[N@@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000117346608 1044477996 /nfs/dbraw/zinc/47/79/96/1044477996.db2.gz BVCJESMKIHOQSH-OAHLLOKOSA-N 1 2 305.809 4.149 20 0 DIADLO Cc1nnc(C[N@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000117346608 1044478000 /nfs/dbraw/zinc/47/80/00/1044478000.db2.gz BVCJESMKIHOQSH-OAHLLOKOSA-N 1 2 305.809 4.149 20 0 DIADLO Cc1ccc(C[N@@H+](CC(=O)OCc2ccccc2)C(C)C)s1 ZINC000303396801 1044485678 /nfs/dbraw/zinc/48/56/78/1044485678.db2.gz PUVDMLXDINPXID-UHFFFAOYSA-N 1 2 317.454 4.010 20 0 DIADLO Cc1ccc(C[N@H+](CC(=O)OCc2ccccc2)C(C)C)s1 ZINC000303396801 1044485685 /nfs/dbraw/zinc/48/56/85/1044485685.db2.gz PUVDMLXDINPXID-UHFFFAOYSA-N 1 2 317.454 4.010 20 0 DIADLO FC(F)(F)c1cnc(C[NH2+]Cc2ccc(C3CCC3)cc2)nc1 ZINC000295068164 1044486025 /nfs/dbraw/zinc/48/60/25/1044486025.db2.gz QTUGJHVFCYRACE-UHFFFAOYSA-N 1 2 321.346 4.053 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nccn1-c1ccccc1)c1ccc(F)cn1 ZINC000348313230 1044490382 /nfs/dbraw/zinc/49/03/82/1044490382.db2.gz GNNMUMHZZWMPEO-YOEHRIQHSA-N 1 2 324.403 4.208 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1cccc2ccsc21 ZINC000362229939 1044491904 /nfs/dbraw/zinc/49/19/04/1044491904.db2.gz JEMXCUWUIUOMSE-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO CC[C@H](CC(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C)C(C)(C)C ZINC001625947107 1044502038 /nfs/dbraw/zinc/50/20/38/1044502038.db2.gz VTGJOFHMGNRIFP-OAHLLOKOSA-N 1 2 320.477 4.128 20 0 DIADLO CC(C)[N@H+](Cc1cc(-c2ccccc2)on1)Cc1cccnc1 ZINC000348320132 1044508474 /nfs/dbraw/zinc/50/84/74/1044508474.db2.gz MOJYFJHXSUOKEL-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO CC(C)[N@@H+](Cc1cc(-c2ccccc2)on1)Cc1cccnc1 ZINC000348320132 1044508490 /nfs/dbraw/zinc/50/84/90/1044508490.db2.gz MOJYFJHXSUOKEL-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2cn3ccsc3n2)o1 ZINC000362436302 1044509847 /nfs/dbraw/zinc/50/98/47/1044509847.db2.gz ZWXPYRHYPLLPGT-DOMZBBRYSA-N 1 2 315.442 4.270 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2cn3ccsc3n2)o1 ZINC000362436302 1044509853 /nfs/dbraw/zinc/50/98/53/1044509853.db2.gz ZWXPYRHYPLLPGT-DOMZBBRYSA-N 1 2 315.442 4.270 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@@H](C)c2cccc3ccccc32)n1 ZINC000120866467 1044515938 /nfs/dbraw/zinc/51/59/38/1044515938.db2.gz YEXOYMGTGXVOBA-AWEZNQCLSA-N 1 2 309.413 4.272 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(CC(C)C)no1)c1ccc(Cl)cc1 ZINC000121005960 1044518445 /nfs/dbraw/zinc/51/84/45/1044518445.db2.gz WOACTHDUUYHRRF-CQSZACIVSA-N 1 2 307.825 4.162 20 0 DIADLO Cc1csc(C[NH+]2CCC(c3c(F)cccc3F)CC2)n1 ZINC000362525086 1044524120 /nfs/dbraw/zinc/52/41/20/1044524120.db2.gz LBLMTPQLPOTPIF-UHFFFAOYSA-N 1 2 308.397 4.109 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2ncc(C)s2)c2cccnc2)cc1 ZINC000925153805 1044539736 /nfs/dbraw/zinc/53/97/36/1044539736.db2.gz VOTGGUKXIPRHAN-LJQANCHMSA-N 1 2 323.465 4.288 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+]2CCC=C(c3cccnc3)C2)n1 ZINC000295692650 1044552302 /nfs/dbraw/zinc/55/23/02/1044552302.db2.gz DNPYGUYUPQQWFM-UHFFFAOYSA-N 1 2 313.470 4.125 20 0 DIADLO CC(C)(C)c1csc(C[N@H+]2CCC=C(c3cccnc3)C2)n1 ZINC000295692650 1044552318 /nfs/dbraw/zinc/55/23/18/1044552318.db2.gz DNPYGUYUPQQWFM-UHFFFAOYSA-N 1 2 313.470 4.125 20 0 DIADLO O=C(CCC1CCC1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000362996528 1044573796 /nfs/dbraw/zinc/57/37/96/1044573796.db2.gz KGUNTFUFHHWYEF-UHFFFAOYSA-N 1 2 303.793 4.045 20 0 DIADLO c1nc(C2CC2)c(C[N@@H+]2CCCn3c(cc4ccccc43)C2)s1 ZINC000567651362 1044578702 /nfs/dbraw/zinc/57/87/02/1044578702.db2.gz SFNJNDXETXHBEZ-UHFFFAOYSA-N 1 2 323.465 4.381 20 0 DIADLO c1nc(C2CC2)c(C[N@H+]2CCCn3c(cc4ccccc43)C2)s1 ZINC000567651362 1044578714 /nfs/dbraw/zinc/57/87/14/1044578714.db2.gz SFNJNDXETXHBEZ-UHFFFAOYSA-N 1 2 323.465 4.381 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CC[C@@H]3CCC[C@H]3C2)c(C)[nH+]1 ZINC000567849578 1044586961 /nfs/dbraw/zinc/58/69/61/1044586961.db2.gz JQDWICVOOQNEMQ-HRCADAONSA-N 1 2 301.434 4.097 20 0 DIADLO c1csc(CCNc2cccc3c2CN(c2cccc[nH+]2)C3)c1 ZINC000778613880 1044588817 /nfs/dbraw/zinc/58/88/17/1044588817.db2.gz RPBVRGBIYOJUPS-UHFFFAOYSA-N 1 2 321.449 4.318 20 0 DIADLO CCn1cc([C@@H](C)[NH2+]Cc2nc(C3CCCCC3)cs2)cn1 ZINC000296143257 1044594912 /nfs/dbraw/zinc/59/49/12/1044594912.db2.gz RYWBRYYSAPINRG-CYBMUJFWSA-N 1 2 318.490 4.258 20 0 DIADLO CC(C)c1nnc(C[N@H+](C)[C@@H]2CCCc3ccccc32)s1 ZINC000568025222 1044596144 /nfs/dbraw/zinc/59/61/44/1044596144.db2.gz GRNUGNLXPVKGJJ-OAHLLOKOSA-N 1 2 301.459 4.171 20 0 DIADLO CC(C)c1nnc(C[N@@H+](C)[C@@H]2CCCc3ccccc32)s1 ZINC000568025222 1044596160 /nfs/dbraw/zinc/59/61/60/1044596160.db2.gz GRNUGNLXPVKGJJ-OAHLLOKOSA-N 1 2 301.459 4.171 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2csc(-c3ccccn3)n2)c1 ZINC000444715044 1044603301 /nfs/dbraw/zinc/60/33/01/1044603301.db2.gz LLEYHDYXXJRAOP-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2csc(-c3ccccn3)n2)c1 ZINC000444715044 1044603305 /nfs/dbraw/zinc/60/33/05/1044603305.db2.gz LLEYHDYXXJRAOP-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)cs1 ZINC000444689199 1044603348 /nfs/dbraw/zinc/60/33/48/1044603348.db2.gz FMDCIIUUFRISLA-QWRGUYRKSA-N 1 2 322.396 4.015 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)cs1 ZINC000444689199 1044603352 /nfs/dbraw/zinc/60/33/52/1044603352.db2.gz FMDCIIUUFRISLA-QWRGUYRKSA-N 1 2 322.396 4.015 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2csc(Cl)n2)cc1 ZINC000296256226 1044603704 /nfs/dbraw/zinc/60/37/04/1044603704.db2.gz JDEBHEHQLLTTNF-LLVKDONJSA-N 1 2 310.850 4.435 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+](C)Cc1cc(F)cc(F)c1 ZINC000444693882 1044605432 /nfs/dbraw/zinc/60/54/32/1044605432.db2.gz AWBOEOVPJSMCNO-LLVKDONJSA-N 1 2 302.324 4.299 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+](C)Cc1cc(F)cc(F)c1 ZINC000444693882 1044605439 /nfs/dbraw/zinc/60/54/39/1044605439.db2.gz AWBOEOVPJSMCNO-LLVKDONJSA-N 1 2 302.324 4.299 20 0 DIADLO CCCc1csc(C[NH2+][C@H](CC)c2nc3ccccc3[nH]2)n1 ZINC000568236837 1044611681 /nfs/dbraw/zinc/61/16/81/1044611681.db2.gz WAWLAOJFGXAZHE-CYBMUJFWSA-N 1 2 314.458 4.213 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2csc(Cl)n2)c1 ZINC000296366179 1044612833 /nfs/dbraw/zinc/61/28/33/1044612833.db2.gz SGOLYWGHIQSVQI-LLVKDONJSA-N 1 2 310.850 4.435 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2csc(-c3ccco3)n2)ccc1F ZINC000444740684 1044616433 /nfs/dbraw/zinc/61/64/33/1044616433.db2.gz CBLNIYSNGTVPFC-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2csc(-c3ccco3)n2)ccc1F ZINC000444740684 1044616438 /nfs/dbraw/zinc/61/64/38/1044616438.db2.gz CBLNIYSNGTVPFC-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Clc1cccc2ccc(C[N@@H+]3CCC[C@@H]3c3cnccn3)nc12 ZINC001137225987 1044622787 /nfs/dbraw/zinc/62/27/87/1044622787.db2.gz JJKLBWYVHVYUNG-QGZVFWFLSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1cccc2ccc(C[N@H+]3CCC[C@@H]3c3cnccn3)nc12 ZINC001137225987 1044622790 /nfs/dbraw/zinc/62/27/90/1044622790.db2.gz JJKLBWYVHVYUNG-QGZVFWFLSA-N 1 2 324.815 4.015 20 0 DIADLO CC(C)c1ccc(-c2ncc(C[N@@H+]3CCOC[C@H]3C)s2)cc1 ZINC000444774663 1044625682 /nfs/dbraw/zinc/62/56/82/1044625682.db2.gz KBBUIMHFFSGJMF-CQSZACIVSA-N 1 2 316.470 4.154 20 0 DIADLO CC(C)c1ccc(-c2ncc(C[N@H+]3CCOC[C@H]3C)s2)cc1 ZINC000444774663 1044625688 /nfs/dbraw/zinc/62/56/88/1044625688.db2.gz KBBUIMHFFSGJMF-CQSZACIVSA-N 1 2 316.470 4.154 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[NH2+][C@H](C)c1ncco1 ZINC000886273823 1044628163 /nfs/dbraw/zinc/62/81/63/1044628163.db2.gz HDDIJAUAVUEDOK-CQSZACIVSA-N 1 2 310.397 4.466 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(-c2ccco2)cc1F ZINC000296604354 1044634267 /nfs/dbraw/zinc/63/42/67/1044634267.db2.gz XXNUCZATPURAGK-CYBMUJFWSA-N 1 2 313.376 4.153 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2nc(C(C)(C)C)no2)c1 ZINC000523440347 1044638274 /nfs/dbraw/zinc/63/82/74/1044638274.db2.gz GQROOKSOGIHJMF-AWEZNQCLSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2nc(C(C)(C)C)no2)c1 ZINC000523440347 1044638280 /nfs/dbraw/zinc/63/82/80/1044638280.db2.gz GQROOKSOGIHJMF-AWEZNQCLSA-N 1 2 301.434 4.177 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nccn2CC(F)(F)F)[C@@H]1c1ccccc1 ZINC000886545286 1044658510 /nfs/dbraw/zinc/65/85/10/1044658510.db2.gz KFMGBNYXRXCZIP-BBRMVZONSA-N 1 2 323.362 4.029 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nccn2CC(F)(F)F)[C@@H]1c1ccccc1 ZINC000886545286 1044658514 /nfs/dbraw/zinc/65/85/14/1044658514.db2.gz KFMGBNYXRXCZIP-BBRMVZONSA-N 1 2 323.362 4.029 20 0 DIADLO Cc1nnc(C[N@@H+]([C@H](C)c2ccc3ccccc3c2)C2CC2)o1 ZINC000070694167 1044659027 /nfs/dbraw/zinc/65/90/27/1044659027.db2.gz MRLGGMZVYPMDTH-CYBMUJFWSA-N 1 2 307.397 4.257 20 0 DIADLO Cc1nnc(C[N@H+]([C@H](C)c2ccc3ccccc3c2)C2CC2)o1 ZINC000070694167 1044659040 /nfs/dbraw/zinc/65/90/40/1044659040.db2.gz MRLGGMZVYPMDTH-CYBMUJFWSA-N 1 2 307.397 4.257 20 0 DIADLO CC(C)[C@H](C)C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000568925532 1044660879 /nfs/dbraw/zinc/66/08/79/1044660879.db2.gz SBXBNYDPWPXBTG-AWEZNQCLSA-N 1 2 311.429 4.117 20 0 DIADLO CC[C@H]([NH2+]Cc1ccn(C(C)C)n1)c1cc(Cl)ccc1OC ZINC000568944211 1044662045 /nfs/dbraw/zinc/66/20/45/1044662045.db2.gz NJQOHJPNIZBVQW-INIZCTEOSA-N 1 2 321.852 4.367 20 0 DIADLO Cc1ccc2c(C(=O)NCc3c[nH+]c(C)cc3C)csc2c1 ZINC001275917029 1044668929 /nfs/dbraw/zinc/66/89/29/1044668929.db2.gz AXUCHFLBCSJWEC-UHFFFAOYSA-N 1 2 310.422 4.152 20 0 DIADLO COC[C@@H](Nc1[nH+]c2ccccc2n1C)c1cccc(Cl)c1 ZINC000569113424 1044675906 /nfs/dbraw/zinc/67/59/06/1044675906.db2.gz MLQBOZBCOKMZAQ-OAHLLOKOSA-N 1 2 315.804 4.026 20 0 DIADLO FCCCCC[N@@H+]1CCO[C@H](c2ccccc2C(F)(F)F)C1 ZINC000569126552 1044676079 /nfs/dbraw/zinc/67/60/79/1044676079.db2.gz GTZKBORPAVMSGN-HNNXBMFYSA-N 1 2 319.342 4.219 20 0 DIADLO FCCCCC[N@H+]1CCO[C@H](c2ccccc2C(F)(F)F)C1 ZINC000569126552 1044676087 /nfs/dbraw/zinc/67/60/87/1044676087.db2.gz GTZKBORPAVMSGN-HNNXBMFYSA-N 1 2 319.342 4.219 20 0 DIADLO c1ccc(N2Cc3cccc(N[C@@H]4CCC[C@H]5C[C@H]54)c3C2)[nH+]c1 ZINC000367188955 1044677281 /nfs/dbraw/zinc/67/72/81/1044677281.db2.gz WUUNEMSXOVCVGW-YXJHDRRASA-N 1 2 305.425 4.202 20 0 DIADLO Fc1ccccc1C[NH2+][C@@H]1CCCc2cn(C3CCCC3)nc21 ZINC000365019447 1044681016 /nfs/dbraw/zinc/68/10/16/1044681016.db2.gz YEHZLDXIURIPDW-GOSISDBHSA-N 1 2 313.420 4.305 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000365343632 1044686411 /nfs/dbraw/zinc/68/64/11/1044686411.db2.gz LMPTWIMTDWMGMR-IAGOWNOFSA-N 1 2 305.466 4.043 20 0 DIADLO Cc1cc(N2CCC[C@H]2CCc2ccccc2)nc(C2CC2)[nH+]1 ZINC000523872621 1044699674 /nfs/dbraw/zinc/69/96/74/1044699674.db2.gz MYIAUMFTTJOEPA-SFHVURJKSA-N 1 2 307.441 4.264 20 0 DIADLO Cc1cc(C)cc(C[NH2+][C@H](CO)c2c(Cl)cccc2Cl)c1 ZINC000475626879 1044702252 /nfs/dbraw/zinc/70/22/52/1044702252.db2.gz RPCVMODNAXQBTF-MRXNPFEDSA-N 1 2 324.251 4.433 20 0 DIADLO CC(C)([NH2+]Cc1scnc1Cl)c1ccc(F)cc1F ZINC000886896878 1044717675 /nfs/dbraw/zinc/71/76/75/1044717675.db2.gz XNGYVLGWRBJPOV-UHFFFAOYSA-N 1 2 302.777 4.100 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@H](C)c2ccccn2)c2ccccn2)cc1 ZINC000366276930 1044717838 /nfs/dbraw/zinc/71/78/38/1044717838.db2.gz ZYKZLRQNMFPPBD-OXQOHEQNSA-N 1 2 303.409 4.225 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(F)cc2Br)CCC1(F)F ZINC000570032922 1044727623 /nfs/dbraw/zinc/72/76/23/1044727623.db2.gz CYUOFUGSMLQLMO-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(F)cc2Br)CCC1(F)F ZINC000570032922 1044727636 /nfs/dbraw/zinc/72/76/36/1044727636.db2.gz CYUOFUGSMLQLMO-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Br)ccc2F)CCC1(F)F ZINC000570130790 1044734576 /nfs/dbraw/zinc/73/45/76/1044734576.db2.gz VVJSKVUCXOYDOE-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Br)ccc2F)CCC1(F)F ZINC000570130790 1044734596 /nfs/dbraw/zinc/73/45/96/1044734596.db2.gz VVJSKVUCXOYDOE-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO CCCc1nc(C)c(C[N@@H+]2CCc3cccc(F)c3[C@H]2C)o1 ZINC000570231157 1044742839 /nfs/dbraw/zinc/74/28/39/1044742839.db2.gz QLQYIKROPDKMSM-CYBMUJFWSA-N 1 2 302.393 4.194 20 0 DIADLO CCCc1nc(C)c(C[N@H+]2CCc3cccc(F)c3[C@H]2C)o1 ZINC000570231157 1044742849 /nfs/dbraw/zinc/74/28/49/1044742849.db2.gz QLQYIKROPDKMSM-CYBMUJFWSA-N 1 2 302.393 4.194 20 0 DIADLO CC1(c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)CCCCC1 ZINC000570316045 1044749951 /nfs/dbraw/zinc/74/99/51/1044749951.db2.gz LCNAYJGACFLSBP-UHFFFAOYSA-N 1 2 308.385 4.144 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@H+](C)Cc1cc[nH]n1 ZINC000093612758 1044758659 /nfs/dbraw/zinc/75/86/59/1044758659.db2.gz QSOYKYAMCHNBHX-CYBMUJFWSA-N 1 2 312.442 4.035 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@@H+](C)Cc1cc[nH]n1 ZINC000093612758 1044758670 /nfs/dbraw/zinc/75/86/70/1044758670.db2.gz QSOYKYAMCHNBHX-CYBMUJFWSA-N 1 2 312.442 4.035 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)[C@@H](C)c2ccccc2C)n1 ZINC000121821166 1044767979 /nfs/dbraw/zinc/76/79/79/1044767979.db2.gz ZYGZOJMSRTZMTI-UONOGXRCSA-N 1 2 319.474 4.385 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)[C@@H](C)c2ccccc2C)n1 ZINC000121821166 1044767988 /nfs/dbraw/zinc/76/79/88/1044767988.db2.gz ZYGZOJMSRTZMTI-UONOGXRCSA-N 1 2 319.474 4.385 20 0 DIADLO Cc1cccn2cc(CC(=O)Nc3ccc(C4CCC4)cc3)[nH+]c12 ZINC000570751168 1044778708 /nfs/dbraw/zinc/77/87/08/1044778708.db2.gz JYELSKQBKQGKMC-UHFFFAOYSA-N 1 2 319.408 4.091 20 0 DIADLO Cc1cnc(C2CC[NH+](Cc3csc(C(C)C)n3)CC2)s1 ZINC000368886639 1044792547 /nfs/dbraw/zinc/79/25/47/1044792547.db2.gz ACFLBAZRFJEAOR-UHFFFAOYSA-N 1 2 321.515 4.411 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(Cc3ccccc3)n2)CCC1(F)F ZINC000571007993 1044795675 /nfs/dbraw/zinc/79/56/75/1044795675.db2.gz GPOIBJXFBLWKNT-CYBMUJFWSA-N 1 2 322.424 4.211 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(Cc3ccccc3)n2)CCC1(F)F ZINC000571007993 1044795690 /nfs/dbraw/zinc/79/56/90/1044795690.db2.gz GPOIBJXFBLWKNT-CYBMUJFWSA-N 1 2 322.424 4.211 20 0 DIADLO C[C@@H]([NH2+][C@H](CO)c1c(Cl)cccc1Cl)c1ccccc1 ZINC000475633182 1044797070 /nfs/dbraw/zinc/79/70/70/1044797070.db2.gz GBDCVLAVUNEUQT-IAQYHMDHSA-N 1 2 310.224 4.378 20 0 DIADLO Cc1cccc([C@H](c2noc(C[C@@H](C)n3cc[nH+]c3)n2)C(C)C)c1 ZINC000571170723 1044798659 /nfs/dbraw/zinc/79/86/59/1044798659.db2.gz IXDUMCOKWCMNNN-CRAIPNDOSA-N 1 2 324.428 4.166 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc(CCC(C)(C)C)no1)c1ccccc1 ZINC000571244940 1044804133 /nfs/dbraw/zinc/80/41/33/1044804133.db2.gz FLGGQXVYCVPWFD-MRXNPFEDSA-N 1 2 301.434 4.089 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc(CCC(C)(C)C)no1)c1ccccc1 ZINC000571244940 1044804154 /nfs/dbraw/zinc/80/41/54/1044804154.db2.gz FLGGQXVYCVPWFD-MRXNPFEDSA-N 1 2 301.434 4.089 20 0 DIADLO Cc1ncc(C[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)s1 ZINC000369320095 1044805449 /nfs/dbraw/zinc/80/54/49/1044805449.db2.gz UWJAYXVPLJQBAW-GOSISDBHSA-N 1 2 309.438 4.034 20 0 DIADLO Clc1ncc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)s1 ZINC000370169128 1044826836 /nfs/dbraw/zinc/82/68/36/1044826836.db2.gz LZGSGEUSXFRPJH-ZDUSSCGKSA-N 1 2 310.875 4.087 20 0 DIADLO Clc1ncc(C[N@H+]2CCS[C@H](c3ccccc3)C2)s1 ZINC000370169128 1044826862 /nfs/dbraw/zinc/82/68/62/1044826862.db2.gz LZGSGEUSXFRPJH-ZDUSSCGKSA-N 1 2 310.875 4.087 20 0 DIADLO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2ncc(C3CC3)o2)cc1 ZINC000371183975 1044864184 /nfs/dbraw/zinc/86/41/84/1044864184.db2.gz LPWMJHIYGPTYNY-KRWDZBQOSA-N 1 2 312.413 4.288 20 0 DIADLO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2ncc(C3CC3)o2)cc1 ZINC000371183975 1044864205 /nfs/dbraw/zinc/86/42/05/1044864205.db2.gz LPWMJHIYGPTYNY-KRWDZBQOSA-N 1 2 312.413 4.288 20 0 DIADLO COC[C@H]([NH2+]Cc1ncc(C(C)C)s1)c1cccc(Cl)c1 ZINC000572796718 1044877377 /nfs/dbraw/zinc/87/73/77/1044877377.db2.gz VXZIOULVUKLJTM-AWEZNQCLSA-N 1 2 324.877 4.397 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1ccncc1 ZINC000371484277 1044880183 /nfs/dbraw/zinc/88/01/83/1044880183.db2.gz BOUSNGZSYLXRSJ-HNNXBMFYSA-N 1 2 316.408 4.170 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ccc([C@H]4C[C@H]4C)o3)CCC2)n1 ZINC000264544966 1044888193 /nfs/dbraw/zinc/88/81/93/1044888193.db2.gz ULBDCDSWKUFIAD-RISCZKNCSA-N 1 2 302.443 4.337 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ccc([C@@H]4C[C@@H]4C)o3)CCC2)n1 ZINC000264544968 1044889638 /nfs/dbraw/zinc/88/96/38/1044889638.db2.gz ULBDCDSWKUFIAD-SMDDNHRTSA-N 1 2 302.443 4.337 20 0 DIADLO Cc1cc(F)cc2c1C[N@H+](Cc1ccc(C(F)(F)F)cn1)CC2 ZINC000337404782 1044892878 /nfs/dbraw/zinc/89/28/78/1044892878.db2.gz MFGLXRSZYFAUSL-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1cc(F)cc2c1C[N@@H+](Cc1ccc(C(F)(F)F)cn1)CC2 ZINC000337404782 1044892897 /nfs/dbraw/zinc/89/28/97/1044892897.db2.gz MFGLXRSZYFAUSL-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO CC(C)CCOc1ccc(C(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC000524652277 1044899658 /nfs/dbraw/zinc/89/96/58/1044899658.db2.gz KCZUGQOGLZAIMS-UHFFFAOYSA-N 1 2 323.396 4.012 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2cnn(C3CCCC3)c2)cs1 ZINC000337505337 1044912491 /nfs/dbraw/zinc/91/24/91/1044912491.db2.gz FEOGSHHRDZLOJD-STQMWFEESA-N 1 2 318.490 4.429 20 0 DIADLO Cc1ccc(C)c(C[N@H+](C)Cc2nccn2Cc2ccccc2)c1 ZINC000524754950 1044916851 /nfs/dbraw/zinc/91/68/51/1044916851.db2.gz CGQIHJGXGMUOPA-UHFFFAOYSA-N 1 2 319.452 4.180 20 0 DIADLO Cc1ccc(C)c(C[N@@H+](C)Cc2nccn2Cc2ccccc2)c1 ZINC000524754950 1044916860 /nfs/dbraw/zinc/91/68/60/1044916860.db2.gz CGQIHJGXGMUOPA-UHFFFAOYSA-N 1 2 319.452 4.180 20 0 DIADLO Cc1ccc([C@H]2COCC[N@@H+]2Cc2ccc3ccccc3c2)o1 ZINC000524811688 1044926187 /nfs/dbraw/zinc/92/61/87/1044926187.db2.gz KTIAAEIMETUYRK-LJQANCHMSA-N 1 2 307.393 4.315 20 0 DIADLO Cc1ccc([C@H]2COCC[N@H+]2Cc2ccc3ccccc3c2)o1 ZINC000524811688 1044926203 /nfs/dbraw/zinc/92/62/03/1044926203.db2.gz KTIAAEIMETUYRK-LJQANCHMSA-N 1 2 307.393 4.315 20 0 DIADLO C[C@@H]1CCC[C@@H](c2noc(-c3cccc(Cn4cc[nH+]c4)c3)n2)C1 ZINC000573841857 1044926710 /nfs/dbraw/zinc/92/67/10/1044926710.db2.gz PRDCDOBFZMUDMD-GDBMZVCRSA-N 1 2 322.412 4.275 20 0 DIADLO C[C@H]1CCC[C@H](c2noc(-c3cccc(Cn4cc[nH+]c4)c3)n2)C1 ZINC000573841859 1044926865 /nfs/dbraw/zinc/92/68/65/1044926865.db2.gz PRDCDOBFZMUDMD-HOCLYGCPSA-N 1 2 322.412 4.275 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000373056613 1044938721 /nfs/dbraw/zinc/93/87/21/1044938721.db2.gz KUWNUXURWJJKKY-SJORKVTESA-N 1 2 319.493 4.123 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)cn1 ZINC000133584937 1044941402 /nfs/dbraw/zinc/94/14/02/1044941402.db2.gz XMXURGHXKAPKFS-LBPRGKRZSA-N 1 2 306.479 4.069 20 0 DIADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cscc1Br ZINC000574235376 1044945228 /nfs/dbraw/zinc/94/52/28/1044945228.db2.gz LFHBWKBRMLWUIK-YMTOWFKASA-N 1 2 324.243 4.122 20 0 DIADLO Cc1noc([C@@H](C)[N@H+](C)Cc2ccc(Cl)c3ccccc23)n1 ZINC000574530050 1044957743 /nfs/dbraw/zinc/95/77/43/1044957743.db2.gz OJBKHIQMPWFYEP-LLVKDONJSA-N 1 2 315.804 4.378 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2ccc(Cl)c3ccccc23)n1 ZINC000574530050 1044957760 /nfs/dbraw/zinc/95/77/60/1044957760.db2.gz OJBKHIQMPWFYEP-LLVKDONJSA-N 1 2 315.804 4.378 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(-c2ccccc2)s1)c1ccncc1F ZINC000337947315 1044967028 /nfs/dbraw/zinc/96/70/28/1044967028.db2.gz QLHZHMVQBSIASD-LBPRGKRZSA-N 1 2 313.401 4.195 20 0 DIADLO O=C(CC1CCCC1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000338114105 1044982024 /nfs/dbraw/zinc/98/20/24/1044982024.db2.gz VBDXBJFAZWVFAN-UHFFFAOYSA-N 1 2 303.793 4.045 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC[C@@]3(CCSC3)C2)c1 ZINC000575042583 1044982674 /nfs/dbraw/zinc/98/26/74/1044982674.db2.gz NXJQUBWXEXOCBA-QGZVFWFLSA-N 1 2 302.418 4.097 20 0 DIADLO CCc1ccc([C@H]2CCC[N@@H+]2[C@H](C)c2nc(C3CC3)no2)o1 ZINC000265375517 1044993057 /nfs/dbraw/zinc/99/30/57/1044993057.db2.gz BJQKUIFVYJJLBU-BXUZGUMPSA-N 1 2 301.390 4.001 20 0 DIADLO CCc1ccc([C@H]2CCC[N@H+]2[C@H](C)c2nc(C3CC3)no2)o1 ZINC000265375517 1044993070 /nfs/dbraw/zinc/99/30/70/1044993070.db2.gz BJQKUIFVYJJLBU-BXUZGUMPSA-N 1 2 301.390 4.001 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1csc(-c2ccco2)n1 ZINC000114721679 1044999682 /nfs/dbraw/zinc/99/96/82/1044999682.db2.gz FCPMDTPQEOGDIZ-GFCCVEGCSA-N 1 2 314.410 4.302 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1csc(-c2ccco2)n1 ZINC000114721679 1044999693 /nfs/dbraw/zinc/99/96/93/1044999693.db2.gz FCPMDTPQEOGDIZ-GFCCVEGCSA-N 1 2 314.410 4.302 20 0 DIADLO Cc1noc([C@@H](C)[N@H+](C)Cc2ccc(-c3ccsc3)cc2)n1 ZINC000575426861 1045000820 /nfs/dbraw/zinc/00/08/20/1045000820.db2.gz BQMRTPWXQJABDE-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2ccc(-c3ccsc3)cc2)n1 ZINC000575426861 1045000834 /nfs/dbraw/zinc/00/08/34/1045000834.db2.gz BQMRTPWXQJABDE-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H](C)c1ccccc1 ZINC000373661199 1045001366 /nfs/dbraw/zinc/00/13/66/1045001366.db2.gz SRQKZKCHFSDHBU-AWEZNQCLSA-N 1 2 305.381 4.127 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@@H]2CCC[C@H](C)C2)no1)c1ccccc1 ZINC000575834975 1045011769 /nfs/dbraw/zinc/01/17/69/1045011769.db2.gz KOTDUKPPULVBKH-USXIJHARSA-N 1 2 313.445 4.404 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@@H]2CCC[C@H](C)C2)no1)c1ccccc1 ZINC000575834975 1045011778 /nfs/dbraw/zinc/01/17/78/1045011778.db2.gz KOTDUKPPULVBKH-USXIJHARSA-N 1 2 313.445 4.404 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@H]2CCC[C@@H](C)C2)no1)c1ccccc1 ZINC000575834974 1045012563 /nfs/dbraw/zinc/01/25/63/1045012563.db2.gz KOTDUKPPULVBKH-HYVNUMGLSA-N 1 2 313.445 4.404 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@H]2CCC[C@@H](C)C2)no1)c1ccccc1 ZINC000575834974 1045012571 /nfs/dbraw/zinc/01/25/71/1045012571.db2.gz KOTDUKPPULVBKH-HYVNUMGLSA-N 1 2 313.445 4.404 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(-c2ncco2)cc1F)c1nccs1 ZINC000411520890 1045016140 /nfs/dbraw/zinc/01/61/40/1045016140.db2.gz XHQGXGVPFKOMEO-CQSZACIVSA-N 1 2 317.389 4.178 20 0 DIADLO CC(C)(CC(=O)N1CCC(n2cc[nH+]c2)CC1)C1CCCCC1 ZINC000373847879 1045016354 /nfs/dbraw/zinc/01/63/54/1045016354.db2.gz AFVAQUVTHFOTIC-UHFFFAOYSA-N 1 2 317.477 4.043 20 0 DIADLO CCc1nc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000525272709 1045019975 /nfs/dbraw/zinc/01/99/75/1045019975.db2.gz OCUSPGCLYPLLPF-BLLLJJGKSA-N 1 2 304.434 4.428 20 0 DIADLO CCc1nc(C[N@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000525272709 1045019984 /nfs/dbraw/zinc/01/99/84/1045019984.db2.gz OCUSPGCLYPLLPF-BLLLJJGKSA-N 1 2 304.434 4.428 20 0 DIADLO C[N@H+](C/C=C\c1ccccc1)Cc1nccn1Cc1ccccc1 ZINC000525274260 1045022633 /nfs/dbraw/zinc/02/26/33/1045022633.db2.gz HBUVINVUJRSTEE-JYRVWZFOSA-N 1 2 317.436 4.077 20 0 DIADLO C[N@@H+](C/C=C\c1ccccc1)Cc1nccn1Cc1ccccc1 ZINC000525274260 1045022649 /nfs/dbraw/zinc/02/26/49/1045022649.db2.gz HBUVINVUJRSTEE-JYRVWZFOSA-N 1 2 317.436 4.077 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3o2)cn1 ZINC000374284118 1045043751 /nfs/dbraw/zinc/04/37/51/1045043751.db2.gz ROZBCFJXYYTRFA-QGZVFWFLSA-N 1 2 324.428 4.332 20 0 DIADLO CC(C)n1cc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3o2)cn1 ZINC000374284118 1045043762 /nfs/dbraw/zinc/04/37/62/1045043762.db2.gz ROZBCFJXYYTRFA-QGZVFWFLSA-N 1 2 324.428 4.332 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC000374301405 1045046207 /nfs/dbraw/zinc/04/62/07/1045046207.db2.gz JHGQOVLZYDOOPK-OAHLLOKOSA-N 1 2 318.490 4.049 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1C[N@H+]1CCC[C@@H]1c1nccs1 ZINC000374301405 1045046216 /nfs/dbraw/zinc/04/62/16/1045046216.db2.gz JHGQOVLZYDOOPK-OAHLLOKOSA-N 1 2 318.490 4.049 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1cccnc1Cl)CCC2 ZINC000152735020 1045046305 /nfs/dbraw/zinc/04/63/05/1045046305.db2.gz GYYVUBSSPXYATN-ZDUSSCGKSA-N 1 2 321.877 4.263 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cccnc1Cl)CCC2 ZINC000152735020 1045046315 /nfs/dbraw/zinc/04/63/15/1045046315.db2.gz GYYVUBSSPXYATN-ZDUSSCGKSA-N 1 2 321.877 4.263 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1C[N@@H+]1CCC[C@H]1c1nccs1 ZINC000374301404 1045047256 /nfs/dbraw/zinc/04/72/56/1045047256.db2.gz JHGQOVLZYDOOPK-HNNXBMFYSA-N 1 2 318.490 4.049 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1C[N@H+]1CCC[C@H]1c1nccs1 ZINC000374301404 1045047267 /nfs/dbraw/zinc/04/72/67/1045047267.db2.gz JHGQOVLZYDOOPK-HNNXBMFYSA-N 1 2 318.490 4.049 20 0 DIADLO CC[N@@H+](Cc1coc(-c2cccs2)n1)Cc1occc1C ZINC000412049933 1045052112 /nfs/dbraw/zinc/05/21/12/1045052112.db2.gz ZFLAQFYRSKUJLJ-UHFFFAOYSA-N 1 2 302.399 4.327 20 0 DIADLO CC[N@H+](Cc1coc(-c2cccs2)n1)Cc1occc1C ZINC000412049933 1045052128 /nfs/dbraw/zinc/05/21/28/1045052128.db2.gz ZFLAQFYRSKUJLJ-UHFFFAOYSA-N 1 2 302.399 4.327 20 0 DIADLO CC(C)[C@H](NC(=O)C[C@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC000576587429 1045066230 /nfs/dbraw/zinc/06/62/30/1045066230.db2.gz JDXBLYIFQVLTJR-GUYCJALGSA-N 1 2 319.836 4.001 20 0 DIADLO CSc1ccc(CNc2ccc(N3CCCC3)c[nH+]2)s1 ZINC000576911077 1045088764 /nfs/dbraw/zinc/08/87/64/1045088764.db2.gz KBBBEZWAUXQVQO-UHFFFAOYSA-N 1 2 305.472 4.077 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](C)Cc2cc(C(C)(C)C)n[nH]2)o1 ZINC000447077740 1045094636 /nfs/dbraw/zinc/09/46/36/1045094636.db2.gz MEXVHELYOUAVHO-SWLSCSKDSA-N 1 2 301.434 4.056 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2cc(C(C)(C)C)n[nH]2)o1 ZINC000447077740 1045094654 /nfs/dbraw/zinc/09/46/54/1045094654.db2.gz MEXVHELYOUAVHO-SWLSCSKDSA-N 1 2 301.434 4.056 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(C)cc2OC)[nH]1 ZINC000577129237 1045103492 /nfs/dbraw/zinc/10/34/92/1045103492.db2.gz BXTQUPUJJWJGAL-IHRRRGAJSA-N 1 2 316.449 4.047 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2noc(C(C)(C)C)n2)c1C ZINC000525637734 1045104337 /nfs/dbraw/zinc/10/43/37/1045104337.db2.gz AVDYXJDBFCLRGN-MRXNPFEDSA-N 1 2 313.445 4.321 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2noc(C(C)(C)C)n2)c1C ZINC000525637734 1045104349 /nfs/dbraw/zinc/10/43/49/1045104349.db2.gz AVDYXJDBFCLRGN-MRXNPFEDSA-N 1 2 313.445 4.321 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+]2CCC[C@H]2c2nc3ccccc3s2)cn1 ZINC000428472116 1045105583 /nfs/dbraw/zinc/10/55/83/1045105583.db2.gz FNAJJOPQWCQLQO-CJNGLKHVSA-N 1 2 324.453 4.293 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+]2CCC[C@H]2c2nc3ccccc3s2)cn1 ZINC000428472116 1045105588 /nfs/dbraw/zinc/10/55/88/1045105588.db2.gz FNAJJOPQWCQLQO-CJNGLKHVSA-N 1 2 324.453 4.293 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2nc(C(C)(C)C)cs2)c1 ZINC000447277065 1045114126 /nfs/dbraw/zinc/11/41/26/1045114126.db2.gz FPNUSUMEBMAPRR-UHFFFAOYSA-N 1 2 304.459 4.081 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2nc(C(C)(C)C)cs2)c1 ZINC000447277065 1045114135 /nfs/dbraw/zinc/11/41/35/1045114135.db2.gz FPNUSUMEBMAPRR-UHFFFAOYSA-N 1 2 304.459 4.081 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@H](c3cccs3)C2)c(Cl)c1 ZINC000447316113 1045118631 /nfs/dbraw/zinc/11/86/31/1045118631.db2.gz VZSODQVPPDMJJT-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@H](c3cccs3)C2)c(Cl)c1 ZINC000447316113 1045118638 /nfs/dbraw/zinc/11/86/38/1045118638.db2.gz VZSODQVPPDMJJT-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO CC[C@H]1c2ccsc2CC[N@H+]1Cc1ccsc1C(=O)OC ZINC000447378610 1045124943 /nfs/dbraw/zinc/12/49/43/1045124943.db2.gz DJQQZSNPHKJNJY-ZDUSSCGKSA-N 1 2 321.467 4.106 20 0 DIADLO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1ccsc1C(=O)OC ZINC000447378610 1045124944 /nfs/dbraw/zinc/12/49/44/1045124944.db2.gz DJQQZSNPHKJNJY-ZDUSSCGKSA-N 1 2 321.467 4.106 20 0 DIADLO FC(F)(F)c1cscc1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC000577549927 1045135562 /nfs/dbraw/zinc/13/55/62/1045135562.db2.gz DZHBFORBSUZHBY-UHFFFAOYSA-N 1 2 319.392 4.302 20 0 DIADLO FC(F)(F)c1cscc1C[N@H+]1CCOC2(CCCCC2)C1 ZINC000577549927 1045135564 /nfs/dbraw/zinc/13/55/64/1045135564.db2.gz DZHBFORBSUZHBY-UHFFFAOYSA-N 1 2 319.392 4.302 20 0 DIADLO Cc1ccccc1[C@H](c1noc([C@@H]2C[C@H]2c2c[nH]c[nH+]2)n1)C(C)C ZINC000924068059 1045145820 /nfs/dbraw/zinc/14/58/20/1045145820.db2.gz GKDPYCCDYJSEQA-BFYDXBDKSA-N 1 2 322.412 4.160 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1sc(C)nc1C ZINC000777505710 1045159168 /nfs/dbraw/zinc/15/91/68/1045159168.db2.gz WTVCCRISOFMYNX-UHFFFAOYSA-N 1 2 300.431 4.132 20 0 DIADLO CC(C)C[C@@H](c1nc(-c2cc3ccccc3[nH]2)no1)n1cc[nH+]c1 ZINC000924427096 1045170957 /nfs/dbraw/zinc/17/09/57/1045170957.db2.gz ADQPNDDZYMNLKM-INIZCTEOSA-N 1 2 321.384 4.050 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1cnc(C(F)(F)F)s1 ZINC000447739296 1045172283 /nfs/dbraw/zinc/17/22/83/1045172283.db2.gz GWLSKFIUWGRSLQ-SECBINFHSA-N 1 2 316.348 4.061 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1cnc(C(F)(F)F)s1 ZINC000447739296 1045172289 /nfs/dbraw/zinc/17/22/89/1045172289.db2.gz GWLSKFIUWGRSLQ-SECBINFHSA-N 1 2 316.348 4.061 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2Cl)on1 ZINC000924545919 1045176271 /nfs/dbraw/zinc/17/62/71/1045176271.db2.gz DNHXECYDABDAJP-BDAKNGLRSA-N 1 2 315.200 4.402 20 0 DIADLO CC[N@H+](Cc1cnc(C(F)(F)F)s1)Cc1cccc(F)c1 ZINC000447797584 1045176409 /nfs/dbraw/zinc/17/64/09/1045176409.db2.gz LMOHTTXLAOCDQH-UHFFFAOYSA-N 1 2 318.339 4.323 20 0 DIADLO CC[N@@H+](Cc1cnc(C(F)(F)F)s1)Cc1cccc(F)c1 ZINC000447797584 1045176416 /nfs/dbraw/zinc/17/64/16/1045176416.db2.gz LMOHTTXLAOCDQH-UHFFFAOYSA-N 1 2 318.339 4.323 20 0 DIADLO C=Cn1cc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000447797879 1045177170 /nfs/dbraw/zinc/17/71/70/1045177170.db2.gz OQUZCDKEFWPLCG-LLVKDONJSA-N 1 2 310.228 4.483 20 0 DIADLO C=Cn1cc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000447797879 1045177176 /nfs/dbraw/zinc/17/71/76/1045177176.db2.gz OQUZCDKEFWPLCG-LLVKDONJSA-N 1 2 310.228 4.483 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1cnc(C(F)(F)F)s1 ZINC000447793320 1045178968 /nfs/dbraw/zinc/17/89/68/1045178968.db2.gz BHTXELWSAFEAGI-SECBINFHSA-N 1 2 318.339 4.494 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1cnc(C(F)(F)F)s1 ZINC000447793320 1045178969 /nfs/dbraw/zinc/17/89/69/1045178969.db2.gz BHTXELWSAFEAGI-SECBINFHSA-N 1 2 318.339 4.494 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000447850122 1045182755 /nfs/dbraw/zinc/18/27/55/1045182755.db2.gz LKDJXNGPZZFVIN-WMLDXEAASA-N 1 2 314.429 4.150 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000447850122 1045182762 /nfs/dbraw/zinc/18/27/62/1045182762.db2.gz LKDJXNGPZZFVIN-WMLDXEAASA-N 1 2 314.429 4.150 20 0 DIADLO CC[C@@H]([NH2+][C@@H]1CCCc2oc(C)nc21)c1ccccc1OC ZINC000924646065 1045187528 /nfs/dbraw/zinc/18/75/28/1045187528.db2.gz JRPAKZYJEPGPMS-HUUCEWRRSA-N 1 2 300.402 4.110 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000447942918 1045190720 /nfs/dbraw/zinc/19/07/20/1045190720.db2.gz OCWFOPHNWFMSQG-UHFFFAOYSA-N 1 2 324.877 4.392 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1cccc(OC)n1 ZINC000924721062 1045195017 /nfs/dbraw/zinc/19/50/17/1045195017.db2.gz NFEFFNZTQWLJMH-BXUZGUMPSA-N 1 2 306.356 4.170 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+][C@H](C)c2ccc(F)c(Cl)c2)nn1 ZINC000924768295 1045197108 /nfs/dbraw/zinc/19/71/08/1045197108.db2.gz FAXNTDRBPDQNRL-MNOVXSKESA-N 1 2 310.804 4.063 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@@H](c1nc2ccccc2[nH]1)C(C)C ZINC000924784092 1045197942 /nfs/dbraw/zinc/19/79/42/1045197942.db2.gz ACIZGHPYIJVFSX-DOTOQJQBSA-N 1 2 324.428 4.224 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+]([C@H](C)c2ccc(F)c(F)c2)CCO1 ZINC000578060066 1045204069 /nfs/dbraw/zinc/20/40/69/1045204069.db2.gz DGMDDOHYUXHENQ-KUHUBIRLSA-N 1 2 317.379 4.408 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+]([C@H](C)c2ccc(F)c(F)c2)CCO1 ZINC000578060066 1045204082 /nfs/dbraw/zinc/20/40/82/1045204082.db2.gz DGMDDOHYUXHENQ-KUHUBIRLSA-N 1 2 317.379 4.408 20 0 DIADLO C[C@H]1N(c2cc[nH+]c3c(Cl)cccc23)CCC12CCOCC2 ZINC000557634137 1045211992 /nfs/dbraw/zinc/21/19/92/1045211992.db2.gz VCMIECRNUMZHTB-CYBMUJFWSA-N 1 2 316.832 4.284 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cnn(C2CCC2)c1 ZINC000924972010 1045214865 /nfs/dbraw/zinc/21/48/65/1045214865.db2.gz ZHSHFVWKTHMMRW-GFCCVEGCSA-N 1 2 318.490 4.213 20 0 DIADLO Cc1cc(CNC(=O)N[C@@H](C)c2cccc(C3CC3)c2)cc(C)[nH+]1 ZINC000557652051 1045216134 /nfs/dbraw/zinc/21/61/34/1045216134.db2.gz WBXKVIVPMGAFJK-HNNXBMFYSA-N 1 2 323.440 4.136 20 0 DIADLO COc1ccc2oc([C@H](C)[NH2+][C@@H](C)c3ncco3)c(C)c2c1 ZINC000924985872 1045216706 /nfs/dbraw/zinc/21/67/06/1045216706.db2.gz GGFFUIPQZDCCCX-RYUDHWBXSA-N 1 2 300.358 4.150 20 0 DIADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1csc(-c2ccccc2)n1 ZINC000578169021 1045217968 /nfs/dbraw/zinc/21/79/68/1045217968.db2.gz JYXTYHTZQROERD-FZKQIMNGSA-N 1 2 322.433 4.422 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H]2CCc3c2nccc3Cl)cs1 ZINC000925034762 1045220880 /nfs/dbraw/zinc/22/08/80/1045220880.db2.gz UKZXHRODBPCCEX-CABZTGNLSA-N 1 2 307.850 4.092 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ncc(C(C)(C)C)s2)c1 ZINC000448220649 1045221666 /nfs/dbraw/zinc/22/16/66/1045221666.db2.gz RATKHTPSPHVTNQ-UHFFFAOYSA-N 1 2 304.459 4.081 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ncc(C(C)(C)C)s2)c1 ZINC000448220649 1045221676 /nfs/dbraw/zinc/22/16/76/1045221676.db2.gz RATKHTPSPHVTNQ-UHFFFAOYSA-N 1 2 304.459 4.081 20 0 DIADLO Cc1[nH]c(CNC2(c3c(Cl)cccc3Cl)CC2)[nH+]c1C ZINC000578248537 1045225010 /nfs/dbraw/zinc/22/50/10/1045225010.db2.gz KISAKGJUSMOZDH-UHFFFAOYSA-N 1 2 310.228 4.112 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2Cl)on1 ZINC000925093860 1045226056 /nfs/dbraw/zinc/22/60/56/1045226056.db2.gz TWDYICRPBIJTLF-BDAKNGLRSA-N 1 2 315.200 4.402 20 0 DIADLO C[N@H+](Cc1csc(-c2cccs2)n1)Cc1ccc(O)cc1 ZINC000578282900 1045227299 /nfs/dbraw/zinc/22/72/99/1045227299.db2.gz YJYBHSVMCATBBH-UHFFFAOYSA-N 1 2 316.451 4.209 20 0 DIADLO C[N@@H+](Cc1csc(-c2cccs2)n1)Cc1ccc(O)cc1 ZINC000578282900 1045227307 /nfs/dbraw/zinc/22/73/07/1045227307.db2.gz YJYBHSVMCATBBH-UHFFFAOYSA-N 1 2 316.451 4.209 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ncc(C(C)(C)C)s2)C1 ZINC000448336302 1045234462 /nfs/dbraw/zinc/23/44/62/1045234462.db2.gz BPQDQBSADWNAHS-HIFRSBDPSA-N 1 2 315.486 4.419 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ncc(C(C)(C)C)s2)C1 ZINC000448336302 1045234474 /nfs/dbraw/zinc/23/44/74/1045234474.db2.gz BPQDQBSADWNAHS-HIFRSBDPSA-N 1 2 315.486 4.419 20 0 DIADLO Cc1cc(NC[C@@H]2CCCO[C@@H]2c2ccccc2)nc(C2CC2)[nH+]1 ZINC000116260286 1045240653 /nfs/dbraw/zinc/24/06/53/1045240653.db2.gz JVNDRNXBZNGUAJ-PKOBYXMFSA-N 1 2 323.440 4.242 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c2ccccn21 ZINC000578540155 1045251939 /nfs/dbraw/zinc/25/19/39/1045251939.db2.gz OMDCCXKXBYCWBF-GOSISDBHSA-N 1 2 320.440 4.190 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@@H]2c2cccnc2)c2ccccn21 ZINC000578540155 1045251950 /nfs/dbraw/zinc/25/19/50/1045251950.db2.gz OMDCCXKXBYCWBF-GOSISDBHSA-N 1 2 320.440 4.190 20 0 DIADLO CC(C)CN(Cc1ccccc1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000578582266 1045256519 /nfs/dbraw/zinc/25/65/19/1045256519.db2.gz AYJUBYOFGWTEHK-UHFFFAOYSA-N 1 2 322.412 4.024 20 0 DIADLO CCS[C@@H]1CCC[C@H]([NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC000578706149 1045267472 /nfs/dbraw/zinc/26/74/72/1045267472.db2.gz NHEFBWMNAMRYKB-ARFHVFGLSA-N 1 2 322.522 4.080 20 0 DIADLO CO[C@@H](C)c1nc(CSCCc2[nH+]cc(C)cc2C)cs1 ZINC000578748976 1045269306 /nfs/dbraw/zinc/26/93/06/1045269306.db2.gz KNYLWUFPMSUJHZ-ZDUSSCGKSA-N 1 2 322.499 4.338 20 0 DIADLO C[C@@H]1CN(c2[nH+]ccc3ccccc32)C[C@@H](c2ccccc2)O1 ZINC000527865849 1045269876 /nfs/dbraw/zinc/26/98/76/1045269876.db2.gz VNDWAHMDZFYNAT-BEFAXECRSA-N 1 2 304.393 4.201 20 0 DIADLO Clc1cccc2c(N3CCC[C@@H]3[C@H]3CCCOC3)cc[nH+]c12 ZINC000578763859 1045270172 /nfs/dbraw/zinc/27/01/72/1045270172.db2.gz OMJMNUSYIGBLRF-XJKSGUPXSA-N 1 2 316.832 4.284 20 0 DIADLO CC(C)c1cccc([C@H](C)[NH2+][C@H](CO)c2c(F)cccc2F)c1 ZINC000527872260 1045271362 /nfs/dbraw/zinc/27/13/62/1045271362.db2.gz VWDLUVYARLODTM-SCLBCKFNSA-N 1 2 319.395 4.472 20 0 DIADLO CC(C)c1nnc([C@@H](C)[NH2+][C@@H]2CCc3cc(F)c(Cl)cc32)[nH]1 ZINC000527875447 1045275799 /nfs/dbraw/zinc/27/57/99/1045275799.db2.gz DACQAXIQKJBIFM-YMTOWFKASA-N 1 2 322.815 4.059 20 0 DIADLO c1cn(Cc2cccc(-c3noc(C4=CCCCCC4)n3)c2)c[nH+]1 ZINC000578916547 1045281173 /nfs/dbraw/zinc/28/11/73/1045281173.db2.gz YZTOSVIZVRQETQ-UHFFFAOYSA-N 1 2 320.396 4.329 20 0 DIADLO Cc1csc(C[NH2+]Cc2ccc(-c3ccco3)cc2F)n1 ZINC000579077474 1045293385 /nfs/dbraw/zinc/29/33/85/1045293385.db2.gz YOCBTTWHNKOKQC-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO C/C(=C\c1cccc(C(F)(F)F)c1)C[N@@H+](C)Cc1ccon1 ZINC000579175430 1045298046 /nfs/dbraw/zinc/29/80/46/1045298046.db2.gz SHCUQIVRXMBXEA-XYOKQWHBSA-N 1 2 310.319 4.229 20 0 DIADLO C/C(=C\c1cccc(C(F)(F)F)c1)C[N@H+](C)Cc1ccon1 ZINC000579175430 1045298048 /nfs/dbraw/zinc/29/80/48/1045298048.db2.gz SHCUQIVRXMBXEA-XYOKQWHBSA-N 1 2 310.319 4.229 20 0 DIADLO CC(C)OC1CCN(c2cc[nH+]c3cc(F)c(Cl)cc32)CC1 ZINC000579435511 1045315969 /nfs/dbraw/zinc/31/59/69/1045315969.db2.gz FOTIKXQCHLEGGI-UHFFFAOYSA-N 1 2 322.811 4.421 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1cc(C(C)(C)C)on1 ZINC000579531230 1045320636 /nfs/dbraw/zinc/32/06/36/1045320636.db2.gz WWCHIFWTGJWUDD-INIZCTEOSA-N 1 2 301.434 4.038 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1cc(C(C)(C)C)on1 ZINC000579531230 1045320642 /nfs/dbraw/zinc/32/06/42/1045320642.db2.gz WWCHIFWTGJWUDD-INIZCTEOSA-N 1 2 301.434 4.038 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@H]2c2ncc[nH]2)cc2ccccc21 ZINC000449014647 1045331914 /nfs/dbraw/zinc/33/19/14/1045331914.db2.gz BDBKELDPMNYJBB-SFHVURJKSA-N 1 2 321.424 4.299 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@H]2c2ncc[nH]2)cc2ccccc21 ZINC000449014647 1045331918 /nfs/dbraw/zinc/33/19/18/1045331918.db2.gz BDBKELDPMNYJBB-SFHVURJKSA-N 1 2 321.424 4.299 20 0 DIADLO COc1cc(C[N@H+](C)Cc2csc(C)n2)cc2ccccc21 ZINC000449011116 1045334355 /nfs/dbraw/zinc/33/43/55/1045334355.db2.gz XZGGKBMPVJFSLE-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2csc(C)n2)cc2ccccc21 ZINC000449011116 1045334359 /nfs/dbraw/zinc/33/43/59/1045334359.db2.gz XZGGKBMPVJFSLE-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO FC(F)(F)c1nn(C[N@H+](C2CC2)C2CCCC2)c(=S)s1 ZINC000188638508 1045338176 /nfs/dbraw/zinc/33/81/76/1045338176.db2.gz FMNPLCKXKIMGMN-UHFFFAOYSA-N 1 2 323.409 4.057 20 0 DIADLO FC(F)(F)c1nn(C[N@@H+](C2CC2)C2CCCC2)c(=S)s1 ZINC000188638508 1045338182 /nfs/dbraw/zinc/33/81/82/1045338182.db2.gz FMNPLCKXKIMGMN-UHFFFAOYSA-N 1 2 323.409 4.057 20 0 DIADLO C[C@@H]1CSC[C@@H]1Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000449047553 1045340501 /nfs/dbraw/zinc/34/05/01/1045340501.db2.gz BZQYKJSJCPPLML-DYVFJYSZSA-N 1 2 313.470 4.050 20 0 DIADLO Fc1ccc(C[NH+]2CCC(=Cc3ccc(F)c(F)c3)CC2)cn1 ZINC000779172990 1045350705 /nfs/dbraw/zinc/35/07/05/1045350705.db2.gz ZDDVSHOHUMWUML-UHFFFAOYSA-N 1 2 318.342 4.178 20 0 DIADLO CCc1cnc(C[NH2+]Cc2cc3ccccc3cc2OC)s1 ZINC000449171601 1045354605 /nfs/dbraw/zinc/35/46/05/1045354605.db2.gz LDRADHNDVQYZNW-UHFFFAOYSA-N 1 2 312.438 4.157 20 0 DIADLO CCOc1ncccc1C[NH2+]Cc1cc(Cl)sc1Cl ZINC000449221065 1045364080 /nfs/dbraw/zinc/36/40/80/1045364080.db2.gz SBJJLXIUCWCQQA-UHFFFAOYSA-N 1 2 317.241 4.138 20 0 DIADLO CC(C)CC[C@@H]1CC[C@H]([NH2+][C@@H](c2nnc[nH]2)c2ccccc2)C1 ZINC000449239977 1045368556 /nfs/dbraw/zinc/36/85/56/1045368556.db2.gz XGWXLRIQNSIQDP-BPQIPLTHSA-N 1 2 312.461 4.089 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2ccccc2-c2ccccc2C)n1 ZINC000449280404 1045371347 /nfs/dbraw/zinc/37/13/47/1045371347.db2.gz XSTWLCIPULTWPF-AWEZNQCLSA-N 1 2 307.397 4.204 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1cccc(C)c1F ZINC000449297539 1045372550 /nfs/dbraw/zinc/37/25/50/1045372550.db2.gz DGUICXSOCDLZRG-MRXNPFEDSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1cccc(C)c1F ZINC000449297539 1045372557 /nfs/dbraw/zinc/37/25/57/1045372557.db2.gz DGUICXSOCDLZRG-MRXNPFEDSA-N 1 2 301.409 4.078 20 0 DIADLO C[C@@H]1C[N@H+](CCOC2CCCCCC2)C[C@@H](c2ccsc2)O1 ZINC000470196409 1045379647 /nfs/dbraw/zinc/37/96/47/1045379647.db2.gz UWRATSFWGQTFKS-QAPCUYQASA-N 1 2 323.502 4.249 20 0 DIADLO C[C@@H]1C[N@@H+](CCOC2CCCCCC2)C[C@@H](c2ccsc2)O1 ZINC000470196409 1045379651 /nfs/dbraw/zinc/37/96/51/1045379651.db2.gz UWRATSFWGQTFKS-QAPCUYQASA-N 1 2 323.502 4.249 20 0 DIADLO FC(F)(F)c1cccc(C[NH2+]Cc2ccsc2Cl)n1 ZINC000449402231 1045390708 /nfs/dbraw/zinc/39/07/08/1045390708.db2.gz QECUIGIYEDEZDV-UHFFFAOYSA-N 1 2 306.740 4.105 20 0 DIADLO c1nc(C[NH2+][C@@H](c2ccccn2)C2CCC2)oc1-c1ccccc1 ZINC000528653209 1045391366 /nfs/dbraw/zinc/39/13/66/1045391366.db2.gz XGPZLRLAAGTYFX-HXUWFJFHSA-N 1 2 319.408 4.368 20 0 DIADLO C[N@H+](Cc1cc(-c2ccc(Cl)cc2)no1)Cc1cccnc1 ZINC000119035199 1045392615 /nfs/dbraw/zinc/39/26/15/1045392615.db2.gz MWLIODXBJNDKFT-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccc(Cl)cc2)no1)Cc1cccnc1 ZINC000119035199 1045392616 /nfs/dbraw/zinc/39/26/16/1045392616.db2.gz MWLIODXBJNDKFT-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCc2nc(C3CC3)ncc2C1 ZINC000528733120 1045405641 /nfs/dbraw/zinc/40/56/41/1045405641.db2.gz IXFZOJMROITSGL-LBPRGKRZSA-N 1 2 313.832 4.127 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCc2nc(C3CC3)ncc2C1 ZINC000528733120 1045405644 /nfs/dbraw/zinc/40/56/44/1045405644.db2.gz IXFZOJMROITSGL-LBPRGKRZSA-N 1 2 313.832 4.127 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1csc(-c2ccsc2)n1 ZINC000528763795 1045411555 /nfs/dbraw/zinc/41/15/55/1045411555.db2.gz CDPFIKUKEMHFMG-SNVBAGLBSA-N 1 2 314.426 4.491 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1csc(-c2ccsc2)n1 ZINC000528763795 1045411560 /nfs/dbraw/zinc/41/15/60/1045411560.db2.gz CDPFIKUKEMHFMG-SNVBAGLBSA-N 1 2 314.426 4.491 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCC(F)(F)C[C@@H]3C)cs2)o1 ZINC000528768192 1045411592 /nfs/dbraw/zinc/41/15/92/1045411592.db2.gz OEBAZCWNNFFCIF-JTQLQIEISA-N 1 2 312.385 4.331 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCC(F)(F)C[C@@H]3C)cs2)o1 ZINC000528768192 1045411597 /nfs/dbraw/zinc/41/15/97/1045411597.db2.gz OEBAZCWNNFFCIF-JTQLQIEISA-N 1 2 312.385 4.331 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC(F)(F)C[C@H]2C)cs1 ZINC000528765247 1045411653 /nfs/dbraw/zinc/41/16/53/1045411653.db2.gz ICBOEZRIZPFHPO-GFCCVEGCSA-N 1 2 302.434 4.351 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC(F)(F)C[C@H]2C)cs1 ZINC000528765247 1045411655 /nfs/dbraw/zinc/41/16/55/1045411655.db2.gz ICBOEZRIZPFHPO-GFCCVEGCSA-N 1 2 302.434 4.351 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+]1CCC(F)(F)C[C@H]1C ZINC000528768753 1045412320 /nfs/dbraw/zinc/41/23/20/1045412320.db2.gz OLRIGGHVFXPKLE-CQSZACIVSA-N 1 2 324.415 4.177 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@H+]1CCC(F)(F)C[C@H]1C ZINC000528768753 1045412322 /nfs/dbraw/zinc/41/23/22/1045412322.db2.gz OLRIGGHVFXPKLE-CQSZACIVSA-N 1 2 324.415 4.177 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+]1CCC(F)(F)C[C@@H]1C ZINC000528768746 1045412409 /nfs/dbraw/zinc/41/24/09/1045412409.db2.gz OLRIGGHVFXPKLE-AWEZNQCLSA-N 1 2 324.415 4.177 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@H+]1CCC(F)(F)C[C@@H]1C ZINC000528768746 1045412411 /nfs/dbraw/zinc/41/24/11/1045412411.db2.gz OLRIGGHVFXPKLE-AWEZNQCLSA-N 1 2 324.415 4.177 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)[C@@H](C)c2ccccc2)n1 ZINC000119292600 1045413815 /nfs/dbraw/zinc/41/38/15/1045413815.db2.gz KTIVNTIHPKAKJY-QWHCGFSZSA-N 1 2 305.447 4.077 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)[C@@H](C)c2ccccc2)n1 ZINC000119292600 1045413817 /nfs/dbraw/zinc/41/38/17/1045413817.db2.gz KTIVNTIHPKAKJY-QWHCGFSZSA-N 1 2 305.447 4.077 20 0 DIADLO CCc1noc(C)c1C[N@@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000528792435 1045415703 /nfs/dbraw/zinc/41/57/03/1045415703.db2.gz DBWLDYAKNSXTFP-UHFFFAOYSA-N 1 2 324.346 4.123 20 0 DIADLO CCc1noc(C)c1C[N@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000528792435 1045415711 /nfs/dbraw/zinc/41/57/11/1045415711.db2.gz DBWLDYAKNSXTFP-UHFFFAOYSA-N 1 2 324.346 4.123 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)o2)c2nccn21 ZINC000449575413 1045416202 /nfs/dbraw/zinc/41/62/02/1045416202.db2.gz XUYKUADSUGVMNV-WBMJQRKESA-N 1 2 311.360 4.078 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](CC)c2cc(C)ccc2C)n1 ZINC000528799552 1045416861 /nfs/dbraw/zinc/41/68/61/1045416861.db2.gz IQRZYRHDRPSSOM-INIZCTEOSA-N 1 2 301.434 4.270 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+]Cc3cnc(C4CC4)o3)o2)cc1 ZINC000449698459 1045428207 /nfs/dbraw/zinc/42/82/07/1045428207.db2.gz NRUGRBHZMBXBTA-UHFFFAOYSA-N 1 2 308.381 4.410 20 0 DIADLO COCc1nc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2C)cs1 ZINC000449730077 1045429637 /nfs/dbraw/zinc/42/96/37/1045429637.db2.gz CRDKTXRUBBIFKU-INIZCTEOSA-N 1 2 320.433 4.074 20 0 DIADLO COCc1nc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2C)cs1 ZINC000449730077 1045429640 /nfs/dbraw/zinc/42/96/40/1045429640.db2.gz CRDKTXRUBBIFKU-INIZCTEOSA-N 1 2 320.433 4.074 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC000449732326 1045431799 /nfs/dbraw/zinc/43/17/99/1045431799.db2.gz LGWHGSTUDCJCAT-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC000449732326 1045431802 /nfs/dbraw/zinc/43/18/02/1045431802.db2.gz LGWHGSTUDCJCAT-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC[C@H](C)[N@H+](Cc1nnc(C2CC2)s1)Cc1ccccc1 ZINC000450240937 1045477140 /nfs/dbraw/zinc/47/71/40/1045477140.db2.gz FJLMMMCXIISIPE-ZDUSSCGKSA-N 1 2 301.459 4.216 20 0 DIADLO CC[C@H](C)[N@@H+](Cc1nnc(C2CC2)s1)Cc1ccccc1 ZINC000450240937 1045477141 /nfs/dbraw/zinc/47/71/41/1045477141.db2.gz FJLMMMCXIISIPE-ZDUSSCGKSA-N 1 2 301.459 4.216 20 0 DIADLO CCOC[C@@H]1CCCN(c2cc[nH+]c3cc(F)c(Cl)cc32)C1 ZINC000450327935 1045488627 /nfs/dbraw/zinc/48/86/27/1045488627.db2.gz AHYVKTRKNAUMSO-GFCCVEGCSA-N 1 2 322.811 4.280 20 0 DIADLO Clc1ccc2c(c1Cl)CC[N@@H+](CCc1cscn1)C2 ZINC000450342365 1045492164 /nfs/dbraw/zinc/49/21/64/1045492164.db2.gz RYOHVRZSVQVKJO-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO Clc1ccc2c(c1Cl)CC[N@H+](CCc1cscn1)C2 ZINC000450342365 1045492165 /nfs/dbraw/zinc/49/21/65/1045492165.db2.gz RYOHVRZSVQVKJO-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO Cc1ncsc1C[N@@H+](C)Cc1csc(C(F)(F)F)c1 ZINC000628163318 1045532724 /nfs/dbraw/zinc/53/27/24/1045532724.db2.gz XGZVLAJNXFCAPM-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nnc(C3CC3)s2)[C@H]1c1cccc(F)c1 ZINC000450458872 1045509375 /nfs/dbraw/zinc/50/93/75/1045509375.db2.gz YYUXPGRFIXCHMH-MEDUHNTESA-N 1 2 317.433 4.138 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nnc(C3CC3)s2)[C@H]1c1cccc(F)c1 ZINC000450458872 1045509382 /nfs/dbraw/zinc/50/93/82/1045509382.db2.gz YYUXPGRFIXCHMH-MEDUHNTESA-N 1 2 317.433 4.138 20 0 DIADLO Cc1c[nH]c(C[N@H+](Cc2cccc(C(F)(F)F)c2)C(C)C)n1 ZINC000628141477 1045529105 /nfs/dbraw/zinc/52/91/05/1045529105.db2.gz SSMQNTQQRZJNFT-UHFFFAOYSA-N 1 2 311.351 4.148 20 0 DIADLO Cc1c[nH]c(C[N@@H+](Cc2cccc(C(F)(F)F)c2)C(C)C)n1 ZINC000628141477 1045529112 /nfs/dbraw/zinc/52/91/12/1045529112.db2.gz SSMQNTQQRZJNFT-UHFFFAOYSA-N 1 2 311.351 4.148 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](C)c2cnn(CC3CCC3)c2)cs1 ZINC001119964125 1045530827 /nfs/dbraw/zinc/53/08/27/1045530827.db2.gz WPDQHWPABSEBEH-CYBMUJFWSA-N 1 2 318.490 4.114 20 0 DIADLO CC[N@H+](Cc1nc(C)c[nH]1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000628164097 1045532120 /nfs/dbraw/zinc/53/21/20/1045532120.db2.gz CXRMCMPTQHZCEU-HXUWFJFHSA-N 1 2 323.415 4.469 20 0 DIADLO CC[N@@H+](Cc1nc(C)c[nH]1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000628164097 1045532128 /nfs/dbraw/zinc/53/21/28/1045532128.db2.gz CXRMCMPTQHZCEU-HXUWFJFHSA-N 1 2 323.415 4.469 20 0 DIADLO Cc1ncsc1C[N@H+](C)Cc1csc(C(F)(F)F)c1 ZINC000628163318 1045532713 /nfs/dbraw/zinc/53/27/13/1045532713.db2.gz XGZVLAJNXFCAPM-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO COc1cccc(F)c1C[NH2+][C@H]1CCCc2c(Cl)ccnc21 ZINC001120366945 1045537793 /nfs/dbraw/zinc/53/77/93/1045537793.db2.gz YZUZHGVWYCVJMX-HNNXBMFYSA-N 1 2 320.795 4.050 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)N(C)Cc1[nH]c(C)c(C)[nH+]1 ZINC000628187132 1045539187 /nfs/dbraw/zinc/53/91/87/1045539187.db2.gz GOHFGBVXGLULGQ-CYBMUJFWSA-N 1 2 306.479 4.108 20 0 DIADLO Clc1ccc2sc(C[NH2+]Cc3cnc(C4CC4)o3)nc2c1 ZINC000628210080 1045545189 /nfs/dbraw/zinc/54/51/89/1045545189.db2.gz GDHIOKROOVZKHZ-UHFFFAOYSA-N 1 2 319.817 4.105 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccc(Cl)s1 ZINC000450729878 1045553921 /nfs/dbraw/zinc/55/39/21/1045553921.db2.gz UOPUZPNGRBTUEW-SECBINFHSA-N 1 2 313.879 4.371 20 0 DIADLO CCO[C@H]1CCN(c2cc[nH+]c3c(Cl)cccc23)C[C@H]1C ZINC000450748728 1045556799 /nfs/dbraw/zinc/55/67/99/1045556799.db2.gz XIOITGJZNLTELX-WBMJQRKESA-N 1 2 304.821 4.140 20 0 DIADLO CCO[C@@H]1CCN(c2cc[nH+]c3c(Cl)cccc23)C[C@@H]1C ZINC000450748725 1045556900 /nfs/dbraw/zinc/55/69/00/1045556900.db2.gz XIOITGJZNLTELX-BLLLJJGKSA-N 1 2 304.821 4.140 20 0 DIADLO CC(C)CCCC(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001121284813 1045559326 /nfs/dbraw/zinc/55/93/26/1045559326.db2.gz LEMDVSXMYDTPTO-INIZCTEOSA-N 1 2 319.493 4.170 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(C(F)(F)F)c2)[C@H]1[C@@H]1CCCO1 ZINC000628284144 1045563797 /nfs/dbraw/zinc/56/37/97/1045563797.db2.gz BRNWUGWAVDVJMO-AAEUAGOBSA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(C(F)(F)F)c2)[C@H]1[C@@H]1CCCO1 ZINC000628284144 1045563804 /nfs/dbraw/zinc/56/38/04/1045563804.db2.gz BRNWUGWAVDVJMO-AAEUAGOBSA-N 1 2 319.392 4.156 20 0 DIADLO C(=C/c1ccccc1)\CC[N@@H+]1CCSC[C@H]1c1nccs1 ZINC000450761149 1045566105 /nfs/dbraw/zinc/56/61/05/1045566105.db2.gz QUDLSFPLBFGANN-YCOJEUHLSA-N 1 2 316.495 4.337 20 0 DIADLO C(=C/c1ccccc1)\CC[N@H+]1CCSC[C@H]1c1nccs1 ZINC000450761149 1045566114 /nfs/dbraw/zinc/56/61/14/1045566114.db2.gz QUDLSFPLBFGANN-YCOJEUHLSA-N 1 2 316.495 4.337 20 0 DIADLO CCCc1ncc(CNc2c(C)c[nH+]c3c(OC)cccc23)o1 ZINC000450856445 1045587033 /nfs/dbraw/zinc/58/70/33/1045587033.db2.gz IMNZNZBPYNFJHE-UHFFFAOYSA-N 1 2 311.385 4.104 20 0 DIADLO COc1cccc(C[NH2+][C@@H](C)c2nc3ccccc3s2)c1F ZINC000800237528 1045590448 /nfs/dbraw/zinc/59/04/48/1045590448.db2.gz HRVKELRQBYQUII-NSHDSACASA-N 1 2 316.401 4.295 20 0 DIADLO Cc1nnc(C[NH2+][C@H](c2ccccc2)c2ccc(C)cc2C)s1 ZINC000391810643 1045619265 /nfs/dbraw/zinc/61/92/65/1045619265.db2.gz LPVDXCCHTZFRMY-LJQANCHMSA-N 1 2 323.465 4.343 20 0 DIADLO FC1(F)CCCC[C@@H]1C[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000451082176 1045623822 /nfs/dbraw/zinc/62/38/22/1045623822.db2.gz UFYZIBVJYCYDEE-OAHLLOKOSA-N 1 2 317.383 4.013 20 0 DIADLO FC1(F)CCCC[C@@H]1C[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000451082176 1045623835 /nfs/dbraw/zinc/62/38/35/1045623835.db2.gz UFYZIBVJYCYDEE-OAHLLOKOSA-N 1 2 317.383 4.013 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@H](C)c2cccc(C3CC3)c2)n1 ZINC000451117203 1045625680 /nfs/dbraw/zinc/62/56/80/1045625680.db2.gz SZNQVRHAHCUQDW-CQSZACIVSA-N 1 2 313.445 4.386 20 0 DIADLO CC(C)c1nnc(C[N@H+]2[C@H](C)[C@@H](CC(F)(F)F)C[C@@H]2C)s1 ZINC000451149564 1045633215 /nfs/dbraw/zinc/63/32/15/1045633215.db2.gz QFXDCNHZPZZQBC-HBNTYKKESA-N 1 2 321.412 4.213 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2[C@H](C)[C@@H](CC(F)(F)F)C[C@@H]2C)s1 ZINC000451149564 1045633219 /nfs/dbraw/zinc/63/32/19/1045633219.db2.gz QFXDCNHZPZZQBC-HBNTYKKESA-N 1 2 321.412 4.213 20 0 DIADLO C[C@@H]1[C@@H](C)CC[N@@H+]1Cn1nc(-c2ccccc2)sc1=S ZINC000751938871 1045643426 /nfs/dbraw/zinc/64/34/26/1045643426.db2.gz BKQUFOCNBQKZHQ-NWDGAFQWSA-N 1 2 305.472 4.029 20 0 DIADLO C[C@@H]1[C@@H](C)CC[N@H+]1Cn1nc(-c2ccccc2)sc1=S ZINC000751938871 1045643433 /nfs/dbraw/zinc/64/34/33/1045643433.db2.gz BKQUFOCNBQKZHQ-NWDGAFQWSA-N 1 2 305.472 4.029 20 0 DIADLO Cc1cccc(C[N@@H+]2CCCC[C@H]2C(=O)Oc2ccccc2C)c1 ZINC001124308081 1045647159 /nfs/dbraw/zinc/64/71/59/1045647159.db2.gz OITJVYOLIBCLLS-IBGZPJMESA-N 1 2 323.436 4.264 20 0 DIADLO Cc1cccc(C[N@H+]2CCCC[C@H]2C(=O)Oc2ccccc2C)c1 ZINC001124308081 1045647164 /nfs/dbraw/zinc/64/71/64/1045647164.db2.gz OITJVYOLIBCLLS-IBGZPJMESA-N 1 2 323.436 4.264 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccc(Cl)cc3Cl)ccn12 ZINC001124319432 1045651639 /nfs/dbraw/zinc/65/16/39/1045651639.db2.gz CRCLTNWVICXYEJ-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO Cc1cccc2c1CC(C)(C)[N@H+](Cc1nnc(C3CC3)s1)C2 ZINC000451263065 1045652374 /nfs/dbraw/zinc/65/23/74/1045652374.db2.gz QAWKEPVUZUYREL-UHFFFAOYSA-N 1 2 313.470 4.061 20 0 DIADLO Cc1cccc2c1CC(C)(C)[N@@H+](Cc1nnc(C3CC3)s1)C2 ZINC000451263065 1045652383 /nfs/dbraw/zinc/65/23/83/1045652383.db2.gz QAWKEPVUZUYREL-UHFFFAOYSA-N 1 2 313.470 4.061 20 0 DIADLO C[NH2+]c1ccc(NCc2cc(Cl)c(OC)c(OC)c2)cc1 ZINC000629388474 1045665041 /nfs/dbraw/zinc/66/50/41/1045665041.db2.gz CIBSDMFSQUUTDQ-UHFFFAOYSA-N 1 2 306.793 4.011 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCC[C@H]3CCCF)cc2)CCO1 ZINC000800982193 1045676046 /nfs/dbraw/zinc/67/60/46/1045676046.db2.gz OVRASGJLTUASIQ-JTDSTZFVSA-N 1 2 320.452 4.242 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+][C@H]2CCC[C@@H]2CCCF)cc1 ZINC000800982171 1045676313 /nfs/dbraw/zinc/67/63/13/1045676313.db2.gz OLGLXGKHWSKBQH-MDZRGWNJSA-N 1 2 320.452 4.242 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CC[C@H]3C3CCC3)cc2)C[C@H](C)O1 ZINC000800983465 1045676845 /nfs/dbraw/zinc/67/68/45/1045676845.db2.gz KBFMNCJEXVXSNM-VZJWBNGJSA-N 1 2 314.473 4.291 20 0 DIADLO CC(C)[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccc(F)cn1 ZINC000779422895 1045701216 /nfs/dbraw/zinc/70/12/16/1045701216.db2.gz MCSZECCBHLHNNW-LJQANCHMSA-N 1 2 313.420 4.412 20 0 DIADLO CC(C)[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccc(F)cn1 ZINC000779422895 1045701228 /nfs/dbraw/zinc/70/12/28/1045701228.db2.gz MCSZECCBHLHNNW-LJQANCHMSA-N 1 2 313.420 4.412 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@H+](C/C(Cl)=C\Cl)CC12CCC2 ZINC000801590319 1045748817 /nfs/dbraw/zinc/74/88/17/1045748817.db2.gz IWOGYMJKOKABST-OLKPEBQYSA-N 1 2 302.167 4.360 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@@H+](C/C(Cl)=C\Cl)CC12CCC2 ZINC000801590319 1045748829 /nfs/dbraw/zinc/74/88/29/1045748829.db2.gz IWOGYMJKOKABST-OLKPEBQYSA-N 1 2 302.167 4.360 20 0 DIADLO c1csc(-c2cnc(COc3ccccc3-n3cc[nH+]c3)o2)c1 ZINC000530777431 1045727303 /nfs/dbraw/zinc/72/73/03/1045727303.db2.gz ALZYTLXFYRCHKM-UHFFFAOYSA-N 1 2 323.377 4.168 20 0 DIADLO COc1ccc2c(c1)[C@H](Nc1ccc([NH+](C)C)cc1)CCS2 ZINC000191544689 1045727483 /nfs/dbraw/zinc/72/74/83/1045727483.db2.gz KATDWQJGEFBQLY-QGZVFWFLSA-N 1 2 314.454 4.410 20 0 DIADLO C[C@@H]([N@H+](C)Cn1nc(-c2ccccc2)sc1=S)C1(C)CC1 ZINC000753113666 1045728484 /nfs/dbraw/zinc/72/84/84/1045728484.db2.gz ZAKNVRCKIRKFSF-GFCCVEGCSA-N 1 2 319.499 4.419 20 0 DIADLO C[C@@H]([N@@H+](C)Cn1nc(-c2ccccc2)sc1=S)C1(C)CC1 ZINC000753113666 1045728498 /nfs/dbraw/zinc/72/84/98/1045728498.db2.gz ZAKNVRCKIRKFSF-GFCCVEGCSA-N 1 2 319.499 4.419 20 0 DIADLO CCc1noc(C)c1C[N@@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC000451875458 1045737470 /nfs/dbraw/zinc/73/74/70/1045737470.db2.gz BYUSAGCAIHNYRG-SFHVURJKSA-N 1 2 324.428 4.149 20 0 DIADLO CCc1noc(C)c1C[N@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC000451875458 1045737482 /nfs/dbraw/zinc/73/74/82/1045737482.db2.gz BYUSAGCAIHNYRG-SFHVURJKSA-N 1 2 324.428 4.149 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@@H+]2Cc2ccoc2)s1 ZINC000753591337 1045769653 /nfs/dbraw/zinc/76/96/53/1045769653.db2.gz QPUDTTQCFXMLAR-NSHDSACASA-N 1 2 312.232 4.441 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@H+]2Cc2ccoc2)s1 ZINC000753591337 1045769667 /nfs/dbraw/zinc/76/96/67/1045769667.db2.gz QPUDTTQCFXMLAR-NSHDSACASA-N 1 2 312.232 4.441 20 0 DIADLO C[C@@H]([NH2+]c1ccc(N2CCC(O)CC2)cc1)C1CCCCCC1 ZINC000753701999 1045791340 /nfs/dbraw/zinc/79/13/40/1045791340.db2.gz CBQZRKZBWDAKKZ-MRXNPFEDSA-N 1 2 316.489 4.419 20 0 DIADLO C[NH+](C)c1ccc(N[C@@H](c2ccc(F)cc2)c2cccnc2)cc1 ZINC000753720065 1045795413 /nfs/dbraw/zinc/79/54/13/1045795413.db2.gz KSZDOVFQVVFHAK-FQEVSTJZSA-N 1 2 321.399 4.488 20 0 DIADLO CCOc1cccc([C@@H](C)[NH2+][C@H]2COc3cc(F)cc(F)c32)c1 ZINC000753764149 1045800751 /nfs/dbraw/zinc/80/07/51/1045800751.db2.gz RLHMAKCRXFVPPM-BZNIZROVSA-N 1 2 319.351 4.148 20 0 DIADLO C[C@H](C(=O)Nc1c[nH+]c2n1CCCC2)c1ccc2ccccc2c1 ZINC000452337248 1045801416 /nfs/dbraw/zinc/80/14/16/1045801416.db2.gz ZDCJYAAGZLWVMU-AWEZNQCLSA-N 1 2 319.408 4.115 20 0 DIADLO CCOc1cccc([C@H](C)[NH2+][C@@H]2COc3cc(F)cc(F)c32)c1 ZINC000753764150 1045802284 /nfs/dbraw/zinc/80/22/84/1045802284.db2.gz RLHMAKCRXFVPPM-MEDUHNTESA-N 1 2 319.351 4.148 20 0 DIADLO CCOc1cccc([C@H](C)[NH2+][C@H]2COc3cc(F)cc(F)c32)c1 ZINC000753764151 1045802297 /nfs/dbraw/zinc/80/22/97/1045802297.db2.gz RLHMAKCRXFVPPM-ZBEGNZNMSA-N 1 2 319.351 4.148 20 0 DIADLO C[C@H](C[NH2+]c1ccc(N2CCOC[C@H]2C)cc1)Cc1ccccc1 ZINC000753969403 1045825895 /nfs/dbraw/zinc/82/58/95/1045825895.db2.gz SOEUGWZQTKVCTH-ZWKOTPCHSA-N 1 2 324.468 4.202 20 0 DIADLO C[C@@H](C[NH2+]c1ccc(N2CCO[C@H](C)C2)cc1)Cc1ccccc1 ZINC000753969397 1045826037 /nfs/dbraw/zinc/82/60/37/1045826037.db2.gz SHPWARAVTMJWPP-QZTJIDSGSA-N 1 2 324.468 4.202 20 0 DIADLO c1cc(N2CCSCC2)ccc1[NH2+]C1CCC2(CC2)CC1 ZINC000754100839 1045845374 /nfs/dbraw/zinc/84/53/74/1045845374.db2.gz IXUDYSNUCJBWGU-UHFFFAOYSA-N 1 2 302.487 4.375 20 0 DIADLO FC[C@@H]([NH2+]Cc1cnc(C2CCC2)s1)c1ccc(F)cc1 ZINC000631282499 1045846599 /nfs/dbraw/zinc/84/65/99/1045846599.db2.gz BMYCMVJPTRJECM-OAHLLOKOSA-N 1 2 308.397 4.350 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+]2CCC[C@@H]2c2ccccn2)n1 ZINC000531523814 1045862227 /nfs/dbraw/zinc/86/22/27/1045862227.db2.gz VOEXIURNOXCUFH-CQSZACIVSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1csc(C[N@H+]2CCC[C@@H]2c2ccccn2)n1 ZINC000531523814 1045862236 /nfs/dbraw/zinc/86/22/36/1045862236.db2.gz VOEXIURNOXCUFH-CQSZACIVSA-N 1 2 301.459 4.173 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@@H](F)C2)ccc1Br ZINC001137613039 1045908088 /nfs/dbraw/zinc/90/80/88/1045908088.db2.gz GJYVDKUWWWAJEB-CYBMUJFWSA-N 1 2 300.215 4.082 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)c(Cl)c1)Cn1cccnc1=S ZINC000192555712 1045865671 /nfs/dbraw/zinc/86/56/71/1045865671.db2.gz OQILJVMDWPOCTO-UHFFFAOYSA-N 1 2 314.241 4.009 20 0 DIADLO C[N@H+](Cc1ccc(Cl)c(Cl)c1)Cn1cccnc1=S ZINC000192555712 1045865680 /nfs/dbraw/zinc/86/56/80/1045865680.db2.gz OQILJVMDWPOCTO-UHFFFAOYSA-N 1 2 314.241 4.009 20 0 DIADLO c1csc([C@H]([NH2+][C@@H]2CCCc3ncccc32)c2ccccc2)n1 ZINC000631577612 1045874668 /nfs/dbraw/zinc/87/46/68/1045874668.db2.gz RHGFRXHRARDWHK-QZTJIDSGSA-N 1 2 321.449 4.295 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccccc2Cl)C[C@@H](c2ccsc2)O1 ZINC000531588440 1045875611 /nfs/dbraw/zinc/87/56/11/1045875611.db2.gz XJEFAISLAOPCBD-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccccc2Cl)C[C@@H](c2ccsc2)O1 ZINC000531588440 1045875622 /nfs/dbraw/zinc/87/56/22/1045875622.db2.gz XJEFAISLAOPCBD-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1coc(-c2ccc(C)cc2)n1 ZINC000754342923 1045877072 /nfs/dbraw/zinc/87/70/72/1045877072.db2.gz VBWVHJFGNQQCIW-LBPRGKRZSA-N 1 2 311.385 4.106 20 0 DIADLO CCC[C@@H]([NH2+]Cc1csc([C@@H](C)OC)n1)c1cc(C)ccn1 ZINC000631587165 1045880072 /nfs/dbraw/zinc/88/00/72/1045880072.db2.gz PLCBEDJLUCNGKX-UKRRQHHQSA-N 1 2 319.474 4.185 20 0 DIADLO C[C@@H](CC(=O)OCc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000754494680 1045893515 /nfs/dbraw/zinc/89/35/15/1045893515.db2.gz ZLGKIXTYRKAAPK-INIZCTEOSA-N 1 2 320.392 4.109 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](CCc2ccccc2)c2ccccn2)no1 ZINC000631672282 1045902969 /nfs/dbraw/zinc/90/29/69/1045902969.db2.gz HDIYWWGMFJIOSK-LPHOPBHVSA-N 1 2 321.424 4.403 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](CCc2ccccc2)c2ccccn2)no1 ZINC000631672284 1045902995 /nfs/dbraw/zinc/90/29/95/1045902995.db2.gz HDIYWWGMFJIOSK-VQIMIIECSA-N 1 2 321.424 4.403 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(Cl)cncc2Cl)CCC1(F)F ZINC001137604473 1045903642 /nfs/dbraw/zinc/90/36/42/1045903642.db2.gz UCZYUXLYFNYMQE-VIFPVBQESA-N 1 2 309.187 4.256 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(Cl)cncc2Cl)CCC1(F)F ZINC001137604473 1045903652 /nfs/dbraw/zinc/90/36/52/1045903652.db2.gz UCZYUXLYFNYMQE-VIFPVBQESA-N 1 2 309.187 4.256 20 0 DIADLO C[N@H+](CCCc1ccccc1)Cc1c(Cl)cncc1Cl ZINC001137608210 1045905032 /nfs/dbraw/zinc/90/50/32/1045905032.db2.gz LJMUKIDQFZLYET-UHFFFAOYSA-N 1 2 309.240 4.453 20 0 DIADLO C[N@@H+](CCCc1ccccc1)Cc1c(Cl)cncc1Cl ZINC001137608210 1045905043 /nfs/dbraw/zinc/90/50/43/1045905043.db2.gz LJMUKIDQFZLYET-UHFFFAOYSA-N 1 2 309.240 4.453 20 0 DIADLO Cc1ccc(CC[N@@H+](C)Cc2c(Cl)cncc2Cl)cc1 ZINC001137609513 1045905337 /nfs/dbraw/zinc/90/53/37/1045905337.db2.gz RLJFLTLFXKCRNE-UHFFFAOYSA-N 1 2 309.240 4.371 20 0 DIADLO Cc1ccc(CC[N@H+](C)Cc2c(Cl)cncc2Cl)cc1 ZINC001137609513 1045905352 /nfs/dbraw/zinc/90/53/52/1045905352.db2.gz RLJFLTLFXKCRNE-UHFFFAOYSA-N 1 2 309.240 4.371 20 0 DIADLO Clc1cncc(Cl)c1C[N@@H+]1CCCc2ccccc2C1 ZINC001137609083 1045905797 /nfs/dbraw/zinc/90/57/97/1045905797.db2.gz FUFRAKFEIVIXPD-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO Clc1cncc(Cl)c1C[N@H+]1CCCc2ccccc2C1 ZINC001137609083 1045905807 /nfs/dbraw/zinc/90/58/07/1045905807.db2.gz FUFRAKFEIVIXPD-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO C[N@H+](Cc1nc(-c2ccccc2)c[nH]1)C[C@@]1(C)CC1(Cl)Cl ZINC000828392314 1045906084 /nfs/dbraw/zinc/90/60/84/1045906084.db2.gz SLZXVLWGPQQAOK-OAHLLOKOSA-N 1 2 324.255 4.092 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccccc2)c[nH]1)C[C@@]1(C)CC1(Cl)Cl ZINC000828392314 1045906089 /nfs/dbraw/zinc/90/60/89/1045906089.db2.gz SLZXVLWGPQQAOK-OAHLLOKOSA-N 1 2 324.255 4.092 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@@H](F)C2)ccc1Br ZINC001137613039 1045908078 /nfs/dbraw/zinc/90/80/78/1045908078.db2.gz GJYVDKUWWWAJEB-CYBMUJFWSA-N 1 2 300.215 4.082 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@@H](C)c1nc2ccccc2s1 ZINC000754697929 1045914856 /nfs/dbraw/zinc/91/48/56/1045914856.db2.gz DZTODVSVHGMEOT-NSHDSACASA-N 1 2 316.401 4.295 20 0 DIADLO COc1ccc2c(c1)CC[N@@H+](Cc1ccc(Cl)c(F)c1)C2 ZINC001137649516 1045918266 /nfs/dbraw/zinc/91/82/66/1045918266.db2.gz GKSJZEGMZWGBBV-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc2c(c1)CC[N@H+](Cc1ccc(Cl)c(F)c1)C2 ZINC001137649516 1045918272 /nfs/dbraw/zinc/91/82/72/1045918272.db2.gz GKSJZEGMZWGBBV-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Oc1cccc2c1CCC[C@H]2[NH2+][C@@H](CF)c1ccc(F)cc1 ZINC000631798183 1045918873 /nfs/dbraw/zinc/91/88/73/1045918873.db2.gz OBZPXIWVMUVODF-SJORKVTESA-N 1 2 303.352 4.209 20 0 DIADLO Oc1ccc2c(c1)[C@H]([NH2+][C@@H](CF)c1ccc(F)cc1)CCC2 ZINC000631798412 1045919368 /nfs/dbraw/zinc/91/93/68/1045919368.db2.gz SEJYHTNGYUSBJV-MSOLQXFVSA-N 1 2 303.352 4.209 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)cc1OC ZINC000631795316 1045920119 /nfs/dbraw/zinc/92/01/19/1045920119.db2.gz HZTZHNTZZNYLTO-WBMJQRKESA-N 1 2 321.367 4.204 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1ccc(C2CC2)cc1F)n1cc[nH+]c1 ZINC000828611113 1045921226 /nfs/dbraw/zinc/92/12/26/1045921226.db2.gz MYUDHTXDPYXQEQ-QGZVFWFLSA-N 1 2 315.392 4.126 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1cc2ccccc2s1 ZINC001137686618 1045933349 /nfs/dbraw/zinc/93/33/49/1045933349.db2.gz MXUDUJVCRQLREW-LBPRGKRZSA-N 1 2 305.443 4.063 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1cc2ccccc2s1 ZINC001137686618 1045933356 /nfs/dbraw/zinc/93/33/56/1045933356.db2.gz MXUDUJVCRQLREW-LBPRGKRZSA-N 1 2 305.443 4.063 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](CC(=O)NC1CCCCCCC1)C1CC1 ZINC000754869691 1045935932 /nfs/dbraw/zinc/93/59/32/1045935932.db2.gz COAPCEOCGWBONG-HNNXBMFYSA-N 1 2 318.461 4.034 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](CC(=O)NC1CCCCCCC1)C1CC1 ZINC000754869691 1045935944 /nfs/dbraw/zinc/93/59/44/1045935944.db2.gz COAPCEOCGWBONG-HNNXBMFYSA-N 1 2 318.461 4.034 20 0 DIADLO O=C1CC[N@@H+](Cc2c[nH]c3ccc(Cl)cc23)[C@H]2CCCC[C@@H]12 ZINC001137708559 1045941025 /nfs/dbraw/zinc/94/10/25/1045941025.db2.gz YKUXQWOQRJLEOB-PBHICJAKSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c[nH]c3ccc(Cl)cc23)[C@H]2CCCC[C@@H]12 ZINC001137708559 1045941032 /nfs/dbraw/zinc/94/10/32/1045941032.db2.gz YKUXQWOQRJLEOB-PBHICJAKSA-N 1 2 316.832 4.155 20 0 DIADLO F[C@@H]1C[N@H+](Cc2c[nH]c3ccc(Cl)cc23)CCCC1(F)F ZINC001137708023 1045941354 /nfs/dbraw/zinc/94/13/54/1045941354.db2.gz DWIZQOSMJVUWSN-CQSZACIVSA-N 1 2 316.754 4.391 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2c[nH]c3ccc(Cl)cc23)CCCC1(F)F ZINC001137708023 1045941375 /nfs/dbraw/zinc/94/13/75/1045941375.db2.gz DWIZQOSMJVUWSN-CQSZACIVSA-N 1 2 316.754 4.391 20 0 DIADLO Cc1ccc(OC2CC[NH+](Cc3scnc3Cl)CC2)cc1 ZINC001137821269 1045972915 /nfs/dbraw/zinc/97/29/15/1045972915.db2.gz ISXUBNDAUCVOLJ-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO C[N@H+](CCC(=O)c1ccccc1)Cc1cc(F)ccc1Cl ZINC001138674621 1045973143 /nfs/dbraw/zinc/97/31/43/1045973143.db2.gz XUBCRBYGYWASGE-UHFFFAOYSA-N 1 2 305.780 4.184 20 0 DIADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1cc(F)ccc1Cl ZINC001138674621 1045973151 /nfs/dbraw/zinc/97/31/51/1045973151.db2.gz XUBCRBYGYWASGE-UHFFFAOYSA-N 1 2 305.780 4.184 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1ccc(-n2ccnc2)cc1 ZINC000193202573 1045978897 /nfs/dbraw/zinc/97/88/97/1045978897.db2.gz ZICJGXVRUGOMOL-HNNXBMFYSA-N 1 2 306.413 4.111 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccncc1F)c1ncc(-c2ccccc2)n1C ZINC000453207014 1045984522 /nfs/dbraw/zinc/98/45/22/1045984522.db2.gz FVEVITRNNKNSHL-KBPBESRZSA-N 1 2 324.403 4.033 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2cc(F)cc(F)c2F)c1 ZINC001137873700 1045995780 /nfs/dbraw/zinc/99/57/80/1045995780.db2.gz QKEAJMGEEKTWKS-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2cc(F)cc(F)c2F)c1 ZINC001137873700 1045995785 /nfs/dbraw/zinc/99/57/85/1045995785.db2.gz QKEAJMGEEKTWKS-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[NH+]1CCC(c2ccncc2)CC1 ZINC001137881317 1045996478 /nfs/dbraw/zinc/99/64/78/1045996478.db2.gz LTUDEOLOHHCGDZ-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[NH+]1CCC(OC2CCC2)CC1 ZINC001137877975 1045997148 /nfs/dbraw/zinc/99/71/48/1045997148.db2.gz GBGVYTDIJKJHGX-UHFFFAOYSA-N 1 2 315.791 4.152 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1ccc(OCC(F)(F)F)cc1)C(F)F ZINC000453252766 1046006020 /nfs/dbraw/zinc/00/60/20/1046006020.db2.gz VQGWIBFODQTOKK-SKDRFNHKSA-N 1 2 311.294 4.322 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@H](C)c2nc3ccccc3s2)n1 ZINC000080273948 1046016090 /nfs/dbraw/zinc/01/60/90/1046016090.db2.gz ZEWDOKKXRGTQOO-GHMZBOCLSA-N 1 2 303.456 4.473 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+][C@H](C)C(C)(F)F)cc1OCC ZINC000453289013 1046016341 /nfs/dbraw/zinc/01/63/41/1046016341.db2.gz MDYSZZBCUKAUQA-NWDGAFQWSA-N 1 2 301.377 4.178 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc(F)c(F)c1F ZINC001137939009 1046025696 /nfs/dbraw/zinc/02/56/96/1046025696.db2.gz DYYPFKIHBIOUHX-HNNXBMFYSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc(F)c(F)c1F ZINC001137939009 1046025713 /nfs/dbraw/zinc/02/57/13/1046025713.db2.gz DYYPFKIHBIOUHX-HNNXBMFYSA-N 1 2 321.342 4.450 20 0 DIADLO CC(C)Sc1ccc([C@H](C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000453314648 1046031365 /nfs/dbraw/zinc/03/13/65/1046031365.db2.gz FVNBAFPOWFPDFM-LBPRGKRZSA-N 1 2 323.893 4.425 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@H]2COCc2ccccc2)c(F)c1F ZINC001137968948 1046038392 /nfs/dbraw/zinc/03/83/92/1046038392.db2.gz ZATLRIUHSICXCA-KRWDZBQOSA-N 1 2 317.379 4.064 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@H]2COCc2ccccc2)c(F)c1F ZINC001137968948 1046038405 /nfs/dbraw/zinc/03/84/05/1046038405.db2.gz ZATLRIUHSICXCA-KRWDZBQOSA-N 1 2 317.379 4.064 20 0 DIADLO Fc1c(Cl)cc(C(F)(F)F)cc1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC001137989025 1046046961 /nfs/dbraw/zinc/04/69/61/1046046961.db2.gz MQXWMEQOZUQYOD-GZMMTYOYSA-N 1 2 307.718 4.482 20 0 DIADLO Fc1c(Cl)cc(C(F)(F)F)cc1C[N@H+]1C[C@H]2CC[C@@H]1C2 ZINC001137989025 1046046979 /nfs/dbraw/zinc/04/69/79/1046046979.db2.gz MQXWMEQOZUQYOD-GZMMTYOYSA-N 1 2 307.718 4.482 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1OC(F)F ZINC000453358763 1046057498 /nfs/dbraw/zinc/05/74/98/1046057498.db2.gz QANIXZMVDCRWMZ-QWHCGFSZSA-N 1 2 323.387 4.225 20 0 DIADLO CCc1ncc(C[NH2+][C@H]2CCc3cc(Cl)cc(Cl)c32)o1 ZINC000453381103 1046057929 /nfs/dbraw/zinc/05/79/29/1046057929.db2.gz LBVYMWITRVFTLL-ZDUSSCGKSA-N 1 2 311.212 4.321 20 0 DIADLO CCCn1cc([C@@H](C)[NH2+][C@H](C)c2oc3ccccc3c2C)nn1 ZINC000902765631 1046065583 /nfs/dbraw/zinc/06/55/83/1046065583.db2.gz REUVPLNSHFPTGD-ZIAGYGMSSA-N 1 2 312.417 4.155 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3ccccc3nc2Cl)CC2(CCC2)O1 ZINC000830708976 1046093695 /nfs/dbraw/zinc/09/36/95/1046093695.db2.gz VCOOJWRNUKMTKT-ZDUSSCGKSA-N 1 2 316.832 4.032 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3ccccc3nc2Cl)CC2(CCC2)O1 ZINC000830708976 1046093708 /nfs/dbraw/zinc/09/37/08/1046093708.db2.gz VCOOJWRNUKMTKT-ZDUSSCGKSA-N 1 2 316.832 4.032 20 0 DIADLO Cc1ccoc1C[N@@H+]1CCC[C@@H]1c1ccc(Br)cn1 ZINC000453618976 1046099951 /nfs/dbraw/zinc/09/99/51/1046099951.db2.gz VOSIOIJPQFKHOJ-CQSZACIVSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ccoc1C[N@H+]1CCC[C@@H]1c1ccc(Br)cn1 ZINC000453618976 1046099962 /nfs/dbraw/zinc/09/99/62/1046099962.db2.gz VOSIOIJPQFKHOJ-CQSZACIVSA-N 1 2 321.218 4.083 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@@H+]2Cc2ccsc2)nc1 ZINC000453622185 1046100171 /nfs/dbraw/zinc/10/01/71/1046100171.db2.gz ZUBHBLXTZKRWIH-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@H+]2Cc2ccsc2)nc1 ZINC000453622185 1046100177 /nfs/dbraw/zinc/10/01/77/1046100177.db2.gz ZUBHBLXTZKRWIH-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1)Cc1c(F)ccc(C)c1F ZINC001138119581 1046100544 /nfs/dbraw/zinc/10/05/44/1046100544.db2.gz JVXNPVALDCXEKX-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1)Cc1c(F)ccc(C)c1F ZINC001138119581 1046100550 /nfs/dbraw/zinc/10/05/50/1046100550.db2.gz JVXNPVALDCXEKX-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CC1(C)Cc2ccsc2C[N@@H+]1Cc1csc(C2CC2)n1 ZINC000453626166 1046103602 /nfs/dbraw/zinc/10/36/02/1046103602.db2.gz SRSBYFJHLAKFHA-UHFFFAOYSA-N 1 2 304.484 4.419 20 0 DIADLO CC1(C)Cc2ccsc2C[N@H+]1Cc1csc(C2CC2)n1 ZINC000453626166 1046103605 /nfs/dbraw/zinc/10/36/05/1046103605.db2.gz SRSBYFJHLAKFHA-UHFFFAOYSA-N 1 2 304.484 4.419 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2cc(O)ccc2Br)c1 ZINC001138142363 1046106104 /nfs/dbraw/zinc/10/61/04/1046106104.db2.gz SIPDOXSMYMKCFL-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2cc(O)ccc2Br)c1 ZINC001138142363 1046106107 /nfs/dbraw/zinc/10/61/07/1046106107.db2.gz SIPDOXSMYMKCFL-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO C[C@H]1COCC[C@H]1[NH2+]c1ccc(N(C)Cc2ccccc2)cc1 ZINC000195085994 1046112466 /nfs/dbraw/zinc/11/24/66/1046112466.db2.gz JPOWKROBWGLUDF-OXJNMPFZSA-N 1 2 310.441 4.160 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1ccc(C(F)(F)F)cn1 ZINC000902928361 1046115295 /nfs/dbraw/zinc/11/52/95/1046115295.db2.gz LCXOFOUYWUJJDC-NSHDSACASA-N 1 2 309.335 4.340 20 0 DIADLO Fc1cc(F)c(F)c(C[NH+]2CCC3(CC[C@H](F)C3)CC2)c1F ZINC001138236688 1046124717 /nfs/dbraw/zinc/12/47/17/1046124717.db2.gz LYVADCCNFHUILB-JTQLQIEISA-N 1 2 319.317 4.347 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1oc(-c3ccccc3)nc1C)C2 ZINC000639895096 1046133560 /nfs/dbraw/zinc/13/35/60/1046133560.db2.gz XQCDOHDGCGFHDU-UHFFFAOYSA-N 1 2 320.392 4.174 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1oc(-c3ccccc3)nc1C)C2 ZINC000639895096 1046133566 /nfs/dbraw/zinc/13/35/66/1046133566.db2.gz XQCDOHDGCGFHDU-UHFFFAOYSA-N 1 2 320.392 4.174 20 0 DIADLO CCOc1cccc(/C=[NH+]/CCCn2ccc3ccccc32)c1O ZINC000005228111 1046138115 /nfs/dbraw/zinc/13/81/15/1046138115.db2.gz LMOJJHHYZMNLFR-RCCKNPSSSA-N 1 2 322.408 4.255 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1cccc(C)c1)c1ccco1 ZINC000151118297 1046144649 /nfs/dbraw/zinc/14/46/49/1046144649.db2.gz JVJPAPGMNZYPRG-FQEVSTJZSA-N 1 2 307.393 4.476 20 0 DIADLO COc1cc(Cl)c(C[NH+]2CCC(C(F)F)CC2)c(Cl)c1 ZINC001142293717 1046146971 /nfs/dbraw/zinc/14/69/71/1046146971.db2.gz ZEUBORYRMYWYHG-UHFFFAOYSA-N 1 2 324.198 4.479 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[NH2+]Cc1ncc(C)s1 ZINC000903103610 1046162534 /nfs/dbraw/zinc/16/25/34/1046162534.db2.gz LBENAEVJTSLSMC-CYBMUJFWSA-N 1 2 322.861 4.281 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccc(C(F)(F)F)s2)cs1 ZINC000718000554 1046162901 /nfs/dbraw/zinc/16/29/01/1046162901.db2.gz QONLGTUAKFYHCV-SSDOTTSWSA-N 1 2 306.378 4.383 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(C(F)(F)F)s2)s1 ZINC000717963525 1046163081 /nfs/dbraw/zinc/16/30/81/1046163081.db2.gz UOQGPYMMACIIMB-RNFRBKRXSA-N 1 2 321.393 4.339 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1[nH]c3ccccc3c1C)CC2 ZINC001138399765 1046164900 /nfs/dbraw/zinc/16/49/00/1046164900.db2.gz IWQZQNBDUBEPDG-UHFFFAOYSA-N 1 2 318.420 4.237 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1[nH]c3ccccc3c1C)CC2 ZINC001138399765 1046164904 /nfs/dbraw/zinc/16/49/04/1046164904.db2.gz IWQZQNBDUBEPDG-UHFFFAOYSA-N 1 2 318.420 4.237 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc(F)c(C(F)(F)F)c1 ZINC000090208742 1046165297 /nfs/dbraw/zinc/16/52/97/1046165297.db2.gz INELHLFHMBCLHG-UHFFFAOYSA-N 1 2 301.287 4.234 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)C[NH+]1CCC(CC(C)C)CC1 ZINC000757085435 1046166673 /nfs/dbraw/zinc/16/66/73/1046166673.db2.gz YNXXZTBEZZVIIK-UHFFFAOYSA-N 1 2 322.880 4.345 20 0 DIADLO CC(C)c1csc(C[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)n1 ZINC000903113768 1046167024 /nfs/dbraw/zinc/16/70/24/1046167024.db2.gz RBFOQADUJMTUES-ZDUSSCGKSA-N 1 2 318.490 4.114 20 0 DIADLO CC(C)c1csc(C[NH2+][C@H](C)c2cnn(CC3CCC3)c2)n1 ZINC000903113767 1046168424 /nfs/dbraw/zinc/16/84/24/1046168424.db2.gz RBFOQADUJMTUES-CYBMUJFWSA-N 1 2 318.490 4.114 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[NH2+]Cc1ncccc1F ZINC000903128494 1046170536 /nfs/dbraw/zinc/17/05/36/1046170536.db2.gz ZPTKDZUEPMAOEL-CQSZACIVSA-N 1 2 320.795 4.050 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](CC(C)C)n2cc[nH+]c2)c(Cl)c1 ZINC000635068642 1046173604 /nfs/dbraw/zinc/17/36/04/1046173604.db2.gz LCEUCFFSOZKVBW-OAHLLOKOSA-N 1 2 305.809 4.071 20 0 DIADLO CC[N@H+](CC(=O)Nc1c(C)cc(C)cc1Cl)Cc1ccoc1 ZINC000102409130 1046179392 /nfs/dbraw/zinc/17/93/92/1046179392.db2.gz IMLAUPXTAWZXHN-UHFFFAOYSA-N 1 2 320.820 4.010 20 0 DIADLO CC[N@@H+](CC(=O)Nc1c(C)cc(C)cc1Cl)Cc1ccoc1 ZINC000102409130 1046179400 /nfs/dbraw/zinc/17/94/00/1046179400.db2.gz IMLAUPXTAWZXHN-UHFFFAOYSA-N 1 2 320.820 4.010 20 0 DIADLO Cc1cc([C@H](C)NC(=O)[C@@H](CC(C)C)n2cc[nH+]c2)c(C)s1 ZINC000635252252 1046182529 /nfs/dbraw/zinc/18/25/29/1046182529.db2.gz LUPSOXOITULTAT-XJKSGUPXSA-N 1 2 319.474 4.026 20 0 DIADLO CCOc1ccc2ccccc2c1C[N@@H+]1Cc2ccncc2C1 ZINC001138443677 1046182873 /nfs/dbraw/zinc/18/28/73/1046182873.db2.gz HBSKEFCOHGEMAF-UHFFFAOYSA-N 1 2 304.393 4.149 20 0 DIADLO CCOc1ccc2ccccc2c1C[N@H+]1Cc2ccncc2C1 ZINC001138443677 1046182880 /nfs/dbraw/zinc/18/28/80/1046182880.db2.gz HBSKEFCOHGEMAF-UHFFFAOYSA-N 1 2 304.393 4.149 20 0 DIADLO Cc1ccc(-c2n[nH]cc2C[N@@H+]2Cc3ccc(F)cc3C2)cc1 ZINC001138447758 1046184838 /nfs/dbraw/zinc/18/48/38/1046184838.db2.gz MTRHGAVSQURFFF-UHFFFAOYSA-N 1 2 307.372 4.040 20 0 DIADLO Cc1ccc(-c2n[nH]cc2C[N@H+]2Cc3ccc(F)cc3C2)cc1 ZINC001138447758 1046184844 /nfs/dbraw/zinc/18/48/44/1046184844.db2.gz MTRHGAVSQURFFF-UHFFFAOYSA-N 1 2 307.372 4.040 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CCCc3ccc(OC)c(Cl)c32)co1 ZINC000903188104 1046187040 /nfs/dbraw/zinc/18/70/40/1046187040.db2.gz YCNNDTWTOTYURE-ZDUSSCGKSA-N 1 2 320.820 4.066 20 0 DIADLO C[C@H]([NH2+]Cc1nccc2c1CCCC2)c1c(F)cccc1F ZINC000903183763 1046187244 /nfs/dbraw/zinc/18/72/44/1046187244.db2.gz GJTNCJUTGILHMA-LBPRGKRZSA-N 1 2 302.368 4.089 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1cccc(C(F)F)c1)n1cc[nH+]c1 ZINC000635470481 1046191739 /nfs/dbraw/zinc/19/17/39/1046191739.db2.gz GIENBFTZVDVYLB-CQSZACIVSA-N 1 2 307.344 4.047 20 0 DIADLO CCCc1nc(C[N@H+](C)[C@@H](C)[C@@H](C)c2ccc(Cl)cc2)no1 ZINC000475743768 1046193080 /nfs/dbraw/zinc/19/30/80/1046193080.db2.gz LDEUBSXZDAXUHU-OLZOCXBDSA-N 1 2 321.852 4.300 20 0 DIADLO CCCc1nc(C[N@@H+](C)[C@@H](C)[C@@H](C)c2ccc(Cl)cc2)no1 ZINC000475743768 1046193085 /nfs/dbraw/zinc/19/30/85/1046193085.db2.gz LDEUBSXZDAXUHU-OLZOCXBDSA-N 1 2 321.852 4.300 20 0 DIADLO COc1ccc(C[N@@H+]2CCC(=O)[C@@H](C)C23CCCC3)cc1Cl ZINC001138473259 1046194826 /nfs/dbraw/zinc/19/48/26/1046194826.db2.gz SAFIGRIZENVCBF-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO COc1ccc(C[N@H+]2CCC(=O)[C@@H](C)C23CCCC3)cc1Cl ZINC001138473259 1046194828 /nfs/dbraw/zinc/19/48/28/1046194828.db2.gz SAFIGRIZENVCBF-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO COc1ccnc(C[N@H+](C)[C@H](C)[C@@H](C)c2ccc(Cl)cc2)c1 ZINC000475745779 1046194982 /nfs/dbraw/zinc/19/49/82/1046194982.db2.gz WZUQGNGWJMNINS-ZIAGYGMSSA-N 1 2 318.848 4.368 20 0 DIADLO COc1ccnc(C[N@@H+](C)[C@H](C)[C@@H](C)c2ccc(Cl)cc2)c1 ZINC000475745779 1046194986 /nfs/dbraw/zinc/19/49/86/1046194986.db2.gz WZUQGNGWJMNINS-ZIAGYGMSSA-N 1 2 318.848 4.368 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1)N1CC[C@@H]([NH3+])c2ccccc21 ZINC001168154557 1046195007 /nfs/dbraw/zinc/19/50/07/1046195007.db2.gz NCPJSZSLNGXXRT-CXAGYDPISA-N 1 2 300.833 4.181 20 0 DIADLO COc1ccnc(C[N@H+](C)[C@@H](C)[C@H](C)c2ccc(Cl)cc2)c1 ZINC000475745776 1046195036 /nfs/dbraw/zinc/19/50/36/1046195036.db2.gz WZUQGNGWJMNINS-KBPBESRZSA-N 1 2 318.848 4.368 20 0 DIADLO COc1ccnc(C[N@@H+](C)[C@@H](C)[C@H](C)c2ccc(Cl)cc2)c1 ZINC000475745776 1046195039 /nfs/dbraw/zinc/19/50/39/1046195039.db2.gz WZUQGNGWJMNINS-KBPBESRZSA-N 1 2 318.848 4.368 20 0 DIADLO CCn1ccc(C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)n1 ZINC001202833350 1046196667 /nfs/dbraw/zinc/19/66/67/1046196667.db2.gz POPURJWPNPHBBB-UHFFFAOYSA-N 1 2 315.804 4.106 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)c(F)c1 ZINC000903225925 1046197886 /nfs/dbraw/zinc/19/78/86/1046197886.db2.gz ILCRCSUCOPVHNW-ZDUSSCGKSA-N 1 2 319.399 4.121 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1cccc(C(C)(F)F)c1)n1cc[nH+]c1 ZINC000635832094 1046207791 /nfs/dbraw/zinc/20/77/91/1046207791.db2.gz SFFHYQWROVZKRY-OAHLLOKOSA-N 1 2 321.371 4.221 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2C/C=C\c2ccc(F)cc2F)no1 ZINC000757733434 1046207990 /nfs/dbraw/zinc/20/79/90/1046207990.db2.gz UVERJLQSEFPCCQ-POKLJVKSSA-N 1 2 304.340 4.112 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2C/C=C\c2ccc(F)cc2F)no1 ZINC000757733434 1046208003 /nfs/dbraw/zinc/20/80/03/1046208003.db2.gz UVERJLQSEFPCCQ-POKLJVKSSA-N 1 2 304.340 4.112 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@@H]2CC3(CCC3)Oc3ccccc32)[nH+]1 ZINC000757793050 1046213624 /nfs/dbraw/zinc/21/36/24/1046213624.db2.gz XSGPQTUQTZTCBM-OAHLLOKOSA-N 1 2 320.396 4.125 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1ccccc1C(F)F)n1cc[nH+]c1 ZINC000636066066 1046214139 /nfs/dbraw/zinc/21/41/39/1046214139.db2.gz TUAPPGIZDBJNBB-CQSZACIVSA-N 1 2 307.344 4.047 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1coc(-c2cccc(F)c2)n1 ZINC000102518792 1046217089 /nfs/dbraw/zinc/21/70/89/1046217089.db2.gz ACBFWVUIPRDXKF-UHFFFAOYSA-N 1 2 300.333 4.096 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1coc(-c2cccc(F)c2)n1 ZINC000102518792 1046217095 /nfs/dbraw/zinc/21/70/95/1046217095.db2.gz ACBFWVUIPRDXKF-UHFFFAOYSA-N 1 2 300.333 4.096 20 0 DIADLO Cc1cn2cccc(Nc3ccc(Br)cc3F)c2[nH+]1 ZINC001212869360 1046228309 /nfs/dbraw/zinc/22/83/09/1046228309.db2.gz SWKYQUMZYMEUNB-UHFFFAOYSA-N 1 2 320.165 4.288 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2CC[C@@H]2c2ccc(F)cc2)c(C)[nH+]1 ZINC000636581472 1046230964 /nfs/dbraw/zinc/23/09/64/1046230964.db2.gz CHWHBYSEILUGAJ-SJORKVTESA-N 1 2 312.388 4.278 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2CC[C@H]2c2ccc(F)cc2)c(C)[nH+]1 ZINC000636581469 1046231078 /nfs/dbraw/zinc/23/10/78/1046231078.db2.gz CHWHBYSEILUGAJ-DLBZAZTESA-N 1 2 312.388 4.278 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccc(Cl)nc1 ZINC000179113497 1046244245 /nfs/dbraw/zinc/24/42/45/1046244245.db2.gz YSINFQJKSINEPN-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO CCC[C@@H]([NH2+][C@@H](C)c1cc(OC)no1)c1ccc(F)cc1F ZINC000925266080 1046245518 /nfs/dbraw/zinc/24/55/18/1046245518.db2.gz WYMRJAWTNVWBNY-IINYFYTJSA-N 1 2 310.344 4.153 20 0 DIADLO O=C1CC[N@@H+](Cc2c(Cl)[nH]c3ccccc32)[C@@H]2CCCC[C@H]12 ZINC001138684770 1046268089 /nfs/dbraw/zinc/26/80/89/1046268089.db2.gz PZSBEOPCYAPQKW-XJKSGUPXSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c(Cl)[nH]c3ccccc32)[C@@H]2CCCC[C@H]12 ZINC001138684770 1046268100 /nfs/dbraw/zinc/26/81/00/1046268100.db2.gz PZSBEOPCYAPQKW-XJKSGUPXSA-N 1 2 316.832 4.155 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(-c3ccccn3)nc2)[C@@H]1c1ccco1 ZINC000639930485 1046270322 /nfs/dbraw/zinc/27/03/22/1046270322.db2.gz XJNAHNYDCGYUQC-LJQANCHMSA-N 1 2 319.408 4.320 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(-c3ccccn3)nc2)[C@@H]1c1ccco1 ZINC000639930485 1046270330 /nfs/dbraw/zinc/27/03/30/1046270330.db2.gz XJNAHNYDCGYUQC-LJQANCHMSA-N 1 2 319.408 4.320 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1ccc(C(F)F)nc1)C1CC1 ZINC000637873280 1046281925 /nfs/dbraw/zinc/28/19/25/1046281925.db2.gz KLHZOPMWKVSMQJ-UHFFFAOYSA-N 1 2 306.331 4.323 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1ccc(C(F)F)nc1)C1CC1 ZINC000637873280 1046281937 /nfs/dbraw/zinc/28/19/37/1046281937.db2.gz KLHZOPMWKVSMQJ-UHFFFAOYSA-N 1 2 306.331 4.323 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)[C@@H](c1nccn1C)C1CC1 ZINC000637900731 1046283048 /nfs/dbraw/zinc/28/30/48/1046283048.db2.gz FRIBIVOYKGAZEQ-BLLLJJGKSA-N 1 2 303.837 4.218 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)[C@@H](c1nccn1C)C1CC1 ZINC000637900731 1046283063 /nfs/dbraw/zinc/28/30/63/1046283063.db2.gz FRIBIVOYKGAZEQ-BLLLJJGKSA-N 1 2 303.837 4.218 20 0 DIADLO Cc1ncc([C@@H](C)[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c(C)n1 ZINC000638120941 1046294146 /nfs/dbraw/zinc/29/41/46/1046294146.db2.gz HCRCZQXEDUIYMZ-PXAZEXFGSA-N 1 2 301.821 4.255 20 0 DIADLO Cc1ncc([C@@H](C)[N@H+]2CC[C@H]2c2ccc(Cl)cc2)c(C)n1 ZINC000638120941 1046294161 /nfs/dbraw/zinc/29/41/61/1046294161.db2.gz HCRCZQXEDUIYMZ-PXAZEXFGSA-N 1 2 301.821 4.255 20 0 DIADLO CCN(CC)c1ncc(C[N@H+](C)Cc2ccccc2Cl)s1 ZINC001138800200 1046295767 /nfs/dbraw/zinc/29/57/67/1046295767.db2.gz SFHNJYKFEQFMCQ-UHFFFAOYSA-N 1 2 323.893 4.275 20 0 DIADLO CCN(CC)c1ncc(C[N@@H+](C)Cc2ccccc2Cl)s1 ZINC001138800200 1046295782 /nfs/dbraw/zinc/29/57/82/1046295782.db2.gz SFHNJYKFEQFMCQ-UHFFFAOYSA-N 1 2 323.893 4.275 20 0 DIADLO C[C@@H]1CC(C)(C)c2ccccc2N1C(=O)c1cccc2[nH+]ccn21 ZINC000780115568 1046296355 /nfs/dbraw/zinc/29/63/55/1046296355.db2.gz PBLLPXVCYXBPMF-CQSZACIVSA-N 1 2 319.408 4.051 20 0 DIADLO C[C@H](CSC(C)(C)C)[NH2+]c1ccc(N2CCOC[C@@H]2C)cc1 ZINC000246052558 1046297692 /nfs/dbraw/zinc/29/76/92/1046297692.db2.gz AQRMKJLOBFUZTI-CABCVRRESA-N 1 2 322.518 4.244 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccnc(Cl)c1 ZINC001138821631 1046301745 /nfs/dbraw/zinc/30/17/45/1046301745.db2.gz YCEAYDZYVWAHQB-INIZCTEOSA-N 1 2 316.832 4.218 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccnc(Cl)c1 ZINC001138821631 1046301750 /nfs/dbraw/zinc/30/17/50/1046301750.db2.gz YCEAYDZYVWAHQB-INIZCTEOSA-N 1 2 316.832 4.218 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1cccc(F)c1)c1ccccn1 ZINC000089796967 1046313779 /nfs/dbraw/zinc/31/37/79/1046313779.db2.gz BGUQYOFQFURLQZ-FQEVSTJZSA-N 1 2 322.383 4.109 20 0 DIADLO C[C@H]([NH2+][C@H](c1nnc[nH]1)C1CCCCC1)c1ccc(Cl)s1 ZINC000638337081 1046315744 /nfs/dbraw/zinc/31/57/44/1046315744.db2.gz MBXAKLOYLYDSHI-HZMBPMFUSA-N 1 2 324.881 4.492 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncco1)c1ccc(OCC2CC2)c(F)c1 ZINC000925268475 1046318604 /nfs/dbraw/zinc/31/86/04/1046318604.db2.gz IDIJLRKHFIGKSB-NEPJUHHUSA-N 1 2 304.365 4.014 20 0 DIADLO Clc1ccc2sc(C[NH2+]Cc3cc(C4CC4)no3)nc2c1 ZINC000638443370 1046323051 /nfs/dbraw/zinc/32/30/51/1046323051.db2.gz LQTYRHGUWIQUMM-UHFFFAOYSA-N 1 2 319.817 4.105 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2CCSC[C@@H]2c2cccc3ccccc32)n1 ZINC001138943131 1046332121 /nfs/dbraw/zinc/33/21/21/1046332121.db2.gz YJKLINGHQLUSJZ-GOSISDBHSA-N 1 2 323.465 4.161 20 0 DIADLO Cc1c[nH]c(C[N@H+]2CCSC[C@@H]2c2cccc3ccccc32)n1 ZINC001138943131 1046332134 /nfs/dbraw/zinc/33/21/34/1046332134.db2.gz YJKLINGHQLUSJZ-GOSISDBHSA-N 1 2 323.465 4.161 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2nc3ccccc3nc2C)on1 ZINC000638690120 1046336297 /nfs/dbraw/zinc/33/62/97/1046336297.db2.gz PXSLGUYYAROQNP-UHFFFAOYSA-N 1 2 324.428 4.120 20 0 DIADLO Cc1nc(C[N@@H+]2[C@H](C)CO[C@@H](c3ccccc3)[C@@H]2C)sc1C ZINC000246324267 1046342834 /nfs/dbraw/zinc/34/28/34/1046342834.db2.gz XGKYEZGSHXXJCU-UVBSCNOISA-N 1 2 316.470 4.110 20 0 DIADLO Cc1nc(C[N@H+]2[C@H](C)CO[C@@H](c3ccccc3)[C@@H]2C)sc1C ZINC000246324267 1046342848 /nfs/dbraw/zinc/34/28/48/1046342848.db2.gz XGKYEZGSHXXJCU-UVBSCNOISA-N 1 2 316.470 4.110 20 0 DIADLO COc1ccc([C@@H]([NH2+][C@H](C)c2nc(C(C)C)no2)C2CC2)cc1 ZINC000170874218 1046351952 /nfs/dbraw/zinc/35/19/52/1046351952.db2.gz ARTNYNYIZWDVRS-WBMJQRKESA-N 1 2 315.417 4.004 20 0 DIADLO CCCOc1ccccc1C[N@@H+]1CCC[C@@H]1c1cc(C)on1 ZINC001138995779 1046353173 /nfs/dbraw/zinc/35/31/73/1046353173.db2.gz TWOYVRBCDXYKDE-QGZVFWFLSA-N 1 2 300.402 4.109 20 0 DIADLO CCCOc1ccccc1C[N@H+]1CCC[C@@H]1c1cc(C)on1 ZINC001138995779 1046353181 /nfs/dbraw/zinc/35/31/81/1046353181.db2.gz TWOYVRBCDXYKDE-QGZVFWFLSA-N 1 2 300.402 4.109 20 0 DIADLO C[C@H](CCCC(F)(F)F)[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1 ZINC000639106012 1046360324 /nfs/dbraw/zinc/36/03/24/1046360324.db2.gz KFIJYEPXWJYPHX-DGCLKSJQSA-N 1 2 318.387 4.137 20 0 DIADLO C[C@@H]([N@H+](C)Cn1nc(C(F)(F)F)sc1=S)C(C)(C)C ZINC000780424494 1046384600 /nfs/dbraw/zinc/38/46/00/1046384600.db2.gz CDPQUCQJWWAHPE-SSDOTTSWSA-N 1 2 313.414 4.017 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(F)cc(Cl)cc2F)CCC1(F)F ZINC001139046986 1046366877 /nfs/dbraw/zinc/36/68/77/1046366877.db2.gz BQCBHQLALJVFRQ-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(F)cc(Cl)cc2F)CCC1(F)F ZINC001139046986 1046366888 /nfs/dbraw/zinc/36/68/88/1046366888.db2.gz BQCBHQLALJVFRQ-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO C[C@@H]([N@@H+](C)Cn1nc(C(F)(F)F)sc1=S)C(C)(C)C ZINC000780424494 1046384608 /nfs/dbraw/zinc/38/46/08/1046384608.db2.gz CDPQUCQJWWAHPE-SSDOTTSWSA-N 1 2 313.414 4.017 20 0 DIADLO Cn1ccnc1[C@@H](C1CC1)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000639184907 1046368221 /nfs/dbraw/zinc/36/82/21/1046368221.db2.gz ZWNPBKITEFKPSR-CABCVRRESA-N 1 2 301.459 4.016 20 0 DIADLO Cn1ccnc1[C@@H](C1CC1)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000639184907 1046368233 /nfs/dbraw/zinc/36/82/33/1046368233.db2.gz ZWNPBKITEFKPSR-CABCVRRESA-N 1 2 301.459 4.016 20 0 DIADLO Cn1ccnc1[C@H](C1CC1)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000639184908 1046368734 /nfs/dbraw/zinc/36/87/34/1046368734.db2.gz ZWNPBKITEFKPSR-GJZGRUSLSA-N 1 2 301.459 4.016 20 0 DIADLO Cn1ccnc1[C@H](C1CC1)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000639184908 1046368741 /nfs/dbraw/zinc/36/87/41/1046368741.db2.gz ZWNPBKITEFKPSR-GJZGRUSLSA-N 1 2 301.459 4.016 20 0 DIADLO Fc1cc(Cl)cc(F)c1C[N@@H+]1CCC[C@H](c2ccccn2)C1 ZINC001139051320 1046369278 /nfs/dbraw/zinc/36/92/78/1046369278.db2.gz JZABBMIVENPNFG-LBPRGKRZSA-N 1 2 322.786 4.393 20 0 DIADLO Fc1cc(Cl)cc(F)c1C[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC001139051320 1046369289 /nfs/dbraw/zinc/36/92/89/1046369289.db2.gz JZABBMIVENPNFG-LBPRGKRZSA-N 1 2 322.786 4.393 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccc(Br)nc2Cl)[C@@H](C)C1 ZINC001139112023 1046386855 /nfs/dbraw/zinc/38/68/55/1046386855.db2.gz HLQFZCBJGJAZDK-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccc(Br)nc2Cl)[C@@H](C)C1 ZINC001139112023 1046386865 /nfs/dbraw/zinc/38/68/65/1046386865.db2.gz HLQFZCBJGJAZDK-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)cn1 ZINC000639234684 1046374168 /nfs/dbraw/zinc/37/41/68/1046374168.db2.gz KWSIIQSUVOJKHH-OAHLLOKOSA-N 1 2 304.340 4.339 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)cn1 ZINC000639234684 1046374184 /nfs/dbraw/zinc/37/41/84/1046374184.db2.gz KWSIIQSUVOJKHH-OAHLLOKOSA-N 1 2 304.340 4.339 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc(Br)nc1Cl ZINC001139112599 1046389270 /nfs/dbraw/zinc/38/92/70/1046389270.db2.gz SDKKHKBWHWNMEN-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc(Br)nc1Cl ZINC001139112599 1046389280 /nfs/dbraw/zinc/38/92/80/1046389280.db2.gz SDKKHKBWHWNMEN-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO c1cc(-c2n[nH]cc2CNc2ccc([NH+]3CCCC3)cc2)cs1 ZINC000780511152 1046390238 /nfs/dbraw/zinc/39/02/38/1046390238.db2.gz ZYDURRVHDRZBPP-UHFFFAOYSA-N 1 2 324.453 4.351 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1ncc(Cl)s1 ZINC000225314998 1046390997 /nfs/dbraw/zinc/39/09/97/1046390997.db2.gz NLELAEXDBCSLST-LLVKDONJSA-N 1 2 310.850 4.435 20 0 DIADLO Cc1cc(C[NH2+]Cc2ccc(F)c(-c3cccs3)c2)no1 ZINC000044412191 1046400493 /nfs/dbraw/zinc/40/04/93/1046400493.db2.gz VGTRXYLFLFCTEP-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO Clc1ccc(Cl)c(-c2ccc(C[N@@H+]3C[C@@H]4C[C@H]3CO4)o2)c1 ZINC001139165156 1046400661 /nfs/dbraw/zinc/40/06/61/1046400661.db2.gz ICJOCKVFKRWEGQ-AAEUAGOBSA-N 1 2 324.207 4.227 20 0 DIADLO Clc1ccc(Cl)c(-c2ccc(C[N@H+]3C[C@@H]4C[C@H]3CO4)o2)c1 ZINC001139165156 1046400663 /nfs/dbraw/zinc/40/06/63/1046400663.db2.gz ICJOCKVFKRWEGQ-AAEUAGOBSA-N 1 2 324.207 4.227 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+][C@@H](C)c1c(F)cccc1F ZINC000037997672 1046403625 /nfs/dbraw/zinc/40/36/25/1046403625.db2.gz OYIOGMXTSNOWEB-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO CCCCc1nc(Cl)c(C[N@H+](C)CCc2ccccc2F)[nH]1 ZINC001139181446 1046404409 /nfs/dbraw/zinc/40/44/09/1046404409.db2.gz AAYREDYVRLVOMT-UHFFFAOYSA-N 1 2 323.843 4.219 20 0 DIADLO CCCCc1nc(Cl)c(C[N@@H+](C)CCc2ccccc2F)[nH]1 ZINC001139181446 1046404412 /nfs/dbraw/zinc/40/44/12/1046404412.db2.gz AAYREDYVRLVOMT-UHFFFAOYSA-N 1 2 323.843 4.219 20 0 DIADLO CCCCc1nc(Cl)c(C[NH+]2CC(c3ccccc3)C2)[nH]1 ZINC001139179009 1046404518 /nfs/dbraw/zinc/40/45/18/1046404518.db2.gz AUXNJIBAOMHOAD-UHFFFAOYSA-N 1 2 303.837 4.005 20 0 DIADLO O[C@@H](C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1)c1cc(F)ccc1F ZINC000748825823 1046407883 /nfs/dbraw/zinc/40/78/83/1046407883.db2.gz ZGJJLLBVCBCXSF-IRXDYDNUSA-N 1 2 323.770 4.099 20 0 DIADLO O[C@@H](C[N@H+]1CC[C@H]1c1ccc(Cl)cc1)c1cc(F)ccc1F ZINC000748825823 1046407887 /nfs/dbraw/zinc/40/78/87/1046407887.db2.gz ZGJJLLBVCBCXSF-IRXDYDNUSA-N 1 2 323.770 4.099 20 0 DIADLO CC/C(C)=C(/C)C(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC000780905746 1046412434 /nfs/dbraw/zinc/41/24/34/1046412434.db2.gz ZJETURNGDNZQJF-HUTFPVNGSA-N 1 2 321.490 4.060 20 0 DIADLO CC/C(C)=C(/C)C(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000780905746 1046412438 /nfs/dbraw/zinc/41/24/38/1046412438.db2.gz ZJETURNGDNZQJF-HUTFPVNGSA-N 1 2 321.490 4.060 20 0 DIADLO FC(F)(F)Sc1cccc(CSCCn2cc[nH+]c2)c1 ZINC000781159349 1046426356 /nfs/dbraw/zinc/42/63/56/1046426356.db2.gz JQNRRWQJEKPTAS-UHFFFAOYSA-N 1 2 318.389 4.428 20 0 DIADLO O=C1CCC[N@@H+](Cc2ccccc2Oc2ccc(F)cc2)CC1 ZINC001139300803 1046427912 /nfs/dbraw/zinc/42/79/12/1046427912.db2.gz PPXPFUPGOUAKRD-UHFFFAOYSA-N 1 2 313.372 4.173 20 0 DIADLO O=C1CCC[N@H+](Cc2ccccc2Oc2ccc(F)cc2)CC1 ZINC001139300803 1046427917 /nfs/dbraw/zinc/42/79/17/1046427917.db2.gz PPXPFUPGOUAKRD-UHFFFAOYSA-N 1 2 313.372 4.173 20 0 DIADLO Brc1cc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)cs1 ZINC000125389085 1046465398 /nfs/dbraw/zinc/46/53/98/1046465398.db2.gz IQBPYAHQUPHUNT-LBPRGKRZSA-N 1 2 311.248 4.176 20 0 DIADLO Cc1cccn2c(CNC(=O)Nc3ccc(C(C)C)cc3)c[nH+]c12 ZINC001202927014 1046438592 /nfs/dbraw/zinc/43/85/92/1046438592.db2.gz HLTJQEQFRMYPRW-UHFFFAOYSA-N 1 2 322.412 4.088 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2ncc(Cl)cc2Cl)s1 ZINC000639994854 1046441711 /nfs/dbraw/zinc/44/17/11/1046441711.db2.gz FWUPNJPUJMNUPA-ZETCQYMHSA-N 1 2 302.230 4.004 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2ncc(-c3ccccc3C)o2)s1 ZINC000639993885 1046441828 /nfs/dbraw/zinc/44/18/28/1046441828.db2.gz FLQRAFHSBIJNGF-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO C[N@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)Cc1ccncn1 ZINC001139417061 1046446777 /nfs/dbraw/zinc/44/67/77/1046446777.db2.gz KYHZYGOCVJDXCW-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)Cc1ccncn1 ZINC001139417061 1046446781 /nfs/dbraw/zinc/44/67/81/1046446781.db2.gz KYHZYGOCVJDXCW-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[C@H]1CCC[C@@H](OCc2cccc(NCc3c[nH+]cn3C)c2)C1 ZINC000123861173 1046450796 /nfs/dbraw/zinc/45/07/96/1046450796.db2.gz KUFCZZHQTCDIRM-HNAYVOBHSA-N 1 2 313.445 4.128 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1ccc(Br)cc1F ZINC000042375730 1046458153 /nfs/dbraw/zinc/45/81/53/1046458153.db2.gz XLUJYALPFMCKKI-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1ccc(Br)cc1F ZINC000042375730 1046458155 /nfs/dbraw/zinc/45/81/55/1046458155.db2.gz XLUJYALPFMCKKI-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO F[C@H]1C[N@H+](Cc2ccc(-c3ccccc3)nc2)CCCC1(F)F ZINC001139520810 1046461233 /nfs/dbraw/zinc/46/12/33/1046461233.db2.gz QZCMKQNAALBDND-KRWDZBQOSA-N 1 2 320.358 4.318 20 0 DIADLO F[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3)nc2)CCCC1(F)F ZINC001139520810 1046461238 /nfs/dbraw/zinc/46/12/38/1046461238.db2.gz QZCMKQNAALBDND-KRWDZBQOSA-N 1 2 320.358 4.318 20 0 DIADLO Brc1cc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cs1 ZINC000125389085 1046465392 /nfs/dbraw/zinc/46/53/92/1046465392.db2.gz IQBPYAHQUPHUNT-LBPRGKRZSA-N 1 2 311.248 4.176 20 0 DIADLO CCn1nccc1C[NH2+]Cc1c(Cl)ccc(Cl)c1Cl ZINC000677139079 1046470252 /nfs/dbraw/zinc/47/02/52/1046470252.db2.gz SGNBJUQFUNMSRZ-UHFFFAOYSA-N 1 2 318.635 4.153 20 0 DIADLO CC(C)[N@H+](Cc1csc(-c2ccoc2)n1)Cc1cccnc1 ZINC000125638456 1046470474 /nfs/dbraw/zinc/47/04/74/1046470474.db2.gz KKUUUTVNEJXXLP-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)[N@@H+](Cc1csc(-c2ccoc2)n1)Cc1cccnc1 ZINC000125638456 1046470476 /nfs/dbraw/zinc/47/04/76/1046470476.db2.gz KKUUUTVNEJXXLP-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)[N@H+](Cc1nc(C(C)(C)C)cs1)Cc1cccnc1 ZINC000125685007 1046472170 /nfs/dbraw/zinc/47/21/70/1046472170.db2.gz PUATXDGBVFSHMX-UHFFFAOYSA-N 1 2 303.475 4.246 20 0 DIADLO CC(C)[N@@H+](Cc1nc(C(C)(C)C)cs1)Cc1cccnc1 ZINC000125685007 1046472179 /nfs/dbraw/zinc/47/21/79/1046472179.db2.gz PUATXDGBVFSHMX-UHFFFAOYSA-N 1 2 303.475 4.246 20 0 DIADLO CC(C)[N@H+](Cc1ncc(-c2cccs2)o1)Cc1cccnc1 ZINC000125683369 1046472819 /nfs/dbraw/zinc/47/28/19/1046472819.db2.gz GNINVZOVYKOUDN-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)[N@@H+](Cc1ncc(-c2cccs2)o1)Cc1cccnc1 ZINC000125683369 1046472822 /nfs/dbraw/zinc/47/28/22/1046472822.db2.gz GNINVZOVYKOUDN-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CCOC1C[NH+](Cc2ccccc2-c2ccccc2Cl)C1 ZINC001139573378 1046474700 /nfs/dbraw/zinc/47/47/00/1046474700.db2.gz DEWHIYKRDJZEPF-UHFFFAOYSA-N 1 2 301.817 4.228 20 0 DIADLO Cn1c[nH+]cc1CNc1cccc(CCCc2ccccc2)c1 ZINC000126030049 1046474816 /nfs/dbraw/zinc/47/48/16/1046474816.db2.gz DZBPLUNPNALZSF-UHFFFAOYSA-N 1 2 305.425 4.208 20 0 DIADLO Cc1cc(C)c(NC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c(C)c1 ZINC001202949068 1046475254 /nfs/dbraw/zinc/47/52/54/1046475254.db2.gz UTANEEBBCMVEMI-UHFFFAOYSA-N 1 2 320.396 4.442 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3nc(C)sc3C2)cc1Cl ZINC001139597225 1046482564 /nfs/dbraw/zinc/48/25/64/1046482564.db2.gz QUKNITPMBZJNOC-UHFFFAOYSA-N 1 2 322.861 4.062 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3nc(C)sc3C2)cc1Cl ZINC001139597225 1046482567 /nfs/dbraw/zinc/48/25/67/1046482567.db2.gz QUKNITPMBZJNOC-UHFFFAOYSA-N 1 2 322.861 4.062 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCC[C@H]3c3ccccc3)no2)cs1 ZINC000127270374 1046482986 /nfs/dbraw/zinc/48/29/86/1046482986.db2.gz XKEQOCRKSQYDND-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCC[C@H]3c3ccccc3)no2)cs1 ZINC000127270374 1046482990 /nfs/dbraw/zinc/48/29/90/1046482990.db2.gz XKEQOCRKSQYDND-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO C[C@@H]1C[C@@H](CCNC(=O)c2cc3c[nH+]ccc3[nH]2)CC(C)(C)C1 ZINC001139604741 1046483336 /nfs/dbraw/zinc/48/33/36/1046483336.db2.gz AWVHBHOBNBENGY-ZIAGYGMSSA-N 1 2 313.445 4.145 20 0 DIADLO COc1ccc(C[NH+]2CC(Oc3ccccc3)C2)cc1C(C)C ZINC001139617955 1046486933 /nfs/dbraw/zinc/48/69/33/1046486933.db2.gz FXLITUVSZNDWGA-UHFFFAOYSA-N 1 2 311.425 4.082 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1coc(C3CC3)n1)[C@@H]2C ZINC000781928234 1046487764 /nfs/dbraw/zinc/48/77/64/1046487764.db2.gz VIWZTUWAWNEZOA-QWHCGFSZSA-N 1 2 312.413 4.068 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1coc(C3CC3)n1)[C@@H]2C ZINC000781928234 1046487767 /nfs/dbraw/zinc/48/77/67/1046487767.db2.gz VIWZTUWAWNEZOA-QWHCGFSZSA-N 1 2 312.413 4.068 20 0 DIADLO Cc1csc(C[N@@H+]2CCO[C@@H](Cc3ccccc3)C2)c1Cl ZINC001137292584 1046490082 /nfs/dbraw/zinc/49/00/82/1046490082.db2.gz GVNRMQJANDTRGK-HNNXBMFYSA-N 1 2 321.873 4.153 20 0 DIADLO Cc1csc(C[N@H+]2CCO[C@@H](Cc3ccccc3)C2)c1Cl ZINC001137292584 1046490087 /nfs/dbraw/zinc/49/00/87/1046490087.db2.gz GVNRMQJANDTRGK-HNNXBMFYSA-N 1 2 321.873 4.153 20 0 DIADLO CCOc1ccncc1C[N@H+](C)Cc1ccccc1C(F)(F)F ZINC001139628900 1046490858 /nfs/dbraw/zinc/49/08/58/1046490858.db2.gz DKDFCPFGAMGNAS-UHFFFAOYSA-N 1 2 324.346 4.131 20 0 DIADLO CCOc1ccncc1C[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC001139628900 1046490863 /nfs/dbraw/zinc/49/08/63/1046490863.db2.gz DKDFCPFGAMGNAS-UHFFFAOYSA-N 1 2 324.346 4.131 20 0 DIADLO CCOc1ccncc1C[N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001139631690 1046490978 /nfs/dbraw/zinc/49/09/78/1046490978.db2.gz DKXBTALCMCOKBR-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccncc1C[N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001139631690 1046490982 /nfs/dbraw/zinc/49/09/82/1046490982.db2.gz DKXBTALCMCOKBR-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc(OC)c(C(C)C)c1)C2 ZINC001139624610 1046491542 /nfs/dbraw/zinc/49/15/42/1046491542.db2.gz PANRDAVCBBLARB-UHFFFAOYSA-N 1 2 311.425 4.343 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc(OC)c(C(C)C)c1)C2 ZINC001139624610 1046491551 /nfs/dbraw/zinc/49/15/51/1046491551.db2.gz PANRDAVCBBLARB-UHFFFAOYSA-N 1 2 311.425 4.343 20 0 DIADLO Cc1csc(C[NH+]2CC3(C2)CC(F)(F)CS3)c1Cl ZINC001137292669 1046491996 /nfs/dbraw/zinc/49/19/96/1046491996.db2.gz KFFUMHPAHCBLOV-UHFFFAOYSA-N 1 2 309.834 4.037 20 0 DIADLO C[C@@H](N[C@@H]1C[N@H+](C)Cc2ccccc21)c1ccccc1Cl ZINC000677413603 1046495082 /nfs/dbraw/zinc/49/50/82/1046495082.db2.gz KXEXYSCSDYLLLZ-FZKQIMNGSA-N 1 2 300.833 4.177 20 0 DIADLO C[C@@H](N[C@@H]1C[N@@H+](C)Cc2ccccc21)c1ccccc1Cl ZINC000677413603 1046495086 /nfs/dbraw/zinc/49/50/86/1046495086.db2.gz KXEXYSCSDYLLLZ-FZKQIMNGSA-N 1 2 300.833 4.177 20 0 DIADLO C[C@@H](C1CC1)[N@@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000782184441 1046497683 /nfs/dbraw/zinc/49/76/83/1046497683.db2.gz SKHYAUZIGNTIAY-BONVTDFDSA-N 1 2 300.229 4.165 20 0 DIADLO C[C@@H](C1CC1)[N@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000782184441 1046497686 /nfs/dbraw/zinc/49/76/86/1046497686.db2.gz SKHYAUZIGNTIAY-BONVTDFDSA-N 1 2 300.229 4.165 20 0 DIADLO CCC(C)(C)CC(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000677472185 1046497958 /nfs/dbraw/zinc/49/79/58/1046497958.db2.gz BGZKOYJSKOXMIA-UHFFFAOYSA-N 1 2 323.440 4.367 20 0 DIADLO Clc1ccc2c(c1)CC[C@@H]2[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000782191577 1046499954 /nfs/dbraw/zinc/49/99/54/1046499954.db2.gz XRAWNRVRLPTOBA-DLBZAZTESA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)CC[C@@H]2[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000782191577 1046499960 /nfs/dbraw/zinc/49/99/60/1046499960.db2.gz XRAWNRVRLPTOBA-DLBZAZTESA-N 1 2 319.857 4.462 20 0 DIADLO C[C@H](C1CC1)[N@@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000782184443 1046500175 /nfs/dbraw/zinc/50/01/75/1046500175.db2.gz SKHYAUZIGNTIAY-MEBBXXQBSA-N 1 2 300.229 4.165 20 0 DIADLO C[C@H](C1CC1)[N@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000782184443 1046500179 /nfs/dbraw/zinc/50/01/79/1046500179.db2.gz SKHYAUZIGNTIAY-MEBBXXQBSA-N 1 2 300.229 4.165 20 0 DIADLO CCn1cc(CC(=O)Nc2c(C)cc(C)[nH+]c2C)c2ccccc21 ZINC000130034442 1046507608 /nfs/dbraw/zinc/50/76/08/1046507608.db2.gz DUMGVSIBMMJKRG-UHFFFAOYSA-N 1 2 321.424 4.163 20 0 DIADLO COc1ncc(Cl)cc1C[N@@H+]1CCC[C@H]1c1cccs1 ZINC001139749996 1046511011 /nfs/dbraw/zinc/51/10/11/1046511011.db2.gz QJWJSRCDSAISMN-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ncc(Cl)cc1C[N@H+]1CCC[C@H]1c1cccs1 ZINC001139749996 1046511019 /nfs/dbraw/zinc/51/10/19/1046511019.db2.gz QJWJSRCDSAISMN-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ncc(Cl)cc1C[N@H+](C)Cc1cccc(Cl)c1 ZINC001139748668 1046512399 /nfs/dbraw/zinc/51/23/99/1046512399.db2.gz UNEDPIKJSHHQHK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ncc(Cl)cc1C[N@@H+](C)Cc1cccc(Cl)c1 ZINC001139748668 1046512412 /nfs/dbraw/zinc/51/24/12/1046512412.db2.gz UNEDPIKJSHHQHK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1ccc2ncc(C[N@@H+](C)[C@@H](C)c3ccccc3Cl)n2c1 ZINC001137310785 1046519881 /nfs/dbraw/zinc/51/98/81/1046519881.db2.gz QJJYFNOJAPWSRG-AWEZNQCLSA-N 1 2 313.832 4.489 20 0 DIADLO Cc1ccc2ncc(C[N@H+](C)[C@@H](C)c3ccccc3Cl)n2c1 ZINC001137310785 1046519890 /nfs/dbraw/zinc/51/98/90/1046519890.db2.gz QJJYFNOJAPWSRG-AWEZNQCLSA-N 1 2 313.832 4.489 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cc(Cl)ncc1Br ZINC001139807186 1046522191 /nfs/dbraw/zinc/52/21/91/1046522191.db2.gz SXYQNZXCFJLAOB-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cc(Cl)ncc1Br ZINC001139807186 1046522200 /nfs/dbraw/zinc/52/22/00/1046522200.db2.gz SXYQNZXCFJLAOB-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO COc1ncc(C[N@H+](C)Cc2ccc(Cl)c(Cl)c2)s1 ZINC001139813811 1046524473 /nfs/dbraw/zinc/52/44/73/1046524473.db2.gz YPIOUVRHHURUFG-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO COc1ncc(C[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)s1 ZINC001139813811 1046524486 /nfs/dbraw/zinc/52/44/86/1046524486.db2.gz YPIOUVRHHURUFG-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@@H]2c2cccc(Cl)c2)nc1 ZINC001139840524 1046529783 /nfs/dbraw/zinc/52/97/83/1046529783.db2.gz WYFIAZLIGLCYQG-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@@H]2c2cccc(Cl)c2)nc1 ZINC001139840524 1046529792 /nfs/dbraw/zinc/52/97/92/1046529792.db2.gz WYFIAZLIGLCYQG-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cccn2cc(C[N@@H+](C)Cc3ccc(Cl)c(F)c3)nc12 ZINC000677821431 1046530280 /nfs/dbraw/zinc/53/02/80/1046530280.db2.gz VJYOUNKNYNHVKS-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1cccn2cc(C[N@H+](C)Cc3ccc(Cl)c(F)c3)nc12 ZINC000677821431 1046530288 /nfs/dbraw/zinc/53/02/88/1046530288.db2.gz VJYOUNKNYNHVKS-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1cccc(C[NH+](Cc2ccccc2)Cc2cccc(C)n2)n1 ZINC000132635035 1046532495 /nfs/dbraw/zinc/53/24/95/1046532495.db2.gz QQPOYONVEMZUST-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO COc1ccccc1[C@H]1CCCCN1c1cc(C)[nH+]c(C2CC2)n1 ZINC000677882425 1046532739 /nfs/dbraw/zinc/53/27/39/1046532739.db2.gz JEJYJYXVPQJMCO-QGZVFWFLSA-N 1 2 323.440 4.403 20 0 DIADLO Cc1csc(C[N@@H+]2CCC[C@@H](Oc3ccccc3Cl)C2)n1 ZINC000133044111 1046537568 /nfs/dbraw/zinc/53/75/68/1046537568.db2.gz MTEGSPAKFPOIEB-CYBMUJFWSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1csc(C[N@H+]2CCC[C@@H](Oc3ccccc3Cl)C2)n1 ZINC000133044111 1046537573 /nfs/dbraw/zinc/53/75/73/1046537573.db2.gz MTEGSPAKFPOIEB-CYBMUJFWSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1C[N@H+](C)CC(=O)c1ccccc1 ZINC001139887630 1046544659 /nfs/dbraw/zinc/54/46/59/1046544659.db2.gz VGDGFDHUFFOMJC-UHFFFAOYSA-N 1 2 321.342 4.329 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1C[N@@H+](C)CC(=O)c1ccccc1 ZINC001139887630 1046544668 /nfs/dbraw/zinc/54/46/68/1046544668.db2.gz VGDGFDHUFFOMJC-UHFFFAOYSA-N 1 2 321.342 4.329 20 0 DIADLO CCCCCC[C@@H](C)NC(=O)C[N@@H+]1CCc2sccc2[C@@H]1C ZINC000783010979 1046551626 /nfs/dbraw/zinc/55/16/26/1046551626.db2.gz ILPGVOJYLKQSQQ-CABCVRRESA-N 1 2 322.518 4.142 20 0 DIADLO CCCCCC[C@@H](C)NC(=O)C[N@H+]1CCc2sccc2[C@@H]1C ZINC000783010979 1046551638 /nfs/dbraw/zinc/55/16/38/1046551638.db2.gz ILPGVOJYLKQSQQ-CABCVRRESA-N 1 2 322.518 4.142 20 0 DIADLO Cc1cccc(-c2nnc([C@H](C)[NH2+][C@H](C)c3cnccc3C)o2)c1 ZINC000783001376 1046552089 /nfs/dbraw/zinc/55/20/89/1046552089.db2.gz FWJADSPOOBOEMG-CABCVRRESA-N 1 2 322.412 4.160 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1cncc(Br)c1 ZINC000695239460 1046552227 /nfs/dbraw/zinc/55/22/27/1046552227.db2.gz JOBRDFCXTXGFLO-NSHDSACASA-N 1 2 320.234 4.083 20 0 DIADLO COCC[N@H+](Cc1cccs1)Cc1cscc1Cl ZINC000678124623 1046558107 /nfs/dbraw/zinc/55/81/07/1046558107.db2.gz LXKAXCKPWAFPNU-UHFFFAOYSA-N 1 2 301.864 4.112 20 0 DIADLO COCC[N@@H+](Cc1cccs1)Cc1cscc1Cl ZINC000678124623 1046558120 /nfs/dbraw/zinc/55/81/20/1046558120.db2.gz LXKAXCKPWAFPNU-UHFFFAOYSA-N 1 2 301.864 4.112 20 0 DIADLO COC(=O)c1c(F)cc(Nc2c(C)cc[nH+]c2C(C)C)cc1F ZINC001214720599 1046558154 /nfs/dbraw/zinc/55/81/54/1046558154.db2.gz RBUMOCWFWYJPPJ-UHFFFAOYSA-N 1 2 320.339 4.322 20 0 DIADLO NC(Cc1cccc(F)c1)=[NH+]OCc1ccc2ccccc2c1 ZINC000783153322 1046559660 /nfs/dbraw/zinc/55/96/60/1046559660.db2.gz VNTOODUGIGVYFU-UHFFFAOYSA-N 1 2 308.356 4.220 20 0 DIADLO CC(C)(C)c1ccc(CO[NH+]=C(N)Cc2cccc(F)c2)cc1 ZINC000783155953 1046560187 /nfs/dbraw/zinc/56/01/87/1046560187.db2.gz ITWZQRWVTLKVMJ-UHFFFAOYSA-N 1 2 314.404 4.364 20 0 DIADLO C[N@H+](Cc1ccnnc1)Cc1cc(F)ccc1Oc1ccccc1 ZINC001139985006 1046562718 /nfs/dbraw/zinc/56/27/18/1046562718.db2.gz HCVQYYBEYAGFEA-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[N@@H+](Cc1ccnnc1)Cc1cc(F)ccc1Oc1ccccc1 ZINC001139985006 1046562740 /nfs/dbraw/zinc/56/27/40/1046562740.db2.gz HCVQYYBEYAGFEA-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1n[nH]c2ccccc21 ZINC000678132090 1046562939 /nfs/dbraw/zinc/56/29/39/1046562939.db2.gz XNAYNJCJCPSUOR-LLVKDONJSA-N 1 2 301.340 4.034 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1n[nH]c2ccccc21 ZINC000678132090 1046562954 /nfs/dbraw/zinc/56/29/54/1046562954.db2.gz XNAYNJCJCPSUOR-LLVKDONJSA-N 1 2 301.340 4.034 20 0 DIADLO C[N@H+](Cc1cnc(Cl)nc1)Cc1cc(Cl)cc(Cl)c1 ZINC001139994200 1046565883 /nfs/dbraw/zinc/56/58/83/1046565883.db2.gz LZDJVMAEASRBGM-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)nc1)Cc1cc(Cl)cc(Cl)c1 ZINC001139994200 1046565897 /nfs/dbraw/zinc/56/58/97/1046565897.db2.gz LZDJVMAEASRBGM-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO Fc1cc2c(cc1F)C[N@H+](Cc1cc3ccccc3cn1)CC2 ZINC001140002648 1046567213 /nfs/dbraw/zinc/56/72/13/1046567213.db2.gz FVRYTSALMSTSJL-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1cc2c(cc1F)C[N@@H+](Cc1cc3ccccc3cn1)CC2 ZINC001140002648 1046567228 /nfs/dbraw/zinc/56/72/28/1046567228.db2.gz FVRYTSALMSTSJL-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Cc1cccc(C)c1C[NH2+][C@H](c1ncc[nH]1)c1ccc(F)cc1 ZINC000783252805 1046570512 /nfs/dbraw/zinc/57/05/12/1046570512.db2.gz CUKMYKCVKNNZHZ-SFHVURJKSA-N 1 2 309.388 4.045 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cnc(Br)cc1Cl ZINC001140077711 1046586158 /nfs/dbraw/zinc/58/61/58/1046586158.db2.gz MVJYTEYJCXTPFU-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cnc(Br)cc1Cl ZINC001140077711 1046586166 /nfs/dbraw/zinc/58/61/66/1046586166.db2.gz MVJYTEYJCXTPFU-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)c1 ZINC001140048480 1046575058 /nfs/dbraw/zinc/57/50/58/1046575058.db2.gz GXCDIKHXRVCIIE-GOSISDBHSA-N 1 2 303.352 4.398 20 0 DIADLO Oc1ccc(F)c(C[N@H+]2CCCC[C@@H]2c2ccccc2F)c1 ZINC001140048480 1046575068 /nfs/dbraw/zinc/57/50/68/1046575068.db2.gz GXCDIKHXRVCIIE-GOSISDBHSA-N 1 2 303.352 4.398 20 0 DIADLO COc1c(Cl)cccc1C[N@H+](C)Cc1ccc(Cl)nc1 ZINC001140062309 1046580164 /nfs/dbraw/zinc/58/01/64/1046580164.db2.gz RMPCHRCKDCOACE-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1c(Cl)cccc1C[N@@H+](C)Cc1ccc(Cl)nc1 ZINC001140062309 1046580178 /nfs/dbraw/zinc/58/01/78/1046580178.db2.gz RMPCHRCKDCOACE-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO c1cc2cccc(C[N@@H+]3CCCC[C@H]3c3noc(C4CC4)n3)c2[nH]1 ZINC000678203066 1046584135 /nfs/dbraw/zinc/58/41/35/1046584135.db2.gz NGKGWSCEIKDWSP-INIZCTEOSA-N 1 2 322.412 4.156 20 0 DIADLO c1cc2cccc(C[N@H+]3CCCC[C@H]3c3noc(C4CC4)n3)c2[nH]1 ZINC000678203066 1046584151 /nfs/dbraw/zinc/58/41/51/1046584151.db2.gz NGKGWSCEIKDWSP-INIZCTEOSA-N 1 2 322.412 4.156 20 0 DIADLO CCc1nc([C@H]2CCCC[N@@H+]2Cc2cc(C)c(C)cc2C)no1 ZINC000678201057 1046584836 /nfs/dbraw/zinc/58/48/36/1046584836.db2.gz LBWMWWBENJHARM-QGZVFWFLSA-N 1 2 313.445 4.284 20 0 DIADLO CCc1nc([C@H]2CCCC[N@H+]2Cc2cc(C)c(C)cc2C)no1 ZINC000678201057 1046584853 /nfs/dbraw/zinc/58/48/53/1046584853.db2.gz LBWMWWBENJHARM-QGZVFWFLSA-N 1 2 313.445 4.284 20 0 DIADLO CCCCc1nc(C[N@H+](CCOC)Cc2ccccc2)cs1 ZINC000642253298 1046587327 /nfs/dbraw/zinc/58/73/27/1046587327.db2.gz BETCZUZZQWCDQT-UHFFFAOYSA-N 1 2 318.486 4.134 20 0 DIADLO CCCCc1nc(C[N@@H+](CCOC)Cc2ccccc2)cs1 ZINC000642253298 1046587341 /nfs/dbraw/zinc/58/73/41/1046587341.db2.gz BETCZUZZQWCDQT-UHFFFAOYSA-N 1 2 318.486 4.134 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1nc2ccc(Cl)cc2n1C ZINC000678222320 1046591601 /nfs/dbraw/zinc/59/16/01/1046591601.db2.gz LDSAZZYZHUJWGO-UHFFFAOYSA-N 1 2 319.758 4.001 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1nc2ccc(Cl)cc2n1C ZINC000678222320 1046591610 /nfs/dbraw/zinc/59/16/10/1046591610.db2.gz LDSAZZYZHUJWGO-UHFFFAOYSA-N 1 2 319.758 4.001 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(C(F)(F)F)ccn2)Cc2ccccc21 ZINC001140108021 1046591847 /nfs/dbraw/zinc/59/18/47/1046591847.db2.gz BIJGFTDUGZBANU-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(C(F)(F)F)ccn2)Cc2ccccc21 ZINC001140108021 1046591856 /nfs/dbraw/zinc/59/18/56/1046591856.db2.gz BIJGFTDUGZBANU-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO CCCn1c(C)nn(C[N@H+](CC2CCCCC2)C2CC2)c1=S ZINC000760278284 1046592349 /nfs/dbraw/zinc/59/23/49/1046592349.db2.gz CBDKOSUHDRYJTR-UHFFFAOYSA-N 1 2 322.522 4.135 20 0 DIADLO CCCn1c(C)nn(C[N@@H+](CC2CCCCC2)C2CC2)c1=S ZINC000760278284 1046592363 /nfs/dbraw/zinc/59/23/63/1046592363.db2.gz CBDKOSUHDRYJTR-UHFFFAOYSA-N 1 2 322.522 4.135 20 0 DIADLO Clc1ccccc1Cn1cc(C[NH+]2Cc3ccccc3C2)cn1 ZINC000678241351 1046600195 /nfs/dbraw/zinc/60/01/95/1046600195.db2.gz SLTKDVTZEOOISF-UHFFFAOYSA-N 1 2 323.827 4.101 20 0 DIADLO Fc1cc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)cc(F)c1F ZINC000678266716 1046604414 /nfs/dbraw/zinc/60/44/14/1046604414.db2.gz HHZREORHVNJZST-MRXNPFEDSA-N 1 2 323.383 4.394 20 0 DIADLO Fc1cc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)cc(F)c1F ZINC000678266716 1046604420 /nfs/dbraw/zinc/60/44/20/1046604420.db2.gz HHZREORHVNJZST-MRXNPFEDSA-N 1 2 323.383 4.394 20 0 DIADLO COc1cc(C[N@H+](C)Cc2csc(C(C)C)n2)ccc1C ZINC001140160313 1046604611 /nfs/dbraw/zinc/60/46/11/1046604611.db2.gz YQECJXVIVRQGQC-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2csc(C(C)C)n2)ccc1C ZINC001140160313 1046604615 /nfs/dbraw/zinc/60/46/15/1046604615.db2.gz YQECJXVIVRQGQC-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@@H+]1CCCOC(C)(C)C1 ZINC000678271756 1046606614 /nfs/dbraw/zinc/60/66/14/1046606614.db2.gz DXJCSTLRXWKVRN-UHFFFAOYSA-N 1 2 318.244 4.003 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@H+]1CCCOC(C)(C)C1 ZINC000678271756 1046606619 /nfs/dbraw/zinc/60/66/19/1046606619.db2.gz DXJCSTLRXWKVRN-UHFFFAOYSA-N 1 2 318.244 4.003 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2c(s1)CCC2)c1cc(F)ccc1F ZINC000093076507 1046606958 /nfs/dbraw/zinc/60/69/58/1046606958.db2.gz ZTEAJZDUCJHOMJ-ZDUSSCGKSA-N 1 2 308.397 4.151 20 0 DIADLO CC(C)c1ccccc1C[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000783575695 1046610631 /nfs/dbraw/zinc/61/06/31/1046610631.db2.gz MZROTYGEAJJCLP-ZDUSSCGKSA-N 1 2 301.434 4.341 20 0 DIADLO CC[N@H+](Cc1cnc[nH]1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000093133728 1046611786 /nfs/dbraw/zinc/61/17/86/1046611786.db2.gz DCRWIBMEZQSJRI-LJQANCHMSA-N 1 2 309.388 4.160 20 0 DIADLO CC[N@@H+](Cc1cnc[nH]1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000093133728 1046611796 /nfs/dbraw/zinc/61/17/96/1046611796.db2.gz DCRWIBMEZQSJRI-LJQANCHMSA-N 1 2 309.388 4.160 20 0 DIADLO CC(C)c1ccc(-c2nc(C[N@@H+]3CCCOCC3)cs2)cc1 ZINC000521191382 1046613123 /nfs/dbraw/zinc/61/31/23/1046613123.db2.gz KEYQWCIGITWRHN-UHFFFAOYSA-N 1 2 316.470 4.156 20 0 DIADLO CC(C)c1ccc(-c2nc(C[N@H+]3CCCOCC3)cs2)cc1 ZINC000521191382 1046613134 /nfs/dbraw/zinc/61/31/34/1046613134.db2.gz KEYQWCIGITWRHN-UHFFFAOYSA-N 1 2 316.470 4.156 20 0 DIADLO Cc1cc(C[N@@H+](Cc2[nH]c(C)cc2C)Cc2ccccc2)on1 ZINC001137331189 1046614865 /nfs/dbraw/zinc/61/48/65/1046614865.db2.gz UJOSDDVGIFAHKL-UHFFFAOYSA-N 1 2 309.413 4.130 20 0 DIADLO Cc1cc(C[N@H+](Cc2[nH]c(C)cc2C)Cc2ccccc2)on1 ZINC001137331189 1046614871 /nfs/dbraw/zinc/61/48/71/1046614871.db2.gz UJOSDDVGIFAHKL-UHFFFAOYSA-N 1 2 309.413 4.130 20 0 DIADLO C[C@@H]1CC[N@@H+]1Cc1cc(C(F)(F)F)ccc1Br ZINC001140217860 1046617609 /nfs/dbraw/zinc/61/76/09/1046617609.db2.gz ANZKMKPCZBVNKU-MRVPVSSYSA-N 1 2 308.141 4.062 20 0 DIADLO C[C@@H]1CC[N@H+]1Cc1cc(C(F)(F)F)ccc1Br ZINC001140217860 1046617611 /nfs/dbraw/zinc/61/76/11/1046617611.db2.gz ANZKMKPCZBVNKU-MRVPVSSYSA-N 1 2 308.141 4.062 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1Cc1noc2c1CCCC2 ZINC000678316134 1046619907 /nfs/dbraw/zinc/61/99/07/1046619907.db2.gz ZVEUTQHDIPJECV-CHWSQXEVSA-N 1 2 314.404 4.200 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1Cc1noc2c1CCCC2 ZINC000678316134 1046619913 /nfs/dbraw/zinc/61/99/13/1046619913.db2.gz ZVEUTQHDIPJECV-CHWSQXEVSA-N 1 2 314.404 4.200 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1cn[nH]c1)[C@@H](c1ccccc1)C2 ZINC000678335871 1046622029 /nfs/dbraw/zinc/62/20/29/1046622029.db2.gz MXUOREZHRJJQAL-LJQANCHMSA-N 1 2 323.827 4.363 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1cn[nH]c1)[C@@H](c1ccccc1)C2 ZINC000678335871 1046622034 /nfs/dbraw/zinc/62/20/34/1046622034.db2.gz MXUOREZHRJJQAL-LJQANCHMSA-N 1 2 323.827 4.363 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(OC)c(OC(C)C)c2)c[nH+]1 ZINC001203016135 1046623142 /nfs/dbraw/zinc/62/31/42/1046623142.db2.gz CEUBPPDZYRJGHP-UHFFFAOYSA-N 1 2 315.417 4.077 20 0 DIADLO C/C=C\C[C@H]1CCCN(C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000626568333 1046626545 /nfs/dbraw/zinc/62/65/45/1046626545.db2.gz ALVDAXJPSYZUSY-KJPDOMRESA-N 1 2 301.434 4.217 20 0 DIADLO COc1ccc(Nc2ccccc2-n2cc[nH+]c2)cc1OC(C)C ZINC001203018221 1046630087 /nfs/dbraw/zinc/63/00/87/1046630087.db2.gz YPVWEAWOPPAFOD-UHFFFAOYSA-N 1 2 323.396 4.412 20 0 DIADLO Cc1cccc(F)c1C[NH2+][C@@H](C)c1ncc(-c2ccccc2)n1C ZINC000834601782 1046638353 /nfs/dbraw/zinc/63/83/53/1046638353.db2.gz ADTSOAZDULPNIZ-HNNXBMFYSA-N 1 2 323.415 4.385 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCn2ccnc21)c1cc2cc(Cl)ccc2o1 ZINC000834654633 1046647137 /nfs/dbraw/zinc/64/71/37/1046647137.db2.gz QHFKLNZIWLHYMI-ZWNOBZJWSA-N 1 2 301.777 4.078 20 0 DIADLO CC(C)c1ccc(C(C)(C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000643251248 1046653520 /nfs/dbraw/zinc/65/35/20/1046653520.db2.gz TUPAXKFSVRWWPX-UHFFFAOYSA-N 1 2 305.853 4.222 20 0 DIADLO Fc1ccc(C[N@H+](Cc2csnn2)C2CCCCC2)cc1 ZINC000533087641 1046655058 /nfs/dbraw/zinc/65/50/58/1046655058.db2.gz OWWXRDQCVQBISL-UHFFFAOYSA-N 1 2 305.422 4.012 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2csnn2)C2CCCCC2)cc1 ZINC000533087641 1046655069 /nfs/dbraw/zinc/65/50/69/1046655069.db2.gz OWWXRDQCVQBISL-UHFFFAOYSA-N 1 2 305.422 4.012 20 0 DIADLO Cc1ccc2n[nH]c(C[N@@H+]3CCc4cc(Cl)ccc4C3)c2c1 ZINC001140329831 1046658542 /nfs/dbraw/zinc/65/85/42/1046658542.db2.gz AZDVYIGLBKAUIQ-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1ccc2n[nH]c(C[N@H+]3CCc4cc(Cl)ccc4C3)c2c1 ZINC001140329831 1046658547 /nfs/dbraw/zinc/65/85/47/1046658547.db2.gz AZDVYIGLBKAUIQ-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1cc(-c2ccccc2)nn1C ZINC000834741260 1046661137 /nfs/dbraw/zinc/66/11/37/1046661137.db2.gz MHJQQHLXPHVUHS-HNNXBMFYSA-N 1 2 320.440 4.326 20 0 DIADLO C[N@H+](Cc1ccncn1)Cc1cc(F)ccc1Oc1ccccc1 ZINC001140348467 1046669749 /nfs/dbraw/zinc/66/97/49/1046669749.db2.gz XFXDXGYRTDSYRK-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[N@@H+](Cc1ccncn1)Cc1cc(F)ccc1Oc1ccccc1 ZINC001140348467 1046669763 /nfs/dbraw/zinc/66/97/63/1046669763.db2.gz XFXDXGYRTDSYRK-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1ccc(-c3cncnc3)cc1)C2 ZINC001140356547 1046671655 /nfs/dbraw/zinc/67/16/55/1046671655.db2.gz KBBGUDVUICKLPH-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1ccc(-c3cncnc3)cc1)C2 ZINC001140356547 1046671663 /nfs/dbraw/zinc/67/16/63/1046671663.db2.gz KBBGUDVUICKLPH-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)CC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000533247293 1046678781 /nfs/dbraw/zinc/67/87/81/1046678781.db2.gz LFPPFPCECCJAAT-IWUURBKTSA-N 1 2 301.430 4.058 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)CC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000533247293 1046678790 /nfs/dbraw/zinc/67/87/90/1046678790.db2.gz LFPPFPCECCJAAT-IWUURBKTSA-N 1 2 301.430 4.058 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)c(Br)c1 ZINC000533263738 1046685255 /nfs/dbraw/zinc/68/52/55/1046685255.db2.gz XCFOHBSHZDNZOH-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c(Br)c1 ZINC000533263738 1046685257 /nfs/dbraw/zinc/68/52/57/1046685257.db2.gz XCFOHBSHZDNZOH-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO CC(C)(C)Nc1nc(Cl)c(C[NH+]2CC3(C2)CCCC3)s1 ZINC001140389989 1046685878 /nfs/dbraw/zinc/68/58/78/1046685878.db2.gz CQJYXUQWGNXIGK-UHFFFAOYSA-N 1 2 313.898 4.383 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@H+](C)Cc1nc2c(s1)CCCC2 ZINC000533308682 1046688835 /nfs/dbraw/zinc/68/88/35/1046688835.db2.gz UZQHRQXGLAXPMU-LBPRGKRZSA-N 1 2 304.434 4.354 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@@H+](C)Cc1nc2c(s1)CCCC2 ZINC000533308682 1046688840 /nfs/dbraw/zinc/68/88/40/1046688840.db2.gz UZQHRQXGLAXPMU-LBPRGKRZSA-N 1 2 304.434 4.354 20 0 DIADLO CCc1noc(C[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)n1 ZINC000678750395 1046692722 /nfs/dbraw/zinc/69/27/22/1046692722.db2.gz ZBYGNABJJHYWPJ-AWEZNQCLSA-N 1 2 305.397 4.038 20 0 DIADLO CCc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCCC2)n1 ZINC000678767769 1046696461 /nfs/dbraw/zinc/69/64/61/1046696461.db2.gz RGBHKTHLSACGDB-KRWDZBQOSA-N 1 2 319.836 4.307 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2ccc(SC(F)F)cc2)co1 ZINC000834899582 1046709521 /nfs/dbraw/zinc/70/95/21/1046709521.db2.gz IHXXDXVEADVCKX-JTQLQIEISA-N 1 2 312.385 4.403 20 0 DIADLO CCOc1cccc2cc([C@@H](C)[NH2+]Cc3coc(CC)n3)oc21 ZINC000834898107 1046710306 /nfs/dbraw/zinc/71/03/06/1046710306.db2.gz JAMGFNBIXNPVEZ-GFCCVEGCSA-N 1 2 314.385 4.233 20 0 DIADLO CCc1nc(C[NH2+][C@H](c2ccccc2)c2ccc(C)cc2)co1 ZINC000834900949 1046710967 /nfs/dbraw/zinc/71/09/67/1046710967.db2.gz XOXQPULIKZHDFK-HXUWFJFHSA-N 1 2 306.409 4.425 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CCCOc3ccc(C(C)C)cc32)co1 ZINC000834899933 1046711740 /nfs/dbraw/zinc/71/17/40/1046711740.db2.gz ROYROVMYQLBATD-QGZVFWFLSA-N 1 2 314.429 4.364 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)co1 ZINC000834900426 1046712781 /nfs/dbraw/zinc/71/27/81/1046712781.db2.gz OMPULJNEGDYGEG-CYBMUJFWSA-N 1 2 311.212 4.321 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2oc3ccc(OC)cc3c2C)co1 ZINC000834900508 1046712879 /nfs/dbraw/zinc/71/28/79/1046712879.db2.gz PWTXSTKZRXCRDT-LBPRGKRZSA-N 1 2 314.385 4.151 20 0 DIADLO c1c(C[NH2+]Cc2nccc3ccccc32)noc1-c1ccccc1 ZINC000644412236 1046713352 /nfs/dbraw/zinc/71/33/52/1046713352.db2.gz OJZXKUXYOBWMBU-UHFFFAOYSA-N 1 2 315.376 4.180 20 0 DIADLO Clc1cc(C[N@@H+]2CCC=C(c3ccco3)C2)cc(Cl)n1 ZINC000796122459 1046716859 /nfs/dbraw/zinc/71/68/59/1046716859.db2.gz HXPSSKWMVOQGRQ-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Clc1cc(C[N@H+]2CCC=C(c3ccco3)C2)cc(Cl)n1 ZINC000796122459 1046716871 /nfs/dbraw/zinc/71/68/71/1046716871.db2.gz HXPSSKWMVOQGRQ-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1cnc2ccc(Cl)cn12 ZINC001140426468 1046717958 /nfs/dbraw/zinc/71/79/58/1046717958.db2.gz NPXLXBOPLZREAA-CYBMUJFWSA-N 1 2 311.816 4.107 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cnc2ccc(Cl)cn12 ZINC001140426468 1046717962 /nfs/dbraw/zinc/71/79/62/1046717962.db2.gz NPXLXBOPLZREAA-CYBMUJFWSA-N 1 2 311.816 4.107 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cc1Br ZINC000533487732 1046736747 /nfs/dbraw/zinc/73/67/47/1046736747.db2.gz YTSFPPRHFMXVFV-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)cc1Br ZINC000533487732 1046736761 /nfs/dbraw/zinc/73/67/61/1046736761.db2.gz YTSFPPRHFMXVFV-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO CC(C)CC[C@H]([NH2+]Cc1cn(-c2ccccc2)nn1)c1ccoc1 ZINC000796840572 1046744325 /nfs/dbraw/zinc/74/43/25/1046744325.db2.gz YWKHCPZYFTVGHW-IBGZPJMESA-N 1 2 324.428 4.127 20 0 DIADLO CC(C)O[C@H]1CC[N@H+](Cc2c(Cl)ccc(F)c2Cl)C1 ZINC001137358633 1046746660 /nfs/dbraw/zinc/74/66/60/1046746660.db2.gz WLGXDQSGHNSBET-JTQLQIEISA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@H]1CC[N@@H+](Cc2c(Cl)ccc(F)c2Cl)C1 ZINC001137358633 1046746670 /nfs/dbraw/zinc/74/66/70/1046746670.db2.gz WLGXDQSGHNSBET-JTQLQIEISA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@@H]1CC[N@H+](Cc2c(Cl)ccc(F)c2Cl)C1 ZINC001137358634 1046746725 /nfs/dbraw/zinc/74/67/25/1046746725.db2.gz WLGXDQSGHNSBET-SNVBAGLBSA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@@H]1CC[N@@H+](Cc2c(Cl)ccc(F)c2Cl)C1 ZINC001137358634 1046746736 /nfs/dbraw/zinc/74/67/36/1046746736.db2.gz WLGXDQSGHNSBET-SNVBAGLBSA-N 1 2 306.208 4.132 20 0 DIADLO CCCO[C@@H]1CC[N@H+](Cc2c(Cl)ccc(F)c2Cl)C1 ZINC001137358472 1046747930 /nfs/dbraw/zinc/74/79/30/1046747930.db2.gz PJURUVDTIAMEFC-SNVBAGLBSA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@@H]1CC[N@@H+](Cc2c(Cl)ccc(F)c2Cl)C1 ZINC001137358472 1046747943 /nfs/dbraw/zinc/74/79/43/1046747943.db2.gz PJURUVDTIAMEFC-SNVBAGLBSA-N 1 2 306.208 4.133 20 0 DIADLO COc1ncc(C[N@H+](C)Cc2ccccc2Cl)cc1Cl ZINC000533555431 1046751669 /nfs/dbraw/zinc/75/16/69/1046751669.db2.gz UOXYFZBPJCSNSY-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ncc(C[N@@H+](C)Cc2ccccc2Cl)cc1Cl ZINC000533555431 1046751683 /nfs/dbraw/zinc/75/16/83/1046751683.db2.gz UOXYFZBPJCSNSY-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)o1)c1nc2ccc(Cl)cc2n1C ZINC000678998580 1046752263 /nfs/dbraw/zinc/75/22/63/1046752263.db2.gz WFENIMFSVVVLDC-SECBINFHSA-N 1 2 324.211 4.324 20 0 DIADLO FC(F)Sc1ccc(C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)cc1 ZINC000796196764 1046756685 /nfs/dbraw/zinc/75/66/85/1046756685.db2.gz WMIYEOPNGRVRHX-OAHLLOKOSA-N 1 2 323.412 4.452 20 0 DIADLO FC(F)Sc1ccc(C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)cc1 ZINC000796196764 1046756700 /nfs/dbraw/zinc/75/67/00/1046756700.db2.gz WMIYEOPNGRVRHX-OAHLLOKOSA-N 1 2 323.412 4.452 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2cc(C)c(F)cc2Cl)c[nH+]1 ZINC000455412012 1046759872 /nfs/dbraw/zinc/75/98/72/1046759872.db2.gz BOZNBLYTMRVPIZ-UHFFFAOYSA-N 1 2 321.783 4.121 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1)Cc1c(F)cc(F)cc1F ZINC001140534903 1046767646 /nfs/dbraw/zinc/76/76/46/1046767646.db2.gz SAPZWMJMALBWSH-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1)Cc1c(F)cc(F)cc1F ZINC001140534903 1046767660 /nfs/dbraw/zinc/76/76/60/1046767660.db2.gz SAPZWMJMALBWSH-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO Cc1cc2cc(CNC(=O)Nc3c(C)cc(C)[nH+]c3C)ccc2[nH]1 ZINC000455467411 1046767823 /nfs/dbraw/zinc/76/78/23/1046767823.db2.gz AWRDQZXACSVMKI-UHFFFAOYSA-N 1 2 322.412 4.118 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2c(F)cc(F)cc2F)c1 ZINC001140534966 1046767711 /nfs/dbraw/zinc/76/77/11/1046767711.db2.gz UPBOHCVWMRPRKO-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2c(F)cc(F)cc2F)c1 ZINC001140534966 1046767719 /nfs/dbraw/zinc/76/77/19/1046767719.db2.gz UPBOHCVWMRPRKO-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1cc(F)c(C[NH+]2CCC3(CC(F)(F)C3)CC2)c(F)c1 ZINC001140529832 1046767767 /nfs/dbraw/zinc/76/77/67/1046767767.db2.gz JEOCGELSSKFZIT-UHFFFAOYSA-N 1 2 305.290 4.115 20 0 DIADLO Cc1cc(C)c(NC(=O)N(Cc2ccccc2)C2CC2)c(C)[nH+]1 ZINC000455462300 1046767854 /nfs/dbraw/zinc/76/78/54/1046767854.db2.gz BTVCYKMZXSPXLR-UHFFFAOYSA-N 1 2 309.413 4.203 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@H](C)c2ccc(F)cc2)c(C)[nH+]1 ZINC000455469259 1046767910 /nfs/dbraw/zinc/76/79/10/1046767910.db2.gz HLRWMDXOWNRBBW-CQSZACIVSA-N 1 2 315.392 4.371 20 0 DIADLO CC[C@H]1CCCC[C@H]1N(C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455472984 1046768140 /nfs/dbraw/zinc/76/81/40/1046768140.db2.gz BWUWAWCUPBHEIF-JKSUJKDBSA-N 1 2 303.450 4.439 20 0 DIADLO CC[C@@H]1Cc2ccccc2CN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455472953 1046768540 /nfs/dbraw/zinc/76/85/40/1046768540.db2.gz BUIWDRNIRXJTSX-GOSISDBHSA-N 1 2 323.440 4.376 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2CCC[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC000455476114 1046768652 /nfs/dbraw/zinc/76/86/52/1046768652.db2.gz LNWPBXSFAUSUGJ-MSOLQXFVSA-N 1 2 323.440 4.465 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2c(F)cc(F)cc2F)c1 ZINC001140534964 1046768950 /nfs/dbraw/zinc/76/89/50/1046768950.db2.gz UPBOHCVWMRPRKO-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2c(F)cc(F)cc2F)c1 ZINC001140534964 1046768967 /nfs/dbraw/zinc/76/89/67/1046768967.db2.gz UPBOHCVWMRPRKO-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@H](c3ccccc3)[C@H]2C)c(C)[nH+]1 ZINC000455476388 1046768981 /nfs/dbraw/zinc/76/89/81/1046768981.db2.gz DUPVVUFKZGPKOQ-AEFFLSMTSA-N 1 2 323.440 4.417 20 0 DIADLO Oc1cccc(C[NH2+]Cc2ccccc2OCC2CC2)c1Cl ZINC000645156707 1046769415 /nfs/dbraw/zinc/76/94/15/1046769415.db2.gz GWTJMHSQBPXTIX-UHFFFAOYSA-N 1 2 317.816 4.124 20 0 DIADLO Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455470137 1046769475 /nfs/dbraw/zinc/76/94/75/1046769475.db2.gz HWACFZFBPWFVDG-KRWDZBQOSA-N 1 2 309.413 4.124 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1cc(F)cc(Cl)c1 ZINC001140537642 1046772885 /nfs/dbraw/zinc/77/28/85/1046772885.db2.gz YCJGHPDUGLDXEO-UHFFFAOYSA-N 1 2 305.205 4.221 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1cc(F)cc(Cl)c1 ZINC001140537642 1046772899 /nfs/dbraw/zinc/77/28/99/1046772899.db2.gz YCJGHPDUGLDXEO-UHFFFAOYSA-N 1 2 305.205 4.221 20 0 DIADLO CCC1(CC)CN(C(=O)Nc2c(C)cc(C)[nH+]c2C)CCS1 ZINC000455485591 1046773206 /nfs/dbraw/zinc/77/32/06/1046773206.db2.gz JUVFPQLBYTVRHH-UHFFFAOYSA-N 1 2 321.490 4.146 20 0 DIADLO Cc1cccc([C@H](C)CNC(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000455480065 1046773835 /nfs/dbraw/zinc/77/38/35/1046773835.db2.gz HCLLUPQLZHWVGL-CQSZACIVSA-N 1 2 311.429 4.240 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCCC23CCCCC3)c(C)[nH+]1 ZINC000455481825 1046773925 /nfs/dbraw/zinc/77/39/25/1046773925.db2.gz HWTYDINCRXCLGS-UHFFFAOYSA-N 1 2 301.434 4.337 20 0 DIADLO Oc1cccc(C[NH2+]Cc2ccc(C3CC3)cc2F)c1Cl ZINC000645181917 1046774835 /nfs/dbraw/zinc/77/48/35/1046774835.db2.gz JRKOPTIKPLOILY-UHFFFAOYSA-N 1 2 305.780 4.352 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)c(C)[nH+]1 ZINC000455490756 1046775209 /nfs/dbraw/zinc/77/52/09/1046775209.db2.gz XQDZDZPOEGMDSC-YJBOKZPZSA-N 1 2 323.440 4.417 20 0 DIADLO CCCCCn1cc(C[NH2+]Cc2cccc(O)c2Cl)c(C)n1 ZINC000645171256 1046775805 /nfs/dbraw/zinc/77/58/05/1046775805.db2.gz GLXYWMJNXMVUGW-UHFFFAOYSA-N 1 2 321.852 4.031 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](C)c2cccc(F)c2F)c(C)[nH+]1 ZINC000455492793 1046775793 /nfs/dbraw/zinc/77/57/93/1046775793.db2.gz LLDIHBUNKPXGKI-LLVKDONJSA-N 1 2 319.355 4.168 20 0 DIADLO Oc1cccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)c1Cl ZINC000645178100 1046776446 /nfs/dbraw/zinc/77/64/46/1046776446.db2.gz YFWLCTBNHIAYIH-UHFFFAOYSA-N 1 2 318.150 4.267 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)c(C)[nH+]1 ZINC000455504376 1046777893 /nfs/dbraw/zinc/77/78/93/1046777893.db2.gz WNMGFMNFBSIYAI-SJKOYZFVSA-N 1 2 324.428 4.017 20 0 DIADLO Oc1cccc(C[N@@H+]2CC[C@H]2c2ccccc2)c1Br ZINC001140550889 1046777949 /nfs/dbraw/zinc/77/79/49/1046777949.db2.gz NNLLMPWGGDIJQR-AWEZNQCLSA-N 1 2 318.214 4.102 20 0 DIADLO Oc1cccc(C[N@H+]2CC[C@H]2c2ccccc2)c1Br ZINC001140550889 1046777963 /nfs/dbraw/zinc/77/79/63/1046777963.db2.gz NNLLMPWGGDIJQR-AWEZNQCLSA-N 1 2 318.214 4.102 20 0 DIADLO Cc1ccc([C@@H](C)CNC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000455500076 1046777926 /nfs/dbraw/zinc/77/79/26/1046777926.db2.gz SSJNMEMWYLPQQM-AWEZNQCLSA-N 1 2 311.429 4.240 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1CCO[C@H](c2cccs2)C1 ZINC000645189763 1046778623 /nfs/dbraw/zinc/77/86/23/1046778623.db2.gz GXOCIQMAIDJSOV-INIZCTEOSA-N 1 2 310.422 4.183 20 0 DIADLO CCS[C@H]1CC[C@@H](N(C)C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000455508412 1046778804 /nfs/dbraw/zinc/77/88/04/1046778804.db2.gz ZTSRTLATPQRLKW-CABCVRRESA-N 1 2 321.490 4.145 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC[C@@H](C[C@H]3CCOC3)C2)c1 ZINC000645205266 1046778978 /nfs/dbraw/zinc/77/89/78/1046778978.db2.gz DHOVBVNKVDJGTQ-LSDHHAIUSA-N 1 2 314.404 4.017 20 0 DIADLO COc1ccc2c(c1)CC[N@@H+](Cc1cccc(F)c1Cl)C2 ZINC001140560200 1046782768 /nfs/dbraw/zinc/78/27/68/1046782768.db2.gz QSWZWIAGSGLCPC-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc2c(c1)CC[N@H+](Cc1cccc(F)c1Cl)C2 ZINC001140560200 1046782777 /nfs/dbraw/zinc/78/27/77/1046782777.db2.gz QSWZWIAGSGLCPC-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Fc1cccc(C[N@@H+]2CC[C@@H]2COCc2ccccc2)c1Cl ZINC001140563514 1046783483 /nfs/dbraw/zinc/78/34/83/1046783483.db2.gz ZQSMIPQUKRJSPD-MRXNPFEDSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1cccc(C[N@H+]2CC[C@@H]2COCc2ccccc2)c1Cl ZINC001140563514 1046783487 /nfs/dbraw/zinc/78/34/87/1046783487.db2.gz ZQSMIPQUKRJSPD-MRXNPFEDSA-N 1 2 319.807 4.270 20 0 DIADLO CC(C)[C@@H]1C[C@@H](OC(=O)CCCn2cc[nH+]c2)c2ccccc21 ZINC000797089509 1046787976 /nfs/dbraw/zinc/78/79/76/1046787976.db2.gz QALZPMHZVHKRSP-ZWKOTPCHSA-N 1 2 312.413 4.091 20 0 DIADLO Cc1ccc([C@@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)c(C)n1 ZINC000679152739 1046788578 /nfs/dbraw/zinc/78/85/78/1046788578.db2.gz GXVVVBYXEQOKPV-MRXNPFEDSA-N 1 2 310.445 4.257 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)c1cc(Cl)c(F)cc1Cl ZINC000645406737 1046788688 /nfs/dbraw/zinc/78/86/88/1046788688.db2.gz SDLKUXBTCPJCIB-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO Clc1ccc(C[N@@H+]2CC[C@@H](Oc3ccccc3Cl)C2)nc1 ZINC000679220324 1046792871 /nfs/dbraw/zinc/79/28/71/1046792871.db2.gz YGYOJJHHHVGMPH-CQSZACIVSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccc(C[N@H+]2CC[C@@H](Oc3ccccc3Cl)C2)nc1 ZINC000679220324 1046792881 /nfs/dbraw/zinc/79/28/81/1046792881.db2.gz YGYOJJHHHVGMPH-CQSZACIVSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cc(C[N@@H+]2CC[C@]3(C2)CCCCO3)c(Cl)s1 ZINC001140584916 1046796259 /nfs/dbraw/zinc/79/62/59/1046796259.db2.gz JVKLWSZVAWEPJQ-ZDUSSCGKSA-N 1 2 306.258 4.200 20 0 DIADLO Clc1cc(C[N@H+]2CC[C@]3(C2)CCCCO3)c(Cl)s1 ZINC001140584916 1046796272 /nfs/dbraw/zinc/79/62/72/1046796272.db2.gz JVKLWSZVAWEPJQ-ZDUSSCGKSA-N 1 2 306.258 4.200 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2cc(Cl)ncc2F)cc1 ZINC001140611167 1046809151 /nfs/dbraw/zinc/80/91/51/1046809151.db2.gz ZQOJICNXMCMZJP-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2cc(Cl)ncc2F)cc1 ZINC001140611167 1046809174 /nfs/dbraw/zinc/80/91/74/1046809174.db2.gz ZQOJICNXMCMZJP-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO Fc1ccccc1C1CC[NH+](Cc2cc(Cl)ncc2F)CC1 ZINC001140607876 1046810176 /nfs/dbraw/zinc/81/01/76/1046810176.db2.gz YYSPKASDQRNBRR-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Cc1n[nH]cc1[C@@H](C)[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000679358533 1046827807 /nfs/dbraw/zinc/82/78/07/1046827807.db2.gz IDOQEMRDDRTJEA-SECBINFHSA-N 1 2 310.228 4.365 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)[C@H](C)c2ccccc2)n1 ZINC000248005327 1046832999 /nfs/dbraw/zinc/83/29/99/1046832999.db2.gz KTIVNTIHPKAKJY-CHWSQXEVSA-N 1 2 305.447 4.077 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)[C@H](C)c2ccccc2)n1 ZINC000248005327 1046833017 /nfs/dbraw/zinc/83/30/17/1046833017.db2.gz KTIVNTIHPKAKJY-CHWSQXEVSA-N 1 2 305.447 4.077 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)[C@H](C)c2ccc(C)cc2)n1 ZINC000247966826 1046835056 /nfs/dbraw/zinc/83/50/56/1046835056.db2.gz GXQUYEXWQSTOEQ-KGLIPLIRSA-N 1 2 319.474 4.385 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2)n1 ZINC000247966826 1046835074 /nfs/dbraw/zinc/83/50/74/1046835074.db2.gz GXQUYEXWQSTOEQ-KGLIPLIRSA-N 1 2 319.474 4.385 20 0 DIADLO Cc1ccc(Br)c(C[N@H+]2CCC[C@](C)(F)C2)c1 ZINC001137382362 1046883508 /nfs/dbraw/zinc/88/35/08/1046883508.db2.gz TWCRGTWYXZNZPI-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cccc([C@@H]2CCCC[N@@H+]2Cc2noc(C3CC3)n2)c1C ZINC000075999649 1046838653 /nfs/dbraw/zinc/83/86/53/1046838653.db2.gz KOOUZFFGBPZAOH-KRWDZBQOSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1cccc([C@@H]2CCCC[N@H+]2Cc2noc(C3CC3)n2)c1C ZINC000075999649 1046838675 /nfs/dbraw/zinc/83/86/75/1046838675.db2.gz KOOUZFFGBPZAOH-KRWDZBQOSA-N 1 2 311.429 4.291 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+]C2(c3cccc(F)c3)CCC2)o1 ZINC000646004184 1046845623 /nfs/dbraw/zinc/84/56/23/1046845623.db2.gz FZQRTMYUCUZZHJ-UHFFFAOYSA-N 1 2 302.393 4.280 20 0 DIADLO Cc1cccc(C2([NH2+]Cc3nc(CCC(C)C)no3)CCC2)c1 ZINC000646021719 1046845760 /nfs/dbraw/zinc/84/57/60/1046845760.db2.gz XLCDRWMJIMRRQV-UHFFFAOYSA-N 1 2 313.445 4.136 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3nc(-c4ccccc4)no3)CCC2)c1 ZINC000646004549 1046846210 /nfs/dbraw/zinc/84/62/10/1046846210.db2.gz DQWORGVONISMSQ-UHFFFAOYSA-N 1 2 323.371 4.045 20 0 DIADLO Cc1cccc(C2([NH2+]Cc3nc(C4CCCC4)no3)CCC2)c1 ZINC000646021915 1046846242 /nfs/dbraw/zinc/84/62/42/1046846242.db2.gz KZWFMHJYISJWFZ-UHFFFAOYSA-N 1 2 311.429 4.205 20 0 DIADLO Fc1cccc([C@H]2CC[N@@H+]2Cc2conc2Cc2ccccc2)c1 ZINC000646094934 1046855881 /nfs/dbraw/zinc/85/58/81/1046855881.db2.gz MNDXIWVNWKNXKH-HXUWFJFHSA-N 1 2 322.383 4.352 20 0 DIADLO Fc1cccc([C@H]2CC[N@H+]2Cc2conc2Cc2ccccc2)c1 ZINC000646094934 1046855900 /nfs/dbraw/zinc/85/59/00/1046855900.db2.gz MNDXIWVNWKNXKH-HXUWFJFHSA-N 1 2 322.383 4.352 20 0 DIADLO FC(F)Oc1cccc(Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001212061134 1046859271 /nfs/dbraw/zinc/85/92/71/1046859271.db2.gz XTGOIHPMNAXUFY-UHFFFAOYSA-N 1 2 301.296 4.217 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)o1 ZINC000646117169 1046859050 /nfs/dbraw/zinc/85/90/50/1046859050.db2.gz RMZOGDNGGIBLME-PBHICJAKSA-N 1 2 309.413 4.086 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)o1 ZINC000646117169 1046859073 /nfs/dbraw/zinc/85/90/73/1046859073.db2.gz RMZOGDNGGIBLME-PBHICJAKSA-N 1 2 309.413 4.086 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccn(C2CCCC2)n1 ZINC000679540901 1046865370 /nfs/dbraw/zinc/86/53/70/1046865370.db2.gz IFZJYYZYVZWAET-QWHCGFSZSA-N 1 2 315.383 4.161 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccn(C2CCCC2)n1 ZINC000679540901 1046865389 /nfs/dbraw/zinc/86/53/89/1046865389.db2.gz IFZJYYZYVZWAET-QWHCGFSZSA-N 1 2 315.383 4.161 20 0 DIADLO C[N@H+](CCC(=O)c1ccccc1)Cc1cc(F)c(Cl)cc1F ZINC001140701701 1046866326 /nfs/dbraw/zinc/86/63/26/1046866326.db2.gz WTWDGCCHDWDWHI-UHFFFAOYSA-N 1 2 323.770 4.323 20 0 DIADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1cc(F)c(Cl)cc1F ZINC001140701701 1046866342 /nfs/dbraw/zinc/86/63/42/1046866342.db2.gz WTWDGCCHDWDWHI-UHFFFAOYSA-N 1 2 323.770 4.323 20 0 DIADLO Cc1nc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)nc2ccccc12 ZINC000679549706 1046868961 /nfs/dbraw/zinc/86/89/61/1046868961.db2.gz YPHVJQJZHZZQEO-WCQYABFASA-N 1 2 323.362 4.101 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)nc2ccccc12 ZINC000679549706 1046868973 /nfs/dbraw/zinc/86/89/73/1046868973.db2.gz YPHVJQJZHZZQEO-WCQYABFASA-N 1 2 323.362 4.101 20 0 DIADLO C[N@H+](Cc1nc2ccccc2s1)Cc1cc(Cl)ccc1N ZINC001140716406 1046873007 /nfs/dbraw/zinc/87/30/07/1046873007.db2.gz MVDORLOVFGSHEK-UHFFFAOYSA-N 1 2 317.845 4.164 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2s1)Cc1cc(Cl)ccc1N ZINC001140716406 1046873016 /nfs/dbraw/zinc/87/30/16/1046873016.db2.gz MVDORLOVFGSHEK-UHFFFAOYSA-N 1 2 317.845 4.164 20 0 DIADLO Cc1ccc(Br)c(C[N@@H+]2CCC[C@](C)(F)C2)c1 ZINC001137382362 1046883495 /nfs/dbraw/zinc/88/34/95/1046883495.db2.gz TWCRGTWYXZNZPI-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO CC1(C)CC[NH+](Cc2ccc(Br)c(F)c2F)CC1 ZINC000701300315 1046884107 /nfs/dbraw/zinc/88/41/07/1046884107.db2.gz QDRNSBRNNOUOTQ-UHFFFAOYSA-N 1 2 318.205 4.349 20 0 DIADLO FC(F)O[C@@H]1CCC[N@H+](Cc2csc(-c3ccccc3)n2)C1 ZINC000679684456 1046891699 /nfs/dbraw/zinc/89/16/99/1046891699.db2.gz SRQNPZRYIHGDJM-CQSZACIVSA-N 1 2 324.396 4.014 20 0 DIADLO FC(F)O[C@@H]1CCC[N@@H+](Cc2csc(-c3ccccc3)n2)C1 ZINC000679684456 1046891713 /nfs/dbraw/zinc/89/17/13/1046891713.db2.gz SRQNPZRYIHGDJM-CQSZACIVSA-N 1 2 324.396 4.014 20 0 DIADLO FC(F)O[C@H]1CCC[N@H+](Cc2csc(-c3ccccc3)n2)C1 ZINC000679684455 1046892852 /nfs/dbraw/zinc/89/28/52/1046892852.db2.gz SRQNPZRYIHGDJM-AWEZNQCLSA-N 1 2 324.396 4.014 20 0 DIADLO FC(F)O[C@H]1CCC[N@@H+](Cc2csc(-c3ccccc3)n2)C1 ZINC000679684455 1046892863 /nfs/dbraw/zinc/89/28/63/1046892863.db2.gz SRQNPZRYIHGDJM-AWEZNQCLSA-N 1 2 324.396 4.014 20 0 DIADLO FC(F)O[C@@H]1CCC[N@H+](Cc2c(Cl)cccc2Cl)C1 ZINC000679680635 1046893272 /nfs/dbraw/zinc/89/32/72/1046893272.db2.gz KHFOUOGAPXZZSJ-SECBINFHSA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@@H]1CCC[N@@H+](Cc2c(Cl)cccc2Cl)C1 ZINC000679680635 1046893283 /nfs/dbraw/zinc/89/32/83/1046893283.db2.gz KHFOUOGAPXZZSJ-SECBINFHSA-N 1 2 310.171 4.197 20 0 DIADLO Oc1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2c2cccnc2)c1 ZINC001140794342 1046903117 /nfs/dbraw/zinc/90/31/17/1046903117.db2.gz IBFGKUVANINQJD-KRWDZBQOSA-N 1 2 302.805 4.168 20 0 DIADLO Oc1cc(Cl)cc(C[N@H+]2CCCC[C@H]2c2cccnc2)c1 ZINC001140794342 1046903147 /nfs/dbraw/zinc/90/31/47/1046903147.db2.gz IBFGKUVANINQJD-KRWDZBQOSA-N 1 2 302.805 4.168 20 0 DIADLO C[C@H]([NH2+]Cc1ccon1)c1ccc(OCc2ccccc2)cc1 ZINC000303379110 1046914444 /nfs/dbraw/zinc/91/44/44/1046914444.db2.gz KZOPNWDAFQFVDY-HNNXBMFYSA-N 1 2 308.381 4.104 20 0 DIADLO Cc1ccccc1-c1cnc(C[NH2+][C@@H](C)c2cnccc2C)o1 ZINC000679940241 1046916141 /nfs/dbraw/zinc/91/61/41/1046916141.db2.gz MLJIMPOANAOAHP-HNNXBMFYSA-N 1 2 307.397 4.204 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)CC(=O)OCc1ccccc1 ZINC000303411573 1046917389 /nfs/dbraw/zinc/91/73/89/1046917389.db2.gz UWLNRFYIOPLHBA-HNNXBMFYSA-N 1 2 323.392 4.169 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)CC(=O)OCc1ccccc1 ZINC000303411573 1046917400 /nfs/dbraw/zinc/91/74/00/1046917400.db2.gz UWLNRFYIOPLHBA-HNNXBMFYSA-N 1 2 323.392 4.169 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)c1ccc(-c2ccccc2)cc1 ZINC000798140725 1046930199 /nfs/dbraw/zinc/93/01/99/1046930199.db2.gz ZWNGTCOULIMWIH-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO Clc1cc(Nc2cccc(Cn3cc[nH+]c3)c2)cc(Cl)n1 ZINC001212096352 1046933525 /nfs/dbraw/zinc/93/35/25/1046933525.db2.gz FZOKUKNDQANGIV-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1ccc(Cl)s1 ZINC000680041680 1046937007 /nfs/dbraw/zinc/93/70/07/1046937007.db2.gz MEQWUUCWWSNYKN-XCBNKYQSSA-N 1 2 315.772 4.464 20 0 DIADLO C[N@H+](Cc1cc(F)c(C(F)(F)F)c(F)c1)Cc1ccccn1 ZINC001140877825 1046939434 /nfs/dbraw/zinc/93/94/34/1046939434.db2.gz INCBMHGTHQDFSS-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO C[N@@H+](Cc1cc(F)c(C(F)(F)F)c(F)c1)Cc1ccccn1 ZINC001140877825 1046939446 /nfs/dbraw/zinc/93/94/46/1046939446.db2.gz INCBMHGTHQDFSS-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO Nc1cccc(F)c1C[N@@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001140876893 1046939969 /nfs/dbraw/zinc/93/99/69/1046939969.db2.gz PUETXGLTXYDXFV-INIZCTEOSA-N 1 2 306.331 4.023 20 0 DIADLO Nc1cccc(F)c1C[N@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001140876893 1046939974 /nfs/dbraw/zinc/93/99/74/1046939974.db2.gz PUETXGLTXYDXFV-INIZCTEOSA-N 1 2 306.331 4.023 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1cccc(F)c1 ZINC000261466621 1046940501 /nfs/dbraw/zinc/94/05/01/1046940501.db2.gz VTYAOHOKZWNPSQ-AWEZNQCLSA-N 1 2 323.371 4.144 20 0 DIADLO C[C@@]1(F)CCC[N@H+](Cc2ccc(OC(F)(F)F)c(F)c2)C1 ZINC001140885932 1046941424 /nfs/dbraw/zinc/94/14/24/1046941424.db2.gz LJJJJRSGNLEIFX-CYBMUJFWSA-N 1 2 309.278 4.048 20 0 DIADLO C[C@@]1(F)CCC[N@@H+](Cc2ccc(OC(F)(F)F)c(F)c2)C1 ZINC001140885932 1046941430 /nfs/dbraw/zinc/94/14/30/1046941430.db2.gz LJJJJRSGNLEIFX-CYBMUJFWSA-N 1 2 309.278 4.048 20 0 DIADLO Oc1ccc(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)c(F)c1F ZINC001140892876 1046942555 /nfs/dbraw/zinc/94/25/55/1046942555.db2.gz CEXXTLAOLUTWND-LLVKDONJSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1ccc(C[N@H+]2CCC[C@H]2c2ccccc2F)c(F)c1F ZINC001140894387 1046946819 /nfs/dbraw/zinc/94/68/19/1046946819.db2.gz WIIKYXIITIDUEF-AWEZNQCLSA-N 1 2 307.315 4.147 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1cnccc1C(F)(F)F ZINC001140916154 1046948185 /nfs/dbraw/zinc/94/81/85/1046948185.db2.gz YXLIVQZDGHZWDF-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cnccc1C(F)(F)F ZINC001140916154 1046948196 /nfs/dbraw/zinc/94/81/96/1046948196.db2.gz YXLIVQZDGHZWDF-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO CCCOc1cccc2c(N3CCC(F)(F)CC3)cc[nH+]c12 ZINC000798398860 1046951184 /nfs/dbraw/zinc/95/11/84/1046951184.db2.gz BIUCQJGNWMSZJZ-UHFFFAOYSA-N 1 2 306.356 4.259 20 0 DIADLO C[C@@]12c3ccccc3[C@@H](Cc3ccccc31)[N@H+]2Cc1cnco1 ZINC001140934059 1046952993 /nfs/dbraw/zinc/95/29/93/1046952993.db2.gz RNBYMHJQOGFOHK-UXHICEINSA-N 1 2 302.377 4.051 20 0 DIADLO C[C@@]12c3ccccc3[C@@H](Cc3ccccc31)[N@@H+]2Cc1cnco1 ZINC001140934059 1046952997 /nfs/dbraw/zinc/95/29/97/1046952997.db2.gz RNBYMHJQOGFOHK-UXHICEINSA-N 1 2 302.377 4.051 20 0 DIADLO C[N@H+](Cc1cnco1)Cc1cc(F)ccc1Oc1ccccc1 ZINC001140932701 1046954368 /nfs/dbraw/zinc/95/43/68/1046954368.db2.gz XFCDYWKRCFVPNG-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO C[N@@H+](Cc1cnco1)Cc1cc(F)ccc1Oc1ccccc1 ZINC001140932701 1046954378 /nfs/dbraw/zinc/95/43/78/1046954378.db2.gz XFCDYWKRCFVPNG-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+](C)Cc1ccc(F)cc1F ZINC000615090988 1046956463 /nfs/dbraw/zinc/95/64/63/1046956463.db2.gz BHRCHZRQZBIYSV-UHFFFAOYSA-N 1 2 305.368 4.384 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+](C)Cc1ccc(F)cc1F ZINC000615090988 1046956473 /nfs/dbraw/zinc/95/64/73/1046956473.db2.gz BHRCHZRQZBIYSV-UHFFFAOYSA-N 1 2 305.368 4.384 20 0 DIADLO O=C(Nc1cc(Cl)c(Cl)cc1F)c1cccc2[nH+]ccn21 ZINC000798580895 1046962387 /nfs/dbraw/zinc/96/23/87/1046962387.db2.gz WVJDHCKYYPVAEX-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)s1 ZINC000680334144 1046965778 /nfs/dbraw/zinc/96/57/78/1046965778.db2.gz IIXRHEWPWFLTJF-GHMZBOCLSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1cnc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)s1 ZINC000680334144 1046965781 /nfs/dbraw/zinc/96/57/81/1046965781.db2.gz IIXRHEWPWFLTJF-GHMZBOCLSA-N 1 2 306.397 4.429 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(Cl)c1Cl)c1cc2n(n1)CCCC2 ZINC000647286414 1046967227 /nfs/dbraw/zinc/96/72/27/1046967227.db2.gz VDBBCUNXAQTZAG-NSHDSACASA-N 1 2 324.255 4.377 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1cc2n(n1)CCCC2)c1cc(F)ccc1F ZINC000647293323 1046969638 /nfs/dbraw/zinc/96/96/38/1046969638.db2.gz AFWYCAYRTQCRDG-YVEFUNNKSA-N 1 2 319.399 4.300 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1cc(F)cc(F)c1 ZINC000680355253 1046971395 /nfs/dbraw/zinc/97/13/95/1046971395.db2.gz NWSAMVATGFCMAY-XLKFXECMSA-N 1 2 311.278 4.027 20 0 DIADLO COc1cc(C)ccc1[C@H](C)[NH2+][C@H]1COc2cc(F)cc(F)c21 ZINC000680355430 1046974093 /nfs/dbraw/zinc/97/40/93/1046974093.db2.gz PJHAFYDVZBTYHE-NHYWBVRUSA-N 1 2 319.351 4.066 20 0 DIADLO COc1ccccc1C1([NH2+][C@H](C)c2ccncc2Cl)CC1 ZINC000647328895 1046979043 /nfs/dbraw/zinc/97/90/43/1046979043.db2.gz AGMRLIVRXVECKX-GFCCVEGCSA-N 1 2 302.805 4.084 20 0 DIADLO Clc1ccc(SC2CC[NH+](Cc3ncco3)CC2)cc1 ZINC001141011117 1046979406 /nfs/dbraw/zinc/97/94/06/1046979406.db2.gz QGPKLNDONABHKN-UHFFFAOYSA-N 1 2 308.834 4.085 20 0 DIADLO CSc1cc(Cl)ccc1NCc1cccc2[nH+]ccn21 ZINC001203089214 1046990528 /nfs/dbraw/zinc/99/05/28/1046990528.db2.gz CVAAUVFVUMDMBK-UHFFFAOYSA-N 1 2 303.818 4.322 20 0 DIADLO FC1(F)CC[C@@H](Nc2[nH+]cccc2OCc2ccccc2)C1 ZINC000680621891 1046995860 /nfs/dbraw/zinc/99/58/60/1046995860.db2.gz KPRFQFUFMDOKAP-CQSZACIVSA-N 1 2 304.340 4.260 20 0 DIADLO C[C@H](CNc1[nH+]cccc1OCc1ccccc1)c1ccncc1 ZINC000680621865 1046995998 /nfs/dbraw/zinc/99/59/98/1046995998.db2.gz JHKKQQXZWJTAOY-MRXNPFEDSA-N 1 2 319.408 4.271 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@H]2c2ccccc2OC)c[nH]1 ZINC001141070104 1046996087 /nfs/dbraw/zinc/99/60/87/1046996087.db2.gz OYMNYJGWLFGZQU-KRWDZBQOSA-N 1 2 313.445 4.098 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@H]2c2ccccc2OC)c[nH]1 ZINC001141070104 1046996096 /nfs/dbraw/zinc/99/60/96/1046996096.db2.gz OYMNYJGWLFGZQU-KRWDZBQOSA-N 1 2 313.445 4.098 20 0 DIADLO CCCCc1[nH]c(CN2CCc3c4ccccc4oc3C2)c[nH+]1 ZINC001141071099 1046996270 /nfs/dbraw/zinc/99/62/70/1046996270.db2.gz BCOFHIIACMHYLC-UHFFFAOYSA-N 1 2 309.413 4.057 20 0 DIADLO CCCCc1[nH]cc(CN2CCc3c4ccccc4oc3C2)[nH+]1 ZINC001141071099 1046996284 /nfs/dbraw/zinc/99/62/84/1046996284.db2.gz BCOFHIIACMHYLC-UHFFFAOYSA-N 1 2 309.413 4.057 20 0 DIADLO CCCCc1[nH]cc(CN2CCC[C@@H]2c2ccc(F)cc2F)[nH+]1 ZINC001141071128 1046997006 /nfs/dbraw/zinc/99/70/06/1046997006.db2.gz CLAVXSCOXBKWKM-QGZVFWFLSA-N 1 2 319.399 4.368 20 0 DIADLO CCCCc1[nH]c(CN2CCC[C@@H]2c2ccc(F)cc2F)c[nH+]1 ZINC001141071128 1046997016 /nfs/dbraw/zinc/99/70/16/1046997016.db2.gz CLAVXSCOXBKWKM-QGZVFWFLSA-N 1 2 319.399 4.368 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cc1nc2ccc(F)cc2o1 ZINC000162531044 1047001099 /nfs/dbraw/zinc/00/10/99/1047001099.db2.gz JFFSNDKWQAKLLJ-UHFFFAOYSA-N 1 2 310.781 4.314 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1nc2ccc(F)cc2o1 ZINC000162531044 1047001111 /nfs/dbraw/zinc/00/11/11/1047001111.db2.gz JFFSNDKWQAKLLJ-UHFFFAOYSA-N 1 2 310.781 4.314 20 0 DIADLO Clc1cnc(C[NH+]2CCC(c3ccccc3)CC2)c(Cl)n1 ZINC001141133990 1047021878 /nfs/dbraw/zinc/02/18/78/1047021878.db2.gz LUKRSHKLUVHLGF-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO c1nc(C[N@@H+]2CCSC[C@H]2c2cccc3ccccc32)co1 ZINC001141132091 1047022954 /nfs/dbraw/zinc/02/29/54/1047022954.db2.gz SZDHBLMMACMJEX-SFHVURJKSA-N 1 2 310.422 4.118 20 0 DIADLO c1nc(C[N@H+]2CCSC[C@H]2c2cccc3ccccc32)co1 ZINC001141132091 1047022970 /nfs/dbraw/zinc/02/29/70/1047022970.db2.gz SZDHBLMMACMJEX-SFHVURJKSA-N 1 2 310.422 4.118 20 0 DIADLO CCC[N@H+](Cc1ccccc1)Cc1ncc(Cl)nc1Cl ZINC001141136723 1047024541 /nfs/dbraw/zinc/02/45/41/1047024541.db2.gz LXAWKXRFWAWZRQ-UHFFFAOYSA-N 1 2 310.228 4.196 20 0 DIADLO CCC[N@@H+](Cc1ccccc1)Cc1ncc(Cl)nc1Cl ZINC001141136723 1047024555 /nfs/dbraw/zinc/02/45/55/1047024555.db2.gz LXAWKXRFWAWZRQ-UHFFFAOYSA-N 1 2 310.228 4.196 20 0 DIADLO COc1ccc2nccc(C[N@@H+]3Cc4ccc(Cl)cc4C3)c2c1 ZINC001141151621 1047030236 /nfs/dbraw/zinc/03/02/36/1047030236.db2.gz SBAHZSXOHRSIAY-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO COc1ccc2nccc(C[N@H+]3Cc4ccc(Cl)cc4C3)c2c1 ZINC001141151621 1047030253 /nfs/dbraw/zinc/03/02/53/1047030253.db2.gz SBAHZSXOHRSIAY-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO CC1(CC(F)F)C[NH+](Cc2ncc(-c3ccccc3)s2)C1 ZINC000648058753 1047031994 /nfs/dbraw/zinc/03/19/94/1047031994.db2.gz AITJLUCFNOXNCL-UHFFFAOYSA-N 1 2 308.397 4.287 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2cc(C)c(C)cc2Cl)c[nH+]1 ZINC000455753224 1047036197 /nfs/dbraw/zinc/03/61/97/1047036197.db2.gz UYMYQGQNCFVGBX-UHFFFAOYSA-N 1 2 317.820 4.290 20 0 DIADLO COc1ccc(C(F)(F)F)cc1C[N@@H+]1CCCC[C@H](F)C1 ZINC001141199647 1047044802 /nfs/dbraw/zinc/04/48/02/1047044802.db2.gz KBXUUQZPVOTOPA-ZDUSSCGKSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C(F)(F)F)cc1C[N@H+]1CCCC[C@H](F)C1 ZINC001141199647 1047044815 /nfs/dbraw/zinc/04/48/15/1047044815.db2.gz KBXUUQZPVOTOPA-ZDUSSCGKSA-N 1 2 305.315 4.038 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2cccc(-c3ccccn3)c2)cs1 ZINC000536655741 1047046251 /nfs/dbraw/zinc/04/62/51/1047046251.db2.gz XDGLQMQALORAJO-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2cccc(-c3ccccn3)c2)cs1 ZINC000536655741 1047046259 /nfs/dbraw/zinc/04/62/59/1047046259.db2.gz XDGLQMQALORAJO-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@H+](Cc2csc(-c3ccccc3)n2)C1 ZINC001141214168 1047048704 /nfs/dbraw/zinc/04/87/04/1047048704.db2.gz MKVVZWUREVDDBM-GFCCVEGCSA-N 1 2 312.360 4.194 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@@H+](Cc2csc(-c3ccccc3)n2)C1 ZINC001141214168 1047048717 /nfs/dbraw/zinc/04/87/17/1047048717.db2.gz MKVVZWUREVDDBM-GFCCVEGCSA-N 1 2 312.360 4.194 20 0 DIADLO COc1cccc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)c1F ZINC001141223723 1047051083 /nfs/dbraw/zinc/05/10/83/1047051083.db2.gz MOTGVXGXXCLVGY-OAHLLOKOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c1F ZINC001141223723 1047051069 /nfs/dbraw/zinc/05/10/69/1047051069.db2.gz MOTGVXGXXCLVGY-OAHLLOKOSA-N 1 2 321.342 4.450 20 0 DIADLO c1ccc2c(c1)[nH]c1c2C[C@H](Nc2ccc([NH+]3CCCC3)cc2)C1 ZINC000799720580 1047054878 /nfs/dbraw/zinc/05/48/78/1047054878.db2.gz JYUDXQCBTCWTCY-INIZCTEOSA-N 1 2 317.436 4.347 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H]1Cc2[nH]c3ccccc3c2C1 ZINC000799720989 1047054927 /nfs/dbraw/zinc/05/49/27/1047054927.db2.gz PDBHUWGJCPGGHP-AWEZNQCLSA-N 1 2 305.425 4.122 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@@H]3Cc4[nH]c5ccccc5c4C3)ccc21 ZINC000799724072 1047057419 /nfs/dbraw/zinc/05/74/19/1047057419.db2.gz CUXJCFPSMTWAPO-INIZCTEOSA-N 1 2 317.436 4.130 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@@H]3Cc4[nH]c5ccccc5c4C3)ccc21 ZINC000799724072 1047057429 /nfs/dbraw/zinc/05/74/29/1047057429.db2.gz CUXJCFPSMTWAPO-INIZCTEOSA-N 1 2 317.436 4.130 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cnc(Cl)s2)ccc1Cl ZINC001141232434 1047057435 /nfs/dbraw/zinc/05/74/35/1047057435.db2.gz FIRDEXBYIPIFGO-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cnc(Cl)s2)ccc1Cl ZINC001141232434 1047057445 /nfs/dbraw/zinc/05/74/45/1047057445.db2.gz FIRDEXBYIPIFGO-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2Cl)C[N@@H+]1Cc1cccs1 ZINC000536673008 1047065089 /nfs/dbraw/zinc/06/50/89/1047065089.db2.gz ICBYHBWQHKGDEG-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2Cl)C[N@H+]1Cc1cccs1 ZINC000536673008 1047065101 /nfs/dbraw/zinc/06/51/01/1047065101.db2.gz ICBYHBWQHKGDEG-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO CC[C@@H](C)Oc1cc(C[NH2+][C@H](CC)C(F)F)ccc1OC ZINC000648619215 1047073407 /nfs/dbraw/zinc/07/34/07/1047073407.db2.gz DTALWRLTGZFBDK-DGCLKSJQSA-N 1 2 301.377 4.006 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NCc1cscc1Cl ZINC000680976479 1047074668 /nfs/dbraw/zinc/07/46/68/1047074668.db2.gz KHEDZWAUBFRCPR-UHFFFAOYSA-N 1 2 321.833 4.010 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2cccc(C(F)(F)F)n2)c(C)s1 ZINC000648656382 1047078806 /nfs/dbraw/zinc/07/88/06/1047078806.db2.gz NMYQQUSPFTULBX-QMMMGPOBSA-N 1 2 315.364 4.025 20 0 DIADLO Cc1cc(N2CCN(c3ccccc3F)CC2)[nH+]c2ccccc12 ZINC001115812268 1047083134 /nfs/dbraw/zinc/08/31/34/1047083134.db2.gz OIOZEDNIKHAPCP-UHFFFAOYSA-N 1 2 321.399 4.009 20 0 DIADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccc(Oc2ccc(F)cc2)cc1 ZINC001141315110 1047087401 /nfs/dbraw/zinc/08/74/01/1047087401.db2.gz QMSCUSWXQKNIJS-CQSZACIVSA-N 1 2 313.372 4.171 20 0 DIADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1ccc(Oc2ccc(F)cc2)cc1 ZINC001141315110 1047087418 /nfs/dbraw/zinc/08/74/18/1047087418.db2.gz QMSCUSWXQKNIJS-CQSZACIVSA-N 1 2 313.372 4.171 20 0 DIADLO COc1ccsc1C[N@H+](Cc1ccccc1)Cc1cccnc1 ZINC001141324498 1047091674 /nfs/dbraw/zinc/09/16/74/1047091674.db2.gz IWRHZAXAJXUBJH-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO COc1ccsc1C[N@@H+](Cc1ccccc1)Cc1cccnc1 ZINC001141324498 1047091688 /nfs/dbraw/zinc/09/16/88/1047091688.db2.gz IWRHZAXAJXUBJH-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO COc1cccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1F ZINC000648801720 1047092872 /nfs/dbraw/zinc/09/28/72/1047092872.db2.gz SZJNDGSGMOPUNU-KRWDZBQOSA-N 1 2 301.361 4.155 20 0 DIADLO COc1cccc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1F ZINC000648801720 1047092887 /nfs/dbraw/zinc/09/28/87/1047092887.db2.gz SZJNDGSGMOPUNU-KRWDZBQOSA-N 1 2 301.361 4.155 20 0 DIADLO Clc1cnc(CNc2[nH+]c3ccccc3n2C2CC2)s1 ZINC000681128382 1047100354 /nfs/dbraw/zinc/10/03/54/1047100354.db2.gz DXCPUQIWHDHQCF-UHFFFAOYSA-N 1 2 304.806 4.093 20 0 DIADLO CC(C)(C)Oc1ccc(C[NH2+]Cc2ncc(Cl)s2)cc1 ZINC000681133759 1047100375 /nfs/dbraw/zinc/10/03/75/1047100375.db2.gz YIBPPZSBHOVVMZ-UHFFFAOYSA-N 1 2 310.850 4.264 20 0 DIADLO CCC[C@H]([NH2+]Cc1ccn(C)n1)c1ccc(Cl)cc1Cl ZINC000536830569 1047103467 /nfs/dbraw/zinc/10/34/67/1047103467.db2.gz CLQXTMCRAOOIGN-HNNXBMFYSA-N 1 2 312.244 4.358 20 0 DIADLO CCn1nc(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)c2ccccc21 ZINC000681166260 1047104610 /nfs/dbraw/zinc/10/46/10/1047104610.db2.gz LUXVYUAGFLHXTB-GOSISDBHSA-N 1 2 309.388 4.142 20 0 DIADLO CCn1nc(C[N@H+]2CC[C@@H]2c2cccc(F)c2)c2ccccc21 ZINC000681166260 1047104614 /nfs/dbraw/zinc/10/46/14/1047104614.db2.gz LUXVYUAGFLHXTB-GOSISDBHSA-N 1 2 309.388 4.142 20 0 DIADLO CC(C)c1ccccc1NC(=O)Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001141378745 1047110114 /nfs/dbraw/zinc/11/01/14/1047110114.db2.gz DTFLWBPFPWDMCO-UHFFFAOYSA-N 1 2 319.408 4.177 20 0 DIADLO c1cc(-c2cccc(C[NH+]3CC(Oc4cccnc4)C3)c2)cs1 ZINC001141384378 1047113335 /nfs/dbraw/zinc/11/33/35/1047113335.db2.gz KTBHCUWKWPLTNQ-UHFFFAOYSA-N 1 2 322.433 4.073 20 0 DIADLO CC[NH+](CC)c1ccc(Nc2nc3c(s2)C(=O)CCC3)cc1 ZINC001212968300 1047115470 /nfs/dbraw/zinc/11/54/70/1047115470.db2.gz VESMKISOAFPBEY-UHFFFAOYSA-N 1 2 315.442 4.252 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@H+](Cc1ccc(C)nc1C)CC3 ZINC000681405975 1047122556 /nfs/dbraw/zinc/12/25/56/1047122556.db2.gz NKWCCZBOCCJVOY-UHFFFAOYSA-N 1 2 305.425 4.046 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](Cc1ccc(C)nc1C)CC3 ZINC000681405975 1047122565 /nfs/dbraw/zinc/12/25/65/1047122565.db2.gz NKWCCZBOCCJVOY-UHFFFAOYSA-N 1 2 305.425 4.046 20 0 DIADLO Cc1cc(NCc2nnc(C(C)(C)C)s2)[nH+]c2ccccc12 ZINC001116255492 1047124006 /nfs/dbraw/zinc/12/40/06/1047124006.db2.gz AHNVQIBHSKLOLY-UHFFFAOYSA-N 1 2 312.442 4.304 20 0 DIADLO CCC[N@H+](Cc1nccn1C(C)C)[C@@H]1CCCc2cccnc21 ZINC000681468729 1047124946 /nfs/dbraw/zinc/12/49/46/1047124946.db2.gz IEYBBCJLMABALE-QGZVFWFLSA-N 1 2 312.461 4.149 20 0 DIADLO CCC[N@@H+](Cc1nccn1C(C)C)[C@@H]1CCCc2cccnc21 ZINC000681468729 1047124950 /nfs/dbraw/zinc/12/49/50/1047124950.db2.gz IEYBBCJLMABALE-QGZVFWFLSA-N 1 2 312.461 4.149 20 0 DIADLO Cc1cc(N[C@H]2CCO[C@]3(CCSC3)C2)[nH+]c2ccccc12 ZINC001116309150 1047129013 /nfs/dbraw/zinc/12/90/13/1047129013.db2.gz RKVJGGYKCDDKTD-KBXCAEBGSA-N 1 2 314.454 4.010 20 0 DIADLO COc1ccc(C)cc1C[NH2+][C@@H]1COCc2cccc(Cl)c21 ZINC000925305583 1047130178 /nfs/dbraw/zinc/13/01/78/1047130178.db2.gz NWPWTOINCCZWGK-MRXNPFEDSA-N 1 2 317.816 4.018 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccccc2C)[C@@H]2CCC[C@H](C)C2)no1 ZINC000537059506 1047133171 /nfs/dbraw/zinc/13/31/71/1047133171.db2.gz LERJMVIKNGCGOM-CRFBAAHOSA-N 1 2 313.445 4.344 20 0 DIADLO CCCc1ccc(C[NH2+]Cc2cc(COC(C)(C)C)on2)cc1 ZINC000681595099 1047133143 /nfs/dbraw/zinc/13/31/43/1047133143.db2.gz MQLDZYZMDUQMFX-UHFFFAOYSA-N 1 2 316.445 4.232 20 0 DIADLO CCOc1ccc(C)cc1C[N@H+](C)Cc1cccc(F)c1F ZINC001139607628 1047133292 /nfs/dbraw/zinc/13/32/92/1047133292.db2.gz YEFGPQWBLKTRJI-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CCOc1ccc(C)cc1C[N@@H+](C)Cc1cccc(F)c1F ZINC001139607628 1047133300 /nfs/dbraw/zinc/13/33/00/1047133300.db2.gz YEFGPQWBLKTRJI-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CC(C)(C)OCc1cc(C[NH2+]Cc2ccccc2C2CC2)no1 ZINC000681595098 1047133349 /nfs/dbraw/zinc/13/33/49/1047133349.db2.gz MPBVXEMOZLDURD-UHFFFAOYSA-N 1 2 314.429 4.157 20 0 DIADLO Cc1c2ccccc2oc1[C@H]([NH2+]Cc1nccc(C)n1)C(C)C ZINC000537059594 1047133443 /nfs/dbraw/zinc/13/34/43/1047133443.db2.gz OYCZXKLHZSTWCF-GOSISDBHSA-N 1 2 309.413 4.327 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000537123383 1047138211 /nfs/dbraw/zinc/13/82/11/1047138211.db2.gz QLKPNXPFSJZHLN-KGLIPLIRSA-N 1 2 322.412 4.106 20 0 DIADLO COC[C@@H]([NH2+]Cc1ncc(-c2ccccc2C)o1)c1ccccc1 ZINC000537108782 1047139777 /nfs/dbraw/zinc/13/97/77/1047139777.db2.gz JNDDMHIUONOKNC-GOSISDBHSA-N 1 2 322.408 4.127 20 0 DIADLO C[C@H]([NH2+]Cc1cc2n(n1)CCCC2)c1cc(Cl)ccc1Cl ZINC000649573771 1047146526 /nfs/dbraw/zinc/14/65/26/1047146526.db2.gz PEAKMYIEDYQTAV-NSHDSACASA-N 1 2 324.255 4.377 20 0 DIADLO C[C@@H]([NH2+]Cc1cc2n(n1)CCCC2)c1cccc(Cl)c1Cl ZINC000649575523 1047147188 /nfs/dbraw/zinc/14/71/88/1047147188.db2.gz SAJQMTZRXISGKZ-LLVKDONJSA-N 1 2 324.255 4.377 20 0 DIADLO COc1c(C)c[nH+]c(CSC[C@@H]2CC2(Cl)Cl)c1C ZINC001116493265 1047148594 /nfs/dbraw/zinc/14/85/94/1047148594.db2.gz MHAHWROIDQUVQY-JTQLQIEISA-N 1 2 306.258 4.134 20 0 DIADLO COc1cc(C)c([C@@H](C)Nc2ccc(C)[nH+]c2C)cc1OC ZINC001116485248 1047148797 /nfs/dbraw/zinc/14/87/97/1047148797.db2.gz TUCZFHKGXSHOPU-CYBMUJFWSA-N 1 2 300.402 4.197 20 0 DIADLO Fc1ccc(C2CC[NH+](Cc3ccc(Cl)nc3F)CC2)cc1 ZINC001137474091 1047151929 /nfs/dbraw/zinc/15/19/29/1047151929.db2.gz IJBYJTXGEROJBI-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)nc2F)c1 ZINC001137478121 1047152080 /nfs/dbraw/zinc/15/20/80/1047152080.db2.gz WGTSNBBEAWTJSO-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)nc2F)c1 ZINC001137478121 1047152084 /nfs/dbraw/zinc/15/20/84/1047152084.db2.gz WGTSNBBEAWTJSO-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO c1cc2c(s1)C[N@H+](Cc1ncc(-c3ccccc3)s1)CC2 ZINC000537204998 1047152680 /nfs/dbraw/zinc/15/26/80/1047152680.db2.gz OXSAZXVLWGMAKI-UHFFFAOYSA-N 1 2 312.463 4.430 20 0 DIADLO c1cc2c(s1)C[N@@H+](Cc1ncc(-c3ccccc3)s1)CC2 ZINC000537204998 1047152690 /nfs/dbraw/zinc/15/26/90/1047152690.db2.gz OXSAZXVLWGMAKI-UHFFFAOYSA-N 1 2 312.463 4.430 20 0 DIADLO C1=CCC2(C[N@@H+](Cc3cc4n(n3)CCCC4)[C@@H]2c2ccccc2)C1 ZINC000649636333 1047155038 /nfs/dbraw/zinc/15/50/38/1047155038.db2.gz UJPAIJMXJXVRNR-HXUWFJFHSA-N 1 2 319.452 4.113 20 0 DIADLO C1=CCC2(C[N@H+](Cc3cc4n(n3)CCCC4)[C@@H]2c2ccccc2)C1 ZINC000649636333 1047155045 /nfs/dbraw/zinc/15/50/45/1047155045.db2.gz UJPAIJMXJXVRNR-HXUWFJFHSA-N 1 2 319.452 4.113 20 0 DIADLO O=C(C/C=C/c1ccc(F)cc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000081553287 1047156138 /nfs/dbraw/zinc/15/61/38/1047156138.db2.gz MHPWGYSSZCFWDJ-HNQUOIGGSA-N 1 2 321.355 4.053 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2nc(C3CCCC3)no2)CCC1 ZINC000649644731 1047157259 /nfs/dbraw/zinc/15/72/59/1047157259.db2.gz PWOQQZJPTNYWCJ-UHFFFAOYSA-N 1 2 311.429 4.205 20 0 DIADLO Clc1ccccc1C1([NH2+]Cc2noc3c2CCCC3)CCC1 ZINC000649643179 1047157317 /nfs/dbraw/zinc/15/73/17/1047157317.db2.gz ATBNRYXPMBCSNK-UHFFFAOYSA-N 1 2 316.832 4.376 20 0 DIADLO Brc1ccccc1C1([NH2+]Cc2nccs2)CCC1 ZINC000649647012 1047157645 /nfs/dbraw/zinc/15/76/45/1047157645.db2.gz YZRIFAZKLMARKG-UHFFFAOYSA-N 1 2 323.259 4.075 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC001141525880 1047163177 /nfs/dbraw/zinc/16/31/77/1047163177.db2.gz QSLUXTKFZMPYQD-IXDOHACOSA-N 1 2 323.440 4.417 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccc(Cl)cn1 ZINC001116650816 1047164625 /nfs/dbraw/zinc/16/46/25/1047164625.db2.gz GVIUEXLJEJFCSF-GFCCVEGCSA-N 1 2 301.821 4.291 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccc(Cl)cn1 ZINC001116650816 1047164632 /nfs/dbraw/zinc/16/46/32/1047164632.db2.gz GVIUEXLJEJFCSF-GFCCVEGCSA-N 1 2 301.821 4.291 20 0 DIADLO CC1(c2ccccc2)CC([NH2+]c2ccc(N3CCOCC3)cc2)C1 ZINC000838862537 1047165685 /nfs/dbraw/zinc/16/56/85/1047165685.db2.gz JYPSHADBZMCBOQ-UHFFFAOYSA-N 1 2 322.452 4.055 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ncc(-c3ccccc3C)o2)[C@H](CC)CO1 ZINC000649721577 1047166824 /nfs/dbraw/zinc/16/68/24/1047166824.db2.gz ZXIVFEGFXSNDHH-HZPDHXFCSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ncc(-c3ccccc3C)o2)[C@H](CC)CO1 ZINC000649721577 1047166832 /nfs/dbraw/zinc/16/68/32/1047166832.db2.gz ZXIVFEGFXSNDHH-HZPDHXFCSA-N 1 2 314.429 4.039 20 0 DIADLO C[C@H]1CN(c2ccc([NH2+]C[C@@H]3C[C@H]3c3ccccc3)cc2)CCO1 ZINC000838879150 1047168662 /nfs/dbraw/zinc/16/86/62/1047168662.db2.gz FCCIRAWRHSKPDD-MDKPJZGXSA-N 1 2 322.452 4.127 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+]2CCc3ccc(-c4ccccc4)cc3C2)n1 ZINC000649725710 1047168795 /nfs/dbraw/zinc/16/87/95/1047168795.db2.gz IVQSYGDZJBDDPS-CQSZACIVSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1noc([C@@H](C)[N@H+]2CCc3ccc(-c4ccccc4)cc3C2)n1 ZINC000649725710 1047168797 /nfs/dbraw/zinc/16/87/97/1047168797.db2.gz IVQSYGDZJBDDPS-CQSZACIVSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2ccc(C)nc2Cl)sc1C ZINC000838898562 1047171751 /nfs/dbraw/zinc/17/17/51/1047171751.db2.gz AXUHTRFPTLQSMP-UHFFFAOYSA-N 1 2 309.866 4.142 20 0 DIADLO Clc1nc(C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)cs1 ZINC000827798095 1047172246 /nfs/dbraw/zinc/17/22/46/1047172246.db2.gz JYIVGMHFCUBCBQ-NSHDSACASA-N 1 2 313.253 4.439 20 0 DIADLO Clc1nc(C[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)cs1 ZINC000827798095 1047172260 /nfs/dbraw/zinc/17/22/60/1047172260.db2.gz JYIVGMHFCUBCBQ-NSHDSACASA-N 1 2 313.253 4.439 20 0 DIADLO CCc1cnc(CSCc2ccc(-n3cc[nH+]c3)cc2C)o1 ZINC001116745408 1047173530 /nfs/dbraw/zinc/17/35/30/1047173530.db2.gz MYKWJHUENYJYNF-UHFFFAOYSA-N 1 2 313.426 4.165 20 0 DIADLO Cc1cc(NCc2ccccc2-n2ccnc2)[nH+]c2ccccc12 ZINC001116736016 1047173771 /nfs/dbraw/zinc/17/37/71/1047173771.db2.gz KHIRAKODZYPGDR-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)c(Cl)n1 ZINC000838924306 1047175689 /nfs/dbraw/zinc/17/56/89/1047175689.db2.gz CZHDPLPSGWKFQG-JQWIXIFHSA-N 1 2 306.759 4.206 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)c(Cl)n1 ZINC000838924306 1047175697 /nfs/dbraw/zinc/17/56/97/1047175697.db2.gz CZHDPLPSGWKFQG-JQWIXIFHSA-N 1 2 306.759 4.206 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H]2CCOc3c(F)cccc32)c(C)s1 ZINC000682144565 1047177174 /nfs/dbraw/zinc/17/71/74/1047177174.db2.gz RVUAVOQLNLPJNI-YMTOWFKASA-N 1 2 306.406 4.073 20 0 DIADLO CCCC[N@H+](Cc1c(Cl)cnn1C)[C@@H](C)c1ccc(C)o1 ZINC000682150656 1047178087 /nfs/dbraw/zinc/17/80/87/1047178087.db2.gz CXJNMUJLYNOYBR-ZDUSSCGKSA-N 1 2 309.841 4.338 20 0 DIADLO CCCC[N@@H+](Cc1c(Cl)cnn1C)[C@@H](C)c1ccc(C)o1 ZINC000682150656 1047178092 /nfs/dbraw/zinc/17/80/92/1047178092.db2.gz CXJNMUJLYNOYBR-ZDUSSCGKSA-N 1 2 309.841 4.338 20 0 DIADLO CCc1nnc([C@H](C)[N@H+](C)Cc2oc3c(cccc3C)c2C)o1 ZINC000649819015 1047179860 /nfs/dbraw/zinc/17/98/60/1047179860.db2.gz ITUKSPGELQHPKR-ZDUSSCGKSA-N 1 2 313.401 4.188 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+](C)Cc2oc3c(cccc3C)c2C)o1 ZINC000649819015 1047179867 /nfs/dbraw/zinc/17/98/67/1047179867.db2.gz ITUKSPGELQHPKR-ZDUSSCGKSA-N 1 2 313.401 4.188 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)o1 ZINC000649875205 1047185040 /nfs/dbraw/zinc/18/50/40/1047185040.db2.gz IXPGMYIBEFQGOK-MRXNPFEDSA-N 1 2 308.784 4.270 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2ncc(-c3ccccc3)o2)nc1 ZINC000649900771 1047187312 /nfs/dbraw/zinc/18/73/12/1047187312.db2.gz WDYQVBQZNACHNP-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2ncc(-c3ccccc3)o2)nc1 ZINC000649900771 1047187317 /nfs/dbraw/zinc/18/73/17/1047187317.db2.gz WDYQVBQZNACHNP-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1csc(Cl)c1 ZINC000682497391 1047200511 /nfs/dbraw/zinc/20/05/11/1047200511.db2.gz BGZJEPNCRDYUCS-RDDDGLTNSA-N 1 2 315.772 4.464 20 0 DIADLO C[C@H](CC(=O)Nc1cc(Cl)ccc1C(C)(C)C)n1cc[nH+]c1 ZINC000650003474 1047201540 /nfs/dbraw/zinc/20/15/40/1047201540.db2.gz CYQSFHBTMVDMPG-GFCCVEGCSA-N 1 2 319.836 4.424 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(Br)cc(Cl)c2F)C1 ZINC001141596544 1047211713 /nfs/dbraw/zinc/21/17/13/1047211713.db2.gz NVHLYGCBJLHSPU-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(Br)cc(Cl)c2F)C1 ZINC001141596544 1047211724 /nfs/dbraw/zinc/21/17/24/1047211724.db2.gz NVHLYGCBJLHSPU-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO CC(C)COc1ccc(C[N@H+](C)Cc2cnc(Cl)s2)cc1 ZINC001138970062 1047226048 /nfs/dbraw/zinc/22/60/48/1047226048.db2.gz WCIRDUFQLRUOKI-UHFFFAOYSA-N 1 2 324.877 4.463 20 0 DIADLO CC(C)COc1ccc(C[N@@H+](C)Cc2cnc(Cl)s2)cc1 ZINC001138970062 1047226055 /nfs/dbraw/zinc/22/60/55/1047226055.db2.gz WCIRDUFQLRUOKI-UHFFFAOYSA-N 1 2 324.877 4.463 20 0 DIADLO COCc1cc[nH+]c(NCc2ccc(C(F)(F)F)cc2C)c1 ZINC000650243948 1047226347 /nfs/dbraw/zinc/22/63/47/1047226347.db2.gz WHQXBIAAQZTVBK-UHFFFAOYSA-N 1 2 310.319 4.167 20 0 DIADLO C[S@@](=O)c1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)cc1 ZINC001117646318 1047233238 /nfs/dbraw/zinc/23/32/38/1047233238.db2.gz XRYDULPCHJGETH-HRAATJIYSA-N 1 2 319.495 4.069 20 0 DIADLO C[S@@](=O)c1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)cc1 ZINC001117646318 1047233247 /nfs/dbraw/zinc/23/32/47/1047233247.db2.gz XRYDULPCHJGETH-HRAATJIYSA-N 1 2 319.495 4.069 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(-c2ccco2)on1)c1ccccc1OC ZINC000839538926 1047245963 /nfs/dbraw/zinc/24/59/63/1047245963.db2.gz OQZULNBECHHEMZ-OAHLLOKOSA-N 1 2 312.369 4.184 20 0 DIADLO CCCCCCO[C@@H](C)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000839612641 1047251071 /nfs/dbraw/zinc/25/10/71/1047251071.db2.gz BKELEDBKCAVTOU-AWEZNQCLSA-N 1 2 315.417 4.001 20 0 DIADLO Cc1ccnc(C[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)c1 ZINC000683021880 1047254625 /nfs/dbraw/zinc/25/46/25/1047254625.db2.gz MOUGWOFVQGQCPK-CQSZACIVSA-N 1 2 309.438 4.364 20 0 DIADLO CCn1ccc(C[N@H+](C)Cc2nc(-c3ccsc3)oc2C)c1 ZINC000683031460 1047261181 /nfs/dbraw/zinc/26/11/81/1047261181.db2.gz WUTIBDNXOCZWMS-UHFFFAOYSA-N 1 2 315.442 4.165 20 0 DIADLO CCn1ccc(C[N@@H+](C)Cc2nc(-c3ccsc3)oc2C)c1 ZINC000683031460 1047261195 /nfs/dbraw/zinc/26/11/95/1047261195.db2.gz WUTIBDNXOCZWMS-UHFFFAOYSA-N 1 2 315.442 4.165 20 0 DIADLO CCCC[C@H](CCC)NC(=O)[C@H]1CCc2[nH+]c(C(C)C)[nH]c2C1 ZINC000476250945 1047264783 /nfs/dbraw/zinc/26/47/83/1047264783.db2.gz STMADXRKROQMRL-GJZGRUSLSA-N 1 2 319.493 4.113 20 0 DIADLO CCCC[C@H](CCC)NC(=O)[C@H]1CCc2[nH]c(C(C)C)[nH+]c2C1 ZINC000476250945 1047264804 /nfs/dbraw/zinc/26/48/04/1047264804.db2.gz STMADXRKROQMRL-GJZGRUSLSA-N 1 2 319.493 4.113 20 0 DIADLO CC(C)C[N@H+](Cc1ccccn1)Cc1ccnc(Cl)c1Cl ZINC001462602526 1047288577 /nfs/dbraw/zinc/28/85/77/1047288577.db2.gz LDXMQMJHSZEOGW-UHFFFAOYSA-N 1 2 324.255 4.442 20 0 DIADLO CC(C)C[N@@H+](Cc1ccccn1)Cc1ccnc(Cl)c1Cl ZINC001462602526 1047288595 /nfs/dbraw/zinc/28/85/95/1047288595.db2.gz LDXMQMJHSZEOGW-UHFFFAOYSA-N 1 2 324.255 4.442 20 0 DIADLO Fc1cc(Cl)cc(Br)c1C[NH+]1C2CCC1CC2 ZINC001141842431 1047298348 /nfs/dbraw/zinc/29/83/48/1047298348.db2.gz SSFAFESOQFDOQZ-UHFFFAOYSA-N 1 2 318.617 4.368 20 0 DIADLO COc1ccc2cc(NCc3cccc4[nH+]ccn43)ccc2c1 ZINC000796459047 1047298592 /nfs/dbraw/zinc/29/85/92/1047298592.db2.gz PWUGKYVXPSXOMS-UHFFFAOYSA-N 1 2 303.365 4.108 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]C/C=C\c2ccc(F)c(F)c2)n1 ZINC000897943888 1047304706 /nfs/dbraw/zinc/30/47/06/1047304706.db2.gz AJTJQFHSYPBTRV-PLNGDYQASA-N 1 2 306.356 4.053 20 0 DIADLO FC(F)(F)c1nc(C[N@@H+]2CCC3(C2)CCCCC3)cs1 ZINC001141887636 1047305106 /nfs/dbraw/zinc/30/51/06/1047305106.db2.gz NXBDMIADGQLSLU-UHFFFAOYSA-N 1 2 304.381 4.318 20 0 DIADLO FC(F)(F)c1nc(C[N@H+]2CCC3(C2)CCCCC3)cs1 ZINC001141887636 1047305110 /nfs/dbraw/zinc/30/51/10/1047305110.db2.gz NXBDMIADGQLSLU-UHFFFAOYSA-N 1 2 304.381 4.318 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(F)c(Br)cc2Cl)C1 ZINC001141919666 1047310593 /nfs/dbraw/zinc/31/05/93/1047310593.db2.gz AYGVGFCFSKIMKL-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(F)c(Br)cc2Cl)C1 ZINC001141919666 1047310607 /nfs/dbraw/zinc/31/06/07/1047310607.db2.gz AYGVGFCFSKIMKL-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001118944811 1047319209 /nfs/dbraw/zinc/31/92/09/1047319209.db2.gz UARUOXXQFVDWRN-TZMCWYRMSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001118944811 1047319224 /nfs/dbraw/zinc/31/92/24/1047319224.db2.gz UARUOXXQFVDWRN-TZMCWYRMSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2ncc(C(F)(F)F)cc2Cl)C1 ZINC001142539353 1047322418 /nfs/dbraw/zinc/32/24/18/1047322418.db2.gz ZFBVBEFRFULCFX-CYBMUJFWSA-N 1 2 324.749 4.468 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2ncc(C(F)(F)F)cc2Cl)C1 ZINC001142539353 1047322432 /nfs/dbraw/zinc/32/24/32/1047322432.db2.gz ZFBVBEFRFULCFX-CYBMUJFWSA-N 1 2 324.749 4.468 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)s1 ZINC000898180199 1047325200 /nfs/dbraw/zinc/32/52/00/1047325200.db2.gz VHVVDGDNMSLGJK-ZDUSSCGKSA-N 1 2 318.490 4.114 20 0 DIADLO CCc1cccc(C[NH2+][C@H](c2ccn(C)n2)c2ccc(F)cc2)c1 ZINC000651748341 1047327470 /nfs/dbraw/zinc/32/74/70/1047327470.db2.gz HQZGPGAIYIANJF-FQEVSTJZSA-N 1 2 323.415 4.001 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(C(C)(C)C)n1)c1ccc([N+](=O)[O-])cc1 ZINC000153417171 1047327764 /nfs/dbraw/zinc/32/77/64/1047327764.db2.gz HPPFBFOUPXZWHC-LLVKDONJSA-N 1 2 319.430 4.200 20 0 DIADLO CC(C)Cn1ccnc1C[NH2+][C@@H]1CCc2ccc(F)c(Cl)c21 ZINC000651751696 1047328150 /nfs/dbraw/zinc/32/81/50/1047328150.db2.gz DOSKVWZNFWAOMP-CQSZACIVSA-N 1 2 321.827 4.109 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1c(C)onc1-c1ccccc1)C2 ZINC001141990835 1047333274 /nfs/dbraw/zinc/33/32/74/1047333274.db2.gz TWISDELXNAMJDN-UHFFFAOYSA-N 1 2 320.392 4.174 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1c(C)onc1-c1ccccc1)C2 ZINC001141990835 1047333286 /nfs/dbraw/zinc/33/32/86/1047333286.db2.gz TWISDELXNAMJDN-UHFFFAOYSA-N 1 2 320.392 4.174 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccccc2SC(F)(F)F)cs1 ZINC000898281882 1047336016 /nfs/dbraw/zinc/33/60/16/1047336016.db2.gz RZFHARLFPDONHH-UHFFFAOYSA-N 1 2 318.389 4.353 20 0 DIADLO COCc1cc[nH+]c(NC2CC(c3ccc(Cl)cc3)C2)c1 ZINC000652067944 1047341309 /nfs/dbraw/zinc/34/13/09/1047341309.db2.gz MIIXQUOXTKCIEY-UHFFFAOYSA-N 1 2 302.805 4.240 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CCc3ccc(F)c(Cl)c32)c1 ZINC000652067714 1047342095 /nfs/dbraw/zinc/34/20/95/1047342095.db2.gz DKYVVZOCHKYWMW-ZDUSSCGKSA-N 1 2 306.768 4.120 20 0 DIADLO Clc1cnc(C[N@@H+]2CC[C@H]2Cc2ccccc2)c(Cl)c1 ZINC000537516666 1047351700 /nfs/dbraw/zinc/35/17/00/1047351700.db2.gz CWEYVFVFTSSJNK-AWEZNQCLSA-N 1 2 307.224 4.205 20 0 DIADLO Clc1cnc(C[N@H+]2CC[C@H]2Cc2ccccc2)c(Cl)c1 ZINC000537516666 1047351710 /nfs/dbraw/zinc/35/17/10/1047351710.db2.gz CWEYVFVFTSSJNK-AWEZNQCLSA-N 1 2 307.224 4.205 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](c2ccc(Cl)cc2)C2CC2)c1 ZINC000652330417 1047355442 /nfs/dbraw/zinc/35/54/42/1047355442.db2.gz FOSRXQLSIVWQMP-QGZVFWFLSA-N 1 2 302.805 4.445 20 0 DIADLO COCc1cc[nH+]c(N[C@H](c2ccc(F)c(F)c2)C(C)C)c1 ZINC000652330495 1047356726 /nfs/dbraw/zinc/35/67/26/1047356726.db2.gz HYKNGXVDACEHEX-KRWDZBQOSA-N 1 2 306.356 4.315 20 0 DIADLO COc1cccc(-c2nc(C[NH+]3CCC(F)(F)CC3)cs2)c1 ZINC000796542705 1047383111 /nfs/dbraw/zinc/38/31/11/1047383111.db2.gz IWKURZXYMUORCW-UHFFFAOYSA-N 1 2 324.396 4.050 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c(Cl)n1 ZINC001142136585 1047387607 /nfs/dbraw/zinc/38/76/07/1047387607.db2.gz MCJKKXWFOGSJIN-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@@H]2c2ccccc2)c(Cl)n1 ZINC001142136585 1047387619 /nfs/dbraw/zinc/38/76/19/1047387619.db2.gz MCJKKXWFOGSJIN-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO CC(C)(C)c1nc[nH]c1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001142227039 1047406365 /nfs/dbraw/zinc/40/63/65/1047406365.db2.gz YWFGZBNGNVYKFR-MRXNPFEDSA-N 1 2 319.399 4.323 20 0 DIADLO CC(C)(C)c1nc[nH]c1C[N@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001142227039 1047406370 /nfs/dbraw/zinc/40/63/70/1047406370.db2.gz YWFGZBNGNVYKFR-MRXNPFEDSA-N 1 2 319.399 4.323 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@H+](C[C@@H]1CC1(Cl)Cl)CC3 ZINC000749276062 1047406444 /nfs/dbraw/zinc/40/64/44/1047406444.db2.gz CJVILWHMLZEVIK-NSHDSACASA-N 1 2 309.240 4.028 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](C[C@@H]1CC1(Cl)Cl)CC3 ZINC000749276062 1047406454 /nfs/dbraw/zinc/40/64/54/1047406454.db2.gz CJVILWHMLZEVIK-NSHDSACASA-N 1 2 309.240 4.028 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@@H+](Cc1cccc(Cl)n1)C2 ZINC000749462624 1047420801 /nfs/dbraw/zinc/42/08/01/1047420801.db2.gz FFTIFWBGRCWMEK-UHFFFAOYSA-N 1 2 316.832 4.082 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@H+](Cc1cccc(Cl)n1)C2 ZINC000749462624 1047420805 /nfs/dbraw/zinc/42/08/05/1047420805.db2.gz FFTIFWBGRCWMEK-UHFFFAOYSA-N 1 2 316.832 4.082 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)/C=C\c3cccs3)c2)[nH+]c1C ZINC000749583448 1047427286 /nfs/dbraw/zinc/42/72/86/1047427286.db2.gz QMHYXVOTHZUGBU-HJWRWDBZSA-N 1 2 323.421 4.407 20 0 DIADLO F[C@@H]1CCC[N@@H+]([C@@H]2CCC[C@H](C(F)(F)F)C2)CC1(F)F ZINC001255706048 1047429020 /nfs/dbraw/zinc/42/90/20/1047429020.db2.gz OLURRWWABCNWHP-HBNTYKKESA-N 1 2 303.290 4.177 20 0 DIADLO F[C@@H]1CCC[N@H+]([C@@H]2CCC[C@H](C(F)(F)F)C2)CC1(F)F ZINC001255706048 1047429026 /nfs/dbraw/zinc/42/90/26/1047429026.db2.gz OLURRWWABCNWHP-HBNTYKKESA-N 1 2 303.290 4.177 20 0 DIADLO COc1cccc([C@H](C)[NH2+][C@@H](Cc2ccccc2)c2ncco2)c1 ZINC000653911597 1047431762 /nfs/dbraw/zinc/43/17/62/1047431762.db2.gz HJCYRWJGHLSVEQ-KXBFYZLASA-N 1 2 322.408 4.318 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCc3ncc(Cl)cc3C2)cc1 ZINC001142367632 1047435395 /nfs/dbraw/zinc/43/53/95/1047435395.db2.gz SWKGHOUOPPYRFS-UHFFFAOYSA-N 1 2 300.833 4.246 20 0 DIADLO CCCc1ccc(C[N@H+]2CCc3ncc(Cl)cc3C2)cc1 ZINC001142367632 1047435403 /nfs/dbraw/zinc/43/54/03/1047435403.db2.gz SWKGHOUOPPYRFS-UHFFFAOYSA-N 1 2 300.833 4.246 20 0 DIADLO C/C(=C/C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1C ZINC001142588830 1047471072 /nfs/dbraw/zinc/47/10/72/1047471072.db2.gz HSTCBATWZQZZIF-SQFISAMPSA-N 1 2 317.392 4.427 20 0 DIADLO Cc1ccsc1[C@@H](CO)Nc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC000119936220 1047475736 /nfs/dbraw/zinc/47/57/36/1047475736.db2.gz OHMYBVRREGOSRQ-CQSZACIVSA-N 1 2 319.474 4.239 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2Cl)C[N@@H+]1Cc1ccsc1 ZINC000537627484 1047486188 /nfs/dbraw/zinc/48/61/88/1047486188.db2.gz UUEXEQGMVWFUKT-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2Cl)C[N@H+]1Cc1ccsc1 ZINC000537627484 1047486192 /nfs/dbraw/zinc/48/61/92/1047486192.db2.gz UUEXEQGMVWFUKT-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1cccc([C@@H](C)C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC000120375588 1047488721 /nfs/dbraw/zinc/48/87/21/1047488721.db2.gz LYIRVXSSVRNUBY-CQSZACIVSA-N 1 2 305.381 4.127 20 0 DIADLO CCOC(=O)C1([NH2+]C2CCC(c3ccc(Cl)cc3)CC2)CC1 ZINC001168336975 1047491365 /nfs/dbraw/zinc/49/13/65/1047491365.db2.gz JPZYBKQLXPAAEL-UHFFFAOYSA-N 1 2 321.848 4.052 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)o1 ZINC000120620049 1047495238 /nfs/dbraw/zinc/49/52/38/1047495238.db2.gz GOWKFFJUVGPZDA-UHFFFAOYSA-N 1 2 314.429 4.090 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+](Cc2cccc(O)c2)CC2CC2)o1 ZINC000120620049 1047495241 /nfs/dbraw/zinc/49/52/41/1047495241.db2.gz GOWKFFJUVGPZDA-UHFFFAOYSA-N 1 2 314.429 4.090 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+][C@H](CN1CCCC1)c1ccccc1 ZINC000120826930 1047503409 /nfs/dbraw/zinc/50/34/09/1047503409.db2.gz BNYBLUMJZFAAKW-YLJYHZDGSA-N 1 2 324.468 4.183 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2nc(C3CC3)cs2)c(F)c1 ZINC000090460500 1047504255 /nfs/dbraw/zinc/50/42/55/1047504255.db2.gz GANDSERIQNOAPC-SNVBAGLBSA-N 1 2 306.406 4.019 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2Cl)c(OC)c1 ZINC000121333714 1047518389 /nfs/dbraw/zinc/51/83/89/1047518389.db2.gz RDYNXQFBJSESMC-LLVKDONJSA-N 1 2 323.795 4.347 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@@H](c2ccccc2)C(C)C)n1 ZINC000121318424 1047518618 /nfs/dbraw/zinc/51/86/18/1047518618.db2.gz JJCICMNAFVJNEG-GOSISDBHSA-N 1 2 301.434 4.145 20 0 DIADLO CC[C@H](NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1)c1ccc(C)cc1 ZINC001143084293 1047530145 /nfs/dbraw/zinc/53/01/45/1047530145.db2.gz TZPKPYZGXQWGDN-ZWKOTPCHSA-N 1 2 313.445 4.046 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)cc1Cl)Cc1ccc(C)nc1N ZINC001143207394 1047540812 /nfs/dbraw/zinc/54/08/12/1047540812.db2.gz WFKFLFGIFOPLBH-UHFFFAOYSA-N 1 2 324.255 4.301 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1Cl)Cc1ccc(C)nc1N ZINC001143207394 1047540813 /nfs/dbraw/zinc/54/08/13/1047540813.db2.gz WFKFLFGIFOPLBH-UHFFFAOYSA-N 1 2 324.255 4.301 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1cc(C(F)(F)F)ccc1F ZINC000093338854 1047545603 /nfs/dbraw/zinc/54/56/03/1047545603.db2.gz IUJXXYGYQVEQAV-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1cc(C(F)(F)F)ccc1F ZINC000093338854 1047545605 /nfs/dbraw/zinc/54/56/05/1047545605.db2.gz IUJXXYGYQVEQAV-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CCOc1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)c(F)c1F ZINC001143278366 1047547259 /nfs/dbraw/zinc/54/72/59/1047547259.db2.gz GFDVWUGUPMQXHL-HNNXBMFYSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1ccc(C[N@H+]2CC[C@H]2c2ccccc2)c(F)c1F ZINC001143278366 1047547261 /nfs/dbraw/zinc/54/72/61/1047547261.db2.gz GFDVWUGUPMQXHL-HNNXBMFYSA-N 1 2 303.352 4.311 20 0 DIADLO C[N@H+](Cc1ccccn1)Cc1c(Cl)cccc1C(F)(F)F ZINC001143283073 1047548519 /nfs/dbraw/zinc/54/85/19/1047548519.db2.gz LHWOSVPSSHPHBQ-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccccn1)Cc1c(Cl)cccc1C(F)(F)F ZINC001143283073 1047548521 /nfs/dbraw/zinc/54/85/21/1047548521.db2.gz LHWOSVPSSHPHBQ-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO COc1c(F)ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c1F ZINC001143317968 1047552970 /nfs/dbraw/zinc/55/29/70/1047552970.db2.gz FSTRHZOJGRVGSF-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(C[N@H+]2CCC[C@@H]2c2ccccc2F)c1F ZINC001143317968 1047552974 /nfs/dbraw/zinc/55/29/74/1047552974.db2.gz FSTRHZOJGRVGSF-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(C[N@@H+]2CCCC[C@H]2c2cccnc2)c1F ZINC001143317809 1047553273 /nfs/dbraw/zinc/55/32/73/1047553273.db2.gz CUKRJVFMBVEDHP-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1c(F)ccc(C[N@H+]2CCCC[C@H]2c2cccnc2)c1F ZINC001143317809 1047553275 /nfs/dbraw/zinc/55/32/75/1047553275.db2.gz CUKRJVFMBVEDHP-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO Fc1ccc(Br)c(C[N@H+](CC2CC2)C2CC2)c1F ZINC001143339267 1047553935 /nfs/dbraw/zinc/55/39/35/1047553935.db2.gz ZZRLRFSWLYISKX-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1ccc(Br)c(C[N@@H+](CC2CC2)C2CC2)c1F ZINC001143339267 1047553937 /nfs/dbraw/zinc/55/39/37/1047553937.db2.gz ZZRLRFSWLYISKX-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2cc(C)ccc2OC(F)F)s1 ZINC000122892813 1047558809 /nfs/dbraw/zinc/55/88/09/1047558809.db2.gz OLEXEGLSNVGJGX-NSHDSACASA-N 1 2 312.385 4.212 20 0 DIADLO COc1ccc(OC)c(C[NH2+][C@@H](c2ccco2)c2ccccc2)c1 ZINC000061556114 1047572812 /nfs/dbraw/zinc/57/28/12/1047572812.db2.gz XGTOPGCCOPPDQS-HXUWFJFHSA-N 1 2 323.392 4.176 20 0 DIADLO C[C@@H](Nc1ccc(Cl)c(N(C)C)c1)c1cn2c([nH+]1)CCCC2 ZINC000926902026 1047575681 /nfs/dbraw/zinc/57/56/81/1047575681.db2.gz ZGHBUTZWSHSIQM-GFCCVEGCSA-N 1 2 318.852 4.112 20 0 DIADLO CC(C)(C)O[C@H]1C[C@@H](Nc2c[nH+]cc3c2CCCC3)C1(C)C ZINC001206636604 1047588208 /nfs/dbraw/zinc/58/82/08/1047588208.db2.gz PWQGMROATHDZNV-SJORKVTESA-N 1 2 302.462 4.355 20 0 DIADLO Fc1cccc(C[N@H+](Cc2ccn(C3CCCC3)n2)C2CC2)c1 ZINC000477153415 1047598934 /nfs/dbraw/zinc/59/89/34/1047598934.db2.gz RFVCODWSMDFUOC-UHFFFAOYSA-N 1 2 313.420 4.302 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2ccn(C3CCCC3)n2)C2CC2)c1 ZINC000477153415 1047598946 /nfs/dbraw/zinc/59/89/46/1047598946.db2.gz RFVCODWSMDFUOC-UHFFFAOYSA-N 1 2 313.420 4.302 20 0 DIADLO CC(C)C[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1ccccc1 ZINC001151976321 1047605207 /nfs/dbraw/zinc/60/52/07/1047605207.db2.gz KXHDYZNNDDSNJZ-KRWDZBQOSA-N 1 2 307.397 4.080 20 0 DIADLO Cc1ccc(Nc2ccc3cnn([C@H]4CCCCO4)c3c2)c(C)[nH+]1 ZINC001203375426 1047605986 /nfs/dbraw/zinc/60/59/86/1047605986.db2.gz ZKWLPQCDAMHHFE-LJQANCHMSA-N 1 2 322.412 4.491 20 0 DIADLO Cc1ccc(Nc2c(N)ccc(Br)c2C)c(C)[nH+]1 ZINC001203375297 1047606283 /nfs/dbraw/zinc/60/62/83/1047606283.db2.gz VKLSIJFPLNTLAS-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO Cc1ccc(Oc2cccc(NC(=O)Cc3c[nH]c[nH+]3)c2)c(C)c1 ZINC001152173960 1047607654 /nfs/dbraw/zinc/60/76/54/1047607654.db2.gz FDVUIGPNRKZIOS-UHFFFAOYSA-N 1 2 321.380 4.000 20 0 DIADLO FC(F)(F)CC[N@@H+](Cc1ccn(C2CCCC2)n1)CC1CC1 ZINC000477272535 1047608973 /nfs/dbraw/zinc/60/89/73/1047608973.db2.gz RHIMQRGLKVWDPM-UHFFFAOYSA-N 1 2 315.383 4.163 20 0 DIADLO FC(F)(F)CC[N@H+](Cc1ccn(C2CCCC2)n1)CC1CC1 ZINC000477272535 1047608976 /nfs/dbraw/zinc/60/89/76/1047608976.db2.gz RHIMQRGLKVWDPM-UHFFFAOYSA-N 1 2 315.383 4.163 20 0 DIADLO Cc1ccc(Nc2ccc(OC3CCOCC3)c(F)c2)c(C)[nH+]1 ZINC001203375811 1047609876 /nfs/dbraw/zinc/60/98/76/1047609876.db2.gz CCTXCAFXCQDJID-UHFFFAOYSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1ccc(Nc2ccc(C(=O)c3ccncc3)cc2)c(C)[nH+]1 ZINC001203375873 1047610147 /nfs/dbraw/zinc/61/01/47/1047610147.db2.gz DHSPNWMIAXNFEO-UHFFFAOYSA-N 1 2 303.365 4.068 20 0 DIADLO CC[N@H+](Cc1ccn(C2CCCC2)n1)[C@H](C)c1cccc(O)c1 ZINC000477287049 1047610588 /nfs/dbraw/zinc/61/05/88/1047610588.db2.gz WSNCVPRHPCDGHY-OAHLLOKOSA-N 1 2 313.445 4.287 20 0 DIADLO CC[N@@H+](Cc1ccn(C2CCCC2)n1)[C@H](C)c1cccc(O)c1 ZINC000477287049 1047610595 /nfs/dbraw/zinc/61/05/95/1047610595.db2.gz WSNCVPRHPCDGHY-OAHLLOKOSA-N 1 2 313.445 4.287 20 0 DIADLO Cc1ccc(Nc2cccc([C@@H]3CN4C=CSC4=N3)c2)c(C)[nH+]1 ZINC001203376034 1047611032 /nfs/dbraw/zinc/61/10/32/1047611032.db2.gz HFNSEKVZIZBNPY-KRWDZBQOSA-N 1 2 322.437 4.373 20 0 DIADLO O=C(N[C@H](CC1CCC1)c1ccccc1)c1cc2c[nH+]ccc2[nH]1 ZINC001152852250 1047616159 /nfs/dbraw/zinc/61/61/59/1047616159.db2.gz HXWYADLWAWFOTK-GOSISDBHSA-N 1 2 319.408 4.224 20 0 DIADLO C/C(=C\c1ccco1)C(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1 ZINC001153554381 1047627816 /nfs/dbraw/zinc/62/78/16/1047627816.db2.gz CXHSUAPZUYXUHL-VAWYXSNFSA-N 1 2 321.380 4.329 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1scc2c1CCCC2 ZINC001153618452 1047628485 /nfs/dbraw/zinc/62/84/85/1047628485.db2.gz XTAZKVNYWPTPGM-UHFFFAOYSA-N 1 2 323.421 4.065 20 0 DIADLO CC[N@H+](Cc1ccccc1)[C@@H](C)c1noc(-c2ccccc2)n1 ZINC000477671023 1047629502 /nfs/dbraw/zinc/62/95/02/1047629502.db2.gz SMRDAFIFWNDENI-HNNXBMFYSA-N 1 2 307.397 4.320 20 0 DIADLO CC[N@@H+](Cc1ccccc1)[C@@H](C)c1noc(-c2ccccc2)n1 ZINC000477671023 1047629507 /nfs/dbraw/zinc/62/95/07/1047629507.db2.gz SMRDAFIFWNDENI-HNNXBMFYSA-N 1 2 307.397 4.320 20 0 DIADLO Brc1ccc(CNc2cc3ccccc3c[nH+]2)cn1 ZINC001154686070 1047654963 /nfs/dbraw/zinc/65/49/63/1047654963.db2.gz NTQUIDDZTJFSOL-UHFFFAOYSA-N 1 2 314.186 4.004 20 0 DIADLO CC(C)(C)OC(=O)[C@@H](Nc1cc2[nH]ccc2c[nH+]1)c1ccccc1 ZINC001154721438 1047655590 /nfs/dbraw/zinc/65/55/90/1047655590.db2.gz MVSMDTVCPAJYFS-KRWDZBQOSA-N 1 2 323.396 4.058 20 0 DIADLO Cc1cccc2ncc(CNc3cc(-c4ccccc4)cc[nH+]3)n21 ZINC001154943641 1047662394 /nfs/dbraw/zinc/66/23/94/1047662394.db2.gz LFYGYHLBWIFELF-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO Cc1cc(Br)cc2c1C[N@H+](CCC(F)(F)F)CC2 ZINC000538227522 1047663630 /nfs/dbraw/zinc/66/36/30/1047663630.db2.gz ZEGNVZPEEMMTBU-UHFFFAOYSA-N 1 2 322.168 4.068 20 0 DIADLO Cc1cc(Br)cc2c1C[N@@H+](CCC(F)(F)F)CC2 ZINC000538227522 1047663634 /nfs/dbraw/zinc/66/36/34/1047663634.db2.gz ZEGNVZPEEMMTBU-UHFFFAOYSA-N 1 2 322.168 4.068 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)/C(F)=C/C2CCCCC2)[nH+]c1C ZINC001155183207 1047670720 /nfs/dbraw/zinc/67/07/20/1047670720.db2.gz CHMVHRQBSPAGAZ-UVQBRAAOSA-N 1 2 319.424 4.124 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)/C(F)=C/C2CCCCC2)[nH+]c1C ZINC001155183204 1047671001 /nfs/dbraw/zinc/67/10/01/1047671001.db2.gz CHMVHRQBSPAGAZ-QZFKAFNDSA-N 1 2 319.424 4.124 20 0 DIADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1cccc(Nc2cccc(C)c2)c1C ZINC001155398554 1047678361 /nfs/dbraw/zinc/67/83/61/1047678361.db2.gz FQOQQPBRQWKLJY-IBGZPJMESA-N 1 2 323.440 4.080 20 0 DIADLO CC[N@H+]1CC[C@H]1C(=O)Nc1cccc(Nc2cccc(C)c2)c1C ZINC001155398554 1047678364 /nfs/dbraw/zinc/67/83/64/1047678364.db2.gz FQOQQPBRQWKLJY-IBGZPJMESA-N 1 2 323.440 4.080 20 0 DIADLO CCOC(CCCNc1cc(-c2ccccc2)cc[nH+]1)OCC ZINC001155721959 1047687587 /nfs/dbraw/zinc/68/75/87/1047687587.db2.gz JVYNYZQJFRXNAP-UHFFFAOYSA-N 1 2 314.429 4.340 20 0 DIADLO CC[N@H+](CCC(=O)c1ccccc1)Cc1c(F)cccc1F ZINC000538618449 1047691110 /nfs/dbraw/zinc/69/11/10/1047691110.db2.gz ATOBJWAWPFRSIR-UHFFFAOYSA-N 1 2 303.352 4.060 20 0 DIADLO CC[N@@H+](CCC(=O)c1ccccc1)Cc1c(F)cccc1F ZINC000538618449 1047691114 /nfs/dbraw/zinc/69/11/14/1047691114.db2.gz ATOBJWAWPFRSIR-UHFFFAOYSA-N 1 2 303.352 4.060 20 0 DIADLO CC1(C)CC[N@@H+]1Cc1cccc(Br)c1OC(F)F ZINC000538613392 1047691148 /nfs/dbraw/zinc/69/11/48/1047691148.db2.gz QDIQXYOTTPFFAV-UHFFFAOYSA-N 1 2 320.177 4.035 20 0 DIADLO CC1(C)CC[N@H+]1Cc1cccc(Br)c1OC(F)F ZINC000538613392 1047691152 /nfs/dbraw/zinc/69/11/52/1047691152.db2.gz QDIQXYOTTPFFAV-UHFFFAOYSA-N 1 2 320.177 4.035 20 0 DIADLO Cc1ccc2cc[nH+]c(N(C)CCC(=O)c3cccs3)c2c1 ZINC001155955561 1047692664 /nfs/dbraw/zinc/69/26/64/1047692664.db2.gz VPDVXMIDRYJULP-UHFFFAOYSA-N 1 2 310.422 4.314 20 0 DIADLO C[C@H]1Cc2ccccc2[C@H]1Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000538635976 1047692839 /nfs/dbraw/zinc/69/28/39/1047692839.db2.gz VRHSXCUOEGJCBR-DJJJIMSYSA-N 1 2 307.372 4.357 20 0 DIADLO Cc1cc(C)c(NC(=O)N(CCC2CC2)CC2CC2)c(C)[nH+]1 ZINC000667119444 1047695719 /nfs/dbraw/zinc/69/57/19/1047695719.db2.gz UNNLLDPVBSMZPX-UHFFFAOYSA-N 1 2 301.434 4.051 20 0 DIADLO CCn1c2ccccc2c2cc(C[N@H+](C)Cc3ccon3)ccc21 ZINC000538720230 1047699339 /nfs/dbraw/zinc/69/93/39/1047699339.db2.gz OCRUROJAQCEMFX-UHFFFAOYSA-N 1 2 319.408 4.434 20 0 DIADLO CCn1c2ccccc2c2cc(C[N@@H+](C)Cc3ccon3)ccc21 ZINC000538720230 1047699343 /nfs/dbraw/zinc/69/93/43/1047699343.db2.gz OCRUROJAQCEMFX-UHFFFAOYSA-N 1 2 319.408 4.434 20 0 DIADLO c1ccc([C@H]2COCC[N@H+]2Cc2ccccc2OCC2CC2)cc1 ZINC000538752168 1047708691 /nfs/dbraw/zinc/70/86/91/1047708691.db2.gz MWLMJIBBCXDNQI-HXUWFJFHSA-N 1 2 323.436 4.049 20 0 DIADLO c1ccc([C@H]2COCC[N@@H+]2Cc2ccccc2OCC2CC2)cc1 ZINC000538752168 1047708698 /nfs/dbraw/zinc/70/86/98/1047708698.db2.gz MWLMJIBBCXDNQI-HXUWFJFHSA-N 1 2 323.436 4.049 20 0 DIADLO CC(=O)Nc1ccc(Nc2ccc(C)[nH+]c2C)c(C(F)(F)F)c1 ZINC001203376866 1047709036 /nfs/dbraw/zinc/70/90/36/1047709036.db2.gz VGPJOMFCXTUKAD-UHFFFAOYSA-N 1 2 323.318 4.419 20 0 DIADLO CCOC(=O)/C=C/c1ccc[nH+]c1NCc1ccccc1C1CC1 ZINC001156537493 1047716858 /nfs/dbraw/zinc/71/68/58/1047716858.db2.gz REOWVOLLYQRIHR-VAWYXSNFSA-N 1 2 322.408 4.147 20 0 DIADLO Fc1ccc(C[NH+]2CC(Cc3ccco3)C2)c(C(F)(F)F)c1 ZINC001206660788 1047718096 /nfs/dbraw/zinc/71/80/96/1047718096.db2.gz IRZUPQHJNPMEQG-UHFFFAOYSA-N 1 2 313.294 4.112 20 0 DIADLO CCc1ccc(Cn2nc(C(F)(F)F)c3c[nH+]ccc32)cc1 ZINC000538940714 1047719683 /nfs/dbraw/zinc/71/96/83/1047719683.db2.gz QKNKFOIIOCYCNP-UHFFFAOYSA-N 1 2 305.303 4.061 20 0 DIADLO Cc1cccc(C2=CC[N@H+](Cc3nc(C4CCCC4)no3)CC2)c1 ZINC000538945235 1047720826 /nfs/dbraw/zinc/72/08/26/1047720826.db2.gz ZDFHKLHIFPVZGZ-UHFFFAOYSA-N 1 2 323.440 4.325 20 0 DIADLO Cc1cccc(C2=CC[N@@H+](Cc3nc(C4CCCC4)no3)CC2)c1 ZINC000538945235 1047720827 /nfs/dbraw/zinc/72/08/27/1047720827.db2.gz ZDFHKLHIFPVZGZ-UHFFFAOYSA-N 1 2 323.440 4.325 20 0 DIADLO Cc1nc2cc(CNc3[nH+]c(C)cc(Cl)c3C)ccc2o1 ZINC001156936167 1047729346 /nfs/dbraw/zinc/72/93/46/1047729346.db2.gz ZVKSZTMBMZVTCQ-UHFFFAOYSA-N 1 2 301.777 4.414 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+]Cc2nnc(-c3ccc(F)cc3)[nH]2)c1C ZINC000539120004 1047737096 /nfs/dbraw/zinc/73/70/96/1047737096.db2.gz XGELUDYJHDWDMG-CQSZACIVSA-N 1 2 324.403 4.078 20 0 DIADLO Cc1cccc([C@H](C)[NH2+]Cc2nnc(-c3ccc(F)cc3)[nH]2)c1C ZINC000539120001 1047737250 /nfs/dbraw/zinc/73/72/50/1047737250.db2.gz XGELUDYJHDWDMG-AWEZNQCLSA-N 1 2 324.403 4.078 20 0 DIADLO CCOc1cc(Nc2cc(F)nc(C(F)(F)F)c2)cc(C)[nH+]1 ZINC001213006964 1047737959 /nfs/dbraw/zinc/73/79/59/1047737959.db2.gz LTPONZSCGGXJSU-UHFFFAOYSA-N 1 2 315.270 4.085 20 0 DIADLO CSCC[C@@H](Nc1cc(C)c2cccc(C)c2[nH+]1)C(C)(C)O ZINC001157429080 1047742900 /nfs/dbraw/zinc/74/29/00/1047742900.db2.gz SZVAUTZJOIAVSC-OAHLLOKOSA-N 1 2 318.486 4.156 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2ccc(-c3csc(C)n3)cc2)no1 ZINC000539277272 1047743884 /nfs/dbraw/zinc/74/38/84/1047743884.db2.gz WRTGPUIGYRHNFY-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO CSCc1cc[nH+]c(N2CCC(c3cccc(O)c3)CC2)c1 ZINC001157570993 1047746012 /nfs/dbraw/zinc/74/60/12/1047746012.db2.gz DXDAUGSCBGSGQI-UHFFFAOYSA-N 1 2 314.454 4.034 20 0 DIADLO COc1ccc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)cn1 ZINC000539329698 1047746945 /nfs/dbraw/zinc/74/69/45/1047746945.db2.gz LOEQLFORJVJWLV-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)N(C)c1[nH+]ccc2c1ccn2C ZINC001157756469 1047753184 /nfs/dbraw/zinc/75/31/84/1047753184.db2.gz KVEOYDCKZOBBEK-SFHVURJKSA-N 1 2 321.424 4.061 20 0 DIADLO COC1CCC(Nc2cc(-c3ccnc(Cl)c3)cc[nH+]2)CC1 ZINC001157805057 1047755267 /nfs/dbraw/zinc/75/52/67/1047755267.db2.gz XUNPPCYFZVHPRO-UHFFFAOYSA-N 1 2 317.820 4.167 20 0 DIADLO CCCc1ccc(CNc2[nH+]cc(C)cc2C(OC)OC)cc1 ZINC001157829679 1047757238 /nfs/dbraw/zinc/75/72/38/1047757238.db2.gz RFOAACUYALTMLJ-UHFFFAOYSA-N 1 2 314.429 4.246 20 0 DIADLO CC(C)OCCCNc1[nH+]cccc1OCc1ccc(F)cc1 ZINC001157870841 1047760769 /nfs/dbraw/zinc/76/07/69/1047760769.db2.gz TXXMVZOQRNHWAL-UHFFFAOYSA-N 1 2 318.392 4.027 20 0 DIADLO CC[C@@H](C)C[C@H](C)Nc1cc([C@@H](CC(=O)OC)C2CC2)cc[nH+]1 ZINC001157885543 1047761616 /nfs/dbraw/zinc/76/16/16/1047761616.db2.gz BOUQGJPXRIVSTP-KEYYUXOJSA-N 1 2 318.461 4.375 20 0 DIADLO CC[C@H](C)C[C@H](C)Nc1cc([C@@H](CC(=O)OC)C2CC2)cc[nH+]1 ZINC001157885545 1047761710 /nfs/dbraw/zinc/76/17/10/1047761710.db2.gz BOUQGJPXRIVSTP-ZQIUZPCESA-N 1 2 318.461 4.375 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@@H]3CC[C@H](C)SC3)cc2)c1C ZINC000655776813 1047762425 /nfs/dbraw/zinc/76/24/25/1047762425.db2.gz PICLZIUGNZFTQW-BLLLJJGKSA-N 1 2 301.459 4.185 20 0 DIADLO Clc1cc2ccccc2nc1NCCc1cn2ccccc2[nH+]1 ZINC001158146343 1047769844 /nfs/dbraw/zinc/76/98/44/1047769844.db2.gz YLJRLOGDYGZHGK-UHFFFAOYSA-N 1 2 322.799 4.191 20 0 DIADLO O[C@@H]1CCC[C@H](Nc2cc(SCc3ccccc3)cc[nH+]2)C1 ZINC001158371831 1047777062 /nfs/dbraw/zinc/77/70/62/1047777062.db2.gz CLOKTZNXPBTUEZ-JKSUJKDBSA-N 1 2 314.454 4.089 20 0 DIADLO CC(=O)Nc1c(C)cc[nH+]c1N(C(C)C)[C@@H](C)c1ccccc1 ZINC001158474065 1047783594 /nfs/dbraw/zinc/78/35/94/1047783594.db2.gz LUBNALSANYIHSF-HNNXBMFYSA-N 1 2 311.429 4.324 20 0 DIADLO C[C@@H]1C[C@H](Nc2cc(N3CCC[C@@H](C)C3)nc[nH+]2)c2ccccc21 ZINC001158476629 1047784964 /nfs/dbraw/zinc/78/49/64/1047784964.db2.gz MAPYGWMTFUZMAS-RKVPGOIHSA-N 1 2 322.456 4.373 20 0 DIADLO C[C@@H]1C[C@H](Nc2cc(N3CCC[C@@H](C)C3)[nH+]cn2)c2ccccc21 ZINC001158476629 1047784967 /nfs/dbraw/zinc/78/49/67/1047784967.db2.gz MAPYGWMTFUZMAS-RKVPGOIHSA-N 1 2 322.456 4.373 20 0 DIADLO C[C@@H]1C[C@@H](Nc2cc(N3CCC[C@@H](C)C3)nc[nH+]2)c2ccccc21 ZINC001158476628 1047785144 /nfs/dbraw/zinc/78/51/44/1047785144.db2.gz MAPYGWMTFUZMAS-IIDMSEBBSA-N 1 2 322.456 4.373 20 0 DIADLO C[C@@H]1C[C@@H](Nc2cc(N3CCC[C@@H](C)C3)[nH+]cn2)c2ccccc21 ZINC001158476628 1047785149 /nfs/dbraw/zinc/78/51/49/1047785149.db2.gz MAPYGWMTFUZMAS-IIDMSEBBSA-N 1 2 322.456 4.373 20 0 DIADLO O[C@H]1c2ccccc2CC[C@H]1Nc1[nH+]ccc2cc(Cl)ccc21 ZINC001158686856 1047794212 /nfs/dbraw/zinc/79/42/12/1047794212.db2.gz YXRDTRDFCSZPDA-MSOLQXFVSA-N 1 2 324.811 4.349 20 0 DIADLO Clc1cccc2c(NCc3cn4ccccc4n3)cc[nH+]c12 ZINC000552911180 1047804342 /nfs/dbraw/zinc/80/43/42/1047804342.db2.gz OCWBVZQJYCAACT-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO CC(C)[C@@H](Nc1cc(N2CCCC2)nc[nH+]1)c1ccc(F)cc1 ZINC000552909990 1047804381 /nfs/dbraw/zinc/80/43/81/1047804381.db2.gz ZHVSPSOMZKVKRS-GOSISDBHSA-N 1 2 314.408 4.025 20 0 DIADLO CC(C)[C@@H](Nc1cc(N2CCCC2)[nH+]cn1)c1ccc(F)cc1 ZINC000552909990 1047804388 /nfs/dbraw/zinc/80/43/88/1047804388.db2.gz ZHVSPSOMZKVKRS-GOSISDBHSA-N 1 2 314.408 4.025 20 0 DIADLO Cc1cc(NCc2ccccc2-c2cccnc2)nc(C2CC2)[nH+]1 ZINC001159107088 1047812445 /nfs/dbraw/zinc/81/24/45/1047812445.db2.gz KDBFNFPIQSXUEO-UHFFFAOYSA-N 1 2 316.408 4.337 20 0 DIADLO FC(F)c1cccc(COc2cccc(-n3cc[nH+]c3)c2)c1 ZINC000478788799 1047816172 /nfs/dbraw/zinc/81/61/72/1047816172.db2.gz OMKGOEXOHYCVSQ-UHFFFAOYSA-N 1 2 300.308 4.389 20 0 DIADLO c1c[nH+]c(N2CCCCC2)c(Nc2ccc3c(c2)CCCN3)c1 ZINC001159167489 1047817350 /nfs/dbraw/zinc/81/73/50/1047817350.db2.gz MLOTUWREQLNMFL-UHFFFAOYSA-N 1 2 308.429 4.174 20 0 DIADLO COc1c[nH+]c(NCc2nc(-c3ccccc3)cs2)c(C)c1 ZINC001159210453 1047820393 /nfs/dbraw/zinc/82/03/93/1047820393.db2.gz HVRJVANIESCPRL-UHFFFAOYSA-N 1 2 311.410 4.134 20 0 DIADLO CC1(C)[C@H](Nc2cc[nH+]c3c(Cl)cccc23)[C@H]2CCO[C@@H]21 ZINC000553076051 1047821661 /nfs/dbraw/zinc/82/16/61/1047821661.db2.gz BQOYTFBATUNCLD-LYRGGWFBSA-N 1 2 302.805 4.114 20 0 DIADLO COc1cc(C)c[nH+]c1NCc1nc(-c2ccccc2)cs1 ZINC001159213859 1047822126 /nfs/dbraw/zinc/82/21/26/1047822126.db2.gz HTURKRDFDDRCLS-UHFFFAOYSA-N 1 2 311.410 4.134 20 0 DIADLO N#CN(Cc1c[nH+]cn1Cc1ccccc1)c1cccc(Cl)c1 ZINC000478889945 1047824175 /nfs/dbraw/zinc/82/41/75/1047824175.db2.gz XYCKIIHLMLYZAE-UHFFFAOYSA-N 1 2 322.799 4.072 20 0 DIADLO Nc1ccc(Nc2c(F)cccc2OCc2ccccc2)c[nH+]1 ZINC001159280788 1047825448 /nfs/dbraw/zinc/82/54/48/1047825448.db2.gz FQNBAKFYAIUUNX-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO Nc1ccc(Nc2ccccc2OCc2ccc(F)cc2)c[nH+]1 ZINC001159280783 1047826069 /nfs/dbraw/zinc/82/60/69/1047826069.db2.gz FHMHICBUMJICNZ-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO FC(F)(F)c1nn(CCCCc2ccccc2)c2cc[nH+]cc21 ZINC000478944759 1047826497 /nfs/dbraw/zinc/82/64/97/1047826497.db2.gz VHWBDOQIHCGWAF-UHFFFAOYSA-N 1 2 319.330 4.473 20 0 DIADLO COc1ccc2c(c1)C[C@@H](Nc1cc3ccccc3c[nH+]1)CC2 ZINC001159362258 1047835547 /nfs/dbraw/zinc/83/55/47/1047835547.db2.gz WPCUCBNXGNXAPM-SFHVURJKSA-N 1 2 304.393 4.213 20 0 DIADLO COC1(C[NH2+]CC(F)(F)c2cccc(F)c2)CCCCCC1 ZINC001182781624 1047844556 /nfs/dbraw/zinc/84/45/56/1047844556.db2.gz LXSLIZFTMXZODF-UHFFFAOYSA-N 1 2 315.379 4.247 20 0 DIADLO C[C@@H](CCc1ccc2c(c1)OCO2)Nc1c[nH+]cc2c1CCCC2 ZINC001182844681 1047847800 /nfs/dbraw/zinc/84/78/00/1047847800.db2.gz OIRQDTIQMIJHRJ-AWEZNQCLSA-N 1 2 324.424 4.122 20 0 DIADLO c1cncc([C@H]2CCC[C@H](Nc3c[nH+]cc4c3CCCC4)C2)c1 ZINC001182844939 1047848407 /nfs/dbraw/zinc/84/84/07/1047848407.db2.gz PKCYDVHUVVRIMC-YJBOKZPZSA-N 1 2 307.441 4.494 20 0 DIADLO Cc1ccccc1Oc1ccccc1NC(=O)[C@@H]1CC[N@H+]1C(C)C ZINC001182851290 1047853996 /nfs/dbraw/zinc/85/39/96/1047853996.db2.gz CBSAAOUHLIYTBM-KRWDZBQOSA-N 1 2 324.424 4.209 20 0 DIADLO Cc1ccccc1Oc1ccccc1NC(=O)[C@@H]1CC[N@@H+]1C(C)C ZINC001182851290 1047854009 /nfs/dbraw/zinc/85/40/09/1047854009.db2.gz CBSAAOUHLIYTBM-KRWDZBQOSA-N 1 2 324.424 4.209 20 0 DIADLO O=C1CCCN1c1ccc(Nc2ccc([NH+]3CCCC3)cc2)cc1 ZINC001174526560 1047855662 /nfs/dbraw/zinc/85/56/62/1047855662.db2.gz VGUDNVZFBFFHNH-UHFFFAOYSA-N 1 2 321.424 4.157 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1ccc(F)cc1Cl ZINC000553456786 1047856060 /nfs/dbraw/zinc/85/60/60/1047856060.db2.gz KVRWGMGYLAMUIT-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1ccc(F)cc1Cl ZINC000553456792 1047856315 /nfs/dbraw/zinc/85/63/15/1047856315.db2.gz KVRWGMGYLAMUIT-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO O=c1ccc2cc(Nc3ccc([NH+]4CCCC4)cc3)c[nH]c-2c1 ZINC001174526899 1047858005 /nfs/dbraw/zinc/85/80/05/1047858005.db2.gz DDLFVTXFMNTFGE-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H]1CCc2c1c(F)ccc2F ZINC000479283642 1047858375 /nfs/dbraw/zinc/85/83/75/1047858375.db2.gz MJQOAEJPRPAUGW-OAHLLOKOSA-N 1 2 323.770 4.404 20 0 DIADLO Clc1cc(Nc2cccc(-c3cc[nH]n3)c2)cn2cc[nH+]c12 ZINC001174506297 1047869776 /nfs/dbraw/zinc/86/97/76/1047869776.db2.gz DQDHIDDTTRCIGO-UHFFFAOYSA-N 1 2 309.760 4.121 20 0 DIADLO Cc1ccc(CC2C[NH+](Cc3c(Cl)cncc3Cl)C2)cc1 ZINC001182929961 1047870070 /nfs/dbraw/zinc/87/00/70/1047870070.db2.gz RGTSRZCCDAECIE-UHFFFAOYSA-N 1 2 321.251 4.371 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@H+]2C[C@H](C)O[C@@](C)(C(F)F)C2)cc1C ZINC001182970254 1047870914 /nfs/dbraw/zinc/87/09/14/1047870914.db2.gz LZCLVIOFGOQJLL-NTWLCTACSA-N 1 2 323.427 4.370 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@@H+]2C[C@H](C)O[C@@](C)(C(F)F)C2)cc1C ZINC001182970254 1047870920 /nfs/dbraw/zinc/87/09/20/1047870920.db2.gz LZCLVIOFGOQJLL-NTWLCTACSA-N 1 2 323.427 4.370 20 0 DIADLO c1cc(-c2cccc(Nc3cccc(-n4cc[nH+]c4)c3)c2)n[nH]1 ZINC001174508091 1047874077 /nfs/dbraw/zinc/87/40/77/1047874077.db2.gz GIIKJHTUQDVGBY-UHFFFAOYSA-N 1 2 301.353 4.006 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccnn1CC1CCC1 ZINC000924719894 1047878712 /nfs/dbraw/zinc/87/87/12/1047878712.db2.gz AXIGSKKNSXTOBR-STQMWFEESA-N 1 2 319.399 4.373 20 0 DIADLO Cc1nn(C)c2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc12 ZINC001174523356 1047884514 /nfs/dbraw/zinc/88/45/14/1047884514.db2.gz JRPRIOYQZZJLDU-UHFFFAOYSA-N 1 2 321.428 4.011 20 0 DIADLO COCc1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)cc1F ZINC001174523188 1047884773 /nfs/dbraw/zinc/88/47/73/1047884773.db2.gz GOJUIBJLSBEFMY-UHFFFAOYSA-N 1 2 315.392 4.101 20 0 DIADLO Fc1cnc(Cl)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174523311 1047884806 /nfs/dbraw/zinc/88/48/06/1047884806.db2.gz YHEZFHCDZXOFJH-UHFFFAOYSA-N 1 2 306.772 4.003 20 0 DIADLO Cc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)cnc1Cl ZINC001174523765 1047885497 /nfs/dbraw/zinc/88/54/97/1047885497.db2.gz ZXUJESREIFQNRV-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO Oc1c(Cl)cccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174524895 1047886859 /nfs/dbraw/zinc/88/68/59/1047886859.db2.gz URQGHVWBLTXWIO-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO FC(F)(F)[C@@H]1C[N@@H+]([C@@H]2CCc3cc(Cl)ccc32)CCS1 ZINC001197817646 1047887713 /nfs/dbraw/zinc/88/77/13/1047887713.db2.gz DNECAIIPURLIQB-OLZOCXBDSA-N 1 2 321.795 4.307 20 0 DIADLO FC(F)(F)[C@@H]1C[N@H+]([C@@H]2CCc3cc(Cl)ccc32)CCS1 ZINC001197817646 1047887725 /nfs/dbraw/zinc/88/77/25/1047887725.db2.gz DNECAIIPURLIQB-OLZOCXBDSA-N 1 2 321.795 4.307 20 0 DIADLO Fc1cc(F)c(Nc2ccc(N3CCCCC3)[nH+]c2)cc1F ZINC001174524079 1047888763 /nfs/dbraw/zinc/88/87/63/1047888763.db2.gz CEAXDVJKUAGSDG-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO Fc1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)c(F)c1F ZINC001174524084 1047888953 /nfs/dbraw/zinc/88/89/53/1047888953.db2.gz CJUQIVAEQUMNRR-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO c1nc2cc(Nc3ccc(N4CCCCC4)[nH+]c3)ccc2s1 ZINC001174524463 1047889114 /nfs/dbraw/zinc/88/91/14/1047889114.db2.gz LBFVISYILHTHFM-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO COc1ccc(Cn2cc(Nc3cc(C)cc(C)[nH+]3)c(C)n2)cc1 ZINC001174576977 1047892513 /nfs/dbraw/zinc/89/25/13/1047892513.db2.gz RWOBAOCLBMDKBG-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO CNc1ccc(Nc2ccc(Cl)c(Br)c2)c[nH+]1 ZINC001159694365 1047902849 /nfs/dbraw/zinc/90/28/49/1047902849.db2.gz UIHWLBYHAYLOCW-UHFFFAOYSA-N 1 2 312.598 4.283 20 0 DIADLO CC(C)C(=O)Nc1ccc(Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC001197962004 1047908520 /nfs/dbraw/zinc/90/85/20/1047908520.db2.gz JNXYACFRULWNPN-UHFFFAOYSA-N 1 2 320.396 4.210 20 0 DIADLO FC(F)c1cccc(Nc2ccccc2C[NH+]2CCOCC2)c1 ZINC001174619879 1047911102 /nfs/dbraw/zinc/91/11/02/1047911102.db2.gz XCTBKSLISFIINC-UHFFFAOYSA-N 1 2 318.367 4.200 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1cnn2c1CCC2 ZINC000667499799 1047911218 /nfs/dbraw/zinc/91/12/18/1047911218.db2.gz VOLWRLPKJQZFDG-NSHDSACASA-N 1 2 324.255 4.329 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1cnn2c1CCC2 ZINC000667499799 1047911222 /nfs/dbraw/zinc/91/12/22/1047911222.db2.gz VOLWRLPKJQZFDG-NSHDSACASA-N 1 2 324.255 4.329 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@H](C)c2cncs2)c2ccccn2)cc1 ZINC000479508273 1047913443 /nfs/dbraw/zinc/91/34/43/1047913443.db2.gz YWIBGHLBBMIJPY-KDOFPFPSSA-N 1 2 309.438 4.287 20 0 DIADLO CNc1ccc(-n2c(-c3ccccc3)cc3cc(N)ccc32)c[nH+]1 ZINC001159753848 1047914472 /nfs/dbraw/zinc/91/44/72/1047914472.db2.gz ZARFUBGNRUVRHX-UHFFFAOYSA-N 1 2 314.392 4.316 20 0 DIADLO Cc1occc1C[N@@H+]1CCc2cc(C)cc(Br)c2C1 ZINC001183300933 1047915831 /nfs/dbraw/zinc/91/58/31/1047915831.db2.gz QSTUDLGBOJUEIC-UHFFFAOYSA-N 1 2 320.230 4.217 20 0 DIADLO Cc1occc1C[N@H+]1CCc2cc(C)cc(Br)c2C1 ZINC001183300933 1047915847 /nfs/dbraw/zinc/91/58/47/1047915847.db2.gz QSTUDLGBOJUEIC-UHFFFAOYSA-N 1 2 320.230 4.217 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cnn([C@@H]4CCCCO4)c3)ccc12 ZINC001174604787 1047923444 /nfs/dbraw/zinc/92/34/44/1047923444.db2.gz LWIWQJNJDOODRR-SFHVURJKSA-N 1 2 308.385 4.182 20 0 DIADLO COc1cc(OC)cc([C@H](C)Nc2cc(C(C)C)[nH+]c(C)n2)c1 ZINC001159809977 1047927745 /nfs/dbraw/zinc/92/77/45/1047927745.db2.gz OWDHCJHODZPGGZ-LBPRGKRZSA-N 1 2 315.417 4.099 20 0 DIADLO Cc1csc2sc(C[N@@H+]3C[C@@H](C)CC[C@@H]3C[NH3+])c(C)c12 ZINC001205827261 1047927805 /nfs/dbraw/zinc/92/78/05/1047927805.db2.gz GDPNZMBPDORKPO-GXFFZTMASA-N 1 2 308.516 4.139 20 0 DIADLO Cc1csc2sc(C[N@H+]3C[C@@H](C)CC[C@@H]3C[NH3+])c(C)c12 ZINC001205827261 1047927814 /nfs/dbraw/zinc/92/78/14/1047927814.db2.gz GDPNZMBPDORKPO-GXFFZTMASA-N 1 2 308.516 4.139 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2cccc(F)c2N)c[nH+]1 ZINC001159870876 1047939261 /nfs/dbraw/zinc/93/92/61/1047939261.db2.gz RLTIIVAZSWJIRR-UHFFFAOYSA-N 1 2 322.387 4.183 20 0 DIADLO Cc1cccc(C)c1NC(=S)Nc1ccccc1-n1cc[nH+]c1 ZINC001198325381 1047944915 /nfs/dbraw/zinc/94/49/15/1047944915.db2.gz IUHTYDOGESBTNB-UHFFFAOYSA-N 1 2 322.437 4.298 20 0 DIADLO C[N@H+](Cc1c(Cl)cccc1Cl)[C@H](CO)c1ccccc1 ZINC000479640683 1047946006 /nfs/dbraw/zinc/94/60/06/1047946006.db2.gz QLIGBTQYWMHIPI-MRXNPFEDSA-N 1 2 310.224 4.159 20 0 DIADLO C[N@@H+](Cc1c(Cl)cccc1Cl)[C@H](CO)c1ccccc1 ZINC000479640683 1047946009 /nfs/dbraw/zinc/94/60/09/1047946009.db2.gz QLIGBTQYWMHIPI-MRXNPFEDSA-N 1 2 310.224 4.159 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc(N4CCOCC4)cc3)ccc12 ZINC001174710562 1047948118 /nfs/dbraw/zinc/94/81/18/1047948118.db2.gz QPDLZXRVAQFFOF-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO FC(F)(F)c1cncc(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001174743434 1047953535 /nfs/dbraw/zinc/95/35/35/1047953535.db2.gz IIPGSDHQQNTOHS-UHFFFAOYSA-N 1 2 318.302 4.089 20 0 DIADLO CC(C)(C)c1ccc(NC(=S)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001198468263 1047960774 /nfs/dbraw/zinc/96/07/74/1047960774.db2.gz WDGIWLHDBWMRMA-UHFFFAOYSA-N 1 2 324.453 4.441 20 0 DIADLO CCc1cc(NC(=S)Nc2ccc(C(C)(C)C)cc2)cc[nH+]1 ZINC001198468809 1047962039 /nfs/dbraw/zinc/96/20/39/1047962039.db2.gz QKBRGWBJSVIXAK-UHFFFAOYSA-N 1 2 313.470 4.172 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(NC(=O)OC(C)(C)C)cc1 ZINC001160027512 1047973029 /nfs/dbraw/zinc/97/30/29/1047973029.db2.gz CRQUTUNHZYBQSX-UHFFFAOYSA-N 1 2 315.373 4.181 20 0 DIADLO Cc1cccc(C2=CC[N@H+](Cc3ccc(Cl)nn3)CC2)c1C ZINC001198573730 1047975940 /nfs/dbraw/zinc/97/59/40/1047975940.db2.gz PDIJRVOTJACCEK-UHFFFAOYSA-N 1 2 313.832 4.036 20 0 DIADLO Cc1cccc(C2=CC[N@@H+](Cc3ccc(Cl)nn3)CC2)c1C ZINC001198573730 1047975950 /nfs/dbraw/zinc/97/59/50/1047975950.db2.gz PDIJRVOTJACCEK-UHFFFAOYSA-N 1 2 313.832 4.036 20 0 DIADLO CCCC[N@H+](Cc1cn(CCC)nn1)Cc1c(C)oc(C)c1C ZINC001183940689 1047980929 /nfs/dbraw/zinc/98/09/29/1047980929.db2.gz YUAWNICDXHUUMJ-UHFFFAOYSA-N 1 2 318.465 4.009 20 0 DIADLO CCCC[N@@H+](Cc1cn(CCC)nn1)Cc1c(C)oc(C)c1C ZINC001183940689 1047980933 /nfs/dbraw/zinc/98/09/33/1047980933.db2.gz YUAWNICDXHUUMJ-UHFFFAOYSA-N 1 2 318.465 4.009 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)s2)nc1 ZINC001198597636 1047983056 /nfs/dbraw/zinc/98/30/56/1047983056.db2.gz WDYQGUZZLICXHE-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)s2)nc1 ZINC001198597636 1047983067 /nfs/dbraw/zinc/98/30/67/1047983067.db2.gz WDYQGUZZLICXHE-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc(Nc2cc(OC)c(C(F)(F)F)c[nH+]2)cc1C ZINC001174830071 1047985817 /nfs/dbraw/zinc/98/58/17/1047985817.db2.gz QSHFUFYNPJYGKE-UHFFFAOYSA-N 1 2 312.291 4.170 20 0 DIADLO CC(C)c1ccc(NC(=S)NCc2c[nH+]cn2C(C)C)cc1 ZINC001198636965 1047988510 /nfs/dbraw/zinc/98/85/10/1047988510.db2.gz FETQJSFWFPZWIT-UHFFFAOYSA-N 1 2 316.474 4.074 20 0 DIADLO Cc1cc(Nc2ccc(N(C)Cc3ccccc3)[nH+]c2)ccc1N ZINC001160211500 1047999352 /nfs/dbraw/zinc/99/93/52/1047999352.db2.gz IKFJJPORSXBVTG-UHFFFAOYSA-N 1 2 318.424 4.352 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2ccc(F)c(N)c2)c[nH+]1 ZINC001160241637 1048008777 /nfs/dbraw/zinc/00/87/77/1048008777.db2.gz UOADWWYTEBCZBQ-UHFFFAOYSA-N 1 2 322.387 4.183 20 0 DIADLO Cc1csc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1Cl ZINC000479937805 1048010084 /nfs/dbraw/zinc/01/00/84/1048010084.db2.gz DBADIHMJYJAGHP-UHFFFAOYSA-N 1 2 317.801 4.352 20 0 DIADLO CC(C)OC(=O)c1cccc(Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001174915969 1048027104 /nfs/dbraw/zinc/02/71/04/1048027104.db2.gz NCWJZDXCVFKACD-UHFFFAOYSA-N 1 2 321.380 4.181 20 0 DIADLO CCc1ccc2c(c1)CC[N@@H+](Cc1c(Cl)n[nH]c1C1CC1)C2 ZINC001184387452 1048034680 /nfs/dbraw/zinc/03/46/80/1048034680.db2.gz KDLALYPBDMGKTB-UHFFFAOYSA-N 1 2 315.848 4.061 20 0 DIADLO CCc1ccc2c(c1)CC[N@H+](Cc1c(Cl)n[nH]c1C1CC1)C2 ZINC001184387452 1048034693 /nfs/dbraw/zinc/03/46/93/1048034693.db2.gz KDLALYPBDMGKTB-UHFFFAOYSA-N 1 2 315.848 4.061 20 0 DIADLO CC[C@@H](C)c1ccc(Nc2ccc(N3CCOCC3)[nH+]c2)cc1 ZINC001174974603 1048035527 /nfs/dbraw/zinc/03/55/27/1048035527.db2.gz QJUDFZFQARMMFP-OAHLLOKOSA-N 1 2 311.429 4.175 20 0 DIADLO Cc1ccc2ccccc2c1Nc1ccc(N2CCOCC2)[nH+]c1 ZINC001174974471 1048036275 /nfs/dbraw/zinc/03/62/75/1048036275.db2.gz MFGAHOJEASEYIG-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO Cc1ccc(C(C)C)cc1Nc1ccc(N2CCOCC2)[nH+]c1 ZINC001174977666 1048037024 /nfs/dbraw/zinc/03/70/24/1048037024.db2.gz MMRPDMBKMRIVKA-UHFFFAOYSA-N 1 2 311.429 4.094 20 0 DIADLO C[C@@H](Nc1[nH+]c2ccccc2n1C)c1nccc2ccccc21 ZINC001184452609 1048042094 /nfs/dbraw/zinc/04/20/94/1048042094.db2.gz QSLFYMIXSXZSFN-CYBMUJFWSA-N 1 2 302.381 4.295 20 0 DIADLO Cc1cc(Nc2ccc(N)c(Br)c2)ccc1[NH+](C)C ZINC001160376589 1048043257 /nfs/dbraw/zinc/04/32/57/1048043257.db2.gz WGPAWSVQXPZORR-UHFFFAOYSA-N 1 2 320.234 4.149 20 0 DIADLO CO[C@](C)(CNc1[nH+]c2ccccc2n1CCC(C)C)C1CC1 ZINC001184461910 1048044151 /nfs/dbraw/zinc/04/41/51/1048044151.db2.gz FVCSEGZZXRLRFQ-LJQANCHMSA-N 1 2 315.461 4.309 20 0 DIADLO Cc1cc(NC(=[NH2+])c2cccc3ccccc32)nc2[nH]ccc21 ZINC001160505276 1048061967 /nfs/dbraw/zinc/06/19/67/1048061967.db2.gz QNDBBPRCYVSQAT-UHFFFAOYSA-N 1 2 300.365 4.462 20 0 DIADLO CC(C)(C)c1ccc(N[C@@H](c2ccccc2)C2(O)CCC2)[nH+]c1 ZINC001160544511 1048066984 /nfs/dbraw/zinc/06/69/84/1048066984.db2.gz VPFTVZCZROTKBM-SFHVURJKSA-N 1 2 310.441 4.447 20 0 DIADLO CC[C@H]1C[C@@H](CNc2ccc([NH+]3CCCC3)cc2C)CCO1 ZINC001199591593 1048078273 /nfs/dbraw/zinc/07/82/73/1048078273.db2.gz FFPIWOKQLBTIEM-WMZOPIPTSA-N 1 2 302.462 4.212 20 0 DIADLO CC[C@H]1C[C@@H](C[NH2+]c2ccc(N3CCCC3)cc2C)CCO1 ZINC001199591593 1048078289 /nfs/dbraw/zinc/07/82/89/1048078289.db2.gz FFPIWOKQLBTIEM-WMZOPIPTSA-N 1 2 302.462 4.212 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3ccc(Cl)c(C)n3)c[nH+]c12 ZINC001160683368 1048078437 /nfs/dbraw/zinc/07/84/37/1048078437.db2.gz NBIANWDAGLLYFL-LBPRGKRZSA-N 1 2 300.793 4.173 20 0 DIADLO CCOc1cc(CNc2[nH+]c(C)cc(Cl)c2C)ccc1O ZINC001160784716 1048085238 /nfs/dbraw/zinc/08/52/38/1048085238.db2.gz XHDJJIQLNALSBK-UHFFFAOYSA-N 1 2 306.793 4.068 20 0 DIADLO c1ccc([C@@H]([NH2+]Cc2noc(C3CC3)n2)C2CCCCC2)cc1 ZINC000776007148 1048087746 /nfs/dbraw/zinc/08/77/46/1048087746.db2.gz QGKZYGIPIJOUHD-GOSISDBHSA-N 1 2 311.429 4.358 20 0 DIADLO Clc1nc(Br)ccc1Nc1cccc2[nH+]c[nH]c21 ZINC001213027412 1048094412 /nfs/dbraw/zinc/09/44/12/1048094412.db2.gz YKHUMGGSNDSIDG-UHFFFAOYSA-N 1 2 323.581 4.117 20 0 DIADLO FC(F)(F)c1cnc(Cl)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213027391 1048094792 /nfs/dbraw/zinc/09/47/92/1048094792.db2.gz XNIHKDXKCDANGQ-UHFFFAOYSA-N 1 2 312.682 4.374 20 0 DIADLO Cc1nc(NCc2nccc(Cl)c2Cl)cc(C(C)C)[nH+]1 ZINC001160927432 1048097686 /nfs/dbraw/zinc/09/76/86/1048097686.db2.gz QLWUULJRGFQIPM-UHFFFAOYSA-N 1 2 311.216 4.222 20 0 DIADLO Cc1cn2cc(NC(=O)N3CCC[C@@]3(C)CC(C)C)ccc2[nH+]1 ZINC001199767558 1048098826 /nfs/dbraw/zinc/09/88/26/1048098826.db2.gz HONZBMAAYSLYHV-SFHVURJKSA-N 1 2 314.433 4.075 20 0 DIADLO CCc1cc(Nc2cccc3[nH+]c[nH]c32)n(-c2ccccc2)n1 ZINC001213028122 1048101684 /nfs/dbraw/zinc/10/16/84/1048101684.db2.gz IGEYIIPZFRBEBJ-UHFFFAOYSA-N 1 2 303.369 4.055 20 0 DIADLO C[C@@H](c1cccs1)N(C)c1nc2ccccc2n2c[nH+]cc12 ZINC001184906307 1048103714 /nfs/dbraw/zinc/10/37/14/1048103714.db2.gz YDMUWRDAASCKNI-LBPRGKRZSA-N 1 2 308.410 4.141 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+]Cc1ccc(F)c(F)c1F ZINC001199800817 1048103727 /nfs/dbraw/zinc/10/37/27/1048103727.db2.gz KETFVHGLOARIRT-UHFFFAOYSA-N 1 2 315.722 4.056 20 0 DIADLO CC(=O)n1ccc2cc(Nc3ccc[nH+]c3N3CCCC3)ccc21 ZINC001184965179 1048105696 /nfs/dbraw/zinc/10/56/96/1048105696.db2.gz STKBDEILFQDBIY-UHFFFAOYSA-N 1 2 320.396 4.040 20 0 DIADLO CCc1cc(N(Cc2ccc(F)cc2F)C2CC2)nc(CC)[nH+]1 ZINC001184927582 1048106042 /nfs/dbraw/zinc/10/60/42/1048106042.db2.gz NQVUKOGXDXJXDP-UHFFFAOYSA-N 1 2 317.383 4.049 20 0 DIADLO Oc1cc(Cl)c(Cl)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001184969194 1048107510 /nfs/dbraw/zinc/10/75/10/1048107510.db2.gz XICRERVMQAWPGT-UHFFFAOYSA-N 1 2 324.211 4.438 20 0 DIADLO Cc1cc(C)c(Nc2cccc3[nH+]c[nH]c32)c(Br)n1 ZINC001213028818 1048109219 /nfs/dbraw/zinc/10/92/19/1048109219.db2.gz YSBYRNVEFFUMTC-UHFFFAOYSA-N 1 2 317.190 4.081 20 0 DIADLO C/C=C\C[C@@H]1CCC[N@@H+]([C@@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001175054491 1048111717 /nfs/dbraw/zinc/11/17/17/1048111717.db2.gz SBNOYSFOXMCRCA-SWTGODCJSA-N 1 2 321.848 4.232 20 0 DIADLO C/C=C\C[C@@H]1CCC[N@H+]([C@@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001175054491 1048111720 /nfs/dbraw/zinc/11/17/20/1048111720.db2.gz SBNOYSFOXMCRCA-SWTGODCJSA-N 1 2 321.848 4.232 20 0 DIADLO Fc1cc(F)c(Nc2cccc3[nH+]c[nH]c32)cc1Br ZINC001213030734 1048113246 /nfs/dbraw/zinc/11/32/46/1048113246.db2.gz ONHHHPNTPZIWOC-UHFFFAOYSA-N 1 2 324.128 4.347 20 0 DIADLO Clc1nccc(Br)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213030541 1048113590 /nfs/dbraw/zinc/11/35/90/1048113590.db2.gz DRKIRORYTSJCJX-UHFFFAOYSA-N 1 2 323.581 4.117 20 0 DIADLO CCOc1cc(Nc2cccc(Cn3cc[nH+]c3)c2)ccc1F ZINC001175055020 1048114439 /nfs/dbraw/zinc/11/44/39/1048114439.db2.gz UDYRAYPZIPDBPF-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO COc1cc(Br)ccc1Nc1cccc2[nH+]c[nH]c21 ZINC001213031668 1048119018 /nfs/dbraw/zinc/11/90/18/1048119018.db2.gz LWZZWPRUHTYHQE-UHFFFAOYSA-N 1 2 318.174 4.078 20 0 DIADLO COc1cc(Nc2cccc3[nH+]c[nH]c32)ccc1C(F)(F)F ZINC001213032154 1048125089 /nfs/dbraw/zinc/12/50/89/1048125089.db2.gz VSGFNZCTLDYWOW-UHFFFAOYSA-N 1 2 307.275 4.334 20 0 DIADLO Fc1cc(Br)cc(Nc2cccc3[nH+]c[nH]c32)c1 ZINC001213032230 1048125172 /nfs/dbraw/zinc/12/51/72/1048125172.db2.gz ZIATWNKHJHUEPE-UHFFFAOYSA-N 1 2 306.138 4.208 20 0 DIADLO Clc1ccc2c(cc[nH+]c2N[C@@H]2CCCc3nccnc32)c1 ZINC001161408850 1048127484 /nfs/dbraw/zinc/12/74/84/1048127484.db2.gz YMMVUJWEOZTJSI-OAHLLOKOSA-N 1 2 310.788 4.168 20 0 DIADLO Fc1c(Nc2cccc3[nH+]c[nH]c32)cccc1OC(F)(F)F ZINC001213032580 1048129059 /nfs/dbraw/zinc/12/90/59/1048129059.db2.gz NATCWKRGFNTQOT-UHFFFAOYSA-N 1 2 311.238 4.344 20 0 DIADLO Nc1ccccc1N(Cc1ccccc1)c1cccc2[nH+]c[nH]c21 ZINC001213032595 1048129284 /nfs/dbraw/zinc/12/92/84/1048129284.db2.gz NRTGQXKWXUJDRB-UHFFFAOYSA-N 1 2 314.392 4.483 20 0 DIADLO Cc1cccc(C2(CC(=O)Nc3cccc4[nH+]ccn43)CCC2)c1 ZINC001185079524 1048131482 /nfs/dbraw/zinc/13/14/82/1048131482.db2.gz SWLDFESJEBXLCK-UHFFFAOYSA-N 1 2 319.408 4.093 20 0 DIADLO Cc1cc(NCCc2ccccc2Cl)nc(C2CCC2)[nH+]1 ZINC001185108205 1048135324 /nfs/dbraw/zinc/13/53/24/1048135324.db2.gz WXGCXQWQUAMOOX-UHFFFAOYSA-N 1 2 301.821 4.361 20 0 DIADLO CCOc1ccc(F)cc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001175082018 1048135213 /nfs/dbraw/zinc/13/52/13/1048135213.db2.gz ZKMXYIMLEDZOBD-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO CSc1cc(Cl)cnc1NCc1c[nH+]cn1CC1CCC1 ZINC001161533441 1048137513 /nfs/dbraw/zinc/13/75/13/1048137513.db2.gz QNNYULBCFQZGTG-UHFFFAOYSA-N 1 2 322.865 4.066 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cc(Cl)nc2ccccc21 ZINC001161562988 1048138755 /nfs/dbraw/zinc/13/87/55/1048138755.db2.gz LFRIJPVJSKRRFR-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO Cc1ccc(C)c(-c2ccc(NCc3c[nH+]cn3C(C)C)nn2)c1 ZINC001161568806 1048139071 /nfs/dbraw/zinc/13/90/71/1048139071.db2.gz CVRCLKZNQWUEDI-UHFFFAOYSA-N 1 2 321.428 4.150 20 0 DIADLO c1nc(-c2ccccc2)sc1C[NH2+]Cc1nc2ccccc2o1 ZINC001200872515 1048151286 /nfs/dbraw/zinc/15/12/86/1048151286.db2.gz QBCRJYZXECLKRS-UHFFFAOYSA-N 1 2 321.405 4.241 20 0 DIADLO COc1c(N)cc(C(C)(C)C)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213034395 1048151599 /nfs/dbraw/zinc/15/15/99/1048151599.db2.gz HIBNRJXDPRMVLS-UHFFFAOYSA-N 1 2 310.401 4.195 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(Nc3cccc(N(C)C(C)C)c3)c12 ZINC001185253531 1048152232 /nfs/dbraw/zinc/15/22/32/1048152232.db2.gz NBRLCKZQIFQERZ-UHFFFAOYSA-N 1 2 309.417 4.109 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@@H+]2Cc3ccccc3[C@@H]2C)c(C)c1 ZINC000554678694 1048152572 /nfs/dbraw/zinc/15/25/72/1048152572.db2.gz LBXUNXKGQPMBKV-HOTGVXAUSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@H+]2Cc3ccccc3[C@@H]2C)c(C)c1 ZINC000554678694 1048152576 /nfs/dbraw/zinc/15/25/76/1048152576.db2.gz LBXUNXKGQPMBKV-HOTGVXAUSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@@H+]2Cc3ccccc3[C@H]2C)c(C)c1 ZINC000554678691 1048152674 /nfs/dbraw/zinc/15/26/74/1048152674.db2.gz LBXUNXKGQPMBKV-CVEARBPZSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@H+]2Cc3ccccc3[C@H]2C)c(C)c1 ZINC000554678691 1048152681 /nfs/dbraw/zinc/15/26/81/1048152681.db2.gz LBXUNXKGQPMBKV-CVEARBPZSA-N 1 2 308.425 4.207 20 0 DIADLO OCc1ccc(F)c(Nc2cc[nH+]c3cc(Cl)ccc23)c1 ZINC001175126991 1048154804 /nfs/dbraw/zinc/15/48/04/1048154804.db2.gz VUJKORMQHOLRAS-UHFFFAOYSA-N 1 2 302.736 4.263 20 0 DIADLO CCCn1nccc1C[N@@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000667684406 1048156531 /nfs/dbraw/zinc/15/65/31/1048156531.db2.gz VTLAYJMRZPSPIL-KRWDZBQOSA-N 1 2 324.428 4.162 20 0 DIADLO CCCn1nccc1C[N@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000667684406 1048156539 /nfs/dbraw/zinc/15/65/39/1048156539.db2.gz VTLAYJMRZPSPIL-KRWDZBQOSA-N 1 2 324.428 4.162 20 0 DIADLO CCC[C@H](Nc1nc2ccccc2n2c[nH+]cc12)c1ccccn1 ZINC001185283002 1048157168 /nfs/dbraw/zinc/15/71/68/1048157168.db2.gz YFZAAIAKFNKXMU-HNNXBMFYSA-N 1 2 317.396 4.231 20 0 DIADLO COC[C@@H](Nc1cc(SCc2ccccc2)cc[nH+]1)C1CC1 ZINC001161727303 1048162101 /nfs/dbraw/zinc/16/21/01/1048162101.db2.gz ZNDCZECGNYGYRP-QGZVFWFLSA-N 1 2 314.454 4.211 20 0 DIADLO CCc1cc(N[C@@H](c2nccs2)c2ccccc2)nc(CC)[nH+]1 ZINC001185306170 1048162357 /nfs/dbraw/zinc/16/23/57/1048162357.db2.gz OQMUXROSOVDQLG-QGZVFWFLSA-N 1 2 324.453 4.259 20 0 DIADLO Cc1cc(NC[C@@H]2CCCO[C@@H]2C(C)(C)C)nc(C2CCC2)[nH+]1 ZINC001185386951 1048170911 /nfs/dbraw/zinc/17/09/11/1048170911.db2.gz LOMOXYZQJMFVRD-RDJZCZTQSA-N 1 2 317.477 4.306 20 0 DIADLO COc1ccc2[nH+]c(NCc3cn(CC(C)C)cn3)cc(C)c2c1 ZINC001161794559 1048173584 /nfs/dbraw/zinc/17/35/84/1048173584.db2.gz TUPWPLWKYUUIMS-UHFFFAOYSA-N 1 2 324.428 4.016 20 0 DIADLO COc1ncccc1[C@@H](Nc1ccc(C(C)(C)C)c[nH+]1)C1CC1 ZINC001161794338 1048173699 /nfs/dbraw/zinc/17/36/99/1048173699.db2.gz OSSAWLSFZAUXQV-KRWDZBQOSA-N 1 2 311.429 4.346 20 0 DIADLO Cc1cc(N[C@H](c2cncc(F)c2)C2CC2)nc(C(C)C)[nH+]1 ZINC001161818809 1048177189 /nfs/dbraw/zinc/17/71/89/1048177189.db2.gz QJNAOILAYNZAMN-INIZCTEOSA-N 1 2 300.381 4.006 20 0 DIADLO Cc1ccc(C)c(CCNc2cccc(-c3c[nH+]cn3C)c2)c1 ZINC001161832348 1048180678 /nfs/dbraw/zinc/18/06/78/1048180678.db2.gz NOYWQQITBTVFPG-UHFFFAOYSA-N 1 2 305.425 4.359 20 0 DIADLO Cc1nc(Cl)cc(Nc2ccc([NH+]3CCC(C)CC3)cc2)n1 ZINC001185459391 1048183493 /nfs/dbraw/zinc/18/34/93/1048183493.db2.gz FPRGYOPGJIIWSB-UHFFFAOYSA-N 1 2 316.836 4.418 20 0 DIADLO Cc1cc(N[C@@H](c2ccnc(F)c2)C2CC2)nc(C(C)(C)C)[nH+]1 ZINC001161845927 1048184515 /nfs/dbraw/zinc/18/45/15/1048184515.db2.gz OHVJNPWQXHFYRZ-MRXNPFEDSA-N 1 2 314.408 4.180 20 0 DIADLO Cc1cc(N[C@H](c2ccnc(F)c2)C2CC2)nc(C(C)(C)C)[nH+]1 ZINC001161845926 1048185219 /nfs/dbraw/zinc/18/52/19/1048185219.db2.gz OHVJNPWQXHFYRZ-INIZCTEOSA-N 1 2 314.408 4.180 20 0 DIADLO Cc1cccnc1CNc1ccc2c(c1)[nH+]cn2-c1ccccc1 ZINC001161883334 1048189144 /nfs/dbraw/zinc/18/91/44/1048189144.db2.gz ILGQZXLQOXEUCI-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Cc1cn2cc(NC(=S)Nc3cccc(Cl)c3)ccc2[nH+]1 ZINC001201097191 1048189852 /nfs/dbraw/zinc/18/98/52/1048189852.db2.gz YVZGUQISGNQPJK-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO CC(C)c1cc(N[C@H](CO)C2CCCCC2)nc(C(C)C)[nH+]1 ZINC001185518555 1048190885 /nfs/dbraw/zinc/19/08/85/1048190885.db2.gz MBHWEIPWTQWOBE-MRXNPFEDSA-N 1 2 305.466 4.077 20 0 DIADLO COc1ccccc1CCNc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC001161923884 1048194927 /nfs/dbraw/zinc/19/49/27/1048194927.db2.gz JKUNFASBEYYTMG-UHFFFAOYSA-N 1 2 313.445 4.387 20 0 DIADLO CCc1ccccc1NC(=S)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001201137194 1048197738 /nfs/dbraw/zinc/19/77/38/1048197738.db2.gz HQXBPWPPOVGUBP-UHFFFAOYSA-N 1 2 322.437 4.244 20 0 DIADLO c1ccc([C@@H](Nc2cc[nH+]c(OC3CCOCC3)c2)C2CC2)cc1 ZINC001161962259 1048200176 /nfs/dbraw/zinc/20/01/76/1048200176.db2.gz WATZINVLQXNTQF-HXUWFJFHSA-N 1 2 324.424 4.203 20 0 DIADLO Cc1cc(CNc2ccc3ncccc3c2)c2c([nH+]1)CCCC2 ZINC001201150281 1048202522 /nfs/dbraw/zinc/20/25/22/1048202522.db2.gz HASWORYDQUUUMZ-UHFFFAOYSA-N 1 2 303.409 4.429 20 0 DIADLO CCCCOc1ncccc1C[NH2+]Cc1ccsc1Cl ZINC000480653768 1048206675 /nfs/dbraw/zinc/20/66/75/1048206675.db2.gz QDEHFOMEJJLNEP-UHFFFAOYSA-N 1 2 310.850 4.265 20 0 DIADLO CC(=O)c1ccc(Nc2cc[nH+]c3ccc(Cl)cc23)cc1F ZINC001175231835 1048207713 /nfs/dbraw/zinc/20/77/13/1048207713.db2.gz RAPYLFTXAHNVAS-UHFFFAOYSA-N 1 2 314.747 4.395 20 0 DIADLO CCO[C@H]1C[C@H](N(C)c2cc(C)[nH+]c(C3CC3)n2)C1(CC)CC ZINC001185620124 1048209746 /nfs/dbraw/zinc/20/97/46/1048209746.db2.gz DDUDJHZSTHQHKR-HOTGVXAUSA-N 1 2 317.477 4.082 20 0 DIADLO CCOc1cccc(Nc2cc(Cl)c3[nH+]ccn3c2)c1F ZINC001175239674 1048213619 /nfs/dbraw/zinc/21/36/19/1048213619.db2.gz BTEMOVPJTOHKBV-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO CCC1(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)CCOCC1 ZINC001201202073 1048216451 /nfs/dbraw/zinc/21/64/51/1048216451.db2.gz PIHVDICEXCEWJC-UHFFFAOYSA-N 1 2 319.836 4.144 20 0 DIADLO COc1ccccc1CNc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001201202088 1048216476 /nfs/dbraw/zinc/21/64/76/1048216476.db2.gz PVJCWNFDRJWFIS-UHFFFAOYSA-N 1 2 313.788 4.146 20 0 DIADLO CCCC[C@@H](CC)CNc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001162090368 1048224361 /nfs/dbraw/zinc/22/43/61/1048224361.db2.gz IFPQFRRJJGHSFP-CYBMUJFWSA-N 1 2 303.454 4.210 20 0 DIADLO COc1cc[nH+]c(C(C)(C)CNc2nc(C)c(Cl)cc2C)c1 ZINC001162129898 1048228386 /nfs/dbraw/zinc/22/83/86/1048228386.db2.gz RGQBROOBSSIQAM-UHFFFAOYSA-N 1 2 319.836 4.145 20 0 DIADLO Nc1ccc(Nc2ccc3sc(C(F)(F)F)nc3c2)c[nH+]1 ZINC001201291542 1048228452 /nfs/dbraw/zinc/22/84/52/1048228452.db2.gz KKDVXHOFGHFVDD-UHFFFAOYSA-N 1 2 310.304 4.036 20 0 DIADLO COc1ccnc(C(C)(C)CNc2cc3ccccc3c[nH+]2)c1 ZINC001162127948 1048228852 /nfs/dbraw/zinc/22/88/52/1048228852.db2.gz CNYSBOKXUBWMRC-UHFFFAOYSA-N 1 2 307.397 4.028 20 0 DIADLO Fc1cc(NCc2cncc3ccccc32)ccc1-n1cc[nH+]c1 ZINC001201256834 1048229166 /nfs/dbraw/zinc/22/91/66/1048229166.db2.gz HGIBRBVXWGUVLX-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO Cc1cc(C)c(Nc2ccc(N)[nH+]c2)c(C)c1Br ZINC001201292047 1048229234 /nfs/dbraw/zinc/22/92/34/1048229234.db2.gz IAKUUJDKABZSKM-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO Cc1cccc(Nc2ccc(N)[nH+]c2)c1NC(=O)OC(C)(C)C ZINC001201299506 1048232060 /nfs/dbraw/zinc/23/20/60/1048232060.db2.gz FYPSSMDBZYELJM-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO COc1ccc2cc(NCc3ccc4c(ccn4C)c3)[nH+]cc2c1 ZINC001162165944 1048234584 /nfs/dbraw/zinc/23/45/84/1048234584.db2.gz MIJIICVSPHNSQQ-UHFFFAOYSA-N 1 2 317.392 4.347 20 0 DIADLO C[C@@H](C[NH2+]c1ccc(N2CCOC[C@@H]2C)cc1)c1ccccc1 ZINC000774936599 1048234663 /nfs/dbraw/zinc/23/46/63/1048234663.db2.gz AEOMBJVQFBHABJ-IRXDYDNUSA-N 1 2 310.441 4.127 20 0 DIADLO C[C@H](C[NH2+]c1ccc(N2CCOC[C@H]2C)cc1)c1ccccc1 ZINC000774936598 1048235330 /nfs/dbraw/zinc/23/53/30/1048235330.db2.gz AEOMBJVQFBHABJ-IAGOWNOFSA-N 1 2 310.441 4.127 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(N[C@@H](C)c2nnc3ccccn32)c1 ZINC001162188273 1048238934 /nfs/dbraw/zinc/23/89/34/1048238934.db2.gz JZKWYVCBSNPRJY-HNNXBMFYSA-N 1 2 323.444 4.057 20 0 DIADLO Cc1ccc(C(=O)CC[N@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)cc1 ZINC000480773493 1048241933 /nfs/dbraw/zinc/24/19/33/1048241933.db2.gz XPZOJSMSEZBKNC-LAUBAEHRSA-N 1 2 323.436 4.030 20 0 DIADLO Cc1ccc(C(=O)CC[N@@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)cc1 ZINC000480773493 1048241949 /nfs/dbraw/zinc/24/19/49/1048241949.db2.gz XPZOJSMSEZBKNC-LAUBAEHRSA-N 1 2 323.436 4.030 20 0 DIADLO Cc1c(Nc2ccccc2-n2cc[nH+]c2)cnn1-c1ccccc1 ZINC001201370444 1048241950 /nfs/dbraw/zinc/24/19/50/1048241950.db2.gz JXQPBNBAFVIEOO-UHFFFAOYSA-N 1 2 315.380 4.110 20 0 DIADLO Brc1ccc2c(NC3=CCSCC3)cc[nH+]c2c1 ZINC001201333032 1048243488 /nfs/dbraw/zinc/24/34/88/1048243488.db2.gz JQJNQPFDDBPQNA-UHFFFAOYSA-N 1 2 321.243 4.430 20 0 DIADLO CN(C)c1ccc(Nc2cc(F)c(OC3CCC3)c(F)c2)c[nH+]1 ZINC001175343996 1048249714 /nfs/dbraw/zinc/24/97/14/1048249714.db2.gz MLDRQHAZVBDJBL-UHFFFAOYSA-N 1 2 319.355 4.101 20 0 DIADLO CN(C)c1ccc(Nc2ccc(Oc3ccccc3)nc2)c[nH+]1 ZINC001175341426 1048250152 /nfs/dbraw/zinc/25/01/52/1048250152.db2.gz QPXKNFAFCHKBQC-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO Clc1cc(Nc2ccc(N3CCCC3)[nH+]c2)c(Cl)cn1 ZINC001175349346 1048251501 /nfs/dbraw/zinc/25/15/01/1048251501.db2.gz ODHNIUWICGIIMB-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO Clc1cnc(Cl)c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175345916 1048251554 /nfs/dbraw/zinc/25/15/54/1048251554.db2.gz IUKLTGYNJRFFPH-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO CC(C)Oc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1F ZINC001175348116 1048252846 /nfs/dbraw/zinc/25/28/46/1048252846.db2.gz AZABRYCLXQLUDT-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO CCc1ccc2c(c1)[C@H](Nc1cc(CC)[nH+]c(CC)n1)CCO2 ZINC001186053704 1048259881 /nfs/dbraw/zinc/25/98/81/1048259881.db2.gz IIXNYTVVNWEALV-MRXNPFEDSA-N 1 2 311.429 4.100 20 0 DIADLO Cc1nc(N2CCc3cc(C(C)(C)C)ccc3C2)c(C)c(C)[nH+]1 ZINC001162345449 1048265001 /nfs/dbraw/zinc/26/50/01/1048265001.db2.gz UPHLYDOLUVYYIA-UHFFFAOYSA-N 1 2 309.457 4.262 20 0 DIADLO CN(C)c1ccc(Nc2cc(-c3ccc(Cl)cc3)no2)c[nH+]1 ZINC001175339023 1048269536 /nfs/dbraw/zinc/26/95/36/1048269536.db2.gz UAKFNWLHKNQJMK-UHFFFAOYSA-N 1 2 314.776 4.200 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2ncc(C(C)C)o2)c1 ZINC000774987637 1048269869 /nfs/dbraw/zinc/26/98/69/1048269869.db2.gz AUTDLSOVZRXECW-AWEZNQCLSA-N 1 2 302.418 4.436 20 0 DIADLO Cc1ccccc1C1(CNc2nc(C)[nH+]c3c2CCCC3)CC1 ZINC001162375272 1048270740 /nfs/dbraw/zinc/27/07/40/1048270740.db2.gz IUTNYFRNNVONGV-UHFFFAOYSA-N 1 2 307.441 4.116 20 0 DIADLO CC(C)C[C@H](CO)Nc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1 ZINC001162372277 1048270803 /nfs/dbraw/zinc/27/08/03/1048270803.db2.gz GCRRAHOQKUACHO-MRXNPFEDSA-N 1 2 309.413 4.049 20 0 DIADLO Cc1ccc2cccc(Nc3ccc(N4CCCC4)[nH+]c3)c2n1 ZINC001175350501 1048271289 /nfs/dbraw/zinc/27/12/89/1048271289.db2.gz AEAJNDZIZKAQAP-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO COc1cc(Cl)cc(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175351397 1048272261 /nfs/dbraw/zinc/27/22/61/1048272261.db2.gz KNTNTXFFEUHMQP-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO Oc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c2ccccc12 ZINC001175353095 1048273157 /nfs/dbraw/zinc/27/31/57/1048273157.db2.gz ZFUHONKCDIYMLM-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO Clc1cc2ncoc2c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175352942 1048273925 /nfs/dbraw/zinc/27/39/25/1048273925.db2.gz RDRKGEGSDXQWGI-UHFFFAOYSA-N 1 2 314.776 4.220 20 0 DIADLO c1ccc(N2CCCCC2)c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175352239 1048274367 /nfs/dbraw/zinc/27/43/67/1048274367.db2.gz LSBBQNQQYGXTLC-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO Cc1cc(N[C@@H]2CCCO[C@H]2CC(C)C)nc(C2CCC2)[nH+]1 ZINC001186212519 1048276036 /nfs/dbraw/zinc/27/60/36/1048276036.db2.gz QNPCLXSBXQOTOG-CVEARBPZSA-N 1 2 303.450 4.058 20 0 DIADLO COC(=O)CCCCCCNc1[nH+]cccc1-c1ccccc1 ZINC001162427320 1048278909 /nfs/dbraw/zinc/27/89/09/1048278909.db2.gz DENOASHVVCSTTH-UHFFFAOYSA-N 1 2 312.413 4.284 20 0 DIADLO Cc1cc(Nc2ccc([NH2+]C(C)C)cc2)n(CC(F)(F)F)n1 ZINC001201489496 1048279756 /nfs/dbraw/zinc/27/97/56/1048279756.db2.gz QOXFSCHZFBRORU-UHFFFAOYSA-N 1 2 312.339 4.318 20 0 DIADLO Cc1cnn(Cc2cccnc2)c1Nc1ccc([NH2+]C(C)C)cc1 ZINC001201489017 1048279934 /nfs/dbraw/zinc/27/99/34/1048279934.db2.gz XAXJWPRERGIVAI-UHFFFAOYSA-N 1 2 321.428 4.199 20 0 DIADLO COc1ccc(-n2nccc2Nc2ccc([NH2+]C(C)C)cc2)cc1 ZINC001201490114 1048279980 /nfs/dbraw/zinc/27/99/80/1048279980.db2.gz BQVCLENUVZCHLD-UHFFFAOYSA-N 1 2 322.412 4.445 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cc(=O)[nH]n2C2CCCC2)cc1 ZINC001201488995 1048280718 /nfs/dbraw/zinc/28/07/18/1048280718.db2.gz WEOAXSKUARPUMY-UHFFFAOYSA-N 1 2 300.406 4.268 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cnc3c(C4CC4)cnn3c2)cc1 ZINC001201490575 1048283461 /nfs/dbraw/zinc/28/34/61/1048283461.db2.gz HAMPGLZDDONNKA-UHFFFAOYSA-N 1 2 307.401 4.171 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(N[C@@H]2c3cc(C)ccc3NC2=O)c1 ZINC001162572573 1048305881 /nfs/dbraw/zinc/30/58/81/1048305881.db2.gz GUHDZUFTVILYKW-LJQANCHMSA-N 1 2 323.440 4.255 20 0 DIADLO COc1cc(CCNc2cc(C)[nH+]c(C3CCC3)n2)ccc1C ZINC001162584907 1048307042 /nfs/dbraw/zinc/30/70/42/1048307042.db2.gz SCQLKHGUQBBGBY-UHFFFAOYSA-N 1 2 311.429 4.024 20 0 DIADLO Cc1nc(N[C@H]2CCC[C@H]2Cc2ccccc2)c2c([nH+]1)CCCC2 ZINC001162584979 1048308564 /nfs/dbraw/zinc/30/85/64/1048308564.db2.gz VSLKABRLJKSZJS-HKUYNNGSSA-N 1 2 321.468 4.487 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+]1CCOC2(C1)CCCCCC2 ZINC000481106781 1048310297 /nfs/dbraw/zinc/31/02/97/1048310297.db2.gz LLXAXNJMFHTJAW-OAHLLOKOSA-N 1 2 314.429 4.314 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+]1CCOC2(C1)CCCCCC2 ZINC000481106781 1048310311 /nfs/dbraw/zinc/31/03/11/1048310311.db2.gz LLXAXNJMFHTJAW-OAHLLOKOSA-N 1 2 314.429 4.314 20 0 DIADLO Cc1c2c[nH]nc2ccc1Nc1[nH+]cccc1N1CCCCC1 ZINC001175466460 1048311906 /nfs/dbraw/zinc/31/19/06/1048311906.db2.gz XUQHXWBJORJGTB-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO Cc1cc(N[C@@H]2C[C@@H](C)Oc3ccccc32)nc(C2CCC2)[nH+]1 ZINC001186510073 1048312809 /nfs/dbraw/zinc/31/28/09/1048312809.db2.gz VZYAKQCUKVJZPM-CZUORRHYSA-N 1 2 309.413 4.377 20 0 DIADLO Cc1c2c[nH]nc2ccc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001175467912 1048313338 /nfs/dbraw/zinc/31/33/38/1048313338.db2.gz JFVNQKOPAUVVQR-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO CC(C)(Nc1ccc(Cn2cc[nH+]c2)cc1)C(=O)c1ccccc1 ZINC001162636630 1048320233 /nfs/dbraw/zinc/32/02/33/1048320233.db2.gz BDAKYIVMLKAAGM-UHFFFAOYSA-N 1 2 319.408 4.005 20 0 DIADLO Cc1cc(F)ccc1C1CCN(c2nc(C)[nH+]c(C)c2C)CC1 ZINC001186585920 1048320801 /nfs/dbraw/zinc/32/08/01/1048320801.db2.gz VFHNDEXZFWBMHY-UHFFFAOYSA-N 1 2 313.420 4.233 20 0 DIADLO C[C@@]1(C2CCCCC2)CCN1C(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC001175484525 1048321745 /nfs/dbraw/zinc/32/17/45/1048321745.db2.gz STWRYYDQPYLGCA-FQEVSTJZSA-N 1 2 323.440 4.057 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(NC(C)(C)C(=O)c2ccccc2)c1 ZINC001162639856 1048322551 /nfs/dbraw/zinc/32/25/51/1048322551.db2.gz NSVWHMLWEGUYLH-UHFFFAOYSA-N 1 2 319.408 4.161 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@H+](Cc2ccnc(Cl)c2)C1 ZINC001175492661 1048326223 /nfs/dbraw/zinc/32/62/23/1048326223.db2.gz QGPUZHVJHPYJLU-KRWDZBQOSA-N 1 2 304.796 4.196 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@@H+](Cc2ccnc(Cl)c2)C1 ZINC001175492661 1048326237 /nfs/dbraw/zinc/32/62/37/1048326237.db2.gz QGPUZHVJHPYJLU-KRWDZBQOSA-N 1 2 304.796 4.196 20 0 DIADLO Fc1cc(F)cc(C[N@@H+]2CCC[C@](F)(c3ccccc3)C2)c1 ZINC001175490667 1048326395 /nfs/dbraw/zinc/32/63/95/1048326395.db2.gz GRECCFFYKCZQRC-GOSISDBHSA-N 1 2 305.343 4.426 20 0 DIADLO Fc1cc(F)cc(C[N@H+]2CCC[C@](F)(c3ccccc3)C2)c1 ZINC001175490667 1048326411 /nfs/dbraw/zinc/32/64/11/1048326411.db2.gz GRECCFFYKCZQRC-GOSISDBHSA-N 1 2 305.343 4.426 20 0 DIADLO CCc1cc(NC[C@H](C)Sc2ccccc2)nc(CC)[nH+]1 ZINC001162652979 1048328626 /nfs/dbraw/zinc/32/86/26/1048328626.db2.gz YCHZTZDZGQAODT-ZDUSSCGKSA-N 1 2 301.459 4.194 20 0 DIADLO c1ccc(CC[N@H+]2Cc3nc(-c4ccccc4)sc3C2)cc1 ZINC001201610596 1048331104 /nfs/dbraw/zinc/33/11/04/1048331104.db2.gz ZHLMNBXUJNVDIM-UHFFFAOYSA-N 1 2 306.434 4.368 20 0 DIADLO c1ccc(CC[N@@H+]2Cc3nc(-c4ccccc4)sc3C2)cc1 ZINC001201610596 1048331121 /nfs/dbraw/zinc/33/11/21/1048331121.db2.gz ZHLMNBXUJNVDIM-UHFFFAOYSA-N 1 2 306.434 4.368 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2CC[C@](F)(c3ccccc3F)C2)s1 ZINC000555366016 1048331189 /nfs/dbraw/zinc/33/11/89/1048331189.db2.gz WWVGKJVGDRGJDZ-QGZVFWFLSA-N 1 2 322.424 4.476 20 0 DIADLO CC(C)c1ncc(C[N@H+]2CC[C@](F)(c3ccccc3F)C2)s1 ZINC000555366016 1048331200 /nfs/dbraw/zinc/33/12/00/1048331200.db2.gz WWVGKJVGDRGJDZ-QGZVFWFLSA-N 1 2 322.424 4.476 20 0 DIADLO C[N@H+](Cc1nc(C(F)(F)F)cs1)[C@@H]1C=CCCCCC1 ZINC000555378384 1048334544 /nfs/dbraw/zinc/33/45/44/1048334544.db2.gz RSBUKSDGTFVNFS-LLVKDONJSA-N 1 2 304.381 4.483 20 0 DIADLO C[N@@H+](Cc1nc(C(F)(F)F)cs1)[C@@H]1C=CCCCCC1 ZINC000555378384 1048334558 /nfs/dbraw/zinc/33/45/58/1048334558.db2.gz RSBUKSDGTFVNFS-LLVKDONJSA-N 1 2 304.381 4.483 20 0 DIADLO Cc1ccc(Nc2cncc(OCc3ccccc3)c2)c(C)[nH+]1 ZINC001201621069 1048335105 /nfs/dbraw/zinc/33/51/05/1048335105.db2.gz MRFCBDCSGAXQRN-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO Cn1cccc1CNc1[nH+]ccc2cccc(C(F)(F)F)c21 ZINC001162704503 1048339764 /nfs/dbraw/zinc/33/97/64/1048339764.db2.gz VJIWVMIGHDTRJU-UHFFFAOYSA-N 1 2 305.303 4.204 20 0 DIADLO Cc1csc([C@H]2COCC[N@H+]2C[C@@H](C)C2CCCCC2)n1 ZINC000555427949 1048345199 /nfs/dbraw/zinc/34/51/99/1048345199.db2.gz XGHKABMBXCZODS-CZUORRHYSA-N 1 2 308.491 4.041 20 0 DIADLO Cc1csc([C@H]2COCC[N@@H+]2C[C@@H](C)C2CCCCC2)n1 ZINC000555427949 1048345214 /nfs/dbraw/zinc/34/52/14/1048345214.db2.gz XGHKABMBXCZODS-CZUORRHYSA-N 1 2 308.491 4.041 20 0 DIADLO COc1ccccc1CC(C)(C)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC001162733139 1048345203 /nfs/dbraw/zinc/34/52/03/1048345203.db2.gz ZYPGUFPAMGOQEG-UHFFFAOYSA-N 1 2 311.429 4.104 20 0 DIADLO OCc1cccc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)c1 ZINC001175509257 1048346535 /nfs/dbraw/zinc/34/65/35/1048346535.db2.gz FTJULWDWCBREMQ-UHFFFAOYSA-N 1 2 318.298 4.490 20 0 DIADLO Cc1cc(Nc2ccc[nH+]c2N2CCCCC2)cc2c[nH]nc21 ZINC001175516792 1048350407 /nfs/dbraw/zinc/35/04/07/1048350407.db2.gz HISRWVRXPLEBGC-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO CCOC(=O)c1c(C)cc(N[C@@H]2CCc3sccc32)[nH+]c1C ZINC001162765973 1048353053 /nfs/dbraw/zinc/35/30/53/1048353053.db2.gz ICHFRCWTTAFFRE-CYBMUJFWSA-N 1 2 316.426 4.036 20 0 DIADLO Cc1cc(N[C@@H]2COc3ccc(Cl)cc32)nc(C2CCC2)[nH+]1 ZINC001162792022 1048361177 /nfs/dbraw/zinc/36/11/77/1048361177.db2.gz KCMXGQWXKLVLDE-CQSZACIVSA-N 1 2 315.804 4.252 20 0 DIADLO C[C@H]1C[C@H](CNc2nc3ccccc3n3c[nH+]cc23)C[C@@H](C)C1 ZINC001186980845 1048364164 /nfs/dbraw/zinc/36/41/64/1048364164.db2.gz NKLQQTKNZZODSM-FICVDOATSA-N 1 2 308.429 4.367 20 0 DIADLO C[C@H]1CC(CNc2nc3ccccc3n3c[nH+]cc23)C[C@H](C)C1 ZINC001186980847 1048364200 /nfs/dbraw/zinc/36/42/00/1048364200.db2.gz NKLQQTKNZZODSM-ZIAGYGMSSA-N 1 2 308.429 4.367 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(NCc2cn(C)c3ccccc23)c1 ZINC001162834865 1048370010 /nfs/dbraw/zinc/37/00/10/1048370010.db2.gz KEDQKEVUDWNYHS-UHFFFAOYSA-N 1 2 316.408 4.191 20 0 DIADLO Cc1ccc2ncc(C[NH2+][C@H](CF)c3ccc(F)cc3)cc2c1 ZINC001175561462 1048370789 /nfs/dbraw/zinc/37/07/89/1048370789.db2.gz UIGFJIWJSXDVKG-LJQANCHMSA-N 1 2 312.363 4.483 20 0 DIADLO CCc1cc(N[C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@@H]32)nc(CC)[nH+]1 ZINC001187107677 1048371029 /nfs/dbraw/zinc/37/10/29/1048371029.db2.gz DSEWTPLHKOBHJJ-FHLIZLRMSA-N 1 2 313.832 4.005 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2c(C)cc(C)nc2Br)c1 ZINC001203656603 1048385047 /nfs/dbraw/zinc/38/50/47/1048385047.db2.gz WXYVDLSFGNYTAE-UHFFFAOYSA-N 1 2 306.207 4.216 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cncc(Br)c2Cl)c1 ZINC001203656277 1048386541 /nfs/dbraw/zinc/38/65/41/1048386541.db2.gz PHMULYIIHVOTLE-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1nc(N[C@@H]2CCc3c2c(F)ccc3F)cc(C(C)C)[nH+]1 ZINC001162930445 1048389715 /nfs/dbraw/zinc/38/97/15/1048389715.db2.gz BMVRURSKZNVQFR-CQSZACIVSA-N 1 2 303.356 4.286 20 0 DIADLO COc1ccc2[nH+]c(N[C@H](CO)c3ccc(C)cc3)c(C)cc2c1 ZINC001162945416 1048393725 /nfs/dbraw/zinc/39/37/25/1048393725.db2.gz LTARIJHYTMEEFA-LJQANCHMSA-N 1 2 322.408 4.006 20 0 DIADLO CCc1ccc(C2=CCN(c3nc(C)[nH+]c(C)c3C)CC2)cc1 ZINC001162949319 1048395424 /nfs/dbraw/zinc/39/54/24/1048395424.db2.gz MNTKGDILPIEBJN-UHFFFAOYSA-N 1 2 307.441 4.258 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2cccc(OC3CCCC3)c2)s1 ZINC001201920125 1048402115 /nfs/dbraw/zinc/40/21/15/1048402115.db2.gz LWHFSYUHMAQSTC-LBPRGKRZSA-N 1 2 317.458 4.019 20 0 DIADLO CC[C@H](CO)Nc1cc(-c2ccccc2)c2ccc(OC)cc2[nH+]1 ZINC001163045860 1048407805 /nfs/dbraw/zinc/40/78/05/1048407805.db2.gz ZXCNDJJWDFNTIN-OAHLLOKOSA-N 1 2 322.408 4.093 20 0 DIADLO CCc1ccccc1NC(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001187603899 1048411184 /nfs/dbraw/zinc/41/11/84/1048411184.db2.gz PXOLZTNXZOEHSO-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO CCSc1cc[nH+]c(N[C@H](c2ccccc2)c2cccnn2)c1 ZINC001163108073 1048416681 /nfs/dbraw/zinc/41/66/81/1048416681.db2.gz HSXNSKWWFACSLW-GOSISDBHSA-N 1 2 322.437 4.185 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@@H](c2ccccc2)c2cccnn2)[nH+]1 ZINC001163105991 1048417266 /nfs/dbraw/zinc/41/72/66/1048417266.db2.gz XWSCFKLQWVLSBK-KRWDZBQOSA-N 1 2 324.815 4.343 20 0 DIADLO Cc1ccc(Cl)cc1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175712493 1048418727 /nfs/dbraw/zinc/41/87/27/1048418727.db2.gz BTXPSSRCJBDZHQ-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Cc1c(Cl)cccc1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175712791 1048418839 /nfs/dbraw/zinc/41/88/39/1048418839.db2.gz REIOQBFEQNQNOZ-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO COc1c(Cl)cccc1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175712547 1048419233 /nfs/dbraw/zinc/41/92/33/1048419233.db2.gz OEDYWSMBMZVIBX-UHFFFAOYSA-N 1 2 317.698 4.088 20 0 DIADLO Cc1ccc(Nc2c[nH+]c(N)cc2C(F)(F)F)c(Cl)c1 ZINC001175712633 1048419394 /nfs/dbraw/zinc/41/93/94/1048419394.db2.gz PJCZXMVARGLKGU-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Cc1ccc2c(c1)nc(Cl)cc2NCc1ccc2[nH+]ccn2c1 ZINC001163139044 1048420603 /nfs/dbraw/zinc/42/06/03/1048420603.db2.gz GJMPUUODUQVFFX-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO CCC(=O)c1ccccc1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175714441 1048421982 /nfs/dbraw/zinc/42/19/82/1048421982.db2.gz WDEPUQZMFANESC-UHFFFAOYSA-N 1 2 309.291 4.019 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccccc2-n2cccc2)c[nH+]1 ZINC001175717773 1048422641 /nfs/dbraw/zinc/42/26/41/1048422641.db2.gz OPTVLDRKUFXRHD-UHFFFAOYSA-N 1 2 318.302 4.217 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccccc2-c2cnco2)c[nH+]1 ZINC001175717662 1048423247 /nfs/dbraw/zinc/42/32/47/1048423247.db2.gz KZZRFXNKWPDVQC-UHFFFAOYSA-N 1 2 320.274 4.081 20 0 DIADLO CC(C)(C)[C@@H]1CCCN(c2nc3ccccc3n3c[nH+]cc23)C1 ZINC001163150856 1048424242 /nfs/dbraw/zinc/42/42/42/1048424242.db2.gz CIOKBSGSBWESOR-CQSZACIVSA-N 1 2 308.429 4.145 20 0 DIADLO O=C(CCCNc1cc(-c2ccccc2)cc[nH+]1)c1cccnc1 ZINC001163175395 1048427388 /nfs/dbraw/zinc/42/73/88/1048427388.db2.gz HPQLYJOCJPTKEY-UHFFFAOYSA-N 1 2 317.392 4.219 20 0 DIADLO COc1ccc2[nH+]c(N[C@H]3CCc4c3cccc4O)cc(C)c2c1 ZINC001163193658 1048433290 /nfs/dbraw/zinc/43/32/90/1048433290.db2.gz CPOHJKIPKFUVSK-KRWDZBQOSA-N 1 2 320.392 4.357 20 0 DIADLO Cc1ccc2c(Nc3ccnc(Br)c3)cccc2[nH+]1 ZINC001175750420 1048434390 /nfs/dbraw/zinc/43/43/90/1048434390.db2.gz VNVGPGJKKWSCRJ-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO c1c[nH+]c(Nc2ccc3ccncc3c2)c(N2CCCCC2)c1 ZINC001175705118 1048436354 /nfs/dbraw/zinc/43/63/54/1048436354.db2.gz SJRMILUNCPSJBU-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cnc3ccc(F)cc3c2)c[nH+]1 ZINC001175710679 1048437600 /nfs/dbraw/zinc/43/76/00/1048437600.db2.gz IXFSEZAEODOAIX-UHFFFAOYSA-N 1 2 322.265 4.114 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cncc(C3CCC3)c2)c[nH+]1 ZINC001175710846 1048437902 /nfs/dbraw/zinc/43/79/02/1048437902.db2.gz LOJNGXRNSBBILL-UHFFFAOYSA-N 1 2 308.307 4.089 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc3c(s2)CCCC3)c[nH+]1 ZINC001175711470 1048437973 /nfs/dbraw/zinc/43/79/73/1048437973.db2.gz XQECBYRNEZRIFH-UHFFFAOYSA-N 1 2 313.348 4.367 20 0 DIADLO CC(=O)Nc1ccc(Nc2cc(C)c[nH+]c2C)c(C(F)(F)F)c1 ZINC001203668109 1048439654 /nfs/dbraw/zinc/43/96/54/1048439654.db2.gz UONKXODGLTVMDE-UHFFFAOYSA-N 1 2 323.318 4.419 20 0 DIADLO CCCCc1ccc(NC(=O)NCc2c[nH+]cn2C(C)C)cc1 ZINC001187749103 1048440524 /nfs/dbraw/zinc/44/05/24/1048440524.db2.gz NUUMRIMZXMIPKP-UHFFFAOYSA-N 1 2 314.433 4.128 20 0 DIADLO Cc1cc(NC[C@H]2C[C@H]2Cc2ccccc2)nc(C2CCC2)[nH+]1 ZINC001187898311 1048447969 /nfs/dbraw/zinc/44/79/69/1048447969.db2.gz ZSZYMWOOBHOTPR-QZTJIDSGSA-N 1 2 307.441 4.343 20 0 DIADLO COc1c(F)cccc1[C@@H](C)Nc1cc(C)[nH+]c(C(C)(C)C)n1 ZINC001163340824 1048457402 /nfs/dbraw/zinc/45/74/02/1048457402.db2.gz MTMAWXXXOXQTGX-GFCCVEGCSA-N 1 2 317.408 4.403 20 0 DIADLO Cc1cc(N2CCC[C@H]2COc2ccccc2)nc(C2CCC2)[nH+]1 ZINC001163346965 1048459005 /nfs/dbraw/zinc/45/90/05/1048459005.db2.gz OUMCMCJESKQFJV-KRWDZBQOSA-N 1 2 323.440 4.100 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc4c(c3)OCCN4C)ccc12 ZINC001213045684 1048459660 /nfs/dbraw/zinc/45/96/60/1048459660.db2.gz UMQFYWOWSLMLDZ-UHFFFAOYSA-N 1 2 305.381 4.115 20 0 DIADLO COc1cnccc1[C@H](Nc1cc2ccccc2c[nH+]1)C1CC1 ZINC001163397617 1048466685 /nfs/dbraw/zinc/46/66/85/1048466685.db2.gz QJRKYNHKZSEBBF-LJQANCHMSA-N 1 2 305.381 4.202 20 0 DIADLO COc1cc(Nc2cccnc2OCc2ccccc2)[nH+]cc1C ZINC001175876692 1048467915 /nfs/dbraw/zinc/46/79/15/1048467915.db2.gz JQNWJZGPCPRKJK-UHFFFAOYSA-N 1 2 321.380 4.116 20 0 DIADLO C[C@H](Nc1cc(SCc2ccccc2)cc[nH+]1)[C@@H]1CCCO1 ZINC001163480706 1048475408 /nfs/dbraw/zinc/47/54/08/1048475408.db2.gz XOEOUPSJFKXZEY-YOEHRIQHSA-N 1 2 314.454 4.353 20 0 DIADLO c1oc(-c2ccccc2)nc1C[N@@H+]1Cc2ccccc2C2(CC2)C1 ZINC000481760206 1048475522 /nfs/dbraw/zinc/47/55/22/1048475522.db2.gz ZAJSQFCGLICZKN-UHFFFAOYSA-N 1 2 316.404 4.389 20 0 DIADLO c1oc(-c2ccccc2)nc1C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000481760206 1048475529 /nfs/dbraw/zinc/47/55/29/1048475529.db2.gz ZAJSQFCGLICZKN-UHFFFAOYSA-N 1 2 316.404 4.389 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2Cc3ccccc3C3(CC3)C2)n1 ZINC000481756270 1048476743 /nfs/dbraw/zinc/47/67/43/1048476743.db2.gz MUGGAWDRSUZLBZ-UHFFFAOYSA-N 1 2 309.457 4.292 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2Cc3ccccc3C3(CC3)C2)n1 ZINC000481756270 1048476750 /nfs/dbraw/zinc/47/67/50/1048476750.db2.gz MUGGAWDRSUZLBZ-UHFFFAOYSA-N 1 2 309.457 4.292 20 0 DIADLO Cc1cccc(C)c1NC(=O)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001202208334 1048482428 /nfs/dbraw/zinc/48/24/28/1048482428.db2.gz RILLGZVMAVXHKF-UHFFFAOYSA-N 1 2 320.396 4.192 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@H](C(F)(F)F)CC1 ZINC001175873066 1048487010 /nfs/dbraw/zinc/48/70/10/1048487010.db2.gz MCNVJDSYTZHWQQ-KGLIPLIRSA-N 1 2 323.305 4.069 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@H+]1CCO[C@H](C(F)(F)F)CC1 ZINC001175873066 1048487018 /nfs/dbraw/zinc/48/70/18/1048487018.db2.gz MCNVJDSYTZHWQQ-KGLIPLIRSA-N 1 2 323.305 4.069 20 0 DIADLO CCN(Cc1ccncc1)c1cc(C2CCCCC2)[nH+]c(C)n1 ZINC001163609236 1048495020 /nfs/dbraw/zinc/49/50/20/1048495020.db2.gz HBUMIFJNTKHWPV-UHFFFAOYSA-N 1 2 310.445 4.254 20 0 DIADLO Cc1ccc(Cl)c(CNc2ccc3[nH+]cn(C)c3c2)c1F ZINC001163655153 1048498306 /nfs/dbraw/zinc/49/83/06/1048498306.db2.gz CKUVHPNXMOODHW-UHFFFAOYSA-N 1 2 303.768 4.286 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3cccc(Cl)c3F)ccc2[nH+]1 ZINC001188386232 1048504579 /nfs/dbraw/zinc/50/45/79/1048504579.db2.gz XGWOGTMFHLJBRP-UHFFFAOYSA-N 1 2 318.739 4.079 20 0 DIADLO Cc1cc(C)cc(CNc2cc[nH+]c(OCc3ccccn3)c2)c1 ZINC001163753110 1048519136 /nfs/dbraw/zinc/51/91/36/1048519136.db2.gz LGDCDMBTLFMPJC-UHFFFAOYSA-N 1 2 319.408 4.285 20 0 DIADLO FC(F)(F)CC[N@@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001202346692 1048519926 /nfs/dbraw/zinc/51/99/26/1048519926.db2.gz RNPHGVOVQDFVEK-GFCCVEGCSA-N 1 2 309.784 4.382 20 0 DIADLO FC(F)(F)CC[N@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001202346692 1048519941 /nfs/dbraw/zinc/51/99/41/1048519941.db2.gz RNPHGVOVQDFVEK-GFCCVEGCSA-N 1 2 309.784 4.382 20 0 DIADLO COc1ccccc1[C@@H]1CCN(c2ccc(C(C)(C)C)c[nH+]2)C1 ZINC001163811229 1048528788 /nfs/dbraw/zinc/52/87/88/1048528788.db2.gz JKJOIZOARJEMPI-OAHLLOKOSA-N 1 2 310.441 4.382 20 0 DIADLO CCc1nc(N2CCC[C@]2(C)Cc2ccc(C)cc2)cc(C)[nH+]1 ZINC001163837701 1048533872 /nfs/dbraw/zinc/53/38/72/1048533872.db2.gz LENBULMZPFOHIT-HXUWFJFHSA-N 1 2 309.457 4.257 20 0 DIADLO Cc1cc(Cl)nnc1NC(=[NH2+])C12CC3CC(CC(C3)C1)C2 ZINC001163839568 1048534395 /nfs/dbraw/zinc/53/43/95/1048534395.db2.gz MGEPNJFSQVVXAI-UHFFFAOYSA-N 1 2 304.825 4.044 20 0 DIADLO Cc1ncc(Cl)nc1NC(=[NH2+])C12CC3CC(CC(C3)C1)C2 ZINC001163841781 1048536300 /nfs/dbraw/zinc/53/63/00/1048536300.db2.gz VPQGVGKRIOSDSO-UHFFFAOYSA-N 1 2 304.825 4.044 20 0 DIADLO CCNc1cc(CNc2nc3c(cc(C)cc3C)s2)cc[nH+]1 ZINC001163861401 1048540053 /nfs/dbraw/zinc/54/00/53/1048540053.db2.gz PJJOKLNMLCROEY-UHFFFAOYSA-N 1 2 312.442 4.352 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3cc(Cl)ccc3C)ccc2[nH+]1 ZINC001188703674 1048543143 /nfs/dbraw/zinc/54/31/43/1048543143.db2.gz XTZYQVCSUNNIKY-UHFFFAOYSA-N 1 2 314.776 4.249 20 0 DIADLO COc1cccc2c(NCc3cc4ccccc4n3C)cc[nH+]c12 ZINC001163946952 1048555352 /nfs/dbraw/zinc/55/53/52/1048555352.db2.gz RBESHVYIBWZSIV-UHFFFAOYSA-N 1 2 317.392 4.347 20 0 DIADLO COc1cccc2[nH]c(Nc3ccc(N4CCCCC4)[nH+]c3)cc21 ZINC001176062299 1048558940 /nfs/dbraw/zinc/55/89/40/1048558940.db2.gz UHKWSAPPGILQMF-UHFFFAOYSA-N 1 2 322.412 4.305 20 0 DIADLO O=C(Nc1cccc2ccccc21)Nc1cccc2[nH+]ccn21 ZINC001188906739 1048566532 /nfs/dbraw/zinc/56/65/32/1048566532.db2.gz XITJICQSZZAOQK-UHFFFAOYSA-N 1 2 302.337 4.132 20 0 DIADLO Cc1ccc2ccc(F)c(Nc3ccc(N4CCCC4)[nH+]c3)c2n1 ZINC001176115916 1048571443 /nfs/dbraw/zinc/57/14/43/1048571443.db2.gz SODVIAGCJPPAQS-UHFFFAOYSA-N 1 2 322.387 4.421 20 0 DIADLO Cc1ccc2ccc(F)c(Nc3ccc4c(c3)[nH+]cn4C)c2n1 ZINC001176117324 1048574632 /nfs/dbraw/zinc/57/46/32/1048574632.db2.gz PWCZTQCRHXKRJQ-UHFFFAOYSA-N 1 2 306.344 4.313 20 0 DIADLO Cc1cc2cc(N[C@H](c3ccccc3)c3ccncc3)[nH+]cc2[nH]1 ZINC001164069005 1048575447 /nfs/dbraw/zinc/57/54/47/1048575447.db2.gz QTNCSJBXYMVGGX-HXUWFJFHSA-N 1 2 314.392 4.468 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(C(F)(F)F)c2ncccc12 ZINC001176125009 1048575979 /nfs/dbraw/zinc/57/59/79/1048575979.db2.gz WMDAESMGMXKLRT-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO COc1cc[nH+]cc1Nc1cccc(NC(=O)OC(C)(C)C)c1 ZINC001176123478 1048577083 /nfs/dbraw/zinc/57/70/83/1048577083.db2.gz VSVSYWSOWKSSDP-UHFFFAOYSA-N 1 2 315.373 4.181 20 0 DIADLO CC(C)C[C@H](C(=O)N1CCC[C@@H]1CC1CCCC1)n1cc[nH+]c1 ZINC001164104816 1048582732 /nfs/dbraw/zinc/58/27/32/1048582732.db2.gz KHXCTBWMLWEJMK-QZTJIDSGSA-N 1 2 317.477 4.042 20 0 DIADLO CCN(C)c1cc(N[C@@H](C)c2ccc3ccccc3c2)[nH+]cn1 ZINC001164144838 1048591342 /nfs/dbraw/zinc/59/13/42/1048591342.db2.gz IEQHWMNCPORWBC-AWEZNQCLSA-N 1 2 306.413 4.259 20 0 DIADLO CCN(C)c1cc(N[C@@H](C)c2ccc3ccccc3c2)nc[nH+]1 ZINC001164144838 1048591354 /nfs/dbraw/zinc/59/13/54/1048591354.db2.gz IEQHWMNCPORWBC-AWEZNQCLSA-N 1 2 306.413 4.259 20 0 DIADLO CCc1cc(N[C@H](CC)c2cc(F)ccc2OC)nc(CC)[nH+]1 ZINC001164182951 1048599509 /nfs/dbraw/zinc/59/95/09/1048599509.db2.gz WQOIRHWUAHPSRL-OAHLLOKOSA-N 1 2 317.408 4.312 20 0 DIADLO Cc1cc(N[C@@H](c2cccnc2)C(F)(F)F)ccc1[NH+](C)C ZINC001164184232 1048600972 /nfs/dbraw/zinc/60/09/72/1048600972.db2.gz URDVRARNNLXOBI-HNNXBMFYSA-N 1 2 309.335 4.172 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)Nc1cccc(Cl)c1Cl ZINC001189202153 1048601733 /nfs/dbraw/zinc/60/17/33/1048601733.db2.gz OWTHUJFINGXZIR-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO COc1ccc(CCC[NH2+]c2ccc(OC)c3cc[nH]c32)cc1 ZINC001164192636 1048602982 /nfs/dbraw/zinc/60/29/82/1048602982.db2.gz YVECZSSDQQPGJM-UHFFFAOYSA-N 1 2 310.397 4.230 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)Cc3cccc(C)c3)cc2)[nH+]c1C ZINC001176209759 1048605628 /nfs/dbraw/zinc/60/56/28/1048605628.db2.gz ASKPDXLLPKBQLU-UHFFFAOYSA-N 1 2 319.408 4.183 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000482486361 1048615722 /nfs/dbraw/zinc/61/57/22/1048615722.db2.gz MNGDSJCWVDOOSK-SCZZXKLOSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000482486361 1048615730 /nfs/dbraw/zinc/61/57/30/1048615730.db2.gz MNGDSJCWVDOOSK-SCZZXKLOSA-N 1 2 311.269 4.267 20 0 DIADLO Cc1cn2cccc(Nc3ccc(O)cc3C(F)(F)F)c2[nH+]1 ZINC001176339639 1048632667 /nfs/dbraw/zinc/63/26/67/1048632667.db2.gz MFJCEEIAYAVLHL-UHFFFAOYSA-N 1 2 307.275 4.111 20 0 DIADLO Cc1[nH]c(CNc2ccc(OCCC(C)C)c(F)c2)[nH+]c1C ZINC000850338448 1048633685 /nfs/dbraw/zinc/63/36/85/1048633685.db2.gz HTFOITASAIIXDA-UHFFFAOYSA-N 1 2 305.397 4.203 20 0 DIADLO Cc1ccc(Nc2ccc(OCc3ccccc3)nc2)c(C)[nH+]1 ZINC001176301728 1048639147 /nfs/dbraw/zinc/63/91/47/1048639147.db2.gz SXMFIDKOAIDCPC-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO COc1c(Cl)cc(Nc2[nH+]cccc2N(C)C)cc1Cl ZINC001176308590 1048644012 /nfs/dbraw/zinc/64/40/12/1048644012.db2.gz CHVZPPXGACIKBZ-UHFFFAOYSA-N 1 2 312.200 4.207 20 0 DIADLO Cc1cccc2c(C)cc(N3CCC(OC4CCC4)CC3)[nH+]c12 ZINC001164571787 1048645210 /nfs/dbraw/zinc/64/52/10/1048645210.db2.gz ROVMDSBXEXYHHC-UHFFFAOYSA-N 1 2 310.441 4.390 20 0 DIADLO Cc1cc(C[NH2+][C@@H](CO)c2cccc(Cl)c2Cl)c(C)o1 ZINC000850402802 1048647995 /nfs/dbraw/zinc/64/79/95/1048647995.db2.gz XNTXVBUPIVZPTQ-AWEZNQCLSA-N 1 2 314.212 4.026 20 0 DIADLO FC(F)(F)c1cccc2cc[nH+]c(NC[C@H]3CCCCO3)c21 ZINC001164670772 1048653459 /nfs/dbraw/zinc/65/34/59/1048653459.db2.gz AKHRVYAHCFUWNR-GFCCVEGCSA-N 1 2 310.319 4.235 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Oc2ccc(F)cc2)ccn1)c1ccco1 ZINC000482749370 1048670960 /nfs/dbraw/zinc/67/09/60/1048670960.db2.gz ZJDXWAKXRPCDAK-ZDUSSCGKSA-N 1 2 312.344 4.457 20 0 DIADLO Cc1cc(N2CCC3(C=Cc4ccccc43)CC2)nc(C(C)C)[nH+]1 ZINC001165337504 1048684837 /nfs/dbraw/zinc/68/48/37/1048684837.db2.gz PWGJOIPREHYPMJ-UHFFFAOYSA-N 1 2 319.452 4.473 20 0 DIADLO Cc1ccc(-c2cc[nH+]c(NCCCc3ccncc3)c2)cc1 ZINC001165500446 1048694957 /nfs/dbraw/zinc/69/49/57/1048694957.db2.gz ZFWKSECAZZQFGM-UHFFFAOYSA-N 1 2 303.409 4.497 20 0 DIADLO Cc1ccc2[nH+]c(CSC[C@@H]3CC3(Cl)Cl)cn2c1 ZINC001165544599 1048696268 /nfs/dbraw/zinc/69/62/68/1048696268.db2.gz BUBCJUOBOFMJRG-JTQLQIEISA-N 1 2 301.242 4.070 20 0 DIADLO CCc1cccc(Nc2ccc(F)c(C(=O)N(CC)CC)c2)[nH+]1 ZINC001176516480 1048703974 /nfs/dbraw/zinc/70/39/74/1048703974.db2.gz HPVKUDJAJCMOJC-UHFFFAOYSA-N 1 2 315.392 4.009 20 0 DIADLO Fc1cccc(-c2cnc(C[N@@H+]3CC[C@@H]3c3ccccc3)o2)c1 ZINC000482949790 1048707207 /nfs/dbraw/zinc/70/72/07/1048707207.db2.gz RREBZUDMADFUFW-QGZVFWFLSA-N 1 2 308.356 4.428 20 0 DIADLO Fc1cccc(-c2cnc(C[N@H+]3CC[C@@H]3c3ccccc3)o2)c1 ZINC000482949790 1048707221 /nfs/dbraw/zinc/70/72/21/1048707221.db2.gz RREBZUDMADFUFW-QGZVFWFLSA-N 1 2 308.356 4.428 20 0 DIADLO Cc1sc(NC(=O)C[N@@H+]2CC[C@H]2c2ccccc2)c(C)c1C ZINC000482950347 1048707486 /nfs/dbraw/zinc/70/74/86/1048707486.db2.gz SIAAZTCOSVYMKW-INIZCTEOSA-N 1 2 314.454 4.059 20 0 DIADLO Cc1sc(NC(=O)C[N@H+]2CC[C@H]2c2ccccc2)c(C)c1C ZINC000482950347 1048707499 /nfs/dbraw/zinc/70/74/99/1048707499.db2.gz SIAAZTCOSVYMKW-INIZCTEOSA-N 1 2 314.454 4.059 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3CC(C)(C)[C@H]3c3cccnc3)cc21 ZINC000668184741 1048718712 /nfs/dbraw/zinc/71/87/12/1048718712.db2.gz PEBTYBOUYTVJMK-LJQANCHMSA-N 1 2 305.425 4.454 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3CC(C)(C)[C@H]3c3cccnc3)cc21 ZINC000668184741 1048718722 /nfs/dbraw/zinc/71/87/22/1048718722.db2.gz PEBTYBOUYTVJMK-LJQANCHMSA-N 1 2 305.425 4.454 20 0 DIADLO COc1cccc([C@@H](C)SCc2cc(OC)cc(C)[nH+]2)c1 ZINC001165816527 1048720147 /nfs/dbraw/zinc/72/01/47/1048720147.db2.gz JUOVKKZWEBPYGX-CYBMUJFWSA-N 1 2 303.427 4.402 20 0 DIADLO COc1cc(Nc2ccc([NH+]3CCCCC3)cc2)cnc1Cl ZINC001203718994 1048721478 /nfs/dbraw/zinc/72/14/78/1048721478.db2.gz OJAIYVCVMRRZOF-UHFFFAOYSA-N 1 2 317.820 4.478 20 0 DIADLO CC[N@H+](CC(=O)c1ccccc1F)Cc1cccc(Cl)c1 ZINC001190367254 1048728161 /nfs/dbraw/zinc/72/81/61/1048728161.db2.gz XJDOBHNNEADRDM-UHFFFAOYSA-N 1 2 305.780 4.184 20 0 DIADLO CC[N@@H+](CC(=O)c1ccccc1F)Cc1cccc(Cl)c1 ZINC001190367254 1048728175 /nfs/dbraw/zinc/72/81/75/1048728175.db2.gz XJDOBHNNEADRDM-UHFFFAOYSA-N 1 2 305.780 4.184 20 0 DIADLO Cn1cc(Nc2cccc3cc[nH+]cc32)c(-c2ccccc2)n1 ZINC001176568816 1048728915 /nfs/dbraw/zinc/72/89/15/1048728915.db2.gz CNRIEVBEHYWOBK-UHFFFAOYSA-N 1 2 300.365 4.379 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cn(C)nc2-c2ccccc2)cc1 ZINC001176570253 1048731136 /nfs/dbraw/zinc/73/11/36/1048731136.db2.gz OZWMMTWQUAZHOI-UHFFFAOYSA-N 1 2 306.413 4.287 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cn(C)nc2-c2ccccc2)cc1 ZINC001176570253 1048731143 /nfs/dbraw/zinc/73/11/43/1048731143.db2.gz OZWMMTWQUAZHOI-UHFFFAOYSA-N 1 2 306.413 4.287 20 0 DIADLO CC(C)c1nnc(C[NH+]2CCC(CC3CCCCC3)CC2)[nH]1 ZINC001176579431 1048734403 /nfs/dbraw/zinc/73/44/03/1048734403.db2.gz VMOVKDKSQMPTGV-UHFFFAOYSA-N 1 2 304.482 4.111 20 0 DIADLO FC(F)(F)Oc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1 ZINC001176640058 1048743298 /nfs/dbraw/zinc/74/32/98/1048743298.db2.gz KCYHEWZBRWGTCR-UHFFFAOYSA-N 1 2 323.318 4.324 20 0 DIADLO CC(C)c1ccc(N2CCC3(CC(OCC4CC4)C3)CC2)[nH+]c1 ZINC001166373754 1048747827 /nfs/dbraw/zinc/74/78/27/1048747827.db2.gz WXEONFDIRAAPAI-UHFFFAOYSA-N 1 2 314.473 4.381 20 0 DIADLO c1ccc2c(c1)cc[nH+]c2N1CCC2(CC(OCC3CC3)C2)CC1 ZINC001166374429 1048748216 /nfs/dbraw/zinc/74/82/16/1048748216.db2.gz SRSBLUBYOZJHLQ-UHFFFAOYSA-N 1 2 322.452 4.410 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@H]2c2ccsc2)o1 ZINC000483173664 1048750682 /nfs/dbraw/zinc/75/06/82/1048750682.db2.gz OKPKEZMNZSUJDD-LBPRGKRZSA-N 1 2 312.232 4.441 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@H]2c2ccsc2)o1 ZINC000483173664 1048750696 /nfs/dbraw/zinc/75/06/96/1048750696.db2.gz OKPKEZMNZSUJDD-LBPRGKRZSA-N 1 2 312.232 4.441 20 0 DIADLO Clc1ccc([C@@H]2CCCCN2Cc2c[nH+]c3n2CCC3)cc1 ZINC000668223570 1048761510 /nfs/dbraw/zinc/76/15/10/1048761510.db2.gz KDZJFRYVZWZWNO-KRWDZBQOSA-N 1 2 315.848 4.210 20 0 DIADLO Cc1cccc2c(C)cc(N3CC[C@H](c4ccncc4)C3)[nH+]c12 ZINC001166570027 1048764158 /nfs/dbraw/zinc/76/41/58/1048764158.db2.gz WDIWZVSLDWTSQV-KRWDZBQOSA-N 1 2 303.409 4.241 20 0 DIADLO FC(F)(F)c1ccc(C=CNc2cccc3[nH+]ccn32)cc1 ZINC001176659934 1048764931 /nfs/dbraw/zinc/76/49/31/1048764931.db2.gz AZBQAFTZSYHLLW-CMDGGOBGSA-N 1 2 303.287 4.436 20 0 DIADLO Cc1cc(-c2noc(C[N@@H+]3CC[C@@H]3c3ccccc3)n2)ccc1F ZINC000483232306 1048765184 /nfs/dbraw/zinc/76/51/84/1048765184.db2.gz GXMXQBBEGNVOBK-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cc(-c2noc(C[N@H+]3CC[C@@H]3c3ccccc3)n2)ccc1F ZINC000483232306 1048765198 /nfs/dbraw/zinc/76/51/98/1048765198.db2.gz GXMXQBBEGNVOBK-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO CC[N@H+](Cc1cc(C(F)(F)F)co1)Cc1ccccc1F ZINC001190628479 1048770264 /nfs/dbraw/zinc/77/02/64/1048770264.db2.gz ZOEKGNRMGHWYHO-UHFFFAOYSA-N 1 2 301.283 4.460 20 0 DIADLO CC[N@@H+](Cc1cc(C(F)(F)F)co1)Cc1ccccc1F ZINC001190628479 1048770279 /nfs/dbraw/zinc/77/02/79/1048770279.db2.gz ZOEKGNRMGHWYHO-UHFFFAOYSA-N 1 2 301.283 4.460 20 0 DIADLO C[C@@H]1CN(c2ccc(Nc3ccc(Cl)cc3)c[nH+]2)C[C@H](C)O1 ZINC001176726552 1048772347 /nfs/dbraw/zinc/77/23/47/1048772347.db2.gz WSINLDHBEWISFM-BETUJISGSA-N 1 2 317.820 4.092 20 0 DIADLO Cc1ccc(-c2cc(Nc3ccc[nH+]c3N3CCCC3)on2)cc1 ZINC001176742946 1048775379 /nfs/dbraw/zinc/77/53/79/1048775379.db2.gz FGZLJYHZYGXQES-UHFFFAOYSA-N 1 2 320.396 4.389 20 0 DIADLO CC1(CC(F)(F)F)C[NH+](Cc2cccc(OC3CC3)c2F)C1 ZINC000668234043 1048776442 /nfs/dbraw/zinc/77/64/42/1048776442.db2.gz XRYOOEYPCOLMIE-UHFFFAOYSA-N 1 2 317.326 4.141 20 0 DIADLO c1ccc(-c2cccc(Nc3ccc[nH+]c3N3CCCC3)n2)cc1 ZINC001176749274 1048777355 /nfs/dbraw/zinc/77/73/55/1048777355.db2.gz BBNQBEUVYYQICZ-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO CCC1(C)CC[NH+]([C@H](C(=O)OC)c2ccccc2Cl)CC1 ZINC001190692262 1048777429 /nfs/dbraw/zinc/77/74/29/1048777429.db2.gz URJRJHZKCNLXKL-HNNXBMFYSA-N 1 2 309.837 4.066 20 0 DIADLO Fc1ccc2ncc(Nc3ccc[nH+]c3N3CCCC3)cc2c1 ZINC001176750505 1048778879 /nfs/dbraw/zinc/77/88/79/1048778879.db2.gz WSHJAZFJVXCHFM-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO CC(C)(C)c1csc(Nc2ccc[nH+]c2N2CCCC2)n1 ZINC001176744365 1048779052 /nfs/dbraw/zinc/77/90/52/1048779052.db2.gz VDGHHIYQMKWEOG-UHFFFAOYSA-N 1 2 302.447 4.179 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccnn2Cc2ccccc2)cc1 ZINC001176706928 1048782132 /nfs/dbraw/zinc/78/21/32/1048782132.db2.gz BVDARTILMUADDG-UHFFFAOYSA-N 1 2 306.413 4.131 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccnn2Cc2ccccc2)cc1 ZINC001176706928 1048782142 /nfs/dbraw/zinc/78/21/42/1048782142.db2.gz BVDARTILMUADDG-UHFFFAOYSA-N 1 2 306.413 4.131 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H](F)C2)cc1SC(F)(F)F ZINC001176805018 1048789819 /nfs/dbraw/zinc/78/98/19/1048789819.db2.gz VJUNRVCCLWKSFJ-LLVKDONJSA-N 1 2 323.355 4.241 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H](F)C2)cc1SC(F)(F)F ZINC001176805018 1048789835 /nfs/dbraw/zinc/78/98/35/1048789835.db2.gz VJUNRVCCLWKSFJ-LLVKDONJSA-N 1 2 323.355 4.241 20 0 DIADLO CC(C)c1cccc(C[N@H+](C)Cc2nc3ccccc3c(=O)[nH]2)c1 ZINC000851725002 1048794606 /nfs/dbraw/zinc/79/46/06/1048794606.db2.gz PDRYTHZOVDYFHI-UHFFFAOYSA-N 1 2 321.424 4.091 20 0 DIADLO CC(C)c1cccc(C[N@@H+](C)Cc2nc3ccccc3c(=O)[nH]2)c1 ZINC000851725002 1048794619 /nfs/dbraw/zinc/79/46/19/1048794619.db2.gz PDRYTHZOVDYFHI-UHFFFAOYSA-N 1 2 321.424 4.091 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cccc(F)n2)C2CC2)o1 ZINC000851711802 1048795745 /nfs/dbraw/zinc/79/57/45/1048795745.db2.gz GIGFZIUAEAXHMD-WBMJQRKESA-N 1 2 300.377 4.102 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cccc(F)n2)C2CC2)o1 ZINC000851711802 1048795755 /nfs/dbraw/zinc/79/57/55/1048795755.db2.gz GIGFZIUAEAXHMD-WBMJQRKESA-N 1 2 300.377 4.102 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2cccc(F)n2)C2CC2)o1 ZINC000851711796 1048796224 /nfs/dbraw/zinc/79/62/24/1048796224.db2.gz GIGFZIUAEAXHMD-BLLLJJGKSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cccc(F)n2)C2CC2)o1 ZINC000851711796 1048796240 /nfs/dbraw/zinc/79/62/40/1048796240.db2.gz GIGFZIUAEAXHMD-BLLLJJGKSA-N 1 2 300.377 4.102 20 0 DIADLO CCc1cnc(C[N@@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)s1 ZINC000483434037 1048798033 /nfs/dbraw/zinc/79/80/33/1048798033.db2.gz OEMLAULTLLFDKO-NSHDSACASA-N 1 2 306.397 4.116 20 0 DIADLO CCc1cnc(C[N@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)s1 ZINC000483434037 1048798040 /nfs/dbraw/zinc/79/80/40/1048798040.db2.gz OEMLAULTLLFDKO-NSHDSACASA-N 1 2 306.397 4.116 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2cc(C3CC3)no2)cc1F ZINC000851770795 1048800912 /nfs/dbraw/zinc/80/09/12/1048800912.db2.gz UJSZQLWTSGMUKM-QGZVFWFLSA-N 1 2 304.340 4.167 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2cc(C3CC3)no2)cc1F ZINC000851770795 1048800928 /nfs/dbraw/zinc/80/09/28/1048800928.db2.gz UJSZQLWTSGMUKM-QGZVFWFLSA-N 1 2 304.340 4.167 20 0 DIADLO CC[N@H+](C[C@H]1CCCN(C(=O)C(C)(C)C)C1)c1ccc(C)cc1 ZINC000851827656 1048803432 /nfs/dbraw/zinc/80/34/32/1048803432.db2.gz HNNKWLRVZGKCOT-QGZVFWFLSA-N 1 2 316.489 4.106 20 0 DIADLO CC[N@@H+](C[C@H]1CCCN(C(=O)C(C)(C)C)C1)c1ccc(C)cc1 ZINC000851827656 1048803456 /nfs/dbraw/zinc/80/34/56/1048803456.db2.gz HNNKWLRVZGKCOT-QGZVFWFLSA-N 1 2 316.489 4.106 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@@H+]1CCOC2(CCCC2)C1 ZINC000483490002 1048804778 /nfs/dbraw/zinc/80/47/78/1048804778.db2.gz HNHBYVMZFSQBQJ-ZDUSSCGKSA-N 1 2 324.262 4.155 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@H+]1CCOC2(CCCC2)C1 ZINC000483490002 1048804802 /nfs/dbraw/zinc/80/48/02/1048804802.db2.gz HNHBYVMZFSQBQJ-ZDUSSCGKSA-N 1 2 324.262 4.155 20 0 DIADLO Cc1cccnc1[C@H](C)[NH2+]Cc1c(F)cccc1Br ZINC001176896461 1048805927 /nfs/dbraw/zinc/80/59/27/1048805927.db2.gz GIUPQNPBMNSRGI-NSHDSACASA-N 1 2 323.209 4.142 20 0 DIADLO Cc1cc(C[N@@H+]2CCSC[C@H]2c2ccc(Cl)cc2)ccn1 ZINC001190953542 1048816279 /nfs/dbraw/zinc/81/62/79/1048816279.db2.gz FCTWSNFXKNOIAT-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(C[N@H+]2CCSC[C@H]2c2ccc(Cl)cc2)ccn1 ZINC001190953542 1048816289 /nfs/dbraw/zinc/81/62/89/1048816289.db2.gz FCTWSNFXKNOIAT-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Fc1cc2[nH]ccc2c(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001203732851 1048829098 /nfs/dbraw/zinc/82/90/98/1048829098.db2.gz ASOUPCNMTQYOHI-UHFFFAOYSA-N 1 2 306.344 4.295 20 0 DIADLO CSCc1cc[nH+]c(N(C)Cc2csc(C(C)C)n2)c1 ZINC001167009397 1048830363 /nfs/dbraw/zinc/83/03/63/1048830363.db2.gz SFIRXUOMEDLVCL-UHFFFAOYSA-N 1 2 307.488 4.161 20 0 DIADLO C[C@@H](Oc1ccc([C@H](C)[NH2+]Cc2cnon2)cc1)c1ccccc1 ZINC000852441189 1048842806 /nfs/dbraw/zinc/84/28/06/1048842806.db2.gz YBTZJIDDRVVVDG-LSDHHAIUSA-N 1 2 323.396 4.060 20 0 DIADLO CCCCCC[N@@H+]1CCC[C@H]1c1nccc(C(F)(F)F)n1 ZINC000852476755 1048844742 /nfs/dbraw/zinc/84/47/42/1048844742.db2.gz NUEYHNAXQQYIGQ-LBPRGKRZSA-N 1 2 301.356 4.213 20 0 DIADLO CCCCCC[N@H+]1CCC[C@H]1c1nccc(C(F)(F)F)n1 ZINC000852476755 1048844752 /nfs/dbraw/zinc/84/47/52/1048844752.db2.gz NUEYHNAXQQYIGQ-LBPRGKRZSA-N 1 2 301.356 4.213 20 0 DIADLO CCc1ccccc1C[NH2+][C@H](c1nccn1C)c1ccc(F)cc1 ZINC001177191146 1048848026 /nfs/dbraw/zinc/84/80/26/1048848026.db2.gz LTPGYPPVLVCHRX-IBGZPJMESA-N 1 2 323.415 4.001 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc2c(c1)CCCO2 ZINC000852782661 1048862242 /nfs/dbraw/zinc/86/22/42/1048862242.db2.gz LLCFSNXDBWNAIW-ZDUSSCGKSA-N 1 2 314.429 4.148 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@@H](C)c3cc4ccccc4o3)[nH]c2c1 ZINC000483839634 1048870403 /nfs/dbraw/zinc/87/04/03/1048870403.db2.gz KCOSJLIYVGFTDY-ZDUSSCGKSA-N 1 2 305.381 4.468 20 0 DIADLO CC(C)n1c[nH+]cc1CNC(=O)Nc1ccc(C(C)(C)C)cc1 ZINC001191166644 1048872874 /nfs/dbraw/zinc/87/28/74/1048872874.db2.gz VULHGOANWZXRFA-UHFFFAOYSA-N 1 2 314.433 4.083 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+][C@@H](C)c3cc(F)c(F)c(F)c3)nc2c1 ZINC000483853543 1048878595 /nfs/dbraw/zinc/87/85/95/1048878595.db2.gz OFLXYXMUPMVOTN-JTQLQIEISA-N 1 2 319.330 4.139 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@@H](C)c3cc(F)c(F)c(F)c3)[nH]c2c1 ZINC000483853543 1048878620 /nfs/dbraw/zinc/87/86/20/1048878620.db2.gz OFLXYXMUPMVOTN-JTQLQIEISA-N 1 2 319.330 4.139 20 0 DIADLO Cc1ccc(-c2ccc(C(=O)Nc3ccn4cc[nH+]c4c3)cc2)o1 ZINC001191197273 1048881012 /nfs/dbraw/zinc/88/10/12/1048881012.db2.gz WVQGZFQXEVVZJM-UHFFFAOYSA-N 1 2 317.348 4.155 20 0 DIADLO Cc1ccc(Nc2cc(C(C)(C)C)nn2-c2cccnc2)c(C)[nH+]1 ZINC001203369326 1048882851 /nfs/dbraw/zinc/88/28/51/1048882851.db2.gz PEUJDOJODWFBHG-UHFFFAOYSA-N 1 2 321.428 4.320 20 0 DIADLO Fc1c(Cl)cccc1CNc1ccc(N2CCCCC2)c[nH+]1 ZINC001177403947 1048882928 /nfs/dbraw/zinc/88/29/28/1048882928.db2.gz LYNSABOXXKPRET-UHFFFAOYSA-N 1 2 319.811 4.477 20 0 DIADLO Cc1ccc(Nc2cc(Br)cc(C)c2N)c(C)[nH+]1 ZINC001203374720 1048886436 /nfs/dbraw/zinc/88/64/36/1048886436.db2.gz MQEILTUPXZBSMV-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO Cc1ccc(Nc2sc(-c3ccccc3)cc2C(N)=O)c(C)[nH+]1 ZINC001203370840 1048887016 /nfs/dbraw/zinc/88/70/16/1048887016.db2.gz WJLLXEYFSUGVKM-UHFFFAOYSA-N 1 2 323.421 4.269 20 0 DIADLO CCOC(=O)c1cnc2cccc(Nc3ccc(C)[nH+]c3C)c2c1 ZINC001203380518 1048888152 /nfs/dbraw/zinc/88/81/52/1048888152.db2.gz KFWGNLDZSQNBFY-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO CC[C@H](C)C[N@H+](C)Cn1nc(-c2cccs2)n(CC)c1=S ZINC000111165616 1048889416 /nfs/dbraw/zinc/88/94/16/1048889416.db2.gz FAPKIOYKJYGHKV-LBPRGKRZSA-N 1 2 324.519 4.098 20 0 DIADLO CC[C@H](C)C[N@@H+](C)Cn1nc(-c2cccs2)n(CC)c1=S ZINC000111165616 1048889435 /nfs/dbraw/zinc/88/94/35/1048889435.db2.gz FAPKIOYKJYGHKV-LBPRGKRZSA-N 1 2 324.519 4.098 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1coc(-c3ccc(F)cc3)n1)C2 ZINC000483988365 1048890271 /nfs/dbraw/zinc/89/02/71/1048890271.db2.gz QZOWUNSWLJKPBJ-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1coc(-c3ccc(F)cc3)n1)C2 ZINC000483988365 1048890290 /nfs/dbraw/zinc/89/02/90/1048890290.db2.gz QZOWUNSWLJKPBJ-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO FC[C@@H]1C[N@H+](Cc2c(F)cccc2Cl)C[C@H]1C(F)(F)F ZINC001203399317 1048890862 /nfs/dbraw/zinc/89/08/62/1048890862.db2.gz TYFOVTLFADVIBO-PSASIEDQSA-N 1 2 313.697 4.059 20 0 DIADLO FC[C@@H]1C[N@@H+](Cc2c(F)cccc2Cl)C[C@H]1C(F)(F)F ZINC001203399317 1048890871 /nfs/dbraw/zinc/89/08/71/1048890871.db2.gz TYFOVTLFADVIBO-PSASIEDQSA-N 1 2 313.697 4.059 20 0 DIADLO CNc1ccc(Nc2cc(-c3ccccc3)nn2C(C)C)c[nH+]1 ZINC001203453142 1048906162 /nfs/dbraw/zinc/90/61/62/1048906162.db2.gz WROGMEXOLYUHMF-UHFFFAOYSA-N 1 2 307.401 4.311 20 0 DIADLO CNc1ccc(Nc2cc(OC(F)(F)F)c(F)cc2F)c[nH+]1 ZINC001203457801 1048906290 /nfs/dbraw/zinc/90/62/90/1048906290.db2.gz ALGYUGMHVXLGKZ-UHFFFAOYSA-N 1 2 319.233 4.044 20 0 DIADLO CNc1ccc(Nc2cc(C3CCC3)nn2-c2ccccc2)c[nH+]1 ZINC001203454971 1048906590 /nfs/dbraw/zinc/90/65/90/1048906590.db2.gz OMHHKPNOCDOWMQ-UHFFFAOYSA-N 1 2 319.412 4.320 20 0 DIADLO CNc1ccc(Nc2cc(F)c(C(F)(F)F)c(F)c2)c[nH+]1 ZINC001203462509 1048906641 /nfs/dbraw/zinc/90/66/41/1048906641.db2.gz VQNOQLGHHFGREM-UHFFFAOYSA-N 1 2 303.234 4.164 20 0 DIADLO CNc1ccc(Nc2c(N)cccc2OCc2ccccc2)c[nH+]1 ZINC001203459631 1048906696 /nfs/dbraw/zinc/90/66/96/1048906696.db2.gz MNKJQXFNGDPTSQ-UHFFFAOYSA-N 1 2 320.396 4.028 20 0 DIADLO CNc1ccc(Nc2cc(C(F)(F)F)c(Cl)cc2N)c[nH+]1 ZINC001203456300 1048907022 /nfs/dbraw/zinc/90/70/22/1048907022.db2.gz BLOCJROISIYOPM-UHFFFAOYSA-N 1 2 316.714 4.121 20 0 DIADLO CNc1ccc(Nc2ccc(C(=O)Nc3ccccc3)cc2)c[nH+]1 ZINC001203456517 1048907579 /nfs/dbraw/zinc/90/75/79/1048907579.db2.gz HVTZQURWMWHPDZ-UHFFFAOYSA-N 1 2 318.380 4.119 20 0 DIADLO CN(Cc1ccccc1)c1ccc(N(C)c2ccccc2N)c[nH+]1 ZINC001203518306 1048916466 /nfs/dbraw/zinc/91/64/66/1048916466.db2.gz BWNZXYJZBNMPKW-UHFFFAOYSA-N 1 2 318.424 4.068 20 0 DIADLO Cc1ccc(F)cc1NC(=O)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001191410983 1048940769 /nfs/dbraw/zinc/94/07/69/1048940769.db2.gz WQUIOYSHWBQRDQ-UHFFFAOYSA-N 1 2 324.359 4.023 20 0 DIADLO c1oc(-c2ccccc2)nc1C[NH2+][C@@H]1CSCc2ccccc21 ZINC001177779385 1048943346 /nfs/dbraw/zinc/94/33/46/1048943346.db2.gz GFYWCIOOXOTHRB-GOSISDBHSA-N 1 2 322.433 4.419 20 0 DIADLO Cc1cn2cccc(Nc3cccnc3-c3ccccc3)c2[nH+]1 ZINC001203647536 1048946297 /nfs/dbraw/zinc/94/62/97/1048946297.db2.gz OARCOOVUQAFWRQ-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2noc3cc(Br)ccc23)c1 ZINC001203654405 1048949980 /nfs/dbraw/zinc/94/99/80/1048949980.db2.gz IUDXIHINRLZPBL-UHFFFAOYSA-N 1 2 318.174 4.346 20 0 DIADLO Cc1cc(Nc2cc(C)c[nH+]c2C)n(Cc2cccc(F)c2)n1 ZINC001203657123 1048950914 /nfs/dbraw/zinc/95/09/14/1048950914.db2.gz JQRNDMJDCGPUFP-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cc(Cl)cc(Br)n2)c1 ZINC001203657500 1048951775 /nfs/dbraw/zinc/95/17/75/1048951775.db2.gz OHXTWKFJXQDDQV-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cccc([C@@H]3CN4C=CSC4=N3)c2)c1 ZINC001203667438 1048952838 /nfs/dbraw/zinc/95/28/38/1048952838.db2.gz LMQMJKAZQWBEPB-KRWDZBQOSA-N 1 2 322.437 4.373 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(C(=O)NC3CCCC3)cc2)c1 ZINC001203663016 1048955672 /nfs/dbraw/zinc/95/56/72/1048955672.db2.gz DQJJSCPPSQRWGL-UHFFFAOYSA-N 1 2 309.413 4.114 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(F)c(Br)c2O)c1 ZINC001203667488 1048957281 /nfs/dbraw/zinc/95/72/81/1048957281.db2.gz MPYPYSQDRJQBRT-UHFFFAOYSA-N 1 2 311.154 4.049 20 0 DIADLO Cc1ccccc1Oc1ccccc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001177925815 1048962077 /nfs/dbraw/zinc/96/20/77/1048962077.db2.gz RMNPKHODMCIOQN-OAHLLOKOSA-N 1 2 321.380 4.184 20 0 DIADLO F[C@H]1C[N@H+](Cc2ccccc2C(F)(F)F)CCCC1(F)F ZINC001203686567 1048962145 /nfs/dbraw/zinc/96/21/45/1048962145.db2.gz FLXIVRVHWKDUGG-LBPRGKRZSA-N 1 2 311.269 4.275 20 0 DIADLO F[C@H]1C[N@@H+](Cc2ccccc2C(F)(F)F)CCCC1(F)F ZINC001203686567 1048962162 /nfs/dbraw/zinc/96/21/62/1048962162.db2.gz FLXIVRVHWKDUGG-LBPRGKRZSA-N 1 2 311.269 4.275 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1ccc(OCC(F)(F)F)nc1 ZINC001203686901 1048963292 /nfs/dbraw/zinc/96/32/92/1048963292.db2.gz YMQOKBULLWTCJL-UHFFFAOYSA-N 1 2 311.307 4.032 20 0 DIADLO CCC[C@H](C)c1noc([C@@H]([NH3+])c2ccccc2C(F)(F)F)n1 ZINC000904090358 1048970657 /nfs/dbraw/zinc/97/06/57/1048970657.db2.gz WANWOUVORBLNAD-CABZTGNLSA-N 1 2 313.323 4.040 20 0 DIADLO COc1cccc(N(Cc2cc(OC)cc(C)[nH+]2)CC(C)C)c1 ZINC001191673028 1048973867 /nfs/dbraw/zinc/97/38/67/1048973867.db2.gz RDKZYELFEUEQTQ-UHFFFAOYSA-N 1 2 314.429 4.070 20 0 DIADLO c1coc(-c2nnc(Nc3ccc([NH+]4CCCCC4)cc3)o2)c1 ZINC001203713425 1048974113 /nfs/dbraw/zinc/97/41/13/1048974113.db2.gz ZWXZUKXLJYVIET-UHFFFAOYSA-N 1 2 310.357 4.064 20 0 DIADLO Oc1cc(Nc2ccc([NH+]3CCCCC3)cc2)cc(F)c1F ZINC001203718794 1048975871 /nfs/dbraw/zinc/97/58/71/1048975871.db2.gz AKNVJZGNWKMPDL-UHFFFAOYSA-N 1 2 304.340 4.404 20 0 DIADLO Cc1nc2c(C)cc(Nc3ccc([NH+]4CCCCC4)cc3)cn2n1 ZINC001203717946 1048976390 /nfs/dbraw/zinc/97/63/90/1048976390.db2.gz PDCKCLMFARJXKS-UHFFFAOYSA-N 1 2 321.428 4.080 20 0 DIADLO Cn1nc(C(C)(C)C)cc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203717633 1048976565 /nfs/dbraw/zinc/97/65/65/1048976565.db2.gz IMKHUEJFZFPIRM-UHFFFAOYSA-N 1 2 312.461 4.452 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nnc[nH]1)c1ccc(C2CCCCC2)cc1 ZINC001191664007 1048978256 /nfs/dbraw/zinc/97/82/56/1048978256.db2.gz IEMWBMHAVMCDMH-LJQANCHMSA-N 1 2 312.461 4.339 20 0 DIADLO Oc1cc(F)c(Nc2ccc([NH+]3CCCCC3)cc2)cc1F ZINC001203724618 1048980818 /nfs/dbraw/zinc/98/08/18/1048980818.db2.gz SKRXWRRXSGDRSK-UHFFFAOYSA-N 1 2 304.340 4.404 20 0 DIADLO OCc1cccc(F)c1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203724643 1048981401 /nfs/dbraw/zinc/98/14/01/1048981401.db2.gz UKDZQTMKIMOEBX-UHFFFAOYSA-N 1 2 300.377 4.052 20 0 DIADLO Oc1c(F)cc(F)cc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203724223 1048981455 /nfs/dbraw/zinc/98/14/55/1048981455.db2.gz JGACISPPLXTWEU-UHFFFAOYSA-N 1 2 304.340 4.404 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]CC(C)(C)c3ccccc3)cc2)CCO1 ZINC001178037474 1048983044 /nfs/dbraw/zinc/98/30/44/1048983044.db2.gz LUDFXYDUHPYTNO-QGZVFWFLSA-N 1 2 324.468 4.301 20 0 DIADLO CC(C)Oc1ccccc1CNc1ccc2c(c1)CCC[N@H+]2C ZINC001178114792 1048986954 /nfs/dbraw/zinc/98/69/54/1048986954.db2.gz UTCJWSWWTFHLQP-UHFFFAOYSA-N 1 2 310.441 4.468 20 0 DIADLO CC(C)Oc1ccccc1CNc1ccc2c(c1)CCC[N@@H+]2C ZINC001178114792 1048986964 /nfs/dbraw/zinc/98/69/64/1048986964.db2.gz UTCJWSWWTFHLQP-UHFFFAOYSA-N 1 2 310.441 4.468 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3ccccc3OCC3CC3)ccc21 ZINC001178114769 1048987307 /nfs/dbraw/zinc/98/73/07/1048987307.db2.gz SRDPRQMXZIHYED-UHFFFAOYSA-N 1 2 322.452 4.470 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3ccccc3OCC3CC3)ccc21 ZINC001178114769 1048987322 /nfs/dbraw/zinc/98/73/22/1048987322.db2.gz SRDPRQMXZIHYED-UHFFFAOYSA-N 1 2 322.452 4.470 20 0 DIADLO CCCn1c[nH+]cc1CNc1cc(-c2nc(C)co2)ccc1C ZINC001178081411 1048989405 /nfs/dbraw/zinc/98/94/05/1048989405.db2.gz VYEPGAKTYHBTOU-UHFFFAOYSA-N 1 2 310.401 4.177 20 0 DIADLO CN(CCCn1cc[nH+]c1)c1ccccc1Oc1ccccc1 ZINC001191731964 1048992242 /nfs/dbraw/zinc/99/22/42/1048992242.db2.gz ZJZFBSGWOLDJCD-UHFFFAOYSA-N 1 2 307.397 4.202 20 0 DIADLO CCN(CC)c1ccc(NCc2cccn2CCC(C)C)c[nH+]1 ZINC001178254077 1049003846 /nfs/dbraw/zinc/00/38/46/1049003846.db2.gz JGYSASLUVIGJIO-UHFFFAOYSA-N 1 2 314.477 4.388 20 0 DIADLO c1ccc(Oc2cccc(C[NH+]3CC4(C3)CCCCO4)c2)cc1 ZINC001203810369 1049004379 /nfs/dbraw/zinc/00/43/79/1049004379.db2.gz ICLQPXZSYDWBIZ-UHFFFAOYSA-N 1 2 309.409 4.234 20 0 DIADLO Cc1cc(F)c(C[NH2+]Cc2ccnc(Cl)c2Cl)c(F)c1 ZINC001203809989 1049005124 /nfs/dbraw/zinc/00/51/24/1049005124.db2.gz PCUFAUKULZIQJX-UHFFFAOYSA-N 1 2 317.166 4.265 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1noc([C@@H]2CCC[C@@H]2c2ccccc2)n1 ZINC000904263481 1049007340 /nfs/dbraw/zinc/00/73/40/1049007340.db2.gz ZUDUPSIEPRSFKS-HZPDHXFCSA-N 1 2 320.396 4.074 20 0 DIADLO Cc1[nH]c(CN[C@H](c2ccccc2)c2ccc(F)cc2)[nH+]c1C ZINC001191846031 1049010533 /nfs/dbraw/zinc/01/05/33/1049010533.db2.gz RSQFYPWUMRCCHF-LJQANCHMSA-N 1 2 309.388 4.045 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)[nH]c1C ZINC001191846031 1049010546 /nfs/dbraw/zinc/01/05/46/1049010546.db2.gz RSQFYPWUMRCCHF-LJQANCHMSA-N 1 2 309.388 4.045 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@H+]1Cc1cccc(F)c1Cl ZINC001191870060 1049013083 /nfs/dbraw/zinc/01/30/83/1049013083.db2.gz CHRNQJMFBJWRIF-LBPRGKRZSA-N 1 2 305.780 4.435 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1cccc(F)c1Cl ZINC001191870060 1049013097 /nfs/dbraw/zinc/01/30/97/1049013097.db2.gz CHRNQJMFBJWRIF-LBPRGKRZSA-N 1 2 305.780 4.435 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)cn1 ZINC000338968127 1049016673 /nfs/dbraw/zinc/01/66/73/1049016673.db2.gz LEVDAPQCNQOOIO-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)cn1 ZINC000338968127 1049016688 /nfs/dbraw/zinc/01/66/88/1049016688.db2.gz LEVDAPQCNQOOIO-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO FC(F)(F)c1cccc(C[NH+]2CC3(C2)CC(F)(F)CS3)c1 ZINC001203886754 1049023393 /nfs/dbraw/zinc/02/33/93/1049023393.db2.gz MTEPCUSFQBCGLE-UHFFFAOYSA-N 1 2 323.330 4.032 20 0 DIADLO Cc1cccc(C[N@@H+]2Cc3cnc(-c4ccc(F)cc4)nc3C2)c1 ZINC001203892730 1049024744 /nfs/dbraw/zinc/02/47/44/1049024744.db2.gz ONEGIOUIMJZXSI-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO Cc1cccc(C[N@H+]2Cc3cnc(-c4ccc(F)cc4)nc3C2)c1 ZINC001203892730 1049024751 /nfs/dbraw/zinc/02/47/51/1049024751.db2.gz ONEGIOUIMJZXSI-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO Cc1cc(NCc2ccc(OC(F)F)cc2)ccc1[NH+](C)C ZINC001178360648 1049026990 /nfs/dbraw/zinc/02/69/90/1049026990.db2.gz ODPLPTIFHKAYSU-UHFFFAOYSA-N 1 2 306.356 4.275 20 0 DIADLO CCCc1cc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)ccc1F ZINC001191975263 1049027656 /nfs/dbraw/zinc/02/76/56/1049027656.db2.gz VLKSJKROFUYPPE-UHFFFAOYSA-N 1 2 323.371 4.216 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CC[C@H]2SCCS[C@H]12 ZINC000776803125 1049028088 /nfs/dbraw/zinc/02/80/88/1049028088.db2.gz SKDSAKPVYCPMOX-BRWVUGGUSA-N 1 2 320.527 4.078 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(Oc3ccccc3)cc2)CCC1=O ZINC001203944855 1049039197 /nfs/dbraw/zinc/03/91/97/1049039197.db2.gz UBSHLZWUSSVNLA-UHFFFAOYSA-N 1 2 309.409 4.280 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(Oc3ccccc3)cc2)CCC1=O ZINC001203944855 1049039211 /nfs/dbraw/zinc/03/92/11/1049039211.db2.gz UBSHLZWUSSVNLA-UHFFFAOYSA-N 1 2 309.409 4.280 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1ccc(F)c(F)c1F ZINC001178487410 1049045010 /nfs/dbraw/zinc/04/50/10/1049045010.db2.gz FZZKVOMTGUORCF-UHFFFAOYSA-N 1 2 315.722 4.056 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@@H+]1CCC[C@H](CC(C)C)C1 ZINC001192197920 1049051561 /nfs/dbraw/zinc/05/15/61/1049051561.db2.gz HRYANOUCKNXONK-PBHICJAKSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@H+]1CCC[C@H](CC(C)C)C1 ZINC001192197920 1049051574 /nfs/dbraw/zinc/05/15/74/1049051574.db2.gz HRYANOUCKNXONK-PBHICJAKSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@H](CC(C)C)C1 ZINC001192197873 1049051699 /nfs/dbraw/zinc/05/16/99/1049051699.db2.gz HGKCCODHDFYVCU-PBHICJAKSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H](CC(C)C)C1 ZINC001192197873 1049051711 /nfs/dbraw/zinc/05/17/11/1049051711.db2.gz HGKCCODHDFYVCU-PBHICJAKSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)C[N@H+](Cc1sccc1C)[C@H](C)c1ccccc1 ZINC001204024968 1049065945 /nfs/dbraw/zinc/06/59/45/1049065945.db2.gz QXVFFCGGXUFESC-OAHLLOKOSA-N 1 2 317.454 4.183 20 0 DIADLO CCOC(=O)C[N@@H+](Cc1sccc1C)[C@H](C)c1ccccc1 ZINC001204024968 1049065956 /nfs/dbraw/zinc/06/59/56/1049065956.db2.gz QXVFFCGGXUFESC-OAHLLOKOSA-N 1 2 317.454 4.183 20 0 DIADLO CCCOc1cccc(C[N@H+](CC(=O)OC(C)(C)C)C(C)C)c1 ZINC001192262378 1049070990 /nfs/dbraw/zinc/07/09/90/1049070990.db2.gz WAZMHXQURZLKHI-UHFFFAOYSA-N 1 2 321.461 4.028 20 0 DIADLO CCCOc1cccc(C[N@@H+](CC(=O)OC(C)(C)C)C(C)C)c1 ZINC001192262378 1049070995 /nfs/dbraw/zinc/07/09/95/1049070995.db2.gz WAZMHXQURZLKHI-UHFFFAOYSA-N 1 2 321.461 4.028 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1cccc2[nH]ccc21 ZINC001204079497 1049078649 /nfs/dbraw/zinc/07/86/49/1049078649.db2.gz LMRMWBGDKHPKNK-UHFFFAOYSA-N 1 2 310.788 4.320 20 0 DIADLO CC(C)c1nc(C[N@H+](C)Cc2ccnc3ccccc23)cs1 ZINC001204088502 1049082336 /nfs/dbraw/zinc/08/23/36/1049082336.db2.gz NSLULKVQPBCEET-UHFFFAOYSA-N 1 2 311.454 4.447 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)Cc2ccnc3ccccc23)cs1 ZINC001204088502 1049082352 /nfs/dbraw/zinc/08/23/52/1049082352.db2.gz NSLULKVQPBCEET-UHFFFAOYSA-N 1 2 311.454 4.447 20 0 DIADLO CC[C@@H](O)C[N@H+](Cc1ccccc1)Cc1c(F)cccc1Cl ZINC001192346104 1049092209 /nfs/dbraw/zinc/09/22/09/1049092209.db2.gz AIOLBIRNCSVZID-OAHLLOKOSA-N 1 2 321.823 4.252 20 0 DIADLO CC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1c(F)cccc1Cl ZINC001192346104 1049092220 /nfs/dbraw/zinc/09/22/20/1049092220.db2.gz AIOLBIRNCSVZID-OAHLLOKOSA-N 1 2 321.823 4.252 20 0 DIADLO CSc1ccc(C[N@@H+]2CCCC[C@H]2C(=O)OC(C)(C)C)cc1 ZINC001204141890 1049095398 /nfs/dbraw/zinc/09/53/98/1049095398.db2.gz HNABGGZFNOLIIC-INIZCTEOSA-N 1 2 321.486 4.105 20 0 DIADLO CSc1ccc(C[N@H+]2CCCC[C@H]2C(=O)OC(C)(C)C)cc1 ZINC001204141890 1049095413 /nfs/dbraw/zinc/09/54/13/1049095413.db2.gz HNABGGZFNOLIIC-INIZCTEOSA-N 1 2 321.486 4.105 20 0 DIADLO C[C@@H](NC(=O)c1cccc2[nH+]ccn21)c1csc2ccccc21 ZINC000776895535 1049099341 /nfs/dbraw/zinc/09/93/41/1049099341.db2.gz CDAHMMCBYZTTEP-GFCCVEGCSA-N 1 2 321.405 4.040 20 0 DIADLO COc1nc2ccccc2cc1C[N@@H+]1CC[C@@H]1c1cccc(F)c1 ZINC001204163900 1049100697 /nfs/dbraw/zinc/10/06/97/1049100697.db2.gz VFSBWXKSPNGOGV-LJQANCHMSA-N 1 2 322.383 4.330 20 0 DIADLO COc1nc2ccccc2cc1C[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC001204163900 1049100703 /nfs/dbraw/zinc/10/07/03/1049100703.db2.gz VFSBWXKSPNGOGV-LJQANCHMSA-N 1 2 322.383 4.330 20 0 DIADLO CCCn1c[nH+]cc1CNc1cc(C(C)C)nn1-c1ccccc1 ZINC001178855047 1049100829 /nfs/dbraw/zinc/10/08/29/1049100829.db2.gz CGURUFRIZKGDKS-UHFFFAOYSA-N 1 2 323.444 4.214 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2cccc(F)c2)s1)c1csnn1 ZINC001178971625 1049116057 /nfs/dbraw/zinc/11/60/57/1049116057.db2.gz IYOZETVKJZSFMC-JTQLQIEISA-N 1 2 319.430 4.257 20 0 DIADLO Cc1ccc([C@]2(C)C[N@H+](Cc3cc(F)cc(F)c3)CCO2)cc1 ZINC001204230351 1049116905 /nfs/dbraw/zinc/11/69/05/1049116905.db2.gz ANAFIMVXTLKORI-IBGZPJMESA-N 1 2 317.379 4.021 20 0 DIADLO Cc1ccc([C@]2(C)C[N@@H+](Cc3cc(F)cc(F)c3)CCO2)cc1 ZINC001204230351 1049116910 /nfs/dbraw/zinc/11/69/10/1049116910.db2.gz ANAFIMVXTLKORI-IBGZPJMESA-N 1 2 317.379 4.021 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)o1 ZINC001204270636 1049125768 /nfs/dbraw/zinc/12/57/68/1049125768.db2.gz PAGDRSFWPJOKAF-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)o1 ZINC001204270636 1049125771 /nfs/dbraw/zinc/12/57/71/1049125771.db2.gz PAGDRSFWPJOKAF-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO Cc1ccn2cc(C[N@@H+](C)Cc3ccc(F)c(Cl)c3)nc2c1 ZINC001204286799 1049128350 /nfs/dbraw/zinc/12/83/50/1049128350.db2.gz OEMDBHGXMGWRGP-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1ccn2cc(C[N@H+](C)Cc3ccc(F)c(Cl)c3)nc2c1 ZINC001204286799 1049128357 /nfs/dbraw/zinc/12/83/57/1049128357.db2.gz OEMDBHGXMGWRGP-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1csc(C2([NH2+][C@@H](C)c3cccnc3Cl)CCC2)n1 ZINC000776925282 1049136376 /nfs/dbraw/zinc/13/63/76/1049136376.db2.gz FXVKJAXSTSHUMD-NSHDSACASA-N 1 2 307.850 4.230 20 0 DIADLO Cc1cccc(-c2n[nH]cc2C[NH2+]CC(F)(F)C(C)(C)C)c1 ZINC001179222674 1049143016 /nfs/dbraw/zinc/14/30/16/1049143016.db2.gz NAKFIFMZPPRAAL-UHFFFAOYSA-N 1 2 307.388 4.156 20 0 DIADLO C[N@H+](Cc1cncs1)Cc1ccccc1OCc1ccccc1 ZINC001204335646 1049144866 /nfs/dbraw/zinc/14/48/66/1049144866.db2.gz KSTKIQKTBWNGIM-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO C[N@@H+](Cc1cncs1)Cc1ccccc1OCc1ccccc1 ZINC001204335646 1049144874 /nfs/dbraw/zinc/14/48/74/1049144874.db2.gz KSTKIQKTBWNGIM-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO CCc1ccc(C2=CC[N@H+](Cc3csnc3OC)CC2)cc1 ZINC001192857727 1049145339 /nfs/dbraw/zinc/14/53/39/1049145339.db2.gz FTRZRGKTCZATPB-UHFFFAOYSA-N 1 2 314.454 4.003 20 0 DIADLO CCc1ccc(C2=CC[N@@H+](Cc3csnc3OC)CC2)cc1 ZINC001192857727 1049145349 /nfs/dbraw/zinc/14/53/49/1049145349.db2.gz FTRZRGKTCZATPB-UHFFFAOYSA-N 1 2 314.454 4.003 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1cccc(OC(F)(F)F)c1)C2 ZINC001204434108 1049161409 /nfs/dbraw/zinc/16/14/09/1049161409.db2.gz MDWVCEHTXDTNHS-UHFFFAOYSA-N 1 2 323.314 4.110 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1cccc(OC(F)(F)F)c1)C2 ZINC001204434108 1049161417 /nfs/dbraw/zinc/16/14/17/1049161417.db2.gz MDWVCEHTXDTNHS-UHFFFAOYSA-N 1 2 323.314 4.110 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1cccc(OC(F)(F)F)c1)C2 ZINC001204433141 1049161846 /nfs/dbraw/zinc/16/18/46/1049161846.db2.gz UUYMNZDYFZKXOP-UHFFFAOYSA-N 1 2 311.278 4.240 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1cccc(OC(F)(F)F)c1)C2 ZINC001204433141 1049161850 /nfs/dbraw/zinc/16/18/50/1049161850.db2.gz UUYMNZDYFZKXOP-UHFFFAOYSA-N 1 2 311.278 4.240 20 0 DIADLO Fc1ccc(OCC[N@@H+]2CCc3cccc(F)c3C2)c(Cl)c1 ZINC001192965340 1049161911 /nfs/dbraw/zinc/16/19/11/1049161911.db2.gz QCSBSTWNBKXSCU-UHFFFAOYSA-N 1 2 323.770 4.055 20 0 DIADLO Fc1ccc(OCC[N@H+]2CCc3cccc(F)c3C2)c(Cl)c1 ZINC001192965340 1049161915 /nfs/dbraw/zinc/16/19/15/1049161915.db2.gz QCSBSTWNBKXSCU-UHFFFAOYSA-N 1 2 323.770 4.055 20 0 DIADLO CC(C)Oc1ccc(C[N@H+](C)Cc2cnc(Cl)s2)cc1 ZINC001204452054 1049164377 /nfs/dbraw/zinc/16/43/77/1049164377.db2.gz DNKOYCAHVLSFFC-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+](C)Cc2cnc(Cl)s2)cc1 ZINC001204452054 1049164382 /nfs/dbraw/zinc/16/43/82/1049164382.db2.gz DNKOYCAHVLSFFC-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCC[C@H]2c2ccc(C(C)C)cc2)[nH]1 ZINC001192977038 1049164681 /nfs/dbraw/zinc/16/46/81/1049164681.db2.gz TWZSLBCBZWAGSL-KRWDZBQOSA-N 1 2 312.461 4.218 20 0 DIADLO CCc1nnc(C[N@H+]2CCCC[C@H]2c2ccc(C(C)C)cc2)[nH]1 ZINC001192977038 1049164684 /nfs/dbraw/zinc/16/46/84/1049164684.db2.gz TWZSLBCBZWAGSL-KRWDZBQOSA-N 1 2 312.461 4.218 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(F)cccc2C(F)(F)F)CCC1(F)F ZINC001204456485 1049166933 /nfs/dbraw/zinc/16/69/33/1049166933.db2.gz KDGTWOOXUYYSBU-VIFPVBQESA-N 1 2 311.269 4.322 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c(F)cccc2C(F)(F)F)CCC1(F)F ZINC001204456485 1049166939 /nfs/dbraw/zinc/16/69/39/1049166939.db2.gz KDGTWOOXUYYSBU-VIFPVBQESA-N 1 2 311.269 4.322 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+]Cc3cc(C)ccn3)cs2)cc1 ZINC001179472960 1049170222 /nfs/dbraw/zinc/17/02/22/1049170222.db2.gz GRIUQDUXAMJLDB-UHFFFAOYSA-N 1 2 309.438 4.112 20 0 DIADLO COc1ccc2cc(C[N@@H+]3CCC(F)(F)[C@H](F)C3)ccc2c1 ZINC001204515318 1049181163 /nfs/dbraw/zinc/18/11/63/1049181163.db2.gz FHKKCIWEEFINRT-MRXNPFEDSA-N 1 2 309.331 4.028 20 0 DIADLO COc1ccc2cc(C[N@H+]3CCC(F)(F)[C@H](F)C3)ccc2c1 ZINC001204515318 1049181170 /nfs/dbraw/zinc/18/11/70/1049181170.db2.gz FHKKCIWEEFINRT-MRXNPFEDSA-N 1 2 309.331 4.028 20 0 DIADLO COc1ccc2cc(C[N@@H+]3CCC(F)(F)[C@@H](F)C3)ccc2c1 ZINC001204515317 1049181353 /nfs/dbraw/zinc/18/13/53/1049181353.db2.gz FHKKCIWEEFINRT-INIZCTEOSA-N 1 2 309.331 4.028 20 0 DIADLO COc1ccc2cc(C[N@H+]3CCC(F)(F)[C@@H](F)C3)ccc2c1 ZINC001204515317 1049181359 /nfs/dbraw/zinc/18/13/59/1049181359.db2.gz FHKKCIWEEFINRT-INIZCTEOSA-N 1 2 309.331 4.028 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)ccc1F ZINC001204563892 1049190243 /nfs/dbraw/zinc/19/02/43/1049190243.db2.gz RRCOWSWLFRBANY-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)ccc1F ZINC001204563892 1049190246 /nfs/dbraw/zinc/19/02/46/1049190246.db2.gz RRCOWSWLFRBANY-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO CC[N@H+](Cc1cn(C)nc1C)Cc1ccc(Cl)cc1Cl ZINC001204582796 1049194950 /nfs/dbraw/zinc/19/49/50/1049194950.db2.gz IJBHAJCZWVJMKF-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO CC[N@@H+](Cc1cn(C)nc1C)Cc1ccc(Cl)cc1Cl ZINC001204582796 1049194952 /nfs/dbraw/zinc/19/49/52/1049194952.db2.gz IJBHAJCZWVJMKF-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO CCOC(=O)[C@H]1CCCC[N@@H+]1C/C=C/c1c(C)cc(C)cc1C ZINC001204601248 1049195780 /nfs/dbraw/zinc/19/57/80/1049195780.db2.gz DJXLJVVFLSBSOT-CSHXORCISA-N 1 2 315.457 4.043 20 0 DIADLO CCOC(=O)[C@H]1CCCC[N@H+]1C/C=C/c1c(C)cc(C)cc1C ZINC001204601248 1049195788 /nfs/dbraw/zinc/19/57/88/1049195788.db2.gz DJXLJVVFLSBSOT-CSHXORCISA-N 1 2 315.457 4.043 20 0 DIADLO Clc1ccccc1C1([NH2+][C@H]2CCCc3cn[nH]c32)CCC1 ZINC000857872818 1049204951 /nfs/dbraw/zinc/20/49/51/1049204951.db2.gz QKLIHLCVKRFGPY-HNNXBMFYSA-N 1 2 301.821 4.110 20 0 DIADLO CC[N@H+](Cc1ncsc1Br)[C@@H]1CCCC[C@H]1C ZINC001193412826 1049209262 /nfs/dbraw/zinc/20/92/62/1049209262.db2.gz HWPWIOUEKHLGJV-ZYHUDNBSSA-N 1 2 317.296 4.306 20 0 DIADLO CC[N@@H+](Cc1ncsc1Br)[C@@H]1CCCC[C@H]1C ZINC001193412826 1049209273 /nfs/dbraw/zinc/20/92/73/1049209273.db2.gz HWPWIOUEKHLGJV-ZYHUDNBSSA-N 1 2 317.296 4.306 20 0 DIADLO CSc1c(F)cccc1NC1CCN(c2cccc[nH+]2)CC1 ZINC000668454327 1049211152 /nfs/dbraw/zinc/21/11/52/1049211152.db2.gz DIFUZQXGJRCTJC-UHFFFAOYSA-N 1 2 317.433 4.024 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H]1CCc2ccc(Cl)nc21 ZINC000857912181 1049211288 /nfs/dbraw/zinc/21/12/88/1049211288.db2.gz ZHTRUPYWUSGYPH-ZDUSSCGKSA-N 1 2 323.223 4.174 20 0 DIADLO CC(C)[C@H]1CCC[C@H](NC(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC001204648833 1049211784 /nfs/dbraw/zinc/21/17/84/1049211784.db2.gz MSFBBEIJXBIUJW-GJZGRUSLSA-N 1 2 314.433 4.061 20 0 DIADLO C[C@@H]1CC[C@H](C)C[N@H+]1Cc1cc(Br)cnc1Cl ZINC001179855441 1049217683 /nfs/dbraw/zinc/21/76/83/1049217683.db2.gz SFWCPWRDVCCJCB-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1cc(Br)cnc1Cl ZINC001179855441 1049217697 /nfs/dbraw/zinc/21/76/97/1049217697.db2.gz SFWCPWRDVCCJCB-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO CCOc1cccc(C[N@H+](CC)Cc2c(F)cccc2F)c1 ZINC001179868598 1049223911 /nfs/dbraw/zinc/22/39/11/1049223911.db2.gz FKNRAIQLLGQCNS-UHFFFAOYSA-N 1 2 305.368 4.386 20 0 DIADLO CCOc1cccc(C[N@@H+](CC)Cc2c(F)cccc2F)c1 ZINC001179868598 1049223925 /nfs/dbraw/zinc/22/39/25/1049223925.db2.gz FKNRAIQLLGQCNS-UHFFFAOYSA-N 1 2 305.368 4.386 20 0 DIADLO CC(C)([NH2+]Cc1cccnc1Cl)c1nc2ccccc2s1 ZINC000858215921 1049228313 /nfs/dbraw/zinc/22/83/13/1049228313.db2.gz CBBYPGGIRFYZGU-UHFFFAOYSA-N 1 2 317.845 4.370 20 0 DIADLO Cc1cccc(OCC[N@@H+](C)Cc2c(F)cc(C)cc2F)c1 ZINC001204704321 1049231697 /nfs/dbraw/zinc/23/16/97/1049231697.db2.gz AQXZBPNEKKFMJS-UHFFFAOYSA-N 1 2 305.368 4.092 20 0 DIADLO Cc1cccc(OCC[N@H+](C)Cc2c(F)cc(C)cc2F)c1 ZINC001204704321 1049231711 /nfs/dbraw/zinc/23/17/11/1049231711.db2.gz AQXZBPNEKKFMJS-UHFFFAOYSA-N 1 2 305.368 4.092 20 0 DIADLO Clc1cccc(-c2ccc(C[N@@H+]3CCn4cccc4C3)o2)c1 ZINC001204710137 1049235754 /nfs/dbraw/zinc/23/57/54/1049235754.db2.gz BHGFQYVRRXLYSO-UHFFFAOYSA-N 1 2 312.800 4.417 20 0 DIADLO Clc1cccc(-c2ccc(C[N@H+]3CCn4cccc4C3)o2)c1 ZINC001204710137 1049235768 /nfs/dbraw/zinc/23/57/68/1049235768.db2.gz BHGFQYVRRXLYSO-UHFFFAOYSA-N 1 2 312.800 4.417 20 0 DIADLO CSCCCCCCC(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000858288886 1049236162 /nfs/dbraw/zinc/23/61/62/1049236162.db2.gz PUXWEQIGJADANE-UHFFFAOYSA-N 1 2 317.458 4.124 20 0 DIADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1ccc(-c2ccccc2Cl)o1 ZINC001204718114 1049240326 /nfs/dbraw/zinc/24/03/26/1049240326.db2.gz VPNBNYAKEGUAPT-LBPRGKRZSA-N 1 2 303.789 4.153 20 0 DIADLO C[C@H]1CC(=O)CC[N@H+]1Cc1ccc(-c2ccccc2Cl)o1 ZINC001204718114 1049240341 /nfs/dbraw/zinc/24/03/41/1049240341.db2.gz VPNBNYAKEGUAPT-LBPRGKRZSA-N 1 2 303.789 4.153 20 0 DIADLO O=C1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)CC[C@@H]1F ZINC001204724330 1049241796 /nfs/dbraw/zinc/24/17/96/1049241796.db2.gz HSZWNQTVZARRAY-HNNXBMFYSA-N 1 2 321.779 4.103 20 0 DIADLO O=C1CC[N@H+](Cc2ccc(-c3ccccc3Cl)o2)CC[C@@H]1F ZINC001204724330 1049241806 /nfs/dbraw/zinc/24/18/06/1049241806.db2.gz HSZWNQTVZARRAY-HNNXBMFYSA-N 1 2 321.779 4.103 20 0 DIADLO O=C1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)CC[C@H]1F ZINC001204724331 1049242373 /nfs/dbraw/zinc/24/23/73/1049242373.db2.gz HSZWNQTVZARRAY-OAHLLOKOSA-N 1 2 321.779 4.103 20 0 DIADLO O=C1CC[N@H+](Cc2ccc(-c3ccccc3Cl)o2)CC[C@H]1F ZINC001204724331 1049242385 /nfs/dbraw/zinc/24/23/85/1049242385.db2.gz HSZWNQTVZARRAY-OAHLLOKOSA-N 1 2 321.779 4.103 20 0 DIADLO Fc1cccc(F)c1C1([NH2+]Cc2ccc(Cl)nc2)CCC1 ZINC000858342255 1049244882 /nfs/dbraw/zinc/24/48/82/1049244882.db2.gz LIIVHQFLLJILPM-UHFFFAOYSA-N 1 2 308.759 4.182 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+]3C[C@@H](C)OC[C@@H]3C)s2)cc1C ZINC001179993530 1049247470 /nfs/dbraw/zinc/24/74/70/1049247470.db2.gz LYAKQUNXWCMMDW-LSDHHAIUSA-N 1 2 316.470 4.036 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+]3C[C@@H](C)OC[C@@H]3C)s2)cc1C ZINC001179993530 1049247480 /nfs/dbraw/zinc/24/74/80/1049247480.db2.gz LYAKQUNXWCMMDW-LSDHHAIUSA-N 1 2 316.470 4.036 20 0 DIADLO Cc1cccc(F)c1C[NH2+][C@H](C)c1cc(-c2ccccc2)n(C)n1 ZINC000858366428 1049249061 /nfs/dbraw/zinc/24/90/61/1049249061.db2.gz CRSIRLDGSPVVJB-OAHLLOKOSA-N 1 2 323.415 4.385 20 0 DIADLO Cc1cc(-c2ccc(OCc3ccccc3)nc2)c2[nH+]ccn2c1 ZINC001204750410 1049252555 /nfs/dbraw/zinc/25/25/55/1049252555.db2.gz KZMCNGRWMUJEDT-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO CCC(CC)([NH2+]Cc1c(C)ccc2cc(C)ccc21)C(=O)OC ZINC001193838197 1049263028 /nfs/dbraw/zinc/26/30/28/1049263028.db2.gz HCNRJAVFWOGKOB-UHFFFAOYSA-N 1 2 313.441 4.278 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2cc(O)ccc2Cl)C1 ZINC001193797693 1049265030 /nfs/dbraw/zinc/26/50/30/1049265030.db2.gz NLXUKZATPORBRM-SFHVURJKSA-N 1 2 319.807 4.425 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2cc(O)ccc2Cl)C1 ZINC001193797693 1049265043 /nfs/dbraw/zinc/26/50/43/1049265043.db2.gz NLXUKZATPORBRM-SFHVURJKSA-N 1 2 319.807 4.425 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@@H+]2CCO[C@@H](c3ccco3)C2)cc1C ZINC001204804200 1049268835 /nfs/dbraw/zinc/26/88/35/1049268835.db2.gz XVQQLSCJSNLSFO-RDBXKPKDSA-N 1 2 311.425 4.292 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@H+]2CCO[C@@H](c3ccco3)C2)cc1C ZINC001204804200 1049268846 /nfs/dbraw/zinc/26/88/46/1049268846.db2.gz XVQQLSCJSNLSFO-RDBXKPKDSA-N 1 2 311.425 4.292 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)cc1F ZINC001204817311 1049274328 /nfs/dbraw/zinc/27/43/28/1049274328.db2.gz RXLBVSVAPKJZOO-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)cc1F ZINC001204817311 1049274338 /nfs/dbraw/zinc/27/43/38/1049274338.db2.gz RXLBVSVAPKJZOO-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)o1 ZINC001204816060 1049274405 /nfs/dbraw/zinc/27/44/05/1049274405.db2.gz GCFYIXNWQKYJAA-INIZCTEOSA-N 1 2 307.340 4.294 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)o1 ZINC001204816060 1049274417 /nfs/dbraw/zinc/27/44/17/1049274417.db2.gz GCFYIXNWQKYJAA-INIZCTEOSA-N 1 2 307.340 4.294 20 0 DIADLO CSCCCCCCC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000858950882 1049302642 /nfs/dbraw/zinc/30/26/42/1049302642.db2.gz QJSBKIDJFHATTA-UHFFFAOYSA-N 1 2 317.458 4.329 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(Oc3ccccc3)o2)C[C@H](C)O1 ZINC001204898931 1049304798 /nfs/dbraw/zinc/30/47/98/1049304798.db2.gz NIUFUMVMHLAOFJ-LSDHHAIUSA-N 1 2 301.386 4.071 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)o2)C[C@H](C)O1 ZINC001204898931 1049304811 /nfs/dbraw/zinc/30/48/11/1049304811.db2.gz NIUFUMVMHLAOFJ-LSDHHAIUSA-N 1 2 301.386 4.071 20 0 DIADLO CCOc1cccc(F)c1C[N@@H+]1CCOc2ccccc2[C@@H]1C ZINC001180165686 1049305996 /nfs/dbraw/zinc/30/59/96/1049305996.db2.gz HEYLUTDYHTZWSX-AWEZNQCLSA-N 1 2 315.388 4.180 20 0 DIADLO CCOc1cccc(F)c1C[N@H+]1CCOc2ccccc2[C@@H]1C ZINC001180165686 1049306005 /nfs/dbraw/zinc/30/60/05/1049306005.db2.gz HEYLUTDYHTZWSX-AWEZNQCLSA-N 1 2 315.388 4.180 20 0 DIADLO COc1cc(C[N@@H+]2CCc3ccc(Cl)cc3C2)ccc1F ZINC001180218547 1049309339 /nfs/dbraw/zinc/30/93/39/1049309339.db2.gz CJMXKWPEBMIHHD-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(C[N@H+]2CCc3ccc(Cl)cc3C2)ccc1F ZINC001180218547 1049309344 /nfs/dbraw/zinc/30/93/44/1049309344.db2.gz CJMXKWPEBMIHHD-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@H+](C)Cc1ccnc(F)c1 ZINC000859097336 1049312644 /nfs/dbraw/zinc/31/26/44/1049312644.db2.gz YQDKDTBWUJBOFS-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@@H+](C)Cc1ccnc(F)c1 ZINC000859097336 1049312658 /nfs/dbraw/zinc/31/26/58/1049312658.db2.gz YQDKDTBWUJBOFS-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccnc(F)c1 ZINC000859168041 1049317699 /nfs/dbraw/zinc/31/76/99/1049317699.db2.gz HOWMZHRXNUIBEI-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccnc(F)c1 ZINC000859168041 1049317707 /nfs/dbraw/zinc/31/77/07/1049317707.db2.gz HOWMZHRXNUIBEI-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO Clc1cnc(Cl)c(Cl)c1Nc1ccn2cc[nH+]c2c1 ZINC001204965719 1049325487 /nfs/dbraw/zinc/32/54/87/1049325487.db2.gz GGQVFMDLVMCLQA-UHFFFAOYSA-N 1 2 313.575 4.433 20 0 DIADLO Clc1cccc(Nc2ccn3cc[nH+]c3c2)c1Br ZINC001204982660 1049330896 /nfs/dbraw/zinc/33/08/96/1049330896.db2.gz CNLLJHFEZKTVPT-UHFFFAOYSA-N 1 2 322.593 4.494 20 0 DIADLO Cc1cc([NH+]2CCCCC2)ccc1Nc1ccn2ccnc2c1 ZINC001204990669 1049333062 /nfs/dbraw/zinc/33/30/62/1049333062.db2.gz DMYKVZDOQLCOBK-UHFFFAOYSA-N 1 2 306.413 4.377 20 0 DIADLO Fc1cc(Nc2ccn3cc[nH+]c3c2)cc(F)c1OC1CCC1 ZINC001204997687 1049334367 /nfs/dbraw/zinc/33/43/67/1049334367.db2.gz NSKPTJRPEJMIIK-UHFFFAOYSA-N 1 2 315.323 4.287 20 0 DIADLO C/C(=C/C(=O)N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1)C(C)(C)C ZINC000079288401 1049335322 /nfs/dbraw/zinc/33/53/22/1049335322.db2.gz VCVHECHIFULADR-IKESIWSLSA-N 1 2 311.429 4.042 20 0 DIADLO Nc1cccc(N(c2ccccc2)c2ccn3cc[nH+]c3c2)c1 ZINC001204997001 1049335878 /nfs/dbraw/zinc/33/58/78/1049335878.db2.gz FYHFQJDUTCIEEA-UHFFFAOYSA-N 1 2 300.365 4.386 20 0 DIADLO Fc1cccc(Nc2ccn3cc[nH+]c3c2)c1N1CCCCC1 ZINC001204996936 1049336120 /nfs/dbraw/zinc/33/61/20/1049336120.db2.gz BIKPHKCNBRUERC-UHFFFAOYSA-N 1 2 310.376 4.207 20 0 DIADLO CC[C@@H](c1ccc(Br)cc1)[N@@H+]1CCO[C@H](C2CC2)C1 ZINC000485793163 1049337636 /nfs/dbraw/zinc/33/76/36/1049337636.db2.gz MQTJZNHPELNMCZ-HOTGVXAUSA-N 1 2 324.262 4.011 20 0 DIADLO CC[C@@H](c1ccc(Br)cc1)[N@H+]1CCO[C@H](C2CC2)C1 ZINC000485793163 1049337650 /nfs/dbraw/zinc/33/76/50/1049337650.db2.gz MQTJZNHPELNMCZ-HOTGVXAUSA-N 1 2 324.262 4.011 20 0 DIADLO C[N@H+](Cc1cccnc1)Cc1cccc(C(F)(F)F)c1Cl ZINC001205031020 1049345674 /nfs/dbraw/zinc/34/56/74/1049345674.db2.gz RHWVEKRSMYPELP-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1cccnc1)Cc1cccc(C(F)(F)F)c1Cl ZINC001205031020 1049345684 /nfs/dbraw/zinc/34/56/84/1049345684.db2.gz RHWVEKRSMYPELP-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[C@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1ccns1 ZINC000860053169 1049366401 /nfs/dbraw/zinc/36/64/01/1049366401.db2.gz RLOWKSBYPCVKQT-NSHDSACASA-N 1 2 307.488 4.498 20 0 DIADLO Cc1cccc(C[N@@H+]2CCc3ncc(C(F)(F)F)cc3C2)c1C ZINC001205088189 1049370115 /nfs/dbraw/zinc/37/01/15/1049370115.db2.gz AXXOSYRUFJFXKB-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cccc(C[N@H+]2CCc3ncc(C(F)(F)F)cc3C2)c1C ZINC001205088189 1049370127 /nfs/dbraw/zinc/37/01/27/1049370127.db2.gz AXXOSYRUFJFXKB-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Fc1cccc(F)c1C1([NH2+]Cc2cnc(Cl)s2)CCC1 ZINC000860200986 1049375669 /nfs/dbraw/zinc/37/56/69/1049375669.db2.gz CKWPKYUJIBKUCL-UHFFFAOYSA-N 1 2 314.788 4.244 20 0 DIADLO Cn1ccnc1C[N@H+]1CC=C(c2cc(Cl)cc(Cl)c2)CC1 ZINC001205111657 1049381791 /nfs/dbraw/zinc/38/17/91/1049381791.db2.gz JIBWRZBAYIWJBY-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1ccnc1C[N@@H+]1CC=C(c2cc(Cl)cc(Cl)c2)CC1 ZINC001205111657 1049381805 /nfs/dbraw/zinc/38/18/05/1049381805.db2.gz JIBWRZBAYIWJBY-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO CCc1ccc(C[N@H+](Cc2cc(F)ncc2F)C2CC2)cc1 ZINC001180566286 1049383935 /nfs/dbraw/zinc/38/39/35/1049383935.db2.gz OOLYDMVTQLHAHN-UHFFFAOYSA-N 1 2 302.368 4.087 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2cc(F)ncc2F)C2CC2)cc1 ZINC001180566286 1049383947 /nfs/dbraw/zinc/38/39/47/1049383947.db2.gz OOLYDMVTQLHAHN-UHFFFAOYSA-N 1 2 302.368 4.087 20 0 DIADLO Oc1ccc(-c2ccc(Nc3cccn4cc[nH+]c34)cc2)cc1 ZINC001205129325 1049388308 /nfs/dbraw/zinc/38/83/08/1049388308.db2.gz ZUYBULBIHNFMPJ-UHFFFAOYSA-N 1 2 301.349 4.451 20 0 DIADLO Cc1ccc([C@H](CC(F)(F)F)[NH2+][C@H]2C[C@H](C)n3ccnc32)cc1 ZINC001180595112 1049388627 /nfs/dbraw/zinc/38/86/27/1049388627.db2.gz YEWJNHDQQFBNDN-QEJZJMRPSA-N 1 2 323.362 4.481 20 0 DIADLO CC(C)c1cccc(C[N@@H+]2C[C@H](C(F)(F)F)OC(C)(C)C2)c1 ZINC001194589241 1049395897 /nfs/dbraw/zinc/39/58/97/1049395897.db2.gz NQFSORXCWNBSNC-OAHLLOKOSA-N 1 2 315.379 4.352 20 0 DIADLO CC(C)c1cccc(C[N@H+]2C[C@H](C(F)(F)F)OC(C)(C)C2)c1 ZINC001194589241 1049395908 /nfs/dbraw/zinc/39/59/08/1049395908.db2.gz NQFSORXCWNBSNC-OAHLLOKOSA-N 1 2 315.379 4.352 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)Oc1ccc2ccccc2c1 ZINC001194628747 1049399252 /nfs/dbraw/zinc/39/92/52/1049399252.db2.gz YLFLECIXFSENFT-UHFFFAOYSA-N 1 2 303.321 4.098 20 0 DIADLO C[C@@H]1Cc2cc(C[N@H+](C)Cc3c(F)cccc3Cl)ccc2O1 ZINC001205209859 1049410602 /nfs/dbraw/zinc/41/06/02/1049410602.db2.gz YWGLINNWXQANTI-GFCCVEGCSA-N 1 2 319.807 4.435 20 0 DIADLO C[C@@H]1Cc2cc(C[N@@H+](C)Cc3c(F)cccc3Cl)ccc2O1 ZINC001205209859 1049410608 /nfs/dbraw/zinc/41/06/08/1049410608.db2.gz YWGLINNWXQANTI-GFCCVEGCSA-N 1 2 319.807 4.435 20 0 DIADLO CCCCC[C@H]([NH2+][C@@H](C)Cc1ccccc1SC)C(=O)OC ZINC001180954125 1049422455 /nfs/dbraw/zinc/42/24/55/1049422455.db2.gz VKDCHMDEHOMGSF-HOCLYGCPSA-N 1 2 323.502 4.051 20 0 DIADLO CCn1nccc1Nc1cc[nH+]c2cc(C(F)(F)F)ccc12 ZINC001205274529 1049423953 /nfs/dbraw/zinc/42/39/53/1049423953.db2.gz MTMBYLCBHFZUPS-UHFFFAOYSA-N 1 2 306.291 4.214 20 0 DIADLO Cc1nc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)sc1C(C)(C)C ZINC001194833346 1049437720 /nfs/dbraw/zinc/43/77/20/1049437720.db2.gz IYEZOEMBPKDBBE-JTQLQIEISA-N 1 2 302.434 4.226 20 0 DIADLO Cc1nc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)sc1C(C)(C)C ZINC001194833346 1049437722 /nfs/dbraw/zinc/43/77/22/1049437722.db2.gz IYEZOEMBPKDBBE-JTQLQIEISA-N 1 2 302.434 4.226 20 0 DIADLO Cc1nc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)sc1C(C)(C)C ZINC001194833347 1049437834 /nfs/dbraw/zinc/43/78/34/1049437834.db2.gz IYEZOEMBPKDBBE-SNVBAGLBSA-N 1 2 302.434 4.226 20 0 DIADLO Cc1nc(C[N@H+]2CCC(F)(F)[C@H](C)C2)sc1C(C)(C)C ZINC001194833347 1049437840 /nfs/dbraw/zinc/43/78/40/1049437840.db2.gz IYEZOEMBPKDBBE-SNVBAGLBSA-N 1 2 302.434 4.226 20 0 DIADLO Fc1ccc(Br)c(C[N@@H+]2CCCc3occc3C2)c1 ZINC001194864619 1049439879 /nfs/dbraw/zinc/43/98/79/1049439879.db2.gz MENYJKQECXMVGY-UHFFFAOYSA-N 1 2 324.193 4.130 20 0 DIADLO Fc1ccc(Br)c(C[N@H+]2CCCc3occc3C2)c1 ZINC001194864619 1049439883 /nfs/dbraw/zinc/43/98/83/1049439883.db2.gz MENYJKQECXMVGY-UHFFFAOYSA-N 1 2 324.193 4.130 20 0 DIADLO Cc1ccc([C@]2(C)C[N@H+](Cc3sccc3Cl)CCO2)cc1 ZINC001205347107 1049443927 /nfs/dbraw/zinc/44/39/27/1049443927.db2.gz GGOBEDHECHFXDV-KRWDZBQOSA-N 1 2 321.873 4.458 20 0 DIADLO Cc1ccc([C@]2(C)C[N@@H+](Cc3sccc3Cl)CCO2)cc1 ZINC001205347107 1049443937 /nfs/dbraw/zinc/44/39/37/1049443937.db2.gz GGOBEDHECHFXDV-KRWDZBQOSA-N 1 2 321.873 4.458 20 0 DIADLO Cc1cc(-c2ccc(Oc3ccccc3)nc2)c2[nH+]ccn2c1 ZINC001205350307 1049445647 /nfs/dbraw/zinc/44/56/47/1049445647.db2.gz POALTEDAEKJENE-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO O=C(Nc1ccccc1)[C@@H]1CCC[N@H+]1Cc1sccc1Cl ZINC001205354014 1049447901 /nfs/dbraw/zinc/44/79/01/1049447901.db2.gz ORTDQBBADUCYAO-AWEZNQCLSA-N 1 2 320.845 4.005 20 0 DIADLO O=C(Nc1ccccc1)[C@@H]1CCC[N@@H+]1Cc1sccc1Cl ZINC001205354014 1049447908 /nfs/dbraw/zinc/44/79/08/1049447908.db2.gz ORTDQBBADUCYAO-AWEZNQCLSA-N 1 2 320.845 4.005 20 0 DIADLO COc1ccc(C[NH2+][C@H](c2nccs2)c2ccccc2)c(C)c1 ZINC000775629095 1049457905 /nfs/dbraw/zinc/45/79/05/1049457905.db2.gz OCWNTOTWOLJKCW-SFHVURJKSA-N 1 2 324.449 4.339 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC001194974859 1049459131 /nfs/dbraw/zinc/45/91/31/1049459131.db2.gz QNARCWOLMMIHMV-AEFFLSMTSA-N 1 2 315.457 4.336 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC001194974859 1049459138 /nfs/dbraw/zinc/45/91/38/1049459138.db2.gz QNARCWOLMMIHMV-AEFFLSMTSA-N 1 2 315.457 4.336 20 0 DIADLO Cc1ccc(Nc2ccc(Br)nc2Cl)c(C)[nH+]1 ZINC001203366792 1049464836 /nfs/dbraw/zinc/46/48/36/1049464836.db2.gz DMJHCAKIDMLNIF-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO C/C=C/C[C@H]([NH2+]C1CC(c2ccc(Cl)cc2)C1)C(=O)OCC ZINC001181453681 1049478984 /nfs/dbraw/zinc/47/89/84/1049478984.db2.gz BOMUCOPBIJKGDG-BXKKRMBKSA-N 1 2 321.848 4.074 20 0 DIADLO Cc1ccc([C@@H](C)CNc2ccc([NH+]3CCC(O)CC3)cc2)cc1 ZINC000862254968 1049480296 /nfs/dbraw/zinc/48/02/96/1049480296.db2.gz KKQKDLPDMZQUNX-KRWDZBQOSA-N 1 2 324.468 4.172 20 0 DIADLO Cc1ccc([C@@H](C)C[NH2+]c2ccc(N3CCC(O)CC3)cc2)cc1 ZINC000862254968 1049480302 /nfs/dbraw/zinc/48/03/02/1049480302.db2.gz KKQKDLPDMZQUNX-KRWDZBQOSA-N 1 2 324.468 4.172 20 0 DIADLO CC(C)([NH2+]Cc1cc2ccccc2nc1Cl)c1nccs1 ZINC000118847518 1049486825 /nfs/dbraw/zinc/48/68/25/1049486825.db2.gz GOCQXGGLIGLKKG-UHFFFAOYSA-N 1 2 317.845 4.370 20 0 DIADLO COC1(c2ccccc2)C[NH+](C/C=C/c2cc(C)c(C)cc2C)C1 ZINC001181543556 1049490062 /nfs/dbraw/zinc/49/00/62/1049490062.db2.gz FMXREKSJUVPEDG-CMDGGOBGSA-N 1 2 321.464 4.483 20 0 DIADLO Cc1c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)ccnc1F ZINC000862391896 1049492080 /nfs/dbraw/zinc/49/20/80/1049492080.db2.gz WLGBXQMQFHDSTN-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)ccnc1F ZINC000862391896 1049492083 /nfs/dbraw/zinc/49/20/83/1049492083.db2.gz WLGBXQMQFHDSTN-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cccc(OC3CC3)c2F)c1 ZINC001205555306 1049497665 /nfs/dbraw/zinc/49/76/65/1049497665.db2.gz RKKCLSJKLADZCT-UHFFFAOYSA-N 1 2 317.379 4.446 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cccc(OC3CC3)c2F)c1 ZINC001205555306 1049497671 /nfs/dbraw/zinc/49/76/71/1049497671.db2.gz RKKCLSJKLADZCT-UHFFFAOYSA-N 1 2 317.379 4.446 20 0 DIADLO CC[N@H+](CC(=O)Nc1ccc2ccccc2c1)Cc1occc1C ZINC001195226092 1049499604 /nfs/dbraw/zinc/49/96/04/1049499604.db2.gz ZYHZZQNWLLDWCW-UHFFFAOYSA-N 1 2 322.408 4.202 20 0 DIADLO CC[N@@H+](CC(=O)Nc1ccc2ccccc2c1)Cc1occc1C ZINC001195226092 1049499613 /nfs/dbraw/zinc/49/96/13/1049499613.db2.gz ZYHZZQNWLLDWCW-UHFFFAOYSA-N 1 2 322.408 4.202 20 0 DIADLO COc1ccc2cc(NCc3[nH+]cc(C)c(OC)c3C)ccc2c1 ZINC001181698660 1049511528 /nfs/dbraw/zinc/51/15/28/1049511528.db2.gz VGSPTFNNMOSTNK-UHFFFAOYSA-N 1 2 322.408 4.481 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CCC[C@H](C)C3)cc2)C[C@H](C)O1 ZINC001205619791 1049513412 /nfs/dbraw/zinc/51/34/12/1049513412.db2.gz AXGSOLZSRNAMRI-CUSZFKRNSA-N 1 2 302.462 4.291 20 0 DIADLO C[C@H]([NH2+]c1ccc(N2C[C@@H](C)O[C@@H](C)C2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC001205620143 1049514393 /nfs/dbraw/zinc/51/43/93/1049514393.db2.gz CJGVHHLQTOMNDT-WYIOCLOVSA-N 1 2 314.473 4.147 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@H+]1C[C@@H]1CCC2(CCCC2)O1 ZINC000794446379 1049514448 /nfs/dbraw/zinc/51/44/48/1049514448.db2.gz RYLRKFFMFYXNQR-KGLIPLIRSA-N 1 2 308.853 4.010 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@@H+]1C[C@@H]1CCC2(CCCC2)O1 ZINC000794446379 1049514460 /nfs/dbraw/zinc/51/44/60/1049514460.db2.gz RYLRKFFMFYXNQR-KGLIPLIRSA-N 1 2 308.853 4.010 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+]3CCOCC3(C)C)s2)cc1C ZINC001205628214 1049515026 /nfs/dbraw/zinc/51/50/26/1049515026.db2.gz GWDZJRRTFRPAAA-UHFFFAOYSA-N 1 2 316.470 4.038 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+]3CCOCC3(C)C)s2)cc1C ZINC001205628214 1049515036 /nfs/dbraw/zinc/51/50/36/1049515036.db2.gz GWDZJRRTFRPAAA-UHFFFAOYSA-N 1 2 316.470 4.038 20 0 DIADLO CCOc1c(Cl)cccc1C[NH2+]Cc1nc(C2CC2)cs1 ZINC000487268262 1049539999 /nfs/dbraw/zinc/53/99/99/1049539999.db2.gz LNBVREZZZMZCQW-UHFFFAOYSA-N 1 2 322.861 4.362 20 0 DIADLO C[C@H]([NH2+][C@@H](Cc1ccccc1)c1ncco1)c1cccc(F)c1 ZINC001195558038 1049540657 /nfs/dbraw/zinc/54/06/57/1049540657.db2.gz MKWWGBUVUBXDKV-KSSFIOAISA-N 1 2 310.372 4.448 20 0 DIADLO CC(C)Cc1ccccc1C[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000863377835 1049562415 /nfs/dbraw/zinc/56/24/15/1049562415.db2.gz ZZTUJUXROOBYON-AWEZNQCLSA-N 1 2 315.461 4.416 20 0 DIADLO Cc1ccc(C[S@@](=O)c2cccc(C(F)(F)F)c2)c(C)[nH+]1 ZINC000773972899 1049565705 /nfs/dbraw/zinc/56/57/05/1049565705.db2.gz PQAPPVONGZQFCF-OAQYLSRUSA-N 1 2 313.344 4.025 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@H](C)CCc3cccnc3)cc2)c1C ZINC001182108548 1049570221 /nfs/dbraw/zinc/57/02/21/1049570221.db2.gz DOEZGFGCNGMUOB-OAHLLOKOSA-N 1 2 320.440 4.317 20 0 DIADLO CCn1ccc(C[N@@H+]2CCc3ccc(-c4ccccc4)cc3C2)n1 ZINC001182115621 1049572298 /nfs/dbraw/zinc/57/22/98/1049572298.db2.gz NIAPPDVOEGIORH-UHFFFAOYSA-N 1 2 317.436 4.128 20 0 DIADLO CCn1ccc(C[N@H+]2CCc3ccc(-c4ccccc4)cc3C2)n1 ZINC001182115621 1049572307 /nfs/dbraw/zinc/57/23/07/1049572307.db2.gz NIAPPDVOEGIORH-UHFFFAOYSA-N 1 2 317.436 4.128 20 0 DIADLO CC(C)OC(=O)[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1c1ccccc1Cl ZINC001205849020 1049581936 /nfs/dbraw/zinc/58/19/36/1049581936.db2.gz KUDNBKUDPVDHLJ-YSVLISHTSA-N 1 2 323.864 4.296 20 0 DIADLO Cc1cc(C)c(NC(=O)NCCC2=CCCCCC2)c(C)[nH+]1 ZINC001205899760 1049594415 /nfs/dbraw/zinc/59/44/15/1049594415.db2.gz PBPYGJITDWDIOX-UHFFFAOYSA-N 1 2 301.434 4.409 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1ncc(-c2ccccc2)o1 ZINC000488078358 1049599857 /nfs/dbraw/zinc/59/98/57/1049599857.db2.gz SOBBZBNNGCLYCO-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1ncc(-c2ccccc2)o1 ZINC000488078358 1049599867 /nfs/dbraw/zinc/59/98/67/1049599867.db2.gz SOBBZBNNGCLYCO-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO CCCCC[C@H](CC)C(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC000775680029 1049602283 /nfs/dbraw/zinc/60/22/83/1049602283.db2.gz ZTQFYETZPPOAKK-INIZCTEOSA-N 1 2 320.477 4.272 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2[C@@H](C#N)c2ccccc2)ccc1F ZINC000093872498 1049606626 /nfs/dbraw/zinc/60/66/26/1049606626.db2.gz RLINYNVOGDQTRS-PKOBYXMFSA-N 1 2 324.399 4.106 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2[C@@H](C#N)c2ccccc2)ccc1F ZINC000093872498 1049606634 /nfs/dbraw/zinc/60/66/34/1049606634.db2.gz RLINYNVOGDQTRS-PKOBYXMFSA-N 1 2 324.399 4.106 20 0 DIADLO C[C@H](Nc1ccc([NH+]2CCCC2)cc1)c1cccc2c1OCO2 ZINC000863987591 1049609168 /nfs/dbraw/zinc/60/91/68/1049609168.db2.gz XFYKYJWOAXFEHY-AWEZNQCLSA-N 1 2 310.397 4.189 20 0 DIADLO C[C@]1(F)CCC[N@H+](Cc2ccc(OCC(F)(F)F)c(F)c2)C1 ZINC001205960638 1049611421 /nfs/dbraw/zinc/61/14/21/1049611421.db2.gz WXDYQSFJVRFRRB-AWEZNQCLSA-N 1 2 323.305 4.091 20 0 DIADLO C[C@]1(F)CCC[N@@H+](Cc2ccc(OCC(F)(F)F)c(F)c2)C1 ZINC001205960638 1049611429 /nfs/dbraw/zinc/61/14/29/1049611429.db2.gz WXDYQSFJVRFRRB-AWEZNQCLSA-N 1 2 323.305 4.091 20 0 DIADLO COc1nsc(C[N@H+](C)Cc2cccc(C)c2C)c1Cl ZINC001205974413 1049614560 /nfs/dbraw/zinc/61/45/60/1049614560.db2.gz PBXAYHUDAPYCJK-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COc1nsc(C[N@@H+](C)Cc2cccc(C)c2C)c1Cl ZINC001205974413 1049614566 /nfs/dbraw/zinc/61/45/66/1049614566.db2.gz PBXAYHUDAPYCJK-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO CC[N@H+](Cc1cccc(Br)n1)Cc1ccccc1F ZINC001205976191 1049617359 /nfs/dbraw/zinc/61/73/59/1049617359.db2.gz GONYTZLMHOJRJA-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1cccc(Br)n1)Cc1ccccc1F ZINC001205976191 1049617363 /nfs/dbraw/zinc/61/73/63/1049617363.db2.gz GONYTZLMHOJRJA-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO Fc1ccc2cc(C[N@@H+]3CCc4[nH]c5ccccc5c4C3)[nH]c2c1 ZINC000488318763 1049634332 /nfs/dbraw/zinc/63/43/32/1049634332.db2.gz VPXJOVWEONRMKI-UHFFFAOYSA-N 1 2 319.383 4.347 20 0 DIADLO Fc1ccc2cc(C[N@H+]3CCc4[nH]c5ccccc5c4C3)[nH]c2c1 ZINC000488318763 1049634339 /nfs/dbraw/zinc/63/43/39/1049634339.db2.gz VPXJOVWEONRMKI-UHFFFAOYSA-N 1 2 319.383 4.347 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3ccc(F)cc3[nH]2)[C@@H](c2ccccc2)CO1 ZINC000488339757 1049637691 /nfs/dbraw/zinc/63/76/91/1049637691.db2.gz XOJBKPHIVKNGOW-JLTOFOAXSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3ccc(F)cc3[nH]2)[C@@H](c2ccccc2)CO1 ZINC000488339757 1049637693 /nfs/dbraw/zinc/63/76/93/1049637693.db2.gz XOJBKPHIVKNGOW-JLTOFOAXSA-N 1 2 324.399 4.269 20 0 DIADLO Cc1cc(CN2C[C@H]3CCCCN3c3ccccc32)cc(C)[nH+]1 ZINC001206054345 1049640450 /nfs/dbraw/zinc/64/04/50/1049640450.db2.gz FNQOSYLXZRYBKZ-GOSISDBHSA-N 1 2 307.441 4.078 20 0 DIADLO CC[N@@H+]1CCCC[C@H]1C(=O)O[C@H](C)c1sc(C(C)C)nc1C ZINC000774304528 1049643924 /nfs/dbraw/zinc/64/39/24/1049643924.db2.gz NJIRRBBDGBDQFE-KGLIPLIRSA-N 1 2 324.490 4.054 20 0 DIADLO CC[N@H+]1CCCC[C@H]1C(=O)O[C@H](C)c1sc(C(C)C)nc1C ZINC000774304528 1049643927 /nfs/dbraw/zinc/64/39/27/1049643927.db2.gz NJIRRBBDGBDQFE-KGLIPLIRSA-N 1 2 324.490 4.054 20 0 DIADLO Cc1cn2c(cccc2NC(=S)Nc2cccc(C)c2C)[nH+]1 ZINC001196385692 1049648346 /nfs/dbraw/zinc/64/83/46/1049648346.db2.gz LQCSPOXYLTYCOJ-UHFFFAOYSA-N 1 2 310.426 4.068 20 0 DIADLO CC(C)(C)[C@H]1C[C@H](Nc2ccc(N3CCCC3)[nH+]c2)CS1 ZINC000488427623 1049651655 /nfs/dbraw/zinc/65/16/55/1049651655.db2.gz ALHAXTPYLFMQKP-LSDHHAIUSA-N 1 2 305.491 4.014 20 0 DIADLO CCCCOc1ccc(-c2cc(-n3ccnc3)cc[nH+]2)c(F)c1 ZINC001206112204 1049656494 /nfs/dbraw/zinc/65/64/94/1049656494.db2.gz LDZJGPQPWOZJBP-UHFFFAOYSA-N 1 2 311.360 4.252 20 0 DIADLO CC(C)[C@H]1C[C@H](Nc2ccc(N3CCCCC3)c[nH+]2)CS1 ZINC000488446560 1049656533 /nfs/dbraw/zinc/65/65/33/1049656533.db2.gz UISCIYYTHOQXIN-GOEBONIOSA-N 1 2 305.491 4.014 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2cc3ccccc3o2)[nH]1 ZINC000488469724 1049661044 /nfs/dbraw/zinc/66/10/44/1049661044.db2.gz ZMNJVVGCRJXJFM-RWMBFGLXSA-N 1 2 312.417 4.476 20 0 DIADLO c1ccc([C@@H]2CC[C@H](Nc3ccc(N4CCCC4)c[nH+]3)C2)cc1 ZINC001182499281 1049678895 /nfs/dbraw/zinc/67/88/95/1049678895.db2.gz NRBIVJCAAUDFAH-MSOLQXFVSA-N 1 2 307.441 4.430 20 0 DIADLO CCCc1ccc(CNc2ccc(N3CCCC3)c[nH+]2)s1 ZINC001182501046 1049679258 /nfs/dbraw/zinc/67/92/58/1049679258.db2.gz YCWXPMPMHNEECS-UHFFFAOYSA-N 1 2 301.459 4.308 20 0 DIADLO Fc1ccc(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)cc1 ZINC001196717061 1049683273 /nfs/dbraw/zinc/68/32/73/1049683273.db2.gz YGUOWCVNIMMNLQ-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Fc1ccc(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)cc1 ZINC001196717061 1049683276 /nfs/dbraw/zinc/68/32/76/1049683276.db2.gz YGUOWCVNIMMNLQ-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO CCOc1cc(F)cc(C[N@@H+]2CCc3cccc(Cl)c3C2)c1 ZINC001206233472 1049686715 /nfs/dbraw/zinc/68/67/15/1049686715.db2.gz ZOTCUODWTQIQDP-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CCOc1cc(F)cc(C[N@H+]2CCc3cccc(Cl)c3C2)c1 ZINC001206233472 1049686719 /nfs/dbraw/zinc/68/67/19/1049686719.db2.gz ZOTCUODWTQIQDP-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO Cn1ccc(C[N@H+]2CC=C(c3cc(Cl)cc(Cl)c3)CC2)n1 ZINC001206256818 1049691562 /nfs/dbraw/zinc/69/15/62/1049691562.db2.gz CPVVVXBDTXKHAR-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1ccc(C[N@@H+]2CC=C(c3cc(Cl)cc(Cl)c3)CC2)n1 ZINC001206256818 1049691571 /nfs/dbraw/zinc/69/15/71/1049691571.db2.gz CPVVVXBDTXKHAR-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cc1cc(O)cc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c1 ZINC001206261414 1049693036 /nfs/dbraw/zinc/69/30/36/1049693036.db2.gz FHIFXAHBBRNWBV-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO Cc1cc(O)cc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c1 ZINC001206261414 1049693039 /nfs/dbraw/zinc/69/30/39/1049693039.db2.gz FHIFXAHBBRNWBV-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1ccc(C(F)(F)F)s1 ZINC001182756124 1049706336 /nfs/dbraw/zinc/70/63/36/1049706336.db2.gz WRBDSWNWNRUERA-SNVBAGLBSA-N 1 2 307.381 4.156 20 0 DIADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1ccc(C(F)(F)F)s1 ZINC001182756124 1049706340 /nfs/dbraw/zinc/70/63/40/1049706340.db2.gz WRBDSWNWNRUERA-SNVBAGLBSA-N 1 2 307.381 4.156 20 0 DIADLO COC(=O)c1ccc(CSCc2ccc(C)[nH+]c2C)c(F)c1 ZINC000774540933 1049707758 /nfs/dbraw/zinc/70/77/58/1049707758.db2.gz OYAJXWCDEXZSNI-UHFFFAOYSA-N 1 2 319.401 4.058 20 0 DIADLO Cn1cc(Cl)c(C[N@@H+]2CC(C)(C)C[C@@H]2c2ccccc2)n1 ZINC001206385080 1049724920 /nfs/dbraw/zinc/72/49/20/1049724920.db2.gz RQEGQRUJJCEUIF-MRXNPFEDSA-N 1 2 303.837 4.047 20 0 DIADLO Cn1cc(Cl)c(C[N@H+]2CC(C)(C)C[C@@H]2c2ccccc2)n1 ZINC001206385080 1049724929 /nfs/dbraw/zinc/72/49/29/1049724929.db2.gz RQEGQRUJJCEUIF-MRXNPFEDSA-N 1 2 303.837 4.047 20 0 DIADLO Clc1cc2c(s1)CC[N@H+](Cc1cccc3c1NCCC3)C2 ZINC001206430023 1049734099 /nfs/dbraw/zinc/73/40/99/1049734099.db2.gz PBSAESZXRAULLG-UHFFFAOYSA-N 1 2 318.873 4.318 20 0 DIADLO Clc1cc2c(s1)CC[N@@H+](Cc1cccc3c1NCCC3)C2 ZINC001206430023 1049734107 /nfs/dbraw/zinc/73/41/07/1049734107.db2.gz PBSAESZXRAULLG-UHFFFAOYSA-N 1 2 318.873 4.318 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](CCCc1c(F)cccc1Cl)C2 ZINC001206455453 1049736962 /nfs/dbraw/zinc/73/69/62/1049736962.db2.gz FWPKNPQIFKBVRT-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO COc1ccc2c(c1)C[N@H+](CCCc1c(F)cccc1Cl)C2 ZINC001206455453 1049736972 /nfs/dbraw/zinc/73/69/72/1049736972.db2.gz FWPKNPQIFKBVRT-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO C[N@H+](Cc1ccc(CO)cc1)Cc1c(Cl)cccc1Cl ZINC000489252091 1049738200 /nfs/dbraw/zinc/73/82/00/1049738200.db2.gz UXMQURXZRKXIFX-UHFFFAOYSA-N 1 2 310.224 4.118 20 0 DIADLO C[N@@H+](Cc1ccc(CO)cc1)Cc1c(Cl)cccc1Cl ZINC000489252091 1049738209 /nfs/dbraw/zinc/73/82/09/1049738209.db2.gz UXMQURXZRKXIFX-UHFFFAOYSA-N 1 2 310.224 4.118 20 0 DIADLO CCCCC[C@H]1CCCN1C(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000489286933 1049740218 /nfs/dbraw/zinc/74/02/18/1049740218.db2.gz BXASOUBOGODOJO-KRWDZBQOSA-N 1 2 311.429 4.057 20 0 DIADLO CCCCC[C@@H]1CCCN1C(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000489301466 1049741915 /nfs/dbraw/zinc/74/19/15/1049741915.db2.gz DMUKQEQXNMWATH-GOSISDBHSA-N 1 2 311.429 4.057 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2C[C@@H](C)OC3(CCCCC3)C2)s1 ZINC001206491312 1049743389 /nfs/dbraw/zinc/74/33/89/1049743389.db2.gz UEAISPIADVVLFD-CQSZACIVSA-N 1 2 308.491 4.190 20 0 DIADLO CC(C)c1cnc(C[N@H+]2C[C@@H](C)OC3(CCCCC3)C2)s1 ZINC001206491312 1049743398 /nfs/dbraw/zinc/74/33/98/1049743398.db2.gz UEAISPIADVVLFD-CQSZACIVSA-N 1 2 308.491 4.190 20 0 DIADLO FC1CC[NH+](Cc2cccc(Br)c2Cl)CC1 ZINC001197335113 1049744316 /nfs/dbraw/zinc/74/43/16/1049744316.db2.gz IUYYJAFCOCALNN-UHFFFAOYSA-N 1 2 306.606 4.036 20 0 DIADLO COc1cnccc1C[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC001206499984 1049744875 /nfs/dbraw/zinc/74/48/75/1049744875.db2.gz OQMIZQPIWHFIPN-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cnccc1C[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC001206499984 1049744883 /nfs/dbraw/zinc/74/48/83/1049744883.db2.gz OQMIZQPIWHFIPN-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO CC[N@H+](Cc1ccccn1)[C@@H](C)c1ccccc1Br ZINC000489334224 1049745071 /nfs/dbraw/zinc/74/50/71/1049745071.db2.gz SFQVYUSIKZOXRL-ZDUSSCGKSA-N 1 2 319.246 4.427 20 0 DIADLO CC[N@@H+](Cc1ccccn1)[C@@H](C)c1ccccc1Br ZINC000489334224 1049745076 /nfs/dbraw/zinc/74/50/76/1049745076.db2.gz SFQVYUSIKZOXRL-ZDUSSCGKSA-N 1 2 319.246 4.427 20 0 DIADLO Cc1c2cccc(C)c2oc1C[N@@H+](C)Cc1cnn(C)c1Cl ZINC001206544685 1049753551 /nfs/dbraw/zinc/75/35/51/1049753551.db2.gz NMBCQZDQXZEKAP-UHFFFAOYSA-N 1 2 317.820 4.069 20 0 DIADLO Cc1c2cccc(C)c2oc1C[N@H+](C)Cc1cnn(C)c1Cl ZINC001206544685 1049753556 /nfs/dbraw/zinc/75/35/56/1049753556.db2.gz NMBCQZDQXZEKAP-UHFFFAOYSA-N 1 2 317.820 4.069 20 0 DIADLO Cc1ccc(OCc2nc(C[N@@H+](C)[C@H]3CC3(C)C)cs2)cc1 ZINC000489451786 1049758773 /nfs/dbraw/zinc/75/87/73/1049758773.db2.gz ZJFKDRDOFPZALA-INIZCTEOSA-N 1 2 316.470 4.261 20 0 DIADLO Cc1ccc(OCc2nc(C[N@H+](C)[C@H]3CC3(C)C)cs2)cc1 ZINC000489451786 1049758782 /nfs/dbraw/zinc/75/87/82/1049758782.db2.gz ZJFKDRDOFPZALA-INIZCTEOSA-N 1 2 316.470 4.261 20 0 DIADLO C[N@H+](Cc1csc(COc2ccc(F)cc2)n1)[C@@H]1CC1(C)C ZINC000489457946 1049759097 /nfs/dbraw/zinc/75/90/97/1049759097.db2.gz ALNYNEJHIQEMAM-OAHLLOKOSA-N 1 2 320.433 4.092 20 0 DIADLO C[N@@H+](Cc1csc(COc2ccc(F)cc2)n1)[C@@H]1CC1(C)C ZINC000489457946 1049759101 /nfs/dbraw/zinc/75/91/01/1049759101.db2.gz ALNYNEJHIQEMAM-OAHLLOKOSA-N 1 2 320.433 4.092 20 0 DIADLO CC(C)[C@H]1C[C@@H]([NH2+]CC(F)(F)c2cccc(F)c2)CS1 ZINC001206591882 1049763523 /nfs/dbraw/zinc/76/35/23/1049763523.db2.gz WFNGISLVXRHUOH-ZIAGYGMSSA-N 1 2 303.393 4.037 20 0 DIADLO Cc1cc2[nH]ccc2cc1-c1ccc(C[NH+]2CCOCC2)cc1F ZINC001206720014 1049783127 /nfs/dbraw/zinc/78/31/27/1049783127.db2.gz UHZBZWLPTNOXIP-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO c1cc2c(ncnc2Nc2ccc([NH+]3CCCCC3)cc2)s1 ZINC000912731574 1049783838 /nfs/dbraw/zinc/78/38/38/1049783838.db2.gz OCNJNAAVUCNZDT-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO Fc1ccc(-c2cc(C[N@@H+]3CCC[C@@H]3c3ccccn3)no2)cc1 ZINC001206833106 1049811049 /nfs/dbraw/zinc/81/10/49/1049811049.db2.gz FRRXDLDRDWKTHV-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(-c2cc(C[N@H+]3CCC[C@@H]3c3ccccn3)no2)cc1 ZINC001206833106 1049811051 /nfs/dbraw/zinc/81/10/51/1049811051.db2.gz FRRXDLDRDWKTHV-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@@]2(C)C(=O)OC(C)(C)C)cc1Cl ZINC001207006731 1049819017 /nfs/dbraw/zinc/81/90/17/1049819017.db2.gz CWSKITLPXBIEGC-SFHVURJKSA-N 1 2 323.864 4.345 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@@]2(C)C(=O)OC(C)(C)C)cc1Cl ZINC001207006731 1049819027 /nfs/dbraw/zinc/81/90/27/1049819027.db2.gz CWSKITLPXBIEGC-SFHVURJKSA-N 1 2 323.864 4.345 20 0 DIADLO COc1c(O)cccc1C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000490354608 1049825172 /nfs/dbraw/zinc/82/51/72/1049825172.db2.gz LQUMLPLNLCDMLQ-HNNXBMFYSA-N 1 2 303.789 4.001 20 0 DIADLO COc1c(O)cccc1C[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000490354608 1049825178 /nfs/dbraw/zinc/82/51/78/1049825178.db2.gz LQUMLPLNLCDMLQ-HNNXBMFYSA-N 1 2 303.789 4.001 20 0 DIADLO CCc1nccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)s2)n1 ZINC001207087553 1049832540 /nfs/dbraw/zinc/83/25/40/1049832540.db2.gz BIARZAZVRRFVOF-LBPRGKRZSA-N 1 2 307.850 4.091 20 0 DIADLO CCc1nccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)s2)n1 ZINC001207087553 1049832555 /nfs/dbraw/zinc/83/25/55/1049832555.db2.gz BIARZAZVRRFVOF-LBPRGKRZSA-N 1 2 307.850 4.091 20 0 DIADLO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2ncc(F)cc2F)cc1 ZINC001207097262 1049834344 /nfs/dbraw/zinc/83/43/44/1049834344.db2.gz PKNXZDZLSGWAFY-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2ncc(F)cc2F)cc1 ZINC001207097262 1049834356 /nfs/dbraw/zinc/83/43/56/1049834356.db2.gz PKNXZDZLSGWAFY-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1c(F)cccc1OC(F)F ZINC001207112376 1049837171 /nfs/dbraw/zinc/83/71/71/1049837171.db2.gz KLPWWEFAFFIGFK-UHFFFAOYSA-N 1 2 301.333 4.121 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1c(F)cccc1OC(F)F ZINC001207112376 1049837183 /nfs/dbraw/zinc/83/71/83/1049837183.db2.gz KLPWWEFAFFIGFK-UHFFFAOYSA-N 1 2 301.333 4.121 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1cccc(C(F)F)c1 ZINC001207126242 1049841187 /nfs/dbraw/zinc/84/11/87/1049841187.db2.gz QTWKHDNVUZYGKM-UHFFFAOYSA-N 1 2 302.777 4.366 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1cccc(C(F)F)c1 ZINC001207126242 1049841197 /nfs/dbraw/zinc/84/11/97/1049841197.db2.gz QTWKHDNVUZYGKM-UHFFFAOYSA-N 1 2 302.777 4.366 20 0 DIADLO CCn1ccnc1C[N@@H+]1CC[C@@H](c2cccc(Cl)c2Cl)C1 ZINC001207146521 1049845351 /nfs/dbraw/zinc/84/53/51/1049845351.db2.gz VCQYDPKKXKIBAL-GFCCVEGCSA-N 1 2 324.255 4.199 20 0 DIADLO CCn1ccnc1C[N@H+]1CC[C@@H](c2cccc(Cl)c2Cl)C1 ZINC001207146521 1049845362 /nfs/dbraw/zinc/84/53/62/1049845362.db2.gz VCQYDPKKXKIBAL-GFCCVEGCSA-N 1 2 324.255 4.199 20 0 DIADLO FC[C@@H]1CC[N@H+](C[C@H]2C[C@@H]2c2ccc(Cl)cc2)CC1(F)F ZINC001207184107 1049854200 /nfs/dbraw/zinc/85/42/00/1049854200.db2.gz ZELMHVBJVLQGMQ-VNHYZAJKSA-N 1 2 317.782 4.370 20 0 DIADLO FC[C@@H]1CC[N@@H+](C[C@H]2C[C@@H]2c2ccc(Cl)cc2)CC1(F)F ZINC001207184107 1049854205 /nfs/dbraw/zinc/85/42/05/1049854205.db2.gz ZELMHVBJVLQGMQ-VNHYZAJKSA-N 1 2 317.782 4.370 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccc3sc(C)nc3c2)c1C ZINC001207639741 1049920894 /nfs/dbraw/zinc/92/08/94/1049920894.db2.gz SNRPJEOLIHCTCB-UHFFFAOYSA-N 1 2 313.426 4.237 20 0 DIADLO Cc1cccc(C)c1C[N@H+](C)Cc1cccnc1Br ZINC001207680119 1049926655 /nfs/dbraw/zinc/92/66/55/1049926655.db2.gz WBFSSXWXKSFBGA-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cccc(C)c1C[N@@H+](C)Cc1cccnc1Br ZINC001207680119 1049926661 /nfs/dbraw/zinc/92/66/61/1049926661.db2.gz WBFSSXWXKSFBGA-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO FC(F)(F)c1ccc2c(Nc3ccncc3Cl)cc[nH+]c2c1 ZINC001212147069 1049926681 /nfs/dbraw/zinc/92/66/81/1049926681.db2.gz XMTFSMXWYVSBPF-UHFFFAOYSA-N 1 2 323.705 4.468 20 0 DIADLO CC[N@H+](Cc1ccoc1C)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001207814584 1049941186 /nfs/dbraw/zinc/94/11/86/1049941186.db2.gz YTDWEDMRSNQNIV-GFCCVEGCSA-N 1 2 304.459 4.191 20 0 DIADLO CC[N@@H+](Cc1ccoc1C)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001207814584 1049941179 /nfs/dbraw/zinc/94/11/79/1049941179.db2.gz YTDWEDMRSNQNIV-GFCCVEGCSA-N 1 2 304.459 4.191 20 0 DIADLO COc1ccc2c(c1)C[C@H]([NH2+][C@H](c1ccccc1)C(F)F)CC2 ZINC001207872279 1049949065 /nfs/dbraw/zinc/94/90/65/1049949065.db2.gz BANAVGJVJIYWCT-SJLPKXTDSA-N 1 2 317.379 4.149 20 0 DIADLO Nc1cc(Br)cc2c1ccn2-c1cc[nH+]cc1Cl ZINC001212153494 1049994942 /nfs/dbraw/zinc/99/49/42/1049994942.db2.gz RNNRVGLEXVQYTQ-UHFFFAOYSA-N 1 2 322.593 4.024 20 0 DIADLO CC(C)(C)[C@H]1CCCN(C(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC000572208972 1049998534 /nfs/dbraw/zinc/99/85/34/1049998534.db2.gz GMCYSACTHVWCQI-AWEZNQCLSA-N 1 2 314.433 4.014 20 0 DIADLO Cc1cn2cc(NC(=O)C3(c4cccc(C)c4)CCC3)ccc2[nH+]1 ZINC000588859166 1050006515 /nfs/dbraw/zinc/00/65/15/1050006515.db2.gz BNXOSVDKKWPAJD-UHFFFAOYSA-N 1 2 319.408 4.012 20 0 DIADLO C[C@@H](C[N@@H+]1CCO[C@@](C)(c2ccc(Cl)cc2)C1)C(F)(F)F ZINC001208890327 1050020420 /nfs/dbraw/zinc/02/04/20/1050020420.db2.gz DEZBJGIHLQGYHO-SMDDNHRTSA-N 1 2 321.770 4.086 20 0 DIADLO C[C@@H](C[N@H+]1CCO[C@@](C)(c2ccc(Cl)cc2)C1)C(F)(F)F ZINC001208890327 1050020424 /nfs/dbraw/zinc/02/04/24/1050020424.db2.gz DEZBJGIHLQGYHO-SMDDNHRTSA-N 1 2 321.770 4.086 20 0 DIADLO COC(=O)CCCCCCCCC[N@@H+]1CCCC(F)(F)C1 ZINC001209094281 1050035008 /nfs/dbraw/zinc/03/50/08/1050035008.db2.gz RMCTXYLDHBINQP-UHFFFAOYSA-N 1 2 305.409 4.011 20 0 DIADLO COC(=O)CCCCCCCCC[N@H+]1CCCC(F)(F)C1 ZINC001209094281 1050035010 /nfs/dbraw/zinc/03/50/10/1050035010.db2.gz RMCTXYLDHBINQP-UHFFFAOYSA-N 1 2 305.409 4.011 20 0 DIADLO C[N@H+](CC1=CSC(=C2SC=CS2)S1)C1(C)COC1 ZINC001209093977 1050035479 /nfs/dbraw/zinc/03/54/79/1050035479.db2.gz JTHGOUPMCDLIBH-UHFFFAOYSA-N 1 2 317.526 4.106 20 0 DIADLO C[N@@H+](CC1=CSC(=C2SC=CS2)S1)C1(C)COC1 ZINC001209093977 1050035484 /nfs/dbraw/zinc/03/54/84/1050035484.db2.gz JTHGOUPMCDLIBH-UHFFFAOYSA-N 1 2 317.526 4.106 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCO[C@@H](c3ccccc3)C2)c(Cl)c1 ZINC001209112739 1050035838 /nfs/dbraw/zinc/03/58/38/1050035838.db2.gz LRYLHSOKRPQHJB-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc(CC[N@H+]2CCO[C@@H](c3ccccc3)C2)c(Cl)c1 ZINC001209112739 1050035844 /nfs/dbraw/zinc/03/58/44/1050035844.db2.gz LRYLHSOKRPQHJB-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Cc1nc([C@H]([NH2+]C[C@@H](C)CC(C)C)c2ccc(Cl)cc2)no1 ZINC000572646783 1050038835 /nfs/dbraw/zinc/03/88/35/1050038835.db2.gz KSEZENFXDUQZPW-BLLLJJGKSA-N 1 2 321.852 4.393 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000589600553 1050048223 /nfs/dbraw/zinc/04/82/23/1050048223.db2.gz FPWPLXSPASFJNT-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000589600553 1050048228 /nfs/dbraw/zinc/04/82/28/1050048228.db2.gz FPWPLXSPASFJNT-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000589600559 1050048395 /nfs/dbraw/zinc/04/83/95/1050048395.db2.gz FPWPLXSPASFJNT-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000589600559 1050048402 /nfs/dbraw/zinc/04/84/02/1050048402.db2.gz FPWPLXSPASFJNT-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO CCOc1ccc([C@@H]([NH2+]Cc2nccs2)c2ccccc2)cc1 ZINC000589646123 1050053897 /nfs/dbraw/zinc/05/38/97/1050053897.db2.gz VJGKKNKZPMVGTI-IBGZPJMESA-N 1 2 324.449 4.421 20 0 DIADLO FC(F)(F)Oc1cccc(Cl)c1C[NH+]1C2CCC1CC2 ZINC001209521779 1050065877 /nfs/dbraw/zinc/06/58/77/1050065877.db2.gz QINAQQAEGVWHFE-UHFFFAOYSA-N 1 2 305.727 4.365 20 0 DIADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC001209557889 1050068712 /nfs/dbraw/zinc/06/87/12/1050068712.db2.gz BWNJVINWTFBQGN-HNNXBMFYSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC001209557889 1050068715 /nfs/dbraw/zinc/06/87/15/1050068715.db2.gz BWNJVINWTFBQGN-HNNXBMFYSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1cn2c(cccc2Nc2cccc(OCC(F)(F)F)c2)[nH+]1 ZINC001212161754 1050070739 /nfs/dbraw/zinc/07/07/39/1050070739.db2.gz BPAJRMSCCPSECL-UHFFFAOYSA-N 1 2 321.302 4.327 20 0 DIADLO Fc1ccccc1C[NH2+][C@@H](CN1CCCCC1)c1ccccc1 ZINC000590075077 1050074175 /nfs/dbraw/zinc/07/41/75/1050074175.db2.gz OOFMKJWQSQXRBF-FQEVSTJZSA-N 1 2 312.432 4.143 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)s1 ZINC000590346158 1050088220 /nfs/dbraw/zinc/08/82/20/1050088220.db2.gz WHZKUEUFKZDFQJ-HNNXBMFYSA-N 1 2 320.483 4.049 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)s1 ZINC000590346158 1050088225 /nfs/dbraw/zinc/08/82/25/1050088225.db2.gz WHZKUEUFKZDFQJ-HNNXBMFYSA-N 1 2 320.483 4.049 20 0 DIADLO Clc1ccc(Br)c(Nc2ccc3[nH]c[nH+]c3c2)n1 ZINC001209847312 1050095181 /nfs/dbraw/zinc/09/51/81/1050095181.db2.gz FTPMZQAVQYPOMM-UHFFFAOYSA-N 1 2 323.581 4.117 20 0 DIADLO COc1cc(C(F)(F)F)ccc1Nc1[nH+]c2ccccc2n1C ZINC001209881566 1050099741 /nfs/dbraw/zinc/09/97/41/1050099741.db2.gz PDGBVSBNILTYEO-UHFFFAOYSA-N 1 2 321.302 4.344 20 0 DIADLO COc1cc(Cl)ccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001209906261 1050103570 /nfs/dbraw/zinc/10/35/70/1050103570.db2.gz LCIOORVENZYRHU-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO c1cc2c(cccc2Nc2ccccc2C[NH+]2CCOCC2)o1 ZINC001209933516 1050108031 /nfs/dbraw/zinc/10/80/31/1050108031.db2.gz PQCKMTZKRVCEIK-UHFFFAOYSA-N 1 2 308.381 4.009 20 0 DIADLO Fc1cc(Cl)ccc1Nc1ccccc1C[NH+]1CCOCC1 ZINC001209929274 1050108105 /nfs/dbraw/zinc/10/81/05/1050108105.db2.gz PLDCUGTYHZUAMW-UHFFFAOYSA-N 1 2 320.795 4.055 20 0 DIADLO Cc1ccc(Cl)c(Nc2ccccc2C[NH+]2CCOCC2)c1 ZINC001209930858 1050108170 /nfs/dbraw/zinc/10/81/70/1050108170.db2.gz SKKVXXNWSHFMQT-UHFFFAOYSA-N 1 2 316.832 4.224 20 0 DIADLO CC(=O)Nc1cc(Nc2ccc([NH+](C)C)c(C)c2)ccc1Cl ZINC001210043640 1050127488 /nfs/dbraw/zinc/12/74/88/1050127488.db2.gz PRNIJUOTILNMSC-UHFFFAOYSA-N 1 2 317.820 4.416 20 0 DIADLO Cc1cc(Nc2cccc(Cn3cccn3)c2)ccc1[NH+](C)C ZINC001210040896 1050127714 /nfs/dbraw/zinc/12/77/14/1050127714.db2.gz DVKZUMPSGKQLQJ-UHFFFAOYSA-N 1 2 306.413 4.049 20 0 DIADLO Cc1nc(-c2ccc(Nc3ccc([NH+](C)C)c(C)c3)cc2)no1 ZINC001210042694 1050127906 /nfs/dbraw/zinc/12/79/06/1050127906.db2.gz ANONQOWKBHMPIK-UHFFFAOYSA-N 1 2 308.385 4.163 20 0 DIADLO Cc1cc(Nc2cc(N)cc(Br)c2)ccc1[NH+](C)C ZINC001210043863 1050127915 /nfs/dbraw/zinc/12/79/15/1050127915.db2.gz HHXIFRDVKPSAHV-UHFFFAOYSA-N 1 2 320.234 4.149 20 0 DIADLO CCOC(=O)c1nc(C2CC2)oc1Nc1ccc2c[nH+]ccc2c1 ZINC001210046544 1050128550 /nfs/dbraw/zinc/12/85/50/1050128550.db2.gz FSWBYIOLTMONFN-UHFFFAOYSA-N 1 2 323.352 4.021 20 0 DIADLO CSc1cc(Nc2cccc(OCC(F)(F)F)c2)cc[nH+]1 ZINC001212167068 1050128904 /nfs/dbraw/zinc/12/89/04/1050128904.db2.gz OCLWVDXFYXXQMD-UHFFFAOYSA-N 1 2 314.332 4.488 20 0 DIADLO c1cnc(Nc2ccc3c[nH+]ccc3c2)c(N2CCCCC2)c1 ZINC001210046974 1050129241 /nfs/dbraw/zinc/12/92/41/1050129241.db2.gz CGUQALLKKGKEHX-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO Cc1ccc2cc(N[C@@H]3CCc4ccc(O)cc4C3)[nH+]cc2c1 ZINC001171026890 1050150365 /nfs/dbraw/zinc/15/03/65/1050150365.db2.gz CQRGAUWIIZRITR-GOSISDBHSA-N 1 2 304.393 4.218 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@@H]2CCCC[C@@H]2C)no1)c1ccccc1 ZINC000573246560 1050153315 /nfs/dbraw/zinc/15/33/15/1050153315.db2.gz QUYLJYZUOIXUAO-USXIJHARSA-N 1 2 313.445 4.404 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@@H]2CCCC[C@@H]2C)no1)c1ccccc1 ZINC000573246560 1050153325 /nfs/dbraw/zinc/15/33/25/1050153325.db2.gz QUYLJYZUOIXUAO-USXIJHARSA-N 1 2 313.445 4.404 20 0 DIADLO C[C@H](CC(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2)C1CC1 ZINC000823769898 1050154677 /nfs/dbraw/zinc/15/46/77/1050154677.db2.gz IWZCOQYGZBNYMC-CQSZACIVSA-N 1 2 323.440 4.261 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1 ZINC000770428016 1050157671 /nfs/dbraw/zinc/15/76/71/1050157671.db2.gz GEFAZZINFMYZGE-MMOPVJDHSA-N 1 2 322.452 4.127 20 0 DIADLO Cc1cc(NCc2cnc(-c3ccncc3)s2)ccc1[NH+](C)C ZINC000770421458 1050158598 /nfs/dbraw/zinc/15/85/98/1050158598.db2.gz REGIUNOIFYSUOG-UHFFFAOYSA-N 1 2 324.453 4.192 20 0 DIADLO Fc1ccccc1-n1nccc1Nc1cccc2cc[nH+]cc21 ZINC001210226213 1050168041 /nfs/dbraw/zinc/16/80/41/1050168041.db2.gz UQGCVPUOEXHODF-UHFFFAOYSA-N 1 2 304.328 4.303 20 0 DIADLO COc1ccc(-n2nccc2Nc2cccc3cc[nH+]cc32)cc1 ZINC001210226180 1050168161 /nfs/dbraw/zinc/16/81/61/1050168161.db2.gz SMPYHGQWLNDPTC-UHFFFAOYSA-N 1 2 316.364 4.173 20 0 DIADLO COCCNc1cccc(F)c1Nc1cccc2cc[nH+]cc21 ZINC001210231762 1050169779 /nfs/dbraw/zinc/16/97/79/1050169779.db2.gz FEBUNMDTHQBZNV-UHFFFAOYSA-N 1 2 311.360 4.176 20 0 DIADLO COc1ccc2c(c1Nc1cccc3cc[nH+]cc31)C(=O)CC2 ZINC001210232756 1050170149 /nfs/dbraw/zinc/17/01/49/1050170149.db2.gz UVPJEQKKGGYWHT-UHFFFAOYSA-N 1 2 304.349 4.116 20 0 DIADLO COC(=O)c1cc(F)c(Nc2cccc3cc[nH+]cc32)cc1F ZINC001210232189 1050170240 /nfs/dbraw/zinc/17/02/40/1050170240.db2.gz IFEBGDFJFNOQBN-UHFFFAOYSA-N 1 2 314.291 4.043 20 0 DIADLO Nc1ccc(OC(F)(F)F)c(Nc2cccc3cc[nH+]cc32)c1 ZINC001210232930 1050170255 /nfs/dbraw/zinc/17/02/55/1050170255.db2.gz YPYQQGGKHVEFHZ-UHFFFAOYSA-N 1 2 319.286 4.459 20 0 DIADLO FC(F)(F)c1ncccc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001210233849 1050172607 /nfs/dbraw/zinc/17/26/07/1050172607.db2.gz WRDWUPNCVZGLMK-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nc3cccc(Cl)c3n2C)oc1C ZINC000282699480 1050179554 /nfs/dbraw/zinc/17/95/54/1050179554.db2.gz KUJPVOKGSZJEQW-LLVKDONJSA-N 1 2 317.820 4.287 20 0 DIADLO Cc1[nH+]c(C(C)(C)C)nc(NCCC(=O)c2ccccc2)c1C ZINC001170015916 1050181278 /nfs/dbraw/zinc/18/12/78/1050181278.db2.gz XEDPVQNCIDPMDV-UHFFFAOYSA-N 1 2 311.429 4.076 20 0 DIADLO Cc1[nH+]cc(Nc2cc(-c3ccccc3Cl)no2)cc1N ZINC001210287588 1050191459 /nfs/dbraw/zinc/19/14/59/1050191459.db2.gz XQAMQAVWGBBFNQ-UHFFFAOYSA-N 1 2 300.749 4.024 20 0 DIADLO Cc1[nH+]cc(Nc2cc(F)c(C(F)(F)F)cc2F)cc1N ZINC001210290297 1050191668 /nfs/dbraw/zinc/19/16/68/1050191668.db2.gz JGAINLLBFSHSLV-UHFFFAOYSA-N 1 2 303.234 4.013 20 0 DIADLO Cc1[nH+]cc(Nc2cc(Cl)c(F)c(Cl)c2F)cc1N ZINC001210290463 1050191758 /nfs/dbraw/zinc/19/17/58/1050191758.db2.gz LSXUGHWXIABQGB-UHFFFAOYSA-N 1 2 304.127 4.301 20 0 DIADLO Cc1[nH+]cc(Nc2cc(-c3ccccc3)nn2C(C)C)cc1N ZINC001210289067 1050191786 /nfs/dbraw/zinc/19/17/86/1050191786.db2.gz SPUCKTDRUODUII-UHFFFAOYSA-N 1 2 307.401 4.160 20 0 DIADLO Cc1cc(Oc2ccc(Nc3cnc(C)c(N)c3)cc2)cc[nH+]1 ZINC001210289530 1050191943 /nfs/dbraw/zinc/19/19/43/1050191943.db2.gz PUUHOOVJAASZDH-UHFFFAOYSA-N 1 2 306.369 4.212 20 0 DIADLO COc1ccccc1-c1cccc(Nc2c[nH+]c(C)c(N)c2)c1 ZINC001210287733 1050192268 /nfs/dbraw/zinc/19/22/68/1050192268.db2.gz BXKGEPBFBQCNED-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(C(F)(F)F)c(C)c1 ZINC001210305554 1050200723 /nfs/dbraw/zinc/20/07/23/1050200723.db2.gz RYLONPMEXAVFLA-UHFFFAOYSA-N 1 2 305.303 4.243 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1cc2c(cccc2Cl)[nH]1 ZINC001136863662 1050200901 /nfs/dbraw/zinc/20/09/01/1050200901.db2.gz LYAADUSPPDRFQB-UHFFFAOYSA-N 1 2 312.800 4.136 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1cc2c(cccc2Cl)[nH]1 ZINC001136863662 1050200911 /nfs/dbraw/zinc/20/09/11/1050200911.db2.gz LYAADUSPPDRFQB-UHFFFAOYSA-N 1 2 312.800 4.136 20 0 DIADLO O=C(OCc1cccc2[nH+]ccn21)c1ccc(-c2ccco2)s1 ZINC000770925387 1050204351 /nfs/dbraw/zinc/20/43/51/1050204351.db2.gz MWPCHANAZFRNAB-UHFFFAOYSA-N 1 2 324.361 4.013 20 0 DIADLO CC(=O)c1ccc([C@H](C)Nc2[nH+]cccc2[Si](C)(C)C)cc1 ZINC001171053957 1050205890 /nfs/dbraw/zinc/20/58/90/1050205890.db2.gz MPHQCTABZFPBMC-ZDUSSCGKSA-N 1 2 312.489 4.003 20 0 DIADLO Cc1nonc1C[N@@H+]([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000734147834 1050233460 /nfs/dbraw/zinc/23/34/60/1050233460.db2.gz ZJJDUJDGLGTWBI-CQSZACIVSA-N 1 2 307.397 4.257 20 0 DIADLO Cc1nonc1C[N@H+]([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000734147834 1050233475 /nfs/dbraw/zinc/23/34/75/1050233475.db2.gz ZJJDUJDGLGTWBI-CQSZACIVSA-N 1 2 307.397 4.257 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c4ccccc4[nH]c3C2)cc(C)c1O ZINC000573725233 1050247783 /nfs/dbraw/zinc/24/77/83/1050247783.db2.gz HPKDNPKMZFINSZ-UHFFFAOYSA-N 1 2 306.409 4.049 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c4ccccc4[nH]c3C2)cc(C)c1O ZINC000573725233 1050247794 /nfs/dbraw/zinc/24/77/94/1050247794.db2.gz HPKDNPKMZFINSZ-UHFFFAOYSA-N 1 2 306.409 4.049 20 0 DIADLO c1ccc2sc(C[N@@H+]3CCCC[C@H]3c3cccnc3)nc2c1 ZINC001136953499 1050249249 /nfs/dbraw/zinc/24/92/49/1050249249.db2.gz HSRWPGOTYUGYAH-INIZCTEOSA-N 1 2 309.438 4.419 20 0 DIADLO c1ccc2sc(C[N@H+]3CCCC[C@H]3c3cccnc3)nc2c1 ZINC001136953499 1050249259 /nfs/dbraw/zinc/24/92/59/1050249259.db2.gz HSRWPGOTYUGYAH-INIZCTEOSA-N 1 2 309.438 4.419 20 0 DIADLO c1ccc(COC[C@H]2CC[N@@H+]2Cc2nc3ccccc3s2)cc1 ZINC001136953603 1050250664 /nfs/dbraw/zinc/25/06/64/1050250664.db2.gz OJZGSOMBKUWIPW-MRXNPFEDSA-N 1 2 324.449 4.087 20 0 DIADLO c1ccc(COC[C@H]2CC[N@H+]2Cc2nc3ccccc3s2)cc1 ZINC001136953603 1050250672 /nfs/dbraw/zinc/25/06/72/1050250672.db2.gz OJZGSOMBKUWIPW-MRXNPFEDSA-N 1 2 324.449 4.087 20 0 DIADLO CCc1nc(C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)co1 ZINC000825062094 1050271435 /nfs/dbraw/zinc/27/14/35/1050271435.db2.gz OIFHDUSSRUOHMF-UHFFFAOYSA-N 1 2 318.726 4.199 20 0 DIADLO Clc1cncc(C[N@H+](Cc2ccccc2)Cc2ccccn2)c1 ZINC001136989349 1050273772 /nfs/dbraw/zinc/27/37/72/1050273772.db2.gz GNACCXQMBAGEBD-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1cncc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)c1 ZINC001136989349 1050273788 /nfs/dbraw/zinc/27/37/88/1050273788.db2.gz GNACCXQMBAGEBD-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cncc(Cl)c1 ZINC001136997774 1050281476 /nfs/dbraw/zinc/28/14/76/1050281476.db2.gz OACVUCMKXJTWNU-QGZVFWFLSA-N 1 2 316.832 4.218 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cncc(Cl)c1 ZINC001136997774 1050281485 /nfs/dbraw/zinc/28/14/85/1050281485.db2.gz OACVUCMKXJTWNU-QGZVFWFLSA-N 1 2 316.832 4.218 20 0 DIADLO C[N@H+](Cc1nc(C(F)(F)F)c[nH]1)Cc1cccc2ccccc21 ZINC001137015758 1050292354 /nfs/dbraw/zinc/29/23/54/1050292354.db2.gz VPORTINUKSCXPM-UHFFFAOYSA-N 1 2 319.330 4.214 20 0 DIADLO C[N@@H+](Cc1nc(C(F)(F)F)c[nH]1)Cc1cccc2ccccc21 ZINC001137015758 1050292364 /nfs/dbraw/zinc/29/23/64/1050292364.db2.gz VPORTINUKSCXPM-UHFFFAOYSA-N 1 2 319.330 4.214 20 0 DIADLO CC(C)(O)c1ccc(Nc2ccc[nH+]c2N2CCCCC2)cc1 ZINC001210618157 1050315429 /nfs/dbraw/zinc/31/54/29/1050315429.db2.gz YRPJRKQOCVWOMG-UHFFFAOYSA-N 1 2 311.429 4.043 20 0 DIADLO COc1ccc(F)c(C[N@H+](C)Cc2ccc(C)cc2)c1Cl ZINC001143369889 1050318992 /nfs/dbraw/zinc/31/89/92/1050318992.db2.gz ZJHAMIIFYDEUMS-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1ccc(F)c(C[N@@H+](C)Cc2ccc(C)cc2)c1Cl ZINC001143369889 1050318996 /nfs/dbraw/zinc/31/89/96/1050318996.db2.gz ZJHAMIIFYDEUMS-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO Cc1cc(Nc2ccc([NH+]3CCCCC3)cc2)nc(C2CC2)n1 ZINC000734835519 1050324033 /nfs/dbraw/zinc/32/40/33/1050324033.db2.gz XIXHAFVDZDLTJN-UHFFFAOYSA-N 1 2 308.429 4.396 20 0 DIADLO FC1CC[NH+](Cc2cc(Cl)ccc2OC(F)(F)F)CC1 ZINC001143698833 1050337508 /nfs/dbraw/zinc/33/75/08/1050337508.db2.gz LUMJRRZXDFICFU-UHFFFAOYSA-N 1 2 311.706 4.173 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2Cl)CCCC1=O ZINC001143709522 1050343386 /nfs/dbraw/zinc/34/33/86/1050343386.db2.gz FXQZTAZEPURYTJ-JTQLQIEISA-N 1 2 319.754 4.160 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(C(F)(F)F)cc2Cl)CCCC1=O ZINC001143709522 1050343402 /nfs/dbraw/zinc/34/34/02/1050343402.db2.gz FXQZTAZEPURYTJ-JTQLQIEISA-N 1 2 319.754 4.160 20 0 DIADLO CCc1noc(C[N@@H+](CC)C(c2ccccc2)c2ccccc2)n1 ZINC000592813639 1050343920 /nfs/dbraw/zinc/34/39/20/1050343920.db2.gz VKCGNARNCHLMQU-UHFFFAOYSA-N 1 2 321.424 4.244 20 0 DIADLO CCc1noc(C[N@H+](CC)C(c2ccccc2)c2ccccc2)n1 ZINC000592813639 1050343929 /nfs/dbraw/zinc/34/39/29/1050343929.db2.gz VKCGNARNCHLMQU-UHFFFAOYSA-N 1 2 321.424 4.244 20 0 DIADLO C[N@H+](Cc1c(F)ccc(Cl)c1Cl)C[C@H]1CCCCO1 ZINC001143859969 1050378837 /nfs/dbraw/zinc/37/88/37/1050378837.db2.gz FKZPZEKMNILYQS-SNVBAGLBSA-N 1 2 306.208 4.133 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(OCC(F)(F)F)cc3)ccc21 ZINC001210743027 1050359436 /nfs/dbraw/zinc/35/94/36/1050359436.db2.gz FNAZYUPFQVPOTL-UHFFFAOYSA-N 1 2 321.302 4.258 20 0 DIADLO C[C@H]1CC[C@@H](CO)C[N@@H+]1Cc1c(Cl)cc(Cl)cc1Cl ZINC001143797678 1050364037 /nfs/dbraw/zinc/36/40/37/1050364037.db2.gz OSYCXILOYGHZHE-VHSXEESVSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1CC[C@@H](CO)C[N@H+]1Cc1c(Cl)cc(Cl)cc1Cl ZINC001143797678 1050364045 /nfs/dbraw/zinc/36/40/45/1050364045.db2.gz OSYCXILOYGHZHE-VHSXEESVSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)CCCC1=O ZINC001143803814 1050365269 /nfs/dbraw/zinc/36/52/69/1050365269.db2.gz BNUPYCHDDXJUSS-SNVBAGLBSA-N 1 2 319.754 4.160 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)CCCC1=O ZINC001143803814 1050365278 /nfs/dbraw/zinc/36/52/78/1050365278.db2.gz BNUPYCHDDXJUSS-SNVBAGLBSA-N 1 2 319.754 4.160 20 0 DIADLO Clc1cc(Cl)c(C[N@@H+]2CCC[C@]23CCOC3)c(Cl)c1 ZINC001143801859 1050366672 /nfs/dbraw/zinc/36/66/72/1050366672.db2.gz ZOCWMDPZVWBZBP-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1cc(Cl)c(C[N@H+]2CCC[C@]23CCOC3)c(Cl)c1 ZINC001143801859 1050366678 /nfs/dbraw/zinc/36/66/78/1050366678.db2.gz ZOCWMDPZVWBZBP-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO CCOc1c(Cl)ccc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)c1F ZINC001143824328 1050368341 /nfs/dbraw/zinc/36/83/41/1050368341.db2.gz ADEWJKLNAGDLBO-SNVBAGLBSA-N 1 2 321.770 4.355 20 0 DIADLO CCOc1c(Cl)ccc(C[N@H+]2CCC(F)(F)[C@H](C)C2)c1F ZINC001143824328 1050368345 /nfs/dbraw/zinc/36/83/45/1050368345.db2.gz ADEWJKLNAGDLBO-SNVBAGLBSA-N 1 2 321.770 4.355 20 0 DIADLO C[N@H+](Cc1c(F)ccc(F)c1Br)CC(C)(C)C ZINC001143819757 1050368385 /nfs/dbraw/zinc/36/83/85/1050368385.db2.gz MHGABWGFOBKHSO-UHFFFAOYSA-N 1 2 306.194 4.205 20 0 DIADLO C[N@@H+](Cc1c(F)ccc(F)c1Br)CC(C)(C)C ZINC001143819757 1050368389 /nfs/dbraw/zinc/36/83/89/1050368389.db2.gz MHGABWGFOBKHSO-UHFFFAOYSA-N 1 2 306.194 4.205 20 0 DIADLO CC(C)([NH2+]Cc1occc1Br)c1ccc(F)cc1 ZINC000735322075 1050370791 /nfs/dbraw/zinc/37/07/91/1050370791.db2.gz BTQUYECTDSPFIH-UHFFFAOYSA-N 1 2 312.182 4.206 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@H](c1ccccc1F)C1CCCC1 ZINC000826626304 1050374505 /nfs/dbraw/zinc/37/45/05/1050374505.db2.gz HROUPYAZRLHLNN-DIFFPNOSSA-N 1 2 303.381 4.099 20 0 DIADLO CCOc1c(Cl)ccc(C[N@@H+]2CCC[C@@H](C(F)F)C2)c1F ZINC001143831451 1050376845 /nfs/dbraw/zinc/37/68/45/1050376845.db2.gz NRHYADZICSAMLP-LLVKDONJSA-N 1 2 321.770 4.355 20 0 DIADLO CCOc1c(Cl)ccc(C[N@H+]2CCC[C@@H](C(F)F)C2)c1F ZINC001143831451 1050376857 /nfs/dbraw/zinc/37/68/57/1050376857.db2.gz NRHYADZICSAMLP-LLVKDONJSA-N 1 2 321.770 4.355 20 0 DIADLO C[N@@H+](Cc1c(F)ccc(Cl)c1Cl)C[C@H]1CCCCO1 ZINC001143859969 1050378823 /nfs/dbraw/zinc/37/88/23/1050378823.db2.gz FKZPZEKMNILYQS-SNVBAGLBSA-N 1 2 306.208 4.133 20 0 DIADLO CC(C)(C)C[C@@H]1CN(C[N@@H+]2CCC[C@H]2c2ccsc2)C(=O)O1 ZINC000785498794 1050383289 /nfs/dbraw/zinc/38/32/89/1050383289.db2.gz IKCLLIYILBKEMG-CABCVRRESA-N 1 2 322.474 4.100 20 0 DIADLO CC(C)(C)C[C@@H]1CN(C[N@H+]2CCC[C@H]2c2ccsc2)C(=O)O1 ZINC000785498794 1050383293 /nfs/dbraw/zinc/38/32/93/1050383293.db2.gz IKCLLIYILBKEMG-CABCVRRESA-N 1 2 322.474 4.100 20 0 DIADLO CCOCC1CC[NH+](Cc2c(F)ccc(Cl)c2Cl)CC1 ZINC001143866868 1050385274 /nfs/dbraw/zinc/38/52/74/1050385274.db2.gz NPVNPAMBINYQCF-UHFFFAOYSA-N 1 2 320.235 4.381 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+]Cc1sccc1Cl)CCC2 ZINC000785515514 1050385735 /nfs/dbraw/zinc/38/57/35/1050385735.db2.gz ZITZJUHUWGRBPT-CYBMUJFWSA-N 1 2 309.866 4.346 20 0 DIADLO COc1ccc(Cl)c(C[NH+]2CC(c3ccccc3)C2)c1F ZINC001143897923 1050396502 /nfs/dbraw/zinc/39/65/02/1050396502.db2.gz JQPNZXKKWKLNCY-UHFFFAOYSA-N 1 2 305.780 4.087 20 0 DIADLO Cc1nc(C)c(C[N@H+](Cc2ccccn2)Cc2ccccc2C)o1 ZINC000844333321 1050399757 /nfs/dbraw/zinc/39/97/57/1050399757.db2.gz HBOIWBOCVROVFD-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1nc(C)c(C[N@@H+](Cc2ccccn2)Cc2ccccc2C)o1 ZINC000844333321 1050399764 /nfs/dbraw/zinc/39/97/64/1050399764.db2.gz HBOIWBOCVROVFD-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Clc1ccccc1C1([NH2+]Cc2nc3ccccc3[nH]2)CCC1 ZINC000844349197 1050402896 /nfs/dbraw/zinc/40/28/96/1050402896.db2.gz HGNHUVLKVACFOU-UHFFFAOYSA-N 1 2 311.816 4.385 20 0 DIADLO Clc1cccc2c(N[C@H]3CCOC4(CCC4)C3)cc[nH+]c12 ZINC000574281745 1050408362 /nfs/dbraw/zinc/40/83/62/1050408362.db2.gz INMRNMSRAQCMLO-LBPRGKRZSA-N 1 2 302.805 4.402 20 0 DIADLO Cc1cc(NC(=O)C23CCC(CC2)C3(C)C)ccc1-n1cc[nH+]c1 ZINC001143939984 1050410777 /nfs/dbraw/zinc/41/07/77/1050410777.db2.gz RLNDSFVYJGRHSZ-UHFFFAOYSA-N 1 2 323.440 4.336 20 0 DIADLO CC[C@H]1CCC[C@@]1(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001143939848 1050410937 /nfs/dbraw/zinc/41/09/37/1050410937.db2.gz PDJTZBLKYJEBSU-HNAYVOBHSA-N 1 2 311.429 4.336 20 0 DIADLO CCOc1ccc(F)c(C[N@H+](C)Cc2ccc(C)cc2)c1F ZINC001143937623 1050411098 /nfs/dbraw/zinc/41/10/98/1050411098.db2.gz TXNZNHUPSIKLBM-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CCOc1ccc(F)c(C[N@@H+](C)Cc2ccc(C)cc2)c1F ZINC001143937623 1050411104 /nfs/dbraw/zinc/41/11/04/1050411104.db2.gz TXNZNHUPSIKLBM-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CC1(C)C[N@H+](Cc2c(Cl)ccc(F)c2F)CCC1(F)F ZINC001143946837 1050412331 /nfs/dbraw/zinc/41/23/31/1050412331.db2.gz XRGOSCMRPZYWKY-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(Cl)ccc(F)c2F)CCC1(F)F ZINC001143946837 1050412338 /nfs/dbraw/zinc/41/23/38/1050412338.db2.gz XRGOSCMRPZYWKY-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO Fc1ccc(Cl)c(C[NH+]2CCC(c3cccnc3)CC2)c1F ZINC001143959015 1050417287 /nfs/dbraw/zinc/41/72/87/1050417287.db2.gz XQKFVJXUHDGBLH-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO CC[C@@H](OC(=O)C[C@@H](C)n1cc[nH+]c1)c1c(F)cccc1Cl ZINC000844428804 1050421265 /nfs/dbraw/zinc/42/12/65/1050421265.db2.gz LXZPPGVKWMTUKB-BXUZGUMPSA-N 1 2 324.783 4.321 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2cccnc2Cl)[C@@H]1c1ccccc1 ZINC000735674594 1050422020 /nfs/dbraw/zinc/42/20/20/1050422020.db2.gz RROIGRWFRRUKDS-BBRMVZONSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2cccnc2Cl)[C@@H]1c1ccccc1 ZINC000735674594 1050422025 /nfs/dbraw/zinc/42/20/25/1050422025.db2.gz RROIGRWFRRUKDS-BBRMVZONSA-N 1 2 318.873 4.414 20 0 DIADLO O=C1CCCc2ccc(Nc3cccc(-n4cc[nH+]c4)c3)cc21 ZINC001210933433 1050422515 /nfs/dbraw/zinc/42/25/15/1050422515.db2.gz DGYALBSDKSNEIJ-UHFFFAOYSA-N 1 2 303.365 4.135 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)cs1 ZINC000844434557 1050424375 /nfs/dbraw/zinc/42/43/75/1050424375.db2.gz LEXPIPGWGPWNLR-AWEZNQCLSA-N 1 2 300.418 4.062 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@]3(CC3(F)F)C2)cs1 ZINC000844434557 1050424381 /nfs/dbraw/zinc/42/43/81/1050424381.db2.gz LEXPIPGWGPWNLR-AWEZNQCLSA-N 1 2 300.418 4.062 20 0 DIADLO Cc1ccc([C@@H]2CCC[C@H]2OC(=O)C[C@@H](C)n2cc[nH+]c2)cc1 ZINC000844480400 1050429213 /nfs/dbraw/zinc/42/92/13/1050429213.db2.gz FKPWRMZHGCWEQK-BPQIPLTHSA-N 1 2 312.413 4.022 20 0 DIADLO CC[C@@H](OC(=O)C[C@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC000844462396 1050432803 /nfs/dbraw/zinc/43/28/03/1050432803.db2.gz NGFYZEJZUJVYJZ-SWLSCSKDSA-N 1 2 306.793 4.182 20 0 DIADLO CC(C)[C@@H](OC(=O)C[C@H](C)n1cc[nH+]c1)c1ccc(F)c(F)c1 ZINC000844465401 1050434489 /nfs/dbraw/zinc/43/44/89/1050434489.db2.gz YWPJTUOXKOQVDU-YVEFUNNKSA-N 1 2 322.355 4.053 20 0 DIADLO CC[C@H](OC(=O)C[C@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1F ZINC000844463905 1050435546 /nfs/dbraw/zinc/43/55/46/1050435546.db2.gz ZENJKSZSEYSLHL-NHYWBVRUSA-N 1 2 324.783 4.321 20 0 DIADLO Cc1cc(C)c2[nH+]c(N[C@H]3NC(=O)c4ccccc43)cc(C)c2c1 ZINC001171126411 1050435731 /nfs/dbraw/zinc/43/57/31/1050435731.db2.gz PDLFFUOFBUEINZ-IBGZPJMESA-N 1 2 317.392 4.014 20 0 DIADLO CC[C@@H](OC(=O)C[C@@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1F ZINC000844463904 1050435898 /nfs/dbraw/zinc/43/58/98/1050435898.db2.gz ZENJKSZSEYSLHL-IAQYHMDHSA-N 1 2 324.783 4.321 20 0 DIADLO Cc1cc(Nc2[nH+]cccc2C(C)C)ccc1N1CCOCC1 ZINC001210973965 1050437670 /nfs/dbraw/zinc/43/76/70/1050437670.db2.gz DLJZAEALXFZJPO-UHFFFAOYSA-N 1 2 311.429 4.094 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2CCCC[C@@](C)(F)C2)cc1F ZINC001144020112 1050442966 /nfs/dbraw/zinc/44/29/66/1050442966.db2.gz AQSUHQSXTJCXEY-MRXNPFEDSA-N 1 2 301.352 4.078 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2CCCC[C@@](C)(F)C2)cc1F ZINC001144020112 1050442969 /nfs/dbraw/zinc/44/29/69/1050442969.db2.gz AQSUHQSXTJCXEY-MRXNPFEDSA-N 1 2 301.352 4.078 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@@H+]1Cc1nc(C2CCC2)no1 ZINC001171132615 1050450759 /nfs/dbraw/zinc/45/07/59/1050450759.db2.gz GXZPUZKIWZBAMB-INIZCTEOSA-N 1 2 315.392 4.122 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@H+]1Cc1nc(C2CCC2)no1 ZINC001171132615 1050450765 /nfs/dbraw/zinc/45/07/65/1050450765.db2.gz GXZPUZKIWZBAMB-INIZCTEOSA-N 1 2 315.392 4.122 20 0 DIADLO CN(c1ccc(Nc2cnncc2Cl)c[nH+]1)C1CCCCC1 ZINC001212613477 1050488513 /nfs/dbraw/zinc/48/85/13/1050488513.db2.gz WANTUXGNXVCWOJ-UHFFFAOYSA-N 1 2 317.824 4.038 20 0 DIADLO Nc1ccc(C(F)(F)F)cc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001211149917 1050498401 /nfs/dbraw/zinc/49/84/01/1050498401.db2.gz YJKMKVUTBULCKF-UHFFFAOYSA-N 1 2 318.302 4.217 20 0 DIADLO CC(C)c1noc(C[NH2+]C(C)(C)c2ccc(C(C)C)cc2)n1 ZINC000594396208 1050505990 /nfs/dbraw/zinc/50/59/90/1050505990.db2.gz MRZGVULITKHHTD-UHFFFAOYSA-N 1 2 301.434 4.341 20 0 DIADLO CC(C)[C@@H](Nc1ccc(Cn2cc[nH+]c2)cn1)c1ccc(F)cc1 ZINC001170063122 1050508988 /nfs/dbraw/zinc/50/89/88/1050508988.db2.gz MKVNCCFDMBGYEC-LJQANCHMSA-N 1 2 324.403 4.275 20 0 DIADLO CC[N@H+](Cn1nc(-c2sccc2C)oc1=S)C1CCC1 ZINC000738051640 1050520575 /nfs/dbraw/zinc/52/05/75/1050520575.db2.gz BJJOQXSQJNDHHU-UHFFFAOYSA-N 1 2 309.460 4.074 20 0 DIADLO CC[N@@H+](Cn1nc(-c2sccc2C)oc1=S)C1CCC1 ZINC000738051640 1050520590 /nfs/dbraw/zinc/52/05/90/1050520590.db2.gz BJJOQXSQJNDHHU-UHFFFAOYSA-N 1 2 309.460 4.074 20 0 DIADLO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cn1nnc2ccccc2c1=S ZINC000738060046 1050524111 /nfs/dbraw/zinc/52/41/11/1050524111.db2.gz ZUHDBUWKBAAYFE-CJNGLKHVSA-N 1 2 316.474 4.019 20 0 DIADLO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cn1nnc2ccccc2c1=S ZINC000738060046 1050524125 /nfs/dbraw/zinc/52/41/25/1050524125.db2.gz ZUHDBUWKBAAYFE-CJNGLKHVSA-N 1 2 316.474 4.019 20 0 DIADLO CO[C@H](c1ccccc1)[C@H](C)Nc1ccc2c(c1)CCC[N@H+]2C ZINC000786903604 1050525787 /nfs/dbraw/zinc/52/57/87/1050525787.db2.gz YMNJOGFJCLMELP-YWZLYKJASA-N 1 2 310.441 4.257 20 0 DIADLO CO[C@H](c1ccccc1)[C@H](C)Nc1ccc2c(c1)CCC[N@@H+]2C ZINC000786903604 1050525802 /nfs/dbraw/zinc/52/58/02/1050525802.db2.gz YMNJOGFJCLMELP-YWZLYKJASA-N 1 2 310.441 4.257 20 0 DIADLO Cc1occc1Nc1cc[nH+]c2ccc(Br)cc12 ZINC001211237017 1050526036 /nfs/dbraw/zinc/52/60/36/1050526036.db2.gz IKFCWUIZVDYSJE-UHFFFAOYSA-N 1 2 303.159 4.064 20 0 DIADLO Cc1ccc([C@@H]2[C@@H](C)CCC[N@@H+]2Cn2ncsc2=S)cc1 ZINC000738284977 1050526792 /nfs/dbraw/zinc/52/67/92/1050526792.db2.gz NSEXNUKFCAHLDR-ZFWWWQNUSA-N 1 2 319.499 4.413 20 0 DIADLO Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2Cn2ncsc2=S)cc1 ZINC000738284977 1050526802 /nfs/dbraw/zinc/52/68/02/1050526802.db2.gz NSEXNUKFCAHLDR-ZFWWWQNUSA-N 1 2 319.499 4.413 20 0 DIADLO C[C@H]1CCCCC[N@@H+]1Cn1nc(-c2ccccc2)oc1=S ZINC000738226230 1050528201 /nfs/dbraw/zinc/52/82/01/1050528201.db2.gz WDGUUKHWKJJYNQ-ZDUSSCGKSA-N 1 2 303.431 4.095 20 0 DIADLO C[C@H]1CCCCC[N@H+]1Cn1nc(-c2ccccc2)oc1=S ZINC000738226230 1050528216 /nfs/dbraw/zinc/52/82/16/1050528216.db2.gz WDGUUKHWKJJYNQ-ZDUSSCGKSA-N 1 2 303.431 4.095 20 0 DIADLO Cc1cccc(Nc2ccc3c(cnn3C(=O)OC(C)(C)C)c2)[nH+]1 ZINC001211253304 1050529429 /nfs/dbraw/zinc/52/94/29/1050529429.db2.gz DYKNOOTWWLAVGR-UHFFFAOYSA-N 1 2 324.384 4.267 20 0 DIADLO Clc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)c(Cl)n1 ZINC001211274138 1050531437 /nfs/dbraw/zinc/53/14/37/1050531437.db2.gz CZGDPVMTFPDRMM-UHFFFAOYSA-N 1 2 305.168 4.318 20 0 DIADLO Clc1ccc(Nc2ccccc2-n2cc[nH+]c2)c(Cl)n1 ZINC001211274192 1050532273 /nfs/dbraw/zinc/53/22/73/1050532273.db2.gz FOPXKRRNFVOXQG-UHFFFAOYSA-N 1 2 305.168 4.318 20 0 DIADLO C[C@@H](OC(=O)C[C@H](C)n1cc[nH+]c1)c1cccc2ccccc21 ZINC000845280014 1050560514 /nfs/dbraw/zinc/56/05/14/1050560514.db2.gz ANILKHYSNWVWPA-LSDHHAIUSA-N 1 2 308.381 4.292 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(Cn2cc[nH+]c2)cc1)c1ccccc1 ZINC001144426097 1050571304 /nfs/dbraw/zinc/57/13/04/1050571304.db2.gz KSARCZFARYDRLH-MRXNPFEDSA-N 1 2 319.408 4.064 20 0 DIADLO CCC(C)(C)c1ccc(OC(=O)C[C@H](C)n2cc[nH+]c2)cc1 ZINC000845441470 1050580450 /nfs/dbraw/zinc/58/04/50/1050580450.db2.gz SGPQGCQEYKWUSN-AWEZNQCLSA-N 1 2 300.402 4.127 20 0 DIADLO FC(F)(F)Oc1ccnc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213087961 1050582679 /nfs/dbraw/zinc/58/26/79/1050582679.db2.gz ITJZZYWWKMCMBV-UHFFFAOYSA-N 1 2 320.274 4.114 20 0 DIADLO CC(C)COC[C@@H]([NH2+]Cc1ccc2ccccc2n1)c1ccco1 ZINC000174328737 1050582969 /nfs/dbraw/zinc/58/29/69/1050582969.db2.gz BTOUDWFJSRELQK-LJQANCHMSA-N 1 2 324.424 4.331 20 0 DIADLO Cc1ccc(-n2nccc2Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001213087274 1050583106 /nfs/dbraw/zinc/58/31/06/1050583106.db2.gz NWEFWQVOIUJEQK-UHFFFAOYSA-N 1 2 315.380 4.314 20 0 DIADLO C[C@H](CC(=O)O[C@H](c1ccccc1)C1CCCC1)n1cc[nH+]c1 ZINC000845465863 1050583223 /nfs/dbraw/zinc/58/32/23/1050583223.db2.gz PVQGTYBBIYCOSL-DNVCBOLYSA-N 1 2 312.413 4.309 20 0 DIADLO Fc1ccccc1-n1nccc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213087121 1050583513 /nfs/dbraw/zinc/58/35/13/1050583513.db2.gz JFWNODPYTDVELL-UHFFFAOYSA-N 1 2 319.343 4.145 20 0 DIADLO Cc1cccc(-n2nccc2Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213087754 1050583573 /nfs/dbraw/zinc/58/35/73/1050583573.db2.gz YWDFWTKHBGIHNR-UHFFFAOYSA-N 1 2 315.380 4.314 20 0 DIADLO C[C@H](CC(=O)O[C@@H](c1ccccc1)C1CCCC1)n1cc[nH+]c1 ZINC000845465862 1050584465 /nfs/dbraw/zinc/58/44/65/1050584465.db2.gz PVQGTYBBIYCOSL-BEFAXECRSA-N 1 2 312.413 4.309 20 0 DIADLO COC(=O)c1ccc(C)c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1C ZINC001213091082 1050584899 /nfs/dbraw/zinc/58/48/99/1050584899.db2.gz VQEGRNSOSIUOLC-UHFFFAOYSA-N 1 2 321.380 4.224 20 0 DIADLO Nc1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(C(F)(F)F)c1 ZINC001213089043 1050586007 /nfs/dbraw/zinc/58/60/07/1050586007.db2.gz QOKVFDGIPCCETK-UHFFFAOYSA-N 1 2 318.302 4.421 20 0 DIADLO CC(=O)Nc1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)ccc1C ZINC001213088938 1050586459 /nfs/dbraw/zinc/58/64/59/1050586459.db2.gz LPPVDAYSLFBDTA-UHFFFAOYSA-N 1 2 306.369 4.087 20 0 DIADLO O=c1ccc2cccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)c2[nH]1 ZINC001213091976 1050586960 /nfs/dbraw/zinc/58/69/60/1050586960.db2.gz VFFQZQVHKKMKMV-UHFFFAOYSA-N 1 2 302.337 4.074 20 0 DIADLO CCOc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(OC)c1 ZINC001213119186 1050595888 /nfs/dbraw/zinc/59/58/88/1050595888.db2.gz RMIBXJXTGHGGOA-UHFFFAOYSA-N 1 2 323.396 4.082 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1cccnc1C(F)(F)F ZINC001144520638 1050603664 /nfs/dbraw/zinc/60/36/64/1050603664.db2.gz XFENXYLUVGWVIX-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cccnc1C(F)(F)F ZINC001144520638 1050603671 /nfs/dbraw/zinc/60/36/71/1050603671.db2.gz XFENXYLUVGWVIX-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2ncc(CC)o2)o1 ZINC000574855107 1050605140 /nfs/dbraw/zinc/60/51/40/1050605140.db2.gz MVICWTORTACXLU-CJNGLKHVSA-N 1 2 302.418 4.366 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2ncc(CC)o2)o1 ZINC000574855107 1050605143 /nfs/dbraw/zinc/60/51/43/1050605143.db2.gz MVICWTORTACXLU-CJNGLKHVSA-N 1 2 302.418 4.366 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2ncc(CC)o2)o1 ZINC000574855108 1050605888 /nfs/dbraw/zinc/60/58/88/1050605888.db2.gz MVICWTORTACXLU-CZUORRHYSA-N 1 2 302.418 4.366 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2ncc(CC)o2)o1 ZINC000574855108 1050605895 /nfs/dbraw/zinc/60/58/95/1050605895.db2.gz MVICWTORTACXLU-CZUORRHYSA-N 1 2 302.418 4.366 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC[C@]2(CC2(F)F)C1 ZINC000845744239 1050610792 /nfs/dbraw/zinc/61/07/92/1050610792.db2.gz RRYBDEHYQNVMJC-KRWDZBQOSA-N 1 2 318.367 4.177 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c(F)c1 ZINC001144554634 1050613192 /nfs/dbraw/zinc/61/31/92/1050613192.db2.gz CUGFCMDJLPAPIS-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c(F)c1 ZINC001144554634 1050613196 /nfs/dbraw/zinc/61/31/96/1050613196.db2.gz CUGFCMDJLPAPIS-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)c(F)c1 ZINC001144554915 1050613616 /nfs/dbraw/zinc/61/36/16/1050613616.db2.gz LWNVSXIOBXRMEI-NSHDSACASA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@H](c3ccccc3Cl)C2)c(F)c1 ZINC001144554915 1050613624 /nfs/dbraw/zinc/61/36/24/1050613624.db2.gz LWNVSXIOBXRMEI-NSHDSACASA-N 1 2 323.770 4.313 20 0 DIADLO COc1ccc2nc(/C=C/c3c[nH+]c4ccccn34)sc2c1 ZINC000740666530 1050617020 /nfs/dbraw/zinc/61/70/20/1050617020.db2.gz QRTJTMXMSBWTOT-VMPITWQZSA-N 1 2 307.378 4.123 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(OCC(F)F)cc2)[nH+]1 ZINC001213298887 1050624072 /nfs/dbraw/zinc/62/40/72/1050624072.db2.gz LVUBTQLKDNHVRC-UHFFFAOYSA-N 1 2 303.312 4.030 20 0 DIADLO CSc1cc(NC(=O)[C@@H](CC(C)C)n2cc[nH+]c2)ccc1C ZINC001144583884 1050624620 /nfs/dbraw/zinc/62/46/20/1050624620.db2.gz XBQJRNALCOBXQU-OAHLLOKOSA-N 1 2 317.458 4.139 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@@H](C)CCCC(C)C)[C@@H]2C ZINC001170079460 1050630055 /nfs/dbraw/zinc/63/00/55/1050630055.db2.gz DIIXYTAHGLRMPL-JKSUJKDBSA-N 1 2 307.482 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@@H](C)CCCC(C)C)[C@@H]2C ZINC001170079460 1050630064 /nfs/dbraw/zinc/63/00/64/1050630064.db2.gz DIIXYTAHGLRMPL-JKSUJKDBSA-N 1 2 307.482 4.011 20 0 DIADLO Clc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ncn2ccccc12 ZINC001144623672 1050632602 /nfs/dbraw/zinc/63/26/02/1050632602.db2.gz ZPYJWYMSQYNDSR-KRWDZBQOSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1ccccc1[C@@H]1CCC[N@H+]1Cc1ncn2ccccc12 ZINC001144623672 1050632606 /nfs/dbraw/zinc/63/26/06/1050632606.db2.gz ZPYJWYMSQYNDSR-KRWDZBQOSA-N 1 2 311.816 4.325 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc(F)c(O)cc2F)c1 ZINC001144646642 1050638880 /nfs/dbraw/zinc/63/88/80/1050638880.db2.gz FLILXLKLLSVRNZ-QGZVFWFLSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2cc(F)c(O)cc2F)c1 ZINC001144646642 1050638896 /nfs/dbraw/zinc/63/88/96/1050638896.db2.gz FLILXLKLLSVRNZ-QGZVFWFLSA-N 1 2 303.352 4.316 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCCC[C@H]2c2ccccc2)cc1F ZINC001144646855 1050639014 /nfs/dbraw/zinc/63/90/14/1050639014.db2.gz NMYZKFTZGQQIQW-KRWDZBQOSA-N 1 2 303.352 4.398 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCCC[C@H]2c2ccccc2)cc1F ZINC001144646855 1050639019 /nfs/dbraw/zinc/63/90/19/1050639019.db2.gz NMYZKFTZGQQIQW-KRWDZBQOSA-N 1 2 303.352 4.398 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(F)c(O)cc1F ZINC001144648780 1050639960 /nfs/dbraw/zinc/63/99/60/1050639960.db2.gz WVPQGIHBWLHQKM-QGZVFWFLSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1cc(F)c(O)cc1F ZINC001144648780 1050639975 /nfs/dbraw/zinc/63/99/75/1050639975.db2.gz WVPQGIHBWLHQKM-QGZVFWFLSA-N 1 2 303.352 4.316 20 0 DIADLO CC[N@H+](Cc1noc2c1CCCC2)Cc1ccc(Cl)cc1 ZINC000595564141 1050640224 /nfs/dbraw/zinc/64/02/24/1050640224.db2.gz HNADTEVYEDQDQG-UHFFFAOYSA-N 1 2 304.821 4.229 20 0 DIADLO CC[N@@H+](Cc1noc2c1CCCC2)Cc1ccc(Cl)cc1 ZINC000595564141 1050640230 /nfs/dbraw/zinc/64/02/30/1050640230.db2.gz HNADTEVYEDQDQG-UHFFFAOYSA-N 1 2 304.821 4.229 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)c(O)cc2F)cc1 ZINC001144667067 1050645493 /nfs/dbraw/zinc/64/54/93/1050645493.db2.gz QTBCNHHUNQZPFJ-KRWDZBQOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)c(O)cc2F)cc1 ZINC001144667067 1050645501 /nfs/dbraw/zinc/64/55/01/1050645501.db2.gz QTBCNHHUNQZPFJ-KRWDZBQOSA-N 1 2 319.351 4.016 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)cc1F ZINC001144666509 1050646595 /nfs/dbraw/zinc/64/65/95/1050646595.db2.gz LNMFKMFKQLYVPE-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCC[C@H]2c2cccc(F)c2)cc1F ZINC001144666509 1050646607 /nfs/dbraw/zinc/64/66/07/1050646607.db2.gz LNMFKMFKQLYVPE-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(F)c(O)cc1F ZINC001144659331 1050648117 /nfs/dbraw/zinc/64/81/17/1050648117.db2.gz DMHVAQSBMCUINO-QGZVFWFLSA-N 1 2 303.352 4.180 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc(F)c(O)cc1F ZINC001144659331 1050648124 /nfs/dbraw/zinc/64/81/24/1050648124.db2.gz DMHVAQSBMCUINO-QGZVFWFLSA-N 1 2 303.352 4.180 20 0 DIADLO CC(C)(C)CCCCCC(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC001144683536 1050655248 /nfs/dbraw/zinc/65/52/48/1050655248.db2.gz NMDXWXMGHOPXRT-HNNXBMFYSA-N 1 2 305.466 4.112 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)ccc1Cl ZINC000846111334 1050666399 /nfs/dbraw/zinc/66/63/99/1050666399.db2.gz LQGXTWUKZMIXGT-AOOOYVTPSA-N 1 2 311.681 4.056 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)ccc1Cl ZINC000846111334 1050666402 /nfs/dbraw/zinc/66/64/02/1050666402.db2.gz LQGXTWUKZMIXGT-AOOOYVTPSA-N 1 2 311.681 4.056 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccnn1Cc1cccc(F)c1 ZINC001213495094 1050669209 /nfs/dbraw/zinc/66/92/09/1050669209.db2.gz PZHZIZZDNYQWMM-UHFFFAOYSA-N 1 2 322.387 4.395 20 0 DIADLO Cc1ncc(Nc2cc(C3CC3)c[nH+]c2C)cc1Br ZINC001213491534 1050669510 /nfs/dbraw/zinc/66/95/10/1050669510.db2.gz NBWNNKPEGVKVHB-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccnc(Br)c1C ZINC001213495274 1050670135 /nfs/dbraw/zinc/67/01/35/1050670135.db2.gz ZGVNXHAKYHEFFV-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1cc(C)c(Nc2ccnc(Cl)c2Br)c[nH+]1 ZINC001213505916 1050670501 /nfs/dbraw/zinc/67/05/01/1050670501.db2.gz SPYJRYNIGWXDPD-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1cc(Nc2cc(C3CC3)c[nH+]c2C)n(CC(F)(F)F)n1 ZINC001213495261 1050670606 /nfs/dbraw/zinc/67/06/06/1050670606.db2.gz YVPGVQANBJYZBS-UHFFFAOYSA-N 1 2 310.323 4.078 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cc(-c2ccccc2O)no1 ZINC001213495169 1050670631 /nfs/dbraw/zinc/67/06/31/1050670631.db2.gz UIRLHNKWJUYZCE-UHFFFAOYSA-N 1 2 307.353 4.372 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(N2CCCC2=O)cc1 ZINC001213497554 1050671576 /nfs/dbraw/zinc/67/15/76/1050671576.db2.gz VGMNWFZGXWYSSD-UHFFFAOYSA-N 1 2 307.397 4.138 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccccc1P(C)(C)=O ZINC001213499500 1050672280 /nfs/dbraw/zinc/67/22/80/1050672280.db2.gz LWGGNLJLJKCGAB-UHFFFAOYSA-N 1 2 300.342 4.259 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cncc(-c2ccccn2)c1 ZINC001213497581 1050672348 /nfs/dbraw/zinc/67/23/48/1050672348.db2.gz WDAXBIRJIHSCQY-UHFFFAOYSA-N 1 2 302.381 4.468 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2nnc(C3CCC3)n2c1 ZINC001213497262 1050672620 /nfs/dbraw/zinc/67/26/20/1050672620.db2.gz LGGRBODBUYKISL-UHFFFAOYSA-N 1 2 319.412 4.321 20 0 DIADLO COC(=O)c1cc(F)c(Nc2cc(C3CC3)c[nH+]c2C)cc1F ZINC001213503422 1050673657 /nfs/dbraw/zinc/67/36/57/1050673657.db2.gz FEZSWIYQUZEZAH-UHFFFAOYSA-N 1 2 318.323 4.076 20 0 DIADLO Cc1cc(C)c(Nc2noc3cc(Br)ccc23)c[nH+]1 ZINC001213505446 1050673773 /nfs/dbraw/zinc/67/37/73/1050673773.db2.gz GUYNSBMPCVOVHK-UHFFFAOYSA-N 1 2 318.174 4.346 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cccc(OC(=O)N(C)C)c1 ZINC001213503819 1050673852 /nfs/dbraw/zinc/67/38/52/1050673852.db2.gz ZRMXTTGRLDOFBA-UHFFFAOYSA-N 1 2 311.385 4.071 20 0 DIADLO CO[C@H]1CCOc2c(Nc3cc(C4CC4)c[nH+]c3C)cccc21 ZINC001213500919 1050674138 /nfs/dbraw/zinc/67/41/38/1050674138.db2.gz CMKBPBNUACLHSO-SFHVURJKSA-N 1 2 310.397 4.481 20 0 DIADLO COc1cc(OC)c(Nc2cc(C3CC3)c[nH+]c2C)c(OC)c1 ZINC001213501338 1050674155 /nfs/dbraw/zinc/67/41/55/1050674155.db2.gz UALFXUYCPXAGMY-UHFFFAOYSA-N 1 2 314.385 4.037 20 0 DIADLO COC(=O)[C@H]1CCc2cc(Nc3cc(C4CC4)c[nH+]c3C)ccc21 ZINC001213503704 1050674669 /nfs/dbraw/zinc/67/46/69/1050674669.db2.gz TUAXAZYYDAJXBE-SFHVURJKSA-N 1 2 322.408 4.214 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(-c2cc(CO)on2)cc1 ZINC001213503798 1050674993 /nfs/dbraw/zinc/67/49/93/1050674993.db2.gz YRWYCCGFDQJUJP-UHFFFAOYSA-N 1 2 321.380 4.158 20 0 DIADLO COC(=O)Cc1cc(Nc2cc(C3CC3)c[nH+]c2C)ccc1C ZINC001213503775 1050675003 /nfs/dbraw/zinc/67/50/03/1050675003.db2.gz XNCSLIMWBCXLDR-UHFFFAOYSA-N 1 2 310.397 4.035 20 0 DIADLO CNC(=O)c1ccc(Nc2cc(C3CC3)c[nH+]c2C)cc1Cl ZINC001213501372 1050675013 /nfs/dbraw/zinc/67/50/13/1050675013.db2.gz VNRVTWIWEJCJIS-UHFFFAOYSA-N 1 2 315.804 4.024 20 0 DIADLO Cc1cc(C)c(Nc2cc(Cl)cnc2Br)c[nH+]1 ZINC001213505356 1050675140 /nfs/dbraw/zinc/67/51/40/1050675140.db2.gz CLXMXRWMYXOJPX-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO COC(=O)c1c(F)ccc(F)c1Nc1cc(C2CC2)c[nH+]c1C ZINC001213500883 1050675246 /nfs/dbraw/zinc/67/52/46/1050675246.db2.gz BBQKZKVNVWGIQU-UHFFFAOYSA-N 1 2 318.323 4.076 20 0 DIADLO COC(=O)c1c(F)cc(F)cc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213501414 1050675307 /nfs/dbraw/zinc/67/53/07/1050675307.db2.gz XIBVDGQAQHTMPM-UHFFFAOYSA-N 1 2 318.323 4.076 20 0 DIADLO Cc1cc(C)c(Nc2cc(F)ccc2OC[C@H]2CCCO2)c[nH+]1 ZINC001213513618 1050676986 /nfs/dbraw/zinc/67/69/86/1050676986.db2.gz ZMGCOTFQEQYJMV-OAHLLOKOSA-N 1 2 316.376 4.139 20 0 DIADLO CC(=O)c1cc(Cl)nc(Cl)c1Nc1c[nH+]c(C)cc1C ZINC001213506021 1050677290 /nfs/dbraw/zinc/67/72/90/1050677290.db2.gz YUJDOAPAJJSVSJ-UHFFFAOYSA-N 1 2 310.184 4.346 20 0 DIADLO Cc1c[nH+]cc(Nc2ccnc(Cl)c2Br)c1C ZINC001213523608 1050677577 /nfs/dbraw/zinc/67/75/77/1050677577.db2.gz WHWHHQNWPYVVMT-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO CC(=O)c1ccc(Nc2c[nH+]c(C)cc2C)c(Br)c1 ZINC001213515728 1050677760 /nfs/dbraw/zinc/67/77/60/1050677760.db2.gz HITJPWAYMUGFQB-UHFFFAOYSA-N 1 2 319.202 4.407 20 0 DIADLO Cc1c[nH+]cc(Nc2sc(-c3ccccc3)cc2C(N)=O)c1C ZINC001213524879 1050678890 /nfs/dbraw/zinc/67/88/90/1050678890.db2.gz HWCVVWTWTCUISV-UHFFFAOYSA-N 1 2 323.421 4.269 20 0 DIADLO Cc1cc(C)c(Nc2cc(Br)cc(F)c2O)c[nH+]1 ZINC001213518618 1050679459 /nfs/dbraw/zinc/67/94/59/1050679459.db2.gz YCYCEQMVYYRHFX-UHFFFAOYSA-N 1 2 311.154 4.049 20 0 DIADLO Cc1cc(C)c(Nc2cccc(F)c2OC[C@H]2CCCO2)c[nH+]1 ZINC001213520389 1050680378 /nfs/dbraw/zinc/68/03/78/1050680378.db2.gz AOXJEPOFNKWMGV-CQSZACIVSA-N 1 2 316.376 4.139 20 0 DIADLO CC(=O)N1CC(C)(C)c2ccc(Nc3c[nH+]cc(C)c3C)cc21 ZINC001213530613 1050681496 /nfs/dbraw/zinc/68/14/96/1050681496.db2.gz GWVYBEDGYVGANM-UHFFFAOYSA-N 1 2 309.413 4.086 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(C(=O)c3ccncc3)cc2)c1C ZINC001213532942 1050681608 /nfs/dbraw/zinc/68/16/08/1050681608.db2.gz XMDSALDRAHLMEU-UHFFFAOYSA-N 1 2 303.365 4.068 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(C(=O)N3CCCCC3)cc2)c1C ZINC001213530610 1050682124 /nfs/dbraw/zinc/68/21/24/1050682124.db2.gz GUUDWLSRHKFHQC-UHFFFAOYSA-N 1 2 309.413 4.068 20 0 DIADLO CC(=O)c1c(Br)cccc1Nc1c[nH+]cc(C)c1C ZINC001213532770 1050682816 /nfs/dbraw/zinc/68/28/16/1050682816.db2.gz UBPFKVMMBWBVDW-UHFFFAOYSA-N 1 2 319.202 4.407 20 0 DIADLO COc1ccc2nc(/C=C/c3c[nH+]c4c(C)cccn34)sc2c1 ZINC000741472173 1050684272 /nfs/dbraw/zinc/68/42/72/1050684272.db2.gz TVXKFXXFJUUJHN-VMPITWQZSA-N 1 2 321.405 4.431 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1Nc1cccc(C2CCC2)[nH+]1 ZINC001213560394 1050684526 /nfs/dbraw/zinc/68/45/26/1050684526.db2.gz NLSBQQRNIJDBNA-UHFFFAOYSA-N 1 2 323.440 4.238 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cc(F)c(F)cc2Cl)cc1 ZINC001144722989 1050686328 /nfs/dbraw/zinc/68/63/28/1050686328.db2.gz HDIDMXMWNIMJEQ-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cc(F)c(F)cc2Cl)cc1 ZINC001144722989 1050686333 /nfs/dbraw/zinc/68/63/33/1050686333.db2.gz HDIDMXMWNIMJEQ-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CC[C@@H](Nc1cc(CC(=O)OC)cc[nH+]1)c1ccc(Cl)cc1 ZINC000596065666 1050686290 /nfs/dbraw/zinc/68/62/90/1050686290.db2.gz IYYKUGFNKPXNQP-OAHLLOKOSA-N 1 2 318.804 4.014 20 0 DIADLO c1cn(-c2ccccc2Nc2ccccc2N2CCCC2)c[nH+]1 ZINC001213607925 1050695096 /nfs/dbraw/zinc/69/50/96/1050695096.db2.gz GWIOWDZXSKTNEY-UHFFFAOYSA-N 1 2 304.397 4.216 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001144749928 1050698449 /nfs/dbraw/zinc/69/84/49/1050698449.db2.gz SSHSLPWNLVWBFF-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001144749928 1050698453 /nfs/dbraw/zinc/69/84/53/1050698453.db2.gz SSHSLPWNLVWBFF-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccc3scnc3c1)CC2 ZINC001144743152 1050702902 /nfs/dbraw/zinc/70/29/02/1050702902.db2.gz BKJFLJZOIIKEEL-UHFFFAOYSA-N 1 2 322.433 4.057 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1ccc3scnc3c1)CC2 ZINC001144743152 1050702916 /nfs/dbraw/zinc/70/29/16/1050702916.db2.gz BKJFLJZOIIKEEL-UHFFFAOYSA-N 1 2 322.433 4.057 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2cc(C3CC3)no2)c1C ZINC000596351937 1050705624 /nfs/dbraw/zinc/70/56/24/1050705624.db2.gz CALBMNBBWOJEOG-UHFFFAOYSA-N 1 2 304.415 4.006 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(F)c1)C1CCCCCCC1 ZINC000741543013 1050706046 /nfs/dbraw/zinc/70/60/46/1050706046.db2.gz AFWGEGQRFICAKC-UHFFFAOYSA-N 1 2 315.392 4.310 20 0 DIADLO CCCN(CCC)C(=O)c1cccc(Nc2ccc(C)c[nH+]2)c1 ZINC001213694948 1050720548 /nfs/dbraw/zinc/72/05/48/1050720548.db2.gz YJQCAAPWQZVION-UHFFFAOYSA-N 1 2 311.429 4.396 20 0 DIADLO CCCN(CCC)C(=O)c1cccc(Nc2[nH+]cccc2C)c1 ZINC001213694883 1050721302 /nfs/dbraw/zinc/72/13/02/1050721302.db2.gz VFDKDLIRWOZAHC-UHFFFAOYSA-N 1 2 311.429 4.396 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H]1COCc2cccc(Cl)c21 ZINC000788687302 1050724497 /nfs/dbraw/zinc/72/44/97/1050724497.db2.gz ANGGKRJBSOJHBX-QGZVFWFLSA-N 1 2 316.832 4.398 20 0 DIADLO Cc1nn(C)c2cc(Nc3ccc4c(C)cc[nH+]c4c3)ccc12 ZINC001213762601 1050733243 /nfs/dbraw/zinc/73/32/43/1050733243.db2.gz ZAJSBYATGIUVCJ-UHFFFAOYSA-N 1 2 302.381 4.482 20 0 DIADLO c1cn(Cc2cccc(-c3cccc(N4CCCC4)c3)c2)c[nH+]1 ZINC000846778967 1050749700 /nfs/dbraw/zinc/74/97/00/1050749700.db2.gz HUBBPGZIGZGIJT-UHFFFAOYSA-N 1 2 303.409 4.199 20 0 DIADLO O[C@@H](c1ccc(-c2cc(F)cc(Cn3cc[nH+]c3)c2)cc1)C1CC1 ZINC000846783701 1050750768 /nfs/dbraw/zinc/75/07/68/1050750768.db2.gz ZJRURDBDHMHGNM-FQEVSTJZSA-N 1 2 322.383 4.181 20 0 DIADLO CN(c1ccc(N2CCc3cccc(N)c32)c[nH+]1)C1CCCCC1 ZINC001212614996 1050752941 /nfs/dbraw/zinc/75/29/41/1050752941.db2.gz BKCHINYPLOTRGG-UHFFFAOYSA-N 1 2 322.456 4.127 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccccc1SC(C)(C)C)c1ncnn1C ZINC000788778085 1050753856 /nfs/dbraw/zinc/75/38/56/1050753856.db2.gz QUHIBGQLWGNKFU-CHWSQXEVSA-N 1 2 318.490 4.118 20 0 DIADLO Fc1cc(C[N@@H+]2CCCCC[C@@H]2c2ccncc2)cnc1Cl ZINC000846773483 1050754929 /nfs/dbraw/zinc/75/49/29/1050754929.db2.gz ZNZYLBNMUSPKHM-MRXNPFEDSA-N 1 2 319.811 4.386 20 0 DIADLO Fc1cc(C[N@H+]2CCCCC[C@@H]2c2ccncc2)cnc1Cl ZINC000846773483 1050754947 /nfs/dbraw/zinc/75/49/47/1050754947.db2.gz ZNZYLBNMUSPKHM-MRXNPFEDSA-N 1 2 319.811 4.386 20 0 DIADLO Cc1cc(C2CC2)ccc1Nc1ccccc1C[NH+]1CCOCC1 ZINC001213864591 1050768579 /nfs/dbraw/zinc/76/85/79/1050768579.db2.gz QKCNPYLUOPMGST-UHFFFAOYSA-N 1 2 322.452 4.448 20 0 DIADLO CCC[C@H]([NH2+]Cc1cnsn1)c1cccc(C(F)(F)F)c1 ZINC000846845585 1050769210 /nfs/dbraw/zinc/76/92/10/1050769210.db2.gz YTEXHGFISQGCQS-ZDUSSCGKSA-N 1 2 315.364 4.188 20 0 DIADLO CCC[C@@H]([NH2+]Cc1cnsn1)c1ccc(Cl)c(Cl)c1 ZINC000846844847 1050769299 /nfs/dbraw/zinc/76/92/99/1050769299.db2.gz QKNGORRRDPFQDT-CYBMUJFWSA-N 1 2 316.257 4.476 20 0 DIADLO Cc1cc(N[C@@H]2CCCC[C@H]2[C@H]2CCOC2)ccc1[NH+](C)C ZINC000788982909 1050769477 /nfs/dbraw/zinc/76/94/77/1050769477.db2.gz GESIKSXPSKYJNS-RYQLBKOJSA-N 1 2 302.462 4.068 20 0 DIADLO COCCCN(c1ccc(C2CC2)cc1C)c1[nH+]cccc1N ZINC001213861970 1050769578 /nfs/dbraw/zinc/76/95/78/1050769578.db2.gz BOEJUFUCZRGFPI-UHFFFAOYSA-N 1 2 311.429 4.024 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCC34CCCC4)cc2)C[C@H](C)O1 ZINC000788986694 1050771277 /nfs/dbraw/zinc/77/12/77/1050771277.db2.gz YSRSGMWDOKQZGU-JTDSTZFVSA-N 1 2 314.473 4.435 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cnsn1)c1ccc(C(F)(F)F)cc1 ZINC000846846174 1050772321 /nfs/dbraw/zinc/77/23/21/1050772321.db2.gz DPCXHPNWRZILLH-ZDUSSCGKSA-N 1 2 315.364 4.044 20 0 DIADLO Clc1cccc([C@H]([NH2+]Cc2cnsn2)C2CCCC2)c1 ZINC000846847450 1050772957 /nfs/dbraw/zinc/77/29/57/1050772957.db2.gz ZOJSSPAGZWVDBG-OAHLLOKOSA-N 1 2 307.850 4.213 20 0 DIADLO CCCCCC[C@H](C)C(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000741913052 1050775011 /nfs/dbraw/zinc/77/50/11/1050775011.db2.gz TYQKDVPPNFPNPO-INIZCTEOSA-N 1 2 313.445 4.095 20 0 DIADLO COc1c2ccccc2oc1C[NH2+][C@H](C)c1cccnc1Cl ZINC000788982672 1050779684 /nfs/dbraw/zinc/77/96/84/1050779684.db2.gz YDYABYYWMHQFKZ-LLVKDONJSA-N 1 2 316.788 4.341 20 0 DIADLO Fc1ccc(Cl)c(Nc2ccc[nH+]c2N2CCCC2)c1F ZINC001213942986 1050785782 /nfs/dbraw/zinc/78/57/82/1050785782.db2.gz ONNSTQQWFGGOHJ-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+]CCOc1ccccc1-c1ccccc1 ZINC000180294266 1050801700 /nfs/dbraw/zinc/80/17/00/1050801700.db2.gz JENTYQLLLWCTPM-HNNXBMFYSA-N 1 2 321.424 4.115 20 0 DIADLO Cc1nn(C[N@@H+]2CC[C@@H](c3ccccc3)[C@H](C)C2)c(=S)s1 ZINC000742167979 1050805451 /nfs/dbraw/zinc/80/54/51/1050805451.db2.gz XBTLBPXPGKCOOH-IUODEOHRSA-N 1 2 319.499 4.066 20 0 DIADLO Cc1nn(C[N@H+]2CC[C@@H](c3ccccc3)[C@H](C)C2)c(=S)s1 ZINC000742167979 1050805463 /nfs/dbraw/zinc/80/54/63/1050805463.db2.gz XBTLBPXPGKCOOH-IUODEOHRSA-N 1 2 319.499 4.066 20 0 DIADLO CCSc1nn(C[N@@H+]2C[C@@H](C)CCC[C@H]2C)c(=S)s1 ZINC000742154456 1050806506 /nfs/dbraw/zinc/80/65/06/1050806506.db2.gz JRSDVFFTCUSROR-WDEREUQCSA-N 1 2 317.549 4.254 20 0 DIADLO CCSc1nn(C[N@H+]2C[C@@H](C)CCC[C@H]2C)c(=S)s1 ZINC000742154456 1050806512 /nfs/dbraw/zinc/80/65/12/1050806512.db2.gz JRSDVFFTCUSROR-WDEREUQCSA-N 1 2 317.549 4.254 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cn2ccc(C(F)(F)F)n2)c1C ZINC000742153569 1050808032 /nfs/dbraw/zinc/80/80/32/1050808032.db2.gz SRKJSJQCPXZCRF-HNNXBMFYSA-N 1 2 323.362 4.313 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cn2ccc(C(F)(F)F)n2)c1C ZINC000742153569 1050808045 /nfs/dbraw/zinc/80/80/45/1050808045.db2.gz SRKJSJQCPXZCRF-HNNXBMFYSA-N 1 2 323.362 4.313 20 0 DIADLO FC1(c2ccccc2)CC[NH+](Cc2cnc(Cl)s2)CC1 ZINC000789310462 1050811242 /nfs/dbraw/zinc/81/12/42/1050811242.db2.gz OAIIVWSTEPCYNV-UHFFFAOYSA-N 1 2 310.825 4.257 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc(Cl)nc2Cl)cc1F ZINC001243088491 1050839267 /nfs/dbraw/zinc/83/92/67/1050839267.db2.gz CEVHNYSDXZDMHN-UHFFFAOYSA-N 1 2 317.166 4.395 20 0 DIADLO CCCc1cc(N[C@@H]2COCc3ccccc32)nc(CCC)[nH+]1 ZINC001171292790 1050853583 /nfs/dbraw/zinc/85/35/83/1050853583.db2.gz ZGFCQVMFAAVCEE-QGZVFWFLSA-N 1 2 311.429 4.065 20 0 DIADLO CC[C@H](Cc1ccccc1)C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000601961414 1050884673 /nfs/dbraw/zinc/88/46/73/1050884673.db2.gz ZYRZCUWFSHFGDH-QGZVFWFLSA-N 1 2 319.408 4.080 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cc(OCOC)ccc2C)cc1 ZINC001214372716 1050886488 /nfs/dbraw/zinc/88/64/88/1050886488.db2.gz AHQKGNPBNAYUFT-UHFFFAOYSA-N 1 2 300.402 4.177 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cc(OCOC)ccc2C)cc1 ZINC001214372716 1050886503 /nfs/dbraw/zinc/88/65/03/1050886503.db2.gz AHQKGNPBNAYUFT-UHFFFAOYSA-N 1 2 300.402 4.177 20 0 DIADLO CCCCC[C@H](C)CC(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000742575619 1050891665 /nfs/dbraw/zinc/89/16/65/1050891665.db2.gz GJFIZIJRGHGIMD-JKSUJKDBSA-N 1 2 307.482 4.021 20 0 DIADLO Oc1cc(Cl)ccc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001214400114 1050893776 /nfs/dbraw/zinc/89/37/76/1050893776.db2.gz RLRIRHALJVLCAT-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO COCOc1ccc(Cl)cc1Nc1cccc2[nH+]c(C)cn21 ZINC001214416195 1050897775 /nfs/dbraw/zinc/89/77/75/1050897775.db2.gz UODKPWOHKURJTE-UHFFFAOYSA-N 1 2 317.776 4.022 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C[C@H]3CCc4ccccc43)cc2)CCO1 ZINC000790052579 1050909230 /nfs/dbraw/zinc/90/92/30/1050909230.db2.gz GXXIZZMDQXPGQS-SJLPKXTDSA-N 1 2 322.452 4.054 20 0 DIADLO Oc1c(F)cc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1Cl ZINC001214488584 1050920312 /nfs/dbraw/zinc/92/03/12/1050920312.db2.gz HOERVJYHDXSUAS-UHFFFAOYSA-N 1 2 317.751 4.173 20 0 DIADLO c1cn(-c2ccc(CSc3ncnc4ccccc43)cc2)c[nH+]1 ZINC000790243279 1050930758 /nfs/dbraw/zinc/93/07/58/1050930758.db2.gz RAXPDHQHGWLKGB-UHFFFAOYSA-N 1 2 318.405 4.108 20 0 DIADLO CC(C)c1ccc(C(=O)Nc2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001148318962 1050933243 /nfs/dbraw/zinc/93/32/43/1050933243.db2.gz SINKVUAPWCZYPB-UHFFFAOYSA-N 1 2 319.408 4.307 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1c(F)cc(Cl)cc1Cl ZINC001214551813 1050938213 /nfs/dbraw/zinc/93/82/13/1050938213.db2.gz JKDJXFFYQGVTHX-UHFFFAOYSA-N 1 2 310.159 4.362 20 0 DIADLO Oc1ccc(Cl)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1F ZINC001214561485 1050944463 /nfs/dbraw/zinc/94/44/63/1050944463.db2.gz ONLJRJJCPDLMGV-UHFFFAOYSA-N 1 2 317.751 4.173 20 0 DIADLO O=C(Nc1ccc(Cn2cc[nH+]c2)cc1)c1ccccc1C1CC1 ZINC001148478683 1050944935 /nfs/dbraw/zinc/94/49/35/1050944935.db2.gz LRUKBLIDBOEVDG-UHFFFAOYSA-N 1 2 317.392 4.061 20 0 DIADLO CC(=O)c1cc(Nc2ccc[nH+]c2N2CCCCC2)cs1 ZINC001214773875 1050998573 /nfs/dbraw/zinc/99/85/73/1050998573.db2.gz XPYMQUPXHCBTOH-UHFFFAOYSA-N 1 2 301.415 4.080 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(CCc2ccccc2)oc1=S ZINC000743347383 1051019334 /nfs/dbraw/zinc/01/93/34/1051019334.db2.gz BYXQROHFBRHXBC-UHFFFAOYSA-N 1 2 319.474 4.070 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(CCc2ccccc2)oc1=S ZINC000743347383 1051019341 /nfs/dbraw/zinc/01/93/41/1051019341.db2.gz BYXQROHFBRHXBC-UHFFFAOYSA-N 1 2 319.474 4.070 20 0 DIADLO CCC[C@H]1CC(=O)N(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC000743348464 1051020059 /nfs/dbraw/zinc/02/00/59/1051020059.db2.gz MTELCSGXXWSWAV-YOEHRIQHSA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@H]1CC(=O)N(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC000743348464 1051020071 /nfs/dbraw/zinc/02/00/71/1051020071.db2.gz MTELCSGXXWSWAV-YOEHRIQHSA-N 1 2 320.864 4.083 20 0 DIADLO S=c1oc(-c2ccccc2)nn1C[N@@H+]1CCC2(CCCC2)C1 ZINC000743390873 1051021003 /nfs/dbraw/zinc/02/10/03/1051021003.db2.gz LEFHYORCQXIRNX-UHFFFAOYSA-N 1 2 315.442 4.096 20 0 DIADLO S=c1oc(-c2ccccc2)nn1C[N@H+]1CCC2(CCCC2)C1 ZINC000743390873 1051021015 /nfs/dbraw/zinc/02/10/15/1051021015.db2.gz LEFHYORCQXIRNX-UHFFFAOYSA-N 1 2 315.442 4.096 20 0 DIADLO CCC[C@@H]1CC(=O)N(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)C1 ZINC000743349200 1051021060 /nfs/dbraw/zinc/02/10/60/1051021060.db2.gz BZJVPHYOHIMROZ-PBHICJAKSA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@@H]1CC(=O)N(C[N@H+]2CCC[C@H]2c2ccccc2Cl)C1 ZINC000743349200 1051021072 /nfs/dbraw/zinc/02/10/72/1051021072.db2.gz BZJVPHYOHIMROZ-PBHICJAKSA-N 1 2 320.864 4.083 20 0 DIADLO CC1(C)CC[N@H+](Cn2c3ccccc3n(C(F)F)c2=S)C1 ZINC000743391770 1051023246 /nfs/dbraw/zinc/02/32/46/1051023246.db2.gz YNBFRNIRQQMVQX-UHFFFAOYSA-N 1 2 311.401 4.257 20 0 DIADLO CC1(C)CC[N@@H+](Cn2c3ccccc3n(C(F)F)c2=S)C1 ZINC000743391770 1051023256 /nfs/dbraw/zinc/02/32/56/1051023256.db2.gz YNBFRNIRQQMVQX-UHFFFAOYSA-N 1 2 311.401 4.257 20 0 DIADLO Cc1cc(Nc2cccc(Cn3cc[nH+]c3)c2)cnc1OC(C)C ZINC001214942872 1051030375 /nfs/dbraw/zinc/03/03/75/1051030375.db2.gz VQNQQQFFDMPPBE-UHFFFAOYSA-N 1 2 322.412 4.166 20 0 DIADLO COc1c(F)cc(Nc2ccc[nH+]c2N2CCCC2)cc1Cl ZINC001214966376 1051036749 /nfs/dbraw/zinc/03/67/49/1051036749.db2.gz HLEPRKQTCOFMKU-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO Cc1nc2c(ccn2C)c(NCc2cccc3sccc32)[nH+]1 ZINC001171378214 1051049009 /nfs/dbraw/zinc/04/90/09/1051049009.db2.gz XNEMARWAPAXRHH-UHFFFAOYSA-N 1 2 308.410 4.104 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000181075278 1051053720 /nfs/dbraw/zinc/05/37/20/1051053720.db2.gz SKFDTHSCAOSZHQ-LSDHHAIUSA-N 1 2 312.461 4.266 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000181075278 1051053733 /nfs/dbraw/zinc/05/37/33/1051053733.db2.gz SKFDTHSCAOSZHQ-LSDHHAIUSA-N 1 2 312.461 4.266 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2ccnc(Cl)c2)c2ccccn2)cc1 ZINC000791641737 1051068042 /nfs/dbraw/zinc/06/80/42/1051068042.db2.gz WQQJIXKXHHEAIQ-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1cccnc1Cl ZINC000773129417 1051071901 /nfs/dbraw/zinc/07/19/01/1051071901.db2.gz FXYCLPWHOSJJEN-LBPRGKRZSA-N 1 2 319.836 4.158 20 0 DIADLO CC(C)c1cnc(C[NH+]2CCC(OCC3CCCCC3)CC2)o1 ZINC000743854397 1051076596 /nfs/dbraw/zinc/07/65/96/1051076596.db2.gz VLPOYKOHFNOFCH-UHFFFAOYSA-N 1 2 320.477 4.359 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CCCC[C@H]1c1ccc(F)cc1 ZINC000752090416 1051090385 /nfs/dbraw/zinc/09/03/85/1051090385.db2.gz WPTJWJQIBRWGBW-INIZCTEOSA-N 1 2 321.827 4.248 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CCCC[C@H]1c1ccc(F)cc1 ZINC000752090416 1051090400 /nfs/dbraw/zinc/09/04/00/1051090400.db2.gz WPTJWJQIBRWGBW-INIZCTEOSA-N 1 2 321.827 4.248 20 0 DIADLO Cc1ccc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)cc1F ZINC001215170035 1051098068 /nfs/dbraw/zinc/09/80/68/1051098068.db2.gz ABNFPULJQYUGRR-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Clc1cccc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)c1 ZINC001215170254 1051098923 /nfs/dbraw/zinc/09/89/23/1051098923.db2.gz JGVQIKJGBPUFEH-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO Clc1ccc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)cc1 ZINC001215195385 1051111738 /nfs/dbraw/zinc/11/17/38/1051111738.db2.gz OXQJEYPMMSOKLJ-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO CCc1ccc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)cc1 ZINC001215216748 1051119228 /nfs/dbraw/zinc/11/92/28/1051119228.db2.gz GUBZDBBQMXNTGY-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO CCc1ccccc1-c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001215256585 1051138208 /nfs/dbraw/zinc/13/82/08/1051138208.db2.gz LNEBHLSMDABZHZ-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO c1cn(Cc2ccc(NCC3(c4ccccc4)CC3)cc2)c[nH+]1 ZINC001171466287 1051142122 /nfs/dbraw/zinc/14/21/22/1051142122.db2.gz KYAFGPPCIZDFJN-UHFFFAOYSA-N 1 2 303.409 4.075 20 0 DIADLO Cc1c(F)cccc1-c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001215268310 1051144869 /nfs/dbraw/zinc/14/48/69/1051144869.db2.gz CGYLCQMCWUFNBM-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Cc1nc(N[C@H]2C[C@@H]2c2ccc(-c3cccc(O)c3)cc2)cc[nH+]1 ZINC001170251750 1051173330 /nfs/dbraw/zinc/17/33/30/1051173330.db2.gz TVROBYJKXNKKST-MOPGFXCFSA-N 1 2 317.392 4.126 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC001170254804 1051175334 /nfs/dbraw/zinc/17/53/34/1051175334.db2.gz WZMBJULYJBZNFI-UONOGXRCSA-N 1 2 318.219 4.276 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC001170254804 1051175342 /nfs/dbraw/zinc/17/53/42/1051175342.db2.gz WZMBJULYJBZNFI-UONOGXRCSA-N 1 2 318.219 4.276 20 0 DIADLO COc1cccc2c1C[N@@H+]([C@H](C)c1cc(F)ccc1F)CC2 ZINC001170341751 1051193003 /nfs/dbraw/zinc/19/30/03/1051193003.db2.gz DFYXXARPMFWSFO-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cccc2c1C[N@H+]([C@H](C)c1cc(F)ccc1F)CC2 ZINC001170341751 1051193008 /nfs/dbraw/zinc/19/30/08/1051193008.db2.gz DFYXXARPMFWSFO-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cccc2c1C[N@@H+]([C@@H](C)c1cc(F)ccc1F)CC2 ZINC001170341752 1051193708 /nfs/dbraw/zinc/19/37/08/1051193708.db2.gz DFYXXARPMFWSFO-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cccc2c1C[N@H+]([C@@H](C)c1cc(F)ccc1F)CC2 ZINC001170341752 1051193719 /nfs/dbraw/zinc/19/37/19/1051193719.db2.gz DFYXXARPMFWSFO-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Cl)c(F)c2)CC2(CCCCC2)O1 ZINC001171636756 1051194022 /nfs/dbraw/zinc/19/40/22/1051194022.db2.gz OSXJAHVGMABMJL-CYBMUJFWSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Cl)c(F)c2)CC2(CCCCC2)O1 ZINC001171636756 1051194030 /nfs/dbraw/zinc/19/40/30/1051194030.db2.gz OSXJAHVGMABMJL-CYBMUJFWSA-N 1 2 311.828 4.403 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2C[C@@H](C)OC3(CCCCC3)C2)c1F ZINC001171636795 1051194767 /nfs/dbraw/zinc/19/47/67/1051194767.db2.gz PKEADUBHXBVOTP-CQSZACIVSA-N 1 2 309.400 4.197 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2C[C@@H](C)OC3(CCCCC3)C2)c1F ZINC001171636795 1051194773 /nfs/dbraw/zinc/19/47/73/1051194773.db2.gz PKEADUBHXBVOTP-CQSZACIVSA-N 1 2 309.400 4.197 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Cl)c(F)c2)CC2(CCCCC2)O1 ZINC001171636757 1051194893 /nfs/dbraw/zinc/19/48/93/1051194893.db2.gz OSXJAHVGMABMJL-ZDUSSCGKSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Cl)c(F)c2)CC2(CCCCC2)O1 ZINC001171636757 1051194899 /nfs/dbraw/zinc/19/48/99/1051194899.db2.gz OSXJAHVGMABMJL-ZDUSSCGKSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@]12CC[N@H+](Cc3csc(C4CC4)n3)C[C@H]1C2(Cl)Cl ZINC000792899317 1051225140 /nfs/dbraw/zinc/22/51/40/1051225140.db2.gz DQFWQCKNWIAROW-YPMHNXCESA-N 1 2 317.285 4.036 20 0 DIADLO C[C@]12CC[N@@H+](Cc3csc(C4CC4)n3)C[C@H]1C2(Cl)Cl ZINC000792899317 1051225151 /nfs/dbraw/zinc/22/51/51/1051225151.db2.gz DQFWQCKNWIAROW-YPMHNXCESA-N 1 2 317.285 4.036 20 0 DIADLO CCOc1cc[nH+]cc1Nc1ccc(F)c(F)c1OC(C)C ZINC001215421471 1051198320 /nfs/dbraw/zinc/19/83/20/1051198320.db2.gz XPTBFMFUQBZSDX-UHFFFAOYSA-N 1 2 308.328 4.289 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000792862167 1051216878 /nfs/dbraw/zinc/21/68/78/1051216878.db2.gz KKERTOZHCPJBFY-HUUCEWRRSA-N 1 2 319.408 4.417 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000792862167 1051216891 /nfs/dbraw/zinc/21/68/91/1051216891.db2.gz KKERTOZHCPJBFY-HUUCEWRRSA-N 1 2 319.408 4.417 20 0 DIADLO COCc1cc(C)c(Nc2ccc(-n3cc[nH+]c3)cc2)c(C)c1 ZINC001215530681 1051234884 /nfs/dbraw/zinc/23/48/84/1051234884.db2.gz SICVIGCDKQLSBY-UHFFFAOYSA-N 1 2 307.397 4.379 20 0 DIADLO CCCCCCOCc1cccc(NCc2c[nH+]cn2C)c1 ZINC000747099031 1051241339 /nfs/dbraw/zinc/24/13/39/1051241339.db2.gz GVHPWXPPCFBJOB-UHFFFAOYSA-N 1 2 301.434 4.129 20 0 DIADLO CCCOc1ccc(F)c(Nc2cccn3cc(C)[nH+]c23)c1F ZINC001215566715 1051247260 /nfs/dbraw/zinc/24/72/60/1051247260.db2.gz AGWKIWSDRUTVDB-UHFFFAOYSA-N 1 2 317.339 4.453 20 0 DIADLO C[C@H](Cc1ccc(C(F)(F)F)cc1)[N@@H+]1CCCC(F)(F)C1 ZINC001171968052 1051249918 /nfs/dbraw/zinc/24/99/18/1051249918.db2.gz DPRUGUCEPIQQGW-LLVKDONJSA-N 1 2 307.306 4.368 20 0 DIADLO C[C@H](Cc1ccc(C(F)(F)F)cc1)[N@H+]1CCCC(F)(F)C1 ZINC001171968052 1051249927 /nfs/dbraw/zinc/24/99/27/1051249927.db2.gz DPRUGUCEPIQQGW-LLVKDONJSA-N 1 2 307.306 4.368 20 0 DIADLO COCc1ccc(Cl)c(Nc2cccn3cc(C)[nH+]c23)c1 ZINC001215596040 1051263875 /nfs/dbraw/zinc/26/38/75/1051263875.db2.gz XNJDWILIZOHJCS-UHFFFAOYSA-N 1 2 301.777 4.186 20 0 DIADLO Cc1nc([C@H]([NH2+]C2CCC(C)CC2)c2ccc(Cl)cc2)no1 ZINC000182682094 1051263901 /nfs/dbraw/zinc/26/39/01/1051263901.db2.gz JXJGMLMDFKRRFJ-QJLPXFQTSA-N 1 2 319.836 4.289 20 0 DIADLO Cc1cccc(Nc2ccc(C(=O)N(C(C)C)C(C)C)cc2)[nH+]1 ZINC001215655557 1051290466 /nfs/dbraw/zinc/29/04/66/1051290466.db2.gz OMJGXMXARZNNRF-UHFFFAOYSA-N 1 2 311.429 4.393 20 0 DIADLO CC(C)Oc1ccc(COc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000746051435 1051308774 /nfs/dbraw/zinc/30/87/74/1051308774.db2.gz MSDDMIZKJPCOEF-UHFFFAOYSA-N 1 2 308.381 4.239 20 0 DIADLO CC(C)Oc1c(F)ccc(Nc2cccn3cc[nH+]c23)c1F ZINC001215727567 1051328770 /nfs/dbraw/zinc/32/87/70/1051328770.db2.gz YRGDCVPNDLGWBM-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1noc2c1CCCC2 ZINC000183535859 1051330900 /nfs/dbraw/zinc/33/09/00/1051330900.db2.gz QAAJNXQWFYPXRU-ZDUSSCGKSA-N 1 2 310.397 4.459 20 0 DIADLO CCCC[N@H+](Cc1ncc(Cl)n1C)[C@H](C)c1ccc(C)o1 ZINC000746164771 1051334853 /nfs/dbraw/zinc/33/48/53/1051334853.db2.gz BWMVHBZOUKNKME-CYBMUJFWSA-N 1 2 309.841 4.338 20 0 DIADLO CCCC[N@@H+](Cc1ncc(Cl)n1C)[C@H](C)c1ccc(C)o1 ZINC000746164771 1051334862 /nfs/dbraw/zinc/33/48/62/1051334862.db2.gz BWMVHBZOUKNKME-CYBMUJFWSA-N 1 2 309.841 4.338 20 0 DIADLO CCOc1ccc(C)c(F)c1Nc1ccccc1-n1cc[nH+]c1 ZINC001215763929 1051352441 /nfs/dbraw/zinc/35/24/41/1051352441.db2.gz YMHJQJUVTNXHIN-UHFFFAOYSA-N 1 2 311.360 4.462 20 0 DIADLO CCc1ccc(N(CC(C)C)C(=O)c2cccc3[nH+]ccn32)cc1 ZINC000794134428 1051357636 /nfs/dbraw/zinc/35/76/36/1051357636.db2.gz LOFUYMOKWBKOMH-UHFFFAOYSA-N 1 2 321.424 4.200 20 0 DIADLO c1cn2cccc(Nc3ccnc(Oc4ccccc4)c3)c2[nH+]1 ZINC001215775403 1051361878 /nfs/dbraw/zinc/36/18/78/1051361878.db2.gz QBNXRONOQJHBCR-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO CCc1ccc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)s1 ZINC000794214333 1051365326 /nfs/dbraw/zinc/36/53/26/1051365326.db2.gz SZGNIOJEDCLSKR-UHFFFAOYSA-N 1 2 311.410 4.261 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H](F)c1ccccc1 ZINC000794213135 1051365416 /nfs/dbraw/zinc/36/54/16/1051365416.db2.gz KLIHKWVJQYQBCQ-MRXNPFEDSA-N 1 2 309.344 4.034 20 0 DIADLO Cc1ccccc1C(N)=[NH+]OCc1csc(C2CCCC2)n1 ZINC000746353347 1051377510 /nfs/dbraw/zinc/37/75/10/1051377510.db2.gz YKYVENVENIOLPA-UHFFFAOYSA-N 1 2 315.442 4.156 20 0 DIADLO CC[C@H](CC(C)C)[N@@H+]1CCCC[C@@H]1c1noc(C(F)(F)F)n1 ZINC001172406167 1051380229 /nfs/dbraw/zinc/38/02/29/1051380229.db2.gz GFGQLMYOXLKPIM-VXGBXAGGSA-N 1 2 319.371 4.440 20 0 DIADLO CC[C@H](CC(C)C)[N@H+]1CCCC[C@@H]1c1noc(C(F)(F)F)n1 ZINC001172406167 1051380238 /nfs/dbraw/zinc/38/02/38/1051380238.db2.gz GFGQLMYOXLKPIM-VXGBXAGGSA-N 1 2 319.371 4.440 20 0 DIADLO C[C@@H]1CC[N@H+](Cn2nc(C3CC3)sc2=S)[C@@H]2CCCC[C@@H]12 ZINC000746375893 1051388168 /nfs/dbraw/zinc/38/81/68/1051388168.db2.gz YKGSRUJYJKJFFK-KWCYVHTRSA-N 1 2 323.531 4.410 20 0 DIADLO C[C@@H]1CC[N@@H+](Cn2nc(C3CC3)sc2=S)[C@@H]2CCCC[C@@H]12 ZINC000746375893 1051388170 /nfs/dbraw/zinc/38/81/70/1051388170.db2.gz YKGSRUJYJKJFFK-KWCYVHTRSA-N 1 2 323.531 4.410 20 0 DIADLO CCOc1cc(Nc2ccc(N3CCCC3)[nH+]c2)ccc1Cl ZINC001212578860 1051389354 /nfs/dbraw/zinc/38/93/54/1051389354.db2.gz DBHOLWOXLQWBNP-UHFFFAOYSA-N 1 2 317.820 4.478 20 0 DIADLO CSc1ncc(Nc2cc(Cl)c3[nH+]ccn3c2)cc1C ZINC001215827763 1051391888 /nfs/dbraw/zinc/39/18/88/1051391888.db2.gz LQSVBEHTJACUHU-UHFFFAOYSA-N 1 2 304.806 4.157 20 0 DIADLO Cc1nc([C@@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)c(C)s1 ZINC000387275618 1051392126 /nfs/dbraw/zinc/39/21/26/1051392126.db2.gz ICUFMHIVLZMFMA-GFCCVEGCSA-N 1 2 316.474 4.318 20 0 DIADLO CC(C)(C)C(=O)Nc1ccccc1Nc1cccn2cc[nH+]c12 ZINC001215831787 1051396462 /nfs/dbraw/zinc/39/64/62/1051396462.db2.gz XGBZMIVYRGZCDE-UHFFFAOYSA-N 1 2 308.385 4.063 20 0 DIADLO CSc1ccc(F)c(Nc2cccc3[nH+]c(C)cn32)c1F ZINC001215836983 1051400945 /nfs/dbraw/zinc/40/09/45/1051400945.db2.gz JJAWCJODPMRHLE-UHFFFAOYSA-N 1 2 305.353 4.386 20 0 DIADLO CCc1ccc([C@@H](C)CC(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001129482161 1051402616 /nfs/dbraw/zinc/40/26/16/1051402616.db2.gz RQSFDNBWVIJEIX-AWEZNQCLSA-N 1 2 307.397 4.029 20 0 DIADLO CSc1ccc(F)c(Nc2cccn3cc(C)[nH+]c23)c1F ZINC001215839751 1051403737 /nfs/dbraw/zinc/40/37/37/1051403737.db2.gz UMPHFKHGHIJCRL-UHFFFAOYSA-N 1 2 305.353 4.386 20 0 DIADLO Cc1ccc(-c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)cc1C ZINC001215846383 1051410729 /nfs/dbraw/zinc/41/07/29/1051410729.db2.gz UAKTUSMKWPTNPY-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO CC(C)OCC[C@H](C)[N@@H+]1CC[C@@H](c2ccccc2)C(F)(F)C1 ZINC001172461855 1051413346 /nfs/dbraw/zinc/41/33/46/1051413346.db2.gz VOALPZZOVFEMHQ-RDJZCZTQSA-N 1 2 311.416 4.315 20 0 DIADLO CC(C)OCC[C@H](C)[N@H+]1CC[C@@H](c2ccccc2)C(F)(F)C1 ZINC001172461855 1051413352 /nfs/dbraw/zinc/41/33/52/1051413352.db2.gz VOALPZZOVFEMHQ-RDJZCZTQSA-N 1 2 311.416 4.315 20 0 DIADLO C[C@H]([NH2+]Cc1ccon1)c1ccc(SCC(F)(F)F)cc1 ZINC000766419836 1051419843 /nfs/dbraw/zinc/41/98/43/1051419843.db2.gz FETWDUDDWLUSCG-JTQLQIEISA-N 1 2 316.348 4.180 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C(C)C)[C@@H](C)c3ccccc3)ccn12 ZINC001129512008 1051421628 /nfs/dbraw/zinc/42/16/28/1051421628.db2.gz AJQRKXIWBVUJEC-INIZCTEOSA-N 1 2 321.424 4.255 20 0 DIADLO Cc1ccc2ccccc2c1Nc1ccc(C[NH+]2CC(O)C2)cc1 ZINC001212668409 1051432008 /nfs/dbraw/zinc/43/20/08/1051432008.db2.gz XIGRERJMPRSPEM-UHFFFAOYSA-N 1 2 318.420 4.068 20 0 DIADLO CSc1cc(F)cc(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001215901974 1051442286 /nfs/dbraw/zinc/44/22/86/1051442286.db2.gz FMXVZZIHHGICOC-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO C[C@H](C[C@H](O)c1ccco1)Nc1cc[nH+]c2c(Cl)cccc12 ZINC000804549345 1051444788 /nfs/dbraw/zinc/44/47/88/1051444788.db2.gz AXZZAMLSKKOJIZ-ABAIWWIYSA-N 1 2 316.788 4.405 20 0 DIADLO CSc1ncc(Cl)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001215914653 1051451261 /nfs/dbraw/zinc/45/12/61/1051451261.db2.gz OPIZZBRJDSUNLZ-UHFFFAOYSA-N 1 2 320.849 4.196 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)c1cc(Cl)c(F)cc1Cl ZINC001129594534 1051454243 /nfs/dbraw/zinc/45/42/43/1051454243.db2.gz RPYHKGIPBRYFDZ-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO Clc1ccnc(C[NH+]2CCC(c3ccccn3)CC2)c1Cl ZINC001168860287 1051454335 /nfs/dbraw/zinc/45/43/35/1051454335.db2.gz WROWTIYIRYTOOH-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO CSc1ncc(Cl)cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001215917389 1051455079 /nfs/dbraw/zinc/45/50/79/1051455079.db2.gz CPHOQGZQGOXEHV-UHFFFAOYSA-N 1 2 320.849 4.196 20 0 DIADLO Cc1cc2ccccc2cc1Nc1ccc(C[NH+]2CC(O)C2)cc1 ZINC001212672435 1051461383 /nfs/dbraw/zinc/46/13/83/1051461383.db2.gz MRTDAZQQLYUBGJ-UHFFFAOYSA-N 1 2 318.420 4.068 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(OC)c(SC)c2)c[nH+]1 ZINC001215932630 1051467191 /nfs/dbraw/zinc/46/71/91/1051467191.db2.gz NSKBCLOADMYWDW-UHFFFAOYSA-N 1 2 303.431 4.012 20 0 DIADLO COc1c(Cl)ccc(Nc2ccc[nH+]c2N2CCCC2)c1F ZINC001212582687 1051470628 /nfs/dbraw/zinc/47/06/28/1051470628.db2.gz UXJNPOAHSQFOIU-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO Fc1ncc(Nc2cccc3[nH+]ccn32)cc1-c1ccccc1 ZINC001215958018 1051481694 /nfs/dbraw/zinc/48/16/94/1051481694.db2.gz GKMNNDTXVUVEFW-UHFFFAOYSA-N 1 2 304.328 4.279 20 0 DIADLO Fc1ccc(NCCc2cn3ccccc3[nH+]2)cc1C(F)(F)F ZINC001169003704 1051484651 /nfs/dbraw/zinc/48/46/51/1051484651.db2.gz AVDBFKDFINPDNF-UHFFFAOYSA-N 1 2 323.293 4.147 20 0 DIADLO Cc1cc(NCCc2cn3ccccc3[nH+]2)c(OC(C)C)cc1C ZINC001169010073 1051487266 /nfs/dbraw/zinc/48/72/66/1051487266.db2.gz ZKVOQMCIQOSTGQ-UHFFFAOYSA-N 1 2 323.440 4.393 20 0 DIADLO CCCOc1ccc(C)c(NCCc2cn3ccccc3[nH+]2)c1 ZINC001169009588 1051487551 /nfs/dbraw/zinc/48/75/51/1051487551.db2.gz RTBLPQVGPQUIBS-UHFFFAOYSA-N 1 2 309.413 4.086 20 0 DIADLO Cc1cc(NCc2ccsc2Br)[nH+]c2cc[nH]c21 ZINC001169058630 1051500577 /nfs/dbraw/zinc/50/05/77/1051500577.db2.gz LDOJBHBOUBIBJD-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(OC)cc2COC)cc1 ZINC001215982852 1051502702 /nfs/dbraw/zinc/50/27/02/1051502702.db2.gz NLQJUDLZVKCSQE-UHFFFAOYSA-N 1 2 300.402 4.041 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(OC)cc2COC)cc1 ZINC001215982852 1051502712 /nfs/dbraw/zinc/50/27/12/1051502712.db2.gz NLQJUDLZVKCSQE-UHFFFAOYSA-N 1 2 300.402 4.041 20 0 DIADLO Cc1cc(NC(=O)N2CCc3cc(C(C)(C)C)ccc32)c(C)c[nH+]1 ZINC001216003169 1051520089 /nfs/dbraw/zinc/52/00/89/1051520089.db2.gz DBMRHGUWOWGENL-UHFFFAOYSA-N 1 2 323.440 4.012 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1cc(F)c(F)c(F)c1N ZINC001216008312 1051521160 /nfs/dbraw/zinc/52/11/60/1051521160.db2.gz KRMPWSVKMFNTIG-UHFFFAOYSA-N 1 2 309.335 4.332 20 0 DIADLO Nc1c(F)c(F)c(F)cc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001216011317 1051522792 /nfs/dbraw/zinc/52/27/92/1051522792.db2.gz ZAFMMRIXYYIWCK-UHFFFAOYSA-N 1 2 321.346 4.420 20 0 DIADLO CC(C)=CCC/C(C)=C/CNc1ccc(Cn2cc[nH+]c2)cn1 ZINC001169135711 1051524987 /nfs/dbraw/zinc/52/49/87/1051524987.db2.gz ODXYPCGECKCHSR-RQZCQDPDSA-N 1 2 310.445 4.431 20 0 DIADLO Clc1ccc2[nH+]ccc(Nc3ccc4c(c3)OCCO4)c2c1 ZINC000169937662 1051525055 /nfs/dbraw/zinc/52/50/55/1051525055.db2.gz GEDBKURQSKZXGR-UHFFFAOYSA-N 1 2 312.756 4.403 20 0 DIADLO CC(C)=CCC/C(C)=C/CNc1cc(C2(C)OCCO2)cc[nH+]1 ZINC001169135068 1051525089 /nfs/dbraw/zinc/52/50/89/1051525089.db2.gz IMXPIMZENNGGES-LZYBPNLTSA-N 1 2 316.445 4.406 20 0 DIADLO CC(C)=CCC/C(C)=C/CNc1ccc(N2CCOCC2)c[nH+]1 ZINC001169135332 1051525349 /nfs/dbraw/zinc/52/53/49/1051525349.db2.gz KQTVCMNCVKGWQP-RQZCQDPDSA-N 1 2 315.461 4.023 20 0 DIADLO COc1c(Cl)ccc(Nc2ccc(-n3cc[nH+]c3)cc2)c1F ZINC001212585052 1051525718 /nfs/dbraw/zinc/52/57/18/1051525718.db2.gz NZMCIPYNRVKGSX-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO CC(C)c1ccc(N)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001216021529 1051528471 /nfs/dbraw/zinc/52/84/71/1051528471.db2.gz TXVORYSSTNKLDE-UHFFFAOYSA-N 1 2 306.413 4.381 20 0 DIADLO CSc1ncc(Nc2[nH+]c3ccccc3n2C)cc1Cl ZINC001216025257 1051531043 /nfs/dbraw/zinc/53/10/43/1051531043.db2.gz KYHWEFHSQHKNFL-UHFFFAOYSA-N 1 2 304.806 4.087 20 0 DIADLO CC(C)c1ccc[nH+]c1Nc1ccc(N)c(OC(F)(F)F)c1 ZINC001216031908 1051536394 /nfs/dbraw/zinc/53/63/94/1051536394.db2.gz NTPRXTDEMTZQTM-UHFFFAOYSA-N 1 2 311.307 4.429 20 0 DIADLO Cc1cc(C)c(CNC(=O)/C=C\c2ccc(C(C)(C)C)cc2)c[nH+]1 ZINC001129842199 1051537629 /nfs/dbraw/zinc/53/76/29/1051537629.db2.gz UVJROQNCFCNVBZ-FLIBITNWSA-N 1 2 322.452 4.326 20 0 DIADLO CC/C(=C\C(=O)NCc1cc(C)[nH+]c(C)c1)c1ccc(C)cc1 ZINC001129858855 1051542578 /nfs/dbraw/zinc/54/25/78/1051542578.db2.gz TXJXDVOKOVYEMI-LDADJPATSA-N 1 2 308.425 4.117 20 0 DIADLO CN(C)c1ccc(Nc2ccccc2-n2cc[nH+]c2)cc1Cl ZINC001216060918 1051556266 /nfs/dbraw/zinc/55/62/66/1051556266.db2.gz JYELMCQPBXIIAA-UHFFFAOYSA-N 1 2 312.804 4.335 20 0 DIADLO Fc1cccc(F)c1C[NH+]1CCC(Oc2ccccc2)CC1 ZINC000351027063 1051564834 /nfs/dbraw/zinc/56/48/34/1051564834.db2.gz IVKCYDGBDHZMIS-UHFFFAOYSA-N 1 2 303.352 4.008 20 0 DIADLO C[C@H](CSc1ccc(Cl)cc1)[N@H+](C)Cc1cscn1 ZINC001172880243 1051564791 /nfs/dbraw/zinc/56/47/91/1051564791.db2.gz BDJPIOHSEYSBQF-LLVKDONJSA-N 1 2 312.891 4.409 20 0 DIADLO C[C@H](CSc1ccc(Cl)cc1)[N@@H+](C)Cc1cscn1 ZINC001172880243 1051564794 /nfs/dbraw/zinc/56/47/94/1051564794.db2.gz BDJPIOHSEYSBQF-LLVKDONJSA-N 1 2 312.891 4.409 20 0 DIADLO CCc1ccc([C@@H]2C[N@H+](Cc3ccccc3Cl)CCO2)cc1 ZINC001169283144 1051568016 /nfs/dbraw/zinc/56/80/16/1051568016.db2.gz GUFVZKXHYJVPBB-IBGZPJMESA-N 1 2 315.844 4.476 20 0 DIADLO CCc1ccc([C@@H]2C[N@@H+](Cc3ccccc3Cl)CCO2)cc1 ZINC001169283144 1051568028 /nfs/dbraw/zinc/56/80/28/1051568028.db2.gz GUFVZKXHYJVPBB-IBGZPJMESA-N 1 2 315.844 4.476 20 0 DIADLO FC(F)(F)[C@@H](Nc1cc(-c2ccncc2)cc[nH+]1)C1CCC1 ZINC001169281189 1051568243 /nfs/dbraw/zinc/56/82/43/1051568243.db2.gz HANHZZNGKUHRCF-HNNXBMFYSA-N 1 2 307.319 4.287 20 0 DIADLO Clc1ccc2oc(Nc3ccc(Cn4cc[nH+]c4)cc3)nc2c1 ZINC001212692442 1051568632 /nfs/dbraw/zinc/56/86/32/1051568632.db2.gz TXXHLOZHDJKUER-UHFFFAOYSA-N 1 2 324.771 4.470 20 0 DIADLO c1cn(Cc2ccc(Nc3nccc4ccccc43)cc2)c[nH+]1 ZINC001212692510 1051570187 /nfs/dbraw/zinc/57/01/87/1051570187.db2.gz XWJRGBHWTIQZPH-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO FC(F)(F)[C@@H](Nc1ccc(Cn2cc[nH+]c2)cc1)C1CCC1 ZINC001169286094 1051572155 /nfs/dbraw/zinc/57/21/55/1051572155.db2.gz RHCWTDIRCVSDNZ-HNNXBMFYSA-N 1 2 309.335 4.074 20 0 DIADLO c1cn(Cc2ccc(Nc3csc4ncccc34)cc2)c[nH+]1 ZINC001212693205 1051574219 /nfs/dbraw/zinc/57/42/19/1051574219.db2.gz ILQGPNLUKADHOZ-UHFFFAOYSA-N 1 2 306.394 4.285 20 0 DIADLO CCS[C@H](C)c1noc(C[NH+]2CCC(C(C)(C)C)CC2)n1 ZINC000178460934 1051575551 /nfs/dbraw/zinc/57/55/51/1051575551.db2.gz VVWMZQKITXFWTI-GFCCVEGCSA-N 1 2 311.495 4.142 20 0 DIADLO COc1ccc(Cl)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212695778 1051584992 /nfs/dbraw/zinc/58/49/92/1051584992.db2.gz RUPZVLIAQPKLII-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO Nc1cc(F)cc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1Cl ZINC001212699806 1051585117 /nfs/dbraw/zinc/58/51/17/1051585117.db2.gz FLVFWUYOXJAENF-UHFFFAOYSA-N 1 2 316.767 4.050 20 0 DIADLO Fc1cccc(Cl)c1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212696656 1051585817 /nfs/dbraw/zinc/58/58/17/1051585817.db2.gz COPMFSZWINFLDY-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO Cc1cc(C)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c(C)c1N ZINC001212696828 1051586683 /nfs/dbraw/zinc/58/66/83/1051586683.db2.gz ORINYCNZYHWUTN-UHFFFAOYSA-N 1 2 306.413 4.182 20 0 DIADLO c1cn(Cc2ccc(Nc3cccc4ncsc43)cc2)c[nH+]1 ZINC001212697531 1051586849 /nfs/dbraw/zinc/58/68/49/1051586849.db2.gz DJLRTMNQQMNVAF-UHFFFAOYSA-N 1 2 306.394 4.285 20 0 DIADLO Cc1noc2ccc(Nc3ccc(Cn4cc[nH+]c4)cc3)cc12 ZINC001212697784 1051587722 /nfs/dbraw/zinc/58/77/22/1051587722.db2.gz SQJUUXMFXKCDCM-UHFFFAOYSA-N 1 2 304.353 4.125 20 0 DIADLO Nc1cc(Cl)cc2c1ccn2-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001212698414 1051588814 /nfs/dbraw/zinc/58/88/14/1051588814.db2.gz RTBPEHJRVNDUFQ-UHFFFAOYSA-N 1 2 322.799 4.111 20 0 DIADLO C[C@@H](c1ccc(Oc2ccccc2)cc1)[N@@H+]1CCC(=O)[C@H](C)C1 ZINC001169409768 1051604733 /nfs/dbraw/zinc/60/47/33/1051604733.db2.gz QGWHQQVVPRIQGR-CVEARBPZSA-N 1 2 309.409 4.451 20 0 DIADLO C[C@@H](c1ccc(Oc2ccccc2)cc1)[N@H+]1CCC(=O)[C@H](C)C1 ZINC001169409768 1051604740 /nfs/dbraw/zinc/60/47/40/1051604740.db2.gz QGWHQQVVPRIQGR-CVEARBPZSA-N 1 2 309.409 4.451 20 0 DIADLO NC(Cc1cccnc1)=[NH+]OCc1ccc(-c2ccsc2)cc1 ZINC000766708644 1051617026 /nfs/dbraw/zinc/61/70/26/1051617026.db2.gz CZJPVJRBNVUTLK-UHFFFAOYSA-N 1 2 323.421 4.051 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](CC(=O)c1c[nH]c2ccccc12)C1CC1 ZINC000088549397 1051626444 /nfs/dbraw/zinc/62/64/44/1051626444.db2.gz IUXGFTGRESFYJO-ZDUSSCGKSA-N 1 2 308.381 4.169 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](CC(=O)c1c[nH]c2ccccc12)C1CC1 ZINC000088549397 1051626452 /nfs/dbraw/zinc/62/64/52/1051626452.db2.gz IUXGFTGRESFYJO-ZDUSSCGKSA-N 1 2 308.381 4.169 20 0 DIADLO COc1cccc2c(NC[C@@H](C)c3ccc(O)cc3)cc[nH+]c12 ZINC001169548937 1051641687 /nfs/dbraw/zinc/64/16/87/1051641687.db2.gz TYHCOJBQSPODPD-CYBMUJFWSA-N 1 2 308.381 4.165 20 0 DIADLO c1oc2ccccc2c1CCNc1ccc(N2CCCC2)[nH+]c1 ZINC001169599840 1051653981 /nfs/dbraw/zinc/65/39/81/1051653981.db2.gz KZXWNFJJTWKIRM-UHFFFAOYSA-N 1 2 307.397 4.083 20 0 DIADLO CC[C@H](C)Sc1ccc(NC(=O)/C=C/c2[nH]cc[nH+]2)c(C)c1 ZINC000493836666 1051659011 /nfs/dbraw/zinc/65/90/11/1051659011.db2.gz MYZHYBGQXNKUOH-GWJCSSMESA-N 1 2 315.442 4.261 20 0 DIADLO OCc1ccc(Nc2cc[nH+]c3cc(Cl)ccc23)c(F)c1 ZINC001216271892 1051666704 /nfs/dbraw/zinc/66/67/04/1051666704.db2.gz GGCKYCQDIYFYQX-UHFFFAOYSA-N 1 2 302.736 4.263 20 0 DIADLO COCOc1ccc(Nc2ccc3c(C)cc[nH+]c3c2)c(OC)c1 ZINC001216288182 1051675446 /nfs/dbraw/zinc/67/54/46/1051675446.db2.gz XLJWLXODCIOFRE-UHFFFAOYSA-N 1 2 324.380 4.278 20 0 DIADLO Clc1cc(Nc2c(Cl)ccnc2Cl)cn2cc[nH+]c12 ZINC001216301594 1051684235 /nfs/dbraw/zinc/68/42/35/1051684235.db2.gz SOZVIJSZKGCYQJ-UHFFFAOYSA-N 1 2 313.575 4.433 20 0 DIADLO Cc1c(Cl)c(Nc2cccc(-n3cc[nH+]c3)c2)ccc1CO ZINC001216329137 1051702949 /nfs/dbraw/zinc/70/29/49/1051702949.db2.gz PFDZXQZPNMPSQW-UHFFFAOYSA-N 1 2 313.788 4.070 20 0 DIADLO c1cn2c(cccc2CNc2ccc(-c3ccccc3)cn2)[nH+]1 ZINC000184288233 1051729331 /nfs/dbraw/zinc/72/93/31/1051729331.db2.gz YMLDGTDJGMNIHE-UHFFFAOYSA-N 1 2 300.365 4.008 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1nnc(-c2ccccc2)s1 ZINC000184222427 1051729394 /nfs/dbraw/zinc/72/93/94/1051729394.db2.gz UZVLNWHXSISFEM-AWEZNQCLSA-N 1 2 321.449 4.152 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1nnc(-c2ccccc2)s1 ZINC000184222427 1051729406 /nfs/dbraw/zinc/72/94/06/1051729406.db2.gz UZVLNWHXSISFEM-AWEZNQCLSA-N 1 2 321.449 4.152 20 0 DIADLO Cc1noc(C)c1CN(C)c1cc[nH+]c2c(Cl)cccc12 ZINC000804344898 1051742666 /nfs/dbraw/zinc/74/26/66/1051742666.db2.gz QSHQNXHZUDVGKC-UHFFFAOYSA-N 1 2 301.777 4.129 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1nccn1-c1ccccc1 ZINC000806175851 1051747717 /nfs/dbraw/zinc/74/77/17/1051747717.db2.gz GOPZQHJMBYVNDE-KBPBESRZSA-N 1 2 324.428 4.143 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CC[C@H]3C(C)(C)C)cc2)CCO1 ZINC000806156822 1051758245 /nfs/dbraw/zinc/75/82/45/1051758245.db2.gz KNRCEAPPVLAXEZ-OLMNPRSZSA-N 1 2 302.462 4.148 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+][C@H]2CC[C@@H]2C(C)(C)C)cc1 ZINC000806156463 1051758397 /nfs/dbraw/zinc/75/83/97/1051758397.db2.gz DDUSKZIKUCASRW-JLSDUUJJSA-N 1 2 302.462 4.148 20 0 DIADLO Cc1cc(N[C@H]2CCc3nc(Cl)ccc32)ccc1[NH+](C)C ZINC000806158027 1051761042 /nfs/dbraw/zinc/76/10/42/1051761042.db2.gz VLTXEVNXRHKBLG-AWEZNQCLSA-N 1 2 301.821 4.209 20 0 DIADLO C[C@@H](CC(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)C1CC1 ZINC000767092592 1051760953 /nfs/dbraw/zinc/76/09/53/1051760953.db2.gz PFFQAZGFKFZJEM-AWEZNQCLSA-N 1 2 323.440 4.261 20 0 DIADLO C/C(=C/C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)C1CC1 ZINC000767091967 1051761099 /nfs/dbraw/zinc/76/10/99/1051761099.db2.gz MTJKYJUHIHFUSU-KAMYIIQDSA-N 1 2 321.424 4.181 20 0 DIADLO CC(C)c1ccc(Nc2ccc3c(c2)[nH+]cn3C)c(Cl)n1 ZINC001216445307 1051770787 /nfs/dbraw/zinc/77/07/87/1051770787.db2.gz QSEICSCMZCBMJZ-UHFFFAOYSA-N 1 2 300.793 4.489 20 0 DIADLO OCc1cc(F)cc(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001212747535 1051778136 /nfs/dbraw/zinc/77/81/36/1051778136.db2.gz KYOCLIVMWGIBKG-UHFFFAOYSA-N 1 2 300.377 4.052 20 0 DIADLO CCOC(=O)/C=C/c1ccc(Nc2cccc(C3CC3)[nH+]2)cc1 ZINC001216475995 1051780086 /nfs/dbraw/zinc/78/00/86/1051780086.db2.gz WGZYRIZQBMDPCB-MDWZMJQESA-N 1 2 308.381 4.279 20 0 DIADLO CC(C)(C)[C@@H]1CN(C(=O)c2cccc3[nH+]ccn32)c2ccccc21 ZINC000767230258 1051780810 /nfs/dbraw/zinc/78/08/10/1051780810.db2.gz NEAHOERZQTUOBA-OAHLLOKOSA-N 1 2 319.408 4.124 20 0 DIADLO CC(C)(O)c1cc(F)cc(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001216489606 1051787396 /nfs/dbraw/zinc/78/73/96/1051787396.db2.gz QRWVOEQKEVIDDE-UHFFFAOYSA-N 1 2 319.767 4.098 20 0 DIADLO C[C@H]1c2cc(Cl)c(Cl)cc2CC[N@H+]1CCC(=O)C1CC1 ZINC000767414192 1051799932 /nfs/dbraw/zinc/79/99/32/1051799932.db2.gz HDUMVTNLYMNEQB-JTQLQIEISA-N 1 2 312.240 4.282 20 0 DIADLO C[C@H]1c2cc(Cl)c(Cl)cc2CC[N@@H+]1CCC(=O)C1CC1 ZINC000767414192 1051799948 /nfs/dbraw/zinc/79/99/48/1051799948.db2.gz HDUMVTNLYMNEQB-JTQLQIEISA-N 1 2 312.240 4.282 20 0 DIADLO COc1ccsc1[C@H](C)Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000186245228 1051803207 /nfs/dbraw/zinc/80/32/07/1051803207.db2.gz IGFKYDSBFIHTDO-ZDUSSCGKSA-N 1 2 317.458 4.315 20 0 DIADLO Nc1c(Cl)cccc1Nc1[nH+]cccc1N1CCCCC1 ZINC001216526657 1051805769 /nfs/dbraw/zinc/80/57/69/1051805769.db2.gz SGKMICRWEFHPBN-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCc3ccc(C(C)C)cc3C2)c(C)[nH+]1 ZINC001130665020 1051809224 /nfs/dbraw/zinc/80/92/24/1051809224.db2.gz CANNSJQWEOGJJG-UHFFFAOYSA-N 1 2 322.452 4.329 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc(-c4ccn(C)n4)nc3)ccc12 ZINC001216563379 1051820148 /nfs/dbraw/zinc/82/01/48/1051820148.db2.gz WTMLYKGPDACBJK-UHFFFAOYSA-N 1 2 315.380 4.082 20 0 DIADLO Brc1ccc2c(Nc3cccnc3)cc[nH+]c2c1 ZINC001173855246 1051829117 /nfs/dbraw/zinc/82/91/17/1051829117.db2.gz OGZGNBUNENBKCE-UHFFFAOYSA-N 1 2 300.159 4.136 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@@H+]2CCCC3(CC3)C2)c(Cl)c1 ZINC000186966117 1051833012 /nfs/dbraw/zinc/83/30/12/1051833012.db2.gz WMQVFBUSINHQOM-AWEZNQCLSA-N 1 2 320.864 4.160 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@H+]2CCCC3(CC3)C2)c(Cl)c1 ZINC000186966117 1051833022 /nfs/dbraw/zinc/83/30/22/1051833022.db2.gz WMQVFBUSINHQOM-AWEZNQCLSA-N 1 2 320.864 4.160 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(Br)cc2)o1 ZINC000220886625 1051843956 /nfs/dbraw/zinc/84/39/56/1051843956.db2.gz CRAVCKUVHIJNNT-QWRGUYRKSA-N 1 2 309.207 4.157 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccc(Br)cc2)o1 ZINC000220886748 1051844998 /nfs/dbraw/zinc/84/49/98/1051844998.db2.gz CRAVCKUVHIJNNT-MNOVXSKESA-N 1 2 309.207 4.157 20 0 DIADLO S=c1n(C2CC2)cnn1C[N@@H+]1CCC[C@@H]1CCC1CCCC1 ZINC000767754514 1051850239 /nfs/dbraw/zinc/85/02/39/1051850239.db2.gz PYPFSBSYSTUAPO-OAHLLOKOSA-N 1 2 320.506 4.141 20 0 DIADLO S=c1n(C2CC2)cnn1C[N@H+]1CCC[C@@H]1CCC1CCCC1 ZINC000767754514 1051850251 /nfs/dbraw/zinc/85/02/51/1051850251.db2.gz PYPFSBSYSTUAPO-OAHLLOKOSA-N 1 2 320.506 4.141 20 0 DIADLO Cc1ccc2c(Nc3ccn(C(=O)OC(C)(C)C)n3)cccc2[nH+]1 ZINC001216675059 1051858886 /nfs/dbraw/zinc/85/88/86/1051858886.db2.gz XEGGFVRRGVIHTA-UHFFFAOYSA-N 1 2 324.384 4.267 20 0 DIADLO CN(C)c1cc(CSCc2nc(C(C)(C)C)cs2)cc[nH+]1 ZINC000767864951 1051859174 /nfs/dbraw/zinc/85/91/74/1051859174.db2.gz FRCLARJXLIMCBS-UHFFFAOYSA-N 1 2 321.515 4.335 20 0 DIADLO CCCc1csc(C[NH2+][C@H](C)c2ccccc2OCC)n1 ZINC000494338723 1051873600 /nfs/dbraw/zinc/87/36/00/1051873600.db2.gz LCEQTAAKAICJPP-CYBMUJFWSA-N 1 2 304.459 4.345 20 0 DIADLO Cc1ccc(F)cc1-c1noc(-c2ccccc2-n2cc[nH+]c2)n1 ZINC001216755039 1051873773 /nfs/dbraw/zinc/87/37/73/1051873773.db2.gz ARWRPKUAGSZFRK-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CCc1nc(C)c(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)o1 ZINC000494360987 1051878464 /nfs/dbraw/zinc/87/84/64/1051878464.db2.gz ZOGKIWSVHZORGI-UHFFFAOYSA-N 1 2 317.191 4.281 20 0 DIADLO Cc1[nH+]c2c(Br)cc(C)cn2c1Nc1ccoc1 ZINC001173934404 1051905666 /nfs/dbraw/zinc/90/56/66/1051905666.db2.gz YHEPUGFJIXWNON-UHFFFAOYSA-N 1 2 306.163 4.050 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2c(Cl)nc(Cl)n2C)c1 ZINC000768330690 1051919005 /nfs/dbraw/zinc/91/90/05/1051919005.db2.gz YCIDMFPXRPGKAU-CYBMUJFWSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2c(Cl)nc(Cl)n2C)c1 ZINC000768330690 1051919016 /nfs/dbraw/zinc/91/90/16/1051919016.db2.gz YCIDMFPXRPGKAU-CYBMUJFWSA-N 1 2 324.255 4.372 20 0 DIADLO Brc1ccoc1C[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000768330182 1051919706 /nfs/dbraw/zinc/91/97/06/1051919706.db2.gz OWDVLTMXACVKAQ-LBPRGKRZSA-N 1 2 312.232 4.441 20 0 DIADLO Brc1ccoc1C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000768330182 1051919715 /nfs/dbraw/zinc/91/97/15/1051919715.db2.gz OWDVLTMXACVKAQ-LBPRGKRZSA-N 1 2 312.232 4.441 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cccn2CCC(C)C)no1 ZINC000768437974 1051932586 /nfs/dbraw/zinc/93/25/86/1051932586.db2.gz MCIAPRZHVJOXFY-GOSISDBHSA-N 1 2 301.434 4.168 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cccn2CCC(C)C)no1 ZINC000768437974 1051932598 /nfs/dbraw/zinc/93/25/98/1051932598.db2.gz MCIAPRZHVJOXFY-GOSISDBHSA-N 1 2 301.434 4.168 20 0 DIADLO COc1ccc(OC)c(OC)c1Nc1c(C)cc[nH+]c1C(C)C ZINC001174055815 1051943630 /nfs/dbraw/zinc/94/36/30/1051943630.db2.gz RQCPOKLDCFXJHN-UHFFFAOYSA-N 1 2 316.401 4.283 20 0 DIADLO COc1ccc2cc(-n3c(C)[nH+]c4ccc(N)cc43)ccc2c1 ZINC001174031604 1051957566 /nfs/dbraw/zinc/95/75/66/1051957566.db2.gz ATRNZTFOCDWHSC-UHFFFAOYSA-N 1 2 303.365 4.078 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2cn(C(C)(C)C)nn2)cc1 ZINC000191358880 1051970431 /nfs/dbraw/zinc/97/04/31/1051970431.db2.gz SUSYMTJSXMWHPI-SFHVURJKSA-N 1 2 312.461 4.069 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2cn(C(C)(C)C)nn2)cc1 ZINC000191358880 1051970437 /nfs/dbraw/zinc/97/04/37/1051970437.db2.gz SUSYMTJSXMWHPI-SFHVURJKSA-N 1 2 312.461 4.069 20 0 DIADLO c1ccc2c(c1)cncc2Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174098945 1051973671 /nfs/dbraw/zinc/97/36/71/1051973671.db2.gz ZPBMFVSKCJLJFE-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO c1cn(Cc2ccc(Nc3cncc4ccccc43)cc2)c[nH+]1 ZINC001174100641 1051975892 /nfs/dbraw/zinc/97/58/92/1051975892.db2.gz AYKOWSRCHASYMX-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO CC(C)CCn1cccc1C[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000191575791 1051977450 /nfs/dbraw/zinc/97/74/50/1051977450.db2.gz JKOLDVYVERRGMA-AWEZNQCLSA-N 1 2 318.465 4.066 20 0 DIADLO Cc1cnc(=S)n(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)c1 ZINC000808225267 1051987158 /nfs/dbraw/zinc/98/71/58/1051987158.db2.gz ZTMSJOIXOSEBOO-CYBMUJFWSA-N 1 2 305.472 4.023 20 0 DIADLO Cc1cnc(=S)n(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)c1 ZINC000808225267 1051987168 /nfs/dbraw/zinc/98/71/68/1051987168.db2.gz ZTMSJOIXOSEBOO-CYBMUJFWSA-N 1 2 305.472 4.023 20 0 DIADLO c1sc(C2CCCC2)nc1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000494652569 1051993188 /nfs/dbraw/zinc/99/31/88/1051993188.db2.gz IVQMKGKBHAXCHT-QGZVFWFLSA-N 1 2 320.502 4.192 20 0 DIADLO c1sc(C2CCCC2)nc1C[N@@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000494652569 1051993193 /nfs/dbraw/zinc/99/31/93/1051993193.db2.gz IVQMKGKBHAXCHT-QGZVFWFLSA-N 1 2 320.502 4.192 20 0 DIADLO Cc1cccc(Nc2ccc(C(=O)NCc3ccccc3)cc2)[nH+]1 ZINC001174074571 1051995352 /nfs/dbraw/zinc/99/53/52/1051995352.db2.gz VZWKBMMEWRPYDQ-UHFFFAOYSA-N 1 2 317.392 4.064 20 0 DIADLO COc1cncc(Nc2ccc(Oc3cc[nH+]c(C)c3)cc2)c1 ZINC001174091398 1052001502 /nfs/dbraw/zinc/00/15/02/1052001502.db2.gz QLQDRRKXYGMMDM-UHFFFAOYSA-N 1 2 307.353 4.330 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(Cl)s1)c1cccc(OC(F)F)c1 ZINC000225314052 1052011094 /nfs/dbraw/zinc/01/10/94/1052011094.db2.gz XRVSCWZKDLODQH-QMMMGPOBSA-N 1 2 318.776 4.249 20 0 DIADLO Cn1cnc(C[NH2+][C@@H](c2ccsc2)c2ccc(Cl)cc2)c1 ZINC000808383007 1052011405 /nfs/dbraw/zinc/01/14/05/1052011405.db2.gz RGCAVIQSYFWZFW-MRXNPFEDSA-N 1 2 317.845 4.014 20 0 DIADLO Cc1ccc(C)c(SCC(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000192842985 1052023104 /nfs/dbraw/zinc/02/31/04/1052023104.db2.gz PCYVSJDAZSRANW-UHFFFAOYSA-N 1 2 314.454 4.355 20 0 DIADLO Cc1cccc(Nc2ccc(C(=O)N3CCC(C)CC3)cc2)[nH+]1 ZINC001174158643 1052023670 /nfs/dbraw/zinc/02/36/70/1052023670.db2.gz NCFNDTRUIPYPOJ-UHFFFAOYSA-N 1 2 309.413 4.006 20 0 DIADLO CCCCCCOc1cccc(C[N@H+](C)Cc2cc[nH]n2)c1 ZINC000769385120 1052035750 /nfs/dbraw/zinc/03/57/50/1052035750.db2.gz SRTYMDREHRTYRY-UHFFFAOYSA-N 1 2 301.434 4.001 20 0 DIADLO CCCCCCOc1cccc(C[N@@H+](C)Cc2cc[nH]n2)c1 ZINC000769385120 1052035763 /nfs/dbraw/zinc/03/57/63/1052035763.db2.gz SRTYMDREHRTYRY-UHFFFAOYSA-N 1 2 301.434 4.001 20 0 DIADLO Cc1ncc2c(n1)CCC[C@@H]2[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000769412818 1052041168 /nfs/dbraw/zinc/04/11/68/1052041168.db2.gz HFNQTGWLFYBIPG-FZMZJTMJSA-N 1 2 316.474 4.093 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2occc2Br)n1 ZINC000769424945 1052044824 /nfs/dbraw/zinc/04/48/24/1052044824.db2.gz AQAIENSKQPPXHG-CQSZACIVSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2occc2Br)n1 ZINC000769424945 1052044833 /nfs/dbraw/zinc/04/48/33/1052044833.db2.gz AQAIENSKQPPXHG-CQSZACIVSA-N 1 2 321.218 4.083 20 0 DIADLO CCOc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)n1 ZINC000769428706 1052048336 /nfs/dbraw/zinc/04/83/36/1052048336.db2.gz RGTKMTJFIJXXGL-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cccc(C[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)n1 ZINC000769428706 1052048340 /nfs/dbraw/zinc/04/83/40/1052048340.db2.gz RGTKMTJFIJXXGL-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2ccc(Br)s2)C1 ZINC001137641252 1052058460 /nfs/dbraw/zinc/05/84/60/1052058460.db2.gz RSHBHNXVZUURPO-LBPRGKRZSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2ccc(Br)s2)C1 ZINC001137641252 1052058471 /nfs/dbraw/zinc/05/84/71/1052058471.db2.gz RSHBHNXVZUURPO-LBPRGKRZSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2F)[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458737 1052061426 /nfs/dbraw/zinc/06/14/26/1052061426.db2.gz ZMVSJOGCCSGFSN-YVEFUNNKSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458737 1052061438 /nfs/dbraw/zinc/06/14/38/1052061438.db2.gz ZMVSJOGCCSGFSN-YVEFUNNKSA-N 1 2 300.377 4.274 20 0 DIADLO Cc1ccccc1N1CC[NH+]([C@@H](C)c2ccc(F)cc2F)CC1 ZINC000195594215 1052063156 /nfs/dbraw/zinc/06/31/56/1052063156.db2.gz OKPWSZLCOVRNMV-HNNXBMFYSA-N 1 2 316.395 4.156 20 0 DIADLO CC(C)c1cc(Cl)ccc1NC(=O)c1cccc2[nH+]ccn21 ZINC001131420904 1052066454 /nfs/dbraw/zinc/06/64/54/1052066454.db2.gz QNGALPFBAFLZTD-UHFFFAOYSA-N 1 2 313.788 4.363 20 0 DIADLO Fc1ccc([C@@H]2CCCC[N@@H+]2Cc2coc(C3CC3)n2)cc1 ZINC000769512364 1052071275 /nfs/dbraw/zinc/07/12/75/1052071275.db2.gz DFPGTKICHZCARP-KRWDZBQOSA-N 1 2 300.377 4.418 20 0 DIADLO Fc1ccc([C@@H]2CCCC[N@H+]2Cc2coc(C3CC3)n2)cc1 ZINC000769512364 1052071288 /nfs/dbraw/zinc/07/12/88/1052071288.db2.gz DFPGTKICHZCARP-KRWDZBQOSA-N 1 2 300.377 4.418 20 0 DIADLO c1cn2c(cccc2-c2nc(-c3cccc4ccccc43)no2)[nH+]1 ZINC001217500807 1052074268 /nfs/dbraw/zinc/07/42/68/1052074268.db2.gz LWKYGFBSURUKKB-UHFFFAOYSA-N 1 2 312.332 4.205 20 0 DIADLO Cc1ccc(Cl)cc1-c1noc(-c2cccc3[nH+]ccn32)n1 ZINC001217500067 1052074559 /nfs/dbraw/zinc/07/45/59/1052074559.db2.gz RPJXLIYLZPJFBE-UHFFFAOYSA-N 1 2 310.744 4.013 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1occc1Br ZINC000769536543 1052077860 /nfs/dbraw/zinc/07/78/60/1052077860.db2.gz ATFDFMXELLQRKY-CQSZACIVSA-N 1 2 323.234 4.108 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1occc1Br ZINC000769536543 1052077870 /nfs/dbraw/zinc/07/78/70/1052077870.db2.gz ATFDFMXELLQRKY-CQSZACIVSA-N 1 2 323.234 4.108 20 0 DIADLO FC(F)(F)c1ccc(Nc2cc[nH+]c3ccc(Cl)cc23)cn1 ZINC001174309454 1052091334 /nfs/dbraw/zinc/09/13/34/1052091334.db2.gz PVOKZVDRAPMDSX-UHFFFAOYSA-N 1 2 323.705 4.468 20 0 DIADLO FC(F)(F)c1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)cn1 ZINC001174310136 1052091674 /nfs/dbraw/zinc/09/16/74/1052091674.db2.gz PVRVGDRNIZGAGO-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1coc(-c2cccs2)n1 ZINC000769873959 1052124777 /nfs/dbraw/zinc/12/47/77/1052124777.db2.gz JEMQEDMKOIRJAK-JTQLQIEISA-N 1 2 317.414 4.113 20 0 DIADLO Cn1cc(-c2ccc(Nc3cccc(-n4cc[nH+]c4)c3)cc2)cn1 ZINC001174378242 1052136970 /nfs/dbraw/zinc/13/69/70/1052136970.db2.gz UFWGXVBJBYAHSI-UHFFFAOYSA-N 1 2 315.380 4.016 20 0 DIADLO COc1ccc(OC)c(Nc2ccc3c(c2)[nH+]cn3C(C)C)c1 ZINC001174381125 1052138796 /nfs/dbraw/zinc/13/87/96/1052138796.db2.gz GPAFVFGILLWABW-UHFFFAOYSA-N 1 2 311.385 4.378 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ncc4ccccc4n3)ccc21 ZINC001174380864 1052139006 /nfs/dbraw/zinc/13/90/06/1052139006.db2.gz NOIANBRAHSWYFL-UHFFFAOYSA-N 1 2 303.369 4.304 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4nccnc4c3)ccc21 ZINC001174381145 1052139184 /nfs/dbraw/zinc/13/91/84/1052139184.db2.gz HNBXVKMTLHAJKX-UHFFFAOYSA-N 1 2 303.369 4.304 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3csc4nccnc34)ccc21 ZINC001174382033 1052140189 /nfs/dbraw/zinc/14/01/89/1052140189.db2.gz UXLLWTLUMVLHGQ-UHFFFAOYSA-N 1 2 309.398 4.366 20 0 DIADLO COc1cc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cc(Cl)n1 ZINC001174381927 1052140521 /nfs/dbraw/zinc/14/05/21/1052140521.db2.gz SRSIVFOOQHGTIM-UHFFFAOYSA-N 1 2 316.792 4.418 20 0 DIADLO Cc1cc(Nc2ccc3c(c2)[nH+]cn3C(C)C)n(CC2CC2)n1 ZINC001174382224 1052140596 /nfs/dbraw/zinc/14/05/96/1052140596.db2.gz FJJPKLVBPQODNE-UHFFFAOYSA-N 1 2 309.417 4.276 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3c(N)cc(F)cc3F)ccc21 ZINC001174381911 1052141303 /nfs/dbraw/zinc/14/13/03/1052141303.db2.gz WIXUZGUFOLBJAB-UHFFFAOYSA-N 1 2 302.328 4.221 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccnn3CC(F)(F)F)ccc21 ZINC001174382240 1052141439 /nfs/dbraw/zinc/14/14/39/1052141439.db2.gz FZJSGOUOHIAZJG-UHFFFAOYSA-N 1 2 323.322 4.120 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cn(CC4CCC4)cn3)ccc21 ZINC001174382493 1052142507 /nfs/dbraw/zinc/14/25/07/1052142507.db2.gz SCQXZLHZHKLKTO-UHFFFAOYSA-N 1 2 309.417 4.357 20 0 DIADLO c1cc2cc(Nc3ccccc3C[NH+]3CCOCC3)ccc2o1 ZINC001174416708 1052146240 /nfs/dbraw/zinc/14/62/40/1052146240.db2.gz AMWOMKQDGQWZTB-UHFFFAOYSA-N 1 2 308.381 4.009 20 0 DIADLO COC(=O)c1ccc(Nc2c(C)cc[nH+]c2C(C)C)cc1OC ZINC001174427204 1052155972 /nfs/dbraw/zinc/15/59/72/1052155972.db2.gz DSDPZTYHCIPVOY-UHFFFAOYSA-N 1 2 314.385 4.052 20 0 DIADLO COC(=O)c1ccc(Nc2ccc3c(C)cc[nH+]c3c2)cc1OC ZINC001174430645 1052157276 /nfs/dbraw/zinc/15/72/76/1052157276.db2.gz FOXDGMCEADQLBM-UHFFFAOYSA-N 1 2 322.364 4.082 20 0 DIADLO CC[C@H](C[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1)c1ccccc1 ZINC000494901942 1052163430 /nfs/dbraw/zinc/16/34/30/1052163430.db2.gz GWONKMNXOISUJA-CRAIPNDOSA-N 1 2 312.461 4.210 20 0 DIADLO CC[C@@H](C[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1)c1ccccc1 ZINC000494901943 1052163897 /nfs/dbraw/zinc/16/38/97/1052163897.db2.gz GWONKMNXOISUJA-MAUKXSAKSA-N 1 2 312.461 4.210 20 0 DIADLO CSc1ccc(C[N@@H+]2CCc3ccc(C(C)=O)cc3C2)cc1 ZINC001204141258 1052166256 /nfs/dbraw/zinc/16/62/56/1052166256.db2.gz LOKBWVDQECOUSX-UHFFFAOYSA-N 1 2 311.450 4.169 20 0 DIADLO CSc1ccc(C[N@H+]2CCc3ccc(C(C)=O)cc3C2)cc1 ZINC001204141258 1052166263 /nfs/dbraw/zinc/16/62/63/1052166263.db2.gz LOKBWVDQECOUSX-UHFFFAOYSA-N 1 2 311.450 4.169 20 0 DIADLO O=C(c1ccccc1)c1ccc(Nc2cc[nH+]c3[nH]ccc32)cc1 ZINC001174412681 1052166295 /nfs/dbraw/zinc/16/62/95/1052166295.db2.gz XLZDLMSTGVNPPC-UHFFFAOYSA-N 1 2 313.360 4.489 20 0 DIADLO CCOC(=O)c1cc(Cl)cc(Nc2cc[nH+]c3[nH]ccc32)c1 ZINC001174415036 1052167417 /nfs/dbraw/zinc/16/74/17/1052167417.db2.gz FKELBUGPCKPLAD-UHFFFAOYSA-N 1 2 315.760 4.088 20 0 DIADLO COC(=O)c1cccc2c(Nc3cc[nH+]c4[nH]ccc43)cccc12 ZINC001174415697 1052168277 /nfs/dbraw/zinc/16/82/77/1052168277.db2.gz REJPCFXXJJGKSV-UHFFFAOYSA-N 1 2 317.348 4.198 20 0 DIADLO C[C@@H]1C[N@H+](Cc2sccc2Cl)C[C@@H](c2ccccc2)O1 ZINC000494948135 1052177827 /nfs/dbraw/zinc/17/78/27/1052177827.db2.gz LAIVIKYAKRALHV-DOMZBBRYSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2sccc2Cl)C[C@@H](c2ccccc2)O1 ZINC000494948135 1052177830 /nfs/dbraw/zinc/17/78/30/1052177830.db2.gz LAIVIKYAKRALHV-DOMZBBRYSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1ccc(C)c([C@@H]2C[N@H+](C/C=C\c3ccncc3)[C@H](C)CO2)c1 ZINC000494960608 1052183232 /nfs/dbraw/zinc/18/32/32/1052183232.db2.gz YARQDVYVLOPGCG-MJDPLZIPSA-N 1 2 322.452 4.174 20 0 DIADLO Cc1ccc(C)c([C@@H]2C[N@@H+](C/C=C\c3ccncc3)[C@H](C)CO2)c1 ZINC000494960608 1052183236 /nfs/dbraw/zinc/18/32/36/1052183236.db2.gz YARQDVYVLOPGCG-MJDPLZIPSA-N 1 2 322.452 4.174 20 0 DIADLO C[C@@H](CC[NH2+][C@H](c1ncn[nH]1)C1CCCCC1)c1ccccc1 ZINC000494983403 1052188795 /nfs/dbraw/zinc/18/87/95/1052188795.db2.gz YDJXRMKYPZYVGD-YJBOKZPZSA-N 1 2 312.461 4.210 20 0 DIADLO CC(C)C[C@@H](c1nc(-c2ccc3cc[nH]c3c2)no1)n1cc[nH+]c1 ZINC000923858153 1052207663 /nfs/dbraw/zinc/20/76/63/1052207663.db2.gz GJFDDIISQCJIMB-INIZCTEOSA-N 1 2 321.384 4.050 20 0 DIADLO Nc1[nH+]cccc1O[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC001218212996 1052209000 /nfs/dbraw/zinc/20/90/00/1052209000.db2.gz BYMJRXHFJORJOR-QGZVFWFLSA-N 1 2 310.784 4.486 20 0 DIADLO C[C@@H](Oc1cc(N)cc[nH+]1)c1cc2cccc(F)c2nc1Cl ZINC001218223083 1052209776 /nfs/dbraw/zinc/20/97/76/1052209776.db2.gz VGHURQFFZRBGMI-SECBINFHSA-N 1 2 317.751 4.145 20 0 DIADLO CC(C)(C[NH2+][C@H](c1ncn[nH]1)C1CCCCC1)C1CCCC1 ZINC000495088059 1052213681 /nfs/dbraw/zinc/21/36/81/1052213681.db2.gz DEPRTHMXIZFDEX-INIZCTEOSA-N 1 2 304.482 4.232 20 0 DIADLO Nc1[nH+]cccc1OC1c2ccccc2C=Cc2ccccc21 ZINC001218294547 1052218476 /nfs/dbraw/zinc/21/84/76/1052218476.db2.gz VTGGRGNYAZAJOQ-UHFFFAOYSA-N 1 2 300.361 4.316 20 0 DIADLO c1cn(-c2ccc(-c3nc(CC4CCCCC4)no3)cc2)c[nH+]1 ZINC000761819484 1052229490 /nfs/dbraw/zinc/22/94/90/1052229490.db2.gz JPVDCHJRDZTLPU-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO Nc1[nH+]cccc1O[C@@H](c1ccccc1)c1ccccc1Cl ZINC001218372987 1052232268 /nfs/dbraw/zinc/23/22/68/1052232268.db2.gz UNDGPVYFLRERSV-KRWDZBQOSA-N 1 2 310.784 4.486 20 0 DIADLO Nc1[nH+]cccc1O[C@H](c1ccccc1)c1ccccc1Cl ZINC001218372989 1052232343 /nfs/dbraw/zinc/23/23/43/1052232343.db2.gz UNDGPVYFLRERSV-QGZVFWFLSA-N 1 2 310.784 4.486 20 0 DIADLO O=C(C/C=C/c1ccccc1F)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000495184563 1052249125 /nfs/dbraw/zinc/24/91/25/1052249125.db2.gz PDMBBZIEFXQLQF-HWKANZROSA-N 1 2 321.355 4.053 20 0 DIADLO CCCCn1c(SCC2CCCC2)nnc1[C@@H](CC)[NH+](C)C ZINC000193211262 1052249814 /nfs/dbraw/zinc/24/98/14/1052249814.db2.gz XFARQPBHSVODIN-OAHLLOKOSA-N 1 2 324.538 4.373 20 0 DIADLO CC(C)(C)[C@H]1CCCC[C@H]1NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001219556652 1052293168 /nfs/dbraw/zinc/29/31/68/1052293168.db2.gz AEWMLFLXXVFWMH-LSDHHAIUSA-N 1 2 314.433 4.061 20 0 DIADLO CC(C)[C@@H]1CN(C(=O)Nc2ccc3[nH+]ccn3c2)c2ccccc21 ZINC001219557165 1052293654 /nfs/dbraw/zinc/29/36/54/1052293654.db2.gz SEWCWVSRBHVRBA-INIZCTEOSA-N 1 2 320.396 4.126 20 0 DIADLO Cc1ccccc1-c1nn(C[N@@H+](C)[C@H](C)C(C)C)c(=S)o1 ZINC000915208482 1052367287 /nfs/dbraw/zinc/36/72/87/1052367287.db2.gz DMLNJJCXQJSJDC-CYBMUJFWSA-N 1 2 305.447 4.115 20 0 DIADLO Cc1ccccc1-c1nn(C[N@H+](C)[C@H](C)C(C)C)c(=S)o1 ZINC000915208482 1052367291 /nfs/dbraw/zinc/36/72/91/1052367291.db2.gz DMLNJJCXQJSJDC-CYBMUJFWSA-N 1 2 305.447 4.115 20 0 DIADLO S=c1oc(-c2cccs2)nn1C[N@H+](C1CC1)C1CCCC1 ZINC000915208239 1052367572 /nfs/dbraw/zinc/36/75/72/1052367572.db2.gz DDZBPANTPJDLTM-UHFFFAOYSA-N 1 2 321.471 4.299 20 0 DIADLO S=c1oc(-c2cccs2)nn1C[N@@H+](C1CC1)C1CCCC1 ZINC000915208239 1052367580 /nfs/dbraw/zinc/36/75/80/1052367580.db2.gz DDZBPANTPJDLTM-UHFFFAOYSA-N 1 2 321.471 4.299 20 0 DIADLO Cc1cc(N[C@H](c2ccccn2)C(F)(F)F)ccc1[NH+](C)C ZINC001168489145 1052369058 /nfs/dbraw/zinc/36/90/58/1052369058.db2.gz DTWOVQSYVPMZOE-OAHLLOKOSA-N 1 2 309.335 4.172 20 0 DIADLO CNc1ccc(Nc2c(Cl)cc(Cl)nc2Cl)c[nH+]1 ZINC001203451943 1052374427 /nfs/dbraw/zinc/37/44/27/1052374427.db2.gz GJBOZFCYLJBECW-UHFFFAOYSA-N 1 2 303.580 4.222 20 0 DIADLO COC(=O)c1ccccc1C[N@H+](C)[C@@H](C)c1ccccc1Cl ZINC000316809832 1052375085 /nfs/dbraw/zinc/37/50/85/1052375085.db2.gz ANTGKXZICBVWEM-ZDUSSCGKSA-N 1 2 317.816 4.320 20 0 DIADLO COC(=O)c1ccccc1C[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC000316809832 1052375090 /nfs/dbraw/zinc/37/50/90/1052375090.db2.gz ANTGKXZICBVWEM-ZDUSSCGKSA-N 1 2 317.816 4.320 20 0 DIADLO c1csc(C2([NH2+]Cc3nsc4ccccc43)CCCC2)n1 ZINC000660094736 1052375994 /nfs/dbraw/zinc/37/59/94/1052375994.db2.gz ZOKJCTJJEHOJMZ-UHFFFAOYSA-N 1 2 315.467 4.312 20 0 DIADLO CN(C)c1cc(CSc2cccc(C(F)(F)F)c2)cc[nH+]1 ZINC000762469559 1052387723 /nfs/dbraw/zinc/38/77/23/1052387723.db2.gz ORIXKRVWYYZXOA-UHFFFAOYSA-N 1 2 312.360 4.459 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2ccccc2F)c2ccccn2)c1 ZINC000153559523 1052394251 /nfs/dbraw/zinc/39/42/51/1052394251.db2.gz OOFTVHAUSMYTSO-HXUWFJFHSA-N 1 2 306.384 4.408 20 0 DIADLO CC1(C)Cc2cc(CNc3ccc(N4CCCC4)[nH+]c3)ccc2O1 ZINC000236697756 1052428949 /nfs/dbraw/zinc/42/89/49/1052428949.db2.gz QSOXZKWRMFYBPV-UHFFFAOYSA-N 1 2 323.440 4.007 20 0 DIADLO CC(C)(C)c1ccc(NC2CCN(c3cccc[nH+]3)CC2)cc1 ZINC000236685668 1052428959 /nfs/dbraw/zinc/42/89/59/1052428959.db2.gz TXTRWNDMHFJHJH-UHFFFAOYSA-N 1 2 309.457 4.460 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)OCc3ccccc3C(C)(C)C)ccn12 ZINC001127375286 1052429949 /nfs/dbraw/zinc/42/99/49/1052429949.db2.gz QRPBTQAORPTGHZ-UHFFFAOYSA-N 1 2 322.408 4.297 20 0 DIADLO CCOc1cc(F)ccc1NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000237069555 1052434449 /nfs/dbraw/zinc/43/44/49/1052434449.db2.gz VTCVNLBYXDDYMR-UHFFFAOYSA-N 1 2 311.360 4.022 20 0 DIADLO CC(C)Cc1ccc([C@H](C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000393374582 1052441125 /nfs/dbraw/zinc/44/11/25/1052441125.db2.gz RHJCSXHLBSJABF-ZDUSSCGKSA-N 1 2 305.853 4.123 20 0 DIADLO Cc1ccc(OC(C)C)cc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001222137509 1052448512 /nfs/dbraw/zinc/44/85/12/1052448512.db2.gz GMVRKEUZGGGXPW-UHFFFAOYSA-N 1 2 307.397 4.089 20 0 DIADLO CNc1ccc(Nc2cc(C)nn2-c2ccc(Cl)cc2)c[nH+]1 ZINC001203452986 1052458095 /nfs/dbraw/zinc/45/80/95/1052458095.db2.gz VIRHERFPJVJJDH-UHFFFAOYSA-N 1 2 313.792 4.014 20 0 DIADLO COCc1ccc(Cl)c(-c2cc(N)c(C(F)(F)F)c[nH+]2)c1 ZINC001222245763 1052468105 /nfs/dbraw/zinc/46/81/05/1052468105.db2.gz NQQXEWXFGJSUPO-UHFFFAOYSA-N 1 2 316.710 4.149 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1cc(C)c(C)o1)c1nnc2n1CCCCC2 ZINC000282113739 1052487600 /nfs/dbraw/zinc/48/76/00/1052487600.db2.gz JDTBMPVEWCZEQK-DZGCQCFKSA-N 1 2 316.449 4.016 20 0 DIADLO C[C@@H](OCc1c[nH+]cn1C)c1cc2cccc(F)c2nc1Cl ZINC001222595279 1052514781 /nfs/dbraw/zinc/51/47/81/1052514781.db2.gz VUDSNHKCZWFSEE-SNVBAGLBSA-N 1 2 319.767 4.039 20 0 DIADLO Cn1c[nH+]cc1CO[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC001222594022 1052515244 /nfs/dbraw/zinc/51/52/44/1052515244.db2.gz BQCWYQRTPFJIQU-GOSISDBHSA-N 1 2 312.800 4.380 20 0 DIADLO Cn1c[nH+]cc1COC1c2ccccc2C=Cc2ccccc21 ZINC001222595384 1052515358 /nfs/dbraw/zinc/51/53/58/1052515358.db2.gz YKSQHWPKWKEVLW-UHFFFAOYSA-N 1 2 302.377 4.210 20 0 DIADLO Cn1c[nH+]cc1CO[C@H](/C=C/c1ccccc1)c1ccccc1 ZINC001222600095 1052516782 /nfs/dbraw/zinc/51/67/82/1052516782.db2.gz ISVMNTGVZGHGSN-DRUFCSCSSA-N 1 2 304.393 4.391 20 0 DIADLO Cn1c[nH+]cc1CO[C@H]1CCN(c2ccccc2)c2ccccc21 ZINC001222599461 1052516846 /nfs/dbraw/zinc/51/68/46/1052516846.db2.gz BMPPZXOTRHAFJA-FQEVSTJZSA-N 1 2 319.408 4.220 20 0 DIADLO Cc1cc(C)cc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000107072346 1052544063 /nfs/dbraw/zinc/54/40/63/1052544063.db2.gz UHUVKUMRPYUCGT-ZIAGYGMSSA-N 1 2 301.434 4.396 20 0 DIADLO Cc1cc(C)cc([C@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000107072348 1052544570 /nfs/dbraw/zinc/54/45/70/1052544570.db2.gz UHUVKUMRPYUCGT-UONOGXRCSA-N 1 2 301.434 4.396 20 0 DIADLO C[C@H](c1nc2ccccc2c(=O)[nH]1)[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000916152348 1052594353 /nfs/dbraw/zinc/59/43/53/1052594353.db2.gz PQUKVFQMJMKOIT-ZIAGYGMSSA-N 1 2 319.408 4.016 20 0 DIADLO C[C@H](c1nc2ccccc2c(=O)[nH]1)[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000916152348 1052594360 /nfs/dbraw/zinc/59/43/60/1052594360.db2.gz PQUKVFQMJMKOIT-ZIAGYGMSSA-N 1 2 319.408 4.016 20 0 DIADLO Cc1cc(CO[C@H](C)c2cccc(Br)n2)cc(C)[nH+]1 ZINC001223419676 1052598665 /nfs/dbraw/zinc/59/86/65/1052598665.db2.gz GWCDUCXVYDEYIH-GFCCVEGCSA-N 1 2 321.218 4.134 20 0 DIADLO Cc1cc(CO[C@H](C(=O)c2ccco2)c2ccco2)cc(C)[nH+]1 ZINC001223422624 1052599112 /nfs/dbraw/zinc/59/91/12/1052599112.db2.gz YEODFRRVHXIZAU-SFHVURJKSA-N 1 2 311.337 4.025 20 0 DIADLO Cc1cc(COCc2c(F)cc(OC(C)C)cc2F)cc(C)[nH+]1 ZINC001223425448 1052600363 /nfs/dbraw/zinc/60/03/63/1052600363.db2.gz RVGWTMVKWBOBCM-UHFFFAOYSA-N 1 2 321.367 4.481 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1cnc2ccccc2c1 ZINC000763413490 1052626921 /nfs/dbraw/zinc/62/69/21/1052626921.db2.gz ULOMVWIPSYGJDE-UHFFFAOYSA-N 1 2 302.381 4.217 20 0 DIADLO CC[C@@H](C)Oc1cccc(NCc2[nH+]cc(C)c(OC)c2C)c1 ZINC000321093835 1052627575 /nfs/dbraw/zinc/62/75/75/1052627575.db2.gz KSIXUQVBNMZZTC-CQSZACIVSA-N 1 2 314.429 4.496 20 0 DIADLO Cc1cc(C)c2[nH+]c(NC3(c4cccnn4)CC3)cc(C)c2c1 ZINC001168513155 1052633884 /nfs/dbraw/zinc/63/38/84/1052633884.db2.gz MUKPZRIYAPXFPZ-UHFFFAOYSA-N 1 2 304.397 4.051 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2cccc(Cl)c2)nc2ccccc12 ZINC000124000911 1052636283 /nfs/dbraw/zinc/63/62/83/1052636283.db2.gz QQGGWUPTRXFIJJ-LBPRGKRZSA-N 1 2 311.816 4.442 20 0 DIADLO CC[C@H](C)[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)C(=O)OC(C)(C)C ZINC001168519200 1052647772 /nfs/dbraw/zinc/64/77/72/1052647772.db2.gz IYJADWFEYQBBRZ-IHRRRGAJSA-N 1 2 319.436 4.158 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@@H](C)c2cccc(OC(F)F)c2)[nH+]1 ZINC000080947974 1052654954 /nfs/dbraw/zinc/65/49/54/1052654954.db2.gz FCRNSNRJKLPXBW-VIFPVBQESA-N 1 2 318.327 4.041 20 0 DIADLO COc1ccc(Cl)cc1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000916840861 1052659206 /nfs/dbraw/zinc/65/92/06/1052659206.db2.gz HHWXMHJLPSUSAE-UHFFFAOYSA-N 1 2 313.788 4.146 20 0 DIADLO Fc1cccc2c1nc(-c1ccc(-n3cc[nH+]c3)cc1)n2C1CC1 ZINC000916854172 1052659974 /nfs/dbraw/zinc/65/99/74/1052659974.db2.gz CCZZOYLQXKCQCB-UHFFFAOYSA-N 1 2 318.355 4.363 20 0 DIADLO COc1ccc(C#N)c(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC000321304022 1052669292 /nfs/dbraw/zinc/66/92/92/1052669292.db2.gz KIYHUBDPVXALDF-UHFFFAOYSA-N 1 2 307.397 4.301 20 0 DIADLO N#Cc1ccc(C(F)(F)F)nc1Nc1cccc2cc[nH+]cc21 ZINC000321308801 1052669390 /nfs/dbraw/zinc/66/93/90/1052669390.db2.gz QQROAOBSTMXQCT-UHFFFAOYSA-N 1 2 314.270 4.264 20 0 DIADLO CCCCCC[C@@H](C)NC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000916962905 1052674715 /nfs/dbraw/zinc/67/47/15/1052674715.db2.gz CADZFHIBHOUFIF-MRXNPFEDSA-N 1 2 313.445 4.020 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2ccn(-c3ccccc3)n2)c1 ZINC000917068164 1052690885 /nfs/dbraw/zinc/69/08/85/1052690885.db2.gz GCIBYQFNJZAFKO-UHFFFAOYSA-N 1 2 305.425 4.121 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2ccn(-c3ccccc3)n2)c1 ZINC000917068164 1052690890 /nfs/dbraw/zinc/69/08/90/1052690890.db2.gz GCIBYQFNJZAFKO-UHFFFAOYSA-N 1 2 305.425 4.121 20 0 DIADLO C[N@H+](Cc1cc2ccccc2o1)Cc1nc(-c2ccccc2)no1 ZINC000127298855 1052691913 /nfs/dbraw/zinc/69/19/13/1052691913.db2.gz WDXLPAPQPMRNGJ-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2o1)Cc1nc(-c2ccccc2)no1 ZINC000127298855 1052691914 /nfs/dbraw/zinc/69/19/14/1052691914.db2.gz WDXLPAPQPMRNGJ-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO Cc1cn2cccc(Nc3cc(F)c(F)cc3OC(C)C)c2[nH+]1 ZINC001212222328 1052697114 /nfs/dbraw/zinc/69/71/14/1052697114.db2.gz MLZRANJPIIWCDQ-UHFFFAOYSA-N 1 2 317.339 4.452 20 0 DIADLO COCc1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)o1 ZINC000127576304 1052698574 /nfs/dbraw/zinc/69/85/74/1052698574.db2.gz KGJVUPNUOZUEHY-NSHDSACASA-N 1 2 308.447 4.031 20 0 DIADLO O=[N+]([O-])c1cc(F)cc(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC000321529673 1052708077 /nfs/dbraw/zinc/70/80/77/1052708077.db2.gz IXKOBKHWAXBPQN-UHFFFAOYSA-N 1 2 315.348 4.468 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000128086964 1052709023 /nfs/dbraw/zinc/70/90/23/1052709023.db2.gz QNRJXOABTAHWQS-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000128086964 1052709031 /nfs/dbraw/zinc/70/90/31/1052709031.db2.gz QNRJXOABTAHWQS-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO Cc1ccc(F)c(-c2noc([C@H](CC(C)C)n3cc[nH+]c3)n2)c1 ZINC000924009896 1052717008 /nfs/dbraw/zinc/71/70/08/1052717008.db2.gz VESHYJSULMPOPK-HNNXBMFYSA-N 1 2 314.364 4.016 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(Nc2ccccc2)cc1)n1cc[nH+]c1 ZINC000917359620 1052723301 /nfs/dbraw/zinc/72/33/01/1052723301.db2.gz CPEGGNWFBZDWDL-OAHLLOKOSA-N 1 2 320.396 4.217 20 0 DIADLO Cc1ccccc1C(N)=[NH+]OCc1ccc(C(F)(F)F)cc1 ZINC000917392893 1052723419 /nfs/dbraw/zinc/72/34/19/1052723419.db2.gz SARDRCUTBSYDCB-UHFFFAOYSA-N 1 2 308.303 4.061 20 0 DIADLO CCCC[N@H+](CC)Cn1ncn([C@@H](C)c2ccccc2)c1=S ZINC000917428966 1052728168 /nfs/dbraw/zinc/72/81/68/1052728168.db2.gz OMQDXRKICIFFHW-HNNXBMFYSA-N 1 2 318.490 4.103 20 0 DIADLO CCCC[N@@H+](CC)Cn1ncn([C@@H](C)c2ccccc2)c1=S ZINC000917428966 1052728172 /nfs/dbraw/zinc/72/81/72/1052728172.db2.gz OMQDXRKICIFFHW-HNNXBMFYSA-N 1 2 318.490 4.103 20 0 DIADLO Cc1nn(C[N@@H+]2CCC[C@@H]2CCc2ccccc2)c(=S)s1 ZINC000917478175 1052729489 /nfs/dbraw/zinc/72/94/89/1052729489.db2.gz KQCMFKLYNXKGKK-OAHLLOKOSA-N 1 2 319.499 4.037 20 0 DIADLO Cc1nn(C[N@H+]2CCC[C@@H]2CCc2ccccc2)c(=S)s1 ZINC000917478175 1052729496 /nfs/dbraw/zinc/72/94/96/1052729496.db2.gz KQCMFKLYNXKGKK-OAHLLOKOSA-N 1 2 319.499 4.037 20 0 DIADLO Cc1cccc(O[C@H]2CCC[N@H+](Cc3cnc(Cl)s3)C2)c1 ZINC001225242218 1052762152 /nfs/dbraw/zinc/76/21/52/1052762152.db2.gz PXVVVCGFBNJLKY-AWEZNQCLSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1cccc(O[C@H]2CCC[N@@H+](Cc3cnc(Cl)s3)C2)c1 ZINC001225242218 1052762156 /nfs/dbraw/zinc/76/21/56/1052762156.db2.gz PXVVVCGFBNJLKY-AWEZNQCLSA-N 1 2 322.861 4.148 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1ccccc1Cl ZINC000068960035 1052774346 /nfs/dbraw/zinc/77/43/46/1052774346.db2.gz MEFMOVLIGWZYSH-CQSZACIVSA-N 1 2 311.816 4.377 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@H+](C)Cc1ccn(-c2ccccc2)n1 ZINC000918187210 1052787236 /nfs/dbraw/zinc/78/72/36/1052787236.db2.gz ZAMLIDMRGLELLQ-OAHLLOKOSA-N 1 2 309.388 4.204 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@@H+](C)Cc1ccn(-c2ccccc2)n1 ZINC000918187210 1052787243 /nfs/dbraw/zinc/78/72/43/1052787243.db2.gz ZAMLIDMRGLELLQ-OAHLLOKOSA-N 1 2 309.388 4.204 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cc1ccc(C(F)(F)F)cn1 ZINC000556495852 1052856767 /nfs/dbraw/zinc/85/67/67/1052856767.db2.gz XAVVLKINGINLFH-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1ccc(C(F)(F)F)cn1 ZINC000556495852 1052856774 /nfs/dbraw/zinc/85/67/74/1052856774.db2.gz XAVVLKINGINLFH-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000170762015 1052865539 /nfs/dbraw/zinc/86/55/39/1052865539.db2.gz JVJNJZKWMHFYSN-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccccc1)[N@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000170762015 1052865546 /nfs/dbraw/zinc/86/55/46/1052865546.db2.gz JVJNJZKWMHFYSN-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2ccc(C3CC3)c(C)c2)c[nH+]1 ZINC000556613965 1052870914 /nfs/dbraw/zinc/87/09/14/1052870914.db2.gz XRQZQMOVYKKCMU-UHFFFAOYSA-N 1 2 309.413 4.206 20 0 DIADLO Cc1ccc(OC(F)F)c(C[N@H+]2CC=C(C(F)(F)F)CC2)c1 ZINC000556895176 1052893391 /nfs/dbraw/zinc/89/33/91/1052893391.db2.gz JCVATBSFKBITGA-UHFFFAOYSA-N 1 2 321.289 4.291 20 0 DIADLO Cc1ccc(OC(F)F)c(C[N@@H+]2CC=C(C(F)(F)F)CC2)c1 ZINC000556895176 1052893396 /nfs/dbraw/zinc/89/33/96/1052893396.db2.gz JCVATBSFKBITGA-UHFFFAOYSA-N 1 2 321.289 4.291 20 0 DIADLO CCC/C=C\C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000920472859 1052943096 /nfs/dbraw/zinc/94/30/96/1052943096.db2.gz GSMOXLJGOMYCIJ-YWEYNIOJSA-N 1 2 309.413 4.181 20 0 DIADLO Cc1nn(C[N@@H+](C)C2CCC(C(C)(C)C)CC2)c(=S)s1 ZINC000921045314 1052960892 /nfs/dbraw/zinc/96/08/92/1052960892.db2.gz AGXAPUOFQADYAX-UHFFFAOYSA-N 1 2 313.536 4.477 20 0 DIADLO Cc1nn(C[N@H+](C)C2CCC(C(C)(C)C)CC2)c(=S)s1 ZINC000921045314 1052960895 /nfs/dbraw/zinc/96/08/95/1052960895.db2.gz AGXAPUOFQADYAX-UHFFFAOYSA-N 1 2 313.536 4.477 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@@H]2CCSc3ccccc32)n1 ZINC000921489158 1052972973 /nfs/dbraw/zinc/97/29/73/1052972973.db2.gz XTPPTNOKAFNFJJ-CYBMUJFWSA-N 1 2 302.443 4.299 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2cccc(C(F)(F)F)c2)n1 ZINC000921479015 1052973899 /nfs/dbraw/zinc/97/38/99/1052973899.db2.gz ZKNZVNSFUYQSAR-UHFFFAOYSA-N 1 2 312.335 4.281 20 0 DIADLO CC[C@@H]1CCC[C@H](Nc2nc(C)[nH+]c(C)c2Br)C1 ZINC000322905156 1052974416 /nfs/dbraw/zinc/97/44/16/1052974416.db2.gz QVNTZILCUINZIQ-NEPJUHHUSA-N 1 2 312.255 4.237 20 0 DIADLO COc1ccc(OC(C)C)c(COc2c(C)cc[nH+]c2C)c1 ZINC001227266157 1052978097 /nfs/dbraw/zinc/97/80/97/1052978097.db2.gz XFHWTJOHGQZLMX-UHFFFAOYSA-N 1 2 301.386 4.073 20 0 DIADLO CC[C@H](Nc1nc(C)[nH+]c(C)c1Br)c1ccccc1 ZINC000322946647 1052979433 /nfs/dbraw/zinc/97/94/33/1052979433.db2.gz JIMDKGLOOGJHIY-ZDUSSCGKSA-N 1 2 320.234 4.419 20 0 DIADLO Fc1ccc(C2=CC[N@H+](Cc3cnc(Cl)s3)CC2)cc1 ZINC000175405363 1052995051 /nfs/dbraw/zinc/99/50/51/1052995051.db2.gz CAQSQMMMLSQFGM-UHFFFAOYSA-N 1 2 308.809 4.225 20 0 DIADLO Fc1ccc(C2=CC[N@@H+](Cc3cnc(Cl)s3)CC2)cc1 ZINC000175405363 1052995054 /nfs/dbraw/zinc/99/50/54/1052995054.db2.gz CAQSQMMMLSQFGM-UHFFFAOYSA-N 1 2 308.809 4.225 20 0 DIADLO C[C@@H](CSC(C)(C)C)[NH2+]c1ccc(N2CCOC[C@H]2C)cc1 ZINC000179942450 1053036197 /nfs/dbraw/zinc/03/61/97/1053036197.db2.gz AQRMKJLOBFUZTI-LSDHHAIUSA-N 1 2 322.518 4.244 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1cccc(Cl)c1O ZINC000180022134 1053042431 /nfs/dbraw/zinc/04/24/31/1053042431.db2.gz WHOULPDSPZYMDS-CXAGYDPISA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1cccc(Cl)c1O ZINC000180022134 1053042435 /nfs/dbraw/zinc/04/24/35/1053042435.db2.gz WHOULPDSPZYMDS-CXAGYDPISA-N 1 2 317.816 4.008 20 0 DIADLO COc1cc2c(cc1O[C@H]1CCc3ccc(C)cc31)C=[NH+]CC2 ZINC001228088428 1053042735 /nfs/dbraw/zinc/04/27/35/1053042735.db2.gz VGEAUQWBCOSBIF-SFHVURJKSA-N 1 2 307.393 4.045 20 0 DIADLO COc1cc2c(cc1O[C@@H](c1ccccc1)C1CC1)C=[NH+]CC2 ZINC001228086872 1053042896 /nfs/dbraw/zinc/04/28/96/1053042896.db2.gz ITEPUVVRGABONI-FQEVSTJZSA-N 1 2 307.393 4.200 20 0 DIADLO C[N@H+](Cc1nc2c(s1)CCCC2)Cc1cccc(Cl)c1O ZINC000180195949 1053048407 /nfs/dbraw/zinc/04/84/07/1053048407.db2.gz STVFCZDAMCUXKC-UHFFFAOYSA-N 1 2 322.861 4.013 20 0 DIADLO C[N@@H+](Cc1nc2c(s1)CCCC2)Cc1cccc(Cl)c1O ZINC000180195949 1053048412 /nfs/dbraw/zinc/04/84/12/1053048412.db2.gz STVFCZDAMCUXKC-UHFFFAOYSA-N 1 2 322.861 4.013 20 0 DIADLO Cc1[nH]c2ccc(O[C@@H](C(=O)c3ccco3)c3ccco3)cc2[nH+]1 ZINC001228327636 1053073129 /nfs/dbraw/zinc/07/31/29/1053073129.db2.gz SNKUMHSXJBECGL-GOSISDBHSA-N 1 2 322.320 4.060 20 0 DIADLO COc1ccc([C@H](C)Oc2ccc3[nH]c(C)[nH+]c3c2)cc1OC ZINC001228329616 1053075942 /nfs/dbraw/zinc/07/59/42/1053075942.db2.gz PNNLCPJLAVJCOM-NSHDSACASA-N 1 2 312.369 4.029 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1c(F)cccc1F ZINC000849323732 1053087533 /nfs/dbraw/zinc/08/75/33/1053087533.db2.gz RYHLVMBZRCQQAH-LLVKDONJSA-N 1 2 321.342 4.496 20 0 DIADLO Clc1nccc(Br)c1C[N@@H+]1CCC12CCCC2 ZINC001236586264 1053121640 /nfs/dbraw/zinc/12/16/40/1053121640.db2.gz KLOCFLKTMTYMPT-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Clc1nccc(Br)c1C[N@H+]1CCC12CCCC2 ZINC001236586264 1053121648 /nfs/dbraw/zinc/12/16/48/1053121648.db2.gz KLOCFLKTMTYMPT-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO CC(C)c1ccc(NC(=O)C[N@H+](C)[C@@H](C)c2ccco2)cc1 ZINC000069069744 1053108716 /nfs/dbraw/zinc/10/87/16/1053108716.db2.gz BWKTYJUTSSVRAF-AWEZNQCLSA-N 1 2 300.402 4.035 20 0 DIADLO CC(C)c1ccc(NC(=O)C[N@@H+](C)[C@@H](C)c2ccco2)cc1 ZINC000069069744 1053108721 /nfs/dbraw/zinc/10/87/21/1053108721.db2.gz BWKTYJUTSSVRAF-AWEZNQCLSA-N 1 2 300.402 4.035 20 0 DIADLO COc1ccnc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC001350932899 1053118009 /nfs/dbraw/zinc/11/80/09/1053118009.db2.gz RGNZZJKBGKEKJE-NEPJUHHUSA-N 1 2 319.474 4.256 20 0 DIADLO Cc1cc(NCc2ccnc(N3CCCC3)c2)[nH+]c2ccccc12 ZINC001317750822 1053131019 /nfs/dbraw/zinc/13/10/19/1053131019.db2.gz KRCKEFDYFKTZSD-UHFFFAOYSA-N 1 2 318.424 4.151 20 0 DIADLO CCC1(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)CCCCC1 ZINC001351065317 1053132766 /nfs/dbraw/zinc/13/27/66/1053132766.db2.gz MIYNFDUQUUFKEO-UHFFFAOYSA-N 1 2 315.392 4.310 20 0 DIADLO Cc1cccc(Oc2ccccc2NC(=O)[C@H](C)n2cc[nH+]c2)c1 ZINC001318034484 1053145798 /nfs/dbraw/zinc/14/57/98/1053145798.db2.gz IYBVCPHCZAIEBX-HNNXBMFYSA-N 1 2 321.380 4.184 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)c1ncccn1 ZINC001351283625 1053161512 /nfs/dbraw/zinc/16/15/12/1053161512.db2.gz NYRVBDMUKSBCJE-JSGCOSHPSA-N 1 2 324.453 4.320 20 0 DIADLO COc1nsc(C[N@H+](C)Cc2c(C)cccc2C)c1Cl ZINC001474726055 1053179058 /nfs/dbraw/zinc/17/90/58/1053179058.db2.gz HXOSUZLFDMNGFO-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COc1nsc(C[N@@H+](C)Cc2c(C)cccc2C)c1Cl ZINC001474726055 1053179065 /nfs/dbraw/zinc/17/90/65/1053179065.db2.gz HXOSUZLFDMNGFO-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO CCCCC[C@@H](NC(=O)c1cccc2[nH+]ccn21)C(C)(C)C ZINC001360195403 1053197204 /nfs/dbraw/zinc/19/72/04/1053197204.db2.gz UMSFIMBRIKETNG-OAHLLOKOSA-N 1 2 301.434 4.059 20 0 DIADLO O=C(CCCc1ccc(C2CC2)cc1)Nc1cccc2[nH+]ccn21 ZINC001360225344 1053201528 /nfs/dbraw/zinc/20/15/28/1053201528.db2.gz QPKMPGIKVVSTRQ-UHFFFAOYSA-N 1 2 319.408 4.173 20 0 DIADLO C[C@@H](Nc1ccc([NH+]2CCCC2)cc1)c1nc2ccccc2n1C ZINC000324853565 1053215196 /nfs/dbraw/zinc/21/51/96/1053215196.db2.gz MSJRPOXINXQRDL-OAHLLOKOSA-N 1 2 320.440 4.347 20 0 DIADLO C/C(=C\c1ccccc1Cl)C(=O)Nc1cccc2[nH+]ccn21 ZINC001360440994 1053227880 /nfs/dbraw/zinc/22/78/80/1053227880.db2.gz AFCMQBFDCXHNJV-VAWYXSNFSA-N 1 2 311.772 4.030 20 0 DIADLO Cc1sc2[nH]c([C@@H](C)[N@@H+]3CC(C)(C)C3(C)C)nc(=O)c2c1C ZINC001319368219 1053237642 /nfs/dbraw/zinc/23/76/42/1053237642.db2.gz CMFNHSLNXTXMMH-SNVBAGLBSA-N 1 2 319.474 4.195 20 0 DIADLO Cc1sc2[nH]c([C@@H](C)[N@H+]3CC(C)(C)C3(C)C)nc(=O)c2c1C ZINC001319368219 1053237654 /nfs/dbraw/zinc/23/76/54/1053237654.db2.gz CMFNHSLNXTXMMH-SNVBAGLBSA-N 1 2 319.474 4.195 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccc(F)cc2)C2CCCCC2)n[nH]1 ZINC001319526403 1053247681 /nfs/dbraw/zinc/24/76/81/1053247681.db2.gz RSQLEUIGXCYENC-UHFFFAOYSA-N 1 2 301.409 4.192 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccc(F)cc2)C2CCCCC2)n[nH]1 ZINC001319526403 1053247692 /nfs/dbraw/zinc/24/76/92/1053247692.db2.gz RSQLEUIGXCYENC-UHFFFAOYSA-N 1 2 301.409 4.192 20 0 DIADLO CCCC1CC[NH+](Cc2nc3ccc(Cl)cc3c(=O)[nH]2)CC1 ZINC001319540200 1053250565 /nfs/dbraw/zinc/25/05/65/1053250565.db2.gz BNJSLHNWUVRHDF-UHFFFAOYSA-N 1 2 319.836 4.001 20 0 DIADLO COCC[N@H+](Cc1ncoc1C(C)C)Cc1ccc(C)cc1C ZINC001319752445 1053270089 /nfs/dbraw/zinc/27/00/89/1053270089.db2.gz GTBWDDMUMNDIJL-UHFFFAOYSA-N 1 2 316.445 4.063 20 0 DIADLO COCC[N@@H+](Cc1ncoc1C(C)C)Cc1ccc(C)cc1C ZINC001319752445 1053270101 /nfs/dbraw/zinc/27/01/01/1053270101.db2.gz GTBWDDMUMNDIJL-UHFFFAOYSA-N 1 2 316.445 4.063 20 0 DIADLO Cc1cc(N2CCC[C@@H](C[C@H]3CCOC3)C2)[nH+]c2ccccc12 ZINC001319782683 1053274280 /nfs/dbraw/zinc/27/42/80/1053274280.db2.gz CXXJOOAQUHWZDG-DLBZAZTESA-N 1 2 310.441 4.186 20 0 DIADLO CC(C)c1ocnc1C[NH2+][C@H](C)c1cccc(OC(F)F)c1 ZINC001319805342 1053276387 /nfs/dbraw/zinc/27/63/87/1053276387.db2.gz KDPQSDGJJXVKDX-LLVKDONJSA-N 1 2 310.344 4.250 20 0 DIADLO CC(C)c1nn(C)c(Cl)c1C[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000069753107 1053291189 /nfs/dbraw/zinc/29/11/89/1053291189.db2.gz LXKRTILXLVTBSZ-YPMHNXCESA-N 1 2 321.852 4.203 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+]([C@@H](C)c1nc3ccccc3o1)CC2 ZINC001320128169 1053307584 /nfs/dbraw/zinc/30/75/84/1053307584.db2.gz WOSSLYZTEYMNDW-AWEZNQCLSA-N 1 2 322.408 4.346 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+]([C@@H](C)c1nc3ccccc3o1)CC2 ZINC001320128169 1053307601 /nfs/dbraw/zinc/30/76/01/1053307601.db2.gz WOSSLYZTEYMNDW-AWEZNQCLSA-N 1 2 322.408 4.346 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(-c2cccs2)no1)c1ccc(F)cc1 ZINC001320159430 1053312265 /nfs/dbraw/zinc/31/22/65/1053312265.db2.gz FUZILRQKGZGWDT-ZDUSSCGKSA-N 1 2 317.389 4.178 20 0 DIADLO CCc1noc([C@@H](C)[N@H+]2CC=C(c3cc(C)cc(C)c3)CC2)n1 ZINC000092427388 1053321635 /nfs/dbraw/zinc/32/16/35/1053321635.db2.gz ZMWQMVXWAOTVAV-OAHLLOKOSA-N 1 2 311.429 4.099 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+]2CC=C(c3cc(C)cc(C)c3)CC2)n1 ZINC000092427388 1053321651 /nfs/dbraw/zinc/32/16/51/1053321651.db2.gz ZMWQMVXWAOTVAV-OAHLLOKOSA-N 1 2 311.429 4.099 20 0 DIADLO CCn1nc(C[N@H+](CC)Cc2ccccc2F)c2ccccc21 ZINC001320464317 1053334722 /nfs/dbraw/zinc/33/47/22/1053334722.db2.gz RFGQBJZYHFCISC-UHFFFAOYSA-N 1 2 311.404 4.217 20 0 DIADLO CCn1nc(C[N@@H+](CC)Cc2ccccc2F)c2ccccc21 ZINC001320464317 1053334737 /nfs/dbraw/zinc/33/47/37/1053334737.db2.gz RFGQBJZYHFCISC-UHFFFAOYSA-N 1 2 311.404 4.217 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2ncoc2C(C)C)c1 ZINC001320610307 1053348858 /nfs/dbraw/zinc/34/88/58/1053348858.db2.gz VEUYWUFELXEPJJ-CQSZACIVSA-N 1 2 302.418 4.436 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2cnc(Cl)s2)c1C ZINC001320671364 1053354757 /nfs/dbraw/zinc/35/47/57/1053354757.db2.gz ZICDVKHWNDKZIL-UHFFFAOYSA-N 1 2 314.863 4.250 20 0 DIADLO CCCCC[C@@H](NC(=O)[C@H](C)Cc1c[nH]c[nH+]1)c1ccccc1 ZINC000847434025 1053399767 /nfs/dbraw/zinc/39/97/67/1053399767.db2.gz RIEIVSZPOOZFEF-CRAIPNDOSA-N 1 2 313.445 4.026 20 0 DIADLO CCCCC[C@@H](NC(=O)[C@H](C)Cc1c[nH+]c[nH]1)c1ccccc1 ZINC000847434025 1053399779 /nfs/dbraw/zinc/39/97/79/1053399779.db2.gz RIEIVSZPOOZFEF-CRAIPNDOSA-N 1 2 313.445 4.026 20 0 DIADLO COc1ccc2c(c1)CCC[C@@H]2[N@H+](C)C/C(Cl)=C/Cl ZINC000763511633 1053403119 /nfs/dbraw/zinc/40/31/19/1053403119.db2.gz PZLYSVPXTQNSRY-LMRWQKIVSA-N 1 2 300.229 4.323 20 0 DIADLO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)C/C(Cl)=C/Cl ZINC000763511633 1053403124 /nfs/dbraw/zinc/40/31/24/1053403124.db2.gz PZLYSVPXTQNSRY-LMRWQKIVSA-N 1 2 300.229 4.323 20 0 DIADLO C[C@@H](Oc1ccc(-n2cc[nH+]c2)cc1)c1cccc(F)c1F ZINC001229955173 1053438424 /nfs/dbraw/zinc/43/84/24/1053438424.db2.gz XZWSUHAYAOEBBH-GFCCVEGCSA-N 1 2 300.308 4.291 20 0 DIADLO CCc1nc2c(s1)[C@H](Nc1ccc([NH+](C)C)cc1)CCC2 ZINC000182495095 1053456338 /nfs/dbraw/zinc/45/63/38/1053456338.db2.gz ODSFLSCXNHSKQD-CQSZACIVSA-N 1 2 301.459 4.261 20 0 DIADLO CCC[C@H]1CC(=O)N(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)C1 ZINC001322142296 1053462334 /nfs/dbraw/zinc/46/23/34/1053462334.db2.gz VTFUAUFMDUGUFR-WMLDXEAASA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@H]1CC(=O)N(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)C1 ZINC001322142296 1053462345 /nfs/dbraw/zinc/46/23/45/1053462345.db2.gz VTFUAUFMDUGUFR-WMLDXEAASA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@H]1CC(=O)N(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)C1 ZINC001322142297 1053463046 /nfs/dbraw/zinc/46/30/46/1053463046.db2.gz VTFUAUFMDUGUFR-YOEHRIQHSA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@H]1CC(=O)N(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)C1 ZINC001322142297 1053463055 /nfs/dbraw/zinc/46/30/55/1053463055.db2.gz VTFUAUFMDUGUFR-YOEHRIQHSA-N 1 2 320.864 4.083 20 0 DIADLO Fc1cccc([C@@H]2C[N@@H+]([C@H]3CCc4c3cccc4F)CCO2)c1 ZINC001322271798 1053475747 /nfs/dbraw/zinc/47/57/47/1053475747.db2.gz GEJCTVNUXPSXNT-OALUTQOASA-N 1 2 315.363 4.026 20 0 DIADLO Fc1cccc([C@@H]2C[N@H+]([C@H]3CCc4c3cccc4F)CCO2)c1 ZINC001322271798 1053475757 /nfs/dbraw/zinc/47/57/57/1053475757.db2.gz GEJCTVNUXPSXNT-OALUTQOASA-N 1 2 315.363 4.026 20 0 DIADLO Cl/C=C(/Cl)C[N@@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000763566333 1053478735 /nfs/dbraw/zinc/47/87/35/1053478735.db2.gz NCTTXVYLULPCKD-RBFDBLARSA-N 1 2 314.256 4.029 20 0 DIADLO Cl/C=C(/Cl)C[N@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000763566333 1053478745 /nfs/dbraw/zinc/47/87/45/1053478745.db2.gz NCTTXVYLULPCKD-RBFDBLARSA-N 1 2 314.256 4.029 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+]2CCc3oc(-c4ccccc4)cc3C2)cn1 ZINC000649676841 1053517087 /nfs/dbraw/zinc/51/70/87/1053517087.db2.gz XQRURWUHVBVMID-HNNXBMFYSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1cnc([C@H](C)[N@H+]2CCc3oc(-c4ccccc4)cc3C2)cn1 ZINC000649676841 1053517100 /nfs/dbraw/zinc/51/71/00/1053517100.db2.gz XQRURWUHVBVMID-HNNXBMFYSA-N 1 2 319.408 4.164 20 0 DIADLO C[C@@H]1CC[C@@H](Nc2[nH+]cnc3c2cnn3-c2ccccc2)C[C@@H]1C ZINC000325669978 1053518022 /nfs/dbraw/zinc/51/80/22/1053518022.db2.gz LVDNQOJDKVEELC-QLFBSQMISA-N 1 2 321.428 4.052 20 0 DIADLO Cc1cc(N2CCO[C@H](c3ccccc3)C2)[nH+]c2ccccc12 ZINC001322855853 1053545951 /nfs/dbraw/zinc/54/59/51/1053545951.db2.gz COWMBHYIESCIRY-IBGZPJMESA-N 1 2 304.393 4.121 20 0 DIADLO C[C@@H](CC1CCCCC1)C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC001322859645 1053546684 /nfs/dbraw/zinc/54/66/84/1053546684.db2.gz MUPKODADVURTLL-RDJZCZTQSA-N 1 2 319.493 4.021 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccccc2Sc2ccccc2)o1 ZINC001200323461 1053557233 /nfs/dbraw/zinc/55/72/33/1053557233.db2.gz OFZMUIURSJOMMO-UHFFFAOYSA-N 1 2 310.422 4.424 20 0 DIADLO CCCCCn1cc(CNc2cc(C)[nH+]c(C(C)C)n2)c(C)n1 ZINC000502786117 1053567910 /nfs/dbraw/zinc/56/79/10/1053567910.db2.gz WKFHCVXHESPDFH-UHFFFAOYSA-N 1 2 315.465 4.216 20 0 DIADLO O=C(CCc1cccc2ccccc21)Nc1cccc2[nH+]ccn21 ZINC001353495784 1053590905 /nfs/dbraw/zinc/59/09/05/1053590905.db2.gz VRCXMCXMMFDBEP-UHFFFAOYSA-N 1 2 315.376 4.059 20 0 DIADLO CCCCc1ccc(NC(=S)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001200383697 1053616485 /nfs/dbraw/zinc/61/64/85/1053616485.db2.gz NWRFTEZBOYQEEO-UHFFFAOYSA-N 1 2 324.453 4.486 20 0 DIADLO CCCC1CC[NH+](Cc2nc3cc(Cl)ccc3c(=O)[nH]2)CC1 ZINC001324198367 1053632865 /nfs/dbraw/zinc/63/28/65/1053632865.db2.gz IXKMIQWOPYMLBA-UHFFFAOYSA-N 1 2 319.836 4.001 20 0 DIADLO Cl/C=C(\Cl)C[N@@H+]1CCC[C@H](c2nc3ccccc3[nH]2)C1 ZINC001324297177 1053641831 /nfs/dbraw/zinc/64/18/31/1053641831.db2.gz IBLSTUOCHNUBIC-LCFDYFRESA-N 1 2 310.228 4.061 20 0 DIADLO Cl/C=C(\Cl)C[N@H+]1CCC[C@H](c2nc3ccccc3[nH]2)C1 ZINC001324297177 1053641834 /nfs/dbraw/zinc/64/18/34/1053641834.db2.gz IBLSTUOCHNUBIC-LCFDYFRESA-N 1 2 310.228 4.061 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccn(-c2ccccc2)n1 ZINC000163182832 1053655171 /nfs/dbraw/zinc/65/51/71/1053655171.db2.gz HGUITCVDEJTBQC-INIZCTEOSA-N 1 2 321.424 4.040 20 0 DIADLO FC(F)(F)[C@H](Oc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccnc1 ZINC001231080209 1053668905 /nfs/dbraw/zinc/66/89/05/1053668905.db2.gz AHOPFIYZCMNSGU-CQSZACIVSA-N 1 2 319.286 4.154 20 0 DIADLO C[C@H](COCc1ccccc1)Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231082385 1053671031 /nfs/dbraw/zinc/67/10/31/1053671031.db2.gz VIMNZNGYXXSEBH-OAHLLOKOSA-N 1 2 308.381 4.061 20 0 DIADLO C[C@@H](COc1ccc(-c2c[nH+]cn2C)cc1)OCc1ccccc1 ZINC001231083669 1053671141 /nfs/dbraw/zinc/67/11/41/1053671141.db2.gz NBXVLMCJJCQKPE-INIZCTEOSA-N 1 2 322.408 4.071 20 0 DIADLO Cc1ccccc1OC[C@H](C)Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231083937 1053671239 /nfs/dbraw/zinc/67/12/39/1053671239.db2.gz QDBDLAQKJONKJV-INIZCTEOSA-N 1 2 322.408 4.242 20 0 DIADLO C[C@@H]1CCc2nc(C[N@@H+]3CCC[C@@H]3c3ccccn3)sc2C1 ZINC001324716177 1053675668 /nfs/dbraw/zinc/67/56/68/1053675668.db2.gz HMXCRJSVIOYQLB-CZUORRHYSA-N 1 2 313.470 4.000 20 0 DIADLO C[C@@H]1CCc2nc(C[N@H+]3CCC[C@@H]3c3ccccn3)sc2C1 ZINC001324716177 1053675672 /nfs/dbraw/zinc/67/56/72/1053675672.db2.gz HMXCRJSVIOYQLB-CZUORRHYSA-N 1 2 313.470 4.000 20 0 DIADLO CCCCNC(=S)Nc1ccc(Oc2cc[nH+]c(C)c2)cc1 ZINC001200458676 1053677596 /nfs/dbraw/zinc/67/75/96/1053677596.db2.gz ZHTDCJAGFSDOLI-UHFFFAOYSA-N 1 2 315.442 4.269 20 0 DIADLO O=C(c1ccc(-n2cc[nH+]c2)cc1)N1CCCC[C@H]1CC1CCC1 ZINC000620573745 1053684561 /nfs/dbraw/zinc/68/45/61/1053684561.db2.gz QTJUZLHZULJBTB-IBGZPJMESA-N 1 2 323.440 4.057 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nc(C3CCCC3)no2)s1 ZINC000153762034 1053714174 /nfs/dbraw/zinc/71/41/74/1053714174.db2.gz ZGJNNEQUAMIBLP-AWEZNQCLSA-N 1 2 317.458 4.434 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nc(C3CCCC3)no2)s1 ZINC000153762034 1053714186 /nfs/dbraw/zinc/71/41/86/1053714186.db2.gz ZGJNNEQUAMIBLP-AWEZNQCLSA-N 1 2 317.458 4.434 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cccc(OC(F)(F)F)c2)c(C)[nH+]1 ZINC000153894536 1053717953 /nfs/dbraw/zinc/71/79/53/1053717953.db2.gz HRFQRYJYEJCBCU-UHFFFAOYSA-N 1 2 324.302 4.158 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cncc(F)c1)c1nc(C(C)(C)C)cs1 ZINC000154013596 1053722442 /nfs/dbraw/zinc/72/24/42/1053722442.db2.gz HXLURHDAEAOTIP-QWRGUYRKSA-N 1 2 307.438 4.387 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cncc(F)c1)c1nc(C(C)(C)C)cs1 ZINC000154013914 1053722961 /nfs/dbraw/zinc/72/29/61/1053722961.db2.gz HXLURHDAEAOTIP-GHMZBOCLSA-N 1 2 307.438 4.387 20 0 DIADLO CC[N@H+](Cc1ccc([S@](C)=O)cc1)Cc1ccccc1Cl ZINC000154175271 1053730146 /nfs/dbraw/zinc/73/01/46/1053730146.db2.gz LDZATGFENQAMFH-OAQYLSRUSA-N 1 2 321.873 4.100 20 0 DIADLO CC[N@@H+](Cc1ccc([S@](C)=O)cc1)Cc1ccccc1Cl ZINC000154175271 1053730164 /nfs/dbraw/zinc/73/01/64/1053730164.db2.gz LDZATGFENQAMFH-OAQYLSRUSA-N 1 2 321.873 4.100 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CC[C@]3(CCCO3)C2)c1Cl ZINC001231478487 1053760555 /nfs/dbraw/zinc/76/05/55/1053760555.db2.gz DDPKFHFPCYKDAA-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CC[C@]3(CCCO3)C2)c1Cl ZINC001231478487 1053760564 /nfs/dbraw/zinc/76/05/64/1053760564.db2.gz DDPKFHFPCYKDAA-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO Cc1ccc([C@@H]2CCC[C@H]2OC(=O)c2cccc3[nH+]ccn32)cc1 ZINC001435985485 1053745871 /nfs/dbraw/zinc/74/58/71/1053745871.db2.gz UZURNTKTAMCJAQ-FUHWJXTLSA-N 1 2 320.392 4.136 20 0 DIADLO C[C@H]1CC[C@@](C)(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)C1(C)C ZINC001354089883 1053761176 /nfs/dbraw/zinc/76/11/76/1053761176.db2.gz VDMHOIIMSRZIRP-LIRRHRJNSA-N 1 2 311.429 4.273 20 0 DIADLO O=C(CCCCc1ccccc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001354095990 1053763836 /nfs/dbraw/zinc/76/38/36/1053763836.db2.gz HHHSUTFUOOZAAL-UHFFFAOYSA-N 1 2 319.408 4.224 20 0 DIADLO FC[C@H]1[C@@H]2C[N@H+](Cc3c(Cl)ccc(Cl)c3Cl)C[C@H]12 ZINC001231481828 1053764784 /nfs/dbraw/zinc/76/47/84/1053764784.db2.gz PUTMZRWVICTPIH-PSVAKVPMSA-N 1 2 308.611 4.294 20 0 DIADLO FC[C@H]1[C@@H]2C[N@@H+](Cc3c(Cl)ccc(Cl)c3Cl)C[C@H]12 ZINC001231481828 1053764792 /nfs/dbraw/zinc/76/47/92/1053764792.db2.gz PUTMZRWVICTPIH-PSVAKVPMSA-N 1 2 308.611 4.294 20 0 DIADLO C[N@@H+](Cc1c(Cl)cc(F)cc1Cl)C[C@@H]1CCCCO1 ZINC001237595437 1053769476 /nfs/dbraw/zinc/76/94/76/1053769476.db2.gz BEUJNZOSDCEJHC-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO C[N@H+](Cc1c(Cl)cc(F)cc1Cl)C[C@@H]1CCCCO1 ZINC001237595437 1053769486 /nfs/dbraw/zinc/76/94/86/1053769486.db2.gz BEUJNZOSDCEJHC-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO COc1cc(Br)ccc1C[NH+]1CC2(C1)CCCCC2 ZINC001231513632 1053776919 /nfs/dbraw/zinc/77/69/19/1053776919.db2.gz BWIYDIWYUFQQEG-UHFFFAOYSA-N 1 2 324.262 4.224 20 0 DIADLO Oc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)cc1C(F)(F)F ZINC001231522804 1053777115 /nfs/dbraw/zinc/77/71/15/1053777115.db2.gz KVVIQUNHCCXGSI-OAHLLOKOSA-N 1 2 307.315 4.358 20 0 DIADLO FC1(F)C[C@@]12CC[N@H+](Cn1cc(-c3ccccc3)oc1=S)C2 ZINC001326405896 1053780501 /nfs/dbraw/zinc/78/05/01/1053780501.db2.gz GZUBLWLVUUKWDS-OAHLLOKOSA-N 1 2 322.380 4.166 20 0 DIADLO FC1(F)C[C@@]12CC[N@@H+](Cn1cc(-c3ccccc3)oc1=S)C2 ZINC001326405896 1053780515 /nfs/dbraw/zinc/78/05/15/1053780515.db2.gz GZUBLWLVUUKWDS-OAHLLOKOSA-N 1 2 322.380 4.166 20 0 DIADLO C[N@H+](Cc1ccc(F)c(Oc2ccccc2)c1)Cc1ccncn1 ZINC001231539299 1053784283 /nfs/dbraw/zinc/78/42/83/1053784283.db2.gz ILXIJIPTKOTXQW-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[N@@H+](Cc1ccc(F)c(Oc2ccccc2)c1)Cc1ccncn1 ZINC001231539299 1053784297 /nfs/dbraw/zinc/78/42/97/1053784297.db2.gz ILXIJIPTKOTXQW-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)o1 ZINC000620934841 1053796658 /nfs/dbraw/zinc/79/66/58/1053796658.db2.gz SPXMUBSJVXDCGB-OAHLLOKOSA-N 1 2 300.402 4.015 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)o1 ZINC000620934841 1053796672 /nfs/dbraw/zinc/79/66/72/1053796672.db2.gz SPXMUBSJVXDCGB-OAHLLOKOSA-N 1 2 300.402 4.015 20 0 DIADLO COC[C@@H]1CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1Cl ZINC001231597846 1053796958 /nfs/dbraw/zinc/79/69/58/1053796958.db2.gz IZRFEHSWIDHYBU-NSHDSACASA-N 1 2 308.636 4.258 20 0 DIADLO COC[C@@H]1CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1Cl ZINC001231597846 1053796969 /nfs/dbraw/zinc/79/69/69/1053796969.db2.gz IZRFEHSWIDHYBU-NSHDSACASA-N 1 2 308.636 4.258 20 0 DIADLO COc1cc(C)c(C[N@@H+]2CCC(F)(F)[C@@H](F)C2)cc1C(C)C ZINC001231624139 1053805665 /nfs/dbraw/zinc/80/56/65/1053805665.db2.gz BHFIPQMVVVLBRM-INIZCTEOSA-N 1 2 315.379 4.306 20 0 DIADLO COc1cc(C)c(C[N@H+]2CCC(F)(F)[C@@H](F)C2)cc1C(C)C ZINC001231624139 1053805688 /nfs/dbraw/zinc/80/56/88/1053805688.db2.gz BHFIPQMVVVLBRM-INIZCTEOSA-N 1 2 315.379 4.306 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1ccc(C)o1 ZINC000156410896 1053808371 /nfs/dbraw/zinc/80/83/71/1053808371.db2.gz GUSWMXHDXKZIIO-XHDPSFHLSA-N 1 2 311.784 4.419 20 0 DIADLO Cc1sc2ccccc2c1C[N@@H+]1CCOC[C@@H]1c1cccnc1 ZINC001231649899 1053819522 /nfs/dbraw/zinc/81/95/22/1053819522.db2.gz STWVUCNZBIDTKA-GOSISDBHSA-N 1 2 324.449 4.178 20 0 DIADLO Cc1sc2ccccc2c1C[N@H+]1CCOC[C@@H]1c1cccnc1 ZINC001231649899 1053819538 /nfs/dbraw/zinc/81/95/38/1053819538.db2.gz STWVUCNZBIDTKA-GOSISDBHSA-N 1 2 324.449 4.178 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)cn1 ZINC001231658654 1053823562 /nfs/dbraw/zinc/82/35/62/1053823562.db2.gz FZNCUMXENQCDSJ-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)cn1 ZINC001231658654 1053823574 /nfs/dbraw/zinc/82/35/74/1053823574.db2.gz FZNCUMXENQCDSJ-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccccc3OCC3CC3)n2c1 ZINC000157090560 1053836373 /nfs/dbraw/zinc/83/63/73/1053836373.db2.gz KKEWPBQZOZWJKZ-UHFFFAOYSA-N 1 2 307.397 4.044 20 0 DIADLO COCc1ccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)o1 ZINC001231695753 1053837565 /nfs/dbraw/zinc/83/75/65/1053837565.db2.gz ZLPCZDGQQKJHMZ-INIZCTEOSA-N 1 2 307.340 4.041 20 0 DIADLO COCc1ccc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)o1 ZINC001231695753 1053837585 /nfs/dbraw/zinc/83/75/85/1053837585.db2.gz ZLPCZDGQQKJHMZ-INIZCTEOSA-N 1 2 307.340 4.041 20 0 DIADLO CC(C)(C)c1csc([C@H]2C[N@H+](Cc3ccccc3)CCO2)n1 ZINC000157099782 1053838513 /nfs/dbraw/zinc/83/85/13/1053838513.db2.gz YCOQRPVCKFXEHA-OAHLLOKOSA-N 1 2 316.470 4.014 20 0 DIADLO CC(C)(C)c1csc([C@H]2C[N@@H+](Cc3ccccc3)CCO2)n1 ZINC000157099782 1053838531 /nfs/dbraw/zinc/83/85/31/1053838531.db2.gz YCOQRPVCKFXEHA-OAHLLOKOSA-N 1 2 316.470 4.014 20 0 DIADLO COc1ncc(F)cc1C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001231742210 1053849432 /nfs/dbraw/zinc/84/94/32/1053849432.db2.gz MAJVQSJANOMXNU-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(F)cc1C[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001231742210 1053849451 /nfs/dbraw/zinc/84/94/51/1053849451.db2.gz MAJVQSJANOMXNU-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(F)cc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001231741945 1053850155 /nfs/dbraw/zinc/85/01/55/1053850155.db2.gz BCRAEHQYHCFBMQ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(F)cc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001231741945 1053850169 /nfs/dbraw/zinc/85/01/69/1053850169.db2.gz BCRAEHQYHCFBMQ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1cccnc1OC(C)C ZINC001231762992 1053850394 /nfs/dbraw/zinc/85/03/94/1053850394.db2.gz VLRSJDIAEHDSRD-HNNXBMFYSA-N 1 2 314.429 4.070 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1cccnc1OC(C)C ZINC001231762992 1053850404 /nfs/dbraw/zinc/85/04/04/1053850404.db2.gz VLRSJDIAEHDSRD-HNNXBMFYSA-N 1 2 314.429 4.070 20 0 DIADLO CC(C)n1ccnc1CNc1[nH+]c2ccccc2n1C(C)(C)C ZINC001327386650 1053857631 /nfs/dbraw/zinc/85/76/31/1053857631.db2.gz LMGYBQCHEMGWIJ-UHFFFAOYSA-N 1 2 311.433 4.181 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCc2nc(Cl)ccc2C1 ZINC001231784859 1053858333 /nfs/dbraw/zinc/85/83/33/1053858333.db2.gz GDUCDYAPUZZILT-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CSc1ccccc1C[N@H+]1CCc2nc(Cl)ccc2C1 ZINC001231784859 1053858345 /nfs/dbraw/zinc/85/83/45/1053858345.db2.gz GDUCDYAPUZZILT-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO Clc1ccc(Oc2ccc(C[N@H+]3C[C@H]4C[C@@H](C3)O4)cc2)cc1 ZINC001231814103 1053872121 /nfs/dbraw/zinc/87/21/21/1053872121.db2.gz HBSLQEOVYCWFAS-HDICACEKSA-N 1 2 315.800 4.105 20 0 DIADLO Clc1ccc(Oc2ccc(C[N@@H+]3C[C@H]4C[C@@H](C3)O4)cc2)cc1 ZINC001231814103 1053872139 /nfs/dbraw/zinc/87/21/39/1053872139.db2.gz HBSLQEOVYCWFAS-HDICACEKSA-N 1 2 315.800 4.105 20 0 DIADLO Fc1ccc(-c2ccccc2C[N@@H+]2Cc3cccnc3C2)cc1 ZINC001231822714 1053876493 /nfs/dbraw/zinc/87/64/93/1053876493.db2.gz OUWQNULNFYALIA-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Fc1ccc(-c2ccccc2C[N@H+]2Cc3cccnc3C2)cc1 ZINC001231822714 1053876507 /nfs/dbraw/zinc/87/65/07/1053876507.db2.gz OUWQNULNFYALIA-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc(C)[nH+]c2C)c(C)c1OC ZINC001327891884 1053891346 /nfs/dbraw/zinc/89/13/46/1053891346.db2.gz PVZYICFVPNBGFI-ZDUSSCGKSA-N 1 2 300.402 4.197 20 0 DIADLO CCc1cc(NCCOc2ccccc2C(C)C)nc(CC)[nH+]1 ZINC001472697512 1053893587 /nfs/dbraw/zinc/89/35/87/1053893587.db2.gz JFTZCWKHUFXFAA-UHFFFAOYSA-N 1 2 313.445 4.216 20 0 DIADLO CCCOc1ncccc1C[N@H+](C)[C@H](C)c1ccccc1OC ZINC001231864407 1053894186 /nfs/dbraw/zinc/89/41/86/1053894186.db2.gz PBXAJJBBLYKYLU-OAHLLOKOSA-N 1 2 314.429 4.072 20 0 DIADLO CCCOc1ncccc1C[N@@H+](C)[C@H](C)c1ccccc1OC ZINC001231864407 1053894200 /nfs/dbraw/zinc/89/42/00/1053894200.db2.gz PBXAJJBBLYKYLU-OAHLLOKOSA-N 1 2 314.429 4.072 20 0 DIADLO Cc1nc(NC[C@H](C)c2ccc(F)cc2F)c2c([nH+]1)CCCC2 ZINC001472708666 1053909045 /nfs/dbraw/zinc/90/90/45/1053909045.db2.gz RWOFOJIOGHKZGC-NSHDSACASA-N 1 2 317.383 4.158 20 0 DIADLO CC1(F)CC[NH+](Cc2cc(Cl)ncc2C(F)(F)F)CC1 ZINC001231928391 1053917429 /nfs/dbraw/zinc/91/74/29/1053917429.db2.gz LRWSKKRYYOOCBC-UHFFFAOYSA-N 1 2 310.722 4.078 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ncccc2C(F)(F)F)cn1 ZINC001231963872 1053922371 /nfs/dbraw/zinc/92/23/71/1053922371.db2.gz JXJZVDJCVRFTGE-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ncccc2C(F)(F)F)cn1 ZINC001231963872 1053922383 /nfs/dbraw/zinc/92/23/83/1053922383.db2.gz JXJZVDJCVRFTGE-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1ncccc1C(F)(F)F ZINC001231963786 1053923540 /nfs/dbraw/zinc/92/35/40/1053923540.db2.gz HDGLMMIWINHZIY-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1ncccc1C(F)(F)F ZINC001231963786 1053923552 /nfs/dbraw/zinc/92/35/52/1053923552.db2.gz HDGLMMIWINHZIY-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+](C)Cc1cccc(Cl)c1Cl ZINC001231982979 1053928649 /nfs/dbraw/zinc/92/86/49/1053928649.db2.gz LLPPBNBUTDOVTB-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(F)ncc1C[N@H+](C)Cc1cccc(Cl)c1Cl ZINC001231982979 1053928664 /nfs/dbraw/zinc/92/86/64/1053928664.db2.gz LLPPBNBUTDOVTB-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO CCC[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccccn1 ZINC000158938079 1053928955 /nfs/dbraw/zinc/92/89/55/1053928955.db2.gz XJWRTEGCQYICDD-QGZVFWFLSA-N 1 2 307.397 4.368 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cnc(F)cc1C ZINC001231984734 1053930068 /nfs/dbraw/zinc/93/00/68/1053930068.db2.gz AWQLZHJMAPCBRO-KRWDZBQOSA-N 1 2 314.404 4.013 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cnc(F)cc1C ZINC001231984734 1053930079 /nfs/dbraw/zinc/93/00/79/1053930079.db2.gz AWQLZHJMAPCBRO-KRWDZBQOSA-N 1 2 314.404 4.013 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001231983378 1053931035 /nfs/dbraw/zinc/93/10/35/1053931035.db2.gz WBAJXTSBZACOCG-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(F)ncc1C[N@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001231983378 1053931052 /nfs/dbraw/zinc/93/10/52/1053931052.db2.gz WBAJXTSBZACOCG-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)cnc2F)cc1 ZINC001231992702 1053933514 /nfs/dbraw/zinc/93/35/14/1053933514.db2.gz MXLBVIUHIXTAKD-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(Cl)cnc2F)cc1 ZINC001231992702 1053933527 /nfs/dbraw/zinc/93/35/27/1053933527.db2.gz MXLBVIUHIXTAKD-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO C[N@H+](Cc1ccccc1)Cc1cc(C(F)(F)F)cnc1Cl ZINC001232006496 1053939710 /nfs/dbraw/zinc/93/97/10/1053939710.db2.gz ZJKSSVSCHXLFPG-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccccc1)Cc1cc(C(F)(F)F)cnc1Cl ZINC001232006496 1053939722 /nfs/dbraw/zinc/93/97/22/1053939722.db2.gz ZJKSSVSCHXLFPG-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(C(F)(F)F)cnc2Cl)C2(CC2)C1 ZINC001232010583 1053939753 /nfs/dbraw/zinc/93/97/53/1053939753.db2.gz IJXDEYMBGCXJAP-VIFPVBQESA-N 1 2 304.743 4.128 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(C(F)(F)F)cnc2Cl)C2(CC2)C1 ZINC001232010583 1053939760 /nfs/dbraw/zinc/93/97/60/1053939760.db2.gz IJXDEYMBGCXJAP-VIFPVBQESA-N 1 2 304.743 4.128 20 0 DIADLO CC1(C)CC[NH+](Cc2cc(C(F)(F)F)cnc2Cl)CC1 ZINC001232008704 1053940840 /nfs/dbraw/zinc/94/08/40/1053940840.db2.gz FETPZOTXGFIBNR-UHFFFAOYSA-N 1 2 306.759 4.376 20 0 DIADLO COc1cccc2c(N[C@@H]3CC[C@@H]4[C@H](C3)C4(F)F)cc[nH+]c12 ZINC001328572810 1053940894 /nfs/dbraw/zinc/94/08/94/1053940894.db2.gz MOTUUSOBUTWTRA-RTXFEEFZSA-N 1 2 304.340 4.089 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(C(F)(F)F)n2)Cc2ccccc21 ZINC001232066574 1053950369 /nfs/dbraw/zinc/95/03/69/1053950369.db2.gz IYNZYQFOJQFCFO-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(C(F)(F)F)n2)Cc2ccccc21 ZINC001232066574 1053950380 /nfs/dbraw/zinc/95/03/80/1053950380.db2.gz IYNZYQFOJQFCFO-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO CCCc1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)s1 ZINC000621338450 1053951973 /nfs/dbraw/zinc/95/19/73/1053951973.db2.gz AFDUMGIQKTVNLW-NSHDSACASA-N 1 2 307.463 4.232 20 0 DIADLO C[N@H+](Cc1cccc(C(F)(F)F)n1)Cc1ccccc1Cl ZINC001232072144 1053955072 /nfs/dbraw/zinc/95/50/72/1053955072.db2.gz ISRPJCYBEFJXEF-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1cccc(C(F)(F)F)n1)Cc1ccccc1Cl ZINC001232072144 1053955083 /nfs/dbraw/zinc/95/50/83/1053955083.db2.gz ISRPJCYBEFJXEF-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO CCc1cnc(C[NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)o1 ZINC000621352135 1053955640 /nfs/dbraw/zinc/95/56/40/1053955640.db2.gz OUGCDPDYZOZMEI-UHFFFAOYSA-N 1 2 324.346 4.425 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ccc(C)nc2C)on1 ZINC001232084366 1053958204 /nfs/dbraw/zinc/95/82/04/1053958204.db2.gz KLGGBNCAHITJTD-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2ccc(C)nc2C)on1 ZINC001232084366 1053958216 /nfs/dbraw/zinc/95/82/16/1053958216.db2.gz KLGGBNCAHITJTD-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO CCC(CC)(CNC(=O)c1c(C)cc(C)[nH+]c1C)c1ccccc1 ZINC001354741339 1053958296 /nfs/dbraw/zinc/95/82/96/1053958296.db2.gz CNDARLLDSPJXJR-UHFFFAOYSA-N 1 2 324.468 4.495 20 0 DIADLO CCc1cc(N2CCC[C@@]2(CC)Cc2ccccc2)nc(C)[nH+]1 ZINC001472828482 1053959090 /nfs/dbraw/zinc/95/90/90/1053959090.db2.gz UGCPHBUVNASQNZ-FQEVSTJZSA-N 1 2 309.457 4.339 20 0 DIADLO Fc1cc(F)c(C[NH+]2CCC(c3ccccn3)CC2)c(Cl)c1 ZINC001232102970 1053965366 /nfs/dbraw/zinc/96/53/66/1053965366.db2.gz YYAOMKUSOMZFGA-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO COc1ccnc(Cl)c1C[N@H+](Cc1ccccc1)C(C)C ZINC001232151862 1053970769 /nfs/dbraw/zinc/97/07/69/1053970769.db2.gz LRQQLZMQUWNJJG-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO COc1ccnc(Cl)c1C[N@@H+](Cc1ccccc1)C(C)C ZINC001232151862 1053970774 /nfs/dbraw/zinc/97/07/74/1053970774.db2.gz LRQQLZMQUWNJJG-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO CC[C@H](c1ccccc1)[N@H+](C)Cc1c(Cl)nccc1OC ZINC001232154118 1053974163 /nfs/dbraw/zinc/97/41/63/1053974163.db2.gz ICRWQGDNNSZVOP-OAHLLOKOSA-N 1 2 304.821 4.327 20 0 DIADLO CC[C@H](c1ccccc1)[N@@H+](C)Cc1c(Cl)nccc1OC ZINC001232154118 1053974172 /nfs/dbraw/zinc/97/41/72/1053974172.db2.gz ICRWQGDNNSZVOP-OAHLLOKOSA-N 1 2 304.821 4.327 20 0 DIADLO COc1ccnc(Cl)c1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001232154567 1053974429 /nfs/dbraw/zinc/97/44/29/1053974429.db2.gz WIZAEQVJVROIQF-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1ccnc(Cl)c1C[N@@H+]1CC=C(c2ccccc2)CC1 ZINC001232154567 1053974443 /nfs/dbraw/zinc/97/44/43/1053974443.db2.gz WIZAEQVJVROIQF-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO Fc1ccc(Cl)nc1C[NH+]1CCC(c2cccs2)CC1 ZINC001232159000 1053975722 /nfs/dbraw/zinc/97/57/22/1053975722.db2.gz NCAQYBWUCMHBOS-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1nc(Cl)ccc1F ZINC001232162121 1053976458 /nfs/dbraw/zinc/97/64/58/1053976458.db2.gz ANCICSRBSOOJRC-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1nc(Cl)ccc1F ZINC001232162121 1053976468 /nfs/dbraw/zinc/97/64/68/1053976468.db2.gz ANCICSRBSOOJRC-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO Cc1cnc(C[N@H+](C)Cc2ccccc2C)c(Br)c1 ZINC001232175142 1053979204 /nfs/dbraw/zinc/97/92/04/1053979204.db2.gz BWAFVWVXZUPTGA-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cnc(C[N@@H+](C)Cc2ccccc2C)c(Br)c1 ZINC001232175142 1053979215 /nfs/dbraw/zinc/97/92/15/1053979215.db2.gz BWAFVWVXZUPTGA-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cc(NCc2nccn2-c2ccccc2)[nH+]c2ccccc12 ZINC001329447972 1053989155 /nfs/dbraw/zinc/98/91/55/1053989155.db2.gz VADKBXIXBNEUDG-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Cc1scnc1C[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC001232206649 1053989930 /nfs/dbraw/zinc/98/99/30/1053989930.db2.gz MODAOVSYFXYNGW-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1scnc1C[N@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC001232206649 1053989941 /nfs/dbraw/zinc/98/99/41/1053989941.db2.gz MODAOVSYFXYNGW-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1cc(NC(=O)c2ccc3c(c2)oc2ccccc23)c(C)c[nH+]1 ZINC001329504669 1053993522 /nfs/dbraw/zinc/99/35/22/1053993522.db2.gz RBSUUSZMBRUWCU-UHFFFAOYSA-N 1 2 316.360 4.272 20 0 DIADLO Cc1nccnc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000621711522 1053996159 /nfs/dbraw/zinc/99/61/59/1053996159.db2.gz XLYLDMPLVSXNSA-MRXNPFEDSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1nccnc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000621711522 1053996166 /nfs/dbraw/zinc/99/61/66/1053996166.db2.gz XLYLDMPLVSXNSA-MRXNPFEDSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1nccnc1C[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000621711067 1053996537 /nfs/dbraw/zinc/99/65/37/1053996537.db2.gz CUHFLLPFMFVLIT-ZDUSSCGKSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1nccnc1C[N@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000621711067 1053996549 /nfs/dbraw/zinc/99/65/49/1053996549.db2.gz CUHFLLPFMFVLIT-ZDUSSCGKSA-N 1 2 301.821 4.164 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccnc(C(F)(F)F)c2)Cc2ccccc21 ZINC001232236824 1053998937 /nfs/dbraw/zinc/99/89/37/1053998937.db2.gz JVIOZXRCAUPHFM-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccnc(C(F)(F)F)c2)Cc2ccccc21 ZINC001232236824 1053998942 /nfs/dbraw/zinc/99/89/42/1053998942.db2.gz JVIOZXRCAUPHFM-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[N@H+](Cc1ccnc(C(F)(F)F)c1)Cc1ccc(F)cc1F ZINC001232239955 1054002430 /nfs/dbraw/zinc/00/24/30/1054002430.db2.gz CPVGGEVNPJZNCI-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO C[N@@H+](Cc1ccnc(C(F)(F)F)c1)Cc1ccc(F)cc1F ZINC001232239955 1054002445 /nfs/dbraw/zinc/00/24/45/1054002445.db2.gz CPVGGEVNPJZNCI-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCCC[C@H]2c2cccnc2)ccn1 ZINC001232239733 1054004214 /nfs/dbraw/zinc/00/42/14/1054004214.db2.gz OLTVCUMCQHOZAE-HNNXBMFYSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCCC[C@H]2c2cccnc2)ccn1 ZINC001232239733 1054004229 /nfs/dbraw/zinc/00/42/29/1054004229.db2.gz OLTVCUMCQHOZAE-HNNXBMFYSA-N 1 2 321.346 4.223 20 0 DIADLO CCc1sc(C[NH+]2CCC(F)(F)CC2)cc1Br ZINC001232286241 1054012841 /nfs/dbraw/zinc/01/28/41/1054012841.db2.gz AGQQEFAUMOWFEU-UHFFFAOYSA-N 1 2 324.234 4.304 20 0 DIADLO CCc1sc(C[N@@H+]2CCC[C@@H]2CF)cc1Br ZINC001232288922 1054014138 /nfs/dbraw/zinc/01/41/38/1054014138.db2.gz DJWGOWBIRKGJFB-SECBINFHSA-N 1 2 306.244 4.007 20 0 DIADLO CCc1sc(C[N@H+]2CCC[C@@H]2CF)cc1Br ZINC001232288922 1054014146 /nfs/dbraw/zinc/01/41/46/1054014146.db2.gz DJWGOWBIRKGJFB-SECBINFHSA-N 1 2 306.244 4.007 20 0 DIADLO CCOc1ncc(C[N@H+](CC)Cc2cccc(F)c2F)cc1C ZINC001232311008 1054020877 /nfs/dbraw/zinc/02/08/77/1054020877.db2.gz HCGQTCXNESLDBU-UHFFFAOYSA-N 1 2 320.383 4.089 20 0 DIADLO CCOc1ncc(C[N@@H+](CC)Cc2cccc(F)c2F)cc1C ZINC001232311008 1054020891 /nfs/dbraw/zinc/02/08/91/1054020891.db2.gz HCGQTCXNESLDBU-UHFFFAOYSA-N 1 2 320.383 4.089 20 0 DIADLO Cc1cc(N2C[C@@H](C)O[C@H](CC(F)(F)F)C2)[nH+]c2ccccc12 ZINC001330088540 1054022477 /nfs/dbraw/zinc/02/24/77/1054022477.db2.gz QQQUSMXLLCTTCD-CHWSQXEVSA-N 1 2 324.346 4.089 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cccc(C)c1OC(C)C)C2 ZINC001232392555 1054035987 /nfs/dbraw/zinc/03/59/87/1054035987.db2.gz UWQORXUCUNADOP-UHFFFAOYSA-N 1 2 311.425 4.307 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cccc(C)c1OC(C)C)C2 ZINC001232392555 1054035999 /nfs/dbraw/zinc/03/59/99/1054035999.db2.gz UWQORXUCUNADOP-UHFFFAOYSA-N 1 2 311.425 4.307 20 0 DIADLO Cc1ccc(OC(C)C)c(C[N@@H+]2CCCC(F)(F)[C@H](F)C2)c1 ZINC001232395946 1054041071 /nfs/dbraw/zinc/04/10/71/1054041071.db2.gz QSTZODCIKRLDPY-MRXNPFEDSA-N 1 2 315.379 4.351 20 0 DIADLO Cc1ccc(OC(C)C)c(C[N@H+]2CCCC(F)(F)[C@H](F)C2)c1 ZINC001232395946 1054041085 /nfs/dbraw/zinc/04/10/85/1054041085.db2.gz QSTZODCIKRLDPY-MRXNPFEDSA-N 1 2 315.379 4.351 20 0 DIADLO Cc1cccc2nc(NCc3cc[nH+]c(N4CCCCC4)c3)oc21 ZINC001330591232 1054042542 /nfs/dbraw/zinc/04/25/42/1054042542.db2.gz UKUYBNOFGVKWCO-UHFFFAOYSA-N 1 2 322.412 4.134 20 0 DIADLO Cc1[nH]c(CN2CCC(c3c(Cl)cccc3Cl)CC2)c[nH+]1 ZINC001232458569 1054050596 /nfs/dbraw/zinc/05/05/96/1054050596.db2.gz LMTJECJGTHLPFO-UHFFFAOYSA-N 1 2 324.255 4.405 20 0 DIADLO Cc1[nH]cc(CN2CCC(c3c(Cl)cccc3Cl)CC2)[nH+]1 ZINC001232458569 1054050607 /nfs/dbraw/zinc/05/06/07/1054050607.db2.gz LMTJECJGTHLPFO-UHFFFAOYSA-N 1 2 324.255 4.405 20 0 DIADLO c1c(C[N@@H+]2CC[C@@H]2c2ccccc2)onc1OCc1ccccc1 ZINC001232452322 1054051643 /nfs/dbraw/zinc/05/16/43/1054051643.db2.gz KGPCLTAUXXJMAQ-LJQANCHMSA-N 1 2 320.392 4.201 20 0 DIADLO c1c(C[N@H+]2CC[C@@H]2c2ccccc2)onc1OCc1ccccc1 ZINC001232452322 1054051658 /nfs/dbraw/zinc/05/16/58/1054051658.db2.gz KGPCLTAUXXJMAQ-LJQANCHMSA-N 1 2 320.392 4.201 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2nc3ccccc3[nH]2)C1 ZINC001330855517 1054054040 /nfs/dbraw/zinc/05/40/40/1054054040.db2.gz JDCNEYCGUMLRLC-UGSOOPFHSA-N 1 2 309.388 4.285 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2nc3ccccc3[nH]2)C1 ZINC001330855517 1054054055 /nfs/dbraw/zinc/05/40/55/1054054055.db2.gz JDCNEYCGUMLRLC-UGSOOPFHSA-N 1 2 309.388 4.285 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(CCc2ccccc2)n1)c1ccoc1 ZINC000164384889 1054058111 /nfs/dbraw/zinc/05/81/11/1054058111.db2.gz RYPJDIYTKHLHFO-CQSZACIVSA-N 1 2 312.438 4.372 20 0 DIADLO Nc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001232510660 1054060099 /nfs/dbraw/zinc/06/00/99/1054060099.db2.gz GIGFMBWXRQWVEC-QGZVFWFLSA-N 1 2 306.331 4.023 20 0 DIADLO Nc1ccc(F)cc1C[N@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001232510660 1054060111 /nfs/dbraw/zinc/06/01/11/1054060111.db2.gz GIGFMBWXRQWVEC-QGZVFWFLSA-N 1 2 306.331 4.023 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3c(Cl)cccc3Cl)ccn12 ZINC001355129433 1054062201 /nfs/dbraw/zinc/06/22/01/1054062201.db2.gz DEALHOLLKOTDCP-UHFFFAOYSA-N 1 2 321.163 4.169 20 0 DIADLO Cc1nnsc1C[NH2+][C@@H](C)c1cc(Cl)sc1Cl ZINC000293389698 1054066967 /nfs/dbraw/zinc/06/69/67/1054066967.db2.gz IVFWVVSLECFTHR-YFKPBYRVSA-N 1 2 308.259 4.066 20 0 DIADLO Cc1cc(N2CCc3nc(C(C)C)ncc3C2)[nH+]c2ccccc12 ZINC001331226132 1054067265 /nfs/dbraw/zinc/06/72/65/1054067265.db2.gz YVQBHIYOKXXLGA-UHFFFAOYSA-N 1 2 318.424 4.019 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cc2ccoc2cn1 ZINC001232556853 1054068616 /nfs/dbraw/zinc/06/86/16/1054068616.db2.gz NGKYIJSZIBLXIW-GOSISDBHSA-N 1 2 322.408 4.311 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cc2ccoc2cn1 ZINC001232556853 1054068626 /nfs/dbraw/zinc/06/86/26/1054068626.db2.gz NGKYIJSZIBLXIW-GOSISDBHSA-N 1 2 322.408 4.311 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CCC[N@@H+]1Cc1cc2ccoc2cn1 ZINC001232556648 1054069458 /nfs/dbraw/zinc/06/94/58/1054069458.db2.gz KMROMDREDFQAGP-INIZCTEOSA-N 1 2 314.335 4.443 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CCC[N@H+]1Cc1cc2ccoc2cn1 ZINC001232556648 1054069467 /nfs/dbraw/zinc/06/94/67/1054069467.db2.gz KMROMDREDFQAGP-INIZCTEOSA-N 1 2 314.335 4.443 20 0 DIADLO C[C@@H]1CCC[N@@H+]1Cc1c(F)ccc(Cl)c1Br ZINC001232690739 1054102898 /nfs/dbraw/zinc/10/28/98/1054102898.db2.gz DIQQABRFSTXCBW-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@@H]1CCC[N@H+]1Cc1c(F)ccc(Cl)c1Br ZINC001232690739 1054102907 /nfs/dbraw/zinc/10/29/07/1054102907.db2.gz DIQQABRFSTXCBW-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2cc(F)cc(F)c2)o1 ZINC000165270157 1054072907 /nfs/dbraw/zinc/07/29/07/1054072907.db2.gz CKZFVMWVMKAQHD-BDJLRTHQSA-N 1 2 309.356 4.159 20 0 DIADLO Fc1ccccc1C1CC[NH+](Cc2c(Cl)ccnc2F)CC1 ZINC001232616969 1054084883 /nfs/dbraw/zinc/08/48/83/1054084883.db2.gz LUYLDLXYNAZCQF-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO CC(=O)Nc1ccc(C)c(NCc2cc(C)[nH+]c3c2CCCC3)c1 ZINC001355225475 1054088407 /nfs/dbraw/zinc/08/84/07/1054088407.db2.gz GFUXXLHKSKMKHI-UHFFFAOYSA-N 1 2 323.440 4.148 20 0 DIADLO CCCC[N@H+](CCC)Cc1cc(F)c(O)c(Br)c1 ZINC001232640403 1054091253 /nfs/dbraw/zinc/09/12/53/1054091253.db2.gz OTLKSVCQUBZCAW-UHFFFAOYSA-N 1 2 318.230 4.306 20 0 DIADLO CCCC[N@@H+](CCC)Cc1cc(F)c(O)c(Br)c1 ZINC001232640403 1054091266 /nfs/dbraw/zinc/09/12/66/1054091266.db2.gz OTLKSVCQUBZCAW-UHFFFAOYSA-N 1 2 318.230 4.306 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1cc(F)c(O)c(Br)c1 ZINC001232633106 1054091793 /nfs/dbraw/zinc/09/17/93/1054091793.db2.gz DYCBEUMVDZVHIE-NSHDSACASA-N 1 2 316.214 4.058 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1cc(F)c(O)c(Br)c1 ZINC001232633106 1054091808 /nfs/dbraw/zinc/09/18/08/1054091808.db2.gz DYCBEUMVDZVHIE-NSHDSACASA-N 1 2 316.214 4.058 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cnc(Cl)cc2Br)[C@H](C)C1 ZINC001232682545 1054097904 /nfs/dbraw/zinc/09/79/04/1054097904.db2.gz DFEGQTWEEHHQOJ-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cnc(Cl)cc2Br)[C@H](C)C1 ZINC001232682545 1054097894 /nfs/dbraw/zinc/09/78/94/1054097894.db2.gz DFEGQTWEEHHQOJ-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO Clc1cc(Br)c(C[N@@H+]2CCC23CCCC3)cn1 ZINC001232680055 1054098334 /nfs/dbraw/zinc/09/83/34/1054098334.db2.gz NMVVBCRROIHXPX-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Clc1cc(Br)c(C[N@H+]2CCC23CCCC3)cn1 ZINC001232680055 1054098341 /nfs/dbraw/zinc/09/83/41/1054098341.db2.gz NMVVBCRROIHXPX-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@@H]2c2cccs2)[nH]1 ZINC001232690171 1054101363 /nfs/dbraw/zinc/10/13/63/1054101363.db2.gz WUFOFHBIBJOWGR-LLVKDONJSA-N 1 2 311.248 4.176 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@@H]2c2cccs2)[nH]1 ZINC001232690171 1054101373 /nfs/dbraw/zinc/10/13/73/1054101373.db2.gz WUFOFHBIBJOWGR-LLVKDONJSA-N 1 2 311.248 4.176 20 0 DIADLO CC(C)O[C@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2Cl)C1 ZINC001232702132 1054104525 /nfs/dbraw/zinc/10/45/25/1054104525.db2.gz FMGLDHMLHYFQKT-NSHDSACASA-N 1 2 306.208 4.132 20 0 DIADLO Fc1cc(C[N@@H+]2CC[C@H]3CCCO[C@@H]3C2)c(Cl)cc1Cl ZINC001232703761 1054104148 /nfs/dbraw/zinc/10/41/48/1054104148.db2.gz ZIHQARDAMDXDJB-MEBBXXQBSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1cc(C[N@H+]2CC[C@H]3CCCO[C@@H]3C2)c(Cl)cc1Cl ZINC001232703761 1054104155 /nfs/dbraw/zinc/10/41/55/1054104155.db2.gz ZIHQARDAMDXDJB-MEBBXXQBSA-N 1 2 318.219 4.133 20 0 DIADLO CC(C)O[C@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2Cl)C1 ZINC001232702132 1054104534 /nfs/dbraw/zinc/10/45/34/1054104534.db2.gz FMGLDHMLHYFQKT-NSHDSACASA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2Cl)C1 ZINC001232702131 1054105560 /nfs/dbraw/zinc/10/55/60/1054105560.db2.gz FMGLDHMLHYFQKT-LLVKDONJSA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2Cl)C1 ZINC001232702131 1054105570 /nfs/dbraw/zinc/10/55/70/1054105570.db2.gz FMGLDHMLHYFQKT-LLVKDONJSA-N 1 2 306.208 4.132 20 0 DIADLO Cc1ccc(N[C@H](C)c2nc(Br)ccc2F)c(C)[nH+]1 ZINC001332401624 1054116977 /nfs/dbraw/zinc/11/69/77/1054116977.db2.gz MOVGANLPODZWPC-SNVBAGLBSA-N 1 2 324.197 4.168 20 0 DIADLO CC(C)c1ocnc1C[N@@H+]1Cc2ccccc2OC2(CCC2)C1 ZINC001332376829 1054115635 /nfs/dbraw/zinc/11/56/35/1054115635.db2.gz LQFYMIDLIFBUKW-UHFFFAOYSA-N 1 2 312.413 4.115 20 0 DIADLO CC(C)c1ocnc1C[N@H+]1Cc2ccccc2OC2(CCC2)C1 ZINC001332376829 1054115640 /nfs/dbraw/zinc/11/56/40/1054115640.db2.gz LQFYMIDLIFBUKW-UHFFFAOYSA-N 1 2 312.413 4.115 20 0 DIADLO CC1=C(C)C[C@@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)CC1 ZINC001355356651 1054117466 /nfs/dbraw/zinc/11/74/66/1054117466.db2.gz FVUYTEXSRPHXAP-AWEZNQCLSA-N 1 2 313.376 4.086 20 0 DIADLO C[N@H+](Cc1ccccc1)Cc1ccc(C(F)(F)F)nc1Cl ZINC001232790570 1054121687 /nfs/dbraw/zinc/12/16/87/1054121687.db2.gz UCTUYFFMUJOSAN-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccccc1)Cc1ccc(C(F)(F)F)nc1Cl ZINC001232790570 1054121694 /nfs/dbraw/zinc/12/16/94/1054121694.db2.gz UCTUYFFMUJOSAN-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(Br)co1 ZINC001232850150 1054130907 /nfs/dbraw/zinc/13/09/07/1054130907.db2.gz JURCEIDNSMOMPS-LLVKDONJSA-N 1 2 306.203 4.161 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc(Br)co1 ZINC001232850150 1054130909 /nfs/dbraw/zinc/13/09/09/1054130909.db2.gz JURCEIDNSMOMPS-LLVKDONJSA-N 1 2 306.203 4.161 20 0 DIADLO Cc1cc(O)cc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)c1 ZINC001232884185 1054137852 /nfs/dbraw/zinc/13/78/52/1054137852.db2.gz LBWYOLRMXFXFFX-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO Cc1cc(O)cc(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)c1 ZINC001232884185 1054137860 /nfs/dbraw/zinc/13/78/60/1054137860.db2.gz LBWYOLRMXFXFFX-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO Cc1cc(O)cc(C[N@@H+](C)Cc2ccccc2Br)c1 ZINC001232881400 1054138252 /nfs/dbraw/zinc/13/82/52/1054138252.db2.gz XTZMDKXBXCNFPT-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1cc(O)cc(C[N@H+](C)Cc2ccccc2Br)c1 ZINC001232881400 1054138256 /nfs/dbraw/zinc/13/82/56/1054138256.db2.gz XTZMDKXBXCNFPT-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cncc(-c2ccccc2)c1 ZINC001232900585 1054143676 /nfs/dbraw/zinc/14/36/76/1054143676.db2.gz ABHBQAKLKDEIFF-INIZCTEOSA-N 1 2 303.409 4.127 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cncc(-c2ccccc2)c1 ZINC001232900585 1054143681 /nfs/dbraw/zinc/14/36/81/1054143681.db2.gz ABHBQAKLKDEIFF-INIZCTEOSA-N 1 2 303.409 4.127 20 0 DIADLO CCCC[N@H+](Cc1ccccc1)Cc1ccc(F)c(O)c1F ZINC001232935092 1054148759 /nfs/dbraw/zinc/14/87/59/1054148759.db2.gz GBLMXVQFEWDVJH-UHFFFAOYSA-N 1 2 305.368 4.473 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(F)c(O)c2F)c1 ZINC001232937971 1054152444 /nfs/dbraw/zinc/15/24/44/1054152444.db2.gz XLJPGRFAKWZJIV-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(F)c(O)c2F)c1 ZINC001232937971 1054152454 /nfs/dbraw/zinc/15/24/54/1054152454.db2.gz XLJPGRFAKWZJIV-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cc(Cl)cnc1Br ZINC001232960561 1054160138 /nfs/dbraw/zinc/16/01/38/1054160138.db2.gz ZQQBOZCMUWWCQK-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)cnc1Br ZINC001232962103 1054159306 /nfs/dbraw/zinc/15/93/06/1054159306.db2.gz ZLXJRQUOIBYOTO-GFCCVEGCSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1cc(Cl)cnc1Br ZINC001232962103 1054159309 /nfs/dbraw/zinc/15/93/09/1054159309.db2.gz ZLXJRQUOIBYOTO-GFCCVEGCSA-N 1 2 317.658 4.262 20 0 DIADLO Oc1cc(C[NH+]2CCC(c3ccc(F)cc3)CC2)cc(F)c1F ZINC001232971583 1054162441 /nfs/dbraw/zinc/16/24/41/1054162441.db2.gz MUMJEDGTLANLPH-UHFFFAOYSA-N 1 2 321.342 4.189 20 0 DIADLO Cc1ccc(N[C@H](C)c2cn3c([nH+]2)CCCC3)cc1-c1ncco1 ZINC001333597740 1054162680 /nfs/dbraw/zinc/16/26/80/1054162680.db2.gz XTQJHMAKHKOQDA-CQSZACIVSA-N 1 2 322.412 4.356 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(O)c(F)c(F)c2)cc1 ZINC001232970496 1054162799 /nfs/dbraw/zinc/16/27/99/1054162799.db2.gz DOJYVJWSDHKFHW-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(O)c(F)c(F)c2)cc1 ZINC001232970496 1054162805 /nfs/dbraw/zinc/16/28/05/1054162805.db2.gz DOJYVJWSDHKFHW-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc(O)c(F)c(F)c2)cc1 ZINC001232970497 1054163183 /nfs/dbraw/zinc/16/31/83/1054163183.db2.gz DOJYVJWSDHKFHW-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(O)c(F)c(F)c2)cc1 ZINC001232970497 1054163186 /nfs/dbraw/zinc/16/31/86/1054163186.db2.gz DOJYVJWSDHKFHW-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2c(Cl)cccc2N(C)C)n1 ZINC001333709941 1054168152 /nfs/dbraw/zinc/16/81/52/1054168152.db2.gz GQJRWWRURNFDKS-LLVKDONJSA-N 1 2 309.866 4.022 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1C[C@@H](C)O[C@H](CC(F)(F)F)C1 ZINC001333741672 1054170114 /nfs/dbraw/zinc/17/01/14/1054170114.db2.gz TVSQGMSPEPWGQB-CHWSQXEVSA-N 1 2 324.346 4.089 20 0 DIADLO Cc1cccnc1C[N@H+](Cc1nc2ccccc2s1)C1CC1 ZINC001333757110 1054170141 /nfs/dbraw/zinc/17/01/41/1054170141.db2.gz BYZRIHRPNWTLFC-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO Cc1cccnc1C[N@@H+](Cc1nc2ccccc2s1)C1CC1 ZINC001333757110 1054170150 /nfs/dbraw/zinc/17/01/50/1054170150.db2.gz BYZRIHRPNWTLFC-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO Oc1cnc(Cl)cc1C[N@@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001233038581 1054174485 /nfs/dbraw/zinc/17/44/85/1054174485.db2.gz VRFGSSWIVDYSPD-ZDUSSCGKSA-N 1 2 324.758 4.056 20 0 DIADLO Oc1cnc(Cl)cc1C[N@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001233038581 1054174489 /nfs/dbraw/zinc/17/44/89/1054174489.db2.gz VRFGSSWIVDYSPD-ZDUSSCGKSA-N 1 2 324.758 4.056 20 0 DIADLO c1csc(C[N@H+](Cc2cccn2C2CC2)Cc2ccncc2)c1 ZINC001333875496 1054175762 /nfs/dbraw/zinc/17/57/62/1054175762.db2.gz IILQMRVOYUWHLR-UHFFFAOYSA-N 1 2 323.465 4.482 20 0 DIADLO c1csc(C[N@@H+](Cc2cccn2C2CC2)Cc2ccncc2)c1 ZINC001333875496 1054175775 /nfs/dbraw/zinc/17/57/75/1054175775.db2.gz IILQMRVOYUWHLR-UHFFFAOYSA-N 1 2 323.465 4.482 20 0 DIADLO CCOc1c(Cl)cc(C[NH+]2CC3(CCC3)C2)cc1Cl ZINC001233104246 1054185653 /nfs/dbraw/zinc/18/56/53/1054185653.db2.gz NZLCHZPGMCRSLU-UHFFFAOYSA-N 1 2 300.229 4.378 20 0 DIADLO CCOc1c(Cl)cc(C[N@@H+]2CCCO[C@@H](C)C2)cc1Cl ZINC001233107925 1054186402 /nfs/dbraw/zinc/18/64/02/1054186402.db2.gz POFGGCLTJAUCEO-NSHDSACASA-N 1 2 318.244 4.003 20 0 DIADLO CCOc1c(Cl)cc(C[N@H+]2CCCO[C@@H](C)C2)cc1Cl ZINC001233107925 1054186403 /nfs/dbraw/zinc/18/64/03/1054186403.db2.gz POFGGCLTJAUCEO-NSHDSACASA-N 1 2 318.244 4.003 20 0 DIADLO Cc1ccc(C)c2nc(Cl)c(C[N@H+]3C[C@H](F)C[C@H]3C)cc12 ZINC001233132195 1054190930 /nfs/dbraw/zinc/19/09/30/1054190930.db2.gz UJRSMBSEYQYLHA-TZMCWYRMSA-N 1 2 306.812 4.437 20 0 DIADLO Cc1ccc(C)c2nc(Cl)c(C[N@@H+]3C[C@H](F)C[C@H]3C)cc12 ZINC001233132195 1054190937 /nfs/dbraw/zinc/19/09/37/1054190937.db2.gz UJRSMBSEYQYLHA-TZMCWYRMSA-N 1 2 306.812 4.437 20 0 DIADLO Cc1nc(C[N@@H+]2CCC23CCCCC3)c(Br)s1 ZINC001233153428 1054190973 /nfs/dbraw/zinc/19/09/73/1054190973.db2.gz RMSCEMIANWOMDJ-UHFFFAOYSA-N 1 2 315.280 4.123 20 0 DIADLO Cc1nc(C[N@H+]2CCC23CCCCC3)c(Br)s1 ZINC001233153428 1054190984 /nfs/dbraw/zinc/19/09/84/1054190984.db2.gz RMSCEMIANWOMDJ-UHFFFAOYSA-N 1 2 315.280 4.123 20 0 DIADLO CCCCC[C@H](C(=O)NC[C@H]1c2ccccc2C[N@H+]1C)C(C)C ZINC001438571626 1054190997 /nfs/dbraw/zinc/19/09/97/1054190997.db2.gz IQMDUXYMQJEUAQ-HKUYNNGSSA-N 1 2 316.489 4.142 20 0 DIADLO CCCCC[C@H](C(=O)NC[C@H]1c2ccccc2C[N@@H+]1C)C(C)C ZINC001438571626 1054191011 /nfs/dbraw/zinc/19/10/11/1054191011.db2.gz IQMDUXYMQJEUAQ-HKUYNNGSSA-N 1 2 316.489 4.142 20 0 DIADLO Clc1nccc(C[N@@H+]2CCC23CCCC3)c1Br ZINC001233179854 1054198579 /nfs/dbraw/zinc/19/85/79/1054198579.db2.gz JIUKVEQYHZNGAT-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Clc1nccc(C[N@H+]2CCC23CCCC3)c1Br ZINC001233179854 1054198585 /nfs/dbraw/zinc/19/85/85/1054198585.db2.gz JIUKVEQYHZNGAT-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2c(F)ccc(C)c2F)C2CC2)s1 ZINC001334766363 1054198506 /nfs/dbraw/zinc/19/85/06/1054198506.db2.gz ILWITRCOJOCCSC-OAHLLOKOSA-N 1 2 308.397 4.279 20 0 DIADLO Cc1cc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)c(C)nn1 ZINC001334874063 1054204438 /nfs/dbraw/zinc/20/44/38/1054204438.db2.gz NDLIVWMOBGXTBI-UHFFFAOYSA-N 1 2 323.362 4.048 20 0 DIADLO Cc1cc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)c(C)nn1 ZINC001334874063 1054204451 /nfs/dbraw/zinc/20/44/51/1054204451.db2.gz NDLIVWMOBGXTBI-UHFFFAOYSA-N 1 2 323.362 4.048 20 0 DIADLO COc1c(O)cccc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)s1 ZINC001233257228 1054219587 /nfs/dbraw/zinc/21/95/87/1054219587.db2.gz WBRKEHCJHKMAHW-LBPRGKRZSA-N 1 2 323.845 4.453 20 0 DIADLO COc1c(O)cccc1C[N@H+]1CCC[C@H]1c1ccc(Cl)s1 ZINC001233257228 1054219599 /nfs/dbraw/zinc/21/95/99/1054219599.db2.gz WBRKEHCJHKMAHW-LBPRGKRZSA-N 1 2 323.845 4.453 20 0 DIADLO Cc1cnsc1C[N@H+](Cc1ccccc1)Cc1ccccn1 ZINC001233318314 1054231774 /nfs/dbraw/zinc/23/17/74/1054231774.db2.gz YVJILYFINQUQEW-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1cnsc1C[N@@H+](Cc1ccccc1)Cc1ccccn1 ZINC001233318314 1054231781 /nfs/dbraw/zinc/23/17/81/1054231781.db2.gz YVJILYFINQUQEW-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1cnsc1C[N@@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC001233321782 1054232159 /nfs/dbraw/zinc/23/21/59/1054232159.db2.gz CUZGUSOCZFYIRO-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1cnsc1C[N@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC001233321782 1054232169 /nfs/dbraw/zinc/23/21/69/1054232169.db2.gz CUZGUSOCZFYIRO-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO COc1cc(F)c(C[N@H+]2Cc3ccccc3[C@@H](C)C2)cc1F ZINC001233340998 1054238933 /nfs/dbraw/zinc/23/89/33/1054238933.db2.gz ZAAPFYUVHLLHOP-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)cc1F ZINC001233340998 1054238939 /nfs/dbraw/zinc/23/89/39/1054238939.db2.gz ZAAPFYUVHLLHOP-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)c2ccc(F)cc2F)c(C)[nH+]1 ZINC001355891215 1054240767 /nfs/dbraw/zinc/24/07/67/1054240767.db2.gz HVVMZEDEKBNVPN-LLVKDONJSA-N 1 2 304.340 4.027 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)Nc1[nH+]cccc1OC(C)C ZINC001336741771 1054244739 /nfs/dbraw/zinc/24/47/39/1054244739.db2.gz CKOTZTXAIBAEFJ-ZSEKCTLFSA-N 1 2 314.366 4.004 20 0 DIADLO FC1(F)CC[C@H](C[N@@H+]2CCO[C@@H](c3ccc(Cl)s3)C2)C1 ZINC001336756926 1054245450 /nfs/dbraw/zinc/24/54/50/1054245450.db2.gz NTVUXQFRDOGSJE-WDEREUQCSA-N 1 2 321.820 4.210 20 0 DIADLO FC1(F)CC[C@H](C[N@H+]2CCO[C@@H](c3ccc(Cl)s3)C2)C1 ZINC001336756926 1054245457 /nfs/dbraw/zinc/24/54/57/1054245457.db2.gz NTVUXQFRDOGSJE-WDEREUQCSA-N 1 2 321.820 4.210 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]1c1cnccn1 ZINC001233352432 1054246013 /nfs/dbraw/zinc/24/60/13/1054246013.db2.gz FDZBATJATUFCEP-OAHLLOKOSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+]1CCC[C@@H]1c1cnccn1 ZINC001233352432 1054246020 /nfs/dbraw/zinc/24/60/20/1054246020.db2.gz FDZBATJATUFCEP-OAHLLOKOSA-N 1 2 319.861 4.189 20 0 DIADLO COc1ccc([C@H]2CCCN2c2[nH+]ccc3cc(F)ccc32)nc1 ZINC001336859584 1054248147 /nfs/dbraw/zinc/24/81/47/1054248147.db2.gz SUOKIMNAIBMZHP-GOSISDBHSA-N 1 2 323.371 4.119 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H](C)c1ccc(CC(C)C)cc1 ZINC001439222688 1054249362 /nfs/dbraw/zinc/24/93/62/1054249362.db2.gz GTOBAUJOOSXHBH-INIZCTEOSA-N 1 2 310.441 4.061 20 0 DIADLO COc1ccc([C@@H]2CCCN2c2[nH+]ccc3cc(F)ccc32)nc1 ZINC001336859585 1054249960 /nfs/dbraw/zinc/24/99/60/1054249960.db2.gz SUOKIMNAIBMZHP-SFHVURJKSA-N 1 2 323.371 4.119 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2ccccc2Oc2ccccc2)o1 ZINC001233367425 1054252010 /nfs/dbraw/zinc/25/20/10/1054252010.db2.gz HNQBNMXIGRUFFN-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2ccccc2Oc2ccccc2)o1 ZINC001233367425 1054252025 /nfs/dbraw/zinc/25/20/25/1054252025.db2.gz HNQBNMXIGRUFFN-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c1F ZINC001233396089 1054261618 /nfs/dbraw/zinc/26/16/18/1054261618.db2.gz JJHXCMNESQIDBN-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c(Cl)c1O ZINC001233400898 1054261792 /nfs/dbraw/zinc/26/17/92/1054261792.db2.gz CWLIQZHJBQRGMC-CQSZACIVSA-N 1 2 303.789 4.001 20 0 DIADLO Cc1c([C@H](C)Nc2ccc(C)[nH+]c2C)nnn1-c1ccc(C)cc1 ZINC001337322337 1054264383 /nfs/dbraw/zinc/26/43/83/1054264383.db2.gz SNRCJWRNDUILGE-HNNXBMFYSA-N 1 2 321.428 4.069 20 0 DIADLO Clc1cccn2cc(C[N@@H+]3CCC[C@H]3c3cccs3)nc12 ZINC001233422530 1054267566 /nfs/dbraw/zinc/26/75/66/1054267566.db2.gz LFUPBCWKAVZNIL-AWEZNQCLSA-N 1 2 317.845 4.386 20 0 DIADLO Clc1cccn2cc(C[N@H+]3CCC[C@H]3c3cccs3)nc12 ZINC001233422530 1054267576 /nfs/dbraw/zinc/26/75/76/1054267576.db2.gz LFUPBCWKAVZNIL-AWEZNQCLSA-N 1 2 317.845 4.386 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1cc(Br)ncc1Cl ZINC001233427748 1054270310 /nfs/dbraw/zinc/27/03/10/1054270310.db2.gz KFCGTSNVKUCSEG-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1cc(Br)ncc1Cl ZINC001233427748 1054270327 /nfs/dbraw/zinc/27/03/27/1054270327.db2.gz KFCGTSNVKUCSEG-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@H](C)[C@@H](C)C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001337683703 1054280392 /nfs/dbraw/zinc/28/03/92/1054280392.db2.gz GROZBEZYSSVNAV-XHSDSOJGSA-N 1 2 319.493 4.026 20 0 DIADLO Cc1cc(N2CCC(O)(c3ccccc3)CC2)[nH+]c2ccccc12 ZINC001338053583 1054295043 /nfs/dbraw/zinc/29/50/43/1054295043.db2.gz XMSXWUFQMRXZSN-UHFFFAOYSA-N 1 2 318.420 4.031 20 0 DIADLO Cn1c(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)cnc1Cl ZINC000848915415 1054297133 /nfs/dbraw/zinc/29/71/33/1054297133.db2.gz VZEPQQHLQOPLKH-INIZCTEOSA-N 1 2 315.848 4.191 20 0 DIADLO Cn1c(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)cnc1Cl ZINC000848915415 1054297140 /nfs/dbraw/zinc/29/71/40/1054297140.db2.gz VZEPQQHLQOPLKH-INIZCTEOSA-N 1 2 315.848 4.191 20 0 DIADLO Clc1cccc2nc(C[N@@H+]3CCC[C@@H]3c3cccs3)cn21 ZINC001233592856 1054304898 /nfs/dbraw/zinc/30/48/98/1054304898.db2.gz VXLVVASDKLZFDF-CYBMUJFWSA-N 1 2 317.845 4.386 20 0 DIADLO Clc1cccc2nc(C[N@H+]3CCC[C@@H]3c3cccs3)cn21 ZINC001233592856 1054304910 /nfs/dbraw/zinc/30/49/10/1054304910.db2.gz VXLVVASDKLZFDF-CYBMUJFWSA-N 1 2 317.845 4.386 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC(=O)CC2)c(OCc2ccccc2)c1 ZINC001233628994 1054313294 /nfs/dbraw/zinc/31/32/94/1054313294.db2.gz PJUNCYSIVUDDDQ-UHFFFAOYSA-N 1 2 323.436 4.129 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC(=O)CC2)c(OCc2ccccc2)c1 ZINC001233628994 1054313308 /nfs/dbraw/zinc/31/33/08/1054313308.db2.gz PJUNCYSIVUDDDQ-UHFFFAOYSA-N 1 2 323.436 4.129 20 0 DIADLO CC1(C)CC[C@@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1 ZINC001356317237 1054317578 /nfs/dbraw/zinc/31/75/78/1054317578.db2.gz QDXTULDFUJLYML-GFCCVEGCSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1cc(C)c(CNC(=O)[C@H](C)c2cccc(CC(C)C)c2)c[nH+]1 ZINC000622667332 1054322168 /nfs/dbraw/zinc/32/21/68/1054322168.db2.gz APRLIYGPBVKCES-QGZVFWFLSA-N 1 2 324.468 4.317 20 0 DIADLO Cc1cc(C)c(NC(=O)C2CCc3ccccc3CC2)c(C)[nH+]1 ZINC001356375893 1054323417 /nfs/dbraw/zinc/32/34/17/1054323417.db2.gz AYKXEINRJBGVQI-UHFFFAOYSA-N 1 2 308.425 4.141 20 0 DIADLO CC[C@@H](C)CCC(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001339299767 1054334845 /nfs/dbraw/zinc/33/48/45/1054334845.db2.gz FVPUZHIQCDYNHW-CVEARBPZSA-N 1 2 319.493 4.170 20 0 DIADLO Cc1cc(C[N@@H+]2CCOC[C@H]2c2ccc(F)cc2)sc1C ZINC001233700560 1054336284 /nfs/dbraw/zinc/33/62/84/1054336284.db2.gz OQDVIJSLBNTQJZ-KRWDZBQOSA-N 1 2 305.418 4.078 20 0 DIADLO Cc1cc(C[N@H+]2CCOC[C@H]2c2ccc(F)cc2)sc1C ZINC001233700560 1054336297 /nfs/dbraw/zinc/33/62/97/1054336297.db2.gz OQDVIJSLBNTQJZ-KRWDZBQOSA-N 1 2 305.418 4.078 20 0 DIADLO Cc1cc(N[C@H]2COc3ccc(Cl)cc32)nc(C(C)C)[nH+]1 ZINC000474782705 1054357042 /nfs/dbraw/zinc/35/70/42/1054357042.db2.gz ZGZWGNCTIUOOTJ-ZDUSSCGKSA-N 1 2 303.793 4.107 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](CC(C)C)n2cc[nH+]c2)cc1Cl ZINC001440572518 1054357288 /nfs/dbraw/zinc/35/72/88/1054357288.db2.gz AXARYYGNGLBMTN-OAHLLOKOSA-N 1 2 305.809 4.071 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)/C(F)=C/C1CCCCC1 ZINC001441151972 1054384455 /nfs/dbraw/zinc/38/44/55/1054384455.db2.gz YCZZRQSSJZTUBN-QINSGFPZSA-N 1 2 313.376 4.245 20 0 DIADLO CCc1cn(Cc2ccc(OC)c(SC(F)(F)F)c2)c[nH+]1 ZINC001473087148 1054386413 /nfs/dbraw/zinc/38/64/13/1054386413.db2.gz NZPVREJMRLYBRW-UHFFFAOYSA-N 1 2 316.348 4.114 20 0 DIADLO CC(C)C[C@@H](C(=O)N(CC1CCCCC1)C1CC1)n1cc[nH+]c1 ZINC001441887503 1054401498 /nfs/dbraw/zinc/40/14/98/1054401498.db2.gz GAKCYIKHVDKWAK-SFHVURJKSA-N 1 2 317.477 4.042 20 0 DIADLO Fc1ccc2cc(CNc3ccc(N4CCCCC4)c[nH+]3)[nH]c2c1 ZINC000486314818 1054409409 /nfs/dbraw/zinc/40/94/09/1054409409.db2.gz BCLJIVVZRNLOPN-UHFFFAOYSA-N 1 2 324.403 4.304 20 0 DIADLO Cc1cc(N[C@H](C)[C@@H]2OCCc3sccc32)nc(C(C)C)[nH+]1 ZINC000488741967 1054433256 /nfs/dbraw/zinc/43/32/56/1054433256.db2.gz CPNKLISYGSTLAF-WBMJQRKESA-N 1 2 317.458 4.084 20 0 DIADLO CCc1cnc(CNc2[nH+]c3ccccc3n2C(C)(C)C)s1 ZINC001343321801 1054440801 /nfs/dbraw/zinc/44/08/01/1054440801.db2.gz KJEDOVGUKUQUIL-UHFFFAOYSA-N 1 2 314.458 4.422 20 0 DIADLO C[C@H]1CCCC[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001357253874 1054445759 /nfs/dbraw/zinc/44/57/59/1054445759.db2.gz HFHAFBOXXVJEKF-GXTWGEPZSA-N 1 2 317.820 4.291 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+]2C[C@@H]3CCCC[C@]32c2ccccc2)[nH]1 ZINC001343871119 1054453887 /nfs/dbraw/zinc/45/38/87/1054453887.db2.gz IJMZOSIKZBOFGA-JXFKEZNVSA-N 1 2 324.472 4.004 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+]2C[C@@H]3CCCC[C@]32c2ccccc2)[nH]1 ZINC001343871119 1054453890 /nfs/dbraw/zinc/45/38/90/1054453890.db2.gz IJMZOSIKZBOFGA-JXFKEZNVSA-N 1 2 324.472 4.004 20 0 DIADLO CC(C)CCc1noc(C[N@H+](C)C(C)(C)c2ccccc2)n1 ZINC000671246183 1054458164 /nfs/dbraw/zinc/45/81/64/1054458164.db2.gz CKKSFFVSKWHBII-UHFFFAOYSA-N 1 2 301.434 4.025 20 0 DIADLO CC(C)CCc1noc(C[N@@H+](C)C(C)(C)c2ccccc2)n1 ZINC000671246183 1054458178 /nfs/dbraw/zinc/45/81/78/1054458178.db2.gz CKKSFFVSKWHBII-UHFFFAOYSA-N 1 2 301.434 4.025 20 0 DIADLO C[N@H+](Cc1noc(-c2ccsc2)n1)C(C)(C)c1ccccc1 ZINC000671246833 1054459983 /nfs/dbraw/zinc/45/99/83/1054459983.db2.gz OZIXTNKZYQUNRB-UHFFFAOYSA-N 1 2 313.426 4.165 20 0 DIADLO C[N@@H+](Cc1noc(-c2ccsc2)n1)C(C)(C)c1ccccc1 ZINC000671246833 1054459992 /nfs/dbraw/zinc/45/99/92/1054459992.db2.gz OZIXTNKZYQUNRB-UHFFFAOYSA-N 1 2 313.426 4.165 20 0 DIADLO C[N@H+](Cc1nc(Cc2ccccc2)no1)C(C)(C)c1ccccc1 ZINC000671246811 1054461129 /nfs/dbraw/zinc/46/11/29/1054461129.db2.gz OLXKCHRKGBRLLP-UHFFFAOYSA-N 1 2 321.424 4.028 20 0 DIADLO C[N@@H+](Cc1nc(Cc2ccccc2)no1)C(C)(C)c1ccccc1 ZINC000671246811 1054461134 /nfs/dbraw/zinc/46/11/34/1054461134.db2.gz OLXKCHRKGBRLLP-UHFFFAOYSA-N 1 2 321.424 4.028 20 0 DIADLO CCO[C@H](C)c1noc(C[NH2+][C@@H](CC)c2cccc(Cl)c2)n1 ZINC000173449565 1054484426 /nfs/dbraw/zinc/48/44/26/1054484426.db2.gz OZWKLBYTSVKHBU-RISCZKNCSA-N 1 2 323.824 4.061 20 0 DIADLO CC[C@H](c1ccccc1)N(C(=O)C[C@H](C)n1cc[nH+]c1)C(C)C ZINC000622977406 1054498071 /nfs/dbraw/zinc/49/80/71/1054498071.db2.gz ZZZCWABTADEFPC-FUHWJXTLSA-N 1 2 313.445 4.223 20 0 DIADLO C[NH+](C)Cc1nnc(C(C)(C)c2ccc(-c3ccccc3)cc2)o1 ZINC001345529574 1054498975 /nfs/dbraw/zinc/49/89/75/1054498975.db2.gz UMTCNEKOBOLNQB-UHFFFAOYSA-N 1 2 321.424 4.124 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@H](C)CCCc3ccccc3)cc2[nH+]1 ZINC001445755463 1054515783 /nfs/dbraw/zinc/51/57/83/1054515783.db2.gz XWOHOTPNTSNDPW-CQSZACIVSA-N 1 2 321.424 4.469 20 0 DIADLO Cc1cccc(C)c1C[N@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000174977556 1054519435 /nfs/dbraw/zinc/51/94/35/1054519435.db2.gz SWSFLSDBXYNRFN-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1cccc(C)c1C[N@@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000174977556 1054519447 /nfs/dbraw/zinc/51/94/47/1054519447.db2.gz SWSFLSDBXYNRFN-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO C[N@H+](Cc1cncs1)Cc1cc(Cl)ccc1OC(F)F ZINC001234441051 1054523593 /nfs/dbraw/zinc/52/35/93/1054523593.db2.gz HZUKEXOJMOXQPM-UHFFFAOYSA-N 1 2 318.776 4.030 20 0 DIADLO C[N@@H+](Cc1cncs1)Cc1cc(Cl)ccc1OC(F)F ZINC001234441051 1054523610 /nfs/dbraw/zinc/52/36/10/1054523610.db2.gz HZUKEXOJMOXQPM-UHFFFAOYSA-N 1 2 318.776 4.030 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccn(Cc2ccccc2)n1)c1ccccc1F ZINC000342810659 1054525955 /nfs/dbraw/zinc/52/59/55/1054525955.db2.gz RALLWGAEHUXJDD-HXUWFJFHSA-N 1 2 323.415 4.311 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[NH2+][C@@H](Cc1ccccc1)c1ncco1 ZINC001346438257 1054537513 /nfs/dbraw/zinc/53/75/13/1054537513.db2.gz NKQBPCPVDIKKHL-OALUTQOASA-N 1 2 322.383 4.375 20 0 DIADLO Fc1cccc2c1CC[C@H]2[NH2+][C@@H](Cc1ccccc1)c1ncco1 ZINC001346438251 1054537679 /nfs/dbraw/zinc/53/76/79/1054537679.db2.gz NKQBPCPVDIKKHL-MOPGFXCFSA-N 1 2 322.383 4.375 20 0 DIADLO Cc1cnc(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)o1 ZINC000671307791 1054550504 /nfs/dbraw/zinc/55/05/04/1054550504.db2.gz ZLWGJSDLIWQPFC-UHFFFAOYSA-N 1 2 319.817 4.050 20 0 DIADLO Cn1ncc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)c1Cl ZINC001347702236 1054576750 /nfs/dbraw/zinc/57/67/50/1054576750.db2.gz RVPWGASTLBREKY-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1ncc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)c1Cl ZINC001347702236 1054576740 /nfs/dbraw/zinc/57/67/40/1054576740.db2.gz RVPWGASTLBREKY-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1c(F)cc(F)cc1Br ZINC001234734797 1054584012 /nfs/dbraw/zinc/58/40/12/1054584012.db2.gz PQDAOQFCIMNGFG-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1c(F)cc(F)cc1Br ZINC001234734797 1054584026 /nfs/dbraw/zinc/58/40/26/1054584026.db2.gz PQDAOQFCIMNGFG-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO FC(F)(F)c1sccc1C[NH2+]Cc1csc(C2CC2)n1 ZINC000623415696 1054589473 /nfs/dbraw/zinc/58/94/73/1054589473.db2.gz UPCNYHDBMCQCRL-UHFFFAOYSA-N 1 2 318.389 4.391 20 0 DIADLO CCCC[C@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)C(C)C ZINC001358066640 1054592422 /nfs/dbraw/zinc/59/24/22/1054592422.db2.gz BHEKHZIZEAGJLH-HNNXBMFYSA-N 1 2 317.408 4.412 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2csc(C(F)(F)F)c2)s1 ZINC000623441344 1054596114 /nfs/dbraw/zinc/59/61/14/1054596114.db2.gz NYRFXTOPJZSAPD-QMMMGPOBSA-N 1 2 306.378 4.383 20 0 DIADLO FC(F)(F)c1cc(C[NH2+]Cc2nc(C3CC3)cs2)cs1 ZINC000623451900 1054599577 /nfs/dbraw/zinc/59/95/77/1054599577.db2.gz PENJVTGYZZBZCZ-UHFFFAOYSA-N 1 2 318.389 4.391 20 0 DIADLO C[C@H](C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1)C(C)(C)C ZINC001348116601 1054612945 /nfs/dbraw/zinc/61/29/45/1054612945.db2.gz VRBFMHZVLZOVTA-HUUCEWRRSA-N 1 2 319.493 4.026 20 0 DIADLO COc1cc2ccccc2cc1OC1C[NH+](Cc2ccccc2)C1 ZINC001234899489 1054615696 /nfs/dbraw/zinc/61/56/96/1054615696.db2.gz PHURQLZIBNTRJU-UHFFFAOYSA-N 1 2 319.404 4.112 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc2c(c1)OCO2)c1ncc(C(C)(C)C)o1 ZINC000177418040 1054620727 /nfs/dbraw/zinc/62/07/27/1054620727.db2.gz JKNOBKPMYBXGFX-RYUDHWBXSA-N 1 2 316.401 4.113 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1c[nH]c(-c2ccccc2F)c1 ZINC001235044112 1054646412 /nfs/dbraw/zinc/64/64/12/1054646412.db2.gz UJLMDHNGCGWNHR-UHFFFAOYSA-N 1 2 322.383 4.136 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1c[nH]c(-c2ccccc2F)c1 ZINC001235044112 1054646418 /nfs/dbraw/zinc/64/64/18/1054646418.db2.gz UJLMDHNGCGWNHR-UHFFFAOYSA-N 1 2 322.383 4.136 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC001473359458 1054649652 /nfs/dbraw/zinc/64/96/52/1054649652.db2.gz VCFBCDSNXVSJCK-OAHLLOKOSA-N 1 2 304.796 4.211 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC001473359458 1054649662 /nfs/dbraw/zinc/64/96/62/1054649662.db2.gz VCFBCDSNXVSJCK-OAHLLOKOSA-N 1 2 304.796 4.211 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC001473359457 1054650181 /nfs/dbraw/zinc/65/01/81/1054650181.db2.gz VCFBCDSNXVSJCK-HNNXBMFYSA-N 1 2 304.796 4.211 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC001473359457 1054650188 /nfs/dbraw/zinc/65/01/88/1054650188.db2.gz VCFBCDSNXVSJCK-HNNXBMFYSA-N 1 2 304.796 4.211 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000179142142 1054668875 /nfs/dbraw/zinc/66/88/75/1054668875.db2.gz CNTPUQVCCJDVCI-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000179142142 1054668885 /nfs/dbraw/zinc/66/88/85/1054668885.db2.gz CNTPUQVCCJDVCI-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO CC(=O)[C@@H]1CCC[N@H+](Cc2c(Cl)cc(C)cc2Cl)C1 ZINC001235166943 1054669011 /nfs/dbraw/zinc/66/90/11/1054669011.db2.gz AMEZGOGKLYARDJ-GFCCVEGCSA-N 1 2 300.229 4.103 20 0 DIADLO CC(=O)[C@@H]1CCC[N@@H+](Cc2c(Cl)cc(C)cc2Cl)C1 ZINC001235166943 1054669028 /nfs/dbraw/zinc/66/90/28/1054669028.db2.gz AMEZGOGKLYARDJ-GFCCVEGCSA-N 1 2 300.229 4.103 20 0 DIADLO CCCCc1ccc(NC(=O)c2ccn3c(C)c[nH+]c3c2)cc1 ZINC001348731369 1054677227 /nfs/dbraw/zinc/67/72/27/1054677227.db2.gz ZEACATDGRLNMQZ-UHFFFAOYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)Cc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000179384203 1054678208 /nfs/dbraw/zinc/67/82/08/1054678208.db2.gz MXUXXYCGRDHOBS-LBPRGKRZSA-N 1 2 316.832 4.478 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3cc(-c4cccs4)on3)CC2)c1 ZINC000179683019 1054696591 /nfs/dbraw/zinc/69/65/91/1054696591.db2.gz KKVLFASARLLEBE-UHFFFAOYSA-N 1 2 314.385 4.321 20 0 DIADLO CCO[C@H](C)c1nc(C[NH2+]C2(c3cccc(F)c3)CC2)cs1 ZINC000179694045 1054697119 /nfs/dbraw/zinc/69/71/19/1054697119.db2.gz GXPAFKDGVLUDSW-GFCCVEGCSA-N 1 2 320.433 4.159 20 0 DIADLO Cc1ccccc1-c1nc(C[NH2+][C@@H](c2ccccc2)C2CC2)no1 ZINC000179690596 1054697253 /nfs/dbraw/zinc/69/72/53/1054697253.db2.gz KYDDRRAPYCFYRN-IBGZPJMESA-N 1 2 319.408 4.286 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1nc2ccccc2o1 ZINC000179746088 1054698841 /nfs/dbraw/zinc/69/88/41/1054698841.db2.gz OJRLCTCTFAVLCV-OAHLLOKOSA-N 1 2 310.397 4.467 20 0 DIADLO Cc1ccc2oc(NCc3cc[nH+]c(N4CCCCC4)c3)nc2c1 ZINC000604035144 1054702184 /nfs/dbraw/zinc/70/21/84/1054702184.db2.gz OCDZISNOHHVQKG-UHFFFAOYSA-N 1 2 322.412 4.134 20 0 DIADLO CCC(CC)[C@@H]([NH2+]Cc1noc(C(C)C)n1)c1ccccc1 ZINC000179789288 1054704679 /nfs/dbraw/zinc/70/46/79/1054704679.db2.gz BVGCFCNSOJWKDG-QGZVFWFLSA-N 1 2 301.434 4.460 20 0 DIADLO Cc1cc(NCCc2ccc(C(F)(F)F)cc2)nc(C2CC2)[nH+]1 ZINC000604755596 1054707988 /nfs/dbraw/zinc/70/79/88/1054707988.db2.gz KIPBYENITFKSTA-UHFFFAOYSA-N 1 2 321.346 4.336 20 0 DIADLO Cc1cc(OC(C)C)ncc1C[N@H+](C)Cc1ccc(F)cc1F ZINC001235430934 1054717403 /nfs/dbraw/zinc/71/74/03/1054717403.db2.gz BLKFERJSHYAOHT-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO Cc1cc(OC(C)C)ncc1C[N@@H+](C)Cc1ccc(F)cc1F ZINC001235430934 1054717421 /nfs/dbraw/zinc/71/74/21/1054717421.db2.gz BLKFERJSHYAOHT-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO Cc1cc(OC(C)C)ncc1C[N@H+](C)Cc1cccc(F)c1F ZINC001235432461 1054717926 /nfs/dbraw/zinc/71/79/26/1054717926.db2.gz KUAVALUAROKASY-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO Cc1cc(OC(C)C)ncc1C[N@@H+](C)Cc1cccc(F)c1F ZINC001235432461 1054717938 /nfs/dbraw/zinc/71/79/38/1054717938.db2.gz KUAVALUAROKASY-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)C[C@]1(C)O ZINC001235587272 1054746794 /nfs/dbraw/zinc/74/67/94/1054746794.db2.gz ALIPDYRGCUMHFM-OTYXRUKQSA-N 1 2 322.663 4.240 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3cnoc3C(C)C)cc2)[nH+]c1C ZINC001349157457 1054722955 /nfs/dbraw/zinc/72/29/55/1054722955.db2.gz LVJGXKOCODKWOP-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H]2CCCc3ccc(Cl)cc32)nn1C ZINC000623752006 1054723032 /nfs/dbraw/zinc/72/30/32/1054723032.db2.gz VOCADEHUYJGSQY-AWEZNQCLSA-N 1 2 324.255 4.203 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@H]2c2cccnc2)cc(F)c1F ZINC001235448538 1054726300 /nfs/dbraw/zinc/72/63/00/1054726300.db2.gz LCJDQQQFBWOZCU-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@H]2c2cccnc2)cc(F)c1F ZINC001235448538 1054726316 /nfs/dbraw/zinc/72/63/16/1054726316.db2.gz LCJDQQQFBWOZCU-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)n1 ZINC000180030637 1054726339 /nfs/dbraw/zinc/72/63/39/1054726339.db2.gz QTUCKWWJNGLBNG-SGIREYDYSA-N 1 2 319.836 4.333 20 0 DIADLO COc1cncc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c1C ZINC001235474491 1054731411 /nfs/dbraw/zinc/73/14/11/1054731411.db2.gz QLTVMUFUFWWGEN-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cncc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)c1C ZINC001235474491 1054731427 /nfs/dbraw/zinc/73/14/27/1054731427.db2.gz QLTVMUFUFWWGEN-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cncc(F)c1Cl ZINC001235494998 1054732164 /nfs/dbraw/zinc/73/21/64/1054732164.db2.gz KWWKBGADHDTIJN-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1cncc(F)c1Cl ZINC001235494998 1054732177 /nfs/dbraw/zinc/73/21/77/1054732177.db2.gz KWWKBGADHDTIJN-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Fc1cncc(C[N@H+]2CC=C(c3ccccc3)CC2)c1Cl ZINC001235500270 1054733723 /nfs/dbraw/zinc/73/37/23/1054733723.db2.gz VIYYFZUSRPSUTA-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Fc1cncc(C[N@@H+]2CC=C(c3ccccc3)CC2)c1Cl ZINC001235500270 1054733737 /nfs/dbraw/zinc/73/37/37/1054733737.db2.gz VIYYFZUSRPSUTA-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO CCCOc1cccc(CNc2ccc(N3CCCC3)c[nH+]2)c1 ZINC000513015002 1054740330 /nfs/dbraw/zinc/74/03/30/1054740330.db2.gz PKCFPFORFBHJDC-UHFFFAOYSA-N 1 2 311.429 4.083 20 0 DIADLO CC(C)Oc1ccc(CNc2ccc(N3CCCC3)c[nH+]2)cc1 ZINC000513019755 1054741171 /nfs/dbraw/zinc/74/11/71/1054741171.db2.gz HEOUKLFYAJFRMG-UHFFFAOYSA-N 1 2 311.429 4.081 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nccc(C)c2Cl)cn1 ZINC001235589720 1054746321 /nfs/dbraw/zinc/74/63/21/1054746321.db2.gz XSXZJVVMTVIUKL-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nccc(C)c2Cl)cn1 ZINC001235589720 1054746335 /nfs/dbraw/zinc/74/63/35/1054746335.db2.gz XSXZJVVMTVIUKL-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)C[C@]1(C)O ZINC001235587272 1054746780 /nfs/dbraw/zinc/74/67/80/1054746780.db2.gz ALIPDYRGCUMHFM-OTYXRUKQSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccccc2-c2ccncc2)CC1(F)F ZINC001235611180 1054755263 /nfs/dbraw/zinc/75/52/63/1054755263.db2.gz HBHOPHXTLDCPJB-CQSZACIVSA-N 1 2 302.368 4.226 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccccc2-c2ccncc2)CC1(F)F ZINC001235611180 1054755279 /nfs/dbraw/zinc/75/52/79/1054755279.db2.gz HBHOPHXTLDCPJB-CQSZACIVSA-N 1 2 302.368 4.226 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2ccc(Cl)cc2Cl)c(C)[nH+]1 ZINC001349504991 1054758899 /nfs/dbraw/zinc/75/88/99/1054758899.db2.gz OBAPIFCUUZUYSG-UHFFFAOYSA-N 1 2 323.223 4.244 20 0 DIADLO CCCC[C@@H](CC)C(=O)N1CC[NH2+][C@H](c2ccc(Cl)cc2)C1 ZINC001454259508 1054761717 /nfs/dbraw/zinc/76/17/17/1054761717.db2.gz XPRGGOADGUQTAH-PBHICJAKSA-N 1 2 322.880 4.029 20 0 DIADLO CC[N@H+](Cc1nc2cc(F)ccc2o1)Cc1ccccc1F ZINC001349586493 1054771427 /nfs/dbraw/zinc/77/14/27/1054771427.db2.gz WXYGSHGZKNMCAW-UHFFFAOYSA-N 1 2 302.324 4.128 20 0 DIADLO CC[N@@H+](Cc1nc2cc(F)ccc2o1)Cc1ccccc1F ZINC001349586493 1054771442 /nfs/dbraw/zinc/77/14/42/1054771442.db2.gz WXYGSHGZKNMCAW-UHFFFAOYSA-N 1 2 302.324 4.128 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1ccc2c(c1)ncn2C ZINC000521069525 1054772197 /nfs/dbraw/zinc/77/21/97/1054772197.db2.gz MATAUBLPASYFLV-UHFFFAOYSA-N 1 2 319.412 4.116 20 0 DIADLO Nc1ccc(Cl)nc1C[N@@H+]1CCCC[C@@H]1c1ccccc1F ZINC001235681238 1054774409 /nfs/dbraw/zinc/77/44/09/1054774409.db2.gz WTAQIEJUAWQPLM-MRXNPFEDSA-N 1 2 319.811 4.184 20 0 DIADLO Nc1ccc(Cl)nc1C[N@H+]1CCCC[C@@H]1c1ccccc1F ZINC001235681238 1054774422 /nfs/dbraw/zinc/77/44/22/1054774422.db2.gz WTAQIEJUAWQPLM-MRXNPFEDSA-N 1 2 319.811 4.184 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1nc2ccc(F)cc2[nH]1 ZINC001235686799 1054778821 /nfs/dbraw/zinc/77/88/21/1054778821.db2.gz BWQZXTGNPKUJSZ-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1nc2ccc(F)cc2[nH]1 ZINC001235686799 1054778831 /nfs/dbraw/zinc/77/88/31/1054778831.db2.gz BWQZXTGNPKUJSZ-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Nc1ccnc(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC001235694174 1054783301 /nfs/dbraw/zinc/78/33/01/1054783301.db2.gz NILYDWCSKOTTMA-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccnc(Cl)c1C[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC001235694174 1054783308 /nfs/dbraw/zinc/78/33/08/1054783308.db2.gz NILYDWCSKOTTMA-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Cc1cc(CNc2cnn([C@@H](C)C3CC3)c2)c2c([nH+]1)CCCC2 ZINC001474121863 1054784036 /nfs/dbraw/zinc/78/40/36/1054784036.db2.gz LSMNQJMENSTVLC-AWEZNQCLSA-N 1 2 310.445 4.048 20 0 DIADLO Clc1ccc2c(c1)[C@H]([NH2+]Cc1n[nH]c3ccccc31)CCC2 ZINC000623832730 1054784914 /nfs/dbraw/zinc/78/49/14/1054784914.db2.gz JAIGDTULTDNSAB-MRXNPFEDSA-N 1 2 311.816 4.384 20 0 DIADLO Fc1cccc(F)c1C1([NH2+]Cc2cc3cccnc3o2)CCC1 ZINC000623844428 1054788410 /nfs/dbraw/zinc/78/84/10/1054788410.db2.gz WAUGKJVSZZXWKU-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2scnc21)c1ccccc1OC(F)F ZINC000623856318 1054788640 /nfs/dbraw/zinc/78/86/40/1054788640.db2.gz RVZMYCUONQKFRF-CMPLNLGQSA-N 1 2 324.396 4.473 20 0 DIADLO c1nc2c(s1)CCC[C@@H]2[NH2+][C@@H](c1ccccc1)c1ccncc1 ZINC000623874996 1054797044 /nfs/dbraw/zinc/79/70/44/1054797044.db2.gz VJOSJCMSMPEOGF-WMZOPIPTSA-N 1 2 321.449 4.295 20 0 DIADLO CCOC1CC[NH+](Cc2c(F)cc(Cl)cc2Cl)CC1 ZINC001235748195 1054797233 /nfs/dbraw/zinc/79/72/33/1054797233.db2.gz YDPMZZWWIBYFLM-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO c1nc2c(s1)CCC[C@H]2[NH2+][C@H](c1ccccc1)c1ccncc1 ZINC000623874995 1054798076 /nfs/dbraw/zinc/79/80/76/1054798076.db2.gz VJOSJCMSMPEOGF-SJLPKXTDSA-N 1 2 321.449 4.295 20 0 DIADLO CCOCC1CC[NH+](Cc2c(F)cc(Cl)cc2Cl)CC1 ZINC001235750519 1054798483 /nfs/dbraw/zinc/79/84/83/1054798483.db2.gz MSEWGNNFYFDCKH-UHFFFAOYSA-N 1 2 320.235 4.381 20 0 DIADLO Cc1cc(NCc2ccnc(-c3ccccc3)c2)nc(C2CC2)[nH+]1 ZINC000624705223 1054799935 /nfs/dbraw/zinc/79/99/35/1054799935.db2.gz CVCQNAQHVAHGGB-UHFFFAOYSA-N 1 2 316.408 4.337 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+][C@H]1CCCc3scnc31)CCCO2 ZINC000623877353 1054800433 /nfs/dbraw/zinc/80/04/33/1054800433.db2.gz ZVSABLMVURMJEN-KBPBESRZSA-N 1 2 318.417 4.163 20 0 DIADLO Cc1noc(C2CCC(Nc3[nH+]c4ccccc4cc3C)CC2)n1 ZINC000531760335 1054806711 /nfs/dbraw/zinc/80/67/11/1054806711.db2.gz HSZWHMVGNRAMAU-UHFFFAOYSA-N 1 2 322.412 4.373 20 0 DIADLO Cc1nc2[nH]ccc2c(NCc2cccc(Cl)c2Cl)[nH+]1 ZINC000531433101 1054807681 /nfs/dbraw/zinc/80/76/81/1054807681.db2.gz IMFCBRXJRSQWSG-UHFFFAOYSA-N 1 2 307.184 4.185 20 0 DIADLO CC(=O)Nc1cccc(CNc2[nH+]c3ccccc3n2C(C)C)c1 ZINC000630953792 1054823649 /nfs/dbraw/zinc/82/36/49/1054823649.db2.gz AKISXFRBZQRMGT-UHFFFAOYSA-N 1 2 322.412 4.188 20 0 DIADLO Cc1nn(C)c(C[N@@H+](C(C)C)[C@@H](C)c2ccsc2)c1Cl ZINC001474586026 1054830215 /nfs/dbraw/zinc/83/02/15/1054830215.db2.gz KCMXXACHOYZDSP-LBPRGKRZSA-N 1 2 311.882 4.415 20 0 DIADLO Cc1nn(C)c(C[N@H+](C(C)C)[C@@H](C)c2ccsc2)c1Cl ZINC001474586026 1054830230 /nfs/dbraw/zinc/83/02/30/1054830230.db2.gz KCMXXACHOYZDSP-LBPRGKRZSA-N 1 2 311.882 4.415 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]C2(c3ccc(F)cc3F)CCC2)n1 ZINC000623944676 1054830417 /nfs/dbraw/zinc/83/04/17/1054830417.db2.gz NOKCXBKUVSJREI-LLVKDONJSA-N 1 2 308.397 4.460 20 0 DIADLO COC[C@@H]([NH2+][C@@H]1CCCc2scnc21)c1cccc(Cl)c1 ZINC000623985397 1054840216 /nfs/dbraw/zinc/84/02/16/1054840216.db2.gz OXYOSKCWCAQELT-ZIAGYGMSSA-N 1 2 322.861 4.151 20 0 DIADLO C[C@@H](CC(=O)Oc1ccc(Cl)c2ccccc12)n1cc[nH+]c1 ZINC001349984229 1054840969 /nfs/dbraw/zinc/84/09/69/1054840969.db2.gz HYKHPCMDBMURGZ-LBPRGKRZSA-N 1 2 314.772 4.246 20 0 DIADLO COC[C@@H]([NH2+][C@@H]1CCCc2scnc21)c1ccc(Cl)cc1 ZINC000623972254 1054841374 /nfs/dbraw/zinc/84/13/74/1054841374.db2.gz XADBBLJYKGCTSL-ZIAGYGMSSA-N 1 2 322.861 4.151 20 0 DIADLO C[C@@H](CC(=O)Oc1ccc2oc3ccccc3c2c1)n1cc[nH+]c1 ZINC001350120352 1054872170 /nfs/dbraw/zinc/87/21/70/1054872170.db2.gz GKMAECWNXNZYHR-ZDUSSCGKSA-N 1 2 320.348 4.339 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1ccc(Cl)cc1Cl ZINC001235961703 1054872470 /nfs/dbraw/zinc/87/24/70/1054872470.db2.gz BYUFCUGAKXJJOI-UHFFFAOYSA-N 1 2 323.223 4.200 20 0 DIADLO Cc1cc2c[nH+]c(C=Cc3ccc(C(F)(F)F)cc3)nc2[nH]1 ZINC001235978565 1054878885 /nfs/dbraw/zinc/87/88/85/1054878885.db2.gz KECMAXIOZYMKPP-QPJJXVBHSA-N 1 2 303.287 4.407 20 0 DIADLO C[C@@H]([NH2+][C@@H](CCc1ccccc1)C(F)F)c1cccc(CO)c1 ZINC000624125065 1054885955 /nfs/dbraw/zinc/88/59/55/1054885955.db2.gz SBSNJXAVHFFRGO-KDOFPFPSSA-N 1 2 319.395 4.096 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](c2cccc(F)c2)C2CCCC2)n1 ZINC000180997066 1054897691 /nfs/dbraw/zinc/89/76/91/1054897691.db2.gz IZUKZXHVFGTVAK-GOSISDBHSA-N 1 2 317.408 4.182 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2cccc(F)c2)C2CCCC2)o1 ZINC000181005420 1054898319 /nfs/dbraw/zinc/89/83/19/1054898319.db2.gz LMCMWXZBFBCEIS-QGZVFWFLSA-N 1 2 317.408 4.353 20 0 DIADLO Fc1ccc(F)c([C@@H]([NH2+][C@H]2CCOC2)c2ccccc2Cl)c1 ZINC000181165510 1054905436 /nfs/dbraw/zinc/90/54/36/1054905436.db2.gz QXRMLXDGAQPIDE-SJCJKPOMSA-N 1 2 323.770 4.086 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(-c2ccc(F)cc2)o1)c1cccc(O)c1 ZINC000181499661 1054917248 /nfs/dbraw/zinc/91/72/48/1054917248.db2.gz ZRQVBVZPVRZCHN-LBPRGKRZSA-N 1 2 312.344 4.037 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1ccccc1NC(C)=O ZINC000181479459 1054917441 /nfs/dbraw/zinc/91/74/41/1054917441.db2.gz XRSJTQMBQDEENQ-UHFFFAOYSA-N 1 2 322.412 4.017 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@@H](CC)c2ccc(C)cc2)n1 ZINC000181677165 1054929000 /nfs/dbraw/zinc/92/90/00/1054929000.db2.gz NDDYMIQUAZFIJS-HIFRSBDPSA-N 1 2 319.474 4.433 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@@H](CC)c2ccc(C)cc2)n1 ZINC000181677203 1054929431 /nfs/dbraw/zinc/92/94/31/1054929431.db2.gz NDDYMIQUAZFIJS-ZFWWWQNUSA-N 1 2 319.474 4.433 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)c1ccc(C)cc1 ZINC000181684652 1054929725 /nfs/dbraw/zinc/92/97/25/1054929725.db2.gz DMLKHPZPCSRLGU-UKRRQHHQSA-N 1 2 301.434 4.477 20 0 DIADLO CC[C@H]([NH2+]Cc1noc(-c2ccccc2)n1)c1ccc(C)cc1 ZINC000181703384 1054931954 /nfs/dbraw/zinc/93/19/54/1054931954.db2.gz PSQWYKPXBKOZRC-KRWDZBQOSA-N 1 2 307.397 4.286 20 0 DIADLO CC[N@H+](Cc1cccc2c1NCC2)Cc1c(F)cccc1Cl ZINC001236104373 1054949446 /nfs/dbraw/zinc/94/94/46/1054949446.db2.gz KARDWZCLVUYYDF-UHFFFAOYSA-N 1 2 318.823 4.469 20 0 DIADLO CC[N@@H+](Cc1cccc2c1NCC2)Cc1c(F)cccc1Cl ZINC001236104373 1054949461 /nfs/dbraw/zinc/94/94/61/1054949461.db2.gz KARDWZCLVUYYDF-UHFFFAOYSA-N 1 2 318.823 4.469 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cccnc1OC(C)C ZINC001236104448 1054950062 /nfs/dbraw/zinc/95/00/62/1054950062.db2.gz ZHZUHSYMEVSPMO-UHFFFAOYSA-N 1 2 311.429 4.230 20 0 DIADLO CC(C)Sc1ccc([C@H](C)[NH2+]Cc2nc(C3CC3)no2)cc1 ZINC000182100165 1054960863 /nfs/dbraw/zinc/96/08/63/1054960863.db2.gz MKFJQWSWSOZHKQ-LBPRGKRZSA-N 1 2 317.458 4.298 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](C)c2ccc(SCC)cc2)n1 ZINC000182112078 1054961615 /nfs/dbraw/zinc/96/16/15/1054961615.db2.gz WNOZFTIYNCXAEU-CYBMUJFWSA-N 1 2 319.474 4.375 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)no2)cc1 ZINC000182131416 1054962852 /nfs/dbraw/zinc/96/28/52/1054962852.db2.gz JDHCTXSHIHXUCY-GFCCVEGCSA-N 1 2 319.474 4.330 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2cn[nH]c2)c2ccccc2Cl)cc1 ZINC000624217156 1054975411 /nfs/dbraw/zinc/97/54/11/1054975411.db2.gz FDAJKSFYAHAFRP-QGZVFWFLSA-N 1 2 315.779 4.081 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nnc(Cc3ccccc3C)o2)cc1 ZINC000182319055 1054980489 /nfs/dbraw/zinc/98/04/89/1054980489.db2.gz OWIHYZSVNOIWLL-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](CC)c2c(C)noc2C)cs1 ZINC000182404407 1054984760 /nfs/dbraw/zinc/98/47/60/1054984760.db2.gz FQMOHDZMBLYLJK-CQSZACIVSA-N 1 2 307.463 4.331 20 0 DIADLO CCO[C@@H](C)c1nc(C[NH2+][C@@H](CC)c2c(C)noc2C)cs1 ZINC000182407264 1054985610 /nfs/dbraw/zinc/98/56/10/1054985610.db2.gz CXNHWEFSCYENMV-JSGCOSHPSA-N 1 2 323.462 4.086 20 0 DIADLO CC[C@H]([NH2+]Cc1ncc(Cl)cc1Cl)c1c(C)noc1C ZINC000182518911 1054994190 /nfs/dbraw/zinc/99/41/90/1054994190.db2.gz KMNQFYRIXAQIEP-LBPRGKRZSA-N 1 2 314.216 4.234 20 0 DIADLO CN(C)c1cc(-c2cc(Cl)cc(C(F)(F)F)c2)cc[nH+]1 ZINC001236204183 1054997351 /nfs/dbraw/zinc/99/73/51/1054997351.db2.gz ZSTBTLDFVCMDCY-UHFFFAOYSA-N 1 2 300.711 4.487 20 0 DIADLO COc1ccccc1[C@@H](C)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000182909219 1055017338 /nfs/dbraw/zinc/01/73/38/1055017338.db2.gz ZOZLVJYLICXYRY-CYBMUJFWSA-N 1 2 311.360 4.193 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C)c1nccn1C ZINC000183117655 1055030413 /nfs/dbraw/zinc/03/04/13/1055030413.db2.gz XORIUPQTKZXTFX-IAQYHMDHSA-N 1 2 307.388 4.136 20 0 DIADLO CCCc1noc(C[NH2+][C@H](CC(C)C)c2ccccc2C)n1 ZINC000183235932 1055036254 /nfs/dbraw/zinc/03/62/54/1055036254.db2.gz QFLBFSDIICPNDX-MRXNPFEDSA-N 1 2 301.434 4.208 20 0 DIADLO FC(F)(F)c1nn(CCSc2ccccc2)c2cc[nH+]cc21 ZINC000183282218 1055039877 /nfs/dbraw/zinc/03/98/77/1055039877.db2.gz QWAWSFKQNJDWFQ-UHFFFAOYSA-N 1 2 323.343 4.242 20 0 DIADLO Cc1cccc(-c2cccc(Cl)c2C[NH+]2CCOCC2)c1C ZINC001236265430 1055044562 /nfs/dbraw/zinc/04/45/62/1055044562.db2.gz GIOKCFMTFZSKFG-UHFFFAOYSA-N 1 2 315.844 4.456 20 0 DIADLO CCc1ccccc1-c1cccc(Cl)c1C[NH+]1CCOCC1 ZINC001236267866 1055044995 /nfs/dbraw/zinc/04/49/95/1055044995.db2.gz XXGUNPXHKYMFSK-UHFFFAOYSA-N 1 2 315.844 4.402 20 0 DIADLO C=Cc1ccccc1-c1cccc(Cl)c1C[NH+]1CCOCC1 ZINC001236266579 1055046203 /nfs/dbraw/zinc/04/62/03/1055046203.db2.gz FDAGCCBXBAEPFY-UHFFFAOYSA-N 1 2 313.828 4.482 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@H+](C)Cc1cccnc1 ZINC000183657898 1055052053 /nfs/dbraw/zinc/05/20/53/1055052053.db2.gz JAVRHHSFTKVLKL-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@@H+](C)Cc1cccnc1 ZINC000183657898 1055052066 /nfs/dbraw/zinc/05/20/66/1055052066.db2.gz JAVRHHSFTKVLKL-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Nc1ccc(-c2cc(F)c(OCc3ccccc3)c(F)c2)c[nH+]1 ZINC001236312964 1055054433 /nfs/dbraw/zinc/05/44/33/1055054433.db2.gz DMLWSQGARDECTG-UHFFFAOYSA-N 1 2 312.319 4.188 20 0 DIADLO Cc1cn2cc(NC(=O)[C@H]3CCC[C@H]3c3ccccc3)ccc2[nH+]1 ZINC001536223071 1055062477 /nfs/dbraw/zinc/06/24/77/1055062477.db2.gz IWHMZWDQHPMZFC-ROUUACIJSA-N 1 2 319.408 4.165 20 0 DIADLO O=C(Nc1ccc(-c2cccc3[nH+]ccn32)cc1)c1ccccc1 ZINC001236333488 1055062583 /nfs/dbraw/zinc/06/25/83/1055062583.db2.gz HYNVXEKUXLRJCC-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2cc(-c3ccc(C)cc3)no2)n1 ZINC000184158270 1055069521 /nfs/dbraw/zinc/06/95/21/1055069521.db2.gz KVWFKCZXJVQOTQ-CYBMUJFWSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1c(-c2ccc(F)c(OC(C)C)c2F)ccc2[nH+]ccn21 ZINC001236367449 1055076726 /nfs/dbraw/zinc/07/67/26/1055076726.db2.gz QSQKXGIKQMJJHP-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO COc1cc(OC(F)(F)F)ccc1-c1cc(C)cn2cc[nH+]c12 ZINC001236383242 1055086630 /nfs/dbraw/zinc/08/66/30/1055086630.db2.gz SPLUMAHOMNUUDX-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)n1 ZINC000193310039 1055101722 /nfs/dbraw/zinc/10/17/22/1055101722.db2.gz MRTWXECKIAGGHN-OAHLLOKOSA-N 1 2 305.809 4.087 20 0 DIADLO COc1nc(C(C)C)ccc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001236448417 1055119176 /nfs/dbraw/zinc/11/91/76/1055119176.db2.gz VVELSHYLDGJQQG-UHFFFAOYSA-N 1 2 320.383 4.220 20 0 DIADLO CCOc1ncc(Cl)cc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001236495719 1055147697 /nfs/dbraw/zinc/14/76/97/1055147697.db2.gz SVBICLRMEYLEGL-UHFFFAOYSA-N 1 2 313.788 4.201 20 0 DIADLO CCOc1ccc(C)c(F)c1-c1cc(N2CCCC2)cc[nH+]1 ZINC001236520354 1055158312 /nfs/dbraw/zinc/15/83/12/1055158312.db2.gz XOBHXBASDSFECC-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO CCOc1ccc(C)c(F)c1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001236536551 1055166398 /nfs/dbraw/zinc/16/63/98/1055166398.db2.gz DIFIWOSBLAZLRJ-UHFFFAOYSA-N 1 2 310.372 4.445 20 0 DIADLO Cc1c(-c2cncc(OCc3ccccc3)c2)ccc2[nH+]ccn21 ZINC001236572218 1055194009 /nfs/dbraw/zinc/19/40/09/1055194009.db2.gz ATAYRNSMTZSBHB-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO Cc1cn2cc(-c3cncc(OCc4ccccc4)c3)ccc2[nH+]1 ZINC001236572663 1055195589 /nfs/dbraw/zinc/19/55/89/1055195589.db2.gz BOZALDOAHRNGLR-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1c(Br)ccnc1Cl ZINC001236587713 1055200719 /nfs/dbraw/zinc/20/07/19/1055200719.db2.gz CNWJQQCSBUOAOB-SNVBAGLBSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1c(Br)ccnc1Cl ZINC001236587713 1055200729 /nfs/dbraw/zinc/20/07/29/1055200729.db2.gz CNWJQQCSBUOAOB-SNVBAGLBSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1c(Br)ccnc1Cl ZINC001236587703 1055200835 /nfs/dbraw/zinc/20/08/35/1055200835.db2.gz CNWJQQCSBUOAOB-JTQLQIEISA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1c(Br)ccnc1Cl ZINC001236587703 1055200845 /nfs/dbraw/zinc/20/08/45/1055200845.db2.gz CNWJQQCSBUOAOB-JTQLQIEISA-N 1 2 317.658 4.262 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(Br)ccnc2Cl)[C@H](C)C1 ZINC001236598382 1055201131 /nfs/dbraw/zinc/20/11/31/1055201131.db2.gz QHCDUIQJTUNOLW-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(Br)ccnc2Cl)[C@H](C)C1 ZINC001236598382 1055201144 /nfs/dbraw/zinc/20/11/44/1055201144.db2.gz QHCDUIQJTUNOLW-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2c(Br)ccnc2Cl)[C@H]1C ZINC001236598868 1055202143 /nfs/dbraw/zinc/20/21/43/1055202143.db2.gz RTQLYTBDHVOICO-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2c(Br)ccnc2Cl)[C@H]1C ZINC001236598868 1055202156 /nfs/dbraw/zinc/20/21/56/1055202156.db2.gz RTQLYTBDHVOICO-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[NH+]1CCC(C(F)F)CC1 ZINC001236608226 1055203929 /nfs/dbraw/zinc/20/39/29/1055203929.db2.gz OISUMTARCUPVLS-UHFFFAOYSA-N 1 2 309.187 4.174 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@@H+]1CCC[C@@H](C(F)F)C1 ZINC001236608523 1055203941 /nfs/dbraw/zinc/20/39/41/1055203941.db2.gz RDBSSKYPDKDYPM-SECBINFHSA-N 1 2 309.187 4.174 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@H+]1CCC[C@@H](C(F)F)C1 ZINC001236608523 1055203951 /nfs/dbraw/zinc/20/39/51/1055203951.db2.gz RDBSSKYPDKDYPM-SECBINFHSA-N 1 2 309.187 4.174 20 0 DIADLO Cc1c(Br)cccc1C[N@@H+]1CCC[C@](C)(F)C1 ZINC001236613474 1055206932 /nfs/dbraw/zinc/20/69/32/1055206932.db2.gz PZSFITIZYYHPTD-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1c(Br)cccc1C[N@H+]1CCC[C@](C)(F)C1 ZINC001236613474 1055206940 /nfs/dbraw/zinc/20/69/40/1055206940.db2.gz PZSFITIZYYHPTD-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO C[C@@]1(F)CCC[N@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)CC1 ZINC001236618616 1055207080 /nfs/dbraw/zinc/20/70/80/1055207080.db2.gz GULAENLCWDAIAZ-CYBMUJFWSA-N 1 2 324.749 4.468 20 0 DIADLO C[C@@]1(F)CCC[N@@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)CC1 ZINC001236618616 1055207084 /nfs/dbraw/zinc/20/70/84/1055207084.db2.gz GULAENLCWDAIAZ-CYBMUJFWSA-N 1 2 324.749 4.468 20 0 DIADLO COc1ccc2sc(C[N@@H+]3CCC(F)(F)[C@@H](F)C3)cc2c1 ZINC001236656713 1055214323 /nfs/dbraw/zinc/21/43/23/1055214323.db2.gz WBFITWOXOWXVBE-AWEZNQCLSA-N 1 2 315.360 4.089 20 0 DIADLO COc1ccc2sc(C[N@H+]3CCC(F)(F)[C@@H](F)C3)cc2c1 ZINC001236656713 1055214335 /nfs/dbraw/zinc/21/43/35/1055214335.db2.gz WBFITWOXOWXVBE-AWEZNQCLSA-N 1 2 315.360 4.089 20 0 DIADLO CC1(C)C[NH+](Cc2ccc(C(F)(F)F)c(Br)c2)C1 ZINC001236716333 1055240180 /nfs/dbraw/zinc/24/01/80/1055240180.db2.gz VPLWZMLRCGWJOF-UHFFFAOYSA-N 1 2 322.168 4.310 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2ccc(O)cc2OC(F)(F)F)C1 ZINC001236721878 1055241003 /nfs/dbraw/zinc/24/10/03/1055241003.db2.gz LZXNGKMMTYXXKK-CQSZACIVSA-N 1 2 321.314 4.005 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2ccc(O)cc2OC(F)(F)F)C1 ZINC001236721878 1055241015 /nfs/dbraw/zinc/24/10/15/1055241015.db2.gz LZXNGKMMTYXXKK-CQSZACIVSA-N 1 2 321.314 4.005 20 0 DIADLO C[C@H]1CC[N@@H+]1Cc1cccc(C(F)(F)F)c1Br ZINC001236728097 1055245697 /nfs/dbraw/zinc/24/56/97/1055245697.db2.gz WXGYYSGCAOWBIR-QMMMGPOBSA-N 1 2 308.141 4.062 20 0 DIADLO C[C@H]1CC[N@H+]1Cc1cccc(C(F)(F)F)c1Br ZINC001236728097 1055245711 /nfs/dbraw/zinc/24/57/11/1055245711.db2.gz WXGYYSGCAOWBIR-QMMMGPOBSA-N 1 2 308.141 4.062 20 0 DIADLO Cc1cccc(C)c1-c1cccc(C[N@@H+]2CCn3cncc3C2)c1 ZINC001236815584 1055274006 /nfs/dbraw/zinc/27/40/06/1055274006.db2.gz RFBVOHDJTWRGAS-UHFFFAOYSA-N 1 2 317.436 4.183 20 0 DIADLO Cc1cccc(C)c1-c1cccc(C[N@H+]2CCn3cncc3C2)c1 ZINC001236815584 1055274021 /nfs/dbraw/zinc/27/40/21/1055274021.db2.gz RFBVOHDJTWRGAS-UHFFFAOYSA-N 1 2 317.436 4.183 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c(F)cc1F ZINC001236830527 1055278845 /nfs/dbraw/zinc/27/88/45/1055278845.db2.gz JQNQFYNHRNSMRF-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c(F)cc1F ZINC001236830527 1055278861 /nfs/dbraw/zinc/27/88/61/1055278861.db2.gz JQNQFYNHRNSMRF-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cccc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c1Cl ZINC001236851046 1055292404 /nfs/dbraw/zinc/29/24/04/1055292404.db2.gz BJQWKKYJZMZOOL-KRWDZBQOSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1cccc(C[N@H+]2CCO[C@H](c3ccccc3)C2)c1Cl ZINC001236851046 1055292420 /nfs/dbraw/zinc/29/24/20/1055292420.db2.gz BJQWKKYJZMZOOL-KRWDZBQOSA-N 1 2 301.817 4.222 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)CCC2 ZINC000764939853 1055295768 /nfs/dbraw/zinc/29/57/68/1055295768.db2.gz MNKWTLZSJVVDAJ-SJCJKPOMSA-N 1 2 319.399 4.470 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1cc2sccc2nc1Cl ZINC001236861565 1055295872 /nfs/dbraw/zinc/29/58/72/1055295872.db2.gz UJUHTGXWJWWIHZ-UHFFFAOYSA-N 1 2 317.845 4.367 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1cc2sccc2nc1Cl ZINC001236861565 1055295880 /nfs/dbraw/zinc/29/58/80/1055295880.db2.gz UJUHTGXWJWWIHZ-UHFFFAOYSA-N 1 2 317.845 4.367 20 0 DIADLO CCOc1ccc(CNc2ccc([NH+](C)C)cc2C)cc1F ZINC000785431790 1055313008 /nfs/dbraw/zinc/31/30/08/1055313008.db2.gz LOXVYVADTYEYBF-UHFFFAOYSA-N 1 2 302.393 4.211 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2ccc(-c3ccccc3F)nc2)C[C@H]1F ZINC001236987378 1055324395 /nfs/dbraw/zinc/32/43/95/1055324395.db2.gz LGDRBMMAVTWDPG-MSOLQXFVSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2ccc(-c3ccccc3F)nc2)C[C@H]1F ZINC001236987378 1055324407 /nfs/dbraw/zinc/32/44/07/1055324407.db2.gz LGDRBMMAVTWDPG-MSOLQXFVSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2ccc(-c3ccccc3F)nc2)C[C@@H]1F ZINC001236987383 1055326062 /nfs/dbraw/zinc/32/60/62/1055326062.db2.gz LGDRBMMAVTWDPG-ZWKOTPCHSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2ccc(-c3ccccc3F)nc2)C[C@@H]1F ZINC001236987383 1055326076 /nfs/dbraw/zinc/32/60/76/1055326076.db2.gz LGDRBMMAVTWDPG-ZWKOTPCHSA-N 1 2 320.358 4.160 20 0 DIADLO CC(C)(C)Oc1ccccc1C[N@@H+]1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001237026116 1055341668 /nfs/dbraw/zinc/34/16/68/1055341668.db2.gz KSBXZLHJRDYPED-IRXDYDNUSA-N 1 2 315.457 4.198 20 0 DIADLO CC(C)(C)Oc1ccccc1C[N@H+]1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001237026116 1055341675 /nfs/dbraw/zinc/34/16/75/1055341675.db2.gz KSBXZLHJRDYPED-IRXDYDNUSA-N 1 2 315.457 4.198 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@@H](C)c3cc(F)ccc3C)ccn12 ZINC001537549513 1055356985 /nfs/dbraw/zinc/35/69/85/1055356985.db2.gz NKOALNWKMUHONL-ZDUSSCGKSA-N 1 2 312.344 4.008 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1cnc(-c2ccco2)s1 ZINC000785432304 1055380302 /nfs/dbraw/zinc/38/03/02/1055380302.db2.gz VSCUATVBZXNLDF-UHFFFAOYSA-N 1 2 313.426 4.390 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H](C)c1cccc(CC(C)C)c1 ZINC001537609574 1055380284 /nfs/dbraw/zinc/38/02/84/1055380284.db2.gz KPPRWCORIKJMCS-MRXNPFEDSA-N 1 2 310.441 4.061 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccnc2c(Cl)cccc12 ZINC001237152422 1055388341 /nfs/dbraw/zinc/38/83/41/1055388341.db2.gz OLHJCNJHNYVOTR-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccnc2c(Cl)cccc12 ZINC001237152422 1055388350 /nfs/dbraw/zinc/38/83/50/1055388350.db2.gz OLHJCNJHNYVOTR-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO CC[N@H+](Cc1c(Br)cccc1OC(F)F)C1CC1 ZINC001237250382 1055410307 /nfs/dbraw/zinc/41/03/07/1055410307.db2.gz KWIUITFFGZTCHG-UHFFFAOYSA-N 1 2 320.177 4.035 20 0 DIADLO CC[N@@H+](Cc1c(Br)cccc1OC(F)F)C1CC1 ZINC001237250382 1055410314 /nfs/dbraw/zinc/41/03/14/1055410314.db2.gz KWIUITFFGZTCHG-UHFFFAOYSA-N 1 2 320.177 4.035 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2cc(C)on2)ccc1C(F)F ZINC001237276060 1055415880 /nfs/dbraw/zinc/41/58/80/1055415880.db2.gz JESIRQLOLXPYDO-OAHLLOKOSA-N 1 2 322.355 4.266 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2cc(C)on2)ccc1C(F)F ZINC001237276060 1055415885 /nfs/dbraw/zinc/41/58/85/1055415885.db2.gz JESIRQLOLXPYDO-OAHLLOKOSA-N 1 2 322.355 4.266 20 0 DIADLO C[N@H+](Cc1ccc(F)cc1F)Cc1ccncc1C(F)(F)F ZINC001237295899 1055420867 /nfs/dbraw/zinc/42/08/67/1055420867.db2.gz UCGZLSPOCLEIDK-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO C[N@@H+](Cc1ccc(F)cc1F)Cc1ccncc1C(F)(F)F ZINC001237295899 1055420875 /nfs/dbraw/zinc/42/08/75/1055420875.db2.gz UCGZLSPOCLEIDK-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CCc3ccc(Cl)cc3)cc2[nH+]1 ZINC000010896766 1055424955 /nfs/dbraw/zinc/42/49/55/1055424955.db2.gz QCPMBJATVSPSEL-UHFFFAOYSA-N 1 2 313.788 4.096 20 0 DIADLO Cc1ccc(Cl)c(C[NH+]2CC3(C2)C[C@H](F)CS3)c1Cl ZINC001237332020 1055429744 /nfs/dbraw/zinc/42/97/44/1055429744.db2.gz QMLITMWDIYCEER-JTQLQIEISA-N 1 2 320.260 4.331 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cnc(Cl)c(F)c2)c1 ZINC001237403127 1055446906 /nfs/dbraw/zinc/44/69/06/1055446906.db2.gz DICOOMBLSXDAOG-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2cnc(Cl)c(F)c2)c1 ZINC001237403127 1055446916 /nfs/dbraw/zinc/44/69/16/1055446916.db2.gz DICOOMBLSXDAOG-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO Clc1cccc([C@H]2CCC[N@@H+]2Cc2cc3ccccn3n2)c1 ZINC001237448654 1055453449 /nfs/dbraw/zinc/45/34/49/1055453449.db2.gz ICSJNVMWYNXLDZ-GOSISDBHSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1cccc([C@H]2CCC[N@H+]2Cc2cc3ccccn3n2)c1 ZINC001237448654 1055453452 /nfs/dbraw/zinc/45/34/52/1055453452.db2.gz ICSJNVMWYNXLDZ-GOSISDBHSA-N 1 2 311.816 4.325 20 0 DIADLO Cc1ccccc1NC(=O)[C@H](C)[N@H+](C)Cc1ccc(Cl)s1 ZINC000016343301 1055455155 /nfs/dbraw/zinc/45/51/55/1055455155.db2.gz AXEFRWOCJALIQE-LBPRGKRZSA-N 1 2 322.861 4.169 20 0 DIADLO Cc1ccccc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccc(Cl)s1 ZINC000016343301 1055455166 /nfs/dbraw/zinc/45/51/66/1055455166.db2.gz AXEFRWOCJALIQE-LBPRGKRZSA-N 1 2 322.861 4.169 20 0 DIADLO COC(=O)c1ccc2c(c1)C[N@@H+](Cc1cccc(C(C)C)c1)C2 ZINC001237460731 1055455952 /nfs/dbraw/zinc/45/59/52/1055455952.db2.gz XAIRJOLNHPMJMF-UHFFFAOYSA-N 1 2 309.409 4.112 20 0 DIADLO COC(=O)c1ccc2c(c1)C[N@H+](Cc1cccc(C(C)C)c1)C2 ZINC001237460731 1055455955 /nfs/dbraw/zinc/45/59/55/1055455955.db2.gz XAIRJOLNHPMJMF-UHFFFAOYSA-N 1 2 309.409 4.112 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Cl)nc(C(F)(F)F)c2)C2(CC2)C1 ZINC001237500875 1055462671 /nfs/dbraw/zinc/46/26/71/1055462671.db2.gz KIUFTMFGKRBZRA-VIFPVBQESA-N 1 2 304.743 4.128 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Cl)nc(C(F)(F)F)c2)C2(CC2)C1 ZINC001237500875 1055462677 /nfs/dbraw/zinc/46/26/77/1055462677.db2.gz KIUFTMFGKRBZRA-VIFPVBQESA-N 1 2 304.743 4.128 20 0 DIADLO Cc1cccn2c(CNc3ccc(OC(C)C)c(C)c3)c[nH+]c12 ZINC001620841241 1055468630 /nfs/dbraw/zinc/46/86/30/1055468630.db2.gz WLQMRXIWWMCUDD-UHFFFAOYSA-N 1 2 309.413 4.350 20 0 DIADLO CCCCCOc1ccc(CNc2ccc(N(C)C)c[nH+]2)cc1 ZINC001620844418 1055472208 /nfs/dbraw/zinc/47/22/08/1055472208.db2.gz SAZCCTAOLRDSCB-UHFFFAOYSA-N 1 2 313.445 4.329 20 0 DIADLO CC[N@H+](CC(=O)Nc1ccc(C)cc1)Cc1ccc(Cl)s1 ZINC000018936086 1055473005 /nfs/dbraw/zinc/47/30/05/1055473005.db2.gz RGKAWLHHGRCUAG-UHFFFAOYSA-N 1 2 322.861 4.171 20 0 DIADLO CC[N@@H+](CC(=O)Nc1ccc(C)cc1)Cc1ccc(Cl)s1 ZINC000018936086 1055473013 /nfs/dbraw/zinc/47/30/13/1055473013.db2.gz RGKAWLHHGRCUAG-UHFFFAOYSA-N 1 2 322.861 4.171 20 0 DIADLO F[C@H]1C[N@H+](Cc2cccc(-c3ccccc3)n2)CCCC1(F)F ZINC001237542810 1055473244 /nfs/dbraw/zinc/47/32/44/1055473244.db2.gz PPCOGTXKJFEXRS-KRWDZBQOSA-N 1 2 320.358 4.318 20 0 DIADLO F[C@H]1C[N@@H+](Cc2cccc(-c3ccccc3)n2)CCCC1(F)F ZINC001237542810 1055473251 /nfs/dbraw/zinc/47/32/51/1055473251.db2.gz PPCOGTXKJFEXRS-KRWDZBQOSA-N 1 2 320.358 4.318 20 0 DIADLO CN(C)c1ccc(NCc2ccccc2-c2ccccc2)[nH+]c1 ZINC001620844412 1055473431 /nfs/dbraw/zinc/47/34/31/1055473431.db2.gz RRBNRPDZHBTLEB-UHFFFAOYSA-N 1 2 303.409 4.427 20 0 DIADLO Fc1cccc(F)c1CNc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001620846131 1055475308 /nfs/dbraw/zinc/47/53/08/1055475308.db2.gz ZWSBQEXZBWKVBJ-UHFFFAOYSA-N 1 2 319.742 4.416 20 0 DIADLO COc1ccc(OC)c(C[N@H+](C)Cc2ccc(C)c(C)c2)c1F ZINC001237573645 1055475716 /nfs/dbraw/zinc/47/57/16/1055475716.db2.gz BJOHYXZUFRSPDC-UHFFFAOYSA-N 1 2 317.404 4.092 20 0 DIADLO COc1ccc(OC)c(C[N@@H+](C)Cc2ccc(C)c(C)c2)c1F ZINC001237573645 1055475723 /nfs/dbraw/zinc/47/57/23/1055475723.db2.gz BJOHYXZUFRSPDC-UHFFFAOYSA-N 1 2 317.404 4.092 20 0 DIADLO Cc1cc(F)c(CNc2ccc(-n3cc[nH+]c3)c(F)c2)c(F)c1 ZINC001620849235 1055477382 /nfs/dbraw/zinc/47/73/82/1055477382.db2.gz XMXHSSXXBYWJJI-UHFFFAOYSA-N 1 2 317.314 4.210 20 0 DIADLO F[C@H]1CC[N@H+](Cc2sc3ccccc3c2Br)C1 ZINC001237587780 1055479594 /nfs/dbraw/zinc/47/95/94/1055479594.db2.gz IZBFWUROGQFWNE-VIFPVBQESA-N 1 2 314.223 4.208 20 0 DIADLO F[C@H]1CC[N@@H+](Cc2sc3ccccc3c2Br)C1 ZINC001237587780 1055479600 /nfs/dbraw/zinc/47/96/00/1055479600.db2.gz IZBFWUROGQFWNE-VIFPVBQESA-N 1 2 314.223 4.208 20 0 DIADLO CSC1CC[NH+](Cc2c(Cl)cc(F)cc2Cl)CC1 ZINC001237598695 1055482282 /nfs/dbraw/zinc/48/22/82/1055482282.db2.gz LVRCVXBIUXYWDY-UHFFFAOYSA-N 1 2 308.249 4.460 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3CC[C@H](C)CC3)cc2)[nH+]c1C ZINC001589439088 1055484615 /nfs/dbraw/zinc/48/46/15/1055484615.db2.gz XTRJSFGYMMFDDR-YGUOUDRMSA-N 1 2 311.429 4.458 20 0 DIADLO CCOc1cc(F)cc(CNc2cc(CSCC)cc[nH+]2)c1 ZINC001620861180 1055488167 /nfs/dbraw/zinc/48/81/67/1055488167.db2.gz PBGQSKPGUBNPIF-UHFFFAOYSA-N 1 2 320.433 4.485 20 0 DIADLO Oc1ccc(-c2ccc(C[N@@H+]3CCC(F)(F)[C@@H](F)C3)cc2)cc1 ZINC001237658023 1055492778 /nfs/dbraw/zinc/49/27/78/1055492778.db2.gz OTVYACZEXMWAPE-KRWDZBQOSA-N 1 2 321.342 4.238 20 0 DIADLO Oc1ccc(-c2ccc(C[N@H+]3CCC(F)(F)[C@@H](F)C3)cc2)cc1 ZINC001237658023 1055492785 /nfs/dbraw/zinc/49/27/85/1055492785.db2.gz OTVYACZEXMWAPE-KRWDZBQOSA-N 1 2 321.342 4.238 20 0 DIADLO CCc1n[nH]cc1C[N@H+](C)Cc1sc2ccccc2c1Cl ZINC001237653161 1055493068 /nfs/dbraw/zinc/49/30/68/1055493068.db2.gz CCBMCNDAUFPESG-UHFFFAOYSA-N 1 2 319.861 4.472 20 0 DIADLO CCc1n[nH]cc1C[N@@H+](C)Cc1sc2ccccc2c1Cl ZINC001237653161 1055493075 /nfs/dbraw/zinc/49/30/75/1055493075.db2.gz CCBMCNDAUFPESG-UHFFFAOYSA-N 1 2 319.861 4.472 20 0 DIADLO CCc1[nH]ncc1C[NH+]1CCC(c2ccccc2Cl)CC1 ZINC001237652966 1055493570 /nfs/dbraw/zinc/49/35/70/1055493570.db2.gz HOLWCKMGOOKCFU-UHFFFAOYSA-N 1 2 303.837 4.005 20 0 DIADLO C[N@H+](Cc1ccon1)Cc1cccc(-c2ccc(F)cc2F)c1 ZINC001237666230 1055500280 /nfs/dbraw/zinc/50/02/80/1055500280.db2.gz AICBCPUVUCVVHD-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1ccon1)Cc1cccc(-c2ccc(F)cc2F)c1 ZINC001237666230 1055500293 /nfs/dbraw/zinc/50/02/93/1055500293.db2.gz AICBCPUVUCVVHD-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO Cc1cc(C)c(Cl)c(C[N@@H+]2CCC[C@H]2c2ncccn2)c1 ZINC001237704512 1055509280 /nfs/dbraw/zinc/50/92/80/1055509280.db2.gz ITOHLNCNEHYBTD-HNNXBMFYSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C)c(Cl)c(C[N@H+]2CCC[C@H]2c2ncccn2)c1 ZINC001237704512 1055509293 /nfs/dbraw/zinc/50/92/93/1055509293.db2.gz ITOHLNCNEHYBTD-HNNXBMFYSA-N 1 2 301.821 4.084 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1cc(F)c(F)c(F)c1 ZINC001620887122 1055512059 /nfs/dbraw/zinc/51/20/59/1055512059.db2.gz NMTRWFUQPLGSIP-UHFFFAOYSA-N 1 2 310.319 4.288 20 0 DIADLO CCc1cc(C[N@@H+]2CCc3nc(C)sc3C2)ccc1Cl ZINC001237740102 1055517777 /nfs/dbraw/zinc/51/77/77/1055517777.db2.gz NZHDWDKUUSYGHM-UHFFFAOYSA-N 1 2 306.862 4.226 20 0 DIADLO CCc1cc(C[N@H+]2CCc3nc(C)sc3C2)ccc1Cl ZINC001237740102 1055517790 /nfs/dbraw/zinc/51/77/90/1055517790.db2.gz NZHDWDKUUSYGHM-UHFFFAOYSA-N 1 2 306.862 4.226 20 0 DIADLO CCc1cc(C[N@@H+]2CCC(=O)[C@@H]3CCCC[C@H]32)ccc1Cl ZINC001237739431 1055518515 /nfs/dbraw/zinc/51/85/15/1055518515.db2.gz YGSPELGQUQLDAI-NVXWUHKLSA-N 1 2 305.849 4.236 20 0 DIADLO CCc1cc(C[N@H+]2CCC(=O)[C@@H]3CCCC[C@H]32)ccc1Cl ZINC001237739431 1055518529 /nfs/dbraw/zinc/51/85/29/1055518529.db2.gz YGSPELGQUQLDAI-NVXWUHKLSA-N 1 2 305.849 4.236 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ncc(Cl)cc2Br)[C@@H](C)C1 ZINC001237761467 1055525073 /nfs/dbraw/zinc/52/50/73/1055525073.db2.gz VTFQDJYTTMIHQK-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ncc(Cl)cc2Br)[C@@H](C)C1 ZINC001237761467 1055525088 /nfs/dbraw/zinc/52/50/88/1055525088.db2.gz VTFQDJYTTMIHQK-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ncc(Cl)cc2Br)[C@@H]1C ZINC001237758242 1055525175 /nfs/dbraw/zinc/52/51/75/1055525175.db2.gz MXOMDOANZBNZBQ-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ncc(Cl)cc2Br)[C@@H]1C ZINC001237758242 1055525190 /nfs/dbraw/zinc/52/51/90/1055525190.db2.gz MXOMDOANZBNZBQ-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ncc(Cl)cc2Br)[C@H]1C ZINC001237758245 1055526475 /nfs/dbraw/zinc/52/64/75/1055526475.db2.gz MXOMDOANZBNZBQ-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ncc(Cl)cc2Br)[C@H]1C ZINC001237758245 1055526490 /nfs/dbraw/zinc/52/64/90/1055526490.db2.gz MXOMDOANZBNZBQ-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO CC1(C)CC[NH+](Cc2ncc(Cl)cc2Br)CC1 ZINC001237757204 1055526683 /nfs/dbraw/zinc/52/66/83/1055526683.db2.gz CZLFRZQHKAEATQ-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(-c3cccc(Cl)c3)no2)C[C@H]1F ZINC001237768479 1055527888 /nfs/dbraw/zinc/52/78/88/1055527888.db2.gz VRFJQYQVBHJNQE-IAQYHMDHSA-N 1 2 308.784 4.175 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(-c3cccc(Cl)c3)no2)C[C@H]1F ZINC001237768479 1055527894 /nfs/dbraw/zinc/52/78/94/1055527894.db2.gz VRFJQYQVBHJNQE-IAQYHMDHSA-N 1 2 308.784 4.175 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cnc(CC)s1 ZINC001237830778 1055541843 /nfs/dbraw/zinc/54/18/43/1055541843.db2.gz PTAUKDPDJFFKII-INIZCTEOSA-N 1 2 316.470 4.189 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cnc(CC)s1 ZINC001237830778 1055541853 /nfs/dbraw/zinc/54/18/53/1055541853.db2.gz PTAUKDPDJFFKII-INIZCTEOSA-N 1 2 316.470 4.189 20 0 DIADLO CCCOc1cccc(C[NH2+]Cc2nc(C(C)(C)C)co2)c1 ZINC000921548352 1055543288 /nfs/dbraw/zinc/54/32/88/1055543288.db2.gz IGHVGSGKGBYXAI-UHFFFAOYSA-N 1 2 302.418 4.051 20 0 DIADLO CC(C)COc1ccc(C[NH2+]Cc2nc(C(C)(C)C)co2)cc1 ZINC000921564693 1055567249 /nfs/dbraw/zinc/56/72/49/1055567249.db2.gz VDHYLRWTCGABGM-UHFFFAOYSA-N 1 2 316.445 4.297 20 0 DIADLO Cc1sccc1C[N@H+](Cc1cccnc1)Cc1ccccn1 ZINC001237965371 1055567962 /nfs/dbraw/zinc/56/79/62/1055567962.db2.gz DBXBNHNNWZHCFN-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1sccc1C[N@@H+](Cc1cccnc1)Cc1ccccn1 ZINC001237965371 1055567970 /nfs/dbraw/zinc/56/79/70/1055567970.db2.gz DBXBNHNNWZHCFN-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1csc(-c2ccc(O)cc2)n1 ZINC001237981264 1055573267 /nfs/dbraw/zinc/57/32/67/1055573267.db2.gz QVDABIUHTSNBGO-UHFFFAOYSA-N 1 2 316.451 4.209 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1csc(-c2ccc(O)cc2)n1 ZINC001237981264 1055573274 /nfs/dbraw/zinc/57/32/74/1055573274.db2.gz QVDABIUHTSNBGO-UHFFFAOYSA-N 1 2 316.451 4.209 20 0 DIADLO Oc1ccc(-c2nc(C[N@@H+]3CCc4ccccc4C3)cs2)cc1 ZINC001237978659 1055573846 /nfs/dbraw/zinc/57/38/46/1055573846.db2.gz XSZRAVWXAMVTOV-UHFFFAOYSA-N 1 2 322.433 4.074 20 0 DIADLO Oc1ccc(-c2nc(C[N@H+]3CCc4ccccc4C3)cs2)cc1 ZINC001237978659 1055573858 /nfs/dbraw/zinc/57/38/58/1055573858.db2.gz XSZRAVWXAMVTOV-UHFFFAOYSA-N 1 2 322.433 4.074 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2csc(-c3ccc(O)cc3)n2)C1 ZINC001237985016 1055574824 /nfs/dbraw/zinc/57/48/24/1055574824.db2.gz HWYWROATEDPMDT-QGZVFWFLSA-N 1 2 320.433 4.230 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2csc(-c3ccc(O)cc3)n2)C1 ZINC001237985016 1055574834 /nfs/dbraw/zinc/57/48/34/1055574834.db2.gz HWYWROATEDPMDT-QGZVFWFLSA-N 1 2 320.433 4.230 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2cc(F)c(O)c(Cl)c2)cc1 ZINC001237994208 1055576719 /nfs/dbraw/zinc/57/67/19/1055576719.db2.gz CWVMAYLWNHOVTC-UHFFFAOYSA-N 1 2 307.796 4.379 20 0 DIADLO C[N@H+](CC/C=C/c1cccnc1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237992984 1055577656 /nfs/dbraw/zinc/57/76/56/1055577656.db2.gz OAVRPFDHGHOWIO-GORDUTHDSA-N 1 2 320.795 4.115 20 0 DIADLO C[N@@H+](CC/C=C/c1cccnc1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237992984 1055577675 /nfs/dbraw/zinc/57/76/75/1055577675.db2.gz OAVRPFDHGHOWIO-GORDUTHDSA-N 1 2 320.795 4.115 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cncc(Cl)c2Cl)cc1 ZINC001238005298 1055582323 /nfs/dbraw/zinc/58/23/23/1055582323.db2.gz ILSJUXKWPVNNCL-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cncc(Cl)c2Cl)cc1 ZINC001238005298 1055582326 /nfs/dbraw/zinc/58/23/26/1055582326.db2.gz ILSJUXKWPVNNCL-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1ccsc1C(F)F ZINC001595394962 1055594811 /nfs/dbraw/zinc/59/48/11/1055594811.db2.gz DAKPTFHSRAANRP-UHFFFAOYSA-N 1 2 319.336 4.124 20 0 DIADLO CCOC(=O)c1c(Cl)cccc1C[N@H+](C)Cc1ccsc1 ZINC001238044262 1055595093 /nfs/dbraw/zinc/59/50/93/1055595093.db2.gz MCPSRBJBUAKJNT-UHFFFAOYSA-N 1 2 323.845 4.210 20 0 DIADLO CCOC(=O)c1c(Cl)cccc1C[N@@H+](C)Cc1ccsc1 ZINC001238044262 1055595101 /nfs/dbraw/zinc/59/51/01/1055595101.db2.gz MCPSRBJBUAKJNT-UHFFFAOYSA-N 1 2 323.845 4.210 20 0 DIADLO Fc1cc(Br)c(F)c(C[NH+]2CCC3(CC3)CC2)c1 ZINC001238070988 1055601203 /nfs/dbraw/zinc/60/12/03/1055601203.db2.gz NHKXGLHEMDIENT-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1cc(F)cc(Br)c1F ZINC001238077598 1055602944 /nfs/dbraw/zinc/60/29/44/1055602944.db2.gz YBEWSNYTGXDWLH-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1cc(F)cc(Br)c1F ZINC001238077598 1055602950 /nfs/dbraw/zinc/60/29/50/1055602950.db2.gz YBEWSNYTGXDWLH-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(F)cc(Br)c2F)C2(CC2)C1 ZINC001238083248 1055603645 /nfs/dbraw/zinc/60/36/45/1055603645.db2.gz YYDYXYZRGUPOMA-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(F)cc(Br)c2F)C2(CC2)C1 ZINC001238083248 1055603649 /nfs/dbraw/zinc/60/36/49/1055603649.db2.gz YYDYXYZRGUPOMA-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO COc1cnc(F)c(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)c1 ZINC001238126717 1055608417 /nfs/dbraw/zinc/60/84/17/1055608417.db2.gz QLLDWLGRTOTSBJ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cnc(F)c(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)c1 ZINC001238126717 1055608421 /nfs/dbraw/zinc/60/84/21/1055608421.db2.gz QLLDWLGRTOTSBJ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CCC[N@H+](CCc1ccccn1)Cc1cc(Cl)c(O)cc1F ZINC001238149666 1055612444 /nfs/dbraw/zinc/61/24/44/1055612444.db2.gz LRINURKDVOISNR-UHFFFAOYSA-N 1 2 322.811 4.034 20 0 DIADLO CCC[N@@H+](CCc1ccccn1)Cc1cc(Cl)c(O)cc1F ZINC001238149666 1055612447 /nfs/dbraw/zinc/61/24/47/1055612447.db2.gz LRINURKDVOISNR-UHFFFAOYSA-N 1 2 322.811 4.034 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@@H](c3ccccc3F)C2)cc1Cl ZINC001238153097 1055614321 /nfs/dbraw/zinc/61/43/21/1055614321.db2.gz VLOGCOLTEYYEJU-LLVKDONJSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@@H](c3ccccc3F)C2)cc1Cl ZINC001238153097 1055614325 /nfs/dbraw/zinc/61/43/25/1055614325.db2.gz VLOGCOLTEYYEJU-LLVKDONJSA-N 1 2 323.770 4.313 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2cc(Cl)c(O)cc2F)cc1 ZINC001238150077 1055615671 /nfs/dbraw/zinc/61/56/71/1055615671.db2.gz RFATUIHYAZOKSB-NSHDSACASA-N 1 2 323.795 4.386 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2cc(Cl)c(O)cc2F)cc1 ZINC001238150077 1055615675 /nfs/dbraw/zinc/61/56/75/1055615675.db2.gz RFATUIHYAZOKSB-NSHDSACASA-N 1 2 323.795 4.386 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cncc(C2CC2)c1 ZINC001238195785 1055617129 /nfs/dbraw/zinc/61/71/29/1055617129.db2.gz VCDRUBOVVUNCOX-FQEVSTJZSA-N 1 2 322.452 4.442 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cncc(C2CC2)c1 ZINC001238195785 1055617134 /nfs/dbraw/zinc/61/71/34/1055617134.db2.gz VCDRUBOVVUNCOX-FQEVSTJZSA-N 1 2 322.452 4.442 20 0 DIADLO Fc1ccc(-c2[nH]c3ccc(NCc4cnsc4)cc3[nH+]2)cc1 ZINC001620962089 1055628823 /nfs/dbraw/zinc/62/88/23/1055628823.db2.gz NXYVKNFHUMHDPC-UHFFFAOYSA-N 1 2 324.384 4.438 20 0 DIADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccc(F)c(OCc2ccccc2)c1 ZINC001238338759 1055641804 /nfs/dbraw/zinc/64/18/04/1055641804.db2.gz GKZZYUIJUCOLET-RHSMWYFYSA-N 1 2 317.379 4.337 20 0 DIADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccc(F)c(OCc2ccccc2)c1 ZINC001238338759 1055641818 /nfs/dbraw/zinc/64/18/18/1055641818.db2.gz GKZZYUIJUCOLET-RHSMWYFYSA-N 1 2 317.379 4.337 20 0 DIADLO CCc1cccc(NC(=O)c2c[nH+]ccc2Nc2ccccc2)c1 ZINC001538503910 1055642788 /nfs/dbraw/zinc/64/27/88/1055642788.db2.gz BWAFDNCSFUOQLC-UHFFFAOYSA-N 1 2 317.392 4.062 20 0 DIADLO Fc1cc(C[NH+]2CC(C(F)F)C2)cc(OCc2ccccc2)c1 ZINC001238383661 1055648066 /nfs/dbraw/zinc/64/80/66/1055648066.db2.gz QLUJYHKZOQTOEM-UHFFFAOYSA-N 1 2 321.342 4.102 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccnc(Br)c2Cl)[C@@H](C)C1 ZINC001238386265 1055649643 /nfs/dbraw/zinc/64/96/43/1055649643.db2.gz YFXLJNUZSXICJW-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccnc(Br)c2Cl)[C@@H](C)C1 ZINC001238386265 1055649649 /nfs/dbraw/zinc/64/96/49/1055649649.db2.gz YFXLJNUZSXICJW-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO CCCCC[N@H+](C)Cc1c(Cl)cncc1Br ZINC001238392633 1055651235 /nfs/dbraw/zinc/65/12/35/1055651235.db2.gz ZXRFUSKOBKSPBQ-UHFFFAOYSA-N 1 2 305.647 4.120 20 0 DIADLO CCCCC[N@@H+](C)Cc1c(Cl)cncc1Br ZINC001238392633 1055651241 /nfs/dbraw/zinc/65/12/41/1055651241.db2.gz ZXRFUSKOBKSPBQ-UHFFFAOYSA-N 1 2 305.647 4.120 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3cc(O)ccc3C2)c(Cl)c1 ZINC001238394430 1055651352 /nfs/dbraw/zinc/65/13/52/1055651352.db2.gz JKVQNMMEVBXEIL-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3cc(O)ccc3C2)c(Cl)c1 ZINC001238394430 1055651357 /nfs/dbraw/zinc/65/13/57/1055651357.db2.gz JKVQNMMEVBXEIL-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ccccc2OC)c(Cl)c1 ZINC001238400531 1055651465 /nfs/dbraw/zinc/65/14/65/1055651465.db2.gz SNPIPNHXTGQGHH-UHFFFAOYSA-N 1 2 319.832 4.379 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ccccc2OC)c(Cl)c1 ZINC001238400531 1055651468 /nfs/dbraw/zinc/65/14/68/1055651468.db2.gz SNPIPNHXTGQGHH-UHFFFAOYSA-N 1 2 319.832 4.379 20 0 DIADLO CC(C)[NH+](Cc1c(Cl)cncc1Br)C(C)C ZINC001238389026 1055651761 /nfs/dbraw/zinc/65/17/61/1055651761.db2.gz BGFDWLDABBSYGM-UHFFFAOYSA-N 1 2 305.647 4.116 20 0 DIADLO Cc1cc(C[N@@H+]2CCSC[C@H]2c2ccccc2)ncc1Cl ZINC001238418116 1055653418 /nfs/dbraw/zinc/65/34/18/1055653418.db2.gz LOBLHNQINIRRQN-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(C[N@H+]2CCSC[C@H]2c2ccccc2)ncc1Cl ZINC001238418116 1055653422 /nfs/dbraw/zinc/65/34/22/1055653422.db2.gz LOBLHNQINIRRQN-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cnc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)c(C)c1 ZINC001238426510 1055657283 /nfs/dbraw/zinc/65/72/83/1055657283.db2.gz MXFHTYARIRKWTL-NRFANRHFSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1cnc(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)c(C)c1 ZINC001238426510 1055657292 /nfs/dbraw/zinc/65/72/92/1055657292.db2.gz MXFHTYARIRKWTL-NRFANRHFSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1cnc(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)c(C)c1 ZINC001238442935 1055660302 /nfs/dbraw/zinc/66/03/02/1055660302.db2.gz WKNMSZNAXYUQND-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cnc(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)c(C)c1 ZINC001238442935 1055660305 /nfs/dbraw/zinc/66/03/05/1055660305.db2.gz WKNMSZNAXYUQND-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO COc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000921621571 1055662366 /nfs/dbraw/zinc/66/23/66/1055662366.db2.gz QEYHZKQCOPAFSI-INIZCTEOSA-N 1 2 314.429 4.148 20 0 DIADLO Cc1cccc(C2([NH2+]Cc3nc(CC(C)C)no3)CCCC2)c1 ZINC000104076567 1055666865 /nfs/dbraw/zinc/66/68/65/1055666865.db2.gz QJSHEDPIUNPOIA-UHFFFAOYSA-N 1 2 313.445 4.136 20 0 DIADLO CCc1cc(C)c(OC(=O)c2ccn3c(C)c[nH+]c3c2)c(C)c1 ZINC001596091930 1055668489 /nfs/dbraw/zinc/66/84/89/1055668489.db2.gz YBSQTSOVUHGUOJ-UHFFFAOYSA-N 1 2 308.381 4.041 20 0 DIADLO C[N@H+](Cc1c(F)ccc(OCc2ccccc2)c1F)C1CC1 ZINC001238474415 1055669400 /nfs/dbraw/zinc/66/94/00/1055669400.db2.gz XFZNUQPQFHNYQI-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO C[N@@H+](Cc1c(F)ccc(OCc2ccccc2)c1F)C1CC1 ZINC001238474415 1055669404 /nfs/dbraw/zinc/66/94/04/1055669404.db2.gz XFZNUQPQFHNYQI-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO CCOc1cc(C[N@@H+]2C[C@@H](C)C[C@H]2CF)cc(C(F)(F)F)c1 ZINC001238501211 1055673498 /nfs/dbraw/zinc/67/34/98/1055673498.db2.gz NFKYOYQXUKJGBS-FZMZJTMJSA-N 1 2 319.342 4.284 20 0 DIADLO CCOc1cc(C[N@H+]2C[C@@H](C)C[C@H]2CF)cc(C(F)(F)F)c1 ZINC001238501211 1055673504 /nfs/dbraw/zinc/67/35/04/1055673504.db2.gz NFKYOYQXUKJGBS-FZMZJTMJSA-N 1 2 319.342 4.284 20 0 DIADLO Fc1ccc(C[N@@H+]2CCCC(F)(F)[C@H](F)C2)cc1C1CC1 ZINC001238497342 1055673692 /nfs/dbraw/zinc/67/36/92/1055673692.db2.gz CYDMKZHSFCTDCP-OAHLLOKOSA-N 1 2 301.327 4.272 20 0 DIADLO Fc1ccc(C[N@H+]2CCCC(F)(F)[C@H](F)C2)cc1C1CC1 ZINC001238497342 1055673695 /nfs/dbraw/zinc/67/36/95/1055673695.db2.gz CYDMKZHSFCTDCP-OAHLLOKOSA-N 1 2 301.327 4.272 20 0 DIADLO Fc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)cc1C1CC1 ZINC001238510402 1055675369 /nfs/dbraw/zinc/67/53/69/1055675369.db2.gz DFTTYJWGOYXTOG-FQEVSTJZSA-N 1 2 311.400 4.277 20 0 DIADLO Fc1ccc(C[N@H+]2CCO[C@H](c3ccccc3)C2)cc1C1CC1 ZINC001238510402 1055675372 /nfs/dbraw/zinc/67/53/72/1055675372.db2.gz DFTTYJWGOYXTOG-FQEVSTJZSA-N 1 2 311.400 4.277 20 0 DIADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC001538636197 1055678748 /nfs/dbraw/zinc/67/87/48/1055678748.db2.gz SBNQLAWRUZNFRA-AWEZNQCLSA-N 1 2 321.380 4.019 20 0 DIADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC001538636197 1055678757 /nfs/dbraw/zinc/67/87/57/1055678757.db2.gz SBNQLAWRUZNFRA-AWEZNQCLSA-N 1 2 321.380 4.019 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@@H](c2ccccc2)C2CCC2)n1 ZINC000104702054 1055678946 /nfs/dbraw/zinc/67/89/46/1055678946.db2.gz PYMCWBJIXDBZNQ-IBGZPJMESA-N 1 2 313.445 4.289 20 0 DIADLO Cc1cc(C[N@@H+]2CCC(=O)[C@@H](C)C2)ccc1Oc1ccccc1 ZINC001238527085 1055680213 /nfs/dbraw/zinc/68/02/13/1055680213.db2.gz UKIXWMVZKUXSLM-INIZCTEOSA-N 1 2 309.409 4.198 20 0 DIADLO Cc1cc(C[N@H+]2CCC(=O)[C@@H](C)C2)ccc1Oc1ccccc1 ZINC001238527085 1055680223 /nfs/dbraw/zinc/68/02/23/1055680223.db2.gz UKIXWMVZKUXSLM-INIZCTEOSA-N 1 2 309.409 4.198 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@H](C)c3nc4ccccc4s3)cn2c1 ZINC000765759446 1055684079 /nfs/dbraw/zinc/68/40/79/1055684079.db2.gz RBXWBDKMTYAFPK-CYBMUJFWSA-N 1 2 322.437 4.103 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(F)c(-c3ccccc3)c2)CCC1=O ZINC001238551516 1055685438 /nfs/dbraw/zinc/68/54/38/1055685438.db2.gz LUTTUIMOIUSMRP-UHFFFAOYSA-N 1 2 311.400 4.294 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(F)c(-c3ccccc3)c2)CCC1=O ZINC001238551516 1055685444 /nfs/dbraw/zinc/68/54/44/1055685444.db2.gz LUTTUIMOIUSMRP-UHFFFAOYSA-N 1 2 311.400 4.294 20 0 DIADLO Cc1ccc(Cl)c(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c1 ZINC001238558375 1055687149 /nfs/dbraw/zinc/68/71/49/1055687149.db2.gz XUGLQWFKQSVZKS-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccc(Cl)c(C[N@H+]2CCO[C@@H](c3ccccc3)C2)c1 ZINC001238558375 1055687154 /nfs/dbraw/zinc/68/71/54/1055687154.db2.gz XUGLQWFKQSVZKS-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1ccccc1-c1ccc(F)cc1F ZINC001238585140 1055690790 /nfs/dbraw/zinc/69/07/90/1055690790.db2.gz ZATADGRHDAEAJN-ZDUSSCGKSA-N 1 2 315.363 4.185 20 0 DIADLO C[C@H]1CC(=O)CC[N@H+]1Cc1ccccc1-c1ccc(F)cc1F ZINC001238585140 1055690798 /nfs/dbraw/zinc/69/07/98/1055690798.db2.gz ZATADGRHDAEAJN-ZDUSSCGKSA-N 1 2 315.363 4.185 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccccc2-c2ccc(F)cc2F)CCC1=O ZINC001238581978 1055690985 /nfs/dbraw/zinc/69/09/85/1055690985.db2.gz HLKHWJBPZAZPJR-ZDUSSCGKSA-N 1 2 315.363 4.043 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccccc2-c2ccc(F)cc2F)CCC1=O ZINC001238581978 1055690992 /nfs/dbraw/zinc/69/09/92/1055690992.db2.gz HLKHWJBPZAZPJR-ZDUSSCGKSA-N 1 2 315.363 4.043 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@@](C)(F)[C@H](F)C2)cnc1-c1ccccc1 ZINC001238605229 1055694531 /nfs/dbraw/zinc/69/45/31/1055694531.db2.gz CDXHNBOEBFMECX-IEBWSBKVSA-N 1 2 316.395 4.329 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@@](C)(F)[C@H](F)C2)cnc1-c1ccccc1 ZINC001238605229 1055694536 /nfs/dbraw/zinc/69/45/36/1055694536.db2.gz CDXHNBOEBFMECX-IEBWSBKVSA-N 1 2 316.395 4.329 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(F)cc2F)cnc1C1CC1 ZINC001238623705 1055700025 /nfs/dbraw/zinc/70/00/25/1055700025.db2.gz JDTUOECKNUDWID-UHFFFAOYSA-N 1 2 302.368 4.178 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(F)cc2F)cnc1C1CC1 ZINC001238623705 1055700028 /nfs/dbraw/zinc/70/00/28/1055700028.db2.gz JDTUOECKNUDWID-UHFFFAOYSA-N 1 2 302.368 4.178 20 0 DIADLO Cc1cnc(-c2ccccc2)c(C[N@H+](C)Cc2nccs2)c1 ZINC001238624845 1055700725 /nfs/dbraw/zinc/70/07/25/1055700725.db2.gz MAAZUPNUNBTXAS-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1cnc(-c2ccccc2)c(C[N@@H+](C)Cc2nccs2)c1 ZINC001238624845 1055700738 /nfs/dbraw/zinc/70/07/38/1055700738.db2.gz MAAZUPNUNBTXAS-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)Cc3ccc(F)cc3)co2)cc1 ZINC000043584686 1055702322 /nfs/dbraw/zinc/70/23/22/1055702322.db2.gz MSLKFKDAQNYSQE-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)Cc3ccc(F)cc3)co2)cc1 ZINC000043584686 1055702336 /nfs/dbraw/zinc/70/23/36/1055702336.db2.gz MSLKFKDAQNYSQE-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cc(-c2ccccc2)ncc1Cl ZINC001238625732 1055704745 /nfs/dbraw/zinc/70/47/45/1055704745.db2.gz ZRNWGHGCCGMZHK-IUODEOHRSA-N 1 2 304.796 4.334 20 0 DIADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cc(-c2ccccc2)ncc1Cl ZINC001238625732 1055704753 /nfs/dbraw/zinc/70/47/53/1055704753.db2.gz ZRNWGHGCCGMZHK-IUODEOHRSA-N 1 2 304.796 4.334 20 0 DIADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2cc(-c3ccccc3)cnc2F)C1 ZINC001238657810 1055708527 /nfs/dbraw/zinc/70/85/27/1055708527.db2.gz LGJSKVXAHDCLPL-GUYCJALGSA-N 1 2 302.368 4.068 20 0 DIADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2cc(-c3ccccc3)cnc2F)C1 ZINC001238657810 1055708539 /nfs/dbraw/zinc/70/85/39/1055708539.db2.gz LGJSKVXAHDCLPL-GUYCJALGSA-N 1 2 302.368 4.068 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC001238652573 1055709708 /nfs/dbraw/zinc/70/97/08/1055709708.db2.gz RXHCZYHQEVAAED-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC001238652573 1055709716 /nfs/dbraw/zinc/70/97/16/1055709716.db2.gz RXHCZYHQEVAAED-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1ccccc1[C@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001565582222 1055710842 /nfs/dbraw/zinc/71/08/42/1055710842.db2.gz MMQJZAXALQGPQX-INIZCTEOSA-N 1 2 319.408 4.231 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cc(-c2ccccc2)cnc1F ZINC001238663532 1055711355 /nfs/dbraw/zinc/71/13/55/1055711355.db2.gz GZYFWCYSDUIASB-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cc(-c2ccccc2)cnc1F ZINC001238663532 1055711367 /nfs/dbraw/zinc/71/13/67/1055711367.db2.gz GZYFWCYSDUIASB-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO C[N@H+](Cc1cc(-c2ccccc2)cnc1F)C1CC(F)(F)C1 ZINC001238660004 1055712782 /nfs/dbraw/zinc/71/27/82/1055712782.db2.gz XOESJOAKCUZMHO-UHFFFAOYSA-N 1 2 306.331 4.117 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccccc2)cnc1F)C1CC(F)(F)C1 ZINC001238660004 1055712791 /nfs/dbraw/zinc/71/27/91/1055712791.db2.gz XOESJOAKCUZMHO-UHFFFAOYSA-N 1 2 306.331 4.117 20 0 DIADLO Cc1ncccc1C[N@@H+](C)Cc1cc(-c2ccccc2)cnc1F ZINC001238667767 1055715424 /nfs/dbraw/zinc/71/54/24/1055715424.db2.gz UQDLOJLXSPNUCQ-UHFFFAOYSA-N 1 2 321.399 4.223 20 0 DIADLO Cc1ncccc1C[N@H+](C)Cc1cc(-c2ccccc2)cnc1F ZINC001238667767 1055715432 /nfs/dbraw/zinc/71/54/32/1055715432.db2.gz UQDLOJLXSPNUCQ-UHFFFAOYSA-N 1 2 321.399 4.223 20 0 DIADLO CSc1cc(C)cc(C[N@@H+]2CCOC[C@@H]2c2ccccc2)c1 ZINC001238676419 1055718578 /nfs/dbraw/zinc/71/85/78/1055718578.db2.gz XBCXNWDWBQXYGE-LJQANCHMSA-N 1 2 313.466 4.290 20 0 DIADLO CSc1cc(C)cc(C[N@H+]2CCOC[C@@H]2c2ccccc2)c1 ZINC001238676419 1055718587 /nfs/dbraw/zinc/71/85/87/1055718587.db2.gz XBCXNWDWBQXYGE-LJQANCHMSA-N 1 2 313.466 4.290 20 0 DIADLO Cc1ccc(NC(=O)[C@H]2CC[C@@H](Nc3cccc[nH+]3)CC2)c(C)c1 ZINC001538801782 1055720183 /nfs/dbraw/zinc/72/01/83/1055720183.db2.gz ISAXBTCRMHWAKQ-CALCHBBNSA-N 1 2 323.440 4.308 20 0 DIADLO CSc1ccc(Cl)cc1C[N@@H+]1CCc2cccnc2C1 ZINC001238682349 1055721312 /nfs/dbraw/zinc/72/13/12/1055721312.db2.gz XPIOZRKSRRDJLI-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CSc1ccc(Cl)cc1C[N@H+]1CCc2cccnc2C1 ZINC001238682349 1055721324 /nfs/dbraw/zinc/72/13/24/1055721324.db2.gz XPIOZRKSRRDJLI-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CCn1c(C)cc2c1CCC[C@H]2[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000921638681 1055727775 /nfs/dbraw/zinc/72/77/75/1055727775.db2.gz DZABDSUUKPIXTJ-OAHLLOKOSA-N 1 2 315.461 4.269 20 0 DIADLO CC[C@@H](C)c1ccc(Nc2ccc[nH+]c2N2CCOCC2)cc1 ZINC001212358504 1055731778 /nfs/dbraw/zinc/73/17/78/1055731778.db2.gz MRDKRFHESWMVKN-OAHLLOKOSA-N 1 2 311.429 4.175 20 0 DIADLO CSc1ncc(C)cc1C[N@@H+]1CCc2cccc(Cl)c2C1 ZINC001238717258 1055732709 /nfs/dbraw/zinc/73/27/09/1055732709.db2.gz AYFUWWGYBIDZIB-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CSc1ncc(C)cc1C[N@H+]1CCc2cccc(Cl)c2C1 ZINC001238717258 1055732717 /nfs/dbraw/zinc/73/27/17/1055732717.db2.gz AYFUWWGYBIDZIB-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CC(C)([NH2+]Cc1nc(-c2ccoc2)no1)c1ccc(Cl)cc1 ZINC000105614446 1055745058 /nfs/dbraw/zinc/74/50/58/1055745058.db2.gz CIJBIPARFUXQCB-UHFFFAOYSA-N 1 2 317.776 4.008 20 0 DIADLO CC(C)Oc1cc(C[N@H+]2Cc3ccccc3[C@H](C)C2)c(F)cn1 ZINC001238795061 1055753504 /nfs/dbraw/zinc/75/35/04/1055753504.db2.gz ULMHSCWSOVNQDB-CQSZACIVSA-N 1 2 314.404 4.127 20 0 DIADLO CC(C)Oc1cc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c(F)cn1 ZINC001238795061 1055753511 /nfs/dbraw/zinc/75/35/11/1055753511.db2.gz ULMHSCWSOVNQDB-CQSZACIVSA-N 1 2 314.404 4.127 20 0 DIADLO CC(C)c1ccccc1NC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000047240137 1055755122 /nfs/dbraw/zinc/75/51/22/1055755122.db2.gz TXKFXRFRPFAIJD-UHFFFAOYSA-N 1 2 319.408 4.307 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1ccnc(Oc2ccccc2)c1 ZINC001238841633 1055761939 /nfs/dbraw/zinc/76/19/39/1055761939.db2.gz FUVZVPDPXMYDJK-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@]3(C)CCc4ccccc4C3)cc2[nH+]1 ZINC001566328721 1055761835 /nfs/dbraw/zinc/76/18/35/1055761835.db2.gz BOGHAWMXBQHUGL-HXUWFJFHSA-N 1 2 319.408 4.005 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CC[C@H]3CCc4ccccc43)cc2[nH+]1 ZINC001566330077 1055762618 /nfs/dbraw/zinc/76/26/18/1055762618.db2.gz VEFVGBGJNDVNOR-OAHLLOKOSA-N 1 2 319.408 4.320 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)nn1C ZINC000282162666 1055764964 /nfs/dbraw/zinc/76/49/64/1055764964.db2.gz LTOCDNLWXFMEFT-QWRGUYRKSA-N 1 2 312.244 4.447 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1ncc(C2CC2)o1 ZINC000347538118 1055787330 /nfs/dbraw/zinc/78/73/30/1055787330.db2.gz KKYKGUDTVYQYLX-HNNXBMFYSA-N 1 2 300.402 4.144 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000347538118 1055787341 /nfs/dbraw/zinc/78/73/41/1055787341.db2.gz KKYKGUDTVYQYLX-HNNXBMFYSA-N 1 2 300.402 4.144 20 0 DIADLO CC(C)CCCC(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC001597107132 1055788253 /nfs/dbraw/zinc/78/82/53/1055788253.db2.gz ITAUKMPIMNSKFW-AWEZNQCLSA-N 1 2 323.506 4.140 20 0 DIADLO CC(C)CCCC(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC001597107132 1055788258 /nfs/dbraw/zinc/78/82/58/1055788258.db2.gz ITAUKMPIMNSKFW-AWEZNQCLSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1nc(C[NH2+]C(C)(C)c2cccc(C(F)(F)F)c2)oc1C ZINC000057847002 1055789603 /nfs/dbraw/zinc/78/96/03/1055789603.db2.gz ZTFZMHWJTNVYFB-UHFFFAOYSA-N 1 2 312.335 4.335 20 0 DIADLO C[C@H]1CCCc2ccccc2[C@@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001567346142 1055799912 /nfs/dbraw/zinc/79/99/12/1055799912.db2.gz OAPWLADBDAUABQ-ORAYPTAESA-N 1 2 319.408 4.006 20 0 DIADLO Fc1ccccc1C[N@@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000058754086 1055816937 /nfs/dbraw/zinc/81/69/37/1055816937.db2.gz IGZXUNTXCCKYCR-FQEVSTJZSA-N 1 2 306.384 4.232 20 0 DIADLO Fc1ccccc1C[N@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000058754086 1055816959 /nfs/dbraw/zinc/81/69/59/1055816959.db2.gz IGZXUNTXCCKYCR-FQEVSTJZSA-N 1 2 306.384 4.232 20 0 DIADLO Cc1nnc(-c2ccc(-c3ccc(-c4c[nH+]cn4C)cc3)cc2)o1 ZINC001239020298 1055826533 /nfs/dbraw/zinc/82/65/33/1055826533.db2.gz QCKWRAASTFQVCA-UHFFFAOYSA-N 1 2 316.364 4.113 20 0 DIADLO Cc1cc(C)c(CNC(=O)/C=C\[C@]2(C)CC[C@@H](C)C2(C)C)c[nH+]1 ZINC001597403830 1055826912 /nfs/dbraw/zinc/82/69/12/1055826912.db2.gz YUGXUPPJZJOHFD-FSYLJHTJSA-N 1 2 314.473 4.333 20 0 DIADLO CCCC1CCC(N(C)C(=O)[C@@H](CC(C)C)n2cc[nH+]c2)CC1 ZINC001568590279 1055840486 /nfs/dbraw/zinc/84/04/86/1055840486.db2.gz FOMFJPLXNOAQKO-DAWZGUTISA-N 1 2 319.493 4.288 20 0 DIADLO C[N@H+](Cc1nc2ccccc2s1)Cc1ccc(F)c(F)c1 ZINC000061798623 1055873091 /nfs/dbraw/zinc/87/30/91/1055873091.db2.gz KHVJDOCUYKYDOC-UHFFFAOYSA-N 1 2 304.365 4.207 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2s1)Cc1ccc(F)c(F)c1 ZINC000061798623 1055873103 /nfs/dbraw/zinc/87/31/03/1055873103.db2.gz KHVJDOCUYKYDOC-UHFFFAOYSA-N 1 2 304.365 4.207 20 0 DIADLO CCc1ccc(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)cn1 ZINC000347612437 1055883685 /nfs/dbraw/zinc/88/36/85/1055883685.db2.gz NWCFLGKRSCGENB-OAQYLSRUSA-N 1 2 317.436 4.051 20 0 DIADLO CCc1ccc(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)cn1 ZINC000347612437 1055883696 /nfs/dbraw/zinc/88/36/96/1055883696.db2.gz NWCFLGKRSCGENB-OAQYLSRUSA-N 1 2 317.436 4.051 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2cccc(C(=O)C(F)(F)F)c2)cc1 ZINC001239391766 1055885854 /nfs/dbraw/zinc/88/58/54/1055885854.db2.gz IPPSOEXYNFOZBM-UHFFFAOYSA-N 1 2 321.298 4.460 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cccc4ccccc43)nn2)c1C ZINC001239469924 1055895310 /nfs/dbraw/zinc/89/53/10/1055895310.db2.gz BMLCZARCXIVQKC-UHFFFAOYSA-N 1 2 300.365 4.099 20 0 DIADLO Cc1cc(CNC(=O)C[C@H]2C[C@@H](C)CC(C)(C)C2)cc(C)[nH+]1 ZINC001597956377 1055897116 /nfs/dbraw/zinc/89/71/16/1055897116.db2.gz VNLWJOCFDGWLTN-CZUORRHYSA-N 1 2 302.462 4.167 20 0 DIADLO Cc1cc(CNC(=O)C[C@@H]2C[C@@H](C)CC(C)(C)C2)cc(C)[nH+]1 ZINC001597956376 1055898134 /nfs/dbraw/zinc/89/81/34/1055898134.db2.gz VNLWJOCFDGWLTN-CJNGLKHVSA-N 1 2 302.462 4.167 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)C1CC2(C1)CCCCC2 ZINC001598071689 1055909657 /nfs/dbraw/zinc/90/96/57/1055909657.db2.gz SGEDPIDSGQIRGV-UHFFFAOYSA-N 1 2 309.413 4.376 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@@H](F)CC1CCCCC1 ZINC001598071436 1055910037 /nfs/dbraw/zinc/91/00/37/1055910037.db2.gz NHRVWIDKEMDNGF-INIZCTEOSA-N 1 2 315.392 4.324 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@H](F)CC1CCCCC1 ZINC001598071438 1055910097 /nfs/dbraw/zinc/91/00/97/1055910097.db2.gz NHRVWIDKEMDNGF-MRXNPFEDSA-N 1 2 315.392 4.324 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@H]1CCCC[C@@H]1C1CC1 ZINC001598071073 1055911001 /nfs/dbraw/zinc/91/10/01/1055911001.db2.gz AXBHEBZTIPYZTI-SJORKVTESA-N 1 2 309.413 4.232 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2ccccc2-c2ccccc2)cc1 ZINC001239506697 1055918192 /nfs/dbraw/zinc/91/81/92/1055918192.db2.gz JIBATWQRSPWGEK-FQEVSTJZSA-N 1 2 317.388 4.193 20 0 DIADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCC[C@@H]1CC1CCCCC1 ZINC001598167464 1055919826 /nfs/dbraw/zinc/91/98/26/1055919826.db2.gz YKKLHCYCGVCEAB-MRXNPFEDSA-N 1 2 311.429 4.138 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2nc(CCC(C)C)no2)cc1 ZINC000064508463 1055920678 /nfs/dbraw/zinc/92/06/78/1055920678.db2.gz BEBODHOYFZDIFA-HNNXBMFYSA-N 1 2 301.434 4.160 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2nc(CCC(C)C)no2)cc1 ZINC000064508463 1055920690 /nfs/dbraw/zinc/92/06/90/1055920690.db2.gz BEBODHOYFZDIFA-HNNXBMFYSA-N 1 2 301.434 4.160 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1c(Cl)nc2ccccn21 ZINC001620753267 1055925513 /nfs/dbraw/zinc/92/55/13/1055925513.db2.gz FPCSWAPWZAAJLQ-UHFFFAOYSA-N 1 2 324.186 4.070 20 0 DIADLO COc1cccc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c1 ZINC001239523094 1055928031 /nfs/dbraw/zinc/92/80/31/1055928031.db2.gz WJHNLQQSTGWNCN-UHFFFAOYSA-N 1 2 320.392 4.005 20 0 DIADLO COc1cccc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c1 ZINC001239523094 1055928044 /nfs/dbraw/zinc/92/80/44/1055928044.db2.gz WJHNLQQSTGWNCN-UHFFFAOYSA-N 1 2 320.392 4.005 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc(F)cc1Cl)CC2 ZINC000065163379 1055941684 /nfs/dbraw/zinc/94/16/84/1055941684.db2.gz XRYNGZUKOVJUNC-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc(F)cc1Cl)CC2 ZINC000065163379 1055941693 /nfs/dbraw/zinc/94/16/93/1055941693.db2.gz XRYNGZUKOVJUNC-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Cc1cc(C)c(-c2cc(C[NH+]3CCOCC3)ccc2F)c(C)c1 ZINC001239551494 1055948560 /nfs/dbraw/zinc/94/85/60/1055948560.db2.gz TZGUVWVXHSOFIN-UHFFFAOYSA-N 1 2 313.416 4.250 20 0 DIADLO Cc1cccc(C)c1-c1ncnc2c1C[N@H+](Cc1ccccc1)C2 ZINC001239595143 1055969721 /nfs/dbraw/zinc/96/97/21/1055969721.db2.gz GQLISVPIHWRSQD-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1cccc(C)c1-c1ncnc2c1C[N@@H+](Cc1ccccc1)C2 ZINC001239595143 1055969729 /nfs/dbraw/zinc/96/97/29/1055969729.db2.gz GQLISVPIHWRSQD-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO CCCOc1ccc(Br)cc1CNc1cccc[nH+]1 ZINC000019777268 1055969983 /nfs/dbraw/zinc/96/99/83/1055969983.db2.gz PFERDYKNBZTGCO-UHFFFAOYSA-N 1 2 321.218 4.245 20 0 DIADLO CC[N@H+](Cc1nc2c(s1)C[C@@H](C)CC2)Cc1scnc1C ZINC001620676875 1055979421 /nfs/dbraw/zinc/97/94/21/1055979421.db2.gz FZDUSZARWHPNIH-NSHDSACASA-N 1 2 321.515 4.055 20 0 DIADLO CC[N@@H+](Cc1nc2c(s1)C[C@@H](C)CC2)Cc1scnc1C ZINC001620676875 1055979426 /nfs/dbraw/zinc/97/94/26/1055979426.db2.gz FZDUSZARWHPNIH-NSHDSACASA-N 1 2 321.515 4.055 20 0 DIADLO c1coc([C@H]([NH2+]Cc2cc3cccnc3o2)c2ccccc2)c1 ZINC001620704594 1055982765 /nfs/dbraw/zinc/98/27/65/1055982765.db2.gz UOJHUZXBANFWMF-GOSISDBHSA-N 1 2 304.349 4.300 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cc(C)c(C)cc3C)CCCCC2)no1 ZINC000067694636 1055995704 /nfs/dbraw/zinc/99/57/04/1055995704.db2.gz LETUMTOHIVXVIU-UHFFFAOYSA-N 1 2 313.445 4.252 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@H]1[NH2+]Cc1nccc2c1CCCC2 ZINC001621043506 1056005225 /nfs/dbraw/zinc/00/52/25/1056005225.db2.gz IXCMEKCZWWPOIA-UYAOXDASSA-N 1 2 310.416 4.076 20 0 DIADLO Cc1cc(NCc2ccc(Sc3ccccn3)o2)c[nH+]c1C ZINC001621047510 1056006057 /nfs/dbraw/zinc/00/60/57/1056006057.db2.gz UZABVBNLYTULFQ-UHFFFAOYSA-N 1 2 311.410 4.450 20 0 DIADLO COc1cccc(OC)c1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001239671254 1056015950 /nfs/dbraw/zinc/01/59/50/1056015950.db2.gz WKEIYTPLHZFCFY-UHFFFAOYSA-N 1 2 312.413 4.065 20 0 DIADLO COc1ccc2c(c1)nccc2-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001239676417 1056019325 /nfs/dbraw/zinc/01/93/25/1056019325.db2.gz BHEYGARVWCHBGX-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Cc1cccc(NC(=O)c2c[nH+]ccc2Nc2ccccc2)c1C ZINC001540520504 1056040088 /nfs/dbraw/zinc/04/00/88/1056040088.db2.gz WXVWEGOHDGYHGR-UHFFFAOYSA-N 1 2 317.392 4.116 20 0 DIADLO Cc1cc(-c2ccc(OCc3ccccc3)cc2F)c[nH+]c1N ZINC001239736752 1056049012 /nfs/dbraw/zinc/04/90/12/1056049012.db2.gz WYOPGHDLZJWLTQ-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO COC1CCC(Nc2ccc(C3(C(F)(F)F)CC3)c[nH+]2)CC1 ZINC001168605762 1056056618 /nfs/dbraw/zinc/05/66/18/1056056618.db2.gz PWGDVQPJERBKBS-UHFFFAOYSA-N 1 2 314.351 4.045 20 0 DIADLO COc1ccc2cc(-c3cc4[nH]c[nH+]c4cc3OC)ccc2c1 ZINC001239839496 1056100194 /nfs/dbraw/zinc/10/01/94/1056100194.db2.gz ABDFQQDKKBDINS-UHFFFAOYSA-N 1 2 304.349 4.400 20 0 DIADLO Cc1cc(C)cc(Oc2ccc(NC(=O)Cc3c[nH]c[nH+]3)cc2)c1 ZINC001542173023 1056106347 /nfs/dbraw/zinc/10/63/47/1056106347.db2.gz UQTHJJMTUJASGT-UHFFFAOYSA-N 1 2 321.380 4.000 20 0 DIADLO CCC[C@H](CC)C(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC001542205288 1056110723 /nfs/dbraw/zinc/11/07/23/1056110723.db2.gz WTDCRPWNNAVCJZ-KBPBESRZSA-N 1 2 323.506 4.140 20 0 DIADLO CCC[C@H](CC)C(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC001542205288 1056110727 /nfs/dbraw/zinc/11/07/27/1056110727.db2.gz WTDCRPWNNAVCJZ-KBPBESRZSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1ccc(-c2cc(C[NH+]3CCOCC3)ccc2F)c(Cl)c1 ZINC001239864082 1056115101 /nfs/dbraw/zinc/11/51/01/1056115101.db2.gz XFHJJHPUBQBLNC-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO Cc1ccccc1C[C@H](C)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001542442066 1056123040 /nfs/dbraw/zinc/12/30/40/1056123040.db2.gz GXRRENIJROKTFN-HNNXBMFYSA-N 1 2 319.408 4.202 20 0 DIADLO O=C(NC1CCCCC1)c1ccc(-c2cccc3[nH+]ccn32)cc1 ZINC001239917159 1056157244 /nfs/dbraw/zinc/15/72/44/1056157244.db2.gz YYUKSUNNMIEYOU-UHFFFAOYSA-N 1 2 319.408 4.064 20 0 DIADLO Cc1cc(NC(=O)[C@H]2CCCC[C@@H]2C2CC2)ccc1-n1cc[nH+]c1 ZINC001542877426 1056162534 /nfs/dbraw/zinc/16/25/34/1056162534.db2.gz VUCCHIHSSVPUIV-MSOLQXFVSA-N 1 2 323.440 4.336 20 0 DIADLO Cc1cc(NC(=O)c2ccc(C3CC3)cc2)ccc1-n1cc[nH+]c1 ZINC001542877128 1056163150 /nfs/dbraw/zinc/16/31/50/1056163150.db2.gz KGBBUZCVXXEDPH-UHFFFAOYSA-N 1 2 317.392 4.310 20 0 DIADLO Cc1cc(NC(=O)c2cccc(C3CC3)c2)ccc1-n1cc[nH+]c1 ZINC001542877178 1056163158 /nfs/dbraw/zinc/16/31/58/1056163158.db2.gz MQYFAVPIQNZBIU-UHFFFAOYSA-N 1 2 317.392 4.310 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](c2nccn2C)c2ccc(F)cc2)cc1 ZINC000030644398 1056173274 /nfs/dbraw/zinc/17/32/74/1056173274.db2.gz HCPXMJXINMAKNI-LJQANCHMSA-N 1 2 323.415 4.001 20 0 DIADLO CCOc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)c(OC)c1 ZINC001213118182 1056184885 /nfs/dbraw/zinc/18/48/85/1056184885.db2.gz MFZQYYLOVBPRAI-UHFFFAOYSA-N 1 2 309.369 4.023 20 0 DIADLO COc1ccc(CN(c2cc(C)[nH+]c(C3CCC3)n2)C2CC2)cc1 ZINC001611758414 1056186321 /nfs/dbraw/zinc/18/63/21/1056186321.db2.gz CJMIFIIYDIYVMW-UHFFFAOYSA-N 1 2 323.440 4.230 20 0 DIADLO Cc1nc(NC[C@@H](Nc2ccccc2)C(C)C)c2c([nH+]1)CCCC2 ZINC001611770509 1056187454 /nfs/dbraw/zinc/18/74/54/1056187454.db2.gz XLSSSGOCEWYLQW-LJQANCHMSA-N 1 2 324.472 4.212 20 0 DIADLO Cc1nc(N(C)Cc2c(Cl)cccc2Cl)c(C)c(C)[nH+]1 ZINC001611872763 1056201783 /nfs/dbraw/zinc/20/17/83/1056201783.db2.gz PMLRYRKNOMCIMO-UHFFFAOYSA-N 1 2 310.228 4.345 20 0 DIADLO Cc1ccc(F)c(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c1 ZINC001239966457 1056204507 /nfs/dbraw/zinc/20/45/07/1056204507.db2.gz FMSCULLOQUOZIF-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO Cc1ccc(F)c(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c1 ZINC001239966457 1056204524 /nfs/dbraw/zinc/20/45/24/1056204524.db2.gz FMSCULLOQUOZIF-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO CCCOc1ccc(-c2ccc3[nH+]c(C)cn3c2)c(F)c1F ZINC001239968006 1056206497 /nfs/dbraw/zinc/20/64/97/1056206497.db2.gz BCMMBLWRXOOLEI-UHFFFAOYSA-N 1 2 302.324 4.377 20 0 DIADLO CC[C@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccccc1 ZINC000054225407 1056209861 /nfs/dbraw/zinc/20/98/61/1056209861.db2.gz FEDWLEMZNWSIQK-INIZCTEOSA-N 1 2 323.371 4.144 20 0 DIADLO CCN(C)c1ccccc1CNc1cc(C)[nH+]c(C2CCC2)n1 ZINC001611947446 1056212263 /nfs/dbraw/zinc/21/22/63/1056212263.db2.gz LHYGJJCRAGUWFF-UHFFFAOYSA-N 1 2 310.445 4.121 20 0 DIADLO CC(C)=C(C)CC(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC001543432909 1056218964 /nfs/dbraw/zinc/21/89/64/1056218964.db2.gz NOKIUNYZYRBNPC-ZDUSSCGKSA-N 1 2 321.490 4.060 20 0 DIADLO CC(C)=C(C)CC(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC001543432909 1056218981 /nfs/dbraw/zinc/21/89/81/1056218981.db2.gz NOKIUNYZYRBNPC-ZDUSSCGKSA-N 1 2 321.490 4.060 20 0 DIADLO Cc1cc(-c2cc(F)ccc2OCc2ccccc2)c[nH+]c1N ZINC001239982759 1056220035 /nfs/dbraw/zinc/22/00/35/1056220035.db2.gz JDPFXIZZLINBMZ-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO CCCCNC(=O)c1ccc(-c2cccc(C(=[NH2+])OCC)c2)cc1 ZINC001239987710 1056226243 /nfs/dbraw/zinc/22/62/43/1056226243.db2.gz BBJWQHYKRNFLTO-UHFFFAOYSA-N 1 2 324.424 4.245 20 0 DIADLO Cc1cc(NC[C@@H](C)Cc2cccs2)nc(C2CCC2)[nH+]1 ZINC001612051052 1056229886 /nfs/dbraw/zinc/22/98/86/1056229886.db2.gz UIXYJHPNKSUZDU-LBPRGKRZSA-N 1 2 301.459 4.405 20 0 DIADLO CC(C)(C)NC(=O)c1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001239991701 1056231351 /nfs/dbraw/zinc/23/13/51/1056231351.db2.gz MGWYQXWMOHGLAJ-UHFFFAOYSA-N 1 2 319.408 4.068 20 0 DIADLO Cc1cc(NC[C@@H](c2cccnc2)C(C)C)nc(C2CCC2)[nH+]1 ZINC001612073537 1056234595 /nfs/dbraw/zinc/23/45/95/1056234595.db2.gz JXFFFHSATCFACU-QGZVFWFLSA-N 1 2 310.445 4.299 20 0 DIADLO CCc1ccc(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)cn1 ZINC000347634903 1056234902 /nfs/dbraw/zinc/23/49/02/1056234902.db2.gz JNMIXVAILLZJFJ-ZDUSSCGKSA-N 1 2 311.454 4.447 20 0 DIADLO CCc1ccc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)cn1 ZINC000347634903 1056234907 /nfs/dbraw/zinc/23/49/07/1056234907.db2.gz JNMIXVAILLZJFJ-ZDUSSCGKSA-N 1 2 311.454 4.447 20 0 DIADLO COc1ccc(-c2ccc(-n3cc[nH+]c3)cc2OC)cc1Cl ZINC001240033474 1056269885 /nfs/dbraw/zinc/26/98/85/1056269885.db2.gz BUIQKVSHKDAQAO-UHFFFAOYSA-N 1 2 314.772 4.210 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)N(c3cc(C)[nH+]c(C4CC4)n3)C2)cc1 ZINC001612322170 1056271938 /nfs/dbraw/zinc/27/19/38/1056271938.db2.gz WNMGNVTXYKSGES-QAPCUYQASA-N 1 2 307.441 4.353 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)N(c3cc(C)[nH+]c(C4CC4)n3)C2)cc1 ZINC001612322168 1056272316 /nfs/dbraw/zinc/27/23/16/1056272316.db2.gz WNMGNVTXYKSGES-CRAIPNDOSA-N 1 2 307.441 4.353 20 0 DIADLO Cc1cc(CNC(=O)/C=C/[C@]2(C)CC[C@H](C)C2(C)C)cc(C)[nH+]1 ZINC001584183448 1056279377 /nfs/dbraw/zinc/27/93/77/1056279377.db2.gz GPBMNVFYUAMREO-GXMAMIFBSA-N 1 2 314.473 4.333 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccc(Cl)c(Cl)c2)C2CC2)[nH]n1 ZINC001116442056 1056296050 /nfs/dbraw/zinc/29/60/50/1056296050.db2.gz FUONNXGBPPBRLW-UHFFFAOYSA-N 1 2 310.228 4.190 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccc(Cl)c(Cl)c2)C2CC2)[nH]n1 ZINC001116442056 1056296068 /nfs/dbraw/zinc/29/60/68/1056296068.db2.gz FUONNXGBPPBRLW-UHFFFAOYSA-N 1 2 310.228 4.190 20 0 DIADLO COCOc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC001205029395 1056307654 /nfs/dbraw/zinc/30/76/54/1056307654.db2.gz IXRQHMVBZQCUIN-UHFFFAOYSA-N 1 2 314.772 4.175 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1)Cc1nc(C)c2ccccc2n1 ZINC000107895954 1056320604 /nfs/dbraw/zinc/32/06/04/1056320604.db2.gz BGKYBEHQRLRELV-UHFFFAOYSA-N 1 2 309.388 4.099 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1)Cc1nc(C)c2ccccc2n1 ZINC000107895954 1056320617 /nfs/dbraw/zinc/32/06/17/1056320617.db2.gz BGKYBEHQRLRELV-UHFFFAOYSA-N 1 2 309.388 4.099 20 0 DIADLO CCC(CC)(CNc1cc(C)[nH+]c(C2CC2)n1)C(F)(F)F ZINC001612786057 1056328515 /nfs/dbraw/zinc/32/85/15/1056328515.db2.gz UAVGQYYHDUEQEX-UHFFFAOYSA-N 1 2 301.356 4.443 20 0 DIADLO CC(C)(C)c1csc(C[NH2+]Cc2nccc3c2CCCC3)n1 ZINC000921697328 1056330688 /nfs/dbraw/zinc/33/06/88/1056330688.db2.gz JYBJVKDQDMCHEB-UHFFFAOYSA-N 1 2 315.486 4.004 20 0 DIADLO Cc1cc(NCc2ccccc2-c2ncc[nH]2)nc(C2CCC2)[nH+]1 ZINC001612950212 1056341221 /nfs/dbraw/zinc/34/12/21/1056341221.db2.gz JJNXDCVOMBUAHL-UHFFFAOYSA-N 1 2 319.412 4.055 20 0 DIADLO COc1cccc2c(N[C@@H]3CCNc4ccccc43)cc[nH+]c12 ZINC001168645616 1056342266 /nfs/dbraw/zinc/34/22/66/1056342266.db2.gz QUESBDOTMMSEST-MRXNPFEDSA-N 1 2 305.381 4.212 20 0 DIADLO Cc1cccc2nc(C[NH2+][C@H](C)c3nc4ccccc4s3)cn21 ZINC000765897749 1056356895 /nfs/dbraw/zinc/35/68/95/1056356895.db2.gz FLFFSGXDARKWET-CYBMUJFWSA-N 1 2 322.437 4.103 20 0 DIADLO C[C@H]1CCc2c(sc3ncnc(-c4ccc5[nH+]ccn5c4)c23)C1 ZINC001240213311 1056371419 /nfs/dbraw/zinc/37/14/19/1056371419.db2.gz CAUBGYNVLXFWNK-NSHDSACASA-N 1 2 320.421 4.131 20 0 DIADLO CCc1nc2sc3c(c2c(-c2ccc4[nH+]ccn4c2)n1)CCC3 ZINC001240216823 1056375629 /nfs/dbraw/zinc/37/56/29/1056375629.db2.gz OCTPMHVMAQHLMQ-UHFFFAOYSA-N 1 2 320.421 4.057 20 0 DIADLO CCOC(=O)[C@@H](CC)c1ccc(-c2ccc3[nH+]ccn3c2)cc1 ZINC001240218733 1056375727 /nfs/dbraw/zinc/37/57/27/1056375727.db2.gz WVLHDTFPUQQITJ-KRWDZBQOSA-N 1 2 308.381 4.058 20 0 DIADLO COc1ccc(-c2ccncc2)cc1-c1ccc2[nH+]ccn2c1 ZINC001240219129 1056375844 /nfs/dbraw/zinc/37/58/44/1056375844.db2.gz AWLWPOAIFACLPH-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO CC(C)COC(=O)Nc1ccc(-c2ccc3[nH+]ccn3c2)cc1 ZINC001240217557 1056376881 /nfs/dbraw/zinc/37/68/81/1056376881.db2.gz ICTGETRRXXMKOY-UHFFFAOYSA-N 1 2 309.369 4.206 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2noc3c2CCCC3)cc1 ZINC000108851802 1056379697 /nfs/dbraw/zinc/37/96/97/1056379697.db2.gz ABPJGGGNEGFRNV-QGZVFWFLSA-N 1 2 300.377 4.030 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2noc3c2CCCC3)cc1 ZINC000108851802 1056379715 /nfs/dbraw/zinc/37/97/15/1056379715.db2.gz ABPJGGGNEGFRNV-QGZVFWFLSA-N 1 2 300.377 4.030 20 0 DIADLO COc1cc(-c2ccc3[nH+]ccn3c2)c(OC)c2ccccc12 ZINC001240221550 1056379579 /nfs/dbraw/zinc/37/95/79/1056379579.db2.gz LGHSUPYIHSIZFX-UHFFFAOYSA-N 1 2 304.349 4.172 20 0 DIADLO c1cn(-c2ccc(CSCc3ccc4c(c3)OCO4)cc2)c[nH+]1 ZINC001613729740 1056401634 /nfs/dbraw/zinc/40/16/34/1056401634.db2.gz XFUOLCVTLVOGDB-UHFFFAOYSA-N 1 2 324.405 4.034 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc(C(F)(F)F)nc2)cc1F ZINC001240269821 1056402927 /nfs/dbraw/zinc/40/29/27/1056402927.db2.gz HAXORKXVCABEGL-UHFFFAOYSA-N 1 2 316.273 4.107 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccnc(C(F)(F)F)c1 ZINC001240339212 1056434272 /nfs/dbraw/zinc/43/42/72/1056434272.db2.gz QMUCGSCDCGQMPX-UHFFFAOYSA-N 1 2 321.346 4.461 20 0 DIADLO CC(C)Sc1c(Cl)cccc1NC(=O)CCc1[nH]cc[nH+]1 ZINC001544456827 1056435843 /nfs/dbraw/zinc/43/58/43/1056435843.db2.gz SROXGQOWFPOTAF-UHFFFAOYSA-N 1 2 323.849 4.135 20 0 DIADLO C[C@H]1CC(C)(C)c2cccc(NC(=O)c3cccc4[nH+]ccn43)c21 ZINC001584947750 1056447815 /nfs/dbraw/zinc/44/78/15/1056447815.db2.gz PTTDUEXFWRZSCZ-ZDUSSCGKSA-N 1 2 319.408 4.371 20 0 DIADLO CC(C)(C)c1cn(Cc2ccc(F)c(Br)c2)c[nH+]1 ZINC001614787646 1056452162 /nfs/dbraw/zinc/45/21/62/1056452162.db2.gz STMZTUSZBNJIDV-UHFFFAOYSA-N 1 2 311.198 4.131 20 0 DIADLO CCC[C@@H]1C[C@H]1C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001544567641 1056458477 /nfs/dbraw/zinc/45/84/77/1056458477.db2.gz NBUDLYWPGYKGNF-CRAIPNDOSA-N 1 2 324.424 4.228 20 0 DIADLO C/C(=C/C(=O)NCc1c[nH+]c(C)cc1C)c1ccccc1Cl ZINC001585012254 1056463796 /nfs/dbraw/zinc/46/37/96/1056463796.db2.gz VXPURVGWUBHZID-LCYFTJDESA-N 1 2 314.816 4.072 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1nccn1-c1ccccc1 ZINC001615151718 1056470229 /nfs/dbraw/zinc/47/02/29/1056470229.db2.gz ZSIWGOHHHMLEKH-QGZVFWFLSA-N 1 2 323.465 4.443 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1nccn1-c1ccccc1 ZINC001615151718 1056470233 /nfs/dbraw/zinc/47/02/33/1056470233.db2.gz ZSIWGOHHHMLEKH-QGZVFWFLSA-N 1 2 323.465 4.443 20 0 DIADLO CC[C@H]1c2ccsc2CC[N@H+]1Cc1nccn1-c1ccccc1 ZINC001615151715 1056470566 /nfs/dbraw/zinc/47/05/66/1056470566.db2.gz ZSIWGOHHHMLEKH-KRWDZBQOSA-N 1 2 323.465 4.443 20 0 DIADLO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1nccn1-c1ccccc1 ZINC001615151715 1056470571 /nfs/dbraw/zinc/47/05/71/1056470571.db2.gz ZSIWGOHHHMLEKH-KRWDZBQOSA-N 1 2 323.465 4.443 20 0 DIADLO CCC1(CC)CCCN(C(=O)c2ccn3c(C)c[nH+]c3c2)CC1 ZINC001585044470 1056472996 /nfs/dbraw/zinc/47/29/96/1056472996.db2.gz JYUXWWGVUAXPPL-UHFFFAOYSA-N 1 2 313.445 4.075 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@@H+]2CC/C=C/c2ccccc2)no1 ZINC001615215702 1056477336 /nfs/dbraw/zinc/47/73/36/1056477336.db2.gz ZBLUAEKCFRQNQY-NIUUYTMRSA-N 1 2 311.429 4.263 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@H+]2CC/C=C/c2ccccc2)no1 ZINC001615215702 1056477345 /nfs/dbraw/zinc/47/73/45/1056477345.db2.gz ZBLUAEKCFRQNQY-NIUUYTMRSA-N 1 2 311.429 4.263 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CN(C)c1ccc(F)c(F)c1 ZINC001615272916 1056487683 /nfs/dbraw/zinc/48/76/83/1056487683.db2.gz UTQQUTXERWLPNJ-UHFFFAOYSA-N 1 2 313.351 4.095 20 0 DIADLO CC[C@](C)([NH2+]Cc1cc(C)cnc1Cl)c1nc(C)cs1 ZINC000921782989 1056487507 /nfs/dbraw/zinc/48/75/07/1056487507.db2.gz WHYQFKGUHJTLMA-HNNXBMFYSA-N 1 2 309.866 4.223 20 0 DIADLO CCCC[N@H+](Cc1nc(CC)cc(=O)[nH]1)[C@@H](C)c1ccc(C)o1 ZINC001615306874 1056489260 /nfs/dbraw/zinc/48/92/60/1056489260.db2.gz FXMGRFDDXHYAAU-AWEZNQCLSA-N 1 2 317.433 4.009 20 0 DIADLO CCCC[N@@H+](Cc1nc(CC)cc(=O)[nH]1)[C@@H](C)c1ccc(C)o1 ZINC001615306874 1056489278 /nfs/dbraw/zinc/48/92/78/1056489278.db2.gz FXMGRFDDXHYAAU-AWEZNQCLSA-N 1 2 317.433 4.009 20 0 DIADLO CCCC[N@H+](Cc1nc(CC)cc(=O)[nH]1)[C@H](C)c1ccc(C)o1 ZINC001615306877 1056489905 /nfs/dbraw/zinc/48/99/05/1056489905.db2.gz FXMGRFDDXHYAAU-CQSZACIVSA-N 1 2 317.433 4.009 20 0 DIADLO CCCC[N@@H+](Cc1nc(CC)cc(=O)[nH]1)[C@H](C)c1ccc(C)o1 ZINC001615306877 1056489906 /nfs/dbraw/zinc/48/99/06/1056489906.db2.gz FXMGRFDDXHYAAU-CQSZACIVSA-N 1 2 317.433 4.009 20 0 DIADLO CC[C@@H](C)[N@H+](CCc1ccccc1F)Cc1noc(C(C)C)n1 ZINC001615322775 1056491593 /nfs/dbraw/zinc/49/15/93/1056491593.db2.gz OJACGTVSVLRJNB-CQSZACIVSA-N 1 2 319.424 4.175 20 0 DIADLO CC[C@@H](C)[N@@H+](CCc1ccccc1F)Cc1noc(C(C)C)n1 ZINC001615322775 1056491599 /nfs/dbraw/zinc/49/15/99/1056491599.db2.gz OJACGTVSVLRJNB-CQSZACIVSA-N 1 2 319.424 4.175 20 0 DIADLO CC[C@H](C)[N@H+](CCc1ccccc1F)Cc1noc(C(C)C)n1 ZINC001615322773 1056492518 /nfs/dbraw/zinc/49/25/18/1056492518.db2.gz OJACGTVSVLRJNB-AWEZNQCLSA-N 1 2 319.424 4.175 20 0 DIADLO CC[C@H](C)[N@@H+](CCc1ccccc1F)Cc1noc(C(C)C)n1 ZINC001615322773 1056492526 /nfs/dbraw/zinc/49/25/26/1056492526.db2.gz OJACGTVSVLRJNB-AWEZNQCLSA-N 1 2 319.424 4.175 20 0 DIADLO Cc1cc(-c2ccc(C[NH+]3CCOCC3)cc2F)c(C)s1 ZINC001240431979 1056505322 /nfs/dbraw/zinc/50/53/22/1056505322.db2.gz WUNNHGCLLKFTHI-UHFFFAOYSA-N 1 2 305.418 4.003 20 0 DIADLO C[C@@H]([NH2+]Cc1cnn(C2CCC2)c1)c1c(F)cccc1Cl ZINC000921808613 1056510966 /nfs/dbraw/zinc/51/09/66/1056510966.db2.gz CEPNRBHXFWVOFL-LLVKDONJSA-N 1 2 307.800 4.251 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@@H](CC)CC1 ZINC001615496971 1056521053 /nfs/dbraw/zinc/52/10/53/1056521053.db2.gz QBUJTFDCWDBSHV-RHSMWYFYSA-N 1 2 323.864 4.456 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H](CC)CC1 ZINC001615496971 1056521069 /nfs/dbraw/zinc/52/10/69/1056521069.db2.gz QBUJTFDCWDBSHV-RHSMWYFYSA-N 1 2 323.864 4.456 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000061800573 1056523637 /nfs/dbraw/zinc/52/36/37/1056523637.db2.gz UKDUCGFECCPCMU-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000061800573 1056523653 /nfs/dbraw/zinc/52/36/53/1056523653.db2.gz UKDUCGFECCPCMU-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO CSCc1cc(F)ccc1C[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000921830670 1056525573 /nfs/dbraw/zinc/52/55/73/1056525573.db2.gz SKGCIWQQAHLBNI-UHFFFAOYSA-N 1 2 322.449 4.264 20 0 DIADLO COc1cc(-c2c[nH+]c(N)c(C)c2)ccc1OCc1ccccc1 ZINC001240472827 1056530197 /nfs/dbraw/zinc/53/01/97/1056530197.db2.gz OWGIULJDOXBTDN-UHFFFAOYSA-N 1 2 320.392 4.227 20 0 DIADLO CC(C)(C)c1cc2ncnc(-c3ccn4cc[nH+]c4c3)c2s1 ZINC001240496293 1056539011 /nfs/dbraw/zinc/53/90/11/1056539011.db2.gz KVTHBQRTTUUJSA-UHFFFAOYSA-N 1 2 308.410 4.304 20 0 DIADLO Cc1ccccc1Oc1nc(-c2ccn3cc[nH+]c3c2)ncc1F ZINC001240503363 1056539565 /nfs/dbraw/zinc/53/95/65/1056539565.db2.gz MSMJAXINDVUVTQ-UHFFFAOYSA-N 1 2 320.327 4.031 20 0 DIADLO Cc1sccc1-c1cc(F)cc(C)c1C[NH+]1CCOCC1 ZINC001240502332 1056539703 /nfs/dbraw/zinc/53/97/03/1056539703.db2.gz RQGJZKXGCUTRAS-UHFFFAOYSA-N 1 2 305.418 4.003 20 0 DIADLO c1cn2ccc(-c3nccc4ccn(Cc5ccccc5)c43)cc2[nH+]1 ZINC001240503388 1056540193 /nfs/dbraw/zinc/54/01/93/1056540193.db2.gz NXTONSSDBVBGDE-UHFFFAOYSA-N 1 2 324.387 4.399 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cncc2ccccc21 ZINC000765944884 1056542270 /nfs/dbraw/zinc/54/22/70/1056542270.db2.gz RGOGUUQNBQTGOF-UHFFFAOYSA-N 1 2 320.371 4.356 20 0 DIADLO CN(C)c1ccc(-c2ccn3cc[nH+]c3c2)cc1C(F)(F)F ZINC001240510569 1056544569 /nfs/dbraw/zinc/54/45/69/1056544569.db2.gz OAYATUVEFVWLMM-UHFFFAOYSA-N 1 2 305.303 4.086 20 0 DIADLO Cc1cc(C(=O)OC(C)(C)C)ccc1-c1ccn2cc[nH+]c2c1 ZINC001240512101 1056544936 /nfs/dbraw/zinc/54/49/36/1056544936.db2.gz ORKCKKSWYXWEBY-UHFFFAOYSA-N 1 2 308.381 4.265 20 0 DIADLO Fc1cccc(COc2ccc(-c3ccn4cc[nH+]c4c3)cn2)c1 ZINC001240513656 1056546429 /nfs/dbraw/zinc/54/64/29/1056546429.db2.gz YGBNOZJRUWUMKC-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO COC(=O)c1ccc(C(C)(C)C)c(-c2ccn3cc[nH+]c3c2)c1 ZINC001240512111 1056546979 /nfs/dbraw/zinc/54/69/79/1056546979.db2.gz PEDMJZJKQPAGPL-UHFFFAOYSA-N 1 2 308.381 4.085 20 0 DIADLO CC[C@]1(C)CCC[N@H+](Cc2nc(C)c(Br)s2)C1 ZINC001615649793 1056552261 /nfs/dbraw/zinc/55/22/61/1056552261.db2.gz NUWDBNUOCICINI-CYBMUJFWSA-N 1 2 317.296 4.226 20 0 DIADLO CC[C@]1(C)CCC[N@@H+](Cc2nc(C)c(Br)s2)C1 ZINC001615649793 1056552275 /nfs/dbraw/zinc/55/22/75/1056552275.db2.gz NUWDBNUOCICINI-CYBMUJFWSA-N 1 2 317.296 4.226 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]CC(=O)c1ccccc1F ZINC001168685539 1056553518 /nfs/dbraw/zinc/55/35/18/1056553518.db2.gz LCBFNOZHEJLFID-AWEZNQCLSA-N 1 2 315.388 4.146 20 0 DIADLO Fc1ccc(C(F)(F)F)c(-c2ccc(Cn3cc[nH+]c3)cn2)c1 ZINC001240531724 1056554965 /nfs/dbraw/zinc/55/49/65/1056554965.db2.gz QGXHRLORJRGLOH-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO Fc1cc(Br)cc(CNc2cc3cc[nH]c3c[nH+]2)c1 ZINC000672170716 1056557044 /nfs/dbraw/zinc/55/70/44/1056557044.db2.gz MRXXSVKXSDEDOH-UHFFFAOYSA-N 1 2 320.165 4.077 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC[C@H](C)C[C@@H]1c1ccc(C)o1 ZINC001615679221 1056562860 /nfs/dbraw/zinc/56/28/60/1056562860.db2.gz SOYWCTHIGDPNBK-CWRNSKLLSA-N 1 2 307.434 4.093 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CC[C@H](C)C[C@@H]1c1ccc(C)o1 ZINC001615679221 1056562869 /nfs/dbraw/zinc/56/28/69/1056562869.db2.gz SOYWCTHIGDPNBK-CWRNSKLLSA-N 1 2 307.434 4.093 20 0 DIADLO Cc1cc(Br)ccc1CNc1cc2cc[nH]c2c[nH+]1 ZINC000672212989 1056567559 /nfs/dbraw/zinc/56/75/59/1056567559.db2.gz HNXDRKJQJMKULD-UHFFFAOYSA-N 1 2 316.202 4.246 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cccc(-c3cc[nH]n3)c2)c1 ZINC001240564115 1056581078 /nfs/dbraw/zinc/58/10/78/1056581078.db2.gz YQYDCMXGULLOTA-UHFFFAOYSA-N 1 2 300.365 4.144 20 0 DIADLO Cc1cc(C)cc(NC(=O)C[N@@H+](C)Cc2cc3ccccc3o2)c1 ZINC001615826052 1056583054 /nfs/dbraw/zinc/58/30/54/1056583054.db2.gz LPMVDGVJXNYAOE-UHFFFAOYSA-N 1 2 322.408 4.120 20 0 DIADLO Cc1cc(C)cc(NC(=O)C[N@H+](C)Cc2cc3ccccc3o2)c1 ZINC001615826052 1056583056 /nfs/dbraw/zinc/58/30/56/1056583056.db2.gz LPMVDGVJXNYAOE-UHFFFAOYSA-N 1 2 322.408 4.120 20 0 DIADLO c1cc2cc(NCc3cccc(-c4ccccn4)c3)[nH+]cc2[nH]1 ZINC000672241438 1056584889 /nfs/dbraw/zinc/58/48/89/1056584889.db2.gz BTUNSIMVVKXMEH-UHFFFAOYSA-N 1 2 300.365 4.237 20 0 DIADLO Cn1ccc2ccc(-c3cc(F)c(C[NH+](C)C)c(F)c3)cc21 ZINC001240577207 1056585277 /nfs/dbraw/zinc/58/52/77/1056585277.db2.gz QJBYOZXATMCXCZ-UHFFFAOYSA-N 1 2 300.352 4.185 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](Cc1cc(Cl)n(C)n1)C1CC1 ZINC001615906703 1056594862 /nfs/dbraw/zinc/59/48/62/1056594862.db2.gz DDTDDSBGONURFC-NSHDSACASA-N 1 2 324.255 4.453 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](Cc1cc(Cl)n(C)n1)C1CC1 ZINC001615906703 1056594873 /nfs/dbraw/zinc/59/48/73/1056594873.db2.gz DDTDDSBGONURFC-NSHDSACASA-N 1 2 324.255 4.453 20 0 DIADLO CCOC(=O)CC(C)(C)CC[N@H+](CC)c1ccc(C)cc1C ZINC001615914647 1056595844 /nfs/dbraw/zinc/59/58/44/1056595844.db2.gz LJGIJMAIRJVQBY-UHFFFAOYSA-N 1 2 305.462 4.499 20 0 DIADLO CCOC(=O)CC(C)(C)CC[N@@H+](CC)c1ccc(C)cc1C ZINC001615914647 1056595856 /nfs/dbraw/zinc/59/58/56/1056595856.db2.gz LJGIJMAIRJVQBY-UHFFFAOYSA-N 1 2 305.462 4.499 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)c(F)c1F)c1ccc(F)cc1F ZINC001620829395 1056598821 /nfs/dbraw/zinc/59/88/21/1056598821.db2.gz DJWOQYSWWFWRJG-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO C[C@H](c1nnc(-c2cccs2)o1)[N@H+](C)Cc1ccsc1 ZINC000007927150 1056602411 /nfs/dbraw/zinc/60/24/11/1056602411.db2.gz BDRBCJCTEOMQBW-SNVBAGLBSA-N 1 2 305.428 4.053 20 0 DIADLO C[C@H](c1nnc(-c2cccs2)o1)[N@@H+](C)Cc1ccsc1 ZINC000007927150 1056602425 /nfs/dbraw/zinc/60/24/25/1056602425.db2.gz BDRBCJCTEOMQBW-SNVBAGLBSA-N 1 2 305.428 4.053 20 0 DIADLO OC[C@@H]1c2ccccc2CC[N@H+]1Cc1cccc(Cl)c1Cl ZINC001616058759 1056609128 /nfs/dbraw/zinc/60/91/28/1056609128.db2.gz AOPFLSCTLWDMOD-MRXNPFEDSA-N 1 2 322.235 4.085 20 0 DIADLO OC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cccc(Cl)c1Cl ZINC001616058759 1056609139 /nfs/dbraw/zinc/60/91/39/1056609139.db2.gz AOPFLSCTLWDMOD-MRXNPFEDSA-N 1 2 322.235 4.085 20 0 DIADLO CC[C@H]1CCc2ccccc2[N@@H+]1C[Si](C)(C)c1ccccc1 ZINC001616208408 1056619064 /nfs/dbraw/zinc/61/90/64/1056619064.db2.gz NGUHXPYZXSJKFU-SFHVURJKSA-N 1 2 309.529 4.373 20 0 DIADLO CC[C@H]1CCc2ccccc2[N@H+]1C[Si](C)(C)c1ccccc1 ZINC001616208408 1056619069 /nfs/dbraw/zinc/61/90/69/1056619069.db2.gz NGUHXPYZXSJKFU-SFHVURJKSA-N 1 2 309.529 4.373 20 0 DIADLO Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)Nc1c(C)c[nH+]cc1C ZINC001616246108 1056624013 /nfs/dbraw/zinc/62/40/13/1056624013.db2.gz FGMQMKMTFLSPCK-BBRMVZONSA-N 1 2 308.425 4.048 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)Cc1cc(Cl)cc2ccccc21 ZINC001616247751 1056624295 /nfs/dbraw/zinc/62/42/95/1056624295.db2.gz ZSJVYEWXQRBSKB-UHFFFAOYSA-N 1 2 324.811 4.108 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C=C[C@]1(C)CC[C@@H](C)C1(C)C ZINC001616247030 1056624346 /nfs/dbraw/zinc/62/43/46/1056624346.db2.gz PNOHUDRGONLKGG-HZEJSKIFSA-N 1 2 300.446 4.077 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1ccc(Cl)cn1 ZINC001616402639 1056650705 /nfs/dbraw/zinc/65/07/05/1056650705.db2.gz MNIINLYSJDHFGT-RYUDHWBXSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1ccc(Cl)cn1 ZINC001616402639 1056650710 /nfs/dbraw/zinc/65/07/10/1056650710.db2.gz MNIINLYSJDHFGT-RYUDHWBXSA-N 1 2 304.796 4.382 20 0 DIADLO CC(C)c1cc(N[C@H](C)CCCC(C)(C)O)nc(C(C)C)[nH+]1 ZINC001168697246 1056653620 /nfs/dbraw/zinc/65/36/20/1056653620.db2.gz AFLDNOGFTAEPPE-CQSZACIVSA-N 1 2 307.482 4.465 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CC[C@@H](Oc3ccccc3Cl)C2)c1 ZINC001616514118 1056668065 /nfs/dbraw/zinc/66/80/65/1056668065.db2.gz AYIBNSSHBGAQSQ-CQSZACIVSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CC[C@@H](Oc3ccccc3Cl)C2)c1 ZINC001616514118 1056668072 /nfs/dbraw/zinc/66/80/72/1056668072.db2.gz AYIBNSSHBGAQSQ-CQSZACIVSA-N 1 2 323.770 4.272 20 0 DIADLO CSc1cc(Nc2cc(F)c(OC(F)F)c(F)c2)cc[nH+]1 ZINC001212449587 1056670812 /nfs/dbraw/zinc/67/08/12/1056670812.db2.gz XNWVQDOKYYYUDR-UHFFFAOYSA-N 1 2 318.295 4.427 20 0 DIADLO Cc1cc(N[C@@H](C)CCCC(C)(C)O)[nH+]cc1C(F)(F)F ZINC001168698112 1056679658 /nfs/dbraw/zinc/67/96/58/1056679658.db2.gz SEPSIODYJWQWNN-NSHDSACASA-N 1 2 304.356 4.150 20 0 DIADLO CCO[C@H](C)n1cc(-c2cc([NH+](CC)CC)ccc2C)cn1 ZINC001240759312 1056683285 /nfs/dbraw/zinc/68/32/85/1056683285.db2.gz MHABSOCENCMTST-OAHLLOKOSA-N 1 2 301.434 4.260 20 0 DIADLO Fc1cc(C[NH+]2CCOCC2)ccc1-c1ccc(C(F)F)cc1 ZINC001240769310 1056690201 /nfs/dbraw/zinc/69/02/01/1056690201.db2.gz GMZDBOMHLMCZFK-UHFFFAOYSA-N 1 2 321.342 4.263 20 0 DIADLO Cc1ccccc1[C@@H]([NH2+][C@H](C(=O)OC(C)(C)C)C1CC1)C1CC1 ZINC001616637343 1056692012 /nfs/dbraw/zinc/69/20/12/1056692012.db2.gz VJTLJQBNNSVNFI-ROUUACIJSA-N 1 2 315.457 4.156 20 0 DIADLO CCCCOC(=O)[C@H](C)[NH2+][C@H](CC)C(C)(C)c1ccccc1 ZINC001616645831 1056693985 /nfs/dbraw/zinc/69/39/85/1056693985.db2.gz NICRJEFUHRAVBY-DOTOQJQBSA-N 1 2 305.462 4.064 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](Cc1nccn1C)Cc1ccccc1 ZINC000338785682 1056717813 /nfs/dbraw/zinc/71/78/13/1056717813.db2.gz ZYNSAXSJAWPURU-KRWDZBQOSA-N 1 2 305.425 4.184 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](Cc1nccn1C)Cc1ccccc1 ZINC000338785682 1056717822 /nfs/dbraw/zinc/71/78/22/1056717822.db2.gz ZYNSAXSJAWPURU-KRWDZBQOSA-N 1 2 305.425 4.184 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+][C@@H](CCO)c2ccco2)c1Cl ZINC000922007088 1056729179 /nfs/dbraw/zinc/72/91/79/1056729179.db2.gz FWXAPRUCVIISJO-ZDUSSCGKSA-N 1 2 314.212 4.108 20 0 DIADLO FC(F)(F)c1cnc2c(c1)[C@@H]([NH2+][C@H]1CCCC1(F)F)CCC2 ZINC000672622516 1056737815 /nfs/dbraw/zinc/73/78/15/1056737815.db2.gz ZYGMOEXUHWCUCE-STQMWFEESA-N 1 2 320.305 4.255 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc(Oc2cccnc2)cc1 ZINC001240880675 1056738438 /nfs/dbraw/zinc/73/84/38/1056738438.db2.gz LPBHIPMZPTZRJF-UHFFFAOYSA-N 1 2 317.348 4.426 20 0 DIADLO Nc1ccc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c[nH+]1 ZINC001240885571 1056740371 /nfs/dbraw/zinc/74/03/71/1056740371.db2.gz KNEAJDMWHQZVJL-UHFFFAOYSA-N 1 2 306.209 4.368 20 0 DIADLO Cc1coc2ccc(NC(=O)[C@@H](CC(C)C)n3cc[nH+]c3)cc12 ZINC001616954114 1056746150 /nfs/dbraw/zinc/74/61/50/1056746150.db2.gz DLZMBLIHVDOCCO-MRXNPFEDSA-N 1 2 311.385 4.164 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2sc3ccccc3c2C)no1 ZINC001617030995 1056764337 /nfs/dbraw/zinc/76/43/37/1056764337.db2.gz MOIWSYWRLBUIKD-GHMZBOCLSA-N 1 2 301.415 4.313 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc2ncccc21 ZINC001240940245 1056769267 /nfs/dbraw/zinc/76/92/67/1056769267.db2.gz AKDSSLFXLWHLIX-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO CC[C@@H](CC(=O)N1CCNc2[nH+]cc(C)cc21)c1ccc(C)cc1 ZINC001586630939 1056769589 /nfs/dbraw/zinc/76/95/89/1056769589.db2.gz YWHGNIVMLXRWMF-INIZCTEOSA-N 1 2 323.440 4.041 20 0 DIADLO CCC(CC)[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1ccccc1 ZINC001586623618 1056770215 /nfs/dbraw/zinc/77/02/15/1056770215.db2.gz BKHDWUYKSGMTMQ-IBGZPJMESA-N 1 2 321.424 4.470 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2cccc(C(=O)OC(C)C)c2)c1 ZINC001240947183 1056775613 /nfs/dbraw/zinc/77/56/13/1056775613.db2.gz OVYJTJXLERUNOD-UHFFFAOYSA-N 1 2 311.381 4.281 20 0 DIADLO Fc1ccc2[nH]c3c(c2c1)C[N@H+](CCOC1CCCCC1)CC3 ZINC001617168648 1056787413 /nfs/dbraw/zinc/78/74/13/1056787413.db2.gz BVEQZFDMWLOZGD-UHFFFAOYSA-N 1 2 316.420 4.014 20 0 DIADLO Fc1ccc2[nH]c3c(c2c1)C[N@@H+](CCOC1CCCCC1)CC3 ZINC001617168648 1056787427 /nfs/dbraw/zinc/78/74/27/1056787427.db2.gz BVEQZFDMWLOZGD-UHFFFAOYSA-N 1 2 316.420 4.014 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cc(F)c(F)c(F)c2)cc1F ZINC001240981305 1056796535 /nfs/dbraw/zinc/79/65/35/1056796535.db2.gz FOJZHKQZNYSYHC-UHFFFAOYSA-N 1 2 301.258 4.111 20 0 DIADLO CCC1(CC)CC[NH+]([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1 ZINC001617316586 1056811728 /nfs/dbraw/zinc/81/17/28/1056811728.db2.gz AQGHGJQHWJXRFX-MRXNPFEDSA-N 1 2 323.864 4.456 20 0 DIADLO Cc1ccc(-c2ccc(F)c(OCc3ccccc3)c2)[nH+]c1N ZINC001241006689 1056811934 /nfs/dbraw/zinc/81/19/34/1056811934.db2.gz OGKMTUMKDRYCOG-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO COc1cccc(F)c1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001241010838 1056815890 /nfs/dbraw/zinc/81/58/90/1056815890.db2.gz JPHSAQVUIGKXOG-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2ccccc2CC(C)C)c(C)[nH+]1 ZINC001586846967 1056817955 /nfs/dbraw/zinc/81/79/55/1056817955.db2.gz QWLSEQIOYAAFQJ-UHFFFAOYSA-N 1 2 310.441 4.135 20 0 DIADLO Cc1ccc(-c2ccc(OCc3ccccc3)c(F)c2)[nH+]c1N ZINC001241039168 1056837977 /nfs/dbraw/zinc/83/79/77/1056837977.db2.gz VCNVWKUCWZLFTF-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO Clc1cccc([C@H]2CCCC[N@@H+]2Cc2cc3n(n2)CCC3)c1 ZINC001617590424 1056852826 /nfs/dbraw/zinc/85/28/26/1056852826.db2.gz JJYPEWLYWQQIFQ-GOSISDBHSA-N 1 2 315.848 4.210 20 0 DIADLO Clc1cccc([C@H]2CCCC[N@H+]2Cc2cc3n(n2)CCC3)c1 ZINC001617590424 1056852834 /nfs/dbraw/zinc/85/28/34/1056852834.db2.gz JJYPEWLYWQQIFQ-GOSISDBHSA-N 1 2 315.848 4.210 20 0 DIADLO COc1c(F)ccc(Nc2cc(Cl)c3[nH+]ccn3c2)c1F ZINC001212496265 1056854658 /nfs/dbraw/zinc/85/46/58/1056854658.db2.gz BGVAPQRGXKUORZ-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO C[C@@H]1C[N@@H+]([C@H](c2ccccc2)c2ccc(Cl)cc2)CCO1 ZINC000673064214 1056855084 /nfs/dbraw/zinc/85/50/84/1056855084.db2.gz ZIRPLFMZAAWDOO-RDTXWAMCSA-N 1 2 301.817 4.150 20 0 DIADLO C[C@@H]1C[N@H+]([C@H](c2ccccc2)c2ccc(Cl)cc2)CCO1 ZINC000673064214 1056855091 /nfs/dbraw/zinc/85/50/91/1056855091.db2.gz ZIRPLFMZAAWDOO-RDTXWAMCSA-N 1 2 301.817 4.150 20 0 DIADLO CCOc1cc(-c2cc(F)c(C[NH+](C)C)c(F)c2)ccc1F ZINC001241071082 1056863594 /nfs/dbraw/zinc/86/35/94/1056863594.db2.gz RHEGWFXXJLIZSX-UHFFFAOYSA-N 1 2 309.331 4.231 20 0 DIADLO CCOc1cc(F)c(-c2cccc(-c3c[nH+]cn3C)c2)cc1F ZINC001241074300 1056866334 /nfs/dbraw/zinc/86/63/34/1056866334.db2.gz ZJMUVZMIMOJSEN-UHFFFAOYSA-N 1 2 314.335 4.431 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1cc(F)cc(C(F)(F)F)c1 ZINC001241082092 1056873946 /nfs/dbraw/zinc/87/39/46/1056873946.db2.gz AGVZWACRYICZRT-UHFFFAOYSA-N 1 2 310.250 4.396 20 0 DIADLO COc1ccc(-c2cn3cc[nH+]c3cc2C)cc1C(F)(F)F ZINC001241091866 1056882860 /nfs/dbraw/zinc/88/28/60/1056882860.db2.gz ZVMZGXXGSVHMDX-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO FC(F)(F)[C@@H]1CC[C@@H](C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)O1 ZINC001617868246 1056892792 /nfs/dbraw/zinc/89/27/92/1056892792.db2.gz NDBAUHGAGHDSFU-IHRRRGAJSA-N 1 2 319.754 4.197 20 0 DIADLO FC(F)(F)[C@@H]1CC[C@@H](C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)O1 ZINC001617868246 1056892799 /nfs/dbraw/zinc/89/27/99/1056892799.db2.gz NDBAUHGAGHDSFU-IHRRRGAJSA-N 1 2 319.754 4.197 20 0 DIADLO Cc1cn(C)nc1C[N@@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001617925793 1056903209 /nfs/dbraw/zinc/90/32/09/1056903209.db2.gz LQZXTYRKEJBTKW-QGZVFWFLSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1cn(C)nc1C[N@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001617925793 1056903216 /nfs/dbraw/zinc/90/32/16/1056903216.db2.gz LQZXTYRKEJBTKW-QGZVFWFLSA-N 1 2 303.837 4.109 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001618235457 1056938450 /nfs/dbraw/zinc/93/84/50/1056938450.db2.gz SJXXKDGBGLSQKZ-INIZCTEOSA-N 1 2 323.436 4.053 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001618235457 1056938464 /nfs/dbraw/zinc/93/84/64/1056938464.db2.gz SJXXKDGBGLSQKZ-INIZCTEOSA-N 1 2 323.436 4.053 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(SCc3ccccc3)c2)CCO1 ZINC001618233691 1056939331 /nfs/dbraw/zinc/93/93/31/1056939331.db2.gz BKNPQXHRDKIVNY-INIZCTEOSA-N 1 2 313.466 4.200 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(SCc3ccccc3)c2)CCO1 ZINC001618233691 1056939343 /nfs/dbraw/zinc/93/93/43/1056939343.db2.gz BKNPQXHRDKIVNY-INIZCTEOSA-N 1 2 313.466 4.200 20 0 DIADLO CN1CCC[C@@H]([NH2+]Cc2nc(C(C)(C)C)co2)c2ccccc21 ZINC000922166550 1056941240 /nfs/dbraw/zinc/94/12/40/1056941240.db2.gz PUEXPXUBTGIFEI-OAHLLOKOSA-N 1 2 313.445 4.033 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)cs1 ZINC000115612846 1056943323 /nfs/dbraw/zinc/94/33/23/1056943323.db2.gz XIQNSHFMMOFZKZ-UHFFFAOYSA-N 1 2 316.401 4.449 20 0 DIADLO Nc1cc(-c2cncc(-c3ccc(C(F)(F)F)cc3)c2)cc[nH+]1 ZINC001241176083 1056946035 /nfs/dbraw/zinc/94/60/35/1056946035.db2.gz UKIRFIDEJMNJBU-UHFFFAOYSA-N 1 2 315.298 4.412 20 0 DIADLO CCOc1ccc(-c2cccc(-c3c[nH+]cn3C)c2)c(F)c1F ZINC001241179392 1056948089 /nfs/dbraw/zinc/94/80/89/1056948089.db2.gz HKGBYGMTBCZEFN-UHFFFAOYSA-N 1 2 314.335 4.431 20 0 DIADLO Cc1cn2cc(-c3cccc(O[C@@H]4CCCCO4)c3)ccc2[nH+]1 ZINC001241211268 1056960811 /nfs/dbraw/zinc/96/08/11/1056960811.db2.gz AOJOIQLTAIYVQG-LJQANCHMSA-N 1 2 308.381 4.215 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cccc(OCc2ccccc2)n1 ZINC001241235620 1056972167 /nfs/dbraw/zinc/97/21/67/1056972167.db2.gz QILWRIBPLTYHPS-UHFFFAOYSA-N 1 2 319.408 4.097 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cc(C(C)(C)C)nc(C(C)C)n1 ZINC001241239779 1056975413 /nfs/dbraw/zinc/97/54/13/1056975413.db2.gz DIRQPZPOHDRVSE-UHFFFAOYSA-N 1 2 312.461 4.334 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cc2c(nn1)CC[C@@H](C(C)(C)C)C2 ZINC001241240058 1056975441 /nfs/dbraw/zinc/97/54/41/1056975441.db2.gz HZWFOSVVTPHWBW-OAHLLOKOSA-N 1 2 324.472 4.064 20 0 DIADLO CCOc1ccc(OC)cc1-c1ccccc1Cn1cc[nH+]c1 ZINC001241240534 1056976149 /nfs/dbraw/zinc/97/61/49/1056976149.db2.gz MQEOFBCBJOESSL-UHFFFAOYSA-N 1 2 308.381 4.006 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(F)c(F)c1OC(C)C ZINC001241251920 1056980619 /nfs/dbraw/zinc/98/06/19/1056980619.db2.gz NYPCOSMAFOWOAP-UHFFFAOYSA-N 1 2 306.356 4.188 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cccc2[nH]c(C(F)(F)F)nc21 ZINC001241252430 1056981364 /nfs/dbraw/zinc/98/13/64/1056981364.db2.gz TZPPIVFUJIDYLA-UHFFFAOYSA-N 1 2 320.318 4.018 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H]2CCSc3c(F)cccc32)s1 ZINC000358285958 1056981767 /nfs/dbraw/zinc/98/17/67/1056981767.db2.gz KEJMPLIMSAMJRU-LBPRGKRZSA-N 1 2 323.462 4.127 20 0 DIADLO CCCCOc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)cc1 ZINC001241267579 1056988550 /nfs/dbraw/zinc/98/85/50/1056988550.db2.gz TZXMGQRIDFYAGO-UHFFFAOYSA-N 1 2 307.397 4.172 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)n1 ZINC000922296283 1057000004 /nfs/dbraw/zinc/00/00/04/1057000004.db2.gz CVSHSGZHLGVGJO-CQSZACIVSA-N 1 2 304.821 4.403 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1c(F)ccc(O)c1F ZINC001241293428 1057001343 /nfs/dbraw/zinc/00/13/43/1057001343.db2.gz XANDQOILCVKVIU-UHFFFAOYSA-N 1 2 304.340 4.031 20 0 DIADLO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2ccn(C(F)F)n2)cc1 ZINC000347708065 1057006544 /nfs/dbraw/zinc/00/65/44/1057006544.db2.gz RVFAEQFNMOATKJ-MRXNPFEDSA-N 1 2 321.371 4.014 20 0 DIADLO CCOc1ccc([C@H]2CCC[N@H+]2Cc2ccn(C(F)F)n2)cc1 ZINC000347708065 1057006546 /nfs/dbraw/zinc/00/65/46/1057006546.db2.gz RVFAEQFNMOATKJ-MRXNPFEDSA-N 1 2 321.371 4.014 20 0 DIADLO Cc1ncoc1CNc1[nH+]c2ccccc2n1C1CCCCC1 ZINC000922328493 1057009606 /nfs/dbraw/zinc/00/96/06/1057009606.db2.gz KDVZFVDXXFDRGL-UHFFFAOYSA-N 1 2 310.401 4.450 20 0 DIADLO c1cn(-c2ccc(C3=CCN(c4ccccc4)CC3)cc2)c[nH+]1 ZINC001241352612 1057023970 /nfs/dbraw/zinc/02/39/70/1057023970.db2.gz ZGHCUHPFGGSCOL-UHFFFAOYSA-N 1 2 301.393 4.166 20 0 DIADLO Clc1ccsc1C[NH2+]Cc1nc(-c2ccncc2)cs1 ZINC000785469910 1057024861 /nfs/dbraw/zinc/02/48/61/1057024861.db2.gz XAZJFHLKRXHISE-UHFFFAOYSA-N 1 2 321.858 4.210 20 0 DIADLO c1c[nH+]c(-c2ccc(C3=CCN(c4ccccc4)CC3)cc2)[nH]1 ZINC001241354514 1057024908 /nfs/dbraw/zinc/02/49/08/1057024908.db2.gz CJIOTFKKMLPCKJ-UHFFFAOYSA-N 1 2 301.393 4.370 20 0 DIADLO Fc1ccc(C2=CCN(c3ccccc3)CC2)cc1-n1cc[nH+]c1 ZINC001241359735 1057026155 /nfs/dbraw/zinc/02/61/55/1057026155.db2.gz BXIWFDYLLVZZAU-UHFFFAOYSA-N 1 2 319.383 4.305 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(N2CCCC2)nc1 ZINC001241375972 1057029814 /nfs/dbraw/zinc/02/98/14/1057029814.db2.gz INFXYZXMUHSOJL-UHFFFAOYSA-N 1 2 322.456 4.043 20 0 DIADLO Cc1cc(C[NH2+][C@H]2c3ccccc3OC[C@@H]2F)cc2cccnc12 ZINC000922520393 1057029968 /nfs/dbraw/zinc/02/99/68/1057029968.db2.gz MCFFETWLYPDURS-PXNSSMCTSA-N 1 2 322.383 4.105 20 0 DIADLO Cc1cc(C[NH2+][C@H]2c3ccccc3OC[C@H]2F)cc2cccnc12 ZINC000922520394 1057030021 /nfs/dbraw/zinc/03/00/21/1057030021.db2.gz MCFFETWLYPDURS-XLIONFOSSA-N 1 2 322.383 4.105 20 0 DIADLO CSc1ccc(C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)s1 ZINC000922520298 1057030230 /nfs/dbraw/zinc/03/02/30/1057030230.db2.gz LAOKKLFXEKUYCZ-SWLSCSKDSA-N 1 2 309.431 4.031 20 0 DIADLO Cc1cc(C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)cc2cccnc12 ZINC000922520395 1057030252 /nfs/dbraw/zinc/03/02/52/1057030252.db2.gz MCFFETWLYPDURS-YLJYHZDGSA-N 1 2 322.383 4.105 20 0 DIADLO Clc1ccc(C[NH2+][C@@H](c2ncccn2)C2CC2)cc1Cl ZINC000922582469 1057034654 /nfs/dbraw/zinc/03/46/54/1057034654.db2.gz NLJZIDWMUBHSCX-CQSZACIVSA-N 1 2 308.212 4.024 20 0 DIADLO c1coc(-c2nc(C[NH2+][C@H](c3ccccn3)C3CC3)cs2)c1 ZINC000922586006 1057036303 /nfs/dbraw/zinc/03/63/03/1057036303.db2.gz JEXCJJXHPJLSKH-INIZCTEOSA-N 1 2 311.410 4.039 20 0 DIADLO CCc1cc(C[NH2+][C@@H](C)c2cc(Cl)sc2Cl)[nH]n1 ZINC000765993312 1057038110 /nfs/dbraw/zinc/03/81/10/1057038110.db2.gz MMOGAVUENRBHRO-ZETCQYMHSA-N 1 2 304.246 4.191 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2ccccc2o1)c1cc(F)ccc1OC ZINC000922623924 1057040262 /nfs/dbraw/zinc/04/02/62/1057040262.db2.gz XCMWTYSAAQXZJC-CQSZACIVSA-N 1 2 314.360 4.216 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](CC)c2cc(F)ccc2OC)s1 ZINC000922620548 1057040534 /nfs/dbraw/zinc/04/05/34/1057040534.db2.gz BZNCKJOSGYYIQK-AWEZNQCLSA-N 1 2 308.422 4.094 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2ccccc2o1)c1cc(F)ccc1OC ZINC000922623923 1057040592 /nfs/dbraw/zinc/04/05/92/1057040592.db2.gz XCMWTYSAAQXZJC-AWEZNQCLSA-N 1 2 314.360 4.216 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)[C@H]1CCCC12CC2 ZINC000624936997 1057042050 /nfs/dbraw/zinc/04/20/50/1057042050.db2.gz AMTOCXDJAQBTAU-CYBMUJFWSA-N 1 2 315.804 4.045 20 0 DIADLO Fc1c(F)c(F)c(-c2ccccc2Cn2cc[nH+]c2)c(F)c1F ZINC001241409315 1057044066 /nfs/dbraw/zinc/04/40/66/1057044066.db2.gz RAIACNSLCRMEGD-UHFFFAOYSA-N 1 2 324.252 4.294 20 0 DIADLO CC(C)(/C=C/Cl)[NH2+]Cc1csc(COc2ccccc2)n1 ZINC000922649841 1057044191 /nfs/dbraw/zinc/04/41/91/1057044191.db2.gz ZMBBBGHGNXGWSR-CMDGGOBGSA-N 1 2 322.861 4.343 20 0 DIADLO CC(C)(C)c1noc(C[N@H+](Cc2ccoc2)C2CCCCC2)n1 ZINC000124931722 1057053224 /nfs/dbraw/zinc/05/32/24/1057053224.db2.gz HKCZBLWHWAQITH-UHFFFAOYSA-N 1 2 317.433 4.295 20 0 DIADLO CC(C)(C)c1noc(C[N@@H+](Cc2ccoc2)C2CCCCC2)n1 ZINC000124931722 1057053227 /nfs/dbraw/zinc/05/32/27/1057053227.db2.gz HKCZBLWHWAQITH-UHFFFAOYSA-N 1 2 317.433 4.295 20 0 DIADLO C[C@@H]([NH2+]Cc1cscc1Cl)c1nccn1-c1ccccc1 ZINC000673613186 1057053994 /nfs/dbraw/zinc/05/39/94/1057053994.db2.gz BGIIEVLBHCOODT-GFCCVEGCSA-N 1 2 317.845 4.438 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]C(c2cccs2)c2cccs2)nn1C ZINC000282369474 1057055986 /nfs/dbraw/zinc/05/59/86/1057055986.db2.gz WLOHESKHRNFTLW-GFCCVEGCSA-N 1 2 317.483 4.292 20 0 DIADLO COc1ccc(C[NH2+][C@H]2CCCC2(F)F)cc1OCC(C)C ZINC000673617861 1057062174 /nfs/dbraw/zinc/06/21/74/1057062174.db2.gz LNVVWWXXDJCQQN-INIZCTEOSA-N 1 2 313.388 4.007 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1ccncc1Br ZINC000625085549 1057086089 /nfs/dbraw/zinc/08/60/89/1057086089.db2.gz SZNAJNVPXARMJR-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccncc1Br ZINC000625085549 1057086092 /nfs/dbraw/zinc/08/60/92/1057086092.db2.gz SZNAJNVPXARMJR-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2cc(O)ccc2Cl)s1 ZINC000625156191 1057092925 /nfs/dbraw/zinc/09/29/25/1057092925.db2.gz VSRAPOCHTFIHRN-JTQLQIEISA-N 1 2 310.850 4.312 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2cc(O)ccc2Cl)s1 ZINC000625156191 1057092930 /nfs/dbraw/zinc/09/29/30/1057092930.db2.gz VSRAPOCHTFIHRN-JTQLQIEISA-N 1 2 310.850 4.312 20 0 DIADLO Cc1ccc(C)c([C@@H]2CCC[N@@H+]2Cc2noc(C3CCC3)n2)c1 ZINC000625217311 1057101737 /nfs/dbraw/zinc/10/17/37/1057101737.db2.gz FULVMOYCQKKLHE-KRWDZBQOSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1ccc(C)c([C@@H]2CCC[N@H+]2Cc2noc(C3CCC3)n2)c1 ZINC000625217311 1057101739 /nfs/dbraw/zinc/10/17/39/1057101739.db2.gz FULVMOYCQKKLHE-KRWDZBQOSA-N 1 2 311.429 4.291 20 0 DIADLO Fc1ccccc1-c1nc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)co1 ZINC000625228856 1057104596 /nfs/dbraw/zinc/10/45/96/1057104596.db2.gz AJKUWYTVMVZPEQ-KRWDZBQOSA-N 1 2 311.360 4.146 20 0 DIADLO Fc1ccccc1-c1nc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)co1 ZINC000625228856 1057104598 /nfs/dbraw/zinc/10/45/98/1057104598.db2.gz AJKUWYTVMVZPEQ-KRWDZBQOSA-N 1 2 311.360 4.146 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccc(C(=O)NC3CC3)cc2)c1 ZINC001241597840 1057104609 /nfs/dbraw/zinc/10/46/09/1057104609.db2.gz HYKUHWFUKWQBIA-UHFFFAOYSA-N 1 2 322.452 4.400 20 0 DIADLO c1cc(C[N@H+](Cc2ccccc2)Cc2ccc3occc3c2)n[nH]1 ZINC000347785795 1057104685 /nfs/dbraw/zinc/10/46/85/1057104685.db2.gz OFQOTMDPTCGMCX-UHFFFAOYSA-N 1 2 317.392 4.358 20 0 DIADLO c1cc(C[N@@H+](Cc2ccccc2)Cc2ccc3occc3c2)n[nH]1 ZINC000347785795 1057104689 /nfs/dbraw/zinc/10/46/89/1057104689.db2.gz OFQOTMDPTCGMCX-UHFFFAOYSA-N 1 2 317.392 4.358 20 0 DIADLO c1ccc([C@H]([NH2+]Cc2noc(C3CCC3)n2)C2CCCC2)cc1 ZINC000625251118 1057107724 /nfs/dbraw/zinc/10/77/24/1057107724.db2.gz CDVSCMNNMKMXTP-SFHVURJKSA-N 1 2 311.429 4.358 20 0 DIADLO Fc1ccccc1-c1nc(C[N@@H+]2CCCc3occc3C2)co1 ZINC000625432158 1057137844 /nfs/dbraw/zinc/13/78/44/1057137844.db2.gz LCAXPVOBNWXVHU-UHFFFAOYSA-N 1 2 312.344 4.022 20 0 DIADLO Fc1ccccc1-c1nc(C[N@H+]2CCCc3occc3C2)co1 ZINC000625432158 1057137845 /nfs/dbraw/zinc/13/78/45/1057137845.db2.gz LCAXPVOBNWXVHU-UHFFFAOYSA-N 1 2 312.344 4.022 20 0 DIADLO CNc1ccc(Nc2cc(-c3ccc(Cl)cc3)no2)c[nH+]1 ZINC001203448635 1057141608 /nfs/dbraw/zinc/14/16/08/1057141608.db2.gz COSSQTUDVVSECL-UHFFFAOYSA-N 1 2 300.749 4.175 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]C2(c3ccc(F)cc3)CCC2)cs1 ZINC000673894591 1057147379 /nfs/dbraw/zinc/14/73/79/1057147379.db2.gz ZOGHXIQXPJQORI-GFCCVEGCSA-N 1 2 320.433 4.159 20 0 DIADLO Cc1cccc(C)c1[C@@H]1CCC[N@@H+]1Cc1noc(C2CCC2)n1 ZINC000625529404 1057156712 /nfs/dbraw/zinc/15/67/12/1057156712.db2.gz JLSQPGJCVNPPRO-INIZCTEOSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1cccc(C)c1[C@@H]1CCC[N@H+]1Cc1noc(C2CCC2)n1 ZINC000625529404 1057156718 /nfs/dbraw/zinc/15/67/18/1057156718.db2.gz JLSQPGJCVNPPRO-INIZCTEOSA-N 1 2 311.429 4.291 20 0 DIADLO OCc1ccc(F)c(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccco2)c1 ZINC000625535251 1057157423 /nfs/dbraw/zinc/15/74/23/1057157423.db2.gz MMZPLBHUXFNEEF-GOSISDBHSA-N 1 2 315.388 4.028 20 0 DIADLO OCc1ccc(F)c(C[N@H+]2CC3(CCCC3)[C@H]2c2ccco2)c1 ZINC000625535251 1057157427 /nfs/dbraw/zinc/15/74/27/1057157427.db2.gz MMZPLBHUXFNEEF-GOSISDBHSA-N 1 2 315.388 4.028 20 0 DIADLO Nc1[nH+]ccc(F)c1NCCC(c1ccccc1)c1ccccc1 ZINC001168748669 1057158263 /nfs/dbraw/zinc/15/82/63/1057158263.db2.gz MDAUGSBAVSRHCA-UHFFFAOYSA-N 1 2 321.399 4.437 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(-c4ccccc4)nc3)nc2)c[nH+]1 ZINC001241790516 1057164800 /nfs/dbraw/zinc/16/48/00/1057164800.db2.gz IDHUDFYRVZAGGF-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO COc1cc(C(F)(F)F)ccc1-c1cn2cc[nH+]c2cc1C ZINC001241804856 1057170910 /nfs/dbraw/zinc/17/09/10/1057170910.db2.gz PPJJSFFKKPLEFA-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO CNc1ccc(Nc2cc(C)nn2-c2ccccc2Cl)c[nH+]1 ZINC001203448766 1057174712 /nfs/dbraw/zinc/17/47/12/1057174712.db2.gz JDCHCRRKJGCBQX-UHFFFAOYSA-N 1 2 313.792 4.014 20 0 DIADLO CC(C)Oc1ccc(-c2ccn3cc(N)[nH+]c3c2)cc1Cl ZINC001241825902 1057177654 /nfs/dbraw/zinc/17/76/54/1057177654.db2.gz TZECYQVUJTURFY-UHFFFAOYSA-N 1 2 301.777 4.024 20 0 DIADLO Fc1cccc([C@@H]2CC[N@@H+]2Cc2cnc(-c3ccccc3)nc2)c1 ZINC000674012395 1057177887 /nfs/dbraw/zinc/17/78/87/1057177887.db2.gz ZRQZPRNPJXDBGH-IBGZPJMESA-N 1 2 319.383 4.230 20 0 DIADLO Fc1cccc([C@@H]2CC[N@H+]2Cc2cnc(-c3ccccc3)nc2)c1 ZINC000674012395 1057177893 /nfs/dbraw/zinc/17/78/93/1057177893.db2.gz ZRQZPRNPJXDBGH-IBGZPJMESA-N 1 2 319.383 4.230 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CCC[C@H](c3ccc(F)c(F)c3)C2)s1 ZINC000625654112 1057184120 /nfs/dbraw/zinc/18/41/20/1057184120.db2.gz BSZGEBMSNSKPEX-GWCFXTLKSA-N 1 2 323.412 4.065 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CCC[C@H](c3ccc(F)c(F)c3)C2)s1 ZINC000625654112 1057184125 /nfs/dbraw/zinc/18/41/25/1057184125.db2.gz BSZGEBMSNSKPEX-GWCFXTLKSA-N 1 2 323.412 4.065 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[NH+]1C[C@H](C)C(F)(F)[C@@H](C)C1 ZINC000625653785 1057185193 /nfs/dbraw/zinc/18/51/93/1057185193.db2.gz NJKNIOASKVGWTE-RWMBFGLXSA-N 1 2 321.371 4.021 20 0 DIADLO Fc1ccc(-c2cnn(C3CCCCC3)c2)cc1-n1cc[nH+]c1 ZINC001241843576 1057187340 /nfs/dbraw/zinc/18/73/40/1057187340.db2.gz QZPKWVVJMWRVNZ-UHFFFAOYSA-N 1 2 310.376 4.380 20 0 DIADLO COc1cccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c1Cl ZINC001241858188 1057193203 /nfs/dbraw/zinc/19/32/03/1057193203.db2.gz YXYTWQCGWHZXFH-UHFFFAOYSA-N 1 2 302.683 4.012 20 0 DIADLO FC(F)C1([NH2+]Cc2cccc(OCC(F)(F)F)c2)CCCC1 ZINC000674143937 1057211003 /nfs/dbraw/zinc/21/10/03/1057211003.db2.gz FSBKXHYNVIQHQT-UHFFFAOYSA-N 1 2 323.305 4.295 20 0 DIADLO FC(F)C1([NH2+]Cc2ccc(Br)cc2)CCCC1 ZINC000674135679 1057211913 /nfs/dbraw/zinc/21/19/13/1057211913.db2.gz YIBODICNCPQRIR-UHFFFAOYSA-N 1 2 304.178 4.117 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(-c4ccccn4)cc3)nc2)c[nH+]1 ZINC001241973608 1057227693 /nfs/dbraw/zinc/22/76/93/1057227693.db2.gz IWMAETTVHNUAJO-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO CO[C@H](C)c1cccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)c1 ZINC001242040689 1057247704 /nfs/dbraw/zinc/24/77/04/1057247704.db2.gz OLXILPKYPQTKJO-GFCCVEGCSA-N 1 2 305.368 4.401 20 0 DIADLO COc1cc(-c2ccc(-c3c[nH+]cn3C)cc2)c(F)cc1F ZINC001242048242 1057250079 /nfs/dbraw/zinc/25/00/79/1057250079.db2.gz GUIXLAXPTUNNSG-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1ccc(-c2ccc(C(C)C)cc2)nn1 ZINC001242078169 1057256292 /nfs/dbraw/zinc/25/62/92/1057256292.db2.gz TVECQVOCMBRCMR-UHFFFAOYSA-N 1 2 304.397 4.220 20 0 DIADLO CNc1ccc(Nc2cccnc2Oc2ccc(F)cc2)c[nH+]1 ZINC001203448973 1057267796 /nfs/dbraw/zinc/26/77/96/1057267796.db2.gz SXAZGQLALSMESV-UHFFFAOYSA-N 1 2 310.332 4.193 20 0 DIADLO C[C@@H](C(=O)Nc1ccc2[nH+]ccn2c1)c1ccc2ccccc2c1 ZINC000674658021 1057269039 /nfs/dbraw/zinc/26/90/39/1057269039.db2.gz CPSYBYRBEQHVIZ-CQSZACIVSA-N 1 2 315.376 4.230 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)cn1 ZINC000674751366 1057280218 /nfs/dbraw/zinc/28/02/18/1057280218.db2.gz OALWARJVWVGBGI-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)cn1 ZINC000674751366 1057280222 /nfs/dbraw/zinc/28/02/22/1057280222.db2.gz OALWARJVWVGBGI-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(O)c(C(F)(F)F)c2)cc1 ZINC001242165684 1057285450 /nfs/dbraw/zinc/28/54/50/1057285450.db2.gz JLZUQDMCFDIYPJ-UHFFFAOYSA-N 1 2 318.298 4.479 20 0 DIADLO Nc1[nH+]cccc1-c1cc(F)c(OCc2ccccc2)c(F)c1 ZINC001242202513 1057292390 /nfs/dbraw/zinc/29/23/90/1057292390.db2.gz MHKADJZUCHCMPU-UHFFFAOYSA-N 1 2 312.319 4.188 20 0 DIADLO C/C(=C\C=C\[NH3+])c1cc(F)c(OCc2ccccc2)c(F)c1 ZINC001242202993 1057292418 /nfs/dbraw/zinc/29/24/18/1057292418.db2.gz ZXIDMBQRUOTNLH-PMHYKQBESA-N 1 2 301.336 4.420 20 0 DIADLO COc1ccc(-c2ccccc2)cc1C[NH2+]Cc1csc(C)n1 ZINC000674909332 1057299436 /nfs/dbraw/zinc/29/94/36/1057299436.db2.gz JIEXWCCXBFUCDS-UHFFFAOYSA-N 1 2 324.449 4.417 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cccnc1OC1CCCCC1 ZINC001242228572 1057302814 /nfs/dbraw/zinc/30/28/14/1057302814.db2.gz YLQWZQDLYAAKRQ-UHFFFAOYSA-N 1 2 311.429 4.230 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2cnccc2c1 ZINC001242246049 1057309949 /nfs/dbraw/zinc/30/99/49/1057309949.db2.gz WJSIMJCGVWLNQM-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO CCCCCC(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001128940404 1057311342 /nfs/dbraw/zinc/31/13/42/1057311342.db2.gz WXQNMNSRLPRMDO-UHFFFAOYSA-N 1 2 312.413 4.372 20 0 DIADLO CCOc1cc(Nc2cccn3cc(C)[nH+]c23)c(F)cc1F ZINC001212528941 1057314247 /nfs/dbraw/zinc/31/42/47/1057314247.db2.gz WCHQHAHSHWORFI-UHFFFAOYSA-N 1 2 303.312 4.063 20 0 DIADLO CCOc1cc(Nc2cc(Cl)c3[nH+]ccn3c2)c(F)cc1F ZINC001212529460 1057317773 /nfs/dbraw/zinc/31/77/73/1057317773.db2.gz BCQOSFZZPXJOGA-UHFFFAOYSA-N 1 2 323.730 4.408 20 0 DIADLO Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1c(Cl)cccc1Cl ZINC000675250102 1057332944 /nfs/dbraw/zinc/33/29/44/1057332944.db2.gz FYNIGVNAJOMKML-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1c(Cl)cccc1Cl ZINC000675250102 1057332952 /nfs/dbraw/zinc/33/29/52/1057332952.db2.gz FYNIGVNAJOMKML-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1c(Cl)cccc1Cl ZINC000675250100 1057333451 /nfs/dbraw/zinc/33/34/51/1057333451.db2.gz FYNIGVNAJOMKML-INIZCTEOSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1c(Cl)cccc1Cl ZINC000675250100 1057333455 /nfs/dbraw/zinc/33/34/55/1057333455.db2.gz FYNIGVNAJOMKML-INIZCTEOSA-N 1 2 324.255 4.372 20 0 DIADLO Fc1c(Cl)cccc1C[NH2+][C@@H]1COc2c1cccc2Cl ZINC000675347010 1057343679 /nfs/dbraw/zinc/34/36/79/1057343679.db2.gz SMCVAPUJYBQDAV-CYBMUJFWSA-N 1 2 312.171 4.356 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+]Cc2c(C3CCC3)cnn2C)cs1 ZINC000658268657 1057347851 /nfs/dbraw/zinc/34/78/51/1057347851.db2.gz QOAUZKMWEONVNN-LBPRGKRZSA-N 1 2 318.490 4.118 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cccnc2C(F)(F)F)cc1 ZINC001242377193 1057353991 /nfs/dbraw/zinc/35/39/91/1057353991.db2.gz SUIDUSJSCNGOFA-UHFFFAOYSA-N 1 2 303.287 4.168 20 0 DIADLO Cc1cc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c(C)o1 ZINC001242407162 1057360009 /nfs/dbraw/zinc/36/00/09/1057360009.db2.gz FXLKYKBOIUJTME-UHFFFAOYSA-N 1 2 308.381 4.206 20 0 DIADLO Cc1cc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c(C)o1 ZINC001242407162 1057360014 /nfs/dbraw/zinc/36/00/14/1057360014.db2.gz FXLKYKBOIUJTME-UHFFFAOYSA-N 1 2 308.381 4.206 20 0 DIADLO CCc1cc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)cs1 ZINC001212569157 1057386138 /nfs/dbraw/zinc/38/61/38/1057386138.db2.gz PFDWIGDFIMXUFB-UHFFFAOYSA-N 1 2 322.393 4.213 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2ccc(Cl)c(Cl)c2C)cc1 ZINC001242516712 1057392144 /nfs/dbraw/zinc/39/21/44/1057392144.db2.gz MNDNUWOFMQFTOI-OAHLLOKOSA-N 1 2 324.207 4.142 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(C)cc1C(F)(F)F ZINC001242561767 1057405950 /nfs/dbraw/zinc/40/59/50/1057405950.db2.gz UFDCBADMHSKQLA-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cnc(C(F)(F)F)nc2)c1 ZINC001242663830 1057439186 /nfs/dbraw/zinc/43/91/86/1057439186.db2.gz LDWNVSVWXQJNNP-UHFFFAOYSA-N 1 2 309.335 4.317 20 0 DIADLO Cc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)cc1C(F)(F)F ZINC001242671861 1057441626 /nfs/dbraw/zinc/44/16/26/1057441626.db2.gz BCNVDCGOMDVAEA-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO C[N@H+](CCOC(C)(C)C)Cc1csc(-c2ccc(F)cc2)n1 ZINC000676041869 1057446308 /nfs/dbraw/zinc/44/63/08/1057446308.db2.gz BZKZMBVPBQKVGS-UHFFFAOYSA-N 1 2 322.449 4.196 20 0 DIADLO C[N@@H+](CCOC(C)(C)C)Cc1csc(-c2ccc(F)cc2)n1 ZINC000676041869 1057446311 /nfs/dbraw/zinc/44/63/11/1057446311.db2.gz BZKZMBVPBQKVGS-UHFFFAOYSA-N 1 2 322.449 4.196 20 0 DIADLO O=C(CCCn1cc[nH+]c1)N1CCC[C@@H]1CCC1CCCCC1 ZINC000676064751 1057446994 /nfs/dbraw/zinc/44/69/94/1057446994.db2.gz ZVTMIDZZCLIZCX-GOSISDBHSA-N 1 2 317.477 4.015 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1nc(C)sc1C)c1cccc(Cl)c1 ZINC000676196925 1057455826 /nfs/dbraw/zinc/45/58/26/1057455826.db2.gz FVFBXEMHCZYMEO-MEBBXXQBSA-N 1 2 324.877 4.452 20 0 DIADLO Cc1cc(-c2ccc(OCC(F)(F)F)cc2)c2[nH+]ccn2c1 ZINC001242720936 1057459333 /nfs/dbraw/zinc/45/93/33/1057459333.db2.gz FGSPMCKCDYZYSO-UHFFFAOYSA-N 1 2 306.287 4.251 20 0 DIADLO COC(=[NH2+])c1cccc(-c2ccc(OCC(F)(F)F)cc2)c1 ZINC001242721062 1057459479 /nfs/dbraw/zinc/45/94/79/1057459479.db2.gz XFDLSPQFARNQLK-UHFFFAOYSA-N 1 2 309.287 4.266 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc(OCC(F)(F)F)cc1 ZINC001242721671 1057460104 /nfs/dbraw/zinc/46/01/04/1057460104.db2.gz ZCCWXMROEMDOQH-UHFFFAOYSA-N 1 2 322.286 4.180 20 0 DIADLO Cc1cccn2c(CNc3ccc4c(cnn4C(C)C)c3)c[nH+]c12 ZINC000676324864 1057465868 /nfs/dbraw/zinc/46/58/68/1057465868.db2.gz UFJXKIZESMZMPN-UHFFFAOYSA-N 1 2 319.412 4.185 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2ccccc2n1 ZINC001242776120 1057470801 /nfs/dbraw/zinc/47/08/01/1057470801.db2.gz QMPVODHYCICUCX-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO Oc1cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc(C(F)(F)F)c1 ZINC001242783353 1057474981 /nfs/dbraw/zinc/47/49/81/1057474981.db2.gz OFKQKDQASYBAAS-UHFFFAOYSA-N 1 2 322.261 4.403 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(SC)cc1F ZINC001242813866 1057488905 /nfs/dbraw/zinc/48/89/05/1057488905.db2.gz MORODZWRHFZIKB-UHFFFAOYSA-N 1 2 314.385 4.409 20 0 DIADLO Nc1[nH+]ccn1-c1ccc(-c2cc(Cl)c(O)c(Cl)c2)cc1 ZINC001242853465 1057499776 /nfs/dbraw/zinc/49/97/76/1057499776.db2.gz TXSGJFGWHHUQRH-UHFFFAOYSA-N 1 2 320.179 4.134 20 0 DIADLO C[C@H]([NH2+]Cc1ccsc1Cl)c1nc2ccccc2n1C ZINC000312884352 1057501138 /nfs/dbraw/zinc/50/11/38/1057501138.db2.gz XWUHHCJJWIWNFF-JTQLQIEISA-N 1 2 305.834 4.139 20 0 DIADLO Sc1cccc(-c2ccc3ncn([C@H]4CCC[NH2+]CC4)c3c2)c1 ZINC001242864894 1057504855 /nfs/dbraw/zinc/50/48/55/1057504855.db2.gz XBVUHTANNIZBCX-INIZCTEOSA-N 1 2 323.465 4.307 20 0 DIADLO Sc1cccc(-c2ccc(-c3c[nH]c([C@@H]4CCC[NH2+]4)n3)cc2)c1 ZINC001242866711 1057505740 /nfs/dbraw/zinc/50/57/40/1057505740.db2.gz GBNSUONAVGYGRD-KRWDZBQOSA-N 1 2 321.449 4.457 20 0 DIADLO [NH3+][C@H]1CCCC[C@@H]1OCc1ccccc1-c1cccc(S)c1 ZINC001242867674 1057505801 /nfs/dbraw/zinc/50/58/01/1057505801.db2.gz NPJMNEUPVQJZIJ-OALUTQOASA-N 1 2 313.466 4.429 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)C)no2)cc1 ZINC000073637370 1057508451 /nfs/dbraw/zinc/50/84/51/1057508451.db2.gz MUIHZCAPQBNVJX-OLZOCXBDSA-N 1 2 303.406 4.004 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)C)no2)cc1 ZINC000073637371 1057509111 /nfs/dbraw/zinc/50/91/11/1057509111.db2.gz MUIHZCAPQBNVJX-STQMWFEESA-N 1 2 303.406 4.004 20 0 DIADLO FC(F)n1c2ccccc2nc1C[N@@H+]1CCCC(F)(F)CC1 ZINC000625767602 1057512497 /nfs/dbraw/zinc/51/24/97/1057512497.db2.gz MRWHEVBEYWAXFI-UHFFFAOYSA-N 1 2 315.314 4.053 20 0 DIADLO FC(F)n1c2ccccc2nc1C[N@H+]1CCCC(F)(F)CC1 ZINC000625767602 1057512501 /nfs/dbraw/zinc/51/25/01/1057512501.db2.gz MRWHEVBEYWAXFI-UHFFFAOYSA-N 1 2 315.314 4.053 20 0 DIADLO C=C(c1ccccc1)c1cc(F)cc(C)c1C[NH+]1CCOCC1 ZINC001242891997 1057514272 /nfs/dbraw/zinc/51/42/72/1057514272.db2.gz DGUPRNVTKDDOGH-UHFFFAOYSA-N 1 2 311.400 4.028 20 0 DIADLO CCc1onc(C)c1C[NH2+]Cc1csc(-c2ccsc2)n1 ZINC000922989031 1057519746 /nfs/dbraw/zinc/51/97/46/1057519746.db2.gz XQQXXJJFFYIESU-UHFFFAOYSA-N 1 2 319.455 4.020 20 0 DIADLO C[C@]1([NH2+]Cc2coc(-c3ccccc3)n2)CCOc2ccccc21 ZINC000923025907 1057521828 /nfs/dbraw/zinc/52/18/28/1057521828.db2.gz ROUBZBAAXONIIA-FQEVSTJZSA-N 1 2 320.392 4.129 20 0 DIADLO CC[C@H](Nc1cc(C)[nH+]c(C2CC2)n1)c1cccc(Cl)c1 ZINC000463016553 1057547659 /nfs/dbraw/zinc/54/76/59/1057547659.db2.gz URHXCLHJHWXIDF-HNNXBMFYSA-N 1 2 301.821 4.879 20 0 DIADLO Cc1nc(N[C@H](C)c2ccccc2Oc2ccccc2)cc[nH+]1 ZINC000462795221 1057549131 /nfs/dbraw/zinc/54/91/31/1057549131.db2.gz PRSUJXVHJAFNHG-CQSZACIVSA-N 1 2 305.381 4.750 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCc2c(O)cccc2C1 ZINC000626027040 1057550696 /nfs/dbraw/zinc/55/06/96/1057550696.db2.gz IZNJGTVGERBDNS-AWEZNQCLSA-N 1 2 320.392 4.167 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCc2c(O)cccc2C1 ZINC000626027040 1057550705 /nfs/dbraw/zinc/55/07/05/1057550705.db2.gz IZNJGTVGERBDNS-AWEZNQCLSA-N 1 2 320.392 4.167 20 0 DIADLO Clc1cc(Cl)cc(CNc2ccc(N3CCCC3)c[nH+]2)c1 ZINC000550670494 1057552058 /nfs/dbraw/zinc/55/20/58/1057552058.db2.gz GJOQCTMSINPXEI-UHFFFAOYSA-N 1 2 322.239 4.601 20 0 DIADLO CCc1ccc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)cn1 ZINC000347923556 1057552887 /nfs/dbraw/zinc/55/28/87/1057552887.db2.gz VBOBSTQQUJHGDW-LBPRGKRZSA-N 1 2 302.368 4.042 20 0 DIADLO CCc1ccc(C[N@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)cn1 ZINC000347923556 1057552892 /nfs/dbraw/zinc/55/28/92/1057552892.db2.gz VBOBSTQQUJHGDW-LBPRGKRZSA-N 1 2 302.368 4.042 20 0 DIADLO Cc1cc(-c2ccc(C(F)(F)F)nc2Cl)c2[nH+]ccn2c1 ZINC001243036633 1057553363 /nfs/dbraw/zinc/55/33/63/1057553363.db2.gz LUDBMRUYISJOSO-UHFFFAOYSA-N 1 2 311.694 4.377 20 0 DIADLO Cc1cc(F)cc(C)c1-c1cc(F)ccc1C[NH+]1CCOCC1 ZINC001243084273 1057565911 /nfs/dbraw/zinc/56/59/11/1057565911.db2.gz IOPIKWWLTJEOOE-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO CSc1cccc(-c2cc(F)ccc2C[NH+]2CCOCC2)c1 ZINC001243086289 1057566370 /nfs/dbraw/zinc/56/63/70/1057566370.db2.gz XCHNRBYKFKGOEM-UHFFFAOYSA-N 1 2 317.429 4.047 20 0 DIADLO Nc1cc(-c2ccc(Cl)nc2Cl)[nH+]cc1C(F)(F)F ZINC001243086397 1057566659 /nfs/dbraw/zinc/56/66/59/1057566659.db2.gz WLVPMLJGINJPKK-UHFFFAOYSA-N 1 2 308.090 4.051 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(Cl)nc2Cl)cc1 ZINC001243087752 1057567284 /nfs/dbraw/zinc/56/72/84/1057567284.db2.gz FGHDTYDYNHPDJW-UHFFFAOYSA-N 1 2 304.180 4.456 20 0 DIADLO c1coc([C@@H]([NH2+]Cc2scnc2C2CC2)c2ccccc2)c1 ZINC000486985688 1057571226 /nfs/dbraw/zinc/57/12/26/1057571226.db2.gz HVOGTMIVMMGLGK-KRWDZBQOSA-N 1 2 310.422 4.493 20 0 DIADLO CCCOc1ccccc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001243128574 1057582177 /nfs/dbraw/zinc/58/21/77/1057582177.db2.gz RWVDODVGAYJNOA-UHFFFAOYSA-N 1 2 305.368 4.482 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2ncc[nH]2)c(OCCCC(C)C)c1 ZINC000513716686 1057623346 /nfs/dbraw/zinc/62/33/46/1057623346.db2.gz GLHRDNPYEULXHP-MRXNPFEDSA-N 1 2 315.461 4.384 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2ncc[nH]2)c(O[C@H](C)CC(C)C)c1 ZINC000513690872 1057623601 /nfs/dbraw/zinc/62/36/01/1057623601.db2.gz NJZYRBKQINCDHT-CVEARBPZSA-N 1 2 315.461 4.382 20 0 DIADLO CCCCCOc1cc(C)ccc1C[NH2+][C@@H](C)c1ncc[nH]1 ZINC000513673696 1057623849 /nfs/dbraw/zinc/62/38/49/1057623849.db2.gz WCYOTKXKFNTPLF-HNNXBMFYSA-N 1 2 301.434 4.138 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](C)Cc1csc2ccccc12 ZINC000727222311 1057642733 /nfs/dbraw/zinc/64/27/33/1057642733.db2.gz XFAWPCJTKCWMNO-UHFFFAOYSA-N 1 2 319.861 4.229 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](C)Cc1csc2ccccc12 ZINC000727222311 1057642738 /nfs/dbraw/zinc/64/27/38/1057642738.db2.gz XFAWPCJTKCWMNO-UHFFFAOYSA-N 1 2 319.861 4.229 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cc(Cl)cc3n[nH]cc32)c1 ZINC001243317253 1057643875 /nfs/dbraw/zinc/64/38/75/1057643875.db2.gz VOKQKUSHLWSNET-UHFFFAOYSA-N 1 2 308.772 4.284 20 0 DIADLO Cc1cccc(-c2nnc([C@@H](C)[N@H+](C)Cc3ccsc3)o2)c1 ZINC000727269234 1057645359 /nfs/dbraw/zinc/64/53/59/1057645359.db2.gz LXVVMPWEUOUTTD-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1cccc(-c2nnc([C@@H](C)[N@@H+](C)Cc3ccsc3)o2)c1 ZINC000727269234 1057645360 /nfs/dbraw/zinc/64/53/60/1057645360.db2.gz LXVVMPWEUOUTTD-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2coc(C3CC3)n2)c1 ZINC000727467378 1057655611 /nfs/dbraw/zinc/65/56/11/1057655611.db2.gz UYWBBEYTVKPKGS-ZDUSSCGKSA-N 1 2 300.402 4.190 20 0 DIADLO Clc1nccc(-c2ccc(Cn3cc[nH+]c3)cc2)c1Cl ZINC001243416125 1057676458 /nfs/dbraw/zinc/67/64/58/1057676458.db2.gz MGTMCCQZWQAGGJ-UHFFFAOYSA-N 1 2 304.180 4.300 20 0 DIADLO CCOc1cc(C)ccc1-c1ccc(-n2cc[nH+]c2)cc1OC ZINC001243415509 1057676677 /nfs/dbraw/zinc/67/66/77/1057676677.db2.gz NGKLFYXAXULEMB-UHFFFAOYSA-N 1 2 308.381 4.255 20 0 DIADLO CCC[N@H+](CC)Cn1nc(-c2cccc(C)c2)n(CC)c1=S ZINC000727821752 1057677484 /nfs/dbraw/zinc/67/74/84/1057677484.db2.gz PVDLGDHFOFWRCI-UHFFFAOYSA-N 1 2 318.490 4.099 20 0 DIADLO CCC[N@@H+](CC)Cn1nc(-c2cccc(C)c2)n(CC)c1=S ZINC000727821752 1057677488 /nfs/dbraw/zinc/67/74/88/1057677488.db2.gz PVDLGDHFOFWRCI-UHFFFAOYSA-N 1 2 318.490 4.099 20 0 DIADLO C[N@H+](CCC1CCCCC1)Cn1ncn(C(C)(C)C)c1=S ZINC000727823643 1057677643 /nfs/dbraw/zinc/67/76/43/1057677643.db2.gz WFCKIAWRVXDWRA-UHFFFAOYSA-N 1 2 310.511 4.029 20 0 DIADLO C[N@@H+](CCC1CCCCC1)Cn1ncn(C(C)(C)C)c1=S ZINC000727823643 1057677644 /nfs/dbraw/zinc/67/76/44/1057677644.db2.gz WFCKIAWRVXDWRA-UHFFFAOYSA-N 1 2 310.511 4.029 20 0 DIADLO Cc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)c(OC(C)C)c1 ZINC001243419449 1057677880 /nfs/dbraw/zinc/67/78/80/1057677880.db2.gz ADWOMDJPMUWFNQ-UHFFFAOYSA-N 1 2 307.397 4.089 20 0 DIADLO CN(C)c1cc(-c2ccc(CNc3ccccc3)cc2)cc[nH+]1 ZINC001243440160 1057684962 /nfs/dbraw/zinc/68/49/62/1057684962.db2.gz RFRXMUVZKBWLRS-UHFFFAOYSA-N 1 2 303.409 4.427 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2nccn2CC(F)(F)F)C1 ZINC000285535349 1057685949 /nfs/dbraw/zinc/68/59/49/1057685949.db2.gz FPXPXCZRFQIEEI-HIFRSBDPSA-N 1 2 323.362 4.029 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2nccn2CC(F)(F)F)C1 ZINC000285535349 1057685952 /nfs/dbraw/zinc/68/59/52/1057685952.db2.gz FPXPXCZRFQIEEI-HIFRSBDPSA-N 1 2 323.362 4.029 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCSc2c(F)cccc21)c1c(F)cncc1F ZINC000285731390 1057686451 /nfs/dbraw/zinc/68/64/51/1057686451.db2.gz QTUGBYVTAIHUFO-OTYXRUKQSA-N 1 2 324.371 4.387 20 0 DIADLO C[C@H]([NH2+][C@H]1CCSc2c(F)cccc21)c1c(F)cncc1F ZINC000285731396 1057686707 /nfs/dbraw/zinc/68/67/07/1057686707.db2.gz QTUGBYVTAIHUFO-XPTSAGLGSA-N 1 2 324.371 4.387 20 0 DIADLO Nc1[nH+]cccc1-c1c(C(F)(F)F)cccc1C(F)(F)F ZINC001243475345 1057691185 /nfs/dbraw/zinc/69/11/85/1057691185.db2.gz WEJYKKWWFBZMSY-UHFFFAOYSA-N 1 2 306.209 4.368 20 0 DIADLO Nc1[nH+]cccc1-c1ccc(F)c(C(F)(F)C(F)(F)F)c1 ZINC001243477070 1057691263 /nfs/dbraw/zinc/69/12/63/1057691263.db2.gz ICXGUIUGOUYGBS-UHFFFAOYSA-N 1 2 306.209 4.124 20 0 DIADLO CCO[C@@H](C)Oc1ccc2cc(-c3ccc[nH+]c3N)ccc2c1 ZINC001243477510 1057691289 /nfs/dbraw/zinc/69/12/89/1057691289.db2.gz RGMCRFMPSOAAEQ-CYBMUJFWSA-N 1 2 308.381 4.245 20 0 DIADLO CCc1csc(SCc2ccc(-n3cc[nH+]c3)cc2C)n1 ZINC001166600787 1057692409 /nfs/dbraw/zinc/69/24/09/1057692409.db2.gz LNJLGMCEBNZRNP-UHFFFAOYSA-N 1 2 315.467 4.492 20 0 DIADLO C[N@H+](CC1CCCC1)Cn1nc(-c2ccccc2)sc1=S ZINC000729981382 1057699985 /nfs/dbraw/zinc/69/99/85/1057699985.db2.gz NGXRRZAWEXQVNY-UHFFFAOYSA-N 1 2 319.499 4.421 20 0 DIADLO C[N@@H+](CC1CCCC1)Cn1nc(-c2ccccc2)sc1=S ZINC000729981382 1057699986 /nfs/dbraw/zinc/69/99/86/1057699986.db2.gz NGXRRZAWEXQVNY-UHFFFAOYSA-N 1 2 319.499 4.421 20 0 DIADLO S=c1sc(-c2ccccc2)nn1C[N@@H+]1CCC[C@@H]1C1CC1 ZINC000729983976 1057700055 /nfs/dbraw/zinc/70/00/55/1057700055.db2.gz RIRMSDCBHZIWAN-CQSZACIVSA-N 1 2 317.483 4.173 20 0 DIADLO S=c1sc(-c2ccccc2)nn1C[N@H+]1CCC[C@@H]1C1CC1 ZINC000729983976 1057700059 /nfs/dbraw/zinc/70/00/59/1057700059.db2.gz RIRMSDCBHZIWAN-CQSZACIVSA-N 1 2 317.483 4.173 20 0 DIADLO CCOc1cc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c(F)cc1F ZINC001243527996 1057703381 /nfs/dbraw/zinc/70/33/81/1057703381.db2.gz QXZAXMVKOGXBCO-UHFFFAOYSA-N 1 2 318.245 4.027 20 0 DIADLO CCOc1cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)ccc1OC ZINC001243540764 1057708090 /nfs/dbraw/zinc/70/80/90/1057708090.db2.gz APNFXMJTZRQPJD-UHFFFAOYSA-N 1 2 312.344 4.086 20 0 DIADLO CCCC[N@H+](Cn1nc(-c2sccc2C)oc1=S)C1CC1 ZINC000730250668 1057709497 /nfs/dbraw/zinc/70/94/97/1057709497.db2.gz ASRJSOITEIFXPK-UHFFFAOYSA-N 1 2 323.487 4.465 20 0 DIADLO CCCC[N@@H+](Cn1nc(-c2sccc2C)oc1=S)C1CC1 ZINC000730250668 1057709501 /nfs/dbraw/zinc/70/95/01/1057709501.db2.gz ASRJSOITEIFXPK-UHFFFAOYSA-N 1 2 323.487 4.465 20 0 DIADLO FC(F)(F)c1cccnc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243657166 1057745523 /nfs/dbraw/zinc/74/55/23/1057745523.db2.gz KYEKQILGQHVPTB-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO c1csc(-c2cc(-c3ccc(Cn4cc[nH+]c4)cc3)ncn2)c1 ZINC001243657187 1057745595 /nfs/dbraw/zinc/74/55/95/1057745595.db2.gz RRFPKLYIGRZITQ-UHFFFAOYSA-N 1 2 318.405 4.117 20 0 DIADLO c1cn(Cc2ccc(-c3cc(-c4ccccc4)ncn3)cc2)c[nH+]1 ZINC001243656930 1057745652 /nfs/dbraw/zinc/74/56/52/1057745652.db2.gz LCDOJFGLTAGHIA-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO Cc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)ncc1C(F)(F)F ZINC001243655817 1057745710 /nfs/dbraw/zinc/74/57/10/1057745710.db2.gz FBCFHKLQYQBPLV-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO COc1cccc2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)nc21 ZINC001243657180 1057745762 /nfs/dbraw/zinc/74/57/62/1057745762.db2.gz LNLAUVWZYQYNKS-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Cc1c(F)c(F)cc(-c2ccc(Cn3cc[nH+]c3)cc2)c1F ZINC001243658727 1057746098 /nfs/dbraw/zinc/74/60/98/1057746098.db2.gz GCTVGFGXSSAQEX-UHFFFAOYSA-N 1 2 302.299 4.324 20 0 DIADLO Fc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)ccc1OC(F)F ZINC001243658972 1057746150 /nfs/dbraw/zinc/74/61/50/1057746150.db2.gz WIWCWSBQRPTDJI-UHFFFAOYSA-N 1 2 318.298 4.339 20 0 DIADLO Cc1[nH]c2ncc(-c3ccc(Cn4cc[nH+]c4)cc3)cc2c1C ZINC001243658042 1057746301 /nfs/dbraw/zinc/74/63/01/1057746301.db2.gz BFOZJDYHWKDRKB-UHFFFAOYSA-N 1 2 302.381 4.092 20 0 DIADLO COc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)nc2ccccc21 ZINC001243658218 1057746589 /nfs/dbraw/zinc/74/65/89/1057746589.db2.gz UOSHQSZOGMCTMI-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Fc1cc2cnccc2cc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243660273 1057747177 /nfs/dbraw/zinc/74/71/77/1057747177.db2.gz SVLIYJLPMGXRJC-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO CCOC(=O)c1ccc(C)c(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243663125 1057748683 /nfs/dbraw/zinc/74/86/83/1057748683.db2.gz VJIMGVIXERLIBV-UHFFFAOYSA-N 1 2 320.392 4.084 20 0 DIADLO C/C(=C/C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc(F)c1 ZINC000732066225 1057767172 /nfs/dbraw/zinc/76/71/72/1057767172.db2.gz LGDUYVHSEAAEOU-QBFSEMIESA-N 1 2 321.355 4.258 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1cc(F)ccc1F ZINC000732210237 1057769169 /nfs/dbraw/zinc/76/91/69/1057769169.db2.gz RBZUGEANODBPIU-BIENJYKASA-N 1 2 317.379 4.315 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@H+]1Cc1cc(F)ccc1F ZINC000732210237 1057769172 /nfs/dbraw/zinc/76/91/72/1057769172.db2.gz RBZUGEANODBPIU-BIENJYKASA-N 1 2 317.379 4.315 20 0 DIADLO CC[C@@H](C)C[N@H+](C)Cn1nc(-c2sccc2C)oc1=S ZINC000732181899 1057769231 /nfs/dbraw/zinc/76/92/31/1057769231.db2.gz BVPNUVXXEDDXEB-SNVBAGLBSA-N 1 2 311.476 4.178 20 0 DIADLO CC[C@@H](C)C[N@@H+](C)Cn1nc(-c2sccc2C)oc1=S ZINC000732181899 1057769233 /nfs/dbraw/zinc/76/92/33/1057769233.db2.gz BVPNUVXXEDDXEB-SNVBAGLBSA-N 1 2 311.476 4.178 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1ccc(F)c(F)c1 ZINC000732209997 1057769848 /nfs/dbraw/zinc/76/98/48/1057769848.db2.gz YTCWYCDIVVBFCA-PJIJBLCYSA-N 1 2 317.379 4.315 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1ccc(F)c(F)c1 ZINC000732209997 1057769852 /nfs/dbraw/zinc/76/98/52/1057769852.db2.gz YTCWYCDIVVBFCA-PJIJBLCYSA-N 1 2 317.379 4.315 20 0 DIADLO COc1ccc(-c2cc[nH+]c(N3CCCCC3)c2)cc1SC ZINC001243748933 1057770182 /nfs/dbraw/zinc/77/01/82/1057770182.db2.gz KFBJIUWSKWYQRD-UHFFFAOYSA-N 1 2 314.454 4.469 20 0 DIADLO Cc1cn2cc(-c3cccc(NC(=O)OC(C)(C)C)n3)ccc2[nH+]1 ZINC001243757601 1057771973 /nfs/dbraw/zinc/77/19/73/1057771973.db2.gz CUSVPMBXTYQOLY-UHFFFAOYSA-N 1 2 324.384 4.052 20 0 DIADLO Clc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c2c[nH]nc21 ZINC001243781358 1057777762 /nfs/dbraw/zinc/77/77/62/1057777762.db2.gz SUAJFKXILFAYAU-UHFFFAOYSA-N 1 2 308.772 4.128 20 0 DIADLO CC(C)c1cc(C[NH2+][C@H](C)c2cc(-c3ccccc3)no2)on1 ZINC000822285018 1057796731 /nfs/dbraw/zinc/79/67/31/1057796731.db2.gz HLIMNHYBEMWNNH-CYBMUJFWSA-N 1 2 311.385 4.304 20 0 DIADLO Cc1csc2ccc(-c3cc[nH+]c(N4CCOCC4)c3)cc12 ZINC001243901957 1057802451 /nfs/dbraw/zinc/80/24/51/1057802451.db2.gz JRRREVHBTPBODI-UHFFFAOYSA-N 1 2 310.422 4.108 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1cccnc1Cl ZINC000733192716 1057806757 /nfs/dbraw/zinc/80/67/57/1057806757.db2.gz NDYYTRKIJSDISB-UHFFFAOYSA-N 1 2 314.820 4.345 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1ncc(C(C)C)o1 ZINC000733309192 1057810729 /nfs/dbraw/zinc/81/07/29/1057810729.db2.gz DXMHMXMHRYLVHY-OAHLLOKOSA-N 1 2 300.402 4.144 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1ncc(C(C)C)o1 ZINC000733309192 1057810735 /nfs/dbraw/zinc/81/07/35/1057810735.db2.gz DXMHMXMHRYLVHY-OAHLLOKOSA-N 1 2 300.402 4.144 20 0 DIADLO CC(C)c1cnc(C[NH2+]C2(c3ccc(F)cc3)CCCC2)o1 ZINC000733310739 1057811934 /nfs/dbraw/zinc/81/19/34/1057811934.db2.gz UROWIBLDSZBEBM-UHFFFAOYSA-N 1 2 302.393 4.496 20 0 DIADLO Cc1sc2nc(-c3cccnc3)nc(C3=C[NH2+]CCC3)c2c1C ZINC001243948336 1057817641 /nfs/dbraw/zinc/81/76/41/1057817641.db2.gz BHAIKQNRSNGYTQ-UHFFFAOYSA-N 1 2 322.437 4.094 20 0 DIADLO COc1ccc(-c2csc3ncnc(C4=C[NH2+]CCC4)c23)cc1 ZINC001243949610 1057818192 /nfs/dbraw/zinc/81/81/92/1057818192.db2.gz VPSDPJVOYJDAAH-UHFFFAOYSA-N 1 2 323.421 4.091 20 0 DIADLO COc1cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)ccc1OC(F)F ZINC001243975799 1057825565 /nfs/dbraw/zinc/82/55/65/1057825565.db2.gz ATVAFRUSWYPKIB-UHFFFAOYSA-N 1 2 316.307 4.354 20 0 DIADLO CCOC(=O)/C=C/c1cccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001243976647 1057826266 /nfs/dbraw/zinc/82/62/66/1057826266.db2.gz SJGILXFLPKHOMV-IZZDOVSWSA-N 1 2 318.376 4.320 20 0 DIADLO CC(C)[S@](=O)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001243976910 1057826393 /nfs/dbraw/zinc/82/63/93/1057826393.db2.gz VSECWQFJUFNAKL-QFIPXVFZSA-N 1 2 310.422 4.260 20 0 DIADLO CCOC(=O)CCc1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001243977531 1057827092 /nfs/dbraw/zinc/82/70/92/1057827092.db2.gz LFQIUWSNTYCCKG-UHFFFAOYSA-N 1 2 320.392 4.239 20 0 DIADLO COC(=O)C(C)(C)c1cccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001243977584 1057827176 /nfs/dbraw/zinc/82/71/76/1057827176.db2.gz NLOJOIFFEQLQGQ-UHFFFAOYSA-N 1 2 320.392 4.194 20 0 DIADLO O=C1CCCc2cc(-c3ccc(-c4[nH]cc[nH+]4)cc3)ccc2N1 ZINC001243977907 1057827535 /nfs/dbraw/zinc/82/75/35/1057827535.db2.gz AUKVVPWREFCITH-UHFFFAOYSA-N 1 2 303.365 4.019 20 0 DIADLO CC(C)COc1ccccc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001244051653 1057850287 /nfs/dbraw/zinc/85/02/87/1057850287.db2.gz GYJRNLORDXKLTO-UHFFFAOYSA-N 1 2 310.319 4.384 20 0 DIADLO COc1cccc(C(F)(F)F)c1-c1cc(C)cn2cc[nH+]c12 ZINC001244082433 1057862720 /nfs/dbraw/zinc/86/27/20/1057862720.db2.gz YWGFPNZNSYPGSD-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Cn1ccc2c[nH+]c(-c3ccc(C(C)(C)C(F)(F)F)cc3)nc21 ZINC001244101021 1057869726 /nfs/dbraw/zinc/86/97/26/1057869726.db2.gz RSJOPOONSMFLIA-UHFFFAOYSA-N 1 2 319.330 4.475 20 0 DIADLO COc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)cc1C(C)C ZINC001244129458 1057879928 /nfs/dbraw/zinc/87/99/28/1057879928.db2.gz KMTBRMDWMGGFIX-UHFFFAOYSA-N 1 2 307.397 4.125 20 0 DIADLO COc1cc(-c2c[nH+]c3c(c2)CCCN3)ccc1-c1ccccc1 ZINC001244152461 1057887414 /nfs/dbraw/zinc/88/74/14/1057887414.db2.gz YQCPRSRWUVQTEY-UHFFFAOYSA-N 1 2 316.404 4.425 20 0 DIADLO Cn1ccc2c[nH+]c(-c3ccc(COc4ccccc4)cc3)nc21 ZINC001244183889 1057893940 /nfs/dbraw/zinc/89/39/40/1057893940.db2.gz FHUVCKGMIKRYCR-UHFFFAOYSA-N 1 2 315.376 4.214 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccccc2N2CCCC2)cc1F ZINC001244185726 1057895137 /nfs/dbraw/zinc/89/51/37/1057895137.db2.gz NAOUOBZUYLFZKE-UHFFFAOYSA-N 1 2 316.395 4.294 20 0 DIADLO Cc1ncc(C(F)(F)F)cc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001244257073 1057913634 /nfs/dbraw/zinc/91/36/34/1057913634.db2.gz KGVIIVBXWRMXDA-UHFFFAOYSA-N 1 2 303.287 4.262 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(CC(F)(F)F)nc2)cc1 ZINC001244295103 1057925206 /nfs/dbraw/zinc/92/52/06/1057925206.db2.gz MCVROUYIGDIFJB-UHFFFAOYSA-N 1 2 317.314 4.254 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1c(Cl)ccc(F)c1F ZINC001244308160 1057929846 /nfs/dbraw/zinc/92/98/46/1057929846.db2.gz NTQIBCVJGLICIQ-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO Nc1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1C(F)(F)F ZINC001244366399 1057945271 /nfs/dbraw/zinc/94/52/71/1057945271.db2.gz CGYHJXMGIWXHSA-UHFFFAOYSA-N 1 2 303.287 4.345 20 0 DIADLO Cc1ccc(C)c(NC(=O)c2ccc(-c3ccc(N)[nH+]c3)cc2)c1 ZINC001244390194 1057949121 /nfs/dbraw/zinc/94/91/21/1057949121.db2.gz XMOKFNAIDTUQJK-UHFFFAOYSA-N 1 2 317.392 4.200 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(N(C)C)c(Cl)c2)c1 ZINC001244415319 1057954163 /nfs/dbraw/zinc/95/41/63/1057954163.db2.gz WTMWMACDXGNXAG-UHFFFAOYSA-N 1 2 302.805 4.435 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(C)c(OC(C)C)c3)nn2)c1C ZINC001244442327 1057959264 /nfs/dbraw/zinc/95/92/64/1057959264.db2.gz AFJBQTAERMSLCV-UHFFFAOYSA-N 1 2 322.412 4.042 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(Cl)cc1O ZINC001244470062 1057968834 /nfs/dbraw/zinc/96/88/34/1057968834.db2.gz XXIWEUZVMUIESS-UHFFFAOYSA-N 1 2 302.805 4.406 20 0 DIADLO C[N@@H+]1CCCC[C@H]1c1ccc(-c2cc(F)c(O)c(Cl)c2)nc1 ZINC001244499856 1057976494 /nfs/dbraw/zinc/97/64/94/1057976494.db2.gz LQICPSJNXGHUOJ-INIZCTEOSA-N 1 2 320.795 4.404 20 0 DIADLO C[N@H+]1CCCC[C@H]1c1ccc(-c2cc(F)c(O)c(Cl)c2)nc1 ZINC001244499856 1057976496 /nfs/dbraw/zinc/97/64/96/1057976496.db2.gz LQICPSJNXGHUOJ-INIZCTEOSA-N 1 2 320.795 4.404 20 0 DIADLO C[N@@H+]1CCCC[C@@H]1c1ccc(-c2cc(F)c(O)c(Cl)c2)nc1 ZINC001244499858 1057976558 /nfs/dbraw/zinc/97/65/58/1057976558.db2.gz LQICPSJNXGHUOJ-MRXNPFEDSA-N 1 2 320.795 4.404 20 0 DIADLO C[N@H+]1CCCC[C@@H]1c1ccc(-c2cc(F)c(O)c(Cl)c2)nc1 ZINC001244499858 1057976560 /nfs/dbraw/zinc/97/65/60/1057976560.db2.gz LQICPSJNXGHUOJ-MRXNPFEDSA-N 1 2 320.795 4.404 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2c(Cl)cc(C)cc2Cl)cc1 ZINC001244508181 1057981065 /nfs/dbraw/zinc/98/10/65/1057981065.db2.gz XGKHQFJPEDRRHJ-OAHLLOKOSA-N 1 2 324.207 4.142 20 0 DIADLO Cc1cc(-c2c[nH+]c(N3CCCCC3)cc2C)cc(O)c1F ZINC001244515272 1057983346 /nfs/dbraw/zinc/98/33/46/1057983346.db2.gz IDUVCSFHNKOWJW-UHFFFAOYSA-N 1 2 300.377 4.200 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2c(Cl)ccc(O)c2F)cc1F ZINC001244542653 1057992409 /nfs/dbraw/zinc/99/24/09/1057992409.db2.gz NEJMIPBPSQBCMN-UHFFFAOYSA-N 1 2 315.722 4.192 20 0 DIADLO Cc1cc(-c2cc(F)c(C[NH+](C)C)c(F)c2)cc(Cl)c1O ZINC001244556655 1057995156 /nfs/dbraw/zinc/99/51/56/1057995156.db2.gz YLWRMGSHJAFLLV-UHFFFAOYSA-N 1 2 311.759 4.361 20 0 DIADLO CCCOc1cc(-c2ccc3[nH+]ccn3c2C)c(Cl)cn1 ZINC001244608288 1058008330 /nfs/dbraw/zinc/00/83/30/1058008330.db2.gz BEVVMVZHFSPFHN-UHFFFAOYSA-N 1 2 301.777 4.147 20 0 DIADLO COCOc1c(C)cccc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001244658047 1058021736 /nfs/dbraw/zinc/02/17/36/1058021736.db2.gz SCMSMEBTXOOREC-UHFFFAOYSA-N 1 2 308.381 4.045 20 0 DIADLO CC(=O)c1ccc(-c2cccc(-c3c[nH+]cn3C)c2)c(F)c1F ZINC001244703721 1058031564 /nfs/dbraw/zinc/03/15/64/1058031564.db2.gz AKSXRIPOHAPNRW-UHFFFAOYSA-N 1 2 312.319 4.235 20 0 DIADLO Cc1c(-c2c(F)c(F)ccc2OC(C)C)ccc2[nH+]ccn21 ZINC001244743144 1058039950 /nfs/dbraw/zinc/03/99/50/1058039950.db2.gz TUCKABZUCNGXQF-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Nc1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c(C(F)(F)F)c1 ZINC001244757771 1058042778 /nfs/dbraw/zinc/04/27/78/1058042778.db2.gz YQLTXVWFUBPSOQ-UHFFFAOYSA-N 1 2 303.287 4.345 20 0 DIADLO COCOc1cc(C)c(-c2ccc(-n3cc[nH+]c3)cc2)c(C)c1 ZINC001244770729 1058044715 /nfs/dbraw/zinc/04/47/15/1058044715.db2.gz LKQAOXOWPRSCRC-UHFFFAOYSA-N 1 2 308.381 4.139 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cccc(-c2ccncc2)c1 ZINC001244781960 1058047463 /nfs/dbraw/zinc/04/74/63/1058047463.db2.gz SEFXCDNVDLLIAC-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO O=C(O[C@@H]1CC=C(c2cccc3[nH+]ccn32)CC1)c1ccccc1 ZINC001244804135 1058049938 /nfs/dbraw/zinc/04/99/38/1058049938.db2.gz JBTGDGCQQSDJRD-QGZVFWFLSA-N 1 2 318.376 4.127 20 0 DIADLO Cc1[nH+]ccc(C2=CC[C@H](OC(=O)c3ccccc3)CC2)c1C ZINC001244807517 1058051125 /nfs/dbraw/zinc/05/11/25/1058051125.db2.gz UXWCYOLTGVCGHJ-SFHVURJKSA-N 1 2 307.393 4.491 20 0 DIADLO Fc1c(C[NH+]2CCOCC2)cccc1-c1cccc2occc21 ZINC001244853808 1058058816 /nfs/dbraw/zinc/05/88/16/1058058816.db2.gz GOYZHESIBBSLJE-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO CNc1cc(-c2cc(C(F)(F)F)nc3ccccc32)cc[nH+]1 ZINC001244970983 1058083366 /nfs/dbraw/zinc/08/33/66/1058083366.db2.gz DEQFPIPUDRTDPJ-UHFFFAOYSA-N 1 2 303.287 4.357 20 0 DIADLO Cc1c(Cl)c(-c2ccccc2Cn2cc[nH+]c2)ccc1CO ZINC001244969861 1058083452 /nfs/dbraw/zinc/08/34/52/1058083452.db2.gz BPUFCOWOCMYXPN-UHFFFAOYSA-N 1 2 312.800 4.053 20 0 DIADLO CNc1cc(-c2ccc(OC(F)(F)F)c3ncccc23)cc[nH+]1 ZINC001244975133 1058083890 /nfs/dbraw/zinc/08/38/90/1058083890.db2.gz BBNVZWOHQKANTG-UHFFFAOYSA-N 1 2 319.286 4.237 20 0 DIADLO CNc1cc(-c2cnc3cc(C(F)(F)F)ccc3c2)cc[nH+]1 ZINC001244976615 1058084583 /nfs/dbraw/zinc/08/45/83/1058084583.db2.gz QBCVCTQGNWCNNO-UHFFFAOYSA-N 1 2 303.287 4.357 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1cccc(C2CCC2)c1 ZINC001244980114 1058085124 /nfs/dbraw/zinc/08/51/24/1058085124.db2.gz TWUVHNSHWFTCQF-UHFFFAOYSA-N 1 2 308.425 4.161 20 0 DIADLO c1cc(-c2ccc(C[NH+]3CCOCC3)cn2)cc(C2CCCC2)c1 ZINC001244987154 1058087758 /nfs/dbraw/zinc/08/77/58/1058087758.db2.gz NJZNZPVMPBMCKN-UHFFFAOYSA-N 1 2 322.452 4.238 20 0 DIADLO Cc1cc(-c2cc[nH+]c(N(C)C)c2)ccc1C(=O)OC(C)(C)C ZINC001245031024 1058098850 /nfs/dbraw/zinc/09/88/50/1058098850.db2.gz BFKGEPFOIRROLD-UHFFFAOYSA-N 1 2 312.413 4.078 20 0 DIADLO Cc1cc(F)cc(Cl)c1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001245059918 1058105440 /nfs/dbraw/zinc/10/54/40/1058105440.db2.gz WJWPXNJTQVCYSS-UHFFFAOYSA-N 1 2 301.752 4.094 20 0 DIADLO COCCc1ccc(OCc2ccc(/C(C)=C/C=C/[NH3+])cc2)cc1 ZINC001245173263 1058123154 /nfs/dbraw/zinc/12/31/54/1058123154.db2.gz ZJLQWLSZCGTRLX-JVYJCDAESA-N 1 2 323.436 4.330 20 0 DIADLO Cc1cn2cc(-c3cccc(OC(F)(F)F)c3F)ccc2[nH+]1 ZINC001245174882 1058123833 /nfs/dbraw/zinc/12/38/33/1058123833.db2.gz IUPXWTJNWOUQRK-UHFFFAOYSA-N 1 2 310.250 4.347 20 0 DIADLO c1cc(-c2ccc(-c3c[nH+]cn3Cc3ccccc3)cc2)no1 ZINC001245197195 1058126243 /nfs/dbraw/zinc/12/62/43/1058126243.db2.gz QUAMMRJCOLOUJV-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO Cc1cc(N(C)C)cc(C)c1-c1c[nH+]cn1Cc1ccccc1 ZINC001245198805 1058126761 /nfs/dbraw/zinc/12/67/61/1058126761.db2.gz OPQJNFWCVVTQFN-UHFFFAOYSA-N 1 2 305.425 4.281 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1-c1ccc(N2CCCC2)cc1 ZINC001245198677 1058126937 /nfs/dbraw/zinc/12/69/37/1058126937.db2.gz LVKHBLBKKPNHNR-UHFFFAOYSA-N 1 2 303.409 4.199 20 0 DIADLO COc1c(F)cc(SC)cc1-c1ccc2[nH+]c(C)cn2c1 ZINC001245226606 1058129838 /nfs/dbraw/zinc/12/98/38/1058129838.db2.gz XJPRKPDPNYIURW-UHFFFAOYSA-N 1 2 302.374 4.179 20 0 DIADLO CCn1ncc2cc(-c3ccc(-c4c[nH+]cn4C)cc3)ccc21 ZINC001245234378 1058131459 /nfs/dbraw/zinc/13/14/59/1058131459.db2.gz CZOSLDNMYRSRFH-UHFFFAOYSA-N 1 2 302.381 4.124 20 0 DIADLO CCn1ncc2cc(-c3ccc(F)c(-n4cc[nH+]c4)c3)ccc21 ZINC001245240386 1058133905 /nfs/dbraw/zinc/13/39/05/1058133905.db2.gz WHJJRNRYTRVGLT-UHFFFAOYSA-N 1 2 306.344 4.048 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccnc(OCC3CCC3)c2)cc1 ZINC001245242012 1058134324 /nfs/dbraw/zinc/13/43/24/1058134324.db2.gz NBNFBSCJWGBVHM-UHFFFAOYSA-N 1 2 319.408 4.328 20 0 DIADLO Cc1cc2ccccc2c(-c2cncc(C[NH+]3CCOCC3)c2)c1 ZINC001245249863 1058135640 /nfs/dbraw/zinc/13/56/40/1058135640.db2.gz IOEIQTGTIYHKSS-UHFFFAOYSA-N 1 2 318.420 4.042 20 0 DIADLO CC(=O)OCc1cc(-c2cccc(-c3c[nH+]cn3C)c2)ccc1C ZINC001245377945 1058156545 /nfs/dbraw/zinc/15/65/45/1058156545.db2.gz JCPDVTYRRMAFLW-UHFFFAOYSA-N 1 2 320.392 4.126 20 0 DIADLO COc1cc2ccccc2cc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001245415514 1058162719 /nfs/dbraw/zinc/16/27/19/1058162719.db2.gz SXTFYWMATOSXHR-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Fc1ccc(-c2ccncc2C(F)(F)F)cc1-n1cc[nH+]c1 ZINC001245446084 1058167833 /nfs/dbraw/zinc/16/78/33/1058167833.db2.gz BQALGDWAFREQGE-UHFFFAOYSA-N 1 2 307.250 4.092 20 0 DIADLO Cc1cc(-c2ncc(C(F)(F)F)cc2-c2ccco2)c[nH+]c1N ZINC001245536713 1058215986 /nfs/dbraw/zinc/21/59/86/1058215986.db2.gz LAFHRUQRKUWVRY-UHFFFAOYSA-N 1 2 319.286 4.313 20 0 DIADLO Cc1nc2scc(CC(C)C)c2c(-c2c[nH+]c(N)c(C)c2)n1 ZINC001245539997 1058218478 /nfs/dbraw/zinc/21/84/78/1058218478.db2.gz ZYFYPINDDMVTAZ-UHFFFAOYSA-N 1 2 312.442 4.151 20 0 DIADLO Cc1cc(-c2ccc(F)c(C(F)(F)C(F)(F)F)c2)c[nH+]c1N ZINC001245540803 1058219722 /nfs/dbraw/zinc/21/97/22/1058219722.db2.gz WTNMMFGSOFSAQH-UHFFFAOYSA-N 1 2 320.236 4.432 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc2ccc(F)cc2[nH]1 ZINC001245590519 1058262561 /nfs/dbraw/zinc/26/25/61/1058262561.db2.gz PXANFCNZGZOWTJ-UHFFFAOYSA-N 1 2 307.328 4.168 20 0 DIADLO C[C@@H](CC1CCCCC1)C(=O)N1CCCC[C@@H]1c1c[nH+]cn1C ZINC001548828316 1058264752 /nfs/dbraw/zinc/26/47/52/1058264752.db2.gz OOKFIEZJRXZGPN-DOTOQJQBSA-N 1 2 317.477 4.080 20 0 DIADLO CCCNc1cc(C)[nH+]c(-c2ccc3c(c2)C(=O)CCCC3)n1 ZINC001245596405 1058270136 /nfs/dbraw/zinc/27/01/36/1058270136.db2.gz FJWAQCIXNYHBFI-UHFFFAOYSA-N 1 2 309.413 4.183 20 0 DIADLO c1nc(C[N@@H+]2CCC[C@H]3O[C@H](c4ccccc4)C[C@@H]32)oc1C1CC1 ZINC001549084553 1058280393 /nfs/dbraw/zinc/28/03/93/1058280393.db2.gz XLJVWVGZPPIONT-KSZLIROESA-N 1 2 324.424 4.047 20 0 DIADLO c1nc(C[N@H+]2CCC[C@H]3O[C@H](c4ccccc4)C[C@@H]32)oc1C1CC1 ZINC001549084553 1058280413 /nfs/dbraw/zinc/28/04/13/1058280413.db2.gz XLJVWVGZPPIONT-KSZLIROESA-N 1 2 324.424 4.047 20 0 DIADLO Cc1cccc2cc(C(=O)Nc3ccn4cc[nH+]c4c3)sc21 ZINC001527999153 1058294007 /nfs/dbraw/zinc/29/40/07/1058294007.db2.gz AQRHVKJVPSHYMS-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cccc3c2CN(C)C3=O)c1 ZINC001245626676 1058297392 /nfs/dbraw/zinc/29/73/92/1058297392.db2.gz ACLQBGFLUAIVHK-UHFFFAOYSA-N 1 2 308.425 4.094 20 0 DIADLO Fc1ccc(-c2ccc(-c3ncco3)cc2)cc1-n1cc[nH+]c1 ZINC001245626304 1058298230 /nfs/dbraw/zinc/29/82/30/1058298230.db2.gz XPNBYVMGGHQZOS-UHFFFAOYSA-N 1 2 305.312 4.333 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1c(Cl)cccc1Cl ZINC001245674590 1058335011 /nfs/dbraw/zinc/33/50/11/1058335011.db2.gz FMRYEEQDLFNXIV-UHFFFAOYSA-N 1 2 323.223 4.200 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2Cc2conc2C2CC2)sc1C ZINC001550530674 1058344262 /nfs/dbraw/zinc/34/42/62/1058344262.db2.gz MQVIHBHNJDRJKI-HNNXBMFYSA-N 1 2 317.458 4.353 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2Cc2conc2C2CC2)sc1C ZINC001550530674 1058344279 /nfs/dbraw/zinc/34/42/79/1058344279.db2.gz MQVIHBHNJDRJKI-HNNXBMFYSA-N 1 2 317.458 4.353 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(F)c(C)c1F ZINC001245692369 1058355817 /nfs/dbraw/zinc/35/58/17/1058355817.db2.gz JSCZPPVLMXUWAD-UHFFFAOYSA-N 1 2 300.308 4.135 20 0 DIADLO CC[C@H]1CCCC[C@H]1CNC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001562900477 1058356722 /nfs/dbraw/zinc/35/67/22/1058356722.db2.gz FRWYTCCGJJCZCD-HOTGVXAUSA-N 1 2 303.450 4.345 20 0 DIADLO Cc1cc(C)c(NC(=O)NC(C)(C)c2ccc(F)cc2)c(C)[nH+]1 ZINC001562901625 1058357883 /nfs/dbraw/zinc/35/78/83/1058357883.db2.gz XBYZTNYPIJROOC-UHFFFAOYSA-N 1 2 315.392 4.203 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(C)c3cccnc23)c(C)[nH+]1 ZINC001518699274 1058370348 /nfs/dbraw/zinc/37/03/48/1058370348.db2.gz JOYNZSJKOFBJEZ-UHFFFAOYSA-N 1 2 305.381 4.116 20 0 DIADLO FC(F)(F)c1cccc(-c2c[nH+]c3c(c2)CCCN3)c1Cl ZINC001245711611 1058384694 /nfs/dbraw/zinc/38/46/94/1058384694.db2.gz IYBQLFSRKAQHHZ-UHFFFAOYSA-N 1 2 312.722 4.422 20 0 DIADLO CCOC(=O)c1ccc(-c2ccccc2Cn2cc[nH+]c2)cc1C ZINC001245719590 1058392196 /nfs/dbraw/zinc/39/21/96/1058392196.db2.gz OSIXTZFZYQUONI-UHFFFAOYSA-N 1 2 320.392 4.084 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2CCC[C@@H](C)C2)[nH+]c1C ZINC001551736716 1058408719 /nfs/dbraw/zinc/40/87/19/1058408719.db2.gz AAAFSAQQANMGHL-IUODEOHRSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@H]2CC(C)C)[nH+]c1C ZINC001551738006 1058409191 /nfs/dbraw/zinc/40/91/91/1058409191.db2.gz GDOVZSRUFWGOQZ-GDBMZVCRSA-N 1 2 311.429 4.314 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C[C@H]2CCC[C@@H]2C)[nH+]c1C ZINC001551740757 1058409272 /nfs/dbraw/zinc/40/92/72/1058409272.db2.gz OCPAHWZMNKDDDA-SWLSCSKDSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@@]2(C)C(C)C)[nH+]c1C ZINC001551743572 1058412053 /nfs/dbraw/zinc/41/20/53/1058412053.db2.gz XBWVPZFPKKLMQE-BEFAXECRSA-N 1 2 311.429 4.314 20 0 DIADLO Fc1c(Cl)ccc(-c2ccccc2C[NH+]2CCOCC2)c1F ZINC001245740279 1058421050 /nfs/dbraw/zinc/42/10/50/1058421050.db2.gz QQPCDROTTQJKIK-UHFFFAOYSA-N 1 2 323.770 4.117 20 0 DIADLO FC(F)(F)c1ccc([C@@H]2OCCC[C@@H]2Cn2cc[nH+]c2)cc1 ZINC001552678135 1058448067 /nfs/dbraw/zinc/44/80/67/1058448067.db2.gz OHZQVLLCNCVWHN-HIFRSBDPSA-N 1 2 310.319 4.070 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cccc(Cl)c1SC ZINC001245775583 1058463114 /nfs/dbraw/zinc/46/31/14/1058463114.db2.gz DTUKLLAZTVCLFI-UHFFFAOYSA-N 1 2 304.802 4.385 20 0 DIADLO CSc1c(Cl)cccc1-c1cc(-n2ccnc2)cc[nH+]1 ZINC001245778823 1058465067 /nfs/dbraw/zinc/46/50/67/1058465067.db2.gz WVVVURZLQMCZLN-UHFFFAOYSA-N 1 2 301.802 4.310 20 0 DIADLO CSc1c(Cl)cccc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001245779130 1058465180 /nfs/dbraw/zinc/46/51/80/1058465180.db2.gz PBCBIMCYCXCXLO-UHFFFAOYSA-N 1 2 315.829 4.369 20 0 DIADLO CC[C@H](C)CCC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001528669068 1058483740 /nfs/dbraw/zinc/48/37/40/1058483740.db2.gz LIIBVSDMUQFQRZ-LBPRGKRZSA-N 1 2 305.809 4.291 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N[C@H]1CCO[C@@H](c2ccccn2)C1 ZINC001553702328 1058500625 /nfs/dbraw/zinc/50/06/25/1058500625.db2.gz QWFWNIGVWHUXJC-QFBILLFUSA-N 1 2 319.408 4.270 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)c2cc[nH]c2C(C)C)[nH+]c1C ZINC001553988875 1058512023 /nfs/dbraw/zinc/51/20/23/1058512023.db2.gz NLLLFGDRHWKLFJ-UHFFFAOYSA-N 1 2 322.412 4.397 20 0 DIADLO Oc1ccc(F)c(-c2ccccc2Cn2cc[nH+]c2)c1Cl ZINC001245831660 1058534388 /nfs/dbraw/zinc/53/43/88/1058534388.db2.gz HIIBDVLNZBEBMK-UHFFFAOYSA-N 1 2 302.736 4.097 20 0 DIADLO COc1cc(-c2cc(C)c3[nH+]ccn3c2)c(F)c(F)c1Cl ZINC001245862973 1058570889 /nfs/dbraw/zinc/57/08/89/1058570889.db2.gz OWLURXKOYQXRLJ-UHFFFAOYSA-N 1 2 308.715 4.250 20 0 DIADLO Cc1cc(CNC(=O)c2ccc(-c3ccccc3F)o2)cc(C)[nH+]1 ZINC001529059376 1058591976 /nfs/dbraw/zinc/59/19/76/1058591976.db2.gz ANEHQYSZTFXXRQ-UHFFFAOYSA-N 1 2 324.355 4.028 20 0 DIADLO Cc1ccc(C[C@H]2CCCN2C(=O)c2c(C)cc(C)[nH+]c2C)cc1 ZINC001529299643 1058669603 /nfs/dbraw/zinc/66/96/03/1058669603.db2.gz VDDRSIJGJFJFIG-LJQANCHMSA-N 1 2 322.452 4.163 20 0 DIADLO CC(=Cc1c(Cl)cccc1Cl)C(=O)Nc1cc[nH+]c(C)c1 ZINC001520753560 1058675801 /nfs/dbraw/zinc/67/58/01/1058675801.db2.gz MMDIXPKQHPGGCQ-CSKARUKUSA-N 1 2 321.207 4.161 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cc2c(o1)CCCC2 ZINC001558975642 1058929650 /nfs/dbraw/zinc/92/96/50/1058929650.db2.gz LLXGGCDHWZCIIF-UHFFFAOYSA-N 1 2 321.380 4.109 20 0 DIADLO CCc1nc(N2CCC[C@H]2c2ccc(Cl)cc2)cc(C)[nH+]1 ZINC001559064105 1058957868 /nfs/dbraw/zinc/95/78/68/1058957868.db2.gz ALTYQLJJXFEUQQ-HNNXBMFYSA-N 1 2 301.821 4.342 20 0 DIADLO COc1cccc([C@@H](C)Nc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001559075956 1058967256 /nfs/dbraw/zinc/96/72/56/1058967256.db2.gz CMXSEAPNUUFWHI-CYBMUJFWSA-N 1 2 318.380 4.064 20 0 DIADLO CCc1cc(NCCc2ccccc2C(F)(F)F)nc(CC)[nH+]1 ZINC001559081739 1058970649 /nfs/dbraw/zinc/97/06/49/1058970649.db2.gz KGCKZTMUNIAUDE-UHFFFAOYSA-N 1 2 323.362 4.275 20 0 DIADLO CCc1cc(N2CCC[C@@H](c3ccccc3)CC2)nc(CC)[nH+]1 ZINC001559094484 1058985464 /nfs/dbraw/zinc/98/54/64/1058985464.db2.gz RCLYAGPATAIDRZ-QGZVFWFLSA-N 1 2 309.457 4.376 20 0 DIADLO CCO[C@H]1C[C@@H](Nc2cc(C)[nH+]c(C3CC3)n2)C12CCCCC2 ZINC001559105639 1058989299 /nfs/dbraw/zinc/98/92/99/1058989299.db2.gz XEHRBWJAHZPPEQ-CVEARBPZSA-N 1 2 315.461 4.202 20 0 DIADLO Fc1ccc2nc(Oc3cccc(-n4cc[nH+]c4)c3)sc2c1 ZINC001559111804 1058997796 /nfs/dbraw/zinc/99/77/96/1058997796.db2.gz XSFCTKSHRXWBBA-UHFFFAOYSA-N 1 2 311.341 4.413 20 0 DIADLO CC[C@H](Cc1ccccc1C(F)(F)F)Nc1cc[nH+]c(C)n1 ZINC001559117249 1059002965 /nfs/dbraw/zinc/00/29/65/1059002965.db2.gz JOAOYEGVSXSRNT-CYBMUJFWSA-N 1 2 309.335 4.237 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3cccc4ccccc43)ccn12 ZINC001521865711 1059010902 /nfs/dbraw/zinc/01/09/02/1059010902.db2.gz DHJWTYTUKMBCCM-UHFFFAOYSA-N 1 2 302.333 4.015 20 0 DIADLO Cc1nc(NCC2(OC(C)C)CCCCC2)c2c([nH+]1)CCCC2 ZINC001559132988 1059022497 /nfs/dbraw/zinc/02/24/97/1059022497.db2.gz MVPDSEBOYBRPHB-UHFFFAOYSA-N 1 2 317.477 4.204 20 0 DIADLO CCc1ccc(Nc2nc3ccccc3n3c[nH+]cc23)cc1C ZINC001559142731 1059032133 /nfs/dbraw/zinc/03/21/33/1059032133.db2.gz USKPTZYLPTVBLS-UHFFFAOYSA-N 1 2 302.381 4.497 20 0 DIADLO Cc1nc(N[C@H](C)c2cccc(F)c2F)c2c([nH+]1)CCCC2 ZINC001559144565 1059033740 /nfs/dbraw/zinc/03/37/40/1059033740.db2.gz QFRXAHXJQSPCRL-SNVBAGLBSA-N 1 2 303.356 4.115 20 0 DIADLO CCc1cc(N2CC=C(c3cccc4ccccc43)C2)nc(C)[nH+]1 ZINC001559150503 1059036634 /nfs/dbraw/zinc/03/66/34/1059036634.db2.gz AODKNXHYEZBATQ-UHFFFAOYSA-N 1 2 315.420 4.404 20 0 DIADLO C[C@@H](CC1CCCCC1)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001559182612 1059066102 /nfs/dbraw/zinc/06/61/02/1059066102.db2.gz NRRJMHDDDJHSMF-ZDUSSCGKSA-N 1 2 315.465 4.352 20 0 DIADLO Cc1ccc2c(c1)[C@@H](Nc1nc(C)[nH+]c3c1CCCC3)CCC2 ZINC001559204536 1059086033 /nfs/dbraw/zinc/08/60/33/1059086033.db2.gz LGQPQNGVWNUBCA-IBGZPJMESA-N 1 2 307.441 4.462 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2NC[C@@H]1CCCC(C)(C)C1 ZINC001559213551 1059094372 /nfs/dbraw/zinc/09/43/72/1059094372.db2.gz XBHSRSGQBVRHNT-CYBMUJFWSA-N 1 2 315.465 4.210 20 0 DIADLO CCc1csc([C@H](C)Nc2cc(C)[nH+]c(C3CCC3)n2)n1 ZINC001559221040 1059099720 /nfs/dbraw/zinc/09/97/20/1059099720.db2.gz ZBCDPHLHCQEOJX-NSHDSACASA-N 1 2 302.447 4.245 20 0 DIADLO CCc1cc(NCC2CCc3ccccc3CC2)nc(CC)[nH+]1 ZINC001559244022 1059117881 /nfs/dbraw/zinc/11/78/81/1059117881.db2.gz JVUUNTNCAHTCHS-UHFFFAOYSA-N 1 2 309.457 4.209 20 0 DIADLO Cc1cc(N[C@H](CF)c2ccc(F)cc2)nc(C2CCC2)[nH+]1 ZINC001559263038 1059129944 /nfs/dbraw/zinc/12/99/44/1059129944.db2.gz VEWURIASXRVEHM-OAHLLOKOSA-N 1 2 303.356 4.314 20 0 DIADLO COc1ccc([C@@H](C)Nc2nc(C)[nH+]c3c2CCCC3)cc1C ZINC001559292408 1059146165 /nfs/dbraw/zinc/14/61/65/1059146165.db2.gz PKDDNFGEKJVABB-CYBMUJFWSA-N 1 2 311.429 4.154 20 0 DIADLO CC[C@H]([NH3+])c1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1 ZINC001247017540 1059248051 /nfs/dbraw/zinc/24/80/51/1059248051.db2.gz NUIMLNXIYYMWKE-ZETCQYMHSA-N 1 2 311.229 4.010 20 0 DIADLO Cc1cc(C)c(C[N@H+](Cc2ccc(F)cc2F)C2CC2)c(C)n1 ZINC001559487781 1059261127 /nfs/dbraw/zinc/26/11/27/1059261127.db2.gz NVNMPOOLHXVHHX-UHFFFAOYSA-N 1 2 316.395 4.450 20 0 DIADLO Cc1cc(C)c(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)c(C)n1 ZINC001559487781 1059261144 /nfs/dbraw/zinc/26/11/44/1059261144.db2.gz NVNMPOOLHXVHHX-UHFFFAOYSA-N 1 2 316.395 4.450 20 0 DIADLO CCc1nnc(C[N@@H+]2CCC[C@H]2c2ccc(C(C)(C)C)cc2)[nH]1 ZINC001559487159 1059263359 /nfs/dbraw/zinc/26/33/59/1059263359.db2.gz UAQDAOYNKLLLPN-INIZCTEOSA-N 1 2 312.461 4.002 20 0 DIADLO CCc1nnc(C[N@H+]2CCC[C@H]2c2ccc(C(C)(C)C)cc2)[nH]1 ZINC001559487159 1059263381 /nfs/dbraw/zinc/26/33/81/1059263381.db2.gz UAQDAOYNKLLLPN-INIZCTEOSA-N 1 2 312.461 4.002 20 0 DIADLO Cc1ccc2c(c1)nc(-c1ccc(S)cc1)n2C1CC[NH2+]CC1 ZINC001247042835 1059264122 /nfs/dbraw/zinc/26/41/22/1059264122.db2.gz SWALWFCIAFJDME-UHFFFAOYSA-N 1 2 323.465 4.225 20 0 DIADLO COC(=O)c1csc(C[N@H+](C)[C@H](C)c2ccccc2Cl)c1 ZINC001559490405 1059265095 /nfs/dbraw/zinc/26/50/95/1059265095.db2.gz ZXCQFYZNFOKZQR-LLVKDONJSA-N 1 2 323.845 4.381 20 0 DIADLO COC(=O)c1csc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)c1 ZINC001559490405 1059265108 /nfs/dbraw/zinc/26/51/08/1059265108.db2.gz ZXCQFYZNFOKZQR-LLVKDONJSA-N 1 2 323.845 4.381 20 0 DIADLO C[N@@H+](Cc1c(Cl)cccc1Cl)C[C@H]1CC[C@@H](C2CC2)O1 ZINC001559501636 1059286697 /nfs/dbraw/zinc/28/66/97/1059286697.db2.gz REQWIHKWNFMFJV-WBMJQRKESA-N 1 2 314.256 4.383 20 0 DIADLO C[N@H+](Cc1c(Cl)cccc1Cl)C[C@H]1CC[C@@H](C2CC2)O1 ZINC001559501636 1059286713 /nfs/dbraw/zinc/28/67/13/1059286713.db2.gz REQWIHKWNFMFJV-WBMJQRKESA-N 1 2 314.256 4.383 20 0 DIADLO Cc1ccc(-c2ccccc2-c2noc(Cc3c[nH]c[nH+]3)n2)cc1 ZINC001247138941 1059313823 /nfs/dbraw/zinc/31/38/23/1059313823.db2.gz WCRAGGGYDFLDLV-UHFFFAOYSA-N 1 2 316.364 4.026 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@@H](C(C)C)CC1 ZINC001559546336 1059347823 /nfs/dbraw/zinc/34/78/23/1059347823.db2.gz TTZKNZRPHACBOX-RHSMWYFYSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H](C(C)C)CC1 ZINC001559546336 1059347843 /nfs/dbraw/zinc/34/78/43/1059347843.db2.gz TTZKNZRPHACBOX-RHSMWYFYSA-N 1 2 323.864 4.312 20 0 DIADLO C[C@H](c1nc(-c2ccc(-c3ccccc3)cc2)no1)n1cc[nH+]c1 ZINC001247257493 1059360861 /nfs/dbraw/zinc/36/08/61/1059360861.db2.gz NLOBVUGFVQKZIB-CQSZACIVSA-N 1 2 316.364 4.209 20 0 DIADLO CC(C)(C)c1ccc(-c2noc([C@@H]3CCCc4[nH]c[nH+]c43)n2)cc1 ZINC001247272049 1059365071 /nfs/dbraw/zinc/36/50/71/1059365071.db2.gz IGYHFHVPRZEXTK-CQSZACIVSA-N 1 2 322.412 4.225 20 0 DIADLO COc1cc(C)[nH+]c(CN2CC[C@@H](C)C[C@@H]2c2ccc(C)o2)c1 ZINC001559569550 1059401559 /nfs/dbraw/zinc/40/15/59/1059401559.db2.gz BFIPYMHWNJVSAV-FZKQIMNGSA-N 1 2 314.429 4.273 20 0 DIADLO CC(C)C1(c2nc(-c3ccccc3-n3cc[nH+]c3)no2)CCC1 ZINC001247376051 1059418109 /nfs/dbraw/zinc/41/81/09/1059418109.db2.gz ZLSQRFCNAWRHCM-UHFFFAOYSA-N 1 2 308.385 4.000 20 0 DIADLO c1cn(CCCN(CCc2ccccc2)c2ccccc2)c[nH+]1 ZINC001559610335 1059442791 /nfs/dbraw/zinc/44/27/91/1059442791.db2.gz HAMSBGCEFXRHRP-UHFFFAOYSA-N 1 2 305.425 4.023 20 0 DIADLO CCc1ccccc1CC[NH2+]C1(C(=O)OC(C)(C)C)CCCC1 ZINC001559613469 1059446027 /nfs/dbraw/zinc/44/60/27/1059446027.db2.gz JNHBKUFVQNJZHR-UHFFFAOYSA-N 1 2 317.473 4.036 20 0 DIADLO CN(C)c1cc(CN2CC(C)(C)c3c2cccc3Cl)cc[nH+]1 ZINC001559637376 1059462859 /nfs/dbraw/zinc/46/28/59/1059462859.db2.gz OGNPBZLHYMITAV-UHFFFAOYSA-N 1 2 315.848 4.099 20 0 DIADLO Cc1ccc(OC(F)F)c(C[N@@H+]2CCc3cc(F)ccc3C2)c1 ZINC001559660407 1059490258 /nfs/dbraw/zinc/49/02/58/1059490258.db2.gz SFTJRVDVLRYGNP-UHFFFAOYSA-N 1 2 321.342 4.294 20 0 DIADLO Cc1ccc(OC(F)F)c(C[N@H+]2CCc3cc(F)ccc3C2)c1 ZINC001559660407 1059490266 /nfs/dbraw/zinc/49/02/66/1059490266.db2.gz SFTJRVDVLRYGNP-UHFFFAOYSA-N 1 2 321.342 4.294 20 0 DIADLO CCNc1nc(C[NH2+][C@H](CC)c2cc(F)ccc2F)cs1 ZINC001559693798 1059522880 /nfs/dbraw/zinc/52/28/80/1059522880.db2.gz QNMZPTMUOOJRAU-CQSZACIVSA-N 1 2 311.401 4.094 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2c(F)ccc(C)c2F)CCC1 ZINC001559704447 1059531855 /nfs/dbraw/zinc/53/18/55/1059531855.db2.gz NVYBAVIPMQMRFT-UHFFFAOYSA-N 1 2 317.379 4.451 20 0 DIADLO CCCc1cc(C(=O)Nc2ccn3cc[nH+]c3c2)ccc1Cl ZINC001524629337 1059560809 /nfs/dbraw/zinc/56/08/09/1059560809.db2.gz PUTYNWIXSZRILV-UHFFFAOYSA-N 1 2 313.788 4.193 20 0 DIADLO FCc1ccccc1C[N@@H+]1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC001559728939 1059562822 /nfs/dbraw/zinc/56/28/22/1059562822.db2.gz GXAWKEAQIOGBOK-GOSISDBHSA-N 1 2 319.807 4.383 20 0 DIADLO FCc1ccccc1C[N@H+]1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC001559728939 1059562845 /nfs/dbraw/zinc/56/28/45/1059562845.db2.gz GXAWKEAQIOGBOK-GOSISDBHSA-N 1 2 319.807 4.383 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@H]1CCCC[C@@H]1C1CC1 ZINC001532353889 1059600629 /nfs/dbraw/zinc/60/06/29/1059600629.db2.gz VBVRVNQKALYYKS-MSOLQXFVSA-N 1 2 309.413 4.027 20 0 DIADLO C[C@H](c1ccccc1F)[NH+]1CCN([C@@H](C)c2ccsc2)CC1 ZINC001559771997 1059610462 /nfs/dbraw/zinc/61/04/62/1059610462.db2.gz LALAKXPOCIEBMT-LSDHHAIUSA-N 1 2 318.461 4.327 20 0 DIADLO Clc1ccc([C@H]2CC[N@@H+]2CC2(Br)CC2)cc1 ZINC001559829474 1059662291 /nfs/dbraw/zinc/66/22/91/1059662291.db2.gz UVDJFPFNNZVTME-GFCCVEGCSA-N 1 2 300.627 4.014 20 0 DIADLO Clc1ccc([C@H]2CC[N@H+]2CC2(Br)CC2)cc1 ZINC001559829474 1059662296 /nfs/dbraw/zinc/66/22/96/1059662296.db2.gz UVDJFPFNNZVTME-GFCCVEGCSA-N 1 2 300.627 4.014 20 0 DIADLO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1c(F)ccc(Br)c1F ZINC001559913143 1059728625 /nfs/dbraw/zinc/72/86/25/1059728625.db2.gz HEFWOAFBTVVWIY-SECBINFHSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@@H]1CC(C)(C)C[N@H+]1Cc1c(F)ccc(Br)c1F ZINC001559913143 1059728647 /nfs/dbraw/zinc/72/86/47/1059728647.db2.gz HEFWOAFBTVVWIY-SECBINFHSA-N 1 2 318.205 4.348 20 0 DIADLO CCn1cc(C[N@H+](Cc2ccc(F)cc2Cl)C(C)C)cn1 ZINC001559961731 1059768091 /nfs/dbraw/zinc/76/80/91/1059768091.db2.gz GSVCUTBUOUBWPF-UHFFFAOYSA-N 1 2 309.816 4.106 20 0 DIADLO CCn1cc(C[N@@H+](Cc2ccc(F)cc2Cl)C(C)C)cn1 ZINC001559961731 1059768101 /nfs/dbraw/zinc/76/81/01/1059768101.db2.gz GSVCUTBUOUBWPF-UHFFFAOYSA-N 1 2 309.816 4.106 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@H+](C)C/C=C\c1ccc(Cl)cc1 ZINC001559960116 1059769236 /nfs/dbraw/zinc/76/92/36/1059769236.db2.gz KPHQJEZKRJTJSK-PTZVLDCSSA-N 1 2 323.864 4.405 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)C/C=C\c1ccc(Cl)cc1 ZINC001559960116 1059769252 /nfs/dbraw/zinc/76/92/52/1059769252.db2.gz KPHQJEZKRJTJSK-PTZVLDCSSA-N 1 2 323.864 4.405 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@@H+]1CCc2ccc(Cl)cc2[C@@H](C)C1 ZINC001559966405 1059771926 /nfs/dbraw/zinc/77/19/26/1059771926.db2.gz ZFQLKMGFABOEOT-UONOGXRCSA-N 1 2 323.864 4.033 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@H+]1CCc2ccc(Cl)cc2[C@@H](C)C1 ZINC001559966405 1059771943 /nfs/dbraw/zinc/77/19/43/1059771943.db2.gz ZFQLKMGFABOEOT-UONOGXRCSA-N 1 2 323.864 4.033 20 0 DIADLO Cc1cc(Cl)ccc1NC(=S)Nc1cccc2[nH+]ccn21 ZINC001248356578 1059794148 /nfs/dbraw/zinc/79/41/48/1059794148.db2.gz KKPYMPOQWBAUFK-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO Fc1cccc([C@@H]2COCC[N@@H+]2Cc2ccccc2C2CC2)c1 ZINC001560002473 1059807477 /nfs/dbraw/zinc/80/74/77/1059807477.db2.gz QCQZUDMIXRVEMV-FQEVSTJZSA-N 1 2 311.400 4.277 20 0 DIADLO Fc1cccc([C@@H]2COCC[N@H+]2Cc2ccccc2C2CC2)c1 ZINC001560002473 1059807499 /nfs/dbraw/zinc/80/74/99/1059807499.db2.gz QCQZUDMIXRVEMV-FQEVSTJZSA-N 1 2 311.400 4.277 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3c(Cl)ccc(C)c3C)ccn12 ZINC001525273118 1059813302 /nfs/dbraw/zinc/81/33/02/1059813302.db2.gz AXQJQJFXKUQODW-UHFFFAOYSA-N 1 2 313.788 4.165 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC001560013817 1059821758 /nfs/dbraw/zinc/82/17/58/1059821758.db2.gz DISLOWNSAVQTLJ-JRPNMDOOSA-N 1 2 303.780 4.146 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC001560013817 1059821780 /nfs/dbraw/zinc/82/17/80/1059821780.db2.gz DISLOWNSAVQTLJ-JRPNMDOOSA-N 1 2 303.780 4.146 20 0 DIADLO Cc1cccc2[nH]c(Nc3ccc(Cn4cc[nH+]c4)cc3)cc21 ZINC001248437709 1059831497 /nfs/dbraw/zinc/83/14/97/1059831497.db2.gz UROCWVVHJNBMON-UHFFFAOYSA-N 1 2 302.381 4.465 20 0 DIADLO Cc1cc(NCc2cnn(-c3ccccc3)c2)[nH+]c2ccccc12 ZINC001248509587 1059858346 /nfs/dbraw/zinc/85/83/46/1059858346.db2.gz VDCBNGGXDPQGBK-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO CC(C)OC1C[NH+](Cc2cccc(-c3ccc(Cl)cc3)n2)C1 ZINC001248520045 1059861312 /nfs/dbraw/zinc/86/13/12/1059861312.db2.gz FPAIJEBKXZHXMM-UHFFFAOYSA-N 1 2 316.832 4.011 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2coc3ccc(Cl)cc23)c[nH+]1 ZINC001525405569 1059868687 /nfs/dbraw/zinc/86/86/87/1059868687.db2.gz OMGKHHVICXTQPA-UHFFFAOYSA-N 1 2 314.772 4.028 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2cc3cccc(C)c3s2)c[nH+]1 ZINC001525405315 1059868765 /nfs/dbraw/zinc/86/87/65/1059868765.db2.gz CPTJFRVAOLGCJN-UHFFFAOYSA-N 1 2 310.422 4.152 20 0 DIADLO Cc1ccc2c(C[N@@H+]3CCC[C@H](F)C(F)(F)C3)cccc2n1 ZINC001248550294 1059879865 /nfs/dbraw/zinc/87/98/65/1059879865.db2.gz ISBQDRDSVVJLNX-INIZCTEOSA-N 1 2 308.347 4.112 20 0 DIADLO Cc1ccc2c(C[N@H+]3CCC[C@H](F)C(F)(F)C3)cccc2n1 ZINC001248550294 1059879893 /nfs/dbraw/zinc/87/98/93/1059879893.db2.gz ISBQDRDSVVJLNX-INIZCTEOSA-N 1 2 308.347 4.112 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@H+](Cc2ccc(Cl)nc2)C1 ZINC001560081004 1059895336 /nfs/dbraw/zinc/89/53/36/1059895336.db2.gz BIRWBNJYXPALTL-KRWDZBQOSA-N 1 2 304.796 4.196 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@@H+](Cc2ccc(Cl)nc2)C1 ZINC001560081004 1059895366 /nfs/dbraw/zinc/89/53/66/1059895366.db2.gz BIRWBNJYXPALTL-KRWDZBQOSA-N 1 2 304.796 4.196 20 0 DIADLO COc1c(C[NH+]2CCC(C)(F)CC2)ccc(Cl)c1Cl ZINC001248628952 1059919200 /nfs/dbraw/zinc/91/92/00/1059919200.db2.gz YKYAYLYZGAYBGY-UHFFFAOYSA-N 1 2 306.208 4.326 20 0 DIADLO CCOC1CC[NH+](Cc2ccc(Cl)c(Cl)c2OC)CC1 ZINC001248637694 1059922175 /nfs/dbraw/zinc/92/21/75/1059922175.db2.gz WFWUIARNINIIFX-UHFFFAOYSA-N 1 2 318.244 4.003 20 0 DIADLO CCCCCCc1csc(CN2CCn3c[nH+]cc3C2)c1 ZINC001248687583 1059939635 /nfs/dbraw/zinc/93/96/35/1059939635.db2.gz VSASNKHIOZUGMS-UHFFFAOYSA-N 1 2 303.475 4.083 20 0 DIADLO CC(C)CC1(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)CCCC1 ZINC001525572975 1059943211 /nfs/dbraw/zinc/94/32/11/1059943211.db2.gz YUDXQZHNWJQWMY-UHFFFAOYSA-N 1 2 311.429 4.417 20 0 DIADLO C/C(=C\c1cccc(Cl)c1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001533645830 1059957122 /nfs/dbraw/zinc/95/71/22/1059957122.db2.gz RLDLENLZKPXVHV-FMIVXFBMSA-N 1 2 311.772 4.030 20 0 DIADLO CC[C@@H](c1ccc(Br)cc1)[N@@H+]1CCC[C@H](F)C1 ZINC001560205178 1059983799 /nfs/dbraw/zinc/98/37/99/1059983799.db2.gz NYGMNANRFLZGGR-KBPBESRZSA-N 1 2 300.215 4.334 20 0 DIADLO CC[C@@H](c1ccc(Br)cc1)[N@H+]1CCC[C@H](F)C1 ZINC001560205178 1059983822 /nfs/dbraw/zinc/98/38/22/1059983822.db2.gz NYGMNANRFLZGGR-KBPBESRZSA-N 1 2 300.215 4.334 20 0 DIADLO Oc1cccc2c1CC[N@H+](Cc1cnc3ccccc3c1Cl)C2 ZINC001248810192 1059987648 /nfs/dbraw/zinc/98/76/48/1059987648.db2.gz CHRBPFCNWCTWBQ-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1cccc2c1CC[N@@H+](Cc1cnc3ccccc3c1Cl)C2 ZINC001248810192 1059987662 /nfs/dbraw/zinc/98/76/62/1059987662.db2.gz CHRBPFCNWCTWBQ-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO O=C(Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1)[C@H]1CC=CCC1 ZINC001525682735 1059987801 /nfs/dbraw/zinc/98/78/01/1059987801.db2.gz XHHPCGIGHJMIGC-INIZCTEOSA-N 1 2 322.408 4.148 20 0 DIADLO C[N@H+](Cc1ccc2n1CCC2)Cc1ccc(Cl)cc1Cl ZINC001248820792 1060002527 /nfs/dbraw/zinc/00/25/27/1060002527.db2.gz CMKKSQDELZASLA-UHFFFAOYSA-N 1 2 309.240 4.373 20 0 DIADLO C[N@@H+](Cc1ccc2n1CCC2)Cc1ccc(Cl)cc1Cl ZINC001248820792 1060002547 /nfs/dbraw/zinc/00/25/47/1060002547.db2.gz CMKKSQDELZASLA-UHFFFAOYSA-N 1 2 309.240 4.373 20 0 DIADLO FC(F)(F)c1cccc2c1CC[N@H+](Cc1ccc3n1CCC3)C2 ZINC001248824688 1060005198 /nfs/dbraw/zinc/00/51/98/1060005198.db2.gz XMWZGGLCBHZIMS-UHFFFAOYSA-N 1 2 320.358 4.011 20 0 DIADLO FC(F)(F)c1cccc2c1CC[N@@H+](Cc1ccc3n1CCC3)C2 ZINC001248824688 1060005217 /nfs/dbraw/zinc/00/52/17/1060005217.db2.gz XMWZGGLCBHZIMS-UHFFFAOYSA-N 1 2 320.358 4.011 20 0 DIADLO CC(C)(C)[C@H]1CC[N@H+](Cc2ncc(-c3cccs3)o2)CCO1 ZINC001560235705 1060007032 /nfs/dbraw/zinc/00/70/32/1060007032.db2.gz SUWFPTNLEQWATH-OAHLLOKOSA-N 1 2 320.458 4.040 20 0 DIADLO CC(C)(C)[C@H]1CC[N@@H+](Cc2ncc(-c3cccs3)o2)CCO1 ZINC001560235705 1060007052 /nfs/dbraw/zinc/00/70/52/1060007052.db2.gz SUWFPTNLEQWATH-OAHLLOKOSA-N 1 2 320.458 4.040 20 0 DIADLO c1ccc(COc2ccc(C[NH+]3Cc4ccccc4C3)nc2)cc1 ZINC001248860797 1060019370 /nfs/dbraw/zinc/01/93/70/1060019370.db2.gz QYNLVYNNXBUHCN-UHFFFAOYSA-N 1 2 316.404 4.176 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nc3cccc(Br)c3o2)[C@H](C)C1 ZINC001248851353 1060021043 /nfs/dbraw/zinc/02/10/43/1060021043.db2.gz IEQHUINXKCMPIL-GHMZBOCLSA-N 1 2 323.234 4.211 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nc3cccc(Br)c3o2)[C@H](C)C1 ZINC001248851353 1060021067 /nfs/dbraw/zinc/02/10/67/1060021067.db2.gz IEQHUINXKCMPIL-GHMZBOCLSA-N 1 2 323.234 4.211 20 0 DIADLO CCC[C@H](C)C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001525783099 1060031732 /nfs/dbraw/zinc/03/17/32/1060031732.db2.gz INBISGXKGAMJLB-AWEZNQCLSA-N 1 2 312.413 4.228 20 0 DIADLO CC[C@@H](C)CC(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001525788610 1060032457 /nfs/dbraw/zinc/03/24/57/1060032457.db2.gz ZCOIPZYETKRFMP-CQSZACIVSA-N 1 2 312.413 4.228 20 0 DIADLO Clc1cscc1C[NH2+]Cc1cccnc1OC1CCCC1 ZINC001560265020 1060034555 /nfs/dbraw/zinc/03/45/55/1060034555.db2.gz AHKWIMSKBKPHTD-UHFFFAOYSA-N 1 2 322.861 4.408 20 0 DIADLO Fc1c(CNc2ccc(-n3cc[nH+]c3)cc2)cccc1OC1CC1 ZINC001560279884 1060056023 /nfs/dbraw/zinc/05/60/23/1060056023.db2.gz ASQVWBHLMUTJDB-UHFFFAOYSA-N 1 2 323.371 4.165 20 0 DIADLO c1cn(-c2ccc(-c3noc([C@@H]4CC45CCCCC5)n3)cc2)c[nH+]1 ZINC001248951369 1060083051 /nfs/dbraw/zinc/08/30/51/1060083051.db2.gz NGGUIZGBVGIOHX-INIZCTEOSA-N 1 2 320.396 4.360 20 0 DIADLO Cc1cc(C)nc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)n1 ZINC001248977534 1060098133 /nfs/dbraw/zinc/09/81/33/1060098133.db2.gz MTBCTBRWEIRCDU-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C)nc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)n1 ZINC001248977534 1060098153 /nfs/dbraw/zinc/09/81/53/1060098153.db2.gz MTBCTBRWEIRCDU-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO [NH3+][C@@H](c1nc(-c2cccc(Cl)c2)no1)c1ccc(Cl)cc1 ZINC001248997952 1060103221 /nfs/dbraw/zinc/10/32/21/1060103221.db2.gz FGICYRZJEKTCCK-CYBMUJFWSA-N 1 2 320.179 4.092 20 0 DIADLO CCc1ccc(-c2noc([C@H]([NH3+])c3ccc(Cl)cc3)n2)cc1 ZINC001248998629 1060105566 /nfs/dbraw/zinc/10/55/66/1060105566.db2.gz NXOLYOPSVHISLL-OAHLLOKOSA-N 1 2 313.788 4.001 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2cc(F)c(F)c(F)c2)on1 ZINC001560357699 1060143406 /nfs/dbraw/zinc/14/34/06/1060143406.db2.gz USGQHPPPDAGLMZ-UHFFFAOYSA-N 1 2 312.335 4.285 20 0 DIADLO c1cn2c(cccc2CNc2cccc(N3CCCCCC3)c2)[nH+]1 ZINC001560379034 1060165970 /nfs/dbraw/zinc/16/59/70/1060165970.db2.gz HYUYXUDCWSHDBS-UHFFFAOYSA-N 1 2 320.440 4.327 20 0 DIADLO COc1cc(CNc2ccc3c(c2)CCC[N@H+]3C)ccc1Cl ZINC001560389943 1060176222 /nfs/dbraw/zinc/17/62/22/1060176222.db2.gz XMMYZZAWOZDZFK-UHFFFAOYSA-N 1 2 316.832 4.343 20 0 DIADLO COc1cc(CNc2ccc3c(c2)CCC[N@@H+]3C)ccc1Cl ZINC001560389943 1060176232 /nfs/dbraw/zinc/17/62/32/1060176232.db2.gz XMMYZZAWOZDZFK-UHFFFAOYSA-N 1 2 316.832 4.343 20 0 DIADLO Cn1cc(CNc2ccc([NH+](C)C)cc2)c(C2CCCCC2)n1 ZINC001560391206 1060176414 /nfs/dbraw/zinc/17/64/14/1060176414.db2.gz VDZYYCSOWGOFDZ-UHFFFAOYSA-N 1 2 312.461 4.146 20 0 DIADLO Cc1c(Cl)ccc(CNc2ccc(N(C)C)[nH+]c2)c1Cl ZINC001560392446 1060178666 /nfs/dbraw/zinc/17/86/66/1060178666.db2.gz HQXLORBHAIHZQX-UHFFFAOYSA-N 1 2 310.228 4.375 20 0 DIADLO Cc1cc(NCc2nc3cc(F)ccc3o2)ccc1-n1cc[nH+]c1 ZINC001560392225 1060179445 /nfs/dbraw/zinc/17/94/45/1060179445.db2.gz UMEBBJVLKWDRNL-UHFFFAOYSA-N 1 2 322.343 4.073 20 0 DIADLO CCOc1cccc(CNc2cc(CSCC)cc[nH+]2)c1 ZINC001560398293 1060183554 /nfs/dbraw/zinc/18/35/54/1060183554.db2.gz LDMWAOKEIWRUKO-UHFFFAOYSA-N 1 2 302.443 4.346 20 0 DIADLO COc1cc[nH+]cc1NCc1ccc(-c2c(F)cccc2F)o1 ZINC001560407841 1060192591 /nfs/dbraw/zinc/19/25/91/1060192591.db2.gz IJDPULNAOIUUGK-UHFFFAOYSA-N 1 2 316.307 4.241 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+]Cc1cccc(Cl)c1F)CCC2 ZINC001560412315 1060198097 /nfs/dbraw/zinc/19/80/97/1060198097.db2.gz PYYYQTHSHKPRNZ-OAHLLOKOSA-N 1 2 321.827 4.424 20 0 DIADLO Cc1cc(Br)ccc1NCc1cccc2[nH+]ccn21 ZINC001560415737 1060200494 /nfs/dbraw/zinc/20/04/94/1060200494.db2.gz YPZJLYRGGIIFBN-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO Cc1cc(F)ccc1-c1noc([C@H]2CC[N@@H+]2Cc2ccccc2)n1 ZINC001249256132 1060204176 /nfs/dbraw/zinc/20/41/76/1060204176.db2.gz OFTSXWZVIPAQEO-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cc(F)ccc1-c1noc([C@H]2CC[N@H+]2Cc2ccccc2)n1 ZINC001249256132 1060204191 /nfs/dbraw/zinc/20/41/91/1060204191.db2.gz OFTSXWZVIPAQEO-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO CCc1cccc(-c2noc([C@@H]3CC[N@@H+]3Cc3ccccc3)n2)c1 ZINC001249255101 1060204330 /nfs/dbraw/zinc/20/43/30/1060204330.db2.gz FDQGRDKBPUXUAE-SFHVURJKSA-N 1 2 319.408 4.246 20 0 DIADLO CCc1cccc(-c2noc([C@@H]3CC[N@H+]3Cc3ccccc3)n2)c1 ZINC001249255101 1060204347 /nfs/dbraw/zinc/20/43/47/1060204347.db2.gz FDQGRDKBPUXUAE-SFHVURJKSA-N 1 2 319.408 4.246 20 0 DIADLO CCc1cccc(-c2noc([C@H]3CC[N@@H+]3Cc3ccccc3)n2)c1 ZINC001249255098 1060205011 /nfs/dbraw/zinc/20/50/11/1060205011.db2.gz FDQGRDKBPUXUAE-GOSISDBHSA-N 1 2 319.408 4.246 20 0 DIADLO CCc1cccc(-c2noc([C@H]3CC[N@H+]3Cc3ccccc3)n2)c1 ZINC001249255098 1060205032 /nfs/dbraw/zinc/20/50/32/1060205032.db2.gz FDQGRDKBPUXUAE-GOSISDBHSA-N 1 2 319.408 4.246 20 0 DIADLO CCc1ccc(-c2noc([C@@H]3CC[N@@H+]3Cc3ccccc3)n2)cc1 ZINC001249256569 1060205255 /nfs/dbraw/zinc/20/52/55/1060205255.db2.gz UAACRRLNPXGPIK-SFHVURJKSA-N 1 2 319.408 4.246 20 0 DIADLO CCc1ccc(-c2noc([C@@H]3CC[N@H+]3Cc3ccccc3)n2)cc1 ZINC001249256569 1060205276 /nfs/dbraw/zinc/20/52/76/1060205276.db2.gz UAACRRLNPXGPIK-SFHVURJKSA-N 1 2 319.408 4.246 20 0 DIADLO Cc1cccc(-c2noc([C@H]3CC[N@@H+]3Cc3ccccc3)n2)c1C ZINC001249254498 1060205431 /nfs/dbraw/zinc/20/54/31/1060205431.db2.gz AKQWOESTTIKXLN-GOSISDBHSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1cccc(-c2noc([C@H]3CC[N@H+]3Cc3ccccc3)n2)c1C ZINC001249254498 1060205446 /nfs/dbraw/zinc/20/54/46/1060205446.db2.gz AKQWOESTTIKXLN-GOSISDBHSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1csc(-c3ccncc3)n1)C2 ZINC001249263845 1060207791 /nfs/dbraw/zinc/20/77/91/1060207791.db2.gz YZOWHGPMHKPXER-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1csc(-c3ccncc3)n1)C2 ZINC001249263845 1060207793 /nfs/dbraw/zinc/20/77/93/1060207793.db2.gz YZOWHGPMHKPXER-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO COc1ccc2nc(C[N@@H+]3CCC[C@H]3c3ccccc3C)[nH]c2c1 ZINC001249412334 1060244656 /nfs/dbraw/zinc/24/46/56/1060244656.db2.gz DLSPQDJKBMZPCP-IBGZPJMESA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccc2nc(C[N@H+]3CCC[C@H]3c3ccccc3C)[nH]c2c1 ZINC001249412334 1060244672 /nfs/dbraw/zinc/24/46/72/1060244672.db2.gz DLSPQDJKBMZPCP-IBGZPJMESA-N 1 2 321.424 4.217 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+]2CCc3c(C)cccc3C2)cn1 ZINC001249512471 1060271569 /nfs/dbraw/zinc/27/15/69/1060271569.db2.gz QOXSUWJHFSHMET-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+]2CCc3c(C)cccc3C2)cn1 ZINC001249512471 1060271585 /nfs/dbraw/zinc/27/15/85/1060271585.db2.gz QOXSUWJHFSHMET-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+](Cc2ccco2)C2CC2)cn1 ZINC001249515527 1060273015 /nfs/dbraw/zinc/27/30/15/1060273015.db2.gz FGKGIBRDFXNAGJ-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+](Cc2ccco2)C2CC2)cn1 ZINC001249515527 1060273033 /nfs/dbraw/zinc/27/30/33/1060273033.db2.gz FGKGIBRDFXNAGJ-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO Cc1[nH+]c(NCc2ccccc2Cl)ccc1-c1cnn(C)c1 ZINC001560482024 1060273173 /nfs/dbraw/zinc/27/31/73/1060273173.db2.gz CWCCKPHDZIEXQH-UHFFFAOYSA-N 1 2 312.804 4.056 20 0 DIADLO Cc1ccc(NC(=O)c2cc3ccccc3cc2F)c(N(C)C)[nH+]1 ZINC001526675353 1060298177 /nfs/dbraw/zinc/29/81/77/1060298177.db2.gz YRDBBZDDRSJBIR-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO Cc1nc(Nc2cc[nH+]cc2C(F)(F)F)c(Cl)cc1Cl ZINC001249582671 1060298252 /nfs/dbraw/zinc/29/82/52/1060298252.db2.gz DSTDMMIHVWBNBM-UHFFFAOYSA-N 1 2 322.117 4.276 20 0 DIADLO Cc1ccc(NC(=O)C[C@@H](C)C2CCCCC2)c(N(C)C)[nH+]1 ZINC001526675096 1060298389 /nfs/dbraw/zinc/29/83/89/1060298389.db2.gz VEVDZFMMGAGOEO-CYBMUJFWSA-N 1 2 303.450 4.001 20 0 DIADLO CCc1ccc2occ(C(=O)Nc3ccc(C)[nH+]c3N(C)C)c2c1 ZINC001534566398 1060305023 /nfs/dbraw/zinc/30/50/23/1060305023.db2.gz XVIAEKWFLVPIOB-UHFFFAOYSA-N 1 2 323.396 4.017 20 0 DIADLO CC[N@H+](Cc1cc(C)sn1)Cc1ccc(C(F)(F)F)cc1 ZINC001249592671 1060305255 /nfs/dbraw/zinc/30/52/55/1060305255.db2.gz PUXHMPAOEUJVNB-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CC[N@@H+](Cc1cc(C)sn1)Cc1ccc(C(F)(F)F)cc1 ZINC001249592671 1060305278 /nfs/dbraw/zinc/30/52/78/1060305278.db2.gz PUXHMPAOEUJVNB-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H](Oc3ccc(Cl)cc3)C2)ns1 ZINC001249589053 1060305580 /nfs/dbraw/zinc/30/55/80/1060305580.db2.gz RJYQZFPLGSEQER-MRXNPFEDSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H](Oc3ccc(Cl)cc3)C2)ns1 ZINC001249589053 1060305601 /nfs/dbraw/zinc/30/56/01/1060305601.db2.gz RJYQZFPLGSEQER-MRXNPFEDSA-N 1 2 322.861 4.148 20 0 DIADLO CCCCOc1cc(C[NH2+]CC(F)(F)CC)ccc1OC ZINC001560533538 1060336802 /nfs/dbraw/zinc/33/68/02/1060336802.db2.gz BOIRYLKSYFDPAN-UHFFFAOYSA-N 1 2 301.377 4.009 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1cc2cc(Cl)ccc2s1 ZINC001534713291 1060347035 /nfs/dbraw/zinc/34/70/35/1060347035.db2.gz UUUPJRIHFNROCJ-UHFFFAOYSA-N 1 2 316.813 4.241 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2cccs2)n1)c1ccns1 ZINC001560551530 1060360077 /nfs/dbraw/zinc/36/00/77/1060360077.db2.gz SBTLVEFVPXUMMM-VIFPVBQESA-N 1 2 307.469 4.179 20 0 DIADLO Cc1cc(C)c(NC(=S)Nc2ccn3cc[nH+]c3c2)c(C)c1 ZINC001249724892 1060372418 /nfs/dbraw/zinc/37/24/18/1060372418.db2.gz JJDCQQNILXLZOD-UHFFFAOYSA-N 1 2 310.426 4.068 20 0 DIADLO CCSCc1ccc[nH+]c1NC/C=C/c1ccccc1OC ZINC001560568717 1060379410 /nfs/dbraw/zinc/37/94/10/1060379410.db2.gz XUPIDPQKPBNMCH-RMKNXTFCSA-N 1 2 314.454 4.469 20 0 DIADLO Cc1ccc2[nH+]c(NCc3cnc(CC(C)C)s3)[nH]c2c1 ZINC001560569721 1060380635 /nfs/dbraw/zinc/38/06/35/1060380635.db2.gz FNCMRHVAKPULTM-UHFFFAOYSA-N 1 2 300.431 4.138 20 0 DIADLO Cc1ccc(C[NH2+]Cc2ccnc(Cl)c2Cl)c(Cl)n1 ZINC001560572685 1060383785 /nfs/dbraw/zinc/38/37/85/1060383785.db2.gz XVDWWLPERODESV-UHFFFAOYSA-N 1 2 316.619 4.035 20 0 DIADLO Cc1ccsc1CNc1[nH]c2ccc(Br)cc2[nH+]1 ZINC001560574153 1060388797 /nfs/dbraw/zinc/38/87/97/1060388797.db2.gz JFYYQHMVZHPWFP-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO Cc1ccsc1CNc1[nH]c2cc(Br)ccc2[nH+]1 ZINC001560574153 1060388818 /nfs/dbraw/zinc/38/88/18/1060388818.db2.gz JFYYQHMVZHPWFP-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO CC(C)(C)c1n[nH]cc1CNc1[nH+]c2ccccc2n1CC1CC1 ZINC001560595406 1060407508 /nfs/dbraw/zinc/40/75/08/1060407508.db2.gz ADTTXHSOOKDPJX-UHFFFAOYSA-N 1 2 323.444 4.079 20 0 DIADLO c1cc(C[NH2+][C@@H]2C[C@@H](c3ccccc3)Oc3ccccc32)no1 ZINC001560608661 1060422626 /nfs/dbraw/zinc/42/26/26/1060422626.db2.gz XTOFLWDIPCGBQX-MJGOQNOKSA-N 1 2 306.365 4.029 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cccc2c1CCC2 ZINC001560622322 1060434502 /nfs/dbraw/zinc/43/45/02/1060434502.db2.gz GMYBZICOEAYEKW-UHFFFAOYSA-N 1 2 309.388 4.296 20 0 DIADLO Fc1ccc2cc(Nc3cc(Cl)c4[nH+]ccn4c3)[nH]c2c1 ZINC001249873414 1060436996 /nfs/dbraw/zinc/43/69/96/1060436996.db2.gz DBNKRKUEAGHEKN-UHFFFAOYSA-N 1 2 300.724 4.352 20 0 DIADLO COc1ccc2[nH]c(Nc3ccc(N4CCCCC4)[nH+]c3)cc2c1 ZINC001249880359 1060443013 /nfs/dbraw/zinc/44/30/13/1060443013.db2.gz NNYXOKSMGGLIGE-UHFFFAOYSA-N 1 2 322.412 4.305 20 0 DIADLO CCO[C@H]1C[C@@H]([N@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001560635718 1060447618 /nfs/dbraw/zinc/44/76/18/1060447618.db2.gz LKGJKXHFQBJHRT-OLZOCXBDSA-N 1 2 317.260 4.024 20 0 DIADLO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001560635718 1060447628 /nfs/dbraw/zinc/44/76/28/1060447628.db2.gz LKGJKXHFQBJHRT-OLZOCXBDSA-N 1 2 317.260 4.024 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1C[C@H](C)C[C@H]1c1ccccc1F ZINC001560641878 1060459885 /nfs/dbraw/zinc/45/98/85/1060459885.db2.gz DJWHICPERLECMO-DOMZBBRYSA-N 1 2 321.827 4.279 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1C[C@H](C)C[C@H]1c1ccccc1F ZINC001560641878 1060459891 /nfs/dbraw/zinc/45/98/91/1060459891.db2.gz DJWHICPERLECMO-DOMZBBRYSA-N 1 2 321.827 4.279 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)nc1C ZINC001249909659 1060474583 /nfs/dbraw/zinc/47/45/83/1060474583.db2.gz UDCABQLEAPZKBE-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)nc1C ZINC001249909659 1060474602 /nfs/dbraw/zinc/47/46/02/1060474602.db2.gz UDCABQLEAPZKBE-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccccc2F)cnc1Cl ZINC001249926145 1060486345 /nfs/dbraw/zinc/48/63/45/1060486345.db2.gz AYKMBNOVNRNGOP-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccccc2F)cnc1Cl ZINC001249926145 1060486355 /nfs/dbraw/zinc/48/63/55/1060486355.db2.gz AYKMBNOVNRNGOP-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@H+](C)Cc1cc2ccccc2o1 ZINC001560661764 1060488202 /nfs/dbraw/zinc/48/82/02/1060488202.db2.gz IBSNLHLTVXDRRP-UHFFFAOYSA-N 1 2 303.793 4.004 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@@H+](C)Cc1cc2ccccc2o1 ZINC001560661764 1060488210 /nfs/dbraw/zinc/48/82/10/1060488210.db2.gz IBSNLHLTVXDRRP-UHFFFAOYSA-N 1 2 303.793 4.004 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)cc(Cl)c2F)cn1 ZINC001249942715 1060496358 /nfs/dbraw/zinc/49/63/58/1060496358.db2.gz XNAXGZSIZREZKF-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cc(Cl)cc(Cl)c2F)cn1 ZINC001249942715 1060496361 /nfs/dbraw/zinc/49/63/61/1060496361.db2.gz XNAXGZSIZREZKF-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc4cccc(C)c4s3)ccc2[nH+]1 ZINC001527357411 1060499425 /nfs/dbraw/zinc/49/94/25/1060499425.db2.gz WOVRFJJFWMANIU-UHFFFAOYSA-N 1 2 321.405 4.418 20 0 DIADLO CCO[C@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001249945863 1060501810 /nfs/dbraw/zinc/50/18/10/1060501810.db2.gz UAVHRIBXNCTJQO-LBPRGKRZSA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001249945863 1060501828 /nfs/dbraw/zinc/50/18/28/1060501828.db2.gz UAVHRIBXNCTJQO-LBPRGKRZSA-N 1 2 306.208 4.133 20 0 DIADLO Oc1ccc(C[N@H+](Cc2ccccc2F)C2CCC2)c(F)c1F ZINC001560670531 1060503476 /nfs/dbraw/zinc/50/34/76/1060503476.db2.gz GDXUEKDSXARXJC-UHFFFAOYSA-N 1 2 321.342 4.364 20 0 DIADLO Oc1ccc(C[N@@H+](Cc2ccccc2F)C2CCC2)c(F)c1F ZINC001560670531 1060503489 /nfs/dbraw/zinc/50/34/89/1060503489.db2.gz GDXUEKDSXARXJC-UHFFFAOYSA-N 1 2 321.342 4.364 20 0 DIADLO CN1Cc2ccc(Nc3cc[nH+]c4cc(Cl)ccc34)cc2C1=O ZINC001249979535 1060517985 /nfs/dbraw/zinc/51/79/85/1060517985.db2.gz MUDQYZHCMZOKCV-UHFFFAOYSA-N 1 2 323.783 4.217 20 0 DIADLO CCOC(=O)CCCCc1ccc(N(C)C2CCCCC2)[nH+]c1 ZINC001249981119 1060519625 /nfs/dbraw/zinc/51/96/25/1060519625.db2.gz LERXKWIFWJLKRW-UHFFFAOYSA-N 1 2 318.461 4.126 20 0 DIADLO FC(F)(F)c1ccc(Cc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC001249994988 1060527319 /nfs/dbraw/zinc/52/73/19/1060527319.db2.gz BFVQCPCPXXDUAA-UHFFFAOYSA-N 1 2 306.331 4.291 20 0 DIADLO CO[C@H]1CCC[N@H+](Cc2cnc(Cl)c(Cl)c2Cl)CC1 ZINC001250034743 1060559118 /nfs/dbraw/zinc/55/91/18/1060559118.db2.gz ZQWRFKFJVSCNNS-JTQLQIEISA-N 1 2 323.651 4.043 20 0 DIADLO CO[C@H]1CCC[N@@H+](Cc2cnc(Cl)c(Cl)c2Cl)CC1 ZINC001250034743 1060559135 /nfs/dbraw/zinc/55/91/35/1060559135.db2.gz ZQWRFKFJVSCNNS-JTQLQIEISA-N 1 2 323.651 4.043 20 0 DIADLO COc1c(Br)cccc1Nc1[nH+]c(C)ccc1C ZINC001250039382 1060561478 /nfs/dbraw/zinc/56/14/78/1060561478.db2.gz WIANAEUSRJYWDE-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO COc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC001560692263 1060540929 /nfs/dbraw/zinc/54/09/29/1060540929.db2.gz SFXCCEKLJJOBAV-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)cc1C[N@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC001560692263 1060540945 /nfs/dbraw/zinc/54/09/45/1060540945.db2.gz SFXCCEKLJJOBAV-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@@H](C[N@H+](C)Cc1c(Cl)ccnc1Cl)c1nccs1 ZINC001560702742 1060556988 /nfs/dbraw/zinc/55/69/88/1060556988.db2.gz DFIQRXRSWYJSQP-VIFPVBQESA-N 1 2 316.257 4.080 20 0 DIADLO C[C@@H](C[N@@H+](C)Cc1c(Cl)ccnc1Cl)c1nccs1 ZINC001560702742 1060557006 /nfs/dbraw/zinc/55/70/06/1060557006.db2.gz DFIQRXRSWYJSQP-VIFPVBQESA-N 1 2 316.257 4.080 20 0 DIADLO COc1c(Br)cccc1Nc1[nH+]cc(C)cc1C ZINC001250039400 1060562679 /nfs/dbraw/zinc/56/26/79/1060562679.db2.gz XJESTOUABWDQLU-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCC[C@@H]1c1ccccc1)C(=O)OC(C)(C)C ZINC001560712596 1060570909 /nfs/dbraw/zinc/57/09/09/1060570909.db2.gz OVKGTKKRRBAHOC-UAGQMJEPSA-N 1 2 303.446 4.033 20 0 DIADLO Cc1c[nH+]c(Nc2cc(Cl)ccc2C(F)(F)F)c(N)c1 ZINC001250052854 1060570923 /nfs/dbraw/zinc/57/09/23/1060570923.db2.gz BETLDVFYCIWHEJ-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO C[C@@H](CC(C)(C)c1ccccc1)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC001560712494 1060570982 /nfs/dbraw/zinc/57/09/82/1060570982.db2.gz MHHPCJFDJDWZNQ-GJZGRUSLSA-N 1 2 305.462 4.063 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1c2c(nn1C)CCCC2 ZINC001560719212 1060581569 /nfs/dbraw/zinc/58/15/69/1060581569.db2.gz ZBFWZTXVHRVROC-UHFFFAOYSA-N 1 2 323.893 4.036 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1c2c(nn1C)CCCC2 ZINC001560719212 1060581589 /nfs/dbraw/zinc/58/15/89/1060581589.db2.gz ZBFWZTXVHRVROC-UHFFFAOYSA-N 1 2 323.893 4.036 20 0 DIADLO CCOC(=O)[C@@H]([NH2+]C[C@@H](C)c1cccc(Cl)c1)C(C)(C)C ZINC001560738798 1060607745 /nfs/dbraw/zinc/60/77/45/1060607745.db2.gz VQRDHGDEVIZFRB-IUODEOHRSA-N 1 2 311.853 4.011 20 0 DIADLO CCOC(=O)[C@@H]([NH2+]C[C@H](C)c1cccc(Cl)c1)C(C)(C)C ZINC001560738799 1060608219 /nfs/dbraw/zinc/60/82/19/1060608219.db2.gz VQRDHGDEVIZFRB-SWLSCSKDSA-N 1 2 311.853 4.011 20 0 DIADLO Cc1[nH]nc(C[N@@H+]2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1C ZINC001560751270 1060618981 /nfs/dbraw/zinc/61/89/81/1060618981.db2.gz KPPLILMEEWMEKT-AWEZNQCLSA-N 1 2 323.362 4.035 20 0 DIADLO Cc1[nH]nc(C[N@H+]2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1C ZINC001560751270 1060618991 /nfs/dbraw/zinc/61/89/91/1060618991.db2.gz KPPLILMEEWMEKT-AWEZNQCLSA-N 1 2 323.362 4.035 20 0 DIADLO CNc1ccc(C)cc1C[N@H+](Cc1c(F)cccc1F)C1CC1 ZINC001560757136 1060622262 /nfs/dbraw/zinc/62/22/62/1060622262.db2.gz BLAOSEYOCKSLRP-UHFFFAOYSA-N 1 2 316.395 4.480 20 0 DIADLO CNc1ccc(C)cc1C[N@@H+](Cc1c(F)cccc1F)C1CC1 ZINC001560757136 1060622272 /nfs/dbraw/zinc/62/22/72/1060622272.db2.gz BLAOSEYOCKSLRP-UHFFFAOYSA-N 1 2 316.395 4.480 20 0 DIADLO COC(=O)[C@H](CC1CCCCC1)[NH2+]CC[C@@H](C)c1ccccc1 ZINC001560756080 1060623462 /nfs/dbraw/zinc/62/34/62/1060623462.db2.gz AADNOONHCWXVFO-APWZRJJASA-N 1 2 317.473 4.282 20 0 DIADLO CC(C)Oc1cc(F)c(C[NH+]2CCC(C)(F)CC2)c(F)c1 ZINC001250142429 1060642711 /nfs/dbraw/zinc/64/27/11/1060642711.db2.gz NAOWAEVOHJZOAW-UHFFFAOYSA-N 1 2 301.352 4.076 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)c(F)c1 ZINC001250142439 1060643283 /nfs/dbraw/zinc/64/32/83/1060643283.db2.gz NGMQWEQLNGSLGN-NSHDSACASA-N 1 2 319.342 4.229 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@H+]2CCC(F)(F)[C@@H](C)C2)c(F)c1 ZINC001250142439 1060643289 /nfs/dbraw/zinc/64/32/89/1060643289.db2.gz NGMQWEQLNGSLGN-NSHDSACASA-N 1 2 319.342 4.229 20 0 DIADLO CC(C)Oc1cc(F)c(C[NH+]2CCC(C(F)F)CC2)c(F)c1 ZINC001250148165 1060646011 /nfs/dbraw/zinc/64/60/11/1060646011.db2.gz PCRWTVHKXHQDSZ-UHFFFAOYSA-N 1 2 319.342 4.229 20 0 DIADLO Clc1cccc2c1cc1n2CC[N@@H+](C[C@@H]2CC=CCC2)C1 ZINC001560794970 1060655657 /nfs/dbraw/zinc/65/56/57/1060655657.db2.gz JKVORYXEXMLAKI-CQSZACIVSA-N 1 2 300.833 4.467 20 0 DIADLO Clc1cccc2c1cc1n2CC[N@H+](C[C@@H]2CC=CCC2)C1 ZINC001560794970 1060655664 /nfs/dbraw/zinc/65/56/64/1060655664.db2.gz JKVORYXEXMLAKI-CQSZACIVSA-N 1 2 300.833 4.467 20 0 DIADLO COc1c(F)c(Cl)ccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001250191021 1060667772 /nfs/dbraw/zinc/66/77/72/1060667772.db2.gz CPAQINBEHFZXBG-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC001560825226 1060684986 /nfs/dbraw/zinc/68/49/86/1060684986.db2.gz GEKRXGUOWFLMDO-INIZCTEOSA-N 1 2 301.434 4.336 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC001560825226 1060684996 /nfs/dbraw/zinc/68/49/96/1060684996.db2.gz GEKRXGUOWFLMDO-INIZCTEOSA-N 1 2 301.434 4.336 20 0 DIADLO C[C@]1(C[NH2+][C@H](CCc2ccccc2)C(F)F)CC1(Cl)Cl ZINC001560839374 1060695141 /nfs/dbraw/zinc/69/51/41/1060695141.db2.gz QMTNCYPZKFEJAX-TZMCWYRMSA-N 1 2 322.226 4.426 20 0 DIADLO Oc1ccc(F)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1Cl ZINC001250233911 1060713743 /nfs/dbraw/zinc/71/37/43/1060713743.db2.gz ZUXYWNMDGBPUNV-UHFFFAOYSA-N 1 2 317.751 4.173 20 0 DIADLO CO[C@H](CNc1ccc(-n2c[nH+]c(C)c2C)cc1)C1CCCC1 ZINC001560860033 1060717435 /nfs/dbraw/zinc/71/74/35/1060717435.db2.gz ZGMPWSBQLSCTHW-LJQANCHMSA-N 1 2 313.445 4.106 20 0 DIADLO c1ccc(COCCCc2ccc(N3CCCCC3)[nH+]c2)cc1 ZINC001250247074 1060725914 /nfs/dbraw/zinc/72/59/14/1060725914.db2.gz SDGMWFKYWSJADN-UHFFFAOYSA-N 1 2 310.441 4.221 20 0 DIADLO Fc1cc(C[N@@H+]2CCC3(CC3)C2)c(Cl)c(C(F)(F)F)c1 ZINC001250270808 1060746938 /nfs/dbraw/zinc/74/69/38/1060746938.db2.gz XPMABEUXPXLGCX-UHFFFAOYSA-N 1 2 307.718 4.484 20 0 DIADLO Fc1cc(C[N@H+]2CCC3(CC3)C2)c(Cl)c(C(F)(F)F)c1 ZINC001250270808 1060746952 /nfs/dbraw/zinc/74/69/52/1060746952.db2.gz XPMABEUXPXLGCX-UHFFFAOYSA-N 1 2 307.718 4.484 20 0 DIADLO C[C@H]1CC(C)(C)C[N@@H+]1Cc1cc(Br)cnc1Cl ZINC001560888556 1060752400 /nfs/dbraw/zinc/75/24/00/1060752400.db2.gz GOLUVZJXSHELCY-VIFPVBQESA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC(C)(C)C[N@H+]1Cc1cc(Br)cnc1Cl ZINC001560888556 1060752418 /nfs/dbraw/zinc/75/24/18/1060752418.db2.gz GOLUVZJXSHELCY-VIFPVBQESA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H](CSc1ccccc1)[N@H+](C)Cc1ccc(O)c(F)c1F ZINC001560919578 1060783896 /nfs/dbraw/zinc/78/38/96/1060783896.db2.gz IGDOSVLDPJQLTK-GFCCVEGCSA-N 1 2 323.408 4.283 20 0 DIADLO C[C@H](CSc1ccccc1)[N@@H+](C)Cc1ccc(O)c(F)c1F ZINC001560919578 1060783905 /nfs/dbraw/zinc/78/39/05/1060783905.db2.gz IGDOSVLDPJQLTK-GFCCVEGCSA-N 1 2 323.408 4.283 20 0 DIADLO CCOc1nccc(C[N@@H+]2CCc3ccccc3[C@H]2C)c1Cl ZINC001250361768 1060789281 /nfs/dbraw/zinc/78/92/81/1060789281.db2.gz YDELGHQRFWCJRE-CYBMUJFWSA-N 1 2 316.832 4.253 20 0 DIADLO CCOc1nccc(C[N@H+]2CCc3ccccc3[C@H]2C)c1Cl ZINC001250361768 1060789293 /nfs/dbraw/zinc/78/92/93/1060789293.db2.gz YDELGHQRFWCJRE-CYBMUJFWSA-N 1 2 316.832 4.253 20 0 DIADLO C[N@H+](CCc1cccs1)Cc1cc(O)c(Cl)c(F)c1F ZINC001250408485 1060795249 /nfs/dbraw/zinc/79/52/49/1060795249.db2.gz IAYVVRPSQXYZAQ-UHFFFAOYSA-N 1 2 317.788 4.060 20 0 DIADLO C[N@@H+](CCc1cccs1)Cc1cc(O)c(Cl)c(F)c1F ZINC001250408485 1060795256 /nfs/dbraw/zinc/79/52/56/1060795256.db2.gz IAYVVRPSQXYZAQ-UHFFFAOYSA-N 1 2 317.788 4.060 20 0 DIADLO C[C@H]1CC[C@H]([N@H+](C)Cc2cc(O)c(Cl)c(F)c2F)CC1 ZINC001250415980 1060796641 /nfs/dbraw/zinc/79/66/41/1060796641.db2.gz YEKJZAYIKBLWFQ-HOMQSWHASA-N 1 2 303.780 4.334 20 0 DIADLO C[C@H]1CC[C@H]([N@@H+](C)Cc2cc(O)c(Cl)c(F)c2F)CC1 ZINC001250415980 1060796658 /nfs/dbraw/zinc/79/66/58/1060796658.db2.gz YEKJZAYIKBLWFQ-HOMQSWHASA-N 1 2 303.780 4.334 20 0 DIADLO CO[C@@H](CNc1ccc(Nc2ccccc2)c[nH+]1)C1CCCC1 ZINC001560939655 1060802381 /nfs/dbraw/zinc/80/23/81/1060802381.db2.gz MUQGZITVWRZBFV-SFHVURJKSA-N 1 2 311.429 4.442 20 0 DIADLO CCO[C@H]1C[C@H]([NH2+]CC(F)(F)c2ccccc2C)C12CCC2 ZINC001560948786 1060814703 /nfs/dbraw/zinc/81/47/03/1060814703.db2.gz HWLHOPNWMNQOAZ-HOTGVXAUSA-N 1 2 309.400 4.024 20 0 DIADLO Cc1cc(C)c(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)c(C)c1 ZINC001250459011 1060815212 /nfs/dbraw/zinc/81/52/12/1060815212.db2.gz ILNPAPZQTPEVNU-UHFFFAOYSA-N 1 2 320.371 4.480 20 0 DIADLO Cc1cc(NC2CCC(C(=O)OC(C)(C)C)CC2)c[nH+]c1C ZINC001560985475 1060849549 /nfs/dbraw/zinc/84/95/49/1060849549.db2.gz BHXNLXJYNSYJKT-UHFFFAOYSA-N 1 2 304.434 4.011 20 0 DIADLO FC[C@H]1CC[N@H+](Cc2c(F)c(Cl)ccc2Br)C1 ZINC001560984861 1060850270 /nfs/dbraw/zinc/85/02/70/1060850270.db2.gz KDIXJDGOXTTZKL-MRVPVSSYSA-N 1 2 324.596 4.033 20 0 DIADLO FC[C@H]1CC[N@@H+](Cc2c(F)c(Cl)ccc2Br)C1 ZINC001560984861 1060850276 /nfs/dbraw/zinc/85/02/76/1060850276.db2.gz KDIXJDGOXTTZKL-MRVPVSSYSA-N 1 2 324.596 4.033 20 0 DIADLO COc1cc(C[C@@H](C)Nc2ccc3[nH+]c(C)cc(C)c3c2)ccn1 ZINC001561007795 1060866596 /nfs/dbraw/zinc/86/65/96/1060866596.db2.gz FYFCVZJFIDDEKG-OAHLLOKOSA-N 1 2 321.424 4.298 20 0 DIADLO CCCn1cc(C[N@H+](CCCC(C)C)Cc2ccc(C)o2)nn1 ZINC001561008382 1060867558 /nfs/dbraw/zinc/86/75/58/1060867558.db2.gz YKRPQHSXAICZOG-UHFFFAOYSA-N 1 2 318.465 4.028 20 0 DIADLO CCCn1cc(C[N@@H+](CCCC(C)C)Cc2ccc(C)o2)nn1 ZINC001561008382 1060867572 /nfs/dbraw/zinc/86/75/72/1060867572.db2.gz YKRPQHSXAICZOG-UHFFFAOYSA-N 1 2 318.465 4.028 20 0 DIADLO Clc1ccc([C@H]2C[C@H]2c2[nH]c3cc4c(cc3[nH+]2)OCC4)cc1 ZINC001250537188 1060882792 /nfs/dbraw/zinc/88/27/92/1060882792.db2.gz HPNDIQOGRCCZLD-ZIAGYGMSSA-N 1 2 310.784 4.422 20 0 DIADLO CCCOc1cc2[nH]c([C@H]3CCCOC3)[nH+]c2cc1OCCC ZINC001250551606 1060891241 /nfs/dbraw/zinc/89/12/41/1060891241.db2.gz QKJHAKJMYLQPKB-ZDUSSCGKSA-N 1 2 318.417 4.035 20 0 DIADLO COc1ccc2c(c1)[nH+]c(CCc1cccc(Cl)c1)n2C ZINC001250553896 1060893620 /nfs/dbraw/zinc/89/36/20/1060893620.db2.gz PZYQGPLNBBFQEI-UHFFFAOYSA-N 1 2 300.789 4.021 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCO[C@@H](C(C)(C)C)CC2)s1 ZINC001561052315 1060902552 /nfs/dbraw/zinc/90/25/52/1060902552.db2.gz YDWWKQXYJQIZJM-CYBMUJFWSA-N 1 2 310.507 4.078 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCO[C@@H](C(C)(C)C)CC2)s1 ZINC001561052315 1060902568 /nfs/dbraw/zinc/90/25/68/1060902568.db2.gz YDWWKQXYJQIZJM-CYBMUJFWSA-N 1 2 310.507 4.078 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1ccc(O)c(F)c1F ZINC001561058438 1060905230 /nfs/dbraw/zinc/90/52/30/1060905230.db2.gz QLPHDOQDFVYPLG-UHFFFAOYSA-N 1 2 317.339 4.213 20 0 DIADLO FC(F)[C@H]([NH2+][C@H]1Cc2[nH]c3ccccc3c2C1)c1ccccc1 ZINC001561059097 1060907431 /nfs/dbraw/zinc/90/74/31/1060907431.db2.gz OOKNXZWITMLLIJ-FZKQIMNGSA-N 1 2 312.363 4.231 20 0 DIADLO Fc1cccc2[nH]c([C@H]3CCCC[N@@H+]3Cc3ccccc3)nc21 ZINC001250573154 1060910491 /nfs/dbraw/zinc/91/04/91/1060910491.db2.gz ZYJTUNQQQRERIJ-QGZVFWFLSA-N 1 2 309.388 4.429 20 0 DIADLO Fc1cccc2[nH]c([C@H]3CCCC[N@H+]3Cc3ccccc3)nc21 ZINC001250573154 1060910507 /nfs/dbraw/zinc/91/05/07/1060910507.db2.gz ZYJTUNQQQRERIJ-QGZVFWFLSA-N 1 2 309.388 4.429 20 0 DIADLO COc1ccc2c(c1)[nH+]c(CCCCOCc1ccccc1)n2C ZINC001250583048 1060917576 /nfs/dbraw/zinc/91/75/76/1060917576.db2.gz RIKXRMNLRLDQRE-UHFFFAOYSA-N 1 2 324.424 4.121 20 0 DIADLO Fc1cc2[nH]c(CCCCOCc3ccccc3)[nH+]c2cc1F ZINC001250583574 1060917747 /nfs/dbraw/zinc/91/77/47/1060917747.db2.gz LADNQWSZWHFVBP-UHFFFAOYSA-N 1 2 316.351 4.381 20 0 DIADLO COc1ccc2[nH]c(CCCCOCc3ccccc3)[nH+]c2c1 ZINC001250582954 1060917850 /nfs/dbraw/zinc/91/78/50/1060917850.db2.gz NSZSJWANJUYWGE-UHFFFAOYSA-N 1 2 310.397 4.111 20 0 DIADLO CCC[C@]1(C)CCC[N@@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001473191243 1060942452 /nfs/dbraw/zinc/94/24/52/1060942452.db2.gz KFWLMVYGDAJZMM-FUHWJXTLSA-N 1 2 323.864 4.456 20 0 DIADLO CCC[C@]1(C)CCC[N@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001473191243 1060942458 /nfs/dbraw/zinc/94/24/58/1060942458.db2.gz KFWLMVYGDAJZMM-FUHWJXTLSA-N 1 2 323.864 4.456 20 0 DIADLO CC[C@@]1(C)COCC[N@@H+]1Cc1ccc(Oc2ccccc2)o1 ZINC001462128020 1060950719 /nfs/dbraw/zinc/95/07/19/1060950719.db2.gz RFJOCOKRKKYGEX-SFHVURJKSA-N 1 2 301.386 4.073 20 0 DIADLO CC[C@@]1(C)COCC[N@H+]1Cc1ccc(Oc2ccccc2)o1 ZINC001462128020 1060950741 /nfs/dbraw/zinc/95/07/41/1060950741.db2.gz RFJOCOKRKKYGEX-SFHVURJKSA-N 1 2 301.386 4.073 20 0 DIADLO Fc1cc2[nH]c(-c3ccc4cc[nH]c4c3)nc2cc1-n1cc[nH+]c1 ZINC001250620138 1060951333 /nfs/dbraw/zinc/95/13/33/1060951333.db2.gz LZVSWAWFOHZOPW-UHFFFAOYSA-N 1 2 317.327 4.036 20 0 DIADLO CCCC[C@H](C)[C@H](C)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001462172482 1060990153 /nfs/dbraw/zinc/99/01/53/1060990153.db2.gz BOVHPGOULBRAHN-QAETUUGQSA-N 1 2 319.493 4.322 20 0 DIADLO Fc1ccc2[nH]cc(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)c2c1 ZINC001250650111 1060991345 /nfs/dbraw/zinc/99/13/45/1060991345.db2.gz LLYUMVCHLGCKQT-UHFFFAOYSA-N 1 2 320.371 4.451 20 0 DIADLO c1cnc2cccc(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)c2c1 ZINC001250663140 1060998559 /nfs/dbraw/zinc/99/85/59/1060998559.db2.gz QGMITHJYBBVSLO-UHFFFAOYSA-N 1 2 314.392 4.378 20 0 DIADLO CC(C)[C@H]1c2ccccc2CC[N@H+]1Cc1c(F)cncc1F ZINC001473223815 1060999793 /nfs/dbraw/zinc/99/97/93/1060999793.db2.gz SUGDXLITXYLBMZ-SFHVURJKSA-N 1 2 302.368 4.115 20 0 DIADLO CC(C)[C@H]1c2ccccc2CC[N@@H+]1Cc1c(F)cncc1F ZINC001473223815 1060999812 /nfs/dbraw/zinc/99/98/12/1060999812.db2.gz SUGDXLITXYLBMZ-SFHVURJKSA-N 1 2 302.368 4.115 20 0 DIADLO CC(C)[C@@H]1c2ccccc2CC[N@H+]1Cc1c(F)cncc1F ZINC001473223812 1061002672 /nfs/dbraw/zinc/00/26/72/1061002672.db2.gz SUGDXLITXYLBMZ-GOSISDBHSA-N 1 2 302.368 4.115 20 0 DIADLO CC(C)[C@@H]1c2ccccc2CC[N@@H+]1Cc1c(F)cncc1F ZINC001473223812 1061002689 /nfs/dbraw/zinc/00/26/89/1061002689.db2.gz SUGDXLITXYLBMZ-GOSISDBHSA-N 1 2 302.368 4.115 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc(C(C)(C)C)cc2)cc(C)[nH+]1 ZINC001562171714 1061003081 /nfs/dbraw/zinc/00/30/81/1061003081.db2.gz YQCYYHAURABDDR-UHFFFAOYSA-N 1 2 311.429 4.318 20 0 DIADLO Cc1ccc2c(c1)N(Cc1ccc(-n3cc[nH+]c3)cc1C)CC2 ZINC001473233738 1061012839 /nfs/dbraw/zinc/01/28/39/1061012839.db2.gz XCNOGUUWEFITBV-UHFFFAOYSA-N 1 2 303.409 4.052 20 0 DIADLO Clc1nccc2oc(C[N@@H+]3CCOC4(CCCCC4)C3)cc21 ZINC001462191900 1061014592 /nfs/dbraw/zinc/01/45/92/1061014592.db2.gz PXAHOUTZJLBNEI-UHFFFAOYSA-N 1 2 320.820 4.016 20 0 DIADLO Clc1nccc2oc(C[N@H+]3CCOC4(CCCCC4)C3)cc21 ZINC001462191900 1061014617 /nfs/dbraw/zinc/01/46/17/1061014617.db2.gz PXAHOUTZJLBNEI-UHFFFAOYSA-N 1 2 320.820 4.016 20 0 DIADLO Cc1cn2cc(NC(=O)NC(CC(C)C)CC(C)C)ccc2[nH+]1 ZINC001562322842 1061029841 /nfs/dbraw/zinc/02/98/41/1061029841.db2.gz LAMKSFHOFOOQIS-UHFFFAOYSA-N 1 2 316.449 4.225 20 0 DIADLO CCC[C@@H]1C[N@@H+]([C@@H](C)c2ccccc2Br)CCO1 ZINC001473281985 1061051197 /nfs/dbraw/zinc/05/11/97/1061051197.db2.gz IKYOHGICZKBGHE-QWHCGFSZSA-N 1 2 312.251 4.011 20 0 DIADLO CCC[C@@H]1C[N@H+]([C@@H](C)c2ccccc2Br)CCO1 ZINC001473281985 1061051204 /nfs/dbraw/zinc/05/12/04/1061051204.db2.gz IKYOHGICZKBGHE-QWHCGFSZSA-N 1 2 312.251 4.011 20 0 DIADLO CCC[C@H]1C[N@@H+]([C@@H](C)c2ccccc2Br)CCO1 ZINC001473281986 1061051799 /nfs/dbraw/zinc/05/17/99/1061051799.db2.gz IKYOHGICZKBGHE-STQMWFEESA-N 1 2 312.251 4.011 20 0 DIADLO CCC[C@H]1C[N@H+]([C@@H](C)c2ccccc2Br)CCO1 ZINC001473281986 1061051812 /nfs/dbraw/zinc/05/18/12/1061051812.db2.gz IKYOHGICZKBGHE-STQMWFEESA-N 1 2 312.251 4.011 20 0 DIADLO C[C@H](CNc1[nH+]cccc1CNC(=O)OC(C)(C)C)C(C)(C)C ZINC001462254072 1061058368 /nfs/dbraw/zinc/05/83/68/1061058368.db2.gz QJUBUQPOTOLBKQ-CYBMUJFWSA-N 1 2 321.465 4.200 20 0 DIADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1cc(C(F)(F)F)ccc1Br ZINC001462280037 1061074136 /nfs/dbraw/zinc/07/41/36/1061074136.db2.gz DOMDGDVERYYDRR-DTWKUNHWSA-N 1 2 322.168 4.308 20 0 DIADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cc(C(F)(F)F)ccc1Br ZINC001462280037 1061074144 /nfs/dbraw/zinc/07/41/44/1061074144.db2.gz DOMDGDVERYYDRR-DTWKUNHWSA-N 1 2 322.168 4.308 20 0 DIADLO CO[C@@H]1CCC[C@@H](Nc2ccc(-n3c[nH+]c(C)c3C)cc2)CC1 ZINC001462290182 1061080868 /nfs/dbraw/zinc/08/08/68/1061080868.db2.gz FSPPUBWHOIAXJI-VQIMIIECSA-N 1 2 313.445 4.249 20 0 DIADLO Cc1[nH+]ccn1-c1ccccc1-c1nc2ccc(Cl)cc2[nH]1 ZINC001250836578 1061088594 /nfs/dbraw/zinc/08/85/94/1061088594.db2.gz LBKQNVZGITWFPE-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO C[C@@H]([NH2+]Cc1nncs1)c1ccccc1Oc1ccccc1 ZINC001473341568 1061098847 /nfs/dbraw/zinc/09/88/47/1061098847.db2.gz AUBNSBAFGUMSGC-CYBMUJFWSA-N 1 2 311.410 4.181 20 0 DIADLO Cc1ccc(C[NH+]2CC(CC(F)(F)F)C2)cc1Br ZINC001462323526 1061100834 /nfs/dbraw/zinc/10/08/34/1061100834.db2.gz QCWRZYVPXKIRSR-UHFFFAOYSA-N 1 2 322.168 4.142 20 0 DIADLO CC(C)Cc1ccc(C[NH+]2CC(C)(CC(F)(F)F)C2)cn1 ZINC001462331492 1061108068 /nfs/dbraw/zinc/10/80/68/1061108068.db2.gz IWHWXWJYUHTJIE-UHFFFAOYSA-N 1 2 300.368 4.054 20 0 DIADLO CCOC(=O)[C@H](CC)[NH2+][C@H](C)c1sc2ccccc2c1C ZINC001473359714 1061110988 /nfs/dbraw/zinc/11/09/88/1061110988.db2.gz AZUISGSCQBZNGO-OCCSQVGLSA-N 1 2 305.443 4.202 20 0 DIADLO Fc1cccc(F)c1C[N@H+](C[C@@H]1CCC2(CCCC2)O1)C1CC1 ZINC001473380560 1061121164 /nfs/dbraw/zinc/12/11/64/1061121164.db2.gz KGIMSGNICVHEFN-HNNXBMFYSA-N 1 2 321.411 4.421 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](C[C@@H]1CCC2(CCCC2)O1)C1CC1 ZINC001473380560 1061121174 /nfs/dbraw/zinc/12/11/74/1061121174.db2.gz KGIMSGNICVHEFN-HNNXBMFYSA-N 1 2 321.411 4.421 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(C3CCCCC3)cc2)C[C@H](C)[S@@]1=O ZINC001473383157 1061124151 /nfs/dbraw/zinc/12/41/51/1061124151.db2.gz CPSMWHPMNADVOZ-MFKICJERSA-N 1 2 319.514 4.076 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(C3CCCCC3)cc2)C[C@H](C)[S@@]1=O ZINC001473383157 1061124159 /nfs/dbraw/zinc/12/41/59/1061124159.db2.gz CPSMWHPMNADVOZ-MFKICJERSA-N 1 2 319.514 4.076 20 0 DIADLO CC(C)(C)OC(=O)[C@H]1CCC[N@@H+]1C/C=C\c1ccc(Cl)cc1 ZINC001473383176 1061124185 /nfs/dbraw/zinc/12/41/85/1061124185.db2.gz CVAAHPMSPXHKIN-DQOPKJQZSA-N 1 2 321.848 4.159 20 0 DIADLO CC(C)(C)OC(=O)[C@H]1CCC[N@H+]1C/C=C\c1ccc(Cl)cc1 ZINC001473383176 1061124195 /nfs/dbraw/zinc/12/41/95/1061124195.db2.gz CVAAHPMSPXHKIN-DQOPKJQZSA-N 1 2 321.848 4.159 20 0 DIADLO CC(C)(C)OC(=O)[C@H]1CCC[N@@H+]1C/C=C/c1ccc(Cl)cc1 ZINC001473383178 1061125126 /nfs/dbraw/zinc/12/51/26/1061125126.db2.gz CVAAHPMSPXHKIN-MQDFFIGUSA-N 1 2 321.848 4.159 20 0 DIADLO CC(C)(C)OC(=O)[C@H]1CCC[N@H+]1C/C=C/c1ccc(Cl)cc1 ZINC001473383178 1061125131 /nfs/dbraw/zinc/12/51/31/1061125131.db2.gz CVAAHPMSPXHKIN-MQDFFIGUSA-N 1 2 321.848 4.159 20 0 DIADLO Fc1nccc(Cl)c1C[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC001462354273 1061125832 /nfs/dbraw/zinc/12/58/32/1061125832.db2.gz IFDXJLMQZVCMMS-VIFPVBQESA-N 1 2 310.722 4.039 20 0 DIADLO Fc1nccc(Cl)c1C[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC001462354273 1061125842 /nfs/dbraw/zinc/12/58/42/1061125842.db2.gz IFDXJLMQZVCMMS-VIFPVBQESA-N 1 2 310.722 4.039 20 0 DIADLO CCCCn1c2cc(F)ccc2nc1-c1ccn2cc[nH+]c2c1 ZINC001250927637 1061128798 /nfs/dbraw/zinc/12/87/98/1061128798.db2.gz GCULSYCVGSHMPL-UHFFFAOYSA-N 1 2 308.360 4.290 20 0 DIADLO CC(C)(C)n1c2cc(F)ccc2nc1-c1ccn2cc[nH+]c2c1 ZINC001250927964 1061129130 /nfs/dbraw/zinc/12/91/30/1061129130.db2.gz OOCUXTRQCYSXIL-UHFFFAOYSA-N 1 2 308.360 4.245 20 0 DIADLO CSCCCn1c2ccccc2nc1-c1ccn2cc[nH+]c2c1 ZINC001250927550 1061129361 /nfs/dbraw/zinc/12/93/61/1061129361.db2.gz BIWNSOSKFPRRSY-UHFFFAOYSA-N 1 2 322.437 4.104 20 0 DIADLO CCOc1ccc2nc(-c3ccn4cc[nH+]c4c3)n(C3CC3)c2c1 ZINC001250927786 1061129431 /nfs/dbraw/zinc/12/94/31/1061129431.db2.gz JZYZJKQFEGIUIL-UHFFFAOYSA-N 1 2 318.380 4.085 20 0 DIADLO CCCn1c2cc(OCC)ccc2nc1-c1ccn2cc[nH+]c2c1 ZINC001250927611 1061129701 /nfs/dbraw/zinc/12/97/01/1061129701.db2.gz FIKRFLMCIWVIQF-UHFFFAOYSA-N 1 2 320.396 4.160 20 0 DIADLO CC[C@@]1(C)C[N@@H+]([C@@H](C)c2ccccc2Br)CCO1 ZINC001473389181 1061130784 /nfs/dbraw/zinc/13/07/84/1061130784.db2.gz KLHGGWJDXWFYOK-WFASDCNBSA-N 1 2 312.251 4.011 20 0 DIADLO CC[C@@]1(C)C[N@H+]([C@@H](C)c2ccccc2Br)CCO1 ZINC001473389181 1061130788 /nfs/dbraw/zinc/13/07/88/1061130788.db2.gz KLHGGWJDXWFYOK-WFASDCNBSA-N 1 2 312.251 4.011 20 0 DIADLO Cc1ccc(NC2CCN(c3cccc[nH+]3)CC2)c(Cl)c1C ZINC001462368135 1061131318 /nfs/dbraw/zinc/13/13/18/1061131318.db2.gz GPNFRVKQQLJRMA-UHFFFAOYSA-N 1 2 315.848 4.433 20 0 DIADLO CCn1c2cc(F)ccc2nc1-c1cccc(-n2cc[nH+]c2)c1 ZINC001250940105 1061135772 /nfs/dbraw/zinc/13/57/72/1061135772.db2.gz DVNCELDXIBUFCZ-UHFFFAOYSA-N 1 2 306.344 4.048 20 0 DIADLO FC(F)c1ccc2[nH]c(-c3cccc(-n4cc[nH+]c4)c3)nc2c1 ZINC001250940800 1061139115 /nfs/dbraw/zinc/13/91/15/1061139115.db2.gz YRIZYQWSVHWMJK-UHFFFAOYSA-N 1 2 310.307 4.353 20 0 DIADLO Cn1c2cc(Cl)ccc2nc1-c1cccc(-n2cc[nH+]c2)c1 ZINC001250940752 1061139334 /nfs/dbraw/zinc/13/93/34/1061139334.db2.gz WHQZZIPNNMFYHL-UHFFFAOYSA-N 1 2 308.772 4.079 20 0 DIADLO CC[C@@H]([NH2+][C@H](c1ccc(C(C)(C)C)cc1)C(C)C)C(=O)OC ZINC001473419944 1061149901 /nfs/dbraw/zinc/14/99/01/1061149901.db2.gz WFXOCRSHNJPTJC-SJORKVTESA-N 1 2 305.462 4.222 20 0 DIADLO C[C@@H]1[C@H](C)[S@](=O)CC[N@@H+]1Cc1ccc(C2CCCCC2)cc1 ZINC001473429619 1061154681 /nfs/dbraw/zinc/15/46/81/1061154681.db2.gz XTVOGGBOWNWLQK-ZMPRRUGASA-N 1 2 319.514 4.076 20 0 DIADLO C[C@@H]1[C@H](C)[S@](=O)CC[N@H+]1Cc1ccc(C2CCCCC2)cc1 ZINC001473429619 1061154689 /nfs/dbraw/zinc/15/46/89/1061154689.db2.gz XTVOGGBOWNWLQK-ZMPRRUGASA-N 1 2 319.514 4.076 20 0 DIADLO COc1cc(C)c(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c(C)c1 ZINC001250975157 1061155134 /nfs/dbraw/zinc/15/51/34/1061155134.db2.gz VBWMIXPAPUYWGR-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO CC1=C(Br)C[N@H+](Cc2cccc(OC(C)C)c2)CC1 ZINC001473427578 1061155877 /nfs/dbraw/zinc/15/58/77/1061155877.db2.gz CVGTWCNQAGDRSV-UHFFFAOYSA-N 1 2 324.262 4.348 20 0 DIADLO CC1=C(Br)C[N@@H+](Cc2cccc(OC(C)C)c2)CC1 ZINC001473427578 1061155888 /nfs/dbraw/zinc/15/58/88/1061155888.db2.gz CVGTWCNQAGDRSV-UHFFFAOYSA-N 1 2 324.262 4.348 20 0 DIADLO CC[C@@H]1Cc2c(Br)cccc2C[N@@H+]1C/C=C\Cl ZINC001473427346 1061156218 /nfs/dbraw/zinc/15/62/18/1061156218.db2.gz YFRPYIHSMJFWCE-DJFZKKHWSA-N 1 2 314.654 4.338 20 0 DIADLO CC[C@@H]1Cc2c(Br)cccc2C[N@H+]1C/C=C\Cl ZINC001473427346 1061156224 /nfs/dbraw/zinc/15/62/24/1061156224.db2.gz YFRPYIHSMJFWCE-DJFZKKHWSA-N 1 2 314.654 4.338 20 0 DIADLO Fc1cc2nc(-c3ccc4[nH+]ccn4c3)[nH]c2cc1C(F)(F)F ZINC001250978729 1061157549 /nfs/dbraw/zinc/15/75/49/1061157549.db2.gz QWIDKZLTNMHDQS-UHFFFAOYSA-N 1 2 320.249 4.036 20 0 DIADLO Cc1ccc2c(c1)nc(-c1ccc3[nH+]ccn3c1)n2CC1CC1 ZINC001250979054 1061158311 /nfs/dbraw/zinc/15/83/11/1061158311.db2.gz RNSMZIPIXOMYOB-UHFFFAOYSA-N 1 2 302.381 4.069 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCC[C@@H]1c1ccccc1)C(=O)OC(C)(C)C ZINC001462427320 1061166156 /nfs/dbraw/zinc/16/61/56/1061166156.db2.gz OVKGTKKRRBAHOC-DJIMGWMZSA-N 1 2 303.446 4.033 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCC[C@H]1c1ccccc1)C(=O)OC(C)(C)C ZINC001462427323 1061166429 /nfs/dbraw/zinc/16/64/29/1061166429.db2.gz OVKGTKKRRBAHOC-HYVNUMGLSA-N 1 2 303.446 4.033 20 0 DIADLO C[N@H+](C/C=C\Cl)Cc1ccc(Br)cc1Cl ZINC001473450595 1061166899 /nfs/dbraw/zinc/16/68/99/1061166899.db2.gz ZTRUDDWTEPNRLM-DJWKRKHSSA-N 1 2 309.034 4.287 20 0 DIADLO C[N@@H+](C/C=C\Cl)Cc1ccc(Br)cc1Cl ZINC001473450595 1061166902 /nfs/dbraw/zinc/16/69/02/1061166902.db2.gz ZTRUDDWTEPNRLM-DJWKRKHSSA-N 1 2 309.034 4.287 20 0 DIADLO C[C@@H]1CO[C@@H](C(F)(F)F)C[N@@H+]1CCc1ccc2ccccc2c1 ZINC001473460960 1061171826 /nfs/dbraw/zinc/17/18/26/1061171826.db2.gz JKRFWECWLYDBBZ-CXAGYDPISA-N 1 2 323.358 4.034 20 0 DIADLO C[C@@H]1CO[C@@H](C(F)(F)F)C[N@H+]1CCc1ccc2ccccc2c1 ZINC001473460960 1061171833 /nfs/dbraw/zinc/17/18/33/1061171833.db2.gz JKRFWECWLYDBBZ-CXAGYDPISA-N 1 2 323.358 4.034 20 0 DIADLO CCC(C)(C)OC1C[NH+](Cc2cc3nc(Cl)ccc3s2)C1 ZINC001462437201 1061171968 /nfs/dbraw/zinc/17/19/68/1061171968.db2.gz FCYBXECSIOQHER-UHFFFAOYSA-N 1 2 324.877 4.339 20 0 DIADLO CC(C)(C)CNC(=O)C[N@@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001473473653 1061179598 /nfs/dbraw/zinc/17/95/98/1061179598.db2.gz OGDMYFYLEIITGT-INIZCTEOSA-N 1 2 322.880 4.029 20 0 DIADLO CC(C)(C)CNC(=O)C[N@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001473473653 1061179606 /nfs/dbraw/zinc/17/96/06/1061179606.db2.gz OGDMYFYLEIITGT-INIZCTEOSA-N 1 2 322.880 4.029 20 0 DIADLO CC1(c2ccccc2)C[NH+](Cc2cscc2Br)C1 ZINC001462454717 1061183750 /nfs/dbraw/zinc/18/37/50/1061183750.db2.gz IDOHMOCAOGUXJD-UHFFFAOYSA-N 1 2 322.271 4.284 20 0 DIADLO CC1(c2ccccc2)C[NH+](Cc2cccc(F)c2OC(F)F)C1 ZINC001462459383 1061186811 /nfs/dbraw/zinc/18/68/11/1061186811.db2.gz XWPJDRYUOGQQIX-UHFFFAOYSA-N 1 2 321.342 4.201 20 0 DIADLO COc1nc(C)cc(C)c1C[N@H+](C)Cc1cc2ccc(C)cc2[nH]1 ZINC001462461048 1061188827 /nfs/dbraw/zinc/18/88/27/1061188827.db2.gz MTDSXBUDXDXBEW-UHFFFAOYSA-N 1 2 323.440 4.129 20 0 DIADLO COc1nc(C)cc(C)c1C[N@@H+](C)Cc1cc2ccc(C)cc2[nH]1 ZINC001462461048 1061188856 /nfs/dbraw/zinc/18/88/56/1061188856.db2.gz MTDSXBUDXDXBEW-UHFFFAOYSA-N 1 2 323.440 4.129 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001473514460 1061209704 /nfs/dbraw/zinc/20/97/04/1061209704.db2.gz PKODNHMMKDJIQO-CYBMUJFWSA-N 1 2 317.816 4.132 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001473514460 1061209720 /nfs/dbraw/zinc/20/97/20/1061209720.db2.gz PKODNHMMKDJIQO-CYBMUJFWSA-N 1 2 317.816 4.132 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(Cl)ccc2Cl)[C@H]1[C@@H]1CCCO1 ZINC001473523365 1061220511 /nfs/dbraw/zinc/22/05/11/1061220511.db2.gz QIRJMCRTNUVMHJ-GJZGRUSLSA-N 1 2 314.256 4.383 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(Cl)ccc2Cl)[C@H]1[C@@H]1CCCO1 ZINC001473523365 1061220535 /nfs/dbraw/zinc/22/05/35/1061220535.db2.gz QIRJMCRTNUVMHJ-GJZGRUSLSA-N 1 2 314.256 4.383 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC001473530089 1061226659 /nfs/dbraw/zinc/22/66/59/1061226659.db2.gz CJJDEMQCMDHZFK-SJLPKXTDSA-N 1 2 315.457 4.336 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC001473530089 1061226680 /nfs/dbraw/zinc/22/66/80/1061226680.db2.gz CJJDEMQCMDHZFK-SJLPKXTDSA-N 1 2 315.457 4.336 20 0 DIADLO CCCCC[C@@H](C)CC(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001455770326 1061234415 /nfs/dbraw/zinc/23/44/15/1061234415.db2.gz MBSXGQGOGWHLKO-CJNGLKHVSA-N 1 2 305.466 4.297 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1nc2ccc(F)c(F)c2n1C(C)(C)C ZINC001251092116 1061235112 /nfs/dbraw/zinc/23/51/12/1061235112.db2.gz QGQIEVYNYSZBFN-UHFFFAOYSA-N 1 2 316.355 4.022 20 0 DIADLO Clc1cc(C[N@H+]2CCSC[C@@H]2C2CCC2)cc(Cl)n1 ZINC001473567964 1061258934 /nfs/dbraw/zinc/25/89/34/1061258934.db2.gz BSLOQMIOCSNQOQ-GFCCVEGCSA-N 1 2 317.285 4.106 20 0 DIADLO Clc1cc(C[N@@H+]2CCSC[C@@H]2C2CCC2)cc(Cl)n1 ZINC001473567964 1061258914 /nfs/dbraw/zinc/25/89/14/1061258914.db2.gz BSLOQMIOCSNQOQ-GFCCVEGCSA-N 1 2 317.285 4.106 20 0 DIADLO Cc1cc(C)c2cc(NCc3c(F)ccc(O)c3F)ccc2[nH+]1 ZINC001462575357 1061270924 /nfs/dbraw/zinc/27/09/24/1061270924.db2.gz AIMVGBSACGOUKK-UHFFFAOYSA-N 1 2 314.335 4.448 20 0 DIADLO CCOC(=O)[C@@H](CCCC(C)C)[NH2+]C[C@@H](C)c1ccccc1 ZINC001462573006 1061271424 /nfs/dbraw/zinc/27/14/24/1061271424.db2.gz MDROCZXWOQJJFT-SJLPKXTDSA-N 1 2 305.462 4.138 20 0 DIADLO COC(=O)[C@@H]([NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1)c1cccc2ccccc21 ZINC001462590675 1061282263 /nfs/dbraw/zinc/28/22/63/1061282263.db2.gz XIMZJDYJXBPYEL-VZHLBOQGSA-N 1 2 323.436 4.222 20 0 DIADLO CCCCCC[N@@H+](Cc1ccn(CC)n1)Cc1ccc(C)o1 ZINC001462600774 1061287648 /nfs/dbraw/zinc/28/76/48/1061287648.db2.gz BGMJUIUUXXGNKV-UHFFFAOYSA-N 1 2 303.450 4.387 20 0 DIADLO CCCCCC[N@H+](Cc1ccn(CC)n1)Cc1ccc(C)o1 ZINC001462600774 1061287669 /nfs/dbraw/zinc/28/76/69/1061287669.db2.gz BGMJUIUUXXGNKV-UHFFFAOYSA-N 1 2 303.450 4.387 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001456342318 1061300536 /nfs/dbraw/zinc/30/05/36/1061300536.db2.gz GBTAUXUFINUEOU-OAHLLOKOSA-N 1 2 305.466 4.146 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001456342318 1061300552 /nfs/dbraw/zinc/30/05/52/1061300552.db2.gz GBTAUXUFINUEOU-OAHLLOKOSA-N 1 2 305.466 4.146 20 0 DIADLO Cc1ccc2c(c1)nc(-c1cccc3[nH+]ccn31)n2CC1CC1 ZINC001251326730 1061315872 /nfs/dbraw/zinc/31/58/72/1061315872.db2.gz UNAJGLLUZABNGV-UHFFFAOYSA-N 1 2 302.381 4.069 20 0 DIADLO Cn1ccc(C[N@H+](C)Cc2ccc(Sc3ccccc3)cc2)n1 ZINC001462656080 1061322950 /nfs/dbraw/zinc/32/29/50/1061322950.db2.gz SPXDONAWMZMESE-UHFFFAOYSA-N 1 2 323.465 4.203 20 0 DIADLO Cn1ccc(C[N@@H+](C)Cc2ccc(Sc3ccccc3)cc2)n1 ZINC001462656080 1061322972 /nfs/dbraw/zinc/32/29/72/1061322972.db2.gz SPXDONAWMZMESE-UHFFFAOYSA-N 1 2 323.465 4.203 20 0 DIADLO FC(F)[C@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1ccccc1 ZINC001462680268 1061334203 /nfs/dbraw/zinc/33/42/03/1061334203.db2.gz DWJZHNINRRWCEO-HZPDHXFCSA-N 1 2 309.400 4.464 20 0 DIADLO CO[C@H](CNc1[nH+]c2ccccc2n1CC1CC1)C1CCCC1 ZINC001462680286 1061335128 /nfs/dbraw/zinc/33/51/28/1061335128.db2.gz FFDPMTUXQPEOEV-GOSISDBHSA-N 1 2 313.445 4.063 20 0 DIADLO CCc1cccc(Cl)c1C[NH+]1CC(Oc2ccccc2)C1 ZINC001462688873 1061340054 /nfs/dbraw/zinc/34/00/54/1061340054.db2.gz WXFGYHNMVOIGQG-UHFFFAOYSA-N 1 2 301.817 4.166 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+]2CCOc3cc(F)ccc3C2)c1 ZINC001473687727 1061345444 /nfs/dbraw/zinc/34/54/44/1061345444.db2.gz JQPDWXRPPAMGBN-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO CC(C)Oc1cccc(C[N@H+]2CCOc3cc(F)ccc3C2)c1 ZINC001473687727 1061345458 /nfs/dbraw/zinc/34/54/58/1061345458.db2.gz JQPDWXRPPAMGBN-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCOc2cc(F)ccc2C1 ZINC001473688420 1061346407 /nfs/dbraw/zinc/34/64/07/1061346407.db2.gz YNKJWQJEWLGBBF-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCOc2cc(F)ccc2C1 ZINC001473688420 1061346422 /nfs/dbraw/zinc/34/64/22/1061346422.db2.gz YNKJWQJEWLGBBF-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO COC[C@H](C)[N@H+](C/C(Cl)=C/Cl)[C@@H]1CCc2ccccc21 ZINC001473691192 1061350787 /nfs/dbraw/zinc/35/07/87/1061350787.db2.gz DVWADQZOECBQGI-WXHNGTRTSA-N 1 2 314.256 4.330 20 0 DIADLO COC[C@H](C)[N@@H+](C/C(Cl)=C/Cl)[C@@H]1CCc2ccccc21 ZINC001473691192 1061350807 /nfs/dbraw/zinc/35/08/07/1061350807.db2.gz DVWADQZOECBQGI-WXHNGTRTSA-N 1 2 314.256 4.330 20 0 DIADLO Fc1ccc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3Cl)nc2c1 ZINC001251507522 1061385160 /nfs/dbraw/zinc/38/51/60/1061385160.db2.gz KTVGFEROCVDBGB-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO Cl/C=C(/Cl)C[N@@H+]1CCC[C@@H](c2nc3c(s2)CCC3)C1 ZINC001473805352 1061413081 /nfs/dbraw/zinc/41/30/81/1061413081.db2.gz CUOAABWONJPWCJ-UEUZTHOGSA-N 1 2 317.285 4.130 20 0 DIADLO Cl/C=C(/Cl)C[N@H+]1CCC[C@@H](c2nc3c(s2)CCC3)C1 ZINC001473805352 1061413091 /nfs/dbraw/zinc/41/30/91/1061413091.db2.gz CUOAABWONJPWCJ-UEUZTHOGSA-N 1 2 317.285 4.130 20 0 DIADLO Cc1cccnc1[C@@H](C)[NH2+][C@@H](C)c1ncc(-c2ccccc2)o1 ZINC001473878788 1061448527 /nfs/dbraw/zinc/44/85/27/1061448527.db2.gz ABJYPTCBIKXYRD-CABCVRRESA-N 1 2 307.397 4.457 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+]1C[C@@]23C[NH+](C)C[C@]2(C1)CCCC3 ZINC001473900856 1061452524 /nfs/dbraw/zinc/45/25/24/1061452524.db2.gz HAOHKHHXCUPCDK-LZQZEXGQSA-N 1 2 318.892 4.209 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[NH+]1C[C@@]23C[N@H+](C)C[C@]2(C1)CCCC3 ZINC001473900856 1061452526 /nfs/dbraw/zinc/45/25/26/1061452526.db2.gz HAOHKHHXCUPCDK-LZQZEXGQSA-N 1 2 318.892 4.209 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@H](Cc3ccccc3)[C@H]2C)c(C)[nH+]1 ZINC001457434506 1061457300 /nfs/dbraw/zinc/45/73/00/1061457300.db2.gz JTMBWUCUIXXLJJ-IEBWSBKVSA-N 1 2 322.452 4.100 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[NH2+]Cc1ccco1 ZINC001473911938 1061458593 /nfs/dbraw/zinc/45/85/93/1061458593.db2.gz VKZDAXGPPVDSSM-UHFFFAOYSA-N 1 2 318.573 4.124 20 0 DIADLO CCCn1cc(C[NH2+][C@H](c2ccco2)c2ccccc2)c(C)n1 ZINC001473919742 1061467815 /nfs/dbraw/zinc/46/78/15/1061467815.db2.gz ZEYAIHRZKBVGTB-IBGZPJMESA-N 1 2 309.413 4.074 20 0 DIADLO Cc1[nH]c(CNc2cccc(COc3ccccc3)c2)[nH+]c1C ZINC001473951303 1061493886 /nfs/dbraw/zinc/49/38/86/1061493886.db2.gz YSJSFLZYCPZBDU-UHFFFAOYSA-N 1 2 307.397 4.218 20 0 DIADLO CCn1cnc(Cl)c1C[NH2+]Cc1c(Cl)cccc1Cl ZINC001473963745 1061503539 /nfs/dbraw/zinc/50/35/39/1061503539.db2.gz OPPOHEZCTOBEJJ-UHFFFAOYSA-N 1 2 318.635 4.153 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1nccc2c1CCCC2 ZINC001473964535 1061508606 /nfs/dbraw/zinc/50/86/06/1061508606.db2.gz BXPMZWSATSMNCL-UHFFFAOYSA-N 1 2 304.796 4.043 20 0 DIADLO Cc1cc(CNC(=O)N2CC[C@H](C(C)(C)C)C[C@H]2C)cc(C)[nH+]1 ZINC001252029595 1061558364 /nfs/dbraw/zinc/55/83/64/1061558364.db2.gz ZPFFWXITHJIMID-WBVHZDCISA-N 1 2 317.477 4.055 20 0 DIADLO CCc1ccc(CNc2nc3ccccc3n3c[nH+]cc23)s1 ZINC001458098828 1061571890 /nfs/dbraw/zinc/57/18/90/1061571890.db2.gz KCXMJAZAKYCAPP-UHFFFAOYSA-N 1 2 308.410 4.119 20 0 DIADLO CCc1cc(NC[C@H](CC)Oc2cccc(C)c2)nc(CC)[nH+]1 ZINC001458106744 1061572581 /nfs/dbraw/zinc/57/25/81/1061572581.db2.gz SUUPJONWBMLLGV-INIZCTEOSA-N 1 2 313.445 4.179 20 0 DIADLO CCc1cc(N2CCC[C@H]2CCc2ccccc2)nc(CC)[nH+]1 ZINC001458115877 1061578121 /nfs/dbraw/zinc/57/81/21/1061578121.db2.gz OEIWBTKABMZWGP-SFHVURJKSA-N 1 2 309.457 4.203 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@@H]3CC=CCC3)c2)[nH+]c1C ZINC001464456592 1061596647 /nfs/dbraw/zinc/59/66/47/1061596647.db2.gz DVNIFCPZBRELEM-OAHLLOKOSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@H]3CC=CCC3)c2)[nH+]c1C ZINC001464456588 1061598286 /nfs/dbraw/zinc/59/82/86/1061598286.db2.gz DVNIFCPZBRELEM-HNNXBMFYSA-N 1 2 309.413 4.378 20 0 DIADLO CN(C)c1ccc(NCc2cc(-c3ccccc3)cs2)[nH+]c1 ZINC001474053169 1061600793 /nfs/dbraw/zinc/60/07/93/1061600793.db2.gz LINSOTOCRRHPRM-UHFFFAOYSA-N 1 2 309.438 4.488 20 0 DIADLO CC1(C)CCC[C@@H](CNc2ccccc2C[NH+]2CCOCC2)C1 ZINC001474057125 1061602536 /nfs/dbraw/zinc/60/25/36/1061602536.db2.gz SCVIPFPNEPASJG-QGZVFWFLSA-N 1 2 316.489 4.147 20 0 DIADLO CCCOc1cc(C)ccc1NCc1c[nH+]c2ccc(C)cn12 ZINC001474063050 1061610733 /nfs/dbraw/zinc/61/07/33/1061610733.db2.gz NLNHJFNGTZAUOM-UHFFFAOYSA-N 1 2 309.413 4.352 20 0 DIADLO CC(C)[C@@H]1CC[C@@H](C)C[C@H]1CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001464603613 1061611996 /nfs/dbraw/zinc/61/19/96/1061611996.db2.gz HCEKHSPVBDZCTL-YCPHGPKFSA-N 1 2 313.445 4.001 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)c(F)c1F)c1cccc(F)c1F ZINC001474077120 1061624482 /nfs/dbraw/zinc/62/44/82/1061624482.db2.gz QELSNVZLVBXTAZ-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO CCC[C@@H]1[C@H](C)CCCN1c1nc2ccccc2n2c[nH+]cc12 ZINC001458210042 1061632479 /nfs/dbraw/zinc/63/24/79/1061632479.db2.gz CUIMATXITPYEIF-GDBMZVCRSA-N 1 2 308.429 4.288 20 0 DIADLO Cc1cc(CNc2cnn(CC(C)C)c2C(C)C)cc(C)[nH+]1 ZINC001474090021 1061637172 /nfs/dbraw/zinc/63/71/72/1061637172.db2.gz VMGXBSIGPZCTMC-UHFFFAOYSA-N 1 2 300.450 4.286 20 0 DIADLO Cc1cc(NCc2ccccc2OCC(F)F)ccc1[NH+](C)C ZINC001474094237 1061640039 /nfs/dbraw/zinc/64/00/39/1061640039.db2.gz WDQNITCMCAKFBH-UHFFFAOYSA-N 1 2 320.383 4.317 20 0 DIADLO CCCOc1cc(C)ccc1CNc1cc(C)[nH+]c(C2CC2)n1 ZINC001458238479 1061652771 /nfs/dbraw/zinc/65/27/71/1061652771.db2.gz ISZUOIXIOGFUQF-UHFFFAOYSA-N 1 2 311.429 4.372 20 0 DIADLO CCCCO[C@H]1C[C@@H](Nc2cc(C)[nH+]c(C3CC3)n2)C1(C)C ZINC001458235856 1061652796 /nfs/dbraw/zinc/65/27/96/1061652796.db2.gz ZPPDDJWYUFLBKC-CABCVRRESA-N 1 2 303.450 4.058 20 0 DIADLO CCCCO[C@@H]1C[C@@H](Nc2cc(C)[nH+]c(C3CC3)n2)C1(C)C ZINC001458235859 1061653956 /nfs/dbraw/zinc/65/39/56/1061653956.db2.gz ZPPDDJWYUFLBKC-HUUCEWRRSA-N 1 2 303.450 4.058 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc3[nH]c(=O)[nH]c3c2)[nH+]c2ccccc12 ZINC001252589244 1061670833 /nfs/dbraw/zinc/67/08/33/1061670833.db2.gz LRJZQJIBIQXYDJ-GFCCVEGCSA-N 1 2 318.380 4.298 20 0 DIADLO Cc1cc(N(C)Cc2cc(F)c(F)c(F)c2)nc(C2CCC2)[nH+]1 ZINC001458277361 1061672508 /nfs/dbraw/zinc/67/25/08/1061672508.db2.gz MSTNKHWZPGYCFR-UHFFFAOYSA-N 1 2 321.346 4.106 20 0 DIADLO CCC1(CC)[C@H](Nc2cc(C)[nH+]c(C3CCC3)n2)[C@H](C)[C@H]1OC ZINC001458294146 1061681357 /nfs/dbraw/zinc/68/13/57/1061681357.db2.gz BSAJMVQNEZJLRE-IAOVAPTHSA-N 1 2 317.477 4.304 20 0 DIADLO CCc1cc(NC(C)(C)Cc2ccc(OC)cc2)nc(CC)[nH+]1 ZINC001458325211 1061697643 /nfs/dbraw/zinc/69/76/43/1061697643.db2.gz JACBNNQZLUCSRM-UHFFFAOYSA-N 1 2 313.445 4.043 20 0 DIADLO C[C@H](C(=O)Nc1ccc(Cl)cc1)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000542133697 1061698174 /nfs/dbraw/zinc/69/81/74/1061698174.db2.gz ZFUPEGWBVGDPCJ-QWHCGFSZSA-N 1 2 314.816 4.244 20 0 DIADLO C[C@H](C(=O)Nc1ccc(Cl)cc1)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000542133697 1061698184 /nfs/dbraw/zinc/69/81/84/1061698184.db2.gz ZFUPEGWBVGDPCJ-QWHCGFSZSA-N 1 2 314.816 4.244 20 0 DIADLO CCc1cc(NCc2cc(F)c(Cl)cc2F)nc(CC)[nH+]1 ZINC001458351593 1061715343 /nfs/dbraw/zinc/71/53/43/1061715343.db2.gz ALMGWUISSVBLCP-UHFFFAOYSA-N 1 2 311.763 4.145 20 0 DIADLO Cc1nc(NCc2cc(F)c(Cl)cc2F)c2c([nH+]1)CCCC2 ZINC001458354526 1061715624 /nfs/dbraw/zinc/71/56/24/1061715624.db2.gz KJZAKRYBQPXBGZ-UHFFFAOYSA-N 1 2 323.774 4.208 20 0 DIADLO Cc1cc(NC[C@H]2CSc3ccccc32)nc(C2CCC2)[nH+]1 ZINC001458400345 1061740528 /nfs/dbraw/zinc/74/05/28/1061740528.db2.gz PMNZXYNJYYAQIE-AWEZNQCLSA-N 1 2 311.454 4.354 20 0 DIADLO Cc1cc(N2CCc3c(Cl)cc(F)cc3C2)nc(C2CC2)[nH+]1 ZINC001458405162 1061746786 /nfs/dbraw/zinc/74/67/86/1061746786.db2.gz IQMOZFRLANXROM-UHFFFAOYSA-N 1 2 317.795 4.018 20 0 DIADLO Cc1cc(N(C)[C@@H](C)Cc2cccc(F)c2)nc(C2CCC2)[nH+]1 ZINC001458427105 1061755006 /nfs/dbraw/zinc/75/50/06/1061755006.db2.gz GNOSFYFXFQNZGE-AWEZNQCLSA-N 1 2 313.420 4.259 20 0 DIADLO CC[C@@H](CNc1cc(C)[nH+]c(C2CCC2)n1)CC(F)(F)F ZINC001458435016 1061761162 /nfs/dbraw/zinc/76/11/62/1061761162.db2.gz ZJHDSGKFLTXEIA-LLVKDONJSA-N 1 2 301.356 4.443 20 0 DIADLO CC(C)c1cc(N[C@@H](CO)CC2CCCCC2)nc(C(C)C)[nH+]1 ZINC001458442721 1061767344 /nfs/dbraw/zinc/76/73/44/1061767344.db2.gz FFZQDINEJVPLFT-MRXNPFEDSA-N 1 2 319.493 4.467 20 0 DIADLO Cc1ccc2sc(NCCc3cn4c(cccc4C)[nH+]3)nc2c1 ZINC001458469011 1061782027 /nfs/dbraw/zinc/78/20/27/1061782027.db2.gz KVRRFVBDEHAXES-UHFFFAOYSA-N 1 2 322.437 4.215 20 0 DIADLO Cc1cc(NC(=O)c2ccc(OCC3CCCCC3)cc2)cc[nH+]1 ZINC001458480553 1061789762 /nfs/dbraw/zinc/78/97/62/1061789762.db2.gz RNAMOBVUFVZCNL-UHFFFAOYSA-N 1 2 324.424 4.023 20 0 DIADLO CCc1cc(NC2CCC(OC(C)(C)C)CC2)nc(CC)[nH+]1 ZINC001458525717 1061821606 /nfs/dbraw/zinc/82/16/06/1061821606.db2.gz GTLJPGIXLYVWRX-UHFFFAOYSA-N 1 2 305.466 4.140 20 0 DIADLO COc1ccccc1/C=C\CNc1[nH]c2ccc(Cl)cc2[nH+]1 ZINC001474255893 1061824179 /nfs/dbraw/zinc/82/41/79/1061824179.db2.gz BLVUTDQRVMVPCQ-XQRVVYSFSA-N 1 2 313.788 4.350 20 0 DIADLO Cc1cc(C)c2cc(NCc3n[nH]c4ccccc34)ccc2[nH+]1 ZINC001474268100 1061836267 /nfs/dbraw/zinc/83/62/67/1061836267.db2.gz STVRNJWHXAJZQL-UHFFFAOYSA-N 1 2 302.381 4.340 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1ccccc1Cl ZINC001474301118 1061869463 /nfs/dbraw/zinc/86/94/63/1061869463.db2.gz FHHYZRFPYBAPHA-UHFFFAOYSA-N 1 2 303.768 4.461 20 0 DIADLO CCOc1cccc(CNc2[nH+]c3cc(F)ccc3n2CC)c1 ZINC001474302494 1061873896 /nfs/dbraw/zinc/87/38/96/1061873896.db2.gz YILKMTPLBABNFC-UHFFFAOYSA-N 1 2 313.376 4.206 20 0 DIADLO CC(C)c1cc(N[C@@H]2CCOCC23CCCC3)nc(C(C)C)[nH+]1 ZINC001458712440 1061880599 /nfs/dbraw/zinc/88/05/99/1061880599.db2.gz VFBNCRNBFWCMDG-MRXNPFEDSA-N 1 2 317.477 4.485 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccc(O)c(F)c2F)C2CC2)cc1C ZINC001474317741 1061892665 /nfs/dbraw/zinc/89/26/65/1061892665.db2.gz OEILPKPPMSPHFU-UHFFFAOYSA-N 1 2 317.379 4.452 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2cnn(C)c2Cl)o1 ZINC001474326439 1061911689 /nfs/dbraw/zinc/91/16/89/1061911689.db2.gz DQQOPWXIVFBRLC-WFASDCNBSA-N 1 2 321.852 4.202 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2cnn(C)c2Cl)o1 ZINC001474326439 1061911717 /nfs/dbraw/zinc/91/17/17/1061911717.db2.gz DQQOPWXIVFBRLC-WFASDCNBSA-N 1 2 321.852 4.202 20 0 DIADLO CCc1ccc2ccccc2c1CSc1nc(N)cc(C)[nH+]1 ZINC001458860340 1061924411 /nfs/dbraw/zinc/92/44/11/1061924411.db2.gz OFFDFUGRBBFLMG-UHFFFAOYSA-N 1 2 309.438 4.375 20 0 DIADLO CC(C)c1ccc2occ(C(=O)Nc3cc(N(C)C)cc[nH+]3)c2c1 ZINC001466377936 1061929782 /nfs/dbraw/zinc/92/97/82/1061929782.db2.gz FVGLNDNXQUIDPC-UHFFFAOYSA-N 1 2 323.396 4.270 20 0 DIADLO C[C@@H]1C[C@H]1C[N@@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001474343766 1061945930 /nfs/dbraw/zinc/94/59/30/1061945930.db2.gz UKVLYZNDZIOTLC-GMXABZIVSA-N 1 2 300.229 4.023 20 0 DIADLO C[C@@H]1C[C@H]1C[N@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001474343766 1061945955 /nfs/dbraw/zinc/94/59/55/1061945955.db2.gz UKVLYZNDZIOTLC-GMXABZIVSA-N 1 2 300.229 4.023 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1cnn(CC2CCC2)c1 ZINC001474364998 1061999503 /nfs/dbraw/zinc/99/95/03/1061999503.db2.gz SEIIQFONDBZEJY-CYBMUJFWSA-N 1 2 319.399 4.154 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cnn(CC2CCC2)c1 ZINC001474364998 1061999519 /nfs/dbraw/zinc/99/95/19/1061999519.db2.gz SEIIQFONDBZEJY-CYBMUJFWSA-N 1 2 319.399 4.154 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3cccc(F)c3[C@@H]2C)c(F)c1 ZINC001474377217 1062021702 /nfs/dbraw/zinc/02/17/02/1062021702.db2.gz YOIMKGVHPVGLOX-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(C[N@H+]2CCc3cccc(F)c3[C@@H]2C)c(F)c1 ZINC001474377217 1062021725 /nfs/dbraw/zinc/02/17/25/1062021725.db2.gz YOIMKGVHPVGLOX-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CC[C@H](Cc3ccccc3)C2)c(C)[nH+]1 ZINC001459169057 1062032612 /nfs/dbraw/zinc/03/26/12/1062032612.db2.gz ZBLRYDZWXLTGKJ-RTBURBONSA-N 1 2 322.452 4.148 20 0 DIADLO CC(C)(C)c1cn(CCOc2ccc(C(F)(F)F)cc2)c[nH+]1 ZINC001459210032 1062042460 /nfs/dbraw/zinc/04/24/60/1062042460.db2.gz LGALYEMWSKXJIG-UHFFFAOYSA-N 1 2 312.335 4.278 20 0 DIADLO CC(C)(C)OC(=O)c1cccc(Cn2c[nH+]c(C(C)(C)C)c2)c1 ZINC001459211777 1062045122 /nfs/dbraw/zinc/04/51/22/1062045122.db2.gz WWYZHJCAGUGKBL-UHFFFAOYSA-N 1 2 314.429 4.184 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@@H](C)[C@H](F)C2)c(C)c1Br ZINC001474393429 1062048329 /nfs/dbraw/zinc/04/83/29/1062048329.db2.gz QIZFEZBKWAKAMR-QMTHXVAHSA-N 1 2 314.242 4.246 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)c(C)c1Br ZINC001474393429 1062048351 /nfs/dbraw/zinc/04/83/51/1062048351.db2.gz QIZFEZBKWAKAMR-QMTHXVAHSA-N 1 2 314.242 4.246 20 0 DIADLO C[N@H+](Cc1ccco1)Cc1cnc(-c2c(F)cccc2F)s1 ZINC001474398716 1062053469 /nfs/dbraw/zinc/05/34/69/1062053469.db2.gz ZESMSOFTMOWJPW-UHFFFAOYSA-N 1 2 320.364 4.313 20 0 DIADLO C[N@@H+](Cc1ccco1)Cc1cnc(-c2c(F)cccc2F)s1 ZINC001474398716 1062053488 /nfs/dbraw/zinc/05/34/88/1062053488.db2.gz ZESMSOFTMOWJPW-UHFFFAOYSA-N 1 2 320.364 4.313 20 0 DIADLO CC(C)Cn1nccc1C[N@H+](C)[C@H](C)c1ccccc1Cl ZINC001474401402 1062057000 /nfs/dbraw/zinc/05/70/00/1062057000.db2.gz MQGNPBWAYHHEMN-CQSZACIVSA-N 1 2 305.853 4.386 20 0 DIADLO CC(C)Cn1nccc1C[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC001474401402 1062057022 /nfs/dbraw/zinc/05/70/22/1062057022.db2.gz MQGNPBWAYHHEMN-CQSZACIVSA-N 1 2 305.853 4.386 20 0 DIADLO FC1(F)CCC([N@@H+]2CCOC[C@H]2c2ccccc2Cl)CC1 ZINC001254225610 1062058399 /nfs/dbraw/zinc/05/83/99/1062058399.db2.gz AAZXRIKTKYZKFI-HNNXBMFYSA-N 1 2 315.791 4.291 20 0 DIADLO FC1(F)CCC([N@H+]2CCOC[C@H]2c2ccccc2Cl)CC1 ZINC001254225610 1062058419 /nfs/dbraw/zinc/05/84/19/1062058419.db2.gz AAZXRIKTKYZKFI-HNNXBMFYSA-N 1 2 315.791 4.291 20 0 DIADLO Cc1cccc([C@H](NC(=O)Nc2ccc3[nH+]ccn3c2)C(C)C)c1 ZINC001467067401 1062059776 /nfs/dbraw/zinc/05/97/76/1062059776.db2.gz RJTWNGAXWLNWAM-GOSISDBHSA-N 1 2 322.412 4.162 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@H+](C)Cc1csc2ccccc12 ZINC001459308096 1062077206 /nfs/dbraw/zinc/07/72/06/1062077206.db2.gz IJMMSDBJAKPDQI-CYBMUJFWSA-N 1 2 305.443 4.065 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@@H+](C)Cc1csc2ccccc12 ZINC001459308096 1062077228 /nfs/dbraw/zinc/07/72/28/1062077228.db2.gz IJMMSDBJAKPDQI-CYBMUJFWSA-N 1 2 305.443 4.065 20 0 DIADLO Clc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc2n(n1)CCCC2 ZINC001459317076 1062083421 /nfs/dbraw/zinc/08/34/21/1062083421.db2.gz FWKTWMWKCRKQDF-GOSISDBHSA-N 1 2 315.848 4.210 20 0 DIADLO Clc1ccccc1[C@H]1CCC[N@H+]1Cc1cc2n(n1)CCCC2 ZINC001459317076 1062083441 /nfs/dbraw/zinc/08/34/41/1062083441.db2.gz FWKTWMWKCRKQDF-GOSISDBHSA-N 1 2 315.848 4.210 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](Cc1cccnc1N)C1CC1 ZINC001474415282 1062085266 /nfs/dbraw/zinc/08/52/66/1062085266.db2.gz WDTBRQQHGWLQDP-GFCCVEGCSA-N 1 2 301.821 4.043 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](Cc1cccnc1N)C1CC1 ZINC001474415282 1062085289 /nfs/dbraw/zinc/08/52/89/1062085289.db2.gz WDTBRQQHGWLQDP-GFCCVEGCSA-N 1 2 301.821 4.043 20 0 DIADLO C[C@H]1Cc2ccccc2N(Cc2cc(-n3cc[nH+]c3)cs2)C1 ZINC001474430047 1062104657 /nfs/dbraw/zinc/10/46/57/1062104657.db2.gz UFYNEIWGGCWPHL-AWEZNQCLSA-N 1 2 309.438 4.133 20 0 DIADLO C[C@@H]1Cc2ccccc2N(Cc2cc(-n3cc[nH+]c3)cs2)C1 ZINC001474430048 1062104768 /nfs/dbraw/zinc/10/47/68/1062104768.db2.gz UFYNEIWGGCWPHL-CQSZACIVSA-N 1 2 309.438 4.133 20 0 DIADLO CCc1nc(C[N@H+](C)C[C@H]2[C@H](c3ccccc3)C2(F)F)cs1 ZINC001459350679 1062105195 /nfs/dbraw/zinc/10/51/95/1062105195.db2.gz SPPJOCGESBUDGX-HOCLYGCPSA-N 1 2 322.424 4.186 20 0 DIADLO CCc1nc(C[N@@H+](C)C[C@H]2[C@H](c3ccccc3)C2(F)F)cs1 ZINC001459350679 1062105197 /nfs/dbraw/zinc/10/51/97/1062105197.db2.gz SPPJOCGESBUDGX-HOCLYGCPSA-N 1 2 322.424 4.186 20 0 DIADLO CCO[C@@H]1C[C@H](Nc2[nH+]cccc2OC(C)C)C12CCCCC2 ZINC001474451256 1062128637 /nfs/dbraw/zinc/12/86/37/1062128637.db2.gz GZPAJYGMSGAMCZ-DLBZAZTESA-N 1 2 318.461 4.409 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCO[C@@H](c3cccc(F)c3)C2)cc1 ZINC001459429660 1062142432 /nfs/dbraw/zinc/14/24/32/1062142432.db2.gz VFDBXUZIGDXYLN-HXUWFJFHSA-N 1 2 313.416 4.352 20 0 DIADLO CCCc1ccc(C[N@H+]2CCO[C@@H](c3cccc(F)c3)C2)cc1 ZINC001459429660 1062142439 /nfs/dbraw/zinc/14/24/39/1062142439.db2.gz VFDBXUZIGDXYLN-HXUWFJFHSA-N 1 2 313.416 4.352 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)c1Cl ZINC001474467494 1062146696 /nfs/dbraw/zinc/14/66/96/1062146696.db2.gz VIIOOANBVDMEST-GFCCVEGCSA-N 1 2 315.791 4.009 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCC[C@@H](OCC3CC3)C2)c1Cl ZINC001474467494 1062146703 /nfs/dbraw/zinc/14/67/03/1062146703.db2.gz VIIOOANBVDMEST-GFCCVEGCSA-N 1 2 315.791 4.009 20 0 DIADLO CC1(C)CCc2onc(C[N@@H+]3CCCc4sccc4C3)c2C1 ZINC001459469981 1062157636 /nfs/dbraw/zinc/15/76/36/1062157636.db2.gz QNVNRRBSYBZWHI-UHFFFAOYSA-N 1 2 316.470 4.199 20 0 DIADLO CC1(C)CCc2onc(C[N@H+]3CCCc4sccc4C3)c2C1 ZINC001459469981 1062157646 /nfs/dbraw/zinc/15/76/46/1062157646.db2.gz QNVNRRBSYBZWHI-UHFFFAOYSA-N 1 2 316.470 4.199 20 0 DIADLO CC(C)c1nsc(C[N@H+](CCc2cccc(F)c2)C2CC2)n1 ZINC001459506208 1062173013 /nfs/dbraw/zinc/17/30/13/1062173013.db2.gz JIWOLZRCWNBJOP-UHFFFAOYSA-N 1 2 319.449 4.008 20 0 DIADLO CC(C)c1nsc(C[N@@H+](CCc2cccc(F)c2)C2CC2)n1 ZINC001459506208 1062173020 /nfs/dbraw/zinc/17/30/20/1062173020.db2.gz JIWOLZRCWNBJOP-UHFFFAOYSA-N 1 2 319.449 4.008 20 0 DIADLO Cc1cc(C[NH+]2CCC(=Cc3cccc(F)c3)CC2)cnc1F ZINC001474499437 1062180601 /nfs/dbraw/zinc/18/06/01/1062180601.db2.gz VVUSPVATHXSYGA-UHFFFAOYSA-N 1 2 314.379 4.348 20 0 DIADLO CCc1ccc([C@H]2COCC[N@@H+]2CCCSC(C)(C)C)o1 ZINC001459531838 1062188306 /nfs/dbraw/zinc/18/83/06/1062188306.db2.gz MFJSOEVYPFKKGK-OAHLLOKOSA-N 1 2 311.491 4.137 20 0 DIADLO CCc1ccc([C@H]2COCC[N@H+]2CCCSC(C)(C)C)o1 ZINC001459531838 1062188317 /nfs/dbraw/zinc/18/83/17/1062188317.db2.gz MFJSOEVYPFKKGK-OAHLLOKOSA-N 1 2 311.491 4.137 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2nc(C3CCC3)no2)cc1 ZINC001459542227 1062195895 /nfs/dbraw/zinc/19/58/95/1062195895.db2.gz OUOKTQSSDARCBM-KRWDZBQOSA-N 1 2 311.429 4.373 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2nc(C3CCC3)no2)cc1 ZINC001459542227 1062195906 /nfs/dbraw/zinc/19/59/06/1062195906.db2.gz OUOKTQSSDARCBM-KRWDZBQOSA-N 1 2 311.429 4.373 20 0 DIADLO C[C@H]1CC[C@@H](c2ccccc2)[N@H+](Cc2cc(C(F)(F)F)n[nH]2)C1 ZINC001474518540 1062200436 /nfs/dbraw/zinc/20/04/36/1062200436.db2.gz ZIVLZUWOBMKXQG-WFASDCNBSA-N 1 2 323.362 4.402 20 0 DIADLO C[C@H]1CC[C@@H](c2ccccc2)[N@@H+](Cc2cc(C(F)(F)F)n[nH]2)C1 ZINC001474518540 1062200447 /nfs/dbraw/zinc/20/04/47/1062200447.db2.gz ZIVLZUWOBMKXQG-WFASDCNBSA-N 1 2 323.362 4.402 20 0 DIADLO Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001467763050 1062201615 /nfs/dbraw/zinc/20/16/15/1062201615.db2.gz ASQPHURHXCOKIY-UHFFFAOYSA-N 1 2 324.771 4.030 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+]1CCCc2occc2C1 ZINC001474564491 1062268463 /nfs/dbraw/zinc/26/84/63/1062268463.db2.gz ZTYGYHXTCHSUMY-UHFFFAOYSA-N 1 2 305.805 4.280 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+]1CCCc2occc2C1 ZINC001474564491 1062268486 /nfs/dbraw/zinc/26/84/86/1062268486.db2.gz ZTYGYHXTCHSUMY-UHFFFAOYSA-N 1 2 305.805 4.280 20 0 DIADLO CCC1C[NH+](Cc2cc(Br)cc(C(F)(F)F)c2)C1 ZINC001474565298 1062272179 /nfs/dbraw/zinc/27/21/79/1062272179.db2.gz HHKRPCKPQFKHEW-UHFFFAOYSA-N 1 2 322.168 4.310 20 0 DIADLO CCC1(C)C[NH+](Cc2c(Cl)cc(Cl)cc2N(C)C)C1 ZINC001474570048 1062274733 /nfs/dbraw/zinc/27/47/33/1062274733.db2.gz UXEOJNFGDWBNNQ-UHFFFAOYSA-N 1 2 301.261 4.291 20 0 DIADLO Clc1cncc(C[NH+]2CC(Cc3ccccc3)C2)c1Cl ZINC001474568335 1062274207 /nfs/dbraw/zinc/27/42/07/1062274207.db2.gz ZBBUCWNQICXWEU-UHFFFAOYSA-N 1 2 307.224 4.063 20 0 DIADLO C[N@H+](C[C@H]1CCCC(C)(C)C1)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC001474570856 1062279924 /nfs/dbraw/zinc/27/99/24/1062279924.db2.gz JOPOTAOIMGCTPT-DOTOQJQBSA-N 1 2 312.461 4.042 20 0 DIADLO C[N@@H+](C[C@H]1CCCC(C)(C)C1)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC001474570856 1062279939 /nfs/dbraw/zinc/27/99/39/1062279939.db2.gz JOPOTAOIMGCTPT-DOTOQJQBSA-N 1 2 312.461 4.042 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]([C@@H](C)C(=O)OC(C)(C)C)C2CC2)c1 ZINC001474575134 1062284204 /nfs/dbraw/zinc/28/42/04/1062284204.db2.gz BRGBHLRDQMNJCB-ZDUSSCGKSA-N 1 2 323.864 4.343 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]([C@@H](C)C(=O)OC(C)(C)C)C2CC2)c1 ZINC001474575134 1062284224 /nfs/dbraw/zinc/28/42/24/1062284224.db2.gz BRGBHLRDQMNJCB-ZDUSSCGKSA-N 1 2 323.864 4.343 20 0 DIADLO COc1ccc(C[N@H+](Cc2nocc2C)Cc2ccccc2)cc1 ZINC001459675759 1062296188 /nfs/dbraw/zinc/29/61/88/1062296188.db2.gz HMWIKMAKQPWAND-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1ccc(C[N@@H+](Cc2nocc2C)Cc2ccccc2)cc1 ZINC001459675759 1062296205 /nfs/dbraw/zinc/29/62/05/1062296205.db2.gz HMWIKMAKQPWAND-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO CCOc1ccc(CNc2ccc(N3CCCC3)c[nH+]2)c(C)c1 ZINC001474592409 1062305694 /nfs/dbraw/zinc/30/56/94/1062305694.db2.gz ZFGKBMBXRGUVJZ-UHFFFAOYSA-N 1 2 311.429 4.001 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2cncc(Cl)c2Cl)CC1 ZINC001474594403 1062309922 /nfs/dbraw/zinc/30/99/22/1062309922.db2.gz USRWGSWJKCLTFV-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)c3c(C)cc(C)[nH+]c3C)C2)cc1 ZINC001459700702 1062316556 /nfs/dbraw/zinc/31/65/56/1062316556.db2.gz XTJSTPNZMSQUEW-VQIMIIECSA-N 1 2 322.452 4.333 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2nc(C3CCC3)no2)C(C)C)cc1 ZINC001459730983 1062342006 /nfs/dbraw/zinc/34/20/06/1062342006.db2.gz ORAXNKNRXGCDRF-GOSISDBHSA-N 1 2 313.445 4.386 20 0 DIADLO Clc1nccc2oc(CNc3c[nH+]cc4c3CCCC4)cc21 ZINC001474624597 1062348409 /nfs/dbraw/zinc/34/84/09/1062348409.db2.gz XSYXRCJSDLXCJL-UHFFFAOYSA-N 1 2 313.788 4.367 20 0 DIADLO CC[NH+](CC)[C@H](c1nnc(C2CCC2)o1)c1ccc(Cl)cc1 ZINC001255202027 1062357136 /nfs/dbraw/zinc/35/71/36/1062357136.db2.gz NLQGJCMUMLAFCW-HNNXBMFYSA-N 1 2 319.836 4.422 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2F)C2CCC2)sc1C ZINC001459763101 1062373831 /nfs/dbraw/zinc/37/38/31/1062373831.db2.gz PBIVQCXBEHNCFS-UHFFFAOYSA-N 1 2 304.434 4.454 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2F)C2CCC2)sc1C ZINC001459763101 1062373855 /nfs/dbraw/zinc/37/38/55/1062373855.db2.gz PBIVQCXBEHNCFS-UHFFFAOYSA-N 1 2 304.434 4.454 20 0 DIADLO Cc1[nH]c(CN2Cc3ccccc3C[C@H]2c2ccccc2)[nH+]c1C ZINC001459788942 1062398849 /nfs/dbraw/zinc/39/88/49/1062398849.db2.gz SPIKBSOPVIQKOQ-FQEVSTJZSA-N 1 2 317.436 4.326 20 0 DIADLO CCC[C@@H]([NH2+]CC(=O)c1ccccc1F)c1ccc(F)cc1F ZINC001459819782 1062426044 /nfs/dbraw/zinc/42/60/44/1062426044.db2.gz VEVWFPRKONECCT-QGZVFWFLSA-N 1 2 321.342 4.418 20 0 DIADLO FC(F)[C@@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1cccc(Cl)c1 ZINC001474707002 1062432216 /nfs/dbraw/zinc/43/22/16/1062432216.db2.gz ODEVXCRDQHJBEZ-KGLIPLIRSA-N 1 2 315.791 4.338 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1ccc(O)c(F)c1F)C(C)(C)C ZINC001474740889 1062457051 /nfs/dbraw/zinc/45/70/51/1062457051.db2.gz DKWWOKACZUATNU-KRWDZBQOSA-N 1 2 320.383 4.251 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@H](Cc2ccccc2)C1 ZINC001459867419 1062460128 /nfs/dbraw/zinc/46/01/28/1062460128.db2.gz HCXCTXLEMLMHPU-DNVCBOLYSA-N 1 2 315.844 4.345 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@H](Cc2ccccc2)C1 ZINC001459867419 1062460144 /nfs/dbraw/zinc/46/01/44/1062460144.db2.gz HCXCTXLEMLMHPU-DNVCBOLYSA-N 1 2 315.844 4.345 20 0 DIADLO C[C@H]([NH2+]Cc1csnn1)c1ccc(Oc2ccccc2)cc1 ZINC001459873275 1062464153 /nfs/dbraw/zinc/46/41/53/1062464153.db2.gz BRVHRXVVFAGYIF-ZDUSSCGKSA-N 1 2 311.410 4.181 20 0 DIADLO CC(C)C[C@H](C(=O)N(C)[C@@H]1CCC[C@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001469154393 1062488744 /nfs/dbraw/zinc/48/87/44/1062488744.db2.gz WKXRSJBERAPENR-BRWVUGGUSA-N 1 2 319.493 4.144 20 0 DIADLO CC[C@@H](C)[C@@H]([NH2+][C@H](C)c1sc2ccccc2c1C)C(=O)OC ZINC001459910871 1062491197 /nfs/dbraw/zinc/49/11/97/1062491197.db2.gz ZCERNFBHOQJVHJ-AXAPSJFSSA-N 1 2 319.470 4.448 20 0 DIADLO C[C@H](CC(F)(F)F)[N@@H+]1CCO[C@](C)(c2ccc(Cl)cc2)C1 ZINC001255654455 1062498021 /nfs/dbraw/zinc/49/80/21/1062498021.db2.gz DFQSXYWBLQMDAP-RISCZKNCSA-N 1 2 321.770 4.228 20 0 DIADLO C[C@H](CC(F)(F)F)[N@H+]1CCO[C@](C)(c2ccc(Cl)cc2)C1 ZINC001255654455 1062498028 /nfs/dbraw/zinc/49/80/28/1062498028.db2.gz DFQSXYWBLQMDAP-RISCZKNCSA-N 1 2 321.770 4.228 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@@H+](Cc1noc3c1CC(C)(C)CC3)CC2 ZINC001459965834 1062533801 /nfs/dbraw/zinc/53/38/01/1062533801.db2.gz PADWZGHSZWAJPI-UHFFFAOYSA-N 1 2 324.468 4.365 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@H+](Cc1noc3c1CC(C)(C)CC3)CC2 ZINC001459965834 1062533818 /nfs/dbraw/zinc/53/38/18/1062533818.db2.gz PADWZGHSZWAJPI-UHFFFAOYSA-N 1 2 324.468 4.365 20 0 DIADLO COc1cc(C)[nH+]c(CN2CCc3cc(C(C)(C)C)ccc32)c1 ZINC001459984567 1062547236 /nfs/dbraw/zinc/54/72/36/1062547236.db2.gz HQIUXOXWMJUFLY-UHFFFAOYSA-N 1 2 310.441 4.259 20 0 DIADLO COC(=O)[C@H](CC(C)C)[NH2+][C@H]1CC(C)(C)CCc2ccccc21 ZINC001460003665 1062562152 /nfs/dbraw/zinc/56/21/52/1062562152.db2.gz FWHZARDVRNBCCX-ROUUACIJSA-N 1 2 317.473 4.268 20 0 DIADLO Clc1ccc2cc3n(c2c1)CC[N@@H+](CCc1cccs1)C3 ZINC001460046548 1062595594 /nfs/dbraw/zinc/59/55/94/1062595594.db2.gz DXQLDVYBCOMTOK-UHFFFAOYSA-N 1 2 316.857 4.415 20 0 DIADLO Clc1ccc2cc3n(c2c1)CC[N@H+](CCc1cccs1)C3 ZINC001460046548 1062595612 /nfs/dbraw/zinc/59/56/12/1062595612.db2.gz DXQLDVYBCOMTOK-UHFFFAOYSA-N 1 2 316.857 4.415 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)c(Cl)s1 ZINC001460096919 1062612079 /nfs/dbraw/zinc/61/20/79/1062612079.db2.gz ZWAORZXUPXRQHL-WDEREUQCSA-N 1 2 306.258 4.198 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c(Cl)s1 ZINC001460096919 1062612098 /nfs/dbraw/zinc/61/20/98/1062612098.db2.gz ZWAORZXUPXRQHL-WDEREUQCSA-N 1 2 306.258 4.198 20 0 DIADLO Cc1cc(CNC(=O)Nc2cc(C)c(Cl)c(C)c2)cc(C)[nH+]1 ZINC001476483980 1062662848 /nfs/dbraw/zinc/66/28/48/1062662848.db2.gz YUZRAPSQTXAYPP-UHFFFAOYSA-N 1 2 317.820 4.290 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@@H+]1CCC[C@](C)(F)C1 ZINC001460145527 1062663067 /nfs/dbraw/zinc/66/30/67/1062663067.db2.gz QROPPGKICAUGRK-FZMZJTMJSA-N 1 2 300.215 4.334 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@H+]1CCC[C@](C)(F)C1 ZINC001460145527 1062663086 /nfs/dbraw/zinc/66/30/86/1062663086.db2.gz QROPPGKICAUGRK-FZMZJTMJSA-N 1 2 300.215 4.334 20 0 DIADLO c1c2ccccc2n2c1C[N@H+](CCCCc1ccccc1)CC2 ZINC001460181532 1062684986 /nfs/dbraw/zinc/68/49/86/1062684986.db2.gz MULNOGBZROVXEY-UHFFFAOYSA-N 1 2 304.437 4.480 20 0 DIADLO c1c2ccccc2n2c1C[N@@H+](CCCCc1ccccc1)CC2 ZINC001460181532 1062684995 /nfs/dbraw/zinc/68/49/95/1062684995.db2.gz MULNOGBZROVXEY-UHFFFAOYSA-N 1 2 304.437 4.480 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(Cl)cc2Cl)[C@@H]1[C@H]1CCCO1 ZINC001460192713 1062689596 /nfs/dbraw/zinc/68/95/96/1062689596.db2.gz BDAXCZFKAPFOAQ-HUUCEWRRSA-N 1 2 314.256 4.383 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(Cl)cc2Cl)[C@@H]1[C@H]1CCCO1 ZINC001460192713 1062689605 /nfs/dbraw/zinc/68/96/05/1062689605.db2.gz BDAXCZFKAPFOAQ-HUUCEWRRSA-N 1 2 314.256 4.383 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(Cl)cc2Cl)[C@H]1[C@@H]1CCCO1 ZINC001460192709 1062690003 /nfs/dbraw/zinc/69/00/03/1062690003.db2.gz BDAXCZFKAPFOAQ-GJZGRUSLSA-N 1 2 314.256 4.383 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(Cl)cc2Cl)[C@H]1[C@@H]1CCCO1 ZINC001460192709 1062690017 /nfs/dbraw/zinc/69/00/17/1062690017.db2.gz BDAXCZFKAPFOAQ-GJZGRUSLSA-N 1 2 314.256 4.383 20 0 DIADLO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1cc(Br)cc(F)c1F ZINC001460249300 1062730490 /nfs/dbraw/zinc/73/04/90/1062730490.db2.gz FLSUVZGLDHJMJL-SECBINFHSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@@H]1CC(C)(C)C[N@H+]1Cc1cc(Br)cc(F)c1F ZINC001460249300 1062730505 /nfs/dbraw/zinc/73/05/05/1062730505.db2.gz FLSUVZGLDHJMJL-SECBINFHSA-N 1 2 318.205 4.348 20 0 DIADLO CC[C@@H]1C[NH+](Cc2cccc(C(F)(F)F)c2)C[C@@H](CC)O1 ZINC001460267102 1062741768 /nfs/dbraw/zinc/74/17/68/1062741768.db2.gz PCTAEPSUWPPSAW-HUUCEWRRSA-N 1 2 301.352 4.095 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC001460336578 1062788864 /nfs/dbraw/zinc/78/88/64/1062788864.db2.gz DBNBLEAHZVAPBD-OLZOCXBDSA-N 1 2 324.262 4.154 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC001460336578 1062788881 /nfs/dbraw/zinc/78/88/81/1062788881.db2.gz DBNBLEAHZVAPBD-OLZOCXBDSA-N 1 2 324.262 4.154 20 0 DIADLO Fc1cc(Br)cc(C[N@@H+]2C[C@H]3CCCC[C@H]32)c1F ZINC001460349222 1062798256 /nfs/dbraw/zinc/79/82/56/1062798256.db2.gz CZXCSCGYTADBOA-NOZJJQNGSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(Br)cc(C[N@H+]2C[C@H]3CCCC[C@H]32)c1F ZINC001460349222 1062798278 /nfs/dbraw/zinc/79/82/78/1062798278.db2.gz CZXCSCGYTADBOA-NOZJJQNGSA-N 1 2 316.189 4.102 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1c(C)cccc1F ZINC001256394780 1062801413 /nfs/dbraw/zinc/80/14/13/1062801413.db2.gz KTLMWSKORACWII-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO Cc1cc(C)c(CNC(=O)N2CCC(C)(CC(C)C)CC2)c[nH+]1 ZINC001470506933 1062801518 /nfs/dbraw/zinc/80/15/18/1062801518.db2.gz AZWLDCCXSAJDRU-UHFFFAOYSA-N 1 2 317.477 4.056 20 0 DIADLO C[C@H](CSc1ccccc1)[N@H+](C)CC(=O)c1ccccc1F ZINC001460359697 1062806973 /nfs/dbraw/zinc/80/69/73/1062806973.db2.gz HJXGEMPIVGYKMF-CQSZACIVSA-N 1 2 317.429 4.121 20 0 DIADLO C[C@H](CSc1ccccc1)[N@@H+](C)CC(=O)c1ccccc1F ZINC001460359697 1062806988 /nfs/dbraw/zinc/80/69/88/1062806988.db2.gz HJXGEMPIVGYKMF-CQSZACIVSA-N 1 2 317.429 4.121 20 0 DIADLO CC[C@@H]1C[N@H+](CCc2cccc(Cl)c2Cl)[C@H](CC)CO1 ZINC001460371939 1062816374 /nfs/dbraw/zinc/81/63/74/1062816374.db2.gz RGERLBXUOBCPFV-ZIAGYGMSSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)[C@H](CC)CO1 ZINC001460371939 1062816393 /nfs/dbraw/zinc/81/63/93/1062816393.db2.gz RGERLBXUOBCPFV-ZIAGYGMSSA-N 1 2 316.272 4.425 20 0 DIADLO CC(C)c1cccc(C[N@@H+]2Cc3ccccc3NC(=O)[C@H]2C)c1 ZINC001460414023 1062844499 /nfs/dbraw/zinc/84/44/99/1062844499.db2.gz ZZLUZNRSLHXKKB-OAHLLOKOSA-N 1 2 308.425 4.153 20 0 DIADLO CC(C)c1cccc(C[N@H+]2Cc3ccccc3NC(=O)[C@H]2C)c1 ZINC001460414023 1062844517 /nfs/dbraw/zinc/84/45/17/1062844517.db2.gz ZZLUZNRSLHXKKB-OAHLLOKOSA-N 1 2 308.425 4.153 20 0 DIADLO CC1(F)CC[NH+](Cc2ccc(Cl)nc2C(F)(F)F)CC1 ZINC001460556760 1062912889 /nfs/dbraw/zinc/91/28/89/1062912889.db2.gz RPFIQGRNAZWZAY-UHFFFAOYSA-N 1 2 310.722 4.078 20 0 DIADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+]1CCc2c(O)cccc2C1 ZINC001460578433 1062922825 /nfs/dbraw/zinc/92/28/25/1062922825.db2.gz COFFCQSHYBPXCC-NSHDSACASA-N 1 2 305.780 4.304 20 0 DIADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@H+]1CCc2c(O)cccc2C1 ZINC001460578433 1062922851 /nfs/dbraw/zinc/92/28/51/1062922851.db2.gz COFFCQSHYBPXCC-NSHDSACASA-N 1 2 305.780 4.304 20 0 DIADLO COC(=O)[C@@H](c1ccccc1F)[N@H+](C)C[C@H](C)C1CCCCC1 ZINC001460598280 1062925076 /nfs/dbraw/zinc/92/50/76/1062925076.db2.gz MNHAFPNFXZLFRB-KBXCAEBGSA-N 1 2 321.436 4.188 20 0 DIADLO COC(=O)[C@@H](c1ccccc1F)[N@@H+](C)C[C@H](C)C1CCCCC1 ZINC001460598280 1062925103 /nfs/dbraw/zinc/92/51/03/1062925103.db2.gz MNHAFPNFXZLFRB-KBXCAEBGSA-N 1 2 321.436 4.188 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3C[C@H]3C3CCCC3)cc2)[nH+]c1C ZINC001471593758 1063006127 /nfs/dbraw/zinc/00/61/27/1063006127.db2.gz RCCHONBFILCWSJ-ROUUACIJSA-N 1 2 323.440 4.458 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001460794114 1063061806 /nfs/dbraw/zinc/06/18/06/1063061806.db2.gz XOXYPVKKPFKEOQ-BXKDBHETSA-N 1 2 309.784 4.381 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001460794114 1063061825 /nfs/dbraw/zinc/06/18/25/1063061825.db2.gz XOXYPVKKPFKEOQ-BXKDBHETSA-N 1 2 309.784 4.381 20 0 DIADLO CCN(C(=O)[C@@H](CC(C)C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC001472015869 1063044081 /nfs/dbraw/zinc/04/40/81/1063044081.db2.gz CALCPPFFAUFDHC-MRXNPFEDSA-N 1 2 319.836 4.177 20 0 DIADLO CC[C@@H](CC(=O)NCc1c[nH]c(C(C)C)[nH+]1)c1ccc(C)cc1 ZINC001472094754 1063047278 /nfs/dbraw/zinc/04/72/78/1063047278.db2.gz JNMMRMANHMZICT-HNNXBMFYSA-N 1 2 313.445 4.042 20 0 DIADLO CC[C@@H](CC(=O)NCc1c[nH+]c(C(C)C)[nH]1)c1ccc(C)cc1 ZINC001472094754 1063047302 /nfs/dbraw/zinc/04/73/02/1063047302.db2.gz JNMMRMANHMZICT-HNNXBMFYSA-N 1 2 313.445 4.042 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@H]2c2cc(C)n[nH]2)cc1Cl ZINC001460837431 1063090724 /nfs/dbraw/zinc/09/07/24/1063090724.db2.gz XOUJXBCYPMFIKW-INIZCTEOSA-N 1 2 319.836 4.107 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@H]2c2cc(C)n[nH]2)cc1Cl ZINC001460837431 1063090747 /nfs/dbraw/zinc/09/07/47/1063090747.db2.gz XOUJXBCYPMFIKW-INIZCTEOSA-N 1 2 319.836 4.107 20 0 DIADLO CC1=CC[C@](C)(C(=O)N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001472533104 1063098844 /nfs/dbraw/zinc/09/88/44/1063098844.db2.gz RXLLDPYPKWBPCT-JXFKEZNVSA-N 1 2 323.440 4.186 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2nnc(CC3CCCCC3)o2)cc1 ZINC001257076380 1063102826 /nfs/dbraw/zinc/10/28/26/1063102826.db2.gz LTXGURHSTMAOAN-UHFFFAOYSA-N 1 2 322.412 4.260 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H](F)C2)nc(-c2ccc(Cl)cc2)n1 ZINC001460896404 1063123828 /nfs/dbraw/zinc/12/38/28/1063123828.db2.gz MGUGZNOYGSRIAT-OAHLLOKOSA-N 1 2 319.811 4.039 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H](F)C2)nc(-c2ccc(Cl)cc2)n1 ZINC001460896404 1063123840 /nfs/dbraw/zinc/12/38/40/1063123840.db2.gz MGUGZNOYGSRIAT-OAHLLOKOSA-N 1 2 319.811 4.039 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2NCCCC1CCCCC1 ZINC001472655335 1063124246 /nfs/dbraw/zinc/12/42/46/1063124246.db2.gz IQFMMNLWYZVHIX-UHFFFAOYSA-N 1 2 315.465 4.354 20 0 DIADLO CCCN(CC1CCCCC1)c1nc(C)[nH+]c2c1CCCC2 ZINC001472665393 1063131614 /nfs/dbraw/zinc/13/16/14/1063131614.db2.gz FRLHYMSDKUYHMP-UHFFFAOYSA-N 1 2 301.478 4.461 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)ccc(C)c2F)nc1 ZINC001460934004 1063143587 /nfs/dbraw/zinc/14/35/87/1063143587.db2.gz UQILUPWTIBAIAU-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2c(F)ccc(C)c2F)nc1 ZINC001460934004 1063143596 /nfs/dbraw/zinc/14/35/96/1063143596.db2.gz UQILUPWTIBAIAU-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO CCc1cc(N[C@@H](COCC(C)C)c2ccco2)nc(CC)[nH+]1 ZINC001472681111 1063145032 /nfs/dbraw/zinc/14/50/32/1063145032.db2.gz ZXZFOTBFPQZRKB-HNNXBMFYSA-N 1 2 317.433 4.020 20 0 DIADLO CC(C)c1cc(NC[C@@H](O)C2CCCCC2)nc(C(C)C)[nH+]1 ZINC001472682936 1063148160 /nfs/dbraw/zinc/14/81/60/1063148160.db2.gz LDRTZNKUFBGNSW-MRXNPFEDSA-N 1 2 305.466 4.077 20 0 DIADLO CCC[C@@H](CC)[NH2+][C@H](C(=O)OC(C)(C)C)[C@@H](C)OC(C)(C)C ZINC001257243745 1063153337 /nfs/dbraw/zinc/15/33/37/1063153337.db2.gz DNUGCGKNQWTGKK-KFWWJZLASA-N 1 2 315.498 4.069 20 0 DIADLO CC[C@H](Cc1ccc(C)cc1)N(C)c1nc(C)[nH+]c2c1CCCC2 ZINC001472709451 1063169323 /nfs/dbraw/zinc/16/93/23/1063169323.db2.gz NJEXEIJZOWHKHB-GOSISDBHSA-N 1 2 323.484 4.430 20 0 DIADLO CC(C)c1cc(N[C@@H]2[C@H]3CCCO[C@H]3C2(C)C)nc(C(C)C)[nH+]1 ZINC001472713149 1063171776 /nfs/dbraw/zinc/17/17/76/1063171776.db2.gz QTYWVVHOYSGEQK-KBRIMQKVSA-N 1 2 317.477 4.339 20 0 DIADLO Cc1cc(CNC(=O)[C@H](C)c2ccc3ccccc3c2)cc(C)[nH+]1 ZINC001461006261 1063182451 /nfs/dbraw/zinc/18/24/51/1063182451.db2.gz FYUQCZCQZIGCHK-MRXNPFEDSA-N 1 2 318.420 4.272 20 0 DIADLO Cc1cc(NCCc2c[nH]c3ccc(F)cc23)nc(C2CCC2)[nH+]1 ZINC001472768584 1063218698 /nfs/dbraw/zinc/21/86/98/1063218698.db2.gz OICRMMBEQDJGJX-UHFFFAOYSA-N 1 2 324.403 4.328 20 0 DIADLO Fc1ccc(CNc2ccc(N3CCCCC3)c[nH+]2)c(F)c1F ZINC001461084302 1063240834 /nfs/dbraw/zinc/24/08/34/1063240834.db2.gz WHQAAVWKNPIHDY-UHFFFAOYSA-N 1 2 321.346 4.101 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1CNc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001472793097 1063242214 /nfs/dbraw/zinc/24/22/14/1063242214.db2.gz IVNLFKHHPXVOQD-ZIAGYGMSSA-N 1 2 315.465 4.210 20 0 DIADLO CCc1cc(N(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)nc(CC)[nH+]1 ZINC001472798752 1063247965 /nfs/dbraw/zinc/24/79/65/1063247965.db2.gz VZVWIRQNOKXZGW-BJHJDKERSA-N 1 2 315.383 4.159 20 0 DIADLO Cc1cccc(C[NH2+]Cc2coc(-c3cccs3)n2)c1F ZINC001461112359 1063262481 /nfs/dbraw/zinc/26/24/81/1063262481.db2.gz HARNTLMFGBCKJS-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO Cc1nc(NCC(C)(C)CC(F)(F)F)c2c([nH+]1)CCCC2 ZINC001472838750 1063275625 /nfs/dbraw/zinc/27/56/25/1063275625.db2.gz BFYSUQYZCSJMQN-UHFFFAOYSA-N 1 2 301.356 4.054 20 0 DIADLO CC(C)c1cc(N[C@@H](C2CCC2)[C@@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC001472856580 1063285482 /nfs/dbraw/zinc/28/54/82/1063285482.db2.gz CLUHJIOIXCGEQK-QAPCUYQASA-N 1 2 317.477 4.341 20 0 DIADLO CC(C)c1cc(NC[C@H]2CC3(CCC3)CO2)nc(C(C)C)[nH+]1 ZINC001472879468 1063294725 /nfs/dbraw/zinc/29/47/25/1063294725.db2.gz YWVNQATYZUDHEB-CQSZACIVSA-N 1 2 303.450 4.095 20 0 DIADLO CCC[C@H](C)CC[C@H](C)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001257484016 1063303833 /nfs/dbraw/zinc/30/38/33/1063303833.db2.gz YOCRQLSOTABRTB-STQMWFEESA-N 1 2 317.399 4.322 20 0 DIADLO CCC[C@H](C)CC[C@H](C)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001257484016 1063303855 /nfs/dbraw/zinc/30/38/55/1063303855.db2.gz YOCRQLSOTABRTB-STQMWFEESA-N 1 2 317.399 4.322 20 0 DIADLO C[N@@H+]1CCCC[C@@H]1c1nnc([C@H]2C[C@H]2c2ccc(Cl)cc2)o1 ZINC001257647400 1063354325 /nfs/dbraw/zinc/35/43/25/1063354325.db2.gz FCJLNHBRGPQMPG-SOUVJXGZSA-N 1 2 317.820 4.151 20 0 DIADLO C[N@H+]1CCCC[C@@H]1c1nnc([C@H]2C[C@H]2c2ccc(Cl)cc2)o1 ZINC001257647400 1063354344 /nfs/dbraw/zinc/35/43/44/1063354344.db2.gz FCJLNHBRGPQMPG-SOUVJXGZSA-N 1 2 317.820 4.151 20 0 DIADLO CCc1csc(SCc2ccc(-n3cc[nH+]c3)cc2)n1 ZINC001473068025 1063385799 /nfs/dbraw/zinc/38/57/99/1063385799.db2.gz ZNGMKZKRMGNNGF-UHFFFAOYSA-N 1 2 301.440 4.184 20 0 DIADLO COc1ccc(C[NH2+][C@H](c2ccccc2)c2cccc(F)c2)o1 ZINC001461287890 1063391659 /nfs/dbraw/zinc/39/16/59/1063391659.db2.gz XSIJZOUWTWFAAN-LJQANCHMSA-N 1 2 311.356 4.307 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1noc2c1CC(C)(C)CC2 ZINC001473107974 1063404240 /nfs/dbraw/zinc/40/42/40/1063404240.db2.gz FBUJVQSLTGXHRQ-LBPRGKRZSA-N 1 2 304.459 4.444 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1noc2c1CC(C)(C)CC2 ZINC001473107974 1063404257 /nfs/dbraw/zinc/40/42/57/1063404257.db2.gz FBUJVQSLTGXHRQ-LBPRGKRZSA-N 1 2 304.459 4.444 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1CCc1c(Cl)cccc1Cl ZINC001473106414 1063404925 /nfs/dbraw/zinc/40/49/25/1063404925.db2.gz VEZDPTFBCQTPTQ-VXGBXAGGSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@H+]1CCc1c(Cl)cccc1Cl ZINC001473106414 1063404932 /nfs/dbraw/zinc/40/49/32/1063404932.db2.gz VEZDPTFBCQTPTQ-VXGBXAGGSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@@H+]1CCc1c(Cl)cccc1Cl ZINC001473106411 1063407020 /nfs/dbraw/zinc/40/70/20/1063407020.db2.gz VEZDPTFBCQTPTQ-NEPJUHHUSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@H+]1CCc1c(Cl)cccc1Cl ZINC001473106411 1063407029 /nfs/dbraw/zinc/40/70/29/1063407029.db2.gz VEZDPTFBCQTPTQ-NEPJUHHUSA-N 1 2 302.245 4.035 20 0 DIADLO Cc1nc(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)cs1 ZINC001461312630 1063411524 /nfs/dbraw/zinc/41/15/24/1063411524.db2.gz JCUHERJLIZATND-UHFFFAOYSA-N 1 2 324.453 4.263 20 0 DIADLO Cc1cc(CNc2ccc3c(c2)CCC[N@H+]3C)cnc1Cl ZINC001461331267 1063424375 /nfs/dbraw/zinc/42/43/75/1063424375.db2.gz NVNSJOLDZSXWBR-UHFFFAOYSA-N 1 2 301.821 4.038 20 0 DIADLO Cc1cc(CNc2ccc3c(c2)CCC[N@@H+]3C)cnc1Cl ZINC001461331267 1063424381 /nfs/dbraw/zinc/42/43/81/1063424381.db2.gz NVNSJOLDZSXWBR-UHFFFAOYSA-N 1 2 301.821 4.038 20 0 DIADLO CCc1cccc(F)c1CNc1ccc(N2CCCCC2)[nH+]c1 ZINC001461373119 1063455306 /nfs/dbraw/zinc/45/53/06/1063455306.db2.gz NIDNOOBLVCQYJW-UHFFFAOYSA-N 1 2 313.420 4.386 20 0 DIADLO CCCCn1ncc(NCc2c[nH+]c(C)n2-c2ccccc2)c1C ZINC001461376741 1063457656 /nfs/dbraw/zinc/45/76/56/1063457656.db2.gz AQYPLFWZYRUUAV-UHFFFAOYSA-N 1 2 323.444 4.098 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+]Cc1cc(Cl)ccc1F)CCC2 ZINC001461382438 1063462499 /nfs/dbraw/zinc/46/24/99/1063462499.db2.gz MLOZODVUVYIIKC-MRXNPFEDSA-N 1 2 321.827 4.424 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2c(F)cncc2F)o1 ZINC001473183216 1063488430 /nfs/dbraw/zinc/48/84/30/1063488430.db2.gz UJNWEQAZRKTXAA-MRXNPFEDSA-N 1 2 306.356 4.379 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2c(F)cncc2F)o1 ZINC001473183216 1063488438 /nfs/dbraw/zinc/48/84/38/1063488438.db2.gz UJNWEQAZRKTXAA-MRXNPFEDSA-N 1 2 306.356 4.379 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(Br)cc(F)c1F ZINC001473185501 1063492911 /nfs/dbraw/zinc/49/29/11/1063492911.db2.gz JFRBXOTVJIEJJZ-VHSXEESVSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc(Br)cc(F)c1F ZINC001473185501 1063492914 /nfs/dbraw/zinc/49/29/14/1063492914.db2.gz JFRBXOTVJIEJJZ-VHSXEESVSA-N 1 2 318.205 4.348 20 0 DIADLO COC(=O)[C@@H](Cc1ccc(Cl)cc1)[NH2+][C@H](C)CCC=C(C)C ZINC001258076535 1063501531 /nfs/dbraw/zinc/50/15/31/1063501531.db2.gz MZTAAHYDMDANQB-RHSMWYFYSA-N 1 2 323.864 4.149 20 0 DIADLO CC(C)C[C@@H](C)C[C@@H](C)[N@@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001258075713 1063503016 /nfs/dbraw/zinc/50/30/16/1063503016.db2.gz WKOKJLZCQZGCBX-HZPDHXFCSA-N 1 2 319.493 4.011 20 0 DIADLO CC(C)C[C@@H](C)C[C@@H](C)[N@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001258075713 1063503032 /nfs/dbraw/zinc/50/30/32/1063503032.db2.gz WKOKJLZCQZGCBX-HZPDHXFCSA-N 1 2 319.493 4.011 20 0 DIADLO CCOC(=O)[C@H](Cc1ccc(F)cc1)[NH2+][C@H](C)CCC=C(C)C ZINC001258082998 1063505635 /nfs/dbraw/zinc/50/56/35/1063505635.db2.gz HFDIUSVKLFHWNI-QAPCUYQASA-N 1 2 321.436 4.024 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+]CCc1ccc2cn[nH]c2c1 ZINC001461498960 1063539833 /nfs/dbraw/zinc/53/98/33/1063539833.db2.gz BWTDJGBTVNTQFQ-UHFFFAOYSA-N 1 2 320.223 4.202 20 0 DIADLO C[C@@H](Cc1ccco1)[NH2+][C@H](C(=O)OC(C)(C)C)C1CCCCC1 ZINC001258178638 1063546717 /nfs/dbraw/zinc/54/67/17/1063546717.db2.gz DZJYALJIISYLQZ-YOEHRIQHSA-N 1 2 321.461 4.091 20 0 DIADLO C[C@@H](Cc1ccco1)[N@@H+]1CC[C@H](c2ccccc2)C(F)(F)C1 ZINC001258197766 1063556648 /nfs/dbraw/zinc/55/66/48/1063556648.db2.gz QXAPKUIPBJFQJF-WMLDXEAASA-N 1 2 305.368 4.335 20 0 DIADLO C[C@@H](Cc1ccco1)[N@H+]1CC[C@H](c2ccccc2)C(F)(F)C1 ZINC001258197766 1063556663 /nfs/dbraw/zinc/55/66/63/1063556663.db2.gz QXAPKUIPBJFQJF-WMLDXEAASA-N 1 2 305.368 4.335 20 0 DIADLO C[C@H](Cc1ccco1)[N@H+]1Cc2nc(-c3ccccc3)sc2C1 ZINC001258197323 1063557761 /nfs/dbraw/zinc/55/77/61/1063557761.db2.gz MGPFUJGCNQPCLP-CYBMUJFWSA-N 1 2 310.422 4.350 20 0 DIADLO C[C@H](Cc1ccco1)[N@@H+]1Cc2nc(-c3ccccc3)sc2C1 ZINC001258197323 1063557776 /nfs/dbraw/zinc/55/77/76/1063557776.db2.gz MGPFUJGCNQPCLP-CYBMUJFWSA-N 1 2 310.422 4.350 20 0 DIADLO CCCn1c(C[NH2+][C@@H]2C[C@@]2(F)c2ccccc2)nc2ccccc21 ZINC001461594800 1063602239 /nfs/dbraw/zinc/60/22/39/1063602239.db2.gz QDGLEKUZRKSIKS-UYAOXDASSA-N 1 2 323.415 4.173 20 0 DIADLO CCCn1c(C[NH2+][C@H]2C[C@@]2(F)c2ccccc2)nc2ccccc21 ZINC001461594790 1063602275 /nfs/dbraw/zinc/60/22/75/1063602275.db2.gz QDGLEKUZRKSIKS-AZUAARDMSA-N 1 2 323.415 4.173 20 0 DIADLO CCc1nc2ccc(NCc3c[nH+]c4c(C)cccn34)cc2s1 ZINC001461599777 1063604132 /nfs/dbraw/zinc/60/41/32/1063604132.db2.gz MDJVUMKPMUKPBC-UHFFFAOYSA-N 1 2 322.437 4.427 20 0 DIADLO FC(F)Oc1ccc(CNc2cc3cc[nH]c3c[nH+]2)cc1Cl ZINC001461603142 1063605309 /nfs/dbraw/zinc/60/53/09/1063605309.db2.gz DEIVLXLYWBXNRJ-UHFFFAOYSA-N 1 2 323.730 4.430 20 0 DIADLO CC[C@@H]([NH2+]Cc1c[nH]c(-c2ccccc2)n1)c1ccccc1F ZINC001461604531 1063608160 /nfs/dbraw/zinc/60/81/60/1063608160.db2.gz GSYLWASYWPZEQQ-GOSISDBHSA-N 1 2 309.388 4.457 20 0 DIADLO Cc1ccccc1C(F)(F)C[NH2+]Cc1cccc2[nH]ccc21 ZINC001461656175 1063640872 /nfs/dbraw/zinc/64/08/72/1063640872.db2.gz MCQODSCYXMKZFF-UHFFFAOYSA-N 1 2 300.352 4.358 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1ccc(OC)cc1C ZINC001461709945 1063671099 /nfs/dbraw/zinc/67/10/99/1063671099.db2.gz LWTKNMNYSFXUHO-UHFFFAOYSA-N 1 2 302.443 4.264 20 0 DIADLO CC(C)Cc1ncc(C[NH2+][C@H]2c3ccccc3CC[C@@H]2F)s1 ZINC001461707776 1063672097 /nfs/dbraw/zinc/67/20/97/1063672097.db2.gz COGYEEMQFZSEOW-WMZOPIPTSA-N 1 2 318.461 4.457 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)C(F)F)cc(C)c1OCc1ccccn1 ZINC001461712918 1063673917 /nfs/dbraw/zinc/67/39/17/1063673917.db2.gz JLNDUDRPXQFMAR-AWEZNQCLSA-N 1 2 320.383 4.021 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)C(F)F)cc(C)c1OCc1ccccn1 ZINC001461712927 1063674429 /nfs/dbraw/zinc/67/44/29/1063674429.db2.gz JLNDUDRPXQFMAR-CQSZACIVSA-N 1 2 320.383 4.021 20 0 DIADLO Cc1cc(NCc2c[nH]nc2-c2ccc(Cl)cc2)c[nH+]c1C ZINC001461716804 1063675527 /nfs/dbraw/zinc/67/55/27/1063675527.db2.gz RBIPXJBIXRJYGQ-UHFFFAOYSA-N 1 2 312.804 4.354 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1cccc2c1OCO2 ZINC001461719745 1063675641 /nfs/dbraw/zinc/67/56/41/1063675641.db2.gz FDBUPIWEIOGCGT-UHFFFAOYSA-N 1 2 323.396 4.132 20 0 DIADLO O=c1cc(CNc2[nH+]c3ccccc3n2C2CCCCC2)cc[nH]1 ZINC001461722547 1063677963 /nfs/dbraw/zinc/67/79/63/1063677963.db2.gz NLOFRCTXTPFEDF-UHFFFAOYSA-N 1 2 322.412 4.254 20 0 DIADLO CC[C@@H](C)CNc1[nH+]c2ccccc2n1CCc1ccccn1 ZINC001461727942 1063682377 /nfs/dbraw/zinc/68/23/77/1063682377.db2.gz GVIJEZZOBXPNJM-OAHLLOKOSA-N 1 2 308.429 4.132 20 0 DIADLO COc1cc(F)cc(CNc2[nH+]c3ccccc3n2C2CC2)c1 ZINC001461730520 1063683797 /nfs/dbraw/zinc/68/37/97/1063683797.db2.gz SRVGGAPIZUKXMJ-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO COc1cccc2[nH+]c(NC[C@H](C)CCc3ccccc3)[nH]c21 ZINC001461730942 1063684071 /nfs/dbraw/zinc/68/40/71/1063684071.db2.gz WYPNVBJMNSLENA-CQSZACIVSA-N 1 2 309.413 4.252 20 0 DIADLO COc1cccc2[nH]c(NC[C@H](C)CCc3ccccc3)[nH+]c21 ZINC001461730942 1063684076 /nfs/dbraw/zinc/68/40/76/1063684076.db2.gz WYPNVBJMNSLENA-CQSZACIVSA-N 1 2 309.413 4.252 20 0 DIADLO CCc1ccc(Br)c(NCc2c[nH+]cn2C(C)C)c1 ZINC001461733045 1063686271 /nfs/dbraw/zinc/68/62/71/1063686271.db2.gz WBLXTAABIQUUEZ-UHFFFAOYSA-N 1 2 322.250 4.401 20 0 DIADLO Clc1cnc(C[NH2+]Cc2c(Cl)ccc3cccnc32)s1 ZINC001461734134 1063686668 /nfs/dbraw/zinc/68/66/68/1063686668.db2.gz XKBFQZPIGBMGTG-UHFFFAOYSA-N 1 2 324.236 4.288 20 0 DIADLO Cc1cc(C[NH2+][C@H]2c3ccccc3OC[C@H]2F)ccc1Cl ZINC001461755236 1063697640 /nfs/dbraw/zinc/69/76/40/1063697640.db2.gz RITAKNHPSOOJEJ-WBVHZDCISA-N 1 2 305.780 4.210 20 0 DIADLO Cc1cc(C)c2cc(NCc3cccc4c3OCCO4)ccc2[nH+]1 ZINC001461753720 1063698503 /nfs/dbraw/zinc/69/85/03/1063698503.db2.gz WKNUUZUGAVBKBG-UHFFFAOYSA-N 1 2 320.392 4.235 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1cccc(O)c1Cl ZINC001461822837 1063738112 /nfs/dbraw/zinc/73/81/12/1063738112.db2.gz OBPJBAWNASRYME-UHFFFAOYSA-N 1 2 322.195 4.198 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cnc(C(C)C)s1 ZINC001461832102 1063740376 /nfs/dbraw/zinc/74/03/76/1063740376.db2.gz RYWTZUIKZGOQDP-UHFFFAOYSA-N 1 2 318.421 4.387 20 0 DIADLO Fc1cccc(Br)c1C[N@@H+]1CCc2ccccc2C1 ZINC001461837273 1063743298 /nfs/dbraw/zinc/74/32/98/1063743298.db2.gz DQFTZWRQBAYHQT-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO Fc1cccc(Br)c1C[N@H+]1CCc2ccccc2C1 ZINC001461837273 1063743307 /nfs/dbraw/zinc/74/33/07/1063743307.db2.gz DQFTZWRQBAYHQT-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CC[C@H]2c2ccccc2)cc1OC ZINC001461838079 1063743493 /nfs/dbraw/zinc/74/34/93/1063743493.db2.gz MCQQVJWYHQDXDT-INIZCTEOSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CC[C@H]2c2ccccc2)cc1OC ZINC001461838079 1063743504 /nfs/dbraw/zinc/74/35/04/1063743504.db2.gz MCQQVJWYHQDXDT-INIZCTEOSA-N 1 2 317.816 4.304 20 0 DIADLO CC[N@H+](Cc1ccc2c(c1)C[C@H](C)O2)Cc1c(F)cccc1F ZINC001461840910 1063746603 /nfs/dbraw/zinc/74/66/03/1063746603.db2.gz DALXXDRVRMPCNQ-ZDUSSCGKSA-N 1 2 317.379 4.310 20 0 DIADLO CC[N@@H+](Cc1ccc2c(c1)C[C@H](C)O2)Cc1c(F)cccc1F ZINC001461840910 1063746617 /nfs/dbraw/zinc/74/66/17/1063746617.db2.gz DALXXDRVRMPCNQ-ZDUSSCGKSA-N 1 2 317.379 4.310 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1Cl)[N@@H+]1CCC(=O)C(C)(C)C1 ZINC001258684139 1063749251 /nfs/dbraw/zinc/74/92/51/1063749251.db2.gz OKGLNMJLGGZBSY-LLVKDONJSA-N 1 2 314.256 4.225 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1Cl)[N@H+]1CCC(=O)C(C)(C)C1 ZINC001258684139 1063749260 /nfs/dbraw/zinc/74/92/60/1063749260.db2.gz OKGLNMJLGGZBSY-LLVKDONJSA-N 1 2 314.256 4.225 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1c(F)cccc1OC(F)(F)F ZINC001461856773 1063752673 /nfs/dbraw/zinc/75/26/73/1063752673.db2.gz DOIZIQXCIGBHDW-UHFFFAOYSA-N 1 2 319.323 4.418 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1c(F)cccc1OC(F)(F)F ZINC001461856773 1063752678 /nfs/dbraw/zinc/75/26/78/1063752678.db2.gz DOIZIQXCIGBHDW-UHFFFAOYSA-N 1 2 319.323 4.418 20 0 DIADLO CCCn1c[nH+]cc1CN(C)Cc1c(Cl)cccc1Cl ZINC001461872932 1063763295 /nfs/dbraw/zinc/76/32/95/1063763295.db2.gz VDSAVJUEXHDTJQ-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO COc1ccc(C[N@H+](Cc2cccc(C)c2)Cc2ccccn2)o1 ZINC001461904903 1063789715 /nfs/dbraw/zinc/78/97/15/1063789715.db2.gz RTZCWGMXJSGBOA-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1ccc(C[N@@H+](Cc2cccc(C)c2)Cc2ccccn2)o1 ZINC001461904903 1063789724 /nfs/dbraw/zinc/78/97/24/1063789724.db2.gz RTZCWGMXJSGBOA-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO C[C@@H](Cc1cccc(Cl)c1)[NH2+]CC(F)(F)c1ccccn1 ZINC001258740860 1063790654 /nfs/dbraw/zinc/79/06/54/1063790654.db2.gz CAXGIDSNEFXTLB-LBPRGKRZSA-N 1 2 310.775 4.048 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)c(F)c1 ZINC001461922384 1063803423 /nfs/dbraw/zinc/80/34/23/1063803423.db2.gz XXYURXAWFSJUTK-GUYCJALGSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)c(F)c1 ZINC001461922384 1063803429 /nfs/dbraw/zinc/80/34/29/1063803429.db2.gz XXYURXAWFSJUTK-GUYCJALGSA-N 1 2 305.418 4.158 20 0 DIADLO COCc1csc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)c1 ZINC001461929932 1063816249 /nfs/dbraw/zinc/81/62/49/1063816249.db2.gz QGIGKUPCDNLAQM-NSHDSACASA-N 1 2 323.408 4.292 20 0 DIADLO COCc1csc(C[N@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)c1 ZINC001461929932 1063816265 /nfs/dbraw/zinc/81/62/65/1063816265.db2.gz QGIGKUPCDNLAQM-NSHDSACASA-N 1 2 323.408 4.292 20 0 DIADLO Cc1ccc(-c2ccccc2C[N@@H+]2CCc3cn[nH]c3C2)c(C)c1 ZINC001461936767 1063823033 /nfs/dbraw/zinc/82/30/33/1063823033.db2.gz RCIOSWPSLONTML-UHFFFAOYSA-N 1 2 317.436 4.252 20 0 DIADLO Cc1ccc(-c2ccccc2C[N@H+]2CCc3cn[nH]c3C2)c(C)c1 ZINC001461936767 1063823046 /nfs/dbraw/zinc/82/30/46/1063823046.db2.gz RCIOSWPSLONTML-UHFFFAOYSA-N 1 2 317.436 4.252 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@H](CC)C[C@@H](C)CC)[C@@H]2C ZINC001258792145 1063827998 /nfs/dbraw/zinc/82/79/98/1063827998.db2.gz DXHNHLIWFREIHC-ARFHVFGLSA-N 1 2 307.482 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@H](CC)C[C@@H](C)CC)[C@@H]2C ZINC001258792145 1063828006 /nfs/dbraw/zinc/82/80/06/1063828006.db2.gz DXHNHLIWFREIHC-ARFHVFGLSA-N 1 2 307.482 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@H](CC)C[C@@H](C)CC)[C@H]2C ZINC001258792148 1063828195 /nfs/dbraw/zinc/82/81/95/1063828195.db2.gz DXHNHLIWFREIHC-HRCADAONSA-N 1 2 307.482 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@H](CC)C[C@@H](C)CC)[C@H]2C ZINC001258792148 1063828206 /nfs/dbraw/zinc/82/82/06/1063828206.db2.gz DXHNHLIWFREIHC-HRCADAONSA-N 1 2 307.482 4.011 20 0 DIADLO CCc1nc(C[N@H+](C)[C@@H](C)c2nccc3ccccc32)cs1 ZINC001461967328 1063846629 /nfs/dbraw/zinc/84/66/29/1063846629.db2.gz BJAKSBMVFWRPDP-ZDUSSCGKSA-N 1 2 311.454 4.447 20 0 DIADLO CCc1nc(C[N@@H+](C)[C@@H](C)c2nccc3ccccc32)cs1 ZINC001461967328 1063846644 /nfs/dbraw/zinc/84/66/44/1063846644.db2.gz BJAKSBMVFWRPDP-ZDUSSCGKSA-N 1 2 311.454 4.447 20 0 DIADLO C[C@@H]1CCC[C@@H]([N@@H+]2CCCC[C@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258824761 1063849889 /nfs/dbraw/zinc/84/98/89/1063849889.db2.gz XAWJXVJYQXAQJJ-UTUOFQBUSA-N 1 2 317.355 4.194 20 0 DIADLO C[C@@H]1CCC[C@@H]([N@H+]2CCCC[C@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258824761 1063849903 /nfs/dbraw/zinc/84/99/03/1063849903.db2.gz XAWJXVJYQXAQJJ-UTUOFQBUSA-N 1 2 317.355 4.194 20 0 DIADLO C[C@H](CCc1ccc(F)cc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001461986890 1063858048 /nfs/dbraw/zinc/85/80/48/1063858048.db2.gz DTSMMNGPUKYXGO-OAHLLOKOSA-N 1 2 309.388 4.445 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC001462021250 1063884572 /nfs/dbraw/zinc/88/45/72/1063884572.db2.gz WTEVMWHDCSOCSZ-LRDDRELGSA-N 1 2 301.386 4.169 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC001462021250 1063884587 /nfs/dbraw/zinc/88/45/87/1063884587.db2.gz WTEVMWHDCSOCSZ-LRDDRELGSA-N 1 2 301.386 4.169 20 0 DIADLO CCCCC[C@H]([NH2+]C[C@H](C)c1cccc(Cl)c1)C(=O)OC ZINC001462117982 1063937730 /nfs/dbraw/zinc/93/77/30/1063937730.db2.gz ZMAOFNKIWMNVEI-BBRMVZONSA-N 1 2 311.853 4.155 20 0 DIADLO C[C@@]1(C[N@@H+]2CCO[C@H](c3ccc(Cl)s3)C2)CCCS1 ZINC001261828176 1063948536 /nfs/dbraw/zinc/94/85/36/1063948536.db2.gz BBNCCTCZRXZRTJ-FZMZJTMJSA-N 1 2 317.907 4.061 20 0 DIADLO C[C@@]1(C[N@H+]2CCO[C@H](c3ccc(Cl)s3)C2)CCCS1 ZINC001261828176 1063948540 /nfs/dbraw/zinc/94/85/40/1063948540.db2.gz BBNCCTCZRXZRTJ-FZMZJTMJSA-N 1 2 317.907 4.061 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](C)c2cc3cnccc3o2)cs1 ZINC001261849969 1063949548 /nfs/dbraw/zinc/94/95/48/1063949548.db2.gz UZSUPCVUTBLCSR-NSHDSACASA-N 1 2 301.415 4.259 20 0 DIADLO CCOc1ccccc1CNc1ccc(N2CCCCC2)[nH+]c1 ZINC000378883745 1063979832 /nfs/dbraw/zinc/97/98/32/1063979832.db2.gz JTXSKPYFRZWBKR-UHFFFAOYSA-N 1 2 311.429 4.083 20 0 DIADLO COc1cccc(CCc2[nH]c3cc(Cl)c(OC)cc3[nH+]2)c1 ZINC000587932022 1063999470 /nfs/dbraw/zinc/99/94/70/1063999470.db2.gz UCQPYDWTMNPIJK-UHFFFAOYSA-N 1 2 316.788 4.019 20 0 DIADLO C[C@H]1CC[C@@H](CC(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1 ZINC001264831236 1064144820 /nfs/dbraw/zinc/14/48/20/1064144820.db2.gz PEUPWZCSTDOYPD-QWHCGFSZSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)ccc2[nH+]1 ZINC001264857947 1064151156 /nfs/dbraw/zinc/15/11/56/1064151156.db2.gz NWQSICWCYDOWIX-HYVNUMGLSA-N 1 2 311.429 4.188 20 0 DIADLO CC1(C)CCC[N@@H+]1Cc1ccc(Br)c(F)c1F ZINC000701279891 1064244660 /nfs/dbraw/zinc/24/46/60/1064244660.db2.gz MQAKLMYRWUSMPB-UHFFFAOYSA-N 1 2 304.178 4.102 20 0 DIADLO CC1(C)CCC[N@H+]1Cc1ccc(Br)c(F)c1F ZINC000701279891 1064244676 /nfs/dbraw/zinc/24/46/76/1064244676.db2.gz MQAKLMYRWUSMPB-UHFFFAOYSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Br)c(F)c2F)CC[C@@H]1C ZINC000701278916 1064245160 /nfs/dbraw/zinc/24/51/60/1064245160.db2.gz CKXNGZNSABFPDK-UWVGGRQHSA-N 1 2 318.205 4.205 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Br)c(F)c2F)CC[C@@H]1C ZINC000701278916 1064245170 /nfs/dbraw/zinc/24/51/70/1064245170.db2.gz CKXNGZNSABFPDK-UWVGGRQHSA-N 1 2 318.205 4.205 20 0 DIADLO CC[C@]1(C)CC[N@H+](Cc2ccc(Br)c(F)c2F)C1 ZINC000701295644 1064246756 /nfs/dbraw/zinc/24/67/56/1064246756.db2.gz RUJUINIUBNLZIW-CQSZACIVSA-N 1 2 318.205 4.349 20 0 DIADLO CC[C@]1(C)CC[N@@H+](Cc2ccc(Br)c(F)c2F)C1 ZINC000701295644 1064246769 /nfs/dbraw/zinc/24/67/69/1064246769.db2.gz RUJUINIUBNLZIW-CQSZACIVSA-N 1 2 318.205 4.349 20 0 DIADLO CC[C@H](C)c1cccc(NC(=O)Cc2cn3cccc(C)c3[nH+]2)c1 ZINC001279963104 1064373140 /nfs/dbraw/zinc/37/31/40/1064373140.db2.gz WFPOBCFNVIQWJJ-AWEZNQCLSA-N 1 2 321.424 4.337 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1sc2ccccc2c1Cl ZINC001288771015 1064568310 /nfs/dbraw/zinc/56/83/10/1064568310.db2.gz MEPFDJCMUUSNLX-UHFFFAOYSA-N 1 2 316.813 4.241 20 0 DIADLO Cc1ccc2sc(NCCCCNc3cccc[nH+]3)nc2c1 ZINC001306952706 1064725451 /nfs/dbraw/zinc/72/54/51/1064725451.db2.gz NHVQGZQMZICHJJ-UHFFFAOYSA-N 1 2 312.442 4.304 20 0 DIADLO Cc1cc(N2CCSC3(CCCCC3)C2)nc(C2CCC2)[nH+]1 ZINC001306989529 1064730085 /nfs/dbraw/zinc/73/00/85/1064730085.db2.gz LJIKALVIMJDMOO-UHFFFAOYSA-N 1 2 317.502 4.309 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3C[C@@H]3C3CCCC3)c2)[nH+]c1C ZINC001292074507 1064757871 /nfs/dbraw/zinc/75/78/71/1064757871.db2.gz ZACBLTIZTNAAGI-MSOLQXFVSA-N 1 2 323.440 4.458 20 0 DIADLO CC(C)CC[C@@H]1CCC[C@H]1NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001292764517 1064786907 /nfs/dbraw/zinc/78/69/07/1064786907.db2.gz BHMBCCXIQZQEME-RCCFBDPRSA-N 1 2 319.493 4.191 20 0 DIADLO Cc1cc(NC(=O)[C@@H](C)[C@H](C)C(C)(C)C)ccc1-n1cc[nH+]c1 ZINC001292865482 1064791653 /nfs/dbraw/zinc/79/16/53/1064791653.db2.gz QURSHTFERXPTHE-GJZGRUSLSA-N 1 2 313.445 4.438 20 0 DIADLO CC[C@H](C)C[C@@H](C)NC(=O)C[N@H+](CC)Cc1ccccc1Cl ZINC001293941381 1064840070 /nfs/dbraw/zinc/84/00/70/1064840070.db2.gz FPIXKWDQTNBOGW-LSDHHAIUSA-N 1 2 324.896 4.103 20 0 DIADLO CC[C@H](C)C[C@@H](C)NC(=O)C[N@@H+](CC)Cc1ccccc1Cl ZINC001293941381 1064840086 /nfs/dbraw/zinc/84/00/86/1064840086.db2.gz FPIXKWDQTNBOGW-LSDHHAIUSA-N 1 2 324.896 4.103 20 0 DIADLO CC(C)C[C@H](C(=O)N[C@@H]1CCCCC12CCCC2)n1cc[nH+]c1 ZINC001298651862 1065014719 /nfs/dbraw/zinc/01/47/19/1065014719.db2.gz NLAOBTRTQLGBIK-IAGOWNOFSA-N 1 2 317.477 4.090 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1ccc2c(c1)C=CCCC2)n1cc[nH+]c1 ZINC001300913710 1065045457 /nfs/dbraw/zinc/04/54/57/1065045457.db2.gz NFDYMUYMGTWQIY-IBGZPJMESA-N 1 2 323.440 4.459 20 0 DIADLO CCCCCC[C@](C)(CC)C(=O)NCC(C)(C)n1cc[nH+]c1 ZINC001301547297 1065068138 /nfs/dbraw/zinc/06/81/38/1065068138.db2.gz IHFDBSORCANJFI-SFHVURJKSA-N 1 2 307.482 4.121 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1noc(C)n1)c1ccc(Cl)cc1)[C@H]1C[C@H]1C ZINC000666122456 1065078554 /nfs/dbraw/zinc/07/85/54/1065078554.db2.gz NYEJJDRVNFLXDA-GCUJQHFUSA-N 1 2 319.836 4.145 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H](C)c3ccco3)cc2)[nH+]c1C ZINC001303123373 1065108340 /nfs/dbraw/zinc/10/83/40/1065108340.db2.gz YGLXWFNFWPADPV-LLVKDONJSA-N 1 2 309.369 4.029 20 0 DIADLO CCCC[C@@H](C(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1)C(C)C ZINC001303607716 1065119346 /nfs/dbraw/zinc/11/93/46/1065119346.db2.gz BDAAXXYJAFHBSW-HZPDHXFCSA-N 1 2 305.466 4.152 20 0 DIADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCCCC12CCCCCC2 ZINC001305699748 1065165301 /nfs/dbraw/zinc/16/53/01/1065165301.db2.gz YIYAPPHHUYSYPG-UHFFFAOYSA-N 1 2 311.429 4.282 20 0 DIADLO Cc1ccn2cc(CNc3cc(C(C)C)[nH+]c(C(C)C)n3)nc2c1 ZINC001306939733 1065213238 /nfs/dbraw/zinc/21/32/38/1065213238.db2.gz HAOGGLQMUOWGGY-UHFFFAOYSA-N 1 2 323.444 4.292 20 0 DIADLO Cc1cc(NCc2nc(C(C)(C)C)cs2)nc(C2CCC2)[nH+]1 ZINC001306962346 1065223197 /nfs/dbraw/zinc/22/31/97/1065223197.db2.gz MHULRRFIPRESHR-UHFFFAOYSA-N 1 2 316.474 4.419 20 0 DIADLO CC[C@H]1CN(c2nc(C)[nH+]c(C)c2C)CC[C@@H]1c1ccccc1 ZINC001306989447 1065238263 /nfs/dbraw/zinc/23/82/63/1065238263.db2.gz LFWFSLVMXPDAPT-HKUYNNGSSA-N 1 2 309.457 4.422 20 0 DIADLO CCS[C@@H]1CCCC[C@@H]1Nc1nc(C)[nH+]c2c1CCCC2 ZINC001306992541 1065240441 /nfs/dbraw/zinc/24/04/41/1065240441.db2.gz BXFIVZFRQFKOCF-JKSUJKDBSA-N 1 2 305.491 4.140 20 0 DIADLO CO[C@@H]1[C@@H](C)[C@@H](Nc2cc(C(C)C)[nH+]c(C(C)C)n2)C1(C)C ZINC001307079534 1065251850 /nfs/dbraw/zinc/25/18/50/1065251850.db2.gz XWVUPRXMHFOYOI-APHBMKBZSA-N 1 2 305.466 4.195 20 0 DIADLO C/C(=C\c1ccccc1)CN(C)c1nc(C)[nH+]c2c1CCCC2 ZINC001307096884 1065261125 /nfs/dbraw/zinc/26/11/25/1065261125.db2.gz YMDHBCUTLLNDHV-FYWRMAATSA-N 1 2 307.441 4.204 20 0 DIADLO Cc1cc(N2[C@H](C)C[C@H](c3ccccc3)[C@H]2C)nc(C2CC2)[nH+]1 ZINC001307129327 1065276690 /nfs/dbraw/zinc/27/66/90/1065276690.db2.gz ZBCZKECZNSQXSM-RKVPGOIHSA-N 1 2 307.441 4.433 20 0 DIADLO Cc1cc(NCc2cccc(-c3cnco3)c2)nc(C2CCC2)[nH+]1 ZINC001307156753 1065287048 /nfs/dbraw/zinc/28/70/48/1065287048.db2.gz NVQMQFVWKHXEFZ-UHFFFAOYSA-N 1 2 320.396 4.320 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(Nc3ccc(C)c(N4CCCC4)c3)c12 ZINC001307202101 1065301160 /nfs/dbraw/zinc/30/11/60/1065301160.db2.gz HBEYHGDYYJYEDQ-UHFFFAOYSA-N 1 2 321.428 4.173 20 0 DIADLO CC(C)c1cc(NCc2cccc3c2OCC3)nc(C(C)C)[nH+]1 ZINC001307215475 1065304826 /nfs/dbraw/zinc/30/48/26/1065304826.db2.gz LVXVEWOGYGHBTJ-UHFFFAOYSA-N 1 2 311.429 4.270 20 0 DIADLO Oc1ccc(Cl)c(C[N@H+](Cc2cccc(F)c2)C2CC2)c1 ZINC001307420401 1065380664 /nfs/dbraw/zinc/38/06/64/1065380664.db2.gz FHXSYUICZJQHAB-UHFFFAOYSA-N 1 2 305.780 4.349 20 0 DIADLO Oc1ccc(Cl)c(C[N@@H+](Cc2cccc(F)c2)C2CC2)c1 ZINC001307420401 1065380668 /nfs/dbraw/zinc/38/06/68/1065380668.db2.gz FHXSYUICZJQHAB-UHFFFAOYSA-N 1 2 305.780 4.349 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@@H+]2CCc2ccc(Cl)cc2)no1 ZINC001307422859 1065383109 /nfs/dbraw/zinc/38/31/09/1065383109.db2.gz UHRYFOQWLBUCRJ-HNNXBMFYSA-N 1 2 319.836 4.055 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@H+]2CCc2ccc(Cl)cc2)no1 ZINC001307422859 1065383126 /nfs/dbraw/zinc/38/31/26/1065383126.db2.gz UHRYFOQWLBUCRJ-HNNXBMFYSA-N 1 2 319.836 4.055 20 0 DIADLO CCc1nc(C[N@@H+](C)CCO[C@@H](CC)c2ccccc2)cs1 ZINC001307428873 1065388169 /nfs/dbraw/zinc/38/81/69/1065388169.db2.gz MMZDYHMRZQKIPS-KRWDZBQOSA-N 1 2 318.486 4.305 20 0 DIADLO CCc1nc(C[N@H+](C)CCO[C@@H](CC)c2ccccc2)cs1 ZINC001307428873 1065388189 /nfs/dbraw/zinc/38/81/89/1065388189.db2.gz MMZDYHMRZQKIPS-KRWDZBQOSA-N 1 2 318.486 4.305 20 0 DIADLO CCC[N@H+](Cc1cc(C2CC2)no1)Cc1ccc(F)cc1F ZINC001307436083 1065397888 /nfs/dbraw/zinc/39/78/88/1065397888.db2.gz NGRHUIQXPZEHFM-UHFFFAOYSA-N 1 2 306.356 4.242 20 0 DIADLO CCC[N@@H+](Cc1cc(C2CC2)no1)Cc1ccc(F)cc1F ZINC001307436083 1065397896 /nfs/dbraw/zinc/39/78/96/1065397896.db2.gz NGRHUIQXPZEHFM-UHFFFAOYSA-N 1 2 306.356 4.242 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@@H+]1CCc2c(C)cccc2C1 ZINC001307461560 1065415896 /nfs/dbraw/zinc/41/58/96/1065415896.db2.gz IBPROEXGEZWTDA-UHFFFAOYSA-N 1 2 323.415 4.062 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@H+]1CCc2c(C)cccc2C1 ZINC001307461560 1065415901 /nfs/dbraw/zinc/41/59/01/1065415901.db2.gz IBPROEXGEZWTDA-UHFFFAOYSA-N 1 2 323.415 4.062 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2nc3c(o2)CCCC3)C1 ZINC001307502973 1065446838 /nfs/dbraw/zinc/44/68/38/1065446838.db2.gz ASCLCBZCPVIAOK-GUYCJALGSA-N 1 2 314.404 4.276 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2nc3c(o2)CCCC3)C1 ZINC001307502973 1065446842 /nfs/dbraw/zinc/44/68/42/1065446842.db2.gz ASCLCBZCPVIAOK-GUYCJALGSA-N 1 2 314.404 4.276 20 0 DIADLO Clc1ccc(-n2ccc(C[N@@H+]3CC[C@H]3c3ccccc3)n2)cc1 ZINC001307513247 1065453072 /nfs/dbraw/zinc/45/30/72/1065453072.db2.gz JGSYQGSHZJGJQV-IBGZPJMESA-N 1 2 323.827 4.473 20 0 DIADLO Clc1ccc(-n2ccc(C[N@H+]3CC[C@H]3c3ccccc3)n2)cc1 ZINC001307513247 1065453084 /nfs/dbraw/zinc/45/30/84/1065453084.db2.gz JGSYQGSHZJGJQV-IBGZPJMESA-N 1 2 323.827 4.473 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+]1CCOC2(C1)CCCCCC2 ZINC001307529745 1065467645 /nfs/dbraw/zinc/46/76/45/1065467645.db2.gz KRJJCIYHBHOQDM-CQSZACIVSA-N 1 2 309.400 4.451 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+]1CCOC2(C1)CCCCCC2 ZINC001307529745 1065467652 /nfs/dbraw/zinc/46/76/52/1065467652.db2.gz KRJJCIYHBHOQDM-CQSZACIVSA-N 1 2 309.400 4.451 20 0 DIADLO CC(C)(C)OC(=O)C1([NH2+]C[C@@H]2CCCCC2(F)F)CCCC1 ZINC001307543555 1065474525 /nfs/dbraw/zinc/47/45/25/1065474525.db2.gz DOGYEXQCGPIGNU-ZDUSSCGKSA-N 1 2 317.420 4.056 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CCCCC[C@@H]2/C=C/c2ccccc2)[nH]1 ZINC001307582356 1065497187 /nfs/dbraw/zinc/49/71/87/1065497187.db2.gz GPUNNHNXUFDRQD-QFQMRYFISA-N 1 2 324.472 4.386 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CCCCC[C@@H]2/C=C/c2ccccc2)[nH]1 ZINC001307582356 1065497190 /nfs/dbraw/zinc/49/71/90/1065497190.db2.gz GPUNNHNXUFDRQD-QFQMRYFISA-N 1 2 324.472 4.386 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@H+]1Cc1cccc(Cl)n1 ZINC001307589258 1065502317 /nfs/dbraw/zinc/50/23/17/1065502317.db2.gz UUQKJEDTUCJPDO-NWDGAFQWSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@@H+]1Cc1cccc(Cl)n1 ZINC001307589258 1065502328 /nfs/dbraw/zinc/50/23/28/1065502328.db2.gz UUQKJEDTUCJPDO-NWDGAFQWSA-N 1 2 304.796 4.382 20 0 DIADLO CCC[N@H+](CC1CCC2(CC1)OCCO2)c1ccc(CC)cc1 ZINC001307776243 1065615759 /nfs/dbraw/zinc/61/57/59/1065615759.db2.gz JQHIXMPLRYEUKY-UHFFFAOYSA-N 1 2 317.473 4.399 20 0 DIADLO CCC[N@@H+](CC1CCC2(CC1)OCCO2)c1ccc(CC)cc1 ZINC001307776243 1065615764 /nfs/dbraw/zinc/61/57/64/1065615764.db2.gz JQHIXMPLRYEUKY-UHFFFAOYSA-N 1 2 317.473 4.399 20 0 DIADLO CC[N@H+](Cc1occc1C)Cc1nc2cc(Cl)ccc2n1C ZINC001307852748 1065651397 /nfs/dbraw/zinc/65/13/97/1065651397.db2.gz YVNLVPJHZRGFOD-UHFFFAOYSA-N 1 2 317.820 4.150 20 0 DIADLO CC[N@@H+](Cc1occc1C)Cc1nc2cc(Cl)ccc2n1C ZINC001307852748 1065651401 /nfs/dbraw/zinc/65/14/01/1065651401.db2.gz YVNLVPJHZRGFOD-UHFFFAOYSA-N 1 2 317.820 4.150 20 0 DIADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1ncc(-c2ccc(C)cc2)o1 ZINC001307907890 1065678415 /nfs/dbraw/zinc/67/84/15/1065678415.db2.gz OANQZHMGEMCWBR-SJORKVTESA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1ncc(-c2ccc(C)cc2)o1 ZINC001307907890 1065678426 /nfs/dbraw/zinc/67/84/26/1065678426.db2.gz OANQZHMGEMCWBR-SJORKVTESA-N 1 2 314.429 4.039 20 0 DIADLO Brc1ccc2[nH]c3c(c2c1)C[N@@H+](C1CCCC1)CC3 ZINC001307909872 1065678936 /nfs/dbraw/zinc/67/89/36/1065678936.db2.gz LGTKHZXHUVEZBO-UHFFFAOYSA-N 1 2 319.246 4.231 20 0 DIADLO Brc1ccc2[nH]c3c(c2c1)C[N@H+](C1CCCC1)CC3 ZINC001307909872 1065678942 /nfs/dbraw/zinc/67/89/42/1065678942.db2.gz LGTKHZXHUVEZBO-UHFFFAOYSA-N 1 2 319.246 4.231 20 0 DIADLO CC(C)(C)OC(=O)[C@H]1c2ccccc2CC[N@@H+]1[C@@H]1C=CCCC1 ZINC001307947578 1065695145 /nfs/dbraw/zinc/69/51/45/1065695145.db2.gz MLDPJHMTUSTESL-SJLPKXTDSA-N 1 2 313.441 4.036 20 0 DIADLO CC(C)(C)OC(=O)[C@H]1c2ccccc2CC[N@H+]1[C@@H]1C=CCCC1 ZINC001307947578 1065695150 /nfs/dbraw/zinc/69/51/50/1065695150.db2.gz MLDPJHMTUSTESL-SJLPKXTDSA-N 1 2 313.441 4.036 20 0 DIADLO CC(C)CCO[C@@H]1CC[N@H+](Cc2c(Cl)cncc2Cl)C1 ZINC001307966807 1065702272 /nfs/dbraw/zinc/70/22/72/1065702272.db2.gz ZDAIMRLIETYMON-GFCCVEGCSA-N 1 2 317.260 4.025 20 0 DIADLO CC(C)CCO[C@@H]1CC[N@@H+](Cc2c(Cl)cncc2Cl)C1 ZINC001307966807 1065702280 /nfs/dbraw/zinc/70/22/80/1065702280.db2.gz ZDAIMRLIETYMON-GFCCVEGCSA-N 1 2 317.260 4.025 20 0 DIADLO CC1(C)Cc2n[nH]cc2C[N@@H+](Cc2ccc(Cl)cc2Cl)C1 ZINC001307969569 1065703586 /nfs/dbraw/zinc/70/35/86/1065703586.db2.gz NLVRKTJREAERQA-UHFFFAOYSA-N 1 2 324.255 4.301 20 0 DIADLO CC1(C)Cc2n[nH]cc2C[N@H+](Cc2ccc(Cl)cc2Cl)C1 ZINC001307969569 1065703596 /nfs/dbraw/zinc/70/35/96/1065703596.db2.gz NLVRKTJREAERQA-UHFFFAOYSA-N 1 2 324.255 4.301 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+]1CC=C(c2ccc(Cl)cc2C)CC1 ZINC001307980680 1065710431 /nfs/dbraw/zinc/71/04/31/1065710431.db2.gz BZXBCVYLCODAPK-AWEZNQCLSA-N 1 2 321.848 4.079 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+]1CC=C(c2ccc(Cl)cc2C)CC1 ZINC001307980680 1065710443 /nfs/dbraw/zinc/71/04/43/1065710443.db2.gz BZXBCVYLCODAPK-AWEZNQCLSA-N 1 2 321.848 4.079 20 0 DIADLO Cc1cc(Cl)ccc1C1=CC[N@H+]([C@H](C)c2ncccn2)CC1 ZINC001307981119 1065712402 /nfs/dbraw/zinc/71/24/02/1065712402.db2.gz RDYYVKBFYVHCNQ-CQSZACIVSA-N 1 2 313.832 4.289 20 0 DIADLO Cc1cc(Cl)ccc1C1=CC[N@@H+]([C@H](C)c2ncccn2)CC1 ZINC001307981119 1065712413 /nfs/dbraw/zinc/71/24/13/1065712413.db2.gz RDYYVKBFYVHCNQ-CQSZACIVSA-N 1 2 313.832 4.289 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1cc(Cl)cc3cccnc31)C2 ZINC001308000591 1065718932 /nfs/dbraw/zinc/71/89/32/1065718932.db2.gz BFVXOJHUFIBYMB-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1cc(Cl)cc3cccnc31)C2 ZINC001308000591 1065718944 /nfs/dbraw/zinc/71/89/44/1065718944.db2.gz BFVXOJHUFIBYMB-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO CC(C)COC(=O)C[NH2+][C@@H]1CCC(C)(C)C[C@H]1c1ccccc1 ZINC001308024263 1065728881 /nfs/dbraw/zinc/72/88/81/1065728881.db2.gz SUHUIKZUBALQGW-ZWKOTPCHSA-N 1 2 317.473 4.138 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CCCC[C@H]2c2ncccn2)cc1 ZINC001308048093 1065740946 /nfs/dbraw/zinc/74/09/46/1065740946.db2.gz UVXALGZVOCNWRE-HNNXBMFYSA-N 1 2 303.356 4.141 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CCCC[C@H]2c2ncccn2)cc1 ZINC001308048093 1065740954 /nfs/dbraw/zinc/74/09/54/1065740954.db2.gz UVXALGZVOCNWRE-HNNXBMFYSA-N 1 2 303.356 4.141 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CCCC[C@@H]2c2ncccn2)cc1 ZINC001308048094 1065741761 /nfs/dbraw/zinc/74/17/61/1065741761.db2.gz UVXALGZVOCNWRE-OAHLLOKOSA-N 1 2 303.356 4.141 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CCCC[C@@H]2c2ncccn2)cc1 ZINC001308048094 1065741768 /nfs/dbraw/zinc/74/17/68/1065741768.db2.gz UVXALGZVOCNWRE-OAHLLOKOSA-N 1 2 303.356 4.141 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2Cc2cc(-c3ccccc3)no2)[nH+]c1C ZINC001308070585 1065750657 /nfs/dbraw/zinc/75/06/57/1065750657.db2.gz JWCSMAOQIJEFKO-GOSISDBHSA-N 1 2 322.412 4.019 20 0 DIADLO Fc1cccc(C[N@H+](Cc2nc3c(o2)CCCC3)C2CCC2)c1 ZINC001308091828 1065759352 /nfs/dbraw/zinc/75/93/52/1065759352.db2.gz YCWUKSLVYOLGQW-UHFFFAOYSA-N 1 2 314.404 4.247 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2nc3c(o2)CCCC3)C2CCC2)c1 ZINC001308091828 1065759363 /nfs/dbraw/zinc/75/93/63/1065759363.db2.gz YCWUKSLVYOLGQW-UHFFFAOYSA-N 1 2 314.404 4.247 20 0 DIADLO Cc1cc([C@@H]2CCCC[N@@H+]2Cc2cc(-c3ccccc3)no2)[nH]n1 ZINC001308109714 1065768340 /nfs/dbraw/zinc/76/83/40/1065768340.db2.gz SFQBBHVXMOOGRW-IBGZPJMESA-N 1 2 322.412 4.100 20 0 DIADLO Cc1cc([C@@H]2CCCC[N@H+]2Cc2cc(-c3ccccc3)no2)[nH]n1 ZINC001308109714 1065768351 /nfs/dbraw/zinc/76/83/51/1065768351.db2.gz SFQBBHVXMOOGRW-IBGZPJMESA-N 1 2 322.412 4.100 20 0 DIADLO Cc1cccc2[nH]c(CNc3ccc(N4CCCCC4)c[nH+]3)cc21 ZINC001308214286 1065822418 /nfs/dbraw/zinc/82/24/18/1065822418.db2.gz PUWHHUKQYSEBBW-UHFFFAOYSA-N 1 2 320.440 4.474 20 0 DIADLO Fc1ccc(F)c(C[NH2+][C@@H](c2ccccc2)c2cccnc2)c1 ZINC001308244230 1065849887 /nfs/dbraw/zinc/84/98/87/1065849887.db2.gz KIFXGRLHBZUAFQ-IBGZPJMESA-N 1 2 310.347 4.239 20 0 DIADLO CCn1cnc(Cl)c1C[NH2+][C@H](C)c1nc2ccccc2s1 ZINC001308272453 1065872165 /nfs/dbraw/zinc/87/21/65/1065872165.db2.gz JWPVXBKYJILAAG-SNVBAGLBSA-N 1 2 320.849 4.017 20 0 DIADLO COc1cccc(C[NH2+][C@@H](C)c2c(F)cccc2Cl)c1OC ZINC001308303681 1065898292 /nfs/dbraw/zinc/89/82/92/1065898292.db2.gz RMEHFYVSKSDGDW-NSHDSACASA-N 1 2 323.795 4.347 20 0 DIADLO CCCn1c[nH+]cc1CNc1cc(F)c(OC(C)(C)C)c(F)c1 ZINC001308344541 1065927591 /nfs/dbraw/zinc/92/75/91/1065927591.db2.gz NHOQRSNFNNDOKQ-UHFFFAOYSA-N 1 2 323.387 4.361 20 0 DIADLO Cc1[nH+]c(NCc2ccc3occc3c2)ccc1-c1cnn(C)c1 ZINC001308414437 1065974002 /nfs/dbraw/zinc/97/40/02/1065974002.db2.gz LJDWMKOUXNVLHJ-UHFFFAOYSA-N 1 2 318.380 4.149 20 0 DIADLO COCc1c(C)cc(C)c(CNc2cc3cc[nH]c3c[nH+]2)c1C ZINC001308451149 1065996628 /nfs/dbraw/zinc/99/66/28/1065996628.db2.gz TYTSXPUARAIJLD-UHFFFAOYSA-N 1 2 309.413 4.247 20 0 DIADLO COc1ccc(C[NH2+]CC(F)(F)C(C)(C)C)cc1OC(F)F ZINC001308470053 1066009230 /nfs/dbraw/zinc/00/92/30/1066009230.db2.gz FPRHCWYNMZUCAC-UHFFFAOYSA-N 1 2 323.330 4.068 20 0 DIADLO C[C@@H](c1ccccc1)N1CC[C@H]([NH2+]CC(F)(F)C(C)(C)C)C1 ZINC001308471508 1066010726 /nfs/dbraw/zinc/01/07/26/1066010726.db2.gz PLMJCKPARDPVPC-HOCLYGCPSA-N 1 2 310.432 4.093 20 0 DIADLO C[C@H](c1ccccc1)N1CC[C@@H]([NH2+]CC(F)(F)C(C)(C)C)C1 ZINC001308471502 1066011362 /nfs/dbraw/zinc/01/13/62/1066011362.db2.gz PLMJCKPARDPVPC-GDBMZVCRSA-N 1 2 310.432 4.093 20 0 DIADLO CC(C)(C)c1n[nH]cc1CNc1ccc(Nc2ccccc2)c[nH+]1 ZINC001308471367 1066011486 /nfs/dbraw/zinc/01/14/86/1066011486.db2.gz KFNCKHHKTOBLKY-UHFFFAOYSA-N 1 2 321.428 4.458 20 0 DIADLO Fc1cccc(C[NH2+]Cc2ncc(-c3ccccc3)s2)c1F ZINC001308480854 1066018071 /nfs/dbraw/zinc/01/80/71/1066018071.db2.gz IZFABEGNVHOQEW-UHFFFAOYSA-N 1 2 316.376 4.378 20 0 DIADLO CC[C@H]1CCC[C@H](CNc2[nH+]c3ccccc3n2CCOC)C1 ZINC001308506935 1066033863 /nfs/dbraw/zinc/03/38/63/1066033863.db2.gz FXOKHVCTIACHTK-HOTGVXAUSA-N 1 2 315.461 4.311 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1ccc2c(c1)OCCO2 ZINC001308506646 1066033947 /nfs/dbraw/zinc/03/39/47/1066033947.db2.gz YMCSTMYKERKJBV-UHFFFAOYSA-N 1 2 323.396 4.001 20 0 DIADLO F[C@@H]1COc2ccccc2[C@@H]1[NH2+]Cc1cc2ccccc2s1 ZINC001308521471 1066041965 /nfs/dbraw/zinc/04/19/65/1066041965.db2.gz UOKOACSOPGYMGI-QAPCUYQASA-N 1 2 313.397 4.463 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)cc2c1OCC2)c1c(F)cccc1F ZINC001308528123 1066046656 /nfs/dbraw/zinc/04/66/56/1066046656.db2.gz GDLUJQNZEXOWFY-SNVBAGLBSA-N 1 2 323.770 4.404 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)c(F)c1F)c1c(F)cccc1F ZINC001308528694 1066048274 /nfs/dbraw/zinc/04/82/74/1066048274.db2.gz VKHYLGYJIGMFOB-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3ccc(F)c(F)c3C2)c(C)c1 ZINC001308568668 1066078936 /nfs/dbraw/zinc/07/89/36/1066078936.db2.gz CVEBRLKRDIKFMN-UHFFFAOYSA-N 1 2 317.379 4.230 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3ccc(F)c(F)c3C2)c(C)c1 ZINC001308568668 1066078945 /nfs/dbraw/zinc/07/89/45/1066078945.db2.gz CVEBRLKRDIKFMN-UHFFFAOYSA-N 1 2 317.379 4.230 20 0 DIADLO CC[C@H]1CN(C)c2ccccc2C[N@@H+]1Cc1nc(Cl)cs1 ZINC001308585061 1066101055 /nfs/dbraw/zinc/10/10/55/1066101055.db2.gz XPDMLMCNKPBMDO-ZDUSSCGKSA-N 1 2 321.877 4.027 20 0 DIADLO CC[C@H]1CN(C)c2ccccc2C[N@H+]1Cc1nc(Cl)cs1 ZINC001308585061 1066101060 /nfs/dbraw/zinc/10/10/60/1066101060.db2.gz XPDMLMCNKPBMDO-ZDUSSCGKSA-N 1 2 321.877 4.027 20 0 DIADLO COc1cc(C)ccc1C[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC001308597459 1066108412 /nfs/dbraw/zinc/10/84/12/1066108412.db2.gz BNVPDTOIYOOCPT-KDOFPFPSSA-N 1 2 317.454 4.027 20 0 DIADLO COc1cc(C)ccc1C[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC001308597459 1066108418 /nfs/dbraw/zinc/10/84/18/1066108418.db2.gz BNVPDTOIYOOCPT-KDOFPFPSSA-N 1 2 317.454 4.027 20 0 DIADLO COc1cc(C)ccc1C[N@H+]1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC001308597461 1066109208 /nfs/dbraw/zinc/10/92/08/1066109208.db2.gz BNVPDTOIYOOCPT-KSSFIOAISA-N 1 2 317.454 4.027 20 0 DIADLO COc1cc(C)ccc1C[N@@H+]1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC001308597461 1066109212 /nfs/dbraw/zinc/10/92/12/1066109212.db2.gz BNVPDTOIYOOCPT-KSSFIOAISA-N 1 2 317.454 4.027 20 0 DIADLO CCc1onc(C)c1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC001308644981 1066135211 /nfs/dbraw/zinc/13/52/11/1066135211.db2.gz VPAINVBKVUEKAN-UHFFFAOYSA-N 1 2 310.397 4.341 20 0 DIADLO CCc1onc(C)c1C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC001308644981 1066135216 /nfs/dbraw/zinc/13/52/16/1066135216.db2.gz VPAINVBKVUEKAN-UHFFFAOYSA-N 1 2 310.397 4.341 20 0 DIADLO Cc1cc(Cl)ccc1C[NH+]1CCN(Cc2ccsc2)CC1 ZINC001308644666 1066135723 /nfs/dbraw/zinc/13/57/23/1066135723.db2.gz BBDURELKJQCARM-UHFFFAOYSA-N 1 2 320.889 4.028 20 0 DIADLO COc1cc(F)cc(OC)c1C[N@H+](C)Cc1ccc(Cl)cc1 ZINC001308659668 1066142568 /nfs/dbraw/zinc/14/25/68/1066142568.db2.gz CGEUYULRRSUNGK-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cc(F)cc(OC)c1C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001308659668 1066142570 /nfs/dbraw/zinc/14/25/70/1066142570.db2.gz CGEUYULRRSUNGK-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2c(F)cccc2Cl)c(C)c1 ZINC001308662054 1066143976 /nfs/dbraw/zinc/14/39/76/1066143976.db2.gz GYBPDOVWSMAYGE-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2c(F)cccc2Cl)c(C)c1 ZINC001308662054 1066143978 /nfs/dbraw/zinc/14/39/78/1066143978.db2.gz GYBPDOVWSMAYGE-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO CCC[N@H+](CC(=O)OC(C)(C)C)Cc1cccc(SCC)c1 ZINC001308672607 1066147851 /nfs/dbraw/zinc/14/78/51/1066147851.db2.gz MOGMBNKYIRSUES-UHFFFAOYSA-N 1 2 323.502 4.352 20 0 DIADLO CCC[N@@H+](CC(=O)OC(C)(C)C)Cc1cccc(SCC)c1 ZINC001308672607 1066147858 /nfs/dbraw/zinc/14/78/58/1066147858.db2.gz MOGMBNKYIRSUES-UHFFFAOYSA-N 1 2 323.502 4.352 20 0 DIADLO CCOC(=O)[C@@H](C)[N@H+](Cc1cccc(C2CCCC2)c1)C1CC1 ZINC001308694930 1066185010 /nfs/dbraw/zinc/18/50/10/1066185010.db2.gz JPCPGCAREIGIHV-OAHLLOKOSA-N 1 2 315.457 4.260 20 0 DIADLO CCOC(=O)[C@@H](C)[N@@H+](Cc1cccc(C2CCCC2)c1)C1CC1 ZINC001308694930 1066185012 /nfs/dbraw/zinc/18/50/12/1066185012.db2.gz JPCPGCAREIGIHV-OAHLLOKOSA-N 1 2 315.457 4.260 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+](CC)Cc1c[nH]c2ccccc12 ZINC001308696872 1066186617 /nfs/dbraw/zinc/18/66/17/1066186617.db2.gz RKYKHPDUSOFRLF-UHFFFAOYSA-N 1 2 316.836 4.060 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+](CC)Cc1c[nH]c2ccccc12 ZINC001308696872 1066186620 /nfs/dbraw/zinc/18/66/20/1066186620.db2.gz RKYKHPDUSOFRLF-UHFFFAOYSA-N 1 2 316.836 4.060 20 0 DIADLO Cc1occc1C[N@@H+]1CCc2c(Br)cc(C)cc2C1 ZINC001308703574 1066188446 /nfs/dbraw/zinc/18/84/46/1066188446.db2.gz DAPPBKAXABBMHS-UHFFFAOYSA-N 1 2 320.230 4.217 20 0 DIADLO Cc1occc1C[N@H+]1CCc2c(Br)cc(C)cc2C1 ZINC001308703574 1066188449 /nfs/dbraw/zinc/18/84/49/1066188449.db2.gz DAPPBKAXABBMHS-UHFFFAOYSA-N 1 2 320.230 4.217 20 0 DIADLO CCOc1cccc(F)c1C[N@@H+]1CCc2cc(F)cc(C)c2C1 ZINC001308716886 1066195662 /nfs/dbraw/zinc/19/56/62/1066195662.db2.gz ZCJFJECIPKLAGM-UHFFFAOYSA-N 1 2 317.379 4.230 20 0 DIADLO CCOc1cccc(F)c1C[N@H+]1CCc2cc(F)cc(C)c2C1 ZINC001308716886 1066195668 /nfs/dbraw/zinc/19/56/68/1066195668.db2.gz ZCJFJECIPKLAGM-UHFFFAOYSA-N 1 2 317.379 4.230 20 0 DIADLO C/C=C\C[C@H]([NH2+][C@H](CC)Cc1ccc(Cl)cc1)C(=O)OCC ZINC001308740085 1066213831 /nfs/dbraw/zinc/21/38/31/1066213831.db2.gz MURXXQVPNSWMEX-RRWQFYAYSA-N 1 2 323.864 4.149 20 0 DIADLO CC(C)(C)C[C@H]1CC[N@H+](Cc2nc(Br)cs2)C1 ZINC001308822440 1066299258 /nfs/dbraw/zinc/29/92/58/1066299258.db2.gz DXQJCRGUCOYYPE-SNVBAGLBSA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)(C)C[C@H]1CC[N@@H+](Cc2nc(Br)cs2)C1 ZINC001308822440 1066299269 /nfs/dbraw/zinc/29/92/69/1066299269.db2.gz DXQJCRGUCOYYPE-SNVBAGLBSA-N 1 2 317.296 4.164 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)c(C)o1 ZINC001308896435 1066376460 /nfs/dbraw/zinc/37/64/60/1066376460.db2.gz NKJSZSMJOFCGMJ-UHFFFAOYSA-N 1 2 309.331 4.474 20 0 DIADLO Cc1cc(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)c(C)o1 ZINC001308896435 1066376476 /nfs/dbraw/zinc/37/64/76/1066376476.db2.gz NKJSZSMJOFCGMJ-UHFFFAOYSA-N 1 2 309.331 4.474 20 0 DIADLO CCCCOc1ccccc1C[N@@H+]1Cc2cccc(OC)c2C1 ZINC001308900816 1066380374 /nfs/dbraw/zinc/38/03/74/1066380374.db2.gz VYWWQSCNMOPCEU-UHFFFAOYSA-N 1 2 311.425 4.390 20 0 DIADLO CCCCOc1ccccc1C[N@H+]1Cc2cccc(OC)c2C1 ZINC001308900816 1066380380 /nfs/dbraw/zinc/38/03/80/1066380380.db2.gz VYWWQSCNMOPCEU-UHFFFAOYSA-N 1 2 311.425 4.390 20 0 DIADLO CCCSC[C@H](C)[NH2+]CC(F)(F)c1cc(F)cc(F)c1 ZINC001308917466 1066395830 /nfs/dbraw/zinc/39/58/30/1066395830.db2.gz IIWNBMXGWLIEAU-JTQLQIEISA-N 1 2 309.372 4.178 20 0 DIADLO COC(=O)CCC[C@H]1CCC[C@@H](Nc2c[nH+]c(C)c(C)c2)C1 ZINC001308917987 1066397977 /nfs/dbraw/zinc/39/79/77/1066397977.db2.gz IHEVTXDZXAQJOI-HZPDHXFCSA-N 1 2 304.434 4.012 20 0 DIADLO CCOC(=O)C(C)(C)CCC[C@H](C)Nc1c[nH+]c(C)c(C)c1 ZINC001308919859 1066398853 /nfs/dbraw/zinc/39/88/53/1066398853.db2.gz UDISQCDKQNULMA-AWEZNQCLSA-N 1 2 306.450 4.258 20 0 DIADLO CC(=O)Nc1ccccc1CNc1ccc2[nH+]c(C)cc(C)c2c1 ZINC001308938681 1066409064 /nfs/dbraw/zinc/40/90/64/1066409064.db2.gz GYQJEMFPIDQUFA-UHFFFAOYSA-N 1 2 319.408 4.422 20 0 DIADLO CCCCCC[N@@H+](Cc1cn(C(C)C)nn1)Cc1ccc(C)o1 ZINC001308948050 1066413935 /nfs/dbraw/zinc/41/39/35/1066413935.db2.gz UPOZJIGKHWNWGC-UHFFFAOYSA-N 1 2 318.465 4.343 20 0 DIADLO CCCCCC[N@H+](Cc1cn(C(C)C)nn1)Cc1ccc(C)o1 ZINC001308948050 1066413945 /nfs/dbraw/zinc/41/39/45/1066413945.db2.gz UPOZJIGKHWNWGC-UHFFFAOYSA-N 1 2 318.465 4.343 20 0 DIADLO c1n[nH]c([C@@H]([NH2+]C[C@@H]2CCC=CCCC2)C2CCCCC2)n1 ZINC001308975478 1066428332 /nfs/dbraw/zinc/42/83/32/1066428332.db2.gz UQIUFGHKOYUYLX-WBVHZDCISA-N 1 2 302.466 4.152 20 0 DIADLO CC(C)c1cccc(N(C)C(=O)Nc2ccc3[nH+]ccn3c2)c1 ZINC001311027098 1066588617 /nfs/dbraw/zinc/58/86/17/1066588617.db2.gz OTGWXKBHOWLWSS-UHFFFAOYSA-N 1 2 308.385 4.126 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C(C)C)no2)cc1 ZINC000079314365 185164786 /nfs/dbraw/zinc/16/47/86/185164786.db2.gz TUTRNZHJFLSZMQ-UONOGXRCSA-N 1 2 317.433 4.392 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1cnc(Cl)s1 ZINC000079316791 185164847 /nfs/dbraw/zinc/16/48/47/185164847.db2.gz WJJHEIWKCLLMQB-QMMMGPOBSA-N 1 2 302.777 4.268 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cnc(Cl)s1 ZINC000079316791 185164848 /nfs/dbraw/zinc/16/48/48/185164848.db2.gz WJJHEIWKCLLMQB-QMMMGPOBSA-N 1 2 302.777 4.268 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc2ccccc2n1 ZINC000090458959 185297676 /nfs/dbraw/zinc/29/76/76/185297676.db2.gz GCYGRZUQSMJWQX-LBPRGKRZSA-N 1 2 309.438 4.420 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1nc(C2CC2)cs1 ZINC000090460059 185297741 /nfs/dbraw/zinc/29/77/41/185297741.db2.gz NHOKGDGQCCBVMB-LBPRGKRZSA-N 1 2 302.443 4.188 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccc(Cl)c(F)c1 ZINC000152321772 334959149 /nfs/dbraw/zinc/95/91/49/334959149.db2.gz ABMIAPAIMNXSNZ-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO C[C@H](CCNC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1)CC(C)(C)C ZINC000190980265 334964903 /nfs/dbraw/zinc/96/49/03/334964903.db2.gz NZSHLPKRNNAZKX-HUUCEWRRSA-N 1 2 320.481 4.109 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc2ccccc2s1)c1nc(C)cs1 ZINC000072864756 191245032 /nfs/dbraw/zinc/24/50/32/191245032.db2.gz GXXZDYDFOQJIHX-MRXNPFEDSA-N 1 2 317.483 4.476 20 0 DIADLO CC(C)c1nnc(C[N@H+](C)C2c3ccccc3-c3ccccc32)o1 ZINC000081596747 192299522 /nfs/dbraw/zinc/29/95/22/192299522.db2.gz YVQYAQOBYXZEMN-UHFFFAOYSA-N 1 2 319.408 4.395 20 0 DIADLO CC(C)c1nnc(C[N@@H+](C)C2c3ccccc3-c3ccccc32)o1 ZINC000081596747 192299524 /nfs/dbraw/zinc/29/95/24/192299524.db2.gz YVQYAQOBYXZEMN-UHFFFAOYSA-N 1 2 319.408 4.395 20 0 DIADLO CCCOc1cccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000236881666 202050279 /nfs/dbraw/zinc/05/02/79/202050279.db2.gz KTCVTAHEPPIOGY-ZDUSSCGKSA-N 1 2 317.433 4.007 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nccs2)c(OC(C)(C)C)c1 ZINC000091734858 193098672 /nfs/dbraw/zinc/09/86/72/193098672.db2.gz HUQGQKAZEWYFKW-ZDUSSCGKSA-N 1 2 304.459 4.480 20 0 DIADLO C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]C1(C(F)F)CC1 ZINC000563764298 335002548 /nfs/dbraw/zinc/00/25/48/335002548.db2.gz AGILITUQGPEJDY-JXMROGBWSA-N 1 2 305.290 4.496 20 0 DIADLO Cc1cccc(Oc2ccccc2C(=O)N[C@H](C)c2[nH]cc[nH+]2)c1 ZINC000563780625 335006524 /nfs/dbraw/zinc/00/65/24/335006524.db2.gz KSNMRTFBMMHHJR-CQSZACIVSA-N 1 2 321.380 4.001 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@H]2c2ccccc2Cl)c(C)[nH+]1 ZINC000097214013 193692771 /nfs/dbraw/zinc/69/27/71/193692771.db2.gz QHAHXXZHHMDYKP-LSDHHAIUSA-N 1 2 314.816 4.402 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccccc2s1)c1ccc(F)cc1F ZINC000015484032 182004932 /nfs/dbraw/zinc/00/49/32/182004932.db2.gz OTBAPLUZBGMDQW-SNVBAGLBSA-N 1 2 304.365 4.425 20 0 DIADLO Cc1cccc2[nH+]c(CSc3cccc4cccnc43)cn21 ZINC000015906839 182023958 /nfs/dbraw/zinc/02/39/58/182023958.db2.gz GTDIXKBXTRWJOH-UHFFFAOYSA-N 1 2 305.406 4.483 20 0 DIADLO Cc1ccc(NCc2cn3ccccc3[nH+]2)c(Br)c1 ZINC000020039942 182183021 /nfs/dbraw/zinc/18/30/21/182183021.db2.gz PIBZVEOYYZPFOF-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO C[C@@H](Cc1nc2ccccc2s1)Nc1cc[nH+]c(C2CC2)n1 ZINC000135508759 335036404 /nfs/dbraw/zinc/03/64/04/335036404.db2.gz XXIGUXQCLJCYHK-NSHDSACASA-N 1 2 310.426 4.007 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H]2CCSc3ccc(F)cc32)cs1 ZINC000036968755 182856638 /nfs/dbraw/zinc/85/66/38/182856638.db2.gz LSPUHHRZTKUSMD-RNCFNFMXSA-N 1 2 308.447 4.478 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccc(F)cc1)C1CCC1)c1nc(C2CC2)no1 ZINC000104706362 194029524 /nfs/dbraw/zinc/02/95/24/194029524.db2.gz FGHOJYMNMYNUCQ-MEDUHNTESA-N 1 2 315.392 4.278 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](c2ccc(F)cc2)C2CCC2)n1 ZINC000104703763 194028902 /nfs/dbraw/zinc/02/89/02/194028902.db2.gz PDRVDDDURZTVGL-SFHVURJKSA-N 1 2 317.408 4.182 20 0 DIADLO Cc1ccc(NC(=O)N[C@H](C)c2ccc(F)cc2Cl)c(C)[nH+]1 ZINC000152390184 335043660 /nfs/dbraw/zinc/04/36/60/335043660.db2.gz LQANSDZAAVIHNA-SNVBAGLBSA-N 1 2 321.783 4.374 20 0 DIADLO C[C@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1cccc(Cl)c1 ZINC000271481525 129921485 /nfs/dbraw/zinc/92/14/85/129921485.db2.gz NJUDGQSTPYYJHZ-ZUZCIYMTSA-N 1 2 311.759 4.002 20 0 DIADLO CC[C@@H](C)[C@H](C)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000272539349 130038919 /nfs/dbraw/zinc/03/89/19/130038919.db2.gz KXSNTJPVAIICAT-CABCVRRESA-N 1 2 323.440 4.223 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H]2CCCOc3c(F)cccc32)cs1 ZINC000272672237 130051781 /nfs/dbraw/zinc/05/17/81/130051781.db2.gz TZJMVVMAYQSGIL-IINYFYTJSA-N 1 2 306.406 4.155 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2ccc(SC(C)C)cc2)s1 ZINC000273010572 130081662 /nfs/dbraw/zinc/08/16/62/130081662.db2.gz AXVNLDSNOLVJKJ-GFCCVEGCSA-N 1 2 321.515 4.452 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+](C)Cc2csc3ccccc23)s1 ZINC000273177106 130095074 /nfs/dbraw/zinc/09/50/74/130095074.db2.gz HQIGOSYWXXHDDH-SNVBAGLBSA-N 1 2 303.456 4.254 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+](C)Cc2csc3ccccc23)s1 ZINC000273177106 130095077 /nfs/dbraw/zinc/09/50/77/130095077.db2.gz HQIGOSYWXXHDDH-SNVBAGLBSA-N 1 2 303.456 4.254 20 0 DIADLO Cc1nnc([C@H](C)[N@H+](C)Cc2ccc(Cl)c(Cl)c2)s1 ZINC000273202634 130097723 /nfs/dbraw/zinc/09/77/23/130097723.db2.gz RVIWLZRILCDIPC-QMMMGPOBSA-N 1 2 316.257 4.346 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)s1 ZINC000273202634 130097724 /nfs/dbraw/zinc/09/77/24/130097724.db2.gz RVIWLZRILCDIPC-QMMMGPOBSA-N 1 2 316.257 4.346 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1nc(Cl)ccc1Cl ZINC000273217146 130099232 /nfs/dbraw/zinc/09/92/32/130099232.db2.gz YFLZMBMSCXTWMR-SNVBAGLBSA-N 1 2 311.212 4.287 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1nc(Cl)ccc1Cl ZINC000273217146 130099233 /nfs/dbraw/zinc/09/92/33/130099233.db2.gz YFLZMBMSCXTWMR-SNVBAGLBSA-N 1 2 311.212 4.287 20 0 DIADLO Fc1ccc([C@@H]2C[C@@H](Nc3cc[nH+]c4ccncc34)CCO2)cc1 ZINC000273274545 130102086 /nfs/dbraw/zinc/10/20/86/130102086.db2.gz IBNOKSNBFAQWDL-KXBFYZLASA-N 1 2 323.371 4.101 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@@H](C)c2ncc(-c3ccccc3)o2)s1 ZINC000273283755 130102987 /nfs/dbraw/zinc/10/29/87/130102987.db2.gz JBQPCIIIIFYWHO-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO Fc1ccc(C[N@@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)cc1 ZINC000273371634 130112387 /nfs/dbraw/zinc/11/23/87/130112387.db2.gz PWSLPDKRQZWQNT-MRXNPFEDSA-N 1 2 315.392 4.203 20 0 DIADLO Fc1ccc(C[N@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)cc1 ZINC000273371634 130112389 /nfs/dbraw/zinc/11/23/89/130112389.db2.gz PWSLPDKRQZWQNT-MRXNPFEDSA-N 1 2 315.392 4.203 20 0 DIADLO CC[C@H]([NH2+]Cc1occc1C(=O)OC)c1ccc(Cl)s1 ZINC000273481847 130126323 /nfs/dbraw/zinc/12/63/23/130126323.db2.gz IJBOXUOTKMUGFN-JTQLQIEISA-N 1 2 313.806 4.022 20 0 DIADLO Cc1ccsc1[C@H]1C[C@H]1c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000273977428 130194153 /nfs/dbraw/zinc/19/41/53/130194153.db2.gz QZWWTZCBEZYHIR-UONOGXRCSA-N 1 2 311.410 4.005 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nnc(C)s1)c1cccc(Cl)c1F ZINC000274029132 130199594 /nfs/dbraw/zinc/19/95/94/130199594.db2.gz GWDBQAYEIRAYLD-QPUJVOFHSA-N 1 2 313.829 4.441 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2sc(C(C)C)nc2C)s1 ZINC000274146793 130210917 /nfs/dbraw/zinc/21/09/17/130210917.db2.gz DVPBUJHFPKAFEW-WPRPVWTQSA-N 1 2 310.492 4.147 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cncc(F)c1)c1nc(C(F)(F)F)cs1 ZINC000274409671 130232503 /nfs/dbraw/zinc/23/25/03/130232503.db2.gz RPYJLCAOQAYJFV-YUMQZZPRSA-N 1 2 319.327 4.108 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2CCc3c2cccc3O)cs1 ZINC000274433858 130234074 /nfs/dbraw/zinc/23/40/74/130234074.db2.gz KLWYUFMAAUVPOV-FZMZJTMJSA-N 1 2 302.443 4.310 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1cn(C)nc1C(F)F ZINC000274462950 130237395 /nfs/dbraw/zinc/23/73/95/130237395.db2.gz HVWBJNPWLZLPDG-SNVBAGLBSA-N 1 2 313.779 4.204 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1cn(C)nc1C(F)F ZINC000274462950 130237396 /nfs/dbraw/zinc/23/73/96/130237396.db2.gz HVWBJNPWLZLPDG-SNVBAGLBSA-N 1 2 313.779 4.204 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)sc1C ZINC000274554369 130244259 /nfs/dbraw/zinc/24/42/59/130244259.db2.gz FAWPJDPAZJOTQU-ZETCQYMHSA-N 1 2 321.393 4.086 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cccc1F)c1nc(C(F)(F)F)cs1 ZINC000274577491 130245921 /nfs/dbraw/zinc/24/59/21/130245921.db2.gz IIFHCYTWIHHGNY-SSDOTTSWSA-N 1 2 322.302 4.291 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3cncc(C)c3)co2)cc1 ZINC000274635829 130250765 /nfs/dbraw/zinc/25/07/65/130250765.db2.gz SJAPROXJWJIBQB-OAHLLOKOSA-N 1 2 307.397 4.204 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1cncc(F)c1 ZINC000274847200 130267220 /nfs/dbraw/zinc/26/72/20/130267220.db2.gz LUJLJOPHNVTPRP-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cncc(F)c1 ZINC000274847200 130267222 /nfs/dbraw/zinc/26/72/22/130267222.db2.gz LUJLJOPHNVTPRP-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[NH+]1CCC(C(=O)C(F)(F)F)CC1 ZINC000275010330 130282231 /nfs/dbraw/zinc/28/22/31/130282231.db2.gz RHLQFVWUCRXQDO-JTQLQIEISA-N 1 2 319.754 4.244 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1cc(C)n(C)n1 ZINC000282121653 130902317 /nfs/dbraw/zinc/90/23/17/130902317.db2.gz JONYAOQYOHZHAW-CVEARBPZSA-N 1 2 315.461 4.065 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)[C@H](C)c1nnc(C)s1 ZINC000283662374 131011428 /nfs/dbraw/zinc/01/14/28/131011428.db2.gz URRYYVVVMKDXHZ-LLVKDONJSA-N 1 2 315.442 4.348 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)[C@H](C)c1nnc(C)s1 ZINC000283662374 131011430 /nfs/dbraw/zinc/01/14/30/131011430.db2.gz URRYYVVVMKDXHZ-LLVKDONJSA-N 1 2 315.442 4.348 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@@H](c3ccccc3F)C2)c(C)s1 ZINC000340187133 131033535 /nfs/dbraw/zinc/03/35/35/131033535.db2.gz YMPAXGQCHYUFGP-QGZVFWFLSA-N 1 2 305.418 4.078 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@@H](c3ccccc3F)C2)c(C)s1 ZINC000340187133 131033536 /nfs/dbraw/zinc/03/35/36/131033536.db2.gz YMPAXGQCHYUFGP-QGZVFWFLSA-N 1 2 305.418 4.078 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(OCC3CC3)c(F)c2)no1 ZINC000284023623 131041536 /nfs/dbraw/zinc/04/15/36/131041536.db2.gz IWSCGOIWCWNECI-STQMWFEESA-N 1 2 318.392 4.323 20 0 DIADLO C[N@H+](CCSC(C)(C)C)Cc1nc(C(F)(F)F)cs1 ZINC000284356237 131073596 /nfs/dbraw/zinc/07/35/96/131073596.db2.gz KLHRXJAIMDAUFH-UHFFFAOYSA-N 1 2 312.426 4.125 20 0 DIADLO C[N@@H+](CCSC(C)(C)C)Cc1nc(C(F)(F)F)cs1 ZINC000284356237 131073598 /nfs/dbraw/zinc/07/35/98/131073598.db2.gz KLHRXJAIMDAUFH-UHFFFAOYSA-N 1 2 312.426 4.125 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](CC(F)(F)F)c2ccc(F)cc2)no1 ZINC000284882072 131119434 /nfs/dbraw/zinc/11/94/34/131119434.db2.gz BJQQTCZVQPCHQS-YGRLFVJLSA-N 1 2 316.298 4.466 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)no1 ZINC000284952359 131125676 /nfs/dbraw/zinc/12/56/76/131125676.db2.gz FDVSMKVLEDYPCJ-SMDDNHRTSA-N 1 2 306.793 4.201 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1csc(-c2ccco2)n1 ZINC000285427329 131167670 /nfs/dbraw/zinc/16/76/70/131167670.db2.gz HDGMNKUVKFXABU-UHFFFAOYSA-N 1 2 317.414 4.033 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H](C)c1c(F)cncc1F ZINC000285836016 131204991 /nfs/dbraw/zinc/20/49/91/131204991.db2.gz YCMXMUTWNIZAMZ-NEPJUHHUSA-N 1 2 306.356 4.089 20 0 DIADLO COc1ccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)cc1OC ZINC000285897730 131208281 /nfs/dbraw/zinc/20/82/81/131208281.db2.gz BDWOFUDTCUSJHB-KRWDZBQOSA-N 1 2 315.417 4.160 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)c1sccc1F ZINC000340217328 131209170 /nfs/dbraw/zinc/20/91/70/131209170.db2.gz GLNRNVADPSUDBT-UHFFFAOYSA-N 1 2 314.341 4.327 20 0 DIADLO CC(=O)Nc1cccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000286322528 131230868 /nfs/dbraw/zinc/23/08/68/131230868.db2.gz YAHYIGVUSNOXQS-QGZVFWFLSA-N 1 2 312.417 4.102 20 0 DIADLO CC(C)c1nn(C)cc1N[C@@H](c1[nH]cc[nH+]1)C1CCCCC1 ZINC000286366626 131232912 /nfs/dbraw/zinc/23/29/12/131232912.db2.gz AAXAZSUQGFQFIY-MRXNPFEDSA-N 1 2 301.438 4.000 20 0 DIADLO Cc1ccncc1C[N@H+](C)Cc1csc(-c2ccccc2)n1 ZINC000340232730 131241179 /nfs/dbraw/zinc/24/11/79/131241179.db2.gz WUYYGFNJFMDWPS-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1ccncc1C[N@@H+](C)Cc1csc(-c2ccccc2)n1 ZINC000340232730 131241180 /nfs/dbraw/zinc/24/11/80/131241180.db2.gz WUYYGFNJFMDWPS-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+]Cc2ccsc2Br)c1 ZINC000287314185 131274324 /nfs/dbraw/zinc/27/43/24/131274324.db2.gz FELQYKXSCAABSQ-SNVBAGLBSA-N 1 2 311.248 4.065 20 0 DIADLO c1csc(C[N@@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)c1 ZINC000287435430 131280560 /nfs/dbraw/zinc/28/05/60/131280560.db2.gz PUBNRVWSOPFMNQ-CQSZACIVSA-N 1 2 303.431 4.126 20 0 DIADLO c1csc(C[N@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)c1 ZINC000287435430 131280563 /nfs/dbraw/zinc/28/05/63/131280563.db2.gz PUBNRVWSOPFMNQ-CQSZACIVSA-N 1 2 303.431 4.126 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000287457828 131281391 /nfs/dbraw/zinc/28/13/91/131281391.db2.gz IMBKIVROQGOOHE-LSDHHAIUSA-N 1 2 315.804 4.029 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NC[C@H](C)Sc1ccccc1 ZINC000287492775 131283016 /nfs/dbraw/zinc/28/30/16/131283016.db2.gz KYGGDPKUZIMGHN-ZDUSSCGKSA-N 1 2 315.442 4.001 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](C)c1ccc(Cl)cc1 ZINC000287536291 131286281 /nfs/dbraw/zinc/28/62/81/131286281.db2.gz NYIVVKHPQAROMR-NSHDSACASA-N 1 2 303.793 4.235 20 0 DIADLO Cc1ccc([C@@H]2CCN(C(=O)Nc3c(C)cc[nH+]c3C)C2)c(C)c1 ZINC000287631257 131291457 /nfs/dbraw/zinc/29/14/57/131291457.db2.gz UYBNVBUTMWYIKV-QGZVFWFLSA-N 1 2 323.440 4.337 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1csc(C)n1)c1cccc(Cl)c1 ZINC000288581277 131331590 /nfs/dbraw/zinc/33/15/90/131331590.db2.gz AANDOLMSNKQFJQ-IINYFYTJSA-N 1 2 310.850 4.143 20 0 DIADLO CCCc1nc(C[NH2+][C@H](COC)c2cccc(Cl)c2)cs1 ZINC000288642081 131334290 /nfs/dbraw/zinc/33/42/90/131334290.db2.gz AQVFZSQWHWLDNV-OAHLLOKOSA-N 1 2 324.877 4.226 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1cnc([C@H](C)O)s1 ZINC000288952735 131347711 /nfs/dbraw/zinc/34/77/11/131347711.db2.gz AGOYBOIHJSWVSC-MNOVXSKESA-N 1 2 310.850 4.043 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1cnc([C@H](C)O)s1 ZINC000288952735 131347713 /nfs/dbraw/zinc/34/77/13/131347713.db2.gz AGOYBOIHJSWVSC-MNOVXSKESA-N 1 2 310.850 4.043 20 0 DIADLO CCOc1cccc([C@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)c1 ZINC000289283143 131371051 /nfs/dbraw/zinc/37/10/51/131371051.db2.gz ACYVVXFIKBCOQT-ZDUSSCGKSA-N 1 2 302.418 4.222 20 0 DIADLO CCc1nnc(C[N@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)o1 ZINC000291259334 131555795 /nfs/dbraw/zinc/55/57/95/131555795.db2.gz WTXVSFCRHTYBHQ-INIZCTEOSA-N 1 2 321.424 4.395 20 0 DIADLO CCc1nnc(C[N@@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)o1 ZINC000291259334 131555797 /nfs/dbraw/zinc/55/57/97/131555797.db2.gz WTXVSFCRHTYBHQ-INIZCTEOSA-N 1 2 321.424 4.395 20 0 DIADLO C[C@H](c1cccs1)[N@H+](Cc1cnns1)Cc1ccccc1 ZINC000297313967 132009627 /nfs/dbraw/zinc/00/96/27/132009627.db2.gz ZGSZYXAJAUJRQF-CYBMUJFWSA-N 1 2 315.467 4.363 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](Cc1cnns1)Cc1ccccc1 ZINC000297313967 132009629 /nfs/dbraw/zinc/00/96/29/132009629.db2.gz ZGSZYXAJAUJRQF-CYBMUJFWSA-N 1 2 315.467 4.363 20 0 DIADLO Clc1cccc(Cl)c1[C@@H]([NH2+][C@@H]1CCn2ccnc21)C1CC1 ZINC000297357395 132011901 /nfs/dbraw/zinc/01/19/01/132011901.db2.gz POYCNSLIHJJCEB-HIFRSBDPSA-N 1 2 322.239 4.376 20 0 DIADLO O=C(Nc1ccc2c(c1)CCCC2)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000297449632 132016680 /nfs/dbraw/zinc/01/66/80/132016680.db2.gz QIHDASJLSVVACV-KRWDZBQOSA-N 1 2 324.428 4.048 20 0 DIADLO Fc1cnc(Cl)c(C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)c1 ZINC000297451338 132016693 /nfs/dbraw/zinc/01/66/93/132016693.db2.gz WZMFYMOCUDRDCK-AWEZNQCLSA-N 1 2 322.815 4.008 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@H]1CCC[C@H]1c1ccccc1 ZINC000297552321 132022713 /nfs/dbraw/zinc/02/27/13/132022713.db2.gz ZSPYVMLHLWDBKP-ROUUACIJSA-N 1 2 323.440 4.498 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@@H]1C[C@H](C)n2ccnc21 ZINC000297646126 132027086 /nfs/dbraw/zinc/02/70/86/132027086.db2.gz JZHGSLQIHXPTRS-YQQAZPJKSA-N 1 2 313.445 4.164 20 0 DIADLO Cc1cc(NC(=O)N2CC3(CCC3)[C@H]2c2ccccc2)cc[nH+]1 ZINC000297673194 132028382 /nfs/dbraw/zinc/02/83/82/132028382.db2.gz GFWGLAQGJRCZNO-QGZVFWFLSA-N 1 2 307.397 4.149 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C1CC[NH+](CC(F)F)CC1 ZINC000297847250 132036709 /nfs/dbraw/zinc/03/67/09/132036709.db2.gz METCTLJLDZDNOW-UHFFFAOYSA-N 1 2 324.415 4.034 20 0 DIADLO COCc1cc(C[NH+](Cc2ccccc2)Cc2ccccc2)no1 ZINC000297983281 132043536 /nfs/dbraw/zinc/04/35/36/132043536.db2.gz YHBVDBUCFQZPGP-UHFFFAOYSA-N 1 2 322.408 4.023 20 0 DIADLO CC(C)CC[C@@H]1CCC[C@@H]1[NH2+]Cc1nc(=O)c2sccc2[nH]1 ZINC000298480983 132065577 /nfs/dbraw/zinc/06/55/77/132065577.db2.gz JEIOWHIYUUAAHO-STQMWFEESA-N 1 2 319.474 4.091 20 0 DIADLO Cc1cc(-c2noc([C@H](C)[NH2+]Cc3cccs3)n2)ccc1F ZINC000298872482 132081413 /nfs/dbraw/zinc/08/14/13/132081413.db2.gz LEPQXCNOGIHDFR-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)no1 ZINC000299040315 132087085 /nfs/dbraw/zinc/08/70/85/132087085.db2.gz CAMKNABULXVGHJ-OAHLLOKOSA-N 1 2 305.397 4.209 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)oc1C ZINC000299122641 132089775 /nfs/dbraw/zinc/08/97/75/132089775.db2.gz HEHYJYJRCDSSCP-BZNIZROVSA-N 1 2 300.402 4.172 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)oc1C ZINC000299122641 132089776 /nfs/dbraw/zinc/08/97/76/132089776.db2.gz HEHYJYJRCDSSCP-BZNIZROVSA-N 1 2 300.402 4.172 20 0 DIADLO CCC[N@H+](Cc1nccn1C(F)F)[C@@H](C)c1ccccc1OC ZINC000299408162 132103684 /nfs/dbraw/zinc/10/36/84/132103684.db2.gz OCBCMOGRFKUACX-ZDUSSCGKSA-N 1 2 323.387 4.260 20 0 DIADLO CCC[N@@H+](Cc1nccn1C(F)F)[C@@H](C)c1ccccc1OC ZINC000299408162 132103686 /nfs/dbraw/zinc/10/36/86/132103686.db2.gz OCBCMOGRFKUACX-ZDUSSCGKSA-N 1 2 323.387 4.260 20 0 DIADLO C[C@H](c1nc2ccccc2n1C(F)F)[N@H+](C)Cc1cccnc1 ZINC000299732758 132116426 /nfs/dbraw/zinc/11/64/26/132116426.db2.gz XYTGBSBLRYWEBV-GFCCVEGCSA-N 1 2 316.355 4.019 20 0 DIADLO C[C@H](c1nc2ccccc2n1C(F)F)[N@@H+](C)Cc1cccnc1 ZINC000299732758 132116427 /nfs/dbraw/zinc/11/64/27/132116427.db2.gz XYTGBSBLRYWEBV-GFCCVEGCSA-N 1 2 316.355 4.019 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)OC2CCCCCC2)c(C)[nH+]1 ZINC000119629334 132134714 /nfs/dbraw/zinc/13/47/14/132134714.db2.gz OPUPUWVAPLTDEI-OAHLLOKOSA-N 1 2 304.434 4.073 20 0 DIADLO Cc1cnc(C[N@@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)nc1 ZINC000340684545 132150244 /nfs/dbraw/zinc/15/02/44/132150244.db2.gz LOPQMVHBVHLCKA-LLVKDONJSA-N 1 2 310.228 4.285 20 0 DIADLO Cc1cnc(C[N@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)nc1 ZINC000340684545 132150245 /nfs/dbraw/zinc/15/02/45/132150245.db2.gz LOPQMVHBVHLCKA-LLVKDONJSA-N 1 2 310.228 4.285 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)c1nc2ccccc2n1C ZINC000121494787 132156337 /nfs/dbraw/zinc/15/63/37/132156337.db2.gz QXGLIHKIQNAFHZ-VXGBXAGGSA-N 1 2 315.367 4.263 20 0 DIADLO Cc1nc(C[NH+]2CCC(=Cc3ccccc3F)CC2)cs1 ZINC000340691978 132159149 /nfs/dbraw/zinc/15/91/49/132159149.db2.gz OSPOBNOKRCQCBA-UHFFFAOYSA-N 1 2 302.418 4.270 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2ccc3nc(C)sc3c2)cs1 ZINC000426047630 335084935 /nfs/dbraw/zinc/08/49/35/335084935.db2.gz RQXFVJZBZXURKY-UHFFFAOYSA-N 1 2 303.456 4.002 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2ccc3nc(C)sc3c2)cs1 ZINC000426047630 335084936 /nfs/dbraw/zinc/08/49/36/335084936.db2.gz RQXFVJZBZXURKY-UHFFFAOYSA-N 1 2 303.456 4.002 20 0 DIADLO COC[C@H](C)CNc1ccc(SCc2ccccc2)c[nH+]1 ZINC000525863867 435009130 /nfs/dbraw/zinc/00/91/30/435009130.db2.gz ZIAKWSIPFLGDMF-CQSZACIVSA-N 1 2 302.443 4.068 20 0 DIADLO Cn1c2ccccc2[nH+]c1N[C@H]1CCCOc2ccc(F)cc21 ZINC000534244158 435273844 /nfs/dbraw/zinc/27/38/44/435273844.db2.gz PSQNEVNBFFEWBQ-AWEZNQCLSA-N 1 2 311.360 4.038 20 0 DIADLO Cc1cc(N2CCCC23CCCCC3)nc(-c2ccncc2)[nH+]1 ZINC000533909858 332894882 /nfs/dbraw/zinc/89/48/82/332894882.db2.gz PAQGIMZNFKEMRS-UHFFFAOYSA-N 1 2 308.429 4.150 20 0 DIADLO CC(C)n1cc[nH+]c1CN(C)Cc1cccc(Cl)c1Cl ZINC000170957746 332908371 /nfs/dbraw/zinc/90/83/71/332908371.db2.gz BEVWWXVNLJDHQZ-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC[C@@](C)([NH2+]CC[C@H](C)OCc1ccccc1)C(F)(F)F ZINC000530442143 331482713 /nfs/dbraw/zinc/48/27/13/331482713.db2.gz QLFJMERYWJGCKR-DZGCQCFKSA-N 1 2 303.368 4.302 20 0 DIADLO c1c[nH]c(C[NH2+][C@@H](c2ccccc2)c2ccc3ccccc3c2)n1 ZINC000109350074 331544227 /nfs/dbraw/zinc/54/42/27/331544227.db2.gz OMMHWCASYTUITP-NRFANRHFSA-N 1 2 313.404 4.442 20 0 DIADLO CC(C)c1cnc(NCc2cn3cc(Cl)ccc3[nH+]2)s1 ZINC000180010520 331555326 /nfs/dbraw/zinc/55/53/26/331555326.db2.gz QCJNYYMBJKFUCQ-UHFFFAOYSA-N 1 2 306.822 4.180 20 0 DIADLO Cc1ccc(NC(=O)Cc2cc(Cl)ccc2Cl)c(C)[nH+]1 ZINC000176193222 332927873 /nfs/dbraw/zinc/92/78/73/332927873.db2.gz VRDOTQFLYKGESW-UHFFFAOYSA-N 1 2 309.196 4.186 20 0 DIADLO Cc1nccnc1[C@H](C)[NH2+]Cc1cc(Cl)sc1Cl ZINC000312751111 331727370 /nfs/dbraw/zinc/72/73/70/331727370.db2.gz WBFHONWKPFOWHJ-QMMMGPOBSA-N 1 2 302.230 4.004 20 0 DIADLO CCc1cccc(NC(=O)C[C@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000557433015 331789991 /nfs/dbraw/zinc/78/99/91/331789991.db2.gz LZEXTAVITSQOGW-SFHVURJKSA-N 1 2 319.408 4.133 20 0 DIADLO Clc1cccc2c(N3CC[C@H](C4CCOCC4)C3)cc[nH+]c12 ZINC000557643963 331805485 /nfs/dbraw/zinc/80/54/85/331805485.db2.gz MOVQNSBZPNZSMG-AWEZNQCLSA-N 1 2 316.832 4.141 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCN(c3cccc[nH+]3)C2)c1 ZINC000557682463 331808384 /nfs/dbraw/zinc/80/83/84/331808384.db2.gz MFBJTMWKVBGEIN-AWEZNQCLSA-N 1 2 306.331 4.484 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1ncc(C(F)(F)F)s1)CC2 ZINC000521169795 331818888 /nfs/dbraw/zinc/81/88/88/331818888.db2.gz CDQIZMMEPWUEOI-LLVKDONJSA-N 1 2 316.323 4.078 20 0 DIADLO c1c(-c2ccc(N[C@@H]3CCC[C@H]4C[C@H]43)cc2)[nH+]c2n1CCCC2 ZINC000558699331 331936857 /nfs/dbraw/zinc/93/68/57/331936857.db2.gz KUDGUFZJPADNQV-CGTJXYLNSA-N 1 2 307.441 4.487 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@H](c2ccco2)c2ccccc2)c1 ZINC000559234263 331997858 /nfs/dbraw/zinc/99/78/58/331997858.db2.gz LGKNOYAZHCNLAX-IBGZPJMESA-N 1 2 311.356 4.307 20 0 DIADLO CC(F)(F)C[NH2+]Cc1cccc(OCc2ccccc2F)c1 ZINC000559323355 332025448 /nfs/dbraw/zinc/02/54/48/332025448.db2.gz DXDCTEVBYAWHML-UHFFFAOYSA-N 1 2 309.331 4.150 20 0 DIADLO CC(F)(F)C[NH2+]Cc1cccc(OCc2ccc(F)cc2)c1 ZINC000559325089 332026133 /nfs/dbraw/zinc/02/61/33/332026133.db2.gz JXSHQWIKGXHRFE-UHFFFAOYSA-N 1 2 309.331 4.150 20 0 DIADLO Cc1ccccc1[C@]1(F)CCN(c2cc[nH+]c3ccncc32)C1 ZINC000409664339 332044643 /nfs/dbraw/zinc/04/46/43/332044643.db2.gz WSOPYWXSIOTFKP-IBGZPJMESA-N 1 2 307.372 4.013 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3ccccc3OC)cc2[nH+]1 ZINC000409719110 332049596 /nfs/dbraw/zinc/04/95/96/332049596.db2.gz ITPYXEKSZHZJDS-UHFFFAOYSA-N 1 2 323.396 4.166 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(COc3ccc(Cl)cc3)n2)[C@@H]1C ZINC000559351135 332059922 /nfs/dbraw/zinc/05/99/22/332059922.db2.gz ZBSBBIPQXYJOFO-VXGBXAGGSA-N 1 2 322.861 4.216 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(COc3ccc(Cl)cc3)n2)[C@@H]1C ZINC000559351135 332059924 /nfs/dbraw/zinc/05/99/24/332059924.db2.gz ZBSBBIPQXYJOFO-VXGBXAGGSA-N 1 2 322.861 4.216 20 0 DIADLO CC[C@@H]([NH2+]Cc1cnc(CCc2ccccc2)s1)C(F)F ZINC000449362335 332073656 /nfs/dbraw/zinc/07/36/56/332073656.db2.gz MRCUPZBHWFGKQG-CQSZACIVSA-N 1 2 310.413 4.062 20 0 DIADLO COc1cccc(C[N@@H+]2CCC[C@@H]2c2nc3ccc(C)cc3[nH]2)c1 ZINC000569391413 332074495 /nfs/dbraw/zinc/07/44/95/332074495.db2.gz LMARVLXZQUVKRD-LJQANCHMSA-N 1 2 321.424 4.217 20 0 DIADLO COc1cccc(C[N@H+]2CCC[C@@H]2c2nc3ccc(C)cc3[nH]2)c1 ZINC000569391413 332074497 /nfs/dbraw/zinc/07/44/97/332074497.db2.gz LMARVLXZQUVKRD-LJQANCHMSA-N 1 2 321.424 4.217 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(C(F)(F)F)s2)[C@@H]1[C@H]1CCCO1 ZINC000569399043 332074629 /nfs/dbraw/zinc/07/46/29/332074629.db2.gz AWYAYABGSDAMGA-DGCLKSJQSA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(C(F)(F)F)s2)[C@@H]1[C@H]1CCCO1 ZINC000569399043 332074630 /nfs/dbraw/zinc/07/46/30/332074630.db2.gz AWYAYABGSDAMGA-DGCLKSJQSA-N 1 2 319.392 4.156 20 0 DIADLO FC(F)(F)c1ccc(-c2nc(C[NH+]3CC4(CC4)C3)cs2)cc1 ZINC000449370849 332083762 /nfs/dbraw/zinc/08/37/62/332083762.db2.gz NQAFNGXLJIMNMB-UHFFFAOYSA-N 1 2 324.371 4.425 20 0 DIADLO c1ccc2cc(C[N@@H+](Cc3nnc(C4CC4)o3)C3CC3)ccc2c1 ZINC000518594643 332089521 /nfs/dbraw/zinc/08/95/21/332089521.db2.gz UHRMCFJZNIIOQW-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO c1ccc2cc(C[N@H+](Cc3nnc(C4CC4)o3)C3CC3)ccc2c1 ZINC000518594643 332089522 /nfs/dbraw/zinc/08/95/22/332089522.db2.gz UHRMCFJZNIIOQW-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1cc(C(C)(C)C)on1 ZINC000518621439 332099114 /nfs/dbraw/zinc/09/91/14/332099114.db2.gz RUZXGUOKDKEKBT-UHFFFAOYSA-N 1 2 302.418 4.006 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)Cc2ccc(C)c(C)c2)cs1 ZINC000093737501 332141929 /nfs/dbraw/zinc/14/19/29/332141929.db2.gz ZREZHXQPSVXICM-HNNXBMFYSA-N 1 2 318.486 4.489 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)Cc2ccc(C)c(C)c2)cs1 ZINC000093737501 332141931 /nfs/dbraw/zinc/14/19/31/332141931.db2.gz ZREZHXQPSVXICM-HNNXBMFYSA-N 1 2 318.486 4.489 20 0 DIADLO CCCc1csc(C[N@@H+]2CCCC[C@H]2c2cccn2C)n1 ZINC000426421453 332149750 /nfs/dbraw/zinc/14/97/50/332149750.db2.gz QBFKOUWPODHROJ-INIZCTEOSA-N 1 2 303.475 4.161 20 0 DIADLO CCCc1csc(C[N@H+]2CCCC[C@H]2c2cccn2C)n1 ZINC000426421453 332149751 /nfs/dbraw/zinc/14/97/51/332149751.db2.gz QBFKOUWPODHROJ-INIZCTEOSA-N 1 2 303.475 4.161 20 0 DIADLO CC[C@H](CC(C)C)C(=O)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000410538059 332150128 /nfs/dbraw/zinc/15/01/28/332150128.db2.gz ACAVXPLEBBXNFC-CQSZACIVSA-N 1 2 317.408 4.154 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2ccco2)cc1F)c1nccs1 ZINC000448020964 332179197 /nfs/dbraw/zinc/17/91/97/332179197.db2.gz FYJJYONLOZYSLO-LLVKDONJSA-N 1 2 302.374 4.393 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H](C)c2ccccc2F)[nH+]1 ZINC000427183273 332182264 /nfs/dbraw/zinc/18/22/64/332182264.db2.gz CNXRPQYXMKKJBA-ZDUSSCGKSA-N 1 2 323.371 4.266 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000181233805 332186798 /nfs/dbraw/zinc/18/67/98/332186798.db2.gz JADCTPIKJQUCDK-SNVBAGLBSA-N 1 2 320.314 4.438 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000181233805 332186800 /nfs/dbraw/zinc/18/68/00/332186800.db2.gz JADCTPIKJQUCDK-SNVBAGLBSA-N 1 2 320.314 4.438 20 0 DIADLO Cc1nccnc1[C@H](C)[NH2+]Cc1ccc(-c2ccco2)cc1F ZINC000448022182 332187854 /nfs/dbraw/zinc/18/78/54/332187854.db2.gz MVLCLOMEZNAPIX-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1cc(NC(=O)CSc2ccc3ccccc3c2)cc[nH+]1 ZINC000215618565 332192828 /nfs/dbraw/zinc/19/28/28/332192828.db2.gz QCGSZNHRPUVIJJ-UHFFFAOYSA-N 1 2 308.406 4.274 20 0 DIADLO Cc1ncc(C[NH2+]Cc2csc(-c3ccc(F)cc3)n2)s1 ZINC000040997638 332208112 /nfs/dbraw/zinc/20/81/12/332208112.db2.gz SMNPICJTIZTPGJ-UHFFFAOYSA-N 1 2 319.430 4.004 20 0 DIADLO CC(=O)c1c(F)cccc1N1CCC(c2ccc(C)[nH+]c2)CC1 ZINC000363678149 332217810 /nfs/dbraw/zinc/21/78/10/332217810.db2.gz ZYWUOSYMIOKJKR-UHFFFAOYSA-N 1 2 312.388 4.116 20 0 DIADLO CCCC[N@@H+](Cc1ccccc1Cl)Cc1ncc(C)cn1 ZINC000536367199 332233319 /nfs/dbraw/zinc/23/33/19/332233319.db2.gz SFUMDSWLJOTBMR-UHFFFAOYSA-N 1 2 303.837 4.241 20 0 DIADLO CCCC[N@H+](Cc1ccccc1Cl)Cc1ncc(C)cn1 ZINC000536367199 332233320 /nfs/dbraw/zinc/23/33/20/332233320.db2.gz SFUMDSWLJOTBMR-UHFFFAOYSA-N 1 2 303.837 4.241 20 0 DIADLO COc1cc(C[N@H+](CC(F)F)CC2CCC2)ccc1SC ZINC000536420440 332241504 /nfs/dbraw/zinc/24/15/04/332241504.db2.gz MNFRAALCNAHUAI-UHFFFAOYSA-N 1 2 315.429 4.284 20 0 DIADLO COc1cc(C[N@@H+](CC(F)F)CC2CCC2)ccc1SC ZINC000536420440 332241507 /nfs/dbraw/zinc/24/15/07/332241507.db2.gz MNFRAALCNAHUAI-UHFFFAOYSA-N 1 2 315.429 4.284 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc(F)c4ccccc4c3)ccc2[nH+]1 ZINC000559421385 332258048 /nfs/dbraw/zinc/25/80/48/332258048.db2.gz GRRGECDMKJPBLS-UHFFFAOYSA-N 1 2 319.339 4.187 20 0 DIADLO Cc1cc2[nH+]cn(Cc3nc4cc(Cl)ccc4n3C)c2cc1C ZINC000569614233 332268038 /nfs/dbraw/zinc/26/80/38/332268038.db2.gz STHMCUDQOBCTCQ-UHFFFAOYSA-N 1 2 324.815 4.242 20 0 DIADLO CCCC[C@H](CCC)C[NH2+][C@@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000559774795 332280060 /nfs/dbraw/zinc/28/00/60/332280060.db2.gz YTCOVPCLJKFSHX-WMLDXEAASA-N 1 2 318.440 4.229 20 0 DIADLO COc1ccc(Cl)c(C[N@H+](C)Cc2cc(C(C)(C)C)n[nH]2)c1 ZINC000564406330 332287051 /nfs/dbraw/zinc/28/70/51/332287051.db2.gz XAAXMEDDHOLBOK-UHFFFAOYSA-N 1 2 321.852 4.001 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+](C)Cc2cc(C(C)(C)C)n[nH]2)c1 ZINC000564406330 332287053 /nfs/dbraw/zinc/28/70/53/332287053.db2.gz XAAXMEDDHOLBOK-UHFFFAOYSA-N 1 2 321.852 4.001 20 0 DIADLO CCOc1ccc([C@H](CC)[NH2+]CC(C)(F)F)cc1OCC ZINC000559885194 332289001 /nfs/dbraw/zinc/28/90/01/332289001.db2.gz HIWJLDAZSPDTCL-ZDUSSCGKSA-N 1 2 301.377 4.180 20 0 DIADLO CC(F)(F)C[NH2+][C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000559890941 332289767 /nfs/dbraw/zinc/28/97/67/332289767.db2.gz KZJIKMIXJIDHNL-LBPRGKRZSA-N 1 2 309.278 4.281 20 0 DIADLO CC[C@H]([NH2+]CC(C)(F)F)c1cc(F)cc(Br)c1 ZINC000559892139 332290051 /nfs/dbraw/zinc/29/00/51/332290051.db2.gz WJUIAIWKHKWRNW-NSHDSACASA-N 1 2 310.157 4.284 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@@H](C)c2cn3ccccc3n2)on1 ZINC000559904096 332292079 /nfs/dbraw/zinc/29/20/79/332292079.db2.gz SRVWFARSCWQAID-ZDUSSCGKSA-N 1 2 312.417 4.077 20 0 DIADLO Cc1nn(-c2ccccc2)cc1N[C@@H](C)c1cn2ccccc2[nH+]1 ZINC000559910012 332293171 /nfs/dbraw/zinc/29/31/71/332293171.db2.gz LFUPZQJEKHMBIA-AWEZNQCLSA-N 1 2 317.396 4.002 20 0 DIADLO C(=C\c1ccc(-n2cc[nH+]c2)cc1)\c1nc(CC2CCCC2)no1 ZINC000560034632 332303994 /nfs/dbraw/zinc/30/39/94/332303994.db2.gz MAYOFRIKLPWFPL-YFHOEESVSA-N 1 2 320.396 4.158 20 0 DIADLO Clc1ccc(-c2ncc(C[NH2+]Cc3cscn3)s2)cc1 ZINC000560050344 332306603 /nfs/dbraw/zinc/30/66/03/332306603.db2.gz KLYCQCSGSKIQBO-UHFFFAOYSA-N 1 2 321.858 4.210 20 0 DIADLO C[C@@H](C[N@@H+]1CCc2ccc(Br)cc2C1)C(F)(F)F ZINC000560199038 332318838 /nfs/dbraw/zinc/31/88/38/332318838.db2.gz LDULMNFIGXELRA-VIFPVBQESA-N 1 2 322.168 4.006 20 0 DIADLO C[C@@H](C[N@H+]1CCc2ccc(Br)cc2C1)C(F)(F)F ZINC000560199038 332318840 /nfs/dbraw/zinc/31/88/40/332318840.db2.gz LDULMNFIGXELRA-VIFPVBQESA-N 1 2 322.168 4.006 20 0 DIADLO c1ccc2[nH+]c(N3CCC(OCC4CCCCC4)CC3)[nH]c2c1 ZINC000560255985 332324417 /nfs/dbraw/zinc/32/44/17/332324417.db2.gz GYHDZNYZGPEKCQ-UHFFFAOYSA-N 1 2 313.445 4.129 20 0 DIADLO C[C@H]1OCC[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)[C@H]1C ZINC000560260966 332325105 /nfs/dbraw/zinc/32/51/05/332325105.db2.gz FNSBSDKFLIQEIL-NWDGAFQWSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@H]1OCC[N@@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)[C@H]1C ZINC000560260966 332325106 /nfs/dbraw/zinc/32/51/06/332325106.db2.gz FNSBSDKFLIQEIL-NWDGAFQWSA-N 1 2 322.861 4.073 20 0 DIADLO O=C(Cc1coc2ccccc12)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000560479252 332344565 /nfs/dbraw/zinc/34/45/65/332344565.db2.gz KSAOOGFLUASDRQ-UHFFFAOYSA-N 1 2 317.348 4.004 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@H](c1ccccc1)C(F)(F)F ZINC000425585919 335107031 /nfs/dbraw/zinc/10/70/31/335107031.db2.gz JIHTYMCLQSRVMI-CQSZACIVSA-N 1 2 322.330 4.373 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)CSCc1cccc(Cl)c1 ZINC000425585817 335107044 /nfs/dbraw/zinc/10/70/44/335107044.db2.gz IXPWNJWZTIKUCU-UHFFFAOYSA-N 1 2 320.845 4.224 20 0 DIADLO C/C=C/c1ccc(NC(=O)CCn2c(C)[nH+]c3ccccc32)cc1 ZINC000583402205 332388575 /nfs/dbraw/zinc/38/85/75/332388575.db2.gz UFYBLIBCSIJXFX-ZZXKWVIFSA-N 1 2 319.408 4.407 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@@H](C)c1cncs1)c1ccco1 ZINC000560917285 332394130 /nfs/dbraw/zinc/39/41/30/332394130.db2.gz GFJPAQLBNZLKPM-SJCJKPOMSA-N 1 2 314.410 4.185 20 0 DIADLO Clc1cccc2c(N3CCCC4(CCOCC4)C3)cc[nH+]c12 ZINC000561210553 332425097 /nfs/dbraw/zinc/42/50/97/332425097.db2.gz DRDRICYERGBTPX-UHFFFAOYSA-N 1 2 316.832 4.285 20 0 DIADLO CCC[C@@H]1C[C@H]1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000425572189 335105308 /nfs/dbraw/zinc/10/53/08/335105308.db2.gz OGGAVSFKKYGEHZ-RHSMWYFYSA-N 1 2 323.440 4.261 20 0 DIADLO Clc1cccc2c(N[C@@H]3[C@@H]4CCO[C@H]4C34CCC4)cc[nH+]c12 ZINC000561267238 332431234 /nfs/dbraw/zinc/43/12/34/332431234.db2.gz ABQLMMBFRXRSAW-JCURWCKSSA-N 1 2 314.816 4.258 20 0 DIADLO CC(C)c1nc(N2CCC[C@H]2[C@@H]2CCCO2)cc(C(C)(C)C)[nH+]1 ZINC000561319082 332437574 /nfs/dbraw/zinc/43/75/74/332437574.db2.gz AWVJLXXUWZBBPP-GJZGRUSLSA-N 1 2 317.477 4.045 20 0 DIADLO CC[C@H](CC(=O)Nc1c(C)cc[nH+]c1C)c1ccc(OC)cc1 ZINC000425583498 335106730 /nfs/dbraw/zinc/10/67/30/335106730.db2.gz ARAREUGVSYCRLZ-OAHLLOKOSA-N 1 2 312.413 4.229 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)cn1 ZINC000427833515 332534026 /nfs/dbraw/zinc/53/40/26/332534026.db2.gz WDOFSNHCFIHPNJ-ZIAGYGMSSA-N 1 2 324.453 4.320 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)cc1F)c1nc2c(s1)CCC2 ZINC000427853006 332542036 /nfs/dbraw/zinc/54/20/36/332542036.db2.gz GQJKYIXSXKZGBD-VIFPVBQESA-N 1 2 310.825 4.275 20 0 DIADLO Cc1nc(CNc2cc[nH+]c(C)n2)oc1-c1ccc(Cl)cc1 ZINC000151749833 332611318 /nfs/dbraw/zinc/61/13/18/332611318.db2.gz JXNPGHGZJWQKCP-UHFFFAOYSA-N 1 2 314.776 4.014 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1c(F)cccc1OC ZINC000318376169 332695145 /nfs/dbraw/zinc/69/51/45/332695145.db2.gz OCKJQDFXLRIBFC-NSHDSACASA-N 1 2 323.795 4.347 20 0 DIADLO COc1cc(OC)cc(N(C)Cc2ccc(C(C)C)[nH+]c2C)c1 ZINC000569944856 332695344 /nfs/dbraw/zinc/69/53/44/332695344.db2.gz IUAKEDHZJVGEDC-UHFFFAOYSA-N 1 2 314.429 4.167 20 0 DIADLO CC(C)n1ccc(CNc2cc[nH+]c3cc(F)c(Cl)cc23)n1 ZINC000570397584 332750089 /nfs/dbraw/zinc/75/00/89/332750089.db2.gz ICEPFJZCDMVGHY-UHFFFAOYSA-N 1 2 318.783 4.417 20 0 DIADLO Cc1cccn2cc(C[S@@](=O)c3ccc(C(C)C)cc3)[nH+]c12 ZINC000176639370 332950435 /nfs/dbraw/zinc/95/04/35/332950435.db2.gz ZUZHBNJHQBHPDY-JOCHJYFZSA-N 1 2 312.438 4.074 20 0 DIADLO Cc1ccc(NC(=O)N2CCC3(CCCCC3)CC2)c(C)[nH+]1 ZINC000176760854 332955594 /nfs/dbraw/zinc/95/55/94/332955594.db2.gz FSSRYSYBEMHDSN-UHFFFAOYSA-N 1 2 301.434 4.277 20 0 DIADLO c1coc(-c2cc(CSCc3cn4ccccc4[nH+]3)no2)c1 ZINC000176901295 332962263 /nfs/dbraw/zinc/96/22/63/332962263.db2.gz OURHJBDROFVJME-UHFFFAOYSA-N 1 2 311.366 4.016 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000177637301 332993908 /nfs/dbraw/zinc/99/39/08/332993908.db2.gz WOAPGJMIOWAWNU-WDEREUQCSA-N 1 2 310.850 4.355 20 0 DIADLO Clc1ccc(-c2nc(C[NH2+]Cc3ccoc3)cs2)cc1 ZINC000518764202 333015514 /nfs/dbraw/zinc/01/55/14/333015514.db2.gz BGEZTUQPVADZMU-UHFFFAOYSA-N 1 2 304.802 4.346 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1cncc(F)c1 ZINC000312872401 333025763 /nfs/dbraw/zinc/02/57/63/333025763.db2.gz DWXWJSUAKLZYIH-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1nc2ccc(Cl)cc2n1C)c1nccs1 ZINC000180101019 333027207 /nfs/dbraw/zinc/02/72/07/333027207.db2.gz BDKPVRJCCZFLOU-UWVGGRQHSA-N 1 2 320.849 4.095 20 0 DIADLO COC(=O)c1sccc1C[N@H+](C)[C@H](C)c1cccc(Cl)c1 ZINC000378665945 333042811 /nfs/dbraw/zinc/04/28/11/333042811.db2.gz JLUDTQGRUJNULJ-LLVKDONJSA-N 1 2 323.845 4.381 20 0 DIADLO COC(=O)c1sccc1C[N@@H+](C)[C@H](C)c1cccc(Cl)c1 ZINC000378665945 333042812 /nfs/dbraw/zinc/04/28/12/333042812.db2.gz JLUDTQGRUJNULJ-LLVKDONJSA-N 1 2 323.845 4.381 20 0 DIADLO CC(C)(C)[C@H]1C[N@H+](Cc2ncc(-c3ccccc3)s2)CCO1 ZINC000580275557 333050792 /nfs/dbraw/zinc/05/07/92/333050792.db2.gz ADMNQIVZVBDEJI-MRXNPFEDSA-N 1 2 316.470 4.057 20 0 DIADLO CC(C)(C)[C@H]1C[N@@H+](Cc2ncc(-c3ccccc3)s2)CCO1 ZINC000580275557 333050793 /nfs/dbraw/zinc/05/07/93/333050793.db2.gz ADMNQIVZVBDEJI-MRXNPFEDSA-N 1 2 316.470 4.057 20 0 DIADLO COc1cc(F)cc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c1 ZINC000183831457 333063630 /nfs/dbraw/zinc/06/36/30/333063630.db2.gz BXGXOSONPNQLCR-LJQANCHMSA-N 1 2 311.356 4.307 20 0 DIADLO C[C@]12CC3CC(C(=O)Nc4cccc5[nH+]ccn54)(C1)C[C@@](C)(C3)C2 ZINC000460344039 333064489 /nfs/dbraw/zinc/06/44/89/333064489.db2.gz VMTNAGNHOUREOF-ODNNXGBQSA-N 1 2 323.440 4.269 20 0 DIADLO COC(=O)[C@H](c1ccccc1C)[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000466829578 333089185 /nfs/dbraw/zinc/08/91/85/333089185.db2.gz WGPQWSMFEBFDDQ-IRXDYDNUSA-N 1 2 315.438 4.108 20 0 DIADLO COC(=O)[C@H](c1ccccc1C)[N@H+]1CCC[C@H]1c1ccsc1 ZINC000466829578 333089187 /nfs/dbraw/zinc/08/91/87/333089187.db2.gz WGPQWSMFEBFDDQ-IRXDYDNUSA-N 1 2 315.438 4.108 20 0 DIADLO CC(C)(C)[C@H]1C[C@H](Nc2cc(C(F)(F)F)cc[nH+]2)CCO1 ZINC000487125305 333112616 /nfs/dbraw/zinc/11/26/16/333112616.db2.gz ZPPUIUFAMWOHNO-VXGBXAGGSA-N 1 2 302.340 4.106 20 0 DIADLO c1cn(-c2ccc(CSCCCC3CCOCC3)cc2)c[nH+]1 ZINC000584331131 333117819 /nfs/dbraw/zinc/11/78/19/333117819.db2.gz JWZLUCBCYMUJKK-UHFFFAOYSA-N 1 2 316.470 4.312 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H](C)c3cccc(Cl)c3)cc2[nH+]1 ZINC000460683036 333124488 /nfs/dbraw/zinc/12/44/88/333124488.db2.gz GKTMBHWOBOSNLJ-JTQLQIEISA-N 1 2 313.788 4.267 20 0 DIADLO CCC[C@@H](C)Cc1nc(Cn2c3ccccc3[nH+]c2CC)no1 ZINC000460728563 333129507 /nfs/dbraw/zinc/12/95/07/333129507.db2.gz KNESXTLAHBYEEQ-CYBMUJFWSA-N 1 2 312.417 4.009 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc([C@H]2CCC[C@@H](C)C2)n1 ZINC000460747845 333133724 /nfs/dbraw/zinc/13/37/24/333133724.db2.gz JBZMCRHRPBIWRU-KGLIPLIRSA-N 1 2 324.428 4.324 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)Oc1cccc(C(C)C)c1 ZINC000425591549 335124415 /nfs/dbraw/zinc/12/44/15/335124415.db2.gz ZXSBTEBBOSGSMU-OAHLLOKOSA-N 1 2 312.413 4.228 20 0 DIADLO FC(F)c1ccc(COc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000460809537 333143869 /nfs/dbraw/zinc/14/38/69/333143869.db2.gz AKRONHLMOVVMRQ-UHFFFAOYSA-N 1 2 300.308 4.389 20 0 DIADLO c1ccc([C@H]([NH2+]Cc2noc(C3CCCCC3)n2)C2CC2)cc1 ZINC000179687705 333154430 /nfs/dbraw/zinc/15/44/30/333154430.db2.gz OQYPEKNWESBALW-SFHVURJKSA-N 1 2 311.429 4.358 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@H](c2ccccc2)C2CC2)n1 ZINC000179688726 333154487 /nfs/dbraw/zinc/15/44/87/333154487.db2.gz QMQGVDYXJQJMIU-MLGOLLRUSA-N 1 2 317.458 4.125 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@@H](c2ccccc2)C2CC2)n1 ZINC000179688703 333154564 /nfs/dbraw/zinc/15/45/64/333154564.db2.gz QMQGVDYXJQJMIU-WBMJQRKESA-N 1 2 317.458 4.125 20 0 DIADLO CC[C@@H](C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1)c1ccc(F)cc1 ZINC000460857593 333170151 /nfs/dbraw/zinc/17/01/51/333170151.db2.gz HSQUYHWCKKGHSF-OAHLLOKOSA-N 1 2 311.360 4.143 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCS[C@@H]1CCO[C@H]1C ZINC000460868085 333178869 /nfs/dbraw/zinc/17/88/69/333178869.db2.gz AMWAYKKFKKAJTA-KBXCAEBGSA-N 1 2 318.486 4.426 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCSc1nncs1 ZINC000460870022 333179723 /nfs/dbraw/zinc/17/97/23/333179723.db2.gz RISVNJVHBPVCKF-UHFFFAOYSA-N 1 2 318.471 4.159 20 0 DIADLO C[C@@H](Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1)c1cccnc1 ZINC000182924037 333181341 /nfs/dbraw/zinc/18/13/41/333181341.db2.gz GFOMSUAIGBFPRU-OAHLLOKOSA-N 1 2 318.424 4.455 20 0 DIADLO O=C(Nc1cccc2c1CCCC2)c1cccc(-n2cc[nH+]c2)c1 ZINC000522742170 333184294 /nfs/dbraw/zinc/18/42/94/333184294.db2.gz BQNJFYBIDLABHF-UHFFFAOYSA-N 1 2 317.392 4.003 20 0 DIADLO Cc1c[nH+]c(CCSCc2nnc(C(C)C)s2)c(C)c1 ZINC000580327468 333192175 /nfs/dbraw/zinc/19/21/75/333192175.db2.gz NQRAUSHLQJSXMT-UHFFFAOYSA-N 1 2 307.488 4.149 20 0 DIADLO Cc1nc(C[NH2+][C@H](CC(F)(F)F)c2ccccc2C)[nH]c1C ZINC000582073491 333200081 /nfs/dbraw/zinc/20/00/81/333200081.db2.gz GEUDGYLXEQMXLG-CQSZACIVSA-N 1 2 311.351 4.118 20 0 DIADLO Cc1[nH]c(CN[C@H](CC(F)(F)F)c2ccccc2C)[nH+]c1C ZINC000582073491 333200082 /nfs/dbraw/zinc/20/00/82/333200082.db2.gz GEUDGYLXEQMXLG-CQSZACIVSA-N 1 2 311.351 4.118 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3cc4cc(F)ccc4o3)ccc2n1C ZINC000525731253 333201472 /nfs/dbraw/zinc/20/14/72/333201472.db2.gz LLWMKCRGWUCIGU-UHFFFAOYSA-N 1 2 323.327 4.019 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2csc(C3CCCC3)n2)s1 ZINC000184992387 333203476 /nfs/dbraw/zinc/20/34/76/333203476.db2.gz PLLZVZABNBTMOI-LLVKDONJSA-N 1 2 307.488 4.416 20 0 DIADLO CC[C@H]([NH2+]Cc1c(C)noc1C)c1nc(C(F)(F)F)cs1 ZINC000185920813 333216017 /nfs/dbraw/zinc/21/60/17/333216017.db2.gz QTPLGHZTXLICND-JTQLQIEISA-N 1 2 319.352 4.008 20 0 DIADLO CC(C)[C@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)c1ccccc1Cl ZINC000565306530 333226716 /nfs/dbraw/zinc/22/67/16/333226716.db2.gz BMLZWYUGXUSAPK-DYVFJYSZSA-N 1 2 319.836 4.001 20 0 DIADLO CC(C)[C@@H](NC(=O)C[C@H](C)n1cc[nH+]c1)c1ccccc1Cl ZINC000565306541 333226893 /nfs/dbraw/zinc/22/68/93/333226893.db2.gz BMLZWYUGXUSAPK-SUMWQHHRSA-N 1 2 319.836 4.001 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(OC(C)C)c(Cl)c2)no1 ZINC000187738456 333236883 /nfs/dbraw/zinc/23/68/83/333236883.db2.gz OOQHGBMJZQYKOQ-UHFFFAOYSA-N 1 2 308.809 4.056 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(OC(C)C)c(Cl)c2)no1 ZINC000187738456 333236885 /nfs/dbraw/zinc/23/68/85/333236885.db2.gz OOQHGBMJZQYKOQ-UHFFFAOYSA-N 1 2 308.809 4.056 20 0 DIADLO CCCCc1nc(C[N@H+](C)[C@H](c2ccccc2)C(C)C)no1 ZINC000497385030 333243461 /nfs/dbraw/zinc/24/34/61/333243461.db2.gz FXPUYXWEKATYSK-SFHVURJKSA-N 1 2 301.434 4.241 20 0 DIADLO CCCCc1nc(C[N@@H+](C)[C@H](c2ccccc2)C(C)C)no1 ZINC000497385030 333243463 /nfs/dbraw/zinc/24/34/63/333243463.db2.gz FXPUYXWEKATYSK-SFHVURJKSA-N 1 2 301.434 4.241 20 0 DIADLO C[N@H+](CC(=O)Nc1ccccc1-c1ccccc1)Cc1ccoc1 ZINC000497471407 333254586 /nfs/dbraw/zinc/25/45/86/333254586.db2.gz MJBXCYMXPVNGJT-UHFFFAOYSA-N 1 2 320.392 4.017 20 0 DIADLO C[N@@H+](CC(=O)Nc1ccccc1-c1ccccc1)Cc1ccoc1 ZINC000497471407 333254588 /nfs/dbraw/zinc/25/45/88/333254588.db2.gz MJBXCYMXPVNGJT-UHFFFAOYSA-N 1 2 320.392 4.017 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000497590745 333266664 /nfs/dbraw/zinc/26/66/64/333266664.db2.gz MZHXZZPZCWMGPJ-KZULUSFZSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000497590745 333266665 /nfs/dbraw/zinc/26/66/65/333266665.db2.gz MZHXZZPZCWMGPJ-KZULUSFZSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1)c1nc2c(s1)CCC2 ZINC000497694776 333279067 /nfs/dbraw/zinc/27/90/67/333279067.db2.gz YWDBDFHDSWYBMV-NTZNESFSSA-N 1 2 302.443 4.199 20 0 DIADLO Fc1cccc(F)c1C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000497719962 333282657 /nfs/dbraw/zinc/28/26/57/333282657.db2.gz PMULOFONDVNHFA-IBGZPJMESA-N 1 2 310.347 4.239 20 0 DIADLO Cc1cc(N(Cc2ccc(Cl)c(Cl)c2)C2CC2)nc[nH+]1 ZINC000498850397 333288297 /nfs/dbraw/zinc/28/82/97/333288297.db2.gz NTJCTDJVUWRJBJ-UHFFFAOYSA-N 1 2 308.212 4.261 20 0 DIADLO Cc1ccc([C@H]2COCC[N@@H+]2CCSC2CCCCC2)o1 ZINC000500077026 333324188 /nfs/dbraw/zinc/32/41/88/333324188.db2.gz VQIMIVJWCBFAGK-MRXNPFEDSA-N 1 2 309.475 4.027 20 0 DIADLO Cc1ccc([C@H]2COCC[N@H+]2CCSC2CCCCC2)o1 ZINC000500077026 333324190 /nfs/dbraw/zinc/32/41/90/333324190.db2.gz VQIMIVJWCBFAGK-MRXNPFEDSA-N 1 2 309.475 4.027 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2cc(F)ccc2F)s1 ZINC000531233464 333336959 /nfs/dbraw/zinc/33/69/59/333336959.db2.gz YPFWFLWRBHASOB-LLVKDONJSA-N 1 2 310.413 4.485 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cc(F)ccc2F)s1 ZINC000531233464 333336960 /nfs/dbraw/zinc/33/69/60/333336960.db2.gz YPFWFLWRBHASOB-LLVKDONJSA-N 1 2 310.413 4.485 20 0 DIADLO CCOc1ccccc1OCCn1c[nH+]c2cc(C)c(C)cc21 ZINC000040224043 333341529 /nfs/dbraw/zinc/34/15/29/333341529.db2.gz VQXITMOGNDIDJR-UHFFFAOYSA-N 1 2 310.397 4.131 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2nc(C(F)(F)F)cs2)cc1 ZINC000531343479 333345022 /nfs/dbraw/zinc/34/50/22/333345022.db2.gz UZRKAMDGHZHACF-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2nc(C(F)(F)F)cs2)cc1 ZINC000531343479 333345024 /nfs/dbraw/zinc/34/50/24/333345024.db2.gz UZRKAMDGHZHACF-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO CC[C@H](C(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccc(OC)cc1 ZINC000463256229 333366059 /nfs/dbraw/zinc/36/60/59/333366059.db2.gz DGOAEYKSZKXYEN-KRWDZBQOSA-N 1 2 312.413 4.148 20 0 DIADLO CCc1cnc(CN(C)c2[nH+]ccc3cc(F)ccc32)s1 ZINC000521430031 333382753 /nfs/dbraw/zinc/38/27/53/333382753.db2.gz GPRKCZJAXVBNEM-UHFFFAOYSA-N 1 2 301.390 4.029 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3cccc(C4CC4)c3)ccc2n1C ZINC000516660940 333392035 /nfs/dbraw/zinc/39/20/35/333392035.db2.gz IBJBWNORVUJJBC-UHFFFAOYSA-N 1 2 305.381 4.011 20 0 DIADLO Clc1cccc(Cl)c1[C@H]([NH2+]Cc1cnccn1)C1CC1 ZINC000563118024 333393077 /nfs/dbraw/zinc/39/30/77/333393077.db2.gz JGWAAMHOBWLERW-OAHLLOKOSA-N 1 2 308.212 4.024 20 0 DIADLO COc1ccc(OC)c([C@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c1 ZINC000319723000 333400477 /nfs/dbraw/zinc/40/04/77/333400477.db2.gz BEKWWFAGEWAZTC-NWDGAFQWSA-N 1 2 321.367 4.394 20 0 DIADLO CCOc1ccccc1[C@H](C)Nc1ccc(N2CCCC2)[nH+]c1 ZINC000319766694 333403351 /nfs/dbraw/zinc/40/33/51/333403351.db2.gz WSVIKZDLLMPOEG-HNNXBMFYSA-N 1 2 311.429 4.254 20 0 DIADLO COc1ccc(C[NH2+][C@H](c2ccco2)c2ccccc2)c(OC)c1 ZINC000066236380 333447220 /nfs/dbraw/zinc/44/72/20/333447220.db2.gz PNFSDNFLJVWSLM-FQEVSTJZSA-N 1 2 323.392 4.176 20 0 DIADLO CC(C)(C)C(C)(C)C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000563269052 333516783 /nfs/dbraw/zinc/51/67/83/333516783.db2.gz NXELTYNIWXTQPF-UHFFFAOYSA-N 1 2 323.506 4.140 20 0 DIADLO Cn1ccnc1[C@@H]([NH2+][C@@H]1CCCc2sccc21)c1ccccc1 ZINC000531687551 333543911 /nfs/dbraw/zinc/54/39/11/333543911.db2.gz IUXYEBGXUSCNCH-AEFFLSMTSA-N 1 2 323.465 4.238 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2c(Cl)oc3ccccc32)s1 ZINC000534131978 333560862 /nfs/dbraw/zinc/56/08/62/333560862.db2.gz IBFZTYRZPVLJII-UHFFFAOYSA-N 1 2 321.833 4.351 20 0 DIADLO CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1cc(C)[nH+]cc1C ZINC000534326063 333576978 /nfs/dbraw/zinc/57/69/78/333576978.db2.gz QMINPKHUXKYYII-SFHVURJKSA-N 1 2 311.429 4.125 20 0 DIADLO Cc1nsc(C)c1C[NH2+][C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000563355459 333595411 /nfs/dbraw/zinc/59/54/11/333595411.db2.gz PQFJOGYHRDGJMQ-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2noc3ccccc23)cs1 ZINC000563419888 333603201 /nfs/dbraw/zinc/60/32/01/333603201.db2.gz ZXTBSWRRKAAYSB-LLVKDONJSA-N 1 2 301.415 4.259 20 0 DIADLO Cc1ccc(NC(=O)Nc2cccc(CC(F)(F)F)c2)c(C)[nH+]1 ZINC000152162560 333636009 /nfs/dbraw/zinc/63/60/09/333636009.db2.gz LZMPQDWGVKOFTB-UHFFFAOYSA-N 1 2 323.318 4.447 20 0 DIADLO Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(C)[nH+]c2C)c1 ZINC000152183144 333640380 /nfs/dbraw/zinc/64/03/80/333640380.db2.gz UYXQBOQURMPNDC-GOSISDBHSA-N 1 2 309.413 4.376 20 0 DIADLO CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(C)[nH+]c1C ZINC000152231467 333648936 /nfs/dbraw/zinc/64/89/36/333648936.db2.gz RLZVQLDCEOLSRT-UHFFFAOYSA-N 1 2 317.820 4.406 20 0 DIADLO CC(C)(c1noc(Cc2cn3ccccc3[nH+]2)n1)C1=CCCCC1 ZINC000571248961 333688122 /nfs/dbraw/zinc/68/81/22/333688122.db2.gz LOZUCZMXDJDXAF-UHFFFAOYSA-N 1 2 322.412 4.086 20 0 DIADLO C[C@H](CC(F)F)C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000411765171 333705358 /nfs/dbraw/zinc/70/53/58/333705358.db2.gz AEIGFGKLIKULJP-LLVKDONJSA-N 1 2 306.312 4.104 20 0 DIADLO Cc1cc(NC2CC[NH+](CC(F)F)CC2)cc(C)c1Cl ZINC000442825795 335156278 /nfs/dbraw/zinc/15/62/78/335156278.db2.gz VPTSHMYYNZFTHX-UHFFFAOYSA-N 1 2 302.796 4.098 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H](C)c1cccc(F)c1 ZINC000366575633 333776908 /nfs/dbraw/zinc/77/69/08/333776908.db2.gz LYXQHOAQRPBFBN-CYBMUJFWSA-N 1 2 323.371 4.266 20 0 DIADLO CC(C)c1cccc(C(C)C)c1NC(=O)C[NH+]1CC(C)(C)C1 ZINC000571580196 333817439 /nfs/dbraw/zinc/81/74/39/333817439.db2.gz VNWJGSJQAYVULL-UHFFFAOYSA-N 1 2 302.462 4.214 20 0 DIADLO CCC(CC)S[C@H](C)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000412987125 333823282 /nfs/dbraw/zinc/82/32/82/333823282.db2.gz ALPKOGQOYAKHDZ-GFCCVEGCSA-N 1 2 317.458 4.326 20 0 DIADLO Cc1csc(C[NH2+][C@@H](C)c2csc(-c3ccccc3)n2)n1 ZINC000414062549 333889508 /nfs/dbraw/zinc/88/95/08/333889508.db2.gz LNYKAJGHWQZZNS-LBPRGKRZSA-N 1 2 315.467 4.426 20 0 DIADLO C[C@H]([NH2+][C@@H](CC(F)(F)F)c1ccccc1)c1cc2n(n1)CCC2 ZINC000414083392 333893071 /nfs/dbraw/zinc/89/30/71/333893071.db2.gz WPSVUCUVDSOFIA-LRDDRELGSA-N 1 2 323.362 4.174 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1Cl)c1cc2n(n1)CCC2 ZINC000414097344 333895687 /nfs/dbraw/zinc/89/56/87/333895687.db2.gz RPZKOUOQGZKOAZ-GHMZBOCLSA-N 1 2 307.800 4.034 20 0 DIADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccn(C)n1 ZINC000414124740 333898853 /nfs/dbraw/zinc/89/88/53/333898853.db2.gz CKLVGXYVGPDFOE-SWLSCSKDSA-N 1 2 311.351 4.073 20 0 DIADLO CC1(C)C[C@@H]([NH2+]Cc2nccc(C(F)(F)F)n2)c2ccccc21 ZINC000414237661 333917923 /nfs/dbraw/zinc/91/79/23/333917923.db2.gz JHZBKAZFGOZKRQ-CYBMUJFWSA-N 1 2 321.346 4.008 20 0 DIADLO CCn1ccc(C[NH2+][C@@H](c2ccccc2)c2ccc(C)cc2C)n1 ZINC000414214361 333922682 /nfs/dbraw/zinc/92/26/82/333922682.db2.gz VYXPWWUWEMCKTQ-NRFANRHFSA-N 1 2 319.452 4.399 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c21)c1csnn1 ZINC000414293508 333934799 /nfs/dbraw/zinc/93/47/99/333934799.db2.gz CVSQEPHIPZBOLM-WRWORJQWSA-N 1 2 314.241 4.183 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(C(F)(F)F)c(C)c2)s1 ZINC000414425481 333970066 /nfs/dbraw/zinc/97/00/66/333970066.db2.gz AEHQKLQGXXFLPE-SECBINFHSA-N 1 2 315.364 4.025 20 0 DIADLO Cc1occc1CNc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000414443926 333978070 /nfs/dbraw/zinc/97/80/70/333978070.db2.gz JSMRNZLBSSGOPC-UHFFFAOYSA-N 1 2 307.397 4.400 20 0 DIADLO Cc1ccc2sc(C[NH2+][C@@H](C)c3c(F)cncc3F)nc2c1 ZINC000528506534 333992376 /nfs/dbraw/zinc/99/23/76/333992376.db2.gz QRJDEXZMYINRIW-JTQLQIEISA-N 1 2 319.380 4.129 20 0 DIADLO c1cc(C2CCCC2)ccc1C[NH2+]Cc1nnc(C2CC2)s1 ZINC000414552057 334015699 /nfs/dbraw/zinc/01/56/99/334015699.db2.gz GNIRTJABDANYLA-UHFFFAOYSA-N 1 2 313.470 4.363 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCOc2cc(Cl)ccc21)c1cscn1 ZINC000271913485 334028529 /nfs/dbraw/zinc/02/85/29/334028529.db2.gz YIOABHLQMXEWNM-ZWNOBZJWSA-N 1 2 308.834 4.361 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+][C@H](C)c2nnc(C)s2)cc1F ZINC000274255945 334058027 /nfs/dbraw/zinc/05/80/27/334058027.db2.gz TURKOIJGARUHKY-RKDXNWHRSA-N 1 2 311.451 4.119 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+](C)Cc1ccc(F)cc1Cl ZINC000343533617 335175744 /nfs/dbraw/zinc/17/57/44/335175744.db2.gz MTEIPQBAEIOKPH-UHFFFAOYSA-N 1 2 309.816 4.197 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+](C)Cc1ccc(F)cc1Cl ZINC000343533617 335175745 /nfs/dbraw/zinc/17/57/45/335175745.db2.gz MTEIPQBAEIOKPH-UHFFFAOYSA-N 1 2 309.816 4.197 20 0 DIADLO c1[nH]c([C@@H]2CCCC[N@H+]2Cc2cccnc2)nc1-c1ccccc1 ZINC000276461646 334078917 /nfs/dbraw/zinc/07/89/17/334078917.db2.gz OSWILNTUXXCFOS-IBGZPJMESA-N 1 2 318.424 4.199 20 0 DIADLO c1[nH]c([C@@H]2CCCC[N@@H+]2Cc2cccnc2)nc1-c1ccccc1 ZINC000276461646 334078918 /nfs/dbraw/zinc/07/89/18/334078918.db2.gz OSWILNTUXXCFOS-IBGZPJMESA-N 1 2 318.424 4.199 20 0 DIADLO c1[nH]c([C@H]2CCCC[N@H+]2Cc2cccnc2)nc1-c1ccccc1 ZINC000276461648 334078971 /nfs/dbraw/zinc/07/89/71/334078971.db2.gz OSWILNTUXXCFOS-LJQANCHMSA-N 1 2 318.424 4.199 20 0 DIADLO c1[nH]c([C@H]2CCCC[N@@H+]2Cc2cccnc2)nc1-c1ccccc1 ZINC000276461648 334078973 /nfs/dbraw/zinc/07/89/73/334078973.db2.gz OSWILNTUXXCFOS-LJQANCHMSA-N 1 2 318.424 4.199 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncnn1C)c1cc2c(ccc3ccccc23)o1 ZINC000276523334 334080919 /nfs/dbraw/zinc/08/09/19/334080919.db2.gz CAOYFVRFORZNGT-OLZOCXBDSA-N 1 2 320.396 4.126 20 0 DIADLO CC(C)[C@H](NC(=O)CCc1ccc2ccccc2c1)c1[nH]cc[nH+]1 ZINC000276577942 334082583 /nfs/dbraw/zinc/08/25/83/334082583.db2.gz JFTOOEWWAPEGCQ-IBGZPJMESA-N 1 2 321.424 4.009 20 0 DIADLO COc1cc(Cl)c(F)c(C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000414791051 334098803 /nfs/dbraw/zinc/09/88/03/334098803.db2.gz QJHINLDRCGQNMB-UHFFFAOYSA-N 1 2 322.767 4.060 20 0 DIADLO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)CC(=O)OC(C)(C)C ZINC000195732512 334107537 /nfs/dbraw/zinc/10/75/37/334107537.db2.gz IGGHQNFOXGVBID-NSHDSACASA-N 1 2 317.351 4.040 20 0 DIADLO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CC(=O)OC(C)(C)C ZINC000195732512 334107539 /nfs/dbraw/zinc/10/75/39/334107539.db2.gz IGGHQNFOXGVBID-NSHDSACASA-N 1 2 317.351 4.040 20 0 DIADLO Cn1cc(-c2ccc(CNc3ccc4c(c3)CCC[NH2+]4)s2)cn1 ZINC000414843771 334113385 /nfs/dbraw/zinc/11/33/85/334113385.db2.gz CUEOQXGKUSZKFS-UHFFFAOYSA-N 1 2 324.453 4.119 20 0 DIADLO CC1=C(C)CN(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000281371159 334125589 /nfs/dbraw/zinc/12/55/89/334125589.db2.gz LXNFJFFCPIGWDN-UHFFFAOYSA-N 1 2 323.396 4.448 20 0 DIADLO Clc1ccc(SCC[N@@H+]2CCO[C@@H](c3ccco3)C2)cc1 ZINC000438539376 334126912 /nfs/dbraw/zinc/12/69/12/334126912.db2.gz FTSPZXIGSKCKQE-MRXNPFEDSA-N 1 2 323.845 4.099 20 0 DIADLO Clc1ccc(SCC[N@H+]2CCO[C@@H](c3ccco3)C2)cc1 ZINC000438539376 334126914 /nfs/dbraw/zinc/12/69/14/334126914.db2.gz FTSPZXIGSKCKQE-MRXNPFEDSA-N 1 2 323.845 4.099 20 0 DIADLO Cc1ccc(-c2n[nH]cc2CNc2ccc3c(c2)CCC[NH2+]3)cc1 ZINC000414854878 334128035 /nfs/dbraw/zinc/12/80/35/334128035.db2.gz VELPCKGCHWFNTJ-UHFFFAOYSA-N 1 2 318.424 4.355 20 0 DIADLO COc1ccc2oc(CNc3ccc4c(c3)CCC[NH2+]4)cc2c1 ZINC000414854528 334128298 /nfs/dbraw/zinc/12/82/98/334128298.db2.gz UJOHDNJFRCYMCE-UHFFFAOYSA-N 1 2 308.381 4.412 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000414855202 334128382 /nfs/dbraw/zinc/12/83/82/334128382.db2.gz VZODNHVEXRQVHP-UHFFFAOYSA-N 1 2 312.461 4.225 20 0 DIADLO CC1(C)CCc2ccccc2[C@@H]([NH2+]Cc2noc(C3CC3)n2)C1 ZINC000281834598 334128703 /nfs/dbraw/zinc/12/87/03/334128703.db2.gz YAWOMVGUYYXTLO-INIZCTEOSA-N 1 2 311.429 4.140 20 0 DIADLO Cc1nn(-c2ccccc2)cc1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000414855789 334128859 /nfs/dbraw/zinc/12/88/59/334128859.db2.gz XNPACWFGGRRDTO-UHFFFAOYSA-N 1 2 318.424 4.151 20 0 DIADLO Fc1ccc(N[C@@H](c2[nH]cc[nH+]2)c2cccnc2)cc1C1CC1 ZINC000343560751 335177967 /nfs/dbraw/zinc/17/79/67/335177967.db2.gz ZJPRSOZKYXTRHE-QGZVFWFLSA-N 1 2 308.360 4.023 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2nc(-c3cccc(F)c3)no2)cs1 ZINC000294956640 334214813 /nfs/dbraw/zinc/21/48/13/334214813.db2.gz DOSGYXOZFDPPME-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO CC(C)([NH2+]Cc1csc(Cl)n1)c1ccc(Cl)cc1 ZINC000294959599 334215073 /nfs/dbraw/zinc/21/50/73/334215073.db2.gz NFPGUFKFULLYHK-UHFFFAOYSA-N 1 2 301.242 4.475 20 0 DIADLO c1c[nH+]c([C@@H](Nc2ccc([C@H]3CCOC3)cc2)c2ccccc2)[nH]1 ZINC000295050941 334216007 /nfs/dbraw/zinc/21/60/07/334216007.db2.gz QGSVPCYFSWGSCS-HKUYNNGSSA-N 1 2 319.408 4.115 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccncn1 ZINC000453052882 334228514 /nfs/dbraw/zinc/22/85/14/334228514.db2.gz DVMVEIDCPKKPPZ-IUCAKERBSA-N 1 2 314.191 4.334 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)Nc1cc(Cl)c(Cl)cc1OC ZINC000296389829 334233324 /nfs/dbraw/zinc/23/33/24/334233324.db2.gz JUFWPLOMPYOXAA-SECBINFHSA-N 1 2 314.216 4.392 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)Nc1ccc(N(C)C(C)C)c(F)c1 ZINC000296692549 334236035 /nfs/dbraw/zinc/23/60/35/334236035.db2.gz HFMNLNSQIAZIMU-CYBMUJFWSA-N 1 2 304.413 4.060 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccc(Cl)c(Cl)c2)C2CC2)nc1 ZINC000340658246 334258761 /nfs/dbraw/zinc/25/87/61/334258761.db2.gz BCAUBPYYRXADAK-UHFFFAOYSA-N 1 2 322.239 4.256 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccc(Cl)c(Cl)c2)C2CC2)nc1 ZINC000340658246 334258763 /nfs/dbraw/zinc/25/87/63/334258763.db2.gz BCAUBPYYRXADAK-UHFFFAOYSA-N 1 2 322.239 4.256 20 0 DIADLO Cc1cccn2cc(CNc3cccc(C(C)(F)F)c3)[nH+]c12 ZINC000187585277 334265584 /nfs/dbraw/zinc/26/55/84/334265584.db2.gz URHVWCCRAVHXDN-UHFFFAOYSA-N 1 2 301.340 4.367 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)nc1 ZINC000514093000 334270993 /nfs/dbraw/zinc/27/09/93/334270993.db2.gz DBLYXWLUXSHNOP-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)nc1 ZINC000514093000 334270994 /nfs/dbraw/zinc/27/09/94/334270994.db2.gz DBLYXWLUXSHNOP-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cc(C)[nH+]c(CSc2nc3cc(C)ccc3o2)c1 ZINC000534518591 334278480 /nfs/dbraw/zinc/27/84/80/334278480.db2.gz BVOVSKNHCSZIEB-UHFFFAOYSA-N 1 2 300.383 4.141 20 0 DIADLO CC[C@H](c1ccc(F)cc1)N1CC[NH+](Cc2ccsc2)CC1 ZINC000534527102 334279005 /nfs/dbraw/zinc/27/90/05/334279005.db2.gz XXQWQMVITBYUPF-GOSISDBHSA-N 1 2 318.461 4.156 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)CCCCSC)cc2[nH+]1 ZINC000531906781 334282630 /nfs/dbraw/zinc/28/26/30/334282630.db2.gz UPZKUGJHZBCMKS-UHFFFAOYSA-N 1 2 319.474 4.377 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1noc(Cc2ccccc2)n1)c1ccccc1 ZINC000111195511 334310867 /nfs/dbraw/zinc/31/08/67/334310867.db2.gz OPSCRQXYARTZHB-HXUWFJFHSA-N 1 2 321.424 4.147 20 0 DIADLO Cc1cccc2[nH+]c(CNc3cccc(OC(F)(F)F)c3)cn21 ZINC000303872746 334338081 /nfs/dbraw/zinc/33/80/81/334338081.db2.gz IBPYKYNVVPAXJM-UHFFFAOYSA-N 1 2 321.302 4.153 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(F)c2F)C[C@H](c2ccc(F)cc2)O1 ZINC000303921405 334347171 /nfs/dbraw/zinc/34/71/71/334347171.db2.gz ORCBKWVFJZFXCD-YVEFUNNKSA-N 1 2 321.342 4.066 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(F)c2F)C[C@H](c2ccc(F)cc2)O1 ZINC000303921405 334347173 /nfs/dbraw/zinc/34/71/73/334347173.db2.gz ORCBKWVFJZFXCD-YVEFUNNKSA-N 1 2 321.342 4.066 20 0 DIADLO CC(C)Cn1cc[nH+]c1CNC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1 ZINC000303927504 334347612 /nfs/dbraw/zinc/34/76/12/334347612.db2.gz PENWXYLTKYANGF-CVEARBPZSA-N 1 2 319.493 4.008 20 0 DIADLO COc1cccc(Cl)c1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000514097287 334354928 /nfs/dbraw/zinc/35/49/28/334354928.db2.gz XSMSUIUUHRZOQG-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000514097287 334354930 /nfs/dbraw/zinc/35/49/30/334354930.db2.gz XSMSUIUUHRZOQG-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO Cc1cc(NC(=O)N2CCCCC[C@H]2c2ccccc2)c(C)c[nH+]1 ZINC000535062076 334361725 /nfs/dbraw/zinc/36/17/25/334361725.db2.gz PSLQQCGOTVSECU-IBGZPJMESA-N 1 2 323.440 4.270 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1OC1CCCC1)c1cscn1 ZINC000535064974 334362353 /nfs/dbraw/zinc/36/23/53/334362353.db2.gz OEMVBAJEGIQUFG-CYBMUJFWSA-N 1 2 302.443 4.315 20 0 DIADLO CCn1c(C[N@@H+]2CCc3sccc3[C@@H]2C)nc2ccccc21 ZINC000535066141 334362976 /nfs/dbraw/zinc/36/29/76/334362976.db2.gz IBBVWNRCFBUKQP-ZDUSSCGKSA-N 1 2 311.454 4.237 20 0 DIADLO CCn1c(C[N@H+]2CCc3sccc3[C@@H]2C)nc2ccccc21 ZINC000535066141 334362977 /nfs/dbraw/zinc/36/29/77/334362977.db2.gz IBBVWNRCFBUKQP-ZDUSSCGKSA-N 1 2 311.454 4.237 20 0 DIADLO FC(F)(F)Oc1ccccc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000535067507 334362995 /nfs/dbraw/zinc/36/29/95/334362995.db2.gz WRLUFPOTQNIZOJ-OAHLLOKOSA-N 1 2 322.330 4.317 20 0 DIADLO FC(F)(F)Oc1ccccc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000535067507 334362996 /nfs/dbraw/zinc/36/29/96/334362996.db2.gz WRLUFPOTQNIZOJ-OAHLLOKOSA-N 1 2 322.330 4.317 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NC(=O)[C@@H]2CCCC(C)(C)C2)c1 ZINC000535126404 334371363 /nfs/dbraw/zinc/37/13/63/334371363.db2.gz UUVKWWLGGIHING-OAHLLOKOSA-N 1 2 311.429 4.242 20 0 DIADLO O=C(C[C@@H]1C[C@@H]1c1ccccc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000340898069 334389241 /nfs/dbraw/zinc/38/92/41/334389241.db2.gz NWOLCIMBYIJAHS-QFBILLFUSA-N 1 2 317.392 4.005 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1ncc(Br)s1 ZINC000340945303 334395732 /nfs/dbraw/zinc/39/57/32/334395732.db2.gz HJSQKFDCPXRVKJ-MRVPVSSYSA-N 1 2 317.277 4.160 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1ncc(Br)s1 ZINC000340945303 334395734 /nfs/dbraw/zinc/39/57/34/334395734.db2.gz HJSQKFDCPXRVKJ-MRVPVSSYSA-N 1 2 317.277 4.160 20 0 DIADLO O=C(C[C@@H]1C[C@H]1c1ccccc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000340951094 334396060 /nfs/dbraw/zinc/39/60/60/334396060.db2.gz JRYUGAPVMBQOCI-LPHOPBHVSA-N 1 2 317.392 4.005 20 0 DIADLO Fc1ccc2cc[nH+]c(NCc3nccn3-c3ccccc3)c2c1 ZINC000340913298 334397377 /nfs/dbraw/zinc/39/73/77/334397377.db2.gz VWFBBLVWDAMNRL-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO Cc1cc(C)cc(NC(=O)C[C@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000340977069 334401182 /nfs/dbraw/zinc/40/11/82/334401182.db2.gz ARJMECIOFXMTMX-SFHVURJKSA-N 1 2 319.408 4.187 20 0 DIADLO CC[C@@H]([NH2+]Cc1noc(-c2ccccc2C)n1)c1ccccc1 ZINC000341217934 334418701 /nfs/dbraw/zinc/41/87/01/334418701.db2.gz ZVRGECWJWDTPEW-QGZVFWFLSA-N 1 2 307.397 4.286 20 0 DIADLO Cc1c[nH+]c(CNc2ccc3nc(C(C)(C)C)sc3c2)n1C ZINC000341390275 334438235 /nfs/dbraw/zinc/43/82/35/334438235.db2.gz JZGHBKMONSCOJB-UHFFFAOYSA-N 1 2 314.458 4.248 20 0 DIADLO C[C@H](SCCn1cc[nH+]c1)c1ccccc1Br ZINC000341446747 334441061 /nfs/dbraw/zinc/44/10/61/334441061.db2.gz FMEJJKKOZPOSSY-NSHDSACASA-N 1 2 311.248 4.140 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2ccc(-c3csc(C)n3)cc2)o1 ZINC000341589747 334459568 /nfs/dbraw/zinc/45/95/68/334459568.db2.gz GMNDOZNSAJVQEO-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2ccccc2Oc2ccccc2)o1 ZINC000341636423 334467289 /nfs/dbraw/zinc/46/72/89/334467289.db2.gz IEWOBLMZSGYROB-CQSZACIVSA-N 1 2 323.396 4.275 20 0 DIADLO CCC[C@H]([NH2+]Cc1nccc(C)n1)c1cccc(C(F)(F)F)c1 ZINC000341643583 334468052 /nfs/dbraw/zinc/46/80/52/334468052.db2.gz VYVDYAYPYLPCII-HNNXBMFYSA-N 1 2 323.362 4.435 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)nc1 ZINC000341787225 334481173 /nfs/dbraw/zinc/48/11/73/334481173.db2.gz FOOMCPCXQMQMRU-AWEZNQCLSA-N 1 2 301.459 4.136 20 0 DIADLO CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1noc(-c2ccccc2)n1 ZINC000341908142 334490921 /nfs/dbraw/zinc/49/09/21/334490921.db2.gz JHUDFYBMEUDDGH-KGLIPLIRSA-N 1 2 322.412 4.106 20 0 DIADLO Cc1nc(CN(C)c2cc[nH+]c3c(Cl)cccc23)cs1 ZINC000341926014 334495307 /nfs/dbraw/zinc/49/53/07/334495307.db2.gz ISFPZECWWLGYQF-UHFFFAOYSA-N 1 2 303.818 4.290 20 0 DIADLO COc1cc[nH+]cc1CSCCOc1ccccc1Cl ZINC000341957293 334497521 /nfs/dbraw/zinc/49/75/21/334497521.db2.gz OPKNOHQTUKUPPZ-UHFFFAOYSA-N 1 2 309.818 4.056 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC000342066705 334506365 /nfs/dbraw/zinc/50/63/65/334506365.db2.gz JICYZJXRUROWNP-GJZGRUSLSA-N 1 2 307.397 4.457 20 0 DIADLO CC(C)(CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000342135376 334513295 /nfs/dbraw/zinc/51/32/95/334513295.db2.gz KLEQNZWLOINBEK-UHFFFAOYSA-N 1 2 319.408 4.179 20 0 DIADLO CC[C@@H](Nc1[nH+]ccc(C)c1Br)c1c(C)noc1C ZINC000342703722 334567116 /nfs/dbraw/zinc/56/71/16/334567116.db2.gz QTWOCIZBSPYDGL-LLVKDONJSA-N 1 2 324.222 4.321 20 0 DIADLO Cc1c[nH+]c(CN2CCc3cc(Cl)cc(Cl)c3[C@H]2C)n1C ZINC000342797181 334572258 /nfs/dbraw/zinc/57/22/58/334572258.db2.gz FCNAWTGOTVNKBK-LLVKDONJSA-N 1 2 324.255 4.155 20 0 DIADLO CO[C@@H](CCNc1cc[nH+]c2c(Cl)cccc12)C(F)(F)F ZINC000342968688 334595224 /nfs/dbraw/zinc/59/52/24/334595224.db2.gz ZTCIJHAEZRQVPR-LBPRGKRZSA-N 1 2 318.726 4.268 20 0 DIADLO Cc1ccc(C(=O)N2C[C@H](C)[C@H](C)[C@H]2C)cc1Oc1cc[nH+]cc1 ZINC000416071817 334649561 /nfs/dbraw/zinc/64/95/61/334649561.db2.gz MATMVWYZTDHUNO-HRCADAONSA-N 1 2 324.424 4.299 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@H]1CCC[C@@H]1C(C)(C)C ZINC000417126148 334696899 /nfs/dbraw/zinc/69/68/99/334696899.db2.gz PGUNAPXVUZVTNW-GJZGRUSLSA-N 1 2 303.450 4.377 20 0 DIADLO CC(C)n1c[nH+]cc1CN(Cc1ccco1)Cc1cccs1 ZINC000425328297 334769881 /nfs/dbraw/zinc/76/98/81/334769881.db2.gz TWQGXAITWIGISD-UHFFFAOYSA-N 1 2 315.442 4.321 20 0 DIADLO CC(C)n1c[nH+]cc1CN(C)[C@H](c1ccccc1)C(F)(F)F ZINC000425330458 334770181 /nfs/dbraw/zinc/77/01/81/334770181.db2.gz VSUCVJRMYCBYMR-OAHLLOKOSA-N 1 2 311.351 4.199 20 0 DIADLO Cc1oc2ccccc2c1C[NH2+][C@@H](c1ncc[nH]1)c1ccccc1 ZINC000188478030 334773314 /nfs/dbraw/zinc/77/33/14/334773314.db2.gz MNJMOBBWFLMNQG-LJQANCHMSA-N 1 2 317.392 4.344 20 0 DIADLO CCC[C@@]1(C(F)(F)F)CCCN1Cc1c[nH+]cn1C(C)C ZINC000425338834 334801521 /nfs/dbraw/zinc/80/15/21/334801521.db2.gz QESXEEFAWLEGRF-AWEZNQCLSA-N 1 2 303.372 4.161 20 0 DIADLO C[C@@H]1[C@H](Cc2ccccc2)CCN1c1cc[nH+]c2ccncc21 ZINC000444071855 338467924 /nfs/dbraw/zinc/46/79/24/338467924.db2.gz GWTXMBKPARNAPS-WBVHZDCISA-N 1 2 303.409 4.087 20 0 DIADLO C[C@H]1C[C@H](c2ccc(F)cc2)CN1c1cc[nH+]c2ccncc21 ZINC000444092251 338468119 /nfs/dbraw/zinc/46/81/19/338468119.db2.gz SKSJFVHQOMRNLE-ZFWWWQNUSA-N 1 2 307.372 4.151 20 0 DIADLO CC(C)n1c[nH+]cc1CN1CCCSc2ccc(F)cc21 ZINC000425387697 334862305 /nfs/dbraw/zinc/86/23/05/334862305.db2.gz VMEPDWVDVBIXMT-UHFFFAOYSA-N 1 2 305.422 4.106 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](c2ccccc2Cl)C(C)C)s1 ZINC000343699712 335189154 /nfs/dbraw/zinc/18/91/54/335189154.db2.gz VCIYHQGXEHSNBV-OAHLLOKOSA-N 1 2 309.866 4.241 20 0 DIADLO CN(C[C@H]1CC=CCC1)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000343812136 335194927 /nfs/dbraw/zinc/19/49/27/335194927.db2.gz AYENVJQSRKKNQC-INIZCTEOSA-N 1 2 322.408 4.302 20 0 DIADLO Cc1cccc(Oc2ccccc2NC(=O)CCn2cc[nH+]c2)c1 ZINC000343843216 335196544 /nfs/dbraw/zinc/19/65/44/335196544.db2.gz BUPGDZGPTGJUMA-UHFFFAOYSA-N 1 2 321.380 4.013 20 0 DIADLO C[C@@H](Nc1[nH+]ccc2ccc(F)cc21)c1c(F)cncc1F ZINC000343881819 335199443 /nfs/dbraw/zinc/19/94/43/335199443.db2.gz YSVFJCRIXFILLL-SECBINFHSA-N 1 2 303.287 4.220 20 0 DIADLO C[C@H]([NH2+]Cc1nccn1C)c1cc2c(ccc3ccccc23)o1 ZINC000344079611 335215943 /nfs/dbraw/zinc/21/59/43/335215943.db2.gz TZQKINIYPJFELR-ZDUSSCGKSA-N 1 2 305.381 4.170 20 0 DIADLO COC[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1cccc(Cl)c1 ZINC000344198424 335224504 /nfs/dbraw/zinc/22/45/04/335224504.db2.gz OUEZLLRYTCAOBO-CQSZACIVSA-N 1 2 322.861 4.151 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCCc3occc3C2)cs1 ZINC000344238867 335231133 /nfs/dbraw/zinc/23/11/33/335231133.db2.gz BMXSQRRWFBDLGA-UHFFFAOYSA-N 1 2 304.459 4.273 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCCc3occc3C2)cs1 ZINC000344238867 335231135 /nfs/dbraw/zinc/23/11/35/335231135.db2.gz BMXSQRRWFBDLGA-UHFFFAOYSA-N 1 2 304.459 4.273 20 0 DIADLO CCC[C@H](NC(=O)c1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000344298820 335238188 /nfs/dbraw/zinc/23/81/88/335238188.db2.gz SNHKWDQTHRBQAP-IBGZPJMESA-N 1 2 319.408 4.144 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[N@H+](C)Cc3ccoc3)o2)cc1C ZINC000344368321 335245111 /nfs/dbraw/zinc/24/51/11/335245111.db2.gz OKHOWUCUFOQWIV-CQSZACIVSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[N@@H+](C)Cc3ccoc3)o2)cc1C ZINC000344368321 335245112 /nfs/dbraw/zinc/24/51/12/335245112.db2.gz OKHOWUCUFOQWIV-CQSZACIVSA-N 1 2 311.385 4.139 20 0 DIADLO CC(C)n1cc[nH+]c1CN1CC[C@H](C)Sc2ccccc21 ZINC000344437133 335253975 /nfs/dbraw/zinc/25/39/75/335253975.db2.gz OZNATHVVJSXJKX-AWEZNQCLSA-N 1 2 301.459 4.355 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+]Cc2cc3cc(F)ccc3o2)s1 ZINC000344685285 335266395 /nfs/dbraw/zinc/26/63/95/335266395.db2.gz QJPGJPCTZDIINR-UHFFFAOYSA-N 1 2 319.405 4.011 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C)cs1)c1nc(C(F)(F)F)cs1 ZINC000344722230 335271391 /nfs/dbraw/zinc/27/13/91/335271391.db2.gz JSZXUODYLVGNOB-MRVPVSSYSA-N 1 2 321.393 4.168 20 0 DIADLO CCc1nnc(C[N@H+](C)[C@H](c2ccccc2Cl)C(C)C)o1 ZINC000113256423 335283575 /nfs/dbraw/zinc/28/35/75/335283575.db2.gz WZRVFVTYYKJQNR-INIZCTEOSA-N 1 2 307.825 4.115 20 0 DIADLO CCc1nnc(C[N@@H+](C)[C@H](c2ccccc2Cl)C(C)C)o1 ZINC000113256423 335283576 /nfs/dbraw/zinc/28/35/76/335283576.db2.gz WZRVFVTYYKJQNR-INIZCTEOSA-N 1 2 307.825 4.115 20 0 DIADLO CC1(C)C[C@@H]([NH2+]Cc2c(F)cccc2F)c2ccc(F)cc2O1 ZINC000345032950 335293566 /nfs/dbraw/zinc/29/35/66/335293566.db2.gz YFNSIQNVTDWZSW-MRXNPFEDSA-N 1 2 321.342 4.496 20 0 DIADLO C[N@@H+](Cc1ccoc1)Cc1cc(-c2ccc(Cl)cc2)no1 ZINC000345090950 335297849 /nfs/dbraw/zinc/29/78/49/335297849.db2.gz MBGCUZAWECPEIT-UHFFFAOYSA-N 1 2 302.761 4.220 20 0 DIADLO C[N@H+](Cc1ccoc1)Cc1cc(-c2ccc(Cl)cc2)no1 ZINC000345090950 335297850 /nfs/dbraw/zinc/29/78/50/335297850.db2.gz MBGCUZAWECPEIT-UHFFFAOYSA-N 1 2 302.761 4.220 20 0 DIADLO C[N@@H+](Cc1csc(C2CCCCC2)n1)C[C@@H]1CCCCO1 ZINC000345310320 335316095 /nfs/dbraw/zinc/31/60/95/335316095.db2.gz WFYFKRDDSRHHSI-INIZCTEOSA-N 1 2 308.491 4.192 20 0 DIADLO C[N@H+](Cc1csc(C2CCCCC2)n1)C[C@@H]1CCCCO1 ZINC000345310320 335316096 /nfs/dbraw/zinc/31/60/96/335316096.db2.gz WFYFKRDDSRHHSI-INIZCTEOSA-N 1 2 308.491 4.192 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cccc(Cl)c1)c1nc(C2CC2)no1 ZINC000113357167 335325658 /nfs/dbraw/zinc/32/56/58/335325658.db2.gz KQJPUMBVAYMBDF-CQSZACIVSA-N 1 2 305.809 4.087 20 0 DIADLO Cc1ccc(CNc2ccc(Oc3cccnc3)cc2)c(C)[nH+]1 ZINC000345479113 335328775 /nfs/dbraw/zinc/32/87/75/335328775.db2.gz MBKMHAZMHVAXBY-UHFFFAOYSA-N 1 2 305.381 4.498 20 0 DIADLO COc1cc[nH+]cc1NC(=O)C[C@H]1C[C@@H](C(C)C)c2ccccc21 ZINC000345739811 335347105 /nfs/dbraw/zinc/34/71/05/335347105.db2.gz KJOFPNXFQFVJPA-PBHICJAKSA-N 1 2 324.424 4.346 20 0 DIADLO C[C@@H]1CCc2nc(C[NH2+]Cc3ccc4ccccc4n3)sc2C1 ZINC000345814164 335353079 /nfs/dbraw/zinc/35/30/79/335353079.db2.gz GHYVDXCDGFFEEX-CYBMUJFWSA-N 1 2 323.465 4.106 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)C[C@H]1C[C@@H](C(C)C)c2ccccc21 ZINC000345906764 335360056 /nfs/dbraw/zinc/36/00/56/335360056.db2.gz OOMXXTPNTAVQRX-QAPCUYQASA-N 1 2 308.425 4.068 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)CCc2[nH]cc[nH+]2)cc1 ZINC000346145601 335381279 /nfs/dbraw/zinc/38/12/79/335381279.db2.gz ZYPSXYVSSUNNMC-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO CCc1cnc(C[N@H+](C)[C@@H](C)c2sc(CC)nc2C)s1 ZINC000346190143 335388302 /nfs/dbraw/zinc/38/83/02/335388302.db2.gz VYKDIOIDMHIBCZ-NSHDSACASA-N 1 2 309.504 4.226 20 0 DIADLO CCc1cnc(C[N@@H+](C)[C@@H](C)c2sc(CC)nc2C)s1 ZINC000346190143 335388304 /nfs/dbraw/zinc/38/83/04/335388304.db2.gz VYKDIOIDMHIBCZ-NSHDSACASA-N 1 2 309.504 4.226 20 0 DIADLO CC[N@H+](Cc1ccc(F)cn1)Cc1ccccc1Br ZINC000346276110 335391563 /nfs/dbraw/zinc/39/15/63/335391563.db2.gz KNKHHGZIHIHYHR-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1ccc(F)cn1)Cc1ccccc1Br ZINC000346276110 335391564 /nfs/dbraw/zinc/39/15/64/335391564.db2.gz KNKHHGZIHIHYHR-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2ccsc2)c2cccnc2)c(F)c1 ZINC000346436861 335407788 /nfs/dbraw/zinc/40/77/88/335407788.db2.gz FGSOKVJSTYIJDD-QGZVFWFLSA-N 1 2 316.376 4.301 20 0 DIADLO Cc1cccc2[nH+]c(CSc3ccc(N)cc3Cl)cn21 ZINC000347743827 335526301 /nfs/dbraw/zinc/52/63/01/335526301.db2.gz KBTBZEGPNIHQHF-UHFFFAOYSA-N 1 2 303.818 4.171 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)o1)c1nc(-c2ccncc2)cs1 ZINC000347837762 335531550 /nfs/dbraw/zinc/53/15/50/335531550.db2.gz LIIVCCNBCCPYLA-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO Cc1ccccc1[C@@H](CC(C)C)NC(=O)Nc1cc[nH+]cc1C ZINC000348848800 335613297 /nfs/dbraw/zinc/61/32/97/335613297.db2.gz OFQFEQUBMMGCLB-GOSISDBHSA-N 1 2 311.429 4.029 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(-c2ncc(C(C)C)o2)cc1 ZINC000417841750 335643709 /nfs/dbraw/zinc/64/37/09/335643709.db2.gz TXLMYNHLLGJQOD-UHFFFAOYSA-N 1 2 310.401 4.294 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+]Cc1ncc(Cl)s1 ZINC000349570099 335681810 /nfs/dbraw/zinc/68/18/10/335681810.db2.gz QWDNVFGXRPFJAW-LBPRGKRZSA-N 1 2 310.850 4.436 20 0 DIADLO CCSc1cccc(C[NH2+]Cc2csc([C@@H](C)OC)n2)c1 ZINC000349648365 335688331 /nfs/dbraw/zinc/68/83/31/335688331.db2.gz ZDRFFAWTURHNER-GFCCVEGCSA-N 1 2 322.499 4.252 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)C(C1CCC1)C1CCC1 ZINC000350000082 335716967 /nfs/dbraw/zinc/71/69/67/335716967.db2.gz HJSMBKCUJHNTJO-UHFFFAOYSA-N 1 2 309.413 4.027 20 0 DIADLO CCCOc1cccc2c(N(C)Cc3ccncc3)cc[nH+]c12 ZINC000350257723 335740165 /nfs/dbraw/zinc/74/01/65/335740165.db2.gz VZVVQQMZQBJJIS-UHFFFAOYSA-N 1 2 307.397 4.055 20 0 DIADLO CCc1cc(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)on1 ZINC000535717046 335742315 /nfs/dbraw/zinc/74/23/15/335742315.db2.gz DQXKXNRMOHSPKU-IBGZPJMESA-N 1 2 310.372 4.255 20 0 DIADLO Cc1ccc([C@H]2CCCCN2C(=O)Nc2cc(C)[nH+]cc2C)cc1 ZINC000535772773 335764384 /nfs/dbraw/zinc/76/43/84/335764384.db2.gz NJXZLFPRZGIBQE-LJQANCHMSA-N 1 2 323.440 4.188 20 0 DIADLO Cc1cc(NC(=O)c2sccc2-c2ccccc2)c(C)c[nH+]1 ZINC000536575328 335840733 /nfs/dbraw/zinc/84/07/33/335840733.db2.gz XWYQQKSGOHLMIL-UHFFFAOYSA-N 1 2 308.406 4.101 20 0 DIADLO CCC[C@H](C)[C@H]1CCCN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000426107488 335914018 /nfs/dbraw/zinc/91/40/18/335914018.db2.gz YPMDUANFZIYKKD-XJKSGUPXSA-N 1 2 314.433 4.075 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@@H](C)c2ccc(F)cc2)c(C)[nH+]1 ZINC000520507673 335984929 /nfs/dbraw/zinc/98/49/29/335984929.db2.gz ITPFTEGJYBJNJE-LLVKDONJSA-N 1 2 300.377 4.278 20 0 DIADLO Cc1ccc(SCC(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)cc1 ZINC000520615557 335995557 /nfs/dbraw/zinc/99/55/57/335995557.db2.gz DLZWLJXFDQALLO-UHFFFAOYSA-N 1 2 323.421 4.116 20 0 DIADLO CSc1ccc(C)c(C(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)c1 ZINC000520615615 335995574 /nfs/dbraw/zinc/99/55/74/335995574.db2.gz KBIFULQFNFHOIZ-UHFFFAOYSA-N 1 2 323.421 4.359 20 0 DIADLO CCC[N@H+](Cc1cocn1)[C@@H](C)c1ccccc1Br ZINC000191928624 336005223 /nfs/dbraw/zinc/00/52/23/336005223.db2.gz NLBTVIGFHOMKJY-LBPRGKRZSA-N 1 2 323.234 4.410 20 0 DIADLO CCC[N@@H+](Cc1cocn1)[C@@H](C)c1ccccc1Br ZINC000191928624 336005224 /nfs/dbraw/zinc/00/52/24/336005224.db2.gz NLBTVIGFHOMKJY-LBPRGKRZSA-N 1 2 323.234 4.410 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc([C@H]2CCC[C@@H](C)C2)n1 ZINC000329630789 336020139 /nfs/dbraw/zinc/02/01/39/336020139.db2.gz VPCCDXUIUNQORS-HIFRSBDPSA-N 1 2 324.428 4.264 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000351333290 336028259 /nfs/dbraw/zinc/02/82/59/336028259.db2.gz UYSNVOGYUCHQGF-UHFFFAOYSA-N 1 2 321.424 4.107 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000351333290 336028260 /nfs/dbraw/zinc/02/82/60/336028260.db2.gz UYSNVOGYUCHQGF-UHFFFAOYSA-N 1 2 321.424 4.107 20 0 DIADLO Cc1nc([C@@H](C)[N@H+]2Cc3ccccc3[C@@H](c3ccccc3)C2)no1 ZINC000351390089 336031825 /nfs/dbraw/zinc/03/18/25/336031825.db2.gz VLDVEIYEIJIBDV-AUUYWEPGSA-N 1 2 319.408 4.087 20 0 DIADLO Cc1nc([C@@H](C)[N@@H+]2Cc3ccccc3[C@@H](c3ccccc3)C2)no1 ZINC000351390089 336031827 /nfs/dbraw/zinc/03/18/27/336031827.db2.gz VLDVEIYEIJIBDV-AUUYWEPGSA-N 1 2 319.408 4.087 20 0 DIADLO c1cn(Cc2ccc(NCc3csc4ccccc34)nc2)c[nH+]1 ZINC000351569074 336045434 /nfs/dbraw/zinc/04/54/34/336045434.db2.gz QVDGQQGQHZMKLJ-UHFFFAOYSA-N 1 2 320.421 4.153 20 0 DIADLO Cc1ccccc1Cc1nnc(C[N@@H+](C)[C@@H](C)c2ccccc2)o1 ZINC000351619912 336051215 /nfs/dbraw/zinc/05/12/15/336051215.db2.gz OAQLCVGFNOUBFT-INIZCTEOSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1ccccc1Cc1nnc(C[N@H+](C)[C@@H](C)c2ccccc2)o1 ZINC000351619912 336051216 /nfs/dbraw/zinc/05/12/16/336051216.db2.gz OAQLCVGFNOUBFT-INIZCTEOSA-N 1 2 321.424 4.162 20 0 DIADLO CC(C)(C)CCc1noc(-c2[nH+]c(C3CC3)n3ccccc23)n1 ZINC000351624866 336052656 /nfs/dbraw/zinc/05/26/56/336052656.db2.gz QJBUETPOVBDDMI-UHFFFAOYSA-N 1 2 310.401 4.240 20 0 DIADLO Fc1ccc(C[N@H+](Cc2nccs2)Cc2ccccc2)cc1 ZINC000351661090 336055870 /nfs/dbraw/zinc/05/58/70/336055870.db2.gz ILARXUZQFQAARL-UHFFFAOYSA-N 1 2 312.413 4.485 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2nccs2)Cc2ccccc2)cc1 ZINC000351661090 336055871 /nfs/dbraw/zinc/05/58/71/336055871.db2.gz ILARXUZQFQAARL-UHFFFAOYSA-N 1 2 312.413 4.485 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1ccccc1)Cc1ccncc1 ZINC000351666108 336056170 /nfs/dbraw/zinc/05/61/70/336056170.db2.gz VBHZROZJWPHSOZ-UHFFFAOYSA-N 1 2 306.384 4.423 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1ccccc1)Cc1ccncc1 ZINC000351666108 336056172 /nfs/dbraw/zinc/05/61/72/336056172.db2.gz VBHZROZJWPHSOZ-UHFFFAOYSA-N 1 2 306.384 4.423 20 0 DIADLO Clc1ccc(-c2cnc(SCCCn3cc[nH+]c3)o2)cc1 ZINC000351672123 336056745 /nfs/dbraw/zinc/05/67/45/336056745.db2.gz GNBIDXKTDNDKRY-UHFFFAOYSA-N 1 2 319.817 4.374 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)Cc2ccsc2C)cs1 ZINC000351671861 336056838 /nfs/dbraw/zinc/05/68/38/336056838.db2.gz AFVXVEOKUKRJBE-NSHDSACASA-N 1 2 310.488 4.243 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)Cc2ccsc2C)cs1 ZINC000351671861 336056839 /nfs/dbraw/zinc/05/68/39/336056839.db2.gz AFVXVEOKUKRJBE-NSHDSACASA-N 1 2 310.488 4.243 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(O)c2Cl)C[C@@H](c2ccsc2)O1 ZINC000351686348 336057704 /nfs/dbraw/zinc/05/77/04/336057704.db2.gz QSNSDIHPZXDNFL-ABAIWWIYSA-N 1 2 323.845 4.069 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(O)c2Cl)C[C@@H](c2ccsc2)O1 ZINC000351686348 336057706 /nfs/dbraw/zinc/05/77/06/336057706.db2.gz QSNSDIHPZXDNFL-ABAIWWIYSA-N 1 2 323.845 4.069 20 0 DIADLO Cc1ccc(-c2noc(C3CCCCC3)n2)c(N2CCCC2)[nH+]1 ZINC000329706829 336061437 /nfs/dbraw/zinc/06/14/37/336061437.db2.gz KFBFWIISYSZYTM-UHFFFAOYSA-N 1 2 312.417 4.088 20 0 DIADLO CC(C)c1cc(N2CCCC[C@H]2c2cc[nH]n2)nc(C(C)C)[nH+]1 ZINC000329764979 336079281 /nfs/dbraw/zinc/07/92/81/336079281.db2.gz WLGPJUJGKPESFX-INIZCTEOSA-N 1 2 313.449 4.178 20 0 DIADLO CC[C@@H]1CCCN1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000351895421 336111894 /nfs/dbraw/zinc/11/18/94/336111894.db2.gz ZUYDMRJXHAIZCK-OAHLLOKOSA-N 1 2 311.385 4.280 20 0 DIADLO CSCc1cccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000526106651 336120169 /nfs/dbraw/zinc/12/01/69/336120169.db2.gz VRZPGGCLKALWGJ-QGZVFWFLSA-N 1 2 309.438 4.474 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CCCc3ccccc32)c(C)[nH+]1 ZINC000332181750 336161832 /nfs/dbraw/zinc/16/18/32/336161832.db2.gz VTROXPFYZWRUJB-QGZVFWFLSA-N 1 2 309.413 4.206 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000332484319 336172956 /nfs/dbraw/zinc/17/29/56/336172956.db2.gz NIOBKLSGNDRWPV-ARFHVFGLSA-N 1 2 301.434 4.179 20 0 DIADLO Cc1ccccc1[C@H](CC(C)C)NC(=O)c1ccc2[nH+]ccn2c1 ZINC000351956298 336182600 /nfs/dbraw/zinc/18/26/00/336182600.db2.gz NGJKCRMBWXSEOX-SFHVURJKSA-N 1 2 321.424 4.160 20 0 DIADLO Cc1ccc(C)n1C1CC[NH+](Cc2ncc(Cl)s2)CC1 ZINC000351998420 336187191 /nfs/dbraw/zinc/18/71/91/336187191.db2.gz ZSAMFPXFNHWCHQ-UHFFFAOYSA-N 1 2 309.866 4.052 20 0 DIADLO CCCn1c(C[N@@H+]2CCC[C@@H]2c2cc(C)no2)nc2ccccc21 ZINC000352086191 336194158 /nfs/dbraw/zinc/19/41/58/336194158.db2.gz AUMCRAUBKZXHGT-QGZVFWFLSA-N 1 2 324.428 4.080 20 0 DIADLO CCCn1c(C[N@H+]2CCC[C@@H]2c2cc(C)no2)nc2ccccc21 ZINC000352086191 336194159 /nfs/dbraw/zinc/19/41/59/336194159.db2.gz AUMCRAUBKZXHGT-QGZVFWFLSA-N 1 2 324.428 4.080 20 0 DIADLO CC1(C2CC2)CC[NH+](Cc2nc(C(F)(F)F)cs2)CC1 ZINC000352175803 336199031 /nfs/dbraw/zinc/19/90/31/336199031.db2.gz JHWCNIOUFLOZGF-UHFFFAOYSA-N 1 2 304.381 4.174 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)N1CCC12CCC2 ZINC000333376862 336202653 /nfs/dbraw/zinc/20/26/53/336202653.db2.gz WTYJBTICJOPARA-UHFFFAOYSA-N 1 2 309.369 4.034 20 0 DIADLO Cc1ccc(-c2noc([C@@]3(C)CC=CCC3)n2)c(N2CCCC2)[nH+]1 ZINC000333851750 336211273 /nfs/dbraw/zinc/21/12/73/336211273.db2.gz POMLLDYKFJWOMX-IBGZPJMESA-N 1 2 324.428 4.038 20 0 DIADLO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1nccn1-c1ccccc1 ZINC000352334901 336213096 /nfs/dbraw/zinc/21/30/96/336213096.db2.gz MWMUBSUDLOWMQY-VKJFTORMSA-N 1 2 321.424 4.440 20 0 DIADLO CCCc1nc(C(=O)Nc2ccc3[nH]c(C4CCC4)[nH+]c3c2)co1 ZINC000352425361 336217896 /nfs/dbraw/zinc/21/78/96/336217896.db2.gz YSXGAEUKXPHFAH-UHFFFAOYSA-N 1 2 324.384 4.023 20 0 DIADLO Fc1cc(Cl)ccc1C[N@@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000352447964 336219497 /nfs/dbraw/zinc/21/94/97/336219497.db2.gz PLAAIQNYBVDDOL-JKSUJKDBSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cc(Cl)ccc1C[N@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000352447964 336219498 /nfs/dbraw/zinc/21/94/98/336219498.db2.gz PLAAIQNYBVDDOL-JKSUJKDBSA-N 1 2 309.812 4.013 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1nc(-c2cccs2)oc1C ZINC000193995213 336222804 /nfs/dbraw/zinc/22/28/04/336222804.db2.gz MAVZHPWXGDCIEP-UHFFFAOYSA-N 1 2 302.399 4.245 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1nc(-c2cccs2)oc1C ZINC000193995213 336222803 /nfs/dbraw/zinc/22/28/03/336222803.db2.gz MAVZHPWXGDCIEP-UHFFFAOYSA-N 1 2 302.399 4.245 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[N@@H+]1CCC=C(c2ccco2)C1 ZINC000352543543 336223576 /nfs/dbraw/zinc/22/35/76/336223576.db2.gz GJIQKDDQIUYTMX-CQSZACIVSA-N 1 2 321.380 4.180 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[N@H+]1CCC=C(c2ccco2)C1 ZINC000352543543 336223577 /nfs/dbraw/zinc/22/35/77/336223577.db2.gz GJIQKDDQIUYTMX-CQSZACIVSA-N 1 2 321.380 4.180 20 0 DIADLO C[C@H]1CCC[C@@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000352764191 336233728 /nfs/dbraw/zinc/23/37/28/336233728.db2.gz VFVWFDNDBIZHKJ-GOEBONIOSA-N 1 2 310.397 4.182 20 0 DIADLO CCCN(CC(C)C)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000352763673 336233730 /nfs/dbraw/zinc/23/37/30/336233730.db2.gz QHARYPQMAWJLNG-UHFFFAOYSA-N 1 2 312.413 4.382 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C(C)C)c(C)s1)c1ccc(F)cn1 ZINC000352754584 336234941 /nfs/dbraw/zinc/23/49/41/336234941.db2.gz VHNOWNIORVRGSN-ZDUSSCGKSA-N 1 2 307.438 4.350 20 0 DIADLO c1ccc(C[C@@H]([NH2+]Cc2nc(C3CC3)no2)c2ccccc2)cc1 ZINC000352757555 336235288 /nfs/dbraw/zinc/23/52/88/336235288.db2.gz KEZSKUZTMITQSF-GOSISDBHSA-N 1 2 319.408 4.021 20 0 DIADLO C[N@H+](Cc1ccc(F)cc1)Cc1ccccc1Br ZINC000042206037 336237285 /nfs/dbraw/zinc/23/72/85/336237285.db2.gz XDLXYURCYXPPHM-UHFFFAOYSA-N 1 2 308.194 4.220 20 0 DIADLO C[N@@H+](Cc1ccc(F)cc1)Cc1ccccc1Br ZINC000042206037 336237286 /nfs/dbraw/zinc/23/72/86/336237286.db2.gz XDLXYURCYXPPHM-UHFFFAOYSA-N 1 2 308.194 4.220 20 0 DIADLO C[C@@H]1CC[C@@H](c2ccccc2)[N@H+](Cc2nccn2C(F)F)C1 ZINC000352799194 336238495 /nfs/dbraw/zinc/23/84/95/336238495.db2.gz FQPLJCZLHBVVPY-HIFRSBDPSA-N 1 2 305.372 4.251 20 0 DIADLO C[C@@H]1CC[C@@H](c2ccccc2)[N@@H+](Cc2nccn2C(F)F)C1 ZINC000352799194 336238496 /nfs/dbraw/zinc/23/84/96/336238496.db2.gz FQPLJCZLHBVVPY-HIFRSBDPSA-N 1 2 305.372 4.251 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C3CC3)no2)cc1 ZINC000103499728 336242035 /nfs/dbraw/zinc/24/20/35/336242035.db2.gz NNSUZHNSGTWDDB-NWDGAFQWSA-N 1 2 317.458 4.471 20 0 DIADLO CCc1sc(C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)cc1C ZINC000103965995 336244233 /nfs/dbraw/zinc/24/42/33/336244233.db2.gz YHSNHXITZPNMQD-UHFFFAOYSA-N 1 2 311.410 4.261 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+](C)[C@H](C)c2ccccc2F)cc1C ZINC000532473756 336249712 /nfs/dbraw/zinc/24/97/12/336249712.db2.gz QVCQXCRNIAORTD-OAHLLOKOSA-N 1 2 314.404 4.074 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+](C)[C@H](C)c2ccccc2F)cc1C ZINC000532473756 336249713 /nfs/dbraw/zinc/24/97/13/336249713.db2.gz QVCQXCRNIAORTD-OAHLLOKOSA-N 1 2 314.404 4.074 20 0 DIADLO Cc1cc(C)cc([C@@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)c1 ZINC000532452344 336250153 /nfs/dbraw/zinc/25/01/53/336250153.db2.gz MJPYPGBQGGWTNG-XLIONFOSSA-N 1 2 319.452 4.477 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccccc3OC(C)(C)C)n2c1 ZINC000532496910 336251016 /nfs/dbraw/zinc/25/10/16/336251016.db2.gz UMXQRINGVLXWDK-UHFFFAOYSA-N 1 2 309.413 4.432 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn[nH]1)c1ccc(-c2ccc(F)cc2)s1 ZINC000532515273 336253082 /nfs/dbraw/zinc/25/30/82/336253082.db2.gz HKPYYIUMWYQKAE-LLVKDONJSA-N 1 2 301.390 4.128 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)cc1C ZINC000580389129 336263256 /nfs/dbraw/zinc/26/32/56/336263256.db2.gz MBVOLDHFKFWOAQ-PXNSSMCTSA-N 1 2 319.452 4.477 20 0 DIADLO Brc1csc(C[N@@H+]2CCc3sccc3C2)c1 ZINC000043686947 336270087 /nfs/dbraw/zinc/27/00/87/336270087.db2.gz SHLWOAJVPCMPFK-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO Brc1csc(C[N@H+]2CCc3sccc3C2)c1 ZINC000043686947 336270088 /nfs/dbraw/zinc/27/00/88/336270088.db2.gz SHLWOAJVPCMPFK-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@@H]2c2ccsc2)cc1Cl ZINC000532779559 336270972 /nfs/dbraw/zinc/27/09/72/336270972.db2.gz VAEJQYGWYBBSIR-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@@H]2c2ccsc2)cc1Cl ZINC000532779559 336270973 /nfs/dbraw/zinc/27/09/73/336270973.db2.gz VAEJQYGWYBBSIR-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO FC(F)Oc1cc(NCc2cn3ccccc3[nH+]2)ccc1Cl ZINC000182616013 336276074 /nfs/dbraw/zinc/27/60/74/336276074.db2.gz VNDOQWPEKXLFIQ-UHFFFAOYSA-N 1 2 323.730 4.201 20 0 DIADLO CC(=O)Nc1ccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000192899234 336282487 /nfs/dbraw/zinc/28/24/87/336282487.db2.gz HIOBWEUXLYXDNN-AWEZNQCLSA-N 1 2 320.396 4.004 20 0 DIADLO c1cn(Cc2ccc(CNc3ccc4ccccc4n3)cc2)c[nH+]1 ZINC000301087331 336289277 /nfs/dbraw/zinc/28/92/77/336289277.db2.gz LUYVYYCEAWFFGX-UHFFFAOYSA-N 1 2 314.392 4.092 20 0 DIADLO Cc1cc(NCc2ncc(-c3ccccc3)o2)nc(C(C)C)[nH+]1 ZINC000301091096 336289463 /nfs/dbraw/zinc/28/94/63/336289463.db2.gz OSZDBOWALUSACK-UHFFFAOYSA-N 1 2 308.385 4.176 20 0 DIADLO COc1cccc([C@@H]2CCCN2c2cc(C)[nH+]c(C(C)C)n2)c1 ZINC000301097405 336289953 /nfs/dbraw/zinc/28/99/53/336289953.db2.gz WTYOVGUESXFQCB-KRWDZBQOSA-N 1 2 311.429 4.259 20 0 DIADLO FC(F)Oc1cccc(CNc2ccc3ccccc3[nH+]2)c1 ZINC000301100049 336289974 /nfs/dbraw/zinc/28/99/74/336289974.db2.gz KAEMMSQBJOGAAY-UHFFFAOYSA-N 1 2 300.308 4.448 20 0 DIADLO c1ccc2oc(Nc3ccc([NH2+]C4CCOCC4)cc3)nc2c1 ZINC000301144669 336292002 /nfs/dbraw/zinc/29/20/02/336292002.db2.gz ACIFWBAUAJMHBF-UHFFFAOYSA-N 1 2 309.369 4.162 20 0 DIADLO O=C(OCc1ccccc1)c1cccc(CNc2cccc[nH+]2)c1 ZINC000301155004 336292232 /nfs/dbraw/zinc/29/22/32/336292232.db2.gz PMPKPFLNEQHGGZ-UHFFFAOYSA-N 1 2 318.376 4.051 20 0 DIADLO CCc1cc(NCc2cccc(Cl)c2)nc(-c2ccncc2)[nH+]1 ZINC000301184261 336293899 /nfs/dbraw/zinc/29/38/99/336293899.db2.gz QTHRYENXKDXQTQ-UHFFFAOYSA-N 1 2 324.815 4.367 20 0 DIADLO CCOc1ccc(CNc2cc(C)[nH+]c(C(C)C)n2)cc1F ZINC000301187392 336293975 /nfs/dbraw/zinc/29/39/75/336293975.db2.gz TUDLMRCUWXKNOP-UHFFFAOYSA-N 1 2 303.381 4.058 20 0 DIADLO CCn1c[nH+]cc1CNc1cccc(-c2ccc3c(c2)CCO3)c1 ZINC000418002535 336295351 /nfs/dbraw/zinc/29/53/51/336295351.db2.gz YFBZOQMBFDXTHQ-UHFFFAOYSA-N 1 2 319.408 4.117 20 0 DIADLO c1ccc2c(c1)cccc2NCCNc1cc[nH+]c(C2CC2)n1 ZINC000301227233 336295641 /nfs/dbraw/zinc/29/56/41/336295641.db2.gz FMKHSJHHRSSSIJ-UHFFFAOYSA-N 1 2 304.397 4.031 20 0 DIADLO Cc1cc(N[C@H](c2ccccc2)C2CC2)nc(-c2ccncc2)[nH+]1 ZINC000301230396 336295765 /nfs/dbraw/zinc/29/57/65/336295765.db2.gz FFBUOIDZICZAPO-LJQANCHMSA-N 1 2 316.408 4.410 20 0 DIADLO Cc1ccc(CNc2nc(-c3ccncc3)[nH+]c(C)c2C)cc1F ZINC000301248511 336296625 /nfs/dbraw/zinc/29/66/25/336296625.db2.gz IMTLHSCVOJBYGG-UHFFFAOYSA-N 1 2 322.387 4.215 20 0 DIADLO Cc1cc(N[C@H]2c3ccccc3C[C@@H]2C)nc(-c2cccnc2)[nH+]1 ZINC000301266790 336297661 /nfs/dbraw/zinc/29/76/61/336297661.db2.gz WQBMSIJABHNUTN-ORAYPTAESA-N 1 2 316.408 4.192 20 0 DIADLO Cc1cc(Br)ccc1CNc1cc[nH+]c(C2CC2)n1 ZINC000301285773 336298789 /nfs/dbraw/zinc/29/87/89/336298789.db2.gz VIMNTSAGTYSIFO-UHFFFAOYSA-N 1 2 318.218 4.037 20 0 DIADLO Fc1ccc2c(c1)[C@@H](Nc1cc[nH+]c(C3CC3)n1)CCS2 ZINC000301297167 336299440 /nfs/dbraw/zinc/29/94/40/336299440.db2.gz WCXBOOSCNXLNEG-ZDUSSCGKSA-N 1 2 301.390 4.142 20 0 DIADLO CC(C)Oc1cccc([C@H](O)CNc2ccc3ccccc3[nH+]2)c1 ZINC000301323501 336300715 /nfs/dbraw/zinc/30/07/15/336300715.db2.gz WAPCPUOOXCQBQR-LJQANCHMSA-N 1 2 322.408 4.168 20 0 DIADLO CCc1cc(N2CCC[C@H]2c2nc3ccccc3s2)nc(C)[nH+]1 ZINC000301339911 336301495 /nfs/dbraw/zinc/30/14/95/336301495.db2.gz HYQPIPKRPBJYDG-HNNXBMFYSA-N 1 2 324.453 4.299 20 0 DIADLO Cc1csc([C@@H]2CCCN(c3cc(C)[nH+]c(C(C)C)n3)C2)n1 ZINC000301409114 336304861 /nfs/dbraw/zinc/30/48/61/336304861.db2.gz NVJFWDPRPXBCGF-CQSZACIVSA-N 1 2 316.474 4.057 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CCN2c2cc[nH+]c(C3CC3)n2)o1 ZINC000301425767 336305914 /nfs/dbraw/zinc/30/59/14/336305914.db2.gz GQUORVALQCPIJG-BBRMVZONSA-N 1 2 311.429 4.487 20 0 DIADLO Clc1ccc2[nH]cc(CCNc3cc[nH+]c(C4CC4)n3)c2c1 ZINC000301432856 336306411 /nfs/dbraw/zinc/30/64/11/336306411.db2.gz GOOUHGWFFRKKIC-UHFFFAOYSA-N 1 2 312.804 4.143 20 0 DIADLO Cc1ccc([C@H]2OCCC[C@H]2CNc2cc[nH+]c(C3CC3)n2)cc1 ZINC000301438119 336306858 /nfs/dbraw/zinc/30/68/58/336306858.db2.gz LFSPCLBMDHSLHY-PKOBYXMFSA-N 1 2 323.440 4.242 20 0 DIADLO Cc1cc(N[C@H](C)c2cccc(-n3ccnc3)c2)nc(C(C)C)[nH+]1 ZINC000301457652 336307977 /nfs/dbraw/zinc/30/79/77/336307977.db2.gz IBBMPBQHZZPWSB-OAHLLOKOSA-N 1 2 321.428 4.267 20 0 DIADLO COc1ccc([C@@H](C)Nc2cc(C(F)(F)F)cc[nH+]2)cc1F ZINC000301508584 336311346 /nfs/dbraw/zinc/31/13/46/336311346.db2.gz DLJXBBRMDDCPSL-SECBINFHSA-N 1 2 314.282 4.421 20 0 DIADLO CCS[C@@H]1CCCCN(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000301509418 336311375 /nfs/dbraw/zinc/31/13/75/336311375.db2.gz KCFAASXHUFXRQJ-GFCCVEGCSA-N 1 2 304.381 4.212 20 0 DIADLO CC[C@@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1nc2ccccc2[nH]1 ZINC000301521720 336312164 /nfs/dbraw/zinc/31/21/64/336312164.db2.gz LPMBMYSZCQVSFW-GFCCVEGCSA-N 1 2 309.417 4.214 20 0 DIADLO COc1ccccc1[C@@H]1CCN(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000301538124 336313248 /nfs/dbraw/zinc/31/32/48/336313248.db2.gz UNLPHUQNRHZKKI-GFCCVEGCSA-N 1 2 322.330 4.103 20 0 DIADLO C[C@@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1nc2ccccc2[nH]1 ZINC000301545405 336313819 /nfs/dbraw/zinc/31/38/19/336313819.db2.gz WPASITRLJXGZOA-SECBINFHSA-N 1 2 306.291 4.150 20 0 DIADLO CC[C@@H](Nc1cc(C)[nH+]c(-c2cccnc2)n1)c1cccs1 ZINC000301558931 336314770 /nfs/dbraw/zinc/31/47/70/336314770.db2.gz ODEKPKIGGOTFLS-CQSZACIVSA-N 1 2 310.426 4.472 20 0 DIADLO CC[C@H](Nc1cc(C)[nH+]c(-c2cccnc2)n1)c1cccs1 ZINC000301558930 336314833 /nfs/dbraw/zinc/31/48/33/336314833.db2.gz ODEKPKIGGOTFLS-AWEZNQCLSA-N 1 2 310.426 4.472 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000301586515 336316607 /nfs/dbraw/zinc/31/66/07/336316607.db2.gz VTVGXFBBHODWQM-IBGZPJMESA-N 1 2 322.383 4.260 20 0 DIADLO Fc1ccc([C@@H]2CCN(c3cc(C(F)(F)F)cc[nH+]3)C2)cc1 ZINC000301589272 336316792 /nfs/dbraw/zinc/31/67/92/336316792.db2.gz XWDWJFPIXDEYLZ-GFCCVEGCSA-N 1 2 310.294 4.233 20 0 DIADLO CC[C@@H](Nc1cc(C)[nH+]c(-c2ccncc2)n1)c1cccs1 ZINC000301597094 336317173 /nfs/dbraw/zinc/31/71/73/336317173.db2.gz ZPGKFUZGUALPSI-CQSZACIVSA-N 1 2 310.426 4.472 20 0 DIADLO Cc1ccc(CCNc2nc(-c3ccc(F)cc3)cs2)c[nH+]1 ZINC000301626330 336319169 /nfs/dbraw/zinc/31/91/69/336319169.db2.gz ZXPULZASVUUYKI-UHFFFAOYSA-N 1 2 313.401 4.307 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)c1cc(C)[nH+]cn1 ZINC000301652564 336320913 /nfs/dbraw/zinc/32/09/13/336320913.db2.gz TVVOOKCCJOXEJH-CQSZACIVSA-N 1 2 324.453 4.414 20 0 DIADLO FC(F)(F)c1csc(Oc2cccc(-n3cc[nH+]c3)c2)n1 ZINC000301665931 336321848 /nfs/dbraw/zinc/32/18/48/336321848.db2.gz CDXMZGZFHWEYEP-UHFFFAOYSA-N 1 2 311.288 4.140 20 0 DIADLO Cc1cc(NC[C@](C)(O)c2ccsc2)c2cccc(F)c2[nH+]1 ZINC000301670266 336322300 /nfs/dbraw/zinc/32/23/00/336322300.db2.gz NLWFCIFDLSIQLC-KRWDZBQOSA-N 1 2 316.401 4.063 20 0 DIADLO COCCOc1ccc(CNc2[nH+]c3ccccc3cc2C)cc1 ZINC000301673682 336322632 /nfs/dbraw/zinc/32/26/32/336322632.db2.gz AWANWENYHIVHJZ-UHFFFAOYSA-N 1 2 322.408 4.181 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCO[C@@H](c2ccsc2)C1 ZINC000301693710 336323880 /nfs/dbraw/zinc/32/38/80/336323880.db2.gz ABFRGSVBWDDXLG-QGZVFWFLSA-N 1 2 310.422 4.183 20 0 DIADLO CC(C)(C)c1nc(N[C@H]2CCOC3(CCCCC3)C2)cc[nH+]1 ZINC000301694873 336323951 /nfs/dbraw/zinc/32/39/51/336323951.db2.gz MIDGYVKHTCYBHB-AWEZNQCLSA-N 1 2 303.450 4.068 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NC[C@@H](CCO)c1ccccc1 ZINC000301713014 336325059 /nfs/dbraw/zinc/32/50/59/336325059.db2.gz IPUFRFIZOFHKRS-GOSISDBHSA-N 1 2 306.409 4.121 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCc1ccn(C2CCCC2)n1 ZINC000301741894 336326909 /nfs/dbraw/zinc/32/69/09/336326909.db2.gz FEXXOLOQOLJDDQ-UHFFFAOYSA-N 1 2 306.413 4.467 20 0 DIADLO C[C@@H](C[C@H](O)c1ccccc1)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000301753514 336327812 /nfs/dbraw/zinc/32/78/12/336327812.db2.gz WCJGAVQCVCQQGT-FZMZJTMJSA-N 1 2 310.319 4.025 20 0 DIADLO Cc1cc(C)n(CCCNc2cc(C(C)C)[nH+]c(C(C)C)n2)n1 ZINC000301821556 336332405 /nfs/dbraw/zinc/33/24/05/336332405.db2.gz MCDFZTXTTIZOIH-UHFFFAOYSA-N 1 2 315.465 4.039 20 0 DIADLO C[C@@H](Nc1cc(C(F)(F)F)cc[nH+]1)[C@@H]1COc2ccccc21 ZINC000301825812 336332645 /nfs/dbraw/zinc/33/26/45/336332645.db2.gz IVYYLYGILOLLBK-MFKMUULPSA-N 1 2 308.303 4.077 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NC[C@](C)(O)c1ccc(F)cc1 ZINC000301837431 336333302 /nfs/dbraw/zinc/33/33/02/336333302.db2.gz MOPXBAGMUKBUIP-IBGZPJMESA-N 1 2 310.372 4.002 20 0 DIADLO CC(C)c1cc(N[C@H](C)C[C@H](O)c2ccco2)nc(C(C)C)[nH+]1 ZINC000301846552 336333710 /nfs/dbraw/zinc/33/37/10/336333710.db2.gz BADGXVDYBFUJSD-HIFRSBDPSA-N 1 2 317.433 4.241 20 0 DIADLO CC(C)c1cc(NCc2nc3ccccc3n2C)nc(C(C)C)[nH+]1 ZINC000301860305 336334645 /nfs/dbraw/zinc/33/46/45/336334645.db2.gz DMOAANMNQSQXNE-UHFFFAOYSA-N 1 2 323.444 4.222 20 0 DIADLO c1ccc2oc([C@@H]3CCCN(c4[nH]c5ccccc5[nH+]4)C3)nc2c1 ZINC000301877851 336335754 /nfs/dbraw/zinc/33/57/54/336335754.db2.gz KXCOMRBEKBWFCE-CYBMUJFWSA-N 1 2 318.380 4.088 20 0 DIADLO Cn1c2ccc(Nc3nc4ccccc4o3)cc2[nH+]c1C1CC1 ZINC000301891604 336336607 /nfs/dbraw/zinc/33/66/07/336336607.db2.gz UXAWANOFPLNDLL-UHFFFAOYSA-N 1 2 304.353 4.336 20 0 DIADLO Cc1cccc([C@H](Nc2nc(C)[nH+]c(C)c2C)c2ccccn2)c1 ZINC000301901155 336337324 /nfs/dbraw/zinc/33/73/24/336337324.db2.gz VLLBFOLIANRCLV-IBGZPJMESA-N 1 2 318.424 4.307 20 0 DIADLO CC(C)c1nc(N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)cc[nH+]1 ZINC000301992913 336341991 /nfs/dbraw/zinc/34/19/91/336341991.db2.gz OCKYZPJQRBUMEU-GOEBONIOSA-N 1 2 317.820 4.196 20 0 DIADLO Cc1cccn2cc(CNc3cc4ccccc4c(Cl)n3)[nH+]c12 ZINC000301995842 336342105 /nfs/dbraw/zinc/34/21/05/336342105.db2.gz PMMISOFNMOGRIY-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO Clc1cccc2c1OCCC[C@H]2Nc1cc[nH+]c(C2CC2)n1 ZINC000302038636 336344826 /nfs/dbraw/zinc/34/48/26/336344826.db2.gz VRHOGOBZKIHBJV-CQSZACIVSA-N 1 2 315.804 4.333 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[C@H](Nc1cc[nH+]c(C2CC2)n1)CC3 ZINC000302057586 336346030 /nfs/dbraw/zinc/34/60/30/336346030.db2.gz QHSDMYROWCCENI-CQSZACIVSA-N 1 2 318.424 4.113 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[C@@H](Nc1cc[nH+]c(C2CC2)n1)CC3 ZINC000302057585 336346044 /nfs/dbraw/zinc/34/60/44/336346044.db2.gz QHSDMYROWCCENI-AWEZNQCLSA-N 1 2 318.424 4.113 20 0 DIADLO Cc1cc(NC[C@@H](C)c2nccs2)c2cccc(F)c2[nH+]1 ZINC000302136112 336350143 /nfs/dbraw/zinc/35/01/43/336350143.db2.gz MNNHXFUGPXYECM-SNVBAGLBSA-N 1 2 301.390 4.354 20 0 DIADLO COc1cccc2c1CCN(c1[nH+]c3ccccc3cc1C)C2 ZINC000302140077 336350437 /nfs/dbraw/zinc/35/04/37/336350437.db2.gz FCNVOLGISCSZNI-UHFFFAOYSA-N 1 2 304.393 4.115 20 0 DIADLO CCn1c2ccccc2nc1[C@H](C)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000302368493 336357678 /nfs/dbraw/zinc/35/76/78/336357678.db2.gz GFQVFWOYOGFOMG-ZDUSSCGKSA-N 1 2 323.444 4.317 20 0 DIADLO COc1cccc2c(N[C@@H](C)C[C@H](O)c3ccccc3)cc[nH+]c12 ZINC000302516065 336360541 /nfs/dbraw/zinc/36/05/41/336360541.db2.gz HHEAFIBPSYJZMF-KSSFIOAISA-N 1 2 322.408 4.168 20 0 DIADLO Cc1nc(N2CCC(c3ccsc3)CC2)c2c([nH+]1)CCCC2 ZINC000302514824 336360573 /nfs/dbraw/zinc/36/05/73/336360573.db2.gz XWFHZONCODYTHE-UHFFFAOYSA-N 1 2 313.470 4.109 20 0 DIADLO COc1cccc2c(NCc3ccn(C4CCCC4)n3)cc[nH+]c12 ZINC000302516095 336360607 /nfs/dbraw/zinc/36/06/07/336360607.db2.gz HIIXLQLUWLTUET-UHFFFAOYSA-N 1 2 322.412 4.167 20 0 DIADLO Oc1cccc2c1CCC[C@H]2Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000302727741 336366730 /nfs/dbraw/zinc/36/67/30/336366730.db2.gz QBOPFEZLQYEADE-CYBMUJFWSA-N 1 2 308.303 4.296 20 0 DIADLO CC1=CC[N@H+]([C@H](C)c2nnc(-c3ccccc3F)s2)CC1 ZINC000514118942 336369954 /nfs/dbraw/zinc/36/99/54/336369954.db2.gz OVXSAZKVHFMGLR-GFCCVEGCSA-N 1 2 303.406 4.057 20 0 DIADLO CC1=CC[N@@H+]([C@H](C)c2nnc(-c3ccccc3F)s2)CC1 ZINC000514118942 336369955 /nfs/dbraw/zinc/36/99/55/336369955.db2.gz OVXSAZKVHFMGLR-GFCCVEGCSA-N 1 2 303.406 4.057 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)Nc1cc(N2CCCC2)nc[nH+]1 ZINC000302804999 336370012 /nfs/dbraw/zinc/37/00/12/336370012.db2.gz WJJZXGQDDXVNFM-AWEZNQCLSA-N 1 2 322.412 4.305 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)Nc1cc(N2CCCC2)[nH+]cn1 ZINC000302804999 336370013 /nfs/dbraw/zinc/37/00/13/336370013.db2.gz WJJZXGQDDXVNFM-AWEZNQCLSA-N 1 2 322.412 4.305 20 0 DIADLO CC(C)c1nc(N[C@@H]2CCO[C@@H](C3CC3)C2)cc(C(C)(C)C)[nH+]1 ZINC000302840294 336371670 /nfs/dbraw/zinc/37/16/70/336371670.db2.gz LKTYEVLKAPHISH-HUUCEWRRSA-N 1 2 317.477 4.267 20 0 DIADLO CC(C)c1nc(N[C@@H](CO)c2ccsc2)cc(C(C)(C)C)[nH+]1 ZINC000302843969 336371812 /nfs/dbraw/zinc/37/18/12/336371812.db2.gz NDNVQGYBJHZZMT-ZDUSSCGKSA-N 1 2 319.474 4.105 20 0 DIADLO COC[C@H](Nc1cc[nH+]c(C(C)C)n1)c1ccc(Cl)cc1 ZINC000302858999 336372159 /nfs/dbraw/zinc/37/21/59/336372159.db2.gz NSPRCOLSBVKXGA-AWEZNQCLSA-N 1 2 305.809 4.053 20 0 DIADLO CCOC[C@@H]1CCCN(c2cc(C(C)(C)C)[nH+]c(C(C)C)n2)C1 ZINC000302878277 336373028 /nfs/dbraw/zinc/37/30/28/336373028.db2.gz GJXGSIMALAHIHA-OAHLLOKOSA-N 1 2 319.493 4.150 20 0 DIADLO C[C@H](Nc1nc[nH+]c(N)c1Cl)c1cccc(Cl)c1Cl ZINC000302883895 336373054 /nfs/dbraw/zinc/37/30/54/336373054.db2.gz JVYXXFIQSJIPHQ-LURJTMIESA-N 1 2 317.607 4.192 20 0 DIADLO C[C@H](Nc1[nH+]cnc(N)c1Cl)c1cccc(Cl)c1Cl ZINC000302883895 336373055 /nfs/dbraw/zinc/37/30/55/336373055.db2.gz JVYXXFIQSJIPHQ-LURJTMIESA-N 1 2 317.607 4.192 20 0 DIADLO CC(C)c1nc(NCC(C)(C)C[C@H](C)O)cc(C(C)(C)C)[nH+]1 ZINC000302885311 336373249 /nfs/dbraw/zinc/37/32/49/336373249.db2.gz KRIUDNWLQYXZDB-ZDUSSCGKSA-N 1 2 307.482 4.107 20 0 DIADLO CSc1cccc(F)c1C[NH2+]Cc1csc(C2CC2)n1 ZINC000352902515 336375570 /nfs/dbraw/zinc/37/55/70/336375570.db2.gz NKONXQBUVMIUSD-UHFFFAOYSA-N 1 2 308.447 4.171 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)s1 ZINC000352947184 336378780 /nfs/dbraw/zinc/37/87/80/336378780.db2.gz OXRKORWMDYQZBJ-GXSJLCMTSA-N 1 2 324.437 4.169 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)s1 ZINC000352947184 336378781 /nfs/dbraw/zinc/37/87/81/336378781.db2.gz OXRKORWMDYQZBJ-GXSJLCMTSA-N 1 2 324.437 4.169 20 0 DIADLO CCCc1csc(C[NH2+]Cc2c(F)cccc2SC)n1 ZINC000352956412 336379249 /nfs/dbraw/zinc/37/92/49/336379249.db2.gz UWFCFBICSCMFIV-UHFFFAOYSA-N 1 2 310.463 4.246 20 0 DIADLO Oc1ccc(F)c(C[NH+]2CCC(c3ccsc3)CC2)c1F ZINC000352960095 336379422 /nfs/dbraw/zinc/37/94/22/336379422.db2.gz XAPNZWRUTQXCED-UHFFFAOYSA-N 1 2 309.381 4.112 20 0 DIADLO CC[C@@H](Nc1cc(OC)c(C(C)C)c(OC)c1)c1[nH+]ccn1C ZINC000352972156 336380587 /nfs/dbraw/zinc/38/05/87/336380587.db2.gz WNXBEKNJLNINLO-CQSZACIVSA-N 1 2 317.433 4.124 20 0 DIADLO Cc1nnc([C@@H](C)[NH+]2CCC(=Cc3cccc(F)c3)CC2)s1 ZINC000565155798 336384449 /nfs/dbraw/zinc/38/44/49/336384449.db2.gz GBVCOWBNCGAWBI-GFCCVEGCSA-N 1 2 317.433 4.226 20 0 DIADLO Cc1c[nH]c(C(C)(C)NC(=O)CC(C)(C)C2CCCCC2)[nH+]1 ZINC000563966269 336388836 /nfs/dbraw/zinc/38/88/36/336388836.db2.gz KRWVKXIFIXAXSX-UHFFFAOYSA-N 1 2 305.466 4.066 20 0 DIADLO CCCC1CCC(NC(=O)N2CCCC[C@H]2c2[nH]cc[nH+]2)CC1 ZINC000106543781 336390137 /nfs/dbraw/zinc/39/01/37/336390137.db2.gz PANKBKSXCJZBGC-GPANFISMSA-N 1 2 318.465 4.005 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2sc(Br)cc21)C(C)(F)F ZINC000389437721 336390908 /nfs/dbraw/zinc/39/09/08/336390908.db2.gz FFSGWZYVVPGSSG-SVRRBLITSA-N 1 2 310.207 4.131 20 0 DIADLO Cn1ccnc1[C@@H]([NH2+]Cc1csc(Cl)c1Cl)C1CC1 ZINC000353049333 336391575 /nfs/dbraw/zinc/39/15/75/336391575.db2.gz RWTGVINNDXUCRD-NSHDSACASA-N 1 2 316.257 4.029 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](C)C(C)(F)F)cc1Br ZINC000389474873 336394816 /nfs/dbraw/zinc/39/48/16/336394816.db2.gz XRKJGQJEQGRHBT-IUCAKERBSA-N 1 2 322.193 4.152 20 0 DIADLO CCn1cncc1C[NH2+]C1(c2c(Cl)cccc2Cl)CCC1 ZINC000418034298 336395683 /nfs/dbraw/zinc/39/56/83/336395683.db2.gz OGAQDNIEHGNSMY-UHFFFAOYSA-N 1 2 324.255 4.379 20 0 DIADLO CCOc1ccc([C@H]2CCCN2c2cc[nH+]c(C3CC3)n2)cc1 ZINC000110118725 336395766 /nfs/dbraw/zinc/39/57/66/336395766.db2.gz BSESTVJWLIBCCH-QGZVFWFLSA-N 1 2 309.413 4.094 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c1C ZINC000115602718 336402017 /nfs/dbraw/zinc/40/20/17/336402017.db2.gz AJEJJGGYKCFJKN-UONOGXRCSA-N 1 2 301.434 4.396 20 0 DIADLO CCOc1cccc(C[NH+]2Cc3ccccc3C2)c1OC(F)F ZINC000353398652 336415421 /nfs/dbraw/zinc/41/54/21/336415421.db2.gz AYUHDZUHXKEUDA-UHFFFAOYSA-N 1 2 319.351 4.203 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)[C@H]1Cc2ccccc21 ZINC000353779923 336440232 /nfs/dbraw/zinc/44/02/32/336440232.db2.gz RIADQBPBQOAPST-IBGZPJMESA-N 1 2 316.360 4.152 20 0 DIADLO Cc1oc(C(C)C)cc1C(=O)NCc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000354466679 336471890 /nfs/dbraw/zinc/47/18/90/336471890.db2.gz VXUVIVFJSRRCSJ-UHFFFAOYSA-N 1 2 323.396 4.032 20 0 DIADLO CCc1cnc(CN(C)c2[nH+]ccc3ccc(F)cc32)s1 ZINC000354538276 336474106 /nfs/dbraw/zinc/47/41/06/336474106.db2.gz LWCRLFHPMFLHBX-UHFFFAOYSA-N 1 2 301.390 4.029 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](c2ccc(C)cc2)c2ccccn2)s1 ZINC000355332203 336504512 /nfs/dbraw/zinc/50/45/12/336504512.db2.gz HLYZNGXSEOEIAN-IBGZPJMESA-N 1 2 323.465 4.288 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1coc2cc(F)ccc12 ZINC000355621777 336516745 /nfs/dbraw/zinc/51/67/45/336516745.db2.gz NCPLNMFOLICPCT-UHFFFAOYSA-N 1 2 321.311 4.214 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1cc2cccc(F)c2o1 ZINC000355738179 336520641 /nfs/dbraw/zinc/52/06/41/336520641.db2.gz QQGOHQRXXAOFGB-NXEZZACHSA-N 1 2 315.348 4.244 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ncc(C)o2)cc1OCC ZINC000356268545 336543355 /nfs/dbraw/zinc/54/33/55/336543355.db2.gz MRYBFKWNHADKMH-ZIAGYGMSSA-N 1 2 318.417 4.192 20 0 DIADLO C(=C\c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1)\c1ccsc1 ZINC000356599232 336555829 /nfs/dbraw/zinc/55/58/29/336555829.db2.gz VQCHNNWZEHMCPX-PLNGDYQASA-N 1 2 320.377 4.154 20 0 DIADLO C(=C/c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1)\c1ccsc1 ZINC000356599244 336555863 /nfs/dbraw/zinc/55/58/63/336555863.db2.gz VQCHNNWZEHMCPX-SNAWJCMRSA-N 1 2 320.377 4.154 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1cccnc1)c1ccc(F)cn1 ZINC000356682612 336558089 /nfs/dbraw/zinc/55/80/89/336558089.db2.gz SERFTGIEUMUUSH-LIRRHRJNSA-N 1 2 307.372 4.056 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(-c2ccco2)on1)c1ccc(F)cc1F ZINC000357063706 336572361 /nfs/dbraw/zinc/57/23/61/336572361.db2.gz GTJIAMBNTBPRQM-SNVBAGLBSA-N 1 2 304.296 4.064 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1ccn(-c2ccccc2)n1 ZINC000358505485 336632971 /nfs/dbraw/zinc/63/29/71/336632971.db2.gz INOULZZZBGNRPA-UHFFFAOYSA-N 1 2 322.412 4.057 20 0 DIADLO COc1ccc(OCCSCc2ccc(C)[nH+]c2C)cc1 ZINC000358652431 336638313 /nfs/dbraw/zinc/63/83/13/336638313.db2.gz FABLIHJPJMRWRX-UHFFFAOYSA-N 1 2 303.427 4.019 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc(C2C(C)(C)C2(C)C)n1 ZINC000359119023 336658767 /nfs/dbraw/zinc/65/87/67/336658767.db2.gz HFOUMGYKTGYULP-UHFFFAOYSA-N 1 2 324.428 4.120 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCC[S@@](=O)CCC(C)C ZINC000359917129 336693025 /nfs/dbraw/zinc/69/30/25/336693025.db2.gz LNPBDOFLFJODDT-JOCHJYFZSA-N 1 2 320.502 4.310 20 0 DIADLO CC(C)(C)c1csc(C2CC[NH+](Cc3cscn3)CC2)n1 ZINC000360108726 336702081 /nfs/dbraw/zinc/70/20/81/336702081.db2.gz YOQCSKOKYWMBNS-UHFFFAOYSA-N 1 2 321.515 4.277 20 0 DIADLO Cc1cc(C)cc(C[NH2+][C@@H](c2ccn(C)n2)c2ccc(F)cc2)c1 ZINC000367372050 336726817 /nfs/dbraw/zinc/72/68/17/336726817.db2.gz OYETWKWUMXGDIF-HXUWFJFHSA-N 1 2 323.415 4.055 20 0 DIADLO CN(Cc1[nH]cc[nH+]1)c1cc(C(F)F)nc2ccc(Cl)cc21 ZINC000360910454 336727041 /nfs/dbraw/zinc/72/70/41/336727041.db2.gz SXCXJHVQCXVGBX-UHFFFAOYSA-N 1 2 322.746 4.185 20 0 DIADLO CCc1cnccc1[C@H](C)[NH2+][C@H](C)c1nnc(-c2ccccc2)o1 ZINC000361118258 336739468 /nfs/dbraw/zinc/73/94/68/336739468.db2.gz APFFGFSTZOJAGW-UONOGXRCSA-N 1 2 322.412 4.106 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H]2CCOc3c(F)ccc(F)c32)s1 ZINC000361253846 336747110 /nfs/dbraw/zinc/74/71/10/336747110.db2.gz VDFNFZXMDHLGTK-GFCCVEGCSA-N 1 2 324.396 4.158 20 0 DIADLO Cc1oc2ccccc2c1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000362230984 336788740 /nfs/dbraw/zinc/78/87/40/336788740.db2.gz PQLLJNQMFYREAB-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO CCc1nnc([C@@H](C)[NH+]2CCC(=Cc3ccccc3F)CC2)o1 ZINC000362482340 336799799 /nfs/dbraw/zinc/79/97/99/336799799.db2.gz CVJZEUZRVPSGNL-CYBMUJFWSA-N 1 2 315.392 4.012 20 0 DIADLO CCSCc1cc[nH+]c(NCc2scnc2C2CC2)c1 ZINC000362648687 336807857 /nfs/dbraw/zinc/80/78/57/336807857.db2.gz MZWNVONTMOGYQX-UHFFFAOYSA-N 1 2 305.472 4.281 20 0 DIADLO Clc1scc(C[NH2+]Cc2noc3c2CCCC3)c1Cl ZINC000367958683 336833193 /nfs/dbraw/zinc/83/31/93/336833193.db2.gz RSSYJXMYCBDMLL-UHFFFAOYSA-N 1 2 317.241 4.212 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccn(C)n1)c1ccc(Cl)cc1)c1ccoc1 ZINC000368358907 336843021 /nfs/dbraw/zinc/84/30/21/336843021.db2.gz ZDPJTDRVTUATNX-YVEFUNNKSA-N 1 2 315.804 4.107 20 0 DIADLO Cc1cc(NC(=O)N(C)[C@@H](C)c2ccc(Cl)cc2)cc[nH+]1 ZINC000119430839 336889835 /nfs/dbraw/zinc/88/98/35/336889835.db2.gz XJWYYEYDILOBHX-LBPRGKRZSA-N 1 2 303.793 4.268 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2F)c1 ZINC000370670169 336890532 /nfs/dbraw/zinc/89/05/32/336890532.db2.gz XFDWAFYOKVUMBT-KXBFYZLASA-N 1 2 323.415 4.308 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cccc3[nH]ccc32)[nH+]1 ZINC000371248826 336898490 /nfs/dbraw/zinc/89/84/90/336898490.db2.gz XNZBBQPALNJCMU-UHFFFAOYSA-N 1 2 316.364 4.119 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc(C)c(C)c2)[nH+]1 ZINC000371248318 336898517 /nfs/dbraw/zinc/89/85/17/336898517.db2.gz VFYJRFQBYPJNQX-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000371646703 336909997 /nfs/dbraw/zinc/90/99/97/336909997.db2.gz GWOWNGNXABDKKD-HOTGVXAUSA-N 1 2 305.466 4.112 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccccn2)cs1 ZINC000372075149 336921387 /nfs/dbraw/zinc/92/13/87/336921387.db2.gz GCSIGKJPZXUJHG-ACJLOTCBSA-N 1 2 309.438 4.287 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](c2ccccc2)c2ccccn2)cs1 ZINC000372075152 336921404 /nfs/dbraw/zinc/92/14/04/336921404.db2.gz GCSIGKJPZXUJHG-UGSOOPFHSA-N 1 2 309.438 4.287 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2cccc(-c3ccccn3)c2)s1 ZINC000372185150 336924429 /nfs/dbraw/zinc/92/44/29/336924429.db2.gz IDCMDCCZHOILCI-UHFFFAOYSA-N 1 2 324.453 4.013 20 0 DIADLO CCCCOc1cc(C[NH2+][C@@H](C)c2cscn2)ccc1OC ZINC000582371625 336947611 /nfs/dbraw/zinc/94/76/11/336947611.db2.gz GQRYHYDLVMZTNT-ZDUSSCGKSA-N 1 2 320.458 4.181 20 0 DIADLO Cc1ccc([C@@H]2CCCN2C(=O)Nc2cc[nH+]cc2C)cc1C ZINC000121576594 336964186 /nfs/dbraw/zinc/96/41/86/336964186.db2.gz ZHFAKPQBYUTDGF-SFHVURJKSA-N 1 2 309.413 4.376 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)[C@@H]1CCCCC1(C)C ZINC000373764762 336972202 /nfs/dbraw/zinc/97/22/02/336972202.db2.gz FHPBTPLXXFRQKV-HOTGVXAUSA-N 1 2 317.477 4.173 20 0 DIADLO c1c[nH+]c([C@@H]2CCCN2Cc2csc(C3CCCCC3)n2)[nH]1 ZINC000374856487 336998289 /nfs/dbraw/zinc/99/82/89/336998289.db2.gz LGLCTVJXNZZZNN-HNNXBMFYSA-N 1 2 316.474 4.251 20 0 DIADLO CC(C)c1ccoc1C(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000375044816 337001987 /nfs/dbraw/zinc/00/19/87/337001987.db2.gz UXRZAJNDGPRPHB-UHFFFAOYSA-N 1 2 309.369 4.056 20 0 DIADLO CCc1nc([C@@H](C)Nc2cc[nH+]c3c(OC)cccc23)cs1 ZINC000193482970 337007039 /nfs/dbraw/zinc/00/70/39/337007039.db2.gz BYVUSZPKSYNSCO-LLVKDONJSA-N 1 2 313.426 4.435 20 0 DIADLO C[C@@H]1C[C@@H]1[C@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc(Cl)cc1 ZINC000375782965 337019442 /nfs/dbraw/zinc/01/94/42/337019442.db2.gz PIKNWWXNVWQXBK-HHBBGTKASA-N 1 2 315.848 4.427 20 0 DIADLO C[C@@H]1C[C@@H]1[C@@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc(Cl)cc1 ZINC000375782967 337019480 /nfs/dbraw/zinc/01/94/80/337019480.db2.gz PIKNWWXNVWQXBK-ZHPMQELBSA-N 1 2 315.848 4.427 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccccn2)c1 ZINC000375783403 337019487 /nfs/dbraw/zinc/01/94/87/337019487.db2.gz RKVUQELXXACDEE-UZLBHIALSA-N 1 2 303.409 4.225 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+][C@@H](c2ccccc2)c2ccccn2)c1 ZINC000375783389 337019490 /nfs/dbraw/zinc/01/94/90/337019490.db2.gz RKVUQELXXACDEE-JXFKEZNVSA-N 1 2 303.409 4.225 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCC[C@@H]2c2nccs2)c1 ZINC000376457545 337033843 /nfs/dbraw/zinc/03/38/43/337033843.db2.gz HRLCHNSLZCRUSB-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCC[C@@H]2c2nccs2)c1 ZINC000376457545 337033844 /nfs/dbraw/zinc/03/38/44/337033844.db2.gz HRLCHNSLZCRUSB-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@H]1CCc1ccccc1 ZINC000376596907 337037689 /nfs/dbraw/zinc/03/76/89/337037689.db2.gz GHFZQEQBZNGSHK-SFHVURJKSA-N 1 2 323.440 4.328 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCCCC[C@@H]1c1ccco1 ZINC000376598842 337037712 /nfs/dbraw/zinc/03/77/12/337037712.db2.gz VBFPBXHFYIPCKM-OAHLLOKOSA-N 1 2 313.401 4.441 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@@H](Cc2ccccc2)C1 ZINC000376619359 337038272 /nfs/dbraw/zinc/03/82/72/337038272.db2.gz VFMPVIVQYRREAP-SFHVURJKSA-N 1 2 323.440 4.185 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@@H](c2ccccc2)[C@@H](C)C1 ZINC000376644996 337038905 /nfs/dbraw/zinc/03/89/05/337038905.db2.gz UQGHTTPWNSWGOM-MAUKXSAKSA-N 1 2 323.440 4.356 20 0 DIADLO CC(C)(CC(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1)C1CCCCC1 ZINC000377090050 337046655 /nfs/dbraw/zinc/04/66/55/337046655.db2.gz JMKYRMURSJPXLO-OAHLLOKOSA-N 1 2 303.450 4.070 20 0 DIADLO C[C@@H]1Oc2cc(F)ccc2[C@H]1[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000377383997 337051433 /nfs/dbraw/zinc/05/14/33/337051433.db2.gz UBJSYKBAXKBTBX-SGTLLEGYSA-N 1 2 324.355 4.093 20 0 DIADLO CC(C)(C)c1cc(C[NH+]2CCC(OCC3CCCC3)CC2)no1 ZINC000377867861 337063027 /nfs/dbraw/zinc/06/30/27/337063027.db2.gz CLLGZHZYNAROQP-UHFFFAOYSA-N 1 2 320.477 4.143 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ncoc2-c2ccccc2)o1 ZINC000378153529 337067333 /nfs/dbraw/zinc/06/73/33/337067333.db2.gz JMYPSWFIDUYMDN-BBRMVZONSA-N 1 2 308.381 4.348 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccncc2)cs1 ZINC000378202872 337068190 /nfs/dbraw/zinc/06/81/90/337068190.db2.gz PMQSOYOQXRDLDP-FZKQIMNGSA-N 1 2 309.438 4.287 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2csc(C)c2C)[nH+]1 ZINC000378395489 337071547 /nfs/dbraw/zinc/07/15/47/337071547.db2.gz LSSUXBUHJHANJK-UHFFFAOYSA-N 1 2 311.410 4.316 20 0 DIADLO Cc1cccc(-c2nnc([C@@H](C)[NH2+][C@H](C)c3cccc(O)c3)o2)c1 ZINC000378486841 337073972 /nfs/dbraw/zinc/07/39/72/337073972.db2.gz DYKMYRRYEXIZTN-ZIAGYGMSSA-N 1 2 323.396 4.162 20 0 DIADLO Cc1ccc(C(=O)NCc2ccsc2)cc1Oc1cc[nH+]cc1 ZINC000172060688 337089582 /nfs/dbraw/zinc/08/95/82/337089582.db2.gz XBZZLQBFUWKWLF-UHFFFAOYSA-N 1 2 324.405 4.174 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)Cc2cccc(C)c2)cs1 ZINC000172320106 337091784 /nfs/dbraw/zinc/09/17/84/337091784.db2.gz UUDOKRKQCVDZQH-CQSZACIVSA-N 1 2 304.459 4.181 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)Cc2cccc(C)c2)cs1 ZINC000172320106 337091785 /nfs/dbraw/zinc/09/17/85/337091785.db2.gz UUDOKRKQCVDZQH-CQSZACIVSA-N 1 2 304.459 4.181 20 0 DIADLO FC(F)C[C@H]1COCC[N@@H+]1Cc1ccc(-c2ccccc2)s1 ZINC000582513448 337099710 /nfs/dbraw/zinc/09/97/10/337099710.db2.gz FKUBYOGNEPJOLI-AWEZNQCLSA-N 1 2 323.408 4.271 20 0 DIADLO FC(F)C[C@H]1COCC[N@H+]1Cc1ccc(-c2ccccc2)s1 ZINC000582513448 337099711 /nfs/dbraw/zinc/09/97/11/337099711.db2.gz FKUBYOGNEPJOLI-AWEZNQCLSA-N 1 2 323.408 4.271 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2ccc(Oc3cccnc3)cc2)o1 ZINC000582629173 337116129 /nfs/dbraw/zinc/11/61/29/337116129.db2.gz DGXDQLLFMMUWFC-AWEZNQCLSA-N 1 2 323.396 4.275 20 0 DIADLO C[C@@H](Nc1nc2cc(F)ccc2o1)c1cccc(-n2cc[nH+]c2)c1 ZINC000172788884 337130991 /nfs/dbraw/zinc/13/09/91/337130991.db2.gz LAPJJJOVFPTICH-GFCCVEGCSA-N 1 2 322.343 4.326 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)o1 ZINC000174594270 337142682 /nfs/dbraw/zinc/14/26/82/337142682.db2.gz YQSPNZJNMWXKBX-CYBMUJFWSA-N 1 2 322.412 4.018 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)o1 ZINC000174594270 337142683 /nfs/dbraw/zinc/14/26/83/337142683.db2.gz YQSPNZJNMWXKBX-CYBMUJFWSA-N 1 2 322.412 4.018 20 0 DIADLO Clc1ncc(C[NH2+][C@@H](c2nccs2)c2ccccc2)s1 ZINC000175417234 337145941 /nfs/dbraw/zinc/14/59/41/337145941.db2.gz LITUEPCHXLYDHL-GFCCVEGCSA-N 1 2 321.858 4.132 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CCOC2(CCCCC2)C1 ZINC000175268908 337146625 /nfs/dbraw/zinc/14/66/25/337146625.db2.gz ZUNMEQPBQVZNHR-AWEZNQCLSA-N 1 2 306.450 4.068 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCOC2(CCCCC2)C1 ZINC000175268908 337146626 /nfs/dbraw/zinc/14/66/26/337146626.db2.gz ZUNMEQPBQVZNHR-AWEZNQCLSA-N 1 2 306.450 4.068 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nccn1C)c1cccc(F)c1)c1ccsc1 ZINC000177805804 337157513 /nfs/dbraw/zinc/15/75/13/337157513.db2.gz FKMMFMTYCCFPCE-MLGOLLRUSA-N 1 2 315.417 4.061 20 0 DIADLO CC[C@H](OC1CCCCC1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000177811193 337157640 /nfs/dbraw/zinc/15/76/40/337157640.db2.gz KLXOZTLFDIFFIP-INIZCTEOSA-N 1 2 304.434 4.073 20 0 DIADLO Cc1nc(SCCCn2cc[nH+]c2)n(C2CCCCC2)c1C ZINC000180432602 337174593 /nfs/dbraw/zinc/17/45/93/337174593.db2.gz IDWGAPQUMVSBIY-UHFFFAOYSA-N 1 2 318.490 4.384 20 0 DIADLO Cc1cnc(C[N@@H+]2CCSC[C@@H]2c2ccc(C)cc2)s1 ZINC000180499069 337176083 /nfs/dbraw/zinc/17/60/83/337176083.db2.gz VGXOCYQXZNDNST-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1cnc(C[N@H+]2CCSC[C@@H]2c2ccc(C)cc2)s1 ZINC000180499069 337176084 /nfs/dbraw/zinc/17/60/84/337176084.db2.gz VGXOCYQXZNDNST-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@H]2c2c(C)n[nH]c2C)cs1 ZINC000180519394 337176170 /nfs/dbraw/zinc/17/61/70/337176170.db2.gz MSIYHUZBWWNSEB-HNNXBMFYSA-N 1 2 318.490 4.163 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@H]2c2c(C)n[nH]c2C)cs1 ZINC000180519394 337176171 /nfs/dbraw/zinc/17/61/71/337176171.db2.gz MSIYHUZBWWNSEB-HNNXBMFYSA-N 1 2 318.490 4.163 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1ncc(-c2ccccc2F)o1 ZINC000180796348 337177900 /nfs/dbraw/zinc/17/79/00/337177900.db2.gz IDOAAPNYBREWKC-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1ncc(-c2ccccc2F)o1 ZINC000180796348 337177901 /nfs/dbraw/zinc/17/79/01/337177901.db2.gz IDOAAPNYBREWKC-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)n1 ZINC000180893208 337178400 /nfs/dbraw/zinc/17/84/00/337178400.db2.gz ICERJCRUMLQFCZ-CQSZACIVSA-N 1 2 322.412 4.106 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)n1 ZINC000180919061 337178655 /nfs/dbraw/zinc/17/86/55/337178655.db2.gz WLMVYOPHQQIMEX-KGLIPLIRSA-N 1 2 322.412 4.106 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)oc1C ZINC000180920228 337178692 /nfs/dbraw/zinc/17/86/92/337178692.db2.gz PVVGTOVZOBRTSG-AWEZNQCLSA-N 1 2 307.397 4.204 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](CC2CCC2)c2ccccc2)no1 ZINC000181344688 337181464 /nfs/dbraw/zinc/18/14/64/337181464.db2.gz ZKHXBWYBPMKKQI-KRWDZBQOSA-N 1 2 313.445 4.433 20 0 DIADLO Cc1nc(CSCc2cn3c(cccc3C)[nH+]2)sc1C ZINC000181490793 337182608 /nfs/dbraw/zinc/18/26/08/337182608.db2.gz HREJGOKRUJGQCE-UHFFFAOYSA-N 1 2 303.456 4.149 20 0 DIADLO CC(C)Cn1cc(C[NH2+][C@H](c2ccco2)c2ccccc2)cn1 ZINC000181758506 337184437 /nfs/dbraw/zinc/18/44/37/337184437.db2.gz OYTZDAXGGNHBFS-IBGZPJMESA-N 1 2 309.413 4.011 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(-c2ccccc2)o1)c1cc2ccccc2o1 ZINC000181778471 337184587 /nfs/dbraw/zinc/18/45/87/337184587.db2.gz YDWLMIVTKMPFIQ-CYBMUJFWSA-N 1 2 319.364 4.334 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(-c2ccc(Cl)cc2)o1)c1ccccn1 ZINC000182175604 337187038 /nfs/dbraw/zinc/18/70/38/337187038.db2.gz MEEMNAYIERZJIV-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2ncc(C(C)C)s2)n1 ZINC000183077511 337191319 /nfs/dbraw/zinc/19/13/19/337191319.db2.gz BYDJQSDAFXPJHM-OAHLLOKOSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ncc(C(C)C)s2)n1 ZINC000183077511 337191320 /nfs/dbraw/zinc/19/13/20/337191320.db2.gz BYDJQSDAFXPJHM-OAHLLOKOSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+](C)[C@@H](C)c2ccco2)s1 ZINC000183574440 337192281 /nfs/dbraw/zinc/19/22/81/337192281.db2.gz ZKXMGBHHLNPOTM-QMMMGPOBSA-N 1 2 304.337 4.256 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+](C)[C@@H](C)c2ccco2)s1 ZINC000183574440 337192282 /nfs/dbraw/zinc/19/22/82/337192282.db2.gz ZKXMGBHHLNPOTM-QMMMGPOBSA-N 1 2 304.337 4.256 20 0 DIADLO COc1cc(C[NH2+][C@H](c2nccs2)c2ccccc2)ccc1C ZINC000183259797 337192539 /nfs/dbraw/zinc/19/25/39/337192539.db2.gz PHRJAZGSCLFPEL-SFHVURJKSA-N 1 2 324.449 4.339 20 0 DIADLO Cc1ccc([C@H]2COCC[N@@H+]2Cc2ccc(C(F)F)cc2)o1 ZINC000183948076 337195755 /nfs/dbraw/zinc/19/57/55/337195755.db2.gz CMEFIDOXOJIBEA-OAHLLOKOSA-N 1 2 307.340 4.099 20 0 DIADLO Cc1ccc([C@H]2COCC[N@H+]2Cc2ccc(C(F)F)cc2)o1 ZINC000183948076 337195756 /nfs/dbraw/zinc/19/57/56/337195756.db2.gz CMEFIDOXOJIBEA-OAHLLOKOSA-N 1 2 307.340 4.099 20 0 DIADLO CCC(=O)Nc1ccc(Cl)c(NCc2ccc(C)[nH+]c2C)c1 ZINC000184449608 337197368 /nfs/dbraw/zinc/19/73/68/337197368.db2.gz QMRCJAGKWRKRPO-UHFFFAOYSA-N 1 2 317.820 4.312 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000185230957 337203575 /nfs/dbraw/zinc/20/35/75/337203575.db2.gz UTTAVKSFTMIKAU-DIFFPNOSSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000185230957 337203576 /nfs/dbraw/zinc/20/35/76/337203576.db2.gz UTTAVKSFTMIKAU-DIFFPNOSSA-N 1 2 306.331 4.082 20 0 DIADLO COc1cccc(Br)c1OCc1ccc(C)[nH+]c1C ZINC000185378971 337204630 /nfs/dbraw/zinc/20/46/30/337204630.db2.gz IECLJNWVEPLNIZ-UHFFFAOYSA-N 1 2 322.202 4.049 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+][C@@H]2CCCSC2)C(F)F)c1 ZINC000582855985 337211144 /nfs/dbraw/zinc/21/11/44/337211144.db2.gz HUTNXMATEMTTNA-HIFRSBDPSA-N 1 2 315.429 4.265 20 0 DIADLO C[C@H]1Oc2cc(F)ccc2[C@@H]1[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000582986577 337222894 /nfs/dbraw/zinc/22/28/94/337222894.db2.gz CHFKICJKMBDSCG-QLJPJBMISA-N 1 2 320.433 4.192 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCN(C)c1cccc(O)c1 ZINC000584384767 337233657 /nfs/dbraw/zinc/23/36/57/337233657.db2.gz ZEZGCBMZYBHIEU-UHFFFAOYSA-N 1 2 323.440 4.357 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]1c1cc(C)no1 ZINC000583092277 337239762 /nfs/dbraw/zinc/23/97/62/337239762.db2.gz KPMVRKSMOCQGLM-OAHLLOKOSA-N 1 2 320.820 4.372 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+]1CCC[C@@H]1c1cc(C)no1 ZINC000583092277 337239763 /nfs/dbraw/zinc/23/97/63/337239763.db2.gz KPMVRKSMOCQGLM-OAHLLOKOSA-N 1 2 320.820 4.372 20 0 DIADLO CCOc1cc(NCc2ccc(N(C)C(C)C)[nH+]c2)ccc1C ZINC000583150395 337246489 /nfs/dbraw/zinc/24/64/89/337246489.db2.gz LXOBPDPOFOQXBN-UHFFFAOYSA-N 1 2 313.445 4.245 20 0 DIADLO c1oc2ccccc2c1C[NH2+]Cc1ncc(-c2ccccc2)cn1 ZINC000185873586 337252261 /nfs/dbraw/zinc/25/22/61/337252261.db2.gz FXOQTTOATSFQEM-UHFFFAOYSA-N 1 2 315.376 4.180 20 0 DIADLO Cc1ccc(CSc2nnc(Cc3cccs3)o2)c(C)[nH+]1 ZINC000186606582 337258007 /nfs/dbraw/zinc/25/80/07/337258007.db2.gz ZIXMCGWQRMQJFE-UHFFFAOYSA-N 1 2 317.439 4.026 20 0 DIADLO Cc1ccc(C[S@@](=O)CCCc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000187232677 337264436 /nfs/dbraw/zinc/26/44/36/337264436.db2.gz CTDSMPRLGFAPJC-NRFANRHFSA-N 1 2 321.873 4.233 20 0 DIADLO CC[C@H]1[C@@H](C)CCN1C(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000187480088 337266153 /nfs/dbraw/zinc/26/61/53/337266153.db2.gz WFIVWEUJJZZQKI-KSSFIOAISA-N 1 2 324.424 4.443 20 0 DIADLO CC(C)c1nnc2n1CC[N@@H+](Cc1cccc3ccccc31)[C@@H]2C ZINC000189576824 337280290 /nfs/dbraw/zinc/28/02/90/337280290.db2.gz AHQCNYDPALCIPM-OAHLLOKOSA-N 1 2 320.440 4.132 20 0 DIADLO CC(C)c1nnc2n1CC[N@H+](Cc1cccc3ccccc31)[C@@H]2C ZINC000189576824 337280291 /nfs/dbraw/zinc/28/02/91/337280291.db2.gz AHQCNYDPALCIPM-OAHLLOKOSA-N 1 2 320.440 4.132 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2cc(-c3ccccc3)n[nH]2)cs1 ZINC000189931158 337283858 /nfs/dbraw/zinc/28/38/58/337283858.db2.gz VQLRPEDWOHSYIC-GOSISDBHSA-N 1 2 324.453 4.179 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2cc(-c3ccccc3)n[nH]2)cs1 ZINC000189931158 337283859 /nfs/dbraw/zinc/28/38/59/337283859.db2.gz VQLRPEDWOHSYIC-GOSISDBHSA-N 1 2 324.453 4.179 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+]1CCC[C@H]1c1csc(C)n1 ZINC000189930791 337283862 /nfs/dbraw/zinc/28/38/62/337283862.db2.gz PNBSAAFBJAFACO-HNNXBMFYSA-N 1 2 322.861 4.451 20 0 DIADLO COc1cccc(Cl)c1C[N@H+]1CCC[C@H]1c1csc(C)n1 ZINC000189930791 337283863 /nfs/dbraw/zinc/28/38/63/337283863.db2.gz PNBSAAFBJAFACO-HNNXBMFYSA-N 1 2 322.861 4.451 20 0 DIADLO CCCc1nc(C[NH2+][C@@H]2CC(C)(C)CCc3ccccc32)no1 ZINC000583241904 337285795 /nfs/dbraw/zinc/28/57/95/337285795.db2.gz DDLVGGVBCCTXHY-MRXNPFEDSA-N 1 2 313.445 4.216 20 0 DIADLO CCN(C)c1ccc(CNc2ccc(COC(C)C)cc2)c[nH+]1 ZINC000190866053 337290357 /nfs/dbraw/zinc/29/03/57/337290357.db2.gz ZRSPCJFZIIMVIJ-UHFFFAOYSA-N 1 2 313.445 4.075 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(Br)o2)n1 ZINC000191078580 337293516 /nfs/dbraw/zinc/29/35/16/337293516.db2.gz XFYPOAPVMLLTEI-CQSZACIVSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc(Br)o2)n1 ZINC000191078580 337293517 /nfs/dbraw/zinc/29/35/17/337293517.db2.gz XFYPOAPVMLLTEI-CQSZACIVSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1nnsc1C[N@@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000583266504 337295766 /nfs/dbraw/zinc/29/57/66/337295766.db2.gz MCKVOWMPTBCWBL-CQSZACIVSA-N 1 2 307.850 4.227 20 0 DIADLO Cc1nnsc1C[N@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000583266504 337295767 /nfs/dbraw/zinc/29/57/67/337295767.db2.gz MCKVOWMPTBCWBL-CQSZACIVSA-N 1 2 307.850 4.227 20 0 DIADLO CCN(C)c1ccc(CNc2ccc(CSC)cc2)c[nH+]1 ZINC000191424258 337296871 /nfs/dbraw/zinc/29/68/71/337296871.db2.gz GPAQOIMDANWPDO-UHFFFAOYSA-N 1 2 301.459 4.013 20 0 DIADLO CCCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1ncccn1 ZINC000192162034 337303418 /nfs/dbraw/zinc/30/34/18/337303418.db2.gz OEKGUVHOIINYKF-KRWDZBQOSA-N 1 2 313.445 4.142 20 0 DIADLO COc1ccc(Cl)cc1[C@H](CC(C)C)[NH2+]Cc1ncccn1 ZINC000192158365 337303433 /nfs/dbraw/zinc/30/34/33/337303433.db2.gz ZWGYTPGMLRZQBA-HNNXBMFYSA-N 1 2 319.836 4.016 20 0 DIADLO COc1ccc(Cl)cc1[C@@H](CC(C)C)[NH2+]Cc1ncccn1 ZINC000192158372 337303462 /nfs/dbraw/zinc/30/34/62/337303462.db2.gz ZWGYTPGMLRZQBA-OAHLLOKOSA-N 1 2 319.836 4.016 20 0 DIADLO c1cn(-c2ccc(CNc3ccc4scnc4c3)cc2)c[nH+]1 ZINC000192257697 337304090 /nfs/dbraw/zinc/30/40/90/337304090.db2.gz XEIMMJKSSPIYAQ-UHFFFAOYSA-N 1 2 306.394 4.094 20 0 DIADLO COc1cccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c1F ZINC000192662749 337306032 /nfs/dbraw/zinc/30/60/32/337306032.db2.gz BFENDXRDVDQAIE-LJQANCHMSA-N 1 2 311.356 4.307 20 0 DIADLO Cc1cc(NC(=O)Nc2ccccn2)ccc1Oc1cc[nH+]cc1 ZINC000192580444 337306409 /nfs/dbraw/zinc/30/64/09/337306409.db2.gz KKVMVGWYODVRNK-UHFFFAOYSA-N 1 2 320.352 4.221 20 0 DIADLO Cc1nc([C@H](C)[N@H+]2CC=C(c3cccc4ccccc43)CC2)no1 ZINC000583291648 337307703 /nfs/dbraw/zinc/30/77/03/337307703.db2.gz YSQDAEXMZAQXSH-AWEZNQCLSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1nc([C@H](C)[N@@H+]2CC=C(c3cccc4ccccc43)CC2)no1 ZINC000583291648 337307704 /nfs/dbraw/zinc/30/77/04/337307704.db2.gz YSQDAEXMZAQXSH-AWEZNQCLSA-N 1 2 319.408 4.382 20 0 DIADLO Brc1cncc(C[N@@H+]2CCC[C@@H]2c2cccs2)c1 ZINC000192836019 337307861 /nfs/dbraw/zinc/30/78/61/337307861.db2.gz LTFJQWLRHQQQCA-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cncc(C[N@H+]2CCC[C@@H]2c2cccs2)c1 ZINC000192836019 337307862 /nfs/dbraw/zinc/30/78/62/337307862.db2.gz LTFJQWLRHQQQCA-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc2ccccc2s1)C(=O)OC(C)(C)C ZINC000525952558 337308974 /nfs/dbraw/zinc/30/89/74/337308974.db2.gz RWPCCBRQXSTBHX-VXGBXAGGSA-N 1 2 305.443 4.282 20 0 DIADLO CCC1CC(Nc2cccc(C[N@H+](C)Cc3cscn3)c2)C1 ZINC000583803041 337335055 /nfs/dbraw/zinc/33/50/55/337335055.db2.gz HGROUHWOAUPGNS-UHFFFAOYSA-N 1 2 315.486 4.376 20 0 DIADLO CCC1CC(Nc2cccc(C[N@@H+](C)Cc3cscn3)c2)C1 ZINC000583803041 337335056 /nfs/dbraw/zinc/33/50/56/337335056.db2.gz HGROUHWOAUPGNS-UHFFFAOYSA-N 1 2 315.486 4.376 20 0 DIADLO CC[C@H](C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000030609246 337390294 /nfs/dbraw/zinc/39/02/94/337390294.db2.gz KQFKJQKZJWNTJG-SFHVURJKSA-N 1 2 305.381 4.005 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)c1noc(-c2ccccc2)n1 ZINC000124453188 337405508 /nfs/dbraw/zinc/40/55/08/337405508.db2.gz IVWSXIHRADZQEQ-QWHCGFSZSA-N 1 2 311.360 4.288 20 0 DIADLO Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]Cc1cscn1)CCCO2 ZINC000126621746 337417279 /nfs/dbraw/zinc/41/72/79/337417279.db2.gz JYMJQBOSNVBNFM-AWEZNQCLSA-N 1 2 308.834 4.108 20 0 DIADLO Cn1cc([C@@H](Nc2[nH+]ccc3ccc(F)cc32)C(C)(C)C)cn1 ZINC000425230118 337442487 /nfs/dbraw/zinc/44/24/87/337442487.db2.gz CPYFUXYLBBLEPU-MRXNPFEDSA-N 1 2 312.392 4.307 20 0 DIADLO CCC(CC)c1cc(C(=O)Nc2c(C)cc(C)[nH+]c2C)on1 ZINC000132896618 337443721 /nfs/dbraw/zinc/44/37/21/337443721.db2.gz GNPWHKPEUJFNTK-UHFFFAOYSA-N 1 2 301.390 4.151 20 0 DIADLO CC(C)(C)CCOc1cnccc1C[NH2+]Cc1ccc(Cl)o1 ZINC000564119257 337457614 /nfs/dbraw/zinc/45/76/14/337457614.db2.gz FNFQXOJAKONAAF-UHFFFAOYSA-N 1 2 322.836 4.433 20 0 DIADLO CCSc1cccc(N[C@@H](c2[nH]cc[nH+]2)c2cccnc2)c1 ZINC000195109648 337465266 /nfs/dbraw/zinc/46/52/66/337465266.db2.gz HPHSZCUWAIWVJI-MRXNPFEDSA-N 1 2 310.426 4.118 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@@H](C)c2ccc(C3CC3)cc2)n1 ZINC000419354596 337480727 /nfs/dbraw/zinc/48/07/27/337480727.db2.gz MFLUOGUGERNXKJ-AWEZNQCLSA-N 1 2 313.445 4.386 20 0 DIADLO Cc1cc(C)n(CCSCc2ccc(C(C)C)[nH+]c2C)n1 ZINC000419421286 337483869 /nfs/dbraw/zinc/48/38/69/337483869.db2.gz ONKFATILJDFWPO-UHFFFAOYSA-N 1 2 303.475 4.260 20 0 DIADLO Cc1cc(C)c(CNC(=O)N(C)[C@H]2CCC[C@@H]2C(C)(C)C)c[nH+]1 ZINC000419510826 337486203 /nfs/dbraw/zinc/48/62/03/337486203.db2.gz WKFIZHGMYKCYED-IRXDYDNUSA-N 1 2 317.477 4.055 20 0 DIADLO Cc1[nH+]cccc1Cc1noc(C[C@@H](c2ccccc2)C(C)C)n1 ZINC000420508854 337505755 /nfs/dbraw/zinc/50/57/55/337505755.db2.gz AWLXCUSMRLAZCP-GOSISDBHSA-N 1 2 321.424 4.346 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@H](C)CCCc2ccccc2)n1 ZINC000420510021 337505841 /nfs/dbraw/zinc/50/58/41/337505841.db2.gz HGXCBZSTYBGYFY-OAHLLOKOSA-N 1 2 321.424 4.490 20 0 DIADLO CCc1ccc([C@H](C)c2nc(Cc3ccc[nH+]c3C)no2)cc1 ZINC000420510640 337505931 /nfs/dbraw/zinc/50/59/31/337505931.db2.gz JQERPACVWMENIB-ZDUSSCGKSA-N 1 2 307.397 4.078 20 0 DIADLO CCc1ccc([C@@H](C)Cc2nc(Cc3ccc[nH+]c3C)no2)cc1 ZINC000420512511 337506192 /nfs/dbraw/zinc/50/61/92/337506192.db2.gz RSUMUQWFLABLJN-AWEZNQCLSA-N 1 2 321.424 4.272 20 0 DIADLO Cc1[nH+]cccc1Cc1noc(COc2cccc(C(C)C)c2)n1 ZINC000420513409 337506317 /nfs/dbraw/zinc/50/63/17/337506317.db2.gz VWMMSRCRBFKIAO-UHFFFAOYSA-N 1 2 323.396 4.066 20 0 DIADLO Cc1cc(CNc2ncc(C(F)(F)F)cc2Cl)cc(C)[nH+]1 ZINC000420654677 337509951 /nfs/dbraw/zinc/50/99/51/337509951.db2.gz QHGYTIAJVIJAHZ-UHFFFAOYSA-N 1 2 315.726 4.378 20 0 DIADLO C[C@@H]1C[C@H]1[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(Cl)cc1 ZINC000420938580 337516869 /nfs/dbraw/zinc/51/68/69/337516869.db2.gz MISOOUQVPDURIW-ZXIHIIQKSA-N 1 2 324.255 4.214 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+]Cc2nn(C)c(C)c2Cl)cc1 ZINC000421329085 337526667 /nfs/dbraw/zinc/52/66/67/337526667.db2.gz UOQXTZHOKPHHJS-LLVKDONJSA-N 1 2 323.893 4.345 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H](C)c2ccc(C3CC3)cc2)nn1C ZINC000421378978 337529046 /nfs/dbraw/zinc/52/90/46/337529046.db2.gz HXPINVZANCQPBG-LLVKDONJSA-N 1 2 303.837 4.110 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H]2C[C@H](C(C)C)c3ccccc32)nn1C ZINC000421399826 337531133 /nfs/dbraw/zinc/53/11/33/337531133.db2.gz UUHFJEZWTAQHRP-HZPDHXFCSA-N 1 2 317.864 4.356 20 0 DIADLO CC[C@@H](C)[C@H](C(=O)NCc1cc(C)[nH+]c(C)c1)c1ccccc1 ZINC000421560445 337541290 /nfs/dbraw/zinc/54/12/90/337541290.db2.gz QPNXGNASHGTMJS-KUHUBIRLSA-N 1 2 310.441 4.145 20 0 DIADLO Cc1cc(NC(=O)[C@]2(C)CC2(F)F)ccc1Oc1cc[nH+]cc1 ZINC000421568114 337541692 /nfs/dbraw/zinc/54/16/92/337541692.db2.gz ZKYXNHXMVPYBQV-INIZCTEOSA-N 1 2 318.323 4.166 20 0 DIADLO Cc1cc(CNC(=O)[C@H](CC(C)C)c2ccccc2)cc(C)[nH+]1 ZINC000421573950 337542207 /nfs/dbraw/zinc/54/22/07/337542207.db2.gz CODPGELIGSIPGP-LJQANCHMSA-N 1 2 310.441 4.145 20 0 DIADLO C[C@H](Cc1noc([C@@H](c2ccccc2)[NH+](C)C)n1)c1ccccc1 ZINC000571840269 337578723 /nfs/dbraw/zinc/57/87/23/337578723.db2.gz RNLUOIKBELQROT-DNVCBOLYSA-N 1 2 321.424 4.067 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc([C@H]2C[C@@H]2C(C)C)n1 ZINC000571959259 337583344 /nfs/dbraw/zinc/58/33/44/337583344.db2.gz AGLUDGMKHFEBTN-KGLIPLIRSA-N 1 2 324.428 4.351 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1cc(F)cc(F)c1)c1ccco1 ZINC000161610018 337593949 /nfs/dbraw/zinc/59/39/49/337593949.db2.gz IBOANBYEOGXJOX-INIZCTEOSA-N 1 2 309.356 4.061 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cc(Cl)ccc1F ZINC000161800894 337597468 /nfs/dbraw/zinc/59/74/68/337597468.db2.gz QDJYBDQKHORHOB-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)CSC(C)C)c1C(C)C ZINC000572431058 337641680 /nfs/dbraw/zinc/64/16/80/337641680.db2.gz IYPCTDJBIPIQET-UHFFFAOYSA-N 1 2 316.470 4.169 20 0 DIADLO FC(F)COc1ccccc1N[C@@H]1CCc2ccc[nH+]c2CC1 ZINC000421835740 337652237 /nfs/dbraw/zinc/65/22/37/337652237.db2.gz MZRBYCDWAOUJOQ-CQSZACIVSA-N 1 2 318.367 4.085 20 0 DIADLO Cc1cc([NH+]2CCCC2)ccc1N[C@@H]1CCc2cccnc2CC1 ZINC000421840133 337653235 /nfs/dbraw/zinc/65/32/35/337653235.db2.gz ZMJINCNZZUVBGU-GOSISDBHSA-N 1 2 321.468 4.350 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1c(F)cccc1Cl ZINC000162696763 337660905 /nfs/dbraw/zinc/66/09/05/337660905.db2.gz KSXCZEIDCALIKC-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]c2ccc3c(c2)CCN3)C1 ZINC000423209869 337704282 /nfs/dbraw/zinc/70/42/82/337704282.db2.gz FNHQQIXYNWIJRX-SJORKVTESA-N 1 2 307.441 4.496 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1cc(-c2ccccc2)nn1C ZINC000423220845 337705386 /nfs/dbraw/zinc/70/53/86/337705386.db2.gz VZQGWDKDVAQJOF-CQSZACIVSA-N 1 2 318.424 4.228 20 0 DIADLO CC(C)=CCS[C@H](C)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000446140490 338521607 /nfs/dbraw/zinc/52/16/07/338521607.db2.gz VMWNTROFYHGKKB-CYBMUJFWSA-N 1 2 315.442 4.103 20 0 DIADLO CC[C@H](NC(=O)c1ccc(Oc2ccccc2)cc1)c1[nH]cc[nH+]1 ZINC000325679026 337737658 /nfs/dbraw/zinc/73/76/58/337737658.db2.gz NVCICUWFLXBNLJ-KRWDZBQOSA-N 1 2 321.380 4.083 20 0 DIADLO Fc1cccnc1C[NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC000527240042 337740203 /nfs/dbraw/zinc/74/02/03/337740203.db2.gz XQKWLSKVTPHRIX-UHFFFAOYSA-N 1 2 318.701 4.183 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2ncc(C(C)C)s2)c(OC)c1 ZINC000527779529 337763522 /nfs/dbraw/zinc/76/35/22/337763522.db2.gz JOCLUUUFSNTKQD-LBPRGKRZSA-N 1 2 320.458 4.135 20 0 DIADLO Fc1ccc(NC2CCN(c3[nH+]ccc4ccccc43)CC2)cc1 ZINC000527856550 337769542 /nfs/dbraw/zinc/76/95/42/337769542.db2.gz AAKCDTZDZCEUPS-UHFFFAOYSA-N 1 2 321.399 4.455 20 0 DIADLO COc1ccccc1[C@@H]1CCN(c2[nH+]ccc3ccccc32)C1 ZINC000527904167 337769873 /nfs/dbraw/zinc/76/98/73/337769873.db2.gz WWPLWLOJSZSGGW-MRXNPFEDSA-N 1 2 304.393 4.237 20 0 DIADLO CC(C)c1cccc([C@@H](C)[NH2+]Cc2ncc(C(F)(F)F)cn2)c1 ZINC000527901128 337772929 /nfs/dbraw/zinc/77/29/29/337772929.db2.gz AUYYFCWWDAGKEF-GFCCVEGCSA-N 1 2 323.362 4.470 20 0 DIADLO c1c[nH+]c2c(c1)CC[C@@H](Nc1cccc(C3CCOCC3)c1)CC2 ZINC000527997126 337778882 /nfs/dbraw/zinc/77/88/82/337778882.db2.gz SGNOMLQJJVWHPX-LJQANCHMSA-N 1 2 322.452 4.335 20 0 DIADLO COCc1ccc([C@H]2CCCN2c2[nH+]ccc3ccccc32)o1 ZINC000527964331 337780566 /nfs/dbraw/zinc/78/05/66/337780566.db2.gz ICPWQAIYSWMIRX-QGZVFWFLSA-N 1 2 308.381 4.316 20 0 DIADLO COc1cccc2cc([C@@H](C)[NH2+][C@@H](C)c3ncccc3F)oc21 ZINC000528035313 337782350 /nfs/dbraw/zinc/78/23/50/337782350.db2.gz FYEVBELEHKBNKG-NEPJUHHUSA-N 1 2 314.360 4.387 20 0 DIADLO Cc1ccc(Cc2noc([C@H]3CC[C@@H]3c3ccc(F)cc3)n2)c[nH+]1 ZINC000528117656 337787061 /nfs/dbraw/zinc/78/70/61/337787061.db2.gz WFHOFQYTZXMLQC-SJORKVTESA-N 1 2 323.371 4.164 20 0 DIADLO Cc1ccc(Cc2noc([C@H](C)Cc3ccccc3C)n2)c[nH+]1 ZINC000528114747 337788783 /nfs/dbraw/zinc/78/87/83/337788783.db2.gz OBPQLOHGRUXICW-CQSZACIVSA-N 1 2 307.397 4.018 20 0 DIADLO C[C@@H]1[C@@H](C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)[C@H]1C1CC1 ZINC000528317371 337801605 /nfs/dbraw/zinc/80/16/05/337801605.db2.gz VGCRVAULNCWSPE-JBBXEZCESA-N 1 2 308.381 4.105 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccc(Oc2ccccc2)cc1 ZINC000107294654 337828454 /nfs/dbraw/zinc/82/84/54/337828454.db2.gz SINMVNVMZSVSNC-UHFFFAOYSA-N 1 2 304.349 4.435 20 0 DIADLO CC(C)(C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccccc1F ZINC000118643151 337851347 /nfs/dbraw/zinc/85/13/47/337851347.db2.gz QQPXXJLBWNCVGX-UHFFFAOYSA-N 1 2 323.371 4.132 20 0 DIADLO Cc1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000119065830 337853864 /nfs/dbraw/zinc/85/38/64/337853864.db2.gz BYCVWHZQSFXQJE-UHFFFAOYSA-N 1 2 318.804 4.148 20 0 DIADLO Cc1ccc(NC(=O)CSc2ccccc2Cl)c(C)[nH+]1 ZINC000119389277 337859011 /nfs/dbraw/zinc/85/90/11/337859011.db2.gz PTXDAPBWBYCYAJ-UHFFFAOYSA-N 1 2 306.818 4.083 20 0 DIADLO Cc1cc(NC(=O)N2CC[C@@H](c3ccc(Cl)cc3)C2)cc[nH+]1 ZINC000119723768 337862785 /nfs/dbraw/zinc/86/27/85/337862785.db2.gz AMNTUIPYQIWMJS-CQSZACIVSA-N 1 2 315.804 4.065 20 0 DIADLO CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1cc[nH+]cc1C ZINC000120495225 337875719 /nfs/dbraw/zinc/87/57/19/337875719.db2.gz SBCOGKAEYOTXJA-KRWDZBQOSA-N 1 2 311.429 4.183 20 0 DIADLO C[C@H]([NH2+][C@H](c1cccc(F)c1)c1ccccn1)c1ccncc1 ZINC000090955969 337887513 /nfs/dbraw/zinc/88/75/13/337887513.db2.gz AQHUHEYKCRDHJW-IFXJQAMLSA-N 1 2 307.372 4.056 20 0 DIADLO CCc1nc2ccccc2c(C(=O)Nc2ccc(C)[nH+]c2C)c1C ZINC000121603888 337896046 /nfs/dbraw/zinc/89/60/46/337896046.db2.gz DZAIBCHYOKLBNA-UHFFFAOYSA-N 1 2 319.408 4.370 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2ccccc2OC(F)(F)F)s1 ZINC000122873265 337924752 /nfs/dbraw/zinc/92/47/52/337924752.db2.gz PQIAHDMKSLOEAA-JTQLQIEISA-N 1 2 316.348 4.201 20 0 DIADLO Cc1ccc(NC(=O)c2cc(Br)ccc2C)c(C)[nH+]1 ZINC000094666386 337925924 /nfs/dbraw/zinc/92/59/24/337925924.db2.gz DLRYOLDDIVJPDN-UHFFFAOYSA-N 1 2 319.202 4.022 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCOc2c(Cl)cccc21)c1cscn1 ZINC000537305065 337929937 /nfs/dbraw/zinc/92/99/37/337929937.db2.gz AQKAWPCHQPUWSY-GWCFXTLKSA-N 1 2 308.834 4.361 20 0 DIADLO Cc1cc(C)c(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)c(C)c1 ZINC000123097289 337943789 /nfs/dbraw/zinc/94/37/89/337943789.db2.gz HBFUCNHOGUCTCI-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO Cc1ccc(Cc2noc([C@H]3CCC[C@@H]3c3ccccc3)n2)c[nH+]1 ZINC000515421969 337988673 /nfs/dbraw/zinc/98/86/73/337988673.db2.gz JZTZKMUXYURKQR-MSOLQXFVSA-N 1 2 319.408 4.415 20 0 DIADLO Cc1cccc2[nH+]c(CNc3cccc(CC(F)(F)F)c3)cn21 ZINC000083143333 337993511 /nfs/dbraw/zinc/99/35/11/337993511.db2.gz CIBBIPHALTURDG-UHFFFAOYSA-N 1 2 319.330 4.360 20 0 DIADLO CCCOc1ccc(C[NH2+][C@H](C)c2cscn2)cc1OCC ZINC000515673210 337994797 /nfs/dbraw/zinc/99/47/97/337994797.db2.gz QLJCWCJSQIQFMQ-CYBMUJFWSA-N 1 2 320.458 4.181 20 0 DIADLO CCSc1ccc(Cl)cc1C(=O)Nc1cc[nH+]cc1C ZINC000084188314 338001270 /nfs/dbraw/zinc/00/12/70/338001270.db2.gz BXJCOTWZQQMREN-UHFFFAOYSA-N 1 2 306.818 4.408 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc(C[C@@H]2C=CCC2)n1 ZINC000515977041 338001832 /nfs/dbraw/zinc/00/18/32/338001832.db2.gz QJMRPTNUXDBZMZ-CQSZACIVSA-N 1 2 322.412 4.100 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)CC1CCC(C(F)(F)F)CC1 ZINC000425596625 338015754 /nfs/dbraw/zinc/01/57/54/338015754.db2.gz OCLLQABWGJGTJY-UHFFFAOYSA-N 1 2 314.351 4.396 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)CCSc1cccc(Cl)c1 ZINC000425596877 338015818 /nfs/dbraw/zinc/01/58/18/338015818.db2.gz PWUQEYLTDIPVOM-UHFFFAOYSA-N 1 2 320.845 4.473 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000425598204 338015906 /nfs/dbraw/zinc/01/59/06/338015906.db2.gz VUQXKYDAUCFYJK-LSDHHAIUSA-N 1 2 300.789 4.094 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cnc(-c3ccco3)s2)c1 ZINC000425968562 338019292 /nfs/dbraw/zinc/01/92/92/338019292.db2.gz SKXWDCHVCQLAEM-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cnc(-c3ccco3)s2)c1 ZINC000425968562 338019293 /nfs/dbraw/zinc/01/92/93/338019293.db2.gz SKXWDCHVCQLAEM-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2cc3ccc(C)cc3o2)s1 ZINC000426032767 338019994 /nfs/dbraw/zinc/01/99/94/338019994.db2.gz AAXVRCNEEJBDRC-MNOVXSKESA-N 1 2 301.415 4.313 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NC(=O)CC2CCCCCC2)c1 ZINC000426152730 338021357 /nfs/dbraw/zinc/02/13/57/338021357.db2.gz HURAHNRIMLSUPV-UHFFFAOYSA-N 1 2 311.429 4.386 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(-c2ccccc2)cc1F)c1ccn(C)n1 ZINC000426300860 338025610 /nfs/dbraw/zinc/02/56/10/338025610.db2.gz JYAQSMCEKMXWST-LJQANCHMSA-N 1 2 323.415 4.467 20 0 DIADLO CCCc1csc(C[N@@H+]2CC3(CCCC3)OC(C)(C)C2)n1 ZINC000426360270 338028863 /nfs/dbraw/zinc/02/88/63/338028863.db2.gz DOKQBYOGPBWXDM-UHFFFAOYSA-N 1 2 308.491 4.019 20 0 DIADLO CCCc1csc(C[N@H+]2CC3(CCCC3)OC(C)(C)C2)n1 ZINC000426360270 338028864 /nfs/dbraw/zinc/02/88/64/338028864.db2.gz DOKQBYOGPBWXDM-UHFFFAOYSA-N 1 2 308.491 4.019 20 0 DIADLO CCCc1csc(C[N@@H+]2CCC[C@@H]2c2ccc(COC)o2)n1 ZINC000426366949 338029077 /nfs/dbraw/zinc/02/90/77/338029077.db2.gz RVMDIYLKINUSER-OAHLLOKOSA-N 1 2 320.458 4.172 20 0 DIADLO CCCc1csc(C[N@H+]2CCC[C@@H]2c2ccc(COC)o2)n1 ZINC000426366949 338029078 /nfs/dbraw/zinc/02/90/78/338029078.db2.gz RVMDIYLKINUSER-OAHLLOKOSA-N 1 2 320.458 4.172 20 0 DIADLO CCCc1csc(C[N@@H+]2CCc3cc(OCC)ccc3C2)n1 ZINC000426403337 338030734 /nfs/dbraw/zinc/03/07/34/338030734.db2.gz VTXIXGGPEABNLU-UHFFFAOYSA-N 1 2 316.470 4.053 20 0 DIADLO CCCc1csc(C[N@H+]2CCc3cc(OCC)ccc3C2)n1 ZINC000426403337 338030735 /nfs/dbraw/zinc/03/07/35/338030735.db2.gz VTXIXGGPEABNLU-UHFFFAOYSA-N 1 2 316.470 4.053 20 0 DIADLO CCCc1csc(C[N@@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)n1 ZINC000426415100 338031225 /nfs/dbraw/zinc/03/12/25/338031225.db2.gz CUDUGEBHRWJDHE-WMLDXEAASA-N 1 2 316.470 4.058 20 0 DIADLO CCCc1csc(C[N@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)n1 ZINC000426415100 338031226 /nfs/dbraw/zinc/03/12/26/338031226.db2.gz CUDUGEBHRWJDHE-WMLDXEAASA-N 1 2 316.470 4.058 20 0 DIADLO CCCc1csc(C[N@@H+]2C[C@H](c3ccccc3)OC[C@H]2C)n1 ZINC000426415099 338031278 /nfs/dbraw/zinc/03/12/78/338031278.db2.gz CUDUGEBHRWJDHE-RHSMWYFYSA-N 1 2 316.470 4.058 20 0 DIADLO CCCc1csc(C[N@H+]2C[C@H](c3ccccc3)OC[C@H]2C)n1 ZINC000426415099 338031279 /nfs/dbraw/zinc/03/12/79/338031279.db2.gz CUDUGEBHRWJDHE-RHSMWYFYSA-N 1 2 316.470 4.058 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(Cl)cc(Cl)cc3[C@@H]2C)ncn1 ZINC000428237999 338043943 /nfs/dbraw/zinc/04/39/43/338043943.db2.gz MERAEZPQLGGSQM-NSHDSACASA-N 1 2 322.239 4.211 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(Cl)cc(Cl)cc3[C@@H]2C)ncn1 ZINC000428237999 338043944 /nfs/dbraw/zinc/04/39/44/338043944.db2.gz MERAEZPQLGGSQM-NSHDSACASA-N 1 2 322.239 4.211 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1[C@@H](C)COC[C@@H]1c1ccccc1 ZINC000428294734 338046118 /nfs/dbraw/zinc/04/61/18/338046118.db2.gz NQWUXIYACGBJAK-WMLDXEAASA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1[C@@H](C)COC[C@@H]1c1ccccc1 ZINC000428294734 338046119 /nfs/dbraw/zinc/04/61/19/338046119.db2.gz NQWUXIYACGBJAK-WMLDXEAASA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC000428363814 338048808 /nfs/dbraw/zinc/04/88/08/338048808.db2.gz MDLMOWFYCNTYOD-BLLLJJGKSA-N 1 2 320.458 4.130 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC000428363814 338048809 /nfs/dbraw/zinc/04/88/09/338048809.db2.gz MDLMOWFYCNTYOD-BLLLJJGKSA-N 1 2 320.458 4.130 20 0 DIADLO Cc1nc(C(C)C)oc1C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000428369829 338049126 /nfs/dbraw/zinc/04/91/26/338049126.db2.gz LFMUERQYOIXKDS-IBGZPJMESA-N 1 2 321.424 4.381 20 0 DIADLO CC(C)c1nnc(C[NH+](Cc2ccccc2)Cc2ccccc2)[nH]1 ZINC000428448048 338052087 /nfs/dbraw/zinc/05/20/87/338052087.db2.gz OQZPVAWXQBHWFI-UHFFFAOYSA-N 1 2 320.440 4.131 20 0 DIADLO CC(C)c1nnc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)[nH]1 ZINC000428449245 338052148 /nfs/dbraw/zinc/05/21/48/338052148.db2.gz SRYCIZMEWZSVKL-UHFFFAOYSA-N 1 2 320.440 4.246 20 0 DIADLO CC(C)c1nnc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)[nH]1 ZINC000428449245 338052149 /nfs/dbraw/zinc/05/21/49/338052149.db2.gz SRYCIZMEWZSVKL-UHFFFAOYSA-N 1 2 320.440 4.246 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2COCc3ccccc32)cs1 ZINC000428451477 338052353 /nfs/dbraw/zinc/05/23/53/338052353.db2.gz BRICIQJPXHYPNE-WFASDCNBSA-N 1 2 302.443 4.189 20 0 DIADLO CCCc1nc(C)c(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)o1 ZINC000428459496 338053199 /nfs/dbraw/zinc/05/31/99/338053199.db2.gz FDUTVEKZUMJLML-GFCCVEGCSA-N 1 2 308.372 4.407 20 0 DIADLO CCCc1nc(C)c(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)o1 ZINC000428459496 338053200 /nfs/dbraw/zinc/05/32/00/338053200.db2.gz FDUTVEKZUMJLML-GFCCVEGCSA-N 1 2 308.372 4.407 20 0 DIADLO CCc1nc(C)c(C[N@H+](Cc2ccco2)Cc2cccs2)o1 ZINC000428463982 338053472 /nfs/dbraw/zinc/05/34/72/338053472.db2.gz OWNAFDFMKDVMBF-UHFFFAOYSA-N 1 2 316.426 4.402 20 0 DIADLO CCc1nc(C)c(C[N@@H+](Cc2ccco2)Cc2cccs2)o1 ZINC000428463982 338053473 /nfs/dbraw/zinc/05/34/73/338053473.db2.gz OWNAFDFMKDVMBF-UHFFFAOYSA-N 1 2 316.426 4.402 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)CC2(C)CC2)c1 ZINC000428502895 338055005 /nfs/dbraw/zinc/05/50/05/338055005.db2.gz KTCIERLRVVESMB-UHFFFAOYSA-N 1 2 311.429 4.479 20 0 DIADLO Cc1nc(N2CCc3c(Cl)cc(Cl)cc3[C@@H]2C)cc[nH+]1 ZINC000428687262 338058632 /nfs/dbraw/zinc/05/86/32/338058632.db2.gz DFUGJICCMIZXJL-VIFPVBQESA-N 1 2 308.212 4.216 20 0 DIADLO CCC(CC)n1ccc(C[N@H+](Cc2cccs2)C2CC2)n1 ZINC000448453473 338065367 /nfs/dbraw/zinc/06/53/67/338065367.db2.gz YUUIYFKDVCAOAO-UHFFFAOYSA-N 1 2 303.475 4.470 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+](Cc2cccs2)C2CC2)n1 ZINC000448453473 338065368 /nfs/dbraw/zinc/06/53/68/338065368.db2.gz YUUIYFKDVCAOAO-UHFFFAOYSA-N 1 2 303.475 4.470 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(C(F)F)cc2)C[C@@H](C(F)(F)F)O1 ZINC000428937793 338065565 /nfs/dbraw/zinc/06/55/65/338065565.db2.gz GWCCFULPMIEWDH-LBPRGKRZSA-N 1 2 323.305 4.166 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(C(F)F)cc2)C[C@@H](C(F)(F)F)O1 ZINC000428937793 338065566 /nfs/dbraw/zinc/06/55/66/338065566.db2.gz GWCCFULPMIEWDH-LBPRGKRZSA-N 1 2 323.305 4.166 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc(C(C)(C)C)cs2)Cc2ccccc2O1 ZINC000429147482 338071881 /nfs/dbraw/zinc/07/18/81/338071881.db2.gz FYRUQLAOEUUHKS-CYBMUJFWSA-N 1 2 316.470 4.224 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc(C(C)(C)C)cs2)Cc2ccccc2O1 ZINC000429147482 338071882 /nfs/dbraw/zinc/07/18/82/338071882.db2.gz FYRUQLAOEUUHKS-CYBMUJFWSA-N 1 2 316.470 4.224 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC000429164450 338072469 /nfs/dbraw/zinc/07/24/69/338072469.db2.gz CQIWHYUBMSYCID-ZIAGYGMSSA-N 1 2 314.429 4.316 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC000429164450 338072470 /nfs/dbraw/zinc/07/24/70/338072470.db2.gz CQIWHYUBMSYCID-ZIAGYGMSSA-N 1 2 314.429 4.316 20 0 DIADLO CC[C@H]1CC[N@@H+]1Cc1csc(COc2ccc(C)cc2)n1 ZINC000429278141 338075770 /nfs/dbraw/zinc/07/57/70/338075770.db2.gz PVWAFERFWKKRLT-HNNXBMFYSA-N 1 2 302.443 4.015 20 0 DIADLO CC[C@H]1CC[N@H+]1Cc1csc(COc2ccc(C)cc2)n1 ZINC000429278141 338075771 /nfs/dbraw/zinc/07/57/71/338075771.db2.gz PVWAFERFWKKRLT-HNNXBMFYSA-N 1 2 302.443 4.015 20 0 DIADLO CC[C@H]1CC[N@@H+]1Cc1cc(Br)ccc1OC(F)F ZINC000429282336 338075952 /nfs/dbraw/zinc/07/59/52/338075952.db2.gz BBJIFRVOQBAVRY-NSHDSACASA-N 1 2 320.177 4.035 20 0 DIADLO CC[C@H]1CC[N@H+]1Cc1cc(Br)ccc1OC(F)F ZINC000429282336 338075953 /nfs/dbraw/zinc/07/59/53/338075953.db2.gz BBJIFRVOQBAVRY-NSHDSACASA-N 1 2 320.177 4.035 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+](C)Cc2cc(C)ccc2C)n1 ZINC000429285850 338076192 /nfs/dbraw/zinc/07/61/92/338076192.db2.gz PHQFDLBXSHNYGQ-HNNXBMFYSA-N 1 2 301.434 4.222 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+](C)Cc2cc(C)ccc2C)n1 ZINC000429285850 338076193 /nfs/dbraw/zinc/07/61/93/338076193.db2.gz PHQFDLBXSHNYGQ-HNNXBMFYSA-N 1 2 301.434 4.222 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@H](C)C(=O)Nc1cccc(Cl)c1C ZINC000429405752 338079918 /nfs/dbraw/zinc/07/99/18/338079918.db2.gz LYCIWFLFUMVWKN-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@H](C)C(=O)Nc1cccc(Cl)c1C ZINC000429405752 338079919 /nfs/dbraw/zinc/07/99/19/338079919.db2.gz LYCIWFLFUMVWKN-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO CN(Cc1cn2c([nH+]1)CCCC2)Cc1cc(Cl)ccc1Cl ZINC000429545333 338083580 /nfs/dbraw/zinc/08/35/80/338083580.db2.gz FDGYWEVPDLJPDP-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO CN(Cc1cn2c([nH+]1)CCCC2)Cc1c(Cl)cccc1Cl ZINC000429544075 338083596 /nfs/dbraw/zinc/08/35/96/338083596.db2.gz AFKTWYRRTZKDKC-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO CN(Cc1cn2c([nH+]1)CCCC2)Cc1csc2ccccc12 ZINC000429553959 338083774 /nfs/dbraw/zinc/08/37/74/338083774.db2.gz QQWNBHLBEXGNKR-UHFFFAOYSA-N 1 2 311.454 4.066 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1csc(-c3ccoc3)n1)CC2 ZINC000429597347 338085710 /nfs/dbraw/zinc/08/57/10/338085710.db2.gz MTUJYWNGUOQUBA-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1csc(-c3ccoc3)n1)CC2 ZINC000429597347 338085711 /nfs/dbraw/zinc/08/57/11/338085711.db2.gz MTUJYWNGUOQUBA-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccc(F)cc1 ZINC000429786856 338089864 /nfs/dbraw/zinc/08/98/64/338089864.db2.gz NZPUBNOMARXMKB-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2coc3ccccc23)c(F)c1F ZINC000430015805 338093580 /nfs/dbraw/zinc/09/35/80/338093580.db2.gz BNSHLCFVSQSWNT-UHFFFAOYSA-N 1 2 309.262 4.279 20 0 DIADLO Cc1[nH+]c2ccccn2c1CNc1cccc(-c2ncco2)c1C ZINC000430083756 338095201 /nfs/dbraw/zinc/09/52/01/338095201.db2.gz ISQNPOONTQHNFQ-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO C[C@@]12CC[N@H+](Cc3cc(C(F)(F)F)ccc3F)C[C@@H]1C2(F)F ZINC000430097523 338096420 /nfs/dbraw/zinc/09/64/20/338096420.db2.gz UPWMFOOXXUJIPG-QWHCGFSZSA-N 1 2 323.280 4.322 20 0 DIADLO C[C@@]12CC[N@@H+](Cc3cc(C(F)(F)F)ccc3F)C[C@@H]1C2(F)F ZINC000430097523 338096421 /nfs/dbraw/zinc/09/64/21/338096421.db2.gz UPWMFOOXXUJIPG-QWHCGFSZSA-N 1 2 323.280 4.322 20 0 DIADLO COc1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccnc2)c(Cl)c1 ZINC000430105020 338096885 /nfs/dbraw/zinc/09/68/85/338096885.db2.gz SGKYIFJEBMDJHD-QGZVFWFLSA-N 1 2 316.832 4.327 20 0 DIADLO COc1ccc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)c(Cl)c1 ZINC000430105020 338096886 /nfs/dbraw/zinc/09/68/86/338096886.db2.gz SGKYIFJEBMDJHD-QGZVFWFLSA-N 1 2 316.832 4.327 20 0 DIADLO COc1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccnc2)cc1Cl ZINC000430105180 338096899 /nfs/dbraw/zinc/09/68/99/338096899.db2.gz OHOOHFFRPWGFAQ-QGZVFWFLSA-N 1 2 316.832 4.327 20 0 DIADLO COc1ccc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)cc1Cl ZINC000430105180 338096900 /nfs/dbraw/zinc/09/69/00/338096900.db2.gz OHOOHFFRPWGFAQ-QGZVFWFLSA-N 1 2 316.832 4.327 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(F)cc2Cl)[C@@H]1c1cccnc1 ZINC000430104139 338096948 /nfs/dbraw/zinc/09/69/48/338096948.db2.gz QYYSKGAONLFXJU-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(F)cc2Cl)[C@@H]1c1cccnc1 ZINC000430104139 338096949 /nfs/dbraw/zinc/09/69/49/338096949.db2.gz QYYSKGAONLFXJU-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO Clc1ccc(C2CC[NH+](Cc3cocn3)CC2)c(Cl)c1 ZINC000430109536 338097395 /nfs/dbraw/zinc/09/73/95/338097395.db2.gz CRQJDKKUAPYGNG-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccnc2)s1 ZINC000430111038 338097415 /nfs/dbraw/zinc/09/74/15/338097415.db2.gz NGJPKTFVOKWQBQ-HNNXBMFYSA-N 1 2 301.459 4.245 20 0 DIADLO CC(C)c1ncc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)s1 ZINC000430111038 338097416 /nfs/dbraw/zinc/09/74/16/338097416.db2.gz NGJPKTFVOKWQBQ-HNNXBMFYSA-N 1 2 301.459 4.245 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1ccc(-c2ccncc2)cc1F ZINC000430210639 338101615 /nfs/dbraw/zinc/10/16/15/338101615.db2.gz URJZXEUNWPMVIS-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1ccc(-c2ccncc2)cc1F ZINC000430210639 338101616 /nfs/dbraw/zinc/10/16/16/338101616.db2.gz URJZXEUNWPMVIS-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO CC1=C[C@@H](C)C[N@H+](Cc2csc(COc3ccccc3)n2)C1 ZINC000430283706 338104351 /nfs/dbraw/zinc/10/43/51/338104351.db2.gz IWXUFCYIUDHWRZ-CQSZACIVSA-N 1 2 314.454 4.120 20 0 DIADLO CC1=C[C@@H](C)C[N@@H+](Cc2csc(COc3ccccc3)n2)C1 ZINC000430283706 338104352 /nfs/dbraw/zinc/10/43/52/338104352.db2.gz IWXUFCYIUDHWRZ-CQSZACIVSA-N 1 2 314.454 4.120 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@H+]2CC(C)=C[C@@H](C)C2)c(Cl)c1 ZINC000430284081 338104414 /nfs/dbraw/zinc/10/44/14/338104414.db2.gz KLISZWSMAIXNHO-DOMZBBRYSA-N 1 2 320.864 4.182 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@@H+]2CC(C)=C[C@@H](C)C2)c(Cl)c1 ZINC000430284081 338104415 /nfs/dbraw/zinc/10/44/15/338104415.db2.gz KLISZWSMAIXNHO-DOMZBBRYSA-N 1 2 320.864 4.182 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000430866289 338117485 /nfs/dbraw/zinc/11/74/85/338117485.db2.gz GFTNQSCCPXMQCV-UAGQMJEPSA-N 1 2 313.445 4.347 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000430866289 338117486 /nfs/dbraw/zinc/11/74/86/338117486.db2.gz GFTNQSCCPXMQCV-UAGQMJEPSA-N 1 2 313.445 4.347 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1cc(Cl)cs1 ZINC000430877020 338117856 /nfs/dbraw/zinc/11/78/56/338117856.db2.gz UPKRJDHDVSLDFH-AWEZNQCLSA-N 1 2 309.866 4.345 20 0 DIADLO Cc1ccc(C)c2[nH+]c(-c3ccccc3-c3ccnn3C)[nH]c21 ZINC000430943337 338119221 /nfs/dbraw/zinc/11/92/21/338119221.db2.gz ORGCEJYKCDJTBW-UHFFFAOYSA-N 1 2 302.381 4.247 20 0 DIADLO C[C@H]1CCN(c2[nH+]c3ccc(F)cc3n2C)[C@@H](c2ccco2)C1 ZINC000431425012 338130468 /nfs/dbraw/zinc/13/04/68/338130468.db2.gz ARSUOXAHQQNGDI-BLLLJJGKSA-N 1 2 313.376 4.283 20 0 DIADLO Cc1nc(COc2cc[nH+]cc2)oc1-c1ccc(Cl)cc1 ZINC000431488916 338132101 /nfs/dbraw/zinc/13/21/01/338132101.db2.gz RSCCLXMURDZEEA-UHFFFAOYSA-N 1 2 300.745 4.277 20 0 DIADLO Clc1cccc(Cl)c1-c1nnc(COc2cc[nH+]cc2)o1 ZINC000431488802 338132134 /nfs/dbraw/zinc/13/21/34/338132134.db2.gz WVRQZYHQJNCIMO-UHFFFAOYSA-N 1 2 322.151 4.017 20 0 DIADLO Clc1ccc(Cc2nc(COc3cc[nH+]cc3)cs2)cc1 ZINC000431491935 338132207 /nfs/dbraw/zinc/13/22/07/338132207.db2.gz ADILCURBKHYFAO-UHFFFAOYSA-N 1 2 316.813 4.361 20 0 DIADLO Cc1cc(N2CC[C@@H](c3cccc(Cl)c3)C2)nc(C2CC2)[nH+]1 ZINC000432134225 338146680 /nfs/dbraw/zinc/14/66/80/338146680.db2.gz CJHDNQOKOATNAU-OAHLLOKOSA-N 1 2 313.832 4.310 20 0 DIADLO CCN(c1ccccc1)c1cc(NCC2(C(F)F)CC2)[nH+]cn1 ZINC000432166480 338147801 /nfs/dbraw/zinc/14/78/01/338147801.db2.gz YCDJMFBQEDJNHG-UHFFFAOYSA-N 1 2 318.371 4.092 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)cs1 ZINC000432240859 338149952 /nfs/dbraw/zinc/14/99/52/338149952.db2.gz GURWEJPZXPWCLZ-UHFFFAOYSA-N 1 2 319.232 4.441 20 0 DIADLO Clc1scc(C[N@@H+]2CCC[C@H](n3cccn3)C2)c1Cl ZINC000432737274 338165291 /nfs/dbraw/zinc/16/52/91/338165291.db2.gz BRRLUTCDFWSDTM-NSHDSACASA-N 1 2 316.257 4.089 20 0 DIADLO Clc1scc(C[N@H+]2CCC[C@H](n3cccn3)C2)c1Cl ZINC000432737274 338165292 /nfs/dbraw/zinc/16/52/92/338165292.db2.gz BRRLUTCDFWSDTM-NSHDSACASA-N 1 2 316.257 4.089 20 0 DIADLO CC(C)C[C@@H]1COCC[N@@H+]1Cc1ccc(C(F)(F)F)s1 ZINC000432748150 338165993 /nfs/dbraw/zinc/16/59/93/338165993.db2.gz BFFKWDSQKCLBLS-LLVKDONJSA-N 1 2 307.381 4.014 20 0 DIADLO CC(C)C[C@@H]1COCC[N@H+]1Cc1ccc(C(F)(F)F)s1 ZINC000432748150 338165994 /nfs/dbraw/zinc/16/59/94/338165994.db2.gz BFFKWDSQKCLBLS-LLVKDONJSA-N 1 2 307.381 4.014 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCc4cccc(F)c4C3)sc2c1 ZINC000432750534 338166183 /nfs/dbraw/zinc/16/61/83/338166183.db2.gz LXNWBZIWVJJESD-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCc4cccc(F)c4C3)sc2c1 ZINC000432750534 338166184 /nfs/dbraw/zinc/16/61/84/338166184.db2.gz LXNWBZIWVJJESD-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO Clc1scc(C[NH+]2CCC(OCC3CC3)CC2)c1Cl ZINC000432754178 338166649 /nfs/dbraw/zinc/16/66/49/338166649.db2.gz JGPLDKSGXGQZAK-UHFFFAOYSA-N 1 2 320.285 4.446 20 0 DIADLO CCc1cccc(Cl)c1CN(C)Cc1cn2c([nH+]1)CCCC2 ZINC000432798873 338168385 /nfs/dbraw/zinc/16/83/85/338168385.db2.gz SUNWTTOGWUPEDB-UHFFFAOYSA-N 1 2 317.864 4.067 20 0 DIADLO Fc1ccc(CN2CCC[C@H]2c2[nH]cc[nH+]2)c(Cl)c1Cl ZINC000432917094 338173003 /nfs/dbraw/zinc/17/30/03/338173003.db2.gz OPMRJMUTLLRIDQ-NSHDSACASA-N 1 2 314.191 4.193 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@H](c3ccccc3)C2)c(C)[nH+]1 ZINC000433020096 338176588 /nfs/dbraw/zinc/17/65/88/338176588.db2.gz BJVHVSKZOAARGZ-KRWDZBQOSA-N 1 2 309.413 4.110 20 0 DIADLO CCc1cnc(C[NH+]2CCC(c3ncccc3Cl)CC2)s1 ZINC000433042657 338177931 /nfs/dbraw/zinc/17/79/31/338177931.db2.gz GEHDUBRUPFVZKW-UHFFFAOYSA-N 1 2 321.877 4.134 20 0 DIADLO Clc1ccc(C[NH+]2CCC(c3ncccc3Cl)CC2)o1 ZINC000433049427 338178531 /nfs/dbraw/zinc/17/85/31/338178531.db2.gz UPKMIODNKSCPNN-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO CCCc1csc(C[NH2+]Cc2cc(F)c(Cl)cc2F)n1 ZINC000433189875 338184861 /nfs/dbraw/zinc/18/48/61/338184861.db2.gz SXJPTTCGAIRQCQ-UHFFFAOYSA-N 1 2 316.804 4.317 20 0 DIADLO C[N@H+](Cc1nc2ccc(F)cc2o1)Cc1ccc(F)c(Cl)c1 ZINC000433251542 338187952 /nfs/dbraw/zinc/18/79/52/338187952.db2.gz GEZKGSQPSHVEJX-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO C[N@@H+](Cc1nc2ccc(F)cc2o1)Cc1ccc(F)c(Cl)c1 ZINC000433251542 338187953 /nfs/dbraw/zinc/18/79/53/338187953.db2.gz GEZKGSQPSHVEJX-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO CN(Cc1cc(Cl)ccc1F)c1cc[nH+]c2ccncc21 ZINC000433788535 338201818 /nfs/dbraw/zinc/20/18/18/338201818.db2.gz HDGFJJHUUSDIIU-UHFFFAOYSA-N 1 2 301.752 4.059 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@@H+]2Cc2ncnn2C(C)C)o1 ZINC000434541493 338219979 /nfs/dbraw/zinc/21/99/79/338219979.db2.gz FHSADOTWCJXBRF-MRXNPFEDSA-N 1 2 316.449 4.132 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@H+]2Cc2ncnn2C(C)C)o1 ZINC000434541493 338219980 /nfs/dbraw/zinc/21/99/80/338219980.db2.gz FHSADOTWCJXBRF-MRXNPFEDSA-N 1 2 316.449 4.132 20 0 DIADLO CC(C)Cc1noc(C[N@H+](C)[C@@H](c2ccc(F)cc2)C(C)C)n1 ZINC000434617850 338221263 /nfs/dbraw/zinc/22/12/63/338221263.db2.gz MWZKJSQPSQPHRA-GOSISDBHSA-N 1 2 319.424 4.236 20 0 DIADLO CC(C)Cc1noc(C[N@@H+](C)[C@@H](c2ccc(F)cc2)C(C)C)n1 ZINC000434617850 338221264 /nfs/dbraw/zinc/22/12/64/338221264.db2.gz MWZKJSQPSQPHRA-GOSISDBHSA-N 1 2 319.424 4.236 20 0 DIADLO Cc1cccn2c(/C=C\c3ncc(Br)s3)c[nH+]c12 ZINC000434634443 338222039 /nfs/dbraw/zinc/22/20/39/338222039.db2.gz ROPZUCSKJBYCHA-PLNGDYQASA-N 1 2 320.215 4.032 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1OC(F)(F)F)c1nccs1 ZINC000153323001 338222484 /nfs/dbraw/zinc/22/24/84/338222484.db2.gz TVZOFZZWKOALGJ-UWVGGRQHSA-N 1 2 316.348 4.454 20 0 DIADLO Cc1ccc(Cl)c(NCc2[nH+]ccn2CC(F)(F)F)c1C ZINC000434746039 338224636 /nfs/dbraw/zinc/22/46/36/338224636.db2.gz LJPVMGVMSPEARV-UHFFFAOYSA-N 1 2 317.742 4.328 20 0 DIADLO CC[N@H+](Cc1ncc(C(F)(F)F)s1)Cc1cccc(F)c1 ZINC000435134747 338232857 /nfs/dbraw/zinc/23/28/57/338232857.db2.gz ZAFKTGROTLMHEX-UHFFFAOYSA-N 1 2 318.339 4.323 20 0 DIADLO CC[N@@H+](Cc1ncc(C(F)(F)F)s1)Cc1cccc(F)c1 ZINC000435134747 338232858 /nfs/dbraw/zinc/23/28/58/338232858.db2.gz ZAFKTGROTLMHEX-UHFFFAOYSA-N 1 2 318.339 4.323 20 0 DIADLO CCS[C@@H]1CCCC[N@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC000435136024 338233047 /nfs/dbraw/zinc/23/30/47/338233047.db2.gz XKBJNZGHAOUGJJ-SNVBAGLBSA-N 1 2 324.437 4.270 20 0 DIADLO CCS[C@@H]1CCCC[N@@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC000435136024 338233048 /nfs/dbraw/zinc/23/30/48/338233048.db2.gz XKBJNZGHAOUGJJ-SNVBAGLBSA-N 1 2 324.437 4.270 20 0 DIADLO CC(C)[C@H](c1ccc(F)cc1)[N@H+](C)Cc1c(Cl)cnn1C ZINC000435301390 338236745 /nfs/dbraw/zinc/23/67/45/338236745.db2.gz YAPMTSDOIMZHGV-MRXNPFEDSA-N 1 2 309.816 4.042 20 0 DIADLO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1c(Cl)cnn1C ZINC000435301390 338236746 /nfs/dbraw/zinc/23/67/46/338236746.db2.gz YAPMTSDOIMZHGV-MRXNPFEDSA-N 1 2 309.816 4.042 20 0 DIADLO C[C@@H]1[C@H](C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)[C@H]1c1ccccc1 ZINC000435618236 338243624 /nfs/dbraw/zinc/24/36/24/338243624.db2.gz SBKXRQXMGJOJDC-VHSSKADRSA-N 1 2 317.392 4.065 20 0 DIADLO C[C@H](C(=O)Nc1cccc2ccccc21)[NH+]1Cc2ccccc2C1 ZINC000436123192 338258960 /nfs/dbraw/zinc/25/89/60/338258960.db2.gz LJHIUYWDWRXTNN-OAHLLOKOSA-N 1 2 316.404 4.183 20 0 DIADLO O=C(CC1CCC1)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436159456 338259985 /nfs/dbraw/zinc/25/99/85/338259985.db2.gz FRDCCUAIXLVKEB-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO CCCCCC(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436171929 338260478 /nfs/dbraw/zinc/26/04/78/338260478.db2.gz OZEIKKRUTWZCMO-UHFFFAOYSA-N 1 2 311.429 4.405 20 0 DIADLO CC(C)[C@@H]1C[C@@H]1C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436185675 338261147 /nfs/dbraw/zinc/26/11/47/338261147.db2.gz FKPZPRGMPAAYGW-ROUUACIJSA-N 1 2 323.440 4.117 20 0 DIADLO COc1cc(C)[nH+]c(CSc2nc(-c3ccccc3)co2)c1 ZINC000436239013 338262917 /nfs/dbraw/zinc/26/29/17/338262917.db2.gz FQQUGEXHORJBBN-UHFFFAOYSA-N 1 2 312.394 4.346 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](c2ccccc2)C2CC2)c(C)[nH+]1 ZINC000436486279 338273828 /nfs/dbraw/zinc/27/38/28/338273828.db2.gz BPOFQYNQJNKWIS-GOSISDBHSA-N 1 2 309.413 4.280 20 0 DIADLO CCc1ccc([C@@H](C)NC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000436490446 338274105 /nfs/dbraw/zinc/27/41/05/338274105.db2.gz HBCFRBDHAPNIHV-CQSZACIVSA-N 1 2 311.429 4.452 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCc3ccccc3[C@H]2C)c(C)[nH+]1 ZINC000436493549 338274206 /nfs/dbraw/zinc/27/42/06/338274206.db2.gz LXZDBDCMYCUGHU-OAHLLOKOSA-N 1 2 309.413 4.158 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@H]2c2cccs2)c(C)[nH+]1 ZINC000436494705 338274312 /nfs/dbraw/zinc/27/43/12/338274312.db2.gz NOPAYCIOIYXUOH-AWEZNQCLSA-N 1 2 315.442 4.437 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)Cc2ccccc2Cl)c(C)[nH+]1 ZINC000436498377 338274314 /nfs/dbraw/zinc/27/43/14/338274314.db2.gz UYEWMNADNXNWCR-UHFFFAOYSA-N 1 2 317.820 4.324 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@@H]2CCc3ccccc32)c(C)[nH+]1 ZINC000436494835 338274401 /nfs/dbraw/zinc/27/44/01/338274401.db2.gz OHCKDDGOEFORGL-QGZVFWFLSA-N 1 2 309.413 4.158 20 0 DIADLO CC(C)c1cccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)c1 ZINC000437008331 338297525 /nfs/dbraw/zinc/29/75/25/338297525.db2.gz PWCYNXHWAKTDHS-LJQANCHMSA-N 1 2 305.425 4.412 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1cccc(F)c1 ZINC000437008881 338297638 /nfs/dbraw/zinc/29/76/38/338297638.db2.gz XFHPUWRVZLGWRH-KRWDZBQOSA-N 1 2 320.408 4.370 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+](CCC(F)(F)F)CC2CC2)o1 ZINC000437518553 338312333 /nfs/dbraw/zinc/31/23/33/338312333.db2.gz VAYBUHQELBZIRO-UHFFFAOYSA-N 1 2 304.356 4.137 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+](CCC(F)(F)F)CC2CC2)o1 ZINC000437518553 338312334 /nfs/dbraw/zinc/31/23/34/338312334.db2.gz VAYBUHQELBZIRO-UHFFFAOYSA-N 1 2 304.356 4.137 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3c(cccc3F)[nH]2)C[C@H](c2ccccc2)O1 ZINC000437683928 338318168 /nfs/dbraw/zinc/31/81/68/338318168.db2.gz BONGLHZJOTZHFU-JLTOFOAXSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3c(cccc3F)[nH]2)C[C@H](c2ccccc2)O1 ZINC000437683928 338318169 /nfs/dbraw/zinc/31/81/69/338318169.db2.gz BONGLHZJOTZHFU-JLTOFOAXSA-N 1 2 324.399 4.269 20 0 DIADLO Clc1oc2ccccc2c1CN1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000437956714 338326353 /nfs/dbraw/zinc/32/63/53/338326353.db2.gz BNOYBKWLWWGOGZ-ZDUSSCGKSA-N 1 2 301.777 4.146 20 0 DIADLO Clc1oc2ccccc2c1C[N@@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000437956714 338326354 /nfs/dbraw/zinc/32/63/54/338326354.db2.gz BNOYBKWLWWGOGZ-ZDUSSCGKSA-N 1 2 301.777 4.146 20 0 DIADLO Clc1oc2ccccc2c1C[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000437956714 338326355 /nfs/dbraw/zinc/32/63/55/338326355.db2.gz BNOYBKWLWWGOGZ-ZDUSSCGKSA-N 1 2 301.777 4.146 20 0 DIADLO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2cccc(OC3CCCC3)c2)n1 ZINC000437978176 338327066 /nfs/dbraw/zinc/32/70/66/338327066.db2.gz UFYXUSVQUOAHOT-SFHVURJKSA-N 1 2 311.429 4.068 20 0 DIADLO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2cccc(OC3CCCC3)c2)n1 ZINC000437978176 338327067 /nfs/dbraw/zinc/32/70/67/338327067.db2.gz UFYXUSVQUOAHOT-SFHVURJKSA-N 1 2 311.429 4.068 20 0 DIADLO FC(F)(F)[C@H]1CCC[C@H](Nc2ccc(N3CCCC3)c[nH+]2)C1 ZINC000438089206 338330782 /nfs/dbraw/zinc/33/07/82/338330782.db2.gz UHSSZSKUSQQOMF-STQMWFEESA-N 1 2 313.367 4.215 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3c(cccc3F)[nH]2)[C@H](c2ccccc2)CO1 ZINC000438091158 338331066 /nfs/dbraw/zinc/33/10/66/338331066.db2.gz AGOPDLMDHXSDJS-VLIAUNLRSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3c(cccc3F)[nH]2)[C@H](c2ccccc2)CO1 ZINC000438091158 338331067 /nfs/dbraw/zinc/33/10/67/338331067.db2.gz AGOPDLMDHXSDJS-VLIAUNLRSA-N 1 2 324.399 4.269 20 0 DIADLO CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000438135007 338333894 /nfs/dbraw/zinc/33/38/94/338333894.db2.gz UTSTWYYMDBRQNS-CZUORRHYSA-N 1 2 314.433 4.075 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2nc3cc(Cl)ccc3[nH]2)o1 ZINC000438290133 338338691 /nfs/dbraw/zinc/33/86/91/338338691.db2.gz MTLDNXGUDRJZSK-MRXNPFEDSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@@H]2c2nc3cc(Cl)ccc3[nH]2)o1 ZINC000438290133 338338692 /nfs/dbraw/zinc/33/86/92/338338692.db2.gz MTLDNXGUDRJZSK-MRXNPFEDSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)o1 ZINC000438290133 338338693 /nfs/dbraw/zinc/33/86/93/338338693.db2.gz MTLDNXGUDRJZSK-MRXNPFEDSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)o1 ZINC000438290133 338338694 /nfs/dbraw/zinc/33/86/94/338338694.db2.gz MTLDNXGUDRJZSK-MRXNPFEDSA-N 1 2 315.804 4.455 20 0 DIADLO CCc1ccc(NCc2c[nH+]cn2Cc2ccccc2)cc1F ZINC000438294847 338338921 /nfs/dbraw/zinc/33/89/21/338338921.db2.gz OZDLYTMFKHDYIU-UHFFFAOYSA-N 1 2 309.388 4.245 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@H](c3cccc(Cl)c3)OC[C@H]2C)nc1 ZINC000438546718 338347535 /nfs/dbraw/zinc/34/75/35/338347535.db2.gz MWZXIZWLGGYTBA-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@H](c3cccc(Cl)c3)OC[C@H]2C)nc1 ZINC000438546718 338347536 /nfs/dbraw/zinc/34/75/36/338347536.db2.gz MWZXIZWLGGYTBA-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@H](c3cccc(Cl)c3)OC[C@H]2C)cn1 ZINC000438550809 338347703 /nfs/dbraw/zinc/34/77/03/338347703.db2.gz BPGONHZIGBDWLU-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@H](c3cccc(Cl)c3)OC[C@H]2C)cn1 ZINC000438550809 338347704 /nfs/dbraw/zinc/34/77/04/338347704.db2.gz BPGONHZIGBDWLU-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cccnc1C[N@H+]1C[C@@H](c2cccc(Cl)c2)OC[C@H]1C ZINC000438554727 338347952 /nfs/dbraw/zinc/34/79/52/338347952.db2.gz VVZUOGTXPYKYPL-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cccnc1C[N@@H+]1C[C@@H](c2cccc(Cl)c2)OC[C@H]1C ZINC000438554727 338347953 /nfs/dbraw/zinc/34/79/53/338347953.db2.gz VVZUOGTXPYKYPL-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO CC[N@H+](Cc1ccccc1Br)[C@@H](C)c1ccccn1 ZINC000439314690 338366662 /nfs/dbraw/zinc/36/66/62/338366662.db2.gz NMEUIDLMGSMXKM-ZDUSSCGKSA-N 1 2 319.246 4.427 20 0 DIADLO CC[N@@H+](Cc1ccccc1Br)[C@@H](C)c1ccccn1 ZINC000439314690 338366663 /nfs/dbraw/zinc/36/66/63/338366663.db2.gz NMEUIDLMGSMXKM-ZDUSSCGKSA-N 1 2 319.246 4.427 20 0 DIADLO CSc1ccc([C@@H](C)NC(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000439458483 338370051 /nfs/dbraw/zinc/37/00/51/338370051.db2.gz DOYHKWZTJRDIAE-GFCCVEGCSA-N 1 2 315.442 4.303 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+]1CCCc2c3cccc(F)c3[nH]c2C1 ZINC000439475497 338370932 /nfs/dbraw/zinc/37/09/32/338370932.db2.gz YNVLXMDPCIMAJR-ZDUSSCGKSA-N 1 2 309.388 4.211 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+]1CCCc2c3cccc(F)c3[nH]c2C1 ZINC000439475497 338370933 /nfs/dbraw/zinc/37/09/33/338370933.db2.gz YNVLXMDPCIMAJR-ZDUSSCGKSA-N 1 2 309.388 4.211 20 0 DIADLO CC(C)CCn1c2ccccc2nc1SCc1c[nH+]cn1C ZINC000439523763 338372411 /nfs/dbraw/zinc/37/24/11/338372411.db2.gz DXVNTTQEHPTUQW-UHFFFAOYSA-N 1 2 314.458 4.108 20 0 DIADLO C[C@H](SCc1c[nH+]cn1C)c1ccc(OC(F)(F)F)cc1 ZINC000439546594 338372890 /nfs/dbraw/zinc/37/28/90/338372890.db2.gz WICYLJVBNADTBD-JTQLQIEISA-N 1 2 316.348 4.313 20 0 DIADLO CCC[C@@H]([NH2+][C@H](C)c1ccc(SCC)cc1)C(=O)OCC ZINC000439595720 338373878 /nfs/dbraw/zinc/37/38/78/338373878.db2.gz YFJYIYPHYHTOEV-CZUORRHYSA-N 1 2 309.475 4.181 20 0 DIADLO CCC[C@H]([NH2+][C@H](C)c1ccc(SCC)cc1)C(=O)OCC ZINC000439595719 338373911 /nfs/dbraw/zinc/37/39/11/338373911.db2.gz YFJYIYPHYHTOEV-CJNGLKHVSA-N 1 2 309.475 4.181 20 0 DIADLO Cc1ccc(C)c(Cn2nc(C(F)(F)F)c3c[nH+]ccc32)c1 ZINC000439883099 338380119 /nfs/dbraw/zinc/38/01/19/338380119.db2.gz MXDMKPHECYKIGC-UHFFFAOYSA-N 1 2 305.303 4.115 20 0 DIADLO FC(F)(F)c1nn(C/C=C/c2ccccc2)c2cc[nH+]cc21 ZINC000156703344 338380391 /nfs/dbraw/zinc/38/03/91/338380391.db2.gz SAFTZKLOQMVKQY-QPJJXVBHSA-N 1 2 303.287 4.164 20 0 DIADLO CC(C)c1ncc(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)cn1 ZINC000440480712 338388202 /nfs/dbraw/zinc/38/82/02/338388202.db2.gz WZHMXFMSSJBXAP-LBPRGKRZSA-N 1 2 305.372 4.071 20 0 DIADLO CC(C)c1ncc(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)cn1 ZINC000440480712 338388203 /nfs/dbraw/zinc/38/82/03/338388203.db2.gz WZHMXFMSSJBXAP-LBPRGKRZSA-N 1 2 305.372 4.071 20 0 DIADLO Cc1ccc(/C=C/CC(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000440600535 338391890 /nfs/dbraw/zinc/39/18/90/338391890.db2.gz XQCDSCMEKOZKRI-DUXPYHPUSA-N 1 2 317.392 4.223 20 0 DIADLO COCC[C@@H](Nc1cc[nH+]c2c(OC)cccc12)c1ccco1 ZINC000440634423 338393501 /nfs/dbraw/zinc/39/35/01/338393501.db2.gz GKPNWOFWNSJABK-OAHLLOKOSA-N 1 2 312.369 4.026 20 0 DIADLO CO[C@@H]1CCN(c2cc(C(C)(C)C)[nH+]c(C(C)(C)C)n2)[C@H](C)C1 ZINC000440669278 338394937 /nfs/dbraw/zinc/39/49/37/338394937.db2.gz DUZAPGDAXOAULB-ZIAGYGMSSA-N 1 2 319.493 4.075 20 0 DIADLO CC[C@@H](F)C[N@@H+]1CCCC[C@@H]1c1nc(-c2ccccc2)no1 ZINC000440690719 338395199 /nfs/dbraw/zinc/39/51/99/338395199.db2.gz DEPSYOPTIUYVDQ-HUUCEWRRSA-N 1 2 303.381 4.012 20 0 DIADLO CC[C@@H](F)C[N@H+]1CCCC[C@@H]1c1nc(-c2ccccc2)no1 ZINC000440690719 338395200 /nfs/dbraw/zinc/39/52/00/338395200.db2.gz DEPSYOPTIUYVDQ-HUUCEWRRSA-N 1 2 303.381 4.012 20 0 DIADLO Cc1cc(C)cc(NC(=O)C[N@@H+]([C@H](C)c2ccco2)C2CC2)c1 ZINC000440895818 338399415 /nfs/dbraw/zinc/39/94/15/338399415.db2.gz YXMAJGLVVBROJT-OAHLLOKOSA-N 1 2 312.413 4.061 20 0 DIADLO Cc1cc(C)cc(NC(=O)C[N@H+]([C@H](C)c2ccco2)C2CC2)c1 ZINC000440895818 338399416 /nfs/dbraw/zinc/39/94/16/338399416.db2.gz YXMAJGLVVBROJT-OAHLLOKOSA-N 1 2 312.413 4.061 20 0 DIADLO CCCC[C@@H](CCC)CNC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000441685865 338418462 /nfs/dbraw/zinc/41/84/62/338418462.db2.gz BHAURPKRNLYTLA-HZPDHXFCSA-N 1 2 320.481 4.253 20 0 DIADLO Cc1cc(N[C@@H](c2[nH]cc[nH+]2)c2cccnc2)cc(C)c1Cl ZINC000442805384 338432701 /nfs/dbraw/zinc/43/27/01/338432701.db2.gz AFRSHSWNXGBIJQ-MRXNPFEDSA-N 1 2 312.804 4.276 20 0 DIADLO Cc1cc(N2CC[C@H](C)[C@@H]2c2ccc(C(F)(F)F)cc2)nc[nH+]1 ZINC000446879850 338539182 /nfs/dbraw/zinc/53/91/82/338539182.db2.gz URXDYWWATYNQNL-MEDUHNTESA-N 1 2 321.346 4.391 20 0 DIADLO C=Cn1cc(CNc2[nH+]cccc2O[C@@H](C)c2ccccc2)cn1 ZINC000446971258 338542086 /nfs/dbraw/zinc/54/20/86/338542086.db2.gz DNJDKPWDRAGPDI-HNNXBMFYSA-N 1 2 320.396 4.131 20 0 DIADLO Cc1ccc(C[S@@](=O)Cc2ccc(C)[nH+]c2C)c(Cl)c1 ZINC000447105362 338545624 /nfs/dbraw/zinc/54/56/24/338545624.db2.gz GODASXUAUMLHGD-FQEVSTJZSA-N 1 2 307.846 4.109 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2ncc(C(C)(C)C)s2)C2CC2)s1 ZINC000447944619 338572444 /nfs/dbraw/zinc/57/24/44/338572444.db2.gz SCIMTEIABQRFKJ-CQSZACIVSA-N 1 2 321.515 4.446 20 0 DIADLO C[C@H]1CSC[C@H]1Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000449047558 338587769 /nfs/dbraw/zinc/58/77/69/338587769.db2.gz BZQYKJSJCPPLML-SUMWQHHRSA-N 1 2 313.470 4.050 20 0 DIADLO COc1cnccc1[C@@H](C)[NH2+]Cc1cc(Cl)sc1Cl ZINC000449268979 338608439 /nfs/dbraw/zinc/60/84/39/338608439.db2.gz KUTAJDUBXNAFMB-MRVPVSSYSA-N 1 2 317.241 4.309 20 0 DIADLO Cc1cc(C[NH2+][C@H](CO)c2c(Cl)cccc2Cl)cs1 ZINC000449296222 338610453 /nfs/dbraw/zinc/61/04/53/338610453.db2.gz APNUUHUKPHNREH-CYBMUJFWSA-N 1 2 316.253 4.187 20 0 DIADLO FCC(CF)[NH2+]Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 ZINC000449382359 338619770 /nfs/dbraw/zinc/61/97/70/338619770.db2.gz WIIHUJKPOCQIDG-UHFFFAOYSA-N 1 2 319.273 4.363 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@@H](Nc2cccc(CCO)c2)C1 ZINC000449759669 338650315 /nfs/dbraw/zinc/65/03/15/338650315.db2.gz YPJBODGIONWHEN-PKOBYXMFSA-N 1 2 310.441 4.063 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](c2ccco2)c2ccc(OC)cc2)cn1 ZINC000449781525 338652653 /nfs/dbraw/zinc/65/26/53/338652653.db2.gz WQDUFHNYZNDJTD-HXUWFJFHSA-N 1 2 322.408 4.125 20 0 DIADLO C[C@@H](CCO)CCNc1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000450567775 338691325 /nfs/dbraw/zinc/69/13/25/338691325.db2.gz RRKXIEGYJQKJNJ-LLVKDONJSA-N 1 2 312.335 4.074 20 0 DIADLO C[C@H](CCO)CCNc1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000450567797 338691377 /nfs/dbraw/zinc/69/13/77/338691377.db2.gz RRKXIEGYJQKJNJ-NSHDSACASA-N 1 2 312.335 4.074 20 0 DIADLO CC(C)CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2csnn2)cc1 ZINC000450667708 338697323 /nfs/dbraw/zinc/69/73/23/338697323.db2.gz MCXPAKBRZQZILI-KBPBESRZSA-N 1 2 319.474 4.375 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1OC1CC1)c1c(F)cccc1F ZINC000450671097 338697697 /nfs/dbraw/zinc/69/76/97/338697697.db2.gz ULEBXTWBWLYWRF-LBPRGKRZSA-N 1 2 303.352 4.357 20 0 DIADLO CC(C)[C@@H]([NH2+][C@@H](C)c1csnn1)c1ccc(Cl)cc1F ZINC000450709902 338700233 /nfs/dbraw/zinc/70/02/33/338700233.db2.gz BWZYBJJYJDGLDV-LKFCYVNXSA-N 1 2 313.829 4.379 20 0 DIADLO Fc1ccc2cc[nH+]c(NC[C@H]3CCOC4(CCC4)C3)c2c1 ZINC000450711953 338700427 /nfs/dbraw/zinc/70/04/27/338700427.db2.gz DJOLPILZZQFBRX-ZDUSSCGKSA-N 1 2 300.377 4.135 20 0 DIADLO Cc1cc(N2CC[C@H](C(F)(F)F)C[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000450714922 338700705 /nfs/dbraw/zinc/70/07/05/338700705.db2.gz YNHNPSVJQGARNN-RYUDHWBXSA-N 1 2 301.356 4.076 20 0 DIADLO CC1(C)C[C@@H](O)CCN(c2cc[nH+]c3cc(F)c(Cl)cc32)C1 ZINC000450858029 338708873 /nfs/dbraw/zinc/70/88/73/338708873.db2.gz RWOWYDNXUWHJDG-NSHDSACASA-N 1 2 322.811 4.015 20 0 DIADLO c1nc(C2CC2)oc1CNc1[nH+]cccc1OCc1ccccc1 ZINC000450916141 338712387 /nfs/dbraw/zinc/71/23/87/338712387.db2.gz QRZUFUAIHGFNDJ-UHFFFAOYSA-N 1 2 321.380 4.138 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@@H](C)c2cccc(C3CC3)c2)n1 ZINC000451117202 338721826 /nfs/dbraw/zinc/72/18/26/338721826.db2.gz SZNQVRHAHCUQDW-AWEZNQCLSA-N 1 2 313.445 4.386 20 0 DIADLO CC(C)c1occc1C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC000452358603 338764461 /nfs/dbraw/zinc/76/44/61/338764461.db2.gz TTZCNGJNTFUWRM-UHFFFAOYSA-N 1 2 323.396 4.270 20 0 DIADLO CCC1(NC(=O)c2ccc(Oc3cc[nH+]cc3)c(Cl)c2)CC1 ZINC000452455708 338767028 /nfs/dbraw/zinc/76/70/28/338767028.db2.gz ACGZPYHZLKQRPR-UHFFFAOYSA-N 1 2 316.788 4.200 20 0 DIADLO Cc1cccn2cc(CNc3ccc(C(=O)C(C)C)cc3)[nH+]c12 ZINC000453161010 338801111 /nfs/dbraw/zinc/80/11/11/338801111.db2.gz PTWNGSUQVPZTBV-UHFFFAOYSA-N 1 2 307.397 4.094 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@H]1C[C@@H](C)n2ccnc21 ZINC000453225848 338810634 /nfs/dbraw/zinc/81/06/34/338810634.db2.gz XIBXLQRWPNAZIH-SNPRPXQTSA-N 1 2 323.362 4.481 20 0 DIADLO CC[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1cccc(Cl)c1F ZINC000453332482 338826184 /nfs/dbraw/zinc/82/61/84/338826184.db2.gz AQUFIGRBNIUNOL-LEWSCRJBSA-N 1 2 307.800 4.422 20 0 DIADLO Cc1ccc(OC(F)F)c([C@H](C)[NH2+][C@H]2C[C@H](C)n3ccnc32)c1 ZINC000453332506 338826354 /nfs/dbraw/zinc/82/63/54/338826354.db2.gz AURFMUJBLPFTJM-OBJOEFQTSA-N 1 2 321.371 4.150 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](c1cc(F)ccc1F)C(C)C ZINC000453335898 338826805 /nfs/dbraw/zinc/82/68/05/338826805.db2.gz FBUUUDJYLQDKFS-BLLLJJGKSA-N 1 2 307.388 4.229 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)cn1 ZINC000453382869 338835441 /nfs/dbraw/zinc/83/54/41/338835441.db2.gz YORAFNDEZQNNEH-JTQLQIEISA-N 1 2 315.364 4.025 20 0 DIADLO CCc1ncc(C[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)o1 ZINC000453400609 338838343 /nfs/dbraw/zinc/83/83/43/338838343.db2.gz YOSAOVKYCWNTKM-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO CCCCc1ccc(NC(=O)N[C@@H]2C[C@H](C)n3cc[nH+]c32)cc1 ZINC000454155612 338854790 /nfs/dbraw/zinc/85/47/90/338854790.db2.gz BKNWGXVPTUPOQO-XJKSGUPXSA-N 1 2 312.417 4.053 20 0 DIADLO CC(C)[C@@H]1CCN1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000454774835 338871650 /nfs/dbraw/zinc/87/16/50/338871650.db2.gz FGKMQUOFZDXBET-KRWDZBQOSA-N 1 2 311.385 4.136 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCc3sccc3[C@H]2C)c(C)[nH+]1 ZINC000455471362 338895508 /nfs/dbraw/zinc/89/55/08/338895508.db2.gz INYVEFVXCQPADY-CYBMUJFWSA-N 1 2 315.442 4.220 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)C2CCC(C)(C)CC2)c(C)[nH+]1 ZINC000455493498 338896505 /nfs/dbraw/zinc/89/65/05/338896505.db2.gz MEVGJHNPUCWSSM-UHFFFAOYSA-N 1 2 303.450 4.439 20 0 DIADLO CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455497096 338896621 /nfs/dbraw/zinc/89/66/21/338896621.db2.gz PSBHPTPOYKKHTR-BLLLJJGKSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC(C3CCCCC3)C2)c(C)[nH+]1 ZINC000455525503 338897833 /nfs/dbraw/zinc/89/78/33/338897833.db2.gz PFZRMPVYWQUAMZ-UHFFFAOYSA-N 1 2 301.434 4.051 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456408018 338929150 /nfs/dbraw/zinc/92/91/50/338929150.db2.gz YXXJBOBRQBZULE-BMFZPTHFSA-N 1 2 303.450 4.002 20 0 DIADLO Cc1cc(C)c(CNC(=O)C[C@@H](c2ccccc2)C(C)C)c[nH+]1 ZINC000456830754 338942795 /nfs/dbraw/zinc/94/27/95/338942795.db2.gz DHJPDYUGVIXQPY-LJQANCHMSA-N 1 2 310.441 4.145 20 0 DIADLO CC[C@H](CC(F)F)C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000457785640 338978930 /nfs/dbraw/zinc/97/89/30/338978930.db2.gz OLTDZOIVZAGMQP-LLVKDONJSA-N 1 2 307.344 4.005 20 0 DIADLO CCCC[C@H](C)N(CCCC)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000459122916 339014171 /nfs/dbraw/zinc/01/41/71/339014171.db2.gz SYNPMFHLKFKMEM-HRCADAONSA-N 1 2 320.481 4.279 20 0 DIADLO CCCC[N@H+](Cc1cc(COC)on1)Cc1ccccc1Cl ZINC000459336253 339022526 /nfs/dbraw/zinc/02/25/26/339022526.db2.gz IZWDYVXUNAHIPK-UHFFFAOYSA-N 1 2 322.836 4.277 20 0 DIADLO CCCC[N@@H+](Cc1cc(COC)on1)Cc1ccccc1Cl ZINC000459336253 339022527 /nfs/dbraw/zinc/02/25/27/339022527.db2.gz IZWDYVXUNAHIPK-UHFFFAOYSA-N 1 2 322.836 4.277 20 0 DIADLO Fc1ccccc1C=C1CC[NH+](Cc2cnc(C3CC3)nc2)CC1 ZINC000459351793 339023769 /nfs/dbraw/zinc/02/37/69/339023769.db2.gz KEKSZBWLISGNAB-UHFFFAOYSA-N 1 2 323.415 4.173 20 0 DIADLO COc1cccc(C[NH2+]Cc2c(F)cc(C)cc2Cl)c1OC ZINC000459384709 339026262 /nfs/dbraw/zinc/02/62/62/339026262.db2.gz GQAUTYGYQWTLOR-UHFFFAOYSA-N 1 2 323.795 4.095 20 0 DIADLO Cc1ccc(NC(=O)N(C)[C@@H]2CCC[C@H]2c2ccccc2)c(C)[nH+]1 ZINC000459433253 339029040 /nfs/dbraw/zinc/02/90/40/339029040.db2.gz LLYONBATGUXKJX-PKOBYXMFSA-N 1 2 323.440 4.498 20 0 DIADLO Clc1cccc(CC[N@@H+]2CCSC[C@@H]2c2nccs2)c1 ZINC000459515175 339033632 /nfs/dbraw/zinc/03/36/32/339033632.db2.gz DGCHZFXERNCBJF-CQSZACIVSA-N 1 2 324.902 4.129 20 0 DIADLO Clc1cccc(CC[N@H+]2CCSC[C@@H]2c2nccs2)c1 ZINC000459515175 339033633 /nfs/dbraw/zinc/03/36/33/339033633.db2.gz DGCHZFXERNCBJF-CQSZACIVSA-N 1 2 324.902 4.129 20 0 DIADLO c1csc([C@H]2CSCC[N@H+]2Cc2ccc(C3CC3)cc2)n1 ZINC000459530077 339034204 /nfs/dbraw/zinc/03/42/04/339034204.db2.gz MBELAXFDTPZVIJ-MRXNPFEDSA-N 1 2 316.495 4.311 20 0 DIADLO c1csc([C@H]2CSCC[N@@H+]2Cc2ccc(C3CC3)cc2)n1 ZINC000459530077 339034205 /nfs/dbraw/zinc/03/42/05/339034205.db2.gz MBELAXFDTPZVIJ-MRXNPFEDSA-N 1 2 316.495 4.311 20 0 DIADLO CC(C)c1noc(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)n1 ZINC000459566575 339036163 /nfs/dbraw/zinc/03/61/63/339036163.db2.gz HKURUSHELUDRRE-KRWDZBQOSA-N 1 2 311.429 4.310 20 0 DIADLO CC(C)c1noc(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)n1 ZINC000459566575 339036164 /nfs/dbraw/zinc/03/61/64/339036164.db2.gz HKURUSHELUDRRE-KRWDZBQOSA-N 1 2 311.429 4.310 20 0 DIADLO COCc1cc(C[N@@H+]2CCCC[C@@H]2c2ccc(Cl)cc2)no1 ZINC000459574677 339036654 /nfs/dbraw/zinc/03/66/54/339036654.db2.gz SIWZBGCNWDZRES-QGZVFWFLSA-N 1 2 320.820 4.202 20 0 DIADLO COCc1cc(C[N@H+]2CCCC[C@@H]2c2ccc(Cl)cc2)no1 ZINC000459574677 339036655 /nfs/dbraw/zinc/03/66/55/339036655.db2.gz SIWZBGCNWDZRES-QGZVFWFLSA-N 1 2 320.820 4.202 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)o1 ZINC000459573237 339036662 /nfs/dbraw/zinc/03/66/62/339036662.db2.gz IHFQLCBSMSOWDB-KRWDZBQOSA-N 1 2 311.429 4.310 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)o1 ZINC000459573237 339036663 /nfs/dbraw/zinc/03/66/63/339036663.db2.gz IHFQLCBSMSOWDB-KRWDZBQOSA-N 1 2 311.429 4.310 20 0 DIADLO CCc1noc([C@H](C)[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)n1 ZINC000459573530 339036781 /nfs/dbraw/zinc/03/67/81/339036781.db2.gz RCHOVEAFOLOEIJ-YOEHRIQHSA-N 1 2 311.429 4.310 20 0 DIADLO CCc1noc([C@H](C)[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)n1 ZINC000459573530 339036782 /nfs/dbraw/zinc/03/67/82/339036782.db2.gz RCHOVEAFOLOEIJ-YOEHRIQHSA-N 1 2 311.429 4.310 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2Cc3sccc3CC2(C)C)s1 ZINC000459591473 339037757 /nfs/dbraw/zinc/03/77/57/339037757.db2.gz ZWNZTLJVGVHXLP-UHFFFAOYSA-N 1 2 307.488 4.060 20 0 DIADLO CC(C)c1nnc(C[N@H+]2Cc3sccc3CC2(C)C)s1 ZINC000459591473 339037758 /nfs/dbraw/zinc/03/77/58/339037758.db2.gz ZWNZTLJVGVHXLP-UHFFFAOYSA-N 1 2 307.488 4.060 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@H](C)c2nc3c(s2)CCC3)n1 ZINC000459627428 339039115 /nfs/dbraw/zinc/03/91/15/339039115.db2.gz BMIRRCJQIRLFLJ-GFCCVEGCSA-N 1 2 318.490 4.040 20 0 DIADLO CC(C)(C)c1ncc(C[NH+]2CC(C)(CC(F)(F)F)C2)s1 ZINC000459632219 339039325 /nfs/dbraw/zinc/03/93/25/339039325.db2.gz FAZWVRRKLDBLBV-UHFFFAOYSA-N 1 2 306.397 4.215 20 0 DIADLO COCCC1(C)C[NH+](Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000459633149 339039449 /nfs/dbraw/zinc/03/94/49/339039449.db2.gz KTDNJJMWAKPFEN-UHFFFAOYSA-N 1 2 321.770 4.217 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)ccc1Cl)c1nc2c(s1)CCC2 ZINC000459636588 339039546 /nfs/dbraw/zinc/03/95/46/339039546.db2.gz WBJRWSYTJCFJRF-SECBINFHSA-N 1 2 310.825 4.275 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)ccc1Cl)c1nc2c(s1)CCC2 ZINC000459636589 339039618 /nfs/dbraw/zinc/03/96/18/339039618.db2.gz WBJRWSYTJCFJRF-VIFPVBQESA-N 1 2 310.825 4.275 20 0 DIADLO CC(C)Cc1ncc(C[NH+]2CC(C)(CC(F)(F)F)C2)s1 ZINC000459642551 339039844 /nfs/dbraw/zinc/03/98/44/339039844.db2.gz SKMHFJHAVNSTBC-UHFFFAOYSA-N 1 2 306.397 4.116 20 0 DIADLO C[C@H]([NH2+][C@H](CCc1ccccc1)C(F)F)c1cncc(F)c1 ZINC000459646544 339040185 /nfs/dbraw/zinc/04/01/85/339040185.db2.gz IVLRASCBRMOLEK-BLLLJJGKSA-N 1 2 308.347 4.138 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)nn1 ZINC000459725132 339044629 /nfs/dbraw/zinc/04/46/29/339044629.db2.gz XELPNLFKJLNOMV-LJQANCHMSA-N 1 2 324.472 4.366 20 0 DIADLO CC(C)n1cc(C[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)nn1 ZINC000459725132 339044630 /nfs/dbraw/zinc/04/46/30/339044630.db2.gz XELPNLFKJLNOMV-LJQANCHMSA-N 1 2 324.472 4.366 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1nc2cc(F)ccc2o1 ZINC000459727157 339044696 /nfs/dbraw/zinc/04/46/96/339044696.db2.gz FUXYDMWWDDNBGE-LBPRGKRZSA-N 1 2 314.360 4.135 20 0 DIADLO Cc1cnc(C[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)nc1 ZINC000459735979 339045281 /nfs/dbraw/zinc/04/52/81/339045281.db2.gz GLEZCMZCZHNEQS-IBGZPJMESA-N 1 2 307.441 4.292 20 0 DIADLO Cc1cnc(C[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)nc1 ZINC000459735979 339045282 /nfs/dbraw/zinc/04/52/82/339045282.db2.gz GLEZCMZCZHNEQS-IBGZPJMESA-N 1 2 307.441 4.292 20 0 DIADLO Cc1nnc(C[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)s1 ZINC000459744066 339045749 /nfs/dbraw/zinc/04/57/49/339045749.db2.gz LVWFFGZTDFPYER-KRWDZBQOSA-N 1 2 313.470 4.354 20 0 DIADLO Cc1nnc(C[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)s1 ZINC000459744066 339045750 /nfs/dbraw/zinc/04/57/50/339045750.db2.gz LVWFFGZTDFPYER-KRWDZBQOSA-N 1 2 313.470 4.354 20 0 DIADLO CCc1ccc(-c2ccc(C[NH2+][C@H](C)c3ccn(C)n3)o2)cc1 ZINC000459757246 339046535 /nfs/dbraw/zinc/04/65/35/339046535.db2.gz PULFLMGEJQHKLK-CQSZACIVSA-N 1 2 309.413 4.093 20 0 DIADLO COc1cc(NCCCc2c[nH+]ccc2C)cc(OC)c1Cl ZINC000459758219 339046656 /nfs/dbraw/zinc/04/66/56/339046656.db2.gz OUULOXMMGXCWIZ-UHFFFAOYSA-N 1 2 320.820 4.105 20 0 DIADLO Cc1cc2[nH+]cn(Cc3cncc(C(F)(F)F)c3)c2cc1C ZINC000461070252 339058543 /nfs/dbraw/zinc/05/85/43/339058543.db2.gz UEVLNGWFYVJHOH-UHFFFAOYSA-N 1 2 305.303 4.115 20 0 DIADLO CSc1ccc(OCCn2c[nH+]c3cc(C)c(C)cc32)cc1 ZINC000462558644 339081357 /nfs/dbraw/zinc/08/13/57/339081357.db2.gz OWEOJKLMQOBTSH-UHFFFAOYSA-N 1 2 312.438 4.454 20 0 DIADLO Cc1nc(N[C@H]2CCOc3c(-c4ccccc4)cccc32)cc[nH+]1 ZINC000462794306 339089302 /nfs/dbraw/zinc/08/93/02/339089302.db2.gz WRGYIQBPPXYKJT-SFHVURJKSA-N 1 2 317.392 4.388 20 0 DIADLO FC(F)(F)[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccccc1 ZINC000462800127 339089707 /nfs/dbraw/zinc/08/97/07/339089707.db2.gz CMIUQDPHOZAYJZ-MRXNPFEDSA-N 1 2 321.346 4.397 20 0 DIADLO CCc1cc(N2C[C@@H](C)CCC[C@H]2C)nc(-c2ccncc2)[nH+]1 ZINC000462885531 339096140 /nfs/dbraw/zinc/09/61/40/339096140.db2.gz BRPYXSIWHWRXNC-LSDHHAIUSA-N 1 2 310.445 4.116 20 0 DIADLO CCc1cc(N2C[C@H](C)CCC[C@@H]2C)nc(-c2ccncc2)[nH+]1 ZINC000462885527 339096159 /nfs/dbraw/zinc/09/61/59/339096159.db2.gz BRPYXSIWHWRXNC-CABCVRRESA-N 1 2 310.445 4.116 20 0 DIADLO C[C@@H]([NH2+]Cc1ccco1)c1csc(-c2ccccc2F)n1 ZINC000462894657 339096585 /nfs/dbraw/zinc/09/65/85/339096585.db2.gz OQYFSIUROGPJOG-LLVKDONJSA-N 1 2 302.374 4.393 20 0 DIADLO CCOC[C@@H]1CCC[C@@H]1Nc1ccc(-n2c[nH+]c(C)c2C)cc1 ZINC000463028450 339101546 /nfs/dbraw/zinc/10/15/46/339101546.db2.gz ASQAZSVZLQPGDT-LPHOPBHVSA-N 1 2 313.445 4.106 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+][C@@H]2CCOc3c(F)ccc(F)c32)o1 ZINC000463028917 339101553 /nfs/dbraw/zinc/10/15/53/339101553.db2.gz MDLNNJJNBWFUAR-ITDIGPHOSA-N 1 2 319.351 4.295 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@H]3CCO[C@H](C(C)C)C3)cc2)c1C ZINC000463035386 339102230 /nfs/dbraw/zinc/10/22/30/339102230.db2.gz HIRMYIVFAFJVCI-HKUYNNGSSA-N 1 2 313.445 4.105 20 0 DIADLO CCC(CC)[C@@H](C)C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000463039505 339102502 /nfs/dbraw/zinc/10/25/02/339102502.db2.gz BTWIEGPOKXKIFJ-CABCVRRESA-N 1 2 322.518 4.026 20 0 DIADLO CCC(CC)[C@H](C)C(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000463039508 339102552 /nfs/dbraw/zinc/10/25/52/339102552.db2.gz BTWIEGPOKXKIFJ-LSDHHAIUSA-N 1 2 322.518 4.026 20 0 DIADLO CCC[C@@]1(C)CCCN(c2cc(C)[nH+]c(-c3ccncc3)n2)C1 ZINC000463070043 339104060 /nfs/dbraw/zinc/10/40/60/339104060.db2.gz QTVLKMFOFQFNIF-IBGZPJMESA-N 1 2 310.445 4.254 20 0 DIADLO C[C@H]1C[N@H+](Cc2cncc(C(F)(F)F)c2)[C@H]1c1ccccc1 ZINC000463098729 339105609 /nfs/dbraw/zinc/10/56/09/339105609.db2.gz ZRKYTHCKYKLJQN-BLLLJJGKSA-N 1 2 306.331 4.293 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cncc(C(F)(F)F)c2)[C@H]1c1ccccc1 ZINC000463098729 339105610 /nfs/dbraw/zinc/10/56/10/339105610.db2.gz ZRKYTHCKYKLJQN-BLLLJJGKSA-N 1 2 306.331 4.293 20 0 DIADLO C[C@H]1C[N@H+](Cc2cncc(C(F)(F)F)c2)[C@@H]1c1ccccc1 ZINC000463098730 339105733 /nfs/dbraw/zinc/10/57/33/339105733.db2.gz ZRKYTHCKYKLJQN-LRDDRELGSA-N 1 2 306.331 4.293 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cncc(C(F)(F)F)c2)[C@@H]1c1ccccc1 ZINC000463098730 339105734 /nfs/dbraw/zinc/10/57/34/339105734.db2.gz ZRKYTHCKYKLJQN-LRDDRELGSA-N 1 2 306.331 4.293 20 0 DIADLO FC(F)Oc1ccc[nH+]c1NCc1ccccc1C(F)(F)F ZINC000463251857 339112176 /nfs/dbraw/zinc/11/21/76/339112176.db2.gz ZHWNAORJKQUNTL-UHFFFAOYSA-N 1 2 318.245 4.314 20 0 DIADLO Fc1ccc(Cl)cc1CNc1[nH+]cccc1OC(F)F ZINC000463255828 339112412 /nfs/dbraw/zinc/11/24/12/339112412.db2.gz MJYLLTJFBGRSKG-UHFFFAOYSA-N 1 2 302.683 4.088 20 0 DIADLO CCc1ccc(-c2ccc(C(=O)Nc3c[nH+]ccc3OC)o2)cc1 ZINC000463624843 339122848 /nfs/dbraw/zinc/12/28/48/339122848.db2.gz PWMBQLGAUQBSTR-UHFFFAOYSA-N 1 2 322.364 4.165 20 0 DIADLO CC(C)[C@H](C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000463627457 339122893 /nfs/dbraw/zinc/12/28/93/339122893.db2.gz CUXYDKUOWSQBDO-SFHVURJKSA-N 1 2 319.408 4.455 20 0 DIADLO CC(C)[C@@H](C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000463627456 339122898 /nfs/dbraw/zinc/12/28/98/339122898.db2.gz CUXYDKUOWSQBDO-GOSISDBHSA-N 1 2 319.408 4.455 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H]2CCCCC23CCCC3)c(C)[nH+]1 ZINC000463736279 339125127 /nfs/dbraw/zinc/12/51/27/339125127.db2.gz ASRIOMJPZMWTES-MRXNPFEDSA-N 1 2 301.434 4.323 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)c1cscc1-c1ccccc1 ZINC000463962912 339130347 /nfs/dbraw/zinc/13/03/47/339130347.db2.gz GWORMCWAWNUFAF-UHFFFAOYSA-N 1 2 319.389 4.315 20 0 DIADLO CCC1(CC)C[N@H+](Cc2noc(C3CCCCC3)n2)CCS1 ZINC000464576539 339145847 /nfs/dbraw/zinc/14/58/47/339145847.db2.gz FPIHLJPBMHGYQK-UHFFFAOYSA-N 1 2 323.506 4.225 20 0 DIADLO CCC1(CC)C[N@@H+](Cc2noc(C3CCCCC3)n2)CCS1 ZINC000464576539 339145848 /nfs/dbraw/zinc/14/58/48/339145848.db2.gz FPIHLJPBMHGYQK-UHFFFAOYSA-N 1 2 323.506 4.225 20 0 DIADLO CCCCc1noc(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccc(C)o2)n1 ZINC000464834824 339156175 /nfs/dbraw/zinc/15/61/75/339156175.db2.gz HHXWEEBAWIUZLR-UKRRQHHQSA-N 1 2 317.433 4.287 20 0 DIADLO CCCCc1noc(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccc(C)o2)n1 ZINC000464834824 339156174 /nfs/dbraw/zinc/15/61/74/339156174.db2.gz HHXWEEBAWIUZLR-UKRRQHHQSA-N 1 2 317.433 4.287 20 0 DIADLO CCCc1noc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccc(CC)o2)n1 ZINC000464837305 339156438 /nfs/dbraw/zinc/15/64/38/339156438.db2.gz MHOHHWALUJSRGG-HIFRSBDPSA-N 1 2 317.433 4.151 20 0 DIADLO CCCc1noc(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccc(CC)o2)n1 ZINC000464837305 339156439 /nfs/dbraw/zinc/15/64/39/339156439.db2.gz MHOHHWALUJSRGG-HIFRSBDPSA-N 1 2 317.433 4.151 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2noc(-c3ccccc3)n2)[C@H](c2ccco2)C1 ZINC000464850424 339157749 /nfs/dbraw/zinc/15/77/49/339157749.db2.gz KCSPZICDXZUJTQ-ZBFHGGJFSA-N 1 2 323.396 4.303 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2noc(-c3ccccc3)n2)[C@H](c2ccco2)C1 ZINC000464850424 339157750 /nfs/dbraw/zinc/15/77/50/339157750.db2.gz KCSPZICDXZUJTQ-ZBFHGGJFSA-N 1 2 323.396 4.303 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nc(-c3ccccc3)no2)[C@@H](c2ccco2)C1 ZINC000464854256 339158187 /nfs/dbraw/zinc/15/81/87/339158187.db2.gz OENDRKBKKUYXAM-GOEBONIOSA-N 1 2 323.396 4.303 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nc(-c3ccccc3)no2)[C@@H](c2ccco2)C1 ZINC000464854256 339158188 /nfs/dbraw/zinc/15/81/88/339158188.db2.gz OENDRKBKKUYXAM-GOEBONIOSA-N 1 2 323.396 4.303 20 0 DIADLO CC(C)CCc1noc(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)n1 ZINC000464863100 339158824 /nfs/dbraw/zinc/15/88/24/339158824.db2.gz ZOPWAMDQUKIWKO-HUUCEWRRSA-N 1 2 317.433 4.224 20 0 DIADLO CC(C)CCc1noc(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)n1 ZINC000464863100 339158825 /nfs/dbraw/zinc/15/88/25/339158825.db2.gz ZOPWAMDQUKIWKO-HUUCEWRRSA-N 1 2 317.433 4.224 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1nc2cc(F)ccc2o1)C(C)C ZINC000464874078 339159615 /nfs/dbraw/zinc/15/96/15/339159615.db2.gz BBRRKMDFJKRMGD-QGZVFWFLSA-N 1 2 313.376 4.157 20 0 DIADLO CC[C@@H]1CCC[C@@H]1NC(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000465071403 339167561 /nfs/dbraw/zinc/16/75/61/339167561.db2.gz NNSOCZBOOJCDES-QAPCUYQASA-N 1 2 324.424 4.491 20 0 DIADLO FC(F)(F)C1CCC(C[NH2+]c2ccc(-n3ccnn3)cc2)CC1 ZINC000466376427 339201433 /nfs/dbraw/zinc/20/14/33/339201433.db2.gz IEWOOIJOGFIUNW-UHFFFAOYSA-N 1 2 324.350 4.048 20 0 DIADLO CC[C@]1(C)C[C@@H]1C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000466444599 339205309 /nfs/dbraw/zinc/20/53/09/339205309.db2.gz AXXDWEPWLYIBSF-YLJYHZDGSA-N 1 2 323.440 4.261 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1cc(Cl)ccc1Cl)CO2 ZINC000466475021 339206619 /nfs/dbraw/zinc/20/66/19/339206619.db2.gz RTRNLTONZKDGEJ-AWEZNQCLSA-N 1 2 312.171 4.356 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1c(Cl)oc3ccccc31)CO2 ZINC000466476042 339206665 /nfs/dbraw/zinc/20/66/65/339206665.db2.gz XWFLLHLKDPPDEX-AWEZNQCLSA-N 1 2 317.747 4.449 20 0 DIADLO Cc1[nH+]c2ccccn2c1CNc1ccc(-c2ccccc2)cn1 ZINC000466618172 339210605 /nfs/dbraw/zinc/21/06/05/339210605.db2.gz LAHAAUOWKWMGEM-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1ccn(-c2ccc(Cl)cc2)n1 ZINC000466839790 339218854 /nfs/dbraw/zinc/21/88/54/339218854.db2.gz CYQSSOXVPMMACC-ZDUSSCGKSA-N 1 2 315.804 4.312 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccn(-c2ccc(Cl)cc2)n1 ZINC000466839790 339218855 /nfs/dbraw/zinc/21/88/55/339218855.db2.gz CYQSSOXVPMMACC-ZDUSSCGKSA-N 1 2 315.804 4.312 20 0 DIADLO O=C(Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000467288521 339230021 /nfs/dbraw/zinc/23/00/21/339230021.db2.gz OPQGMJTUFOFHMU-HALDLXJZSA-N 1 2 309.413 4.205 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@@H](Nc2cn(C)nc2C(C)C)C1 ZINC000467365399 339234268 /nfs/dbraw/zinc/23/42/68/339234268.db2.gz PRMGSJOMMGCKBN-JKSUJKDBSA-N 1 2 312.461 4.385 20 0 DIADLO Fc1cccc2c3c([nH]c21)C[N@@H+](C/C=C\c1ccncc1)CCC3 ZINC000467549032 339241893 /nfs/dbraw/zinc/24/18/93/339241893.db2.gz UWNZOHZEOVLHLG-RQOWECAXSA-N 1 2 321.399 4.164 20 0 DIADLO Fc1cccc2c3c([nH]c21)C[N@H+](C/C=C\c1ccncc1)CCC3 ZINC000467549032 339241894 /nfs/dbraw/zinc/24/18/94/339241894.db2.gz UWNZOHZEOVLHLG-RQOWECAXSA-N 1 2 321.399 4.164 20 0 DIADLO FC1(c2cccc(Cl)c2)CC[NH+](Cc2cscn2)CC1 ZINC000467551153 339242182 /nfs/dbraw/zinc/24/21/82/339242182.db2.gz AFZNFCYPCKLTPJ-UHFFFAOYSA-N 1 2 310.825 4.257 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@@H](C(F)(F)F)C3)sc2c1 ZINC000467557963 339242532 /nfs/dbraw/zinc/24/25/32/339242532.db2.gz PQEPUHNDJGLZRO-SECBINFHSA-N 1 2 318.339 4.210 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@@H](C(F)(F)F)C3)sc2c1 ZINC000467557963 339242533 /nfs/dbraw/zinc/24/25/33/339242533.db2.gz PQEPUHNDJGLZRO-SECBINFHSA-N 1 2 318.339 4.210 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2cc(Cl)c(OC)cc2Cl)CCCO1 ZINC000467556973 339242539 /nfs/dbraw/zinc/24/25/39/339242539.db2.gz HIPAVQHYWVSCPV-GFCCVEGCSA-N 1 2 318.244 4.003 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2cc(Cl)c(OC)cc2Cl)CCCO1 ZINC000467556973 339242540 /nfs/dbraw/zinc/24/25/40/339242540.db2.gz HIPAVQHYWVSCPV-GFCCVEGCSA-N 1 2 318.244 4.003 20 0 DIADLO Cc1ccc(CSCc2[nH+]ccn2CC(F)(F)F)cc1C ZINC000468649976 339267991 /nfs/dbraw/zinc/26/79/91/339267991.db2.gz XAYIEDJEFKITIX-UHFFFAOYSA-N 1 2 314.376 4.496 20 0 DIADLO Cc1ccsc1C[N@@H+]1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000468692362 339268818 /nfs/dbraw/zinc/26/88/18/339268818.db2.gz CQXCJCSMMXXZLG-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccsc1C[N@H+]1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000468692362 339268819 /nfs/dbraw/zinc/26/88/19/339268819.db2.gz CQXCJCSMMXXZLG-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO CCC(CC)CC(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC000468777002 339270576 /nfs/dbraw/zinc/27/05/76/339270576.db2.gz BMEJLWWVCULPRT-ZDUSSCGKSA-N 1 2 323.506 4.140 20 0 DIADLO CCC(CC)CC(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC000468777002 339270577 /nfs/dbraw/zinc/27/05/77/339270577.db2.gz BMEJLWWVCULPRT-ZDUSSCGKSA-N 1 2 323.506 4.140 20 0 DIADLO Fc1ccc(SCC[N@@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000469200562 339282921 /nfs/dbraw/zinc/28/29/21/339282921.db2.gz BMJWLPSPCBWSIW-MRXNPFEDSA-N 1 2 323.458 4.053 20 0 DIADLO Fc1ccc(SCC[N@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000469200562 339282922 /nfs/dbraw/zinc/28/29/22/339282922.db2.gz BMJWLPSPCBWSIW-MRXNPFEDSA-N 1 2 323.458 4.053 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1csc(Cl)c1 ZINC000469234859 339283808 /nfs/dbraw/zinc/28/38/08/339283808.db2.gz YIUSMUHGJMXEAE-LBPRGKRZSA-N 1 2 317.845 4.438 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CC[C@H](c3c(F)cccc3F)C2)o1 ZINC000469465302 339290533 /nfs/dbraw/zinc/29/05/33/339290533.db2.gz SWEWTYKFOLVVCP-LBPRGKRZSA-N 1 2 320.383 4.240 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)o1 ZINC000469465302 339290534 /nfs/dbraw/zinc/29/05/34/339290534.db2.gz SWEWTYKFOLVVCP-LBPRGKRZSA-N 1 2 320.383 4.240 20 0 DIADLO Cn1ccc(C[N@@H+]2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)n1 ZINC000469529717 339292626 /nfs/dbraw/zinc/29/26/26/339292626.db2.gz UJMZZNJBQJLARK-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1ccc(C[N@H+]2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)n1 ZINC000469529717 339292627 /nfs/dbraw/zinc/29/26/27/339292627.db2.gz UJMZZNJBQJLARK-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470213305 339314396 /nfs/dbraw/zinc/31/43/96/339314396.db2.gz GLOSVKMHDGJQKE-IIYDPXPESA-N 1 2 305.418 4.410 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470213305 339314397 /nfs/dbraw/zinc/31/43/97/339314397.db2.gz GLOSVKMHDGJQKE-IIYDPXPESA-N 1 2 305.418 4.410 20 0 DIADLO FC(F)c1cccc(C[N@@H+]2CCOC[C@@H]2c2ccccc2)c1 ZINC000470759113 339326925 /nfs/dbraw/zinc/32/69/25/339326925.db2.gz BQLRZZNHFGRIIE-QGZVFWFLSA-N 1 2 303.352 4.198 20 0 DIADLO FC(F)c1cccc(C[N@H+]2CCOC[C@@H]2c2ccccc2)c1 ZINC000470759113 339326926 /nfs/dbraw/zinc/32/69/26/339326926.db2.gz BQLRZZNHFGRIIE-QGZVFWFLSA-N 1 2 303.352 4.198 20 0 DIADLO Fc1ccccc1[C@H]1C[N@H+](Cc2cccc(C(F)F)c2)CCO1 ZINC000470771005 339327444 /nfs/dbraw/zinc/32/74/44/339327444.db2.gz DIWGJPGFTYHKHO-QGZVFWFLSA-N 1 2 321.342 4.337 20 0 DIADLO Fc1ccccc1[C@H]1C[N@@H+](Cc2cccc(C(F)F)c2)CCO1 ZINC000470771005 339327445 /nfs/dbraw/zinc/32/74/45/339327445.db2.gz DIWGJPGFTYHKHO-QGZVFWFLSA-N 1 2 321.342 4.337 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cccc(C(F)F)c1)C(=O)OC(C)(C)C ZINC000470781724 339327919 /nfs/dbraw/zinc/32/79/19/339327919.db2.gz ZJMSTTLATWMAEZ-CQSZACIVSA-N 1 2 313.388 4.080 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000470944819 339331965 /nfs/dbraw/zinc/33/19/65/339331965.db2.gz LKNJGUCXMNWZAP-GXSJLCMTSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000470944819 339331966 /nfs/dbraw/zinc/33/19/66/339331966.db2.gz LKNJGUCXMNWZAP-GXSJLCMTSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(-c2cccs2)on1 ZINC000470947067 339332086 /nfs/dbraw/zinc/33/20/86/339332086.db2.gz MWCVQDPHSODBKN-GXSJLCMTSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(-c2cccs2)on1 ZINC000470947067 339332087 /nfs/dbraw/zinc/33/20/87/339332087.db2.gz MWCVQDPHSODBKN-GXSJLCMTSA-N 1 2 316.348 4.176 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)cs1 ZINC000470946897 339332243 /nfs/dbraw/zinc/33/22/43/339332243.db2.gz GZAXCCUHWFLGLT-JQWIXIFHSA-N 1 2 306.397 4.258 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)cs1 ZINC000470946897 339332244 /nfs/dbraw/zinc/33/22/44/339332244.db2.gz GZAXCCUHWFLGLT-JQWIXIFHSA-N 1 2 306.397 4.258 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+](C)Cc2ccccc2SC)n1 ZINC000471016894 339334554 /nfs/dbraw/zinc/33/45/54/339334554.db2.gz FJMHEXYLWBUJPG-ZDUSSCGKSA-N 1 2 319.474 4.327 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+](C)Cc2ccccc2SC)n1 ZINC000471016894 339334555 /nfs/dbraw/zinc/33/45/55/339334555.db2.gz FJMHEXYLWBUJPG-ZDUSSCGKSA-N 1 2 319.474 4.327 20 0 DIADLO Brc1csc(C[N@@H+]2CC[C@H]2c2ccccc2)c1 ZINC000471174521 339339466 /nfs/dbraw/zinc/33/94/66/339339466.db2.gz YJSBTLOGWBTWJQ-AWEZNQCLSA-N 1 2 308.244 4.458 20 0 DIADLO Brc1csc(C[N@H+]2CC[C@H]2c2ccccc2)c1 ZINC000471174521 339339467 /nfs/dbraw/zinc/33/94/67/339339467.db2.gz YJSBTLOGWBTWJQ-AWEZNQCLSA-N 1 2 308.244 4.458 20 0 DIADLO Brc1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)s1 ZINC000471173726 339339574 /nfs/dbraw/zinc/33/95/74/339339574.db2.gz RFQAKKPMDUXJQD-CYBMUJFWSA-N 1 2 308.244 4.458 20 0 DIADLO Brc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)s1 ZINC000471173726 339339575 /nfs/dbraw/zinc/33/95/75/339339575.db2.gz RFQAKKPMDUXJQD-CYBMUJFWSA-N 1 2 308.244 4.458 20 0 DIADLO COc1ccc(-c2nc(C[N@@H+]3CC[C@H]3c3ccccc3)co2)cc1 ZINC000471172821 339339596 /nfs/dbraw/zinc/33/95/96/339339596.db2.gz JTKLMFDTRUFCJE-IBGZPJMESA-N 1 2 320.392 4.297 20 0 DIADLO COc1ccc(-c2nc(C[N@H+]3CC[C@H]3c3ccccc3)co2)cc1 ZINC000471172821 339339597 /nfs/dbraw/zinc/33/95/97/339339597.db2.gz JTKLMFDTRUFCJE-IBGZPJMESA-N 1 2 320.392 4.297 20 0 DIADLO CN(Cc1ccccc1Cl)c1cc(C(F)(F)F)cc[nH+]1 ZINC000471254562 339341166 /nfs/dbraw/zinc/34/11/66/339341166.db2.gz LSLXWJVDASJBFG-UHFFFAOYSA-N 1 2 300.711 4.390 20 0 DIADLO CC[C@H](Nc1[nH+]c(C)nc2[nH]ccc21)c1ccc(Cl)cc1 ZINC000471251921 339341203 /nfs/dbraw/zinc/34/12/03/339341203.db2.gz QUNKPLOFFBVEKD-AWEZNQCLSA-N 1 2 300.793 4.483 20 0 DIADLO CCN(Cc1c[nH+]c2ccc(C)cn12)c1ccc2[nH]ccc2c1 ZINC000471810006 339354962 /nfs/dbraw/zinc/35/49/62/339354962.db2.gz NLMHGDYKATZABH-UHFFFAOYSA-N 1 2 304.397 4.151 20 0 DIADLO Cc1ccc(C[NH2+]Cc2ncc(Cl)s2)c(OC(C)C)c1 ZINC000472042460 339360263 /nfs/dbraw/zinc/36/02/63/339360263.db2.gz DQYWTQAECPSOMF-UHFFFAOYSA-N 1 2 310.850 4.182 20 0 DIADLO Cc1ccccc1-c1nc(C[N@@H+]2CCc3ccccc3[C@H]2C)no1 ZINC000472567614 339374025 /nfs/dbraw/zinc/37/40/25/339374025.db2.gz CVGSAUHXTQQUNE-OAHLLOKOSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1ccccc1-c1nc(C[N@H+]2CCc3ccccc3[C@H]2C)no1 ZINC000472567614 339374026 /nfs/dbraw/zinc/37/40/26/339374026.db2.gz CVGSAUHXTQQUNE-OAHLLOKOSA-N 1 2 319.408 4.164 20 0 DIADLO C[C@@H](c1cn(-c2ccccc2)nn1)[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000472590464 339374628 /nfs/dbraw/zinc/37/46/28/339374628.db2.gz GASCWHGORWHJOM-GUXCAODWSA-N 1 2 318.424 4.021 20 0 DIADLO C[C@@H](c1cn(-c2ccccc2)nn1)[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000472590464 339374629 /nfs/dbraw/zinc/37/46/29/339374629.db2.gz GASCWHGORWHJOM-GUXCAODWSA-N 1 2 318.424 4.021 20 0 DIADLO CC[N@H+](Cc1ncc(Cl)s1)Cc1ccc(Cl)cc1 ZINC000473143675 339382585 /nfs/dbraw/zinc/38/25/85/339382585.db2.gz MORNRCDXNIJQJW-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC[N@@H+](Cc1ncc(Cl)s1)Cc1ccc(Cl)cc1 ZINC000473143675 339382586 /nfs/dbraw/zinc/38/25/86/339382586.db2.gz MORNRCDXNIJQJW-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ncc(Cl)s2)CC2CC2)cc1 ZINC000473144868 339382723 /nfs/dbraw/zinc/38/27/23/339382723.db2.gz IDABNMIWRDNRKA-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ncc(Cl)s2)CC2CC2)cc1 ZINC000473144868 339382724 /nfs/dbraw/zinc/38/27/24/339382724.db2.gz IDABNMIWRDNRKA-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ncc(Cl)s2)CC[C@@H]1c1ccccc1 ZINC000473149108 339383247 /nfs/dbraw/zinc/38/32/47/339383247.db2.gz SLYLPVAPPJMQDI-OCCSQVGLSA-N 1 2 306.862 4.422 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ncc(Cl)s2)CC[C@@H]1c1ccccc1 ZINC000473149108 339383248 /nfs/dbraw/zinc/38/32/48/339383248.db2.gz SLYLPVAPPJMQDI-OCCSQVGLSA-N 1 2 306.862 4.422 20 0 DIADLO CCc1[nH+]c(C)ccc1OCc1ncc(-c2cccc(F)c2)o1 ZINC000473664177 339389867 /nfs/dbraw/zinc/38/98/67/339389867.db2.gz FYLJAITYWWAHSI-UHFFFAOYSA-N 1 2 312.344 4.326 20 0 DIADLO CCC[C@H](CC1CCCCC1)C(=O)NC[C@H](C)Cn1cc[nH+]c1 ZINC000473871928 339393881 /nfs/dbraw/zinc/39/38/81/339393881.db2.gz CIQZUFIFDSRGTA-FUHWJXTLSA-N 1 2 319.493 4.022 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1cc(F)ccc1F ZINC000473991487 339396438 /nfs/dbraw/zinc/39/64/38/339396438.db2.gz RHFSZZZHHGUCRS-UHFFFAOYSA-N 1 2 303.308 4.009 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)c[nH+]1)C1CCC(F)(F)CC1 ZINC000474037149 339398226 /nfs/dbraw/zinc/39/82/26/339398226.db2.gz AXVQLWUBVKEBHD-ZDUSSCGKSA-N 1 2 309.404 4.308 20 0 DIADLO CCCC(=O)Nc1cccc(NCCCc2ccc(C)[nH+]c2)c1 ZINC000474378683 339411631 /nfs/dbraw/zinc/41/16/31/339411631.db2.gz SALGFBBUHIDFEC-UHFFFAOYSA-N 1 2 311.429 4.173 20 0 DIADLO COc1ccc([C@@H](C)[C@H](C)Nc2ccc[nH+]c2C)cc1OC ZINC000474885577 339429924 /nfs/dbraw/zinc/42/99/24/339429924.db2.gz FSJATGUIONMGMA-STQMWFEESA-N 1 2 300.402 4.011 20 0 DIADLO C[C@H](CC(C)(C)C)C(=O)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000476886900 339482687 /nfs/dbraw/zinc/48/26/87/339482687.db2.gz OLRRNTAIHJZBLV-CYBMUJFWSA-N 1 2 317.408 4.154 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cc(C)c(F)c(C)c1 ZINC000477977643 339506648 /nfs/dbraw/zinc/50/66/48/339506648.db2.gz UWECAGLDEVGRSV-UHFFFAOYSA-N 1 2 323.371 4.393 20 0 DIADLO COc1ccc(OCc2ccc(C)[nH+]c2C)c(Br)c1 ZINC000478863295 339523711 /nfs/dbraw/zinc/52/37/11/339523711.db2.gz ZQPTUSDUWZLGKP-UHFFFAOYSA-N 1 2 322.202 4.049 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@@H](C)c2cncs2)c2ccccn2)cc1 ZINC000479508272 339538529 /nfs/dbraw/zinc/53/85/29/339538529.db2.gz YWIBGHLBBMIJPY-KBXCAEBGSA-N 1 2 309.438 4.287 20 0 DIADLO CCCc1cccc(C[NH2+]C2(c3noc(C)n3)CCCCC2)c1 ZINC000479570102 339541609 /nfs/dbraw/zinc/54/16/09/339541609.db2.gz OGCRTHBOLGEAOJ-UHFFFAOYSA-N 1 2 313.445 4.280 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccc(Cl)cn1 ZINC000480194504 339562939 /nfs/dbraw/zinc/56/29/39/339562939.db2.gz HXAZSFMMGYWNAH-XPTSAGLGSA-N 1 2 309.196 4.173 20 0 DIADLO Cc1cc(N2CCC[C@@H](C(F)(F)F)[C@H]2C)nc(C(C)C)[nH+]1 ZINC000480291208 339567454 /nfs/dbraw/zinc/56/74/54/339567454.db2.gz LQEHTGLGVBXBDT-VXGBXAGGSA-N 1 2 301.356 4.076 20 0 DIADLO COc1cc(Cl)c(Cl)cc1NCc1cccc2[nH+]ccn21 ZINC000480490952 339574799 /nfs/dbraw/zinc/57/47/99/339574799.db2.gz IFLWJFKPJPLBOG-UHFFFAOYSA-N 1 2 322.195 4.262 20 0 DIADLO Cc1cc(N2CCC[C@@H]2CC(C)(C)C)nc(-c2ccncc2)[nH+]1 ZINC000480508088 339575257 /nfs/dbraw/zinc/57/52/57/339575257.db2.gz DNPJYXGSUSBZRU-MRXNPFEDSA-N 1 2 310.445 4.252 20 0 DIADLO Cc1cc(N2CC[C@@H](C(F)(F)F)[C@@H]2C)c2cccc(F)c2[nH+]1 ZINC000480561378 339577780 /nfs/dbraw/zinc/57/77/80/339577780.db2.gz YLFCCIGBSKHDGP-CMPLNLGQSA-N 1 2 312.310 4.459 20 0 DIADLO CC(C)=CCCNC(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000480999775 339592558 /nfs/dbraw/zinc/59/25/58/339592558.db2.gz BQZCWOIOXBCNNP-UHFFFAOYSA-N 1 2 310.397 4.268 20 0 DIADLO CC[C@@H](Nc1cc(C)[nH+]c2c(F)cccc12)C1CCOCC1 ZINC000482009469 339619630 /nfs/dbraw/zinc/61/96/30/339619630.db2.gz VCHKCDMWSFDLNM-MRXNPFEDSA-N 1 2 302.393 4.299 20 0 DIADLO CCc1ccc(-c2noc([C@@H](C)[NH2+]Cc3ccc(C)cc3)n2)cc1 ZINC000483655897 339670958 /nfs/dbraw/zinc/67/09/58/339670958.db2.gz QPQHGMGVOSMAKY-OAHLLOKOSA-N 1 2 321.424 4.458 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)cn1)c1cc(Cl)sc1Cl ZINC000484825327 339693946 /nfs/dbraw/zinc/69/39/46/339693946.db2.gz VFTFYQXDDLMCJT-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO Cc1ccccc1C[C@@H]1CCCN1C(=O)Nc1c(C)cc[nH+]c1C ZINC000485451919 339703482 /nfs/dbraw/zinc/70/34/82/339703482.db2.gz NKALJVFPANCZJZ-SFHVURJKSA-N 1 2 323.440 4.246 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NC(C)(C)c1cccc(Cl)c1 ZINC000485553099 339705569 /nfs/dbraw/zinc/70/55/69/339705569.db2.gz RXTFREUZHLXNEO-UHFFFAOYSA-N 1 2 317.820 4.409 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CCC[C@H](C(C)C)CC1 ZINC000485628688 339707622 /nfs/dbraw/zinc/70/76/22/339707622.db2.gz HJANYQYAQYSNPS-HOTGVXAUSA-N 1 2 303.450 4.425 20 0 DIADLO Cc1cc(OCC(=O)Nc2ccc(C)c(F)c2)c2ccccc2[nH+]1 ZINC000486225582 339723612 /nfs/dbraw/zinc/72/36/12/339723612.db2.gz CWFQSUJFWPHWPE-UHFFFAOYSA-N 1 2 324.355 4.008 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)N(c3cc[nH+]c4ccncc43)C2)cc1 ZINC000486475458 339728004 /nfs/dbraw/zinc/72/80/04/339728004.db2.gz BZSWNXYFJDRFKU-NVXWUHKLSA-N 1 2 303.409 4.321 20 0 DIADLO Cc1cc(N[C@H](C)c2ccccc2Cl)nc(-c2ccncc2)[nH+]1 ZINC000486798973 339734788 /nfs/dbraw/zinc/73/47/88/339734788.db2.gz LIFQUCWLFXQJRU-CYBMUJFWSA-N 1 2 324.815 4.095 20 0 DIADLO Cc1cccn2c(CNc3ccc(C)c(OC(C)C)c3)c[nH+]c12 ZINC000487190166 339745777 /nfs/dbraw/zinc/74/57/77/339745777.db2.gz QRBWMGVEQDTBFH-UHFFFAOYSA-N 1 2 309.413 4.350 20 0 DIADLO Cc1cccn2cc(CNc3ccc(C(=O)C(C)(C)C)cc3)[nH+]c12 ZINC000487358300 339752058 /nfs/dbraw/zinc/75/20/58/339752058.db2.gz CNPUTIDDSODJSK-UHFFFAOYSA-N 1 2 321.424 4.484 20 0 DIADLO C[C@@H](CF)[NH2+][C@H](C(=O)c1c[nH]c2ccccc12)c1ccccc1 ZINC000487855050 339764216 /nfs/dbraw/zinc/76/42/16/339764216.db2.gz LDCABVJZVDUZKR-UGSOOPFHSA-N 1 2 310.372 4.040 20 0 DIADLO CN(C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)[C@@H]1CC1(C)C ZINC000488002225 339767981 /nfs/dbraw/zinc/76/79/81/339767981.db2.gz NCWPOTDJAUYRAW-MRXNPFEDSA-N 1 2 311.385 4.136 20 0 DIADLO c1cn(CCOc2ccccc2NC2CCC3(CC3)CC2)c[nH+]1 ZINC000488339916 339777716 /nfs/dbraw/zinc/77/77/16/339777716.db2.gz OXFJZRKYBGWJGR-UHFFFAOYSA-N 1 2 311.429 4.097 20 0 DIADLO CC(C)(C)[C@H]1C[C@@H](Nc2ccc(N3CCCC3)[nH+]c2)CS1 ZINC000488427620 339781504 /nfs/dbraw/zinc/78/15/04/339781504.db2.gz ALHAXTPYLFMQKP-HUUCEWRRSA-N 1 2 305.491 4.014 20 0 DIADLO Cc1ccc(C[C@H](C)C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000488464458 339784063 /nfs/dbraw/zinc/78/40/63/339784063.db2.gz WGYPAKRIPNRNOR-HNNXBMFYSA-N 1 2 319.408 4.202 20 0 DIADLO CCOC1(C)CCN(c2cc(C)[nH+]c3c(F)cccc23)CC1 ZINC000488468823 339784439 /nfs/dbraw/zinc/78/44/39/339784439.db2.gz SNYUWYYPQKIVGV-UHFFFAOYSA-N 1 2 302.393 4.078 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@H](CC)c2ccc(F)cn2)on1 ZINC000493245436 339920929 /nfs/dbraw/zinc/92/09/29/339920929.db2.gz BTIADJSZRLURCH-OAHLLOKOSA-N 1 2 305.397 4.353 20 0 DIADLO CCCc1csc(C[NH2+][C@@H](c2ncc(C)s2)C2CC2)n1 ZINC000494099154 339941016 /nfs/dbraw/zinc/94/10/16/339941016.db2.gz QLMHWPGMQRVTIS-CQSZACIVSA-N 1 2 307.488 4.101 20 0 DIADLO CCCc1csc(CNc2c[nH+]ccc2OC(C)(C)C)n1 ZINC000494181069 339942912 /nfs/dbraw/zinc/94/29/12/339942912.db2.gz ZDJLRXNRXISWIW-UHFFFAOYSA-N 1 2 305.447 4.280 20 0 DIADLO CCCC(C)(C)CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000495093657 339973785 /nfs/dbraw/zinc/97/37/85/339973785.db2.gz MCFHNEHBYWKFME-UHFFFAOYSA-N 1 2 303.381 4.166 20 0 DIADLO FC(F)[C@H](CCc1ccccc1)[NH2+]Cc1ccc2c(c1)COC2 ZINC000498804609 340023578 /nfs/dbraw/zinc/02/35/78/340023578.db2.gz BFWIULQNQVITMA-SFHVURJKSA-N 1 2 317.379 4.073 20 0 DIADLO c1ccc(Oc2ccc(C[N@@H+]3CC[C@H]3c3ccccc3)nn2)cc1 ZINC000499053657 340028711 /nfs/dbraw/zinc/02/87/11/340028711.db2.gz GKRPKAWPEGGNCP-IBGZPJMESA-N 1 2 317.392 4.216 20 0 DIADLO c1ccc(Oc2ccc(C[N@H+]3CC[C@H]3c3ccccc3)nn2)cc1 ZINC000499053657 340028712 /nfs/dbraw/zinc/02/87/12/340028712.db2.gz GKRPKAWPEGGNCP-IBGZPJMESA-N 1 2 317.392 4.216 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC000499566219 340039601 /nfs/dbraw/zinc/03/96/01/340039601.db2.gz VNCYYHGBEIPTRK-GOSISDBHSA-N 1 2 319.399 4.469 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC000499566219 340039602 /nfs/dbraw/zinc/03/96/02/340039602.db2.gz VNCYYHGBEIPTRK-GOSISDBHSA-N 1 2 319.399 4.469 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000499601375 340040379 /nfs/dbraw/zinc/04/03/79/340040379.db2.gz XBMCBHIKLYEJDX-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000499601375 340040380 /nfs/dbraw/zinc/04/03/80/340040380.db2.gz XBMCBHIKLYEJDX-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO CSc1ccc([C@H](C)[NH2+]Cc2nc(CCC(C)C)no2)cc1 ZINC000500230739 340053678 /nfs/dbraw/zinc/05/36/78/340053678.db2.gz LOPKAIQYJRTXEV-ZDUSSCGKSA-N 1 2 319.474 4.231 20 0 DIADLO C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C1(C(F)F)CC1 ZINC000500513092 340061311 /nfs/dbraw/zinc/06/13/11/340061311.db2.gz LVGFEDWYSDLCLK-NTMALXAHSA-N 1 2 305.290 4.496 20 0 DIADLO Cc1ccc(Nc2nc(C[N@@H+]3CC[C@](C)(F)C3)cs2)cc1 ZINC000501389187 340079836 /nfs/dbraw/zinc/07/98/36/340079836.db2.gz BHEFVGMCXARUOM-INIZCTEOSA-N 1 2 305.422 4.129 20 0 DIADLO Cc1ccc(Nc2nc(C[N@H+]3CC[C@](C)(F)C3)cs2)cc1 ZINC000501389187 340079837 /nfs/dbraw/zinc/07/98/37/340079837.db2.gz BHEFVGMCXARUOM-INIZCTEOSA-N 1 2 305.422 4.129 20 0 DIADLO CC(C)c1nc([C@@H]2CCCCC[N@@H+]2Cc2cccs2)no1 ZINC000501711768 340087059 /nfs/dbraw/zinc/08/70/59/340087059.db2.gz FGCGPEPBBYBWJL-AWEZNQCLSA-N 1 2 305.447 4.372 20 0 DIADLO CC(C)c1nc([C@@H]2CCCCC[N@H+]2Cc2cccs2)no1 ZINC000501711768 340087060 /nfs/dbraw/zinc/08/70/60/340087060.db2.gz FGCGPEPBBYBWJL-AWEZNQCLSA-N 1 2 305.447 4.372 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1nc2c(s1)CCC2 ZINC000502010816 340092906 /nfs/dbraw/zinc/09/29/06/340092906.db2.gz ACYAXVQPTNDQHI-VHSXEESVSA-N 1 2 308.397 4.322 20 0 DIADLO CCCOc1cccc2c(N3CCC(C)(OC)CC3)cc[nH+]c12 ZINC000502021587 340093241 /nfs/dbraw/zinc/09/32/41/340093241.db2.gz YOTXGXFDORILMF-UHFFFAOYSA-N 1 2 314.429 4.029 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(Cl)c1F)c1nc2c(s1)CCC2 ZINC000502049278 340094080 /nfs/dbraw/zinc/09/40/80/340094080.db2.gz ZUCSZCPVXHTPOJ-VIFPVBQESA-N 1 2 310.825 4.275 20 0 DIADLO CC(C)c1noc([C@H](C)[NH2+][C@H](c2ccc(F)cc2)C(C)C)n1 ZINC000502488740 340105964 /nfs/dbraw/zinc/10/59/64/340105964.db2.gz SCGIFEXSXIVHHT-WFASDCNBSA-N 1 2 305.397 4.380 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000502573647 340108164 /nfs/dbraw/zinc/10/81/64/340108164.db2.gz UHRKDHCHAASKTF-KDOFPFPSSA-N 1 2 301.817 4.475 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000502573647 340108165 /nfs/dbraw/zinc/10/81/65/340108165.db2.gz UHRKDHCHAASKTF-KDOFPFPSSA-N 1 2 301.817 4.475 20 0 DIADLO CCCCc1noc(C[NH2+][C@]2(c3cccc(C)c3)C[C@@H]2CC)n1 ZINC000502592364 340108647 /nfs/dbraw/zinc/10/86/47/340108647.db2.gz PLYPBSOBACVDSW-HNAYVOBHSA-N 1 2 313.445 4.136 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+]2CC[C@@](F)(c3cc(C)cc(F)c3)C2)o1 ZINC000502887494 340115605 /nfs/dbraw/zinc/11/56/05/340115605.db2.gz MAYHBYZFFGBCNC-DYVFJYSZSA-N 1 2 306.356 4.062 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+]2CC[C@@](F)(c3cc(C)cc(F)c3)C2)o1 ZINC000502887494 340115606 /nfs/dbraw/zinc/11/56/06/340115606.db2.gz MAYHBYZFFGBCNC-DYVFJYSZSA-N 1 2 306.356 4.062 20 0 DIADLO Cc1cc(F)cc2c1C[N@H+](Cc1coc(-c3ccccc3)n1)CC2 ZINC000502888014 340115733 /nfs/dbraw/zinc/11/57/33/340115733.db2.gz PIDSXZZVUCBDHP-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1cc(F)cc2c1C[N@@H+](Cc1coc(-c3ccccc3)n1)CC2 ZINC000502888014 340115734 /nfs/dbraw/zinc/11/57/34/340115734.db2.gz PIDSXZZVUCBDHP-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2CC=CCC2)c[nH+]c1N1CCCC[C@H]1C ZINC000503185273 340122896 /nfs/dbraw/zinc/12/28/96/340122896.db2.gz QWJHZAGJTVVXDO-HZPDHXFCSA-N 1 2 313.445 4.064 20 0 DIADLO CC(C)(C)Oc1cccc(C[NH2+]Cc2c(F)cccc2Cl)n1 ZINC000503259185 340124121 /nfs/dbraw/zinc/12/41/21/340124121.db2.gz JKPWYGKEUGPSHJ-UHFFFAOYSA-N 1 2 322.811 4.341 20 0 DIADLO C[C@H]1C[C@]1([NH2+]Cc1nc(C(C)(C)C)no1)c1ccc(Cl)cc1 ZINC000503379253 340126877 /nfs/dbraw/zinc/12/68/77/340126877.db2.gz UVUSKQMDFLQHLI-APPDUMDISA-N 1 2 319.836 4.045 20 0 DIADLO CCCOc1cccc2c(N[C@@H]3C[C@H]4OCCC[C@H]34)cc[nH+]c12 ZINC000503575674 340131381 /nfs/dbraw/zinc/13/13/81/340131381.db2.gz IJCDZKCNYRHYOV-MZMPZRCHSA-N 1 2 312.413 4.003 20 0 DIADLO CCCOc1cccc2c(N[C@@H](C)[C@H]3CCCOC3)cc[nH+]c12 ZINC000503577036 340131418 /nfs/dbraw/zinc/13/14/18/340131418.db2.gz UHYMJZFFOSKWQI-GJZGRUSLSA-N 1 2 314.429 4.251 20 0 DIADLO Cc1cc(Br)cc2c1[C@@H]([NH2+]C1(C(F)F)CC1)CC2 ZINC000503861085 340135473 /nfs/dbraw/zinc/13/54/73/340135473.db2.gz WGUBOVJSNGWBSU-NSHDSACASA-N 1 2 316.189 4.132 20 0 DIADLO C[C@@H]([NH2+]C1(C(F)F)CC1)c1ccc(F)c(Br)c1 ZINC000503912039 340136585 /nfs/dbraw/zinc/13/65/85/340136585.db2.gz QWVOTQAFMRXTAV-SSDOTTSWSA-N 1 2 308.141 4.037 20 0 DIADLO Cc1ccccc1[C@@H](NC(=O)Nc1cc[nH+]cc1C)C(C)(C)C ZINC000504150806 340141729 /nfs/dbraw/zinc/14/17/29/340141729.db2.gz KPPHTZWKYKOYFG-QGZVFWFLSA-N 1 2 311.429 4.029 20 0 DIADLO CC[N@H+](C)[C@H](c1nc(Cc2ccccc2C)no1)c1ccccc1 ZINC000504223054 340143289 /nfs/dbraw/zinc/14/32/89/340143289.db2.gz MBKIOQHVAWEJHF-IBGZPJMESA-N 1 2 321.424 4.010 20 0 DIADLO CC[N@@H+](C)[C@H](c1nc(Cc2ccccc2C)no1)c1ccccc1 ZINC000504223054 340143290 /nfs/dbraw/zinc/14/32/90/340143290.db2.gz MBKIOQHVAWEJHF-IBGZPJMESA-N 1 2 321.424 4.010 20 0 DIADLO CCc1ccc(CC(=O)Nc2c[nH+]ccc2OC(C)(C)C)cc1 ZINC000504684811 340151154 /nfs/dbraw/zinc/15/11/54/340151154.db2.gz MFURMUGXTSTOPI-UHFFFAOYSA-N 1 2 312.413 4.003 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)[C@@H]1CC12CCCCC2 ZINC000504699151 340151309 /nfs/dbraw/zinc/15/13/09/340151309.db2.gz FEGALJQTGNHCHE-ZDUSSCGKSA-N 1 2 302.418 4.168 20 0 DIADLO Cn1c2ccc(Cl)cc2nc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000505291786 340165692 /nfs/dbraw/zinc/16/56/92/340165692.db2.gz YYKCWMYJVCZLJN-INIZCTEOSA-N 1 2 311.816 4.174 20 0 DIADLO Cn1c2ccc(Cl)cc2nc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000505291786 340165693 /nfs/dbraw/zinc/16/56/93/340165693.db2.gz YYKCWMYJVCZLJN-INIZCTEOSA-N 1 2 311.816 4.174 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1nc(-c2ccccc2)cs1 ZINC000505612353 340172864 /nfs/dbraw/zinc/17/28/64/340172864.db2.gz RLNWSXSEPZTCCC-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1nc(-c2ccccc2)cs1 ZINC000505612353 340172865 /nfs/dbraw/zinc/17/28/65/340172865.db2.gz RLNWSXSEPZTCCC-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1C[N@@H+](C)Cc1ccccc1F ZINC000505610779 340172957 /nfs/dbraw/zinc/17/29/57/340172957.db2.gz KXEGAERWUQLYLQ-UHFFFAOYSA-N 1 2 303.425 4.026 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1C[N@H+](C)Cc1ccccc1F ZINC000505610779 340172958 /nfs/dbraw/zinc/17/29/58/340172958.db2.gz KXEGAERWUQLYLQ-UHFFFAOYSA-N 1 2 303.425 4.026 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cccc(F)c2)c(Cl)c1OC ZINC000505611143 340173003 /nfs/dbraw/zinc/17/30/03/340173003.db2.gz QGHNFXLZIQDEGB-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cccc(F)c2)c(Cl)c1OC ZINC000505611143 340173004 /nfs/dbraw/zinc/17/30/04/340173004.db2.gz QGHNFXLZIQDEGB-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COC(=O)c1cc(F)ccc1C[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000505828583 340179035 /nfs/dbraw/zinc/17/90/35/340179035.db2.gz VSAAHSIIZLIKTL-MRXNPFEDSA-N 1 2 319.401 4.011 20 0 DIADLO COC(=O)c1cc(F)ccc1C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000505828583 340179036 /nfs/dbraw/zinc/17/90/36/340179036.db2.gz VSAAHSIIZLIKTL-MRXNPFEDSA-N 1 2 319.401 4.011 20 0 DIADLO Clc1ccc(C[NH2+][C@H]2CCCc3cn(C4CCCC4)nc32)o1 ZINC000505991281 340182780 /nfs/dbraw/zinc/18/27/80/340182780.db2.gz HZRMSOOHUAPGCN-HNNXBMFYSA-N 1 2 319.836 4.412 20 0 DIADLO COCC[N@H+](Cc1cccs1)Cc1ccc(F)cc1Cl ZINC000506035114 340183883 /nfs/dbraw/zinc/18/38/83/340183883.db2.gz NLMCHHSYBAFVCY-UHFFFAOYSA-N 1 2 313.825 4.189 20 0 DIADLO COCC[N@@H+](Cc1cccs1)Cc1ccc(F)cc1Cl ZINC000506035114 340183884 /nfs/dbraw/zinc/18/38/84/340183884.db2.gz NLMCHHSYBAFVCY-UHFFFAOYSA-N 1 2 313.825 4.189 20 0 DIADLO COCC[N@H+](Cc1cccs1)Cc1c(F)cccc1Cl ZINC000506046434 340184229 /nfs/dbraw/zinc/18/42/29/340184229.db2.gz XGNULFBIWGHIMK-UHFFFAOYSA-N 1 2 313.825 4.189 20 0 DIADLO COCC[N@@H+](Cc1cccs1)Cc1c(F)cccc1Cl ZINC000506046434 340184230 /nfs/dbraw/zinc/18/42/30/340184230.db2.gz XGNULFBIWGHIMK-UHFFFAOYSA-N 1 2 313.825 4.189 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cc(F)ccc2Br)o1 ZINC000506766927 340201282 /nfs/dbraw/zinc/20/12/82/340201282.db2.gz JVTMZUIQZHCOFD-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cc(F)ccc2Br)o1 ZINC000506766927 340201283 /nfs/dbraw/zinc/20/12/83/340201283.db2.gz JVTMZUIQZHCOFD-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cnn(Cc3ccccc3)c2)c1 ZINC000506128976 340186374 /nfs/dbraw/zinc/18/63/74/340186374.db2.gz OQDZQLBMFHFUSP-UHFFFAOYSA-N 1 2 323.415 4.011 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cnn(Cc3ccccc3)c2)c1 ZINC000506128976 340186375 /nfs/dbraw/zinc/18/63/75/340186375.db2.gz OQDZQLBMFHFUSP-UHFFFAOYSA-N 1 2 323.415 4.011 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1ccc(Cl)o1 ZINC000506139466 340186608 /nfs/dbraw/zinc/18/66/08/340186608.db2.gz ZDDSJPQYBHUTFK-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1ccc(Cl)o1 ZINC000506139466 340186609 /nfs/dbraw/zinc/18/66/09/340186609.db2.gz ZDDSJPQYBHUTFK-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO COc1ccsc1C[N@H+](C)Cc1cc(Cl)ccc1OC ZINC000506141422 340186648 /nfs/dbraw/zinc/18/66/48/340186648.db2.gz WGHFYHBQVVLGEQ-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1ccsc1C[N@@H+](C)Cc1cc(Cl)ccc1OC ZINC000506141422 340186649 /nfs/dbraw/zinc/18/66/49/340186649.db2.gz WGHFYHBQVVLGEQ-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1cnc(C(C)(C)C)s1 ZINC000506206998 340188739 /nfs/dbraw/zinc/18/87/39/340188739.db2.gz QHMFVVBFBLKLDE-UHFFFAOYSA-N 1 2 318.486 4.471 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1cnc(C(C)(C)C)s1 ZINC000506206998 340188740 /nfs/dbraw/zinc/18/87/40/340188740.db2.gz QHMFVVBFBLKLDE-UHFFFAOYSA-N 1 2 318.486 4.471 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1cnc(CC(C)C)s1 ZINC000506217469 340188900 /nfs/dbraw/zinc/18/89/00/340188900.db2.gz DDYKEVYEPCKWAU-UHFFFAOYSA-N 1 2 318.486 4.372 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1cnc(CC(C)C)s1 ZINC000506217469 340188901 /nfs/dbraw/zinc/18/89/01/340188901.db2.gz DDYKEVYEPCKWAU-UHFFFAOYSA-N 1 2 318.486 4.372 20 0 DIADLO CCc1cc(NCc2c[nH+]cn2Cc2ccccc2)ccc1F ZINC000506309694 340191942 /nfs/dbraw/zinc/19/19/42/340191942.db2.gz OAKNXGBNTSTSEP-UHFFFAOYSA-N 1 2 309.388 4.245 20 0 DIADLO Fc1cc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)ccc1Cl ZINC000506370893 340193558 /nfs/dbraw/zinc/19/35/58/340193558.db2.gz QPMWUOBGGCCSLO-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1cc(C[N@H+]2CCO[C@H](c3ccccc3)C2)ccc1Cl ZINC000506370893 340193559 /nfs/dbraw/zinc/19/35/59/340193559.db2.gz QPMWUOBGGCCSLO-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)cc1Cl ZINC000506385972 340193831 /nfs/dbraw/zinc/19/38/31/340193831.db2.gz MZYKTZODNHVDFO-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)cc1Cl ZINC000506385972 340193832 /nfs/dbraw/zinc/19/38/32/340193832.db2.gz MZYKTZODNHVDFO-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC000506557956 340196783 /nfs/dbraw/zinc/19/67/83/340196783.db2.gz ZFYIMDSNTXDAPZ-CQSZACIVSA-N 1 2 309.388 4.409 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC000506557956 340196784 /nfs/dbraw/zinc/19/67/84/340196784.db2.gz ZFYIMDSNTXDAPZ-CQSZACIVSA-N 1 2 309.388 4.409 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1c[nH]c(-c2ccccc2)n1 ZINC000506557956 340196785 /nfs/dbraw/zinc/19/67/85/340196785.db2.gz ZFYIMDSNTXDAPZ-CQSZACIVSA-N 1 2 309.388 4.409 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1c[nH]c(-c2ccccc2)n1 ZINC000506557956 340196786 /nfs/dbraw/zinc/19/67/86/340196786.db2.gz ZFYIMDSNTXDAPZ-CQSZACIVSA-N 1 2 309.388 4.409 20 0 DIADLO Fc1cccc(C[N@H+](Cc2cnc(-c3ccccc3)[nH]2)C2CC2)c1 ZINC000506602627 340197467 /nfs/dbraw/zinc/19/74/67/340197467.db2.gz XHYIRKXOOZSBDI-UHFFFAOYSA-N 1 2 321.399 4.380 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2cnc(-c3ccccc3)[nH]2)C2CC2)c1 ZINC000506602627 340197468 /nfs/dbraw/zinc/19/74/68/340197468.db2.gz XHYIRKXOOZSBDI-UHFFFAOYSA-N 1 2 321.399 4.380 20 0 DIADLO Fc1cccc(C[N@H+](Cc2c[nH]c(-c3ccccc3)n2)C2CC2)c1 ZINC000506602627 340197469 /nfs/dbraw/zinc/19/74/69/340197469.db2.gz XHYIRKXOOZSBDI-UHFFFAOYSA-N 1 2 321.399 4.380 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2c[nH]c(-c3ccccc3)n2)C2CC2)c1 ZINC000506602627 340197470 /nfs/dbraw/zinc/19/74/70/340197470.db2.gz XHYIRKXOOZSBDI-UHFFFAOYSA-N 1 2 321.399 4.380 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000506727205 340200233 /nfs/dbraw/zinc/20/02/33/340200233.db2.gz RAALXLPGXWEWTD-CYBMUJFWSA-N 1 2 323.408 4.208 20 0 DIADLO Fc1cccc(F)c1C[N@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000506727205 340200234 /nfs/dbraw/zinc/20/02/34/340200234.db2.gz RAALXLPGXWEWTD-CYBMUJFWSA-N 1 2 323.408 4.208 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1ncccc1C(F)(F)F)C1CC1 ZINC000506733359 340200279 /nfs/dbraw/zinc/20/02/79/340200279.db2.gz DTOFVUJGKZDODE-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1ncccc1C(F)(F)F)C1CC1 ZINC000506733359 340200280 /nfs/dbraw/zinc/20/02/80/340200280.db2.gz DTOFVUJGKZDODE-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO C[C@@H]1CCc2nc(C[N@H+](C)Cc3ccc(F)cc3)sc2C1 ZINC000506758595 340201092 /nfs/dbraw/zinc/20/10/92/340201092.db2.gz MTYDLOGSRMFMBY-GFCCVEGCSA-N 1 2 304.434 4.039 20 0 DIADLO C[C@@H]1CCc2nc(C[N@@H+](C)Cc3ccc(F)cc3)sc2C1 ZINC000506758595 340201093 /nfs/dbraw/zinc/20/10/93/340201093.db2.gz MTYDLOGSRMFMBY-GFCCVEGCSA-N 1 2 304.434 4.039 20 0 DIADLO C[N@H+](Cc1cnn2ccccc12)Cc1cccc(Cl)c1Cl ZINC000506758946 340201100 /nfs/dbraw/zinc/20/11/00/340201100.db2.gz NJMMSMJZBFNUQN-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1cnn2ccccc12)Cc1cccc(Cl)c1Cl ZINC000506758946 340201101 /nfs/dbraw/zinc/20/11/01/340201101.db2.gz NJMMSMJZBFNUQN-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO CC[N@H+](Cc1cccc(O)c1)Cc1ccccc1Br ZINC000507117236 340208066 /nfs/dbraw/zinc/20/80/66/340208066.db2.gz VBJQBPHRYHIKLT-UHFFFAOYSA-N 1 2 320.230 4.177 20 0 DIADLO CC[N@@H+](Cc1cccc(O)c1)Cc1ccccc1Br ZINC000507117236 340208067 /nfs/dbraw/zinc/20/80/67/340208067.db2.gz VBJQBPHRYHIKLT-UHFFFAOYSA-N 1 2 320.230 4.177 20 0 DIADLO COCc1nc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2)cs1 ZINC000507203091 340213017 /nfs/dbraw/zinc/21/30/17/340213017.db2.gz LKBIPJQWFHHPFW-LLVKDONJSA-N 1 2 310.850 4.136 20 0 DIADLO COCc1nc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2)cs1 ZINC000507203091 340213018 /nfs/dbraw/zinc/21/30/18/340213018.db2.gz LKBIPJQWFHHPFW-LLVKDONJSA-N 1 2 310.850 4.136 20 0 DIADLO Cc1cccn2c(C[N@@H+](C)[C@@H](C)c3cc(F)ccc3F)cnc12 ZINC000507216617 340214082 /nfs/dbraw/zinc/21/40/82/340214082.db2.gz YQHDXZWZOHERND-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1cccn2c(C[N@H+](C)[C@@H](C)c3cc(F)ccc3F)cnc12 ZINC000507216617 340214083 /nfs/dbraw/zinc/21/40/83/340214083.db2.gz YQHDXZWZOHERND-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1cccn2c(CN(C)[C@@H](C)c3cc(F)ccc3F)c[nH+]c12 ZINC000507216617 340214084 /nfs/dbraw/zinc/21/40/84/340214084.db2.gz YQHDXZWZOHERND-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO CCCc1noc(C[N@H+](C)Cc2ccccc2-c2ccccc2)n1 ZINC000507219182 340214230 /nfs/dbraw/zinc/21/42/30/340214230.db2.gz NUJVQSXZIKTLGN-UHFFFAOYSA-N 1 2 321.424 4.321 20 0 DIADLO CCCc1noc(C[N@@H+](C)Cc2ccccc2-c2ccccc2)n1 ZINC000507219182 340214231 /nfs/dbraw/zinc/21/42/31/340214231.db2.gz NUJVQSXZIKTLGN-UHFFFAOYSA-N 1 2 321.424 4.321 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)[C@@H](C)c1ccc(F)cc1F ZINC000507233444 340214815 /nfs/dbraw/zinc/21/48/15/340214815.db2.gz VGLYXOGSLHRVET-NSHDSACASA-N 1 2 321.396 4.175 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)[C@@H](C)c1ccc(F)cc1F ZINC000507233444 340214816 /nfs/dbraw/zinc/21/48/16/340214816.db2.gz VGLYXOGSLHRVET-NSHDSACASA-N 1 2 321.396 4.175 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1cnn(C(C)(C)C)c1 ZINC000507243524 340215231 /nfs/dbraw/zinc/21/52/31/340215231.db2.gz MRQSTQBFSPNBFP-ZDUSSCGKSA-N 1 2 305.853 4.485 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1cnn(C(C)(C)C)c1 ZINC000507243524 340215232 /nfs/dbraw/zinc/21/52/32/340215232.db2.gz MRQSTQBFSPNBFP-ZDUSSCGKSA-N 1 2 305.853 4.485 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)Cc1ccc2c[nH]nc2c1 ZINC000507243173 340215321 /nfs/dbraw/zinc/21/53/21/340215321.db2.gz KKIWHEULHCXZGY-NSHDSACASA-N 1 2 301.340 4.034 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccc2c[nH]nc2c1 ZINC000507243173 340215322 /nfs/dbraw/zinc/21/53/22/340215322.db2.gz KKIWHEULHCXZGY-NSHDSACASA-N 1 2 301.340 4.034 20 0 DIADLO CCCCc1nc(C[N@H+](C)CCc2cccc3ccccc32)no1 ZINC000507304710 340216945 /nfs/dbraw/zinc/21/69/45/340216945.db2.gz LWWHGGDXHLQEAL-UHFFFAOYSA-N 1 2 323.440 4.240 20 0 DIADLO CCCCc1nc(C[N@@H+](C)CCc2cccc3ccccc32)no1 ZINC000507304710 340216946 /nfs/dbraw/zinc/21/69/46/340216946.db2.gz LWWHGGDXHLQEAL-UHFFFAOYSA-N 1 2 323.440 4.240 20 0 DIADLO CC[N@H+](Cc1c(F)ccc(O)c1F)[C@H](C)c1cccc(OC)c1 ZINC000507331561 340217408 /nfs/dbraw/zinc/21/74/08/340217408.db2.gz FUDYOWOYQOHCLH-GFCCVEGCSA-N 1 2 321.367 4.262 20 0 DIADLO CC[N@@H+](Cc1c(F)ccc(O)c1F)[C@H](C)c1cccc(OC)c1 ZINC000507331561 340217409 /nfs/dbraw/zinc/21/74/09/340217409.db2.gz FUDYOWOYQOHCLH-GFCCVEGCSA-N 1 2 321.367 4.262 20 0 DIADLO CC[C@@H](C)CCC(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1 ZINC000507467577 340221108 /nfs/dbraw/zinc/22/11/08/340221108.db2.gz XGQGOXFZIGUUDV-CYBMUJFWSA-N 1 2 323.506 4.140 20 0 DIADLO C[C@@H](Nc1cccc([NH+]2CCCCCC2)c1)[C@@H]1CCCOC1 ZINC000507480623 340221715 /nfs/dbraw/zinc/22/17/15/340221715.db2.gz PGYVCBWZNPYXBU-IAGOWNOFSA-N 1 2 302.462 4.294 20 0 DIADLO Fc1cc(F)cc(C[N@@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC000507667946 340227859 /nfs/dbraw/zinc/22/78/59/340227859.db2.gz XSCRZLOVSPNASP-QGZVFWFLSA-N 1 2 323.770 4.192 20 0 DIADLO Fc1cc(F)cc(C[N@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC000507667946 340227860 /nfs/dbraw/zinc/22/78/60/340227860.db2.gz XSCRZLOVSPNASP-QGZVFWFLSA-N 1 2 323.770 4.192 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+][C@H]1CCc2c1c(F)ccc2F ZINC000507794805 340231731 /nfs/dbraw/zinc/23/17/31/340231731.db2.gz QSOKFCDXSWYBAM-BONVTDFDSA-N 1 2 321.342 4.451 20 0 DIADLO Cc1ccc(N[C@H](c2[nH+]ccn2C)c2cccc(F)c2)cc1F ZINC000507804128 340232001 /nfs/dbraw/zinc/23/20/01/340232001.db2.gz MJGNWYZJVAMUFZ-KRWDZBQOSA-N 1 2 313.351 4.208 20 0 DIADLO Cc1ccc(F)c(N[C@@H](c2[nH+]ccn2C)c2cccc(F)c2)c1 ZINC000507810858 340232684 /nfs/dbraw/zinc/23/26/84/340232684.db2.gz CJISQDGXEBVMJR-QGZVFWFLSA-N 1 2 313.351 4.208 20 0 DIADLO COCC[N@H+](CCCSc1ccccc1Cl)CC(F)F ZINC000507850664 340234003 /nfs/dbraw/zinc/23/40/03/340234003.db2.gz LCHSBNKQFIDMPS-UHFFFAOYSA-N 1 2 323.836 4.036 20 0 DIADLO COCC[N@@H+](CCCSc1ccccc1Cl)CC(F)F ZINC000507850664 340234004 /nfs/dbraw/zinc/23/40/04/340234004.db2.gz LCHSBNKQFIDMPS-UHFFFAOYSA-N 1 2 323.836 4.036 20 0 DIADLO COc1ccc(C)cc1C[NH2+][C@H](COCC(C)C)c1ccco1 ZINC000507931164 340235968 /nfs/dbraw/zinc/23/59/68/340235968.db2.gz QTXHDIHWKKLXSQ-QGZVFWFLSA-N 1 2 317.429 4.100 20 0 DIADLO Cc1sccc1C[N@@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000508204759 340240570 /nfs/dbraw/zinc/24/05/70/340240570.db2.gz CSTLCVBYDNXSPB-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1sccc1C[N@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000508204759 340240571 /nfs/dbraw/zinc/24/05/71/340240571.db2.gz CSTLCVBYDNXSPB-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO COCC[N@H+](Cc1csc(C(C)C)n1)[C@H](C)c1ccccc1 ZINC000508531072 340245903 /nfs/dbraw/zinc/24/59/03/340245903.db2.gz KRGOGVCLXPXVBL-OAHLLOKOSA-N 1 2 318.486 4.476 20 0 DIADLO COCC[N@@H+](Cc1csc(C(C)C)n1)[C@H](C)c1ccccc1 ZINC000508531072 340245904 /nfs/dbraw/zinc/24/59/04/340245904.db2.gz KRGOGVCLXPXVBL-OAHLLOKOSA-N 1 2 318.486 4.476 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(-c3cccc(F)c3)s2)no1 ZINC000508543138 340246213 /nfs/dbraw/zinc/24/62/13/340246213.db2.gz TYEXJAUGNUDRJF-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(-c3cccc(F)c3)s2)no1 ZINC000508543138 340246214 /nfs/dbraw/zinc/24/62/14/340246214.db2.gz TYEXJAUGNUDRJF-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Clc1ccc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000508804327 340253449 /nfs/dbraw/zinc/25/34/49/340253449.db2.gz ALWANOWKIRBJAT-UHFFFAOYSA-N 1 2 311.816 4.266 20 0 DIADLO Clc1ccc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000508804327 340253450 /nfs/dbraw/zinc/25/34/50/340253450.db2.gz ALWANOWKIRBJAT-UHFFFAOYSA-N 1 2 311.816 4.266 20 0 DIADLO Cc1cccc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)c1 ZINC000509010632 340258277 /nfs/dbraw/zinc/25/82/77/340258277.db2.gz HMUQCBMEGSLEPE-UHFFFAOYSA-N 1 2 304.349 4.435 20 0 DIADLO Cc1nocc1C[N@@H+]1CCc2cc(Cl)cc(Cl)c2[C@@H]1C ZINC000509030709 340258787 /nfs/dbraw/zinc/25/87/87/340258787.db2.gz JQRPZJZATAVKPI-JTQLQIEISA-N 1 2 311.212 4.409 20 0 DIADLO Cc1nocc1C[N@H+]1CCc2cc(Cl)cc(Cl)c2[C@@H]1C ZINC000509030709 340258788 /nfs/dbraw/zinc/25/87/88/340258788.db2.gz JQRPZJZATAVKPI-JTQLQIEISA-N 1 2 311.212 4.409 20 0 DIADLO CC[C@@H](C)CN(CC)C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509346780 340266757 /nfs/dbraw/zinc/26/67/57/340266757.db2.gz UZBGQQZRWFPUBL-OAHLLOKOSA-N 1 2 312.413 4.382 20 0 DIADLO C[C@@H]1CC[C@@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)[C@H](C)C1 ZINC000509430032 340269239 /nfs/dbraw/zinc/26/92/39/340269239.db2.gz NQMYDBPVTNCPRT-IIDMSEBBSA-N 1 2 324.424 4.428 20 0 DIADLO O=C(c1ccccc1Oc1cc[nH+]cc1)N(CC1CC1)CC1CC1 ZINC000509438029 340269515 /nfs/dbraw/zinc/26/95/15/340269515.db2.gz JWCXFZYHBOTUJA-UHFFFAOYSA-N 1 2 322.408 4.136 20 0 DIADLO Cn1c2ccccc2[nH+]c1N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000509479571 340271025 /nfs/dbraw/zinc/27/10/25/340271025.db2.gz ZCMZBPFSIQVZPJ-CQSZACIVSA-N 1 2 323.362 4.132 20 0 DIADLO Cn1ncc2c1nc[nH+]c2N[C@H](CC1CCCC1)c1ccccc1 ZINC000509563798 340273608 /nfs/dbraw/zinc/27/36/08/340273608.db2.gz LLFHZPFRYMFNGG-QGZVFWFLSA-N 1 2 321.428 4.097 20 0 DIADLO FCCCC[N@@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000509671348 340276456 /nfs/dbraw/zinc/27/64/56/340276456.db2.gz DTJZOKMUSXVRJE-AWEZNQCLSA-N 1 2 306.208 4.116 20 0 DIADLO FCCCC[N@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000509671348 340276457 /nfs/dbraw/zinc/27/64/57/340276457.db2.gz DTJZOKMUSXVRJE-AWEZNQCLSA-N 1 2 306.208 4.116 20 0 DIADLO FC(F)(F)c1ccccc1C[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC000509674480 340276612 /nfs/dbraw/zinc/27/66/12/340276612.db2.gz YTNPZYJBBBFPOY-QGZVFWFLSA-N 1 2 321.342 4.279 20 0 DIADLO FC(F)(F)c1ccccc1C[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC000509674480 340276613 /nfs/dbraw/zinc/27/66/13/340276613.db2.gz YTNPZYJBBBFPOY-QGZVFWFLSA-N 1 2 321.342 4.279 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2nc(-c3ccc(C)cc3)cs2)C[C@H](C)O1 ZINC000509681016 340276805 /nfs/dbraw/zinc/27/68/05/340276805.db2.gz CNOWDSOGPRZMPY-GOEBONIOSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2nc(-c3ccc(C)cc3)cs2)C[C@H](C)O1 ZINC000509681016 340276806 /nfs/dbraw/zinc/27/68/06/340276806.db2.gz CNOWDSOGPRZMPY-GOEBONIOSA-N 1 2 316.470 4.118 20 0 DIADLO C[C@@H](F)CC[N@@H+]1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000509695916 340277322 /nfs/dbraw/zinc/27/73/22/340277322.db2.gz IARIPZPWFYQISR-OTYXRUKQSA-N 1 2 324.198 4.254 20 0 DIADLO C[C@@H](F)CC[N@H+]1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000509695916 340277323 /nfs/dbraw/zinc/27/73/23/340277323.db2.gz IARIPZPWFYQISR-OTYXRUKQSA-N 1 2 324.198 4.254 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)c1oc2c(cccc2Cl)c1C ZINC000509742002 340278242 /nfs/dbraw/zinc/27/82/42/340278242.db2.gz GTSFYLSABQQLLZ-UHFFFAOYSA-N 1 2 314.772 4.026 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@H+](C)Cc1sccc1C ZINC000510221871 340293067 /nfs/dbraw/zinc/29/30/67/340293067.db2.gz IWMMCSRHTKVRFB-OAHLLOKOSA-N 1 2 323.845 4.056 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1sccc1C ZINC000510221871 340293068 /nfs/dbraw/zinc/29/30/68/340293068.db2.gz IWMMCSRHTKVRFB-OAHLLOKOSA-N 1 2 323.845 4.056 20 0 DIADLO COc1cccc(C2([NH2+]Cc3ncc(Cl)cc3Cl)CC2)c1 ZINC000510243046 340293991 /nfs/dbraw/zinc/29/39/91/340293991.db2.gz QKYWDTYBEQYZRR-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO COc1cc[nH+]cc1NC(=O)c1ccc(C2CCCCC2)cc1 ZINC000303038275 340297173 /nfs/dbraw/zinc/29/71/73/340297173.db2.gz PKCANDWWGYXLOP-UHFFFAOYSA-N 1 2 310.397 4.390 20 0 DIADLO C[N@@H+](Cc1ccn(-c2ccccc2)n1)Cc1cc2ccccc2o1 ZINC000510396124 340297731 /nfs/dbraw/zinc/29/77/31/340297731.db2.gz ORFQKZCLETUKNN-UHFFFAOYSA-N 1 2 317.392 4.251 20 0 DIADLO C[N@H+](Cc1ccn(-c2ccccc2)n1)Cc1cc2ccccc2o1 ZINC000510396124 340297732 /nfs/dbraw/zinc/29/77/32/340297732.db2.gz ORFQKZCLETUKNN-UHFFFAOYSA-N 1 2 317.392 4.251 20 0 DIADLO C[C@H]1CC[C@H](CNC(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000510781673 340310874 /nfs/dbraw/zinc/31/08/74/340310874.db2.gz NOONOQMTDNNILN-GJZGRUSLSA-N 1 2 310.397 4.040 20 0 DIADLO Cn1nccc1C1=CC[N@H+](Cc2cccc(Cl)c2Cl)CC1 ZINC000511059821 340319733 /nfs/dbraw/zinc/31/97/33/340319733.db2.gz OPUUSKPJCOJCKD-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1nccc1C1=CC[N@@H+](Cc2cccc(Cl)c2Cl)CC1 ZINC000511059821 340319734 /nfs/dbraw/zinc/31/97/34/340319734.db2.gz OPUUSKPJCOJCKD-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1nccc1C1=CC[N@H+](Cc2cc(Cl)ccc2Cl)CC1 ZINC000511074705 340320022 /nfs/dbraw/zinc/32/00/22/340320022.db2.gz PMJROVYDERCLOI-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1nccc1C1=CC[N@@H+](Cc2cc(Cl)ccc2Cl)CC1 ZINC000511074705 340320023 /nfs/dbraw/zinc/32/00/23/340320023.db2.gz PMJROVYDERCLOI-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO COC(=O)c1ccc(Cl)c(C[N@@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000511110701 340321163 /nfs/dbraw/zinc/32/11/63/340321163.db2.gz MXAYTNDPBHRDEB-QGZVFWFLSA-N 1 2 315.800 4.074 20 0 DIADLO COC(=O)c1ccc(Cl)c(C[N@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000511110701 340321164 /nfs/dbraw/zinc/32/11/64/340321164.db2.gz MXAYTNDPBHRDEB-QGZVFWFLSA-N 1 2 315.800 4.074 20 0 DIADLO Clc1cnc(C[N@@H+]2CCC=C(c3ccco3)C2)c(Cl)c1 ZINC000511142552 340322233 /nfs/dbraw/zinc/32/22/33/340322233.db2.gz PARVRWVYNPXJQR-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Clc1cnc(C[N@H+]2CCC=C(c3ccco3)C2)c(Cl)c1 ZINC000511142552 340322234 /nfs/dbraw/zinc/32/22/34/340322234.db2.gz PARVRWVYNPXJQR-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO C[C@@H]1C[C@H](C)[C@@H](C)N(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000511290565 340324854 /nfs/dbraw/zinc/32/48/54/340324854.db2.gz YEZYSBZVCJRZMJ-OWCLPIDISA-N 1 2 324.424 4.381 20 0 DIADLO COC(=O)c1ccc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)s1 ZINC000511597159 340331938 /nfs/dbraw/zinc/33/19/38/340331938.db2.gz UFJFOKQMXAYUDT-AWEZNQCLSA-N 1 2 321.829 4.135 20 0 DIADLO COC(=O)c1ccc(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)s1 ZINC000511597159 340331939 /nfs/dbraw/zinc/33/19/39/340331939.db2.gz UFJFOKQMXAYUDT-AWEZNQCLSA-N 1 2 321.829 4.135 20 0 DIADLO CCOC(=O)c1ccc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)o1 ZINC000511613426 340332569 /nfs/dbraw/zinc/33/25/69/340332569.db2.gz XJEWICZBKXHKFZ-HNNXBMFYSA-N 1 2 319.788 4.057 20 0 DIADLO CCOC(=O)c1ccc(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)o1 ZINC000511613426 340332570 /nfs/dbraw/zinc/33/25/70/340332570.db2.gz XJEWICZBKXHKFZ-HNNXBMFYSA-N 1 2 319.788 4.057 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Cl)s2)C[C@@H](c2ccccc2)O1 ZINC000511838180 340339809 /nfs/dbraw/zinc/33/98/09/340339809.db2.gz LZEVYYJEPUMQIA-WFASDCNBSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Cl)s2)C[C@@H](c2ccccc2)O1 ZINC000511838180 340339810 /nfs/dbraw/zinc/33/98/10/340339810.db2.gz LZEVYYJEPUMQIA-WFASDCNBSA-N 1 2 307.846 4.364 20 0 DIADLO CC[C@H]1C[N@H+](Cc2csc(-c3ccc(C)cc3)n2)C[C@H](C)O1 ZINC000511855808 340340626 /nfs/dbraw/zinc/34/06/26/340340626.db2.gz QWHXOPKKEBCHOH-YOEHRIQHSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2csc(-c3ccc(C)cc3)n2)C[C@H](C)O1 ZINC000511855808 340340627 /nfs/dbraw/zinc/34/06/27/340340627.db2.gz QWHXOPKKEBCHOH-YOEHRIQHSA-N 1 2 316.470 4.118 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cc(C)c(C)cc3Cl)cc2[nH+]1 ZINC000511962795 340343991 /nfs/dbraw/zinc/34/39/91/340343991.db2.gz APRNDIYAOVIGBO-UHFFFAOYSA-N 1 2 313.788 4.394 20 0 DIADLO Cc1[nH]c2cc(NC(=O)c3cc(C)c(C)cc3Cl)ccc2[nH+]1 ZINC000511962795 340343992 /nfs/dbraw/zinc/34/39/92/340343992.db2.gz APRNDIYAOVIGBO-UHFFFAOYSA-N 1 2 313.788 4.394 20 0 DIADLO Clc1cc(Cl)cc(CN2CCCC[C@@H]2c2[nH]cc[nH+]2)c1 ZINC000512536886 340365898 /nfs/dbraw/zinc/36/58/98/340365898.db2.gz LZPSWQRYBXXOBB-CQSZACIVSA-N 1 2 310.228 4.444 20 0 DIADLO CC(C)COc1ccc(C[N@@H+]2CCCC[C@H]2c2ncc[nH]2)cc1 ZINC000512541664 340366092 /nfs/dbraw/zinc/36/60/92/340366092.db2.gz GZUDZBLAICGSOS-SFHVURJKSA-N 1 2 313.445 4.172 20 0 DIADLO CC(C)COc1ccc(C[N@H+]2CCCC[C@H]2c2ncc[nH]2)cc1 ZINC000512541664 340366093 /nfs/dbraw/zinc/36/60/93/340366093.db2.gz GZUDZBLAICGSOS-SFHVURJKSA-N 1 2 313.445 4.172 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cccc(O)c1Cl ZINC000512677203 340372598 /nfs/dbraw/zinc/37/25/98/340372598.db2.gz HTPKDTKFHQKYIZ-GXSJLCMTSA-N 1 2 307.743 4.208 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cccc(O)c1Cl ZINC000512677206 340372659 /nfs/dbraw/zinc/37/26/59/340372659.db2.gz HTPKDTKFHQKYIZ-KOLCDFICSA-N 1 2 307.743 4.208 20 0 DIADLO C[C@H]([NH2+]C/C=C/c1ccccc1)c1nc(C2CCCCC2)no1 ZINC000173866594 340376306 /nfs/dbraw/zinc/37/63/06/340376306.db2.gz YJXONKNQJXXOSR-SHQCLWGWSA-N 1 2 311.429 4.481 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@@H](C)Cc2cccc(F)c2)c(C)[nH+]1 ZINC000174028983 340380476 /nfs/dbraw/zinc/38/04/76/340380476.db2.gz IEAQUDKTZKEEOK-LBPRGKRZSA-N 1 2 314.404 4.353 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@H](C)Cc2cccc(F)c2)c(C)[nH+]1 ZINC000174028994 340380500 /nfs/dbraw/zinc/38/05/00/340380500.db2.gz IEAQUDKTZKEEOK-GFCCVEGCSA-N 1 2 314.404 4.353 20 0 DIADLO Fc1ccc2nc(C[NH2+]C3(C(F)F)CCCCC3)sc2c1 ZINC000512885442 340382456 /nfs/dbraw/zinc/38/24/56/340382456.db2.gz PPJFUUZAPZYBMY-UHFFFAOYSA-N 1 2 314.376 4.493 20 0 DIADLO CCCN(CC1CC1)C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000512886468 340382607 /nfs/dbraw/zinc/38/26/07/340382607.db2.gz IRRNPMCQXGUYOC-UHFFFAOYSA-N 1 2 310.397 4.136 20 0 DIADLO CCc1ccc(C[NH2+]CC(F)(F)c2ccc(Cl)cc2)cn1 ZINC000512977858 340386618 /nfs/dbraw/zinc/38/66/18/340386618.db2.gz TUHBETQVNVXOER-UHFFFAOYSA-N 1 2 310.775 4.179 20 0 DIADLO CCC(C)(C)C1CCC(CC(=O)N[C@@H](C)Cn2cc[nH+]c2)CC1 ZINC000513053047 340391071 /nfs/dbraw/zinc/39/10/71/340391071.db2.gz ALWCNJLYALBJJZ-GTPINHCMSA-N 1 2 319.493 4.021 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)c1c(F)cncc1F ZINC000513065839 340391666 /nfs/dbraw/zinc/39/16/66/340391666.db2.gz YFBMBEAQMDZSJV-MRVPVSSYSA-N 1 2 300.711 4.003 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000513123738 340394307 /nfs/dbraw/zinc/39/43/07/340394307.db2.gz WJNBOCMCWQZEPV-LBPRGKRZSA-N 1 2 303.789 4.001 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+]1CCOc2cc(O)ccc2C1 ZINC000513123738 340394308 /nfs/dbraw/zinc/39/43/08/340394308.db2.gz WJNBOCMCWQZEPV-LBPRGKRZSA-N 1 2 303.789 4.001 20 0 DIADLO C[C@H](c1ccc(F)c(Cl)c1)[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000513133440 340394530 /nfs/dbraw/zinc/39/45/30/340394530.db2.gz IFIBSLVBXUDKEU-LLVKDONJSA-N 1 2 321.779 4.140 20 0 DIADLO C[C@H](c1ccc(F)c(Cl)c1)[N@H+]1CCOc2cc(O)ccc2C1 ZINC000513133440 340394531 /nfs/dbraw/zinc/39/45/31/340394531.db2.gz IFIBSLVBXUDKEU-LLVKDONJSA-N 1 2 321.779 4.140 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@@H+]1Cc1cc[nH]n1 ZINC000513138373 340394813 /nfs/dbraw/zinc/39/48/13/340394813.db2.gz GZDRLDKJRUPINZ-OAHLLOKOSA-N 1 2 309.335 4.156 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@H+]1Cc1cc[nH]n1 ZINC000513138373 340394814 /nfs/dbraw/zinc/39/48/14/340394814.db2.gz GZDRLDKJRUPINZ-OAHLLOKOSA-N 1 2 309.335 4.156 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000513144498 340394968 /nfs/dbraw/zinc/39/49/68/340394968.db2.gz LISLWUNSXIHCNM-GFCCVEGCSA-N 1 2 303.789 4.001 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCOc2cc(O)ccc2C1 ZINC000513144498 340394969 /nfs/dbraw/zinc/39/49/69/340394969.db2.gz LISLWUNSXIHCNM-GFCCVEGCSA-N 1 2 303.789 4.001 20 0 DIADLO CCCOc1ccc(C[NH2+]Cc2c(F)ccc(O)c2F)c(C)c1 ZINC000513145726 340395070 /nfs/dbraw/zinc/39/50/70/340395070.db2.gz XPHIQNRYUGWTFR-UHFFFAOYSA-N 1 2 321.367 4.057 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1ccc2c(c1)CCC2 ZINC000513195413 340396579 /nfs/dbraw/zinc/39/65/79/340396579.db2.gz BHVSCQFMWICVOL-OLZOCXBDSA-N 1 2 313.445 4.268 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC(C(F)(F)F)CC1 ZINC000175280084 340407620 /nfs/dbraw/zinc/40/76/20/340407620.db2.gz OEZWNCSUTMJJGQ-JTQLQIEISA-N 1 2 304.356 4.307 20 0 DIADLO C[C@@H]1CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)CC1(C)C ZINC000513656151 340417536 /nfs/dbraw/zinc/41/75/36/340417536.db2.gz YKAWNKKOUAPLTG-OAHLLOKOSA-N 1 2 324.424 4.382 20 0 DIADLO CCc1c[nH+]ccc1[C@@H](C)[C@H](C)c1ccccc1-n1ccnn1 ZINC000513708652 340420920 /nfs/dbraw/zinc/42/09/20/340420920.db2.gz VJBSHSUKRAMPAQ-GJZGRUSLSA-N 1 2 306.413 4.132 20 0 DIADLO CC(C)[C@@H]1CCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000513829170 340427301 /nfs/dbraw/zinc/42/73/01/340427301.db2.gz XKPAPBVCLQDITQ-MRXNPFEDSA-N 1 2 324.424 4.382 20 0 DIADLO Cc1cc2[nH]c(-c3ccc(OC[C@H]4CCCO4)cc3)[nH+]c2cc1C ZINC000513855555 340428565 /nfs/dbraw/zinc/42/85/65/340428565.db2.gz HGGQBUNFFAYNTQ-QGZVFWFLSA-N 1 2 322.408 4.405 20 0 DIADLO CSC1(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)CC1 ZINC000516685477 340453830 /nfs/dbraw/zinc/45/38/30/340453830.db2.gz VTACPHCNVBOALH-UHFFFAOYSA-N 1 2 313.470 4.194 20 0 DIADLO COc1cc(CSc2[nH+]cc3ccccn32)ccc1SC ZINC000520996217 340478649 /nfs/dbraw/zinc/47/86/49/340478649.db2.gz MYRRBGJPEHELAQ-UHFFFAOYSA-N 1 2 316.451 4.357 20 0 DIADLO Cc1oc2ccccc2c1C[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000185046671 340497515 /nfs/dbraw/zinc/49/75/15/340497515.db2.gz RXOYALVZTUTLPX-LLVKDONJSA-N 1 2 313.401 4.273 20 0 DIADLO CCN(C)c1ccc(CNc2ccc(C)c(OC(F)F)c2)c[nH+]1 ZINC000191071420 340549705 /nfs/dbraw/zinc/54/97/05/340549705.db2.gz FMAOUJZCKYQEER-UHFFFAOYSA-N 1 2 321.371 4.060 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)c(C)c2)o1 ZINC000193188707 340573743 /nfs/dbraw/zinc/57/37/43/340573743.db2.gz QRPMFPIFVYKHOC-UHFFFAOYSA-N 1 2 308.337 4.336 20 0 DIADLO CCOc1ccccc1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000194888428 340596986 /nfs/dbraw/zinc/59/69/86/340596986.db2.gz VZOYAYQAUWJURO-OAQYLSRUSA-N 1 2 318.420 4.360 20 0 DIADLO Cc1ccc(C(=O)N[C@H]2CCCC[C@H]2C)cc1Oc1cc[nH+]cc1 ZINC000522312686 340598625 /nfs/dbraw/zinc/59/86/25/340598625.db2.gz NADPENGAEMQQIF-KDOFPFPSSA-N 1 2 324.424 4.491 20 0 DIADLO Cc1ccc(C[C@H]2CCCN2c2cc(C)[nH+]c(C3CC3)n2)cc1 ZINC000522568936 340604578 /nfs/dbraw/zinc/60/45/78/340604578.db2.gz QKRIVKCOXCKDLW-GOSISDBHSA-N 1 2 307.441 4.182 20 0 DIADLO Cc1cc(N2C[C@@H](c3ccccc3C)C[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000523086803 340614566 /nfs/dbraw/zinc/61/45/66/340614566.db2.gz XOMGALHULHNNNL-RDJZCZTQSA-N 1 2 307.441 4.353 20 0 DIADLO Cc1cc2[nH+]cn(Cc3cc(-c4ccccc4)on3)c2cc1C ZINC000302769691 340630807 /nfs/dbraw/zinc/63/08/07/340630807.db2.gz YKGZPXMMOWQSIS-UHFFFAOYSA-N 1 2 303.365 4.356 20 0 DIADLO FC(F)(F)c1cccc(NC2CCN(c3cccc[nH+]3)CC2)c1 ZINC000237685216 340673150 /nfs/dbraw/zinc/67/31/50/340673150.db2.gz OFNFMRJTLUXUCJ-UHFFFAOYSA-N 1 2 321.346 4.181 20 0 DIADLO C[C@H]1C[NH+](Cc2csc(Cc3ccccc3)n2)C[C@H](C)S1 ZINC000524756488 340679313 /nfs/dbraw/zinc/67/93/13/340679313.db2.gz OOGCYTNBCYGCDX-KBPBESRZSA-N 1 2 318.511 4.060 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)CC/C=C/c3ccccc3)ccc2n1C ZINC000525217367 340695623 /nfs/dbraw/zinc/69/56/23/340695623.db2.gz GFSAHYWAGCRZGA-UXBLZVDNSA-N 1 2 319.408 4.314 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1ncccc1Cl ZINC000528432356 340718527 /nfs/dbraw/zinc/71/85/27/340718527.db2.gz HZFQELWUPJSYED-OAHLLOKOSA-N 1 2 304.821 4.375 20 0 DIADLO CC(C)([NH2+]Cc1ncccc1Cl)c1nc2ccccc2s1 ZINC000528603431 340725950 /nfs/dbraw/zinc/72/59/50/340725950.db2.gz PDNPWGADABOULI-UHFFFAOYSA-N 1 2 317.845 4.370 20 0 DIADLO CC(C)([NH2+]Cc1ccsc1C(F)(F)F)c1nccs1 ZINC000529550036 340762507 /nfs/dbraw/zinc/76/25/07/340762507.db2.gz PGJZZZWGLVJTFM-UHFFFAOYSA-N 1 2 306.378 4.248 20 0 DIADLO Cc1ccc(-c2ncc(C[NH2+][C@@H](C)c3nccs3)s2)o1 ZINC000127568524 340853368 /nfs/dbraw/zinc/85/33/68/340853368.db2.gz MUFMIMLBJCSGFU-JTQLQIEISA-N 1 2 305.428 4.019 20 0 DIADLO CC(C)(C)c1ccc(C(C)(C)[NH2+]Cc2nnc(C3CC3)o2)cc1 ZINC000539307691 340880394 /nfs/dbraw/zinc/88/03/94/340880394.db2.gz VJKVSPITOIXQNU-UHFFFAOYSA-N 1 2 313.445 4.269 20 0 DIADLO C[C@]1([NH2+]Cc2noc(-c3ccccc3)n2)CCCc2ccccc21 ZINC000539798396 340900267 /nfs/dbraw/zinc/90/02/67/340900267.db2.gz NAXPVDIYKWCILF-FQEVSTJZSA-N 1 2 319.408 4.078 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccccc2OC(C)C)c(C)s1 ZINC000540328168 340927088 /nfs/dbraw/zinc/92/70/88/340927088.db2.gz MRQCLLRIWDTNQP-GFCCVEGCSA-N 1 2 304.459 4.398 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2nc3ccccc3s2)c1 ZINC000540725091 340943368 /nfs/dbraw/zinc/94/33/68/340943368.db2.gz RFEYYTVWJYNWQD-UHFFFAOYSA-N 1 2 316.451 4.442 20 0 DIADLO CSCc1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)cc1 ZINC000129449875 340961171 /nfs/dbraw/zinc/96/11/71/340961171.db2.gz CPRRNNLPXAURJQ-KRWDZBQOSA-N 1 2 309.438 4.474 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@H]2CCC(C)(C)C2)c2ccc(Cl)cc2)no1 ZINC000541587385 340976109 /nfs/dbraw/zinc/97/61/09/340976109.db2.gz GKVVGBSWZDNZGS-GJZGRUSLSA-N 1 2 319.836 4.289 20 0 DIADLO CCOc1ccc([C@@H]2CCCN2c2cc(CC)[nH+]c(C)n2)cc1 ZINC000542019023 340993521 /nfs/dbraw/zinc/99/35/21/340993521.db2.gz AFTANNYHXUVHIN-SFHVURJKSA-N 1 2 311.429 4.088 20 0 DIADLO CCCCS(=O)(=O)Nc1ccc([NH2+][C@@H](C)[C@H](C)CC)cc1 ZINC000542165751 340998179 /nfs/dbraw/zinc/99/81/79/340998179.db2.gz IUZALTIXYYBVTL-KGLIPLIRSA-N 1 2 312.479 4.075 20 0 DIADLO COc1cccc([C@H]2C[C@@H](C)CN2c2[nH]c3ccccc3[nH+]2)c1 ZINC000542205342 340999818 /nfs/dbraw/zinc/99/98/18/340999818.db2.gz NOEHLGXPUQZANQ-FZKQIMNGSA-N 1 2 307.397 4.159 20 0 DIADLO Clc1ccc2c(c1)[C@H]([N@@H+]1CCO[C@@H](c3ccsc3)C1)CC2 ZINC000542279023 341003274 /nfs/dbraw/zinc/00/32/74/341003274.db2.gz COSZHDCLXKXASR-IAGOWNOFSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)[C@H]([N@H+]1CCO[C@@H](c3ccsc3)C1)CC2 ZINC000542279023 341003275 /nfs/dbraw/zinc/00/32/75/341003275.db2.gz COSZHDCLXKXASR-IAGOWNOFSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)[C@H]([N@@H+]1CCO[C@H](c3ccsc3)C1)CC2 ZINC000542279025 341003344 /nfs/dbraw/zinc/00/33/44/341003344.db2.gz COSZHDCLXKXASR-SJORKVTESA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)[C@H]([N@H+]1CCO[C@H](c3ccsc3)C1)CC2 ZINC000542279025 341003345 /nfs/dbraw/zinc/00/33/45/341003345.db2.gz COSZHDCLXKXASR-SJORKVTESA-N 1 2 319.857 4.462 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1sccc1Br)c1nccs1 ZINC000070717643 341007298 /nfs/dbraw/zinc/00/72/98/341007298.db2.gz MVKXWJCXTZWCHY-YUMQZZPRSA-N 1 2 317.277 4.379 20 0 DIADLO Fc1ccc(-c2cnc(C[NH2+][C@@H](c3cccnc3)C3CC3)o2)cc1 ZINC000542518030 341011633 /nfs/dbraw/zinc/01/16/33/341011633.db2.gz GKWRAZMUOCVKGF-LJQANCHMSA-N 1 2 323.371 4.117 20 0 DIADLO Fc1ccc(-c2cnc(C[NH2+][C@H](c3cccnc3)C3CC3)o2)cc1 ZINC000542518025 341011658 /nfs/dbraw/zinc/01/16/58/341011658.db2.gz GKWRAZMUOCVKGF-IBGZPJMESA-N 1 2 323.371 4.117 20 0 DIADLO CC(C)c1cc(N2CCC3(CCOCC3)[C@H]2C)nc(C(C)C)[nH+]1 ZINC000542524419 341012034 /nfs/dbraw/zinc/01/20/34/341012034.db2.gz AXMYVWSGLLLVGD-OAHLLOKOSA-N 1 2 317.477 4.119 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[NH2+][C@H](C)c1cnn(C(C)C)c1 ZINC000542574271 341014174 /nfs/dbraw/zinc/01/41/74/341014174.db2.gz MDKUYTBKLWTROX-CQSZACIVSA-N 1 2 324.428 4.278 20 0 DIADLO CCc1ccc(-c2noc([C@H](C)[NH2+]Cc3cccc(C)c3)n2)cc1 ZINC000542623864 341015135 /nfs/dbraw/zinc/01/51/35/341015135.db2.gz XRPLYYUYJKTZGP-HNNXBMFYSA-N 1 2 321.424 4.458 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](c2ccc(C)o2)C2CCC2)cs1 ZINC000542664275 341016132 /nfs/dbraw/zinc/01/61/32/341016132.db2.gz UQTGOVDJHRZRSL-BLLLJJGKSA-N 1 2 320.458 4.383 20 0 DIADLO COc1c(C)cnc(C[N@H+](C)Cc2ccc([C@@H]3C[C@H]3C)o2)c1C ZINC000542693508 341017481 /nfs/dbraw/zinc/01/74/81/341017481.db2.gz FHYBLPVEWZWFIW-MLGOLLRUSA-N 1 2 314.429 4.055 20 0 DIADLO COc1c(C)cnc(C[N@@H+](C)Cc2ccc([C@@H]3C[C@H]3C)o2)c1C ZINC000542693508 341017482 /nfs/dbraw/zinc/01/74/82/341017482.db2.gz FHYBLPVEWZWFIW-MLGOLLRUSA-N 1 2 314.429 4.055 20 0 DIADLO CCc1cnc(C[N@H+](C)C/C=C/c2ccc(F)cc2F)s1 ZINC000542702678 341017900 /nfs/dbraw/zinc/01/79/00/341017900.db2.gz OJYWMPRDKFUDNM-SNAWJCMRSA-N 1 2 308.397 4.129 20 0 DIADLO CCc1cnc(C[N@@H+](C)C/C=C/c2ccc(F)cc2F)s1 ZINC000542702678 341017901 /nfs/dbraw/zinc/01/79/01/341017901.db2.gz OJYWMPRDKFUDNM-SNAWJCMRSA-N 1 2 308.397 4.129 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CCC[C@H]2c2ccccc2)n1 ZINC000130395540 341020742 /nfs/dbraw/zinc/02/07/42/341020742.db2.gz YDKRCZMDVPMWAO-LBPRGKRZSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CCC[C@H]2c2ccccc2)n1 ZINC000130395540 341020743 /nfs/dbraw/zinc/02/07/43/341020743.db2.gz YDKRCZMDVPMWAO-LBPRGKRZSA-N 1 2 312.360 4.499 20 0 DIADLO Cc1ccc(C)c(NC(=O)[C@H](C)[N@@H+]2Cc3ccccc3[C@@H]2C)c1 ZINC000543061399 341029848 /nfs/dbraw/zinc/02/98/48/341029848.db2.gz GQUFBKMZGWKCOM-HOTGVXAUSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1ccc(C)c(NC(=O)[C@H](C)[N@H+]2Cc3ccccc3[C@@H]2C)c1 ZINC000543061399 341029849 /nfs/dbraw/zinc/02/98/49/341029849.db2.gz GQUFBKMZGWKCOM-HOTGVXAUSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1ccc(C)c(NC(=O)[C@@H](C)[N@@H+]2Cc3ccccc3[C@@H]2C)c1 ZINC000543061401 341029942 /nfs/dbraw/zinc/02/99/42/341029942.db2.gz GQUFBKMZGWKCOM-JKSUJKDBSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1ccc(C)c(NC(=O)[C@@H](C)[N@H+]2Cc3ccccc3[C@@H]2C)c1 ZINC000543061401 341029943 /nfs/dbraw/zinc/02/99/43/341029943.db2.gz GQUFBKMZGWKCOM-JKSUJKDBSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@@H+]2Cc3ccccc3[C@@H]2C)c(F)c1 ZINC000543063033 341030041 /nfs/dbraw/zinc/03/00/41/341030041.db2.gz WTCSLLFXKIINES-KBPBESRZSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@H+]2Cc3ccccc3[C@@H]2C)c(F)c1 ZINC000543063033 341030042 /nfs/dbraw/zinc/03/00/42/341030042.db2.gz WTCSLLFXKIINES-KBPBESRZSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000543063133 341030113 /nfs/dbraw/zinc/03/01/13/341030113.db2.gz YOHAVOYVKMHMLW-CYBMUJFWSA-N 1 2 314.816 4.164 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)C[N@H+]1Cc2ccccc2[C@H]1C ZINC000543063133 341030114 /nfs/dbraw/zinc/03/01/14/341030114.db2.gz YOHAVOYVKMHMLW-CYBMUJFWSA-N 1 2 314.816 4.164 20 0 DIADLO CC(C)CC[C@H]1CCC[N@@H+]1Cc1ncc(Br)s1 ZINC000543079855 341030941 /nfs/dbraw/zinc/03/09/41/341030941.db2.gz RFFVNCWTZJUEQE-LLVKDONJSA-N 1 2 317.296 4.306 20 0 DIADLO CC(C)CC[C@H]1CCC[N@H+]1Cc1ncc(Br)s1 ZINC000543079855 341030942 /nfs/dbraw/zinc/03/09/42/341030942.db2.gz RFFVNCWTZJUEQE-LLVKDONJSA-N 1 2 317.296 4.306 20 0 DIADLO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000130620924 341033981 /nfs/dbraw/zinc/03/39/81/341033981.db2.gz HROUQBWLXLHQAP-CYBMUJFWSA-N 1 2 318.490 4.118 20 0 DIADLO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000130620924 341033982 /nfs/dbraw/zinc/03/39/82/341033982.db2.gz HROUQBWLXLHQAP-CYBMUJFWSA-N 1 2 318.490 4.118 20 0 DIADLO Fc1cccc(CC[N@@H+]2CCc3c4ccccc4[nH]c3C2)c1F ZINC000543194338 341036240 /nfs/dbraw/zinc/03/62/40/341036240.db2.gz MGMRSURATCLQQF-UHFFFAOYSA-N 1 2 312.363 4.047 20 0 DIADLO Fc1cccc(CC[N@H+]2CCc3c4ccccc4[nH]c3C2)c1F ZINC000543194338 341036241 /nfs/dbraw/zinc/03/62/41/341036241.db2.gz MGMRSURATCLQQF-UHFFFAOYSA-N 1 2 312.363 4.047 20 0 DIADLO COc1ccc(C[N@H+](Cc2ncc(C(C)C)s2)C2CC2)cc1 ZINC000543397106 341041978 /nfs/dbraw/zinc/04/19/78/341041978.db2.gz ZAUYUNUFQUIPKF-UHFFFAOYSA-N 1 2 316.470 4.440 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ncc(C(C)C)s2)C2CC2)cc1 ZINC000543397106 341041979 /nfs/dbraw/zinc/04/19/79/341041979.db2.gz ZAUYUNUFQUIPKF-UHFFFAOYSA-N 1 2 316.470 4.440 20 0 DIADLO Cc1ccccc1C1CCN(c2cc[nH+]c3ccncc32)CC1 ZINC000543484166 341046782 /nfs/dbraw/zinc/04/67/82/341046782.db2.gz UIJQCRAQKNHZFV-UHFFFAOYSA-N 1 2 303.409 4.322 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CC[C@@H](COc3ccccc3)C2)c1 ZINC000543726975 341055431 /nfs/dbraw/zinc/05/54/31/341055431.db2.gz QSSPLEPEEVBMBM-CYBMUJFWSA-N 1 2 322.330 4.006 20 0 DIADLO CCc1nc(C[N@@H+]2[C@@H](C)Cc3cc(OC)ccc3[C@@H]2C)cs1 ZINC000543781094 341058352 /nfs/dbraw/zinc/05/83/52/341058352.db2.gz MVFKXTGUNJAAFE-STQMWFEESA-N 1 2 316.470 4.222 20 0 DIADLO CCc1nc(C[N@H+]2[C@@H](C)Cc3cc(OC)ccc3[C@@H]2C)cs1 ZINC000543781094 341058353 /nfs/dbraw/zinc/05/83/53/341058353.db2.gz MVFKXTGUNJAAFE-STQMWFEESA-N 1 2 316.470 4.222 20 0 DIADLO CCc1nc(C[N@@H+]2[C@H](C)Cc3cc(OC)ccc3[C@H]2C)cs1 ZINC000543781068 341058482 /nfs/dbraw/zinc/05/84/82/341058482.db2.gz MVFKXTGUNJAAFE-CHWSQXEVSA-N 1 2 316.470 4.222 20 0 DIADLO CCc1nc(C[N@H+]2[C@H](C)Cc3cc(OC)ccc3[C@H]2C)cs1 ZINC000543781068 341058483 /nfs/dbraw/zinc/05/84/83/341058483.db2.gz MVFKXTGUNJAAFE-CHWSQXEVSA-N 1 2 316.470 4.222 20 0 DIADLO COc1cc[nH+]cc1NC(=O)C1(c2ccccc2C)CCCCC1 ZINC000072059401 341059054 /nfs/dbraw/zinc/05/90/54/341059054.db2.gz PFJLWYDYCMEEFV-UHFFFAOYSA-N 1 2 324.424 4.239 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1C[N@@H+]([C@H]2C=CCCC2)CCO1 ZINC000543806876 341059928 /nfs/dbraw/zinc/05/99/28/341059928.db2.gz DSFSWEBXDGIFHE-BBRMVZONSA-N 1 2 311.347 4.187 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1C[N@H+]([C@H]2C=CCCC2)CCO1 ZINC000543806876 341059929 /nfs/dbraw/zinc/05/99/29/341059929.db2.gz DSFSWEBXDGIFHE-BBRMVZONSA-N 1 2 311.347 4.187 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C1CCCCCC1 ZINC000072077327 341061387 /nfs/dbraw/zinc/06/13/87/341061387.db2.gz ZKFKXOOSBCQNIB-UHFFFAOYSA-N 1 2 317.820 4.435 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1c(F)cccc1N1CCCC1 ZINC000131142485 341062636 /nfs/dbraw/zinc/06/26/36/341062636.db2.gz AZIAQRMPAGZJFL-AWEZNQCLSA-N 1 2 302.393 4.212 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1c(F)cccc1N1CCCC1 ZINC000131142485 341062637 /nfs/dbraw/zinc/06/26/37/341062637.db2.gz AZIAQRMPAGZJFL-AWEZNQCLSA-N 1 2 302.393 4.212 20 0 DIADLO Clc1ccccc1[C@@H]1C[N@H+](CCCc2ccsc2)CCO1 ZINC000543957936 341064169 /nfs/dbraw/zinc/06/41/69/341064169.db2.gz NQKJVFYGIFGIQK-KRWDZBQOSA-N 1 2 321.873 4.408 20 0 DIADLO Clc1ccccc1[C@@H]1C[N@@H+](CCCc2ccsc2)CCO1 ZINC000543957936 341064170 /nfs/dbraw/zinc/06/41/70/341064170.db2.gz NQKJVFYGIFGIQK-KRWDZBQOSA-N 1 2 321.873 4.408 20 0 DIADLO Cc1cc(-c2noc(C[N@@H+]3Cc4ccccc4[C@H]3C)n2)ccc1F ZINC000543988826 341065263 /nfs/dbraw/zinc/06/52/63/341065263.db2.gz JHCGWUQXVRXBAT-CYBMUJFWSA-N 1 2 323.371 4.261 20 0 DIADLO Cc1cc(-c2noc(C[N@H+]3Cc4ccccc4[C@H]3C)n2)ccc1F ZINC000543988826 341065264 /nfs/dbraw/zinc/06/52/64/341065264.db2.gz JHCGWUQXVRXBAT-CYBMUJFWSA-N 1 2 323.371 4.261 20 0 DIADLO Cc1cccc(NC(=O)[C@@H](C)[N@@H+]2Cc3ccccc3[C@H]2C)c1C ZINC000543990200 341065418 /nfs/dbraw/zinc/06/54/18/341065418.db2.gz VGPXZRDCTNLKJA-HZPDHXFCSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1cccc(NC(=O)[C@@H](C)[N@H+]2Cc3ccccc3[C@H]2C)c1C ZINC000543990200 341065419 /nfs/dbraw/zinc/06/54/19/341065419.db2.gz VGPXZRDCTNLKJA-HZPDHXFCSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1nn(C(C)C)cc1CNc1ccc(-c2ccccc2)c[nH+]1 ZINC000544003793 341065905 /nfs/dbraw/zinc/06/59/05/341065905.db2.gz XOVKHRMDWAQQBJ-UHFFFAOYSA-N 1 2 306.413 4.447 20 0 DIADLO Cc1ccc(Cc2noc(-c3cc(C)c(F)cc3Cl)n2)c[nH+]1 ZINC000544164817 341072602 /nfs/dbraw/zinc/07/26/02/341072602.db2.gz RPVREHBVFWJDMS-UHFFFAOYSA-N 1 2 317.751 4.132 20 0 DIADLO COCC[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1ccc(C)o1 ZINC000544470468 341083586 /nfs/dbraw/zinc/08/35/86/341083586.db2.gz OKCSKAAOIOSODO-OAHLLOKOSA-N 1 2 311.784 4.248 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2ccc(Cl)cc21)c1nc(C(C)(C)C)no1 ZINC000544511171 341084593 /nfs/dbraw/zinc/08/45/93/341084593.db2.gz UYNJDJMYCULASX-QMTHXVAHSA-N 1 2 319.836 4.359 20 0 DIADLO Cc1ccc(-c2noc(CCC(C)(C)C)n2)c(N2CCCC2)[nH+]1 ZINC000544510922 341084635 /nfs/dbraw/zinc/08/46/35/341084635.db2.gz XEQSPFCLRFHSPE-UHFFFAOYSA-N 1 2 314.433 4.019 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2ccc(Cl)cc21)c1nc(C(C)(C)C)no1 ZINC000544511172 341084680 /nfs/dbraw/zinc/08/46/80/341084680.db2.gz UYNJDJMYCULASX-YGRLFVJLSA-N 1 2 319.836 4.359 20 0 DIADLO c1c2ccccc2oc1C[NH2+][C@H](c1ccccc1)c1cncnc1 ZINC000544567793 341085991 /nfs/dbraw/zinc/08/59/91/341085991.db2.gz XOHQJIPBUGNAHX-HXUWFJFHSA-N 1 2 315.376 4.102 20 0 DIADLO COc1ccc2oc([C@@H](C)[NH2+][C@@H](C)c3ccon3)c(C)c2c1 ZINC000544605072 341088337 /nfs/dbraw/zinc/08/83/37/341088337.db2.gz XVSLBCWCSSIVAD-NWDGAFQWSA-N 1 2 300.358 4.150 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCO[C@@H](c3cccs3)C2)c(F)c1 ZINC000544609865 341088823 /nfs/dbraw/zinc/08/88/23/341088823.db2.gz QQWLDMSUEQAOMS-BCMPFUBYSA-N 1 2 321.392 4.113 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCO[C@@H](c3cccs3)C2)c(F)c1 ZINC000544609865 341088824 /nfs/dbraw/zinc/08/88/24/341088824.db2.gz QQWLDMSUEQAOMS-BCMPFUBYSA-N 1 2 321.392 4.113 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCO[C@H](c3ccccc3)C2)c(F)c1 ZINC000544610627 341088886 /nfs/dbraw/zinc/08/88/86/341088886.db2.gz AARCEDJRRQFSKR-OCTSTCLRSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCO[C@H](c3ccccc3)C2)c(F)c1 ZINC000544610627 341088887 /nfs/dbraw/zinc/08/88/87/341088887.db2.gz AARCEDJRRQFSKR-OCTSTCLRSA-N 1 2 315.363 4.052 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1Cl)c1ccon1 ZINC000544615681 341089271 /nfs/dbraw/zinc/08/92/71/341089271.db2.gz VDKJFPIDOJCRKX-QMMMGPOBSA-N 1 2 304.699 4.198 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc3ccccc3n2C(F)F)s1 ZINC000072604010 341093292 /nfs/dbraw/zinc/09/32/92/341093292.db2.gz NHJLTCHSYHPPLI-UHFFFAOYSA-N 1 2 321.396 4.433 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc3ccccc3n2C(F)F)s1 ZINC000072604010 341093293 /nfs/dbraw/zinc/09/32/93/341093293.db2.gz NHJLTCHSYHPPLI-UHFFFAOYSA-N 1 2 321.396 4.433 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@@H](C)c2c(C)cccc2C)n1 ZINC000544895646 341097803 /nfs/dbraw/zinc/09/78/03/341097803.db2.gz KAZWWJBOGMJYPP-LSDHHAIUSA-N 1 2 301.434 4.441 20 0 DIADLO CCc1nn(C)c(CC)c1C[N@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000131604359 341101244 /nfs/dbraw/zinc/10/12/44/341101244.db2.gz DKHBFCPCBUQONG-GFCCVEGCSA-N 1 2 321.415 4.016 20 0 DIADLO CCc1nn(C)c(CC)c1C[N@@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000131604359 341101245 /nfs/dbraw/zinc/10/12/45/341101245.db2.gz DKHBFCPCBUQONG-GFCCVEGCSA-N 1 2 321.415 4.016 20 0 DIADLO c1cn(Cc2cccc(-c3noc([C@H]4CC45CCCC5)n3)c2)c[nH+]1 ZINC000544962447 341101413 /nfs/dbraw/zinc/10/14/13/341101413.db2.gz YXJASRIIMDLJNY-MRXNPFEDSA-N 1 2 320.396 4.029 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)Cc1ccc(Cl)cc1 ZINC000131858813 341112855 /nfs/dbraw/zinc/11/28/55/341112855.db2.gz HDYOZMOYJIAOOV-UHFFFAOYSA-N 1 2 318.804 4.094 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1nc(C(C)(C)C)no1 ZINC000073637236 341119465 /nfs/dbraw/zinc/11/94/65/341119465.db2.gz VURMNGQJILHWKL-VHSXEESVSA-N 1 2 309.360 4.057 20 0 DIADLO CC[C@H](C)c1ccc([C@@H]([NH2+]Cc2nc(C)no2)C(C)C)cc1 ZINC000073644385 341119603 /nfs/dbraw/zinc/11/96/03/341119603.db2.gz ZEZWKEXSMYBUHS-UGSOOPFHSA-N 1 2 301.434 4.378 20 0 DIADLO C[C@@H](C(=O)Nc1c[nH+]ccc1OC(C)(C)C)c1ccsc1 ZINC000132431037 341123090 /nfs/dbraw/zinc/12/30/90/341123090.db2.gz WLUVPXHORZXVJB-LLVKDONJSA-N 1 2 304.415 4.063 20 0 DIADLO CC[C@H](C)c1csc(Cc2[nH+]ccn2Cc2ccccc2)n1 ZINC000132499290 341124865 /nfs/dbraw/zinc/12/48/65/341124865.db2.gz NDOAKRYYPOGCAM-AWEZNQCLSA-N 1 2 311.454 4.492 20 0 DIADLO CC[C@@H](C)c1csc(Cc2[nH+]ccn2Cc2ccccc2)n1 ZINC000132499108 341124870 /nfs/dbraw/zinc/12/48/70/341124870.db2.gz NDOAKRYYPOGCAM-CQSZACIVSA-N 1 2 311.454 4.492 20 0 DIADLO c1csc(-c2nc(C[N@@H+]3CCc4ccsc4C3)co2)c1 ZINC000132573892 341127812 /nfs/dbraw/zinc/12/78/12/341127812.db2.gz RRZJBFHOALOKSL-UHFFFAOYSA-N 1 2 302.424 4.023 20 0 DIADLO c1csc(-c2nc(C[N@H+]3CCc4ccsc4C3)co2)c1 ZINC000132573892 341127813 /nfs/dbraw/zinc/12/78/13/341127813.db2.gz RRZJBFHOALOKSL-UHFFFAOYSA-N 1 2 302.424 4.023 20 0 DIADLO CC(C)(C)/C=C\c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000545573425 341131106 /nfs/dbraw/zinc/13/11/06/341131106.db2.gz OXMQBYWMIOMSLW-FPLPWBNLSA-N 1 2 308.385 4.041 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+]3CCc4ccsc4C3)o2)cc1 ZINC000132620286 341132899 /nfs/dbraw/zinc/13/28/99/341132899.db2.gz GEHJEYXRYFRCHZ-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+]3CCc4ccsc4C3)o2)cc1 ZINC000132620286 341132900 /nfs/dbraw/zinc/13/29/00/341132900.db2.gz GEHJEYXRYFRCHZ-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO CC(C)(C)[N@H+](Cc1ccon1)Cc1ccccc1Br ZINC000132631990 341134127 /nfs/dbraw/zinc/13/41/27/341134127.db2.gz ABOKNHNGQFLKAO-UHFFFAOYSA-N 1 2 323.234 4.238 20 0 DIADLO CC(C)(C)[N@@H+](Cc1ccon1)Cc1ccccc1Br ZINC000132631990 341134128 /nfs/dbraw/zinc/13/41/28/341134128.db2.gz ABOKNHNGQFLKAO-UHFFFAOYSA-N 1 2 323.234 4.238 20 0 DIADLO CCCC(=Cc1nc(Cc2cn3ccccc3[nH+]2)no1)CCC ZINC000545630637 341133851 /nfs/dbraw/zinc/13/38/51/341133851.db2.gz PJVZTNZLYPZLJF-UHFFFAOYSA-N 1 2 310.401 4.292 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc(CCC2CCCCC2)no1 ZINC000545630713 341133933 /nfs/dbraw/zinc/13/39/33/341133933.db2.gz KSPZHZJTXXQZHW-UHFFFAOYSA-N 1 2 324.428 4.289 20 0 DIADLO CCC[C@H](C)Cc1nc(-c2ccc(C)[nH+]c2N2CCCC2)no1 ZINC000545666664 341135433 /nfs/dbraw/zinc/13/54/33/341135433.db2.gz PCSUYYJBFXIHBI-ZDUSSCGKSA-N 1 2 314.433 4.019 20 0 DIADLO CCC[C@@H](C)Cc1nc(-c2ccc(C)[nH+]c2N2CCCC2)no1 ZINC000545666663 341135517 /nfs/dbraw/zinc/13/55/17/341135517.db2.gz PCSUYYJBFXIHBI-CYBMUJFWSA-N 1 2 314.433 4.019 20 0 DIADLO C[C@@H]1CCCC[C@@H]1c1noc(CCc2[nH]c3ccccc3[nH+]2)n1 ZINC000545686755 341136279 /nfs/dbraw/zinc/13/62/79/341136279.db2.gz KLAVYIXZYCLEFR-OLZOCXBDSA-N 1 2 310.401 4.025 20 0 DIADLO CCc1cc(C)c(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)o1 ZINC000545693428 341136712 /nfs/dbraw/zinc/13/67/12/341136712.db2.gz WBXYQJRKKXZYQC-UHFFFAOYSA-N 1 2 320.352 4.053 20 0 DIADLO CC[C@@H](C)c1ccc([C@H]([NH2+]Cc2noc(C)n2)C(C)C)cc1 ZINC000132711906 341143178 /nfs/dbraw/zinc/14/31/78/341143178.db2.gz PXTSQPLYCWPIFJ-FZKQIMNGSA-N 1 2 301.434 4.378 20 0 DIADLO FC(F)(F)CCCC[N@@H+]1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000132754024 341144651 /nfs/dbraw/zinc/14/46/51/341144651.db2.gz KGLLPTDYRSDYAA-CQSZACIVSA-N 1 2 321.770 4.446 20 0 DIADLO FC(F)(F)CCCC[N@H+]1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000132754024 341144652 /nfs/dbraw/zinc/14/46/52/341144652.db2.gz KGLLPTDYRSDYAA-CQSZACIVSA-N 1 2 321.770 4.446 20 0 DIADLO CCc1ccc(C[NH2+]Cc2ncc(-c3ccccc3)cn2)s1 ZINC000545894836 341144808 /nfs/dbraw/zinc/14/48/08/341144808.db2.gz RSTWUWOTFTUKJS-UHFFFAOYSA-N 1 2 309.438 4.057 20 0 DIADLO CCn1ccnc1CNc1[nH+]cccc1O[C@@H](C)c1ccccc1 ZINC000545927227 341146585 /nfs/dbraw/zinc/14/65/85/341146585.db2.gz RZLZRCQZLQFOJK-HNNXBMFYSA-N 1 2 322.412 4.050 20 0 DIADLO COCC[C@H](C)Nc1ccc(SCc2ccccc2)c[nH+]1 ZINC000545954661 341148351 /nfs/dbraw/zinc/14/83/51/341148351.db2.gz OXBZDXRAQDZBIV-AWEZNQCLSA-N 1 2 302.443 4.211 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H]2COc3ccc(F)cc32)cs1 ZINC000545986119 341149833 /nfs/dbraw/zinc/14/98/33/341149833.db2.gz JQVMWDKNHMOUBN-ZWNOBZJWSA-N 1 2 306.406 4.190 20 0 DIADLO Cc1cc(OCc2nc(-c3ccoc3)no2)c2cccc(C)c2[nH+]1 ZINC000546180471 341156289 /nfs/dbraw/zinc/15/62/89/341156289.db2.gz DFBKZFLJDGBFLL-UHFFFAOYSA-N 1 2 321.336 4.074 20 0 DIADLO c1ccc(COc2ccc[nH+]c2N[C@@H]2CCOC3(CCC3)C2)cc1 ZINC000546180899 341156371 /nfs/dbraw/zinc/15/63/71/341156371.db2.gz AWMIAWVAWGRBII-QGZVFWFLSA-N 1 2 324.424 4.174 20 0 DIADLO C[C@H]1CC/C(=C/c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)C1 ZINC000546284919 341161107 /nfs/dbraw/zinc/16/11/07/341161107.db2.gz NQVVURCYYZWXPA-XFNCEPBJSA-N 1 2 320.396 4.185 20 0 DIADLO CC(C)C[C@H](C)Cc1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000546285529 341161194 /nfs/dbraw/zinc/16/11/94/341161194.db2.gz ZIOYWCBOVXKJCB-HNNXBMFYSA-N 1 2 324.428 4.206 20 0 DIADLO Cc1ccc(Cc2noc(-c3cc4sccc4s3)n2)c[nH+]1 ZINC000546347653 341164500 /nfs/dbraw/zinc/16/45/00/341164500.db2.gz SZURBICCWXIKSQ-UHFFFAOYSA-N 1 2 313.407 4.307 20 0 DIADLO Cc1ccc(Cc2noc([C@@H](c3ccccc3)C(C)C)n2)c[nH+]1 ZINC000546346619 341164526 /nfs/dbraw/zinc/16/45/26/341164526.db2.gz NYURUWSDDKQCES-GOSISDBHSA-N 1 2 307.397 4.152 20 0 DIADLO Cc1ccc(-c2noc(/C=C3\CC[C@@H](C)C3)n2)c(N2CCCC2)[nH+]1 ZINC000546368184 341165269 /nfs/dbraw/zinc/16/52/69/341165269.db2.gz PGTDJCJWWIAQMY-MLJWKTOOSA-N 1 2 324.428 4.244 20 0 DIADLO Cc1ccc(-c2noc(/C=C3\CC[C@H](C)C3)n2)c(N2CCCC2)[nH+]1 ZINC000546368185 341165327 /nfs/dbraw/zinc/16/53/27/341165327.db2.gz PGTDJCJWWIAQMY-UESPBHMZSA-N 1 2 324.428 4.244 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc(-c2cc(C)cc(C)c2)no1 ZINC000546400614 341166763 /nfs/dbraw/zinc/16/67/63/341166763.db2.gz XCWNCOCXTVIAKN-UHFFFAOYSA-N 1 2 318.380 4.060 20 0 DIADLO CC1(C)CCC(C)(C[NH2+][C@@H](c2cccs2)c2nnc[nH]2)CC1 ZINC000564305684 341175638 /nfs/dbraw/zinc/17/56/38/341175638.db2.gz RNRFDDPQBXILEK-AWEZNQCLSA-N 1 2 318.490 4.152 20 0 DIADLO CC1(C)C[C@H](Nc2[nH+]cccc2OCc2ccccc2)CCO1 ZINC000546635849 341176527 /nfs/dbraw/zinc/17/65/27/341176527.db2.gz FBQIUDIGBHAFCF-MRXNPFEDSA-N 1 2 312.413 4.030 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](Cc2nc3ccccc3o2)[C@H](C)CO1 ZINC000075784574 341182756 /nfs/dbraw/zinc/18/27/56/341182756.db2.gz LOHFTMOALMRVRZ-DNVCBOLYSA-N 1 2 322.408 4.098 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2nc3ccccc3o2)[C@H](C)CO1 ZINC000075784574 341182757 /nfs/dbraw/zinc/18/27/57/341182757.db2.gz LOHFTMOALMRVRZ-DNVCBOLYSA-N 1 2 322.408 4.098 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)Cc2cc(C)cc(C)c2)cs1 ZINC000075887847 341188389 /nfs/dbraw/zinc/18/83/89/341188389.db2.gz SNELYQRISFPYNI-HNNXBMFYSA-N 1 2 318.486 4.489 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)Cc2cc(C)cc(C)c2)cs1 ZINC000075887847 341188390 /nfs/dbraw/zinc/18/83/90/341188390.db2.gz SNELYQRISFPYNI-HNNXBMFYSA-N 1 2 318.486 4.489 20 0 DIADLO CCCCc1nc(C[NH+]2CCC(C(F)(F)F)CC2)cs1 ZINC000075969423 341193620 /nfs/dbraw/zinc/19/36/20/341193620.db2.gz ZCTKUBWXLZDKMU-UHFFFAOYSA-N 1 2 306.397 4.260 20 0 DIADLO Cc1ccc(N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)c[nH+]1 ZINC000133855982 341194266 /nfs/dbraw/zinc/19/42/66/341194266.db2.gz VYKSHCJARBAODC-OAHLLOKOSA-N 1 2 307.319 4.293 20 0 DIADLO Cc1ccc(-c2noc([C@@H](C)C(C)(C)C)n2)c(N2CCCC2)[nH+]1 ZINC000547076165 341194706 /nfs/dbraw/zinc/19/47/06/341194706.db2.gz BGPNGZJOSILLLX-CYBMUJFWSA-N 1 2 314.433 4.190 20 0 DIADLO CCC(CC)c1noc(CCn2c3ccccc3[nH+]c2C2CC2)n1 ZINC000547083692 341195015 /nfs/dbraw/zinc/19/50/15/341195015.db2.gz RLGJYONJBNBNKC-UHFFFAOYSA-N 1 2 324.428 4.443 20 0 DIADLO Cc1cccn2cc(Cc3noc(C4(CC(C)C)CCC4)n3)[nH+]c12 ZINC000547095713 341195743 /nfs/dbraw/zinc/19/57/43/341195743.db2.gz BTLNNKKCRXKWIV-UHFFFAOYSA-N 1 2 324.428 4.084 20 0 DIADLO C=Cc1ccc(C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)cc1 ZINC000547298365 341203950 /nfs/dbraw/zinc/20/39/50/341203950.db2.gz ZAIYPNBBQZNXEH-UHFFFAOYSA-N 1 2 317.392 4.346 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)nc1 ZINC000134299465 341212455 /nfs/dbraw/zinc/21/24/55/341212455.db2.gz QXNADHWKBAQUAY-CQSZACIVSA-N 1 2 309.438 4.364 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)[C@@H](C)c2ccccc2)cs1 ZINC000076716645 341212873 /nfs/dbraw/zinc/21/28/73/341212873.db2.gz FDWJDTACGHQPOC-KBPBESRZSA-N 1 2 304.459 4.434 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)[C@@H](C)c2ccccc2)cs1 ZINC000076716645 341212874 /nfs/dbraw/zinc/21/28/74/341212874.db2.gz FDWJDTACGHQPOC-KBPBESRZSA-N 1 2 304.459 4.434 20 0 DIADLO COc1ccc(C[NH2+][C@H](C)c2csc(C(C)C)n2)cc1F ZINC000076900201 341215394 /nfs/dbraw/zinc/21/53/94/341215394.db2.gz MZJSRLRARLYJJT-LLVKDONJSA-N 1 2 308.422 4.265 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)Nc3cc(C)cc(C)c3)ccc2n1C ZINC000547506093 341218681 /nfs/dbraw/zinc/21/86/81/341218681.db2.gz QUCDRQBPQPLUSN-UHFFFAOYSA-N 1 2 308.385 4.143 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc(F)cc3C)CCCCCC2)no1 ZINC000547506732 341218812 /nfs/dbraw/zinc/21/88/12/341218812.db2.gz KUFXSKVHUUCFME-UHFFFAOYSA-N 1 2 317.408 4.165 20 0 DIADLO CC(C)(C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1)c1cccs1 ZINC000134808329 341224559 /nfs/dbraw/zinc/22/45/59/341224559.db2.gz MFWAYBUILPZREM-UHFFFAOYSA-N 1 2 311.410 4.055 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cccc3c2OC(C)(C)C3)s1 ZINC000134910913 341226664 /nfs/dbraw/zinc/22/66/64/341226664.db2.gz NGDDFBXNEIPZNT-GFCCVEGCSA-N 1 2 302.443 4.016 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(Br)c(C)c2)c(C)[nH+]1 ZINC000135501173 341241104 /nfs/dbraw/zinc/24/11/04/341241104.db2.gz SJPAOGTXSJURIO-UHFFFAOYSA-N 1 2 319.202 4.022 20 0 DIADLO CCC(=O)c1cccc(NCc2[nH+]ccn2Cc2ccccc2)c1 ZINC000135714862 341244729 /nfs/dbraw/zinc/24/47/29/341244729.db2.gz LPBNQKWVSRAHGY-UHFFFAOYSA-N 1 2 319.408 4.136 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)c(F)cc1F)c1ccc(F)cc1F ZINC000135810682 341246385 /nfs/dbraw/zinc/24/63/85/341246385.db2.gz DQLXGRXFFOHNEI-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO COC(=O)c1ccc2ccccc2c1OCc1ccc(C)[nH+]c1C ZINC000548142373 341249135 /nfs/dbraw/zinc/24/91/35/341249135.db2.gz HVBNKNDFFAKFAX-UHFFFAOYSA-N 1 2 321.376 4.217 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c(OC)c1 ZINC000078968810 341250856 /nfs/dbraw/zinc/25/08/56/341250856.db2.gz QRDJXLLLXYLTSS-RYUDHWBXSA-N 1 2 321.367 4.394 20 0 DIADLO CCc1nc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)cs1 ZINC000136130761 341253488 /nfs/dbraw/zinc/25/34/88/341253488.db2.gz KYWUTABRGZNAFA-UHFFFAOYSA-N 1 2 308.397 4.153 20 0 DIADLO Cc1ccc(-c2ccc(C)c(NC(=O)[C@H](C)Cc3c[nH+]c[nH]3)c2)o1 ZINC000564350268 341259870 /nfs/dbraw/zinc/25/98/70/341259870.db2.gz LQPOTZFCYYRAGI-CYBMUJFWSA-N 1 2 323.396 4.104 20 0 DIADLO Cc1ccc(-c2ccc(C)c(NC(=O)[C@H](C)Cc3c[nH]c[nH+]3)c2)o1 ZINC000564350268 341259871 /nfs/dbraw/zinc/25/98/71/341259871.db2.gz LQPOTZFCYYRAGI-CYBMUJFWSA-N 1 2 323.396 4.104 20 0 DIADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1cc(Br)ccc1OC(F)F ZINC000548425906 341259984 /nfs/dbraw/zinc/25/99/84/341259984.db2.gz OYQRGFZDEJWWGR-DTORHVGOSA-N 1 2 320.177 4.033 20 0 DIADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cc(Br)ccc1OC(F)F ZINC000548425906 341259985 /nfs/dbraw/zinc/25/99/85/341259985.db2.gz OYQRGFZDEJWWGR-DTORHVGOSA-N 1 2 320.177 4.033 20 0 DIADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1cccc(Br)c1OC(F)F ZINC000548426233 341260098 /nfs/dbraw/zinc/26/00/98/341260098.db2.gz CPCCAPVHNNDYGX-RKDXNWHRSA-N 1 2 320.177 4.033 20 0 DIADLO Cc1cc(NC(=O)N2CCCC[C@H]2c2[nH]cc[nH+]2)ccc1C1CC1 ZINC000548501093 341264301 /nfs/dbraw/zinc/26/43/01/341264301.db2.gz FLYCQEZTKGKBTA-KRWDZBQOSA-N 1 2 324.428 4.355 20 0 DIADLO COC[C@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1ccc(C)o1 ZINC000080238776 341271275 /nfs/dbraw/zinc/27/12/75/341271275.db2.gz RLCLPQCJGPBUOZ-AWEZNQCLSA-N 1 2 314.212 4.372 20 0 DIADLO C[C@@H]1C[C@H](C)[N@H+]1CC(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000548752655 341272192 /nfs/dbraw/zinc/27/21/92/341272192.db2.gz QYLHGBLQKFIPTG-OCAPTIKFSA-N 1 2 321.635 4.068 20 0 DIADLO C[C@@H]1C[C@H](C)[N@@H+]1CC(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000548752655 341272193 /nfs/dbraw/zinc/27/21/93/341272193.db2.gz QYLHGBLQKFIPTG-OCAPTIKFSA-N 1 2 321.635 4.068 20 0 DIADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000548754182 341272313 /nfs/dbraw/zinc/27/23/13/341272313.db2.gz VYURXTYPLYTFEN-TXEJJXNPSA-N 1 2 322.861 4.358 20 0 DIADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000548754182 341272314 /nfs/dbraw/zinc/27/23/14/341272314.db2.gz VYURXTYPLYTFEN-TXEJJXNPSA-N 1 2 322.861 4.358 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000548787029 341275625 /nfs/dbraw/zinc/27/56/25/341275625.db2.gz WNUOVRCRCKNODT-JQWIXIFHSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000548787029 341275626 /nfs/dbraw/zinc/27/56/26/341275626.db2.gz WNUOVRCRCKNODT-JQWIXIFHSA-N 1 2 323.305 4.069 20 0 DIADLO c1cc(N[C@H]2CCC23CCOCC3)cc([NH+]2CCCCCC2)c1 ZINC000548793584 341275869 /nfs/dbraw/zinc/27/58/69/341275869.db2.gz LARBLDZMCDLGRP-IBGZPJMESA-N 1 2 314.473 4.438 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccccc2OC(C)C)s1 ZINC000548916922 341280765 /nfs/dbraw/zinc/28/07/65/341280765.db2.gz ODDBMTCEOPOGDD-NWDGAFQWSA-N 1 2 305.447 4.046 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1cc(-c2ccccc2)n[nH]1 ZINC000548921757 341281205 /nfs/dbraw/zinc/28/12/05/341281205.db2.gz PLNWJHGFYIKELD-UHFFFAOYSA-N 1 2 322.412 4.261 20 0 DIADLO CCc1cc(N2CC(C)(C)[C@H]3CCC[C@H]32)nc(-c2ccncc2)[nH+]1 ZINC000549267592 341290037 /nfs/dbraw/zinc/29/00/37/341290037.db2.gz LTSMLWLHSWYKSU-DLBZAZTESA-N 1 2 322.456 4.116 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2ccc(C(C)C)nc2CC)cs1 ZINC000549770690 341302795 /nfs/dbraw/zinc/30/27/95/341302795.db2.gz YFZBHIWFIWFTGE-UHFFFAOYSA-N 1 2 317.502 4.418 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2ccc(C(C)C)nc2CC)cs1 ZINC000549770690 341302796 /nfs/dbraw/zinc/30/27/96/341302796.db2.gz YFZBHIWFIWFTGE-UHFFFAOYSA-N 1 2 317.502 4.418 20 0 DIADLO c1nc(C[N@@H+]2CCc3ccccc3[C@H]2c2ccccc2)cs1 ZINC000549960878 341307915 /nfs/dbraw/zinc/30/79/15/341307915.db2.gz CFVACCFOOGJCPB-LJQANCHMSA-N 1 2 306.434 4.291 20 0 DIADLO c1nc(C[N@H+]2CCc3ccccc3[C@H]2c2ccccc2)cs1 ZINC000549960878 341307916 /nfs/dbraw/zinc/30/79/16/341307916.db2.gz CFVACCFOOGJCPB-LJQANCHMSA-N 1 2 306.434 4.291 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)[C@H](C)C(C)(F)F)cc2[nH+]1 ZINC000550198431 341312251 /nfs/dbraw/zinc/31/22/51/341312251.db2.gz ZKPKDTKOYYRZCF-JTQLQIEISA-N 1 2 309.360 4.135 20 0 DIADLO C[N@H+](Cc1cccc(OC(F)F)c1)Cc1c(F)cccc1F ZINC000550331698 341315333 /nfs/dbraw/zinc/31/53/33/341315333.db2.gz XYDBYBXCZBHMTO-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO C[N@@H+](Cc1cccc(OC(F)F)c1)Cc1c(F)cccc1F ZINC000550331698 341315334 /nfs/dbraw/zinc/31/53/34/341315334.db2.gz XYDBYBXCZBHMTO-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO C[C@@H]1C[C@H]1[C@@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000245860379 341316478 /nfs/dbraw/zinc/31/64/78/341316478.db2.gz HVAYRIJNDZYEIR-HQQWDMGQSA-N 1 2 317.820 4.087 20 0 DIADLO Cc1nc([C@H]([NH2+][C@H]2CCC[C@@H](C)C2)c2ccc(Cl)cc2)no1 ZINC000245968028 341320209 /nfs/dbraw/zinc/32/02/09/341320209.db2.gz ZHGSHRHCMGDEHA-XFBWCDHKSA-N 1 2 319.836 4.289 20 0 DIADLO CC(C)C1CCC(C[NH2+][C@H](c2cccs2)c2nnc[nH]2)CC1 ZINC000550699859 341321676 /nfs/dbraw/zinc/32/16/76/341321676.db2.gz PGKARKPDALYIDM-ZBCRRDGASA-N 1 2 318.490 4.008 20 0 DIADLO COc1cccc(C[C@@H]([NH2+]CC(C)(F)F)c2ccccc2)c1 ZINC000550875456 341325168 /nfs/dbraw/zinc/32/51/68/341325168.db2.gz RGTFYXSIYJLXNT-QGZVFWFLSA-N 1 2 305.368 4.224 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccnc(O[C@H](C)CC(C)C)c2)no1 ZINC000550887539 341325857 /nfs/dbraw/zinc/32/58/57/341325857.db2.gz RXWGWEJOAGGEEJ-HIFRSBDPSA-N 1 2 317.433 4.042 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccc(Br)s2)no1 ZINC000550909522 341326532 /nfs/dbraw/zinc/32/65/32/341326532.db2.gz ABCVSQUUVQITHT-DTWKUNHWSA-N 1 2 315.236 4.219 20 0 DIADLO Fc1ccccc1C[NH2+]Cc1c(F)cccc1OC(F)(F)F ZINC000551202520 341333803 /nfs/dbraw/zinc/33/38/03/341333803.db2.gz DARNZNYLABBQDX-UHFFFAOYSA-N 1 2 317.257 4.153 20 0 DIADLO C[C@@H]1CC=CC[C@H]1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000551207232 341333979 /nfs/dbraw/zinc/33/39/79/341333979.db2.gz VFWISQKPENPIBA-RDTXWAMCSA-N 1 2 308.381 4.415 20 0 DIADLO c1ccc(-c2nc(C[N@@H+]3CCC=C(c4ccccc4)C3)no2)cc1 ZINC000551707538 341349621 /nfs/dbraw/zinc/34/96/21/341349621.db2.gz MQUXRFMBLVLHTM-UHFFFAOYSA-N 1 2 317.392 4.026 20 0 DIADLO c1ccc(-c2nc(C[N@H+]3CCC=C(c4ccccc4)C3)no2)cc1 ZINC000551707538 341349622 /nfs/dbraw/zinc/34/96/22/341349622.db2.gz MQUXRFMBLVLHTM-UHFFFAOYSA-N 1 2 317.392 4.026 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(-c2ccccc2)s1)c1cscn1 ZINC000551917705 341354822 /nfs/dbraw/zinc/35/48/22/341354822.db2.gz YNXOUVYLZZBMSF-NSHDSACASA-N 1 2 301.440 4.117 20 0 DIADLO Cc1cc(NC(=O)[C@H](c2cccc(Cl)c2)C(C)C)c(C)c[nH+]1 ZINC000551957756 341356142 /nfs/dbraw/zinc/35/61/42/341356142.db2.gz ACIXSEVYDKDNDC-KRWDZBQOSA-N 1 2 316.832 4.152 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247311035 341363255 /nfs/dbraw/zinc/36/32/55/341363255.db2.gz IHIQRBSIYYUTDS-XHDPSFHLSA-N 1 2 309.381 4.161 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247311035 341363256 /nfs/dbraw/zinc/36/32/56/341363256.db2.gz IHIQRBSIYYUTDS-XHDPSFHLSA-N 1 2 309.381 4.161 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+]2CCO[C@H](c3cccc(F)c3)C2)o1 ZINC000552033126 341363331 /nfs/dbraw/zinc/36/33/31/341363331.db2.gz NPUXNIWMRCKTIM-FMEYXAORSA-N 1 2 315.388 4.116 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CCO[C@H](c3cccc(F)c3)C2)o1 ZINC000552033126 341363332 /nfs/dbraw/zinc/36/33/32/341363332.db2.gz NPUXNIWMRCKTIM-FMEYXAORSA-N 1 2 315.388 4.116 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@@H]2c2cccc(C)n2)s1 ZINC000552050960 341365264 /nfs/dbraw/zinc/36/52/64/341365264.db2.gz RSNGTPOKGKYWSK-OAHLLOKOSA-N 1 2 319.499 4.047 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@@H]2c2cccc(C)n2)s1 ZINC000552050960 341365265 /nfs/dbraw/zinc/36/52/65/341365265.db2.gz RSNGTPOKGKYWSK-OAHLLOKOSA-N 1 2 319.499 4.047 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@H]2c2cccc(C)n2)s1 ZINC000552050959 341365267 /nfs/dbraw/zinc/36/52/67/341365267.db2.gz RSNGTPOKGKYWSK-HNNXBMFYSA-N 1 2 319.499 4.047 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@H]2c2cccc(C)n2)s1 ZINC000552050959 341365268 /nfs/dbraw/zinc/36/52/68/341365268.db2.gz RSNGTPOKGKYWSK-HNNXBMFYSA-N 1 2 319.499 4.047 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2nc3ccccc3o2)[C@@H](C)CO1 ZINC000247499271 341365888 /nfs/dbraw/zinc/36/58/88/341365888.db2.gz LOHFTMOALMRVRZ-KXBFYZLASA-N 1 2 322.408 4.098 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2nc3ccccc3o2)[C@@H](C)CO1 ZINC000247499271 341365889 /nfs/dbraw/zinc/36/58/89/341365889.db2.gz LOHFTMOALMRVRZ-KXBFYZLASA-N 1 2 322.408 4.098 20 0 DIADLO Cc1c(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)cnn1CC(C)C ZINC000552065793 341366814 /nfs/dbraw/zinc/36/68/14/341366814.db2.gz OFSYXXIANQEDEN-KRWDZBQOSA-N 1 2 315.465 4.304 20 0 DIADLO Clc1ccccc1C[N@@H+](Cc1nnc(C2CC2)o1)CC1CC1 ZINC000552096395 341369475 /nfs/dbraw/zinc/36/94/75/341369475.db2.gz NTXAZGQMORQDCC-UHFFFAOYSA-N 1 2 317.820 4.013 20 0 DIADLO Clc1ccccc1C[N@H+](Cc1nnc(C2CC2)o1)CC1CC1 ZINC000552096395 341369476 /nfs/dbraw/zinc/36/94/76/341369476.db2.gz NTXAZGQMORQDCC-UHFFFAOYSA-N 1 2 317.820 4.013 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H]1CC2CCC1CC2 ZINC000552111217 341370530 /nfs/dbraw/zinc/37/05/30/341370530.db2.gz GVGUJZHSDMYGNQ-XUJLQICISA-N 1 2 309.413 4.150 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)[C@H](CC)c2ccccc2)n1 ZINC000247966426 341371501 /nfs/dbraw/zinc/37/15/01/341371501.db2.gz GWIXINJFGDTDKU-DZGCQCFKSA-N 1 2 319.474 4.467 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)[C@H](CC)c2ccccc2)n1 ZINC000247966426 341371502 /nfs/dbraw/zinc/37/15/02/341371502.db2.gz GWIXINJFGDTDKU-DZGCQCFKSA-N 1 2 319.474 4.467 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)[C@@H](CC)c2ccccc2)n1 ZINC000247966429 341371561 /nfs/dbraw/zinc/37/15/61/341371561.db2.gz GWIXINJFGDTDKU-ZFWWWQNUSA-N 1 2 319.474 4.467 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)[C@@H](CC)c2ccccc2)n1 ZINC000247966429 341371562 /nfs/dbraw/zinc/37/15/62/341371562.db2.gz GWIXINJFGDTDKU-ZFWWWQNUSA-N 1 2 319.474 4.467 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)s1 ZINC000564388687 341375814 /nfs/dbraw/zinc/37/58/14/341375814.db2.gz NZXDAUCZURNVFD-UHFFFAOYSA-N 1 2 320.364 4.280 20 0 DIADLO C[NH+](C)[C@H](C(=O)Nc1ccccc1Cl)c1cccc(Cl)c1 ZINC000552250752 341381300 /nfs/dbraw/zinc/38/13/00/341381300.db2.gz ZQCSAJDKPJWQLF-HNNXBMFYSA-N 1 2 323.223 4.235 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1csc([C@H](C)OC)n1 ZINC000248640673 341382576 /nfs/dbraw/zinc/38/25/76/341382576.db2.gz YCSSLADYUOKMBW-GUYCJALGSA-N 1 2 316.470 4.187 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1csc([C@H](C)OC)n1 ZINC000248640673 341382577 /nfs/dbraw/zinc/38/25/77/341382577.db2.gz YCSSLADYUOKMBW-GUYCJALGSA-N 1 2 316.470 4.187 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(F)cc(Cl)c2)[C@H]1c1ccncc1 ZINC000552279588 341383716 /nfs/dbraw/zinc/38/37/16/341383716.db2.gz VLFORGXVRSXVMU-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(F)cc(Cl)c2)[C@H]1c1ccncc1 ZINC000552279588 341383717 /nfs/dbraw/zinc/38/37/17/341383717.db2.gz VLFORGXVRSXVMU-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc(C(F)(F)F)cs2)cc1C ZINC000552305578 341385542 /nfs/dbraw/zinc/38/55/42/341385542.db2.gz MYDFMTWEHSQKSU-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc(C(F)(F)F)cs2)cc1C ZINC000552305578 341385543 /nfs/dbraw/zinc/38/55/43/341385543.db2.gz MYDFMTWEHSQKSU-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)Cc1coc2ccccc12 ZINC000552376071 341389930 /nfs/dbraw/zinc/38/99/30/341389930.db2.gz UVUJSYZPRNPHOA-UHFFFAOYSA-N 1 2 324.380 4.186 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cc[nH]c1C(C)C ZINC000552551998 341398458 /nfs/dbraw/zinc/39/84/58/341398458.db2.gz JVEVYHVDYOHCCH-UHFFFAOYSA-N 1 2 308.385 4.089 20 0 DIADLO Cc1ccc(F)cc1C(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000089868963 341410242 /nfs/dbraw/zinc/41/02/42/341410242.db2.gz DPBICDABVIGRDJ-UHFFFAOYSA-N 1 2 323.371 4.151 20 0 DIADLO CCOC[C@H]1CCCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000553096245 341415684 /nfs/dbraw/zinc/41/56/84/341415684.db2.gz FLWIKNJQPNBLTN-ZDUSSCGKSA-N 1 2 304.821 4.141 20 0 DIADLO Cc1nc(N2CCC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc[nH+]1 ZINC000553244403 341421736 /nfs/dbraw/zinc/42/17/36/341421736.db2.gz VIVDGQHRWNQCSD-CQSZACIVSA-N 1 2 321.346 4.188 20 0 DIADLO Clc1cccc2c(N3CCC[C@@H](OCC4CC4)C3)cc[nH+]c12 ZINC000553540701 341431426 /nfs/dbraw/zinc/43/14/26/341431426.db2.gz GUSRUBNYKLIRIK-CQSZACIVSA-N 1 2 316.832 4.284 20 0 DIADLO COC[C@@H]([NH2+]Cc1ccccc1F)c1cccc(Cl)c1F ZINC000554049603 341441657 /nfs/dbraw/zinc/44/16/57/341441657.db2.gz UKLPFBCGEDVXFU-OAHLLOKOSA-N 1 2 311.759 4.096 20 0 DIADLO Cc1cc(N2CCSCC2)ccc1[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000554087351 341443445 /nfs/dbraw/zinc/44/34/45/341443445.db2.gz BUUFCHBGSLPCKV-AEFFLSMTSA-N 1 2 302.487 4.149 20 0 DIADLO c1[nH+]c(-c2ccc(N[C@H]3CC[C@H]3C3CC3)cc2)n2c1CCCC2 ZINC000554372541 341451942 /nfs/dbraw/zinc/45/19/42/341451942.db2.gz NQORHOCNAMGUPK-OALUTQOASA-N 1 2 307.441 4.487 20 0 DIADLO FC(F)(F)CCc1ccc(NCc2cn3ccccc3[nH+]2)cc1 ZINC000554645038 341460547 /nfs/dbraw/zinc/46/05/47/341460547.db2.gz WTWHZYDPPZUGIX-UHFFFAOYSA-N 1 2 319.330 4.441 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@H](C)c2ccncc2F)c2ccccn2)cc1 ZINC000556245063 341499113 /nfs/dbraw/zinc/49/91/13/341499113.db2.gz MAASNHIPWAJJSM-QRWLVFNGSA-N 1 2 321.399 4.364 20 0 DIADLO c1sc(-c2ccccc2)nc1C[NH2+][C@H]1COCc2ccccc21 ZINC000556260104 341499717 /nfs/dbraw/zinc/49/97/17/341499717.db2.gz BYJGWHAWGKXWAX-SFHVURJKSA-N 1 2 322.433 4.171 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2cc(C)no2)c2ccc(C)cc2)cc1 ZINC000565394590 341526030 /nfs/dbraw/zinc/52/60/30/341526030.db2.gz KNGOCGVPWBDDAG-HXUWFJFHSA-N 1 2 322.408 4.179 20 0 DIADLO CCCCc1noc([C@H](C)SCCc2cccc(C)[nH+]2)n1 ZINC000566068951 341546916 /nfs/dbraw/zinc/54/69/16/341546916.db2.gz MIQGPLURISOWSB-ZDUSSCGKSA-N 1 2 305.447 4.153 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1cc(F)ccc1Cl ZINC000566633649 341563794 /nfs/dbraw/zinc/56/37/94/341563794.db2.gz UYMGCEWUNBTIJG-INIZCTEOSA-N 1 2 321.827 4.423 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1nnc(C2CC2)s1 ZINC000567122159 341581479 /nfs/dbraw/zinc/58/14/79/341581479.db2.gz UQXDXHXEQSLVGT-LLVKDONJSA-N 1 2 313.426 4.321 20 0 DIADLO Cc1cc2[nH+]cn(Cc3nc(C(F)(F)F)cs3)c2cc1C ZINC000154164271 341585797 /nfs/dbraw/zinc/58/57/97/341585797.db2.gz JIVARCPITXEDMQ-UHFFFAOYSA-N 1 2 311.332 4.177 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1cc(F)cc(F)c1 ZINC000154805095 341596223 /nfs/dbraw/zinc/59/62/23/341596223.db2.gz HJDZVYXMDUTDKX-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO c1ccc([C@@H]([NH2+]Cc2nc(C3CCCC3)no2)C2CCC2)cc1 ZINC000157149911 341633246 /nfs/dbraw/zinc/63/32/46/341633246.db2.gz JHSKUTIJGGBOMI-GOSISDBHSA-N 1 2 311.429 4.358 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2c(Cl)cccc2Cl)s1 ZINC000273618931 341636687 /nfs/dbraw/zinc/63/66/87/341636687.db2.gz QCIFITOSHUNKAD-SSDOTTSWSA-N 1 2 302.230 4.004 20 0 DIADLO Cc1cc(N[C@@H](C[C@@H]2CCOC2)c2ccccc2)nc(C2CC2)[nH+]1 ZINC000157958898 341648405 /nfs/dbraw/zinc/64/84/05/341648405.db2.gz QROJXBGGBSEPRP-YJBOKZPZSA-N 1 2 323.440 4.242 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1coc(-c2ccccc2)n1 ZINC000158885925 341665890 /nfs/dbraw/zinc/66/58/90/341665890.db2.gz OSMLYGXKRWHLAA-UHFFFAOYSA-N 1 2 318.380 4.323 20 0 DIADLO CC(C)(C)CN(CC(C)(C)C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000568806900 341682226 /nfs/dbraw/zinc/68/22/26/341682226.db2.gz MAJAQVCZWBCZKZ-UHFFFAOYSA-N 1 2 316.449 4.260 20 0 DIADLO Cc1[nH]c(CNc2ccc(C)c(OCCC(C)C)c2)[nH+]c1C ZINC000569002033 341687879 /nfs/dbraw/zinc/68/78/79/341687879.db2.gz UPRVQQQOUBHHGJ-UHFFFAOYSA-N 1 2 301.434 4.372 20 0 DIADLO Cc1cc[nH+]c(N[C@H]2CCCC(F)(F)C2)c1Br ZINC000569016479 341688349 /nfs/dbraw/zinc/68/83/49/341688349.db2.gz ZMMQHRRWBIJQDU-VIFPVBQESA-N 1 2 305.166 4.142 20 0 DIADLO Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1noc(Cc2ccccc2)n1 ZINC000165419552 341711866 /nfs/dbraw/zinc/71/18/66/341711866.db2.gz XWGZNSWVVSHAQC-HOTGVXAUSA-N 1 2 321.424 4.381 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ncc(-c2ccccc2)s1 ZINC000573283232 341723552 /nfs/dbraw/zinc/72/35/52/341723552.db2.gz DMZWQEFKLCHORP-ORAYPTAESA-N 1 2 322.433 4.422 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1F)c1cscn1 ZINC000575430672 341798106 /nfs/dbraw/zinc/79/81/06/341798106.db2.gz GCMGWKQFKFUCQB-QMMMGPOBSA-N 1 2 304.312 4.152 20 0 DIADLO COC[C@@H]([NH2+]Cc1cc2cc(C)c(C)cc2o1)c1ccc(C)o1 ZINC000174978999 341833404 /nfs/dbraw/zinc/83/34/04/341833404.db2.gz JAHCXPQKKXUTGH-QGZVFWFLSA-N 1 2 313.397 4.428 20 0 DIADLO CC(C)C(=O)Nc1cccc(N[C@@H]2CCc3ccc[nH+]c3CC2)c1 ZINC000576504940 341849585 /nfs/dbraw/zinc/84/95/85/341849585.db2.gz DOMVIZKABBOKBN-MRXNPFEDSA-N 1 2 323.440 4.036 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)CN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000192654267 341882366 /nfs/dbraw/zinc/88/23/66/341882366.db2.gz MQCDQCDZDAFBHX-SWLSCSKDSA-N 1 2 322.330 4.067 20 0 DIADLO Cc1ccn2cc(CN[C@@H](c3ccccc3)C(F)(F)F)[nH+]c2c1 ZINC000580672606 341895956 /nfs/dbraw/zinc/89/59/56/341895956.db2.gz QEQQREIBSCUNED-INIZCTEOSA-N 1 2 319.330 4.036 20 0 DIADLO C[C@@H]1C[C@@H](Nc2cccc([NH+]3CCCCCC3)c2)C[C@H](C)O1 ZINC000577465361 341910983 /nfs/dbraw/zinc/91/09/83/341910983.db2.gz HMLWBOZSDRUIIR-ALXJQNPVSA-N 1 2 302.462 4.435 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2coc(C)n2)c2ccc(C)cc2)cc1 ZINC000577510456 341914526 /nfs/dbraw/zinc/91/45/26/341914526.db2.gz MAWBKQZAQLFOMK-FQEVSTJZSA-N 1 2 322.408 4.179 20 0 DIADLO c1ccc(N2Cc3cccc(N[C@@H]4CC[C@@H]4C4CC4)c3C2)[nH+]c1 ZINC000577525938 341915569 /nfs/dbraw/zinc/91/55/69/341915569.db2.gz WZVHKHMAYLRHFT-VQIMIIECSA-N 1 2 305.425 4.202 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)s1 ZINC000177961742 341940344 /nfs/dbraw/zinc/94/03/44/341940344.db2.gz IRBIDRYSXOKSGU-LBPRGKRZSA-N 1 2 315.467 4.426 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000537123384 517869424 /nfs/dbraw/zinc/86/94/24/517869424.db2.gz QLKPNXPFSJZHLN-UONOGXRCSA-N 1 2 322.412 4.106 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(C(F)(F)F)cc1 ZINC000341224948 518183277 /nfs/dbraw/zinc/18/32/77/518183277.db2.gz YYFFWQZZKQTUBU-JTQLQIEISA-N 1 2 310.319 4.422 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H](CC(C)C)C2)c(C)[nH+]1 ZINC000455498102 518186861 /nfs/dbraw/zinc/18/68/61/518186861.db2.gz QZSAOWUSAYSLIY-INIZCTEOSA-N 1 2 303.450 4.297 20 0 DIADLO Cc1cccc2[nH+]cc(CNc3ccccc3OCC3CC3)n21 ZINC000453573100 518190735 /nfs/dbraw/zinc/19/07/35/518190735.db2.gz HZMFNSRBLQLKTN-UHFFFAOYSA-N 1 2 307.397 4.044 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH+]1CC(C)(C)OC(C)(C)C1 ZINC000442887665 518194462 /nfs/dbraw/zinc/19/44/62/518194462.db2.gz ZQDNUXYETFLVRL-UHFFFAOYSA-N 1 2 320.458 4.101 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1ccccc1 ZINC000181799633 519250098 /nfs/dbraw/zinc/25/00/98/519250098.db2.gz ALBQRPUUHNWAII-OAHLLOKOSA-N 1 2 301.434 4.244 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1ccccc1 ZINC000181799705 519398158 /nfs/dbraw/zinc/39/81/58/519398158.db2.gz XTHOXIMUEZYOHW-HNNXBMFYSA-N 1 2 301.434 4.244 20 0 DIADLO CC(C)N(C)c1ccc(CNc2ccc(-c3ncco3)cc2)c[nH+]1 ZINC000191529581 519633475 /nfs/dbraw/zinc/63/34/75/519633475.db2.gz XGEUTBHQDKTYFS-UHFFFAOYSA-N 1 2 322.412 4.193 20 0 DIADLO CC(C)[C@@H]1CCCN1C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000264899528 519802579 /nfs/dbraw/zinc/80/25/79/519802579.db2.gz JPPYEAURPDENCC-SFHVURJKSA-N 1 2 310.397 4.135 20 0 DIADLO CC(C)c1ccc(C(=O)N2CCC[C@@H]2c2[nH]cc[nH+]2)cc1Cl ZINC000364202258 519834591 /nfs/dbraw/zinc/83/45/91/519834591.db2.gz SBOFXCANMIBZOF-OAHLLOKOSA-N 1 2 317.820 4.164 20 0 DIADLO CC(C)c1ccc(C(=O)N2CCC[C@H]2c2[nH]cc[nH+]2)cc1Cl ZINC000364202252 519834826 /nfs/dbraw/zinc/83/48/26/519834826.db2.gz SBOFXCANMIBZOF-HNNXBMFYSA-N 1 2 317.820 4.164 20 0 DIADLO CC(C)c1nc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)cs1 ZINC000363812423 519863539 /nfs/dbraw/zinc/86/35/39/519863539.db2.gz DAFPQAVYVDJHHS-XJKSGUPXSA-N 1 2 301.459 4.245 20 0 DIADLO CC(C)c1nc(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)cs1 ZINC000363812423 519863540 /nfs/dbraw/zinc/86/35/40/519863540.db2.gz DAFPQAVYVDJHHS-XJKSGUPXSA-N 1 2 301.459 4.245 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)no1 ZINC000180020857 519864133 /nfs/dbraw/zinc/86/41/33/519864133.db2.gz ZEHKXIIPEBMCCQ-DIOULYMOSA-N 1 2 319.836 4.333 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)no1 ZINC000180020875 519864186 /nfs/dbraw/zinc/86/41/86/519864186.db2.gz ZEHKXIIPEBMCCQ-HZUKXOBISA-N 1 2 319.836 4.333 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)o1 ZINC000181619139 519888021 /nfs/dbraw/zinc/88/80/21/519888021.db2.gz INJLYQGPCKRKAE-OAHLLOKOSA-N 1 2 323.387 4.348 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)n1 ZINC000182422011 519905149 /nfs/dbraw/zinc/90/51/49/519905149.db2.gz SHTFWAWSUUJQPA-JTQLQIEISA-N 1 2 313.323 4.063 20 0 DIADLO CCN(C(=O)CCn1c(C)[nH+]c2ccccc21)c1cccc(C)c1 ZINC000339220399 519909320 /nfs/dbraw/zinc/90/93/20/519909320.db2.gz VVBHBCQAWUQTMJ-UHFFFAOYSA-N 1 2 321.424 4.096 20 0 DIADLO CC(C)n1cc[nH+]c1CN(Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000337349983 520026500 /nfs/dbraw/zinc/02/65/00/520026500.db2.gz RBJMTFNFCMNSHQ-PBHICJAKSA-N 1 2 313.445 4.345 20 0 DIADLO CC(C)n1nccc1C[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC000337208990 520112123 /nfs/dbraw/zinc/11/21/23/520112123.db2.gz RTRIVFLKVYGCMJ-GFCCVEGCSA-N 1 2 306.479 4.069 20 0 DIADLO CCCCCC[C@@H](C)NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000106515786 520114851 /nfs/dbraw/zinc/11/48/51/520114851.db2.gz URPVSTDBRCUWHP-CABCVRRESA-N 1 2 306.454 4.005 20 0 DIADLO CCCCCC[C@@H](C)NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000106515779 520115479 /nfs/dbraw/zinc/11/54/79/520115479.db2.gz URPVSTDBRCUWHP-HUUCEWRRSA-N 1 2 306.454 4.005 20 0 DIADLO CC([NH2+]Cc1nc(C2CC2)no1)(c1ccccc1)c1ccccc1 ZINC000182189538 520174825 /nfs/dbraw/zinc/17/48/25/520174825.db2.gz HEUXPVYBWLCHRZ-UHFFFAOYSA-N 1 2 319.408 4.000 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+]2CC[C@@H]2c2ccccc2)cs1 ZINC000336842309 520270888 /nfs/dbraw/zinc/27/08/88/520270888.db2.gz RTPKLSKHGUMOBB-XJKSGUPXSA-N 1 2 302.443 4.188 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+]2CC[C@@H]2c2ccccc2)cs1 ZINC000336842309 520270897 /nfs/dbraw/zinc/27/08/97/520270897.db2.gz RTPKLSKHGUMOBB-XJKSGUPXSA-N 1 2 302.443 4.188 20 0 DIADLO CC1(C)CCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000338189712 520327536 /nfs/dbraw/zinc/32/75/36/520327536.db2.gz NDXYFBVSURZAFO-UHFFFAOYSA-N 1 2 310.397 4.136 20 0 DIADLO CCCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1ccon1 ZINC000181718798 520485756 /nfs/dbraw/zinc/48/57/56/520485756.db2.gz GIVGDAJYDPMKLU-QGZVFWFLSA-N 1 2 302.418 4.340 20 0 DIADLO CCCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nnc(C)o1 ZINC000181719953 520485989 /nfs/dbraw/zinc/48/59/89/520485989.db2.gz YCSVWMQBQBKZFI-MRXNPFEDSA-N 1 2 317.433 4.044 20 0 DIADLO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000336828533 520650767 /nfs/dbraw/zinc/65/07/67/520650767.db2.gz AEWAXGIQYAPFJU-LLVKDONJSA-N 1 2 304.381 4.183 20 0 DIADLO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1csc(C2CC2)n1 ZINC000336828533 520650776 /nfs/dbraw/zinc/65/07/76/520650776.db2.gz AEWAXGIQYAPFJU-LLVKDONJSA-N 1 2 304.381 4.183 20 0 DIADLO CCCC[C@@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc(OC)cc1 ZINC000367743215 521104546 /nfs/dbraw/zinc/10/45/46/521104546.db2.gz ZBAUUWLMNCVTKL-MSOLQXFVSA-N 1 2 313.445 4.317 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@H](CC)c2ccc(OC)cc2)n1 ZINC000181823313 521351550 /nfs/dbraw/zinc/35/15/50/521351550.db2.gz WMQIZNQPEPNGGF-XJKSGUPXSA-N 1 2 317.433 4.223 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)c2cc[nH]c2C)c1 ZINC000157937997 521391024 /nfs/dbraw/zinc/39/10/24/521391024.db2.gz QOWHLEJGZBFRAO-UHFFFAOYSA-N 1 2 322.412 4.239 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)CCSC)c1 ZINC000157902905 521391329 /nfs/dbraw/zinc/39/13/29/521391329.db2.gz QHYDVTFFTBJIRA-UHFFFAOYSA-N 1 2 317.458 4.042 20 0 DIADLO CCCc1ccc(C[NH2+]C2(c3noc(C(F)F)n3)CCC2)cc1 ZINC000366358928 521397587 /nfs/dbraw/zinc/39/75/87/521397587.db2.gz UCXVGUUYSSVCNV-UHFFFAOYSA-N 1 2 321.371 4.129 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+][C@H](C)c1nc(C(C)C)no1 ZINC000179746915 521577967 /nfs/dbraw/zinc/57/79/67/521577967.db2.gz SLWVQOAQKJATMY-UKRRQHHQSA-N 1 2 317.433 4.394 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+]Cc1csc([C@H](C)OC)n1 ZINC000269044244 521584376 /nfs/dbraw/zinc/58/43/76/521584376.db2.gz HDEZTPPVQQSCRK-STQMWFEESA-N 1 2 320.458 4.100 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](c2ccccc2F)C2CCCC2)n1 ZINC000181486520 521586624 /nfs/dbraw/zinc/58/66/24/521586624.db2.gz CXSVWPQSHISEBM-GOSISDBHSA-N 1 2 317.408 4.182 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2nccn2-c2ccccc2)on1 ZINC000191206799 521633567 /nfs/dbraw/zinc/63/35/67/521633567.db2.gz WIPSUNPPQVXPHH-UHFFFAOYSA-N 1 2 324.428 4.054 20 0 DIADLO CCSCc1ccc(C(=O)Nc2cc[nH+]cc2CC)cc1 ZINC000265078476 521718527 /nfs/dbraw/zinc/71/85/27/521718527.db2.gz WJXHZGUWZXYWFL-UHFFFAOYSA-N 1 2 300.427 4.149 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+][C@H](C)c2nnc(C)s2)cc1 ZINC000338290157 521750042 /nfs/dbraw/zinc/75/00/42/521750042.db2.gz WAPXMEPMEBMVQG-GHMZBOCLSA-N 1 2 307.488 4.370 20 0 DIADLO CCc1nc(C[N@@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)cs1 ZINC000338351273 522319693 /nfs/dbraw/zinc/31/96/93/522319693.db2.gz HXNCPRDWOIGCHL-LBPRGKRZSA-N 1 2 318.408 4.260 20 0 DIADLO CCc1nc(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)cs1 ZINC000338351273 522319701 /nfs/dbraw/zinc/31/97/01/522319701.db2.gz HXNCPRDWOIGCHL-LBPRGKRZSA-N 1 2 318.408 4.260 20 0 DIADLO COc1cc(Cl)c(C[NH2+][C@@H](C)c2ncc(C)o2)cc1Cl ZINC000337246742 522521961 /nfs/dbraw/zinc/52/19/61/522521961.db2.gz HUBKYBSNHCUJQV-VIFPVBQESA-N 1 2 315.200 4.149 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000182307262 522701063 /nfs/dbraw/zinc/70/10/63/522701063.db2.gz UMIFKULKZKDBIH-HZMBPMFUSA-N 1 2 305.809 4.402 20 0 DIADLO CN(CCC1CC1)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000159076042 522702331 /nfs/dbraw/zinc/70/23/31/522702331.db2.gz MRLDWWDJUBZKBM-UHFFFAOYSA-N 1 2 311.385 4.138 20 0 DIADLO CCc1nnc(C[NH2+][C@H](c2cccc(Cl)c2)C2CCCC2)o1 ZINC000181033635 522746466 /nfs/dbraw/zinc/74/64/66/522746466.db2.gz GHWHHVBQXBINMO-KRWDZBQOSA-N 1 2 319.836 4.307 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1csc(C(C)C)n1)c1ccccc1 ZINC000186405748 522761307 /nfs/dbraw/zinc/76/13/07/522761307.db2.gz WOVYGHRTQNYPPW-ZFWWWQNUSA-N 1 2 304.459 4.305 20 0 DIADLO CC[C@H](Nc1ccc(N2CCCC2)c(Cl)c1)c1[nH+]ccn1C ZINC000183012542 522767211 /nfs/dbraw/zinc/76/72/11/522767211.db2.gz VAEAXLSJYACEKB-HNNXBMFYSA-N 1 2 318.852 4.237 20 0 DIADLO CC[C@H](Nc1ccc(CCC(F)(F)F)cc1)c1[nH+]ccn1C ZINC000182335514 522768184 /nfs/dbraw/zinc/76/81/84/522768184.db2.gz JVEQFHAHLZWEJA-AWEZNQCLSA-N 1 2 311.351 4.478 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1ccccn1)c1nc(C(F)(F)F)cs1 ZINC000159275118 522913237 /nfs/dbraw/zinc/91/32/37/522913237.db2.gz CULJXNCLIPUWDR-VHSXEESVSA-N 1 2 315.364 4.359 20 0 DIADLO CC[C@@H](Nc1ccc(CCC(F)(F)F)cc1)c1[nH+]ccn1C ZINC000182335531 522955576 /nfs/dbraw/zinc/95/55/76/522955576.db2.gz JVEQFHAHLZWEJA-CQSZACIVSA-N 1 2 311.351 4.478 20 0 DIADLO CC[C@@H](Nc1ccc(Br)c(C)c1)c1[nH+]ccn1C ZINC000182742772 522956821 /nfs/dbraw/zinc/95/68/21/522956821.db2.gz KSRMCRABFTZIOI-CYBMUJFWSA-N 1 2 308.223 4.054 20 0 DIADLO CC[C@@H](Nc1ccc(Cl)c(OC(F)F)c1)c1[nH+]ccn1C ZINC000180232927 522959216 /nfs/dbraw/zinc/95/92/16/522959216.db2.gz RAHQLIAKVMKVRA-LLVKDONJSA-N 1 2 315.751 4.238 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1csc(-c2ccoc2)n1 ZINC000130094985 523121990 /nfs/dbraw/zinc/12/19/90/523121990.db2.gz QUQIZFSAWWWKDM-INIZCTEOSA-N 1 2 313.426 4.381 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1csc(-c2ccoc2)n1 ZINC000130094985 523121999 /nfs/dbraw/zinc/12/19/99/523121999.db2.gz QUQIZFSAWWWKDM-INIZCTEOSA-N 1 2 313.426 4.381 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cs1 ZINC000336846166 523467828 /nfs/dbraw/zinc/46/78/28/523467828.db2.gz KKZIQFOAMCRNPV-GXSJLCMTSA-N 1 2 322.396 4.013 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cs1 ZINC000336846166 523467840 /nfs/dbraw/zinc/46/78/40/523467840.db2.gz KKZIQFOAMCRNPV-GXSJLCMTSA-N 1 2 322.396 4.013 20 0 DIADLO CCn1cc[nH+]c1CN1CCCSc2ccc(Cl)cc21 ZINC000356343753 523533147 /nfs/dbraw/zinc/53/31/47/523533147.db2.gz PUCPAAKKWKAEMB-UHFFFAOYSA-N 1 2 307.850 4.059 20 0 DIADLO CC[C@]1(C)CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000337967500 523567516 /nfs/dbraw/zinc/56/75/16/523567516.db2.gz GCUOZWJNWOFLHK-LJQANCHMSA-N 1 2 310.397 4.136 20 0 DIADLO C[N@H+](Cc1nc2ccccc2s1)Cc1cnc2ccccc2c1 ZINC000337123339 523571110 /nfs/dbraw/zinc/57/11/10/523571110.db2.gz BTSYTSQGJHZYHA-UHFFFAOYSA-N 1 2 319.433 4.477 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2s1)Cc1cnc2ccccc2c1 ZINC000337123339 523571117 /nfs/dbraw/zinc/57/11/17/523571117.db2.gz BTSYTSQGJHZYHA-UHFFFAOYSA-N 1 2 319.433 4.477 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]Cc2cc(C)cc(Cl)c2)cs1 ZINC000339294547 523915923 /nfs/dbraw/zinc/91/59/23/523915923.db2.gz TWGKLQNIRZRNIG-LLVKDONJSA-N 1 2 310.850 4.102 20 0 DIADLO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000267017531 524093287 /nfs/dbraw/zinc/09/32/87/524093287.db2.gz IMALZZDJPCXDJM-OLZOCXBDSA-N 1 2 302.418 4.393 20 0 DIADLO COc1cccc([C@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000124341091 524156955 /nfs/dbraw/zinc/15/69/55/524156955.db2.gz QRSPRMOVRUPPJJ-UONOGXRCSA-N 1 2 323.396 4.157 20 0 DIADLO COc1cccc([C@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000124340750 524156997 /nfs/dbraw/zinc/15/69/97/524156997.db2.gz QRSPRMOVRUPPJJ-KBPBESRZSA-N 1 2 323.396 4.157 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2ncnn2-c2ccccc2)c1 ZINC000337142096 524209087 /nfs/dbraw/zinc/20/90/87/524209087.db2.gz SWGMWPJHKFZKKC-KRWDZBQOSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2ncnn2-c2ccccc2)c1 ZINC000337142096 524209094 /nfs/dbraw/zinc/20/90/94/524209094.db2.gz SWGMWPJHKFZKKC-KRWDZBQOSA-N 1 2 320.440 4.077 20 0 DIADLO COc1ccc(Cl)cc1[C@H](CC(C)C)[NH2+]Cc1cocn1 ZINC000182070095 524254039 /nfs/dbraw/zinc/25/40/39/524254039.db2.gz COLUPWGJSMNVQB-HNNXBMFYSA-N 1 2 308.809 4.214 20 0 DIADLO C[C@@H](C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)c1ccccn1 ZINC000339275136 524272400 /nfs/dbraw/zinc/27/24/00/524272400.db2.gz VFMDHCVDGMXGFI-CQSZACIVSA-N 1 2 319.364 4.011 20 0 DIADLO C[C@H]1CC[C@H](C)N(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000337955752 524393205 /nfs/dbraw/zinc/39/32/05/524393205.db2.gz PGRTWUZNEAIORL-GJZGRUSLSA-N 1 2 310.397 4.135 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nc(Cc3ccccc3)no2)cc1C ZINC000191596665 524592425 /nfs/dbraw/zinc/59/24/25/524592425.db2.gz ADLTYHPLHYDYAH-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO C[C@@H]1CC[C@H](C)N(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000337955751 524654890 /nfs/dbraw/zinc/65/48/90/524654890.db2.gz PGRTWUZNEAIORL-CABCVRRESA-N 1 2 310.397 4.135 20 0 DIADLO Cc1cccc(NCc2c[nH+]cn2C(C)C)c1Br ZINC000131230834 524687448 /nfs/dbraw/zinc/68/74/48/524687448.db2.gz AESAJTCLAYOCHD-UHFFFAOYSA-N 1 2 308.223 4.147 20 0 DIADLO C[C@H]1COC[C@H](c2ccccc2)[N@@H+]1Cc1cnc2ccccc2c1 ZINC000337178758 524737361 /nfs/dbraw/zinc/73/73/61/524737361.db2.gz KPQYLWYUEXBSQR-HRAATJIYSA-N 1 2 318.420 4.197 20 0 DIADLO C[C@H]1COC[C@H](c2ccccc2)[N@H+]1Cc1cnc2ccccc2c1 ZINC000337178758 524737371 /nfs/dbraw/zinc/73/73/71/524737371.db2.gz KPQYLWYUEXBSQR-HRAATJIYSA-N 1 2 318.420 4.197 20 0 DIADLO Cc1cc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)no1 ZINC000179999782 524754037 /nfs/dbraw/zinc/75/40/37/524754037.db2.gz XWPFZDDAJIJBDK-UHFFFAOYSA-N 1 2 310.319 4.171 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+][C@H](C)c1noc(-c2ccccc2)n1 ZINC000124339248 524781980 /nfs/dbraw/zinc/78/19/80/524781980.db2.gz PCVKJQPYORBASL-UONOGXRCSA-N 1 2 323.396 4.157 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1ccsc1C)c1ccccn1 ZINC000339332072 524798733 /nfs/dbraw/zinc/79/87/33/524798733.db2.gz ZXJFYOUTOHAEEJ-IBGZPJMESA-N 1 2 324.449 4.339 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000124499838 524878296 /nfs/dbraw/zinc/87/82/96/524878296.db2.gz FDDNHVLAKTWBMR-LSDHHAIUSA-N 1 2 307.397 4.457 20 0 DIADLO Cc1ccc(NC(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)c(C)[nH+]1 ZINC000176717635 525146675 /nfs/dbraw/zinc/14/66/75/525146675.db2.gz ROPOMBSSKMBDHA-YOEHRIQHSA-N 1 2 309.413 4.108 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c(F)c1 ZINC000133469797 525325875 /nfs/dbraw/zinc/32/58/75/525325875.db2.gz WLMDECLHCBVYPH-NSHDSACASA-N 1 2 322.449 4.439 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1F)c1nc(C2CCCCC2)no1 ZINC000237505760 525462764 /nfs/dbraw/zinc/46/27/64/525462764.db2.gz APVWERKZBYIZPH-LBPRGKRZSA-N 1 2 303.381 4.107 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(F)(F)F)cs1)c1cccc(F)c1F ZINC000181976300 525487250 /nfs/dbraw/zinc/48/72/50/525487250.db2.gz KOFRLHGKDWSPKR-ZETCQYMHSA-N 1 2 322.302 4.291 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2cc(-c3ccccc3)on2)o1 ZINC000237467672 525509701 /nfs/dbraw/zinc/50/97/01/525509701.db2.gz WUFYGJLVLLXBCN-CXAGYDPISA-N 1 2 308.381 4.348 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1nc2c(s1)CCCC2 ZINC000130236016 525514300 /nfs/dbraw/zinc/51/43/00/525514300.db2.gz BVTUCPQUDSGFDC-SNVBAGLBSA-N 1 2 308.397 4.151 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2cc(Cl)ccc2s1)c1ccncc1F ZINC000338369118 525559609 /nfs/dbraw/zinc/55/96/09/525559609.db2.gz MRNMRKSNNNEUID-SECBINFHSA-N 1 2 321.808 4.335 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2ccccc21)c1noc(-c2ccccc2)n1 ZINC000124303650 525582590 /nfs/dbraw/zinc/58/25/90/525582590.db2.gz VRECXTYUURBZLK-SUMWQHHRSA-N 1 2 305.381 4.075 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1noc(-c2ccccc2)n1 ZINC000124254219 525630807 /nfs/dbraw/zinc/63/08/07/525630807.db2.gz CPFBINPCOZNOQH-SJCJKPOMSA-N 1 2 323.371 4.214 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1nc2c(s1)CCCC2 ZINC000182489926 525706410 /nfs/dbraw/zinc/70/64/10/525706410.db2.gz GNNMRFLMOFDZEB-GFCCVEGCSA-N 1 2 301.459 4.261 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)c1 ZINC000368609226 525712533 /nfs/dbraw/zinc/71/25/33/525712533.db2.gz WSEYAKLEIVBKAO-WMLDXEAASA-N 1 2 309.438 4.287 20 0 DIADLO Cc1ccc(-c2cc(C[NH2+][C@H](C)c3ccncc3F)on2)cc1 ZINC000338360066 525735155 /nfs/dbraw/zinc/73/51/55/525735155.db2.gz WHAPPLKVJMMNOQ-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000124490985 525747903 /nfs/dbraw/zinc/74/79/03/525747903.db2.gz AEPZZPATXKTQAF-HUUCEWRRSA-N 1 2 307.397 4.457 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nccn2C(F)F)o1 ZINC000158649570 525796737 /nfs/dbraw/zinc/79/67/37/525796737.db2.gz PRDKQFNZYBJGCH-ZDUSSCGKSA-N 1 2 309.360 4.297 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2nccn2C(F)F)o1 ZINC000158649570 525796745 /nfs/dbraw/zinc/79/67/45/525796745.db2.gz PRDKQFNZYBJGCH-ZDUSSCGKSA-N 1 2 309.360 4.297 20 0 DIADLO Cc1cn2cc(NC(=O)C[C@H]3CCCc4ccccc43)ccc2[nH+]1 ZINC000336966443 525948469 /nfs/dbraw/zinc/94/84/69/525948469.db2.gz HFTAPSXMEDVOMC-MRXNPFEDSA-N 1 2 319.408 4.091 20 0 DIADLO Cc1cn2cc(NC(=O)c3csc4ccccc34)ccc2[nH+]1 ZINC000339269532 525952736 /nfs/dbraw/zinc/95/27/36/525952736.db2.gz TXVOYNQHIJECJC-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2nccn2C(F)F)o1 ZINC000158649730 525989868 /nfs/dbraw/zinc/98/98/68/525989868.db2.gz PRDKQFNZYBJGCH-CYBMUJFWSA-N 1 2 309.360 4.297 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2nccn2C(F)F)o1 ZINC000158649730 525989876 /nfs/dbraw/zinc/98/98/76/525989876.db2.gz PRDKQFNZYBJGCH-CYBMUJFWSA-N 1 2 309.360 4.297 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)no1 ZINC000299047748 534899811 /nfs/dbraw/zinc/89/98/11/534899811.db2.gz FSWJPKTYQXHMOA-HNNXBMFYSA-N 1 2 319.424 4.383 20 0 DIADLO Cc1cc(-c2nnc(C[N@@H+]3Cc4ccccc4[C@H]3C)o2)c(C)o1 ZINC000336869894 526060879 /nfs/dbraw/zinc/06/08/79/526060879.db2.gz FXBFGHXDBIGAIJ-GFCCVEGCSA-N 1 2 309.369 4.023 20 0 DIADLO Cc1cc(-c2nnc(C[N@H+]3Cc4ccccc4[C@H]3C)o2)c(C)o1 ZINC000336869894 526060889 /nfs/dbraw/zinc/06/08/89/526060889.db2.gz FXBFGHXDBIGAIJ-GFCCVEGCSA-N 1 2 309.369 4.023 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H](c1nc(C)cs1)C1CC1 ZINC000338300257 526103624 /nfs/dbraw/zinc/10/36/24/526103624.db2.gz CHHULZCSRNSATA-OAHLLOKOSA-N 1 2 322.861 4.354 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+](C)Cc1ccc(Cl)nc1 ZINC000181135622 526173190 /nfs/dbraw/zinc/17/31/90/526173190.db2.gz JDLMHFIIQFRTPH-NSHDSACASA-N 1 2 301.777 4.069 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000181135622 526173198 /nfs/dbraw/zinc/17/31/98/526173198.db2.gz JDLMHFIIQFRTPH-NSHDSACASA-N 1 2 301.777 4.069 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@@H](SCc1ccccc1)C(C)C ZINC000107289008 526239800 /nfs/dbraw/zinc/23/98/00/526239800.db2.gz BLSSCBATIUQBMA-KRWDZBQOSA-N 1 2 314.454 4.287 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000107290722 526240746 /nfs/dbraw/zinc/24/07/46/526240746.db2.gz VLACHBBZZNIWBN-KBPBESRZSA-N 1 2 320.314 4.151 20 0 DIADLO Cc1coc2ccc(NC(=O)N3CCCC[C@H]3c3[nH]cc[nH+]3)cc12 ZINC000187958750 526294446 /nfs/dbraw/zinc/29/44/46/526294446.db2.gz BPCPSQQOMSFWRF-HNNXBMFYSA-N 1 2 324.384 4.223 20 0 DIADLO Fc1ccc(-c2nc(C[NH+]3Cc4ccccc4C3)co2)cc1F ZINC000106302827 526316367 /nfs/dbraw/zinc/31/63/67/526316367.db2.gz ZXPBECVKPNXXFR-UHFFFAOYSA-N 1 2 312.319 4.136 20 0 DIADLO Cc1csc(C[NH+]2CCC(Oc3ccccc3Cl)CC2)n1 ZINC000157363909 526340815 /nfs/dbraw/zinc/34/08/15/526340815.db2.gz QHAXUYAYVRXJSH-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+][C@@H](c1ncc[nH]1)c1ccccc1)CCC2 ZINC000127801788 526372591 /nfs/dbraw/zinc/37/25/91/526372591.db2.gz AOVUCWLLNFIMBN-RBUKOAKNSA-N 1 2 321.399 4.305 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)o1 ZINC000180264517 526406702 /nfs/dbraw/zinc/40/67/02/526406702.db2.gz CZCBCUOHHMYDDX-XPTSAGLGSA-N 1 2 311.788 4.218 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1ccccc1)Cc1cccnc1 ZINC000339289729 526410598 /nfs/dbraw/zinc/41/05/98/526410598.db2.gz HBDHGNWHMCNBIW-UHFFFAOYSA-N 1 2 306.384 4.423 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1ccccc1)Cc1cccnc1 ZINC000339289729 526410601 /nfs/dbraw/zinc/41/06/01/526410601.db2.gz HBDHGNWHMCNBIW-UHFFFAOYSA-N 1 2 306.384 4.423 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2nc(C(C)(C)C)cs2)C2CC2)n1 ZINC000181625016 526415674 /nfs/dbraw/zinc/41/56/74/526415674.db2.gz QQMQRIJNAUZWQL-AWEZNQCLSA-N 1 2 321.515 4.446 20 0 DIADLO c1ccc([C@@H](CC2CCCC2)[NH2+]Cc2nc(C3CC3)no2)cc1 ZINC000181942514 526489724 /nfs/dbraw/zinc/48/97/24/526489724.db2.gz MYPNYUXFHWZEDL-QGZVFWFLSA-N 1 2 311.429 4.358 20 0 DIADLO c1cncc([C@H]2CCC[C@@H](Nc3ccc(N4CCCC4)c[nH+]3)C2)c1 ZINC000337372523 526550220 /nfs/dbraw/zinc/55/02/20/526550220.db2.gz DIVWWQCXMGPXHL-FUHWJXTLSA-N 1 2 322.456 4.215 20 0 DIADLO c1csc(-c2nc(C[N@@H+]3CCC[C@@H]3c3ccncc3)co2)c1 ZINC000125369387 526574383 /nfs/dbraw/zinc/57/43/83/526574383.db2.gz BJICGKDAHPBQNK-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2nc(C[N@H+]3CCC[C@@H]3c3ccncc3)co2)c1 ZINC000125369387 526574384 /nfs/dbraw/zinc/57/43/84/526574384.db2.gz BJICGKDAHPBQNK-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO Cc1nocc1CNc1ccc(-c2cn3cccc(C)c3[nH+]2)cc1 ZINC000339303876 526698896 /nfs/dbraw/zinc/69/88/96/526698896.db2.gz VSVDILFYJOPGTR-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@@H]2CCCc3nc(C)sc32)c(C)s1 ZINC000336820260 526843472 /nfs/dbraw/zinc/84/34/72/526843472.db2.gz CHLIMSOQNLICGK-CQSZACIVSA-N 1 2 307.488 4.034 20 0 DIADLO Cc1nc(C[N@H+](C)[C@@H]2CCCc3nc(C)sc32)c(C)s1 ZINC000336820260 526843475 /nfs/dbraw/zinc/84/34/75/526843475.db2.gz CHLIMSOQNLICGK-CQSZACIVSA-N 1 2 307.488 4.034 20 0 DIADLO Cc1nc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c(C)s1 ZINC000336824134 526870212 /nfs/dbraw/zinc/87/02/12/526870212.db2.gz SWTFYSOJNCALSE-INIZCTEOSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1nc(C[N@H+]2CCSC[C@H]2c2ccccc2)c(C)s1 ZINC000336824134 526870220 /nfs/dbraw/zinc/87/02/20/526870220.db2.gz SWTFYSOJNCALSE-INIZCTEOSA-N 1 2 304.484 4.050 20 0 DIADLO Clc1ccc(C2([NH2+][C@H]3CCCc4[nH]ncc43)CC2)cc1Cl ZINC000368607941 526942524 /nfs/dbraw/zinc/94/25/24/526942524.db2.gz JSAKRVZVPPMNHT-AWEZNQCLSA-N 1 2 322.239 4.373 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2noc(C3CC3)n2)C2CCC2)cc1 ZINC000182566257 526961733 /nfs/dbraw/zinc/96/17/33/526961733.db2.gz NKCSXFOVOVFDOU-INIZCTEOSA-N 1 2 317.820 4.231 20 0 DIADLO Cc1nnc([C@H]2CCCC[N@@H+]2Cc2ccc(C3CCC3)cc2)[nH]1 ZINC000338329444 527073747 /nfs/dbraw/zinc/07/37/47/527073747.db2.gz UIIYMUURTCPBBJ-GOSISDBHSA-N 1 2 310.445 4.108 20 0 DIADLO Cc1nnc([C@H]2CCCC[N@H+]2Cc2ccc(C3CCC3)cc2)[nH]1 ZINC000338329444 527073754 /nfs/dbraw/zinc/07/37/54/527073754.db2.gz UIIYMUURTCPBBJ-GOSISDBHSA-N 1 2 310.445 4.108 20 0 DIADLO Cc1[nH]c(C(=O)N[C@H](C)c2ccc(Oc3ccccc3)cc2)c[nH+]1 ZINC000339226433 527241208 /nfs/dbraw/zinc/24/12/08/527241208.db2.gz HGLNFIRXOIMURV-CYBMUJFWSA-N 1 2 321.380 4.001 20 0 DIADLO Cc1ncc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000339294325 527254896 /nfs/dbraw/zinc/25/48/96/527254896.db2.gz UPVXGGPZYMJEIY-MRXNPFEDSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1ncc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000339294325 527254900 /nfs/dbraw/zinc/25/49/00/527254900.db2.gz UPVXGGPZYMJEIY-MRXNPFEDSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1ncc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000339294320 527255151 /nfs/dbraw/zinc/25/51/51/527255151.db2.gz UPVXGGPZYMJEIY-INIZCTEOSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1ncc(C[N@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000339294320 527255155 /nfs/dbraw/zinc/25/51/55/527255155.db2.gz UPVXGGPZYMJEIY-INIZCTEOSA-N 1 2 322.239 4.429 20 0 DIADLO Cn1cc([C@@H]([NH2+]Cc2sccc2Cl)c2ccccc2)cn1 ZINC000365953293 527294074 /nfs/dbraw/zinc/29/40/74/527294074.db2.gz DYJILODOGCQFCB-INIZCTEOSA-N 1 2 317.845 4.014 20 0 DIADLO O=C(Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1)C(C1CC1)C1CC1 ZINC000338042341 527300239 /nfs/dbraw/zinc/30/02/39/527300239.db2.gz NOLBJYADBZCCOF-UHFFFAOYSA-N 1 2 309.413 4.205 20 0 DIADLO Cc1nccnc1[C@@H](C)Nc1cccc([NH+]2CCCCCC2)c1 ZINC000188423654 527457152 /nfs/dbraw/zinc/45/71/52/527457152.db2.gz KYALQVYARCQRPR-MRXNPFEDSA-N 1 2 310.445 4.339 20 0 DIADLO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1ncc(C(C)(C)C)o1 ZINC000157794825 527584752 /nfs/dbraw/zinc/58/47/52/527584752.db2.gz YOPYLISEDKSTGR-GFCCVEGCSA-N 1 2 318.465 4.083 20 0 DIADLO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]Cc1ncc(C(C)(C)C)o1 ZINC000157794923 527589819 /nfs/dbraw/zinc/58/98/19/527589819.db2.gz YOPYLISEDKSTGR-LBPRGKRZSA-N 1 2 318.465 4.083 20 0 DIADLO FC(F)(F)Cn1cc[nH+]c1CSCCCc1ccsc1 ZINC000360934425 527674724 /nfs/dbraw/zinc/67/47/24/527674724.db2.gz JFDNEZJGSOWLIF-UHFFFAOYSA-N 1 2 320.405 4.373 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCC[N@@H+]2Cc2cncnc2)c1 ZINC000364883730 527686169 /nfs/dbraw/zinc/68/61/69/527686169.db2.gz VEADBPDPYIIPBI-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCC[N@H+]2Cc2cncnc2)c1 ZINC000364883730 527686174 /nfs/dbraw/zinc/68/61/74/527686174.db2.gz VEADBPDPYIIPBI-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO CC(C)c1nnc(C[N@@H+](Cc2ccccc2Cl)CC2CC2)o1 ZINC000285543217 534968457 /nfs/dbraw/zinc/96/84/57/534968457.db2.gz TZPRSKGDLAOCTR-UHFFFAOYSA-N 1 2 319.836 4.259 20 0 DIADLO CC(C)c1nnc(C[N@H+](Cc2ccccc2Cl)CC2CC2)o1 ZINC000285543217 534968464 /nfs/dbraw/zinc/96/84/64/534968464.db2.gz TZPRSKGDLAOCTR-UHFFFAOYSA-N 1 2 319.836 4.259 20 0 DIADLO CC(C)c1nnc(C[N@H+](CCc2ccc(F)cc2)C2CC2)s1 ZINC000297653623 534969692 /nfs/dbraw/zinc/96/96/92/534969692.db2.gz YPTDNKJGCQBBBZ-UHFFFAOYSA-N 1 2 319.449 4.008 20 0 DIADLO CC(C)c1nnc(C[N@@H+](CCc2ccc(F)cc2)C2CC2)s1 ZINC000297653623 534969696 /nfs/dbraw/zinc/96/96/96/534969696.db2.gz YPTDNKJGCQBBBZ-UHFFFAOYSA-N 1 2 319.449 4.008 20 0 DIADLO CC(F)(F)c1cccc(NC2CCN(c3cccc[nH+]3)CC2)c1 ZINC000275774332 535214954 /nfs/dbraw/zinc/21/49/54/535214954.db2.gz VIADGUKYQXGBBE-UHFFFAOYSA-N 1 2 317.383 4.274 20 0 DIADLO CCCC(=O)Nc1cccc(N[C@H]2C[C@@H](C)n3cc[nH+]c32)c1C ZINC000297126750 535352074 /nfs/dbraw/zinc/35/20/74/535352074.db2.gz YSFIAPXXTJEMET-WBMJQRKESA-N 1 2 312.417 4.048 20 0 DIADLO CCCC(CCC)c1nc(-c2ccnc(-n3cc[nH+]c3)c2)no1 ZINC000273848000 535360144 /nfs/dbraw/zinc/36/01/44/535360144.db2.gz LCIUCRZRQZHUIG-UHFFFAOYSA-N 1 2 311.389 4.001 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(-c2ccco2)o1)c1ccc(Cl)s1 ZINC000273551917 535806649 /nfs/dbraw/zinc/80/66/49/535806649.db2.gz XOLHDOOMJJVSHX-SECBINFHSA-N 1 2 323.805 4.285 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(-c2ccco2)o1)c1ccc(Cl)s1 ZINC000273551923 535923684 /nfs/dbraw/zinc/92/36/84/535923684.db2.gz XOLHDOOMJJVSHX-VIFPVBQESA-N 1 2 323.805 4.285 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1ccc(Cl)s1 ZINC000273480306 535943064 /nfs/dbraw/zinc/94/30/64/535943064.db2.gz HZGJBKHRGKTHES-SCZZXKLOSA-N 1 2 311.838 4.464 20 0 DIADLO COC[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1cccc(Cl)c1 ZINC000288825941 536720092 /nfs/dbraw/zinc/72/00/92/536720092.db2.gz NNYUVUWEBBCHLT-CQSZACIVSA-N 1 2 322.836 4.103 20 0 DIADLO COCC[C@@H]([NH2+]Cc1csc(C2CCCC2)n1)c1ccco1 ZINC000273212675 536805032 /nfs/dbraw/zinc/80/50/32/536805032.db2.gz BXNYJFDLHGWYMF-OAHLLOKOSA-N 1 2 320.458 4.261 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2Cl)cc1O ZINC000289510567 536898594 /nfs/dbraw/zinc/89/85/94/536898594.db2.gz AISATOJEIITLFM-JTQLQIEISA-N 1 2 309.768 4.044 20 0 DIADLO CCO[C@H]1CCC[N@@H+](Cc2cc(F)c(Cl)cc2Cl)C1 ZINC001232700454 1054105047 /nfs/dbraw/zinc/10/50/47/1054105047.db2.gz KEORVDGGAWLRLI-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO CC(C)CCC(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000044567933 1035505679 /nfs/dbraw/zinc/50/56/79/1035505679.db2.gz BNTOFIAQDDPNMY-UHFFFAOYSA-N 1 2 311.429 4.261 20 0 DIADLO CCCC1(c2nc(-c3ccccc3-n3cc[nH+]c3)no2)CCC1 ZINC001211488135 1035525220 /nfs/dbraw/zinc/52/52/20/1035525220.db2.gz HVBBKJWZZBRLDF-UHFFFAOYSA-N 1 2 308.385 4.144 20 0 DIADLO CC(C)c1ccc(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000029435859 1035698271 /nfs/dbraw/zinc/69/82/71/1035698271.db2.gz POUIQAWFBOCZCH-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO Cc1ccc(Nc2nn(C[NH+]3CCCC3)c(=S)s2)cc1C ZINC000021318993 1035700624 /nfs/dbraw/zinc/70/06/24/1035700624.db2.gz IQQJMKRIFXBQJY-UHFFFAOYSA-N 1 2 320.487 4.088 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2nc3ccc(F)cc3s2)o1 ZINC000683200513 1035720366 /nfs/dbraw/zinc/72/03/66/1035720366.db2.gz APVUIOUCGVNXFB-MFKMUULPSA-N 1 2 316.401 4.442 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@H]2c2cccc(Cl)c2)cn1 ZINC001139933358 1035727075 /nfs/dbraw/zinc/72/70/75/1035727075.db2.gz ZRHBFNCPAOKBHV-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@H]2c2cccc(Cl)c2)cn1 ZINC001139933358 1035727094 /nfs/dbraw/zinc/72/70/94/1035727094.db2.gz ZRHBFNCPAOKBHV-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO COc1cc(F)c(C[N@H+]([C@H](C)c2ccco2)C2CC2)cc1OC ZINC000579841521 1035794616 /nfs/dbraw/zinc/79/46/16/1035794616.db2.gz FNNDBPZVKCDEBH-GFCCVEGCSA-N 1 2 319.376 4.162 20 0 DIADLO COc1cc(F)c(C[N@@H+]([C@H](C)c2ccco2)C2CC2)cc1OC ZINC000579841521 1035794629 /nfs/dbraw/zinc/79/46/29/1035794629.db2.gz FNNDBPZVKCDEBH-GFCCVEGCSA-N 1 2 319.376 4.162 20 0 DIADLO CCc1noc(C[NH2+][C@H](c2ccc(C(C)C)cc2)C(C)C)n1 ZINC000127043171 1035800655 /nfs/dbraw/zinc/80/06/55/1035800655.db2.gz FSAACWJBWACDOW-SFHVURJKSA-N 1 2 301.434 4.242 20 0 DIADLO CCc1noc(C[NH2+][C@@H](c2ccc(C(C)C)cc2)C(C)C)n1 ZINC000127042935 1035800965 /nfs/dbraw/zinc/80/09/65/1035800965.db2.gz FSAACWJBWACDOW-GOSISDBHSA-N 1 2 301.434 4.242 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2Oc2ccccc2)cc[nH+]1 ZINC000010163152 1035830302 /nfs/dbraw/zinc/83/03/02/1035830302.db2.gz KNNYAHDZUODVTE-UHFFFAOYSA-N 1 2 304.349 4.435 20 0 DIADLO CCC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001125300831 1035836587 /nfs/dbraw/zinc/83/65/87/1035836587.db2.gz FAOPAVUSUWMZLM-UKRRQHHQSA-N 1 2 315.392 4.166 20 0 DIADLO CC[C@H]1CCC[C@]1(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001125301516 1035845193 /nfs/dbraw/zinc/84/51/93/1035845193.db2.gz UJYPEYSXRBUVQO-UGSOOPFHSA-N 1 2 315.392 4.166 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2cccc(F)c2Cl)C2CC2)s1 ZINC000579857198 1035847909 /nfs/dbraw/zinc/84/79/09/1035847909.db2.gz NGTHOMUNCOLFSC-AWEZNQCLSA-N 1 2 310.825 4.485 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1ccc2c(c1)CCCC2 ZINC000154325950 1035866363 /nfs/dbraw/zinc/86/63/63/1035866363.db2.gz NCWHVRADWDMDAV-CYBMUJFWSA-N 1 2 313.445 4.097 20 0 DIADLO Cc1cncc(C[N@H+](Cc2nc3ccccc3s2)C2CC2)c1 ZINC000932394684 1035878544 /nfs/dbraw/zinc/87/85/44/1035878544.db2.gz NWGKTKSZBZGCPE-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO Cc1cncc(C[N@@H+](Cc2nc3ccccc3s2)C2CC2)c1 ZINC000932394684 1035878563 /nfs/dbraw/zinc/87/85/63/1035878563.db2.gz NWGKTKSZBZGCPE-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1ccncc1Br ZINC000625042030 1035894556 /nfs/dbraw/zinc/89/45/56/1035894556.db2.gz DFENFFXJZCSTCH-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccncc1Br ZINC000625042030 1035894577 /nfs/dbraw/zinc/89/45/77/1035894577.db2.gz DFENFFXJZCSTCH-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1ccco1)[N@H+](Cc1c[nH]c(-c2ccccc2)n1)C1CC1 ZINC000179610386 1035904517 /nfs/dbraw/zinc/90/45/17/1035904517.db2.gz BMUYNDCAOIIELO-CQSZACIVSA-N 1 2 307.397 4.395 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](Cc1c[nH]c(-c2ccccc2)n1)C1CC1 ZINC000179610386 1035904526 /nfs/dbraw/zinc/90/45/26/1035904526.db2.gz BMUYNDCAOIIELO-CQSZACIVSA-N 1 2 307.397 4.395 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cccc(OC(F)(F)F)c1)C2 ZINC001204431773 1035917657 /nfs/dbraw/zinc/91/76/57/1035917657.db2.gz GQSYODAPZQPHNO-UHFFFAOYSA-N 1 2 323.314 4.110 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cccc(OC(F)(F)F)c1)C2 ZINC001204431773 1035917674 /nfs/dbraw/zinc/91/76/74/1035917674.db2.gz GQSYODAPZQPHNO-UHFFFAOYSA-N 1 2 323.314 4.110 20 0 DIADLO CC(C)CCn1cccc1CNc1ccc(N2CCCC2)[nH+]c1 ZINC000533446812 1035919977 /nfs/dbraw/zinc/91/99/77/1035919977.db2.gz FJFMYMCBTXHHOC-UHFFFAOYSA-N 1 2 312.461 4.142 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1nnc2n1CCCCC2)c1ccc(Cl)s1 ZINC000037140689 1035951617 /nfs/dbraw/zinc/95/16/17/1035951617.db2.gz CHZQBOARMQPVET-GHMZBOCLSA-N 1 2 324.881 4.131 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(Cl)n1C)c1ccc(Cl)cc1Cl ZINC000037302060 1035999448 /nfs/dbraw/zinc/99/94/48/1035999448.db2.gz PLQZVWXYCHWRSN-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO COc1cc(C)c[nH+]c1N(Cc1ccccn1)C1CCCCC1 ZINC001167102855 1036054366 /nfs/dbraw/zinc/05/43/66/1036054366.db2.gz UMGNKZLTMMTWSI-UHFFFAOYSA-N 1 2 311.429 4.133 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+](CC)Cc1ccc(Cl)c(Cl)c1 ZINC001167115725 1036109331 /nfs/dbraw/zinc/10/93/31/1036109331.db2.gz IQGMUCQLPBHIAL-LLVKDONJSA-N 1 2 318.244 4.157 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+](CC)Cc1ccc(Cl)c(Cl)c1 ZINC001167115725 1036109341 /nfs/dbraw/zinc/10/93/41/1036109341.db2.gz IQGMUCQLPBHIAL-LLVKDONJSA-N 1 2 318.244 4.157 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+](Cc1cc(F)ccc1Cl)CC2 ZINC001167206464 1036271564 /nfs/dbraw/zinc/27/15/64/1036271564.db2.gz QHKLHIBJHGGCRK-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+](Cc1cc(F)ccc1Cl)CC2 ZINC001167206464 1036271578 /nfs/dbraw/zinc/27/15/78/1036271578.db2.gz QHKLHIBJHGGCRK-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CCCCCCN(Cc1ccco1)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000890940956 1036479281 /nfs/dbraw/zinc/47/92/81/1036479281.db2.gz MTBAHHXPJXMRHA-INIZCTEOSA-N 1 2 317.433 4.036 20 0 DIADLO CCCC[N@H+](Cc1ccccc1F)Cc1cccnc1OC ZINC001167294868 1036487743 /nfs/dbraw/zinc/48/77/43/1036487743.db2.gz YTYMMQGHGFHUTN-UHFFFAOYSA-N 1 2 302.393 4.032 20 0 DIADLO CCCC[N@@H+](Cc1ccccc1F)Cc1cccnc1OC ZINC001167294868 1036487750 /nfs/dbraw/zinc/48/77/50/1036487750.db2.gz YTYMMQGHGFHUTN-UHFFFAOYSA-N 1 2 302.393 4.032 20 0 DIADLO Fc1ccc([C@@H]([NH2+][C@H]2CCCn3ccnc32)c2ccccc2)cc1 ZINC000655701736 1036494746 /nfs/dbraw/zinc/49/47/46/1036494746.db2.gz YXGPAKSQINULTE-OALUTQOASA-N 1 2 321.399 4.236 20 0 DIADLO Cc1cc(C[NH2+]Cc2cnc(-c3ccc(C)c(C)c3)s2)no1 ZINC000655720411 1036497561 /nfs/dbraw/zinc/49/75/61/1036497561.db2.gz VQCDXIMIZHVCAH-UHFFFAOYSA-N 1 2 313.426 4.013 20 0 DIADLO COCC[C@H]([NH2+]Cc1nc2cc(C)ccc2s1)c1ccco1 ZINC000625318670 1036502639 /nfs/dbraw/zinc/50/26/39/1036502639.db2.gz JBNOTLDZTGZIGU-ZDUSSCGKSA-N 1 2 316.426 4.065 20 0 DIADLO Clc1ccccc1C1([NH2+][C@H]2CCCn3ccnc32)CCC1 ZINC000655790905 1036544440 /nfs/dbraw/zinc/54/44/40/1036544440.db2.gz DBDSMXBGKNMONW-HNNXBMFYSA-N 1 2 301.821 4.040 20 0 DIADLO Clc1ccccc1C1([NH2+][C@@H]2CCCn3ccnc32)CCC1 ZINC000655790909 1036545126 /nfs/dbraw/zinc/54/51/26/1036545126.db2.gz DBDSMXBGKNMONW-OAHLLOKOSA-N 1 2 301.821 4.040 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)c(N(C)C)[nH+]1 ZINC001266516176 1036589480 /nfs/dbraw/zinc/58/94/80/1036589480.db2.gz UALTXHYNQJCBKR-BZUAXINKSA-N 1 2 315.461 4.001 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(/C=C/c3ccc(N)cc3)cc2)cc1N ZINC001210288792 1036594958 /nfs/dbraw/zinc/59/49/58/1036594958.db2.gz VMKWLROOMTWBTD-NSCUHMNNSA-N 1 2 316.408 4.468 20 0 DIADLO Cc1[nH+]cc(Nc2cc(Oc3ccccc3)ccc2N)cc1N ZINC001210290006 1036595029 /nfs/dbraw/zinc/59/50/29/1036595029.db2.gz DPQZXMVYHWYVCV-UHFFFAOYSA-N 1 2 306.369 4.090 20 0 DIADLO CCn1c[nH+]cc1CNc1cc(OC)c(Cl)cc1C1CC1 ZINC000655863993 1036620103 /nfs/dbraw/zinc/62/01/03/1036620103.db2.gz WIIKVLNFCGVEKX-UHFFFAOYSA-N 1 2 305.809 4.055 20 0 DIADLO c1c[nH]c([C@H]([NH2+]Cc2coc3ccccc23)c2ccccc2)n1 ZINC000340445587 1036635940 /nfs/dbraw/zinc/63/59/40/1036635940.db2.gz FPFXRWKOINCCJO-GOSISDBHSA-N 1 2 303.365 4.035 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2cc(COC(C)(C)C)on2)c(C)o1 ZINC000683692561 1036716630 /nfs/dbraw/zinc/71/66/30/1036716630.db2.gz VPWSDHPJBXSAAW-GFCCVEGCSA-N 1 2 306.406 4.050 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2cc(COC(C)(C)C)on2)c(C)o1 ZINC000683692562 1036718734 /nfs/dbraw/zinc/71/87/34/1036718734.db2.gz VPWSDHPJBXSAAW-LBPRGKRZSA-N 1 2 306.406 4.050 20 0 DIADLO Cc1c([C@H](C)[NH2+]Cc2c(F)cc(F)cc2F)cnn1C(C)C ZINC000340492932 1036760055 /nfs/dbraw/zinc/76/00/55/1036760055.db2.gz WZRJMBDKXMOAKF-JTQLQIEISA-N 1 2 311.351 4.041 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1ccncc1F ZINC000340511317 1036776374 /nfs/dbraw/zinc/77/63/74/1036776374.db2.gz PXIKDNWBFPHMPJ-MRVPVSSYSA-N 1 2 300.711 4.003 20 0 DIADLO CCc1ccc([C@H](CC)[NH2+]Cc2ncn(-c3ccccc3)n2)cc1 ZINC000340521062 1036778241 /nfs/dbraw/zinc/77/82/41/1036778241.db2.gz CDUTZIWEXKBQOB-IBGZPJMESA-N 1 2 320.440 4.071 20 0 DIADLO Cc1cc(C)c(NC(=O)C2(Sc3ccccc3)CC2)c(C)[nH+]1 ZINC001125403751 1036807668 /nfs/dbraw/zinc/80/76/68/1036807668.db2.gz GLFPETSZGKLTDI-UHFFFAOYSA-N 1 2 312.438 4.270 20 0 DIADLO CCOc1c(Cl)cccc1C[NH2+]Cc1cc(C(C)C)no1 ZINC000683770007 1036878316 /nfs/dbraw/zinc/87/83/16/1036878316.db2.gz INDIVJCJNBTIJZ-UHFFFAOYSA-N 1 2 308.809 4.140 20 0 DIADLO O=C(Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CCCCC1 ZINC000044567528 1036910016 /nfs/dbraw/zinc/91/00/16/1036910016.db2.gz KBIMICCCAJDWON-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO Fc1ccc(F)c2c1CC[N@H+](Cc1ccc3cnccc3c1)C2 ZINC000683833256 1036994199 /nfs/dbraw/zinc/99/41/99/1036994199.db2.gz VGESVNOMCBFTAN-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1ccc(F)c2c1CC[N@@H+](Cc1ccc3cnccc3c1)C2 ZINC000683833256 1036994216 /nfs/dbraw/zinc/99/42/16/1036994216.db2.gz VGESVNOMCBFTAN-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO COc1c(F)cc(F)cc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001210865649 1037021734 /nfs/dbraw/zinc/02/17/34/1037021734.db2.gz SAQKKQFYTRYBBM-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO Clc1cc(C[NH2+][C@@H]2COCc3ccccc32)c(Cl)s1 ZINC000312764138 1037029270 /nfs/dbraw/zinc/02/92/70/1037029270.db2.gz XEVSRDWNDAQAGB-GFCCVEGCSA-N 1 2 314.237 4.416 20 0 DIADLO O=C(C/C=C\c1cccc(F)c1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000255309981 1037029433 /nfs/dbraw/zinc/02/94/33/1037029433.db2.gz CVHKPWKXGCGXOX-RQOWECAXSA-N 1 2 321.355 4.258 20 0 DIADLO c1cc(N2CCSCC2)ccc1[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000926092308 1037050562 /nfs/dbraw/zinc/05/05/62/1037050562.db2.gz XWZUHEJLKDIQPK-ZXFUBFMLSA-N 1 2 320.527 4.078 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2oc(C)nc2C)s1 ZINC000683897451 1037074529 /nfs/dbraw/zinc/07/45/29/1037074529.db2.gz CXNFJNOIFXNVQT-UHFFFAOYSA-N 1 2 316.426 4.457 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2oc(C)nc2C)s1 ZINC000683897451 1037074546 /nfs/dbraw/zinc/07/45/46/1037074546.db2.gz CXNFJNOIFXNVQT-UHFFFAOYSA-N 1 2 316.426 4.457 20 0 DIADLO C[C@H]([NH2+]C/C=C\c1ccccc1)c1nc(C2CCCCC2)no1 ZINC000255629630 1037222098 /nfs/dbraw/zinc/22/20/98/1037222098.db2.gz YJXONKNQJXXOSR-QIENPNARSA-N 1 2 311.429 4.481 20 0 DIADLO CC(C)[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)c1nc(C2CC2)no1 ZINC000089670916 1037260131 /nfs/dbraw/zinc/26/01/31/1037260131.db2.gz IPXQVUOPUDTHDN-HOTGVXAUSA-N 1 2 315.392 4.060 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)Sc2ccc(F)cc2)c(C)[nH+]1 ZINC001125473787 1037303378 /nfs/dbraw/zinc/30/33/78/1037303378.db2.gz MPWXLHQSOGYBLV-CYBMUJFWSA-N 1 2 318.417 4.265 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1ccco1 ZINC000261687897 1037311718 /nfs/dbraw/zinc/31/17/18/1037311718.db2.gz KMZBVUXFOMSWPU-PVAVHDDUSA-N 1 2 317.429 4.500 20 0 DIADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2)cs1)c1csnn1 ZINC000398265612 1037315406 /nfs/dbraw/zinc/31/54/06/1037315406.db2.gz GRFCQKJSWXITBZ-NSHDSACASA-N 1 2 301.440 4.117 20 0 DIADLO CC(C)[C@H]([NH2+][C@H]1C[C@@H](C)n2ncnc21)c1ccc(Cl)cc1F ZINC000926127894 1037349015 /nfs/dbraw/zinc/34/90/15/1037349015.db2.gz KRHJLQCXVGAGIO-ONERCXAPSA-N 1 2 322.815 4.063 20 0 DIADLO CCC[C@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1ccccn1 ZINC000684111926 1037360679 /nfs/dbraw/zinc/36/06/79/1037360679.db2.gz VEDVNDOWWLUHQR-ZDUSSCGKSA-N 1 2 303.475 4.467 20 0 DIADLO Cc1c[nH+]cc(Nc2ncc(Cl)cc2Br)c1C ZINC001213523234 1037375329 /nfs/dbraw/zinc/37/53/29/1037375329.db2.gz NTUNUOAZVXWLEF-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001143387538 1037411139 /nfs/dbraw/zinc/41/11/39/1037411139.db2.gz LQJYVNFWCOKOFL-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001143387538 1037411148 /nfs/dbraw/zinc/41/11/48/1037411148.db2.gz LQJYVNFWCOKOFL-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1ncccc1C[N@@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001207155164 1037468665 /nfs/dbraw/zinc/46/86/65/1037468665.db2.gz NWZOWUCVMKKAPZ-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ncccc1C[N@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001207155164 1037468682 /nfs/dbraw/zinc/46/86/82/1037468682.db2.gz NWZOWUCVMKKAPZ-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO c1csc([C@@H]([NH2+]Cc2ncc[nH]2)c2ccc3c(c2)CCCC3)c1 ZINC000067667500 1037518044 /nfs/dbraw/zinc/51/80/44/1037518044.db2.gz KTBYRNIUORPBCO-IBGZPJMESA-N 1 2 323.465 4.229 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](C)c2ccc3c(c2)CCCC3)n1 ZINC000128662917 1037519727 /nfs/dbraw/zinc/51/97/27/1037519727.db2.gz KRMOPJIZQOIQKE-AWEZNQCLSA-N 1 2 313.445 4.142 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)o1 ZINC000068813090 1037556834 /nfs/dbraw/zinc/55/68/34/1037556834.db2.gz HGYOUUUDCMGDIU-HNNXBMFYSA-N 1 2 319.424 4.383 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2noc(-c3ccsc3)n2)s1 ZINC000754674933 1037616553 /nfs/dbraw/zinc/61/65/53/1037616553.db2.gz NIDWXKFHCKKMOT-SNVBAGLBSA-N 1 2 305.428 4.019 20 0 DIADLO Cc1cn(C)nc1C[NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl ZINC000723495364 1037674731 /nfs/dbraw/zinc/67/47/31/1037674731.db2.gz DVPOHVIFUUIPAO-VIFPVBQESA-N 1 2 316.207 4.025 20 0 DIADLO c1[nH]c([C@H]2CCCC[N@H+]2Cc2ccccn2)nc1-c1ccccc1 ZINC000276270055 1037677806 /nfs/dbraw/zinc/67/78/06/1037677806.db2.gz CSDZRKNTUJYLSO-LJQANCHMSA-N 1 2 318.424 4.199 20 0 DIADLO c1[nH]c([C@H]2CCCC[N@@H+]2Cc2ccccn2)nc1-c1ccccc1 ZINC000276270055 1037677819 /nfs/dbraw/zinc/67/78/19/1037677819.db2.gz CSDZRKNTUJYLSO-LJQANCHMSA-N 1 2 318.424 4.199 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2nc(-c3ccc(C)cc3)no2)cc1 ZINC000061760784 1037684866 /nfs/dbraw/zinc/68/48/66/1037684866.db2.gz FDNBQEVYGDVQMV-UHFFFAOYSA-N 1 2 321.424 4.239 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2nc(-c3ccc(C)cc3)no2)cc1 ZINC000061760784 1037684875 /nfs/dbraw/zinc/68/48/75/1037684875.db2.gz FDNBQEVYGDVQMV-UHFFFAOYSA-N 1 2 321.424 4.239 20 0 DIADLO Fc1cccc(C[NH2+][C@H](c2ccccc2)c2ccccn2)c1F ZINC000073621081 1037722054 /nfs/dbraw/zinc/72/20/54/1037722054.db2.gz MGUOVCAXWHFECM-LJQANCHMSA-N 1 2 310.347 4.239 20 0 DIADLO c1csc(C[NH2+][C@H](COc2ccccc2)c2ccccc2)n1 ZINC000341215032 1037751953 /nfs/dbraw/zinc/75/19/53/1037751953.db2.gz CFQMRBYUVXVZQO-QGZVFWFLSA-N 1 2 310.422 4.053 20 0 DIADLO CCO[C@H](C)c1nc(C[NH2+][C@@H](C)c2cccc(OC)c2)cs1 ZINC000341218732 1037758849 /nfs/dbraw/zinc/75/88/49/1037758849.db2.gz KYKPQKODBZTXOE-QWHCGFSZSA-N 1 2 320.458 4.100 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1ccc(F)cc1 ZINC000090228744 1037761006 /nfs/dbraw/zinc/76/10/06/1037761006.db2.gz WWHRWZDJPCLBOL-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)CC2 ZINC000090228929 1037761272 /nfs/dbraw/zinc/76/12/72/1037761272.db2.gz GTQPVSQQNRFPON-AWEZNQCLSA-N 1 2 313.269 4.159 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@H](C)c3ccccc3C)cc2[nH+]1 ZINC000341282218 1037846521 /nfs/dbraw/zinc/84/65/21/1037846521.db2.gz PETSHERBKCYCNE-ZDUSSCGKSA-N 1 2 307.397 4.312 20 0 DIADLO Cc1cccc2[nH]c(CNc3ccc(N4CCCC4)[nH+]c3)cc21 ZINC000656769039 1037853855 /nfs/dbraw/zinc/85/38/55/1037853855.db2.gz QFJJVAMBHGZDPW-UHFFFAOYSA-N 1 2 306.413 4.084 20 0 DIADLO Cc1cccc2[nH]c(CNc3ccc(N4CCCC4)c[nH+]3)cc21 ZINC000656768921 1037855479 /nfs/dbraw/zinc/85/54/79/1037855479.db2.gz POXJARSPRYEZIS-UHFFFAOYSA-N 1 2 306.413 4.084 20 0 DIADLO CCOc1cc(CNc2ccc([NH+](C)C)cc2C)ccc1OC ZINC000121424698 1037890894 /nfs/dbraw/zinc/89/08/94/1037890894.db2.gz YKTZHVSOHONHII-UHFFFAOYSA-N 1 2 314.429 4.080 20 0 DIADLO Cc1[nH]c(CNc2ccc(Cl)c(Br)c2)[nH+]c1C ZINC000581677634 1037896717 /nfs/dbraw/zinc/89/67/17/1037896717.db2.gz IBTLYFMBGHCAEI-UHFFFAOYSA-N 1 2 314.614 4.055 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)n1C ZINC000341362303 1037920319 /nfs/dbraw/zinc/92/03/19/1037920319.db2.gz UKGRACJBDTWJIH-MRXNPFEDSA-N 1 2 309.816 4.008 20 0 DIADLO Cc1c[nH+]c(CNc2cc(Cl)cc(C(F)(F)F)c2)n1C ZINC000341393365 1037962460 /nfs/dbraw/zinc/96/24/60/1037962460.db2.gz LTOKJPIYOSUMJA-UHFFFAOYSA-N 1 2 303.715 4.013 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1NC(=O)CCc1c[nH]c[nH+]1 ZINC000684438008 1038054367 /nfs/dbraw/zinc/05/43/67/1038054367.db2.gz QEVKHYKLNPIONB-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1NC(=O)CCc1c[nH+]c[nH]1 ZINC000684438008 1038054384 /nfs/dbraw/zinc/05/43/84/1038054384.db2.gz QEVKHYKLNPIONB-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1cc(N(C)[C@@H](C)c2cc(F)ccc2F)nc(C2CC2)[nH+]1 ZINC000341483930 1038058481 /nfs/dbraw/zinc/05/84/81/1038058481.db2.gz KAVAJWOVTXRSIO-NSHDSACASA-N 1 2 303.356 4.138 20 0 DIADLO COc1cccc([C@@H]2CCCN2c2cc(C)[nH+]c(C3CC3)n2)c1 ZINC000341493440 1038062133 /nfs/dbraw/zinc/06/21/33/1038062133.db2.gz WXSMEYBYPJUOHL-KRWDZBQOSA-N 1 2 309.413 4.013 20 0 DIADLO CSCCC[NH2+][C@H](c1ccc(Br)cc1)C(F)F ZINC000598677782 1038151610 /nfs/dbraw/zinc/15/16/10/1038151610.db2.gz JKXIWQKRNTYMLQ-LLVKDONJSA-N 1 2 324.234 4.098 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@@H]3C[C@@H]3c3ccccc3)cc2[nH+]1 ZINC000341641577 1038198410 /nfs/dbraw/zinc/19/84/10/1038198410.db2.gz UXWVADVXGJWACZ-GOEBONIOSA-N 1 2 305.381 4.004 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@@H]3C[C@H]3c3ccccc3)cc2[nH+]1 ZINC000341641580 1038198725 /nfs/dbraw/zinc/19/87/25/1038198725.db2.gz UXWVADVXGJWACZ-HOCLYGCPSA-N 1 2 305.381 4.004 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)n1 ZINC000891796361 1038202502 /nfs/dbraw/zinc/20/25/02/1038202502.db2.gz MROZLONIRSEXII-OAHLLOKOSA-N 1 2 300.402 4.015 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)n1 ZINC000891796361 1038202515 /nfs/dbraw/zinc/20/25/15/1038202515.db2.gz MROZLONIRSEXII-OAHLLOKOSA-N 1 2 300.402 4.015 20 0 DIADLO CCCC(C)(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001125547977 1038209798 /nfs/dbraw/zinc/20/97/98/1038209798.db2.gz PITCUJKBBDFWGZ-UHFFFAOYSA-N 1 2 305.809 4.291 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1cccc(C)c1)c1ccccn1 ZINC000089797001 1038226681 /nfs/dbraw/zinc/22/66/81/1038226681.db2.gz ILKBNKORGOXAPG-OAQYLSRUSA-N 1 2 318.420 4.278 20 0 DIADLO FC(F)CC1C[NH+](Cc2c(Cl)cccc2OC(F)F)C1 ZINC000644906911 1038243321 /nfs/dbraw/zinc/24/33/21/1038243321.db2.gz XHONVTHWLFLIEH-UHFFFAOYSA-N 1 2 311.706 4.028 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](C)Cc2cccc(C)c2C)cs1 ZINC000091868353 1038269621 /nfs/dbraw/zinc/26/96/21/1038269621.db2.gz UNVCCGTUTQEJJY-CQSZACIVSA-N 1 2 304.459 4.099 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](C)Cc2cccc(C)c2C)cs1 ZINC000091868353 1038269631 /nfs/dbraw/zinc/26/96/31/1038269631.db2.gz UNVCCGTUTQEJJY-CQSZACIVSA-N 1 2 304.459 4.099 20 0 DIADLO CCn1ccnc1C[N@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000341815093 1038277311 /nfs/dbraw/zinc/27/73/11/1038277311.db2.gz WAZCYMVVBSUAMK-UHFFFAOYSA-N 1 2 305.425 4.221 20 0 DIADLO CCn1ccnc1C[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000341815093 1038277319 /nfs/dbraw/zinc/27/73/19/1038277319.db2.gz WAZCYMVVBSUAMK-UHFFFAOYSA-N 1 2 305.425 4.221 20 0 DIADLO Cc1cc(N(C)Cc2ccc(C(F)(F)F)cc2)nc(C2CC2)[nH+]1 ZINC000599429939 1038280689 /nfs/dbraw/zinc/28/06/89/1038280689.db2.gz SZWRHODSFJEAON-UHFFFAOYSA-N 1 2 321.346 4.318 20 0 DIADLO CCn1ccnc1C[N@H+](C)[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000341829008 1038285728 /nfs/dbraw/zinc/28/57/28/1038285728.db2.gz MERMQARMNGKGRU-GFCCVEGCSA-N 1 2 311.351 4.115 20 0 DIADLO CCn1ccnc1C[N@@H+](C)[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000341829008 1038285735 /nfs/dbraw/zinc/28/57/35/1038285735.db2.gz MERMQARMNGKGRU-GFCCVEGCSA-N 1 2 311.351 4.115 20 0 DIADLO Clc1ccccc1C1([NH2+]Cc2nc3c(s2)CCC3)CC1 ZINC000647223978 1038301395 /nfs/dbraw/zinc/30/13/95/1038301395.db2.gz DSDWDJIPPSIESB-UHFFFAOYSA-N 1 2 304.846 4.064 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000133514646 1038303749 /nfs/dbraw/zinc/30/37/49/1038303749.db2.gz XDYNYXVERBMKPQ-LBPRGKRZSA-N 1 2 304.459 4.300 20 0 DIADLO FC(F)(F)CC1CC[NH+](Cc2nccn2-c2ccccc2)CC1 ZINC000341988431 1038362037 /nfs/dbraw/zinc/36/20/37/1038362037.db2.gz ITLQLVKZLOMDKO-UHFFFAOYSA-N 1 2 323.362 4.037 20 0 DIADLO c1coc([C@H]2CCCCC[N@H+]2Cc2nc(C3CCCC3)no2)c1 ZINC000153983828 1038384299 /nfs/dbraw/zinc/38/42/99/1038384299.db2.gz XVSKYPLKVIUOOA-OAHLLOKOSA-N 1 2 315.417 4.438 20 0 DIADLO c1coc([C@H]2CCCCC[N@@H+]2Cc2nc(C3CCCC3)no2)c1 ZINC000153983828 1038384305 /nfs/dbraw/zinc/38/43/05/1038384305.db2.gz XVSKYPLKVIUOOA-OAHLLOKOSA-N 1 2 315.417 4.438 20 0 DIADLO CC(C)c1ccc(-c2noc(C[NH+]3CCC(F)(F)CC3)n2)cc1 ZINC000684623491 1038402379 /nfs/dbraw/zinc/40/23/79/1038402379.db2.gz CUBHUNQOABHLPW-UHFFFAOYSA-N 1 2 321.371 4.091 20 0 DIADLO FC1(F)CC[NH+](Cc2nc(C3CCCCC3)cs2)CC1 ZINC000684626271 1038408285 /nfs/dbraw/zinc/40/82/85/1038408285.db2.gz UPGBHSVLHHUCDJ-UHFFFAOYSA-N 1 2 300.418 4.422 20 0 DIADLO COc1cccc(C[NH2+][C@H](c2ccco2)c2ccccc2OC)c1 ZINC000151135309 1038431928 /nfs/dbraw/zinc/43/19/28/1038431928.db2.gz OBLHFFQAZKWKAH-FQEVSTJZSA-N 1 2 323.392 4.176 20 0 DIADLO COc1ccc(C[NH2+][C@H](c2ccco2)c2ccccc2OC)cc1 ZINC000151123830 1038433001 /nfs/dbraw/zinc/43/30/01/1038433001.db2.gz JZVJHLNXHFXHLZ-FQEVSTJZSA-N 1 2 323.392 4.176 20 0 DIADLO Cc1cc(N2CCC[C@@](C)(c3ccccc3)C2)nc(C2CC2)[nH+]1 ZINC000604756529 1038449457 /nfs/dbraw/zinc/44/94/57/1038449457.db2.gz JISNTAOUEVRGKI-HXUWFJFHSA-N 1 2 307.441 4.221 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(F)c(F)c2)[nH]1 ZINC000277207871 1038450827 /nfs/dbraw/zinc/45/08/27/1038450827.db2.gz KAXGSDSDYFSBNF-HBNTYKKESA-N 1 2 308.376 4.008 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@@H](Cc2ccccc2)c2cccs2)n1 ZINC000604891898 1038463234 /nfs/dbraw/zinc/46/32/34/1038463234.db2.gz FSOHDYQTDYMBBB-WFASDCNBSA-N 1 2 313.426 4.074 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000061858348 1038468039 /nfs/dbraw/zinc/46/80/39/1038468039.db2.gz DVXFMCMXXPDFIA-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000061858348 1038468047 /nfs/dbraw/zinc/46/80/47/1038468047.db2.gz DVXFMCMXXPDFIA-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO Cc1nc(C[NH2+]Cc2cc(Cl)ccc2OCC2CC2)cs1 ZINC000684662978 1038479031 /nfs/dbraw/zinc/47/90/31/1038479031.db2.gz RXDPGGPSZXBMMY-UHFFFAOYSA-N 1 2 322.861 4.184 20 0 DIADLO CCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nccc(C)n1 ZINC000342231312 1038489185 /nfs/dbraw/zinc/48/91/85/1038489185.db2.gz NWPYZKCTXPWPDJ-QGZVFWFLSA-N 1 2 313.445 4.061 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H]2CC(C)(C)Cc3occc32)[nH]1 ZINC000277296336 1038490788 /nfs/dbraw/zinc/49/07/88/1038490788.db2.gz RPQANIJXUVIPMB-SCRDCRAPSA-N 1 2 316.449 4.276 20 0 DIADLO CC[N@@H+](c1ccc(Nc2nccc(C(F)(F)F)n2)cc1)C(C)C ZINC000071840349 1038491015 /nfs/dbraw/zinc/49/10/15/1038491015.db2.gz KISZVZCXBUBATI-UHFFFAOYSA-N 1 2 324.350 4.474 20 0 DIADLO CC[N@H+](c1ccc(Nc2nccc(C(F)(F)F)n2)cc1)C(C)C ZINC000071840349 1038491019 /nfs/dbraw/zinc/49/10/19/1038491019.db2.gz KISZVZCXBUBATI-UHFFFAOYSA-N 1 2 324.350 4.474 20 0 DIADLO CCCc1nc(C[N@@H+]2CCCCC[C@H]2c2cccc(C)c2)no1 ZINC000605157020 1038493543 /nfs/dbraw/zinc/49/35/43/1038493543.db2.gz GCOKDOFZBMRCQV-KRWDZBQOSA-N 1 2 313.445 4.448 20 0 DIADLO CCCc1nc(C[N@H+]2CCCCC[C@H]2c2cccc(C)c2)no1 ZINC000605157020 1038493547 /nfs/dbraw/zinc/49/35/47/1038493547.db2.gz GCOKDOFZBMRCQV-KRWDZBQOSA-N 1 2 313.445 4.448 20 0 DIADLO CCc1ccc(-c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)cc1 ZINC000605258056 1038497231 /nfs/dbraw/zinc/49/72/31/1038497231.db2.gz UXKAGODYVKWWHA-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2cc(F)cc(F)c2)[nH]1 ZINC000277311767 1038499672 /nfs/dbraw/zinc/49/96/72/1038499672.db2.gz SOSQEOLEBOGIKC-HBNTYKKESA-N 1 2 308.376 4.008 20 0 DIADLO Cc1nnc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)s1 ZINC000342262087 1038505625 /nfs/dbraw/zinc/50/56/25/1038505625.db2.gz CJQOJWQZLOOWDV-CQSZACIVSA-N 1 2 311.401 4.002 20 0 DIADLO C[C@H]([NH2+]Cc1csc(Cc2ccccc2)n1)c1cncs1 ZINC000934200802 1038512362 /nfs/dbraw/zinc/51/23/62/1038512362.db2.gz ICNHIYAABMVBEQ-LBPRGKRZSA-N 1 2 315.467 4.041 20 0 DIADLO Fc1cc2cccnc2c(COc2ccccc2-n2cc[nH+]c2)c1 ZINC000605434226 1038516979 /nfs/dbraw/zinc/51/69/79/1038516979.db2.gz PHLGRSFKKNYDJM-UHFFFAOYSA-N 1 2 319.339 4.139 20 0 DIADLO Fc1cccc2c1SCC[C@@H]2[NH2+]Cc1nc2ccccc2o1 ZINC000684710099 1038531800 /nfs/dbraw/zinc/53/18/00/1038531800.db2.gz DEFPZICJAIVGSI-ZDUSSCGKSA-N 1 2 314.385 4.294 20 0 DIADLO Cc1csc(C[NH2+]Cc2cc(F)c(C(F)(F)F)cc2F)n1 ZINC000342325036 1038534824 /nfs/dbraw/zinc/53/48/24/1038534824.db2.gz WHWWDSFLKQXVIN-UHFFFAOYSA-N 1 2 322.302 4.038 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(F)c1F)c1nc2c(s1)CCCC2 ZINC000605593924 1038536010 /nfs/dbraw/zinc/53/60/10/1038536010.db2.gz ROYWRVQEVAAFDR-JTQLQIEISA-N 1 2 308.397 4.151 20 0 DIADLO O=C(C[N@H+]1CCC[C@@H]1c1cccc(Cl)c1)Nc1ccccc1 ZINC000071953733 1038539698 /nfs/dbraw/zinc/53/96/98/1038539698.db2.gz LQBBELPIXVHTMP-QGZVFWFLSA-N 1 2 314.816 4.116 20 0 DIADLO O=C(C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1)Nc1ccccc1 ZINC000071953733 1038539700 /nfs/dbraw/zinc/53/97/00/1038539700.db2.gz LQBBELPIXVHTMP-QGZVFWFLSA-N 1 2 314.816 4.116 20 0 DIADLO Cc1nnsc1C[N@@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC000563218833 1038541707 /nfs/dbraw/zinc/54/17/07/1038541707.db2.gz XDIYVXREYVKBJB-CQSZACIVSA-N 1 2 307.850 4.227 20 0 DIADLO Cc1nnsc1C[N@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC000563218833 1038541709 /nfs/dbraw/zinc/54/17/09/1038541709.db2.gz XDIYVXREYVKBJB-CQSZACIVSA-N 1 2 307.850 4.227 20 0 DIADLO C/C(=C\c1ccccc1)CNc1ccc([NH+]2CCC(O)CC2)cc1 ZINC000172191506 1038560621 /nfs/dbraw/zinc/56/06/21/1038560621.db2.gz KXJSKPTVZZMFSY-BMRADRMJSA-N 1 2 322.452 4.163 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1csc(Cl)n1)C(C)(C)C ZINC000934289411 1038580845 /nfs/dbraw/zinc/58/08/45/1038580845.db2.gz NDXFYMQORXTZQM-ZDUSSCGKSA-N 1 2 309.866 4.377 20 0 DIADLO C[C@]1(F)CCC[N@H+](Cc2ccc(F)c(OC(F)(F)F)c2)C1 ZINC001143436370 1038582625 /nfs/dbraw/zinc/58/26/25/1038582625.db2.gz NNXQATFIQARCFS-ZDUSSCGKSA-N 1 2 309.278 4.048 20 0 DIADLO C[C@]1(F)CCC[N@@H+](Cc2ccc(F)c(OC(F)(F)F)c2)C1 ZINC001143436370 1038582626 /nfs/dbraw/zinc/58/26/26/1038582626.db2.gz NNXQATFIQARCFS-ZDUSSCGKSA-N 1 2 309.278 4.048 20 0 DIADLO Fc1ccc2oc(C[NH2+][C@H]3COc4cccc(Cl)c43)cc2c1 ZINC000342419255 1038585824 /nfs/dbraw/zinc/58/58/24/1038585824.db2.gz APUYTGIBXZIKBI-AWEZNQCLSA-N 1 2 317.747 4.449 20 0 DIADLO Cc1ccccc1C[N@@H+]1Cc2ccc(Br)cc2C1 ZINC000707943318 1038587764 /nfs/dbraw/zinc/58/77/64/1038587764.db2.gz SMOYUULWVAQQTN-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO Cc1ccccc1C[N@H+]1Cc2ccc(Br)cc2C1 ZINC000707943318 1038587769 /nfs/dbraw/zinc/58/77/69/1038587769.db2.gz SMOYUULWVAQQTN-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO CC[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1nc(C)cs1 ZINC000657350959 1038594330 /nfs/dbraw/zinc/59/43/30/1038594330.db2.gz YJQIQHPLZWRHAC-CQSZACIVSA-N 1 2 320.433 4.373 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(F)c(F)c1F)c1nc(C)cs1 ZINC000657352953 1038595545 /nfs/dbraw/zinc/59/55/45/1038595545.db2.gz WUWJYGMTPIXBHU-NSHDSACASA-N 1 2 300.349 4.110 20 0 DIADLO CCc1cccc2cc(C[NH2+]C(C)(C)c3nccs3)oc21 ZINC000657363039 1038604393 /nfs/dbraw/zinc/60/43/93/1038604393.db2.gz DSLCEHSMZJQVIQ-UHFFFAOYSA-N 1 2 300.427 4.477 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2cccc(OC3CC3)c2F)CC1 ZINC000657363658 1038607342 /nfs/dbraw/zinc/60/73/42/1038607342.db2.gz AESJWDKWZIRFAJ-UHFFFAOYSA-N 1 2 315.363 4.285 20 0 DIADLO C=C(Br)C[N@H+](Cc1cccc(Cl)c1)C(C)C ZINC000062640492 1038612383 /nfs/dbraw/zinc/61/23/83/1038612383.db2.gz CBBKKGLHGUAFSQ-UHFFFAOYSA-N 1 2 302.643 4.459 20 0 DIADLO C=C(Br)C[N@@H+](Cc1cccc(Cl)c1)C(C)C ZINC000062640492 1038612388 /nfs/dbraw/zinc/61/23/88/1038612388.db2.gz CBBKKGLHGUAFSQ-UHFFFAOYSA-N 1 2 302.643 4.459 20 0 DIADLO Cc1cn2cc(NC(=O)N(C)CCC3CCCCC3)ccc2[nH+]1 ZINC000606569681 1038614187 /nfs/dbraw/zinc/61/41/87/1038614187.db2.gz NZFJWHAUQVDRNN-UHFFFAOYSA-N 1 2 314.433 4.077 20 0 DIADLO CC[C@@H](C)N(Cc1ccccc1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606581525 1038616262 /nfs/dbraw/zinc/61/62/62/1038616262.db2.gz HABOOTVSPKWFLJ-OAHLLOKOSA-N 1 2 322.412 4.167 20 0 DIADLO CC(C)C[C@H](NC(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000606580349 1038616346 /nfs/dbraw/zinc/61/63/46/1038616346.db2.gz KZBBWWLKFDCPOY-KRWDZBQOSA-N 1 2 322.412 4.243 20 0 DIADLO CCc1cnc(C[NH2+]Cc2cc3cccc(CC)c3o2)s1 ZINC000657378565 1038620588 /nfs/dbraw/zinc/62/05/88/1038620588.db2.gz OSQHMSBRXOUPGM-UHFFFAOYSA-N 1 2 300.427 4.304 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2ccc(F)c(F)c2F)C2CC2)s1 ZINC000657380991 1038622560 /nfs/dbraw/zinc/62/25/60/1038622560.db2.gz NRGGFNFOKBKUOQ-AWEZNQCLSA-N 1 2 312.360 4.110 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@@H](c3cccs3)C2)s1 ZINC000582273122 1038624996 /nfs/dbraw/zinc/62/49/96/1038624996.db2.gz ZVDBDYBNRPKPGG-GFCCVEGCSA-N 1 2 311.497 4.105 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@@H](c3cccs3)C2)s1 ZINC000582273122 1038625002 /nfs/dbraw/zinc/62/50/02/1038625002.db2.gz ZVDBDYBNRPKPGG-GFCCVEGCSA-N 1 2 311.497 4.105 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+]Cc1nccn1C(C)C ZINC000657392933 1038634239 /nfs/dbraw/zinc/63/42/39/1038634239.db2.gz FWIBDYWBKUQZFN-INIZCTEOSA-N 1 2 315.461 4.240 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(-c3ccccc3)n2C)c(C)[nH+]1 ZINC000172724681 1038635117 /nfs/dbraw/zinc/63/51/17/1038635117.db2.gz QXDBGOQLZKXWHW-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nc(C(C)C)no2)o1 ZINC000606899419 1038637932 /nfs/dbraw/zinc/63/79/32/1038637932.db2.gz LVIJTAKIKMKIRB-HNNXBMFYSA-N 1 2 317.433 4.466 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@H+]2Cc2nc(C(C)C)no2)o1 ZINC000606899419 1038637934 /nfs/dbraw/zinc/63/79/34/1038637934.db2.gz LVIJTAKIKMKIRB-HNNXBMFYSA-N 1 2 317.433 4.466 20 0 DIADLO Cc1[nH]c(CNc2ccccc2SCC(F)(F)F)[nH+]c1C ZINC000657404342 1038642698 /nfs/dbraw/zinc/64/26/98/1038642698.db2.gz QCKGBWOKSBFSBP-UHFFFAOYSA-N 1 2 315.364 4.293 20 0 DIADLO CC1CC[NH+](Cc2nc(C(C)(C)C3=CCCCC3)no2)CC1 ZINC000582413907 1038659838 /nfs/dbraw/zinc/65/98/38/1038659838.db2.gz CYMHDNSJCCLFTI-UHFFFAOYSA-N 1 2 303.450 4.080 20 0 DIADLO CC1(C)CC[C@H](c2nc(-c3ccccc3-n3cc[nH+]c3)no2)C1 ZINC001211544596 1038661554 /nfs/dbraw/zinc/66/15/54/1038661554.db2.gz CZWWZTUUGMEQEU-ZDUSSCGKSA-N 1 2 308.385 4.216 20 0 DIADLO CC1(C)CC[C@@H](c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)C1 ZINC001211545146 1038667519 /nfs/dbraw/zinc/66/75/19/1038667519.db2.gz NUJNRKIUWOIWTK-CQSZACIVSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@H](O)C[N@H+](Cc1ccccc1)Cc1c(Cl)cccc1Cl ZINC000607358641 1038674577 /nfs/dbraw/zinc/67/45/77/1038674577.db2.gz BLEXJQIVZYOXTD-ZDUSSCGKSA-N 1 2 324.251 4.376 20 0 DIADLO C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1c(Cl)cccc1Cl ZINC000607358641 1038674580 /nfs/dbraw/zinc/67/45/80/1038674580.db2.gz BLEXJQIVZYOXTD-ZDUSSCGKSA-N 1 2 324.251 4.376 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCOc2ccccc2C1 ZINC000607356926 1038674588 /nfs/dbraw/zinc/67/45/88/1038674588.db2.gz FUYDZRBDJSULTA-HNNXBMFYSA-N 1 2 320.392 4.297 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCOc2ccccc2C1 ZINC000607356926 1038674591 /nfs/dbraw/zinc/67/45/91/1038674591.db2.gz FUYDZRBDJSULTA-HNNXBMFYSA-N 1 2 320.392 4.297 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@H]2c2cccc(F)c2F)c(C)[nH+]1 ZINC000607454909 1038678419 /nfs/dbraw/zinc/67/84/19/1038678419.db2.gz AAGUMXVDVRPREJ-KBPBESRZSA-N 1 2 316.351 4.027 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1cccc(F)c1OC(F)F ZINC000625981499 1038687730 /nfs/dbraw/zinc/68/77/30/1038687730.db2.gz VOWNSWPVXRPWNZ-SECBINFHSA-N 1 2 309.278 4.047 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1cccc(F)c1OC(F)F ZINC000625981499 1038687731 /nfs/dbraw/zinc/68/77/31/1038687731.db2.gz VOWNSWPVXRPWNZ-SECBINFHSA-N 1 2 309.278 4.047 20 0 DIADLO C[C@@H]1CCC[C@@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1 ZINC000607484602 1038688382 /nfs/dbraw/zinc/68/83/82/1038688382.db2.gz HEOVNWLDFIPWEV-CHWSQXEVSA-N 1 2 317.820 4.291 20 0 DIADLO CC(C)COc1cccc(C[N@@H+]2CCCC[C@H]2c2ncc[nH]2)c1 ZINC000342625882 1038693098 /nfs/dbraw/zinc/69/30/98/1038693098.db2.gz UIQTXMWBPRKKRK-SFHVURJKSA-N 1 2 313.445 4.172 20 0 DIADLO CC(C)COc1cccc(C[N@H+]2CCCC[C@H]2c2ncc[nH]2)c1 ZINC000342625882 1038693103 /nfs/dbraw/zinc/69/31/03/1038693103.db2.gz UIQTXMWBPRKKRK-SFHVURJKSA-N 1 2 313.445 4.172 20 0 DIADLO CC(C)n1ccnc1C[NH2+]Cc1ccc(-c2ccco2)cc1F ZINC000657454001 1038695860 /nfs/dbraw/zinc/69/58/60/1038695860.db2.gz GAGKQXZMAYSSLX-UHFFFAOYSA-N 1 2 313.376 4.153 20 0 DIADLO CC[C@H](C)c1ccccc1NC(=O)[C@H](C)[N@H+](C)Cc1ccoc1 ZINC000342639815 1038697630 /nfs/dbraw/zinc/69/76/30/1038697630.db2.gz OUAJKPIYCQJHID-GJZGRUSLSA-N 1 2 314.429 4.252 20 0 DIADLO CC[C@H](C)c1ccccc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccoc1 ZINC000342639815 1038697637 /nfs/dbraw/zinc/69/76/37/1038697637.db2.gz OUAJKPIYCQJHID-GJZGRUSLSA-N 1 2 314.429 4.252 20 0 DIADLO Fc1cccc(Cl)c1C[N@@H+]1CC[C@@H]1COCc1ccccc1 ZINC001203406597 1038711881 /nfs/dbraw/zinc/71/18/81/1038711881.db2.gz IYQVATHLONMJKG-OAHLLOKOSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1cccc(Cl)c1C[N@H+]1CC[C@@H]1COCc1ccccc1 ZINC001203406597 1038711888 /nfs/dbraw/zinc/71/18/88/1038711888.db2.gz IYQVATHLONMJKG-OAHLLOKOSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1ccc(C2=CC[N@H+](Cc3nc(C4CC4)cs3)CC2)cc1 ZINC000342695933 1038724453 /nfs/dbraw/zinc/72/44/53/1038724453.db2.gz GXOFRSDBAPQOQP-UHFFFAOYSA-N 1 2 314.429 4.449 20 0 DIADLO Fc1ccc(C2=CC[N@@H+](Cc3nc(C4CC4)cs3)CC2)cc1 ZINC000342695933 1038724458 /nfs/dbraw/zinc/72/44/58/1038724458.db2.gz GXOFRSDBAPQOQP-UHFFFAOYSA-N 1 2 314.429 4.449 20 0 DIADLO Fc1cccc(Cl)c1COc1cccc(-n2cc[nH+]c2)c1 ZINC000607723359 1038725669 /nfs/dbraw/zinc/72/56/69/1038725669.db2.gz XUBHRGHSNSSIAK-UHFFFAOYSA-N 1 2 302.736 4.244 20 0 DIADLO CC[C@H](C)[C@H](C(=O)Nc1cccc2[nH+]ccn21)c1ccccc1 ZINC000607714936 1038726117 /nfs/dbraw/zinc/72/61/17/1038726117.db2.gz NXDPMUCYMCBHDU-KSSFIOAISA-N 1 2 307.397 4.103 20 0 DIADLO CC(C)[N@H+](Cc1ccco1)Cc1ncc(-c2ccccc2F)o1 ZINC000607727797 1038727473 /nfs/dbraw/zinc/72/74/73/1038727473.db2.gz IFXSQNZDEWJBNA-UHFFFAOYSA-N 1 2 314.360 4.484 20 0 DIADLO CC(C)[N@@H+](Cc1ccco1)Cc1ncc(-c2ccccc2F)o1 ZINC000607727797 1038727478 /nfs/dbraw/zinc/72/74/78/1038727478.db2.gz IFXSQNZDEWJBNA-UHFFFAOYSA-N 1 2 314.360 4.484 20 0 DIADLO Cc1cn2cc(NC(=O)CC[C@@H]3CCc4ccccc43)ccc2[nH+]1 ZINC001125612622 1038746666 /nfs/dbraw/zinc/74/66/66/1038746666.db2.gz CIGZMCOPRDUNHV-INIZCTEOSA-N 1 2 319.408 4.091 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]C2(c3nccs3)CCCC2)o1 ZINC000116374387 1038753271 /nfs/dbraw/zinc/75/32/71/1038753271.db2.gz VKJVXRWUXYNYBG-OCCSQVGLSA-N 1 2 302.443 4.419 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2nc(C3CC3)cs2)cc1 ZINC000342766929 1038764550 /nfs/dbraw/zinc/76/45/50/1038764550.db2.gz YULMLUXSVUVECM-MRXNPFEDSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2nc(C3CC3)cs2)cc1 ZINC000342766929 1038764558 /nfs/dbraw/zinc/76/45/58/1038764558.db2.gz YULMLUXSVUVECM-MRXNPFEDSA-N 1 2 302.418 4.497 20 0 DIADLO Cc1ccc2oc(C[NH2+][C@@H](c3nnc[nH]3)C3CCCCC3)cc2c1 ZINC000563444576 1038771128 /nfs/dbraw/zinc/77/11/28/1038771128.db2.gz PHSCRLBGKWUYFK-GOSISDBHSA-N 1 2 324.428 4.271 20 0 DIADLO Oc1cccc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)c1 ZINC000277820298 1038774177 /nfs/dbraw/zinc/77/41/77/1038774177.db2.gz ZXGBFNOTVZBQTI-UHFFFAOYSA-N 1 2 319.408 4.204 20 0 DIADLO CC[C@H](N[C@H](C[NH+](C)C)c1ccc(OC)cc1)c1ccccc1 ZINC000342785731 1038776442 /nfs/dbraw/zinc/77/64/42/1038776442.db2.gz SDMMZMIQBVPYAZ-VQTJNVASSA-N 1 2 312.457 4.039 20 0 DIADLO Nc1cc(Cl)ccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001213646259 1038780202 /nfs/dbraw/zinc/78/02/02/1038780202.db2.gz MLVWHFYJHJZXGZ-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO CCc1cnc(C[NH+](Cc2ccccc2)Cc2ccccc2)o1 ZINC000075616223 1038807361 /nfs/dbraw/zinc/80/73/61/1038807361.db2.gz MQZBRJRBGWSWGV-UHFFFAOYSA-N 1 2 306.409 4.439 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+]CCc2ccc3cn[nH]c3c2)cs1 ZINC000342805421 1038830055 /nfs/dbraw/zinc/83/00/55/1038830055.db2.gz GSEOVEBTIMATOK-GFCCVEGCSA-N 1 2 314.458 4.036 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[N@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000076496606 1038837988 /nfs/dbraw/zinc/83/79/88/1038837988.db2.gz USFVMYFTIXDLHS-CYBMUJFWSA-N 1 2 313.445 4.438 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[N@@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000076496606 1038838016 /nfs/dbraw/zinc/83/80/16/1038838016.db2.gz USFVMYFTIXDLHS-CYBMUJFWSA-N 1 2 313.445 4.438 20 0 DIADLO C[C@@H](Nc1cccc[nH+]1)c1ccc(OCc2cccnc2)cc1 ZINC000076720511 1038854246 /nfs/dbraw/zinc/85/42/46/1038854246.db2.gz DVTDHLLHLMEJBA-OAHLLOKOSA-N 1 2 305.381 4.229 20 0 DIADLO CCC(CC)(C(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000608477193 1038855418 /nfs/dbraw/zinc/85/54/18/1038855418.db2.gz RIJFBASUEURPIJ-UHFFFAOYSA-N 1 2 307.397 4.031 20 0 DIADLO CCO[C@H](C)c1nc(C[NH2+]C2(c3ccccc3)CC2)cs1 ZINC000076726717 1038855390 /nfs/dbraw/zinc/85/53/90/1038855390.db2.gz DMYKZBQTARWPAG-CYBMUJFWSA-N 1 2 302.443 4.020 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@H]2Cc2c(F)cccc2Cl)[nH]c1C ZINC000628144384 1038862568 /nfs/dbraw/zinc/86/25/68/1038862568.db2.gz AGGVUCYDQVOKOS-ZDUSSCGKSA-N 1 2 321.827 4.026 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@H]2Cc2c(F)cccc2Cl)[nH]c1C ZINC000628144384 1038862591 /nfs/dbraw/zinc/86/25/91/1038862591.db2.gz AGGVUCYDQVOKOS-ZDUSSCGKSA-N 1 2 321.827 4.026 20 0 DIADLO Cc1[nH]c(CN2CCC[C@H]2Cc2c(F)cccc2Cl)[nH+]c1C ZINC000628144384 1038862612 /nfs/dbraw/zinc/86/26/12/1038862612.db2.gz AGGVUCYDQVOKOS-ZDUSSCGKSA-N 1 2 321.827 4.026 20 0 DIADLO CCc1ccc(-c2noc(C[NH2+]C3(c4ccccc4)CC3)n2)cc1 ZINC000077378132 1038865601 /nfs/dbraw/zinc/86/56/01/1038865601.db2.gz PGDMSQZESHAMAW-UHFFFAOYSA-N 1 2 319.408 4.078 20 0 DIADLO COc1ccc(-c2cnc(C[NH2+]C3(c4ccccc4)CC3)o2)cc1 ZINC000077379100 1038867754 /nfs/dbraw/zinc/86/77/54/1038867754.db2.gz NVZZWPJPWCGBRF-UHFFFAOYSA-N 1 2 320.392 4.129 20 0 DIADLO CC[C@H](C)Oc1cc(C[NH2+][C@@H](C)c2cscn2)ccc1OC ZINC000657599696 1038900638 /nfs/dbraw/zinc/90/06/38/1038900638.db2.gz QIOHIHPNUYFHOI-STQMWFEESA-N 1 2 320.458 4.180 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc3ccccc23)C[C@@H](C(F)(F)F)O1 ZINC000608750528 1038911033 /nfs/dbraw/zinc/91/10/33/1038911033.db2.gz RUPUXMNHMNXZNW-YGRLFVJLSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc3ccccc23)C[C@@H](C(F)(F)F)O1 ZINC000608750528 1038911048 /nfs/dbraw/zinc/91/10/48/1038911048.db2.gz RUPUXMNHMNXZNW-YGRLFVJLSA-N 1 2 315.360 4.053 20 0 DIADLO FC(F)(F)c1cccnc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213085533 1038927270 /nfs/dbraw/zinc/92/72/70/1038927270.db2.gz KIIZLMFKQDJUSM-UHFFFAOYSA-N 1 2 304.275 4.234 20 0 DIADLO C[C@H](NCc1ccc(F)c(C[NH+](C)C)c1)c1cc(F)ccc1F ZINC000120842841 1039017823 /nfs/dbraw/zinc/01/78/23/1039017823.db2.gz FEDJNUGUQNWCPX-LBPRGKRZSA-N 1 2 322.374 4.016 20 0 DIADLO COCc1cnc(C[N@H+](Cc2ccc(C)c(C)c2)C2CC2)s1 ZINC000342933935 1039027292 /nfs/dbraw/zinc/02/72/92/1039027292.db2.gz PFLONOFLFKHTAZ-UHFFFAOYSA-N 1 2 316.470 4.071 20 0 DIADLO COCc1cnc(C[N@@H+](Cc2ccc(C)c(C)c2)C2CC2)s1 ZINC000342933935 1039027306 /nfs/dbraw/zinc/02/73/06/1039027306.db2.gz PFLONOFLFKHTAZ-UHFFFAOYSA-N 1 2 316.470 4.071 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](CCCc2ccccc2)c2ccccc2)o1 ZINC000121411088 1039048687 /nfs/dbraw/zinc/04/86/87/1039048687.db2.gz XIKVRZOTSWLIOS-IBGZPJMESA-N 1 2 321.424 4.232 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2scnc2C2CC2)cs1 ZINC000426155172 1039070571 /nfs/dbraw/zinc/07/05/71/1039070571.db2.gz YTLMIPCKFBROII-CYBMUJFWSA-N 1 2 305.472 4.123 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2scnc2C2CC2)cs1 ZINC000426155172 1039070591 /nfs/dbraw/zinc/07/05/91/1039070591.db2.gz YTLMIPCKFBROII-CYBMUJFWSA-N 1 2 305.472 4.123 20 0 DIADLO CCCn1c(C)nn(C[N@H+](CCC)Cc2ccccc2)c1=S ZINC000089649216 1039073179 /nfs/dbraw/zinc/07/31/79/1039073179.db2.gz DQSJANZYIHUDLU-UHFFFAOYSA-N 1 2 318.490 4.002 20 0 DIADLO CCCn1c(C)nn(C[N@@H+](CCC)Cc2ccccc2)c1=S ZINC000089649216 1039073193 /nfs/dbraw/zinc/07/31/93/1039073193.db2.gz DQSJANZYIHUDLU-UHFFFAOYSA-N 1 2 318.490 4.002 20 0 DIADLO C[N@H+](CC(=O)Nc1ccccc1C(C)(C)C)Cc1cccs1 ZINC000067127999 1039081392 /nfs/dbraw/zinc/08/13/92/1039081392.db2.gz ZYQPHBHZUDGGLR-UHFFFAOYSA-N 1 2 316.470 4.116 20 0 DIADLO C[N@@H+](CC(=O)Nc1ccccc1C(C)(C)C)Cc1cccs1 ZINC000067127999 1039081411 /nfs/dbraw/zinc/08/14/11/1039081411.db2.gz ZYQPHBHZUDGGLR-UHFFFAOYSA-N 1 2 316.470 4.116 20 0 DIADLO CCOC(=O)[C@H]1CCCC[N@@H+]1C/C=C\c1c(C)cc(C)cc1C ZINC001204601250 1039105742 /nfs/dbraw/zinc/10/57/42/1039105742.db2.gz DJXLJVVFLSBSOT-OLHLWXQYSA-N 1 2 315.457 4.043 20 0 DIADLO CCOC(=O)[C@H]1CCCC[N@H+]1C/C=C\c1c(C)cc(C)cc1C ZINC001204601250 1039105746 /nfs/dbraw/zinc/10/57/46/1039105746.db2.gz DJXLJVVFLSBSOT-OLHLWXQYSA-N 1 2 315.457 4.043 20 0 DIADLO Fc1ccccc1C=C1CC[NH+](Cc2cc(C3CC3)no2)CC1 ZINC000659997333 1039142021 /nfs/dbraw/zinc/14/20/21/1039142021.db2.gz IPMXNJFPWWNFDL-UHFFFAOYSA-N 1 2 312.388 4.371 20 0 DIADLO COc1cc(C)[nH+]c(CN(C)[C@H](C)c2cc3ccccc3o2)c1 ZINC000535279272 1039167997 /nfs/dbraw/zinc/16/79/97/1039167997.db2.gz CWFZAQZBWGFFNN-CQSZACIVSA-N 1 2 310.397 4.338 20 0 DIADLO CCc1ccc(C[NH2+][C@H](C)c2nc(-c3ccncc3)cs2)o1 ZINC000150803249 1039186740 /nfs/dbraw/zinc/18/67/40/1039186740.db2.gz DUXCOUGKLKMIPD-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO O=c1ccc2cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)c[nH]c-2c1 ZINC001213087558 1039204897 /nfs/dbraw/zinc/20/48/97/1039204897.db2.gz SWKLPBUBPLPHHL-UHFFFAOYSA-N 1 2 302.337 4.074 20 0 DIADLO Cc1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)n(CC2CCC2)n1 ZINC001213087555 1039207773 /nfs/dbraw/zinc/20/77/73/1039207773.db2.gz SPNBQYKCPDZFHE-UHFFFAOYSA-N 1 2 307.401 4.125 20 0 DIADLO CCOc1ccccc1Oc1ccc(CNc2cccc[nH+]2)cn1 ZINC000079944910 1039228236 /nfs/dbraw/zinc/22/82/36/1039228236.db2.gz APVHOHYXHUCLNB-UHFFFAOYSA-N 1 2 321.380 4.280 20 0 DIADLO c1cn(Cc2ccccc2)c(C[N@@H+]2CCC[C@@H]2c2ccsc2)n1 ZINC000079989369 1039238518 /nfs/dbraw/zinc/23/85/18/1039238518.db2.gz OYFYKCLGQQEIDC-GOSISDBHSA-N 1 2 323.465 4.330 20 0 DIADLO c1cn(Cc2ccccc2)c(C[N@H+]2CCC[C@@H]2c2ccsc2)n1 ZINC000079989369 1039238539 /nfs/dbraw/zinc/23/85/39/1039238539.db2.gz OYFYKCLGQQEIDC-GOSISDBHSA-N 1 2 323.465 4.330 20 0 DIADLO Cc1ccc(F)cc1C[N@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000491247141 1039239974 /nfs/dbraw/zinc/23/99/74/1039239974.db2.gz ARRICYOSXJCSGL-UHFFFAOYSA-N 1 2 309.388 4.060 20 0 DIADLO Cc1ccc(F)cc1C[N@@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000491247141 1039239982 /nfs/dbraw/zinc/23/99/82/1039239982.db2.gz ARRICYOSXJCSGL-UHFFFAOYSA-N 1 2 309.388 4.060 20 0 DIADLO CC(C)c1cc(N2CCC[C@@]3(CCCOC3)C2)nc(C(C)C)[nH+]1 ZINC000535593507 1039250762 /nfs/dbraw/zinc/25/07/62/1039250762.db2.gz VWKMGCYSJACHSE-LJQANCHMSA-N 1 2 317.477 4.120 20 0 DIADLO COCc1cnc(C[N@@H+](C)Cc2ccc(C(C)(C)C)cc2)s1 ZINC000539409515 1039257142 /nfs/dbraw/zinc/25/71/42/1039257142.db2.gz GJLCJTKPHNZCDD-UHFFFAOYSA-N 1 2 318.486 4.219 20 0 DIADLO COCc1cnc(C[N@H+](C)Cc2ccc(C(C)(C)C)cc2)s1 ZINC000539409515 1039257122 /nfs/dbraw/zinc/25/71/22/1039257122.db2.gz GJLCJTKPHNZCDD-UHFFFAOYSA-N 1 2 318.486 4.219 20 0 DIADLO C[N@H+](Cc1cnc(C(C)(C)C)s1)Cc1ccc(Cl)nc1 ZINC000125751869 1039268849 /nfs/dbraw/zinc/26/88/49/1039268849.db2.gz AHHSMMYCYSSMTF-UHFFFAOYSA-N 1 2 309.866 4.121 20 0 DIADLO C[N@@H+](Cc1cnc(C(C)(C)C)s1)Cc1ccc(Cl)nc1 ZINC000125751869 1039268861 /nfs/dbraw/zinc/26/88/61/1039268861.db2.gz AHHSMMYCYSSMTF-UHFFFAOYSA-N 1 2 309.866 4.121 20 0 DIADLO Cc1nc(C[NH2+][C@H]2CCCOc3ccc(Cl)cc32)cs1 ZINC000126541053 1039271382 /nfs/dbraw/zinc/27/13/82/1039271382.db2.gz HKNOIEOVVYFFSG-AWEZNQCLSA-N 1 2 308.834 4.108 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccccc2OC(F)(F)F)cs1 ZINC000126547369 1039273653 /nfs/dbraw/zinc/27/36/53/1039273653.db2.gz UDUAXHQVZFHLRP-SECBINFHSA-N 1 2 316.348 4.201 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2sccc2Br)s1 ZINC000125990408 1039278317 /nfs/dbraw/zinc/27/83/17/1039278317.db2.gz FFYJSVODHCFJIV-QMMMGPOBSA-N 1 2 317.277 4.126 20 0 DIADLO CCCOc1ccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000126015942 1039280108 /nfs/dbraw/zinc/28/01/08/1039280108.db2.gz HPWVVHMYNBORFR-LJQANCHMSA-N 1 2 321.424 4.078 20 0 DIADLO CCC1CC[NH+](Cc2ccnc(Cl)c2Br)CC1 ZINC001233179746 1039309298 /nfs/dbraw/zinc/30/92/98/1039309298.db2.gz GGOGTSUMIRNAEJ-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO CCc1nc(C)c([C@@H](C)Nc2ccc(N(CC)CC)[nH+]c2)s1 ZINC000539658894 1039313302 /nfs/dbraw/zinc/31/33/02/1039313302.db2.gz JSDAQIVLILCFKH-GFCCVEGCSA-N 1 2 318.490 4.428 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(F)cc2OC(F)F)cs1 ZINC000126626566 1039314842 /nfs/dbraw/zinc/31/48/42/1039314842.db2.gz KISJZYQQBWJQDH-QMMMGPOBSA-N 1 2 316.348 4.043 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000525640958 1039317004 /nfs/dbraw/zinc/31/70/04/1039317004.db2.gz LRNKJZDEMKTWBB-ZDUSSCGKSA-N 1 2 300.471 4.387 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000525640958 1039317023 /nfs/dbraw/zinc/31/70/23/1039317023.db2.gz LRNKJZDEMKTWBB-ZDUSSCGKSA-N 1 2 300.471 4.387 20 0 DIADLO COC[C@@H](C)C[NH2+]c1ccc(N2CCc3sccc3C2)cc1 ZINC000187587390 1039319145 /nfs/dbraw/zinc/31/91/45/1039319145.db2.gz DOKVMMBGEZWCGY-AWEZNQCLSA-N 1 2 316.470 4.005 20 0 DIADLO Cc1ccc2c(c1)[C@@H](Nc1ccc(-n3cc[nH+]c3)c(F)c1)CC2 ZINC000539734377 1039331117 /nfs/dbraw/zinc/33/11/17/1039331117.db2.gz FNJVZRFSLGELGG-SFHVURJKSA-N 1 2 307.372 4.419 20 0 DIADLO Cn1cccc1C[N@H+](C)Cc1cc(C(F)(F)F)ccc1Cl ZINC000539818681 1039344212 /nfs/dbraw/zinc/34/42/12/1039344212.db2.gz FDZAACQCRSBLEO-UHFFFAOYSA-N 1 2 316.754 4.329 20 0 DIADLO Cn1cccc1C[N@@H+](C)Cc1cc(C(F)(F)F)ccc1Cl ZINC000539818681 1039344226 /nfs/dbraw/zinc/34/42/26/1039344226.db2.gz FDZAACQCRSBLEO-UHFFFAOYSA-N 1 2 316.754 4.329 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc3ccc(Cl)cn23)[C@H]1c1ccccc1 ZINC000539825341 1039346137 /nfs/dbraw/zinc/34/61/37/1039346137.db2.gz RYAYLQFFVLAVAC-FZKQIMNGSA-N 1 2 311.816 4.181 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc3ccc(Cl)cn23)[C@H]1c1ccccc1 ZINC000539825341 1039346153 /nfs/dbraw/zinc/34/61/53/1039346153.db2.gz RYAYLQFFVLAVAC-FZKQIMNGSA-N 1 2 311.816 4.181 20 0 DIADLO Cc1ccccc1-c1cccc(C[N@@H+]2CCC[C@@H]2c2ncon2)c1 ZINC000539816662 1039346190 /nfs/dbraw/zinc/34/61/90/1039346190.db2.gz XQELRWWURRRTIO-LJQANCHMSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccccc1-c1cccc(C[N@H+]2CCC[C@@H]2c2ncon2)c1 ZINC000539816662 1039346208 /nfs/dbraw/zinc/34/62/08/1039346208.db2.gz XQELRWWURRRTIO-LJQANCHMSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccccc1-c1cccc(C[N@@H+]2CCC[C@H]2c2ncon2)c1 ZINC000539816661 1039346364 /nfs/dbraw/zinc/34/63/64/1039346364.db2.gz XQELRWWURRRTIO-IBGZPJMESA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccccc1-c1cccc(C[N@H+]2CCC[C@H]2c2ncon2)c1 ZINC000539816661 1039346376 /nfs/dbraw/zinc/34/63/76/1039346376.db2.gz XQELRWWURRRTIO-IBGZPJMESA-N 1 2 319.408 4.382 20 0 DIADLO Cc1nn(C(C)C)c(C)c1CNc1ccc([NH+](C)C)c(C)c1 ZINC000892340693 1039352567 /nfs/dbraw/zinc/35/25/67/1039352567.db2.gz PVZPQAPJQPIZOH-UHFFFAOYSA-N 1 2 300.450 4.067 20 0 DIADLO C[N@H+](C/C=C/c1ccc(F)cc1)Cc1nc2c(s1)CCCC2 ZINC000539830473 1039357203 /nfs/dbraw/zinc/35/72/03/1039357203.db2.gz YEMVRBIGXWKKLI-SNAWJCMRSA-N 1 2 316.445 4.306 20 0 DIADLO C[N@@H+](C/C=C/c1ccc(F)cc1)Cc1nc2c(s1)CCCC2 ZINC000539830473 1039357215 /nfs/dbraw/zinc/35/72/15/1039357215.db2.gz YEMVRBIGXWKKLI-SNAWJCMRSA-N 1 2 316.445 4.306 20 0 DIADLO C[C@]1(C(=O)Oc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C=CCC1 ZINC001272319001 1039385609 /nfs/dbraw/zinc/38/56/09/1039385609.db2.gz ADXCBQRCAJNSBV-FQEVSTJZSA-N 1 2 322.408 4.148 20 0 DIADLO Cc1cc(N2CCCO[C@@H](c3ccccc3)C2)nc(C2CCC2)[nH+]1 ZINC000892345938 1039402241 /nfs/dbraw/zinc/40/22/41/1039402241.db2.gz PTAISEITQHVRQN-GOSISDBHSA-N 1 2 323.440 4.021 20 0 DIADLO O=C1CCCc2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2N1 ZINC001213089851 1039417244 /nfs/dbraw/zinc/41/72/44/1039417244.db2.gz HVXFLUKXVVIGBS-UHFFFAOYSA-N 1 2 318.380 4.095 20 0 DIADLO C[C@H](N[C@@H]1C[N@H+](C)Cc2ccccc21)c1ccc(F)cc1Cl ZINC000540147939 1039427323 /nfs/dbraw/zinc/42/73/23/1039427323.db2.gz DJBFTRJXDIQDCH-KPZWWZAWSA-N 1 2 318.823 4.316 20 0 DIADLO C[C@H](N[C@@H]1C[N@@H+](C)Cc2ccccc21)c1ccc(F)cc1Cl ZINC000540147939 1039427331 /nfs/dbraw/zinc/42/73/31/1039427331.db2.gz DJBFTRJXDIQDCH-KPZWWZAWSA-N 1 2 318.823 4.316 20 0 DIADLO C[C@@H](N[C@H]1C[N@H+](C)Cc2ccccc21)c1ccc(F)cc1Cl ZINC000540147947 1039428258 /nfs/dbraw/zinc/42/82/58/1039428258.db2.gz DJBFTRJXDIQDCH-XIKOKIGWSA-N 1 2 318.823 4.316 20 0 DIADLO C[C@@H](N[C@H]1C[N@@H+](C)Cc2ccccc21)c1ccc(F)cc1Cl ZINC000540147947 1039428267 /nfs/dbraw/zinc/42/82/67/1039428267.db2.gz DJBFTRJXDIQDCH-XIKOKIGWSA-N 1 2 318.823 4.316 20 0 DIADLO C[C@@H]([NH2+][C@H]1CC(C)(C)Oc2cc(F)ccc21)c1cscn1 ZINC000540162546 1039440256 /nfs/dbraw/zinc/44/02/56/1039440256.db2.gz ADNPIAFLSJDRAG-MFKMUULPSA-N 1 2 306.406 4.235 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nnc(-c3ccc(F)cc3)[nH]2)cc1C ZINC000540219647 1039459770 /nfs/dbraw/zinc/45/97/70/1039459770.db2.gz HENYBSDCSWWYCZ-AWEZNQCLSA-N 1 2 324.403 4.078 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nc(-c3ccc(F)cc3)n[nH]2)cc1C ZINC000540219647 1039459777 /nfs/dbraw/zinc/45/97/77/1039459777.db2.gz HENYBSDCSWWYCZ-AWEZNQCLSA-N 1 2 324.403 4.078 20 0 DIADLO Cc1cc(C)cc([C@H](C)[NH2+]Cc2nnc(-c3ccc(F)cc3)[nH]2)c1 ZINC000540219964 1039460118 /nfs/dbraw/zinc/46/01/18/1039460118.db2.gz OBMKXPZBGXSSED-AWEZNQCLSA-N 1 2 324.403 4.078 20 0 DIADLO Cc1cc(C)cc([C@H](C)[NH2+]Cc2nc(-c3ccc(F)cc3)n[nH]2)c1 ZINC000540219964 1039460126 /nfs/dbraw/zinc/46/01/26/1039460126.db2.gz OBMKXPZBGXSSED-AWEZNQCLSA-N 1 2 324.403 4.078 20 0 DIADLO Cc1nc(C[N@@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)[nH]c1C ZINC000628130520 1039472478 /nfs/dbraw/zinc/47/24/78/1039472478.db2.gz BYDSQQVPPPHYCB-ZDUSSCGKSA-N 1 2 303.837 4.406 20 0 DIADLO Cc1nc(C[N@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)[nH]c1C ZINC000628130520 1039472485 /nfs/dbraw/zinc/47/24/85/1039472485.db2.gz BYDSQQVPPPHYCB-ZDUSSCGKSA-N 1 2 303.837 4.406 20 0 DIADLO Cc1[nH]c(CN([C@@H](C)c2ccc(Cl)cc2)C2CC2)[nH+]c1C ZINC000628130520 1039472489 /nfs/dbraw/zinc/47/24/89/1039472489.db2.gz BYDSQQVPPPHYCB-ZDUSSCGKSA-N 1 2 303.837 4.406 20 0 DIADLO O=C1CCCc2cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)ccc21 ZINC001213090967 1039483370 /nfs/dbraw/zinc/48/33/70/1039483370.db2.gz OZKOTFVSMCVBQK-UHFFFAOYSA-N 1 2 303.365 4.339 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC000540438975 1039493889 /nfs/dbraw/zinc/49/38/89/1039493889.db2.gz BMVMEBRKORZAPN-AWEZNQCLSA-N 1 2 307.397 4.150 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ncc(-c3ccccc3)s2)c1 ZINC000540507745 1039509523 /nfs/dbraw/zinc/50/95/23/1039509523.db2.gz NMQNKOBSQPMZQT-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ncc(-c3ccccc3)s2)c1 ZINC000540507745 1039509531 /nfs/dbraw/zinc/50/95/31/1039509531.db2.gz NMQNKOBSQPMZQT-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+]3CCc4sccc4C3)s2)o1 ZINC000349962835 1039525441 /nfs/dbraw/zinc/52/54/41/1039525441.db2.gz JIDIJTXFBAZBKJ-UHFFFAOYSA-N 1 2 316.451 4.331 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+]3CCc4sccc4C3)s2)o1 ZINC000349962835 1039525463 /nfs/dbraw/zinc/52/54/63/1039525463.db2.gz JIDIJTXFBAZBKJ-UHFFFAOYSA-N 1 2 316.451 4.331 20 0 DIADLO CCOc1ccc(C[NH2+][C@H](C)c2csc(CC)n2)cc1F ZINC000278544929 1039535836 /nfs/dbraw/zinc/53/58/36/1039535836.db2.gz UJHJHCBERWRPBJ-LLVKDONJSA-N 1 2 308.422 4.094 20 0 DIADLO COc1cccc([C@@H](C)[N@@H+]2CCc3c([nH]c4ccccc43)C2)c1 ZINC000536181060 1039536674 /nfs/dbraw/zinc/53/66/74/1039536674.db2.gz SNVQIRMGERWYLG-CQSZACIVSA-N 1 2 306.409 4.296 20 0 DIADLO COc1cccc([C@@H](C)[N@H+]2CCc3c([nH]c4ccccc43)C2)c1 ZINC000536181060 1039536687 /nfs/dbraw/zinc/53/66/87/1039536687.db2.gz SNVQIRMGERWYLG-CQSZACIVSA-N 1 2 306.409 4.296 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1ncc(C(F)(F)F)s1 ZINC000278564673 1039548529 /nfs/dbraw/zinc/54/85/29/1039548529.db2.gz CXBOVLFXHRHGGR-SECBINFHSA-N 1 2 316.348 4.021 20 0 DIADLO COc1cccc([C@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)c1 ZINC000540727616 1039553842 /nfs/dbraw/zinc/55/38/42/1039553842.db2.gz JLTXRXCSGCQYMZ-HNNXBMFYSA-N 1 2 311.429 4.254 20 0 DIADLO C[N@H+](Cc1nccn1C(F)F)Cc1ccc(C2CCC2)cc1 ZINC000278568684 1039557616 /nfs/dbraw/zinc/55/76/16/1039557616.db2.gz WNHAQANHZBGJAC-UHFFFAOYSA-N 1 2 305.372 4.178 20 0 DIADLO C[N@@H+](Cc1nccn1C(F)F)Cc1ccc(C2CCC2)cc1 ZINC000278568684 1039557631 /nfs/dbraw/zinc/55/76/31/1039557631.db2.gz WNHAQANHZBGJAC-UHFFFAOYSA-N 1 2 305.372 4.178 20 0 DIADLO CC(C)[C@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)CCO1 ZINC000540917314 1039595152 /nfs/dbraw/zinc/59/51/52/1039595152.db2.gz ZQAZSFKTCMHCKL-MRXNPFEDSA-N 1 2 308.491 4.048 20 0 DIADLO CC(C)[C@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)CCO1 ZINC000540917314 1039595166 /nfs/dbraw/zinc/59/51/66/1039595166.db2.gz ZQAZSFKTCMHCKL-MRXNPFEDSA-N 1 2 308.491 4.048 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1cccc(C(F)F)c1)n1cc[nH+]c1 ZINC000635470480 1039603079 /nfs/dbraw/zinc/60/30/79/1039603079.db2.gz GIENBFTZVDVYLB-AWEZNQCLSA-N 1 2 307.344 4.047 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1c[nH]nc1-c1ccccc1 ZINC000158920412 1039604787 /nfs/dbraw/zinc/60/47/87/1039604787.db2.gz SYPJKMIZETWMSD-UHFFFAOYSA-N 1 2 317.396 4.058 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1ncc(-c2ccccc2)o1 ZINC000541086506 1039619277 /nfs/dbraw/zinc/61/92/77/1039619277.db2.gz PQIDQBMFLUDLDV-OAHLLOKOSA-N 1 2 320.392 4.125 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1ncc(-c2ccccc2)o1 ZINC000541086506 1039619283 /nfs/dbraw/zinc/61/92/83/1039619283.db2.gz PQIDQBMFLUDLDV-OAHLLOKOSA-N 1 2 320.392 4.125 20 0 DIADLO Cc1cc(NCc2ncc(C(F)(F)F)s2)ccc1[NH+](C)C ZINC000278658791 1039627771 /nfs/dbraw/zinc/62/77/71/1039627771.db2.gz NDRIACULHOIPDO-UHFFFAOYSA-N 1 2 315.364 4.148 20 0 DIADLO FC(F)(F)C[C@@H]1CC[N@H+](Cc2nc(Cl)ccc2Cl)C1 ZINC000278659454 1039628265 /nfs/dbraw/zinc/62/82/65/1039628265.db2.gz HSRVLIJTOCPDKG-QMMMGPOBSA-N 1 2 313.150 4.163 20 0 DIADLO FC(F)(F)C[C@@H]1CC[N@@H+](Cc2nc(Cl)ccc2Cl)C1 ZINC000278659454 1039628270 /nfs/dbraw/zinc/62/82/70/1039628270.db2.gz HSRVLIJTOCPDKG-QMMMGPOBSA-N 1 2 313.150 4.163 20 0 DIADLO CCc1cnccc1[C@H](C)[NH2+][C@@H](C)c1nc(-c2ccccc2)no1 ZINC000541195456 1039637928 /nfs/dbraw/zinc/63/79/28/1039637928.db2.gz VWYJYPAXMZZJNH-KBPBESRZSA-N 1 2 322.412 4.106 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nccn2CCc2ccccc2)c(C)o1 ZINC000278699479 1039660296 /nfs/dbraw/zinc/66/02/96/1039660296.db2.gz KYKCQQYLAAYHGH-INIZCTEOSA-N 1 2 323.440 4.186 20 0 DIADLO C[C@@H]1C[N@H+](CCc2cccc(F)c2F)C[C@@H](c2ccsc2)O1 ZINC000541349604 1039670450 /nfs/dbraw/zinc/67/04/50/1039670450.db2.gz NLUAQKGQVIMFJH-WBMJQRKESA-N 1 2 323.408 4.031 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2cccc(F)c2F)C[C@@H](c2ccsc2)O1 ZINC000541349604 1039670459 /nfs/dbraw/zinc/67/04/59/1039670459.db2.gz NLUAQKGQVIMFJH-WBMJQRKESA-N 1 2 323.408 4.031 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccc(C)cc2OC(C)(C)C)s1 ZINC000541382713 1039677063 /nfs/dbraw/zinc/67/70/63/1039677063.db2.gz CEMLYPKMCFXYDL-UHFFFAOYSA-N 1 2 318.486 4.481 20 0 DIADLO COc1ccccc1C1([NH2+][C@H](C)c2nc(C)sc2C)CC1 ZINC000647329878 1039681485 /nfs/dbraw/zinc/68/14/85/1039681485.db2.gz YJXBWGQECWMCHU-LLVKDONJSA-N 1 2 302.443 4.108 20 0 DIADLO CC[N@H+](Cc1ncc(C(C)(C)C)o1)[C@H](C)c1cccc(O)c1 ZINC000080933038 1039688490 /nfs/dbraw/zinc/68/84/90/1039688490.db2.gz SCTQLUMFBKGVJK-CYBMUJFWSA-N 1 2 302.418 4.261 20 0 DIADLO CC[N@@H+](Cc1ncc(C(C)(C)C)o1)[C@H](C)c1cccc(O)c1 ZINC000080933038 1039688496 /nfs/dbraw/zinc/68/84/96/1039688496.db2.gz SCTQLUMFBKGVJK-CYBMUJFWSA-N 1 2 302.418 4.261 20 0 DIADLO CC(C)CCc1nc(C[NH2+][C@@H](C)c2cnn(C(C)C)c2)cs1 ZINC000541645073 1039724241 /nfs/dbraw/zinc/72/42/41/1039724241.db2.gz AMDSLKTXOFQCMP-AWEZNQCLSA-N 1 2 320.506 4.360 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2nccn2CC(C)C)C2CCC2)o1 ZINC000541735732 1039734475 /nfs/dbraw/zinc/73/44/75/1039734475.db2.gz CFOAOYMIOWANHK-GOSISDBHSA-N 1 2 301.434 4.072 20 0 DIADLO Cc1ccoc1C[NH2+]Cc1csc(CCc2ccccc2)n1 ZINC000083476615 1039736187 /nfs/dbraw/zinc/73/61/87/1039736187.db2.gz WECKBCVFSIGJLV-UHFFFAOYSA-N 1 2 312.438 4.120 20 0 DIADLO Cc1ccc(NC2CCC(C(=O)OC(C)(C)C)CC2)c(C)[nH+]1 ZINC000541755082 1039740804 /nfs/dbraw/zinc/74/08/04/1039740804.db2.gz HUAYDQIQMDLTRE-UHFFFAOYSA-N 1 2 304.434 4.011 20 0 DIADLO CC(C)c1cc(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)on1 ZINC000090093023 1039800841 /nfs/dbraw/zinc/80/08/41/1039800841.db2.gz MHOLBXYDKOYUTK-UHFFFAOYSA-N 1 2 302.422 4.447 20 0 DIADLO CC[C@H]1CCCCC[N@@H+]1Cc1ncc(Br)s1 ZINC000542167106 1039807658 /nfs/dbraw/zinc/80/76/58/1039807658.db2.gz IWKTXTRSYBZNGD-JTQLQIEISA-N 1 2 303.269 4.060 20 0 DIADLO CC[C@H]1CCCCC[N@H+]1Cc1ncc(Br)s1 ZINC000542167106 1039807686 /nfs/dbraw/zinc/80/76/86/1039807686.db2.gz IWKTXTRSYBZNGD-JTQLQIEISA-N 1 2 303.269 4.060 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@@H](C)c2ccc(F)cn2)c2ccccn2)c1 ZINC000090946509 1039807817 /nfs/dbraw/zinc/80/78/17/1039807817.db2.gz NWWYEJUAGKXCSC-MGPUTAFESA-N 1 2 321.399 4.364 20 0 DIADLO Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]Cc1ncccc1F ZINC000090720587 1039815078 /nfs/dbraw/zinc/81/50/78/1039815078.db2.gz YSMQTPJSBSVLOF-HNNXBMFYSA-N 1 2 320.795 4.186 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](C)C/C(C)=C/c2ccccc2)cs1 ZINC000091868489 1039860474 /nfs/dbraw/zinc/86/04/74/1039860474.db2.gz BVHMYTDUYKRUBW-YVGNARHYSA-N 1 2 316.470 4.386 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](C)C/C(C)=C/c2ccccc2)cs1 ZINC000091868489 1039860499 /nfs/dbraw/zinc/86/04/99/1039860499.db2.gz BVHMYTDUYKRUBW-YVGNARHYSA-N 1 2 316.470 4.386 20 0 DIADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1cnc(C2CCC2)s1 ZINC000091931406 1039861133 /nfs/dbraw/zinc/86/11/33/1039861133.db2.gz SPYGRSWMFYJKGG-UHFFFAOYSA-N 1 2 309.866 4.035 20 0 DIADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1cnc(C2CCC2)s1 ZINC000091931406 1039861160 /nfs/dbraw/zinc/86/11/60/1039861160.db2.gz SPYGRSWMFYJKGG-UHFFFAOYSA-N 1 2 309.866 4.035 20 0 DIADLO CCCc1csc(C[NH2+]Cc2ccc(C3CC3)cc2F)n1 ZINC000491594077 1039864132 /nfs/dbraw/zinc/86/41/32/1039864132.db2.gz MKCPNKSIFZBWGO-UHFFFAOYSA-N 1 2 304.434 4.402 20 0 DIADLO Fc1cc(C2CC2)ccc1C[NH2+]Cc1csc(C2CC2)n1 ZINC000491587614 1039865281 /nfs/dbraw/zinc/86/52/81/1039865281.db2.gz ZXKVCUBGEWBHEG-UHFFFAOYSA-N 1 2 302.418 4.327 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(-c2ccc(Cl)cc2)o1)c1ccsc1 ZINC000669937505 1039869666 /nfs/dbraw/zinc/86/96/66/1039869666.db2.gz JGDHNVJXBLXVGR-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)cs1)c1ccc(F)cn1 ZINC000092747197 1039886303 /nfs/dbraw/zinc/88/63/03/1039886303.db2.gz JCOFYWDAFDOJNW-MNOVXSKESA-N 1 2 307.438 4.387 20 0 DIADLO CCn1nc(C)c(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c1C ZINC000093686116 1039898924 /nfs/dbraw/zinc/89/89/24/1039898924.db2.gz IHLMYXILUWRQRW-KRWDZBQOSA-N 1 2 303.837 4.120 20 0 DIADLO CCn1nc(C)c(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)c1C ZINC000093686116 1039898952 /nfs/dbraw/zinc/89/89/52/1039898952.db2.gz IHLMYXILUWRQRW-KRWDZBQOSA-N 1 2 303.837 4.120 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)cc1O ZINC000093686109 1039900125 /nfs/dbraw/zinc/90/01/25/1039900125.db2.gz HEPMOHZHSMCSMX-OAHLLOKOSA-N 1 2 303.789 4.001 20 0 DIADLO COc1ccc(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)cc1O ZINC000093686109 1039900138 /nfs/dbraw/zinc/90/01/38/1039900138.db2.gz HEPMOHZHSMCSMX-OAHLLOKOSA-N 1 2 303.789 4.001 20 0 DIADLO Cc1ccc(F)cc1C[NH2+]C(C)(C)c1cc(C(F)(F)F)on1 ZINC000492051019 1039910007 /nfs/dbraw/zinc/91/00/07/1039910007.db2.gz VCWBBMAILAOJPS-UHFFFAOYSA-N 1 2 316.298 4.166 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](Cc3ccccc3)CCO2)c(Cl)c1 ZINC000143666539 1039947314 /nfs/dbraw/zinc/94/73/14/1039947314.db2.gz JPCVKIQFCZHGIY-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](Cc3ccccc3)CCO2)c(Cl)c1 ZINC000143666539 1039947329 /nfs/dbraw/zinc/94/73/29/1039947329.db2.gz JPCVKIQFCZHGIY-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cccc4ccccc43)CCCCC2)no1 ZINC000138834239 1039999447 /nfs/dbraw/zinc/99/94/47/1039999447.db2.gz DGSHBZIOFJURHL-UHFFFAOYSA-N 1 2 321.424 4.480 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2ccc(C(F)F)nc2)o1 ZINC000657886163 1039999500 /nfs/dbraw/zinc/99/95/00/1039999500.db2.gz CNJGTUOOOWGOLL-XHDPSFHLSA-N 1 2 324.371 4.213 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000175028067 1040002115 /nfs/dbraw/zinc/00/21/15/1040002115.db2.gz ITAOGFYQBHZTPA-MNOVXSKESA-N 1 2 304.356 4.307 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000175028067 1040002122 /nfs/dbraw/zinc/00/21/22/1040002122.db2.gz ITAOGFYQBHZTPA-MNOVXSKESA-N 1 2 304.356 4.307 20 0 DIADLO CCCc1nc(C[N@@H+]2CCCC[C@H]2c2cccn2C)cs1 ZINC000175136476 1040008103 /nfs/dbraw/zinc/00/81/03/1040008103.db2.gz AYLACDVTNZCWOE-INIZCTEOSA-N 1 2 303.475 4.161 20 0 DIADLO CCCc1nc(C[N@H+]2CCCC[C@H]2c2cccn2C)cs1 ZINC000175136476 1040008116 /nfs/dbraw/zinc/00/81/16/1040008116.db2.gz AYLACDVTNZCWOE-INIZCTEOSA-N 1 2 303.475 4.161 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC(C(F)(F)F)CC1 ZINC000175280104 1040019250 /nfs/dbraw/zinc/01/92/50/1040019250.db2.gz OEZWNCSUTMJJGQ-SNVBAGLBSA-N 1 2 304.356 4.307 20 0 DIADLO COc1cccc([C@H]2C[N@H+](Cc3ccc4occc4c3)CCO2)c1 ZINC000685416088 1040035617 /nfs/dbraw/zinc/03/56/17/1040035617.db2.gz CSIZOLUGWMQPNN-HXUWFJFHSA-N 1 2 323.392 4.015 20 0 DIADLO COc1cccc([C@H]2C[N@@H+](Cc3ccc4occc4c3)CCO2)c1 ZINC000685416088 1040035627 /nfs/dbraw/zinc/03/56/27/1040035627.db2.gz CSIZOLUGWMQPNN-HXUWFJFHSA-N 1 2 323.392 4.015 20 0 DIADLO Cc1ccc2[nH+]c(CSc3ccc(C(F)(F)F)cn3)cn2c1 ZINC000685419950 1040041553 /nfs/dbraw/zinc/04/15/53/1040041553.db2.gz PZEGYFPUHXEXEX-UHFFFAOYSA-N 1 2 323.343 4.349 20 0 DIADLO Cc1c(C)c(C)c(C[N@@H+](C)Cc2ncc(Cl)n2C)c(C)c1C ZINC001168446895 1040055348 /nfs/dbraw/zinc/05/53/48/1040055348.db2.gz CQSKLIYOKZIOHP-UHFFFAOYSA-N 1 2 319.880 4.248 20 0 DIADLO Cc1c(C)c(C)c(C[N@H+](C)Cc2ncc(Cl)n2C)c(C)c1C ZINC001168446895 1040055366 /nfs/dbraw/zinc/05/53/66/1040055366.db2.gz CQSKLIYOKZIOHP-UHFFFAOYSA-N 1 2 319.880 4.248 20 0 DIADLO c1cn(Cc2ccc(N[C@H]3CCC[C@H]3c3ccccc3)nc2)c[nH+]1 ZINC000685447611 1040055955 /nfs/dbraw/zinc/05/59/55/1040055955.db2.gz PKDQHAAVCCJFRJ-OALUTQOASA-N 1 2 318.424 4.075 20 0 DIADLO c1cn(Cc2ccc(N[C@@H]3CCC[C@@H]3c3ccccc3)nc2)c[nH+]1 ZINC000685447613 1040057006 /nfs/dbraw/zinc/05/70/06/1040057006.db2.gz PKDQHAAVCCJFRJ-RTBURBONSA-N 1 2 318.424 4.075 20 0 DIADLO Cc1noc([C@H](C)[N@H+](C)Cc2cc(-c3ccccc3)cs2)n1 ZINC000565229101 1040068822 /nfs/dbraw/zinc/06/88/22/1040068822.db2.gz KPYSFRRKNGRMTL-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1noc([C@H](C)[N@@H+](C)Cc2cc(-c3ccccc3)cs2)n1 ZINC000565229101 1040068836 /nfs/dbraw/zinc/06/88/36/1040068836.db2.gz KPYSFRRKNGRMTL-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1nc(C)c(C[N@@H+](C)[C@@H](C)c2ccccc2Br)o1 ZINC000685561792 1040128205 /nfs/dbraw/zinc/12/82/05/1040128205.db2.gz XDCOFWHPRLUNEK-NSHDSACASA-N 1 2 323.234 4.247 20 0 DIADLO Cc1nc(C)c(C[N@H+](C)[C@@H](C)c2ccccc2Br)o1 ZINC000685561792 1040128216 /nfs/dbraw/zinc/12/82/16/1040128216.db2.gz XDCOFWHPRLUNEK-NSHDSACASA-N 1 2 323.234 4.247 20 0 DIADLO CCC[N@H+](Cc1noc(-c2ccccc2)n1)Cc1ccccc1 ZINC000302876462 1040099884 /nfs/dbraw/zinc/09/98/84/1040099884.db2.gz OMPOHVMYVZBXEK-UHFFFAOYSA-N 1 2 307.397 4.149 20 0 DIADLO CCC[N@@H+](Cc1noc(-c2ccccc2)n1)Cc1ccccc1 ZINC000302876462 1040099901 /nfs/dbraw/zinc/09/99/01/1040099901.db2.gz OMPOHVMYVZBXEK-UHFFFAOYSA-N 1 2 307.397 4.149 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)c2cc3ccccc3o2)c(C)[nH+]1 ZINC000177576939 1040126324 /nfs/dbraw/zinc/12/63/24/1040126324.db2.gz MVOHBPGLPSBCOE-ZDUSSCGKSA-N 1 2 308.381 4.495 20 0 DIADLO CC[N@H+](Cc1oc(C)nc1C)Cc1ccccc1Br ZINC000685561675 1040129243 /nfs/dbraw/zinc/12/92/43/1040129243.db2.gz JKXQEDGIVIOJAB-UHFFFAOYSA-N 1 2 323.234 4.076 20 0 DIADLO CC[N@@H+](Cc1oc(C)nc1C)Cc1ccccc1Br ZINC000685561675 1040129252 /nfs/dbraw/zinc/12/92/52/1040129252.db2.gz JKXQEDGIVIOJAB-UHFFFAOYSA-N 1 2 323.234 4.076 20 0 DIADLO COc1ccc(C[N@H+](C)[C@@H](C)c2ncc(C(C)(C)C)o2)cc1C ZINC000177671825 1040132261 /nfs/dbraw/zinc/13/22/61/1040132261.db2.gz UXJASTLEKOXXTI-AWEZNQCLSA-N 1 2 316.445 4.482 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@@H](C)c2ncc(C(C)(C)C)o2)cc1C ZINC000177671825 1040132272 /nfs/dbraw/zinc/13/22/72/1040132272.db2.gz UXJASTLEKOXXTI-AWEZNQCLSA-N 1 2 316.445 4.482 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)o1 ZINC000685572656 1040138351 /nfs/dbraw/zinc/13/83/51/1040138351.db2.gz XDPKNYLXEVVUHB-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)cc1 ZINC000685570800 1040139463 /nfs/dbraw/zinc/13/94/63/1040139463.db2.gz FAWZQQNQJNPEBT-ZDUSSCGKSA-N 1 2 302.418 4.222 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1coc(-c2c(F)cccc2F)n1 ZINC000131424886 1040148685 /nfs/dbraw/zinc/14/86/85/1040148685.db2.gz NIVINFSYPUQIDC-UHFFFAOYSA-N 1 2 320.364 4.313 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1coc(-c2c(F)cccc2F)n1 ZINC000131424886 1040148695 /nfs/dbraw/zinc/14/86/95/1040148695.db2.gz NIVINFSYPUQIDC-UHFFFAOYSA-N 1 2 320.364 4.313 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2ccc(C(F)F)nc2)[nH]1 ZINC000657991347 1040254715 /nfs/dbraw/zinc/25/47/15/1040254715.db2.gz VERKYCWGIQVWPR-AXFHLTTASA-N 1 2 323.391 4.063 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(C(F)F)nc2)[nH]1 ZINC000657991350 1040255803 /nfs/dbraw/zinc/25/58/03/1040255803.db2.gz VERKYCWGIQVWPR-HBNTYKKESA-N 1 2 323.391 4.063 20 0 DIADLO COc1cc2ccc([C@H](C)[NH2+]CC(C)(F)F)cc2cc1OC ZINC000658024356 1040273470 /nfs/dbraw/zinc/27/34/70/1040273470.db2.gz WUBIZCKTCCHYEU-NSHDSACASA-N 1 2 309.356 4.163 20 0 DIADLO Cc1ccccc1C(F)(F)C[NH2+][C@@H](C)Cc1ccn(C(C)C)n1 ZINC000658315954 1040416529 /nfs/dbraw/zinc/41/65/29/1040416529.db2.gz YDBMOERFYPXBHU-HNNXBMFYSA-N 1 2 321.415 4.085 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@H](C)c2nccn2C)c2cccc(F)c2)c1 ZINC000658337381 1040427030 /nfs/dbraw/zinc/42/70/30/1040427030.db2.gz DEDUCPDYZTVVCM-BEFAXECRSA-N 1 2 323.415 4.308 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@H](c2ccccc2)[C@H](C)O)cs1 ZINC000658359795 1040441236 /nfs/dbraw/zinc/44/12/36/1040441236.db2.gz HVRKGZAMFHOMKF-XEZPLFJOSA-N 1 2 304.459 4.039 20 0 DIADLO Cc1cnc(=S)n(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1 ZINC000179460915 1040464094 /nfs/dbraw/zinc/46/40/94/1040464094.db2.gz AZMWWGLVMDMMQW-HNNXBMFYSA-N 1 2 319.861 4.369 20 0 DIADLO Cc1cnc(=S)n(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1 ZINC000179460915 1040464105 /nfs/dbraw/zinc/46/41/05/1040464105.db2.gz AZMWWGLVMDMMQW-HNNXBMFYSA-N 1 2 319.861 4.369 20 0 DIADLO Cc1ncccc1C[N@@H+](C)Cc1c(Cl)ncc2ccccc21 ZINC001140726249 1040471952 /nfs/dbraw/zinc/47/19/52/1040471952.db2.gz JZSHFYGGAYDAMN-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO Cc1ncccc1C[N@H+](C)Cc1c(Cl)ncc2ccccc21 ZINC001140726249 1040471967 /nfs/dbraw/zinc/47/19/67/1040471967.db2.gz JZSHFYGGAYDAMN-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO c1coc(C[N@H+](Cc2nc(C3CCCC3)no2)C2CCCC2)c1 ZINC000132568279 1040478661 /nfs/dbraw/zinc/47/86/61/1040478661.db2.gz HWZQLXBIGODIQX-UHFFFAOYSA-N 1 2 315.417 4.265 20 0 DIADLO c1coc(C[N@@H+](Cc2nc(C3CCCC3)no2)C2CCCC2)c1 ZINC000132568279 1040478668 /nfs/dbraw/zinc/47/86/68/1040478668.db2.gz HWZQLXBIGODIQX-UHFFFAOYSA-N 1 2 315.417 4.265 20 0 DIADLO Cc1ccc(F)c(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000278784218 1040517213 /nfs/dbraw/zinc/51/72/13/1040517213.db2.gz PZZZHEUVKKERSX-VIFPVBQESA-N 1 2 318.339 4.460 20 0 DIADLO CO[C@@H]1CCC[N@H+](Cn2c(-c3ccccc3)csc2=S)C1 ZINC000177142326 1040540170 /nfs/dbraw/zinc/54/01/70/1040540170.db2.gz KKWICZYQXLPJNK-CQSZACIVSA-N 1 2 320.483 4.014 20 0 DIADLO CO[C@@H]1CCC[N@@H+](Cn2c(-c3ccccc3)csc2=S)C1 ZINC000177142326 1040540193 /nfs/dbraw/zinc/54/01/93/1040540193.db2.gz KKWICZYQXLPJNK-CQSZACIVSA-N 1 2 320.483 4.014 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2ccc(F)cc2Cl)CC2CC2)o1 ZINC000628271135 1040570616 /nfs/dbraw/zinc/57/06/16/1040570616.db2.gz NXYMZGVXUUWYIC-UHFFFAOYSA-N 1 2 308.784 4.188 20 0 DIADLO Cc1ncc(C[N@H+](Cc2ccc(F)cc2Cl)CC2CC2)o1 ZINC000628271135 1040570637 /nfs/dbraw/zinc/57/06/37/1040570637.db2.gz NXYMZGVXUUWYIC-UHFFFAOYSA-N 1 2 308.784 4.188 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2csc(C(F)(F)F)c2)c1 ZINC000926660583 1040572235 /nfs/dbraw/zinc/57/22/35/1040572235.db2.gz LCMGMCUOPWRBCL-VIFPVBQESA-N 1 2 316.348 4.481 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000924540751 1040572719 /nfs/dbraw/zinc/57/27/19/1040572719.db2.gz GKDOXENAUGERTE-JGVFFNPUSA-N 1 2 300.189 4.097 20 0 DIADLO C#CC[N@@H+](CN1c2cccc3cccc(c23)C1=O)C1CCCCC1 ZINC000065943459 1040610390 /nfs/dbraw/zinc/61/03/90/1040610390.db2.gz LGCBLUJNTASCMU-UHFFFAOYSA-N 1 2 318.420 4.025 20 0 DIADLO C#CC[N@H+](CN1c2cccc3cccc(c23)C1=O)C1CCCCC1 ZINC000065943459 1040610397 /nfs/dbraw/zinc/61/03/97/1040610397.db2.gz LGCBLUJNTASCMU-UHFFFAOYSA-N 1 2 318.420 4.025 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CC[C@H](OC(F)F)C1 ZINC000570227850 1040674770 /nfs/dbraw/zinc/67/47/70/1040674770.db2.gz RJMMJUGLPSQTPJ-WPRPVWTQSA-N 1 2 310.171 4.368 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CC[C@H](OC(F)F)C1 ZINC000570227850 1040674782 /nfs/dbraw/zinc/67/47/82/1040674782.db2.gz RJMMJUGLPSQTPJ-WPRPVWTQSA-N 1 2 310.171 4.368 20 0 DIADLO CC(C)[C@@H]([NH2+][C@H](C)c1cn(C(C)C)nn1)c1ccccc1F ZINC000926692383 1040685697 /nfs/dbraw/zinc/68/56/97/1040685697.db2.gz IQPHBLUJVXNOJK-CXAGYDPISA-N 1 2 304.413 4.046 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCC1(F)F)c1ccc(Br)s1 ZINC000309551236 1040712317 /nfs/dbraw/zinc/71/23/17/1040712317.db2.gz IGYBDWRWZBKRBB-APPZFPTMSA-N 1 2 310.207 4.349 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000066155371 1040725040 /nfs/dbraw/zinc/72/50/40/1040725040.db2.gz YCNJPUXMDYSFFB-GFCCVEGCSA-N 1 2 317.820 4.321 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000066155371 1040725052 /nfs/dbraw/zinc/72/50/52/1040725052.db2.gz YCNJPUXMDYSFFB-GFCCVEGCSA-N 1 2 317.820 4.321 20 0 DIADLO Cc1c[nH]nc1C[N@H+](Cc1ccc(Cl)c(Cl)c1)C1CC1 ZINC000685834598 1040770265 /nfs/dbraw/zinc/77/02/65/1040770265.db2.gz ISHPVGBUIUJGRU-UHFFFAOYSA-N 1 2 310.228 4.190 20 0 DIADLO Cc1c[nH]nc1C[N@@H+](Cc1ccc(Cl)c(Cl)c1)C1CC1 ZINC000685834598 1040770280 /nfs/dbraw/zinc/77/02/80/1040770280.db2.gz ISHPVGBUIUJGRU-UHFFFAOYSA-N 1 2 310.228 4.190 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C1CCC(c2ccccc2)CC1 ZINC001625884528 1040779253 /nfs/dbraw/zinc/77/92/53/1040779253.db2.gz PYKWNTQAXUHUCW-UHFFFAOYSA-N 1 2 308.425 4.033 20 0 DIADLO Cc1cn[nH]c1C[N@H+]1CC=C(c2ccc(Cl)c(Cl)c2)CC1 ZINC000685843231 1040785426 /nfs/dbraw/zinc/78/54/26/1040785426.db2.gz VJCJKZXBLKHNAG-UHFFFAOYSA-N 1 2 322.239 4.314 20 0 DIADLO Cc1cn[nH]c1C[N@@H+]1CC=C(c2ccc(Cl)c(Cl)c2)CC1 ZINC000685843231 1040785442 /nfs/dbraw/zinc/78/54/42/1040785442.db2.gz VJCJKZXBLKHNAG-UHFFFAOYSA-N 1 2 322.239 4.314 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccc(F)cc1F)C(C)(C)C)c1ccn(C)n1 ZINC000414115258 1040882668 /nfs/dbraw/zinc/88/26/68/1040882668.db2.gz PIIVDGGBUITVFX-ZBEGNZNMSA-N 1 2 307.388 4.136 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1Cl)c1cc2n(n1)CCC2 ZINC000414130532 1040904966 /nfs/dbraw/zinc/90/49/66/1040904966.db2.gz WQAXRGAFQNSOFA-GHMZBOCLSA-N 1 2 307.800 4.034 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccccc2F)C2CCCCC2)o1 ZINC000173666223 1040913616 /nfs/dbraw/zinc/91/36/16/1040913616.db2.gz AVXLOZAKZLRYKV-UHFFFAOYSA-N 1 2 302.393 4.457 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccccc2F)C2CCCCC2)o1 ZINC000173666223 1040913632 /nfs/dbraw/zinc/91/36/32/1040913632.db2.gz AVXLOZAKZLRYKV-UHFFFAOYSA-N 1 2 302.393 4.457 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+][C@@H](C)c1nc2c(s1)CCC2 ZINC000414137247 1040913768 /nfs/dbraw/zinc/91/37/68/1040913768.db2.gz DXBYYZJASZEJHS-RYUDHWBXSA-N 1 2 301.459 4.001 20 0 DIADLO FC(F)(F)[C@H]1C[C@H](Nc2cccc[nH+]2)C[C@@H](C(F)(F)F)C1 ZINC000613438210 1040952472 /nfs/dbraw/zinc/95/24/72/1040952472.db2.gz VINVTRBKYDMNEO-MYJAWHEDSA-N 1 2 312.257 4.403 20 0 DIADLO Cc1ncc(C[NH2+][C@H](C)c2cc(Cl)ccc2OC(F)F)o1 ZINC000414180535 1040966158 /nfs/dbraw/zinc/96/61/58/1040966158.db2.gz LLNDMKYQFLDFMN-MRVPVSSYSA-N 1 2 316.735 4.089 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C=Cc1cc(Cl)cc(Cl)c1 ZINC001625884890 1040971959 /nfs/dbraw/zinc/97/19/59/1040971959.db2.gz VYBKVJRFHPGQKY-ARJAWSKDSA-N 1 2 321.207 4.079 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c21)c1ccn(C)n1 ZINC000414188475 1040972342 /nfs/dbraw/zinc/97/23/42/1040972342.db2.gz QSLQZOMVGYSZQL-YMTOWFKASA-N 1 2 310.228 4.065 20 0 DIADLO Clc1ccc(SCC[N@@H+]2CCC[C@H](c3ccn[nH]3)C2)cc1 ZINC000613509106 1041028693 /nfs/dbraw/zinc/02/86/93/1041028693.db2.gz GAOHXTYWGHWMMH-ZDUSSCGKSA-N 1 2 321.877 4.035 20 0 DIADLO Clc1ccc(SCC[N@H+]2CCC[C@H](c3ccn[nH]3)C2)cc1 ZINC000613509106 1041028710 /nfs/dbraw/zinc/02/87/10/1041028710.db2.gz GAOHXTYWGHWMMH-ZDUSSCGKSA-N 1 2 321.877 4.035 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1cc(O)cc(Cl)c1 ZINC001140797484 1041030096 /nfs/dbraw/zinc/03/00/96/1041030096.db2.gz AUQQNHZDWLUTPH-UHFFFAOYSA-N 1 2 317.816 4.139 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1cc(O)cc(Cl)c1 ZINC001140797484 1041030113 /nfs/dbraw/zinc/03/01/13/1041030113.db2.gz AUQQNHZDWLUTPH-UHFFFAOYSA-N 1 2 317.816 4.139 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)CCc2ccccc2F)c(C)[nH+]1 ZINC000175102280 1041032606 /nfs/dbraw/zinc/03/26/06/1041032606.db2.gz ZGPUALKMWKTWMQ-LBPRGKRZSA-N 1 2 314.404 4.353 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nccc(C(F)(F)F)n1)c1ccsc1 ZINC000414233751 1041034967 /nfs/dbraw/zinc/03/49/67/1041034967.db2.gz FIIZCHUBQJVWGN-LLVKDONJSA-N 1 2 315.364 4.188 20 0 DIADLO Cc1cn2c(cccc2Nc2cc(C(F)(F)F)cnc2C)[nH+]1 ZINC001213824428 1041072489 /nfs/dbraw/zinc/07/24/89/1041072489.db2.gz DMAVXNQGOXZPTC-UHFFFAOYSA-N 1 2 306.291 4.109 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2csnn2)cc1 ZINC000414310916 1041107404 /nfs/dbraw/zinc/10/74/04/1041107404.db2.gz XKWOERRVAJZCPI-STQMWFEESA-N 1 2 305.447 4.129 20 0 DIADLO CSc1ccc([C@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc1F ZINC000414325831 1041130336 /nfs/dbraw/zinc/13/03/36/1041130336.db2.gz MTPMRPGBTIYJMQ-VIFPVBQESA-N 1 2 323.462 4.127 20 0 DIADLO Cn1c(Cl)cnc1C[NH2+]C(c1cccs1)c1cccs1 ZINC000372981250 1041133146 /nfs/dbraw/zinc/13/31/46/1041133146.db2.gz PRZPIXYXXSLXKL-UHFFFAOYSA-N 1 2 323.874 4.076 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2csc(C(F)(F)F)n2)cc1 ZINC000892632996 1041167485 /nfs/dbraw/zinc/16/74/85/1041167485.db2.gz XVHTYTJDQOXOBU-JTQLQIEISA-N 1 2 300.349 4.321 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)nn1 ZINC000414371291 1041184513 /nfs/dbraw/zinc/18/45/13/1041184513.db2.gz NADWICDMWLFONC-NSHDSACASA-N 1 2 310.228 4.285 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)nn1 ZINC000414371291 1041184517 /nfs/dbraw/zinc/18/45/17/1041184517.db2.gz NADWICDMWLFONC-NSHDSACASA-N 1 2 310.228 4.285 20 0 DIADLO Clc1ccccc1SCCC[N@@H+]1Cc2ccncc2C1 ZINC000809565128 1041187568 /nfs/dbraw/zinc/18/75/68/1041187568.db2.gz UUBZQMVTQSSZDP-UHFFFAOYSA-N 1 2 304.846 4.233 20 0 DIADLO Clc1ccccc1SCCC[N@H+]1Cc2ccncc2C1 ZINC000809565128 1041187572 /nfs/dbraw/zinc/18/75/72/1041187572.db2.gz UUBZQMVTQSSZDP-UHFFFAOYSA-N 1 2 304.846 4.233 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2ccc(C(F)(F)F)c(C)c2)cs1 ZINC000414374480 1041191043 /nfs/dbraw/zinc/19/10/43/1041191043.db2.gz VYKFCLOZBPZJII-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2ccc(C(F)(F)F)c(C)c2)cs1 ZINC000414374480 1041191053 /nfs/dbraw/zinc/19/10/53/1041191053.db2.gz VYKFCLOZBPZJII-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO C=Cc1ccc(NCCc2ccc(OC(F)(F)F)cc2)[nH+]c1 ZINC001158460642 1041196385 /nfs/dbraw/zinc/19/63/85/1041196385.db2.gz UPIYZRZJDKJXTN-UHFFFAOYSA-N 1 2 308.303 4.278 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+][C@H]1CCCc2oc(C)nc21 ZINC000924582477 1041219278 /nfs/dbraw/zinc/21/92/78/1041219278.db2.gz RJIDIGNUCFHAQY-DOMZBBRYSA-N 1 2 300.402 4.028 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)n1 ZINC000176894082 1041219371 /nfs/dbraw/zinc/21/93/71/1041219371.db2.gz AMIYMCFRIWUTSM-JTQLQIEISA-N 1 2 306.397 4.215 20 0 DIADLO CC(C)(C)c1csc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)n1 ZINC000176894082 1041219391 /nfs/dbraw/zinc/21/93/91/1041219391.db2.gz AMIYMCFRIWUTSM-JTQLQIEISA-N 1 2 306.397 4.215 20 0 DIADLO Cc1cc(NCc2nccc3ccccc32)cc(OC(F)F)[nH+]1 ZINC001167704410 1041219497 /nfs/dbraw/zinc/21/94/97/1041219497.db2.gz PNOIPEKMHKLGFR-UHFFFAOYSA-N 1 2 315.323 4.152 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCc4ccccc4C3)co2)cc1 ZINC000024950212 1041219734 /nfs/dbraw/zinc/21/97/34/1041219734.db2.gz NLXHIJASRUYWOO-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCc4ccccc4C3)co2)cc1 ZINC000024950212 1041219750 /nfs/dbraw/zinc/21/97/50/1041219750.db2.gz NLXHIJASRUYWOO-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1ccsc1C(F)(F)F ZINC000926781347 1041221889 /nfs/dbraw/zinc/22/18/89/1041221889.db2.gz UTAMXFDXVIGCMY-JTQLQIEISA-N 1 2 316.348 4.231 20 0 DIADLO CCc1ccc([N@H+](CC)CC2CCC3(CC2)OCCO3)cc1 ZINC001167706151 1041224916 /nfs/dbraw/zinc/22/49/16/1041224916.db2.gz RNJTYROWFKICTJ-UHFFFAOYSA-N 1 2 303.446 4.009 20 0 DIADLO CCc1ccc([N@@H+](CC)CC2CCC3(CC2)OCCO3)cc1 ZINC001167706151 1041224939 /nfs/dbraw/zinc/22/49/39/1041224939.db2.gz RNJTYROWFKICTJ-UHFFFAOYSA-N 1 2 303.446 4.009 20 0 DIADLO CC(C)(C)[C@@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc(F)cc1 ZINC000375894963 1041226154 /nfs/dbraw/zinc/22/61/54/1041226154.db2.gz IBZHQRXWOMZILJ-RDJZCZTQSA-N 1 2 301.409 4.303 20 0 DIADLO CCCCOc1ccc([C@@H](C)Nc2cccc[nH+]2)cc1OC ZINC000613546687 1041265586 /nfs/dbraw/zinc/26/55/86/1041265586.db2.gz LGXBKGFAUCUFRN-CQSZACIVSA-N 1 2 300.402 4.442 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccccc1OC ZINC000809970964 1041279778 /nfs/dbraw/zinc/27/97/78/1041279778.db2.gz PVEQUXQCNGZZDB-HNNXBMFYSA-N 1 2 302.418 4.222 20 0 DIADLO Cl/C=C(/Cl)C[N@@H+]1CC[C@@H](Oc2ccc(Cl)cc2)C1 ZINC001170594943 1041299014 /nfs/dbraw/zinc/29/90/14/1041299014.db2.gz ZGRMENSAQSCEBQ-SVTZGKHISA-N 1 2 306.620 4.112 20 0 DIADLO Cl/C=C(/Cl)C[N@H+]1CC[C@@H](Oc2ccc(Cl)cc2)C1 ZINC001170594943 1041299018 /nfs/dbraw/zinc/29/90/18/1041299018.db2.gz ZGRMENSAQSCEBQ-SVTZGKHISA-N 1 2 306.620 4.112 20 0 DIADLO C[C@@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1ccnn1C1CCC1 ZINC000926807044 1041300679 /nfs/dbraw/zinc/30/06/79/1041300679.db2.gz AOGBELCGPMWDIZ-WBMJQRKESA-N 1 2 305.372 4.109 20 0 DIADLO CCc1nc(C[NH2+]Cc2cc(Cl)cc(Cl)c2)cs1 ZINC000107715992 1041312430 /nfs/dbraw/zinc/31/24/30/1041312430.db2.gz AICIZPRQJBOZNL-UHFFFAOYSA-N 1 2 301.242 4.302 20 0 DIADLO COc1ccc([NH2+]C[C@@H]2CC(C)=C[C@@H](C)C2)c(OC)c1OC ZINC000810149898 1041324065 /nfs/dbraw/zinc/32/40/65/1041324065.db2.gz WTFMEEXUDCKZNZ-OCCSQVGLSA-N 1 2 305.418 4.117 20 0 DIADLO COc1ccc([NH2+]C[C@H]2CC(C)=C[C@@H](C)C2)c(OC)c1OC ZINC000810149899 1041324772 /nfs/dbraw/zinc/32/47/72/1041324772.db2.gz WTFMEEXUDCKZNZ-TZMCWYRMSA-N 1 2 305.418 4.117 20 0 DIADLO Cc1cn2cc(NC(=O)c3c[nH]c4cc(Cl)ccc34)ccc2[nH+]1 ZINC000589484166 1041337543 /nfs/dbraw/zinc/33/75/43/1041337543.db2.gz CYBAUQKQPHUDRA-UHFFFAOYSA-N 1 2 324.771 4.030 20 0 DIADLO C[C@@H]([NH2+]CCN1C[C@H](C)C[C@H](C)C1)c1ccc(F)cc1Cl ZINC001170603802 1041378262 /nfs/dbraw/zinc/37/82/62/1041378262.db2.gz DUNNUJDVOWJQFU-HZSPNIEDSA-N 1 2 312.860 4.108 20 0 DIADLO Clc1ccc(C2([NH2+]Cc3nccn3C3CC3)CC2)cc1Cl ZINC000892801737 1041404786 /nfs/dbraw/zinc/40/47/86/1041404786.db2.gz QNJXEDJWRZZHMV-UHFFFAOYSA-N 1 2 322.239 4.304 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)NC[C@@H]1c2ccccc2C[N@H+]1C ZINC001132405730 1041425826 /nfs/dbraw/zinc/42/58/26/1041425826.db2.gz XEVQWAVVAPWVIJ-UYAOXDASSA-N 1 2 316.489 4.286 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)NC[C@@H]1c2ccccc2C[N@@H+]1C ZINC001132405730 1041425832 /nfs/dbraw/zinc/42/58/32/1041425832.db2.gz XEVQWAVVAPWVIJ-UYAOXDASSA-N 1 2 316.489 4.286 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+](C)Cc1nccs1 ZINC000175083506 1041436833 /nfs/dbraw/zinc/43/68/33/1041436833.db2.gz YUHFMSZXSRDQBR-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+](C)Cc1nccs1 ZINC000175083506 1041436841 /nfs/dbraw/zinc/43/68/41/1041436841.db2.gz YUHFMSZXSRDQBR-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO CC[C@H](CC(F)F)C[N@@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000659849748 1041447788 /nfs/dbraw/zinc/44/77/88/1041447788.db2.gz JOGARSIFZUFUIM-DGCLKSJQSA-N 1 2 313.392 4.155 20 0 DIADLO CC[C@H](CC(F)F)C[N@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000659849748 1041447791 /nfs/dbraw/zinc/44/77/91/1041447791.db2.gz JOGARSIFZUFUIM-DGCLKSJQSA-N 1 2 313.392 4.155 20 0 DIADLO ClC1(Cl)C[C@@H]1C[N@@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000747668217 1041472775 /nfs/dbraw/zinc/47/27/75/1041472775.db2.gz AHBOHGVUHJTWOX-ZBFHGGJFSA-N 1 2 321.251 4.087 20 0 DIADLO ClC1(Cl)C[C@@H]1C[N@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000747668217 1041472782 /nfs/dbraw/zinc/47/27/82/1041472782.db2.gz AHBOHGVUHJTWOX-ZBFHGGJFSA-N 1 2 321.251 4.087 20 0 DIADLO CC[N@H+](Cc1ccncc1)[C@H](C)c1nc(-c2ccccc2C)no1 ZINC000270988243 1041484231 /nfs/dbraw/zinc/48/42/31/1041484231.db2.gz HSSYHUIJUKIIJI-OAHLLOKOSA-N 1 2 322.412 4.023 20 0 DIADLO CC[N@@H+](Cc1ccncc1)[C@H](C)c1nc(-c2ccccc2C)no1 ZINC000270988243 1041484236 /nfs/dbraw/zinc/48/42/36/1041484236.db2.gz HSSYHUIJUKIIJI-OAHLLOKOSA-N 1 2 322.412 4.023 20 0 DIADLO Fc1cccc([C@H]([NH2+]Cc2nccn2C2CC2)c2ccccc2)c1 ZINC000893152907 1041505867 /nfs/dbraw/zinc/50/58/67/1041505867.db2.gz KPVMQCZVBTVDLO-HXUWFJFHSA-N 1 2 321.399 4.236 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccnc(Cl)c1Cl ZINC000811498565 1041525659 /nfs/dbraw/zinc/52/56/59/1041525659.db2.gz YRIUKDXKQPJLIC-CBAPKCEASA-N 1 2 313.150 4.161 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccnc(Cl)c1Cl ZINC000811498565 1041525668 /nfs/dbraw/zinc/52/56/68/1041525668.db2.gz YRIUKDXKQPJLIC-CBAPKCEASA-N 1 2 313.150 4.161 20 0 DIADLO CC(C)[C@@H]1CC[C@@H]1[NH2+]c1ccc(N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000796976398 1041516339 /nfs/dbraw/zinc/51/63/39/1041516339.db2.gz IGDSNQHDZRHJEN-QXGSTGNESA-N 1 2 302.462 4.147 20 0 DIADLO CN(Cc1ccn2cc[nH+]c2c1)Cc1c(Cl)cccc1Cl ZINC001141046117 1041520561 /nfs/dbraw/zinc/52/05/61/1041520561.db2.gz MQKFNOIRTCMZKT-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO CSC1(C[NH2+]c2ccc(N3CCSCC3)c(C)c2)CCC1 ZINC000811469319 1041525522 /nfs/dbraw/zinc/52/55/22/1041525522.db2.gz BHSAXMOLQNEHFL-UHFFFAOYSA-N 1 2 322.543 4.246 20 0 DIADLO Cc1cc(C(F)(F)F)nn1C[NH+]1CCC(c2ccccc2)CC1 ZINC000811730402 1041564371 /nfs/dbraw/zinc/56/43/71/1041564371.db2.gz XDVHXRINVMXYKD-UHFFFAOYSA-N 1 2 323.362 4.047 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1cccc(C)c1Br ZINC001141089125 1041578824 /nfs/dbraw/zinc/57/88/24/1041578824.db2.gz JNYDHMRVEVQOLG-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1cccc(C)c1Br ZINC001141089125 1041578829 /nfs/dbraw/zinc/57/88/29/1041578829.db2.gz JNYDHMRVEVQOLG-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO C[NH+](C)c1ccc(N[C@@H](c2ccccc2)c2ccc(F)cn2)cc1 ZINC000183988593 1041590064 /nfs/dbraw/zinc/59/00/64/1041590064.db2.gz QTMFOSZORXGGPH-FQEVSTJZSA-N 1 2 321.399 4.488 20 0 DIADLO Clc1cc2nc(/C=C\c3[nH]cc[nH+]3)oc2c(Br)c1 ZINC000812242879 1041606189 /nfs/dbraw/zinc/60/61/89/1041606189.db2.gz XLRFJKQVMGKOPP-UPHRSURJSA-N 1 2 324.565 4.137 20 0 DIADLO C[N@H+](Cc1coc(C2CC2)n1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000812781427 1041647198 /nfs/dbraw/zinc/64/71/98/1041647198.db2.gz UEDJEMGBAMDKBN-OLZOCXBDSA-N 1 2 302.340 4.105 20 0 DIADLO C[N@@H+](Cc1coc(C2CC2)n1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000812781427 1041647202 /nfs/dbraw/zinc/64/72/02/1041647202.db2.gz UEDJEMGBAMDKBN-OLZOCXBDSA-N 1 2 302.340 4.105 20 0 DIADLO FC(F)(F)c1cncc(C[N@@H+]2CCCc3sccc3C2)c1 ZINC000812825706 1041649792 /nfs/dbraw/zinc/64/97/92/1041649792.db2.gz GDYWUPCUOCSWOI-UHFFFAOYSA-N 1 2 312.360 4.110 20 0 DIADLO FC(F)(F)c1cncc(C[N@H+]2CCCc3sccc3C2)c1 ZINC000812825706 1041649794 /nfs/dbraw/zinc/64/97/94/1041649794.db2.gz GDYWUPCUOCSWOI-UHFFFAOYSA-N 1 2 312.360 4.110 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cncc(C(F)(F)F)c2)C2CC2)o1 ZINC000812822518 1041649965 /nfs/dbraw/zinc/64/99/65/1041649965.db2.gz RBZLCEJFPLXXDK-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cncc(C(F)(F)F)c2)C2CC2)o1 ZINC000812822518 1041649967 /nfs/dbraw/zinc/64/99/67/1041649967.db2.gz RBZLCEJFPLXXDK-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO CCCc1ccc(CCCC(=O)Nc2c(C)c[nH+]cc2C)cc1 ZINC001133455627 1041651968 /nfs/dbraw/zinc/65/19/68/1041651968.db2.gz KMXWWNAGZRQXBI-UHFFFAOYSA-N 1 2 310.441 4.034 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(-c3csc(C)n3)cc2)co1 ZINC000660183136 1041654493 /nfs/dbraw/zinc/65/44/93/1041654493.db2.gz BOTAVLAWLHVGJP-NSHDSACASA-N 1 2 313.426 4.266 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccccc2-n2cc[nH+]c2)cc1C ZINC000196630799 1041656761 /nfs/dbraw/zinc/65/67/61/1041656761.db2.gz AZFKSLVLDYNLIC-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2nnc(C(C)C)s2)C2CCC2)o1 ZINC000584808210 1041678802 /nfs/dbraw/zinc/67/88/02/1041678802.db2.gz HMMBNNPSSBBXPW-OAHLLOKOSA-N 1 2 305.447 4.194 20 0 DIADLO CCCn1c2ccccc2nc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC000813258161 1041688579 /nfs/dbraw/zinc/68/85/79/1041688579.db2.gz VQJSSSVAGWCUQT-UHFFFAOYSA-N 1 2 302.381 4.299 20 0 DIADLO COc1cccc(C[NH2+][C@@H](c2ncc(C)s2)C2CC2)c1Cl ZINC000660253815 1041692532 /nfs/dbraw/zinc/69/25/32/1041692532.db2.gz MBMJOPJHXZRTIU-OAHLLOKOSA-N 1 2 322.861 4.354 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2cccc(OC)c2Cl)cs1 ZINC000660267219 1041697523 /nfs/dbraw/zinc/69/75/23/1041697523.db2.gz LDHDXUGDKGGREB-SNVBAGLBSA-N 1 2 310.850 4.218 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)s1 ZINC000584876512 1041697661 /nfs/dbraw/zinc/69/76/61/1041697661.db2.gz LVAJQBBOCQFFOL-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCC[C@H]2c2ccccn2)s1 ZINC000584876512 1041697663 /nfs/dbraw/zinc/69/76/63/1041697663.db2.gz LVAJQBBOCQFFOL-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO CCn1c[nH+]cc1CNc1cccc(COC(C)(C)C)c1C ZINC000417808345 1041702767 /nfs/dbraw/zinc/70/27/67/1041702767.db2.gz LFJJZOUCJSHSAD-UHFFFAOYSA-N 1 2 301.434 4.139 20 0 DIADLO CCc1noc(C[NH2+][C@H](c2ccc(CC(C)C)cc2)C(C)C)n1 ZINC000623048224 1041718907 /nfs/dbraw/zinc/71/89/07/1041718907.db2.gz MZGLVGDJEDDKAF-IBGZPJMESA-N 1 2 315.461 4.317 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Br)o1)c1cc(F)ccc1F ZINC000036921848 1041721543 /nfs/dbraw/zinc/72/15/43/1041721543.db2.gz GARRDCUCXILLIG-QMMMGPOBSA-N 1 2 316.145 4.171 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc(Br)cc1 ZINC000397935068 1041738512 /nfs/dbraw/zinc/73/85/12/1041738512.db2.gz DEPBDPIPGRWTAL-JOYOIKCWSA-N 1 2 304.178 4.288 20 0 DIADLO CC(C)c1ccc2c(c1)CCCN2Cc1cc[nH+]c(N(C)C)c1 ZINC001167755475 1041754036 /nfs/dbraw/zinc/75/40/36/1041754036.db2.gz RNJGPKIZHABHJY-UHFFFAOYSA-N 1 2 309.457 4.224 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@@H+](CCSc1ccncc1)CC2 ZINC001170723794 1041760451 /nfs/dbraw/zinc/76/04/51/1041760451.db2.gz UJCZVIRFQWEUJH-UHFFFAOYSA-N 1 2 322.836 4.025 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@H+](CCSc1ccncc1)CC2 ZINC001170723794 1041760465 /nfs/dbraw/zinc/76/04/65/1041760465.db2.gz UJCZVIRFQWEUJH-UHFFFAOYSA-N 1 2 322.836 4.025 20 0 DIADLO COCc1cc[nH+]c(NC2CCC(c3ccc(O)cc3)CC2)c1 ZINC000652068657 1041772524 /nfs/dbraw/zinc/77/25/24/1041772524.db2.gz KIESVSXOXPBBQA-UHFFFAOYSA-N 1 2 312.413 4.072 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ncccc2C(F)(F)F)n1 ZINC000093444976 1041782321 /nfs/dbraw/zinc/78/23/21/1041782321.db2.gz BSSZVEADQPMPEM-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ncccc2C(F)(F)F)n1 ZINC000093444976 1041782322 /nfs/dbraw/zinc/78/23/22/1041782322.db2.gz BSSZVEADQPMPEM-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO C[C@@H](CC(=O)Nc1cccc2c1[C@@H](C)CC2(C)C)n1cc[nH+]c1 ZINC001134154340 1041786145 /nfs/dbraw/zinc/78/61/45/1041786145.db2.gz HONNWQIXHKZQFF-KBPBESRZSA-N 1 2 311.429 4.258 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@H](F)C2)cc(C(F)(F)F)c1 ZINC001143511729 1041810371 /nfs/dbraw/zinc/81/03/71/1041810371.db2.gz IQAVBZPELOURFL-ZDUSSCGKSA-N 1 2 305.315 4.038 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@H](F)C2)cc(C(F)(F)F)c1 ZINC001143511729 1041810380 /nfs/dbraw/zinc/81/03/80/1041810380.db2.gz IQAVBZPELOURFL-ZDUSSCGKSA-N 1 2 305.315 4.038 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1ncc(-c2cccs2)o1 ZINC000109785587 1041811474 /nfs/dbraw/zinc/81/14/74/1041811474.db2.gz FAWXWHHBRVRNBD-LBPRGKRZSA-N 1 2 314.410 4.302 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ncc(-c2cccs2)o1 ZINC000109785587 1041811480 /nfs/dbraw/zinc/81/14/80/1041811480.db2.gz FAWXWHHBRVRNBD-LBPRGKRZSA-N 1 2 314.410 4.302 20 0 DIADLO CSc1cc(Nc2ccc(N3CCCC3)cc2F)cc[nH+]1 ZINC001213849687 1041811570 /nfs/dbraw/zinc/81/15/70/1041811570.db2.gz MTWGVAGTEIALBP-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO Fc1ccc(C[NH2+]Cc2nc3ccccc3o2)c(C(F)(F)F)c1 ZINC000613752554 1041823577 /nfs/dbraw/zinc/82/35/77/1041823577.db2.gz UWXSJOIVTDKTRM-UHFFFAOYSA-N 1 2 324.277 4.276 20 0 DIADLO Cc1nn(C[N@@H+](C)[C@@H](C)C(C)(C)C)c(=S)n1-c1ccccc1 ZINC000026629920 1041841976 /nfs/dbraw/zinc/84/19/76/1041841976.db2.gz MHXCJLMNIKHBJG-ZDUSSCGKSA-N 1 2 318.490 4.036 20 0 DIADLO Cc1nn(C[N@H+](C)[C@@H](C)C(C)(C)C)c(=S)n1-c1ccccc1 ZINC000026629920 1041841981 /nfs/dbraw/zinc/84/19/81/1041841981.db2.gz MHXCJLMNIKHBJG-ZDUSSCGKSA-N 1 2 318.490 4.036 20 0 DIADLO C[N@H+](C[C@H]1CCCCC1(C)C)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660764309 1041860291 /nfs/dbraw/zinc/86/02/91/1041860291.db2.gz JDKYVOYYWSXUIJ-SJORKVTESA-N 1 2 312.461 4.042 20 0 DIADLO C[N@@H+](C[C@H]1CCCCC1(C)C)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660764309 1041860301 /nfs/dbraw/zinc/86/03/01/1041860301.db2.gz JDKYVOYYWSXUIJ-SJORKVTESA-N 1 2 312.461 4.042 20 0 DIADLO FC(F)(F)c1nnc(C[N@@H+]2CCC[C@H]2CC2CCCC2)s1 ZINC000660925218 1041873173 /nfs/dbraw/zinc/87/31/73/1041873173.db2.gz AATKYTUQUARBQS-NSHDSACASA-N 1 2 319.396 4.102 20 0 DIADLO FC(F)(F)c1nnc(C[N@H+]2CCC[C@H]2CC2CCCC2)s1 ZINC000660925218 1041873181 /nfs/dbraw/zinc/87/31/81/1041873181.db2.gz AATKYTUQUARBQS-NSHDSACASA-N 1 2 319.396 4.102 20 0 DIADLO C[C@@H]([NH2+]Cc1cnn(C)c1Cl)c1cccc(Cl)c1Cl ZINC000815124714 1041916576 /nfs/dbraw/zinc/91/65/76/1041916576.db2.gz IVMFKHGASLWABU-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@H]2CCc3ccc(F)c(Cl)c32)n1 ZINC000651719453 1041891519 /nfs/dbraw/zinc/89/15/19/1041891519.db2.gz TVIHMNYSMGZODP-AWEZNQCLSA-N 1 2 307.800 4.034 20 0 DIADLO CC(C)Cc1noc(C[N@H+](Cc2ccsc2)C(C)(C)C)n1 ZINC000661137690 1041894735 /nfs/dbraw/zinc/89/47/35/1041894735.db2.gz TYOYHGULOSSAFD-UHFFFAOYSA-N 1 2 307.463 4.130 20 0 DIADLO CC(C)Cc1noc(C[N@@H+](Cc2ccsc2)C(C)(C)C)n1 ZINC000661137690 1041894742 /nfs/dbraw/zinc/89/47/42/1041894742.db2.gz TYOYHGULOSSAFD-UHFFFAOYSA-N 1 2 307.463 4.130 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1ccc(-c2ccccc2)cn1)c1ccco1 ZINC000651729196 1041896254 /nfs/dbraw/zinc/89/62/54/1041896254.db2.gz YWVFIAQHTTYPCG-DNVCBOLYSA-N 1 2 322.408 4.380 20 0 DIADLO CC(C)(C)C1=CC[N@H+](Cc2ccnc(Br)c2)CC1 ZINC000815075796 1041911710 /nfs/dbraw/zinc/91/17/10/1041911710.db2.gz MPBKGTQBKVATAL-UHFFFAOYSA-N 1 2 309.251 4.022 20 0 DIADLO CC(C)(C)C1=CC[N@@H+](Cc2ccnc(Br)c2)CC1 ZINC000815075796 1041911715 /nfs/dbraw/zinc/91/17/15/1041911715.db2.gz MPBKGTQBKVATAL-UHFFFAOYSA-N 1 2 309.251 4.022 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2cccc(Cl)c2F)c(F)c1 ZINC000815152113 1041918864 /nfs/dbraw/zinc/91/88/64/1041918864.db2.gz HYHSFOMOCJAMHY-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO COc1cccc2cc(C[NH2+]Cc3c(F)cc(F)cc3F)oc21 ZINC000815151261 1041919513 /nfs/dbraw/zinc/91/95/13/1041919513.db2.gz DLRUHIKILLSGER-UHFFFAOYSA-N 1 2 321.298 4.149 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@@H+](Cc1nnc(-c3ccco3)o1)CC2 ZINC000661372870 1041928044 /nfs/dbraw/zinc/92/80/44/1041928044.db2.gz DZBSZDQDIGTPQR-UHFFFAOYSA-N 1 2 323.396 4.011 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@H+](Cc1nnc(-c3ccco3)o1)CC2 ZINC000661372870 1041928049 /nfs/dbraw/zinc/92/80/49/1041928049.db2.gz DZBSZDQDIGTPQR-UHFFFAOYSA-N 1 2 323.396 4.011 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC[C@@H](Oc3ccc(Cl)cc3)C2)o1 ZINC000815208719 1041933612 /nfs/dbraw/zinc/93/36/12/1041933612.db2.gz ZGVQTUUHPLPFHX-OAHLLOKOSA-N 1 2 320.820 4.105 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC[C@@H](Oc3ccc(Cl)cc3)C2)o1 ZINC000815208719 1041933618 /nfs/dbraw/zinc/93/36/18/1041933618.db2.gz ZGVQTUUHPLPFHX-OAHLLOKOSA-N 1 2 320.820 4.105 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC[C@H](Oc3ccc(Cl)cc3)C2)o1 ZINC000815208718 1041933876 /nfs/dbraw/zinc/93/38/76/1041933876.db2.gz ZGVQTUUHPLPFHX-HNNXBMFYSA-N 1 2 320.820 4.105 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC[C@H](Oc3ccc(Cl)cc3)C2)o1 ZINC000815208718 1041933885 /nfs/dbraw/zinc/93/38/85/1041933885.db2.gz ZGVQTUUHPLPFHX-HNNXBMFYSA-N 1 2 320.820 4.105 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1)[N@@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661445573 1041938830 /nfs/dbraw/zinc/93/88/30/1041938830.db2.gz INJIOCOGKHRHAX-MAUKXSAKSA-N 1 2 324.424 4.224 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1)[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661445573 1041938835 /nfs/dbraw/zinc/93/88/35/1041938835.db2.gz INJIOCOGKHRHAX-MAUKXSAKSA-N 1 2 324.424 4.224 20 0 DIADLO CCCOc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1F ZINC001211668443 1041938994 /nfs/dbraw/zinc/93/89/94/1041938994.db2.gz WXTPRPFOEIMYFY-UHFFFAOYSA-N 1 2 315.392 4.353 20 0 DIADLO C[C@@H]([NH2+]Cc1c[nH]cn1)c1ccc(O[C@H](C)c2ccccc2)cc1 ZINC000661460026 1041941397 /nfs/dbraw/zinc/94/13/97/1041941397.db2.gz XMXNXWUBJZRRJL-HZPDHXFCSA-N 1 2 321.424 4.401 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccccc2F)C(C)C)s1 ZINC000661482779 1041944188 /nfs/dbraw/zinc/94/41/88/1041944188.db2.gz DBCOBOOJFAAQGZ-HNNXBMFYSA-N 1 2 307.438 4.288 20 0 DIADLO CCCn1nc(C)c(C[N@H+](C)Cc2ccccc2Cl)c1C ZINC000350099022 1041952344 /nfs/dbraw/zinc/95/23/44/1041952344.db2.gz NAQOYEIZPFEVEO-UHFFFAOYSA-N 1 2 305.853 4.195 20 0 DIADLO CCCn1nc(C)c(C[N@@H+](C)Cc2ccccc2Cl)c1C ZINC000350099022 1041952347 /nfs/dbraw/zinc/95/23/47/1041952347.db2.gz NAQOYEIZPFEVEO-UHFFFAOYSA-N 1 2 305.853 4.195 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2nc(C)c(C)s2)cc1F ZINC000661659741 1041966286 /nfs/dbraw/zinc/96/62/86/1041966286.db2.gz MCKULUOVUSZLTN-OAHLLOKOSA-N 1 2 320.433 4.245 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2nc(C)c(C)s2)cc1F ZINC000661659741 1041966293 /nfs/dbraw/zinc/96/62/93/1041966293.db2.gz MCKULUOVUSZLTN-OAHLLOKOSA-N 1 2 320.433 4.245 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(-c2ccccc2)[nH]1)c1cccc(C2CC2)c1 ZINC000815610822 1041973770 /nfs/dbraw/zinc/97/37/70/1041973770.db2.gz VBZJSFAULUUXOD-CQSZACIVSA-N 1 2 318.424 4.200 20 0 DIADLO COC(=O)CCC[C@H]1CCC[C@H](Nc2ccc([NH+](C)C)cc2)C1 ZINC000815610901 1041974359 /nfs/dbraw/zinc/97/43/59/1041974359.db2.gz XYYIWIMYUQHQKL-WBVHZDCISA-N 1 2 318.461 4.067 20 0 DIADLO COC(=O)CCC[C@H]1CCC[C@H]([NH2+]c2ccc(N(C)C)cc2)C1 ZINC000815610901 1041974365 /nfs/dbraw/zinc/97/43/65/1041974365.db2.gz XYYIWIMYUQHQKL-WBVHZDCISA-N 1 2 318.461 4.067 20 0 DIADLO Cc1[nH]c(CN2CCCC[C@H]2c2ccc(Cl)cc2)[nH+]c1C ZINC000628300716 1041978070 /nfs/dbraw/zinc/97/80/70/1041978070.db2.gz SHIUTZLPNDPOEG-INIZCTEOSA-N 1 2 303.837 4.407 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccc(Cl)nc1 ZINC000815648983 1041984082 /nfs/dbraw/zinc/98/40/82/1041984082.db2.gz DMPPRMUMJIGKGN-MRVPVSSYSA-N 1 2 300.711 4.003 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccc(Cl)nc1 ZINC000815648984 1041984885 /nfs/dbraw/zinc/98/48/85/1041984885.db2.gz DMPPRMUMJIGKGN-QMMMGPOBSA-N 1 2 300.711 4.003 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1cc(F)c(F)c(F)c1 ZINC000815650749 1041985158 /nfs/dbraw/zinc/98/51/58/1041985158.db2.gz ZWSHJJSBSGFVIE-ZETCQYMHSA-N 1 2 319.248 4.372 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1cc(F)c(F)c(F)c1 ZINC000815650748 1041985777 /nfs/dbraw/zinc/98/57/77/1041985777.db2.gz ZWSHJJSBSGFVIE-SSDOTTSWSA-N 1 2 319.248 4.372 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+]Cc1c(F)cc(F)cc1F ZINC000815650554 1041985864 /nfs/dbraw/zinc/98/58/64/1041985864.db2.gz UTMBAMJFRZKMJM-NSHDSACASA-N 1 2 309.331 4.353 20 0 DIADLO C[C@@H](c1nc(C(C)(C)c2cccc3ccccc32)no1)[NH+](C)C ZINC000815701738 1041988952 /nfs/dbraw/zinc/98/89/52/1041988952.db2.gz ACINELQIPRCPQB-ZDUSSCGKSA-N 1 2 309.413 4.171 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(Cl)n1C)c1cccc(Cl)c1Cl ZINC000178448100 1041992929 /nfs/dbraw/zinc/99/29/29/1041992929.db2.gz CTNFOBYHPLZNTE-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2cc(C)c(OC)cc2C)c1 ZINC000652330474 1042009505 /nfs/dbraw/zinc/00/95/05/1042009505.db2.gz HLFVRBAHEJHRRY-CQSZACIVSA-N 1 2 300.402 4.027 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CCCOc3cc4c(cc32)CCC4)c1 ZINC000652331134 1042013197 /nfs/dbraw/zinc/01/31/97/1042013197.db2.gz ZDOJZTIVJITNHJ-GOSISDBHSA-N 1 2 324.424 4.043 20 0 DIADLO CC(C)CCc1nc(C[NH+]2CCC3(CCCC3=O)CC2)cs1 ZINC000661954958 1042030330 /nfs/dbraw/zinc/03/03/30/1042030330.db2.gz RRIZGGFFVRXGDW-UHFFFAOYSA-N 1 2 320.502 4.067 20 0 DIADLO Clc1cccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)n1 ZINC000075746230 1042037870 /nfs/dbraw/zinc/03/78/70/1042037870.db2.gz BVTZZESLUNCMES-HNNXBMFYSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cccc(C[N@H+]2CCSC[C@H]2c2ccccc2)n1 ZINC000075746230 1042037876 /nfs/dbraw/zinc/03/78/76/1042037876.db2.gz BVTZZESLUNCMES-HNNXBMFYSA-N 1 2 304.846 4.025 20 0 DIADLO C[C@@H]1COCC[C@@H]1Nc1[nH+]ccc2cccc(C(F)(F)F)c21 ZINC001170820965 1042042156 /nfs/dbraw/zinc/04/21/56/1042042156.db2.gz QFMXXHUUONSZKW-MFKMUULPSA-N 1 2 310.319 4.091 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CCC[C@@H](C3CCC3)C2)n1 ZINC000662044682 1042049230 /nfs/dbraw/zinc/04/92/30/1042049230.db2.gz SNNKSOWQJWTKOH-LLVKDONJSA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CCC[C@@H](C3CCC3)C2)n1 ZINC000662044682 1042049233 /nfs/dbraw/zinc/04/92/33/1042049233.db2.gz SNNKSOWQJWTKOH-LLVKDONJSA-N 1 2 304.381 4.174 20 0 DIADLO CCCC[N@H+](Cc1cnn(C)c1Cl)[C@@H](C)c1ccc(C)o1 ZINC000816490858 1042057287 /nfs/dbraw/zinc/05/72/87/1042057287.db2.gz LIOQINQKFCUKAK-ZDUSSCGKSA-N 1 2 309.841 4.338 20 0 DIADLO CCCC[N@@H+](Cc1cnn(C)c1Cl)[C@@H](C)c1ccc(C)o1 ZINC000816490858 1042057296 /nfs/dbraw/zinc/05/72/96/1042057296.db2.gz LIOQINQKFCUKAK-ZDUSSCGKSA-N 1 2 309.841 4.338 20 0 DIADLO CC[N@H+](Cc1cnn(C)c1Cl)[C@H](C)c1cc2ccccc2o1 ZINC000816496332 1042057580 /nfs/dbraw/zinc/05/75/80/1042057580.db2.gz FZRQZOYLBGZVNQ-GFCCVEGCSA-N 1 2 317.820 4.403 20 0 DIADLO CC[N@@H+](Cc1cnn(C)c1Cl)[C@H](C)c1cc2ccccc2o1 ZINC000816496332 1042057585 /nfs/dbraw/zinc/05/75/85/1042057585.db2.gz FZRQZOYLBGZVNQ-GFCCVEGCSA-N 1 2 317.820 4.403 20 0 DIADLO Cn1ncc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)c1Cl ZINC000816486681 1042058150 /nfs/dbraw/zinc/05/81/50/1042058150.db2.gz NREJZAZAYWACJD-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1ncc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)c1Cl ZINC000816486681 1042058156 /nfs/dbraw/zinc/05/81/56/1042058156.db2.gz NREJZAZAYWACJD-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CC2(CCC2)[C@H]1c1ccccc1 ZINC000816630589 1042070621 /nfs/dbraw/zinc/07/06/21/1042070621.db2.gz KECINWNSRLWZSK-MRXNPFEDSA-N 1 2 315.848 4.109 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CC2(CCC2)[C@H]1c1ccccc1 ZINC000816630589 1042070628 /nfs/dbraw/zinc/07/06/28/1042070628.db2.gz KECINWNSRLWZSK-MRXNPFEDSA-N 1 2 315.848 4.109 20 0 DIADLO CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ncsc1Br ZINC000662160635 1042074332 /nfs/dbraw/zinc/07/43/32/1042074332.db2.gz MMDJJBFMUGEBGJ-VHSXEESVSA-N 1 2 303.269 4.059 20 0 DIADLO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1ncsc1Br ZINC000662160635 1042074338 /nfs/dbraw/zinc/07/43/38/1042074338.db2.gz MMDJJBFMUGEBGJ-VHSXEESVSA-N 1 2 303.269 4.059 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2ccnc(Cl)c2Cl)s1 ZINC000278857150 1042087573 /nfs/dbraw/zinc/08/75/73/1042087573.db2.gz FFWIHZHXTMQBPF-QMMMGPOBSA-N 1 2 302.230 4.004 20 0 DIADLO C[N@@H+](Cc1csc(-c2ccccc2F)n1)CC1=CCSC1 ZINC000662268912 1042101941 /nfs/dbraw/zinc/10/19/41/1042101941.db2.gz PWTNEEYZYALELB-UHFFFAOYSA-N 1 2 320.458 4.054 20 0 DIADLO C[N@H+](Cc1csc(-c2ccccc2F)n1)CC1=CCSC1 ZINC000662268912 1042101944 /nfs/dbraw/zinc/10/19/44/1042101944.db2.gz PWTNEEYZYALELB-UHFFFAOYSA-N 1 2 320.458 4.054 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@]2(c3ccccc3)CC2(C)C)cs1 ZINC000662342378 1042116356 /nfs/dbraw/zinc/11/63/56/1042116356.db2.gz ARPVADRVCFDDGS-UGSOOPFHSA-N 1 2 316.470 4.266 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1ccncc1Cl)CCC2 ZINC000817584799 1042117359 /nfs/dbraw/zinc/11/73/59/1042117359.db2.gz FXONCPZPYBANHG-LRDDRELGSA-N 1 2 318.852 4.241 20 0 DIADLO Brc1scnc1C[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000662373685 1042118662 /nfs/dbraw/zinc/11/86/62/1042118662.db2.gz BMDWFQVCCAOOCZ-JQWIXIFHSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1scnc1C[N@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000662373685 1042118665 /nfs/dbraw/zinc/11/86/65/1042118665.db2.gz BMDWFQVCCAOOCZ-JQWIXIFHSA-N 1 2 315.280 4.060 20 0 DIADLO CCOc1cccc([C@@H](C)[NH2+]Cc2csc([C@H](C)OC)n2)c1 ZINC000165243421 1042123581 /nfs/dbraw/zinc/12/35/81/1042123581.db2.gz XAYPCANSZOVIJV-OLZOCXBDSA-N 1 2 320.458 4.100 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1nc(Br)cs1 ZINC000817950365 1042129926 /nfs/dbraw/zinc/12/99/26/1042129926.db2.gz URFMTSXVFXUGPB-QMMMGPOBSA-N 1 2 324.247 4.047 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc(OC2CCC2)c(F)c1 ZINC000818196732 1042143668 /nfs/dbraw/zinc/14/36/68/1042143668.db2.gz YJEDSSXVUBZEEY-UHFFFAOYSA-N 1 2 303.381 4.147 20 0 DIADLO F[C@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1ccnc(Cl)c1Cl ZINC000818229679 1042144737 /nfs/dbraw/zinc/14/47/37/1042144737.db2.gz ADXUHLIOFUVWTP-WFASDCNBSA-N 1 2 311.187 4.115 20 0 DIADLO F[C@@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1ccnc(Cl)c1Cl ZINC000818229677 1042144918 /nfs/dbraw/zinc/14/49/18/1042144918.db2.gz ADXUHLIOFUVWTP-SWLSCSKDSA-N 1 2 311.187 4.115 20 0 DIADLO CO[C@@H]1CCC[C@H]([NH2+][C@@H](c2cccc(Cl)c2)C(F)F)C1 ZINC001207553304 1042146163 /nfs/dbraw/zinc/14/61/63/1042146163.db2.gz IYEATWUDYGYIEE-MJBXVCDLSA-N 1 2 303.780 4.193 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000069519542 1042148785 /nfs/dbraw/zinc/14/87/85/1042148785.db2.gz CNJHKMPLDLOEMO-LBPRGKRZSA-N 1 2 300.333 4.267 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000069519542 1042148789 /nfs/dbraw/zinc/14/87/89/1042148789.db2.gz CNJHKMPLDLOEMO-LBPRGKRZSA-N 1 2 300.333 4.267 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C=Cc3ccc(Cl)cc3)cc2[nH+]1 ZINC000819627938 1042191441 /nfs/dbraw/zinc/19/14/41/1042191441.db2.gz HPWRDTBBBIJBNP-RUDMXATFSA-N 1 2 311.772 4.177 20 0 DIADLO O=C(Nc1ccc(C2CCC2)cc1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000278915653 1042206492 /nfs/dbraw/zinc/20/64/92/1042206492.db2.gz LDGXYCWJHBBASU-INIZCTEOSA-N 1 2 324.428 4.089 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](c2ccccc2)[C@H]2CCCO2)cs1 ZINC001648933405 1042221433 /nfs/dbraw/zinc/22/14/33/1042221433.db2.gz UBCVPMBOETWBMU-SJORKVTESA-N 1 2 316.470 4.276 20 0 DIADLO COc1ccccc1[C@@H]1CCCN1c1[nH+]ccc2c(N)cccc21 ZINC000663535522 1042223612 /nfs/dbraw/zinc/22/36/12/1042223612.db2.gz PJGQJYZPBNDQMX-SFHVURJKSA-N 1 2 319.408 4.167 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H]2CCc3ccc(Cl)nc32)cs1 ZINC000820810132 1042229706 /nfs/dbraw/zinc/22/97/06/1042229706.db2.gz PMOKIDVMCCNIAY-ONGXEEELSA-N 1 2 307.850 4.092 20 0 DIADLO c1sc(-c2ccccn2)nc1C[N@H+](Cc1ccccc1)C1CC1 ZINC000111682433 1042231021 /nfs/dbraw/zinc/23/10/21/1042231021.db2.gz JNLOHGNIHVHXSR-UHFFFAOYSA-N 1 2 321.449 4.370 20 0 DIADLO c1sc(-c2ccccn2)nc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000111682433 1042231025 /nfs/dbraw/zinc/23/10/25/1042231025.db2.gz JNLOHGNIHVHXSR-UHFFFAOYSA-N 1 2 321.449 4.370 20 0 DIADLO Cc1cc(Nc2cccc(Br)c2N)ccc1[NH+](C)C ZINC001159866932 1042239656 /nfs/dbraw/zinc/23/96/56/1042239656.db2.gz VHOHLSCAJOHFFS-UHFFFAOYSA-N 1 2 320.234 4.149 20 0 DIADLO FC[C@@H]([NH2+]Cc1cccc(OC(F)F)c1)c1ccc(F)cc1 ZINC000631282835 1042247669 /nfs/dbraw/zinc/24/76/69/1042247669.db2.gz DXAMSDCDTZCBDT-OAHLLOKOSA-N 1 2 313.294 4.228 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1csc(Cl)n1 ZINC000828647602 1042255685 /nfs/dbraw/zinc/25/56/85/1042255685.db2.gz GHWYBIBEZXXSGO-NSHDSACASA-N 1 2 310.850 4.435 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1csc(Cl)n1 ZINC000828647599 1042255709 /nfs/dbraw/zinc/25/57/09/1042255709.db2.gz GHWYBIBEZXXSGO-LLVKDONJSA-N 1 2 310.850 4.435 20 0 DIADLO Cc1ccccc1[C@@H](C)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001136459225 1042255773 /nfs/dbraw/zinc/25/57/73/1042255773.db2.gz MCAUSKWYRYROCX-CQSZACIVSA-N 1 2 305.381 4.127 20 0 DIADLO COc1cc(C)ccc1C[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000279179304 1042279749 /nfs/dbraw/zinc/27/97/49/1042279749.db2.gz RQDRZZBARDLYHK-UHFFFAOYSA-N 1 2 304.459 4.047 20 0 DIADLO c1cc(CNc2ccc([NH+]3CCCC3)cc2)n(-c2ccccc2)n1 ZINC000279217298 1042282575 /nfs/dbraw/zinc/28/25/75/1042282575.db2.gz WXWSEPNGAZFWJH-UHFFFAOYSA-N 1 2 318.424 4.085 20 0 DIADLO O=C(CCc1[nH]cc[nH+]1)Nc1ccccc1SC1CCCC1 ZINC000279281854 1042289398 /nfs/dbraw/zinc/28/93/98/1042289398.db2.gz WYOVHXUYQQZUNT-UHFFFAOYSA-N 1 2 315.442 4.016 20 0 DIADLO Cc1[nH]c2ccccc2c1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000162803278 1042297367 /nfs/dbraw/zinc/29/73/67/1042297367.db2.gz LWQDIJFWASTJJX-UHFFFAOYSA-N 1 2 316.364 4.119 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cc2ccccc2o1 ZINC000162789545 1042297937 /nfs/dbraw/zinc/29/79/37/1042297937.db2.gz LEHZRXUQXQUIMZ-UHFFFAOYSA-N 1 2 303.321 4.075 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@@H]3CC[C@@H]4C[C@@H]43)c2)[nH+]c1C ZINC000822730459 1042299042 /nfs/dbraw/zinc/29/90/42/1042299042.db2.gz LHHXBXXKKBHGFD-KEYYUXOJSA-N 1 2 309.413 4.068 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1csc(C3CC3)n1)CCC2 ZINC000162988968 1042303769 /nfs/dbraw/zinc/30/37/69/1042303769.db2.gz PZLYHTYAORKHBZ-CQSZACIVSA-N 1 2 319.499 4.295 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1csc(C3CC3)n1)CCC2 ZINC000162988968 1042303776 /nfs/dbraw/zinc/30/37/76/1042303776.db2.gz PZLYHTYAORKHBZ-CQSZACIVSA-N 1 2 319.499 4.295 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(F)F)no1)c1csc2ccccc21 ZINC000822846119 1042303982 /nfs/dbraw/zinc/30/39/82/1042303982.db2.gz YQHUWJORYPCWME-MRVPVSSYSA-N 1 2 309.341 4.073 20 0 DIADLO Cn1ncc(Cl)c1C[N@H+](C)C1c2ccccc2-c2ccccc21 ZINC000187372157 1042311816 /nfs/dbraw/zinc/31/18/16/1042311816.db2.gz CAPMRDXAKPGFGD-UHFFFAOYSA-N 1 2 323.827 4.275 20 0 DIADLO Cn1ncc(Cl)c1C[N@@H+](C)C1c2ccccc2-c2ccccc21 ZINC000187372157 1042311822 /nfs/dbraw/zinc/31/18/22/1042311822.db2.gz CAPMRDXAKPGFGD-UHFFFAOYSA-N 1 2 323.827 4.275 20 0 DIADLO COc1cccc(C[NH2+][C@H](c2ccco2)c2ccccc2)c1OC ZINC000066236383 1042320691 /nfs/dbraw/zinc/32/06/91/1042320691.db2.gz JMNWPKXBFNLWNF-IBGZPJMESA-N 1 2 323.392 4.176 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccnc(Cl)c1F ZINC000823432346 1042324653 /nfs/dbraw/zinc/32/46/53/1042324653.db2.gz FZUUOEAOORRZFN-AWEZNQCLSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccnc(Cl)c1F ZINC000823432346 1042324660 /nfs/dbraw/zinc/32/46/60/1042324660.db2.gz FZUUOEAOORRZFN-AWEZNQCLSA-N 1 2 320.795 4.220 20 0 DIADLO Fc1c(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)ccnc1Cl ZINC000823452568 1042327040 /nfs/dbraw/zinc/32/70/40/1042327040.db2.gz COARNGSMXJRDHT-CQSZACIVSA-N 1 2 322.836 4.164 20 0 DIADLO Fc1c(C[N@H+]2CCS[C@@H](c3ccccc3)C2)ccnc1Cl ZINC000823452568 1042327046 /nfs/dbraw/zinc/32/70/46/1042327046.db2.gz COARNGSMXJRDHT-CQSZACIVSA-N 1 2 322.836 4.164 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](C[C@@H]1CC3(CO1)CCCCC3)C2 ZINC001171019896 1042327310 /nfs/dbraw/zinc/32/73/10/1042327310.db2.gz ZAENRAGSVCHMRA-KRWDZBQOSA-N 1 2 305.849 4.395 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](C[C@@H]1CC3(CO1)CCCCC3)C2 ZINC001171019896 1042327318 /nfs/dbraw/zinc/32/73/18/1042327318.db2.gz ZAENRAGSVCHMRA-KRWDZBQOSA-N 1 2 305.849 4.395 20 0 DIADLO COCc1ccc(C[NH2+][C@@H](c2ccc(C)cc2)c2ccccn2)o1 ZINC000279690772 1042331719 /nfs/dbraw/zinc/33/17/19/1042331719.db2.gz PVIIQFVATBXAKO-FQEVSTJZSA-N 1 2 322.408 4.009 20 0 DIADLO C[C@H]1CN(c2ccc([NH2+][C@H]3CCCC34CCC4)cc2)CCO1 ZINC000823554090 1042333879 /nfs/dbraw/zinc/33/38/79/1042333879.db2.gz HGTCHPDWARXUDT-YJBOKZPZSA-N 1 2 300.446 4.046 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2ccc(F)c(Cl)c2)s1 ZINC000293426052 1042337871 /nfs/dbraw/zinc/33/78/71/1042337871.db2.gz ATNMWRBAEFXDJB-UHFFFAOYSA-N 1 2 316.854 4.088 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ncnn1C(C)C)c1ccc(Cl)cc1F ZINC000279753710 1042338227 /nfs/dbraw/zinc/33/82/27/1042338227.db2.gz QKOSFSKSRFWYIJ-MRXNPFEDSA-N 1 2 324.831 4.138 20 0 DIADLO CCCCS[C@@H](C)C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000279820501 1042345474 /nfs/dbraw/zinc/34/54/74/1042345474.db2.gz AEAABXQEQZDBGM-ZDUSSCGKSA-N 1 2 317.458 4.245 20 0 DIADLO CCc1cc(OCc2nnc(C(C)C)s2)c2ccccc2[nH+]1 ZINC000418922539 1042364935 /nfs/dbraw/zinc/36/49/35/1042364935.db2.gz LBKVSBUJRFOHCA-UHFFFAOYSA-N 1 2 313.426 4.351 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1c(N)cc(Cl)nc1Cl ZINC001213491181 1042365570 /nfs/dbraw/zinc/36/55/70/1042365570.db2.gz AUPYONUFWBSVAC-UHFFFAOYSA-N 1 2 309.200 4.295 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)s1 ZINC001139817291 1042366667 /nfs/dbraw/zinc/36/66/67/1042366667.db2.gz GLWZRRCGVPYYGJ-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)s1 ZINC001139817291 1042366672 /nfs/dbraw/zinc/36/66/72/1042366672.db2.gz GLWZRRCGVPYYGJ-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO C[C@@]1(F)CCC[N@H+](Cc2cc(OC(F)(F)F)ccc2F)C1 ZINC001143538924 1042391366 /nfs/dbraw/zinc/39/13/66/1042391366.db2.gz WCAHZJIPZLONAO-CYBMUJFWSA-N 1 2 309.278 4.048 20 0 DIADLO C[C@@]1(F)CCC[N@@H+](Cc2cc(OC(F)(F)F)ccc2F)C1 ZINC001143538924 1042391371 /nfs/dbraw/zinc/39/13/71/1042391371.db2.gz WCAHZJIPZLONAO-CYBMUJFWSA-N 1 2 309.278 4.048 20 0 DIADLO CCc1ccc(C[NH2+]Cc2nc3cc(Cl)ccc3s2)o1 ZINC000531602458 1042391975 /nfs/dbraw/zinc/39/19/75/1042391975.db2.gz HTPYJXPGDQZGPU-UHFFFAOYSA-N 1 2 306.818 4.395 20 0 DIADLO C[N@H+](Cc1ccc(Br)o1)Cc1ccc(Cl)s1 ZINC000048056911 1042398656 /nfs/dbraw/zinc/39/86/56/1042398656.db2.gz RSIQFENOQPSKIC-UHFFFAOYSA-N 1 2 320.639 4.389 20 0 DIADLO C[N@@H+](Cc1ccc(Br)o1)Cc1ccc(Cl)s1 ZINC000048056911 1042398663 /nfs/dbraw/zinc/39/86/63/1042398663.db2.gz RSIQFENOQPSKIC-UHFFFAOYSA-N 1 2 320.639 4.389 20 0 DIADLO FC(F)(F)COCC[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC000110272064 1042401428 /nfs/dbraw/zinc/40/14/28/1042401428.db2.gz QFJDQQLLJMVAPR-UHFFFAOYSA-N 1 2 321.342 4.248 20 0 DIADLO Cc1ncoc1C[N@H+]1CCC[C@@H]1c1nc2ccccc2n1C(C)C ZINC000894021751 1042402665 /nfs/dbraw/zinc/40/26/65/1042402665.db2.gz VHRWNCGKAYPZES-QGZVFWFLSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1ncoc1C[N@@H+]1CCC[C@@H]1c1nc2ccccc2n1C(C)C ZINC000894021751 1042402668 /nfs/dbraw/zinc/40/26/68/1042402668.db2.gz VHRWNCGKAYPZES-QGZVFWFLSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1noc2ncc(C[N@@H+]3CC[C@H]3c3ccc(Cl)cc3)cc12 ZINC000894059720 1042405623 /nfs/dbraw/zinc/40/56/23/1042405623.db2.gz SQWYKCIUHKWQCH-INIZCTEOSA-N 1 2 313.788 4.132 20 0 DIADLO Cc1noc2ncc(C[N@H+]3CC[C@H]3c3ccc(Cl)cc3)cc12 ZINC000894059720 1042405627 /nfs/dbraw/zinc/40/56/27/1042405627.db2.gz SQWYKCIUHKWQCH-INIZCTEOSA-N 1 2 313.788 4.132 20 0 DIADLO CCOc1cc(F)c(F)cc1Nc1ccccc1-n1cc[nH+]c1 ZINC001211800788 1042454836 /nfs/dbraw/zinc/45/48/36/1042454836.db2.gz GMVQHCQNXTWMBV-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO Cc1ccc(C)c(NC(=O)C[N@@H+](C)[C@@H](C)c2ccccc2F)c1 ZINC000052074433 1042474359 /nfs/dbraw/zinc/47/43/59/1042474359.db2.gz RBWNPCWRLLXWIC-HNNXBMFYSA-N 1 2 314.404 4.074 20 0 DIADLO Cc1ccc(C)c(NC(=O)C[N@H+](C)[C@@H](C)c2ccccc2F)c1 ZINC000052074433 1042474363 /nfs/dbraw/zinc/47/43/63/1042474363.db2.gz RBWNPCWRLLXWIC-HNNXBMFYSA-N 1 2 314.404 4.074 20 0 DIADLO CC(C)c1ccc([C@H]([NH2+]Cc2cnc[nH]2)c2cccs2)cc1 ZINC000894158490 1042475925 /nfs/dbraw/zinc/47/59/25/1042475925.db2.gz RQGVIDGQHWGHNT-SFHVURJKSA-N 1 2 311.454 4.474 20 0 DIADLO Cn1ccnc1[C@H]([NH2+]Cc1cccs1)c1ccc(Cl)cc1 ZINC000052774879 1042516482 /nfs/dbraw/zinc/51/64/82/1042516482.db2.gz CVYYHNSQJVXOLK-OAHLLOKOSA-N 1 2 317.845 4.014 20 0 DIADLO CSc1cc(C)nc(SC)c1Nc1ccn2cc[nH+]c2c1 ZINC001204951753 1042523761 /nfs/dbraw/zinc/52/37/61/1042523761.db2.gz ZGKTWIIGXDRQMW-UHFFFAOYSA-N 1 2 316.455 4.225 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@@H]2CCc3c2c(F)ccc3F)n1 ZINC000513395959 1042538657 /nfs/dbraw/zinc/53/86/57/1042538657.db2.gz WDXKLTZLCIDJGY-CYBMUJFWSA-N 1 2 322.424 4.496 20 0 DIADLO Cc1ccncc1CNc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000280186081 1042567097 /nfs/dbraw/zinc/56/70/97/1042567097.db2.gz HSESYSCDMYBKAI-UHFFFAOYSA-N 1 2 318.424 4.202 20 0 DIADLO CCn1cc([C@H](C)[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)cn1 ZINC000280292029 1042569711 /nfs/dbraw/zinc/56/97/11/1042569711.db2.gz ZHZJQTDFHREGRW-OXJNMPFZSA-N 1 2 320.440 4.047 20 0 DIADLO CC[C@@](C)([NH2+]Cc1ccc(Cl)cc1OC)c1nccs1 ZINC000280321049 1042570065 /nfs/dbraw/zinc/57/00/65/1042570065.db2.gz YGPYXRUBXSQUTB-OAHLLOKOSA-N 1 2 310.850 4.220 20 0 DIADLO Fc1ccc(F)c(C[NH+]2CCC3(CC3(F)F)CC2)c1Cl ZINC000628325121 1042572950 /nfs/dbraw/zinc/57/29/50/1042572950.db2.gz ZEMBUWUXTIJQPT-UHFFFAOYSA-N 1 2 307.718 4.239 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000319622999 1042579110 /nfs/dbraw/zinc/57/91/10/1042579110.db2.gz AXALONQUAHIXML-CQSZACIVSA-N 1 2 313.401 4.451 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2ccc(C(C)=O)cc2)c1C ZINC000419453324 1042583278 /nfs/dbraw/zinc/58/32/78/1042583278.db2.gz JIARAZUVGQFKLR-UHFFFAOYSA-N 1 2 315.438 4.343 20 0 DIADLO C[C@H](c1ccc(CSCCn2cc[nH+]c2)cc1)C(F)(F)F ZINC000419526233 1042587982 /nfs/dbraw/zinc/58/79/82/1042587982.db2.gz ZQVQNMGENNKMOB-GFCCVEGCSA-N 1 2 314.376 4.482 20 0 DIADLO Cc1occc1C[N@@H+]1CCC[C@H]1c1ccc(Br)cn1 ZINC000414462062 1042610173 /nfs/dbraw/zinc/61/01/73/1042610173.db2.gz PNRXXPZDXJZEFT-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1occc1C[N@H+]1CCC[C@H]1c1ccc(Br)cn1 ZINC000414462062 1042610178 /nfs/dbraw/zinc/61/01/78/1042610178.db2.gz PNRXXPZDXJZEFT-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1cc(N2CCC[C@H](CC(F)(F)F)C2)nc(C(C)C)[nH+]1 ZINC000420627463 1042610345 /nfs/dbraw/zinc/61/03/45/1042610345.db2.gz MXIGEIJMRUDTFO-GFCCVEGCSA-N 1 2 301.356 4.077 20 0 DIADLO Cc1cccc([C@H]2CCCN2C(=O)NCc2cc(C)[nH+]c(C)c2)c1 ZINC000420847929 1042613690 /nfs/dbraw/zinc/61/36/90/1042613690.db2.gz LAZCPHLJQILULZ-LJQANCHMSA-N 1 2 323.440 4.054 20 0 DIADLO CCCC[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(OC)cc1 ZINC000420913225 1042615389 /nfs/dbraw/zinc/61/53/89/1042615389.db2.gz ARWMKNZBWBCGLE-INIZCTEOSA-N 1 2 321.852 4.103 20 0 DIADLO C[C@@H]1C[C@H]1[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(Cl)cc1 ZINC000420938578 1042616613 /nfs/dbraw/zinc/61/66/13/1042616613.db2.gz MISOOUQVPDURIW-CKUKBARFSA-N 1 2 324.255 4.214 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420939598 1042616690 /nfs/dbraw/zinc/61/66/90/1042616690.db2.gz BVCUYLLGQHBQEP-MNOVXSKESA-N 1 2 319.371 4.093 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420939598 1042616691 /nfs/dbraw/zinc/61/66/91/1042616691.db2.gz BVCUYLLGQHBQEP-MNOVXSKESA-N 1 2 319.371 4.093 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2nc(-c3ccccc3)oc2C)C[C@H](CC)O1 ZINC000420951041 1042616747 /nfs/dbraw/zinc/61/67/47/1042616747.db2.gz QJAOUDKAUKFMKV-CALCHBBNSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2nc(-c3ccccc3)oc2C)C[C@H](CC)O1 ZINC000420951041 1042616750 /nfs/dbraw/zinc/61/67/50/1042616750.db2.gz QJAOUDKAUKFMKV-CALCHBBNSA-N 1 2 314.429 4.039 20 0 DIADLO CCc1ccc(-c2ccc(C[NH2+]Cc3ccn(CC)n3)o2)cc1 ZINC000414484212 1042619876 /nfs/dbraw/zinc/61/98/76/1042619876.db2.gz PLDNEXPMZMOPJU-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO CCCOc1c(C[NH2+][C@@H](C)c2nccs2)cccc1OCC ZINC000414491760 1042622872 /nfs/dbraw/zinc/62/28/72/1042622872.db2.gz DFTNQYVKHYCRQI-ZDUSSCGKSA-N 1 2 320.458 4.181 20 0 DIADLO COCc1nc(C[N@H+](C(C)C)[C@@H](C)c2ccsc2)cs1 ZINC000421020067 1042622930 /nfs/dbraw/zinc/62/29/30/1042622930.db2.gz YPZNGUGGFSGMPY-LBPRGKRZSA-N 1 2 310.488 4.323 20 0 DIADLO COCc1nc(C[N@@H+](C(C)C)[C@@H](C)c2ccsc2)cs1 ZINC000421020067 1042622932 /nfs/dbraw/zinc/62/29/32/1042622932.db2.gz YPZNGUGGFSGMPY-LBPRGKRZSA-N 1 2 310.488 4.323 20 0 DIADLO Cc1cc(Br)c(C[NH2+][C@@H](C)c2nccs2)s1 ZINC000414493369 1042623354 /nfs/dbraw/zinc/62/33/54/1042623354.db2.gz ILYMRJSOWUPYNY-QMMMGPOBSA-N 1 2 317.277 4.126 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2nn(C)c(C)c2Cl)s1 ZINC000421319458 1042630221 /nfs/dbraw/zinc/63/02/21/1042630221.db2.gz NAQWPTIQZSYRAQ-CYBMUJFWSA-N 1 2 309.866 4.089 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nn(C)c(C)c2Cl)s1 ZINC000421319458 1042630223 /nfs/dbraw/zinc/63/02/23/1042630223.db2.gz NAQWPTIQZSYRAQ-CYBMUJFWSA-N 1 2 309.866 4.089 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)nn1C ZINC000421337540 1042631279 /nfs/dbraw/zinc/63/12/79/1042631279.db2.gz ZJNXCJZCAMNTFP-INIZCTEOSA-N 1 2 324.255 4.276 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccncc1Cl ZINC000421834684 1042655445 /nfs/dbraw/zinc/65/54/45/1042655445.db2.gz CRLMHFNFZOCCOL-ZDUSSCGKSA-N 1 2 316.836 4.293 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccncc1Cl ZINC000421839995 1042658834 /nfs/dbraw/zinc/65/88/34/1042658834.db2.gz ZHBJLAOPOPOUQS-ZDUSSCGKSA-N 1 2 316.836 4.293 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2ccc(Cl)cc2OC)cs1 ZINC000421838839 1042658893 /nfs/dbraw/zinc/65/88/93/1042658893.db2.gz VWPFEGRKLMQCFQ-JTQLQIEISA-N 1 2 310.850 4.218 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1cccc(N2CCCC2)c1 ZINC000271763284 1042668023 /nfs/dbraw/zinc/66/80/23/1042668023.db2.gz GRUZINUFNDNJQK-CQSZACIVSA-N 1 2 311.429 4.003 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2oc3ccccc3c2CC)[nH]1 ZINC000271896541 1042671805 /nfs/dbraw/zinc/67/18/05/1042671805.db2.gz UKTQUNWCIODADU-NEPJUHHUSA-N 1 2 312.417 4.088 20 0 DIADLO Cc1ccccc1[C@@H]([NH2+]Cc1noc(-c2ccccc2)n1)C1CC1 ZINC000272077478 1042676333 /nfs/dbraw/zinc/67/63/33/1042676333.db2.gz VRLYWOJFHCCQRS-IBGZPJMESA-N 1 2 319.408 4.286 20 0 DIADLO Cc1cc(CNC(=O)N(C)[C@H]2CCC[C@H]2C(C)(C)C)cc(C)[nH+]1 ZINC000422215295 1042682182 /nfs/dbraw/zinc/68/21/82/1042682182.db2.gz UEXJDCKUPLAIFF-SJORKVTESA-N 1 2 317.477 4.055 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2ccc(C(C)C)cc2)c2cccnc2)on1 ZINC000924959254 1042693800 /nfs/dbraw/zinc/69/38/00/1042693800.db2.gz JGLMFYKEQXITDQ-HXUWFJFHSA-N 1 2 321.424 4.381 20 0 DIADLO Cc1ccc(NC(=O)C[C@H](C)[NH2+]c2ccc3c(c2)CCN3)c(C)c1 ZINC000423217282 1042701634 /nfs/dbraw/zinc/70/16/34/1042701634.db2.gz PWKCYZZSRLYHRB-HNNXBMFYSA-N 1 2 323.440 4.101 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@@H]2CCOc3ccc(F)cc32)c(F)c1 ZINC000424181198 1042727537 /nfs/dbraw/zinc/72/75/37/1042727537.db2.gz XETSBSNRMXHCPV-MRXNPFEDSA-N 1 2 307.315 4.026 20 0 DIADLO CCCCOc1ccc(OC)cc1NCc1c[nH+]cn1C(C)C ZINC000424161032 1042728195 /nfs/dbraw/zinc/72/81/95/1042728195.db2.gz XYNBVCBBEPSWBS-UHFFFAOYSA-N 1 2 317.433 4.264 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2ccc(OC)cc2Cl)cs1 ZINC000424291516 1042731659 /nfs/dbraw/zinc/73/16/59/1042731659.db2.gz BRADSCUVAZDSJP-SNVBAGLBSA-N 1 2 310.850 4.218 20 0 DIADLO CCCC(C)(C)CC(=O)N1CC[NH2+][C@@H](c2cccc(Cl)c2)C1 ZINC000514002478 1042766911 /nfs/dbraw/zinc/76/69/11/1042766911.db2.gz XKYPTWSAXAJHOE-MRXNPFEDSA-N 1 2 322.880 4.029 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2noc(-c3ccccc3)n2)cc1 ZINC000514235988 1042776501 /nfs/dbraw/zinc/77/65/01/1042776501.db2.gz LXSZWFMCWZKWHF-SFHVURJKSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2noc(-c3ccccc3)n2)cc1 ZINC000514235988 1042776507 /nfs/dbraw/zinc/77/65/07/1042776507.db2.gz LXSZWFMCWZKWHF-SFHVURJKSA-N 1 2 319.408 4.382 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(C3CCC3)s2)[C@H]1c1cccnc1 ZINC000430111735 1042780419 /nfs/dbraw/zinc/78/04/19/1042780419.db2.gz UGIZMSUJBAFBPV-INIZCTEOSA-N 1 2 313.470 4.389 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(C3CCC3)s2)[C@H]1c1cccnc1 ZINC000430111735 1042780422 /nfs/dbraw/zinc/78/04/22/1042780422.db2.gz UGIZMSUJBAFBPV-INIZCTEOSA-N 1 2 313.470 4.389 20 0 DIADLO CC(C)n1c[nH+]cc1CN(Cc1ccco1)Cc1ccccc1 ZINC000425328729 1042793176 /nfs/dbraw/zinc/79/31/76/1042793176.db2.gz URCLYROJORKUQW-UHFFFAOYSA-N 1 2 309.413 4.259 20 0 DIADLO FC(F)(F)C1CCC(Nc2ccc(N3CCCC3)c[nH+]2)CC1 ZINC000425370080 1042799759 /nfs/dbraw/zinc/79/97/59/1042799759.db2.gz NGOHAPSCZZIFOU-UHFFFAOYSA-N 1 2 313.367 4.215 20 0 DIADLO CCSc1ccc(Cl)cc1NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000514941244 1042801979 /nfs/dbraw/zinc/80/19/79/1042801979.db2.gz AMPQEVOKLWCQBB-NSHDSACASA-N 1 2 323.849 4.238 20 0 DIADLO Cc1nc([C@@H](C)[NH+]2CCC(C)(c3ccc(Cl)cc3)CC2)no1 ZINC000515021084 1042804580 /nfs/dbraw/zinc/80/45/80/1042804580.db2.gz WKJICICWRABWJG-GFCCVEGCSA-N 1 2 319.836 4.146 20 0 DIADLO Cc1nc([C@H](C)[NH+]2CCC(C)(c3ccc(Cl)cc3)CC2)no1 ZINC000515021085 1042804879 /nfs/dbraw/zinc/80/48/79/1042804879.db2.gz WKJICICWRABWJG-LBPRGKRZSA-N 1 2 319.836 4.146 20 0 DIADLO COc1c(F)cc(F)cc1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001143560785 1042811496 /nfs/dbraw/zinc/81/14/96/1042811496.db2.gz DUCYSEDJYRXJPH-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cc(F)cc1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001143560785 1042811505 /nfs/dbraw/zinc/81/15/05/1042811505.db2.gz DUCYSEDJYRXJPH-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO CC(C)(C)[C@H]([NH2+]Cc1nc(C(F)F)no1)c1ccc(F)cc1 ZINC000425427895 1042821460 /nfs/dbraw/zinc/82/14/60/1042821460.db2.gz TWKDQMHNOMVYMY-GFCCVEGCSA-N 1 2 313.323 4.023 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(F)F)no1)c1ccc(F)c2ccccc21 ZINC000425458548 1042826799 /nfs/dbraw/zinc/82/67/99/1042826799.db2.gz NBWBIOPJWHYXQN-SECBINFHSA-N 1 2 321.302 4.150 20 0 DIADLO CCC[C@H]1CCC[N@H+](Cc2nc(C)c(Br)s2)C1 ZINC001167960920 1042840343 /nfs/dbraw/zinc/84/03/43/1042840343.db2.gz YRQQORSWUGEGKL-NSHDSACASA-N 1 2 317.296 4.226 20 0 DIADLO CCC[C@H]1CCC[N@@H+](Cc2nc(C)c(Br)s2)C1 ZINC001167960920 1042840346 /nfs/dbraw/zinc/84/03/46/1042840346.db2.gz YRQQORSWUGEGKL-NSHDSACASA-N 1 2 317.296 4.226 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1cccc(F)c1F ZINC000516933767 1042860438 /nfs/dbraw/zinc/86/04/38/1042860438.db2.gz YXYYBBRPJIPCRN-OTYXRUKQSA-N 1 2 309.743 4.403 20 0 DIADLO CC[C@@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)C(C)C ZINC000517163696 1042869993 /nfs/dbraw/zinc/86/99/93/1042869993.db2.gz PCFRCTLHHDTCHX-ZDUSSCGKSA-N 1 2 303.381 4.022 20 0 DIADLO Fc1cccc(F)c1C[N@H+](C/C=C\c1ccncc1)C1CC1 ZINC000425984457 1042892993 /nfs/dbraw/zinc/89/29/93/1042892993.db2.gz IGSWIOHJPCDICD-IHWYPQMZSA-N 1 2 300.352 4.038 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](C/C=C\c1ccncc1)C1CC1 ZINC000425984457 1042892998 /nfs/dbraw/zinc/89/29/98/1042892998.db2.gz IGSWIOHJPCDICD-IHWYPQMZSA-N 1 2 300.352 4.038 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)Cc1cccs1 ZINC000073387034 1042899225 /nfs/dbraw/zinc/89/92/25/1042899225.db2.gz YJMMYDRMTMSPJZ-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)Cc1cccs1 ZINC000073387034 1042899231 /nfs/dbraw/zinc/89/92/31/1042899231.db2.gz YJMMYDRMTMSPJZ-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccnn2C2CCC2)cs1 ZINC000925034524 1042901960 /nfs/dbraw/zinc/90/19/60/1042901960.db2.gz SZZRPYLODQBNHX-NWDGAFQWSA-N 1 2 304.463 4.039 20 0 DIADLO CCCCCC(C)(C)C[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000294689615 1042909406 /nfs/dbraw/zinc/90/94/06/1042909406.db2.gz IMMFFHKNBKLPPN-AWEZNQCLSA-N 1 2 306.479 4.152 20 0 DIADLO Cc1cnccc1CNc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000296817851 1042919231 /nfs/dbraw/zinc/91/92/31/1042919231.db2.gz NHXVIMPMVQZOJJ-UHFFFAOYSA-N 1 2 318.424 4.202 20 0 DIADLO CC[N@H+](C)[C@H](c1nc(Cc2cccc(C)c2)no1)c1ccccc1 ZINC000519225537 1042938591 /nfs/dbraw/zinc/93/85/91/1042938591.db2.gz PSVCXOQHJARIFI-IBGZPJMESA-N 1 2 321.424 4.010 20 0 DIADLO CC[N@@H+](C)[C@H](c1nc(Cc2cccc(C)c2)no1)c1ccccc1 ZINC000519225537 1042938593 /nfs/dbraw/zinc/93/85/93/1042938593.db2.gz PSVCXOQHJARIFI-IBGZPJMESA-N 1 2 321.424 4.010 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)Cc1ncc(C2CC2)o1 ZINC000340657556 1042951982 /nfs/dbraw/zinc/95/19/82/1042951982.db2.gz HNUBOOYPJWHSRQ-UHFFFAOYSA-N 1 2 310.397 4.493 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000340657556 1042951984 /nfs/dbraw/zinc/95/19/84/1042951984.db2.gz HNUBOOYPJWHSRQ-UHFFFAOYSA-N 1 2 310.397 4.493 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(C(F)F)c(F)c1)c1c(F)cncc1F ZINC000894436056 1042957894 /nfs/dbraw/zinc/95/78/94/1042957894.db2.gz SWUHYZZDEKJACK-MRVPVSSYSA-N 1 2 316.273 4.287 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[NH2+][C@@H](C)c1c(F)cncc1F ZINC000894435223 1042958481 /nfs/dbraw/zinc/95/84/81/1042958481.db2.gz MMTSVEYUINMYPG-JTQLQIEISA-N 1 2 308.372 4.410 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(-c3ccccc3)no2)[C@@H]1c1ccncc1 ZINC000664831781 1042967941 /nfs/dbraw/zinc/96/79/41/1042967941.db2.gz BHEJJZZAFUTIPB-LJQANCHMSA-N 1 2 319.408 4.320 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(-c3ccccc3)no2)[C@@H]1c1ccncc1 ZINC000664831781 1042967944 /nfs/dbraw/zinc/96/79/44/1042967944.db2.gz BHEJJZZAFUTIPB-LJQANCHMSA-N 1 2 319.408 4.320 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2ccc(C(C)(F)F)cc2)s1 ZINC000894610059 1042969449 /nfs/dbraw/zinc/96/94/49/1042969449.db2.gz IHVVGFVEDSLCNC-UHFFFAOYSA-N 1 2 311.401 4.063 20 0 DIADLO Cc1nn(C(C)C)c(C)c1C[N@@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000894584180 1042969731 /nfs/dbraw/zinc/96/97/31/1042969731.db2.gz GVFYUOWSUAUFLS-GOSISDBHSA-N 1 2 312.461 4.059 20 0 DIADLO Cc1nn(C(C)C)c(C)c1C[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000894584180 1042969734 /nfs/dbraw/zinc/96/97/34/1042969734.db2.gz GVFYUOWSUAUFLS-GOSISDBHSA-N 1 2 312.461 4.059 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000894705681 1042974172 /nfs/dbraw/zinc/97/41/72/1042974172.db2.gz BAVAKUMXAYRQPS-WDEREUQCSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000894705681 1042974174 /nfs/dbraw/zinc/97/41/74/1042974174.db2.gz BAVAKUMXAYRQPS-WDEREUQCSA-N 1 2 304.356 4.135 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2cc3ccccc3o2)s1 ZINC000519581812 1042978507 /nfs/dbraw/zinc/97/85/07/1042978507.db2.gz FPYMCBINCQABPY-UHFFFAOYSA-N 1 2 304.440 4.042 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H](C)c1nc2ccccc2n1C ZINC000319980141 1042980210 /nfs/dbraw/zinc/98/02/10/1042980210.db2.gz FNEZXKLBHDEMSQ-AWEZNQCLSA-N 1 2 308.429 4.121 20 0 DIADLO CC[C@H](NC(=O)CCCn1cc[nH+]c1)c1cccc2ccccc21 ZINC000894855179 1042989593 /nfs/dbraw/zinc/98/95/93/1042989593.db2.gz NXAXYSSTNSGYSD-IBGZPJMESA-N 1 2 321.424 4.084 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@H]2c2nc(-c3ccccc3)no2)cc1 ZINC000188004165 1042996128 /nfs/dbraw/zinc/99/61/28/1042996128.db2.gz ZYUOUJIRXNMMSX-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@H]2c2nc(-c3ccccc3)no2)cc1 ZINC000188004165 1042996130 /nfs/dbraw/zinc/99/61/30/1042996130.db2.gz ZYUOUJIRXNMMSX-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@@H]2c2nc(-c3ccccc3)no2)cc1 ZINC000188004187 1042996328 /nfs/dbraw/zinc/99/63/28/1042996328.db2.gz ZYUOUJIRXNMMSX-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@@H]2c2nc(-c3ccccc3)no2)cc1 ZINC000188004187 1042996330 /nfs/dbraw/zinc/99/63/30/1042996330.db2.gz ZYUOUJIRXNMMSX-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO FC(F)(F)c1ccc(Cl)c(Nc2ccn3cc[nH+]c3c2)n1 ZINC001204971295 1043003662 /nfs/dbraw/zinc/00/36/62/1043003662.db2.gz GNRTZTKSXGXNSS-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO Cc1cccc(C[N@@H+]2Cc3cccc(Br)c3C2)c1 ZINC000713232986 1043004089 /nfs/dbraw/zinc/00/40/89/1043004089.db2.gz OWZQKOLFOBFUTL-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO Cc1cccc(C[N@H+]2Cc3cccc(Br)c3C2)c1 ZINC000713232986 1043004095 /nfs/dbraw/zinc/00/40/95/1043004095.db2.gz OWZQKOLFOBFUTL-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(OCC(C)C)cc2)c(C)[nH+]1 ZINC000519963674 1043011615 /nfs/dbraw/zinc/01/16/15/1043011615.db2.gz PRCBZQMKRNNRGI-UHFFFAOYSA-N 1 2 312.413 4.294 20 0 DIADLO C[N@H+](CCOc1ccccc1)Cc1csc(C2CCCC2)n1 ZINC000520172812 1043020587 /nfs/dbraw/zinc/02/05/87/1043020587.db2.gz BPEHDISCXCMINH-UHFFFAOYSA-N 1 2 316.470 4.312 20 0 DIADLO C[N@@H+](CCOc1ccccc1)Cc1csc(C2CCCC2)n1 ZINC000520172812 1043020593 /nfs/dbraw/zinc/02/05/93/1043020593.db2.gz BPEHDISCXCMINH-UHFFFAOYSA-N 1 2 316.470 4.312 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[N@H+](Cc1ccco1)C(C)C ZINC000520168586 1043021909 /nfs/dbraw/zinc/02/19/09/1043021909.db2.gz IGTTZPDOWAMAOH-UHFFFAOYSA-N 1 2 314.429 4.252 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[N@@H+](Cc1ccco1)C(C)C ZINC000520168586 1043021913 /nfs/dbraw/zinc/02/19/13/1043021913.db2.gz IGTTZPDOWAMAOH-UHFFFAOYSA-N 1 2 314.429 4.252 20 0 DIADLO CC(C)CCc1noc(C[N@H+](Cc2ccc(F)cc2)C(C)C)n1 ZINC000520183375 1043023627 /nfs/dbraw/zinc/02/36/27/1043023627.db2.gz WAKWJPOSDFTJGB-UHFFFAOYSA-N 1 2 319.424 4.208 20 0 DIADLO CC(C)CCc1noc(C[N@@H+](Cc2ccc(F)cc2)C(C)C)n1 ZINC000520183375 1043023632 /nfs/dbraw/zinc/02/36/32/1043023632.db2.gz WAKWJPOSDFTJGB-UHFFFAOYSA-N 1 2 319.424 4.208 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@H]3c3ccccn3)sc2c1 ZINC000520321621 1043033399 /nfs/dbraw/zinc/03/33/99/1043033399.db2.gz NXNHYQUWOKKCKE-HNNXBMFYSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@H]3c3ccccn3)sc2c1 ZINC000520321621 1043033404 /nfs/dbraw/zinc/03/34/04/1043033404.db2.gz NXNHYQUWOKKCKE-HNNXBMFYSA-N 1 2 313.401 4.168 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000520383642 1043041155 /nfs/dbraw/zinc/04/11/55/1043041155.db2.gz JKVNLWULWLKAAN-TYILLQQXSA-N 1 2 317.379 4.488 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000520383642 1043041160 /nfs/dbraw/zinc/04/11/60/1043041160.db2.gz JKVNLWULWLKAAN-TYILLQQXSA-N 1 2 317.379 4.488 20 0 DIADLO Cc1cc(N[C@@H](C)c2cc3cnccc3o2)nc(C2CCC2)[nH+]1 ZINC000895037137 1043068412 /nfs/dbraw/zinc/06/84/12/1043068412.db2.gz DPANECDJZMGPHL-LBPRGKRZSA-N 1 2 308.385 4.367 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2)cs1 ZINC000175096711 1043075419 /nfs/dbraw/zinc/07/54/19/1043075419.db2.gz DCYXOZPORMXAPB-UONOGXRCSA-N 1 2 304.459 4.352 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2)cs1 ZINC000175096711 1043075431 /nfs/dbraw/zinc/07/54/31/1043075431.db2.gz DCYXOZPORMXAPB-UONOGXRCSA-N 1 2 304.459 4.352 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2cccnc2F)c2ccccc2)cc1 ZINC000794836520 1043084194 /nfs/dbraw/zinc/08/41/94/1043084194.db2.gz QMDMERHTDQTUHT-GOSISDBHSA-N 1 2 310.347 4.239 20 0 DIADLO CC(C)(C)c1cn(Cc2ccc(Cl)nc2C(F)(F)F)c[nH+]1 ZINC000865376461 1043088318 /nfs/dbraw/zinc/08/83/18/1043088318.db2.gz ODDGAVZMIQCVPO-UHFFFAOYSA-N 1 2 317.742 4.296 20 0 DIADLO CC(C)(C)c1cn(Cc2coc(-c3ccc(F)c(F)c3)n2)c[nH+]1 ZINC000865375914 1043088627 /nfs/dbraw/zinc/08/86/27/1043088627.db2.gz QPEKZCOLBLBBQD-UHFFFAOYSA-N 1 2 317.339 4.162 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CC[C@@H](C)c3ccccc3)cc2[nH+]1 ZINC000441433451 1043090639 /nfs/dbraw/zinc/09/06/39/1043090639.db2.gz GMYNTEXVPRLZRS-CYBMUJFWSA-N 1 2 307.397 4.394 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2ccc(OC(F)F)cc2F)n1 ZINC000865446501 1043100359 /nfs/dbraw/zinc/10/03/59/1043100359.db2.gz VSIZIISQVSHLIG-SECBINFHSA-N 1 2 316.348 4.043 20 0 DIADLO C[C@H]([NH2+]c1ccc(N2CCC(O)CC2)cc1)C1CCCCC1 ZINC000177235920 1043104353 /nfs/dbraw/zinc/10/43/53/1043104353.db2.gz ZGYMFVLNSQSILR-HNNXBMFYSA-N 1 2 302.462 4.028 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(OC(F)F)cc2F)s1 ZINC000865485768 1043105366 /nfs/dbraw/zinc/10/53/66/1043105366.db2.gz URVBFLUCVCYXHJ-SECBINFHSA-N 1 2 316.348 4.043 20 0 DIADLO O=C(C[C@@H]1CCC[N@H+]1Cc1ccc(Cl)nc1)c1cccs1 ZINC000177395591 1043106190 /nfs/dbraw/zinc/10/61/90/1043106190.db2.gz LKYCNFJUOCVKQU-ZDUSSCGKSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)nc1)c1cccs1 ZINC000177395591 1043106207 /nfs/dbraw/zinc/10/62/07/1043106207.db2.gz LKYCNFJUOCVKQU-ZDUSSCGKSA-N 1 2 320.845 4.034 20 0 DIADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+]Cc1cn(C2CC2)cn1 ZINC000865545194 1043112244 /nfs/dbraw/zinc/11/22/44/1043112244.db2.gz TWEZSQSTXGQEQW-MRXNPFEDSA-N 1 2 323.362 4.310 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@@H]2CCOc3c(F)cccc32)n1 ZINC000865539866 1043112329 /nfs/dbraw/zinc/11/23/29/1043112329.db2.gz ZNILFIWDKGUCMV-CYBMUJFWSA-N 1 2 320.433 4.193 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1ccc2ccccc2n1)c1ccc(C)o1 ZINC000178229106 1043124014 /nfs/dbraw/zinc/12/40/14/1043124014.db2.gz GFDBRCIYTDTEQF-RDTXWAMCSA-N 1 2 310.397 4.175 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2conc2Cc2ccccc2)o1 ZINC000865815366 1043136507 /nfs/dbraw/zinc/13/65/07/1043136507.db2.gz VXEMPSWWESYQHG-UHFFFAOYSA-N 1 2 324.424 4.446 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2ccc3ccccc3n2)o1 ZINC000178801746 1043137548 /nfs/dbraw/zinc/13/75/48/1043137548.db2.gz OFSYAPVEZFOJMK-AUUYWEPGSA-N 1 2 324.424 4.429 20 0 DIADLO Cc1c[nH]c(C[NH2+][C@@H](c2nc3ccccc3[nH]2)C2CCCCC2)n1 ZINC000865841255 1043139699 /nfs/dbraw/zinc/13/96/99/1043139699.db2.gz AKDACDVPQOGERK-GOSISDBHSA-N 1 2 323.444 4.006 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)nc1)c1ccco1 ZINC000179117577 1043140861 /nfs/dbraw/zinc/14/08/61/1043140861.db2.gz UKDUWKZKMDTGAN-DZGCQCFKSA-N 1 2 322.836 4.393 20 0 DIADLO Cc1ncsc1C[N@H+](C)Cc1ccc(CSC(F)F)o1 ZINC000179429078 1043144933 /nfs/dbraw/zinc/14/49/33/1043144933.db2.gz LIBZLNVPDNMVKT-UHFFFAOYSA-N 1 2 318.414 4.132 20 0 DIADLO Cc1ncsc1C[N@@H+](C)Cc1ccc(CSC(F)F)o1 ZINC000179429078 1043144938 /nfs/dbraw/zinc/14/49/38/1043144938.db2.gz LIBZLNVPDNMVKT-UHFFFAOYSA-N 1 2 318.414 4.132 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(Br)o2)o1 ZINC000189498166 1043155869 /nfs/dbraw/zinc/15/58/69/1043155869.db2.gz LDKLWZGWJMNZAX-JOYOIKCWSA-N 1 2 310.191 4.048 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2cccc(F)c2F)o1 ZINC000183271573 1043158882 /nfs/dbraw/zinc/15/88/82/1043158882.db2.gz FUTDDSBBJZSITL-ABAIWWIYSA-N 1 2 309.356 4.159 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+](C)[C@H](C)c2cccnc2)s1 ZINC000183634846 1043168564 /nfs/dbraw/zinc/16/85/64/1043168564.db2.gz YOMSHQHUCSAPPG-SECBINFHSA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+](C)[C@H](C)c2cccnc2)s1 ZINC000183634846 1043168566 /nfs/dbraw/zinc/16/85/66/1043168566.db2.gz YOMSHQHUCSAPPG-SECBINFHSA-N 1 2 315.364 4.058 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@@H](C)c2cccc(C)c2C)n1 ZINC000183707324 1043170338 /nfs/dbraw/zinc/17/03/38/1043170338.db2.gz KQOAYPHFRYNANO-KBPBESRZSA-N 1 2 319.474 4.351 20 0 DIADLO C[C@@H]([NH2+]Cc1ccon1)c1cccc(SC(F)(F)F)c1 ZINC000866278058 1043172837 /nfs/dbraw/zinc/17/28/37/1043172837.db2.gz LRUFSNQUBMQTOZ-SECBINFHSA-N 1 2 302.321 4.137 20 0 DIADLO Cc1nn(C(C)(C)C)cc1[C@@H](C)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000130522242 1043178161 /nfs/dbraw/zinc/17/81/61/1043178161.db2.gz DFZSKKRQCCAQPK-CYBMUJFWSA-N 1 2 315.465 4.341 20 0 DIADLO c1n[nH]c([C@H]([NH2+]CC2(c3ccccc3)CCC2)C2CCCCC2)n1 ZINC000520481533 1043178409 /nfs/dbraw/zinc/17/84/09/1043178409.db2.gz IKIGJPFYDFUOMR-GOSISDBHSA-N 1 2 324.472 4.138 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)s1 ZINC000866335830 1043183017 /nfs/dbraw/zinc/18/30/17/1043183017.db2.gz AXYSVUZWXSEICG-YUMQZZPRSA-N 1 2 322.821 4.053 20 0 DIADLO FC(F)c1ccc(C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)cc1 ZINC000866341847 1043184911 /nfs/dbraw/zinc/18/49/11/1043184911.db2.gz SEBLNRKXEWHEMF-GDBMZVCRSA-N 1 2 307.315 4.186 20 0 DIADLO CCCNc1ccc(C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)cc1 ZINC000866348049 1043186292 /nfs/dbraw/zinc/18/62/92/1043186292.db2.gz MHCFLOVUTNXZEW-IEBWSBKVSA-N 1 2 314.404 4.070 20 0 DIADLO CCC[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1cc(C)ccn1 ZINC000866362164 1043187737 /nfs/dbraw/zinc/18/77/37/1043187737.db2.gz AYXGDPPDLFRGLX-MRXNPFEDSA-N 1 2 308.347 4.438 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1F)c1nccn1C ZINC000866576505 1043227352 /nfs/dbraw/zinc/22/73/52/1043227352.db2.gz GODDBFJXHJUTEW-GFCCVEGCSA-N 1 2 316.207 4.107 20 0 DIADLO CCC[C@@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1cccnc1 ZINC000186806172 1043235421 /nfs/dbraw/zinc/23/54/21/1043235421.db2.gz QUQVYCVTTUBMBH-QGZVFWFLSA-N 1 2 317.433 4.016 20 0 DIADLO c1csc([C@H]2CSCC[N@H+]2CCSc2ccccc2)n1 ZINC000187028473 1043238872 /nfs/dbraw/zinc/23/88/72/1043238872.db2.gz XRVKHBHCEZXBGQ-CQSZACIVSA-N 1 2 322.524 4.025 20 0 DIADLO c1csc([C@H]2CSCC[N@@H+]2CCSc2ccccc2)n1 ZINC000187028473 1043238880 /nfs/dbraw/zinc/23/88/80/1043238880.db2.gz XRVKHBHCEZXBGQ-CQSZACIVSA-N 1 2 322.524 4.025 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@@H](c2ncc[nH]2)c2ccc(F)cc2)c(C)c1 ZINC000187894966 1043253667 /nfs/dbraw/zinc/25/36/67/1043253667.db2.gz SFDAYAJLWCEBCE-LJQANCHMSA-N 1 2 323.415 4.353 20 0 DIADLO Clc1ncccc1CNc1ccc([N@@H+]2C[C@H]3CC[C@@H]2C3)cc1 ZINC000192217685 1043267536 /nfs/dbraw/zinc/26/75/36/1043267536.db2.gz MMBWTCNUAJDPEL-SUMWQHHRSA-N 1 2 313.832 4.336 20 0 DIADLO Clc1ncccc1CNc1ccc([N@H+]2C[C@H]3CC[C@@H]2C3)cc1 ZINC000192217685 1043267549 /nfs/dbraw/zinc/26/75/49/1043267549.db2.gz MMBWTCNUAJDPEL-SUMWQHHRSA-N 1 2 313.832 4.336 20 0 DIADLO c1[nH]nc2cc(CNc3ccc([N@@H+]4C[C@H]5CC[C@@H]4C5)cc3)ccc12 ZINC000192216738 1043267738 /nfs/dbraw/zinc/26/77/38/1043267738.db2.gz FSDOEOBMJOQBOJ-HNAYVOBHSA-N 1 2 318.424 4.164 20 0 DIADLO c1[nH]nc2cc(CNc3ccc([N@H+]4C[C@H]5CC[C@@H]4C5)cc3)ccc12 ZINC000192216738 1043267747 /nfs/dbraw/zinc/26/77/47/1043267747.db2.gz FSDOEOBMJOQBOJ-HNAYVOBHSA-N 1 2 318.424 4.164 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@H]1CCCc2occc21)c1ccco1 ZINC000192795747 1043274287 /nfs/dbraw/zinc/27/42/87/1043274287.db2.gz GUEGMCCTHFOZFZ-HOTGVXAUSA-N 1 2 303.402 4.254 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2cnc(-c3ccco3)s2)cs1 ZINC000193099539 1043279520 /nfs/dbraw/zinc/27/95/20/1043279520.db2.gz IONSMDPUZGZSRF-JTQLQIEISA-N 1 2 319.455 4.273 20 0 DIADLO C[C@@H](Nc1ccc([NH+]2CCCC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000320119770 1043287115 /nfs/dbraw/zinc/28/71/15/1043287115.db2.gz XWZGCKKKRWILPX-CQSZACIVSA-N 1 2 311.385 4.368 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)nn1C ZINC000487403484 1043297662 /nfs/dbraw/zinc/29/76/62/1043297662.db2.gz YSNMVXMPWVBLEH-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO Cc1cc(C[N@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)nn1C ZINC000487403484 1043297673 /nfs/dbraw/zinc/29/76/73/1043297673.db2.gz YSNMVXMPWVBLEH-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)cn1 ZINC000427833513 1043309716 /nfs/dbraw/zinc/30/97/16/1043309716.db2.gz WDOFSNHCFIHPNJ-UONOGXRCSA-N 1 2 324.453 4.320 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1ccc(Cl)cc1F ZINC000427878597 1043310159 /nfs/dbraw/zinc/31/01/59/1043310159.db2.gz WCSNRDHRIBBDIY-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO Cc1nn(C)c(C[NH2+]C2(c3ccccc3Cl)CCC2)c1Cl ZINC000895135983 1043314029 /nfs/dbraw/zinc/31/40/29/1043314029.db2.gz CXWTXMJYFRRFBC-UHFFFAOYSA-N 1 2 324.255 4.204 20 0 DIADLO Cc1ccccc1[C@@H](C)[NH2+][C@@H](c1nccn1C)c1ccc(F)cc1 ZINC000268784635 1043331465 /nfs/dbraw/zinc/33/14/65/1043331465.db2.gz VDOFGYZUASRERV-DNVCBOLYSA-N 1 2 323.415 4.308 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cc(F)c(F)cc3F)CCC2)n1 ZINC000268998197 1043348388 /nfs/dbraw/zinc/34/83/88/1043348388.db2.gz YLNPKIIJHBFXPB-UHFFFAOYSA-N 1 2 312.360 4.038 20 0 DIADLO COc1cccc([C@H](C)[NH2+][C@H](C)c2nc(-c3ccccc3)no2)c1 ZINC000269085061 1043356365 /nfs/dbraw/zinc/35/63/65/1043356365.db2.gz MBYKNNIFLYQYEC-UONOGXRCSA-N 1 2 323.396 4.157 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2cc3ccccc3o2)s1 ZINC000269114700 1043356910 /nfs/dbraw/zinc/35/69/10/1043356910.db2.gz WKGXYXURAHQAJE-NSHDSACASA-N 1 2 301.415 4.259 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H]2CC(C)(C)Cc3occc32)cs1 ZINC000269087705 1043357761 /nfs/dbraw/zinc/35/77/61/1043357761.db2.gz PWDSVZWAOFOXFH-SMDDNHRTSA-N 1 2 320.458 4.247 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](c2nc3ccccc3[nH]2)C(C)C)cs1 ZINC000269399090 1043365142 /nfs/dbraw/zinc/36/51/42/1043365142.db2.gz FUIRITJTGFDMNP-ZBEGNZNMSA-N 1 2 314.458 4.376 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H]2CCc3c2c(F)ccc3F)cs1 ZINC000269812267 1043372936 /nfs/dbraw/zinc/37/29/36/1043372936.db2.gz HFCLAGRSWKRBIB-RNCFNFMXSA-N 1 2 308.397 4.322 20 0 DIADLO Cc1csc(C2([NH2+][C@H]3CCc4c3c(F)ccc4F)CCC2)n1 ZINC000269880036 1043375599 /nfs/dbraw/zinc/37/55/99/1043375599.db2.gz YDDRXVRECZUGFV-AWEZNQCLSA-N 1 2 320.408 4.386 20 0 DIADLO Cc1cc(C)c(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)c(=O)[nH]1 ZINC000269937683 1043377460 /nfs/dbraw/zinc/37/74/60/1043377460.db2.gz FOHUEXPREJAYTR-UHFFFAOYSA-N 1 2 314.433 4.053 20 0 DIADLO Cn1c(Cl)nc(Cl)c1C[N@@H+]1CCC[C@H]1c1ccccc1 ZINC000123662357 1043379915 /nfs/dbraw/zinc/37/99/15/1043379915.db2.gz BWOXOFTVKNJMSR-LBPRGKRZSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1c(Cl)nc(Cl)c1C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000123662357 1043379927 /nfs/dbraw/zinc/37/99/27/1043379927.db2.gz BWOXOFTVKNJMSR-LBPRGKRZSA-N 1 2 310.228 4.064 20 0 DIADLO CCc1ccc(CNc2cccc3c2CN(c2cccc[nH+]2)C3)o1 ZINC000270195069 1043381025 /nfs/dbraw/zinc/38/10/25/1043381025.db2.gz LMKCFLCFFLZQDQ-UHFFFAOYSA-N 1 2 319.408 4.369 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)C[N@H+](Cc1ccco1)C(C)C ZINC000270343992 1043385034 /nfs/dbraw/zinc/38/50/34/1043385034.db2.gz VDRFMKYTNWZTMH-UHFFFAOYSA-N 1 2 320.820 4.091 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)C[N@@H+](Cc1ccco1)C(C)C ZINC000270343992 1043385045 /nfs/dbraw/zinc/38/50/45/1043385045.db2.gz VDRFMKYTNWZTMH-UHFFFAOYSA-N 1 2 320.820 4.091 20 0 DIADLO CC[N@H+](Cc1ncc(C2CC2)o1)[C@@H](C)c1cccc(OC)c1 ZINC000270533406 1043389416 /nfs/dbraw/zinc/38/94/16/1043389416.db2.gz GCKVGLCTMMOVEZ-ZDUSSCGKSA-N 1 2 300.402 4.144 20 0 DIADLO CC[N@@H+](Cc1ncc(C2CC2)o1)[C@@H](C)c1cccc(OC)c1 ZINC000270533406 1043389420 /nfs/dbraw/zinc/38/94/20/1043389420.db2.gz GCKVGLCTMMOVEZ-ZDUSSCGKSA-N 1 2 300.402 4.144 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270593977 1043390730 /nfs/dbraw/zinc/39/07/30/1043390730.db2.gz KRCBATBJKHKOOW-WBMJQRKESA-N 1 2 300.377 4.274 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270593977 1043390736 /nfs/dbraw/zinc/39/07/36/1043390736.db2.gz KRCBATBJKHKOOW-WBMJQRKESA-N 1 2 300.377 4.274 20 0 DIADLO Cc1ccc(C[C@H]([NH2+][C@H](C)c2cscn2)c2ccccn2)cc1 ZINC000271067920 1043401540 /nfs/dbraw/zinc/40/15/40/1043401540.db2.gz DKENBZFSVZAWPW-QAPCUYQASA-N 1 2 323.465 4.481 20 0 DIADLO Cc1conc1C[NH2+]C(c1ccccc1C)c1ccccc1C ZINC000871831655 1043401704 /nfs/dbraw/zinc/40/17/04/1043401704.db2.gz GHDXBAOQSMWBNV-UHFFFAOYSA-N 1 2 306.409 4.479 20 0 DIADLO Cc1ccc(C[C@@H]([NH2+][C@@H](C)c2cscn2)c2ccccn2)cc1 ZINC000271067918 1043402231 /nfs/dbraw/zinc/40/22/31/1043402231.db2.gz DKENBZFSVZAWPW-MAUKXSAKSA-N 1 2 323.465 4.481 20 0 DIADLO COc1ccc(C[NH2+][C@@H](C)c2cscn2)c(C(F)(F)F)c1 ZINC000271070020 1043402553 /nfs/dbraw/zinc/40/25/53/1043402553.db2.gz DXDOBIQGUCWIEQ-VIFPVBQESA-N 1 2 316.348 4.021 20 0 DIADLO Cc1cncc(C[N@@H+]2CCSC[C@H]2c2ccc(Cl)cc2)c1 ZINC000442681329 1043403691 /nfs/dbraw/zinc/40/36/91/1043403691.db2.gz IAHHVOKDBWSXAB-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cncc(C[N@H+]2CCSC[C@H]2c2ccc(Cl)cc2)c1 ZINC000442681329 1043403703 /nfs/dbraw/zinc/40/37/03/1043403703.db2.gz IAHHVOKDBWSXAB-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO CCC[C@H]([NH2+][C@@H](C)c1nn(CC)nc1C)c1ccc(F)cc1F ZINC000925264335 1043406481 /nfs/dbraw/zinc/40/64/81/1043406481.db2.gz MAJKARLENVOQAO-ZBEGNZNMSA-N 1 2 322.403 4.077 20 0 DIADLO CCCCOc1ccc(C[NH2+][C@H](C)c2cscn2)cc1OC ZINC000271201982 1043408074 /nfs/dbraw/zinc/40/80/74/1043408074.db2.gz ZJWFEZAMTFNCLF-CYBMUJFWSA-N 1 2 320.458 4.181 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccc(OCC2CC2)c(F)c1 ZINC000271195483 1043408122 /nfs/dbraw/zinc/40/81/22/1043408122.db2.gz YIKZOAQSVPQONO-NEPJUHHUSA-N 1 2 320.433 4.483 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1ccccc1OC1CCC1 ZINC000925437319 1043416586 /nfs/dbraw/zinc/41/65/86/1043416586.db2.gz AVGRTZUHBNJSPC-MRXNPFEDSA-N 1 2 312.413 4.082 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1cn2c(n1)CCCC2)c1cc(F)ccc1F ZINC000925454783 1043419693 /nfs/dbraw/zinc/41/96/93/1043419693.db2.gz ZOWCPODONZEWCX-MLGOLLRUSA-N 1 2 319.399 4.300 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1ccco1 ZINC000347272156 1043421124 /nfs/dbraw/zinc/42/11/24/1043421124.db2.gz QDMKGUAHOQFVSD-AWEZNQCLSA-N 1 2 305.381 4.368 20 0 DIADLO CC(C)c1nnc([C@@H](C)[NH2+][C@@H]2C[C@H](C)Sc3sccc32)[nH]1 ZINC000271481564 1043424424 /nfs/dbraw/zinc/42/44/24/1043424424.db2.gz JSIZSZVWUDLCAE-HOSYDEDBSA-N 1 2 322.503 4.266 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@H](C)c2cccc(O)c2F)on1 ZINC000872038410 1043430698 /nfs/dbraw/zinc/43/06/98/1043430698.db2.gz LMXAUAVLGLUSLV-LLVKDONJSA-N 1 2 306.381 4.274 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@H](C)c2cc(O)ccc2F)on1 ZINC000872040576 1043430928 /nfs/dbraw/zinc/43/09/28/1043430928.db2.gz ZGJRNZSFGRNBIR-LLVKDONJSA-N 1 2 306.381 4.274 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@@H](C)C1(Cl)CC1)c1ccco1 ZINC000925566703 1043431305 /nfs/dbraw/zinc/43/13/05/1043431305.db2.gz FNVKALMAJDFEFG-LRDDRELGSA-N 1 2 305.805 4.127 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@@H](C)c1nnc(C(C)C)[nH]1 ZINC000271571770 1043438745 /nfs/dbraw/zinc/43/87/45/1043438745.db2.gz VVKCFNHBJKSXOZ-JQWIXIFHSA-N 1 2 321.494 4.228 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)[nH]1 ZINC000271594961 1043441971 /nfs/dbraw/zinc/44/19/71/1043441971.db2.gz YUEQBFXNBZPELX-DTWKUNHWSA-N 1 2 313.232 4.086 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)[nH]1 ZINC000271594960 1043442206 /nfs/dbraw/zinc/44/22/06/1043442206.db2.gz YUEQBFXNBZPELX-BDAKNGLRSA-N 1 2 313.232 4.086 20 0 DIADLO CO[C@H](C)c1noc(C[NH2+][C@H](CC(C)(C)C)c2ccccc2)n1 ZINC000271639170 1043443235 /nfs/dbraw/zinc/44/32/35/1043443235.db2.gz CGRWCWMKOZXGMM-UKRRQHHQSA-N 1 2 317.433 4.044 20 0 DIADLO CO[C@@H](C)c1noc(C[NH2+][C@H](CC(C)(C)C)c2ccccc2)n1 ZINC000271639159 1043444925 /nfs/dbraw/zinc/44/49/25/1043444925.db2.gz CGRWCWMKOZXGMM-DZGCQCFKSA-N 1 2 317.433 4.044 20 0 DIADLO Cc1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCCC2)n1 ZINC000271667587 1043446677 /nfs/dbraw/zinc/44/66/77/1043446677.db2.gz FVGNBONHPPKDHD-MRXNPFEDSA-N 1 2 305.809 4.053 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nc(-c3cccs3)no2)ccc1F ZINC000271678757 1043447774 /nfs/dbraw/zinc/44/77/74/1043447774.db2.gz BALOCYLBGSVSQV-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](c2ccccc2F)C2CCCC2)s1 ZINC000271681874 1043447895 /nfs/dbraw/zinc/44/78/95/1043447895.db2.gz BTTLPHMSRRCWOP-MRXNPFEDSA-N 1 2 305.422 4.007 20 0 DIADLO CC1(C)C[NH+](Cc2csc(-c3ccccc3)n2)CC(C)(C)O1 ZINC000442883546 1043448063 /nfs/dbraw/zinc/44/80/63/1043448063.db2.gz HNYWJBNXGLSIIY-UHFFFAOYSA-N 1 2 316.470 4.200 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[NH+]1CC(C)(C)OC(C)(C)C1 ZINC000442883077 1043448959 /nfs/dbraw/zinc/44/89/59/1043448959.db2.gz CBGSPDODYOCUAA-UHFFFAOYSA-N 1 2 314.429 4.039 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1cccc(O)c1F)c1cccc(Cl)c1 ZINC000872072354 1043450631 /nfs/dbraw/zinc/45/06/31/1043450631.db2.gz CTOMWFIRBQZLJJ-ABAIWWIYSA-N 1 2 323.795 4.223 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1cccc(O)c1F ZINC000872085942 1043453622 /nfs/dbraw/zinc/45/36/22/1043453622.db2.gz QVONXHIKRBHWRU-LLVKDONJSA-N 1 2 319.351 4.062 20 0 DIADLO Cc1cc(C)c2c(c1)[C@H]([NH2+]Cc1ncc(Cl)s1)CCCO2 ZINC000872117227 1043464191 /nfs/dbraw/zinc/46/41/91/1043464191.db2.gz ZSQYUDDOWSRSPG-CYBMUJFWSA-N 1 2 322.861 4.417 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C(F)(F)F)cc(Cl)n1)c1ccco1 ZINC000872116851 1043464775 /nfs/dbraw/zinc/46/47/75/1043464775.db2.gz ORHQVYQRNHQOIB-MRVPVSSYSA-N 1 2 304.699 4.198 20 0 DIADLO Cc1noc([C@H]2CCC[N@@H+]2Cc2cc3cc(C)c(C)cc3o2)n1 ZINC000348817858 1043470382 /nfs/dbraw/zinc/47/03/82/1043470382.db2.gz QMEUYTWWBAWYOL-MRXNPFEDSA-N 1 2 311.385 4.078 20 0 DIADLO Cc1noc([C@H]2CCC[N@H+]2Cc2cc3cc(C)c(C)cc3o2)n1 ZINC000348817858 1043470388 /nfs/dbraw/zinc/47/03/88/1043470388.db2.gz QMEUYTWWBAWYOL-MRXNPFEDSA-N 1 2 311.385 4.078 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2ccc(C(F)(F)F)nc2)cs1 ZINC000872130310 1043471178 /nfs/dbraw/zinc/47/11/78/1043471178.db2.gz KQFWLQSFUZKNIY-BDAKNGLRSA-N 1 2 315.364 4.277 20 0 DIADLO C[C@@H]([NH2+]C1(c2ccc(Br)cc2)CCC1)c1ncco1 ZINC000925780461 1043471193 /nfs/dbraw/zinc/47/11/93/1043471193.db2.gz QWPLSVQXOLDNDI-LLVKDONJSA-N 1 2 321.218 4.167 20 0 DIADLO C[C@H]([NH2+]C1(c2cccc(Br)c2)CCC1)c1ncco1 ZINC000925778487 1043471524 /nfs/dbraw/zinc/47/15/24/1043471524.db2.gz DQMYCLQMIJCGAD-NSHDSACASA-N 1 2 321.218 4.167 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)nc2)cs1 ZINC000872130676 1043472621 /nfs/dbraw/zinc/47/26/21/1043472621.db2.gz KQFWLQSFUZKNIY-IUCAKERBSA-N 1 2 315.364 4.277 20 0 DIADLO FCc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3Cl)C2)cc1 ZINC000777577116 1043481996 /nfs/dbraw/zinc/48/19/96/1043481996.db2.gz BVHJUTDCZINDSY-SFHVURJKSA-N 1 2 319.807 4.383 20 0 DIADLO FCc1ccc(C[N@H+]2CCO[C@H](c3ccccc3Cl)C2)cc1 ZINC000777577116 1043482004 /nfs/dbraw/zinc/48/20/04/1043482004.db2.gz BVHJUTDCZINDSY-SFHVURJKSA-N 1 2 319.807 4.383 20 0 DIADLO C[C@@H]1CC[C@H]([NH2+]Cc2nnc(-c3ccccc3)[nH]2)c2ccccc21 ZINC000777576615 1043482408 /nfs/dbraw/zinc/48/24/08/1043482408.db2.gz XFTDJAFKKBSSSW-KDOFPFPSSA-N 1 2 318.424 4.200 20 0 DIADLO Fc1ccc(C2([NH2+][C@@H]3COCc4cccc(Cl)c43)CC2)cc1 ZINC000925848045 1043482726 /nfs/dbraw/zinc/48/27/26/1043482726.db2.gz ZAVCXKMFCCAHSJ-MRXNPFEDSA-N 1 2 317.791 4.329 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)C1(Cl)CC1 ZINC000925940876 1043497475 /nfs/dbraw/zinc/49/74/75/1043497475.db2.gz UGIGIKIEOWEOEW-ZDUSSCGKSA-N 1 2 313.832 4.174 20 0 DIADLO CC1(Cc2noc(-c3ccc(Cn4cc[nH+]c4)cc3)n2)CCCC1 ZINC000558396777 1043498698 /nfs/dbraw/zinc/49/86/98/1043498698.db2.gz PAHMHWFXMWXTRX-UHFFFAOYSA-N 1 2 322.412 4.104 20 0 DIADLO O=c1[nH]nc(Cl)cc1Nc1ccc([NH2+]CC2CCCC2)cc1 ZINC000872439130 1043500208 /nfs/dbraw/zinc/50/02/08/1043500208.db2.gz DIOOYNHWLPNRCD-UHFFFAOYSA-N 1 2 318.808 4.181 20 0 DIADLO Cc1csc([C@@H]2CCN(c3[nH+]ccc4cc(F)ccc43)C2)n1 ZINC000872737628 1043505750 /nfs/dbraw/zinc/50/57/50/1043505750.db2.gz VVKONWTVHQJDAZ-CYBMUJFWSA-N 1 2 313.401 4.133 20 0 DIADLO COc1cc(CNc2ccc([NH+](C)C)cc2)cc(Cl)c1OC ZINC000124207467 1043506782 /nfs/dbraw/zinc/50/67/82/1043506782.db2.gz FKOYFHJQWAIEFZ-UHFFFAOYSA-N 1 2 320.820 4.035 20 0 DIADLO C[C@H](Nc1[nH+]c2ccccc2n1C)c1ccc(C(F)(F)F)nc1 ZINC000872768436 1043508914 /nfs/dbraw/zinc/50/89/14/1043508914.db2.gz RMFRPBMZBGHXFG-JTQLQIEISA-N 1 2 320.318 4.160 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1cccc(Br)n1 ZINC000926024585 1043511713 /nfs/dbraw/zinc/51/17/13/1043511713.db2.gz ABMOYADMXWMJDE-LLVKDONJSA-N 1 2 320.234 4.083 20 0 DIADLO CC(C)(C)Oc1cccc(C[NH2+]Cc2ncc(Cl)s2)c1 ZINC000873163940 1043520615 /nfs/dbraw/zinc/52/06/15/1043520615.db2.gz WJLTYZOEPIVFKH-UHFFFAOYSA-N 1 2 310.850 4.264 20 0 DIADLO CC1(C)CCc2onc(C[NH2+]Cc3cnc4ccccc4c3)c2C1 ZINC000873174903 1043521496 /nfs/dbraw/zinc/52/14/96/1043521496.db2.gz AQFDPMLAFBWDRH-UHFFFAOYSA-N 1 2 321.424 4.028 20 0 DIADLO Cc1cc2cc(C[NH2+]Cc3ncc(Cl)s3)oc2cc1C ZINC000873165024 1043522173 /nfs/dbraw/zinc/52/21/73/1043522173.db2.gz HARSJOSYROXGRX-UHFFFAOYSA-N 1 2 306.818 4.449 20 0 DIADLO C[C@H]1C[C@H](C(C)(C)C)CCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000558505605 1043525732 /nfs/dbraw/zinc/52/57/32/1043525732.db2.gz LCJOMIHEYGGWJO-UONOGXRCSA-N 1 2 314.433 4.013 20 0 DIADLO CC(C)[N@@H+](Cc1csc(-c2ccco2)n1)Cc1ccco1 ZINC000349841403 1043529595 /nfs/dbraw/zinc/52/95/95/1043529595.db2.gz VQOOXQQVEAEGJE-UHFFFAOYSA-N 1 2 302.399 4.407 20 0 DIADLO CC(C)[N@H+](Cc1csc(-c2ccco2)n1)Cc1ccco1 ZINC000349841403 1043529605 /nfs/dbraw/zinc/52/96/05/1043529605.db2.gz VQOOXQQVEAEGJE-UHFFFAOYSA-N 1 2 302.399 4.407 20 0 DIADLO CC[N@H+](Cc1ccc(N2CCCC2)o1)Cc1cccc(F)c1F ZINC001137070246 1043532415 /nfs/dbraw/zinc/53/24/15/1043532415.db2.gz HBEDEUYMRJIUJH-UHFFFAOYSA-N 1 2 320.383 4.180 20 0 DIADLO CC[N@@H+](Cc1ccc(N2CCCC2)o1)Cc1cccc(F)c1F ZINC001137070246 1043532431 /nfs/dbraw/zinc/53/24/31/1043532431.db2.gz HBEDEUYMRJIUJH-UHFFFAOYSA-N 1 2 320.383 4.180 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@H](c1ccc(Cl)cc1F)C(C)C ZINC000926126976 1043532763 /nfs/dbraw/zinc/53/27/63/1043532763.db2.gz GCMYSUSLPDBDPA-XPTSAGLGSA-N 1 2 311.788 4.218 20 0 DIADLO Cc1ccc(Oc2ccc(NC(=O)CCc3[nH]cc[nH+]3)cc2)cc1 ZINC000350065234 1043537126 /nfs/dbraw/zinc/53/71/26/1043537126.db2.gz IMRPBEQMEOGIET-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO CCCOc1cccc2c(NCCc3cccnc3)cc[nH+]c12 ZINC000350244986 1043541296 /nfs/dbraw/zinc/54/12/96/1043541296.db2.gz IELNFVDHJVGXFC-UHFFFAOYSA-N 1 2 307.397 4.073 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2ncc(CSC)s2)cc1 ZINC000350221701 1043542139 /nfs/dbraw/zinc/54/21/39/1043542139.db2.gz PCGFWRATKBSCDW-UHFFFAOYSA-N 1 2 306.500 4.201 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2ncc(CSC)s2)cc1 ZINC000350221701 1043542153 /nfs/dbraw/zinc/54/21/53/1043542153.db2.gz PCGFWRATKBSCDW-UHFFFAOYSA-N 1 2 306.500 4.201 20 0 DIADLO CC(C)(C)OC(=O)Nc1ccsc1C[N@@H+]1CCC[C@@H](F)C1 ZINC000895190852 1043555730 /nfs/dbraw/zinc/55/57/30/1043555730.db2.gz DCNHNGBSSZBWRM-LLVKDONJSA-N 1 2 314.426 4.029 20 0 DIADLO CC(C)(C)OC(=O)Nc1ccsc1C[N@H+]1CCC[C@@H](F)C1 ZINC000895190852 1043555736 /nfs/dbraw/zinc/55/57/36/1043555736.db2.gz DCNHNGBSSZBWRM-LLVKDONJSA-N 1 2 314.426 4.029 20 0 DIADLO CC(C)c1nsc(C[N@H+](Cc2ccccc2)C(C)(C)C)n1 ZINC001168018411 1043560091 /nfs/dbraw/zinc/56/00/91/1043560091.db2.gz OEXUCGOYFWIBPR-UHFFFAOYSA-N 1 2 303.475 4.462 20 0 DIADLO CC(C)c1nsc(C[N@@H+](Cc2ccccc2)C(C)(C)C)n1 ZINC001168018411 1043560096 /nfs/dbraw/zinc/56/00/96/1043560096.db2.gz OEXUCGOYFWIBPR-UHFFFAOYSA-N 1 2 303.475 4.462 20 0 DIADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1cn(C)cn1 ZINC000926299699 1043560079 /nfs/dbraw/zinc/56/00/79/1043560079.db2.gz ZWSXABWCYVRAHR-TZMCWYRMSA-N 1 2 311.351 4.073 20 0 DIADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1cn(C)cn1 ZINC000926299690 1043560131 /nfs/dbraw/zinc/56/01/31/1043560131.db2.gz ZWSXABWCYVRAHR-GXTWGEPZSA-N 1 2 311.351 4.073 20 0 DIADLO Fc1cc(F)c(C[NH2+][C@@H](c2ccccn2)C2CCC2)c(F)c1F ZINC000926321005 1043562702 /nfs/dbraw/zinc/56/27/02/1043562702.db2.gz LCGMYWBFQJDQAN-QGZVFWFLSA-N 1 2 324.321 4.269 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1ccsc1Br ZINC000388959091 1043574990 /nfs/dbraw/zinc/57/49/90/1043574990.db2.gz GCYSOLZIUAHSRY-UHFFFAOYSA-N 1 2 302.262 4.204 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1ccsc1Br ZINC000388959091 1043575003 /nfs/dbraw/zinc/57/50/03/1043575003.db2.gz GCYSOLZIUAHSRY-UHFFFAOYSA-N 1 2 302.262 4.204 20 0 DIADLO COc1ccc([C@@H](Cc2ccccc2)[NH2+][C@H](C)c2ncco2)cc1 ZINC000926448779 1043580668 /nfs/dbraw/zinc/58/06/68/1043580668.db2.gz BLVFSTBYDCAKHJ-DNVCBOLYSA-N 1 2 322.408 4.318 20 0 DIADLO CCc1noc(C)c1C[NH2+][C@@H](c1ccc(C)cc1)c1cccnc1 ZINC000926483517 1043584559 /nfs/dbraw/zinc/58/45/59/1043584559.db2.gz WJNIHNRMBOPFIX-FQEVSTJZSA-N 1 2 321.424 4.128 20 0 DIADLO COCc1nc(C[N@H+](Cc2ccc(F)cc2)C(C)(C)C)cs1 ZINC000353143085 1043588252 /nfs/dbraw/zinc/58/82/52/1043588252.db2.gz SPPYONPHBYFDSX-UHFFFAOYSA-N 1 2 322.449 4.229 20 0 DIADLO COCc1nc(C[N@@H+](Cc2ccc(F)cc2)C(C)(C)C)cs1 ZINC000353143085 1043588264 /nfs/dbraw/zinc/58/82/64/1043588264.db2.gz SPPYONPHBYFDSX-UHFFFAOYSA-N 1 2 322.449 4.229 20 0 DIADLO CCc1cc(C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)on1 ZINC000558761880 1043592920 /nfs/dbraw/zinc/59/29/20/1043592920.db2.gz QCCAOKIPDNOXMU-UHFFFAOYSA-N 1 2 318.323 4.065 20 0 DIADLO Cc1cc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)c(C)s1 ZINC000353284658 1043597293 /nfs/dbraw/zinc/59/72/93/1043597293.db2.gz VTSUKVFKALAZHD-UHFFFAOYSA-N 1 2 311.454 4.290 20 0 DIADLO Cc1cc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)c(C)s1 ZINC000353284658 1043597302 /nfs/dbraw/zinc/59/73/02/1043597302.db2.gz VTSUKVFKALAZHD-UHFFFAOYSA-N 1 2 311.454 4.290 20 0 DIADLO c1cc(C[N@H+](Cc2coc3ccccc23)Cc2ccccc2)n[nH]1 ZINC000353334610 1043599969 /nfs/dbraw/zinc/59/99/69/1043599969.db2.gz SQVQZDXZDGADAZ-UHFFFAOYSA-N 1 2 317.392 4.358 20 0 DIADLO c1cc(C[N@@H+](Cc2coc3ccccc23)Cc2ccccc2)n[nH]1 ZINC000353334610 1043599973 /nfs/dbraw/zinc/59/99/73/1043599973.db2.gz SQVQZDXZDGADAZ-UHFFFAOYSA-N 1 2 317.392 4.358 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@@H]1CCCC[C@H]1F)c1ccccn1 ZINC000926587548 1043603863 /nfs/dbraw/zinc/60/38/63/1043603863.db2.gz NCNIPHPISQTKIM-MDZRGWNJSA-N 1 2 314.404 4.050 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC=C(c3ccccc3)C2)s1 ZINC000353388758 1043604018 /nfs/dbraw/zinc/60/40/18/1043604018.db2.gz OMKZGIOQOUUKAD-UHFFFAOYSA-N 1 2 316.495 4.295 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC=C(c3ccccc3)C2)s1 ZINC000353388758 1043604029 /nfs/dbraw/zinc/60/40/29/1043604029.db2.gz OMKZGIOQOUUKAD-UHFFFAOYSA-N 1 2 316.495 4.295 20 0 DIADLO C[C@H](NC1(c2ccccc2Cl)CC1)c1cn2c([nH+]1)CCCC2 ZINC000926627982 1043609440 /nfs/dbraw/zinc/60/94/40/1043609440.db2.gz PDXPEGHARMCLIO-ZDUSSCGKSA-N 1 2 315.848 4.213 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1cc(-c2cccs2)on1 ZINC000353550334 1043616399 /nfs/dbraw/zinc/61/63/99/1043616399.db2.gz NWSPNTZCIVGRJV-UHFFFAOYSA-N 1 2 317.414 4.033 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1ncc(-c3ccc(F)cc3)o1)C2 ZINC000558851932 1043618229 /nfs/dbraw/zinc/61/82/29/1043618229.db2.gz UXTMLHBBDFUVDI-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1ncc(-c3ccc(F)cc3)o1)C2 ZINC000558851932 1043618237 /nfs/dbraw/zinc/61/82/37/1043618237.db2.gz UXTMLHBBDFUVDI-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Clc1cccc2c1CC[C@@H]2[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000443620188 1043622553 /nfs/dbraw/zinc/62/25/53/1043622553.db2.gz JFXSKKYCIGMUOR-DLBZAZTESA-N 1 2 319.857 4.462 20 0 DIADLO Clc1cccc2c1CC[C@@H]2[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000443620188 1043622559 /nfs/dbraw/zinc/62/25/59/1043622559.db2.gz JFXSKKYCIGMUOR-DLBZAZTESA-N 1 2 319.857 4.462 20 0 DIADLO COCc1nc(C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)cs1 ZINC000353626035 1043625714 /nfs/dbraw/zinc/62/57/14/1043625714.db2.gz SYQGJVNBXREANM-GFCCVEGCSA-N 1 2 316.426 4.195 20 0 DIADLO COCc1nc(C[NH2+]C2c3ccccc3-c3ccccc32)cs1 ZINC000353654033 1043629411 /nfs/dbraw/zinc/62/94/11/1043629411.db2.gz ZKHRGTSGVFQADM-UHFFFAOYSA-N 1 2 322.433 4.149 20 0 DIADLO COc1ccnc([C@@H](C)[NH2+]C2(c3c(F)cccc3F)CCC2)c1 ZINC000926775133 1043630758 /nfs/dbraw/zinc/63/07/58/1043630758.db2.gz UAVRNMOGILKURH-GFCCVEGCSA-N 1 2 318.367 4.098 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1cnc(C3CCC3)s1)CC2 ZINC000353678150 1043632047 /nfs/dbraw/zinc/63/20/47/1043632047.db2.gz ZVMOXVZMFDQVJD-UHFFFAOYSA-N 1 2 302.418 4.108 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1cnc(C3CCC3)s1)CC2 ZINC000353678150 1043632053 /nfs/dbraw/zinc/63/20/53/1043632053.db2.gz ZVMOXVZMFDQVJD-UHFFFAOYSA-N 1 2 302.418 4.108 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@@H](c3ccccc3)OCC2(C)C)c(C)s1 ZINC000443635672 1043633741 /nfs/dbraw/zinc/63/37/41/1043633741.db2.gz ZKNOACSNOHPGBW-KRWDZBQOSA-N 1 2 316.470 4.112 20 0 DIADLO Cc1nc(C[N@H+]2C[C@@H](c3ccccc3)OCC2(C)C)c(C)s1 ZINC000443635672 1043633747 /nfs/dbraw/zinc/63/37/47/1043633747.db2.gz ZKNOACSNOHPGBW-KRWDZBQOSA-N 1 2 316.470 4.112 20 0 DIADLO C[C@@H]([NH2+]Cc1c(Cl)cccc1OC(F)F)c1ccns1 ZINC000926801871 1043636245 /nfs/dbraw/zinc/63/62/45/1043636245.db2.gz PDKOBWRLSIBLQG-MRVPVSSYSA-N 1 2 318.776 4.249 20 0 DIADLO Cc1nc(N[C@@H](C)CC(C)(C)C)c(Br)c(C)[nH+]1 ZINC000322756799 1043642467 /nfs/dbraw/zinc/64/24/67/1043642467.db2.gz BNQACEKBQGHDQD-QMMMGPOBSA-N 1 2 300.244 4.093 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@H]1CCc2c1nccc2Cl ZINC000926859784 1043644731 /nfs/dbraw/zinc/64/47/31/1043644731.db2.gz CTKJNWTZCILVGU-IKGGRYGDSA-N 1 2 316.807 4.338 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1cc(-c2ccccc2)no1 ZINC000926868981 1043646480 /nfs/dbraw/zinc/64/64/80/1043646480.db2.gz NUZSIMTYOVGKSW-GFCCVEGCSA-N 1 2 309.369 4.058 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nc2c(s1)CCC2)c1ncccc1Cl ZINC000926882425 1043647971 /nfs/dbraw/zinc/64/79/71/1043647971.db2.gz RWDNLWNBEVVSEN-CYBMUJFWSA-N 1 2 321.877 4.311 20 0 DIADLO Cc1nnc(C[N@@H+](C)Cc2ccccc2-c2ccc(C)cc2C)o1 ZINC000895352461 1043651061 /nfs/dbraw/zinc/65/10/61/1043651061.db2.gz LUXHENBQDNQWKY-UHFFFAOYSA-N 1 2 321.424 4.294 20 0 DIADLO Cc1nnc(C[N@H+](C)Cc2ccccc2-c2ccc(C)cc2C)o1 ZINC000895352461 1043651069 /nfs/dbraw/zinc/65/10/69/1043651069.db2.gz LUXHENBQDNQWKY-UHFFFAOYSA-N 1 2 321.424 4.294 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F)c1cnccn1 ZINC000926903417 1043651618 /nfs/dbraw/zinc/65/16/18/1043651618.db2.gz VHCHXVBGRZBMIY-DTWKUNHWSA-N 1 2 314.191 4.334 20 0 DIADLO COCc1nc(C[N@@H+]2CC[C@H](C)C[C@H]2c2ccc(C)o2)cs1 ZINC000353934319 1043662533 /nfs/dbraw/zinc/66/25/33/1043662533.db2.gz PQYRZCDSDKEADA-WFASDCNBSA-N 1 2 320.458 4.164 20 0 DIADLO COCc1nc(C[N@H+]2CC[C@H](C)C[C@H]2c2ccc(C)o2)cs1 ZINC000353934319 1043662540 /nfs/dbraw/zinc/66/25/40/1043662540.db2.gz PQYRZCDSDKEADA-WFASDCNBSA-N 1 2 320.458 4.164 20 0 DIADLO CCCCc1noc(C[N@H+](Cc2ccc(F)cc2)C(C)(C)C)n1 ZINC000474156086 1043671023 /nfs/dbraw/zinc/67/10/23/1043671023.db2.gz YDWQVDOHUCGCOB-UHFFFAOYSA-N 1 2 319.424 4.352 20 0 DIADLO CCCCc1noc(C[N@@H+](Cc2ccc(F)cc2)C(C)(C)C)n1 ZINC000474156086 1043671031 /nfs/dbraw/zinc/67/10/31/1043671031.db2.gz YDWQVDOHUCGCOB-UHFFFAOYSA-N 1 2 319.424 4.352 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@@H]2CCCc3cccnc32)cs1 ZINC000927060965 1043676129 /nfs/dbraw/zinc/67/61/29/1043676129.db2.gz HTBQKMRDXLBFPY-GXTWGEPZSA-N 1 2 301.459 4.390 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1Nc1nc(C)[nH+]c(C)c1Br ZINC000322762551 1043679846 /nfs/dbraw/zinc/67/98/46/1043679846.db2.gz CQSRVTDRYATBAL-NEPJUHHUSA-N 1 2 312.255 4.237 20 0 DIADLO CC[C@H]1CCCC[C@H]1Nc1nc(C)[nH+]c(C)c1Br ZINC000322762552 1043680017 /nfs/dbraw/zinc/68/00/17/1043680017.db2.gz CQSRVTDRYATBAL-NWDGAFQWSA-N 1 2 312.255 4.237 20 0 DIADLO Fc1ccc2oc(C[N@@H+]3CCOC[C@@H]3c3ccccc3)cc2c1 ZINC000354108672 1043681638 /nfs/dbraw/zinc/68/16/38/1043681638.db2.gz GJJXNCDDHOENGJ-GOSISDBHSA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccc2oc(C[N@H+]3CCOC[C@@H]3c3ccccc3)cc2c1 ZINC000354108672 1043681645 /nfs/dbraw/zinc/68/16/45/1043681645.db2.gz GJJXNCDDHOENGJ-GOSISDBHSA-N 1 2 311.356 4.145 20 0 DIADLO CC[C@@H](C)CCCCC(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927083373 1043683198 /nfs/dbraw/zinc/68/31/98/1043683198.db2.gz FPAKISNIVFMNCJ-MRXNPFEDSA-N 1 2 317.477 4.091 20 0 DIADLO CCCC[C@H](CC)CC(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927092361 1043683830 /nfs/dbraw/zinc/68/38/30/1043683830.db2.gz VWBMHLBICUOESN-INIZCTEOSA-N 1 2 317.477 4.091 20 0 DIADLO CCCCCC[C@@H](C)C(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927089255 1043684253 /nfs/dbraw/zinc/68/42/53/1043684253.db2.gz KIJGEHAVAVECCN-MRXNPFEDSA-N 1 2 317.477 4.091 20 0 DIADLO Cc1ccc(-n2cc[nH+]c2)c(C(=O)Nc2cccc(C)c2C)c1 ZINC000114111521 1043684325 /nfs/dbraw/zinc/68/43/25/1043684325.db2.gz KKNAJDOCAXYVHW-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1ccc(-c2ccccc2)o1 ZINC000927111410 1043688856 /nfs/dbraw/zinc/68/88/56/1043688856.db2.gz BUFZZBAZYSIYRC-AWEZNQCLSA-N 1 2 321.424 4.408 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1cccc(Cl)c1Cl ZINC000927111981 1043689582 /nfs/dbraw/zinc/68/95/82/1043689582.db2.gz CPMFLYYGLUJLEO-SNVBAGLBSA-N 1 2 324.255 4.455 20 0 DIADLO CC[C@H](C)CCC(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000354324301 1043693570 /nfs/dbraw/zinc/69/35/70/1043693570.db2.gz MJGMKPLHWYVELU-HNNXBMFYSA-N 1 2 323.440 4.367 20 0 DIADLO Cc1csc(C[N@@H+]2CCc3cc(-c4ccccc4)oc3C2)n1 ZINC000354304598 1043694425 /nfs/dbraw/zinc/69/44/25/1043694425.db2.gz OKCKLAWBDXQLNO-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1csc(C[N@H+]2CCc3cc(-c4ccccc4)oc3C2)n1 ZINC000354304598 1043694435 /nfs/dbraw/zinc/69/44/35/1043694435.db2.gz OKCKLAWBDXQLNO-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2ccc(Cl)nn2)C2CC2)o1 ZINC000876570204 1043696065 /nfs/dbraw/zinc/69/60/65/1043696065.db2.gz WMAHIWFAIOFOQR-XHDPSFHLSA-N 1 2 317.820 4.011 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2ccc(Cl)nn2)C2CC2)o1 ZINC000876570204 1043696082 /nfs/dbraw/zinc/69/60/82/1043696082.db2.gz WMAHIWFAIOFOQR-XHDPSFHLSA-N 1 2 317.820 4.011 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)cc2c1OCC2)c1nccs1 ZINC000927139095 1043696678 /nfs/dbraw/zinc/69/66/78/1043696678.db2.gz GATYUDDCGZWQJM-VHSXEESVSA-N 1 2 308.834 4.143 20 0 DIADLO Fc1ccc(-c2noc([C@H]3CCC[C@@H](c4ccccc4)[NH2+]3)n2)cc1 ZINC001211884381 1043702100 /nfs/dbraw/zinc/70/21/00/1043702100.db2.gz FWJOTUKPIAFSCP-DLBZAZTESA-N 1 2 323.371 4.432 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[N@H+](C)Cc1ccc(Cl)nn1 ZINC000876790132 1043709798 /nfs/dbraw/zinc/70/97/98/1043709798.db2.gz UDZZZASFFMEBJF-LLVKDONJSA-N 1 2 324.881 4.211 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)Cc1ccc(Cl)nn1 ZINC000876790132 1043709810 /nfs/dbraw/zinc/70/98/10/1043709810.db2.gz UDZZZASFFMEBJF-LLVKDONJSA-N 1 2 324.881 4.211 20 0 DIADLO CCc1cccc(F)c1C[N@H+](C)Cc1c(C)nc2sccn12 ZINC000474269002 1043720004 /nfs/dbraw/zinc/72/00/04/1043720004.db2.gz YOYGSRZHNQEUQH-UHFFFAOYSA-N 1 2 317.433 4.038 20 0 DIADLO CCc1cccc(F)c1C[N@@H+](C)Cc1c(C)nc2sccn12 ZINC000474269002 1043720010 /nfs/dbraw/zinc/72/00/10/1043720010.db2.gz YOYGSRZHNQEUQH-UHFFFAOYSA-N 1 2 317.433 4.038 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)[C@@H](C)c3ccncc3)co2)cc1 ZINC000354800441 1043722342 /nfs/dbraw/zinc/72/23/42/1043722342.db2.gz XXMSKXFSFQELSD-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)[C@@H](C)c3ccncc3)co2)cc1 ZINC000354800441 1043722351 /nfs/dbraw/zinc/72/23/51/1043722351.db2.gz XXMSKXFSFQELSD-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(Cl)cs1)c1ccccc1OC(F)F ZINC000876909000 1043723524 /nfs/dbraw/zinc/72/35/24/1043723524.db2.gz SSNUXHIJNOFTQH-MRVPVSSYSA-N 1 2 318.776 4.249 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1nc(Cl)cs1 ZINC000876937576 1043726902 /nfs/dbraw/zinc/72/69/02/1043726902.db2.gz YQRFYENGHNUVEH-LLVKDONJSA-N 1 2 310.850 4.435 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H]2C[C@@H](C)Sc3sccc32)s1 ZINC000354961855 1043730748 /nfs/dbraw/zinc/73/07/48/1043730748.db2.gz DCKVWYGELASDKH-FYBVGQRMSA-N 1 2 311.501 4.184 20 0 DIADLO CCCc1nc(C)c(NCc2cc(-n3cc[nH+]c3)cs2)s1 ZINC000354926839 1043731640 /nfs/dbraw/zinc/73/16/40/1043731640.db2.gz HMJXVBZTRYEFPH-UHFFFAOYSA-N 1 2 318.471 4.263 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2ccc(C(C)C)cc2C(C)C)n1 ZINC000680415905 1043739301 /nfs/dbraw/zinc/73/93/01/1043739301.db2.gz QNQZYFKNVCHKQH-ZDUSSCGKSA-N 1 2 301.434 4.476 20 0 DIADLO Fc1cc(Cl)cc(Br)c1C[N@@H+]1CCC2(CC2)C1 ZINC001141837871 1043743674 /nfs/dbraw/zinc/74/36/74/1043743674.db2.gz SYUUQIFQFIVIHA-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO Fc1cc(Cl)cc(Br)c1C[N@H+]1CCC2(CC2)C1 ZINC001141837871 1043743680 /nfs/dbraw/zinc/74/36/80/1043743680.db2.gz SYUUQIFQFIVIHA-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO COc1cccc(C=C2CC[NH+](Cc3nc(C)cs3)CC2)c1 ZINC000355159367 1043747067 /nfs/dbraw/zinc/74/70/67/1043747067.db2.gz DBICRJGGZPCOSS-UHFFFAOYSA-N 1 2 314.454 4.140 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](C)Cc2cc(C)ccc2C)cs1 ZINC000355141263 1043747441 /nfs/dbraw/zinc/74/74/41/1043747441.db2.gz XHBHJEKPTUVAHP-AWEZNQCLSA-N 1 2 304.459 4.099 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](C)Cc2cc(C)ccc2C)cs1 ZINC000355141263 1043747449 /nfs/dbraw/zinc/74/74/49/1043747449.db2.gz XHBHJEKPTUVAHP-AWEZNQCLSA-N 1 2 304.459 4.099 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)[NH2+]c1ccc2c(c1)CCCN2C ZINC000877160256 1043751926 /nfs/dbraw/zinc/75/19/26/1043751926.db2.gz UKRRYIDFFCDEMX-FPTDNZKUSA-N 1 2 324.405 4.204 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)Nc1ccc2c(c1)CCC[N@H+]2C ZINC000877160256 1043751931 /nfs/dbraw/zinc/75/19/31/1043751931.db2.gz UKRRYIDFFCDEMX-FPTDNZKUSA-N 1 2 324.405 4.204 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)Nc1ccc2c(c1)CCC[N@@H+]2C ZINC000877160256 1043751940 /nfs/dbraw/zinc/75/19/40/1043751940.db2.gz UKRRYIDFFCDEMX-FPTDNZKUSA-N 1 2 324.405 4.204 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)Nc1c[nH+]c2c(c1)CCCC2 ZINC000877194840 1043753340 /nfs/dbraw/zinc/75/33/40/1043753340.db2.gz CYJYBFWLEVZWNK-ASSNKEHSSA-N 1 2 310.378 4.095 20 0 DIADLO Cc1nc(C)c(C[N@@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)s1 ZINC000355277584 1043758570 /nfs/dbraw/zinc/75/85/70/1043758570.db2.gz WHTQIWRUEDUXMF-JTQLQIEISA-N 1 2 308.397 4.157 20 0 DIADLO Cc1nc(C)c(C[N@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)s1 ZINC000355277584 1043758575 /nfs/dbraw/zinc/75/85/75/1043758575.db2.gz WHTQIWRUEDUXMF-JTQLQIEISA-N 1 2 308.397 4.157 20 0 DIADLO Fc1cc(Cl)cc(Br)c1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC001141844049 1043759616 /nfs/dbraw/zinc/75/96/16/1043759616.db2.gz IBNGFVWPGWEEJK-WCBMZHEXSA-N 1 2 318.617 4.226 20 0 DIADLO Fc1cc(Cl)cc(Br)c1C[N@H+]1C[C@H]2CC[C@@H]1C2 ZINC001141844049 1043759627 /nfs/dbraw/zinc/75/96/27/1043759627.db2.gz IBNGFVWPGWEEJK-WCBMZHEXSA-N 1 2 318.617 4.226 20 0 DIADLO CC(C)Cc1ccc(C[NH2+][C@H](CF)c2ccc(F)cc2)cn1 ZINC000895853971 1043766261 /nfs/dbraw/zinc/76/62/61/1043766261.db2.gz RVHNWPPXGXPAKW-GOSISDBHSA-N 1 2 304.384 4.220 20 0 DIADLO C[N@H+](Cc1c(F)c(F)cc(F)c1F)[C@H]1CCc2ccccc21 ZINC001138238464 1043767152 /nfs/dbraw/zinc/76/71/52/1043767152.db2.gz VLXJIDUJBVWZJR-HNNXBMFYSA-N 1 2 309.306 4.362 20 0 DIADLO C[N@@H+](Cc1c(F)c(F)cc(F)c1F)[C@H]1CCc2ccccc21 ZINC001138238464 1043767160 /nfs/dbraw/zinc/76/71/60/1043767160.db2.gz VLXJIDUJBVWZJR-HNNXBMFYSA-N 1 2 309.306 4.362 20 0 DIADLO C[N@H+](Cc1cccc(Cl)c1Br)C1CC(F)(F)C1 ZINC001137618184 1043770052 /nfs/dbraw/zinc/77/00/52/1043770052.db2.gz GPLZXZBPONKLTM-UHFFFAOYSA-N 1 2 324.596 4.332 20 0 DIADLO C[N@@H+](Cc1cccc(Cl)c1Br)C1CC(F)(F)C1 ZINC001137618184 1043770063 /nfs/dbraw/zinc/77/00/63/1043770063.db2.gz GPLZXZBPONKLTM-UHFFFAOYSA-N 1 2 324.596 4.332 20 0 DIADLO CC1(C)C[N@H+](Cc2cc3c(cc[nH]c3=O)o2)[C@@H]1c1cccs1 ZINC000877534263 1043772778 /nfs/dbraw/zinc/77/27/78/1043772778.db2.gz CWCMINCOEDNACV-OAHLLOKOSA-N 1 2 314.410 4.178 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc3c(cc[nH]c3=O)o2)[C@@H]1c1cccs1 ZINC000877534263 1043772790 /nfs/dbraw/zinc/77/27/90/1043772790.db2.gz CWCMINCOEDNACV-OAHLLOKOSA-N 1 2 314.410 4.178 20 0 DIADLO Clc1ccc(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)o1 ZINC000355550544 1043774001 /nfs/dbraw/zinc/77/40/01/1043774001.db2.gz BATJDPPTRRHQPR-UHFFFAOYSA-N 1 2 308.168 4.384 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](Cc2ccccc2C)C2CC2)cs1 ZINC000355551321 1043775274 /nfs/dbraw/zinc/77/52/74/1043775274.db2.gz HPQQLCIVUIUZGO-AWEZNQCLSA-N 1 2 316.470 4.324 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](Cc2ccccc2C)C2CC2)cs1 ZINC000355551321 1043775281 /nfs/dbraw/zinc/77/52/81/1043775281.db2.gz HPQQLCIVUIUZGO-AWEZNQCLSA-N 1 2 316.470 4.324 20 0 DIADLO Cc1ccncc1C[N@H+](C)Cc1ccc(Oc2ccccc2)o1 ZINC000355595407 1043779245 /nfs/dbraw/zinc/77/92/45/1043779245.db2.gz HCMWANAVNBYSEE-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO Cc1ccncc1C[N@@H+](C)Cc1ccc(Oc2ccccc2)o1 ZINC000355595407 1043779255 /nfs/dbraw/zinc/77/92/55/1043779255.db2.gz HCMWANAVNBYSEE-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO C[N@H+](Cc1nccn1C(F)F)[C@@H]1CCc2cc(Cl)ccc21 ZINC000777717400 1043781006 /nfs/dbraw/zinc/78/10/06/1043781006.db2.gz MXWUWNCKUYEEQJ-CYBMUJFWSA-N 1 2 311.763 4.051 20 0 DIADLO C[N@@H+](Cc1nccn1C(F)F)[C@@H]1CCc2cc(Cl)ccc21 ZINC000777717400 1043781014 /nfs/dbraw/zinc/78/10/14/1043781014.db2.gz MXWUWNCKUYEEQJ-CYBMUJFWSA-N 1 2 311.763 4.051 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CCC[C@H]2c2ccc(C)cc2)cs1 ZINC000355666761 1043784107 /nfs/dbraw/zinc/78/41/07/1043784107.db2.gz XOYGJGVJDCAUJW-PBHICJAKSA-N 1 2 316.470 4.496 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CCC[C@H]2c2ccc(C)cc2)cs1 ZINC000355666761 1043784118 /nfs/dbraw/zinc/78/41/18/1043784118.db2.gz XOYGJGVJDCAUJW-PBHICJAKSA-N 1 2 316.470 4.496 20 0 DIADLO CCCc1ccc([C@@H]([NH2+]Cc2nc(C3CC3)no2)C(C)C)cc1 ZINC000097131343 1043784971 /nfs/dbraw/zinc/78/49/71/1043784971.db2.gz BAHDJXOSLDCANS-SFHVURJKSA-N 1 2 313.445 4.386 20 0 DIADLO CCCc1ccc([C@H]([NH2+]Cc2nc(C3CC3)no2)C(C)C)cc1 ZINC000097131341 1043785933 /nfs/dbraw/zinc/78/59/33/1043785933.db2.gz BAHDJXOSLDCANS-GOSISDBHSA-N 1 2 313.445 4.386 20 0 DIADLO Cc1ncc(C[NH2+]C(C)(C)c2nc3cc(Cl)ccc3o2)s1 ZINC000877668639 1043788005 /nfs/dbraw/zinc/78/80/05/1043788005.db2.gz LUBPMXKFGVPNCV-UHFFFAOYSA-N 1 2 321.833 4.271 20 0 DIADLO CCc1cnc(C[N@H+](C)CCSc2ccc(F)cc2)s1 ZINC000355751656 1043788074 /nfs/dbraw/zinc/78/80/74/1043788074.db2.gz WHKMABOHHXGVGS-UHFFFAOYSA-N 1 2 310.463 4.069 20 0 DIADLO CCc1cnc(C[N@@H+](C)CCSc2ccc(F)cc2)s1 ZINC000355751656 1043788086 /nfs/dbraw/zinc/78/80/86/1043788086.db2.gz WHKMABOHHXGVGS-UHFFFAOYSA-N 1 2 310.463 4.069 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[NH2+]Cc1cnc(C2CC2)o1 ZINC000877735129 1043791681 /nfs/dbraw/zinc/79/16/81/1043791681.db2.gz OAHDISZRJLELMS-UHFFFAOYSA-N 1 2 315.175 4.288 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)[C@@H](C)c1snnc1C ZINC000929131615 1043794174 /nfs/dbraw/zinc/79/41/74/1043794174.db2.gz YOPZUDMOIKVPMV-VIFPVBQESA-N 1 2 301.868 4.145 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)[C@@H](C)c1snnc1C ZINC000929131615 1043794185 /nfs/dbraw/zinc/79/41/85/1043794185.db2.gz YOPZUDMOIKVPMV-VIFPVBQESA-N 1 2 301.868 4.145 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](c2ccc(CC)cc2)C(C)C)no1 ZINC000097258830 1043798990 /nfs/dbraw/zinc/79/89/90/1043798990.db2.gz NVQAZCKMAZJKTM-GOSISDBHSA-N 1 2 301.434 4.071 20 0 DIADLO CCSc1ccc(C[NH2+]Cc2nnc(C(C)C)s2)cc1 ZINC000895995135 1043804399 /nfs/dbraw/zinc/80/43/99/1043804399.db2.gz PPNMDPJLXGBWLJ-UHFFFAOYSA-N 1 2 307.488 4.063 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2cscc2C(F)(F)F)s1 ZINC000356061031 1043805508 /nfs/dbraw/zinc/80/55/08/1043805508.db2.gz IVSGTGKXXNRCPV-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2cscc2C(F)(F)F)s1 ZINC000356061031 1043805524 /nfs/dbraw/zinc/80/55/24/1043805524.db2.gz IVSGTGKXXNRCPV-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO Cc1cc(C)c2cc(NCc3nnc(C(C)C)s3)ccc2[nH+]1 ZINC000896064384 1043818656 /nfs/dbraw/zinc/81/86/56/1043818656.db2.gz MOYQOTDTGVKBPU-UHFFFAOYSA-N 1 2 312.442 4.439 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2nc3c(o2)CCCC3)cc1 ZINC000877914542 1043823247 /nfs/dbraw/zinc/82/32/47/1043823247.db2.gz AXAXETMKOMFQEC-MRXNPFEDSA-N 1 2 300.377 4.030 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2nc3c(o2)CCCC3)cc1 ZINC000877914542 1043823261 /nfs/dbraw/zinc/82/32/61/1043823261.db2.gz AXAXETMKOMFQEC-MRXNPFEDSA-N 1 2 300.377 4.030 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H](C)c2ncc(C)o2)ccc1OC(C)C ZINC000356270540 1043827057 /nfs/dbraw/zinc/82/70/57/1043827057.db2.gz GAWICGLTNSJWLM-ZIAGYGMSSA-N 1 2 318.417 4.191 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@@H]2c2cccnc2)cc(C(F)(F)F)c1 ZINC000356294825 1043829607 /nfs/dbraw/zinc/82/96/07/1043829607.db2.gz ANOOOGUKXYQFMD-MRXNPFEDSA-N 1 2 322.330 4.143 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@@H]2c2cccnc2)cc(C(F)(F)F)c1 ZINC000356294825 1043829624 /nfs/dbraw/zinc/82/96/24/1043829624.db2.gz ANOOOGUKXYQFMD-MRXNPFEDSA-N 1 2 322.330 4.143 20 0 DIADLO Clc1ncsc1C[NH+]1CCC(OC2CCCCC2)CC1 ZINC000878019068 1043839660 /nfs/dbraw/zinc/83/96/60/1043839660.db2.gz VIUFEKDPEUMYHJ-UHFFFAOYSA-N 1 2 314.882 4.110 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1scnc1Cl ZINC000878046074 1043842605 /nfs/dbraw/zinc/84/26/05/1043842605.db2.gz YEGCLSNWDZQAAK-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1scnc1Cl ZINC000878046074 1043842625 /nfs/dbraw/zinc/84/26/25/1043842625.db2.gz YEGCLSNWDZQAAK-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1c(C)cccc1Cl ZINC000878036566 1043843063 /nfs/dbraw/zinc/84/30/63/1043843063.db2.gz NVAIKTCQXSOYAA-CYBMUJFWSA-N 1 2 320.820 4.091 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1c(C)cccc1Cl ZINC000878036566 1043843078 /nfs/dbraw/zinc/84/30/78/1043843078.db2.gz NVAIKTCQXSOYAA-CYBMUJFWSA-N 1 2 320.820 4.091 20 0 DIADLO Clc1ccc(C2([NH2+]Cc3nc4c(o3)CCCC4)CCC2)cc1 ZINC000878238637 1043864599 /nfs/dbraw/zinc/86/45/99/1043864599.db2.gz ZMLNXZRHEJVRIH-UHFFFAOYSA-N 1 2 316.832 4.376 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(o1)CCCC2)c1cccc(C(F)(F)F)c1 ZINC000878346432 1043872319 /nfs/dbraw/zinc/87/23/19/1043872319.db2.gz ZKJIICWQJKIIRG-LLVKDONJSA-N 1 2 324.346 4.423 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2c(o1)CCCC2)c1cccc(Cl)c1 ZINC000878349585 1043874576 /nfs/dbraw/zinc/87/45/76/1043874576.db2.gz DEVHVPJCIDVEDH-CQSZACIVSA-N 1 2 304.821 4.448 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(o1)CCCC2)c1cccc(OC(F)F)c1 ZINC000878351119 1043876279 /nfs/dbraw/zinc/87/62/79/1043876279.db2.gz ORGNMZWHBCRMOM-LLVKDONJSA-N 1 2 322.355 4.006 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2nc3c(o2)CCCC3)c1 ZINC000878352964 1043876357 /nfs/dbraw/zinc/87/63/57/1043876357.db2.gz QOBBUPRTMKCZIB-CQSZACIVSA-N 1 2 314.429 4.191 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3scnc3Cl)CCC2)c(F)c1 ZINC000878367779 1043878826 /nfs/dbraw/zinc/87/88/26/1043878826.db2.gz BRMSQJAVSDQICP-UHFFFAOYSA-N 1 2 314.788 4.244 20 0 DIADLO CCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nocc1C ZINC000878368396 1043878947 /nfs/dbraw/zinc/87/89/47/1043878947.db2.gz BHVUNRXHJKUHNK-MRXNPFEDSA-N 1 2 302.418 4.259 20 0 DIADLO C[C@H]([NH2+]Cc1scnc1Cl)c1c(F)cccc1Cl ZINC000878372076 1043880290 /nfs/dbraw/zinc/88/02/90/1043880290.db2.gz ZSDYDAZUFYGHLK-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2ccc(-c3ccccc3F)s2)n1 ZINC000356858879 1043884324 /nfs/dbraw/zinc/88/43/24/1043884324.db2.gz CTMXKKIKACQBRD-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(C(F)(F)F)co1)c1nc(C)cs1 ZINC000878407801 1043884683 /nfs/dbraw/zinc/88/46/83/1043884683.db2.gz BFFQMSXIGSHQCH-LLVKDONJSA-N 1 2 304.337 4.304 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1coc(C(C)(C)C)n1 ZINC000930185854 1043888178 /nfs/dbraw/zinc/88/81/78/1043888178.db2.gz OIORFASMEPFHPY-CYBMUJFWSA-N 1 2 302.418 4.140 20 0 DIADLO C[C@H]([NH2+]Cc1nc(CC2CC2)no1)c1csc2ccccc12 ZINC000878419393 1043889675 /nfs/dbraw/zinc/88/96/75/1043889675.db2.gz DKQGXXPVRLPNSA-NSHDSACASA-N 1 2 313.426 4.088 20 0 DIADLO FC1(F)CCC[C@H]1CC[N@@H+]1CCSC[C@H]1c1nccs1 ZINC000878447299 1043893663 /nfs/dbraw/zinc/89/36/63/1043893663.db2.gz LISFUQCISVFMRM-RYUDHWBXSA-N 1 2 318.458 4.059 20 0 DIADLO FC1(F)CCC[C@H]1CC[N@H+]1CCSC[C@H]1c1nccs1 ZINC000878447299 1043893676 /nfs/dbraw/zinc/89/36/76/1043893676.db2.gz LISFUQCISVFMRM-RYUDHWBXSA-N 1 2 318.458 4.059 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2cc(C(F)(F)F)co2)C1 ZINC000878429077 1043893792 /nfs/dbraw/zinc/89/37/92/1043893792.db2.gz WAPHZKBWVVZJAS-IAQYHMDHSA-N 1 2 310.319 4.277 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cc(C(F)(F)F)co2)C1 ZINC000878429077 1043893811 /nfs/dbraw/zinc/89/38/11/1043893811.db2.gz WAPHZKBWVVZJAS-IAQYHMDHSA-N 1 2 310.319 4.277 20 0 DIADLO Cc1nc(-c2ccc([C@H](C)[NH2+][C@H](C)c3ncccn3)cc2)cs1 ZINC000930205578 1043894073 /nfs/dbraw/zinc/89/40/73/1043894073.db2.gz TYDXHLCICBDQBB-QWHCGFSZSA-N 1 2 324.453 4.320 20 0 DIADLO C[N@H+](Cc1csc(C(F)(F)F)n1)[C@@H]1CCc2ccccc21 ZINC001141887263 1043894102 /nfs/dbraw/zinc/89/41/02/1043894102.db2.gz AUXRKRVRMFFLMW-CYBMUJFWSA-N 1 2 312.360 4.281 20 0 DIADLO C[N@@H+](Cc1csc(C(F)(F)F)n1)[C@@H]1CCc2ccccc21 ZINC001141887263 1043894117 /nfs/dbraw/zinc/89/41/17/1043894117.db2.gz AUXRKRVRMFFLMW-CYBMUJFWSA-N 1 2 312.360 4.281 20 0 DIADLO CC(C)CC[C@H]([NH2+]Cc1nncs1)c1ccc(Cl)cc1 ZINC000930204578 1043895080 /nfs/dbraw/zinc/89/50/80/1043895080.db2.gz BJCTUHDIDIAPDH-AWEZNQCLSA-N 1 2 309.866 4.459 20 0 DIADLO C[NH+](C)C1(c2nc(C3CCC(c4ccccc4)CC3)no2)CC1 ZINC000896350718 1043896328 /nfs/dbraw/zinc/89/63/28/1043896328.db2.gz HSNHUUKGCMMEQV-UHFFFAOYSA-N 1 2 311.429 4.062 20 0 DIADLO CC(C)[C@@H](c1ccccc1)[N@H+](C)Cc1ncn(-c2ccccc2)n1 ZINC000356992078 1043903905 /nfs/dbraw/zinc/90/39/05/1043903905.db2.gz VUTIJGTUYMUOKJ-FQEVSTJZSA-N 1 2 320.440 4.096 20 0 DIADLO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1ncn(-c2ccccc2)n1 ZINC000356992078 1043903918 /nfs/dbraw/zinc/90/39/18/1043903918.db2.gz VUTIJGTUYMUOKJ-FQEVSTJZSA-N 1 2 320.440 4.096 20 0 DIADLO CCOc1ccccc1C1=CC[N@@H+]([C@H](C)c2ncc(C)o2)CC1 ZINC000356985196 1043904044 /nfs/dbraw/zinc/90/40/44/1043904044.db2.gz NMUMAIAAMXYACK-OAHLLOKOSA-N 1 2 312.413 4.232 20 0 DIADLO CCOc1ccccc1C1=CC[N@H+]([C@H](C)c2ncc(C)o2)CC1 ZINC000356985196 1043904053 /nfs/dbraw/zinc/90/40/53/1043904053.db2.gz NMUMAIAAMXYACK-OAHLLOKOSA-N 1 2 312.413 4.232 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(-c3cccs3)n2)CCC1(F)F ZINC000290007351 1043906670 /nfs/dbraw/zinc/90/66/70/1043906670.db2.gz ZNQIDVZFPVOULX-SNVBAGLBSA-N 1 2 314.426 4.349 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(-c3cccs3)n2)CCC1(F)F ZINC000290007351 1043906682 /nfs/dbraw/zinc/90/66/82/1043906682.db2.gz ZNQIDVZFPVOULX-SNVBAGLBSA-N 1 2 314.426 4.349 20 0 DIADLO COc1ccccc1[C@H](CC(C)C)[NH2+][C@H](C)c1cc(C)on1 ZINC000290035778 1043912080 /nfs/dbraw/zinc/91/20/80/1043912080.db2.gz BEUFQHXIEDBNQD-PBHICJAKSA-N 1 2 302.418 4.430 20 0 DIADLO C[C@@H](O)C[C@H](CNc1cc(C(F)(F)F)cc[nH+]1)c1ccccc1 ZINC000561259038 1043914992 /nfs/dbraw/zinc/91/49/92/1043914992.db2.gz INWKJOPMMRBOQI-TZMCWYRMSA-N 1 2 324.346 4.067 20 0 DIADLO C[C@@H]([NH2+]Cc1cn2cc(Cl)ccc2n1)c1ccc(F)cc1F ZINC000102689669 1043926252 /nfs/dbraw/zinc/92/62/52/1043926252.db2.gz WXHHBILHSBIVRO-SNVBAGLBSA-N 1 2 321.758 4.117 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccccc1F ZINC000878918044 1043929220 /nfs/dbraw/zinc/92/92/20/1043929220.db2.gz CNPMMPMSBJETIS-GOSISDBHSA-N 1 2 302.393 4.179 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1nc(-c2ccccc2)cs1 ZINC000357219872 1043931450 /nfs/dbraw/zinc/93/14/50/1043931450.db2.gz ZPSMHULDALQDDK-AWEZNQCLSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1nc(-c2ccccc2)cs1 ZINC000357219872 1043931462 /nfs/dbraw/zinc/93/14/62/1043931462.db2.gz ZPSMHULDALQDDK-AWEZNQCLSA-N 1 2 309.438 4.398 20 0 DIADLO CCCC[C@H](CC)[NH2+][C@@H](COC(C)(C)C)C(=O)OC(C)(C)C ZINC001257409271 1043937125 /nfs/dbraw/zinc/93/71/25/1043937125.db2.gz ZXRQMVOMGARIOF-GJZGRUSLSA-N 1 2 315.498 4.070 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+](C)Cc1cccc(F)c1F ZINC001137140648 1043944254 /nfs/dbraw/zinc/94/42/54/1043944254.db2.gz JQXJDPIPNOCUEU-UHFFFAOYSA-N 1 2 305.368 4.384 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+](C)Cc1cccc(F)c1F ZINC001137140648 1043944260 /nfs/dbraw/zinc/94/42/60/1043944260.db2.gz JQXJDPIPNOCUEU-UHFFFAOYSA-N 1 2 305.368 4.384 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+](Cc2ccccn2)C2CC2)s1 ZINC000290366535 1043945155 /nfs/dbraw/zinc/94/51/55/1043945155.db2.gz HFEPBAFJXMCRTG-UHFFFAOYSA-N 1 2 301.459 4.000 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+](Cc2ccccn2)C2CC2)s1 ZINC000290366535 1043945164 /nfs/dbraw/zinc/94/51/64/1043945164.db2.gz HFEPBAFJXMCRTG-UHFFFAOYSA-N 1 2 301.459 4.000 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccc(F)c(Cl)c1)C1CC1)c1ncccn1 ZINC000930610714 1043947496 /nfs/dbraw/zinc/94/74/96/1043947496.db2.gz DUIQDUAZNQALFE-BMIGLBTASA-N 1 2 305.784 4.071 20 0 DIADLO FC(F)SCc1ccc(C[N@H+](Cc2ccccn2)C2CC2)o1 ZINC000290510459 1043958484 /nfs/dbraw/zinc/95/84/84/1043958484.db2.gz PMZWKABMFPMDBE-UHFFFAOYSA-N 1 2 324.396 4.295 20 0 DIADLO FC(F)SCc1ccc(C[N@@H+](Cc2ccccn2)C2CC2)o1 ZINC000290510459 1043958492 /nfs/dbraw/zinc/95/84/92/1043958492.db2.gz PMZWKABMFPMDBE-UHFFFAOYSA-N 1 2 324.396 4.295 20 0 DIADLO CC(C)OCc1noc(C[N@H+](C(C)C)[C@H](C)c2ccsc2)n1 ZINC000930750517 1043959699 /nfs/dbraw/zinc/95/96/99/1043959699.db2.gz GWJSRHQRXWCLEB-CYBMUJFWSA-N 1 2 323.462 4.028 20 0 DIADLO CC(C)OCc1noc(C[N@@H+](C(C)C)[C@H](C)c2ccsc2)n1 ZINC000930750517 1043959707 /nfs/dbraw/zinc/95/97/07/1043959707.db2.gz GWJSRHQRXWCLEB-CYBMUJFWSA-N 1 2 323.462 4.028 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)[C@@H](C)c3cccnc3)co2)cc1 ZINC000357612249 1043969042 /nfs/dbraw/zinc/96/90/42/1043969042.db2.gz JISCQDLUKCGDCQ-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)[C@@H](C)c3cccnc3)co2)cc1 ZINC000357612249 1043969052 /nfs/dbraw/zinc/96/90/52/1043969052.db2.gz JISCQDLUKCGDCQ-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1cc2ccccc2nc1Cl ZINC000127801416 1043970240 /nfs/dbraw/zinc/97/02/40/1043970240.db2.gz LGLHWFVOJRYWEB-CYBMUJFWSA-N 1 2 311.816 4.476 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1cc2ccccc2nc1Cl ZINC000127801416 1043970248 /nfs/dbraw/zinc/97/02/48/1043970248.db2.gz LGLHWFVOJRYWEB-CYBMUJFWSA-N 1 2 311.816 4.476 20 0 DIADLO C[C@H](c1ccc(F)nc1)[N@@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000930967485 1043978737 /nfs/dbraw/zinc/97/87/37/1043978737.db2.gz XVANUUNNVGJHIC-CXAGYDPISA-N 1 2 300.377 4.492 20 0 DIADLO C[C@H](c1ccc(F)nc1)[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000930967485 1043978748 /nfs/dbraw/zinc/97/87/48/1043978748.db2.gz XVANUUNNVGJHIC-CXAGYDPISA-N 1 2 300.377 4.492 20 0 DIADLO Cc1nnsc1[C@H](C)[N@@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000930966523 1043979441 /nfs/dbraw/zinc/97/94/41/1043979441.db2.gz PWWXTYRMDFQUHZ-WFASDCNBSA-N 1 2 303.431 4.118 20 0 DIADLO Cc1nnsc1[C@H](C)[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000930966523 1043979454 /nfs/dbraw/zinc/97/94/54/1043979454.db2.gz PWWXTYRMDFQUHZ-WFASDCNBSA-N 1 2 303.431 4.118 20 0 DIADLO c1cn2c(cccc2CNc2cccnc2-c2ccccc2)[nH+]1 ZINC000357711814 1043979552 /nfs/dbraw/zinc/97/95/52/1043979552.db2.gz PXTNTWNISQXOOK-UHFFFAOYSA-N 1 2 300.365 4.008 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](C)c2cc3cnccc3o2)cs1 ZINC000879712072 1043984952 /nfs/dbraw/zinc/98/49/52/1043984952.db2.gz GTSVSLYFAINBRJ-GFCCVEGCSA-N 1 2 315.442 4.478 20 0 DIADLO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2cccnc2C(F)(F)F)c1 ZINC000879752916 1043990432 /nfs/dbraw/zinc/99/04/32/1043990432.db2.gz WEVXJMSHFMUBSF-HNNXBMFYSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cncc([C@@H]2CCC[N@H+]2Cc2cccnc2C(F)(F)F)c1 ZINC000879752916 1043990436 /nfs/dbraw/zinc/99/04/36/1043990436.db2.gz WEVXJMSHFMUBSF-HNNXBMFYSA-N 1 2 321.346 4.141 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nnc[nH]1)c1ccccc1)[C@@H](C)C1CCCCC1 ZINC000474937965 1043991130 /nfs/dbraw/zinc/99/11/30/1043991130.db2.gz CBWMCQMOFCHQOL-RVKKMQEKSA-N 1 2 312.461 4.089 20 0 DIADLO COc1c(Nc2ccc[nH+]c2N2CCCCC2)ccc(F)c1F ZINC001211887564 1043995154 /nfs/dbraw/zinc/99/51/54/1043995154.db2.gz LHSNEXFSANCQQY-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1cc(F)c(Br)cc1F ZINC001141910814 1044001226 /nfs/dbraw/zinc/00/12/26/1044001226.db2.gz XWLUWCLHCLZPBH-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1cc(F)c(Br)cc1F ZINC001141910814 1044001240 /nfs/dbraw/zinc/00/12/40/1044001240.db2.gz XWLUWCLHCLZPBH-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CC[C@](C)(C(F)(F)F)C2)n1 ZINC000880002458 1044005624 /nfs/dbraw/zinc/00/56/24/1044005624.db2.gz KTIMHSKGWSOBDH-AWEZNQCLSA-N 1 2 303.372 4.019 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CC[C@](C)(C(F)(F)F)C2)n1 ZINC000880002458 1044005638 /nfs/dbraw/zinc/00/56/38/1044005638.db2.gz KTIMHSKGWSOBDH-AWEZNQCLSA-N 1 2 303.372 4.019 20 0 DIADLO CC(C)Sc1ccc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)cc1 ZINC000358074746 1044013636 /nfs/dbraw/zinc/01/36/36/1044013636.db2.gz PDHLVLVBAZQDJA-MRXNPFEDSA-N 1 2 301.459 4.247 20 0 DIADLO CC(C)Sc1ccc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)cc1 ZINC000358074746 1044013646 /nfs/dbraw/zinc/01/36/46/1044013646.db2.gz PDHLVLVBAZQDJA-MRXNPFEDSA-N 1 2 301.459 4.247 20 0 DIADLO COCc1cccc(C[N@H+](Cc2ccco2)Cc2cccnc2)c1 ZINC000358065457 1044015211 /nfs/dbraw/zinc/01/52/11/1044015211.db2.gz RRTWKEYZLFAXLX-UHFFFAOYSA-N 1 2 322.408 4.023 20 0 DIADLO COCc1cccc(C[N@@H+](Cc2ccco2)Cc2cccnc2)c1 ZINC000358065457 1044015226 /nfs/dbraw/zinc/01/52/26/1044015226.db2.gz RRTWKEYZLFAXLX-UHFFFAOYSA-N 1 2 322.408 4.023 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2cc(F)ccc2OC)on1 ZINC000291166002 1044032557 /nfs/dbraw/zinc/03/25/57/1044032557.db2.gz JDEMPJBTFBBVBI-UHFFFAOYSA-N 1 2 306.381 4.016 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCO[C@@H](c3ccccc3)C2)cc1F ZINC000561945959 1044032572 /nfs/dbraw/zinc/03/25/72/1044032572.db2.gz ZVWGIMXEJYKZSG-PHWHVTFISA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCO[C@@H](c3ccccc3)C2)cc1F ZINC000561945959 1044032588 /nfs/dbraw/zinc/03/25/88/1044032588.db2.gz ZVWGIMXEJYKZSG-PHWHVTFISA-N 1 2 315.363 4.052 20 0 DIADLO COc1c(C)cnc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)c1C ZINC000561960460 1044035186 /nfs/dbraw/zinc/03/51/86/1044035186.db2.gz SQKPHHXJJWRBQV-KRWDZBQOSA-N 1 2 316.470 4.352 20 0 DIADLO COc1c(C)cnc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)c1C ZINC000561960460 1044035202 /nfs/dbraw/zinc/03/52/02/1044035202.db2.gz SQKPHHXJJWRBQV-KRWDZBQOSA-N 1 2 316.470 4.352 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1nc2ccccc2n1C ZINC000561957663 1044035525 /nfs/dbraw/zinc/03/55/25/1044035525.db2.gz PBPYVGSBOXHSCK-KRWDZBQOSA-N 1 2 323.440 4.165 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1nc2ccccc2n1C ZINC000561957663 1044035539 /nfs/dbraw/zinc/03/55/39/1044035539.db2.gz PBPYVGSBOXHSCK-KRWDZBQOSA-N 1 2 323.440 4.165 20 0 DIADLO CCOc1cc(Cl)ccc1C[NH2+][C@@H](C)c1csc(C)n1 ZINC000358232300 1044038382 /nfs/dbraw/zinc/03/83/82/1044038382.db2.gz UUCFFDSLHYVXCL-JTQLQIEISA-N 1 2 310.850 4.354 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+][C@H](c1cccc(F)c1)c1ccccn1 ZINC000358241787 1044038572 /nfs/dbraw/zinc/03/85/72/1044038572.db2.gz TYQDLPUPWYMWBJ-FOIQADDNSA-N 1 2 321.399 4.364 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+][C@H](c1cccc(F)c1)c1ccccn1 ZINC000358241789 1044039994 /nfs/dbraw/zinc/03/99/94/1044039994.db2.gz TYQDLPUPWYMWBJ-MGPUTAFESA-N 1 2 321.399 4.364 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)[nH]1 ZINC000358237285 1044040077 /nfs/dbraw/zinc/04/00/77/1044040077.db2.gz LAPLIDXGCDDTSH-CHWSQXEVSA-N 1 2 310.401 4.039 20 0 DIADLO FC(F)[C@H]([NH2+]CCC[C@@H]1CCOC1)c1cccc(Cl)c1 ZINC000880534674 1044046112 /nfs/dbraw/zinc/04/61/12/1044046112.db2.gz UHXWOGOWRCXZGT-BXUZGUMPSA-N 1 2 303.780 4.053 20 0 DIADLO CCOC1CC(C[NH2+][C@H](c2cccc(Cl)c2)C(F)F)C1 ZINC000880533719 1044046442 /nfs/dbraw/zinc/04/64/42/1044046442.db2.gz GHMCVPUQHICABM-UZANAETPSA-N 1 2 303.780 4.051 20 0 DIADLO c1cn(-c2ccc(CSc3nc4ccccc4[nH]3)cc2)c[nH+]1 ZINC000358318584 1044051961 /nfs/dbraw/zinc/05/19/61/1044051961.db2.gz DENWUNFQRMJOOH-UHFFFAOYSA-N 1 2 306.394 4.041 20 0 DIADLO c1cc2cc(CNc3ccc([NH+]4CCCC4)cc3)ccc2cn1 ZINC000324158047 1044070984 /nfs/dbraw/zinc/07/09/84/1044070984.db2.gz IEXASEHOQGYHQU-UHFFFAOYSA-N 1 2 303.409 4.447 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ccnc(Cl)c1Cl ZINC000291585536 1044085836 /nfs/dbraw/zinc/08/58/36/1044085836.db2.gz PFTNTYBBWVRYCO-UHFFFAOYSA-N 1 2 314.216 4.018 20 0 DIADLO COc1cccc([C@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)c1 ZINC000281038574 1044089053 /nfs/dbraw/zinc/08/90/53/1044089053.db2.gz GSZMAGUCPYOXLO-VIFPVBQESA-N 1 2 313.294 4.102 20 0 DIADLO Cc1ccc(CSCc2cnn(-c3ccccc3)c2)c(C)[nH+]1 ZINC000358650425 1044089652 /nfs/dbraw/zinc/08/96/52/1044089652.db2.gz LABWTUMRRMDTFK-UHFFFAOYSA-N 1 2 309.438 4.318 20 0 DIADLO CC[N@H+](Cc1ncccn1)C(c1ccccc1)c1ccccc1 ZINC000562319106 1044099065 /nfs/dbraw/zinc/09/90/65/1044099065.db2.gz DGTUJXMGUUJAAY-UHFFFAOYSA-N 1 2 303.409 4.088 20 0 DIADLO CC[N@@H+](Cc1ncccn1)C(c1ccccc1)c1ccccc1 ZINC000562319106 1044099082 /nfs/dbraw/zinc/09/90/82/1044099082.db2.gz DGTUJXMGUUJAAY-UHFFFAOYSA-N 1 2 303.409 4.088 20 0 DIADLO CC1(c2ccccc2)CC([NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC000562340254 1044101708 /nfs/dbraw/zinc/10/17/08/1044101708.db2.gz GWSAIAVDILGNHH-QPIRBTGLSA-N 1 2 324.472 4.136 20 0 DIADLO CCCCc1nc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccnc2)cs1 ZINC000358835535 1044102968 /nfs/dbraw/zinc/10/29/68/1044102968.db2.gz YNMPTSRLUFMBDM-PBHICJAKSA-N 1 2 315.486 4.464 20 0 DIADLO CCCCc1nc(C[N@H+]2C[C@H](C)C[C@H]2c2cccnc2)cs1 ZINC000358835535 1044102981 /nfs/dbraw/zinc/10/29/81/1044102981.db2.gz YNMPTSRLUFMBDM-PBHICJAKSA-N 1 2 315.486 4.464 20 0 DIADLO CCCCc1nc(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccnc2)cs1 ZINC000358835538 1044103502 /nfs/dbraw/zinc/10/35/02/1044103502.db2.gz YNMPTSRLUFMBDM-YOEHRIQHSA-N 1 2 315.486 4.464 20 0 DIADLO CCCCc1nc(C[N@H+]2C[C@@H](C)C[C@H]2c2cccnc2)cs1 ZINC000358835538 1044103505 /nfs/dbraw/zinc/10/35/05/1044103505.db2.gz YNMPTSRLUFMBDM-YOEHRIQHSA-N 1 2 315.486 4.464 20 0 DIADLO Cc1cccc([C@H](C)C[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)c1 ZINC000562340579 1044104054 /nfs/dbraw/zinc/10/40/54/1044104054.db2.gz KZFLUDRCUOMVSR-QAPCUYQASA-N 1 2 312.461 4.128 20 0 DIADLO Cc1cc(NC(=O)c2cccc(-n3cc[nH+]c3)c2)ccc1C1CC1 ZINC000358890433 1044108086 /nfs/dbraw/zinc/10/80/86/1044108086.db2.gz WONFSEWWJMKJDV-UHFFFAOYSA-N 1 2 317.392 4.310 20 0 DIADLO Cc1ccsc1[C@@H](CO)[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000346517205 1044110797 /nfs/dbraw/zinc/11/07/97/1044110797.db2.gz DDNPGKACOXLJSW-NWDGAFQWSA-N 1 2 310.488 4.021 20 0 DIADLO CSc1cc(C[NH2+][C@@H](C)c2csc(C(C)C)n2)ccn1 ZINC000346568381 1044117245 /nfs/dbraw/zinc/11/72/45/1044117245.db2.gz NZAMNBWTXCSFRB-NSHDSACASA-N 1 2 307.488 4.234 20 0 DIADLO Clc1ccc(C[N@H+](Cc2ccccc2)Cc2cccnc2)cn1 ZINC001137167038 1044118851 /nfs/dbraw/zinc/11/88/51/1044118851.db2.gz RTVIGMOTJHVODB-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1ccc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)cn1 ZINC001137167038 1044118857 /nfs/dbraw/zinc/11/88/57/1044118857.db2.gz RTVIGMOTJHVODB-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000932375278 1044122667 /nfs/dbraw/zinc/12/26/67/1044122667.db2.gz NAZVAAWHKXCMNU-LJQANCHMSA-N 1 2 319.408 4.286 20 0 DIADLO CC(C)c1ccc(C[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)cc1 ZINC000292018190 1044126867 /nfs/dbraw/zinc/12/68/67/1044126867.db2.gz CCACJISQPAXZSY-SFHVURJKSA-N 1 2 312.461 4.339 20 0 DIADLO O=C(Nc1cccc(C2CCC2)c1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000292026297 1044129342 /nfs/dbraw/zinc/12/93/42/1044129342.db2.gz KEBUSAONYBBSJX-UHFFFAOYSA-N 1 2 324.428 4.089 20 0 DIADLO Cc1oncc1C[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1F ZINC000932568172 1044144910 /nfs/dbraw/zinc/14/49/10/1044144910.db2.gz PMIFYIJBFNFQEG-SSDOTTSWSA-N 1 2 303.164 4.280 20 0 DIADLO COc1ccncc1C[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000346814317 1044145967 /nfs/dbraw/zinc/14/59/67/1044145967.db2.gz BALYWJHVPIQXSE-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccncc1C[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000346814317 1044145973 /nfs/dbraw/zinc/14/59/73/1044145973.db2.gz BALYWJHVPIQXSE-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO CCCc1nc(C)c(CNc2cc[nH+]c3c(OC)cccc23)o1 ZINC000292187236 1044147404 /nfs/dbraw/zinc/14/74/04/1044147404.db2.gz FWWXYQOFFARHPE-UHFFFAOYSA-N 1 2 311.385 4.104 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C/C=C\c3ccccc3F)cc2[nH+]1 ZINC000359309724 1044153999 /nfs/dbraw/zinc/15/39/99/1044153999.db2.gz RQIXZMRBUJHVFT-XQRVVYSFSA-N 1 2 309.344 4.052 20 0 DIADLO c1[nH+]c(-c2cccc(NCc3ccccc3)c2)n2c1CCCC2 ZINC000444013069 1044155170 /nfs/dbraw/zinc/15/51/70/1044155170.db2.gz XFIIGJARXLMCTC-UHFFFAOYSA-N 1 2 303.409 4.499 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1nccn1C)c1ccccc1)c1ccsc1 ZINC000562774789 1044156427 /nfs/dbraw/zinc/15/64/27/1044156427.db2.gz IAJZBWDRKMEREN-DLBZAZTESA-N 1 2 311.454 4.312 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000346968872 1044177436 /nfs/dbraw/zinc/17/74/36/1044177436.db2.gz FNRRHBFYQACQIN-IBGZPJMESA-N 1 2 324.424 4.020 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000346968872 1044177445 /nfs/dbraw/zinc/17/74/45/1044177445.db2.gz FNRRHBFYQACQIN-IBGZPJMESA-N 1 2 324.424 4.020 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+]2CCC[C@H]2c2cccnc2)o1 ZINC000346963875 1044177741 /nfs/dbraw/zinc/17/77/41/1044177741.db2.gz AJZYOXUBTHWWGL-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+]2CCC[C@H]2c2cccnc2)o1 ZINC000346963875 1044177745 /nfs/dbraw/zinc/17/77/45/1044177745.db2.gz AJZYOXUBTHWWGL-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO C[C@H]1CC[C@@]2(CC[N@H+](Cc3nc(C(F)(F)F)cs3)C2)C1 ZINC000359568937 1044178296 /nfs/dbraw/zinc/17/82/96/1044178296.db2.gz YMIHFYUOGYBNQS-GXFFZTMASA-N 1 2 304.381 4.174 20 0 DIADLO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3nc(C(F)(F)F)cs3)C2)C1 ZINC000359568937 1044178306 /nfs/dbraw/zinc/17/83/06/1044178306.db2.gz YMIHFYUOGYBNQS-GXFFZTMASA-N 1 2 304.381 4.174 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@H]2c2cccnc2)s1 ZINC000346975872 1044180632 /nfs/dbraw/zinc/18/06/32/1044180632.db2.gz QDIOBCZBELTRDT-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@H]2c2cccnc2)s1 ZINC000346975872 1044180638 /nfs/dbraw/zinc/18/06/38/1044180638.db2.gz QDIOBCZBELTRDT-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO c1csc(-c2cnc(C[N@@H+]3CCC[C@H]3c3cccnc3)o2)c1 ZINC000346991341 1044182130 /nfs/dbraw/zinc/18/21/30/1044182130.db2.gz IBUAFPSRRKFZSD-AWEZNQCLSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2cnc(C[N@H+]3CCC[C@H]3c3cccnc3)o2)c1 ZINC000346991341 1044182134 /nfs/dbraw/zinc/18/21/34/1044182134.db2.gz IBUAFPSRRKFZSD-AWEZNQCLSA-N 1 2 311.410 4.135 20 0 DIADLO Fc1ccc(-c2nc(C[N@@H+]3CCC[C@@H]3c3cccnc3)co2)cc1 ZINC000346994259 1044183377 /nfs/dbraw/zinc/18/33/77/1044183377.db2.gz ZYWKMFTXDCUNNX-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(-c2nc(C[N@H+]3CCC[C@@H]3c3cccnc3)co2)cc1 ZINC000346994259 1044183383 /nfs/dbraw/zinc/18/33/83/1044183383.db2.gz ZYWKMFTXDCUNNX-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1ncc(C3CC3)o1)[C@H]2C ZINC000359637498 1044185140 /nfs/dbraw/zinc/18/51/40/1044185140.db2.gz QEGVRUWXPFQAGC-OLZOCXBDSA-N 1 2 312.413 4.068 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1ncc(C3CC3)o1)[C@H]2C ZINC000359637498 1044185144 /nfs/dbraw/zinc/18/51/44/1044185144.db2.gz QEGVRUWXPFQAGC-OLZOCXBDSA-N 1 2 312.413 4.068 20 0 DIADLO CCn1cnc2c1CC[N@@H+]([C@@H](C)c1ccc(C(F)(F)F)cc1)C2 ZINC000933263183 1044190687 /nfs/dbraw/zinc/19/06/87/1044190687.db2.gz YNRLOLVCKSXHOP-LBPRGKRZSA-N 1 2 323.362 4.041 20 0 DIADLO CCn1cnc2c1CC[N@H+]([C@@H](C)c1ccc(C(F)(F)F)cc1)C2 ZINC000933263183 1044190696 /nfs/dbraw/zinc/19/06/96/1044190696.db2.gz YNRLOLVCKSXHOP-LBPRGKRZSA-N 1 2 323.362 4.041 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2ccc(OC)c(C)c2)n1 ZINC000933490067 1044200670 /nfs/dbraw/zinc/20/06/70/1044200670.db2.gz QFPKEOSHHVPZDC-ZIAGYGMSSA-N 1 2 317.433 4.141 20 0 DIADLO CC[C@H](C)n1ncc(NCc2cc(-n3cc[nH+]c3)cs2)c1C ZINC000359809698 1044202290 /nfs/dbraw/zinc/20/22/90/1044202290.db2.gz CDIASBUNVOJSLS-LBPRGKRZSA-N 1 2 315.446 4.022 20 0 DIADLO CC[C@@H](C)n1ncc(NCc2cc(-n3cc[nH+]c3)cs2)c1C ZINC000359809696 1044202859 /nfs/dbraw/zinc/20/28/59/1044202859.db2.gz CDIASBUNVOJSLS-GFCCVEGCSA-N 1 2 315.446 4.022 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000292825674 1044216879 /nfs/dbraw/zinc/21/68/79/1044216879.db2.gz OIWAINBVQNTUPS-GOSISDBHSA-N 1 2 316.470 4.148 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000292825674 1044216893 /nfs/dbraw/zinc/21/68/93/1044216893.db2.gz OIWAINBVQNTUPS-GOSISDBHSA-N 1 2 316.470 4.148 20 0 DIADLO CCC[C@@](C)([NH2+]Cc1nc(C(C)(C)C)no1)c1ccccc1 ZINC000934184566 1044229986 /nfs/dbraw/zinc/22/99/86/1044229986.db2.gz TUIVRYIAXNVHSR-GOSISDBHSA-N 1 2 301.434 4.172 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3cncs3)cs2)cc1 ZINC000934201803 1044231431 /nfs/dbraw/zinc/23/14/31/1044231431.db2.gz UXXFGWUEZBNAPB-GFCCVEGCSA-N 1 2 315.467 4.426 20 0 DIADLO C[C@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1cncs1 ZINC000934202430 1044231655 /nfs/dbraw/zinc/23/16/55/1044231655.db2.gz QNSHVSBSLPNESC-NSHDSACASA-N 1 2 307.488 4.498 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nnc(C)s1)c1sccc1Cl ZINC000883215628 1044237122 /nfs/dbraw/zinc/23/71/22/1044237122.db2.gz CETUIBIWRYJFFW-GMSGAONNSA-N 1 2 301.868 4.363 20 0 DIADLO CC[C@@H]([NH2+]Cc1nccc(OC)c1F)c1sccc1Cl ZINC000883235502 1044240422 /nfs/dbraw/zinc/24/04/22/1044240422.db2.gz DZULNFQWTLZWEG-SNVBAGLBSA-N 1 2 314.813 4.185 20 0 DIADLO Cc1cnc(=S)n(C[N@H+](Cc2ccc(Cl)cc2)C2CC2)c1 ZINC000131305251 1044244536 /nfs/dbraw/zinc/24/45/36/1044244536.db2.gz NYVIXJSCXYUYEP-UHFFFAOYSA-N 1 2 319.861 4.197 20 0 DIADLO Cc1cnc(=S)n(C[N@@H+](Cc2ccc(Cl)cc2)C2CC2)c1 ZINC000131305251 1044244554 /nfs/dbraw/zinc/24/45/54/1044244554.db2.gz NYVIXJSCXYUYEP-UHFFFAOYSA-N 1 2 319.861 4.197 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)C[N@H+]2C[C@H](C)[C@H]2C)cc1 ZINC000563320572 1044247906 /nfs/dbraw/zinc/24/79/06/1044247906.db2.gz OJEMPTROGPDRKJ-JKSUJKDBSA-N 1 2 324.424 4.066 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)C[N@@H+]2C[C@H](C)[C@H]2C)cc1 ZINC000563320572 1044247920 /nfs/dbraw/zinc/24/79/20/1044247920.db2.gz OJEMPTROGPDRKJ-JKSUJKDBSA-N 1 2 324.424 4.066 20 0 DIADLO COc1ccc(C2CC2)cc1C[NH2+]Cc1cccc(O)c1Cl ZINC000883258063 1044248941 /nfs/dbraw/zinc/24/89/41/1044248941.db2.gz QMOJGQDYINETIY-UHFFFAOYSA-N 1 2 317.816 4.221 20 0 DIADLO COc1ccc(C2CC2)cc1C[NH2+][C@@H](C)c1nc(C)sc1C ZINC000883265682 1044252615 /nfs/dbraw/zinc/25/26/15/1044252615.db2.gz HUTRJKNSUGAZCY-NSHDSACASA-N 1 2 316.470 4.497 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccc(Cl)cc2OC(C)C)nn1C ZINC000883267317 1044256186 /nfs/dbraw/zinc/25/61/86/1044256186.db2.gz AISRFHCRHJRMJQ-ZDUSSCGKSA-N 1 2 321.852 4.020 20 0 DIADLO Cc1ccc(C[NH2+]Cc2cccc(OC3CC3)c2F)c(Cl)n1 ZINC000883293322 1044260946 /nfs/dbraw/zinc/26/09/46/1044260946.db2.gz PKIZXRMPUXWKND-UHFFFAOYSA-N 1 2 320.795 4.014 20 0 DIADLO CCCc1c(NCc2[nH]c(C)c(C)[nH+]2)cnn1-c1cccc(C)c1 ZINC000563441349 1044261458 /nfs/dbraw/zinc/26/14/58/1044261458.db2.gz WHQLOJMFSMJIIF-UHFFFAOYSA-N 1 2 323.444 4.085 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]C2(c3ncccn3)CCC2)s1 ZINC000883307566 1044261903 /nfs/dbraw/zinc/26/19/03/1044261903.db2.gz XGRLOXFTHMKWOR-UHFFFAOYSA-N 1 2 301.459 4.005 20 0 DIADLO CCSc1ccccc1[C@H](C)[NH2+]C1(c2ncccn2)CCC1 ZINC000883312630 1044264897 /nfs/dbraw/zinc/26/48/97/1044264897.db2.gz JESVCSRZDAPBFN-AWEZNQCLSA-N 1 2 313.470 4.319 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc(Br)nc2)c[nH+]c1C ZINC000883342709 1044278201 /nfs/dbraw/zinc/27/82/01/1044278201.db2.gz IZUKRCSCZSDYIJ-LLVKDONJSA-N 1 2 306.207 4.029 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)c[nH+]c1C ZINC000883342312 1044279219 /nfs/dbraw/zinc/27/92/19/1044279219.db2.gz SHRRKCFNINJQQG-ZDUSSCGKSA-N 1 2 309.413 4.101 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)c(F)cc2F)cc1 ZINC001137891266 1044286728 /nfs/dbraw/zinc/28/67/28/1044286728.db2.gz HCXKTJRVXLMIFT-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)c(F)cc2F)cc1 ZINC001137891266 1044286740 /nfs/dbraw/zinc/28/67/40/1044286740.db2.gz HCXKTJRVXLMIFT-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@H]([NH2+][C@H]1c2ccccc2CC[C@@H]1F)c1ccncc1Cl ZINC000883377536 1044289824 /nfs/dbraw/zinc/28/98/24/1044289824.db2.gz KIGVBGNJUCKVKR-GOPGUHFVSA-N 1 2 304.796 4.411 20 0 DIADLO C[C@H]([NH2+][C@H]1c2ccccc2CC[C@@H]1F)c1nc2ccccc2n1C ZINC000883376587 1044289901 /nfs/dbraw/zinc/28/99/01/1044289901.db2.gz OOLDFCQDFNHFND-AXHNFQJDSA-N 1 2 323.415 4.250 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@H]1CCc2ccc(Cl)nc21 ZINC000883377012 1044290374 /nfs/dbraw/zinc/29/03/74/1044290374.db2.gz XSXIQTQUJNVXTH-VKJFTORMSA-N 1 2 316.807 4.338 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@H]1[NH2+][C@H]1CCc2ccc(Cl)nc21 ZINC000883377011 1044291061 /nfs/dbraw/zinc/29/10/61/1044291061.db2.gz XSXIQTQUJNVXTH-RVKKMQEKSA-N 1 2 316.807 4.338 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@@H](C)c2ccncc2F)c2ccccn2)c1 ZINC000563670188 1044300961 /nfs/dbraw/zinc/30/09/61/1044300961.db2.gz LFRXMERHXHRIIG-YWZLYKJASA-N 1 2 321.399 4.364 20 0 DIADLO O=C(Nc1cccc(C2CCC2)c1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000563685202 1044302292 /nfs/dbraw/zinc/30/22/92/1044302292.db2.gz YYLOXQZHKRZFBT-UHFFFAOYSA-N 1 2 324.428 4.089 20 0 DIADLO O=C(Nc1cccc(C2CCC2)c1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000563685202 1044302301 /nfs/dbraw/zinc/30/23/01/1044302301.db2.gz YYLOXQZHKRZFBT-UHFFFAOYSA-N 1 2 324.428 4.089 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000360725706 1044304377 /nfs/dbraw/zinc/30/43/77/1044304377.db2.gz MQLXHNXCGJXGGK-JOYOIKCWSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1csc(C2CC2)n1 ZINC000360725706 1044304388 /nfs/dbraw/zinc/30/43/88/1044304388.db2.gz MQLXHNXCGJXGGK-JOYOIKCWSA-N 1 2 304.381 4.183 20 0 DIADLO Oc1cccc(C[NH2+][C@H]2CCOc3c(Cl)cccc32)c1Cl ZINC000293637446 1044308390 /nfs/dbraw/zinc/30/83/90/1044308390.db2.gz RMNBUBZFFWQOLH-ZDUSSCGKSA-N 1 2 324.207 4.312 20 0 DIADLO Oc1cccc(C[NH2+]C2(c3nccs3)CCCC2)c1Cl ZINC000293657071 1044310608 /nfs/dbraw/zinc/31/06/08/1044310608.db2.gz SXYNGNYAASHVEI-UHFFFAOYSA-N 1 2 308.834 4.061 20 0 DIADLO Cc1ccc2c(Nc3ncc(Cl)nc3Cl)cccc2[nH+]1 ZINC001212795235 1044319588 /nfs/dbraw/zinc/31/95/88/1044319588.db2.gz WNMADCVMIAGNGV-UHFFFAOYSA-N 1 2 305.168 4.384 20 0 DIADLO Cc1cc2cc(C[NH2+][C@H](c3nnc[nH]3)C3CCCCC3)ccc2[nH]1 ZINC000293722987 1044320017 /nfs/dbraw/zinc/32/00/17/1044320017.db2.gz PRRPUNOQJPKIPX-SFHVURJKSA-N 1 2 323.444 4.006 20 0 DIADLO Cc1cc2cc(C[NH2+][C@@H](c3nnc[nH]3)C3CCCCC3)ccc2[nH]1 ZINC000293722977 1044320732 /nfs/dbraw/zinc/32/07/32/1044320732.db2.gz PRRPUNOQJPKIPX-GOSISDBHSA-N 1 2 323.444 4.006 20 0 DIADLO c1cncc([C@@H](Nc2ccc(N3CCCCC3)[nH+]c2)C2CCC2)c1 ZINC000360882024 1044322527 /nfs/dbraw/zinc/32/25/27/1044322527.db2.gz BYTAXDQILFWKAG-FQEVSTJZSA-N 1 2 322.456 4.420 20 0 DIADLO Cc1nc(N2CCC(c3cccc4ccccc43)CC2)cc[nH+]1 ZINC000360983079 1044338940 /nfs/dbraw/zinc/33/89/40/1044338940.db2.gz MGFFJHYYZHWFHJ-UHFFFAOYSA-N 1 2 303.409 4.322 20 0 DIADLO FC(F)[C@@H](CCc1ccccc1)[NH2+]C[C@H]1CC1(Cl)Cl ZINC001308862800 1044340228 /nfs/dbraw/zinc/34/02/28/1044340228.db2.gz IGKANIIHUZLZEU-VXGBXAGGSA-N 1 2 308.199 4.036 20 0 DIADLO Fc1cccc([C@H]2C[N@H+](Cc3ccc4occc4c3)CCO2)c1 ZINC000564128713 1044344352 /nfs/dbraw/zinc/34/43/52/1044344352.db2.gz FGOGZMXTNQQSHA-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO Fc1cccc([C@H]2C[N@@H+](Cc3ccc4occc4c3)CCO2)c1 ZINC000564128713 1044344369 /nfs/dbraw/zinc/34/43/69/1044344369.db2.gz FGOGZMXTNQQSHA-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO Cc1ccc2c(Nc3cnccc3OC(F)F)cccc2[nH+]1 ZINC001212797002 1044350718 /nfs/dbraw/zinc/35/07/18/1044350718.db2.gz RVLFKHSILYHTKA-UHFFFAOYSA-N 1 2 301.296 4.283 20 0 DIADLO Cc1ccc2c(Nc3ccc(-n4ccnc4)cc3)cccc2[nH+]1 ZINC001212797057 1044355378 /nfs/dbraw/zinc/35/53/78/1044355378.db2.gz VUPHSMAQYWTEDC-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO CC(C)CCc1nc(C[NH2+][C@@H](C)c2cncc(F)c2)cs1 ZINC000361133163 1044364598 /nfs/dbraw/zinc/36/45/98/1044364598.db2.gz VKDAQPXJOJHJQP-LBPRGKRZSA-N 1 2 307.438 4.117 20 0 DIADLO Cc1ccc2c(Nc3ccc4c(cc[nH]c4=O)c3)cccc2[nH+]1 ZINC001212797658 1044368384 /nfs/dbraw/zinc/36/83/84/1044368384.db2.gz BXCPMVWDAHTNTD-UHFFFAOYSA-N 1 2 301.349 4.128 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cnc3ccccc3c2C)c(C)[nH+]1 ZINC000361173967 1044370545 /nfs/dbraw/zinc/37/05/45/1044370545.db2.gz PQNBZZPITDBDDV-UHFFFAOYSA-N 1 2 305.381 4.116 20 0 DIADLO Fc1ccc(F)c2c1OCC[C@H]2[NH2+]Cc1ccccc1Cl ZINC000361229386 1044378571 /nfs/dbraw/zinc/37/85/71/1044378571.db2.gz RDOXHHTYXHESEW-CQSZACIVSA-N 1 2 309.743 4.232 20 0 DIADLO Cc1ccc2c(Nc3ccc4c(c3)CCC(=O)N4)cccc2[nH+]1 ZINC001212797861 1044378762 /nfs/dbraw/zinc/37/87/62/1044378762.db2.gz OKGXGPFHMWQTHW-UHFFFAOYSA-N 1 2 303.365 4.172 20 0 DIADLO Clc1cccc(C2CC[NH+](Cc3c[nH]cn3)CC2)c1Cl ZINC000361239258 1044380997 /nfs/dbraw/zinc/38/09/97/1044380997.db2.gz TZLLZJKUMABMKY-UHFFFAOYSA-N 1 2 310.228 4.096 20 0 DIADLO Cc1nc(C[NH2+]C(C)(C)c2ccc(OCC(C)C)cc2)oc1C ZINC000107899823 1044383415 /nfs/dbraw/zinc/38/34/15/1044383415.db2.gz ZWQOCIFTPMKPDA-UHFFFAOYSA-N 1 2 316.445 4.351 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cncc(C(F)(F)F)c1 ZINC000361311006 1044389268 /nfs/dbraw/zinc/38/92/68/1044389268.db2.gz VVIVNYTVYURDBP-GFCCVEGCSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cncc(C(F)(F)F)c1 ZINC000361311006 1044389283 /nfs/dbraw/zinc/38/92/83/1044389283.db2.gz VVIVNYTVYURDBP-GFCCVEGCSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(CC2CC2)no1)c1cccc2ccccc21 ZINC000639561615 1044393659 /nfs/dbraw/zinc/39/36/59/1044393659.db2.gz OOKYUAWXSBFTCP-CYBMUJFWSA-N 1 2 307.397 4.026 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nc3cc(Cl)ccc3n2C)oc1C ZINC000282874197 1044394424 /nfs/dbraw/zinc/39/44/24/1044394424.db2.gz VHZSZJCZMPKUMP-LLVKDONJSA-N 1 2 317.820 4.287 20 0 DIADLO COc1cc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc(OC)c1 ZINC000192901979 1044398689 /nfs/dbraw/zinc/39/86/89/1044398689.db2.gz UIDGHKQRWCHTKC-AWEZNQCLSA-N 1 2 323.396 4.063 20 0 DIADLO Clc1cc([NH2+]CC[C@H]2CCOC2)ccc1N1CCCCC1 ZINC000783582463 1044408769 /nfs/dbraw/zinc/40/87/69/1044408769.db2.gz HWIDSCHVXFTQII-AWEZNQCLSA-N 1 2 308.853 4.169 20 0 DIADLO Cc1ccc([C@H](c2noc(C[C@H](C)n3cc[nH+]c3)n2)C(C)C)cc1 ZINC000565063107 1044413111 /nfs/dbraw/zinc/41/31/11/1044413111.db2.gz RKIGLIZPLUPFQH-MAUKXSAKSA-N 1 2 324.428 4.166 20 0 DIADLO C[C@H]([NH2+]Cc1ncccc1N(C)C)c1cc(Cl)ccc1Cl ZINC000565334315 1044426906 /nfs/dbraw/zinc/42/69/06/1044426906.db2.gz KRIQKLNCHHNKSA-NSHDSACASA-N 1 2 324.255 4.305 20 0 DIADLO Cc1cnc(CCN(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)s1 ZINC000301870830 1044428869 /nfs/dbraw/zinc/42/88/69/1044428869.db2.gz PJNXEKDLIKTHJX-UHFFFAOYSA-N 1 2 318.490 4.167 20 0 DIADLO COc1cc(C)[nH+]c(CNc2ccc(Oc3cccnc3)cc2)c1 ZINC000565383694 1044429439 /nfs/dbraw/zinc/42/94/39/1044429439.db2.gz CBSBAIMAWRXCNW-UHFFFAOYSA-N 1 2 321.380 4.198 20 0 DIADLO Fc1cccc(F)c1C[N@H+](Cc1ccc2c[nH]nc2c1)C1CC1 ZINC000361733484 1044435903 /nfs/dbraw/zinc/43/59/03/1044435903.db2.gz NRBXVXDXBQTSRG-UHFFFAOYSA-N 1 2 313.351 4.006 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](Cc1ccc2c[nH]nc2c1)C1CC1 ZINC000361733484 1044435911 /nfs/dbraw/zinc/43/59/11/1044435911.db2.gz NRBXVXDXBQTSRG-UHFFFAOYSA-N 1 2 313.351 4.006 20 0 DIADLO CCCN(CC1CCCCC1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000565569209 1044443429 /nfs/dbraw/zinc/44/34/29/1044443429.db2.gz YIOAZTRVSDVMOH-UHFFFAOYSA-N 1 2 314.433 4.159 20 0 DIADLO Cc1ccc2c(Nc3ccccc3C3OCCO3)cccc2[nH+]1 ZINC001212798755 1044451413 /nfs/dbraw/zinc/45/14/13/1044451413.db2.gz QSUDCYURWDDZLX-UHFFFAOYSA-N 1 2 306.365 4.332 20 0 DIADLO COc1ccccc1-c1ccc([C@H](C)[NH2+]Cc2ncccn2)cc1 ZINC000361859164 1044454264 /nfs/dbraw/zinc/45/42/64/1044454264.db2.gz APKXCFWFAJTJPH-HNNXBMFYSA-N 1 2 319.408 4.003 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+][C@H](C)c1csnn1 ZINC000565821115 1044459649 /nfs/dbraw/zinc/45/96/49/1044459649.db2.gz XEWCXOLGLCDYJA-IAQYHMDHSA-N 1 2 312.442 4.056 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+][C@@H](C)c1csnn1 ZINC000565821117 1044459744 /nfs/dbraw/zinc/45/97/44/1044459744.db2.gz XEWCXOLGLCDYJA-XHDPSFHLSA-N 1 2 312.442 4.056 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000565968872 1044467265 /nfs/dbraw/zinc/46/72/65/1044467265.db2.gz RYJDOPAOFFLMTC-BBRMVZONSA-N 1 2 314.454 4.158 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000565968872 1044467271 /nfs/dbraw/zinc/46/72/71/1044467271.db2.gz RYJDOPAOFFLMTC-BBRMVZONSA-N 1 2 314.454 4.158 20 0 DIADLO C[C@@H](c1ccc(C[N@H+](C)Cc2nccs2)cc1)C(F)(F)F ZINC000294945518 1044476966 /nfs/dbraw/zinc/47/69/66/1044476966.db2.gz KAFSOWABKGDGCV-NSHDSACASA-N 1 2 314.376 4.441 20 0 DIADLO C[C@@H](c1ccc(C[N@@H+](C)Cc2nccs2)cc1)C(F)(F)F ZINC000294945518 1044476971 /nfs/dbraw/zinc/47/69/71/1044476971.db2.gz KAFSOWABKGDGCV-NSHDSACASA-N 1 2 314.376 4.441 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000117346664 1044477530 /nfs/dbraw/zinc/47/75/30/1044477530.db2.gz RRAIKTAJQJDUIV-OAHLLOKOSA-N 1 2 319.836 4.403 20 0 DIADLO CCc1nnc(C[N@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000117346664 1044477539 /nfs/dbraw/zinc/47/75/39/1044477539.db2.gz RRAIKTAJQJDUIV-OAHLLOKOSA-N 1 2 319.836 4.403 20 0 DIADLO CC(C)c1nnc(C[NH2+]C(C)(C)c2cccc(Cl)c2)s1 ZINC000294988867 1044478131 /nfs/dbraw/zinc/47/81/31/1044478131.db2.gz MWOMBISWZIGAFO-UHFFFAOYSA-N 1 2 309.866 4.340 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1nccc2ccc(Cl)cc21 ZINC001161563145 1044479164 /nfs/dbraw/zinc/47/91/64/1044479164.db2.gz PMHKFNDLAPBCHP-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO C[C@@H](c1nnc(-c2cccs2)o1)[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000362178257 1044486041 /nfs/dbraw/zinc/48/60/41/1044486041.db2.gz BULFJOCPQFXIIF-GXTWGEPZSA-N 1 2 311.410 4.306 20 0 DIADLO C[C@@H](c1nnc(-c2cccs2)o1)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000362178257 1044486044 /nfs/dbraw/zinc/48/60/44/1044486044.db2.gz BULFJOCPQFXIIF-GXTWGEPZSA-N 1 2 311.410 4.306 20 0 DIADLO C[C@H](c1nnc(-c2cccs2)o1)[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000362178260 1044486207 /nfs/dbraw/zinc/48/62/07/1044486207.db2.gz BULFJOCPQFXIIF-TZMCWYRMSA-N 1 2 311.410 4.306 20 0 DIADLO C[C@H](c1nnc(-c2cccs2)o1)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000362178260 1044486213 /nfs/dbraw/zinc/48/62/13/1044486213.db2.gz BULFJOCPQFXIIF-TZMCWYRMSA-N 1 2 311.410 4.306 20 0 DIADLO Cc1cccc(NC(=O)C[N@@H+]([C@H](C)c2ccco2)C2CC2)c1C ZINC000119108497 1044489193 /nfs/dbraw/zinc/48/91/93/1044489193.db2.gz JDPJPNZPOZKQCC-OAHLLOKOSA-N 1 2 312.413 4.061 20 0 DIADLO Cc1cccc(NC(=O)C[N@H+]([C@H](C)c2ccco2)C2CC2)c1C ZINC000119108497 1044489201 /nfs/dbraw/zinc/48/92/01/1044489201.db2.gz JDPJPNZPOZKQCC-OAHLLOKOSA-N 1 2 312.413 4.061 20 0 DIADLO Clc1cccc(Cl)c1[C@H]([NH2+]Cc1cnns1)C1CC1 ZINC000295201583 1044499219 /nfs/dbraw/zinc/49/92/19/1044499219.db2.gz NJEBODQREPDKLD-CYBMUJFWSA-N 1 2 314.241 4.086 20 0 DIADLO Cc1ccncc1C[N@@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000475559142 1044502493 /nfs/dbraw/zinc/50/24/93/1044502493.db2.gz NKGVIYVXNOAPSZ-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1ccncc1C[N@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000475559142 1044502504 /nfs/dbraw/zinc/50/25/04/1044502504.db2.gz NKGVIYVXNOAPSZ-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+][C@@H](C)c2nc(C3CC3)no2)c1 ZINC000120239296 1044502647 /nfs/dbraw/zinc/50/26/47/1044502647.db2.gz ZXDKTVODCBHTPT-OLZOCXBDSA-N 1 2 315.417 4.146 20 0 DIADLO CC[C@@H](CC(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C)C(C)(C)C ZINC001625947105 1044502989 /nfs/dbraw/zinc/50/29/89/1044502989.db2.gz VTGJOFHMGNRIFP-HNNXBMFYSA-N 1 2 320.477 4.128 20 0 DIADLO c1n[nH]c([C@H]([NH2+]CC2CC(c3ccccc3)C2)C2CCCCC2)n1 ZINC000566685100 1044508062 /nfs/dbraw/zinc/50/80/62/1044508062.db2.gz JKYSGRUCFHGWBE-XUJQIHCRSA-N 1 2 324.472 4.210 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2nc(CC(C)C)no2)o1 ZINC000362432273 1044508893 /nfs/dbraw/zinc/50/88/93/1044508893.db2.gz YQNJCXMIAAOABX-HIFRSBDPSA-N 1 2 317.433 4.143 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2nc(CC(C)C)no2)o1 ZINC000362432273 1044508908 /nfs/dbraw/zinc/50/89/08/1044508908.db2.gz YQNJCXMIAAOABX-HIFRSBDPSA-N 1 2 317.433 4.143 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2ncccc2C)C(C)C)cs1 ZINC000120773489 1044513556 /nfs/dbraw/zinc/51/35/56/1044513556.db2.gz FNGJMTULPCNADO-INIZCTEOSA-N 1 2 303.475 4.286 20 0 DIADLO CCc1nc(C[NH+]2CCC(c3c(F)cccc3F)CC2)cs1 ZINC000362511920 1044522038 /nfs/dbraw/zinc/52/20/38/1044522038.db2.gz OQMQZFJPZJSFIB-UHFFFAOYSA-N 1 2 322.424 4.363 20 0 DIADLO CSC1(C[NH2+]c2ccc(N3CCSCC3)cc2C)CCC1 ZINC000566886759 1044526638 /nfs/dbraw/zinc/52/66/38/1044526638.db2.gz BZXRCHBPIWRQGA-UHFFFAOYSA-N 1 2 322.543 4.246 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1ccc(Cl)cn1)[C@@H]2C ZINC000566934325 1044527344 /nfs/dbraw/zinc/52/73/44/1044527344.db2.gz GDVZABWIVYNXNQ-CHWSQXEVSA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1ccc(Cl)cn1)[C@@H]2C ZINC000566934325 1044527360 /nfs/dbraw/zinc/52/73/60/1044527360.db2.gz GDVZABWIVYNXNQ-CHWSQXEVSA-N 1 2 316.832 4.251 20 0 DIADLO CC(C)CCc1noc(C[NH+]2CCC(c3ccsc3)CC2)n1 ZINC000362595717 1044536326 /nfs/dbraw/zinc/53/63/26/1044536326.db2.gz GKKZQVJLKCUQMH-UHFFFAOYSA-N 1 2 319.474 4.099 20 0 DIADLO Cc1cnccc1C[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000295586252 1044544468 /nfs/dbraw/zinc/54/44/68/1044544468.db2.gz DYPUZWMMOXVWRW-UHFFFAOYSA-N 1 2 307.224 4.476 20 0 DIADLO CCC(CC)(C(=O)Nc1ccn2cc[nH+]c2c1)c1ccccc1 ZINC000567186706 1044548589 /nfs/dbraw/zinc/54/85/89/1044548589.db2.gz AOGBTZOGLCDQPD-UHFFFAOYSA-N 1 2 307.397 4.031 20 0 DIADLO COc1c(F)cc(Nc2[nH+]cc(O)cc2C)cc1C(F)(F)F ZINC001214635273 1044549007 /nfs/dbraw/zinc/54/90/07/1044549007.db2.gz LWEFOQFYKBRBJK-UHFFFAOYSA-N 1 2 316.254 4.006 20 0 DIADLO C[N@H+](Cc1cc[nH]n1)Cc1cccc(SCc2ccccc2)c1 ZINC000567173548 1044548732 /nfs/dbraw/zinc/54/87/32/1044548732.db2.gz BXLHDIQVECQMDB-UHFFFAOYSA-N 1 2 323.465 4.334 20 0 DIADLO C[N@@H+](Cc1cc[nH]n1)Cc1cccc(SCc2ccccc2)c1 ZINC000567173548 1044548747 /nfs/dbraw/zinc/54/87/47/1044548747.db2.gz BXLHDIQVECQMDB-UHFFFAOYSA-N 1 2 323.465 4.334 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+]Cc1ncc(C)s1 ZINC000295727546 1044554648 /nfs/dbraw/zinc/55/46/48/1044554648.db2.gz NYLVXIIAPTYKJF-CYBMUJFWSA-N 1 2 304.459 4.227 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CCc3ccc(-c4ccccc4)cc3C2)o1 ZINC000295760866 1044556731 /nfs/dbraw/zinc/55/67/31/1044556731.db2.gz RNXCIBZHOFLSSI-CQSZACIVSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CCc3ccc(-c4ccccc4)cc3C2)o1 ZINC000295760866 1044556740 /nfs/dbraw/zinc/55/67/40/1044556740.db2.gz RNXCIBZHOFLSSI-CQSZACIVSA-N 1 2 319.408 4.164 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@H](CC)c2cccc(OC)n2)on1 ZINC000925156932 1044565637 /nfs/dbraw/zinc/56/56/37/1044565637.db2.gz PMNICIIHADOUBX-OAHLLOKOSA-N 1 2 317.433 4.223 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+]Cc2cc3cc(F)ccc3o2)[nH]1 ZINC000362932868 1044565879 /nfs/dbraw/zinc/56/58/79/1044565879.db2.gz ZGFDKDJCJWZUBQ-QWRGUYRKSA-N 1 2 316.380 4.054 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2nncn2-c2ccccc2)c(C)c1 ZINC000444591313 1044572106 /nfs/dbraw/zinc/57/21/06/1044572106.db2.gz NONCCNISVUKAGT-KRWDZBQOSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2nncn2-c2ccccc2)c(C)c1 ZINC000444591313 1044572119 /nfs/dbraw/zinc/57/21/19/1044572119.db2.gz NONCCNISVUKAGT-KRWDZBQOSA-N 1 2 320.440 4.077 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2Br)CCS1 ZINC000719414818 1044572843 /nfs/dbraw/zinc/57/28/43/1044572843.db2.gz KVVYJZXUEACUAT-SECBINFHSA-N 1 2 320.683 4.040 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2Br)CCS1 ZINC000719414818 1044572852 /nfs/dbraw/zinc/57/28/52/1044572852.db2.gz KVVYJZXUEACUAT-SECBINFHSA-N 1 2 320.683 4.040 20 0 DIADLO CCCCN(C(=O)C[C@H](C)n1cc[nH+]c1)[C@@H]1CCC[C@H](C)C1 ZINC000567593213 1044576234 /nfs/dbraw/zinc/57/62/34/1044576234.db2.gz UKLIUZPGNWHFQM-YESZJQIVSA-N 1 2 305.466 4.042 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1Br ZINC000295977027 1044578650 /nfs/dbraw/zinc/57/86/50/1044578650.db2.gz MZTJVOUWMXHJTM-NWDGAFQWSA-N 1 2 322.250 4.077 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CC[C@@H]3CCC[C@@H]3C2)c(C)[nH+]1 ZINC000567849576 1044588276 /nfs/dbraw/zinc/58/82/76/1044588276.db2.gz JQDWICVOOQNEMQ-ARFHVFGLSA-N 1 2 301.434 4.097 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]C(c1ccccc1)c1ccccc1 ZINC000296152553 1044594305 /nfs/dbraw/zinc/59/43/05/1044594305.db2.gz WVJSKTIUQLVTIV-INIZCTEOSA-N 1 2 305.425 4.343 20 0 DIADLO C[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)c2nccn21 ZINC000296186193 1044595780 /nfs/dbraw/zinc/59/57/80/1044595780.db2.gz YGHOSUYRCUKWGM-CCKFTAQKSA-N 1 2 321.399 4.407 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+](C)Cc2ccc(Br)cc2C)o1 ZINC000444719684 1044615812 /nfs/dbraw/zinc/61/58/12/1044615812.db2.gz ZTCAEKQAXPUJBM-GFCCVEGCSA-N 1 2 323.234 4.247 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+](C)Cc2ccc(Br)cc2C)o1 ZINC000444719684 1044615823 /nfs/dbraw/zinc/61/58/23/1044615823.db2.gz ZTCAEKQAXPUJBM-GFCCVEGCSA-N 1 2 323.234 4.247 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2ncccc2C(F)(F)F)c1 ZINC000444742834 1044617496 /nfs/dbraw/zinc/61/74/96/1044617496.db2.gz GRAACSPCOKKHON-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2ncccc2C(F)(F)F)c1 ZINC000444742834 1044617504 /nfs/dbraw/zinc/61/75/04/1044617504.db2.gz GRAACSPCOKKHON-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO CCn1nc(C[NH2+]Cc2cscc2Cl)c2ccccc21 ZINC000886199106 1044624362 /nfs/dbraw/zinc/62/43/62/1044624362.db2.gz KTRHORQKCRZQQS-UHFFFAOYSA-N 1 2 305.834 4.061 20 0 DIADLO CCCc1ccc([C@@H](C)[NH2+]Cc2ncc(C(F)(F)F)cn2)cc1 ZINC000296539975 1044625063 /nfs/dbraw/zinc/62/50/63/1044625063.db2.gz QWSVMIKNRJRBAX-GFCCVEGCSA-N 1 2 323.362 4.299 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)nn1C ZINC000282954487 1044628550 /nfs/dbraw/zinc/62/85/50/1044628550.db2.gz ZITZOHUASVMBQQ-LLVKDONJSA-N 1 2 324.255 4.375 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+]Cc3cc(C4CC4)no3)o2)cc1 ZINC000886272318 1044628823 /nfs/dbraw/zinc/62/88/23/1044628823.db2.gz MWUIEPPLTKYUDM-UHFFFAOYSA-N 1 2 308.381 4.410 20 0 DIADLO CC1(C)C[NH+](Cc2ccc3cccc(Cl)c3n2)CC(C)(C)O1 ZINC001137228881 1044640275 /nfs/dbraw/zinc/64/02/75/1044640275.db2.gz VOZPIWPEXJELDU-UHFFFAOYSA-N 1 2 318.848 4.278 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3cccc(F)c3)c2)[nH+]c1C ZINC000363626890 1044640375 /nfs/dbraw/zinc/64/03/75/1044640375.db2.gz GTYSIFPABSPAPU-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO C/C(=C\c1ccc(Cl)cc1)C(=O)NCc1c[nH+]c(C)cc1C ZINC001275917177 1044669163 /nfs/dbraw/zinc/66/91/63/1044669163.db2.gz HLMWHAIFIIHGPJ-UKTHLTGXSA-N 1 2 314.816 4.072 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000364649575 1044673382 /nfs/dbraw/zinc/67/33/82/1044673382.db2.gz UNYPYSLOMFWFHJ-GOSISDBHSA-N 1 2 305.466 4.043 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(C2CC2)c1)c1noc(-c2ccccc2)n1 ZINC000569210725 1044683591 /nfs/dbraw/zinc/68/35/91/1044683591.db2.gz ZDJOQIHKOYRBLB-CQSZACIVSA-N 1 2 319.408 4.465 20 0 DIADLO CCC[C@@H](CC1CCCC1)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000365284015 1044684692 /nfs/dbraw/zinc/68/46/92/1044684692.db2.gz SLJHWGLQKIUETC-KRWDZBQOSA-N 1 2 317.477 4.043 20 0 DIADLO C[C@@H](CC(C)(C)C)C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000475623149 1044685034 /nfs/dbraw/zinc/68/50/34/1044685034.db2.gz JZUQIZWLWWQVBI-ZDUSSCGKSA-N 1 2 323.506 4.140 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000365343631 1044686239 /nfs/dbraw/zinc/68/62/39/1044686239.db2.gz LMPTWIMTDWMGMR-DLBZAZTESA-N 1 2 305.466 4.043 20 0 DIADLO CCCCOCC[N@@H+]1CCc2c(Cl)c(Cl)ccc2C1 ZINC000523898095 1044701445 /nfs/dbraw/zinc/70/14/45/1044701445.db2.gz RNRHZFMKFCNUQQ-UHFFFAOYSA-N 1 2 302.245 4.168 20 0 DIADLO CCCCOCC[N@H+]1CCc2c(Cl)c(Cl)ccc2C1 ZINC000523898095 1044701462 /nfs/dbraw/zinc/70/14/62/1044701462.db2.gz RNRHZFMKFCNUQQ-UHFFFAOYSA-N 1 2 302.245 4.168 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1cncc(F)c1 ZINC000366263611 1044717266 /nfs/dbraw/zinc/71/72/66/1044717266.db2.gz ASLWYZNARJJXLK-AUUYWEPGSA-N 1 2 307.372 4.056 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@H](C)c2cncc(F)c2)c2ccccn2)cc1 ZINC000366435285 1044719066 /nfs/dbraw/zinc/71/90/66/1044719066.db2.gz WPJLTVQLDMJGOU-FOIQADDNSA-N 1 2 321.399 4.364 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2cccc(SC(F)(F)F)c2)o1 ZINC000886929859 1044719414 /nfs/dbraw/zinc/71/94/14/1044719414.db2.gz IZMISRPEUPTXBT-JTQLQIEISA-N 1 2 316.348 4.446 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2F)c1nc(-c2ccccc2)no1 ZINC000886925089 1044720813 /nfs/dbraw/zinc/72/08/13/1044720813.db2.gz DZDAKVSTCNWRRZ-SJKOYZFVSA-N 1 2 323.371 4.214 20 0 DIADLO CCc1oc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)cc1C ZINC000366539808 1044722515 /nfs/dbraw/zinc/72/25/15/1044722515.db2.gz COAKEFYLJPAZRV-UHFFFAOYSA-N 1 2 309.369 4.101 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+][C@H]2CCOc3ccc(F)cc32)s1 ZINC000366732026 1044726229 /nfs/dbraw/zinc/72/62/29/1044726229.db2.gz VFFIGQIAHSDZEN-ZDUSSCGKSA-N 1 2 320.433 4.193 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cc(C(F)(F)F)c1 ZINC000356056714 1044734434 /nfs/dbraw/zinc/73/44/34/1044734434.db2.gz MZVXUYLIVILQTH-HNNXBMFYSA-N 1 2 310.319 4.076 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)cc(C(F)(F)F)c1 ZINC000356056714 1044734448 /nfs/dbraw/zinc/73/44/48/1044734448.db2.gz MZVXUYLIVILQTH-HNNXBMFYSA-N 1 2 310.319 4.076 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cc(C(F)(F)F)c1 ZINC000356056719 1044735667 /nfs/dbraw/zinc/73/56/67/1044735667.db2.gz MZVXUYLIVILQTH-OAHLLOKOSA-N 1 2 310.319 4.076 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)cc(C(F)(F)F)c1 ZINC000356056719 1044735680 /nfs/dbraw/zinc/73/56/80/1044735680.db2.gz MZVXUYLIVILQTH-OAHLLOKOSA-N 1 2 310.319 4.076 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H]2CCCOc3c(Cl)cccc32)no1 ZINC000367381716 1044738958 /nfs/dbraw/zinc/73/89/58/1044738958.db2.gz LSSQODVVFYCUIN-BXUZGUMPSA-N 1 2 306.793 4.201 20 0 DIADLO Cc1cn2cc(NC(=O)N[C@H](C)c3cc(C)cc(C)c3)ccc2[nH+]1 ZINC000524129990 1044741351 /nfs/dbraw/zinc/74/13/51/1044741351.db2.gz AFBCWPWOTULVMN-OAHLLOKOSA-N 1 2 322.412 4.142 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@H](c1cccs1)c1ccc(Cl)cc1 ZINC000368059270 1044765665 /nfs/dbraw/zinc/76/56/65/1044765665.db2.gz YCOMQXSUFSZSFV-INIZCTEOSA-N 1 2 317.845 4.312 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@H](c1cccs1)c1ccc(Cl)cc1 ZINC000368059270 1044765679 /nfs/dbraw/zinc/76/56/79/1044765679.db2.gz YCOMQXSUFSZSFV-INIZCTEOSA-N 1 2 317.845 4.312 20 0 DIADLO Clc1cccnc1SCc1c[nH+]cn1Cc1ccccc1 ZINC000445596186 1044770713 /nfs/dbraw/zinc/77/07/13/1044770713.db2.gz GAOOGLLGGDATBL-UHFFFAOYSA-N 1 2 315.829 4.272 20 0 DIADLO Cc1ccc(NC(=O)Nc2cccc(Cn3cc[nH+]c3)c2)c(C)c1 ZINC001202747477 1044782363 /nfs/dbraw/zinc/78/23/63/1044782363.db2.gz UESLYQOCFIHPDG-UHFFFAOYSA-N 1 2 320.396 4.192 20 0 DIADLO Cc1cscc1-c1noc(CCc2[nH]c3c(cccc3C)[nH+]2)n1 ZINC000445635280 1044782987 /nfs/dbraw/zinc/78/29/87/1044782987.db2.gz DJWRODWUCUAUMI-UHFFFAOYSA-N 1 2 324.409 4.076 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000570838907 1044785861 /nfs/dbraw/zinc/78/58/61/1044785861.db2.gz FYWWUSNVSXZFOU-LSDHHAIUSA-N 1 2 312.413 4.046 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000570838907 1044785867 /nfs/dbraw/zinc/78/58/67/1044785867.db2.gz FYWWUSNVSXZFOU-LSDHHAIUSA-N 1 2 312.413 4.046 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@H+]1CCc2ncsc2C1 ZINC000445851550 1044832140 /nfs/dbraw/zinc/83/21/40/1044832140.db2.gz GSEHTLAZZRPTGE-JTQLQIEISA-N 1 2 323.259 4.025 20 0 DIADLO CCc1noc(C)c1C[NH2+][C@H](c1ccc(C)cc1)c1ccccn1 ZINC000369290775 1044800100 /nfs/dbraw/zinc/80/01/00/1044800100.db2.gz RBJVSCJOFMMOAM-HXUWFJFHSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1ncc(C[NH2+][C@@H](c2ccc(C)cc2)c2ccccn2)s1 ZINC000369320096 1044804994 /nfs/dbraw/zinc/80/49/94/1044804994.db2.gz UWJAYXVPLJQBAW-SFHVURJKSA-N 1 2 309.438 4.034 20 0 DIADLO C[C@@H]1c2ccccc2C[N@H+]1Cc1cncn1Cc1ccccc1 ZINC000445756345 1044808315 /nfs/dbraw/zinc/80/83/15/1044808315.db2.gz DMLXSTBCYNWTJF-MRXNPFEDSA-N 1 2 303.409 4.008 20 0 DIADLO C[C@@H]1c2ccccc2C[N@@H+]1Cc1cncn1Cc1ccccc1 ZINC000445756345 1044808335 /nfs/dbraw/zinc/80/83/35/1044808335.db2.gz DMLXSTBCYNWTJF-MRXNPFEDSA-N 1 2 303.409 4.008 20 0 DIADLO CC(C)c1ccc([C@@H]2CCC[N@@H+]2Cc2nc(C3CC3)nn2C)cc1 ZINC000571518915 1044817406 /nfs/dbraw/zinc/81/74/06/1044817406.db2.gz CUDRPOOKOKMOOF-SFHVURJKSA-N 1 2 324.472 4.153 20 0 DIADLO CC(C)c1ccc([C@@H]2CCC[N@H+]2Cc2nc(C3CC3)nn2C)cc1 ZINC000571518915 1044817429 /nfs/dbraw/zinc/81/74/29/1044817429.db2.gz CUDRPOOKOKMOOF-SFHVURJKSA-N 1 2 324.472 4.153 20 0 DIADLO C[C@@H](Cc1noc([C@H](c2ccccc2)[NH+](C)C)n1)c1ccccc1 ZINC000571840271 1044828077 /nfs/dbraw/zinc/82/80/77/1044828077.db2.gz RNLUOIKBELQROT-KXBFYZLASA-N 1 2 321.424 4.067 20 0 DIADLO FC(F)C[C@H]1COCC[N@@H+]1Cc1cc(-c2ccccc2)cs1 ZINC000571842176 1044829293 /nfs/dbraw/zinc/82/92/93/1044829293.db2.gz PWTYVACMVUQDFA-HNNXBMFYSA-N 1 2 323.408 4.271 20 0 DIADLO FC(F)C[C@H]1COCC[N@H+]1Cc1cc(-c2ccccc2)cs1 ZINC000571842176 1044829317 /nfs/dbraw/zinc/82/93/17/1044829317.db2.gz PWTYVACMVUQDFA-HNNXBMFYSA-N 1 2 323.408 4.271 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@@H+]1CCc2ncsc2C1 ZINC000445851550 1044832115 /nfs/dbraw/zinc/83/21/15/1044832115.db2.gz GSEHTLAZZRPTGE-JTQLQIEISA-N 1 2 323.259 4.025 20 0 DIADLO CC(C)(C)c1noc(C[NH2+]C(C)(C)c2ccc(Cl)cc2)n1 ZINC000264068250 1044848494 /nfs/dbraw/zinc/84/84/94/1044848494.db2.gz AMBHVQLXUJYPGN-UHFFFAOYSA-N 1 2 307.825 4.045 20 0 DIADLO CC[N@H+](Cc1nccn1C(C)C)[C@@H](C)c1cccc(OC)c1 ZINC000264204141 1044856456 /nfs/dbraw/zinc/85/64/56/1044856456.db2.gz KDASBCSPKUGRSG-HNNXBMFYSA-N 1 2 301.434 4.056 20 0 DIADLO CC[N@@H+](Cc1nccn1C(C)C)[C@@H](C)c1cccc(OC)c1 ZINC000264204141 1044856477 /nfs/dbraw/zinc/85/64/77/1044856477.db2.gz KDASBCSPKUGRSG-HNNXBMFYSA-N 1 2 301.434 4.056 20 0 DIADLO CC[N@H+](Cc1nccn1C(C)C)[C@H](C)c1cccc(OC)c1 ZINC000264204142 1044858066 /nfs/dbraw/zinc/85/80/66/1044858066.db2.gz KDASBCSPKUGRSG-OAHLLOKOSA-N 1 2 301.434 4.056 20 0 DIADLO CC[N@@H+](Cc1nccn1C(C)C)[C@H](C)c1cccc(OC)c1 ZINC000264204142 1044858087 /nfs/dbraw/zinc/85/80/87/1044858087.db2.gz KDASBCSPKUGRSG-OAHLLOKOSA-N 1 2 301.434 4.056 20 0 DIADLO CC(C)Sc1ccc(Cl)cc1NC(=O)CCn1cc[nH+]c1 ZINC000264229038 1044860016 /nfs/dbraw/zinc/86/00/16/1044860016.db2.gz LTDLYSCJMNUCJG-UHFFFAOYSA-N 1 2 323.849 4.066 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)no1 ZINC000572666376 1044869529 /nfs/dbraw/zinc/86/95/29/1044869529.db2.gz FIXIIUCQBDBALQ-LLVKDONJSA-N 1 2 304.356 4.135 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)no1 ZINC000572666376 1044869544 /nfs/dbraw/zinc/86/95/44/1044869544.db2.gz FIXIIUCQBDBALQ-LLVKDONJSA-N 1 2 304.356 4.135 20 0 DIADLO O=C(c1cccs1)C1CC[NH+](Cc2cc(F)cc(F)c2)CC1 ZINC000371420720 1044876843 /nfs/dbraw/zinc/87/68/43/1044876843.db2.gz DEOWXHUUTDZJFO-UHFFFAOYSA-N 1 2 321.392 4.121 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2nc(CCC(C)C)no2)c1 ZINC000524595492 1044881462 /nfs/dbraw/zinc/88/14/62/1044881462.db2.gz MROJLOVJRGJDCD-INIZCTEOSA-N 1 2 315.461 4.468 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2nc(CCC(C)C)no2)c1 ZINC000524595492 1044881478 /nfs/dbraw/zinc/88/14/78/1044881478.db2.gz MROJLOVJRGJDCD-INIZCTEOSA-N 1 2 315.461 4.468 20 0 DIADLO CCc1cc(C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)on1 ZINC000524638674 1044893220 /nfs/dbraw/zinc/89/32/20/1044893220.db2.gz USJSCGWSFHFAHD-UHFFFAOYSA-N 1 2 318.323 4.065 20 0 DIADLO COc1cccc2cc([C@@H](C)[NH2+][C@@H](C)c3cscn3)oc21 ZINC000573466732 1044909389 /nfs/dbraw/zinc/90/93/89/1044909389.db2.gz CLYGBOSYNDLNPC-WDEREUQCSA-N 1 2 302.399 4.310 20 0 DIADLO CC(C)CC[C@@H]1CCC[C@H]1Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000573764183 1044921093 /nfs/dbraw/zinc/92/10/93/1044921093.db2.gz UYUXNYJYXOQOQC-ZWKOTPCHSA-N 1 2 312.461 4.343 20 0 DIADLO CC(C)CC[C@H]1CCC[C@@H]1Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000573764180 1044922140 /nfs/dbraw/zinc/92/21/40/1044922140.db2.gz UYUXNYJYXOQOQC-MSOLQXFVSA-N 1 2 312.461 4.343 20 0 DIADLO C[C@@H]1CCC[C@H](c2noc(-c3cccc(Cn4cc[nH+]c4)c3)n2)C1 ZINC000573841860 1044926133 /nfs/dbraw/zinc/92/61/33/1044926133.db2.gz PRDCDOBFZMUDMD-ZBFHGGJFSA-N 1 2 322.412 4.275 20 0 DIADLO C[C@@H](c1ccccc1Cl)N(C)Cc1cn2c([nH+]1)CCCC2 ZINC000372995200 1044934224 /nfs/dbraw/zinc/93/42/24/1044934224.db2.gz APGIGGLWURHYIX-ZDUSSCGKSA-N 1 2 303.837 4.066 20 0 DIADLO CC[N@H+](Cc1ccccc1)Cc1cc(O)ccc1Br ZINC001138142138 1044941599 /nfs/dbraw/zinc/94/15/99/1044941599.db2.gz LZNADXOLPWAGCA-UHFFFAOYSA-N 1 2 320.230 4.177 20 0 DIADLO CC[N@@H+](Cc1ccccc1)Cc1cc(O)ccc1Br ZINC001138142138 1044941609 /nfs/dbraw/zinc/94/16/09/1044941609.db2.gz LZNADXOLPWAGCA-UHFFFAOYSA-N 1 2 320.230 4.177 20 0 DIADLO CC(C)CO[C@H]1CCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000575011961 1044984352 /nfs/dbraw/zinc/98/43/52/1044984352.db2.gz WORSDNLGCNMHIZ-ZDUSSCGKSA-N 1 2 304.821 4.140 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC[C@]3(CCSC3)C2)c1 ZINC000575042581 1044984490 /nfs/dbraw/zinc/98/44/90/1044984490.db2.gz NXJQUBWXEXOCBA-KRWDZBQOSA-N 1 2 302.418 4.097 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@H+](C)Cc1nccs1 ZINC000137804533 1044995663 /nfs/dbraw/zinc/99/56/63/1044995663.db2.gz PVAQDTAELYFOHE-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@@H+](C)Cc1nccs1 ZINC000137804533 1044995672 /nfs/dbraw/zinc/99/56/72/1044995672.db2.gz PVAQDTAELYFOHE-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+]Cc1ccc(-c2cc[nH]n2)o1 ZINC000575241744 1044992814 /nfs/dbraw/zinc/99/28/14/1044992814.db2.gz UPIORUBUBLJAFE-UHFFFAOYSA-N 1 2 322.195 4.266 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cc(-c3ccc(F)cc3)no2)s1 ZINC000348501375 1045000656 /nfs/dbraw/zinc/00/06/56/1045000656.db2.gz YXZOZUVYGKYTBF-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1ccc(F)cc1C ZINC000373703167 1045002585 /nfs/dbraw/zinc/00/25/85/1045002585.db2.gz SWOMPSPXAGEIER-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO C[N@H+](C/C=C/c1ccccc1)Cc1nccn1Cc1ccccc1 ZINC000525274261 1045021576 /nfs/dbraw/zinc/02/15/76/1045021576.db2.gz HBUVINVUJRSTEE-MDWZMJQESA-N 1 2 317.436 4.077 20 0 DIADLO C[N@@H+](C/C=C/c1ccccc1)Cc1nccn1Cc1ccccc1 ZINC000525274261 1045021591 /nfs/dbraw/zinc/02/15/91/1045021591.db2.gz HBUVINVUJRSTEE-MDWZMJQESA-N 1 2 317.436 4.077 20 0 DIADLO CCC1(CC)C[N@@H+](Cc2cnc(C(F)(F)F)s2)CCS1 ZINC000446752423 1045030020 /nfs/dbraw/zinc/03/00/20/1045030020.db2.gz OOXLWSTYTIZUHK-UHFFFAOYSA-N 1 2 324.437 4.270 20 0 DIADLO CCC1(CC)C[N@H+](Cc2cnc(C(F)(F)F)s2)CCS1 ZINC000446752423 1045030005 /nfs/dbraw/zinc/03/00/05/1045030005.db2.gz OOXLWSTYTIZUHK-UHFFFAOYSA-N 1 2 324.437 4.270 20 0 DIADLO CC[N@H+](CCc1ccccc1)Cc1noc(C2CCCCC2)n1 ZINC000446767632 1045032940 /nfs/dbraw/zinc/03/29/40/1045032940.db2.gz LHWMLKAOGKCYIA-UHFFFAOYSA-N 1 2 313.445 4.182 20 0 DIADLO CC[N@@H+](CCc1ccccc1)Cc1noc(C2CCCCC2)n1 ZINC000446767632 1045032956 /nfs/dbraw/zinc/03/29/56/1045032956.db2.gz LHWMLKAOGKCYIA-UHFFFAOYSA-N 1 2 313.445 4.182 20 0 DIADLO C(=C/C1CCCC1)\c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000576159282 1045038745 /nfs/dbraw/zinc/03/87/45/1045038745.db2.gz SCXGMSOQNVMKMG-CMDGGOBGSA-N 1 2 320.396 4.185 20 0 DIADLO COC(=O)c1sccc1C[N@@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000446779877 1045040250 /nfs/dbraw/zinc/04/02/50/1045040250.db2.gz DDXACYXTDIZSJI-OCCSQVGLSA-N 1 2 319.426 4.101 20 0 DIADLO COC(=O)c1sccc1C[N@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000446779877 1045040264 /nfs/dbraw/zinc/04/02/64/1045040264.db2.gz DDXACYXTDIZSJI-OCCSQVGLSA-N 1 2 319.426 4.101 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3o2)cn1 ZINC000374284117 1045043339 /nfs/dbraw/zinc/04/33/39/1045043339.db2.gz ROZBCFJXYYTRFA-KRWDZBQOSA-N 1 2 324.428 4.332 20 0 DIADLO CC(C)n1cc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3o2)cn1 ZINC000374284117 1045043349 /nfs/dbraw/zinc/04/33/49/1045043349.db2.gz ROZBCFJXYYTRFA-KRWDZBQOSA-N 1 2 324.428 4.332 20 0 DIADLO CCC(CC)n1ccc(C[N@H+](C)Cc2ccc(OC)c(C)c2)n1 ZINC000446838855 1045051733 /nfs/dbraw/zinc/05/17/33/1045051733.db2.gz MUEIOOIQLCEGNA-UHFFFAOYSA-N 1 2 315.461 4.193 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+](C)Cc2ccc(OC)c(C)c2)n1 ZINC000446838855 1045051744 /nfs/dbraw/zinc/05/17/44/1045051744.db2.gz MUEIOOIQLCEGNA-UHFFFAOYSA-N 1 2 315.461 4.193 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2)N(c2cc(N3CCCCC3)[nH+]cn2)C1 ZINC000576538502 1045064313 /nfs/dbraw/zinc/06/43/13/1045064313.db2.gz JRTNLJVXQHOBJZ-SJLPKXTDSA-N 1 2 322.456 4.054 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2)N(c2cc(N3CCCCC3)nc[nH+]2)C1 ZINC000576538502 1045064319 /nfs/dbraw/zinc/06/43/19/1045064319.db2.gz JRTNLJVXQHOBJZ-SJLPKXTDSA-N 1 2 322.456 4.054 20 0 DIADLO CCCc1nc(C)c(C[N@H+](C)Cc2cc(Cl)ccc2OC)o1 ZINC000428462758 1045080290 /nfs/dbraw/zinc/08/02/90/1045080290.db2.gz MESKTWXVEIWPSX-UHFFFAOYSA-N 1 2 322.836 4.230 20 0 DIADLO CCCc1nc(C)c(C[N@@H+](C)Cc2cc(Cl)ccc2OC)o1 ZINC000428462758 1045080302 /nfs/dbraw/zinc/08/03/02/1045080302.db2.gz MESKTWXVEIWPSX-UHFFFAOYSA-N 1 2 322.836 4.230 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(Cl)cc(O)cc2Cl)CCC1(F)F ZINC001142105665 1045081301 /nfs/dbraw/zinc/08/13/01/1045081301.db2.gz JJKMKEYVVBBKGW-QMMMGPOBSA-N 1 2 310.171 4.176 20 0 DIADLO CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000576866910 1045085577 /nfs/dbraw/zinc/08/55/77/1045085577.db2.gz HFGPGZZTIOKRRV-GOSISDBHSA-N 1 2 322.412 4.195 20 0 DIADLO CC(C)(C)C(C)(C)c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000576963174 1045089554 /nfs/dbraw/zinc/08/95/54/1045089554.db2.gz WPWJJKRCBWREMV-UHFFFAOYSA-N 1 2 310.401 4.246 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)cn1 ZINC000428472117 1045108110 /nfs/dbraw/zinc/10/81/10/1045108110.db2.gz FNAJJOPQWCQLQO-CZUORRHYSA-N 1 2 324.453 4.293 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)cn1 ZINC000428472117 1045108112 /nfs/dbraw/zinc/10/81/12/1045108112.db2.gz FNAJJOPQWCQLQO-CZUORRHYSA-N 1 2 324.453 4.293 20 0 DIADLO CSc1ccc(F)cc1C[NH2+][C@H]1CCCc2oc(C)nc21 ZINC000925193488 1045111158 /nfs/dbraw/zinc/11/11/58/1045111158.db2.gz YTVPSVJMDUZAHT-ZDUSSCGKSA-N 1 2 306.406 4.011 20 0 DIADLO COCC[N@H+](Cc1nc(C(C)(C)C)cs1)Cc1ccccc1 ZINC000447293645 1045115894 /nfs/dbraw/zinc/11/58/94/1045115894.db2.gz WXQKRLWGTKHVLT-UHFFFAOYSA-N 1 2 318.486 4.089 20 0 DIADLO COCC[N@@H+](Cc1nc(C(C)(C)C)cs1)Cc1ccccc1 ZINC000447293645 1045115899 /nfs/dbraw/zinc/11/58/99/1045115899.db2.gz WXQKRLWGTKHVLT-UHFFFAOYSA-N 1 2 318.486 4.089 20 0 DIADLO c1ccc(N2Cc3cccc(N[C@H]4CC[C@H]4C4CC4)c3C2)[nH+]c1 ZINC000577525936 1045133445 /nfs/dbraw/zinc/13/34/45/1045133445.db2.gz WZVHKHMAYLRHFT-LPHOPBHVSA-N 1 2 305.425 4.202 20 0 DIADLO Cc1ccccc1[C@H](C)c1noc([C@@H](CC(C)C)n2cc[nH+]c2)n1 ZINC000923955723 1045144599 /nfs/dbraw/zinc/14/45/99/1045144599.db2.gz INLHLTAZMJZBGS-DOTOQJQBSA-N 1 2 324.428 4.362 20 0 DIADLO FC1(C[N@@H+]2CCC[C@H]2c2ccc(Br)s2)CC1 ZINC000525992065 1045145238 /nfs/dbraw/zinc/14/52/38/1045145238.db2.gz HMSFDHVZQHYOOA-VIFPVBQESA-N 1 2 304.228 4.150 20 0 DIADLO FC1(C[N@H+]2CCC[C@H]2c2ccc(Br)s2)CC1 ZINC000525992065 1045145245 /nfs/dbraw/zinc/14/52/45/1045145245.db2.gz HMSFDHVZQHYOOA-VIFPVBQESA-N 1 2 304.228 4.150 20 0 DIADLO CC(C)C[C@@H](c1nc(-c2occc2C(C)C)no1)n1cc[nH+]c1 ZINC000924079667 1045148304 /nfs/dbraw/zinc/14/83/04/1045148304.db2.gz VAVQKKHDPHJQOR-AWEZNQCLSA-N 1 2 314.389 4.285 20 0 DIADLO CC(C)(C)C1=CC[N@H+](Cc2cnc(C(F)(F)F)s2)CC1 ZINC000447725894 1045168085 /nfs/dbraw/zinc/16/80/85/1045168085.db2.gz CQIFANMOQQSGLF-UHFFFAOYSA-N 1 2 304.381 4.340 20 0 DIADLO CC(C)(C)C1=CC[N@@H+](Cc2cnc(C(F)(F)F)s2)CC1 ZINC000447725894 1045168089 /nfs/dbraw/zinc/16/80/89/1045168089.db2.gz CQIFANMOQQSGLF-UHFFFAOYSA-N 1 2 304.381 4.340 20 0 DIADLO FC(F)(F)c1ncc(C[N@H+](Cc2ccccc2)C2CC2)s1 ZINC000447721857 1045170290 /nfs/dbraw/zinc/17/02/90/1045170290.db2.gz HNPSVNINCYYLJM-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO FC(F)(F)c1ncc(C[N@@H+](Cc2ccccc2)C2CC2)s1 ZINC000447721857 1045170301 /nfs/dbraw/zinc/17/03/01/1045170301.db2.gz HNPSVNINCYYLJM-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO COC(=O)c1ccc(NCc2c[nH+]cn2C(C)C)c2ccccc12 ZINC000601064491 1045183514 /nfs/dbraw/zinc/18/35/14/1045183514.db2.gz NYPWUFNKTSFUCI-UHFFFAOYSA-N 1 2 323.396 4.016 20 0 DIADLO CCCCn1cc(C[NH2+]Cc2ncc(C(C)(C)C)s2)c(C)n1 ZINC000447897085 1045188245 /nfs/dbraw/zinc/18/82/45/1045188245.db2.gz MFVJGKRYEYNXHE-UHFFFAOYSA-N 1 2 320.506 4.035 20 0 DIADLO CCC[C@H]([NH2+]Cc1cccc2c1OCO2)c1ncccc1Cl ZINC000924732953 1045194279 /nfs/dbraw/zinc/19/42/79/1045194279.db2.gz BRABEOQYPNDSJV-AWEZNQCLSA-N 1 2 318.804 4.095 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cccc(OC)n1 ZINC000924721070 1045195316 /nfs/dbraw/zinc/19/53/16/1045195316.db2.gz NFEFFNZTQWLJMH-SMDDNHRTSA-N 1 2 306.356 4.170 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@@H]1CCSc2ccc(F)cc21 ZINC000924808377 1045199763 /nfs/dbraw/zinc/19/97/63/1045199763.db2.gz BNICEVBDTNCDII-KGLIPLIRSA-N 1 2 318.417 4.326 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@@H]1CCSc2ccc(F)cc21 ZINC000924808379 1045200453 /nfs/dbraw/zinc/20/04/53/1045200453.db2.gz BNICEVBDTNCDII-ZIAGYGMSSA-N 1 2 318.417 4.326 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H](C)c2ncco2)ccc1OCC(C)C ZINC000924815415 1045201397 /nfs/dbraw/zinc/20/13/97/1045201397.db2.gz QEDQDGGBYWZXRH-ZIAGYGMSSA-N 1 2 318.417 4.130 20 0 DIADLO CC[C@H]([NH2+][C@H](c1nccn1C)c1ccccc1)c1cccc(F)c1 ZINC000527348636 1045216572 /nfs/dbraw/zinc/21/65/72/1045216572.db2.gz LDGAGQWHOYSGDN-OALUTQOASA-N 1 2 323.415 4.390 20 0 DIADLO CC[C@@H]([NH2+][C@H](c1nccn1C)c1ccccc1)c1cccc(F)c1 ZINC000527348635 1045216958 /nfs/dbraw/zinc/21/69/58/1045216958.db2.gz LDGAGQWHOYSGDN-MOPGFXCFSA-N 1 2 323.415 4.390 20 0 DIADLO COc1ccc2oc([C@H](C)[NH2+][C@H](C)c3ncco3)c(C)c2c1 ZINC000924985871 1045217662 /nfs/dbraw/zinc/21/76/62/1045217662.db2.gz GGFFUIPQZDCCCX-NWDGAFQWSA-N 1 2 300.358 4.150 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccnn2CC2CCC2)cs1 ZINC000925034044 1045221321 /nfs/dbraw/zinc/22/13/21/1045221321.db2.gz POOHUINCOGEVIT-STQMWFEESA-N 1 2 318.490 4.114 20 0 DIADLO CCCCCC(CCCCC)NC(=O)[C@H]1CCn2c[nH+]cc2C1 ZINC000779057070 1045224030 /nfs/dbraw/zinc/22/40/30/1045224030.db2.gz DKHAOGKWGYPKHP-INIZCTEOSA-N 1 2 319.493 4.091 20 0 DIADLO Clc1cccc2c1[C@@H]([NH2+][C@@H]1CSc3ccccc31)COC2 ZINC000925091869 1045226329 /nfs/dbraw/zinc/22/63/29/1045226329.db2.gz DCAYMEVYEHLYFW-LSDHHAIUSA-N 1 2 317.841 4.348 20 0 DIADLO CCc1cc(C[NH2+][C@@H](c2ccc(CC)cc2)c2cccnc2)on1 ZINC000925129594 1045229410 /nfs/dbraw/zinc/22/94/10/1045229410.db2.gz PULXJFFFCWCQSJ-FQEVSTJZSA-N 1 2 321.424 4.074 20 0 DIADLO CCc1nc(C[NH+]2CCC(c3cccc(F)c3F)CC2)cs1 ZINC000578293274 1045229562 /nfs/dbraw/zinc/22/95/62/1045229562.db2.gz OAMILVIQZVJIDL-UHFFFAOYSA-N 1 2 322.424 4.363 20 0 DIADLO CC1(C)C[N@H+](Cc2cscc2C(F)(F)F)[C@H]1[C@H]1CCCO1 ZINC000578288033 1045229711 /nfs/dbraw/zinc/22/97/11/1045229711.db2.gz HOJISHKJVXSMOE-OLZOCXBDSA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2cscc2C(F)(F)F)[C@H]1[C@H]1CCCO1 ZINC000578288033 1045229721 /nfs/dbraw/zinc/22/97/21/1045229721.db2.gz HOJISHKJVXSMOE-OLZOCXBDSA-N 1 2 319.392 4.156 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@H]2CCc3c2nccc3Cl)on1 ZINC000925157233 1045230608 /nfs/dbraw/zinc/23/06/08/1045230608.db2.gz QHYYIEKJJPSALM-HNNXBMFYSA-N 1 2 319.836 4.404 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+]C2CCSCC2)C(F)F)c1 ZINC000578337243 1045232793 /nfs/dbraw/zinc/23/27/93/1045232793.db2.gz AOIZQLOKWHRFCY-HNNXBMFYSA-N 1 2 315.429 4.265 20 0 DIADLO CCOc1ccccc1[C@@H](CC(C)C)[NH2+][C@H](C)c1nonc1C ZINC000925207940 1045236215 /nfs/dbraw/zinc/23/62/15/1045236215.db2.gz NZOYZBFDERVEKG-CZUORRHYSA-N 1 2 317.433 4.215 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2coc3ccccc32)cs1 ZINC000925234544 1045237532 /nfs/dbraw/zinc/23/75/32/1045237532.db2.gz ANILKMINSZUDMA-NWDGAFQWSA-N 1 2 316.426 4.448 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CC[C@@](F)(c4ccccc4)C3)oc2c1 ZINC000578455218 1045244251 /nfs/dbraw/zinc/24/42/51/1045244251.db2.gz XMFQNGVPVQZPIN-SFHVURJKSA-N 1 2 314.335 4.038 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CC[C@@](F)(c4ccccc4)C3)oc2c1 ZINC000578455218 1045244258 /nfs/dbraw/zinc/24/42/58/1045244258.db2.gz XMFQNGVPVQZPIN-SFHVURJKSA-N 1 2 314.335 4.038 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccsc2C(F)(F)F)s1 ZINC000527665535 1045246427 /nfs/dbraw/zinc/24/64/27/1045246427.db2.gz GWEBNCQLGUJTKJ-UHFFFAOYSA-N 1 2 306.378 4.076 20 0 DIADLO Cc1cccn2c(CNc3cccc(C4CCOCC4)c3)c[nH+]c12 ZINC000527795923 1045263466 /nfs/dbraw/zinc/26/34/66/1045263466.db2.gz FUYXJXYBOVLWBM-UHFFFAOYSA-N 1 2 321.424 4.149 20 0 DIADLO O[C@@H](c1ccccc1)C1CCN(c2[nH+]ccc3ccccc32)CC1 ZINC000527835089 1045266481 /nfs/dbraw/zinc/26/64/81/1045266481.db2.gz ITADSQHDFHSZED-FQEVSTJZSA-N 1 2 318.420 4.185 20 0 DIADLO C[C@H]1CN(c2[nH+]ccc3ccccc32)C[C@H](c2ccccc2)O1 ZINC000527865860 1045270068 /nfs/dbraw/zinc/27/00/68/1045270068.db2.gz VNDWAHMDZFYNAT-HNAYVOBHSA-N 1 2 304.393 4.201 20 0 DIADLO CC[C@@H](C)c1ccc([C@@H](C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000527905947 1045279235 /nfs/dbraw/zinc/27/92/35/1045279235.db2.gz SYPCBEUDZSLBON-CHWSQXEVSA-N 1 2 305.853 4.438 20 0 DIADLO CC(C)c1cccc([C@@H](C)[NH2+]Cc2nccc(C(F)(F)F)n2)c1 ZINC000527907079 1045281151 /nfs/dbraw/zinc/28/11/51/1045281151.db2.gz FJWSRKKKWHUKOP-GFCCVEGCSA-N 1 2 323.362 4.470 20 0 DIADLO CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1ncc(Cl)s1 ZINC000579018251 1045288147 /nfs/dbraw/zinc/28/81/47/1045288147.db2.gz ZPNCFHBSIWBYJO-CYBMUJFWSA-N 1 2 310.850 4.388 20 0 DIADLO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000579018251 1045288153 /nfs/dbraw/zinc/28/81/53/1045288153.db2.gz ZPNCFHBSIWBYJO-CYBMUJFWSA-N 1 2 310.850 4.388 20 0 DIADLO C[C@H](CC(=O)N[C@@H](CC(C)(C)C)c1ccccc1)n1cc[nH+]c1 ZINC000579115503 1045294103 /nfs/dbraw/zinc/29/41/03/1045294103.db2.gz OERLPSLSILIAJN-WBVHZDCISA-N 1 2 313.445 4.128 20 0 DIADLO CC1CCC(N(C(=O)c2cccc(-n3cc[nH+]c3)c2)C2CC2)CC1 ZINC000117597576 1045307831 /nfs/dbraw/zinc/30/78/31/1045307831.db2.gz JAGMZTVMXGCUPM-UHFFFAOYSA-N 1 2 323.440 4.056 20 0 DIADLO COCCC1(C[NH2+]Cc2cccc(Cl)c2O)CCCCC1 ZINC000187696717 1045331097 /nfs/dbraw/zinc/33/10/97/1045331097.db2.gz XHFXASCGEBDRMN-UHFFFAOYSA-N 1 2 311.853 4.122 20 0 DIADLO Cc1cc(N[C@@H](c2ncc[nH]2)c2ccc(F)cc2)ccc1[NH+](C)C ZINC000188400262 1045336378 /nfs/dbraw/zinc/33/63/78/1045336378.db2.gz JZURVOGQNYPHID-GOSISDBHSA-N 1 2 324.403 4.125 20 0 DIADLO CC[C@H](C)C[N@H+](CC)Cn1nc(C(F)(F)F)sc1=S ZINC000188694064 1045338336 /nfs/dbraw/zinc/33/83/36/1045338336.db2.gz HDHRUAATPHYGAP-QMMMGPOBSA-N 1 2 313.414 4.018 20 0 DIADLO CC[C@H](C)C[N@@H+](CC)Cn1nc(C(F)(F)F)sc1=S ZINC000188694064 1045338344 /nfs/dbraw/zinc/33/83/44/1045338344.db2.gz HDHRUAATPHYGAP-QMMMGPOBSA-N 1 2 313.414 4.018 20 0 DIADLO Cc1cnc(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)s1 ZINC000449051139 1045341199 /nfs/dbraw/zinc/34/11/99/1045341199.db2.gz SDWMKNDYTFMWPY-UHFFFAOYSA-N 1 2 324.453 4.263 20 0 DIADLO C[C@@H]1c2cc(F)cc(F)c2CC[N@H+]1Cc1cc2cccnc2o1 ZINC000449052265 1045341542 /nfs/dbraw/zinc/34/15/42/1045341542.db2.gz YXEGTRISBIBFAJ-LLVKDONJSA-N 1 2 314.335 4.225 20 0 DIADLO C[C@@H]1c2cc(F)cc(F)c2CC[N@@H+]1Cc1cc2cccnc2o1 ZINC000449052265 1045341545 /nfs/dbraw/zinc/34/15/45/1045341545.db2.gz YXEGTRISBIBFAJ-LLVKDONJSA-N 1 2 314.335 4.225 20 0 DIADLO C/C=C\C[C@@H]1CCCN(C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000626568334 1045351143 /nfs/dbraw/zinc/35/11/43/1045351143.db2.gz ALVDAXJPSYZUSY-OGZRUICASA-N 1 2 301.434 4.217 20 0 DIADLO O=C(C[C@@H]1CCC[N@H+]1Cc1ncccc1Cl)c1cccs1 ZINC000528427582 1045353568 /nfs/dbraw/zinc/35/35/68/1045353568.db2.gz WDEIZZOONYWQOK-LBPRGKRZSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@@H]1CCC[N@@H+]1Cc1ncccc1Cl)c1cccs1 ZINC000528427582 1045353571 /nfs/dbraw/zinc/35/35/71/1045353571.db2.gz WDEIZZOONYWQOK-LBPRGKRZSA-N 1 2 320.845 4.034 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1ncccc1Cl ZINC000528429697 1045354524 /nfs/dbraw/zinc/35/45/24/1045354524.db2.gz AWQFUMRYHKVARE-CYBMUJFWSA-N 1 2 304.821 4.373 20 0 DIADLO CC(C)COc1ccccc1C[NH2+]Cc1nc(C2CC2)cs1 ZINC000449189754 1045357908 /nfs/dbraw/zinc/35/79/08/1045357908.db2.gz MNUOBEMDWFGYND-UHFFFAOYSA-N 1 2 316.470 4.345 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1ncccc1Cl ZINC000528507903 1045372351 /nfs/dbraw/zinc/37/23/51/1045372351.db2.gz XVNPYPZAOHYETG-MRXNPFEDSA-N 1 2 304.821 4.327 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1ncccc1Cl ZINC000528507903 1045372358 /nfs/dbraw/zinc/37/23/58/1045372358.db2.gz XVNPYPZAOHYETG-MRXNPFEDSA-N 1 2 304.821 4.327 20 0 DIADLO Cc1cnc(C[NH2+]Cc2cc(F)c(C(F)(F)F)cc2F)s1 ZINC000449327861 1045375738 /nfs/dbraw/zinc/37/57/38/1045375738.db2.gz DCYLREBWZZZIKZ-UHFFFAOYSA-N 1 2 322.302 4.038 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)cs1 ZINC000449318319 1045376252 /nfs/dbraw/zinc/37/62/52/1045376252.db2.gz FYPNOKQDORUYNM-OAHLLOKOSA-N 1 2 317.458 4.434 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)cs1 ZINC000449318319 1045376255 /nfs/dbraw/zinc/37/62/55/1045376255.db2.gz FYPNOKQDORUYNM-OAHLLOKOSA-N 1 2 317.458 4.434 20 0 DIADLO c1cn(Cc2ccc(N[C@@H]3CCCC34CCCCC4)nc2)c[nH+]1 ZINC000449320960 1045377719 /nfs/dbraw/zinc/37/77/19/1045377719.db2.gz QGYWIFSHQRUJLP-QGZVFWFLSA-N 1 2 310.445 4.241 20 0 DIADLO Fc1ccc(C2CC2)cc1C[NH2+]Cc1nccn1-c1ccccc1 ZINC000449373192 1045384257 /nfs/dbraw/zinc/38/42/57/1045384257.db2.gz PFPZCWBCOQJTKX-UHFFFAOYSA-N 1 2 321.399 4.179 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@@H+]1CCc2nc(C(C)(C)C)ncc2C1 ZINC000528589866 1045385499 /nfs/dbraw/zinc/38/54/99/1045385499.db2.gz AZOQPIUWXGYDLW-CYBMUJFWSA-N 1 2 313.420 4.033 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@H+]1CCc2nc(C(C)(C)C)ncc2C1 ZINC000528589866 1045385504 /nfs/dbraw/zinc/38/55/04/1045385504.db2.gz AZOQPIUWXGYDLW-CYBMUJFWSA-N 1 2 313.420 4.033 20 0 DIADLO CCCCc1oc2ccccc2c1C[NH2+]Cc1nnc(C2CC2)[nH]1 ZINC000449406302 1045390436 /nfs/dbraw/zinc/39/04/36/1045390436.db2.gz WNVONNNHYMXZOI-UHFFFAOYSA-N 1 2 324.428 4.061 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000449458860 1045395650 /nfs/dbraw/zinc/39/56/50/1045395650.db2.gz JHJWUVWJROBNMW-ZIAGYGMSSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000449458860 1045395653 /nfs/dbraw/zinc/39/56/53/1045395653.db2.gz JHJWUVWJROBNMW-ZIAGYGMSSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000528722528 1045403777 /nfs/dbraw/zinc/40/37/77/1045403777.db2.gz ZYXQNVNLUMQFNY-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000528722528 1045403779 /nfs/dbraw/zinc/40/37/79/1045403779.db2.gz ZYXQNVNLUMQFNY-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@@H+]1CCc2nc(C3CC3)ncc2C1 ZINC000528734261 1045405807 /nfs/dbraw/zinc/40/58/07/1045405807.db2.gz PGAHUVSXRREKAH-SFHVURJKSA-N 1 2 311.404 4.003 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@H+]1CCc2nc(C3CC3)ncc2C1 ZINC000528734261 1045405809 /nfs/dbraw/zinc/40/58/09/1045405809.db2.gz PGAHUVSXRREKAH-SFHVURJKSA-N 1 2 311.404 4.003 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+]1CCC(F)(F)C[C@H]1C ZINC000528767968 1045411851 /nfs/dbraw/zinc/41/18/51/1045411851.db2.gz MPBIJBHFZJCYTJ-SNVBAGLBSA-N 1 2 312.385 4.331 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+]1CCC(F)(F)C[C@H]1C ZINC000528767968 1045411854 /nfs/dbraw/zinc/41/18/54/1045411854.db2.gz MPBIJBHFZJCYTJ-SNVBAGLBSA-N 1 2 312.385 4.331 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1coc(-c2ccc(F)cc2)n1 ZINC000528772110 1045412814 /nfs/dbraw/zinc/41/28/14/1045412814.db2.gz ZKDXQRNFDXSPRH-LLVKDONJSA-N 1 2 310.319 4.100 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1coc(-c2ccc(F)cc2)n1 ZINC000528772110 1045412819 /nfs/dbraw/zinc/41/28/19/1045412819.db2.gz ZKDXQRNFDXSPRH-LLVKDONJSA-N 1 2 310.319 4.100 20 0 DIADLO C[C@H](C[N@H+](C)Cc1nnc(C(F)(F)F)s1)C1CCCCC1 ZINC000528774072 1045413527 /nfs/dbraw/zinc/41/35/27/1045413527.db2.gz PNLMMHFULCGEJL-SNVBAGLBSA-N 1 2 321.412 4.205 20 0 DIADLO C[C@H](C[N@@H+](C)Cc1nnc(C(F)(F)F)s1)C1CCCCC1 ZINC000528774072 1045413531 /nfs/dbraw/zinc/41/35/31/1045413531.db2.gz PNLMMHFULCGEJL-SNVBAGLBSA-N 1 2 321.412 4.205 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000528792466 1045416207 /nfs/dbraw/zinc/41/62/07/1045416207.db2.gz DTXAOVIZJNXBMU-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H](c1ccccn1)[N@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000528792466 1045416211 /nfs/dbraw/zinc/41/62/11/1045416211.db2.gz DTXAOVIZJNXBMU-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO CCCc1ncc(C[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)o1 ZINC000449613133 1045418804 /nfs/dbraw/zinc/41/88/04/1045418804.db2.gz QYRBWSFPEZZHRL-UHFFFAOYSA-N 1 2 310.397 4.485 20 0 DIADLO CCCc1ncc(C[NH2+]Cc2cc(Cl)sc2Cl)o1 ZINC000449620512 1045420582 /nfs/dbraw/zinc/42/05/82/1045420582.db2.gz FJHFMYBODPYAJG-UHFFFAOYSA-N 1 2 305.230 4.285 20 0 DIADLO c1coc([C@H]2[N@H+](Cc3ccc(N4CCCC4)nc3)CC23CCC3)c1 ZINC000449638062 1045424403 /nfs/dbraw/zinc/42/44/03/1045424403.db2.gz JDEWUCWIHPXNHB-LJQANCHMSA-N 1 2 323.440 4.002 20 0 DIADLO c1coc([C@H]2[N@@H+](Cc3ccc(N4CCCC4)nc3)CC23CCC3)c1 ZINC000449638062 1045424405 /nfs/dbraw/zinc/42/44/05/1045424405.db2.gz JDEWUCWIHPXNHB-LJQANCHMSA-N 1 2 323.440 4.002 20 0 DIADLO COc1cccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)c1OC ZINC000449637346 1045424633 /nfs/dbraw/zinc/42/46/33/1045424633.db2.gz ZDKLRSFMDNLDMH-GOSISDBHSA-N 1 2 313.397 4.024 20 0 DIADLO COc1cccc(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)c1OC ZINC000449637346 1045424636 /nfs/dbraw/zinc/42/46/36/1045424636.db2.gz ZDKLRSFMDNLDMH-GOSISDBHSA-N 1 2 313.397 4.024 20 0 DIADLO COc1ccc([C@@H]([NH2+][C@H](C)c2cc(C)ccn2)c2ccco2)cc1 ZINC000449783190 1045437543 /nfs/dbraw/zinc/43/75/43/1045437543.db2.gz ZZROKEPAJCWDIP-FOIQADDNSA-N 1 2 322.408 4.432 20 0 DIADLO COc1ccc([C@H]([NH2+][C@H](C)c2cc(C)ccn2)c2ccco2)cc1 ZINC000449783192 1045437558 /nfs/dbraw/zinc/43/75/58/1045437558.db2.gz ZZROKEPAJCWDIP-QRWLVFNGSA-N 1 2 322.408 4.432 20 0 DIADLO Cc1cc(F)c(NC(=O)NCc2cc(C)[nH+]c(C)c2)c(Cl)c1 ZINC000529256473 1045466423 /nfs/dbraw/zinc/46/64/23/1045466423.db2.gz RJWSPGAJWIECKJ-UHFFFAOYSA-N 1 2 321.783 4.121 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2nnc(C(C)C)s2)cc1 ZINC000450212827 1045476449 /nfs/dbraw/zinc/47/64/49/1045476449.db2.gz TWIZDEPXACGPRK-OAHLLOKOSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nnc(C(C)C)s2)cc1 ZINC000450212827 1045476451 /nfs/dbraw/zinc/47/64/51/1045476451.db2.gz TWIZDEPXACGPRK-OAHLLOKOSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1ccc(C[N@H+](Cc2nnc(C3CC3)s2)C(C)C)s1 ZINC000450286475 1045482217 /nfs/dbraw/zinc/48/22/17/1045482217.db2.gz LSSJTWFVUMVWNJ-UHFFFAOYSA-N 1 2 307.488 4.196 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2nnc(C3CC3)s2)C(C)C)s1 ZINC000450286475 1045482221 /nfs/dbraw/zinc/48/22/21/1045482221.db2.gz LSSJTWFVUMVWNJ-UHFFFAOYSA-N 1 2 307.488 4.196 20 0 DIADLO Cc1ncsc1C[N@@H+](C)Cc1ccsc1C(F)(F)F ZINC000529527987 1045487139 /nfs/dbraw/zinc/48/71/39/1045487139.db2.gz DLZFZNRYVDLHLZ-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO Cc1ncsc1C[N@H+](C)Cc1ccsc1C(F)(F)F ZINC000529527987 1045487143 /nfs/dbraw/zinc/48/71/43/1045487143.db2.gz DLZFZNRYVDLHLZ-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO Brc1sccc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000529521622 1045489340 /nfs/dbraw/zinc/48/93/40/1045489340.db2.gz CXHFKOLOAGVCEY-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1sccc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000529521622 1045489344 /nfs/dbraw/zinc/48/93/44/1045489344.db2.gz CXHFKOLOAGVCEY-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1sccc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000529564022 1045494991 /nfs/dbraw/zinc/49/49/91/1045494991.db2.gz AJHXKDJMDHTXBX-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1sccc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000529564022 1045494993 /nfs/dbraw/zinc/49/49/93/1045494993.db2.gz AJHXKDJMDHTXBX-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO FC(F)(F)c1ccc2c(cc[nH+]c2N2CCO[C@@H]3CCC[C@@H]32)c1 ZINC000450368708 1045498090 /nfs/dbraw/zinc/49/80/90/1045498090.db2.gz JHRHMJSGMKQPPA-LSDHHAIUSA-N 1 2 322.330 4.011 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2Cl)C[N@@H+]1CC1CC(F)(F)C1 ZINC000450387950 1045499772 /nfs/dbraw/zinc/49/97/72/1045499772.db2.gz HDLKJBPJBWFEPS-ABAIWWIYSA-N 1 2 315.791 4.147 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2Cl)C[N@H+]1CC1CC(F)(F)C1 ZINC000450387950 1045499774 /nfs/dbraw/zinc/49/97/74/1045499774.db2.gz HDLKJBPJBWFEPS-ABAIWWIYSA-N 1 2 315.791 4.147 20 0 DIADLO CCC1(CO)CCN(c2cc[nH+]c3cc(F)c(Cl)cc32)CC1 ZINC000450412748 1045500627 /nfs/dbraw/zinc/50/06/27/1045500627.db2.gz QVHZMHOBLYCBLR-UHFFFAOYSA-N 1 2 322.811 4.016 20 0 DIADLO COC1(C)CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)CC1 ZINC000450421640 1045503363 /nfs/dbraw/zinc/50/33/63/1045503363.db2.gz LUDBZJIMYWRCQN-UHFFFAOYSA-N 1 2 324.346 4.259 20 0 DIADLO CC(=O)c1ccc(C[N@H+]2C[C@@H](c3ccccc3C)OC[C@H]2C)cc1 ZINC000450440214 1045505755 /nfs/dbraw/zinc/50/57/55/1045505755.db2.gz PBMQBNWSSHPRGB-IERDGZPVSA-N 1 2 323.436 4.160 20 0 DIADLO CC(=O)c1ccc(C[N@@H+]2C[C@@H](c3ccccc3C)OC[C@H]2C)cc1 ZINC000450440214 1045505760 /nfs/dbraw/zinc/50/57/60/1045505760.db2.gz PBMQBNWSSHPRGB-IERDGZPVSA-N 1 2 323.436 4.160 20 0 DIADLO c1coc(CC2C[NH+](Cc3csc(-c4ccsc4)n3)C2)c1 ZINC000529649082 1045507855 /nfs/dbraw/zinc/50/78/55/1045507855.db2.gz NUKDFMCSDSFPTD-UHFFFAOYSA-N 1 2 316.451 4.139 20 0 DIADLO Clc1cc(Cl)c2c(c1)C[N@@H+](CCc1cscn1)CC2 ZINC000450501527 1045512385 /nfs/dbraw/zinc/51/23/85/1045512385.db2.gz QEHBYCHFTJIKND-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO Clc1cc(Cl)c2c(c1)C[N@H+](CCc1cscn1)CC2 ZINC000450501527 1045512390 /nfs/dbraw/zinc/51/23/90/1045512390.db2.gz QEHBYCHFTJIKND-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO Fc1cc2[nH+]ccc(N3CC[C@@]4(C3)CCCOC4)c2cc1Cl ZINC000450511245 1045514714 /nfs/dbraw/zinc/51/47/14/1045514714.db2.gz ARFCARXFEPLYRI-QGZVFWFLSA-N 1 2 320.795 4.034 20 0 DIADLO C(=C\[C@H]1CCCCC[N@H+]1Cc1nncs1)\c1cccs1 ZINC001119729337 1045522379 /nfs/dbraw/zinc/52/23/79/1045522379.db2.gz OEMRDTOMESDCBD-MEJMFZKBSA-N 1 2 305.472 4.058 20 0 DIADLO C(=C\[C@H]1CCCCC[N@@H+]1Cc1nncs1)\c1cccs1 ZINC001119729337 1045522387 /nfs/dbraw/zinc/52/23/87/1045522387.db2.gz OEMRDTOMESDCBD-MEJMFZKBSA-N 1 2 305.472 4.058 20 0 DIADLO CCOc1cccc2cc([C@@H](C)[NH2+][C@@H](C)c3ncccn3)oc21 ZINC001119732912 1045524020 /nfs/dbraw/zinc/52/40/20/1045524020.db2.gz RUPMMPQYZNSGKH-OLZOCXBDSA-N 1 2 311.385 4.033 20 0 DIADLO Cc1ncc(C[N@@H+]2CCc3sccc3[C@@H]2c2cccs2)o1 ZINC000628123158 1045526336 /nfs/dbraw/zinc/52/63/36/1045526336.db2.gz CYRNPXRBZPSALF-MRXNPFEDSA-N 1 2 316.451 4.254 20 0 DIADLO Cc1ncc(C[N@H+]2CCc3sccc3[C@@H]2c2cccs2)o1 ZINC000628123158 1045526350 /nfs/dbraw/zinc/52/63/50/1045526350.db2.gz CYRNPXRBZPSALF-MRXNPFEDSA-N 1 2 316.451 4.254 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1ccsc1Br ZINC000628160478 1045532177 /nfs/dbraw/zinc/53/21/77/1045532177.db2.gz WGDGHKDBGDJVBW-UHFFFAOYSA-N 1 2 316.186 4.285 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1ccsc1Br ZINC000628160478 1045532183 /nfs/dbraw/zinc/53/21/83/1045532183.db2.gz WGDGHKDBGDJVBW-UHFFFAOYSA-N 1 2 316.186 4.285 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2nc(C)c(C)[nH]2)o1 ZINC000628188845 1045538610 /nfs/dbraw/zinc/53/86/10/1045538610.db2.gz LFCHYXQOJAPNLW-MLGOLLRUSA-N 1 2 301.434 4.155 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2nc(C)c(C)[nH]2)o1 ZINC000628188845 1045538622 /nfs/dbraw/zinc/53/86/22/1045538622.db2.gz LFCHYXQOJAPNLW-MLGOLLRUSA-N 1 2 301.434 4.155 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CCN2Cc2[nH]c(C)c(C)[nH+]2)o1 ZINC000628188845 1045538628 /nfs/dbraw/zinc/53/86/28/1045538628.db2.gz LFCHYXQOJAPNLW-MLGOLLRUSA-N 1 2 301.434 4.155 20 0 DIADLO c1nc(C2CC2)oc1C[N@@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000628187634 1045538929 /nfs/dbraw/zinc/53/89/29/1045538929.db2.gz VRMLZVGSZDBLOQ-INIZCTEOSA-N 1 2 323.396 4.420 20 0 DIADLO c1nc(C2CC2)oc1C[N@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000628187634 1045538942 /nfs/dbraw/zinc/53/89/42/1045538942.db2.gz VRMLZVGSZDBLOQ-INIZCTEOSA-N 1 2 323.396 4.420 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2nc(C)c(C)[nH]2)o1 ZINC000628188843 1045539668 /nfs/dbraw/zinc/53/96/68/1045539668.db2.gz LFCHYXQOJAPNLW-BLLLJJGKSA-N 1 2 301.434 4.155 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2nc(C)c(C)[nH]2)o1 ZINC000628188843 1045539678 /nfs/dbraw/zinc/53/96/78/1045539678.db2.gz LFCHYXQOJAPNLW-BLLLJJGKSA-N 1 2 301.434 4.155 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CCN2Cc2[nH]c(C)c(C)[nH+]2)o1 ZINC000628188843 1045539686 /nfs/dbraw/zinc/53/96/86/1045539686.db2.gz LFCHYXQOJAPNLW-BLLLJJGKSA-N 1 2 301.434 4.155 20 0 DIADLO CCC[C@@H]([NH2+]Cc1noc(-c2cncc(C)c2)n1)c1ccccc1 ZINC000450665589 1045541089 /nfs/dbraw/zinc/54/10/89/1045541089.db2.gz WPYJBSVGOBFFKS-QGZVFWFLSA-N 1 2 322.412 4.071 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccsc2C(F)(F)F)cs1 ZINC000628213316 1045547119 /nfs/dbraw/zinc/54/71/19/1045547119.db2.gz GRQJDLKRYQVTBA-SSDOTTSWSA-N 1 2 306.378 4.383 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1SC1CCCC1)[NH+]1CC(C)C1 ZINC000654481165 1045547481 /nfs/dbraw/zinc/54/74/81/1045547481.db2.gz IGRMDBBJRUIQPT-CQSZACIVSA-N 1 2 318.486 4.000 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H](C)c1c(Cl)cccc1Cl ZINC001121231435 1045555874 /nfs/dbraw/zinc/55/58/74/1045555874.db2.gz NIPJUYONKPUHLB-LLVKDONJSA-N 1 2 323.223 4.169 20 0 DIADLO Fc1ccccc1C1CC[NH+](Cc2cnc(Cl)s2)CC1 ZINC000750798197 1045555889 /nfs/dbraw/zinc/55/58/89/1045555889.db2.gz FQFZNOIQBRVXLO-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO C[C@H]([NH2+][C@@H](Cc1ccccc1)c1cccs1)c1csnn1 ZINC000450725584 1045556241 /nfs/dbraw/zinc/55/62/41/1045556241.db2.gz ITNCNQMOKWWRJK-JSGCOSHPSA-N 1 2 315.467 4.234 20 0 DIADLO CCC(CC)CC(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001121286766 1045559529 /nfs/dbraw/zinc/55/95/29/1045559529.db2.gz ZYVUFXOSECSFBN-INIZCTEOSA-N 1 2 319.493 4.170 20 0 DIADLO CC(C)C[C@H](C(=O)N1CCC[C@@H]1C1CCCCC1)n1cc[nH+]c1 ZINC001626153669 1045561762 /nfs/dbraw/zinc/56/17/62/1045561762.db2.gz GNOBXNRTXQWATN-QZTJIDSGSA-N 1 2 317.477 4.042 20 0 DIADLO C[C@@H]1C[C@@]1([NH2+]Cc1nnc(C2CC2)s1)c1ccc(Cl)cc1 ZINC000450929635 1045592936 /nfs/dbraw/zinc/59/29/36/1045592936.db2.gz VBGJJQXDXCLIPI-HWPZZCPQSA-N 1 2 319.861 4.094 20 0 DIADLO Clc1cccc([C@H]2CC[N@H+](Cc3nnc(C4CC4)s3)C2)c1 ZINC000451058881 1045619430 /nfs/dbraw/zinc/61/94/30/1045619430.db2.gz BGTSSPRTXRLZJN-ZDUSSCGKSA-N 1 2 319.861 4.058 20 0 DIADLO Clc1cccc([C@H]2CC[N@@H+](Cc3nnc(C4CC4)s3)C2)c1 ZINC000451058881 1045619438 /nfs/dbraw/zinc/61/94/38/1045619438.db2.gz BGTSSPRTXRLZJN-ZDUSSCGKSA-N 1 2 319.861 4.058 20 0 DIADLO Cc1nc(COc2ccc(CNc3cccc[nH+]3)cc2)cs1 ZINC000121573346 1045621970 /nfs/dbraw/zinc/62/19/70/1045621970.db2.gz JYEMJBRWMBEORY-UHFFFAOYSA-N 1 2 311.410 4.038 20 0 DIADLO Cc1cc(F)cc([C@@]2(F)CC[N@H+](C[C@H]3CC3(Cl)Cl)C2)c1 ZINC000800473879 1045623539 /nfs/dbraw/zinc/62/35/39/1045623539.db2.gz COVZOEASRCFITM-TZMCWYRMSA-N 1 2 320.210 4.198 20 0 DIADLO Cc1cc(F)cc([C@@]2(F)CC[N@@H+](C[C@H]3CC3(Cl)Cl)C2)c1 ZINC000800473879 1045623541 /nfs/dbraw/zinc/62/35/41/1045623541.db2.gz COVZOEASRCFITM-TZMCWYRMSA-N 1 2 320.210 4.198 20 0 DIADLO Cc1ccc(Nc2nn(C[N@H+]3CCC[C@@H]3C)c(=S)s2)cc1 ZINC000751926730 1045641583 /nfs/dbraw/zinc/64/15/83/1045641583.db2.gz WGAKFWVFGPBLER-LBPRGKRZSA-N 1 2 320.487 4.168 20 0 DIADLO Cc1ccc(Nc2nn(C[N@@H+]3CCC[C@@H]3C)c(=S)s2)cc1 ZINC000751926730 1045641592 /nfs/dbraw/zinc/64/15/92/1045641592.db2.gz WGAKFWVFGPBLER-LBPRGKRZSA-N 1 2 320.487 4.168 20 0 DIADLO C[C@@H]1CC[N@H+](Cn2nc(-c3ccccc3)sc2=S)[C@@H]1C ZINC000751938875 1045643792 /nfs/dbraw/zinc/64/37/92/1045643792.db2.gz BKQUFOCNBQKZHQ-VXGBXAGGSA-N 1 2 305.472 4.029 20 0 DIADLO C[C@@H]1CC[N@@H+](Cn2nc(-c3ccccc3)sc2=S)[C@@H]1C ZINC000751938875 1045643794 /nfs/dbraw/zinc/64/37/94/1045643794.db2.gz BKQUFOCNBQKZHQ-VXGBXAGGSA-N 1 2 305.472 4.029 20 0 DIADLO Cc1cc([NH2+]C[C@H]2CC=CCC2)ccc1OC1CCOCC1 ZINC000752086405 1045656322 /nfs/dbraw/zinc/65/63/22/1045656322.db2.gz BNFRYEFJNKAWIL-INIZCTEOSA-N 1 2 301.430 4.321 20 0 DIADLO CCCC[N@H+](C)c1ccc(Nc2nc([C@H](C)OC)ns2)cc1 ZINC000800850409 1045659099 /nfs/dbraw/zinc/65/90/99/1045659099.db2.gz NZPYQJFAKSPXGW-LBPRGKRZSA-N 1 2 320.462 4.225 20 0 DIADLO CCCC[N@@H+](C)c1ccc(Nc2nc([C@H](C)OC)ns2)cc1 ZINC000800850409 1045659108 /nfs/dbraw/zinc/65/91/08/1045659108.db2.gz NZPYQJFAKSPXGW-LBPRGKRZSA-N 1 2 320.462 4.225 20 0 DIADLO c1cc(N2CCSCC2)ccc1[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000800982394 1045676255 /nfs/dbraw/zinc/67/62/55/1045676255.db2.gz RYDFPCNKIYWAJE-MSOLQXFVSA-N 1 2 302.487 4.230 20 0 DIADLO Cc1cc(NCc2ccc(Br)o2)ccc1[NH+](C)C ZINC000191399036 1045695427 /nfs/dbraw/zinc/69/54/27/1045695427.db2.gz BQRJGVMRYVTUHH-UHFFFAOYSA-N 1 2 309.207 4.029 20 0 DIADLO CC(C)c1cnc(-c2cc(F)cc(Cn3cc[nH+]c3)c2)s1 ZINC000629733035 1045704921 /nfs/dbraw/zinc/70/49/21/1045704921.db2.gz YFYPMFPWXDOVBK-UHFFFAOYSA-N 1 2 301.390 4.317 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCC[C@H]3c3ccccn3)cs2)co1 ZINC000530724451 1045718552 /nfs/dbraw/zinc/71/85/52/1045718552.db2.gz MHDAJGJPZGAHLQ-INIZCTEOSA-N 1 2 311.410 4.135 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCC[C@H]3c3ccccn3)cs2)co1 ZINC000530724451 1045718562 /nfs/dbraw/zinc/71/85/62/1045718562.db2.gz MHDAJGJPZGAHLQ-INIZCTEOSA-N 1 2 311.410 4.135 20 0 DIADLO C[C@@H]([NH2+]Cc1c[nH]c(-c2ccccc2)n1)c1ccc(F)cc1F ZINC000530774341 1045727098 /nfs/dbraw/zinc/72/70/98/1045727098.db2.gz LLJIFTALLJBIJK-GFCCVEGCSA-N 1 2 313.351 4.206 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1ccc([NH+](C)C)cc1)CCS2 ZINC000191544709 1045728087 /nfs/dbraw/zinc/72/80/87/1045728087.db2.gz KATDWQJGEFBQLY-KRWDZBQOSA-N 1 2 314.454 4.410 20 0 DIADLO C[C@H]([N@H+](C)Cn1nc(-c2cccs2)oc1=S)C1(C)CC1 ZINC000753113553 1045728863 /nfs/dbraw/zinc/72/88/63/1045728863.db2.gz XSHMMIXXGVRYFX-JTQLQIEISA-N 1 2 309.460 4.012 20 0 DIADLO C[C@H]([N@@H+](C)Cn1nc(-c2cccs2)oc1=S)C1(C)CC1 ZINC000753113553 1045728879 /nfs/dbraw/zinc/72/88/79/1045728879.db2.gz XSHMMIXXGVRYFX-JTQLQIEISA-N 1 2 309.460 4.012 20 0 DIADLO Clc1ccc(C[NH+]2CCC(c3cccnc3)CC2)c(Cl)n1 ZINC000801526298 1045730424 /nfs/dbraw/zinc/73/04/24/1045730424.db2.gz JDWNYVQFKYCZKS-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)nc1 ZINC000451867025 1045735679 /nfs/dbraw/zinc/73/56/79/1045735679.db2.gz YSDJJUZCOGOTKC-OAHLLOKOSA-N 1 2 322.330 4.421 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)nc1 ZINC000451867025 1045735696 /nfs/dbraw/zinc/73/56/96/1045735696.db2.gz YSDJJUZCOGOTKC-OAHLLOKOSA-N 1 2 322.330 4.421 20 0 DIADLO CCc1noc(C)c1C[N@@H+]1CCCC[C@@H]1c1nc2ccccc2[nH]1 ZINC000451875457 1045735904 /nfs/dbraw/zinc/73/59/04/1045735904.db2.gz BYUSAGCAIHNYRG-GOSISDBHSA-N 1 2 324.428 4.149 20 0 DIADLO CCc1noc(C)c1C[N@H+]1CCCC[C@@H]1c1nc2ccccc2[nH]1 ZINC000451875457 1045735912 /nfs/dbraw/zinc/73/59/12/1045735912.db2.gz BYUSAGCAIHNYRG-GOSISDBHSA-N 1 2 324.428 4.149 20 0 DIADLO Cc1ncc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3[nH]2)s1 ZINC000451881337 1045738343 /nfs/dbraw/zinc/73/83/43/1045738343.db2.gz YDVYCWUHMRAZLB-MRXNPFEDSA-N 1 2 312.442 4.055 20 0 DIADLO Cc1ncc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3[nH]2)s1 ZINC000451881337 1045738358 /nfs/dbraw/zinc/73/83/58/1045738358.db2.gz YDVYCWUHMRAZLB-MRXNPFEDSA-N 1 2 312.442 4.055 20 0 DIADLO Cc1cccc(C[N@@H+]2CCSC[C@H]2c2ccc(Cl)cc2)n1 ZINC000347358492 1045739702 /nfs/dbraw/zinc/73/97/02/1045739702.db2.gz KZQOGUWLEBBBRQ-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cccc(C[N@H+]2CCSC[C@H]2c2ccc(Cl)cc2)n1 ZINC000347358492 1045739722 /nfs/dbraw/zinc/73/97/22/1045739722.db2.gz KZQOGUWLEBBBRQ-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO c1csc(-c2cc(C[N@@H+]3CCC[C@@H]3c3ccccn3)no2)c1 ZINC000530962288 1045760398 /nfs/dbraw/zinc/76/03/98/1045760398.db2.gz CUSHOAZHUNVTCG-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2cc(C[N@H+]3CCC[C@@H]3c3ccccn3)no2)c1 ZINC000530962288 1045760408 /nfs/dbraw/zinc/76/04/08/1045760408.db2.gz CUSHOAZHUNVTCG-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO CC1=C(C)C[C@@](C)(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001124772621 1045761331 /nfs/dbraw/zinc/76/13/31/1045761331.db2.gz PELKRXQRSLPRBX-IBGZPJMESA-N 1 2 309.413 4.337 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)C1(C2CCCCC2)CC1 ZINC001124773481 1045761582 /nfs/dbraw/zinc/76/15/82/1045761582.db2.gz YOUGDFDMVLULAN-UHFFFAOYSA-N 1 2 309.413 4.171 20 0 DIADLO c1csc(-c2nc(C[N@@H+]3CCC[C@H]3c3ccccn3)co2)c1 ZINC000530963163 1045761836 /nfs/dbraw/zinc/76/18/36/1045761836.db2.gz WAXIHECLTWDSMG-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2nc(C[N@H+]3CCC[C@H]3c3ccccn3)co2)c1 ZINC000530963163 1045761843 /nfs/dbraw/zinc/76/18/43/1045761843.db2.gz WAXIHECLTWDSMG-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO C[C@H]1CCC(C)(C)[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000452006589 1045762844 /nfs/dbraw/zinc/76/28/44/1045762844.db2.gz MAEGBOTUVYMNAM-JTQLQIEISA-N 1 2 315.244 4.195 20 0 DIADLO C[C@H]1CCC(C)(C)[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000452006589 1045762855 /nfs/dbraw/zinc/76/28/55/1045762855.db2.gz MAEGBOTUVYMNAM-JTQLQIEISA-N 1 2 315.244 4.195 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+]Cc2nnc(Cc3ccccc3C)o2)c1 ZINC000452086440 1045772044 /nfs/dbraw/zinc/77/20/44/1045772044.db2.gz MVOYHCUDRHRAAM-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO C[C@@H]1CC/C(=C\C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1 ZINC000753597803 1045772373 /nfs/dbraw/zinc/77/23/73/1045772373.db2.gz COCWBOMAVPVFIV-AUWXEVLLSA-N 1 2 315.804 4.211 20 0 DIADLO c1coc([C@@H]([NH2+]Cc2ccnn2CC2CCC2)c2ccccc2)c1 ZINC000631036692 1045799941 /nfs/dbraw/zinc/79/99/41/1045799941.db2.gz HTUJXYONSVCSBG-FQEVSTJZSA-N 1 2 321.424 4.155 20 0 DIADLO CCOc1cccc([C@@H](C)[NH2+][C@@H]2COc3cc(F)cc(F)c32)c1 ZINC000753764148 1045801969 /nfs/dbraw/zinc/80/19/69/1045801969.db2.gz RLHMAKCRXFVPPM-BDJLRTHQSA-N 1 2 319.351 4.148 20 0 DIADLO Cc1nc(C[NH2+]Cc2oc3ccccc3c2Cl)sc1C ZINC000631081397 1045811970 /nfs/dbraw/zinc/81/19/70/1045811970.db2.gz ORSBKSOQHUCBJL-UHFFFAOYSA-N 1 2 306.818 4.449 20 0 DIADLO FC(F)(F)c1sccc1C[NH2+]Cc1ncc(Cl)s1 ZINC000631190041 1045830514 /nfs/dbraw/zinc/83/05/14/1045830514.db2.gz ZWUAGBWGOKLIJJ-UHFFFAOYSA-N 1 2 312.769 4.167 20 0 DIADLO CC(C)C1CC([NH2+]c2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC000754099109 1045844973 /nfs/dbraw/zinc/84/49/73/1045844973.db2.gz BOXNOZOALWWNKK-SFYZZRBRSA-N 1 2 302.462 4.147 20 0 DIADLO Fc1ccc(-c2cnc(C[N@@H+]3CCC[C@@H]3c3ccccn3)o2)cc1 ZINC000531439674 1045845440 /nfs/dbraw/zinc/84/54/40/1045845440.db2.gz QVZQRKGPSBHECF-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(-c2cnc(C[N@H+]3CCC[C@@H]3c3ccccn3)o2)cc1 ZINC000531439674 1045845463 /nfs/dbraw/zinc/84/54/63/1045845463.db2.gz QVZQRKGPSBHECF-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO C[C@H]1COCCN1c1ccc([NH2+]C2CCC3(CC3)CC2)cc1 ZINC000754103173 1045847006 /nfs/dbraw/zinc/84/70/06/1045847006.db2.gz WAVBDQCCXHGEPZ-HNNXBMFYSA-N 1 2 300.446 4.046 20 0 DIADLO c1oc(-c2ccccc2)nc1C[NH2+]Cc1nccc2ccccc21 ZINC000754325818 1045875522 /nfs/dbraw/zinc/87/55/22/1045875522.db2.gz DRBKWDDYYQERGV-UHFFFAOYSA-N 1 2 315.376 4.180 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1csc(C)n1)c1cccc(OC)c1OC ZINC000631583403 1045876489 /nfs/dbraw/zinc/87/64/89/1045876489.db2.gz XCYPGXKMYJLUQW-FZMZJTMJSA-N 1 2 320.458 4.271 20 0 DIADLO Clc1ccc(Br)c(C[N@@H+]2CCC[C@H]3C[C@H]32)c1 ZINC001137527807 1045884706 /nfs/dbraw/zinc/88/47/06/1045884706.db2.gz WHPMLOVCTAYKAG-TVQRCGJNSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1ccc(Br)c(C[N@H+]2CCC[C@H]3C[C@H]32)c1 ZINC001137527807 1045884722 /nfs/dbraw/zinc/88/47/22/1045884722.db2.gz WHPMLOVCTAYKAG-TVQRCGJNSA-N 1 2 300.627 4.087 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2cc(C(C)C)ccc2Cl)cc1 ZINC001204693954 1045891173 /nfs/dbraw/zinc/89/11/73/1045891173.db2.gz NIZISLUHAWDREB-QGZVFWFLSA-N 1 2 317.816 4.303 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CCCc3ccc(C)cc3)cc2[nH+]1 ZINC000531686776 1045892351 /nfs/dbraw/zinc/89/23/51/1045892351.db2.gz KRRSPTXYZRLNPL-UHFFFAOYSA-N 1 2 307.397 4.141 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@H](C)c3ccc(F)cc3)cc2[nH+]1 ZINC000531686626 1045896294 /nfs/dbraw/zinc/89/62/94/1045896294.db2.gz QCPYQYNSVTWLRM-NSHDSACASA-N 1 2 311.360 4.143 20 0 DIADLO Clc1cccc([C@@H]2CC[N@H+](Cc3cscn3)C2)c1Cl ZINC001137596228 1045903299 /nfs/dbraw/zinc/90/32/99/1045903299.db2.gz MSEPONRRGPGAEI-SNVBAGLBSA-N 1 2 313.253 4.439 20 0 DIADLO Clc1cccc([C@@H]2CC[N@@H+](Cc3cscn3)C2)c1Cl ZINC001137596228 1045903305 /nfs/dbraw/zinc/90/33/05/1045903305.db2.gz MSEPONRRGPGAEI-SNVBAGLBSA-N 1 2 313.253 4.439 20 0 DIADLO CC1(C)C[N@H+](Cc2c(Cl)cncc2Cl)CCC1(F)F ZINC001137603647 1045903601 /nfs/dbraw/zinc/90/36/01/1045903601.db2.gz AJNUJZMKVNQGEI-UHFFFAOYSA-N 1 2 309.187 4.256 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(Cl)cncc2Cl)CCC1(F)F ZINC001137603647 1045903611 /nfs/dbraw/zinc/90/36/11/1045903611.db2.gz AJNUJZMKVNQGEI-UHFFFAOYSA-N 1 2 309.187 4.256 20 0 DIADLO C[N@H+](CCc1ccccc1F)Cc1c(Cl)cncc1Cl ZINC001137610125 1045905486 /nfs/dbraw/zinc/90/54/86/1045905486.db2.gz CPBBCGQTHNDEST-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1ccccc1F)Cc1c(Cl)cncc1Cl ZINC001137610125 1045905512 /nfs/dbraw/zinc/90/55/12/1045905512.db2.gz CPBBCGQTHNDEST-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO Clc1cncc(Cl)c1C[N@@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001137608040 1045906008 /nfs/dbraw/zinc/90/60/08/1045906008.db2.gz HHSRBQJZVOQVIT-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cncc(Cl)c1C[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001137608040 1045906015 /nfs/dbraw/zinc/90/60/15/1045906015.db2.gz HHSRBQJZVOQVIT-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(C)cc2OC)cs1 ZINC000531715792 1045906447 /nfs/dbraw/zinc/90/64/47/1045906447.db2.gz FRQJWHCDSAKZOF-STQMWFEESA-N 1 2 304.459 4.434 20 0 DIADLO CCc1noc(C)c1C[NH2+][C@@H](C)c1nc2ccccc2s1 ZINC000754701771 1045914938 /nfs/dbraw/zinc/91/49/38/1045914938.db2.gz MIRFXHZKKAFJQW-JTQLQIEISA-N 1 2 301.415 4.006 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1csc2ccccc12 ZINC000754746552 1045922942 /nfs/dbraw/zinc/92/29/42/1045922942.db2.gz ZONZMYWYQLNRRB-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cc(Cl)nc(Cl)c2)s1 ZINC000755008792 1045945406 /nfs/dbraw/zinc/94/54/06/1045945406.db2.gz QAAXHKPRXVVLJW-QMMMGPOBSA-N 1 2 302.230 4.004 20 0 DIADLO CCOc1nnc(C[NH2+][C@H](C)c2csc3ccccc23)s1 ZINC000754739027 1045923814 /nfs/dbraw/zinc/92/38/14/1045923814.db2.gz QGFKUJOPEYHHTF-SNVBAGLBSA-N 1 2 319.455 4.002 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2csc3ccccc23)o1 ZINC000754745189 1045923968 /nfs/dbraw/zinc/92/39/68/1045923968.db2.gz VDRVHYHXAIMFGF-LLVKDONJSA-N 1 2 301.415 4.259 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]C2c3ccccc3-c3ccccc32)c2nccn21 ZINC000453075333 1045924459 /nfs/dbraw/zinc/92/44/59/1045924459.db2.gz HLWYHBBXPVCUMB-SCLBCKFNSA-N 1 2 301.393 4.249 20 0 DIADLO COC(=O)c1ccc2c(c1)C[N@@H+](Cc1cc3ccccc3s1)C2 ZINC001137687040 1045934666 /nfs/dbraw/zinc/93/46/66/1045934666.db2.gz ZJVCUIQJZBLAQL-UHFFFAOYSA-N 1 2 323.417 4.204 20 0 DIADLO COC(=O)c1ccc2c(c1)C[N@H+](Cc1cc3ccccc3s1)C2 ZINC001137687040 1045934678 /nfs/dbraw/zinc/93/46/78/1045934678.db2.gz ZJVCUIQJZBLAQL-UHFFFAOYSA-N 1 2 323.417 4.204 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1ccc(-n3cccn3)cc1)C2 ZINC001137760520 1045959252 /nfs/dbraw/zinc/95/92/52/1045959252.db2.gz WZSPKXNXNKYZQO-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1ccc(-n3cccn3)cc1)C2 ZINC001137760520 1045959261 /nfs/dbraw/zinc/95/92/61/1045959261.db2.gz WZSPKXNXNKYZQO-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2ccc(C(C)(C)C)cc2)s1 ZINC000531817821 1045960034 /nfs/dbraw/zinc/96/00/34/1045960034.db2.gz GJEZQTFTOGQUGR-UHFFFAOYSA-N 1 2 303.475 4.249 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)c2nccn21 ZINC000453160308 1045961310 /nfs/dbraw/zinc/96/13/10/1045961310.db2.gz FKQUNSKELVBFGQ-IINYFYTJSA-N 1 2 322.239 4.475 20 0 DIADLO CC[N@H+](Cc1ccc(C)cc1)Cc1cccnc1Br ZINC001137801781 1045968697 /nfs/dbraw/zinc/96/86/97/1045968697.db2.gz JQTRJPHWNWKZHE-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccc(C)cc1)Cc1cccnc1Br ZINC001137801781 1045968703 /nfs/dbraw/zinc/96/87/03/1045968703.db2.gz JQTRJPHWNWKZHE-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000531841938 1045971709 /nfs/dbraw/zinc/97/17/09/1045971709.db2.gz LQWZLRGPRCKDIO-LIRRHRJNSA-N 1 2 317.379 4.273 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000531841938 1045971711 /nfs/dbraw/zinc/97/17/11/1045971711.db2.gz LQWZLRGPRCKDIO-LIRRHRJNSA-N 1 2 317.379 4.273 20 0 DIADLO C[C@@]1(c2ccc(F)cc2)CC[N@H+](Cc2csc(Cl)n2)C1 ZINC000829391039 1045972531 /nfs/dbraw/zinc/97/25/31/1045972531.db2.gz UUXRKLCPUFXZKO-OAHLLOKOSA-N 1 2 310.825 4.099 20 0 DIADLO C[C@@]1(c2ccc(F)cc2)CC[N@@H+](Cc2csc(Cl)n2)C1 ZINC000829391039 1045972542 /nfs/dbraw/zinc/97/25/42/1045972542.db2.gz UUXRKLCPUFXZKO-OAHLLOKOSA-N 1 2 310.825 4.099 20 0 DIADLO C[N@H+](CCC(=O)c1cccs1)Cc1cc(F)ccc1Cl ZINC001138675124 1045973329 /nfs/dbraw/zinc/97/33/29/1045973329.db2.gz MPTUDXAIYHJORE-UHFFFAOYSA-N 1 2 311.809 4.245 20 0 DIADLO C[N@@H+](CCC(=O)c1cccs1)Cc1cc(F)ccc1Cl ZINC001138675124 1045973334 /nfs/dbraw/zinc/97/33/34/1045973334.db2.gz MPTUDXAIYHJORE-UHFFFAOYSA-N 1 2 311.809 4.245 20 0 DIADLO Cc1cccc(OC2CC[NH+](Cc3scnc3Cl)CC2)c1 ZINC001137824095 1045974105 /nfs/dbraw/zinc/97/41/05/1045974105.db2.gz XPROEEQCMKIGCG-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO C[NH+](C)c1ccc(N[C@@H](c2ccccc2)c2ccccn2)cc1 ZINC000193202645 1045978422 /nfs/dbraw/zinc/97/84/22/1045978422.db2.gz UPZKHMWRDCFQJW-FQEVSTJZSA-N 1 2 303.409 4.349 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccc2c(c1)OCCCO2 ZINC000193202724 1045979263 /nfs/dbraw/zinc/97/92/63/1045979263.db2.gz AUAINEQQVPNPLL-CQSZACIVSA-N 1 2 312.413 4.087 20 0 DIADLO CCCn1c(C[NH2+]Cc2ccccc2Cl)nc2ccccc21 ZINC000080145554 1045997015 /nfs/dbraw/zinc/99/70/15/1045997015.db2.gz MMLOVAOMOLVTHQ-UHFFFAOYSA-N 1 2 313.832 4.390 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CCC[C@@H](Oc3ccccc3)C2)cc1F ZINC001137891373 1045999840 /nfs/dbraw/zinc/99/98/40/1045999840.db2.gz MTBYWUHRYQLIMU-OAHLLOKOSA-N 1 2 321.342 4.147 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CCC[C@@H](Oc3ccccc3)C2)cc1F ZINC001137891373 1045999859 /nfs/dbraw/zinc/99/98/59/1045999859.db2.gz MTBYWUHRYQLIMU-OAHLLOKOSA-N 1 2 321.342 4.147 20 0 DIADLO CC[C@H]([NH2+]Cc1csc(N)n1)c1ccc(Cl)cc1Cl ZINC000902489963 1046007804 /nfs/dbraw/zinc/00/78/04/1046007804.db2.gz SYWUWOZKTMVRRB-LBPRGKRZSA-N 1 2 316.257 4.273 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+][C@H](C)C(C)(F)F)cc1OCC ZINC000453289016 1046016116 /nfs/dbraw/zinc/01/61/16/1046016116.db2.gz MDYSZZBCUKAUQA-VXGBXAGGSA-N 1 2 301.377 4.178 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)C(C)(F)F)cc1OCC ZINC000453289011 1046016957 /nfs/dbraw/zinc/01/69/57/1046016957.db2.gz MDYSZZBCUKAUQA-NEPJUHHUSA-N 1 2 301.377 4.178 20 0 DIADLO Fc1ccc(F)c(C[NH+]2CCC3(CC(F)(F)C3)CC2)c1F ZINC001137927378 1046020627 /nfs/dbraw/zinc/02/06/27/1046020627.db2.gz YJGHKQQCCJZKLM-UHFFFAOYSA-N 1 2 305.290 4.115 20 0 DIADLO Cc1ccc2[nH]c([C@H]3CCC[N@@H+]3C[C@@H]3CC3(Cl)Cl)nc2c1 ZINC000829859432 1046020906 /nfs/dbraw/zinc/02/09/06/1046020906.db2.gz RBBSUWXSIGJBTR-SMDDNHRTSA-N 1 2 324.255 4.202 20 0 DIADLO Cc1ccc2[nH]c([C@H]3CCC[N@H+]3C[C@@H]3CC3(Cl)Cl)nc2c1 ZINC000829859432 1046020921 /nfs/dbraw/zinc/02/09/21/1046020921.db2.gz RBBSUWXSIGJBTR-SMDDNHRTSA-N 1 2 324.255 4.202 20 0 DIADLO Cc1ccc2nc([C@H]3CCC[N@@H+]3C[C@@H]3CC3(Cl)Cl)[nH]c2c1 ZINC000829859432 1046020925 /nfs/dbraw/zinc/02/09/25/1046020925.db2.gz RBBSUWXSIGJBTR-SMDDNHRTSA-N 1 2 324.255 4.202 20 0 DIADLO Cc1ccc2nc([C@H]3CCC[N@H+]3C[C@@H]3CC3(Cl)Cl)[nH]c2c1 ZINC000829859432 1046020931 /nfs/dbraw/zinc/02/09/31/1046020931.db2.gz RBBSUWXSIGJBTR-SMDDNHRTSA-N 1 2 324.255 4.202 20 0 DIADLO FC(F)(F)Sc1ccc(C[N@@H+]2CCc3occc3C2)cc1 ZINC001137956240 1046034202 /nfs/dbraw/zinc/03/42/02/1046034202.db2.gz DLRODBSRRYEIHM-UHFFFAOYSA-N 1 2 313.344 4.450 20 0 DIADLO FC(F)(F)Sc1ccc(C[N@H+]2CCc3occc3C2)cc1 ZINC001137956240 1046034219 /nfs/dbraw/zinc/03/42/19/1046034219.db2.gz DLRODBSRRYEIHM-UHFFFAOYSA-N 1 2 313.344 4.450 20 0 DIADLO Cn1cc(Cl)c(C[NH2+][C@@H]2CCCCc3ccc(Cl)cc32)n1 ZINC000453319475 1046035973 /nfs/dbraw/zinc/03/59/73/1046035973.db2.gz LAQTWTSXQFDXIZ-OAHLLOKOSA-N 1 2 324.255 4.284 20 0 DIADLO Oc1cccc2c1CC[N@H+](Cc1cc3ccccc3nc1Cl)C2 ZINC001137972223 1046039892 /nfs/dbraw/zinc/03/98/92/1046039892.db2.gz DMLJTFQMKWKTLR-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1cccc2c1CC[N@@H+](Cc1cc3ccccc3nc1Cl)C2 ZINC001137972223 1046039905 /nfs/dbraw/zinc/03/99/05/1046039905.db2.gz DMLJTFQMKWKTLR-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO CCn1cnc(C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2F)c1 ZINC000902657705 1046040676 /nfs/dbraw/zinc/04/06/76/1046040676.db2.gz GSCVXDPCUNGEOS-SECBINFHSA-N 1 2 316.207 4.200 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1cccc(C(F)(F)F)c1F ZINC001138011530 1046053385 /nfs/dbraw/zinc/05/33/85/1046053385.db2.gz XYQJIJINCXHMSY-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1cccc(C(F)(F)F)c1F ZINC001138011530 1046053371 /nfs/dbraw/zinc/05/33/71/1046053371.db2.gz XYQJIJINCXHMSY-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(C(F)(F)F)c2F)CCC1(F)F ZINC001138007226 1046054226 /nfs/dbraw/zinc/05/42/26/1046054226.db2.gz ZOQOPNLVIVAJFL-SECBINFHSA-N 1 2 311.269 4.322 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2F)CCC1(F)F ZINC001138007226 1046054236 /nfs/dbraw/zinc/05/42/36/1046054236.db2.gz ZOQOPNLVIVAJFL-SECBINFHSA-N 1 2 311.269 4.322 20 0 DIADLO CCc1ncc(COc2ccc(-c3[nH+]cc4n3CCCC4)cc2)o1 ZINC000902739641 1046055539 /nfs/dbraw/zinc/05/55/39/1046055539.db2.gz RXILNEBIGNBFGD-UHFFFAOYSA-N 1 2 323.396 4.016 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3nc(Cl)ncc3C2)c2ccccc12 ZINC001138016241 1046056882 /nfs/dbraw/zinc/05/68/82/1046056882.db2.gz CBBOVWGZKJSQLB-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3nc(Cl)ncc3C2)c2ccccc12 ZINC001138016241 1046056899 /nfs/dbraw/zinc/05/68/99/1046056899.db2.gz CBBOVWGZKJSQLB-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@H](C)c2ccc(C(F)(F)F)cn2)n1 ZINC000902789807 1046069030 /nfs/dbraw/zinc/06/90/30/1046069030.db2.gz NKNLDNKTXMWTKF-NXEZZACHSA-N 1 2 315.364 4.277 20 0 DIADLO CCc1ncc(C[NH2+][C@@H](c2ccccc2)c2ccc(OC)cc2)o1 ZINC000453375738 1046072035 /nfs/dbraw/zinc/07/20/35/1046072035.db2.gz JSNWUIFRKTUUQZ-FQEVSTJZSA-N 1 2 322.408 4.125 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+][C@H]1C[C@@H](C)n2ccnc21 ZINC000453378649 1046072590 /nfs/dbraw/zinc/07/25/90/1046072590.db2.gz ZIIMFHDYXNXHOU-XUJVJEKNSA-N 1 2 319.836 4.292 20 0 DIADLO COc1cccnc1C[NH2+][C@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000453375873 1046072854 /nfs/dbraw/zinc/07/28/54/1046072854.db2.gz UEIMVJNMDIPGDH-ZDUSSCGKSA-N 1 2 323.223 4.174 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1ccc(C(F)(F)F)cn1 ZINC000902792457 1046072953 /nfs/dbraw/zinc/07/29/53/1046072953.db2.gz AHEPDWSTINMHQP-SECBINFHSA-N 1 2 316.273 4.229 20 0 DIADLO CCCn1cc([C@H](C)[NH2+][C@@H](c2ccccc2Cl)C(C)C)nn1 ZINC000902807077 1046073617 /nfs/dbraw/zinc/07/36/17/1046073617.db2.gz VLNLOQIMKXIBPB-SUMWQHHRSA-N 1 2 320.868 4.389 20 0 DIADLO c1cc2n(c1)CC[N@@H+](Cc1cccc(OCc3ccccc3)c1)C2 ZINC001138079374 1046085926 /nfs/dbraw/zinc/08/59/26/1046085926.db2.gz GNWFMBSWRMXGBW-UHFFFAOYSA-N 1 2 318.420 4.083 20 0 DIADLO c1cc2n(c1)CC[N@H+](Cc1cccc(OCc3ccccc3)c1)C2 ZINC001138079374 1046085937 /nfs/dbraw/zinc/08/59/37/1046085937.db2.gz GNWFMBSWRMXGBW-UHFFFAOYSA-N 1 2 318.420 4.083 20 0 DIADLO CC(=O)[C@H]1CCC[N@H+](Cc2cc(C(F)(F)F)ccc2Cl)C1 ZINC001138085492 1046087579 /nfs/dbraw/zinc/08/75/79/1046087579.db2.gz IWFVPKHXZTVICW-NSHDSACASA-N 1 2 319.754 4.160 20 0 DIADLO CC(=O)[C@H]1CCC[N@@H+](Cc2cc(C(F)(F)F)ccc2Cl)C1 ZINC001138085492 1046087592 /nfs/dbraw/zinc/08/75/92/1046087592.db2.gz IWFVPKHXZTVICW-NSHDSACASA-N 1 2 319.754 4.160 20 0 DIADLO CC1(C)C[NH+](Cc2cc(F)ccc2C(F)(F)F)CC(C)(C)O1 ZINC001138093766 1046088971 /nfs/dbraw/zinc/08/89/71/1046088971.db2.gz JKRCDZFXMYUVSP-UHFFFAOYSA-N 1 2 319.342 4.234 20 0 DIADLO Clc1cnc(C[N@@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)cn1 ZINC000830764961 1046099381 /nfs/dbraw/zinc/09/93/81/1046099381.db2.gz NPNSIDDTLGCZRU-KRWDZBQOSA-N 1 2 311.816 4.023 20 0 DIADLO Clc1cnc(C[N@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)cn1 ZINC000830764961 1046099395 /nfs/dbraw/zinc/09/93/95/1046099395.db2.gz NPNSIDDTLGCZRU-KRWDZBQOSA-N 1 2 311.816 4.023 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(Br)cn2)o1 ZINC000453619087 1046101345 /nfs/dbraw/zinc/10/13/45/1046101345.db2.gz WDMGMVDHHHFUNV-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@H]2c2ccc(Br)cn2)o1 ZINC000453619087 1046101355 /nfs/dbraw/zinc/10/13/55/1046101355.db2.gz WDMGMVDHHHFUNV-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO C[C@H](Nc1cnn([C@@H](C)C2CC2)c1)c1cccc(-n2cc[nH+]c2)c1 ZINC000902962580 1046130631 /nfs/dbraw/zinc/13/06/31/1046130631.db2.gz HJRODWGMVPLESE-GJZGRUSLSA-N 1 2 321.428 4.213 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[NH2+]Cc1csc(C)n1 ZINC000903072137 1046154245 /nfs/dbraw/zinc/15/42/45/1046154245.db2.gz CJYWIIKZDKRVET-AWEZNQCLSA-N 1 2 322.861 4.281 20 0 DIADLO COc1ccc2c(c1Cl)[C@@H]([NH2+]Cc1csc(C)n1)CCC2 ZINC000903072481 1046154292 /nfs/dbraw/zinc/15/42/92/1046154292.db2.gz DOEBJWJUIBMEKP-ZDUSSCGKSA-N 1 2 322.861 4.281 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1c(F)cccc1OC ZINC001138385425 1046161591 /nfs/dbraw/zinc/16/15/91/1046161591.db2.gz QIPNTIFWZFYVOI-ZDUSSCGKSA-N 1 2 303.377 4.036 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1c(F)cccc1OC ZINC001138385425 1046161596 /nfs/dbraw/zinc/16/15/96/1046161596.db2.gz QIPNTIFWZFYVOI-ZDUSSCGKSA-N 1 2 303.377 4.036 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(C(F)(F)F)s1 ZINC000717968470 1046163109 /nfs/dbraw/zinc/16/31/09/1046163109.db2.gz ODZJDARSHKGPCA-SSDOTTSWSA-N 1 2 323.771 4.005 20 0 DIADLO c1csc([C@H]([NH2+]Cc2ccon2)c2ccc3c(c2)CCCC3)c1 ZINC000634950869 1046165220 /nfs/dbraw/zinc/16/52/20/1046165220.db2.gz FWKFYDGCESMQFA-LJQANCHMSA-N 1 2 324.449 4.494 20 0 DIADLO Cc1ccc(C[NH2+]Cc2ccon2)c(O[C@H](C)CC(C)C)c1 ZINC000634967920 1046166590 /nfs/dbraw/zinc/16/65/90/1046166590.db2.gz AILDJOPNPSVICT-OAHLLOKOSA-N 1 2 302.418 4.086 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3ncc(Cl)cc3C2)c(C)c1 ZINC001138437678 1046182791 /nfs/dbraw/zinc/18/27/91/1046182791.db2.gz XKXMVIBHTGRWGW-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3ncc(Cl)cc3C2)c(C)c1 ZINC001138437678 1046182798 /nfs/dbraw/zinc/18/27/98/1046182798.db2.gz XKXMVIBHTGRWGW-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO Cc1nsc(C)c1C[N@@H+]1CCc2c(F)cc(F)cc2[C@@H]1C ZINC001168153235 1046183161 /nfs/dbraw/zinc/18/31/61/1046183161.db2.gz FIMGEBFWFPXSMV-JTQLQIEISA-N 1 2 308.397 4.157 20 0 DIADLO Cc1nsc(C)c1C[N@H+]1CCc2c(F)cc(F)cc2[C@@H]1C ZINC001168153235 1046183168 /nfs/dbraw/zinc/18/31/68/1046183168.db2.gz FIMGEBFWFPXSMV-JTQLQIEISA-N 1 2 308.397 4.157 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2nccc3c2CCCC3)cs1 ZINC000903181538 1046184537 /nfs/dbraw/zinc/18/45/37/1046184537.db2.gz KJZGXEGUPIXKSB-CYBMUJFWSA-N 1 2 315.486 4.391 20 0 DIADLO c1coc([C@@H]([NH2+]Cc2nccc3c2CCCC3)c2ccccc2)c1 ZINC000903182633 1046185237 /nfs/dbraw/zinc/18/52/37/1046185237.db2.gz SWRZRHZWRUNJEL-NRFANRHFSA-N 1 2 318.420 4.433 20 0 DIADLO COc1c(Cl)cc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)cc1Cl ZINC001138473381 1046194167 /nfs/dbraw/zinc/19/41/67/1046194167.db2.gz XGQRIDUZZYKCKR-VIFPVBQESA-N 1 2 324.198 4.479 20 0 DIADLO COc1c(Cl)cc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)cc1Cl ZINC001138473381 1046194178 /nfs/dbraw/zinc/19/41/78/1046194178.db2.gz XGQRIDUZZYKCKR-VIFPVBQESA-N 1 2 324.198 4.479 20 0 DIADLO C[C@@H]1C[C@@H](C)[C@@H](C)[N@H+](CCC(=O)Nc2ccccc2Cl)C1 ZINC000475745650 1046195242 /nfs/dbraw/zinc/19/52/42/1046195242.db2.gz GIULNGURHYRDKQ-MGPQQGTHSA-N 1 2 308.853 4.035 20 0 DIADLO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](CCC(=O)Nc2ccccc2Cl)C1 ZINC000475745650 1046195251 /nfs/dbraw/zinc/19/52/51/1046195251.db2.gz GIULNGURHYRDKQ-MGPQQGTHSA-N 1 2 308.853 4.035 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1cc(OC)no1 ZINC000925262575 1046196934 /nfs/dbraw/zinc/19/69/34/1046196934.db2.gz NOWDAUDWHHOKHP-KBPBESRZSA-N 1 2 318.417 4.020 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1CCC(=O)[C@@H](C)C12CCCC2 ZINC001138483521 1046197048 /nfs/dbraw/zinc/19/70/48/1046197048.db2.gz JSAOECAZPWRNJP-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1CCC(=O)[C@@H](C)C12CCCC2 ZINC001138483521 1046197054 /nfs/dbraw/zinc/19/70/54/1046197054.db2.gz JSAOECAZPWRNJP-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO CN(C)c1ccc(C[N@@H+]2CCc3c4ccccc4oc3C2)s1 ZINC001138493652 1046199299 /nfs/dbraw/zinc/19/92/99/1046199299.db2.gz RRUYCMHWPQYBIC-UHFFFAOYSA-N 1 2 312.438 4.119 20 0 DIADLO CN(C)c1ccc(C[N@H+]2CCc3c4ccccc4oc3C2)s1 ZINC001138493652 1046199305 /nfs/dbraw/zinc/19/93/05/1046199305.db2.gz RRUYCMHWPQYBIC-UHFFFAOYSA-N 1 2 312.438 4.119 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cnc(Cl)c(C)c1 ZINC000780395554 1046199567 /nfs/dbraw/zinc/19/95/67/1046199567.db2.gz PJNFJGKKBQKNPR-UHFFFAOYSA-N 1 2 318.783 4.164 20 0 DIADLO COc1ccc(C)cc1C[N@H+](CC(=O)c1ccccc1)C(C)C ZINC001138487079 1046200030 /nfs/dbraw/zinc/20/00/30/1046200030.db2.gz CXJQEBLPFBSDBF-UHFFFAOYSA-N 1 2 311.425 4.097 20 0 DIADLO COc1ccc(C)cc1C[N@@H+](CC(=O)c1ccccc1)C(C)C ZINC001138487079 1046200039 /nfs/dbraw/zinc/20/00/39/1046200039.db2.gz CXJQEBLPFBSDBF-UHFFFAOYSA-N 1 2 311.425 4.097 20 0 DIADLO COc1ccc2[nH]cc(C[N@@H+]3Cc4ccc(Cl)cc4C3)c2c1 ZINC001138509362 1046203217 /nfs/dbraw/zinc/20/32/17/1046203217.db2.gz BQVLPRAJRTXIDH-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccc2[nH]cc(C[N@H+]3Cc4ccc(Cl)cc4C3)c2c1 ZINC001138509362 1046203229 /nfs/dbraw/zinc/20/32/29/1046203229.db2.gz BQVLPRAJRTXIDH-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1ccc(-c2ccc[nH]2)cc1)n1cc[nH+]c1 ZINC000635768131 1046204321 /nfs/dbraw/zinc/20/43/21/1046204321.db2.gz YGFVSZRCJGRKBD-GOSISDBHSA-N 1 2 322.412 4.104 20 0 DIADLO COc1c(Cl)cccc1C[NH2+][C@H](C)c1cc(O)ccc1F ZINC000903247331 1046208062 /nfs/dbraw/zinc/20/80/62/1046208062.db2.gz UFAQRXHKACCUOK-SNVBAGLBSA-N 1 2 309.768 4.044 20 0 DIADLO Cc1ccc(-c2ccc(C)c(NC(=O)[C@@H]3C[C@H]3c3c[nH]c[nH+]3)c2)o1 ZINC000635881044 1046209017 /nfs/dbraw/zinc/20/90/17/1046209017.db2.gz RQHSTDGNCFLOPB-HUUCEWRRSA-N 1 2 321.380 4.029 20 0 DIADLO Cc1ccc(-c2ccc(C)c(NC(=O)[C@@H]3C[C@H]3c3c[nH+]c[nH]3)c2)o1 ZINC000635881044 1046209031 /nfs/dbraw/zinc/20/90/31/1046209031.db2.gz RQHSTDGNCFLOPB-HUUCEWRRSA-N 1 2 321.380 4.029 20 0 DIADLO CCc1nc(C)c([C@H](C)[NH2+][C@@H]2c3ccccc3OC[C@H]2F)s1 ZINC000903270383 1046214960 /nfs/dbraw/zinc/21/49/60/1046214960.db2.gz DKOMICPRRXIUKH-NORZTCDRSA-N 1 2 320.433 4.136 20 0 DIADLO CCCc1ccc(C[NH+]2Cc3cc(OC)c(OC)cc3C2)s1 ZINC001138529298 1046215393 /nfs/dbraw/zinc/21/53/93/1046215393.db2.gz SMHWZBTYNPUOLR-UHFFFAOYSA-N 1 2 317.454 4.234 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1c(C)cc(C)cc1C ZINC000102518899 1046218102 /nfs/dbraw/zinc/21/81/02/1046218102.db2.gz AJILBGOOCHQEME-INIZCTEOSA-N 1 2 314.429 4.054 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1c(C)cc(C)cc1C ZINC000102518899 1046218114 /nfs/dbraw/zinc/21/81/14/1046218114.db2.gz AJILBGOOCHQEME-INIZCTEOSA-N 1 2 314.429 4.054 20 0 DIADLO CCc1nc(C)c([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)s1 ZINC000903313587 1046235334 /nfs/dbraw/zinc/23/53/34/1046235334.db2.gz UFOYZRNFJDLPFC-SNVBAGLBSA-N 1 2 307.463 4.150 20 0 DIADLO CC[C@@H]([NH2+][C@@H](c1ncccn1)C1CC1)c1sccc1Cl ZINC000903321990 1046237707 /nfs/dbraw/zinc/23/77/07/1046237707.db2.gz FITFRKHDVXBECC-CHWSQXEVSA-N 1 2 307.850 4.384 20 0 DIADLO CCC[C@@H]([NH2+][C@H](C)c1cn(C(C)C)nn1)c1ccc(F)cc1F ZINC000925265489 1046237832 /nfs/dbraw/zinc/23/78/32/1046237832.db2.gz UKRSJDVVSWZWQO-MLGOLLRUSA-N 1 2 322.403 4.329 20 0 DIADLO Cc1ccc2cc([C@H](C)[NH2+][C@H](c3ncccn3)C3CC3)oc2c1 ZINC000903324234 1046238853 /nfs/dbraw/zinc/23/88/53/1046238853.db2.gz CWOSZCBCJDUSEX-UGSOOPFHSA-N 1 2 307.397 4.333 20 0 DIADLO Clc1ccc2c(c1)CC[N@@H+](Cc1cnn(-c3ccccc3)c1)C2 ZINC001138602729 1046239838 /nfs/dbraw/zinc/23/98/38/1046239838.db2.gz MWBCOTAMBKCGJD-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1ccc2c(c1)CC[N@H+](Cc1cnn(-c3ccccc3)c1)C2 ZINC001138602729 1046239852 /nfs/dbraw/zinc/23/98/52/1046239852.db2.gz MWBCOTAMBKCGJD-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO C[C@H]1C[C@@H]([NH2+][C@H](c2ncccn2)C2CC2)c2ccsc2S1 ZINC000903327609 1046240593 /nfs/dbraw/zinc/24/05/93/1046240593.db2.gz WRRSZXIHXLRNCC-GDLCADMTSA-N 1 2 317.483 4.204 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+][C@@H](C)c1cn(C(C)C)nn1)C(C)(C)C ZINC000903328879 1046241577 /nfs/dbraw/zinc/24/15/77/1046241577.db2.gz PRUTUBQXEQHXIJ-WMLDXEAASA-N 1 2 315.465 4.000 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H](c1ncccn1)C1CC1 ZINC000903331950 1046244580 /nfs/dbraw/zinc/24/45/80/1046244580.db2.gz LBSSIGFMIZZCGU-CXAGYDPISA-N 1 2 307.397 4.333 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1F ZINC000102639238 1046244673 /nfs/dbraw/zinc/24/46/73/1046244673.db2.gz UCCMPDMXLSSSBH-CYBMUJFWSA-N 1 2 323.371 4.348 20 0 DIADLO CC[C@@H]([NH2+][C@H]1CCCc2scnc21)c1cc(F)ccc1OC ZINC000903370367 1046259586 /nfs/dbraw/zinc/25/95/86/1046259586.db2.gz FZDVFCZJLGQPSB-KGLIPLIRSA-N 1 2 320.433 4.409 20 0 DIADLO CN(C)c1cc[nH+]c(NC(=S)Nc2ccc3ccccc3c2)c1 ZINC000783765330 1046261538 /nfs/dbraw/zinc/26/15/38/1046261538.db2.gz ZRSVGZYIDGDLBV-UHFFFAOYSA-N 1 2 322.437 4.110 20 0 DIADLO COc1cc(C[N@H+](C)Cc2cc(F)ccc2Cl)cc(OC)c1 ZINC001138673124 1046263409 /nfs/dbraw/zinc/26/34/09/1046263409.db2.gz WQERGSYXKXDUME-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2cc(F)ccc2Cl)cc(OC)c1 ZINC001138673124 1046263418 /nfs/dbraw/zinc/26/34/18/1046263418.db2.gz WQERGSYXKXDUME-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccc(C(F)(F)F)s2)cc1 ZINC000758381762 1046264399 /nfs/dbraw/zinc/26/43/99/1046264399.db2.gz LGYTUXNWEPSHCR-UHFFFAOYSA-N 1 2 300.349 4.445 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H]2CCCc3[nH]ncc32)cc2ccccc21 ZINC000903413303 1046271295 /nfs/dbraw/zinc/27/12/95/1046271295.db2.gz KGFVAWNKDYIYFG-UGSOOPFHSA-N 1 2 321.424 4.300 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cc1OC ZINC000637813558 1046279733 /nfs/dbraw/zinc/27/97/33/1046279733.db2.gz BWOWPLLFYCBRJX-HNNXBMFYSA-N 1 2 320.820 4.022 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CCC[C@H]2c2ccc[nH]2)cc1OC ZINC000637813558 1046279745 /nfs/dbraw/zinc/27/97/45/1046279745.db2.gz BWOWPLLFYCBRJX-HNNXBMFYSA-N 1 2 320.820 4.022 20 0 DIADLO CCc1cccc2cc(C[NH+]3CC(C(F)F)C3)c(Cl)nc21 ZINC001138730675 1046281028 /nfs/dbraw/zinc/28/10/28/1046281028.db2.gz ITEMHYJWFULFIZ-UHFFFAOYSA-N 1 2 310.775 4.148 20 0 DIADLO COCCc1ncc(C[N@H+](C)[C@H](C)c2ccccc2Cl)s1 ZINC000637901121 1046284016 /nfs/dbraw/zinc/28/40/16/1046284016.db2.gz IYJZHJZAVPAMRF-GFCCVEGCSA-N 1 2 324.877 4.178 20 0 DIADLO COCCc1ncc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)s1 ZINC000637901121 1046284027 /nfs/dbraw/zinc/28/40/27/1046284027.db2.gz IYJZHJZAVPAMRF-GFCCVEGCSA-N 1 2 324.877 4.178 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@H+](Cc2coc(-c3ccccc3)n2)C1 ZINC000170755189 1046285911 /nfs/dbraw/zinc/28/59/11/1046285911.db2.gz ZCOUSCHNJLWEHE-CYBMUJFWSA-N 1 2 310.319 4.116 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2coc(-c3ccccc3)n2)C1 ZINC000170755189 1046285923 /nfs/dbraw/zinc/28/59/23/1046285923.db2.gz ZCOUSCHNJLWEHE-CYBMUJFWSA-N 1 2 310.319 4.116 20 0 DIADLO CCCCc1ccc(C[N@@H+]2CCO[C@@H](c3ccccn3)C2)s1 ZINC001138756519 1046289776 /nfs/dbraw/zinc/28/97/76/1046289776.db2.gz FGAOALUOELXXOW-GOSISDBHSA-N 1 2 316.470 4.059 20 0 DIADLO CCCCc1ccc(C[N@H+]2CCO[C@@H](c3ccccn3)C2)s1 ZINC001138756519 1046289788 /nfs/dbraw/zinc/28/97/88/1046289788.db2.gz FGAOALUOELXXOW-GOSISDBHSA-N 1 2 316.470 4.059 20 0 DIADLO c1coc([C@H]2[N@H+](Cc3cccc4nsnc43)CC23CCC3)c1 ZINC000832230985 1046290586 /nfs/dbraw/zinc/29/05/86/1046290586.db2.gz HJFOQWDZCRSEOQ-MRXNPFEDSA-N 1 2 311.410 4.012 20 0 DIADLO c1coc([C@H]2[N@@H+](Cc3cccc4nsnc43)CC23CCC3)c1 ZINC000832230985 1046290597 /nfs/dbraw/zinc/29/05/97/1046290597.db2.gz HJFOQWDZCRSEOQ-MRXNPFEDSA-N 1 2 311.410 4.012 20 0 DIADLO c1coc([C@@H]2[N@H+](Cc3cccc4nsnc43)CC23CCC3)c1 ZINC000832230984 1046292493 /nfs/dbraw/zinc/29/24/93/1046292493.db2.gz HJFOQWDZCRSEOQ-INIZCTEOSA-N 1 2 311.410 4.012 20 0 DIADLO c1coc([C@@H]2[N@@H+](Cc3cccc4nsnc43)CC23CCC3)c1 ZINC000832230984 1046292500 /nfs/dbraw/zinc/29/25/00/1046292500.db2.gz HJFOQWDZCRSEOQ-INIZCTEOSA-N 1 2 311.410 4.012 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccnc(Cl)c1 ZINC001138821633 1046300804 /nfs/dbraw/zinc/30/08/04/1046300804.db2.gz YCEAYDZYVWAHQB-MRXNPFEDSA-N 1 2 316.832 4.218 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccnc(Cl)c1 ZINC001138821633 1046300824 /nfs/dbraw/zinc/30/08/24/1046300824.db2.gz YCEAYDZYVWAHQB-MRXNPFEDSA-N 1 2 316.832 4.218 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1c[nH]c3c1cccc3Cl)C2 ZINC001138833690 1046307417 /nfs/dbraw/zinc/30/74/17/1046307417.db2.gz KCZOMADLNSZBHZ-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1c[nH]c3c1cccc3Cl)C2 ZINC001138833690 1046307429 /nfs/dbraw/zinc/30/74/29/1046307429.db2.gz KCZOMADLNSZBHZ-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1cccs1)c1ccccn1 ZINC000089796930 1046314471 /nfs/dbraw/zinc/31/44/71/1046314471.db2.gz FMOIHIOHXMLZPP-GOSISDBHSA-N 1 2 310.422 4.031 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1ccc(C)s1)c1ccccn1 ZINC000089797076 1046314500 /nfs/dbraw/zinc/31/45/00/1046314500.db2.gz BSBRZKGWOJBMMG-IBGZPJMESA-N 1 2 324.449 4.339 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1csc(C(C)(C)O)n1 ZINC000832379405 1046315403 /nfs/dbraw/zinc/31/54/03/1046315403.db2.gz JKHQKWCPEYJAFM-HNNXBMFYSA-N 1 2 322.449 4.093 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1csc(C(C)(C)O)n1 ZINC000832379405 1046315416 /nfs/dbraw/zinc/31/54/16/1046315416.db2.gz JKHQKWCPEYJAFM-HNNXBMFYSA-N 1 2 322.449 4.093 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cc(F)cnc1Cl ZINC001138895885 1046320990 /nfs/dbraw/zinc/32/09/90/1046320990.db2.gz MCTHEHPHTIPQBD-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(F)cnc1Cl ZINC001138895885 1046321002 /nfs/dbraw/zinc/32/10/02/1046321002.db2.gz MCTHEHPHTIPQBD-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H](c1nnc[nH]1)C1CCCCC1 ZINC000638426749 1046322408 /nfs/dbraw/zinc/32/24/08/1046322408.db2.gz WEEZQSWGDRCSHG-ROUUACIJSA-N 1 2 310.445 4.012 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)cc1C ZINC000638446782 1046324170 /nfs/dbraw/zinc/32/41/70/1046324170.db2.gz ZBCNDDPNWBUHGS-CRAIPNDOSA-N 1 2 312.461 4.394 20 0 DIADLO CCC(=CC(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1)CC ZINC000759161734 1046326874 /nfs/dbraw/zinc/32/68/74/1046326874.db2.gz LUROUKFNGVLJRQ-ZDUSSCGKSA-N 1 2 321.490 4.060 20 0 DIADLO CCC(=CC(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1)CC ZINC000759161734 1046326890 /nfs/dbraw/zinc/32/68/90/1046326890.db2.gz LUROUKFNGVLJRQ-ZDUSSCGKSA-N 1 2 321.490 4.060 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1nc2ccccc2o1 ZINC000246220363 1046328703 /nfs/dbraw/zinc/32/87/03/1046328703.db2.gz YXOVOPJXRLVOKM-SXGZJXTBSA-N 1 2 322.408 4.178 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1nc2ccccc2o1 ZINC000246220363 1046328712 /nfs/dbraw/zinc/32/87/12/1046328712.db2.gz YXOVOPJXRLVOKM-SXGZJXTBSA-N 1 2 322.408 4.178 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(Br)cnc1Cl ZINC001138942353 1046331540 /nfs/dbraw/zinc/33/15/40/1046331540.db2.gz YXFQNOCEEAORIZ-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cc(Br)cnc1Cl ZINC001138942353 1046331550 /nfs/dbraw/zinc/33/15/50/1046331550.db2.gz YXFQNOCEEAORIZ-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2CCSC[C@H]2c2cccc3ccccc32)n1 ZINC001138943132 1046332757 /nfs/dbraw/zinc/33/27/57/1046332757.db2.gz YJKLINGHQLUSJZ-SFHVURJKSA-N 1 2 323.465 4.161 20 0 DIADLO Cc1c[nH]c(C[N@H+]2CCSC[C@H]2c2cccc3ccccc32)n1 ZINC001138943132 1046332768 /nfs/dbraw/zinc/33/27/68/1046332768.db2.gz YJKLINGHQLUSJZ-SFHVURJKSA-N 1 2 323.465 4.161 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@@H]1CC1(F)F ZINC000638803650 1046342593 /nfs/dbraw/zinc/34/25/93/1046342593.db2.gz GSMLJPICLVPFKF-DOMZBBRYSA-N 1 2 315.367 4.057 20 0 DIADLO COc1ccc(C[NH+](Cc2ccco2)Cc2ccco2)cc1F ZINC000053138502 1046349110 /nfs/dbraw/zinc/34/91/10/1046349110.db2.gz AEBRVFSPYUICPI-UHFFFAOYSA-N 1 2 315.344 4.223 20 0 DIADLO CCCOc1ccccc1C[N@H+](C)Cc1nc2ccccc2o1 ZINC001138998493 1046352036 /nfs/dbraw/zinc/35/20/36/1046352036.db2.gz KYBLEYLYZJQEMN-UHFFFAOYSA-N 1 2 310.397 4.249 20 0 DIADLO CCCOc1ccccc1C[N@@H+](C)Cc1nc2ccccc2o1 ZINC001138998493 1046352048 /nfs/dbraw/zinc/35/20/48/1046352048.db2.gz KYBLEYLYZJQEMN-UHFFFAOYSA-N 1 2 310.397 4.249 20 0 DIADLO COc1cccc([C@H]2C[C@H]([N@H+](C)C/C(Cl)=C/Cl)C2)c1 ZINC000832580324 1046352850 /nfs/dbraw/zinc/35/28/50/1046352850.db2.gz QFPITACWEBZRIR-FQNMHCGOSA-N 1 2 300.229 4.192 20 0 DIADLO COc1cccc([C@H]2C[C@H]([N@@H+](C)C/C(Cl)=C/Cl)C2)c1 ZINC000832580324 1046352865 /nfs/dbraw/zinc/35/28/65/1046352865.db2.gz QFPITACWEBZRIR-FQNMHCGOSA-N 1 2 300.229 4.192 20 0 DIADLO O=C(Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CC2(CC2)C1 ZINC000666456483 1046352868 /nfs/dbraw/zinc/35/28/68/1046352868.db2.gz LLSVBURRBFQUIC-UHFFFAOYSA-N 1 2 321.424 4.015 20 0 DIADLO CCCOc1ccccc1C[N@H+](C)Cc1cccc(F)c1F ZINC001138998966 1046353390 /nfs/dbraw/zinc/35/33/90/1046353390.db2.gz SIRXZVQDGGUGNU-UHFFFAOYSA-N 1 2 305.368 4.386 20 0 DIADLO CCCOc1ccccc1C[N@@H+](C)Cc1cccc(F)c1F ZINC001138998966 1046353403 /nfs/dbraw/zinc/35/34/03/1046353403.db2.gz SIRXZVQDGGUGNU-UHFFFAOYSA-N 1 2 305.368 4.386 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC001139011099 1046355285 /nfs/dbraw/zinc/35/52/85/1046355285.db2.gz MENVFMGPNOUXKH-CYBMUJFWSA-N 1 2 304.821 4.117 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@H+]1CCn2cccc2[C@H]1C ZINC001139011099 1046355300 /nfs/dbraw/zinc/35/53/00/1046355300.db2.gz MENVFMGPNOUXKH-CYBMUJFWSA-N 1 2 304.821 4.117 20 0 DIADLO CC1=C(C)C[C@H]([C@H](C)[NH2+][C@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000639062622 1046357446 /nfs/dbraw/zinc/35/74/46/1046357446.db2.gz RNFAQEQCDDBULP-JQHSSLGASA-N 1 2 310.445 4.009 20 0 DIADLO COc1ccccc1-c1ccc(C[N@@H+]2C[C@@H](F)C[C@H]2CF)cc1 ZINC001139033968 1046365787 /nfs/dbraw/zinc/36/57/87/1046365787.db2.gz RZEORJJHSHUYAH-IRXDYDNUSA-N 1 2 317.379 4.244 20 0 DIADLO COc1ccccc1-c1ccc(C[N@H+]2C[C@@H](F)C[C@H]2CF)cc1 ZINC001139033968 1046365799 /nfs/dbraw/zinc/36/57/99/1046365799.db2.gz RZEORJJHSHUYAH-IRXDYDNUSA-N 1 2 317.379 4.244 20 0 DIADLO Cn1ccnc1[C@@H](C1CC1)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000639184909 1046367824 /nfs/dbraw/zinc/36/78/24/1046367824.db2.gz ZWNPBKITEFKPSR-HUUCEWRRSA-N 1 2 301.459 4.016 20 0 DIADLO Cn1ccnc1[C@@H](C1CC1)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000639184909 1046367838 /nfs/dbraw/zinc/36/78/38/1046367838.db2.gz ZWNPBKITEFKPSR-HUUCEWRRSA-N 1 2 301.459 4.016 20 0 DIADLO Cc1ccccc1C1([NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)CC1 ZINC000639281230 1046377406 /nfs/dbraw/zinc/37/74/06/1046377406.db2.gz FQDIZLFVWYYJSQ-QGZVFWFLSA-N 1 2 310.445 4.013 20 0 DIADLO CC[C@H]([NH2+][C@H](c1nnc[nH]1)C1CCCCC1)c1ccccc1F ZINC000639296104 1046378811 /nfs/dbraw/zinc/37/88/11/1046378811.db2.gz OZVKUTFYDOBDNB-IRXDYDNUSA-N 1 2 316.424 4.306 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)c1ccccc1F ZINC000639296097 1046379417 /nfs/dbraw/zinc/37/94/17/1046379417.db2.gz OZVKUTFYDOBDNB-DLBZAZTESA-N 1 2 316.424 4.306 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(Br)nc2Cl)[C@@H](C)C1 ZINC001139112025 1046386524 /nfs/dbraw/zinc/38/65/24/1046386524.db2.gz HLQFZCBJGJAZDK-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(Br)nc2Cl)[C@@H](C)C1 ZINC001139112025 1046386539 /nfs/dbraw/zinc/38/65/39/1046386539.db2.gz HLQFZCBJGJAZDK-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ccc(Br)nc2Cl)[C@H]1C ZINC001139112600 1046389426 /nfs/dbraw/zinc/38/94/26/1046389426.db2.gz SDKKHKBWHWNMEN-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ccc(Br)nc2Cl)[C@H]1C ZINC001139112600 1046389441 /nfs/dbraw/zinc/38/94/41/1046389441.db2.gz SDKKHKBWHWNMEN-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@@](C)(F)C2)c(Cl)c1OC ZINC001139115431 1046389656 /nfs/dbraw/zinc/38/96/56/1046389656.db2.gz ZOJLRCGEFMRTIF-MRXNPFEDSA-N 1 2 315.816 4.071 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@@](C)(F)C2)c(Cl)c1OC ZINC001139115431 1046389668 /nfs/dbraw/zinc/38/96/68/1046389668.db2.gz ZOJLRCGEFMRTIF-MRXNPFEDSA-N 1 2 315.816 4.071 20 0 DIADLO Cc1nc(-c2ccccc2)oc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC000639438886 1046401599 /nfs/dbraw/zinc/40/15/99/1046401599.db2.gz BAMYRWLXWVLFDZ-OAHLLOKOSA-N 1 2 307.397 4.028 20 0 DIADLO Cc1nc(-c2ccccc2)oc1C[N@H+]1CCn2cccc2[C@H]1C ZINC000639438886 1046401607 /nfs/dbraw/zinc/40/16/07/1046401607.db2.gz BAMYRWLXWVLFDZ-OAHLLOKOSA-N 1 2 307.397 4.028 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)CC(=O)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000639462273 1046403469 /nfs/dbraw/zinc/40/34/69/1046403469.db2.gz UEEJPYLMJWEJLS-RWMBFGLXSA-N 1 2 317.351 4.210 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)CC(=O)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000639462273 1046403473 /nfs/dbraw/zinc/40/34/73/1046403473.db2.gz UEEJPYLMJWEJLS-RWMBFGLXSA-N 1 2 317.351 4.210 20 0 DIADLO CCCCc1nc(Cl)c(C[N@@H+]2CCCc3ccccc3C2)[nH]1 ZINC001139180999 1046404051 /nfs/dbraw/zinc/40/40/51/1046404051.db2.gz JJKLPYTUNBCMGA-UHFFFAOYSA-N 1 2 317.864 4.354 20 0 DIADLO CCCCc1nc(Cl)c(C[N@H+]2CCCc3ccccc3C2)[nH]1 ZINC001139180999 1046404055 /nfs/dbraw/zinc/40/40/55/1046404055.db2.gz JJKLPYTUNBCMGA-UHFFFAOYSA-N 1 2 317.864 4.354 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1csc(-c2ccoc2)n1 ZINC000170983475 1046404382 /nfs/dbraw/zinc/40/43/82/1046404382.db2.gz JQVGWUNFCVXINF-INIZCTEOSA-N 1 2 313.426 4.079 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1csc(-c2ccoc2)n1 ZINC000170983475 1046404387 /nfs/dbraw/zinc/40/43/87/1046404387.db2.gz JQVGWUNFCVXINF-INIZCTEOSA-N 1 2 313.426 4.079 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1csc(-c2ccoc2)n1 ZINC000170983477 1046406214 /nfs/dbraw/zinc/40/62/14/1046406214.db2.gz JQVGWUNFCVXINF-MRXNPFEDSA-N 1 2 313.426 4.079 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1csc(-c2ccoc2)n1 ZINC000170983477 1046406222 /nfs/dbraw/zinc/40/62/22/1046406222.db2.gz JQVGWUNFCVXINF-MRXNPFEDSA-N 1 2 313.426 4.079 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@H+](Cc2csc(-c3ccoc3)n2)C1 ZINC000170983387 1046406494 /nfs/dbraw/zinc/40/64/94/1046406494.db2.gz RLGQQEOFFNWFGT-NSHDSACASA-N 1 2 316.348 4.177 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@@H+](Cc2csc(-c3ccoc3)n2)C1 ZINC000170983387 1046406501 /nfs/dbraw/zinc/40/65/01/1046406501.db2.gz RLGQQEOFFNWFGT-NSHDSACASA-N 1 2 316.348 4.177 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2nc(C3CCC3)no2)C2CCC2)cc1 ZINC000639529589 1046409495 /nfs/dbraw/zinc/40/94/95/1046409495.db2.gz JBSBVPHHTGASRL-KRWDZBQOSA-N 1 2 315.392 4.107 20 0 DIADLO FC[C@@H]([NH2+]Cc1ccccc1OC1CC1)c1ccc(F)cc1 ZINC000640155290 1046422795 /nfs/dbraw/zinc/42/27/95/1046422795.db2.gz SLOBFDUYROBRKC-QGZVFWFLSA-N 1 2 303.352 4.167 20 0 DIADLO COc1ccc2cc(C[N@@H+]3CCC[C@@](C)(F)C3)c(Cl)nc2c1 ZINC001139310489 1046429728 /nfs/dbraw/zinc/42/97/28/1046429728.db2.gz LGRUZPCSRJITOH-QGZVFWFLSA-N 1 2 322.811 4.221 20 0 DIADLO COc1ccc2cc(C[N@H+]3CCC[C@@](C)(F)C3)c(Cl)nc2c1 ZINC001139310489 1046429733 /nfs/dbraw/zinc/42/97/33/1046429733.db2.gz LGRUZPCSRJITOH-QGZVFWFLSA-N 1 2 322.811 4.221 20 0 DIADLO FC(F)(F)c1nn(Cc2ccc(Cl)s2)c2cc[nH+]cc21 ZINC000749151318 1046433817 /nfs/dbraw/zinc/43/38/17/1046433817.db2.gz QLFRTAUROXNJOY-UHFFFAOYSA-N 1 2 317.723 4.213 20 0 DIADLO CCc1oc2ccccc2c1C[NH2+]Cc1ncc(Cl)s1 ZINC000719462407 1046434979 /nfs/dbraw/zinc/43/49/79/1046434979.db2.gz SXWFXJGCNCSYMJ-UHFFFAOYSA-N 1 2 306.818 4.395 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@H+]1Cc1ccncc1Cl ZINC001168234635 1046435695 /nfs/dbraw/zinc/43/56/95/1046435695.db2.gz NGSLAGCLMROULC-NWDGAFQWSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@@H+]1Cc1ccncc1Cl ZINC001168234635 1046435701 /nfs/dbraw/zinc/43/57/01/1046435701.db2.gz NGSLAGCLMROULC-NWDGAFQWSA-N 1 2 304.796 4.382 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCc3ccc(F)cc3C2)c1 ZINC001137265218 1046437862 /nfs/dbraw/zinc/43/78/62/1046437862.db2.gz UATXFWQDTKWWLJ-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCc3ccc(F)cc3C2)c1 ZINC001137265218 1046437866 /nfs/dbraw/zinc/43/78/66/1046437866.db2.gz UATXFWQDTKWWLJ-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CC1(C)CN(Cc2c[nH+]cn2Cc2ccccc2)[C@H]1c1ccco1 ZINC000639927182 1046438120 /nfs/dbraw/zinc/43/81/20/1046438120.db2.gz DECJYKAPPBJAPE-IBGZPJMESA-N 1 2 321.424 4.108 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1ccc(-n3ccnc3)cc1)C2 ZINC001139361126 1046438225 /nfs/dbraw/zinc/43/82/25/1046438225.db2.gz KWXSVXJISMZKRD-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1ccc(-n3ccnc3)cc1)C2 ZINC001139361126 1046438232 /nfs/dbraw/zinc/43/82/32/1046438232.db2.gz KWXSVXJISMZKRD-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H]2CCCOc3ccc(F)cc32)c(C)s1 ZINC000676838970 1046441331 /nfs/dbraw/zinc/44/13/31/1046441331.db2.gz INNSCHJXDXYAPZ-ZUZCIYMTSA-N 1 2 320.433 4.464 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H]2CCCOc3ccc(F)cc32)c(C)s1 ZINC000676838966 1046441433 /nfs/dbraw/zinc/44/14/33/1046441433.db2.gz INNSCHJXDXYAPZ-BONVTDFDSA-N 1 2 320.433 4.464 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2nc(-c3ccccc3)oc2C)s1 ZINC000639994553 1046441816 /nfs/dbraw/zinc/44/18/16/1046441816.db2.gz KEUBYIFWMHGZOP-NSHDSACASA-N 1 2 313.426 4.266 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2csc(-c3ccoc3)n2)s1 ZINC000639994826 1046441899 /nfs/dbraw/zinc/44/18/99/1046441899.db2.gz NDQALUNQKVDQHI-SECBINFHSA-N 1 2 305.428 4.019 20 0 DIADLO CCc1nnc(C[NH2+][C@H](c2ccc(F)cc2)C2CCCCC2)o1 ZINC000640012806 1046442900 /nfs/dbraw/zinc/44/29/00/1046442900.db2.gz JTXLCJWZIIABSI-SFHVURJKSA-N 1 2 317.408 4.182 20 0 DIADLO Cc1nc2c(o1)CC[N@H+](Cc1ccc(-c3ccccc3)s1)C2 ZINC001139416166 1046446737 /nfs/dbraw/zinc/44/67/37/1046446737.db2.gz ODMVYIQDJKSNED-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1nc2c(o1)CC[N@@H+](Cc1ccc(-c3ccccc3)s1)C2 ZINC001139416166 1046446740 /nfs/dbraw/zinc/44/67/40/1046446740.db2.gz ODMVYIQDJKSNED-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1ccc(Cl)cc1C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000123774623 1046449486 /nfs/dbraw/zinc/44/94/86/1046449486.db2.gz GXZXMFTYVKITSQ-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO FC[C@@H]([NH2+]Cc1ccccc1OC(F)F)c1ccc(F)cc1 ZINC000640152129 1046450922 /nfs/dbraw/zinc/45/09/22/1046450922.db2.gz BVJMBBHSOGFXSJ-CQSZACIVSA-N 1 2 313.294 4.228 20 0 DIADLO Cc1nc2cc(NC3CCN(c4cccc[nH+]4)CC3)ccc2s1 ZINC000781531514 1046453308 /nfs/dbraw/zinc/45/33/08/1046453308.db2.gz FUCZCJVSMRBCRN-UHFFFAOYSA-N 1 2 324.453 4.081 20 0 DIADLO Cc1cccc(CC[N@@H+](C)Cc2c(Cl)ccnc2Cl)c1 ZINC001139480158 1046454928 /nfs/dbraw/zinc/45/49/28/1046454928.db2.gz VPJSUIQOVKIFMV-UHFFFAOYSA-N 1 2 309.240 4.371 20 0 DIADLO Cc1cccc(CC[N@H+](C)Cc2c(Cl)ccnc2Cl)c1 ZINC001139480158 1046454934 /nfs/dbraw/zinc/45/49/34/1046454934.db2.gz VPJSUIQOVKIFMV-UHFFFAOYSA-N 1 2 309.240 4.371 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@@H+]2Cc2cc(C)nc3ccccc23)o1 ZINC000125047309 1046461657 /nfs/dbraw/zinc/46/16/57/1046461657.db2.gz HCJYXBIFVIPQFS-IBGZPJMESA-N 1 2 322.408 4.018 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@H+]2Cc2cc(C)nc3ccccc23)o1 ZINC000125047309 1046461663 /nfs/dbraw/zinc/46/16/63/1046461663.db2.gz HCJYXBIFVIPQFS-IBGZPJMESA-N 1 2 322.408 4.018 20 0 DIADLO F[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3)nc2)CCCC1(F)F ZINC001139520811 1046461936 /nfs/dbraw/zinc/46/19/36/1046461936.db2.gz QZCMKQNAALBDND-QGZVFWFLSA-N 1 2 320.358 4.318 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3)nc2)CCCC1(F)F ZINC001139520811 1046461937 /nfs/dbraw/zinc/46/19/37/1046461937.db2.gz QZCMKQNAALBDND-QGZVFWFLSA-N 1 2 320.358 4.318 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc(-c2ccccc2)nc1 ZINC001139519465 1046462056 /nfs/dbraw/zinc/46/20/56/1046462056.db2.gz QUDDYUFKBQZQLH-MRXNPFEDSA-N 1 2 303.409 4.127 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccc(-c2ccccc2)nc1 ZINC001139519465 1046462057 /nfs/dbraw/zinc/46/20/57/1046462057.db2.gz QUDDYUFKBQZQLH-MRXNPFEDSA-N 1 2 303.409 4.127 20 0 DIADLO Fc1c(Br)cccc1C[NH+]1CC(c2ccccc2)C1 ZINC001139534273 1046464659 /nfs/dbraw/zinc/46/46/59/1046464659.db2.gz IBKQSWDYNNSUIB-UHFFFAOYSA-N 1 2 320.205 4.188 20 0 DIADLO Fc1ccc(Cl)cc1C[NH2+][C@@H]1COc2c1cccc2Cl ZINC000677128834 1046466396 /nfs/dbraw/zinc/46/63/96/1046466396.db2.gz DVEHOHZYOIBLFV-CQSZACIVSA-N 1 2 312.171 4.356 20 0 DIADLO CC(C)c1nc2n(n1)CCC[C@@H]2[NH2+][C@H](C)c1ccccc1Cl ZINC000126128754 1046474474 /nfs/dbraw/zinc/47/44/74/1046474474.db2.gz VMZCUZPFPRCFFY-DOMZBBRYSA-N 1 2 318.852 4.241 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3cc(O)ccc3C2)cc1Cl ZINC001139596581 1046481065 /nfs/dbraw/zinc/48/10/65/1046481065.db2.gz QXZVWBRBDGRLQU-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3cc(O)ccc3C2)cc1Cl ZINC001139596581 1046481067 /nfs/dbraw/zinc/48/10/67/1046481067.db2.gz QXZVWBRBDGRLQU-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO C[C@@H]1C[C@H](CCNC(=O)c2cc3c[nH+]ccc3[nH]2)CC(C)(C)C1 ZINC001139604739 1046482429 /nfs/dbraw/zinc/48/24/29/1046482429.db2.gz AWVHBHOBNBENGY-KGLIPLIRSA-N 1 2 313.445 4.145 20 0 DIADLO CCCCn1c(C)c(C)nc1SCc1cc[nH+]c(N(C)C)c1 ZINC000782112402 1046495464 /nfs/dbraw/zinc/49/54/64/1046495464.db2.gz QDZUVRYNKCGLKP-UHFFFAOYSA-N 1 2 318.490 4.053 20 0 DIADLO COc1cc(C)[nH+]c(CN(C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000677438396 1046496165 /nfs/dbraw/zinc/49/61/65/1046496165.db2.gz RHANVHTWTJRJMH-UHFFFAOYSA-N 1 2 324.346 4.049 20 0 DIADLO CCC[C@@H](C)[N@@H+]1CCO[C@@H](c2ccccc2Br)C1 ZINC000782181286 1046497051 /nfs/dbraw/zinc/49/70/51/1046497051.db2.gz RACMARQWDGBETO-IUODEOHRSA-N 1 2 312.251 4.011 20 0 DIADLO CCC[C@@H](C)[N@H+]1CCO[C@@H](c2ccccc2Br)C1 ZINC000782181286 1046497059 /nfs/dbraw/zinc/49/70/59/1046497059.db2.gz RACMARQWDGBETO-IUODEOHRSA-N 1 2 312.251 4.011 20 0 DIADLO Clc1ccc2c(c1)CC[C@@H]2[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000782180935 1046497871 /nfs/dbraw/zinc/49/78/71/1046497871.db2.gz LFXFWNDCWDDKCA-HOTGVXAUSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)CC[C@@H]2[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000782180935 1046497874 /nfs/dbraw/zinc/49/78/74/1046497874.db2.gz LFXFWNDCWDDKCA-HOTGVXAUSA-N 1 2 319.857 4.462 20 0 DIADLO Cc1cc([C@H]([NH2+]Cc2n[nH]c3ccccc32)C2CC2)ccc1F ZINC000677521429 1046501590 /nfs/dbraw/zinc/50/15/90/1046501590.db2.gz RZGFTVFJUJECIP-LJQANCHMSA-N 1 2 309.388 4.251 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(Cl)ncc1Br ZINC001139806174 1046521060 /nfs/dbraw/zinc/52/10/60/1046521060.db2.gz PHDUCGISNYWYSO-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cc(Cl)ncc1Br ZINC001139806174 1046521070 /nfs/dbraw/zinc/52/10/70/1046521070.db2.gz PHDUCGISNYWYSO-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO CCc1ccc(C[NH2+][C@H](C)c2nc3ccccc3n2C(F)F)o1 ZINC000641705787 1046505700 /nfs/dbraw/zinc/50/57/00/1046505700.db2.gz UJSJYBSHMVNUGE-LLVKDONJSA-N 1 2 319.355 4.438 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@](C)(F)C2)cc1Br ZINC001139728663 1046506658 /nfs/dbraw/zinc/50/66/58/1046506658.db2.gz CRQMFBXDDTVWIR-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@](C)(F)C2)cc1Br ZINC001139728663 1046506669 /nfs/dbraw/zinc/50/66/69/1046506669.db2.gz CRQMFBXDDTVWIR-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO C[C@@H]([NH2+]Cc1cscc1Cl)c1nc2ccccc2n1C ZINC000641726211 1046508662 /nfs/dbraw/zinc/50/86/62/1046508662.db2.gz OMGKTWFIWBCPTH-SNVBAGLBSA-N 1 2 305.834 4.139 20 0 DIADLO Cc1ccc(Nc2nc(C[N@@H+]3CC[C@H](C(F)F)C3)cs2)cc1 ZINC000677731169 1046518467 /nfs/dbraw/zinc/51/84/67/1046518467.db2.gz FAOUFYBKBZUFOV-LBPRGKRZSA-N 1 2 323.412 4.282 20 0 DIADLO Cc1ccc(Nc2nc(C[N@H+]3CC[C@H](C(F)F)C3)cs2)cc1 ZINC000677731169 1046518476 /nfs/dbraw/zinc/51/84/76/1046518476.db2.gz FAOUFYBKBZUFOV-LBPRGKRZSA-N 1 2 323.412 4.282 20 0 DIADLO COc1cc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)ccn1 ZINC000677817164 1046530562 /nfs/dbraw/zinc/53/05/62/1046530562.db2.gz KFBWGNJUWWBTFI-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)ccn1 ZINC000677817164 1046530571 /nfs/dbraw/zinc/53/05/71/1046530571.db2.gz KFBWGNJUWWBTFI-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO O=C1C[N@@H+](Cc2cccc3c4ccccc4oc32)CCC[C@H]1F ZINC001139855746 1046533367 /nfs/dbraw/zinc/53/33/67/1046533367.db2.gz APCWQQKVUVALAO-MRXNPFEDSA-N 1 2 311.356 4.089 20 0 DIADLO O=C1C[N@H+](Cc2cccc3c4ccccc4oc32)CCC[C@H]1F ZINC001139855746 1046533377 /nfs/dbraw/zinc/53/33/77/1046533377.db2.gz APCWQQKVUVALAO-MRXNPFEDSA-N 1 2 311.356 4.089 20 0 DIADLO CCC[N@H+](Cc1nc(C(C)(C)C)no1)Cc1ccc(C)cc1 ZINC000641979603 1046534196 /nfs/dbraw/zinc/53/41/96/1046534196.db2.gz NZRRNLZMWCBAAZ-UHFFFAOYSA-N 1 2 301.434 4.088 20 0 DIADLO CCC[N@@H+](Cc1nc(C(C)(C)C)no1)Cc1ccc(C)cc1 ZINC000641979603 1046534201 /nfs/dbraw/zinc/53/42/01/1046534201.db2.gz NZRRNLZMWCBAAZ-UHFFFAOYSA-N 1 2 301.434 4.088 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@@H]2c2cccc(C)c2C)c(C)c[nH+]1 ZINC000536621041 1046534480 /nfs/dbraw/zinc/53/44/80/1046534480.db2.gz XUERFEZMEPGRFR-LJQANCHMSA-N 1 2 323.440 4.106 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ncccc2C(F)(F)F)o1 ZINC000677964770 1046538130 /nfs/dbraw/zinc/53/81/30/1046538130.db2.gz PAEJQBYOFVUEJK-JQWIXIFHSA-N 1 2 310.319 4.107 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ncccc2C(F)(F)F)o1 ZINC000677964771 1046538398 /nfs/dbraw/zinc/53/83/98/1046538398.db2.gz PAEJQBYOFVUEJK-PWSUYJOCSA-N 1 2 310.319 4.107 20 0 DIADLO FC(F)(F)c1n[nH]c2c1CC[N@H+](Cc1cc3ccccc3[nH]1)C2 ZINC001137320987 1046547155 /nfs/dbraw/zinc/54/71/55/1046547155.db2.gz WIYPGEFJEUAYEE-OAHLLOKOSA-N 1 2 320.318 4.024 20 0 DIADLO FC(F)(F)c1n[nH]c2c1CC[N@@H+](Cc1cc3ccccc3[nH]1)C2 ZINC001137320987 1046547163 /nfs/dbraw/zinc/54/71/63/1046547163.db2.gz WIYPGEFJEUAYEE-OAHLLOKOSA-N 1 2 320.318 4.024 20 0 DIADLO Cc1cccc(-c2nnc([C@H](C)[NH2+][C@@H](C)c3cnccc3C)o2)c1 ZINC000783001378 1046551475 /nfs/dbraw/zinc/55/14/75/1046551475.db2.gz FWJADSPOOBOEMG-GJZGRUSLSA-N 1 2 322.412 4.160 20 0 DIADLO Brc1ncc(C[N@@H+]2CCC[C@H]2c2ccccc2)s1 ZINC001139914147 1046552662 /nfs/dbraw/zinc/55/26/62/1046552662.db2.gz QPKDLCQMZGJMIH-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ncc(C[N@H+]2CCC[C@H]2c2ccccc2)s1 ZINC001139914147 1046552678 /nfs/dbraw/zinc/55/26/78/1046552678.db2.gz QPKDLCQMZGJMIH-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Fc1ccccc1-c1ncc(CNc2cc3cc[nH]c3c[nH+]2)s1 ZINC001202985467 1046554323 /nfs/dbraw/zinc/55/43/23/1046554323.db2.gz IABCCOGAZQSPOE-UHFFFAOYSA-N 1 2 324.384 4.438 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@@H+]1Cc1cccnn1 ZINC001139976343 1046559464 /nfs/dbraw/zinc/55/94/64/1046559464.db2.gz XUHSWXRDUOIOOS-MRXNPFEDSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@H+]1Cc1cccnn1 ZINC001139976343 1046559477 /nfs/dbraw/zinc/55/94/77/1046559477.db2.gz XUHSWXRDUOIOOS-MRXNPFEDSA-N 1 2 321.346 4.223 20 0 DIADLO NC(Cc1cccc(F)c1)=[NH+]OCCCc1ccc(Cl)cc1 ZINC000783149033 1046559633 /nfs/dbraw/zinc/55/96/33/1046559633.db2.gz NYEIJLFMNDJOGE-UHFFFAOYSA-N 1 2 320.795 4.153 20 0 DIADLO NC(Cc1cccc(F)c1)=[NH+]OC/C=C/c1ccc(Cl)cc1 ZINC000783152043 1046559788 /nfs/dbraw/zinc/55/97/88/1046559788.db2.gz MKABMBXWNKBNKN-DUXPYHPUSA-N 1 2 318.779 4.233 20 0 DIADLO NC(Cc1cccc(F)c1)=[NH+]OCc1cccc2ccccc21 ZINC000783149690 1046560753 /nfs/dbraw/zinc/56/07/53/1046560753.db2.gz SDEZZAMIGAEFMF-UHFFFAOYSA-N 1 2 308.356 4.220 20 0 DIADLO CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)[N@H+](C)Cc1ccco1 ZINC000057875882 1046571449 /nfs/dbraw/zinc/57/14/49/1046571449.db2.gz ISQIVNKMERRUCJ-HUUCEWRRSA-N 1 2 314.429 4.252 20 0 DIADLO CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccco1 ZINC000057875882 1046571453 /nfs/dbraw/zinc/57/14/53/1046571453.db2.gz ISQIVNKMERRUCJ-HUUCEWRRSA-N 1 2 314.429 4.252 20 0 DIADLO COc1c(Cl)cccc1C[N@@H+]1CCC(=O)[C@@H](C)C12CCCC2 ZINC001140065761 1046580270 /nfs/dbraw/zinc/58/02/70/1046580270.db2.gz KWOMKLRGWDNVLC-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO COc1c(Cl)cccc1C[N@H+]1CCC(=O)[C@@H](C)C12CCCC2 ZINC001140065761 1046580277 /nfs/dbraw/zinc/58/02/77/1046580277.db2.gz KWOMKLRGWDNVLC-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@@H+]2Cc2ccccc2C2CC2)no1 ZINC000678202289 1046583685 /nfs/dbraw/zinc/58/36/85/1046583685.db2.gz NIKASSVZERIFOE-KRWDZBQOSA-N 1 2 311.429 4.237 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@H+]2Cc2ccccc2C2CC2)no1 ZINC000678202289 1046583702 /nfs/dbraw/zinc/58/37/02/1046583702.db2.gz NIKASSVZERIFOE-KRWDZBQOSA-N 1 2 311.429 4.237 20 0 DIADLO C[C@H]1CCCCC[N@@H+]1Cc1cnc(Br)cc1Cl ZINC001140077801 1046584441 /nfs/dbraw/zinc/58/44/41/1046584441.db2.gz PQCIEDCYHGURRL-JTQLQIEISA-N 1 2 317.658 4.262 20 0 DIADLO C[C@H]1CCCCC[N@H+]1Cc1cnc(Br)cc1Cl ZINC001140077801 1046584455 /nfs/dbraw/zinc/58/44/55/1046584455.db2.gz PQCIEDCYHGURRL-JTQLQIEISA-N 1 2 317.658 4.262 20 0 DIADLO Fc1ccc(-c2ncc(C[NH+]3Cc4ccccc4C3)s2)cc1 ZINC001140092095 1046589622 /nfs/dbraw/zinc/58/96/22/1046589622.db2.gz BTKIAALDRVJTKU-UHFFFAOYSA-N 1 2 310.397 4.465 20 0 DIADLO FC(F)(F)c1ccnc(C[N@H+]2CC=C(c3ccccc3)CC2)c1 ZINC001140108926 1046591460 /nfs/dbraw/zinc/59/14/60/1046591460.db2.gz TWOFYWLWZQZQGL-UHFFFAOYSA-N 1 2 318.342 4.390 20 0 DIADLO FC(F)(F)c1ccnc(C[N@@H+]2CC=C(c3ccccc3)CC2)c1 ZINC001140108926 1046591470 /nfs/dbraw/zinc/59/14/70/1046591470.db2.gz TWOFYWLWZQZQGL-UHFFFAOYSA-N 1 2 318.342 4.390 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c(F)c1 ZINC001140128127 1046595186 /nfs/dbraw/zinc/59/51/86/1046595186.db2.gz IALLXCPKJVRNBF-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)c(F)c1 ZINC001140128127 1046595199 /nfs/dbraw/zinc/59/51/99/1046595199.db2.gz IALLXCPKJVRNBF-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(O)cc1F ZINC001140129553 1046596988 /nfs/dbraw/zinc/59/69/88/1046596988.db2.gz HKDOZEJCQFUBED-SFHVURJKSA-N 1 2 315.388 4.015 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(O)cc1F ZINC001140129553 1046597000 /nfs/dbraw/zinc/59/70/00/1046597000.db2.gz HKDOZEJCQFUBED-SFHVURJKSA-N 1 2 315.388 4.015 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c(F)c1 ZINC001140129753 1046597457 /nfs/dbraw/zinc/59/74/57/1046597457.db2.gz MEWSIUGRSCDIJY-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)c(F)c1 ZINC001140129753 1046597469 /nfs/dbraw/zinc/59/74/69/1046597469.db2.gz MEWSIUGRSCDIJY-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO COCc1ccc(C[N@H+](C)[C@H](C)c2c(F)cccc2F)cc1 ZINC000536638039 1046598714 /nfs/dbraw/zinc/59/87/14/1046598714.db2.gz QYBLEUUAKGISIU-CYBMUJFWSA-N 1 2 305.368 4.304 20 0 DIADLO COCc1ccc(C[N@@H+](C)[C@H](C)c2c(F)cccc2F)cc1 ZINC000536638039 1046598729 /nfs/dbraw/zinc/59/87/29/1046598729.db2.gz QYBLEUUAKGISIU-CYBMUJFWSA-N 1 2 305.368 4.304 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3ccccc3s2)C[C@@H](C(F)(F)F)O1 ZINC000678282370 1046611559 /nfs/dbraw/zinc/61/15/59/1046611559.db2.gz ZRCAQQUXWGJZHA-YGRLFVJLSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3ccccc3s2)C[C@@H](C(F)(F)F)O1 ZINC000678282370 1046611564 /nfs/dbraw/zinc/61/15/64/1046611564.db2.gz ZRCAQQUXWGJZHA-YGRLFVJLSA-N 1 2 315.360 4.053 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000678295142 1046616332 /nfs/dbraw/zinc/61/63/32/1046616332.db2.gz XLHWJISYRKOOFT-QGZVFWFLSA-N 1 2 305.805 4.123 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000678295142 1046616339 /nfs/dbraw/zinc/61/63/39/1046616339.db2.gz XLHWJISYRKOOFT-QGZVFWFLSA-N 1 2 305.805 4.123 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1noc2c1CCCC2 ZINC000678316135 1046619023 /nfs/dbraw/zinc/61/90/23/1046619023.db2.gz ZVEUTQHDIPJECV-OLZOCXBDSA-N 1 2 314.404 4.200 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1noc2c1CCCC2 ZINC000678316135 1046619028 /nfs/dbraw/zinc/61/90/28/1046619028.db2.gz ZVEUTQHDIPJECV-OLZOCXBDSA-N 1 2 314.404 4.200 20 0 DIADLO CCOC(=O)c1ccc(OC)c(Nc2cccc3cc[nH+]cc32)c1 ZINC001211978689 1046621251 /nfs/dbraw/zinc/62/12/51/1046621251.db2.gz DVTXFIOSBMPHBZ-UHFFFAOYSA-N 1 2 322.364 4.164 20 0 DIADLO Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1 ZINC000678339074 1046621840 /nfs/dbraw/zinc/62/18/40/1046621840.db2.gz MVHHOOGJAKMGQE-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1 ZINC000678339074 1046621849 /nfs/dbraw/zinc/62/18/49/1046621849.db2.gz MVHHOOGJAKMGQE-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H]2COc3c2ccc(C)c3C)c(C)s1 ZINC000678344654 1046623351 /nfs/dbraw/zinc/62/33/51/1046623351.db2.gz ATARLKQMKVUJAY-NHYWBVRUSA-N 1 2 302.443 4.161 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H]2COc3c2ccc(C)c3C)c(C)s1 ZINC000678344651 1046623759 /nfs/dbraw/zinc/62/37/59/1046623759.db2.gz ATARLKQMKVUJAY-ABAIWWIYSA-N 1 2 302.443 4.161 20 0 DIADLO C[C@@H]1CC[C@H](c2ccccc2)[N@H+](Cn2ncsc2=S)C1 ZINC000795707359 1046651349 /nfs/dbraw/zinc/65/13/49/1046651349.db2.gz WRPWTNMMYUBOEA-TZMCWYRMSA-N 1 2 305.472 4.105 20 0 DIADLO C[C@@H]1CC[C@H](c2ccccc2)[N@@H+](Cn2ncsc2=S)C1 ZINC000795707359 1046651354 /nfs/dbraw/zinc/65/13/54/1046651354.db2.gz WRPWTNMMYUBOEA-TZMCWYRMSA-N 1 2 305.472 4.105 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CCc3ccc([C@@H]4C[C@@H]4C)o3)cc2[nH+]1 ZINC000643247970 1046651796 /nfs/dbraw/zinc/65/17/96/1046651796.db2.gz PQDJSFRSZOABFE-XHDPSFHLSA-N 1 2 323.396 4.159 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccccc2-c2cccnc2)CC1(F)F ZINC001140315248 1046652295 /nfs/dbraw/zinc/65/22/95/1046652295.db2.gz IXSWLXSDCKUCLL-AWEZNQCLSA-N 1 2 302.368 4.226 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccccc2-c2cccnc2)CC1(F)F ZINC001140315248 1046652301 /nfs/dbraw/zinc/65/23/01/1046652301.db2.gz IXSWLXSDCKUCLL-AWEZNQCLSA-N 1 2 302.368 4.226 20 0 DIADLO CCSc1cccc(NC(=O)NCc2c[nH+]c(C)cc2C)c1 ZINC000454802320 1046656950 /nfs/dbraw/zinc/65/69/50/1046656950.db2.gz SWBCONLYFASOJQ-UHFFFAOYSA-N 1 2 315.442 4.132 20 0 DIADLO Cc1ccc2[nH]nc(C[N@@H+]3CCSC[C@@H]3c3ccccc3)c2c1 ZINC001140330123 1046658275 /nfs/dbraw/zinc/65/82/75/1046658275.db2.gz NDJNQDCZOFCPLC-LJQANCHMSA-N 1 2 323.465 4.161 20 0 DIADLO Cc1ccc2[nH]nc(C[N@H+]3CCSC[C@@H]3c3ccccc3)c2c1 ZINC001140330123 1046658281 /nfs/dbraw/zinc/65/82/81/1046658281.db2.gz NDJNQDCZOFCPLC-LJQANCHMSA-N 1 2 323.465 4.161 20 0 DIADLO CC[N@H+](Cc1[nH]nc2ccc(C)cc21)Cc1cccc(F)c1F ZINC001140333363 1046661012 /nfs/dbraw/zinc/66/10/12/1046661012.db2.gz IMUSPQWMHKODLA-UHFFFAOYSA-N 1 2 315.367 4.172 20 0 DIADLO CC[N@@H+](Cc1[nH]nc2ccc(C)cc21)Cc1cccc(F)c1F ZINC001140333363 1046661023 /nfs/dbraw/zinc/66/10/23/1046661023.db2.gz IMUSPQWMHKODLA-UHFFFAOYSA-N 1 2 315.367 4.172 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cccc(-c3nccs3)c1)C2 ZINC001140337459 1046665052 /nfs/dbraw/zinc/66/50/52/1046665052.db2.gz PFJYEHBPJOISLR-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cccc(-c3nccs3)c1)C2 ZINC001140337459 1046665054 /nfs/dbraw/zinc/66/50/54/1046665054.db2.gz PFJYEHBPJOISLR-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1cccc(-c3nccs3)c1)C2 ZINC001140336509 1046665129 /nfs/dbraw/zinc/66/51/29/1046665129.db2.gz HJICLPKYOHGDGB-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1cccc(-c3nccs3)c1)C2 ZINC001140336509 1046665135 /nfs/dbraw/zinc/66/51/35/1046665135.db2.gz HJICLPKYOHGDGB-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H]2COc3c2cccc3Cl)c(C)s1 ZINC000678597280 1046670697 /nfs/dbraw/zinc/67/06/97/1046670697.db2.gz CMSKHXIWCUIECD-ISVAXAHUSA-N 1 2 308.834 4.198 20 0 DIADLO O=C1c2cccc3cccc(c23)N1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000054493827 1046672494 /nfs/dbraw/zinc/67/24/94/1046672494.db2.gz IUJXKVGBVJVJAH-SFHVURJKSA-N 1 2 314.388 4.205 20 0 DIADLO O=C1c2cccc3cccc(c23)N1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000054493827 1046672498 /nfs/dbraw/zinc/67/24/98/1046672498.db2.gz IUJXKVGBVJVJAH-SFHVURJKSA-N 1 2 314.388 4.205 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1ccc(-c3cncnc3)cc1)C2 ZINC001140357196 1046672540 /nfs/dbraw/zinc/67/25/40/1046672540.db2.gz UBSQCRWALOMFBH-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1ccc(-c3cncnc3)cc1)C2 ZINC001140357196 1046672548 /nfs/dbraw/zinc/67/25/48/1046672548.db2.gz UBSQCRWALOMFBH-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Cc1cccc(-c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)c1F ZINC000784202446 1046673278 /nfs/dbraw/zinc/67/32/78/1046673278.db2.gz PCGLINAUGICXCZ-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Fc1cccnc1C[NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000678603642 1046675910 /nfs/dbraw/zinc/67/59/10/1046675910.db2.gz AOZMEQQBTBSIED-CYBMUJFWSA-N 1 2 311.187 4.305 20 0 DIADLO Cc1cccc(C[N@@H+](C)[C@@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000533242781 1046676672 /nfs/dbraw/zinc/67/66/72/1046676672.db2.gz QSGSOOLUNQEMIE-INIZCTEOSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1cccc(C[N@H+](C)[C@@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000533242781 1046676680 /nfs/dbraw/zinc/67/66/80/1046676680.db2.gz QSGSOOLUNQEMIE-INIZCTEOSA-N 1 2 321.424 4.162 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1cc(C)nc(Cl)c1 ZINC000795783899 1046677203 /nfs/dbraw/zinc/67/72/03/1046677203.db2.gz PUNUJDHYVODTQQ-UHFFFAOYSA-N 1 2 314.820 4.415 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)cnc1Cl)c1cnn(C2CCCC2)c1 ZINC000834834814 1046680555 /nfs/dbraw/zinc/68/05/55/1046680555.db2.gz FAUOINXDADOFFX-LLVKDONJSA-N 1 2 322.815 4.037 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(Cl)c1F)c1nc2ccccc2n1C ZINC000678689735 1046689387 /nfs/dbraw/zinc/68/93/87/1046689387.db2.gz KHFCJTKLEQSPNO-LLVKDONJSA-N 1 2 317.795 4.217 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc2c(s1)CCCC2 ZINC000533308273 1046693482 /nfs/dbraw/zinc/69/34/82/1046693482.db2.gz FWNYQTGJOGOZMY-NSHDSACASA-N 1 2 322.424 4.493 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc2c(s1)CCCC2 ZINC000533308273 1046693486 /nfs/dbraw/zinc/69/34/86/1046693486.db2.gz FWNYQTGJOGOZMY-NSHDSACASA-N 1 2 322.424 4.493 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@H](CC2CC2)c2ccccc2)n1 ZINC000678775740 1046700692 /nfs/dbraw/zinc/70/06/92/1046700692.db2.gz BHHDAUHUHJOASE-QGZVFWFLSA-N 1 2 313.445 4.289 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc2c(s1)CCC2 ZINC000678812989 1046708294 /nfs/dbraw/zinc/70/82/94/1046708294.db2.gz ZPYFKJAPAHLCLG-JTQLQIEISA-N 1 2 308.397 4.103 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc2c(s1)CCC2 ZINC000678812989 1046708307 /nfs/dbraw/zinc/70/83/07/1046708307.db2.gz ZPYFKJAPAHLCLG-JTQLQIEISA-N 1 2 308.397 4.103 20 0 DIADLO CCOc1cccc2cc([C@H](C)[NH2+]Cc3coc(CC)n3)oc21 ZINC000834898108 1046708598 /nfs/dbraw/zinc/70/85/98/1046708598.db2.gz JAMGFNBIXNPVEZ-LBPRGKRZSA-N 1 2 314.385 4.233 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2sc(C(C)(C)C)nc2C)co1 ZINC000834901580 1046711101 /nfs/dbraw/zinc/71/11/01/1046711101.db2.gz WLFRAJDFUBHRLK-JTQLQIEISA-N 1 2 307.463 4.150 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2ccc(OC(C)(C)C)cc2)co1 ZINC000834900568 1046711370 /nfs/dbraw/zinc/71/13/70/1046711370.db2.gz VEFHOEJNOJCIII-CYBMUJFWSA-N 1 2 302.418 4.265 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](C)Cc2nc3c(s2)CCC3)c1 ZINC000678839690 1046716722 /nfs/dbraw/zinc/71/67/22/1046716722.db2.gz YXXLAMCCOAXJNB-UHFFFAOYSA-N 1 2 316.470 4.051 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2nc3c(s2)CCC3)c1 ZINC000678839690 1046716728 /nfs/dbraw/zinc/71/67/28/1046716728.db2.gz YXXLAMCCOAXJNB-UHFFFAOYSA-N 1 2 316.470 4.051 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1cnc2ccc(Cl)cn12 ZINC001140426469 1046717472 /nfs/dbraw/zinc/71/74/72/1046717472.db2.gz NPXLXBOPLZREAA-ZDUSSCGKSA-N 1 2 311.816 4.107 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cnc2ccc(Cl)cn12 ZINC001140426469 1046717479 /nfs/dbraw/zinc/71/74/79/1046717479.db2.gz NPXLXBOPLZREAA-ZDUSSCGKSA-N 1 2 311.816 4.107 20 0 DIADLO C[C@H](C[NH2+][C@H](c1ncn[nH]1)C1CCCCC1)C1CCCCC1 ZINC000644536057 1046719247 /nfs/dbraw/zinc/71/92/47/1046719247.db2.gz DWMNPWWELCLSAA-PBHICJAKSA-N 1 2 304.482 4.232 20 0 DIADLO O=C1CC[N@@H+](Cc2c[nH]c3cccc(Cl)c23)[C@@H]2CCCC[C@@H]12 ZINC001140433202 1046722115 /nfs/dbraw/zinc/72/21/15/1046722115.db2.gz SIEPFCZVUDXGRZ-CZUORRHYSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c[nH]c3cccc(Cl)c23)[C@@H]2CCCC[C@@H]12 ZINC001140433202 1046722131 /nfs/dbraw/zinc/72/21/31/1046722131.db2.gz SIEPFCZVUDXGRZ-CZUORRHYSA-N 1 2 316.832 4.155 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1F)Cc1nc(Cl)ccc1C ZINC001140446366 1046726232 /nfs/dbraw/zinc/72/62/32/1046726232.db2.gz IABBAJXXTPUUEG-UHFFFAOYSA-N 1 2 310.775 4.344 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1F)Cc1nc(Cl)ccc1C ZINC001140446366 1046726241 /nfs/dbraw/zinc/72/62/41/1046726241.db2.gz IABBAJXXTPUUEG-UHFFFAOYSA-N 1 2 310.775 4.344 20 0 DIADLO CC(C)CC[C@@H]([NH2+]Cc1csnn1)c1ccc(Cl)cc1 ZINC000678898535 1046728571 /nfs/dbraw/zinc/72/85/71/1046728571.db2.gz PHOIHSDAVKRGMW-OAHLLOKOSA-N 1 2 309.866 4.459 20 0 DIADLO Cc1nc([C@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)c(C)s1 ZINC000678904806 1046729489 /nfs/dbraw/zinc/72/94/89/1046729489.db2.gz KUANPACYAKITKJ-LBPRGKRZSA-N 1 2 316.474 4.318 20 0 DIADLO Fc1c(Br)cccc1C[N@@H+]1CCCC(F)(F)CC1 ZINC001139531435 1046730279 /nfs/dbraw/zinc/73/02/79/1046730279.db2.gz BOSUHAUWSRKAAT-UHFFFAOYSA-N 1 2 322.168 4.209 20 0 DIADLO Fc1c(Br)cccc1C[N@H+]1CCCC(F)(F)CC1 ZINC001139531435 1046730293 /nfs/dbraw/zinc/73/02/93/1046730293.db2.gz BOSUHAUWSRKAAT-UHFFFAOYSA-N 1 2 322.168 4.209 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc(-c2cccnc2)cc1 ZINC000796778167 1046730943 /nfs/dbraw/zinc/73/09/43/1046730943.db2.gz GBAGMQVJTFRNET-LIRRHRJNSA-N 1 2 318.424 4.200 20 0 DIADLO c1snnc1C[NH2+][C@H](CC1CCCCC1)c1ccccc1 ZINC000678929152 1046735212 /nfs/dbraw/zinc/73/52/12/1046735212.db2.gz BAVITWMTTJETHZ-QGZVFWFLSA-N 1 2 301.459 4.339 20 0 DIADLO COc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001140481740 1046743896 /nfs/dbraw/zinc/74/38/96/1046743896.db2.gz CRQXLHODBHEUMA-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)cc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001140481740 1046743908 /nfs/dbraw/zinc/74/39/08/1046743908.db2.gz CRQXLHODBHEUMA-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c1 ZINC001140484594 1046744037 /nfs/dbraw/zinc/74/40/37/1046744037.db2.gz VSKLTEJJAGUKKY-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)cc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)c1 ZINC001140484594 1046744051 /nfs/dbraw/zinc/74/40/51/1046744051.db2.gz VSKLTEJJAGUKKY-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c1 ZINC001140484596 1046745324 /nfs/dbraw/zinc/74/53/24/1046745324.db2.gz VSNWHIXSYPPPCE-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)c1 ZINC001140484596 1046745337 /nfs/dbraw/zinc/74/53/37/1046745337.db2.gz VSNWHIXSYPPPCE-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1cccc(C[N@H+](Cc2nc3c(s2)CCCC3)C2CC2)c1 ZINC000678956422 1046745658 /nfs/dbraw/zinc/74/56/58/1046745658.db2.gz WKEZQCDPIJMAAH-UHFFFAOYSA-N 1 2 316.445 4.326 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2nc3c(s2)CCCC3)C2CC2)c1 ZINC000678956422 1046745672 /nfs/dbraw/zinc/74/56/72/1046745672.db2.gz WKEZQCDPIJMAAH-UHFFFAOYSA-N 1 2 316.445 4.326 20 0 DIADLO CCO[C@@H]1CCC[N@H+](Cc2c(Cl)ccc(F)c2Cl)C1 ZINC001137358648 1046747084 /nfs/dbraw/zinc/74/70/84/1046747084.db2.gz XETJFTCLGLIVFC-SNVBAGLBSA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@@H]1CCC[N@@H+](Cc2c(Cl)ccc(F)c2Cl)C1 ZINC001137358648 1046747096 /nfs/dbraw/zinc/74/70/96/1046747096.db2.gz XETJFTCLGLIVFC-SNVBAGLBSA-N 1 2 306.208 4.133 20 0 DIADLO CC1(C)C[N@H+](Cc2c(Cl)ccc(F)c2Cl)CCCO1 ZINC001137358347 1046747692 /nfs/dbraw/zinc/74/76/92/1046747692.db2.gz KBVDKLOYKMBHBC-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(Cl)ccc(F)c2Cl)CCCO1 ZINC001137358347 1046747703 /nfs/dbraw/zinc/74/77/03/1046747703.db2.gz KBVDKLOYKMBHBC-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO CC(C)n1ccn(C[N@@H+]2CCc3sccc3[C@@H]2C)c1=S ZINC000835083874 1046756817 /nfs/dbraw/zinc/75/68/17/1046756817.db2.gz GSIJKGZZHNYIGW-LBPRGKRZSA-N 1 2 307.488 4.238 20 0 DIADLO CC(C)n1ccn(C[N@H+]2CCc3sccc3[C@@H]2C)c1=S ZINC000835083874 1046756832 /nfs/dbraw/zinc/75/68/32/1046756832.db2.gz GSIJKGZZHNYIGW-LBPRGKRZSA-N 1 2 307.488 4.238 20 0 DIADLO Cc1nc(-c2cc([C@@H](C)[NH2+]Cc3cocn3)cs2)cs1 ZINC000679048437 1046764206 /nfs/dbraw/zinc/76/42/06/1046764206.db2.gz ORJNQBUFOHYZBQ-SECBINFHSA-N 1 2 305.428 4.019 20 0 DIADLO Clc1ccc2c(c1)CC[N@@H+](Cc1ccnn1-c1ccccc1)C2 ZINC001140528126 1046765504 /nfs/dbraw/zinc/76/55/04/1046765504.db2.gz OGAYSFJVLFYUGH-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1ccc2c(c1)CC[N@H+](Cc1ccnn1-c1ccccc1)C2 ZINC001140528126 1046765519 /nfs/dbraw/zinc/76/55/19/1046765519.db2.gz OGAYSFJVLFYUGH-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@H](c3ccccc3C)C2)c(C)[nH+]1 ZINC000455464507 1046767754 /nfs/dbraw/zinc/76/77/54/1046767754.db2.gz DQQNRBLNTORYFK-KRWDZBQOSA-N 1 2 323.440 4.337 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC000455466648 1046767946 /nfs/dbraw/zinc/76/79/46/1046767946.db2.gz FQWOSRBCYWYXRT-QGZVFWFLSA-N 1 2 309.413 4.376 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@H]2c2ccccc2)c(C)[nH+]1 ZINC000455466642 1046768104 /nfs/dbraw/zinc/76/81/04/1046768104.db2.gz FQWOSRBCYWYXRT-KRWDZBQOSA-N 1 2 309.413 4.376 20 0 DIADLO C[N@H+](Cc1cccc2cccnc21)Cc1c(F)cc(F)cc1F ZINC001140532402 1046769103 /nfs/dbraw/zinc/76/91/03/1046769103.db2.gz FYIHGYPEJOQLKB-UHFFFAOYSA-N 1 2 316.326 4.284 20 0 DIADLO C[N@@H+](Cc1cccc2cccnc21)Cc1c(F)cc(F)cc1F ZINC001140532402 1046769115 /nfs/dbraw/zinc/76/91/15/1046769115.db2.gz FYIHGYPEJOQLKB-UHFFFAOYSA-N 1 2 316.326 4.284 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1c(F)cc(F)cc1F ZINC001140532159 1046769337 /nfs/dbraw/zinc/76/93/37/1046769337.db2.gz AFLQESNCZYOCAU-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1c(F)cc(F)cc1F ZINC001140532159 1046769350 /nfs/dbraw/zinc/76/93/50/1046769350.db2.gz AFLQESNCZYOCAU-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCCC[C@@H]2c2ccco2)c(C)[nH+]1 ZINC000455493692 1046770457 /nfs/dbraw/zinc/77/04/57/1046770457.db2.gz MHHQTCVFJHMDAV-OAHLLOKOSA-N 1 2 313.401 4.359 20 0 DIADLO Fc1cc(Cl)cc(C[N@@H+]2CC[C@@H]2COCc2ccccc2)c1 ZINC001140538785 1046771191 /nfs/dbraw/zinc/77/11/91/1046771191.db2.gz LJRTWAQPIJMHOJ-GOSISDBHSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1cc(Cl)cc(C[N@H+]2CC[C@@H]2COCc2ccccc2)c1 ZINC001140538785 1046771205 /nfs/dbraw/zinc/77/12/05/1046771205.db2.gz LJRTWAQPIJMHOJ-GOSISDBHSA-N 1 2 319.807 4.270 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@H](C(C)C)[C@@H]2C(C)C)c(C)[nH+]1 ZINC000455493273 1046771874 /nfs/dbraw/zinc/77/18/74/1046771874.db2.gz CFASDLRSUOPVHS-WBVHZDCISA-N 1 2 303.450 4.151 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCCO[C@@H](c3ccccc3)C2)c1 ZINC000645158297 1046772246 /nfs/dbraw/zinc/77/22/46/1046772246.db2.gz JYEIZMYEJDMZHV-LJQANCHMSA-N 1 2 322.383 4.342 20 0 DIADLO CCN(Cc1ccccc1C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455485322 1046773098 /nfs/dbraw/zinc/77/30/98/1046773098.db2.gz RAXGIBPRDWFWLF-UHFFFAOYSA-N 1 2 311.429 4.369 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)C[C@@H](C)c2ccccc2)c(C)[nH+]1 ZINC000455487099 1046775622 /nfs/dbraw/zinc/77/56/22/1046775622.db2.gz SLRMTWJIEJKTDZ-CQSZACIVSA-N 1 2 311.429 4.274 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@H](C)C3(CCC3)C2)c(C)[nH+]1 ZINC000455501381 1046777416 /nfs/dbraw/zinc/77/74/16/1046777416.db2.gz UMLDXQWAMOEOLJ-CYBMUJFWSA-N 1 2 301.434 4.051 20 0 DIADLO CCCCCN(CCCOC)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455499102 1046777565 /nfs/dbraw/zinc/77/75/65/1046777565.db2.gz RWEXASMHUDRROA-UHFFFAOYSA-N 1 2 321.465 4.067 20 0 DIADLO Cc1cc(C)c(NC(=O)N2Cc3cccc(Cl)c3C2)c(C)[nH+]1 ZINC000455509762 1046780096 /nfs/dbraw/zinc/78/00/96/1046780096.db2.gz GVVFFCFOTRZSRO-UHFFFAOYSA-N 1 2 315.804 4.208 20 0 DIADLO F[C@@H]1C[N@H+](Cc2ccc(OC(F)(F)F)c(Cl)c2)C[C@@H]2C[C@@H]21 ZINC001140558455 1046781431 /nfs/dbraw/zinc/78/14/31/1046781431.db2.gz UVPGGLUPYZBYFC-JBLDHEPKSA-N 1 2 323.717 4.028 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2ccc(OC(F)(F)F)c(Cl)c2)C[C@@H]2C[C@@H]21 ZINC001140558455 1046781442 /nfs/dbraw/zinc/78/14/42/1046781442.db2.gz UVPGGLUPYZBYFC-JBLDHEPKSA-N 1 2 323.717 4.028 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ncc(-c3cccs3)o2)cc1 ZINC000067374690 1046787337 /nfs/dbraw/zinc/78/73/37/1046787337.db2.gz DFOULVSWUMTSKU-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ncc(-c3cccs3)o2)cc1 ZINC000067374690 1046787343 /nfs/dbraw/zinc/78/73/43/1046787343.db2.gz DFOULVSWUMTSKU-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1ccc(-c2nc(C[N@H+](C)[C@@H](C)c3ccco3)co2)cc1 ZINC000069067265 1046792010 /nfs/dbraw/zinc/79/20/10/1046792010.db2.gz YMBBTCHLYFQERM-ZDUSSCGKSA-N 1 2 312.369 4.136 20 0 DIADLO COc1ccc(-c2nc(C[N@@H+](C)[C@@H](C)c3ccco3)co2)cc1 ZINC000069067265 1046792021 /nfs/dbraw/zinc/79/20/21/1046792021.db2.gz YMBBTCHLYFQERM-ZDUSSCGKSA-N 1 2 312.369 4.136 20 0 DIADLO Cc1ccc(F)cc1C[NH+](Cc1cccnc1)Cc1cccnc1 ZINC001140592777 1046800527 /nfs/dbraw/zinc/80/05/27/1046800527.db2.gz CFRLPNLOQHYYLL-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO CC[C@H]([NH2+]Cc1ncc(C(C)C)o1)c1ccc(OC)c(OC)c1 ZINC000796255893 1046801889 /nfs/dbraw/zinc/80/18/89/1046801889.db2.gz PITINXMJAFAAQN-AWEZNQCLSA-N 1 2 318.417 4.056 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2cc(Cl)ncc2F)cc1 ZINC001140611166 1046809469 /nfs/dbraw/zinc/80/94/69/1046809469.db2.gz ZQOJICNXMCMZJP-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2cc(Cl)ncc2F)cc1 ZINC001140611166 1046809494 /nfs/dbraw/zinc/80/94/94/1046809494.db2.gz ZQOJICNXMCMZJP-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO Cc1cnccc1C[N@H+]1C[C@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000648535259 1046820145 /nfs/dbraw/zinc/82/01/45/1046820145.db2.gz YRMYOEFZQNHZGQ-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cnccc1C[N@@H+]1C[C@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000648535259 1046820155 /nfs/dbraw/zinc/82/01/55/1046820155.db2.gz YRMYOEFZQNHZGQ-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1c[nH+]c(Nc2cccc(F)c2OCc2ccccc2)c(N)c1 ZINC001212019039 1046822875 /nfs/dbraw/zinc/82/28/75/1046822875.db2.gz KKDRXTGJXGRQTC-UHFFFAOYSA-N 1 2 323.371 4.434 20 0 DIADLO COCC[C@H]([NH2+][C@@H](C)c1nc(C)sc1C)c1ccc(C)o1 ZINC000679359916 1046829022 /nfs/dbraw/zinc/82/90/22/1046829022.db2.gz GDJKAIFGPSUWLX-FZMZJTMJSA-N 1 2 308.447 4.090 20 0 DIADLO FC(F)C(F)(F)C[N@@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000796282224 1046830867 /nfs/dbraw/zinc/83/08/67/1046830867.db2.gz KHMGATQPXUZZNI-MJBXVCDLSA-N 1 2 301.327 4.155 20 0 DIADLO FC(F)C(F)(F)C[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000796282224 1046830881 /nfs/dbraw/zinc/83/08/81/1046830881.db2.gz KHMGATQPXUZZNI-MJBXVCDLSA-N 1 2 301.327 4.155 20 0 DIADLO CC(C)(C)c1cc(C[NH2+]C2(c3cccc(F)c3)CCC2)no1 ZINC000646002023 1046839592 /nfs/dbraw/zinc/83/95/92/1046839592.db2.gz HMHPJPXAOYCTFN-UHFFFAOYSA-N 1 2 302.393 4.280 20 0 DIADLO CCc1nocc1C[N@@H+]1CCC[C@H]1c1nc2ccccc2s1 ZINC000646047625 1046849392 /nfs/dbraw/zinc/84/93/92/1046849392.db2.gz KNKUJEQTTANVDV-HNNXBMFYSA-N 1 2 313.426 4.184 20 0 DIADLO CCc1nocc1C[N@H+]1CCC[C@H]1c1nc2ccccc2s1 ZINC000646047625 1046849413 /nfs/dbraw/zinc/84/94/13/1046849413.db2.gz KNKUJEQTTANVDV-HNNXBMFYSA-N 1 2 313.426 4.184 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1nccn1C(F)F ZINC000076191527 1046849498 /nfs/dbraw/zinc/84/94/98/1046849498.db2.gz YWWGQXDEYJNOIY-NSHDSACASA-N 1 2 305.328 4.217 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nccn1C(F)F ZINC000076191527 1046849512 /nfs/dbraw/zinc/84/95/12/1046849512.db2.gz YWWGQXDEYJNOIY-NSHDSACASA-N 1 2 305.328 4.217 20 0 DIADLO FC(F)Oc1cccc(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001212058254 1046852574 /nfs/dbraw/zinc/85/25/74/1046852574.db2.gz AJGCKZYXJGYBDJ-UHFFFAOYSA-N 1 2 309.703 4.333 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccc(Cl)nc1 ZINC000797585612 1046856427 /nfs/dbraw/zinc/85/64/27/1046856427.db2.gz IUZJVHMGQMLQCH-SSDOTTSWSA-N 1 2 318.701 4.142 20 0 DIADLO Clc1cccc(C2([NH2+]Cc3noc4c3CCCC4)CCC2)c1 ZINC000646095146 1046856602 /nfs/dbraw/zinc/85/66/02/1046856602.db2.gz GZHHXLSLUAFWGU-UHFFFAOYSA-N 1 2 316.832 4.376 20 0 DIADLO C1=CCC2(C[N@@H+](Cc3ncc(C4CC4)o3)[C@H]2c2ccccc2)C1 ZINC000646118271 1046859939 /nfs/dbraw/zinc/85/99/39/1046859939.db2.gz HAZIZAKIVMSMID-IBGZPJMESA-N 1 2 306.409 4.445 20 0 DIADLO C1=CCC2(C[N@H+](Cc3ncc(C4CC4)o3)[C@H]2c2ccccc2)C1 ZINC000646118271 1046859963 /nfs/dbraw/zinc/85/99/63/1046859963.db2.gz HAZIZAKIVMSMID-IBGZPJMESA-N 1 2 306.409 4.445 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2F)CCC1(F)F ZINC001140699603 1046862312 /nfs/dbraw/zinc/86/23/12/1046862312.db2.gz WKZUWTUAVFAMQK-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2F)CCC1(F)F ZINC001140699603 1046862338 /nfs/dbraw/zinc/86/23/38/1046862338.db2.gz WKZUWTUAVFAMQK-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646117762 1046862108 /nfs/dbraw/zinc/86/21/08/1046862108.db2.gz QNXYKRDBKVZNLJ-IBGZPJMESA-N 1 2 307.441 4.357 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646117762 1046862134 /nfs/dbraw/zinc/86/21/34/1046862134.db2.gz QNXYKRDBKVZNLJ-IBGZPJMESA-N 1 2 307.441 4.357 20 0 DIADLO Cc1cc(C[NH2+][C@H](COCC(C)C)c2ccco2)cc(Cl)n1 ZINC000797597062 1046865484 /nfs/dbraw/zinc/86/54/84/1046865484.db2.gz DQXWJSSTXGYTTG-OAHLLOKOSA-N 1 2 322.836 4.140 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000679546300 1046867350 /nfs/dbraw/zinc/86/73/50/1046867350.db2.gz OOHYZROFSLAGAN-GHMZBOCLSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000679546300 1046867368 /nfs/dbraw/zinc/86/73/68/1046867368.db2.gz OOHYZROFSLAGAN-GHMZBOCLSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000679547998 1046868590 /nfs/dbraw/zinc/86/85/90/1046868590.db2.gz SUZGCTGHIIVHOY-RYUDHWBXSA-N 1 2 324.346 4.013 20 0 DIADLO Cc1cc(CNc2ccc3c(c2)CCC[N@H+]3C)cc(Cl)n1 ZINC000797601502 1046868525 /nfs/dbraw/zinc/86/85/25/1046868525.db2.gz UQDKLDVAMUPFOE-UHFFFAOYSA-N 1 2 301.821 4.038 20 0 DIADLO Cc1cc(CNc2ccc3c(c2)CCC[N@@H+]3C)cc(Cl)n1 ZINC000797601502 1046868544 /nfs/dbraw/zinc/86/85/44/1046868544.db2.gz UQDKLDVAMUPFOE-UHFFFAOYSA-N 1 2 301.821 4.038 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000679547998 1046868610 /nfs/dbraw/zinc/86/86/10/1046868610.db2.gz SUZGCTGHIIVHOY-RYUDHWBXSA-N 1 2 324.346 4.013 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000679548514 1046869798 /nfs/dbraw/zinc/86/97/98/1046869798.db2.gz VDBZAJKXWWJIGG-UONOGXRCSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000679548514 1046869816 /nfs/dbraw/zinc/86/98/16/1046869816.db2.gz VDBZAJKXWWJIGG-UONOGXRCSA-N 1 2 323.362 4.035 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+]1CCc2cc(F)ccc2C1 ZINC001140730546 1046880995 /nfs/dbraw/zinc/88/09/95/1046880995.db2.gz OUGUKUHAWDMXMD-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc(Cl)c1C[N@H+]1CCc2cc(F)ccc2C1 ZINC001140730546 1046881006 /nfs/dbraw/zinc/88/10/06/1046881006.db2.gz OUGUKUHAWDMXMD-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO FC(F)O[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2Cl)C1 ZINC000679680082 1046893040 /nfs/dbraw/zinc/89/30/40/1046893040.db2.gz WICXKISQLRFSKV-NSHDSACASA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2Cl)C1 ZINC000679680082 1046893048 /nfs/dbraw/zinc/89/30/48/1046893048.db2.gz WICXKISQLRFSKV-NSHDSACASA-N 1 2 310.171 4.197 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(C(C)(C)C)[nH]2)[C@@H](c2ccccc2)CO1 ZINC001137380354 1046884691 /nfs/dbraw/zinc/88/46/91/1046884691.db2.gz IMCQKRZPYMEIGX-MAUKXSAKSA-N 1 2 312.457 4.274 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(C(C)(C)C)[nH]2)[C@@H](c2ccccc2)CO1 ZINC001137380354 1046884701 /nfs/dbraw/zinc/88/47/01/1046884701.db2.gz IMCQKRZPYMEIGX-MAUKXSAKSA-N 1 2 312.457 4.274 20 0 DIADLO Cc1ccc(Br)c(C[N@@H+](C)Cc2cccnc2C)c1 ZINC001137386137 1046894852 /nfs/dbraw/zinc/89/48/52/1046894852.db2.gz QYGDSXGHGUGTNA-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO CC[N@H+](Cc1cc(Br)ccn1)Cc1ccccc1F ZINC001140766833 1046891717 /nfs/dbraw/zinc/89/17/17/1046891717.db2.gz SSKXLMHKDGTDTI-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1cc(Br)ccn1)Cc1ccccc1F ZINC001140766833 1046891730 /nfs/dbraw/zinc/89/17/30/1046891730.db2.gz SSKXLMHKDGTDTI-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO Cc1ccc(Br)c(C[N@H+](C)Cc2cccnc2C)c1 ZINC001137386137 1046894839 /nfs/dbraw/zinc/89/48/39/1046894839.db2.gz QYGDSXGHGUGTNA-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1cc(C)ccc1Br ZINC001137386049 1046894881 /nfs/dbraw/zinc/89/48/81/1046894881.db2.gz NIPULNHRCHWSSO-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1cc(C)ccc1Br ZINC001137386049 1046894896 /nfs/dbraw/zinc/89/48/96/1046894896.db2.gz NIPULNHRCHWSSO-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc(C)c(C)c2Cl)cc(C)[nH+]1 ZINC000646429259 1046898833 /nfs/dbraw/zinc/89/88/33/1046898833.db2.gz YHTXOQBAAUJRFJ-UHFFFAOYSA-N 1 2 317.820 4.290 20 0 DIADLO FC(F)O[C@H]1CCC[N@H+](Cc2nc(-c3ccccc3)cs2)C1 ZINC000679740417 1046899050 /nfs/dbraw/zinc/89/90/50/1046899050.db2.gz NEANKIYOBNFCCQ-ZDUSSCGKSA-N 1 2 324.396 4.014 20 0 DIADLO FC(F)O[C@H]1CCC[N@@H+](Cc2nc(-c3ccccc3)cs2)C1 ZINC000679740417 1046899066 /nfs/dbraw/zinc/89/90/66/1046899066.db2.gz NEANKIYOBNFCCQ-ZDUSSCGKSA-N 1 2 324.396 4.014 20 0 DIADLO CCc1cc(N2CCCC[C@H]2c2ccccc2OC)nc(C)[nH+]1 ZINC000679839330 1046906420 /nfs/dbraw/zinc/90/64/20/1046906420.db2.gz XYIJFIGKJKFENZ-KRWDZBQOSA-N 1 2 311.429 4.088 20 0 DIADLO Cc1nnc(C[N@@H+]2CCCCC[C@H]2/C=C\c2cccs2)s1 ZINC000679951909 1046914720 /nfs/dbraw/zinc/91/47/20/1046914720.db2.gz CAUFMTJETLGEGQ-CKXPSTMWSA-N 1 2 319.499 4.366 20 0 DIADLO Cc1nnc(C[N@H+]2CCCCC[C@H]2/C=C\c2cccs2)s1 ZINC000679951909 1046914734 /nfs/dbraw/zinc/91/47/34/1046914734.db2.gz CAUFMTJETLGEGQ-CKXPSTMWSA-N 1 2 319.499 4.366 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[NH2+][C@H](C)c3cnccc3C)o2)cc1 ZINC000679940337 1046914951 /nfs/dbraw/zinc/91/49/51/1046914951.db2.gz PFRNWDRCPOTTJD-CABCVRRESA-N 1 2 322.412 4.160 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000161816475 1046915529 /nfs/dbraw/zinc/91/55/29/1046915529.db2.gz YJKZVBCMCGNVBM-AWEZNQCLSA-N 1 2 305.381 4.209 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[NH2+][C@@H](C)c3cnccc3C)o2)cc1 ZINC000679940340 1046916168 /nfs/dbraw/zinc/91/61/68/1046916168.db2.gz PFRNWDRCPOTTJD-GJZGRUSLSA-N 1 2 322.412 4.160 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2c(F)cc(OC)cc2F)cc1 ZINC001140827622 1046918436 /nfs/dbraw/zinc/91/84/36/1046918436.db2.gz FXINDQFNQVVNPF-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2c(F)cc(OC)cc2F)cc1 ZINC001140827622 1046918445 /nfs/dbraw/zinc/91/84/45/1046918445.db2.gz FXINDQFNQVVNPF-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccccc2F)c(F)c1 ZINC001140826193 1046918704 /nfs/dbraw/zinc/91/87/04/1046918704.db2.gz DUOJAXIZLZTZBX-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@H]2c2ccccc2F)c(F)c1 ZINC001140826193 1046918714 /nfs/dbraw/zinc/91/87/14/1046918714.db2.gz DUOJAXIZLZTZBX-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO C(=C\c1ccc(-n2cc[nH+]c2)cc1)\c1nc(C2CCCC2)no1 ZINC000254971849 1046924514 /nfs/dbraw/zinc/92/45/14/1046924514.db2.gz ADRGZYLMUYXSLU-YFHOEESVSA-N 1 2 306.369 4.083 20 0 DIADLO Nc1cccc(F)c1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001140875039 1046937059 /nfs/dbraw/zinc/93/70/59/1046937059.db2.gz SRYTXYDYJYMJJJ-QGZVFWFLSA-N 1 2 306.331 4.023 20 0 DIADLO Nc1cccc(F)c1C[N@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001140875039 1046937066 /nfs/dbraw/zinc/93/70/66/1046937066.db2.gz SRYTXYDYJYMJJJ-QGZVFWFLSA-N 1 2 306.331 4.023 20 0 DIADLO CCCCC[N@H+](Cc1nnc(CC)s1)Cc1ccc(F)cc1 ZINC000680046043 1046939728 /nfs/dbraw/zinc/93/97/28/1046939728.db2.gz GCXNZSASERFMPV-UHFFFAOYSA-N 1 2 321.465 4.432 20 0 DIADLO CCCCC[N@@H+](Cc1nnc(CC)s1)Cc1ccc(F)cc1 ZINC000680046043 1046939731 /nfs/dbraw/zinc/93/97/31/1046939731.db2.gz GCXNZSASERFMPV-UHFFFAOYSA-N 1 2 321.465 4.432 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c(F)c1F ZINC001140889689 1046943360 /nfs/dbraw/zinc/94/33/60/1046943360.db2.gz JPGYOXJJDPCFRI-CQSZACIVSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2F)c(F)c1F ZINC001140894388 1046945467 /nfs/dbraw/zinc/94/54/67/1046945467.db2.gz WIIKYXIITIDUEF-CQSZACIVSA-N 1 2 307.315 4.147 20 0 DIADLO CC(C)Cn1nccc1C[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000647189481 1046951862 /nfs/dbraw/zinc/95/18/62/1046951862.db2.gz XQXBQBWBYNYYAT-LBPRGKRZSA-N 1 2 309.816 4.182 20 0 DIADLO CC[C@@H](C)CCCCC(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000680221653 1046958739 /nfs/dbraw/zinc/95/87/39/1046958739.db2.gz YPIDSVHKGCWTJB-MRXNPFEDSA-N 1 2 313.445 4.095 20 0 DIADLO CCc1nc2ccc(NCc3c[nH+]cn3C(C)C)cc2s1 ZINC000647239611 1046960363 /nfs/dbraw/zinc/96/03/63/1046960363.db2.gz GKIUKVXDWPTJCB-UHFFFAOYSA-N 1 2 300.431 4.248 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2N(C)C)cs1 ZINC000162391160 1046966547 /nfs/dbraw/zinc/96/65/47/1046966547.db2.gz AQHVEEWQJJWZOI-RYUDHWBXSA-N 1 2 321.465 4.322 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1cc2ccccc2o1 ZINC000680354913 1046972069 /nfs/dbraw/zinc/97/20/69/1046972069.db2.gz KNEQNECKCLYHIV-QMTHXVAHSA-N 1 2 315.319 4.495 20 0 DIADLO COc1cc(C)ccc1[C@@H](C)[NH2+][C@H]1COc2cc(F)cc(F)c21 ZINC000680355425 1046973618 /nfs/dbraw/zinc/97/36/18/1046973618.db2.gz PJHAFYDVZBTYHE-ABAIWWIYSA-N 1 2 319.351 4.066 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3c(C)noc3C)cs2)o1 ZINC000680381615 1046977353 /nfs/dbraw/zinc/97/73/53/1046977353.db2.gz URMKAZASQYBUTL-SNVBAGLBSA-N 1 2 317.414 4.167 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000798931350 1046988302 /nfs/dbraw/zinc/98/83/02/1046988302.db2.gz KJNSUZPROHQJIG-GVDBMIGSSA-N 1 2 302.462 4.068 20 0 DIADLO Cc1cc(N(C)C)ccc1[NH2+][C@@H]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000798931350 1046988318 /nfs/dbraw/zinc/98/83/18/1046988318.db2.gz KJNSUZPROHQJIG-GVDBMIGSSA-N 1 2 302.462 4.068 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000798931356 1046988717 /nfs/dbraw/zinc/98/87/17/1046988717.db2.gz KJNSUZPROHQJIG-YESZJQIVSA-N 1 2 302.462 4.068 20 0 DIADLO Cc1cc(N(C)C)ccc1[NH2+][C@@H]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000798931356 1046988721 /nfs/dbraw/zinc/98/87/21/1046988721.db2.gz KJNSUZPROHQJIG-YESZJQIVSA-N 1 2 302.462 4.068 20 0 DIADLO COc1cc2c(cc1F)CC[C@H]2Nc1ccc([NH+](C)C)cc1C ZINC000798931990 1046988979 /nfs/dbraw/zinc/98/89/79/1046988979.db2.gz QQEZWMLUQUUREU-GOSISDBHSA-N 1 2 314.404 4.308 20 0 DIADLO CN1CCCc2cc([NH2+][C@@H]3CCC[C@H]([C@@H]4CCOC4)C3)ccc21 ZINC000798932768 1046990766 /nfs/dbraw/zinc/99/07/66/1046990766.db2.gz KAGWSPJPJSTKTH-CGTJXYLNSA-N 1 2 314.473 4.076 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1csnn1)c1ccc(SC(F)F)cc1 ZINC000828702848 1046993987 /nfs/dbraw/zinc/99/39/87/1046993987.db2.gz BNHNSRSEAYEBQX-BDAKNGLRSA-N 1 2 315.414 4.265 20 0 DIADLO Cc1cccc(C[N@@H+]2CCC[C@](C)(F)C2)c1Br ZINC001141089297 1047005984 /nfs/dbraw/zinc/00/59/84/1047005984.db2.gz QMRODYIIGWPOCN-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cccc(C[N@H+]2CCC[C@](C)(F)C2)c1Br ZINC001141089297 1047005997 /nfs/dbraw/zinc/00/59/97/1047005997.db2.gz QMRODYIIGWPOCN-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO CCCCc1ncc(C[N@H+](CC)Cc2ccc(Cl)cc2)[nH]1 ZINC001141071245 1046998719 /nfs/dbraw/zinc/99/87/19/1046998719.db2.gz HITFYBCHFVOJHV-UHFFFAOYSA-N 1 2 305.853 4.428 20 0 DIADLO CCCCc1ncc(C[N@@H+](CC)Cc2ccc(Cl)cc2)[nH]1 ZINC001141071245 1046998734 /nfs/dbraw/zinc/99/87/34/1046998734.db2.gz HITFYBCHFVOJHV-UHFFFAOYSA-N 1 2 305.853 4.428 20 0 DIADLO CCCCc1nc(C[N@H+](CC)Cc2ccc(Cl)cc2)c[nH]1 ZINC001141071245 1046998745 /nfs/dbraw/zinc/99/87/45/1046998745.db2.gz HITFYBCHFVOJHV-UHFFFAOYSA-N 1 2 305.853 4.428 20 0 DIADLO CCCCc1nc(C[N@@H+](CC)Cc2ccc(Cl)cc2)c[nH]1 ZINC001141071245 1046998754 /nfs/dbraw/zinc/99/87/54/1046998754.db2.gz HITFYBCHFVOJHV-UHFFFAOYSA-N 1 2 305.853 4.428 20 0 DIADLO CCCCc1[nH]c(CN(CC)Cc2cccc(F)c2F)c[nH+]1 ZINC001141073944 1046998895 /nfs/dbraw/zinc/99/88/95/1046998895.db2.gz QDVGATUTVOHRGQ-UHFFFAOYSA-N 1 2 307.388 4.053 20 0 DIADLO CCCCc1[nH]cc(CN(CC)Cc2cccc(F)c2F)[nH+]1 ZINC001141073944 1046998908 /nfs/dbraw/zinc/99/89/08/1046998908.db2.gz QDVGATUTVOHRGQ-UHFFFAOYSA-N 1 2 307.388 4.053 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124885 1047002964 /nfs/dbraw/zinc/00/29/64/1047002964.db2.gz AIGMTJNXTVKFIS-IUODEOHRSA-N 1 2 319.836 4.259 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124885 1047002980 /nfs/dbraw/zinc/00/29/80/1047002980.db2.gz AIGMTJNXTVKFIS-IUODEOHRSA-N 1 2 319.836 4.259 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3cnc(Cl)cn3)CC2)cc1 ZINC000799140207 1047003652 /nfs/dbraw/zinc/00/36/52/1047003652.db2.gz CINKJJOYQRKYFA-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3cnc(Cl)cn3)CC2)cc1 ZINC000799140207 1047003667 /nfs/dbraw/zinc/00/36/67/1047003667.db2.gz CINKJJOYQRKYFA-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO C[C@@H]1CCCC[C@H]1c1noc(-c2cccc(Cn3cc[nH+]c3)c2)n1 ZINC000680740275 1047022570 /nfs/dbraw/zinc/02/25/70/1047022570.db2.gz LSBQQAIOTQLSJF-RHSMWYFYSA-N 1 2 322.412 4.275 20 0 DIADLO CCCOc1cccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC000162777628 1047033531 /nfs/dbraw/zinc/03/35/31/1047033531.db2.gz ACFDWWPXZRROMS-UHFFFAOYSA-N 1 2 321.380 4.118 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cc1ncccc1C(F)(F)F ZINC000162770133 1047033864 /nfs/dbraw/zinc/03/38/64/1047033864.db2.gz BNQULXADGIJPIA-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1ncccc1C(F)(F)F ZINC000162770133 1047033876 /nfs/dbraw/zinc/03/38/76/1047033876.db2.gz BNQULXADGIJPIA-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO CC1(CO)CC[NH+](Cc2c(Cl)ccc(Cl)c2Cl)CC1 ZINC000680829558 1047051660 /nfs/dbraw/zinc/05/16/60/1047051660.db2.gz ABVLKYNQLNAOIS-UHFFFAOYSA-N 1 2 322.663 4.241 20 0 DIADLO COCc1ccc(CNc2[nH+]c3ccccc3n2C2CC2)cc1 ZINC000680852786 1047055370 /nfs/dbraw/zinc/05/53/70/1047055370.db2.gz WVLJIVDKKZYCBY-UHFFFAOYSA-N 1 2 307.397 4.130 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(-c3nnc(C)o3)cc2)cc1 ZINC001203106062 1047061011 /nfs/dbraw/zinc/06/10/11/1047061011.db2.gz HWBBDKCUUUGSFQ-UHFFFAOYSA-N 1 2 308.385 4.245 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(-c3nnc(C)o3)cc2)cc1 ZINC001203106062 1047061025 /nfs/dbraw/zinc/06/10/25/1047061025.db2.gz HWBBDKCUUUGSFQ-UHFFFAOYSA-N 1 2 308.385 4.245 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1cc(OC)c(OC)cc1F ZINC001141282955 1047075047 /nfs/dbraw/zinc/07/50/47/1047075047.db2.gz HJZVEJVRDQLNSE-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1cc(OC)c(OC)cc1F ZINC001141282955 1047075053 /nfs/dbraw/zinc/07/50/53/1047075053.db2.gz HJZVEJVRDQLNSE-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO FC(F)(F)c1cccc(C[NH2+]Cc2cscc2Cl)n1 ZINC000648656396 1047077891 /nfs/dbraw/zinc/07/78/91/1047077891.db2.gz WKMLOGYQHKNTNP-UHFFFAOYSA-N 1 2 306.740 4.105 20 0 DIADLO COc1ccsc1C[N@H+](Cc1ccccc1)Cc1ccccn1 ZINC001141318327 1047088356 /nfs/dbraw/zinc/08/83/56/1047088356.db2.gz BSQIYMXYTYCTIF-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO COc1ccsc1C[N@@H+](Cc1ccccc1)Cc1ccccn1 ZINC001141318327 1047088369 /nfs/dbraw/zinc/08/83/69/1047088369.db2.gz BSQIYMXYTYCTIF-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO COc1nc(C)cc(C)c1C[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000681108746 1047096334 /nfs/dbraw/zinc/09/63/34/1047096334.db2.gz UVSJGBSVJQQKSS-CYBMUJFWSA-N 1 2 319.474 4.138 20 0 DIADLO COc1cc(Cl)ncc1C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC001141341254 1047099443 /nfs/dbraw/zinc/09/94/43/1047099443.db2.gz UOVNUMQCSZFFNY-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cc(Cl)ncc1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC001141341254 1047099459 /nfs/dbraw/zinc/09/94/59/1047099459.db2.gz UOVNUMQCSZFFNY-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO CCSc1cccc(C[NH2+][C@H]2COc3cc(F)cc(F)c32)c1 ZINC000681133940 1047101620 /nfs/dbraw/zinc/10/16/20/1047101620.db2.gz IFBLWZXJUWPOHJ-HNNXBMFYSA-N 1 2 321.392 4.300 20 0 DIADLO CCC[N@H+](Cc1ncc(Cl)s1)Cc1ccc(OC)cc1 ZINC000681164036 1047104163 /nfs/dbraw/zinc/10/41/63/1047104163.db2.gz LQGLZANFGHDXCV-UHFFFAOYSA-N 1 2 310.850 4.217 20 0 DIADLO CCC[N@@H+](Cc1ncc(Cl)s1)Cc1ccc(OC)cc1 ZINC000681164036 1047104170 /nfs/dbraw/zinc/10/41/70/1047104170.db2.gz LQGLZANFGHDXCV-UHFFFAOYSA-N 1 2 310.850 4.217 20 0 DIADLO c1csc([C@@H]2CSCC[N@H+]2Cc2ccccc2C2CC2)n1 ZINC000681168050 1047105242 /nfs/dbraw/zinc/10/52/42/1047105242.db2.gz IAFDSWINKAHHPU-INIZCTEOSA-N 1 2 316.495 4.311 20 0 DIADLO c1csc([C@@H]2CSCC[N@@H+]2Cc2ccccc2C2CC2)n1 ZINC000681168050 1047105246 /nfs/dbraw/zinc/10/52/46/1047105246.db2.gz IAFDSWINKAHHPU-INIZCTEOSA-N 1 2 316.495 4.311 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CCc3cc(C(C)(C)C)ccc3C2)n1 ZINC001116079161 1047106163 /nfs/dbraw/zinc/10/61/63/1047106163.db2.gz GSJIWNRDPVSJRU-UHFFFAOYSA-N 1 2 311.473 4.320 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CCc3cc(C(C)(C)C)ccc3C2)n1 ZINC001116079161 1047106169 /nfs/dbraw/zinc/10/61/69/1047106169.db2.gz GSJIWNRDPVSJRU-UHFFFAOYSA-N 1 2 311.473 4.320 20 0 DIADLO Cc1c(CSC(C)C)cccc1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001116134673 1047110449 /nfs/dbraw/zinc/11/04/49/1047110449.db2.gz FSODQIFLIPZKTB-AWEZNQCLSA-N 1 2 317.458 4.033 20 0 DIADLO FC(F)[C@@H](Cc1ccccc1)[NH2+]Cc1cnc2ccccc2c1 ZINC000536861168 1047115328 /nfs/dbraw/zinc/11/53/28/1047115328.db2.gz BNBSCJAZHUWFDB-GOSISDBHSA-N 1 2 312.363 4.201 20 0 DIADLO C[C@@H](c1cccc(Cl)c1F)[N@@H+]1CCC[C@@H](OC(F)F)C1 ZINC000681410739 1047122367 /nfs/dbraw/zinc/12/23/67/1047122367.db2.gz XTEAEBOBOLODKT-VHSXEESVSA-N 1 2 307.743 4.244 20 0 DIADLO C[C@@H](c1cccc(Cl)c1F)[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000681410739 1047122370 /nfs/dbraw/zinc/12/23/70/1047122370.db2.gz XTEAEBOBOLODKT-VHSXEESVSA-N 1 2 307.743 4.244 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@@H+]2CC(C)(C)C2(C)C)c(Cl)c1 ZINC001116343875 1047130970 /nfs/dbraw/zinc/13/09/70/1047130970.db2.gz FCGFSBJMUXQKHT-CYBMUJFWSA-N 1 2 322.880 4.404 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@H+]2CC(C)(C)C2(C)C)c(Cl)c1 ZINC001116343875 1047130972 /nfs/dbraw/zinc/13/09/72/1047130972.db2.gz FCGFSBJMUXQKHT-CYBMUJFWSA-N 1 2 322.880 4.404 20 0 DIADLO CCCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1c[nH]cn1 ZINC000081197987 1047137099 /nfs/dbraw/zinc/13/70/99/1047137099.db2.gz VAMLWHUWORUEHO-QGZVFWFLSA-N 1 2 301.434 4.076 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccc(OCC3CC3)c(F)c2)o1 ZINC000537126004 1047139857 /nfs/dbraw/zinc/13/98/57/1047139857.db2.gz SIQZQPPLKDRWEZ-OLZOCXBDSA-N 1 2 318.392 4.323 20 0 DIADLO CC[C@](C)([NH2+]Cc1cc(OC(C)C)ccn1)c1nc(C)cs1 ZINC000649562378 1047142576 /nfs/dbraw/zinc/14/25/76/1047142576.db2.gz FMWYZKCUQCJUAU-KRWDZBQOSA-N 1 2 319.474 4.049 20 0 DIADLO c1c(C[NH2+]C(c2ccccc2)c2ccccc2)nn2c1CCCC2 ZINC000649553155 1047143464 /nfs/dbraw/zinc/14/34/64/1047143464.db2.gz GDLDXCNGOPYZSS-UHFFFAOYSA-N 1 2 317.436 4.099 20 0 DIADLO Cn1cc(C[N@H+](C)Cc2ccc(F)cc2Cl)c(C(C)(C)C)n1 ZINC000537179951 1047144879 /nfs/dbraw/zinc/14/48/79/1047144879.db2.gz OVDBBNBRFUNVAE-UHFFFAOYSA-N 1 2 323.843 4.142 20 0 DIADLO Cn1cc(C[N@@H+](C)Cc2ccc(F)cc2Cl)c(C(C)(C)C)n1 ZINC000537179951 1047144891 /nfs/dbraw/zinc/14/48/91/1047144891.db2.gz OVDBBNBRFUNVAE-UHFFFAOYSA-N 1 2 323.843 4.142 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+][C@H]1COc2c1cccc2Cl ZINC000681742794 1047145061 /nfs/dbraw/zinc/14/50/61/1047145061.db2.gz PLMVCYDQVGGHQJ-AWEZNQCLSA-N 1 2 312.171 4.356 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000649566857 1047145391 /nfs/dbraw/zinc/14/53/91/1047145391.db2.gz ZWDDDTBABRWBLE-LBPRGKRZSA-N 1 2 302.805 4.402 20 0 DIADLO C[C@H]([NH2+]Cc1cc2n(n1)CCCC2)c1cccc(Cl)c1Cl ZINC000649575524 1047147004 /nfs/dbraw/zinc/14/70/04/1047147004.db2.gz SAJQMTZRXISGKZ-NSHDSACASA-N 1 2 324.255 4.377 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)nc2F)cc1 ZINC001137474531 1047152951 /nfs/dbraw/zinc/15/29/51/1047152951.db2.gz XQVOEJBNYDCSHJ-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)nc2F)cc1 ZINC001137474531 1047152955 /nfs/dbraw/zinc/15/29/55/1047152955.db2.gz XQVOEJBNYDCSHJ-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc2c(NCc3cccnc3OC(C)C)cc[nH+]c12 ZINC000681976123 1047157282 /nfs/dbraw/zinc/15/72/82/1047157282.db2.gz SIVHMGMFGWNUNR-UHFFFAOYSA-N 1 2 323.396 4.038 20 0 DIADLO COc1cccc2c(N3CCC(c4cccnc4)CC3)cc[nH+]c12 ZINC000681989679 1047159759 /nfs/dbraw/zinc/15/97/59/1047159759.db2.gz IJZZDJYOZRHWCE-UHFFFAOYSA-N 1 2 319.408 4.022 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001141525879 1047163271 /nfs/dbraw/zinc/16/32/71/1047163271.db2.gz QSLUXTKFZMPYQD-GVDBMIGSSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(C)nc2Cl)n1 ZINC000838872827 1047167128 /nfs/dbraw/zinc/16/71/28/1047167128.db2.gz JYODGYIYLZALQU-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc(C)nc2Cl)n1 ZINC000838872827 1047167132 /nfs/dbraw/zinc/16/71/32/1047167132.db2.gz JYODGYIYLZALQU-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2nc(-c3ccccc3)oc2C)[C@H](CC)CO1 ZINC000649722122 1047167299 /nfs/dbraw/zinc/16/72/99/1047167299.db2.gz IQIFUDFRWOUJMW-IAGOWNOFSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2nc(-c3ccccc3)oc2C)[C@H](CC)CO1 ZINC000649722122 1047167304 /nfs/dbraw/zinc/16/73/04/1047167304.db2.gz IQIFUDFRWOUJMW-IAGOWNOFSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2nc(-c3ccsc3)oc2C)[C@@H](CC)CO1 ZINC000649720961 1047167507 /nfs/dbraw/zinc/16/75/07/1047167507.db2.gz RLHNDTWFJOUCHT-LSDHHAIUSA-N 1 2 320.458 4.101 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2nc(-c3ccsc3)oc2C)[C@@H](CC)CO1 ZINC000649720961 1047167510 /nfs/dbraw/zinc/16/75/10/1047167510.db2.gz RLHNDTWFJOUCHT-LSDHHAIUSA-N 1 2 320.458 4.101 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2nc(-c3ccsc3)oc2C)[C@H](CC)CO1 ZINC000649720960 1047167532 /nfs/dbraw/zinc/16/75/32/1047167532.db2.gz RLHNDTWFJOUCHT-HUUCEWRRSA-N 1 2 320.458 4.101 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2nc(-c3ccsc3)oc2C)[C@H](CC)CO1 ZINC000649720960 1047167535 /nfs/dbraw/zinc/16/75/35/1047167535.db2.gz RLHNDTWFJOUCHT-HUUCEWRRSA-N 1 2 320.458 4.101 20 0 DIADLO CC(=O)c1cccc(C[N@@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@@H]2C)c1 ZINC000827799518 1047172855 /nfs/dbraw/zinc/17/28/55/1047172855.db2.gz ZNLQHEYVLCAGLM-XFQAVAEZSA-N 1 2 323.436 4.240 20 0 DIADLO CC(=O)c1cccc(C[N@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@@H]2C)c1 ZINC000827799518 1047172863 /nfs/dbraw/zinc/17/28/63/1047172863.db2.gz ZNLQHEYVLCAGLM-XFQAVAEZSA-N 1 2 323.436 4.240 20 0 DIADLO Cc1cc(N[C@@H](C)[C@H](O)c2ccc(F)cc2)[nH+]c2ccccc12 ZINC001116736234 1047173716 /nfs/dbraw/zinc/17/37/16/1047173716.db2.gz NILNTUNKHOMJOZ-DJJJIMSYSA-N 1 2 310.372 4.216 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3cccc(Cl)c3nc2Cl)C[C@@H]1F ZINC001141543419 1047176298 /nfs/dbraw/zinc/17/62/98/1047176298.db2.gz AEIFRGWIWNJSDZ-RNCFNFMXSA-N 1 2 313.203 4.331 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3cccc(Cl)c3nc2Cl)C[C@@H]1F ZINC001141543419 1047176306 /nfs/dbraw/zinc/17/63/06/1047176306.db2.gz AEIFRGWIWNJSDZ-RNCFNFMXSA-N 1 2 313.203 4.331 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2nc(-c3ccccc3)c[nH]2)n1 ZINC001116833320 1047180229 /nfs/dbraw/zinc/18/02/29/1047180229.db2.gz UVQBHLVVFQAENS-IBGZPJMESA-N 1 2 318.424 4.117 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2nc(-c3ccccc3)c[nH]2)n1 ZINC001116833320 1047180238 /nfs/dbraw/zinc/18/02/38/1047180238.db2.gz UVQBHLVVFQAENS-IBGZPJMESA-N 1 2 318.424 4.117 20 0 DIADLO C[C@H](CC(=O)Nc1cc(C(F)F)ccc1Cl)n1cc[nH+]c1 ZINC000649847247 1047183435 /nfs/dbraw/zinc/18/34/35/1047183435.db2.gz DDKBTGXMQINYMJ-SECBINFHSA-N 1 2 313.735 4.064 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(F)cc(Br)cc2F)C2(CC2)C1 ZINC001141563842 1047191625 /nfs/dbraw/zinc/19/16/25/1047191625.db2.gz WIJZXQMSJKKVMA-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c(F)cc(Br)cc2F)C2(CC2)C1 ZINC001141563842 1047191631 /nfs/dbraw/zinc/19/16/31/1047191631.db2.gz WIJZXQMSJKKVMA-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO Cc1cc(F)c(C[NH2+]Cc2cc(C)cc(Cl)n2)c(Cl)c1 ZINC000839071609 1047191730 /nfs/dbraw/zinc/19/17/30/1047191730.db2.gz GQVQPPITUKUDHO-UHFFFAOYSA-N 1 2 313.203 4.434 20 0 DIADLO Clc1cnc(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)cn1 ZINC000839127566 1047196947 /nfs/dbraw/zinc/19/69/47/1047196947.db2.gz UZDRIRVCTNMUER-KRWDZBQOSA-N 1 2 313.832 4.247 20 0 DIADLO Clc1cnc(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)cn1 ZINC000839127566 1047196953 /nfs/dbraw/zinc/19/69/53/1047196953.db2.gz UZDRIRVCTNMUER-KRWDZBQOSA-N 1 2 313.832 4.247 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CC[C@H](c2ccco2)C1 ZINC000682463127 1047199440 /nfs/dbraw/zinc/19/94/40/1047199440.db2.gz RTUFSMTZVIEBSQ-AWEZNQCLSA-N 1 2 308.381 4.139 20 0 DIADLO FC(F)[C@H]1CC[N@H+](Cc2ccc(Br)c(Cl)c2)C1 ZINC000682531585 1047203071 /nfs/dbraw/zinc/20/30/71/1047203071.db2.gz PIGLOWILCMZMHC-VIFPVBQESA-N 1 2 324.596 4.190 20 0 DIADLO FC(F)[C@H]1CC[N@@H+](Cc2ccc(Br)c(Cl)c2)C1 ZINC000682531585 1047203079 /nfs/dbraw/zinc/20/30/79/1047203079.db2.gz PIGLOWILCMZMHC-VIFPVBQESA-N 1 2 324.596 4.190 20 0 DIADLO C[C@@H]1C[N@H+](C[C@@]2(C)CC2(Cl)Cl)C[C@@H](c2ccsc2)O1 ZINC000828047165 1047218217 /nfs/dbraw/zinc/21/82/17/1047218217.db2.gz HIPKUFLQXAGOKM-KGYLQXTDSA-N 1 2 320.285 4.094 20 0 DIADLO C[C@@H]1C[N@@H+](C[C@@]2(C)CC2(Cl)Cl)C[C@@H](c2ccsc2)O1 ZINC000828047165 1047218228 /nfs/dbraw/zinc/21/82/28/1047218228.db2.gz HIPKUFLQXAGOKM-KGYLQXTDSA-N 1 2 320.285 4.094 20 0 DIADLO CCN(c1ccccc1)c1ccc(C[NH2+]Cc2ncc(C)o2)cc1 ZINC000682780305 1047223714 /nfs/dbraw/zinc/22/37/14/1047223714.db2.gz GARPNPHTGNQZRT-UHFFFAOYSA-N 1 2 321.424 4.431 20 0 DIADLO Cc1cnc(C[NH2+]Cc2c(OC(C)C)ccc3ccccc32)o1 ZINC000682780984 1047224309 /nfs/dbraw/zinc/22/43/09/1047224309.db2.gz RBSXIBCJXOKFRH-UHFFFAOYSA-N 1 2 310.397 4.213 20 0 DIADLO COCc1cc[nH+]c(NCc2ccc(C(F)(F)F)c(C)c2)c1 ZINC000650243112 1047225405 /nfs/dbraw/zinc/22/54/05/1047225405.db2.gz KXXLUXRCBOZKBE-UHFFFAOYSA-N 1 2 310.319 4.167 20 0 DIADLO CC(C)c1cccc2c1N(C(=O)c1cccc3[nH+]ccn31)CCC2 ZINC000839436098 1047230894 /nfs/dbraw/zinc/23/08/94/1047230894.db2.gz NNJWTDJEBFLCCF-UHFFFAOYSA-N 1 2 319.408 4.051 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC001117595984 1047232452 /nfs/dbraw/zinc/23/24/52/1047232452.db2.gz UCGIYCUDJNIBCZ-XJKSGUPXSA-N 1 2 315.486 4.246 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC001117595984 1047232458 /nfs/dbraw/zinc/23/24/58/1047232458.db2.gz UCGIYCUDJNIBCZ-XJKSGUPXSA-N 1 2 315.486 4.246 20 0 DIADLO C[C@H]([NH2+]Cc1csc(Cl)n1)c1ccc(Cl)c(F)c1 ZINC001117756971 1047240229 /nfs/dbraw/zinc/24/02/29/1047240229.db2.gz NTZVVVLRCUZIFA-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc3cc(F)ccc3n2)no1 ZINC001141640352 1047242710 /nfs/dbraw/zinc/24/27/10/1047242710.db2.gz WRNSZPMYFMUUIN-GOSISDBHSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc3cc(F)ccc3n2)no1 ZINC001141640352 1047242723 /nfs/dbraw/zinc/24/27/23/1047242723.db2.gz WRNSZPMYFMUUIN-GOSISDBHSA-N 1 2 311.360 4.007 20 0 DIADLO CC(C)OC1CC(SCc2ccc(-n3cc[nH+]c3)cc2)C1 ZINC001117978490 1047253137 /nfs/dbraw/zinc/25/31/37/1047253137.db2.gz KLFKQWHKNJGGNI-UHFFFAOYSA-N 1 2 302.443 4.062 20 0 DIADLO Cc1ccnc(C[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)c1 ZINC000683021879 1047253568 /nfs/dbraw/zinc/25/35/68/1047253568.db2.gz MOUGWOFVQGQCPK-AWEZNQCLSA-N 1 2 309.438 4.364 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(SC(F)(F)F)c1)c1csnn1 ZINC000839662982 1047254386 /nfs/dbraw/zinc/25/43/86/1047254386.db2.gz NOUZNLYPZUGIAZ-MRVPVSSYSA-N 1 2 319.377 4.001 20 0 DIADLO CCn1ccc(C[N@H+](C)Cc2csc(-c3ccc(C)o3)n2)c1 ZINC000683030340 1047262105 /nfs/dbraw/zinc/26/21/05/1047262105.db2.gz CARHLWNWLVEDAI-UHFFFAOYSA-N 1 2 315.442 4.165 20 0 DIADLO CCn1ccc(C[N@@H+](C)Cc2csc(-c3ccc(C)o3)n2)c1 ZINC000683030340 1047262127 /nfs/dbraw/zinc/26/21/27/1047262127.db2.gz CARHLWNWLVEDAI-UHFFFAOYSA-N 1 2 315.442 4.165 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[N@@H+]1CCCC12CC2 ZINC001141689965 1047265266 /nfs/dbraw/zinc/26/52/66/1047265266.db2.gz UWPPONIHMHGYRZ-UHFFFAOYSA-N 1 2 318.617 4.370 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[N@H+]1CCCC12CC2 ZINC001141689965 1047265283 /nfs/dbraw/zinc/26/52/83/1047265283.db2.gz UWPPONIHMHGYRZ-UHFFFAOYSA-N 1 2 318.617 4.370 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[N@@H+]1CCC2(CC2)C1 ZINC001141692998 1047268685 /nfs/dbraw/zinc/26/86/85/1047268685.db2.gz UDPVYVUBGPWTBG-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[N@H+]1CCC2(CC2)C1 ZINC001141692998 1047268696 /nfs/dbraw/zinc/26/86/96/1047268696.db2.gz UDPVYVUBGPWTBG-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO CN(C)c1ccc([NH2+][C@@H]2CCCC23CCOCC3)cc1Cl ZINC000384957554 1047274194 /nfs/dbraw/zinc/27/41/94/1047274194.db2.gz CWEKXEOCKGWIHR-MRXNPFEDSA-N 1 2 308.853 4.167 20 0 DIADLO C[N@H+](Cc1nccs1)Cc1ccc2c(c1)Cc1ccccc1-2 ZINC001141739501 1047282826 /nfs/dbraw/zinc/28/28/26/1047282826.db2.gz KROGQVHTDHFOCY-UHFFFAOYSA-N 1 2 306.434 4.346 20 0 DIADLO C[N@@H+](Cc1nccs1)Cc1ccc2c(c1)Cc1ccccc1-2 ZINC001141739501 1047282837 /nfs/dbraw/zinc/28/28/37/1047282837.db2.gz KROGQVHTDHFOCY-UHFFFAOYSA-N 1 2 306.434 4.346 20 0 DIADLO COc1cccc(CNc2ccc([NH+]3CCCC3)cc2)c1F ZINC000388769934 1047289539 /nfs/dbraw/zinc/28/95/39/1047289539.db2.gz GBNQTVYMLQWDOX-UHFFFAOYSA-N 1 2 300.377 4.047 20 0 DIADLO O=C1SCCN1C[N@@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000840160969 1047290493 /nfs/dbraw/zinc/29/04/93/1047290493.db2.gz FBCCAVBFKJONOZ-INIZCTEOSA-N 1 2 316.470 4.120 20 0 DIADLO O=C1SCCN1C[N@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000840160969 1047290508 /nfs/dbraw/zinc/29/05/08/1047290508.db2.gz FBCCAVBFKJONOZ-INIZCTEOSA-N 1 2 316.470 4.120 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1cc(Br)cc(F)c1F ZINC001141795291 1047290831 /nfs/dbraw/zinc/29/08/31/1047290831.db2.gz CGOYCPGZMCMLNX-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1cc(Br)cc(F)c1F ZINC001141795291 1047290845 /nfs/dbraw/zinc/29/08/45/1047290845.db2.gz CGOYCPGZMCMLNX-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO COc1ccc2cc(NCc3c[nH+]c4ccc(C)cn34)ccc2c1 ZINC000796457720 1047298809 /nfs/dbraw/zinc/29/88/09/1047298809.db2.gz GJGSSGOSPPECJP-UHFFFAOYSA-N 1 2 317.392 4.417 20 0 DIADLO CC(C)CCn1cccc1C[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000897944655 1047304438 /nfs/dbraw/zinc/30/44/38/1047304438.db2.gz JTFKYJLSDLTPIZ-UHFFFAOYSA-N 1 2 303.450 4.110 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1cnn(-c2ccccc2)c1 ZINC000391488596 1047304687 /nfs/dbraw/zinc/30/46/87/1047304687.db2.gz YISVYKMNEIJAAJ-HNNXBMFYSA-N 1 2 306.413 4.111 20 0 DIADLO Fc1c(Br)ccc(Cl)c1C[N@@H+]1CCC2(CC2)C1 ZINC001141887587 1047305549 /nfs/dbraw/zinc/30/55/49/1047305549.db2.gz MDZGBFNHWVPHOF-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO Fc1c(Br)ccc(Cl)c1C[N@H+]1CCC2(CC2)C1 ZINC001141887587 1047305563 /nfs/dbraw/zinc/30/55/63/1047305563.db2.gz MDZGBFNHWVPHOF-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(F)c(Br)cc2Cl)C1 ZINC001141919667 1047310676 /nfs/dbraw/zinc/31/06/76/1047310676.db2.gz AYGVGFCFSKIMKL-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(F)c(Br)cc2Cl)C1 ZINC001141919667 1047310686 /nfs/dbraw/zinc/31/06/86/1047310686.db2.gz AYGVGFCFSKIMKL-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCC[C@H]1CCCC1=O ZINC001118895344 1047314850 /nfs/dbraw/zinc/31/48/50/1047314850.db2.gz PUESWDZARQSJHE-OAHLLOKOSA-N 1 2 314.454 4.173 20 0 DIADLO Fc1ccc(F)c([C@H]2CCC[N@@H+]2Cc2cccc3c2OCO3)c1 ZINC001141956420 1047315948 /nfs/dbraw/zinc/31/59/48/1047315948.db2.gz CBMZSRMVZUSNFP-MRXNPFEDSA-N 1 2 317.335 4.031 20 0 DIADLO Fc1ccc(F)c([C@H]2CCC[N@H+]2Cc2cccc3c2OCO3)c1 ZINC001141956420 1047315960 /nfs/dbraw/zinc/31/59/60/1047315960.db2.gz CBMZSRMVZUSNFP-MRXNPFEDSA-N 1 2 317.335 4.031 20 0 DIADLO CCc1cnc(C[NH2+][C@H]2CCc3ccc(F)c(Cl)c32)s1 ZINC000651726461 1047324173 /nfs/dbraw/zinc/32/41/73/1047324173.db2.gz NFWDYRUGDCKWAZ-LBPRGKRZSA-N 1 2 310.825 4.275 20 0 DIADLO CCc1cccc(C[NH2+][C@@H](c2ccn(C)n2)c2ccc(F)cc2)c1 ZINC000651748342 1047326281 /nfs/dbraw/zinc/32/62/81/1047326281.db2.gz HQZGPGAIYIANJF-HXUWFJFHSA-N 1 2 323.415 4.001 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+]Cc1nc(C(C)C)n2ccccc12 ZINC000651748321 1047327854 /nfs/dbraw/zinc/32/78/54/1047327854.db2.gz HHILQUQUHJBJNL-HNNXBMFYSA-N 1 2 308.429 4.012 20 0 DIADLO FC(F)(F)Sc1ccccc1C[NH2+]Cc1cscn1 ZINC000898280002 1047335208 /nfs/dbraw/zinc/33/52/08/1047335208.db2.gz AMOTVGXDDFTCJT-UHFFFAOYSA-N 1 2 304.362 4.045 20 0 DIADLO CC1(C)C[N@H+](Cc2sccc2Oc2ccccc2)CCO1 ZINC001141994739 1047336951 /nfs/dbraw/zinc/33/69/51/1047336951.db2.gz XYVFZGZHDYKLGX-UHFFFAOYSA-N 1 2 303.427 4.151 20 0 DIADLO CC1(C)C[N@@H+](Cc2sccc2Oc2ccccc2)CCO1 ZINC001141994739 1047336959 /nfs/dbraw/zinc/33/69/59/1047336959.db2.gz XYVFZGZHDYKLGX-UHFFFAOYSA-N 1 2 303.427 4.151 20 0 DIADLO CCC/C(C)=C\C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000726146024 1047337880 /nfs/dbraw/zinc/33/78/80/1047337880.db2.gz CXMJEPDPZVKUGT-XFXZXTDPSA-N 1 2 303.793 4.211 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[N@H+](C)Cc1conc1C ZINC000652039052 1047340128 /nfs/dbraw/zinc/34/01/28/1047340128.db2.gz JKVJELUWYOIJQR-HNNXBMFYSA-N 1 2 320.820 4.154 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[N@@H+](C)Cc1conc1C ZINC000652039052 1047340139 /nfs/dbraw/zinc/34/01/39/1047340139.db2.gz JKVJELUWYOIJQR-HNNXBMFYSA-N 1 2 320.820 4.154 20 0 DIADLO Cc1cc(C)c(CNC(=S)Nc2cccc(C(C)C)c2)c[nH+]1 ZINC000840827037 1047340809 /nfs/dbraw/zinc/34/08/09/1047340809.db2.gz ZNODMAUIDSSWJW-UHFFFAOYSA-N 1 2 313.470 4.308 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2ccc(SC)c(F)c2)c1 ZINC000652067771 1047342113 /nfs/dbraw/zinc/34/21/13/1047342113.db2.gz GURUEJQNZFPWGM-LLVKDONJSA-N 1 2 306.406 4.262 20 0 DIADLO Cc1[nH]ncc1C[NH2+]C1(c2ccc(Cl)cc2)CCCCC1 ZINC000105427775 1047344336 /nfs/dbraw/zinc/34/43/36/1047344336.db2.gz NBLDOOQNZXLACP-UHFFFAOYSA-N 1 2 303.837 4.321 20 0 DIADLO Fc1cc(Br)c(C[N@@H+]2CC3CCC2CC3)cc1F ZINC001142013503 1047344907 /nfs/dbraw/zinc/34/49/07/1047344907.db2.gz OVYNEICAFJIZDW-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(Br)c(C[N@H+]2CC3CCC2CC3)cc1F ZINC001142013503 1047344913 /nfs/dbraw/zinc/34/49/13/1047344913.db2.gz OVYNEICAFJIZDW-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO CSc1ccc(C[N@H+](C)Cc2cnc(Cl)s2)s1 ZINC001142018398 1047347493 /nfs/dbraw/zinc/34/74/93/1047347493.db2.gz GBGYZCVUQSRTAW-UHFFFAOYSA-N 1 2 304.893 4.212 20 0 DIADLO CSc1ccc(C[N@@H+](C)Cc2cnc(Cl)s2)s1 ZINC001142018398 1047347503 /nfs/dbraw/zinc/34/75/03/1047347503.db2.gz GBGYZCVUQSRTAW-UHFFFAOYSA-N 1 2 304.893 4.212 20 0 DIADLO C[C@@H]([NH2+][C@H]1CC(C)(C)Oc2ccc(F)cc21)c1cscn1 ZINC000652266705 1047349474 /nfs/dbraw/zinc/34/94/74/1047349474.db2.gz JNOOJFSJZUKWRE-MFKMUULPSA-N 1 2 306.406 4.235 20 0 DIADLO CC[C@@H](Nc1cc(COC)cc[nH+]1)c1ccc(OC(F)F)cc1 ZINC000652329869 1047354145 /nfs/dbraw/zinc/35/41/45/1047354145.db2.gz MEWVSCDRYRCBAY-OAHLLOKOSA-N 1 2 322.355 4.393 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2ccc(C(F)(F)F)cc2)c1 ZINC000652330897 1047356597 /nfs/dbraw/zinc/35/65/97/1047356597.db2.gz SCGKHDLVPOXLMX-LLVKDONJSA-N 1 2 310.319 4.420 20 0 DIADLO c1coc(-c2cc(C[N@@H+](Cc3cccs3)C3CC3)no2)c1 ZINC000045007017 1047356532 /nfs/dbraw/zinc/35/65/32/1047356532.db2.gz XFGAMOUQMNRXIT-UHFFFAOYSA-N 1 2 300.383 4.161 20 0 DIADLO c1coc(-c2cc(C[N@H+](Cc3cccs3)C3CC3)no2)c1 ZINC000045007017 1047356538 /nfs/dbraw/zinc/35/65/38/1047356538.db2.gz XFGAMOUQMNRXIT-UHFFFAOYSA-N 1 2 300.383 4.161 20 0 DIADLO CCn1c(C)nn(C[N@H+](C)C2CCC(C(C)(C)C)CC2)c1=S ZINC000726586318 1047366860 /nfs/dbraw/zinc/36/68/60/1047366860.db2.gz IQUBSISQLYOOAM-UHFFFAOYSA-N 1 2 324.538 4.237 20 0 DIADLO CCn1c(C)nn(C[N@@H+](C)C2CCC(C(C)(C)C)CC2)c1=S ZINC000726586318 1047366873 /nfs/dbraw/zinc/36/68/73/1047366873.db2.gz IQUBSISQLYOOAM-UHFFFAOYSA-N 1 2 324.538 4.237 20 0 DIADLO CCC[N@H+](Cn1ncsc1=S)[C@@H]1CCc2ccccc21 ZINC000726588024 1047367868 /nfs/dbraw/zinc/36/78/68/1047367868.db2.gz BHBKFFAQCCYUQI-CQSZACIVSA-N 1 2 305.472 4.031 20 0 DIADLO CCC[N@@H+](Cn1ncsc1=S)[C@@H]1CCc2ccccc21 ZINC000726588024 1047367881 /nfs/dbraw/zinc/36/78/81/1047367881.db2.gz BHBKFFAQCCYUQI-CQSZACIVSA-N 1 2 305.472 4.031 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)Cc3cccc(C)c3)c2)[nH+]c1C ZINC000726769688 1047380713 /nfs/dbraw/zinc/38/07/13/1047380713.db2.gz ZKCYSTXCJSZIJN-UHFFFAOYSA-N 1 2 319.408 4.183 20 0 DIADLO Oc1cc(Cl)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)c(Cl)c1 ZINC001142105699 1047381830 /nfs/dbraw/zinc/38/18/30/1047381830.db2.gz KIDCQEQTIRIRIX-MRXNPFEDSA-N 1 2 323.223 4.431 20 0 DIADLO CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)[NH+]1CCC(F)(F)CC1 ZINC000796540173 1047384005 /nfs/dbraw/zinc/38/40/05/1047384005.db2.gz HHPBTSRBTUZGKC-KGLIPLIRSA-N 1 2 324.415 4.258 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1ccc(C)o1)c1ccccc1 ZINC000108421211 1047398183 /nfs/dbraw/zinc/39/81/83/1047398183.db2.gz NTUARYCTZKOYMD-FQEVSTJZSA-N 1 2 307.393 4.476 20 0 DIADLO COc1ccc(C(C)C)cc1C[NH2+][C@@H](C)c1ncc(C)s1 ZINC000653616284 1047408901 /nfs/dbraw/zinc/40/89/01/1047408901.db2.gz OPQMMTZMXDPHEO-ZDUSSCGKSA-N 1 2 304.459 4.434 20 0 DIADLO C/C(=C\c1ccc(F)cc1)C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000749347879 1047412578 /nfs/dbraw/zinc/41/25/78/1047412578.db2.gz JRWGTFSPOMGYSZ-SDNWHVSQSA-N 1 2 321.355 4.053 20 0 DIADLO C/C(=C/C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000749380829 1047414460 /nfs/dbraw/zinc/41/44/60/1047414460.db2.gz BRQSGGKMJXHLKH-YPKPFQOOSA-N 1 2 303.365 4.119 20 0 DIADLO C[C@H](Cc1ccc(F)cc1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000749382170 1047414929 /nfs/dbraw/zinc/41/49/29/1047414929.db2.gz MMSLNJATBBYRDF-CYBMUJFWSA-N 1 2 323.371 4.033 20 0 DIADLO CC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC001142247384 1047415284 /nfs/dbraw/zinc/41/52/84/1047415284.db2.gz XELYNCLWGQWVFI-PBHICJAKSA-N 1 2 311.429 4.458 20 0 DIADLO CC1=C(C)C[N@H+](Cc2ccc(Cl)nc2C(F)(F)F)CC1 ZINC000796592262 1047426752 /nfs/dbraw/zinc/42/67/52/1047426752.db2.gz DQVVWFSLZSSSQF-UHFFFAOYSA-N 1 2 304.743 4.296 20 0 DIADLO CC1=C(C)C[N@@H+](Cc2ccc(Cl)nc2C(F)(F)F)CC1 ZINC000796592262 1047426758 /nfs/dbraw/zinc/42/67/58/1047426758.db2.gz DQVVWFSLZSSSQF-UHFFFAOYSA-N 1 2 304.743 4.296 20 0 DIADLO COc1ccc(C)cc1C[NH2+][C@@H](Cc1ccccc1)c1ncco1 ZINC000653910004 1047431676 /nfs/dbraw/zinc/43/16/76/1047431676.db2.gz SKAQRFZHUXCNPZ-SFHVURJKSA-N 1 2 322.408 4.065 20 0 DIADLO CC(C)C[C@@H](C(=O)N(C1CC1)C1CCC(C)CC1)n1cc[nH+]c1 ZINC001142428538 1047445588 /nfs/dbraw/zinc/44/55/88/1047445588.db2.gz RGGYJBDIVWVWKU-HTWSVDAQSA-N 1 2 317.477 4.040 20 0 DIADLO CSc1ncc(C[N@@H+]2CCC[C@@H]2c2ccccc2)c(Cl)n1 ZINC001142426956 1047445699 /nfs/dbraw/zinc/44/56/99/1047445699.db2.gz GPQWSKLJLUZDIY-CQSZACIVSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1ncc(C[N@H+]2CCC[C@@H]2c2ccccc2)c(Cl)n1 ZINC001142426956 1047445703 /nfs/dbraw/zinc/44/57/03/1047445703.db2.gz GPQWSKLJLUZDIY-CQSZACIVSA-N 1 2 319.861 4.189 20 0 DIADLO CC(C)(C)OC(=O)Nc1ccc(CCNc2cccc[nH+]2)cc1 ZINC000088754748 1047470119 /nfs/dbraw/zinc/47/01/19/1047470119.db2.gz RWZTXZPCGSYLBY-UHFFFAOYSA-N 1 2 313.401 4.083 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cnccn1)c1nc(-c2ccccc2)cs1 ZINC000089553652 1047485043 /nfs/dbraw/zinc/48/50/43/1047485043.db2.gz MQJGVRKMCMBMQL-CHWSQXEVSA-N 1 2 310.426 4.012 20 0 DIADLO C[N@H+](Cc1nc2ccccc2s1)Cc1cc(F)cc(F)c1 ZINC000120780348 1047499902 /nfs/dbraw/zinc/49/99/02/1047499902.db2.gz ZIVQGOHPIMJTGE-UHFFFAOYSA-N 1 2 304.365 4.207 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2s1)Cc1cc(F)cc(F)c1 ZINC000120780348 1047499908 /nfs/dbraw/zinc/49/99/08/1047499908.db2.gz ZIVQGOHPIMJTGE-UHFFFAOYSA-N 1 2 304.365 4.207 20 0 DIADLO FC1(F)CCC([NH2+]c2ccc(N3CCSCC3)cc2)CC1 ZINC000842866015 1047509831 /nfs/dbraw/zinc/50/98/31/1047509831.db2.gz YEIFHDOWQLWTHL-UHFFFAOYSA-N 1 2 312.429 4.230 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000091702671 1047520845 /nfs/dbraw/zinc/52/08/45/1047520845.db2.gz KDGLEUHOTOCGFT-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)[C@H](C)c1ccccn1 ZINC000091702671 1047520848 /nfs/dbraw/zinc/52/08/48/1047520848.db2.gz KDGLEUHOTOCGFT-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1cccc(C[NH+](Cc2cccs2)Cc2cccc(C)n2)n1 ZINC000091893996 1047524846 /nfs/dbraw/zinc/52/48/46/1047524846.db2.gz MCLFCZOSVQYYRF-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO CC[N@H+](Cc1occc1Br)Cc1ccc(F)cc1 ZINC001143128911 1047534014 /nfs/dbraw/zinc/53/40/14/1047534014.db2.gz VMOZWFUCNAECPE-UHFFFAOYSA-N 1 2 312.182 4.203 20 0 DIADLO CC[N@@H+](Cc1occc1Br)Cc1ccc(F)cc1 ZINC001143128911 1047534020 /nfs/dbraw/zinc/53/40/20/1047534020.db2.gz VMOZWFUCNAECPE-UHFFFAOYSA-N 1 2 312.182 4.203 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2C[C@H](C)O[C@@H](c3ccccc3)C2)s1 ZINC000092486144 1047535404 /nfs/dbraw/zinc/53/54/04/1047535404.db2.gz ZFADSFOFVQHXGZ-WMLDXEAASA-N 1 2 316.470 4.229 20 0 DIADLO CC(C)c1ncc(C[N@H+]2C[C@H](C)O[C@@H](c3ccccc3)C2)s1 ZINC000092486144 1047535410 /nfs/dbraw/zinc/53/54/10/1047535410.db2.gz ZFADSFOFVQHXGZ-WMLDXEAASA-N 1 2 316.470 4.229 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2cccc(F)c2)c(F)c1F ZINC001143269205 1047546023 /nfs/dbraw/zinc/54/60/23/1047546023.db2.gz LAZWLRFALGSXCV-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2cccc(F)c2)c(F)c1F ZINC001143269205 1047546025 /nfs/dbraw/zinc/54/60/25/1047546025.db2.gz LAZWLRFALGSXCV-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ccccc2OC)c(F)c1F ZINC001143276168 1047547203 /nfs/dbraw/zinc/54/72/03/1047547203.db2.gz HMQBFRLISTXAQS-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ccccc2OC)c(F)c1F ZINC001143276168 1047547208 /nfs/dbraw/zinc/54/72/08/1047547208.db2.gz HMQBFRLISTXAQS-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO O=C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1c(Cl)cccc1C(F)(F)F ZINC001143283185 1047548260 /nfs/dbraw/zinc/54/82/60/1047548260.db2.gz ONMLJAXWPLOYRR-AOOOYVTPSA-N 1 2 317.738 4.055 20 0 DIADLO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1c(Cl)cccc1C(F)(F)F ZINC001143283185 1047548266 /nfs/dbraw/zinc/54/82/66/1047548266.db2.gz ONMLJAXWPLOYRR-AOOOYVTPSA-N 1 2 317.738 4.055 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1ccc(F)c(OC)c1F ZINC001143321670 1047552512 /nfs/dbraw/zinc/55/25/12/1047552512.db2.gz MPDNZJUTHLBKPJ-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1ccc(F)c(OC)c1F ZINC001143321670 1047552523 /nfs/dbraw/zinc/55/25/23/1047552523.db2.gz MPDNZJUTHLBKPJ-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cccc(-c3cccnc3)c2)s1 ZINC000093807567 1047553054 /nfs/dbraw/zinc/55/30/54/1047553054.db2.gz GKMRTJFPMDCDBQ-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cccc(-c3cccnc3)c2)s1 ZINC000093807567 1047553057 /nfs/dbraw/zinc/55/30/57/1047553057.db2.gz GKMRTJFPMDCDBQ-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO C[C@@H]1CCN(C(=O)CCCC2CCCCC2)C[C@H]1n1cc[nH+]c1 ZINC000122781114 1047556184 /nfs/dbraw/zinc/55/61/84/1047556184.db2.gz SDPGYVAQIANBQQ-SJLPKXTDSA-N 1 2 317.477 4.043 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2ccc(F)cc2OC(F)F)s1 ZINC000123024135 1047568394 /nfs/dbraw/zinc/56/83/94/1047568394.db2.gz ZRKGYYUCMHKYDY-SECBINFHSA-N 1 2 316.348 4.043 20 0 DIADLO Cc1[nH]ncc1C[N@@H+]1CC[C@H](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000537654482 1047569663 /nfs/dbraw/zinc/56/96/63/1047569663.db2.gz AOINWNHZMSMLEK-MEDUHNTESA-N 1 2 323.362 4.320 20 0 DIADLO C[N@H+](Cc1ccc[nH]1)Cc1cc(Br)ccc1Cl ZINC000537661189 1047572525 /nfs/dbraw/zinc/57/25/25/1047572525.db2.gz MTLHJBQTWDYNTD-UHFFFAOYSA-N 1 2 313.626 4.063 20 0 DIADLO C[N@@H+](Cc1ccc[nH]1)Cc1cc(Br)ccc1Cl ZINC000537661189 1047572532 /nfs/dbraw/zinc/57/25/32/1047572532.db2.gz MTLHJBQTWDYNTD-UHFFFAOYSA-N 1 2 313.626 4.063 20 0 DIADLO CC(=CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1)c1ccc(F)cc1 ZINC001150105790 1047573973 /nfs/dbraw/zinc/57/39/73/1047573973.db2.gz APLPLMYSSISADY-PKNBQFBNSA-N 1 2 309.344 4.052 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCc3cccc(Cl)n3)c2c1 ZINC000760551736 1047585172 /nfs/dbraw/zinc/58/51/72/1047585172.db2.gz KROUDOHXVOCEHG-UHFFFAOYSA-N 1 2 314.772 4.179 20 0 DIADLO Cc1cc(Cl)cc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC000477046622 1047590584 /nfs/dbraw/zinc/59/05/84/1047590584.db2.gz GKCRPNFNUCLBIN-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO CC(C)c1ccc([C@@H](C)NC(=O)c2cc3c[nH+]ccc3[nH]2)cc1 ZINC001151978127 1047605300 /nfs/dbraw/zinc/60/53/00/1047605300.db2.gz ADDRIZDJPDPTGE-CYBMUJFWSA-N 1 2 307.397 4.177 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cccc1F)c1ccccc1OC(F)F ZINC000315405815 1047605933 /nfs/dbraw/zinc/60/59/33/1047605933.db2.gz GZRZYKNXORHOLP-SNVBAGLBSA-N 1 2 313.294 4.417 20 0 DIADLO CC[N@H+](Cc1nc(C)cs1)Cc1cccc(C(F)(F)F)c1 ZINC001204380712 1047614899 /nfs/dbraw/zinc/61/48/99/1047614899.db2.gz KGHAJGPJNUIQGQ-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CC[N@@H+](Cc1nc(C)cs1)Cc1cccc(C(F)(F)F)c1 ZINC001204380712 1047614901 /nfs/dbraw/zinc/61/49/01/1047614901.db2.gz KGHAJGPJNUIQGQ-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](c2ccccc2)c2cccc(F)c2)nn1C ZINC000282082645 1047621321 /nfs/dbraw/zinc/62/13/21/1047621321.db2.gz HQQONMYJXVSFQJ-YWZLYKJASA-N 1 2 323.415 4.308 20 0 DIADLO Cc1cscc1C(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1 ZINC001153557344 1047627775 /nfs/dbraw/zinc/62/77/75/1047627775.db2.gz WWGHIHLXEBDSAE-UHFFFAOYSA-N 1 2 311.410 4.316 20 0 DIADLO CC(C)c1cccc2cc(C(=O)Nc3cccc4[nH+]ccn43)[nH]c21 ZINC001154095147 1047639612 /nfs/dbraw/zinc/63/96/12/1047639612.db2.gz DYGWDBGUMXEYGG-UHFFFAOYSA-N 1 2 318.380 4.191 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+]2CCC[C@@H](Oc3ccccc3Cl)C2)o1 ZINC000537850782 1047639920 /nfs/dbraw/zinc/63/99/20/1047639920.db2.gz CCKJAMHPNBLLAM-UONOGXRCSA-N 1 2 320.820 4.241 20 0 DIADLO Cc1cnc([C@H](C)[N@H+]2CCC[C@@H](Oc3ccccc3Cl)C2)o1 ZINC000537850782 1047639926 /nfs/dbraw/zinc/63/99/26/1047639926.db2.gz CCKJAMHPNBLLAM-UONOGXRCSA-N 1 2 320.820 4.241 20 0 DIADLO CC(C)C[C@@H](C(=O)NCC[C@@H](C)CC(C)(C)C)n1cc[nH+]c1 ZINC001154338602 1047645648 /nfs/dbraw/zinc/64/56/48/1047645648.db2.gz BBLVRMTZVUBLFU-CVEARBPZSA-N 1 2 307.482 4.049 20 0 DIADLO C[C@H]([NH2+][C@H](C(=O)Nc1ccccc1)c1ccccc1)c1ccoc1 ZINC000537985610 1047650838 /nfs/dbraw/zinc/65/08/38/1047650838.db2.gz CRKMMUMZQVYQKS-KXBFYZLASA-N 1 2 320.392 4.310 20 0 DIADLO COC(OC)c1cc(C)c[nH+]c1N[C@H](c1ccccc1)C1CC1 ZINC001154645988 1047653611 /nfs/dbraw/zinc/65/36/11/1047653611.db2.gz VFOUDZVUYBDJBW-QGZVFWFLSA-N 1 2 312.413 4.245 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nnc(-c2ccc(F)cc2)[nH]1)c1ccccc1 ZINC000538117858 1047657102 /nfs/dbraw/zinc/65/71/02/1047657102.db2.gz YRLQELSELVLZJU-SFHVURJKSA-N 1 2 324.403 4.098 20 0 DIADLO COc1ccc2ccc(NCc3ccc4c(ccn4C)c3)[nH+]c2c1 ZINC001154804352 1047657433 /nfs/dbraw/zinc/65/74/33/1047657433.db2.gz UGFVPICXFZETSO-UHFFFAOYSA-N 1 2 317.392 4.347 20 0 DIADLO COC(=O)CCCCCCNc1[nH+]ccc2cc(Cl)ccc21 ZINC001155004096 1047664379 /nfs/dbraw/zinc/66/43/79/1047664379.db2.gz HFWJQNRCOMGEIN-UHFFFAOYSA-N 1 2 320.820 4.424 20 0 DIADLO CC(=O)c1ccc2c(c1)CN(c1ccc(C(C)(C)C)c[nH+]1)CC2 ZINC001155086883 1047667943 /nfs/dbraw/zinc/66/79/43/1047667943.db2.gz KXRMKFNRHNYYDE-UHFFFAOYSA-N 1 2 308.425 4.144 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(COCc2ccccc2)c1)c1ncco1 ZINC000924660237 1047668062 /nfs/dbraw/zinc/66/80/62/1047668062.db2.gz JMXWSSUCYXXBOD-INIZCTEOSA-N 1 2 322.408 4.242 20 0 DIADLO COc1ccc2[nH+]c(NC[C@@H]3CCC(F)(F)C3)c(C)cc2c1 ZINC001155166418 1047669625 /nfs/dbraw/zinc/66/96/25/1047669625.db2.gz LIDKNRZHNDUQKY-GFCCVEGCSA-N 1 2 306.356 4.399 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)c2oc3ccccc3c2C)[nH+]c1C ZINC001155173285 1047670114 /nfs/dbraw/zinc/67/01/14/1047670114.db2.gz DNPOQHGZFQKTIY-HNNXBMFYSA-N 1 2 323.396 4.058 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1cnc(Cl)nc1Oc1ccccc1F ZINC001155181806 1047670979 /nfs/dbraw/zinc/67/09/79/1047670979.db2.gz RJKDPGRJSZRQOA-UHFFFAOYSA-N 1 2 322.771 4.497 20 0 DIADLO CCc1noc(C[NH2+][C@@H](c2ccc(CC(C)C)cc2)C2CC2)n1 ZINC000152585866 1047671096 /nfs/dbraw/zinc/67/10/96/1047671096.db2.gz QAMNOYPJFFWCJA-IBGZPJMESA-N 1 2 313.445 4.071 20 0 DIADLO Cn1c(CNc2cc3ccccc3c[nH+]2)ccc1C(F)(F)F ZINC001155242384 1047673481 /nfs/dbraw/zinc/67/34/81/1047673481.db2.gz FSHSYSVLHLZWTA-UHFFFAOYSA-N 1 2 305.303 4.204 20 0 DIADLO COC(=O)c1ccc(C2(Nc3ccc(C(C)(C)C)c[nH+]3)CC2)cc1 ZINC001155313846 1047676623 /nfs/dbraw/zinc/67/66/23/1047676623.db2.gz FUCJFLBZVIWXEC-UHFFFAOYSA-N 1 2 324.424 4.267 20 0 DIADLO Cc1cc(N2CCc3c4ccccc4oc3C2)nc(C(C)(C)C)[nH+]1 ZINC001155517453 1047683130 /nfs/dbraw/zinc/68/31/30/1047683130.db2.gz LEEYBOQPOXQDDI-UHFFFAOYSA-N 1 2 321.424 4.391 20 0 DIADLO CC[C@H](Nc1ccc([NH+]2CCCC2)cc1C)C1CCOCC1 ZINC000538508195 1047684277 /nfs/dbraw/zinc/68/42/77/1047684277.db2.gz AWSDPNDSNBUALQ-SFHVURJKSA-N 1 2 302.462 4.212 20 0 DIADLO Cc1cc(NCc2c(Cl)ccc(C)c2F)nc(C2CC2)[nH+]1 ZINC001155832682 1047689852 /nfs/dbraw/zinc/68/98/52/1047689852.db2.gz ICZYTASYIWAMHI-UHFFFAOYSA-N 1 2 305.784 4.375 20 0 DIADLO COc1cccc(CCNc2[nH+]c(C)cc(Cl)c2C)c1OC ZINC001155859229 1047689907 /nfs/dbraw/zinc/68/99/07/1047689907.db2.gz ZICYNDUQJHSKES-UHFFFAOYSA-N 1 2 320.820 4.024 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)C[C@H]2CCc3ccccc32)c(C)[nH+]1 ZINC000667119641 1047695539 /nfs/dbraw/zinc/69/55/39/1047695539.db2.gz YNFZIRGKWYSDCW-QGZVFWFLSA-N 1 2 323.440 4.201 20 0 DIADLO C[C@@]12c3ccccc3[C@@H](Cc3ccccc31)N2c1ccc(N)c[nH+]1 ZINC001156004268 1047696027 /nfs/dbraw/zinc/69/60/27/1047696027.db2.gz DSLHPGLSEBHKFY-CTNGQTDRSA-N 1 2 313.404 4.045 20 0 DIADLO CCSc1cc[nH+]c(NC[C@@H](C)Oc2ccc(OC)cc2)c1 ZINC001156079659 1047697885 /nfs/dbraw/zinc/69/78/85/1047697885.db2.gz BMGGTWLWUTVEPE-CYBMUJFWSA-N 1 2 318.442 4.082 20 0 DIADLO FC(F)(F)[C@H](Nc1cc2ccccc2c[nH+]1)c1cccnc1 ZINC001156157554 1047702677 /nfs/dbraw/zinc/70/26/77/1047702677.db2.gz YIXKXQRZEBWGQY-OAHLLOKOSA-N 1 2 303.287 4.345 20 0 DIADLO Cc1cccn2c(CN(C)Cc3ccc(F)cc3Cl)c[nH+]c12 ZINC000538733757 1047702896 /nfs/dbraw/zinc/70/28/96/1047702896.db2.gz VMRRHXWRUKFLGZ-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO CCCn1c(C[N@@H+]2CCc3ccsc3C2)nc2ccccc21 ZINC000538735600 1047703851 /nfs/dbraw/zinc/70/38/51/1047703851.db2.gz LXSYDHBHJTXSFD-UHFFFAOYSA-N 1 2 311.454 4.066 20 0 DIADLO CCCn1c(C[N@H+]2CCc3ccsc3C2)nc2ccccc21 ZINC000538735600 1047703854 /nfs/dbraw/zinc/70/38/54/1047703854.db2.gz LXSYDHBHJTXSFD-UHFFFAOYSA-N 1 2 311.454 4.066 20 0 DIADLO CCCCC/C(=C/c1ccccc1)C[N@@H+]1CCn2nc(C)nc2C1 ZINC000538736779 1047704915 /nfs/dbraw/zinc/70/49/15/1047704915.db2.gz COTKCCVCILLWJA-RGEXLXHISA-N 1 2 324.472 4.066 20 0 DIADLO CCCCC/C(=C/c1ccccc1)C[N@H+]1CCn2nc(C)nc2C1 ZINC000538736779 1047704918 /nfs/dbraw/zinc/70/49/18/1047704918.db2.gz COTKCCVCILLWJA-RGEXLXHISA-N 1 2 324.472 4.066 20 0 DIADLO COc1ccc2ccc(NCCSCc3ccco3)[nH+]c2c1 ZINC001156191460 1047705043 /nfs/dbraw/zinc/70/50/43/1047705043.db2.gz NVGPHIUIYBULII-UHFFFAOYSA-N 1 2 314.410 4.182 20 0 DIADLO COc1ccc(C(C)=O)c(Nc2ccc(C)[nH+]c2C)c1Cl ZINC001203376857 1047709200 /nfs/dbraw/zinc/70/92/00/1047709200.db2.gz VAUDZZLRVYYJDR-UHFFFAOYSA-N 1 2 304.777 4.307 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)cc1 ZINC000538752831 1047709333 /nfs/dbraw/zinc/70/93/33/1047709333.db2.gz PBFXWOOLZOUQGB-GUYCJALGSA-N 1 2 319.495 4.432 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)cc1 ZINC000538752831 1047709339 /nfs/dbraw/zinc/70/93/39/1047709339.db2.gz PBFXWOOLZOUQGB-GUYCJALGSA-N 1 2 319.495 4.432 20 0 DIADLO COc1ccc2c(c1)[nH+]c(N[C@@H](C)CCO)cc2-c1ccccc1 ZINC001156451580 1047713232 /nfs/dbraw/zinc/71/32/32/1047713232.db2.gz KJCKCIHRRCULQU-AWEZNQCLSA-N 1 2 322.408 4.093 20 0 DIADLO CN(Cc1ccc(-n2ccnc2)cc1)c1ccc(C(C)(C)C)c[nH+]1 ZINC001156788110 1047722623 /nfs/dbraw/zinc/72/26/23/1047722623.db2.gz IVOXZVHLASXAAH-UHFFFAOYSA-N 1 2 320.440 4.201 20 0 DIADLO CN(Cc1ccc(-n2cc[nH+]c2)cc1)c1cc2ccsc2cn1 ZINC001156783177 1047722672 /nfs/dbraw/zinc/72/26/72/1047722672.db2.gz FRGHNEVGELBLEP-UHFFFAOYSA-N 1 2 320.421 4.118 20 0 DIADLO COc1ccc2ccc(NCc3ccc4oc(C)nc4c3)[nH+]c2c1 ZINC001156935326 1047728614 /nfs/dbraw/zinc/72/86/14/1047728614.db2.gz BNMCGYRBEUEPDG-UHFFFAOYSA-N 1 2 319.364 4.305 20 0 DIADLO COc1ccc(C)[nH+]c1N1CCC[C@@H]1c1c(F)cccc1F ZINC001156939143 1047729274 /nfs/dbraw/zinc/72/92/74/1047729274.db2.gz IJTVMBYHQWUXMZ-CQSZACIVSA-N 1 2 304.340 4.018 20 0 DIADLO CCOC(=O)c1ccc2c(cccc2Nc2ccc(C)[nH+]c2C)n1 ZINC001203379380 1047734813 /nfs/dbraw/zinc/73/48/13/1047734813.db2.gz AZBKWEOGEWCKLB-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H]2C[C@H]2c2ccc(F)c(F)c2)c1 ZINC001157301313 1047739461 /nfs/dbraw/zinc/73/94/61/1047739461.db2.gz DTTCUGIYVHIFNQ-SWLSCSKDSA-N 1 2 306.381 4.440 20 0 DIADLO CSc1cc(Nc2cc(F)nc(C(F)(F)F)c2)cc[nH+]1 ZINC001213008038 1047742390 /nfs/dbraw/zinc/74/23/90/1047742390.db2.gz PULDYJJDIHKKPF-UHFFFAOYSA-N 1 2 303.284 4.100 20 0 DIADLO Cc1nc(-c2ccc([C@@H](C)[NH2+]Cc3nccc(C)n3)cc2)cs1 ZINC000539279455 1047745010 /nfs/dbraw/zinc/74/50/10/1047745010.db2.gz DKICYTULSMABBI-CYBMUJFWSA-N 1 2 324.453 4.068 20 0 DIADLO Fc1cc(Nc2ccc(-n3cc[nH+]c3)cc2)cc(C(F)(F)F)n1 ZINC001213009183 1047745421 /nfs/dbraw/zinc/74/54/21/1047745421.db2.gz YJDUCMNGJDBBTL-UHFFFAOYSA-N 1 2 322.265 4.169 20 0 DIADLO CCC1(CNc2cc(SCc3ccccc3)cc[nH+]2)COC1 ZINC001157547393 1047745881 /nfs/dbraw/zinc/74/58/81/1047745881.db2.gz HUCDNQPYIWXTAJ-UHFFFAOYSA-N 1 2 314.454 4.212 20 0 DIADLO Cc1cccc(C2(Nc3cc(C)c4ccccc4[nH+]3)COC2)c1 ZINC001157677241 1047748493 /nfs/dbraw/zinc/74/84/93/1047748493.db2.gz SWAUYQYIPCDJNV-UHFFFAOYSA-N 1 2 304.393 4.189 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+][C@@H](C)c1cn(C(C)C)nn1 ZINC000924692737 1047749213 /nfs/dbraw/zinc/74/92/13/1047749213.db2.gz RJFUHIPFKLDDAI-GJZGRUSLSA-N 1 2 316.449 4.058 20 0 DIADLO Cc1cc(N[C@@H](c2ccccn2)C(F)(F)F)nc(C(C)(C)C)[nH+]1 ZINC001157686321 1047749768 /nfs/dbraw/zinc/74/97/68/1047749768.db2.gz LBWFTEWWFIZQLU-ZDUSSCGKSA-N 1 2 324.350 4.193 20 0 DIADLO Cc1cc(N[C@H](c2ccccn2)C(F)(F)F)nc(C(C)(C)C)[nH+]1 ZINC001157686284 1047750097 /nfs/dbraw/zinc/75/00/97/1047750097.db2.gz LBWFTEWWFIZQLU-CYBMUJFWSA-N 1 2 324.350 4.193 20 0 DIADLO Cc1nc(NCc2ccc(F)c(Cl)c2F)cc(C(C)C)[nH+]1 ZINC001157710142 1047750545 /nfs/dbraw/zinc/75/05/45/1047750545.db2.gz YXEYPMUFSKWBRS-UHFFFAOYSA-N 1 2 311.763 4.452 20 0 DIADLO Cc1c(CNc2cc(N)cc(Cl)[nH+]2)cccc1C(F)(F)F ZINC001157732901 1047751609 /nfs/dbraw/zinc/75/16/09/1047751609.db2.gz LNPLCKQTGBSTJM-UHFFFAOYSA-N 1 2 315.726 4.257 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)N(C)c1[nH+]ccc2[nH]ccc21 ZINC001157744884 1047752585 /nfs/dbraw/zinc/75/25/85/1047752585.db2.gz HDZHRAJFNNKKNI-QGZVFWFLSA-N 1 2 307.397 4.051 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)N(C)c1[nH+]ccc2c1ccn2C ZINC001157756468 1047752944 /nfs/dbraw/zinc/75/29/44/1047752944.db2.gz KVEOYDCKZOBBEK-GOSISDBHSA-N 1 2 321.424 4.061 20 0 DIADLO C=Cc1ccc(CNc2[nH+]ccc3ccc(C(=O)OC)cc32)cc1 ZINC001157771351 1047753699 /nfs/dbraw/zinc/75/36/99/1047753699.db2.gz NRNBWCODUMWWJK-UHFFFAOYSA-N 1 2 318.376 4.277 20 0 DIADLO Cc1cc(Cl)c(C)c(N2CCC3(CCOC3(C)C)CC2)[nH+]1 ZINC001157804478 1047755902 /nfs/dbraw/zinc/75/59/02/1047755902.db2.gz JNNATZAXNRXTRZ-UHFFFAOYSA-N 1 2 308.853 4.137 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H](C)CCCC(C)(C)O)c(C)cc2c1 ZINC001157886369 1047761665 /nfs/dbraw/zinc/76/16/65/1047761665.db2.gz HQAZRBCRRVLRSX-AWEZNQCLSA-N 1 2 316.445 4.293 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)Cc1c(C)cccc1C ZINC000477974321 1047762376 /nfs/dbraw/zinc/76/23/76/1047762376.db2.gz CDYHEMJOWLVIMI-UHFFFAOYSA-N 1 2 319.408 4.183 20 0 DIADLO COC(OC)c1cc(C)c[nH+]c1NC(C)(C)c1ccc(C)cc1 ZINC001157980128 1047766102 /nfs/dbraw/zinc/76/61/02/1047766102.db2.gz XROIXYQUIRPUIZ-UHFFFAOYSA-N 1 2 314.429 4.337 20 0 DIADLO C[C@H]1C[C@@H](Nc2cc(N3CCCCC3)nc[nH+]2)c2ccccc21 ZINC001158474915 1047784150 /nfs/dbraw/zinc/78/41/50/1047784150.db2.gz WEQFUHADPYGAOR-WMLDXEAASA-N 1 2 308.429 4.127 20 0 DIADLO C[C@H]1C[C@@H](Nc2cc(N3CCCCC3)[nH+]cn2)c2ccccc21 ZINC001158474915 1047784155 /nfs/dbraw/zinc/78/41/55/1047784155.db2.gz WEQFUHADPYGAOR-WMLDXEAASA-N 1 2 308.429 4.127 20 0 DIADLO O[C@H]1c2ccccc2CC[C@@H]1Nc1[nH+]ccc2cc(Cl)ccc21 ZINC001158686858 1047794180 /nfs/dbraw/zinc/79/41/80/1047794180.db2.gz YXRDTRDFCSZPDA-ROUUACIJSA-N 1 2 324.811 4.349 20 0 DIADLO Cc1c(F)cc[nH+]c1N1CCC2(CC1)O[C@@H](C)c1ccccc12 ZINC001158749801 1047796861 /nfs/dbraw/zinc/79/68/61/1047796861.db2.gz LBCYQDMCGWCOEV-AWEZNQCLSA-N 1 2 312.388 4.116 20 0 DIADLO Cc1cc(Cl)c(C)c(N2CCc3cc(F)c(F)cc3C2)[nH+]1 ZINC001158808759 1047799256 /nfs/dbraw/zinc/79/92/56/1047799256.db2.gz HUWAUOQXPLOLDN-UHFFFAOYSA-N 1 2 308.759 4.193 20 0 DIADLO COc1c[nH+]c(NCc2ccc(-c3ccccn3)cc2)c(C)c1 ZINC001158910229 1047803688 /nfs/dbraw/zinc/80/36/88/1047803688.db2.gz RIEBQUCUUYQTQL-UHFFFAOYSA-N 1 2 305.381 4.073 20 0 DIADLO Cc1nc(N2Cc3nc(-c4ccccc4)sc3C2)c(C)c(C)[nH+]1 ZINC001158985296 1047806513 /nfs/dbraw/zinc/80/65/13/1047806513.db2.gz YGCGNNHDLWFWMP-UHFFFAOYSA-N 1 2 322.437 4.046 20 0 DIADLO Nc1cc(Cl)[nH+]c(NC/C(=C/F)CCc2ccc(F)cc2)c1 ZINC001159049880 1047809482 /nfs/dbraw/zinc/80/94/82/1047809482.db2.gz XJWSTMWOQXMOOV-FMIVXFBMSA-N 1 2 323.774 4.354 20 0 DIADLO Nc1[nH+]c(NCc2nc(-c3ccccc3)cs2)ccc1Cl ZINC001159213846 1047821063 /nfs/dbraw/zinc/82/10/63/1047821063.db2.gz PYJXRQATNLXNPG-UHFFFAOYSA-N 1 2 316.817 4.053 20 0 DIADLO CC1(C)[C@H](Nc2cc[nH+]c3c(Cl)cccc23)[C@@H]2CCO[C@H]21 ZINC000553076050 1047821263 /nfs/dbraw/zinc/82/12/63/1047821263.db2.gz BQOYTFBATUNCLD-IUIKQTSFSA-N 1 2 302.805 4.114 20 0 DIADLO C[C@H](Nc1cc(N2CCCC2)nc[nH+]1)c1c(F)cccc1Cl ZINC000553150756 1047827282 /nfs/dbraw/zinc/82/72/82/1047827282.db2.gz CVWYLKGOXBUEJH-NSHDSACASA-N 1 2 320.799 4.042 20 0 DIADLO C[C@H](Nc1cc(N2CCCC2)[nH+]cn1)c1c(F)cccc1Cl ZINC000553150756 1047827286 /nfs/dbraw/zinc/82/72/86/1047827286.db2.gz CVWYLKGOXBUEJH-NSHDSACASA-N 1 2 320.799 4.042 20 0 DIADLO Fc1ccc2oc(Nc3cc([C@H]4CCCC[NH2+]4)no3)cc2c1 ZINC001159312629 1047829765 /nfs/dbraw/zinc/82/97/65/1047829765.db2.gz DAPGQMAXZZJGOO-GFCCVEGCSA-N 1 2 301.321 4.118 20 0 DIADLO Nc1ccc2cc(Nc3[nH+]cccc3N3CCCC3)ccc2c1 ZINC001159365716 1047836631 /nfs/dbraw/zinc/83/66/31/1047836631.db2.gz LZAGBCDHKJRMJE-UHFFFAOYSA-N 1 2 304.397 4.161 20 0 DIADLO Clc1cccc2c(NCc3cnn4ccccc34)cc[nH+]c12 ZINC000553336516 1047839615 /nfs/dbraw/zinc/83/96/15/1047839615.db2.gz WIRNPXOGKHPUSJ-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2ccc(F)cc2N)c[nH+]1 ZINC001159442081 1047844863 /nfs/dbraw/zinc/84/48/63/1047844863.db2.gz ANYYPRFMRVMJRW-UHFFFAOYSA-N 1 2 322.387 4.183 20 0 DIADLO CNc1ccc(Nc2ccc3c(c2)OC2(CCCCC2)O3)c[nH+]1 ZINC001159524005 1047861648 /nfs/dbraw/zinc/86/16/48/1047861648.db2.gz YWWAKHBQVLGYIO-UHFFFAOYSA-N 1 2 311.385 4.299 20 0 DIADLO Clc1cccc2c(N3CCC[C@@H]([C@H]4CCOC4)C3)cc[nH+]c12 ZINC000553494973 1047861774 /nfs/dbraw/zinc/86/17/74/1047861774.db2.gz QROXUXGYHJVIRI-KGLIPLIRSA-N 1 2 316.832 4.141 20 0 DIADLO COc1cccc(Nc2ccc(NCc3ccc(C)nc3)[nH+]c2)c1 ZINC001182909865 1047862587 /nfs/dbraw/zinc/86/25/87/1047862587.db2.gz KKBUXRSHBIQLNF-UHFFFAOYSA-N 1 2 320.396 4.149 20 0 DIADLO Cc1c(F)cc[nH+]c1N[C@@H](Cc1ccccc1)c1nccs1 ZINC001159571891 1047871123 /nfs/dbraw/zinc/87/11/23/1047871123.db2.gz RDFPTSWAKHNKKI-HNNXBMFYSA-N 1 2 313.401 4.382 20 0 DIADLO CN(c1ccc(Nc2cc(F)ccc2N)c[nH+]1)C1CCCCC1 ZINC001159590890 1047873875 /nfs/dbraw/zinc/87/38/75/1047873875.db2.gz YRSHIEGOUIBKRG-UHFFFAOYSA-N 1 2 314.408 4.315 20 0 DIADLO CCNC(=O)Nc1ccc(Nc2cccc(C3CCC3)[nH+]2)cc1 ZINC001174518736 1047880228 /nfs/dbraw/zinc/88/02/28/1047880228.db2.gz QMNVKVWHBDHKTG-UHFFFAOYSA-N 1 2 310.401 4.234 20 0 DIADLO CCOC(=O)C[C@H]1CC[C@H](Nc2[nH+]c(C)cc(Cl)c2C)CC1 ZINC001159605637 1047881776 /nfs/dbraw/zinc/88/17/76/1047881776.db2.gz LNCKKYGPEKZFPR-HDJSIYSDSA-N 1 2 324.852 4.276 20 0 DIADLO FC(F)(F)c1cncc(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174523660 1047884002 /nfs/dbraw/zinc/88/40/02/1047884002.db2.gz UTOZIDNYIFHADR-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO COc1c(F)ccc(Nc2ccc(N3CCCCC3)[nH+]c2)c1F ZINC001174523236 1047884328 /nfs/dbraw/zinc/88/43/28/1047884328.db2.gz HELQJJAGEGMEKM-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO c1cnc2c(c1)cccc2Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174522820 1047884845 /nfs/dbraw/zinc/88/48/45/1047884845.db2.gz XWLWJSLAWCNKFG-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO Cc1ccnc(Cl)c1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523249 1047885516 /nfs/dbraw/zinc/88/55/16/1047885516.db2.gz KFWAZHKIZAURDK-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO Fc1cc(F)c(Nc2ccc(N3CCCCC3)[nH+]c2)c(F)c1 ZINC001174524234 1047887340 /nfs/dbraw/zinc/88/73/40/1047887340.db2.gz JJQBUBTXWVSJHE-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO Cc1nc2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc2o1 ZINC001174524190 1047888531 /nfs/dbraw/zinc/88/85/31/1047888531.db2.gz HWIHSQTYGDXGGG-UHFFFAOYSA-N 1 2 308.385 4.265 20 0 DIADLO COc1cc(F)c(Nc2ccc(N3CCCCC3)[nH+]c2)c(F)c1 ZINC001174524999 1047888748 /nfs/dbraw/zinc/88/87/48/1047888748.db2.gz WGMZJXFARWKKKP-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO COc1cc2ccc(N[C@@H](C)c3cccc(N)c3)[nH+]c2cc1OC ZINC001159638878 1047891380 /nfs/dbraw/zinc/89/13/80/1047891380.db2.gz ZHZKNFGFUMAFKP-LBPRGKRZSA-N 1 2 323.396 4.007 20 0 DIADLO C[C@H]1COCCN1c1ccc([NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)cc1Cl ZINC001183156297 1047903763 /nfs/dbraw/zinc/90/37/63/1047903763.db2.gz NNAQULYYSPWUGI-XQLPTFJDSA-N 1 2 320.864 4.023 20 0 DIADLO Cc1cn2c(cccc2NC(=S)Nc2ccc(C)cc2C)[nH+]1 ZINC001197959883 1047907937 /nfs/dbraw/zinc/90/79/37/1047907937.db2.gz SRIWMHIEYOOEIH-UHFFFAOYSA-N 1 2 310.426 4.068 20 0 DIADLO C[C@H]1COCC[C@@H]1Nc1cc(SCc2ccccc2)cc[nH+]1 ZINC001159719052 1047908640 /nfs/dbraw/zinc/90/86/40/1047908640.db2.gz OOKBXBHSJOIFDV-YOEHRIQHSA-N 1 2 314.454 4.211 20 0 DIADLO CCN(CC)c1cc(N[C@@H](c2ccccc2)C(F)(F)F)[nH+]cn1 ZINC001159773346 1047920088 /nfs/dbraw/zinc/92/00/88/1047920088.db2.gz UVGARHIADOZOKW-HNNXBMFYSA-N 1 2 324.350 4.038 20 0 DIADLO CCN(CC)c1cc(N[C@@H](c2ccccc2)C(F)(F)F)nc[nH+]1 ZINC001159773346 1047920102 /nfs/dbraw/zinc/92/01/02/1047920102.db2.gz UVGARHIADOZOKW-HNNXBMFYSA-N 1 2 324.350 4.038 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1cnn([C@@H]2CCCCO2)c1 ZINC001174601471 1047922179 /nfs/dbraw/zinc/92/21/79/1047922179.db2.gz BDPZNEFPBDYMII-HNNXBMFYSA-N 1 2 300.406 4.153 20 0 DIADLO CCCCC[C@@H](CC)C(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000775816056 1047923882 /nfs/dbraw/zinc/92/38/82/1047923882.db2.gz MJQBVVBLLGHGCN-MRXNPFEDSA-N 1 2 313.445 4.095 20 0 DIADLO CN(c1ccc(OCc2ccccc2)cc1)c1[nH+]cccc1N ZINC001174687713 1047933620 /nfs/dbraw/zinc/93/36/20/1047933620.db2.gz FETNUWLHAPWCSL-UHFFFAOYSA-N 1 2 305.381 4.011 20 0 DIADLO Oc1ccc2c(c1)C[C@H](Nc1cc(-c3ccccc3)cc[nH+]1)CC2 ZINC001159890792 1047942312 /nfs/dbraw/zinc/94/23/12/1047942312.db2.gz HRYJRXOPYOGDAF-LJQANCHMSA-N 1 2 316.404 4.424 20 0 DIADLO Oc1ccc2c(c1)C[C@@H](Nc1cc(-c3ccccc3)cc[nH+]1)CC2 ZINC001159890791 1047942388 /nfs/dbraw/zinc/94/23/88/1047942388.db2.gz HRYJRXOPYOGDAF-IBGZPJMESA-N 1 2 316.404 4.424 20 0 DIADLO Cc1cccc(C)c1NC(=S)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001198325214 1047945656 /nfs/dbraw/zinc/94/56/56/1047945656.db2.gz AXTUZUOZNVVUMI-UHFFFAOYSA-N 1 2 322.437 4.298 20 0 DIADLO Oc1ccc(C[NH+]2CCC(c3cccc(F)c3)CC2)c(F)c1F ZINC001183652865 1047951024 /nfs/dbraw/zinc/95/10/24/1047951024.db2.gz WVHOKRGOOBEXIE-UHFFFAOYSA-N 1 2 321.342 4.189 20 0 DIADLO c1cc(N2CCCCC2)[nH+]cc1Nc1ccc2c(c1)CCCO2 ZINC001174719143 1047951606 /nfs/dbraw/zinc/95/16/06/1047951606.db2.gz IYBHGCLFUYQRGN-UHFFFAOYSA-N 1 2 309.413 4.141 20 0 DIADLO COC(=O)c1cccc([C@@H](C)Nc2ccc(C(C)(C)C)c[nH+]2)c1 ZINC001159960676 1047958256 /nfs/dbraw/zinc/95/82/56/1047958256.db2.gz ZEZJVVDAFHWYCZ-CYBMUJFWSA-N 1 2 312.413 4.339 20 0 DIADLO COc1c(C)c[nH+]c(CN(c2cccc(F)c2)C(C)C)c1C ZINC001174735058 1047958304 /nfs/dbraw/zinc/95/83/04/1047958304.db2.gz KFNAQQMKMGNTJL-UHFFFAOYSA-N 1 2 302.393 4.261 20 0 DIADLO FC(F)(F)c1cncc(Nc2cc[nH+]c3ccc(Cl)cc23)c1 ZINC001174739156 1047959337 /nfs/dbraw/zinc/95/93/37/1047959337.db2.gz CLXJAHQNEAQJTC-UHFFFAOYSA-N 1 2 323.705 4.468 20 0 DIADLO Cc1ccc(C)c(C2CC[NH+](Cc3cc(Cl)n(C)n3)CC2)c1 ZINC001198467188 1047960714 /nfs/dbraw/zinc/96/07/14/1047960714.db2.gz JOGVHTJPGNQEME-UHFFFAOYSA-N 1 2 317.864 4.070 20 0 DIADLO COc1ccc(C(F)(F)F)cc1Nc1cccc2[nH+]ccn21 ZINC001174774409 1047967408 /nfs/dbraw/zinc/96/74/08/1047967408.db2.gz KWZCYBAYSDCTIT-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO COc1ccc(C(F)(F)F)cc1Nc1cccc2[nH+]c(C)cn21 ZINC001174774000 1047967556 /nfs/dbraw/zinc/96/75/56/1047967556.db2.gz GIAGUHZGOZKKTD-UHFFFAOYSA-N 1 2 321.302 4.414 20 0 DIADLO CC(C)C[C@@H](c1nc(-c2ccc3[nH]ccc3c2)no1)n1cc[nH+]c1 ZINC000923810346 1047968849 /nfs/dbraw/zinc/96/88/49/1047968849.db2.gz JYTXZXCMZOQGKP-INIZCTEOSA-N 1 2 321.384 4.050 20 0 DIADLO COC(=O)[C@H]([NH2+][C@@H](C)C1CCCC1)c1cccc2ccccc21 ZINC001183833467 1047970645 /nfs/dbraw/zinc/97/06/45/1047970645.db2.gz QIRHDCHLDJERNU-IFXJQAMLSA-N 1 2 311.425 4.222 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C/C=C\c3ccc(C)cc3)cc2[nH+]1 ZINC000479794861 1047971049 /nfs/dbraw/zinc/97/10/49/1047971049.db2.gz HKKNXNRKZSYZBI-ARJAWSKDSA-N 1 2 305.381 4.222 20 0 DIADLO Cc1cccc(C2=CC[N@H+](Cc3ncc(C4CC4)o3)CC2)c1C ZINC001198572960 1047974864 /nfs/dbraw/zinc/97/48/64/1047974864.db2.gz KKJUGSXRQWDNEW-UHFFFAOYSA-N 1 2 308.425 4.458 20 0 DIADLO Cc1cccc(C2=CC[N@@H+](Cc3ncc(C4CC4)o3)CC2)c1C ZINC001198572960 1047974878 /nfs/dbraw/zinc/97/48/78/1047974878.db2.gz KKJUGSXRQWDNEW-UHFFFAOYSA-N 1 2 308.425 4.458 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cccc(F)c2Cl)nc1 ZINC001198596149 1047980920 /nfs/dbraw/zinc/98/09/20/1047980920.db2.gz KIRSMSSPXAHFKO-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cccc(F)c2Cl)nc1 ZINC001198596149 1047980928 /nfs/dbraw/zinc/98/09/28/1047980928.db2.gz KIRSMSSPXAHFKO-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO c1ccc(-c2cc[nH+]c(N[C@H]3COCc4ccccc43)c2)cc1 ZINC001160115968 1047981780 /nfs/dbraw/zinc/98/17/80/1047981780.db2.gz FIHYHNLZQHCZQW-IBGZPJMESA-N 1 2 302.377 4.432 20 0 DIADLO COC[C@H]([NH2+]Cc1ccccc1F)c1cccc(Cl)c1F ZINC000554049602 1047994350 /nfs/dbraw/zinc/99/43/50/1047994350.db2.gz UKLPFBCGEDVXFU-HNNXBMFYSA-N 1 2 311.759 4.096 20 0 DIADLO c1cnc2c(c1)cccc2Nc1ccc[nH+]c1N1CCCCC1 ZINC001174856721 1048002364 /nfs/dbraw/zinc/00/23/64/1048002364.db2.gz OMHWKQWSKBXKSY-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO C[C@H]([NH2+][C@@H](CN(C)C)c1ccc(F)cc1)c1ccc(F)cc1F ZINC000554086570 1048004240 /nfs/dbraw/zinc/00/42/40/1048004240.db2.gz OAGNPFXTKVKKGQ-SGTLLEGYSA-N 1 2 322.374 4.057 20 0 DIADLO CC[C@H](N[C@H](C[NH+](C)C)c1ccc(F)cc1)c1ccc(C)cc1 ZINC000554086867 1048004655 /nfs/dbraw/zinc/00/46/55/1048004655.db2.gz RLJDZXNKWYFFCC-VQTJNVASSA-N 1 2 314.448 4.478 20 0 DIADLO Cc1cc(C)cc(C2CC[NH+](Cc3nn(C)cc3Cl)CC2)c1 ZINC001184189765 1048005083 /nfs/dbraw/zinc/00/50/83/1048005083.db2.gz ZYYYOSKWBUOTRV-UHFFFAOYSA-N 1 2 317.864 4.070 20 0 DIADLO Cc1ccc(Nc2cc[nH+]c(NC(=O)OC(C)(C)C)c2)cc1N ZINC001174930576 1048012589 /nfs/dbraw/zinc/01/25/89/1048012589.db2.gz RSMNQZFDFCXAEG-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO c1nn2c(c1C[NH+]1Cc3ccccc3-c3ccccc3C1)CCC2 ZINC000667586265 1048018404 /nfs/dbraw/zinc/01/84/04/1048018404.db2.gz LAEZQGALFRRGOT-UHFFFAOYSA-N 1 2 315.420 4.012 20 0 DIADLO COc1ccc2ccc(NCCOC3CCCCC3)[nH+]c2c1 ZINC001160278597 1048021228 /nfs/dbraw/zinc/02/12/28/1048021228.db2.gz VVZNVEFJNOZFKT-UHFFFAOYSA-N 1 2 300.402 4.005 20 0 DIADLO C[C@]1(c2ccc(F)cc2)C[N@H+](Cc2ccc(Cl)cc2)CCO1 ZINC001203923391 1048022417 /nfs/dbraw/zinc/02/24/17/1048022417.db2.gz NQLWOHYRJYATSV-GOSISDBHSA-N 1 2 319.807 4.227 20 0 DIADLO C[C@]1(c2ccc(F)cc2)C[N@@H+](Cc2ccc(Cl)cc2)CCO1 ZINC001203923391 1048022430 /nfs/dbraw/zinc/02/24/30/1048022430.db2.gz NQLWOHYRJYATSV-GOSISDBHSA-N 1 2 319.807 4.227 20 0 DIADLO Cc1cccc(Nc2ccc(N(C)Cc3ccccc3)[nH+]c2)c1N ZINC001160302779 1048027192 /nfs/dbraw/zinc/02/71/92/1048027192.db2.gz KKDXWRVAJTUQJP-UHFFFAOYSA-N 1 2 318.424 4.352 20 0 DIADLO Cc1c(N)cccc1Nc1ccc(N(C)C2CCCCC2)[nH+]c1 ZINC001160310407 1048027648 /nfs/dbraw/zinc/02/76/48/1048027648.db2.gz QUHYVSQKJWQEEN-UHFFFAOYSA-N 1 2 310.445 4.485 20 0 DIADLO COc1cc(F)c(Nc2ccc(N3CCCCC3)[nH+]c2)cc1F ZINC001174923556 1048031881 /nfs/dbraw/zinc/03/18/81/1048031881.db2.gz LJBXZCVQGPRDRV-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO Cc1ccc(Nc2ccc(N(C)C3CCCCC3)[nH+]c2)c(N)c1 ZINC001160338191 1048035965 /nfs/dbraw/zinc/03/59/65/1048035965.db2.gz GPXZPBZWUGTTBW-UHFFFAOYSA-N 1 2 310.445 4.485 20 0 DIADLO Cc1cc(Nc2ccc(O[C@H]3CC[NH2+]CC3(F)F)cc2)c(C)o1 ZINC001160350410 1048039329 /nfs/dbraw/zinc/03/93/29/1048039329.db2.gz LPNBQGFUWJKECF-INIZCTEOSA-N 1 2 322.355 4.016 20 0 DIADLO Cc1c(C)c(C)c(CC(=O)Nc2ccn3cc[nH+]c3c2)c(C)c1C ZINC001184421684 1048039411 /nfs/dbraw/zinc/03/94/11/1048039411.db2.gz LFJFKWXVCOSCFP-UHFFFAOYSA-N 1 2 321.424 4.058 20 0 DIADLO c1cn(Cc2ccccc2)nc1CNc1cc2ccccc2c[nH+]1 ZINC001160384227 1048043562 /nfs/dbraw/zinc/04/35/62/1048043562.db2.gz APCKEMZGMPXVOK-UHFFFAOYSA-N 1 2 314.392 4.092 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1c(C2CCC2)cnn1C ZINC001184462249 1048043969 /nfs/dbraw/zinc/04/39/69/1048043969.db2.gz ITZDEVWEUOMJEF-UHFFFAOYSA-N 1 2 323.444 4.230 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc4occc(=O)c4c3)ccc12 ZINC001174946974 1048045152 /nfs/dbraw/zinc/04/51/52/1048045152.db2.gz SKCYQYXYRSCUEP-UHFFFAOYSA-N 1 2 302.333 4.393 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccc(F)c(F)c2F)s1 ZINC000667615029 1048047934 /nfs/dbraw/zinc/04/79/34/1048047934.db2.gz DZLAJJRTRIQOFQ-VIFPVBQESA-N 1 2 314.376 4.370 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccc(F)c(F)c2F)s1 ZINC000667615029 1048047946 /nfs/dbraw/zinc/04/79/46/1048047946.db2.gz DZLAJJRTRIQOFQ-VIFPVBQESA-N 1 2 314.376 4.370 20 0 DIADLO Fc1cc(Nc2ccc[nH+]c2N2CCCCC2)cc(F)c1F ZINC001174955998 1048048195 /nfs/dbraw/zinc/04/81/95/1048048195.db2.gz VJWYDVWYSBOVEG-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO Cc1cccc2c(C)cc(N[C@](C)(CO)c3ccccc3)[nH+]c12 ZINC001160437143 1048050934 /nfs/dbraw/zinc/05/09/34/1048050934.db2.gz YKWTWNSCTPBDBB-HXUWFJFHSA-N 1 2 306.409 4.171 20 0 DIADLO C[C@@H](C[N@@H+]1CCn2c(C3CCCC3)nnc2[C@@H]1C)c1ccccc1 ZINC000554288549 1048056807 /nfs/dbraw/zinc/05/68/07/1048056807.db2.gz YFLBKJLXXVSENZ-HOTGVXAUSA-N 1 2 324.472 4.116 20 0 DIADLO C[C@@H](C[N@H+]1CCn2c(C3CCCC3)nnc2[C@@H]1C)c1ccccc1 ZINC000554288549 1048056819 /nfs/dbraw/zinc/05/68/19/1048056819.db2.gz YFLBKJLXXVSENZ-HOTGVXAUSA-N 1 2 324.472 4.116 20 0 DIADLO COc1c[nH+]c(N[C@H](c2ccccc2)c2ccc(O)cc2)c(C)c1 ZINC001160496704 1048059618 /nfs/dbraw/zinc/05/96/18/1048059618.db2.gz RSRGVVQTNJXYJZ-LJQANCHMSA-N 1 2 320.392 4.306 20 0 DIADLO Fc1ccc(F)c(Nc2ccc[nH+]c2N2CCCCC2)c1F ZINC001175026019 1048060986 /nfs/dbraw/zinc/06/09/86/1048060986.db2.gz QLVBIWIHYZIHSQ-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H](c2ccccc2)C2(O)CCC2)c1 ZINC001160543399 1048066230 /nfs/dbraw/zinc/06/62/30/1048066230.db2.gz KHZFLTSZBUKDLF-KRWDZBQOSA-N 1 2 314.454 4.262 20 0 DIADLO CCc1ccc(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)o1 ZINC001204389420 1048066291 /nfs/dbraw/zinc/06/62/91/1048066291.db2.gz OIOVFFHKFWYSPX-HXUWFJFHSA-N 1 2 306.409 4.249 20 0 DIADLO CCc1ccc(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)o1 ZINC001204389420 1048066306 /nfs/dbraw/zinc/06/63/06/1048066306.db2.gz OIOVFFHKFWYSPX-HXUWFJFHSA-N 1 2 306.409 4.249 20 0 DIADLO CCc1cc(NCCSCc2ccccc2F)nc(CC)[nH+]1 ZINC001184644406 1048070588 /nfs/dbraw/zinc/07/05/88/1048070588.db2.gz OPGPSPCGXPYPOX-UHFFFAOYSA-N 1 2 319.449 4.086 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3cc(C(C)C)[nH+]c(C)n3)cnc12 ZINC001160682215 1048076628 /nfs/dbraw/zinc/07/66/28/1048076628.db2.gz BQBSMCVDBVNJDB-ZDUSSCGKSA-N 1 2 309.417 4.038 20 0 DIADLO Cc1nc2ccccc2c(N[C@@H](C)c2c[nH+]c3c(C)cccn23)n1 ZINC001160684262 1048077004 /nfs/dbraw/zinc/07/70/04/1048077004.db2.gz ZLFRGPMXMYLTLC-ZDUSSCGKSA-N 1 2 317.396 4.067 20 0 DIADLO CCCCCN(C)c1ccc(F)cc1C[NH2+]Cc1nccs1 ZINC001199563731 1048077102 /nfs/dbraw/zinc/07/71/02/1048077102.db2.gz IGDVOVBMPOKACJ-UHFFFAOYSA-N 1 2 321.465 4.198 20 0 DIADLO c1ccc2c(c1)cncc2CNc1ccc(N2CCCCC2)c[nH+]1 ZINC001199554544 1048077145 /nfs/dbraw/zinc/07/71/45/1048077145.db2.gz QFFXIDKAFJZQJD-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3cc(C)c(Cl)cn3)c[nH+]c12 ZINC001160683763 1048077466 /nfs/dbraw/zinc/07/74/66/1048077466.db2.gz RVPYFRYNDBBLCG-LBPRGKRZSA-N 1 2 300.793 4.173 20 0 DIADLO Cc1cc2ccccc2cc1Nc1ccc(N2CCOCC2)[nH+]c1 ZINC001174979953 1048078509 /nfs/dbraw/zinc/07/85/09/1048078509.db2.gz KQXVZSYDLOOXRK-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3cc4ccccc4c[nH+]3)cnc12 ZINC001160683373 1048078671 /nfs/dbraw/zinc/07/86/71/1048078671.db2.gz NKZUFKLIQKCWIC-AWEZNQCLSA-N 1 2 302.381 4.364 20 0 DIADLO CSCc1ccc(N[C@@H](C)c2c[nH+]c3c(C)cccn23)nc1 ZINC001160688624 1048078955 /nfs/dbraw/zinc/07/89/55/1048078955.db2.gz RMXCYFBYAJNTGM-ZDUSSCGKSA-N 1 2 312.442 4.074 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](CCc3ccccc3Cl)CCO2)cc1 ZINC000480194942 1048082454 /nfs/dbraw/zinc/08/24/54/1048082454.db2.gz GLBAVHFEXHYJRO-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](CCc3ccccc3Cl)CCO2)cc1 ZINC000480194942 1048082470 /nfs/dbraw/zinc/08/24/70/1048082470.db2.gz GLBAVHFEXHYJRO-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO CCc1cc(NCc2ccc(C(F)(F)F)cc2)nc(CC)[nH+]1 ZINC001184681851 1048083021 /nfs/dbraw/zinc/08/30/21/1048083021.db2.gz VYSXXFZUEVQNBU-UHFFFAOYSA-N 1 2 309.335 4.232 20 0 DIADLO CCOc1cc(F)c(Nc2cccc3[nH+]c(C)cn32)cc1F ZINC001175058002 1048085335 /nfs/dbraw/zinc/08/53/35/1048085335.db2.gz WBDIGNOPRXPXEK-UHFFFAOYSA-N 1 2 303.312 4.063 20 0 DIADLO Cc1cc(NCCc2ccc3ccccc3c2)nc(C2CC2)[nH+]1 ZINC001184802859 1048090297 /nfs/dbraw/zinc/09/02/97/1048090297.db2.gz NRTCUTCKFLUPKX-UHFFFAOYSA-N 1 2 303.409 4.470 20 0 DIADLO CCOc1ccc(Nc2[nH+]cccc2N2CCCCC2)cc1F ZINC001175067612 1048092670 /nfs/dbraw/zinc/09/26/70/1048092670.db2.gz YIKHZOGJMAQKRB-UHFFFAOYSA-N 1 2 315.392 4.353 20 0 DIADLO Clc1cc(Nc2cccc3[nH+]c[nH]c32)c(Br)cn1 ZINC001213027034 1048093345 /nfs/dbraw/zinc/09/33/45/1048093345.db2.gz FTZQVWHPOQKKCS-UHFFFAOYSA-N 1 2 323.581 4.117 20 0 DIADLO Cc1cc(Nc2cccc3[nH+]c[nH]c32)n(-c2cccc(Cl)c2)n1 ZINC001213027265 1048095786 /nfs/dbraw/zinc/09/57/86/1048095786.db2.gz QSXLEDQKZLREAK-UHFFFAOYSA-N 1 2 323.787 4.454 20 0 DIADLO CCCOc1ccc(CNc2nc(C)[nH+]c3c2CCCC3)cc1 ZINC001184885551 1048097781 /nfs/dbraw/zinc/09/77/81/1048097781.db2.gz RDJPZAPULSFPPU-UHFFFAOYSA-N 1 2 311.429 4.065 20 0 DIADLO CC(=O)c1cc(Cl)nc(Cl)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213027993 1048099186 /nfs/dbraw/zinc/09/91/86/1048099186.db2.gz DKNRZTMYTWNUCZ-UHFFFAOYSA-N 1 2 321.167 4.211 20 0 DIADLO CCCC[C@H](NC(=O)Nc1ccc2[nH+]c(C)cn2c1)C1CCC1 ZINC001199768002 1048100545 /nfs/dbraw/zinc/10/05/45/1048100545.db2.gz PVKSIDZJMSEUMI-INIZCTEOSA-N 1 2 314.433 4.123 20 0 DIADLO c1[nH]c2c(cccc2Nc2ccc(Oc3ccccc3)nc2)[nH+]1 ZINC001213028126 1048101403 /nfs/dbraw/zinc/10/14/03/1048101403.db2.gz IIGIUAXLPXNNDW-UHFFFAOYSA-N 1 2 302.337 4.494 20 0 DIADLO CCc1cc(N(C)[C@H](C)c2cc(F)ccc2F)nc(CC)[nH+]1 ZINC001184916229 1048104085 /nfs/dbraw/zinc/10/40/85/1048104085.db2.gz LBUKZONIIJGBQA-LLVKDONJSA-N 1 2 305.372 4.077 20 0 DIADLO Cc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1OC(F)F ZINC001184964588 1048106104 /nfs/dbraw/zinc/10/61/04/1048106104.db2.gz PKFNYDVCFWUMHS-UHFFFAOYSA-N 1 2 319.355 4.335 20 0 DIADLO COc1ccc(F)c(Nc2ccc[nH+]c2N2CCCC2)c1Cl ZINC001184967392 1048107121 /nfs/dbraw/zinc/10/71/21/1048107121.db2.gz BLNOMTACMMALEM-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO O=C1CCCCc2cc(Nc3ccc[nH+]c3N3CCCC3)ccc21 ZINC001184965191 1048107375 /nfs/dbraw/zinc/10/73/75/1048107375.db2.gz TYLQKZVKCVRSDY-UHFFFAOYSA-N 1 2 321.424 4.335 20 0 DIADLO Fc1ccc(Cl)c(F)c1Nc1ccc[nH+]c1N1CCCC1 ZINC001184968578 1048107600 /nfs/dbraw/zinc/10/76/00/1048107600.db2.gz QHWRZIGFRHZQPO-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO Oc1c(Cl)c(Cl)ccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001184965189 1048108108 /nfs/dbraw/zinc/10/81/08/1048108108.db2.gz SZMCITICMKEIIP-UHFFFAOYSA-N 1 2 324.211 4.438 20 0 DIADLO Oc1ccc(C(F)(F)F)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001184967926 1048108139 /nfs/dbraw/zinc/10/81/39/1048108139.db2.gz GXTPCJHXOZLXHH-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO Fc1cc(F)c(Nc2ccc[nH+]c2N2CCCC2)c(Cl)c1 ZINC001184969177 1048108269 /nfs/dbraw/zinc/10/82/69/1048108269.db2.gz WVRXOWLCPRVCPY-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO CCOc1cc(Nc2cc(Cl)c3[nH+]ccn3c2)ccc1F ZINC001175049557 1048110472 /nfs/dbraw/zinc/11/04/72/1048110472.db2.gz DRHXLOFVECUBNR-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO Cc1cc(N2CCC[C@@H](C(F)(F)F)[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000480291204 1048111167 /nfs/dbraw/zinc/11/11/67/1048111167.db2.gz LQEHTGLGVBXBDT-NWDGAFQWSA-N 1 2 301.356 4.076 20 0 DIADLO COc1ccc(Br)c(Nc2cccc3[nH+]c[nH]c32)c1 ZINC001213030759 1048112350 /nfs/dbraw/zinc/11/23/50/1048112350.db2.gz PUNLWKBZZQRMOR-UHFFFAOYSA-N 1 2 318.174 4.078 20 0 DIADLO Cc1cnn(-c2cccc(Cl)c2)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213030924 1048114800 /nfs/dbraw/zinc/11/48/00/1048114800.db2.gz XROKVAQOPROFTO-UHFFFAOYSA-N 1 2 323.787 4.454 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@@H+]2Cc2ccc(Cl)cn2)cc1 ZINC000554496300 1048114979 /nfs/dbraw/zinc/11/49/79/1048114979.db2.gz QHYJUAIAJVHSKW-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@H+]2Cc2ccc(Cl)cn2)cc1 ZINC000554496300 1048114988 /nfs/dbraw/zinc/11/49/88/1048114988.db2.gz QHYJUAIAJVHSKW-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)cc3c2OCC3)cs1 ZINC000927142754 1048121606 /nfs/dbraw/zinc/12/16/06/1048121606.db2.gz XAAYMYVHCQRQTD-VHSXEESVSA-N 1 2 322.861 4.452 20 0 DIADLO CCOC(=O)c1ccc(Nc2cccc3[nH+]c[nH]c32)cc1Cl ZINC001213031956 1048123611 /nfs/dbraw/zinc/12/36/11/1048123611.db2.gz RVNDUWZVRDTJNQ-UHFFFAOYSA-N 1 2 315.760 4.137 20 0 DIADLO Fc1cc(OC(F)(F)F)ccc1Nc1cccc2[nH+]c[nH]c21 ZINC001213032339 1048126705 /nfs/dbraw/zinc/12/67/05/1048126705.db2.gz AIRUVEWRVMVPJL-UHFFFAOYSA-N 1 2 311.238 4.344 20 0 DIADLO COc1ccc2[nH+]c(NC[C@@H]3CCOC(C)(C)C3)c(C)cc2c1 ZINC001161422772 1048128849 /nfs/dbraw/zinc/12/88/49/1048128849.db2.gz BVVBTQQJNYIZIB-CQSZACIVSA-N 1 2 314.429 4.169 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(F)c(C(F)(F)F)c1 ZINC001175075320 1048129149 /nfs/dbraw/zinc/12/91/49/1048129149.db2.gz TZRGKTIXQKRPNN-UHFFFAOYSA-N 1 2 309.266 4.074 20 0 DIADLO COc1ccc(OC(F)(F)F)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213032817 1048131158 /nfs/dbraw/zinc/13/11/58/1048131158.db2.gz ZFMAXUHOBUBUHN-UHFFFAOYSA-N 1 2 323.274 4.214 20 0 DIADLO Fc1cccc(Nc2cccc3[nH+]c[nH]c32)c1Br ZINC001213032828 1048131220 /nfs/dbraw/zinc/13/12/20/1048131220.db2.gz ZOSNLDPWLZQRQX-UHFFFAOYSA-N 1 2 306.138 4.208 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(F)c(Cl)c2)nc2ccccc12 ZINC001199990018 1048132811 /nfs/dbraw/zinc/13/28/11/1048132811.db2.gz HFMNTYKZESWGIL-UHFFFAOYSA-N 1 2 315.779 4.021 20 0 DIADLO Fc1ccc(Nc2cccc3[nH+]c[nH]c32)c(F)c1Br ZINC001213033445 1048137455 /nfs/dbraw/zinc/13/74/55/1048137455.db2.gz GQSKWVDERQSNAU-UHFFFAOYSA-N 1 2 324.128 4.347 20 0 DIADLO CC(C)n1cncc1CNc1[nH+]ccc2cc(Cl)ccc21 ZINC001161562785 1048139150 /nfs/dbraw/zinc/13/91/50/1048139150.db2.gz FTVDAVSEUCIVJT-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO CC[C@H](C)c1nc(Cl)c(C)c(NCc2c[nH+]cn2C(C)C)n1 ZINC001161569159 1048140239 /nfs/dbraw/zinc/14/02/39/1048140239.db2.gz DAKUASQTORSSAZ-NSHDSACASA-N 1 2 321.856 4.341 20 0 DIADLO C[C@H](CCc1ccccc1)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001161612901 1048143790 /nfs/dbraw/zinc/14/37/90/1048143790.db2.gz NCEXUYRMBYIMRO-QGZVFWFLSA-N 1 2 305.425 4.365 20 0 DIADLO CCOc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)c(F)c1F ZINC001175152320 1048144594 /nfs/dbraw/zinc/14/45/94/1048144594.db2.gz ONLNVOGGAUZPPU-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO CCOc1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)c(F)c1F ZINC001175152107 1048144654 /nfs/dbraw/zinc/14/46/54/1048144654.db2.gz GVEIORINXRUABE-UHFFFAOYSA-N 1 2 323.730 4.408 20 0 DIADLO CCCC[C@@H]1CCC[C@H]1Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001185241241 1048151049 /nfs/dbraw/zinc/15/10/49/1048151049.db2.gz HHGJIDXHKOVRCT-UKRRQHHQSA-N 1 2 315.465 4.352 20 0 DIADLO Fc1ccc(Br)c(F)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213034301 1048151388 /nfs/dbraw/zinc/15/13/88/1048151388.db2.gz BXESKNUKZBZVTI-UHFFFAOYSA-N 1 2 324.128 4.347 20 0 DIADLO Cc1cccc(C(C)(C)CNc2cc(C)[nH+]c(C(C)(C)C)n2)n1 ZINC001161644187 1048151669 /nfs/dbraw/zinc/15/16/69/1048151669.db2.gz OXZGSZMHVIOQKU-UHFFFAOYSA-N 1 2 312.461 4.176 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@@H+]2Cc3ccccc3[C@H]2C)c(C)c1 ZINC000554678695 1048152772 /nfs/dbraw/zinc/15/27/72/1048152772.db2.gz LBXUNXKGQPMBKV-HZPDHXFCSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@H+]2Cc3ccccc3[C@H]2C)c(C)c1 ZINC000554678695 1048152777 /nfs/dbraw/zinc/15/27/77/1048152777.db2.gz LBXUNXKGQPMBKV-HZPDHXFCSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1c(Cl)nc2cccc(F)c2c1NCCCn1cc[nH+]c1 ZINC001161681822 1048152642 /nfs/dbraw/zinc/15/26/42/1048152642.db2.gz AKHLXHCFYJJLFY-UHFFFAOYSA-N 1 2 318.783 4.034 20 0 DIADLO CCC[C@@H](Nc1nc2ccccc2n2c[nH+]cc12)c1ccccn1 ZINC001185283004 1048157135 /nfs/dbraw/zinc/15/71/35/1048157135.db2.gz YFZAAIAKFNKXMU-OAHLLOKOSA-N 1 2 317.396 4.231 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CCO[C@@H](c4ccsc4)C3)[nH]c2c1 ZINC000667680504 1048157362 /nfs/dbraw/zinc/15/73/62/1048157362.db2.gz IQDVUHCWARLAOZ-GOSISDBHSA-N 1 2 312.438 4.111 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CCO[C@@H](c4ccsc4)C3)[nH]c2c1 ZINC000667680504 1048157371 /nfs/dbraw/zinc/15/73/71/1048157371.db2.gz IQDVUHCWARLAOZ-GOSISDBHSA-N 1 2 312.438 4.111 20 0 DIADLO Fc1cc(F)c(F)c(C[NH2+]Cc2cncc3ccccc32)c1F ZINC001200931870 1048159696 /nfs/dbraw/zinc/15/96/96/1048159696.db2.gz IOVLPKTUMCTUDB-UHFFFAOYSA-N 1 2 320.289 4.081 20 0 DIADLO CSc1ccc(C[NH2+]Cc2c(F)c(F)cc(F)c2F)cc1 ZINC001200933294 1048160347 /nfs/dbraw/zinc/16/03/47/1048160347.db2.gz WZWFIMVNRRWZSD-UHFFFAOYSA-N 1 2 315.335 4.255 20 0 DIADLO CCc1ccc(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)nc1 ZINC001175148904 1048169761 /nfs/dbraw/zinc/16/97/61/1048169761.db2.gz SZVDNVQXFYMJCB-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO CCc1ccc(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)nc1 ZINC001175148904 1048169767 /nfs/dbraw/zinc/16/97/67/1048169767.db2.gz SZVDNVQXFYMJCB-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO Cc1cc(N2C[C@H](c3ccccc3)C[C@H]2C)nc(C2CCC2)[nH+]1 ZINC001185367770 1048173960 /nfs/dbraw/zinc/17/39/60/1048173960.db2.gz ZHKIJPYUCVJZKA-CRAIPNDOSA-N 1 2 307.441 4.435 20 0 DIADLO Cc1cc(N[C@@H](c2cncc(F)c2)C2CC2)nc(C(C)C)[nH+]1 ZINC001161818810 1048176769 /nfs/dbraw/zinc/17/67/69/1048176769.db2.gz QJNAOILAYNZAMN-MRXNPFEDSA-N 1 2 300.381 4.006 20 0 DIADLO Cc1ccc(C)c(CC[NH2+]c2ccc(N3CCOCC3)c(C)c2)c1 ZINC001161831366 1048180463 /nfs/dbraw/zinc/18/04/63/1048180463.db2.gz CEJIPHNUALHJKT-UHFFFAOYSA-N 1 2 324.468 4.103 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@@H](c2ccnc(F)c2)C2CC2)[nH+]1 ZINC001161841116 1048182987 /nfs/dbraw/zinc/18/29/87/1048182987.db2.gz PPLRNXQRVWBXJG-OAHLLOKOSA-N 1 2 305.784 4.449 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(S[C@@H](C)c3ccccc3OC)c12 ZINC001185497737 1048188483 /nfs/dbraw/zinc/18/84/83/1048188483.db2.gz JHDNRTMUMDVEGQ-NSHDSACASA-N 1 2 313.426 4.382 20 0 DIADLO CCc1cc(NCc2cc(F)ccc2SC)nc(CC)[nH+]1 ZINC001185498087 1048188745 /nfs/dbraw/zinc/18/87/45/1048188745.db2.gz OYVYWCBDRNDHFX-UHFFFAOYSA-N 1 2 305.422 4.075 20 0 DIADLO Cc1nc(NC2(CC3CCC3)CCOCC2)cc(C(C)C)[nH+]1 ZINC001161919954 1048193334 /nfs/dbraw/zinc/19/33/34/1048193334.db2.gz GDQVIGMLNZYWTA-UHFFFAOYSA-N 1 2 303.450 4.060 20 0 DIADLO CN(C)c1nc(N[C@@H](c2ccccc2)C2CC2)[nH+]c2ccccc21 ZINC001161955369 1048197626 /nfs/dbraw/zinc/19/76/26/1048197626.db2.gz PZTOPJAWHBIMSL-SFHVURJKSA-N 1 2 318.424 4.259 20 0 DIADLO Cc1cccn2c(CNc3cc(Cl)cc4cccnc43)c[nH+]c12 ZINC001201141118 1048199531 /nfs/dbraw/zinc/19/95/31/1048199531.db2.gz WWCPKOPOULTKBO-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2nnc(C(C)(C)C)o2)cc1 ZINC000774902548 1048201595 /nfs/dbraw/zinc/20/15/95/1048201595.db2.gz VKJULSVCHFZZOY-ZDUSSCGKSA-N 1 2 317.433 4.005 20 0 DIADLO CCCc1cc(NCc2nc3ccccc3o2)nc(CCC)[nH+]1 ZINC001161967687 1048202426 /nfs/dbraw/zinc/20/24/26/1048202426.db2.gz LNPKOWAWSDTYNS-UHFFFAOYSA-N 1 2 310.401 4.135 20 0 DIADLO CC(=O)c1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)cc1F ZINC001175227681 1048204689 /nfs/dbraw/zinc/20/46/89/1048204689.db2.gz ARQBZHONPRPCNN-UHFFFAOYSA-N 1 2 303.724 4.073 20 0 DIADLO Clc1ncc(Nc2cccn3cc[nH+]c23)c(Cl)c1Cl ZINC001250197943 1048205019 /nfs/dbraw/zinc/20/50/19/1048205019.db2.gz OOSQDUKGHVCBMT-UHFFFAOYSA-N 1 2 313.575 4.433 20 0 DIADLO CSCc1ccc(NCCc2cccc(Cl)c2F)[nH+]c1 ZINC001161985523 1048208572 /nfs/dbraw/zinc/20/85/72/1048208572.db2.gz HKBBPFKKVQIIJC-UHFFFAOYSA-N 1 2 310.825 4.392 20 0 DIADLO COCCC1(CNc2[nH+]ccc(F)c2C)CCC(F)(F)CC1 ZINC001162008325 1048213808 /nfs/dbraw/zinc/21/38/08/1048213808.db2.gz YCCUGEZRDWMHMP-UHFFFAOYSA-N 1 2 316.367 4.173 20 0 DIADLO COC1(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)CCCCC1 ZINC001201202034 1048216595 /nfs/dbraw/zinc/21/65/95/1048216595.db2.gz OZECBZLKRLDQRO-UHFFFAOYSA-N 1 2 319.836 4.287 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)Nc1ccc2c(c1)CCC2 ZINC001185721609 1048217740 /nfs/dbraw/zinc/21/77/40/1048217740.db2.gz RXBLZKFJTOKIJZ-UHFFFAOYSA-N 1 2 318.380 4.005 20 0 DIADLO CCCC[C@H](CC)CNc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001162090369 1048223437 /nfs/dbraw/zinc/22/34/37/1048223437.db2.gz IFPQFRRJJGHSFP-ZDUSSCGKSA-N 1 2 303.454 4.210 20 0 DIADLO CC1(C)CC[C@@H](C[N@@H+]2CCc3[nH]c4ccc(Cl)cc4c3C2)O1 ZINC000480704966 1048223576 /nfs/dbraw/zinc/22/35/76/1048223576.db2.gz FBIFEYSFIDWAJD-ZDUSSCGKSA-N 1 2 318.848 4.137 20 0 DIADLO CC1(C)CC[C@@H](C[N@H+]2CCc3[nH]c4ccc(Cl)cc4c3C2)O1 ZINC000480704966 1048223586 /nfs/dbraw/zinc/22/35/86/1048223586.db2.gz FBIFEYSFIDWAJD-ZDUSSCGKSA-N 1 2 318.848 4.137 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccccc3OC(F)(F)F)n2c1 ZINC001201280798 1048226066 /nfs/dbraw/zinc/22/60/66/1048226066.db2.gz FSDAZJWABBKYBD-UHFFFAOYSA-N 1 2 321.302 4.153 20 0 DIADLO COc1cc[nH+]c(C(C)(C)CNc2ccc3cccc(C)c3n2)c1 ZINC001162127973 1048228492 /nfs/dbraw/zinc/22/84/92/1048228492.db2.gz DVEZYLDCLFBTMA-UHFFFAOYSA-N 1 2 321.424 4.337 20 0 DIADLO CC(C)(C)c1cc(Br)ccc1Nc1ccc(N)[nH+]c1 ZINC001201293238 1048231352 /nfs/dbraw/zinc/23/13/52/1048231352.db2.gz YSKDFHMBCKDKHH-UHFFFAOYSA-N 1 2 320.234 4.467 20 0 DIADLO CCOc1cc(F)ccc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001175286250 1048231526 /nfs/dbraw/zinc/23/15/26/1048231526.db2.gz HRJDYUXEIIHOJB-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO C[C@@H](C[NH2+]c1ccc(N2CCO[C@@H](C)C2)cc1)c1ccccc1 ZINC000774939411 1048232079 /nfs/dbraw/zinc/23/20/79/1048232079.db2.gz UUEWOWBEVFIUJP-IRXDYDNUSA-N 1 2 310.441 4.127 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(C3CCCC3)n2)CCC1(F)F ZINC000554945816 1048236259 /nfs/dbraw/zinc/23/62/59/1048236259.db2.gz KPFKZKQBJVMLRM-NSHDSACASA-N 1 2 300.418 4.278 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(C3CCCC3)n2)CCC1(F)F ZINC000554945816 1048236244 /nfs/dbraw/zinc/23/62/44/1048236244.db2.gz KPFKZKQBJVMLRM-NSHDSACASA-N 1 2 300.418 4.278 20 0 DIADLO CCc1cc(NCCOc2cccc3ccccc32)nc(CC)[nH+]1 ZINC001162205509 1048240890 /nfs/dbraw/zinc/24/08/90/1048240890.db2.gz HSYNVDPQKWSHIU-UHFFFAOYSA-N 1 2 321.424 4.246 20 0 DIADLO Cc1c(Nc2cc(Cl)c3[nH+]ccn3c2)cnn1-c1ccccc1 ZINC001201368048 1048240988 /nfs/dbraw/zinc/24/09/88/1048240988.db2.gz HNRIVAYNTPKUCA-UHFFFAOYSA-N 1 2 323.787 4.225 20 0 DIADLO ClC1(Cl)C[C@H]1CSc1nc2ccccc2n2c[nH+]cc12 ZINC001162211034 1048243090 /nfs/dbraw/zinc/24/30/90/1048243090.db2.gz OUYMTIZTJAAQOV-VIFPVBQESA-N 1 2 324.236 4.168 20 0 DIADLO COc1nsc(CNc2ccc([NH+]3CCCC3)cc2)c1Cl ZINC001201339388 1048243617 /nfs/dbraw/zinc/24/36/17/1048243617.db2.gz XZTGTXWBASYRPY-UHFFFAOYSA-N 1 2 323.849 4.017 20 0 DIADLO Cc1nc(N2CC=C(c3cccc4ccccc43)C2)c(C)c(C)[nH+]1 ZINC001185929718 1048244103 /nfs/dbraw/zinc/24/41/03/1048244103.db2.gz FNMQZAHJYKWUGQ-UHFFFAOYSA-N 1 2 315.420 4.459 20 0 DIADLO C[C@H](CCc1ccccc1)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001186012158 1048251301 /nfs/dbraw/zinc/25/13/01/1048251301.db2.gz AFNPHEWCKONFRM-MRXNPFEDSA-N 1 2 319.408 4.080 20 0 DIADLO c1ccc(-c2ccc(Nc3ccc(N4CCCC4)[nH+]c3)cn2)cc1 ZINC001175346485 1048252913 /nfs/dbraw/zinc/25/29/13/1048252913.db2.gz WEPOGCWTRLWDNH-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO C[S@](=O)c1ccccc1Nc1cc[nH+]c2cc(Cl)ccc12 ZINC001175303706 1048254655 /nfs/dbraw/zinc/25/46/55/1048254655.db2.gz FNEPSJGVFYVTIW-NRFANRHFSA-N 1 2 316.813 4.369 20 0 DIADLO Cc1cc([C@@H](C)Nc2nc3ccccc3n3c[nH+]cc23)c(C)o1 ZINC001162313870 1048261555 /nfs/dbraw/zinc/26/15/55/1048261555.db2.gz OADUAXSQNVTYFN-GFCCVEGCSA-N 1 2 306.369 4.265 20 0 DIADLO CCCOc1ccc(CNc2cc(C)[nH+]c(C3CC3)n2)c(C)c1 ZINC001186088497 1048263805 /nfs/dbraw/zinc/26/38/05/1048263805.db2.gz BQKMYHZDNYDKTL-UHFFFAOYSA-N 1 2 311.429 4.372 20 0 DIADLO Fc1c(Cl)ccc(Nc2ccc(N3CCCC3)[nH+]c2)c1F ZINC001175350944 1048271318 /nfs/dbraw/zinc/27/13/18/1048271318.db2.gz JWARKCQSVZRVLX-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO COc1cc(Nc2ccc(N3CCCC3)[nH+]c2)ccc1Cl ZINC001175351561 1048271608 /nfs/dbraw/zinc/27/16/08/1048271608.db2.gz JBPPQPVVBLYTQF-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO Oc1ccc(C(F)(F)F)cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175350819 1048272639 /nfs/dbraw/zinc/27/26/39/1048272639.db2.gz IEUSTYUPLVDGQW-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO COc1cc(Nc2ccc(N3CCCC3)[nH+]c2)ccc1SC ZINC001175351340 1048272740 /nfs/dbraw/zinc/27/27/40/1048272740.db2.gz QWSQBVOQQKCOHX-UHFFFAOYSA-N 1 2 315.442 4.156 20 0 DIADLO Brc1ccccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175351319 1048272843 /nfs/dbraw/zinc/27/28/43/1048272843.db2.gz QJHPVPLUVAAYAS-UHFFFAOYSA-N 1 2 318.218 4.188 20 0 DIADLO COc1nc(C(C)C)ccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001201437525 1048273035 /nfs/dbraw/zinc/27/30/35/1048273035.db2.gz GRGMLMXJMKSXGL-UHFFFAOYSA-N 1 2 322.412 4.202 20 0 DIADLO c1ncc(-c2ccccc2Nc2ccc(N3CCCC3)[nH+]c2)o1 ZINC001175352593 1048273792 /nfs/dbraw/zinc/27/37/92/1048273792.db2.gz XFYGNPXUVMPDJP-UHFFFAOYSA-N 1 2 306.369 4.080 20 0 DIADLO Nc1cc(Cl)cc(Cl)c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175352599 1048274559 /nfs/dbraw/zinc/27/45/59/1048274559.db2.gz XRWIKARCPGWAAP-UHFFFAOYSA-N 1 2 323.227 4.314 20 0 DIADLO CSc1cc[nH+]c(N[C@H]2CCOc3c(F)cc(F)cc32)c1 ZINC001162408054 1048275894 /nfs/dbraw/zinc/27/58/94/1048275894.db2.gz ZHYRXDCEQDVTPC-ZDUSSCGKSA-N 1 2 308.353 4.017 20 0 DIADLO Br/C(=C\c1ccccc1)C[NH+]1CC2(C1)CCCC2 ZINC001201450850 1048277919 /nfs/dbraw/zinc/27/79/19/1048277919.db2.gz LQZUQMVHELLWBC-GDNBJRDFSA-N 1 2 306.247 4.298 20 0 DIADLO C[C@H]1C[C@H]1c1csc(Cc2[nH+]ccn2Cc2ccccc2)n1 ZINC000899241174 1048278400 /nfs/dbraw/zinc/27/84/00/1048278400.db2.gz KGTKKICPZBSQDE-DZGCQCFKSA-N 1 2 309.438 4.102 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cc(=O)n(-c3ccccc3)[nH]2)cc1 ZINC001201489607 1048280522 /nfs/dbraw/zinc/28/05/22/1048280522.db2.gz UTIPVXDLSNUAMW-UHFFFAOYSA-N 1 2 308.385 4.142 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2ccc(Br)nc2)cc1 ZINC001201487444 1048280901 /nfs/dbraw/zinc/28/09/01/1048280901.db2.gz HZQWFHPPZDNDNI-UHFFFAOYSA-N 1 2 306.207 4.408 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cncc(Br)c2)cc1 ZINC001201487534 1048281257 /nfs/dbraw/zinc/28/12/57/1048281257.db2.gz KCYBVQODYHVJQM-UHFFFAOYSA-N 1 2 306.207 4.408 20 0 DIADLO CC(C)[C@@H]1CCC[C@H](Nc2[nH+]cnc3c2cnn3C(C)(C)C)C1 ZINC001162460531 1048282918 /nfs/dbraw/zinc/28/29/18/1048282918.db2.gz MIMNFPUNUFKWIU-KGLIPLIRSA-N 1 2 315.465 4.208 20 0 DIADLO Cc1cc(Nc2ccc([NH2+]C(C)C)cc2)n(C2CCOCC2)n1 ZINC001201492247 1048283082 /nfs/dbraw/zinc/28/30/82/1048283082.db2.gz YAQDEJPHZLSANC-UHFFFAOYSA-N 1 2 314.433 4.107 20 0 DIADLO CC(C)[C@H]1CCC[C@H](Nc2[nH+]cnc3c2cnn3C(C)(C)C)C1 ZINC001162460529 1048283251 /nfs/dbraw/zinc/28/32/51/1048283251.db2.gz MIMNFPUNUFKWIU-KBPBESRZSA-N 1 2 315.465 4.208 20 0 DIADLO C[C@@H]1CCC[C@@H](CNc2[nH+]cnc3c2cnn3C(C)(C)C)[C@@H]1C ZINC001186303544 1048283687 /nfs/dbraw/zinc/28/36/87/1048283687.db2.gz DPGRVXJVTJFBOH-MCIONIFRSA-N 1 2 315.465 4.066 20 0 DIADLO Cc1cn2c(cccc2Nc2c(F)c(F)c(F)c(F)c2F)[nH+]1 ZINC001175383277 1048289874 /nfs/dbraw/zinc/28/98/74/1048289874.db2.gz CZMDFRCRACMRIP-UHFFFAOYSA-N 1 2 313.229 4.082 20 0 DIADLO Cc1ccc(N=C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(F)n1 ZINC001201470853 1048293120 /nfs/dbraw/zinc/29/31/20/1048293120.db2.gz XFEPTPDWZKYSQU-MSOLQXFVSA-N 1 2 323.415 4.262 20 0 DIADLO Cc1ccc(N=C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c(F)n1 ZINC001201470853 1048293132 /nfs/dbraw/zinc/29/31/32/1048293132.db2.gz XFEPTPDWZKYSQU-MSOLQXFVSA-N 1 2 323.415 4.262 20 0 DIADLO COCc1cc[nH+]c(NCC2c3ccccc3-c3ccccc32)c1 ZINC001162555015 1048302178 /nfs/dbraw/zinc/30/21/78/1048302178.db2.gz CMWKIPZACNLURB-UHFFFAOYSA-N 1 2 316.404 4.452 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCCOc1cc(Cl)ccn1 ZINC001162622839 1048315713 /nfs/dbraw/zinc/31/57/13/1048315713.db2.gz VQDMFTUPLVTARS-UHFFFAOYSA-N 1 2 313.788 4.083 20 0 DIADLO CCc1cc(N2C[C@H](C)C[C@@H]2c2cccc(F)c2)nc(CC)[nH+]1 ZINC001162625829 1048315930 /nfs/dbraw/zinc/31/59/30/1048315930.db2.gz JNUBEIFALMDKKF-CXAGYDPISA-N 1 2 313.420 4.328 20 0 DIADLO Cc1cc(NC[C@H]2CCC(F)(F)C2)nc(-c2ccccc2)[nH+]1 ZINC001162642420 1048324841 /nfs/dbraw/zinc/32/48/41/1048324841.db2.gz NWXWHWWZEUWTJK-ZDUSSCGKSA-N 1 2 303.356 4.299 20 0 DIADLO FC1(F)CC[C@H](C[NH2+]c2cc3c4c(c2)CCCN4CCC3)C1 ZINC001162650077 1048328578 /nfs/dbraw/zinc/32/85/78/1048328578.db2.gz PSHRNPKXHJUPDM-ZDUSSCGKSA-N 1 2 306.400 4.233 20 0 DIADLO Cc1nc(N2CC[C@@](C)(CCc3ccccc3)C2)c(C)c(C)[nH+]1 ZINC001162691769 1048334783 /nfs/dbraw/zinc/33/47/83/1048334783.db2.gz BLDRUNXJFJSBRM-HXUWFJFHSA-N 1 2 309.457 4.251 20 0 DIADLO Cc1ccc(C)c(Nc2cncc(OCc3ccccc3)c2)[nH+]1 ZINC001201622017 1048335644 /nfs/dbraw/zinc/33/56/44/1048335644.db2.gz OXOUBQJMWYKFPI-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO CC(C)(C)OC(=O)c1cccc(Nc2cccc3[nH+]ccn32)c1 ZINC001175545317 1048336302 /nfs/dbraw/zinc/33/63/02/1048336302.db2.gz HTSVBSYKEVVLRN-UHFFFAOYSA-N 1 2 309.369 4.033 20 0 DIADLO Cc1cc(Cl)c(C)c(NCc2ccnc(C(F)(F)F)c2)[nH+]1 ZINC001162739112 1048345504 /nfs/dbraw/zinc/34/55/04/1048345504.db2.gz AXLYKGIPYAPBDT-UHFFFAOYSA-N 1 2 315.726 4.378 20 0 DIADLO CCc1cc(NCC2(c3ccccc3F)CCC2)nc(CC)[nH+]1 ZINC001186914175 1048360393 /nfs/dbraw/zinc/36/03/93/1048360393.db2.gz MAYVSEASQSPGCX-UHFFFAOYSA-N 1 2 313.420 4.274 20 0 DIADLO Cc1cc(N[C@H]2COc3ccc(Cl)cc32)nc(C2CCC2)[nH+]1 ZINC001162792021 1048361023 /nfs/dbraw/zinc/36/10/23/1048361023.db2.gz KCMXGQWXKLVLDE-AWEZNQCLSA-N 1 2 315.804 4.252 20 0 DIADLO CCOC(=O)/C=C/c1ccc[nH+]c1N[C@H]1CCc2ccc(C)cc21 ZINC001162823083 1048366478 /nfs/dbraw/zinc/36/64/78/1048366478.db2.gz PRDSQCAIFIREHV-CKDFRHGISA-N 1 2 322.408 4.066 20 0 DIADLO COC(OC)c1cc(C)c[nH+]c1N[C@H]1CCc2ccc(C)cc21 ZINC001162824465 1048366927 /nfs/dbraw/zinc/36/69/27/1048366927.db2.gz WQMRBIGVZNCSJO-KRWDZBQOSA-N 1 2 312.413 4.089 20 0 DIADLO Cc1cc(NCc2cccc(F)c2OC(F)F)ccc1[NH+](C)C ZINC001201760750 1048369264 /nfs/dbraw/zinc/36/92/64/1048369264.db2.gz IPBGGZXIRALONS-UHFFFAOYSA-N 1 2 324.346 4.414 20 0 DIADLO COc1cccc2c(NCc3cn(C)c4ccccc34)cc[nH+]c12 ZINC001162834594 1048370085 /nfs/dbraw/zinc/37/00/85/1048370085.db2.gz AZJVCBRWHQNSDO-UHFFFAOYSA-N 1 2 317.392 4.347 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1ccccc1OC ZINC000775082395 1048370490 /nfs/dbraw/zinc/37/04/90/1048370490.db2.gz XVMRVUVBJHFIHH-CQSZACIVSA-N 1 2 314.360 4.216 20 0 DIADLO O=C(Nc1cc(Cl)cc(Cl)c1)Nc1cccc2[nH+]ccn21 ZINC001187120171 1048370514 /nfs/dbraw/zinc/37/05/14/1048370514.db2.gz XPSXVWSQUSQGPX-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO Cc1ccc2ncc(C[NH2+][C@@H](CF)c3ccc(F)cc3)cc2c1 ZINC001175561461 1048370880 /nfs/dbraw/zinc/37/08/80/1048370880.db2.gz UIGFJIWJSXDVKG-IBGZPJMESA-N 1 2 312.363 4.483 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cc(Cl)ncc2Br)c1 ZINC001203654661 1048372520 /nfs/dbraw/zinc/37/25/20/1048372520.db2.gz PFJFNQXXIIFFMO-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1ccc2[nH+]cc(CN[C@H](CC(C)(C)C)C(F)(F)F)n2c1 ZINC001201734966 1048373408 /nfs/dbraw/zinc/37/34/08/1048373408.db2.gz QEXZROQZOPVALM-CYBMUJFWSA-N 1 2 313.367 4.099 20 0 DIADLO Cc1nc(N[C@H](C)c2cccc(F)c2Cl)c2c([nH+]1)CCC2 ZINC001162891495 1048377757 /nfs/dbraw/zinc/37/77/57/1048377757.db2.gz NSXLUKAYGKNRCT-SECBINFHSA-N 1 2 305.784 4.239 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@H](C)c2cccc(F)c2Cl)[nH+]1 ZINC001162893628 1048379736 /nfs/dbraw/zinc/37/97/36/1048379736.db2.gz UZRMZTIBPVOYNS-MRVPVSSYSA-N 1 2 304.756 4.232 20 0 DIADLO COc1ccc2c(c1)CC[C@H](Nc1cc(C)[nH+]c(C3CCC3)n1)C2 ZINC001162907631 1048384406 /nfs/dbraw/zinc/38/44/06/1048384406.db2.gz UGQQRAFAABHENV-KRWDZBQOSA-N 1 2 323.440 4.031 20 0 DIADLO CCC(CC)[C@H]1C[C@@H](Nc2cc(C)[nH+]c(C3CCC3)n2)CCO1 ZINC001162942214 1048393974 /nfs/dbraw/zinc/39/39/74/1048393974.db2.gz CKXXCMXKCUHJSC-DLBZAZTESA-N 1 2 317.477 4.448 20 0 DIADLO Cn1cc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc2n1 ZINC001175614873 1048396495 /nfs/dbraw/zinc/39/64/95/1048396495.db2.gz BGAZANIZFRUEFN-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO Cc1nc(NCCC[C@H]2C=CCC2)c(Br)c(C)[nH+]1 ZINC001187503805 1048400838 /nfs/dbraw/zinc/40/08/38/1048400838.db2.gz REIJSAIXCYPIKS-LBPRGKRZSA-N 1 2 310.239 4.014 20 0 DIADLO COc1ccc2c(c1)CCC[C@H]2CNc1cc(C)[nH+]c(C2CC2)n1 ZINC001163004978 1048404072 /nfs/dbraw/zinc/40/40/72/1048404072.db2.gz HRKGBWFFQWNQLV-INIZCTEOSA-N 1 2 323.440 4.203 20 0 DIADLO Cc1cccc([C@@H]2CCN(c3cc(C)[nH+]c(C4CCC4)n3)C2)c1 ZINC001163030413 1048405250 /nfs/dbraw/zinc/40/52/50/1048405250.db2.gz FKVCGFZFFPIJFO-GOSISDBHSA-N 1 2 307.441 4.355 20 0 DIADLO CC[C@@H](NC(=O)[C@H](C)Cc1c[nH]c[nH+]1)c1cccc2ccccc21 ZINC000899654072 1048409723 /nfs/dbraw/zinc/40/97/23/1048409723.db2.gz FTGOQUVIZFUXDG-AUUYWEPGSA-N 1 2 321.424 4.009 20 0 DIADLO CC[C@@H](NC(=O)[C@H](C)Cc1c[nH+]c[nH]1)c1cccc2ccccc21 ZINC000899654072 1048409741 /nfs/dbraw/zinc/40/97/41/1048409741.db2.gz FTGOQUVIZFUXDG-AUUYWEPGSA-N 1 2 321.424 4.009 20 0 DIADLO C[N@H+](Cc1ccc(F)c2cccnc12)Cc1c(F)cccc1F ZINC000555650616 1048416239 /nfs/dbraw/zinc/41/62/39/1048416239.db2.gz DJCKODIAOKMRJI-UHFFFAOYSA-N 1 2 316.326 4.284 20 0 DIADLO C[N@@H+](Cc1ccc(F)c2cccnc12)Cc1c(F)cccc1F ZINC000555650616 1048416246 /nfs/dbraw/zinc/41/62/46/1048416246.db2.gz DJCKODIAOKMRJI-UHFFFAOYSA-N 1 2 316.326 4.284 20 0 DIADLO Cc1cc(Nc2c[nH+]c(N)cc2C(F)(F)F)c2ccsc2n1 ZINC001175713030 1048418989 /nfs/dbraw/zinc/41/89/89/1048418989.db2.gz YGAUOPXDLFBPPI-UHFFFAOYSA-N 1 2 324.331 4.344 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2c(F)cccc2Cl)c[nH+]1 ZINC001175713114 1048419741 /nfs/dbraw/zinc/41/97/41/1048419741.db2.gz QFVAFKNGTIUZIL-UHFFFAOYSA-N 1 2 305.662 4.219 20 0 DIADLO CC(C)c1ncsc1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175712553 1048419862 /nfs/dbraw/zinc/41/98/62/1048419862.db2.gz OGJJJDCNXJEXFE-UHFFFAOYSA-N 1 2 302.325 4.006 20 0 DIADLO Cc1ccc([C@@H]2CC[N@H+](CC(F)(F)C(F)F)C2(C)C)cc1 ZINC001175715353 1048420481 /nfs/dbraw/zinc/42/04/81/1048420481.db2.gz ODBPNCSVDXFNHU-ZDUSSCGKSA-N 1 2 303.343 4.463 20 0 DIADLO Cc1ccc([C@@H]2CC[N@@H+](CC(F)(F)C(F)F)C2(C)C)cc1 ZINC001175715353 1048420486 /nfs/dbraw/zinc/42/04/86/1048420486.db2.gz ODBPNCSVDXFNHU-ZDUSSCGKSA-N 1 2 303.343 4.463 20 0 DIADLO Cc1ccc(Nc2c[nH+]c(N)cc2C(F)(F)F)c(Cl)c1O ZINC001175714321 1048420528 /nfs/dbraw/zinc/42/05/28/1048420528.db2.gz MVHAAGHWLMGHKN-UHFFFAOYSA-N 1 2 317.698 4.094 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccccc2OCC2CC2)c[nH+]1 ZINC001175714469 1048420605 /nfs/dbraw/zinc/42/06/05/1048420605.db2.gz XCGYHHDGIRMZIN-UHFFFAOYSA-N 1 2 323.318 4.215 20 0 DIADLO Cc1c(F)ccc(Nc2c[nH+]c(N)cc2C(F)(F)F)c1F ZINC001175714268 1048421420 /nfs/dbraw/zinc/42/14/20/1048421420.db2.gz LKYUKEAQLOVXES-UHFFFAOYSA-N 1 2 303.234 4.013 20 0 DIADLO Cc1c(C)c(Nc2c[nH+]c(N)cc2C(F)(F)F)c(C)c(C)c1N ZINC001175714407 1048421638 /nfs/dbraw/zinc/42/16/38/1048421638.db2.gz VMNVVAOKBYRLRQ-UHFFFAOYSA-N 1 2 324.350 4.242 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(F)c3cccnc23)c[nH+]1 ZINC001175714322 1048421746 /nfs/dbraw/zinc/42/17/46/1048421746.db2.gz MVTTXIZJMHWMOS-UHFFFAOYSA-N 1 2 322.265 4.114 20 0 DIADLO Cc1cc(F)c(F)cc1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175717736 1048422926 /nfs/dbraw/zinc/42/29/26/1048422926.db2.gz NWBIIICDEPFOPD-UHFFFAOYSA-N 1 2 303.234 4.013 20 0 DIADLO COc1cccc(Nc2c[nH+]c(N)cc2C(F)(F)F)c1Cl ZINC001175716900 1048423408 /nfs/dbraw/zinc/42/34/08/1048423408.db2.gz CLQPTXOAZBBBPH-UHFFFAOYSA-N 1 2 317.698 4.088 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2csc3cnccc23)c[nH+]1 ZINC001175707137 1048437929 /nfs/dbraw/zinc/43/79/29/1048437929.db2.gz WIUGUCUAZIRXCM-UHFFFAOYSA-N 1 2 310.304 4.036 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ncc(Cl)cc2Cl)c[nH+]1 ZINC001175710056 1048437962 /nfs/dbraw/zinc/43/79/62/1048437962.db2.gz RFSXQWWBMFEDJJ-UHFFFAOYSA-N 1 2 323.105 4.128 20 0 DIADLO Cc1cc(Nc2c[nH+]c(N)cc2C(F)(F)F)nc2ccccc12 ZINC001175709614 1048438012 /nfs/dbraw/zinc/43/80/12/1048438012.db2.gz GULWNKYOEFUCTN-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Cc1cscc1Nc1ccc2[nH+]cc(Br)n2c1 ZINC001175765054 1048444125 /nfs/dbraw/zinc/44/41/25/1048444125.db2.gz AOLREGKHEWSEQB-UHFFFAOYSA-N 1 2 308.204 4.210 20 0 DIADLO CCc1nc(N(Cc2cccs2)Cc2ccncc2)cc(C)[nH+]1 ZINC001187880489 1048449558 /nfs/dbraw/zinc/44/95/58/1048449558.db2.gz HJCGSXZFRQIYGB-UHFFFAOYSA-N 1 2 324.453 4.011 20 0 DIADLO COc1c(F)cccc1[C@@H](C)Nc1cc(C(C)C)[nH+]c(C)n1 ZINC001163335487 1048455236 /nfs/dbraw/zinc/45/52/36/1048455236.db2.gz PUXWMAGUCRMSGD-LLVKDONJSA-N 1 2 303.381 4.229 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+]Cc3nc4c(s3)CCC4)o2)cc1 ZINC001203672421 1048455667 /nfs/dbraw/zinc/45/56/67/1048455667.db2.gz KQGVCOIJWCARDQ-UHFFFAOYSA-N 1 2 324.449 4.490 20 0 DIADLO COc1cnccc1[C@@H](Nc1[nH+]c(C)cc(Cl)c1C)C1CC1 ZINC001163397504 1048466657 /nfs/dbraw/zinc/46/66/57/1048466657.db2.gz GKHYLIWZEAZTSW-INIZCTEOSA-N 1 2 317.820 4.319 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3Cc4ccccc4C4(CC4)C3)oc2c1 ZINC000481736693 1048473829 /nfs/dbraw/zinc/47/38/29/1048473829.db2.gz CAORYEDKYHTOAY-UHFFFAOYSA-N 1 2 308.356 4.014 20 0 DIADLO Fc1ccc2nc(C[N@H+]3Cc4ccccc4C4(CC4)C3)oc2c1 ZINC000481736693 1048473837 /nfs/dbraw/zinc/47/38/37/1048473837.db2.gz CAORYEDKYHTOAY-UHFFFAOYSA-N 1 2 308.356 4.014 20 0 DIADLO COc1cccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1Cl ZINC001175894532 1048476092 /nfs/dbraw/zinc/47/60/92/1048476092.db2.gz MBCXUHLUZAIPTI-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO COc1cc2ccc(N3[C@H](C)CCC[C@H]3C)[nH+]c2cc1OC ZINC001163544184 1048486333 /nfs/dbraw/zinc/48/63/33/1048486333.db2.gz DCTDLQAOPHOROK-CHWSQXEVSA-N 1 2 300.402 4.019 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC001175875275 1048488938 /nfs/dbraw/zinc/48/89/38/1048488938.db2.gz WLPGUGQVPGCKDI-GIPNMCIBSA-N 1 2 323.305 4.068 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC001175875275 1048488940 /nfs/dbraw/zinc/48/89/40/1048488940.db2.gz WLPGUGQVPGCKDI-GIPNMCIBSA-N 1 2 323.305 4.068 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1C(F)F ZINC001188265776 1048494191 /nfs/dbraw/zinc/49/41/91/1048494191.db2.gz BDPHJFWRQKAJRF-UHFFFAOYSA-N 1 2 313.307 4.062 20 0 DIADLO CCc1cccc(CNc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001163636123 1048495724 /nfs/dbraw/zinc/49/57/24/1048495724.db2.gz WYOAQVNSGSWEIE-UHFFFAOYSA-N 1 2 302.381 4.057 20 0 DIADLO CCCN(CCOC)c1cc(SCc2ccccc2)cc[nH+]1 ZINC001163647697 1048496582 /nfs/dbraw/zinc/49/65/82/1048496582.db2.gz ISRNQTRQQQYPAX-UHFFFAOYSA-N 1 2 316.470 4.237 20 0 DIADLO COC(=O)C1(c2ccc(Nc3cccc(C(C)C)[nH+]3)cc2)CC1 ZINC001175917836 1048500803 /nfs/dbraw/zinc/50/08/03/1048500803.db2.gz RRXRDVNFVUBYBM-UHFFFAOYSA-N 1 2 310.397 4.153 20 0 DIADLO CCc1nc(N2CCc3oc(-c4ccccc4)cc3C2)cc(C)[nH+]1 ZINC001163676141 1048501568 /nfs/dbraw/zinc/50/15/68/1048501568.db2.gz REVMSAJGEZCSQO-UHFFFAOYSA-N 1 2 319.408 4.170 20 0 DIADLO CC(C)Oc1c(F)cc(C[NH+]2CCC(F)(F)CC2)cc1Cl ZINC001250280813 1048515965 /nfs/dbraw/zinc/51/59/65/1048515965.db2.gz LCKKZJFPEVRDMM-UHFFFAOYSA-N 1 2 321.770 4.497 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cnc(-c3ccccc3)[nH]2)ccc1F ZINC000556045141 1048521855 /nfs/dbraw/zinc/52/18/55/1048521855.db2.gz XRLBRLJXKSWNGW-UHFFFAOYSA-N 1 2 309.388 4.156 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cnc(-c3ccccc3)[nH]2)ccc1F ZINC000556045141 1048521864 /nfs/dbraw/zinc/52/18/64/1048521864.db2.gz XRLBRLJXKSWNGW-UHFFFAOYSA-N 1 2 309.388 4.156 20 0 DIADLO COc1ccccc1[C@H]1CCN(c2[nH+]c(C)cc(Cl)c2C)C1 ZINC001163807245 1048527917 /nfs/dbraw/zinc/52/79/17/1048527917.db2.gz QHBAXSYZDCTXGX-AWEZNQCLSA-N 1 2 316.832 4.354 20 0 DIADLO FC(F)Oc1ccccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176009142 1048532016 /nfs/dbraw/zinc/53/20/16/1048532016.db2.gz GBQKEEXOOYJJSV-UHFFFAOYSA-N 1 2 305.328 4.027 20 0 DIADLO [NH2+]=C(Nc1nccc2ccncc21)C12CC3CC(CC(C3)C1)C2 ZINC001163839233 1048533501 /nfs/dbraw/zinc/53/35/01/1048533501.db2.gz GATBQQUWNXQECH-UHFFFAOYSA-N 1 2 306.413 4.235 20 0 DIADLO COc1cc(C)c(NCc2c[nH+]c(C)n2-c2ccccc2)cc1C ZINC000775183143 1048536480 /nfs/dbraw/zinc/53/64/80/1048536480.db2.gz IFMYTGANSWJPEX-UHFFFAOYSA-N 1 2 321.424 4.418 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1cccc(N2CCOCC2)c1 ZINC001176019624 1048538406 /nfs/dbraw/zinc/53/84/06/1048538406.db2.gz OPOJCPIOYSRAFO-UHFFFAOYSA-N 1 2 311.429 4.094 20 0 DIADLO c1ccc(-c2ccc(Nc3[nH+]cccc3N3CCCC3)cc2)nc1 ZINC001176038098 1048542050 /nfs/dbraw/zinc/54/20/50/1048542050.db2.gz FMFOYMASVIQZDQ-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Nc1ccccc1CNc1[nH+]ccc2cccc(C(F)(F)F)c21 ZINC001163880605 1048544421 /nfs/dbraw/zinc/54/44/21/1048544421.db2.gz BOVMQUQLKZUCID-UHFFFAOYSA-N 1 2 317.314 4.448 20 0 DIADLO Cn1c(CNc2cc(-c3ccncc3)cc[nH+]2)cc2ccccc21 ZINC001163931367 1048551712 /nfs/dbraw/zinc/55/17/12/1048551712.db2.gz BBUPKOYRQHZCIG-UHFFFAOYSA-N 1 2 314.392 4.247 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667986095 1048559310 /nfs/dbraw/zinc/55/93/10/1048559310.db2.gz PZYYCVFCCVWILQ-ABAIWWIYSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667986095 1048559328 /nfs/dbraw/zinc/55/93/28/1048559328.db2.gz PZYYCVFCCVWILQ-ABAIWWIYSA-N 1 2 306.331 4.082 20 0 DIADLO Cc1ccccc1OCCCNc1ccc(Cn2cc[nH+]c2)cc1 ZINC001163975623 1048563852 /nfs/dbraw/zinc/56/38/52/1048563852.db2.gz VCVFOGMONONULZ-UHFFFAOYSA-N 1 2 321.424 4.121 20 0 DIADLO Cc1nc(N2CCCC(F)(F)CC2)cc(C2CCCCC2)[nH+]1 ZINC001163981597 1048565512 /nfs/dbraw/zinc/56/55/12/1048565512.db2.gz BNLJVOZYDNSMTE-UHFFFAOYSA-N 1 2 309.404 4.458 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(C)cc(F)c1Br ZINC001176125152 1048576459 /nfs/dbraw/zinc/57/64/59/1048576459.db2.gz XNQFLFXCDMBZMP-UHFFFAOYSA-N 1 2 311.154 4.044 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(Oc2ccccc2F)nc1 ZINC001176117950 1048574442 /nfs/dbraw/zinc/57/44/42/1048574442.db2.gz FAABDDWJGYVXKR-UHFFFAOYSA-N 1 2 311.316 4.160 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)Nc1cc(Cl)ccc1Cl ZINC001188972351 1048574555 /nfs/dbraw/zinc/57/45/55/1048574555.db2.gz DVLARWABHPHRHE-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(C2CCC2)nn1C(C)(C)C ZINC001176117243 1048574738 /nfs/dbraw/zinc/57/47/38/1048574738.db2.gz XJMWTFPXWKTWFZ-UHFFFAOYSA-N 1 2 300.406 4.053 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(F)cc(C)c1Br ZINC001176124473 1048575872 /nfs/dbraw/zinc/57/58/72/1048575872.db2.gz NDFYTEHDMAETPH-UHFFFAOYSA-N 1 2 311.154 4.044 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(-c2ccccc2)nn1CC1CC1 ZINC001176121086 1048575959 /nfs/dbraw/zinc/57/59/59/1048575959.db2.gz GRYRJLWERABQCM-UHFFFAOYSA-N 1 2 320.396 4.107 20 0 DIADLO COc1cc[nH+]cc1Nc1ccccc1Oc1ccccc1N ZINC001176125227 1048577442 /nfs/dbraw/zinc/57/74/42/1048577442.db2.gz WVBLXYWIHQGGFN-UHFFFAOYSA-N 1 2 307.353 4.208 20 0 DIADLO COc1cc[nH+]cc1-n1c(-c2ccccc2)cc2cc(N)ccc21 ZINC001176124422 1048577511 /nfs/dbraw/zinc/57/75/11/1048577511.db2.gz NLQCEEJBIZZOGK-UHFFFAOYSA-N 1 2 315.376 4.283 20 0 DIADLO COc1cc[nH+]cc1N[C@@H](C)c1ccc(Br)s1 ZINC001164088729 1048581761 /nfs/dbraw/zinc/58/17/61/1048581761.db2.gz JXUAQSWXWHNNFW-QMMMGPOBSA-N 1 2 313.220 4.087 20 0 DIADLO C[C@H](Nc1ccn2cc(N)[nH+]c2c1)c1ccc2ccccc2c1 ZINC001164144429 1048590769 /nfs/dbraw/zinc/59/07/69/1048590769.db2.gz DIGQMIWSESNCBZ-ZDUSSCGKSA-N 1 2 302.381 4.243 20 0 DIADLO Fc1ccc2c[nH+]c(N[C@H](c3cccnc3)C(F)(F)F)cc2c1 ZINC001164175177 1048596668 /nfs/dbraw/zinc/59/66/68/1048596668.db2.gz CRVTVXRKKWGTBH-OAHLLOKOSA-N 1 2 321.277 4.484 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3CCC[C@H](C)C3)cc2)[nH+]c1C ZINC001176211244 1048605490 /nfs/dbraw/zinc/60/54/90/1048605490.db2.gz MEMWSSKBVHPVFH-LRDDRELGSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@]3(C)CC=CCC3)cc2)[nH+]c1C ZINC001176211332 1048606294 /nfs/dbraw/zinc/60/62/94/1048606294.db2.gz OYTTWQMQXJOOGJ-LJQANCHMSA-N 1 2 309.413 4.378 20 0 DIADLO CC1=C(C)C[N@@H+](Cc2csc(COc3ccccc3)n2)CC1 ZINC000482457932 1048611797 /nfs/dbraw/zinc/61/17/97/1048611797.db2.gz LDOALFGWVANHCI-UHFFFAOYSA-N 1 2 314.454 4.264 20 0 DIADLO CC1=C(C)C[N@H+](Cc2csc(COc3ccccc3)n2)CC1 ZINC000482457932 1048611795 /nfs/dbraw/zinc/61/17/95/1048611795.db2.gz LDOALFGWVANHCI-UHFFFAOYSA-N 1 2 314.454 4.264 20 0 DIADLO CCCCOc1ccc(NC(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001189289401 1048611551 /nfs/dbraw/zinc/61/15/51/1048611551.db2.gz YKLFQOSWVRNOFW-UHFFFAOYSA-N 1 2 324.384 4.157 20 0 DIADLO CCc1cc(N2CCC[C@@H]2/C=C\c2ccccc2)nc(CC)[nH+]1 ZINC001164261736 1048614138 /nfs/dbraw/zinc/61/41/38/1048614138.db2.gz YXZWPHMFPPLRKZ-MENFKHAKSA-N 1 2 307.441 4.284 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2nc(-c3ccccc3)c[nH]2)C2CC2)n1 ZINC000194339517 1048614743 /nfs/dbraw/zinc/61/47/43/1048614743.db2.gz RUCJRUUGESFBEF-KRWDZBQOSA-N 1 2 324.453 4.083 20 0 DIADLO Cc1cc(N2CCC[C@@]2(C)Cc2cccs2)nc(C2CC2)[nH+]1 ZINC001164265048 1048616083 /nfs/dbraw/zinc/61/60/83/1048616083.db2.gz MVUULLSANVHTJN-SFHVURJKSA-N 1 2 313.470 4.326 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000482495058 1048617678 /nfs/dbraw/zinc/61/76/78/1048617678.db2.gz HADDIWDCTZDCCG-WFASDCNBSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000482495058 1048617687 /nfs/dbraw/zinc/61/76/87/1048617687.db2.gz HADDIWDCTZDCCG-WFASDCNBSA-N 1 2 323.362 4.240 20 0 DIADLO Cc1[nH]c(CNc2cccc(C3SCCS3)c2)[nH+]c1C ZINC000850200546 1048621743 /nfs/dbraw/zinc/62/17/43/1048621743.db2.gz CBBRDVGXYXAIBT-UHFFFAOYSA-N 1 2 305.472 4.117 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3cc4ccncc4s3)ccc21 ZINC000850209075 1048624666 /nfs/dbraw/zinc/62/46/66/1048624666.db2.gz MJGQQKFWLZZRIJ-UHFFFAOYSA-N 1 2 309.438 4.291 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3cc4ccncc4s3)ccc21 ZINC000850209075 1048624675 /nfs/dbraw/zinc/62/46/75/1048624675.db2.gz MJGQQKFWLZZRIJ-UHFFFAOYSA-N 1 2 309.438 4.291 20 0 DIADLO FC(F)(F)c1cccc2cc[nH+]c(NCCn3cccc3)c21 ZINC001164443520 1048628264 /nfs/dbraw/zinc/62/82/64/1048628264.db2.gz UZSCTYZLGPOBFM-UHFFFAOYSA-N 1 2 305.303 4.167 20 0 DIADLO Cc1cc(Oc2ccc(Nc3ccc4nonc4c3)cc2)cc[nH+]1 ZINC001176326756 1048628720 /nfs/dbraw/zinc/62/87/20/1048628720.db2.gz DBIUACBVIBXSSZ-UHFFFAOYSA-N 1 2 318.336 4.462 20 0 DIADLO Fc1cc(F)c(Nc2cccc(Cn3cc[nH+]c3)c2)c(F)c1F ZINC001176348774 1048629314 /nfs/dbraw/zinc/62/93/14/1048629314.db2.gz GRWWHPLIRSYVNB-UHFFFAOYSA-N 1 2 321.277 4.231 20 0 DIADLO Cc1cccn2c(CNc3ccc4c(c3)[C@@H](O)CCCC4)c[nH+]c12 ZINC000850362730 1048638395 /nfs/dbraw/zinc/63/83/95/1048638395.db2.gz NDHXAOHWCHNQMM-IBGZPJMESA-N 1 2 321.424 4.015 20 0 DIADLO Cc1cc(N)nc(SCCc2cccc(Cl)c2Cl)[nH+]1 ZINC001165288288 1048675326 /nfs/dbraw/zinc/67/53/26/1048675326.db2.gz FMQSJYBFDFOXNX-UHFFFAOYSA-N 1 2 314.241 4.009 20 0 DIADLO Cc1c[nH+]c(Nc2cccc3c2cnn3[C@@H]2CCCCO2)c(C)c1 ZINC001176317307 1048649599 /nfs/dbraw/zinc/64/95/99/1048649599.db2.gz GAFOCPDHXWEMNR-SFHVURJKSA-N 1 2 322.412 4.491 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1ccc(Cl)cc1 ZINC000109324570 1048653727 /nfs/dbraw/zinc/65/37/27/1048653727.db2.gz LXWZQAZUXXYKHI-CYBMUJFWSA-N 1 2 307.825 4.261 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CCCC34CC4)cc2)C[C@H](C)O1 ZINC000850458793 1048664322 /nfs/dbraw/zinc/66/43/22/1048664322.db2.gz PWVDKLGEDZVEJW-DAYGRLMNSA-N 1 2 300.446 4.045 20 0 DIADLO CCc1cc(SCc2cc[nH+]c(N(C)C)c2)c(C)cc1OC ZINC001189892702 1048676086 /nfs/dbraw/zinc/67/60/86/1048676086.db2.gz RPGVYGBLGIJSNF-UHFFFAOYSA-N 1 2 316.470 4.319 20 0 DIADLO CCn1cc(C[NH2+][C@H](C)c2ccccc2SC(C)(C)C)nn1 ZINC000850522754 1048677377 /nfs/dbraw/zinc/67/73/77/1048677377.db2.gz ZIDKIHTULJHSAZ-CYBMUJFWSA-N 1 2 318.490 4.039 20 0 DIADLO COc1cc2cc[nH+]c(N3CCC4(CC(F)C4)CC3)c2cc1F ZINC001165310297 1048679579 /nfs/dbraw/zinc/67/95/79/1048679579.db2.gz NKPCKVJMDOYZTN-UHFFFAOYSA-N 1 2 318.367 4.101 20 0 DIADLO Fc1cc(Br)cc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000482826633 1048684116 /nfs/dbraw/zinc/68/41/16/1048684116.db2.gz SDRWJQMRKUSXBN-HNNXBMFYSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1cc(Br)cc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000482826633 1048684123 /nfs/dbraw/zinc/68/41/23/1048684123.db2.gz SDRWJQMRKUSXBN-HNNXBMFYSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1cc(Br)cc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)c1 ZINC000482826636 1048685039 /nfs/dbraw/zinc/68/50/39/1048685039.db2.gz SDRWJQMRKUSXBN-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1cc(Br)cc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c1 ZINC000482826636 1048685048 /nfs/dbraw/zinc/68/50/48/1048685048.db2.gz SDRWJQMRKUSXBN-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO CSc1cc[nH+]c(N2CCC3(C=Cc4ccccc43)CC2)c1 ZINC001165337187 1048685108 /nfs/dbraw/zinc/68/51/08/1048685108.db2.gz JEUOMTPLSRHJNO-UHFFFAOYSA-N 1 2 308.450 4.369 20 0 DIADLO CCN(C)c1ccc(Nc2cc(F)cc(N3CCCC3)c2)c[nH+]1 ZINC001176421600 1048685279 /nfs/dbraw/zinc/68/52/79/1048685279.db2.gz SLVAXOUNVFERQF-UHFFFAOYSA-N 1 2 314.408 4.021 20 0 DIADLO CCN(C)C(=O)c1cccc(Nc2c(C)cc[nH+]c2C(C)C)c1 ZINC001176464781 1048689998 /nfs/dbraw/zinc/68/99/98/1048689998.db2.gz UXJSSQUHHBIYAY-UHFFFAOYSA-N 1 2 311.429 4.349 20 0 DIADLO CCc1cccc(CC)c1NC(=O)c1ccccc1-n1cc[nH+]c1 ZINC001190099390 1048695119 /nfs/dbraw/zinc/69/51/19/1048695119.db2.gz HPXNLTSYAPVZKM-UHFFFAOYSA-N 1 2 319.408 4.249 20 0 DIADLO c1cn(Cc2cccc(Nc3cccc(OCC4CC4)c3)c2)c[nH+]1 ZINC001176492111 1048697090 /nfs/dbraw/zinc/69/70/90/1048697090.db2.gz UQOJAHOPOUBSSM-UHFFFAOYSA-N 1 2 319.408 4.464 20 0 DIADLO Cc1ccc2c(Nc3cnc(N4CCCCC4)nc3)cccc2[nH+]1 ZINC001176507853 1048703775 /nfs/dbraw/zinc/70/37/75/1048703775.db2.gz GJYPSKFSFFDKMU-UHFFFAOYSA-N 1 2 319.412 4.067 20 0 DIADLO CC(C)c1cccc(NC(=O)C[N@@H+]2CC[C@H]2c2ccccc2)c1 ZINC000482936191 1048706756 /nfs/dbraw/zinc/70/67/56/1048706756.db2.gz JHPASARGDMZHDS-IBGZPJMESA-N 1 2 308.425 4.196 20 0 DIADLO CC(C)c1cccc(NC(=O)C[N@H+]2CC[C@H]2c2ccccc2)c1 ZINC000482936191 1048706773 /nfs/dbraw/zinc/70/67/73/1048706773.db2.gz JHPASARGDMZHDS-IBGZPJMESA-N 1 2 308.425 4.196 20 0 DIADLO Cc1cn2cccc(Nc3cccc(OC(F)(F)F)c3)c2[nH+]1 ZINC001176535321 1048710470 /nfs/dbraw/zinc/71/04/70/1048710470.db2.gz KJKDOHMORICXJD-UHFFFAOYSA-N 1 2 307.275 4.285 20 0 DIADLO COc1cccc([C@H](C)SCc2cc(OC)cc(C)[nH+]2)c1 ZINC001165816528 1048720260 /nfs/dbraw/zinc/72/02/60/1048720260.db2.gz JUOVKKZWEBPYGX-ZDUSSCGKSA-N 1 2 303.427 4.402 20 0 DIADLO CCc1ccc(NC(=O)C[N@H+](C)[C@H](C)c2ccccc2F)cc1 ZINC001190392401 1048725695 /nfs/dbraw/zinc/72/56/95/1048725695.db2.gz OWYBONMOPZDDRM-CQSZACIVSA-N 1 2 314.404 4.020 20 0 DIADLO CCc1ccc(NC(=O)C[N@@H+](C)[C@H](C)c2ccccc2F)cc1 ZINC001190392401 1048725708 /nfs/dbraw/zinc/72/57/08/1048725708.db2.gz OWYBONMOPZDDRM-CQSZACIVSA-N 1 2 314.404 4.020 20 0 DIADLO C(=C/c1ccccc1)\CNc1cc[nH+]c(OCc2ccccn2)c1 ZINC001166154338 1048737624 /nfs/dbraw/zinc/73/76/24/1048737624.db2.gz XHJZJZFKFZQXAC-RMKNXTFCSA-N 1 2 317.392 4.181 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1)c1ncco1 ZINC000924783823 1048742088 /nfs/dbraw/zinc/74/20/88/1048742088.db2.gz ZULSQFWDSQJWHU-QWRGUYRKSA-N 1 2 314.307 4.028 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(OCC(F)(F)F)cc1)c1ncco1 ZINC000924783821 1048743505 /nfs/dbraw/zinc/74/35/05/1048743505.db2.gz ZULSQFWDSQJWHU-GHMZBOCLSA-N 1 2 314.307 4.028 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1F)Cc1cccc(F)c1 ZINC001190510797 1048745505 /nfs/dbraw/zinc/74/55/05/1048745505.db2.gz PWWVWVLVJMYZIS-UHFFFAOYSA-N 1 2 303.352 4.058 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1F)Cc1cccc(F)c1 ZINC001190510797 1048745516 /nfs/dbraw/zinc/74/55/16/1048745516.db2.gz PWWVWVLVJMYZIS-UHFFFAOYSA-N 1 2 303.352 4.058 20 0 DIADLO CCN(C)c1ccc(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)cn1 ZINC000483172972 1048749713 /nfs/dbraw/zinc/74/97/13/1048749713.db2.gz MFRYDRIRCYVNSS-CYBMUJFWSA-N 1 2 319.399 4.009 20 0 DIADLO CCN(C)c1ccc(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)cn1 ZINC000483172972 1048749728 /nfs/dbraw/zinc/74/97/28/1048749728.db2.gz MFRYDRIRCYVNSS-CYBMUJFWSA-N 1 2 319.399 4.009 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(-c4ccncc4)cc3)ccc21 ZINC001176697809 1048761303 /nfs/dbraw/zinc/76/13/03/1048761303.db2.gz IACGDEXLIARDHG-UHFFFAOYSA-N 1 2 300.365 4.379 20 0 DIADLO CCNc1nc(C[N@H+](CC)Cc2ccc(Cl)cc2)cs1 ZINC001190627868 1048768943 /nfs/dbraw/zinc/76/89/43/1048768943.db2.gz OFWMMQBFUZRNBE-UHFFFAOYSA-N 1 2 309.866 4.250 20 0 DIADLO CCNc1nc(C[N@@H+](CC)Cc2ccc(Cl)cc2)cs1 ZINC001190627868 1048768956 /nfs/dbraw/zinc/76/89/56/1048768956.db2.gz OFWMMQBFUZRNBE-UHFFFAOYSA-N 1 2 309.866 4.250 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Br)o2)[C@H]1c1ccccc1 ZINC000483282780 1048771753 /nfs/dbraw/zinc/77/17/53/1048771753.db2.gz CCQNMJYIYQUKLN-IAQYHMDHSA-N 1 2 306.203 4.235 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Br)o2)[C@H]1c1ccccc1 ZINC000483282780 1048771766 /nfs/dbraw/zinc/77/17/66/1048771766.db2.gz CCQNMJYIYQUKLN-IAQYHMDHSA-N 1 2 306.203 4.235 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Br)o2)[C@@H]1c1ccccc1 ZINC000483282779 1048772110 /nfs/dbraw/zinc/77/21/10/1048772110.db2.gz CCQNMJYIYQUKLN-ABAIWWIYSA-N 1 2 306.203 4.235 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Br)o2)[C@@H]1c1ccccc1 ZINC000483282779 1048772120 /nfs/dbraw/zinc/77/21/20/1048772120.db2.gz CCQNMJYIYQUKLN-ABAIWWIYSA-N 1 2 306.203 4.235 20 0 DIADLO Oc1ccc2ccc(Nc3ccc[nH+]c3N3CCCC3)cc2c1 ZINC001176751222 1048777397 /nfs/dbraw/zinc/77/73/97/1048777397.db2.gz ZNHZJSAXDZCVQE-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO Cc1ccc2cccnc2c1Nc1ccc[nH+]c1N1CCCC1 ZINC001176750816 1048777725 /nfs/dbraw/zinc/77/77/25/1048777725.db2.gz NTNMPTVTOWFWJE-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO Fc1ccc2cc(Nc3ccc[nH+]c3N3CCCC3)cnc2c1 ZINC001176750556 1048778444 /nfs/dbraw/zinc/77/84/44/1048778444.db2.gz YQOJXQDAEPCRDE-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO Cc1nc2ccccc2cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176749427 1048779013 /nfs/dbraw/zinc/77/90/13/1048779013.db2.gz CEYZXLFZSKFWDG-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO Cc1cc(Nc2ccc[nH+]c2N2CCCC2)c2cccc(F)c2n1 ZINC001176749462 1048779242 /nfs/dbraw/zinc/77/92/42/1048779242.db2.gz DVFXTRNQUQSCDN-UHFFFAOYSA-N 1 2 322.387 4.421 20 0 DIADLO Cc1cc(Cl)c(C)c(N2CC[C@@H]2COCc2ccccc2)[nH+]1 ZINC001166671927 1048779490 /nfs/dbraw/zinc/77/94/90/1048779490.db2.gz WQKWGXPNURCLRV-MRXNPFEDSA-N 1 2 316.832 4.147 20 0 DIADLO Cc1cccc2c(C)cc(N3CCO[C@@H](c4ccccc4)C3)[nH+]c12 ZINC001166677432 1048780969 /nfs/dbraw/zinc/78/09/69/1048780969.db2.gz RVJSVRCFNOBXMA-LJQANCHMSA-N 1 2 318.420 4.430 20 0 DIADLO CCCC[N@H+](Cc1cc2n(n1)CCC2)Cc1ccccc1Cl ZINC001190753212 1048784067 /nfs/dbraw/zinc/78/40/67/1048784067.db2.gz QGKFCJPJGPFCML-UHFFFAOYSA-N 1 2 317.864 4.285 20 0 DIADLO CCCC[N@@H+](Cc1cc2n(n1)CCC2)Cc1ccccc1Cl ZINC001190753212 1048784080 /nfs/dbraw/zinc/78/40/80/1048784080.db2.gz QGKFCJPJGPFCML-UHFFFAOYSA-N 1 2 317.864 4.285 20 0 DIADLO FC1(C2CC2)CC[NH+](Cc2ncc(Cl)cc2Cl)CC1 ZINC001176755322 1048786776 /nfs/dbraw/zinc/78/67/76/1048786776.db2.gz TWGRBLDJCRJXNN-UHFFFAOYSA-N 1 2 303.208 4.103 20 0 DIADLO FC(F)(F)C1(c2ccc(NCCc3ccsc3)[nH+]c2)CC1 ZINC001166791026 1048794976 /nfs/dbraw/zinc/79/49/76/1048794976.db2.gz GLJNCTKFZBFTLL-UHFFFAOYSA-N 1 2 312.360 4.392 20 0 DIADLO c1ccc(CN(c2cc3ccccc3c[nH+]2)C2CCOCC2)cc1 ZINC001166809600 1048798384 /nfs/dbraw/zinc/79/83/84/1048798384.db2.gz PKBMNIILEHSTFR-UHFFFAOYSA-N 1 2 318.420 4.420 20 0 DIADLO CC[C@@H](CC(F)F)C[N@@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000851746946 1048800967 /nfs/dbraw/zinc/80/09/67/1048800967.db2.gz CVTMHQZCJRLFMO-NHYWBVRUSA-N 1 2 319.342 4.020 20 0 DIADLO CC[C@@H](CC(F)F)C[N@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000851746946 1048800989 /nfs/dbraw/zinc/80/09/89/1048800989.db2.gz CVTMHQZCJRLFMO-NHYWBVRUSA-N 1 2 319.342 4.020 20 0 DIADLO CC(=O)C1(c2ccccc2)CCN(c2ccc(C(C)C)c[nH+]2)CC1 ZINC001166838133 1048803139 /nfs/dbraw/zinc/80/31/39/1048803139.db2.gz PPARNOIZSSWDRJ-UHFFFAOYSA-N 1 2 322.452 4.332 20 0 DIADLO CC[C@@H](CC(F)F)Cn1c[nH+]c(Cc2ccccc2OC)c1 ZINC001166964783 1048819346 /nfs/dbraw/zinc/81/93/46/1048819346.db2.gz XTBPDKVUGNZIAZ-ZDUSSCGKSA-N 1 2 308.372 4.164 20 0 DIADLO C[C@H](c1nc2cc(Cl)ccc2[nH]1)[N@H+](C)Cc1ccsc1 ZINC000852126786 1048824985 /nfs/dbraw/zinc/82/49/85/1048824985.db2.gz HLGXDNYAENKMTD-SNVBAGLBSA-N 1 2 305.834 4.471 20 0 DIADLO C[C@H](c1nc2cc(Cl)ccc2[nH]1)[N@@H+](C)Cc1ccsc1 ZINC000852126786 1048825001 /nfs/dbraw/zinc/82/50/01/1048825001.db2.gz HLGXDNYAENKMTD-SNVBAGLBSA-N 1 2 305.834 4.471 20 0 DIADLO FC(F)(F)c1nc(Cl)ccc1C[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000852220152 1048829300 /nfs/dbraw/zinc/82/93/00/1048829300.db2.gz XXTPZOKJAOBMLV-ONGXEEELSA-N 1 2 304.743 4.128 20 0 DIADLO FC(F)(F)c1nc(Cl)ccc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000852220152 1048829319 /nfs/dbraw/zinc/82/93/19/1048829319.db2.gz XXTPZOKJAOBMLV-ONGXEEELSA-N 1 2 304.743 4.128 20 0 DIADLO COc1ccc(CN(C)c2ccc(C(C)(C)C)c[nH+]2)c(OC)c1 ZINC001167022924 1048832875 /nfs/dbraw/zinc/83/28/75/1048832875.db2.gz NUSSXJPOQDDZEC-UHFFFAOYSA-N 1 2 314.429 4.033 20 0 DIADLO Cc1cc(C[N@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)cc(Cl)n1 ZINC000797590034 1048834055 /nfs/dbraw/zinc/83/40/55/1048834055.db2.gz JEAFEUUGFXJKSU-PBHICJAKSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)cc(Cl)n1 ZINC000797590034 1048834071 /nfs/dbraw/zinc/83/40/71/1048834071.db2.gz JEAFEUUGFXJKSU-PBHICJAKSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cc(C[N@@H+]2C[C@@H](c3ccccc3)O[C@@H](C)C2)cc(Cl)n1 ZINC000797590039 1048834106 /nfs/dbraw/zinc/83/41/06/1048834106.db2.gz JEAFEUUGFXJKSU-YOEHRIQHSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cc(C[N@H+]2C[C@@H](c3ccccc3)O[C@@H](C)C2)cc(Cl)n1 ZINC000797590039 1048834129 /nfs/dbraw/zinc/83/41/29/1048834129.db2.gz JEAFEUUGFXJKSU-YOEHRIQHSA-N 1 2 316.832 4.005 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)nc1C(F)(F)F)c1cscn1 ZINC000852417373 1048839582 /nfs/dbraw/zinc/83/95/82/1048839582.db2.gz RZXSSMINVSZZNI-ZETCQYMHSA-N 1 2 321.755 4.061 20 0 DIADLO C[C@H]1COC2(CCC2)C[N@@H+]1Cc1cc2ccccc2c(Cl)n1 ZINC000852443621 1048842366 /nfs/dbraw/zinc/84/23/66/1048842366.db2.gz LFDCKXGAVLAPLJ-ZDUSSCGKSA-N 1 2 316.832 4.032 20 0 DIADLO C[C@H]1COC2(CCC2)C[N@H+]1Cc1cc2ccccc2c(Cl)n1 ZINC000852443621 1048842381 /nfs/dbraw/zinc/84/23/81/1048842381.db2.gz LFDCKXGAVLAPLJ-ZDUSSCGKSA-N 1 2 316.832 4.032 20 0 DIADLO C[N@H+](Cc1ccsc1)[C@@H](CO)c1cccc(Cl)c1Cl ZINC000852515186 1048847072 /nfs/dbraw/zinc/84/70/72/1048847072.db2.gz QRKRJWVERYXIMX-ZDUSSCGKSA-N 1 2 316.253 4.220 20 0 DIADLO C[N@@H+](Cc1ccsc1)[C@@H](CO)c1cccc(Cl)c1Cl ZINC000852515186 1048847088 /nfs/dbraw/zinc/84/70/88/1048847088.db2.gz QRKRJWVERYXIMX-ZDUSSCGKSA-N 1 2 316.253 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cccnc2Cl)cc1F ZINC000852518521 1048848530 /nfs/dbraw/zinc/84/85/30/1048848530.db2.gz IJTGYPWXSYUTJO-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cccnc2Cl)cc1F ZINC000852518521 1048848546 /nfs/dbraw/zinc/84/85/46/1048848546.db2.gz IJTGYPWXSYUTJO-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO C[N@H+](Cc1ccsc1)[C@H](CO)c1cccc(Cl)c1Cl ZINC000852515185 1048848680 /nfs/dbraw/zinc/84/86/80/1048848680.db2.gz QRKRJWVERYXIMX-CYBMUJFWSA-N 1 2 316.253 4.220 20 0 DIADLO C[N@@H+](Cc1ccsc1)[C@H](CO)c1cccc(Cl)c1Cl ZINC000852515185 1048848696 /nfs/dbraw/zinc/84/86/96/1048848696.db2.gz QRKRJWVERYXIMX-CYBMUJFWSA-N 1 2 316.253 4.220 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](CCSC(F)(F)F)[C@H](C)CO1 ZINC001191085858 1048863462 /nfs/dbraw/zinc/86/34/62/1048863462.db2.gz URXFSDIEQWSXBC-TZMCWYRMSA-N 1 2 319.392 4.010 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](CCSC(F)(F)F)[C@H](C)CO1 ZINC001191085858 1048863477 /nfs/dbraw/zinc/86/34/77/1048863477.db2.gz URXFSDIEQWSXBC-TZMCWYRMSA-N 1 2 319.392 4.010 20 0 DIADLO COCc1csc(C[N@@H+]2CCc3sc(Cl)cc3C2)c1 ZINC000668272060 1048868710 /nfs/dbraw/zinc/86/87/10/1048868710.db2.gz WPWDMOKLXWHZJJ-UHFFFAOYSA-N 1 2 313.875 4.168 20 0 DIADLO COCc1csc(C[N@H+]2CCc3sc(Cl)cc3C2)c1 ZINC000668272060 1048868723 /nfs/dbraw/zinc/86/87/23/1048868723.db2.gz WPWDMOKLXWHZJJ-UHFFFAOYSA-N 1 2 313.875 4.168 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1ncc(C(C)C)s1 ZINC001177315091 1048870702 /nfs/dbraw/zinc/87/07/02/1048870702.db2.gz JNMDEGDGUVBOJY-LLVKDONJSA-N 1 2 308.422 4.265 20 0 DIADLO CCOc1cc(Nc2cccc(C(=O)C(F)(F)F)c2)cc(C)[nH+]1 ZINC001203338505 1048873413 /nfs/dbraw/zinc/87/34/13/1048873413.db2.gz RMJBLGGJCVNHAN-UHFFFAOYSA-N 1 2 324.302 4.277 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@@H](CC(C)C)c3ccccn3)[nH]c2c1 ZINC000483870039 1048873434 /nfs/dbraw/zinc/87/34/34/1048873434.db2.gz QJODRVWLUUEDFM-KRWDZBQOSA-N 1 2 308.429 4.143 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+][C@H](C)c3cc(F)c(F)c(F)c3)nc2c1 ZINC000483853591 1048876451 /nfs/dbraw/zinc/87/64/51/1048876451.db2.gz OFLXYXMUPMVOTN-SNVBAGLBSA-N 1 2 319.330 4.139 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@H](C)c3cc(F)c(F)c(F)c3)[nH]c2c1 ZINC000483853591 1048876455 /nfs/dbraw/zinc/87/64/55/1048876455.db2.gz OFLXYXMUPMVOTN-SNVBAGLBSA-N 1 2 319.330 4.139 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+][C@H](C)c3ccc4ccccc4n3)nc2c1 ZINC000483877577 1048880055 /nfs/dbraw/zinc/88/00/55/1048880055.db2.gz FUINYKCZKKYEFM-CQSZACIVSA-N 1 2 316.408 4.270 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@H](C)c3ccc4ccccc4n3)[nH]c2c1 ZINC000483877577 1048880074 /nfs/dbraw/zinc/88/00/74/1048880074.db2.gz FUINYKCZKKYEFM-CQSZACIVSA-N 1 2 316.408 4.270 20 0 DIADLO Cc1ccc(Nc2ccc(Cl)nc2Br)c(C)[nH+]1 ZINC001203367581 1048883503 /nfs/dbraw/zinc/88/35/03/1048883503.db2.gz MPTZAVMSUPPXPK-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1cc(Nc2ccc(C)[nH+]c2C)n(Cc2cccc(F)c2)n1 ZINC001203368635 1048883572 /nfs/dbraw/zinc/88/35/72/1048883572.db2.gz BZNQJYNSHCRYNU-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO Cc1ccc(Nc2cc(F)ccc2OC[C@H]2CCCO2)c(C)[nH+]1 ZINC001203373152 1048886709 /nfs/dbraw/zinc/88/67/09/1048886709.db2.gz IHDWPITXCZDHSP-OAHLLOKOSA-N 1 2 316.376 4.139 20 0 DIADLO CC[C@@]1(C)CCC[N@@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191214548 1048888196 /nfs/dbraw/zinc/88/81/96/1048888196.db2.gz PPVMTODOPMBEDH-WBVHZDCISA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@@]1(C)CCC[N@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191214548 1048888218 /nfs/dbraw/zinc/88/82/18/1048888218.db2.gz PPVMTODOPMBEDH-WBVHZDCISA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@@]1(C)CCC[N@@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191214546 1048890618 /nfs/dbraw/zinc/89/06/18/1048890618.db2.gz PPVMTODOPMBEDH-RDJZCZTQSA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@@]1(C)CCC[N@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191214546 1048890632 /nfs/dbraw/zinc/89/06/32/1048890632.db2.gz PPVMTODOPMBEDH-RDJZCZTQSA-N 1 2 309.837 4.066 20 0 DIADLO Cc1ccc(CNc2c[nH+]c(C)c(C)c2)cc1Br ZINC001203484727 1048912965 /nfs/dbraw/zinc/91/29/65/1048912965.db2.gz CLKIQGCGQCLUFZ-UHFFFAOYSA-N 1 2 305.219 4.381 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2csnc2OC)o1 ZINC001191259039 1048899868 /nfs/dbraw/zinc/89/98/68/1048899868.db2.gz RUTVQLGETRLZMX-WFASDCNBSA-N 1 2 320.458 4.280 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2csnc2OC)o1 ZINC001191259039 1048899876 /nfs/dbraw/zinc/89/98/76/1048899876.db2.gz RUTVQLGETRLZMX-WFASDCNBSA-N 1 2 320.458 4.280 20 0 DIADLO COc1ccccc1C[N@@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC001203437735 1048901732 /nfs/dbraw/zinc/90/17/32/1048901732.db2.gz IVSRQOCOSRJSMN-UHFFFAOYSA-N 1 2 321.342 4.272 20 0 DIADLO COc1ccccc1C[N@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC001203437735 1048901739 /nfs/dbraw/zinc/90/17/39/1048901739.db2.gz IVSRQOCOSRJSMN-UHFFFAOYSA-N 1 2 321.342 4.272 20 0 DIADLO CNc1ccc(Nc2ccc(Oc3ccc(F)cc3)nc2)c[nH+]1 ZINC001203449243 1048903705 /nfs/dbraw/zinc/90/37/05/1048903705.db2.gz DGSSDRCKCSKAAF-UHFFFAOYSA-N 1 2 310.332 4.193 20 0 DIADLO CNc1ccc(Nc2cccc(NC(=O)OC(C)(C)C)c2)c[nH+]1 ZINC001203458868 1048907183 /nfs/dbraw/zinc/90/71/83/1048907183.db2.gz SEGFNNKJBZVULM-UHFFFAOYSA-N 1 2 314.389 4.214 20 0 DIADLO CNc1ccc(-n2c(-c3ccc(N)cc3)cc3ccccc32)c[nH+]1 ZINC001203457800 1048907527 /nfs/dbraw/zinc/90/75/27/1048907527.db2.gz AKDIHYDYFPRFHF-UHFFFAOYSA-N 1 2 314.392 4.316 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2cc3n(n2)CCCC3)o1 ZINC001191276915 1048914045 /nfs/dbraw/zinc/91/40/45/1048914045.db2.gz GTXCJHXMJOTPMI-KBXCAEBGSA-N 1 2 313.445 4.094 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2cc3n(n2)CCCC3)o1 ZINC001191276915 1048914058 /nfs/dbraw/zinc/91/40/58/1048914058.db2.gz GTXCJHXMJOTPMI-KBXCAEBGSA-N 1 2 313.445 4.094 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(s1)CCCC2)c1cc(F)ccc1F ZINC000776687999 1048915629 /nfs/dbraw/zinc/91/56/29/1048915629.db2.gz YMFIHDMQQGTMKO-SNVBAGLBSA-N 1 2 308.397 4.151 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3ncc(C(F)(F)F)cc3C2)c(C)c1 ZINC001203736935 1048917770 /nfs/dbraw/zinc/91/77/70/1048917770.db2.gz ZSPFGGYHVICGPK-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3ncc(C(F)(F)F)cc3C2)c(C)c1 ZINC001203736935 1048917782 /nfs/dbraw/zinc/91/77/82/1048917782.db2.gz ZSPFGGYHVICGPK-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO CC(C)CCn1c2ccccc2[nH+]c1NCc1nccn1C1CC1 ZINC001203535937 1048923376 /nfs/dbraw/zinc/92/33/76/1048923376.db2.gz AXLWYFPJFZIMLW-UHFFFAOYSA-N 1 2 323.444 4.226 20 0 DIADLO CNc1ccc(C)cc1CNc1[nH+]c2ccccc2n1C1CC1 ZINC001203536306 1048924653 /nfs/dbraw/zinc/92/46/53/1048924653.db2.gz NUQKHDHQBSTQMO-UHFFFAOYSA-N 1 2 306.413 4.333 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1F)Cc1cc(OC)ccc1OC ZINC001203531978 1048925213 /nfs/dbraw/zinc/92/52/13/1048925213.db2.gz SLBQQDSCFVMILH-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1F)Cc1cc(OC)ccc1OC ZINC001203531978 1048925224 /nfs/dbraw/zinc/92/52/24/1048925224.db2.gz SLBQQDSCFVMILH-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO FC(F)(F)c1ccc2c(cc[nH+]c2N[C@@H]2COC3(CCC3)C2)c1 ZINC000853827522 1048927557 /nfs/dbraw/zinc/92/75/57/1048927557.db2.gz AVBUKULHGAZUTE-ZDUSSCGKSA-N 1 2 322.330 4.377 20 0 DIADLO CC1(C)C[N@H+](Cc2nc(C3CC3)cs2)CC[C@@H]1C(F)(F)F ZINC000484346464 1048930164 /nfs/dbraw/zinc/93/01/64/1048930164.db2.gz RGUAIFPURIRISC-LBPRGKRZSA-N 1 2 318.408 4.431 20 0 DIADLO CC1(C)C[N@@H+](Cc2nc(C3CC3)cs2)CC[C@@H]1C(F)(F)F ZINC000484346464 1048930172 /nfs/dbraw/zinc/93/01/72/1048930172.db2.gz RGUAIFPURIRISC-LBPRGKRZSA-N 1 2 318.408 4.431 20 0 DIADLO CSc1ccc(C[NH2+][C@H](c2ccccc2)c2cccnc2)o1 ZINC001177658461 1048930975 /nfs/dbraw/zinc/93/09/75/1048930975.db2.gz VTVVXDIUAAAFAQ-GOSISDBHSA-N 1 2 310.422 4.276 20 0 DIADLO CSc1ccc(C[NH2+][C@@H](c2ccccc2)c2cccnc2)o1 ZINC001177658462 1048931345 /nfs/dbraw/zinc/93/13/45/1048931345.db2.gz VTVVXDIUAAAFAQ-SFHVURJKSA-N 1 2 310.422 4.276 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@@H+]2CC[C@H]2c2ccccc2)c1 ZINC001191391307 1048933200 /nfs/dbraw/zinc/93/32/00/1048933200.db2.gz WCYBGZYFRINMMG-HNNXBMFYSA-N 1 2 307.315 4.374 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@H+]2CC[C@H]2c2ccccc2)c1 ZINC001191391307 1048933215 /nfs/dbraw/zinc/93/32/15/1048933215.db2.gz WCYBGZYFRINMMG-HNNXBMFYSA-N 1 2 307.315 4.374 20 0 DIADLO c1oc(-c2ccccc2)nc1C[NH2+][C@H]1CSCc2ccccc21 ZINC001177779386 1048943609 /nfs/dbraw/zinc/94/36/09/1048943609.db2.gz GFYWCIOOXOTHRB-SFHVURJKSA-N 1 2 322.433 4.419 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2nc(Cl)ccc2Br)c1 ZINC001203656922 1048950368 /nfs/dbraw/zinc/95/03/68/1048950368.db2.gz CXBQBGWATCXXHB-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO O[C@H](c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1)C1CC1 ZINC000854202527 1048950912 /nfs/dbraw/zinc/95/09/12/1048950912.db2.gz HTCOWFLFKNGWMH-HXUWFJFHSA-N 1 2 304.393 4.042 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2c(N)ccc(Br)c2C)c1 ZINC001203663056 1048953235 /nfs/dbraw/zinc/95/32/35/1048953235.db2.gz HDSWVDAXTKUYPO-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(-c3ccc(N)c(O)c3)cc2O)c1 ZINC001203666751 1048954622 /nfs/dbraw/zinc/95/46/22/1048954622.db2.gz FKXRIQQBESYEQH-UHFFFAOYSA-N 1 2 321.380 4.102 20 0 DIADLO COc1ccc(C(C)=O)c(Nc2cc(C)c[nH+]c2C)c1Cl ZINC001203663230 1048954768 /nfs/dbraw/zinc/95/47/68/1048954768.db2.gz FQFDONOFMVXYEC-UHFFFAOYSA-N 1 2 304.777 4.307 20 0 DIADLO CCc1ccc(NC(=O)C[N@H+](C)Cc2cc3ccccc3o2)cc1 ZINC001191464460 1048955089 /nfs/dbraw/zinc/95/50/89/1048955089.db2.gz LPLNHPXSNDKBLE-UHFFFAOYSA-N 1 2 322.408 4.066 20 0 DIADLO CCc1ccc(NC(=O)C[N@@H+](C)Cc2cc3ccccc3o2)cc1 ZINC001191464460 1048955103 /nfs/dbraw/zinc/95/51/03/1048955103.db2.gz LPLNHPXSNDKBLE-UHFFFAOYSA-N 1 2 322.408 4.066 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(OC[C@H]3CCCO3)c(F)c2)c1 ZINC001203663645 1048955124 /nfs/dbraw/zinc/95/51/24/1048955124.db2.gz VFQUBAZUSKXSTO-OAHLLOKOSA-N 1 2 316.376 4.139 20 0 DIADLO O=C1CC[N@@H+](Cc2ccccc2C(F)(F)F)[C@@H]2CCCC[C@@H]12 ZINC001203684412 1048963619 /nfs/dbraw/zinc/96/36/19/1048963619.db2.gz VDQPPUADTSRELD-UKRRQHHQSA-N 1 2 311.347 4.039 20 0 DIADLO O=C1CC[N@H+](Cc2ccccc2C(F)(F)F)[C@@H]2CCCC[C@@H]12 ZINC001203684412 1048963632 /nfs/dbraw/zinc/96/36/32/1048963632.db2.gz VDQPPUADTSRELD-UKRRQHHQSA-N 1 2 311.347 4.039 20 0 DIADLO Cn1c2ccccc2nc1[C@@H]1CCCC[N@@H+]1Cc1ccc(F)cc1 ZINC001191682316 1048975050 /nfs/dbraw/zinc/97/50/50/1048975050.db2.gz PLQGULLPEHVOLG-IBGZPJMESA-N 1 2 323.415 4.440 20 0 DIADLO Cn1c2ccccc2nc1[C@@H]1CCCC[N@H+]1Cc1ccc(F)cc1 ZINC001191682316 1048975069 /nfs/dbraw/zinc/97/50/69/1048975069.db2.gz PLQGULLPEHVOLG-IBGZPJMESA-N 1 2 323.415 4.440 20 0 DIADLO Cc1cnn(CC2CC2)c1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718400 1048975340 /nfs/dbraw/zinc/97/53/40/1048975340.db2.gz GCQOMXLHISVBFD-UHFFFAOYSA-N 1 2 310.445 4.335 20 0 DIADLO O=C1OCc2c1cccc2Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203719263 1048975763 /nfs/dbraw/zinc/97/57/63/1048975763.db2.gz MIOJOUQTPUYQCU-UHFFFAOYSA-N 1 2 308.381 4.091 20 0 DIADLO Cc1cc(C)n2nc(Nc3ccc([NH+]4CCCCC4)cc3)cc2n1 ZINC001203717433 1048975786 /nfs/dbraw/zinc/97/57/86/1048975786.db2.gz CFHNRPXDQGHIMC-UHFFFAOYSA-N 1 2 321.428 4.080 20 0 DIADLO Oc1cc(F)c(F)cc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718843 1048976011 /nfs/dbraw/zinc/97/60/11/1048976011.db2.gz DKSDIKXEUYJRBK-UHFFFAOYSA-N 1 2 304.340 4.404 20 0 DIADLO CCc1nnc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cn21 ZINC001203718954 1048976283 /nfs/dbraw/zinc/97/62/83/1048976283.db2.gz NSUJJFPRCRGCMX-UHFFFAOYSA-N 1 2 321.428 4.026 20 0 DIADLO CCc1cc2ncc(Nc3ccc([NH+]4CCCCC4)cc3)cn2n1 ZINC001203718705 1048977072 /nfs/dbraw/zinc/97/70/72/1048977072.db2.gz LMLUYQXNXMDHOR-UHFFFAOYSA-N 1 2 321.428 4.026 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nnc[nH]1)c1ccc(C2CCCCC2)cc1 ZINC001191664006 1048978541 /nfs/dbraw/zinc/97/85/41/1048978541.db2.gz IEMWBMHAVMCDMH-IBGZPJMESA-N 1 2 312.461 4.339 20 0 DIADLO FC(F)(F)c1ncncc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203719623 1048978923 /nfs/dbraw/zinc/97/89/23/1048978923.db2.gz ZEUHMWXFABUSDE-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO Nc1ccc(-c2cnn(-c3ccc([NH+]4CCCCC4)cc3)c2)cc1 ZINC001203724125 1048979038 /nfs/dbraw/zinc/97/90/38/1048979038.db2.gz GLBREOIGONMTKJ-UHFFFAOYSA-N 1 2 318.424 4.112 20 0 DIADLO c1ncn(-c2cccc(Nc3ccc([NH+]4CCCCC4)cc3)c2)n1 ZINC001203719827 1048979768 /nfs/dbraw/zinc/97/97/68/1048979768.db2.gz USZQPHJHXWWGST-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO FC(F)(F)Cn1nccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203719432 1048980043 /nfs/dbraw/zinc/98/00/43/1048980043.db2.gz WXOVKWXAXFFYEW-UHFFFAOYSA-N 1 2 324.350 4.179 20 0 DIADLO CN(C)C(=O)c1ccccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203719686 1048980208 /nfs/dbraw/zinc/98/02/08/1048980208.db2.gz SHHMYWDBTJFAPC-UHFFFAOYSA-N 1 2 323.440 4.122 20 0 DIADLO O=C1NCc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc2N1 ZINC001203724671 1048981377 /nfs/dbraw/zinc/98/13/77/1048981377.db2.gz VTVVIISUBFMMEN-UHFFFAOYSA-N 1 2 322.412 4.056 20 0 DIADLO O=C1CCc2cccc(Nc3ccc([NH+]4CCCCC4)cc3)c2N1 ZINC001203724368 1048981618 /nfs/dbraw/zinc/98/16/18/1048981618.db2.gz KZQSHDKHDVCKSO-UHFFFAOYSA-N 1 2 321.424 4.305 20 0 DIADLO OCc1ccc(F)c(F)c1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203724437 1048981881 /nfs/dbraw/zinc/98/18/81/1048981881.db2.gz NXSKSJALJBLVFJ-UHFFFAOYSA-N 1 2 318.367 4.191 20 0 DIADLO c1cc([NH+]2CCCCC2)ccc1Nc1ccc2ncncc2c1 ZINC001203724509 1048982304 /nfs/dbraw/zinc/98/23/04/1048982304.db2.gz PJFOLGCJQAKFST-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO COc1cccc(CNc2[nH+]c3ccccc3n2CC2CC2)c1 ZINC001203739057 1048987004 /nfs/dbraw/zinc/98/70/04/1048987004.db2.gz CUOCZNDMXPCVKD-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO Cc1ccc(C[N@@H+]2Cc3cnc(-c4ccccc4)nc3C2)c(C)c1 ZINC001203738998 1048987341 /nfs/dbraw/zinc/98/73/41/1048987341.db2.gz CRAWKSKJOCSVNZ-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1ccc(C[N@H+]2Cc3cnc(-c4ccccc4)nc3C2)c(C)c1 ZINC001203738998 1048987346 /nfs/dbraw/zinc/98/73/46/1048987346.db2.gz CRAWKSKJOCSVNZ-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@@H+]2Cc2cccnc2Cl)cc1 ZINC000112635917 1048989193 /nfs/dbraw/zinc/98/91/93/1048989193.db2.gz FVNGBLJRTAHUTO-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@H+]2Cc2cccnc2Cl)cc1 ZINC000112635917 1048989203 /nfs/dbraw/zinc/98/92/03/1048989203.db2.gz FVNGBLJRTAHUTO-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1[nH+]cc(CNc2ccc(C(C)C)nc2)n1-c1ccccc1 ZINC001203770782 1048994030 /nfs/dbraw/zinc/99/40/30/1048994030.db2.gz IRBTWYYATSQWIB-UHFFFAOYSA-N 1 2 306.413 4.311 20 0 DIADLO C[C@@]1(c2ccc(F)cc2)C[N@H+](Cc2cccc(Cl)c2)CCO1 ZINC001203801180 1048998947 /nfs/dbraw/zinc/99/89/47/1048998947.db2.gz MEJXELWBPKLEFO-SFHVURJKSA-N 1 2 319.807 4.227 20 0 DIADLO C[C@@]1(c2ccc(F)cc2)C[N@@H+](Cc2cccc(Cl)c2)CCO1 ZINC001203801180 1048998960 /nfs/dbraw/zinc/99/89/60/1048998960.db2.gz MEJXELWBPKLEFO-SFHVURJKSA-N 1 2 319.807 4.227 20 0 DIADLO C[NH+](C)[C@@H](c1nc(-c2ccccc2)no1)c1ccc(Cl)cc1 ZINC000904238284 1049005800 /nfs/dbraw/zinc/00/58/00/1049005800.db2.gz KAMOFAMZAQCKNE-OAHLLOKOSA-N 1 2 313.788 4.041 20 0 DIADLO CC(C)C[C@H]1CCCC[N@@H+]1Cc1ncsc1Br ZINC001191899552 1049014757 /nfs/dbraw/zinc/01/47/57/1049014757.db2.gz MFFGUVCNYIYJKH-LLVKDONJSA-N 1 2 317.296 4.306 20 0 DIADLO CC(C)C[C@H]1CCCC[N@H+]1Cc1ncsc1Br ZINC001191899552 1049014771 /nfs/dbraw/zinc/01/47/71/1049014771.db2.gz MFFGUVCNYIYJKH-LLVKDONJSA-N 1 2 317.296 4.306 20 0 DIADLO C[NH+](C)[C@@H](c1nc(-c2cccs2)no1)c1ccc(Cl)cc1 ZINC000904279433 1049017905 /nfs/dbraw/zinc/01/79/05/1049017905.db2.gz PKNHPZADTACODH-CYBMUJFWSA-N 1 2 319.817 4.103 20 0 DIADLO Cc1cc(C)c2c(c1)N(Cc1ccc(-n3cc[nH+]c3)cc1)CCC2 ZINC001191946925 1049020376 /nfs/dbraw/zinc/02/03/76/1049020376.db2.gz BCKZMXMAJGNBKT-UHFFFAOYSA-N 1 2 317.436 4.442 20 0 DIADLO C[C@H](Cc1nc(-c2c(Cl)cccc2Cl)no1)n1cc[nH+]c1 ZINC000904305762 1049025724 /nfs/dbraw/zinc/02/57/24/1049025724.db2.gz HZYWJWMOHNQBDP-SECBINFHSA-N 1 2 323.183 4.044 20 0 DIADLO COc1ccnc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)c1 ZINC000484798612 1049038460 /nfs/dbraw/zinc/03/84/60/1049038460.db2.gz PHFDFIPSEFRELT-UHFFFAOYSA-N 1 2 324.346 4.045 20 0 DIADLO COc1ccnc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)c1 ZINC000484798612 1049038474 /nfs/dbraw/zinc/03/84/74/1049038474.db2.gz PHFDFIPSEFRELT-UHFFFAOYSA-N 1 2 324.346 4.045 20 0 DIADLO COc1ccc(CC[C@H](C)Nc2c[nH+]c3c(c2)CCCC3)cc1 ZINC001178473012 1049043171 /nfs/dbraw/zinc/04/31/71/1049043171.db2.gz LLGQADYDRCNZMB-HNNXBMFYSA-N 1 2 310.441 4.402 20 0 DIADLO COc1ccc2ccccc2c1C[N@@H+]1CCC(F)(F)[C@H](F)C1 ZINC001203987448 1049051402 /nfs/dbraw/zinc/05/14/02/1049051402.db2.gz XRFSEIIPWAPKKX-MRXNPFEDSA-N 1 2 309.331 4.028 20 0 DIADLO COc1ccc2ccccc2c1C[N@H+]1CCC(F)(F)[C@H](F)C1 ZINC001203987448 1049051417 /nfs/dbraw/zinc/05/14/17/1049051417.db2.gz XRFSEIIPWAPKKX-MRXNPFEDSA-N 1 2 309.331 4.028 20 0 DIADLO COc1ccc2ccccc2c1C[N@H+](C)CC(=O)c1ccccc1 ZINC001203991187 1049054501 /nfs/dbraw/zinc/05/45/01/1049054501.db2.gz MXWQCEOFDNHREO-UHFFFAOYSA-N 1 2 319.404 4.163 20 0 DIADLO COc1ccc2ccccc2c1C[N@@H+](C)CC(=O)c1ccccc1 ZINC001203991187 1049054515 /nfs/dbraw/zinc/05/45/15/1049054515.db2.gz MXWQCEOFDNHREO-UHFFFAOYSA-N 1 2 319.404 4.163 20 0 DIADLO CC(C)c1ccccc1NC(=O)Nc1cc[nH+]c(N2CCCC2)c1 ZINC001192226174 1049065213 /nfs/dbraw/zinc/06/52/13/1049065213.db2.gz FCRMAUWWELJTHY-UHFFFAOYSA-N 1 2 324.428 4.449 20 0 DIADLO FC(F)(C[NH2+]Cc1cccc2n[nH]cc21)c1ccc(Cl)cc1 ZINC001178666909 1049073081 /nfs/dbraw/zinc/07/30/81/1049073081.db2.gz JXLOOTQHQYWQHM-UHFFFAOYSA-N 1 2 321.758 4.098 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@H+]1Cc1cncc(Cl)c1 ZINC001192301870 1049082029 /nfs/dbraw/zinc/08/20/29/1049082029.db2.gz CWGOTUBBVXYXTD-NWDGAFQWSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@@H+]1Cc1cncc(Cl)c1 ZINC001192301870 1049082039 /nfs/dbraw/zinc/08/20/39/1049082039.db2.gz CWGOTUBBVXYXTD-NWDGAFQWSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@H](c1nc(-c2cccs2)no1)[N@@H+]1CC[C@H]1c1ccccc1 ZINC000484926755 1049086788 /nfs/dbraw/zinc/08/67/88/1049086788.db2.gz MIYTVPSTZXTJKM-OCCSQVGLSA-N 1 2 311.410 4.306 20 0 DIADLO C[C@H](c1nc(-c2cccs2)no1)[N@H+]1CC[C@H]1c1ccccc1 ZINC000484926755 1049086802 /nfs/dbraw/zinc/08/68/02/1049086802.db2.gz MIYTVPSTZXTJKM-OCCSQVGLSA-N 1 2 311.410 4.306 20 0 DIADLO Cc1cc(NC(=O)Nc2cccc(Cn3cc[nH+]c3)c2)ccc1F ZINC001192392168 1049098122 /nfs/dbraw/zinc/09/81/22/1049098122.db2.gz UXZIQSQSIGXCCN-UHFFFAOYSA-N 1 2 324.359 4.023 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc(-c3ccccc3)c[nH]2)cc1F ZINC001192412037 1049101087 /nfs/dbraw/zinc/10/10/87/1049101087.db2.gz GESJQQFYJXYOEG-UHFFFAOYSA-N 1 2 309.388 4.156 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc(-c3ccccc3)c[nH]2)cc1F ZINC001192412037 1049101096 /nfs/dbraw/zinc/10/10/96/1049101096.db2.gz GESJQQFYJXYOEG-UHFFFAOYSA-N 1 2 309.388 4.156 20 0 DIADLO C[C@H]([NH2+]Cc1cn(C)nc1Cl)c1ccc(Cl)cc1Cl ZINC000856763580 1049102582 /nfs/dbraw/zinc/10/25/82/1049102582.db2.gz DJTFCIHQHFMZDO-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO COC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccc(C(C)C)cc1)C2 ZINC001204168206 1049103041 /nfs/dbraw/zinc/10/30/41/1049103041.db2.gz KHNLCUPYRLZLDY-UHFFFAOYSA-N 1 2 309.409 4.112 20 0 DIADLO COC(=O)c1ccc2c(c1)C[N@H+](Cc1ccc(C(C)C)cc1)C2 ZINC001204168206 1049103049 /nfs/dbraw/zinc/10/30/49/1049103049.db2.gz KHNLCUPYRLZLDY-UHFFFAOYSA-N 1 2 309.409 4.112 20 0 DIADLO C[C@H]([NH2+]Cc1cn(C)nc1Cl)c1cccc(Cl)c1Cl ZINC000856770153 1049104548 /nfs/dbraw/zinc/10/45/48/1049104548.db2.gz NLKPZENMRXCNMZ-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC001192585416 1049120448 /nfs/dbraw/zinc/12/04/48/1049120448.db2.gz UUNFSJHCSUAUJZ-CZUORRHYSA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC001192585416 1049120456 /nfs/dbraw/zinc/12/04/56/1049120456.db2.gz UUNFSJHCSUAUJZ-CZUORRHYSA-N 1 2 321.848 4.066 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccccc2Cl)c(OC)c1C ZINC001204261805 1049123407 /nfs/dbraw/zinc/12/34/07/1049123407.db2.gz FQMQWMBGRRHLSV-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccccc2Cl)c(OC)c1C ZINC001204261805 1049123410 /nfs/dbraw/zinc/12/34/10/1049123410.db2.gz FQMQWMBGRRHLSV-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO COc1cc(Cl)c(CNc2cc3cc[nH]c3c[nH+]2)cc1Cl ZINC001179044937 1049123997 /nfs/dbraw/zinc/12/39/97/1049123997.db2.gz VOSAHYSHXDTYRB-UHFFFAOYSA-N 1 2 322.195 4.490 20 0 DIADLO Cc1[nH]c2ccccc2c1C[N@@H+]1CCOC[C@H]1c1ccc(F)cc1 ZINC001204296471 1049130012 /nfs/dbraw/zinc/13/00/12/1049130012.db2.gz ACFTVRCKQXSZFN-FQEVSTJZSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1[nH]c2ccccc2c1C[N@H+]1CCOC[C@H]1c1ccc(F)cc1 ZINC001204296471 1049130018 /nfs/dbraw/zinc/13/00/18/1049130018.db2.gz ACFTVRCKQXSZFN-FQEVSTJZSA-N 1 2 324.399 4.189 20 0 DIADLO CC(C)([NH2+]Cc1noc2c1CC(C)(C)CC2)c1cccc(F)c1 ZINC001192690081 1049131017 /nfs/dbraw/zinc/13/10/17/1049131017.db2.gz OYSZUUBHPONZEC-UHFFFAOYSA-N 1 2 316.420 4.354 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1c(F)ccc(C)c1F ZINC001192662598 1049131857 /nfs/dbraw/zinc/13/18/57/1049131857.db2.gz PTZGWWJDHOLSHG-LLVKDONJSA-N 1 2 309.331 4.272 20 0 DIADLO c1[nH]nc2c1cccc2CNc1ccc(Nc2ccccc2)c[nH+]1 ZINC001179205348 1049141324 /nfs/dbraw/zinc/14/13/24/1049141324.db2.gz MCCGJJCEPUKZGW-UHFFFAOYSA-N 1 2 315.380 4.314 20 0 DIADLO CCn1c[nH+]cc1CN1CCc2cc(Cl)cc(Cl)c2[C@@H]1C ZINC001204334062 1049144675 /nfs/dbraw/zinc/14/46/75/1049144675.db2.gz GDIBEJSAMNLMDW-NSHDSACASA-N 1 2 324.255 4.329 20 0 DIADLO CC(C)(C)CCO[C@@H]1CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC001224725747 1049147713 /nfs/dbraw/zinc/14/77/13/1049147713.db2.gz WYMBHYQNWGUYLL-GFCCVEGCSA-N 1 2 316.898 4.214 20 0 DIADLO CC(C)(C)CCO[C@@H]1CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC001224725747 1049147722 /nfs/dbraw/zinc/14/77/22/1049147722.db2.gz WYMBHYQNWGUYLL-GFCCVEGCSA-N 1 2 316.898 4.214 20 0 DIADLO Cc1ccccc1C(F)(F)C[NH2+]Cc1ccc2c(c1)CCC2 ZINC001179247590 1049147724 /nfs/dbraw/zinc/14/77/24/1049147724.db2.gz HPYCEOBDPSAZEV-UHFFFAOYSA-N 1 2 301.380 4.365 20 0 DIADLO Fc1ccc(C(F)(F)C[NH2+]Cc2cccc3c2CCC3)cc1 ZINC001179247618 1049147812 /nfs/dbraw/zinc/14/78/12/1049147812.db2.gz ILIYCAHGSOWYQV-UHFFFAOYSA-N 1 2 305.343 4.196 20 0 DIADLO Cc1ccc(C[N@@H+]2Cc3cnc(-c4ccccc4)nc3C2)cc1C ZINC001204355326 1049148940 /nfs/dbraw/zinc/14/89/40/1049148940.db2.gz KCWWAEYZOUDZMK-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1ccc(C[N@H+]2Cc3cnc(-c4ccccc4)nc3C2)cc1C ZINC001204355326 1049148948 /nfs/dbraw/zinc/14/89/48/1049148948.db2.gz KCWWAEYZOUDZMK-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@H+]1Cc1cccc2ncccc12 ZINC001192948102 1049150340 /nfs/dbraw/zinc/15/03/40/1049150340.db2.gz VCDGBWWHUVGWFD-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@@H+]1Cc1cccc2ncccc12 ZINC001192948102 1049150348 /nfs/dbraw/zinc/15/03/48/1049150348.db2.gz VCDGBWWHUVGWFD-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2nccn2-c2ccccc2)o1 ZINC001179370045 1049161165 /nfs/dbraw/zinc/16/11/65/1049161165.db2.gz PVWXDDKONNDCCW-UHFFFAOYSA-N 1 2 309.413 4.053 20 0 DIADLO Fc1ccc(C[N@@H+]2CC[C@H]2COCc2ccccc2)c(Cl)c1 ZINC001204436453 1049162026 /nfs/dbraw/zinc/16/20/26/1049162026.db2.gz GZHIVANHEKAOOY-KRWDZBQOSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1ccc(C[N@H+]2CC[C@H]2COCc2ccccc2)c(Cl)c1 ZINC001204436453 1049162030 /nfs/dbraw/zinc/16/20/30/1049162030.db2.gz GZHIVANHEKAOOY-KRWDZBQOSA-N 1 2 319.807 4.270 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1noc2ccc(F)cc21 ZINC001179391268 1049162069 /nfs/dbraw/zinc/16/20/69/1049162069.db2.gz QNZAAPQRFKCBFB-UHFFFAOYSA-N 1 2 318.779 4.473 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1c(F)cccc1C(F)(F)F ZINC001204465382 1049169067 /nfs/dbraw/zinc/16/90/67/1049169067.db2.gz IKSGEHOZDFBFAB-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1c(F)cccc1C(F)(F)F ZINC001204465382 1049169072 /nfs/dbraw/zinc/16/90/72/1049169072.db2.gz IKSGEHOZDFBFAB-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1ccc(C(F)(F)F)cc1F ZINC001204469641 1049170407 /nfs/dbraw/zinc/17/04/07/1049170407.db2.gz QESQXZMPCUFFRJ-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1ccc(C(F)(F)F)cc1F ZINC001204469641 1049170411 /nfs/dbraw/zinc/17/04/11/1049170411.db2.gz QESQXZMPCUFFRJ-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1cccc(O)c1 ZINC001179484777 1049170958 /nfs/dbraw/zinc/17/09/58/1049170958.db2.gz RCQCBCIENCHSHO-UHFFFAOYSA-N 1 2 301.777 4.027 20 0 DIADLO C[C@H]1C[NH+](Cc2cccc(F)c2OC(F)(F)F)C[C@H](C)S1 ZINC001204489726 1049173814 /nfs/dbraw/zinc/17/38/14/1049173814.db2.gz WWWCKBPZDCSPNP-UWVGGRQHSA-N 1 2 323.355 4.050 20 0 DIADLO COc1cccc2[nH]c(NCc3cccc(Cl)c3Cl)[nH+]c21 ZINC001179494400 1049173880 /nfs/dbraw/zinc/17/38/80/1049173880.db2.gz QLHZDPSOMBZUBP-UHFFFAOYSA-N 1 2 322.195 4.490 20 0 DIADLO Fc1ccc(Br)cc1C[N@H+]1CCC[C@@H](C(F)F)C1 ZINC001204496787 1049176465 /nfs/dbraw/zinc/17/64/65/1049176465.db2.gz PYJAWUWLCRZYRZ-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO Fc1ccc(Br)cc1C[N@@H+]1CCC[C@@H](C(F)F)C1 ZINC001204496787 1049176473 /nfs/dbraw/zinc/17/64/73/1049176473.db2.gz PYJAWUWLCRZYRZ-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO Cc1cc(C)cc(C[N@@H+]2Cc3cnc(-c4ccccc4)nc3C2)c1 ZINC001204523630 1049180149 /nfs/dbraw/zinc/18/01/49/1049180149.db2.gz BTDVZMLGGZOQJH-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1cc(C)cc(C[N@H+]2Cc3cnc(-c4ccccc4)nc3C2)c1 ZINC001204523630 1049180158 /nfs/dbraw/zinc/18/01/58/1049180158.db2.gz BTDVZMLGGZOQJH-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1ccc([C@@H]2CCCCN2C(=O)c2cccc3[nH+]ccn32)cc1 ZINC000776952829 1049184917 /nfs/dbraw/zinc/18/49/17/1049184917.db2.gz CHEOTTHIWVFVNF-KRWDZBQOSA-N 1 2 319.408 4.010 20 0 DIADLO Fc1ccc(Br)c2c1C[N@@H+]([C@@H]1C=CCCC1)CC2 ZINC001193187718 1049190520 /nfs/dbraw/zinc/19/05/20/1049190520.db2.gz GCMFQVYAGMOKRX-LLVKDONJSA-N 1 2 310.210 4.055 20 0 DIADLO Fc1ccc(Br)c2c1C[N@H+]([C@@H]1C=CCCC1)CC2 ZINC001193187718 1049190530 /nfs/dbraw/zinc/19/05/30/1049190530.db2.gz GCMFQVYAGMOKRX-LLVKDONJSA-N 1 2 310.210 4.055 20 0 DIADLO Fc1cc(Br)cc([C@H]2CCC[N@@H+]2C/C=C\Cl)c1 ZINC001193189174 1049190905 /nfs/dbraw/zinc/19/09/05/1049190905.db2.gz XARZUIRZVNYCEC-QDOCKXBDSA-N 1 2 318.617 4.478 20 0 DIADLO Fc1cc(Br)cc([C@H]2CCC[N@H+]2C/C=C\Cl)c1 ZINC001193189174 1049190911 /nfs/dbraw/zinc/19/09/11/1049190911.db2.gz XARZUIRZVNYCEC-QDOCKXBDSA-N 1 2 318.617 4.478 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1scnc1Cl)[C@@H]2C ZINC001193271891 1049191945 /nfs/dbraw/zinc/19/19/45/1049191945.db2.gz BWTASLIJELQRGE-WDEREUQCSA-N 1 2 322.861 4.313 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1scnc1Cl)[C@@H]2C ZINC001193271891 1049191954 /nfs/dbraw/zinc/19/19/54/1049191954.db2.gz BWTASLIJELQRGE-WDEREUQCSA-N 1 2 322.861 4.313 20 0 DIADLO Cc1[nH+]c[nH]c1CN(C)Cc1sc2ccccc2c1Cl ZINC001204590412 1049194891 /nfs/dbraw/zinc/19/48/91/1049194891.db2.gz PJBVFXOJRIOZJJ-UHFFFAOYSA-N 1 2 305.834 4.218 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1cccc(F)c1OC(F)F)CC2 ZINC001193354885 1049201740 /nfs/dbraw/zinc/20/17/40/1049201740.db2.gz ILVZIHKZEFIFQF-UHFFFAOYSA-N 1 2 321.342 4.294 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1cccc(F)c1OC(F)F)CC2 ZINC001193354885 1049201752 /nfs/dbraw/zinc/20/17/52/1049201752.db2.gz ILVZIHKZEFIFQF-UHFFFAOYSA-N 1 2 321.342 4.294 20 0 DIADLO CCn1c2cc(Br)ccc2[nH+]c1NCC1(C)CC1 ZINC001179809917 1049209181 /nfs/dbraw/zinc/20/91/81/1049209181.db2.gz IFVNIDVMLCXQKH-UHFFFAOYSA-N 1 2 308.223 4.031 20 0 DIADLO Clc1ccc2c(n1)[C@H](Nc1ccc([NH+]3CCCC3)cc1)CC2 ZINC000857909262 1049209435 /nfs/dbraw/zinc/20/94/35/1049209435.db2.gz OUZSCIUARWSDBI-MRXNPFEDSA-N 1 2 313.832 4.435 20 0 DIADLO Clc1ccc2c(n1)[C@@H](Nc1ccc([NH+]3CCCC3)cc1)CC2 ZINC000857909261 1049209796 /nfs/dbraw/zinc/20/97/96/1049209796.db2.gz OUZSCIUARWSDBI-INIZCTEOSA-N 1 2 313.832 4.435 20 0 DIADLO CCC[C@@H]1CCCC[C@H]1CNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001204649149 1049211246 /nfs/dbraw/zinc/21/12/46/1049211246.db2.gz RSIGTXGJAHPYNJ-CABCVRRESA-N 1 2 314.433 4.062 20 0 DIADLO CCCCCC[C@](C)(CCC)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857982866 1049212824 /nfs/dbraw/zinc/21/28/24/1049212824.db2.gz NEIVSMQMNSYAOR-YJBOKZPZSA-N 1 2 305.466 4.221 20 0 DIADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001204695554 1049229739 /nfs/dbraw/zinc/22/97/39/1049229739.db2.gz UCJLDEXEXSOCSY-GFCCVEGCSA-N 1 2 303.789 4.153 20 0 DIADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001204695554 1049229750 /nfs/dbraw/zinc/22/97/50/1049229750.db2.gz UCJLDEXEXSOCSY-GFCCVEGCSA-N 1 2 303.789 4.153 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CCC1=O ZINC001204695754 1049230282 /nfs/dbraw/zinc/23/02/82/1049230282.db2.gz ZSKFEVFPDQCIDC-GFCCVEGCSA-N 1 2 303.789 4.011 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CCC1=O ZINC001204695754 1049230293 /nfs/dbraw/zinc/23/02/93/1049230293.db2.gz ZSKFEVFPDQCIDC-GFCCVEGCSA-N 1 2 303.789 4.011 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+](Cc1ccc(F)cc1)C(C)C ZINC001204696632 1049230899 /nfs/dbraw/zinc/23/08/99/1049230899.db2.gz CMWOAXHSMNUYRZ-UHFFFAOYSA-N 1 2 309.816 4.106 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC001204696632 1049230907 /nfs/dbraw/zinc/23/09/07/1049230907.db2.gz CMWOAXHSMNUYRZ-UHFFFAOYSA-N 1 2 309.816 4.106 20 0 DIADLO Oc1ccc(C2=CC[N@H+](Cc3ccc(F)c(F)c3F)CC2)cc1 ZINC001179946290 1049235949 /nfs/dbraw/zinc/23/59/49/1049235949.db2.gz OOZJBFFKFHPQIZ-UHFFFAOYSA-N 1 2 319.326 4.099 20 0 DIADLO Oc1ccc(C2=CC[N@@H+](Cc3ccc(F)c(F)c3F)CC2)cc1 ZINC001179946290 1049235959 /nfs/dbraw/zinc/23/59/59/1049235959.db2.gz OOZJBFFKFHPQIZ-UHFFFAOYSA-N 1 2 319.326 4.099 20 0 DIADLO CC[N@H+](Cc1c(C2CCC2)cnn1C)Cc1ccccc1Cl ZINC001179909749 1049237579 /nfs/dbraw/zinc/23/75/79/1049237579.db2.gz UBTQODDHKAKOBG-UHFFFAOYSA-N 1 2 317.864 4.363 20 0 DIADLO CC[N@@H+](Cc1c(C2CCC2)cnn1C)Cc1ccccc1Cl ZINC001179909749 1049237588 /nfs/dbraw/zinc/23/75/88/1049237588.db2.gz UBTQODDHKAKOBG-UHFFFAOYSA-N 1 2 317.864 4.363 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1cccnc1N ZINC001204721164 1049239999 /nfs/dbraw/zinc/23/99/99/1049239999.db2.gz JGOYEPWOXXVHIQ-SNVBAGLBSA-N 1 2 310.228 4.164 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1cccnc1N ZINC001204721164 1049240010 /nfs/dbraw/zinc/24/00/10/1049240010.db2.gz JGOYEPWOXXVHIQ-SNVBAGLBSA-N 1 2 310.228 4.164 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+]3C[C@@H](C)OC[C@H]3C)s2)cc1C ZINC001179993529 1049246393 /nfs/dbraw/zinc/24/63/93/1049246393.db2.gz LYAKQUNXWCMMDW-HUUCEWRRSA-N 1 2 316.470 4.036 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+]3C[C@@H](C)OC[C@H]3C)s2)cc1C ZINC001179993529 1049246404 /nfs/dbraw/zinc/24/64/04/1049246404.db2.gz LYAKQUNXWCMMDW-HUUCEWRRSA-N 1 2 316.470 4.036 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2ccn(CC)n2)o1 ZINC001179961134 1049251501 /nfs/dbraw/zinc/25/15/01/1049251501.db2.gz AOAYCNSFHUCNPZ-RHSMWYFYSA-N 1 2 301.434 4.032 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2ccn(CC)n2)o1 ZINC001179961134 1049251515 /nfs/dbraw/zinc/25/15/15/1049251515.db2.gz AOAYCNSFHUCNPZ-RHSMWYFYSA-N 1 2 301.434 4.032 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2ccn(CC)n2)o1 ZINC001179961136 1049251832 /nfs/dbraw/zinc/25/18/32/1049251832.db2.gz AOAYCNSFHUCNPZ-YOEHRIQHSA-N 1 2 301.434 4.032 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2ccn(CC)n2)o1 ZINC001179961136 1049251841 /nfs/dbraw/zinc/25/18/41/1049251841.db2.gz AOAYCNSFHUCNPZ-YOEHRIQHSA-N 1 2 301.434 4.032 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(F)c(Cl)c2Cl)CCS1 ZINC001204769285 1049258386 /nfs/dbraw/zinc/25/83/86/1049258386.db2.gz RBLLFRTXIQLLGJ-UHFFFAOYSA-N 1 2 308.249 4.460 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(F)c(Cl)c2Cl)CCS1 ZINC001204769285 1049258397 /nfs/dbraw/zinc/25/83/97/1049258397.db2.gz RBLLFRTXIQLLGJ-UHFFFAOYSA-N 1 2 308.249 4.460 20 0 DIADLO CCCOc1ccc(-c2cn3cc[nH+]c3cc2OC)cc1Cl ZINC001204794525 1049265430 /nfs/dbraw/zinc/26/54/30/1049265430.db2.gz NRRFYKQSOODIEU-UHFFFAOYSA-N 1 2 316.788 4.452 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[N@H+](C)Cc1ncccc1F ZINC001204790474 1049265752 /nfs/dbraw/zinc/26/57/52/1049265752.db2.gz LLPITYZKBHVZJM-GFCCVEGCSA-N 1 2 307.438 4.302 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)Cc1ncccc1F ZINC001204790474 1049265762 /nfs/dbraw/zinc/26/57/62/1049265762.db2.gz LLPITYZKBHVZJM-GFCCVEGCSA-N 1 2 307.438 4.302 20 0 DIADLO C[C@@H]1C[N@H+](C/C=C\c2cccc(F)c2)C[C@H](c2ccsc2)O1 ZINC001180076304 1049274247 /nfs/dbraw/zinc/27/42/47/1049274247.db2.gz DMUZICPPCWEHEV-MSAFKSEASA-N 1 2 317.429 4.362 20 0 DIADLO C[C@@H]1C[N@@H+](C/C=C\c2cccc(F)c2)C[C@H](c2ccsc2)O1 ZINC001180076304 1049274260 /nfs/dbraw/zinc/27/42/60/1049274260.db2.gz DMUZICPPCWEHEV-MSAFKSEASA-N 1 2 317.429 4.362 20 0 DIADLO COc1cnc(F)c(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)c1 ZINC001180129361 1049277716 /nfs/dbraw/zinc/27/77/16/1049277716.db2.gz PIYQDZYBUGPAGI-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cnc(F)c(C[N@H+]2CCC[C@H]2c2ccccc2Cl)c1 ZINC001180129361 1049277728 /nfs/dbraw/zinc/27/77/28/1049277728.db2.gz PIYQDZYBUGPAGI-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC[N@H+](Cc1c(Cl)n[nH]c1C1CC1)[C@@H](C)c1cccc(O)c1 ZINC001204827330 1049278990 /nfs/dbraw/zinc/27/89/90/1049278990.db2.gz SNKQEMMORCEXEE-NSHDSACASA-N 1 2 319.836 4.229 20 0 DIADLO CC[N@@H+](Cc1c(Cl)n[nH]c1C1CC1)[C@@H](C)c1cccc(O)c1 ZINC001204827330 1049279003 /nfs/dbraw/zinc/27/90/03/1049279003.db2.gz SNKQEMMORCEXEE-NSHDSACASA-N 1 2 319.836 4.229 20 0 DIADLO Clc1ccc(Cl)c(CCSCCn2cc[nH+]c2)c1 ZINC000485577665 1049280041 /nfs/dbraw/zinc/28/00/41/1049280041.db2.gz KVUNXHYYVZRROK-UHFFFAOYSA-N 1 2 301.242 4.166 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@@H+]2CCC[C@H](c3ccn[nH]3)C2)cc1C ZINC001204840654 1049282995 /nfs/dbraw/zinc/28/29/95/1049282995.db2.gz NNCIDBFRKNWUBC-UTSMFGRCSA-N 1 2 309.457 4.228 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@H+]2CCC[C@H](c3ccn[nH]3)C2)cc1C ZINC001204840654 1049283005 /nfs/dbraw/zinc/28/30/05/1049283005.db2.gz NNCIDBFRKNWUBC-UTSMFGRCSA-N 1 2 309.457 4.228 20 0 DIADLO CCCC[C@@H](CC)COC(=O)NCc1c[nH+]c2ccc(C)cn12 ZINC001193977377 1049292073 /nfs/dbraw/zinc/29/20/73/1049292073.db2.gz WFHQZJYGMOHNBS-OAHLLOKOSA-N 1 2 317.433 4.085 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC001180203059 1049307775 /nfs/dbraw/zinc/30/77/75/1049307775.db2.gz IPDPZUCXNLONQX-MRXNPFEDSA-N 1 2 303.837 4.489 20 0 DIADLO Cc1c[nH]c(C[N@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC001180203059 1049307783 /nfs/dbraw/zinc/30/77/83/1049307783.db2.gz IPDPZUCXNLONQX-MRXNPFEDSA-N 1 2 303.837 4.489 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1cc(Cl)n(C)n1 ZINC000859052081 1049307737 /nfs/dbraw/zinc/30/77/37/1049307737.db2.gz UFJBOBADGXSKPJ-LLVKDONJSA-N 1 2 303.793 4.013 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1cc(Cl)n(C)n1 ZINC000859052081 1049307745 /nfs/dbraw/zinc/30/77/45/1049307745.db2.gz UFJBOBADGXSKPJ-LLVKDONJSA-N 1 2 303.793 4.013 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2cc(C)cc(C)n2)c2ccccn2)cc1 ZINC001194051869 1049308911 /nfs/dbraw/zinc/30/89/11/1049308911.db2.gz KADFZMARCVCHQB-OAQYLSRUSA-N 1 2 317.436 4.281 20 0 DIADLO CC[N@H+](Cc1ccnc(F)c1)Cc1ccccc1Br ZINC000859098093 1049311619 /nfs/dbraw/zinc/31/16/19/1049311619.db2.gz YYZVCQDAHJUINR-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1ccnc(F)c1)Cc1ccccc1Br ZINC000859098093 1049311626 /nfs/dbraw/zinc/31/16/26/1049311626.db2.gz YYZVCQDAHJUINR-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c(F)c1 ZINC001204941189 1049317445 /nfs/dbraw/zinc/31/74/45/1049317445.db2.gz FMYRKIUZAPBUCN-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)c(F)c1 ZINC001204941189 1049317455 /nfs/dbraw/zinc/31/74/55/1049317455.db2.gz FMYRKIUZAPBUCN-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c(F)c1 ZINC001204941127 1049317509 /nfs/dbraw/zinc/31/75/09/1049317509.db2.gz BUKKZIINPHAXEV-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)c(F)c1 ZINC001204941127 1049317520 /nfs/dbraw/zinc/31/75/20/1049317520.db2.gz BUKKZIINPHAXEV-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2nccn2-c2ccccc2)c1 ZINC001194083140 1049317900 /nfs/dbraw/zinc/31/79/00/1049317900.db2.gz PVHYQBKYCVUXMU-UHFFFAOYSA-N 1 2 305.425 4.121 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2nccn2-c2ccccc2)c1 ZINC001194083140 1049317910 /nfs/dbraw/zinc/31/79/10/1049317910.db2.gz PVHYQBKYCVUXMU-UHFFFAOYSA-N 1 2 305.425 4.121 20 0 DIADLO CC[N@H+](Cc1ccc(OC)cc1F)Cc1cccc(F)c1F ZINC001204941530 1049318060 /nfs/dbraw/zinc/31/80/60/1049318060.db2.gz RICYGEZINITOCW-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)cc1F)Cc1cccc(F)c1F ZINC001204941530 1049318073 /nfs/dbraw/zinc/31/80/73/1049318073.db2.gz RICYGEZINITOCW-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC(C)(C)n1nc(C2CCC2)cc1Nc1ccn2cc[nH+]c2c1 ZINC001204951092 1049320363 /nfs/dbraw/zinc/32/03/63/1049320363.db2.gz NFUKYSDNKNXOJG-UHFFFAOYSA-N 1 2 309.417 4.297 20 0 DIADLO FC(F)(F)c1cc(Cl)c(Nc2ccn3cc[nH+]c3c2)cn1 ZINC001204959657 1049322616 /nfs/dbraw/zinc/32/26/16/1049322616.db2.gz SFUGAFXLDLSJAF-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)n(C)n1)c1cc(Cl)ccc1Cl ZINC000859227516 1049322820 /nfs/dbraw/zinc/32/28/20/1049322820.db2.gz HVJOTBGBEWREAV-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)n(C)n1)c1cccc(Cl)c1Cl ZINC000859233458 1049324797 /nfs/dbraw/zinc/32/47/97/1049324797.db2.gz GXATZNGHONPKTI-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO COc1cc(Nc2ccn3cc[nH+]c3c2)cc(C(F)(F)F)c1 ZINC001204978321 1049327883 /nfs/dbraw/zinc/32/78/83/1049327883.db2.gz SHMMYWVXZPZNMO-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO c1cn2ccc(Nc3cccc(CCc4ccccn4)c3)cc2[nH+]1 ZINC001204977735 1049328935 /nfs/dbraw/zinc/32/89/35/1049328935.db2.gz JZWAYPQIVHJRTH-UHFFFAOYSA-N 1 2 314.392 4.258 20 0 DIADLO Nc1ccc2c(c1)Cc1cc(Nc3ccn4cc[nH+]c4c3)ccc1-2 ZINC001204982688 1049330208 /nfs/dbraw/zinc/33/02/08/1049330208.db2.gz FFFPNOCYWUOEAM-UHFFFAOYSA-N 1 2 312.376 4.231 20 0 DIADLO Clc1nc2ccc(Nc3ccn4cc[nH+]c4c3)cc2s1 ZINC001204982681 1049331294 /nfs/dbraw/zinc/33/12/94/1049331294.db2.gz DYEGSDTUCCYPGK-UHFFFAOYSA-N 1 2 300.774 4.341 20 0 DIADLO Cc1cc(Nc2ccn3cc[nH+]c3c2)ccc1Br ZINC001204983408 1049331532 /nfs/dbraw/zinc/33/15/32/1049331532.db2.gz UXTIMNAQJWJNPZ-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccc(F)cc2OC(C)C)c1C ZINC001204993029 1049333248 /nfs/dbraw/zinc/33/32/48/1049333248.db2.gz SEJTUARZWVRCSA-UHFFFAOYSA-N 1 2 318.392 4.245 20 0 DIADLO Oc1ccc(-c2cccc(Nc3ccn4cc[nH+]c4c3)c2)cc1 ZINC001204998117 1049334940 /nfs/dbraw/zinc/33/49/40/1049334940.db2.gz USLXCVMTXXDVMP-UHFFFAOYSA-N 1 2 301.349 4.451 20 0 DIADLO Cc1cc2c(cc1C)N(Cc1ccc(-n3cc[nH+]c3)cc1)CC2 ZINC001194231165 1049337764 /nfs/dbraw/zinc/33/77/64/1049337764.db2.gz JOHPGAPPFVZKBT-UHFFFAOYSA-N 1 2 303.409 4.052 20 0 DIADLO CC[C@@H](c1ccc(Br)cc1)[N@@H+]1CCO[C@@H](C2CC2)C1 ZINC000485793165 1049338622 /nfs/dbraw/zinc/33/86/22/1049338622.db2.gz MQTJZNHPELNMCZ-JKSUJKDBSA-N 1 2 324.262 4.011 20 0 DIADLO CC[C@@H](c1ccc(Br)cc1)[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000485793165 1049338628 /nfs/dbraw/zinc/33/86/28/1049338628.db2.gz MQTJZNHPELNMCZ-JKSUJKDBSA-N 1 2 324.262 4.011 20 0 DIADLO CCCn1cncc1C[N@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC001180403469 1049351776 /nfs/dbraw/zinc/35/17/76/1049351776.db2.gz LCNBBPZAWCZSIA-KBXCAEBGSA-N 1 2 313.445 4.174 20 0 DIADLO CCCn1cncc1C[N@@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC001180403469 1049351788 /nfs/dbraw/zinc/35/17/88/1049351788.db2.gz LCNBBPZAWCZSIA-KBXCAEBGSA-N 1 2 313.445 4.174 20 0 DIADLO c1coc(C[NH+](Cc2ccco2)Cc2cc3cnccc3o2)c1 ZINC001180413380 1049360227 /nfs/dbraw/zinc/36/02/27/1049360227.db2.gz UEQWFWXWEFSZGR-UHFFFAOYSA-N 1 2 308.337 4.216 20 0 DIADLO Clc1nccc2oc(C[N@@H+]3CCc4sccc4C3)cc21 ZINC001180515100 1049368074 /nfs/dbraw/zinc/36/80/74/1049368074.db2.gz YWNKXLLUXPHRSE-UHFFFAOYSA-N 1 2 304.802 4.101 20 0 DIADLO Clc1nccc2oc(C[N@H+]3CCc4sccc4C3)cc21 ZINC001180515100 1049368085 /nfs/dbraw/zinc/36/80/85/1049368085.db2.gz YWNKXLLUXPHRSE-UHFFFAOYSA-N 1 2 304.802 4.101 20 0 DIADLO CN(C)c1ccc(F)cc1C[N@H+](C)Cc1ccccc1Cl ZINC001180531148 1049372849 /nfs/dbraw/zinc/37/28/49/1049372849.db2.gz DDICESKXLXWJPB-UHFFFAOYSA-N 1 2 306.812 4.177 20 0 DIADLO CN(C)c1ccc(F)cc1C[N@@H+](C)Cc1ccccc1Cl ZINC001180531148 1049372860 /nfs/dbraw/zinc/37/28/60/1049372860.db2.gz DDICESKXLXWJPB-UHFFFAOYSA-N 1 2 306.812 4.177 20 0 DIADLO Oc1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c(C(F)(F)F)c1 ZINC001205104704 1049377831 /nfs/dbraw/zinc/37/78/31/1049377831.db2.gz RQWJJHASFFALEF-UHFFFAOYSA-N 1 2 322.261 4.403 20 0 DIADLO CN(C)c1ccc[nH+]c1Nc1ccc(-c2ccc(O)cc2)cc1 ZINC001205134666 1049390442 /nfs/dbraw/zinc/39/04/42/1049390442.db2.gz PTLZGZOZBBWGIX-UHFFFAOYSA-N 1 2 305.381 4.264 20 0 DIADLO C[C@H]1CN(c2cccc(Cl)c2)CC[N@@H+]1CC=C(Cl)Cl ZINC001194551960 1049391027 /nfs/dbraw/zinc/39/10/27/1049391027.db2.gz ODPUUTSCGNLOFH-NSHDSACASA-N 1 2 319.663 4.170 20 0 DIADLO C[C@H]1CN(c2cccc(Cl)c2)CC[N@H+]1CC=C(Cl)Cl ZINC001194551960 1049391038 /nfs/dbraw/zinc/39/10/38/1049391038.db2.gz ODPUUTSCGNLOFH-NSHDSACASA-N 1 2 319.663 4.170 20 0 DIADLO COc1cc(Cl)cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1 ZINC001205144550 1049391500 /nfs/dbraw/zinc/39/15/00/1049391500.db2.gz KXIQSEKUQBUYLF-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO Clc1cccc(C[N@H+](Cc2cccnc2)Cc2ccccn2)c1 ZINC001203800611 1049408030 /nfs/dbraw/zinc/40/80/30/1049408030.db2.gz YKRYHFMUUJCFNB-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1cccc(C[N@@H+](Cc2cccnc2)Cc2ccccn2)c1 ZINC001203800611 1049408033 /nfs/dbraw/zinc/40/80/33/1049408033.db2.gz YKRYHFMUUJCFNB-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC(c3ccsc3)CC2)c(C)[nH+]1 ZINC000907514789 1049417998 /nfs/dbraw/zinc/41/79/98/1049417998.db2.gz VSRCEGJDZGBJFM-UHFFFAOYSA-N 1 2 314.454 4.088 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@@H+](CCOCC1CCCC1)CC2 ZINC001194755769 1049423938 /nfs/dbraw/zinc/42/39/38/1049423938.db2.gz YGUWGUVZJKOOJV-UHFFFAOYSA-N 1 2 311.828 4.044 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@H+](CCOCC1CCCC1)CC2 ZINC001194755769 1049423945 /nfs/dbraw/zinc/42/39/45/1049423945.db2.gz YGUWGUVZJKOOJV-UHFFFAOYSA-N 1 2 311.828 4.044 20 0 DIADLO C[N@H+](Cc1cc(C2CC2)no1)Cc1cc(Cl)cc(Cl)c1 ZINC000659844755 1049448856 /nfs/dbraw/zinc/44/88/56/1049448856.db2.gz FHDLBDAVHCSBEJ-UHFFFAOYSA-N 1 2 311.212 4.491 20 0 DIADLO C[N@@H+](Cc1cc(C2CC2)no1)Cc1cc(Cl)cc(Cl)c1 ZINC000659844755 1049448866 /nfs/dbraw/zinc/44/88/66/1049448866.db2.gz FHDLBDAVHCSBEJ-UHFFFAOYSA-N 1 2 311.212 4.491 20 0 DIADLO C[C@@H](c1nc(-c2cccs2)no1)[N@H+](C)Cc1ccsc1 ZINC000152925476 1049451173 /nfs/dbraw/zinc/45/11/73/1049451173.db2.gz IPSJYDUEILGQLV-JTQLQIEISA-N 1 2 305.428 4.053 20 0 DIADLO C[C@@H](c1nc(-c2cccs2)no1)[N@@H+](C)Cc1ccsc1 ZINC000152925476 1049451181 /nfs/dbraw/zinc/45/11/81/1049451181.db2.gz IPSJYDUEILGQLV-JTQLQIEISA-N 1 2 305.428 4.053 20 0 DIADLO COCc1ccc(C[NH2+][C@@H](c2nccs2)c2ccccc2)cc1 ZINC000339029715 1049453092 /nfs/dbraw/zinc/45/30/92/1049453092.db2.gz OXHMWYQAHQASPY-GOSISDBHSA-N 1 2 324.449 4.169 20 0 DIADLO Clc1cccc(C2=CC[N@H+](Cc3cn(C4CC4)cn3)CC2)c1 ZINC001181372800 1049468104 /nfs/dbraw/zinc/46/81/04/1049468104.db2.gz LFGAFPOZFQCOKT-UHFFFAOYSA-N 1 2 313.832 4.161 20 0 DIADLO Clc1cccc(C2=CC[N@@H+](Cc3cn(C4CC4)cn3)CC2)c1 ZINC001181372800 1049468109 /nfs/dbraw/zinc/46/81/09/1049468109.db2.gz LFGAFPOZFQCOKT-UHFFFAOYSA-N 1 2 313.832 4.161 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCCC[C@H]3C)cc2)C[C@H](C)O1 ZINC001181383406 1049470592 /nfs/dbraw/zinc/47/05/92/1049470592.db2.gz TVOULYXLVYFXMX-OAFZBRQQSA-N 1 2 302.462 4.291 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)Cc1csc(C(F)(F)F)c1 ZINC000862226469 1049479645 /nfs/dbraw/zinc/47/96/45/1049479645.db2.gz GICKVHNKDGAVHC-UHFFFAOYSA-N 1 2 304.337 4.004 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)Cc1csc(C(F)(F)F)c1 ZINC000862226469 1049479647 /nfs/dbraw/zinc/47/96/47/1049479647.db2.gz GICKVHNKDGAVHC-UHFFFAOYSA-N 1 2 304.337 4.004 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1c(Cl)ncn1CC ZINC001181514276 1049486767 /nfs/dbraw/zinc/48/67/67/1049486767.db2.gz DAXGCJRNICWNMB-HNNXBMFYSA-N 1 2 321.852 4.148 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1c(Cl)ncn1CC ZINC001181514276 1049486771 /nfs/dbraw/zinc/48/67/71/1049486771.db2.gz DAXGCJRNICWNMB-HNNXBMFYSA-N 1 2 321.852 4.148 20 0 DIADLO COc1ccc2c(c1)OCC[N@@H+](Cc1cc(C)cc(Cl)c1)C2 ZINC001205514391 1049489502 /nfs/dbraw/zinc/48/95/02/1049489502.db2.gz PJYUIMBVICPIGV-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO COc1ccc2c(c1)OCC[N@H+](Cc1cc(C)cc(Cl)c1)C2 ZINC001205514391 1049489507 /nfs/dbraw/zinc/48/95/07/1049489507.db2.gz PJYUIMBVICPIGV-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO Cc1csc2nc(C)c(C[N@@H+](C)Cc3cc(C)ccc3F)n12 ZINC001205554718 1049497743 /nfs/dbraw/zinc/49/77/43/1049497743.db2.gz KHNHWNYFKVVDHZ-UHFFFAOYSA-N 1 2 317.433 4.092 20 0 DIADLO Cc1csc2nc(C)c(C[N@H+](C)Cc3cc(C)ccc3F)n12 ZINC001205554718 1049497752 /nfs/dbraw/zinc/49/77/52/1049497752.db2.gz KHNHWNYFKVVDHZ-UHFFFAOYSA-N 1 2 317.433 4.092 20 0 DIADLO CC(C)(C)C[C@@H]1CC[N@H+](Cc2ncsc2Br)C1 ZINC001195213915 1049498127 /nfs/dbraw/zinc/49/81/27/1049498127.db2.gz MAGXDKHXOIWRAB-JTQLQIEISA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)(C)C[C@@H]1CC[N@@H+](Cc2ncsc2Br)C1 ZINC001195213915 1049498129 /nfs/dbraw/zinc/49/81/29/1049498129.db2.gz MAGXDKHXOIWRAB-JTQLQIEISA-N 1 2 317.296 4.164 20 0 DIADLO C[C@H](CC1CCCC1)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)[nH+]c1 ZINC001205601531 1049508997 /nfs/dbraw/zinc/50/89/97/1049508997.db2.gz XJFYAWPNNYZIBH-BZUAXINKSA-N 1 2 317.477 4.076 20 0 DIADLO C[C@H](CC1CCCC1)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001205601534 1049509288 /nfs/dbraw/zinc/50/92/88/1049509288.db2.gz XJFYAWPNNYZIBH-PMPSAXMXSA-N 1 2 317.477 4.076 20 0 DIADLO CC[C@H]1C[NH+](CCc2cccc(Cl)c2Cl)C[C@H](CC)O1 ZINC001195299292 1049512948 /nfs/dbraw/zinc/51/29/48/1049512948.db2.gz MXPWFXOXKQUGMH-KBPBESRZSA-N 1 2 316.272 4.425 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)s1 ZINC000174572974 1049514925 /nfs/dbraw/zinc/51/49/25/1049514925.db2.gz IPTKPDKTATVGSZ-UHFFFAOYSA-N 1 2 320.364 4.280 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@H+]1C[C@H]1CCC2(CCCC2)O1 ZINC000794446380 1049515330 /nfs/dbraw/zinc/51/53/30/1049515330.db2.gz RYLRKFFMFYXNQR-UONOGXRCSA-N 1 2 308.853 4.010 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@@H+]1C[C@H]1CCC2(CCCC2)O1 ZINC000794446380 1049515340 /nfs/dbraw/zinc/51/53/40/1049515340.db2.gz RYLRKFFMFYXNQR-UONOGXRCSA-N 1 2 308.853 4.010 20 0 DIADLO Cc1ccc(Nc2cncc(Br)c2Cl)c(C)[nH+]1 ZINC001203368121 1049528279 /nfs/dbraw/zinc/52/82/79/1049528279.db2.gz VABSMHFZPMYYAW-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1cc(F)cc(Cl)c1)C2 ZINC001181985961 1049555061 /nfs/dbraw/zinc/55/50/61/1049555061.db2.gz ISOIVNZUROXNJC-UHFFFAOYSA-N 1 2 317.791 4.232 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@H+](Cc1cc(F)cc(Cl)c1)C2 ZINC001181985961 1049555070 /nfs/dbraw/zinc/55/50/70/1049555070.db2.gz ISOIVNZUROXNJC-UHFFFAOYSA-N 1 2 317.791 4.232 20 0 DIADLO c1cn(-c2csc(CN3CCCCc4ccccc43)c2)c[nH+]1 ZINC001205772760 1049560180 /nfs/dbraw/zinc/56/01/80/1049560180.db2.gz FESRRQGUCCBUFO-UHFFFAOYSA-N 1 2 309.438 4.277 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2sc(N(C)C)nc2Cl)c1C ZINC001182006899 1049563227 /nfs/dbraw/zinc/56/32/27/1049563227.db2.gz ANOUOWJEMBMZKS-UHFFFAOYSA-N 1 2 323.893 4.111 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2sc(N(C)C)nc2Cl)c1C ZINC001182006899 1049563235 /nfs/dbraw/zinc/56/32/35/1049563235.db2.gz ANOUOWJEMBMZKS-UHFFFAOYSA-N 1 2 323.893 4.111 20 0 DIADLO [NH3+][C@@H](c1nc(-c2cccc(Cl)c2)no1)c1cccc(Cl)c1 ZINC001205812272 1049571371 /nfs/dbraw/zinc/57/13/71/1049571371.db2.gz OXAANZHPFDACDF-CYBMUJFWSA-N 1 2 320.179 4.092 20 0 DIADLO C[C@H]([NH2+]C[C@H]1CCCC[C@H]1c1ccccc1)C(=O)OC(C)(C)C ZINC001205830294 1049576111 /nfs/dbraw/zinc/57/61/11/1049576111.db2.gz AFRYTJDHPUWSHC-JQHSSLGASA-N 1 2 317.473 4.280 20 0 DIADLO C[C@H]([NH2+]C[C@@H]1CCCC[C@@H]1c1ccccc1)C(=O)OC(C)(C)C ZINC001205830295 1049576485 /nfs/dbraw/zinc/57/64/85/1049576485.db2.gz AFRYTJDHPUWSHC-RYQLBKOJSA-N 1 2 317.473 4.280 20 0 DIADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1cccc(C(F)(F)F)c1 ZINC001195861571 1049576857 /nfs/dbraw/zinc/57/68/57/1049576857.db2.gz JMWAVVNTLDXADY-AWEZNQCLSA-N 1 2 301.352 4.095 20 0 DIADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1cccc(C(F)(F)F)c1 ZINC001195861571 1049576867 /nfs/dbraw/zinc/57/68/67/1049576867.db2.gz JMWAVVNTLDXADY-AWEZNQCLSA-N 1 2 301.352 4.095 20 0 DIADLO Clc1cc(Cl)c2nc(C[N@@H+]3C[C@H]4CCCC[C@H]43)cn2c1 ZINC001195834614 1049577738 /nfs/dbraw/zinc/57/77/38/1049577738.db2.gz RRFMJNWBMJVELF-QMTHXVAHSA-N 1 2 310.228 4.016 20 0 DIADLO Clc1cc(Cl)c2nc(C[N@H+]3C[C@H]4CCCC[C@H]43)cn2c1 ZINC001195834614 1049577750 /nfs/dbraw/zinc/57/77/50/1049577750.db2.gz RRFMJNWBMJVELF-QMTHXVAHSA-N 1 2 310.228 4.016 20 0 DIADLO Cc1ccc(C[S@@](=O)Cc2ccc(CC(C)C)cc2)c(C)[nH+]1 ZINC000773983085 1049578479 /nfs/dbraw/zinc/57/84/79/1049578479.db2.gz GCGBYTKBAFQDSC-QFIPXVFZSA-N 1 2 315.482 4.346 20 0 DIADLO C[C@@H](CF)[NH2+][C@@H](C(=O)c1c[nH]c2ccccc12)c1ccccc1 ZINC000487855048 1049579591 /nfs/dbraw/zinc/57/95/91/1049579591.db2.gz LDCABVJZVDUZKR-SCLBCKFNSA-N 1 2 310.372 4.040 20 0 DIADLO CC1(CC(F)(F)F)C[NH+](Cc2cccc(Br)c2)C1 ZINC001182228323 1049590345 /nfs/dbraw/zinc/59/03/45/1049590345.db2.gz XJOTUVGGDZJRRE-UHFFFAOYSA-N 1 2 322.168 4.223 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1csc(-c2ccoc2)n1 ZINC000487982811 1049591510 /nfs/dbraw/zinc/59/15/10/1049591510.db2.gz SNZLOJPQGPOSEN-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1csc(-c2ccoc2)n1 ZINC000487982811 1049591523 /nfs/dbraw/zinc/59/15/23/1049591523.db2.gz SNZLOJPQGPOSEN-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CCC[C@@H]2C(C)(C)C)c(C)[nH+]1 ZINC001205899531 1049595249 /nfs/dbraw/zinc/59/52/49/1049595249.db2.gz KNEZVYZMRGRULC-LSDHHAIUSA-N 1 2 303.450 4.343 20 0 DIADLO CCOc1ccc(N(C)C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC001205907024 1049597274 /nfs/dbraw/zinc/59/72/74/1049597274.db2.gz BXTFRYGEWLSAOS-UHFFFAOYSA-N 1 2 313.401 4.074 20 0 DIADLO CCC1(c2ccccc2)C[NH+](Cc2ccc(F)c(F)c2F)C1 ZINC001182261034 1049601020 /nfs/dbraw/zinc/60/10/20/1049601020.db2.gz IAZQYOPYXWBNEM-UHFFFAOYSA-N 1 2 305.343 4.268 20 0 DIADLO CC[N@H+](C/C=C\c1ccc(Cl)cc1)[C@@H](C)C(=O)OC(C)(C)C ZINC001196058180 1049607689 /nfs/dbraw/zinc/60/76/89/1049607689.db2.gz YDUZNUVLYFZDQE-DANTVBBOSA-N 1 2 323.864 4.405 20 0 DIADLO CC[N@@H+](C/C=C\c1ccc(Cl)cc1)[C@@H](C)C(=O)OC(C)(C)C ZINC001196058180 1049607693 /nfs/dbraw/zinc/60/76/93/1049607693.db2.gz YDUZNUVLYFZDQE-DANTVBBOSA-N 1 2 323.864 4.405 20 0 DIADLO Fc1cccc([C@H]2COCC[N@@H+]2CC[C@H]2CCCC2(F)F)c1 ZINC001196142345 1049617787 /nfs/dbraw/zinc/61/77/87/1049617787.db2.gz JQKNCQXZALLILO-GDBMZVCRSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1cccc([C@H]2COCC[N@H+]2CC[C@H]2CCCC2(F)F)c1 ZINC001196142345 1049617790 /nfs/dbraw/zinc/61/77/90/1049617790.db2.gz JQKNCQXZALLILO-GDBMZVCRSA-N 1 2 313.363 4.025 20 0 DIADLO C[C@H](Nc1cc(F)cc(N(C)C)c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000864026556 1049630395 /nfs/dbraw/zinc/63/03/95/1049630395.db2.gz QDNUSKMZDACNTO-AWEZNQCLSA-N 1 2 324.403 4.251 20 0 DIADLO Oc1ccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccccc2)c(F)c1F ZINC001206047563 1049638954 /nfs/dbraw/zinc/63/89/54/1049638954.db2.gz JJYIFPKNQDOUMP-GOSISDBHSA-N 1 2 315.363 4.398 20 0 DIADLO Oc1ccc(C[N@H+]2CC3(CCC3)[C@H]2c2ccccc2)c(F)c1F ZINC001206047563 1049638960 /nfs/dbraw/zinc/63/89/60/1049638960.db2.gz JJYIFPKNQDOUMP-GOSISDBHSA-N 1 2 315.363 4.398 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1c(Cl)nc2ccccn21 ZINC000119990352 1049649912 /nfs/dbraw/zinc/64/99/12/1049649912.db2.gz BDDRQTJZOGPUAA-UHFFFAOYSA-N 1 2 305.834 4.071 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1c(Cl)nc2ccccn21 ZINC000119990352 1049649921 /nfs/dbraw/zinc/64/99/21/1049649921.db2.gz BDDRQTJZOGPUAA-UHFFFAOYSA-N 1 2 305.834 4.071 20 0 DIADLO CC(C)(C)[C@@H]1C[C@@H](Nc2ccc(N3CCCC3)c[nH+]2)CS1 ZINC000488440017 1049655157 /nfs/dbraw/zinc/65/51/57/1049655157.db2.gz IQHLVCBWPYJOJB-HIFRSBDPSA-N 1 2 305.491 4.014 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cc(F)cc(N3CCCC3)c2)c1 ZINC001206131393 1049661882 /nfs/dbraw/zinc/66/18/82/1049661882.db2.gz ZJQPLJDVRCCYHI-UHFFFAOYSA-N 1 2 321.399 4.493 20 0 DIADLO CC[C@H]([NH2+]C1CC(c2ccc(Cl)cc2)C1)C(=O)OC(C)(C)C ZINC001182534557 1049683919 /nfs/dbraw/zinc/68/39/19/1049683919.db2.gz VVUWXZAMNNUGOE-BCLQGDPASA-N 1 2 323.864 4.296 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2ccc(Br)cc2)C[C@@H](C)O1 ZINC000488614976 1049684227 /nfs/dbraw/zinc/68/42/27/1049684227.db2.gz SUKQAIFBIOONAS-TYNCELHUSA-N 1 2 312.251 4.009 20 0 DIADLO CC[C@@H]1C[N@H+]([C@@H](C)c2ccc(Br)cc2)C[C@@H](C)O1 ZINC000488614976 1049684232 /nfs/dbraw/zinc/68/42/32/1049684232.db2.gz SUKQAIFBIOONAS-TYNCELHUSA-N 1 2 312.251 4.009 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000488614927 1049684681 /nfs/dbraw/zinc/68/46/81/1049684681.db2.gz SMAANTODRYAVFZ-VXGBXAGGSA-N 1 2 312.251 4.009 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000488614927 1049684685 /nfs/dbraw/zinc/68/46/85/1049684685.db2.gz SMAANTODRYAVFZ-VXGBXAGGSA-N 1 2 312.251 4.009 20 0 DIADLO CCOc1nnc(C[N@H+](C)[C@H](c2ccccc2C)C(C)C)s1 ZINC000488712366 1049690869 /nfs/dbraw/zinc/69/08/69/1049690869.db2.gz ZAZWWQBMRKETTO-INIZCTEOSA-N 1 2 319.474 4.074 20 0 DIADLO CCOc1nnc(C[N@@H+](C)[C@H](c2ccccc2C)C(C)C)s1 ZINC000488712366 1049690873 /nfs/dbraw/zinc/69/08/73/1049690873.db2.gz ZAZWWQBMRKETTO-INIZCTEOSA-N 1 2 319.474 4.074 20 0 DIADLO COC(=O)[C@H](c1ccsc1)[N@H+](C)C[C@@H](C)C1CCCCC1 ZINC001196818610 1049693389 /nfs/dbraw/zinc/69/33/89/1049693389.db2.gz LVGNLNKBBUDEFU-CJNGLKHVSA-N 1 2 309.475 4.110 20 0 DIADLO COC(=O)[C@H](c1ccsc1)[N@@H+](C)C[C@@H](C)C1CCCCC1 ZINC001196818610 1049693392 /nfs/dbraw/zinc/69/33/92/1049693392.db2.gz LVGNLNKBBUDEFU-CJNGLKHVSA-N 1 2 309.475 4.110 20 0 DIADLO Brc1csc(C[N@@H+]2CCCC[C@@H]2C2CCC2)n1 ZINC001182734025 1049708689 /nfs/dbraw/zinc/70/86/89/1049708689.db2.gz LCPCBHFZLNGOHE-LLVKDONJSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1csc(C[N@H+]2CCCC[C@@H]2C2CCC2)n1 ZINC001182734025 1049708702 /nfs/dbraw/zinc/70/87/02/1049708702.db2.gz LCPCBHFZLNGOHE-LLVKDONJSA-N 1 2 315.280 4.060 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@H+](Cc2cc(C3CC3)no2)C1 ZINC001197078597 1049720056 /nfs/dbraw/zinc/72/00/56/1049720056.db2.gz YIDLMKJFSCJUTM-SFHVURJKSA-N 1 2 300.377 4.013 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@@H+](Cc2cc(C3CC3)no2)C1 ZINC001197078597 1049720059 /nfs/dbraw/zinc/72/00/59/1049720059.db2.gz YIDLMKJFSCJUTM-SFHVURJKSA-N 1 2 300.377 4.013 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3ccc(Cl)c(C)c3C2)nc1 ZINC001197177239 1049727386 /nfs/dbraw/zinc/72/73/86/1049727386.db2.gz NEUKUJZGJYQCEX-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3ccc(Cl)c(C)c3C2)nc1 ZINC001197177239 1049727398 /nfs/dbraw/zinc/72/73/98/1049727398.db2.gz NEUKUJZGJYQCEX-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO COC(=O)[C@H](CC(C)(C)C)[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC001206419825 1049731711 /nfs/dbraw/zinc/73/17/11/1049731711.db2.gz NBNATHACRGRPGO-BCLQGDPASA-N 1 2 323.864 4.153 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2c(C)cccc2Cl)c(C)[nH+]1 ZINC000489271950 1049737941 /nfs/dbraw/zinc/73/79/41/1049737941.db2.gz SUWRBGIRZBDBDN-UHFFFAOYSA-N 1 2 302.805 4.150 20 0 DIADLO CC(C)(CC1CCC1)c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001206478482 1049740783 /nfs/dbraw/zinc/74/07/83/1049740783.db2.gz BNBMCJVNEQSXMN-UHFFFAOYSA-N 1 2 322.412 4.390 20 0 DIADLO COc1cnc(F)c(C[N@@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)c1 ZINC001206538458 1049753101 /nfs/dbraw/zinc/75/31/01/1049753101.db2.gz ZDJSIVYASNVPEA-GOSISDBHSA-N 1 2 324.399 4.123 20 0 DIADLO COc1cnc(F)c(C[N@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)c1 ZINC001206538458 1049753111 /nfs/dbraw/zinc/75/31/11/1049753111.db2.gz ZDJSIVYASNVPEA-GOSISDBHSA-N 1 2 324.399 4.123 20 0 DIADLO CCCC1(CCC)CCC[N@@H+]1Cc1nnc(C(F)(F)F)s1 ZINC001197513915 1049756405 /nfs/dbraw/zinc/75/64/05/1049756405.db2.gz FRZORNXFHRLOGH-UHFFFAOYSA-N 1 2 321.412 4.492 20 0 DIADLO CCCC1(CCC)CCC[N@H+]1Cc1nnc(C(F)(F)F)s1 ZINC001197513915 1049756412 /nfs/dbraw/zinc/75/64/12/1049756412.db2.gz FRZORNXFHRLOGH-UHFFFAOYSA-N 1 2 321.412 4.492 20 0 DIADLO CC(C)C(=O)Nc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1 ZINC001197501841 1049757691 /nfs/dbraw/zinc/75/76/91/1049757691.db2.gz YQWSKQZYJSRJKH-UHFFFAOYSA-N 1 2 324.428 4.020 20 0 DIADLO CCc1cnc(C[N@@H+]2CCc3ccc(C(C)C)cc3C2)s1 ZINC001206585788 1049762160 /nfs/dbraw/zinc/76/21/60/1049762160.db2.gz ZLUQFRPZOGQENM-UHFFFAOYSA-N 1 2 300.471 4.387 20 0 DIADLO CCc1cnc(C[N@H+]2CCc3ccc(C(C)C)cc3C2)s1 ZINC001206585788 1049762171 /nfs/dbraw/zinc/76/21/71/1049762171.db2.gz ZLUQFRPZOGQENM-UHFFFAOYSA-N 1 2 300.471 4.387 20 0 DIADLO COc1cccnc1C[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC001206620819 1049770751 /nfs/dbraw/zinc/77/07/51/1049770751.db2.gz WGJLYMIQCSJOPI-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cccnc1C[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC001206620819 1049770760 /nfs/dbraw/zinc/77/07/60/1049770760.db2.gz WGJLYMIQCSJOPI-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cccnc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)s1 ZINC001206643847 1049774330 /nfs/dbraw/zinc/77/43/30/1049774330.db2.gz BESDHYGPPQHTCC-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cccnc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)s1 ZINC001206643847 1049774334 /nfs/dbraw/zinc/77/43/34/1049774334.db2.gz BESDHYGPPQHTCC-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1c[nH]c2ccc(-c3ccc(C[NH+]4CCOCC4)cc3F)cc12 ZINC001206704531 1049782027 /nfs/dbraw/zinc/78/20/27/1049782027.db2.gz YRGKXGLALZNACH-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Cc1cc(C[N@@H+]2Cc3ccc(O)cc3C2)ccc1C(F)(F)F ZINC001206721644 1049783346 /nfs/dbraw/zinc/78/33/46/1049783346.db2.gz VYTBONPHIDVHDE-UHFFFAOYSA-N 1 2 307.315 4.235 20 0 DIADLO Cc1cc(C[N@H+]2Cc3ccc(O)cc3C2)ccc1C(F)(F)F ZINC001206721644 1049783351 /nfs/dbraw/zinc/78/33/51/1049783351.db2.gz VYTBONPHIDVHDE-UHFFFAOYSA-N 1 2 307.315 4.235 20 0 DIADLO Cc1c2[nH]ccc2ccc1-c1ccc(C[NH+]2CCOCC2)cc1F ZINC001206734109 1049786697 /nfs/dbraw/zinc/78/66/97/1049786697.db2.gz QWPQZGQKMMYRQL-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO CCCOc1ccc(F)c(-c2c[nH+]c(N(C)C)cc2C)c1F ZINC001206738892 1049787922 /nfs/dbraw/zinc/78/79/22/1049787922.db2.gz MPZMPPQOTRTVFU-UHFFFAOYSA-N 1 2 306.356 4.190 20 0 DIADLO COc1cc(C)ccc1C[N@H+](C)Cc1ncccc1C(F)(F)F ZINC001206741462 1049789351 /nfs/dbraw/zinc/78/93/51/1049789351.db2.gz SBJWMJUASBJTQD-UHFFFAOYSA-N 1 2 324.346 4.049 20 0 DIADLO COc1cc(C)ccc1C[N@@H+](C)Cc1ncccc1C(F)(F)F ZINC001206741462 1049789356 /nfs/dbraw/zinc/78/93/56/1049789356.db2.gz SBJWMJUASBJTQD-UHFFFAOYSA-N 1 2 324.346 4.049 20 0 DIADLO OCc1ccc(C[N@@H+]2CCc3c(Cl)cc(Cl)cc3C2)cc1 ZINC000489963500 1049792442 /nfs/dbraw/zinc/79/24/42/1049792442.db2.gz FDPTZRORPDRNEV-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO OCc1ccc(C[N@H+]2CCc3c(Cl)cc(Cl)cc3C2)cc1 ZINC000489963500 1049792448 /nfs/dbraw/zinc/79/24/48/1049792448.db2.gz FDPTZRORPDRNEV-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO Cc1ccc(F)cc1-c1noc([C@H](CC(C)C)n2cc[nH+]c2)n1 ZINC000923817628 1049793511 /nfs/dbraw/zinc/79/35/11/1049793511.db2.gz JWIPZDJOVYLVAQ-HNNXBMFYSA-N 1 2 314.364 4.016 20 0 DIADLO COc1ccc(-c2cc(C[N@@H+]3CC[C@@H]3c3ccccc3)no2)cc1 ZINC001206829778 1049807613 /nfs/dbraw/zinc/80/76/13/1049807613.db2.gz NXGHHJYPHPNYGH-LJQANCHMSA-N 1 2 320.392 4.297 20 0 DIADLO COc1ccc(-c2cc(C[N@H+]3CC[C@@H]3c3ccccc3)no2)cc1 ZINC001206829778 1049807622 /nfs/dbraw/zinc/80/76/22/1049807622.db2.gz NXGHHJYPHPNYGH-LJQANCHMSA-N 1 2 320.392 4.297 20 0 DIADLO Fc1ccc(-c2cc(C[N@@H+]3CCC[C@@H]3c3cccnc3)no2)cc1 ZINC001206833056 1049810097 /nfs/dbraw/zinc/81/00/97/1049810097.db2.gz FQKDFBFNQSVCNR-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(-c2cc(C[N@H+]3CCC[C@@H]3c3cccnc3)no2)cc1 ZINC001206833056 1049810104 /nfs/dbraw/zinc/81/01/04/1049810104.db2.gz FQKDFBFNQSVCNR-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccc(F)cc2)on1)Cc1cccs1 ZINC001206835189 1049811158 /nfs/dbraw/zinc/81/11/58/1049811158.db2.gz XDDKGMUPSUYYNR-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@H+](Cc1cc(-c2ccc(F)cc2)on1)Cc1cccs1 ZINC001206835189 1049811170 /nfs/dbraw/zinc/81/11/70/1049811170.db2.gz XDDKGMUPSUYYNR-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO Fc1cncc(F)c1C[NH+]1CCC(c2cccc(Cl)c2)CC1 ZINC001206854667 1049814747 /nfs/dbraw/zinc/81/47/47/1049814747.db2.gz IHNYJKQNRXONFM-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@]2(C)C(=O)OC(C)(C)C)cc1Cl ZINC001207006728 1049819046 /nfs/dbraw/zinc/81/90/46/1049819046.db2.gz CWSKITLPXBIEGC-GOSISDBHSA-N 1 2 323.864 4.345 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@]2(C)C(=O)OC(C)(C)C)cc1Cl ZINC001207006728 1049819051 /nfs/dbraw/zinc/81/90/51/1049819051.db2.gz CWSKITLPXBIEGC-GOSISDBHSA-N 1 2 323.864 4.345 20 0 DIADLO COc1cncc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)s2)c1 ZINC001206997040 1049819865 /nfs/dbraw/zinc/81/98/65/1049819865.db2.gz NULXUKQXTNPVTC-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cncc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)c1 ZINC001206997040 1049819871 /nfs/dbraw/zinc/81/98/71/1049819871.db2.gz NULXUKQXTNPVTC-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1C[NH2+][C@](CC)(C(=O)OC)c1ccccc1 ZINC001207049638 1049825066 /nfs/dbraw/zinc/82/50/66/1049825066.db2.gz MASKFZVRXNACMW-HLIPFELVSA-N 1 2 317.473 4.271 20 0 DIADLO C[N@H+](Cc1ncc2ccccn21)Cc1ccc2ccccc2c1 ZINC001207055559 1049828201 /nfs/dbraw/zinc/82/82/01/1049828201.db2.gz ZLXXFTLOOAEOPU-UHFFFAOYSA-N 1 2 301.393 4.120 20 0 DIADLO C[N@@H+](Cc1ncc2ccccn21)Cc1ccc2ccccc2c1 ZINC001207055559 1049828226 /nfs/dbraw/zinc/82/82/26/1049828226.db2.gz ZLXXFTLOOAEOPU-UHFFFAOYSA-N 1 2 301.393 4.120 20 0 DIADLO C[N@@H+](Cc1ccc(F)c(F)c1)Cn1c2ccccc2oc1=S ZINC000913064482 1049834025 /nfs/dbraw/zinc/83/40/25/1049834025.db2.gz XFEQHYKKGMNMSU-UHFFFAOYSA-N 1 2 320.364 4.331 20 0 DIADLO C[N@H+](Cc1ccc(F)c(F)c1)Cn1c2ccccc2oc1=S ZINC000913064482 1049834036 /nfs/dbraw/zinc/83/40/36/1049834036.db2.gz XFEQHYKKGMNMSU-UHFFFAOYSA-N 1 2 320.364 4.331 20 0 DIADLO COc1cccc([C@@H]2CCCC[N@@H+]2Cc2ncc(F)cc2F)c1 ZINC001207097458 1049835836 /nfs/dbraw/zinc/83/58/36/1049835836.db2.gz QSUUJSLYXLOJDW-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cccc([C@@H]2CCCC[N@H+]2Cc2ncc(F)cc2F)c1 ZINC001207097458 1049835845 /nfs/dbraw/zinc/83/58/45/1049835845.db2.gz QSUUJSLYXLOJDW-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO Fc1cccc(OC(F)F)c1C[NH+]1CC(c2ccccc2)C1 ZINC001207119101 1049836983 /nfs/dbraw/zinc/83/69/83/1049836983.db2.gz ZQRSGUCYIRSMNB-UHFFFAOYSA-N 1 2 307.315 4.027 20 0 DIADLO CCn1ccnc1C[N@@H+]1CC[C@H](c2cccc(Cl)c2Cl)C1 ZINC001207146522 1049845881 /nfs/dbraw/zinc/84/58/81/1049845881.db2.gz VCQYDPKKXKIBAL-LBPRGKRZSA-N 1 2 324.255 4.199 20 0 DIADLO CCn1ccnc1C[N@H+]1CC[C@H](c2cccc(Cl)c2Cl)C1 ZINC001207146522 1049845885 /nfs/dbraw/zinc/84/58/85/1049845885.db2.gz VCQYDPKKXKIBAL-LBPRGKRZSA-N 1 2 324.255 4.199 20 0 DIADLO Fc1ccc(C2CC[NH+](Cc3c(Cl)ccnc3F)CC2)cc1 ZINC001207168331 1049850459 /nfs/dbraw/zinc/85/04/59/1049850459.db2.gz RTRIYYABUXRBAO-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Cc1cc[nH+]c(C)c1NC1(c2ccc(C(F)(F)F)cc2)COC1 ZINC001168376585 1049873571 /nfs/dbraw/zinc/87/35/71/1049873571.db2.gz RKDJJHYTTHONRX-UHFFFAOYSA-N 1 2 322.330 4.055 20 0 DIADLO Fc1ccccc1CC[N@@H+]1Cc2cccc(Br)c2C1 ZINC001207502358 1049900871 /nfs/dbraw/zinc/90/08/71/1049900871.db2.gz XMEPGEDUBWFNNM-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO Fc1ccccc1CC[N@H+]1Cc2cccc(Br)c2C1 ZINC001207502358 1049900876 /nfs/dbraw/zinc/90/08/76/1049900876.db2.gz XMEPGEDUBWFNNM-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO Cc1ccc(C2=CC[N@H+]([C@H](C)c3nc(C(C)C)no3)CC2)cc1 ZINC000044586249 1049919233 /nfs/dbraw/zinc/91/92/33/1049919233.db2.gz VHHLADPJJQBLJV-OAHLLOKOSA-N 1 2 311.429 4.352 20 0 DIADLO Cc1ccc(C2=CC[N@@H+]([C@H](C)c3nc(C(C)C)no3)CC2)cc1 ZINC000044586249 1049919238 /nfs/dbraw/zinc/91/92/38/1049919238.db2.gz VHHLADPJJQBLJV-OAHLLOKOSA-N 1 2 311.429 4.352 20 0 DIADLO CCOc1ccc(C[N@@H+]2CC[C@@H]2c2ccc(F)cc2)cc1F ZINC001207724142 1049931114 /nfs/dbraw/zinc/93/11/14/1049931114.db2.gz UQXVOJYEBSOCMT-QGZVFWFLSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1ccc(C[N@H+]2CC[C@@H]2c2ccc(F)cc2)cc1F ZINC001207724142 1049931118 /nfs/dbraw/zinc/93/11/18/1049931118.db2.gz UQXVOJYEBSOCMT-QGZVFWFLSA-N 1 2 303.352 4.311 20 0 DIADLO CC[N@H+](Cc1cc(C)co1)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001207812690 1049941218 /nfs/dbraw/zinc/94/12/18/1049941218.db2.gz FWEXSACFEZGEAY-GFCCVEGCSA-N 1 2 304.459 4.191 20 0 DIADLO CC[N@@H+](Cc1cc(C)co1)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001207812690 1049941228 /nfs/dbraw/zinc/94/12/28/1049941228.db2.gz FWEXSACFEZGEAY-GFCCVEGCSA-N 1 2 304.459 4.191 20 0 DIADLO CC(C)CC[C@H](NC(=O)Nc1ccc2[nH+]ccn2c1)C(C)(C)C ZINC001207826827 1049943534 /nfs/dbraw/zinc/94/35/34/1049943534.db2.gz RTNFHPGGCHMFHM-HNNXBMFYSA-N 1 2 316.449 4.307 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](CCCC3CCCC3)CCO2)cc1F ZINC001208094270 1049972279 /nfs/dbraw/zinc/97/22/79/1049972279.db2.gz HPHVXRVBQZCJNH-SFHVURJKSA-N 1 2 309.400 4.309 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](CCCC3CCCC3)CCO2)cc1F ZINC001208094270 1049972287 /nfs/dbraw/zinc/97/22/87/1049972287.db2.gz HPHVXRVBQZCJNH-SFHVURJKSA-N 1 2 309.400 4.309 20 0 DIADLO Cc1ccc([C@H](C)CC[N@@H+]2CCCC[C@@H]2c2noc(C)n2)o1 ZINC001208154277 1049978829 /nfs/dbraw/zinc/97/88/29/1049978829.db2.gz FCNJOCBMQWCECX-IUODEOHRSA-N 1 2 303.406 4.000 20 0 DIADLO Cc1ccc([C@H](C)CC[N@H+]2CCCC[C@@H]2c2noc(C)n2)o1 ZINC001208154277 1049978831 /nfs/dbraw/zinc/97/88/31/1049978831.db2.gz FCNJOCBMQWCECX-IUODEOHRSA-N 1 2 303.406 4.000 20 0 DIADLO Cc1cn2cc(NC(=O)N(C)[C@H](C)C3CCCCC3)ccc2[nH+]1 ZINC000571942469 1049978878 /nfs/dbraw/zinc/97/88/78/1049978878.db2.gz IBFNDHQGFKCQAZ-CQSZACIVSA-N 1 2 314.433 4.075 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCC[C@H]2c2cccnc2)s1 ZINC000572324147 1049999460 /nfs/dbraw/zinc/99/94/60/1049999460.db2.gz KPKLROLBDWTPAF-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCC[C@H]2c2cccnc2)s1 ZINC000572324147 1049999462 /nfs/dbraw/zinc/99/94/62/1049999462.db2.gz KPKLROLBDWTPAF-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO COc1cccc(/C=[NH+]/CCc2cccc3ccccc32)c1O ZINC000032074655 1050002268 /nfs/dbraw/zinc/00/22/68/1050002268.db2.gz QDTIRQRSUGFHDQ-KGENOOAVSA-N 1 2 305.377 4.216 20 0 DIADLO Cc1cn2cc(NC(=O)c3oc4c(cccc4F)c3C)ccc2[nH+]1 ZINC000588859022 1050006388 /nfs/dbraw/zinc/00/63/88/1050006388.db2.gz DBHCGDATPGRNIC-UHFFFAOYSA-N 1 2 323.327 4.089 20 0 DIADLO Brc1ccc(CSc2[nH+]cnc3[nH]ccc32)cc1 ZINC000588895571 1050011048 /nfs/dbraw/zinc/01/10/48/1050011048.db2.gz PLFUMPFDEFIDLX-UHFFFAOYSA-N 1 2 320.215 4.013 20 0 DIADLO Cc1csc(-c2cccc(Nc3[nH+]cnc4[nH]ccc43)c2)n1 ZINC000588897502 1050011634 /nfs/dbraw/zinc/01/16/34/1050011634.db2.gz GUIGNIIRXGUSLQ-UHFFFAOYSA-N 1 2 307.382 4.133 20 0 DIADLO CCCC[N@H+](Cc1nnc(C(C)C)o1)[C@@H](C)c1ccc(C)o1 ZINC000588937986 1050014174 /nfs/dbraw/zinc/01/41/74/1050014174.db2.gz RXNSNESNNINIIS-AWEZNQCLSA-N 1 2 305.422 4.458 20 0 DIADLO CCCC[N@@H+](Cc1nnc(C(C)C)o1)[C@@H](C)c1ccc(C)o1 ZINC000588937986 1050014181 /nfs/dbraw/zinc/01/41/81/1050014181.db2.gz RXNSNESNNINIIS-AWEZNQCLSA-N 1 2 305.422 4.458 20 0 DIADLO C[C@H]1CCc2nc(C[NH2+][C@@H]3CSc4ccccc43)sc2C1 ZINC000498353550 1050014895 /nfs/dbraw/zinc/01/48/95/1050014895.db2.gz MIEYCRQGRYKNNK-SMDDNHRTSA-N 1 2 316.495 4.205 20 0 DIADLO F[C@H]1CSC2(C[NH+](CCc3c(Cl)cccc3Cl)C2)C1 ZINC001209108153 1050036450 /nfs/dbraw/zinc/03/64/50/1050036450.db2.gz BARSFXGLWGBBTA-SNVBAGLBSA-N 1 2 320.260 4.065 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCCC(F)(F)[C@@H](F)C2)c(Cl)c1 ZINC001209109876 1050036536 /nfs/dbraw/zinc/03/65/36/1050036536.db2.gz YHYGSLNSDMUTGP-ZDUSSCGKSA-N 1 2 309.734 4.091 20 0 DIADLO Fc1ccc(CC[N@H+]2CCCC(F)(F)[C@@H](F)C2)c(Cl)c1 ZINC001209109876 1050036542 /nfs/dbraw/zinc/03/65/42/1050036542.db2.gz YHYGSLNSDMUTGP-ZDUSSCGKSA-N 1 2 309.734 4.091 20 0 DIADLO FC1(F)C[N@H+](CCCc2ccncc2)CC[C@@H]1c1ccccc1 ZINC001209191796 1050043903 /nfs/dbraw/zinc/04/39/03/1050043903.db2.gz PACZCUFASRIVRJ-GOSISDBHSA-N 1 2 316.395 4.139 20 0 DIADLO FC1(F)C[N@@H+](CCCc2ccncc2)CC[C@@H]1c1ccccc1 ZINC001209191796 1050043909 /nfs/dbraw/zinc/04/39/09/1050043909.db2.gz PACZCUFASRIVRJ-GOSISDBHSA-N 1 2 316.395 4.139 20 0 DIADLO C[C@@]1(F)CC[N@H+](CCc2ccccc2C(F)(F)F)C[C@H]1F ZINC001209278771 1050049532 /nfs/dbraw/zinc/04/95/32/1050049532.db2.gz XMCNHSDTEYOCGO-ZIAGYGMSSA-N 1 2 307.306 4.020 20 0 DIADLO C[C@@]1(F)CC[N@@H+](CCc2ccccc2C(F)(F)F)C[C@H]1F ZINC001209278771 1050049536 /nfs/dbraw/zinc/04/95/36/1050049536.db2.gz XMCNHSDTEYOCGO-ZIAGYGMSSA-N 1 2 307.306 4.020 20 0 DIADLO Fc1cccc2c1C[N@H+](CCc1ccccc1C(F)(F)F)C2 ZINC001209283026 1050049754 /nfs/dbraw/zinc/04/97/54/1050049754.db2.gz LZUWXSUIVRCZDT-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Fc1cccc2c1C[N@@H+](CCc1ccccc1C(F)(F)F)C2 ZINC001209283026 1050049759 /nfs/dbraw/zinc/04/97/59/1050049759.db2.gz LZUWXSUIVRCZDT-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)cc1 ZINC000589598756 1050050347 /nfs/dbraw/zinc/05/03/47/1050050347.db2.gz YWVHVZLFELJDQT-GOSISDBHSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)cc1 ZINC000589598756 1050050349 /nfs/dbraw/zinc/05/03/49/1050050349.db2.gz YWVHVZLFELJDQT-GOSISDBHSA-N 1 2 319.807 4.361 20 0 DIADLO c1coc([C@H]([NH2+]Cc2ccc3nc[nH]c3c2)c2ccccc2)c1 ZINC000589638247 1050051185 /nfs/dbraw/zinc/05/11/85/1050051185.db2.gz QRLDFRTZCCCOIE-LJQANCHMSA-N 1 2 303.365 4.035 20 0 DIADLO C[C@@H]([NH2+]Cc1n[nH]c2ccccc21)c1ccc2c(c1)CCCC2 ZINC000589637009 1050051579 /nfs/dbraw/zinc/05/15/79/1050051579.db2.gz XVFRKTBYWJTCRO-CQSZACIVSA-N 1 2 305.425 4.293 20 0 DIADLO CCOc1ccc([C@H]([NH2+]Cc2nccs2)c2ccccc2)cc1 ZINC000589646124 1050053764 /nfs/dbraw/zinc/05/37/64/1050053764.db2.gz VJGKKNKZPMVGTI-LJQANCHMSA-N 1 2 324.449 4.421 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3n[nH]c4ccccc43)CCCC2)cc1 ZINC000589649622 1050054220 /nfs/dbraw/zinc/05/42/20/1050054220.db2.gz BXJHYEQNDFDZIL-UHFFFAOYSA-N 1 2 309.388 4.261 20 0 DIADLO FC(F)(F)Oc1cccc(Cl)c1C[N@@H+]1CCCC12CC2 ZINC001209523887 1050066079 /nfs/dbraw/zinc/06/60/79/1050066079.db2.gz TWLWVFQJVXOFJV-UHFFFAOYSA-N 1 2 305.727 4.367 20 0 DIADLO FC(F)(F)Oc1cccc(Cl)c1C[N@H+]1CCCC12CC2 ZINC001209523887 1050066082 /nfs/dbraw/zinc/06/60/82/1050066082.db2.gz TWLWVFQJVXOFJV-UHFFFAOYSA-N 1 2 305.727 4.367 20 0 DIADLO CC[N@H+](Cc1cncs1)Cc1ccc(Cl)cc1Cl ZINC001209551254 1050068682 /nfs/dbraw/zinc/06/86/82/1050068682.db2.gz UJSXINLMZFFZCZ-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC[N@@H+](Cc1cncs1)Cc1ccc(Cl)cc1Cl ZINC001209551254 1050068683 /nfs/dbraw/zinc/06/86/83/1050068683.db2.gz UJSXINLMZFFZCZ-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO Cc1ccc(C[N@H+]2Cc3ccc(Br)cc3C[C@H]2C)[nH]1 ZINC001209577014 1050069599 /nfs/dbraw/zinc/06/95/99/1050069599.db2.gz KYMZBECGSWVDCG-GFCCVEGCSA-N 1 2 319.246 4.032 20 0 DIADLO Cc1ccc(C[N@@H+]2Cc3ccc(Br)cc3C[C@H]2C)[nH]1 ZINC001209577014 1050069605 /nfs/dbraw/zinc/06/96/05/1050069605.db2.gz KYMZBECGSWVDCG-GFCCVEGCSA-N 1 2 319.246 4.032 20 0 DIADLO Cc1cn2cc(NC(=O)N[C@@H](c3ccccc3)C(C)C)ccc2[nH+]1 ZINC000590014075 1050070102 /nfs/dbraw/zinc/07/01/02/1050070102.db2.gz WGSJTMZGAQIXPQ-GOSISDBHSA-N 1 2 322.412 4.162 20 0 DIADLO FC(F)(F)COc1cccc(Nc2cccc3[nH+]ccn32)c1 ZINC001212162439 1050077685 /nfs/dbraw/zinc/07/76/85/1050077685.db2.gz OWXOBIXDXYESRU-UHFFFAOYSA-N 1 2 307.275 4.019 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc3cc(Cl)ccc3[nH]2)no1 ZINC001209718230 1050078035 /nfs/dbraw/zinc/07/80/35/1050078035.db2.gz KSCAVCAVMBDWQQ-KRWDZBQOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc3cc(Cl)ccc3[nH]2)no1 ZINC001209718230 1050078039 /nfs/dbraw/zinc/07/80/39/1050078039.db2.gz KSCAVCAVMBDWQQ-KRWDZBQOSA-N 1 2 315.804 4.455 20 0 DIADLO O=C1CC[N@@H+](Cc2cc3cc(Cl)ccc3[nH]2)[C@H]2CCCC[C@H]12 ZINC001209717996 1050078246 /nfs/dbraw/zinc/07/82/46/1050078246.db2.gz IUSZSJNISJTMQP-RDJZCZTQSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2cc3cc(Cl)ccc3[nH]2)[C@H]2CCCC[C@H]12 ZINC001209717996 1050078251 /nfs/dbraw/zinc/07/82/51/1050078251.db2.gz IUSZSJNISJTMQP-RDJZCZTQSA-N 1 2 316.832 4.155 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1[nH]nc2ccc(Cl)cc21 ZINC001209751460 1050079902 /nfs/dbraw/zinc/07/99/02/1050079902.db2.gz PMOOWTYEMNRXKS-GFCCVEGCSA-N 1 2 311.816 4.336 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1[nH]nc2ccc(Cl)cc21 ZINC001209751460 1050079904 /nfs/dbraw/zinc/07/99/04/1050079904.db2.gz PMOOWTYEMNRXKS-GFCCVEGCSA-N 1 2 311.816 4.336 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1n[nH]c2ccc(Cl)cc21 ZINC001209751460 1050079908 /nfs/dbraw/zinc/07/99/08/1050079908.db2.gz PMOOWTYEMNRXKS-GFCCVEGCSA-N 1 2 311.816 4.336 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1n[nH]c2ccc(Cl)cc21 ZINC001209751460 1050079912 /nfs/dbraw/zinc/07/99/12/1050079912.db2.gz PMOOWTYEMNRXKS-GFCCVEGCSA-N 1 2 311.816 4.336 20 0 DIADLO CSCc1cnc(C[NH2+][C@H]2CSCc3ccccc32)s1 ZINC000590183978 1050080316 /nfs/dbraw/zinc/08/03/16/1050080316.db2.gz NFJUKCBXVBGDLD-AWEZNQCLSA-N 1 2 322.524 4.084 20 0 DIADLO CCC[C@H]([NH2+]Cc1ncc(CSC)s1)c1ccccn1 ZINC000590185661 1050080647 /nfs/dbraw/zinc/08/06/47/1050080647.db2.gz TVYKPYMOAXRZDA-ZDUSSCGKSA-N 1 2 307.488 4.032 20 0 DIADLO CC[N@H+](Cc1n[nH]c2ccc(Cl)cc21)Cc1cccc(F)c1 ZINC001209759598 1050081157 /nfs/dbraw/zinc/08/11/57/1050081157.db2.gz QZIUZDCGXMEMSN-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO CC[N@@H+](Cc1n[nH]c2ccc(Cl)cc21)Cc1cccc(F)c1 ZINC001209759598 1050081162 /nfs/dbraw/zinc/08/11/62/1050081162.db2.gz QZIUZDCGXMEMSN-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO CC[N@H+](Cc1n[nH]c2ccc(Cl)cc21)Cc1ccc(F)cc1 ZINC001209760699 1050081211 /nfs/dbraw/zinc/08/12/11/1050081211.db2.gz YIROAJMRMBJZFC-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO CC[N@@H+](Cc1n[nH]c2ccc(Cl)cc21)Cc1ccc(F)cc1 ZINC001209760699 1050081214 /nfs/dbraw/zinc/08/12/14/1050081214.db2.gz YIROAJMRMBJZFC-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1[nH]nc3ccc(Cl)cc31)C2 ZINC001209761317 1050081262 /nfs/dbraw/zinc/08/12/62/1050081262.db2.gz JLZOBNZFZIJUAO-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1[nH]nc3ccc(Cl)cc31)C2 ZINC001209761317 1050081267 /nfs/dbraw/zinc/08/12/67/1050081267.db2.gz JLZOBNZFZIJUAO-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1[nH]nc2ccc(Cl)cc21 ZINC001209760492 1050081359 /nfs/dbraw/zinc/08/13/59/1050081359.db2.gz XKDZTVUGQPZNQC-GFCCVEGCSA-N 1 2 311.816 4.163 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1[nH]nc2ccc(Cl)cc21 ZINC001209760492 1050081363 /nfs/dbraw/zinc/08/13/63/1050081363.db2.gz XKDZTVUGQPZNQC-GFCCVEGCSA-N 1 2 311.816 4.163 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1n[nH]c2ccc(Cl)cc21 ZINC001209760492 1050081369 /nfs/dbraw/zinc/08/13/69/1050081369.db2.gz XKDZTVUGQPZNQC-GFCCVEGCSA-N 1 2 311.816 4.163 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1n[nH]c2ccc(Cl)cc21 ZINC001209760492 1050081372 /nfs/dbraw/zinc/08/13/72/1050081372.db2.gz XKDZTVUGQPZNQC-GFCCVEGCSA-N 1 2 311.816 4.163 20 0 DIADLO C[N@H+](C/C=C/c1ccccc1)Cc1n[nH]c2ccc(Cl)cc21 ZINC001209758287 1050082295 /nfs/dbraw/zinc/08/22/95/1050082295.db2.gz FJRIILSQUKFZPA-VMPITWQZSA-N 1 2 311.816 4.362 20 0 DIADLO C[N@@H+](C/C=C/c1ccccc1)Cc1n[nH]c2ccc(Cl)cc21 ZINC001209758287 1050082302 /nfs/dbraw/zinc/08/23/02/1050082302.db2.gz FJRIILSQUKFZPA-VMPITWQZSA-N 1 2 311.816 4.362 20 0 DIADLO COc1c(F)ccc(Nc2ccc(-n3cc[nH+]c3)cc2)c1Cl ZINC001209803511 1050087341 /nfs/dbraw/zinc/08/73/41/1050087341.db2.gz ZFRRURIQXSIVPY-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO CC(C)Oc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c(F)c1 ZINC001209837090 1050091399 /nfs/dbraw/zinc/09/13/99/1050091399.db2.gz JTXXBKVAGIJONB-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO FC(F)(F)c1cc(Cl)cnc1Nc1ccc2[nH]c[nH+]c2c1 ZINC001209845223 1050093614 /nfs/dbraw/zinc/09/36/14/1050093614.db2.gz UEUMYASPHMDTJV-UHFFFAOYSA-N 1 2 312.682 4.374 20 0 DIADLO CCCCOC(=O)Nc1ccc(Nc2cccn3cc[nH+]c23)cc1 ZINC001209914981 1050105866 /nfs/dbraw/zinc/10/58/66/1050105866.db2.gz HMWHJSXYBBWDOM-UHFFFAOYSA-N 1 2 324.384 4.427 20 0 DIADLO c1ccc(Nc2cccc3c2CCCC3)c(C[NH+]2CCOCC2)c1 ZINC001209930513 1050107818 /nfs/dbraw/zinc/10/78/18/1050107818.db2.gz NJRPWTSFMAOOFN-UHFFFAOYSA-N 1 2 322.452 4.141 20 0 DIADLO Cc1ccc(Cl)cc1Nc1ccccc1C[NH+]1CCOCC1 ZINC001209926694 1050108199 /nfs/dbraw/zinc/10/81/99/1050108199.db2.gz AKSBCQAKAHEWQQ-UHFFFAOYSA-N 1 2 316.832 4.224 20 0 DIADLO CSc1cc(Nc2ccc(O)c(C(F)(F)F)c2)cc[nH+]1 ZINC001209985865 1050116863 /nfs/dbraw/zinc/11/68/63/1050116863.db2.gz MNFPKCCNNGHHRC-UHFFFAOYSA-N 1 2 300.305 4.272 20 0 DIADLO Cc1cc(Nc2cncc(-c3ccccn3)c2)ccc1[NH+](C)C ZINC001210041869 1050127552 /nfs/dbraw/zinc/12/75/52/1050127552.db2.gz UCDZKYQSDLISTM-UHFFFAOYSA-N 1 2 304.397 4.262 20 0 DIADLO Cc1cc(Nc2ccc3nnc(C(C)(C)C)n3c2)ccc1[NH+](C)C ZINC001210043132 1050127752 /nfs/dbraw/zinc/12/77/52/1050127752.db2.gz UCLYEQHWOFDSFG-UHFFFAOYSA-N 1 2 323.444 4.145 20 0 DIADLO Cc1cc(Nc2ccc(O)c(Br)c2)ccc1[NH+](C)C ZINC001210042105 1050127820 /nfs/dbraw/zinc/12/78/20/1050127820.db2.gz WAFDIVARSUSFJL-UHFFFAOYSA-N 1 2 321.218 4.273 20 0 DIADLO CC(=O)n1ccc2cc(Nc3ccc([NH+](C)C)c(C)c3)ccc21 ZINC001210043238 1050127833 /nfs/dbraw/zinc/12/78/33/1050127833.db2.gz BSFBDHJBEAGZMP-UHFFFAOYSA-N 1 2 307.397 4.419 20 0 DIADLO COC(=O)[C@H](C)c1ccc(Nc2ccc([NH+](C)C)c(C)c2)cc1 ZINC001210045790 1050128248 /nfs/dbraw/zinc/12/82/48/1050128248.db2.gz XUCNNCXWJMQOTH-CQSZACIVSA-N 1 2 312.413 4.081 20 0 DIADLO COC(=O)[C@@H](C)c1ccc(Nc2ccc([NH+](C)C)c(C)c2)cc1 ZINC001210045788 1050128656 /nfs/dbraw/zinc/12/86/56/1050128656.db2.gz XUCNNCXWJMQOTH-AWEZNQCLSA-N 1 2 312.413 4.081 20 0 DIADLO Cc1cc(Nc2ccc3c(c2)NC(=O)CC3(C)C)ccc1[NH+](C)C ZINC001210044388 1050128833 /nfs/dbraw/zinc/12/88/33/1050128833.db2.gz ZAWLCVLNRQORAD-UHFFFAOYSA-N 1 2 323.440 4.424 20 0 DIADLO Cc1ccc(C(=O)NC2CC2)cc1Nc1ccc([NH+](C)C)c(C)c1 ZINC001210044961 1050128869 /nfs/dbraw/zinc/12/88/69/1050128869.db2.gz QEMFPCRCMDRXME-UHFFFAOYSA-N 1 2 323.440 4.005 20 0 DIADLO FC(F)(F)Oc1ccnc(Nc2ccc3c[nH+]ccc3c2)c1 ZINC001210047131 1050129416 /nfs/dbraw/zinc/12/94/16/1050129416.db2.gz MGTHJZRHRPFFMT-UHFFFAOYSA-N 1 2 305.259 4.272 20 0 DIADLO FC(F)(F)c1ccncc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001210092940 1050134783 /nfs/dbraw/zinc/13/47/83/1050134783.db2.gz FQDPPJWYVGEGKW-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO FC(F)(F)c1ccncc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001210094171 1050135386 /nfs/dbraw/zinc/13/53/86/1050135386.db2.gz PVJOGSUZVYPOJY-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO FC(F)(F)c1ccncc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001210093968 1050135451 /nfs/dbraw/zinc/13/54/51/1050135451.db2.gz JKQSJMQUGRZCHD-UHFFFAOYSA-N 1 2 318.302 4.089 20 0 DIADLO Cc1cccc(Nc2cc[nH+]c(NC(=O)OC(C)(C)C)c2)c1O ZINC001210186776 1050151346 /nfs/dbraw/zinc/15/13/46/1050151346.db2.gz SPVUSNVIUHEJHF-UHFFFAOYSA-N 1 2 315.373 4.186 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCC[N@@H+]1Cc1ccoc1 ZINC000770336216 1050152842 /nfs/dbraw/zinc/15/28/42/1050152842.db2.gz NCKMXOVAIZIDTQ-HNNXBMFYSA-N 1 2 321.852 4.431 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCC[N@H+]1Cc1ccoc1 ZINC000770336216 1050152845 /nfs/dbraw/zinc/15/28/45/1050152845.db2.gz NCKMXOVAIZIDTQ-HNNXBMFYSA-N 1 2 321.852 4.431 20 0 DIADLO CCCC[C@H](C)N(CCCC)C(=O)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000573259389 1050155442 /nfs/dbraw/zinc/15/54/42/1050155442.db2.gz VOIAQURKQJTKDU-GJZGRUSLSA-N 1 2 305.466 4.037 20 0 DIADLO CCOc1ccc(SCc2[nH+]cc(C)c(OC)c2C)cc1 ZINC000733871759 1050159870 /nfs/dbraw/zinc/15/98/70/1050159870.db2.gz PDGWCRMUNCMEJA-UHFFFAOYSA-N 1 2 303.427 4.398 20 0 DIADLO CC1CC[NH+](c2ccc(NCc3[nH]nc4ccccc43)cc2)CC1 ZINC000770512956 1050163419 /nfs/dbraw/zinc/16/34/19/1050163419.db2.gz RQRUQNWNJBAMFE-UHFFFAOYSA-N 1 2 320.440 4.411 20 0 DIADLO Fc1cccc(Cn2nccc2Nc2cccc3cc[nH+]cc32)c1 ZINC001210224371 1050165029 /nfs/dbraw/zinc/16/50/29/1050165029.db2.gz LDNBCRVANOJFFN-UHFFFAOYSA-N 1 2 318.355 4.362 20 0 DIADLO Cc1cc(Br)nc(Nc2cccc3cc[nH+]cc32)c1 ZINC001210224077 1050165564 /nfs/dbraw/zinc/16/55/64/1050165564.db2.gz DALIZHNOQCLROK-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO Cc1cc(Nc2cccc3cc[nH+]cc32)cnc1Br ZINC001210224151 1050166314 /nfs/dbraw/zinc/16/63/14/1050166314.db2.gz QWMWPULQAOXWHK-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO c1c(C2CCC2)nn2cc(Nc3cccc4cc[nH+]cc43)cnc12 ZINC001210225587 1050167280 /nfs/dbraw/zinc/16/72/80/1050167280.db2.gz KKWSEOXPYRFLBI-UHFFFAOYSA-N 1 2 315.380 4.289 20 0 DIADLO Brc1ccncc1Nc1cccc2cc[nH+]cc21 ZINC001210224887 1050167313 /nfs/dbraw/zinc/16/73/13/1050167313.db2.gz ZUFXGDVTPHKXRX-UHFFFAOYSA-N 1 2 300.159 4.136 20 0 DIADLO COC(=O)c1cc(Cl)sc1Nc1cccc2cc[nH+]cc21 ZINC001210226171 1050168007 /nfs/dbraw/zinc/16/80/07/1050168007.db2.gz SIXMFZSNPSIHNU-UHFFFAOYSA-N 1 2 318.785 4.480 20 0 DIADLO Oc1ccc(Nc2cccc3cc[nH+]cc32)cc1Br ZINC001210231228 1050168535 /nfs/dbraw/zinc/16/85/35/1050168535.db2.gz JRJVWBRZKZADJH-UHFFFAOYSA-N 1 2 315.170 4.447 20 0 DIADLO Nc1ccc(N(c2cccc3cc[nH+]cc32)C2CCCC2)nc1 ZINC001210226498 1050168542 /nfs/dbraw/zinc/16/85/42/1050168542.db2.gz ZEIMFYYTJFHUOW-UHFFFAOYSA-N 1 2 304.397 4.293 20 0 DIADLO CCOC(=O)c1ccc(Nc2cccc3cc[nH+]cc32)c(F)c1 ZINC001210232053 1050169744 /nfs/dbraw/zinc/16/97/44/1050169744.db2.gz XMXHFROIRJWWEA-UHFFFAOYSA-N 1 2 310.328 4.294 20 0 DIADLO COc1cc(OC)c(F)c(Nc2cccc3cc[nH+]cc32)c1F ZINC001210231815 1050169938 /nfs/dbraw/zinc/16/99/38/1050169938.db2.gz RBHKIALMVZQKHP-UHFFFAOYSA-N 1 2 316.307 4.274 20 0 DIADLO Oc1cccc(Nc2cccc3cc[nH+]cc32)c1Br ZINC001210233101 1050171519 /nfs/dbraw/zinc/17/15/19/1050171519.db2.gz RRERTSUYDLICGX-UHFFFAOYSA-N 1 2 315.170 4.447 20 0 DIADLO COc1ccc2oc([C@H](C)[NH2+][C@H](C)c3cc(C)on3)c(C)c2c1 ZINC000282654654 1050174563 /nfs/dbraw/zinc/17/45/63/1050174563.db2.gz IFRSCHRRJKFZJG-OLZOCXBDSA-N 1 2 314.385 4.458 20 0 DIADLO FC(F)(F)c1ccccc1CCNc1ccn2cc[nH+]c2c1 ZINC001171040891 1050175353 /nfs/dbraw/zinc/17/53/53/1050175353.db2.gz KFNAPWGDQYAOOC-UHFFFAOYSA-N 1 2 305.303 4.008 20 0 DIADLO CCCC[N@H+](C)c1ccc(NCc2[nH]nc3ccccc32)cc1 ZINC000770564019 1050178053 /nfs/dbraw/zinc/17/80/53/1050178053.db2.gz PRBOVBWUSNEEEZ-UHFFFAOYSA-N 1 2 308.429 4.411 20 0 DIADLO CCCC[N@@H+](C)c1ccc(NCc2[nH]nc3ccccc32)cc1 ZINC000770564019 1050178058 /nfs/dbraw/zinc/17/80/58/1050178058.db2.gz PRBOVBWUSNEEEZ-UHFFFAOYSA-N 1 2 308.429 4.411 20 0 DIADLO C[C@H]1CC[N@H+](Cn2nc(C3CC3)sc2=S)CC12CCC2 ZINC000770671323 1050183633 /nfs/dbraw/zinc/18/36/33/1050183633.db2.gz RKJILBXAMXTVAO-NSHDSACASA-N 1 2 309.504 4.021 20 0 DIADLO C[C@H]1CC[N@@H+](Cn2nc(C3CC3)sc2=S)CC12CCC2 ZINC000770671323 1050183645 /nfs/dbraw/zinc/18/36/45/1050183645.db2.gz RKJILBXAMXTVAO-NSHDSACASA-N 1 2 309.504 4.021 20 0 DIADLO Fc1cc(C[NH+]2CCC(c3cccc(F)c3F)CC2)c(F)cn1 ZINC000824187856 1050188127 /nfs/dbraw/zinc/18/81/27/1050188127.db2.gz NCHPDVXBJXECSA-UHFFFAOYSA-N 1 2 324.321 4.018 20 0 DIADLO Cc1[nH+]cc(Nc2cc(C(C)(C)C)nn2-c2ccccc2)cc1N ZINC001210285718 1050189380 /nfs/dbraw/zinc/18/93/80/1050189380.db2.gz PYSPHPVQHOROIC-UHFFFAOYSA-N 1 2 321.428 4.199 20 0 DIADLO Cc1ncc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)cc1N ZINC001210286694 1050190394 /nfs/dbraw/zinc/19/03/94/1050190394.db2.gz DLLZJESQOSVLPO-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Cc1[nH+]cc(Nc2cc(C(F)(F)F)cc3ncccc32)cc1N ZINC001210291719 1050191288 /nfs/dbraw/zinc/19/12/88/1050191288.db2.gz RPCPDJSOJDWVLX-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CC3CCC2CC3)cc1Br ZINC001136854209 1050197677 /nfs/dbraw/zinc/19/76/77/1050197677.db2.gz MTQHHORVPCERIY-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CC3CCC2CC3)cc1Br ZINC001136854209 1050197678 /nfs/dbraw/zinc/19/76/78/1050197678.db2.gz MTQHHORVPCERIY-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CCC3(CCC3)C2)cc1Br ZINC001136854335 1050197143 /nfs/dbraw/zinc/19/71/43/1050197143.db2.gz RRYADNQFMGAXRN-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CCC3(CCC3)C2)cc1Br ZINC001136854335 1050197150 /nfs/dbraw/zinc/19/71/50/1050197150.db2.gz RRYADNQFMGAXRN-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO CC(=O)c1ccc([C@H](C)Nc2ccc(-n3cccc3)c[nH+]2)cc1 ZINC001171054261 1050205512 /nfs/dbraw/zinc/20/55/12/1050205512.db2.gz QDADABQZIWGHKS-AWEZNQCLSA-N 1 2 305.381 4.248 20 0 DIADLO CC[C@@H](CC1CCCC1)C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000734092650 1050219528 /nfs/dbraw/zinc/21/95/28/1050219528.db2.gz WSLWQEMAIKHARB-DLBZAZTESA-N 1 2 319.493 4.021 20 0 DIADLO CC[C@@H](CC1CCCC1)C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000734092652 1050219674 /nfs/dbraw/zinc/21/96/74/1050219674.db2.gz WSLWQEMAIKHARB-IRXDYDNUSA-N 1 2 319.493 4.021 20 0 DIADLO CC[C@H](CC1CCCC1)C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000734092653 1050219823 /nfs/dbraw/zinc/21/98/23/1050219823.db2.gz WSLWQEMAIKHARB-SJORKVTESA-N 1 2 319.493 4.021 20 0 DIADLO CC[C@H]1C[N@H+](Cn2ncsc2=S)CC[C@@H]1c1ccccc1 ZINC000746379876 1050223188 /nfs/dbraw/zinc/22/31/88/1050223188.db2.gz BAGXVMDUPMCHFR-ZFWWWQNUSA-N 1 2 319.499 4.147 20 0 DIADLO CC[C@H]1C[N@@H+](Cn2ncsc2=S)CC[C@@H]1c1ccccc1 ZINC000746379876 1050223197 /nfs/dbraw/zinc/22/31/97/1050223197.db2.gz BAGXVMDUPMCHFR-ZFWWWQNUSA-N 1 2 319.499 4.147 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)c2ccccc12)c1nc2ccccc2s1 ZINC000734164112 1050235914 /nfs/dbraw/zinc/23/59/14/1050235914.db2.gz KGOZLMHBKWWILN-GFCCVEGCSA-N 1 2 322.437 4.034 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)cn1)c1nc2ccccc2s1 ZINC000771392405 1050249442 /nfs/dbraw/zinc/24/94/42/1050249442.db2.gz WHHLSDWAUNHRMY-GHMZBOCLSA-N 1 2 301.390 4.242 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cn1)c1nc2ccccc2s1 ZINC000771392416 1050249823 /nfs/dbraw/zinc/24/98/23/1050249823.db2.gz WHHLSDWAUNHRMY-WDEREUQCSA-N 1 2 301.390 4.242 20 0 DIADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccc(Cl)c(OC(F)(F)F)c1 ZINC001143356911 1050315797 /nfs/dbraw/zinc/31/57/97/1050315797.db2.gz KVILGGSKDGRDKY-PSASIEDQSA-N 1 2 311.706 4.171 20 0 DIADLO FC(F)(F)c1c[nH]c(C[N@@H+]2CCC[C@@H](c3ccccc3)CC2)n1 ZINC001137017585 1050295874 /nfs/dbraw/zinc/29/58/74/1050295874.db2.gz OLEMSPPDKWXWGK-CQSZACIVSA-N 1 2 323.362 4.198 20 0 DIADLO FC(F)(F)c1c[nH]c(C[N@H+]2CCC[C@@H](c3ccccc3)CC2)n1 ZINC001137017585 1050295884 /nfs/dbraw/zinc/29/58/84/1050295884.db2.gz OLEMSPPDKWXWGK-CQSZACIVSA-N 1 2 323.362 4.198 20 0 DIADLO C[N@H+](Cc1ncc(C(F)(F)F)[nH]1)C1CCC(C(C)(C)C)CC1 ZINC001137017509 1050296157 /nfs/dbraw/zinc/29/61/57/1050296157.db2.gz MAXZVEHPQAQGBO-UHFFFAOYSA-N 1 2 317.399 4.465 20 0 DIADLO C[N@@H+](Cc1ncc(C(F)(F)F)[nH]1)C1CCC(C(C)(C)C)CC1 ZINC001137017509 1050296159 /nfs/dbraw/zinc/29/61/59/1050296159.db2.gz MAXZVEHPQAQGBO-UHFFFAOYSA-N 1 2 317.399 4.465 20 0 DIADLO CC(C)(C)c1csc(C[NH2+]Cc2cscc2Cl)n1 ZINC000771944757 1050301927 /nfs/dbraw/zinc/30/19/27/1050301927.db2.gz CNUCAWNWIQIEEY-UHFFFAOYSA-N 1 2 300.880 4.445 20 0 DIADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccc(Cl)c(OC(F)(F)F)c1 ZINC001143356911 1050315792 /nfs/dbraw/zinc/31/57/92/1050315792.db2.gz KVILGGSKDGRDKY-PSASIEDQSA-N 1 2 311.706 4.171 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc(NC(=O)N(C)C)cc3)ccc12 ZINC001210639217 1050324220 /nfs/dbraw/zinc/32/42/20/1050324220.db2.gz ZQUXQUMYGUMOMZ-UHFFFAOYSA-N 1 2 320.396 4.380 20 0 DIADLO Cc1ccc(C(F)(F)F)c(C[N@@H+]2CCc3ncsc3C2)c1 ZINC001143680823 1050335925 /nfs/dbraw/zinc/33/59/25/1050335925.db2.gz KJMNBNITXCTQDU-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1ccc(C(F)(F)F)c(C[N@H+]2CCc3ncsc3C2)c1 ZINC001143680823 1050335928 /nfs/dbraw/zinc/33/59/28/1050335928.db2.gz KJMNBNITXCTQDU-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO FC(F)(F)Oc1ccc(Cl)cc1C[N@@H+]1CCC2(CC2)C1 ZINC001143698250 1050337676 /nfs/dbraw/zinc/33/76/76/1050337676.db2.gz CANMVCJECBDRMN-UHFFFAOYSA-N 1 2 305.727 4.225 20 0 DIADLO FC(F)(F)Oc1ccc(Cl)cc1C[N@H+]1CCC2(CC2)C1 ZINC001143698250 1050337686 /nfs/dbraw/zinc/33/76/86/1050337686.db2.gz CANMVCJECBDRMN-UHFFFAOYSA-N 1 2 305.727 4.225 20 0 DIADLO CC(C)[C@@H]1COCC[N@@H+]1Cc1ccc(C(F)(F)F)cc1Cl ZINC001143715487 1050338011 /nfs/dbraw/zinc/33/80/11/1050338011.db2.gz JSEPFXFOIJYKIZ-AWEZNQCLSA-N 1 2 321.770 4.216 20 0 DIADLO CC(C)[C@@H]1COCC[N@H+]1Cc1ccc(C(F)(F)F)cc1Cl ZINC001143715487 1050338018 /nfs/dbraw/zinc/33/80/18/1050338018.db2.gz JSEPFXFOIJYKIZ-AWEZNQCLSA-N 1 2 321.770 4.216 20 0 DIADLO F[C@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1cc(Cl)ccc1OC(F)(F)F ZINC001143704512 1050341165 /nfs/dbraw/zinc/34/11/65/1050341165.db2.gz IJBZWWWNPKQVDC-UWJYBYFXSA-N 1 2 323.717 4.171 20 0 DIADLO F[C@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1cc(Cl)ccc1OC(F)(F)F ZINC001143704512 1050341181 /nfs/dbraw/zinc/34/11/81/1050341181.db2.gz IJBZWWWNPKQVDC-UWJYBYFXSA-N 1 2 323.717 4.171 20 0 DIADLO Clc1cc(Cl)c(C[N@@H+]2CC[C@]3(CCCO3)C2)c(Cl)c1 ZINC001143797343 1050364559 /nfs/dbraw/zinc/36/45/59/1050364559.db2.gz HNNIYDZQFKWALZ-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1cc(Cl)c(C[N@H+]2CC[C@]3(CCCO3)C2)c(Cl)c1 ZINC001143797343 1050364569 /nfs/dbraw/zinc/36/45/69/1050364569.db2.gz HNNIYDZQFKWALZ-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCC[C@H](F)CC2)c1Br ZINC001143813325 1050372844 /nfs/dbraw/zinc/37/28/44/1050372844.db2.gz NWYIJXUTSMZWGS-VIFPVBQESA-N 1 2 322.168 4.051 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCC[C@H](F)CC2)c1Br ZINC001143813325 1050372854 /nfs/dbraw/zinc/37/28/54/1050372854.db2.gz NWYIJXUTSMZWGS-VIFPVBQESA-N 1 2 322.168 4.051 20 0 DIADLO Cc1c(F)cc(F)cc1C[N@H+](C)Cc1nc2ccccc2o1 ZINC001143768104 1050352076 /nfs/dbraw/zinc/35/20/76/1050352076.db2.gz YVSJQFCTQAVHBC-UHFFFAOYSA-N 1 2 302.324 4.046 20 0 DIADLO Cc1c(F)cc(F)cc1C[N@@H+](C)Cc1nc2ccccc2o1 ZINC001143768104 1050352084 /nfs/dbraw/zinc/35/20/84/1050352084.db2.gz YVSJQFCTQAVHBC-UHFFFAOYSA-N 1 2 302.324 4.046 20 0 DIADLO Cc1nc(-c2cc3c(s2)CC[N@H+](C/C=C\Cl)C3)cs1 ZINC000772322571 1050352561 /nfs/dbraw/zinc/35/25/61/1050352561.db2.gz FDNJTAQEDAHFAY-RQOWECAXSA-N 1 2 310.875 4.291 20 0 DIADLO Cc1nc(-c2cc3c(s2)CC[N@@H+](C/C=C\Cl)C3)cs1 ZINC000772322571 1050352573 /nfs/dbraw/zinc/35/25/73/1050352573.db2.gz FDNJTAQEDAHFAY-RQOWECAXSA-N 1 2 310.875 4.291 20 0 DIADLO Cc1nc(-c2cc3c(s2)CC[N@H+](C/C=C/Cl)C3)cs1 ZINC000772322570 1050353217 /nfs/dbraw/zinc/35/32/17/1050353217.db2.gz FDNJTAQEDAHFAY-DUXPYHPUSA-N 1 2 310.875 4.291 20 0 DIADLO Cc1nc(-c2cc3c(s2)CC[N@@H+](C/C=C/Cl)C3)cs1 ZINC000772322570 1050353227 /nfs/dbraw/zinc/35/32/27/1050353227.db2.gz FDNJTAQEDAHFAY-DUXPYHPUSA-N 1 2 310.875 4.291 20 0 DIADLO Cc1c(F)cc(F)cc1C[N@H+](C)Cc1cnc(Cl)s1 ZINC001143758113 1050355033 /nfs/dbraw/zinc/35/50/33/1050355033.db2.gz XCUPGVBFCPUBTG-UHFFFAOYSA-N 1 2 302.777 4.015 20 0 DIADLO Cc1c(F)cc(F)cc1C[N@@H+](C)Cc1cnc(Cl)s1 ZINC001143758113 1050355042 /nfs/dbraw/zinc/35/50/42/1050355042.db2.gz XCUPGVBFCPUBTG-UHFFFAOYSA-N 1 2 302.777 4.015 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCCc3sccc3C2)cs1 ZINC000592982338 1050357482 /nfs/dbraw/zinc/35/74/82/1050357482.db2.gz IBNAODJWKDZURP-UHFFFAOYSA-N 1 2 306.500 4.496 20 0 DIADLO CCCCc1nc(C[N@H+]2CCCc3sccc3C2)cs1 ZINC000592982338 1050357496 /nfs/dbraw/zinc/35/74/96/1050357496.db2.gz IBNAODJWKDZURP-UHFFFAOYSA-N 1 2 306.500 4.496 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(Cl)cc(Cl)cc2Cl)CC[C@@]1(C)O ZINC001143797049 1050361571 /nfs/dbraw/zinc/36/15/71/1050361571.db2.gz DFVCGZOAXBVACD-YMTOWFKASA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(Cl)cc(Cl)cc2Cl)CC[C@@]1(C)O ZINC001143797049 1050361577 /nfs/dbraw/zinc/36/15/77/1050361577.db2.gz DFVCGZOAXBVACD-YMTOWFKASA-N 1 2 322.663 4.240 20 0 DIADLO COC1CC[NH+](Cc2c(Cl)cc(Cl)cc2Cl)CC1 ZINC001143794426 1050361800 /nfs/dbraw/zinc/36/18/00/1050361800.db2.gz WLMSRVOZWCISNA-UHFFFAOYSA-N 1 2 308.636 4.258 20 0 DIADLO CCCC[C@H](CC)CC(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000735271469 1050362570 /nfs/dbraw/zinc/36/25/70/1050362570.db2.gz HMZOSGCJDABTKH-JKSUJKDBSA-N 1 2 307.482 4.021 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1c(F)c(F)c(OC)c(F)c1F ZINC001210763314 1050364121 /nfs/dbraw/zinc/36/41/21/1050364121.db2.gz WOAKZHPFDNCZGM-UHFFFAOYSA-N 1 2 314.282 4.261 20 0 DIADLO Clc1cc(Cl)c(C[N@@H+]2CCC[C@@]23CCOC3)c(Cl)c1 ZINC001143801858 1050365181 /nfs/dbraw/zinc/36/51/81/1050365181.db2.gz ZOCWMDPZVWBZBP-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1cc(Cl)c(C[N@H+]2CCC[C@@]23CCOC3)c(Cl)c1 ZINC001143801858 1050365187 /nfs/dbraw/zinc/36/51/87/1050365187.db2.gz ZOCWMDPZVWBZBP-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2cc(O)ccc2F)cc[nH+]1 ZINC001210798956 1050369378 /nfs/dbraw/zinc/36/93/78/1050369378.db2.gz LFPDJBMDZVELOD-UHFFFAOYSA-N 1 2 319.336 4.017 20 0 DIADLO COc1cc(Nc2ccc(Cc3ccncc3)cc2)cc(C)[nH+]1 ZINC001210780561 1050369615 /nfs/dbraw/zinc/36/96/15/1050369615.db2.gz FGNJRLSOHNHHDH-UHFFFAOYSA-N 1 2 305.381 4.128 20 0 DIADLO COc1cc(Nc2ccc(Oc3ccncc3)cc2)cc(C)[nH+]1 ZINC001210780629 1050370164 /nfs/dbraw/zinc/37/01/64/1050370164.db2.gz WTBREXXRFKAPRO-UHFFFAOYSA-N 1 2 307.353 4.330 20 0 DIADLO Brc1ccoc1C[NH2+][C@H]1CCCOc2ccccc21 ZINC000735322829 1050370239 /nfs/dbraw/zinc/37/02/39/1050370239.db2.gz NDPURFGVMLQNCC-ZDUSSCGKSA-N 1 2 322.202 4.046 20 0 DIADLO CN(c1ccc(Nc2cnc(Cl)nc2)c[nH+]1)C1CCCCC1 ZINC001212613051 1050372522 /nfs/dbraw/zinc/37/25/22/1050372522.db2.gz APYDGHUAWCNZPS-UHFFFAOYSA-N 1 2 317.824 4.038 20 0 DIADLO Fc1ccc(F)c(C[NH+]2CCC3(CC3)CC2)c1Br ZINC001143813560 1050373035 /nfs/dbraw/zinc/37/30/35/1050373035.db2.gz TVXTUOJXHXVZPS-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCC[C@H]2c2ccncc2)cc1Cl ZINC001143847777 1050375944 /nfs/dbraw/zinc/37/59/44/1050375944.db2.gz ZLEKQILPJODFAA-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCC[C@H]2c2ccncc2)cc1Cl ZINC001143847777 1050375955 /nfs/dbraw/zinc/37/59/55/1050375955.db2.gz ZLEKQILPJODFAA-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO c1cn(Cc2cccc(Nc3ccc4ccccc4n3)c2)c[nH+]1 ZINC001210818021 1050377492 /nfs/dbraw/zinc/37/74/92/1050377492.db2.gz VYZWWVXABTTXTC-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCCC[C@@](C)(F)C2)cc1Cl ZINC001143840291 1050377826 /nfs/dbraw/zinc/37/78/26/1050377826.db2.gz YSVKPVCRQWDVFE-OAHLLOKOSA-N 1 2 303.780 4.202 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCCC[C@@](C)(F)C2)cc1Cl ZINC001143840291 1050377832 /nfs/dbraw/zinc/37/78/32/1050377832.db2.gz YSVKPVCRQWDVFE-OAHLLOKOSA-N 1 2 303.780 4.202 20 0 DIADLO C[N@H+](CCc1ccccn1)Cc1c(F)ccc(Cl)c1Cl ZINC001143864568 1050378344 /nfs/dbraw/zinc/37/83/44/1050378344.db2.gz QWRFFNGSKLIOCE-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1ccccn1)Cc1c(F)ccc(Cl)c1Cl ZINC001143864568 1050378355 /nfs/dbraw/zinc/37/83/55/1050378355.db2.gz QWRFFNGSKLIOCE-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CC[C@@H]2c2ccccc2)cc1Cl ZINC001143848161 1050379915 /nfs/dbraw/zinc/37/99/15/1050379915.db2.gz PCWGEHRMHKJYLM-MRXNPFEDSA-N 1 2 305.780 4.435 20 0 DIADLO COc1c(F)cc(C[N@H+]2CC[C@@H]2c2ccccc2)cc1Cl ZINC001143848161 1050379926 /nfs/dbraw/zinc/37/99/26/1050379926.db2.gz PCWGEHRMHKJYLM-MRXNPFEDSA-N 1 2 305.780 4.435 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CC[C@H]2c2ccccc2)cc1Cl ZINC001143848160 1050380389 /nfs/dbraw/zinc/38/03/89/1050380389.db2.gz PCWGEHRMHKJYLM-INIZCTEOSA-N 1 2 305.780 4.435 20 0 DIADLO COc1c(F)cc(C[N@H+]2CC[C@H]2c2ccccc2)cc1Cl ZINC001143848160 1050380405 /nfs/dbraw/zinc/38/04/05/1050380405.db2.gz PCWGEHRMHKJYLM-INIZCTEOSA-N 1 2 305.780 4.435 20 0 DIADLO Oc1cc(Nc2cccc(-n3cc[nH+]c3)c2)cc(C(F)(F)F)c1 ZINC001210825798 1050382771 /nfs/dbraw/zinc/38/27/71/1050382771.db2.gz RGCXFGXKBABDFJ-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO CC(C)(C)C[C@H]1CN(C[N@@H+]2CCC[C@H]2c2ccsc2)C(=O)O1 ZINC000785498795 1050383192 /nfs/dbraw/zinc/38/31/92/1050383192.db2.gz IKCLLIYILBKEMG-GJZGRUSLSA-N 1 2 322.474 4.100 20 0 DIADLO CC(C)(C)C[C@H]1CN(C[N@H+]2CCC[C@H]2c2ccsc2)C(=O)O1 ZINC000785498795 1050383200 /nfs/dbraw/zinc/38/32/00/1050383200.db2.gz IKCLLIYILBKEMG-GJZGRUSLSA-N 1 2 322.474 4.100 20 0 DIADLO CC(C)O[C@H]1CC[N@H+](Cc2c(F)ccc(Cl)c2Cl)C1 ZINC001143867065 1050386597 /nfs/dbraw/zinc/38/65/97/1050386597.db2.gz WIMIDIFSVVHERC-JTQLQIEISA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@H]1CC[N@@H+](Cc2c(F)ccc(Cl)c2Cl)C1 ZINC001143867065 1050386610 /nfs/dbraw/zinc/38/66/10/1050386610.db2.gz WIMIDIFSVVHERC-JTQLQIEISA-N 1 2 306.208 4.132 20 0 DIADLO Cc1cc(C(C)(C)C)ccc1OC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000844286064 1050393853 /nfs/dbraw/zinc/39/38/53/1050393853.db2.gz QBMCVZBOPGWCMJ-CQSZACIVSA-N 1 2 300.402 4.046 20 0 DIADLO c1cn(Cc2ccc(Nc3cccc(OC4CC4)c3)cc2)c[nH+]1 ZINC001210862990 1050397836 /nfs/dbraw/zinc/39/78/36/1050397836.db2.gz MTNCVEYFYSFEGR-UHFFFAOYSA-N 1 2 305.381 4.216 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)/C=C\C2CCCCC2)n1 ZINC000735463223 1050400160 /nfs/dbraw/zinc/40/01/60/1050400160.db2.gz GBUWSUVILOMOGQ-KHPPLWFESA-N 1 2 321.490 4.060 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)o1 ZINC000735494952 1050404445 /nfs/dbraw/zinc/40/44/45/1050404445.db2.gz LKFLSMNZEXNMLC-INIZCTEOSA-N 1 2 302.443 4.088 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CCS[C@H](c3ccccc3)C2)o1 ZINC000735494952 1050404454 /nfs/dbraw/zinc/40/44/54/1050404454.db2.gz LKFLSMNZEXNMLC-INIZCTEOSA-N 1 2 302.443 4.088 20 0 DIADLO Cc1cc(Nc2cc[nH+]c(NC(=O)OC(C)(C)C)c2)cnc1F ZINC001212173560 1050405479 /nfs/dbraw/zinc/40/54/79/1050405479.db2.gz LTGYMPUZJXUKNI-UHFFFAOYSA-N 1 2 318.352 4.015 20 0 DIADLO COc1ccc(C[N@@H+]2CCSc3ccccc3C2)c(F)c1F ZINC001143916026 1050405969 /nfs/dbraw/zinc/40/59/69/1050405969.db2.gz OZFHTZBCNXCVAP-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO COc1ccc(C[N@H+]2CCSc3ccccc3C2)c(F)c1F ZINC001143916026 1050405976 /nfs/dbraw/zinc/40/59/76/1050405976.db2.gz OZFHTZBCNXCVAP-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO CCOc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1F ZINC001143937307 1050411115 /nfs/dbraw/zinc/41/11/15/1050411115.db2.gz IRVKPUNXXCDGNB-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2ccccn2)c1F ZINC001143937307 1050411117 /nfs/dbraw/zinc/41/11/17/1050411117.db2.gz IRVKPUNXXCDGNB-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1c(C[N@@H+]2CCc3ncsc3C2)cccc1C(F)(F)F ZINC001143930375 1050412745 /nfs/dbraw/zinc/41/27/45/1050412745.db2.gz OMVBEUCJJCNURE-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1c(C[N@H+]2CCc3ncsc3C2)cccc1C(F)(F)F ZINC001143930375 1050412755 /nfs/dbraw/zinc/41/27/55/1050412755.db2.gz OMVBEUCJJCNURE-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO CCOc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2cccnc2)c1F ZINC001143931603 1050415543 /nfs/dbraw/zinc/41/55/43/1050415543.db2.gz ZYIIYRMFOLCDCK-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(F)c(C[N@H+]2CCC[C@H]2c2cccnc2)c1F ZINC001143931603 1050415547 /nfs/dbraw/zinc/41/55/47/1050415547.db2.gz ZYIIYRMFOLCDCK-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1nc2c(cc(Nc3cccc4[nH+]ccn43)cc2F)n1C(C)C ZINC001210924470 1050415833 /nfs/dbraw/zinc/41/58/33/1050415833.db2.gz UHCILPOPTOLGRJ-UHFFFAOYSA-N 1 2 323.375 4.456 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c1F ZINC001143958220 1050417039 /nfs/dbraw/zinc/41/70/39/1050417039.db2.gz ZHEVOJDOWVOFOD-ZDUSSCGKSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c1F ZINC001143958220 1050417042 /nfs/dbraw/zinc/41/70/42/1050417042.db2.gz ZHEVOJDOWVOFOD-ZDUSSCGKSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1ccc(Cl)c(C[NH+]2CCC(c3ccccn3)CC2)c1F ZINC001143957967 1050417097 /nfs/dbraw/zinc/41/70/97/1050417097.db2.gz TTZLMEWXSXULNZ-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(-c2ccccc2)n[nH]1)c1cccc(C)c1 ZINC000796895260 1050420046 /nfs/dbraw/zinc/42/00/46/1050420046.db2.gz ANIAXLCEBMHHIS-KRWDZBQOSA-N 1 2 306.413 4.021 20 0 DIADLO COc1ccc(F)c(C[N@H+](C)[C@H]2CCc3ccccc32)c1F ZINC001143984809 1050421338 /nfs/dbraw/zinc/42/13/38/1050421338.db2.gz JWQRDCIZMGEROJ-INIZCTEOSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(F)c(C[N@@H+](C)[C@H]2CCc3ccccc32)c1F ZINC001143984809 1050421345 /nfs/dbraw/zinc/42/13/45/1050421345.db2.gz JWQRDCIZMGEROJ-INIZCTEOSA-N 1 2 303.352 4.093 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)o1 ZINC000735674758 1050423015 /nfs/dbraw/zinc/42/30/15/1050423015.db2.gz UMBNKHSAIWGJCY-KBXCAEBGSA-N 1 2 316.470 4.477 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)o1 ZINC000735674758 1050423022 /nfs/dbraw/zinc/42/30/22/1050423022.db2.gz UMBNKHSAIWGJCY-KBXCAEBGSA-N 1 2 316.470 4.477 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cncc(C(F)(F)F)c2)cc1F ZINC001240794407 1050425004 /nfs/dbraw/zinc/42/50/04/1050425004.db2.gz OEPCXAVCZVBHCJ-UHFFFAOYSA-N 1 2 316.273 4.107 20 0 DIADLO FC1(F)C[C@]12CCC[N@H+](Cc1ncc(Cl)cc1Cl)C2 ZINC000844441541 1050425690 /nfs/dbraw/zinc/42/56/90/1050425690.db2.gz OCZCPMCALJVZKO-LBPRGKRZSA-N 1 2 307.171 4.010 20 0 DIADLO FC1(F)C[C@]12CCC[N@@H+](Cc1ncc(Cl)cc1Cl)C2 ZINC000844441541 1050425698 /nfs/dbraw/zinc/42/56/98/1050425698.db2.gz OCZCPMCALJVZKO-LBPRGKRZSA-N 1 2 307.171 4.010 20 0 DIADLO Cc1ccc([C@@H]2CCC[C@@H]2OC(=O)C[C@H](C)n2cc[nH+]c2)cc1 ZINC000844480403 1050429415 /nfs/dbraw/zinc/42/94/15/1050429415.db2.gz FKPWRMZHGCWEQK-SZMVWBNQSA-N 1 2 312.413 4.022 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)OC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000844469224 1050435819 /nfs/dbraw/zinc/43/58/19/1050435819.db2.gz DXGVREGWLXKUDD-WCQYABFASA-N 1 2 321.446 4.027 20 0 DIADLO CC[C@@H](OC(=O)C[C@@H](C)n1cc[nH+]c1)c1cccc(Cl)c1F ZINC000844489971 1050438790 /nfs/dbraw/zinc/43/87/90/1050438790.db2.gz KXFOWPGDVRUOKR-BXUZGUMPSA-N 1 2 324.783 4.321 20 0 DIADLO Cc1ccc(Nc2ccc3c(cnn3C(=O)OC(C)(C)C)c2)[nH+]c1 ZINC001211011573 1050444877 /nfs/dbraw/zinc/44/48/77/1050444877.db2.gz WEPTUQASDPPOIL-UHFFFAOYSA-N 1 2 324.384 4.267 20 0 DIADLO COc1c(C)cc(Nc2ccc(C)c[nH+]2)cc1Br ZINC001211012535 1050445280 /nfs/dbraw/zinc/44/52/80/1050445280.db2.gz HTFABARTCJAJMA-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1ccc(Nc2ccc3nccc(Br)c3c2)[nH+]c1 ZINC001211010271 1050445458 /nfs/dbraw/zinc/44/54/58/1050445458.db2.gz FXUUXVWJYBLEEQ-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@@H+]1Cc1nc(C2CCC2)no1 ZINC001171132618 1050451251 /nfs/dbraw/zinc/45/12/51/1050451251.db2.gz GXZPUZKIWZBAMB-MRXNPFEDSA-N 1 2 315.392 4.122 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@H+]1Cc1nc(C2CCC2)no1 ZINC001171132618 1050451255 /nfs/dbraw/zinc/45/12/55/1050451255.db2.gz GXZPUZKIWZBAMB-MRXNPFEDSA-N 1 2 315.392 4.122 20 0 DIADLO Cc1cccc([C@H](C)OC(=O)c2cccc(Cn3cc[nH+]c3)c2)c1 ZINC000736024441 1050456295 /nfs/dbraw/zinc/45/62/95/1050456295.db2.gz JEKIDXCHTXEFPF-INIZCTEOSA-N 1 2 320.392 4.158 20 0 DIADLO Fc1cccc(C[NH2+]Cc2nc(-c3ccccc3)cs2)c1F ZINC000594051709 1050470069 /nfs/dbraw/zinc/47/00/69/1050470069.db2.gz PQSMAVRCVIROBB-UHFFFAOYSA-N 1 2 316.376 4.378 20 0 DIADLO S=c1ncccn1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000046476930 1050476100 /nfs/dbraw/zinc/47/61/00/1050476100.db2.gz BZYFQXIFVWHYLS-CQSZACIVSA-N 1 2 305.834 4.061 20 0 DIADLO S=c1ncccn1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000046476930 1050476107 /nfs/dbraw/zinc/47/61/07/1050476107.db2.gz BZYFQXIFVWHYLS-CQSZACIVSA-N 1 2 305.834 4.061 20 0 DIADLO Cc1ccc(N(CC(C)C)C(=O)C[C@H](C)n2cc[nH+]c2)c(C)c1 ZINC000844660400 1050477249 /nfs/dbraw/zinc/47/72/49/1050477249.db2.gz GGSQEDHRXNLDKQ-KRWDZBQOSA-N 1 2 313.445 4.140 20 0 DIADLO CSc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1F ZINC001211108293 1050477483 /nfs/dbraw/zinc/47/74/83/1050477483.db2.gz CRCFNUXURZQUFS-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO Fc1ccc2[nH]nc(C[N@@H+]3CCC[C@H]3c3cccs3)c2c1 ZINC001144197840 1050490443 /nfs/dbraw/zinc/49/04/43/1050490443.db2.gz ZYFOVXWCIVNVJK-HNNXBMFYSA-N 1 2 301.390 4.101 20 0 DIADLO Fc1ccc2[nH]nc(C[N@H+]3CCC[C@H]3c3cccs3)c2c1 ZINC001144197840 1050490447 /nfs/dbraw/zinc/49/04/47/1050490447.db2.gz ZYFOVXWCIVNVJK-HNNXBMFYSA-N 1 2 301.390 4.101 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)o1 ZINC000761057351 1050500386 /nfs/dbraw/zinc/50/03/86/1050500386.db2.gz QBYGQLQSNJLEJO-LBPRGKRZSA-N 1 2 310.319 4.034 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+]2CC[C@H](C(F)(F)F)C2)o1 ZINC000761057351 1050500398 /nfs/dbraw/zinc/50/03/98/1050500398.db2.gz QBYGQLQSNJLEJO-LBPRGKRZSA-N 1 2 310.319 4.034 20 0 DIADLO CC[N@H+](Cc1ccc(O)cn1)Cc1ccc(Cl)cc1Cl ZINC001144264400 1050519143 /nfs/dbraw/zinc/51/91/43/1050519143.db2.gz UCHGQCFRAASEIR-UHFFFAOYSA-N 1 2 311.212 4.116 20 0 DIADLO CC[N@@H+](Cc1ccc(O)cn1)Cc1ccc(Cl)cc1Cl ZINC001144264400 1050519156 /nfs/dbraw/zinc/51/91/56/1050519156.db2.gz UCHGQCFRAASEIR-UHFFFAOYSA-N 1 2 311.212 4.116 20 0 DIADLO CC[N@H+](Cn1nc(-c2ccc(C)cc2)oc1=S)C1CCC1 ZINC000738051565 1050521270 /nfs/dbraw/zinc/52/12/70/1050521270.db2.gz AJIMEUSJXZRYOF-UHFFFAOYSA-N 1 2 303.431 4.013 20 0 DIADLO CC[N@@H+](Cn1nc(-c2ccc(C)cc2)oc1=S)C1CCC1 ZINC000738051565 1050521283 /nfs/dbraw/zinc/52/12/83/1050521283.db2.gz AJIMEUSJXZRYOF-UHFFFAOYSA-N 1 2 303.431 4.013 20 0 DIADLO Cc1nn(C[N@H+]2C[C@@H](c3ccccc3C)C[C@@H]2C)c(=S)s1 ZINC000738054889 1050523618 /nfs/dbraw/zinc/52/36/18/1050523618.db2.gz QGNAIHXVBANVLT-JSGCOSHPSA-N 1 2 319.499 4.126 20 0 DIADLO Cc1nn(C[N@@H+]2C[C@@H](c3ccccc3C)C[C@@H]2C)c(=S)s1 ZINC000738054889 1050523630 /nfs/dbraw/zinc/52/36/30/1050523630.db2.gz QGNAIHXVBANVLT-JSGCOSHPSA-N 1 2 319.499 4.126 20 0 DIADLO Cc1nn(C[N@H+]2C[C@@H](c3ccccc3C)C[C@H]2C)c(=S)s1 ZINC000738054891 1050524373 /nfs/dbraw/zinc/52/43/73/1050524373.db2.gz QGNAIHXVBANVLT-OCCSQVGLSA-N 1 2 319.499 4.126 20 0 DIADLO Cc1nn(C[N@@H+]2C[C@@H](c3ccccc3C)C[C@H]2C)c(=S)s1 ZINC000738054891 1050524390 /nfs/dbraw/zinc/52/43/90/1050524390.db2.gz QGNAIHXVBANVLT-OCCSQVGLSA-N 1 2 319.499 4.126 20 0 DIADLO Cc1c[nH+]c(CCSCCc2noc3ccccc23)c(C)c1 ZINC000594561605 1050535842 /nfs/dbraw/zinc/53/58/42/1050535842.db2.gz FWQCNVQDSOHOAE-UHFFFAOYSA-N 1 2 312.438 4.358 20 0 DIADLO CC(C)C1=[NH+]CCc2ccc(-c3cc(F)c(O)cc3F)cc21 ZINC001211360745 1050556186 /nfs/dbraw/zinc/55/61/86/1050556186.db2.gz WBQYHRIQGIQQTA-UHFFFAOYSA-N 1 2 301.336 4.339 20 0 DIADLO CC[C@@](C)(NC(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000738918969 1050557054 /nfs/dbraw/zinc/55/70/54/1050557054.db2.gz DRQQCCCPCBUERF-LJQANCHMSA-N 1 2 322.412 4.090 20 0 DIADLO CC1(C)CCC[N@H+](Cc2ccc(Cl)nc2C(F)(F)F)C1 ZINC000787246383 1050574563 /nfs/dbraw/zinc/57/45/63/1050574563.db2.gz NWYINSKTCUDONR-UHFFFAOYSA-N 1 2 306.759 4.376 20 0 DIADLO CC1(C)CCC[N@@H+](Cc2ccc(Cl)nc2C(F)(F)F)C1 ZINC000787246383 1050574575 /nfs/dbraw/zinc/57/45/75/1050574575.db2.gz NWYINSKTCUDONR-UHFFFAOYSA-N 1 2 306.759 4.376 20 0 DIADLO CN(c1ccc(Nc2cnn(C(F)F)c2)c[nH+]1)C1CCCCC1 ZINC001212613993 1050574904 /nfs/dbraw/zinc/57/49/04/1050574904.db2.gz APXSUIZFVXSKGY-UHFFFAOYSA-N 1 2 321.375 4.186 20 0 DIADLO CN(c1ccc(Nc2ccc(F)nc2F)c[nH+]1)C1CCCCC1 ZINC001212613982 1050575070 /nfs/dbraw/zinc/57/50/70/1050575070.db2.gz AFXQRJOKIMYFKQ-UHFFFAOYSA-N 1 2 318.371 4.267 20 0 DIADLO CCCCCC(CCCCC)NC(=O)[C@H]1CCc2[nH+]ccn2C1 ZINC000787249961 1050578519 /nfs/dbraw/zinc/57/85/19/1050578519.db2.gz NFEYYEVSBNIELZ-INIZCTEOSA-N 1 2 319.493 4.091 20 0 DIADLO CC(=O)c1oc2cccnc2c1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213087012 1050582851 /nfs/dbraw/zinc/58/28/51/1050582851.db2.gz HAXKNPHRYNSNSG-UHFFFAOYSA-N 1 2 318.336 4.164 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1ccc2ccccc2n1)c1ccco1 ZINC000174328722 1050583072 /nfs/dbraw/zinc/58/30/72/1050583072.db2.gz BTOUDWFJSRELQK-IBGZPJMESA-N 1 2 324.424 4.331 20 0 DIADLO Fc1ncc(C(F)(F)F)cc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213088120 1050583361 /nfs/dbraw/zinc/58/33/61/1050583361.db2.gz QAEUYDYPKOYQKL-UHFFFAOYSA-N 1 2 322.265 4.373 20 0 DIADLO Nc1ccc(N(c2ccc(-c3[nH]cc[nH+]3)cc2)C2CCCC2)nc1 ZINC001213087901 1050583949 /nfs/dbraw/zinc/58/39/49/1050583949.db2.gz GMONVDPRSSDDGY-UHFFFAOYSA-N 1 2 319.412 4.135 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3cc(-c4ccncn4)cs3)cc2)[nH]1 ZINC001213087352 1050584419 /nfs/dbraw/zinc/58/44/19/1050584419.db2.gz OTAHWOZIXKEOJB-UHFFFAOYSA-N 1 2 319.393 4.339 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3cccnc3-c3ccccn3)cc2)[nH]1 ZINC001213087826 1050584477 /nfs/dbraw/zinc/58/44/77/1050584477.db2.gz BSCRTJDFAWZNCU-UHFFFAOYSA-N 1 2 313.364 4.277 20 0 DIADLO Nc1cc(F)cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1Cl ZINC001213092071 1050585646 /nfs/dbraw/zinc/58/56/46/1050585646.db2.gz ZRCXILLABYSKNB-UHFFFAOYSA-N 1 2 302.740 4.195 20 0 DIADLO Nc1ccc(C(F)(F)F)cc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213089143 1050585780 /nfs/dbraw/zinc/58/57/80/1050585780.db2.gz WNTCZPQMTTZJPC-UHFFFAOYSA-N 1 2 318.302 4.421 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3ccc(-c4cnco4)cc3)cc2)[nH]1 ZINC001213089186 1050586303 /nfs/dbraw/zinc/58/63/03/1050586303.db2.gz YDCYUUHDDKYOJG-UHFFFAOYSA-N 1 2 302.337 4.475 20 0 DIADLO Cc1cc(=O)c2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2o1 ZINC001213090993 1050587148 /nfs/dbraw/zinc/58/71/48/1050587148.db2.gz QBRTYHHYBIIZGM-UHFFFAOYSA-N 1 2 317.348 4.235 20 0 DIADLO COc1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c2ncccc12 ZINC001213090033 1050587206 /nfs/dbraw/zinc/58/72/06/1050587206.db2.gz QPOMBZGGIQUMBG-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO Cc1cccc(N)c1Nc1ccc(N(C)C2CCCCC2)[nH+]c1 ZINC001212614439 1050594775 /nfs/dbraw/zinc/59/47/75/1050594775.db2.gz NKRBLBUEXLYHIZ-UHFFFAOYSA-N 1 2 310.445 4.485 20 0 DIADLO COc1ncc(C[N@H+](C)[C@H](C)c2ccccc2Cl)cc1F ZINC001144472907 1050596335 /nfs/dbraw/zinc/59/63/35/1050596335.db2.gz HRCOWAAROXIRTG-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1ncc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)cc1F ZINC001144472907 1050596343 /nfs/dbraw/zinc/59/63/43/1050596343.db2.gz HRCOWAAROXIRTG-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO CN(c1ccc(Nc2ccc(O)cc2O)c[nH+]1)C1CCCCC1 ZINC001212614666 1050596970 /nfs/dbraw/zinc/59/69/70/1050596970.db2.gz UCOWZGBHWMYPQH-UHFFFAOYSA-N 1 2 313.401 4.005 20 0 DIADLO Cc1cc(N)nc(SCSCc2ccc(Cl)cc2)[nH+]1 ZINC000787489648 1050603779 /nfs/dbraw/zinc/60/37/79/1050603779.db2.gz RIHMESOLERLBKU-UHFFFAOYSA-N 1 2 311.863 4.004 20 0 DIADLO CC[C@]1(C)CCC[C@@H]1[NH2+]c1ccc(N2CCC(O)CC2)cc1 ZINC000845916539 1050630417 /nfs/dbraw/zinc/63/04/17/1050630417.db2.gz WUEHQBUOWSVOGD-RBUKOAKNSA-N 1 2 302.462 4.028 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(F)c(O)cc1F ZINC001144648779 1050640214 /nfs/dbraw/zinc/64/02/14/1050640214.db2.gz WVPQGIHBWLHQKM-KRWDZBQOSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc(F)c(O)cc1F ZINC001144648779 1050640220 /nfs/dbraw/zinc/64/02/20/1050640220.db2.gz WVPQGIHBWLHQKM-KRWDZBQOSA-N 1 2 303.352 4.316 20 0 DIADLO CC[C@H]([NH2+]Cc1occc1Br)c1ccccc1OC ZINC000227366264 1050663611 /nfs/dbraw/zinc/66/36/11/1050663611.db2.gz MIKZXCLLDXKKMK-ZDUSSCGKSA-N 1 2 324.218 4.292 20 0 DIADLO CC1(F)CC[NH+](Cc2cc(Cl)cc(Br)c2)CC1 ZINC001144685484 1050657454 /nfs/dbraw/zinc/65/74/54/1050657454.db2.gz UCZCVLYDMVJIKF-UHFFFAOYSA-N 1 2 320.633 4.427 20 0 DIADLO CC(C)(C)CCCCCC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC001144684087 1050658136 /nfs/dbraw/zinc/65/81/36/1050658136.db2.gz XKEMLZUQJPPAEG-UHFFFAOYSA-N 1 2 305.466 4.043 20 0 DIADLO Clc1cc(Br)cc(C[N@@H+]2CCC[C@H]3C[C@H]32)c1 ZINC001144693350 1050659708 /nfs/dbraw/zinc/65/97/08/1050659708.db2.gz CWEBDGAZGXHZLB-GXFFZTMASA-N 1 2 300.627 4.087 20 0 DIADLO Clc1cc(Br)cc(C[N@H+]2CCC[C@H]3C[C@H]32)c1 ZINC001144693350 1050659714 /nfs/dbraw/zinc/65/97/14/1050659714.db2.gz CWEBDGAZGXHZLB-GXFFZTMASA-N 1 2 300.627 4.087 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)OCc1ccc(Cl)cc1)c1ccccc1 ZINC000741150660 1050663567 /nfs/dbraw/zinc/66/35/67/1050663567.db2.gz KPGJZDQSYAISPR-KRWDZBQOSA-N 1 2 317.816 4.076 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)OCc1ccc(Cl)cc1)c1ccccc1 ZINC000741150660 1050663575 /nfs/dbraw/zinc/66/35/75/1050663575.db2.gz KPGJZDQSYAISPR-KRWDZBQOSA-N 1 2 317.816 4.076 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cncc(Br)c1 ZINC001213491610 1050667551 /nfs/dbraw/zinc/66/75/51/1050667551.db2.gz NYJCLZYKOONQPO-UHFFFAOYSA-N 1 2 304.191 4.169 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cc(-c2cccnc2)ccn1 ZINC001213489565 1050669032 /nfs/dbraw/zinc/66/90/32/1050669032.db2.gz SITXZHKKJTVMPS-UHFFFAOYSA-N 1 2 302.381 4.468 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccnn1-c1ccc(F)cc1 ZINC001213494674 1050670220 /nfs/dbraw/zinc/67/02/20/1050670220.db2.gz FQBVOWLBWDLYHY-UHFFFAOYSA-N 1 2 308.360 4.336 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cc(Br)ncc1F ZINC001213494746 1050670468 /nfs/dbraw/zinc/67/04/68/1050670468.db2.gz HWRWQSMGCVQSJN-UHFFFAOYSA-N 1 2 322.181 4.308 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(Br)cn1 ZINC001213489563 1050670443 /nfs/dbraw/zinc/67/04/43/1050670443.db2.gz SEUKJSMDHOFAKX-UHFFFAOYSA-N 1 2 304.191 4.169 20 0 DIADLO Cc1ccc(Nc2cc(C3CC3)c[nH+]c2C)c(Br)n1 ZINC001213491492 1050670586 /nfs/dbraw/zinc/67/05/86/1050670586.db2.gz LGTXLNHHHICJAI-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1ncc(Br)cc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213492170 1050670654 /nfs/dbraw/zinc/67/06/54/1050670654.db2.gz YKYRIZPLQCKRHI-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnc2c(C3CCC3)cnn2c1 ZINC001213497486 1050671696 /nfs/dbraw/zinc/67/16/96/1050671696.db2.gz QZZWTPNIWHBASB-UHFFFAOYSA-N 1 2 319.412 4.321 20 0 DIADLO COc1cc(Nc2cc(C3CC3)c[nH+]c2C)ncc1C(F)(F)F ZINC001213497504 1050671944 /nfs/dbraw/zinc/67/19/44/1050671944.db2.gz RWDCSNKUCJCULU-UHFFFAOYSA-N 1 2 323.318 4.433 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnc2c(C(C)(C)C)cnn2c1 ZINC001213497048 1050671991 /nfs/dbraw/zinc/67/19/91/1050671991.db2.gz GCGLAUXSGSXLAA-UHFFFAOYSA-N 1 2 321.428 4.351 20 0 DIADLO Cc1ncc(C2CC2)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001213499585 1050672024 /nfs/dbraw/zinc/67/20/24/1050672024.db2.gz QMXFRUBWINIMCU-UHFFFAOYSA-N 1 2 304.397 4.256 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cncc(OC(F)(F)F)c1 ZINC001213497295 1050672631 /nfs/dbraw/zinc/67/26/31/1050672631.db2.gz MRAWJIHGDXHYGL-UHFFFAOYSA-N 1 2 309.291 4.305 20 0 DIADLO COC(=O)/C=C/c1cccc(Nc2cc(C3CC3)c[nH+]c2C)c1 ZINC001213503416 1050673677 /nfs/dbraw/zinc/67/36/77/1050673677.db2.gz FAHLNOKAKZYBTM-RMKNXTFCSA-N 1 2 308.381 4.197 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2c(c1)NC(=O)C2(C)C ZINC001213501100 1050674303 /nfs/dbraw/zinc/67/43/03/1050674303.db2.gz HYVYZIYSOGMXJK-UHFFFAOYSA-N 1 2 307.397 4.241 20 0 DIADLO COc1ccc(Nc2cc(C3CC3)c[nH+]c2C)c(OC)c1F ZINC001213500944 1050674367 /nfs/dbraw/zinc/67/43/67/1050674367.db2.gz FNLIEEUVOWOSFC-UHFFFAOYSA-N 1 2 302.349 4.167 20 0 DIADLO COC(=O)C1(c2ccc(Nc3cc(C4CC4)c[nH+]c3C)cc2)CC1 ZINC001213501212 1050674522 /nfs/dbraw/zinc/67/45/22/1050674522.db2.gz MUUJKEPBPIVFPU-UHFFFAOYSA-N 1 2 322.408 4.216 20 0 DIADLO CC(=O)N1CCCc2ccc(Nc3cc(C4CC4)c[nH+]c3C)cc21 ZINC001213500913 1050674803 /nfs/dbraw/zinc/67/48/03/1050674803.db2.gz CIGDQTCURUNLDY-UHFFFAOYSA-N 1 2 321.424 4.310 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2c(c1)C(=O)NCC2(C)C ZINC001213503588 1050674865 /nfs/dbraw/zinc/67/48/65/1050674865.db2.gz NQLVMMAVNRAPBS-UHFFFAOYSA-N 1 2 321.424 4.032 20 0 DIADLO Cc1ccc(C(=O)NC2CC2)cc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213503784 1050675054 /nfs/dbraw/zinc/67/50/54/1050675054.db2.gz YBIMBHWZVMDCGO-UHFFFAOYSA-N 1 2 321.424 4.212 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2c(c1)N(C)C(=O)C2(C)C ZINC001213503628 1050675378 /nfs/dbraw/zinc/67/53/78/1050675378.db2.gz POJRQRDLKUREMW-UHFFFAOYSA-N 1 2 321.424 4.265 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@@H](C)C2CCCC2)c2ccc(Cl)cc2)no1 ZINC000179894703 1050676619 /nfs/dbraw/zinc/67/66/19/1050676619.db2.gz DPQAXADHENLJDF-ZBEGNZNMSA-N 1 2 319.836 4.289 20 0 DIADLO CCOC(=O)c1cc(Nc2c[nH+]c(C)cc2C)ccc1Cl ZINC001213518351 1050676945 /nfs/dbraw/zinc/67/69/45/1050676945.db2.gz JLLLTUUUCDUQDH-UHFFFAOYSA-N 1 2 304.777 4.272 20 0 DIADLO CCOC(=O)Cc1ccc(Nc2c[nH+]c(C)cc2C)c(Cl)c1 ZINC001213518472 1050677772 /nfs/dbraw/zinc/67/77/72/1050677772.db2.gz QAGRCDOXPGONHW-UHFFFAOYSA-N 1 2 318.804 4.201 20 0 DIADLO Cc1c[nH+]cc(Nc2cc(-c3ccc(F)c(F)c3)no2)c1C ZINC001213522919 1050678476 /nfs/dbraw/zinc/67/84/76/1050678476.db2.gz JMGCCBKYSREJIE-UHFFFAOYSA-N 1 2 301.296 4.375 20 0 DIADLO CCOC(=O)c1cnc2cccc(Nc3c[nH+]c(C)cc3C)c2c1 ZINC001213521105 1050678529 /nfs/dbraw/zinc/67/85/29/1050678529.db2.gz UGFSZXKRAXTPHK-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO COc1ccccc1Cn1ncc(C)c1Nc1c[nH+]cc(C)c1C ZINC001213527215 1050679779 /nfs/dbraw/zinc/67/97/79/1050679779.db2.gz COOSHGUKPHCSPO-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1cc(Nc2c[nH+]cc(C)c2C)n(Cc2ccc(F)cc2)n1 ZINC001213527319 1050680251 /nfs/dbraw/zinc/68/02/51/1050680251.db2.gz FVBUORDKSGIRHO-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO Cc1c[nH+]cc(Nc2nc(Cl)c(Cl)nc2Cl)c1C ZINC001213528618 1050680324 /nfs/dbraw/zinc/68/03/24/1050680324.db2.gz IMKKGPVCDPPLLL-UHFFFAOYSA-N 1 2 303.580 4.192 20 0 DIADLO Cc1c[nH+]cc(Nc2ccnc(NC(=O)OC(C)(C)C)c2)c1C ZINC001213523121 1050680342 /nfs/dbraw/zinc/68/03/42/1050680342.db2.gz LOJHCQLJZSOXEW-UHFFFAOYSA-N 1 2 314.389 4.184 20 0 DIADLO Cc1c[nH+]cc(Nc2nc(C)c(C)cc2Br)c1C ZINC001213527678 1050680489 /nfs/dbraw/zinc/68/04/89/1050680489.db2.gz YHXIPDDVWQGTJT-UHFFFAOYSA-N 1 2 306.207 4.216 20 0 DIADLO Cc1cc(N)c(Nc2c[nH+]cc(C)c2C)c(Br)c1 ZINC001213532769 1050681948 /nfs/dbraw/zinc/68/19/48/1050681948.db2.gz UAZVAMHSSYUVAA-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO CCOC(=O)c1cnc2cc(Nc3c[nH+]cc(C)c3C)ccc2c1 ZINC001213534259 1050682741 /nfs/dbraw/zinc/68/27/41/1050682741.db2.gz UILQLIATXAKHNB-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(-c3ccc(N)c(O)c3)cc2O)c1C ZINC001213534287 1050682764 /nfs/dbraw/zinc/68/27/64/1050682764.db2.gz VKGKTNSYZVQRDU-UHFFFAOYSA-N 1 2 321.380 4.102 20 0 DIADLO Cc1c[nH+]cc(Nc2cccc([C@@H]3CN4C=CSC4=N3)c2)c1C ZINC001213534061 1050682995 /nfs/dbraw/zinc/68/29/95/1050682995.db2.gz KOFAYHYZJBFXTC-KRWDZBQOSA-N 1 2 322.437 4.373 20 0 DIADLO C[N@H+](Cc1ccc(Cl)c(Cl)c1)Cc1cnc(Cl)cn1 ZINC000788473375 1050688522 /nfs/dbraw/zinc/68/85/22/1050688522.db2.gz HXMZWAIRKFGTAM-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)c(Cl)c1)Cc1cnc(Cl)cn1 ZINC000788473375 1050688528 /nfs/dbraw/zinc/68/85/28/1050688528.db2.gz HXMZWAIRKFGTAM-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO FC(F)(F)Oc1cc[nH+]c(Nc2ccccc2N2CCCC2)c1 ZINC001213605623 1050693071 /nfs/dbraw/zinc/69/30/71/1050693071.db2.gz HWXOAHLBFLGGCH-UHFFFAOYSA-N 1 2 323.318 4.324 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC001144744583 1050694795 /nfs/dbraw/zinc/69/47/95/1050694795.db2.gz ADLGNNKYYIUVGL-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC001144744583 1050694801 /nfs/dbraw/zinc/69/48/01/1050694801.db2.gz ADLGNNKYYIUVGL-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1csc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)c1C ZINC001213606999 1050694993 /nfs/dbraw/zinc/69/49/93/1050694993.db2.gz ZWBVUQKNFWLQOE-UHFFFAOYSA-N 1 2 322.393 4.268 20 0 DIADLO Cc1csc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)c1C ZINC001213606698 1050695220 /nfs/dbraw/zinc/69/52/20/1050695220.db2.gz QFLAWKRERNAHRZ-UHFFFAOYSA-N 1 2 322.393 4.268 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001144754855 1050701902 /nfs/dbraw/zinc/70/19/02/1050701902.db2.gz OWOZUQYLRYXSEY-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001144754855 1050701916 /nfs/dbraw/zinc/70/19/16/1050701916.db2.gz OWOZUQYLRYXSEY-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc3scnc3c2)[C@@H](c2ccccc2)CO1 ZINC001144744084 1050703713 /nfs/dbraw/zinc/70/37/13/1050703713.db2.gz JCELZIHXEUAOEU-KBXCAEBGSA-N 1 2 324.449 4.258 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc3scnc3c2)[C@@H](c2ccccc2)CO1 ZINC001144744084 1050703730 /nfs/dbraw/zinc/70/37/30/1050703730.db2.gz JCELZIHXEUAOEU-KBXCAEBGSA-N 1 2 324.449 4.258 20 0 DIADLO Cc1nc(N(C)[C@@H](C)c2ccccc2Cl)c2c([nH+]1)CCC2 ZINC001157367676 1050713520 /nfs/dbraw/zinc/71/35/20/1050713520.db2.gz JCTORCVXOVMWBW-NSHDSACASA-N 1 2 301.821 4.125 20 0 DIADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1cc(F)c(Cl)cc1F ZINC000788618718 1050719117 /nfs/dbraw/zinc/71/91/17/1050719117.db2.gz AMBUCVFFNRINGC-MRVPVSSYSA-N 1 2 314.763 4.328 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@@H+]1CC[C@H](CC(C)(C)C)C1 ZINC001171229968 1050726706 /nfs/dbraw/zinc/72/67/06/1050726706.db2.gz LPLKZTXJICOTDK-CZUORRHYSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@H+]1CC[C@H](CC(C)(C)C)C1 ZINC001171229968 1050726723 /nfs/dbraw/zinc/72/67/23/1050726723.db2.gz LPLKZTXJICOTDK-CZUORRHYSA-N 1 2 323.864 4.312 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)c1ccc(-c2ccccc2)cc1 ZINC000741739561 1050733361 /nfs/dbraw/zinc/73/33/61/1050733361.db2.gz BZBCIQOOQNUZOU-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO CC1=CC[C@H]([NH2+]c2ccc(N3C[C@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000788734635 1050742715 /nfs/dbraw/zinc/74/27/15/1050742715.db2.gz HMYPLFTUPVVZNL-ULQDDVLXSA-N 1 2 300.446 4.211 20 0 DIADLO Cc1cc2cc(Nc3cccc(Cn4cc[nH+]c4)c3)ccc2[nH]1 ZINC001213791639 1050743357 /nfs/dbraw/zinc/74/33/57/1050743357.db2.gz MSGJZLFKBZVSGT-UHFFFAOYSA-N 1 2 302.381 4.465 20 0 DIADLO COc1cccc(Nc2ccc[nH+]c2N2CCCC2)c1C1CC1 ZINC001213797199 1050744486 /nfs/dbraw/zinc/74/44/86/1050744486.db2.gz QLTSVFGOASJBLM-UHFFFAOYSA-N 1 2 309.413 4.311 20 0 DIADLO COc1ccc(C(C)C)cc1C[N@H+](C)Cc1c(C)noc1C ZINC000846769349 1050745222 /nfs/dbraw/zinc/74/52/22/1050745222.db2.gz JPIPADZYMJLFAJ-UHFFFAOYSA-N 1 2 302.418 4.055 20 0 DIADLO COc1ccc(C(C)C)cc1C[N@@H+](C)Cc1c(C)noc1C ZINC000846769349 1050745235 /nfs/dbraw/zinc/74/52/35/1050745235.db2.gz JPIPADZYMJLFAJ-UHFFFAOYSA-N 1 2 302.418 4.055 20 0 DIADLO Cc1ncc(C(F)(F)F)cc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001213830700 1050755732 /nfs/dbraw/zinc/75/57/32/1050755732.db2.gz GQRFBSAKROYDBU-UHFFFAOYSA-N 1 2 318.302 4.338 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc(Cl)nc(C3CC3)c2)c(C)[nH+]1 ZINC000846796860 1050757875 /nfs/dbraw/zinc/75/78/75/1050757875.db2.gz MUOVEYWMWQJTJX-UHFFFAOYSA-N 1 2 315.804 4.185 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(N2CCCCC2)cc1F ZINC001213840163 1050761227 /nfs/dbraw/zinc/76/12/27/1050761227.db2.gz SFNGWOVFYISQNZ-UHFFFAOYSA-N 1 2 324.403 4.046 20 0 DIADLO C[C@@H]([NH2+]c1ccc(N2CCOCC2)cc1)C1CCC(F)(F)CC1 ZINC000788986704 1050775029 /nfs/dbraw/zinc/77/50/29/1050775029.db2.gz YWBQOJIAVXUZBX-CQSZACIVSA-N 1 2 324.415 4.149 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](C)Cc1ccc(C(C)C)cc1 ZINC000060374602 1050783233 /nfs/dbraw/zinc/78/32/33/1050783233.db2.gz UQNZLTITQPUMKR-UHFFFAOYSA-N 1 2 305.853 4.137 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](C)Cc1ccc(C(C)C)cc1 ZINC000060374602 1050783248 /nfs/dbraw/zinc/78/32/48/1050783248.db2.gz UQNZLTITQPUMKR-UHFFFAOYSA-N 1 2 305.853 4.137 20 0 DIADLO CCCCCC[C@@H](C)C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000742056364 1050797572 /nfs/dbraw/zinc/79/75/72/1050797572.db2.gz SYRANTHGIUYJNH-HZPDHXFCSA-N 1 2 307.482 4.021 20 0 DIADLO CC(C)C[C@@H](C(=O)N1CCC[C@@H](C(C)(C)C)CC1)n1cc[nH+]c1 ZINC001146669295 1050835756 /nfs/dbraw/zinc/83/57/56/1050835756.db2.gz MOCSKWMOXKPDOW-SJORKVTESA-N 1 2 319.493 4.145 20 0 DIADLO CCOC(=O)c1c[nH+]c2ccccc2c1N1CCC2(CCCC2)C1 ZINC000742425726 1050846444 /nfs/dbraw/zinc/84/64/44/1050846444.db2.gz JYOCGKWURRNMQU-UHFFFAOYSA-N 1 2 324.424 4.182 20 0 DIADLO Cc1ccc(O)c(Nc2cc[nH+]c(NC(=O)OC(C)(C)C)c2)c1 ZINC001214216572 1050848049 /nfs/dbraw/zinc/84/80/49/1050848049.db2.gz CDUAFOVKJBXOLV-UHFFFAOYSA-N 1 2 315.373 4.186 20 0 DIADLO Cn1c[nH+]c2ccc(NCc3ccccc3-c3cccnc3)cc21 ZINC001170114474 1050873910 /nfs/dbraw/zinc/87/39/10/1050873910.db2.gz LJNZPEBDKNZXSA-UHFFFAOYSA-N 1 2 314.392 4.247 20 0 DIADLO CC[C@H](Cc1ccccc1)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000601945351 1050879930 /nfs/dbraw/zinc/87/99/30/1050879930.db2.gz JVAZGNIRWCNHSP-QGZVFWFLSA-N 1 2 319.408 4.080 20 0 DIADLO CCCCCC[C@@H](C)NC(=O)c1ccc(Cn2cc[nH+]c2)cc1 ZINC000060615008 1050885510 /nfs/dbraw/zinc/88/55/10/1050885510.db2.gz HSIHWFILDBZYSR-MRXNPFEDSA-N 1 2 313.445 4.020 20 0 DIADLO C/C(=C/C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C(C)(C)C ZINC000742600851 1050899573 /nfs/dbraw/zinc/89/95/73/1050899573.db2.gz WBJWQOIBRIWGPH-XFXZXTDPSA-N 1 2 317.820 4.457 20 0 DIADLO O=C(Nc1ccsc1)[C@@H]1CCC[N@H+]1Cc1ccc(Cl)cc1 ZINC001147765451 1050900717 /nfs/dbraw/zinc/90/07/17/1050900717.db2.gz UMYDJZSNOONEPD-HNNXBMFYSA-N 1 2 320.845 4.005 20 0 DIADLO O=C(Nc1ccsc1)[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1 ZINC001147765451 1050900732 /nfs/dbraw/zinc/90/07/32/1050900732.db2.gz UMYDJZSNOONEPD-HNNXBMFYSA-N 1 2 320.845 4.005 20 0 DIADLO CCCCCC[C@@](C)(CC)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000742634341 1050907391 /nfs/dbraw/zinc/90/73/91/1050907391.db2.gz NXBRMYFMGNHFMZ-PKOBYXMFSA-N 1 2 319.493 4.433 20 0 DIADLO CCCCCC[C@](C)(CC)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000742634337 1050907612 /nfs/dbraw/zinc/90/76/12/1050907612.db2.gz NXBRMYFMGNHFMZ-HKUYNNGSSA-N 1 2 319.493 4.433 20 0 DIADLO COc1ccc(C)c(F)c1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001214627043 1050966548 /nfs/dbraw/zinc/96/65/48/1050966548.db2.gz FQLGUOGZUKXZDZ-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO COc1c(F)cc(Nc2ccc(C)c[nH+]2)cc1C(F)(F)F ZINC001214633179 1050967290 /nfs/dbraw/zinc/96/72/90/1050967290.db2.gz IDFHPWHYUGBGKR-UHFFFAOYSA-N 1 2 300.255 4.300 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1ccc(CO)c(C(F)(F)F)c1 ZINC001214681635 1050978117 /nfs/dbraw/zinc/97/81/17/1050978117.db2.gz QTNMVVSJGFAKEB-UHFFFAOYSA-N 1 2 310.319 4.207 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2nnc(-c3cccs3)o2)c(C)o1 ZINC000348105462 1050989307 /nfs/dbraw/zinc/98/93/07/1050989307.db2.gz DCQXCBYKVYCMEC-QWRGUYRKSA-N 1 2 317.414 4.420 20 0 DIADLO CC[N@H+](Cc1ccncc1)[C@@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000348123404 1050990411 /nfs/dbraw/zinc/99/04/11/1050990411.db2.gz FFOOGBKKAOTAFJ-HNNXBMFYSA-N 1 2 322.412 4.023 20 0 DIADLO CC[N@@H+](Cc1ccncc1)[C@@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000348123404 1050990418 /nfs/dbraw/zinc/99/04/18/1050990418.db2.gz FFOOGBKKAOTAFJ-HNNXBMFYSA-N 1 2 322.412 4.023 20 0 DIADLO c1ccc(N2Cc3cccc(N[C@@H]4CCC45CCC5)c3C2)[nH+]c1 ZINC000282735376 1050990983 /nfs/dbraw/zinc/99/09/83/1050990983.db2.gz MVLBMSZCUUWAIA-GOSISDBHSA-N 1 2 305.425 4.346 20 0 DIADLO CC[N@H+](Cc1ccncc1)[C@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000348123405 1050991821 /nfs/dbraw/zinc/99/18/21/1050991821.db2.gz FFOOGBKKAOTAFJ-OAHLLOKOSA-N 1 2 322.412 4.023 20 0 DIADLO CC[N@@H+](Cc1ccncc1)[C@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000348123405 1050991833 /nfs/dbraw/zinc/99/18/33/1050991833.db2.gz FFOOGBKKAOTAFJ-OAHLLOKOSA-N 1 2 322.412 4.023 20 0 DIADLO CC(=O)c1cc(Nc2cc[nH+]c3ccc(Cl)cc23)cs1 ZINC001214773559 1050999384 /nfs/dbraw/zinc/99/93/84/1050999384.db2.gz GNEAVVMRGJQYTA-UHFFFAOYSA-N 1 2 302.786 4.318 20 0 DIADLO Cc1cc(NC(=[NH2+])c2cccnc2Cl)ccc1OC(C)C ZINC001171352178 1051009892 /nfs/dbraw/zinc/00/98/92/1051009892.db2.gz SNUKOMZRDAHCAG-UHFFFAOYSA-N 1 2 303.793 4.268 20 0 DIADLO CC1(C)CCc2cc(NC(=[NH2+])c3cccnc3Cl)ccc2O1 ZINC001171351357 1051012078 /nfs/dbraw/zinc/01/20/78/1051012078.db2.gz HYBWNFCPBIIDAM-UHFFFAOYSA-N 1 2 315.804 4.276 20 0 DIADLO CCCCC[C@@H](C)CC(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000743318723 1051012019 /nfs/dbraw/zinc/01/20/19/1051012019.db2.gz AODHSSKWZCUNNO-MRXNPFEDSA-N 1 2 313.445 4.095 20 0 DIADLO CCCCC[C@H](C)CC(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000743318721 1051012713 /nfs/dbraw/zinc/01/27/13/1051012713.db2.gz AODHSSKWZCUNNO-INIZCTEOSA-N 1 2 313.445 4.095 20 0 DIADLO COCOc1c(C)cccc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001214846565 1051014813 /nfs/dbraw/zinc/01/48/13/1051014813.db2.gz IBYCALHAYFYIES-UHFFFAOYSA-N 1 2 317.776 4.022 20 0 DIADLO COc1c(F)cc(Nc2cccc(-n3cc[nH+]c3)c2)cc1Cl ZINC001214971680 1051040033 /nfs/dbraw/zinc/04/00/33/1051040033.db2.gz DMISBEMDYBUELU-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2cccc(F)c2)C(C)(C)C)o1 ZINC000181061134 1051050114 /nfs/dbraw/zinc/05/01/14/1051050114.db2.gz PZBZPLAFPXCDLO-OAHLLOKOSA-N 1 2 305.397 4.209 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)nc(Cl)c1 ZINC000791583143 1051059711 /nfs/dbraw/zinc/05/97/11/1051059711.db2.gz LKWZZRANETYELB-CBAPKCEASA-N 1 2 313.150 4.161 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(Cl)nc(Cl)c1 ZINC000791583143 1051059724 /nfs/dbraw/zinc/05/97/24/1051059724.db2.gz LKWZZRANETYELB-CBAPKCEASA-N 1 2 313.150 4.161 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(F)n1)c1nc(-c2ccccc2)cs1 ZINC000773092081 1051060353 /nfs/dbraw/zinc/06/03/53/1051060353.db2.gz YLEWZOVECVABAO-GFCCVEGCSA-N 1 2 313.401 4.195 20 0 DIADLO CCCCn1nc(C)c(C[NH2+]Cc2ccc(Cl)o2)c1Cl ZINC000743767870 1051063949 /nfs/dbraw/zinc/06/39/49/1051063949.db2.gz HOSGBNFZAMMWST-UHFFFAOYSA-N 1 2 316.232 4.181 20 0 DIADLO Cc1cn2cccc(Nc3c(F)c(F)ccc3OC(C)C)c2[nH+]1 ZINC001215073942 1051068899 /nfs/dbraw/zinc/06/88/99/1051068899.db2.gz MCNZTADUQVKWOU-UHFFFAOYSA-N 1 2 317.339 4.452 20 0 DIADLO COc1cc(F)cc(CNc2ccc3c(cccc3OC)[nH+]2)c1 ZINC001171411203 1051099882 /nfs/dbraw/zinc/09/98/82/1051099882.db2.gz PHNBZNKGYIGPET-UHFFFAOYSA-N 1 2 312.344 4.003 20 0 DIADLO CC(C)Oc1ccc(F)c(Nc2cccn3cc[nH+]c23)c1F ZINC001215172294 1051101808 /nfs/dbraw/zinc/10/18/08/1051101808.db2.gz BJJPQSWSOOLVRB-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO CC(C)Oc1ccc(F)c(Nc2ccc3c(c2)[nH+]cn3C)c1F ZINC001215176761 1051104742 /nfs/dbraw/zinc/10/47/42/1051104742.db2.gz VEKIUCRSEDVKFH-UHFFFAOYSA-N 1 2 317.339 4.382 20 0 DIADLO Cc1cc(C)cc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)c1 ZINC001215190122 1051108331 /nfs/dbraw/zinc/10/83/31/1051108331.db2.gz GNYDDGFVXXBRJL-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cn2ccc(C(F)(F)F)n2)cc1C ZINC000744146367 1051122124 /nfs/dbraw/zinc/12/21/24/1051122124.db2.gz BEJTYXJXGQPETP-HNNXBMFYSA-N 1 2 323.362 4.313 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cn2ccc(C(F)(F)F)n2)cc1C ZINC000744146367 1051122129 /nfs/dbraw/zinc/12/21/29/1051122129.db2.gz BEJTYXJXGQPETP-HNNXBMFYSA-N 1 2 323.362 4.313 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)nc(Cl)c2)cc1 ZINC000744200232 1051130751 /nfs/dbraw/zinc/13/07/51/1051130751.db2.gz ITJAZGSUXUUWTR-AWEZNQCLSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@H+]2Cc2cc(Cl)nc(Cl)c2)cc1 ZINC000744200232 1051130755 /nfs/dbraw/zinc/13/07/55/1051130755.db2.gz ITJAZGSUXUUWTR-AWEZNQCLSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)nc(Cl)c2)cc1 ZINC000744200234 1051130825 /nfs/dbraw/zinc/13/08/25/1051130825.db2.gz ITJAZGSUXUUWTR-CQSZACIVSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@H]2CCC[N@H+]2Cc2cc(Cl)nc(Cl)c2)cc1 ZINC000744200234 1051130838 /nfs/dbraw/zinc/13/08/38/1051130838.db2.gz ITJAZGSUXUUWTR-CQSZACIVSA-N 1 2 323.223 4.431 20 0 DIADLO c1nc2cccc(CNc3cc4c5c(c3)CCC[NH+]5CCC4)c2o1 ZINC001171456423 1051138035 /nfs/dbraw/zinc/13/80/35/1051138035.db2.gz FKLCEYQVUZVIHX-UHFFFAOYSA-N 1 2 319.408 4.139 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2c(F)ccc(C)c2F)CC2CC2)cn1 ZINC001171501513 1051156229 /nfs/dbraw/zinc/15/62/29/1051156229.db2.gz JAFDETVIIUOGJE-UHFFFAOYSA-N 1 2 316.395 4.389 20 0 DIADLO Cc1ccc(C[N@H+](Cc2c(F)ccc(C)c2F)CC2CC2)cn1 ZINC001171501513 1051156238 /nfs/dbraw/zinc/15/62/38/1051156238.db2.gz JAFDETVIIUOGJE-UHFFFAOYSA-N 1 2 316.395 4.389 20 0 DIADLO CCc1cnc(C[N@H+]2CC=C(c3c[nH]c4ccccc43)CC2)o1 ZINC000744387103 1051172375 /nfs/dbraw/zinc/17/23/75/1051172375.db2.gz WOMFTGHHTBWHAN-UHFFFAOYSA-N 1 2 307.397 4.008 20 0 DIADLO CCc1cnc(C[N@@H+]2CC=C(c3c[nH]c4ccccc43)CC2)o1 ZINC000744387103 1051172383 /nfs/dbraw/zinc/17/23/83/1051172383.db2.gz WOMFTGHHTBWHAN-UHFFFAOYSA-N 1 2 307.397 4.008 20 0 DIADLO CC[C@@H]1C[C@H](C)C[N@@H+]1Cn1nc(-c2cccs2)oc1=S ZINC000744443767 1051176864 /nfs/dbraw/zinc/17/68/64/1051176864.db2.gz OHNYGRZZAHGDRN-WDEREUQCSA-N 1 2 309.460 4.012 20 0 DIADLO CC[C@@H]1C[C@H](C)C[N@H+]1Cn1nc(-c2cccs2)oc1=S ZINC000744443767 1051176869 /nfs/dbraw/zinc/17/68/69/1051176869.db2.gz OHNYGRZZAHGDRN-WDEREUQCSA-N 1 2 309.460 4.012 20 0 DIADLO CC[C@H]1C[C@H](C)C[N@@H+]1Cn1nc(-c2cccs2)oc1=S ZINC000744443766 1051176934 /nfs/dbraw/zinc/17/69/34/1051176934.db2.gz OHNYGRZZAHGDRN-QWRGUYRKSA-N 1 2 309.460 4.012 20 0 DIADLO CC[C@H]1C[C@H](C)C[N@H+]1Cn1nc(-c2cccs2)oc1=S ZINC000744443766 1051176938 /nfs/dbraw/zinc/17/69/38/1051176938.db2.gz OHNYGRZZAHGDRN-QWRGUYRKSA-N 1 2 309.460 4.012 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2C[C@H](C)OC3(CCCCC3)C2)c1F ZINC001171636794 1051194069 /nfs/dbraw/zinc/19/40/69/1051194069.db2.gz PKEADUBHXBVOTP-AWEZNQCLSA-N 1 2 309.400 4.197 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2C[C@H](C)OC3(CCCCC3)C2)c1F ZINC001171636794 1051194081 /nfs/dbraw/zinc/19/40/81/1051194081.db2.gz PKEADUBHXBVOTP-AWEZNQCLSA-N 1 2 309.400 4.197 20 0 DIADLO O=C(C[NH2+]C1(c2ccccc2Cl)CCC1)c1ccccc1F ZINC001171700072 1051198172 /nfs/dbraw/zinc/19/81/72/1051198172.db2.gz FUOCIDVWEASQMQ-UHFFFAOYSA-N 1 2 317.791 4.331 20 0 DIADLO COc1ccc2c(c1)C[C@@H](Nc1cc3cc(F)ccc3c[nH+]1)CC2 ZINC001170410891 1051203282 /nfs/dbraw/zinc/20/32/82/1051203282.db2.gz PPZQTKMZNPWWLE-SFHVURJKSA-N 1 2 322.383 4.352 20 0 DIADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1cccc(C(F)(F)F)c1 ZINC001171778669 1051213501 /nfs/dbraw/zinc/21/35/01/1051213501.db2.gz PUNBDDIWVKODMR-CABCVRRESA-N 1 2 301.352 4.095 20 0 DIADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1cccc(C(F)(F)F)c1 ZINC001171778669 1051213508 /nfs/dbraw/zinc/21/35/08/1051213508.db2.gz PUNBDDIWVKODMR-CABCVRRESA-N 1 2 301.352 4.095 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@@H+](Cc1ccnc(Cl)c1)CC2 ZINC001171819970 1051215178 /nfs/dbraw/zinc/21/51/78/1051215178.db2.gz IIDHNBMFVPWMKI-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@H+](Cc1ccnc(Cl)c1)CC2 ZINC001171819970 1051215190 /nfs/dbraw/zinc/21/51/90/1051215190.db2.gz IIDHNBMFVPWMKI-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1nc(C)sc1C ZINC000037089649 1051219645 /nfs/dbraw/zinc/21/96/45/1051219645.db2.gz CNKPNBSETLEZNN-ZJUUUORDSA-N 1 2 308.422 4.319 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001171787876 1051219994 /nfs/dbraw/zinc/21/99/94/1051219994.db2.gz MIPFYBHPVIMFGT-NSHDSACASA-N 1 2 313.788 4.050 20 0 DIADLO CC(C)Oc1cc(Nc2ccc[nH+]c2N2CCCC2)ccc1F ZINC001215495751 1051221395 /nfs/dbraw/zinc/22/13/95/1051221395.db2.gz GCFDAPZKAJQVOC-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO CC(C)[C@@H]1CCC[C@H]([NH2+]c2ccc(N3CCC(O)CC3)cc2)C1 ZINC000792849924 1051221725 /nfs/dbraw/zinc/22/17/25/1051221725.db2.gz UNOWHDPZHDMJKB-AEFFLSMTSA-N 1 2 316.489 4.274 20 0 DIADLO Fc1ccc([C@@H]2CC[N@@H+]2Cc2ccc3c(c2)OC(F)(F)O3)cc1 ZINC001171847083 1051232241 /nfs/dbraw/zinc/23/22/41/1051232241.db2.gz IOXILPXPPKFETK-AWEZNQCLSA-N 1 2 321.298 4.094 20 0 DIADLO Fc1ccc([C@@H]2CC[N@H+]2Cc2ccc3c(c2)OC(F)(F)O3)cc1 ZINC001171847083 1051232248 /nfs/dbraw/zinc/23/22/48/1051232248.db2.gz IOXILPXPPKFETK-AWEZNQCLSA-N 1 2 321.298 4.094 20 0 DIADLO CCc1cccc(Nc2ccc3cnn([C@H]4CCCCO4)c3c2)[nH+]1 ZINC001215561641 1051246227 /nfs/dbraw/zinc/24/62/27/1051246227.db2.gz KDHCBDCJWVEJCG-LJQANCHMSA-N 1 2 322.412 4.436 20 0 DIADLO COc1c(F)c(C)ccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001215603401 1051271028 /nfs/dbraw/zinc/27/10/28/1051271028.db2.gz USWBGZDGMMASOT-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO Fc1ncccc1C[NH2+]Cc1cc(C(F)(F)F)ccc1Cl ZINC000793279844 1051277800 /nfs/dbraw/zinc/27/78/00/1051277800.db2.gz HLEPPBJYQWKACQ-UHFFFAOYSA-N 1 2 318.701 4.183 20 0 DIADLO CCCOc1c(F)cc(F)c(Nc2c[nH+]ccc2OC)c1F ZINC001212647376 1051325335 /nfs/dbraw/zinc/32/53/35/1051325335.db2.gz YJMJTUGEJQDRJX-UHFFFAOYSA-N 1 2 312.291 4.040 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@H+](C)[C@@H](C)c2ccco2)cc1 ZINC000746124454 1051325387 /nfs/dbraw/zinc/32/53/87/1051325387.db2.gz LWRCDQBQBJUNIW-GJZGRUSLSA-N 1 2 314.429 4.425 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@@H+](C)[C@@H](C)c2ccco2)cc1 ZINC000746124454 1051325400 /nfs/dbraw/zinc/32/54/00/1051325400.db2.gz LWRCDQBQBJUNIW-GJZGRUSLSA-N 1 2 314.429 4.425 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)CC(=O)Nc1ccc2ccccc2c1 ZINC000746124704 1051326320 /nfs/dbraw/zinc/32/63/20/1051326320.db2.gz SYNMXNADYBLAFP-AWEZNQCLSA-N 1 2 308.381 4.064 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)CC(=O)Nc1ccc2ccccc2c1 ZINC000746124704 1051326332 /nfs/dbraw/zinc/32/63/32/1051326332.db2.gz SYNMXNADYBLAFP-AWEZNQCLSA-N 1 2 308.381 4.064 20 0 DIADLO CC(C)Oc1c(F)ccc(Nc2cccc3[nH+]ccn32)c1F ZINC001215726704 1051326981 /nfs/dbraw/zinc/32/69/81/1051326981.db2.gz VWLYWAKCXOSYDR-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)s1 ZINC000793615521 1051328580 /nfs/dbraw/zinc/32/85/80/1051328580.db2.gz SQKREJSTIFGFBQ-WCQYABFASA-N 1 2 319.301 4.282 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)s1 ZINC000793615521 1051328586 /nfs/dbraw/zinc/32/85/86/1051328586.db2.gz SQKREJSTIFGFBQ-WCQYABFASA-N 1 2 319.301 4.282 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C3C(C)(C)C3(C)C)c2)[nH+]c1C ZINC000746158271 1051332845 /nfs/dbraw/zinc/33/28/45/1051332845.db2.gz VCXUHTXPKORUQK-UHFFFAOYSA-N 1 2 311.429 4.314 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)CCc2c[nH]c[nH+]2)cc1 ZINC000188546340 1051356114 /nfs/dbraw/zinc/35/61/14/1051356114.db2.gz ACYMBKOLJDAQTO-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)CCc2c[nH+]c[nH]2)cc1 ZINC000188546340 1051356121 /nfs/dbraw/zinc/35/61/21/1051356121.db2.gz ACYMBKOLJDAQTO-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1cccc(Nc2cnc(OCc3ccccc3)cc2C)[nH+]1 ZINC001215777680 1051363487 /nfs/dbraw/zinc/36/34/87/1051363487.db2.gz ZAEFDXRJKHQZSN-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO CSCc1cc[nH+]c(NCCCOc2ccccc2C)c1 ZINC001156038297 1051364428 /nfs/dbraw/zinc/36/44/28/1051364428.db2.gz KKTLDRDIQYTVEF-UHFFFAOYSA-N 1 2 302.443 4.134 20 0 DIADLO CCOCc1cncc(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001215789482 1051372328 /nfs/dbraw/zinc/37/23/28/1051372328.db2.gz PKXZUXBFEXPWBG-UHFFFAOYSA-N 1 2 311.429 4.352 20 0 DIADLO CCOc1cc(Nc2cccc3[nH+]c(C)cn32)ccc1Cl ZINC001212577582 1051381055 /nfs/dbraw/zinc/38/10/55/1051381055.db2.gz WBGDTLJCTMCOHQ-UHFFFAOYSA-N 1 2 301.777 4.438 20 0 DIADLO C[C@@H]1CC[N@H+](Cn2nc(C3CC3)sc2=S)[C@H]2CCCC[C@H]12 ZINC000746375892 1051386958 /nfs/dbraw/zinc/38/69/58/1051386958.db2.gz YKGSRUJYJKJFFK-BNOWGMLFSA-N 1 2 323.531 4.410 20 0 DIADLO C[C@@H]1CC[N@@H+](Cn2nc(C3CC3)sc2=S)[C@H]2CCCC[C@H]12 ZINC000746375892 1051386969 /nfs/dbraw/zinc/38/69/69/1051386969.db2.gz YKGSRUJYJKJFFK-BNOWGMLFSA-N 1 2 323.531 4.410 20 0 DIADLO CCCCCC[C@H](CCC)[NH2+][C@H]1Oc2ccc(CCO)cc2O1 ZINC001172386844 1051391252 /nfs/dbraw/zinc/39/12/52/1051391252.db2.gz HHKCIDOEQQLBRF-LPHOPBHVSA-N 1 2 321.461 4.005 20 0 DIADLO CSc1ncc(Nc2ccc(N3CCCCC3)[nH+]c2)cc1C ZINC001215827403 1051391674 /nfs/dbraw/zinc/39/16/74/1051391674.db2.gz UQGLUFFCVHJSBZ-UHFFFAOYSA-N 1 2 314.458 4.241 20 0 DIADLO CCOc1cc[nH+]cc1Nc1ccccc1NC(=O)C(C)(C)C ZINC001215832445 1051396253 /nfs/dbraw/zinc/39/62/53/1051396253.db2.gz QPGWPCITQOENLG-UHFFFAOYSA-N 1 2 313.401 4.209 20 0 DIADLO Clc1cc2n[nH]cc2c(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001215858872 1051417534 /nfs/dbraw/zinc/41/75/34/1051417534.db2.gz FJLWFEIFLZFFQB-UHFFFAOYSA-N 1 2 323.787 4.205 20 0 DIADLO Clc1cc2n[nH]cc2c(Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001215859773 1051418130 /nfs/dbraw/zinc/41/81/30/1051418130.db2.gz SXTBMBGMRNQZTM-UHFFFAOYSA-N 1 2 309.760 4.146 20 0 DIADLO C[C@@H]([NH2+]Cc1ccon1)c1ccc2ccccc2c1OC(F)F ZINC000766422309 1051419286 /nfs/dbraw/zinc/41/92/86/1051419286.db2.gz UQINXKZRRANCJZ-LLVKDONJSA-N 1 2 318.323 4.280 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C(C)C)[C@H](C)c3ccccc3)ccn12 ZINC001129512009 1051421833 /nfs/dbraw/zinc/42/18/33/1051421833.db2.gz AJQRKXIWBVUJEC-MRXNPFEDSA-N 1 2 321.424 4.255 20 0 DIADLO Cc1cc(NCCCCc2ccccn2)[nH+]cc1C(F)(F)F ZINC001168792420 1051423140 /nfs/dbraw/zinc/42/31/40/1051423140.db2.gz WQXACLFVXBAXMO-UHFFFAOYSA-N 1 2 309.335 4.239 20 0 DIADLO COc1cccc2[nH+]c(NCCCCc3ccccn3)ccc21 ZINC001168793300 1051423826 /nfs/dbraw/zinc/42/38/26/1051423826.db2.gz NFMOIDCVYGOHGD-UHFFFAOYSA-N 1 2 307.397 4.073 20 0 DIADLO C[C@H](CNc1cc[nH+]c2c(Cl)cccc12)CC1(C)OCCO1 ZINC000804491227 1051430113 /nfs/dbraw/zinc/43/01/13/1051430113.db2.gz AORPDMTWQVHPTI-LBPRGKRZSA-N 1 2 320.820 4.089 20 0 DIADLO C=Cc1ccc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)cc1 ZINC001215879825 1051435602 /nfs/dbraw/zinc/43/56/02/1051435602.db2.gz OYBAHDVMVSITBI-UHFFFAOYSA-N 1 2 314.348 4.232 20 0 DIADLO C[C@@H](C[C@H](O)c1ccco1)Nc1cc[nH+]c2c(Cl)cccc12 ZINC000804549347 1051445059 /nfs/dbraw/zinc/44/50/59/1051445059.db2.gz AXZZAMLSKKOJIZ-NHYWBVRUSA-N 1 2 316.788 4.405 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1)C(=O)OC(C)(C)C ZINC001172538264 1051452232 /nfs/dbraw/zinc/45/22/32/1051452232.db2.gz NXSLZTNBCDCKCN-USXIJHARSA-N 1 2 303.446 4.033 20 0 DIADLO CSc1ncc(Cl)cc1Nc1ccccc1-n1cc[nH+]c1 ZINC001215917599 1051454977 /nfs/dbraw/zinc/45/49/77/1051454977.db2.gz IJVZVGHPSZLJKU-UHFFFAOYSA-N 1 2 316.817 4.386 20 0 DIADLO Cc1nc(OC(C)C)ccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001215920385 1051456183 /nfs/dbraw/zinc/45/61/83/1051456183.db2.gz UKLUPPLOSPCPAP-UHFFFAOYSA-N 1 2 322.412 4.166 20 0 DIADLO COc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)cc1SC ZINC001215936375 1051468795 /nfs/dbraw/zinc/46/87/95/1051468795.db2.gz WVMNTTYLSUGNND-UHFFFAOYSA-N 1 2 311.410 4.346 20 0 DIADLO Clc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)c2c[nH]nc21 ZINC001215942565 1051471381 /nfs/dbraw/zinc/47/13/81/1051471381.db2.gz HNQHJXACOGFEQI-UHFFFAOYSA-N 1 2 309.760 4.146 20 0 DIADLO CCN(C)c1ccc(Nc2cccc(C(=O)C(F)(F)F)c2)c[nH+]1 ZINC001203341094 1051476190 /nfs/dbraw/zinc/47/61/90/1051476190.db2.gz LXKXACBKNZPJQN-UHFFFAOYSA-N 1 2 323.318 4.026 20 0 DIADLO Cc1cc(NCCc2cn3ccccc3[nH+]2)ccc1C(F)(F)F ZINC001169005814 1051487589 /nfs/dbraw/zinc/48/75/89/1051487589.db2.gz ZREKZOHFGVFVIA-UHFFFAOYSA-N 1 2 319.330 4.316 20 0 DIADLO Fc1cc(NCCc2cn3ccccc3[nH+]2)cc(C(F)F)c1F ZINC001169011413 1051487802 /nfs/dbraw/zinc/48/78/02/1051487802.db2.gz SHSRXDTVWCAXOS-UHFFFAOYSA-N 1 2 323.293 4.205 20 0 DIADLO CCOC(=O)CCc1ccc[nH+]c1NC(C)(C)CC(C)(C)C ZINC001169052410 1051497317 /nfs/dbraw/zinc/49/73/17/1051497317.db2.gz NSXHTTSKHPBZHP-UHFFFAOYSA-N 1 2 306.450 4.204 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cc(F)c(F)c(F)c3N)ccc12 ZINC001216009524 1051521543 /nfs/dbraw/zinc/52/15/43/1051521543.db2.gz HALZZQKQYNYOEX-UHFFFAOYSA-N 1 2 303.287 4.286 20 0 DIADLO Cc1ccc2c(c1)CC[C@H]2[NH2+][C@@H](C)c1noc(-c2ccccc2)n1 ZINC000766603031 1051525217 /nfs/dbraw/zinc/52/52/17/1051525217.db2.gz VKIOPCFFNSIAHN-KBXCAEBGSA-N 1 2 319.408 4.383 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1F)c1nc2ccccc2s1 ZINC000766605184 1051528978 /nfs/dbraw/zinc/52/89/78/1051528978.db2.gz RSHBXDIXYKSPFT-JTQLQIEISA-N 1 2 304.365 4.425 20 0 DIADLO Cc1cc(C)c(CNC(=O)[C@H](CCc2ccccc2)C(C)C)c[nH+]1 ZINC001129842142 1051536117 /nfs/dbraw/zinc/53/61/17/1051536117.db2.gz RTQODJRNQZFYMS-HXUWFJFHSA-N 1 2 324.468 4.220 20 0 DIADLO Cc1cc(CNC(=O)C[C@@H]2C[C@H](C)c3c2cccc3C)cc(C)[nH+]1 ZINC001129858171 1051542598 /nfs/dbraw/zinc/54/25/98/1051542598.db2.gz IUIBFTONXYTDHK-KSSFIOAISA-N 1 2 322.452 4.304 20 0 DIADLO C/C(=C\c1ccc(Cl)cc1)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001129859171 1051542725 /nfs/dbraw/zinc/54/27/25/1051542725.db2.gz YLYMEIPCAZTIIF-XYOKQWHBSA-N 1 2 314.816 4.072 20 0 DIADLO Nc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1C(F)(F)F ZINC001216051293 1051549684 /nfs/dbraw/zinc/54/96/84/1051549684.db2.gz CJVYVVBYJVPVOQ-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO c1coc(C[N@H+](Cc2cccnc2)Cc2ccc3cc[nH]c3c2)c1 ZINC001168448523 1051554124 /nfs/dbraw/zinc/55/41/24/1051554124.db2.gz PLTKBCVXYXVYMW-UHFFFAOYSA-N 1 2 317.392 4.358 20 0 DIADLO c1coc(C[N@@H+](Cc2cccnc2)Cc2ccc3cc[nH]c3c2)c1 ZINC001168448523 1051554131 /nfs/dbraw/zinc/55/41/31/1051554131.db2.gz PLTKBCVXYXVYMW-UHFFFAOYSA-N 1 2 317.392 4.358 20 0 DIADLO CN(C)c1ccc(Nc2ccc3c(c2)[nH+]cn3C)cc1Cl ZINC001216062364 1051557717 /nfs/dbraw/zinc/55/77/17/1051557717.db2.gz LWKKCOYOVJFYQX-UHFFFAOYSA-N 1 2 300.793 4.036 20 0 DIADLO CN(C)c1ccc(Nc2cc(-c3ccccc3)cnc2F)c[nH+]1 ZINC001216068616 1051560620 /nfs/dbraw/zinc/56/06/20/1051560620.db2.gz RRILQEZLBRWYEV-UHFFFAOYSA-N 1 2 308.360 4.092 20 0 DIADLO COc1ccc2cc(N[C@@H](C3CCC3)C(F)(F)F)[nH+]cc2c1 ZINC001169281800 1051568830 /nfs/dbraw/zinc/56/88/30/1051568830.db2.gz NZWAWQLSUOEBBF-HNNXBMFYSA-N 1 2 310.319 4.386 20 0 DIADLO Cc1cc(Nc2[nH+]cccc2N2CCCC2)cc(Cl)c1O ZINC001216086742 1051571059 /nfs/dbraw/zinc/57/10/59/1051571059.db2.gz GGYSWVDEBFDIMG-UHFFFAOYSA-N 1 2 303.793 4.093 20 0 DIADLO c1cn(Cc2ccc(Nc3cccnc3C3CCC3)cc2)c[nH+]1 ZINC001212695149 1051582245 /nfs/dbraw/zinc/58/22/45/1051582245.db2.gz QAPREEMBCLOVNP-UHFFFAOYSA-N 1 2 304.397 4.338 20 0 DIADLO CC[C@@]1(C)C[N@@H+](CCc2c(Cl)cccc2Cl)CCO1 ZINC001169343456 1051586221 /nfs/dbraw/zinc/58/62/21/1051586221.db2.gz UPNYXNVOBGOMKE-HNNXBMFYSA-N 1 2 302.245 4.037 20 0 DIADLO CC[C@@]1(C)C[N@H+](CCc2c(Cl)cccc2Cl)CCO1 ZINC001169343456 1051586211 /nfs/dbraw/zinc/58/62/11/1051586211.db2.gz UPNYXNVOBGOMKE-HNNXBMFYSA-N 1 2 302.245 4.037 20 0 DIADLO CCC(=O)c1ccccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212699012 1051586874 /nfs/dbraw/zinc/58/68/74/1051586874.db2.gz JGACADGVWOZFQC-UHFFFAOYSA-N 1 2 305.381 4.268 20 0 DIADLO c1cn(Cc2ccc(Nc3cccc4c3CCCO4)cc2)c[nH+]1 ZINC001212699914 1051588056 /nfs/dbraw/zinc/58/80/56/1051588056.db2.gz JRUFAUYQBKIUIL-UHFFFAOYSA-N 1 2 305.381 4.000 20 0 DIADLO CNc1ccc(N[C@H]2CCc3c2cccc3OC(F)(F)F)c[nH+]1 ZINC001169359853 1051588369 /nfs/dbraw/zinc/58/83/69/1051588369.db2.gz SDVSVHNPKLXQKT-ZDUSSCGKSA-N 1 2 323.318 4.121 20 0 DIADLO Nc1ccc(Nc2ccccc2-n2cc[nH+]c2)c(C(F)(F)F)c1 ZINC001216132175 1051595913 /nfs/dbraw/zinc/59/59/13/1051595913.db2.gz PEFNVIJKOIUGEN-UHFFFAOYSA-N 1 2 318.302 4.217 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)Cc2ccccc2Cl)c(C)[nH+]1 ZINC000178992441 1051598794 /nfs/dbraw/zinc/59/87/94/1051598794.db2.gz QBYNLZAHJNRDPN-LBPRGKRZSA-N 1 2 316.832 4.478 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@@H](CC)c2ccc(F)cn2)on1 ZINC000493245435 1051603973 /nfs/dbraw/zinc/60/39/73/1051603973.db2.gz BTIADJSZRLURCH-HNNXBMFYSA-N 1 2 305.397 4.353 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCCC2(CCCC2)C1 ZINC001169397322 1051607545 /nfs/dbraw/zinc/60/75/45/1051607545.db2.gz XMAZCOYTJIECER-MRXNPFEDSA-N 1 2 321.848 4.210 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[N@H+]1CCCC2(CCCC2)C1 ZINC001169397322 1051607550 /nfs/dbraw/zinc/60/75/50/1051607550.db2.gz XMAZCOYTJIECER-MRXNPFEDSA-N 1 2 321.848 4.210 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[N@@H+]1CCCC2(CCCC2)C1 ZINC001169397321 1051607962 /nfs/dbraw/zinc/60/79/62/1051607962.db2.gz XMAZCOYTJIECER-INIZCTEOSA-N 1 2 321.848 4.210 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[N@H+]1CCCC2(CCCC2)C1 ZINC001169397321 1051607973 /nfs/dbraw/zinc/60/79/73/1051607973.db2.gz XMAZCOYTJIECER-INIZCTEOSA-N 1 2 321.848 4.210 20 0 DIADLO NC(Cc1ccccc1)=[NH+]OCc1nc(-c2ccccc2)cs1 ZINC000766693513 1051610564 /nfs/dbraw/zinc/61/05/64/1051610564.db2.gz STCHLKAJTZFDJR-UHFFFAOYSA-N 1 2 323.421 4.051 20 0 DIADLO FC(F)(F)C(F)(F)C[NH2+]C1CCC(Oc2ccccc2)CC1 ZINC001173191797 1051627098 /nfs/dbraw/zinc/62/70/98/1051627098.db2.gz AZOZCSYKIXOTSU-UHFFFAOYSA-N 1 2 323.305 4.164 20 0 DIADLO COc1ccc2cc(NC[C@H](C)c3ccc(O)cc3)[nH+]cc2c1 ZINC001169537276 1051637555 /nfs/dbraw/zinc/63/75/55/1051637555.db2.gz ZZSJLAAYWDVIMR-ZDUSSCGKSA-N 1 2 308.381 4.165 20 0 DIADLO CCOc1ccc(C)c(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001216235838 1051641520 /nfs/dbraw/zinc/64/15/20/1051641520.db2.gz LTUKQQORBGYPBR-UHFFFAOYSA-N 1 2 307.397 4.382 20 0 DIADLO CCOc1cc[nH+]cc1Nc1ccc(OC(C)C)c(OC)c1 ZINC001216244268 1051651885 /nfs/dbraw/zinc/65/18/85/1051651885.db2.gz MCKCHXZKMYQCFA-UHFFFAOYSA-N 1 2 302.374 4.020 20 0 DIADLO COc1cc(Nc2ccc[nH+]c2N2CCCC2)ccc1C1CC1 ZINC001216248612 1051655299 /nfs/dbraw/zinc/65/52/99/1051655299.db2.gz QZZCNRDZFBTPIV-UHFFFAOYSA-N 1 2 309.413 4.311 20 0 DIADLO CC[C@@H](C)Sc1ccc(NC(=O)/C=C\c2[nH]cc[nH+]2)c(C)c1 ZINC000493836669 1051658669 /nfs/dbraw/zinc/65/86/69/1051658669.db2.gz MYZHYBGQXNKUOH-MEJMFZKBSA-N 1 2 315.442 4.261 20 0 DIADLO CCCC[C@H](CC(C)C)[N@@H+]1CCOC[C@@H]1c1csc(C)n1 ZINC001173261566 1051663857 /nfs/dbraw/zinc/66/38/57/1051663857.db2.gz OYTKUTQWWGRXPS-NVXWUHKLSA-N 1 2 310.507 4.430 20 0 DIADLO CCCC[C@H](CC(C)C)[N@H+]1CCOC[C@@H]1c1csc(C)n1 ZINC001173261566 1051663867 /nfs/dbraw/zinc/66/38/67/1051663867.db2.gz OYTKUTQWWGRXPS-NVXWUHKLSA-N 1 2 310.507 4.430 20 0 DIADLO COc1ccc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)c(F)c1 ZINC000494027763 1051679985 /nfs/dbraw/zinc/67/99/85/1051679985.db2.gz INSLGSVQIPDGLA-FQEVSTJZSA-N 1 2 322.383 4.109 20 0 DIADLO CCCc1csc(C[NH2+]C2(c3nc(C)cs3)CCCC2)n1 ZINC000494035748 1051683127 /nfs/dbraw/zinc/68/31/27/1051683127.db2.gz BAQABWRRPOWLBS-UHFFFAOYSA-N 1 2 321.515 4.420 20 0 DIADLO CCCc1csc(C[NH2+]Cc2ccccc2OCC2CC2)n1 ZINC000494099738 1051688007 /nfs/dbraw/zinc/68/80/07/1051688007.db2.gz SUAXJYUYTUICLU-UHFFFAOYSA-N 1 2 316.470 4.174 20 0 DIADLO CCCc1csc(C[NH2+]Cc2ccc(Cl)cc2OCC)n1 ZINC000494163009 1051701501 /nfs/dbraw/zinc/70/15/01/1051701501.db2.gz KXFZEBYFMPEQEB-UHFFFAOYSA-N 1 2 324.877 4.438 20 0 DIADLO O[C@H]1CCN(c2ccc(Nc3cccc(C4CCCC4)c3)c[nH+]2)C1 ZINC001216345635 1051712691 /nfs/dbraw/zinc/71/26/91/1051712691.db2.gz JYFCPEJQQZGZTN-IBGZPJMESA-N 1 2 323.440 4.054 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCC[C@H](Oc3ccccc3)C2)c1F ZINC001137930471 1051713285 /nfs/dbraw/zinc/71/32/85/1051713285.db2.gz PYFAAHPNCLYMBR-AWEZNQCLSA-N 1 2 321.342 4.147 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCC[C@H](Oc3ccccc3)C2)c1F ZINC001137930471 1051713298 /nfs/dbraw/zinc/71/32/98/1051713298.db2.gz PYFAAHPNCLYMBR-AWEZNQCLSA-N 1 2 321.342 4.147 20 0 DIADLO CC1(C)C[C@@H](CNc2ccc3[nH]c(-c4ccccc4)[nH+]c3c2)O1 ZINC001168461299 1051716923 /nfs/dbraw/zinc/71/69/23/1051716923.db2.gz SRIBKUBLLPTIMF-HNNXBMFYSA-N 1 2 307.397 4.209 20 0 DIADLO CCOc1cc(C)cc(F)c1Nc1ccccc1-n1cc[nH+]c1 ZINC001216369268 1051727588 /nfs/dbraw/zinc/72/75/88/1051727588.db2.gz ZXLMYKZRLFNQAA-UHFFFAOYSA-N 1 2 311.360 4.462 20 0 DIADLO COc1cc(C)c(C)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001216375512 1051730827 /nfs/dbraw/zinc/73/08/27/1051730827.db2.gz NUNNQEFMPHVXAR-UHFFFAOYSA-N 1 2 307.397 4.300 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(Cl)ccc1Cl)c1c(C)noc1C ZINC000766892626 1051738754 /nfs/dbraw/zinc/73/87/54/1051738754.db2.gz IGNHBNMQVCBORN-NSHDSACASA-N 1 2 314.216 4.234 20 0 DIADLO C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001173545643 1051739459 /nfs/dbraw/zinc/73/94/59/1051739459.db2.gz CGSUWJLFSLZOBV-CUOATXAZSA-N 1 2 308.199 4.306 20 0 DIADLO Oc1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)c(Cl)c1 ZINC001216426143 1051759098 /nfs/dbraw/zinc/75/90/98/1051759098.db2.gz UQHSYWFTVFVQFU-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO C/C=C(\CC)C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000767091980 1051759896 /nfs/dbraw/zinc/75/98/96/1051759896.db2.gz NBWOZSPMYOPEBC-LZWSPWQCSA-N 1 2 309.413 4.181 20 0 DIADLO CC(C)(C)/C=C/C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000767089991 1051760024 /nfs/dbraw/zinc/76/00/24/1051760024.db2.gz BTEDRYNNUKAQBC-ZHACJKMWSA-N 1 2 323.440 4.427 20 0 DIADLO CC/C=C(\C)C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000767091868 1051760471 /nfs/dbraw/zinc/76/04/71/1051760471.db2.gz KRHZSJWPSGIEEY-VGOFMYFVSA-N 1 2 309.413 4.181 20 0 DIADLO CC(C)(C)/C=C\C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000767089987 1051760548 /nfs/dbraw/zinc/76/05/48/1051760548.db2.gz BTEDRYNNUKAQBC-KHPPLWFESA-N 1 2 323.440 4.427 20 0 DIADLO O[C@@H](CNc1cc[nH+]c2c(Cl)cccc12)c1ccc(F)cc1 ZINC000804347437 1051767561 /nfs/dbraw/zinc/76/75/61/1051767561.db2.gz KZXNQLURXNVZLE-INIZCTEOSA-N 1 2 316.763 4.173 20 0 DIADLO CC[C@H](C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccc(F)cc1 ZINC000185745794 1051783648 /nfs/dbraw/zinc/78/36/48/1051783648.db2.gz OSTOADYFBBKTCO-SFHVURJKSA-N 1 2 323.371 4.144 20 0 DIADLO Fc1ccc(Cl)c(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001216478657 1051784397 /nfs/dbraw/zinc/78/43/97/1051784397.db2.gz WKGMCNYVFJWKNG-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO Cc1ccccc1Nc1ccc2[nH+]cc(Br)n2c1 ZINC001173816254 1051795119 /nfs/dbraw/zinc/79/51/19/1051795119.db2.gz ODGLNLJHFMMTIC-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO Cc1ccccc1Nc1cc(Br)c2[nH+]ccn2c1 ZINC001173816320 1051795369 /nfs/dbraw/zinc/79/53/69/1051795369.db2.gz RRTXFDBLKPIDRS-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO Cc1cccc(Nc2cc(Br)cn3cc[nH+]c23)c1 ZINC001173807489 1051813239 /nfs/dbraw/zinc/81/32/39/1051813239.db2.gz SRBIQBLTMRNGAV-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO CCN(C)c1ccc(Nc2cc(SC)cc(F)c2OC)c[nH+]1 ZINC001216581390 1051822927 /nfs/dbraw/zinc/82/29/27/1051822927.db2.gz DSEZFKQWNSKORG-UHFFFAOYSA-N 1 2 321.421 4.151 20 0 DIADLO CCn1ncc2cc(Nc3cc(Cl)c4[nH+]ccn4c3)ccc21 ZINC001216589898 1051830238 /nfs/dbraw/zinc/83/02/38/1051830238.db2.gz ILTUEKZWXDOAKQ-UHFFFAOYSA-N 1 2 311.776 4.101 20 0 DIADLO Fc1cccc(F)c1Nc1cc(Br)cn2cc[nH+]c12 ZINC001173859210 1051830524 /nfs/dbraw/zinc/83/05/24/1051830524.db2.gz LUHUDFGUZAMFLQ-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Brc1cc(NC=Cc2ccccc2)c2[nH+]ccn2c1 ZINC001173870850 1051840749 /nfs/dbraw/zinc/84/07/49/1051840749.db2.gz YDGIJTCHPAEPJG-VOTSOKGWSA-N 1 2 314.186 4.180 20 0 DIADLO COc1c(Nc2ccc3c(c2)[nH+]cn3C)cccc1C(F)(F)F ZINC001216634995 1051842954 /nfs/dbraw/zinc/84/29/54/1051842954.db2.gz GFHJSGJXJBVGCB-UHFFFAOYSA-N 1 2 321.302 4.344 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nnc(-c3cccc(F)c3)o2)[C@H]1c1ccccc1 ZINC000746490159 1051850890 /nfs/dbraw/zinc/85/08/90/1051850890.db2.gz QZRVYALFKVPBEM-FZKQIMNGSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nnc(-c3cccc(F)c3)o2)[C@H]1c1ccccc1 ZINC000746490159 1051850901 /nfs/dbraw/zinc/85/09/01/1051850901.db2.gz QZRVYALFKVPBEM-FZKQIMNGSA-N 1 2 323.371 4.069 20 0 DIADLO Nc1ccc[nH+]c1Nc1ccc(OCc2ccccc2F)cc1 ZINC001216654871 1051854215 /nfs/dbraw/zinc/85/42/15/1051854215.db2.gz IOJJGMAVQYBHAB-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO COc1ccccc1Nc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001173839089 1051854720 /nfs/dbraw/zinc/85/47/20/1051854720.db2.gz JPCPDOPUGQWOFV-UHFFFAOYSA-N 1 2 315.373 4.181 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2cc(F)cc(F)c2)cc[nH+]1 ZINC001173912750 1051872271 /nfs/dbraw/zinc/87/22/71/1051872271.db2.gz CYRIIBJVYLYGTC-UHFFFAOYSA-N 1 2 321.327 4.450 20 0 DIADLO Cc1ccc(-c2noc(-c3ccccc3-n3cc[nH+]c3)n2)cc1F ZINC001216755581 1051873337 /nfs/dbraw/zinc/87/33/37/1051873337.db2.gz SFWMXBAOXNGPFP-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Cc1ccc(-c2noc(-c3ccccc3-n3cc[nH+]c3)n2)c(F)c1 ZINC001216755375 1051873572 /nfs/dbraw/zinc/87/35/72/1051873572.db2.gz KWFOASIYSQXSHM-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Cc1c([C@@H](C)[NH2+][C@H](C)c2cscn2)cnn1-c1ccccc1 ZINC000768099449 1051876671 /nfs/dbraw/zinc/87/66/71/1051876671.db2.gz NGZLBRLPPYITKJ-CHWSQXEVSA-N 1 2 312.442 4.049 20 0 DIADLO Cc1c([C@H](C)[NH2+][C@@H](C)c2cscn2)cnn1-c1ccccc1 ZINC000768099460 1051878783 /nfs/dbraw/zinc/87/87/83/1051878783.db2.gz NGZLBRLPPYITKJ-STQMWFEESA-N 1 2 312.442 4.049 20 0 DIADLO Fc1ccc(Nc2cc(Br)cn3cc[nH+]c23)c(F)c1 ZINC001173925352 1051883278 /nfs/dbraw/zinc/88/32/78/1051883278.db2.gz MZLDRMCZWSJCTR-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2coc(C3CC3)n2)cc1 ZINC000768200755 1051895192 /nfs/dbraw/zinc/89/51/92/1051895192.db2.gz PWOMARMNHSMVHS-GOSISDBHSA-N 1 2 312.413 4.288 20 0 DIADLO CCOc1ccc([C@H]2CCC[N@H+]2Cc2coc(C3CC3)n2)cc1 ZINC000768200755 1051895211 /nfs/dbraw/zinc/89/52/11/1051895211.db2.gz PWOMARMNHSMVHS-GOSISDBHSA-N 1 2 312.413 4.288 20 0 DIADLO Clc1nc2ccccn2c1C[N@H+](Cc1ccccc1)C1CC1 ZINC000768229683 1051907264 /nfs/dbraw/zinc/90/72/64/1051907264.db2.gz OIJIZTDTYJFSLK-UHFFFAOYSA-N 1 2 311.816 4.152 20 0 DIADLO Clc1nc2ccccn2c1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000768229683 1051907271 /nfs/dbraw/zinc/90/72/71/1051907271.db2.gz OIJIZTDTYJFSLK-UHFFFAOYSA-N 1 2 311.816 4.152 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(Cl)ccc(F)c1Cl)c1cn[nH]c1 ZINC000222506390 1051920444 /nfs/dbraw/zinc/92/04/44/1051920444.db2.gz BTKQTFBXSZZVHC-SFYZADRCSA-N 1 2 302.180 4.267 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccccc2OCC2CC2)no1 ZINC000768429000 1051929360 /nfs/dbraw/zinc/92/93/60/1051929360.db2.gz ISNQNYLTYTTXSY-SFHVURJKSA-N 1 2 312.413 4.109 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccccc2OCC2CC2)no1 ZINC000768429000 1051929372 /nfs/dbraw/zinc/92/93/72/1051929372.db2.gz ISNQNYLTYTTXSY-SFHVURJKSA-N 1 2 312.413 4.109 20 0 DIADLO Cl/C=C(/Cl)CNc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000768389192 1051929596 /nfs/dbraw/zinc/92/95/96/1051929596.db2.gz SYFAPSNLJHKWNU-MDWZMJQESA-N 1 2 320.223 4.333 20 0 DIADLO CN(C)C(=O)c1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1 ZINC001174005711 1051929984 /nfs/dbraw/zinc/92/99/84/1051929984.db2.gz COMHIMBOWSOXQZ-UHFFFAOYSA-N 1 2 323.440 4.122 20 0 DIADLO CCNc1cc(CNC(=O)Nc2ccc(C3CCC3)cc2)cc[nH+]1 ZINC001217027609 1051930538 /nfs/dbraw/zinc/93/05/38/1051930538.db2.gz ABPSWJWTRMOQJS-UHFFFAOYSA-N 1 2 324.428 4.103 20 0 DIADLO Cc1cc(Oc2ccc(Nc3ccc(C(N)=O)cc3)cc2)cc[nH+]1 ZINC001174050994 1051941115 /nfs/dbraw/zinc/94/11/15/1051941115.db2.gz JGNFTEGIAAMREM-UHFFFAOYSA-N 1 2 319.364 4.025 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1csc(Cl)c1 ZINC000190722751 1051951025 /nfs/dbraw/zinc/95/10/25/1051951025.db2.gz XTRBYMAVKWOAIJ-UHFFFAOYSA-N 1 2 303.774 4.044 20 0 DIADLO COc1ccc(Nc2cc(OC)c(C(F)(F)F)c[nH+]2)c(C)c1 ZINC001174021943 1051952883 /nfs/dbraw/zinc/95/28/83/1051952883.db2.gz HPXNQMXGGURRCT-UHFFFAOYSA-N 1 2 312.291 4.170 20 0 DIADLO CC(C)[N@H+](Cc1cn(C(C)(C)C)nn1)Cc1cccc(Cl)c1 ZINC000191233354 1051965913 /nfs/dbraw/zinc/96/59/13/1051965913.db2.gz WMDLSIHTUHFOLG-UHFFFAOYSA-N 1 2 320.868 4.097 20 0 DIADLO CC(C)[N@@H+](Cc1cn(C(C)(C)C)nn1)Cc1cccc(Cl)c1 ZINC000191233354 1051965922 /nfs/dbraw/zinc/96/59/22/1051965922.db2.gz WMDLSIHTUHFOLG-UHFFFAOYSA-N 1 2 320.868 4.097 20 0 DIADLO C[N@H+](CCc1cccs1)Cc1c(F)c(F)c(F)c(F)c1F ZINC000743859772 1051976435 /nfs/dbraw/zinc/97/64/35/1051976435.db2.gz IDWJOVNKOVEBFR-UHFFFAOYSA-N 1 2 321.314 4.118 20 0 DIADLO C[N@@H+](CCc1cccs1)Cc1c(F)c(F)c(F)c(F)c1F ZINC000743859772 1051976450 /nfs/dbraw/zinc/97/64/50/1051976450.db2.gz IDWJOVNKOVEBFR-UHFFFAOYSA-N 1 2 321.314 4.118 20 0 DIADLO CC[C@]1(C)CC(=O)N(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)C1 ZINC000808142665 1051980274 /nfs/dbraw/zinc/98/02/74/1051980274.db2.gz XQYDWZWKUWLYSO-SJLPKXTDSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@]1(C)CC(=O)N(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)C1 ZINC000808142665 1051980291 /nfs/dbraw/zinc/98/02/91/1051980291.db2.gz XQYDWZWKUWLYSO-SJLPKXTDSA-N 1 2 320.864 4.083 20 0 DIADLO CCc1nc(C[N@@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)cs1 ZINC000191660734 1051981023 /nfs/dbraw/zinc/98/10/23/1051981023.db2.gz KNQMENDPBTUMAJ-NSHDSACASA-N 1 2 306.397 4.116 20 0 DIADLO CCc1nc(C[N@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)cs1 ZINC000191660734 1051981031 /nfs/dbraw/zinc/98/10/31/1051981031.db2.gz KNQMENDPBTUMAJ-NSHDSACASA-N 1 2 306.397 4.116 20 0 DIADLO CN(C)C(=O)c1cccc(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001174086250 1051998922 /nfs/dbraw/zinc/99/89/22/1051998922.db2.gz MZWZPICAUGWCNK-UHFFFAOYSA-N 1 2 323.440 4.122 20 0 DIADLO CSc1cc(Nc2ccc(C(=O)NC(C)(C)C)cc2)cc[nH+]1 ZINC001174125955 1052005192 /nfs/dbraw/zinc/00/51/92/1052005192.db2.gz LGPMBBYKLSJSPI-UHFFFAOYSA-N 1 2 315.442 4.075 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)CCC1CCCCC1 ZINC000192247507 1052008218 /nfs/dbraw/zinc/00/82/18/1052008218.db2.gz IGLXSYLCMRXERG-UHFFFAOYSA-N 1 2 319.493 4.045 20 0 DIADLO Cn1cnc(C[NH2+][C@@H](c2cccs2)c2ccc(Cl)cc2)c1 ZINC000808379608 1052009561 /nfs/dbraw/zinc/00/95/61/1052009561.db2.gz SCVNNGVLYLEBQK-MRXNPFEDSA-N 1 2 317.845 4.014 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC[C@@H](c3c(F)cccc3F)C2)o1 ZINC000769228781 1052011343 /nfs/dbraw/zinc/01/13/43/1052011343.db2.gz RGZDANBFUMQEQK-GFCCVEGCSA-N 1 2 306.356 4.066 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)o1 ZINC000769228781 1052011348 /nfs/dbraw/zinc/01/13/48/1052011348.db2.gz RGZDANBFUMQEQK-GFCCVEGCSA-N 1 2 306.356 4.066 20 0 DIADLO CCc1nc(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)cs1 ZINC000192653307 1052017667 /nfs/dbraw/zinc/01/76/67/1052017667.db2.gz WHANWLRJOLQQOU-UHFFFAOYSA-N 1 2 302.418 4.134 20 0 DIADLO CCc1nc(C[N@H+]2CC=C(c3ccc(F)cc3)CC2)cs1 ZINC000192653307 1052017653 /nfs/dbraw/zinc/01/76/53/1052017653.db2.gz WHANWLRJOLQQOU-UHFFFAOYSA-N 1 2 302.418 4.134 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000192837448 1052022135 /nfs/dbraw/zinc/02/21/35/1052022135.db2.gz HOYNZFKMMDYWDW-OAHLLOKOSA-N 1 2 303.475 4.116 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000192837448 1052022144 /nfs/dbraw/zinc/02/21/44/1052022144.db2.gz HOYNZFKMMDYWDW-OAHLLOKOSA-N 1 2 303.475 4.116 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)c1ccccc1-c1ccccc1 ZINC001131309439 1052027030 /nfs/dbraw/zinc/02/70/30/1052027030.db2.gz MVJAXJHHBCIBNI-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc2ccccc2[nH]1 ZINC000193191325 1052033884 /nfs/dbraw/zinc/03/38/84/1052033884.db2.gz LBNFQYTVRXMPSN-NSHDSACASA-N 1 2 301.340 4.034 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc2ccccc2[nH]1 ZINC000193191325 1052033891 /nfs/dbraw/zinc/03/38/91/1052033891.db2.gz LBNFQYTVRXMPSN-NSHDSACASA-N 1 2 301.340 4.034 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cccc(C(=O)N3CCCC3)c2)cc1 ZINC001174173161 1052033806 /nfs/dbraw/zinc/03/38/06/1052033806.db2.gz NYLAUERLXMWFJE-UHFFFAOYSA-N 1 2 323.440 4.122 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cccc(C(=O)N3CCCC3)c2)cc1 ZINC001174173161 1052033818 /nfs/dbraw/zinc/03/38/18/1052033818.db2.gz NYLAUERLXMWFJE-UHFFFAOYSA-N 1 2 323.440 4.122 20 0 DIADLO Cc1ccc(Nc2cccc(C(=O)N3CCCCC3)c2)c(C)[nH+]1 ZINC001174173168 1052034186 /nfs/dbraw/zinc/03/41/86/1052034186.db2.gz OCTHUNVKVIXSLP-UHFFFAOYSA-N 1 2 309.413 4.068 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)cn1 ZINC000769427044 1052044407 /nfs/dbraw/zinc/04/44/07/1052044407.db2.gz FPSCDXKALLFGAS-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1cc(C[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)cn1 ZINC000769427044 1052044421 /nfs/dbraw/zinc/04/44/21/1052044421.db2.gz FPSCDXKALLFGAS-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO CCn1ncnc1C[N@@H+]1CCCC[C@H]1c1ccc(C(C)C)cc1 ZINC000193458447 1052045761 /nfs/dbraw/zinc/04/57/61/1052045761.db2.gz ONPLBMZQVRVMBS-SFHVURJKSA-N 1 2 312.461 4.149 20 0 DIADLO CCn1ncnc1C[N@H+]1CCCC[C@H]1c1ccc(C(C)C)cc1 ZINC000193458447 1052045773 /nfs/dbraw/zinc/04/57/73/1052045773.db2.gz ONPLBMZQVRVMBS-SFHVURJKSA-N 1 2 312.461 4.149 20 0 DIADLO Cc1cc(C)c(Nc2cccc(C(=O)N3CCC(C)CC3)c2)c[nH+]1 ZINC001174203091 1052047592 /nfs/dbraw/zinc/04/75/92/1052047592.db2.gz IYULWAGBMACRMN-UHFFFAOYSA-N 1 2 323.440 4.314 20 0 DIADLO Cc1cc(O)c[nH+]c1Nc1cccc(C(=O)Nc2ccccc2)c1 ZINC001174205066 1052048235 /nfs/dbraw/zinc/04/82/35/1052048235.db2.gz MTYUTYLINPZUGN-UHFFFAOYSA-N 1 2 319.364 4.092 20 0 DIADLO Cc1ccc(-c2noc(-c3cccc4[nH+]ccn43)n2)c(Cl)c1 ZINC001217500861 1052074517 /nfs/dbraw/zinc/07/45/17/1052074517.db2.gz PKAVAAMQGAQCKB-UHFFFAOYSA-N 1 2 310.744 4.013 20 0 DIADLO Cc1ccc(-c2noc(-c3cccc4[nH+]ccn43)n2)cc1Cl ZINC001217500863 1052075078 /nfs/dbraw/zinc/07/50/78/1052075078.db2.gz PPEMFFWTMFHTEE-UHFFFAOYSA-N 1 2 310.744 4.013 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2coc(C3CC3)n2)o1 ZINC000769549527 1052080434 /nfs/dbraw/zinc/08/04/34/1052080434.db2.gz NLMFOZFWKUVRGS-WBMJQRKESA-N 1 2 300.402 4.427 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2coc(C3CC3)n2)o1 ZINC000769549527 1052080439 /nfs/dbraw/zinc/08/04/39/1052080439.db2.gz NLMFOZFWKUVRGS-WBMJQRKESA-N 1 2 300.402 4.427 20 0 DIADLO Cc1cccc(C2(Nc3cc4ccc(C)cc4c[nH+]3)COC2)c1 ZINC001168469466 1052090169 /nfs/dbraw/zinc/09/01/69/1052090169.db2.gz QCNZICIMTFTSHL-UHFFFAOYSA-N 1 2 304.393 4.189 20 0 DIADLO FC(F)(F)c1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)cn1 ZINC001174310682 1052091084 /nfs/dbraw/zinc/09/10/84/1052091084.db2.gz DFJXJDRQBANXFY-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO FC(F)(F)c1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)cn1 ZINC001174310058 1052092278 /nfs/dbraw/zinc/09/22/78/1052092278.db2.gz REKQGICSPLDSFY-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO CN(c1ccc(OCc2ccc(F)cc2)cc1)c1[nH+]cccc1N ZINC001174317434 1052097124 /nfs/dbraw/zinc/09/71/24/1052097124.db2.gz PKSWLHJVFMASDM-UHFFFAOYSA-N 1 2 323.371 4.150 20 0 DIADLO CC(C)c1ccc(-c2nnc([C@H]([NH3+])[C@@H](C)OC(C)(C)C)o2)cc1 ZINC001217702292 1052119466 /nfs/dbraw/zinc/11/94/66/1052119466.db2.gz ZWOWTAFRXNGJBU-IUODEOHRSA-N 1 2 317.433 4.063 20 0 DIADLO CC(C)(C)c1ccc(-c2nnc([C@@H]3[NH2+]Cc4ccccc43)o2)cc1 ZINC001217726706 1052126870 /nfs/dbraw/zinc/12/68/70/1052126870.db2.gz KKWCRZOQSRZADR-QGZVFWFLSA-N 1 2 319.408 4.227 20 0 DIADLO Clc1cc(Nc2ccc3ncsc3c2)cn2cc[nH+]c12 ZINC001174364901 1052130690 /nfs/dbraw/zinc/13/06/90/1052130690.db2.gz IVZZRTOOPPROSE-UHFFFAOYSA-N 1 2 300.774 4.341 20 0 DIADLO c1ccc([C@@H]2CCC[C@H](c3nnc(CC4CCCC4)o3)[NH2+]2)cc1 ZINC001217750725 1052132839 /nfs/dbraw/zinc/13/28/39/1052132839.db2.gz WGUALULMVPBALD-DLBZAZTESA-N 1 2 311.429 4.358 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(C(F)(F)F)nn3C)ccc21 ZINC001174380691 1052138434 /nfs/dbraw/zinc/13/84/34/1052138434.db2.gz JWOIXQXUNYAUBM-UHFFFAOYSA-N 1 2 323.322 4.113 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc(C(=O)N(C)C)c3)ccc21 ZINC001174381154 1052139135 /nfs/dbraw/zinc/13/91/35/1052139135.db2.gz HXPAQHGEMDZIFX-UHFFFAOYSA-N 1 2 322.412 4.063 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(c3)C(=O)OC4)ccc21 ZINC001174381617 1052140511 /nfs/dbraw/zinc/14/05/11/1052140511.db2.gz PAOOEECFUGSWSV-UHFFFAOYSA-N 1 2 307.353 4.031 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4cnn(C)c4c3)ccc21 ZINC001174382008 1052140917 /nfs/dbraw/zinc/14/09/17/1052140917.db2.gz ZJAJECRPCGDGTN-UHFFFAOYSA-N 1 2 305.385 4.248 20 0 DIADLO Cc1ncc(Nc2ccc3c(c2)[nH+]cn3C(C)C)c(Cl)n1 ZINC001174381825 1052140935 /nfs/dbraw/zinc/14/09/35/1052140935.db2.gz PXELFOBCOCKDAL-UHFFFAOYSA-N 1 2 301.781 4.113 20 0 DIADLO COc1ccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)c(Cl)n1 ZINC001174381904 1052141135 /nfs/dbraw/zinc/14/11/35/1052141135.db2.gz SHRJYZLEODBGOL-UHFFFAOYSA-N 1 2 316.792 4.418 20 0 DIADLO CC(=O)Nc1ccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cc1 ZINC001174381505 1052141169 /nfs/dbraw/zinc/14/11/69/1052141169.db2.gz MBSOILINRCVOPP-UHFFFAOYSA-N 1 2 308.385 4.319 20 0 DIADLO O=C(Nc1ccccc1-c1cccs1)c1cccc2[nH+]ccn21 ZINC000770061568 1052141208 /nfs/dbraw/zinc/14/12/08/1052141208.db2.gz HLJQBWJPPKWVGX-UHFFFAOYSA-N 1 2 319.389 4.315 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cncnc3C(F)(F)F)ccc21 ZINC001174382612 1052142372 /nfs/dbraw/zinc/14/23/72/1052142372.db2.gz YSBVCFWSUNGWPH-UHFFFAOYSA-N 1 2 321.306 4.170 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4[nH]c(=O)ccc4c3)ccc21 ZINC001174383031 1052143138 /nfs/dbraw/zinc/14/31/38/1052143138.db2.gz JYAHXPNYOLTQRH-UHFFFAOYSA-N 1 2 318.380 4.202 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc(C4=NCCO4)c3)ccc21 ZINC001174383947 1052143908 /nfs/dbraw/zinc/14/39/08/1052143908.db2.gz AQOPKPWQYPJSQI-UHFFFAOYSA-N 1 2 320.396 4.138 20 0 DIADLO CC(=O)Nc1ccc(O)c(Nc2ccc3c(c2)[nH+]cn3C(C)C)c1 ZINC001174385600 1052144529 /nfs/dbraw/zinc/14/45/29/1052144529.db2.gz QNCZGHVDRHMUPE-UHFFFAOYSA-N 1 2 324.384 4.025 20 0 DIADLO C=CC(=O)Nc1cccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)c1 ZINC001174385387 1052144693 /nfs/dbraw/zinc/14/46/93/1052144693.db2.gz QAAMFJPWODONDA-UHFFFAOYSA-N 1 2 320.396 4.485 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4c3OCC[C@@H]4O)ccc21 ZINC001174385728 1052144993 /nfs/dbraw/zinc/14/49/93/1052144993.db2.gz VWFBPTVZLHMCPL-SFHVURJKSA-N 1 2 323.396 4.177 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(F)cc(F)c3O)ccc21 ZINC001174384598 1052145412 /nfs/dbraw/zinc/14/54/12/1052145412.db2.gz IUUXBWWDVMWTMM-UHFFFAOYSA-N 1 2 303.312 4.345 20 0 DIADLO c1n[nH]c([C@H]([NH2+]C[C@@H]2CCCc3ccccc32)C2CCCCC2)n1 ZINC000494877849 1052156009 /nfs/dbraw/zinc/15/60/09/1052156009.db2.gz LMESHHWXYIOLMN-PKOBYXMFSA-N 1 2 324.472 4.136 20 0 DIADLO FC(F)(F)c1cc(Nc2cc[nH+]c3[nH]ccc32)cc(Cl)n1 ZINC001174410448 1052164038 /nfs/dbraw/zinc/16/40/38/1052164038.db2.gz VOIXJZGTOYOZLN-UHFFFAOYSA-N 1 2 312.682 4.325 20 0 DIADLO Cc1cc(Br)ccc1Nc1cc[nH+]c2[nH]ccc21 ZINC001174411403 1052164469 /nfs/dbraw/zinc/16/44/69/1052164469.db2.gz XSSOPUUXXBDRNG-UHFFFAOYSA-N 1 2 302.175 4.329 20 0 DIADLO Fc1cc(Nc2cc[nH+]c3[nH]ccc32)cc(F)c1Br ZINC001174411441 1052165499 /nfs/dbraw/zinc/16/54/99/1052165499.db2.gz ZFTCTXURAZGNCT-UHFFFAOYSA-N 1 2 324.128 4.299 20 0 DIADLO Nc1ccc2c(c1)Cc1cc(Nc3cc[nH+]c4[nH]ccc43)ccc1-2 ZINC001174412696 1052166077 /nfs/dbraw/zinc/16/60/77/1052166077.db2.gz XSHUWLCYOGKLTJ-UHFFFAOYSA-N 1 2 312.376 4.412 20 0 DIADLO FC(F)(F)COc1ccc(Nc2cc[nH+]c3[nH]ccc32)cc1 ZINC001174414554 1052167209 /nfs/dbraw/zinc/16/72/09/1052167209.db2.gz VMSJGKHOWPBYMB-UHFFFAOYSA-N 1 2 307.275 4.199 20 0 DIADLO Fc1cc(Nc2cc[nH+]c3[nH]ccc32)cc(Br)c1F ZINC001174415033 1052167389 /nfs/dbraw/zinc/16/73/89/1052167389.db2.gz FHKGSGJKCOBECO-UHFFFAOYSA-N 1 2 324.128 4.299 20 0 DIADLO CC(C)C[N@H+](Cn1nc(-c2ccccc2F)oc1=S)C1CC1 ZINC000914567082 1052168087 /nfs/dbraw/zinc/16/80/87/1052168087.db2.gz YVWDGIBRBGUZCB-UHFFFAOYSA-N 1 2 321.421 4.090 20 0 DIADLO CC(C)C[N@@H+](Cn1nc(-c2ccccc2F)oc1=S)C1CC1 ZINC000914567082 1052168093 /nfs/dbraw/zinc/16/80/93/1052168093.db2.gz YVWDGIBRBGUZCB-UHFFFAOYSA-N 1 2 321.421 4.090 20 0 DIADLO C[C@@H]([N@H+](C)Cn1nc(-c2ccccc2)oc1=S)C(C)(C)C ZINC000914568405 1052169522 /nfs/dbraw/zinc/16/95/22/1052169522.db2.gz HNDKSYHGWYUZNL-GFCCVEGCSA-N 1 2 305.447 4.196 20 0 DIADLO C[C@@H]([N@@H+](C)Cn1nc(-c2ccccc2)oc1=S)C(C)(C)C ZINC000914568405 1052169524 /nfs/dbraw/zinc/16/95/24/1052169524.db2.gz HNDKSYHGWYUZNL-GFCCVEGCSA-N 1 2 305.447 4.196 20 0 DIADLO CCCC[N@H+](CC)Cn1ncn(-c2ccc(C)cc2C)c1=S ZINC000914567219 1052169560 /nfs/dbraw/zinc/16/95/60/1052169560.db2.gz JWTMWJNHPCADCH-UHFFFAOYSA-N 1 2 318.490 4.100 20 0 DIADLO CCCC[N@@H+](CC)Cn1ncn(-c2ccc(C)cc2C)c1=S ZINC000914567219 1052169564 /nfs/dbraw/zinc/16/95/64/1052169564.db2.gz JWTMWJNHPCADCH-UHFFFAOYSA-N 1 2 318.490 4.100 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(-c2cccs2)n(CC)c1=S ZINC000914567248 1052170141 /nfs/dbraw/zinc/17/01/41/1052170141.db2.gz LGSOGDOAWBWMKC-UHFFFAOYSA-N 1 2 324.519 4.242 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(-c2cccs2)n(CC)c1=S ZINC000914567248 1052170153 /nfs/dbraw/zinc/17/01/53/1052170153.db2.gz LGSOGDOAWBWMKC-UHFFFAOYSA-N 1 2 324.519 4.242 20 0 DIADLO Cc1sccc1Nc1ccc2[nH+]cc(Br)n2c1 ZINC001174459407 1052179735 /nfs/dbraw/zinc/17/97/35/1052179735.db2.gz RJPRIGDEFYLQNE-UHFFFAOYSA-N 1 2 308.204 4.210 20 0 DIADLO Clc1ccsc1C[N@@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000494985839 1052190605 /nfs/dbraw/zinc/19/06/05/1052190605.db2.gz NNXKLNPIYHWIAS-QGZVFWFLSA-N 1 2 319.857 4.075 20 0 DIADLO Clc1ccsc1C[N@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000494985839 1052190612 /nfs/dbraw/zinc/19/06/12/1052190612.db2.gz NNXKLNPIYHWIAS-QGZVFWFLSA-N 1 2 319.857 4.075 20 0 DIADLO Nc1cc[nH+]c(O[C@H](c2ccccc2)c2cccc(Cl)c2)c1 ZINC001218191537 1052205874 /nfs/dbraw/zinc/20/58/74/1052205874.db2.gz BNCNQLUQFXPHHA-GOSISDBHSA-N 1 2 310.784 4.486 20 0 DIADLO CC(C)CC1(C[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)CCC1 ZINC000495069655 1052208958 /nfs/dbraw/zinc/20/89/58/1052208958.db2.gz MPZAYSXYKWQSAU-MRXNPFEDSA-N 1 2 304.482 4.232 20 0 DIADLO Cc1cccc(-c2ccccc2)c1O[C@H]1C[NH2+]CC(F)(F)C1 ZINC001218273796 1052216198 /nfs/dbraw/zinc/21/61/98/1052216198.db2.gz CHPCCOCYVFJSQQ-OAHLLOKOSA-N 1 2 303.352 4.038 20 0 DIADLO Cc1cccc(-c2ccccc2)c1O[C@@H]1C[NH2+]CC(F)(F)C1 ZINC001218273794 1052216333 /nfs/dbraw/zinc/21/63/33/1052216333.db2.gz CHPCCOCYVFJSQQ-HNNXBMFYSA-N 1 2 303.352 4.038 20 0 DIADLO Cc1ccc(-c2ccc(O[C@@H]3C[NH2+]CC(F)(F)C3)cc2)cc1 ZINC001218275291 1052216436 /nfs/dbraw/zinc/21/64/36/1052216436.db2.gz VXDDEYJAHYTRAF-KRWDZBQOSA-N 1 2 303.352 4.038 20 0 DIADLO Cc1cc(O[C@H]2C[NH2+]CC(F)(F)C2)c(C(C)C)cc1Cl ZINC001218273230 1052216622 /nfs/dbraw/zinc/21/66/22/1052216622.db2.gz JGBSMFWQUARFSO-LLVKDONJSA-N 1 2 303.780 4.148 20 0 DIADLO C[C@H](c1ccccc1)c1ccccc1O[C@H]1C[NH2+]CC(F)(F)C1 ZINC001218280978 1052217851 /nfs/dbraw/zinc/21/78/51/1052217851.db2.gz YOPXAEURKBNWQY-GDBMZVCRSA-N 1 2 317.379 4.214 20 0 DIADLO COc1ccc2cc(CC[C@H](C)Oc3ccc[nH+]c3N)ccc2c1 ZINC001218490526 1052250106 /nfs/dbraw/zinc/25/01/06/1052250106.db2.gz LOGNSGCRNOGLCW-AWEZNQCLSA-N 1 2 322.408 4.226 20 0 DIADLO CC(C)c1ccccc1-n1ccn(C[N@H+](C)C2CC2)c1=S ZINC000914783956 1052250928 /nfs/dbraw/zinc/25/09/28/1052250928.db2.gz LSLDEOWERUORAD-UHFFFAOYSA-N 1 2 301.459 4.183 20 0 DIADLO CC(C)c1ccccc1-n1ccn(C[N@@H+](C)C2CC2)c1=S ZINC000914783956 1052250934 /nfs/dbraw/zinc/25/09/34/1052250934.db2.gz LSLDEOWERUORAD-UHFFFAOYSA-N 1 2 301.459 4.183 20 0 DIADLO CCCCc1nc(N[C@H](c2ccccn2)C(F)(F)F)cc(C)[nH+]1 ZINC001168481027 1052261112 /nfs/dbraw/zinc/26/11/12/1052261112.db2.gz PQJFNZJHELTTCQ-OAHLLOKOSA-N 1 2 324.350 4.238 20 0 DIADLO CCc1cnc(C[NH2+]Cc2c(Cl)oc3ccccc32)s1 ZINC000230347544 1052267203 /nfs/dbraw/zinc/26/72/03/1052267203.db2.gz GTHMNCNLMLQCPE-UHFFFAOYSA-N 1 2 306.818 4.395 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1nnc2n1CCCCC2)c1csc(Cl)c1 ZINC000230407780 1052267288 /nfs/dbraw/zinc/26/72/88/1052267288.db2.gz IEWAQKRLQKQDEU-QWRGUYRKSA-N 1 2 324.881 4.131 20 0 DIADLO CC[C@@H](NC(=O)Nc1c(C)cc(C)[nH+]c1C)C1CCCCC1 ZINC001219009821 1052268134 /nfs/dbraw/zinc/26/81/34/1052268134.db2.gz PFJRCTDTQPCLKJ-MRXNPFEDSA-N 1 2 303.450 4.487 20 0 DIADLO CCc1nc(C[N@@H+]2CCS[C@H](C)[C@H]2c2ccccc2)cs1 ZINC000303703981 1052338624 /nfs/dbraw/zinc/33/86/24/1052338624.db2.gz OOIKPNXSJPRDCR-DYVFJYSZSA-N 1 2 318.511 4.384 20 0 DIADLO CCc1nc(C[N@H+]2CCS[C@H](C)[C@H]2c2ccccc2)cs1 ZINC000303703981 1052338626 /nfs/dbraw/zinc/33/86/26/1052338626.db2.gz OOIKPNXSJPRDCR-DYVFJYSZSA-N 1 2 318.511 4.384 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@@H](C)c2ccc(C)s2)n1 ZINC000754672086 1052368282 /nfs/dbraw/zinc/36/82/82/1052368282.db2.gz HICXKQRMQLXVOT-WDEREUQCSA-N 1 2 311.476 4.104 20 0 DIADLO Cc1nc(Cl)c(Nc2ccc([NH+]3CCCCC3)cc2)nc1C ZINC000316625310 1052370840 /nfs/dbraw/zinc/37/08/40/1052370840.db2.gz SFZLJSURIFHWDN-UHFFFAOYSA-N 1 2 316.836 4.481 20 0 DIADLO COc1ccccc1[C@@H](C)SCc1cc[nH+]c(N(C)C)c1 ZINC000762479834 1052389756 /nfs/dbraw/zinc/38/97/56/1052389756.db2.gz NIZOMMLADHWZBE-CYBMUJFWSA-N 1 2 302.443 4.151 20 0 DIADLO c1ccc(N2CCC(Nc3cccc4ccccc43)CC2)[nH+]c1 ZINC000236748478 1052429814 /nfs/dbraw/zinc/42/98/14/1052429814.db2.gz DSIYJDVYZSUZTI-UHFFFAOYSA-N 1 2 303.409 4.316 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+]C[C@H](C)c1ccccc1 ZINC000237447101 1052439944 /nfs/dbraw/zinc/43/99/44/1052439944.db2.gz XLWRHFBTIWILOT-KRWDZBQOSA-N 1 2 310.441 4.047 20 0 DIADLO CC(=O)Nc1cccc([C@H](C)Nc2ccc([NH+](C)C)cc2C)c1 ZINC000237534703 1052443000 /nfs/dbraw/zinc/44/30/00/1052443000.db2.gz HALODKQBBPEOTI-AWEZNQCLSA-N 1 2 311.429 4.193 20 0 DIADLO FC(F)(F)c1ccc(CNc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC000237887202 1052447558 /nfs/dbraw/zinc/44/75/58/1052447558.db2.gz CQVXFQPABDJKQR-UHFFFAOYSA-N 1 2 321.346 4.313 20 0 DIADLO Cc1ccc(C[NH+](Cc2cccnc2)Cc2cccnc2)s1 ZINC000197692419 1052448809 /nfs/dbraw/zinc/44/88/09/1052448809.db2.gz OLURSOBKDBGORY-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1csc(C)n1 ZINC000915669834 1052467924 /nfs/dbraw/zinc/46/79/24/1052467924.db2.gz UWSLRVFNUGSNEM-UHFFFAOYSA-N 1 2 300.431 4.062 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1csc(CC)n1 ZINC000915669285 1052467998 /nfs/dbraw/zinc/46/79/98/1052467998.db2.gz BDCIXFLUCUFTMO-UHFFFAOYSA-N 1 2 314.458 4.316 20 0 DIADLO COc1c(F)c(C)ccc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001222321831 1052481887 /nfs/dbraw/zinc/48/18/87/1052481887.db2.gz FUQSVMLLKPEGBF-UHFFFAOYSA-N 1 2 300.308 4.135 20 0 DIADLO FC(F)(F)Oc1cccc(-c2cc[nH+]c(N3CCCC3)c2)c1 ZINC001222323700 1052482901 /nfs/dbraw/zinc/48/29/01/1052482901.db2.gz VMMTVKRRGZQCKM-UHFFFAOYSA-N 1 2 308.303 4.247 20 0 DIADLO CC[N@H+](Cc1ccc(OC)cc1)Cc1nccc(C)c1Cl ZINC001235587655 1052485161 /nfs/dbraw/zinc/48/51/61/1052485161.db2.gz GFYGVJWJEYTBSI-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)cc1)Cc1nccc(C)c1Cl ZINC001235587655 1052485165 /nfs/dbraw/zinc/48/51/65/1052485165.db2.gz GFYGVJWJEYTBSI-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1ccc(Cl)c(Cl)c1 ZINC001222352940 1052488452 /nfs/dbraw/zinc/48/84/52/1052488452.db2.gz VQDOHFWIQCGPTO-UHFFFAOYSA-N 1 2 323.223 4.200 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(Cl)cc3Cl)ccc2[nH+]1 ZINC000074859578 1052507283 /nfs/dbraw/zinc/50/72/83/1052507283.db2.gz QZWPRPBNOVVMNA-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2nc(-c3ccccc3)no2)cc1 ZINC000025360140 1052515196 /nfs/dbraw/zinc/51/51/96/1052515196.db2.gz NHALZUQALPNVRZ-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2nc(-c3ccccc3)no2)cc1 ZINC000025360140 1052515202 /nfs/dbraw/zinc/51/52/02/1052515202.db2.gz NHALZUQALPNVRZ-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Cc1nc([C@@H]([NH2+]C[C@H](C)C(C)(C)C)c2ccc(Cl)cc2)no1 ZINC000670267999 1052544300 /nfs/dbraw/zinc/54/43/00/1052544300.db2.gz BBJJYZKNOHFFBC-NHYWBVRUSA-N 1 2 321.852 4.393 20 0 DIADLO Cc1ncc(C[NH2+][C@H](C)c2cc(F)c(Cl)cc2Cl)o1 ZINC000397956366 1052559862 /nfs/dbraw/zinc/55/98/62/1052559862.db2.gz RWRWFSAEWHUOCM-SSDOTTSWSA-N 1 2 303.164 4.280 20 0 DIADLO Cc1nc(SCc2ccc(N)[nH+]c2)n(C2CCCCC2)c1C ZINC000916177086 1052594129 /nfs/dbraw/zinc/59/41/29/1052594129.db2.gz QYHNXSRWZLWZFC-UHFFFAOYSA-N 1 2 316.474 4.275 20 0 DIADLO Fc1ccc(Cl)cc1CNc1ccc(N2CCCC2)[nH+]c1 ZINC000125375048 1052648169 /nfs/dbraw/zinc/64/81/69/1052648169.db2.gz KXDSFOSDLHXNCF-UHFFFAOYSA-N 1 2 305.784 4.086 20 0 DIADLO CC(C)c1ccc([C@@H]2CCC[N@@H+]2Cc2nc(C3CC3)no2)cc1 ZINC000125467383 1052649238 /nfs/dbraw/zinc/64/92/38/1052649238.db2.gz XBZKLNFCDCWLNE-KRWDZBQOSA-N 1 2 311.429 4.408 20 0 DIADLO CC(C)c1ccc([C@@H]2CCC[N@H+]2Cc2nc(C3CC3)no2)cc1 ZINC000125467383 1052649241 /nfs/dbraw/zinc/64/92/41/1052649241.db2.gz XBZKLNFCDCWLNE-KRWDZBQOSA-N 1 2 311.429 4.408 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+](Cc1cccnc1)C(C)C ZINC000125744428 1052652850 /nfs/dbraw/zinc/65/28/50/1052652850.db2.gz HRZDDDWKLFKVEK-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+](Cc1cccnc1)C(C)C ZINC000125744428 1052652854 /nfs/dbraw/zinc/65/28/54/1052652854.db2.gz HRZDDDWKLFKVEK-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO Cn1c2ccc(Cl)cc2nc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC000916856307 1052661309 /nfs/dbraw/zinc/66/13/09/1052661309.db2.gz KVLMODONZFSOOM-UHFFFAOYSA-N 1 2 308.772 4.079 20 0 DIADLO FC(F)(F)[C@H]1CCC[C@H](Nc2ccc(N3CCCC3)[nH+]c2)C1 ZINC000125977573 1052662316 /nfs/dbraw/zinc/66/23/16/1052662316.db2.gz GUODZZYAFWUADY-STQMWFEESA-N 1 2 313.367 4.215 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@@H+](Cc2cccc3cccnc32)C1 ZINC000126373908 1052668873 /nfs/dbraw/zinc/66/88/73/1052668873.db2.gz ZQAQKNYCZHSSCR-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@H+](Cc2cccc3cccnc32)C1 ZINC000126373908 1052668876 /nfs/dbraw/zinc/66/88/76/1052668876.db2.gz ZQAQKNYCZHSSCR-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO CC[N@@H+](c1ccc(Nc2nn3cc(C)nc3s2)cc1)C(C)C ZINC000916977459 1052676750 /nfs/dbraw/zinc/67/67/50/1052676750.db2.gz RGARDZWSSUEXBN-UHFFFAOYSA-N 1 2 315.446 4.078 20 0 DIADLO CC[N@H+](c1ccc(Nc2nn3cc(C)nc3s2)cc1)C(C)C ZINC000916977459 1052676754 /nfs/dbraw/zinc/67/67/54/1052676754.db2.gz RGARDZWSSUEXBN-UHFFFAOYSA-N 1 2 315.446 4.078 20 0 DIADLO COc1c(C)c[nH+]c(CSc2ncnc3ccsc32)c1C ZINC000126818092 1052681598 /nfs/dbraw/zinc/68/15/98/1052681598.db2.gz IRZANTRGXZYGLJ-UHFFFAOYSA-N 1 2 317.439 4.004 20 0 DIADLO Cc1cn2c(cccc2Nc2cc(F)c(F)cc2OC(C)C)[nH+]1 ZINC001212219911 1052687936 /nfs/dbraw/zinc/68/79/36/1052687936.db2.gz APQYITQUJSXSMD-UHFFFAOYSA-N 1 2 317.339 4.452 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2cc[nH]n2)c2cccs2)cc1 ZINC000066990355 1052698243 /nfs/dbraw/zinc/69/82/43/1052698243.db2.gz KIDSEXRKYYHCLT-OAHLLOKOSA-N 1 2 303.818 4.004 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1ccc2c(c1)CCCC2 ZINC000154343644 1052718980 /nfs/dbraw/zinc/71/89/80/1052718980.db2.gz BUOOYDYKEBTCKM-CYBMUJFWSA-N 1 2 313.445 4.097 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(Nc2ccccc2)cc1)n1cc[nH+]c1 ZINC000917359619 1052723545 /nfs/dbraw/zinc/72/35/45/1052723545.db2.gz CPEGGNWFBZDWDL-HNNXBMFYSA-N 1 2 320.396 4.217 20 0 DIADLO CCOC(=[NH2+])CCCCO[C@@H](c1ccccc1)c1ccccn1 ZINC001224965264 1052738681 /nfs/dbraw/zinc/73/86/81/1052738681.db2.gz IGWIFAIRORAGPN-IBGZPJMESA-N 1 2 312.413 4.372 20 0 DIADLO Cc1cccc(O[C@@H]2CCC[N@H+](Cc3cnc(Cl)s3)C2)c1 ZINC001225242219 1052761696 /nfs/dbraw/zinc/76/16/96/1052761696.db2.gz PXVVVCGFBNJLKY-CQSZACIVSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1cccc(O[C@@H]2CCC[N@@H+](Cc3cnc(Cl)s3)C2)c1 ZINC001225242219 1052761701 /nfs/dbraw/zinc/76/17/01/1052761701.db2.gz PXVVVCGFBNJLKY-CQSZACIVSA-N 1 2 322.861 4.148 20 0 DIADLO Brc1ccc(C2CC(Oc3cc[nH+]cc3)C2)cc1 ZINC001225293945 1052769840 /nfs/dbraw/zinc/76/98/40/1052769840.db2.gz CMAMTFHLBSIKKJ-UHFFFAOYSA-N 1 2 304.187 4.169 20 0 DIADLO O=C(/C=C/c1ccccc1Cl)Nc1ccccc1-n1cc[nH+]c1 ZINC000918066242 1052777048 /nfs/dbraw/zinc/77/70/48/1052777048.db2.gz QFOJDQUZWKIQCI-MDZDMXLPSA-N 1 2 323.783 4.178 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1cc(F)ccc1OC(F)F ZINC000660141060 1052798287 /nfs/dbraw/zinc/79/82/87/1052798287.db2.gz SMGFFAXHKUHAGB-NSHDSACASA-N 1 2 310.319 4.015 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1cc(F)ccc1OC(F)F ZINC000660141060 1052798290 /nfs/dbraw/zinc/79/82/90/1052798290.db2.gz SMGFFAXHKUHAGB-NSHDSACASA-N 1 2 310.319 4.015 20 0 DIADLO CC(C)CC1(C[NH2+][C@H](c2cccs2)c2nnc[nH]2)CCCC1 ZINC000556104697 1052799856 /nfs/dbraw/zinc/79/98/56/1052799856.db2.gz IFITUOVFOYGAGH-OAHLLOKOSA-N 1 2 318.490 4.152 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1ncccc1C(F)(F)F ZINC000129712490 1052807293 /nfs/dbraw/zinc/80/72/93/1052807293.db2.gz KUIJELRVWCQBNC-LLVKDONJSA-N 1 2 312.310 4.433 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1ncccc1C(F)(F)F ZINC000129712490 1052807299 /nfs/dbraw/zinc/80/72/99/1052807299.db2.gz KUIJELRVWCQBNC-LLVKDONJSA-N 1 2 312.310 4.433 20 0 DIADLO CCn1nccc1C[N@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000129886076 1052813148 /nfs/dbraw/zinc/81/31/48/1052813148.db2.gz LMQJPOBTMFVRTK-CYBMUJFWSA-N 1 2 303.837 4.282 20 0 DIADLO CCn1nccc1C[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000129886076 1052813151 /nfs/dbraw/zinc/81/31/51/1052813151.db2.gz LMQJPOBTMFVRTK-CYBMUJFWSA-N 1 2 303.837 4.282 20 0 DIADLO C[C@H](c1nc(-c2cccs2)no1)[N@H+](C)Cc1cccc(F)c1 ZINC000129926491 1052814027 /nfs/dbraw/zinc/81/40/27/1052814027.db2.gz VJBVLADCJQSEBH-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO C[C@H](c1nc(-c2cccs2)no1)[N@@H+](C)Cc1cccc(F)c1 ZINC000129926491 1052814032 /nfs/dbraw/zinc/81/40/32/1052814032.db2.gz VJBVLADCJQSEBH-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO C[C@@]1(C[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)C[C@H]1c1ccccc1 ZINC000556224162 1052822071 /nfs/dbraw/zinc/82/20/71/1052822071.db2.gz QWKKGTUVJNWSQZ-NSHGMRRFSA-N 1 2 324.472 4.210 20 0 DIADLO C[C@@]1(C[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)C[C@H]1c1ccccc1 ZINC000556224159 1052822263 /nfs/dbraw/zinc/82/22/63/1052822263.db2.gz QWKKGTUVJNWSQZ-BJLQDIEVSA-N 1 2 324.472 4.210 20 0 DIADLO Cc1ccc(NC(=O)c2cccc(C(C)(C)C)c2)c(N(C)C)[nH+]1 ZINC001127450452 1052839150 /nfs/dbraw/zinc/83/91/50/1052839150.db2.gz AWVATHTVDYOWSX-UHFFFAOYSA-N 1 2 311.429 4.006 20 0 DIADLO C[C@H](CC(=O)Nc1ccccc1Oc1ccccc1)n1cc[nH+]c1 ZINC000556687817 1052876223 /nfs/dbraw/zinc/87/62/23/1052876223.db2.gz BRNNUHYBJYPIGH-OAHLLOKOSA-N 1 2 321.380 4.265 20 0 DIADLO C[C@H]([NH2+][C@@H](c1cccs1)c1ccc(F)cc1)c1ncc[nH]1 ZINC000556860398 1052890039 /nfs/dbraw/zinc/89/00/39/1052890039.db2.gz IZMXOXSZVSBWHB-XHDPSFHLSA-N 1 2 301.390 4.051 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CCc3cccc(F)c3C2)s1 ZINC000556887767 1052893134 /nfs/dbraw/zinc/89/31/34/1052893134.db2.gz GZLHFELGEQOJBC-UHFFFAOYSA-N 1 2 304.434 4.138 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CCc3cccc(F)c3C2)s1 ZINC000556887767 1052893135 /nfs/dbraw/zinc/89/31/35/1052893135.db2.gz GZLHFELGEQOJBC-UHFFFAOYSA-N 1 2 304.434 4.138 20 0 DIADLO CC1(C)C[N@H+](Cc2ncc(C(F)(F)F)s2)[C@@H]2CCC[C@@H]21 ZINC000556958945 1052905278 /nfs/dbraw/zinc/90/52/78/1052905278.db2.gz LMZDISATLVBDPM-VHSXEESVSA-N 1 2 304.381 4.172 20 0 DIADLO CC1(C)C[N@@H+](Cc2ncc(C(F)(F)F)s2)[C@@H]2CCC[C@@H]21 ZINC000556958945 1052905282 /nfs/dbraw/zinc/90/52/82/1052905282.db2.gz LMZDISATLVBDPM-VHSXEESVSA-N 1 2 304.381 4.172 20 0 DIADLO CC1(C)C[N@H+](Cc2ncc(C(F)(F)F)s2)[C@@H]2CCC[C@H]21 ZINC000556958943 1052905933 /nfs/dbraw/zinc/90/59/33/1052905933.db2.gz LMZDISATLVBDPM-NXEZZACHSA-N 1 2 304.381 4.172 20 0 DIADLO CC1(C)C[N@@H+](Cc2ncc(C(F)(F)F)s2)[C@@H]2CCC[C@H]21 ZINC000556958943 1052905936 /nfs/dbraw/zinc/90/59/36/1052905936.db2.gz LMZDISATLVBDPM-NXEZZACHSA-N 1 2 304.381 4.172 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)Cc3ccc(C)cc3)c2)[nH+]c1C ZINC000920251270 1052930411 /nfs/dbraw/zinc/93/04/11/1052930411.db2.gz IIEGDUWTADTALV-UHFFFAOYSA-N 1 2 319.408 4.183 20 0 DIADLO Cc1ccsc1C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC000920251220 1052930593 /nfs/dbraw/zinc/93/05/93/1052930593.db2.gz HUZOLNRMICXSAT-UHFFFAOYSA-N 1 2 311.410 4.316 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3cccc(C)c3)c2)[nH+]c1C ZINC000920251193 1052930828 /nfs/dbraw/zinc/93/08/28/1052930828.db2.gz HLLJYICKCIGAIA-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO C[N@H+](Cn1ncn(C2CC2)c1=S)C1CCC(C(C)(C)C)CC1 ZINC000921047198 1052960697 /nfs/dbraw/zinc/96/06/97/1052960697.db2.gz WGMLQKOYMIOENU-UHFFFAOYSA-N 1 2 322.522 4.243 20 0 DIADLO C[N@@H+](Cn1ncn(C2CC2)c1=S)C1CCC(C(C)(C)C)CC1 ZINC000921047198 1052960699 /nfs/dbraw/zinc/96/06/99/1052960699.db2.gz WGMLQKOYMIOENU-UHFFFAOYSA-N 1 2 322.522 4.243 20 0 DIADLO CC(C)CC[N@H+](C)Cn1nc2sc3ccccc3n2c1=S ZINC000921050974 1052961045 /nfs/dbraw/zinc/96/10/45/1052961045.db2.gz ZXVCLHHVESWGIM-UHFFFAOYSA-N 1 2 320.487 4.015 20 0 DIADLO CC(C)CC[N@@H+](C)Cn1nc2sc3ccccc3n2c1=S ZINC000921050974 1052961048 /nfs/dbraw/zinc/96/10/48/1052961048.db2.gz ZXVCLHHVESWGIM-UHFFFAOYSA-N 1 2 320.487 4.015 20 0 DIADLO COC(=O)c1c(C)cc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1C ZINC001213122790 1052961223 /nfs/dbraw/zinc/96/12/23/1052961223.db2.gz CUFYUPDKFPSZGV-UHFFFAOYSA-N 1 2 321.380 4.019 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](Cn1cc(Cl)cn1)C1CC1 ZINC000921186879 1052964503 /nfs/dbraw/zinc/96/45/03/1052964503.db2.gz RUPKSAGJLLNHNG-NSHDSACASA-N 1 2 310.228 4.373 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](Cn1cc(Cl)cn1)C1CC1 ZINC000921186879 1052964505 /nfs/dbraw/zinc/96/45/05/1052964505.db2.gz RUPKSAGJLLNHNG-NSHDSACASA-N 1 2 310.228 4.373 20 0 DIADLO Cc1cc[nH+]c(C)c1O[C@@H](C)c1ncc(C(F)(F)F)cc1F ZINC001227264137 1052977203 /nfs/dbraw/zinc/97/72/03/1052977203.db2.gz JNIIAISRBRCGAO-JTQLQIEISA-N 1 2 314.282 4.391 20 0 DIADLO COc1ccc2oc(CNc3ccc([NH+](C)C)cc3C)cc2c1 ZINC000763459961 1053004256 /nfs/dbraw/zinc/00/42/56/1053004256.db2.gz CSHHLMBKYZMNFN-UHFFFAOYSA-N 1 2 310.397 4.428 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c(C)c1 ZINC000237553053 1053011927 /nfs/dbraw/zinc/01/19/27/1053011927.db2.gz KDIRHHBAOJCEGP-AWEZNQCLSA-N 1 2 301.434 4.143 20 0 DIADLO Oc1ccc(C2=CC[N@H+](Cc3cccc(Cl)c3O)CC2)cc1 ZINC000179631297 1053018972 /nfs/dbraw/zinc/01/89/72/1053018972.db2.gz MBOSBNTUQMXEPB-UHFFFAOYSA-N 1 2 315.800 4.041 20 0 DIADLO Oc1ccc(C2=CC[N@@H+](Cc3cccc(Cl)c3O)CC2)cc1 ZINC000179631297 1053018974 /nfs/dbraw/zinc/01/89/74/1053018974.db2.gz MBOSBNTUQMXEPB-UHFFFAOYSA-N 1 2 315.800 4.041 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2O)C[C@H](c2ccccc2)O1 ZINC000179854701 1053031343 /nfs/dbraw/zinc/03/13/43/1053031343.db2.gz XBIHJDHHIHXHJB-CXAGYDPISA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2O)C[C@H](c2ccccc2)O1 ZINC000179854701 1053031349 /nfs/dbraw/zinc/03/13/49/1053031349.db2.gz XBIHJDHHIHXHJB-CXAGYDPISA-N 1 2 317.816 4.008 20 0 DIADLO Cc1cnc(CSCc2ccc(-n3cc[nH+]c3)cc2)s1 ZINC000180013238 1053042324 /nfs/dbraw/zinc/04/23/24/1053042324.db2.gz VNQKIDJEWMQBJQ-UHFFFAOYSA-N 1 2 301.440 4.071 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)o1 ZINC000068813096 1053071943 /nfs/dbraw/zinc/07/19/43/1053071943.db2.gz HGYOUUUDCMGDIU-OAHLLOKOSA-N 1 2 319.424 4.383 20 0 DIADLO Cc1[nH]c2ccc(OC3CCN(c4ccc(C)cc4)CC3)cc2[nH+]1 ZINC001228326363 1053074078 /nfs/dbraw/zinc/07/40/78/1053074078.db2.gz HMLPPLLYKXAFDS-UHFFFAOYSA-N 1 2 321.424 4.228 20 0 DIADLO Cc1[nH]c2ccc(O[C@@H]3CC[C@@H](OCc4ccccc4)C3)cc2[nH+]1 ZINC001228330295 1053076540 /nfs/dbraw/zinc/07/65/40/1053076540.db2.gz XGTPNPRZOIFPPF-IAGOWNOFSA-N 1 2 322.408 4.388 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C=CSc3ccccc3)cc2[nH+]1 ZINC000849366287 1053088918 /nfs/dbraw/zinc/08/89/18/1053088918.db2.gz XEKCDNRPIQLMNB-KTKRTIGZSA-N 1 2 309.394 4.116 20 0 DIADLO COc1cncc(CNc2[nH+]c3ccccc3n2C2CCCC2)c1 ZINC000849344692 1053089479 /nfs/dbraw/zinc/08/94/79/1053089479.db2.gz BLUJJODLTKUOLK-UHFFFAOYSA-N 1 2 322.412 4.167 20 0 DIADLO C[C@@H]([NH2+]Cc1cnn(C2CCC2)c1)c1nc(C(C)(C)C)cs1 ZINC001350887547 1053114564 /nfs/dbraw/zinc/11/45/64/1053114564.db2.gz DGSQKJVTFCOVRE-GFCCVEGCSA-N 1 2 318.490 4.213 20 0 DIADLO CC(C)C(C)(C)C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001350904691 1053116712 /nfs/dbraw/zinc/11/67/12/1053116712.db2.gz MWNSZGGKORIVSS-HNNXBMFYSA-N 1 2 319.493 4.026 20 0 DIADLO CC[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001351066398 1053132694 /nfs/dbraw/zinc/13/26/94/1053132694.db2.gz YRLLQNYFKXEXFA-ZFWWWQNUSA-N 1 2 315.392 4.166 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ncc(C(C)C)o2)c1 ZINC001351065806 1053132711 /nfs/dbraw/zinc/13/27/11/1053132711.db2.gz QBNNLMHINOSJCA-INIZCTEOSA-N 1 2 300.402 4.144 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2ncc(C(C)C)o2)c1 ZINC001351065806 1053132717 /nfs/dbraw/zinc/13/27/17/1053132717.db2.gz QBNNLMHINOSJCA-INIZCTEOSA-N 1 2 300.402 4.144 20 0 DIADLO Cc1cc(NCc2ccc(OC(C)C)nc2)[nH+]c2ccccc12 ZINC001317881372 1053136781 /nfs/dbraw/zinc/13/67/81/1053136781.db2.gz YTLBCUCQJKSYKB-UHFFFAOYSA-N 1 2 307.397 4.338 20 0 DIADLO CCC(CC)[N@H+](Cn1nc(NC(C)C)sc1=S)C1CC1 ZINC001317976062 1053141800 /nfs/dbraw/zinc/14/18/00/1053141800.db2.gz FVWKEURFNVYABC-UHFFFAOYSA-N 1 2 314.524 4.105 20 0 DIADLO CCC(CC)[N@@H+](Cn1nc(NC(C)C)sc1=S)C1CC1 ZINC001317976062 1053141807 /nfs/dbraw/zinc/14/18/07/1053141807.db2.gz FVWKEURFNVYABC-UHFFFAOYSA-N 1 2 314.524 4.105 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(CNc2ccccc2)cc1 ZINC001212300440 1053143441 /nfs/dbraw/zinc/14/34/41/1053143441.db2.gz UURSYYSYUNRHHS-UHFFFAOYSA-N 1 2 305.381 4.446 20 0 DIADLO CC(C)Oc1ccc(F)c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001212310553 1053149044 /nfs/dbraw/zinc/14/90/44/1053149044.db2.gz LULDPIAUWBDDCQ-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)CC(C3CC3)C3CC3)c2)[nH+]c1C ZINC001318183978 1053154103 /nfs/dbraw/zinc/15/41/03/1053154103.db2.gz VUOJHFVXKGTRSO-UHFFFAOYSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1cc(NCc2nc(C)c3ccccc3n2)[nH+]c2ccccc12 ZINC001318215723 1053155703 /nfs/dbraw/zinc/15/57/03/1053155703.db2.gz FFYPCUHMOAKJHO-UHFFFAOYSA-N 1 2 314.392 4.407 20 0 DIADLO CCCCn1c(SC[C@H](C)CC)nnc1[C@H](CC)[NH+](C)C ZINC000088484592 1053189756 /nfs/dbraw/zinc/18/97/56/1053189756.db2.gz PZGWZJCDMWMSMP-KGLIPLIRSA-N 1 2 312.527 4.229 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(F)c(C(F)F)c2)c(C)[nH+]1 ZINC001351553755 1053193783 /nfs/dbraw/zinc/19/37/83/1053193783.db2.gz FFIVCUPIKLRCCD-UHFFFAOYSA-N 1 2 308.303 4.336 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccn(C)c2-c2ccccc2)c(C)[nH+]1 ZINC001351553754 1053193913 /nfs/dbraw/zinc/19/39/13/1053193913.db2.gz FENBEBHUWAIPBW-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc3cccc(F)c3nc2C)c(C)[nH+]1 ZINC001351554795 1053194388 /nfs/dbraw/zinc/19/43/88/1053194388.db2.gz KBGLSDOSYXOHLC-UHFFFAOYSA-N 1 2 323.371 4.255 20 0 DIADLO Cc1cc(N2CCC[C@H](OCC(F)(F)F)C2)[nH+]c2ccccc12 ZINC001319088484 1053216723 /nfs/dbraw/zinc/21/67/23/1053216723.db2.gz MSWQRRBLORBSLW-ZDUSSCGKSA-N 1 2 324.346 4.091 20 0 DIADLO Cc1ccc(CNc2ccc3c(c2)[nH+]cn3-c2ccccc2)cn1 ZINC000200656930 1053224927 /nfs/dbraw/zinc/22/49/27/1053224927.db2.gz SFAIHQSCPZPGEK-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Clc1ccc([C@@H]2C[N@H+](CCCc3ccccc3)CCO2)s1 ZINC001319256351 1053229707 /nfs/dbraw/zinc/22/97/07/1053229707.db2.gz SKWNJKNKWJKHOZ-HNNXBMFYSA-N 1 2 321.873 4.408 20 0 DIADLO Clc1ccc([C@@H]2C[N@@H+](CCCc3ccccc3)CCO2)s1 ZINC001319256351 1053229716 /nfs/dbraw/zinc/22/97/16/1053229716.db2.gz SKWNJKNKWJKHOZ-HNNXBMFYSA-N 1 2 321.873 4.408 20 0 DIADLO CCOc1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)o1 ZINC001351986713 1053255029 /nfs/dbraw/zinc/25/50/29/1053255029.db2.gz JHMZCINTYCWSHA-LLVKDONJSA-N 1 2 308.447 4.283 20 0 DIADLO CCc1ccc(Cl)c(CC)c1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000649501666 1053274144 /nfs/dbraw/zinc/27/41/44/1053274144.db2.gz PDYNBNZIBXIFFZ-GFCCVEGCSA-N 1 2 319.836 4.251 20 0 DIADLO CC(C)c1noc(C[N@@H+]2C[C@H]3CCCC[C@@]32c2ccccc2)n1 ZINC001319808170 1053275831 /nfs/dbraw/zinc/27/58/31/1053275831.db2.gz IYQMCLXLYRKGNS-VQIMIIECSA-N 1 2 311.429 4.094 20 0 DIADLO CC(C)c1noc(C[N@H+]2C[C@H]3CCCC[C@@]32c2ccccc2)n1 ZINC001319808170 1053275843 /nfs/dbraw/zinc/27/58/43/1053275843.db2.gz IYQMCLXLYRKGNS-VQIMIIECSA-N 1 2 311.429 4.094 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@H](C)c1cc(O)ccc1F)CCC2 ZINC001352083957 1053276362 /nfs/dbraw/zinc/27/63/62/1053276362.db2.gz IAKPQUBMMDIZBR-SJKOYZFVSA-N 1 2 317.408 4.037 20 0 DIADLO COc1c(C)c[nH+]c(CS[C@@H](C)c2nc(C(C)C)no2)c1C ZINC001319859266 1053283524 /nfs/dbraw/zinc/28/35/24/1053283524.db2.gz SJFARKDHZWBLFI-LBPRGKRZSA-N 1 2 321.446 4.208 20 0 DIADLO Cc1nc(C[N@H+]2CC=C(c3ccc(Cl)nc3)CC2)c(C)s1 ZINC001319895007 1053284913 /nfs/dbraw/zinc/28/49/13/1053284913.db2.gz KMCHYMMKWDLXLV-UHFFFAOYSA-N 1 2 319.861 4.098 20 0 DIADLO Cc1nc(C[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)c(C)s1 ZINC001319895007 1053284920 /nfs/dbraw/zinc/28/49/20/1053284920.db2.gz KMCHYMMKWDLXLV-UHFFFAOYSA-N 1 2 319.861 4.098 20 0 DIADLO CCCCC[C@@H]([NH2+]Cc1nc(CCC)no1)c1ccccc1 ZINC000181742703 1053286677 /nfs/dbraw/zinc/28/66/77/1053286677.db2.gz HHSJMRFJVZYBBD-MRXNPFEDSA-N 1 2 301.434 4.433 20 0 DIADLO CC(C)c1nn(C)c(Cl)c1C[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000069753111 1053290958 /nfs/dbraw/zinc/29/09/58/1053290958.db2.gz LXKRTILXLVTBSZ-DGCLKSJQSA-N 1 2 321.852 4.203 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2cccc(Cl)n2)c1C ZINC001320095690 1053303470 /nfs/dbraw/zinc/30/34/70/1053303470.db2.gz NYKLUADWASOEQR-UHFFFAOYSA-N 1 2 308.834 4.189 20 0 DIADLO Cc1nc(CSCc2ccc(-n3cc[nH+]c3)cc2)c(C)s1 ZINC001320122314 1053307996 /nfs/dbraw/zinc/30/79/96/1053307996.db2.gz ITXQNXHKIROVSM-UHFFFAOYSA-N 1 2 315.467 4.379 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1nc(C)sc1C ZINC001320123104 1053308492 /nfs/dbraw/zinc/30/84/92/1053308492.db2.gz LHRYDACKMWNSLF-UHFFFAOYSA-N 1 2 314.458 4.370 20 0 DIADLO Cc1cc(-c2ccccc2)ccc1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001320179046 1053311764 /nfs/dbraw/zinc/31/17/64/1053311764.db2.gz JGLHMFHQFZRMTI-HNNXBMFYSA-N 1 2 305.381 4.058 20 0 DIADLO CN(C)c1cc(CSCCC(Cl)(Cl)Cl)cc[nH+]1 ZINC001320278560 1053320701 /nfs/dbraw/zinc/32/07/01/1053320701.db2.gz NWRFGDZNRLEXMU-UHFFFAOYSA-N 1 2 313.681 4.141 20 0 DIADLO CCc1noc([C@H](C)[N@H+]2CC=C(c3cc(C)cc(C)c3)CC2)n1 ZINC000092427389 1053321323 /nfs/dbraw/zinc/32/13/23/1053321323.db2.gz ZMWQMVXWAOTVAV-HNNXBMFYSA-N 1 2 311.429 4.099 20 0 DIADLO CCc1noc([C@H](C)[N@@H+]2CC=C(c3cc(C)cc(C)c3)CC2)n1 ZINC000092427389 1053321338 /nfs/dbraw/zinc/32/13/38/1053321338.db2.gz ZMWQMVXWAOTVAV-HNNXBMFYSA-N 1 2 311.429 4.099 20 0 DIADLO C[C@@H](SCc1cc[nH+]c(N(C)C)c1)c1ncc(C(C)(C)C)o1 ZINC001320278582 1053322115 /nfs/dbraw/zinc/32/21/15/1053322115.db2.gz OEPDCAJGLWOWHB-GFCCVEGCSA-N 1 2 319.474 4.428 20 0 DIADLO Cc1cccnc1C[N@@H+](C)[C@@H](C)c1ccccc1Br ZINC000093168590 1053365492 /nfs/dbraw/zinc/36/54/92/1053365492.db2.gz XEMRWXMFNDTSCJ-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cccnc1C[N@H+](C)[C@@H](C)c1ccccc1Br ZINC000093168590 1053365511 /nfs/dbraw/zinc/36/55/11/1053365511.db2.gz XEMRWXMFNDTSCJ-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CCCC[C@H]2c2ccccc2)s1 ZINC000450747669 1053367548 /nfs/dbraw/zinc/36/75/48/1053367548.db2.gz PXKQNTKIWWGJBV-HNNXBMFYSA-N 1 2 301.459 4.389 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CCCC[C@H]2c2ccccc2)s1 ZINC000450747669 1053367562 /nfs/dbraw/zinc/36/75/62/1053367562.db2.gz PXKQNTKIWWGJBV-HNNXBMFYSA-N 1 2 301.459 4.389 20 0 DIADLO CC(C)Cc1ncc(C[N@H+](C)Cc2cc(F)cc(F)c2)s1 ZINC001320899473 1053374780 /nfs/dbraw/zinc/37/47/80/1053374780.db2.gz LCQJATJPPFZCLW-UHFFFAOYSA-N 1 2 310.413 4.252 20 0 DIADLO CC(C)Cc1ncc(C[N@@H+](C)Cc2cc(F)cc(F)c2)s1 ZINC001320899473 1053374789 /nfs/dbraw/zinc/37/47/89/1053374789.db2.gz LCQJATJPPFZCLW-UHFFFAOYSA-N 1 2 310.413 4.252 20 0 DIADLO CCc1noc([C@H](C)[N@H+]2CC=C(c3ccc(CC)cc3)CC2)n1 ZINC000093263636 1053375603 /nfs/dbraw/zinc/37/56/03/1053375603.db2.gz FAHMBHXFYNLWLT-AWEZNQCLSA-N 1 2 311.429 4.045 20 0 DIADLO CCc1noc([C@H](C)[N@@H+]2CC=C(c3ccc(CC)cc3)CC2)n1 ZINC000093263636 1053375617 /nfs/dbraw/zinc/37/56/17/1053375617.db2.gz FAHMBHXFYNLWLT-AWEZNQCLSA-N 1 2 311.429 4.045 20 0 DIADLO CC(=O)Nc1ccc([C@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)cc1 ZINC000182216068 1053378801 /nfs/dbraw/zinc/37/88/01/1053378801.db2.gz RSCLVOCAIADQEZ-AWEZNQCLSA-N 1 2 323.440 4.201 20 0 DIADLO CC(=O)Nc1ccc([C@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)cc1 ZINC000182216068 1053378809 /nfs/dbraw/zinc/37/88/09/1053378809.db2.gz RSCLVOCAIADQEZ-AWEZNQCLSA-N 1 2 323.440 4.201 20 0 DIADLO FC(F)C(F)(F)CSCc1ccc(-n2cc[nH+]c2)cc1 ZINC001320997006 1053381310 /nfs/dbraw/zinc/38/13/10/1053381310.db2.gz YTHKPDKPWHDXAW-UHFFFAOYSA-N 1 2 304.312 4.006 20 0 DIADLO CC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001434922248 1053386916 /nfs/dbraw/zinc/38/69/16/1053386916.db2.gz VUUSWYUBIGDGKX-OCCSQVGLSA-N 1 2 317.820 4.291 20 0 DIADLO Fc1c(Cl)cccc1C[NH2+]Cc1nc(-c2ccccc2)c[nH]1 ZINC001321296583 1053406944 /nfs/dbraw/zinc/40/69/44/1053406944.db2.gz QGQHSVISPRZVHI-UHFFFAOYSA-N 1 2 315.779 4.159 20 0 DIADLO COc1cc(C)c([C@H](C)Nc2ccc([NH+](C)C)cc2)cc1OC ZINC000182495931 1053455221 /nfs/dbraw/zinc/45/52/21/1053455221.db2.gz PJNGTTYAWDYTNQ-AWEZNQCLSA-N 1 2 314.429 4.251 20 0 DIADLO O=C(Nc1ccc(-c2ccccc2)cc1)c1cccc2[nH+]ccn21 ZINC001353046676 1053467920 /nfs/dbraw/zinc/46/79/20/1053467920.db2.gz AUFGFDPLXSAIIU-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO Cl/C=C(/Cl)C[NH+]1CCC(OCC2CCCCC2)CC1 ZINC000763559737 1053472742 /nfs/dbraw/zinc/47/27/42/1053472742.db2.gz RSTPISZUUBCQQR-GXDHUFHOSA-N 1 2 306.277 4.367 20 0 DIADLO Fc1cccc([C@@H]2C[N@@H+]([C@@H]3CCc4c3cccc4F)CCO2)c1 ZINC001322271797 1053476136 /nfs/dbraw/zinc/47/61/36/1053476136.db2.gz GEJCTVNUXPSXNT-MOPGFXCFSA-N 1 2 315.363 4.026 20 0 DIADLO Fc1cccc([C@@H]2C[N@H+]([C@@H]3CCc4c3cccc4F)CCO2)c1 ZINC001322271797 1053476145 /nfs/dbraw/zinc/47/61/45/1053476145.db2.gz GEJCTVNUXPSXNT-MOPGFXCFSA-N 1 2 315.363 4.026 20 0 DIADLO Cc1cc(-c2ccccc2)ccc1NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC001353176558 1053497274 /nfs/dbraw/zinc/49/72/74/1053497274.db2.gz BIWXHBVBLKRKHF-INIZCTEOSA-N 1 2 319.408 4.448 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C\c2ccc3ccccc3n2)c(C)[nH+]1 ZINC000254995264 1053503192 /nfs/dbraw/zinc/50/31/92/1053503192.db2.gz YTFAUGWKGJVJEH-KHPPLWFESA-N 1 2 317.392 4.207 20 0 DIADLO C[C@@H]1CC[C@H](Nc2[nH+]cnc3c2cnn3-c2ccccc2)C[C@H]1C ZINC000325669976 1053517073 /nfs/dbraw/zinc/51/70/73/1053517073.db2.gz LVDNQOJDKVEELC-KFWWJZLASA-N 1 2 321.428 4.052 20 0 DIADLO C[C@H]1CCc2nc(C[NH2+]C3(c4ccccc4F)CC3)sc2C1 ZINC000152737087 1053517766 /nfs/dbraw/zinc/51/77/66/1053517766.db2.gz HVPCLLIUAQATRC-LBPRGKRZSA-N 1 2 316.445 4.186 20 0 DIADLO Cc1cc(N(C)Cc2cnc(C(C)C)nc2)[nH+]c2ccccc12 ZINC001322616920 1053526764 /nfs/dbraw/zinc/52/67/64/1053526764.db2.gz PYLLKOUHUDXWMW-UHFFFAOYSA-N 1 2 306.413 4.093 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccc([N+](=O)[O-])cc1 ZINC000182955641 1053561333 /nfs/dbraw/zinc/56/13/33/1053561333.db2.gz HXUSDTWAHACQCF-ZDUSSCGKSA-N 1 2 311.385 4.150 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccc([N+](=O)[O-])cc1 ZINC000182955641 1053561345 /nfs/dbraw/zinc/56/13/45/1053561345.db2.gz HXUSDTWAHACQCF-ZDUSSCGKSA-N 1 2 311.385 4.150 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1cccnc1Cl ZINC000182955047 1053562580 /nfs/dbraw/zinc/56/25/80/1053562580.db2.gz OMNFGLYTRLRZRB-LBPRGKRZSA-N 1 2 301.821 4.291 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1cccnc1Cl ZINC000182955047 1053562595 /nfs/dbraw/zinc/56/25/95/1053562595.db2.gz OMNFGLYTRLRZRB-LBPRGKRZSA-N 1 2 301.821 4.291 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1ncoc1C(C)C ZINC001323390040 1053579452 /nfs/dbraw/zinc/57/94/52/1053579452.db2.gz YVUXTSWSHPAUES-INIZCTEOSA-N 1 2 302.418 4.390 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1ncoc1C(C)C ZINC001323390040 1053579460 /nfs/dbraw/zinc/57/94/60/1053579460.db2.gz YVUXTSWSHPAUES-INIZCTEOSA-N 1 2 302.418 4.390 20 0 DIADLO Cc1cc(NCc2cn3c(cccc3C)n2)[nH+]c2ccccc12 ZINC001323566689 1053587977 /nfs/dbraw/zinc/58/79/77/1053587977.db2.gz ZPGGUFNKPGATGP-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@@H](CC)c2ccc(F)cc2)n1 ZINC001323731979 1053597034 /nfs/dbraw/zinc/59/70/34/1053597034.db2.gz YYKSMEHCJKZREL-FZMZJTMJSA-N 1 2 323.437 4.264 20 0 DIADLO CCC[N@H+](Cc1nc(CCC(C)C)no1)Cc1ccc(C)cc1 ZINC000620278064 1053635334 /nfs/dbraw/zinc/63/53/34/1053635334.db2.gz YSTMLXLPZVRZBL-UHFFFAOYSA-N 1 2 315.461 4.379 20 0 DIADLO CCC[N@@H+](Cc1nc(CCC(C)C)no1)Cc1ccc(C)cc1 ZINC000620278064 1053635341 /nfs/dbraw/zinc/63/53/41/1053635341.db2.gz YSTMLXLPZVRZBL-UHFFFAOYSA-N 1 2 315.461 4.379 20 0 DIADLO Cc1cc(NC[C@]2(CO)C[C@@H]2c2ccccc2)[nH+]c2ccccc12 ZINC001324235306 1053636647 /nfs/dbraw/zinc/63/66/47/1053636647.db2.gz HTPLJYRZHNKQCX-NQIIRXRSSA-N 1 2 318.420 4.121 20 0 DIADLO CC(C)(C)C[C@@H](NC(=O)c1cccc2[nH+]ccn21)c1ccccc1 ZINC001353675312 1053639812 /nfs/dbraw/zinc/63/98/12/1053639812.db2.gz OAGBFLPYYOMFCT-MRXNPFEDSA-N 1 2 321.424 4.242 20 0 DIADLO Cc1ccc(N[C@@H](C)c2ccc(Br)nc2)c(C)[nH+]1 ZINC001324587295 1053663000 /nfs/dbraw/zinc/66/30/00/1053663000.db2.gz HNULAJHXUFOGSV-JTQLQIEISA-N 1 2 306.207 4.029 20 0 DIADLO COc1cc(C)[nH+]c(CSCCCOCc2ccccc2)c1 ZINC001324496640 1053659326 /nfs/dbraw/zinc/65/93/26/1053659326.db2.gz XFGNZNGNIJUBDV-UHFFFAOYSA-N 1 2 317.454 4.239 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2nc3c(s2)C[C@H](C)CC3)o1 ZINC001324643159 1053667744 /nfs/dbraw/zinc/66/77/44/1053667744.db2.gz UPXLXFKCMIKXSU-BZPMIXESSA-N 1 2 316.470 4.274 20 0 DIADLO CSC1(C[N@@H+]2CCO[C@@H](c3ccc(Cl)s3)C2)CCC1 ZINC001324622851 1053667882 /nfs/dbraw/zinc/66/78/82/1053667882.db2.gz KOOJTSJXSVZDSN-LLVKDONJSA-N 1 2 317.907 4.061 20 0 DIADLO CSC1(C[N@H+]2CCO[C@@H](c3ccc(Cl)s3)C2)CCC1 ZINC001324622851 1053667891 /nfs/dbraw/zinc/66/78/91/1053667891.db2.gz KOOJTSJXSVZDSN-LLVKDONJSA-N 1 2 317.907 4.061 20 0 DIADLO C[C@@H](Oc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc(N(C)C)c1 ZINC001231080257 1053669155 /nfs/dbraw/zinc/66/91/55/1053669155.db2.gz AXFBBWGGSNSKIT-CQSZACIVSA-N 1 2 307.397 4.283 20 0 DIADLO Cc1ccccc1OC[C@@H](C)Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231082777 1053671107 /nfs/dbraw/zinc/67/11/07/1053671107.db2.gz ZDBWCKQJZDLIKR-OAHLLOKOSA-N 1 2 308.381 4.231 20 0 DIADLO COc1ccc([C@@H](C)Oc2ccc(-c3[nH]cc[nH+]3)cc2)c(F)c1 ZINC001231084221 1053671408 /nfs/dbraw/zinc/67/14/08/1053671408.db2.gz HSSUUQJTMRFVLI-GFCCVEGCSA-N 1 2 312.344 4.364 20 0 DIADLO C[C@@H](COc1ccc(-c2[nH]cc[nH+]2)cc1)OCc1ccccc1 ZINC001231082515 1053671549 /nfs/dbraw/zinc/67/15/49/1053671549.db2.gz XDTUFEWDCPLMSJ-HNNXBMFYSA-N 1 2 308.381 4.061 20 0 DIADLO C[C@H](Oc1ccc(-c2[nH]cc[nH+]2)cc1)c1c(F)cccc1F ZINC001231084195 1053672184 /nfs/dbraw/zinc/67/21/84/1053672184.db2.gz ZMIMHUUYIUAXAC-NSHDSACASA-N 1 2 300.308 4.495 20 0 DIADLO CC(C)c1ocnc1C[NH2+][C@H](C)c1ccccc1OC(F)F ZINC001324887843 1053684645 /nfs/dbraw/zinc/68/46/45/1053684645.db2.gz PWQYDWCVBSHZPE-LLVKDONJSA-N 1 2 310.344 4.250 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2cc(Cl)nc(Cl)c2O)c1 ZINC001237521076 1053697310 /nfs/dbraw/zinc/69/73/10/1053697310.db2.gz AMGPNNPANRAEPT-UHFFFAOYSA-N 1 2 311.212 4.034 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2cc(Cl)nc(Cl)c2O)c1 ZINC001237521076 1053697317 /nfs/dbraw/zinc/69/73/17/1053697317.db2.gz AMGPNNPANRAEPT-UHFFFAOYSA-N 1 2 311.212 4.034 20 0 DIADLO Cc1cc(C[N@H+]2CC=C(c3ccccc3C(F)(F)F)CC2)no1 ZINC000153639054 1053703999 /nfs/dbraw/zinc/70/39/99/1053703999.db2.gz FTPWSDDEOOTKSI-UHFFFAOYSA-N 1 2 322.330 4.291 20 0 DIADLO Cc1cc(C[N@@H+]2CC=C(c3ccccc3C(F)(F)F)CC2)no1 ZINC000153639054 1053704012 /nfs/dbraw/zinc/70/40/12/1053704012.db2.gz FTPWSDDEOOTKSI-UHFFFAOYSA-N 1 2 322.330 4.291 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@H+](C)Cc1ccc(F)nc1 ZINC000189296138 1053729229 /nfs/dbraw/zinc/72/92/29/1053729229.db2.gz SZCOUOOJYZARND-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@@H+](C)Cc1ccc(F)nc1 ZINC000189296138 1053729247 /nfs/dbraw/zinc/72/92/47/1053729247.db2.gz SZCOUOOJYZARND-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO Cc1cc(N2CCO[C@@H](c3ccccc3F)C2)[nH+]c2ccccc12 ZINC001325889014 1053740665 /nfs/dbraw/zinc/74/06/65/1053740665.db2.gz JCFIQYKMFSBFRT-LJQANCHMSA-N 1 2 322.383 4.260 20 0 DIADLO CC[N@H+](Cc1ccc(OC)cc1)Cc1c(F)ccc(F)c1OC ZINC001231414531 1053746321 /nfs/dbraw/zinc/74/63/21/1053746321.db2.gz XNKAMJJWBHHIFD-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)cc1)Cc1c(F)ccc(F)c1OC ZINC001231414531 1053746330 /nfs/dbraw/zinc/74/63/30/1053746330.db2.gz XNKAMJJWBHHIFD-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1)Cc1c(F)ccc(F)c1OC ZINC001231414580 1053746865 /nfs/dbraw/zinc/74/68/65/1053746865.db2.gz YWNHXDHFNZWJHI-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1)Cc1c(F)ccc(F)c1OC ZINC001231414580 1053746872 /nfs/dbraw/zinc/74/68/72/1053746872.db2.gz YWNHXDHFNZWJHI-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO Cc1nc2c(o1)CC[N@H+](Cc1ccc(-c3cccs3)cc1)C2 ZINC001231430521 1053749028 /nfs/dbraw/zinc/74/90/28/1053749028.db2.gz IPYXZNJRTTYYSB-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1nc2c(o1)CC[N@@H+](Cc1ccc(-c3cccs3)cc1)C2 ZINC001231430521 1053749040 /nfs/dbraw/zinc/74/90/40/1053749040.db2.gz IPYXZNJRTTYYSB-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Clc1cc(C[NH+]2CC3(C2)CCCC3)ccc1Br ZINC001231435199 1053752272 /nfs/dbraw/zinc/75/22/72/1053752272.db2.gz NVEJCLBXEATOSO-UHFFFAOYSA-N 1 2 314.654 4.479 20 0 DIADLO CC[N@H+](Cc1nnc(C)n1C1CC1)[C@@H](C)c1cc2ccccc2o1 ZINC000154964753 1053756057 /nfs/dbraw/zinc/75/60/57/1053756057.db2.gz AQGMZQTXXIPJPC-ZDUSSCGKSA-N 1 2 324.428 4.251 20 0 DIADLO CC[N@@H+](Cc1nnc(C)n1C1CC1)[C@@H](C)c1cc2ccccc2o1 ZINC000154964753 1053756065 /nfs/dbraw/zinc/75/60/65/1053756065.db2.gz AQGMZQTXXIPJPC-ZDUSSCGKSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1ccsc1C[N@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155070129 1053760871 /nfs/dbraw/zinc/76/08/71/1053760871.db2.gz KLGJMZKAITWPEI-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO Cc1ccsc1C[N@@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155070129 1053760878 /nfs/dbraw/zinc/76/08/78/1053760878.db2.gz KLGJMZKAITWPEI-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO C[N@H+](Cc1nnc(-c2ccccc2)s1)[C@H]1CCc2ccccc21 ZINC000155103985 1053762544 /nfs/dbraw/zinc/76/25/44/1053762544.db2.gz JBPQJXGEAZZESO-KRWDZBQOSA-N 1 2 321.449 4.324 20 0 DIADLO C[N@@H+](Cc1nnc(-c2ccccc2)s1)[C@H]1CCc2ccccc21 ZINC000155103985 1053762552 /nfs/dbraw/zinc/76/25/52/1053762552.db2.gz JBPQJXGEAZZESO-KRWDZBQOSA-N 1 2 321.449 4.324 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CCC[C@@]23CCOC3)c1Cl ZINC001231482029 1053763461 /nfs/dbraw/zinc/76/34/61/1053763461.db2.gz ZZWRJVWZLAHROW-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CCC[C@@]23CCOC3)c1Cl ZINC001231482029 1053763467 /nfs/dbraw/zinc/76/34/67/1053763467.db2.gz ZZWRJVWZLAHROW-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO Cc1c(C)c(C)c(C[N@@H+]2CCOC[C@@H]2c2cccnc2)c(C)c1C ZINC001231493818 1053769710 /nfs/dbraw/zinc/76/97/10/1053769710.db2.gz DYFONVFQEFOPDB-OAQYLSRUSA-N 1 2 324.468 4.197 20 0 DIADLO Cc1c(C)c(C)c(C[N@H+]2CCOC[C@@H]2c2cccnc2)c(C)c1C ZINC001231493818 1053769722 /nfs/dbraw/zinc/76/97/22/1053769722.db2.gz DYFONVFQEFOPDB-OAQYLSRUSA-N 1 2 324.468 4.197 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC001200572597 1053776518 /nfs/dbraw/zinc/77/65/18/1053776518.db2.gz NOKFITFVFHSACW-UHFFFAOYSA-N 1 2 324.877 4.392 20 0 DIADLO CCOc1cccc(F)c1C[NH2+]Cc1ccc(Cl)cc1OC ZINC001200572891 1053777481 /nfs/dbraw/zinc/77/74/81/1053777481.db2.gz TYEVRCIGJSCYIS-UHFFFAOYSA-N 1 2 323.795 4.176 20 0 DIADLO C[N@H+](Cc1ccc(F)c(Oc2ccccc2)c1)Cc1cnccn1 ZINC001231542292 1053783114 /nfs/dbraw/zinc/78/31/14/1053783114.db2.gz WVQPDMJYDDDNJZ-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[N@@H+](Cc1ccc(F)c(Oc2ccccc2)c1)Cc1cnccn1 ZINC001231542292 1053783122 /nfs/dbraw/zinc/78/31/22/1053783122.db2.gz WVQPDMJYDDDNJZ-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3CCC[C@@H](F)C3)cc2)[nH+]c1C ZINC001354160129 1053784293 /nfs/dbraw/zinc/78/42/93/1053784293.db2.gz KLWUCYGCHMASAT-HUUCEWRRSA-N 1 2 315.392 4.160 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nc3c(s2)CCCC3)cn1 ZINC001231584055 1053787875 /nfs/dbraw/zinc/78/78/75/1053787875.db2.gz YEDLVHBZCSHSLA-MRXNPFEDSA-N 1 2 313.470 4.062 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2nc3c(s2)CCCC3)cn1 ZINC001231584055 1053787889 /nfs/dbraw/zinc/78/78/89/1053787889.db2.gz YEDLVHBZCSHSLA-MRXNPFEDSA-N 1 2 313.470 4.062 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[N@H+](C)Cc1cc(C)no1 ZINC000649856573 1053790514 /nfs/dbraw/zinc/79/05/14/1053790514.db2.gz LKXOWVSSDGLVBG-HNNXBMFYSA-N 1 2 320.820 4.154 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[N@@H+](C)Cc1cc(C)no1 ZINC000649856573 1053790522 /nfs/dbraw/zinc/79/05/22/1053790522.db2.gz LKXOWVSSDGLVBG-HNNXBMFYSA-N 1 2 320.820 4.154 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3cccc(O)c3)co2)cc1 ZINC000155953436 1053791695 /nfs/dbraw/zinc/79/16/95/1053791695.db2.gz DPTCTVHPVOVGTQ-AWEZNQCLSA-N 1 2 308.381 4.206 20 0 DIADLO Clc1cc(Cl)c(Cl)c(C[N@@H+]2CC[C@@]3(CCCO3)C2)c1 ZINC001231597893 1053796386 /nfs/dbraw/zinc/79/63/86/1053796386.db2.gz JNAREHCKWUBEFM-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1cc(Cl)c(Cl)c(C[N@H+]2CC[C@@]3(CCCO3)C2)c1 ZINC001231597893 1053796394 /nfs/dbraw/zinc/79/63/94/1053796394.db2.gz JNAREHCKWUBEFM-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO C[C@@H]1CO[C@@H]2C[N@H+](Cc3cc(Cl)cc(Cl)c3Cl)C[C@H]12 ZINC001231603527 1053799106 /nfs/dbraw/zinc/79/91/06/1053799106.db2.gz BTRYIKGPFKXYKX-XTWCZFFVSA-N 1 2 320.647 4.114 20 0 DIADLO C[C@@H]1CO[C@@H]2C[N@@H+](Cc3cc(Cl)cc(Cl)c3Cl)C[C@H]12 ZINC001231603527 1053799121 /nfs/dbraw/zinc/79/91/21/1053799121.db2.gz BTRYIKGPFKXYKX-XTWCZFFVSA-N 1 2 320.647 4.114 20 0 DIADLO Cc1cc(NCc2ccc(-c3cnn(C)c3)cc2)ccc1[NH+](C)C ZINC001326829279 1053804117 /nfs/dbraw/zinc/80/41/17/1053804117.db2.gz ZLSXGZDQOGQNAG-UHFFFAOYSA-N 1 2 320.440 4.074 20 0 DIADLO Cn1c(Cl)ncc1C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001326891657 1053807100 /nfs/dbraw/zinc/80/71/00/1053807100.db2.gz SSMKGLSUXPMALS-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1c(Cl)ncc1C[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001326891657 1053807113 /nfs/dbraw/zinc/80/71/13/1053807113.db2.gz SSMKGLSUXPMALS-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1ccccc1Br)c1ccco1 ZINC000156585984 1053815881 /nfs/dbraw/zinc/81/58/81/1053815881.db2.gz BXXVVRQDJHQTKG-BXUZGUMPSA-N 1 2 324.218 4.080 20 0 DIADLO CC[C@@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1ccc(F)cc1F ZINC000156455212 1053811081 /nfs/dbraw/zinc/81/10/81/1053811081.db2.gz IIYYQECWAHRKEX-CVEARBPZSA-N 1 2 309.356 4.295 20 0 DIADLO CCc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)nc1 ZINC001231640835 1053813500 /nfs/dbraw/zinc/81/35/00/1053813500.db2.gz OIPUYYVZXSYUBD-GOSISDBHSA-N 1 2 302.368 4.259 20 0 DIADLO CCc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)nc1 ZINC001231640835 1053813509 /nfs/dbraw/zinc/81/35/09/1053813509.db2.gz OIPUYYVZXSYUBD-GOSISDBHSA-N 1 2 302.368 4.259 20 0 DIADLO Cc1cccc2cc(C[N@@H+]3CCn4cccc4C3)c(Cl)nc12 ZINC001231647416 1053817382 /nfs/dbraw/zinc/81/73/82/1053817382.db2.gz ZJPBLGCRBIJUIU-UHFFFAOYSA-N 1 2 311.816 4.014 20 0 DIADLO Cc1cccc2cc(C[N@H+]3CCn4cccc4C3)c(Cl)nc12 ZINC001231647416 1053817393 /nfs/dbraw/zinc/81/73/93/1053817393.db2.gz ZJPBLGCRBIJUIU-UHFFFAOYSA-N 1 2 311.816 4.014 20 0 DIADLO CC(C)[C@@H]1C[C@@H]1C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001436229856 1053817559 /nfs/dbraw/zinc/81/75/59/1053817559.db2.gz VZROHCMXNDUXOW-ROUUACIJSA-N 1 2 324.424 4.084 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1csc(N(C)C2CC2)n1 ZINC000156586172 1053817602 /nfs/dbraw/zinc/81/76/02/1053817602.db2.gz BUCFNKBEIGAIED-GFCCVEGCSA-N 1 2 319.449 4.074 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1csc(N(C)C2CC2)n1 ZINC000156586172 1053817614 /nfs/dbraw/zinc/81/76/14/1053817614.db2.gz BUCFNKBEIGAIED-GFCCVEGCSA-N 1 2 319.449 4.074 20 0 DIADLO Cc1ccc(C[NH+]2CC(c3cccnc3)C2)c(Cl)c1Cl ZINC001231667054 1053826813 /nfs/dbraw/zinc/82/68/13/1053826813.db2.gz CFQWQKVMLGUPOC-UHFFFAOYSA-N 1 2 307.224 4.296 20 0 DIADLO COc1c(Cl)cc(C[NH+]2CCCCC2)cc1Br ZINC001231720647 1053838739 /nfs/dbraw/zinc/83/87/39/1053838739.db2.gz CWRAQJIBCZFGDD-UHFFFAOYSA-N 1 2 318.642 4.097 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2cc(Cl)c(OC(C)C)c(Cl)c2)C1 ZINC001231727261 1053841451 /nfs/dbraw/zinc/84/14/51/1053841451.db2.gz DQCUFHONKQBMJX-LBPRGKRZSA-N 1 2 318.244 4.001 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2cc(Cl)c(OC(C)C)c(Cl)c2)C1 ZINC001231727261 1053841467 /nfs/dbraw/zinc/84/14/67/1053841467.db2.gz DQCUFHONKQBMJX-LBPRGKRZSA-N 1 2 318.244 4.001 20 0 DIADLO CC(C)Oc1ccc(C[NH+]2CC(C)(C)C2)cc1Br ZINC001231722799 1053842249 /nfs/dbraw/zinc/84/22/49/1053842249.db2.gz GHVIXNLZZDVFJS-UHFFFAOYSA-N 1 2 312.251 4.078 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2oc3ccccc3c2C)s1 ZINC000273403584 1053846802 /nfs/dbraw/zinc/84/68/02/1053846802.db2.gz MUDCITZVKRLNIF-NSHDSACASA-N 1 2 301.415 4.006 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2ccn(-c3ccccc3)n2)cc1 ZINC000621114122 1053859713 /nfs/dbraw/zinc/85/97/13/1053859713.db2.gz KBMBXRYEEIZWOP-HXUWFJFHSA-N 1 2 321.399 4.349 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2ccn(-c3ccccc3)n2)cc1 ZINC000621114122 1053859725 /nfs/dbraw/zinc/85/97/25/1053859725.db2.gz KBMBXRYEEIZWOP-HXUWFJFHSA-N 1 2 321.399 4.349 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC000157606005 1053860790 /nfs/dbraw/zinc/86/07/90/1053860790.db2.gz QSMNABSKOWOPLN-SNVBAGLBSA-N 1 2 324.211 4.427 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC000157606005 1053860815 /nfs/dbraw/zinc/86/08/15/1053860815.db2.gz QSMNABSKOWOPLN-SNVBAGLBSA-N 1 2 324.211 4.427 20 0 DIADLO Cc1nc(-c2ccccc2)ncc1C[N@H+](C)Cc1ccccc1F ZINC001231798183 1053862181 /nfs/dbraw/zinc/86/21/81/1053862181.db2.gz QXGUXYDKLHASPM-UHFFFAOYSA-N 1 2 321.399 4.223 20 0 DIADLO Cc1nc(-c2ccccc2)ncc1C[N@@H+](C)Cc1ccccc1F ZINC001231798183 1053862208 /nfs/dbraw/zinc/86/22/08/1053862208.db2.gz QXGUXYDKLHASPM-UHFFFAOYSA-N 1 2 321.399 4.223 20 0 DIADLO Clc1ccc(Oc2ccc(C[N@@H+]3CCC34COC4)cc2)cc1 ZINC001231814407 1053875991 /nfs/dbraw/zinc/87/59/91/1053875991.db2.gz NYIICECWRXMZBD-UHFFFAOYSA-N 1 2 315.800 4.107 20 0 DIADLO Clc1ccc(Oc2ccc(C[N@H+]3CCC34COC4)cc2)cc1 ZINC001231814407 1053876005 /nfs/dbraw/zinc/87/60/05/1053876005.db2.gz NYIICECWRXMZBD-UHFFFAOYSA-N 1 2 315.800 4.107 20 0 DIADLO COC(C)(C)[C@H](C)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000671122237 1053898216 /nfs/dbraw/zinc/89/82/16/1053898216.db2.gz AXABVULCFBAEKW-AWEZNQCLSA-N 1 2 313.445 4.112 20 0 DIADLO Cc1nc(NC[C@@H](C)c2ccc(F)cc2F)c2c([nH+]1)CCCC2 ZINC001472708665 1053909425 /nfs/dbraw/zinc/90/94/25/1053909425.db2.gz RWOFOJIOGHKZGC-LLVKDONJSA-N 1 2 317.383 4.158 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1ccnc(C(F)F)c1 ZINC001231893141 1053909797 /nfs/dbraw/zinc/90/97/97/1053909797.db2.gz UAOQDONPKGONMJ-UHFFFAOYSA-N 1 2 318.367 4.113 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1ccnc(C(F)F)c1 ZINC001231893141 1053909817 /nfs/dbraw/zinc/90/98/17/1053909817.db2.gz UAOQDONPKGONMJ-UHFFFAOYSA-N 1 2 318.367 4.113 20 0 DIADLO CC(C)c1nc(C[NH+]2CC(Cc3ccc(F)c(F)c3)C2)cs1 ZINC001328205263 1053914503 /nfs/dbraw/zinc/91/45/03/1053914503.db2.gz YFAATBNTOPAHGW-UHFFFAOYSA-N 1 2 322.424 4.219 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ccccn2)cnc1F ZINC001231923632 1053914766 /nfs/dbraw/zinc/91/47/66/1053914766.db2.gz SJOXQNSQUBCGHT-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)cnc1F ZINC001231923632 1053914780 /nfs/dbraw/zinc/91/47/80/1053914780.db2.gz SJOXQNSQUBCGHT-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO O=C(CCc1cccc2ccccc21)Nc1ccn2cc[nH+]c2c1 ZINC001436596854 1053916846 /nfs/dbraw/zinc/91/68/46/1053916846.db2.gz JCTDDBNPPSYCEY-UHFFFAOYSA-N 1 2 315.376 4.059 20 0 DIADLO F[C@H]1CCC[N@H+](Cc2cc(Cl)ncc2C(F)(F)F)CC1 ZINC001231930538 1053918652 /nfs/dbraw/zinc/91/86/52/1053918652.db2.gz PPYJLRFXJWQTTK-JTQLQIEISA-N 1 2 310.722 4.078 20 0 DIADLO F[C@H]1CCC[N@@H+](Cc2cc(Cl)ncc2C(F)(F)F)CC1 ZINC001231930538 1053918661 /nfs/dbraw/zinc/91/86/61/1053918661.db2.gz PPYJLRFXJWQTTK-JTQLQIEISA-N 1 2 310.722 4.078 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cnc(F)c(C)c1 ZINC001231931244 1053918980 /nfs/dbraw/zinc/91/89/80/1053918980.db2.gz UCQHHOYVFBVRBO-QGZVFWFLSA-N 1 2 314.404 4.013 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cnc(F)c(C)c1 ZINC001231931244 1053918985 /nfs/dbraw/zinc/91/89/85/1053918985.db2.gz UCQHHOYVFBVRBO-QGZVFWFLSA-N 1 2 314.404 4.013 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2ccc3ccnc(Cl)c3c2)C[C@@H]1F ZINC001231976357 1053925170 /nfs/dbraw/zinc/92/51/70/1053925170.db2.gz OERDHBRFWALRKT-HOCLYGCPSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2ccc3ccnc(Cl)c3c2)C[C@@H]1F ZINC001231976357 1053925186 /nfs/dbraw/zinc/92/51/86/1053925186.db2.gz OERDHBRFWALRKT-HOCLYGCPSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2cc(C(F)(F)F)cnc2Cl)[C@H]1C ZINC001232009199 1053940568 /nfs/dbraw/zinc/94/05/68/1053940568.db2.gz RAAOPYHIHHBTEY-UWVGGRQHSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2cc(C(F)(F)F)cnc2Cl)[C@H]1C ZINC001232009199 1053940584 /nfs/dbraw/zinc/94/05/84/1053940584.db2.gz RAAOPYHIHHBTEY-UWVGGRQHSA-N 1 2 306.759 4.374 20 0 DIADLO FC(F)(F)c1cc(SCCn2cc[nH+]c2)ccc1Cl ZINC000159187354 1053943112 /nfs/dbraw/zinc/94/31/12/1053943112.db2.gz PQOLAAJITYSZSQ-UHFFFAOYSA-N 1 2 306.740 4.348 20 0 DIADLO Clc1oc2ccccc2c1C[N@@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000621288287 1053943247 /nfs/dbraw/zinc/94/32/47/1053943247.db2.gz SGGYKGXKMFXZSW-CQSZACIVSA-N 1 2 301.777 4.146 20 0 DIADLO Clc1oc2ccccc2c1C[N@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000621288287 1053943256 /nfs/dbraw/zinc/94/32/56/1053943256.db2.gz SGGYKGXKMFXZSW-CQSZACIVSA-N 1 2 301.777 4.146 20 0 DIADLO COc1cccc2[nH]cc(C[N@@H+]3Cc4cccc(Cl)c4C3)c21 ZINC001232037946 1053947490 /nfs/dbraw/zinc/94/74/90/1053947490.db2.gz GUTUWCZDHXKYHI-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1cccc2[nH]cc(C[N@H+]3Cc4cccc(Cl)c4C3)c21 ZINC001232037946 1053947503 /nfs/dbraw/zinc/94/75/03/1053947503.db2.gz GUTUWCZDHXKYHI-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO CCOc1cncc(C[NH2+][C@@H](C)c2c(F)cccc2Cl)c1 ZINC000621339144 1053951294 /nfs/dbraw/zinc/95/12/94/1053951294.db2.gz WXSNDIJZRHLVPP-NSHDSACASA-N 1 2 308.784 4.124 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ncc(C)cc2Br)cc1 ZINC001232176600 1053978615 /nfs/dbraw/zinc/97/86/15/1053978615.db2.gz XKPDNBHCSFDPCU-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ncc(C)cc2Br)cc1 ZINC001232176600 1053978628 /nfs/dbraw/zinc/97/86/28/1053978628.db2.gz XKPDNBHCSFDPCU-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO CCCC[N@H+](Cc1nc(C2CC2)no1)[C@@H](C)c1ccc(C)o1 ZINC000621317424 1053956660 /nfs/dbraw/zinc/95/66/60/1053956660.db2.gz BSIJCILUMWJHPJ-ZDUSSCGKSA-N 1 2 303.406 4.212 20 0 DIADLO CCCC[N@@H+](Cc1nc(C2CC2)no1)[C@@H](C)c1ccc(C)o1 ZINC000621317424 1053956663 /nfs/dbraw/zinc/95/66/63/1053956663.db2.gz BSIJCILUMWJHPJ-ZDUSSCGKSA-N 1 2 303.406 4.212 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(F)cc(F)cc2Cl)CCC1(F)F ZINC001232097065 1053961734 /nfs/dbraw/zinc/96/17/34/1053961734.db2.gz ITMXZDOLPZOONJ-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(F)cc(F)cc2Cl)CCC1(F)F ZINC001232097065 1053961747 /nfs/dbraw/zinc/96/17/47/1053961747.db2.gz ITMXZDOLPZOONJ-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO Brc1ccccc1[C@@H]1CCC[N@H+]1Cc1cnsc1 ZINC001232223060 1053996887 /nfs/dbraw/zinc/99/68/87/1053996887.db2.gz CMYPSJGGQNVXJS-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@H+]2Cc2cnsc2)cc1 ZINC001232223304 1053997053 /nfs/dbraw/zinc/99/70/53/1053997053.db2.gz FYFSJJPAEYXBPR-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO CCCOC1CC[NH+](Cc2c(F)cc(F)cc2Cl)CC1 ZINC001232102695 1053966290 /nfs/dbraw/zinc/96/62/90/1053966290.db2.gz VYDKVMSOKIKZKI-UHFFFAOYSA-N 1 2 303.780 4.009 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@@H+]2Cc2ccns2)cc1 ZINC001232190307 1053982185 /nfs/dbraw/zinc/98/21/85/1053982185.db2.gz UEXJKJCKVRVZJD-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@H+]2Cc2ccns2)cc1 ZINC001232190307 1053982194 /nfs/dbraw/zinc/98/21/94/1053982194.db2.gz UEXJKJCKVRVZJD-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Oc1cccc(CNc2ccc([NH+]3CCCC3)cc2)c1Cl ZINC000293661439 1053982226 /nfs/dbraw/zinc/98/22/26/1053982226.db2.gz UAONPKUBSVPYGJ-UHFFFAOYSA-N 1 2 302.805 4.258 20 0 DIADLO CCOC(=O)C[N@H+](C)Cc1ccccc1-c1ccc(Cl)cc1 ZINC001232197932 1053985793 /nfs/dbraw/zinc/98/57/93/1053985793.db2.gz WVORIRZIZFFOBM-UHFFFAOYSA-N 1 2 317.816 4.002 20 0 DIADLO CCOC(=O)C[N@@H+](C)Cc1ccccc1-c1ccc(Cl)cc1 ZINC001232197932 1053985805 /nfs/dbraw/zinc/98/58/05/1053985805.db2.gz WVORIRZIZFFOBM-UHFFFAOYSA-N 1 2 317.816 4.002 20 0 DIADLO FC(F)c1cccc(C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)c1 ZINC001329376167 1053987829 /nfs/dbraw/zinc/98/78/29/1053987829.db2.gz RZJUGVJIXUBPMA-GOEBONIOSA-N 1 2 307.315 4.186 20 0 DIADLO CCOc1cncc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC001329490946 1053991106 /nfs/dbraw/zinc/99/11/06/1053991106.db2.gz JHMKURYRSWTWRI-LBPRGKRZSA-N 1 2 319.474 4.085 20 0 DIADLO Cc1nccnc1C[NH+](Cc1cccs1)Cc1cccs1 ZINC000621710009 1053996003 /nfs/dbraw/zinc/99/60/03/1053996003.db2.gz OPACQAGTVCWKBG-UHFFFAOYSA-N 1 2 315.467 4.110 20 0 DIADLO Brc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cnsc1 ZINC001232223060 1053996879 /nfs/dbraw/zinc/99/68/79/1053996879.db2.gz CMYPSJGGQNVXJS-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@@H+]2Cc2cnsc2)cc1 ZINC001232223304 1053997045 /nfs/dbraw/zinc/99/70/45/1053997045.db2.gz FYFSJJPAEYXBPR-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccnc(C(F)(F)F)c2)cn1 ZINC001232240978 1054002950 /nfs/dbraw/zinc/00/29/50/1054002950.db2.gz YIWZRWZBGMIAJC-HNNXBMFYSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccnc(C(F)(F)F)c2)cn1 ZINC001232240978 1054002969 /nfs/dbraw/zinc/00/29/69/1054002969.db2.gz YIWZRWZBGMIAJC-HNNXBMFYSA-N 1 2 321.346 4.141 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccnc(C(F)(F)F)c1 ZINC001232240419 1054003570 /nfs/dbraw/zinc/00/35/70/1054003570.db2.gz GZQNWHZXKSBXSP-LBPRGKRZSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ccnc(C(F)(F)F)c1 ZINC001232240419 1054003578 /nfs/dbraw/zinc/00/35/78/1054003578.db2.gz GZQNWHZXKSBXSP-LBPRGKRZSA-N 1 2 306.331 4.047 20 0 DIADLO Cc1ccccc1[C@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001354916248 1054004063 /nfs/dbraw/zinc/00/40/63/1054004063.db2.gz BAFOMXBFUNKRMN-AWEZNQCLSA-N 1 2 323.371 4.062 20 0 DIADLO Cc1nc(NC[C@@H]2C[C@H]2C2CCCC2)c(Br)c(C)[nH+]1 ZINC001472904133 1054015258 /nfs/dbraw/zinc/01/52/58/1054015258.db2.gz IZJOYGFILQGOGN-STQMWFEESA-N 1 2 324.266 4.094 20 0 DIADLO Cc1sc(C[N@@H+]2CCCC[C@H](F)C2)cc1Br ZINC001232291805 1054018080 /nfs/dbraw/zinc/01/80/80/1054018080.db2.gz OWEXELFJKHWVGF-JTQLQIEISA-N 1 2 306.244 4.143 20 0 DIADLO Cc1sc(C[N@H+]2CCCC[C@H](F)C2)cc1Br ZINC001232291805 1054018083 /nfs/dbraw/zinc/01/80/83/1054018083.db2.gz OWEXELFJKHWVGF-JTQLQIEISA-N 1 2 306.244 4.143 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c(C)n1 ZINC001232334830 1054024288 /nfs/dbraw/zinc/02/42/88/1054024288.db2.gz MGCZWXBRQPHPCF-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)c(C)n1 ZINC001232334830 1054024299 /nfs/dbraw/zinc/02/42/99/1054024299.db2.gz MGCZWXBRQPHPCF-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO c1ccc(COc2ccc(C[NH+]3Cc4ccccc4C3)cn2)cc1 ZINC001232354864 1054026027 /nfs/dbraw/zinc/02/60/27/1054026027.db2.gz DNKHELJCAXIWFF-UHFFFAOYSA-N 1 2 316.404 4.176 20 0 DIADLO CSc1cc(C)c(C[N@@H+]2CCc3cc(Cl)ccc3C2)cn1 ZINC001232348262 1054026091 /nfs/dbraw/zinc/02/60/91/1054026091.db2.gz POKTVMZLUSXPDJ-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CSc1cc(C)c(C[N@H+]2CCc3cc(Cl)ccc3C2)cn1 ZINC001232348262 1054026104 /nfs/dbraw/zinc/02/61/04/1054026104.db2.gz POKTVMZLUSXPDJ-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cc(C)ccc1OC(C)C)C2 ZINC001232397444 1054039723 /nfs/dbraw/zinc/03/97/23/1054039723.db2.gz PJNPHTYWUCXVPB-UHFFFAOYSA-N 1 2 311.425 4.307 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cc(C)ccc1OC(C)C)C2 ZINC001232397444 1054039733 /nfs/dbraw/zinc/03/97/33/1054039733.db2.gz PJNPHTYWUCXVPB-UHFFFAOYSA-N 1 2 311.425 4.307 20 0 DIADLO O=C(c1ccccc1)[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)o2)C1 ZINC001232444893 1054047531 /nfs/dbraw/zinc/04/75/31/1054047531.db2.gz DJPVYRPMLFFDOZ-CYBMUJFWSA-N 1 2 323.314 4.003 20 0 DIADLO O=C(c1ccccc1)[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)o2)C1 ZINC001232444893 1054047539 /nfs/dbraw/zinc/04/75/39/1054047539.db2.gz DJPVYRPMLFFDOZ-CYBMUJFWSA-N 1 2 323.314 4.003 20 0 DIADLO Cc1[nH]c(CN(C)Cc2ccccc2Oc2ccccc2)c[nH+]1 ZINC001232464833 1054050861 /nfs/dbraw/zinc/05/08/61/1054050861.db2.gz MOJMCLKPAOSBPG-UHFFFAOYSA-N 1 2 307.397 4.142 20 0 DIADLO Cc1cc(Br)c(C[N@@H+](C)C2CC(F)(F)C2)cc1F ZINC001232469069 1054052404 /nfs/dbraw/zinc/05/24/04/1054052404.db2.gz SGYHXTFAQXVARM-UHFFFAOYSA-N 1 2 322.168 4.126 20 0 DIADLO Cc1cc(Br)c(C[N@H+](C)C2CC(F)(F)C2)cc1F ZINC001232469069 1054052411 /nfs/dbraw/zinc/05/24/11/1054052411.db2.gz SGYHXTFAQXVARM-UHFFFAOYSA-N 1 2 322.168 4.126 20 0 DIADLO Cc1ccccc1C(N)=[NH+]OCc1cnc(-c2ccccc2)s1 ZINC001331257545 1054069478 /nfs/dbraw/zinc/06/94/78/1054069478.db2.gz IUROCJCGJUCVER-UHFFFAOYSA-N 1 2 323.421 4.165 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2cc(F)ccc2F)o1 ZINC000165216041 1054070779 /nfs/dbraw/zinc/07/07/79/1054070779.db2.gz KHMRJZODDKAEPS-BDJLRTHQSA-N 1 2 309.356 4.159 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2ccc(F)cc2F)o1 ZINC000165234051 1054073898 /nfs/dbraw/zinc/07/38/98/1054073898.db2.gz CYWFFXSLYLTLNY-BZNIZROVSA-N 1 2 309.356 4.159 20 0 DIADLO CC[N@H+](Cc1cc2ccoc2cn1)Cc1cccc(F)c1F ZINC001232557126 1054074393 /nfs/dbraw/zinc/07/43/93/1054074393.db2.gz OSZIHACQKCZNAP-UHFFFAOYSA-N 1 2 302.324 4.128 20 0 DIADLO CC[N@@H+](Cc1cc2ccoc2cn1)Cc1cccc(F)c1F ZINC001232557126 1054074405 /nfs/dbraw/zinc/07/44/05/1054074405.db2.gz OSZIHACQKCZNAP-UHFFFAOYSA-N 1 2 302.324 4.128 20 0 DIADLO Clc1cc(-n2cccn2)ccc1C[NH+]1Cc2ccccc2C1 ZINC001232598216 1054079313 /nfs/dbraw/zinc/07/93/13/1054079313.db2.gz QXYXGLKBMBVUGW-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(F)c(O)c(Br)c1 ZINC001232630188 1054089560 /nfs/dbraw/zinc/08/95/60/1054089560.db2.gz LOCOHEJBRZRPHC-AOOOYVTPSA-N 1 2 316.214 4.057 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cc(F)c(O)c(Br)c1 ZINC001232630188 1054089577 /nfs/dbraw/zinc/08/95/77/1054089577.db2.gz LOCOHEJBRZRPHC-AOOOYVTPSA-N 1 2 316.214 4.057 20 0 DIADLO CC(C)(O)c1ccc(CNc2ccc([NH+]3CCCC3)cc2)cc1 ZINC000295536795 1054083391 /nfs/dbraw/zinc/08/33/91/1054083391.db2.gz VWWWKOCRBLSPGG-UHFFFAOYSA-N 1 2 310.441 4.126 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cnc(Cl)cc2Br)[C@@H]1C ZINC001232682120 1054098106 /nfs/dbraw/zinc/09/81/06/1054098106.db2.gz WCDUIBQVFOCAHT-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cnc(Cl)cc2Br)[C@@H]1C ZINC001232682120 1054098116 /nfs/dbraw/zinc/09/81/16/1054098116.db2.gz WCDUIBQVFOCAHT-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[N@H+](Cc1ccc(Br)[nH]1)Cc1ccccc1Cl ZINC001232689780 1054101550 /nfs/dbraw/zinc/10/15/50/1054101550.db2.gz RPFLBDSLWZIKEZ-UHFFFAOYSA-N 1 2 313.626 4.063 20 0 DIADLO C[N@@H+](Cc1ccc(Br)[nH]1)Cc1ccccc1Cl ZINC001232689780 1054101555 /nfs/dbraw/zinc/10/15/55/1054101555.db2.gz RPFLBDSLWZIKEZ-UHFFFAOYSA-N 1 2 313.626 4.063 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2cccnc21)c1nc(C(C)(C)C)cs1 ZINC001331959924 1054104253 /nfs/dbraw/zinc/10/42/53/1054104253.db2.gz MCDVMYGUXYBKBB-DGCLKSJQSA-N 1 2 301.459 4.174 20 0 DIADLO CCO[C@H]1CCC[N@H+](Cc2cc(F)c(Cl)cc2Cl)C1 ZINC001232700454 1054105044 /nfs/dbraw/zinc/10/50/44/1054105044.db2.gz KEORVDGGAWLRLI-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc3ccc(Cl)cc3[nH]2)no1 ZINC001232726364 1054107389 /nfs/dbraw/zinc/10/73/89/1054107389.db2.gz CAQBMFBIIIUIDZ-QGZVFWFLSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cc3ccc(Cl)cc3[nH]2)no1 ZINC001232726364 1054107401 /nfs/dbraw/zinc/10/74/01/1054107401.db2.gz CAQBMFBIIIUIDZ-QGZVFWFLSA-N 1 2 315.804 4.455 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1ccc(COC)o1 ZINC000167826974 1054107341 /nfs/dbraw/zinc/10/73/41/1054107341.db2.gz CNFVKVOGKZPQQU-UHFFFAOYSA-N 1 2 319.792 4.061 20 0 DIADLO Fc1cc2c(cc1F)C[N@H+](Cc1ccc3ncsc3c1)CC2 ZINC001232743899 1054113541 /nfs/dbraw/zinc/11/35/41/1054113541.db2.gz FEIITPFJEKTMNL-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO Fc1cc2c(cc1F)C[N@@H+](Cc1ccc3ncsc3c1)CC2 ZINC001232743899 1054113546 /nfs/dbraw/zinc/11/35/46/1054113546.db2.gz FEIITPFJEKTMNL-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO CC(C)(C)C[C@@H]1C[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001355349511 1054115376 /nfs/dbraw/zinc/11/53/76/1054115376.db2.gz UBUIMFPZHHDULQ-GXTWGEPZSA-N 1 2 315.392 4.022 20 0 DIADLO Oc1cccc(C[N@@H+]2CCCC[C@H]2c2cccnc2)c1Cl ZINC001232787999 1054118669 /nfs/dbraw/zinc/11/86/69/1054118669.db2.gz XSCLFYKPFXLNIT-HNNXBMFYSA-N 1 2 302.805 4.168 20 0 DIADLO Oc1cccc(C[N@H+]2CCCC[C@H]2c2cccnc2)c1Cl ZINC001232787999 1054118677 /nfs/dbraw/zinc/11/86/77/1054118677.db2.gz XSCLFYKPFXLNIT-HNNXBMFYSA-N 1 2 302.805 4.168 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)c(F)c2)nn1 ZINC001332419964 1054119595 /nfs/dbraw/zinc/11/95/95/1054119595.db2.gz HXPLKUQSGOYRCA-MNOVXSKESA-N 1 2 310.804 4.063 20 0 DIADLO CCCn1cnc(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)c1 ZINC001232799112 1054121106 /nfs/dbraw/zinc/12/11/06/1054121106.db2.gz VZNUXJMLYNTEKT-GOSISDBHSA-N 1 2 301.409 4.159 20 0 DIADLO CCCn1cnc(C[N@H+]2CCCC[C@@H]2c2ccccc2F)c1 ZINC001232799112 1054121112 /nfs/dbraw/zinc/12/11/12/1054121112.db2.gz VZNUXJMLYNTEKT-GOSISDBHSA-N 1 2 301.409 4.159 20 0 DIADLO CCCn1cnc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)c1 ZINC001232799360 1054122338 /nfs/dbraw/zinc/12/23/38/1054122338.db2.gz HPXJHHYBGVOAFW-QGZVFWFLSA-N 1 2 303.837 4.284 20 0 DIADLO CCCn1cnc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)c1 ZINC001232799360 1054122341 /nfs/dbraw/zinc/12/23/41/1054122341.db2.gz HPXJHHYBGVOAFW-QGZVFWFLSA-N 1 2 303.837 4.284 20 0 DIADLO CCCCCC[C@@H](CC)CN(C)C(=O)c1cccc2[nH+]ccn21 ZINC001438004626 1054126029 /nfs/dbraw/zinc/12/60/29/1054126029.db2.gz XBOBGSJPERPFMN-MRXNPFEDSA-N 1 2 315.461 4.403 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc2c1OCC2)c1nc(C(C)(C)C)cs1 ZINC001332780934 1054128075 /nfs/dbraw/zinc/12/80/75/1054128075.db2.gz KSUOEXPKRVKYFE-GFCCVEGCSA-N 1 2 316.470 4.226 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1c[nH]c3cc(Cl)ncc13)C2 ZINC001232823532 1054128456 /nfs/dbraw/zinc/12/84/56/1054128456.db2.gz DFOKEBVIZQVFGY-UHFFFAOYSA-N 1 2 318.207 4.386 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1c[nH]c3cc(Cl)ncc13)C2 ZINC001232823532 1054128462 /nfs/dbraw/zinc/12/84/62/1054128462.db2.gz DFOKEBVIZQVFGY-UHFFFAOYSA-N 1 2 318.207 4.386 20 0 DIADLO Clc1cc(Cl)c(C[NH+]2C[C@H]3CCC[C@@H]3C2)c(Cl)n1 ZINC001232847075 1054130011 /nfs/dbraw/zinc/13/00/11/1054130011.db2.gz SHBFGMBBUVTJFV-RKDXNWHRSA-N 1 2 305.636 4.274 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccc(F)c(F)c2Cl)cc1 ZINC001232875675 1054134783 /nfs/dbraw/zinc/13/47/83/1054134783.db2.gz MKVQSNPSXZFSFS-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccc(F)c(F)c2Cl)cc1 ZINC001232875675 1054134796 /nfs/dbraw/zinc/13/47/96/1054134796.db2.gz MKVQSNPSXZFSFS-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO Cc1cc(O)cc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)c1 ZINC001232880116 1054137100 /nfs/dbraw/zinc/13/71/00/1054137100.db2.gz LXMIGJFTMAPZLO-NRFANRHFSA-N 1 2 318.420 4.107 20 0 DIADLO Cc1cc(O)cc(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)c1 ZINC001232880116 1054137108 /nfs/dbraw/zinc/13/71/08/1054137108.db2.gz LXMIGJFTMAPZLO-NRFANRHFSA-N 1 2 318.420 4.107 20 0 DIADLO Cc1cc(O)cc(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)c1 ZINC001232880122 1054137176 /nfs/dbraw/zinc/13/71/76/1054137176.db2.gz LXMIGJFTMAPZLO-OAQYLSRUSA-N 1 2 318.420 4.107 20 0 DIADLO Cc1cc(O)cc(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)c1 ZINC001232880122 1054137186 /nfs/dbraw/zinc/13/71/86/1054137186.db2.gz LXMIGJFTMAPZLO-OAQYLSRUSA-N 1 2 318.420 4.107 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1cncc(-c3ccccc3)c1)C2 ZINC001232903205 1054146790 /nfs/dbraw/zinc/14/67/90/1054146790.db2.gz IEZWTKLPMJFEMS-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1cncc(-c3ccccc3)c1)C2 ZINC001232903205 1054146799 /nfs/dbraw/zinc/14/67/99/1054146799.db2.gz IEZWTKLPMJFEMS-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(F)c(O)c2F)c1 ZINC001232930919 1054149862 /nfs/dbraw/zinc/14/98/62/1054149862.db2.gz GRPOBKCVLIRXES-INIZCTEOSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2cc(Cl)cc3c2OCC3)c(C)s1 ZINC001333381592 1054152070 /nfs/dbraw/zinc/15/20/70/1054152070.db2.gz UQIFBRPZWXSTDW-VIFPVBQESA-N 1 2 322.861 4.199 20 0 DIADLO CC[N@H+](Cc1cccc(Cl)c1)Cc1ccc(F)c(O)c1F ZINC001232941028 1054153605 /nfs/dbraw/zinc/15/36/05/1054153605.db2.gz SJNQPXLECAUFGR-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC[N@@H+](Cc1cccc(Cl)c1)Cc1ccc(F)c(O)c1F ZINC001232941028 1054153611 /nfs/dbraw/zinc/15/36/11/1054153611.db2.gz SJNQPXLECAUFGR-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(F)c(O)c2F)cc1 ZINC001232936866 1054154027 /nfs/dbraw/zinc/15/40/27/1054154027.db2.gz YAWROUGIFQOWQZ-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(F)c(O)c2F)cc1 ZINC001232936866 1054154041 /nfs/dbraw/zinc/15/40/41/1054154041.db2.gz YAWROUGIFQOWQZ-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO CC1(C)CC[NH+](Cc2cc(Cl)cnc2Br)CC1 ZINC001232960931 1054159656 /nfs/dbraw/zinc/15/96/56/1054159656.db2.gz SQOSZIZCUNAALA-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Cl)cnc2Br)[C@@H](C)C1 ZINC001232961559 1054159887 /nfs/dbraw/zinc/15/98/87/1054159887.db2.gz PIFOKEYHHNUQNB-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Cl)cnc2Br)[C@@H](C)C1 ZINC001232961559 1054159903 /nfs/dbraw/zinc/15/99/03/1054159903.db2.gz PIFOKEYHHNUQNB-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232975193 1054161813 /nfs/dbraw/zinc/16/18/13/1054161813.db2.gz GHXMRHUDMZQLCJ-INIZCTEOSA-N 1 2 303.352 4.180 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232975193 1054161821 /nfs/dbraw/zinc/16/18/21/1054161821.db2.gz GHXMRHUDMZQLCJ-INIZCTEOSA-N 1 2 303.352 4.180 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2cc(O)c(F)c(F)c2)c1 ZINC001232972929 1054162197 /nfs/dbraw/zinc/16/21/97/1054162197.db2.gz HAIAVBMPMPSOHG-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2cc(O)c(F)c(F)c2)c1 ZINC001232972929 1054162201 /nfs/dbraw/zinc/16/22/01/1054162201.db2.gz HAIAVBMPMPSOHG-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO Oc1cc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)cc(F)c1F ZINC001232973289 1054162896 /nfs/dbraw/zinc/16/28/96/1054162896.db2.gz SDEQFTUCZBADKV-ZDUSSCGKSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)cc(F)c1F ZINC001232973289 1054162903 /nfs/dbraw/zinc/16/29/03/1054162903.db2.gz SDEQFTUCZBADKV-ZDUSSCGKSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(C[NH+]2CCC(c3ccccc3F)CC2)cc(F)c1F ZINC001232971907 1054162944 /nfs/dbraw/zinc/16/29/44/1054162944.db2.gz RWBRZTJTAZHWFK-UHFFFAOYSA-N 1 2 321.342 4.189 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc(F)c1F ZINC001232971253 1054163155 /nfs/dbraw/zinc/16/31/55/1054163155.db2.gz ZCYSXKPTOQTLOE-OAHLLOKOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cc(F)c1F ZINC001232971253 1054163160 /nfs/dbraw/zinc/16/31/60/1054163160.db2.gz ZCYSXKPTOQTLOE-OAHLLOKOSA-N 1 2 307.315 4.147 20 0 DIADLO Cc1ncc(C[NH2+][C@@H](c2ccc(C(C)C)cc2)c2cccnc2)o1 ZINC001333618016 1054164438 /nfs/dbraw/zinc/16/44/38/1054164438.db2.gz URGJLZGPPMLKGW-FQEVSTJZSA-N 1 2 321.424 4.381 20 0 DIADLO Cc1ncc(F)cc1C[N@H+](C)Cc1ccc(Cl)cc1Cl ZINC001232985942 1054165054 /nfs/dbraw/zinc/16/50/54/1054165054.db2.gz KJMHHICHASSJIO-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1ncc(F)cc1C[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC001232985942 1054165064 /nfs/dbraw/zinc/16/50/64/1054165064.db2.gz KJMHHICHASSJIO-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cc(F)cnc1C ZINC001232993785 1054169032 /nfs/dbraw/zinc/16/90/32/1054169032.db2.gz RYHINZXPZWYHNH-SFHVURJKSA-N 1 2 314.404 4.013 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cc(F)cnc1C ZINC001232993785 1054169040 /nfs/dbraw/zinc/16/90/40/1054169040.db2.gz RYHINZXPZWYHNH-SFHVURJKSA-N 1 2 314.404 4.013 20 0 DIADLO CCOc1c(Cl)cc(C[N@@H+]2CCC[C@H]3C[C@H]32)cc1Cl ZINC001233106673 1054185435 /nfs/dbraw/zinc/18/54/35/1054185435.db2.gz GPPIGGRHENVPDT-SMDDNHRTSA-N 1 2 300.229 4.376 20 0 DIADLO CCOc1c(Cl)cc(C[N@H+]2CCC[C@H]3C[C@H]32)cc1Cl ZINC001233106673 1054185442 /nfs/dbraw/zinc/18/54/42/1054185442.db2.gz GPPIGGRHENVPDT-SMDDNHRTSA-N 1 2 300.229 4.376 20 0 DIADLO CCOC(=O)c1ccsc1C[N@@H+]1CCc2ccccc2[C@@H]1C ZINC001233016969 1054174432 /nfs/dbraw/zinc/17/44/32/1054174432.db2.gz BVKHFZMMQCNKEY-ZDUSSCGKSA-N 1 2 315.438 4.044 20 0 DIADLO CCOC(=O)c1ccsc1C[N@H+]1CCc2ccccc2[C@@H]1C ZINC001233016969 1054174438 /nfs/dbraw/zinc/17/44/38/1054174438.db2.gz BVKHFZMMQCNKEY-ZDUSSCGKSA-N 1 2 315.438 4.044 20 0 DIADLO C[N@H+](Cc1cccc(O)c1F)Cc1ccccc1C(F)(F)F ZINC001233053016 1054176548 /nfs/dbraw/zinc/17/65/48/1054176548.db2.gz GXFPQHAWRUTCPM-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO C[N@@H+](Cc1cccc(O)c1F)Cc1ccccc1C(F)(F)F ZINC001233053016 1054176555 /nfs/dbraw/zinc/17/65/55/1054176555.db2.gz GXFPQHAWRUTCPM-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO Cc1ccc(N2CC[NH+](Cc3ccsc3Cl)CC2)cc1 ZINC001233055805 1054177715 /nfs/dbraw/zinc/17/77/15/1054177715.db2.gz URCHYHKRFPPBFA-UHFFFAOYSA-N 1 2 306.862 4.032 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc(Cl)c(Br)n1 ZINC001233090007 1054183151 /nfs/dbraw/zinc/18/31/51/1054183151.db2.gz DOALFCRXWUYFKG-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ccc(Cl)c(Br)n1 ZINC001233090007 1054183154 /nfs/dbraw/zinc/18/31/54/1054183154.db2.gz DOALFCRXWUYFKG-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO Fc1ccc2c(c1)[nH]nc2C[N@@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC001233127535 1054188591 /nfs/dbraw/zinc/18/85/91/1054188591.db2.gz YDNSUMHQFZSXCT-MRXNPFEDSA-N 1 2 323.415 4.472 20 0 DIADLO Fc1ccc2c(c1)[nH]nc2C[N@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC001233127535 1054188595 /nfs/dbraw/zinc/18/85/95/1054188595.db2.gz YDNSUMHQFZSXCT-MRXNPFEDSA-N 1 2 323.415 4.472 20 0 DIADLO Cc1ccc(C)c2nc(Cl)c(C[N@H+]3C[C@@H](C)[C@@H](F)C3)cc12 ZINC001233131695 1054188702 /nfs/dbraw/zinc/18/87/02/1054188702.db2.gz NDPNQSXBEXLDKG-DOMZBBRYSA-N 1 2 306.812 4.295 20 0 DIADLO Cc1ccc(C)c2nc(Cl)c(C[N@@H+]3C[C@@H](C)[C@@H](F)C3)cc12 ZINC001233131695 1054188708 /nfs/dbraw/zinc/18/87/08/1054188708.db2.gz NDPNQSXBEXLDKG-DOMZBBRYSA-N 1 2 306.812 4.295 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@H]2CC[C@H](C)CC2)c(Br)s1 ZINC001233156939 1054191216 /nfs/dbraw/zinc/19/12/16/1054191216.db2.gz WDHSQIKDRMWEMT-HOMQSWHASA-N 1 2 317.296 4.225 20 0 DIADLO Cc1nc(C[N@H+](C)[C@H]2CC[C@H](C)CC2)c(Br)s1 ZINC001233156939 1054191224 /nfs/dbraw/zinc/19/12/24/1054191224.db2.gz WDHSQIKDRMWEMT-HOMQSWHASA-N 1 2 317.296 4.225 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)cnc1C ZINC001233161397 1054193483 /nfs/dbraw/zinc/19/34/83/1054193483.db2.gz ADTJGLUFZSCFIC-KRWDZBQOSA-N 1 2 302.368 4.314 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)cnc1C ZINC001233161397 1054193491 /nfs/dbraw/zinc/19/34/91/1054193491.db2.gz ADTJGLUFZSCFIC-KRWDZBQOSA-N 1 2 302.368 4.314 20 0 DIADLO Cc1cc(NC(=O)CC(C)(C)Cc2ccc(Cl)cc2)cc[nH+]1 ZINC000622367900 1054193981 /nfs/dbraw/zinc/19/39/81/1054193981.db2.gz BCUVBLCXEVPLGH-UHFFFAOYSA-N 1 2 316.832 4.063 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CC[C@H](C(F)(F)F)C2)cs1 ZINC001233177087 1054195950 /nfs/dbraw/zinc/19/59/50/1054195950.db2.gz GANFCMLXHRDGDX-QMMMGPOBSA-N 1 2 303.271 4.151 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)cs1 ZINC001233177087 1054195967 /nfs/dbraw/zinc/19/59/67/1054195967.db2.gz GANFCMLXHRDGDX-QMMMGPOBSA-N 1 2 303.271 4.151 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccnc(Cl)c2Br)[C@H](C)C1 ZINC001233181205 1054198497 /nfs/dbraw/zinc/19/84/97/1054198497.db2.gz HDDANEXFTDHAFY-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccnc(Cl)c2Br)[C@H](C)C1 ZINC001233181205 1054198503 /nfs/dbraw/zinc/19/85/03/1054198503.db2.gz HDDANEXFTDHAFY-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2c(F)ccc(C)c2F)C2CC2)s1 ZINC001334766362 1054199153 /nfs/dbraw/zinc/19/91/53/1054199153.db2.gz ILWITRCOJOCCSC-HNNXBMFYSA-N 1 2 308.397 4.279 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1ccc(Cl)c(F)c1F ZINC001233211534 1054203091 /nfs/dbraw/zinc/20/30/91/1054203091.db2.gz YLGNUVRYNWGLBI-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1ccc(Cl)c(F)c1F ZINC001233211534 1054203106 /nfs/dbraw/zinc/20/31/06/1054203106.db2.gz YLGNUVRYNWGLBI-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CCc1nnc(C[N@@H+]2C[C@@H]3CCCC[C@@]32c2ccccc2)s1 ZINC001334885414 1054203539 /nfs/dbraw/zinc/20/35/39/1054203539.db2.gz ODLFRLCJAJZQNC-MAUKXSAKSA-N 1 2 313.470 4.002 20 0 DIADLO CCc1nnc(C[N@H+]2C[C@@H]3CCCC[C@@]32c2ccccc2)s1 ZINC001334885414 1054203545 /nfs/dbraw/zinc/20/35/45/1054203545.db2.gz ODLFRLCJAJZQNC-MAUKXSAKSA-N 1 2 313.470 4.002 20 0 DIADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC001233218459 1054205227 /nfs/dbraw/zinc/20/52/27/1054205227.db2.gz AKWALHZGJFAIJM-CYBMUJFWSA-N 1 2 317.816 4.000 20 0 DIADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC001233218459 1054205235 /nfs/dbraw/zinc/20/52/35/1054205235.db2.gz AKWALHZGJFAIJM-CYBMUJFWSA-N 1 2 317.816 4.000 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1)c1cc(Br)cc(F)c1O ZINC000184849756 1054209282 /nfs/dbraw/zinc/20/92/82/1054209282.db2.gz XCTIBWFGEVEEME-SNVBAGLBSA-N 1 2 324.193 4.145 20 0 DIADLO Cc1ccc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)cc1O ZINC001233230735 1054209692 /nfs/dbraw/zinc/20/96/92/1054209692.db2.gz LPMNDPXWLQLMQA-NRFANRHFSA-N 1 2 318.420 4.107 20 0 DIADLO Cc1ccc(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)cc1O ZINC001233230735 1054209698 /nfs/dbraw/zinc/20/96/98/1054209698.db2.gz LPMNDPXWLQLMQA-NRFANRHFSA-N 1 2 318.420 4.107 20 0 DIADLO C[N@H+](Cc1csc(-c2ccc(F)cc2)n1)C1CC(F)(F)C1 ZINC001233240725 1054211947 /nfs/dbraw/zinc/21/19/47/1054211947.db2.gz NYTFHBRDEHMHCH-UHFFFAOYSA-N 1 2 312.360 4.179 20 0 DIADLO C[N@@H+](Cc1csc(-c2ccc(F)cc2)n1)C1CC(F)(F)C1 ZINC001233240725 1054211961 /nfs/dbraw/zinc/21/19/61/1054211961.db2.gz NYTFHBRDEHMHCH-UHFFFAOYSA-N 1 2 312.360 4.179 20 0 DIADLO C[N@H+](Cc1cscn1)Cc1ccc(Cc2ccccc2)cc1 ZINC001233331172 1054236554 /nfs/dbraw/zinc/23/65/54/1054236554.db2.gz KQGYQZZAAGMCKP-UHFFFAOYSA-N 1 2 308.450 4.366 20 0 DIADLO C[N@@H+](Cc1cscn1)Cc1ccc(Cc2ccccc2)cc1 ZINC001233331172 1054236571 /nfs/dbraw/zinc/23/65/71/1054236571.db2.gz KQGYQZZAAGMCKP-UHFFFAOYSA-N 1 2 308.450 4.366 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1cc3cccnc3s1)C2 ZINC001233349078 1054240921 /nfs/dbraw/zinc/24/09/21/1054240921.db2.gz CPKNDQZTDZSGNS-UHFFFAOYSA-N 1 2 300.814 4.466 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1cc3cccnc3s1)C2 ZINC001233349078 1054240930 /nfs/dbraw/zinc/24/09/30/1054240930.db2.gz CPKNDQZTDZSGNS-UHFFFAOYSA-N 1 2 300.814 4.466 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCSc3ccccc3C2)cc1F ZINC001233344374 1054242740 /nfs/dbraw/zinc/24/27/40/1054242740.db2.gz AVUBIKRFAXHVBP-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCSc3ccccc3C2)cc1F ZINC001233344374 1054242754 /nfs/dbraw/zinc/24/27/54/1054242754.db2.gz AVUBIKRFAXHVBP-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccc(C)nc2)cc1F ZINC001233344211 1054243649 /nfs/dbraw/zinc/24/36/49/1054243649.db2.gz TVQMQSFJOGQECC-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccc(C)nc2)cc1F ZINC001233344211 1054243668 /nfs/dbraw/zinc/24/36/68/1054243668.db2.gz TVQMQSFJOGQECC-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO C[N@H+](Cc1ccc(Cl)c(Cl)c1)Cc1cncc(Cl)n1 ZINC001233447350 1054277324 /nfs/dbraw/zinc/27/73/24/1054277324.db2.gz CBLMQEMHXKRWOY-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)c(Cl)c1)Cc1cncc(Cl)n1 ZINC001233447350 1054277335 /nfs/dbraw/zinc/27/73/35/1054277335.db2.gz CBLMQEMHXKRWOY-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO CC[N@H+](Cc1cnc2cccc(Cl)n12)Cc1ccccc1F ZINC001233359096 1054248471 /nfs/dbraw/zinc/24/84/71/1054248471.db2.gz IOCMWTOHNJTWNM-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO CC[N@@H+](Cc1cnc2cccc(Cl)n12)Cc1ccccc1F ZINC001233359096 1054248480 /nfs/dbraw/zinc/24/84/80/1054248480.db2.gz IOCMWTOHNJTWNM-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1cnc2cccc(Cl)n12 ZINC001233355960 1054249546 /nfs/dbraw/zinc/24/95/46/1054249546.db2.gz UIYUXBRJLAXDSS-CYBMUJFWSA-N 1 2 311.816 4.107 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cnc2cccc(Cl)n12 ZINC001233355960 1054249554 /nfs/dbraw/zinc/24/95/54/1054249554.db2.gz UIYUXBRJLAXDSS-CYBMUJFWSA-N 1 2 311.816 4.107 20 0 DIADLO Nc1ccc(C[N@@H+]2CCc3ccc(Cl)cc3C2)c(Cl)c1 ZINC001233373713 1054252546 /nfs/dbraw/zinc/25/25/46/1054252546.db2.gz YCMVOLDQCAXRKF-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1ccc(C[N@H+]2CCc3ccc(Cl)cc3C2)c(Cl)c1 ZINC001233373713 1054252557 /nfs/dbraw/zinc/25/25/57/1054252557.db2.gz YCMVOLDQCAXRKF-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Cc1cc(F)cc(N2CCC(c3nc4ccccc4o3)CC2)[nH+]1 ZINC001336959796 1054254245 /nfs/dbraw/zinc/25/42/45/1054254245.db2.gz VGBZZCZTSXMWMA-UHFFFAOYSA-N 1 2 311.360 4.054 20 0 DIADLO Nc1cc(F)c(F)cc1C[N@@H+]1CCCC[C@@H]1c1ccccc1F ZINC001233380909 1054257244 /nfs/dbraw/zinc/25/72/44/1054257244.db2.gz IRSKULGFYMPUGQ-GOSISDBHSA-N 1 2 320.358 4.413 20 0 DIADLO Nc1cc(F)c(F)cc1C[N@H+]1CCCC[C@@H]1c1ccccc1F ZINC001233380909 1054257256 /nfs/dbraw/zinc/25/72/56/1054257256.db2.gz IRSKULGFYMPUGQ-GOSISDBHSA-N 1 2 320.358 4.413 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)ccc(O)c2F)cc1 ZINC001233395619 1054259643 /nfs/dbraw/zinc/25/96/43/1054259643.db2.gz FQKZUPZLBBLKIR-MRXNPFEDSA-N 1 2 303.352 4.316 20 0 DIADLO C[C@H]([NH2+]C/C(Cl)=C/Cl)c1ccc(F)cc1OC(F)F ZINC001337224457 1054260378 /nfs/dbraw/zinc/26/03/78/1054260378.db2.gz HHIBGQLPTLNQRO-BJMRUTCWSA-N 1 2 314.134 4.397 20 0 DIADLO Clc1ncnc(Cl)c1C[N@@H+]1CCC[C@H](c2ccccc2)C1 ZINC001233409799 1054262861 /nfs/dbraw/zinc/26/28/61/1054262861.db2.gz NCFYPKAZMVBVID-ZDUSSCGKSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1ncnc(Cl)c1C[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC001233409799 1054262871 /nfs/dbraw/zinc/26/28/71/1054262871.db2.gz NCFYPKAZMVBVID-ZDUSSCGKSA-N 1 2 322.239 4.163 20 0 DIADLO CCC1CC[NH+](Cc2cc(Br)ncc2Cl)CC1 ZINC001233425352 1054270983 /nfs/dbraw/zinc/27/09/83/1054270983.db2.gz VZYSSSOCBKZDJJ-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Br)c(Cl)cc2F)C1 ZINC001233439893 1054273784 /nfs/dbraw/zinc/27/37/84/1054273784.db2.gz VUCLBLMJKUPCGH-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Br)c(Cl)cc2F)C1 ZINC001233439893 1054273797 /nfs/dbraw/zinc/27/37/97/1054273797.db2.gz VUCLBLMJKUPCGH-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO Clc1ccc2cc(C[NH+]3CC(Oc4ccccc4)C3)ccc2n1 ZINC001233444220 1054274815 /nfs/dbraw/zinc/27/48/15/1054274815.db2.gz HUXUUBRILLOBPE-UHFFFAOYSA-N 1 2 324.811 4.151 20 0 DIADLO Cn1c(Cl)ncc1C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000848881766 1054280547 /nfs/dbraw/zinc/28/05/47/1054280547.db2.gz RUEVXTJSJNIQQM-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1c(Cl)ncc1C[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000848881766 1054280559 /nfs/dbraw/zinc/28/05/59/1054280559.db2.gz RUEVXTJSJNIQQM-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO CC[C@H](C)[C@@H](C)C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001337683700 1054280746 /nfs/dbraw/zinc/28/07/46/1054280746.db2.gz GROZBEZYSSVNAV-ARFHVFGLSA-N 1 2 319.493 4.026 20 0 DIADLO CC(C)(C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C1CCC1 ZINC001356317924 1054318429 /nfs/dbraw/zinc/31/84/29/1054318429.db2.gz XQIPQLAVBLOLNW-UHFFFAOYSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1cc(C)c(NC(=O)c2nc(C(C)(C)C)cs2)c(C)[nH+]1 ZINC001356376190 1054323029 /nfs/dbraw/zinc/32/30/29/1054323029.db2.gz FQFVXJVTZSVNMZ-UHFFFAOYSA-N 1 2 303.431 4.013 20 0 DIADLO CCCc1sc(C(=O)NCc2c[nH+]c(C)cc2C)cc1CC ZINC000622667473 1054324738 /nfs/dbraw/zinc/32/47/38/1054324738.db2.gz IEOCNEAUHXXJCN-UHFFFAOYSA-N 1 2 316.470 4.205 20 0 DIADLO CC[C@H](C(=O)NCc1c[nH+]c(C)cc1C)C1CCC(C)CC1 ZINC000622667791 1054331543 /nfs/dbraw/zinc/33/15/43/1054331543.db2.gz TXAROEDOBUUBCV-AUCFXJAVSA-N 1 2 302.462 4.167 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1cc(Br)ccc1F ZINC000171146690 1054347800 /nfs/dbraw/zinc/34/78/00/1054347800.db2.gz ZNRZZDKMRPQVIB-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1cc(Br)ccc1F ZINC000171146690 1054347811 /nfs/dbraw/zinc/34/78/11/1054347811.db2.gz ZNRZZDKMRPQVIB-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO Cc1cc(N[C@@H]2COc3ccc(Cl)cc32)nc(C(C)C)[nH+]1 ZINC000474782703 1054356448 /nfs/dbraw/zinc/35/64/48/1054356448.db2.gz ZGZWGNCTIUOOTJ-CYBMUJFWSA-N 1 2 303.793 4.107 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cscc2C(F)(F)F)c(C)[nH+]1 ZINC000622776973 1054381920 /nfs/dbraw/zinc/38/19/20/1054381920.db2.gz YEQPQCLWSPMJLG-UHFFFAOYSA-N 1 2 314.332 4.339 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)c(C)[nH+]1 ZINC000171916893 1054397155 /nfs/dbraw/zinc/39/71/55/1054397155.db2.gz IREMTBBFMMOGPS-LSDHHAIUSA-N 1 2 316.351 4.027 20 0 DIADLO Cc1nc(C[NH+]2CCC(C(C)C)CC2)sc1Br ZINC001473165199 1054399156 /nfs/dbraw/zinc/39/91/56/1054399156.db2.gz JTLSLTKHMIZHNC-UHFFFAOYSA-N 1 2 317.296 4.082 20 0 DIADLO FC(F)C1CC[NH+](Cc2csc(Nc3ccccc3)n2)CC1 ZINC000483519487 1054400798 /nfs/dbraw/zinc/40/07/98/1054400798.db2.gz NGIABWNIZYAMCG-UHFFFAOYSA-N 1 2 323.412 4.364 20 0 DIADLO Fc1cc(Cl)cc(CNc2ccc(N3CCCC3)c[nH+]2)c1 ZINC000485706515 1054404864 /nfs/dbraw/zinc/40/48/64/1054404864.db2.gz CFZGUMBYSHXOQQ-UHFFFAOYSA-N 1 2 305.784 4.086 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)n1 ZINC000172409326 1054428804 /nfs/dbraw/zinc/42/88/04/1054428804.db2.gz ISTBXQBZRGWLTQ-YJBOKZPZSA-N 1 2 315.486 4.143 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)n1 ZINC000172409326 1054428807 /nfs/dbraw/zinc/42/88/07/1054428807.db2.gz ISTBXQBZRGWLTQ-YJBOKZPZSA-N 1 2 315.486 4.143 20 0 DIADLO Cc1cc(N[C@@H](C)[C@@H]2OCCc3sccc32)nc(C(C)C)[nH+]1 ZINC000488741965 1054433390 /nfs/dbraw/zinc/43/33/90/1054433390.db2.gz CPNKLISYGSTLAF-LRDDRELGSA-N 1 2 317.458 4.084 20 0 DIADLO COc1cccc2cc(C[NH2+]Cc3cccc(O)c3Cl)oc21 ZINC001343895783 1054455531 /nfs/dbraw/zinc/45/55/31/1054455531.db2.gz ORIQEMGTAFZSPE-UHFFFAOYSA-N 1 2 317.772 4.090 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[N@H+]1CC=C(C(C)(C)C)CC1 ZINC000671242436 1054457044 /nfs/dbraw/zinc/45/70/44/1054457044.db2.gz UHEVVKIRLJXIKE-CQSZACIVSA-N 1 2 311.429 4.476 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000671242436 1054457051 /nfs/dbraw/zinc/45/70/51/1054457051.db2.gz UHEVVKIRLJXIKE-CQSZACIVSA-N 1 2 311.429 4.476 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[N@@H+]1CCCc2ccccc2C1 ZINC000671241064 1054457069 /nfs/dbraw/zinc/45/70/69/1054457069.db2.gz JXACTZNPUBEFLY-OAHLLOKOSA-N 1 2 319.408 4.246 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[N@H+]1CCCc2ccccc2C1 ZINC000671241064 1054457078 /nfs/dbraw/zinc/45/70/78/1054457078.db2.gz JXACTZNPUBEFLY-OAHLLOKOSA-N 1 2 319.408 4.246 20 0 DIADLO CC(C)C[C@@H](C(=O)N[C@H](C)CCC1CCCCC1)n1cc[nH+]c1 ZINC001443972891 1054463870 /nfs/dbraw/zinc/46/38/70/1054463870.db2.gz ILDBZUZEEURJDD-AEFFLSMTSA-N 1 2 319.493 4.336 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001357393605 1054471203 /nfs/dbraw/zinc/47/12/03/1054471203.db2.gz CEKHUKOHQMPHKA-MRXNPFEDSA-N 1 2 317.477 4.391 20 0 DIADLO CC[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C(C)(C)c1ccccc1 ZINC001444561790 1054479875 /nfs/dbraw/zinc/47/98/75/1054479875.db2.gz QVSATJVRCNOUDA-GOSISDBHSA-N 1 2 321.424 4.049 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@@H]1CCC[C@H]2CCCC[C@H]21 ZINC001357549323 1054498256 /nfs/dbraw/zinc/49/82/56/1054498256.db2.gz DPQRHVOERJBWHR-ATZDWAIDSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1ccc(CC[N@@H+](Cc2cscn2)Cc2ccco2)cc1 ZINC000174043361 1054501377 /nfs/dbraw/zinc/50/13/77/1054501377.db2.gz XEMRXZUTHZUVKA-UHFFFAOYSA-N 1 2 312.438 4.289 20 0 DIADLO Cc1ccc(CC[N@H+](Cc2cscn2)Cc2ccco2)cc1 ZINC000174043361 1054501387 /nfs/dbraw/zinc/50/13/87/1054501387.db2.gz XEMRXZUTHZUVKA-UHFFFAOYSA-N 1 2 312.438 4.289 20 0 DIADLO CC(C)(C)c1ccc(-c2ccc(C[NH2+]Cc3cc[nH]n3)o2)cc1 ZINC000174422146 1054508242 /nfs/dbraw/zinc/50/82/42/1054508242.db2.gz FYPXBBJIHKKXGK-UHFFFAOYSA-N 1 2 309.413 4.257 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H](C)CCCc3ccccc3)cc2[nH+]1 ZINC001445755457 1054515202 /nfs/dbraw/zinc/51/52/02/1054515202.db2.gz XWOHOTPNTSNDPW-AWEZNQCLSA-N 1 2 321.424 4.469 20 0 DIADLO CCc1noc(C)c1C[N@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000342278267 1054523552 /nfs/dbraw/zinc/52/35/52/1054523552.db2.gz WBGKSRAEFFWJFR-WBMJQRKESA-N 1 2 314.429 4.426 20 0 DIADLO COc1ccc(/C(C)=C\C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC001357672109 1054523674 /nfs/dbraw/zinc/52/36/74/1054523674.db2.gz INNZTZWKCZNZSG-QXMHVHEDSA-N 1 2 310.397 4.057 20 0 DIADLO CCc1noc(C)c1C[N@@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000342278267 1054523567 /nfs/dbraw/zinc/52/35/67/1054523567.db2.gz WBGKSRAEFFWJFR-WBMJQRKESA-N 1 2 314.429 4.426 20 0 DIADLO Clc1ccc(-c2ccc(C[N@@H+]3CCc4c[nH]nc4C3)cc2)cc1 ZINC000671306147 1054546099 /nfs/dbraw/zinc/54/60/99/1054546099.db2.gz CGEHPFJLYKUJHD-UHFFFAOYSA-N 1 2 323.827 4.288 20 0 DIADLO Clc1ccc(-c2ccc(C[N@H+]3CCc4c[nH]nc4C3)cc2)cc1 ZINC000671306147 1054546107 /nfs/dbraw/zinc/54/61/07/1054546107.db2.gz CGEHPFJLYKUJHD-UHFFFAOYSA-N 1 2 323.827 4.288 20 0 DIADLO Clc1ccc(-c2ccc(C[N@@H+]3CCc4cn[nH]c4C3)cc2)cc1 ZINC000671306147 1054546116 /nfs/dbraw/zinc/54/61/16/1054546116.db2.gz CGEHPFJLYKUJHD-UHFFFAOYSA-N 1 2 323.827 4.288 20 0 DIADLO Clc1ccc(-c2ccc(C[N@H+]3CCc4cn[nH]c4C3)cc2)cc1 ZINC000671306147 1054546126 /nfs/dbraw/zinc/54/61/26/1054546126.db2.gz CGEHPFJLYKUJHD-UHFFFAOYSA-N 1 2 323.827 4.288 20 0 DIADLO CCOC(=[NH2+])c1ccc(OC2CC(C)(C)OC(C)(C)C2)cc1 ZINC001234588944 1054550717 /nfs/dbraw/zinc/55/07/17/1054550717.db2.gz UJIDZEGKXFIBCZ-UHFFFAOYSA-N 1 2 305.418 4.163 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@@H](C)COCc2ccccc2)cc1 ZINC001234588311 1054550956 /nfs/dbraw/zinc/55/09/56/1054550956.db2.gz LQVXGIVKXUTOLP-HNNXBMFYSA-N 1 2 313.397 4.033 20 0 DIADLO CCOC(=[NH2+])c1ccc(OC[C@@H](C)OCc2ccccc2)cc1 ZINC001234589319 1054552619 /nfs/dbraw/zinc/55/26/19/1054552619.db2.gz ZMPIJDZEAYHHDJ-OAHLLOKOSA-N 1 2 313.397 4.033 20 0 DIADLO COc1cccc([C@@H]2CCCN2c2[nH+]ccc3c(N)cccc32)c1 ZINC001347182141 1054559577 /nfs/dbraw/zinc/55/95/77/1054559577.db2.gz YOIDBHIOSFXEPW-IBGZPJMESA-N 1 2 319.408 4.167 20 0 DIADLO Cc1nc([C@@H]([NH2+]C[C@@H](C)C(C)(C)C)c2ccc(Cl)cc2)no1 ZINC000670267997 1054573722 /nfs/dbraw/zinc/57/37/22/1054573722.db2.gz BBJJYZKNOHFFBC-ABAIWWIYSA-N 1 2 321.852 4.393 20 0 DIADLO COc1ccc(C)cc1C[NH2+]Cc1coc(-c2ccc(C)cc2)n1 ZINC000072927158 1054575886 /nfs/dbraw/zinc/57/58/86/1054575886.db2.gz SXGNOYIUHBJGHP-UHFFFAOYSA-N 1 2 322.408 4.257 20 0 DIADLO COC[C@@H]([NH2+]Cc1csc(C(F)(F)F)c1)c1ccc(C)o1 ZINC000623438154 1054592444 /nfs/dbraw/zinc/59/24/44/1054592444.db2.gz OHTBUHMBXNRYAT-LLVKDONJSA-N 1 2 319.348 4.146 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3ccc(C(C)(C)C)cc3)ccn12 ZINC001348477735 1054649823 /nfs/dbraw/zinc/64/98/23/1054649823.db2.gz MIHQXPMYHXHTQX-UHFFFAOYSA-N 1 2 308.381 4.159 20 0 DIADLO CC(C)c1nc(C[NH2+]Cc2cnccc2C(C)(C)C)cs1 ZINC001348568683 1054660298 /nfs/dbraw/zinc/66/02/98/1054660298.db2.gz RNXRUDCRRVLYPO-UHFFFAOYSA-N 1 2 303.475 4.249 20 0 DIADLO FC1C[C@@H]2COC[C@H](C1)[N@@H+]2Cc1cc(-c2ccsc2)cs1 ZINC001235189543 1054680619 /nfs/dbraw/zinc/68/06/19/1054680619.db2.gz REVMABOJYLOQBI-GOOCMWNKSA-N 1 2 323.458 4.178 20 0 DIADLO FC1C[C@@H]2COC[C@H](C1)[N@H+]2Cc1cc(-c2ccsc2)cs1 ZINC001235189543 1054680625 /nfs/dbraw/zinc/68/06/25/1054680625.db2.gz REVMABOJYLOQBI-GOOCMWNKSA-N 1 2 323.458 4.178 20 0 DIADLO CSC1CC[NH+](Cc2nc(Cl)ccc2C(F)(F)F)CC1 ZINC001235238645 1054689257 /nfs/dbraw/zinc/68/92/57/1054689257.db2.gz RTBWTQPZUULHFZ-UHFFFAOYSA-N 1 2 324.799 4.081 20 0 DIADLO CCc1cccc(C[N@@H+]2CCSC[C@H]2c2ccc(F)cc2)n1 ZINC001235261398 1054695722 /nfs/dbraw/zinc/69/57/22/1054695722.db2.gz RYFIDAYKSHFTII-SFHVURJKSA-N 1 2 316.445 4.073 20 0 DIADLO CCc1cccc(C[N@H+]2CCSC[C@H]2c2ccc(F)cc2)n1 ZINC001235261398 1054695728 /nfs/dbraw/zinc/69/57/28/1054695728.db2.gz RYFIDAYKSHFTII-SFHVURJKSA-N 1 2 316.445 4.073 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](CC(C)C)c2ccc(Cl)cc2)o1 ZINC000179716630 1054698382 /nfs/dbraw/zinc/69/83/82/1054698382.db2.gz OOWSDYDHHIVVJM-AWEZNQCLSA-N 1 2 307.825 4.162 20 0 DIADLO Cc1nc(N[C@@H](C)CCCC(F)(F)F)c2c([nH+]1)CCCC2 ZINC000493573971 1054700452 /nfs/dbraw/zinc/70/04/52/1054700452.db2.gz RHHFZBLTIBATIG-JTQLQIEISA-N 1 2 301.356 4.197 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)c(F)cn1 ZINC001235314967 1054700950 /nfs/dbraw/zinc/70/09/50/1054700950.db2.gz CMNMGOPVNPLLOZ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)c(F)cn1 ZINC001235314967 1054700967 /nfs/dbraw/zinc/70/09/67/1054700967.db2.gz CMNMGOPVNPLLOZ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2ccccc2o1)c1cc(F)ccc1F ZINC000179794218 1054703489 /nfs/dbraw/zinc/70/34/89/1054703489.db2.gz FVVHLARPAXCAPV-CQSZACIVSA-N 1 2 302.324 4.347 20 0 DIADLO Cc1cnc(F)c(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC001235337767 1054703904 /nfs/dbraw/zinc/70/39/04/1054703904.db2.gz FTPORKNUZPIYSX-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1cnc(F)c(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC001235337767 1054703924 /nfs/dbraw/zinc/70/39/24/1054703924.db2.gz FTPORKNUZPIYSX-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO COc1ccc2cc(CNc3cc(C)[nH+]c(C4CC4)n3)ccc2c1 ZINC000604756485 1054707921 /nfs/dbraw/zinc/70/79/21/1054707921.db2.gz CQHLEINYKUWXMB-UHFFFAOYSA-N 1 2 319.408 4.436 20 0 DIADLO Cc1cc(NCCOc2cccc3ccccc32)nc(C2CC2)[nH+]1 ZINC000604757110 1054709023 /nfs/dbraw/zinc/70/90/23/1054709023.db2.gz URCNMVJORQRNPZ-UHFFFAOYSA-N 1 2 319.408 4.307 20 0 DIADLO CCOc1cc(O)cc(C[N@H+](CC)Cc2cccc(F)c2F)c1 ZINC001235400315 1054712681 /nfs/dbraw/zinc/71/26/81/1054712681.db2.gz FWRIGBZFTLKESF-UHFFFAOYSA-N 1 2 321.367 4.091 20 0 DIADLO CCOc1cc(O)cc(C[N@@H+](CC)Cc2cccc(F)c2F)c1 ZINC001235400315 1054712704 /nfs/dbraw/zinc/71/27/04/1054712704.db2.gz FWRIGBZFTLKESF-UHFFFAOYSA-N 1 2 321.367 4.091 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(C)nc2)cc(F)c1F ZINC001235441743 1054720879 /nfs/dbraw/zinc/72/08/79/1054720879.db2.gz RNDGZZOJDZFHHF-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(C)nc2)cc(F)c1F ZINC001235441743 1054720895 /nfs/dbraw/zinc/72/08/95/1054720895.db2.gz RNDGZZOJDZFHHF-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccc(OC(F)F)cc1 ZINC000921505849 1054724921 /nfs/dbraw/zinc/72/49/21/1054724921.db2.gz CUSFUTALJVGAIK-LLVKDONJSA-N 1 2 324.371 4.424 20 0 DIADLO CN(Cc1cccc2[nH+]ccn21)[C@@H](c1ccccc1)C(F)(F)F ZINC000180038096 1054729169 /nfs/dbraw/zinc/72/91/69/1054729169.db2.gz FYFJVOOCLMQFPP-INIZCTEOSA-N 1 2 319.330 4.070 20 0 DIADLO Fc1ccc2oc(Nc3ccc(NC4CCCC4)[nH+]c3)nc2c1 ZINC000511662335 1054732592 /nfs/dbraw/zinc/73/25/92/1054732592.db2.gz AYGHPUAKORLTGL-UHFFFAOYSA-N 1 2 312.348 4.460 20 0 DIADLO Clc1cc2c(C[N@@H+]3CCC[C@@H]3c3nccs3)c[nH]c2cn1 ZINC001235519304 1054732597 /nfs/dbraw/zinc/73/25/97/1054732597.db2.gz DVVBQJMXGBVDPR-CYBMUJFWSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1cc2c(C[N@H+]3CCC[C@@H]3c3nccs3)c[nH]c2cn1 ZINC001235519304 1054732611 /nfs/dbraw/zinc/73/26/11/1054732611.db2.gz DVVBQJMXGBVDPR-CYBMUJFWSA-N 1 2 318.833 4.010 20 0 DIADLO Cc1ccccc1[C@@H]([NH2+]Cc1nc(CC(C)C)no1)C(C)(C)C ZINC000180089127 1054732678 /nfs/dbraw/zinc/73/26/78/1054732678.db2.gz DBGQFWVJDMFCGT-GOSISDBHSA-N 1 2 315.461 4.454 20 0 DIADLO c1snnc1C[NH2+][C@@H](CCc1ccccc1)c1ccccc1 ZINC000180135182 1054737975 /nfs/dbraw/zinc/73/79/75/1054737975.db2.gz VKTNBJNYGKZRFY-SFHVURJKSA-N 1 2 309.438 4.002 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1ncc(C)c(OC)c1C ZINC000623759774 1054739547 /nfs/dbraw/zinc/73/95/47/1054739547.db2.gz BPNCMBPJSFGIIC-UHFFFAOYSA-N 1 2 324.877 4.444 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1ncc(C)c(OC)c1C ZINC000623759774 1054739563 /nfs/dbraw/zinc/73/95/63/1054739563.db2.gz BPNCMBPJSFGIIC-UHFFFAOYSA-N 1 2 324.877 4.444 20 0 DIADLO Fc1ccc(Cl)cc1CNc1ccc(N2CCCC2)c[nH+]1 ZINC000513005921 1054741478 /nfs/dbraw/zinc/74/14/78/1054741478.db2.gz ZMOBFMDTGMLSFG-UHFFFAOYSA-N 1 2 305.784 4.086 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ncc(Cl)cc1Cl ZINC000180214033 1054744543 /nfs/dbraw/zinc/74/45/43/1054744543.db2.gz KETCYWAJKSPENC-HNNXBMFYSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ncc(Cl)cc1Cl ZINC000180214033 1054744551 /nfs/dbraw/zinc/74/45/51/1054744551.db2.gz KETCYWAJKSPENC-HNNXBMFYSA-N 1 2 310.228 4.367 20 0 DIADLO Cc1ccccc1C[N@H+](C)Cc1c(C)cncc1Br ZINC001235645508 1054761330 /nfs/dbraw/zinc/76/13/30/1054761330.db2.gz QFIZJSAGILGMPH-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccccc1C[N@@H+](C)Cc1c(C)cncc1Br ZINC001235645508 1054761315 /nfs/dbraw/zinc/76/13/15/1054761315.db2.gz QFIZJSAGILGMPH-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO CC(C)C[C@H](C(=O)N(c1ccccc1)C1CCC1)n1cc[nH+]c1 ZINC001454266546 1054761639 /nfs/dbraw/zinc/76/16/39/1054761639.db2.gz KOFPEIWGRDPVKP-GOSISDBHSA-N 1 2 311.429 4.056 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(Nc3ccccc3)n2)CCC1(F)F ZINC000519235010 1054768473 /nfs/dbraw/zinc/76/84/73/1054768473.db2.gz RKMVTXUCIYRHFY-LBPRGKRZSA-N 1 2 323.412 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(Nc3ccccc3)n2)CCC1(F)F ZINC000519235010 1054768483 /nfs/dbraw/zinc/76/84/83/1054768483.db2.gz RKMVTXUCIYRHFY-LBPRGKRZSA-N 1 2 323.412 4.364 20 0 DIADLO Nc1nccc(Cl)c1C[N@@H+]1CCCC[C@H]1c1ccccc1F ZINC001235679836 1054773370 /nfs/dbraw/zinc/77/33/70/1054773370.db2.gz RKGLVFGHLGIHBU-INIZCTEOSA-N 1 2 319.811 4.184 20 0 DIADLO Nc1nccc(Cl)c1C[N@H+]1CCCC[C@H]1c1ccccc1F ZINC001235679836 1054773387 /nfs/dbraw/zinc/77/33/87/1054773387.db2.gz RKGLVFGHLGIHBU-INIZCTEOSA-N 1 2 319.811 4.184 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2ncc(C)s2)c2ccccc2)cc1 ZINC000180644403 1054773544 /nfs/dbraw/zinc/77/35/44/1054773544.db2.gz JCHWOEGPBXYVGW-LJQANCHMSA-N 1 2 324.449 4.339 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC000180896336 1054779392 /nfs/dbraw/zinc/77/93/92/1054779392.db2.gz IKMDURGYBXJUOH-AWEZNQCLSA-N 1 2 322.412 4.106 20 0 DIADLO Cc1cc(NCCOc2ccc3ccccc3c2)nc(C2CC2)[nH+]1 ZINC000523876033 1054780242 /nfs/dbraw/zinc/78/02/42/1054780242.db2.gz KNWIOFCSHCNLOV-UHFFFAOYSA-N 1 2 319.408 4.307 20 0 DIADLO Cc1ccc(-c2nc(CNc3cc(C)[nH+]c(C4CC4)n3)co2)cc1 ZINC000525307646 1054781648 /nfs/dbraw/zinc/78/16/48/1054781648.db2.gz UBIRJNPTAJJSFA-UHFFFAOYSA-N 1 2 320.396 4.238 20 0 DIADLO CC(C)c1cc(N[C@@H](C)c2ncccc2F)nc(C(C)C)[nH+]1 ZINC000528263527 1054794870 /nfs/dbraw/zinc/79/48/70/1054794870.db2.gz MSXPYCYBCJBESB-LBPRGKRZSA-N 1 2 302.397 4.431 20 0 DIADLO CCCO[C@@H]1CC[N@H+](Cc2c(F)cc(Cl)cc2Cl)C1 ZINC001235742603 1054795168 /nfs/dbraw/zinc/79/51/68/1054795168.db2.gz OGCBUZGWICNWEM-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@@H]1CC[N@@H+](Cc2c(F)cc(Cl)cc2Cl)C1 ZINC001235742603 1054795174 /nfs/dbraw/zinc/79/51/74/1054795174.db2.gz OGCBUZGWICNWEM-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@@H](c2nc3ccccc3[nH]2)C(C)C)n1 ZINC000623873726 1054797198 /nfs/dbraw/zinc/79/71/98/1054797198.db2.gz PTVZPEGQUPLXHH-SWLSCSKDSA-N 1 2 314.458 4.376 20 0 DIADLO CCO[C@@H]1CCC[N@H+](Cc2c(F)cc(Cl)cc2Cl)C1 ZINC001235748402 1054798886 /nfs/dbraw/zinc/79/88/86/1054798886.db2.gz ZCJCGZMTYHRBTJ-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@@H]1CCC[N@@H+](Cc2c(F)cc(Cl)cc2Cl)C1 ZINC001235748402 1054798896 /nfs/dbraw/zinc/79/88/96/1054798896.db2.gz ZCJCGZMTYHRBTJ-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO Clc1cccc2c1OCC[C@@H]2[NH2+][C@H]1CCCc2scnc21 ZINC000623877299 1054800166 /nfs/dbraw/zinc/80/01/66/1054800166.db2.gz XYCHEIIZVRQWQM-STQMWFEESA-N 1 2 320.845 4.287 20 0 DIADLO C[C@H]1C[NH+](Cc2c(F)cccc2OC(F)(F)F)C[C@H](C)S1 ZINC001474340101 1054804868 /nfs/dbraw/zinc/80/48/68/1054804868.db2.gz VWZUQYUNHMDLGU-UWVGGRQHSA-N 1 2 323.355 4.050 20 0 DIADLO CC[C@@H]([NH2+]Cc1n[nH]cc1Br)c1cc(C)ccc1C ZINC000623896345 1054804914 /nfs/dbraw/zinc/80/49/14/1054804914.db2.gz OOPYICLBZFEZPI-CQSZACIVSA-N 1 2 322.250 4.030 20 0 DIADLO Fc1cc(C[NH+]2CC(C(F)F)C2)ccc1OCc1ccccc1 ZINC001235771726 1054804794 /nfs/dbraw/zinc/80/47/94/1054804794.db2.gz AMZQNBLRMIPNAL-UHFFFAOYSA-N 1 2 321.342 4.102 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@H](C)c2ccccc2OC(C)C)[nH+]1 ZINC000531433514 1054807093 /nfs/dbraw/zinc/80/70/93/1054807093.db2.gz VVLSDMAXUOVMLD-GFCCVEGCSA-N 1 2 310.401 4.227 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCc1cc(F)cc2c1OCOC2 ZINC000532268977 1054809517 /nfs/dbraw/zinc/80/95/17/1054809517.db2.gz RJYVVCMKJODBFF-UHFFFAOYSA-N 1 2 324.355 4.161 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000532369561 1054809678 /nfs/dbraw/zinc/80/96/78/1054809678.db2.gz ZGFWBSLOSCRELJ-GFCCVEGCSA-N 1 2 303.381 4.229 20 0 DIADLO Cc1nc(F)ccc1C[N@H+](Cc1ccccc1)Cc1ccccn1 ZINC001235805603 1054810382 /nfs/dbraw/zinc/81/03/82/1054810382.db2.gz PCMVXDNEPAUYML-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+](Cc1ccccc1)Cc1ccccn1 ZINC001235805603 1054810391 /nfs/dbraw/zinc/81/03/91/1054810391.db2.gz PCMVXDNEPAUYML-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO CCOc1cc(C)ccc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000623905240 1054815549 /nfs/dbraw/zinc/81/55/49/1054815549.db2.gz VPQAROVSHOWXIV-CQSZACIVSA-N 1 2 302.443 4.017 20 0 DIADLO Cc1ccc(OC(F)F)c(C[NH2+][C@@H]2CCCc3scnc32)c1 ZINC000623905371 1054815705 /nfs/dbraw/zinc/81/57/05/1054815705.db2.gz ZOHHUUVTVWZWIY-GFCCVEGCSA-N 1 2 324.396 4.220 20 0 DIADLO CCCCCn1cc(C[NH2+][C@@H]2CCCc3scnc32)c(C)n1 ZINC000623926428 1054816496 /nfs/dbraw/zinc/81/64/96/1054816496.db2.gz GAKUPRWEDJBMMB-OAHLLOKOSA-N 1 2 318.490 4.005 20 0 DIADLO COc1nccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c1Cl ZINC001235828923 1054816473 /nfs/dbraw/zinc/81/64/73/1054816473.db2.gz BODYWQJUAPECCV-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c1Cl ZINC001235828923 1054816479 /nfs/dbraw/zinc/81/64/79/1054816479.db2.gz BODYWQJUAPECCV-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1ccc(C(F)F)nc1 ZINC000630953230 1054823609 /nfs/dbraw/zinc/82/36/09/1054823609.db2.gz DHKTYCNKBOHKNX-UHFFFAOYSA-N 1 2 320.318 4.140 20 0 DIADLO Cc1nc2cc(C[N@H+](C)Cc3cnc(Cl)s3)ccc2s1 ZINC001235851514 1054824068 /nfs/dbraw/zinc/82/40/68/1054824068.db2.gz ZOJNFRXDHIKOCL-UHFFFAOYSA-N 1 2 323.874 4.347 20 0 DIADLO Cc1nc2cc(C[N@@H+](C)Cc3cnc(Cl)s3)ccc2s1 ZINC001235851514 1054824077 /nfs/dbraw/zinc/82/40/77/1054824077.db2.gz ZOJNFRXDHIKOCL-UHFFFAOYSA-N 1 2 323.874 4.347 20 0 DIADLO Fc1ccc(C2([NH2+][C@H]3CCCc4scnc43)CCC2)c(F)c1 ZINC000623944996 1054831351 /nfs/dbraw/zinc/83/13/51/1054831351.db2.gz ZEDOQWGLRXIGNE-AWEZNQCLSA-N 1 2 320.408 4.468 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc(O)cc(Cl)c1 ZINC001235903735 1054839114 /nfs/dbraw/zinc/83/91/14/1054839114.db2.gz KHJHJCMRYVMEKA-UHFFFAOYSA-N 1 2 302.805 4.406 20 0 DIADLO CSc1cccc(F)c1C[NH2+][C@H]1CCCc2scnc21 ZINC000623981828 1054845174 /nfs/dbraw/zinc/84/51/74/1054845174.db2.gz WPHJJSSGVVLVMG-LBPRGKRZSA-N 1 2 308.447 4.171 20 0 DIADLO FC(F)(F)Oc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001235938067 1054856566 /nfs/dbraw/zinc/85/65/66/1054856566.db2.gz DJXVYXFWMZEQAO-UHFFFAOYSA-N 1 2 318.298 4.497 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CCc3cc(F)c(Cl)cc32)c1 ZINC000624008481 1054859163 /nfs/dbraw/zinc/85/91/63/1054859163.db2.gz ZAQOZVCOHNFWJO-HNNXBMFYSA-N 1 2 306.768 4.120 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(Cl)cc3Cl)nn2)c1C ZINC001235964291 1054874437 /nfs/dbraw/zinc/87/44/37/1054874437.db2.gz AKQNBPNZFFGYMC-UHFFFAOYSA-N 1 2 319.195 4.253 20 0 DIADLO CC[C@H]([NH2+]Cc1c(Cl)oc2ccccc21)c1ccn(C)n1 ZINC000624108776 1054878949 /nfs/dbraw/zinc/87/89/49/1054878949.db2.gz FAORQMAQIGEXJM-ZDUSSCGKSA-N 1 2 303.793 4.061 20 0 DIADLO CC[C@@H]([NH2+][C@H](CCc1ccccc1)C(F)F)c1ccncc1 ZINC000624124628 1054888020 /nfs/dbraw/zinc/88/80/20/1054888020.db2.gz HYKJANIQAJCZCC-IAGOWNOFSA-N 1 2 304.384 4.389 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@@H](c2cccc(F)c2)C(C)(C)C)n1 ZINC000181066897 1054901464 /nfs/dbraw/zinc/90/14/64/1054901464.db2.gz QVFIQSPIFZWNRG-KRWDZBQOSA-N 1 2 319.424 4.284 20 0 DIADLO C[C@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1ccc(F)cc1F ZINC000181580360 1054922279 /nfs/dbraw/zinc/92/22/79/1054922279.db2.gz CQQDCONNXXBHMO-VIFPVBQESA-N 1 2 306.287 4.096 20 0 DIADLO Nc1nccc(Cl)c1C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001236152652 1054971385 /nfs/dbraw/zinc/97/13/85/1054971385.db2.gz WAUQRKUCOXTXRV-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nccc(Cl)c1C[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001236152652 1054971395 /nfs/dbraw/zinc/97/13/95/1054971395.db2.gz WAUQRKUCOXTXRV-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO CCC(CC)n1nc(C)cc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000182260425 1054975977 /nfs/dbraw/zinc/97/59/77/1054975977.db2.gz AADJBFWDGMJRFT-UHFFFAOYSA-N 1 2 314.433 4.125 20 0 DIADLO C[N@H+](Cc1ccc2ccccc2c1)Cc1c(Cl)ccnc1N ZINC001236184436 1054985789 /nfs/dbraw/zinc/98/57/89/1054985789.db2.gz QHMPVRPQFQRLKK-UHFFFAOYSA-N 1 2 311.816 4.102 20 0 DIADLO C[N@@H+](Cc1ccc2ccccc2c1)Cc1c(Cl)ccnc1N ZINC001236184436 1054985803 /nfs/dbraw/zinc/98/58/03/1054985803.db2.gz QHMPVRPQFQRLKK-UHFFFAOYSA-N 1 2 311.816 4.102 20 0 DIADLO c1[nH]c2ccccc2c1[C@H]1CCCN1Cc1[nH+]cc2ccccn21 ZINC001236189668 1054988755 /nfs/dbraw/zinc/98/87/55/1054988755.db2.gz BTCQPCAOGXXOBF-LJQANCHMSA-N 1 2 316.408 4.153 20 0 DIADLO COc1cc(-c2cc(F)c(C[NH+](C)C)c(F)c2)cc(C)c1F ZINC001236205188 1054999968 /nfs/dbraw/zinc/99/99/68/1054999968.db2.gz BHPODLHBHAPZBB-UHFFFAOYSA-N 1 2 309.331 4.150 20 0 DIADLO COc1cccc([C@@H](C)Nc2ccc(-n3cc[nH+]c3)c(F)c2)c1 ZINC000182912818 1055016705 /nfs/dbraw/zinc/01/67/05/1055016705.db2.gz QCEMEHNWAZQTSH-CYBMUJFWSA-N 1 2 311.360 4.193 20 0 DIADLO CC(C)Cn1cc(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)cn1 ZINC000183050041 1055025297 /nfs/dbraw/zinc/02/52/97/1055025297.db2.gz RFSUQTHPSMMJFG-ZDUSSCGKSA-N 1 2 307.388 4.010 20 0 DIADLO CC(C)Cn1cc(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)cn1 ZINC000183050041 1055025309 /nfs/dbraw/zinc/02/53/09/1055025309.db2.gz RFSUQTHPSMMJFG-ZDUSSCGKSA-N 1 2 307.388 4.010 20 0 DIADLO CCCCCOc1cc(C)ccc1C[NH2+][C@H](C)c1nccn1C ZINC000183106511 1055028991 /nfs/dbraw/zinc/02/89/91/1055028991.db2.gz KQENKXAZSSHBDC-MRXNPFEDSA-N 1 2 315.461 4.148 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccc(F)cc1F)C(C)(C)C)c1nccn1C ZINC000183117312 1055029784 /nfs/dbraw/zinc/02/97/84/1055029784.db2.gz XORIUPQTKZXTFX-ABAIWWIYSA-N 1 2 307.388 4.136 20 0 DIADLO Fc1ccc(Br)c2[nH+]ccc(N3CCC[C@@H]4C[C@@H]43)c12 ZINC000672323797 1055034572 /nfs/dbraw/zinc/03/45/72/1055034572.db2.gz RROCAOSAKMFKBI-RNCFNFMXSA-N 1 2 321.193 4.125 20 0 DIADLO CC(=O)Nc1cccc(C[NH2+][C@H](c2ccco2)c2ccccc2)c1 ZINC000183353812 1055042182 /nfs/dbraw/zinc/04/21/82/1055042182.db2.gz HHSNRTVUHCDDDY-FQEVSTJZSA-N 1 2 320.392 4.117 20 0 DIADLO C=Cc1cccc(-c2cccc(Cl)c2C[NH+]2CCOCC2)c1 ZINC001236264493 1055043252 /nfs/dbraw/zinc/04/32/52/1055043252.db2.gz DFWBINGWFFYHIZ-UHFFFAOYSA-N 1 2 313.828 4.482 20 0 DIADLO CC(C)C(=O)Nc1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001236266904 1055045203 /nfs/dbraw/zinc/04/52/03/1055045203.db2.gz STGKHUCSJKHITG-UHFFFAOYSA-N 1 2 305.381 4.338 20 0 DIADLO CCc1noc(CC)c1C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000183707537 1055054491 /nfs/dbraw/zinc/05/44/91/1055054491.db2.gz GXRZRLSUBFNJHL-IBGZPJMESA-N 1 2 310.397 4.272 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2cccnc2)c(Br)c1 ZINC000183732011 1055057521 /nfs/dbraw/zinc/05/75/21/1055057521.db2.gz RLAVYOSYLPBYIW-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2cccnc2)c(Br)c1 ZINC000183732011 1055057532 /nfs/dbraw/zinc/05/75/32/1055057532.db2.gz RLAVYOSYLPBYIW-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO CCCOc1c(F)c(F)c(-c2ccc3[nH+]ccn3c2)c(F)c1F ZINC001236327556 1055058801 /nfs/dbraw/zinc/05/88/01/1055058801.db2.gz LRHMVHDIRUUZGO-UHFFFAOYSA-N 1 2 324.277 4.347 20 0 DIADLO CC(C)Oc1c(F)ccc(-c2[nH+]ccc3c2ccn3C)c1F ZINC001236338791 1055065902 /nfs/dbraw/zinc/06/59/02/1055065902.db2.gz NXPSPQUWPZNAPL-UHFFFAOYSA-N 1 2 302.324 4.306 20 0 DIADLO CC(C)Oc1cc(-c2ccn3cc(N)[nH+]c3c2)ccc1Cl ZINC001236410492 1055101836 /nfs/dbraw/zinc/10/18/36/1055101836.db2.gz PAXVLSYKRZMKBA-UHFFFAOYSA-N 1 2 301.777 4.024 20 0 DIADLO Clc1ccsc1C[N@@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000194353665 1055121571 /nfs/dbraw/zinc/12/15/71/1055121571.db2.gz PDKMDUWQOIGPDR-ZDUSSCGKSA-N 1 2 311.834 4.176 20 0 DIADLO Clc1ccsc1C[N@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000194353665 1055121579 /nfs/dbraw/zinc/12/15/79/1055121579.db2.gz PDKMDUWQOIGPDR-ZDUSSCGKSA-N 1 2 311.834 4.176 20 0 DIADLO Cc1ccc(NC(=O)C(CC(C)C)CC(C)C)c(N(C)C)[nH+]1 ZINC001536522604 1055121932 /nfs/dbraw/zinc/12/19/32/1055121932.db2.gz DIQXTBUNVRKYPY-UHFFFAOYSA-N 1 2 305.466 4.103 20 0 DIADLO CC/C(=C\C(=O)Nc1ccc(C)[nH+]c1N(C)C)c1ccc(C)cc1 ZINC001536522627 1055122050 /nfs/dbraw/zinc/12/20/50/1055122050.db2.gz DSAUVPJGLDBUQJ-DTQAZKPQSA-N 1 2 323.440 4.197 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1c(Br)ccnc1Cl ZINC001236598869 1055200431 /nfs/dbraw/zinc/20/04/31/1055200431.db2.gz RTQLYTBDHVOICO-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1c(Br)ccnc1Cl ZINC001236598869 1055200439 /nfs/dbraw/zinc/20/04/39/1055200439.db2.gz RTQLYTBDHVOICO-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO CCC1CC[NH+](Cc2c(Br)ccnc2Cl)CC1 ZINC001236585968 1055201731 /nfs/dbraw/zinc/20/17/31/1055201731.db2.gz FQVRMSRUYRUFTJ-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[NH+]1CCC(OC(C)C)CC1 ZINC001236605259 1055204278 /nfs/dbraw/zinc/20/42/78/1055204278.db2.gz OSOTUIQQKZAEDP-UHFFFAOYSA-N 1 2 317.260 4.086 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)[C@H]1C ZINC001236636873 1055209586 /nfs/dbraw/zinc/20/95/86/1055209586.db2.gz UZJVWWXNSLXKOS-ZJUUUORDSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)[C@H]1C ZINC001236636873 1055209597 /nfs/dbraw/zinc/20/95/97/1055209597.db2.gz UZJVWWXNSLXKOS-ZJUUUORDSA-N 1 2 306.759 4.374 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)n1 ZINC001236642870 1055211121 /nfs/dbraw/zinc/21/11/21/1055211121.db2.gz LTACQBNGDZPHHB-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCSC[C@@H]2c2ccccc2)n1 ZINC001236642870 1055211132 /nfs/dbraw/zinc/21/11/32/1055211132.db2.gz LTACQBNGDZPHHB-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Fc1c(Cl)cc(C[N@@H+]2CC[C@H]3CCCO[C@@H]3C2)cc1Cl ZINC001236651532 1055213073 /nfs/dbraw/zinc/21/30/73/1055213073.db2.gz LJRCEIHRXKGMJM-BXUZGUMPSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1c(Cl)cc(C[N@H+]2CC[C@H]3CCCO[C@@H]3C2)cc1Cl ZINC001236651532 1055213082 /nfs/dbraw/zinc/21/30/82/1055213082.db2.gz LJRCEIHRXKGMJM-BXUZGUMPSA-N 1 2 318.219 4.133 20 0 DIADLO CCOc1ncc(C[N@H+](C)[C@H](C)c2ccccc2Cl)cc1F ZINC001236696160 1055233189 /nfs/dbraw/zinc/23/31/89/1055233189.db2.gz HZSHDLQSFTXSNH-GFCCVEGCSA-N 1 2 322.811 4.466 20 0 DIADLO CCOc1ncc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)cc1F ZINC001236696160 1055233206 /nfs/dbraw/zinc/23/32/06/1055233206.db2.gz HZSHDLQSFTXSNH-GFCCVEGCSA-N 1 2 322.811 4.466 20 0 DIADLO CCOc1ncc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1F ZINC001236691727 1055234067 /nfs/dbraw/zinc/23/40/67/1055234067.db2.gz ZNVQDABIBMFDEP-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ncc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1F ZINC001236691727 1055234083 /nfs/dbraw/zinc/23/40/83/1055234083.db2.gz ZNVQDABIBMFDEP-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)ccc1F ZINC001236706373 1055235679 /nfs/dbraw/zinc/23/56/79/1055235679.db2.gz WTNFOFZQDQBEEO-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)ccc1F ZINC001236706373 1055235694 /nfs/dbraw/zinc/23/56/94/1055235694.db2.gz WTNFOFZQDQBEEO-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO Fc1cc(OC(F)F)ccc1C[N@@H+]1CCc2sccc2C1 ZINC001236716909 1055238495 /nfs/dbraw/zinc/23/84/95/1055238495.db2.gz ALAMOGJBQSQVAO-UHFFFAOYSA-N 1 2 313.344 4.047 20 0 DIADLO Fc1cc(OC(F)F)ccc1C[N@H+]1CCc2sccc2C1 ZINC001236716909 1055238506 /nfs/dbraw/zinc/23/85/06/1055238506.db2.gz ALAMOGJBQSQVAO-UHFFFAOYSA-N 1 2 313.344 4.047 20 0 DIADLO Cc1cccc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c1Cl ZINC001236851051 1055291191 /nfs/dbraw/zinc/29/11/91/1055291191.db2.gz BJQWKKYJZMZOOL-QGZVFWFLSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1cccc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)c1Cl ZINC001236851051 1055291205 /nfs/dbraw/zinc/29/12/05/1055291205.db2.gz BJQWKKYJZMZOOL-QGZVFWFLSA-N 1 2 301.817 4.222 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2cccc(C)c2Cl)c1OC ZINC001236859344 1055294491 /nfs/dbraw/zinc/29/44/91/1055294491.db2.gz SSMTVLPIEQNUGS-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2cccc(C)c2Cl)c1OC ZINC001236859344 1055294507 /nfs/dbraw/zinc/29/45/07/1055294507.db2.gz SSMTVLPIEQNUGS-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO Clc1ccc(Cl)c(COc2cccc(-n3cc[nH+]c3)c2)n1 ZINC000764936719 1055299304 /nfs/dbraw/zinc/29/93/04/1055299304.db2.gz GXGVPDCZPMKFTG-UHFFFAOYSA-N 1 2 320.179 4.153 20 0 DIADLO C[N@H+](Cc1cccc(O)c1)Cc1nc2ccccc2cc1Cl ZINC001236869286 1055299651 /nfs/dbraw/zinc/29/96/51/1055299651.db2.gz CBTTWDXUQWEHBP-UHFFFAOYSA-N 1 2 312.800 4.226 20 0 DIADLO C[N@@H+](Cc1cccc(O)c1)Cc1nc2ccccc2cc1Cl ZINC001236869286 1055299657 /nfs/dbraw/zinc/29/96/57/1055299657.db2.gz CBTTWDXUQWEHBP-UHFFFAOYSA-N 1 2 312.800 4.226 20 0 DIADLO Cc1ccc(Cl)c(NCc2cc[nH+]c(N3CCCCC3)c2)n1 ZINC000765000601 1055312337 /nfs/dbraw/zinc/31/23/37/1055312337.db2.gz HSDOYFWWXFHKTK-UHFFFAOYSA-N 1 2 316.836 4.041 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2ccc(-c3ccccc3F)nc2)C[C@H]1F ZINC001236987381 1055323727 /nfs/dbraw/zinc/32/37/27/1055323727.db2.gz LGDRBMMAVTWDPG-QZTJIDSGSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2ccc(-c3ccccc3F)nc2)C[C@H]1F ZINC001236987381 1055323744 /nfs/dbraw/zinc/32/37/44/1055323744.db2.gz LGDRBMMAVTWDPG-QZTJIDSGSA-N 1 2 320.358 4.160 20 0 DIADLO Cc1ccc(-c2cncc(C[N@@H+]3CC[C@@](C)(F)[C@H](F)C3)c2)cc1 ZINC001236990744 1055329704 /nfs/dbraw/zinc/32/97/04/1055329704.db2.gz HLFMNDWEKUAZMK-RTBURBONSA-N 1 2 316.395 4.329 20 0 DIADLO Cc1ccc(-c2cncc(C[N@H+]3CC[C@@](C)(F)[C@H](F)C3)c2)cc1 ZINC001236990744 1055329719 /nfs/dbraw/zinc/32/97/19/1055329719.db2.gz HLFMNDWEKUAZMK-RTBURBONSA-N 1 2 316.395 4.329 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2cncc(-c3ccc(F)cc3)c2)C[C@H]1F ZINC001236998327 1055333140 /nfs/dbraw/zinc/33/31/40/1055333140.db2.gz WNOXZBSKGJBGQX-MSOLQXFVSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2cncc(-c3ccc(F)cc3)c2)C[C@H]1F ZINC001236998327 1055333154 /nfs/dbraw/zinc/33/31/54/1055333154.db2.gz WNOXZBSKGJBGQX-MSOLQXFVSA-N 1 2 320.358 4.160 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccccc2OC(C)(C)C)no1 ZINC001237027789 1055346007 /nfs/dbraw/zinc/34/60/07/1055346007.db2.gz UANQPZVVCPMRGT-KRWDZBQOSA-N 1 2 314.429 4.497 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccccc2OC(C)(C)C)no1 ZINC001237027789 1055346024 /nfs/dbraw/zinc/34/60/24/1055346024.db2.gz UANQPZVVCPMRGT-KRWDZBQOSA-N 1 2 314.429 4.497 20 0 DIADLO Cc1c(CNc2ccn3cc[nH+]c3c2)cccc1C(F)(F)F ZINC001168538598 1055348225 /nfs/dbraw/zinc/34/82/25/1055348225.db2.gz IXTSSFHAADTLBT-UHFFFAOYSA-N 1 2 305.303 4.274 20 0 DIADLO Cc1cc(NC(=O)Cc2ccc(C3CCCCC3)cc2)cc[nH+]1 ZINC001537535491 1055352269 /nfs/dbraw/zinc/35/22/69/1055352269.db2.gz SDSSDJTYXCJBAX-UHFFFAOYSA-N 1 2 308.425 4.041 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccnc(Cl)c1 ZINC000765333145 1055363531 /nfs/dbraw/zinc/36/35/31/1055363531.db2.gz LSSZTOLYVVXNFM-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO CC[C@H]([NH2+]Cc1nccn1CC)c1ccc(Cl)cc1Cl ZINC000385449500 1055374377 /nfs/dbraw/zinc/37/43/77/1055374377.db2.gz JAXNUJUDICQORO-AWEZNQCLSA-N 1 2 312.244 4.451 20 0 DIADLO COc1cccc2c(C[N@@H+]3Cc4ccc(Cl)cc4C3)ccnc12 ZINC001237112163 1055376859 /nfs/dbraw/zinc/37/68/59/1055376859.db2.gz PVINMEQULUUCBB-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO COc1cccc2c(C[N@H+]3Cc4ccc(Cl)cc4C3)ccnc12 ZINC001237112163 1055376869 /nfs/dbraw/zinc/37/68/69/1055376869.db2.gz PVINMEQULUUCBB-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccnc3c(Cl)cccc13)C2 ZINC001237147580 1055383366 /nfs/dbraw/zinc/38/33/66/1055383366.db2.gz ZOWKTSNWDDLUHM-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccnc3c(Cl)cccc13)C2 ZINC001237147580 1055383379 /nfs/dbraw/zinc/38/33/79/1055383379.db2.gz ZOWKTSNWDDLUHM-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO CC(C)[C@@](C)(Cc1ccccc1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001587889660 1055391237 /nfs/dbraw/zinc/39/12/37/1055391237.db2.gz KYGRULLNYMKPCR-HXUWFJFHSA-N 1 2 321.424 4.178 20 0 DIADLO CCCCC1CCC(NC(=O)NCc2cc(C)[nH+]c(C)c2)CC1 ZINC001563733994 1055398882 /nfs/dbraw/zinc/39/88/82/1055398882.db2.gz LNFMKVZYJMUESM-UHFFFAOYSA-N 1 2 317.477 4.247 20 0 DIADLO c1coc([C@H]([NH2+]Cc2cnn(C3CCC3)c2)c2ccccc2)c1 ZINC000921513233 1055401394 /nfs/dbraw/zinc/40/13/94/1055401394.db2.gz QODOVANSQSOPPD-LJQANCHMSA-N 1 2 307.397 4.080 20 0 DIADLO CCOC(=O)C[N@H+](C)Cc1ccc2sc3ccccc3c2c1 ZINC001237201440 1055405010 /nfs/dbraw/zinc/40/50/10/1055405010.db2.gz VHOZDDJSHMBIKC-UHFFFAOYSA-N 1 2 313.422 4.049 20 0 DIADLO CCOC(=O)C[N@@H+](C)Cc1ccc2sc3ccccc3c2c1 ZINC001237201440 1055405018 /nfs/dbraw/zinc/40/50/18/1055405018.db2.gz VHOZDDJSHMBIKC-UHFFFAOYSA-N 1 2 313.422 4.049 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2cc(C)on2)ccc1C(F)F ZINC001237276058 1055416390 /nfs/dbraw/zinc/41/63/90/1055416390.db2.gz JESIRQLOLXPYDO-HNNXBMFYSA-N 1 2 322.355 4.266 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2cc(C)on2)ccc1C(F)F ZINC001237276058 1055416396 /nfs/dbraw/zinc/41/63/96/1055416396.db2.gz JESIRQLOLXPYDO-HNNXBMFYSA-N 1 2 322.355 4.266 20 0 DIADLO c1ccc(CCc2ccccc2C[N@@H+]2Cc3cccnc3C2)cc1 ZINC001237299653 1055421414 /nfs/dbraw/zinc/42/14/14/1055421414.db2.gz WAPPEZPYYFTCNT-UHFFFAOYSA-N 1 2 314.432 4.383 20 0 DIADLO c1ccc(CCc2ccccc2C[N@H+]2Cc3cccnc3C2)cc1 ZINC001237299653 1055421418 /nfs/dbraw/zinc/42/14/18/1055421418.db2.gz WAPPEZPYYFTCNT-UHFFFAOYSA-N 1 2 314.432 4.383 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@H]2c2cccs2)nc1 ZINC000171959108 1055426412 /nfs/dbraw/zinc/42/64/12/1055426412.db2.gz LKSKNJSYJMMBLV-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@H]2c2cccs2)nc1 ZINC000171959108 1055426417 /nfs/dbraw/zinc/42/64/17/1055426417.db2.gz LKSKNJSYJMMBLV-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO COc1ccc(-c2nc(C[N@H+](C)C3CC(F)(F)C3)cs2)cc1 ZINC001237339054 1055431431 /nfs/dbraw/zinc/43/14/31/1055431431.db2.gz HBVVOCHDDVGOLD-UHFFFAOYSA-N 1 2 324.396 4.048 20 0 DIADLO COc1ccc(-c2nc(C[N@@H+](C)C3CC(F)(F)C3)cs2)cc1 ZINC001237339054 1055431434 /nfs/dbraw/zinc/43/14/34/1055431434.db2.gz HBVVOCHDDVGOLD-UHFFFAOYSA-N 1 2 324.396 4.048 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC001237405064 1055448054 /nfs/dbraw/zinc/44/80/54/1055448054.db2.gz PNNKGTUFHDODKT-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC001237405064 1055448056 /nfs/dbraw/zinc/44/80/56/1055448056.db2.gz PNNKGTUFHDODKT-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO C[N@H+](Cc1nc(-c2ccccc2Cl)no1)Cc1ccccc1 ZINC000016333891 1055455436 /nfs/dbraw/zinc/45/54/36/1055455436.db2.gz MLRCDVFIFOMABR-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccccc2Cl)no1)Cc1ccccc1 ZINC000016333891 1055455445 /nfs/dbraw/zinc/45/54/45/1055455445.db2.gz MLRCDVFIFOMABR-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1c(F)ccc(Br)c1F ZINC000230341225 1055455977 /nfs/dbraw/zinc/45/59/77/1055455977.db2.gz NVCPTAVVMRCEIY-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1c(F)ccc(Br)c1F ZINC000230341225 1055455981 /nfs/dbraw/zinc/45/59/81/1055455981.db2.gz NVCPTAVVMRCEIY-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1cn2cc(Cl)ccc2n1 ZINC000016420979 1055456780 /nfs/dbraw/zinc/45/67/80/1055456780.db2.gz MVPMZBYASWKQAK-NSHDSACASA-N 1 2 317.845 4.169 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1cn2cc(Cl)ccc2n1 ZINC000016420979 1055456789 /nfs/dbraw/zinc/45/67/89/1055456789.db2.gz MVPMZBYASWKQAK-NSHDSACASA-N 1 2 317.845 4.169 20 0 DIADLO Oc1c(C[N@@H+]2CC[C@@H](c3ccccc3)C2)cc(Cl)nc1Cl ZINC001237527357 1055467402 /nfs/dbraw/zinc/46/74/02/1055467402.db2.gz XPFMAZJTEFZAHO-GFCCVEGCSA-N 1 2 323.223 4.084 20 0 DIADLO Oc1c(C[N@H+]2CC[C@@H](c3ccccc3)C2)cc(Cl)nc1Cl ZINC001237527357 1055467406 /nfs/dbraw/zinc/46/74/06/1055467406.db2.gz XPFMAZJTEFZAHO-GFCCVEGCSA-N 1 2 323.223 4.084 20 0 DIADLO Oc1c(C[N@H+]2CCC[C@H]2c2ccccc2)cc(Cl)nc1Cl ZINC001237534694 1055469079 /nfs/dbraw/zinc/46/90/79/1055469079.db2.gz LYMAZLCIRBYYCR-ZDUSSCGKSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1c(C[N@@H+]2CCC[C@H]2c2ccccc2)cc(Cl)nc1Cl ZINC001237534694 1055469071 /nfs/dbraw/zinc/46/90/71/1055469071.db2.gz LYMAZLCIRBYYCR-ZDUSSCGKSA-N 1 2 323.223 4.431 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cccc(-c3ccccc3)n2)no1 ZINC001237542231 1055469197 /nfs/dbraw/zinc/46/91/97/1055469197.db2.gz FDWVEUWNZFAADZ-FQEVSTJZSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cccc(-c3ccccc3)n2)no1 ZINC001237542231 1055469201 /nfs/dbraw/zinc/46/92/01/1055469201.db2.gz FDWVEUWNZFAADZ-FQEVSTJZSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccccc1C[N@@H+](C)Cc1cc(Cl)nc(Cl)c1O ZINC001237535094 1055469447 /nfs/dbraw/zinc/46/94/47/1055469447.db2.gz OUJLDNUDSOHADR-UHFFFAOYSA-N 1 2 311.212 4.034 20 0 DIADLO Cc1ccccc1C[N@H+](C)Cc1cc(Cl)nc(Cl)c1O ZINC001237535094 1055469451 /nfs/dbraw/zinc/46/94/51/1055469451.db2.gz OUJLDNUDSOHADR-UHFFFAOYSA-N 1 2 311.212 4.034 20 0 DIADLO C[N@H+](C/C=C/c1ccccc1)Cc1cc(Cl)nc(Cl)c1O ZINC001237538861 1055470468 /nfs/dbraw/zinc/47/04/68/1055470468.db2.gz NRBQXWNDNSLFLC-VMPITWQZSA-N 1 2 323.223 4.239 20 0 DIADLO C[N@@H+](C/C=C/c1ccccc1)Cc1cc(Cl)nc(Cl)c1O ZINC001237538861 1055470474 /nfs/dbraw/zinc/47/04/74/1055470474.db2.gz NRBQXWNDNSLFLC-VMPITWQZSA-N 1 2 323.223 4.239 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2cccc(-c3ccccc3)n2)C[C@H]1F ZINC001237543736 1055471490 /nfs/dbraw/zinc/47/14/90/1055471490.db2.gz ZLCXKOJGVVRKGY-QZTJIDSGSA-N 1 2 302.368 4.021 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2cccc(-c3ccccc3)n2)C[C@H]1F ZINC001237543736 1055471495 /nfs/dbraw/zinc/47/14/95/1055471495.db2.gz ZLCXKOJGVVRKGY-QZTJIDSGSA-N 1 2 302.368 4.021 20 0 DIADLO COc1ccc(OC)c(C[N@H+](C)Cc2cccc(Cl)c2)c1F ZINC001237571006 1055474868 /nfs/dbraw/zinc/47/48/68/1055474868.db2.gz FGTGORMLTBJGMO-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(OC)c(C[N@@H+](C)Cc2cccc(Cl)c2)c1F ZINC001237571006 1055474880 /nfs/dbraw/zinc/47/48/80/1055474880.db2.gz FGTGORMLTBJGMO-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2c(F)c(OC)ccc2OC)cc1 ZINC001237579494 1055475906 /nfs/dbraw/zinc/47/59/06/1055475906.db2.gz FOFPTJZMZCOKCQ-UHFFFAOYSA-N 1 2 317.404 4.037 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2c(F)c(OC)ccc2OC)cc1 ZINC001237579494 1055475913 /nfs/dbraw/zinc/47/59/13/1055475913.db2.gz FOFPTJZMZCOKCQ-UHFFFAOYSA-N 1 2 317.404 4.037 20 0 DIADLO Cc1c(C[N@@H+](C)Cc2ncccn2)cccc1-c1ccccc1 ZINC001237580798 1055477026 /nfs/dbraw/zinc/47/70/26/1055477026.db2.gz ISZNGSQJCSNVJR-UHFFFAOYSA-N 1 2 303.409 4.084 20 0 DIADLO Cc1c(C[N@H+](C)Cc2ncccn2)cccc1-c1ccccc1 ZINC001237580798 1055477034 /nfs/dbraw/zinc/47/70/34/1055477034.db2.gz ISZNGSQJCSNVJR-UHFFFAOYSA-N 1 2 303.409 4.084 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1)Cc1c(F)c(OC)ccc1OC ZINC001237580457 1055477509 /nfs/dbraw/zinc/47/75/09/1055477509.db2.gz LZHYRIRXFXLLKM-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1)Cc1c(F)c(OC)ccc1OC ZINC001237580457 1055477516 /nfs/dbraw/zinc/47/75/16/1055477516.db2.gz LZHYRIRXFXLLKM-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@H+](Cc1ccc(F)cc1)Cc1c(F)c(OC)ccc1OC ZINC001237581532 1055478599 /nfs/dbraw/zinc/47/85/99/1055478599.db2.gz SDCCPDVDSAMZTD-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1ccc(F)cc1)Cc1c(F)c(OC)ccc1OC ZINC001237581532 1055478608 /nfs/dbraw/zinc/47/86/08/1055478608.db2.gz SDCCPDVDSAMZTD-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO COC[C@@H]1CCCC[N@@H+]1Cc1c(Cl)cc(F)cc1Cl ZINC001237590690 1055479651 /nfs/dbraw/zinc/47/96/51/1055479651.db2.gz AWIJUDNIYQGPGU-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO COC[C@@H]1CCCC[N@H+]1Cc1c(Cl)cc(F)cc1Cl ZINC001237590690 1055479661 /nfs/dbraw/zinc/47/96/61/1055479661.db2.gz AWIJUDNIYQGPGU-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO C[N@H+](CCc1ccccn1)Cc1c(Cl)cc(F)cc1Cl ZINC001237590698 1055479798 /nfs/dbraw/zinc/47/97/98/1055479798.db2.gz AXOIIWOUBQKMHA-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1ccccn1)Cc1c(Cl)cc(F)cc1Cl ZINC001237590698 1055479801 /nfs/dbraw/zinc/47/98/01/1055479801.db2.gz AXOIIWOUBQKMHA-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO Fc1ccc(F)c(CNc2cccc(-n3cc[nH+]c3)c2)c1Cl ZINC001620853543 1055480771 /nfs/dbraw/zinc/48/07/71/1055480771.db2.gz KMNXUMCHVSDECT-UHFFFAOYSA-N 1 2 319.742 4.416 20 0 DIADLO COc1ccc(OC)c(C[N@H+](C)Cc2ccc(Cl)cc2)c1F ZINC001237586626 1055481073 /nfs/dbraw/zinc/48/10/73/1055481073.db2.gz XEBOMURCVVSOJK-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(OC)c(C[N@@H+](C)Cc2ccc(Cl)cc2)c1F ZINC001237586626 1055481082 /nfs/dbraw/zinc/48/10/82/1055481082.db2.gz XEBOMURCVVSOJK-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO Oc1ccc(-c2ccc(C[N@@H+]3CCC(F)(F)[C@H](F)C3)cc2)cc1 ZINC001237658024 1055492807 /nfs/dbraw/zinc/49/28/07/1055492807.db2.gz OTVYACZEXMWAPE-QGZVFWFLSA-N 1 2 321.342 4.238 20 0 DIADLO Oc1ccc(-c2ccc(C[N@H+]3CCC(F)(F)[C@H](F)C3)cc2)cc1 ZINC001237658024 1055492813 /nfs/dbraw/zinc/49/28/13/1055492813.db2.gz OTVYACZEXMWAPE-QGZVFWFLSA-N 1 2 321.342 4.238 20 0 DIADLO CCc1[nH]ncc1C[N@@H+](CC)Cc1cccc(C(F)(F)F)c1 ZINC001237653907 1055493369 /nfs/dbraw/zinc/49/33/69/1055493369.db2.gz SWXOPUJFBIMMPJ-UHFFFAOYSA-N 1 2 311.351 4.013 20 0 DIADLO CCc1[nH]ncc1C[N@H+](CC)Cc1cccc(C(F)(F)F)c1 ZINC001237653907 1055493379 /nfs/dbraw/zinc/49/33/79/1055493379.db2.gz SWXOPUJFBIMMPJ-UHFFFAOYSA-N 1 2 311.351 4.013 20 0 DIADLO C[N@H+](Cc1nccs1)Cc1ccc(-c2ccc(O)cc2)cc1 ZINC001237664590 1055501199 /nfs/dbraw/zinc/50/11/99/1055501199.db2.gz GEWXCVZMSDKPGF-UHFFFAOYSA-N 1 2 310.422 4.148 20 0 DIADLO C[N@@H+](Cc1nccs1)Cc1ccc(-c2ccc(O)cc2)cc1 ZINC001237664590 1055501210 /nfs/dbraw/zinc/50/12/10/1055501210.db2.gz GEWXCVZMSDKPGF-UHFFFAOYSA-N 1 2 310.422 4.148 20 0 DIADLO Cc1cc(C)c(Cl)c(C[N@@H+]2CCC(=O)[C@H]3CCCC[C@@H]32)c1 ZINC001237698958 1055507776 /nfs/dbraw/zinc/50/77/76/1055507776.db2.gz SEFSICWEBNKILU-HOTGVXAUSA-N 1 2 305.849 4.290 20 0 DIADLO Cc1cc(C)c(Cl)c(C[N@H+]2CCC(=O)[C@H]3CCCC[C@@H]32)c1 ZINC001237698958 1055507791 /nfs/dbraw/zinc/50/77/91/1055507791.db2.gz SEFSICWEBNKILU-HOTGVXAUSA-N 1 2 305.849 4.290 20 0 DIADLO COCC[N@@H+](C)Cc1c(Cl)cc(C(F)(F)F)cc1Cl ZINC001237723899 1055516430 /nfs/dbraw/zinc/51/64/30/1055516430.db2.gz CFWAHSPKMIRFLO-UHFFFAOYSA-N 1 2 316.150 4.090 20 0 DIADLO COCC[N@H+](C)Cc1c(Cl)cc(C(F)(F)F)cc1Cl ZINC001237723899 1055516419 /nfs/dbraw/zinc/51/64/19/1055516419.db2.gz CFWAHSPKMIRFLO-UHFFFAOYSA-N 1 2 316.150 4.090 20 0 DIADLO CC[C@@H]1CCC[N@H+](Cc2ncc(Cl)cc2Br)C1 ZINC001237766726 1055526355 /nfs/dbraw/zinc/52/63/55/1055526355.db2.gz JBJZJPUSJCICQH-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@@H]1CCC[N@@H+](Cc2ncc(Cl)cc2Br)C1 ZINC001237766726 1055526372 /nfs/dbraw/zinc/52/63/72/1055526372.db2.gz JBJZJPUSJCICQH-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c(Cl)n1 ZINC001237801788 1055531974 /nfs/dbraw/zinc/53/19/74/1055531974.db2.gz GOSSAZWWLBOZGY-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c(Cl)n1 ZINC001237801788 1055531987 /nfs/dbraw/zinc/53/19/87/1055531987.db2.gz GOSSAZWWLBOZGY-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1cnc(C[N@@H+](C)C(c2ccccc2)c2ccccc2)nc1 ZINC001237802147 1055534261 /nfs/dbraw/zinc/53/42/61/1055534261.db2.gz VKCQABMTGVOHSQ-UHFFFAOYSA-N 1 2 303.409 4.006 20 0 DIADLO Cc1cnc(C[N@H+](C)C(c2ccccc2)c2ccccc2)nc1 ZINC001237802147 1055534277 /nfs/dbraw/zinc/53/42/77/1055534277.db2.gz VKCQABMTGVOHSQ-UHFFFAOYSA-N 1 2 303.409 4.006 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)ccc1F ZINC001237823588 1055536995 /nfs/dbraw/zinc/53/69/95/1055536995.db2.gz JGKLRNNTSWCNSH-QGZVFWFLSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)ccc1F ZINC001237823588 1055537005 /nfs/dbraw/zinc/53/70/05/1055537005.db2.gz JGKLRNNTSWCNSH-QGZVFWFLSA-N 1 2 306.331 4.144 20 0 DIADLO C[C@H]1CCC[N@@H+]1Cc1ccc(Br)c(Cl)c1F ZINC001237890278 1055551512 /nfs/dbraw/zinc/55/15/12/1055551512.db2.gz WAIFJVCRWAZODJ-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@H]1CCC[N@H+]1Cc1ccc(Br)c(Cl)c1F ZINC001237890278 1055551524 /nfs/dbraw/zinc/55/15/24/1055551524.db2.gz WAIFJVCRWAZODJ-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO CCOC(=O)c1ccccc1C[N@H+](CC)Cc1ccccc1F ZINC001237893038 1055551658 /nfs/dbraw/zinc/55/16/58/1055551658.db2.gz STIGNVXWPZMADI-UHFFFAOYSA-N 1 2 315.388 4.025 20 0 DIADLO CCOC(=O)c1ccccc1C[N@@H+](CC)Cc1ccccc1F ZINC001237893038 1055551673 /nfs/dbraw/zinc/55/16/73/1055551673.db2.gz STIGNVXWPZMADI-UHFFFAOYSA-N 1 2 315.388 4.025 20 0 DIADLO CC(C)(C)[C@H](CO)Nc1[nH+]ccc2cccc(C(F)(F)F)c21 ZINC001168552699 1055563999 /nfs/dbraw/zinc/56/39/99/1055563999.db2.gz OZDQRHWSJRYDMI-LBPRGKRZSA-N 1 2 312.335 4.073 20 0 DIADLO Clc1cccc(-c2nc(C[NH+]3CC4(CCC4)C3)cs2)c1 ZINC001237984152 1055573548 /nfs/dbraw/zinc/57/35/48/1055573548.db2.gz LRYUBNOGDZRKBY-UHFFFAOYSA-N 1 2 304.846 4.449 20 0 DIADLO Oc1c(F)cc(C[NH+]2CCC3(CC[C@H](F)C3)CC2)cc1Cl ZINC001237992975 1055576600 /nfs/dbraw/zinc/57/66/00/1055576600.db2.gz NZLFEKKFKMHIGP-LBPRGKRZSA-N 1 2 315.791 4.289 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cc(F)c(O)c(Cl)c2)cc1C ZINC001237993927 1055577293 /nfs/dbraw/zinc/57/72/93/1055577293.db2.gz WEYINLSJAASYAN-UHFFFAOYSA-N 1 2 307.796 4.434 20 0 DIADLO C[N@H+](CCCc1ccccc1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237990583 1055577808 /nfs/dbraw/zinc/57/78/08/1055577808.db2.gz VWIYISKYLJHGNC-UHFFFAOYSA-N 1 2 307.796 4.249 20 0 DIADLO C[N@@H+](CCCc1ccccc1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237990583 1055577820 /nfs/dbraw/zinc/57/78/20/1055577820.db2.gz VWIYISKYLJHGNC-UHFFFAOYSA-N 1 2 307.796 4.249 20 0 DIADLO Oc1c(F)cc(C[N@@H+]2CC[C@@H](c3ccc(F)cc3)C2)cc1Cl ZINC001237997952 1055578599 /nfs/dbraw/zinc/57/85/99/1055578599.db2.gz PLKCNWJNQAQQRQ-CYBMUJFWSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)cc1Cl ZINC001237997952 1055578612 /nfs/dbraw/zinc/57/86/12/1055578612.db2.gz PLKCNWJNQAQQRQ-CYBMUJFWSA-N 1 2 323.770 4.313 20 0 DIADLO Cc1cc(Br)ccc1C[NH2+]C1(C(F)F)CCCC1 ZINC001620955960 1055579376 /nfs/dbraw/zinc/57/93/76/1055579376.db2.gz ALJYSIAKWPBUTC-UHFFFAOYSA-N 1 2 318.205 4.425 20 0 DIADLO Fc1ccc(C[NH2+]C2(C(F)F)CCCC2)cc1Br ZINC001620956079 1055579743 /nfs/dbraw/zinc/57/97/43/1055579743.db2.gz GGCODTFJPMHEQE-UHFFFAOYSA-N 1 2 322.168 4.256 20 0 DIADLO CCCCc1ccc(C(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)cc1 ZINC001595322562 1055586410 /nfs/dbraw/zinc/58/64/10/1055586410.db2.gz ZQUJOLMFRCPIGN-UHFFFAOYSA-N 1 2 307.397 4.466 20 0 DIADLO C/C(=C\c1ccc(C)cc1)C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC001595394831 1055593675 /nfs/dbraw/zinc/59/36/75/1055593675.db2.gz ASXOHMPBPCKLRO-DTQAZKPQSA-N 1 2 317.392 4.223 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1C[N@H+]1CCC(=O)C[C@H]1C ZINC001238059178 1055593779 /nfs/dbraw/zinc/59/37/79/1055593779.db2.gz DEJGYWIZWQGILU-MRXNPFEDSA-N 1 2 309.409 4.341 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1C[N@@H+]1CCC(=O)C[C@H]1C ZINC001238059178 1055593791 /nfs/dbraw/zinc/59/37/91/1055593791.db2.gz DEJGYWIZWQGILU-MRXNPFEDSA-N 1 2 309.409 4.341 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@H]3C[C@@H](C)CC(C)(C)C3)ccn12 ZINC001595397650 1055594223 /nfs/dbraw/zinc/59/42/23/1055594223.db2.gz DMNJJRHKYSYXCC-DOMZBBRYSA-N 1 2 300.402 4.014 20 0 DIADLO c1cc(C[NH+]2CC3(C2)CCCO3)cc(OCC2CCCCC2)c1 ZINC001238068121 1055601173 /nfs/dbraw/zinc/60/11/73/1055601173.db2.gz WZMPMFPXBMYURM-UHFFFAOYSA-N 1 2 315.457 4.011 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@H]2CCCCC23CCCC3)c[nH+]1 ZINC001564807943 1055602996 /nfs/dbraw/zinc/60/29/96/1055602996.db2.gz ICUBDWNOWCDSOK-KRWDZBQOSA-N 1 2 315.461 4.001 20 0 DIADLO Fc1ccc(C[NH+]2CCCCCC2)c(F)c1Br ZINC001238079048 1055603057 /nfs/dbraw/zinc/60/30/57/1055603057.db2.gz UNZQQUVMRKNDNY-UHFFFAOYSA-N 1 2 304.178 4.103 20 0 DIADLO Cc1cc(C[N@@H+]2CCC(=O)[C@@H]3CCCC[C@@H]32)cc(C)c1Cl ZINC001238088996 1055603582 /nfs/dbraw/zinc/60/35/82/1055603582.db2.gz MQQCUXIQZDKCKW-CVEARBPZSA-N 1 2 305.849 4.290 20 0 DIADLO Cc1cc(C[N@H+]2CCC(=O)[C@@H]3CCCC[C@@H]32)cc(C)c1Cl ZINC001238088996 1055603586 /nfs/dbraw/zinc/60/35/86/1055603586.db2.gz MQQCUXIQZDKCKW-CVEARBPZSA-N 1 2 305.849 4.290 20 0 DIADLO CC(C)CCC1CCN(C(=O)[C@@H](CC(C)C)n2cc[nH+]c2)CC1 ZINC001595502956 1055604596 /nfs/dbraw/zinc/60/45/96/1055604596.db2.gz JJWUEPYXKCBYJN-GOSISDBHSA-N 1 2 319.493 4.145 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ncccn2)cc(C)c1Cl ZINC001238091795 1055606438 /nfs/dbraw/zinc/60/64/38/1055606438.db2.gz IQAJCFAIJZWNJU-OAHLLOKOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2ncccn2)cc(C)c1Cl ZINC001238091795 1055606443 /nfs/dbraw/zinc/60/64/43/1055606443.db2.gz IQAJCFAIJZWNJU-OAHLLOKOSA-N 1 2 301.821 4.084 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@H](c3ccccc3)C2)cc1Cl ZINC001238144850 1055612515 /nfs/dbraw/zinc/61/25/15/1055612515.db2.gz YDJBCGJEWAORIK-ZDUSSCGKSA-N 1 2 305.780 4.174 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@H](c3ccccc3)C2)cc1Cl ZINC001238144850 1055612528 /nfs/dbraw/zinc/61/25/28/1055612528.db2.gz YDJBCGJEWAORIK-ZDUSSCGKSA-N 1 2 305.780 4.174 20 0 DIADLO Cc1cccc(CC[N@@H+](C)Cc2cc(Cl)c(O)cc2F)c1 ZINC001238152736 1055615750 /nfs/dbraw/zinc/61/57/50/1055615750.db2.gz QGGWHZATLISFKU-UHFFFAOYSA-N 1 2 307.796 4.168 20 0 DIADLO Cc1cccc(CC[N@H+](C)Cc2cc(Cl)c(O)cc2F)c1 ZINC001238152736 1055615756 /nfs/dbraw/zinc/61/57/56/1055615756.db2.gz QGGWHZATLISFKU-UHFFFAOYSA-N 1 2 307.796 4.168 20 0 DIADLO Cc1cnc2c(c1)C[N@@H+](Cc1cccc(-c3cccs3)n1)CC2 ZINC001238214847 1055622097 /nfs/dbraw/zinc/62/20/97/1055622097.db2.gz AVQVAXJOCKJDMJ-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1cnc2c(c1)C[N@H+](Cc1cccc(-c3cccs3)n1)CC2 ZINC001238214847 1055622101 /nfs/dbraw/zinc/62/21/01/1055622101.db2.gz AVQVAXJOCKJDMJ-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO CNc1ccc(Nc2cc(F)c(C(F)(F)F)cc2F)c[nH+]1 ZINC001203458246 1055635809 /nfs/dbraw/zinc/63/58/09/1055635809.db2.gz HSHHDXRWFALLNA-UHFFFAOYSA-N 1 2 303.234 4.164 20 0 DIADLO C[C@@H]1CC[N@@H+]1Cc1c(F)c(F)ccc1OCc1ccccc1 ZINC001238301252 1055636056 /nfs/dbraw/zinc/63/60/56/1055636056.db2.gz TWKPTYJOODLBTP-CYBMUJFWSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@@H]1CC[N@H+]1Cc1c(F)c(F)ccc1OCc1ccccc1 ZINC001238301252 1055636064 /nfs/dbraw/zinc/63/60/64/1055636064.db2.gz TWKPTYJOODLBTP-CYBMUJFWSA-N 1 2 303.352 4.138 20 0 DIADLO CC(C)Oc1c(F)cccc1C[N@H+](C)Cc1ccccc1F ZINC001238327037 1055638306 /nfs/dbraw/zinc/63/83/06/1055638306.db2.gz JKASQDATOCLRBZ-UHFFFAOYSA-N 1 2 305.368 4.384 20 0 DIADLO CC(C)Oc1c(F)cccc1C[N@@H+](C)Cc1ccccc1F ZINC001238327037 1055638316 /nfs/dbraw/zinc/63/83/16/1055638316.db2.gz JKASQDATOCLRBZ-UHFFFAOYSA-N 1 2 305.368 4.384 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1c(Br)ccc(O)c1F ZINC001238307900 1055639431 /nfs/dbraw/zinc/63/94/31/1055639431.db2.gz YNYMQXUDOVJNOQ-UWVGGRQHSA-N 1 2 316.214 4.057 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@H+](C)Cc1ccc(C)cc1 ZINC001238339210 1055640891 /nfs/dbraw/zinc/64/08/91/1055640891.db2.gz MQPLOSMROZWJMI-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@@H+](C)Cc1ccc(C)cc1 ZINC001238339210 1055640896 /nfs/dbraw/zinc/64/08/96/1055640896.db2.gz MQPLOSMROZWJMI-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c(F)c1O ZINC001238358690 1055643154 /nfs/dbraw/zinc/64/31/54/1055643154.db2.gz RUWNPVGKHHGCJG-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c(F)c1O ZINC001238358690 1055643159 /nfs/dbraw/zinc/64/31/59/1055643159.db2.gz RUWNPVGKHHGCJG-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccccc2F)c(F)c1O ZINC001238361838 1055646192 /nfs/dbraw/zinc/64/61/92/1055646192.db2.gz YJXZFHABLRNHLI-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2ccccc2F)c(F)c1O ZINC001238361838 1055646195 /nfs/dbraw/zinc/64/61/95/1055646195.db2.gz YJXZFHABLRNHLI-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1c(Cl)cncc1Br ZINC001238391255 1055651524 /nfs/dbraw/zinc/65/15/24/1055651524.db2.gz QFBKNYHJRUOURU-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO CC1(C)CC[NH+](Cc2c(Cl)cncc2Br)CC1 ZINC001238389666 1055651562 /nfs/dbraw/zinc/65/15/62/1055651562.db2.gz BNUDGOUAEXDETR-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3c(O)cccc3C2)c(Cl)c1 ZINC001238396743 1055651650 /nfs/dbraw/zinc/65/16/50/1055651650.db2.gz YXTVZRBNMUYJBF-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3c(O)cccc3C2)c(Cl)c1 ZINC001238396743 1055651653 /nfs/dbraw/zinc/65/16/53/1055651653.db2.gz YXTVZRBNMUYJBF-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCC[N@H+](C)Cc1c(F)c(Cl)c(F)cc1Br ZINC001238404670 1055653607 /nfs/dbraw/zinc/65/36/07/1055653607.db2.gz WRDNJENXQASPLI-UHFFFAOYSA-N 1 2 312.585 4.223 20 0 DIADLO CCC[N@@H+](C)Cc1c(F)c(Cl)c(F)cc1Br ZINC001238404670 1055653608 /nfs/dbraw/zinc/65/36/08/1055653608.db2.gz WRDNJENXQASPLI-UHFFFAOYSA-N 1 2 312.585 4.223 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+]2CCOc3ccccc3C2)c1F ZINC001238428599 1055657824 /nfs/dbraw/zinc/65/78/24/1055657824.db2.gz YLQLBRSPQKWOHO-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO CC(C)Oc1cccc(C[N@H+]2CCOc3ccccc3C2)c1F ZINC001238428599 1055657826 /nfs/dbraw/zinc/65/78/26/1055657826.db2.gz YLQLBRSPQKWOHO-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1ncc(C)cc1C ZINC001238436491 1055661358 /nfs/dbraw/zinc/66/13/58/1055661358.db2.gz VWOWJACFXKRKHP-LJQANCHMSA-N 1 2 310.441 4.182 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ncc(C)cc1C ZINC001238436491 1055661363 /nfs/dbraw/zinc/66/13/63/1055661363.db2.gz VWOWJACFXKRKHP-LJQANCHMSA-N 1 2 310.441 4.182 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)cnc1F ZINC001238455519 1055663443 /nfs/dbraw/zinc/66/34/43/1055663443.db2.gz ZSEGEGNPANVMFY-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)cnc1F ZINC001238455519 1055663450 /nfs/dbraw/zinc/66/34/50/1055663450.db2.gz ZSEGEGNPANVMFY-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)Oc1cncc(C[N@@H+]2CCc3ccc(Cl)cc3C2)c1 ZINC001238462878 1055665953 /nfs/dbraw/zinc/66/59/53/1055665953.db2.gz RNUGSHHJJJQELZ-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO CC(C)Oc1cncc(C[N@H+]2CCc3ccc(Cl)cc3C2)c1 ZINC001238462878 1055665962 /nfs/dbraw/zinc/66/59/62/1055665962.db2.gz RNUGSHHJJJQELZ-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO COc1c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)ccc(F)c1F ZINC001238466261 1055666182 /nfs/dbraw/zinc/66/61/82/1055666182.db2.gz GKLYYRIJDKTDMT-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)ccc(F)c1F ZINC001238466261 1055666190 /nfs/dbraw/zinc/66/61/90/1055666190.db2.gz GKLYYRIJDKTDMT-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1c(Cl)n[nH]c1C1CC1 ZINC000921622486 1055668041 /nfs/dbraw/zinc/66/80/41/1055668041.db2.gz VRTBRBLDNBSUAF-UHFFFAOYSA-N 1 2 314.191 4.023 20 0 DIADLO COc1cnc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c(Cl)c1 ZINC001238486953 1055672028 /nfs/dbraw/zinc/67/20/28/1055672028.db2.gz GWJLIVMUUSWQIJ-KRWDZBQOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cnc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c(Cl)c1 ZINC001238486953 1055672031 /nfs/dbraw/zinc/67/20/31/1055672031.db2.gz GWJLIVMUUSWQIJ-KRWDZBQOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)Cc3cccs3)cs2)o1 ZINC000042121980 1055673759 /nfs/dbraw/zinc/67/37/59/1055673759.db2.gz WQRMXUJXEHIXQV-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)Cc3cccs3)cs2)o1 ZINC000042121980 1055673766 /nfs/dbraw/zinc/67/37/66/1055673766.db2.gz WQRMXUJXEHIXQV-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc(COC(C)C)cc3)cc2[nH+]1 ZINC000042060019 1055673986 /nfs/dbraw/zinc/67/39/86/1055673986.db2.gz XWVYXTOVNDZVET-UHFFFAOYSA-N 1 2 323.396 4.049 20 0 DIADLO C[C@H]1CC[N@@H+]1Cc1cc(F)c(OCc2ccccc2)cc1F ZINC001238512707 1055675469 /nfs/dbraw/zinc/67/54/69/1055675469.db2.gz WGHDUKKESALFKL-ZDUSSCGKSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@H]1CC[N@H+]1Cc1cc(F)c(OCc2ccccc2)cc1F ZINC001238512707 1055675473 /nfs/dbraw/zinc/67/54/73/1055675473.db2.gz WGHDUKKESALFKL-ZDUSSCGKSA-N 1 2 303.352 4.138 20 0 DIADLO Fc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)cc1C1CC1 ZINC001238510403 1055676155 /nfs/dbraw/zinc/67/61/55/1055676155.db2.gz DFTTYJWGOYXTOG-HXUWFJFHSA-N 1 2 311.400 4.277 20 0 DIADLO Fc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)cc1C1CC1 ZINC001238510403 1055676162 /nfs/dbraw/zinc/67/61/62/1055676162.db2.gz DFTTYJWGOYXTOG-HXUWFJFHSA-N 1 2 311.400 4.277 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccon2)ccc1Oc1ccccc1 ZINC001238522935 1055678563 /nfs/dbraw/zinc/67/85/63/1055678563.db2.gz IZTXNWCZSYVRFB-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccon2)ccc1Oc1ccccc1 ZINC001238522935 1055678570 /nfs/dbraw/zinc/67/85/70/1055678570.db2.gz IZTXNWCZSYVRFB-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1ccc(F)c(OC(C)C)c1F ZINC001238527350 1055681287 /nfs/dbraw/zinc/68/12/87/1055681287.db2.gz KMTRTNFUTJGPPY-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1ccc(F)c(OC(C)C)c1F ZINC001238527350 1055681295 /nfs/dbraw/zinc/68/12/95/1055681295.db2.gz KMTRTNFUTJGPPY-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@@H+]1Cc1cccc(-c2ccc(Cl)cn2)c1 ZINC001238635416 1055706142 /nfs/dbraw/zinc/70/61/42/1055706142.db2.gz RTKFEDAVSCADRA-HOTGVXAUSA-N 1 2 322.786 4.284 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@H+]1Cc1cccc(-c2ccc(Cl)cn2)c1 ZINC001238635416 1055706150 /nfs/dbraw/zinc/70/61/50/1055706150.db2.gz RTKFEDAVSCADRA-HOTGVXAUSA-N 1 2 322.786 4.284 20 0 DIADLO Fc1ncc(-c2ccccc2)cc1C[N@H+]1CCCC[C@H](F)C1 ZINC001238657685 1055709440 /nfs/dbraw/zinc/70/94/40/1055709440.db2.gz KDCOBADQXFRNSH-KRWDZBQOSA-N 1 2 302.368 4.212 20 0 DIADLO Fc1ncc(-c2ccccc2)cc1C[N@@H+]1CCCC[C@H](F)C1 ZINC001238657685 1055709451 /nfs/dbraw/zinc/70/94/51/1055709451.db2.gz KDCOBADQXFRNSH-KRWDZBQOSA-N 1 2 302.368 4.212 20 0 DIADLO C[C@@]1(F)CCC[N@H+](Cc2cc(-c3ccccc3)cnc2F)C1 ZINC001238660132 1055711433 /nfs/dbraw/zinc/71/14/33/1055711433.db2.gz ZVDYTZSHTWAVNO-GOSISDBHSA-N 1 2 302.368 4.212 20 0 DIADLO C[C@@]1(F)CCC[N@@H+](Cc2cc(-c3ccccc3)cnc2F)C1 ZINC001238660132 1055711443 /nfs/dbraw/zinc/71/14/43/1055711443.db2.gz ZVDYTZSHTWAVNO-GOSISDBHSA-N 1 2 302.368 4.212 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@@H+](Cc1ccco1)C1CC1 ZINC001238662049 1055712355 /nfs/dbraw/zinc/71/23/55/1055712355.db2.gz VBIKPAVCRARLGL-UHFFFAOYSA-N 1 2 307.340 4.121 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@H+](Cc1ccco1)C1CC1 ZINC001238662049 1055712348 /nfs/dbraw/zinc/71/23/48/1055712348.db2.gz VBIKPAVCRARLGL-UHFFFAOYSA-N 1 2 307.340 4.121 20 0 DIADLO CC1=C(Br)C[N@H+](C/C=C/c2ccc(F)cc2)CC1 ZINC001621288820 1055715848 /nfs/dbraw/zinc/71/58/48/1055715848.db2.gz VGTLXYHWBPINBD-NSCUHMNNSA-N 1 2 310.210 4.214 20 0 DIADLO CC1=C(Br)C[N@@H+](C/C=C/c2ccc(F)cc2)CC1 ZINC001621288820 1055715856 /nfs/dbraw/zinc/71/58/56/1055715856.db2.gz VGTLXYHWBPINBD-NSCUHMNNSA-N 1 2 310.210 4.214 20 0 DIADLO CC(C)Oc1cc(F)ccc1C[N@H+](C)Cc1ccccc1F ZINC001238701729 1055727118 /nfs/dbraw/zinc/72/71/18/1055727118.db2.gz GKJOXRFQLPXZFI-UHFFFAOYSA-N 1 2 305.368 4.384 20 0 DIADLO CC(C)Oc1cc(F)ccc1C[N@@H+](C)Cc1ccccc1F ZINC001238701729 1055727123 /nfs/dbraw/zinc/72/71/23/1055727123.db2.gz GKJOXRFQLPXZFI-UHFFFAOYSA-N 1 2 305.368 4.384 20 0 DIADLO CCC(CC)(CC)NC(=O)[C@H]1CC[C@@H](Nc2cccc[nH+]2)CC1 ZINC001565796154 1055730588 /nfs/dbraw/zinc/73/05/88/1055730588.db2.gz OMMRPJXDEIRJHN-IYBDPMFKSA-N 1 2 317.477 4.137 20 0 DIADLO CC(C)c1ccc(C[NH+]2CC(C)(C)OC(C)(C)C2)c(Cl)n1 ZINC001238731413 1055736236 /nfs/dbraw/zinc/73/62/36/1055736236.db2.gz NWYCQHWGTUTDCH-UHFFFAOYSA-N 1 2 310.869 4.248 20 0 DIADLO CC(C)Oc1c(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)ccc(F)c1F ZINC001238751470 1055738878 /nfs/dbraw/zinc/73/88/78/1055738878.db2.gz XFPBDXLVEYGUTK-LLVKDONJSA-N 1 2 323.305 4.136 20 0 DIADLO CC(C)Oc1c(C[N@H+]2CC[C@@H](C(F)(F)F)C2)ccc(F)c1F ZINC001238751470 1055738886 /nfs/dbraw/zinc/73/88/86/1055738886.db2.gz XFPBDXLVEYGUTK-LLVKDONJSA-N 1 2 323.305 4.136 20 0 DIADLO CC(C)Oc1c(F)c(F)ccc1C[N@H+](C)Cc1ccsc1 ZINC001238750602 1055739117 /nfs/dbraw/zinc/73/91/17/1055739117.db2.gz OEYVFWJWCUMTDV-UHFFFAOYSA-N 1 2 311.397 4.446 20 0 DIADLO CC(C)Oc1c(F)c(F)ccc1C[N@@H+](C)Cc1ccsc1 ZINC001238750602 1055739127 /nfs/dbraw/zinc/73/91/27/1055739127.db2.gz OEYVFWJWCUMTDV-UHFFFAOYSA-N 1 2 311.397 4.446 20 0 DIADLO Fc1ccc(C[N@@H+]2CC3CCC2CC3)c(Br)c1F ZINC001238769899 1055745038 /nfs/dbraw/zinc/74/50/38/1055745038.db2.gz IMMAEHCJWPBWAI-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1ccc(C[N@H+]2CC3CCC2CC3)c(Br)c1F ZINC001238769899 1055745045 /nfs/dbraw/zinc/74/50/45/1055745045.db2.gz IMMAEHCJWPBWAI-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Cc1cc(F)cc(C[N@@H+]2CCc3cc(O)ccc3C2)c1Cl ZINC001238777413 1055746547 /nfs/dbraw/zinc/74/65/47/1055746547.db2.gz LFMRDKXPFFOZOF-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Cc1cc(F)cc(C[N@H+]2CCc3cc(O)ccc3C2)c1Cl ZINC001238777413 1055746556 /nfs/dbraw/zinc/74/65/56/1055746556.db2.gz LFMRDKXPFFOZOF-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1c(C)cc(F)cc1Cl ZINC001238784787 1055749209 /nfs/dbraw/zinc/74/92/09/1055749209.db2.gz BVQMJCUKRGWKTC-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1c(C)cc(F)cc1Cl ZINC001238784787 1055749219 /nfs/dbraw/zinc/74/92/19/1055749219.db2.gz BVQMJCUKRGWKTC-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO Cc1ccc(C(C)C)cc1Nc1ccc[nH+]c1N1CCOCC1 ZINC001212362581 1055753202 /nfs/dbraw/zinc/75/32/02/1055753202.db2.gz OWNXJYKLQVRVCT-UHFFFAOYSA-N 1 2 311.429 4.094 20 0 DIADLO CC(C)Oc1cc(C[N@H+](C)C/C=C/c2ccccc2)c(F)cn1 ZINC001238798000 1055753250 /nfs/dbraw/zinc/75/32/50/1055753250.db2.gz ATDKXWZDQVZQBJ-JXMROGBWSA-N 1 2 314.404 4.153 20 0 DIADLO CC(C)Oc1cc(C[N@@H+](C)C/C=C/c2ccccc2)c(F)cn1 ZINC001238798000 1055753260 /nfs/dbraw/zinc/75/32/60/1055753260.db2.gz ATDKXWZDQVZQBJ-JXMROGBWSA-N 1 2 314.404 4.153 20 0 DIADLO COc1cc(C[NH+]2CCOCC2)ccc1-c1ccc(C2CC2)cc1 ZINC001238838376 1055761213 /nfs/dbraw/zinc/76/12/13/1055761213.db2.gz QAVAFRKWMQTGEW-UHFFFAOYSA-N 1 2 323.436 4.072 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@H]3CC[C@@H]3c3ccc(F)cc3)cc2[nH+]1 ZINC001566329599 1055762022 /nfs/dbraw/zinc/76/20/22/1055762022.db2.gz DGNRKQIYCKPJIW-CVEARBPZSA-N 1 2 323.371 4.143 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc(OCC(C)C)cc3)cc2[nH+]1 ZINC001566328799 1055762541 /nfs/dbraw/zinc/76/25/41/1055762541.db2.gz DRRSTUQPRQEOEI-UHFFFAOYSA-N 1 2 323.396 4.158 20 0 DIADLO COc1ccc(C[NH2+][C@@H](c2ccccc2)c2ccccc2OC)o1 ZINC001649245145 1055774992 /nfs/dbraw/zinc/77/49/92/1055774992.db2.gz ROUBQEVXWJOSOW-FQEVSTJZSA-N 1 2 323.392 4.176 20 0 DIADLO C[C@H]1CCCc2ccccc2[C@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001567346141 1055799076 /nfs/dbraw/zinc/79/90/76/1055799076.db2.gz OAPWLADBDAUABQ-DJJJIMSYSA-N 1 2 319.408 4.006 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cc(Cl)cc3c2OCC3)c1 ZINC001621290258 1055799559 /nfs/dbraw/zinc/79/95/59/1055799559.db2.gz LLZBWNIEMBPODN-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cc(Cl)cc3c2OCC3)c1 ZINC001621290258 1055799574 /nfs/dbraw/zinc/79/95/74/1055799574.db2.gz LLZBWNIEMBPODN-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO C[C@H](CCNC(=O)c1ccc(-n2cc[nH+]c2)cc1)CC(C)(C)C ZINC001567622364 1055809983 /nfs/dbraw/zinc/80/99/83/1055809983.db2.gz XSSBKTWLSYIROT-OAHLLOKOSA-N 1 2 313.445 4.065 20 0 DIADLO Fc1ccccc1C[N@@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000058754085 1055815723 /nfs/dbraw/zinc/81/57/23/1055815723.db2.gz IGZXUNTXCCKYCR-HXUWFJFHSA-N 1 2 306.384 4.232 20 0 DIADLO Fc1ccccc1C[N@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000058754085 1055815731 /nfs/dbraw/zinc/81/57/31/1055815731.db2.gz IGZXUNTXCCKYCR-HXUWFJFHSA-N 1 2 306.384 4.232 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C(C)(C)c3ccccc3C)cc2[nH+]1 ZINC000058789850 1055818068 /nfs/dbraw/zinc/81/80/68/1055818068.db2.gz XESJQJXVYSBOTJ-UHFFFAOYSA-N 1 2 307.397 4.096 20 0 DIADLO Cc1oc(-c2ccccc2)cc1C(=O)NCc1c[nH+]c(C)cc1C ZINC001597403302 1055824835 /nfs/dbraw/zinc/82/48/35/1055824835.db2.gz POHVHWSKGJPYJQ-UHFFFAOYSA-N 1 2 320.392 4.197 20 0 DIADLO Cc1cc(C)c(CNC(=O)/C=C/[C@]2(C)CC[C@@H](C)C2(C)C)c[nH+]1 ZINC001597403832 1055826653 /nfs/dbraw/zinc/82/66/53/1055826653.db2.gz YUGXUPPJZJOHFD-YSBOVISJSA-N 1 2 314.473 4.333 20 0 DIADLO CCCC1CCC(N(C)C(=O)[C@H](CC(C)C)n2cc[nH+]c2)CC1 ZINC001568590278 1055840742 /nfs/dbraw/zinc/84/07/42/1055840742.db2.gz FOMFJPLXNOAQKO-ABHNRTSZSA-N 1 2 319.493 4.288 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3C[C@@H]4CCCC[C@H]34)c2)[nH+]c1C ZINC001597513788 1055841606 /nfs/dbraw/zinc/84/16/06/1055841606.db2.gz DYHJINVAUFBBID-JCGIZDLHSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ccc(CF)cc3)c2)[nH+]c1C ZINC001597513773 1055841657 /nfs/dbraw/zinc/84/16/57/1055841657.db2.gz DOLCWNAWNSDHNH-UHFFFAOYSA-N 1 2 323.371 4.415 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC(C)(C)[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC001597537126 1055844051 /nfs/dbraw/zinc/84/40/51/1055844051.db2.gz BBBNTCVNZAPXBY-SFHVURJKSA-N 1 2 308.425 4.230 20 0 DIADLO O=C(N[C@H]1CCC[C@@H](c2ccccc2)C1)c1cc2c[nH+]ccc2[nH]1 ZINC001568683583 1055844372 /nfs/dbraw/zinc/84/43/72/1055844372.db2.gz MVLHKOUQZDFEQL-WBVHZDCISA-N 1 2 319.408 4.019 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1ccc(C2CCCCC2)cc1 ZINC001597677324 1055862307 /nfs/dbraw/zinc/86/23/07/1055862307.db2.gz UIOAUMXDEZFATC-UHFFFAOYSA-N 1 2 308.425 4.420 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)CCCc1ccc2ccccc2c1 ZINC001597683400 1055863484 /nfs/dbraw/zinc/86/34/84/1055863484.db2.gz DWQKRNXVXZGMDC-UHFFFAOYSA-N 1 2 318.420 4.235 20 0 DIADLO Cc1nn(-c2ccccc2)c(C)c1C[N@@H+](C)Cc1ccccc1F ZINC000061801047 1055872750 /nfs/dbraw/zinc/87/27/50/1055872750.db2.gz SXWFCJNEAPORRY-UHFFFAOYSA-N 1 2 323.415 4.260 20 0 DIADLO Cc1nn(-c2ccccc2)c(C)c1C[N@H+](C)Cc1ccccc1F ZINC000061801047 1055872760 /nfs/dbraw/zinc/87/27/60/1055872760.db2.gz SXWFCJNEAPORRY-UHFFFAOYSA-N 1 2 323.415 4.260 20 0 DIADLO CC(C)c1[nH]cc(CNC(=O)CC2CCC(C(C)(C)C)CC2)[nH+]1 ZINC001597812411 1055878815 /nfs/dbraw/zinc/87/88/15/1055878815.db2.gz UVJCVIGVIZKMGK-UHFFFAOYSA-N 1 2 319.493 4.392 20 0 DIADLO CC(C)c1[nH]c(CNC(=O)CC2CCC(C(C)(C)C)CC2)c[nH+]1 ZINC001597812411 1055878819 /nfs/dbraw/zinc/87/88/19/1055878819.db2.gz UVJCVIGVIZKMGK-UHFFFAOYSA-N 1 2 319.493 4.392 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]C2(c3c(F)cccc3F)CCC2)c(C)n1 ZINC000624345156 1055912694 /nfs/dbraw/zinc/91/26/94/1055912694.db2.gz YWITXKDEYUUIRA-LBPRGKRZSA-N 1 2 317.383 4.102 20 0 DIADLO Fc1cccc(F)c1C1([NH2+][C@@H]2CCCc3cccnc32)CCC1 ZINC000624345715 1055913700 /nfs/dbraw/zinc/91/37/00/1055913700.db2.gz SFJQKSXLVAZXPH-MRXNPFEDSA-N 1 2 314.379 4.406 20 0 DIADLO CCC[C@@H]1CCC[C@@H]1C(=O)Nc1nc(C[NH+](CC)CC)cs1 ZINC001570869777 1055918664 /nfs/dbraw/zinc/91/86/64/1055918664.db2.gz XXIIXJBTIPOLHP-HIFRSBDPSA-N 1 2 323.506 4.140 20 0 DIADLO FC1(F)C(F)(F)C12CCN(c1[nH+]ccc3ccccc31)CC2 ZINC000624349356 1055919171 /nfs/dbraw/zinc/91/91/71/1055919171.db2.gz JYRKVVKTJVADLY-UHFFFAOYSA-N 1 2 310.294 4.106 20 0 DIADLO FC(F)(F)c1cccc(-c2ccc(Cn3cc[nH+]c3)cn2)c1 ZINC001239514689 1055922235 /nfs/dbraw/zinc/92/22/35/1055922235.db2.gz IQYUIWREMPJJPU-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO O=C(Oc1cccc(C2CC2)c1)c1cccc(Cn2cc[nH+]c2)c1 ZINC001598204812 1055925218 /nfs/dbraw/zinc/92/52/18/1055925218.db2.gz BEBOGXWKRQYGCB-UHFFFAOYSA-N 1 2 318.376 4.028 20 0 DIADLO C[C@H](CC(C)(C)c1ccccc1)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001598262837 1055932523 /nfs/dbraw/zinc/93/25/23/1055932523.db2.gz QJYCMMMNSNDWRY-CQSZACIVSA-N 1 2 321.424 4.049 20 0 DIADLO CC(C)CCc1nc(C[N@H+](C)CCOc2ccccc2)cs1 ZINC000065040521 1055935981 /nfs/dbraw/zinc/93/59/81/1055935981.db2.gz LBCISKAERMWQTH-UHFFFAOYSA-N 1 2 318.486 4.243 20 0 DIADLO CC(C)CCc1nc(C[N@@H+](C)CCOc2ccccc2)cs1 ZINC000065040521 1055935994 /nfs/dbraw/zinc/93/59/94/1055935994.db2.gz LBCISKAERMWQTH-UHFFFAOYSA-N 1 2 318.486 4.243 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cn(C)c2ccccc12 ZINC001239546610 1055945777 /nfs/dbraw/zinc/94/57/77/1055945777.db2.gz RNORVDANLOWFGU-UHFFFAOYSA-N 1 2 303.365 4.040 20 0 DIADLO CCCC[C@H](CC)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000065729564 1055959654 /nfs/dbraw/zinc/95/96/54/1055959654.db2.gz SNBLVDVPYJEGLW-ZDUSSCGKSA-N 1 2 303.381 4.166 20 0 DIADLO Cc1sc(CNc2cc3cc[nH]c3c[nH+]2)cc1Br ZINC001620988614 1055961360 /nfs/dbraw/zinc/96/13/60/1055961360.db2.gz SAYJKIPMLBENKO-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO Cc1csc2ccc(-c3ccc(C[NH+]4CCOCC4)nc3)cc12 ZINC001239589489 1055967758 /nfs/dbraw/zinc/96/77/58/1055967758.db2.gz PUKVMLJMYFCBJW-UHFFFAOYSA-N 1 2 324.449 4.104 20 0 DIADLO Cc1cc2ccccc2c(-c2ccc(C[NH+]3CCOCC3)nc2)c1 ZINC001239593836 1055969240 /nfs/dbraw/zinc/96/92/40/1055969240.db2.gz MICFVHQCZPAVDY-UHFFFAOYSA-N 1 2 318.420 4.042 20 0 DIADLO Cc1c(C)c(C)c(C[N@@H+]2Cc3cn[nH]c3C[C@H](C)C2)c(C)c1C ZINC001620582952 1055972258 /nfs/dbraw/zinc/97/22/58/1055972258.db2.gz WCGQMEJDFPPMHH-LBPRGKRZSA-N 1 2 311.473 4.146 20 0 DIADLO Cc1c(C)c(C)c(C[N@H+]2Cc3cn[nH]c3C[C@H](C)C2)c(C)c1C ZINC001620582952 1055972270 /nfs/dbraw/zinc/97/22/70/1055972270.db2.gz WCGQMEJDFPPMHH-LBPRGKRZSA-N 1 2 311.473 4.146 20 0 DIADLO CC(C)(C)C(F)(F)C[NH2+]Cc1ccc2c(c1)OCCCCO2 ZINC001621015169 1055982210 /nfs/dbraw/zinc/98/22/10/1055982210.db2.gz OVUOVAFFQZTHDI-UHFFFAOYSA-N 1 2 313.388 4.009 20 0 DIADLO CCC(CC)C[NH2+]c1ccc(N2CCOC[C@@H]2C)c(Cl)c1 ZINC001621024408 1055990358 /nfs/dbraw/zinc/99/03/58/1055990358.db2.gz WIPZPSXKYXNYDR-ZDUSSCGKSA-N 1 2 310.869 4.413 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2cscn2)c2ccc(C)cc2)cc1 ZINC000067503295 1055991023 /nfs/dbraw/zinc/99/10/23/1055991023.db2.gz GHWZDWKWYZOKMO-LJQANCHMSA-N 1 2 324.449 4.339 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)s1 ZINC000067387364 1055992407 /nfs/dbraw/zinc/99/24/07/1055992407.db2.gz GKQBLCKHIZMUIT-GFCCVEGCSA-N 1 2 311.248 4.176 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)s1 ZINC000067387364 1055992420 /nfs/dbraw/zinc/99/24/20/1055992420.db2.gz GKQBLCKHIZMUIT-GFCCVEGCSA-N 1 2 311.248 4.176 20 0 DIADLO CC(C)c1cnc(C[NH2+]Cc2ccccc2OCC2CC2)s1 ZINC001620807644 1056001645 /nfs/dbraw/zinc/00/16/45/1056001645.db2.gz HHIPGSUCZLAXDI-UHFFFAOYSA-N 1 2 316.470 4.345 20 0 DIADLO CC(C)CCc1noc(C[N@@H+]2CCC[C@@H]2c2ccsc2)n1 ZINC000067965437 1056001991 /nfs/dbraw/zinc/00/19/91/1056001991.db2.gz WDPGGMXQBZFBNC-CQSZACIVSA-N 1 2 305.447 4.057 20 0 DIADLO CC(C)CCc1noc(C[N@H+]2CCC[C@@H]2c2ccsc2)n1 ZINC000067965437 1056001999 /nfs/dbraw/zinc/00/19/99/1056001999.db2.gz WDPGGMXQBZFBNC-CQSZACIVSA-N 1 2 305.447 4.057 20 0 DIADLO Cc1nn(-c2ccc(C)cc2)cc1CNc1c[nH+]c(C)c(C)c1 ZINC001621046986 1056005728 /nfs/dbraw/zinc/00/57/28/1056005728.db2.gz BWHAHHDMPMYEGL-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO COc1cc(CNc2c[nH+]c(C)c(C)c2)c(SC)cc1OC ZINC001621047484 1056005760 /nfs/dbraw/zinc/00/57/60/1056005760.db2.gz UCJTZJCQWMUFLI-UHFFFAOYSA-N 1 2 318.442 4.050 20 0 DIADLO Cc1ccc2[nH+]c(NCc3sccc3Br)[nH]c2c1 ZINC001621046206 1056006311 /nfs/dbraw/zinc/00/63/11/1056006311.db2.gz XLVOTAXFTSSXKM-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO COc1cccc(COc2ccc(C[NH2+][C@@H](C)C(F)F)cc2)c1 ZINC001621045792 1056007293 /nfs/dbraw/zinc/00/72/93/1056007293.db2.gz HSBDPYFJFJFCPT-ZDUSSCGKSA-N 1 2 321.367 4.017 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1ccccc1NC ZINC001621052412 1056009930 /nfs/dbraw/zinc/00/99/30/1056009930.db2.gz WEPVLTIEIJRZEF-UHFFFAOYSA-N 1 2 314.820 4.363 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NCc1cccc2ccoc21 ZINC001621052196 1056011058 /nfs/dbraw/zinc/01/10/58/1056011058.db2.gz MJATWNGIRPWHGD-UHFFFAOYSA-N 1 2 321.380 4.041 20 0 DIADLO CCOc1cc(F)cc(CNc2[nH]c3ccc(Cl)cc3[nH+]2)c1 ZINC001621056861 1056014399 /nfs/dbraw/zinc/01/43/99/1056014399.db2.gz GWNBWLKJFCTPOS-UHFFFAOYSA-N 1 2 319.767 4.366 20 0 DIADLO Cc1ccc(C)c(NC(=O)c2c[nH+]ccc2Nc2ccccc2)c1 ZINC001540332771 1056017999 /nfs/dbraw/zinc/01/79/99/1056017999.db2.gz IJLWEALMGYFHAV-UHFFFAOYSA-N 1 2 317.392 4.116 20 0 DIADLO Clc1cccc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)n1 ZINC000072556824 1056030221 /nfs/dbraw/zinc/03/02/21/1056030221.db2.gz BIGAXTHPYAAZFH-SFHVURJKSA-N 1 2 309.800 4.009 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000072558793 1056031235 /nfs/dbraw/zinc/03/12/35/1056031235.db2.gz XLRYRNOQPBHWOB-HNNXBMFYSA-N 1 2 305.809 4.087 20 0 DIADLO CCC(C)(C)C1CCC(NC(=O)c2cc3c[nH+]ccc3[nH]2)CC1 ZINC001540651605 1056056066 /nfs/dbraw/zinc/05/60/66/1056056066.db2.gz CFVDMAQSTGPZEW-UHFFFAOYSA-N 1 2 313.445 4.288 20 0 DIADLO Cc1ccc(-c2ncnc3c2C[N@H+](Cc2ccccc2)C3)cc1F ZINC001239817972 1056088585 /nfs/dbraw/zinc/08/85/85/1056088585.db2.gz BCTUCBORZDMIPI-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO Cc1ccc(-c2ncnc3c2C[N@@H+](Cc2ccccc2)C3)cc1F ZINC001239817972 1056088592 /nfs/dbraw/zinc/08/85/92/1056088592.db2.gz BCTUCBORZDMIPI-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO Cc1cc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)c(C)s1 ZINC001212388437 1056096994 /nfs/dbraw/zinc/09/69/94/1056096994.db2.gz UPHGPQPBGWMSIA-UHFFFAOYSA-N 1 2 322.393 4.268 20 0 DIADLO CC[C@H](CC(C)C)C(=O)N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC001611051913 1056101199 /nfs/dbraw/zinc/10/11/99/1056101199.db2.gz FNVBSBRPNDNLLY-HZPDHXFCSA-N 1 2 313.445 4.122 20 0 DIADLO CCCC1(C(=O)N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)CCC1 ZINC001611052620 1056101860 /nfs/dbraw/zinc/10/18/60/1056101860.db2.gz OSMHLPCOIQQQNT-OAHLLOKOSA-N 1 2 311.429 4.020 20 0 DIADLO Cc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001542442143 1056125074 /nfs/dbraw/zinc/12/50/74/1056125074.db2.gz KDSAUTHMPRMTNW-ZWKOTPCHSA-N 1 2 317.392 4.127 20 0 DIADLO COC1CCC(Nc2ccc3c(c2)[nH+]cn3-c2ccccc2)CC1 ZINC001168615445 1056127965 /nfs/dbraw/zinc/12/79/65/1056127965.db2.gz XUQKGXOSRRADLI-UHFFFAOYSA-N 1 2 321.424 4.395 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(C(=O)N(CC)CC)cc2)c1 ZINC001239890406 1056135256 /nfs/dbraw/zinc/13/52/56/1056135256.db2.gz DUYIMNJXEUYVNT-UHFFFAOYSA-N 1 2 324.424 4.197 20 0 DIADLO O=C(NC1CCCCC1)c1ccc(-c2ccc3[nH+]ccn3c2)cc1 ZINC001239916393 1056157066 /nfs/dbraw/zinc/15/70/66/1056157066.db2.gz RWDDGTBLGWJSED-UHFFFAOYSA-N 1 2 319.408 4.064 20 0 DIADLO Cc1cc(NC(=O)C2(C)C(C)(C)C2(C)C)ccc1-n1cc[nH+]c1 ZINC001542877423 1056162853 /nfs/dbraw/zinc/16/28/53/1056162853.db2.gz VQBRDJRPHFPGFQ-UHFFFAOYSA-N 1 2 311.429 4.192 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3occ4c3CCC4)cc2)[nH+]c1C ZINC000921652723 1056164794 /nfs/dbraw/zinc/16/47/94/1056164794.db2.gz BVMOBTJFCDXMEJ-UHFFFAOYSA-N 1 2 321.380 4.028 20 0 DIADLO C[C@@H]([NH2+]Cc1cnsc1)c1nc(-c2ccccc2)cs1 ZINC001649117646 1056178153 /nfs/dbraw/zinc/17/81/53/1056178153.db2.gz LTQIAQKBGHXIAN-LLVKDONJSA-N 1 2 301.440 4.117 20 0 DIADLO Cc1cc(C)c(CNC(=O)CCCc2ccc(C3CC3)cc2)c[nH+]1 ZINC001583839684 1056182602 /nfs/dbraw/zinc/18/26/02/1056182602.db2.gz LJXOWZQCHBUNJP-UHFFFAOYSA-N 1 2 322.452 4.215 20 0 DIADLO Fc1cccc(C[N@H+](Cn2cc(-c3ccccc3)cn2)C2CC2)c1 ZINC000058529392 1056190062 /nfs/dbraw/zinc/19/00/62/1056190062.db2.gz NQNGANUYPAEAQY-UHFFFAOYSA-N 1 2 321.399 4.311 20 0 DIADLO Fc1cccc(C[N@@H+](Cn2cc(-c3ccccc3)cn2)C2CC2)c1 ZINC000058529392 1056190071 /nfs/dbraw/zinc/19/00/71/1056190071.db2.gz NQNGANUYPAEAQY-UHFFFAOYSA-N 1 2 321.399 4.311 20 0 DIADLO CCC[C@@H]1CCCC[C@@H]1CNC(=O)c1c(C)cc(C)[nH+]c1C ZINC001583876227 1056191697 /nfs/dbraw/zinc/19/16/97/1056191697.db2.gz DICSXWQWIPBCEL-IAGOWNOFSA-N 1 2 302.462 4.343 20 0 DIADLO CCc1cc(N[C@H](C)Cc2ccccc2Cl)nc(CC)[nH+]1 ZINC001611809154 1056193994 /nfs/dbraw/zinc/19/39/94/1056193994.db2.gz BLGMJLPZENPICW-GFCCVEGCSA-N 1 2 303.837 4.298 20 0 DIADLO COc1ccccc1CN(c1cc(C)[nH+]c(C2CCC2)n1)C1CC1 ZINC001611831293 1056195829 /nfs/dbraw/zinc/19/58/29/1056195829.db2.gz QVNRFYUSFIQTBI-UHFFFAOYSA-N 1 2 323.440 4.230 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc(OC(C)C)c1 ZINC001239971547 1056212779 /nfs/dbraw/zinc/21/27/79/1056212779.db2.gz BVHXPYVKRDDDIM-UHFFFAOYSA-N 1 2 308.381 4.335 20 0 DIADLO CC1CC[NH+](c2ccc(Nc3cc(C(F)F)ncn3)cc2)CC1 ZINC001612014809 1056222308 /nfs/dbraw/zinc/22/23/08/1056222308.db2.gz SWOCGHYDTCQNFZ-UHFFFAOYSA-N 1 2 318.371 4.394 20 0 DIADLO CC[N@@H+](CC(=O)N(C)[C@@H](C)C(C)(C)C)Cc1ccccc1Cl ZINC001583989505 1056229378 /nfs/dbraw/zinc/22/93/78/1056229378.db2.gz MDQLJCVKDNDTDP-AWEZNQCLSA-N 1 2 324.896 4.055 20 0 DIADLO CC[N@H+](CC(=O)N(C)[C@@H](C)C(C)(C)C)Cc1ccccc1Cl ZINC001583989505 1056229369 /nfs/dbraw/zinc/22/93/69/1056229369.db2.gz MDQLJCVKDNDTDP-AWEZNQCLSA-N 1 2 324.896 4.055 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(S[C@H]3CCOc4ccccc43)c12 ZINC001612112297 1056240395 /nfs/dbraw/zinc/24/03/95/1056240395.db2.gz KPQDEJGPFBZSOM-AWEZNQCLSA-N 1 2 311.410 4.136 20 0 DIADLO CCOc1cccc(CCNc2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC001612155071 1056246937 /nfs/dbraw/zinc/24/69/37/1056246937.db2.gz OYINMLJLKAUGDS-UHFFFAOYSA-N 1 2 311.429 4.106 20 0 DIADLO CCc1noc(C)c1[C@@H](C)[NH2+][C@H]1CCCc2cn(C(C)C)nc21 ZINC000765822349 1056253461 /nfs/dbraw/zinc/25/34/61/1056253461.db2.gz ZRVPFCDAIYQTNF-WBMJQRKESA-N 1 2 316.449 4.051 20 0 DIADLO Cc1cc(N2CCC[C@]2(C)Cc2ccccc2)nc(C2CC2)[nH+]1 ZINC001612224912 1056255898 /nfs/dbraw/zinc/25/58/98/1056255898.db2.gz VTPGSLFDYZFLPJ-HXUWFJFHSA-N 1 2 307.441 4.264 20 0 DIADLO Cc1cc(NCC[C@@H]2C[C@@H](C)O[C@@H](C)C2)nc(C2CCC2)[nH+]1 ZINC001612294817 1056267702 /nfs/dbraw/zinc/26/77/02/1056267702.db2.gz SNVYSUJUSZVDTO-QDMKHBRRSA-N 1 2 303.450 4.058 20 0 DIADLO CC(C)c1cc(NC[C@@H](CO)CC2CCCC2)nc(C(C)C)[nH+]1 ZINC001612311046 1056270028 /nfs/dbraw/zinc/27/00/28/1056270028.db2.gz UNYWVTURKPYSNL-INIZCTEOSA-N 1 2 319.493 4.324 20 0 DIADLO CCc1cc(N2C[C@H](c3ccccc3)[C@H]3CCC[C@H]32)nc(CC)[nH+]1 ZINC001612357204 1056277104 /nfs/dbraw/zinc/27/71/04/1056277104.db2.gz CTWPQODKVJLXTD-GUDVDZBRSA-N 1 2 321.468 4.374 20 0 DIADLO Cc1cc(N2CC[C@H](c3ccccc3F)C2)nc(C2CCC2)[nH+]1 ZINC001612416337 1056285420 /nfs/dbraw/zinc/28/54/20/1056285420.db2.gz LGZHOTLBJUPOMX-HNNXBMFYSA-N 1 2 311.404 4.186 20 0 DIADLO CC(C)c1cc(N[C@H](C2CC2)[C@@H]2CCCCO2)nc(C(C)C)[nH+]1 ZINC001612549147 1056303686 /nfs/dbraw/zinc/30/36/86/1056303686.db2.gz WUAFJPORLMRTMZ-FUHWJXTLSA-N 1 2 317.477 4.483 20 0 DIADLO C/C=C\C[C@@H]1CCCN(c2nc3ccccc3n3c[nH+]cc23)C1 ZINC001612685302 1056318273 /nfs/dbraw/zinc/31/82/73/1056318273.db2.gz PYZBOEBVZNNXCA-MPNWYJEXSA-N 1 2 306.413 4.065 20 0 DIADLO Cc1cc(N(C)Cc2ccc3cc[nH]c3c2)nc(C2CCC2)[nH+]1 ZINC001612802403 1056329177 /nfs/dbraw/zinc/32/91/77/1056329177.db2.gz FNYZHNSWEPMPMV-UHFFFAOYSA-N 1 2 306.413 4.170 20 0 DIADLO c1ccc2c(c1)NCC[C@H]2Nc1cc2c3c(c1)CCC[NH+]3CCC2 ZINC001168644433 1056336377 /nfs/dbraw/zinc/33/63/77/1056336377.db2.gz KDFLEKYSGFIGHS-HXUWFJFHSA-N 1 2 319.452 4.354 20 0 DIADLO Cc1cccc(F)c1C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC001544056394 1056351383 /nfs/dbraw/zinc/35/13/83/1056351383.db2.gz WESKULJARJOQRP-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO CC(C)c1ccc(-n2ccnc2SCc2ccc[nH+]c2N)cc1 ZINC001613331305 1056371306 /nfs/dbraw/zinc/37/13/06/1056371306.db2.gz COVAYKMAOSGEBD-UHFFFAOYSA-N 1 2 324.453 4.265 20 0 DIADLO CC(C)(C)OC(=O)c1ccc(-c2ccc3[nH+]ccn3c2)c(F)c1 ZINC001240218123 1056374764 /nfs/dbraw/zinc/37/47/64/1056374764.db2.gz BNWNLHTXDXIGNT-UHFFFAOYSA-N 1 2 312.344 4.096 20 0 DIADLO O=C(Nc1ccc(-c2ccc3[nH+]ccn3c2)cc1)c1ccccc1 ZINC001240218982 1056374832 /nfs/dbraw/zinc/37/48/32/1056374832.db2.gz SNUAQXDBCZIUJX-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO Fc1cc(-c2ccc3[nH+]ccn3c2)cc(F)c1OC(F)(F)F ZINC001240219589 1056375302 /nfs/dbraw/zinc/37/53/02/1056375302.db2.gz PCTCRGSNNWUHFM-UHFFFAOYSA-N 1 2 314.213 4.178 20 0 DIADLO COc1ccc(-c2cccnc2)cc1-c1ccc2[nH+]ccn2c1 ZINC001240219727 1056375760 /nfs/dbraw/zinc/37/57/60/1056375760.db2.gz STNKLGRDWCRFFJ-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO c1cn2cc(-c3cc(SCc4ccccc4)ncn3)ccc2[nH+]1 ZINC001240217312 1056376572 /nfs/dbraw/zinc/37/65/72/1056376572.db2.gz MJGABGKHZKODDQ-UHFFFAOYSA-N 1 2 318.405 4.084 20 0 DIADLO Fc1cc(O[C@H]2CCCCO2)ccc1-c1ccc2[nH+]ccn2c1 ZINC001240220553 1056377920 /nfs/dbraw/zinc/37/79/20/1056377920.db2.gz HGKNHSOPNXKGMD-SFHVURJKSA-N 1 2 312.344 4.046 20 0 DIADLO COc1ncc(-c2ccccc2)cc1-c1ccc2[nH+]ccn2c1 ZINC001240222040 1056379304 /nfs/dbraw/zinc/37/93/04/1056379304.db2.gz VJBAHDHKKBDVJF-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2c3cc[nH]c3ccc2F)cc1F ZINC001240226049 1056381449 /nfs/dbraw/zinc/38/14/49/1056381449.db2.gz MULVFPDYKOMABW-UHFFFAOYSA-N 1 2 304.315 4.314 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC(CCC(C)C)CC2)c(C)[nH+]1 ZINC001544255697 1056393072 /nfs/dbraw/zinc/39/30/72/1056393072.db2.gz APDYMPUNZNXXQA-UHFFFAOYSA-N 1 2 302.462 4.295 20 0 DIADLO FC(F)(F)c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cn1 ZINC001240269198 1056403827 /nfs/dbraw/zinc/40/38/27/1056403827.db2.gz ZHHVVVRCVIRCSN-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO Fc1ccc(-c2ccnc(C(F)(F)F)c2)cc1-n1cc[nH+]c1 ZINC001240340896 1056436024 /nfs/dbraw/zinc/43/60/24/1056436024.db2.gz JYDZOHZAVNVQBO-UHFFFAOYSA-N 1 2 307.250 4.092 20 0 DIADLO CC(C)[N@@H+]1CCC[C@@H]1C(=O)Oc1c(Cl)ccc2ccccc21 ZINC001544494360 1056442775 /nfs/dbraw/zinc/44/27/75/1056442775.db2.gz MLLJZYDLSXAWPX-MRXNPFEDSA-N 1 2 317.816 4.271 20 0 DIADLO CC(C)[N@H+]1CCC[C@@H]1C(=O)Oc1c(Cl)ccc2ccccc21 ZINC001544494360 1056442783 /nfs/dbraw/zinc/44/27/83/1056442783.db2.gz MLLJZYDLSXAWPX-MRXNPFEDSA-N 1 2 317.816 4.271 20 0 DIADLO Cc1ccc(F)cc1OCc1c[nH+]c(N(C)C)c2ccccc12 ZINC001614708436 1056446396 /nfs/dbraw/zinc/44/63/96/1056446396.db2.gz LLRMRWXVESAAIE-UHFFFAOYSA-N 1 2 310.372 4.327 20 0 DIADLO COc1ccc2cc(N[C@@H]3CCCc4cccnc43)[nH+]cc2c1 ZINC001168657399 1056447932 /nfs/dbraw/zinc/44/79/32/1056447932.db2.gz ZKEKGPZQMQRSMM-QGZVFWFLSA-N 1 2 305.381 4.128 20 0 DIADLO Cn1cc(-c2ccc(-c3ccc(-c4c[nH+]cn4C)cc3)cc2)cn1 ZINC001240364483 1056448687 /nfs/dbraw/zinc/44/86/87/1056448687.db2.gz FEVJLGJBIDMSMU-UHFFFAOYSA-N 1 2 314.392 4.155 20 0 DIADLO CC(C)(C)c1cn(Cc2ccn(-c3ccc(Cl)cc3)n2)c[nH+]1 ZINC001614787049 1056452837 /nfs/dbraw/zinc/45/28/37/1056452837.db2.gz FLHKFJFZNFICRQ-UHFFFAOYSA-N 1 2 314.820 4.068 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)C(C)C ZINC000921744424 1056454086 /nfs/dbraw/zinc/45/40/86/1056454086.db2.gz DABNLWHOHNMSDX-INIZCTEOSA-N 1 2 301.434 4.162 20 0 DIADLO Cc1cc(NC(=O)c2occc2C(C)C)ccc1-n1cc[nH+]c1 ZINC001614883823 1056455913 /nfs/dbraw/zinc/45/59/13/1056455913.db2.gz JJVQBRZOQKSRSY-UHFFFAOYSA-N 1 2 309.369 4.149 20 0 DIADLO Cc1c(F)cccc1NC(=O)C[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC001544583600 1056462097 /nfs/dbraw/zinc/46/20/97/1056462097.db2.gz MZZXSXICVGLQDD-HNNXBMFYSA-N 1 2 323.371 4.018 20 0 DIADLO Cc1cc(C)c(CNC(=O)C2(c3ccccc3C)CCCC2)c[nH+]1 ZINC001585012291 1056463777 /nfs/dbraw/zinc/46/37/77/1056463777.db2.gz XXDFMZZDSLUERL-UHFFFAOYSA-N 1 2 322.452 4.135 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2cnn(CC3CCC3)c2)cs1 ZINC000921756903 1056464567 /nfs/dbraw/zinc/46/45/67/1056464567.db2.gz CJEGVCNCXNRAHS-CYBMUJFWSA-N 1 2 318.490 4.114 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+]Cc2cnn(CC3CCC3)c2)cs1 ZINC000921756905 1056465032 /nfs/dbraw/zinc/46/50/32/1056465032.db2.gz CJEGVCNCXNRAHS-ZDUSSCGKSA-N 1 2 318.490 4.114 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+]Cc2cccc3c2OCC3)cs1 ZINC000921758230 1056465260 /nfs/dbraw/zinc/46/52/60/1056465260.db2.gz KSFAHNRQSIJWLL-LBPRGKRZSA-N 1 2 302.443 4.052 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cccc3c2OC(F)(F)O3)C2CC2)o1 ZINC001615181309 1056472513 /nfs/dbraw/zinc/47/25/13/1056472513.db2.gz PNCWKGTYMANQKO-UHFFFAOYSA-N 1 2 321.323 4.074 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cccc3c2OC(F)(F)O3)C2CC2)o1 ZINC001615181309 1056472514 /nfs/dbraw/zinc/47/25/14/1056472514.db2.gz PNCWKGTYMANQKO-UHFFFAOYSA-N 1 2 321.323 4.074 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@H](C)c2ccc(OC(F)(F)F)cc2)no1 ZINC000172621116 1056473708 /nfs/dbraw/zinc/47/37/08/1056473708.db2.gz XQQXQUASSJTFJT-LLVKDONJSA-N 1 2 314.307 4.075 20 0 DIADLO Cc1cc(C[N@H+](C)[C@H](C)c2ccc(OC(F)(F)F)cc2)no1 ZINC000172621116 1056473714 /nfs/dbraw/zinc/47/37/14/1056473714.db2.gz XQQXQUASSJTFJT-LLVKDONJSA-N 1 2 314.307 4.075 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1cccc(-n2ccnc2)c1 ZINC000921798385 1056499436 /nfs/dbraw/zinc/49/94/36/1056499436.db2.gz FLCBMCCPDGLIHW-CQSZACIVSA-N 1 2 324.428 4.009 20 0 DIADLO COC(=O)[C@@H](c1ccc(F)cc1)[N@@H+]1CCCC2(CCCCC2)C1 ZINC001615454075 1056511902 /nfs/dbraw/zinc/51/19/02/1056511902.db2.gz MIVAHBTWZDNAAM-QGZVFWFLSA-N 1 2 319.420 4.086 20 0 DIADLO COC(=O)[C@@H](c1ccc(F)cc1)[N@H+]1CCCC2(CCCCC2)C1 ZINC001615454075 1056511915 /nfs/dbraw/zinc/51/19/15/1056511915.db2.gz MIVAHBTWZDNAAM-QGZVFWFLSA-N 1 2 319.420 4.086 20 0 DIADLO Cc1cn2cc(-c3ccc(C(=O)OC(C)(C)C)cc3)ccc2[nH+]1 ZINC001240441183 1056512492 /nfs/dbraw/zinc/51/24/92/1056512492.db2.gz QLIAREUPONLVBB-UHFFFAOYSA-N 1 2 308.381 4.265 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)n1 ZINC000921819478 1056514797 /nfs/dbraw/zinc/51/47/97/1056514797.db2.gz CQLPVDHUAOXXCV-UHFFFAOYSA-N 1 2 308.372 4.275 20 0 DIADLO Fc1cc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)ccn1 ZINC001615468879 1056516181 /nfs/dbraw/zinc/51/61/81/1056516181.db2.gz FHKSESWYEOTISL-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO Fc1cc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)ccn1 ZINC001615468879 1056516186 /nfs/dbraw/zinc/51/61/86/1056516186.db2.gz FHKSESWYEOTISL-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO CC[C@@H]1CCCCN1C(=O)C[N@H+](C)[C@H](C)c1ccccc1Cl ZINC000251650226 1056526744 /nfs/dbraw/zinc/52/67/44/1056526744.db2.gz GKYLIDMSPUNUGW-HUUCEWRRSA-N 1 2 322.880 4.124 20 0 DIADLO CC[C@@H]1CCCCN1C(=O)C[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC000251650226 1056526752 /nfs/dbraw/zinc/52/67/52/1056526752.db2.gz GKYLIDMSPUNUGW-HUUCEWRRSA-N 1 2 322.880 4.124 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+](Cc2c(F)c(F)c(F)c(F)c2F)C1 ZINC001615544797 1056534412 /nfs/dbraw/zinc/53/44/12/1056534412.db2.gz ZZOJITSHPVTIBI-BDAKNGLRSA-N 1 2 307.306 4.393 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2c(F)c(F)c(F)c(F)c2F)C1 ZINC001615544797 1056534418 /nfs/dbraw/zinc/53/44/18/1056534418.db2.gz ZZOJITSHPVTIBI-BDAKNGLRSA-N 1 2 307.306 4.393 20 0 DIADLO FC(F)(F)c1cnc(-c2ccn3cc[nH+]c3c2)c(C2CC2)c1 ZINC001240504030 1056542927 /nfs/dbraw/zinc/54/29/27/1056542927.db2.gz VABVTYQFKBUIIN-UHFFFAOYSA-N 1 2 303.287 4.293 20 0 DIADLO c1cn2ccc(-c3ccc4c(c3)ncn4-c3ccccc3)cc2[nH+]1 ZINC001240509111 1056544414 /nfs/dbraw/zinc/54/44/14/1056544414.db2.gz RLFVDPQXWAQPDS-UHFFFAOYSA-N 1 2 310.360 4.340 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)CC(=O)N[C@H]1CCCC[C@H]1C ZINC000252096123 1056544501 /nfs/dbraw/zinc/54/45/01/1056544501.db2.gz FMGKGMZNHBEMIE-CPUCHLNUSA-N 1 2 322.880 4.028 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)CC(=O)N[C@H]1CCCC[C@H]1C ZINC000252096123 1056544515 /nfs/dbraw/zinc/54/45/15/1056544515.db2.gz FMGKGMZNHBEMIE-CPUCHLNUSA-N 1 2 322.880 4.028 20 0 DIADLO COC(=O)c1cc2cccc(-c3ccn4cc[nH+]c4c3)c2s1 ZINC001240508677 1056544651 /nfs/dbraw/zinc/54/46/51/1056544651.db2.gz IKJPJKWMAYLQCF-UHFFFAOYSA-N 1 2 308.362 4.003 20 0 DIADLO C/C(=C/C1CCC(C)CC1)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001585398814 1056544712 /nfs/dbraw/zinc/54/47/12/1056544712.db2.gz LUGKNCJXMQSLEL-ZROIWOOFSA-N 1 2 300.446 4.087 20 0 DIADLO CCOC(=O)c1cccc2c(-c3ccn4cc[nH+]c4c3)cccc12 ZINC001240513377 1056546198 /nfs/dbraw/zinc/54/61/98/1056546198.db2.gz OLJYDXMYTXMBNE-UHFFFAOYSA-N 1 2 316.360 4.331 20 0 DIADLO Fc1cc(O[C@H]2CCCCO2)ccc1-c1ccn2cc[nH+]c2c1 ZINC001240517926 1056548241 /nfs/dbraw/zinc/54/82/41/1056548241.db2.gz IRLXLKPBSPOFIY-SFHVURJKSA-N 1 2 312.344 4.046 20 0 DIADLO COc1cc(-c2ccn3cc[nH+]c3c2)ccc1-c1ccncc1 ZINC001240518595 1056549436 /nfs/dbraw/zinc/54/94/36/1056549436.db2.gz QYCZSVKPJHTSRH-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO Fc1ccc(C(F)(F)F)c(-c2cc(-n3ccnc3)cc[nH+]2)c1 ZINC001240531047 1056554556 /nfs/dbraw/zinc/55/45/56/1056554556.db2.gz HRVXHEZTZQVRCF-UHFFFAOYSA-N 1 2 307.250 4.092 20 0 DIADLO Cc1csc(CCNc2cc[nH+]c3c(Cl)cccc23)n1 ZINC000672160410 1056555726 /nfs/dbraw/zinc/55/57/26/1056555726.db2.gz MQCYAQAFHYTSPV-UHFFFAOYSA-N 1 2 303.818 4.308 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cccc(N3CCCC3)c2)cc1 ZINC001240537579 1056562129 /nfs/dbraw/zinc/56/21/29/1056562129.db2.gz UKDDFCQEOHTIIY-UHFFFAOYSA-N 1 2 303.409 4.354 20 0 DIADLO CC[C@@H]1CN(Cc2ccc(-n3cc[nH+]c3)cc2)c2ccccc2O1 ZINC001615679226 1056565059 /nfs/dbraw/zinc/56/50/59/1056565059.db2.gz SRWZGJDZDQYTIM-GOSISDBHSA-N 1 2 319.408 4.050 20 0 DIADLO Cc1ccccc1[C@@H](CO)Nc1cc[nH+]c2c(Cl)cccc12 ZINC000672229627 1056575437 /nfs/dbraw/zinc/57/54/37/1056575437.db2.gz BCVPBAHNTUXRGP-QGZVFWFLSA-N 1 2 312.800 4.342 20 0 DIADLO Clc1cccc2c(N3CCO[C@@H](c4ccco4)C3)cc[nH+]c12 ZINC000672232755 1056577155 /nfs/dbraw/zinc/57/71/55/1056577155.db2.gz CPGNKRQNGQUQSB-MRXNPFEDSA-N 1 2 314.772 4.059 20 0 DIADLO Cc1c[nH+]c(Nc2cc(F)c(OC(F)F)c(F)c2)c(C)c1 ZINC001212446449 1056580908 /nfs/dbraw/zinc/58/09/08/1056580908.db2.gz CFQZGPWRPBOCJP-UHFFFAOYSA-N 1 2 300.255 4.322 20 0 DIADLO Clc1cccc2c(N3CCC[C@H]3C3CCOCC3)cc[nH+]c12 ZINC000672247702 1056586719 /nfs/dbraw/zinc/58/67/19/1056586719.db2.gz WPGQHHXKCJLNNI-INIZCTEOSA-N 1 2 316.832 4.284 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+]1CCOC2(C1)CCCCCC2 ZINC001615868534 1056587714 /nfs/dbraw/zinc/58/77/14/1056587714.db2.gz RUGLMPNWTGRRKS-AWEZNQCLSA-N 1 2 309.400 4.451 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+]1CCOC2(C1)CCCCCC2 ZINC001615868534 1056587724 /nfs/dbraw/zinc/58/77/24/1056587724.db2.gz RUGLMPNWTGRRKS-AWEZNQCLSA-N 1 2 309.400 4.451 20 0 DIADLO Cc1cc2c[nH+]c(-c3ccc(-c4ccc(O)cc4)cc3)nc2[nH]1 ZINC001240594831 1056601486 /nfs/dbraw/zinc/60/14/86/1056601486.db2.gz CFVCIKICXCNQBL-UHFFFAOYSA-N 1 2 301.349 4.258 20 0 DIADLO COCC[N@H+](Cc1ccc(C)o1)Cc1ccc(C)cc1Cl ZINC001616055481 1056609210 /nfs/dbraw/zinc/60/92/10/1056609210.db2.gz ALYWNZUFUGYSGJ-UHFFFAOYSA-N 1 2 307.821 4.198 20 0 DIADLO COCC[N@@H+](Cc1ccc(C)o1)Cc1ccc(C)cc1Cl ZINC001616055481 1056609215 /nfs/dbraw/zinc/60/92/15/1056609215.db2.gz ALYWNZUFUGYSGJ-UHFFFAOYSA-N 1 2 307.821 4.198 20 0 DIADLO CCCC[N@H+](Cc1nnc(OCC)s1)[C@@H](C)c1ccccc1 ZINC000621301612 1056613390 /nfs/dbraw/zinc/61/33/90/1056613390.db2.gz ZUIBZIPSLDBTHK-AWEZNQCLSA-N 1 2 319.474 4.300 20 0 DIADLO CCCC[N@@H+](Cc1nnc(OCC)s1)[C@@H](C)c1ccccc1 ZINC000621301612 1056613394 /nfs/dbraw/zinc/61/33/94/1056613394.db2.gz ZUIBZIPSLDBTHK-AWEZNQCLSA-N 1 2 319.474 4.300 20 0 DIADLO CCC[C@@H]1CCC[N@@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001616158815 1056615946 /nfs/dbraw/zinc/61/59/46/1056615946.db2.gz KARLGLLVUCJLTH-CJNGLKHVSA-N 1 2 309.837 4.066 20 0 DIADLO CCC[C@@H]1CCC[N@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001616158815 1056615949 /nfs/dbraw/zinc/61/59/49/1056615949.db2.gz KARLGLLVUCJLTH-CJNGLKHVSA-N 1 2 309.837 4.066 20 0 DIADLO CCC[C@H]1CCC[N@@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001616158817 1056616705 /nfs/dbraw/zinc/61/67/05/1056616705.db2.gz KARLGLLVUCJLTH-XJKSGUPXSA-N 1 2 309.837 4.066 20 0 DIADLO CCC[C@H]1CCC[N@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001616158817 1056616716 /nfs/dbraw/zinc/61/67/16/1056616716.db2.gz KARLGLLVUCJLTH-XJKSGUPXSA-N 1 2 309.837 4.066 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1Cc1ccc(Cl)cn1 ZINC001616402642 1056650694 /nfs/dbraw/zinc/65/06/94/1056650694.db2.gz MNIINLYSJDHFGT-VXGBXAGGSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1Cc1ccc(Cl)cn1 ZINC001616402642 1056650696 /nfs/dbraw/zinc/65/06/96/1056650696.db2.gz MNIINLYSJDHFGT-VXGBXAGGSA-N 1 2 304.796 4.382 20 0 DIADLO Nc1cn2ccc(-c3ccc(OCc4ccccc4)cc3)cc2[nH+]1 ZINC001240748454 1056678449 /nfs/dbraw/zinc/67/84/49/1056678449.db2.gz MRXFDVHBFDOWTG-UHFFFAOYSA-N 1 2 315.376 4.163 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+]2CCC[C@@H]2c2ccsc2)n1 ZINC000076989706 1056679859 /nfs/dbraw/zinc/67/98/59/1056679859.db2.gz HRZUZZCOQFTWOV-GXTWGEPZSA-N 1 2 305.447 4.372 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+]2CCC[C@@H]2c2ccsc2)n1 ZINC000076989706 1056679868 /nfs/dbraw/zinc/67/98/68/1056679868.db2.gz HRZUZZCOQFTWOV-GXTWGEPZSA-N 1 2 305.447 4.372 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2cccnc2)cc1F ZINC001616592425 1056682353 /nfs/dbraw/zinc/68/23/53/1056682353.db2.gz HDXZVWCUNUNFCR-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2cccnc2)cc1F ZINC001616592425 1056682363 /nfs/dbraw/zinc/68/23/63/1056682363.db2.gz HDXZVWCUNUNFCR-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C(C)C)ns1)c1ccc(C)c(F)c1 ZINC001616623890 1056688460 /nfs/dbraw/zinc/68/84/60/1056688460.db2.gz WJKGWVMAWKYKQG-CQSZACIVSA-N 1 2 307.438 4.350 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)cc1-c1ccc(C(F)F)cc1 ZINC001240771299 1056692026 /nfs/dbraw/zinc/69/20/26/1056692026.db2.gz RYUJBOZDZBOKGM-UHFFFAOYSA-N 1 2 321.342 4.263 20 0 DIADLO CC(C)N1CCCC[C@@H]1C[NH2+][C@H](C)c1c(F)cccc1Cl ZINC001616662914 1056696785 /nfs/dbraw/zinc/69/67/85/1056696785.db2.gz VDLNNAINUNUPJG-ZIAGYGMSSA-N 1 2 312.860 4.393 20 0 DIADLO COc1ccc(C(F)(F)F)cc1-c1ccc2[nH+]ccn2c1C ZINC001240826904 1056722439 /nfs/dbraw/zinc/72/24/39/1056722439.db2.gz NEVZTZFEIRGYRZ-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Cc1cc2c[nH+]c(-c3ccc(Oc4cccnc4)cc3)nc2[nH]1 ZINC001240879612 1056736321 /nfs/dbraw/zinc/73/63/21/1056736321.db2.gz OKJLUBVQFLJUHQ-UHFFFAOYSA-N 1 2 302.337 4.072 20 0 DIADLO Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+][C@H]1CCCC1(F)F ZINC000672622447 1056737967 /nfs/dbraw/zinc/73/79/67/1056737967.db2.gz IXBPQFBMJWYZSI-GWCFXTLKSA-N 1 2 323.412 4.352 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H]2CCCC2(F)F)ccc1SC ZINC000672621930 1056741335 /nfs/dbraw/zinc/74/13/35/1056741335.db2.gz OQAAQUYGPMHYGE-HZMBPMFUSA-N 1 2 301.402 4.256 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H]2CCCC2(F)F)ccc1SC ZINC000672621933 1056741048 /nfs/dbraw/zinc/74/10/48/1056741048.db2.gz OQAAQUYGPMHYGE-YGRLFVJLSA-N 1 2 301.402 4.256 20 0 DIADLO C[N@H+](Cc1ccc(Cl)c(F)c1)Cc1cc(O)ccc1Cl ZINC001616935580 1056744297 /nfs/dbraw/zinc/74/42/97/1056744297.db2.gz FHRSXMFONFPEJM-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)c(F)c1)Cc1cc(O)ccc1Cl ZINC001616935580 1056744310 /nfs/dbraw/zinc/74/43/10/1056744310.db2.gz FHRSXMFONFPEJM-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1ccc(Cl)c(F)c1 ZINC001616935505 1056744575 /nfs/dbraw/zinc/74/45/75/1056744575.db2.gz BACSIURDNLJCGE-CQSZACIVSA-N 1 2 315.816 4.031 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC001616935505 1056744583 /nfs/dbraw/zinc/74/45/83/1056744583.db2.gz BACSIURDNLJCGE-CQSZACIVSA-N 1 2 315.816 4.031 20 0 DIADLO Cn1nc(C(F)(F)F)cc1C[N@@H+]1CCCC[C@@H]1c1ccccc1 ZINC001616975329 1056751194 /nfs/dbraw/zinc/75/11/94/1056751194.db2.gz YWTXACLYIIACGB-OAHLLOKOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1nc(C(F)(F)F)cc1C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC001616975329 1056751205 /nfs/dbraw/zinc/75/12/05/1056751205.db2.gz YWTXACLYIIACGB-OAHLLOKOSA-N 1 2 323.362 4.166 20 0 DIADLO Cc1[nH]c(CN[C@H](CC(F)(F)F)c2ccc(C)cc2)[nH+]c1C ZINC001616981293 1056751650 /nfs/dbraw/zinc/75/16/50/1056751650.db2.gz KGXWXPRPJUKWTP-CQSZACIVSA-N 1 2 311.351 4.118 20 0 DIADLO Cc1nc(C[NH2+][C@H](CC(F)(F)F)c2ccc(C)cc2)[nH]c1C ZINC001616981293 1056751661 /nfs/dbraw/zinc/75/16/61/1056751661.db2.gz KGXWXPRPJUKWTP-CQSZACIVSA-N 1 2 311.351 4.118 20 0 DIADLO CCc1cccc(C[N@@H+]2CCO[C@H](c3cccc(Cl)c3)C2)c1 ZINC001617013509 1056759702 /nfs/dbraw/zinc/75/97/02/1056759702.db2.gz DQWAWOKQDVHKGP-IBGZPJMESA-N 1 2 315.844 4.476 20 0 DIADLO CCc1cccc(C[N@H+]2CCO[C@H](c3cccc(Cl)c3)C2)c1 ZINC001617013509 1056759717 /nfs/dbraw/zinc/75/97/17/1056759717.db2.gz DQWAWOKQDVHKGP-IBGZPJMESA-N 1 2 315.844 4.476 20 0 DIADLO CC(C)OC(=O)c1cccc(-c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001240946839 1056774656 /nfs/dbraw/zinc/77/46/56/1056774656.db2.gz YTTSPQBGKHFNTJ-UHFFFAOYSA-N 1 2 306.365 4.105 20 0 DIADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1nccc(Cl)c1Cl ZINC001617130367 1056780652 /nfs/dbraw/zinc/78/06/52/1056780652.db2.gz DPYBYMWVCDDLSO-SNVBAGLBSA-N 1 2 310.228 4.197 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1ccc(F)c(Cl)c1 ZINC001617197651 1056790772 /nfs/dbraw/zinc/79/07/72/1056790772.db2.gz BNPSIASZPJNSPQ-AWEZNQCLSA-N 1 2 315.816 4.031 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC001617197651 1056790781 /nfs/dbraw/zinc/79/07/81/1056790781.db2.gz BNPSIASZPJNSPQ-AWEZNQCLSA-N 1 2 315.816 4.031 20 0 DIADLO CCC(C)(C)c1ccccc1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001586807974 1056809855 /nfs/dbraw/zinc/80/98/55/1056809855.db2.gz ILZQXIBEDXFHTI-UHFFFAOYSA-N 1 2 307.397 4.274 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2noc(C3CCC3)n2)CC12CCCCC2 ZINC001617382101 1056823310 /nfs/dbraw/zinc/82/33/10/1056823310.db2.gz OVTMXNRPJNCCFV-CQSZACIVSA-N 1 2 303.450 4.129 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2noc(C3CCC3)n2)CC12CCCCC2 ZINC001617382101 1056823312 /nfs/dbraw/zinc/82/33/12/1056823312.db2.gz OVTMXNRPJNCCFV-CQSZACIVSA-N 1 2 303.450 4.129 20 0 DIADLO COc1ccc(-c2cccc(-c3c[nH+]cn3C)c2)c(F)c1F ZINC001241045757 1056841803 /nfs/dbraw/zinc/84/18/03/1056841803.db2.gz UYJOFJQHSJWICH-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO CCCCc1ccc(-c2ccc(-n3c[nH+]c(C)c3C)nn2)cc1 ZINC001241052902 1056848683 /nfs/dbraw/zinc/84/86/83/1056848683.db2.gz OCBTWGWUTHBTEL-UHFFFAOYSA-N 1 2 306.413 4.289 20 0 DIADLO CCOc1cc(-c2cc[nH+]c(N3CCCCC3)c2)ccc1F ZINC001241069320 1056861634 /nfs/dbraw/zinc/86/16/34/1056861634.db2.gz LCJLGYHIUFNGFZ-UHFFFAOYSA-N 1 2 300.377 4.277 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@@H](C)c2ccccc2C(F)(F)F)n1 ZINC000114750100 1056873080 /nfs/dbraw/zinc/87/30/80/1056873080.db2.gz LLEMRHMETUKOCO-UWVGGRQHSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2occc2Br)cn1 ZINC001143128705 1056877726 /nfs/dbraw/zinc/87/77/26/1056877726.db2.gz SGNMIGHUEGVTCN-AWEZNQCLSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2occc2Br)cn1 ZINC001143128705 1056877733 /nfs/dbraw/zinc/87/77/33/1056877733.db2.gz SGNMIGHUEGVTCN-AWEZNQCLSA-N 1 2 321.218 4.083 20 0 DIADLO COc1ccc(-c2cn3cc[nH+]c3cc2OC)cc1C(F)(F)F ZINC001241092255 1056885018 /nfs/dbraw/zinc/88/50/18/1056885018.db2.gz PLGFHQZIQFBNDZ-UHFFFAOYSA-N 1 2 322.286 4.037 20 0 DIADLO Fc1ccc(-c2cc(-n3ccnc3)cc[nH+]2)c(C(F)(F)F)c1 ZINC001241123983 1056908448 /nfs/dbraw/zinc/90/84/48/1056908448.db2.gz FOKWDTPTZMQLHI-UHFFFAOYSA-N 1 2 307.250 4.092 20 0 DIADLO CCCCOCC[N@H+](C)[C@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC001618012984 1056914108 /nfs/dbraw/zinc/91/41/08/1056914108.db2.gz UVKSTAWTZVXKDE-GFCCVEGCSA-N 1 2 309.841 4.026 20 0 DIADLO CCCCOCC[N@@H+](C)[C@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC001618012984 1056914115 /nfs/dbraw/zinc/91/41/15/1056914115.db2.gz UVKSTAWTZVXKDE-GFCCVEGCSA-N 1 2 309.841 4.026 20 0 DIADLO C[N@H+](Cc1cc(-c2ccc(Cl)cc2)no1)Cc1ccccn1 ZINC001618165132 1056927952 /nfs/dbraw/zinc/92/79/52/1056927952.db2.gz DVWZCGSXHUFCEH-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccc(Cl)cc2)no1)Cc1ccccn1 ZINC001618165132 1056927963 /nfs/dbraw/zinc/92/79/63/1056927963.db2.gz DVWZCGSXHUFCEH-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO Cc1occc1C[NH2+]Cc1csc(-c2ccc(F)cc2)n1 ZINC000067217863 1056928623 /nfs/dbraw/zinc/92/86/23/1056928623.db2.gz USNBSVHMEPRYOK-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO Nc1[nH+]cccc1-c1cc(F)c(OCc2ccccc2)cc1F ZINC001241181378 1056949178 /nfs/dbraw/zinc/94/91/78/1056949178.db2.gz HPAHSDVZIDBGHP-UHFFFAOYSA-N 1 2 312.319 4.188 20 0 DIADLO Cc1ccc(C)c(-c2ncnc3c2C[N@H+](Cc2ccccc2)C3)c1 ZINC001241189768 1056950968 /nfs/dbraw/zinc/95/09/68/1056950968.db2.gz OFDJYXUVXIZVRQ-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1ccc(C)c(-c2ncnc3c2C[N@@H+](Cc2ccccc2)C3)c1 ZINC001241189768 1056950972 /nfs/dbraw/zinc/95/09/72/1056950972.db2.gz OFDJYXUVXIZVRQ-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1cccc(O[C@@H]2CCCCO2)c1 ZINC001241212391 1056961413 /nfs/dbraw/zinc/96/14/13/1056961413.db2.gz HDTZDZCLVXOQRV-LJQANCHMSA-N 1 2 324.380 4.144 20 0 DIADLO c1cn(-c2ccc(-c3cccc(O[C@H]4CCCCO4)c3)cc2)c[nH+]1 ZINC001241215095 1056963909 /nfs/dbraw/zinc/96/39/09/1056963909.db2.gz WWLQOBNQFMXURM-FQEVSTJZSA-N 1 2 320.392 4.445 20 0 DIADLO Fc1cnccc1-c1[nH+]ccc2c1ccn2Cc1ccccc1 ZINC001241225505 1056969351 /nfs/dbraw/zinc/96/93/51/1056969351.db2.gz RBDCOVSWBYMFDB-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO COCc1nc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)cs1 ZINC000358020398 1056971303 /nfs/dbraw/zinc/97/13/03/1056971303.db2.gz NFTXGCWNMCIHBC-MRXNPFEDSA-N 1 2 302.443 4.017 20 0 DIADLO COCc1nc(C[N@H+]2CCCC[C@@H]2c2ccccc2)cs1 ZINC000358020398 1056971308 /nfs/dbraw/zinc/97/13/08/1056971308.db2.gz NFTXGCWNMCIHBC-MRXNPFEDSA-N 1 2 302.443 4.017 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ncccc1OCc1ccccc1 ZINC001241235746 1056972617 /nfs/dbraw/zinc/97/26/17/1056972617.db2.gz SJLGAXNFUUOKKF-UHFFFAOYSA-N 1 2 319.408 4.097 20 0 DIADLO CCOc1ccc(OC)cc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001241240465 1056976932 /nfs/dbraw/zinc/97/69/32/1056976932.db2.gz LEHWQLVFKLIDFP-UHFFFAOYSA-N 1 2 308.381 4.006 20 0 DIADLO COc1ccc(-c2ccccn2)cc1-c1c[nH+]c(N(C)C)cc1C ZINC001241248177 1056978858 /nfs/dbraw/zinc/97/88/58/1056978858.db2.gz DKNWDEMUWLQPRQ-UHFFFAOYSA-N 1 2 319.408 4.194 20 0 DIADLO CCOc1cccc(F)c1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001241253465 1056982273 /nfs/dbraw/zinc/98/22/73/1056982273.db2.gz FKYPVWDSIOBICH-UHFFFAOYSA-N 1 2 309.331 4.231 20 0 DIADLO c1csc(-c2cc(C[N@@H+]3CCC=C(c4cccnc4)C3)no2)c1 ZINC000347701040 1056983812 /nfs/dbraw/zinc/98/38/12/1056983812.db2.gz BZMHPTHRFVECMY-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO c1csc(-c2cc(C[N@H+]3CCC=C(c4cccnc4)C3)no2)c1 ZINC000347701040 1056983814 /nfs/dbraw/zinc/98/38/14/1056983814.db2.gz BZMHPTHRFVECMY-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO CC(C)OC(=O)c1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc1 ZINC001241286556 1056997342 /nfs/dbraw/zinc/99/73/42/1056997342.db2.gz QKGPIZRWPFAHEQ-UHFFFAOYSA-N 1 2 324.355 4.244 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cccc(C(C)(C)C)c3)nn2)c1C ZINC001241301214 1057004255 /nfs/dbraw/zinc/00/42/55/1057004255.db2.gz SAAVXONYMMFHBX-UHFFFAOYSA-N 1 2 306.413 4.244 20 0 DIADLO Cc1cc(-c2c(F)cccc2OCc2ccccc2)c[nH+]c1N ZINC001241306129 1057006124 /nfs/dbraw/zinc/00/61/24/1057006124.db2.gz GIASXYNQYWIJIT-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO CCSc1ccc(C[NH2+]Cc2nc(C(C)(C)C)co2)cc1 ZINC000922333394 1057011249 /nfs/dbraw/zinc/01/12/49/1057011249.db2.gz XBMCBYYHDMMEMN-UHFFFAOYSA-N 1 2 304.459 4.374 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000118002267 1057012856 /nfs/dbraw/zinc/01/28/56/1057012856.db2.gz IDGKEVLTKKOLFE-CQSZACIVSA-N 1 2 311.385 4.221 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000118002267 1057012857 /nfs/dbraw/zinc/01/28/57/1057012857.db2.gz IDGKEVLTKKOLFE-CQSZACIVSA-N 1 2 311.385 4.221 20 0 DIADLO C[C@@H](CC(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccccc1F ZINC000338856306 1057024976 /nfs/dbraw/zinc/02/49/76/1057024976.db2.gz JHUMBXOZHKZUGF-AWEZNQCLSA-N 1 2 323.371 4.144 20 0 DIADLO Cc1cccc2[nH]c(C[NH2+][C@H]3c4ccccc4OC[C@@H]3F)cc21 ZINC000922522900 1057030413 /nfs/dbraw/zinc/03/04/13/1057030413.db2.gz XBEVCIAUKVLGER-LPHOPBHVSA-N 1 2 310.372 4.038 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccccc1COC(C)(C)C ZINC000922550041 1057031146 /nfs/dbraw/zinc/03/11/46/1057031146.db2.gz BQLWJFBWGOXULF-UHFFFAOYSA-N 1 2 301.434 4.391 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@H](c2ccccn2)C2CC2)cs1 ZINC000922586886 1057037789 /nfs/dbraw/zinc/03/77/89/1057037789.db2.gz SUVJFUPYPDHEPU-HNNXBMFYSA-N 1 2 301.459 4.077 20 0 DIADLO Fc1c(F)c(F)c(-c2ccc(-n3cc[nH+]c3)cc2)c(F)c1F ZINC001241407894 1057043198 /nfs/dbraw/zinc/04/31/98/1057043198.db2.gz VZSQERDAOPXFGG-UHFFFAOYSA-N 1 2 310.225 4.235 20 0 DIADLO C[C@H]([NH2+]Cc1cnc([C@@H]2CCCO2)s1)c1c(F)cccc1F ZINC000922651998 1057045331 /nfs/dbraw/zinc/04/53/31/1057045331.db2.gz JJZJZPGQHJQYSI-HZMBPMFUSA-N 1 2 324.396 4.124 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC=C(c3cccnc3)C2)cs1 ZINC000347739094 1057062633 /nfs/dbraw/zinc/06/26/33/1057062633.db2.gz YBMKSCJBPWWSCI-UHFFFAOYSA-N 1 2 313.470 4.170 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC=C(c3cccnc3)C2)cs1 ZINC000347739094 1057062636 /nfs/dbraw/zinc/06/26/36/1057062636.db2.gz YBMKSCJBPWWSCI-UHFFFAOYSA-N 1 2 313.470 4.170 20 0 DIADLO C[C@H](CF)[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000673619146 1057063809 /nfs/dbraw/zinc/06/38/09/1057063809.db2.gz IXASRIISJGLUTM-SECBINFHSA-N 1 2 318.339 4.277 20 0 DIADLO CC(C)[N@@H+](Cc1coc(-c2ccccc2F)n1)Cc1ccco1 ZINC000625108205 1057088424 /nfs/dbraw/zinc/08/84/24/1057088424.db2.gz DNTDGMXLCCIJHC-UHFFFAOYSA-N 1 2 314.360 4.484 20 0 DIADLO CC(C)[N@H+](Cc1coc(-c2ccccc2F)n1)Cc1ccco1 ZINC000625108205 1057088434 /nfs/dbraw/zinc/08/84/34/1057088434.db2.gz DNTDGMXLCCIJHC-UHFFFAOYSA-N 1 2 314.360 4.484 20 0 DIADLO Cc1ccccc1-c1noc(C[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)n1 ZINC000673714297 1057119955 /nfs/dbraw/zinc/11/99/55/1057119955.db2.gz VVGRHJRMIXMUDE-DNVCBOLYSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccccc1-c1noc(C[N@@H+]2C[C@@H](C)[C@@H]2c2ccccc2)n1 ZINC000673714297 1057119959 /nfs/dbraw/zinc/11/99/59/1057119959.db2.gz VVGRHJRMIXMUDE-DNVCBOLYSA-N 1 2 319.408 4.238 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2ccsc2)n1)c1ccccn1 ZINC000057594851 1057152654 /nfs/dbraw/zinc/15/26/54/1057152654.db2.gz VTPZKCATAIYEFI-NSHDSACASA-N 1 2 301.440 4.117 20 0 DIADLO COc1cc(-c2cc(F)c(C[NH+](C)C)c(F)c2)ccc1Cl ZINC001241739699 1057153044 /nfs/dbraw/zinc/15/30/44/1057153044.db2.gz ZKCZIDIDARUEQU-UHFFFAOYSA-N 1 2 311.759 4.355 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cc2ccncc2s1 ZINC000657954471 1057156253 /nfs/dbraw/zinc/15/62/53/1057156253.db2.gz UZSUREPWMNLGOQ-ZDUSSCGKSA-N 1 2 324.453 4.465 20 0 DIADLO c1[nH+]c(-c2ccc(N[C@H]3COC4(CCC4)C3)cc2)n2c1CCCC2 ZINC000657961619 1057161149 /nfs/dbraw/zinc/16/11/49/1057161149.db2.gz SGNMVBLREJCCNS-QGZVFWFLSA-N 1 2 323.440 4.010 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(-c3ccco3)n2)C[C@H](C)C1(F)F ZINC000625648709 1057183820 /nfs/dbraw/zinc/18/38/20/1057183820.db2.gz RVSQDCITWRREHX-PHIMTYICSA-N 1 2 312.385 4.126 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(-c3ccco3)n2)C[C@H](C)C1(F)F ZINC000625648709 1057183822 /nfs/dbraw/zinc/18/38/22/1057183822.db2.gz RVSQDCITWRREHX-PHIMTYICSA-N 1 2 312.385 4.126 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CCC[C@@H](c3ccc(F)c(F)c3)C2)s1 ZINC000625654117 1057183944 /nfs/dbraw/zinc/18/39/44/1057183944.db2.gz BSZGEBMSNSKPEX-ZWNOBZJWSA-N 1 2 323.412 4.065 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CCC[C@@H](c3ccc(F)c(F)c3)C2)s1 ZINC000625654117 1057183949 /nfs/dbraw/zinc/18/39/49/1057183949.db2.gz BSZGEBMSNSKPEX-ZWNOBZJWSA-N 1 2 323.412 4.065 20 0 DIADLO c1cn(Cc2ccc(-c3cnn(C4CCCCC4)c3)cc2)c[nH+]1 ZINC001241844743 1057187943 /nfs/dbraw/zinc/18/79/43/1057187943.db2.gz SGXRIXFJGIEFRB-UHFFFAOYSA-N 1 2 306.413 4.300 20 0 DIADLO COc1cccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1Cl ZINC001241859705 1057194273 /nfs/dbraw/zinc/19/42/73/1057194273.db2.gz DXXKIGDIDVPLGY-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO Cc1ccccc1C1(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)CC1 ZINC000171036412 1057205867 /nfs/dbraw/zinc/20/58/67/1057205867.db2.gz QYKJOWQPLQDIGO-UHFFFAOYSA-N 1 2 317.392 4.055 20 0 DIADLO CCCOc1ccc(C[NH2+]C2(C(F)F)CCCC2)cc1OC ZINC000674132110 1057209290 /nfs/dbraw/zinc/20/92/90/1057209290.db2.gz XUQKVTRSELDJNO-UHFFFAOYSA-N 1 2 313.388 4.152 20 0 DIADLO C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1n[nH]c2ccccc21 ZINC000674336036 1057232179 /nfs/dbraw/zinc/23/21/79/1057232179.db2.gz WSGXBYRIHBTPBR-HXPMCKFVSA-N 1 2 309.388 4.115 20 0 DIADLO CCOC(=O)c1nc2ccc(-c3cc(C)[nH+]c(C)c3)cc2s1 ZINC001241996556 1057234897 /nfs/dbraw/zinc/23/48/97/1057234897.db2.gz VPHWHYWYPDJZLZ-UHFFFAOYSA-N 1 2 312.394 4.152 20 0 DIADLO COc1cccc2[nH]c(-c3ccccc3Cn3cc[nH+]c3)cc21 ZINC001242000765 1057236214 /nfs/dbraw/zinc/23/62/14/1057236214.db2.gz WEWCTFOYGLZYAS-UHFFFAOYSA-N 1 2 303.365 4.088 20 0 DIADLO CCc1cccc2c(CC(=O)Nc3c(C)cc(C)[nH+]c3C)c[nH]c21 ZINC000171789914 1057241604 /nfs/dbraw/zinc/24/16/04/1057241604.db2.gz MRDDAXDVXXVYQN-UHFFFAOYSA-N 1 2 321.424 4.232 20 0 DIADLO CO[C@@H](C)c1cccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)c1 ZINC001242040690 1057247310 /nfs/dbraw/zinc/24/73/10/1057247310.db2.gz OLXILPKYPQTKJO-LBPRGKRZSA-N 1 2 305.368 4.401 20 0 DIADLO CC(C)Oc1ccc(-c2c[nH+]c3c(c2)CCCN3)c(Cl)c1 ZINC001242088827 1057260193 /nfs/dbraw/zinc/26/01/93/1057260193.db2.gz LXHYCWHGFOFACW-UHFFFAOYSA-N 1 2 302.805 4.190 20 0 DIADLO Oc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1C(F)(F)F ZINC001242158390 1057284403 /nfs/dbraw/zinc/28/44/03/1057284403.db2.gz WBXQPOSNHKWIRD-UHFFFAOYSA-N 1 2 304.271 4.264 20 0 DIADLO CCCC1(C(=O)Oc2ccc(-c3[nH+]cc4n3CCCC4)cc2)CC1 ZINC001128841212 1057288937 /nfs/dbraw/zinc/28/89/37/1057288937.db2.gz LXQKIKYPTKWTEH-UHFFFAOYSA-N 1 2 324.424 4.372 20 0 DIADLO CC(C)Oc1ccc(-c2cc[nH+]c(N3CCCC3)c2)cc1F ZINC001242199012 1057290662 /nfs/dbraw/zinc/29/06/62/1057290662.db2.gz PLSBNUHAWVPGQZ-UHFFFAOYSA-N 1 2 300.377 4.275 20 0 DIADLO Cc1ccc(C[N@H+](Cc2nc3cc(F)ccc3o2)C2CC2)o1 ZINC000674904118 1057297899 /nfs/dbraw/zinc/29/78/99/1057297899.db2.gz JXULPTMYRHDNRQ-UHFFFAOYSA-N 1 2 300.333 4.033 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2nc3cc(F)ccc3o2)C2CC2)o1 ZINC000674904118 1057297902 /nfs/dbraw/zinc/29/79/02/1057297902.db2.gz JXULPTMYRHDNRQ-UHFFFAOYSA-N 1 2 300.333 4.033 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccccc1OC(C)C ZINC001242224175 1057299646 /nfs/dbraw/zinc/29/96/46/1057299646.db2.gz JDQPNMMCVQONSR-UHFFFAOYSA-N 1 2 308.381 4.335 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cccnc1OC1CCCCC1 ZINC001242229462 1057303463 /nfs/dbraw/zinc/30/34/63/1057303463.db2.gz TWSYPRBVNHQGFP-UHFFFAOYSA-N 1 2 307.397 4.416 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@H]2COc3c2cccc3Cl)o1 ZINC000675103577 1057315524 /nfs/dbraw/zinc/31/55/24/1057315524.db2.gz XHGRVTFZEZEFHR-YVLXSGLVSA-N 1 2 303.789 4.280 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(F)c(C)c(F)c1 ZINC001242288373 1057322250 /nfs/dbraw/zinc/32/22/50/1057322250.db2.gz HUSHAWCXASLENB-UHFFFAOYSA-N 1 2 300.308 4.135 20 0 DIADLO Fc1cc(F)c(-c2ccccc2C[NH+]2CCOCC2)cc1Cl ZINC001242291474 1057323688 /nfs/dbraw/zinc/32/36/88/1057323688.db2.gz PRIYFKYKOWSKMR-UHFFFAOYSA-N 1 2 323.770 4.117 20 0 DIADLO C[N@@H+]1CCCC[C@@H]1c1ccc(-c2cccc(Cl)c2O)nc1 ZINC001242365904 1057346981 /nfs/dbraw/zinc/34/69/81/1057346981.db2.gz VNRRGRPDVVZHRO-MRXNPFEDSA-N 1 2 302.805 4.264 20 0 DIADLO C[N@H+]1CCCC[C@@H]1c1ccc(-c2cccc(Cl)c2O)nc1 ZINC001242365904 1057346987 /nfs/dbraw/zinc/34/69/87/1057346987.db2.gz VNRRGRPDVVZHRO-MRXNPFEDSA-N 1 2 302.805 4.264 20 0 DIADLO Fc1ccc(-c2cccnc2C(F)(F)F)cc1-n1cc[nH+]c1 ZINC001242376782 1057353647 /nfs/dbraw/zinc/35/36/47/1057353647.db2.gz NIXLQXQAPQYYQJ-UHFFFAOYSA-N 1 2 307.250 4.092 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(Oc2ccccc2)cn1)c1nccn1C ZINC000658340193 1057380008 /nfs/dbraw/zinc/38/00/08/1057380008.db2.gz ZDONLKGQFDCMMO-GJZGRUSLSA-N 1 2 322.412 4.019 20 0 DIADLO CC(C)CC[C@@H]1CCCCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000675531959 1057384908 /nfs/dbraw/zinc/38/49/08/1057384908.db2.gz HSXGBJDMYZJOHR-INIZCTEOSA-N 1 2 314.433 4.157 20 0 DIADLO CC(C)[C@H]1c2ccccc2CC[N@H+]1Cc1nccn1C(F)F ZINC000675642817 1057390941 /nfs/dbraw/zinc/39/09/41/1057390941.db2.gz OLAMHBDBKOCQJZ-INIZCTEOSA-N 1 2 305.372 4.034 20 0 DIADLO CC(C)[C@H]1c2ccccc2CC[N@@H+]1Cc1nccn1C(F)F ZINC000675642817 1057390947 /nfs/dbraw/zinc/39/09/47/1057390947.db2.gz OLAMHBDBKOCQJZ-INIZCTEOSA-N 1 2 305.372 4.034 20 0 DIADLO COc1cc(F)c(F)cc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001242578126 1057412490 /nfs/dbraw/zinc/41/24/90/1057412490.db2.gz DDNYNXCSUFIHJS-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO CCC1(CC)CCC([NH2+][C@@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000675965038 1057438028 /nfs/dbraw/zinc/43/80/28/1057438028.db2.gz KTVFCYGRWTYLPB-QGZVFWFLSA-N 1 2 312.461 4.233 20 0 DIADLO C[C@H](c1c(F)cccc1F)[NH+]1CC(c2nc3ccccc3[nH]2)C1 ZINC000675975502 1057440343 /nfs/dbraw/zinc/44/03/43/1057440343.db2.gz OLLUGZIGFULICJ-LLVKDONJSA-N 1 2 313.351 4.002 20 0 DIADLO Cc1cn2c(cccc2-c2ccc(OCC(F)(F)F)cc2)[nH+]1 ZINC001242718722 1057458652 /nfs/dbraw/zinc/45/86/52/1057458652.db2.gz HPBZDXLHNNFEAF-UHFFFAOYSA-N 1 2 306.287 4.251 20 0 DIADLO Cc1ccoc1CNc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000676320293 1057464923 /nfs/dbraw/zinc/46/49/23/1057464923.db2.gz RHVONLMPIZWHBN-UHFFFAOYSA-N 1 2 307.397 4.400 20 0 DIADLO CCO[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2OC)C1 ZINC000676414283 1057470461 /nfs/dbraw/zinc/47/04/61/1057470461.db2.gz RYUXYICZJFWAQF-CYBMUJFWSA-N 1 2 318.244 4.003 20 0 DIADLO CCO[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2OC)C1 ZINC000676414283 1057470463 /nfs/dbraw/zinc/47/04/63/1057470463.db2.gz RYUXYICZJFWAQF-CYBMUJFWSA-N 1 2 318.244 4.003 20 0 DIADLO Cc1ccc([C@H](CNCc2cscc2Cl)[NH+]2CCCC2)o1 ZINC000676416564 1057471554 /nfs/dbraw/zinc/47/15/54/1057471554.db2.gz OREMHDWQIQZAPK-HNNXBMFYSA-N 1 2 324.877 4.230 20 0 DIADLO CC(C)COC[C@@H]([NH2+]Cc1cscc1Cl)c1ccco1 ZINC000676416817 1057472097 /nfs/dbraw/zinc/47/20/97/1057472097.db2.gz VEZORXHHGGBKBT-CQSZACIVSA-N 1 2 313.850 4.498 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc(OC2CC2)c1 ZINC001242806111 1057484734 /nfs/dbraw/zinc/48/47/34/1057484734.db2.gz XRZKIQHMLDJTMO-UHFFFAOYSA-N 1 2 306.365 4.089 20 0 DIADLO O=C1CCCc2ccc(-c3cc[nH+]c(N4CCCCC4)c3)cc21 ZINC001242857656 1057502206 /nfs/dbraw/zinc/50/22/06/1057502206.db2.gz WCPYZKAFGPQYHI-UHFFFAOYSA-N 1 2 306.409 4.258 20 0 DIADLO O=C1CCCc2ccc(-c3ccccc3Cn3cc[nH+]c3)cc21 ZINC001242857909 1057502356 /nfs/dbraw/zinc/50/23/56/1057502356.db2.gz OHHSBDRPZMDATQ-UHFFFAOYSA-N 1 2 302.377 4.117 20 0 DIADLO Sc1cccc(-c2ccc(SC3CC[NH2+]CC3)cc2)c1 ZINC001242867640 1057505317 /nfs/dbraw/zinc/50/53/17/1057505317.db2.gz NIZXQBPTRMLGIH-UHFFFAOYSA-N 1 2 301.480 4.486 20 0 DIADLO Cc1ccc2ccccc2c1-c1c[nH+]c(N2CCOCC2)cc1C ZINC001242981462 1057534317 /nfs/dbraw/zinc/53/43/17/1057534317.db2.gz HBCOZDAUCMUZJI-UHFFFAOYSA-N 1 2 318.420 4.355 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1cccc(-c2cccnc2)c1 ZINC001243001224 1057542874 /nfs/dbraw/zinc/54/28/74/1057542874.db2.gz NIADBDCRHNBELK-UHFFFAOYSA-N 1 2 301.349 4.301 20 0 DIADLO FC(F)(F)c1ccc2c(c1)CC[N@@H+](Cc1cc(C3CC3)no1)C2 ZINC000626008031 1057548482 /nfs/dbraw/zinc/54/84/82/1057548482.db2.gz FGQSIKSWBNGFEJ-UHFFFAOYSA-N 1 2 322.330 4.129 20 0 DIADLO FC(F)(F)c1ccc2c(c1)CC[N@H+](Cc1cc(C3CC3)no1)C2 ZINC000626008031 1057548492 /nfs/dbraw/zinc/54/84/92/1057548492.db2.gz FGQSIKSWBNGFEJ-UHFFFAOYSA-N 1 2 322.330 4.129 20 0 DIADLO Cc1cc(N)nc(S[C@@H](Cc2ccccc2)c2ccccc2)[nH+]1 ZINC000496518712 1057555879 /nfs/dbraw/zinc/55/58/79/1057555879.db2.gz QNUBTRKJODGLFB-KRWDZBQOSA-N 1 2 321.449 4.443 20 0 DIADLO Cc1c[nH]c2ccc(-c3cc(F)ccc3C[NH+]3CCOCC3)cc12 ZINC001243084249 1057565802 /nfs/dbraw/zinc/56/58/02/1057565802.db2.gz HRZZBIXCCGLEKP-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)c(-c2cccc(C(F)F)c2)c1 ZINC001243086629 1057566288 /nfs/dbraw/zinc/56/62/88/1057566288.db2.gz UONWGWXMRHRWQF-UHFFFAOYSA-N 1 2 321.342 4.263 20 0 DIADLO CC(C)c1cc(Br)ccc1OCc1ccc[nH+]c1N ZINC000136480674 1057566744 /nfs/dbraw/zinc/56/67/44/1057566744.db2.gz BQPUBWMHYSWEBT-UHFFFAOYSA-N 1 2 321.218 4.129 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1nc(-c2ccccc2)no1 ZINC000016431208 1057569296 /nfs/dbraw/zinc/56/92/96/1057569296.db2.gz PTBFYUMXTIOCCH-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc(-c2ccccc2)no1 ZINC000016431208 1057569299 /nfs/dbraw/zinc/56/92/99/1057569299.db2.gz PTBFYUMXTIOCCH-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO CCCCOc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)c(C)c1 ZINC001243092448 1057569741 /nfs/dbraw/zinc/56/97/41/1057569741.db2.gz WZNGCJGWOMHPHW-UHFFFAOYSA-N 1 2 321.424 4.481 20 0 DIADLO CCc1cccc(NC(=O)c2cccc(-n3cc[nH+]c3)c2)c1CC ZINC000489562424 1057592543 /nfs/dbraw/zinc/59/25/43/1057592543.db2.gz OWIQSENUFCVAEE-UHFFFAOYSA-N 1 2 319.408 4.249 20 0 DIADLO C[C@@H]1C[N@H+](Cc2scnc2C2CC2)C[C@H](c2ccsc2)O1 ZINC000494929987 1057619739 /nfs/dbraw/zinc/61/97/39/1057619739.db2.gz MRXPWLINQXWNDC-BXUZGUMPSA-N 1 2 320.483 4.044 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2scnc2C2CC2)C[C@H](c2ccsc2)O1 ZINC000494929987 1057619741 /nfs/dbraw/zinc/61/97/41/1057619741.db2.gz MRXPWLINQXWNDC-BXUZGUMPSA-N 1 2 320.483 4.044 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1scnc1C1CC1 ZINC000495065733 1057620626 /nfs/dbraw/zinc/62/06/26/1057620626.db2.gz FXDJBFHUAJAAFP-UHFFFAOYSA-N 1 2 322.861 4.315 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1scnc1C1CC1 ZINC000495065733 1057620630 /nfs/dbraw/zinc/62/06/30/1057620630.db2.gz FXDJBFHUAJAAFP-UHFFFAOYSA-N 1 2 322.861 4.315 20 0 DIADLO CCCN(CCC)C(=O)c1ccc(-c2ccc3[nH+]ccn3c2)cc1 ZINC001243257516 1057622499 /nfs/dbraw/zinc/62/24/99/1057622499.db2.gz QKQIMOJQPYTVRB-UHFFFAOYSA-N 1 2 321.424 4.264 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1scnc1C1CC1 ZINC000495078178 1057622658 /nfs/dbraw/zinc/62/26/58/1057622658.db2.gz IJUZTHLOHSFKGD-SNVBAGLBSA-N 1 2 308.397 4.492 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1scnc1C1CC1 ZINC000495078178 1057622667 /nfs/dbraw/zinc/62/26/67/1057622667.db2.gz IJUZTHLOHSFKGD-SNVBAGLBSA-N 1 2 308.397 4.492 20 0 DIADLO c1ccc([C@@H]2CCCC[N@H+]2Cc2nnc(C3CC3)n2C2CC2)cc1 ZINC000273811772 1057624870 /nfs/dbraw/zinc/62/48/70/1057624870.db2.gz DFCUSNQWSRKXDP-SFHVURJKSA-N 1 2 322.456 4.218 20 0 DIADLO c1ccc([C@@H]2CCCC[N@@H+]2Cc2nnc(C3CC3)n2C2CC2)cc1 ZINC000273811772 1057624873 /nfs/dbraw/zinc/62/48/73/1057624873.db2.gz DFCUSNQWSRKXDP-SFHVURJKSA-N 1 2 322.456 4.218 20 0 DIADLO CC(C)Oc1cccc(F)c1-c1cc(N2CCCC2)cc[nH+]1 ZINC001243263181 1057624969 /nfs/dbraw/zinc/62/49/69/1057624969.db2.gz SOCXZIFLUXYCAO-UHFFFAOYSA-N 1 2 300.377 4.275 20 0 DIADLO CCOc1cc(F)c(F)cc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001243276530 1057632615 /nfs/dbraw/zinc/63/26/15/1057632615.db2.gz RXZSVMFKKWWKBF-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO Cc1cccc(-c2nnc([C@@H](C)[N@H+](C)Cc3cccs3)o2)c1 ZINC000727238587 1057643777 /nfs/dbraw/zinc/64/37/77/1057643777.db2.gz HNGNVCQYJRAAFG-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1cccc(-c2nnc([C@@H](C)[N@@H+](C)Cc3cccs3)o2)c1 ZINC000727238587 1057643781 /nfs/dbraw/zinc/64/37/81/1057643781.db2.gz HNGNVCQYJRAAFG-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(-c2nn(C[N@@H+](C)CC(C)C)c(=S)o2)c(C)c1 ZINC000727422158 1057654067 /nfs/dbraw/zinc/65/40/67/1057654067.db2.gz GDWMKZSYHZDASH-UHFFFAOYSA-N 1 2 305.447 4.035 20 0 DIADLO Cc1ccc(-c2nn(C[N@H+](C)CC(C)C)c(=S)o2)c(C)c1 ZINC000727422158 1057654069 /nfs/dbraw/zinc/65/40/69/1057654069.db2.gz GDWMKZSYHZDASH-UHFFFAOYSA-N 1 2 305.447 4.035 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000727675435 1057664485 /nfs/dbraw/zinc/66/44/85/1057664485.db2.gz OVDNIDKOYPYVBE-OAHLLOKOSA-N 1 2 305.466 4.112 20 0 DIADLO FC(F)(F)COc1cccc(-c2cc[nH+]c(N3CCCC3)c2)c1 ZINC001243392540 1057669250 /nfs/dbraw/zinc/66/92/50/1057669250.db2.gz XWTIVXJLHFEKCB-UHFFFAOYSA-N 1 2 322.330 4.290 20 0 DIADLO CN1Cc2ccccc2[C@H]([NH2+]Cc2c(Cl)cccc2Cl)C1 ZINC000536051997 1057673854 /nfs/dbraw/zinc/67/38/54/1057673854.db2.gz MRVWAEMPINMKQR-QGZVFWFLSA-N 1 2 321.251 4.270 20 0 DIADLO CN1Cc2ccccc2[C@@H]([NH2+]Cc2c(Cl)cccc2Cl)C1 ZINC000536051996 1057673874 /nfs/dbraw/zinc/67/38/74/1057673874.db2.gz MRVWAEMPINMKQR-KRWDZBQOSA-N 1 2 321.251 4.270 20 0 DIADLO CCC[N@H+](CC)Cn1nc([C@H](CC)c2ccccc2)oc1=S ZINC000727820592 1057676757 /nfs/dbraw/zinc/67/67/57/1057676757.db2.gz KXCCYINLGCTMGK-OAHLLOKOSA-N 1 2 319.474 4.437 20 0 DIADLO CCC[N@@H+](CC)Cn1nc([C@H](CC)c2ccccc2)oc1=S ZINC000727820592 1057676759 /nfs/dbraw/zinc/67/67/59/1057676759.db2.gz KXCCYINLGCTMGK-OAHLLOKOSA-N 1 2 319.474 4.437 20 0 DIADLO CC[C@H](c1nn(C[N@@H+]2CC[C@@H](C)C2)c(=S)o1)c1ccccc1 ZINC000727823650 1057677764 /nfs/dbraw/zinc/67/77/64/1057677764.db2.gz WKIUSPVNNBDRDM-HIFRSBDPSA-N 1 2 317.458 4.047 20 0 DIADLO CC[C@H](c1nn(C[N@H+]2CC[C@@H](C)C2)c(=S)o1)c1ccccc1 ZINC000727823650 1057677768 /nfs/dbraw/zinc/67/77/68/1057677768.db2.gz WKIUSPVNNBDRDM-HIFRSBDPSA-N 1 2 317.458 4.047 20 0 DIADLO CC[C@@H](c1nn(C[N@@H+]2CC[C@H](C)C2)c(=S)o1)c1ccccc1 ZINC000727823648 1057677952 /nfs/dbraw/zinc/67/79/52/1057677952.db2.gz WKIUSPVNNBDRDM-DZGCQCFKSA-N 1 2 317.458 4.047 20 0 DIADLO CC[C@@H](c1nn(C[N@H+]2CC[C@H](C)C2)c(=S)o1)c1ccccc1 ZINC000727823648 1057677955 /nfs/dbraw/zinc/67/79/55/1057677955.db2.gz WKIUSPVNNBDRDM-DZGCQCFKSA-N 1 2 317.458 4.047 20 0 DIADLO Cc1cc2c[nH+]c(-c3ccc(CNc4ccccc4)cc3)nc2[nH]1 ZINC001243440522 1057685154 /nfs/dbraw/zinc/68/51/54/1057685154.db2.gz OPUNAXAUYYCZSY-UHFFFAOYSA-N 1 2 314.392 4.497 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc(Cl)ccc1N ZINC001243482784 1057692710 /nfs/dbraw/zinc/69/27/10/1057692710.db2.gz HMPNUOXYWJKAAL-UHFFFAOYSA-N 1 2 301.821 4.283 20 0 DIADLO COC(=O)c1c[nH]c2nc[nH+]c(-c3ccc(C4CCCC4)cc3)c12 ZINC001243494320 1057696302 /nfs/dbraw/zinc/69/63/02/1057696302.db2.gz XHMNNYJGTYXWNK-UHFFFAOYSA-N 1 2 321.380 4.069 20 0 DIADLO COc1c(F)ccc(-c2c[nH+]c(N3CCCCC3)cc2C)c1F ZINC001243509805 1057699100 /nfs/dbraw/zinc/69/91/00/1057699100.db2.gz WJDSKWJOALSAMQ-UHFFFAOYSA-N 1 2 318.367 4.334 20 0 DIADLO Cc1ccccc1C1CC[NH+](Cn2ccc(C(F)(F)F)n2)CC1 ZINC000730253399 1057709369 /nfs/dbraw/zinc/70/93/69/1057709369.db2.gz FHHHBHYDGGLMLA-UHFFFAOYSA-N 1 2 323.362 4.047 20 0 DIADLO Cc1ccsc1-c1nn(C[N@@H+]2CCC[C@@H]2C2CC2)c(=S)o1 ZINC000730253563 1057709534 /nfs/dbraw/zinc/70/95/34/1057709534.db2.gz IWPHRKXMNQKAOL-GFCCVEGCSA-N 1 2 321.471 4.074 20 0 DIADLO Cc1ccsc1-c1nn(C[N@H+]2CCC[C@@H]2C2CC2)c(=S)o1 ZINC000730253563 1057709537 /nfs/dbraw/zinc/70/95/37/1057709537.db2.gz IWPHRKXMNQKAOL-GFCCVEGCSA-N 1 2 321.471 4.074 20 0 DIADLO Cc1ccsc1-c1nn(C[N@@H+]2CCC[C@H]2C2CC2)c(=S)o1 ZINC000730253565 1057709892 /nfs/dbraw/zinc/70/98/92/1057709892.db2.gz IWPHRKXMNQKAOL-LBPRGKRZSA-N 1 2 321.471 4.074 20 0 DIADLO Cc1ccsc1-c1nn(C[N@H+]2CCC[C@H]2C2CC2)c(=S)o1 ZINC000730253565 1057709896 /nfs/dbraw/zinc/70/98/96/1057709896.db2.gz IWPHRKXMNQKAOL-LBPRGKRZSA-N 1 2 321.471 4.074 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(-c2sccc2C)oc1=S ZINC000730253888 1057710105 /nfs/dbraw/zinc/71/01/05/1057710105.db2.gz YFSQZJWXAHKHKF-UHFFFAOYSA-N 1 2 311.476 4.322 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(-c2sccc2C)oc1=S ZINC000730253888 1057710107 /nfs/dbraw/zinc/71/01/07/1057710107.db2.gz YFSQZJWXAHKHKF-UHFFFAOYSA-N 1 2 311.476 4.322 20 0 DIADLO CCCC[N@H+](C)c1ccc(Nc2nc3ccccc3c(=O)[nH]2)cc1 ZINC000730567226 1057718430 /nfs/dbraw/zinc/71/84/30/1057718430.db2.gz PJRNFAMAGWNHNL-UHFFFAOYSA-N 1 2 322.412 4.315 20 0 DIADLO CCCC[N@@H+](C)c1ccc(Nc2nc3ccccc3c(=O)[nH]2)cc1 ZINC000730567226 1057718434 /nfs/dbraw/zinc/71/84/34/1057718434.db2.gz PJRNFAMAGWNHNL-UHFFFAOYSA-N 1 2 322.412 4.315 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1ccc(N(C)C2CCCCC2)nc1 ZINC001243596686 1057728596 /nfs/dbraw/zinc/72/85/96/1057728596.db2.gz NENHFJZCYBXAQV-UHFFFAOYSA-N 1 2 320.440 4.474 20 0 DIADLO Oc1cc(C(F)(F)F)ccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243610086 1057732150 /nfs/dbraw/zinc/73/21/50/1057732150.db2.gz WIJGDYBAJIFILP-UHFFFAOYSA-N 1 2 318.298 4.323 20 0 DIADLO CCCOc1c(F)cc(F)c(-c2c[nH+]c(N(C)C)cc2C)c1F ZINC001243622227 1057736952 /nfs/dbraw/zinc/73/69/52/1057736952.db2.gz MSUJFGJZZAEXEM-UHFFFAOYSA-N 1 2 324.346 4.329 20 0 DIADLO CCCOc1c(F)cc(F)c(-c2cccc3[nH+]ccn32)c1F ZINC001243623170 1057737348 /nfs/dbraw/zinc/73/73/48/1057737348.db2.gz VXLIHJQGGYKDKA-UHFFFAOYSA-N 1 2 306.287 4.207 20 0 DIADLO c1cn(-c2ccc(-c3ccc(C4CCOCC4)cc3)cc2)c[nH+]1 ZINC001243626503 1057738487 /nfs/dbraw/zinc/73/84/87/1057738487.db2.gz DLFJOOWEDZKKRY-UHFFFAOYSA-N 1 2 304.393 4.433 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc(C2CCOCC2)cc1 ZINC001243630025 1057740000 /nfs/dbraw/zinc/74/00/00/1057740000.db2.gz NUDJHJWXYIZUPY-UHFFFAOYSA-N 1 2 308.381 4.133 20 0 DIADLO Fc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)nc1C(F)(F)F ZINC001243655705 1057745589 /nfs/dbraw/zinc/74/55/89/1057745589.db2.gz BMLKWKPRSQECQU-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO c1coc(-c2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)cc2)n1 ZINC001243656294 1057745602 /nfs/dbraw/zinc/74/56/02/1057745602.db2.gz ATWRKKBWJUPMJL-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO Fc1ccc2cc(-c3ccc(Cn4cc[nH+]c4)cc3)ncc2c1 ZINC001243657269 1057745645 /nfs/dbraw/zinc/74/56/45/1057745645.db2.gz UDFTUKXVEUUHQM-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO Cc1nc(C(C)(C)C)nc(-c2ccc(Cn3cc[nH+]c3)cc2)c1C ZINC001243656992 1057745721 /nfs/dbraw/zinc/74/57/21/1057745721.db2.gz OUZSKTQBCTWNFX-UHFFFAOYSA-N 1 2 320.440 4.303 20 0 DIADLO CC(C)[S@@](=O)c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001243658591 1057746076 /nfs/dbraw/zinc/74/60/76/1057746076.db2.gz VFQUEWHDLDMGFB-HSZRJFAPSA-N 1 2 324.449 4.114 20 0 DIADLO COc1ccc2cccc(-c3ccc(Cn4cc[nH+]c4)cc3)c2n1 ZINC001243658690 1057746207 /nfs/dbraw/zinc/74/62/07/1057746207.db2.gz FNINEXPHQZTSIV-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO c1cn(Cc2ccc(-c3cc(-c4ccccc4)cnn3)cc2)c[nH+]1 ZINC001243657460 1057746233 /nfs/dbraw/zinc/74/62/33/1057746233.db2.gz QAZJTWPLEQJSEW-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO COc1cccc2nccc(-c3ccc(Cn4cc[nH+]c4)cc3)c21 ZINC001243658819 1057746323 /nfs/dbraw/zinc/74/63/23/1057746323.db2.gz JAICUHUGKJCDSV-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Fc1cc(OC(F)F)ccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243657474 1057746382 /nfs/dbraw/zinc/74/63/82/1057746382.db2.gz MEPVZWOMLFLCBE-UHFFFAOYSA-N 1 2 318.298 4.339 20 0 DIADLO CCc1cc2c(ncnc2-c2ccc(Cn3cc[nH+]c3)cc2)s1 ZINC001243657632 1057746507 /nfs/dbraw/zinc/74/65/07/1057746507.db2.gz RSKPLYSZBDUKJL-UHFFFAOYSA-N 1 2 320.421 4.166 20 0 DIADLO c1cn(Cc2ccc(-c3ccccc3-c3cnco3)cc2)c[nH+]1 ZINC001243659422 1057746983 /nfs/dbraw/zinc/74/69/83/1057746983.db2.gz SABZKIAGDMNENL-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO c1cn(Cc2ccc(-c3ccnc(-c4ccccn4)c3)cc2)c[nH+]1 ZINC001243661980 1057748093 /nfs/dbraw/zinc/74/80/93/1057748093.db2.gz IMKCQLAPTVCFIV-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO COc1ccc2nccc(-c3ccc(Cn4cc[nH+]c4)cc3)c2c1 ZINC001243662376 1057748597 /nfs/dbraw/zinc/74/85/97/1057748597.db2.gz NUSYIQPEDYIFJM-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO C/C(=C\C(=O)Nc1ccccc1-n1cc[nH+]c1)c1cccc(F)c1 ZINC000732057596 1057767300 /nfs/dbraw/zinc/76/73/00/1057767300.db2.gz MLDRHTLUYUABCN-SDNWHVSQSA-N 1 2 321.355 4.053 20 0 DIADLO CC[C@@H](C)C[N@H+](C)Cn1nc2sc3ccccc3n2c1=S ZINC000732183819 1057769308 /nfs/dbraw/zinc/76/93/08/1057769308.db2.gz ORVQMJBYNUTHKD-LLVKDONJSA-N 1 2 320.487 4.015 20 0 DIADLO CC[C@@H](C)C[N@@H+](C)Cn1nc2sc3ccccc3n2c1=S ZINC000732183819 1057769314 /nfs/dbraw/zinc/76/93/14/1057769314.db2.gz ORVQMJBYNUTHKD-LLVKDONJSA-N 1 2 320.487 4.015 20 0 DIADLO COc1ccc(-c2ccccc2Cn2cc[nH+]c2)cc1SC ZINC001243748843 1057769377 /nfs/dbraw/zinc/76/93/77/1057769377.db2.gz GLAJVGXWZMHELU-UHFFFAOYSA-N 1 2 310.422 4.329 20 0 DIADLO CC(C)(C)n1cnn(C[N@@H+]2CCCC3(CCCCC3)C2)c1=S ZINC000732191116 1057769725 /nfs/dbraw/zinc/76/97/25/1057769725.db2.gz SFPNMNNNWAWEGU-UHFFFAOYSA-N 1 2 322.522 4.173 20 0 DIADLO CC(C)(C)n1cnn(C[N@H+]2CCCC3(CCCCC3)C2)c1=S ZINC000732191116 1057769729 /nfs/dbraw/zinc/76/97/29/1057769729.db2.gz SFPNMNNNWAWEGU-UHFFFAOYSA-N 1 2 322.522 4.173 20 0 DIADLO Nc1cn2ccc(-c3c(F)c(Cl)cc(Cl)c3F)cc2[nH+]1 ZINC001243764572 1057773942 /nfs/dbraw/zinc/77/39/42/1057773942.db2.gz FVBWQNUVNYKONH-UHFFFAOYSA-N 1 2 314.122 4.169 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(Cl)c2n[nH]cc21 ZINC001243786000 1057778907 /nfs/dbraw/zinc/77/89/07/1057778907.db2.gz ARDXGTIXDVNWSA-UHFFFAOYSA-N 1 2 324.771 4.078 20 0 DIADLO Cc1cn2c(cccc2-c2ccc(Br)cc2F)[nH+]1 ZINC001243802701 1057783404 /nfs/dbraw/zinc/78/34/04/1057783404.db2.gz QTVUBWKMWBKTHW-UHFFFAOYSA-N 1 2 305.150 4.211 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cc(C3CC3)cnc2F)cc1F ZINC001243875498 1057796444 /nfs/dbraw/zinc/79/64/44/1057796444.db2.gz XDTJVKZSOBDOHR-UHFFFAOYSA-N 1 2 306.331 4.105 20 0 DIADLO Cc1c(-c2ccc(OC(F)(F)F)c(F)c2)ccc2[nH+]ccn21 ZINC001243923669 1057808687 /nfs/dbraw/zinc/80/86/87/1057808687.db2.gz ACPWFOXDWQRRQW-UHFFFAOYSA-N 1 2 310.250 4.347 20 0 DIADLO COc1ccc(-c2cn3cc[nH+]c3cc2OC)c(C(F)(F)F)c1 ZINC001243947074 1057816995 /nfs/dbraw/zinc/81/69/95/1057816995.db2.gz BKBMYIYPPNJRCA-UHFFFAOYSA-N 1 2 322.286 4.037 20 0 DIADLO CCc1cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)ccc1NC(C)=O ZINC001243975830 1057826461 /nfs/dbraw/zinc/82/64/61/1057826461.db2.gz CBWYLLXHCHRZMF-UHFFFAOYSA-N 1 2 305.381 4.265 20 0 DIADLO COC(=O)c1cc2ccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)cc2[nH]1 ZINC001243977362 1057827266 /nfs/dbraw/zinc/82/72/66/1057827266.db2.gz CGUCRJHHSGHYBL-UHFFFAOYSA-N 1 2 317.348 4.012 20 0 DIADLO COC(=O)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c(C)c1C ZINC001243978053 1057827513 /nfs/dbraw/zinc/82/75/13/1057827513.db2.gz FZCXMBUOOJSGRZ-UHFFFAOYSA-N 1 2 306.365 4.147 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc(-c3ncc[nH]3)cc2)cc1F ZINC001243982595 1057828971 /nfs/dbraw/zinc/82/89/71/1057828971.db2.gz ZKRQZZCRBRHEOH-UHFFFAOYSA-N 1 2 313.351 4.084 20 0 DIADLO CCOc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c(OC)c1 ZINC001244002863 1057835462 /nfs/dbraw/zinc/83/54/62/1057835462.db2.gz RXHOYKRVJVXOTB-UHFFFAOYSA-N 1 2 308.381 4.006 20 0 DIADLO CCOc1ccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)c(OC)c1 ZINC001244004233 1057835848 /nfs/dbraw/zinc/83/58/48/1057835848.db2.gz AANQUZIGLNPWIM-UHFFFAOYSA-N 1 2 321.367 4.101 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccnc(C(C)(C)C)c1 ZINC001244029219 1057843206 /nfs/dbraw/zinc/84/32/06/1057843206.db2.gz WROHPNLGWSADON-UHFFFAOYSA-N 1 2 307.397 4.240 20 0 DIADLO Cc1cc(-c2cc(OCc3ccccc3)ccc2F)c[nH+]c1N ZINC001244056515 1057851837 /nfs/dbraw/zinc/85/18/37/1057851837.db2.gz FTNYOCQFVPFTHQ-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO CCOc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)c(C)c1C ZINC001244061407 1057854378 /nfs/dbraw/zinc/85/43/78/1057854378.db2.gz XPYJGANBEOILQR-UHFFFAOYSA-N 1 2 307.397 4.009 20 0 DIADLO Cc1cn2cc(-c3cc(F)c(OC(C)C)c(F)c3)ccc2[nH+]1 ZINC001244109759 1057871604 /nfs/dbraw/zinc/87/16/04/1057871604.db2.gz KIHZKBUIJGHOOG-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Cc1ncc(C2CC2)cc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001244143446 1057885457 /nfs/dbraw/zinc/88/54/57/1057885457.db2.gz GQLLNOCESZNITJ-UHFFFAOYSA-N 1 2 302.368 4.274 20 0 DIADLO Cc1cncc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c1C ZINC001244153384 1057888143 /nfs/dbraw/zinc/88/81/43/1057888143.db2.gz URZBHUVOAFUVJW-UHFFFAOYSA-N 1 2 319.408 4.008 20 0 DIADLO Cc1cncc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c1C ZINC001244153384 1057888146 /nfs/dbraw/zinc/88/81/46/1057888146.db2.gz URZBHUVOAFUVJW-UHFFFAOYSA-N 1 2 319.408 4.008 20 0 DIADLO CCCN(CCC)C(=O)c1cccc(-c2cccc3[nH+]ccn32)c1 ZINC001244214024 1057902174 /nfs/dbraw/zinc/90/21/74/1057902174.db2.gz KMYJNLGGBGELAH-UHFFFAOYSA-N 1 2 321.424 4.264 20 0 DIADLO COc1cccc(-c2ccc(Cn3cc[nH+]c3)cc2)c1C1CC1 ZINC001244250410 1057910679 /nfs/dbraw/zinc/91/06/79/1057910679.db2.gz PVVZRZMGYZHMNF-UHFFFAOYSA-N 1 2 304.393 4.484 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(N)c(C(F)(F)F)c2)cc1 ZINC001244366471 1057945553 /nfs/dbraw/zinc/94/55/53/1057945553.db2.gz FXZPMCXWUSWMIB-UHFFFAOYSA-N 1 2 317.314 4.355 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(Cl)c3c[nH]nc32)cc1 ZINC001244399914 1057950861 /nfs/dbraw/zinc/95/08/61/1057950861.db2.gz PIMMHCCOMCOPET-UHFFFAOYSA-N 1 2 308.772 4.284 20 0 DIADLO CN(C)c1ccc(-c2cc[nH+]c(N3CCCC3)c2)cc1Cl ZINC001244412348 1057953557 /nfs/dbraw/zinc/95/35/57/1057953557.db2.gz VFENHGQEFXPXJN-UHFFFAOYSA-N 1 2 301.821 4.068 20 0 DIADLO CSc1cc(-c2nc3[nH]ccc3c[nH+]2)cc(C(F)(F)F)c1 ZINC001244508604 1057981218 /nfs/dbraw/zinc/98/12/18/1057981218.db2.gz ZEEXLPZCVKOVNM-UHFFFAOYSA-N 1 2 309.316 4.317 20 0 DIADLO COc1c(C)ccc(F)c1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001244527910 1057986802 /nfs/dbraw/zinc/98/68/02/1057986802.db2.gz RDERTWSHMFUXAS-UHFFFAOYSA-N 1 2 309.331 4.150 20 0 DIADLO Cc1cc(-c2cccc(-c3c[nH+]cn3C)c2)cnc1OC(C)C ZINC001244688517 1058026540 /nfs/dbraw/zinc/02/65/40/1058026540.db2.gz GDSLAOIIVZVYDP-UHFFFAOYSA-N 1 2 307.397 4.245 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1c(F)c(F)ccc1OC(C)C ZINC001244741824 1058039527 /nfs/dbraw/zinc/03/95/27/1058039527.db2.gz WTKIVPALLPLKCM-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2cc(C)c(Cl)cc2Cl)cc1 ZINC001244748162 1058041096 /nfs/dbraw/zinc/04/10/96/1058041096.db2.gz IBIDBMCCTOWPOE-HNNXBMFYSA-N 1 2 324.207 4.142 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(N)cc2C(F)(F)F)cc1 ZINC001244760488 1058043283 /nfs/dbraw/zinc/04/32/83/1058043283.db2.gz WYLQOAUXJRWDRG-UHFFFAOYSA-N 1 2 317.314 4.355 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1cccc(-c2ccncc2)c1 ZINC001244780248 1058046849 /nfs/dbraw/zinc/04/68/49/1058046849.db2.gz VVGGKMHVOMUGKW-UHFFFAOYSA-N 1 2 301.349 4.301 20 0 DIADLO O=C(O[C@@H]1CC=C(c2ccn3cc[nH+]c3c2)CC1)c1ccccc1 ZINC001244806823 1058050591 /nfs/dbraw/zinc/05/05/91/1058050591.db2.gz RSXDNYKDQOBNSB-GOSISDBHSA-N 1 2 318.376 4.127 20 0 DIADLO Cc1[nH+]ccc(C2=CC[C@@H](OC(=O)c3ccccc3)CC2)c1C ZINC001244807514 1058051429 /nfs/dbraw/zinc/05/14/29/1058051429.db2.gz UXWCYOLTGVCGHJ-GOSISDBHSA-N 1 2 307.393 4.491 20 0 DIADLO CCN(CC)c1cc(F)cc(-c2cc3[nH]c[nH+]c3cc2OC)c1 ZINC001244823564 1058053803 /nfs/dbraw/zinc/05/38/03/1058053803.db2.gz NXHUYSHBMJCKAX-UHFFFAOYSA-N 1 2 313.376 4.224 20 0 DIADLO Cc1c(-c2cc(F)cc(N3CCCCC3)c2)ccc2[nH+]ccn21 ZINC001244823187 1058053944 /nfs/dbraw/zinc/05/39/44/1058053944.db2.gz JPMLCKUEWIHYOC-UHFFFAOYSA-N 1 2 309.388 4.439 20 0 DIADLO Cc1cc2[nH]ccc2c(-c2cccc(C[NH+]3CCOCC3)c2F)c1 ZINC001244856275 1058058613 /nfs/dbraw/zinc/05/86/13/1058058613.db2.gz VZYCJBJISJVORF-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(C2CC2)c(OC)c1 ZINC001244892934 1058067161 /nfs/dbraw/zinc/06/71/61/1058067161.db2.gz KXMNKOZYNPZZJE-UHFFFAOYSA-N 1 2 320.392 4.434 20 0 DIADLO Clc1ccnc(Cl)c1-c1cc(N2CCCCC2)cc[nH+]1 ZINC001244938170 1058075596 /nfs/dbraw/zinc/07/55/96/1058075596.db2.gz WOFOPUPJYNOHMF-UHFFFAOYSA-N 1 2 308.212 4.441 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2c(Cl)ccnc2Cl)cc1 ZINC001244939765 1058076015 /nfs/dbraw/zinc/07/60/15/1058076015.db2.gz DUPJIWUROJQTIY-UHFFFAOYSA-N 1 2 304.180 4.456 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2c(Cl)ccnc2Cl)c1 ZINC001244941050 1058076692 /nfs/dbraw/zinc/07/66/92/1058076692.db2.gz VFUHRTVDMQSCNJ-UHFFFAOYSA-N 1 2 304.180 4.456 20 0 DIADLO CNc1cc(-c2ccc(OCCCc3ccccn3)cc2)cc[nH+]1 ZINC001244973030 1058084011 /nfs/dbraw/zinc/08/40/11/1058084011.db2.gz SVYPZAYFGZWUHX-UHFFFAOYSA-N 1 2 319.408 4.197 20 0 DIADLO COC(=O)c1c[nH]c2nc(-c3cccc(C4CCCC4)c3)[nH+]cc12 ZINC001244985999 1058087101 /nfs/dbraw/zinc/08/71/01/1058087101.db2.gz LMZMHGVOHPPLOG-UHFFFAOYSA-N 1 2 321.380 4.021 20 0 DIADLO c1cc(-c2cc[nH+]c(N3CCOCC3)c2)cc(C2CCCC2)c1 ZINC001244989724 1058087522 /nfs/dbraw/zinc/08/75/22/1058087522.db2.gz VHVUEFOQOXDRIX-UHFFFAOYSA-N 1 2 308.425 4.243 20 0 DIADLO COc1c(OCc2ccccc2)cccc1-c1c[nH+]c(N)c(C)c1 ZINC001244995365 1058088615 /nfs/dbraw/zinc/08/86/15/1058088615.db2.gz GFSURHQXEKKJBC-UHFFFAOYSA-N 1 2 320.392 4.227 20 0 DIADLO CCOC(=O)/C=C/c1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001245129170 1058117774 /nfs/dbraw/zinc/11/77/74/1058117774.db2.gz TWYBNDZAWXEQRY-LFYBBSHMSA-N 1 2 318.376 4.116 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cc(F)cc(C(C)(C)O)c2)cc1F ZINC001245144954 1058120737 /nfs/dbraw/zinc/12/07/37/1058120737.db2.gz WYJLSXZXAMUAMR-UHFFFAOYSA-N 1 2 323.358 4.060 20 0 DIADLO FC(F)(F)c1cc(-c2c[nH+]cn2Cc2ccccc2)ccn1 ZINC001245196269 1058125898 /nfs/dbraw/zinc/12/58/98/1058125898.db2.gz ADXDORMPLDTICB-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO CC(=O)n1ccc2cc(-c3c[nH+]cn3Cc3ccccc3)ccc21 ZINC001245196640 1058126154 /nfs/dbraw/zinc/12/61/54/1058126154.db2.gz JVVITVNRASKKIJ-UHFFFAOYSA-N 1 2 315.376 4.213 20 0 DIADLO COc1ccc2c(c1)nccc2-c1c[nH+]cn1Cc1ccccc1 ZINC001245196892 1058126326 /nfs/dbraw/zinc/12/63/26/1058126326.db2.gz MFFCWOKYYQLCKQ-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Fc1cc(-c2c[nH+]cn2Cc2ccccc2)cc(N2CCCC2)c1 ZINC001245197581 1058126349 /nfs/dbraw/zinc/12/63/49/1058126349.db2.gz ZYVBFXCGQSDMTP-UHFFFAOYSA-N 1 2 321.399 4.338 20 0 DIADLO Fc1cnc2cc(-c3c[nH+]cn3Cc3ccccc3)ccc2c1 ZINC001245199148 1058127131 /nfs/dbraw/zinc/12/71/31/1058127131.db2.gz RGRVBSUTOSKKNG-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO Cc1cn(C)c2ccc(-c3c[nH+]cn3Cc3ccccc3)cc12 ZINC001245202045 1058127659 /nfs/dbraw/zinc/12/76/59/1058127659.db2.gz OVDUZWZISPQZMA-UHFFFAOYSA-N 1 2 301.393 4.399 20 0 DIADLO COc1c(F)cc(SC)cc1-c1cc(C)cn2cc[nH+]c12 ZINC001245225810 1058129377 /nfs/dbraw/zinc/12/93/77/1058129377.db2.gz ISABVECDJIDYHF-UHFFFAOYSA-N 1 2 302.374 4.179 20 0 DIADLO CC[C@@H](C)c1ccc(-c2cncc(C[NH+]3CCOCC3)c2)cc1 ZINC001245251293 1058135231 /nfs/dbraw/zinc/13/52/31/1058135231.db2.gz QXBVLTQEMHYJOH-MRXNPFEDSA-N 1 2 310.441 4.094 20 0 DIADLO Cc1cccc2[nH]c(-c3ccc(C[NH+]4CCOCC4)cc3F)cc21 ZINC001245341872 1058147406 /nfs/dbraw/zinc/14/74/06/1058147406.db2.gz CERRORHCJODAIU-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc2c(cccc2C)[nH]1 ZINC001245348263 1058149229 /nfs/dbraw/zinc/14/92/29/1058149229.db2.gz UWNWZGXHLBIBTP-UHFFFAOYSA-N 1 2 303.365 4.338 20 0 DIADLO COc1cc2ccccc2cc1-c1cc(-n2ccnc2)cc[nH+]1 ZINC001245414949 1058162981 /nfs/dbraw/zinc/16/29/81/1058162981.db2.gz IUEDQBSBPJIIJY-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO CC(C)(C)[C@@H]1CCC[C@@H](NC(=O)c2cccc3[nH+]ccn32)CC1 ZINC001516564435 1058181925 /nfs/dbraw/zinc/18/19/25/1058181925.db2.gz PIOFCWWNJNNZBI-HUUCEWRRSA-N 1 2 313.445 4.059 20 0 DIADLO CC(C)(C)[C@H]1CCC[C@@H](NC(=O)c2cccc3[nH+]ccn32)CC1 ZINC001516564437 1058182538 /nfs/dbraw/zinc/18/25/38/1058182538.db2.gz PIOFCWWNJNNZBI-LSDHHAIUSA-N 1 2 313.445 4.059 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)c1cc(Cl)cc(Cl)c1F ZINC001527606622 1058186680 /nfs/dbraw/zinc/18/66/80/1058186680.db2.gz XFXMRDMBZFBGNZ-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@@]2(C)CCCc3ccccc32)c(C)[nH+]1 ZINC001527694956 1058207648 /nfs/dbraw/zinc/20/76/48/1058207648.db2.gz BHIFXDWJQCSTMO-OAQYLSRUSA-N 1 2 322.452 4.031 20 0 DIADLO CC(=Cc1ccc(C)cc1)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC001545563061 1058210333 /nfs/dbraw/zinc/21/03/33/1058210333.db2.gz IASBCUATAWXWKM-RAXLEYEMSA-N 1 2 305.381 4.222 20 0 DIADLO Cc1cc(-c2nc3ccccc3cc2C(F)(F)F)c[nH+]c1N ZINC001245535792 1058217165 /nfs/dbraw/zinc/21/71/65/1058217165.db2.gz PIRBTGMLZGPDMG-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1cc(-c2nccc3cccc(C(F)(F)F)c32)c[nH+]c1N ZINC001245536213 1058217410 /nfs/dbraw/zinc/21/74/10/1058217410.db2.gz RIUQCWIXTDNSIF-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1cc(-c2ccnc3ccc(OC(F)(F)F)cc32)c[nH+]c1N ZINC001245540881 1058220304 /nfs/dbraw/zinc/22/03/04/1058220304.db2.gz JFMWPKCFZNFXKD-UHFFFAOYSA-N 1 2 319.286 4.086 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC(C3CCCCC3)CC2)c(C)[nH+]1 ZINC001527751573 1058227563 /nfs/dbraw/zinc/22/75/63/1058227563.db2.gz ZWBREYONPUJIEE-UHFFFAOYSA-N 1 2 314.473 4.439 20 0 DIADLO CCCn1nccc1C[N@@H+]1CCCC[C@H]1c1nc(C)c(C)s1 ZINC001549368041 1058289915 /nfs/dbraw/zinc/28/99/15/1058289915.db2.gz FRGUXGBGGLHFEV-INIZCTEOSA-N 1 2 318.490 4.094 20 0 DIADLO CCCn1nccc1C[N@H+]1CCCC[C@H]1c1nc(C)c(C)s1 ZINC001549368041 1058289933 /nfs/dbraw/zinc/28/99/33/1058289933.db2.gz FRGUXGBGGLHFEV-INIZCTEOSA-N 1 2 318.490 4.094 20 0 DIADLO CCCCCOc1ccc(C(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001527995175 1058293605 /nfs/dbraw/zinc/29/36/05/1058293605.db2.gz CZUHKNHHZCSLMQ-UHFFFAOYSA-N 1 2 323.396 4.156 20 0 DIADLO c1oc(C2CC2)nc1C[N@@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@H]21 ZINC001550134207 1058318868 /nfs/dbraw/zinc/31/88/68/1058318868.db2.gz KUYSMWKWHUYBNP-QYZOEREBSA-N 1 2 324.424 4.047 20 0 DIADLO c1oc(C2CC2)nc1C[N@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@H]21 ZINC001550134207 1058318889 /nfs/dbraw/zinc/31/88/89/1058318889.db2.gz KUYSMWKWHUYBNP-QYZOEREBSA-N 1 2 324.424 4.047 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2nc(C)c(C)s2)sn1 ZINC001550058208 1058320219 /nfs/dbraw/zinc/32/02/19/1058320219.db2.gz IPTPFTVQIPINMK-AWEZNQCLSA-N 1 2 307.488 4.252 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2nc(C)c(C)s2)sn1 ZINC001550058208 1058320235 /nfs/dbraw/zinc/32/02/35/1058320235.db2.gz IPTPFTVQIPINMK-AWEZNQCLSA-N 1 2 307.488 4.252 20 0 DIADLO COc1c(Br)cccc1-c1ccc2[nH+]c(C)cn2c1 ZINC001245684789 1058347964 /nfs/dbraw/zinc/34/79/64/1058347964.db2.gz ZYGZFRVMBJOFCC-UHFFFAOYSA-N 1 2 317.186 4.081 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@@H]2c2nc(C)c(C)s2)o1 ZINC001550623383 1058351031 /nfs/dbraw/zinc/35/10/31/1058351031.db2.gz QXTIIYDFDVKHDQ-CQSZACIVSA-N 1 2 306.431 4.089 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@@H]2c2nc(C)c(C)s2)o1 ZINC001550623383 1058351047 /nfs/dbraw/zinc/35/10/47/1058351047.db2.gz QXTIIYDFDVKHDQ-CQSZACIVSA-N 1 2 306.431 4.089 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1ccc(Cl)c(C)c1C ZINC001245686908 1058351435 /nfs/dbraw/zinc/35/14/35/1058351435.db2.gz DYWZZBJZDJBHPD-UHFFFAOYSA-N 1 2 316.832 4.164 20 0 DIADLO Cc1ccc(-c2ccc(F)c(C)c2F)c(C[NH+]2CCOCC2)c1 ZINC001245692377 1058355390 /nfs/dbraw/zinc/35/53/90/1058355390.db2.gz JZLCXTVVHJEINF-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO CCC[C@@H](CC)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC001518615846 1058357254 /nfs/dbraw/zinc/35/72/54/1058357254.db2.gz PXEZQGYCQKWDQA-OAHLLOKOSA-N 1 2 323.440 4.367 20 0 DIADLO CC[C@@H]1CCCC[C@H]1CNC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001562900476 1058358066 /nfs/dbraw/zinc/35/80/66/1058358066.db2.gz FRWYTCCGJJCZCD-CVEARBPZSA-N 1 2 303.450 4.345 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C[C@H]2CCC[C@H]2C)[nH+]c1C ZINC001551740749 1058408425 /nfs/dbraw/zinc/40/84/25/1058408425.db2.gz OCPAHWZMNKDDDA-IUODEOHRSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2CCC[C@H](C)C2)[nH+]c1C ZINC001551736717 1058409101 /nfs/dbraw/zinc/40/91/01/1058409101.db2.gz AAAFSAQQANMGHL-SWLSCSKDSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C[C@H]2CC[C@H](C)C2)[nH+]c1C ZINC001551743542 1058411513 /nfs/dbraw/zinc/41/15/13/1058411513.db2.gz WMYYSRIZXPNUGX-WFASDCNBSA-N 1 2 311.429 4.458 20 0 DIADLO COc1c(Cl)ccc(F)c1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001245732606 1058414005 /nfs/dbraw/zinc/41/40/05/1058414005.db2.gz VBHFFBJPZWXSEF-UHFFFAOYSA-N 1 2 316.763 4.400 20 0 DIADLO Cc1ccc(NC(=O)CC(C2CCC2)C2CCC2)c(N(C)C)[nH+]1 ZINC001519737658 1058469288 /nfs/dbraw/zinc/46/92/88/1058469288.db2.gz LAKNTJSIFBFXJC-UHFFFAOYSA-N 1 2 315.461 4.001 20 0 DIADLO COc1c(F)c(Cl)ccc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001245804283 1058488825 /nfs/dbraw/zinc/48/88/25/1058488825.db2.gz YVZKEJWTYBFJGZ-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO CCOc1cc(-c2ccc(-c3c[nH+]cn3C)cc2)c(Cl)cn1 ZINC001245817714 1058506774 /nfs/dbraw/zinc/50/67/74/1058506774.db2.gz RWDUTJFRRVPSMH-UHFFFAOYSA-N 1 2 313.788 4.201 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)c2cc(C(C)C)on2)[nH+]c1C ZINC001553990078 1058513878 /nfs/dbraw/zinc/51/38/78/1058513878.db2.gz WMCNQURIAXSMFS-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2c(F)ccc(O)c2Cl)c1 ZINC001245831333 1058532579 /nfs/dbraw/zinc/53/25/79/1058532579.db2.gz JWVIRZWXTYNLQL-UHFFFAOYSA-N 1 2 302.736 4.252 20 0 DIADLO CC[C@H](Cc1cccc(C)c1)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001528982300 1058568734 /nfs/dbraw/zinc/56/87/34/1058568734.db2.gz FZPUANQEYFKQFR-QGZVFWFLSA-N 1 2 321.424 4.159 20 0 DIADLO COc1ccc(-c2c[nH+]c(N3CCCCC3)cc2C)c(Cl)n1 ZINC001245873434 1058583034 /nfs/dbraw/zinc/58/30/34/1058583034.db2.gz KZLZXWAZLWCAKC-UHFFFAOYSA-N 1 2 317.820 4.104 20 0 DIADLO Cc1cc(NC(=O)C2(C3CCCCC3)CCCCC2)cc[nH+]1 ZINC001520752479 1058675524 /nfs/dbraw/zinc/67/55/24/1058675524.db2.gz AGIXIGWTUZVGBR-UHFFFAOYSA-N 1 2 300.446 4.281 20 0 DIADLO CC(=Cc1c(Cl)cccc1Cl)C(=O)Nc1cc[nH+]c(C)c1 ZINC001520753561 1058676636 /nfs/dbraw/zinc/67/66/36/1058676636.db2.gz MMDIXPKQHPGGCQ-NTMALXAHSA-N 1 2 321.207 4.161 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)c1cc(Cl)cc(Cl)c1F ZINC001529650064 1058781842 /nfs/dbraw/zinc/78/18/42/1058781842.db2.gz BZWMFPOJDHQSEM-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3CCCC[C@@H]3C)cc2)[nH+]c1C ZINC001558135430 1058840702 /nfs/dbraw/zinc/84/07/02/1058840702.db2.gz QQBONBVESZSASA-YVEFUNNKSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-c3[nH]c(C)c(C)[nH+]3)cc2)c(C)o1 ZINC001558132714 1058841975 /nfs/dbraw/zinc/84/19/75/1058841975.db2.gz ILNGQDNJHRKPQV-UHFFFAOYSA-N 1 2 309.369 4.156 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3CC34CCCC4)cc2)[nH+]c1C ZINC001558134667 1058843175 /nfs/dbraw/zinc/84/31/75/1058843175.db2.gz HFWARTBHCPQWQU-INIZCTEOSA-N 1 2 309.413 4.212 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)C[C@@H](C)C2CCCCC2)[nH+]c1C ZINC001558350992 1058861929 /nfs/dbraw/zinc/86/19/29/1058861929.db2.gz DPEOOJCFCOMILT-CXAGYDPISA-N 1 2 317.477 4.297 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)CC2(C)CCCCC2)[nH+]c1C ZINC001558353946 1058865298 /nfs/dbraw/zinc/86/52/98/1058865298.db2.gz ZPSUWWUZHNZEBR-OAHLLOKOSA-N 1 2 303.450 4.051 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccc(C)c(C)c3Cl)ccn12 ZINC001530098160 1058940554 /nfs/dbraw/zinc/94/05/54/1058940554.db2.gz QDVVUZJKMFCKFB-UHFFFAOYSA-N 1 2 313.788 4.165 20 0 DIADLO Cc1cc(N(C)Cc2ccc(Cl)s2)nc(C2CCC2)[nH+]1 ZINC001559051325 1058948130 /nfs/dbraw/zinc/94/81/30/1058948130.db2.gz VNYIITJPERFXKD-UHFFFAOYSA-N 1 2 307.850 4.404 20 0 DIADLO FC(F)c1cc(Nc2ccc([NH+]3CCCCC3)cc2)ncn1 ZINC001559052849 1058950207 /nfs/dbraw/zinc/95/02/07/1058950207.db2.gz GRWFMFASTILBBU-UHFFFAOYSA-N 1 2 304.344 4.148 20 0 DIADLO Cc1cc(N[C@H](C)Cc2ccccc2Cl)nc(C2CC2)[nH+]1 ZINC001559071338 1058965126 /nfs/dbraw/zinc/96/51/26/1058965126.db2.gz MXNAWWZQUFSZEL-LLVKDONJSA-N 1 2 301.821 4.359 20 0 DIADLO Cc1nc(NCC(C)(C)c2c(Cl)cccc2Cl)cc[nH+]1 ZINC001559099509 1058986846 /nfs/dbraw/zinc/98/68/46/1058986846.db2.gz PJOXINDASONCEL-UHFFFAOYSA-N 1 2 310.228 4.482 20 0 DIADLO CCc1cc(N2CCC[C@@](C)(c3ccccc3)C2)nc(CC)[nH+]1 ZINC001559102512 1058990300 /nfs/dbraw/zinc/99/03/00/1058990300.db2.gz TUZIIGVIZCHWNQ-HXUWFJFHSA-N 1 2 309.457 4.160 20 0 DIADLO CCc1cc(N2CCC(Cc3ccc(C)cc3)CC2)nc(CC)[nH+]1 ZINC001559150323 1059037563 /nfs/dbraw/zinc/03/75/63/1059037563.db2.gz UAYULXVOKHAZNL-UHFFFAOYSA-N 1 2 323.484 4.369 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3cccc(Cl)c3Cl)ccn12 ZINC001522226613 1059066223 /nfs/dbraw/zinc/06/62/23/1059066223.db2.gz WJRLXQQDMYICDS-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO CO[C@@H]1C[C@@H](N(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)C12CCC2 ZINC001559189895 1059073837 /nfs/dbraw/zinc/07/38/37/1059073837.db2.gz FFOHJMAROPUDHW-HZPDHXFCSA-N 1 2 317.477 4.117 20 0 DIADLO CO[C@H]1C[C@H](N(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)C12CCC2 ZINC001559189894 1059074288 /nfs/dbraw/zinc/07/42/88/1059074288.db2.gz FFOHJMAROPUDHW-HOTGVXAUSA-N 1 2 317.477 4.117 20 0 DIADLO CCc1cc(N(C)[C@H](CC)c2ccccc2OC)nc(CC)[nH+]1 ZINC001559203910 1059083014 /nfs/dbraw/zinc/08/30/14/1059083014.db2.gz LCGSMFIUVAGEPQ-MRXNPFEDSA-N 1 2 313.445 4.198 20 0 DIADLO CC(C)(C)C[C@@H]1CCN(c2nc3ccccc3n3c[nH+]cc23)C1 ZINC001559214348 1059094416 /nfs/dbraw/zinc/09/44/16/1059094416.db2.gz YCZKDGXDYUOPAK-AWEZNQCLSA-N 1 2 308.429 4.145 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2NC[C@H]1CCCC(C)(C)C1 ZINC001559213552 1059094784 /nfs/dbraw/zinc/09/47/84/1059094784.db2.gz XBHSRSGQBVRHNT-ZDUSSCGKSA-N 1 2 315.465 4.210 20 0 DIADLO Cc1cc(CNc2cc(Cl)nc(C3CCC3)n2)cc(C)[nH+]1 ZINC001559216398 1059096796 /nfs/dbraw/zinc/09/67/96/1059096796.db2.gz YAAQXDFSMJQXGS-UHFFFAOYSA-N 1 2 302.809 4.021 20 0 DIADLO Cc1nc(N2CC[C@H]([C@H]3CCCC3(C)C)C2)c2c([nH+]1)CCCC2 ZINC001559220241 1059099669 /nfs/dbraw/zinc/09/96/69/1059099669.db2.gz SXJBKUDUXCTGFC-DOTOQJQBSA-N 1 2 313.489 4.316 20 0 DIADLO Cc1nc(N2CC[C@H]([C@@H]3CCCC3(C)C)C2)c2c([nH+]1)CCCC2 ZINC001559220243 1059100278 /nfs/dbraw/zinc/10/02/78/1059100278.db2.gz SXJBKUDUXCTGFC-RDJZCZTQSA-N 1 2 313.489 4.316 20 0 DIADLO Cc1nc(N2CCc3ccc(Cl)cc3[C@@H](C)C2)c(C)c(C)[nH+]1 ZINC001559228723 1059106942 /nfs/dbraw/zinc/10/69/42/1059106942.db2.gz MKYLOVMDZOBNMX-NSHDSACASA-N 1 2 315.848 4.221 20 0 DIADLO COc1ccccc1Cc1cn(Cc2ccccc2C2CC2)c[nH+]1 ZINC001559479218 1059252138 /nfs/dbraw/zinc/25/21/38/1059252138.db2.gz VLPNNTFWGKBXRO-UHFFFAOYSA-N 1 2 318.420 4.408 20 0 DIADLO COc1ccccc1Cc1cn(CCCSCC(C)C)c[nH+]1 ZINC001559479117 1059254334 /nfs/dbraw/zinc/25/43/34/1059254334.db2.gz QZVGZOAXMVJROC-UHFFFAOYSA-N 1 2 318.486 4.262 20 0 DIADLO CCC1(CC)CCC(NC(=O)c2c(C)cc(C)[nH+]c2C)CC1 ZINC001531232572 1059260170 /nfs/dbraw/zinc/26/01/70/1059260170.db2.gz DYFCJOSHKCGDDF-UHFFFAOYSA-N 1 2 302.462 4.486 20 0 DIADLO CCCC[N@H+](Cc1cc(Cl)n(C)n1)[C@@H](C)c1ccc(C)o1 ZINC001559503796 1059287656 /nfs/dbraw/zinc/28/76/56/1059287656.db2.gz CXMWQCGHBTYOLA-ZDUSSCGKSA-N 1 2 309.841 4.338 20 0 DIADLO CCCC[N@@H+](Cc1cc(Cl)n(C)n1)[C@@H](C)c1ccc(C)o1 ZINC001559503796 1059287675 /nfs/dbraw/zinc/28/76/75/1059287675.db2.gz CXMWQCGHBTYOLA-ZDUSSCGKSA-N 1 2 309.841 4.338 20 0 DIADLO C[N@H+](Cc1c(Cl)cccc1Cl)C[C@H]1CC[C@H](C2CC2)O1 ZINC001559501635 1059289806 /nfs/dbraw/zinc/28/98/06/1059289806.db2.gz REQWIHKWNFMFJV-MLGOLLRUSA-N 1 2 314.256 4.383 20 0 DIADLO C[N@@H+](Cc1c(Cl)cccc1Cl)C[C@H]1CC[C@H](C2CC2)O1 ZINC001559501635 1059289784 /nfs/dbraw/zinc/28/97/84/1059289784.db2.gz REQWIHKWNFMFJV-MLGOLLRUSA-N 1 2 314.256 4.383 20 0 DIADLO CCOC(=O)C[N@H+](CCC(C)(C)C1CC1)Cc1ccc(F)cc1 ZINC001559509927 1059301925 /nfs/dbraw/zinc/30/19/25/1059301925.db2.gz OOMIZNVQGCPBLV-UHFFFAOYSA-N 1 2 321.436 4.017 20 0 DIADLO CCOC(=O)C[N@@H+](CCC(C)(C)C1CC1)Cc1ccc(F)cc1 ZINC001559509927 1059301946 /nfs/dbraw/zinc/30/19/46/1059301946.db2.gz OOMIZNVQGCPBLV-UHFFFAOYSA-N 1 2 321.436 4.017 20 0 DIADLO CCOC(=O)C[N@H+](CCCC(C)(C)C)Cc1ccc(F)cc1 ZINC001559509775 1059304346 /nfs/dbraw/zinc/30/43/46/1059304346.db2.gz IAZPCRDJCCGMIV-UHFFFAOYSA-N 1 2 309.425 4.017 20 0 DIADLO CCOC(=O)C[N@@H+](CCCC(C)(C)C)Cc1ccc(F)cc1 ZINC001559509775 1059304362 /nfs/dbraw/zinc/30/43/62/1059304362.db2.gz IAZPCRDJCCGMIV-UHFFFAOYSA-N 1 2 309.425 4.017 20 0 DIADLO Cc1cc(C[NH+]2Cc3ccccc3-c3ccccc3C2)nc(C)n1 ZINC001559514362 1059309626 /nfs/dbraw/zinc/30/96/26/1059309626.db2.gz AJJZQPMKWVGGCM-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@@H](C(C)C)CC1 ZINC001559546112 1059351511 /nfs/dbraw/zinc/35/15/11/1059351511.db2.gz OBZBGWYUOSDGCZ-PBHICJAKSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@@H](C(C)C)CC1 ZINC001559546112 1059351532 /nfs/dbraw/zinc/35/15/32/1059351532.db2.gz OBZBGWYUOSDGCZ-PBHICJAKSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)C1([NH2+]Cc2c(C)ccc3ccccc32)CCCCC1 ZINC001559551048 1059364331 /nfs/dbraw/zinc/36/43/31/1059364331.db2.gz XMBVGXFCHIFEHZ-UHFFFAOYSA-N 1 2 311.425 4.114 20 0 DIADLO c1[nH]c2c([nH+]1)[C@H](c1nc(-c3cccc4ccccc43)no1)CCC2 ZINC001247276163 1059365374 /nfs/dbraw/zinc/36/53/74/1059365374.db2.gz PETOHCZHWIZIGH-OAHLLOKOSA-N 1 2 316.364 4.081 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ncc(Br)cc2Cl)[C@H]1C ZINC001559559325 1059365962 /nfs/dbraw/zinc/36/59/62/1059365962.db2.gz ONOFHEICVMSHGQ-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ncc(Br)cc2Cl)[C@H]1C ZINC001559559325 1059365985 /nfs/dbraw/zinc/36/59/85/1059365985.db2.gz ONOFHEICVMSHGQ-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO c1[nH]c2c([nH+]1)[C@H](c1nc(-c3ccc4ccccc4c3)no1)CCC2 ZINC001247275730 1059367712 /nfs/dbraw/zinc/36/77/12/1059367712.db2.gz LKSXHCFZXIVVGI-OAHLLOKOSA-N 1 2 316.364 4.081 20 0 DIADLO Clc1ncsc1C[N@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC001559604958 1059439864 /nfs/dbraw/zinc/43/98/64/1059439864.db2.gz WZZQLAVHBVVLEU-CQSZACIVSA-N 1 2 304.846 4.448 20 0 DIADLO Clc1ncsc1C[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC001559604958 1059439869 /nfs/dbraw/zinc/43/98/69/1059439869.db2.gz WZZQLAVHBVVLEU-CQSZACIVSA-N 1 2 304.846 4.448 20 0 DIADLO CC(C)CCOCC[N@@H+]1CCc2c(Cl)cc(Cl)cc2C1 ZINC001559653678 1059482664 /nfs/dbraw/zinc/48/26/64/1059482664.db2.gz ZLEZAPDYXUPNHB-UHFFFAOYSA-N 1 2 316.272 4.414 20 0 DIADLO CC(C)CCOCC[N@H+]1CCc2c(Cl)cc(Cl)cc2C1 ZINC001559653678 1059482674 /nfs/dbraw/zinc/48/26/74/1059482674.db2.gz ZLEZAPDYXUPNHB-UHFFFAOYSA-N 1 2 316.272 4.414 20 0 DIADLO CC[C@H](C)[C@H](C(=O)OC)[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001559659801 1059489157 /nfs/dbraw/zinc/48/91/57/1059489157.db2.gz AINNTENNTMHETQ-SUMWQHHRSA-N 1 2 321.848 4.017 20 0 DIADLO CC[C@H](C)[C@H](C(=O)OC)[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001559659801 1059489169 /nfs/dbraw/zinc/48/91/69/1059489169.db2.gz AINNTENNTMHETQ-SUMWQHHRSA-N 1 2 321.848 4.017 20 0 DIADLO CC[C@@H](C)[C@@H](C(=O)OC)[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001559659799 1059490111 /nfs/dbraw/zinc/49/01/11/1059490111.db2.gz AINNTENNTMHETQ-DYVFJYSZSA-N 1 2 321.848 4.017 20 0 DIADLO CC[C@@H](C)[C@@H](C(=O)OC)[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001559659799 1059490121 /nfs/dbraw/zinc/49/01/21/1059490121.db2.gz AINNTENNTMHETQ-DYVFJYSZSA-N 1 2 321.848 4.017 20 0 DIADLO c1cn(-c2ccc(-c3noc(C4CCCCCC4)n3)cc2)c[nH+]1 ZINC001247539773 1059524407 /nfs/dbraw/zinc/52/44/07/1059524407.db2.gz WVWYCQQNDPLLJV-UHFFFAOYSA-N 1 2 308.385 4.360 20 0 DIADLO C[C@@H](CC(=O)OCCCc1cccc2ccccc21)n1cc[nH+]c1 ZINC001532286161 1059579719 /nfs/dbraw/zinc/57/97/19/1059579719.db2.gz HTIUECJGNIEAMZ-INIZCTEOSA-N 1 2 322.408 4.163 20 0 DIADLO CC(C)(C)c1ccc(-c2noc([C@@H]([NH3+])c3ccccc3)n2)cc1 ZINC001247650024 1059585819 /nfs/dbraw/zinc/58/58/19/1059585819.db2.gz GEXSLKIJILDXAI-INIZCTEOSA-N 1 2 307.397 4.082 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@@H]1CCCC[C@H]1C1CC1 ZINC001532353895 1059601229 /nfs/dbraw/zinc/60/12/29/1059601229.db2.gz VBVRVNQKALYYKS-ZWKOTPCHSA-N 1 2 309.413 4.027 20 0 DIADLO CCOC(=O)[C@H](CC)[N@H+](C/C=C\c1ccc(Cl)cc1)C1CC1 ZINC001559766040 1059601737 /nfs/dbraw/zinc/60/17/37/1059601737.db2.gz WMFGKFSVHFBYGV-OSJSJHBBSA-N 1 2 321.848 4.159 20 0 DIADLO CCOC(=O)[C@H](CC)[N@@H+](C/C=C\c1ccc(Cl)cc1)C1CC1 ZINC001559766040 1059601755 /nfs/dbraw/zinc/60/17/55/1059601755.db2.gz WMFGKFSVHFBYGV-OSJSJHBBSA-N 1 2 321.848 4.159 20 0 DIADLO C[C@@H]1C[N@H+](CCc2cccc(Cl)c2Cl)C[C@@H](C2CC2)O1 ZINC001559802215 1059639625 /nfs/dbraw/zinc/63/96/25/1059639625.db2.gz ULQZTRLHZLYRQL-ABAIWWIYSA-N 1 2 314.256 4.035 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)C[C@@H](C2CC2)O1 ZINC001559802215 1059639630 /nfs/dbraw/zinc/63/96/30/1059639630.db2.gz ULQZTRLHZLYRQL-ABAIWWIYSA-N 1 2 314.256 4.035 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2noc3c2CC(C)(C)CC3)c1 ZINC001559811808 1059648803 /nfs/dbraw/zinc/64/88/03/1059648803.db2.gz PPPZQOGHZYQLNC-UHFFFAOYSA-N 1 2 312.457 4.438 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2noc3c2CC(C)(C)CC3)c1 ZINC001559811808 1059648814 /nfs/dbraw/zinc/64/88/14/1059648814.db2.gz PPPZQOGHZYQLNC-UHFFFAOYSA-N 1 2 312.457 4.438 20 0 DIADLO CCN(Cc1ccc(Cl)cc1)C(=O)c1c(C)cc(C)[nH+]c1C ZINC001524844070 1059652195 /nfs/dbraw/zinc/65/21/95/1059652195.db2.gz CBKHZDXYYSWJPD-UHFFFAOYSA-N 1 2 316.832 4.323 20 0 DIADLO CC[C@@]([NH2+]CC1CCCCCC1)(C(=O)OC)c1ccccc1 ZINC001559830784 1059664860 /nfs/dbraw/zinc/66/48/60/1059664860.db2.gz LIDXSJUOUYCNPB-IBGZPJMESA-N 1 2 303.446 4.025 20 0 DIADLO Cc1cc(C)[nH+]c(CN2CCc3c(Cl)cc(F)cc3C2)c1 ZINC001559874983 1059693123 /nfs/dbraw/zinc/69/31/23/1059693123.db2.gz HQQOGDUVXNKCDZ-UHFFFAOYSA-N 1 2 304.796 4.049 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCCn3c(cc4ccccc43)C2)c(C)n1 ZINC001559875171 1059696448 /nfs/dbraw/zinc/69/64/48/1059696448.db2.gz NQGVXHZDIFIKFP-UHFFFAOYSA-N 1 2 319.452 4.367 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCCn3c(cc4ccccc43)C2)c(C)n1 ZINC001559875171 1059696453 /nfs/dbraw/zinc/69/64/53/1059696453.db2.gz NQGVXHZDIFIKFP-UHFFFAOYSA-N 1 2 319.452 4.367 20 0 DIADLO FCc1ccccc1C[NH2+][C@H](Cc1ccccc1)c1ncco1 ZINC001559945510 1059755388 /nfs/dbraw/zinc/75/53/88/1059755388.db2.gz WGWGDTUTYOQXII-GOSISDBHSA-N 1 2 310.372 4.218 20 0 DIADLO Cc1ccc(F)cc1C[NH2+][C@@H](Cc1ccccc1)c1ncco1 ZINC001559945194 1059758694 /nfs/dbraw/zinc/75/86/94/1059758694.db2.gz KYVBXKVXNHDLTR-SFHVURJKSA-N 1 2 310.372 4.196 20 0 DIADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1CCc1c(Cl)cccc1Cl ZINC001559973023 1059781818 /nfs/dbraw/zinc/78/18/18/1059781818.db2.gz CFEBKHAMPAVKKQ-OLZOCXBDSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1CCc1c(Cl)cccc1Cl ZINC001559973023 1059781838 /nfs/dbraw/zinc/78/18/38/1059781838.db2.gz CFEBKHAMPAVKKQ-OLZOCXBDSA-N 1 2 316.272 4.425 20 0 DIADLO C[C@@H](c1nc(-c2ccccc2-n2cc[nH+]c2)no1)c1ccccc1 ZINC001248330212 1059782074 /nfs/dbraw/zinc/78/20/74/1059782074.db2.gz BJWGZZNURJIIME-CQSZACIVSA-N 1 2 316.364 4.074 20 0 DIADLO O=C(CCCc1ccc(C2CC2)cc1)Nc1ccc2[nH+]ccn2c1 ZINC001533107294 1059797330 /nfs/dbraw/zinc/79/73/30/1059797330.db2.gz GLVZCKGPUMNXAW-UHFFFAOYSA-N 1 2 319.408 4.173 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)c1cccc(C2CCCC2)c1 ZINC001533110319 1059797703 /nfs/dbraw/zinc/79/77/03/1059797703.db2.gz ULBLQTZNNNRUED-UHFFFAOYSA-N 1 2 305.381 4.244 20 0 DIADLO CC1(C)CO[C@H](c2cccc(F)c2)C[N@@H+]1Cc1ccc(F)cc1 ZINC001560001589 1059806331 /nfs/dbraw/zinc/80/63/31/1059806331.db2.gz NBEMLCIRXWTILJ-SFHVURJKSA-N 1 2 317.379 4.317 20 0 DIADLO CC1(C)CO[C@H](c2cccc(F)c2)C[N@H+]1Cc1ccc(F)cc1 ZINC001560001589 1059806357 /nfs/dbraw/zinc/80/63/57/1059806357.db2.gz NBEMLCIRXWTILJ-SFHVURJKSA-N 1 2 317.379 4.317 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC001560013819 1059825485 /nfs/dbraw/zinc/82/54/85/1059825485.db2.gz DISLOWNSAVQTLJ-ZETOZRRWSA-N 1 2 303.780 4.146 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC001560013819 1059825516 /nfs/dbraw/zinc/82/55/16/1059825516.db2.gz DISLOWNSAVQTLJ-ZETOZRRWSA-N 1 2 303.780 4.146 20 0 DIADLO Fc1c(F)c(F)c(C[N@@H+]2CCCC3(CC3)CC2)c(F)c1F ZINC001560040607 1059849432 /nfs/dbraw/zinc/84/94/32/1059849432.db2.gz VNLCTAFTZVXQGJ-UHFFFAOYSA-N 1 2 305.290 4.148 20 0 DIADLO Fc1c(F)c(F)c(C[N@H+]2CCCC3(CC3)CC2)c(F)c1F ZINC001560040607 1059849461 /nfs/dbraw/zinc/84/94/61/1059849461.db2.gz VNLCTAFTZVXQGJ-UHFFFAOYSA-N 1 2 305.290 4.148 20 0 DIADLO Clc1ccc(-c2cccc(C[N@@H+]3CCn4cccc4C3)n2)cc1 ZINC001248516001 1059862551 /nfs/dbraw/zinc/86/25/51/1059862551.db2.gz MMQAFUOORLMHOE-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Clc1ccc(-c2cccc(C[N@H+]3CCn4cccc4C3)n2)cc1 ZINC001248516001 1059862581 /nfs/dbraw/zinc/86/25/81/1059862581.db2.gz MMQAFUOORLMHOE-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Fc1ccc2occc2c1C[N@@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001248528823 1059864334 /nfs/dbraw/zinc/86/43/34/1059864334.db2.gz WPISHCYJOQZSMQ-CQSZACIVSA-N 1 2 301.283 4.141 20 0 DIADLO Fc1ccc2occc2c1C[N@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001248528823 1059864357 /nfs/dbraw/zinc/86/43/57/1059864357.db2.gz WPISHCYJOQZSMQ-CQSZACIVSA-N 1 2 301.283 4.141 20 0 DIADLO Fc1ccc2occc2c1C[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC001248539696 1059871955 /nfs/dbraw/zinc/87/19/55/1059871955.db2.gz UCTXXPPQPMCEGZ-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccc2occc2c1C[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC001248539696 1059871981 /nfs/dbraw/zinc/87/19/81/1059871981.db2.gz UCTXXPPQPMCEGZ-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1c3ccoc3ccc1F)CC2 ZINC001248541831 1059875316 /nfs/dbraw/zinc/87/53/16/1059875316.db2.gz LWGNHHPTJRYIAL-UHFFFAOYSA-N 1 2 323.367 4.333 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1c3ccoc3ccc1F)CC2 ZINC001248541831 1059875342 /nfs/dbraw/zinc/87/53/42/1059875342.db2.gz LWGNHHPTJRYIAL-UHFFFAOYSA-N 1 2 323.367 4.333 20 0 DIADLO Cc1cccc(Br)c1C[N@H+](C)Cc1cccc(O)c1 ZINC001248604776 1059909578 /nfs/dbraw/zinc/90/95/78/1059909578.db2.gz QFUBTZDLPUCXJG-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1cccc(Br)c1C[N@@H+](C)Cc1cccc(O)c1 ZINC001248604776 1059909601 /nfs/dbraw/zinc/90/96/01/1059909601.db2.gz QFUBTZDLPUCXJG-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO CC(C)(C)[C@@H]1CSCC[N@@H+]1Cc1c(Cl)cncc1Cl ZINC001560101297 1059909628 /nfs/dbraw/zinc/90/96/28/1059909628.db2.gz IDKORQSZXOVFII-ZDUSSCGKSA-N 1 2 319.301 4.352 20 0 DIADLO CC(C)(C)[C@@H]1CSCC[N@H+]1Cc1c(Cl)cncc1Cl ZINC001560101297 1059909653 /nfs/dbraw/zinc/90/96/53/1059909653.db2.gz IDKORQSZXOVFII-ZDUSSCGKSA-N 1 2 319.301 4.352 20 0 DIADLO CCO[C@H]1CCC[N@H+](Cc2ccc(Cl)c(Cl)c2OC)C1 ZINC001248637283 1059921476 /nfs/dbraw/zinc/92/14/76/1059921476.db2.gz KVFJWTZXMGHXML-LBPRGKRZSA-N 1 2 318.244 4.003 20 0 DIADLO CCO[C@H]1CCC[N@@H+](Cc2ccc(Cl)c(Cl)c2OC)C1 ZINC001248637283 1059921487 /nfs/dbraw/zinc/92/14/87/1059921487.db2.gz KVFJWTZXMGHXML-LBPRGKRZSA-N 1 2 318.244 4.003 20 0 DIADLO COc1c(C[N@H+](C)Cc2ccccn2)ccc(Cl)c1Cl ZINC001248624385 1059916826 /nfs/dbraw/zinc/91/68/26/1059916826.db2.gz QIKANPKPOHJKJY-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1c(C[N@@H+](C)Cc2ccccn2)ccc(Cl)c1Cl ZINC001248624385 1059916839 /nfs/dbraw/zinc/91/68/39/1059916839.db2.gz QIKANPKPOHJKJY-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO CC(C)Oc1cc(C[N@@H+]2CCC[C@@H](F)C2)cc(OC(C)C)c1 ZINC001248658658 1059928248 /nfs/dbraw/zinc/92/82/48/1059928248.db2.gz QACYYLXSJUJION-MRXNPFEDSA-N 1 2 309.425 4.195 20 0 DIADLO CC(C)Oc1cc(C[N@H+]2CCC[C@@H](F)C2)cc(OC(C)C)c1 ZINC001248658658 1059928272 /nfs/dbraw/zinc/92/82/72/1059928272.db2.gz QACYYLXSJUJION-MRXNPFEDSA-N 1 2 309.425 4.195 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2CC[C@@H](c3c(F)cccc3F)C2)n1 ZINC001560131102 1059934165 /nfs/dbraw/zinc/93/41/65/1059934165.db2.gz UJLYGGRIQOHDET-GFCCVEGCSA-N 1 2 320.383 4.240 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)n1 ZINC001560131102 1059934187 /nfs/dbraw/zinc/93/41/87/1059934187.db2.gz UJLYGGRIQOHDET-GFCCVEGCSA-N 1 2 320.383 4.240 20 0 DIADLO Cc1noc2ccc(C[N@@H+]3CCc4c5ccccc5oc4C3)cc12 ZINC001248708226 1059946742 /nfs/dbraw/zinc/94/67/42/1059946742.db2.gz AUNGEOZRBRKLGB-UHFFFAOYSA-N 1 2 318.376 4.441 20 0 DIADLO Cc1noc2ccc(C[N@H+]3CCc4c5ccccc5oc4C3)cc12 ZINC001248708226 1059946767 /nfs/dbraw/zinc/94/67/67/1059946767.db2.gz AUNGEOZRBRKLGB-UHFFFAOYSA-N 1 2 318.376 4.441 20 0 DIADLO Cc1[nH]c(C2CCN(Cc3cc(Cl)ccc3F)CC2)[nH+]c1C ZINC001560149505 1059950835 /nfs/dbraw/zinc/95/08/35/1059950835.db2.gz MGCQUSFUZMANIP-UHFFFAOYSA-N 1 2 321.827 4.199 20 0 DIADLO Cc1cc([C@@H]2CCCC[N@@H+]2CCSc2ccccc2)n[nH]1 ZINC001560174203 1059965833 /nfs/dbraw/zinc/96/58/33/1059965833.db2.gz WVONSFWKLNPHSJ-KRWDZBQOSA-N 1 2 301.459 4.037 20 0 DIADLO Cc1cc([C@@H]2CCCC[N@H+]2CCSc2ccccc2)n[nH]1 ZINC001560174203 1059965848 /nfs/dbraw/zinc/96/58/48/1059965848.db2.gz WVONSFWKLNPHSJ-KRWDZBQOSA-N 1 2 301.459 4.037 20 0 DIADLO Fc1cc(C(F)(F)F)cnc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC001248790215 1059978299 /nfs/dbraw/zinc/97/82/99/1059978299.db2.gz IANWSWLZDLNONR-HNNXBMFYSA-N 1 2 310.294 4.187 20 0 DIADLO Fc1cc(C(F)(F)F)cnc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC001248790215 1059978323 /nfs/dbraw/zinc/97/83/23/1059978323.db2.gz IANWSWLZDLNONR-HNNXBMFYSA-N 1 2 310.294 4.187 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccco2)C2CC2)c(OC)c1Cl ZINC001248800352 1059981159 /nfs/dbraw/zinc/98/11/59/1059981159.db2.gz PWAMCYPAAPRAPU-UHFFFAOYSA-N 1 2 321.804 4.115 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccco2)C2CC2)c(OC)c1Cl ZINC001248800352 1059981183 /nfs/dbraw/zinc/98/11/83/1059981183.db2.gz PWAMCYPAAPRAPU-UHFFFAOYSA-N 1 2 321.804 4.115 20 0 DIADLO COc1nccc(Cl)c1C[N@H+](Cc1ccccc1)C1CCC1 ZINC001248796208 1059982355 /nfs/dbraw/zinc/98/23/55/1059982355.db2.gz LPZWQCNHULYTPQ-UHFFFAOYSA-N 1 2 316.832 4.298 20 0 DIADLO COc1nccc(Cl)c1C[N@@H+](Cc1ccccc1)C1CCC1 ZINC001248796208 1059982380 /nfs/dbraw/zinc/98/23/80/1059982380.db2.gz LPZWQCNHULYTPQ-UHFFFAOYSA-N 1 2 316.832 4.298 20 0 DIADLO Clc1cc(-c2ccccc2)ccc1C[N@@H+]1CCOC2(CC2)C1 ZINC001248820519 1060003889 /nfs/dbraw/zinc/00/38/89/1060003889.db2.gz OYBIXZOMQDWYID-UHFFFAOYSA-N 1 2 313.828 4.372 20 0 DIADLO Clc1cc(-c2ccccc2)ccc1C[N@H+]1CCOC2(CC2)C1 ZINC001248820519 1060003909 /nfs/dbraw/zinc/00/39/09/1060003909.db2.gz OYBIXZOMQDWYID-UHFFFAOYSA-N 1 2 313.828 4.372 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CCC[C@@H]3c3ccccc3F)nc2c1 ZINC001248842372 1060013151 /nfs/dbraw/zinc/01/31/51/1060013151.db2.gz RZDOFTFMEHLKAO-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CCC[C@@H]3c3ccccc3F)nc2c1 ZINC001248842372 1060013172 /nfs/dbraw/zinc/01/31/72/1060013172.db2.gz RZDOFTFMEHLKAO-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO CC1(C)CC[NH+](Cc2nc3cccc(Br)c3o2)CC1 ZINC001248851055 1060020045 /nfs/dbraw/zinc/02/00/45/1060020045.db2.gz VRIQWJORVVZMNV-UHFFFAOYSA-N 1 2 323.234 4.212 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nc3cccc(Br)c3o2)[C@@H](C)C1 ZINC001248851354 1060022654 /nfs/dbraw/zinc/02/26/54/1060022654.db2.gz IEQHUINXKCMPIL-MNOVXSKESA-N 1 2 323.234 4.211 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nc3cccc(Br)c3o2)[C@@H](C)C1 ZINC001248851354 1060022673 /nfs/dbraw/zinc/02/26/73/1060022673.db2.gz IEQHUINXKCMPIL-MNOVXSKESA-N 1 2 323.234 4.211 20 0 DIADLO Cc1csc(C[NH2+]Cc2cc3cccc(C)c3nc2Cl)n1 ZINC001560260115 1060027505 /nfs/dbraw/zinc/02/75/05/1060027505.db2.gz QXBYPKBQVFDSGB-UHFFFAOYSA-N 1 2 317.845 4.251 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3cc(C)c(Cl)c(C)c3)ccn12 ZINC001533843752 1060041226 /nfs/dbraw/zinc/04/12/26/1060041226.db2.gz ZNPFTVKINWRIFY-UHFFFAOYSA-N 1 2 314.772 4.132 20 0 DIADLO Cc1cc(Br)cn2c(CNc3ccccc3)c[nH+]c12 ZINC001560278097 1060053507 /nfs/dbraw/zinc/05/35/07/1060053507.db2.gz XVHWNXQOIFEYGP-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO Cc1cc(C)nc(C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)n1 ZINC001248931656 1060066638 /nfs/dbraw/zinc/06/66/38/1060066638.db2.gz CEWUONUFKWGWJJ-UHFFFAOYSA-N 1 2 313.832 4.036 20 0 DIADLO Cc1cc(C)nc(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)n1 ZINC001248931656 1060066656 /nfs/dbraw/zinc/06/66/56/1060066656.db2.gz CEWUONUFKWGWJJ-UHFFFAOYSA-N 1 2 313.832 4.036 20 0 DIADLO CCC1(CC)C[C@@H]1c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001248946485 1060073983 /nfs/dbraw/zinc/07/39/83/1060073983.db2.gz BLPRGUIDPBHJKU-OAHLLOKOSA-N 1 2 308.385 4.216 20 0 DIADLO c1cn(-c2ccccc2-c2noc([C@H]3CC34CCCCC4)n2)c[nH+]1 ZINC001248951271 1060082451 /nfs/dbraw/zinc/08/24/51/1060082451.db2.gz DZBGRAVVGCIWAI-OAHLLOKOSA-N 1 2 320.396 4.360 20 0 DIADLO c1cn(-c2ccccc2-c2noc([C@@H]3CC34CCCCC4)n2)c[nH+]1 ZINC001248951270 1060083348 /nfs/dbraw/zinc/08/33/48/1060083348.db2.gz DZBGRAVVGCIWAI-HNNXBMFYSA-N 1 2 320.396 4.360 20 0 DIADLO CNc1ccc(C)cc1C[NH2+][C@H](c1nccs1)c1ccccc1 ZINC001560302711 1060089485 /nfs/dbraw/zinc/08/94/85/1060089485.db2.gz IQVYJXVUPIKESW-SFHVURJKSA-N 1 2 323.465 4.372 20 0 DIADLO CC[N@H+](Cc1cccc(C(F)(F)F)c1)Cc1nc(C)cc(C)n1 ZINC001248982846 1060101067 /nfs/dbraw/zinc/10/10/67/1060101067.db2.gz NWKMZWRVMVXKPU-UHFFFAOYSA-N 1 2 323.362 4.134 20 0 DIADLO CC[N@@H+](Cc1cccc(C(F)(F)F)c1)Cc1nc(C)cc(C)n1 ZINC001248982846 1060101072 /nfs/dbraw/zinc/10/10/72/1060101072.db2.gz NWKMZWRVMVXKPU-UHFFFAOYSA-N 1 2 323.362 4.134 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2ccccn2)c(Cl)nc1C ZINC001249020487 1060112190 /nfs/dbraw/zinc/11/21/90/1060112190.db2.gz VULGUYWIQTXVQP-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2ccccn2)c(Cl)nc1C ZINC001249020487 1060112197 /nfs/dbraw/zinc/11/21/97/1060112197.db2.gz VULGUYWIQTXVQP-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C[N@H+](C)CCC(=O)c2ccccc2)c(Cl)nc1C ZINC001249020186 1060112790 /nfs/dbraw/zinc/11/27/90/1060112790.db2.gz TXWUQEODEWDCBR-UHFFFAOYSA-N 1 2 316.832 4.057 20 0 DIADLO Cc1cc(C[N@@H+](C)CCC(=O)c2ccccc2)c(Cl)nc1C ZINC001249020186 1060112797 /nfs/dbraw/zinc/11/27/97/1060112797.db2.gz TXWUQEODEWDCBR-UHFFFAOYSA-N 1 2 316.832 4.057 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c(Cl)nc1C ZINC001249020490 1060112891 /nfs/dbraw/zinc/11/28/91/1060112891.db2.gz VULGUYWIQTXVQP-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2ccccn2)c(Cl)nc1C ZINC001249020490 1060112900 /nfs/dbraw/zinc/11/29/00/1060112900.db2.gz VULGUYWIQTXVQP-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO COC(=O)[C@@]1(C)CCC[N@@H+]1Cc1sc(Cl)c2ccccc21 ZINC001249051870 1060131941 /nfs/dbraw/zinc/13/19/41/1060131941.db2.gz UPQKJJTVKAZZCF-MRXNPFEDSA-N 1 2 323.845 4.082 20 0 DIADLO COC(=O)[C@@]1(C)CCC[N@H+]1Cc1sc(Cl)c2ccccc21 ZINC001249051870 1060131945 /nfs/dbraw/zinc/13/19/45/1060131945.db2.gz UPQKJJTVKAZZCF-MRXNPFEDSA-N 1 2 323.845 4.082 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C)c2ccc(Cl)c(F)c2)c(C)[nH+]1 ZINC001534085513 1060132346 /nfs/dbraw/zinc/13/23/46/1060132346.db2.gz IJJRSPMVJOUEAU-NSHDSACASA-N 1 2 320.795 4.290 20 0 DIADLO COC[C@H]([NH2+]Cc1cc(C(C)(C)C)oc1C)c1ccc(C)o1 ZINC001560362702 1060148737 /nfs/dbraw/zinc/14/87/37/1060148737.db2.gz WKWDEEZHQJMUGB-HNNXBMFYSA-N 1 2 305.418 4.264 20 0 DIADLO COc1ccc(-c2ccc(C[NH2+]Cc3ncc(C)o3)s2)cc1 ZINC001560370247 1060157954 /nfs/dbraw/zinc/15/79/54/1060157954.db2.gz AZLPGKQHBIPBJZ-UHFFFAOYSA-N 1 2 314.410 4.010 20 0 DIADLO c1ccc2c(c1)C[NH2+][C@H]2c1nc(-c2cccc3ccccc32)no1 ZINC001249133661 1060168845 /nfs/dbraw/zinc/16/88/45/1060168845.db2.gz UFNRPGAJWJGWIW-GOSISDBHSA-N 1 2 313.360 4.082 20 0 DIADLO CCCCC(C)(C)c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001249155899 1060173072 /nfs/dbraw/zinc/17/30/72/1060173072.db2.gz PMLVFBRPBIWSOW-UHFFFAOYSA-N 1 2 310.401 4.390 20 0 DIADLO CCC[C@](C)(CC)c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001249165913 1060178059 /nfs/dbraw/zinc/17/80/59/1060178059.db2.gz MPWNXJDIPCNSBB-SFHVURJKSA-N 1 2 310.401 4.390 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3CC[N@@H+]3Cc3ccccc3)n2)cc1F ZINC001249255969 1060205680 /nfs/dbraw/zinc/20/56/80/1060205680.db2.gz MRFKDAAGEKXFLV-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3CC[N@H+]3Cc3ccccc3)n2)cc1F ZINC001249255969 1060205700 /nfs/dbraw/zinc/20/57/00/1060205700.db2.gz MRFKDAAGEKXFLV-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1c(F)cccc1-c1noc([C@H]2CC[N@@H+]2Cc2ccccc2)n1 ZINC001249253376 1060206157 /nfs/dbraw/zinc/20/61/57/1060206157.db2.gz XKZPPDKQCUWHRF-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1c(F)cccc1-c1noc([C@H]2CC[N@H+]2Cc2ccccc2)n1 ZINC001249253376 1060206178 /nfs/dbraw/zinc/20/61/78/1060206178.db2.gz XKZPPDKQCUWHRF-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cc(CNc2ccc([NH+](C)C)c(C)c2)c2c(n1)CCCC2 ZINC001560422751 1060206309 /nfs/dbraw/zinc/20/63/09/1060206309.db2.gz BDQFDJVJDXYMFL-UHFFFAOYSA-N 1 2 309.457 4.255 20 0 DIADLO c1sc(-c2ccncc2)nc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC001249297975 1060213661 /nfs/dbraw/zinc/21/36/61/1060213661.db2.gz DRXFRGWXUDVSAR-KRWDZBQOSA-N 1 2 307.422 4.152 20 0 DIADLO c1sc(-c2ccncc2)nc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC001249297975 1060213676 /nfs/dbraw/zinc/21/36/76/1060213676.db2.gz DRXFRGWXUDVSAR-KRWDZBQOSA-N 1 2 307.422 4.152 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1csc(-c3ccncc3)n1)C2 ZINC001249310887 1060217417 /nfs/dbraw/zinc/21/74/17/1060217417.db2.gz UQVGQUXBJLQUNU-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1csc(-c3ccncc3)n1)C2 ZINC001249310887 1060217434 /nfs/dbraw/zinc/21/74/34/1060217434.db2.gz UQVGQUXBJLQUNU-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1cccc(-c2noc([C@@H]([NH3+])c3ccc4ccccc4c3)n2)c1 ZINC001249325524 1060219752 /nfs/dbraw/zinc/21/97/52/1060219752.db2.gz NQSJPCUIHJQNCR-SFHVURJKSA-N 1 2 315.376 4.246 20 0 DIADLO COCCc1ccccc1NCc1cc(C)[nH+]c2c1CCCC2 ZINC001560440804 1060229439 /nfs/dbraw/zinc/22/94/39/1060229439.db2.gz HCDATJJTZPATFO-UHFFFAOYSA-N 1 2 310.441 4.070 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cc(Br)sc2Cl)C1 ZINC001249378933 1060230409 /nfs/dbraw/zinc/23/04/09/1060230409.db2.gz FUGNGERJEONQGT-MRVPVSSYSA-N 1 2 308.672 4.396 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cc(Br)sc2Cl)C1 ZINC001249378933 1060230427 /nfs/dbraw/zinc/23/04/27/1060230427.db2.gz FUGNGERJEONQGT-MRVPVSSYSA-N 1 2 308.672 4.396 20 0 DIADLO CC[C@H](c1ccccc1)[N@H+](C)Cc1nc2ccc(OC)cc2[nH]1 ZINC001249414518 1060239575 /nfs/dbraw/zinc/23/95/75/1060239575.db2.gz KXOWRTQVWXZTFA-GOSISDBHSA-N 1 2 309.413 4.155 20 0 DIADLO CC[C@H](c1ccccc1)[N@@H+](C)Cc1nc2ccc(OC)cc2[nH]1 ZINC001249414518 1060239596 /nfs/dbraw/zinc/23/95/96/1060239596.db2.gz KXOWRTQVWXZTFA-GOSISDBHSA-N 1 2 309.413 4.155 20 0 DIADLO COc1ccc2nc(C[N@@H+]3CCC[C@H]3c3ccc(C)cc3)[nH]c2c1 ZINC001249413717 1060243477 /nfs/dbraw/zinc/24/34/77/1060243477.db2.gz CUIGYMYELSSUNF-IBGZPJMESA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccc2nc(C[N@H+]3CCC[C@H]3c3ccc(C)cc3)[nH]c2c1 ZINC001249413717 1060243495 /nfs/dbraw/zinc/24/34/95/1060243495.db2.gz CUIGYMYELSSUNF-IBGZPJMESA-N 1 2 321.424 4.217 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)cn1 ZINC001249512130 1060270200 /nfs/dbraw/zinc/27/02/00/1060270200.db2.gz FTPJBIYACKCJLE-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]2c2cccnc2)cn1 ZINC001249512130 1060270218 /nfs/dbraw/zinc/27/02/18/1060270218.db2.gz FTPJBIYACKCJLE-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1[nH+]c(NCc2cc(Cl)cs2)ccc1-c1cnn(C)c1 ZINC001560482080 1060271291 /nfs/dbraw/zinc/27/12/91/1060271291.db2.gz FPBJIBZAHWNSFY-UHFFFAOYSA-N 1 2 318.833 4.118 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+]2CCC[C@H]2c2ccccn2)cn1 ZINC001249514281 1060274090 /nfs/dbraw/zinc/27/40/90/1060274090.db2.gz FOPZMLGTGHTKDG-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+]2CCC[C@H]2c2ccccn2)cn1 ZINC001249514281 1060274100 /nfs/dbraw/zinc/27/41/00/1060274100.db2.gz FOPZMLGTGHTKDG-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO c1sc(C[N@@H+]2CCSc3ccccc3C2)nc1C1CC1 ZINC001249530040 1060276628 /nfs/dbraw/zinc/27/66/28/1060276628.db2.gz UODLBIQFOAQIEQ-UHFFFAOYSA-N 1 2 302.468 4.128 20 0 DIADLO c1sc(C[N@H+]2CCSc3ccccc3C2)nc1C1CC1 ZINC001249530040 1060276647 /nfs/dbraw/zinc/27/66/47/1060276647.db2.gz UODLBIQFOAQIEQ-UHFFFAOYSA-N 1 2 302.468 4.128 20 0 DIADLO Fc1cc2cc[nH]c2c(C[N@@H+]2CCc3cc(F)c(F)cc3C2)c1 ZINC001249526432 1060278658 /nfs/dbraw/zinc/27/86/58/1060278658.db2.gz FDDUGIMANNRNPV-UHFFFAOYSA-N 1 2 316.326 4.144 20 0 DIADLO Fc1cc2cc[nH]c2c(C[N@H+]2CCc3cc(F)c(F)cc3C2)c1 ZINC001249526432 1060278676 /nfs/dbraw/zinc/27/86/76/1060278676.db2.gz FDDUGIMANNRNPV-UHFFFAOYSA-N 1 2 316.326 4.144 20 0 DIADLO Cc1ccc(-c2cc(Nc3cc[nH+]cc3C(F)(F)F)on2)cc1 ZINC001249582311 1060299015 /nfs/dbraw/zinc/29/90/15/1060299015.db2.gz AFBNHFQJQSEQIB-UHFFFAOYSA-N 1 2 319.286 4.229 20 0 DIADLO CC(C)(C)c1csc(Nc2cc[nH+]cc2C(F)(F)F)n1 ZINC001249584502 1060302088 /nfs/dbraw/zinc/30/20/88/1060302088.db2.gz SALYBPYCKFSIBZ-UHFFFAOYSA-N 1 2 301.337 4.020 20 0 DIADLO Fc1cc(CNc2cc3cc[nH]c3c[nH+]2)cc(C(F)(F)F)c1 ZINC001560518499 1060317765 /nfs/dbraw/zinc/31/77/65/1060317765.db2.gz XMCJSVQHFWJCFB-UHFFFAOYSA-N 1 2 309.266 4.333 20 0 DIADLO Cc1cc(C)c(NC(=O)C(F)(F)c2ccccc2C)c(C)[nH+]1 ZINC001526806584 1060342889 /nfs/dbraw/zinc/34/28/89/1060342889.db2.gz ZDIHYLSVMHAZGX-UHFFFAOYSA-N 1 2 304.340 4.046 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)CCCCc1ccc(Cl)cc1 ZINC001534713350 1060347074 /nfs/dbraw/zinc/34/70/74/1060347074.db2.gz VFMRYXCJTICREE-UHFFFAOYSA-N 1 2 316.832 4.125 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC(c3ccccc3)CC2)c(C)[nH+]1 ZINC001526816027 1060347846 /nfs/dbraw/zinc/34/78/46/1060347846.db2.gz GMJXLYWXJIBTBS-UHFFFAOYSA-N 1 2 308.425 4.027 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(-c2cccs2)n1)c1ccns1 ZINC001560551529 1060361968 /nfs/dbraw/zinc/36/19/68/1060361968.db2.gz SBTLVEFVPXUMMM-SECBINFHSA-N 1 2 307.469 4.179 20 0 DIADLO Oc1cccc(C[NH2+]Cc2ccsc2C(F)(F)F)c1Cl ZINC001560552624 1060362674 /nfs/dbraw/zinc/36/26/74/1060362674.db2.gz IOUVDSBUBWBBED-UHFFFAOYSA-N 1 2 321.751 4.416 20 0 DIADLO COc1ccc(C2CC2)c(NCc2c[nH+]c3ccc(C)cn23)c1 ZINC001560566791 1060379239 /nfs/dbraw/zinc/37/92/39/1060379239.db2.gz BOSMHJGYIOKVCD-UHFFFAOYSA-N 1 2 307.397 4.141 20 0 DIADLO Cc1ccc2[nH+]c(NCc3cc(Cl)cc4c3OCC4)[nH]c2c1 ZINC001560569881 1060381105 /nfs/dbraw/zinc/38/11/05/1060381105.db2.gz MFGZZHRFSMYOQI-UHFFFAOYSA-N 1 2 313.788 4.072 20 0 DIADLO Cc1ccc2c(c1)[C@@H](NC(=O)c1c(C)cc(C)[nH+]c1C)CCC2 ZINC001534850972 1060386339 /nfs/dbraw/zinc/38/63/39/1060386339.db2.gz SZDYYSLASPZKQQ-SFHVURJKSA-N 1 2 308.425 4.123 20 0 DIADLO COc1ccc(CNc2[nH+]c3ccccc3n2CCC(C)C)o1 ZINC001560575669 1060389483 /nfs/dbraw/zinc/38/94/83/1060389483.db2.gz MJDGXTRSWRUIKO-UHFFFAOYSA-N 1 2 313.401 4.296 20 0 DIADLO CC(C)Oc1cc(F)c(Nc2ccn3cc[nH+]c3c2)c(F)c1 ZINC001249776668 1060394592 /nfs/dbraw/zinc/39/45/92/1060394592.db2.gz YEVWJDIGJWGEJC-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO Fc1ccc(/C=C/C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)c(F)c1 ZINC001560588471 1060399863 /nfs/dbraw/zinc/39/98/63/1060399863.db2.gz XSBAEJNAQVMDAS-CMDLKFMISA-N 1 2 319.326 4.039 20 0 DIADLO CCCCc1ccc(NC(=S)Nc2c[nH+]c(C)n2C)c(C)c1 ZINC001249807977 1060409491 /nfs/dbraw/zinc/40/94/91/1060409491.db2.gz AQEUCNIDNAAKOB-UHFFFAOYSA-N 1 2 316.474 4.188 20 0 DIADLO Cc1ccc2[nH]c(Nc3ccc(Cn4cc[nH+]c4)cc3)cc2c1 ZINC001249844967 1060418218 /nfs/dbraw/zinc/41/82/18/1060418218.db2.gz MUVFVOZKHWLUKD-UHFFFAOYSA-N 1 2 302.381 4.465 20 0 DIADLO Cc1ccc2[nH]c(Nc3ccccc3C[NH+]3CCOCC3)cc2c1 ZINC001249845233 1060418763 /nfs/dbraw/zinc/41/87/63/1060418763.db2.gz TWEMKMWFWMXZBI-UHFFFAOYSA-N 1 2 321.424 4.052 20 0 DIADLO Cn1c[nH+]cc1CNc1ccc(Oc2ccccc2)c(Cl)c1 ZINC001560606829 1060419720 /nfs/dbraw/zinc/41/97/20/1060419720.db2.gz FLNSRNGWMWCMGU-UHFFFAOYSA-N 1 2 313.788 4.478 20 0 DIADLO C[C@]1(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)C[C@@H]1c1ccccc1 ZINC001527042555 1060421343 /nfs/dbraw/zinc/42/13/43/1060421343.db2.gz SWUZYKINMNWPGE-QUCCMNQESA-N 1 2 317.392 4.005 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1cscc1C(F)F ZINC001527042507 1060421660 /nfs/dbraw/zinc/42/16/60/1060421660.db2.gz SBPUBUSERXEOGB-UHFFFAOYSA-N 1 2 319.336 4.124 20 0 DIADLO CCCC[C@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001527046361 1060422374 /nfs/dbraw/zinc/42/23/74/1060422374.db2.gz FIVQPKHCAVIKFG-LBPRGKRZSA-N 1 2 305.809 4.291 20 0 DIADLO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001560635719 1060446906 /nfs/dbraw/zinc/44/69/06/1060446906.db2.gz LKGJKXHFQBJHRT-QWHCGFSZSA-N 1 2 317.260 4.024 20 0 DIADLO Fc1ccc2cc(Nc3ccc(N4CCCCC4)[nH+]c3)[nH]c2c1 ZINC001249874368 1060437053 /nfs/dbraw/zinc/43/70/53/1060437053.db2.gz LGCZGZDLRQNZLE-UHFFFAOYSA-N 1 2 310.376 4.436 20 0 DIADLO CCO[C@@H]1C[C@H]([N@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001560635719 1060446903 /nfs/dbraw/zinc/44/69/03/1060446903.db2.gz LKGJKXHFQBJHRT-QWHCGFSZSA-N 1 2 317.260 4.024 20 0 DIADLO CC/C(=C\C(=O)Nc1ccn2cc[nH+]c2c1)c1ccc(C)cc1 ZINC001535108511 1060463332 /nfs/dbraw/zinc/46/33/32/1060463332.db2.gz WFJQWILUZDYPCD-NTCAYCPXSA-N 1 2 305.381 4.075 20 0 DIADLO C[C@@H]1CN(c2ccc(Nc3cccc4ccoc43)c[nH+]2)C[C@H](C)O1 ZINC001249911327 1060473362 /nfs/dbraw/zinc/47/33/62/1060473362.db2.gz LQYWGXKMZNCPNU-OKILXGFUSA-N 1 2 323.396 4.185 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cnc1Cl ZINC001249926662 1060486618 /nfs/dbraw/zinc/48/66/18/1060486618.db2.gz QQCJBNQUUFYTAJ-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)cnc1Cl ZINC001249926662 1060486625 /nfs/dbraw/zinc/48/66/25/1060486625.db2.gz QQCJBNQUUFYTAJ-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO Oc1ccc([C@H]2CCC[N@@H+]2Cc2c(Cl)ccnc2Cl)cc1 ZINC001560663230 1060490911 /nfs/dbraw/zinc/49/09/11/1060490911.db2.gz HLONWYMWFKSSKS-OAHLLOKOSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@H]2CCC[N@H+]2Cc2c(Cl)ccnc2Cl)cc1 ZINC001560663230 1060490917 /nfs/dbraw/zinc/49/09/17/1060490917.db2.gz HLONWYMWFKSSKS-OAHLLOKOSA-N 1 2 323.223 4.431 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2F)[C@H](C)C1 ZINC001249944393 1060494912 /nfs/dbraw/zinc/49/49/12/1060494912.db2.gz XPKMNUFQUXCGMI-SKDRFNHKSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)[C@H](C)C1 ZINC001249944393 1060494928 /nfs/dbraw/zinc/49/49/28/1060494928.db2.gz XPKMNUFQUXCGMI-SKDRFNHKSA-N 1 2 306.208 4.132 20 0 DIADLO CCOCC1CC[NH+](Cc2cc(Cl)cc(Cl)c2F)CC1 ZINC001249942321 1060496199 /nfs/dbraw/zinc/49/61/99/1060496199.db2.gz SKCVSEFYNKAZEJ-UHFFFAOYSA-N 1 2 320.235 4.381 20 0 DIADLO Cc1cn2cc(NC(=O)C3(c4ccc(C)cc4)CCC3)ccc2[nH+]1 ZINC001527357757 1060499299 /nfs/dbraw/zinc/49/92/99/1060499299.db2.gz YPAXOZGBENMTTN-UHFFFAOYSA-N 1 2 319.408 4.012 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3cnoc3C(C)C)c2)[nH+]c1C ZINC001527483608 1060538396 /nfs/dbraw/zinc/53/83/96/1060538396.db2.gz QJFNFYWWLCJLIE-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO Clc1ncc(C[NH+]2C[C@H]3CCC[C@@H]3C2)c(Cl)c1Cl ZINC001250017637 1060542223 /nfs/dbraw/zinc/54/22/23/1060542223.db2.gz GIDQVNJETQHFNP-RKDXNWHRSA-N 1 2 305.636 4.274 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+](Cc1ccc(F)cc1)C(C)(C)C ZINC001560700257 1060554170 /nfs/dbraw/zinc/55/41/70/1060554170.db2.gz PBQVWHSULBWBJU-UHFFFAOYSA-N 1 2 323.843 4.496 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+](Cc1ccc(F)cc1)C(C)(C)C ZINC001560700257 1060554182 /nfs/dbraw/zinc/55/41/82/1060554182.db2.gz PBQVWHSULBWBJU-UHFFFAOYSA-N 1 2 323.843 4.496 20 0 DIADLO COc1ccc([C@@H](C)[C@@H](C)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC001560703972 1060560303 /nfs/dbraw/zinc/56/03/03/1060560303.db2.gz UCHUGCCNTMQHIJ-JKSUJKDBSA-N 1 2 321.424 4.485 20 0 DIADLO Clc1cncc(CNc2cccc(-n3cc[nH+]c3)c2)c1Cl ZINC001560703847 1060560347 /nfs/dbraw/zinc/56/03/47/1060560347.db2.gz OOXPJYXECCNESM-UHFFFAOYSA-N 1 2 319.195 4.186 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)Cc1cn(C)nc1Cl ZINC001560714799 1060575482 /nfs/dbraw/zinc/57/54/82/1060575482.db2.gz BCQXLEMZIUXFRH-UHFFFAOYSA-N 1 2 317.820 4.014 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)Cc1cn(C)nc1Cl ZINC001560714799 1060575497 /nfs/dbraw/zinc/57/54/97/1060575497.db2.gz BCQXLEMZIUXFRH-UHFFFAOYSA-N 1 2 317.820 4.014 20 0 DIADLO CCCn1cncc1C[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC001560730534 1060596285 /nfs/dbraw/zinc/59/62/85/1060596285.db2.gz CCTCFYDZMKGDDW-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO CCCn1cncc1C[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC001560730534 1060596297 /nfs/dbraw/zinc/59/62/97/1060596297.db2.gz CCTCFYDZMKGDDW-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO C[C@@H](Cc1cc(F)ccc1C[NH+]1CCOCC1)c1ccccc1 ZINC001250111057 1060619084 /nfs/dbraw/zinc/61/90/84/1060619084.db2.gz QOZDBFRELIIBIW-INIZCTEOSA-N 1 2 313.416 4.004 20 0 DIADLO C/C(=C\c1ccccc1)C[N@@H+](C)Cc1ccc(O)c(F)c1F ZINC001560755739 1060623712 /nfs/dbraw/zinc/62/37/12/1060623712.db2.gz RKQGNRGMUTULKO-JLHYYAGUSA-N 1 2 303.352 4.206 20 0 DIADLO C/C(=C\c1ccccc1)C[N@H+](C)Cc1ccc(O)c(F)c1F ZINC001560755739 1060623719 /nfs/dbraw/zinc/62/37/19/1060623719.db2.gz RKQGNRGMUTULKO-JLHYYAGUSA-N 1 2 303.352 4.206 20 0 DIADLO COc1cc(Nc2cccc3cc[nH+]cc32)c(Cl)c(OC)n1 ZINC001250128536 1060631749 /nfs/dbraw/zinc/63/17/49/1060631749.db2.gz YCKSCDBXPZECCZ-UHFFFAOYSA-N 1 2 315.760 4.044 20 0 DIADLO Cc1nc(Cc2ccc(N(C)C3CCCCC3)[nH+]c2)cs1 ZINC001250197145 1060675692 /nfs/dbraw/zinc/67/56/92/1060675692.db2.gz UYAYKICSAXEUGB-UHFFFAOYSA-N 1 2 301.459 4.206 20 0 DIADLO Cc1nn(C)c(C[N@@H+]([C@@H](C)c2ccccc2)C2CC2)c1Cl ZINC001560823941 1060680923 /nfs/dbraw/zinc/68/09/23/1060680923.db2.gz ULKCHLWRBKNGEJ-ZDUSSCGKSA-N 1 2 303.837 4.108 20 0 DIADLO Cc1nn(C)c(C[N@H+]([C@@H](C)c2ccccc2)C2CC2)c1Cl ZINC001560823941 1060680935 /nfs/dbraw/zinc/68/09/35/1060680935.db2.gz ULKCHLWRBKNGEJ-ZDUSSCGKSA-N 1 2 303.837 4.108 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]([C@H](C)c1ccccc1)C1CC1 ZINC001560823358 1060681840 /nfs/dbraw/zinc/68/18/40/1060681840.db2.gz CXWXVWVMRPOLRC-CYBMUJFWSA-N 1 2 303.837 4.282 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC001560823358 1060681849 /nfs/dbraw/zinc/68/18/49/1060681849.db2.gz CXWXVWVMRPOLRC-CYBMUJFWSA-N 1 2 303.837 4.282 20 0 DIADLO Clc1ccc([C@H]2CC[N@@H+]2Cc2cnn(C3CCC3)c2)cc1 ZINC001560827121 1060686410 /nfs/dbraw/zinc/68/64/10/1060686410.db2.gz HJQWWYCILNQXDA-QGZVFWFLSA-N 1 2 301.821 4.209 20 0 DIADLO Clc1ccc([C@H]2CC[N@H+]2Cc2cnn(C3CCC3)c2)cc1 ZINC001560827121 1060686415 /nfs/dbraw/zinc/68/64/15/1060686415.db2.gz HJQWWYCILNQXDA-QGZVFWFLSA-N 1 2 301.821 4.209 20 0 DIADLO COc1ccc(Cl)cc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001250207681 1060689335 /nfs/dbraw/zinc/68/93/35/1060689335.db2.gz PTLYEOGZGBYNCF-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO C[C@]1(C[NH2+][C@@H](CCc2ccccc2)C(F)F)CC1(Cl)Cl ZINC001560839371 1060695349 /nfs/dbraw/zinc/69/53/49/1060695349.db2.gz QMTNCYPZKFEJAX-GXTWGEPZSA-N 1 2 322.226 4.426 20 0 DIADLO COc1cc(Nc2[nH+]cccc2N)ccc1Oc1ccccc1 ZINC001250215616 1060695707 /nfs/dbraw/zinc/69/57/07/1060695707.db2.gz PTCHHBBOKSQNRK-UHFFFAOYSA-N 1 2 307.353 4.208 20 0 DIADLO COc1cc(N(C)c2[nH+]cccc2N)ccc1Oc1ccccc1 ZINC001250215607 1060696366 /nfs/dbraw/zinc/69/63/66/1060696366.db2.gz PLPMYBZZDFIBMJ-UHFFFAOYSA-N 1 2 321.380 4.233 20 0 DIADLO COc1cc(Nc2cccc3[nH+]c(C)cn32)c(F)c(F)c1Cl ZINC001250260316 1060739144 /nfs/dbraw/zinc/73/91/44/1060739144.db2.gz QINUBWUHNWPWLN-UHFFFAOYSA-N 1 2 323.730 4.327 20 0 DIADLO CCC1(c2ccccc2)C[NH+](Cc2ncc(C(C)C)s2)C1 ZINC001560879757 1060741309 /nfs/dbraw/zinc/74/13/09/1060741309.db2.gz KGRFIYALVBQBLR-UHFFFAOYSA-N 1 2 300.471 4.430 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(F)c(OC(C)C)c(Cl)c1 ZINC001250279671 1060751164 /nfs/dbraw/zinc/75/11/64/1060751164.db2.gz ZAUZBDJVZCXBGU-UHFFFAOYSA-N 1 2 310.756 4.414 20 0 DIADLO C[C@@H](CCc1ccc(F)cc1)Nc1ccc(N2CCCC2)c[nH+]1 ZINC001560897735 1060759336 /nfs/dbraw/zinc/75/93/36/1060759336.db2.gz LRRLUCGLEGDEDE-HNNXBMFYSA-N 1 2 313.420 4.254 20 0 DIADLO OCc1ccc(Nc2cccc3cc[nH+]cc32)c(Cl)c1F ZINC001250297327 1060763352 /nfs/dbraw/zinc/76/33/52/1060763352.db2.gz AERFVWVOVFNOIY-UHFFFAOYSA-N 1 2 302.736 4.263 20 0 DIADLO CCNc1ccccc1C[N@@H+]1CCc2sc(Cl)cc2C1 ZINC001560903728 1060767548 /nfs/dbraw/zinc/76/75/48/1060767548.db2.gz BYSRLLBRHGTKPO-UHFFFAOYSA-N 1 2 306.862 4.392 20 0 DIADLO CCNc1ccccc1C[N@H+]1CCc2sc(Cl)cc2C1 ZINC001560903728 1060767561 /nfs/dbraw/zinc/76/75/61/1060767561.db2.gz BYSRLLBRHGTKPO-UHFFFAOYSA-N 1 2 306.862 4.392 20 0 DIADLO CCOc1nccc(C[N@H+](C)Cc2ccccc2C)c1Cl ZINC001250379104 1060793151 /nfs/dbraw/zinc/79/31/51/1060793151.db2.gz WNAMQTNUDBOHLH-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCOc1nccc(C[N@@H+](C)Cc2ccccc2C)c1Cl ZINC001250379104 1060793162 /nfs/dbraw/zinc/79/31/62/1060793162.db2.gz WNAMQTNUDBOHLH-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO COc1ccc(C[N@@H+]2Cc3ccc(O)cc3C2)cc1C(C)(C)C ZINC001560938590 1060800989 /nfs/dbraw/zinc/80/09/89/1060800989.db2.gz IZZXUYQREAXJML-UHFFFAOYSA-N 1 2 311.425 4.214 20 0 DIADLO COc1ccc(C[N@H+]2Cc3ccc(O)cc3C2)cc1C(C)(C)C ZINC001560938590 1060801006 /nfs/dbraw/zinc/80/10/06/1060801006.db2.gz IZZXUYQREAXJML-UHFFFAOYSA-N 1 2 311.425 4.214 20 0 DIADLO CC1(C)CC[NH+](Cc2cncc(Br)c2Cl)CC1 ZINC001250465466 1060824141 /nfs/dbraw/zinc/82/41/41/1060824141.db2.gz VKTCBHCSJCHDCZ-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO Fc1cc2[nH]c(-c3ccc(Cl)cc3)nc2cc1-n1cc[nH+]c1 ZINC001250468937 1060827133 /nfs/dbraw/zinc/82/71/33/1060827133.db2.gz TZHKYOKEEYDLDP-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO CCSCc1ccc[nH+]c1N[C@H]1C[C@@H](OC(C)C)C1(C)C ZINC001560982089 1060844780 /nfs/dbraw/zinc/84/47/80/1060844780.db2.gz POKSMSNRRDPLBB-LSDHHAIUSA-N 1 2 308.491 4.339 20 0 DIADLO CCSCc1ccc[nH+]c1NC[C@H](Cc1ccccc1)OC ZINC001560982259 1060847584 /nfs/dbraw/zinc/84/75/84/1060847584.db2.gz RUBGUYAFEJXXIT-KRWDZBQOSA-N 1 2 316.470 4.004 20 0 DIADLO COC[C@@H](CC(C)(C)C)[NH2+]CC(F)(F)c1cc(F)cc(F)c1 ZINC001560985229 1060848854 /nfs/dbraw/zinc/84/88/54/1060848854.db2.gz UUBLXQGXDHPQOK-CQSZACIVSA-N 1 2 321.358 4.097 20 0 DIADLO Oc1ccc(Cl)c(C[NH2+]Cc2ccnc(Cl)c2Cl)c1 ZINC001560987821 1060852194 /nfs/dbraw/zinc/85/21/94/1060852194.db2.gz YUHLSPJPSUVZTG-UHFFFAOYSA-N 1 2 317.603 4.037 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccc3nc(C)cc(C)c3c2)c1C ZINC001561007720 1060865760 /nfs/dbraw/zinc/86/57/60/1060865760.db2.gz DRJIOPJEGSKPRF-UHFFFAOYSA-N 1 2 321.424 4.484 20 0 DIADLO COCC1(C[NH2+][C@H](c2cccc(Cl)c2)C(F)F)CCC1 ZINC001561007050 1060865952 /nfs/dbraw/zinc/86/59/52/1060865952.db2.gz JFNWTZLPMXFVEW-CYBMUJFWSA-N 1 2 303.780 4.053 20 0 DIADLO Clc1ccc([C@H]2C[C@H]2c2[nH]c3cc4c(cc3[nH+]2)OCO4)cc1 ZINC001250536892 1060880357 /nfs/dbraw/zinc/88/03/57/1060880357.db2.gz DUGOCFXTXJKKOT-VXGBXAGGSA-N 1 2 312.756 4.216 20 0 DIADLO CCC[C@@H](CNc1[nH+]c2ccccc2n1CCC(C)C)OC ZINC001561058912 1060907153 /nfs/dbraw/zinc/90/71/53/1060907153.db2.gz HVYWNUNMCKYZMG-HNNXBMFYSA-N 1 2 303.450 4.309 20 0 DIADLO Cc1cccc2c1[nH+]c(CCCCOCc1ccccc1)n2C ZINC001250583468 1060917228 /nfs/dbraw/zinc/91/72/28/1060917228.db2.gz HZXJXVJKYARGRO-UHFFFAOYSA-N 1 2 308.425 4.421 20 0 DIADLO COc1ccccc1CCc1[nH+]c2cccc(C)c2n1C1CC1 ZINC001250583300 1060918146 /nfs/dbraw/zinc/91/81/46/1060918146.db2.gz CPUYNAFJILLJJE-UHFFFAOYSA-N 1 2 306.409 4.473 20 0 DIADLO CCOc1ccc2[nH]c(C3CCN(c4ccccc4)CC3)[nH+]c2c1 ZINC001250583802 1060920305 /nfs/dbraw/zinc/92/03/05/1060920305.db2.gz BSOWVBBASNPVQY-UHFFFAOYSA-N 1 2 321.424 4.346 20 0 DIADLO Cc1cc(F)cc2[nH+]c(C3CCN(c4ccccc4)CC3)[nH]c21 ZINC001250583757 1060920436 /nfs/dbraw/zinc/92/04/36/1060920436.db2.gz BIDQFHGCRDIVLW-UHFFFAOYSA-N 1 2 309.388 4.394 20 0 DIADLO COC(=O)CCCCCCCCc1[nH]c2ccc(OC)cc2[nH+]1 ZINC001250596251 1060928670 /nfs/dbraw/zinc/92/86/70/1060928670.db2.gz FSCXDGPSJJMOID-UHFFFAOYSA-N 1 2 318.417 4.018 20 0 DIADLO CCOc1ccc2[nH+]c(CCCOCc3ccccc3)n(C)c2c1 ZINC001250605829 1060935601 /nfs/dbraw/zinc/93/56/01/1060935601.db2.gz XGVYAGSFBMCPLL-UHFFFAOYSA-N 1 2 324.424 4.121 20 0 DIADLO CCOc1cc2[nH]c(C3C[C@H](C)O[C@@H](C)C3)[nH+]c2cc1OCC ZINC001250612471 1060941174 /nfs/dbraw/zinc/94/11/74/1060941174.db2.gz PPIQEJNDKYMHEF-RYUDHWBXSA-N 1 2 318.417 4.031 20 0 DIADLO CCOC(=O)CCCCCc1[nH+]c2cccc(C)c2n1C1CC1 ZINC001250611546 1060941871 /nfs/dbraw/zinc/94/18/71/1060941871.db2.gz OMSHBIDOBKZGGX-UHFFFAOYSA-N 1 2 314.429 4.346 20 0 DIADLO Cc1ccc(-c2cccc(Cl)c2C[NH+]2CCOCC2)cc1F ZINC001250630287 1060966958 /nfs/dbraw/zinc/96/69/58/1060966958.db2.gz JRACFGOJXHPSNM-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO Oc1cc(C[N@@H+]2CC[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 ZINC001473205859 1060967709 /nfs/dbraw/zinc/96/77/09/1060967709.db2.gz BZUCNCYXONWUQE-MRXNPFEDSA-N 1 2 307.315 4.358 20 0 DIADLO Oc1cc(C[N@H+]2CC[C@@H]2c2ccccc2)cc(C(F)(F)F)c1 ZINC001473205859 1060967725 /nfs/dbraw/zinc/96/77/25/1060967725.db2.gz BZUCNCYXONWUQE-MRXNPFEDSA-N 1 2 307.315 4.358 20 0 DIADLO CC[C@@H](CC(F)F)C[N@@H+]1CCCC[C@@H]1c1noc(C(C)C)n1 ZINC001473207081 1060972972 /nfs/dbraw/zinc/97/29/72/1060972972.db2.gz XFOZHEKUIFCCKY-QWHCGFSZSA-N 1 2 315.408 4.401 20 0 DIADLO CC[C@@H](CC(F)F)C[N@H+]1CCCC[C@@H]1c1noc(C(C)C)n1 ZINC001473207081 1060972979 /nfs/dbraw/zinc/97/29/79/1060972979.db2.gz XFOZHEKUIFCCKY-QWHCGFSZSA-N 1 2 315.408 4.401 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ncccc2Br)[C@@H]1c1ccccc1 ZINC001473208069 1060974209 /nfs/dbraw/zinc/97/42/09/1060974209.db2.gz HPPKRZVEPWGBOU-WBMJQRKESA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ncccc2Br)[C@@H]1c1ccccc1 ZINC001473208069 1060974232 /nfs/dbraw/zinc/97/42/32/1060974232.db2.gz HPPKRZVEPWGBOU-WBMJQRKESA-N 1 2 317.230 4.037 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3cccc(-c4ccncc4)c3)[nH+]c2c1 ZINC001250650510 1060992235 /nfs/dbraw/zinc/99/22/35/1060992235.db2.gz DCFQOXNMXMADFW-UHFFFAOYSA-N 1 2 314.392 4.358 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1cncc(Cl)c1Cl ZINC001462218546 1061034769 /nfs/dbraw/zinc/03/47/69/1061034769.db2.gz UNXQHLJVOOPOPG-UHFFFAOYSA-N 1 2 314.216 4.018 20 0 DIADLO CC(C)CO[C@@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001473274884 1061050016 /nfs/dbraw/zinc/05/00/16/1061050016.db2.gz LUCJKEWKIDOLSM-CYBMUJFWSA-N 1 2 320.235 4.379 20 0 DIADLO CC(C)CO[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001473274884 1061050026 /nfs/dbraw/zinc/05/00/26/1061050026.db2.gz LUCJKEWKIDOLSM-CYBMUJFWSA-N 1 2 320.235 4.379 20 0 DIADLO Fc1ccc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3)nc2c1Cl ZINC001250771779 1061062078 /nfs/dbraw/zinc/06/20/78/1061062078.db2.gz DMEBYUWKSYFTOJ-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO Cc1cc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3)nc2c(Cl)c1 ZINC001250772590 1061062108 /nfs/dbraw/zinc/06/21/08/1061062108.db2.gz ZMOXUFVKMODUIB-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(C3CC3)cc2)C[C@@H](C(F)(F)F)O1 ZINC001462269840 1061064619 /nfs/dbraw/zinc/06/46/19/1061064619.db2.gz IKKKNIAJWBXUSN-HNNXBMFYSA-N 1 2 313.363 4.106 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(C3CC3)cc2)C[C@@H](C(F)(F)F)O1 ZINC001462269840 1061064636 /nfs/dbraw/zinc/06/46/36/1061064636.db2.gz IKKKNIAJWBXUSN-HNNXBMFYSA-N 1 2 313.363 4.106 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccccc2[nH]1)c1cc(Cl)ccc1F ZINC001473309408 1061074739 /nfs/dbraw/zinc/07/47/39/1061074739.db2.gz KZBARLMPLKQRLZ-SNVBAGLBSA-N 1 2 303.768 4.206 20 0 DIADLO Fc1cc2[nH]c(-c3ccccc3C3CC3)nc2cc1-n1cc[nH+]c1 ZINC001250819594 1061082980 /nfs/dbraw/zinc/08/29/80/1061082980.db2.gz UBXSPJXLXOXDCI-UHFFFAOYSA-N 1 2 318.355 4.432 20 0 DIADLO CCn1c[nH+]cc1CN1CC[C@@H](C)Sc2ccc(Cl)cc21 ZINC001462306790 1061093317 /nfs/dbraw/zinc/09/33/17/1061093317.db2.gz VJFXPSIBJWGOPW-GFCCVEGCSA-N 1 2 321.877 4.447 20 0 DIADLO C[C@H]([NH2+]Cc1nsc2ccccc12)c1ccc(F)cc1F ZINC001473334500 1061095073 /nfs/dbraw/zinc/09/50/73/1061095073.db2.gz DWSNIXIZZJLELY-JTQLQIEISA-N 1 2 304.365 4.425 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccccc3-c3cccnc3)[nH+]c2c1 ZINC001250861542 1061098891 /nfs/dbraw/zinc/09/88/91/1061098891.db2.gz RPARWZFHODQFMQ-UHFFFAOYSA-N 1 2 314.392 4.358 20 0 DIADLO FC(F)Oc1ccccc1C[N@@H+]1CCc2ccc(Cl)cc2C1 ZINC001473342184 1061099359 /nfs/dbraw/zinc/09/93/59/1061099359.db2.gz MRJNWLSHFIPHMD-UHFFFAOYSA-N 1 2 323.770 4.500 20 0 DIADLO FC(F)Oc1ccccc1C[N@H+]1CCc2ccc(Cl)cc2C1 ZINC001473342184 1061099374 /nfs/dbraw/zinc/09/93/74/1061099374.db2.gz MRJNWLSHFIPHMD-UHFFFAOYSA-N 1 2 323.770 4.500 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@@H+]1Cc1c(F)ccc(O)c1F ZINC001462340796 1061116829 /nfs/dbraw/zinc/11/68/29/1061116829.db2.gz QWHKYDHNJXEIFV-INIZCTEOSA-N 1 2 321.342 4.455 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@H+]1Cc1c(F)ccc(O)c1F ZINC001462340796 1061116839 /nfs/dbraw/zinc/11/68/39/1061116839.db2.gz QWHKYDHNJXEIFV-INIZCTEOSA-N 1 2 321.342 4.455 20 0 DIADLO Fc1cc2[nH]c(-c3c[nH]c4cc[nH+]cc34)nc2cc1C(F)(F)F ZINC001250908646 1061121445 /nfs/dbraw/zinc/12/14/45/1061121445.db2.gz XUBUREAMMCUKKI-UHFFFAOYSA-N 1 2 320.249 4.264 20 0 DIADLO C[C@H]1CC(C)(C)C[N@@H+]1Cc1c(F)cc(Br)cc1F ZINC001462351335 1061123492 /nfs/dbraw/zinc/12/34/92/1061123492.db2.gz SQKAVBQSTJCQKV-VIFPVBQESA-N 1 2 318.205 4.348 20 0 DIADLO C[C@H]1CC(C)(C)C[N@H+]1Cc1c(F)cc(Br)cc1F ZINC001462351335 1061123497 /nfs/dbraw/zinc/12/34/97/1061123497.db2.gz SQKAVBQSTJCQKV-VIFPVBQESA-N 1 2 318.205 4.348 20 0 DIADLO CC[N@H+](Cc1nc2ccc(OC)cc2s1)Cc1occc1C ZINC001462357360 1061126367 /nfs/dbraw/zinc/12/63/67/1061126367.db2.gz VBMBKQHXCZEHAR-UHFFFAOYSA-N 1 2 316.426 4.228 20 0 DIADLO CC[N@@H+](Cc1nc2ccc(OC)cc2s1)Cc1occc1C ZINC001462357360 1061126373 /nfs/dbraw/zinc/12/63/73/1061126373.db2.gz VBMBKQHXCZEHAR-UHFFFAOYSA-N 1 2 316.426 4.228 20 0 DIADLO Fc1cc2nc(-c3ccn4cc[nH+]c4c3)[nH]c2cc1C(F)(F)F ZINC001250927593 1061129903 /nfs/dbraw/zinc/12/99/03/1061129903.db2.gz DQDMLYCLGYQBDE-UHFFFAOYSA-N 1 2 320.249 4.036 20 0 DIADLO Cc1cc(Cl)cc(CNc2ccc(N3CCCC3)c[nH+]2)c1 ZINC001462366083 1061131791 /nfs/dbraw/zinc/13/17/91/1061131791.db2.gz VSIZOXQSTIGDLT-UHFFFAOYSA-N 1 2 301.821 4.256 20 0 DIADLO Fc1ccc2c(c1)nc(-c1cccc(-n3cc[nH+]c3)c1)n2C1CC1 ZINC001250938667 1061136112 /nfs/dbraw/zinc/13/61/12/1061136112.db2.gz AROKLUCLLGTXNF-UHFFFAOYSA-N 1 2 318.355 4.363 20 0 DIADLO Cc1ccc(C[NH+]2CC(C)(CC(F)F)C2)c(Br)c1 ZINC001462376753 1061136724 /nfs/dbraw/zinc/13/67/24/1061136724.db2.gz ZTHUWEMPXYVVSO-UHFFFAOYSA-N 1 2 318.205 4.235 20 0 DIADLO Cc1ccc2[nH]c(-c3cccc(-n4cc[nH+]c4)c3)nc2c1Cl ZINC001250940487 1061138632 /nfs/dbraw/zinc/13/86/32/1061138632.db2.gz OTQRCNBWYGRGQH-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[NH+]1CCC(C)(C(C)C)CC1 ZINC001473402725 1061139597 /nfs/dbraw/zinc/13/95/97/1061139597.db2.gz UVAQCUVXVBRKNE-MRXNPFEDSA-N 1 2 323.864 4.312 20 0 DIADLO FC(F)(F)c1nc(C[N@H+]2CC[C@@H](C3CCCC3)C2)cs1 ZINC001462385336 1061141117 /nfs/dbraw/zinc/14/11/17/1061141117.db2.gz MZNOARUVOAWNCE-LLVKDONJSA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1nc(C[N@@H+]2CC[C@@H](C3CCCC3)C2)cs1 ZINC001462385336 1061141110 /nfs/dbraw/zinc/14/11/10/1061141110.db2.gz MZNOARUVOAWNCE-LLVKDONJSA-N 1 2 304.381 4.174 20 0 DIADLO Cc1cc(CN2CCOc3c2cccc3C(F)(F)F)cc(C)[nH+]1 ZINC001462395425 1061148562 /nfs/dbraw/zinc/14/85/62/1061148562.db2.gz MRJDDYSEMNZMJS-UHFFFAOYSA-N 1 2 322.330 4.116 20 0 DIADLO CC[C@H]([NH2+][C@H](c1ccc(C(C)(C)C)cc1)C(C)C)C(=O)OC ZINC001473419943 1061151612 /nfs/dbraw/zinc/15/16/12/1061151612.db2.gz WFXOCRSHNJPTJC-IRXDYDNUSA-N 1 2 305.462 4.222 20 0 DIADLO CC(C)(C)CNC(=O)C[N@@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC001473430377 1061156176 /nfs/dbraw/zinc/15/61/76/1061156176.db2.gz BYKVGJYXCAPXFG-INIZCTEOSA-N 1 2 322.880 4.029 20 0 DIADLO CC(C)(C)CNC(=O)C[N@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC001473430377 1061156186 /nfs/dbraw/zinc/15/61/86/1061156186.db2.gz BYKVGJYXCAPXFG-INIZCTEOSA-N 1 2 322.880 4.029 20 0 DIADLO CC[C@H]1Cc2c(Br)cccc2C[N@@H+]1C/C=C\Cl ZINC001473427347 1061156755 /nfs/dbraw/zinc/15/67/55/1061156755.db2.gz YFRPYIHSMJFWCE-KMSCOEIWSA-N 1 2 314.654 4.338 20 0 DIADLO CC[C@H]1Cc2c(Br)cccc2C[N@H+]1C/C=C\Cl ZINC001473427347 1061156762 /nfs/dbraw/zinc/15/67/62/1061156762.db2.gz YFRPYIHSMJFWCE-KMSCOEIWSA-N 1 2 314.654 4.338 20 0 DIADLO CC(C)(C)[C@H]1C[N@H+](CCc2c(Cl)cccc2Cl)CCO1 ZINC001473439577 1061160049 /nfs/dbraw/zinc/16/00/49/1061160049.db2.gz IKEVUVAUCLIYIO-OAHLLOKOSA-N 1 2 316.272 4.283 20 0 DIADLO CC(C)(C)[C@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)CCO1 ZINC001473439577 1061160057 /nfs/dbraw/zinc/16/00/57/1061160057.db2.gz IKEVUVAUCLIYIO-OAHLLOKOSA-N 1 2 316.272 4.283 20 0 DIADLO CCn1c2ccc(C(F)(F)F)cc2nc1-c1ccc(C)[nH+]c1N ZINC001250982225 1061160729 /nfs/dbraw/zinc/16/07/29/1061160729.db2.gz SLABVHMOQRIGQG-UHFFFAOYSA-N 1 2 320.318 4.028 20 0 DIADLO Cc1ccc(-c2nc3cc(-c4ccccc4)ccc3[nH]2)c(N)[nH+]1 ZINC001250982272 1061160957 /nfs/dbraw/zinc/16/09/57/1061160957.db2.gz VNWQGUJOAHFUIA-UHFFFAOYSA-N 1 2 300.365 4.183 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[NH+]1CCC2(CCC2)CC1 ZINC001473453812 1061167579 /nfs/dbraw/zinc/16/75/79/1061167579.db2.gz KLQMYHGKMDMGEL-INIZCTEOSA-N 1 2 321.848 4.210 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@H+]1C[C@H](C)O[C@](C)(C(F)F)C1 ZINC001462449761 1061181088 /nfs/dbraw/zinc/18/10/88/1061181088.db2.gz GULGRQMEDZHPJT-LRDDRELGSA-N 1 2 317.807 4.201 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@@H+]1C[C@H](C)O[C@](C)(C(F)F)C1 ZINC001462449761 1061181095 /nfs/dbraw/zinc/18/10/95/1061181095.db2.gz GULGRQMEDZHPJT-LRDDRELGSA-N 1 2 317.807 4.201 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC001462449768 1061181239 /nfs/dbraw/zinc/18/12/39/1061181239.db2.gz GULGRQMEDZHPJT-WBMJQRKESA-N 1 2 317.807 4.201 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC001462449768 1061181246 /nfs/dbraw/zinc/18/12/46/1061181246.db2.gz GULGRQMEDZHPJT-WBMJQRKESA-N 1 2 317.807 4.201 20 0 DIADLO CC1(C)CCC[C@H]1CC[NH2+][C@H](c1ncn[nH]1)C1CCCCC1 ZINC001462454662 1061184390 /nfs/dbraw/zinc/18/43/90/1061184390.db2.gz HQBMCGFSXCGNGS-HOTGVXAUSA-N 1 2 304.482 4.232 20 0 DIADLO Cc1cc(Br)c(C[N@H+]2C[C@@H](C)[C@@H]2C)cc1Cl ZINC001473511561 1061203389 /nfs/dbraw/zinc/20/33/89/1061203389.db2.gz YCWGEZKWPAHPRV-ZJUUUORDSA-N 1 2 302.643 4.251 20 0 DIADLO Cc1cc(Br)c(C[N@@H+]2C[C@@H](C)[C@@H]2C)cc1Cl ZINC001473511561 1061203407 /nfs/dbraw/zinc/20/34/07/1061203407.db2.gz YCWGEZKWPAHPRV-ZJUUUORDSA-N 1 2 302.643 4.251 20 0 DIADLO FC(F)(F)c1cccc2c1CC[N@H+](Cc1cccn1C1CC1)C2 ZINC001462484387 1061204005 /nfs/dbraw/zinc/20/40/05/1061204005.db2.gz AWZYRSIAVXLDSI-UHFFFAOYSA-N 1 2 320.358 4.400 20 0 DIADLO FC(F)(F)c1cccc2c1CC[N@@H+](Cc1cccn1C1CC1)C2 ZINC001462484387 1061204022 /nfs/dbraw/zinc/20/40/22/1061204022.db2.gz AWZYRSIAVXLDSI-UHFFFAOYSA-N 1 2 320.358 4.400 20 0 DIADLO Cc1cc(Br)c(C[N@H+]2C[C@@H](C)[C@H]2C)cc1Cl ZINC001473511553 1061205981 /nfs/dbraw/zinc/20/59/81/1061205981.db2.gz YCWGEZKWPAHPRV-NXEZZACHSA-N 1 2 302.643 4.251 20 0 DIADLO Cc1cc(Br)c(C[N@@H+]2C[C@@H](C)[C@H]2C)cc1Cl ZINC001473511553 1061205997 /nfs/dbraw/zinc/20/59/97/1061205997.db2.gz YCWGEZKWPAHPRV-NXEZZACHSA-N 1 2 302.643 4.251 20 0 DIADLO CCCCn1c(-c2ccc(N)[nH+]c2C)nc2ccc(F)c(F)c21 ZINC001251091645 1061232551 /nfs/dbraw/zinc/23/25/51/1061232551.db2.gz KTKHQLGIDGPXGI-UHFFFAOYSA-N 1 2 316.355 4.067 20 0 DIADLO CCSCc1ccc[nH+]c1NC1CCC2(CSC2)CC1 ZINC001462529060 1061236777 /nfs/dbraw/zinc/23/67/77/1061236777.db2.gz PTSBAHWUKNOUQK-UHFFFAOYSA-N 1 2 308.516 4.422 20 0 DIADLO C[N@H+](Cc1ccc2cc[nH]c2c1)Cc1cccc(O)c1Cl ZINC001462532021 1061241074 /nfs/dbraw/zinc/24/10/74/1061241074.db2.gz WFAYYUPLHNPTGC-UHFFFAOYSA-N 1 2 300.789 4.159 20 0 DIADLO C[N@@H+](Cc1ccc2cc[nH]c2c1)Cc1cccc(O)c1Cl ZINC001462532021 1061241093 /nfs/dbraw/zinc/24/10/93/1061241093.db2.gz WFAYYUPLHNPTGC-UHFFFAOYSA-N 1 2 300.789 4.159 20 0 DIADLO Cc1cc(NCCc2cccc(OC(F)(F)F)c2)c[nH+]c1C ZINC001462539918 1061247891 /nfs/dbraw/zinc/24/78/91/1061247891.db2.gz VJGGASUUHMJVEF-UHFFFAOYSA-N 1 2 310.319 4.252 20 0 DIADLO CC[N@H+](CCOc1ccccc1C)Cc1csc(Cl)n1 ZINC001473569475 1061257571 /nfs/dbraw/zinc/25/75/71/1061257571.db2.gz HHBGJGFVUOSVIY-UHFFFAOYSA-N 1 2 310.850 4.006 20 0 DIADLO CC[N@@H+](CCOc1ccccc1C)Cc1csc(Cl)n1 ZINC001473569475 1061257591 /nfs/dbraw/zinc/25/75/91/1061257591.db2.gz HHBGJGFVUOSVIY-UHFFFAOYSA-N 1 2 310.850 4.006 20 0 DIADLO CC(C)(C)OC(=O)CC[C@@H]1CCCC[N@@H+]1C/C(Cl)=C/Cl ZINC001473575224 1061261083 /nfs/dbraw/zinc/26/10/83/1061261083.db2.gz OFRFAWJBVZVOJN-UKVQZPPCSA-N 1 2 322.276 4.282 20 0 DIADLO CC(C)(C)OC(=O)CC[C@@H]1CCCC[N@H+]1C/C(Cl)=C/Cl ZINC001473575224 1061261101 /nfs/dbraw/zinc/26/11/01/1061261101.db2.gz OFRFAWJBVZVOJN-UKVQZPPCSA-N 1 2 322.276 4.282 20 0 DIADLO CCCc1nc(C[N@@H+](Cc2c(C)cccc2C)CC(C)C)no1 ZINC001473578341 1061267722 /nfs/dbraw/zinc/26/77/22/1061267722.db2.gz VOYPXTZIGOBJER-UHFFFAOYSA-N 1 2 315.461 4.297 20 0 DIADLO CCCc1nc(C[N@H+](Cc2c(C)cccc2C)CC(C)C)no1 ZINC001473578341 1061267741 /nfs/dbraw/zinc/26/77/41/1061267741.db2.gz VOYPXTZIGOBJER-UHFFFAOYSA-N 1 2 315.461 4.297 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccc(F)c(F)c3Cl)[nH+]c2c1 ZINC001251226074 1061275610 /nfs/dbraw/zinc/27/56/10/1061275610.db2.gz GOYUCSZCDRQZAH-UHFFFAOYSA-N 1 2 307.731 4.228 20 0 DIADLO C[C@@H](CC1CCOCC1)[NH2+][C@@H](c1cccc(Cl)c1)C(F)F ZINC001462589234 1061281107 /nfs/dbraw/zinc/28/11/07/1061281107.db2.gz VILBHBFYHCETMR-NHYWBVRUSA-N 1 2 317.807 4.441 20 0 DIADLO C[C@H](CC1CCOCC1)[NH2+][C@H](c1cccc(Cl)c1)C(F)F ZINC001462589233 1061281229 /nfs/dbraw/zinc/28/12/29/1061281229.db2.gz VILBHBFYHCETMR-IAQYHMDHSA-N 1 2 317.807 4.441 20 0 DIADLO COC(=O)[C@H]([NH2+][C@@H]1CCC[C@@H](C)C1)c1cccc2ccccc21 ZINC001462588286 1061281945 /nfs/dbraw/zinc/28/19/45/1061281945.db2.gz STNHXKVWWKQYJW-IDHHARJASA-N 1 2 311.425 4.222 20 0 DIADLO Clc1cc2[nH]c(-c3cccc4[nH+]ccn43)nc2c(Cl)c1 ZINC001251326433 1061316453 /nfs/dbraw/zinc/31/64/53/1061316453.db2.gz JICXVWWOBWKTDP-UHFFFAOYSA-N 1 2 303.152 4.184 20 0 DIADLO CCc1cc(OC)ccc1C[N@@H+]1CCc2cc(F)cc(F)c2C1 ZINC001462676056 1061335274 /nfs/dbraw/zinc/33/52/74/1061335274.db2.gz VLXZSLHNOHYXFF-UHFFFAOYSA-N 1 2 317.379 4.094 20 0 DIADLO CCc1cc(OC)ccc1C[N@H+]1CCc2cc(F)cc(F)c2C1 ZINC001462676056 1061335286 /nfs/dbraw/zinc/33/52/86/1061335286.db2.gz VLXZSLHNOHYXFF-UHFFFAOYSA-N 1 2 317.379 4.094 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)CC1CCC(C(C)(C)C)CC1 ZINC001462729341 1061345802 /nfs/dbraw/zinc/34/58/02/1061345802.db2.gz DWNLMTISMVYXSE-UHFFFAOYSA-N 1 2 302.462 4.301 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@H+](Cc2cncc(Cl)c2)C1 ZINC001473730236 1061377222 /nfs/dbraw/zinc/37/72/22/1061377222.db2.gz ONHCZRGUSOQZCN-QGZVFWFLSA-N 1 2 304.796 4.196 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@@H+](Cc2cncc(Cl)c2)C1 ZINC001473730236 1061377239 /nfs/dbraw/zinc/37/72/39/1061377239.db2.gz ONHCZRGUSOQZCN-QGZVFWFLSA-N 1 2 304.796 4.196 20 0 DIADLO Cc1cccc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3Cl)nc21 ZINC001251507288 1061384802 /nfs/dbraw/zinc/38/48/02/1061384802.db2.gz CERTYLYRMDGNHF-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO COc1cccc2[nH]c(-c3ccc(-n4cc[nH+]c4)c(Cl)c3)nc21 ZINC001251507441 1061385214 /nfs/dbraw/zinc/38/52/14/1061385214.db2.gz HBQUCOFCXXTGNH-UHFFFAOYSA-N 1 2 324.771 4.078 20 0 DIADLO COc1cc(-c2[nH]c3ccc(N(C)C)cc3[nH+]2)ccc1C(F)F ZINC001251565459 1061404591 /nfs/dbraw/zinc/40/45/91/1061404591.db2.gz AJDFFSXYLSEKKW-UHFFFAOYSA-N 1 2 317.339 4.242 20 0 DIADLO Clc1ccc(C[N@@H+]2CCc3nc[nH]c3C23CCCCC3)s1 ZINC001473794144 1061411028 /nfs/dbraw/zinc/41/10/28/1061411028.db2.gz IKKOHYYKUSXFBE-UHFFFAOYSA-N 1 2 321.877 4.342 20 0 DIADLO Clc1ccc(C[N@H+]2CCc3nc[nH]c3C23CCCCC3)s1 ZINC001473794144 1061411049 /nfs/dbraw/zinc/41/10/49/1061411049.db2.gz IKKOHYYKUSXFBE-UHFFFAOYSA-N 1 2 321.877 4.342 20 0 DIADLO Fc1cccc(C[N@H+](Cc2noc3c2CCCC3)C2CCC2)c1 ZINC001473812155 1061417001 /nfs/dbraw/zinc/41/70/01/1061417001.db2.gz NVURXUMZJZDPAH-UHFFFAOYSA-N 1 2 314.404 4.247 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2noc3c2CCCC3)C2CCC2)c1 ZINC001473812155 1061417014 /nfs/dbraw/zinc/41/70/14/1061417014.db2.gz NVURXUMZJZDPAH-UHFFFAOYSA-N 1 2 314.404 4.247 20 0 DIADLO CCc1ccc2c(c1)C[N@H+](Cc1ccn(C(CC)CC)n1)CC2 ZINC001473904926 1061456327 /nfs/dbraw/zinc/45/63/27/1061456327.db2.gz MUOQEYAFVSBREP-UHFFFAOYSA-N 1 2 311.473 4.365 20 0 DIADLO CCc1ccc2c(c1)C[N@@H+](Cc1ccn(C(CC)CC)n1)CC2 ZINC001473904926 1061456333 /nfs/dbraw/zinc/45/63/33/1061456333.db2.gz MUOQEYAFVSBREP-UHFFFAOYSA-N 1 2 311.473 4.365 20 0 DIADLO Cc1cc(C[NH2+]Cc2coc(-c3cccs3)n2)cnc1Cl ZINC001473960916 1061502673 /nfs/dbraw/zinc/50/26/73/1061502673.db2.gz MEESCKNVYZLIML-UHFFFAOYSA-N 1 2 319.817 4.050 20 0 DIADLO CCN(C)c1ccccc1C[NH2+]Cc1csc(C(C)C)n1 ZINC001473982271 1061527339 /nfs/dbraw/zinc/52/73/39/1061527339.db2.gz FPBAYVUMADEDNL-UHFFFAOYSA-N 1 2 303.475 4.012 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc(OCC4CC4)cc3)n2c1 ZINC001474000430 1061543379 /nfs/dbraw/zinc/54/33/79/1061543379.db2.gz DGATVYKUPURTDF-UHFFFAOYSA-N 1 2 307.397 4.044 20 0 DIADLO CCCCC[C@@H](C)NC(=O)[C@H]1CC[C@@H](Nc2cccc[nH+]2)CC1 ZINC001464022619 1061545106 /nfs/dbraw/zinc/54/51/06/1061545106.db2.gz BPQJANNGMJQASD-ZACQAIPSSA-N 1 2 317.477 4.137 20 0 DIADLO Cc1cc(CNC(=O)N2CC[C@@H](C(C)(C)C)C[C@@H]2C)cc(C)[nH+]1 ZINC001252029592 1061558715 /nfs/dbraw/zinc/55/87/15/1061558715.db2.gz ZPFFWXITHJIMID-DOTOQJQBSA-N 1 2 317.477 4.055 20 0 DIADLO CCCc1nsc(Nc2ccc([N@H+](CC)C(C)C)cc2)n1 ZINC001458089605 1061565611 /nfs/dbraw/zinc/56/56/11/1061565611.db2.gz RLDUMFHZJCNHOB-UHFFFAOYSA-N 1 2 304.463 4.469 20 0 DIADLO CCCc1nsc(Nc2ccc([N@@H+](CC)C(C)C)cc2)n1 ZINC001458089605 1061565622 /nfs/dbraw/zinc/56/56/22/1061565622.db2.gz RLDUMFHZJCNHOB-UHFFFAOYSA-N 1 2 304.463 4.469 20 0 DIADLO C[C@H]([NH2+]Cc1cccc2c1OCC2)c1c(F)cccc1Cl ZINC001474038082 1061581996 /nfs/dbraw/zinc/58/19/96/1061581996.db2.gz QXSRTNCMGIOVNY-NSHDSACASA-N 1 2 305.780 4.265 20 0 DIADLO Cc1cc(CNc2ccn(CCC(C)C)n2)c2c([nH+]1)CCCC2 ZINC001474045856 1061591854 /nfs/dbraw/zinc/59/18/54/1061591854.db2.gz SMTZKVVTTKPURR-UHFFFAOYSA-N 1 2 312.461 4.124 20 0 DIADLO Cc1ccc(OC[C@H](C)Nc2cc(C)[nH+]c(C3CCC3)n2)cc1 ZINC001458135193 1061592720 /nfs/dbraw/zinc/59/27/20/1061592720.db2.gz IJJIVUJDEDCEPS-HNNXBMFYSA-N 1 2 311.429 4.240 20 0 DIADLO Cc1cc(N[C@H]2CCCOc3ccccc32)nc(C2CCC2)[nH+]1 ZINC001458148237 1061599206 /nfs/dbraw/zinc/59/92/06/1061599206.db2.gz QBJUXYRURPVLIC-INIZCTEOSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1cc([C@@](C)(O)CNc2cc(C)c3ccccc3[nH+]2)c(C)o1 ZINC001252164674 1061603478 /nfs/dbraw/zinc/60/34/78/1061603478.db2.gz NJKXOQALNCWEGG-IBGZPJMESA-N 1 2 310.397 4.073 20 0 DIADLO C/C(=C/C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccs1 ZINC001464569831 1061607567 /nfs/dbraw/zinc/60/75/67/1061607567.db2.gz NVQGSYVUSVNRCG-QXMHVHEDSA-N 1 2 309.394 4.180 20 0 DIADLO COc1ccc(CNc2cccc(-n3cc[nH+]c3)c2)c(Cl)c1 ZINC001474063529 1061610194 /nfs/dbraw/zinc/61/01/94/1061610194.db2.gz RAWHXDUIXLUBBK-UHFFFAOYSA-N 1 2 313.788 4.146 20 0 DIADLO CCCOc1cc(F)ccc1NCc1c[nH+]c2ccc(C)cn12 ZINC001474064968 1061610252 /nfs/dbraw/zinc/61/02/52/1061610252.db2.gz HCHGEOATYZLLSU-UHFFFAOYSA-N 1 2 313.376 4.183 20 0 DIADLO Cc1cc(NCc2ccc3ncccc3c2)ccc1-n1cc[nH+]c1 ZINC001474063514 1061611804 /nfs/dbraw/zinc/61/18/04/1061611804.db2.gz PWVPATZLALATLE-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO COc1c(C)c[nH+]c(CNC(=O)C[C@H](C)CCC=C(C)C)c1C ZINC001464612633 1061614668 /nfs/dbraw/zinc/61/46/68/1061614668.db2.gz QLRVACZYPFHUME-CQSZACIVSA-N 1 2 318.461 4.096 20 0 DIADLO CCS[C@H]1CC[C@@H](N(C)c2cc(C)[nH+]c(C3CCC3)n2)C1 ZINC001458202213 1061627964 /nfs/dbraw/zinc/62/79/64/1061627964.db2.gz ANZLLBXPVORADK-CABCVRRESA-N 1 2 305.491 4.163 20 0 DIADLO CCC[C@H]1[C@H](C)CCCN1c1nc2ccccc2n2c[nH+]cc12 ZINC001458210046 1061632298 /nfs/dbraw/zinc/63/22/98/1061632298.db2.gz CUIMATXITPYEIF-ZBFHGGJFSA-N 1 2 308.429 4.288 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2CC[C@@H](C)[C@@H](C)C2)ccc1-n1cc[nH+]c1 ZINC001464832395 1061639268 /nfs/dbraw/zinc/63/92/68/1061639268.db2.gz XMWJHRUZHVPEBE-IJEWVQPXSA-N 1 2 311.429 4.192 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2CC[C@@H](C)[C@H](C)C2)ccc1-n1cc[nH+]c1 ZINC001464832393 1061640761 /nfs/dbraw/zinc/64/07/61/1061640761.db2.gz XMWJHRUZHVPEBE-IIAWOOMASA-N 1 2 311.429 4.192 20 0 DIADLO CCCCC[C@H]1CCCN1c1nc2ccccc2n2c[nH+]cc12 ZINC001458268729 1061669310 /nfs/dbraw/zinc/66/93/10/1061669310.db2.gz XJUZUOCJGZDBOA-HNNXBMFYSA-N 1 2 308.429 4.432 20 0 DIADLO C(=C\c1ccccc1)\CNc1nc2ccccc2n2c[nH+]cc12 ZINC001458278822 1061674368 /nfs/dbraw/zinc/67/43/68/1061674368.db2.gz CVTYUXSOPDJFNA-TWGQIWQCSA-N 1 2 300.365 4.008 20 0 DIADLO Cc1cc(N(C)Cc2nc3ccccc3n2C)[nH+]c2ccccc12 ZINC001252656530 1061688018 /nfs/dbraw/zinc/68/80/18/1061688018.db2.gz IFGDBVPSAFFOLC-UHFFFAOYSA-N 1 2 316.408 4.066 20 0 DIADLO CCOc1ccc([C@@H]2C[C@H]2Nc2cc(C)[nH+]c(C3CCC3)n2)cc1 ZINC001458341728 1061706968 /nfs/dbraw/zinc/70/69/68/1061706968.db2.gz FGLPSABPBOJMLL-ZWKOTPCHSA-N 1 2 323.440 4.419 20 0 DIADLO Cc1coc(C[NH2+]Cc2cc(F)c(C(F)(F)F)cc2F)c1 ZINC001474168343 1061712550 /nfs/dbraw/zinc/71/25/50/1061712550.db2.gz STGQARWZAJMZGT-UHFFFAOYSA-N 1 2 305.246 4.175 20 0 DIADLO Clc1ccc(-c2nnc(-c3cccc(-n4cc[nH+]c4)c3)o2)cc1 ZINC001252782488 1061715987 /nfs/dbraw/zinc/71/59/87/1061715987.db2.gz UBEJSWBWDDVJLF-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO Cc1cc(NCCCOc2cccc(C)c2C)nc(C2CC2)[nH+]1 ZINC001458356061 1061717815 /nfs/dbraw/zinc/71/78/15/1061717815.db2.gz RWNJBUCUBZYOAC-UHFFFAOYSA-N 1 2 311.429 4.160 20 0 DIADLO Cc1ccc(C[NH2+]Cc2ncc(-c3ccccc3)s2)nc1C ZINC001474175231 1061720798 /nfs/dbraw/zinc/72/07/98/1061720798.db2.gz DDPUZNDGXSFTPR-UHFFFAOYSA-N 1 2 309.438 4.112 20 0 DIADLO Cc1cc(CNc2cccc(NCC(F)(F)F)c2)cc(C)[nH+]1 ZINC001474188005 1061736436 /nfs/dbraw/zinc/73/64/36/1061736436.db2.gz CWVUXPNWZMVWNA-UHFFFAOYSA-N 1 2 309.335 4.285 20 0 DIADLO CCc1ccc(-c2nnc([C@H]3CCC[N@@H+]3Cc3ccco3)o2)cc1 ZINC001252967975 1061767588 /nfs/dbraw/zinc/76/75/88/1061767588.db2.gz VNUJUYSWDYMFAC-QGZVFWFLSA-N 1 2 323.396 4.229 20 0 DIADLO CCc1ccc(-c2nnc([C@H]3CCC[N@H+]3Cc3ccco3)o2)cc1 ZINC001252967975 1061767608 /nfs/dbraw/zinc/76/76/08/1061767608.db2.gz VNUJUYSWDYMFAC-QGZVFWFLSA-N 1 2 323.396 4.229 20 0 DIADLO COc1ccc(C[NH2+][C@H](CCc2ccccc2)C(F)F)cc1F ZINC001474211632 1061767950 /nfs/dbraw/zinc/76/79/50/1061767950.db2.gz WMNHXWPHIWROAX-MRXNPFEDSA-N 1 2 323.358 4.190 20 0 DIADLO CCc1ccc(-c2nnc(-c3ccccc3-n3cc[nH+]c3)o2)cc1 ZINC001253026019 1061789376 /nfs/dbraw/zinc/78/93/76/1061789376.db2.gz BOUSMDJCKXJPOO-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO CC(F)(F)c1cc(F)ccc1NCc1cccc2[nH+]ccn21 ZINC001474243504 1061808484 /nfs/dbraw/zinc/80/84/84/1061808484.db2.gz OBNZDBSARCXCDX-UHFFFAOYSA-N 1 2 305.303 4.197 20 0 DIADLO Cc1cc(NCc2cccc(C(=O)OC(C)(C)C)c2)c[nH+]c1C ZINC001474249006 1061815695 /nfs/dbraw/zinc/81/56/95/1061815695.db2.gz XXAVDUQIVFYARD-UHFFFAOYSA-N 1 2 312.413 4.266 20 0 DIADLO CC(C)c1cc(N[C@H](C2CCC2)[C@H]2CCCO2)nc(C(C)C)[nH+]1 ZINC001458521795 1061817633 /nfs/dbraw/zinc/81/76/33/1061817633.db2.gz ZVXORYQLHWQDIL-SJLPKXTDSA-N 1 2 317.477 4.483 20 0 DIADLO CC1(C)CCc2onc(C[NH2+]Cc3cc(Cl)cs3)c2C1 ZINC001474254925 1061821832 /nfs/dbraw/zinc/82/18/32/1061821832.db2.gz REIKWPFYTGGKMW-UHFFFAOYSA-N 1 2 310.850 4.194 20 0 DIADLO Cc1cc(N[C@H]2c3ccccc3CC[C@@H]2F)nc(C2CCC2)[nH+]1 ZINC001458550075 1061831366 /nfs/dbraw/zinc/83/13/66/1061831366.db2.gz QZDQQFJRRLCJEI-WMZOPIPTSA-N 1 2 311.404 4.490 20 0 DIADLO Cc1cc(C)c2cc(NCc3ccc4c(c3)CCO4)ccc2[nH+]1 ZINC001474267539 1061836970 /nfs/dbraw/zinc/83/69/70/1061836970.db2.gz BZTGZWMXHCOKLC-UHFFFAOYSA-N 1 2 304.393 4.399 20 0 DIADLO Cc1[nH+]cc(CNc2cncc(C(C)C)c2)n1-c1ccccc1 ZINC001474285773 1061855991 /nfs/dbraw/zinc/85/59/91/1061855991.db2.gz TZZYNLWMPSYVND-UHFFFAOYSA-N 1 2 306.413 4.311 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3c4ccccc4[nH]c3C2)c(C)c1 ZINC001474308513 1061876471 /nfs/dbraw/zinc/87/64/71/1061876471.db2.gz DFTPCBQKROCVDL-UHFFFAOYSA-N 1 2 320.436 4.433 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3c4ccccc4[nH]c3C2)c(C)c1 ZINC001474308513 1061876487 /nfs/dbraw/zinc/87/64/87/1061876487.db2.gz DFTPCBQKROCVDL-UHFFFAOYSA-N 1 2 320.436 4.433 20 0 DIADLO COC(=O)C(C)(C)CC[N@H+](C)Cc1c(Cl)cccc1Cl ZINC001474318639 1061892766 /nfs/dbraw/zinc/89/27/66/1061892766.db2.gz IJMUOMZDVXIRKM-UHFFFAOYSA-N 1 2 318.244 4.015 20 0 DIADLO COC(=O)C(C)(C)CC[N@@H+](C)Cc1c(Cl)cccc1Cl ZINC001474318639 1061892778 /nfs/dbraw/zinc/89/27/78/1061892778.db2.gz IJMUOMZDVXIRKM-UHFFFAOYSA-N 1 2 318.244 4.015 20 0 DIADLO CC(C)[C@H]1CCC[N@H+](Cc2nc(Br)cs2)CC1 ZINC001474321569 1061902163 /nfs/dbraw/zinc/90/21/63/1061902163.db2.gz NAYGRMZHJMNNEN-NSHDSACASA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)[C@H]1CCC[N@@H+](Cc2nc(Br)cs2)CC1 ZINC001474321569 1061902183 /nfs/dbraw/zinc/90/21/83/1061902183.db2.gz NAYGRMZHJMNNEN-NSHDSACASA-N 1 2 317.296 4.164 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC001474323972 1061906264 /nfs/dbraw/zinc/90/62/64/1061906264.db2.gz JTZNUITWIOCJSX-SWLSCSKDSA-N 1 2 321.827 4.279 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC001474323972 1061906283 /nfs/dbraw/zinc/90/62/83/1061906283.db2.gz JTZNUITWIOCJSX-SWLSCSKDSA-N 1 2 321.827 4.279 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(F)cccc2OC(F)(F)F)C[C@H](C)S1 ZINC001474340099 1061934382 /nfs/dbraw/zinc/93/43/82/1061934382.db2.gz VWZUQYUNHMDLGU-AOOOYVTPSA-N 1 2 323.355 4.050 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(F)cccc2OC(F)(F)F)C[C@H](C)S1 ZINC001474340099 1061934403 /nfs/dbraw/zinc/93/44/03/1061934403.db2.gz VWZUQYUNHMDLGU-AOOOYVTPSA-N 1 2 323.355 4.050 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3C[C@H](C)OC[C@H]3c3ccccc3)cc21 ZINC001474349976 1061956251 /nfs/dbraw/zinc/95/62/51/1061956251.db2.gz BXJCPIPENGOQMR-KKSFZXQISA-N 1 2 320.436 4.438 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3C[C@H](C)OC[C@H]3c3ccccc3)cc21 ZINC001474349976 1061956271 /nfs/dbraw/zinc/95/62/71/1061956271.db2.gz BXJCPIPENGOQMR-KKSFZXQISA-N 1 2 320.436 4.438 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ncc(CC)s2)c(C)c1 ZINC001474349132 1061958342 /nfs/dbraw/zinc/95/83/42/1061958342.db2.gz WNBLQJZPHOTBFG-UHFFFAOYSA-N 1 2 304.459 4.045 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ncc(CC)s2)c(C)c1 ZINC001474349132 1061958362 /nfs/dbraw/zinc/95/83/62/1061958362.db2.gz WNBLQJZPHOTBFG-UHFFFAOYSA-N 1 2 304.459 4.045 20 0 DIADLO Clc1cccc(-c2nnc(-c3ccc(-n4cc[nH+]c4)cc3)o2)c1 ZINC001253807007 1061988100 /nfs/dbraw/zinc/98/81/00/1061988100.db2.gz PVFKINMXEIVEJF-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO CON(C[C@H]1CCC[C@@H](C)C1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001466755260 1062000088 /nfs/dbraw/zinc/00/00/88/1062000088.db2.gz NYRSUJVHFSOETE-WBMJQRKESA-N 1 2 319.449 4.228 20 0 DIADLO Cc1cc(C)c(NC(=O)NCCC2(c3ccccc3)CC2)c(C)[nH+]1 ZINC001466756291 1062000553 /nfs/dbraw/zinc/00/05/53/1062000553.db2.gz NYDRFAGZEQHRGU-UHFFFAOYSA-N 1 2 323.440 4.250 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CCO[C@@H](c4ccc(F)cc4)C3)[nH]c2c1 ZINC001474377936 1062019450 /nfs/dbraw/zinc/01/94/50/1062019450.db2.gz ZUEKJABMTDLANF-HXUWFJFHSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CCO[C@@H](c4ccc(F)cc4)C3)[nH]c2c1 ZINC001474377936 1062019470 /nfs/dbraw/zinc/01/94/70/1062019470.db2.gz ZUEKJABMTDLANF-HXUWFJFHSA-N 1 2 324.399 4.189 20 0 DIADLO C[N@H+](C/C=C/c1cccc(F)c1)Cc1nc2c(s1)CCCC2 ZINC001474380953 1062027978 /nfs/dbraw/zinc/02/79/78/1062027978.db2.gz IIJNAUCCMZJWSL-FNORWQNLSA-N 1 2 316.445 4.306 20 0 DIADLO C[N@@H+](C/C=C/c1cccc(F)c1)Cc1nc2c(s1)CCCC2 ZINC001474380953 1062027998 /nfs/dbraw/zinc/02/79/98/1062027998.db2.gz IIJNAUCCMZJWSL-FNORWQNLSA-N 1 2 316.445 4.306 20 0 DIADLO Oc1ccc2c(c1)C[N@@H+](Cc1ccc(Oc3ccccc3)o1)CC2 ZINC001474382861 1062028538 /nfs/dbraw/zinc/02/85/38/1062028538.db2.gz IOLDOAHGXMGPTF-UHFFFAOYSA-N 1 2 321.376 4.336 20 0 DIADLO Oc1ccc2c(c1)C[N@H+](Cc1ccc(Oc3ccccc3)o1)CC2 ZINC001474382861 1062028560 /nfs/dbraw/zinc/02/85/60/1062028560.db2.gz IOLDOAHGXMGPTF-UHFFFAOYSA-N 1 2 321.376 4.336 20 0 DIADLO CCCC[C@H](C)[NH2+][C@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001474389434 1062042302 /nfs/dbraw/zinc/04/23/02/1062042302.db2.gz BDBRMKQZKRRDAH-DOTOQJQBSA-N 1 2 305.462 4.108 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1cc2c(cc[nH]c2=O)o1 ZINC001474401430 1062056517 /nfs/dbraw/zinc/05/65/17/1062056517.db2.gz NMVPKBMUKPXWQD-LLVKDONJSA-N 1 2 316.788 4.380 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1cc2c(cc[nH]c2=O)o1 ZINC001474401430 1062056539 /nfs/dbraw/zinc/05/65/39/1062056539.db2.gz NMVPKBMUKPXWQD-LLVKDONJSA-N 1 2 316.788 4.380 20 0 DIADLO CCc1cn(CCCCOc2cccc(C(F)(F)F)c2)c[nH+]1 ZINC001459257728 1062059465 /nfs/dbraw/zinc/05/94/65/1062059465.db2.gz BLXGPUDKFMYCID-UHFFFAOYSA-N 1 2 312.335 4.324 20 0 DIADLO CCCCC[NH+](CCCCC)Cc1n[nH]cc1Br ZINC001474404512 1062064830 /nfs/dbraw/zinc/06/48/30/1062064830.db2.gz NKIJQQZRWKBISB-UHFFFAOYSA-N 1 2 316.287 4.355 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](C)Cc1cccc(O)c1Br ZINC001474410298 1062071661 /nfs/dbraw/zinc/07/16/61/1062071661.db2.gz PKIKFKOUYNCJJH-LBPRGKRZSA-N 1 2 320.230 4.348 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1cccc(O)c1Br ZINC001474410298 1062071686 /nfs/dbraw/zinc/07/16/86/1062071686.db2.gz PKIKFKOUYNCJJH-LBPRGKRZSA-N 1 2 320.230 4.348 20 0 DIADLO COc1ccccc1Cc1cn(CCCc2cccc(C)c2)c[nH+]1 ZINC001459300795 1062072983 /nfs/dbraw/zinc/07/29/83/1062072983.db2.gz KZLWAPAEUSANMK-UHFFFAOYSA-N 1 2 320.436 4.424 20 0 DIADLO CCC[N@H+](CC(=O)OC(C)(C)C)Cc1ccc(C)c(Cl)c1 ZINC001474426339 1062101148 /nfs/dbraw/zinc/10/11/48/1062101148.db2.gz WYGHQUARAPFCLS-UHFFFAOYSA-N 1 2 311.853 4.202 20 0 DIADLO CCC[N@@H+](CC(=O)OC(C)(C)C)Cc1ccc(C)c(Cl)c1 ZINC001474426339 1062101152 /nfs/dbraw/zinc/10/11/52/1062101152.db2.gz WYGHQUARAPFCLS-UHFFFAOYSA-N 1 2 311.853 4.202 20 0 DIADLO COc1ccccc1Cc1cn(Cc2ccccc2CF)c[nH+]1 ZINC001459361870 1062111921 /nfs/dbraw/zinc/11/19/21/1062111921.db2.gz VOCIHFXGWPJNFI-UHFFFAOYSA-N 1 2 310.372 4.000 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCC=C(Br)C2)c(Cl)c1 ZINC001474474629 1062154753 /nfs/dbraw/zinc/15/47/53/1062154753.db2.gz QFZWEAQCGGKYIO-UHFFFAOYSA-N 1 2 318.617 4.006 20 0 DIADLO Fc1ccc(CC[N@H+]2CCC=C(Br)C2)c(Cl)c1 ZINC001474474629 1062154764 /nfs/dbraw/zinc/15/47/64/1062154764.db2.gz QFZWEAQCGGKYIO-UHFFFAOYSA-N 1 2 318.617 4.006 20 0 DIADLO COCC[N@H+](Cc1nc(C(C)(C)C)co1)[C@H](C)c1ccccc1 ZINC001459379992 1062119367 /nfs/dbraw/zinc/11/93/67/1062119367.db2.gz RMXKIDQISNPVLU-OAHLLOKOSA-N 1 2 316.445 4.182 20 0 DIADLO COCC[N@@H+](Cc1nc(C(C)(C)C)co1)[C@H](C)c1ccccc1 ZINC001459379992 1062119375 /nfs/dbraw/zinc/11/93/75/1062119375.db2.gz RMXKIDQISNPVLU-OAHLLOKOSA-N 1 2 316.445 4.182 20 0 DIADLO COc1ccc(C[N@H+](Cc2c(F)cccc2F)C2CC2)c(C)c1 ZINC001474442968 1062121219 /nfs/dbraw/zinc/12/12/19/1062121219.db2.gz UBIKEXGRFVIMCI-UHFFFAOYSA-N 1 2 317.379 4.446 20 0 DIADLO COc1ccc(C[N@@H+](Cc2c(F)cccc2F)C2CC2)c(C)c1 ZINC001474442968 1062121230 /nfs/dbraw/zinc/12/12/30/1062121230.db2.gz UBIKEXGRFVIMCI-UHFFFAOYSA-N 1 2 317.379 4.446 20 0 DIADLO CCOc1ccc(Cl)cc1C[NH+]1CC(C)(C)OC(C)(C)C1 ZINC001474449059 1062126413 /nfs/dbraw/zinc/12/64/13/1062126413.db2.gz OTXFOOFGORDYIE-UHFFFAOYSA-N 1 2 311.853 4.128 20 0 DIADLO C/C=C\C[C@@H]([NH2+]CCc1ccc(C(C)(C)C)cc1)C(=O)OCC ZINC001474496519 1062175938 /nfs/dbraw/zinc/17/59/38/1062175938.db2.gz NWEKILGVZLYGSP-XOWYPZSQSA-N 1 2 317.473 4.014 20 0 DIADLO CC(C)[C@H]1C[N@H+](Cc2csc(C(F)(F)F)n2)[C@H]1C(C)C ZINC001474521621 1062204424 /nfs/dbraw/zinc/20/44/24/1062204424.db2.gz NMNZBVRFZOKRLL-NEPJUHHUSA-N 1 2 306.397 4.274 20 0 DIADLO CC(C)[C@H]1C[N@@H+](Cc2csc(C(F)(F)F)n2)[C@H]1C(C)C ZINC001474521621 1062204439 /nfs/dbraw/zinc/20/44/39/1062204439.db2.gz NMNZBVRFZOKRLL-NEPJUHHUSA-N 1 2 306.397 4.274 20 0 DIADLO CSC1CC([NH2+][C@H](CCC(C)(C)C)C(=O)OC(C)(C)C)C1 ZINC001474530484 1062215665 /nfs/dbraw/zinc/21/56/65/1062215665.db2.gz POFXWLSGHATPKA-JXQTWKCFSA-N 1 2 315.523 4.007 20 0 DIADLO CC(C)C[C@H]1COCC[N@@H+]1CCc1c(Cl)cccc1Cl ZINC001459602749 1062234281 /nfs/dbraw/zinc/23/42/81/1062234281.db2.gz ULNKSDUGXMTBTE-ZDUSSCGKSA-N 1 2 316.272 4.283 20 0 DIADLO CC(C)C[C@H]1COCC[N@H+]1CCc1c(Cl)cccc1Cl ZINC001459602749 1062234298 /nfs/dbraw/zinc/23/42/98/1062234298.db2.gz ULNKSDUGXMTBTE-ZDUSSCGKSA-N 1 2 316.272 4.283 20 0 DIADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1ccc(Br)cc1C(F)(F)F ZINC001474549845 1062245894 /nfs/dbraw/zinc/24/58/94/1062245894.db2.gz LBOJIVOCTWUVMH-DTWKUNHWSA-N 1 2 322.168 4.308 20 0 DIADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1ccc(Br)cc1C(F)(F)F ZINC001474549845 1062245915 /nfs/dbraw/zinc/24/59/15/1062245915.db2.gz LBOJIVOCTWUVMH-DTWKUNHWSA-N 1 2 322.168 4.308 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Br)cc2C(F)(F)F)[C@H]1C ZINC001474549848 1062248156 /nfs/dbraw/zinc/24/81/56/1062248156.db2.gz LBOJIVOCTWUVMH-IUCAKERBSA-N 1 2 322.168 4.308 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Br)cc2C(F)(F)F)[C@H]1C ZINC001474549848 1062248172 /nfs/dbraw/zinc/24/81/72/1062248172.db2.gz LBOJIVOCTWUVMH-IUCAKERBSA-N 1 2 322.168 4.308 20 0 DIADLO Cc1[nH+]cn(-c2ccc(NC[C@@H]3CC3(Cl)Cl)cc2)c1C ZINC001474553231 1062251446 /nfs/dbraw/zinc/25/14/46/1062251446.db2.gz YIPURZGVARPTJC-LBPRGKRZSA-N 1 2 310.228 4.095 20 0 DIADLO Cc1ccc2cc(C[NH2+]CC(F)(F)c3ccccc3)ccc2n1 ZINC001474561957 1062264912 /nfs/dbraw/zinc/26/49/12/1062264912.db2.gz XRIDSBNSTKWXQG-UHFFFAOYSA-N 1 2 312.363 4.425 20 0 DIADLO CCCn1cncc1C[N@@H+]1CCc2oc(-c3ccccc3)cc2C1 ZINC001474616286 1062333717 /nfs/dbraw/zinc/33/37/17/1062333717.db2.gz LVBGQEDFLHUTNR-UHFFFAOYSA-N 1 2 321.424 4.111 20 0 DIADLO CCCn1cncc1C[N@H+]1CCc2oc(-c3ccccc3)cc2C1 ZINC001474616286 1062333737 /nfs/dbraw/zinc/33/37/37/1062333737.db2.gz LVBGQEDFLHUTNR-UHFFFAOYSA-N 1 2 321.424 4.111 20 0 DIADLO CO[C@H](c1ccccc1)[C@H](C)[NH2+]CC(F)(F)c1cccc(F)c1 ZINC001474618356 1062337492 /nfs/dbraw/zinc/33/74/92/1062337492.db2.gz SLOGJEXETUXLDU-GUYCJALGSA-N 1 2 323.358 4.283 20 0 DIADLO c1n[nH]c([C@@H]([NH2+]C2CCC(C3CCC3)CC2)C2CCCCC2)n1 ZINC001474635589 1062361344 /nfs/dbraw/zinc/36/13/44/1062361344.db2.gz BXSSWGNDVYAPMG-VJFUWPCTSA-N 1 2 316.493 4.375 20 0 DIADLO CCC[C@H]1C[N@H+](Cc2cccc(SC(F)(F)F)c2)CCO1 ZINC001459764788 1062375297 /nfs/dbraw/zinc/37/52/97/1062375297.db2.gz TYVZTQFBWNHKEL-ZDUSSCGKSA-N 1 2 319.392 4.299 20 0 DIADLO CCC[C@H]1C[N@@H+](Cc2cccc(SC(F)(F)F)c2)CCO1 ZINC001459764788 1062375321 /nfs/dbraw/zinc/37/53/21/1062375321.db2.gz TYVZTQFBWNHKEL-ZDUSSCGKSA-N 1 2 319.392 4.299 20 0 DIADLO C[C@H]1COCCN1c1ccc([NH2+]CCC(C)(C)C)cc1Cl ZINC001474653382 1062381926 /nfs/dbraw/zinc/38/19/26/1062381926.db2.gz UXQNRURVXMKNKI-ZDUSSCGKSA-N 1 2 310.869 4.413 20 0 DIADLO COc1ccc([C@H](C)[C@H](C)Nc2c[nH+]c(C)c(C)c2)cc1OC ZINC001474683817 1062416548 /nfs/dbraw/zinc/41/65/48/1062416548.db2.gz BYNJRFHQRGIJIO-HIFRSBDPSA-N 1 2 314.429 4.320 20 0 DIADLO COc1ccc([C@H](C)[C@@H](C)Nc2c[nH+]c(C)c(C)c2)cc1OC ZINC001474683818 1062417586 /nfs/dbraw/zinc/41/75/86/1062417586.db2.gz BYNJRFHQRGIJIO-UKRRQHHQSA-N 1 2 314.429 4.320 20 0 DIADLO C[C@@H]([NH2+]Cc1nsc2ccccc12)c1cccc(F)c1F ZINC001459860428 1062455850 /nfs/dbraw/zinc/45/58/50/1062455850.db2.gz WDFKKGCUFAGCIS-SNVBAGLBSA-N 1 2 304.365 4.425 20 0 DIADLO Cc1ccc([C@@H]2CCN(C(=O)c3c(C)cc(C)[nH+]c3C)C2)c(C)c1 ZINC001459862591 1062456662 /nfs/dbraw/zinc/45/66/62/1062456662.db2.gz KIKMOJXUPSVJTJ-GOSISDBHSA-N 1 2 322.452 4.253 20 0 DIADLO Cc1ccc([C@H]2CCN(C(=O)c3c(C)cc(C)[nH+]c3C)C2)c(C)c1 ZINC001459862594 1062458007 /nfs/dbraw/zinc/45/80/07/1062458007.db2.gz KIKMOJXUPSVJTJ-SFHVURJKSA-N 1 2 322.452 4.253 20 0 DIADLO COCc1cnc2n1CC[N@H+](C1CCC(C(C)(C)C)CC1)[C@H]2C ZINC001255502953 1062465400 /nfs/dbraw/zinc/46/54/00/1062465400.db2.gz OGYCUDNWBAIKHU-FHERZECASA-N 1 2 319.493 4.011 20 0 DIADLO COCc1cnc2n1CC[N@@H+](C1CCC(C(C)(C)C)CC1)[C@H]2C ZINC001255502953 1062465412 /nfs/dbraw/zinc/46/54/12/1062465412.db2.gz OGYCUDNWBAIKHU-FHERZECASA-N 1 2 319.493 4.011 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)[NH2+][C@@H](c1ccccc1)C(F)F ZINC001474764214 1062468333 /nfs/dbraw/zinc/46/83/33/1062468333.db2.gz UVNMQKWRFOVFMS-VUCVNMQBSA-N 1 2 319.332 4.305 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2[C@@H]2CCC[C@@H](C(F)(F)F)C2)no1 ZINC001255718926 1062539770 /nfs/dbraw/zinc/53/97/70/1062539770.db2.gz XGABDPPTCHPPSB-UPJWGTAASA-N 1 2 317.355 4.026 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2[C@@H]2CCC[C@@H](C(F)(F)F)C2)no1 ZINC001255718926 1062539787 /nfs/dbraw/zinc/53/97/87/1062539787.db2.gz XGABDPPTCHPPSB-UPJWGTAASA-N 1 2 317.355 4.026 20 0 DIADLO Cc1cc(F)ccc1C[NH+]1CCN([C@@H](C)c2ccsc2)CC1 ZINC001459995361 1062555156 /nfs/dbraw/zinc/55/51/56/1062555156.db2.gz UADKKYZEZKIFNF-HNNXBMFYSA-N 1 2 318.461 4.074 20 0 DIADLO CC(C)[C@H](C)C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001460015049 1062572254 /nfs/dbraw/zinc/57/22/54/1062572254.db2.gz MSUSBJOAIBCDCH-AWEZNQCLSA-N 1 2 312.413 4.084 20 0 DIADLO C[C@@H]1CC[C@@H](C(=O)Oc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C1 ZINC001460019260 1062574296 /nfs/dbraw/zinc/57/42/96/1062574296.db2.gz ZFHFKSLBXIXSSG-GDBMZVCRSA-N 1 2 324.424 4.228 20 0 DIADLO C[C@H]1CC[C@@H](C(=O)Oc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C1 ZINC001460019265 1062574452 /nfs/dbraw/zinc/57/44/52/1062574452.db2.gz ZFHFKSLBXIXSSG-GOEBONIOSA-N 1 2 324.424 4.228 20 0 DIADLO Cc1cc(NC(=O)N[C@H](CCC(C)C)C(C)(C)C)c(C)c[nH+]1 ZINC001476303697 1062628432 /nfs/dbraw/zinc/62/84/32/1062628432.db2.gz QUAIXVROBUCIRR-MRXNPFEDSA-N 1 2 305.466 4.093 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ccncc2F)CC2CC2)c(Cl)c1 ZINC001460097604 1062632723 /nfs/dbraw/zinc/63/27/23/1062632723.db2.gz HAVUYXUTUMRUSZ-UHFFFAOYSA-N 1 2 322.786 4.425 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ccncc2F)CC2CC2)c(Cl)c1 ZINC001460097604 1062632741 /nfs/dbraw/zinc/63/27/41/1062632741.db2.gz HAVUYXUTUMRUSZ-UHFFFAOYSA-N 1 2 322.786 4.425 20 0 DIADLO CCCCC[C@H]1CCCCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001476536057 1062677682 /nfs/dbraw/zinc/67/76/82/1062677682.db2.gz XKYSOUAQWGIGCA-INIZCTEOSA-N 1 2 314.433 4.301 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(Cl)c2Cl)[C@H]1[C@H]1CCCO1 ZINC001460193824 1062689932 /nfs/dbraw/zinc/68/99/32/1062689932.db2.gz FCHFJOPGRGBAIJ-HIFRSBDPSA-N 1 2 314.256 4.383 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(Cl)c2Cl)[C@H]1[C@H]1CCCO1 ZINC001460193824 1062689952 /nfs/dbraw/zinc/68/99/52/1062689952.db2.gz FCHFJOPGRGBAIJ-HIFRSBDPSA-N 1 2 314.256 4.383 20 0 DIADLO Cc1nc(C[N@@H+]2CC(C)(C)[C@H]2[C@H]2CCCO2)sc1C(C)(C)C ZINC001460195854 1062693674 /nfs/dbraw/zinc/69/36/74/1062693674.db2.gz LIWXCQZDGQVJMU-UKRRQHHQSA-N 1 2 322.518 4.138 20 0 DIADLO Cc1nc(C[N@H+]2CC(C)(C)[C@H]2[C@H]2CCCO2)sc1C(C)(C)C ZINC001460195854 1062693679 /nfs/dbraw/zinc/69/36/79/1062693679.db2.gz LIWXCQZDGQVJMU-UKRRQHHQSA-N 1 2 322.518 4.138 20 0 DIADLO CCC[C@](C)(NC(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC001476898460 1062744464 /nfs/dbraw/zinc/74/44/64/1062744464.db2.gz JTBXZZGZQAFSIA-IBGZPJMESA-N 1 2 322.412 4.171 20 0 DIADLO Cc1ccc(C[NH2+][C@H](Cc2ccccc2)c2ncco2)cc1F ZINC001460312449 1062775631 /nfs/dbraw/zinc/77/56/31/1062775631.db2.gz YPESVRYDMSZNFD-GOSISDBHSA-N 1 2 310.372 4.196 20 0 DIADLO Fc1cc2c(cc1F)C[NH+](C[C@H]1[C@H](c3ccccc3)C1(F)F)C2 ZINC001460311843 1062775948 /nfs/dbraw/zinc/77/59/48/1062775948.db2.gz VTEWJMKFOIVSCF-YOEHRIQHSA-N 1 2 321.317 4.329 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+]1C[C@H](C)OC2(CCC2)C1 ZINC001460336579 1062790838 /nfs/dbraw/zinc/79/08/38/1062790838.db2.gz DBNBLEAHZVAPBD-QWHCGFSZSA-N 1 2 324.262 4.154 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+]1C[C@H](C)OC2(CCC2)C1 ZINC001460336579 1062790847 /nfs/dbraw/zinc/79/08/47/1062790847.db2.gz DBNBLEAHZVAPBD-QWHCGFSZSA-N 1 2 324.262 4.154 20 0 DIADLO Brc1cccc([C@H]2COCC[N@@H+]2CC2CCCC2)c1 ZINC001460438906 1062856322 /nfs/dbraw/zinc/85/63/22/1062856322.db2.gz BNRCNQJQXSZMKG-MRXNPFEDSA-N 1 2 324.262 4.013 20 0 DIADLO Brc1cccc([C@H]2COCC[N@H+]2CC2CCCC2)c1 ZINC001460438906 1062856336 /nfs/dbraw/zinc/85/63/36/1062856336.db2.gz BNRCNQJQXSZMKG-MRXNPFEDSA-N 1 2 324.262 4.013 20 0 DIADLO CC(C)C[C@H](C(=O)N(C)C[C@H](C)C1CCCCC1)n1cc[nH+]c1 ZINC001471014032 1062907294 /nfs/dbraw/zinc/90/72/94/1062907294.db2.gz PEIMKEPZNZNNGO-FUHWJXTLSA-N 1 2 319.493 4.145 20 0 DIADLO CC(C)C[C@H](C(=O)N(C)C[C@@H](C)C1CCCCC1)n1cc[nH+]c1 ZINC001471014035 1062908614 /nfs/dbraw/zinc/90/86/14/1062908614.db2.gz PEIMKEPZNZNNGO-SJLPKXTDSA-N 1 2 319.493 4.145 20 0 DIADLO C[N@H+](CCc1ccccc1)[C@@H](CCc1ccccc1)C(F)F ZINC001460572197 1062918070 /nfs/dbraw/zinc/91/80/70/1062918070.db2.gz DIDXIXGKRMFAKQ-SFHVURJKSA-N 1 2 303.396 4.427 20 0 DIADLO C[N@@H+](CCc1ccccc1)[C@@H](CCc1ccccc1)C(F)F ZINC001460572197 1062918095 /nfs/dbraw/zinc/91/80/95/1062918095.db2.gz DIDXIXGKRMFAKQ-SFHVURJKSA-N 1 2 303.396 4.427 20 0 DIADLO COC(=O)[C@H](c1ccccc1F)[N@H+](C)C[C@@H](C)C1CCCCC1 ZINC001460598282 1062924071 /nfs/dbraw/zinc/92/40/71/1062924071.db2.gz MNHAFPNFXZLFRB-KDOFPFPSSA-N 1 2 321.436 4.188 20 0 DIADLO COC(=O)[C@H](c1ccccc1F)[N@@H+](C)C[C@@H](C)C1CCCCC1 ZINC001460598282 1062924091 /nfs/dbraw/zinc/92/40/91/1062924091.db2.gz MNHAFPNFXZLFRB-KDOFPFPSSA-N 1 2 321.436 4.188 20 0 DIADLO CN(C)c1cc(CN2C[C@@H](C(C)(C)C)Cc3ccccc32)cc[nH+]1 ZINC001460617488 1062937042 /nfs/dbraw/zinc/93/70/42/1062937042.db2.gz RFHMLZZSVZHVAP-SFHVURJKSA-N 1 2 323.484 4.373 20 0 DIADLO CC[NH+](CC)[C@@H](c1nnc([C@@H]2C[C@H]2C)o1)c1ccc(Cl)cc1 ZINC001256683215 1062943890 /nfs/dbraw/zinc/94/38/90/1062943890.db2.gz OBBQEIUCHDAWBF-KCPJHIHWSA-N 1 2 319.836 4.278 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@H+](Cc2ccc(Cl)cn2)C1 ZINC001460650487 1062961953 /nfs/dbraw/zinc/96/19/53/1062961953.db2.gz FWSYRJFAYWPTHX-KRWDZBQOSA-N 1 2 304.796 4.196 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@@H+](Cc2ccc(Cl)cn2)C1 ZINC001460650487 1062961961 /nfs/dbraw/zinc/96/19/61/1062961961.db2.gz FWSYRJFAYWPTHX-KRWDZBQOSA-N 1 2 304.796 4.196 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)C/C=C/c2ccc(C)cc2)[nH+]c1C ZINC001471859758 1063025870 /nfs/dbraw/zinc/02/58/70/1063025870.db2.gz SLCKGQYEQQMUMP-JXTAAOLFSA-N 1 2 323.440 4.102 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)c2cc(C(C)C)oc2C)[nH+]c1C ZINC001471860076 1063026855 /nfs/dbraw/zinc/02/68/55/1063026855.db2.gz JIISBRMJQGXNPI-HNNXBMFYSA-N 1 2 315.417 4.029 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)[C@H](C)CC2CCCCC2)[nH+]c1C ZINC001471859752 1063027804 /nfs/dbraw/zinc/02/78/04/1063027804.db2.gz SKWZCVSOFNMMIL-CXAGYDPISA-N 1 2 317.477 4.297 20 0 DIADLO CCOC(=O)[C@H](CC1CC1)[NH2+][C@H](C)c1cccc2ccccc21 ZINC001460739185 1063033990 /nfs/dbraw/zinc/03/39/90/1063033990.db2.gz VSAGSQUHTZGROK-KUHUBIRLSA-N 1 2 311.425 4.222 20 0 DIADLO CCCCCC[N@H+](Cc1ccc(C)o1)Cc1snnc1C ZINC001460808258 1063069003 /nfs/dbraw/zinc/06/90/03/1063069003.db2.gz FUVCTGZKYSZMCE-UHFFFAOYSA-N 1 2 307.463 4.330 20 0 DIADLO CCCCCC[N@@H+](Cc1ccc(C)o1)Cc1snnc1C ZINC001460808258 1063069031 /nfs/dbraw/zinc/06/90/31/1063069031.db2.gz FUVCTGZKYSZMCE-UHFFFAOYSA-N 1 2 307.463 4.330 20 0 DIADLO C[C@@]1([NH2+]Cc2nccc(Cl)c2Cl)CCOc2ccccc21 ZINC001460823077 1063085313 /nfs/dbraw/zinc/08/53/13/1063085313.db2.gz FUJUJKMWRJSAGW-MRXNPFEDSA-N 1 2 323.223 4.176 20 0 DIADLO CC1=C(C)C[C@H](C(=O)N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001472532045 1063096716 /nfs/dbraw/zinc/09/67/16/1063096716.db2.gz AWXRZPNAMFDTIZ-FUHWJXTLSA-N 1 2 323.440 4.186 20 0 DIADLO CC1=CC[C@](C)(C(=O)N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001472533107 1063097489 /nfs/dbraw/zinc/09/74/89/1063097489.db2.gz RXLLDPYPKWBPCT-UZLBHIALSA-N 1 2 323.440 4.186 20 0 DIADLO CC1=CC[C@@](C)(C(=O)N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001472533106 1063098295 /nfs/dbraw/zinc/09/82/95/1063098295.db2.gz RXLLDPYPKWBPCT-OXQOHEQNSA-N 1 2 323.440 4.186 20 0 DIADLO c1cn(-c2ccc(-c3nnc(CC4CCCCC4)o3)cc2)c[nH+]1 ZINC001257076705 1063103212 /nfs/dbraw/zinc/10/32/12/1063103212.db2.gz RSLSNTIWMTWCQV-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccc(C3CCCC3)cc2)c[nH+]1 ZINC001460887538 1063117976 /nfs/dbraw/zinc/11/79/76/1063117976.db2.gz BOZZHDSUCRAYHN-UHFFFAOYSA-N 1 2 308.425 4.286 20 0 DIADLO CC(C)c1cc(NC[C@](C)(O)c2ccccc2)nc(C(C)C)[nH+]1 ZINC001472696563 1063157783 /nfs/dbraw/zinc/15/77/83/1063157783.db2.gz MCHBGZBSXWZEIP-IBGZPJMESA-N 1 2 313.445 4.043 20 0 DIADLO CCc1cc(N[C@H](C)c2ncc(-c3ccccc3)o2)nc(CC)[nH+]1 ZINC001472702873 1063163729 /nfs/dbraw/zinc/16/37/29/1063163729.db2.gz AKURQAYUVAVKQZ-CYBMUJFWSA-N 1 2 322.412 4.430 20 0 DIADLO COc1cc(C)[nH+]c(CN2c3ccc(Cl)cc3C[C@H]2C)c1 ZINC001460975862 1063165184 /nfs/dbraw/zinc/16/51/84/1063165184.db2.gz LETZLVYBACBMSG-GFCCVEGCSA-N 1 2 302.805 4.003 20 0 DIADLO CCc1cc(N[C@H](Cc2ccc(F)cc2)C(C)C)nc(CC)[nH+]1 ZINC001472705744 1063165875 /nfs/dbraw/zinc/16/58/75/1063165875.db2.gz ALIUWLREHDTFOD-QGZVFWFLSA-N 1 2 315.436 4.420 20 0 DIADLO Cc1ccc([C@@H]2C[C@H]2c2nnc([C@H]3CC[N@@H+]3C(C)(C)C)o2)cc1 ZINC001257280122 1063176733 /nfs/dbraw/zinc/17/67/33/1063176733.db2.gz QJSRSYUZHKRFAI-ARFHVFGLSA-N 1 2 311.429 4.194 20 0 DIADLO Cc1ccc([C@@H]2C[C@H]2c2nnc([C@H]3CC[N@H+]3C(C)(C)C)o2)cc1 ZINC001257280122 1063176743 /nfs/dbraw/zinc/17/67/43/1063176743.db2.gz QJSRSYUZHKRFAI-ARFHVFGLSA-N 1 2 311.429 4.194 20 0 DIADLO CCc1cc(N2CC[C@@H](Cc3ccccc3)[C@@H]2C)nc(CC)[nH+]1 ZINC001472719183 1063179290 /nfs/dbraw/zinc/17/92/90/1063179290.db2.gz ZKDAPIYPPCWDNQ-RDJZCZTQSA-N 1 2 309.457 4.059 20 0 DIADLO Fc1cc(C[NH2+][C@@H](c2ccco2)c2ccccc2)cnc1Cl ZINC001461015078 1063189025 /nfs/dbraw/zinc/18/90/25/1063189025.db2.gz GAWQCYCLCXQDSE-MRXNPFEDSA-N 1 2 316.763 4.346 20 0 DIADLO CCC(CC)[N@@H+]1CCn2cc(-c3ccc(F)cc3)nc2C1(C)C ZINC001257303351 1063190071 /nfs/dbraw/zinc/19/00/71/1063190071.db2.gz NVTRQUFKILMXOC-UHFFFAOYSA-N 1 2 315.436 4.429 20 0 DIADLO CCC(CC)[N@H+]1CCn2cc(-c3ccc(F)cc3)nc2C1(C)C ZINC001257303351 1063190085 /nfs/dbraw/zinc/19/00/85/1063190085.db2.gz NVTRQUFKILMXOC-UHFFFAOYSA-N 1 2 315.436 4.429 20 0 DIADLO Cc1cc(Nc2cc(C3CC3)ncn2)c[nH+]c1N1CCCC[C@H]1C ZINC001472740260 1063197452 /nfs/dbraw/zinc/19/74/52/1063197452.db2.gz DQCRCFSNYHXTOF-CQSZACIVSA-N 1 2 323.444 4.180 20 0 DIADLO CCc1cc(N[C@H]2CCCOc3c(F)cccc32)nc(CC)[nH+]1 ZINC001472745027 1063201906 /nfs/dbraw/zinc/20/19/06/1063201906.db2.gz KGLYOOJCMGXHBG-HNNXBMFYSA-N 1 2 315.392 4.066 20 0 DIADLO CCc1cc(N[C@@H]2CCCOc3c(F)cccc32)nc(CC)[nH+]1 ZINC001472745028 1063202683 /nfs/dbraw/zinc/20/26/83/1063202683.db2.gz KGLYOOJCMGXHBG-OAHLLOKOSA-N 1 2 315.392 4.066 20 0 DIADLO CC(C)c1cc(NCC[C@@H]2CCO[C@@H](C)C2)nc(C(C)C)[nH+]1 ZINC001472755729 1063209442 /nfs/dbraw/zinc/20/94/42/1063209442.db2.gz IZBCGDUPJHBHQL-LSDHHAIUSA-N 1 2 305.466 4.341 20 0 DIADLO CCOc1cccc(F)c1C[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC001461063648 1063228743 /nfs/dbraw/zinc/22/87/43/1063228743.db2.gz JWOICYSDKBMOGJ-OCCSQVGLSA-N 1 2 303.377 4.231 20 0 DIADLO CCCCCC[C@H](C)N1CC[NH+](CCc2cccs2)CC1 ZINC001257367488 1063233004 /nfs/dbraw/zinc/23/30/04/1063233004.db2.gz CYKOTMPYTGFDSF-KRWDZBQOSA-N 1 2 308.535 4.267 20 0 DIADLO Cc1nc(NC[C@H](c2ccccc2)C2CC2)c2c([nH+]1)CCCC2 ZINC001472794873 1063241155 /nfs/dbraw/zinc/24/11/55/1063241155.db2.gz KHVRFWBZNUFGEW-GOSISDBHSA-N 1 2 307.441 4.270 20 0 DIADLO CCCCCC[C@@H](C)[N@H+]1Cc2nnc(C(F)(F)F)n2[C@H](C)C1 ZINC001257373989 1063242901 /nfs/dbraw/zinc/24/29/01/1063242901.db2.gz XVKDIRVIUJHBBH-VXGBXAGGSA-N 1 2 318.387 4.032 20 0 DIADLO CCCCCC[C@@H](C)[N@@H+]1Cc2nnc(C(F)(F)F)n2[C@H](C)C1 ZINC001257373989 1063242914 /nfs/dbraw/zinc/24/29/14/1063242914.db2.gz XVKDIRVIUJHBBH-VXGBXAGGSA-N 1 2 318.387 4.032 20 0 DIADLO CCOc1cccc(F)c1C[NH2+]Cc1ccccc1OC(C)C ZINC001461086996 1063244850 /nfs/dbraw/zinc/24/48/50/1063244850.db2.gz GWDKUTKPLSAEDB-UHFFFAOYSA-N 1 2 317.404 4.301 20 0 DIADLO Clc1ncc(C[N@@H+]2Cc3ccccc3C3(CCC3)C2)s1 ZINC001257432078 1063274557 /nfs/dbraw/zinc/27/45/57/1063274557.db2.gz MZZNMEOPSXDJOW-UHFFFAOYSA-N 1 2 304.846 4.234 20 0 DIADLO Clc1ncc(C[N@H+]2Cc3ccccc3C3(CCC3)C2)s1 ZINC001257432078 1063274577 /nfs/dbraw/zinc/27/45/77/1063274577.db2.gz MZZNMEOPSXDJOW-UHFFFAOYSA-N 1 2 304.846 4.234 20 0 DIADLO CCc1cc(N[C@H](Cc2cccnc2)C2CCCC2)nc(CC)[nH+]1 ZINC001472860162 1063288667 /nfs/dbraw/zinc/28/86/67/1063288667.db2.gz LWAPNANUIUCIHI-GOSISDBHSA-N 1 2 324.472 4.210 20 0 DIADLO Cc1cc(C)c(CNC(=O)N2CC[C@H](C(C)(C)C)C[C@@H]2C)c[nH+]1 ZINC001478814047 1063298518 /nfs/dbraw/zinc/29/85/18/1063298518.db2.gz IPENVQIQUMJECF-RDJZCZTQSA-N 1 2 317.477 4.055 20 0 DIADLO Cc1cc(NCCCOc2cccc(F)c2)nc(C2CCC2)[nH+]1 ZINC001472897847 1063307479 /nfs/dbraw/zinc/30/74/79/1063307479.db2.gz YKRXRTQWAAUOMU-UHFFFAOYSA-N 1 2 315.392 4.073 20 0 DIADLO CCCCn1c(SCCC2CCC2)nnc1[C@H](CC)[NH+](C)C ZINC001472913031 1063313119 /nfs/dbraw/zinc/31/31/19/1063313119.db2.gz MGMRIBFYGBKWTN-HNNXBMFYSA-N 1 2 324.538 4.373 20 0 DIADLO COc1cccc(SCCSc2[nH+]cc3ccccn32)c1 ZINC001472924394 1063316942 /nfs/dbraw/zinc/31/69/42/1063316942.db2.gz UGXJZMULNFAUTB-UHFFFAOYSA-N 1 2 316.451 4.227 20 0 DIADLO C[N@@H+]1CCCC[C@@H]1c1nnc([C@H]2C[C@@H]2c2ccc(Cl)cc2)o1 ZINC001257647397 1063355694 /nfs/dbraw/zinc/35/56/94/1063355694.db2.gz FCJLNHBRGPQMPG-QLFBSQMISA-N 1 2 317.820 4.151 20 0 DIADLO C[N@H+]1CCCC[C@@H]1c1nnc([C@H]2C[C@@H]2c2ccc(Cl)cc2)o1 ZINC001257647397 1063355714 /nfs/dbraw/zinc/35/57/14/1063355714.db2.gz FCJLNHBRGPQMPG-QLFBSQMISA-N 1 2 317.820 4.151 20 0 DIADLO COc1ccccc1Cc1cn(CC[C@H]2CCCC2(F)F)c[nH+]1 ZINC001473101261 1063402852 /nfs/dbraw/zinc/40/28/52/1063402852.db2.gz QIEKICKSBQKRGZ-OAHLLOKOSA-N 1 2 320.383 4.308 20 0 DIADLO CCc1nc(C[N@H+](C)C[C@H]2CCC3(CCCCCC3)O2)cs1 ZINC001473120870 1063425635 /nfs/dbraw/zinc/42/56/35/1063425635.db2.gz CBXDWBMPHCDBNB-MRXNPFEDSA-N 1 2 322.518 4.409 20 0 DIADLO CCc1nc(C[N@@H+](C)C[C@H]2CCC3(CCCCCC3)O2)cs1 ZINC001473120870 1063425649 /nfs/dbraw/zinc/42/56/49/1063425649.db2.gz CBXDWBMPHCDBNB-MRXNPFEDSA-N 1 2 322.518 4.409 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)s1 ZINC001461339194 1063427268 /nfs/dbraw/zinc/42/72/68/1063427268.db2.gz CZJONPFKZMODSG-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+](Cc1c(F)ccc(C)c1F)CC2 ZINC001473124663 1063427610 /nfs/dbraw/zinc/42/76/10/1063427610.db2.gz SLSHKELQOXUOFJ-UHFFFAOYSA-N 1 2 317.379 4.230 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+](Cc1c(F)ccc(C)c1F)CC2 ZINC001473124663 1063427619 /nfs/dbraw/zinc/42/76/19/1063427619.db2.gz SLSHKELQOXUOFJ-UHFFFAOYSA-N 1 2 317.379 4.230 20 0 DIADLO COc1ccc(CNc2ccc(N3CCCCC3)[nH+]c2)c(C)c1 ZINC001461373821 1063454552 /nfs/dbraw/zinc/45/45/52/1063454552.db2.gz UAXXQOVWQABSNS-UHFFFAOYSA-N 1 2 311.429 4.001 20 0 DIADLO Cc1ccc2cc(C[NH2+]Cc3c(F)cc(F)c(F)c3F)[nH]c2c1 ZINC001461487139 1063533547 /nfs/dbraw/zinc/53/35/47/1063533547.db2.gz TZNSKHSPWRSATF-UHFFFAOYSA-N 1 2 322.305 4.323 20 0 DIADLO Cc1cccc(C[NH2+][C@H](C)c2nccn2-c2ccccc2)c1F ZINC001461542895 1063570299 /nfs/dbraw/zinc/57/02/99/1063570299.db2.gz YDQJRMMMUCKKFA-OAHLLOKOSA-N 1 2 309.388 4.171 20 0 DIADLO Cc1cccc(C[NH2+][C@@H](C)c2nccn2-c2ccccc2)c1F ZINC001461542893 1063571847 /nfs/dbraw/zinc/57/18/47/1063571847.db2.gz YDQJRMMMUCKKFA-HNNXBMFYSA-N 1 2 309.388 4.171 20 0 DIADLO Cc1ccc(C[NH2+]Cc2n[nH]c3ccccc32)c2ccccc12 ZINC001461582330 1063592686 /nfs/dbraw/zinc/59/26/86/1063592686.db2.gz OHJYCOMWJXOICP-UHFFFAOYSA-N 1 2 301.393 4.314 20 0 DIADLO C[C@@H](CC(=O)N(C)c1ccc(-c2ccccc2)cc1)n1cc[nH+]c1 ZINC001514767361 1063610944 /nfs/dbraw/zinc/61/09/44/1063610944.db2.gz ASMCSCLTSLFASJ-INIZCTEOSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1ccc2oc(C[NH2+]Cc3cccc(O)c3Cl)cc2c1 ZINC001461642416 1063630357 /nfs/dbraw/zinc/63/03/57/1063630357.db2.gz OLLNEUGMTBCJFZ-UHFFFAOYSA-N 1 2 301.773 4.390 20 0 DIADLO COc1ccc(CC[C@@H](C)[N@@H+]2CCC[C@H](F)C(F)(F)C2)cc1 ZINC001258398251 1063637876 /nfs/dbraw/zinc/63/78/76/1063637876.db2.gz QYCJFWUPVNFHTO-CJNGLKHVSA-N 1 2 315.379 4.086 20 0 DIADLO COc1ccc(CC[C@@H](C)[N@H+]2CCC[C@H](F)C(F)(F)C2)cc1 ZINC001258398251 1063637881 /nfs/dbraw/zinc/63/78/81/1063637881.db2.gz QYCJFWUPVNFHTO-CJNGLKHVSA-N 1 2 315.379 4.086 20 0 DIADLO COc1ccc(CC[C@H](C)[N@@H+]2Cc3cnc(Cl)cc3C2)cc1 ZINC001258409802 1063642850 /nfs/dbraw/zinc/64/28/50/1063642850.db2.gz IBZSHBIVUSYBGA-ZDUSSCGKSA-N 1 2 316.832 4.081 20 0 DIADLO COc1ccc(CC[C@H](C)[N@H+]2Cc3cnc(Cl)cc3C2)cc1 ZINC001258409802 1063642858 /nfs/dbraw/zinc/64/28/58/1063642858.db2.gz IBZSHBIVUSYBGA-ZDUSSCGKSA-N 1 2 316.832 4.081 20 0 DIADLO CCCCC[C@H](CC)[N@H+]1Cc2nnc(C(F)(F)F)n2[C@@H](C)C1 ZINC001258443871 1063657434 /nfs/dbraw/zinc/65/74/34/1063657434.db2.gz PCWUTNZSMOSNEN-RYUDHWBXSA-N 1 2 318.387 4.032 20 0 DIADLO CCCCC[C@H](CC)[N@@H+]1Cc2nnc(C(F)(F)F)n2[C@@H](C)C1 ZINC001258443871 1063657439 /nfs/dbraw/zinc/65/74/39/1063657439.db2.gz PCWUTNZSMOSNEN-RYUDHWBXSA-N 1 2 318.387 4.032 20 0 DIADLO COc1ccc(NCc2cc(C)[nH+]c3c2CCCC3)c(F)c1 ZINC001461693338 1063659723 /nfs/dbraw/zinc/65/97/23/1063659723.db2.gz RVXCWQZGPWDKMV-UHFFFAOYSA-N 1 2 300.377 4.029 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cc(F)ccc1OC ZINC001461701000 1063667013 /nfs/dbraw/zinc/66/70/13/1063667013.db2.gz ATHCIFAQSWHNII-UHFFFAOYSA-N 1 2 306.406 4.095 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc(F)c(C(F)F)c3)n2c1 ZINC001461707116 1063671597 /nfs/dbraw/zinc/67/15/97/1063671597.db2.gz OVLREVSUQPPTFU-UHFFFAOYSA-N 1 2 305.303 4.332 20 0 DIADLO CC(C)Cc1ncc(C[NH2+][C@@H]2c3ccccc3CC[C@@H]2F)s1 ZINC001461707762 1063671897 /nfs/dbraw/zinc/67/18/97/1063671897.db2.gz COGYEEMQFZSEOW-FUHWJXTLSA-N 1 2 318.461 4.457 20 0 DIADLO Cc1ccc2[nH+]c(NCc3ccc(OCC(F)F)cc3)[nH]c2c1 ZINC001461710216 1063672587 /nfs/dbraw/zinc/67/25/87/1063672587.db2.gz PBUQBFYVBOYEOR-UHFFFAOYSA-N 1 2 317.339 4.127 20 0 DIADLO CNc1ccccc1CNc1[nH+]c2ccccc2n1C(C)(C)C ZINC001461724097 1063679161 /nfs/dbraw/zinc/67/91/61/1063679161.db2.gz XQSBEVHGFODYNV-UHFFFAOYSA-N 1 2 308.429 4.445 20 0 DIADLO Clc1ccc2[nH]c(NCc3ccn(-c4ccccc4)n3)[nH+]c2c1 ZINC001461730282 1063683435 /nfs/dbraw/zinc/68/34/35/1063683435.db2.gz GUJMFBZUAKYGDZ-UHFFFAOYSA-N 1 2 323.787 4.014 20 0 DIADLO Clc1ccc2[nH+]c(NCc3ccn(-c4ccccc4)n3)[nH]c2c1 ZINC001461730282 1063683444 /nfs/dbraw/zinc/68/34/44/1063683444.db2.gz GUJMFBZUAKYGDZ-UHFFFAOYSA-N 1 2 323.787 4.014 20 0 DIADLO COc1cc(C)ccc1CNc1[nH+]c2ccccc2n1C1CC1 ZINC001461729537 1063683915 /nfs/dbraw/zinc/68/39/15/1063683915.db2.gz NFFFMVXZXIKFPV-UHFFFAOYSA-N 1 2 307.397 4.300 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1ccsc1C(F)F ZINC001515863768 1063705172 /nfs/dbraw/zinc/70/51/72/1063705172.db2.gz DACHCKKKRFJSCE-UHFFFAOYSA-N 1 2 319.336 4.124 20 0 DIADLO CCC[C@H](Cc1ccccc1)[NH2+]C(C)(C)C(=O)OC(C)(C)C ZINC001258652229 1063723764 /nfs/dbraw/zinc/72/37/64/1063723764.db2.gz QKBRWFGSFUAIOS-MRXNPFEDSA-N 1 2 305.462 4.108 20 0 DIADLO CCCc1ccc(OC(=O)c2cccc(Cn3cc[nH+]c3)c2)cc1 ZINC001516335019 1063738249 /nfs/dbraw/zinc/73/82/49/1063738249.db2.gz LMLQPHHELYNFQU-UHFFFAOYSA-N 1 2 320.392 4.103 20 0 DIADLO CCOc1cc(C[N@@H+]2CC[C@H]2c2ccccc2)cc(Cl)c1O ZINC001461839553 1063743262 /nfs/dbraw/zinc/74/32/62/1063743262.db2.gz VUCPRMKHAPGDSI-INIZCTEOSA-N 1 2 317.816 4.391 20 0 DIADLO CCOc1cc(C[N@H+]2CC[C@H]2c2ccccc2)cc(Cl)c1O ZINC001461839553 1063743275 /nfs/dbraw/zinc/74/32/75/1063743275.db2.gz VUCPRMKHAPGDSI-INIZCTEOSA-N 1 2 317.816 4.391 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(O)c1Cl)c1cc(F)ccc1N(C)C ZINC001461835559 1063743525 /nfs/dbraw/zinc/74/35/25/1063743525.db2.gz NFRMMJPLRJZYJO-NSHDSACASA-N 1 2 322.811 4.102 20 0 DIADLO CCOc1cc(F)cc(C[N@@H+]2CC[C@H]2c2cccc(F)c2)c1 ZINC001461841633 1063746769 /nfs/dbraw/zinc/74/67/69/1063746769.db2.gz GYSHGAOZJKDKLH-SFHVURJKSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1cc(F)cc(C[N@H+]2CC[C@H]2c2cccc(F)c2)c1 ZINC001461841633 1063746781 /nfs/dbraw/zinc/74/67/81/1063746781.db2.gz GYSHGAOZJKDKLH-SFHVURJKSA-N 1 2 303.352 4.311 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)o1 ZINC001461874258 1063767293 /nfs/dbraw/zinc/76/72/93/1063767293.db2.gz PYARKBWCJFRMKG-UHFFFAOYSA-N 1 2 311.381 4.392 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)o1 ZINC001461874258 1063767306 /nfs/dbraw/zinc/76/73/06/1063767306.db2.gz PYARKBWCJFRMKG-UHFFFAOYSA-N 1 2 311.381 4.392 20 0 DIADLO COCC[N@H+](Cc1nc(Cl)cs1)Cc1ccc(C)cc1C ZINC001461892978 1063780479 /nfs/dbraw/zinc/78/04/79/1063780479.db2.gz ZAUNRROGIHMIMA-UHFFFAOYSA-N 1 2 324.877 4.062 20 0 DIADLO COCC[N@@H+](Cc1nc(Cl)cs1)Cc1ccc(C)cc1C ZINC001461892978 1063780491 /nfs/dbraw/zinc/78/04/91/1063780491.db2.gz ZAUNRROGIHMIMA-UHFFFAOYSA-N 1 2 324.877 4.062 20 0 DIADLO C[N@H+](Cc1nccn1C(F)F)Cc1cccc(CC2CCC2)c1 ZINC001461922360 1063805671 /nfs/dbraw/zinc/80/56/71/1063805671.db2.gz XCXYDLWSCSBKQF-UHFFFAOYSA-N 1 2 319.399 4.253 20 0 DIADLO C[N@@H+](Cc1nccn1C(F)F)Cc1cccc(CC2CCC2)c1 ZINC001461922360 1063805680 /nfs/dbraw/zinc/80/56/80/1063805680.db2.gz XCXYDLWSCSBKQF-UHFFFAOYSA-N 1 2 319.399 4.253 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2C[C@@H](C)OC[C@H]2c2ccccc2)cn1 ZINC001461920969 1063806370 /nfs/dbraw/zinc/80/63/70/1063806370.db2.gz HAQFGETZMFGZIP-UTKZUKDTSA-N 1 2 324.468 4.242 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2C[C@@H](C)OC[C@H]2c2ccccc2)cn1 ZINC001461920969 1063806383 /nfs/dbraw/zinc/80/63/83/1063806383.db2.gz HAQFGETZMFGZIP-UTKZUKDTSA-N 1 2 324.468 4.242 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)o1 ZINC001461936971 1063823266 /nfs/dbraw/zinc/82/32/66/1063823266.db2.gz SZUHNMFCPCACTR-WMLDXEAASA-N 1 2 317.454 4.272 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)o1 ZINC001461936971 1063823281 /nfs/dbraw/zinc/82/32/81/1063823281.db2.gz SZUHNMFCPCACTR-WMLDXEAASA-N 1 2 317.454 4.272 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)sn1 ZINC001461936955 1063823308 /nfs/dbraw/zinc/82/33/08/1063823308.db2.gz DIECNSCOABOIOV-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)sn1 ZINC001461936955 1063823322 /nfs/dbraw/zinc/82/33/22/1063823322.db2.gz DIECNSCOABOIOV-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1ccc(-c2nnc(-c3ccc(-n4cc[nH+]c4)cc3)o2)cc1F ZINC001258786615 1063826819 /nfs/dbraw/zinc/82/68/19/1063826819.db2.gz ZQHGGPGAGWNYKQ-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO C[C@@H]1c2c(F)cccc2CC[N@H+]1Cc1ccnn1-c1ccccc1 ZINC001461959513 1063843094 /nfs/dbraw/zinc/84/30/94/1063843094.db2.gz IFZHGAITVNURTM-OAHLLOKOSA-N 1 2 321.399 4.131 20 0 DIADLO C[C@@H]1c2c(F)cccc2CC[N@@H+]1Cc1ccnn1-c1ccccc1 ZINC001461959513 1063843110 /nfs/dbraw/zinc/84/31/10/1063843110.db2.gz IFZHGAITVNURTM-OAHLLOKOSA-N 1 2 321.399 4.131 20 0 DIADLO C[C@@H]1CCC[C@@H]([N@@H+]2CCCC[C@@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258824759 1063849504 /nfs/dbraw/zinc/84/95/04/1063849504.db2.gz XAWJXVJYQXAQJJ-IJLUTSLNSA-N 1 2 317.355 4.194 20 0 DIADLO C[C@@H]1CCC[C@@H]([N@H+]2CCCC[C@@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258824759 1063849513 /nfs/dbraw/zinc/84/95/13/1063849513.db2.gz XAWJXVJYQXAQJJ-IJLUTSLNSA-N 1 2 317.355 4.194 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2nn(C)cc2Cl)cc1 ZINC001461987212 1063858620 /nfs/dbraw/zinc/85/86/20/1063858620.db2.gz IRJPDZAVMXQGHF-QGZVFWFLSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2nn(C)cc2Cl)cc1 ZINC001461987212 1063858630 /nfs/dbraw/zinc/85/86/30/1063858630.db2.gz IRJPDZAVMXQGHF-QGZVFWFLSA-N 1 2 303.837 4.109 20 0 DIADLO O=C(c1cccs1)C1CC[NH+](Cc2cccn2C(F)F)CC1 ZINC001461985066 1063860168 /nfs/dbraw/zinc/86/01/68/1063860168.db2.gz YJDQPZPKFODZFS-UHFFFAOYSA-N 1 2 324.396 4.040 20 0 DIADLO C[C@]1(CNc2cccc(-n3cc[nH+]c3)c2)C[C@@H]1c1ccccc1 ZINC001461989420 1063861918 /nfs/dbraw/zinc/86/19/18/1063861918.db2.gz SELQFAWHXREBGN-WOJBJXKFSA-N 1 2 303.409 4.478 20 0 DIADLO c1coc(C[N@H+](Cc2ccccc2)Cc2ccc3c(n2)CCC3)c1 ZINC001462005980 1063875681 /nfs/dbraw/zinc/87/56/81/1063875681.db2.gz RQKQMUGNWZOJLK-UHFFFAOYSA-N 1 2 318.420 4.366 20 0 DIADLO c1coc(C[N@@H+](Cc2ccccc2)Cc2ccc3c(n2)CCC3)c1 ZINC001462005980 1063875688 /nfs/dbraw/zinc/87/56/88/1063875688.db2.gz RQKQMUGNWZOJLK-UHFFFAOYSA-N 1 2 318.420 4.366 20 0 DIADLO COc1nccc(C[N@H+](C)[C@@H](C)c2cccc(Cl)c2)c1F ZINC001462013383 1063877944 /nfs/dbraw/zinc/87/79/44/1063877944.db2.gz IWBQTHSSMXYGMD-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1nccc(C[N@@H+](C)[C@@H](C)c2cccc(Cl)c2)c1F ZINC001462013383 1063877955 /nfs/dbraw/zinc/87/79/55/1063877955.db2.gz IWBQTHSSMXYGMD-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO Cc1ccccc1C[N@H+](Cc1ccc(O)c(F)c1F)C1CC1 ZINC001462043714 1063898693 /nfs/dbraw/zinc/89/86/93/1063898693.db2.gz HCZIRFOZSNUTGY-UHFFFAOYSA-N 1 2 303.352 4.143 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2[nH]ncc2C)c2cccc(F)c2)cc1 ZINC001261205506 1063912152 /nfs/dbraw/zinc/91/21/52/1063912152.db2.gz FCWAIZSSBDRZKK-HXUWFJFHSA-N 1 2 323.415 4.299 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2n[nH]cc2C)c2cccc(F)c2)cc1 ZINC001261205506 1063912155 /nfs/dbraw/zinc/91/21/55/1063912155.db2.gz FCWAIZSSBDRZKK-HXUWFJFHSA-N 1 2 323.415 4.299 20 0 DIADLO Cc1cc(CN2CCc3ccc(Cl)cc32)c2c([nH+]1)CCCC2 ZINC001462071326 1063913456 /nfs/dbraw/zinc/91/34/56/1063913456.db2.gz GXKGDYOICPTLGJ-UHFFFAOYSA-N 1 2 312.844 4.485 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2c(F)c(F)c(F)c(F)c2F)c(C)o1 ZINC001261256732 1063916456 /nfs/dbraw/zinc/91/64/56/1063916456.db2.gz RRJXBDMQWTUZAV-ZETCQYMHSA-N 1 2 319.273 4.443 20 0 DIADLO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(F)c(F)c1F ZINC001462089113 1063922599 /nfs/dbraw/zinc/92/25/99/1063922599.db2.gz BZFKYBHXBCLHQC-SNVBAGLBSA-N 1 2 311.269 4.267 20 0 DIADLO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc(F)c(F)c1F ZINC001462089113 1063922609 /nfs/dbraw/zinc/92/26/09/1063922609.db2.gz BZFKYBHXBCLHQC-SNVBAGLBSA-N 1 2 311.269 4.267 20 0 DIADLO CC(C)Oc1ccc[nH+]c1N[C@@H]1CCc2cccc(Cl)c2C1 ZINC001462101102 1063929371 /nfs/dbraw/zinc/92/93/71/1063929371.db2.gz CNTIXJOBLILPCJ-CQSZACIVSA-N 1 2 316.832 4.492 20 0 DIADLO COc1ccc([C@H](C)[C@@H](C)Nc2[nH+]cccc2OC(C)C)cc1 ZINC001462107552 1063932301 /nfs/dbraw/zinc/93/23/01/1063932301.db2.gz WCAUZCNMQXXOCI-HUUCEWRRSA-N 1 2 314.429 4.482 20 0 DIADLO CC(C)Oc1ccc[nH+]c1N[C@@H](C)CCc1ccccc1F ZINC001462106477 1063932805 /nfs/dbraw/zinc/93/28/05/1063932805.db2.gz RBUJJKNQBAQOBB-AWEZNQCLSA-N 1 2 302.393 4.441 20 0 DIADLO CCCCC[C@@H]([NH2+]C1CC(c2ccc(Cl)cc2)C1)C(=O)OC ZINC001462116583 1063935586 /nfs/dbraw/zinc/93/55/86/1063935586.db2.gz XABYIBKCNVCARJ-BDVYOWHSSA-N 1 2 323.864 4.298 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2ccc(CC(C)C)nc2)cs1 ZINC001462116527 1063935852 /nfs/dbraw/zinc/93/58/52/1063935852.db2.gz MMARHSBFDRYTEZ-GOSISDBHSA-N 1 2 315.486 4.382 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2ccc(CC(C)C)nc2)cs1 ZINC001462116527 1063935861 /nfs/dbraw/zinc/93/58/61/1063935861.db2.gz MMARHSBFDRYTEZ-GOSISDBHSA-N 1 2 315.486 4.382 20 0 DIADLO CCCCC[C@@H]([NH2+]C[C@@H](C)c1cccc(Cl)c1)C(=O)OC ZINC001462117990 1063937550 /nfs/dbraw/zinc/93/75/50/1063937550.db2.gz ZMAOFNKIWMNVEI-CZUORRHYSA-N 1 2 311.853 4.155 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(Cl)cs1)c1cc(F)ccc1OC ZINC001262375465 1063964997 /nfs/dbraw/zinc/96/49/97/1063964997.db2.gz LJCBJVCWEWKSKR-NSHDSACASA-N 1 2 314.813 4.185 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(F)(F)F)n(C)n1)c1ccc(Cl)s1 ZINC001262479411 1063965723 /nfs/dbraw/zinc/96/57/23/1063965723.db2.gz AFVCGAWUIXHUQJ-ZETCQYMHSA-N 1 2 323.771 4.005 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1ccc(Br)cc1C#N ZINC000381143316 1063990436 /nfs/dbraw/zinc/99/04/36/1063990436.db2.gz GBTVVLGEIHHNTM-OAHLLOKOSA-N 1 2 307.235 4.085 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1ccc(Br)cc1C#N ZINC000381143316 1063990442 /nfs/dbraw/zinc/99/04/42/1063990442.db2.gz GBTVVLGEIHHNTM-OAHLLOKOSA-N 1 2 307.235 4.085 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1ccc(Br)cc1C#N ZINC000381143311 1063991163 /nfs/dbraw/zinc/99/11/63/1063991163.db2.gz GBTVVLGEIHHNTM-HNNXBMFYSA-N 1 2 307.235 4.085 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1ccc(Br)cc1C#N ZINC000381143311 1063991170 /nfs/dbraw/zinc/99/11/70/1063991170.db2.gz GBTVVLGEIHHNTM-HNNXBMFYSA-N 1 2 307.235 4.085 20 0 DIADLO Cc1cc(C)c(NC(=O)CCC(=O)c2ccc(C)c(C)c2)c(C)[nH+]1 ZINC001264804003 1064138475 /nfs/dbraw/zinc/13/84/75/1064138475.db2.gz MPZCIADPMSXPJW-UHFFFAOYSA-N 1 2 324.424 4.225 20 0 DIADLO C[C@@H]1CC[C@H](CC(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1 ZINC001264831235 1064144975 /nfs/dbraw/zinc/14/49/75/1064144975.db2.gz PEUPWZCSTDOYPD-OLZOCXBDSA-N 1 2 317.820 4.291 20 0 DIADLO CC[C@H](C(=O)Nc1ccc2[nH+]c(C)cn2c1)C1CCC(C)CC1 ZINC001264857953 1064151185 /nfs/dbraw/zinc/15/11/85/1064151185.db2.gz ODBXHCZSFKVJOX-PGEKIEPBSA-N 1 2 313.445 4.434 20 0 DIADLO Cc1cn2cc(NC(=O)/C=C\c3cc(C)c(C)cc3C)ccc2[nH+]1 ZINC001264857686 1064151915 /nfs/dbraw/zinc/15/19/15/1064151915.db2.gz FGXOOLPYTVHBAU-YVMONPNESA-N 1 2 319.408 4.220 20 0 DIADLO CCc1onc(C)c1C[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC001332885027 1064414860 /nfs/dbraw/zinc/41/48/60/1064414860.db2.gz NSIIDJCZFBLTLH-NSHDSACASA-N 1 2 307.463 4.150 20 0 DIADLO C[C@@H](CC(=O)N1CCC(CC2CCCCC2)CC1)n1cc[nH+]c1 ZINC001289342598 1064617399 /nfs/dbraw/zinc/61/73/99/1064617399.db2.gz WNZSUKXYLQKZBP-INIZCTEOSA-N 1 2 317.477 4.043 20 0 DIADLO CC(C)=CCC[C@@H](C)CC(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC001292058546 1064756890 /nfs/dbraw/zinc/75/68/90/1064756890.db2.gz JGJHBXQTDDYCCH-SJORKVTESA-N 1 2 319.493 4.187 20 0 DIADLO CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001292764512 1064786815 /nfs/dbraw/zinc/78/68/15/1064786815.db2.gz BHMBCCXIQZQEME-BZSNNMDCSA-N 1 2 319.493 4.191 20 0 DIADLO CC(=CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1)c1cccc(F)c1 ZINC001294769471 1064884101 /nfs/dbraw/zinc/88/41/01/1064884101.db2.gz VFSWHHOFJYGEKN-FLIBITNWSA-N 1 2 309.344 4.052 20 0 DIADLO CC[C@@H](Cc1cccc(C)c1)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC001294769452 1064884575 /nfs/dbraw/zinc/88/45/75/1064884575.db2.gz ULSRUWJTMFNQNE-INIZCTEOSA-N 1 2 321.424 4.387 20 0 DIADLO CCc1[nH]c(CNc2nc3cc(Cl)cc(Cl)c3o2)c[nH+]1 ZINC001307219072 1064963606 /nfs/dbraw/zinc/96/36/06/1064963606.db2.gz KZKQZRLVLDKDDS-UHFFFAOYSA-N 1 2 311.172 4.032 20 0 DIADLO CCc1[nH]cc(CNc2nc3cc(Cl)cc(Cl)c3o2)[nH+]1 ZINC001307219072 1064963619 /nfs/dbraw/zinc/96/36/19/1064963619.db2.gz KZKQZRLVLDKDDS-UHFFFAOYSA-N 1 2 311.172 4.032 20 0 DIADLO CCCC[C@H](CC)CCCN(C)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC001301079346 1065052059 /nfs/dbraw/zinc/05/20/59/1065052059.db2.gz DIOAAGXBIJBRPF-HNNXBMFYSA-N 1 2 307.482 4.142 20 0 DIADLO CCC[C@@H](C)CCNC(=O)C[N@H+](CC)Cc1ccccc1Cl ZINC001303150784 1065109800 /nfs/dbraw/zinc/10/98/00/1065109800.db2.gz PLGZAYJYFANRKS-OAHLLOKOSA-N 1 2 324.896 4.104 20 0 DIADLO CCC[C@@H](C)CCNC(=O)C[N@@H+](CC)Cc1ccccc1Cl ZINC001303150784 1065109809 /nfs/dbraw/zinc/10/98/09/1065109809.db2.gz PLGZAYJYFANRKS-OAHLLOKOSA-N 1 2 324.896 4.104 20 0 DIADLO CCCC[C@@H](C(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1)C(C)C ZINC001303607714 1065119025 /nfs/dbraw/zinc/11/90/25/1065119025.db2.gz BDAAXXYJAFHBSW-CVEARBPZSA-N 1 2 305.466 4.152 20 0 DIADLO CC[C@H](Cc1ccc(C)cc1)N(C)c1cc(C)[nH+]c(C2CC2)n1 ZINC001306977663 1065232975 /nfs/dbraw/zinc/23/29/75/1065232975.db2.gz BKSMBMJBTABNKJ-GOSISDBHSA-N 1 2 309.457 4.428 20 0 DIADLO Cc1cc(N2Cc3ccccc3C(F)(F)C2)nc(C2CCC2)[nH+]1 ZINC001307076041 1065250381 /nfs/dbraw/zinc/25/03/81/1065250381.db2.gz ZMSYCSBYMPYGDC-UHFFFAOYSA-N 1 2 315.367 4.165 20 0 DIADLO Cc1nc2c(s1)[C@H](Nc1cc(C)[nH+]c(C3CCC3)n1)CCC2 ZINC001307081227 1065253416 /nfs/dbraw/zinc/25/34/16/1065253416.db2.gz NMMHAVANPIJKDJ-CQSZACIVSA-N 1 2 314.458 4.307 20 0 DIADLO CCOc1cccc([C@@H]2C[C@H]2Nc2nc(C)[nH+]c3c2CCCC3)c1 ZINC001307105971 1065265962 /nfs/dbraw/zinc/26/59/62/1065265962.db2.gz KMFJLBUKBAYBAS-PKOBYXMFSA-N 1 2 323.440 4.031 20 0 DIADLO Cc1cc(N2CCc3ccccc3[C@H]2C(C)C)nc(C2CC2)[nH+]1 ZINC001307121780 1065271822 /nfs/dbraw/zinc/27/18/22/1065271822.db2.gz SXAMXDMUASUJHB-LJQANCHMSA-N 1 2 307.441 4.422 20 0 DIADLO CC(C)c1cc(NC[C@H]2Cc3ccccc3O2)nc(C(C)C)[nH+]1 ZINC001307120670 1065272510 /nfs/dbraw/zinc/27/25/10/1065272510.db2.gz RVFIMJZRJLCYAQ-OAHLLOKOSA-N 1 2 311.429 4.139 20 0 DIADLO Cc1cc(N2[C@H](C)C[C@@H](c3ccccc3)[C@H]2C)nc(C2CC2)[nH+]1 ZINC001307129323 1065276092 /nfs/dbraw/zinc/27/60/92/1065276092.db2.gz ZBCZKECZNSQXSM-IIDMSEBBSA-N 1 2 307.441 4.433 20 0 DIADLO CCc1cc(N(C)[C@H]2CCC[C@@H]2c2ccccc2)nc(CC)[nH+]1 ZINC001307138013 1065279899 /nfs/dbraw/zinc/27/98/99/1065279899.db2.gz BVXGDSCRYWOBRS-MSOLQXFVSA-N 1 2 309.457 4.374 20 0 DIADLO Cc1nc(N(C)[C@H]2CCC[C@@H]2c2ccccc2)c2c([nH+]1)CCCC2 ZINC001307139907 1065281168 /nfs/dbraw/zinc/28/11/68/1065281168.db2.gz PTSKTFUZHWGPHX-XLIONFOSSA-N 1 2 321.468 4.436 20 0 DIADLO CO[C@@](C)([C@@H](C)Nc1cc(C(C)C)[nH+]c(C(C)C)n1)C1CC1 ZINC001307143033 1065283126 /nfs/dbraw/zinc/28/31/26/1065283126.db2.gz WJWFIYBXEZXSHP-ACJLOTCBSA-N 1 2 305.466 4.339 20 0 DIADLO Cc1cc(N2CCc3ccccc3C(C)(C)C2)nc(C2CCC2)[nH+]1 ZINC001307165099 1065290553 /nfs/dbraw/zinc/29/05/53/1065290553.db2.gz ZNPUUNUEZFOZFN-UHFFFAOYSA-N 1 2 321.468 4.393 20 0 DIADLO CCc1cc(NCc2ccnc(-c3ccccc3)c2)nc(CC)[nH+]1 ZINC001307180222 1065295067 /nfs/dbraw/zinc/29/50/67/1065295067.db2.gz SGDHMZNYOFPCMD-UHFFFAOYSA-N 1 2 318.424 4.276 20 0 DIADLO Cc1nc(N[C@H]2CCCc3c4cc(Cl)ccc4[nH]c32)cc[nH+]1 ZINC001307183607 1065296469 /nfs/dbraw/zinc/29/64/69/1065296469.db2.gz SAHJSVUVWZZVQE-HNNXBMFYSA-N 1 2 312.804 4.409 20 0 DIADLO CC(C)c1cc(NCCN2CCc3ccccc32)nc(C(C)C)[nH+]1 ZINC001307205874 1065302424 /nfs/dbraw/zinc/30/24/24/1065302424.db2.gz YCEWVZIINLOPLU-UHFFFAOYSA-N 1 2 324.472 4.198 20 0 DIADLO CCOc1ccc(-c2nc(Cn3c[nH+]c(CC)c3)cs2)cc1 ZINC001307397000 1065367416 /nfs/dbraw/zinc/36/74/16/1065367416.db2.gz CFWUPNMKPNFYRL-UHFFFAOYSA-N 1 2 313.426 4.016 20 0 DIADLO C[N@@H+](Cc1csc2ccccc12)Cc1nc2c(o1)CCCC2 ZINC001307414744 1065377891 /nfs/dbraw/zinc/37/78/91/1065377891.db2.gz WGZGDINAFZLDDN-UHFFFAOYSA-N 1 2 312.438 4.400 20 0 DIADLO C[N@H+](Cc1csc2ccccc12)Cc1nc2c(o1)CCCC2 ZINC001307414744 1065377905 /nfs/dbraw/zinc/37/79/05/1065377905.db2.gz WGZGDINAFZLDDN-UHFFFAOYSA-N 1 2 312.438 4.400 20 0 DIADLO CCc1nnc([C@H](C)[N@H+](CC)Cc2ccc3ccccc3c2)[nH]1 ZINC001307429856 1065390504 /nfs/dbraw/zinc/39/05/04/1065390504.db2.gz XNFCHZFQRMDGED-AWEZNQCLSA-N 1 2 308.429 4.103 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+](CC)Cc2ccc3ccccc3c2)[nH]1 ZINC001307429856 1065390509 /nfs/dbraw/zinc/39/05/09/1065390509.db2.gz XNFCHZFQRMDGED-AWEZNQCLSA-N 1 2 308.429 4.103 20 0 DIADLO CC[N@H+](Cc1ccc(F)cc1F)Cc1ccc(OC)cc1OC ZINC001307434845 1065392487 /nfs/dbraw/zinc/39/24/87/1065392487.db2.gz YXWVPSWJLCIUKX-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1ccc(F)cc1F)Cc1ccc(OC)cc1OC ZINC001307434845 1065392496 /nfs/dbraw/zinc/39/24/96/1065392496.db2.gz YXWVPSWJLCIUKX-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+](Cc1cc(O)ccc1Cl)CC2 ZINC001307434318 1065393452 /nfs/dbraw/zinc/39/34/52/1065393452.db2.gz VDAYKWWADFZUTP-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+](Cc1cc(O)ccc1Cl)CC2 ZINC001307434318 1065393459 /nfs/dbraw/zinc/39/34/59/1065393459.db2.gz VDAYKWWADFZUTP-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCC[N@H+](C/C=C\Cl)Cc1ccccc1Br ZINC001307437214 1065396546 /nfs/dbraw/zinc/39/65/46/1065396546.db2.gz DIWONFIBTANTRU-YVMONPNESA-N 1 2 302.643 4.414 20 0 DIADLO CCC[N@@H+](C/C=C\Cl)Cc1ccccc1Br ZINC001307437214 1065396561 /nfs/dbraw/zinc/39/65/61/1065396561.db2.gz DIWONFIBTANTRU-YVMONPNESA-N 1 2 302.643 4.414 20 0 DIADLO CC(C)c1nc([C@H]2CCCC[N@@H+]2CCCCOC(C)(C)C)no1 ZINC001307510821 1065450832 /nfs/dbraw/zinc/45/08/32/1065450832.db2.gz OBKQPBATWYJTRI-OAHLLOKOSA-N 1 2 323.481 4.315 20 0 DIADLO CC(C)c1nc([C@H]2CCCC[N@H+]2CCCCOC(C)(C)C)no1 ZINC001307510821 1065450838 /nfs/dbraw/zinc/45/08/38/1065450838.db2.gz OBKQPBATWYJTRI-OAHLLOKOSA-N 1 2 323.481 4.315 20 0 DIADLO CC(C)CN(Cc1ccc(-n2cc[nH+]c2)cc1)c1cccc(O)c1 ZINC001307507320 1065451392 /nfs/dbraw/zinc/45/13/92/1065451392.db2.gz JOAMXSFWKNCEPY-UHFFFAOYSA-N 1 2 321.424 4.241 20 0 DIADLO CCCC1CC[NH+](CC(=O)Nc2ccc(C)cc2Cl)CC1 ZINC001307508270 1065451513 /nfs/dbraw/zinc/45/15/13/1065451513.db2.gz GYOAYVOZKKMHNT-UHFFFAOYSA-N 1 2 308.853 4.099 20 0 DIADLO CCc1ccc(CC[NH2+]C2(C(=O)OC(C)(C)C)CCCC2)cc1 ZINC001307543784 1065474241 /nfs/dbraw/zinc/47/42/41/1065474241.db2.gz DOKXXLQPGKMQQY-UHFFFAOYSA-N 1 2 317.473 4.036 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1noc2c1CC(C)(C)CC2 ZINC001307551608 1065478394 /nfs/dbraw/zinc/47/83/94/1065478394.db2.gz JXHOICGNCGVNNG-ZDUSSCGKSA-N 1 2 314.429 4.088 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1noc2c1CC(C)(C)CC2 ZINC001307551608 1065478400 /nfs/dbraw/zinc/47/84/00/1065478400.db2.gz JXHOICGNCGVNNG-ZDUSSCGKSA-N 1 2 314.429 4.088 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+]1CCc2c(F)cc(F)cc2C1 ZINC001307598802 1065506320 /nfs/dbraw/zinc/50/63/20/1065506320.db2.gz BLZWKRPGYYBAHD-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+]1CCc2c(F)cc(F)cc2C1 ZINC001307598802 1065506336 /nfs/dbraw/zinc/50/63/36/1065506336.db2.gz BLZWKRPGYYBAHD-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO CCNc1nc(C[NH2+][C@H](C)c2ccccc2OC(C)C)cs1 ZINC001307632130 1065530983 /nfs/dbraw/zinc/53/09/83/1065530983.db2.gz UOYQDPVJWLDTSN-CYBMUJFWSA-N 1 2 319.474 4.213 20 0 DIADLO C[N@H+](Cc1ccccc1F)[C@]1(c2ccccc2)CCCCC1=O ZINC001307689899 1065564075 /nfs/dbraw/zinc/56/40/75/1065564075.db2.gz OWMLELDTHIBICN-FQEVSTJZSA-N 1 2 311.400 4.296 20 0 DIADLO C[N@@H+](Cc1ccccc1F)[C@]1(c2ccccc2)CCCCC1=O ZINC001307689899 1065564084 /nfs/dbraw/zinc/56/40/84/1065564084.db2.gz OWMLELDTHIBICN-FQEVSTJZSA-N 1 2 311.400 4.296 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+]([C@H]3C=CCCCCC3)CCO2)c(F)c1 ZINC001307699775 1065570280 /nfs/dbraw/zinc/57/02/80/1065570280.db2.gz HKHICPLJSOQAHY-MAUKXSAKSA-N 1 2 307.384 4.227 20 0 DIADLO Fc1ccc([C@H]2C[N@H+]([C@H]3C=CCCCCC3)CCO2)c(F)c1 ZINC001307699775 1065570292 /nfs/dbraw/zinc/57/02/92/1065570292.db2.gz HKHICPLJSOQAHY-MAUKXSAKSA-N 1 2 307.384 4.227 20 0 DIADLO C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+](C)CC(=O)OC(C)(C)C ZINC001307723524 1065585747 /nfs/dbraw/zinc/58/57/47/1065585747.db2.gz KEPZDRHVHOECTG-CQSZACIVSA-N 1 2 305.462 4.319 20 0 DIADLO C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+](C)CC(=O)OC(C)(C)C ZINC001307723524 1065585756 /nfs/dbraw/zinc/58/57/56/1065585756.db2.gz KEPZDRHVHOECTG-CQSZACIVSA-N 1 2 305.462 4.319 20 0 DIADLO Cc1ccc2ncc(C[N@@H+]3CCC=C(Br)C3)cc2c1 ZINC001307721561 1065587133 /nfs/dbraw/zinc/58/71/33/1065587133.db2.gz JMKJZBFKURALHP-UHFFFAOYSA-N 1 2 317.230 4.028 20 0 DIADLO Cc1ccc2ncc(C[N@H+]3CCC=C(Br)C3)cc2c1 ZINC001307721561 1065587146 /nfs/dbraw/zinc/58/71/46/1065587146.db2.gz JMKJZBFKURALHP-UHFFFAOYSA-N 1 2 317.230 4.028 20 0 DIADLO CC1=CCC[N@H+](Cc2cccc(Br)c2Cl)C1 ZINC001307725383 1065587783 /nfs/dbraw/zinc/58/77/83/1065587783.db2.gz VXNAHRGRGJDMOH-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO CC1=CCC[N@@H+](Cc2cccc(Br)c2Cl)C1 ZINC001307725383 1065587791 /nfs/dbraw/zinc/58/77/91/1065587791.db2.gz VXNAHRGRGJDMOH-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC001307742163 1065599516 /nfs/dbraw/zinc/59/95/16/1065599516.db2.gz XSGPCJNAMSPQCC-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+]1CCOC2(CCCCC2)C1 ZINC001307742163 1065599526 /nfs/dbraw/zinc/59/95/26/1065599526.db2.gz XSGPCJNAMSPQCC-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO Clc1cccc(Cl)c1C[N@H+](CCOCC1CC1)C1CC1 ZINC001307747174 1065602465 /nfs/dbraw/zinc/60/24/65/1065602465.db2.gz KHAVAVJRADZQNH-UHFFFAOYSA-N 1 2 314.256 4.384 20 0 DIADLO Clc1cccc(Cl)c1C[N@@H+](CCOCC1CC1)C1CC1 ZINC001307747174 1065602471 /nfs/dbraw/zinc/60/24/71/1065602471.db2.gz KHAVAVJRADZQNH-UHFFFAOYSA-N 1 2 314.256 4.384 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@@H+](CCOC1CCCCC1)CC2 ZINC001307805561 1065629292 /nfs/dbraw/zinc/62/92/92/1065629292.db2.gz JWGDFOSSELXBKP-UHFFFAOYSA-N 1 2 311.828 4.187 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@H+](CCOC1CCCCC1)CC2 ZINC001307805561 1065629296 /nfs/dbraw/zinc/62/92/96/1065629296.db2.gz JWGDFOSSELXBKP-UHFFFAOYSA-N 1 2 311.828 4.187 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@@H+](CCOCc1ccccc1)CC2 ZINC001307805308 1065630089 /nfs/dbraw/zinc/63/00/89/1065630089.db2.gz ILLNCZCWXIOTBD-UHFFFAOYSA-N 1 2 319.807 4.054 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@H+](CCOCc1ccccc1)CC2 ZINC001307805308 1065630096 /nfs/dbraw/zinc/63/00/96/1065630096.db2.gz ILLNCZCWXIOTBD-UHFFFAOYSA-N 1 2 319.807 4.054 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2Cc3ccccc3OC(C)(C)C2)c1F ZINC001307814742 1065635813 /nfs/dbraw/zinc/63/58/13/1065635813.db2.gz XJUHYMYERZQDIT-UHFFFAOYSA-N 1 2 317.379 4.446 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2Cc3ccccc3OC(C)(C)C2)c1F ZINC001307814742 1065635818 /nfs/dbraw/zinc/63/58/18/1065635818.db2.gz XJUHYMYERZQDIT-UHFFFAOYSA-N 1 2 317.379 4.446 20 0 DIADLO Cc1c(Cl)cc2c(c1Cl)CCCN2CCCn1cc[nH+]c1 ZINC001307835444 1065645972 /nfs/dbraw/zinc/64/59/72/1065645972.db2.gz OIHJXDIFKVGNEI-UHFFFAOYSA-N 1 2 324.255 4.341 20 0 DIADLO C[C@H]1C[N@H+](CCc2cc(Cl)cc(Cl)c2)C2(CCC2)CO1 ZINC001307902476 1065673588 /nfs/dbraw/zinc/67/35/88/1065673588.db2.gz VIQXFGOUFXXNCN-LBPRGKRZSA-N 1 2 314.256 4.179 20 0 DIADLO C[C@H]1C[N@@H+](CCc2cc(Cl)cc(Cl)c2)C2(CCC2)CO1 ZINC001307902476 1065673592 /nfs/dbraw/zinc/67/35/92/1065673592.db2.gz VIQXFGOUFXXNCN-LBPRGKRZSA-N 1 2 314.256 4.179 20 0 DIADLO COC/C(C)=C/C[N@@H+]1C[C@@H](c2cccc(Cl)c2)OCC1(C)C ZINC001307935032 1065688054 /nfs/dbraw/zinc/68/80/54/1065688054.db2.gz QLBHWXWJAOUQRA-AAKUMTKESA-N 1 2 323.864 4.085 20 0 DIADLO COC/C(C)=C/C[N@H+]1C[C@@H](c2cccc(Cl)c2)OCC1(C)C ZINC001307935032 1065688062 /nfs/dbraw/zinc/68/80/62/1065688062.db2.gz QLBHWXWJAOUQRA-AAKUMTKESA-N 1 2 323.864 4.085 20 0 DIADLO COC/C(C)=C\C[N@@H+]1C[C@H](c2cccc(Cl)c2)OCC1(C)C ZINC001307935035 1065688894 /nfs/dbraw/zinc/68/88/94/1065688894.db2.gz QLBHWXWJAOUQRA-XMCSSRMMSA-N 1 2 323.864 4.085 20 0 DIADLO COC/C(C)=C\C[N@H+]1C[C@H](c2cccc(Cl)c2)OCC1(C)C ZINC001307935035 1065688896 /nfs/dbraw/zinc/68/88/96/1065688896.db2.gz QLBHWXWJAOUQRA-XMCSSRMMSA-N 1 2 323.864 4.085 20 0 DIADLO CC(C)(C)OC(=O)[C@H]1c2ccccc2CC[N@@H+]1[C@H]1C=CCCC1 ZINC001307947577 1065695717 /nfs/dbraw/zinc/69/57/17/1065695717.db2.gz MLDPJHMTUSTESL-FUHWJXTLSA-N 1 2 313.441 4.036 20 0 DIADLO CC(C)(C)OC(=O)[C@H]1c2ccccc2CC[N@H+]1[C@H]1C=CCCC1 ZINC001307947577 1065695722 /nfs/dbraw/zinc/69/57/22/1065695722.db2.gz MLDPJHMTUSTESL-FUHWJXTLSA-N 1 2 313.441 4.036 20 0 DIADLO CC(C)CCO[C@@H]1CC[N@H+](Cc2csc(CCC(C)C)n2)C1 ZINC001307967871 1065703650 /nfs/dbraw/zinc/70/36/50/1065703650.db2.gz GCLCDIQLQQXMSU-QGZVFWFLSA-N 1 2 324.534 4.369 20 0 DIADLO CC(C)CCO[C@@H]1CC[N@@H+](Cc2csc(CCC(C)C)n2)C1 ZINC001307967871 1065703663 /nfs/dbraw/zinc/70/36/63/1065703663.db2.gz GCLCDIQLQQXMSU-QGZVFWFLSA-N 1 2 324.534 4.369 20 0 DIADLO Cc1cc(Cl)ccc1C1=CC[N@H+]([C@@H](C)c2ncccn2)CC1 ZINC001307981118 1065712320 /nfs/dbraw/zinc/71/23/20/1065712320.db2.gz RDYYVKBFYVHCNQ-AWEZNQCLSA-N 1 2 313.832 4.289 20 0 DIADLO Cc1cc(Cl)ccc1C1=CC[N@@H+]([C@@H](C)c2ncccn2)CC1 ZINC001307981118 1065712335 /nfs/dbraw/zinc/71/23/35/1065712335.db2.gz RDYYVKBFYVHCNQ-AWEZNQCLSA-N 1 2 313.832 4.289 20 0 DIADLO CC(C)(C)OCCC[NH+]1CCN(CCC2CCCCCC2)CC1 ZINC001308032473 1065734318 /nfs/dbraw/zinc/73/43/18/1065734318.db2.gz FDZCKPZZNAUUSL-UHFFFAOYSA-N 1 2 324.553 4.170 20 0 DIADLO Cc1nc(C2CC[NH+](Cc3ccc(F)c(Cl)c3)CC2)[nH]c1C ZINC001308082363 1065754031 /nfs/dbraw/zinc/75/40/31/1065754031.db2.gz BVWXVBLHUWWBOR-UHFFFAOYSA-N 1 2 321.827 4.199 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@H+](Cc2ccoc2)C2CC2)c1 ZINC001308107424 1065764832 /nfs/dbraw/zinc/76/48/32/1065764832.db2.gz QAVIFWAPGQKJRZ-UHFFFAOYSA-N 1 2 311.303 4.185 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@@H+](Cc2ccoc2)C2CC2)c1 ZINC001308107424 1065764837 /nfs/dbraw/zinc/76/48/37/1065764837.db2.gz QAVIFWAPGQKJRZ-UHFFFAOYSA-N 1 2 311.303 4.185 20 0 DIADLO COc1ccccc1C[NH2+]Cc1nc(-c2cccs2)oc1C ZINC001308181099 1065790927 /nfs/dbraw/zinc/79/09/27/1065790927.db2.gz YPYRXKSYTYMKJJ-UHFFFAOYSA-N 1 2 314.410 4.010 20 0 DIADLO CCc1ccc([C@H](CNCc2cccc(C)c2F)[NH+](C)C)cc1 ZINC001308182846 1065794263 /nfs/dbraw/zinc/79/42/63/1065794263.db2.gz XFWDVYIZVCBFCK-IBGZPJMESA-N 1 2 314.448 4.089 20 0 DIADLO CCC(=O)Nc1cccc(C[NH2+]Cc2c(F)cccc2Cl)c1 ZINC001308205114 1065813024 /nfs/dbraw/zinc/81/30/24/1065813024.db2.gz RCWDQIUMNRFDSM-UHFFFAOYSA-N 1 2 320.795 4.117 20 0 DIADLO COc1ccc(C)cc1C[NH2+]Cc1csc(-c2ccco2)n1 ZINC001308307134 1065900579 /nfs/dbraw/zinc/90/05/79/1065900579.db2.gz WHCMGMNKGAZUGL-UHFFFAOYSA-N 1 2 314.410 4.010 20 0 DIADLO CCCCN1CCc2ccc(NCc3cccc4[nH+]ccn43)cc21 ZINC001308318183 1065909740 /nfs/dbraw/zinc/90/97/40/1065909740.db2.gz NCXNVEOKGTWWKW-UHFFFAOYSA-N 1 2 320.440 4.109 20 0 DIADLO Clc1cc(NCc2cc3cnccc3o2)ccc1-n1cc[nH+]c1 ZINC001308317240 1065909928 /nfs/dbraw/zinc/90/99/28/1065909928.db2.gz OHNQQONBPVBPDH-UHFFFAOYSA-N 1 2 324.771 4.279 20 0 DIADLO Cc1cc(NCc2cnc(C(C)C)s2)ccc1-n1cc[nH+]c1 ZINC001308325115 1065914202 /nfs/dbraw/zinc/91/42/02/1065914202.db2.gz VNZXWMNGXIEONJ-UHFFFAOYSA-N 1 2 312.442 4.373 20 0 DIADLO CCOc1ccccc1CNc1cc(CSCC)cc[nH+]1 ZINC001308331884 1065919151 /nfs/dbraw/zinc/91/91/51/1065919151.db2.gz HSOLJXWRGKUNRX-UHFFFAOYSA-N 1 2 302.443 4.346 20 0 DIADLO CCOc1cc(Cl)ccc1C[NH2+]Cc1ncc(CC)s1 ZINC001308341676 1065925914 /nfs/dbraw/zinc/92/59/14/1065925914.db2.gz IBKOQXNANLIFLK-UHFFFAOYSA-N 1 2 310.850 4.047 20 0 DIADLO CCCCCCOc1ccc(C[NH2+]Cc2nnc(C)s2)cc1 ZINC001308368399 1065944697 /nfs/dbraw/zinc/94/46/97/1065944697.db2.gz VJQFJIYMSYIALY-UHFFFAOYSA-N 1 2 319.474 4.095 20 0 DIADLO Cc1cc(CNc2cc3c[nH]nc3cc2C)c2c([nH+]1)CCCC2 ZINC001308370644 1065946307 /nfs/dbraw/zinc/94/63/07/1065946307.db2.gz QMJLYUDSKBRCSF-UHFFFAOYSA-N 1 2 306.413 4.066 20 0 DIADLO OCc1cc[nH+]c(NCc2c(Cl)ccc(Cl)c2Cl)c1 ZINC001308442676 1065990795 /nfs/dbraw/zinc/99/07/95/1065990795.db2.gz OIRXAVNMGOUAFT-UHFFFAOYSA-N 1 2 317.603 4.146 20 0 DIADLO Clc1ccc(-c2ccc(C[NH2+][C@H]3CCn4ccnc43)o2)cc1 ZINC001308413542 1065972211 /nfs/dbraw/zinc/97/22/11/1065972211.db2.gz SLSUXLGWVLTZTG-HNNXBMFYSA-N 1 2 313.788 4.031 20 0 DIADLO FC(F)Oc1cccc(Cl)c1CNc1cc2cc[nH]c2c[nH+]1 ZINC001308450381 1065996481 /nfs/dbraw/zinc/99/64/81/1065996481.db2.gz MEYOLMYGWJRWMD-UHFFFAOYSA-N 1 2 323.730 4.430 20 0 DIADLO Cc1ccccc1-n1cc(CNc2c[nH+]cc3c2CCCC3)cn1 ZINC001308464934 1066006944 /nfs/dbraw/zinc/00/69/44/1066006944.db2.gz ZOQOHZZAFQTJOS-UHFFFAOYSA-N 1 2 318.424 4.067 20 0 DIADLO CC(C)(C)C(F)(F)C[NH2+]Cc1ccc(Br)s1 ZINC001308472865 1066012274 /nfs/dbraw/zinc/01/22/74/1066012274.db2.gz YSMFUZPRJDGDOL-UHFFFAOYSA-N 1 2 312.223 4.282 20 0 DIADLO Clc1ccc(-c2ccc(C[NH2+]Cc3csnn3)cc2)cc1 ZINC001308481567 1066020354 /nfs/dbraw/zinc/02/03/54/1066020354.db2.gz XFSKJYCDQLBMSD-UHFFFAOYSA-N 1 2 315.829 4.148 20 0 DIADLO COc1ccc(NCc2c[nH+]c3c(C)cccn23)c2ccccc12 ZINC001308483829 1066021444 /nfs/dbraw/zinc/02/14/44/1066021444.db2.gz HUGGIDOMPMVKOY-UHFFFAOYSA-N 1 2 317.392 4.417 20 0 DIADLO CC[C@H]1CCC[C@@H](CNc2[nH+]c3ccccc3n2CCOC)C1 ZINC001308506937 1066033588 /nfs/dbraw/zinc/03/35/88/1066033588.db2.gz FXOKHVCTIACHTK-JKSUJKDBSA-N 1 2 315.461 4.311 20 0 DIADLO CC(C)CCn1c2ccccc2[nH+]c1NCc1cscn1 ZINC001308508107 1066036313 /nfs/dbraw/zinc/03/63/13/1066036313.db2.gz YFCZQOXZTJGEMH-UHFFFAOYSA-N 1 2 300.431 4.151 20 0 DIADLO Cc1cc(Cl)cc(C[NH2+]Cc2noc3c2CC(C)(C)CC3)c1 ZINC001308508951 1066036540 /nfs/dbraw/zinc/03/65/40/1066036540.db2.gz VBZPDJFZPNQAKW-UHFFFAOYSA-N 1 2 318.848 4.441 20 0 DIADLO F[C@H]1COc2ccccc2[C@@H]1[NH2+]Cc1cc2ccccc2s1 ZINC001308521472 1066042991 /nfs/dbraw/zinc/04/29/91/1066042991.db2.gz UOKOACSOPGYMGI-YJBOKZPZSA-N 1 2 313.397 4.463 20 0 DIADLO Cc1cc(C)c2cc(NCc3cnn(C(C)(C)C)c3)ccc2[nH+]1 ZINC001308522052 1066043431 /nfs/dbraw/zinc/04/34/31/1066043431.db2.gz NVTIYEKSRKBSCY-UHFFFAOYSA-N 1 2 308.429 4.415 20 0 DIADLO Cc1cc(C)c2cc(NCc3cnn(C4CCC4)c3)ccc2[nH+]1 ZINC001308522760 1066043803 /nfs/dbraw/zinc/04/38/03/1066043803.db2.gz YVIWBFNMQADTAN-UHFFFAOYSA-N 1 2 306.413 4.385 20 0 DIADLO CCCOc1cccc(C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)c1 ZINC001308521647 1066044171 /nfs/dbraw/zinc/04/41/71/1066044171.db2.gz WPXIVKCDGLDIFF-IEBWSBKVSA-N 1 2 315.388 4.037 20 0 DIADLO Fc1ccc(CNc2[nH+]c3ccccc3n2CC2CC2)c(F)c1 ZINC001308527518 1066046462 /nfs/dbraw/zinc/04/64/62/1066046462.db2.gz JUHQHMZSHMJNGN-UHFFFAOYSA-N 1 2 313.351 4.337 20 0 DIADLO Fc1cccc(CNc2[nH+]c3ccccc3n2CC2CC2)c1F ZINC001308527046 1066047455 /nfs/dbraw/zinc/04/74/55/1066047455.db2.gz BERZJCUXXRNWNJ-UHFFFAOYSA-N 1 2 313.351 4.337 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NC/C=C\c1ccc(F)cc1 ZINC001308550687 1066063553 /nfs/dbraw/zinc/06/35/53/1066063553.db2.gz BDFUCDOQDXZTSU-IHWYPQMZSA-N 1 2 315.779 4.491 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1ccc(C)cc1F ZINC001308552338 1066064421 /nfs/dbraw/zinc/06/44/21/1066064421.db2.gz BMQLVTHOSFAEQY-UHFFFAOYSA-N 1 2 301.340 4.255 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2c(Cl)c(C)nn2C)o1 ZINC001308578251 1066093692 /nfs/dbraw/zinc/09/36/92/1066093692.db2.gz NYRUPUILNVWROB-FZMZJTMJSA-N 1 2 321.852 4.257 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2c(Cl)c(C)nn2C)o1 ZINC001308578251 1066093704 /nfs/dbraw/zinc/09/37/04/1066093704.db2.gz NYRUPUILNVWROB-FZMZJTMJSA-N 1 2 321.852 4.257 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2nccn2C2CC2)o1 ZINC001308578828 1066094577 /nfs/dbraw/zinc/09/45/77/1066094577.db2.gz QTQPRHZSGSPXNI-PBHICJAKSA-N 1 2 313.445 4.347 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2nccn2C2CC2)o1 ZINC001308578828 1066094587 /nfs/dbraw/zinc/09/45/87/1066094587.db2.gz QTQPRHZSGSPXNI-PBHICJAKSA-N 1 2 313.445 4.347 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Oc3ccccc3)o2)CC(C)(C)O1 ZINC001308593308 1066104640 /nfs/dbraw/zinc/10/46/40/1066104640.db2.gz QZPZVFPQPVCPBB-CQSZACIVSA-N 1 2 301.386 4.071 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)o2)CC(C)(C)O1 ZINC001308593308 1066104646 /nfs/dbraw/zinc/10/46/46/1066104646.db2.gz QZPZVFPQPVCPBB-CQSZACIVSA-N 1 2 301.386 4.071 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1nccc2c1CCCC2 ZINC001308613599 1066119044 /nfs/dbraw/zinc/11/90/44/1066119044.db2.gz GNPKGZBVVADHME-CYBMUJFWSA-N 1 2 316.395 4.432 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1nccc2c1CCCC2 ZINC001308613599 1066119048 /nfs/dbraw/zinc/11/90/48/1066119048.db2.gz GNPKGZBVVADHME-CYBMUJFWSA-N 1 2 316.395 4.432 20 0 DIADLO CCC[N@H+](Cc1cncn1C(C)C)Cc1ccc(F)cc1F ZINC001308628194 1066125098 /nfs/dbraw/zinc/12/50/98/1066125098.db2.gz VDBMUYVBTUJDHK-UHFFFAOYSA-N 1 2 307.388 4.154 20 0 DIADLO CCC[N@@H+](Cc1cncn1C(C)C)Cc1ccc(F)cc1F ZINC001308628194 1066125101 /nfs/dbraw/zinc/12/51/01/1066125101.db2.gz VDBMUYVBTUJDHK-UHFFFAOYSA-N 1 2 307.388 4.154 20 0 DIADLO COCC[N@H+](Cc1ccoc1C)Cc1ccc(F)cc1Cl ZINC001308629064 1066126694 /nfs/dbraw/zinc/12/66/94/1066126694.db2.gz ZZQFKWWXVKSPOK-UHFFFAOYSA-N 1 2 311.784 4.029 20 0 DIADLO COCC[N@@H+](Cc1ccoc1C)Cc1ccc(F)cc1Cl ZINC001308629064 1066126698 /nfs/dbraw/zinc/12/66/98/1066126698.db2.gz ZZQFKWWXVKSPOK-UHFFFAOYSA-N 1 2 311.784 4.029 20 0 DIADLO Oc1ccc2c(c1)C[N@@H+](Cc1ccc(C(F)F)c(F)c1)CC2 ZINC001308631452 1066127553 /nfs/dbraw/zinc/12/75/53/1066127553.db2.gz NJMWNEFKKZJCJA-UHFFFAOYSA-N 1 2 307.315 4.027 20 0 DIADLO Oc1ccc2c(c1)C[N@H+](Cc1ccc(C(F)F)c(F)c1)CC2 ZINC001308631452 1066127564 /nfs/dbraw/zinc/12/75/64/1066127564.db2.gz NJMWNEFKKZJCJA-UHFFFAOYSA-N 1 2 307.315 4.027 20 0 DIADLO CC(C)[C@@H]1C[N@H+](CCCc2c(Cl)cccc2Cl)CCO1 ZINC001308639432 1066132805 /nfs/dbraw/zinc/13/28/05/1066132805.db2.gz BZLJWMHIEMWCCU-INIZCTEOSA-N 1 2 316.272 4.283 20 0 DIADLO CC(C)[C@@H]1C[N@@H+](CCCc2c(Cl)cccc2Cl)CCO1 ZINC001308639432 1066132807 /nfs/dbraw/zinc/13/28/07/1066132807.db2.gz BZLJWMHIEMWCCU-INIZCTEOSA-N 1 2 316.272 4.283 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2cnn(Cc3ccccc3)c2)c1F ZINC001308654354 1066139658 /nfs/dbraw/zinc/13/96/58/1066139658.db2.gz QCPMFQNDELPKSE-UHFFFAOYSA-N 1 2 323.415 4.011 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2cnn(Cc3ccccc3)c2)c1F ZINC001308654354 1066139663 /nfs/dbraw/zinc/13/96/63/1066139663.db2.gz QCPMFQNDELPKSE-UHFFFAOYSA-N 1 2 323.415 4.011 20 0 DIADLO CCn1c[nH+]cc1CN1CCc2cc(-c3cccc(F)c3)ccc21 ZINC001308679509 1066152814 /nfs/dbraw/zinc/15/28/14/1066152814.db2.gz XSYOKZFLRCQTTD-UHFFFAOYSA-N 1 2 321.399 4.272 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@@H+]1CCC[C@@H]1C(=O)OC(C)(C)C ZINC001308689182 1066181632 /nfs/dbraw/zinc/18/16/32/1066181632.db2.gz MYAPGDSNRTYHBL-OAHLLOKOSA-N 1 2 321.461 4.192 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@H+]1CCC[C@@H]1C(=O)OC(C)(C)C ZINC001308689182 1066181636 /nfs/dbraw/zinc/18/16/36/1066181636.db2.gz MYAPGDSNRTYHBL-OAHLLOKOSA-N 1 2 321.461 4.192 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1cc(Cl)cc(Cl)c1N)CC2 ZINC001308688087 1066181661 /nfs/dbraw/zinc/18/16/61/1066181661.db2.gz RRKVWVXVYVGVDP-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1cc(Cl)cc(Cl)c1N)CC2 ZINC001308688087 1066181667 /nfs/dbraw/zinc/18/16/67/1066181667.db2.gz RRKVWVXVYVGVDP-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@@H+](Cc1ccc(F)c(F)c1F)CC2 ZINC001308696530 1066186241 /nfs/dbraw/zinc/18/62/41/1066186241.db2.gz LXIOZFMXWJQAMF-UHFFFAOYSA-N 1 2 305.343 4.279 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@H+](Cc1ccc(F)c(F)c1F)CC2 ZINC001308696530 1066186245 /nfs/dbraw/zinc/18/62/45/1066186245.db2.gz LXIOZFMXWJQAMF-UHFFFAOYSA-N 1 2 305.343 4.279 20 0 DIADLO Fc1ccc(C2CC2)cc1C[NH2+]Cc1c(Cl)ccnc1F ZINC001308786258 1066262775 /nfs/dbraw/zinc/26/27/75/1066262775.db2.gz LBSUCDLDLCXPRP-UHFFFAOYSA-N 1 2 308.759 4.180 20 0 DIADLO Fc1ccc(C[N@@H+]2CCCc3occc3C2)cc1C(F)(F)F ZINC001308798046 1066274702 /nfs/dbraw/zinc/27/47/02/1066274702.db2.gz PQAQRHYJXLLSLA-UHFFFAOYSA-N 1 2 313.294 4.386 20 0 DIADLO Fc1ccc(C[N@H+]2CCCc3occc3C2)cc1C(F)(F)F ZINC001308798046 1066274713 /nfs/dbraw/zinc/27/47/13/1066274713.db2.gz PQAQRHYJXLLSLA-UHFFFAOYSA-N 1 2 313.294 4.386 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2ccnn2C2CCC2)c(F)c1 ZINC001308819024 1066293052 /nfs/dbraw/zinc/29/30/52/1066293052.db2.gz ZAYFMMDWMFMHOZ-SFHVURJKSA-N 1 2 317.383 4.223 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2ccnn2C2CCC2)c(F)c1 ZINC001308819024 1066293062 /nfs/dbraw/zinc/29/30/62/1066293062.db2.gz ZAYFMMDWMFMHOZ-SFHVURJKSA-N 1 2 317.383 4.223 20 0 DIADLO CC1(C)CCC[C@@H](C[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC001308820988 1066297210 /nfs/dbraw/zinc/29/72/10/1066297210.db2.gz TUHUSUPQHMAFPK-GDBMZVCRSA-N 1 2 304.482 4.232 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+](CC(=O)OC(C)(C)C)C2CCC2)c1 ZINC001308840096 1066314475 /nfs/dbraw/zinc/31/44/75/1066314475.db2.gz JBDOXXGDVYONQO-UHFFFAOYSA-N 1 2 323.864 4.345 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+](CC(=O)OC(C)(C)C)C2CCC2)c1 ZINC001308840096 1066314491 /nfs/dbraw/zinc/31/44/91/1066314491.db2.gz JBDOXXGDVYONQO-UHFFFAOYSA-N 1 2 323.864 4.345 20 0 DIADLO COc1cccc(Nc2ccc(NCc3ccncc3C)[nH+]c2)c1 ZINC001308864404 1066344171 /nfs/dbraw/zinc/34/41/71/1066344171.db2.gz QAZHWZZFANBWFK-UHFFFAOYSA-N 1 2 320.396 4.149 20 0 DIADLO ClC1(Cl)C[C@H]1CNc1ccc(Nc2ccccc2)c[nH+]1 ZINC001308871647 1066350634 /nfs/dbraw/zinc/35/06/34/1066350634.db2.gz FIBMQMQVBKEYGJ-NSHDSACASA-N 1 2 308.212 4.431 20 0 DIADLO C/C=C/C[C@H]1CCC[N@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC001308885574 1066364926 /nfs/dbraw/zinc/36/49/26/1066364926.db2.gz HXXWRIZPQDIPQZ-VUDBWIFFSA-N 1 2 304.381 4.340 20 0 DIADLO C/C=C/C[C@H]1CCC[N@@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC001308885574 1066364939 /nfs/dbraw/zinc/36/49/39/1066364939.db2.gz HXXWRIZPQDIPQZ-VUDBWIFFSA-N 1 2 304.381 4.340 20 0 DIADLO COc1nscc1C[N@H+](C)Cc1cccc(CC2CCC2)c1 ZINC001308954169 1066417232 /nfs/dbraw/zinc/41/72/32/1066417232.db2.gz ICDZMZZRTGVGNC-UHFFFAOYSA-N 1 2 316.470 4.126 20 0 DIADLO COc1nscc1C[N@@H+](C)Cc1cccc(CC2CCC2)c1 ZINC001308954169 1066417240 /nfs/dbraw/zinc/41/72/40/1066417240.db2.gz ICDZMZZRTGVGNC-UHFFFAOYSA-N 1 2 316.470 4.126 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NCCC1CCCCC1 ZINC001308976528 1066429248 /nfs/dbraw/zinc/42/92/48/1066429248.db2.gz GTEACYCZCHXHEK-UHFFFAOYSA-N 1 2 301.434 4.065 20 0 DIADLO Cc1ccc(CCCNc2[nH+]c3ccccc3n2C2CC2)cn1 ZINC001308990910 1066434751 /nfs/dbraw/zinc/43/47/51/1066434751.db2.gz BWGVCEHFZGRUTQ-UHFFFAOYSA-N 1 2 306.413 4.119 20 0 DIADLO Cc1cn2cc(NC(=O)NC3(C)CCC(C)(C)CC3)ccc2[nH+]1 ZINC001310254529 1066504645 /nfs/dbraw/zinc/50/46/45/1066504645.db2.gz GKONQAQEJPCVAM-UHFFFAOYSA-N 1 2 314.433 4.123 20 0 DIADLO CCCC[C@@H](CCC)NC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001310256223 1066504715 /nfs/dbraw/zinc/50/47/15/1066504715.db2.gz TWWGPCPSZJKYQK-CQSZACIVSA-N 1 2 302.422 4.123 20 0 DIADLO Cc1cc(CNC(=O)Nc2cccc3ccsc32)cc(C)[nH+]1 ZINC001310459794 1066526552 /nfs/dbraw/zinc/52/65/52/1066526552.db2.gz JQJFWHZYMUOHIM-UHFFFAOYSA-N 1 2 311.410 4.235 20 0 DIADLO CCCCC[C@@H](NC(=O)NCc1cc(C)[nH+]c(C)c1)C(C)(C)C ZINC001311970551 1066720762 /nfs/dbraw/zinc/72/07/62/1066720762.db2.gz CCSZNLBCRUEMCG-QGZVFWFLSA-N 1 2 319.493 4.493 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)CCCC2)c1nc(C2CC2)no1 ZINC000079291126 185163450 /nfs/dbraw/zinc/16/34/50/185163450.db2.gz FYSHGRKMBKKTKO-CHWSQXEVSA-N 1 2 311.429 4.238 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc2c(c1)CCCC2)c1nc(C2CC2)no1 ZINC000079291111 185163591 /nfs/dbraw/zinc/16/35/91/185163591.db2.gz FYSHGRKMBKKTKO-STQMWFEESA-N 1 2 311.429 4.238 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccccc1OC(F)F ZINC000090458639 185297579 /nfs/dbraw/zinc/29/75/79/185297579.db2.gz LKYANPHAQJBZKJ-SNVBAGLBSA-N 1 2 324.396 4.473 20 0 DIADLO CCCC[C@H](CC)C(=O)N1CCCC[C@@H]1c1[nH+]ccn1CC ZINC000366642722 534982144 /nfs/dbraw/zinc/98/21/44/534982144.db2.gz FKJZZULDNBGQTA-JKSUJKDBSA-N 1 2 305.466 4.173 20 0 DIADLO C[C@@H](NC(=O)C[C@H](C)C1CC[NH2+]CC1)c1cccc2ccccc21 ZINC000150723262 186060247 /nfs/dbraw/zinc/06/02/47/186060247.db2.gz GZCKUQBLZKLBCN-JKSUJKDBSA-N 1 2 324.468 4.043 20 0 DIADLO CC(C)c1csc(C[NH2+][C@@H](C)c2nc3ccccc3n2C)n1 ZINC000091371681 193047006 /nfs/dbraw/zinc/04/70/06/193047006.db2.gz BVXDZIWHPIHYCY-LBPRGKRZSA-N 1 2 314.458 4.004 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1csc(-c2ccsc2)n1 ZINC000091704687 193094724 /nfs/dbraw/zinc/09/47/24/193094724.db2.gz BRBPFKRKLBLYPR-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1csc(-c2ccsc2)n1 ZINC000091704687 193094726 /nfs/dbraw/zinc/09/47/26/193094726.db2.gz BRBPFKRKLBLYPR-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1nccs1 ZINC000091735979 193099291 /nfs/dbraw/zinc/09/92/91/193099291.db2.gz PEYOKMSMORLYIV-ZIAGYGMSSA-N 1 2 304.459 4.480 20 0 DIADLO C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]C1(C(F)F)CC1 ZINC000563764324 335002491 /nfs/dbraw/zinc/00/24/91/335002491.db2.gz AGILITUQGPEJDY-YFHOEESVSA-N 1 2 305.290 4.496 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1OC1CCCC1)c1nccs1 ZINC000093399327 193245013 /nfs/dbraw/zinc/24/50/13/193245013.db2.gz QUYDRIIMNIYFOD-ZDUSSCGKSA-N 1 2 302.443 4.315 20 0 DIADLO CC(C)[C@@H]([NH2+][C@@H](C)c1nccs1)c1nc2ccccc2[nH]1 ZINC000093401137 193244328 /nfs/dbraw/zinc/24/43/28/193244328.db2.gz SDLGIHOORJGQLM-SMDDNHRTSA-N 1 2 300.431 4.067 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+](C)Cc3nccs3)s2)cc1 ZINC000093582877 193269141 /nfs/dbraw/zinc/26/91/41/193269141.db2.gz QDJNVMXJSJRJHN-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+](C)Cc3nccs3)s2)cc1 ZINC000093582877 193269143 /nfs/dbraw/zinc/26/91/43/193269143.db2.gz QDJNVMXJSJRJHN-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO Cc1cc(NC(=O)c2ccc(OCc3ccccc3)cc2)cc[nH+]1 ZINC000017820636 182085939 /nfs/dbraw/zinc/08/59/39/182085939.db2.gz XHMXCNPUGKOQSG-UHFFFAOYSA-N 1 2 318.376 4.221 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccccc2Br)cs1 ZINC000042419251 183268001 /nfs/dbraw/zinc/26/80/01/183268001.db2.gz KJOARWBOSQMEPW-SECBINFHSA-N 1 2 311.248 4.065 20 0 DIADLO Cc1cc(OCCCO[C@H]2CCCCO2)c2cccc(C)c2[nH+]1 ZINC000563838158 335037991 /nfs/dbraw/zinc/03/79/91/335037991.db2.gz XECQCTPMUJLTMI-SFHVURJKSA-N 1 2 315.413 4.164 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CCC3(C2)CCCCC3)n1 ZINC000154341229 335042154 /nfs/dbraw/zinc/04/21/54/335042154.db2.gz QIAJVTMXLQQQID-UHFFFAOYSA-N 1 2 304.381 4.318 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CCC3(C2)CCCCC3)n1 ZINC000154341229 335042155 /nfs/dbraw/zinc/04/21/55/335042155.db2.gz QIAJVTMXLQQQID-UHFFFAOYSA-N 1 2 304.381 4.318 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)n(C)n1 ZINC000417699798 335064080 /nfs/dbraw/zinc/06/40/80/335064080.db2.gz GFESFSJYDBYFHF-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO Cc1cc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)n(C)n1 ZINC000417699798 335064081 /nfs/dbraw/zinc/06/40/81/335064081.db2.gz GFESFSJYDBYFHF-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO CC[C@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1ccc(Cl)s1 ZINC000272299721 130017845 /nfs/dbraw/zinc/01/78/45/130017845.db2.gz QFHKKLNIWHEXIC-VIFPVBQESA-N 1 2 313.854 4.323 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2nnc(C3CC3)n2C2CC2)c(C)c1 ZINC000272880235 130071721 /nfs/dbraw/zinc/07/17/21/130071721.db2.gz XSFWKXAZRSHDJY-HNNXBMFYSA-N 1 2 324.472 4.300 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2nnc(C3CC3)n2C2CC2)c(C)c1 ZINC000272880235 130071723 /nfs/dbraw/zinc/07/17/23/130071723.db2.gz XSFWKXAZRSHDJY-HNNXBMFYSA-N 1 2 324.472 4.300 20 0 DIADLO COc1ccnc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)c1 ZINC000273134956 130092190 /nfs/dbraw/zinc/09/21/90/130092190.db2.gz JFRCGUAKGQBSJP-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2csc(CCC(C)C)n2)s1 ZINC000273281976 130102652 /nfs/dbraw/zinc/10/26/52/130102652.db2.gz ISIIVWWABMOKFH-GFCCVEGCSA-N 1 2 309.504 4.347 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(-c2ccccc2)no1)c1nc(C)cs1 ZINC000273529339 130132438 /nfs/dbraw/zinc/13/24/38/130132438.db2.gz SNLLTMFAUQKTOJ-HNNXBMFYSA-N 1 2 313.426 4.347 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(-c2ccco2)no1)c1ccc(Cl)s1 ZINC000273534218 130133187 /nfs/dbraw/zinc/13/31/87/130133187.db2.gz UIGWJIGMVQFRPD-VIFPVBQESA-N 1 2 323.805 4.285 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](CC)c2ccc(Cl)s2)s1 ZINC000273546470 130134834 /nfs/dbraw/zinc/13/48/34/130134834.db2.gz WQMUYNAHYXKVRP-QMMMGPOBSA-N 1 2 301.868 4.056 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)s1 ZINC000273657642 130149896 /nfs/dbraw/zinc/14/98/96/130149896.db2.gz XNDJACDNQQGWQV-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1ccc(Cc2nc(-c3ccccc3OCC(C)C)no2)c[nH+]1 ZINC000273718181 130158083 /nfs/dbraw/zinc/15/80/83/130158083.db2.gz JCOZRCYGKFHGSD-UHFFFAOYSA-N 1 2 323.396 4.066 20 0 DIADLO CCCCc1nc(C[NH2+]C2(c3nc(C)cs3)CCC2)cs1 ZINC000273931966 130187677 /nfs/dbraw/zinc/18/76/77/130187677.db2.gz CLNJPUGWWDPWCH-UHFFFAOYSA-N 1 2 321.515 4.420 20 0 DIADLO Cc1ccc(Cc2noc(COc3ccc(C(C)C)cc3)n2)c[nH+]1 ZINC000273961285 130192230 /nfs/dbraw/zinc/19/22/30/130192230.db2.gz PAXVCVGYRLDNKQ-UHFFFAOYSA-N 1 2 323.396 4.066 20 0 DIADLO Cc1ccc(C[C@@H](C)c2nc(Cc3ccc(C)[nH+]c3)no2)cc1 ZINC000273986032 130194717 /nfs/dbraw/zinc/19/47/17/130194717.db2.gz SEZKWBFOXCMVEC-CQSZACIVSA-N 1 2 307.397 4.018 20 0 DIADLO CC(C)C[C@@H](C)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000274159681 130212089 /nfs/dbraw/zinc/21/20/89/130212089.db2.gz MLMNYTMUXYXKME-OAHLLOKOSA-N 1 2 323.440 4.223 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc(Cl)cc3C)CCCCC2)no1 ZINC000274293289 130225025 /nfs/dbraw/zinc/22/50/25/130225025.db2.gz LBLNXXQOVGZVLW-UHFFFAOYSA-N 1 2 319.836 4.289 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nc(Cl)ccc1Cl ZINC000274311697 130226207 /nfs/dbraw/zinc/22/62/07/130226207.db2.gz MMRKIGSHBWACCU-CQSZACIVSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nc(Cl)ccc1Cl ZINC000274311697 130226208 /nfs/dbraw/zinc/22/62/08/130226208.db2.gz MMRKIGSHBWACCU-CQSZACIVSA-N 1 2 310.228 4.367 20 0 DIADLO Fc1cncc(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)c1 ZINC000274332034 130227478 /nfs/dbraw/zinc/22/74/78/130227478.db2.gz GALLWTMQQQPXLR-OAHLLOKOSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1cncc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)c1 ZINC000274332034 130227481 /nfs/dbraw/zinc/22/74/81/130227481.db2.gz GALLWTMQQQPXLR-OAHLLOKOSA-N 1 2 313.401 4.168 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1nc(Cl)ccc1Cl ZINC000274357901 130228477 /nfs/dbraw/zinc/22/84/77/130228477.db2.gz YRYMOIIGYBMJSS-JTQLQIEISA-N 1 2 311.212 4.248 20 0 DIADLO Cc1ccn2cc(C[NH2+][C@H](C)c3csc(C(C)C)n3)nc2c1 ZINC000274476445 130239309 /nfs/dbraw/zinc/23/93/09/130239309.db2.gz QMVDDYYCUDCMPS-CYBMUJFWSA-N 1 2 314.458 4.073 20 0 DIADLO Cc1ccn2cc(CN[C@H](C)c3csc(C(C)C)n3)[nH+]c2c1 ZINC000274476445 130239311 /nfs/dbraw/zinc/23/93/11/130239311.db2.gz QMVDDYYCUDCMPS-CYBMUJFWSA-N 1 2 314.458 4.073 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cccc(O)c1)c1nc(C(F)(F)F)cs1 ZINC000274589006 130247193 /nfs/dbraw/zinc/24/71/93/130247193.db2.gz JRSFKDURDSHNPR-RKDXNWHRSA-N 1 2 316.348 4.279 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@H](C)c1ccc(Cl)cn1)c1ccco1 ZINC000274957164 130277413 /nfs/dbraw/zinc/27/74/13/130277413.db2.gz WCIGNAYXLGQVDD-CJNGLKHVSA-N 1 2 322.836 4.393 20 0 DIADLO Cc1nccnc1[C@H](C)[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000275662900 130357373 /nfs/dbraw/zinc/35/73/73/130357373.db2.gz BNEHWVGZQGQXDR-NSHDSACASA-N 1 2 322.239 4.432 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)CC1(C)CCCCC1 ZINC000366610236 130905618 /nfs/dbraw/zinc/90/56/18/130905618.db2.gz QYVPDLHMZPOHFU-MRXNPFEDSA-N 1 2 317.477 4.317 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2cccc(OC(C)C)c2)s1 ZINC000283050449 130954914 /nfs/dbraw/zinc/95/49/14/130954914.db2.gz IYDJPOMOEPBWCC-RYUDHWBXSA-N 1 2 305.447 4.046 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+][C@H](C)c1nc(C(C)C)no1 ZINC000283525748 131000492 /nfs/dbraw/zinc/00/04/92/131000492.db2.gz NJXPHWJJSIQCCU-VXGBXAGGSA-N 1 2 305.447 4.327 20 0 DIADLO Cn1cc[nH+]c1CN1CCCC[C@@H]1c1ccccc1C(F)(F)F ZINC000340184894 131017170 /nfs/dbraw/zinc/01/71/70/131017170.db2.gz GOWAGWKTIBUKJT-OAHLLOKOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1ccnc1C[N@@H+]1CCCC[C@@H]1c1ccccc1C(F)(F)F ZINC000340184894 131017172 /nfs/dbraw/zinc/01/71/72/131017172.db2.gz GOWAGWKTIBUKJT-OAHLLOKOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1ccnc1C[N@H+]1CCCC[C@@H]1c1ccccc1C(F)(F)F ZINC000340184894 131017173 /nfs/dbraw/zinc/01/71/73/131017173.db2.gz GOWAGWKTIBUKJT-OAHLLOKOSA-N 1 2 323.362 4.166 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccc(C)cc2OC(C)(C)C)no1 ZINC000283835525 131028181 /nfs/dbraw/zinc/02/81/81/131028181.db2.gz AUISBJLIFNEKLJ-AWEZNQCLSA-N 1 2 302.418 4.320 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(C(C)(C)C)nc1)c1c(F)cccc1Cl ZINC000284252226 131064309 /nfs/dbraw/zinc/06/43/09/131064309.db2.gz FSQAUUWVNRHZPQ-LLVKDONJSA-N 1 2 321.827 4.417 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)no1 ZINC000284952338 131125870 /nfs/dbraw/zinc/12/58/70/131125870.db2.gz FDVSMKVLEDYPCJ-BXUZGUMPSA-N 1 2 306.793 4.201 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccncc1)c1ccncc1F ZINC000340206560 131172684 /nfs/dbraw/zinc/17/26/84/131172684.db2.gz OSSHXDMSRLTKFV-AUUYWEPGSA-N 1 2 307.372 4.056 20 0 DIADLO Cc1noc([C@@H]2CCCC[N@@H+]2Cc2cccc(C(F)F)c2)n1 ZINC000285609089 131185863 /nfs/dbraw/zinc/18/58/63/131185863.db2.gz KDROQCQVRKFVTR-AWEZNQCLSA-N 1 2 307.344 4.043 20 0 DIADLO Cc1noc([C@@H]2CCCC[N@H+]2Cc2cccc(C(F)F)c2)n1 ZINC000285609089 131185864 /nfs/dbraw/zinc/18/58/64/131185864.db2.gz KDROQCQVRKFVTR-AWEZNQCLSA-N 1 2 307.344 4.043 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cc(F)c(F)c(F)c1 ZINC000285731139 131197699 /nfs/dbraw/zinc/19/76/99/131197699.db2.gz QSMMRIZNUXYWGQ-YUMQZZPRSA-N 1 2 316.273 4.189 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)c1c(F)cncc1F ZINC000285836022 131205108 /nfs/dbraw/zinc/20/51/08/131205108.db2.gz YCMXMUTWNIZAMZ-NWDGAFQWSA-N 1 2 306.356 4.089 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3cc(C)ccn3)co2)cc1 ZINC000286050947 131217021 /nfs/dbraw/zinc/21/70/21/131217021.db2.gz KZTQJYPWVIYHNN-HNNXBMFYSA-N 1 2 307.397 4.204 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3cc(C)ccn3)co2)cc1 ZINC000286050954 131217125 /nfs/dbraw/zinc/21/71/25/131217125.db2.gz KZTQJYPWVIYHNN-OAHLLOKOSA-N 1 2 307.397 4.204 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cscc2Br)s1 ZINC000286415661 131235436 /nfs/dbraw/zinc/23/54/36/131235436.db2.gz ICYQXPVZCNMNIT-QMMMGPOBSA-N 1 2 317.277 4.126 20 0 DIADLO C[C@@H]([NH2+]Cc1nccc(C(F)F)n1)c1cc2ccccc2o1 ZINC000286965470 131257889 /nfs/dbraw/zinc/25/78/89/131257889.db2.gz IECAKVQCCBLKIA-SNVBAGLBSA-N 1 2 303.312 4.011 20 0 DIADLO Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)Nc2c(C)cc[nH+]c2C)C1 ZINC000286979870 131258529 /nfs/dbraw/zinc/25/85/29/131258529.db2.gz BTPQDVXIPUMPCS-WBVHZDCISA-N 1 2 323.440 4.417 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCC[C@H]1c1ccccc1 ZINC000286982452 131258984 /nfs/dbraw/zinc/25/89/84/131258984.db2.gz BYWSRCIGIZJXKW-DLBZAZTESA-N 1 2 309.413 4.156 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2nccn2-c2ccccc2)oc1C ZINC000287188739 131268603 /nfs/dbraw/zinc/26/86/03/131268603.db2.gz VPUUWZIHWNSEJS-HUUCEWRRSA-N 1 2 309.413 4.494 20 0 DIADLO Fc1ccccc1C[N@@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000287381008 131278191 /nfs/dbraw/zinc/27/81/91/131278191.db2.gz MXPHFCQPOJVYBR-MRXNPFEDSA-N 1 2 315.392 4.203 20 0 DIADLO Fc1ccccc1C[N@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000287381008 131278192 /nfs/dbraw/zinc/27/81/92/131278192.db2.gz MXPHFCQPOJVYBR-MRXNPFEDSA-N 1 2 315.392 4.203 20 0 DIADLO CCc1cnc(CCNc2[nH+]ccc3ccc(F)cc32)s1 ZINC000340254831 131279438 /nfs/dbraw/zinc/27/94/38/131279438.db2.gz FZEQFJCYKRLLTG-UHFFFAOYSA-N 1 2 301.390 4.047 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@H]1c1ccsc1 ZINC000287451382 131280674 /nfs/dbraw/zinc/28/06/74/131280674.db2.gz IAWZLPGNAJRTPB-AWEZNQCLSA-N 1 2 301.415 4.129 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC=C(c2ccccc2)C1 ZINC000287444992 131281026 /nfs/dbraw/zinc/28/10/26/131281026.db2.gz HPWQMJFOMMVDLN-UHFFFAOYSA-N 1 2 307.397 4.020 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCCCC[C@@H]1c1ccncc1 ZINC000287460157 131281251 /nfs/dbraw/zinc/28/12/51/131281251.db2.gz ISXJLSOYIDXPLK-QGZVFWFLSA-N 1 2 324.428 4.243 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(Cc1ccccc1F)C(C)C ZINC000287488133 131283045 /nfs/dbraw/zinc/28/30/45/131283045.db2.gz KPLCMGSVFPGMRO-UHFFFAOYSA-N 1 2 315.392 4.280 20 0 DIADLO CCN(C(=O)Nc1c(C)cc[nH+]c1C)[C@@H](C)c1cccc(O)c1 ZINC000287508006 131284369 /nfs/dbraw/zinc/28/43/69/131284369.db2.gz LXVNDROZANSORT-AWEZNQCLSA-N 1 2 313.401 4.019 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC(c2ccsc2)CC1 ZINC000287610512 131289798 /nfs/dbraw/zinc/28/97/98/131289798.db2.gz SQZHRVHQUPYLHC-UHFFFAOYSA-N 1 2 315.442 4.171 20 0 DIADLO Fc1ccc2cc[nH+]c(NCc3ccc4c(c3)OCCCO4)c2c1 ZINC000340258495 131290376 /nfs/dbraw/zinc/29/03/76/131290376.db2.gz VMJSTTZOFYWOTF-UHFFFAOYSA-N 1 2 324.355 4.147 20 0 DIADLO CC[C@@H](NC(=O)Nc1c(C)cc[nH+]c1C)c1cc(F)ccc1F ZINC000287670290 131293287 /nfs/dbraw/zinc/29/32/87/131293287.db2.gz XQRUGHGRKFQLDG-OAHLLOKOSA-N 1 2 319.355 4.249 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000287675845 131294679 /nfs/dbraw/zinc/29/46/79/131294679.db2.gz VZJGHEQVMHXPSM-ZJUUUORDSA-N 1 2 315.364 4.277 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+]Cc1noc2c1CCCC2 ZINC000288332275 131320497 /nfs/dbraw/zinc/32/04/97/131320497.db2.gz AUJADPGAQKMOHQ-UHFFFAOYSA-N 1 2 311.212 4.150 20 0 DIADLO Clc1ccc(C[NH2+]Cc2noc3c2CCCC3)cc1Cl ZINC000288482919 131327069 /nfs/dbraw/zinc/32/70/69/131327069.db2.gz PXSXUOWASOPXEY-UHFFFAOYSA-N 1 2 311.212 4.150 20 0 DIADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000288572904 131330727 /nfs/dbraw/zinc/33/07/27/131330727.db2.gz NENXGTNZZLHSTC-BZNIZROVSA-N 1 2 302.443 4.052 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CCC=C(c2cccnc2)C1 ZINC000289252784 131369169 /nfs/dbraw/zinc/36/91/69/131369169.db2.gz CLDPXDBAGZHMHL-AWEZNQCLSA-N 1 2 311.429 4.217 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCC=C(c2cccnc2)C1 ZINC000289252784 131369170 /nfs/dbraw/zinc/36/91/70/131369170.db2.gz CLDPXDBAGZHMHL-AWEZNQCLSA-N 1 2 311.429 4.217 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)no1 ZINC000289305307 131372601 /nfs/dbraw/zinc/37/26/01/131372601.db2.gz BYMJOJGQMVCEIF-FCIDVOKBSA-N 1 2 305.809 4.079 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccc(Oc3cccnc3)cc2)oc1C ZINC000289389630 131381522 /nfs/dbraw/zinc/38/15/22/131381522.db2.gz JXZFBYGHAMLUES-CQSZACIVSA-N 1 2 323.396 4.330 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1cccc(OC(F)F)c1 ZINC000289393229 131382398 /nfs/dbraw/zinc/38/23/98/131382398.db2.gz RFQVXIPCLSJBNO-NSHDSACASA-N 1 2 324.371 4.424 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2csc(Cl)n2)c1 ZINC000289450832 131387449 /nfs/dbraw/zinc/38/74/49/131387449.db2.gz XGTNEUVSIQBCGK-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2csc(Cl)n2)c1 ZINC000289450832 131387451 /nfs/dbraw/zinc/38/74/51/131387451.db2.gz XGTNEUVSIQBCGK-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO CC(C)OCc1nc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)no1 ZINC000290035743 131446491 /nfs/dbraw/zinc/44/64/91/131446491.db2.gz WDTMHJJIZSFDLT-NWDGAFQWSA-N 1 2 323.824 4.060 20 0 DIADLO CC(C)COC1CC[NH+](Cc2ccnc(Cl)c2Cl)CC1 ZINC000290418882 131485673 /nfs/dbraw/zinc/48/56/73/131485673.db2.gz MCFUMIFXUQJFLS-UHFFFAOYSA-N 1 2 317.260 4.025 20 0 DIADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ccnc(Cl)c1Cl ZINC000291668555 131590704 /nfs/dbraw/zinc/59/07/04/131590704.db2.gz WBDDVZAWHIROOS-OTYXRUKQSA-N 1 2 309.196 4.000 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@H]2CC=C(C)CC2)c2ccc(Cl)cc2)no1 ZINC000293553030 131745759 /nfs/dbraw/zinc/74/57/59/131745759.db2.gz HGYZSXXBDUXWOB-HOTGVXAUSA-N 1 2 317.820 4.209 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccc(C)cc2OC(C)(C)C)s1 ZINC000295636644 131912698 /nfs/dbraw/zinc/91/26/98/131912698.db2.gz HXMOOOGXSBJNGR-UHFFFAOYSA-N 1 2 304.459 4.227 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cc(Cl)c1O ZINC000297610605 132025600 /nfs/dbraw/zinc/02/56/00/132025600.db2.gz GMKIAPBZPWNYDG-HNNXBMFYSA-N 1 2 320.820 4.110 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)cc(Cl)c1O ZINC000297610605 132025602 /nfs/dbraw/zinc/02/56/02/132025602.db2.gz GMKIAPBZPWNYDG-HNNXBMFYSA-N 1 2 320.820 4.110 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cc(Cl)c1O ZINC000297610609 132025871 /nfs/dbraw/zinc/02/58/71/132025871.db2.gz GMKIAPBZPWNYDG-OAHLLOKOSA-N 1 2 320.820 4.110 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)cc(Cl)c1O ZINC000297610609 132025873 /nfs/dbraw/zinc/02/58/73/132025873.db2.gz GMKIAPBZPWNYDG-OAHLLOKOSA-N 1 2 320.820 4.110 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1nccn1CC ZINC000297818034 132035582 /nfs/dbraw/zinc/03/55/82/132035582.db2.gz REZHARHEXBYJTQ-JKSUJKDBSA-N 1 2 315.461 4.240 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1[C@H](C)C[C@@H](c2ccccc2)[C@H]1C ZINC000297831640 132036116 /nfs/dbraw/zinc/03/61/16/132036116.db2.gz RIDVJZHSCXBNPV-BFYDXBDKSA-N 1 2 309.413 4.188 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cc(-c2ccco2)on1)c1nc(C)cs1 ZINC000298028728 132044629 /nfs/dbraw/zinc/04/46/29/132044629.db2.gz BLVLBEUYPJEPAW-MRXNPFEDSA-N 1 2 317.414 4.115 20 0 DIADLO CC[C@](C)([NH2+]Cc1cc(-c2ccco2)on1)c1nc(C)cs1 ZINC000298028727 132045098 /nfs/dbraw/zinc/04/50/98/132045098.db2.gz BLVLBEUYPJEPAW-INIZCTEOSA-N 1 2 317.414 4.115 20 0 DIADLO C[C@@H](c1nc2ccccc2n1C(F)F)[N@H+](C)Cc1ccccn1 ZINC000298126077 132047366 /nfs/dbraw/zinc/04/73/66/132047366.db2.gz KPWNACGRROBDPZ-LBPRGKRZSA-N 1 2 316.355 4.019 20 0 DIADLO C[C@@H](c1nc2ccccc2n1C(F)F)[N@@H+](C)Cc1ccccn1 ZINC000298126077 132047367 /nfs/dbraw/zinc/04/73/67/132047367.db2.gz KPWNACGRROBDPZ-LBPRGKRZSA-N 1 2 316.355 4.019 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1cc(-c2ccco2)on1)C(C)C ZINC000298712550 132075111 /nfs/dbraw/zinc/07/51/11/132075111.db2.gz UFCFJQRFHUKXLI-KRWDZBQOSA-N 1 2 311.385 4.125 20 0 DIADLO CC[C@H](c1ccccc1)[N@H+](CC)Cc1csc(NC(C)=O)n1 ZINC000299382442 132102537 /nfs/dbraw/zinc/10/25/37/132102537.db2.gz JSIKCBZNUIMHBS-MRXNPFEDSA-N 1 2 317.458 4.075 20 0 DIADLO CC[C@H](c1ccccc1)[N@@H+](CC)Cc1csc(NC(C)=O)n1 ZINC000299382442 132102538 /nfs/dbraw/zinc/10/25/38/132102538.db2.gz JSIKCBZNUIMHBS-MRXNPFEDSA-N 1 2 317.458 4.075 20 0 DIADLO Cc1nnc(C[N@H+](Cc2ccccc2)[C@H](C)c2cccs2)o1 ZINC000299442620 132105540 /nfs/dbraw/zinc/10/55/40/132105540.db2.gz XFYARVZJJDGUKT-CYBMUJFWSA-N 1 2 313.426 4.203 20 0 DIADLO Cc1nnc(C[N@@H+](Cc2ccccc2)[C@H](C)c2cccs2)o1 ZINC000299442620 132105542 /nfs/dbraw/zinc/10/55/42/132105542.db2.gz XFYARVZJJDGUKT-CYBMUJFWSA-N 1 2 313.426 4.203 20 0 DIADLO CC(C)n1ccnc1C[NH2+]C(c1ccccc1)c1ccccc1 ZINC000299582723 132111923 /nfs/dbraw/zinc/11/19/23/132111923.db2.gz IXRWOGYEBYQJBW-UHFFFAOYSA-N 1 2 305.425 4.343 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ccccc3OC(F)F)CCC2)n1 ZINC000299663920 132114850 /nfs/dbraw/zinc/11/48/50/132114850.db2.gz YHYMWZNDQNHENV-UHFFFAOYSA-N 1 2 324.396 4.222 20 0 DIADLO C[C@H]1CCC[C@H](C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)C1 ZINC000340670191 132139110 /nfs/dbraw/zinc/13/91/10/132139110.db2.gz XENSIYWZQKEJKC-JSGCOSHPSA-N 1 2 311.429 4.216 20 0 DIADLO CCO[C@@H]1C[C@@H](Nc2ccc3cc(OC)ccc3[nH+]2)C12CCC2 ZINC000608088375 435349145 /nfs/dbraw/zinc/34/91/45/435349145.db2.gz OTSLWLIKPPBHOI-IAGOWNOFSA-N 1 2 312.413 4.003 20 0 DIADLO CCc1nc([C@H](C)Nc2[nH+]c(C3CC3)nc3[nH]ccc32)cs1 ZINC000631115334 435401054 /nfs/dbraw/zinc/40/10/54/435401054.db2.gz KTUZJOBQLOWCDR-VIFPVBQESA-N 1 2 313.430 4.027 20 0 DIADLO Cc1nc([C@@H](C)Nc2[nH+]c(C(C)C)nc3[nH]ccc32)cs1 ZINC000631112328 435401120 /nfs/dbraw/zinc/40/11/20/435401120.db2.gz VCCJGBLNOJEAEH-SECBINFHSA-N 1 2 301.419 4.019 20 0 DIADLO CCc1csc([C@@H](C)Nc2[nH+]c(C3CC3)nc3[nH]ccc32)n1 ZINC000631318464 435402114 /nfs/dbraw/zinc/40/21/14/435402114.db2.gz GSQADEWFWIOFLD-SECBINFHSA-N 1 2 313.430 4.027 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)c(C)o1 ZINC000570896356 332837064 /nfs/dbraw/zinc/83/70/64/332837064.db2.gz XTPHGNFPKAEMNS-KSSFIOAISA-N 1 2 309.413 4.070 20 0 DIADLO C[C@H](CCOc1ccccc1-n1cc[nH+]c1)OCc1ccccc1 ZINC000530489174 331494585 /nfs/dbraw/zinc/49/45/85/331494585.db2.gz QRKTTYMFUAZZCA-QGZVFWFLSA-N 1 2 322.408 4.247 20 0 DIADLO C[C@@H](C(=O)Nc1cccc(Cc2[nH]c3ccccc3[nH+]2)c1)C1CC1 ZINC000583990283 331518370 /nfs/dbraw/zinc/51/83/70/331518370.db2.gz RMGBNYJTNBUWQD-CYBMUJFWSA-N 1 2 319.408 4.138 20 0 DIADLO Fc1cccc(Cl)c1CNc1cccc(-n2cc[nH+]c2)c1 ZINC000036940085 331526564 /nfs/dbraw/zinc/52/65/64/331526564.db2.gz XTLABSNWTOUCPP-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO CCc1nc(C[NH2+][C@@H](c2ccc(CC(C)C)cc2)C(C)C)no1 ZINC000533472037 331538790 /nfs/dbraw/zinc/53/87/90/331538790.db2.gz ZSSKRRWTTAWDOF-LJQANCHMSA-N 1 2 315.461 4.317 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)no1 ZINC000370543556 331550763 /nfs/dbraw/zinc/55/07/63/331550763.db2.gz IEJRBHZMRQOXJR-UFBFGSQYSA-N 1 2 313.184 4.074 20 0 DIADLO CCC[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1cccnc1 ZINC000186281055 332921009 /nfs/dbraw/zinc/92/10/09/332921009.db2.gz UPJYSDQANUIJGZ-GOSISDBHSA-N 1 2 310.445 4.420 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2cc(Cl)sc2Cl)s1 ZINC000312575389 331662642 /nfs/dbraw/zinc/66/26/42/331662642.db2.gz DPFJYLQLEZMPCX-YFKPBYRVSA-N 1 2 308.259 4.066 20 0 DIADLO Fc1c[nH+]ccc1NCc1cnc(-c2ccc(Cl)cc2)s1 ZINC000556330358 331669024 /nfs/dbraw/zinc/66/90/24/331669024.db2.gz KHSFHFGGXUKMKW-UHFFFAOYSA-N 1 2 319.792 4.032 20 0 DIADLO Cc1[nH]c(CNc2cc(C)c(Br)c(C)c2)[nH+]c1C ZINC000568269278 331760865 /nfs/dbraw/zinc/76/08/65/331760865.db2.gz FZJAPZYDBKDIQB-UHFFFAOYSA-N 1 2 308.223 4.018 20 0 DIADLO Cc1cc[nH+]c(NCCc2nc3c(s2)CCCC3)c1Cl ZINC000557612041 331802526 /nfs/dbraw/zinc/80/25/26/331802526.db2.gz VOTQHPWPYJLRHD-UHFFFAOYSA-N 1 2 307.850 4.033 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(F)c2ccccc21 ZINC000558172278 331881156 /nfs/dbraw/zinc/88/11/56/331881156.db2.gz GAIFYQATOFWYIY-NSHDSACASA-N 1 2 311.360 4.090 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000363410916 331900179 /nfs/dbraw/zinc/90/01/79/331900179.db2.gz HVJZWKDBJLAPPK-SJORKVTESA-N 1 2 317.477 4.112 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000363410914 331900291 /nfs/dbraw/zinc/90/02/91/331900291.db2.gz HVJZWKDBJLAPPK-IAGOWNOFSA-N 1 2 317.477 4.112 20 0 DIADLO CC(C)(C)CCCC(=O)N[C@H]1CC[C@H](Nc2cccc[nH+]2)CC1 ZINC000569349429 331983745 /nfs/dbraw/zinc/98/37/45/331983745.db2.gz XIZRHOFEIICUAB-WKILWMFISA-N 1 2 317.477 4.137 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)s1 ZINC000559246218 332002257 /nfs/dbraw/zinc/00/22/57/332002257.db2.gz YFALPADLOBOTMZ-GWCFXTLKSA-N 1 2 308.472 4.012 20 0 DIADLO O=C(c1ccccc1)C1CC[NH+](Cc2ccc(F)cc2F)CC1 ZINC000084860451 332007000 /nfs/dbraw/zinc/00/70/00/332007000.db2.gz KLTQXKSKTQCVJQ-UHFFFAOYSA-N 1 2 315.363 4.060 20 0 DIADLO CC(C)c1ccc(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)cc1 ZINC000518301677 332009593 /nfs/dbraw/zinc/00/95/93/332009593.db2.gz KDBMRQPOPFGFHM-UHFFFAOYSA-N 1 2 319.408 4.463 20 0 DIADLO Cc1cc2[nH+]cn(Cc3ncc(-c4cccc(F)c4)o3)c2cc1C ZINC000085259553 332010015 /nfs/dbraw/zinc/01/00/15/332010015.db2.gz PYUQYHLELBAHRT-UHFFFAOYSA-N 1 2 321.355 4.496 20 0 DIADLO OC[C@H]([NH2+]Cc1ccc(C2CCC2)cc1)c1c(F)cccc1F ZINC000559268035 332010267 /nfs/dbraw/zinc/01/02/67/332010267.db2.gz VNSFHHIFBXCYDE-SFHVURJKSA-N 1 2 317.379 4.056 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@H](C)c2c(F)cccc2Cl)c1 ZINC000559273807 332011331 /nfs/dbraw/zinc/01/13/31/332011331.db2.gz ZZKPRYUNSUYKOD-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+]2CC=C(C(C)(C)C)CC2)cs1 ZINC000409446795 332032076 /nfs/dbraw/zinc/03/20/76/332032076.db2.gz SRFMOFBKKLBICB-CYBMUJFWSA-N 1 2 308.491 4.419 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+]2CC=C(C(C)(C)C)CC2)cs1 ZINC000409446795 332032077 /nfs/dbraw/zinc/03/20/77/332032077.db2.gz SRFMOFBKKLBICB-CYBMUJFWSA-N 1 2 308.491 4.419 20 0 DIADLO Cc1cc(N[C@H]2CCCC23CCOCC3)c2cccc(F)c2[nH+]1 ZINC000409666256 332044953 /nfs/dbraw/zinc/04/49/53/332044953.db2.gz OEGDNAZCJFUXGC-KRWDZBQOSA-N 1 2 314.404 4.444 20 0 DIADLO CC[C@H]([NH2+]Cc1cnc(CCc2ccccc2)s1)C(F)F ZINC000449362332 332073587 /nfs/dbraw/zinc/07/35/87/332073587.db2.gz MRCUPZBHWFGKQG-AWEZNQCLSA-N 1 2 310.413 4.062 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(C(F)(F)F)s2)[C@@H]1[C@@H]1CCCO1 ZINC000569399044 332074602 /nfs/dbraw/zinc/07/46/02/332074602.db2.gz AWYAYABGSDAMGA-WCQYABFASA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(C(F)(F)F)s2)[C@@H]1[C@@H]1CCCO1 ZINC000569399044 332074603 /nfs/dbraw/zinc/07/46/03/332074603.db2.gz AWYAYABGSDAMGA-WCQYABFASA-N 1 2 319.392 4.156 20 0 DIADLO CC(C)c1ccc(C[N@H+](C)Cc2ncnn2-c2ccccc2)cc1 ZINC000410313757 332110331 /nfs/dbraw/zinc/11/03/31/332110331.db2.gz WVIOFCKNUXIYEG-UHFFFAOYSA-N 1 2 320.440 4.023 20 0 DIADLO CC(C)c1ccc(C[N@@H+](C)Cc2ncnn2-c2ccccc2)cc1 ZINC000410313757 332110333 /nfs/dbraw/zinc/11/03/33/332110333.db2.gz WVIOFCKNUXIYEG-UHFFFAOYSA-N 1 2 320.440 4.023 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(C)n1)c1ccc(Cl)c(Cl)c1Cl ZINC000213135544 332111277 /nfs/dbraw/zinc/11/12/77/332111277.db2.gz BQYGUXKHPKFBRJ-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO CCCc1csc(C[N@H+](CCOC)[C@H](C)c2ccccc2)n1 ZINC000426401331 332114374 /nfs/dbraw/zinc/11/43/74/332114374.db2.gz OMNVYUUTHJMUHL-OAHLLOKOSA-N 1 2 318.486 4.305 20 0 DIADLO CCCc1csc(C[N@@H+](CCOC)[C@H](C)c2ccccc2)n1 ZINC000426401331 332114376 /nfs/dbraw/zinc/11/43/76/332114376.db2.gz OMNVYUUTHJMUHL-OAHLLOKOSA-N 1 2 318.486 4.305 20 0 DIADLO CO[C@H](C)CSCCCCCn1c(C)[nH+]c2ccccc21 ZINC000569519870 332122332 /nfs/dbraw/zinc/12/23/32/332122332.db2.gz YYMWMLHWNOSNDR-CQSZACIVSA-N 1 2 306.475 4.283 20 0 DIADLO CO[C@@H](C)CSCCCCCn1c(C)[nH+]c2ccccc21 ZINC000569519869 332122359 /nfs/dbraw/zinc/12/23/59/332122359.db2.gz YYMWMLHWNOSNDR-AWEZNQCLSA-N 1 2 306.475 4.283 20 0 DIADLO Cc1ccccc1NC(=O)[C@H](C)[N@H+](C)Cc1ccccc1Cl ZINC000016376593 332131862 /nfs/dbraw/zinc/13/18/62/332131862.db2.gz VZGAXHDUDYRGBF-AWEZNQCLSA-N 1 2 316.832 4.107 20 0 DIADLO Cc1ccccc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccccc1Cl ZINC000016376593 332131865 /nfs/dbraw/zinc/13/18/65/332131865.db2.gz VZGAXHDUDYRGBF-AWEZNQCLSA-N 1 2 316.832 4.107 20 0 DIADLO Cc1nc([C@H]([NH2+]C[C@H]2CCC[C@H](C)C2)c2ccccc2F)no1 ZINC000092565703 332133689 /nfs/dbraw/zinc/13/36/89/332133689.db2.gz HIOFJPJZSOFTPT-RVSPLBMKSA-N 1 2 317.408 4.022 20 0 DIADLO Cc1ccc[nH+]c1CCc1noc(C(C)(C)c2ccccc2C)n1 ZINC000569559351 332137858 /nfs/dbraw/zinc/13/78/58/332137858.db2.gz CYHHINXGYATJQT-UHFFFAOYSA-N 1 2 321.424 4.193 20 0 DIADLO CC(C)(C)Cc1nc2cc(N[C@H]3CCn4cc[nH+]c43)ccc2o1 ZINC000569559572 332137940 /nfs/dbraw/zinc/13/79/40/332137940.db2.gz UWGWVBYROLLUNM-ZDUSSCGKSA-N 1 2 310.401 4.170 20 0 DIADLO Cc1nc(N[C@H](COc2ccccc2)c2ccccc2)cc[nH+]1 ZINC000426898010 332160645 /nfs/dbraw/zinc/16/06/45/332160645.db2.gz JUHQLTNYZFEBCB-GOSISDBHSA-N 1 2 305.381 4.017 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@H](C)OC[C@H]1c1ccccc1 ZINC000428245153 332164106 /nfs/dbraw/zinc/16/41/06/332164106.db2.gz LUGYJEFAVYLWQO-YOEHRIQHSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@H](C)OC[C@H]1c1ccccc1 ZINC000428245153 332164108 /nfs/dbraw/zinc/16/41/08/332164108.db2.gz LUGYJEFAVYLWQO-YOEHRIQHSA-N 1 2 314.429 4.068 20 0 DIADLO Fc1cccc([C@H]([NH2+]Cc2cocn2)c2cccc(Cl)c2)c1 ZINC000181109655 332175709 /nfs/dbraw/zinc/17/57/09/332175709.db2.gz VUCOIFYNKYYVMR-QGZVFWFLSA-N 1 2 316.763 4.346 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(-c2ccco2)cc1F)c1ccn(C)n1 ZINC000448024320 332190281 /nfs/dbraw/zinc/19/02/81/332190281.db2.gz XQTKYSLCIIHZOO-INIZCTEOSA-N 1 2 313.376 4.060 20 0 DIADLO CCCCC1CCC(C(=O)NCc2[nH+]ccn2CC(C)C)CC1 ZINC000525607161 332198709 /nfs/dbraw/zinc/19/87/09/332198709.db2.gz SHWFBFXKPJAPLO-UHFFFAOYSA-N 1 2 319.493 4.152 20 0 DIADLO CC[C@H](Nc1ccc(C(F)(F)F)c(OC)c1)c1[nH+]ccn1C ZINC000448029044 332201744 /nfs/dbraw/zinc/20/17/44/332201744.db2.gz PNXXXSIKPIJHMF-LBPRGKRZSA-N 1 2 313.323 4.011 20 0 DIADLO CSCc1cnc(C[N@@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)s1 ZINC000449463311 332234814 /nfs/dbraw/zinc/23/48/14/332234814.db2.gz VVVCOKJZMDCPDB-UWVGGRQHSA-N 1 2 324.437 4.169 20 0 DIADLO CSCc1cnc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)s1 ZINC000449463311 332234816 /nfs/dbraw/zinc/23/48/16/332234816.db2.gz VVVCOKJZMDCPDB-UWVGGRQHSA-N 1 2 324.437 4.169 20 0 DIADLO CSCc1cnc(C[N@@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)s1 ZINC000449463313 332234833 /nfs/dbraw/zinc/23/48/33/332234833.db2.gz VVVCOKJZMDCPDB-ZJUUUORDSA-N 1 2 324.437 4.169 20 0 DIADLO CSCc1cnc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)s1 ZINC000449463313 332234835 /nfs/dbraw/zinc/23/48/35/332234835.db2.gz VVVCOKJZMDCPDB-ZJUUUORDSA-N 1 2 324.437 4.169 20 0 DIADLO CC(C)CCn1c2ccccc2nc1SCCn1cc[nH+]c1 ZINC000536446283 332247573 /nfs/dbraw/zinc/24/75/73/332247573.db2.gz AXVOATDWJXNAOM-UHFFFAOYSA-N 1 2 314.458 4.071 20 0 DIADLO COc1ccc[nH+]c1NCc1ccc(F)c(Cl)c1Cl ZINC000555762229 332265631 /nfs/dbraw/zinc/26/56/31/332265631.db2.gz LICDJZLHRXWCBI-UHFFFAOYSA-N 1 2 301.148 4.148 20 0 DIADLO Fc1cc(CNc2cccc(-n3cc[nH+]c3)c2)ccc1Cl ZINC000043389066 332269637 /nfs/dbraw/zinc/26/96/37/332269637.db2.gz QXOHGEJXHDJTDJ-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO CC(F)(F)C[NH2+][C@H]1CCSc2ccc(Br)cc21 ZINC000559876713 332288207 /nfs/dbraw/zinc/28/82/07/332288207.db2.gz BJQNNUIEPBGOAI-JTQLQIEISA-N 1 2 322.218 4.231 20 0 DIADLO Cc1cc(C(=O)Nc2c(C)cc(C)[nH+]c2C)c2nccc(C)c2c1 ZINC000560043861 332305704 /nfs/dbraw/zinc/30/57/04/332305704.db2.gz XAHKVWIQWLURGG-UHFFFAOYSA-N 1 2 319.408 4.424 20 0 DIADLO CC[C@@H]1COCC[N@@H+]1Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000560260870 332324848 /nfs/dbraw/zinc/32/48/48/332324848.db2.gz AOBFHZIHRXUMIE-CQSZACIVSA-N 1 2 322.861 4.074 20 0 DIADLO CC[C@@H]1COCC[N@H+]1Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000560260870 332324849 /nfs/dbraw/zinc/32/48/49/332324849.db2.gz AOBFHZIHRXUMIE-CQSZACIVSA-N 1 2 322.861 4.074 20 0 DIADLO C[C@@H]([NH2+][C@@H](Cc1ccccc1)c1ccccc1F)c1ncc[nH]1 ZINC000560530058 332352215 /nfs/dbraw/zinc/35/22/15/332352215.db2.gz YRLBNYZOHGUHIC-KDOFPFPSSA-N 1 2 309.388 4.183 20 0 DIADLO C[C@@H](Nc1cccc(COc2cccc(F)c2)c1)c1[nH]cc[nH+]1 ZINC000560548562 332357804 /nfs/dbraw/zinc/35/78/04/332357804.db2.gz IVQUWMMXYCYZJY-CYBMUJFWSA-N 1 2 311.360 4.301 20 0 DIADLO CC(C)[C@@H]1CC[C@H]1Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000560553251 332358744 /nfs/dbraw/zinc/35/87/44/332358744.db2.gz PNPHMTQAXATHFH-QFBILLFUSA-N 1 2 307.441 4.448 20 0 DIADLO C[C@H]([NH2+]Cc1cccc2[nH]ccc21)c1noc(-c2ccccc2)n1 ZINC000153234426 332365070 /nfs/dbraw/zinc/36/50/70/332365070.db2.gz DQVURTWLKATBIJ-ZDUSSCGKSA-N 1 2 318.380 4.069 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CCCC[C@H]3c3cc[nH]n3)cc2c1C ZINC000564494910 332371609 /nfs/dbraw/zinc/37/16/09/332371609.db2.gz GTHFBMHUPGDEAR-IBGZPJMESA-N 1 2 308.429 4.235 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CCCC[C@H]3c3cc[nH]n3)cc2c1C ZINC000564494910 332371610 /nfs/dbraw/zinc/37/16/10/332371610.db2.gz GTHFBMHUPGDEAR-IBGZPJMESA-N 1 2 308.429 4.235 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@@H](c1ccccc1)C(F)(F)F ZINC000425585917 335107149 /nfs/dbraw/zinc/10/71/49/335107149.db2.gz JIHTYMCLQSRVMI-AWEZNQCLSA-N 1 2 322.330 4.373 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+](C)[C@@H](C)c1cccnc1 ZINC000583388865 332380680 /nfs/dbraw/zinc/38/06/80/332380680.db2.gz IFMPIXGNWNRECV-ZDUSSCGKSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000583388865 332380681 /nfs/dbraw/zinc/38/06/81/332380681.db2.gz IFMPIXGNWNRECV-ZDUSSCGKSA-N 1 2 304.821 4.327 20 0 DIADLO Cc1ccc(Cl)c(O[C@H](C)C(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000425588085 335107708 /nfs/dbraw/zinc/10/77/08/335107708.db2.gz POBPZFKCZNJTFE-CYBMUJFWSA-N 1 2 318.804 4.066 20 0 DIADLO Cc1ccc(CCCNc2cnn(CC(C)C)c2C2CC2)c[nH+]1 ZINC000583408619 332392003 /nfs/dbraw/zinc/39/20/03/332392003.db2.gz GJHLDTRCZGRZHB-UHFFFAOYSA-N 1 2 312.461 4.165 20 0 DIADLO CC(C)c1ncc(C[NH2+]Cc2ncc(-c3ccccc3)cn2)s1 ZINC000564502437 332394049 /nfs/dbraw/zinc/39/40/49/332394049.db2.gz MHRYSXQTDSIRFK-UHFFFAOYSA-N 1 2 324.453 4.013 20 0 DIADLO CCc1ccccc1NC(=O)C[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000561108751 332411933 /nfs/dbraw/zinc/41/19/33/332411933.db2.gz TYZFACFTOVMUPK-QGZVFWFLSA-N 1 2 319.408 4.133 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)CSc1ccccc1 ZINC000425583515 335106716 /nfs/dbraw/zinc/10/67/16/335106716.db2.gz AURDUZXDLOVGRZ-ZDUSSCGKSA-N 1 2 300.427 4.065 20 0 DIADLO CC(C)[C@@H]1CC[C@@H](Nc2ccc(Cn3cc[nH+]c3)cn2)C[C@H]1C ZINC000561398238 332446372 /nfs/dbraw/zinc/44/63/72/332446372.db2.gz RPSPANMUSJUGPU-NXHRZFHOSA-N 1 2 312.461 4.199 20 0 DIADLO CC(C)CCC1CCN(C(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC000566591226 332487938 /nfs/dbraw/zinc/48/79/38/332487938.db2.gz VNLMXCNEJLRUBK-UHFFFAOYSA-N 1 2 314.433 4.014 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)c(C(F)(F)F)cc1F)c1ccco1 ZINC000561886911 332511326 /nfs/dbraw/zinc/51/13/26/332511326.db2.gz CEMHYNGJMNDLLE-MRVPVSSYSA-N 1 2 305.246 4.427 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(C2CC2)cc1)c1noc(-c2ccccc2)n1 ZINC000569684737 332659676 /nfs/dbraw/zinc/65/96/76/332659676.db2.gz ILZDIXZVSYEQPS-AWEZNQCLSA-N 1 2 319.408 4.465 20 0 DIADLO CC(C)(C)C[C@@H]([NH2+]C1CCC2(CCCO2)CC1)C(F)(F)F ZINC000570220478 332726812 /nfs/dbraw/zinc/72/68/12/332726812.db2.gz UGNCPOHBQVEFNN-JVWICGRDSA-N 1 2 307.400 4.435 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)oc1C ZINC000570412476 332752270 /nfs/dbraw/zinc/75/22/70/332752270.db2.gz LTWNUAHHPZIBKL-KBXCAEBGSA-N 1 2 309.413 4.070 20 0 DIADLO CC[C@H](CC(=O)N[C@H](c1[nH]cc[nH+]1)C(C)C)c1ccc(C)cc1 ZINC000570465512 332759933 /nfs/dbraw/zinc/75/99/33/332759933.db2.gz LHVXKGZIMVNDBT-QAPCUYQASA-N 1 2 313.445 4.115 20 0 DIADLO Cc1ccc[nH+]c1CCc1noc(-c2ccccc2OC(C)C)n1 ZINC000580696855 332955748 /nfs/dbraw/zinc/95/57/48/332955748.db2.gz NZLSNSGOKZUVKM-UHFFFAOYSA-N 1 2 323.396 4.012 20 0 DIADLO Cc1ccc(NC(=O)NC(C)(C)c2ccc(F)c(F)c2)c(C)[nH+]1 ZINC000176766114 332955982 /nfs/dbraw/zinc/95/59/82/332955982.db2.gz GGSYIVCCBYMCPD-UHFFFAOYSA-N 1 2 319.355 4.033 20 0 DIADLO CC(C)C1(CNC(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000177409103 332985905 /nfs/dbraw/zinc/98/59/05/332985905.db2.gz YRDFHYZXWOJQIR-UHFFFAOYSA-N 1 2 310.397 4.040 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cccc1Br)c1cccc(O)c1 ZINC000181509680 333030718 /nfs/dbraw/zinc/03/07/18/333030718.db2.gz RPLFJMPBPPVXHF-SNVBAGLBSA-N 1 2 324.193 4.145 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2nc(C(C)(C)C)cs2)C1 ZINC000460348563 333068251 /nfs/dbraw/zinc/06/82/51/333068251.db2.gz MHMKSPLMBGGPDS-HIFRSBDPSA-N 1 2 315.486 4.419 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2nc(C(C)(C)C)cs2)C1 ZINC000460348563 333068252 /nfs/dbraw/zinc/06/82/52/333068252.db2.gz MHMKSPLMBGGPDS-HIFRSBDPSA-N 1 2 315.486 4.419 20 0 DIADLO CCCCc1nc(C[NH2+][C@@](C)(CC)c2nccs2)cs1 ZINC000173500106 333074491 /nfs/dbraw/zinc/07/44/91/333074491.db2.gz SGAPFPCEYZMLMW-HNNXBMFYSA-N 1 2 309.504 4.357 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1OC(F)F)c1c(F)cccc1F ZINC000314106118 333087805 /nfs/dbraw/zinc/08/78/05/333087805.db2.gz BYYCYINHPFTFTR-JTQLQIEISA-N 1 2 313.294 4.417 20 0 DIADLO CC(C)(C)[C@@H]1C[C@@H](Nc2cc(C(F)(F)F)cc[nH+]2)CCO1 ZINC000487125303 333112629 /nfs/dbraw/zinc/11/26/29/333112629.db2.gz ZPPUIUFAMWOHNO-RYUDHWBXSA-N 1 2 302.340 4.106 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)nn1C ZINC000487404442 333132537 /nfs/dbraw/zinc/13/25/37/333132537.db2.gz AGIALVIMZJGBSE-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)nn1C ZINC000487404442 333132539 /nfs/dbraw/zinc/13/25/39/333132539.db2.gz AGIALVIMZJGBSE-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(CC2CCCCC2)n1 ZINC000460747894 333133598 /nfs/dbraw/zinc/13/35/98/333133598.db2.gz JSVSDNXPQSBEAU-UHFFFAOYSA-N 1 2 324.428 4.153 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc([C@@H]2CCC[C@H](C)C2)n1 ZINC000460747846 333133658 /nfs/dbraw/zinc/13/36/58/333133658.db2.gz JBZMCRHRPBIWRU-UONOGXRCSA-N 1 2 324.428 4.324 20 0 DIADLO CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1c(C)cc[nH+]c1C ZINC000425591500 335124458 /nfs/dbraw/zinc/12/44/58/335124458.db2.gz ZVZBKOHDAXNOHL-CQSZACIVSA-N 1 2 318.804 4.148 20 0 DIADLO CCn1cc([C@@H](C)[NH2+][C@@H](c2cccc(C)c2)c2ccccn2)cn1 ZINC000179535418 333152315 /nfs/dbraw/zinc/15/23/15/333152315.db2.gz GIWXKWZZMDTMGV-UZLBHIALSA-N 1 2 320.440 4.047 20 0 DIADLO C[C@H]1CCCC[N@H+](CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000187920550 333153458 /nfs/dbraw/zinc/15/34/58/333153458.db2.gz ZPQGZAYBHOYGPJ-NSHDSACASA-N 1 2 315.244 4.054 20 0 DIADLO C[C@H]1CCCC[N@@H+](CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000187920550 333153459 /nfs/dbraw/zinc/15/34/59/333153459.db2.gz ZPQGZAYBHOYGPJ-NSHDSACASA-N 1 2 315.244 4.054 20 0 DIADLO CC[C@H](Nc1cccc(OCCC(C)C)c1)c1[nH+]ccn1C ZINC000180318099 333160790 /nfs/dbraw/zinc/16/07/90/333160790.db2.gz KRABEVIIODZAHW-KRWDZBQOSA-N 1 2 301.434 4.408 20 0 DIADLO Cc1nc([C@H]([NH2+][C@@H]2CCC[C@H](C)C2)c2ccc(Cl)cc2)no1 ZINC000182681717 333179759 /nfs/dbraw/zinc/17/97/59/333179759.db2.gz ZHGSHRHCMGDEHA-IUIKQTSFSA-N 1 2 319.836 4.289 20 0 DIADLO C[C@@H](Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1)c1ccncc1 ZINC000182924540 333181313 /nfs/dbraw/zinc/18/13/13/333181313.db2.gz JSFLGHLNNVBQIQ-OAHLLOKOSA-N 1 2 318.424 4.455 20 0 DIADLO COC(=O)[C@H]([NH2+]CC1(c2ccccc2)CCCC1)c1ccccc1 ZINC000522752866 333189067 /nfs/dbraw/zinc/18/90/67/333189067.db2.gz SRCGLLQUQTYFFY-LJQANCHMSA-N 1 2 323.436 4.002 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2csc(-c3ccoc3)n2)s1 ZINC000183972042 333190488 /nfs/dbraw/zinc/19/04/88/333190488.db2.gz CCHZADAIYBJIKR-UHFFFAOYSA-N 1 2 319.455 4.193 20 0 DIADLO CCc1sc(C(=O)Nc2ccc3c(c2)[nH+]c(C)n3C)cc1C ZINC000525730823 333201641 /nfs/dbraw/zinc/20/16/41/333201641.db2.gz QPQZZUPSZOELBC-UHFFFAOYSA-N 1 2 313.426 4.066 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000497590682 333266166 /nfs/dbraw/zinc/26/61/66/333266166.db2.gz LZCGSXAZPKATDI-RDTXWAMCSA-N 1 2 301.817 4.475 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000497590682 333266167 /nfs/dbraw/zinc/26/61/67/333266167.db2.gz LZCGSXAZPKATDI-RDTXWAMCSA-N 1 2 301.817 4.475 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@@](C)(F)C2)oc1-c1ccc(Cl)cc1 ZINC000501425737 333273001 /nfs/dbraw/zinc/27/30/01/333273001.db2.gz RRINRONYYJIGDI-MRXNPFEDSA-N 1 2 308.784 4.237 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@@](C)(F)C2)oc1-c1ccc(Cl)cc1 ZINC000501425737 333273003 /nfs/dbraw/zinc/27/30/03/333273003.db2.gz RRINRONYYJIGDI-MRXNPFEDSA-N 1 2 308.784 4.237 20 0 DIADLO C[C@@H](CC(=O)N1CCC[C@H]1c1[nH]c2c([nH+]1)CCCC2)C(C)(C)C ZINC000497670671 333276629 /nfs/dbraw/zinc/27/66/29/333276629.db2.gz HNRICHZJPFVNKD-BBRMVZONSA-N 1 2 317.477 4.024 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1c(F)cccc1F ZINC000497710506 333280914 /nfs/dbraw/zinc/28/09/14/333280914.db2.gz JYPHUNGKZHFIOH-ZJUUUORDSA-N 1 2 308.397 4.322 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Nc2cc[nH+]c(C)c2)o1 ZINC000120471893 333284763 /nfs/dbraw/zinc/28/47/63/333284763.db2.gz ROEWNDTZAPRUKU-WBMJQRKESA-N 1 2 313.401 4.297 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2ccc3cc(OC)ccc3c2)o1 ZINC000525783531 333309267 /nfs/dbraw/zinc/30/92/67/333309267.db2.gz KUJMSVYZASEIIO-UHFFFAOYSA-N 1 2 310.397 4.031 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2ccc3cc(OC)ccc3c2)o1 ZINC000525783531 333309269 /nfs/dbraw/zinc/30/92/69/333309269.db2.gz KUJMSVYZASEIIO-UHFFFAOYSA-N 1 2 310.397 4.031 20 0 DIADLO c1coc(-c2nc(C[N@@H+]3CCC[C@H]3c3ccccn3)cs2)c1 ZINC000531201494 333330532 /nfs/dbraw/zinc/33/05/32/333330532.db2.gz XXRAIMXTEHJBDS-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO c1coc(-c2nc(C[N@H+]3CCC[C@H]3c3ccccn3)cs2)c1 ZINC000531201494 333330533 /nfs/dbraw/zinc/33/05/33/333330533.db2.gz XXRAIMXTEHJBDS-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO Fc1ccccc1C1CCN(c2cc[nH+]c3ccncc32)CC1 ZINC000531253385 333338241 /nfs/dbraw/zinc/33/82/41/333338241.db2.gz UAXWQPBDPCSWQU-UHFFFAOYSA-N 1 2 307.372 4.153 20 0 DIADLO Cc1ocnc1C(=O)Nc1ccc2[nH]c(C3CCCCC3)[nH+]c2c1 ZINC000531267597 333338994 /nfs/dbraw/zinc/33/89/94/333338994.db2.gz LNBVPQRUMWXVIB-UHFFFAOYSA-N 1 2 324.384 4.159 20 0 DIADLO CCCCN(C(=O)c1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000531436359 333352756 /nfs/dbraw/zinc/35/27/56/333352756.db2.gz JXIBXSNURCBRDX-UHFFFAOYSA-N 1 2 319.408 4.319 20 0 DIADLO Cc1cc2[nH+]cn(CC(=O)c3ccc4c(c3)CCC4)c2cc1C ZINC000319637322 333392240 /nfs/dbraw/zinc/39/22/40/333392240.db2.gz CPYUWOZQCHVHTR-UHFFFAOYSA-N 1 2 304.393 4.025 20 0 DIADLO Fc1cc2[nH+]cn(Cc3ccccc3C(F)(F)F)c2cc1F ZINC000319956658 333419350 /nfs/dbraw/zinc/41/93/50/333419350.db2.gz NPDDSEGCVWNARC-UHFFFAOYSA-N 1 2 312.241 4.382 20 0 DIADLO CSCc1cccc(NCc2ccc(N(C)C(C)C)[nH+]c2)c1 ZINC000564791163 333446520 /nfs/dbraw/zinc/44/65/20/333446520.db2.gz BSHYRJSRURRAIS-UHFFFAOYSA-N 1 2 315.486 4.401 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@@H]2CCOc3ccccc32)cs1 ZINC000067184135 333447564 /nfs/dbraw/zinc/44/75/64/333447564.db2.gz QKSJCNFJTYMLHN-CQSZACIVSA-N 1 2 302.443 4.054 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1csc(C(C)(C)C)n1 ZINC000067183999 333447566 /nfs/dbraw/zinc/44/75/66/333447566.db2.gz KSBRFWLDLLQWQX-LBPRGKRZSA-N 1 2 304.459 4.300 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2csc(-c3ccccn3)n2)c(C)o1 ZINC000124896585 333502059 /nfs/dbraw/zinc/50/20/59/333502059.db2.gz SWOCHHAOCWUIHM-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO c1cc(C[NH2+][C@@H](CCCc2ccccc2)c2ccccc2)[nH]n1 ZINC000066990317 335144913 /nfs/dbraw/zinc/14/49/13/335144913.db2.gz FBZKPYDKFZFXFQ-FQEVSTJZSA-N 1 2 305.425 4.264 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+]C[C@@H](C)c1ccccc1 ZINC000237611244 333521714 /nfs/dbraw/zinc/52/17/14/333521714.db2.gz XLWRHFBTIWILOT-QGZVFWFLSA-N 1 2 310.441 4.047 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1COc1ccccc1NC(=O)C1CC1 ZINC000563612489 333637228 /nfs/dbraw/zinc/63/72/28/333637228.db2.gz MHUDPMMCHSFKTF-UHFFFAOYSA-N 1 2 324.424 4.441 20 0 DIADLO CC1(C)CCc2ccccc2[C@H]([NH2+]Cc2nnsc2Cl)C1 ZINC000571267339 333692504 /nfs/dbraw/zinc/69/25/04/333692504.db2.gz XDSSDRKSZKDYSE-CYBMUJFWSA-N 1 2 321.877 4.385 20 0 DIADLO Cc1ccc(C(=O)N2CCCC[C@@H]2c2[nH]cc[nH+]2)c2ccccc12 ZINC000411771877 333705589 /nfs/dbraw/zinc/70/55/89/333705589.db2.gz QYURJLPWWCRQNM-GOSISDBHSA-N 1 2 319.408 4.239 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3nccs3)cs2)o1 ZINC000411878954 333711533 /nfs/dbraw/zinc/71/15/33/333711533.db2.gz XZLBPJMDAHPMDZ-JTQLQIEISA-N 1 2 305.428 4.019 20 0 DIADLO Cc1cc(NC(=O)[C@@H](C)CC(F)F)ccc1Oc1cc[nH+]cc1 ZINC000412291827 333744737 /nfs/dbraw/zinc/74/47/37/333744737.db2.gz SRSGVGRDPIBFJL-LBPRGKRZSA-N 1 2 320.339 4.412 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccn(C(C)C)n1 ZINC000571468855 333793005 /nfs/dbraw/zinc/79/30/05/333793005.db2.gz VVOCVGSBOJPKGF-ZDUSSCGKSA-N 1 2 321.852 4.367 20 0 DIADLO c1nc(C2CCC2)sc1CNc1ccc(N2CCCC2)c[nH+]1 ZINC000343358833 335159369 /nfs/dbraw/zinc/15/93/69/335159369.db2.gz HKBZUSNIFFPSAE-UHFFFAOYSA-N 1 2 314.458 4.018 20 0 DIADLO C[C@H]1CC(C)(C)CN1C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000412767424 333795677 /nfs/dbraw/zinc/79/56/77/333795677.db2.gz OMCOZUQSYWHDOG-AWEZNQCLSA-N 1 2 310.397 4.135 20 0 DIADLO CCc1cc(C[NH2+][C@H](C)c2csc(-c3ccccc3)n2)on1 ZINC000571502928 333807095 /nfs/dbraw/zinc/80/70/95/333807095.db2.gz UWIPJGZULUSJNH-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO CC(C)[C@@H](C)S[C@@H](C)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000412999893 333824688 /nfs/dbraw/zinc/82/46/88/333824688.db2.gz NRAJENCQCPRAAF-OLZOCXBDSA-N 1 2 317.458 4.181 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@H](C)c2ccn(C)n2)c2ccccc2)cc1 ZINC000414060654 333889128 /nfs/dbraw/zinc/88/91/28/333889128.db2.gz YBMBNSNXUZDBFN-OXQOHEQNSA-N 1 2 305.425 4.169 20 0 DIADLO Cc1noc(C)c1C[NH2+][C@@H](C)c1csc(-c2ccccc2)n1 ZINC000414070468 333891045 /nfs/dbraw/zinc/89/10/45/333891045.db2.gz LGFQKSIVEQDHEY-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1cc2n(n1)CCC2 ZINC000414130536 333899795 /nfs/dbraw/zinc/89/97/95/333899795.db2.gz WQAXRGAFQNSOFA-WDEREUQCSA-N 1 2 307.800 4.034 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@H](C)c2nc3c(s2)CCC3)c(F)c1 ZINC000414142002 333902108 /nfs/dbraw/zinc/90/21/08/333902108.db2.gz IRQVMZPITDFPJP-GHMZBOCLSA-N 1 2 320.433 4.191 20 0 DIADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1csc(-c2ccccc2)n1 ZINC000414154363 333904348 /nfs/dbraw/zinc/90/43/48/333904348.db2.gz TVGLJUQHZWPRKX-KCQAQPDRSA-N 1 2 324.453 4.363 20 0 DIADLO CCn1ccc(C[NH2+][C@H](c2ccccc2)c2ccc(C)cc2)n1 ZINC000414216338 333922892 /nfs/dbraw/zinc/92/28/92/333922892.db2.gz ZQBAVAIMQDVGQA-HXUWFJFHSA-N 1 2 305.425 4.091 20 0 DIADLO Cc1cc(C)c([C@H](C)[NH2+]Cc2nccc(C(F)(F)F)n2)cc1C ZINC000414231008 333926733 /nfs/dbraw/zinc/92/67/33/333926733.db2.gz BNDBUCXXQZQWGE-ZDUSSCGKSA-N 1 2 323.362 4.271 20 0 DIADLO Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]Cc1nccc(C(F)(F)F)n1 ZINC000414258664 333928641 /nfs/dbraw/zinc/92/86/41/333928641.db2.gz PMOVXFVUIGTIJD-WCQYABFASA-N 1 2 321.346 4.142 20 0 DIADLO Cc1ccc(C[S@@](=O)C2CCC(C(F)(F)F)CC2)c(C)[nH+]1 ZINC000414269846 333931253 /nfs/dbraw/zinc/93/12/53/333931253.db2.gz PGESDTFPCNJUFE-OCJVHDGVSA-N 1 2 319.392 4.068 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H](C)c2csnn2)c2ccccc12 ZINC000414308348 333937026 /nfs/dbraw/zinc/93/70/26/333937026.db2.gz SSRQUIXDTUOLMS-NWDGAFQWSA-N 1 2 313.426 4.112 20 0 DIADLO Cn1ccc([C@H]([NH2+][C@@H]2CCCC[C@H]2F)c2ccc(Cl)cc2)n1 ZINC000414315159 333938085 /nfs/dbraw/zinc/93/80/85/333938085.db2.gz RPVFYKZHXVOVIQ-BFYDXBDKSA-N 1 2 321.827 4.033 20 0 DIADLO Cn1ccc([C@@H]([NH2+][C@@H]2CCCC[C@H]2F)c2ccc(Cl)cc2)n1 ZINC000414315160 333938103 /nfs/dbraw/zinc/93/81/03/333938103.db2.gz RPVFYKZHXVOVIQ-INMHGKMJSA-N 1 2 321.827 4.033 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nnc(C2CC2)s1)c1cc(F)ccc1F ZINC000414320136 333939166 /nfs/dbraw/zinc/93/91/66/333939166.db2.gz BETHCGFFMUTMNF-HNNXBMFYSA-N 1 2 323.412 4.181 20 0 DIADLO CCn1ccc(C[NH2+]Cc2c(Cl)cccc2SC(C)C)n1 ZINC000414488330 333995680 /nfs/dbraw/zinc/99/56/80/333995680.db2.gz WNAKXJRXMQCENU-UHFFFAOYSA-N 1 2 323.893 4.347 20 0 DIADLO COCC[C@@H]([NH2+]Cc1csc(C(C)(C)C)n1)c1ccc(C)o1 ZINC000272273246 334032587 /nfs/dbraw/zinc/03/25/87/334032587.db2.gz KTOQSUMFKZKUPB-CQSZACIVSA-N 1 2 322.474 4.209 20 0 DIADLO C[C@@H](CC1CCCC1)c1nc(-c2ccnc(-n3cc[nH+]c3)c2)no1 ZINC000273734421 334050168 /nfs/dbraw/zinc/05/01/68/334050168.db2.gz APZUPNIMAIMOHA-ZDUSSCGKSA-N 1 2 323.400 4.001 20 0 DIADLO Cn1ncc(Cl)c1C[N@H+](Cc1cccc(F)c1)C1CCCC1 ZINC000437578851 334052296 /nfs/dbraw/zinc/05/22/96/334052296.db2.gz KHGYUNRDWOUPLL-UHFFFAOYSA-N 1 2 321.827 4.157 20 0 DIADLO Cn1ncc(Cl)c1C[N@@H+](Cc1cccc(F)c1)C1CCCC1 ZINC000437578851 334052297 /nfs/dbraw/zinc/05/22/97/334052297.db2.gz KHGYUNRDWOUPLL-UHFFFAOYSA-N 1 2 321.827 4.157 20 0 DIADLO Cn1ncc(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000437583388 334053263 /nfs/dbraw/zinc/05/32/63/334053263.db2.gz SKROGACYZIKKCW-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1ncc(Cl)c1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000437583388 334053264 /nfs/dbraw/zinc/05/32/64/334053264.db2.gz SKROGACYZIKKCW-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ccc(Cl)cc3F)CCC2)n1 ZINC000275517690 334071701 /nfs/dbraw/zinc/07/17/01/334071701.db2.gz YSEMHEIFMNHRGV-UHFFFAOYSA-N 1 2 310.825 4.413 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)nc1 ZINC000276401970 334077037 /nfs/dbraw/zinc/07/70/37/334077037.db2.gz UMFCWZMNSCOYIA-OAHLLOKOSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)nc1 ZINC000276401970 334077038 /nfs/dbraw/zinc/07/70/38/334077038.db2.gz UMFCWZMNSCOYIA-OAHLLOKOSA-N 1 2 313.401 4.168 20 0 DIADLO CC(C)c1cccc(C(C)C)c1NC(=O)COc1cc[nH+]cc1 ZINC000276495406 334080083 /nfs/dbraw/zinc/08/00/83/334080083.db2.gz WAIDIZYCKOAFDI-UHFFFAOYSA-N 1 2 312.413 4.346 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)Cc1cccc(C)n1 ZINC000437903457 334081293 /nfs/dbraw/zinc/08/12/93/334081293.db2.gz SZFVAXFZKWVIHW-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)Cc1cccc(C)n1 ZINC000437903457 334081295 /nfs/dbraw/zinc/08/12/95/334081295.db2.gz SZFVAXFZKWVIHW-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)s1 ZINC000343818725 335195377 /nfs/dbraw/zinc/19/53/77/335195377.db2.gz OWLGUMZMDBMSBK-ZETCQYMHSA-N 1 2 321.393 4.086 20 0 DIADLO CC[C@@H](C(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccc(F)cc1 ZINC000414787322 334096408 /nfs/dbraw/zinc/09/64/08/334096408.db2.gz MOKPCYVUNYXRPO-MRXNPFEDSA-N 1 2 300.377 4.278 20 0 DIADLO C[C@@H]([NH2+]C1(c2c(Cl)cccc2Cl)CCC1)c1ccnn1C ZINC000278514735 334097240 /nfs/dbraw/zinc/09/72/40/334097240.db2.gz RTTOOQJSMNIHLT-LLVKDONJSA-N 1 2 324.255 4.457 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1cn(C(C)C)nc1C ZINC000343509043 335173019 /nfs/dbraw/zinc/17/30/19/335173019.db2.gz JEATUCCYECYBLT-UHFFFAOYSA-N 1 2 321.852 4.066 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1cn(C(C)C)nc1C ZINC000343509043 335173020 /nfs/dbraw/zinc/17/30/20/335173020.db2.gz JEATUCCYECYBLT-UHFFFAOYSA-N 1 2 321.852 4.066 20 0 DIADLO FC(F)(F)c1ncc(CNc2ccc3c(c2)CCC[NH2+]3)s1 ZINC000414846703 334117946 /nfs/dbraw/zinc/11/79/46/334117946.db2.gz HNCBPQVMJMFLLS-UHFFFAOYSA-N 1 2 313.348 4.132 20 0 DIADLO CC(C)(C)n1ncnc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000283709110 334141085 /nfs/dbraw/zinc/14/10/85/334141085.db2.gz ZGEBJFHUDQSYRV-HNNXBMFYSA-N 1 2 318.852 4.024 20 0 DIADLO CC(C)(C)n1ncnc1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000283709110 334141087 /nfs/dbraw/zinc/14/10/87/334141087.db2.gz ZGEBJFHUDQSYRV-HNNXBMFYSA-N 1 2 318.852 4.024 20 0 DIADLO CCCn1c(C)nnc1C[N@H+](CC)Cc1ccc2ccccc2c1 ZINC000343666240 335181074 /nfs/dbraw/zinc/18/10/74/335181074.db2.gz RICNZLFNEHNMIE-UHFFFAOYSA-N 1 2 322.456 4.172 20 0 DIADLO CCCn1c(C)nnc1C[N@@H+](CC)Cc1ccc2ccccc2c1 ZINC000343666240 335181076 /nfs/dbraw/zinc/18/10/76/335181076.db2.gz RICNZLFNEHNMIE-UHFFFAOYSA-N 1 2 322.456 4.172 20 0 DIADLO CC1=CC[N@H+](Cc2csc(COc3ccc(F)cc3)n2)CC1 ZINC000534479226 334276561 /nfs/dbraw/zinc/27/65/61/334276561.db2.gz JIVDALYDRGSKGW-UHFFFAOYSA-N 1 2 318.417 4.013 20 0 DIADLO CC1=CC[N@@H+](Cc2csc(COc3ccc(F)cc3)n2)CC1 ZINC000534479226 334276564 /nfs/dbraw/zinc/27/65/64/334276564.db2.gz JIVDALYDRGSKGW-UHFFFAOYSA-N 1 2 318.417 4.013 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1noc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000299063484 334252379 /nfs/dbraw/zinc/25/23/79/334252379.db2.gz MRVZUCOVKIWRLF-HNNXBMFYSA-N 1 2 305.809 4.087 20 0 DIADLO CCSc1ccccc1[C@H](C)[NH2+]Cc1nn(C)cc1Cl ZINC000453330519 334254086 /nfs/dbraw/zinc/25/40/86/334254086.db2.gz WZWNOCZGOPUHJI-NSHDSACASA-N 1 2 309.866 4.036 20 0 DIADLO Cc1cccc2[nH+]c(CNc3cccc(C(C)(F)F)c3)cn21 ZINC000187571766 334265181 /nfs/dbraw/zinc/26/51/81/334265181.db2.gz KXRQCQHJWYLHEP-UHFFFAOYSA-N 1 2 301.340 4.367 20 0 DIADLO C[C@@H](Nc1cnn([C@@H](C)C2CC2)c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000187623265 334267770 /nfs/dbraw/zinc/26/77/70/334267770.db2.gz LGFJREMGUTYVRG-CABCVRRESA-N 1 2 321.428 4.213 20 0 DIADLO Cc1ccc(OCc2nc(C[N@H+]3CC=C(C)CC3)cs2)cc1 ZINC000534472991 334271712 /nfs/dbraw/zinc/27/17/12/334271712.db2.gz LHKBOYVYNDJOFY-UHFFFAOYSA-N 1 2 314.454 4.183 20 0 DIADLO Cc1ccc(OCc2nc(C[N@@H+]3CC=C(C)CC3)cs2)cc1 ZINC000534472991 334271713 /nfs/dbraw/zinc/27/17/13/334271713.db2.gz LHKBOYVYNDJOFY-UHFFFAOYSA-N 1 2 314.454 4.183 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C(C)(C)Cc3ccccc3)cc2[nH+]1 ZINC000531930508 334291234 /nfs/dbraw/zinc/29/12/34/334291234.db2.gz APVZTCQQMIGIQO-UHFFFAOYSA-N 1 2 307.397 4.079 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)cc1 ZINC000531943818 334300020 /nfs/dbraw/zinc/30/00/20/334300020.db2.gz CLMSFQLFOUURCE-APWZRJJASA-N 1 2 305.425 4.169 20 0 DIADLO COc1c(C)cc(C[N@H+](C)Cc2ncc(C(C)(C)C)o2)cc1C ZINC000101566178 334327803 /nfs/dbraw/zinc/32/78/03/334327803.db2.gz PWWZHQZKJVGECN-UHFFFAOYSA-N 1 2 316.445 4.230 20 0 DIADLO COc1c(C)cc(C[N@@H+](C)Cc2ncc(C(C)(C)C)o2)cc1C ZINC000101566178 334327804 /nfs/dbraw/zinc/32/78/04/334327804.db2.gz PWWZHQZKJVGECN-UHFFFAOYSA-N 1 2 316.445 4.230 20 0 DIADLO C[C@@H]1C[N@H+](C/C=C/c2ccccc2)C[C@H](c2ccc(F)cc2)O1 ZINC000303862562 334337234 /nfs/dbraw/zinc/33/72/34/334337234.db2.gz GVHHTNCKLVGOOV-AXIKGPDFSA-N 1 2 311.400 4.301 20 0 DIADLO C[C@@H]1C[N@@H+](C/C=C/c2ccccc2)C[C@H](c2ccc(F)cc2)O1 ZINC000303862562 334337235 /nfs/dbraw/zinc/33/72/35/334337235.db2.gz GVHHTNCKLVGOOV-AXIKGPDFSA-N 1 2 311.400 4.301 20 0 DIADLO Brc1ccc(C[N@@H+]2CCc3ccsc3C2)s1 ZINC000534864073 334341988 /nfs/dbraw/zinc/34/19/88/334341988.db2.gz SROHADQPLHSXKE-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO Brc1ccc(C[N@H+]2CCc3ccsc3C2)s1 ZINC000534864073 334341989 /nfs/dbraw/zinc/34/19/89/334341989.db2.gz SROHADQPLHSXKE-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO CC(C)c1cc(N2CCC[C@@H]2c2ccccn2)nc(C(C)C)[nH+]1 ZINC000534881614 334343388 /nfs/dbraw/zinc/34/33/88/334343388.db2.gz SQQJDBODBBNJPB-QGZVFWFLSA-N 1 2 310.445 4.460 20 0 DIADLO Cc1cccc2[nH+]c(CNc3ccccc3OC(F)(F)F)cn21 ZINC000303935946 334346503 /nfs/dbraw/zinc/34/65/03/334346503.db2.gz ROBZLODXOCYQDR-UHFFFAOYSA-N 1 2 321.302 4.153 20 0 DIADLO CC(C)Cn1cc[nH+]c1CNC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1 ZINC000303927520 334347764 /nfs/dbraw/zinc/34/77/64/334347764.db2.gz PENWXYLTKYANGF-HZPDHXFCSA-N 1 2 319.493 4.008 20 0 DIADLO C[N@H+](Cc1nc2ccc(F)cc2o1)Cc1ccc(Cl)c(F)c1 ZINC000534963831 334350167 /nfs/dbraw/zinc/35/01/67/334350167.db2.gz NHMFFUGEOYXLTN-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO C[N@@H+](Cc1nc2ccc(F)cc2o1)Cc1ccc(Cl)c(F)c1 ZINC000534963831 334350168 /nfs/dbraw/zinc/35/01/68/334350168.db2.gz NHMFFUGEOYXLTN-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)CC(C)(C)O1 ZINC000535084635 334366790 /nfs/dbraw/zinc/36/67/90/334366790.db2.gz WNZUCDPRMKRLFL-ZDUSSCGKSA-N 1 2 308.491 4.190 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)CC(C)(C)O1 ZINC000535084635 334366792 /nfs/dbraw/zinc/36/67/92/334366792.db2.gz WNZUCDPRMKRLFL-ZDUSSCGKSA-N 1 2 308.491 4.190 20 0 DIADLO Cc1ccc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)cc1 ZINC000112183415 334368717 /nfs/dbraw/zinc/36/87/17/334368717.db2.gz CYSRERGZSGOJPD-UHFFFAOYSA-N 1 2 304.349 4.435 20 0 DIADLO CCCN(Cc1ccc(C)cc1)C(=O)Nc1ccc(C)[nH+]c1C ZINC000532033850 334381527 /nfs/dbraw/zinc/38/15/27/334381527.db2.gz RARBIEJYVYNWEC-UHFFFAOYSA-N 1 2 311.429 4.451 20 0 DIADLO O=C(Cc1ccc(F)cc1)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1 ZINC000340902491 334389656 /nfs/dbraw/zinc/38/96/56/334389656.db2.gz HNAZTGWLMDZBNH-UHFFFAOYSA-N 1 2 323.371 4.151 20 0 DIADLO O=C(C[C@H]1C[C@@H]1c1ccccc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000340951101 334396077 /nfs/dbraw/zinc/39/60/77/334396077.db2.gz JRYUGAPVMBQOCI-VQIMIIECSA-N 1 2 317.392 4.005 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](C)Cc1ncc(Br)s1 ZINC000340922691 334397612 /nfs/dbraw/zinc/39/76/12/334397612.db2.gz WCCZLRZLEUTTQR-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ncc(Br)s1 ZINC000340922691 334397614 /nfs/dbraw/zinc/39/76/14/334397614.db2.gz WCCZLRZLEUTTQR-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO Fc1ccccc1Oc1ccc(C[NH2+]Cc2cocn2)cc1F ZINC000341230118 334420614 /nfs/dbraw/zinc/42/06/14/334420614.db2.gz POQALWZSGQSNQF-UHFFFAOYSA-N 1 2 316.307 4.035 20 0 DIADLO CC[C@@H](C)n1ncc(NCc2c[nH+]c3ccc(C)cn23)c1C1CC1 ZINC000341254012 334425534 /nfs/dbraw/zinc/42/55/34/334425534.db2.gz DRCRBZDKAPFJEQ-CQSZACIVSA-N 1 2 323.444 4.300 20 0 DIADLO COc1cc[nH+]cc1COc1ccc(-c2csc(C)n2)cc1 ZINC000341265763 334426833 /nfs/dbraw/zinc/42/68/33/334426833.db2.gz DSNHAEQWJYUHPG-UHFFFAOYSA-N 1 2 312.394 4.101 20 0 DIADLO Cc1cc(N(C)[C@@H](C)c2c(F)cccc2F)nc(C2CC2)[nH+]1 ZINC000341476931 334451931 /nfs/dbraw/zinc/45/19/31/334451931.db2.gz GERLKIISTJFRBG-NSHDSACASA-N 1 2 303.356 4.138 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1ncc(C)o1)c1ccccc1OC(F)F ZINC000341659278 334463599 /nfs/dbraw/zinc/46/35/99/334463599.db2.gz NHXVXQSFFWCOMM-DGCLKSJQSA-N 1 2 310.344 4.386 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+]Cc2occc2C(=O)OC)cc1 ZINC000341772819 334474872 /nfs/dbraw/zinc/47/48/72/334474872.db2.gz AAVVKZVCRUODER-GFCCVEGCSA-N 1 2 319.426 4.029 20 0 DIADLO COc1cc[nH+]cc1CSCc1nc2ccccc2s1 ZINC000341962181 334498003 /nfs/dbraw/zinc/49/80/03/334498003.db2.gz CBKYBKDKLDWEOX-UHFFFAOYSA-N 1 2 302.424 4.133 20 0 DIADLO COc1cc[nH+]cc1CSCc1ncc(Cl)cc1Cl ZINC000342004573 334500320 /nfs/dbraw/zinc/50/03/20/334500320.db2.gz SXAWGLBRFSCQCK-UHFFFAOYSA-N 1 2 315.225 4.225 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc(C2CC2)cs1)c1nc(C)cs1 ZINC000342754649 334566980 /nfs/dbraw/zinc/56/69/80/334566980.db2.gz SNWDSFSROKFGPF-OAHLLOKOSA-N 1 2 307.488 4.200 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1cc(C(F)(F)F)cc[nH+]1)CCO2 ZINC000342884939 334586605 /nfs/dbraw/zinc/58/66/05/334586605.db2.gz SBUINMWVBVRYIU-ZDUSSCGKSA-N 1 2 324.302 4.045 20 0 DIADLO CCSc1cccc(C(=O)Nc2ccccc2-n2cc[nH+]c2)c1 ZINC000343132082 334602651 /nfs/dbraw/zinc/60/26/51/334602651.db2.gz HFCFCEDRGLJADD-UHFFFAOYSA-N 1 2 323.421 4.237 20 0 DIADLO CCC(CC)CN(CC)C(=O)c1cc(C)ccc1-n1cc[nH+]c1 ZINC000343133986 334602860 /nfs/dbraw/zinc/60/28/60/334602860.db2.gz BCZNMNKQAQFHKM-UHFFFAOYSA-N 1 2 313.445 4.079 20 0 DIADLO Cc1nccnc1[C@H](C)[NH2+][C@@H](c1ccccc1)c1cccc(F)c1 ZINC000188136572 334655771 /nfs/dbraw/zinc/65/57/71/334655771.db2.gz NRKYNQGXQKETCM-YWZLYKJASA-N 1 2 321.399 4.364 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1cc(F)c(F)c(F)c1 ZINC000188278685 334672175 /nfs/dbraw/zinc/67/21/75/334672175.db2.gz IMFQAYFRCPIGOE-UHFFFAOYSA-N 1 2 315.722 4.056 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1C ZINC000330653690 334795517 /nfs/dbraw/zinc/79/55/17/334795517.db2.gz RUPRWKIINGNZRU-KBPBESRZSA-N 1 2 301.434 4.396 20 0 DIADLO CCc1noc(C)c1C[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000330862307 334816113 /nfs/dbraw/zinc/81/61/13/334816113.db2.gz QFUATZDKJDVEEF-JTQLQIEISA-N 1 2 307.463 4.150 20 0 DIADLO CS[C@@H]1CC[C@@H]1Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000425353613 334836264 /nfs/dbraw/zinc/83/62/64/334836264.db2.gz IUBVOJKGDIKRNV-DLBZAZTESA-N 1 2 313.470 4.192 20 0 DIADLO C[C@H](Nc1cc[nH+]c2ccncc12)c1ccccc1C(F)(F)F ZINC000444079788 338467888 /nfs/dbraw/zinc/46/78/88/338467888.db2.gz ZFCZFWSWRTXSTQ-NSHDSACASA-N 1 2 317.314 4.244 20 0 DIADLO c1ccc(C[C@H]2CCCN(c3cc[nH+]c4ccncc43)C2)cc1 ZINC000444087863 338468123 /nfs/dbraw/zinc/46/81/23/338468123.db2.gz RNVBXVLIZJJCHF-QGZVFWFLSA-N 1 2 303.409 4.089 20 0 DIADLO C[C@H]1C[C@@H](c2ccc(F)cc2)CN1c1cc[nH+]c2ccncc21 ZINC000444092248 338468173 /nfs/dbraw/zinc/46/81/73/338468173.db2.gz SKSJFVHQOMRNLE-DZGCQCFKSA-N 1 2 307.372 4.151 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)Nc1cc[nH+]c2ccncc12 ZINC000444111459 338468370 /nfs/dbraw/zinc/46/83/70/338468370.db2.gz UPGWVVDIJNSNPU-ZDUSSCGKSA-N 1 2 303.365 4.279 20 0 DIADLO CCn1c2ccccc2nc1[C@@H](C)[NH2+]Cc1cc(F)ccc1F ZINC000127039870 334873995 /nfs/dbraw/zinc/87/39/95/334873995.db2.gz YONOZJIVOOBJDH-GFCCVEGCSA-N 1 2 315.367 4.185 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000563700704 334884840 /nfs/dbraw/zinc/88/48/40/334884840.db2.gz LHSXWSIWLUBWDQ-LBPRGKRZSA-N 1 2 321.424 4.057 20 0 DIADLO FC(F)C1([NH2+]Cc2ccc(-c3ccccn3)nc2)CCCCC1 ZINC000425457456 334912443 /nfs/dbraw/zinc/91/24/43/334912443.db2.gz KQZJIUJLYXIQAD-UHFFFAOYSA-N 1 2 317.383 4.201 20 0 DIADLO COc1cncc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)c1 ZINC000343794581 335193309 /nfs/dbraw/zinc/19/33/09/335193309.db2.gz MAIKZRISFGWWMJ-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1cncc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)c1 ZINC000343794581 335193311 /nfs/dbraw/zinc/19/33/11/335193311.db2.gz MAIKZRISFGWWMJ-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1cccc2c(N[C@H](C)c3c(F)cncc3F)cc[nH+]c12 ZINC000343798977 335193768 /nfs/dbraw/zinc/19/37/68/335193768.db2.gz ZJUWQXIKGALXHL-SNVBAGLBSA-N 1 2 315.323 4.090 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)n1 ZINC000343845647 335196695 /nfs/dbraw/zinc/19/66/95/335196695.db2.gz YFCSFICQMXACHE-SFYZADRCSA-N 1 2 321.393 4.339 20 0 DIADLO Cc1sc(C[NH2+]Cc2ncc(C(C)C)s2)nc1C(C)C ZINC000344122292 335219050 /nfs/dbraw/zinc/21/90/50/335219050.db2.gz QPEUZUHBGCQYCL-UHFFFAOYSA-N 1 2 309.504 4.445 20 0 DIADLO Cc1sc(C[NH2+]Cc2cc(F)c(F)c(F)c2)nc1C(C)C ZINC000344148119 335221912 /nfs/dbraw/zinc/22/19/12/335221912.db2.gz FOSJZQAIEKLTMU-UHFFFAOYSA-N 1 2 314.376 4.282 20 0 DIADLO CC(C)(Cc1ccccc1)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000344258848 335233543 /nfs/dbraw/zinc/23/35/43/335233543.db2.gz SUTAAUWUCSCVAM-UHFFFAOYSA-N 1 2 319.408 4.080 20 0 DIADLO CC[C@@]1(C)CCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000344328413 335241080 /nfs/dbraw/zinc/24/10/80/335241080.db2.gz VRSZOOHWKUODGV-IBGZPJMESA-N 1 2 310.397 4.136 20 0 DIADLO Cc1cc2cc(C[NH2+]Cc3nnc(C(C)C)s3)oc2cc1C ZINC000344626088 335264919 /nfs/dbraw/zinc/26/49/19/335264919.db2.gz AQJPAXMORPTHID-UHFFFAOYSA-N 1 2 315.442 4.314 20 0 DIADLO CCCCOc1ccc(C[NH2+]Cc2nnc(C(C)C)s2)cc1 ZINC000344680281 335266046 /nfs/dbraw/zinc/26/60/46/335266046.db2.gz NBEAMCJUMSIMMV-UHFFFAOYSA-N 1 2 319.474 4.130 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2cncc(F)c2)C2CC2)o1 ZINC000344699047 335267964 /nfs/dbraw/zinc/26/79/64/335267964.db2.gz XGYMGFADDOOIRU-SJKOYZFVSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cncc(F)c2)C2CC2)o1 ZINC000344699047 335267966 /nfs/dbraw/zinc/26/79/66/335267966.db2.gz XGYMGFADDOOIRU-SJKOYZFVSA-N 1 2 300.377 4.102 20 0 DIADLO CCc1nnc(C[N@H+](C)[C@@H](c2ccccc2Cl)C(C)C)o1 ZINC000113256418 335283640 /nfs/dbraw/zinc/28/36/40/335283640.db2.gz WZRVFVTYYKJQNR-MRXNPFEDSA-N 1 2 307.825 4.115 20 0 DIADLO CCc1nnc(C[N@@H+](C)[C@@H](c2ccccc2Cl)C(C)C)o1 ZINC000113256418 335283642 /nfs/dbraw/zinc/28/36/42/335283642.db2.gz WZRVFVTYYKJQNR-MRXNPFEDSA-N 1 2 307.825 4.115 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CCS[C@H](C)[C@H]1c1ccccc1 ZINC000345158260 335302431 /nfs/dbraw/zinc/30/24/31/335302431.db2.gz PUZASUFEKKRSQR-QAPCUYQASA-N 1 2 315.486 4.143 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CCS[C@H](C)[C@H]1c1ccccc1 ZINC000345158260 335302433 /nfs/dbraw/zinc/30/24/33/335302433.db2.gz PUZASUFEKKRSQR-QAPCUYQASA-N 1 2 315.486 4.143 20 0 DIADLO C[C@H]1CC[C@@H](C(=O)Nc2ccc(-c3cn4c([nH+]3)CCCC4)cc2)C1 ZINC000345133626 335304338 /nfs/dbraw/zinc/30/43/38/335304338.db2.gz AUIIHBZZUFZRFN-GOEBONIOSA-N 1 2 323.440 4.261 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)C[C@H]1C[C@H](C(C)C)c2ccccc21 ZINC000345906744 335360088 /nfs/dbraw/zinc/36/00/88/335360088.db2.gz OOMXXTPNTAVQRX-CRAIPNDOSA-N 1 2 308.425 4.068 20 0 DIADLO CCc1cnc(C[N@H+]2CC=C(c3ccc(F)cc3)CC2)s1 ZINC000346188827 335388308 /nfs/dbraw/zinc/38/83/08/335388308.db2.gz YAYZWTSVLFPNPP-UHFFFAOYSA-N 1 2 302.418 4.134 20 0 DIADLO CCc1cnc(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)s1 ZINC000346188827 335388310 /nfs/dbraw/zinc/38/83/10/335388310.db2.gz YAYZWTSVLFPNPP-UHFFFAOYSA-N 1 2 302.418 4.134 20 0 DIADLO CC(C)c1cnc(C[NH2+]Cc2cc(-c3ccccc3)on2)s1 ZINC000346437326 335407840 /nfs/dbraw/zinc/40/78/40/335407840.db2.gz NNHKQGYBAXAATH-UHFFFAOYSA-N 1 2 313.426 4.211 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)c(C(F)(F)F)cc1F)c1nccs1 ZINC000347233027 335476779 /nfs/dbraw/zinc/47/67/79/335476779.db2.gz PNJVEVRDFSXNEL-ZETCQYMHSA-N 1 2 322.302 4.291 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](CCO)c2ccc(Cl)cc2)cs1 ZINC000347424587 335495447 /nfs/dbraw/zinc/49/54/47/335495447.db2.gz DAFZEAXCBOKNKK-HNNXBMFYSA-N 1 2 324.877 4.133 20 0 DIADLO CCO[C@@H](C)c1noc(C[NH2+][C@H](CC(C)C)c2cccs2)n1 ZINC000347611666 335510568 /nfs/dbraw/zinc/51/05/68/335510568.db2.gz NEHCPAIJRYLKFZ-QWHCGFSZSA-N 1 2 323.462 4.106 20 0 DIADLO CCCC1(CNC(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000348105688 335553834 /nfs/dbraw/zinc/55/38/34/335553834.db2.gz QKCBAPZTTLCWGP-UHFFFAOYSA-N 1 2 310.397 4.184 20 0 DIADLO Cc1cc(N[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)nc[nH+]1 ZINC000348116319 335554892 /nfs/dbraw/zinc/55/48/92/335554892.db2.gz JXQKQRSKIRAXBI-KRWDZBQOSA-N 1 2 324.815 4.229 20 0 DIADLO CCCC1(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CC1 ZINC000348328518 335577881 /nfs/dbraw/zinc/57/78/81/335577881.db2.gz LEBOQIAHPKXEOA-UHFFFAOYSA-N 1 2 303.793 4.045 20 0 DIADLO CN(Cc1[nH+]ccn1Cc1ccccc1)c1ccc2cc[nH]c2c1 ZINC000348332453 335582680 /nfs/dbraw/zinc/58/26/80/335582680.db2.gz UUEPKHLXZPWXSA-UHFFFAOYSA-N 1 2 316.408 4.049 20 0 DIADLO Cc1csc(C2([NH2+]Cc3nc(C)sc3C)CCCC2)n1 ZINC000348397791 335583844 /nfs/dbraw/zinc/58/38/44/335583844.db2.gz BGJDICABANCNFA-UHFFFAOYSA-N 1 2 307.488 4.084 20 0 DIADLO Cc1ccc(NC(=O)N(C)[C@@H](C)Cc2ccccc2C)c(C)[nH+]1 ZINC000444898362 338491701 /nfs/dbraw/zinc/49/17/01/338491701.db2.gz HIJDIATYIYOCNQ-HNNXBMFYSA-N 1 2 311.429 4.102 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2nc(-c3ccsc3)oc2C)s1 ZINC000348488708 335590473 /nfs/dbraw/zinc/59/04/73/335590473.db2.gz FIJYMNRPOLUPIH-SNVBAGLBSA-N 1 2 319.455 4.327 20 0 DIADLO CC1(C)CC[C@@H]1NC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000349322047 335663200 /nfs/dbraw/zinc/66/32/00/335663200.db2.gz MXKVJDNSHJNBMY-INIZCTEOSA-N 1 2 311.385 4.184 20 0 DIADLO CCSc1cccc(C[NH2+]Cc2csc([C@H](C)OC)n2)c1 ZINC000349648392 335688365 /nfs/dbraw/zinc/68/83/65/335688365.db2.gz ZDRFFAWTURHNER-LBPRGKRZSA-N 1 2 322.499 4.252 20 0 DIADLO O=C(NC1(C2CCC2)CCC1)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000583549975 335717565 /nfs/dbraw/zinc/71/75/65/335717565.db2.gz BEGPLNRKHHPPQC-UHFFFAOYSA-N 1 2 322.408 4.327 20 0 DIADLO Cc1cc(N2CCc3sccc3[C@@H]2C)nc(-c2ccncc2)[nH+]1 ZINC000350716811 335775913 /nfs/dbraw/zinc/77/59/13/335775913.db2.gz XTGOCQLPHUAXTG-ZDUSSCGKSA-N 1 2 322.437 4.032 20 0 DIADLO Fc1cc(F)cc(C[NH+]2CC(c3nc4ccccc4s3)C2)c1 ZINC000527324224 335807935 /nfs/dbraw/zinc/80/79/35/335807935.db2.gz YXUQQGCWSRHLLI-UHFFFAOYSA-N 1 2 316.376 4.174 20 0 DIADLO Cc1cc(N[C@@H](C)c2cc(F)c(Cl)cc2Cl)nc[nH+]1 ZINC000520308698 335958039 /nfs/dbraw/zinc/95/80/39/335958039.db2.gz BGLOUDXZQYMVFJ-QMMMGPOBSA-N 1 2 300.164 4.404 20 0 DIADLO Cc1[nH+]c2cc(CNC(=O)Nc3ccccc3)ccc2n1C1CC1 ZINC000583641330 336013230 /nfs/dbraw/zinc/01/32/30/336013230.db2.gz MVAGVSGTZAVWNK-UHFFFAOYSA-N 1 2 320.396 4.001 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2ccc3c(c2)CC(C)(C)O3)s1 ZINC000354011658 336016409 /nfs/dbraw/zinc/01/64/09/336016409.db2.gz VYRIMWHDAJPBHF-UHFFFAOYSA-N 1 2 316.470 4.051 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2ccc3c(c2)CC(C)(C)O3)s1 ZINC000354011658 336016410 /nfs/dbraw/zinc/01/64/10/336016410.db2.gz VYRIMWHDAJPBHF-UHFFFAOYSA-N 1 2 316.470 4.051 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1CN1CCSc2ccccc21 ZINC000445796975 338509773 /nfs/dbraw/zinc/50/97/73/338509773.db2.gz DJJPDCJAEUTNFR-UHFFFAOYSA-N 1 2 321.449 4.044 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc([C@@H]2CCC[C@H](C)C2)n1 ZINC000329630788 336020204 /nfs/dbraw/zinc/02/02/04/336020204.db2.gz VPCCDXUIUNQORS-DZGCQCFKSA-N 1 2 324.428 4.264 20 0 DIADLO Cc1nc(NC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)oc1C ZINC000351543173 336041912 /nfs/dbraw/zinc/04/19/12/336041912.db2.gz VMHOIIGTFSDBIP-UHFFFAOYSA-N 1 2 324.340 4.123 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)no1 ZINC000351572201 336046037 /nfs/dbraw/zinc/04/60/37/336046037.db2.gz CHNYPRQCSBVMDK-RYUDHWBXSA-N 1 2 305.447 4.290 20 0 DIADLO c1nc(C2CCC2)sc1C[N@@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000351572836 336046053 /nfs/dbraw/zinc/04/60/53/336046053.db2.gz GJJDZBRLWJGDGF-QGZVFWFLSA-N 1 2 320.502 4.192 20 0 DIADLO c1nc(C2CCC2)sc1C[N@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000351572836 336046055 /nfs/dbraw/zinc/04/60/55/336046055.db2.gz GJJDZBRLWJGDGF-QGZVFWFLSA-N 1 2 320.502 4.192 20 0 DIADLO COc1cccc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)c1 ZINC000351610909 336049982 /nfs/dbraw/zinc/04/99/82/336049982.db2.gz FAWXUUBBHVRFIJ-UHFFFAOYSA-N 1 2 320.348 4.135 20 0 DIADLO COc1ccc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)cc1 ZINC000351611714 336050253 /nfs/dbraw/zinc/05/02/53/336050253.db2.gz IRNSHUQDKPSKDL-UHFFFAOYSA-N 1 2 320.348 4.135 20 0 DIADLO Cc1ccc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)s1 ZINC000351612878 336050292 /nfs/dbraw/zinc/05/02/92/336050292.db2.gz QCOXHXQUDBECHU-UHFFFAOYSA-N 1 2 310.378 4.496 20 0 DIADLO Cc1ccc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)c(C)n1 ZINC000351612107 336050345 /nfs/dbraw/zinc/05/03/45/336050345.db2.gz LRIRGILNCFAQFK-UHFFFAOYSA-N 1 2 319.364 4.138 20 0 DIADLO CC(C)c1cnc(NCc2[nH+]ccn2Cc2ccccc2)s1 ZINC000351767412 336066120 /nfs/dbraw/zinc/06/61/20/336066120.db2.gz DIHDUXQOMLFKTN-UHFFFAOYSA-N 1 2 312.442 4.123 20 0 DIADLO COCc1cccc(C[N@@H+]2CCc3[nH]c4ccc(F)cc4c3C2)c1 ZINC000351822964 336070457 /nfs/dbraw/zinc/07/04/57/336070457.db2.gz ZGALNEBAXOQIRT-UHFFFAOYSA-N 1 2 324.399 4.012 20 0 DIADLO COCc1cccc(C[N@H+]2CCc3[nH]c4ccc(F)cc4c3C2)c1 ZINC000351822964 336070458 /nfs/dbraw/zinc/07/04/58/336070458.db2.gz ZGALNEBAXOQIRT-UHFFFAOYSA-N 1 2 324.399 4.012 20 0 DIADLO Cc1ccc(NC(=O)NC[C@H]2CCCCC(F)(F)C2)c(C)[nH+]1 ZINC000331948209 336153978 /nfs/dbraw/zinc/15/39/78/336153978.db2.gz HAUQUUBBKHBSPW-ZDUSSCGKSA-N 1 2 311.376 4.036 20 0 DIADLO CC[C@@H]1Cc2ccccc2CN1C(=O)Nc1c(C)cc[nH+]c1C ZINC000351923677 336178877 /nfs/dbraw/zinc/17/88/77/336178877.db2.gz ZOKXTFKYLUOVHY-QGZVFWFLSA-N 1 2 309.413 4.067 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)Cc1ccc(F)cc1Cl ZINC000351931117 336180617 /nfs/dbraw/zinc/18/06/17/336180617.db2.gz OKYNLFKYXRLQMW-UHFFFAOYSA-N 1 2 321.783 4.155 20 0 DIADLO O=C(Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1)c1occ2c1CCC2 ZINC000351972694 336184719 /nfs/dbraw/zinc/18/47/19/336184719.db2.gz SRJYPBVIQFXUBN-UHFFFAOYSA-N 1 2 321.380 4.164 20 0 DIADLO CC[N@H+](Cc1ncnn1CC(C)C)Cc1ccc2ccccc2c1 ZINC000351985419 336186129 /nfs/dbraw/zinc/18/61/29/336186129.db2.gz WKSJSHBQRSYINQ-UHFFFAOYSA-N 1 2 322.456 4.109 20 0 DIADLO CC[N@@H+](Cc1ncnn1CC(C)C)Cc1ccc2ccccc2c1 ZINC000351985419 336186130 /nfs/dbraw/zinc/18/61/30/336186130.db2.gz WKSJSHBQRSYINQ-UHFFFAOYSA-N 1 2 322.456 4.109 20 0 DIADLO COCCCC[N@H+](Cc1ncc(Cl)s1)Cc1ccccc1 ZINC000351993957 336186678 /nfs/dbraw/zinc/18/66/78/336186678.db2.gz DGLLRSTWWUBIRD-UHFFFAOYSA-N 1 2 324.877 4.225 20 0 DIADLO COCCCC[N@@H+](Cc1ncc(Cl)s1)Cc1ccccc1 ZINC000351993957 336186679 /nfs/dbraw/zinc/18/66/79/336186679.db2.gz DGLLRSTWWUBIRD-UHFFFAOYSA-N 1 2 324.877 4.225 20 0 DIADLO C[N@H+](Cc1ncc(Cl)s1)Cc1ccc(OC(F)F)cc1 ZINC000351997250 336187286 /nfs/dbraw/zinc/18/72/86/336187286.db2.gz SRANHMDMLOXJQL-UHFFFAOYSA-N 1 2 318.776 4.030 20 0 DIADLO C[N@@H+](Cc1ncc(Cl)s1)Cc1ccc(OC(F)F)cc1 ZINC000351997250 336187287 /nfs/dbraw/zinc/18/72/87/336187287.db2.gz SRANHMDMLOXJQL-UHFFFAOYSA-N 1 2 318.776 4.030 20 0 DIADLO CCCOc1cccc2c(NCCc3nccs3)cc[nH+]c12 ZINC000352068201 336192826 /nfs/dbraw/zinc/19/28/26/336192826.db2.gz HDDHAOXRTMRFHR-UHFFFAOYSA-N 1 2 313.426 4.135 20 0 DIADLO Clc1cccc2c1CC[N@H+](Cc1cnn(-c3ccccc3)c1)C2 ZINC000352223196 336204179 /nfs/dbraw/zinc/20/41/79/336204179.db2.gz QMJWJQUTEXTXQF-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1cccc2c1CC[N@@H+](Cc1cnn(-c3ccccc3)c1)C2 ZINC000352223196 336204180 /nfs/dbraw/zinc/20/41/80/336204180.db2.gz QMJWJQUTEXTXQF-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO CCCC[C@@H](C)C(=O)NCc1ccc2c(c1)[nH+]c(C)n2C1CC1 ZINC000352409432 336216273 /nfs/dbraw/zinc/21/62/73/336216273.db2.gz ZRPXOXWUHAZPJB-CYBMUJFWSA-N 1 2 313.445 4.122 20 0 DIADLO Cc1c(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)ccn1C(C)C ZINC000352414168 336216972 /nfs/dbraw/zinc/21/69/72/336216972.db2.gz SQYDFVICTYZOND-UHFFFAOYSA-N 1 2 322.412 4.328 20 0 DIADLO Cc1nc(C(=O)Nc2ccc(C)[nH+]c2C)c(-c2ccccc2)s1 ZINC000352443732 336219361 /nfs/dbraw/zinc/21/93/61/336219361.db2.gz PTILPAPNYITVBN-UHFFFAOYSA-N 1 2 323.421 4.383 20 0 DIADLO CCSCc1cc[nH+]c(N[C@@H](C)Cc2ccc(O)cc2)c1 ZINC000352704875 336231603 /nfs/dbraw/zinc/23/16/03/336231603.db2.gz LTICRBCLYNQTIB-ZDUSSCGKSA-N 1 2 302.443 4.083 20 0 DIADLO C[C@@H]1CC[C@H](c2ccccc2)[N@H+](Cc2nccn2C(F)F)C1 ZINC000352799195 336238642 /nfs/dbraw/zinc/23/86/42/336238642.db2.gz FQPLJCZLHBVVPY-UKRRQHHQSA-N 1 2 305.372 4.251 20 0 DIADLO C[C@@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2nccn2C(F)F)C1 ZINC000352799195 336238643 /nfs/dbraw/zinc/23/86/43/336238643.db2.gz FQPLJCZLHBVVPY-UKRRQHHQSA-N 1 2 305.372 4.251 20 0 DIADLO Brc1ccccc1C[N@@H+]1CCc2sccc2C1 ZINC000042229701 336239333 /nfs/dbraw/zinc/23/93/33/336239333.db2.gz OUPIUMBZVFSTTM-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1ccccc1C[N@H+]1CCc2sccc2C1 ZINC000042229701 336239334 /nfs/dbraw/zinc/23/93/34/336239334.db2.gz OUPIUMBZVFSTTM-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Cc1occc1CN(C)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000352803357 336239950 /nfs/dbraw/zinc/23/99/50/336239950.db2.gz AKWZBNSWCBMLMP-UHFFFAOYSA-N 1 2 322.364 4.048 20 0 DIADLO Cc1cccc2[nH+]c(CNC(=O)Nc3ccc(C(C)C)cc3)cn21 ZINC000532348952 336243664 /nfs/dbraw/zinc/24/36/64/336243664.db2.gz QUSPNWPIPGEQDB-UHFFFAOYSA-N 1 2 322.412 4.088 20 0 DIADLO Cc1ccccc1SCC(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000103966953 336244197 /nfs/dbraw/zinc/24/41/97/336244197.db2.gz OKDVURUFZJSHIT-UHFFFAOYSA-N 1 2 323.421 4.116 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nccn1C)c1ccc(Cl)cc1)c1ccoc1 ZINC000532455673 336248317 /nfs/dbraw/zinc/24/83/17/336248317.db2.gz DINAWNJUZFFVGS-MLGOLLRUSA-N 1 2 315.804 4.107 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nccn1C)c1ccc(Cl)cc1)c1ccoc1 ZINC000532455674 336248329 /nfs/dbraw/zinc/24/83/29/336248329.db2.gz DINAWNJUZFFVGS-WBMJQRKESA-N 1 2 315.804 4.107 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nccn1C)c1ccc(Cl)cc1)c1ccoc1 ZINC000532455658 336248340 /nfs/dbraw/zinc/24/83/40/336248340.db2.gz DINAWNJUZFFVGS-BLLLJJGKSA-N 1 2 315.804 4.107 20 0 DIADLO Cc1cc(C)cc([C@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)c1 ZINC000532452337 336250069 /nfs/dbraw/zinc/25/00/69/336250069.db2.gz MJPYPGBQGGWTNG-FXAWDEMLSA-N 1 2 319.452 4.477 20 0 DIADLO CCc1cc(C[NH2+][C@H](C)c2cc(Cl)sc2Cl)on1 ZINC000532520216 336253439 /nfs/dbraw/zinc/25/34/39/336253439.db2.gz CGKXOISLMQGRJL-SSDOTTSWSA-N 1 2 305.230 4.456 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3coc(-c4cccs4)n3)CC2)cc1 ZINC000532723860 336268489 /nfs/dbraw/zinc/26/84/89/336268489.db2.gz YPSCPLMDEHGTNO-UHFFFAOYSA-N 1 2 314.385 4.321 20 0 DIADLO Cc1ccccc1C[N@@H+](C)[C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000532749340 336269498 /nfs/dbraw/zinc/26/94/98/336269498.db2.gz FXOZOXGDDITNJD-INIZCTEOSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1ccccc1C[N@H+](C)[C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000532749340 336269499 /nfs/dbraw/zinc/26/94/99/336269499.db2.gz FXOZOXGDDITNJD-INIZCTEOSA-N 1 2 321.424 4.162 20 0 DIADLO CCc1nc(C[N@H+](C)[C@H]2CCc3c2cccc3Cl)cs1 ZINC000532779392 336270829 /nfs/dbraw/zinc/27/08/29/336270829.db2.gz QNBYUKCKJWACQD-HNNXBMFYSA-N 1 2 306.862 4.478 20 0 DIADLO CCc1nc(C[N@@H+](C)[C@H]2CCc3c2cccc3Cl)cs1 ZINC000532779392 336270830 /nfs/dbraw/zinc/27/08/30/336270830.db2.gz QNBYUKCKJWACQD-HNNXBMFYSA-N 1 2 306.862 4.478 20 0 DIADLO CSc1ccc(CNc2ccc(-n3cc[nH+]c3)c(F)c2)s1 ZINC000352834695 336271414 /nfs/dbraw/zinc/27/14/14/336271414.db2.gz IOOHANXNGNAVDX-UHFFFAOYSA-N 1 2 319.430 4.407 20 0 DIADLO C[C@H]1C[C@H](C)N1C(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000526933482 336275427 /nfs/dbraw/zinc/27/54/27/336275427.db2.gz KSASJZOGDWVJTI-RYUDHWBXSA-N 1 2 316.788 4.150 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc2[nH]c(C(C)(C)C)[nH+]c2c1)n1cccc1 ZINC000526999877 336278971 /nfs/dbraw/zinc/27/89/71/336278971.db2.gz BHOCNKDGOALAEH-ZDUSSCGKSA-N 1 2 324.428 4.252 20 0 DIADLO CC(C)Cn1ccnc1C[NH2+]C1c2ccccc2-c2ccccc21 ZINC000182681075 336280660 /nfs/dbraw/zinc/28/06/60/336280660.db2.gz RXRMDVSNTRXPKN-UHFFFAOYSA-N 1 2 317.436 4.399 20 0 DIADLO CCN(Cc1c[nH+]cn1Cc1ccccc1)c1ccccc1F ZINC000527074977 336282780 /nfs/dbraw/zinc/28/27/80/336282780.db2.gz OKCVNVODGGTDQS-UHFFFAOYSA-N 1 2 309.388 4.097 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc(N3CCCC3)[nH+]c2)c(F)c1 ZINC000192987171 336286555 /nfs/dbraw/zinc/28/65/55/336286555.db2.gz CIHVBFZEHSYXCO-ZDUSSCGKSA-N 1 2 315.392 4.003 20 0 DIADLO Cc1cc(NCc2ccccc2OC(F)F)nc(C(C)C)[nH+]1 ZINC000301063780 336288052 /nfs/dbraw/zinc/28/80/52/336288052.db2.gz CPBQVNNVBQKQIM-UHFFFAOYSA-N 1 2 307.344 4.122 20 0 DIADLO c1ccc2[nH+]c(CCCNc3ccc4ccccc4n3)[nH]c2c1 ZINC000301063632 336288089 /nfs/dbraw/zinc/28/80/89/336288089.db2.gz BQTQSKRHQLVCPF-UHFFFAOYSA-N 1 2 302.381 4.156 20 0 DIADLO Cc1nc2ccccc2n1CCCNc1cc(C)[nH+]c(C(C)C)n1 ZINC000301073102 336288556 /nfs/dbraw/zinc/28/85/56/336288556.db2.gz XJUPFFNUDUIREL-UHFFFAOYSA-N 1 2 323.444 4.069 20 0 DIADLO COc1ccc(OC)c([C@H](C)Nc2cc(C)[nH+]c(C(C)C)n2)c1 ZINC000301083805 336288975 /nfs/dbraw/zinc/28/89/75/336288975.db2.gz VGSWVXYGZGYPGB-ZDUSSCGKSA-N 1 2 315.417 4.099 20 0 DIADLO O=C(Nc1ccc(CNc2cccc[nH+]2)cc1)c1ccc(F)cc1 ZINC000301092988 336289625 /nfs/dbraw/zinc/28/96/25/336289625.db2.gz GCPHVGSXWNBERX-UHFFFAOYSA-N 1 2 321.355 4.085 20 0 DIADLO FC(F)Oc1ccccc1CNc1ccc2ccccc2[nH+]1 ZINC000301098871 336289901 /nfs/dbraw/zinc/28/99/01/336289901.db2.gz XFOJJRZZLRQOGN-UHFFFAOYSA-N 1 2 300.308 4.448 20 0 DIADLO Cc1cc(Nc2cccc(COCc3ccco3)c2)nc(C)[nH+]1 ZINC000301119876 336290973 /nfs/dbraw/zinc/29/09/73/336290973.db2.gz ZNCNQGPIYVDMDI-UHFFFAOYSA-N 1 2 309.369 4.147 20 0 DIADLO CCc1cc(N[C@H]2C[C@H]2c2ccccc2)nc(-c2ccncc2)[nH+]1 ZINC000301186098 336293870 /nfs/dbraw/zinc/29/38/70/336293870.db2.gz UWATVKWRXXOUGT-ROUUACIJSA-N 1 2 316.408 4.069 20 0 DIADLO Cc1[nH+]c(-c2ccncc2)nc(NCc2ccc(Cl)cc2)c1C ZINC000301187432 336293980 /nfs/dbraw/zinc/29/39/80/336293980.db2.gz TXEJQQVAQLXCBD-UHFFFAOYSA-N 1 2 324.815 4.421 20 0 DIADLO FC(F)(F)c1ccc(CCNc2cc[nH+]c(C3CC3)n2)cc1 ZINC000301222259 336295510 /nfs/dbraw/zinc/29/55/10/336295510.db2.gz BDAAQLPLHJKVHZ-UHFFFAOYSA-N 1 2 307.319 4.027 20 0 DIADLO COc1ccccc1Oc1ccc(CNc2cc(C)[nH+]cn2)cc1 ZINC000301233033 336296002 /nfs/dbraw/zinc/29/60/02/336296002.db2.gz GHZBCZPOBIDXSF-UHFFFAOYSA-N 1 2 321.380 4.198 20 0 DIADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1ccc(OC(F)(F)F)cc1 ZINC000301232612 336296007 /nfs/dbraw/zinc/29/60/07/336296007.db2.gz ILBXVXUXLJORQV-SNVBAGLBSA-N 1 2 323.318 4.426 20 0 DIADLO Cc1nc(Cl)cc(Nc2cccc(Oc3cc[nH+]cc3)c2)n1 ZINC000301238055 336296259 /nfs/dbraw/zinc/29/62/59/336296259.db2.gz NDCJICCUWOAIGJ-UHFFFAOYSA-N 1 2 312.760 4.369 20 0 DIADLO CN(Cc1ccc(C(F)(F)F)cc1)c1cc[nH+]c(C2CC2)n1 ZINC000301250744 336296801 /nfs/dbraw/zinc/29/68/01/336296801.db2.gz PNISQPMRLYGZRV-UHFFFAOYSA-N 1 2 307.319 4.009 20 0 DIADLO CC(C)c1nc(N[C@@H]2CCSc3ccc(F)cc32)cc[nH+]1 ZINC000301251063 336296881 /nfs/dbraw/zinc/29/68/81/336296881.db2.gz JDBLDKZYQOHCSU-CYBMUJFWSA-N 1 2 303.406 4.388 20 0 DIADLO c1ccc(OC2CCCC2)c(CNc2cc[nH+]c(C3CC3)n2)c1 ZINC000301259645 336297205 /nfs/dbraw/zinc/29/72/05/336297205.db2.gz RURPNRLYMXWYST-UHFFFAOYSA-N 1 2 309.413 4.288 20 0 DIADLO Cc1cc(N[C@@H](Cc2ccccc2)c2ccccc2F)nc[nH+]1 ZINC000301373214 336303210 /nfs/dbraw/zinc/30/32/10/336303210.db2.gz USBPVNJDWYIXLR-SFHVURJKSA-N 1 2 307.372 4.320 20 0 DIADLO Fc1cccc(Cl)c1[C@H]1C[C@@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000301380744 336303697 /nfs/dbraw/zinc/30/36/97/336303697.db2.gz YGHYDPHPLRTWRP-GWCFXTLKSA-N 1 2 303.768 4.115 20 0 DIADLO Cc1ccc([C@H]2OCCC[C@@H]2CNc2cc[nH+]c(C3CC3)n2)cc1 ZINC000301438117 336306760 /nfs/dbraw/zinc/30/67/60/336306760.db2.gz LFSPCLBMDHSLHY-IEBWSBKVSA-N 1 2 323.440 4.242 20 0 DIADLO COc1ccc(-c2ccc(CNc3cc(C)[nH+]cn3)s2)cc1 ZINC000301462234 336308326 /nfs/dbraw/zinc/30/83/26/336308326.db2.gz FCKVUQPZZCDCDA-UHFFFAOYSA-N 1 2 311.410 4.134 20 0 DIADLO C[C@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1cccc(-n2cccn2)c1 ZINC000301502789 336310910 /nfs/dbraw/zinc/31/09/10/336310910.db2.gz BMGZFEZATUSUJG-AWEZNQCLSA-N 1 2 321.428 4.133 20 0 DIADLO CC(C)(C)c1nc(NCCc2nc3ccccc3s2)cc[nH+]1 ZINC000301528561 336312549 /nfs/dbraw/zinc/31/25/49/336312549.db2.gz OINYSBXLPKZMAA-UHFFFAOYSA-N 1 2 312.442 4.038 20 0 DIADLO Fc1cc(F)c(F)c(CNc2ccc3ccccc3[nH+]2)c1F ZINC000301560583 336314862 /nfs/dbraw/zinc/31/48/62/336314862.db2.gz IWIIOFIDUSGANJ-UHFFFAOYSA-N 1 2 306.262 4.403 20 0 DIADLO Cc1ccc(-c2csc(CN3CCC[C@H]3c3[nH]cc[nH+]3)n2)cc1 ZINC000367138821 336315704 /nfs/dbraw/zinc/31/57/04/336315704.db2.gz SHOKZTNLEWJCBN-INIZCTEOSA-N 1 2 324.453 4.179 20 0 DIADLO Cc1cnc([C@@H](Nc2cc(C)[nH+]c(C(C)C)n2)C2CC2)s1 ZINC000301607865 336318031 /nfs/dbraw/zinc/31/80/31/336318031.db2.gz ZODSWEUGYRAENX-AWEZNQCLSA-N 1 2 302.447 4.237 20 0 DIADLO COc1cccc2c1CC[C@@H]2Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000301614869 336318432 /nfs/dbraw/zinc/31/84/32/336318432.db2.gz AZJNVBAHYRVXGY-ZDUSSCGKSA-N 1 2 308.303 4.208 20 0 DIADLO Cc1cc(NCc2cc(-c3ccccc3)on2)nc(C(C)C)[nH+]1 ZINC000301644780 336320341 /nfs/dbraw/zinc/32/03/41/336320341.db2.gz NHHUVWHLMCGEHK-UHFFFAOYSA-N 1 2 308.385 4.176 20 0 DIADLO Cc1cc(NC[C@@](C)(O)c2cccs2)c2cccc(F)c2[nH+]1 ZINC000301648660 336320630 /nfs/dbraw/zinc/32/06/30/336320630.db2.gz FCZVPDFEBGIUOY-QGZVFWFLSA-N 1 2 316.401 4.063 20 0 DIADLO Cc1cc(N[C@H](C)c2noc(-c3ccccc3)n2)nc(C(C)C)[nH+]1 ZINC000301685244 336323428 /nfs/dbraw/zinc/32/34/28/336323428.db2.gz WRNZYHVQEOSMMS-CYBMUJFWSA-N 1 2 323.400 4.132 20 0 DIADLO Cc1cc(NCc2cn3c(cccc3C)n2)c2cccc(F)c2[nH+]1 ZINC000301691615 336323832 /nfs/dbraw/zinc/32/38/32/336323832.db2.gz WUMVUCYMTJWPFK-UHFFFAOYSA-N 1 2 320.371 4.251 20 0 DIADLO Cc1cc(N2CC[C@H](Nc3ccccc3)C2)c2cccc(F)c2[nH+]1 ZINC000301696470 336323979 /nfs/dbraw/zinc/32/39/79/336323979.db2.gz ZCMDXJYOJGLYDS-INIZCTEOSA-N 1 2 321.399 4.373 20 0 DIADLO Cc1cc(N[C@@H]2CCOC3(CCCCC3)C2)nc(C(C)C)[nH+]1 ZINC000301698360 336324169 /nfs/dbraw/zinc/32/41/69/336324169.db2.gz OJHRFXQUQZCJLM-OAHLLOKOSA-N 1 2 303.450 4.202 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000301716613 336325271 /nfs/dbraw/zinc/32/52/71/336325271.db2.gz KGOMLNCXBBOERZ-LJQANCHMSA-N 1 2 322.383 4.260 20 0 DIADLO C[C@@H](C[C@H](O)c1ccc(F)cc1)Nc1ccc2ccccc2[nH+]1 ZINC000301750755 336327594 /nfs/dbraw/zinc/32/75/94/336327594.db2.gz ULCWUSQSGRAYKL-UGSOOPFHSA-N 1 2 310.372 4.298 20 0 DIADLO C[C@H](C[C@@H](O)c1ccc(F)cc1)Nc1ccc2ccccc2[nH+]1 ZINC000301750753 336327721 /nfs/dbraw/zinc/32/77/21/336327721.db2.gz ULCWUSQSGRAYKL-FZKQIMNGSA-N 1 2 310.372 4.298 20 0 DIADLO CC(C)(C)c1cc(NCc2ncccc2F)nc(C(C)(C)C)[nH+]1 ZINC000301788558 336330010 /nfs/dbraw/zinc/33/00/10/336330010.db2.gz MEYFBWFNYIBLII-UHFFFAOYSA-N 1 2 316.424 4.218 20 0 DIADLO Cc1cc(N[C@@H]2[C@H]3CCO[C@H]3C23CCC3)c2cccc(F)c2[nH+]1 ZINC000301795959 336330436 /nfs/dbraw/zinc/33/04/36/336330436.db2.gz ACIZFMJWYQHCBL-FSPWUOQZSA-N 1 2 312.388 4.052 20 0 DIADLO CC(C)c1cc(NC[C@@H](O)c2ccccc2F)nc(C(C)C)[nH+]1 ZINC000301803206 336331237 /nfs/dbraw/zinc/33/12/37/336331237.db2.gz CZJCPFMSRNIYSK-MRXNPFEDSA-N 1 2 317.408 4.008 20 0 DIADLO C[C@H](CCc1ccccc1)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC000301851322 336334167 /nfs/dbraw/zinc/33/41/67/336334167.db2.gz XABCVUOPNUZVTE-CQSZACIVSA-N 1 2 323.444 4.015 20 0 DIADLO C[C@H](Nc1nc(N)c2ccccc2[nH+]1)c1c(F)cccc1Cl ZINC000301883497 336336037 /nfs/dbraw/zinc/33/60/37/336336037.db2.gz JCVIFZSNEUIGOG-VIFPVBQESA-N 1 2 316.767 4.178 20 0 DIADLO c1cn(-c2ccccc2CNc2nc3ccccc3s2)c[nH+]1 ZINC000301985630 336341422 /nfs/dbraw/zinc/34/14/22/336341422.db2.gz JUNIJMVQDBATKF-UHFFFAOYSA-N 1 2 306.394 4.094 20 0 DIADLO Clc1ccc2c(c1)OCCC[C@@H]2Nc1cc[nH+]c(C2CC2)n1 ZINC000302035788 336344511 /nfs/dbraw/zinc/34/45/11/336344511.db2.gz UQPRVWQSMDNGHS-AWEZNQCLSA-N 1 2 315.804 4.333 20 0 DIADLO COc1ccccc1[C@H]1CCCN1c1nc(C)[nH+]c2c1CCCC2 ZINC000302041966 336344991 /nfs/dbraw/zinc/34/49/91/336344991.db2.gz IPVOHYKTFSXLIS-GOSISDBHSA-N 1 2 323.440 4.014 20 0 DIADLO CCc1cc(N2C[C@H](C)[C@@H]3CCCC[C@H]32)nc(-c2ccncc2)[nH+]1 ZINC000302066107 336346552 /nfs/dbraw/zinc/34/65/52/336346552.db2.gz AWEJQJAECIROMY-JCGIZDLHSA-N 1 2 322.456 4.116 20 0 DIADLO Cc1nc(N2CCC[C@H]2c2cccc(F)c2)c2c([nH+]1)CCCC2 ZINC000302067142 336346629 /nfs/dbraw/zinc/34/66/29/336346629.db2.gz WOBWGROGMPDDNQ-SFHVURJKSA-N 1 2 311.404 4.144 20 0 DIADLO Cc1cc(N(C)C[C@@H](C)c2nccs2)c2cccc(F)c2[nH+]1 ZINC000302161217 336351714 /nfs/dbraw/zinc/35/17/14/336351714.db2.gz NYRZYAVHHZFPQQ-LLVKDONJSA-N 1 2 315.417 4.379 20 0 DIADLO C[C@@](O)(CNc1ccc2ccccc2[nH+]1)c1cccc(Cl)c1 ZINC000302181053 336352759 /nfs/dbraw/zinc/35/27/59/336352759.db2.gz QQIPZMLCKFPTRV-GOSISDBHSA-N 1 2 312.800 4.208 20 0 DIADLO Cc1nc([C@H]2CCCN2c2cc(C)[nH+]c(C(C)C)n2)cs1 ZINC000302459512 336359215 /nfs/dbraw/zinc/35/92/15/336359215.db2.gz UIJAAAXUBGIKRA-CQSZACIVSA-N 1 2 302.447 4.015 20 0 DIADLO COc1ccc(CNc2cc[nH+]c3c(OC)cccc23)cc1F ZINC000302493506 336359997 /nfs/dbraw/zinc/35/99/97/336359997.db2.gz ZUOIRODGNXJSKZ-UHFFFAOYSA-N 1 2 312.344 4.003 20 0 DIADLO CC(C)c1nc(NC[C@@H](c2ccccc2)C(F)(F)F)cc[nH+]1 ZINC000302497467 336360091 /nfs/dbraw/zinc/36/00/91/336360091.db2.gz UTEWXEJSPQMSMC-ZDUSSCGKSA-N 1 2 309.335 4.358 20 0 DIADLO COc1cccc2c(N[C@@H]3CCc4c3cccc4O)cc[nH+]c12 ZINC000302522759 336360805 /nfs/dbraw/zinc/36/08/05/336360805.db2.gz JGOPRTHNEDFIGT-OAHLLOKOSA-N 1 2 306.365 4.048 20 0 DIADLO COc1cccc2c(N[C@H]3CCOC4(CCCC4)C3)cc[nH+]c12 ZINC000302566470 336361805 /nfs/dbraw/zinc/36/18/05/336361805.db2.gz WNCRNPFNKUEZPA-AWEZNQCLSA-N 1 2 312.413 4.147 20 0 DIADLO Cc1cccc(CNc2cc[nH+]c(C3CC3)n2)c1Br ZINC000302614304 336362629 /nfs/dbraw/zinc/36/26/29/336362629.db2.gz BGNQWKLVKDBDRV-UHFFFAOYSA-N 1 2 318.218 4.037 20 0 DIADLO Cc1cc(C(F)(F)F)ccc1CNc1cc[nH+]c(C2CC2)n1 ZINC000302617362 336362713 /nfs/dbraw/zinc/36/27/13/336362713.db2.gz DHYOTTJHXORXME-UHFFFAOYSA-N 1 2 307.319 4.293 20 0 DIADLO CC(C)c1nc(NCCc2nccs2)cc(C(C)(C)C)[nH+]1 ZINC000302777360 336368634 /nfs/dbraw/zinc/36/86/34/336368634.db2.gz PJNLDYQFVGITGP-UHFFFAOYSA-N 1 2 304.463 4.009 20 0 DIADLO Cc1ccnc([C@@H](Nc2cc(C)[nH+]c3c(F)cccc23)C2CC2)n1 ZINC000302805710 336370015 /nfs/dbraw/zinc/37/00/15/336370015.db2.gz FSRADUFSFINIRR-KRWDZBQOSA-N 1 2 322.387 4.344 20 0 DIADLO CC(C)c1nc(N[C@@H]2C[C@@H](C)O[C@@H](C)C2)cc(C(C)(C)C)[nH+]1 ZINC000302826873 336370888 /nfs/dbraw/zinc/37/08/88/336370888.db2.gz HMVULGNDNRJKAV-BTTYYORXSA-N 1 2 305.466 4.265 20 0 DIADLO C[C@H](Nc1nc[nH+]c(N)c1Cl)c1cc(Cl)ccc1Cl ZINC000302830016 336371208 /nfs/dbraw/zinc/37/12/08/336371208.db2.gz KFAFJJBLPVOHTE-LURJTMIESA-N 1 2 317.607 4.192 20 0 DIADLO C[C@H](Nc1[nH+]cnc(N)c1Cl)c1cc(Cl)ccc1Cl ZINC000302830016 336371209 /nfs/dbraw/zinc/37/12/09/336371209.db2.gz KFAFJJBLPVOHTE-LURJTMIESA-N 1 2 317.607 4.192 20 0 DIADLO Cc1cc(NCC2(c3ccccn3)CC2)c2cccc(F)c2[nH+]1 ZINC000302868479 336372516 /nfs/dbraw/zinc/37/25/16/336372516.db2.gz XCMAIPWBXPHYRO-UHFFFAOYSA-N 1 2 307.372 4.221 20 0 DIADLO CC(C)c1nc(NCC(C)(C)C[C@@H](C)O)cc(C(C)(C)C)[nH+]1 ZINC000302885310 336373317 /nfs/dbraw/zinc/37/33/17/336373317.db2.gz KRIUDNWLQYXZDB-CYBMUJFWSA-N 1 2 307.482 4.107 20 0 DIADLO CC(C)c1nc(N[C@@H](C)C2CCOCC2)cc(C(C)(C)C)[nH+]1 ZINC000302891251 336373487 /nfs/dbraw/zinc/37/34/87/336373487.db2.gz NUOIYUTUFZAKBO-ZDUSSCGKSA-N 1 2 305.466 4.125 20 0 DIADLO CC(C)Sc1ccc([C@@H](C)Nc2nc[nH+]c(N)c2Cl)cc1 ZINC000302917935 336374199 /nfs/dbraw/zinc/37/41/99/336374199.db2.gz XLWVXGWFPZGWGA-SNVBAGLBSA-N 1 2 322.865 4.386 20 0 DIADLO CC(C)Sc1ccc([C@@H](C)Nc2[nH+]cnc(N)c2Cl)cc1 ZINC000302917935 336374200 /nfs/dbraw/zinc/37/42/00/336374200.db2.gz XLWVXGWFPZGWGA-SNVBAGLBSA-N 1 2 322.865 4.386 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1ncc(CSC)s1 ZINC000352926988 336377648 /nfs/dbraw/zinc/37/76/48/336377648.db2.gz SIZLQHUWUMXBFU-HNNXBMFYSA-N 1 2 318.511 4.343 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1ncc(CSC)s1 ZINC000352926988 336377649 /nfs/dbraw/zinc/37/76/49/336377649.db2.gz SIZLQHUWUMXBFU-HNNXBMFYSA-N 1 2 318.511 4.343 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)c1occ2c1CCC2 ZINC000352956291 336379212 /nfs/dbraw/zinc/37/92/12/336379212.db2.gz KZPPVYIZJYJMHJ-UHFFFAOYSA-N 1 2 320.348 4.208 20 0 DIADLO CSCc1cnc(C[N@@H+]2Cc3ccccc3C3(CC3)C2)s1 ZINC000352960104 336379459 /nfs/dbraw/zinc/37/94/59/336379459.db2.gz XFNCBOYINLAGKL-UHFFFAOYSA-N 1 2 316.495 4.054 20 0 DIADLO CSCc1cnc(C[N@H+]2Cc3ccccc3C3(CC3)C2)s1 ZINC000352960104 336379460 /nfs/dbraw/zinc/37/94/60/336379460.db2.gz XFNCBOYINLAGKL-UHFFFAOYSA-N 1 2 316.495 4.054 20 0 DIADLO FC(F)(F)CCCC[N@@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000152442757 336384493 /nfs/dbraw/zinc/38/44/93/336384493.db2.gz KJDUMCYKPPEPJY-AWEZNQCLSA-N 1 2 321.770 4.446 20 0 DIADLO FC(F)(F)CCCC[N@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000152442757 336384494 /nfs/dbraw/zinc/38/44/94/336384494.db2.gz KJDUMCYKPPEPJY-AWEZNQCLSA-N 1 2 321.770 4.446 20 0 DIADLO Cc1[nH]c(CNc2cccc(COC(C)(C)C)c2C)[nH+]c1C ZINC000514615642 336386466 /nfs/dbraw/zinc/38/64/66/336386466.db2.gz CNMVFTMNSIOMBW-UHFFFAOYSA-N 1 2 301.434 4.262 20 0 DIADLO C[N@H+](Cc1cnc(C2CC2)s1)Cc1cc(Cl)ccc1F ZINC000514651176 336391391 /nfs/dbraw/zinc/39/13/91/336391391.db2.gz CWUPKMYCTQZMCC-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO C[N@@H+](Cc1cnc(C2CC2)s1)Cc1cc(Cl)ccc1F ZINC000514651176 336391392 /nfs/dbraw/zinc/39/13/92/336391392.db2.gz CWUPKMYCTQZMCC-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H](C)C(C)(F)F)cc1Br ZINC000389474871 336394799 /nfs/dbraw/zinc/39/47/99/336394799.db2.gz XRKJGQJEQGRHBT-BDAKNGLRSA-N 1 2 322.193 4.152 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)cc1O ZINC000353416497 336416321 /nfs/dbraw/zinc/41/63/21/336416321.db2.gz XYUXAJYSYFOZRJ-LLVKDONJSA-N 1 2 320.458 4.006 20 0 DIADLO CCSc1ccccc1[C@H](C)[NH2+]Cc1nnc(CC)s1 ZINC000353565721 336425566 /nfs/dbraw/zinc/42/55/66/336425566.db2.gz XEIXGIPISKRQSJ-NSHDSACASA-N 1 2 307.488 4.063 20 0 DIADLO O=C(c1ccc(C2CCCC2)cc1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000353773556 336439959 /nfs/dbraw/zinc/43/99/59/336439959.db2.gz OUKOBTPSXIZECC-GOSISDBHSA-N 1 2 323.440 4.435 20 0 DIADLO Cc1ccc(CCCNc2ccc(NC(=O)C(C)C)cc2)c[nH+]1 ZINC000353816721 336442181 /nfs/dbraw/zinc/44/21/81/336442181.db2.gz POQFBIDUILXAIB-UHFFFAOYSA-N 1 2 311.429 4.029 20 0 DIADLO C[C@@H]1c2ccccc2CN1Cc1[nH+]ccn1Cc1ccccc1 ZINC000353860673 336444284 /nfs/dbraw/zinc/44/42/84/336444284.db2.gz YTWUYVAAHGDHOQ-MRXNPFEDSA-N 1 2 303.409 4.008 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccccc1OC ZINC000353924529 336448870 /nfs/dbraw/zinc/44/88/70/336448870.db2.gz SKWWTIBFZYNCKO-XHDPSFHLSA-N 1 2 306.356 4.170 20 0 DIADLO CCO[C@@H]1C[C@@H](Nc2[nH+]ccc3ccc(F)cc32)C12CCC2 ZINC000354329981 336467138 /nfs/dbraw/zinc/46/71/38/336467138.db2.gz VDYJFXJOLIHBGO-HZPDHXFCSA-N 1 2 300.377 4.134 20 0 DIADLO CC(C)COC1CCN(c2[nH+]ccc3ccc(F)cc32)CC1 ZINC000354556383 336474590 /nfs/dbraw/zinc/47/45/90/336474590.db2.gz CYGLJQLTUCZGHP-UHFFFAOYSA-N 1 2 302.393 4.015 20 0 DIADLO Cc1cc([C@@H](C)Nc2cc(C)[nH+]c(-c3ccncc3)n2)c(C)s1 ZINC000354739433 336480704 /nfs/dbraw/zinc/48/07/04/336480704.db2.gz YLKSGZHSDMQQTE-CYBMUJFWSA-N 1 2 324.453 4.120 20 0 DIADLO Cc1ccoc1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000355389655 336506926 /nfs/dbraw/zinc/50/69/26/336506926.db2.gz JHUSCSCLPHWIES-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO CC[C@H](C)NC(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000114219241 336537383 /nfs/dbraw/zinc/53/73/83/336537383.db2.gz VTUUVIIHCNURTB-NSHDSACASA-N 1 2 304.777 4.056 20 0 DIADLO FC1(F)CCC12C[NH+](Cc1csc(-c3ccsc3)n1)C2 ZINC000356535991 336553759 /nfs/dbraw/zinc/55/37/59/336553759.db2.gz YHTZXFAMNGPYNB-UHFFFAOYSA-N 1 2 312.410 4.103 20 0 DIADLO Cc1ccc(C(=O)N(C)[C@@H](C)C2CCC2)cc1Oc1cc[nH+]cc1 ZINC000356567116 336554781 /nfs/dbraw/zinc/55/47/81/336554781.db2.gz QLYACDLZBGKGKJ-HNNXBMFYSA-N 1 2 324.424 4.443 20 0 DIADLO C[C@@H]1CCC[C@@H](c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)C1 ZINC000356602655 336555919 /nfs/dbraw/zinc/55/59/19/336555919.db2.gz QEWNAABVOPNTPH-UKRRQHHQSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccccc1)c1cccnc1)c1ccc(F)cn1 ZINC000356682610 336558091 /nfs/dbraw/zinc/55/80/91/336558091.db2.gz SERFTGIEUMUUSH-IFXJQAMLSA-N 1 2 307.372 4.056 20 0 DIADLO C[C@H]([NH2+]Cc1nc2cc(Cl)ccc2s1)c1ccc(F)cn1 ZINC000356692117 336558340 /nfs/dbraw/zinc/55/83/40/336558340.db2.gz HGHGJCWWIZGUOP-VIFPVBQESA-N 1 2 321.808 4.335 20 0 DIADLO C[C@H](F)CCNC(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000356697299 336558476 /nfs/dbraw/zinc/55/84/76/336558476.db2.gz JDSQEUCQCKYEED-NSHDSACASA-N 1 2 322.767 4.005 20 0 DIADLO Cc1cnc([C@@H](C)[NH+]2CCC(Oc3ccccc3Cl)CC2)o1 ZINC000356998056 336569296 /nfs/dbraw/zinc/56/92/96/336569296.db2.gz ABZFPTIYLNJNSA-CYBMUJFWSA-N 1 2 320.820 4.241 20 0 DIADLO Cc1cccc2[nH+]c(CNc3ccc(-c4ccccn4)cc3)cn21 ZINC000357282816 336579288 /nfs/dbraw/zinc/57/92/88/336579288.db2.gz LHMYSRODJOZJSV-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H](C)c1ccsc1 ZINC000357926245 336603601 /nfs/dbraw/zinc/60/36/01/336603601.db2.gz PXUMGSOWVVUYJB-GFCCVEGCSA-N 1 2 311.410 4.189 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H]2CCCOc3ccc(F)cc32)cs1 ZINC000358027136 336607388 /nfs/dbraw/zinc/60/73/88/336607388.db2.gz VYMIHJKCBWESNB-IINYFYTJSA-N 1 2 306.406 4.155 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[S@](=O)Cc1ccc(C)[nH+]c1C ZINC000358116186 336612169 /nfs/dbraw/zinc/61/21/69/336612169.db2.gz GJROKLUOBQQIDK-HTAPYJJXSA-N 1 2 323.408 4.377 20 0 DIADLO C[C@H]([NH2+][C@@H](c1cccc(F)c1)c1ccccn1)c1cncs1 ZINC000358260947 336620082 /nfs/dbraw/zinc/62/00/82/336620082.db2.gz CCSVVGVLJKUZFJ-SJCJKPOMSA-N 1 2 313.401 4.117 20 0 DIADLO Cc1nnc([C@@H](C)[NH+]2CCC(c3c(F)cccc3F)CC2)s1 ZINC000367306436 336620810 /nfs/dbraw/zinc/62/08/10/336620810.db2.gz XLOXONFSMYLLSU-SNVBAGLBSA-N 1 2 323.412 4.065 20 0 DIADLO Cc1cc2c(ncnc2SCc2ccc(C)[nH+]c2C)s1 ZINC000358660600 336638649 /nfs/dbraw/zinc/63/86/49/336638649.db2.gz LEVOXSAYLUSLIS-UHFFFAOYSA-N 1 2 301.440 4.304 20 0 DIADLO FC(F)(F)c1cncc(CSc2[nH+]cc3ccccn32)c1 ZINC000359164060 336660957 /nfs/dbraw/zinc/66/09/57/336660957.db2.gz OVVWPEGXLWXSFA-UHFFFAOYSA-N 1 2 309.316 4.040 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc3ccccc3nc2C)c(C)[nH+]1 ZINC000359426172 336672445 /nfs/dbraw/zinc/67/24/45/336672445.db2.gz YXBXBQGLSATBJA-UHFFFAOYSA-N 1 2 305.381 4.116 20 0 DIADLO Fc1ccc2ccnc(NCc3cccc(-c4[nH]cc[nH+]4)c3)c2c1 ZINC000361045398 336735044 /nfs/dbraw/zinc/73/50/44/336735044.db2.gz LFPLMQILFHOMBM-UHFFFAOYSA-N 1 2 318.355 4.376 20 0 DIADLO CC[C@H]([NH2+][C@H]1CCOc2c(F)ccc(F)c21)c1ccc(F)cn1 ZINC000361181406 336742739 /nfs/dbraw/zinc/74/27/39/336742739.db2.gz MAHIWZXGINVSHR-ZFWWWQNUSA-N 1 2 322.330 4.063 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@@H]2CCOc3c(F)ccc(F)c32)o1 ZINC000361190119 336743627 /nfs/dbraw/zinc/74/36/27/336743627.db2.gz YBEAMQYGFBLERZ-IINYFYTJSA-N 1 2 307.340 4.295 20 0 DIADLO Cc1ccc(F)c(C[NH2+][C@H]2CCOc3c(F)ccc(F)c32)c1 ZINC000361253798 336747158 /nfs/dbraw/zinc/74/71/58/336747158.db2.gz XKVMPYTWKPXHEU-HNNXBMFYSA-N 1 2 307.315 4.026 20 0 DIADLO CCCc1nc(C[NH2+]C(C)(C)c2nc(C)c(C)s2)cs1 ZINC000362415676 336796425 /nfs/dbraw/zinc/79/64/25/336796425.db2.gz LWFRKYXULAIMRA-UHFFFAOYSA-N 1 2 309.504 4.194 20 0 DIADLO Fc1cc(-c2ccc(Cl)cc2)ccc1C[NH2+]Cc1ncc[nH]1 ZINC000362802061 336811939 /nfs/dbraw/zinc/81/19/39/336811939.db2.gz KCNOTIWIFRNAIB-UHFFFAOYSA-N 1 2 315.779 4.159 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1occc1C(C)C ZINC000367644051 336827201 /nfs/dbraw/zinc/82/72/01/336827201.db2.gz QUIWEMCPCMZLNO-UHFFFAOYSA-N 1 2 309.369 4.354 20 0 DIADLO Cc1ccc([C@H](C)N(C)C(=O)c2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000117598324 336856581 /nfs/dbraw/zinc/85/65/81/336856581.db2.gz HUFCGHKZTUEDMC-INIZCTEOSA-N 1 2 319.408 4.014 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2cc(O)cc(F)c2)c2ccccn2)cc1 ZINC000369545091 336866773 /nfs/dbraw/zinc/86/67/73/336866773.db2.gz CQFHSCJIZZNILR-HXUWFJFHSA-N 1 2 322.383 4.114 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nccn1C)c1ccccc1F)c1cccs1 ZINC000370671156 336890526 /nfs/dbraw/zinc/89/05/26/336890526.db2.gz NJRVFDJUNVNCHY-WBMJQRKESA-N 1 2 315.417 4.061 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2F)c1 ZINC000370670166 336890542 /nfs/dbraw/zinc/89/05/42/336890542.db2.gz XFDWAFYOKVUMBT-BEFAXECRSA-N 1 2 323.415 4.308 20 0 DIADLO CC1(C)CCCC[C@@H]1CC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000120236394 336904646 /nfs/dbraw/zinc/90/46/46/336904646.db2.gz AFGYIXNRULNWHW-HUUCEWRRSA-N 1 2 303.450 4.070 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1cccnc1 ZINC000371485091 336906216 /nfs/dbraw/zinc/90/62/16/336906216.db2.gz KKEAAZBYERUVSP-HNNXBMFYSA-N 1 2 316.408 4.170 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)cs1 ZINC000371545546 336907508 /nfs/dbraw/zinc/90/75/08/336907508.db2.gz ISQLBIGJZJHART-CQSZACIVSA-N 1 2 322.861 4.362 20 0 DIADLO CC(C)(C)c1ccc(C(=O)N2CCCC[C@@H]2c2[nH]cc[nH+]2)cc1 ZINC000120708356 336919685 /nfs/dbraw/zinc/91/96/85/336919685.db2.gz NFMDJNXEGRQKSL-MRXNPFEDSA-N 1 2 311.429 4.075 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H]2CCOc3c(F)cccc32)s1 ZINC000372905840 336942705 /nfs/dbraw/zinc/94/27/05/336942705.db2.gz XZKYSNOKOKXECQ-CYBMUJFWSA-N 1 2 306.406 4.019 20 0 DIADLO Cc1nc(C[NH2+][C@H](CCCc2ccccc2)c2ccccc2)no1 ZINC000121445228 336954519 /nfs/dbraw/zinc/95/45/19/336954519.db2.gz BWUYENWCDWYRBM-LJQANCHMSA-N 1 2 321.424 4.232 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)CSCCC(C)C ZINC000373705878 336969771 /nfs/dbraw/zinc/96/97/71/336969771.db2.gz NJLJIADYJAHTHT-UHFFFAOYSA-N 1 2 317.458 4.103 20 0 DIADLO C[C@H](SCCn1cc[nH+]c1)c1ccc(Br)cc1 ZINC000122442591 337008458 /nfs/dbraw/zinc/00/84/58/337008458.db2.gz QTRDGBSLXRZSON-NSHDSACASA-N 1 2 311.248 4.140 20 0 DIADLO C[C@@H](SCCn1cc[nH+]c1)c1ccc(Br)cc1 ZINC000122442840 337008552 /nfs/dbraw/zinc/00/85/52/337008552.db2.gz QTRDGBSLXRZSON-LLVKDONJSA-N 1 2 311.248 4.140 20 0 DIADLO Cc1cc(NC(=O)c2cc(-c3ccccn3)ccc2Cl)cc[nH+]1 ZINC000122451423 337008651 /nfs/dbraw/zinc/00/86/51/337008651.db2.gz JIEZOXLWTVJOAK-UHFFFAOYSA-N 1 2 323.783 4.358 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+]2CCC=C(c3ccco3)C2)cs1 ZINC000375620274 337014967 /nfs/dbraw/zinc/01/49/67/337014967.db2.gz VVSGHEJJRDXENI-CYBMUJFWSA-N 1 2 318.442 4.123 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+]2CCC=C(c3ccco3)C2)cs1 ZINC000375620274 337014968 /nfs/dbraw/zinc/01/49/68/337014968.db2.gz VVSGHEJJRDXENI-CYBMUJFWSA-N 1 2 318.442 4.123 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)c1 ZINC000375800642 337019819 /nfs/dbraw/zinc/01/98/19/337019819.db2.gz CITHVXSOHVIQIX-HZMBPMFUSA-N 1 2 323.223 4.481 20 0 DIADLO O=C(c1cccc(Oc2cc[nH+]cc2)c1)N1CC(C2CCCC2)C1 ZINC000376015770 337025259 /nfs/dbraw/zinc/02/52/59/337025259.db2.gz TUVUTPHSFXQRSO-UHFFFAOYSA-N 1 2 322.408 4.136 20 0 DIADLO CCOC1CC2(C1)CCN(c1cc(C(C)C)[nH+]c(C(C)C)n1)C2 ZINC000376198124 337029336 /nfs/dbraw/zinc/02/93/36/337029336.db2.gz NGHHQTRTHOTDNM-UHFFFAOYSA-N 1 2 317.477 4.119 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000376551021 337036591 /nfs/dbraw/zinc/03/65/91/337036591.db2.gz AJAORZSSDQEOLY-BXUZGUMPSA-N 1 2 322.239 4.367 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000376551021 337036592 /nfs/dbraw/zinc/03/65/92/337036592.db2.gz AJAORZSSDQEOLY-BXUZGUMPSA-N 1 2 322.239 4.367 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000376607388 337037920 /nfs/dbraw/zinc/03/79/20/337037920.db2.gz XAUUERRHDSGLHN-ZGKFYVQTSA-N 1 2 321.424 4.408 20 0 DIADLO Cc1ccc([C@@]2(C)CCN(C(=O)Nc3c(C)cc[nH+]c3C)C2)cc1 ZINC000376606462 337037924 /nfs/dbraw/zinc/03/79/24/337037924.db2.gz ODADTAUHFAQZET-FQEVSTJZSA-N 1 2 323.440 4.202 20 0 DIADLO Cc1cc([C@@H](C)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)no1 ZINC000377093970 337046705 /nfs/dbraw/zinc/04/67/05/337046705.db2.gz UMKAJANSGNKHRJ-CQSZACIVSA-N 1 2 322.412 4.356 20 0 DIADLO Cc1cc(C)c(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c(C)c1 ZINC000123425935 337047987 /nfs/dbraw/zinc/04/79/87/337047987.db2.gz INAFGTJOBBIBRG-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)no1 ZINC000377873528 337063144 /nfs/dbraw/zinc/06/31/44/337063144.db2.gz JQUKLXFINWENCB-INIZCTEOSA-N 1 2 300.402 4.015 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)no1 ZINC000377873528 337063145 /nfs/dbraw/zinc/06/31/45/337063145.db2.gz JQUKLXFINWENCB-INIZCTEOSA-N 1 2 300.402 4.015 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000378073714 337065919 /nfs/dbraw/zinc/06/59/19/337065919.db2.gz HRYSEFUKEDOGBZ-INIZCTEOSA-N 1 2 317.477 4.112 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000378073714 337065920 /nfs/dbraw/zinc/06/59/20/337065920.db2.gz HRYSEFUKEDOGBZ-INIZCTEOSA-N 1 2 317.477 4.112 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000378081713 337066137 /nfs/dbraw/zinc/06/61/37/337066137.db2.gz ZUYBNXRRBSDURF-OAHLLOKOSA-N 1 2 305.466 4.112 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000378081713 337066138 /nfs/dbraw/zinc/06/61/38/337066138.db2.gz ZUYBNXRRBSDURF-OAHLLOKOSA-N 1 2 305.466 4.112 20 0 DIADLO CCCCCC[C@@](C)(CCC)C(=O)N1CCn2c[nH+]cc2C1 ZINC000378091782 337066313 /nfs/dbraw/zinc/06/63/13/337066313.db2.gz IQWQBVHGDRMLGZ-GOSISDBHSA-N 1 2 305.466 4.002 20 0 DIADLO COc1cc(NCc2ccc(-n3cc[nH+]c3)cc2)ccc1Cl ZINC000193680987 337079127 /nfs/dbraw/zinc/07/91/27/337079127.db2.gz VCUWOTZKPQPLFF-UHFFFAOYSA-N 1 2 313.788 4.146 20 0 DIADLO CCN(CC(C)C)C(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000172058475 337089441 /nfs/dbraw/zinc/08/94/41/337089441.db2.gz FROMFFKHQCFPDA-UHFFFAOYSA-N 1 2 312.413 4.300 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1cc(-c2ccco2)on1 ZINC000023355939 337130591 /nfs/dbraw/zinc/13/05/91/337130591.db2.gz WSWMXQCHJKZIKV-LLVKDONJSA-N 1 2 318.323 4.406 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1cc(-c2ccco2)on1 ZINC000023355939 337130592 /nfs/dbraw/zinc/13/05/92/337130592.db2.gz WSWMXQCHJKZIKV-LLVKDONJSA-N 1 2 318.323 4.406 20 0 DIADLO CCc1ccc([C@@H]2CCCC[N@@H+]2Cc2nc(C(C)C)no2)o1 ZINC000172871212 337131704 /nfs/dbraw/zinc/13/17/04/337131704.db2.gz MJWVAZHCBKNVQM-AWEZNQCLSA-N 1 2 303.406 4.076 20 0 DIADLO CCc1ccc([C@@H]2CCCC[N@H+]2Cc2nc(C(C)C)no2)o1 ZINC000172871212 337131705 /nfs/dbraw/zinc/13/17/05/337131705.db2.gz MJWVAZHCBKNVQM-AWEZNQCLSA-N 1 2 303.406 4.076 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1csc(-c2ccccn2)n1 ZINC000172994861 337132835 /nfs/dbraw/zinc/13/28/35/337132835.db2.gz JWYZPPZXOHUEMS-CQSZACIVSA-N 1 2 321.449 4.152 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1csc(-c2ccccn2)n1 ZINC000172994861 337132836 /nfs/dbraw/zinc/13/28/36/337132836.db2.gz JWYZPPZXOHUEMS-CQSZACIVSA-N 1 2 321.449 4.152 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)C1(Cc2ccccc2Cl)CC1 ZINC000425597470 337138577 /nfs/dbraw/zinc/13/85/77/337138577.db2.gz SSTMDTDTYLICEU-UHFFFAOYSA-N 1 2 314.816 4.313 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)c(F)c1)c1ncc(-c2ccccc2)o1 ZINC000174002819 337140447 /nfs/dbraw/zinc/14/04/47/337140447.db2.gz LEEQLZYTFOTOJG-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO Cc1cc(C[N@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)no1 ZINC000174595452 337142710 /nfs/dbraw/zinc/14/27/10/337142710.db2.gz LHYZBBVFUWFQIV-UHFFFAOYSA-N 1 2 307.397 4.062 20 0 DIADLO Cc1cc(C[N@@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)no1 ZINC000174595452 337142711 /nfs/dbraw/zinc/14/27/11/337142711.db2.gz LHYZBBVFUWFQIV-UHFFFAOYSA-N 1 2 307.397 4.062 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1cc(-c2ccco2)on1 ZINC000175144116 337144648 /nfs/dbraw/zinc/14/46/48/337144648.db2.gz LGDSTDIPXDAUMX-MRXNPFEDSA-N 1 2 311.385 4.000 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1cc(-c2ccco2)on1 ZINC000175144116 337144649 /nfs/dbraw/zinc/14/46/49/337144649.db2.gz LGDSTDIPXDAUMX-MRXNPFEDSA-N 1 2 311.385 4.000 20 0 DIADLO CCCn1c(C(=O)Nc2c(C)cc[nH+]c2C)cc2ccccc21 ZINC000425598568 337151623 /nfs/dbraw/zinc/15/16/23/337151623.db2.gz XADQRGHLDCUNJL-UHFFFAOYSA-N 1 2 307.397 4.315 20 0 DIADLO CCC1(NC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)CCC1 ZINC000176559310 337152089 /nfs/dbraw/zinc/15/20/89/337152089.db2.gz WESCHYVSYCUDHP-UHFFFAOYSA-N 1 2 311.385 4.328 20 0 DIADLO FC(F)(F)c1cccc(CN2CCCC[C@H]2c2[nH]cc[nH+]2)c1 ZINC000177039871 337152932 /nfs/dbraw/zinc/15/29/32/337152932.db2.gz SIHBMJIGHFNPHU-AWEZNQCLSA-N 1 2 309.335 4.156 20 0 DIADLO CCc1cccc(C)c1NCc1[nH+]ccn1Cc1ccccc1 ZINC000176909382 337153794 /nfs/dbraw/zinc/15/37/94/337153794.db2.gz ARJHPDRCXULUPA-UHFFFAOYSA-N 1 2 305.425 4.414 20 0 DIADLO Cc1[nH]c2ccccc2c1C1=CC[N@H+](Cc2cscn2)CC1 ZINC000177094670 337155366 /nfs/dbraw/zinc/15/53/66/337155366.db2.gz CDTQYEHENLBLNC-UHFFFAOYSA-N 1 2 309.438 4.222 20 0 DIADLO Cc1[nH]c2ccccc2c1C1=CC[N@@H+](Cc2cscn2)CC1 ZINC000177094670 337155367 /nfs/dbraw/zinc/15/53/67/337155367.db2.gz CDTQYEHENLBLNC-UHFFFAOYSA-N 1 2 309.438 4.222 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3cc(-c4ccccc4)oc3C2)oc1C ZINC000177721514 337158682 /nfs/dbraw/zinc/15/86/82/337158682.db2.gz HTXFNBUQAHLDJB-UHFFFAOYSA-N 1 2 308.381 4.110 20 0 DIADLO Cc1nc(C[N@H+]2CCc3cc(-c4ccccc4)oc3C2)oc1C ZINC000177721514 337158683 /nfs/dbraw/zinc/15/86/83/337158683.db2.gz HTXFNBUQAHLDJB-UHFFFAOYSA-N 1 2 308.381 4.110 20 0 DIADLO CCC[N@H+](Cc1nc([C@H](C)SCC)no1)Cc1ccccc1 ZINC000178254329 337161673 /nfs/dbraw/zinc/16/16/73/337161673.db2.gz FCROGZAZNDVFRB-AWEZNQCLSA-N 1 2 319.474 4.296 20 0 DIADLO CCC[N@@H+](Cc1nc([C@H](C)SCC)no1)Cc1ccccc1 ZINC000178254329 337161674 /nfs/dbraw/zinc/16/16/74/337161674.db2.gz FCROGZAZNDVFRB-AWEZNQCLSA-N 1 2 319.474 4.296 20 0 DIADLO Cc1cccc(C(C)(C)[NH2+]Cc2noc(C3CCCCC3)n2)c1 ZINC000179594211 337170413 /nfs/dbraw/zinc/17/04/13/337170413.db2.gz BAXUJJLDGKCXHI-UHFFFAOYSA-N 1 2 313.445 4.451 20 0 DIADLO C[N@H+](Cc1ccc(-c2ccc(F)cc2)o1)Cc1nccs1 ZINC000179836904 337172192 /nfs/dbraw/zinc/17/21/92/337172192.db2.gz MCFSUVNDMIFPCF-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1ccc(-c2ccc(F)cc2)o1)Cc1nccs1 ZINC000179836904 337172193 /nfs/dbraw/zinc/17/21/93/337172193.db2.gz MCFSUVNDMIFPCF-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO Cc1cnc(C[NH+]2CCC(Oc3ccccc3Cl)CC2)s1 ZINC000180667622 337177152 /nfs/dbraw/zinc/17/71/52/337177152.db2.gz ZPZOAFSIRISRHR-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO Fc1cccc(-c2cnc(C[N@H+](Cc3ccccn3)C3CC3)o2)c1 ZINC000180868342 337178245 /nfs/dbraw/zinc/17/82/45/337178245.db2.gz HLRQQKAHQXBNNX-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1cccc(-c2cnc(C[N@@H+](Cc3ccccn3)C3CC3)o2)c1 ZINC000180868342 337178246 /nfs/dbraw/zinc/17/82/46/337178246.db2.gz HLRQQKAHQXBNNX-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO CC[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccccc1F ZINC000180969711 337178997 /nfs/dbraw/zinc/17/89/97/337178997.db2.gz LJQHWAAQMXOQJO-SFHVURJKSA-N 1 2 301.409 4.378 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](CC2CCC2)c2ccccc2)no1 ZINC000181344709 337181351 /nfs/dbraw/zinc/18/13/51/337181351.db2.gz ZKHXBWYBPMKKQI-QGZVFWFLSA-N 1 2 313.445 4.433 20 0 DIADLO CCc1nc(CSCc2cn3c(cccc3C)[nH+]2)cs1 ZINC000181477758 337182391 /nfs/dbraw/zinc/18/23/91/337182391.db2.gz WQCYBCLDDMISBZ-UHFFFAOYSA-N 1 2 303.456 4.095 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cccc(O)c1)c1ncc(-c2ccccc2)o1 ZINC000181579842 337183118 /nfs/dbraw/zinc/18/31/18/337183118.db2.gz QDTOGCRLBKHUDY-ZIAGYGMSSA-N 1 2 308.381 4.459 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2ccccc2F)n1)c1ccccn1 ZINC000181782625 337184582 /nfs/dbraw/zinc/18/45/82/337184582.db2.gz TZWFNSYVQNZUGQ-LBPRGKRZSA-N 1 2 313.401 4.195 20 0 DIADLO CCc1cc(NC(=O)N2CCCC[C@H]2c2[nH]cc[nH+]2)ccc1C ZINC000181976667 337185595 /nfs/dbraw/zinc/18/55/95/337185595.db2.gz JCUANUBLWKYEEG-INIZCTEOSA-N 1 2 312.417 4.040 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2sc(C)nc2C(F)(F)F)n1 ZINC000183670838 337194026 /nfs/dbraw/zinc/19/40/26/337194026.db2.gz FMLOOPIKSOQKIR-ZETCQYMHSA-N 1 2 321.393 4.086 20 0 DIADLO Cc1ccc(N[C@@H]2CCc3c2cccc3Br)c[nH+]1 ZINC000225838845 337194397 /nfs/dbraw/zinc/19/43/97/337194397.db2.gz NWAVQKIXMDAYGY-OAHLLOKOSA-N 1 2 303.203 4.252 20 0 DIADLO Cc1ccc(C(=O)N2CCCC3(CC3)C2)cc1Oc1cc[nH+]cc1 ZINC000184137391 337196452 /nfs/dbraw/zinc/19/64/52/337196452.db2.gz OHBQMHQILYRDRJ-UHFFFAOYSA-N 1 2 322.408 4.199 20 0 DIADLO Cc1cncc([C@H](C)[NH2+][C@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000184426069 337197204 /nfs/dbraw/zinc/19/72/04/337197204.db2.gz GLSAAWROSIUMHL-MGPUTAFESA-N 1 2 321.399 4.364 20 0 DIADLO Cc1ccc(CNc2ccc(-n3cccn3)c(Cl)c2)c(C)[nH+]1 ZINC000184434685 337197307 /nfs/dbraw/zinc/19/73/07/337197307.db2.gz VMNJVISBGUDQFH-UHFFFAOYSA-N 1 2 312.804 4.150 20 0 DIADLO Cc1cncc([C@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)c1 ZINC000184329626 337197878 /nfs/dbraw/zinc/19/78/78/337197878.db2.gz ZDVAPPGSMDOSPX-YOEHRIQHSA-N 1 2 309.438 4.287 20 0 DIADLO Cc1ccc(CSCc2nc(-c3ccccc3)no2)c(C)[nH+]1 ZINC000184810137 337200265 /nfs/dbraw/zinc/20/02/65/337200265.db2.gz XHAXPEPHEPNXPY-UHFFFAOYSA-N 1 2 311.410 4.182 20 0 DIADLO Cc1ccc(CSc2ccc(Br)cn2)c(C)[nH+]1 ZINC000184812842 337200298 /nfs/dbraw/zinc/20/02/98/337200298.db2.gz ZUXNQHWKTPSEKP-UHFFFAOYSA-N 1 2 309.232 4.148 20 0 DIADLO CCCCc1noc([C@@H](C)SCc2ccc(C)[nH+]c2C)n1 ZINC000184824492 337200419 /nfs/dbraw/zinc/20/04/19/337200419.db2.gz VMUYBAYXXSOZFR-CYBMUJFWSA-N 1 2 305.447 4.418 20 0 DIADLO Fc1c[nH+]ccc1NCc1ccc(OC(F)F)c(Cl)c1 ZINC000186426600 337256078 /nfs/dbraw/zinc/25/60/78/337256078.db2.gz HZJPNCBEHRXYPF-UHFFFAOYSA-N 1 2 302.683 4.088 20 0 DIADLO C[C@@H]1C[NH+](Cc2nc(-c3ccccc3Cl)cs2)C[C@@H](C)O1 ZINC000186459179 337256298 /nfs/dbraw/zinc/25/62/98/337256298.db2.gz OMCLQMGJSRHYOZ-VXGBXAGGSA-N 1 2 322.861 4.073 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000186727152 337259114 /nfs/dbraw/zinc/25/91/14/337259114.db2.gz OSSPXIQMTWOZJT-UHFFFAOYSA-N 1 2 320.314 4.079 20 0 DIADLO COc1ccc2nc(C[N@H+](C)[C@H](C)c3ccco3)sc2c1 ZINC000186804216 337259896 /nfs/dbraw/zinc/25/98/96/337259896.db2.gz CLCKQXUZMSSULF-LLVKDONJSA-N 1 2 302.399 4.091 20 0 DIADLO COc1ccc2nc(C[N@@H+](C)[C@H](C)c3ccco3)sc2c1 ZINC000186804216 337259897 /nfs/dbraw/zinc/25/98/97/337259897.db2.gz CLCKQXUZMSSULF-LLVKDONJSA-N 1 2 302.399 4.091 20 0 DIADLO Cc1ccc(C[S@@](=O)[C@@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000187069697 337261656 /nfs/dbraw/zinc/26/16/56/337261656.db2.gz INRYRLQUDBBNTA-RNODOKPDSA-N 1 2 307.846 4.362 20 0 DIADLO Cc1cc(C)c(C[S@@](=O)Cc2ccc(C)[nH+]c2C)c(C)c1 ZINC000187150602 337263082 /nfs/dbraw/zinc/26/30/82/337263082.db2.gz VSKOFCSNVNIPGO-NRFANRHFSA-N 1 2 301.455 4.073 20 0 DIADLO Cc1ccc(C[S@@](=O)CCCc2ccccc2Cl)c(C)[nH+]1 ZINC000187225136 337263276 /nfs/dbraw/zinc/26/32/76/337263276.db2.gz JYZUMULLTAOORK-NRFANRHFSA-N 1 2 321.873 4.233 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccccc2)c[nH]1)c1ccc(F)cc1F ZINC000187409260 337265772 /nfs/dbraw/zinc/26/57/72/337265772.db2.gz NYEYNBWNFALBDE-GFCCVEGCSA-N 1 2 313.351 4.206 20 0 DIADLO Cc1ccc(CS(=O)(=O)[C@@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000187416194 337265827 /nfs/dbraw/zinc/26/58/27/337265827.db2.gz DBPWHKGXOJWPJO-ZDUSSCGKSA-N 1 2 323.845 4.028 20 0 DIADLO Cc1ccc(CS(=O)(=O)[C@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000187416210 337265880 /nfs/dbraw/zinc/26/58/80/337265880.db2.gz DBPWHKGXOJWPJO-CYBMUJFWSA-N 1 2 323.845 4.028 20 0 DIADLO CC[C@@H]1[C@@H](C)CCN1C(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000187480069 337266118 /nfs/dbraw/zinc/26/61/18/337266118.db2.gz WFIVWEUJJZZQKI-KBXCAEBGSA-N 1 2 324.424 4.443 20 0 DIADLO Cc1ccc(CNc2ccccc2OCC(F)(F)F)c(C)[nH+]1 ZINC000187707822 337269518 /nfs/dbraw/zinc/26/95/18/337269518.db2.gz YMTRWECCJCCOID-UHFFFAOYSA-N 1 2 310.319 4.252 20 0 DIADLO Cc1ccc(CNc2cccc(OCC(F)(F)F)c2)c(C)[nH+]1 ZINC000187716067 337269541 /nfs/dbraw/zinc/26/95/41/337269541.db2.gz VCKCFWLCWWMLFM-UHFFFAOYSA-N 1 2 310.319 4.252 20 0 DIADLO CCOc1cc2c(cc1NCc1ccc(C)[nH+]c1C)O[C@@H](C)C2 ZINC000187727636 337269572 /nfs/dbraw/zinc/26/95/72/337269572.db2.gz PYJTZGOLVWIDJD-ZDUSSCGKSA-N 1 2 312.413 4.033 20 0 DIADLO Cc1ccc2cc(C[NH2+][C@@H](C)c3nc(C(C)(C)C)no3)ccc2n1 ZINC000189367495 337278936 /nfs/dbraw/zinc/27/89/36/337278936.db2.gz PMUXTGIDUMKUAX-ZDUSSCGKSA-N 1 2 324.428 4.075 20 0 DIADLO CCOc1cccc2cc([C@@H](C)[NH2+]Cc3ncccc3F)oc21 ZINC000530418729 337279328 /nfs/dbraw/zinc/27/93/28/337279328.db2.gz DONLCQNHSMOZSR-GFCCVEGCSA-N 1 2 314.360 4.216 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H]1CCOc2ccc(F)cc21 ZINC000189583381 337280395 /nfs/dbraw/zinc/28/03/95/337280395.db2.gz KWYPHRWANPUNCS-OAHLLOKOSA-N 1 2 321.779 4.101 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2csc(C)n2)cc1Cl ZINC000189751239 337282460 /nfs/dbraw/zinc/28/24/60/337282460.db2.gz UKLIZGDAZLJYIX-HNNXBMFYSA-N 1 2 322.861 4.451 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2csc(C)n2)cc1Cl ZINC000189751239 337282461 /nfs/dbraw/zinc/28/24/61/337282461.db2.gz UKLIZGDAZLJYIX-HNNXBMFYSA-N 1 2 322.861 4.451 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000189825590 337283301 /nfs/dbraw/zinc/28/33/01/337283301.db2.gz CIZVRCWXTMNPCQ-OAHLLOKOSA-N 1 2 322.861 4.451 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000189825590 337283302 /nfs/dbraw/zinc/28/33/02/337283302.db2.gz CIZVRCWXTMNPCQ-OAHLLOKOSA-N 1 2 322.861 4.451 20 0 DIADLO Cc1ccc(NC(=O)Cc2ccccc2OC2CCCC2)c(C)[nH+]1 ZINC000583247960 337287633 /nfs/dbraw/zinc/28/76/33/337287633.db2.gz TYGDXTHLWBBTHM-UHFFFAOYSA-N 1 2 324.424 4.201 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2nccn2-c2ccccc2)cc1 ZINC000191209997 337294997 /nfs/dbraw/zinc/29/49/97/337294997.db2.gz VLLRHTYSBOMVBO-MRXNPFEDSA-N 1 2 321.424 4.074 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2nccn2-c2ccccc2)cc1 ZINC000191209997 337294998 /nfs/dbraw/zinc/29/49/98/337294998.db2.gz VLLRHTYSBOMVBO-MRXNPFEDSA-N 1 2 321.424 4.074 20 0 DIADLO CC(C)c1nc2n(n1)CCC[C@H]2[NH2+][C@@H](C)c1csc(Cl)c1 ZINC000191337224 337296090 /nfs/dbraw/zinc/29/60/90/337296090.db2.gz KKLLJNJVMGVRIG-CMPLNLGQSA-N 1 2 324.881 4.302 20 0 DIADLO CC(C)N(C)c1ccc(CNc2nccc3sccc32)c[nH+]1 ZINC000191557677 337298963 /nfs/dbraw/zinc/29/89/63/337298963.db2.gz UPOROYNYSBOAHZ-UHFFFAOYSA-N 1 2 312.442 4.148 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+][C@H]2CSC[C@@H]2C)C(F)F)c1 ZINC000583273650 337299723 /nfs/dbraw/zinc/29/97/23/337299723.db2.gz XCQOIXCMZKPESI-CQDKDKBSSA-N 1 2 315.429 4.121 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+][C@H]2CSC[C@H]2C)C(F)F)c1 ZINC000583273653 337299789 /nfs/dbraw/zinc/29/97/89/337299789.db2.gz XCQOIXCMZKPESI-UGFHNGPFSA-N 1 2 315.429 4.121 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)Cc2cccnc2)c1C(C)C ZINC000191957249 337301328 /nfs/dbraw/zinc/30/13/28/337301328.db2.gz KYCVFHKLVDPUSH-UHFFFAOYSA-N 1 2 319.408 4.243 20 0 DIADLO CC(C)[N@H+](Cc1ccc(Cl)c(Cl)c1)Cc1ncccn1 ZINC000191951962 337301400 /nfs/dbraw/zinc/30/14/00/337301400.db2.gz JAOKKCLBFAYJQY-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO CC(C)[N@@H+](Cc1ccc(Cl)c(Cl)c1)Cc1ncccn1 ZINC000191951962 337301401 /nfs/dbraw/zinc/30/14/01/337301401.db2.gz JAOKKCLBFAYJQY-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO Clc1ccccc1C[N@H+](Cc1ncccn1)C1CCCC1 ZINC000191995482 337302577 /nfs/dbraw/zinc/30/25/77/337302577.db2.gz UDKVRLHSIRGIJH-UHFFFAOYSA-N 1 2 301.821 4.075 20 0 DIADLO Clc1ccccc1C[N@@H+](Cc1ncccn1)C1CCCC1 ZINC000191995482 337302578 /nfs/dbraw/zinc/30/25/78/337302578.db2.gz UDKVRLHSIRGIJH-UHFFFAOYSA-N 1 2 301.821 4.075 20 0 DIADLO Cc1cc(N2CCCC2)ccc1[NH2+][C@@H](C)Cc1ccc(O)cc1 ZINC000321915499 337304095 /nfs/dbraw/zinc/30/40/95/337304095.db2.gz APMDXOIQNSVFGL-INIZCTEOSA-N 1 2 310.441 4.344 20 0 DIADLO Cc1cc(C)c(NC(=O)c2nc(-c3ccccc3)cs2)c(C)[nH+]1 ZINC000192536903 337306303 /nfs/dbraw/zinc/30/63/03/337306303.db2.gz HVKFOULWPKFJOE-UHFFFAOYSA-N 1 2 323.421 4.383 20 0 DIADLO COc1cccc(C[NH2+][C@H](c2ccccc2)c2cccnc2)c1F ZINC000192679040 337306815 /nfs/dbraw/zinc/30/68/15/337306815.db2.gz GSCCPQMTRLMSCL-HXUWFJFHSA-N 1 2 322.383 4.109 20 0 DIADLO CCCc1nc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)cs1 ZINC000064515900 337307251 /nfs/dbraw/zinc/30/72/51/337307251.db2.gz WTYXTIIQVJJKQL-PBHICJAKSA-N 1 2 316.470 4.058 20 0 DIADLO CCCc1nc(C[N@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)cs1 ZINC000064515900 337307252 /nfs/dbraw/zinc/30/72/52/337307252.db2.gz WTYXTIIQVJJKQL-PBHICJAKSA-N 1 2 316.470 4.058 20 0 DIADLO COC[C@@H](Nc1cc(C)[nH+]c(C2CC2)n1)c1ccc(Cl)cc1 ZINC000192810653 337307756 /nfs/dbraw/zinc/30/77/56/337307756.db2.gz WEXPWDGMRFGFKI-OAHLLOKOSA-N 1 2 317.820 4.115 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(-n3cccc3)cc2)c(C)[nH+]1 ZINC000193182864 337309956 /nfs/dbraw/zinc/30/99/56/337309956.db2.gz JKZXIZAHIZEQHV-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)[C@@H]1CCC(C)=C(C)C1 ZINC000583755502 337330065 /nfs/dbraw/zinc/33/00/65/337330065.db2.gz SEPGAEOTZGRJEJ-IAGOWNOFSA-N 1 2 315.461 4.093 20 0 DIADLO Cc1ccc(Nc2ccccc2C(=O)Nc2cc[nH+]cc2C)cc1 ZINC000583824340 337337219 /nfs/dbraw/zinc/33/72/19/337337219.db2.gz JKVQXRMYMNIYJZ-UHFFFAOYSA-N 1 2 317.392 4.116 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NC[C@H]1CCC[C@H]1c1ccccc1 ZINC000584453251 337340253 /nfs/dbraw/zinc/34/02/53/337340253.db2.gz IYVBBVMOGZRVLI-MSOLQXFVSA-N 1 2 323.440 4.404 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NC[C@@H]1CCC[C@H]1c1ccccc1 ZINC000584453253 337340284 /nfs/dbraw/zinc/34/02/84/337340284.db2.gz IYVBBVMOGZRVLI-ROUUACIJSA-N 1 2 323.440 4.404 20 0 DIADLO CC(C)CC1(c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)CC1 ZINC000583897665 337384599 /nfs/dbraw/zinc/38/45/99/337384599.db2.gz GARVPNHBXJQGSV-UHFFFAOYSA-N 1 2 308.385 4.000 20 0 DIADLO CCCCC1CCC(C(=O)N2CCC(n3cc[nH+]c3)CC2)CC1 ZINC000101863548 337386212 /nfs/dbraw/zinc/38/62/12/337386212.db2.gz GIDXPYIIMKVDQG-UHFFFAOYSA-N 1 2 317.477 4.043 20 0 DIADLO C[C@@H](CC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1)C1CCCCC1 ZINC000120120134 337395531 /nfs/dbraw/zinc/39/55/31/337395531.db2.gz AQJUQSGRTGEYNN-GOEBONIOSA-N 1 2 303.450 4.070 20 0 DIADLO C[C@@H](CC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1)C1CCCCC1 ZINC000120120422 337395541 /nfs/dbraw/zinc/39/55/41/337395541.db2.gz AQJUQSGRTGEYNN-HOCLYGCPSA-N 1 2 303.450 4.070 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[NH+]3Cc4ccccc4C3)o2)cc1C ZINC000120260594 337395678 /nfs/dbraw/zinc/39/56/78/337395678.db2.gz YDFNMQLORZHVEG-OAHLLOKOSA-N 1 2 319.408 4.430 20 0 DIADLO Cc1ccc(C)c([C@@H]2CCCN2C(=O)Nc2cc[nH+]cc2C)c1 ZINC000120797473 337396072 /nfs/dbraw/zinc/39/60/72/337396072.db2.gz XRXAZOVNMICPFS-SFHVURJKSA-N 1 2 309.413 4.376 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(-c2ccco2)no1)c1cccc(Cl)c1 ZINC000125287919 337410403 /nfs/dbraw/zinc/41/04/03/337410403.db2.gz HEEUQQDPUBLCCI-CYBMUJFWSA-N 1 2 317.776 4.224 20 0 DIADLO c1nc(C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCCC4)cs1 ZINC000126621255 337417262 /nfs/dbraw/zinc/41/72/62/337417262.db2.gz KTLQVDRAGSOHCH-QGZVFWFLSA-N 1 2 314.454 4.025 20 0 DIADLO CC(C)c1ccc2c(c1)[C@@H]([NH2+]Cc1cscn1)CCCO2 ZINC000126620989 337417299 /nfs/dbraw/zinc/41/72/99/337417299.db2.gz WRGIGWXREMTCCO-INIZCTEOSA-N 1 2 302.443 4.270 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2cccc(F)c2)cc1 ZINC000128538896 337425664 /nfs/dbraw/zinc/42/56/64/337425664.db2.gz ZSWSMYPERREBMC-DNVCBOLYSA-N 1 2 323.415 4.308 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2cccc(F)c2)c1 ZINC000128544893 337425667 /nfs/dbraw/zinc/42/56/67/337425667.db2.gz XRCWDBMWVOCPEY-DNVCBOLYSA-N 1 2 323.415 4.308 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@H](c2nccn2C)c2cccc(F)c2)cc1 ZINC000128538644 337425694 /nfs/dbraw/zinc/42/56/94/337425694.db2.gz ZSWSMYPERREBMC-KXBFYZLASA-N 1 2 323.415 4.308 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)s1 ZINC000567105576 337447790 /nfs/dbraw/zinc/44/77/90/337447790.db2.gz ABULDPJWOBVMBY-UHFFFAOYSA-N 1 2 305.205 4.187 20 0 DIADLO CSc1ccccc1C(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000194743855 337463456 /nfs/dbraw/zinc/46/34/56/337463456.db2.gz FNVVZAHMVOXRCY-UHFFFAOYSA-N 1 2 323.421 4.061 20 0 DIADLO C[C@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1cccc(O)c1 ZINC000194874130 337463970 /nfs/dbraw/zinc/46/39/70/337463970.db2.gz UEHKGAWOPGOURR-GUYCJALGSA-N 1 2 310.422 4.289 20 0 DIADLO FC(F)(F)c1cccc(N[C@@H](c2[nH]cc[nH+]2)c2cccnc2)c1 ZINC000195104341 337465253 /nfs/dbraw/zinc/46/52/53/337465253.db2.gz LXUVOAPOMQJARM-CQSZACIVSA-N 1 2 318.302 4.025 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CS[C@@H](C)C(=O)NC(C)(C)C ZINC000419490626 337487648 /nfs/dbraw/zinc/48/76/48/337487648.db2.gz IJAPZROECMIZTF-ZDUSSCGKSA-N 1 2 308.491 4.050 20 0 DIADLO CCc1nnc([C@@H](C)SCc2ccc(C(C)C)[nH+]c2C)o1 ZINC000419497423 337488149 /nfs/dbraw/zinc/48/81/49/337488149.db2.gz XIIICNGSEKBLQL-GFCCVEGCSA-N 1 2 305.447 4.453 20 0 DIADLO Cn1cc(Cl)c(C[NH2+][C@H](c2cccc(F)c2)C(C)(C)C)n1 ZINC000420929334 337516532 /nfs/dbraw/zinc/51/65/32/337516532.db2.gz DLACXVLCZJBTDW-OAHLLOKOSA-N 1 2 309.816 4.090 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](CC(F)F)c2ccccc2)s1 ZINC000420998571 337518352 /nfs/dbraw/zinc/51/83/52/337518352.db2.gz UAMPTHDIHFTIGV-GFCCVEGCSA-N 1 2 311.401 4.148 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc([C@@H](C)C(C)(C)C)n1 ZINC000445387479 337523456 /nfs/dbraw/zinc/52/34/56/337523456.db2.gz XQLSLTFZNBRXJG-GFCCVEGCSA-N 1 2 312.417 4.120 20 0 DIADLO Cc1c(Cl)c(C[NH2+]C2(c3ccc(F)cc3)CCCC2)nn1C ZINC000421326948 337526641 /nfs/dbraw/zinc/52/66/41/337526641.db2.gz PBWJNZLZGWVWEA-UHFFFAOYSA-N 1 2 321.827 4.080 20 0 DIADLO CC[C@@H]1C[C@@]1([NH2+]Cc1nn(C)c(C)c1Cl)c1cccc(C)c1 ZINC000421359464 337532005 /nfs/dbraw/zinc/53/20/05/337532005.db2.gz WVBXHOZQRSNQCV-KDOFPFPSSA-N 1 2 317.864 4.105 20 0 DIADLO Cc1cc(CCCC(=O)NCc2cc(C)[nH+]c(C)c2)c(C)s1 ZINC000421578515 337540120 /nfs/dbraw/zinc/54/01/20/337540120.db2.gz RGJLWBQJDAPZBX-UHFFFAOYSA-N 1 2 316.470 4.016 20 0 DIADLO Cc1cc(CNC(=O)CCc2ccc(C(C)C)cc2)cc(C)[nH+]1 ZINC000421574134 337542131 /nfs/dbraw/zinc/54/21/31/337542131.db2.gz DKNSRMCTZWWCRD-UHFFFAOYSA-N 1 2 310.441 4.071 20 0 DIADLO CCSc1cccc(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000072697433 337548252 /nfs/dbraw/zinc/54/82/52/337548252.db2.gz NVVJTJLEFLBHDD-UHFFFAOYSA-N 1 2 323.421 4.237 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)cc[nH+]1 ZINC000073409123 337549976 /nfs/dbraw/zinc/54/99/76/337549976.db2.gz OZOUYRSSNOUDDD-ZIAGYGMSSA-N 1 2 320.314 4.151 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1nc(C2CC2)no1 ZINC000247220857 337558513 /nfs/dbraw/zinc/55/85/13/337558513.db2.gz MHPQLIDHLJNUDB-PJODQICGSA-N 1 2 315.417 4.150 20 0 DIADLO Cc1cc[nH+]cc1CCCNc1cc(F)ccc1OC(C)C ZINC000572286685 337604998 /nfs/dbraw/zinc/60/49/98/337604998.db2.gz VROGCTTUOJUTQQ-UHFFFAOYSA-N 1 2 302.393 4.361 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2N(C)C)cs1 ZINC000162391421 337617338 /nfs/dbraw/zinc/61/73/38/337617338.db2.gz AQHVEEWQJJWZOI-NEPJUHHUSA-N 1 2 321.465 4.322 20 0 DIADLO C[C@H](Oc1ccc[nH+]c1NCc1cscn1)c1ccccc1 ZINC000162407935 337618259 /nfs/dbraw/zinc/61/82/59/337618259.db2.gz HOWPQQHRZLFNNG-ZDUSSCGKSA-N 1 2 311.410 4.290 20 0 DIADLO CCc1nocc1CSCc1ccc(-n2cc[nH+]c2)cc1C ZINC000580465240 337679590 /nfs/dbraw/zinc/67/95/90/337679590.db2.gz AMZCHGDXZGDCHV-UHFFFAOYSA-N 1 2 313.426 4.165 20 0 DIADLO CC(C)=CCS[C@@H](C)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000446140491 338521576 /nfs/dbraw/zinc/52/15/76/338521576.db2.gz VMWNTROFYHGKKB-ZDUSSCGKSA-N 1 2 315.442 4.103 20 0 DIADLO C[C@@H](Nc1ccccc1OCCn1cc[nH+]c1)C1CCCCC1 ZINC000527522675 337748649 /nfs/dbraw/zinc/74/86/49/337748649.db2.gz ICLXANMQBVYAJB-MRXNPFEDSA-N 1 2 313.445 4.343 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccsc2C(F)(F)F)cs1 ZINC000527658415 337756701 /nfs/dbraw/zinc/75/67/01/337756701.db2.gz ZRWCNYCGLKVXHQ-UHFFFAOYSA-N 1 2 306.378 4.076 20 0 DIADLO CC(C)c1cccc([C@@H](C)[NH2+]Cc2n[nH]cc2Br)c1 ZINC000527862816 337765953 /nfs/dbraw/zinc/76/59/53/337765953.db2.gz IGAYEXDCSJQYQT-LLVKDONJSA-N 1 2 322.250 4.146 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2ncccc2F)c(Br)c1 ZINC000527825895 337767220 /nfs/dbraw/zinc/76/72/20/337767220.db2.gz GITYPVKRBDORJS-NSHDSACASA-N 1 2 323.209 4.142 20 0 DIADLO Cn1cc[nH+]c1[C@@H](Nc1cc2c(cc1Cl)CCC2)C1CC1 ZINC000528002415 337779729 /nfs/dbraw/zinc/77/97/29/337779729.db2.gz QHHVVOKEBZEQRT-INIZCTEOSA-N 1 2 301.821 4.125 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc([C@H]2CCCC23CC3)n1 ZINC000528155692 337790529 /nfs/dbraw/zinc/79/05/29/337790529.db2.gz AVOONWRCGGMCOP-CQSZACIVSA-N 1 2 322.412 4.018 20 0 DIADLO CCC[C@H](OCC)C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000528318220 337801755 /nfs/dbraw/zinc/80/17/55/337801755.db2.gz XLQUXKWJRYCULV-KRWDZBQOSA-N 1 2 314.385 4.018 20 0 DIADLO CCC[C@@H](C(=O)Nc1c[nH+]ccc1OC)c1cccc(Cl)c1 ZINC000528317579 337801797 /nfs/dbraw/zinc/80/17/97/337801797.db2.gz FPZUBKKLZPGOTQ-CQSZACIVSA-N 1 2 318.804 4.266 20 0 DIADLO CSc1ccc(NCc2cn3cc(Cl)ccc3[nH+]2)cc1 ZINC000105863902 337811420 /nfs/dbraw/zinc/81/14/20/337811420.db2.gz UZLLTBIQZJPBOY-UHFFFAOYSA-N 1 2 303.818 4.322 20 0 DIADLO Cc1c2cccc(Cl)c2oc1C(=O)Nc1cc[nH+]cc1C ZINC000107294477 337828347 /nfs/dbraw/zinc/82/83/47/337828347.db2.gz DUIYMXJGLBNGQY-UHFFFAOYSA-N 1 2 300.745 4.350 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@H](C)Oc1cccc(C(C)(C)C)c1 ZINC000107292677 337828511 /nfs/dbraw/zinc/82/85/11/337828511.db2.gz YVPWXIPQYSUZRZ-AWEZNQCLSA-N 1 2 312.413 4.094 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+]Cc2cc(Cl)ccc2F)o1 ZINC000119345336 337857095 /nfs/dbraw/zinc/85/70/95/337857095.db2.gz BOKLTJVSDGOQOO-OAHLLOKOSA-N 1 2 311.784 4.112 20 0 DIADLO Cc1ccc(S[C@@H](C)C(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000119336925 337857721 /nfs/dbraw/zinc/85/77/21/337857721.db2.gz BWZHEWLNOCUEHM-AWEZNQCLSA-N 1 2 300.427 4.126 20 0 DIADLO C[C@@H](Sc1[nH+]cnc2c1cnn2C)c1ccc2ccccc2c1 ZINC000057499601 337860123 /nfs/dbraw/zinc/86/01/23/337860123.db2.gz APGZEHGKBDSTCR-GFCCVEGCSA-N 1 2 320.421 4.370 20 0 DIADLO Cc1cc(NC(=O)NCCCCCOC2CCCCC2)cc[nH+]1 ZINC000119723943 337862863 /nfs/dbraw/zinc/86/28/63/337862863.db2.gz PLNWHXPBOXZJIE-UHFFFAOYSA-N 1 2 319.449 4.031 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@@H](c1ccc(F)cc1F)C(C)C ZINC000121217499 337888126 /nfs/dbraw/zinc/88/81/26/337888126.db2.gz XVHXTXKIALOTOC-MRXNPFEDSA-N 1 2 319.355 4.187 20 0 DIADLO CCn1c(C[NH2+][C@H](C)c2ccc(F)cc2F)nc2ccccc21 ZINC000121607897 337895994 /nfs/dbraw/zinc/89/59/94/337895994.db2.gz CDNLZMIRFQINGP-GFCCVEGCSA-N 1 2 315.367 4.185 20 0 DIADLO Cc1nc([C@@H]([NH2+]C[C@@H]2CC=CCC2)c2ccc(Cl)cc2)no1 ZINC000092441405 337904330 /nfs/dbraw/zinc/90/43/30/337904330.db2.gz IJFODXIQWWKVEH-CJNGLKHVSA-N 1 2 317.820 4.067 20 0 DIADLO CC[C@@H]1CN(C(=O)Nc2cc[nH+]cc2C)CC[C@@H]1c1ccccc1 ZINC000122073133 337906048 /nfs/dbraw/zinc/90/60/48/337906048.db2.gz WRHOCVNPZRNXCN-AEFFLSMTSA-N 1 2 323.440 4.438 20 0 DIADLO CCC[C@@]1(C(F)(F)F)CCCN1Cc1cccc2[nH+]ccn21 ZINC000537204981 337912283 /nfs/dbraw/zinc/91/22/83/337912283.db2.gz OETJYLHCLSGRPO-HNNXBMFYSA-N 1 2 311.351 4.031 20 0 DIADLO Cc1cccc(C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)c1Cl ZINC000122249389 337912419 /nfs/dbraw/zinc/91/24/19/337912419.db2.gz ROZAEHBGHJBKGM-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2OC)c(F)c1 ZINC000122407386 337917623 /nfs/dbraw/zinc/91/76/23/337917623.db2.gz GQXYKEALSJQBKQ-NWDGAFQWSA-N 1 2 321.367 4.394 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2OC)c(F)c1 ZINC000122407515 337917696 /nfs/dbraw/zinc/91/76/96/337917696.db2.gz GQXYKEALSJQBKQ-VXGBXAGGSA-N 1 2 321.367 4.394 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2ccccc2OC(F)(F)F)s1 ZINC000122873467 337924787 /nfs/dbraw/zinc/92/47/87/337924787.db2.gz PQIAHDMKSLOEAA-SNVBAGLBSA-N 1 2 316.348 4.201 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)cc1 ZINC000537424855 337935772 /nfs/dbraw/zinc/93/57/72/337935772.db2.gz DKQRYYTVJVBPOB-HNNXBMFYSA-N 1 2 311.429 4.254 20 0 DIADLO CCc1cc(C[NH2+][C@H](c2ccccc2)c2ccc(OC)cc2)on1 ZINC000537610882 337946078 /nfs/dbraw/zinc/94/60/78/337946078.db2.gz SZXJUUWOUINCFF-HXUWFJFHSA-N 1 2 322.408 4.125 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C)c2ccccc2n1)c1ccccc1F ZINC000537612410 337946409 /nfs/dbraw/zinc/94/64/09/337946409.db2.gz OTWNMTOKTLPASU-QGZVFWFLSA-N 1 2 309.388 4.318 20 0 DIADLO CCCCS(=O)(=O)Nc1ccc([NH2+][C@@H](C)CC(C)C)cc1 ZINC000537750814 337960633 /nfs/dbraw/zinc/96/06/33/337960633.db2.gz DEJPJOLSJBTNHR-AWEZNQCLSA-N 1 2 312.479 4.075 20 0 DIADLO CCCC[C@@H](C)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000514755889 337969328 /nfs/dbraw/zinc/96/93/28/337969328.db2.gz KVIYLKMIEQEMQX-CQSZACIVSA-N 1 2 310.401 4.275 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccccc1 ZINC000516700172 337992459 /nfs/dbraw/zinc/99/24/59/337992459.db2.gz UBNKIVCGJMHWAR-CQSZACIVSA-N 1 2 323.371 4.144 20 0 DIADLO CCc1occc1C(=O)Nc1ccc2c(c1)[nH+]c1n2CCCCC1 ZINC000515735308 337995934 /nfs/dbraw/zinc/99/59/34/337995934.db2.gz QNNPMHUHPZLHGP-UHFFFAOYSA-N 1 2 323.396 4.170 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NC(=O)CCCc2ccccc2)c1 ZINC000516134385 338004839 /nfs/dbraw/zinc/00/48/39/338004839.db2.gz ZDLXWLSHYCJLAH-UHFFFAOYSA-N 1 2 319.408 4.049 20 0 DIADLO C[C@@H]([NH2+]CC(F)(F)c1ccccc1)c1ccc2c(c1)COC2 ZINC000516353890 338010515 /nfs/dbraw/zinc/01/05/15/338010515.db2.gz AJFOHLAVGWSIBP-CYBMUJFWSA-N 1 2 303.352 4.159 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1Cl)N(C)Cc1[nH+]ccn1C ZINC000445457039 338017523 /nfs/dbraw/zinc/01/75/23/338017523.db2.gz QPLMAAPFTVMJAJ-AWEZNQCLSA-N 1 2 312.244 4.310 20 0 DIADLO Cc1ccccc1-c1nc(C[NH2+]Cc2cc(Cl)cs2)no1 ZINC000426163583 338021887 /nfs/dbraw/zinc/02/18/87/338021887.db2.gz AWGBNMXOHPXMQT-UHFFFAOYSA-N 1 2 319.817 4.050 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cccc(-c3cccnc3)c2)CC1(F)F ZINC000426377327 338029627 /nfs/dbraw/zinc/02/96/27/338029627.db2.gz MNZJCYTYRJKPDG-CQSZACIVSA-N 1 2 302.368 4.226 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cccc(-c3cccnc3)c2)CC1(F)F ZINC000426377327 338029628 /nfs/dbraw/zinc/02/96/28/338029628.db2.gz MNZJCYTYRJKPDG-CQSZACIVSA-N 1 2 302.368 4.226 20 0 DIADLO Cc1c[nH+]cc(CCc2nc(Cc3c(C)cc(C)cc3C)no2)c1 ZINC000426464415 338032839 /nfs/dbraw/zinc/03/28/39/338032839.db2.gz ZBFASPUFDQCTES-UHFFFAOYSA-N 1 2 321.424 4.074 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2nnc(C(C)C)[nH]2)o1 ZINC000428244578 338044063 /nfs/dbraw/zinc/04/40/63/338044063.db2.gz IRXUHDSSKWROCU-HIFRSBDPSA-N 1 2 316.449 4.057 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2nnc(C(C)C)[nH]2)o1 ZINC000428244578 338044064 /nfs/dbraw/zinc/04/40/64/338044064.db2.gz IRXUHDSSKWROCU-HIFRSBDPSA-N 1 2 316.449 4.057 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2ccccc2Cl)C(C)C)[nH]1 ZINC000428318230 338046903 /nfs/dbraw/zinc/04/69/03/338046903.db2.gz FWWZDCDOOJCEGH-OAHLLOKOSA-N 1 2 306.841 4.068 20 0 DIADLO CC(C)c1nnc(C[N@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)[nH]1 ZINC000428366774 338048985 /nfs/dbraw/zinc/04/89/85/338048985.db2.gz ZFOUSBUCKUGLJA-GFCCVEGCSA-N 1 2 318.852 4.307 20 0 DIADLO CC(C)c1nnc(C[N@@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)[nH]1 ZINC000428366774 338048986 /nfs/dbraw/zinc/04/89/86/338048986.db2.gz ZFOUSBUCKUGLJA-GFCCVEGCSA-N 1 2 318.852 4.307 20 0 DIADLO CCCc1nc(C)c(C[NH2+][C@](C)(CC)c2nc(C)cs2)o1 ZINC000428386461 338049894 /nfs/dbraw/zinc/04/98/94/338049894.db2.gz WZKZPIUZPHCVIO-MRXNPFEDSA-N 1 2 307.463 4.115 20 0 DIADLO CCCc1nc(C)c(C[N@H+](Cc2ccccc2F)C2CC2)o1 ZINC000428457010 338052793 /nfs/dbraw/zinc/05/27/93/338052793.db2.gz GVGVISDEIZSFMH-UHFFFAOYSA-N 1 2 302.393 4.239 20 0 DIADLO CCCc1nc(C)c(C[N@@H+](Cc2ccccc2F)C2CC2)o1 ZINC000428457010 338052794 /nfs/dbraw/zinc/05/27/94/338052794.db2.gz GVGVISDEIZSFMH-UHFFFAOYSA-N 1 2 302.393 4.239 20 0 DIADLO CC[N@H+](Cc1nnc(C(C)C)[nH]1)[C@H](C)c1cc2ccccc2o1 ZINC000428458395 338052874 /nfs/dbraw/zinc/05/28/74/338052874.db2.gz BQEZJXPMXNQVTC-CYBMUJFWSA-N 1 2 312.417 4.257 20 0 DIADLO CC[N@@H+](Cc1nnc(C(C)C)[nH]1)[C@H](C)c1cc2ccccc2o1 ZINC000428458395 338052875 /nfs/dbraw/zinc/05/28/75/338052875.db2.gz BQEZJXPMXNQVTC-CYBMUJFWSA-N 1 2 312.417 4.257 20 0 DIADLO Cc1nc(C(C)C)oc1C[NH+](Cc1ccco1)Cc1ccco1 ZINC000428460437 338053037 /nfs/dbraw/zinc/05/30/37/338053037.db2.gz NONBXHQGVRJQAD-UHFFFAOYSA-N 1 2 314.385 4.495 20 0 DIADLO CCCc1nc(C)c(C[N@H+](Cc2ccc(F)cc2F)C2CC2)o1 ZINC000428469070 338053943 /nfs/dbraw/zinc/05/39/43/338053943.db2.gz RXWRXONRVBUUOC-UHFFFAOYSA-N 1 2 320.383 4.378 20 0 DIADLO CCCc1nc(C)c(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)o1 ZINC000428469070 338053944 /nfs/dbraw/zinc/05/39/44/338053944.db2.gz RXWRXONRVBUUOC-UHFFFAOYSA-N 1 2 320.383 4.378 20 0 DIADLO Clc1ccc(C2CCN(Cc3[nH]cc[nH+]3)CC2)c(Cl)c1 ZINC000428705355 338058862 /nfs/dbraw/zinc/05/88/62/338058862.db2.gz BHFZHZHGNZHXDI-UHFFFAOYSA-N 1 2 310.228 4.096 20 0 DIADLO Clc1ccc(C2CC[NH+](Cc3ncc[nH]3)CC2)c(Cl)c1 ZINC000428705355 338058863 /nfs/dbraw/zinc/05/88/63/338058863.db2.gz BHFZHZHGNZHXDI-UHFFFAOYSA-N 1 2 310.228 4.096 20 0 DIADLO CCCCc1nc(C[N@H+](C(C)C)[C@@H](C)c2ccccc2)no1 ZINC000428841088 338061837 /nfs/dbraw/zinc/06/18/37/338061837.db2.gz PAFJDBMIKMCCGF-HNNXBMFYSA-N 1 2 301.434 4.384 20 0 DIADLO CCCCc1nc(C[N@@H+](C(C)C)[C@@H](C)c2ccccc2)no1 ZINC000428841088 338061838 /nfs/dbraw/zinc/06/18/38/338061838.db2.gz PAFJDBMIKMCCGF-HNNXBMFYSA-N 1 2 301.434 4.384 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2Cc3ccccc3O[C@@H](C)C2)n1 ZINC000429183745 338072709 /nfs/dbraw/zinc/07/27/09/338072709.db2.gz RKTCBANTPQKCPT-HNNXBMFYSA-N 1 2 313.445 4.027 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2Cc3ccccc3O[C@@H](C)C2)n1 ZINC000429183745 338072710 /nfs/dbraw/zinc/07/27/10/338072710.db2.gz RKTCBANTPQKCPT-HNNXBMFYSA-N 1 2 313.445 4.027 20 0 DIADLO CC(C)n1cnnc1C[N@H+](C)[C@H](C)c1ccc2ccccc2c1 ZINC000429290047 338076578 /nfs/dbraw/zinc/07/65/78/338076578.db2.gz QSWZPIRXKIFEPB-OAHLLOKOSA-N 1 2 308.429 4.205 20 0 DIADLO CC(C)n1cnnc1C[N@@H+](C)[C@H](C)c1ccc2ccccc2c1 ZINC000429290047 338076579 /nfs/dbraw/zinc/07/65/79/338076579.db2.gz QSWZPIRXKIFEPB-OAHLLOKOSA-N 1 2 308.429 4.205 20 0 DIADLO CCC(C)(C)c1ccc(C[N@H+](C)Cc2nncn2C(C)C)cc1 ZINC000429291446 338076879 /nfs/dbraw/zinc/07/68/79/338076879.db2.gz GLSFHIQWFYMFOH-UHFFFAOYSA-N 1 2 314.477 4.179 20 0 DIADLO CCC(C)(C)c1ccc(C[N@@H+](C)Cc2nncn2C(C)C)cc1 ZINC000429291446 338076880 /nfs/dbraw/zinc/07/68/80/338076880.db2.gz GLSFHIQWFYMFOH-UHFFFAOYSA-N 1 2 314.477 4.179 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000429404197 338079697 /nfs/dbraw/zinc/07/96/97/338079697.db2.gz LLFHRJGEJDMKBR-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000429404197 338079698 /nfs/dbraw/zinc/07/96/98/338079698.db2.gz LLFHRJGEJDMKBR-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1csc(-c3ccccn3)n1)CC2 ZINC000429567558 338084498 /nfs/dbraw/zinc/08/44/98/338084498.db2.gz NMQRXMVMJANTDO-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1csc(-c3ccccn3)n1)CC2 ZINC000429567558 338084499 /nfs/dbraw/zinc/08/44/99/338084499.db2.gz NMQRXMVMJANTDO-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1ncc(-c3cccs3)o1)CC2 ZINC000429578050 338084871 /nfs/dbraw/zinc/08/48/71/338084871.db2.gz HYNQUBXODZKITH-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1ncc(-c3cccs3)o1)CC2 ZINC000429578050 338084872 /nfs/dbraw/zinc/08/48/72/338084872.db2.gz HYNQUBXODZKITH-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO C[N@H+](CCOc1cccc(Cl)c1)Cc1cc(C(C)(C)C)on1 ZINC000429720472 338088268 /nfs/dbraw/zinc/08/82/68/338088268.db2.gz QEVARRITIBYPGP-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO C[N@@H+](CCOc1cccc(Cl)c1)Cc1cc(C(C)(C)C)on1 ZINC000429720472 338088269 /nfs/dbraw/zinc/08/82/69/338088269.db2.gz QEVARRITIBYPGP-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO N#CN(Cc1c[nH+]cn1Cc1ccccc1)c1ccccc1Cl ZINC000429796657 338090106 /nfs/dbraw/zinc/09/01/06/338090106.db2.gz XMFKECWKWYTQPW-UHFFFAOYSA-N 1 2 322.799 4.072 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2cccc(Cl)c2)c(F)c1F ZINC000430034187 338093985 /nfs/dbraw/zinc/09/39/85/338093985.db2.gz IUSSOYXSVRBVBI-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO CC1(C)C[N@H+](C/C=C/c2ccc(F)cc2F)[C@H]1c1cccnc1 ZINC000430095568 338096270 /nfs/dbraw/zinc/09/62/70/338096270.db2.gz PUKCHTXEDQYOBO-JXTAAOLFSA-N 1 2 314.379 4.456 20 0 DIADLO CC1(C)C[N@@H+](C/C=C/c2ccc(F)cc2F)[C@H]1c1cccnc1 ZINC000430095568 338096271 /nfs/dbraw/zinc/09/62/71/338096271.db2.gz PUKCHTXEDQYOBO-JXTAAOLFSA-N 1 2 314.379 4.456 20 0 DIADLO C[C@@H]1C[C@H](Nc2cccc(C[N@H+](C)Cc3cscn3)c2)[C@H]1C ZINC000430228511 338102224 /nfs/dbraw/zinc/10/22/24/338102224.db2.gz QVOWFBHDQSNFIG-GLJUWKHASA-N 1 2 315.486 4.232 20 0 DIADLO C[C@@H]1C[C@H](Nc2cccc(C[N@@H+](C)Cc3cscn3)c2)[C@H]1C ZINC000430228511 338102225 /nfs/dbraw/zinc/10/22/25/338102225.db2.gz QVOWFBHDQSNFIG-GLJUWKHASA-N 1 2 315.486 4.232 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1cc(F)cc(F)c1 ZINC000430739593 338112884 /nfs/dbraw/zinc/11/28/84/338112884.db2.gz IDTCCYDPORNCDR-ZETCQYMHSA-N 1 2 319.248 4.372 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1cc(F)cc(F)c1 ZINC000430739592 338112945 /nfs/dbraw/zinc/11/29/45/338112945.db2.gz IDTCCYDPORNCDR-SSDOTTSWSA-N 1 2 319.248 4.372 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1cc(F)c(F)cc1F ZINC000430861160 338117359 /nfs/dbraw/zinc/11/73/59/338117359.db2.gz ANHKZVGOFVUQPQ-MRXNPFEDSA-N 1 2 323.362 4.048 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1cc(C)ccc1F ZINC000430872984 338117654 /nfs/dbraw/zinc/11/76/54/338117654.db2.gz NZKODHLZAJLNMK-KRWDZBQOSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1cc(C)ccc1F ZINC000430872984 338117655 /nfs/dbraw/zinc/11/76/55/338117655.db2.gz NZKODHLZAJLNMK-KRWDZBQOSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1cnc(C(C)C)s1 ZINC000430879701 338117979 /nfs/dbraw/zinc/11/79/79/338117979.db2.gz UVPCEVLMYICUST-HNNXBMFYSA-N 1 2 318.490 4.210 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1cnc(C(C)C)s1 ZINC000430879701 338117980 /nfs/dbraw/zinc/11/79/80/338117980.db2.gz UVPCEVLMYICUST-HNNXBMFYSA-N 1 2 318.490 4.210 20 0 DIADLO CCOc1cccc(C[N@@H+]2CCCC[C@@H]2c2nccn2CC)c1 ZINC000430881229 338118013 /nfs/dbraw/zinc/11/80/13/338118013.db2.gz ZHZOJDNJLHTMKO-GOSISDBHSA-N 1 2 313.445 4.029 20 0 DIADLO CCOc1cccc(C[N@H+]2CCCC[C@@H]2c2nccn2CC)c1 ZINC000430881229 338118014 /nfs/dbraw/zinc/11/80/14/338118014.db2.gz ZHZOJDNJLHTMKO-GOSISDBHSA-N 1 2 313.445 4.029 20 0 DIADLO Cn1c2cc(F)ccc2[nH+]c1N1CCC(c2ccsc2)CC1 ZINC000431423292 338130354 /nfs/dbraw/zinc/13/03/54/338130354.db2.gz RUGYZVQXUSVWTI-UHFFFAOYSA-N 1 2 315.417 4.158 20 0 DIADLO Fc1ccc([C@H]2CCCC[N@@H+]2CCOCC(F)(F)F)c(F)c1 ZINC000432010943 338143663 /nfs/dbraw/zinc/14/36/63/338143663.db2.gz DGHBTWHUVPMWNZ-CQSZACIVSA-N 1 2 323.305 4.071 20 0 DIADLO Fc1ccc([C@H]2CCCC[N@H+]2CCOCC(F)(F)F)c(F)c1 ZINC000432010943 338143664 /nfs/dbraw/zinc/14/36/64/338143664.db2.gz DGHBTWHUVPMWNZ-CQSZACIVSA-N 1 2 323.305 4.071 20 0 DIADLO CC(C)n1cc[nH+]c1CN1CCCC[C@H]1c1ccc(F)cc1F ZINC000432019840 338143691 /nfs/dbraw/zinc/14/36/91/338143691.db2.gz MZYRCPLSPMCWSG-KRWDZBQOSA-N 1 2 319.399 4.469 20 0 DIADLO Cc1cc(N(Cc2cccnc2)C2CC2)c2cccc(F)c2[nH+]1 ZINC000432144574 338147040 /nfs/dbraw/zinc/14/70/40/338147040.db2.gz ZKRLKPNAZPXEDV-UHFFFAOYSA-N 1 2 307.372 4.246 20 0 DIADLO CCc1nc(C[NH2+]Cc2csc(Cl)c2Cl)cs1 ZINC000432240150 338149986 /nfs/dbraw/zinc/14/99/86/338149986.db2.gz CCVVRYLBNYWACT-UHFFFAOYSA-N 1 2 307.271 4.364 20 0 DIADLO CC(C)n1cc[nH+]c1CSCc1ncccc1C(F)(F)F ZINC000432245944 338150440 /nfs/dbraw/zinc/15/04/40/338150440.db2.gz LPJZNWHVEVXAPL-UHFFFAOYSA-N 1 2 315.364 4.311 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(F)c(Cl)c2Cl)s1 ZINC000432260896 338151773 /nfs/dbraw/zinc/15/17/73/338151773.db2.gz ZHWMLXQHFSBNOY-ZCFIWIBFSA-N 1 2 320.220 4.143 20 0 DIADLO COCC[N@H+](Cc1ccco1)Cc1ccc(C(F)(F)F)s1 ZINC000432741740 338165515 /nfs/dbraw/zinc/16/55/15/338165515.db2.gz JIWBVFUZZLWUAD-UHFFFAOYSA-N 1 2 319.348 4.009 20 0 DIADLO COCC[N@@H+](Cc1ccco1)Cc1ccc(C(F)(F)F)s1 ZINC000432741740 338165516 /nfs/dbraw/zinc/16/55/16/338165516.db2.gz JIWBVFUZZLWUAD-UHFFFAOYSA-N 1 2 319.348 4.009 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)s1 ZINC000432753248 338166560 /nfs/dbraw/zinc/16/65/60/338166560.db2.gz TWJOGKBWPKJFAU-LBPRGKRZSA-N 1 2 300.349 4.432 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)s1 ZINC000432753248 338166561 /nfs/dbraw/zinc/16/65/61/338166561.db2.gz TWJOGKBWPKJFAU-LBPRGKRZSA-N 1 2 300.349 4.432 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1nnc(C(C)(C)C)[nH]1 ZINC000432795668 338168224 /nfs/dbraw/zinc/16/82/24/338168224.db2.gz XMCWOSOOIIIQHA-LBPRGKRZSA-N 1 2 312.417 4.008 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+](Cc2ccc(F)cc2)C(C)(C)C)[nH]1 ZINC000432830378 338169802 /nfs/dbraw/zinc/16/98/02/338169802.db2.gz FPYYBXOWKPTUFU-UHFFFAOYSA-N 1 2 318.440 4.042 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+](Cc2ccc(F)cc2)C(C)(C)C)[nH]1 ZINC000432830378 338169803 /nfs/dbraw/zinc/16/98/03/338169803.db2.gz FPYYBXOWKPTUFU-UHFFFAOYSA-N 1 2 318.440 4.042 20 0 DIADLO Cc1cc(N2CCC(F)(c3ccccc3)CC2)nc(C2CC2)[nH+]1 ZINC000432832833 338170038 /nfs/dbraw/zinc/17/00/38/338170038.db2.gz SBAPETBVOGETIW-UHFFFAOYSA-N 1 2 311.404 4.128 20 0 DIADLO CCOc1ccccc1OCC[NH2+][C@H](c1ccccc1)C(F)F ZINC000433040174 338177802 /nfs/dbraw/zinc/17/78/02/338177802.db2.gz PFAGVVAZNBSYII-QGZVFWFLSA-N 1 2 321.367 4.060 20 0 DIADLO FC(F)[C@@H](NCc1cn2cc(Cl)ccc2[nH+]1)c1ccccc1 ZINC000433079639 338180578 /nfs/dbraw/zinc/18/05/78/338180578.db2.gz XJPKJOCZLMFNDS-HNNXBMFYSA-N 1 2 321.758 4.084 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1ccc(F)cn1 ZINC000433107178 338182053 /nfs/dbraw/zinc/18/20/53/338182053.db2.gz XVSLAQVETXDWBN-QMMMGPOBSA-N 1 2 300.711 4.003 20 0 DIADLO CC(C)N(C)c1ccc(CNc2ccc(Cl)c(F)c2)c[nH+]1 ZINC000433340195 338193210 /nfs/dbraw/zinc/19/32/10/338193210.db2.gz CXFFQIUVYMCLPB-UHFFFAOYSA-N 1 2 307.800 4.331 20 0 DIADLO Cc1cc(N2CCc3cc(Cl)cc(Cl)c3[C@@H]2C)nc[nH+]1 ZINC000433620905 338198408 /nfs/dbraw/zinc/19/84/08/338198408.db2.gz CMNKVHIWRGRAOH-JTQLQIEISA-N 1 2 308.212 4.216 20 0 DIADLO CCC(CC)n1ccc(CSCc2cn3ccccc3[nH+]2)n1 ZINC000433639903 338199024 /nfs/dbraw/zinc/19/90/24/338199024.db2.gz OWIXHDZYVNXMBO-UHFFFAOYSA-N 1 2 314.458 4.325 20 0 DIADLO CC[C@H](Nc1[nH+]c(C)nc2[nH]ccc21)c1cc(F)ccc1F ZINC000433766374 338201147 /nfs/dbraw/zinc/20/11/47/338201147.db2.gz MTQLYFQFKQTOLD-AWEZNQCLSA-N 1 2 302.328 4.108 20 0 DIADLO Cc1nc2[nH]ccc2c(N2CCC[C@@H]2c2ccc(Cl)cc2)[nH+]1 ZINC000433785530 338201885 /nfs/dbraw/zinc/20/18/85/338201885.db2.gz RODIRKNAWWPXHX-OAHLLOKOSA-N 1 2 312.804 4.261 20 0 DIADLO Cc1cc(N2CC[C@@H](CC(F)(F)F)C2)c2cccc(F)c2[nH+]1 ZINC000433809455 338202613 /nfs/dbraw/zinc/20/26/13/338202613.db2.gz VAODRRAHFSFEDM-NSHDSACASA-N 1 2 312.310 4.461 20 0 DIADLO CC(C)Cc1csc(Cc2[nH+]ccn2Cc2ccccc2)n1 ZINC000434231257 338212787 /nfs/dbraw/zinc/21/27/87/338212787.db2.gz MFYZCHWDAGMQMG-UHFFFAOYSA-N 1 2 311.454 4.177 20 0 DIADLO Clc1cccc(CC[N@@H+]2CCc3ncsc3C2)c1Cl ZINC000434507197 338218881 /nfs/dbraw/zinc/21/88/81/338218881.db2.gz YMZZKSYTFGSZHY-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO Clc1cccc(CC[N@H+]2CCc3ncsc3C2)c1Cl ZINC000434507197 338218882 /nfs/dbraw/zinc/21/88/82/338218882.db2.gz YMZZKSYTFGSZHY-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO CC[N@H+](Cc1ncnn1C(C)C)Cc1ccc2ccccc2c1 ZINC000434535822 338219669 /nfs/dbraw/zinc/21/96/69/338219669.db2.gz QFIISKKHYJHBTK-UHFFFAOYSA-N 1 2 308.429 4.034 20 0 DIADLO CC[N@@H+](Cc1ncnn1C(C)C)Cc1ccc2ccccc2c1 ZINC000434535822 338219670 /nfs/dbraw/zinc/21/96/70/338219670.db2.gz QFIISKKHYJHBTK-UHFFFAOYSA-N 1 2 308.429 4.034 20 0 DIADLO CC(C)[C@H](c1ccc(F)cc1)[N@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000434621535 338221516 /nfs/dbraw/zinc/22/15/16/338221516.db2.gz UKGFZMHDWIURTC-MRXNPFEDSA-N 1 2 319.424 4.335 20 0 DIADLO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000434621535 338221517 /nfs/dbraw/zinc/22/15/17/338221517.db2.gz UKGFZMHDWIURTC-MRXNPFEDSA-N 1 2 319.424 4.335 20 0 DIADLO Cc1ccc(OC(F)F)c([C@H](C)[NH2+][C@@H](C)c2nccs2)c1 ZINC000153335047 338222610 /nfs/dbraw/zinc/22/26/10/338222610.db2.gz YTHAHGPILDRBOP-QWRGUYRKSA-N 1 2 312.385 4.465 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1OC(F)F)c1nccs1 ZINC000153416623 338224123 /nfs/dbraw/zinc/22/41/23/338224123.db2.gz QRIZUFNSSYZVOK-IUCAKERBSA-N 1 2 316.348 4.295 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@](C)(CCc3ccccc3)C2)no1 ZINC000434904523 338227749 /nfs/dbraw/zinc/22/77/49/338227749.db2.gz FUTBCAUBZOVVEH-IBGZPJMESA-N 1 2 313.445 4.038 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@](C)(CCc3ccccc3)C2)no1 ZINC000434904523 338227750 /nfs/dbraw/zinc/22/77/50/338227750.db2.gz FUTBCAUBZOVVEH-IBGZPJMESA-N 1 2 313.445 4.038 20 0 DIADLO CCCOc1ccc2c(c1)CCN(c1cc(C)[nH+]c(C3CC3)n1)C2 ZINC000434943076 338228017 /nfs/dbraw/zinc/22/80/17/338228017.db2.gz NILCMXUOCPVXSR-UHFFFAOYSA-N 1 2 323.440 4.014 20 0 DIADLO COc1cccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1OC(F)F ZINC000434981528 338228516 /nfs/dbraw/zinc/22/85/16/338228516.db2.gz KXGWXIZWRFYEFQ-OAHLLOKOSA-N 1 2 319.351 4.244 20 0 DIADLO COc1cccc(C[N@H+]2CC[C@@H]2c2ccccc2)c1OC(F)F ZINC000434981528 338228517 /nfs/dbraw/zinc/22/85/17/338228517.db2.gz KXGWXIZWRFYEFQ-OAHLLOKOSA-N 1 2 319.351 4.244 20 0 DIADLO C[N@H+](Cc1ccc(-c2cc[nH]n2)o1)Cc1cc(Cl)ccc1F ZINC000434985076 338228859 /nfs/dbraw/zinc/22/88/59/338228859.db2.gz FTKCKAOVZMRZIW-UHFFFAOYSA-N 1 2 319.767 4.094 20 0 DIADLO C[N@@H+](Cc1ccc(-c2cc[nH]n2)o1)Cc1cc(Cl)ccc1F ZINC000434985076 338228860 /nfs/dbraw/zinc/22/88/60/338228860.db2.gz FTKCKAOVZMRZIW-UHFFFAOYSA-N 1 2 319.767 4.094 20 0 DIADLO Cc1ccc2c(nccc2N2CCC(c3ccc(C)[nH+]c3)CC2)n1 ZINC000435573368 338242444 /nfs/dbraw/zinc/24/24/44/338242444.db2.gz HHAUTDFEUDRYBV-UHFFFAOYSA-N 1 2 318.424 4.026 20 0 DIADLO Cc1nc(N[C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)cc[nH+]1 ZINC000435598256 338243226 /nfs/dbraw/zinc/24/32/26/338243226.db2.gz NZBWGJIPRUNIPS-MQMHXKEQSA-N 1 2 307.319 4.162 20 0 DIADLO C[C@@H]1[C@@H](C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)[C@@H]1c1ccccc1 ZINC000435618230 338243633 /nfs/dbraw/zinc/24/36/33/338243633.db2.gz SBKXRQXMGJOJDC-DOPJRALCSA-N 1 2 317.392 4.065 20 0 DIADLO C[C@H]1[C@@H](c2ccccc2)[C@H]1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000435618232 338243668 /nfs/dbraw/zinc/24/36/68/338243668.db2.gz SBKXRQXMGJOJDC-KKXDTOCCSA-N 1 2 317.392 4.065 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+]Cc2nc(Cc3ccccc3)no2)cc1 ZINC000154929536 338253253 /nfs/dbraw/zinc/25/32/53/338253253.db2.gz NJCUCHAHMXQKMJ-OAHLLOKOSA-N 1 2 321.424 4.074 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)[C@H](C)CCC(C)(C)C ZINC000435996574 338255404 /nfs/dbraw/zinc/25/54/04/338255404.db2.gz UJBZNKPLAXZJGK-CVEARBPZSA-N 1 2 319.493 4.419 20 0 DIADLO CCC[C@@H](NC(=O)[C@@H](C)[NH+]1Cc2ccccc2C1)c1ccccc1 ZINC000436133988 338259147 /nfs/dbraw/zinc/25/91/47/338259147.db2.gz UFSKZADLHWTNIF-OXQOHEQNSA-N 1 2 322.452 4.048 20 0 DIADLO CCC[C@H](C)C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436152033 338259767 /nfs/dbraw/zinc/25/97/67/338259767.db2.gz FXGVQYFMYWGDIL-AWEZNQCLSA-N 1 2 311.429 4.261 20 0 DIADLO O=C(C[C@H]1C=CCC1)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436178204 338260805 /nfs/dbraw/zinc/26/08/05/338260805.db2.gz SIIGEPQULFCEDX-HNNXBMFYSA-N 1 2 321.424 4.181 20 0 DIADLO CC1(C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)CCC1 ZINC000436201364 338261810 /nfs/dbraw/zinc/26/18/10/338261810.db2.gz UMIZIQISVAGKBT-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO COc1ccc(CNc2cc[nH+]c3c(OC)cccc23)c(F)c1 ZINC000436427484 338272170 /nfs/dbraw/zinc/27/21/70/338272170.db2.gz BBNAPGJNUUERSD-UHFFFAOYSA-N 1 2 312.344 4.003 20 0 DIADLO COc1cccc2c(N[C@H]3CCO[C@H](CC(C)C)C3)cc[nH+]c12 ZINC000436463453 338272974 /nfs/dbraw/zinc/27/29/74/338272974.db2.gz YPMFODFPKSYNSV-LSDHHAIUSA-N 1 2 314.429 4.249 20 0 DIADLO Cc1cc(C)c(NC(=O)N2[C@H](C)C[C@H]3CCCC[C@@H]32)c(C)[nH+]1 ZINC000436486974 338273956 /nfs/dbraw/zinc/27/39/56/338273956.db2.gz CKJPQQKHDBEWGP-BMFZPTHFSA-N 1 2 301.434 4.192 20 0 DIADLO CC[C@@H](c1ccncc1)N(C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000436492017 338274157 /nfs/dbraw/zinc/27/41/57/338274157.db2.gz JFTRSMOEFHLLHP-INIZCTEOSA-N 1 2 312.417 4.017 20 0 DIADLO CCCN(Cc1ccccc1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000436500325 338274501 /nfs/dbraw/zinc/27/45/01/338274501.db2.gz ZNLPNWRKJLWIOS-UHFFFAOYSA-N 1 2 311.429 4.451 20 0 DIADLO CC(C)c1cccc(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)c1 ZINC000437008330 338297469 /nfs/dbraw/zinc/29/74/69/338297469.db2.gz PWCYNXHWAKTDHS-IBGZPJMESA-N 1 2 305.425 4.412 20 0 DIADLO Fc1ccc(CSCc2[nH+]ccn2CC(F)(F)F)cc1 ZINC000437278004 338305785 /nfs/dbraw/zinc/30/57/85/338305785.db2.gz RWTBPANXCFZFGT-UHFFFAOYSA-N 1 2 304.312 4.018 20 0 DIADLO Fc1ccc(OCc2c[nH+]cn2Cc2ccccc2)c(Cl)c1 ZINC000437624843 338316401 /nfs/dbraw/zinc/31/64/01/338316401.db2.gz YZHYYTVKEYTNIZ-UHFFFAOYSA-N 1 2 316.763 4.303 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC[C@@H]2c2cccn2C)cs1 ZINC000437645223 338317106 /nfs/dbraw/zinc/31/71/06/338317106.db2.gz IURYQKMXNHRGAB-QGZVFWFLSA-N 1 2 317.502 4.407 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC[C@@H]2c2cccn2C)cs1 ZINC000437645223 338317107 /nfs/dbraw/zinc/31/71/07/338317107.db2.gz IURYQKMXNHRGAB-QGZVFWFLSA-N 1 2 317.502 4.407 20 0 DIADLO Fc1cc(Cl)ccc1C[N@@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000437686952 338318291 /nfs/dbraw/zinc/31/82/91/338318291.db2.gz JGNTULSITQPVKH-INIZCTEOSA-N 1 2 323.795 4.253 20 0 DIADLO Fc1cc(Cl)ccc1C[N@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000437686952 338318292 /nfs/dbraw/zinc/31/82/92/338318292.db2.gz JGNTULSITQPVKH-INIZCTEOSA-N 1 2 323.795 4.253 20 0 DIADLO Clc1ccc2[nH]c([C@H]3CCC[N@@H+]3Cc3ccco3)nc2c1 ZINC000438261039 338338095 /nfs/dbraw/zinc/33/80/95/338338095.db2.gz PUQLIGVOJOPVFU-OAHLLOKOSA-N 1 2 301.777 4.146 20 0 DIADLO Clc1ccc2[nH]c([C@H]3CCC[N@H+]3Cc3ccco3)nc2c1 ZINC000438261039 338338096 /nfs/dbraw/zinc/33/80/96/338338096.db2.gz PUQLIGVOJOPVFU-OAHLLOKOSA-N 1 2 301.777 4.146 20 0 DIADLO CO[C@@H](C)c1cccc(NCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000438298826 338339028 /nfs/dbraw/zinc/33/90/28/338339028.db2.gz KPUNFTCFYXWQFN-INIZCTEOSA-N 1 2 321.424 4.251 20 0 DIADLO CCCOc1cccc(NCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000438306260 338339089 /nfs/dbraw/zinc/33/90/89/338339089.db2.gz NMKUWWMLRMUZAJ-UHFFFAOYSA-N 1 2 321.424 4.332 20 0 DIADLO Fc1cc(OCc2c[nH+]cn2Cc2ccccc2)ccc1Cl ZINC000438315361 338339361 /nfs/dbraw/zinc/33/93/61/338339361.db2.gz BQWSEMSUGUFMES-UHFFFAOYSA-N 1 2 316.763 4.303 20 0 DIADLO Fc1cc(Cl)ccc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438323002 338339552 /nfs/dbraw/zinc/33/95/52/338339552.db2.gz VVJRCPQCRYMGQZ-UHFFFAOYSA-N 1 2 315.779 4.336 20 0 DIADLO c1nc2c(s1)C[N@H+](Cc1ccccc1OC1CCCC1)CC2 ZINC000438352221 338340918 /nfs/dbraw/zinc/34/09/18/338340918.db2.gz GUJUZDICLQJULI-UHFFFAOYSA-N 1 2 314.454 4.023 20 0 DIADLO c1nc2c(s1)C[N@@H+](Cc1ccccc1OC1CCCC1)CC2 ZINC000438352221 338340919 /nfs/dbraw/zinc/34/09/19/338340919.db2.gz GUJUZDICLQJULI-UHFFFAOYSA-N 1 2 314.454 4.023 20 0 DIADLO CC(C)C(C)(C)CNC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000438393308 338342601 /nfs/dbraw/zinc/34/26/01/338342601.db2.gz ODXGRVXUCHPRLY-UHFFFAOYSA-N 1 2 312.413 4.286 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H](c3cccc(Cl)c3)OC[C@@H]2C)nc1 ZINC000438546717 338347598 /nfs/dbraw/zinc/34/75/98/338347598.db2.gz MWZXIZWLGGYTBA-KSSFIOAISA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H](c3cccc(Cl)c3)OC[C@@H]2C)nc1 ZINC000438546717 338347599 /nfs/dbraw/zinc/34/75/99/338347599.db2.gz MWZXIZWLGGYTBA-KSSFIOAISA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H](c3cccc(Cl)c3)OC[C@H]2C)nc1 ZINC000438546716 338347605 /nfs/dbraw/zinc/34/76/05/338347605.db2.gz MWZXIZWLGGYTBA-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H](c3cccc(Cl)c3)OC[C@H]2C)nc1 ZINC000438546716 338347606 /nfs/dbraw/zinc/34/76/06/338347606.db2.gz MWZXIZWLGGYTBA-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc(NC(=O)C2(Cc3ccccc3Cl)CC2)c(C)[nH+]1 ZINC000439147884 338362621 /nfs/dbraw/zinc/36/26/21/338362621.db2.gz PJUYVUFYGGXRKB-UHFFFAOYSA-N 1 2 314.816 4.313 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)n1 ZINC000439331047 338367523 /nfs/dbraw/zinc/36/75/23/338367523.db2.gz RCFCGRIZOCBXAX-GFCCVEGCSA-N 1 2 303.372 4.019 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)n1 ZINC000439331047 338367524 /nfs/dbraw/zinc/36/75/24/338367524.db2.gz RCFCGRIZOCBXAX-GFCCVEGCSA-N 1 2 303.372 4.019 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)n1 ZINC000439331048 338367568 /nfs/dbraw/zinc/36/75/68/338367568.db2.gz RCFCGRIZOCBXAX-LBPRGKRZSA-N 1 2 303.372 4.019 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)n1 ZINC000439331048 338367569 /nfs/dbraw/zinc/36/75/69/338367569.db2.gz RCFCGRIZOCBXAX-LBPRGKRZSA-N 1 2 303.372 4.019 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@@H](c3ccccc3)C[C@H]2C)no1 ZINC000439334136 338367602 /nfs/dbraw/zinc/36/76/02/338367602.db2.gz XCIWTGJMQKIZCS-NVXWUHKLSA-N 1 2 313.445 4.180 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@@H](c3ccccc3)C[C@H]2C)no1 ZINC000439334136 338367603 /nfs/dbraw/zinc/36/76/03/338367603.db2.gz XCIWTGJMQKIZCS-NVXWUHKLSA-N 1 2 313.445 4.180 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@@H](c3ccccc3)C[C@@H]2C)no1 ZINC000439334135 338367675 /nfs/dbraw/zinc/36/76/75/338367675.db2.gz XCIWTGJMQKIZCS-DOTOQJQBSA-N 1 2 313.445 4.180 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@@H](c3ccccc3)C[C@@H]2C)no1 ZINC000439334135 338367676 /nfs/dbraw/zinc/36/76/76/338367676.db2.gz XCIWTGJMQKIZCS-DOTOQJQBSA-N 1 2 313.445 4.180 20 0 DIADLO CCCc1nc(CSCc2cn3cccc(C)c3[nH+]2)cs1 ZINC000439553819 338372908 /nfs/dbraw/zinc/37/29/08/338372908.db2.gz ZMOLCYURRLAUDF-UHFFFAOYSA-N 1 2 317.483 4.485 20 0 DIADLO CCC[C@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1)C(=O)OCC ZINC000439558001 338373094 /nfs/dbraw/zinc/37/30/94/338373094.db2.gz QIKKJMXXBVPJCH-RISCZKNCSA-N 1 2 317.351 4.088 20 0 DIADLO CCC[C@@H]([NH2+][C@@H](C)c1ccc(SCC)cc1)C(=O)OCC ZINC000439595721 338373967 /nfs/dbraw/zinc/37/39/67/338373967.db2.gz YFJYIYPHYHTOEV-XJKSGUPXSA-N 1 2 309.475 4.181 20 0 DIADLO C[C@@H](C(=O)Nc1cccc2[nH+]ccn21)c1ccc2ccccc2c1 ZINC000439736911 338376876 /nfs/dbraw/zinc/37/68/76/338376876.db2.gz SIVKNYJZZKGQKB-CQSZACIVSA-N 1 2 315.376 4.230 20 0 DIADLO FC(F)(F)CCc1ccc(Nc2[nH+]cnc3[nH]ccc32)cc1 ZINC000440185943 338384097 /nfs/dbraw/zinc/38/40/97/338384097.db2.gz ALZJJILFLNNKFM-UHFFFAOYSA-N 1 2 306.291 4.196 20 0 DIADLO CCC(CC)n1ccc(C[NH2+]C2(c3ccc(F)cc3)CC2)n1 ZINC000440295793 338385130 /nfs/dbraw/zinc/38/51/30/338385130.db2.gz RNRYTSAGUKHENN-UHFFFAOYSA-N 1 2 301.409 4.162 20 0 DIADLO CC(C)c1ncc(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)cn1 ZINC000440480709 338388282 /nfs/dbraw/zinc/38/82/82/338388282.db2.gz WZHMXFMSSJBXAP-GFCCVEGCSA-N 1 2 305.372 4.071 20 0 DIADLO CC(C)c1ncc(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)cn1 ZINC000440480709 338388283 /nfs/dbraw/zinc/38/82/83/338388283.db2.gz WZHMXFMSSJBXAP-GFCCVEGCSA-N 1 2 305.372 4.071 20 0 DIADLO CC[C@H](F)C[NH2+][C@@H](c1nc2ccccc2n1C)c1ccccc1 ZINC000440518435 338388960 /nfs/dbraw/zinc/38/89/60/338388960.db2.gz KDNKFKVUMSGNFV-MAUKXSAKSA-N 1 2 311.404 4.000 20 0 DIADLO Cc1ccc(/C=C\CC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000440524885 338389241 /nfs/dbraw/zinc/38/92/41/338389241.db2.gz LDIXTIGDMAWJRW-IHWYPQMZSA-N 1 2 317.392 4.223 20 0 DIADLO Cc1ccc(/C=C\CC(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)cc1 ZINC000440562654 338390359 /nfs/dbraw/zinc/39/03/59/338390359.db2.gz DAIFWSMGDSVWJS-RQOWECAXSA-N 1 2 317.392 4.427 20 0 DIADLO Cc1ccc(/C=C/CC(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)cc1 ZINC000440562653 338390369 /nfs/dbraw/zinc/39/03/69/338390369.db2.gz DAIFWSMGDSVWJS-DUXPYHPUSA-N 1 2 317.392 4.427 20 0 DIADLO COc1cccc2c(N[C@H]3CCOc4c(F)cccc43)cc[nH+]c12 ZINC000440638369 338393695 /nfs/dbraw/zinc/39/36/95/338393695.db2.gz QCRZUAPADFHRSM-INIZCTEOSA-N 1 2 324.355 4.318 20 0 DIADLO Cc1cc(N(C)Cc2cnc(C(C)C)nc2)c2cccc(F)c2[nH+]1 ZINC000440663040 338394686 /nfs/dbraw/zinc/39/46/86/338394686.db2.gz MPEULGVXGAFXDP-UHFFFAOYSA-N 1 2 324.403 4.232 20 0 DIADLO CO[C@H]1CCN(c2cc(C(C)(C)C)[nH+]c(C(C)(C)C)n2)[C@@H](C)C1 ZINC000440669268 338394879 /nfs/dbraw/zinc/39/48/79/338394879.db2.gz DUZAPGDAXOAULB-KBPBESRZSA-N 1 2 319.493 4.075 20 0 DIADLO COc1ccc([C@@H](C)Nc2cc[nH+]c3c(OC)cccc23)cc1 ZINC000440674416 338395006 /nfs/dbraw/zinc/39/50/06/338395006.db2.gz RDXVQWYGBZWSNU-CYBMUJFWSA-N 1 2 308.381 4.425 20 0 DIADLO CC[C@H](F)C[N@@H+]1CCCC[C@@H]1c1nc(-c2ccccc2)no1 ZINC000440690723 338395272 /nfs/dbraw/zinc/39/52/72/338395272.db2.gz DEPSYOPTIUYVDQ-LSDHHAIUSA-N 1 2 303.381 4.012 20 0 DIADLO CC[C@H](F)C[N@H+]1CCCC[C@@H]1c1nc(-c2ccccc2)no1 ZINC000440690723 338395273 /nfs/dbraw/zinc/39/52/73/338395273.db2.gz DEPSYOPTIUYVDQ-LSDHHAIUSA-N 1 2 303.381 4.012 20 0 DIADLO CC[C@H](F)C[N@H+](CC)CC(=O)Nc1c(Cl)cccc1Cl ZINC000440700997 338395494 /nfs/dbraw/zinc/39/54/94/338395494.db2.gz IEFWDESSUWKCMP-JTQLQIEISA-N 1 2 321.223 4.002 20 0 DIADLO CC[C@H](F)C[N@@H+](CC)CC(=O)Nc1c(Cl)cccc1Cl ZINC000440700997 338395495 /nfs/dbraw/zinc/39/54/95/338395495.db2.gz IEFWDESSUWKCMP-JTQLQIEISA-N 1 2 321.223 4.002 20 0 DIADLO CC(C)CC1(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CC1 ZINC000440728859 338396150 /nfs/dbraw/zinc/39/61/50/338396150.db2.gz NFCLFQNCFVEVKR-UHFFFAOYSA-N 1 2 317.820 4.291 20 0 DIADLO CCCCC(=O)N(Cc1[nH]cc[nH+]1)c1cc(C)ccc1Cl ZINC000440885279 338399258 /nfs/dbraw/zinc/39/92/58/338399258.db2.gz IRTFLOOZIIVPRF-UHFFFAOYSA-N 1 2 305.809 4.095 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+]([C@H](C)c2ccco2)C2CC2)cc1C ZINC000440899035 338399456 /nfs/dbraw/zinc/39/94/56/338399456.db2.gz FXVWSQGFJLTSCC-OAHLLOKOSA-N 1 2 312.413 4.061 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+]([C@H](C)c2ccco2)C2CC2)cc1C ZINC000440899035 338399457 /nfs/dbraw/zinc/39/94/57/338399457.db2.gz FXVWSQGFJLTSCC-OAHLLOKOSA-N 1 2 312.413 4.061 20 0 DIADLO C[C@H](c1ccco1)[N@H+](CC(=O)Nc1cccc(Cl)c1)C1CC1 ZINC000440902110 338399580 /nfs/dbraw/zinc/39/95/80/338399580.db2.gz HTLJZIBHQXOUTQ-GFCCVEGCSA-N 1 2 318.804 4.097 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](CC(=O)Nc1cccc(Cl)c1)C1CC1 ZINC000440902110 338399581 /nfs/dbraw/zinc/39/95/81/338399581.db2.gz HTLJZIBHQXOUTQ-GFCCVEGCSA-N 1 2 318.804 4.097 20 0 DIADLO CCn1c(C)cc(C(=O)C[N@H+]([C@@H](C)c2ccco2)C2CC2)c1C ZINC000440910152 338399852 /nfs/dbraw/zinc/39/98/52/338399852.db2.gz QBLRFWMBECSZJM-HNNXBMFYSA-N 1 2 314.429 4.126 20 0 DIADLO CCn1c(C)cc(C(=O)C[N@@H+]([C@@H](C)c2ccco2)C2CC2)c1C ZINC000440910152 338399853 /nfs/dbraw/zinc/39/98/53/338399853.db2.gz QBLRFWMBECSZJM-HNNXBMFYSA-N 1 2 314.429 4.126 20 0 DIADLO Cc1ccc(NC(=O)CC(C)(C)CC(=O)c2ccccc2)c(C)[nH+]1 ZINC000441620209 338417893 /nfs/dbraw/zinc/41/78/93/338417893.db2.gz LMTMYQZRDYNQGN-UHFFFAOYSA-N 1 2 324.424 4.326 20 0 DIADLO Cc1ccc(NC(=O)CO[C@@H]2C[C@@H](C)CC[C@@H]2C(C)C)c(C)[nH+]1 ZINC000446438163 338528100 /nfs/dbraw/zinc/52/81/00/338528100.db2.gz HDNAJCSNEWXLFI-FDQGKXFDSA-N 1 2 318.461 4.114 20 0 DIADLO Cc1nc(N2CC[C@@H](C)[C@H]2c2ccc(C(F)(F)F)cc2)cc[nH+]1 ZINC000446879842 338539270 /nfs/dbraw/zinc/53/92/70/338539270.db2.gz UPVJCXYMACVBNW-BZNIZROVSA-N 1 2 321.346 4.391 20 0 DIADLO CC(C)[C@H]1CN(Cc2[nH+]ccn2CC(F)(F)F)c2ccccc21 ZINC000447058417 338543798 /nfs/dbraw/zinc/54/37/98/338543798.db2.gz SYFOKNZRVUCMEB-CQSZACIVSA-N 1 2 323.362 4.205 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@@H](C(C)(C)C)CC2)c(C)[nH+]1 ZINC000447165099 338546690 /nfs/dbraw/zinc/54/66/90/338546690.db2.gz GKKJRJFWIMSNFX-OAHLLOKOSA-N 1 2 303.450 4.379 20 0 DIADLO Cc1ccc(NC(=O)N(CC2CCCCC2)C2CC2)c(C)[nH+]1 ZINC000447176510 338546892 /nfs/dbraw/zinc/54/68/92/338546892.db2.gz LBNCUDPVIAMSDL-UHFFFAOYSA-N 1 2 301.434 4.275 20 0 DIADLO Cc1ccc(NC(=O)N[C@H](C)C(C)(C)c2ccccc2)c(C)[nH+]1 ZINC000447183354 338547203 /nfs/dbraw/zinc/54/72/03/338547203.db2.gz SBEZPYAVYJPNQP-OAHLLOKOSA-N 1 2 311.429 4.186 20 0 DIADLO Clc1cc(C[NH+]2CCC(OCC3CC3)CC2)c(Cl)s1 ZINC000449032627 338585750 /nfs/dbraw/zinc/58/57/50/338585750.db2.gz XMVUCUKCGWBRRY-UHFFFAOYSA-N 1 2 320.285 4.446 20 0 DIADLO Cc1cccc(C[NH2+][C@H](COCC(C)C)c2ccco2)c1F ZINC000449106078 338593996 /nfs/dbraw/zinc/59/39/96/338593996.db2.gz GFLPJXMFXIAFIO-MRXNPFEDSA-N 1 2 305.393 4.231 20 0 DIADLO CCc1ncc(C[NH2+]Cc2ccc(-c3ccc(F)cc3C)o2)o1 ZINC000449607608 338640608 /nfs/dbraw/zinc/64/06/08/338640608.db2.gz BLWGKHCMMBIJPB-UHFFFAOYSA-N 1 2 314.360 4.234 20 0 DIADLO CCCc1ncc(C[NH2+]Cc2csc(-c3cccs3)n2)o1 ZINC000449612506 338640894 /nfs/dbraw/zinc/64/08/94/338640894.db2.gz MOKNEINMQNTJBA-UHFFFAOYSA-N 1 2 319.455 4.102 20 0 DIADLO CCCO[C@@H]1CCCN(c2[nH+]ccc3c(OC)cccc32)CC1 ZINC000450326667 338677632 /nfs/dbraw/zinc/67/76/32/338677632.db2.gz INWATAWNQCMHCG-OAHLLOKOSA-N 1 2 314.429 4.029 20 0 DIADLO CSc1cccc(C(=O)Nc2c[nH+]ccc2OC(C)(C)C)c1 ZINC000450327313 338677644 /nfs/dbraw/zinc/67/76/44/338677644.db2.gz LJBUZSXUSIYPOZ-UHFFFAOYSA-N 1 2 316.426 4.233 20 0 DIADLO COc1cccc2c1cc[nH+]c2N[C@H](CCCO)c1ccccc1 ZINC000450349714 338679273 /nfs/dbraw/zinc/67/92/73/338679273.db2.gz OYBKYQOFQSLANJ-GOSISDBHSA-N 1 2 322.408 4.169 20 0 DIADLO COc1cccc2c1cc[nH+]c2NC[C@@H](C)c1ncc(C)s1 ZINC000450436464 338684118 /nfs/dbraw/zinc/68/41/18/338684118.db2.gz GVRQDKGXKCCFNF-LLVKDONJSA-N 1 2 313.426 4.224 20 0 DIADLO CC(C)c1ccc([C@@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc1 ZINC000450496938 338687908 /nfs/dbraw/zinc/68/79/08/338687908.db2.gz AMNSEBOPVABEDB-GFCCVEGCSA-N 1 2 301.459 4.390 20 0 DIADLO Cc1cc(N2[C@H](C)[C@H](CC(F)(F)F)C[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000450573180 338691681 /nfs/dbraw/zinc/69/16/81/338691681.db2.gz WFQRTWFEJDZGSL-LOWVWBTDSA-N 1 2 313.367 4.218 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc1 ZINC000450669824 338697494 /nfs/dbraw/zinc/69/74/94/338697494.db2.gz RCERVCVFHWJEOG-GFCCVEGCSA-N 1 2 317.458 4.054 20 0 DIADLO CC(C)[C@@H]([NH2+][C@H](C)c1csnn1)c1ccc(Cl)cc1F ZINC000450709917 338700269 /nfs/dbraw/zinc/70/02/69/338700269.db2.gz BWZYBJJYJDGLDV-YMTOWFKASA-N 1 2 313.829 4.379 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccn(CCc3ccccc3)n2)c(C)o1 ZINC000450731563 338702254 /nfs/dbraw/zinc/70/22/54/338702254.db2.gz ZDJRPHIKMIFAEM-INIZCTEOSA-N 1 2 323.440 4.186 20 0 DIADLO Cc1cccc(Cl)c1C[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000450740787 338702586 /nfs/dbraw/zinc/70/25/86/338702586.db2.gz VIEZOIZFAFCHPL-NSHDSACASA-N 1 2 307.825 4.180 20 0 DIADLO C[C@H]1C[C@H](Nc2ncc(C(F)(F)F)cc2Cl)c2[nH+]ccn21 ZINC000450832155 338707575 /nfs/dbraw/zinc/70/75/75/338707575.db2.gz QRUQHWUULHGSHF-XVKPBYJWSA-N 1 2 316.714 4.068 20 0 DIADLO CCCc1ncc(CNc2[nH+]cccc2OCc2ccccc2)o1 ZINC000450848173 338708289 /nfs/dbraw/zinc/70/82/89/338708289.db2.gz REUWXBNWANGXAH-UHFFFAOYSA-N 1 2 323.396 4.213 20 0 DIADLO CCn1cc([C@H](C)Nc2cc[nH+]c3cc(F)c(Cl)cc23)cn1 ZINC000450869573 338709720 /nfs/dbraw/zinc/70/97/20/338709720.db2.gz BLTYSSSPEHYYLX-JTQLQIEISA-N 1 2 318.783 4.417 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@]2(c3ccc(Cl)cc3)C[C@@H]2C)s1 ZINC000450931937 338713002 /nfs/dbraw/zinc/71/30/02/338713002.db2.gz YYLQAJIZAZNZJG-MEDUHNTESA-N 1 2 321.877 4.340 20 0 DIADLO CC(=O)Nc1cccc(NCc2ccc(C(C)C)[nH+]c2C)c1C ZINC000453063757 338789222 /nfs/dbraw/zinc/78/92/22/338789222.db2.gz IBMMFAOQPQJLSN-UHFFFAOYSA-N 1 2 311.429 4.392 20 0 DIADLO CC[C@@H](Cc1nc(CCc2[nH+]cccc2C)no1)c1ccccc1 ZINC000453216315 338809115 /nfs/dbraw/zinc/80/91/15/338809115.db2.gz DIXRDZQNMDKTDJ-INIZCTEOSA-N 1 2 321.424 4.295 20 0 DIADLO Fc1cccc2c1CCC[C@@H]2[NH2+][C@H](c1ncc[nH]1)c1ccccc1 ZINC000453223885 338810284 /nfs/dbraw/zinc/81/02/84/338810284.db2.gz BQXIGJHPIKFJBQ-OALUTQOASA-N 1 2 321.399 4.305 20 0 DIADLO Cc1c([C@H](C)[NH2+][C@@H](C)C(C)(F)F)cnn1-c1ccc(F)cc1 ZINC000453274886 338817251 /nfs/dbraw/zinc/81/72/51/338817251.db2.gz BHZQFSQXHDERSH-JQWIXIFHSA-N 1 2 311.351 4.014 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2ncc(C(F)(F)F)cc21)C(C)(F)F ZINC000453293876 338819908 /nfs/dbraw/zinc/81/99/08/338819908.db2.gz PISVLGHVOGHTLK-PELKAZGASA-N 1 2 308.294 4.111 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C(F)(F)F)cn1)c1cccc(C2CC2)c1 ZINC000453301363 338821128 /nfs/dbraw/zinc/82/11/28/338821128.db2.gz BCQDHQKOUJKPST-LLVKDONJSA-N 1 2 321.346 4.224 20 0 DIADLO CC[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(Cl)s1 ZINC000453325693 338825241 /nfs/dbraw/zinc/82/52/41/338825241.db2.gz RPDPIQYPHRVTCJ-VIFPVBQESA-N 1 2 304.246 4.029 20 0 DIADLO CCc1ncc(C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cn2)o1 ZINC000453378634 338834671 /nfs/dbraw/zinc/83/46/71/338834671.db2.gz KMLKYLYRHXXKHH-CQSZACIVSA-N 1 2 323.396 4.275 20 0 DIADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+][C@H](C)c1nccn1CC ZINC000453379043 338834839 /nfs/dbraw/zinc/83/48/39/338834839.db2.gz ZYDAEGGFCKYSCN-CHWSQXEVSA-N 1 2 321.852 4.367 20 0 DIADLO c1[nH+]c2ccccn2c1CSc1nc(-c2ccccc2)co1 ZINC000195110791 338852264 /nfs/dbraw/zinc/85/22/64/338852264.db2.gz AAZCWBRJQWZZJC-UHFFFAOYSA-N 1 2 307.378 4.282 20 0 DIADLO Cc1ccc(NC(=O)N2[C@H](C)C[C@H](c3ccccc3)[C@@H]2C)c(C)[nH+]1 ZINC000455047040 338879546 /nfs/dbraw/zinc/87/95/46/338879546.db2.gz OVODRHHSKFBWPY-HFTRVMKXSA-N 1 2 323.440 4.497 20 0 DIADLO CCc1ccc(NC(=O)N[C@H](C)c2[nH+]ccn2CC)cc1Cl ZINC000455410478 338893303 /nfs/dbraw/zinc/89/33/03/338893303.db2.gz NGBIVWGDXHILED-LLVKDONJSA-N 1 2 320.824 4.002 20 0 DIADLO Cc1cc(C)c(CNC(=O)N2CCC[C@@H]2c2ccccc2C)c[nH+]1 ZINC000455552719 338898659 /nfs/dbraw/zinc/89/86/59/338898659.db2.gz GWNFPVKQFMOEEF-LJQANCHMSA-N 1 2 323.440 4.054 20 0 DIADLO CCC[C@H](CC1CCCCC1)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456360034 338927647 /nfs/dbraw/zinc/92/76/47/338927647.db2.gz CYKIXTDIHXTEKC-DJIMGWMZSA-N 1 2 317.477 4.392 20 0 DIADLO CCC[C@H](CC1CCCCC1)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456360037 338927681 /nfs/dbraw/zinc/92/76/81/338927681.db2.gz CYKIXTDIHXTEKC-USXIJHARSA-N 1 2 317.477 4.392 20 0 DIADLO CC(C)[C@H](CC1CCCCC1)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456377480 338928231 /nfs/dbraw/zinc/92/82/31/338928231.db2.gz KZGGUUAQVZXIIC-HYVNUMGLSA-N 1 2 317.477 4.248 20 0 DIADLO C[C@H](C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1)C1CCC1 ZINC000457461718 338964685 /nfs/dbraw/zinc/96/46/85/338964685.db2.gz SABPLQTYYDPWCD-AWEZNQCLSA-N 1 2 323.440 4.261 20 0 DIADLO C[C@H](CC(F)(F)F)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000457568555 338969653 /nfs/dbraw/zinc/96/96/53/338969653.db2.gz PPCYQVIWDNZEGU-LLVKDONJSA-N 1 2 324.302 4.401 20 0 DIADLO CC[C@@H](CC(F)F)C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000457785641 338978922 /nfs/dbraw/zinc/97/89/22/338978922.db2.gz OLTDZOIVZAGMQP-NSHDSACASA-N 1 2 307.344 4.005 20 0 DIADLO Cc1ccc(C(=O)N(C)C2CC(C)(C)C2)cc1Oc1cc[nH+]cc1 ZINC000458179003 338990788 /nfs/dbraw/zinc/99/07/88/338990788.db2.gz FWDHADYAAQRONI-UHFFFAOYSA-N 1 2 324.424 4.443 20 0 DIADLO CCCCCN(CCCCC)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000459097266 339013597 /nfs/dbraw/zinc/01/35/97/339013597.db2.gz DVGJKMNCMQIMPI-HZPDHXFCSA-N 1 2 320.481 4.281 20 0 DIADLO CCCCCN(CCCCC)C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000459097263 339013605 /nfs/dbraw/zinc/01/36/05/339013605.db2.gz DVGJKMNCMQIMPI-CVEARBPZSA-N 1 2 320.481 4.281 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)NC(=O)N(CCC(C)C)CCC(C)C ZINC000459109635 339013921 /nfs/dbraw/zinc/01/39/21/339013921.db2.gz KVDGYYMLPJALJA-INIZCTEOSA-N 1 2 322.497 4.068 20 0 DIADLO CCCC[C@H](C)N(CCCC)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000459122915 339014254 /nfs/dbraw/zinc/01/42/54/339014254.db2.gz SYNPMFHLKFKMEM-ARFHVFGLSA-N 1 2 320.481 4.279 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1cnc(C2CC2)nc1 ZINC000459297485 339019951 /nfs/dbraw/zinc/01/99/51/339019951.db2.gz JHXPSCZYKRBYPM-LBPRGKRZSA-N 1 2 301.821 4.200 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1cnc(C2CC2)nc1 ZINC000459297485 339019952 /nfs/dbraw/zinc/01/99/52/339019952.db2.gz JHXPSCZYKRBYPM-LBPRGKRZSA-N 1 2 301.821 4.200 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1cnc(C2CC2)nc1 ZINC000459307137 339020651 /nfs/dbraw/zinc/02/06/51/339020651.db2.gz NTRZXTUADNQAEF-GFCCVEGCSA-N 1 2 324.453 4.157 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cnc(C2CC2)nc1 ZINC000459307137 339020652 /nfs/dbraw/zinc/02/06/52/339020652.db2.gz NTRZXTUADNQAEF-GFCCVEGCSA-N 1 2 324.453 4.157 20 0 DIADLO COCc1cc(C[N@H+](C)[C@H](c2ccccc2Cl)C(C)C)no1 ZINC000459345059 339023226 /nfs/dbraw/zinc/02/32/26/339023226.db2.gz JDOSSNZCLMPJFM-KRWDZBQOSA-N 1 2 322.836 4.304 20 0 DIADLO COCc1cc(C[N@@H+](C)[C@H](c2ccccc2Cl)C(C)C)no1 ZINC000459345059 339023227 /nfs/dbraw/zinc/02/32/27/339023227.db2.gz JDOSSNZCLMPJFM-KRWDZBQOSA-N 1 2 322.836 4.304 20 0 DIADLO CCOc1ccc([C@H]([NH2+]Cc2cc(C)on2)c2ccccc2)cc1 ZINC000459376806 339025561 /nfs/dbraw/zinc/02/55/61/339025561.db2.gz SLOUQJIYBULMCD-HXUWFJFHSA-N 1 2 322.408 4.261 20 0 DIADLO CC(C)OC1CC([N@@H+]2CCn3c(cc4ccc(Cl)cc43)C2)C1 ZINC000459424317 339028421 /nfs/dbraw/zinc/02/84/21/339028421.db2.gz KSJAIGJJYWCZRF-UHFFFAOYSA-N 1 2 318.848 4.066 20 0 DIADLO CC(C)OC1CC([N@H+]2CCn3c(cc4ccc(Cl)cc43)C2)C1 ZINC000459424317 339028422 /nfs/dbraw/zinc/02/84/22/339028422.db2.gz KSJAIGJJYWCZRF-UHFFFAOYSA-N 1 2 318.848 4.066 20 0 DIADLO FC1(F)CCC(C[N@@H+]2Cc3cnn(-c4ccccc4)c3C2)CC1 ZINC000459487368 339032278 /nfs/dbraw/zinc/03/22/78/339032278.db2.gz MITAYLXCALXDHZ-UHFFFAOYSA-N 1 2 317.383 4.013 20 0 DIADLO FC1(F)CCC(C[N@H+]2Cc3cnn(-c4ccccc4)c3C2)CC1 ZINC000459487368 339032279 /nfs/dbraw/zinc/03/22/79/339032279.db2.gz MITAYLXCALXDHZ-UHFFFAOYSA-N 1 2 317.383 4.013 20 0 DIADLO CC(C)(C)n1ncnc1C[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459568220 339036352 /nfs/dbraw/zinc/03/63/52/339036352.db2.gz BEBLKCFFFWFOPR-SFHVURJKSA-N 1 2 324.472 4.150 20 0 DIADLO CC(C)(C)n1ncnc1C[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459568220 339036353 /nfs/dbraw/zinc/03/63/53/339036353.db2.gz BEBLKCFFFWFOPR-SFHVURJKSA-N 1 2 324.472 4.150 20 0 DIADLO CC(C)Cn1ncnc1C[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459577113 339036973 /nfs/dbraw/zinc/03/69/73/339036973.db2.gz LXQNWKWYXHWORA-IBGZPJMESA-N 1 2 324.472 4.051 20 0 DIADLO CC(C)Cn1ncnc1C[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459577113 339036974 /nfs/dbraw/zinc/03/69/74/339036974.db2.gz LXQNWKWYXHWORA-IBGZPJMESA-N 1 2 324.472 4.051 20 0 DIADLO CCCn1c(C)nnc1C[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459589361 339037582 /nfs/dbraw/zinc/03/75/82/339037582.db2.gz YKVQVYSXSYTMAX-LJQANCHMSA-N 1 2 324.472 4.114 20 0 DIADLO CCCn1c(C)nnc1C[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459589361 339037583 /nfs/dbraw/zinc/03/75/83/339037583.db2.gz YKVQVYSXSYTMAX-LJQANCHMSA-N 1 2 324.472 4.114 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](C)c2nc3c(s2)CCC3)cs1 ZINC000459630982 339039402 /nfs/dbraw/zinc/03/94/02/339039402.db2.gz HLQBSXNEKWFDMV-NSHDSACASA-N 1 2 321.515 4.282 20 0 DIADLO CC1(CC(F)(F)F)C[NH+](C/C=C/c2ccc(F)cc2F)C1 ZINC000459637753 339039730 /nfs/dbraw/zinc/03/97/30/339039730.db2.gz LYRJBJSYIBEWTK-NSCUHMNNSA-N 1 2 305.290 4.252 20 0 DIADLO CC1(CC(F)(F)F)C[NH+](Cc2coc(-c3ccccc3)n2)C1 ZINC000459645085 339040110 /nfs/dbraw/zinc/04/01/10/339040110.db2.gz YBOPOBNLSBHMHU-UHFFFAOYSA-N 1 2 310.319 4.116 20 0 DIADLO CCCn1ncnc1C[N@@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000459749490 339046088 /nfs/dbraw/zinc/04/60/88/339046088.db2.gz PINKYNOQQRNUTG-LJQANCHMSA-N 1 2 324.472 4.196 20 0 DIADLO CCCn1ncnc1C[N@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000459749490 339046089 /nfs/dbraw/zinc/04/60/89/339046089.db2.gz PINKYNOQQRNUTG-LJQANCHMSA-N 1 2 324.472 4.196 20 0 DIADLO Cc1cc[nH+]c(NC[C@@H]2CCN(c3ccccc3F)C2)c1Cl ZINC000461875256 339067782 /nfs/dbraw/zinc/06/77/82/339067782.db2.gz AQIYGJARZIZVHQ-ZDUSSCGKSA-N 1 2 319.811 4.121 20 0 DIADLO C[C@H]1CCc2nc(C[NH+]3CC(c4ccccc4F)C3)sc2C1 ZINC000462828037 339092792 /nfs/dbraw/zinc/09/27/92/339092792.db2.gz KJWAVSQIVOQXJH-LBPRGKRZSA-N 1 2 316.445 4.006 20 0 DIADLO Cc1nc(N[C@@H](Cc2ccccc2)c2ccccc2F)cc[nH+]1 ZINC000462863208 339094867 /nfs/dbraw/zinc/09/48/67/339094867.db2.gz PKIRSKBNZMLRIO-SFHVURJKSA-N 1 2 307.372 4.320 20 0 DIADLO Cc1nc(N[C@H](Cc2ccccc2)c2ccccc2F)cc[nH+]1 ZINC000462863207 339094880 /nfs/dbraw/zinc/09/48/80/339094880.db2.gz PKIRSKBNZMLRIO-GOSISDBHSA-N 1 2 307.372 4.320 20 0 DIADLO CCc1cc(N2C[C@@H](C)CCC[C@@H]2C)nc(-c2ccncc2)[nH+]1 ZINC000462885529 339096135 /nfs/dbraw/zinc/09/61/35/339096135.db2.gz BRPYXSIWHWRXNC-GJZGRUSLSA-N 1 2 310.445 4.116 20 0 DIADLO C[C@H]([NH2+]Cc1ccco1)c1csc(-c2ccccc2F)n1 ZINC000462894658 339096636 /nfs/dbraw/zinc/09/66/36/339096636.db2.gz OQYFSIUROGPJOG-NSHDSACASA-N 1 2 302.374 4.393 20 0 DIADLO Cc1cc(N2CC[C@H](c3ccccc3)[C@H](C)C2)nc(C2CC2)[nH+]1 ZINC000462902529 339097001 /nfs/dbraw/zinc/09/70/01/339097001.db2.gz OAHJVHOAALMSAZ-KDOFPFPSSA-N 1 2 307.441 4.292 20 0 DIADLO CCOC[C@H]1CCC[C@@H]1Nc1ccc(-n2c[nH+]c(C)c2C)cc1 ZINC000463028449 339101503 /nfs/dbraw/zinc/10/15/03/339101503.db2.gz ASQAZSVZLQPGDT-APWZRJJASA-N 1 2 313.445 4.106 20 0 DIADLO COC1(C[C@@H](C)Nc2ccc(-n3c[nH+]c(C)c3C)cc2)CCC1 ZINC000463027855 339101530 /nfs/dbraw/zinc/10/15/30/339101530.db2.gz JHSVXWJJWZPWFD-CQSZACIVSA-N 1 2 313.445 4.249 20 0 DIADLO C[C@H](c1ccsc1)[NH+]1CCN(C(=O)C[C@H](C)C(C)(C)C)CC1 ZINC000463031254 339101838 /nfs/dbraw/zinc/10/18/38/339101838.db2.gz FMELWQVNBPURFL-LSDHHAIUSA-N 1 2 322.518 4.026 20 0 DIADLO CCc1cccc(F)c1C[NH2+][C@@H]1CCOc2c(F)ccc(F)c21 ZINC000463037163 339102313 /nfs/dbraw/zinc/10/23/13/339102313.db2.gz MOLFUMSULPKLRV-MRXNPFEDSA-N 1 2 321.342 4.280 20 0 DIADLO Cc1cccn2cc(-c3ccc(NC(=O)CC4CCC4)cc3)[nH+]c12 ZINC000463126375 339106471 /nfs/dbraw/zinc/10/64/71/339106471.db2.gz IUXGYNBNSGAPFQ-UHFFFAOYSA-N 1 2 319.408 4.438 20 0 DIADLO CC(C)(C)OCCCC[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000463426336 339117409 /nfs/dbraw/zinc/11/74/09/339117409.db2.gz YZOSSBZPBRFJJS-UHFFFAOYSA-N 1 2 300.446 4.052 20 0 DIADLO CC(C)(C)OCCCC[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000463426336 339117410 /nfs/dbraw/zinc/11/74/10/339117410.db2.gz YZOSSBZPBRFJJS-UHFFFAOYSA-N 1 2 300.446 4.052 20 0 DIADLO Cc1ccc(NC(=O)CCc2cccc(C(F)(F)F)c2)c(C)[nH+]1 ZINC000463569480 339121701 /nfs/dbraw/zinc/12/17/01/339121701.db2.gz MTWPMMMTFSNALR-UHFFFAOYSA-N 1 2 322.330 4.289 20 0 DIADLO Cc1ccc(NC(=O)N[C@H]2CCCCC23CCCC3)c(C)[nH+]1 ZINC000463736278 339125091 /nfs/dbraw/zinc/12/50/91/339125091.db2.gz ASRIOMJPZMWTES-INIZCTEOSA-N 1 2 301.434 4.323 20 0 DIADLO CCCC[C@H](CC)C(=O)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000464094333 339134244 /nfs/dbraw/zinc/13/42/44/339134244.db2.gz RAESRVXOKCIJFA-AWEZNQCLSA-N 1 2 317.408 4.298 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)C2(CCF)CC2)c1C(C)C ZINC000464436275 339141879 /nfs/dbraw/zinc/14/18/79/339141879.db2.gz IFPNZAFOLVYZGH-UHFFFAOYSA-N 1 2 314.404 4.167 20 0 DIADLO C[C@@H](NC(=O)C[C@@H](C)C(C)(C)C)c1cccc(-n2cc[nH+]c2)c1 ZINC000464514630 339144000 /nfs/dbraw/zinc/14/40/00/339144000.db2.gz GUIFOHVIUAONJX-HUUCEWRRSA-N 1 2 313.445 4.122 20 0 DIADLO CC(C)(C)OC(=O)C[N@@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000464723679 339149935 /nfs/dbraw/zinc/14/99/35/339149935.db2.gz CANDEPQPPNPLQS-IBGZPJMESA-N 1 2 323.436 4.128 20 0 DIADLO CC(C)(C)OC(=O)C[N@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000464723679 339149936 /nfs/dbraw/zinc/14/99/36/339149936.db2.gz CANDEPQPPNPLQS-IBGZPJMESA-N 1 2 323.436 4.128 20 0 DIADLO CCCc1nc(C[N@@H+]2CCCC[C@@H]2c2cccc(C)c2C)no1 ZINC000464770267 339151996 /nfs/dbraw/zinc/15/19/96/339151996.db2.gz DPKQOBJNEGVZLC-QGZVFWFLSA-N 1 2 313.445 4.366 20 0 DIADLO CCCc1nc(C[N@H+]2CCCC[C@@H]2c2cccc(C)c2C)no1 ZINC000464770267 339151997 /nfs/dbraw/zinc/15/19/97/339151997.db2.gz DPKQOBJNEGVZLC-QGZVFWFLSA-N 1 2 313.445 4.366 20 0 DIADLO CCCc1noc(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccc(CC)o2)n1 ZINC000464837306 339156336 /nfs/dbraw/zinc/15/63/36/339156336.db2.gz MHOHHWALUJSRGG-UKRRQHHQSA-N 1 2 317.433 4.151 20 0 DIADLO CCCc1noc(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccc(CC)o2)n1 ZINC000464837306 339156337 /nfs/dbraw/zinc/15/63/37/339156337.db2.gz MHOHHWALUJSRGG-UKRRQHHQSA-N 1 2 317.433 4.151 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccccc2Cl)[C@H](c2ccccc2)CO1 ZINC000464854369 339158062 /nfs/dbraw/zinc/15/80/62/339158062.db2.gz SOTNNDBWLAVJHH-KDOFPFPSSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccccc2Cl)[C@H](c2ccccc2)CO1 ZINC000464854369 339158063 /nfs/dbraw/zinc/15/80/63/339158063.db2.gz SOTNNDBWLAVJHH-KDOFPFPSSA-N 1 2 301.817 4.302 20 0 DIADLO CC[C@@H]1CCC[C@H]1NC(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000465071401 339167610 /nfs/dbraw/zinc/16/76/10/339167610.db2.gz NNSOCZBOOJCDES-CRAIPNDOSA-N 1 2 324.424 4.491 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)[C@@H](c1cccc(Cl)c1)C(C)C ZINC000465463479 339177659 /nfs/dbraw/zinc/17/76/59/339177659.db2.gz WZOZFLOYFDOOFL-QGZVFWFLSA-N 1 2 316.832 4.098 20 0 DIADLO COC(=O)c1ccc(C[N@H+](C)[C@H](C)c2ccccc2Cl)s1 ZINC000466816801 339217971 /nfs/dbraw/zinc/21/79/71/339217971.db2.gz YWGUEUDDTFVOQK-LLVKDONJSA-N 1 2 323.845 4.381 20 0 DIADLO COC(=O)c1ccc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)s1 ZINC000466816801 339217972 /nfs/dbraw/zinc/21/79/72/339217972.db2.gz YWGUEUDDTFVOQK-LLVKDONJSA-N 1 2 323.845 4.381 20 0 DIADLO Fc1cccc(C[N@@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)c1 ZINC000467191397 339227533 /nfs/dbraw/zinc/22/75/33/339227533.db2.gz OSGCFDBKEOPWOX-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1cccc(C[N@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)c1 ZINC000467191397 339227534 /nfs/dbraw/zinc/22/75/34/339227534.db2.gz OSGCFDBKEOPWOX-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@@H+](C[C@H]2CCC3(CCCCC3)O2)C1 ZINC000467189604 339227589 /nfs/dbraw/zinc/22/75/89/339227589.db2.gz BHFSNENVCPZMRV-MRXNPFEDSA-N 1 2 324.468 4.408 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@H+](C[C@H]2CCC3(CCCCC3)O2)C1 ZINC000467189604 339227590 /nfs/dbraw/zinc/22/75/90/339227590.db2.gz BHFSNENVCPZMRV-MRXNPFEDSA-N 1 2 324.468 4.408 20 0 DIADLO Fc1cccc(C[N@@H+]2CCO[C@H](c3cccc(Cl)c3)C2)c1 ZINC000467191396 339227603 /nfs/dbraw/zinc/22/76/03/339227603.db2.gz OSGCFDBKEOPWOX-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1cccc(C[N@H+]2CCO[C@H](c3cccc(Cl)c3)C2)c1 ZINC000467191396 339227604 /nfs/dbraw/zinc/22/76/04/339227604.db2.gz OSGCFDBKEOPWOX-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@H](Nc2cnn(CC(C)C)c2)C1 ZINC000467344122 339232731 /nfs/dbraw/zinc/23/27/31/339232731.db2.gz GLKOJPQXMCMFCV-SJORKVTESA-N 1 2 312.461 4.381 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)s1 ZINC000467554090 339242279 /nfs/dbraw/zinc/24/22/79/339242279.db2.gz NWGJCRAHZKRNPQ-JTQLQIEISA-N 1 2 306.397 4.215 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)s1 ZINC000467554090 339242280 /nfs/dbraw/zinc/24/22/80/339242280.db2.gz NWGJCRAHZKRNPQ-JTQLQIEISA-N 1 2 306.397 4.215 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)s1 ZINC000467554091 339242358 /nfs/dbraw/zinc/24/23/58/339242358.db2.gz NWGJCRAHZKRNPQ-SNVBAGLBSA-N 1 2 306.397 4.215 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)s1 ZINC000467554091 339242359 /nfs/dbraw/zinc/24/23/59/339242359.db2.gz NWGJCRAHZKRNPQ-SNVBAGLBSA-N 1 2 306.397 4.215 20 0 DIADLO CC[C@H]1C[N@H+](Cc2cc(Cl)cc(Cl)c2OC)CCCO1 ZINC000467560828 339242659 /nfs/dbraw/zinc/24/26/59/339242659.db2.gz VWVCDHRDBJFFCP-ZDUSSCGKSA-N 1 2 318.244 4.003 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2OC)CCCO1 ZINC000467560828 339242660 /nfs/dbraw/zinc/24/26/60/339242660.db2.gz VWVCDHRDBJFFCP-ZDUSSCGKSA-N 1 2 318.244 4.003 20 0 DIADLO CC[C@]1(C)CC[N@H+](CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000468113652 339253822 /nfs/dbraw/zinc/25/38/22/339253822.db2.gz PWEBIXIOXLPYJH-OAHLLOKOSA-N 1 2 315.244 4.054 20 0 DIADLO CC[C@]1(C)CC[N@@H+](CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000468113652 339253823 /nfs/dbraw/zinc/25/38/23/339253823.db2.gz PWEBIXIOXLPYJH-OAHLLOKOSA-N 1 2 315.244 4.054 20 0 DIADLO CCCCOc1ccccc1C[N@@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000468398535 339261879 /nfs/dbraw/zinc/26/18/79/339261879.db2.gz XJMBOGLUXYBMHR-QGZVFWFLSA-N 1 2 313.445 4.316 20 0 DIADLO CCCCOc1ccccc1C[N@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000468398535 339261880 /nfs/dbraw/zinc/26/18/80/339261880.db2.gz XJMBOGLUXYBMHR-QGZVFWFLSA-N 1 2 313.445 4.316 20 0 DIADLO Fc1cncc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)c1 ZINC000468492099 339264118 /nfs/dbraw/zinc/26/41/18/339264118.db2.gz MOMWDXCAMNJAEH-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO Fc1cncc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)c1 ZINC000468492099 339264119 /nfs/dbraw/zinc/26/41/19/339264119.db2.gz MOMWDXCAMNJAEH-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO CCC(C)(C)c1ccc(NC(=O)Cc2cn3ccccc3[nH+]2)cc1 ZINC000468745141 339269742 /nfs/dbraw/zinc/26/97/42/339269742.db2.gz QGJPSBCDBBWAOV-UHFFFAOYSA-N 1 2 321.424 4.203 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CC=C(C(F)(F)F)CC1 ZINC000468787861 339270843 /nfs/dbraw/zinc/27/08/43/339270843.db2.gz BLRAZYSLNSQXDE-UHFFFAOYSA-N 1 2 322.330 4.251 20 0 DIADLO Cc1cc(C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)ccc1Cl ZINC000469042231 339278509 /nfs/dbraw/zinc/27/85/09/339278509.db2.gz VENRQSOKRXBWNM-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO CCC1(CC)C[N@@H+]([C@@H](C)c2ccccc2Cl)CC[S@]1=O ZINC000469440812 339289309 /nfs/dbraw/zinc/28/93/09/339289309.db2.gz NMJHBQGHDUVSEN-RNODOKPDSA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@H+]([C@@H](C)c2ccccc2Cl)CC[S@]1=O ZINC000469440812 339289310 /nfs/dbraw/zinc/28/93/10/339289310.db2.gz NMJHBQGHDUVSEN-RNODOKPDSA-N 1 2 313.894 4.024 20 0 DIADLO CCc1nc(C[N@H+](Cc2ccccc2)[C@@H](C)C(C)(C)C)no1 ZINC000469445679 339289491 /nfs/dbraw/zinc/28/94/91/339289491.db2.gz FQAZNHUBAYQFSV-AWEZNQCLSA-N 1 2 301.434 4.069 20 0 DIADLO CCc1nc(C[N@@H+](Cc2ccccc2)[C@@H](C)C(C)(C)C)no1 ZINC000469445679 339289492 /nfs/dbraw/zinc/28/94/92/339289492.db2.gz FQAZNHUBAYQFSV-AWEZNQCLSA-N 1 2 301.434 4.069 20 0 DIADLO Cc1cnc(C[NH+]2CCC(=Cc3ccc(F)c(F)c3)CC2)s1 ZINC000469447011 339289729 /nfs/dbraw/zinc/28/97/29/339289729.db2.gz WQIISQKIHXSGAX-UHFFFAOYSA-N 1 2 320.408 4.409 20 0 DIADLO CCCc1nc(C[N@@H+]2CC[C@@H](c3c(F)cccc3F)C2)cs1 ZINC000469465200 339290445 /nfs/dbraw/zinc/29/04/45/339290445.db2.gz RPWXSHFUAXONHV-GFCCVEGCSA-N 1 2 322.424 4.363 20 0 DIADLO CCCc1nc(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)cs1 ZINC000469465200 339290446 /nfs/dbraw/zinc/29/04/46/339290446.db2.gz RPWXSHFUAXONHV-GFCCVEGCSA-N 1 2 322.424 4.363 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)Cc2cccc(CC)c2)cs1 ZINC000469603378 339294148 /nfs/dbraw/zinc/29/41/48/339294148.db2.gz STQBZLOILRSXGU-AWEZNQCLSA-N 1 2 318.486 4.435 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)Cc2cccc(CC)c2)cs1 ZINC000469603378 339294149 /nfs/dbraw/zinc/29/41/49/339294149.db2.gz STQBZLOILRSXGU-AWEZNQCLSA-N 1 2 318.486 4.435 20 0 DIADLO Fc1ccc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)nc1 ZINC000469722137 339296532 /nfs/dbraw/zinc/29/65/32/339296532.db2.gz ZVTXYCRJYQXGMN-QGZVFWFLSA-N 1 2 306.331 4.226 20 0 DIADLO Fc1ccc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)nc1 ZINC000469722137 339296533 /nfs/dbraw/zinc/29/65/33/339296533.db2.gz ZVTXYCRJYQXGMN-QGZVFWFLSA-N 1 2 306.331 4.226 20 0 DIADLO Fc1ccc(C[NH+]2CCC(=Cc3ccc(F)c(F)c3)CC2)nc1 ZINC000469765402 339298181 /nfs/dbraw/zinc/29/81/81/339298181.db2.gz SMDQUBIAEGJOPX-UHFFFAOYSA-N 1 2 318.342 4.178 20 0 DIADLO CCCC(C)(C)CC(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000469782372 339299517 /nfs/dbraw/zinc/29/95/17/339299517.db2.gz ZAJMAPWZUQDRLS-HNNXBMFYSA-N 1 2 322.518 4.170 20 0 DIADLO CCc1ccc([C@H](CO)[NH2+][C@H](C)c2csc(C(C)C)n2)cc1 ZINC000469784192 339299694 /nfs/dbraw/zinc/29/96/94/339299694.db2.gz VQZJHOPQUZUWQF-CJNGLKHVSA-N 1 2 318.486 4.213 20 0 DIADLO COc1ccc(C[NH2+][C@H](C)c2csc(C(C)C)n2)c(F)c1 ZINC000469787859 339299990 /nfs/dbraw/zinc/29/99/90/339299990.db2.gz WLJVUTPVBPAJRP-LLVKDONJSA-N 1 2 308.422 4.265 20 0 DIADLO CC(C)CCC1CC[NH+](CC(=O)Nc2c(F)cccc2F)CC1 ZINC000470014946 339308493 /nfs/dbraw/zinc/30/84/93/339308493.db2.gz IJZQKXCRRQIBTI-UHFFFAOYSA-N 1 2 324.415 4.052 20 0 DIADLO C[C@@H]1C[N@H+](CCO[C@@H]2CCCC[C@H]2C)C[C@@H](c2ccsc2)O1 ZINC000470200035 339313995 /nfs/dbraw/zinc/31/39/95/339313995.db2.gz IVZLLPWFLIHYEW-AHCXZYCDSA-N 1 2 323.502 4.105 20 0 DIADLO C[C@@H]1C[N@@H+](CCO[C@@H]2CCCC[C@H]2C)C[C@@H](c2ccsc2)O1 ZINC000470200035 339313996 /nfs/dbraw/zinc/31/39/96/339313996.db2.gz IVZLLPWFLIHYEW-AHCXZYCDSA-N 1 2 323.502 4.105 20 0 DIADLO Cc1ccc(C(=O)N[C@@H](C)CCC2CC2)cc1Oc1cc[nH+]cc1 ZINC000470347533 339317895 /nfs/dbraw/zinc/31/78/95/339317895.db2.gz WAFJCGGRUCASIR-HNNXBMFYSA-N 1 2 324.424 4.491 20 0 DIADLO FC(F)c1cccc(C[N@@H+]2CCO[C@@H](Cc3ccccc3)C2)c1 ZINC000470767245 339327205 /nfs/dbraw/zinc/32/72/05/339327205.db2.gz UTMIARAGRONDMV-SFHVURJKSA-N 1 2 317.379 4.068 20 0 DIADLO FC(F)c1cccc(C[N@H+]2CCO[C@@H](Cc3ccccc3)C2)c1 ZINC000470767245 339327206 /nfs/dbraw/zinc/32/72/06/339327206.db2.gz UTMIARAGRONDMV-SFHVURJKSA-N 1 2 317.379 4.068 20 0 DIADLO FC(F)c1cccc(C[N@@H+]2CCO[C@H](Cc3ccccc3)C2)c1 ZINC000470767244 339327215 /nfs/dbraw/zinc/32/72/15/339327215.db2.gz UTMIARAGRONDMV-GOSISDBHSA-N 1 2 317.379 4.068 20 0 DIADLO FC(F)c1cccc(C[N@H+]2CCO[C@H](Cc3ccccc3)C2)c1 ZINC000470767244 339327216 /nfs/dbraw/zinc/32/72/16/339327216.db2.gz UTMIARAGRONDMV-GOSISDBHSA-N 1 2 317.379 4.068 20 0 DIADLO Fc1ccc2c(c1F)C[N@H+](Cc1cccc(C(F)F)c1)CC2 ZINC000470772243 339327439 /nfs/dbraw/zinc/32/74/39/339327439.db2.gz JHMJFGOPGPOIOC-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO Fc1ccc2c(c1F)C[N@@H+](Cc1cccc(C(F)F)c1)CC2 ZINC000470772243 339327440 /nfs/dbraw/zinc/32/74/40/339327440.db2.gz JHMJFGOPGPOIOC-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO Fc1cccc([C@H]2C[N@H+](Cc3cccc(C(F)F)c3)CCO2)c1 ZINC000470772134 339327510 /nfs/dbraw/zinc/32/75/10/339327510.db2.gz JJKKRLYNCUAHKM-QGZVFWFLSA-N 1 2 321.342 4.337 20 0 DIADLO Fc1cccc([C@H]2C[N@@H+](Cc3cccc(C(F)F)c3)CCO2)c1 ZINC000470772134 339327511 /nfs/dbraw/zinc/32/75/11/339327511.db2.gz JJKKRLYNCUAHKM-QGZVFWFLSA-N 1 2 321.342 4.337 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1cccc(C(F)F)c1)CCO2 ZINC000470868392 339329201 /nfs/dbraw/zinc/32/92/01/339329201.db2.gz KYLBFGHZUWAKOW-UHFFFAOYSA-N 1 2 307.315 4.158 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1cccc(C(F)F)c1)CCO2 ZINC000470868392 339329202 /nfs/dbraw/zinc/32/92/02/339329202.db2.gz KYLBFGHZUWAKOW-UHFFFAOYSA-N 1 2 307.315 4.158 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H]2C)n1 ZINC000470937939 339331662 /nfs/dbraw/zinc/33/16/62/339331662.db2.gz QSHQTMPPBUDVIC-RISCZKNCSA-N 1 2 303.372 4.017 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)n1 ZINC000470937939 339331663 /nfs/dbraw/zinc/33/16/63/339331663.db2.gz QSHQTMPPBUDVIC-RISCZKNCSA-N 1 2 303.372 4.017 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H]2C)cs1 ZINC000470946898 339332059 /nfs/dbraw/zinc/33/20/59/339332059.db2.gz GZAXCCUHWFLGLT-PWSUYJOCSA-N 1 2 306.397 4.258 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)cs1 ZINC000470946898 339332060 /nfs/dbraw/zinc/33/20/60/339332060.db2.gz GZAXCCUHWFLGLT-PWSUYJOCSA-N 1 2 306.397 4.258 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(-c2cccs2)on1 ZINC000470947070 339332208 /nfs/dbraw/zinc/33/22/08/339332208.db2.gz MWCVQDPHSODBKN-ONGXEEELSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(-c2cccs2)on1 ZINC000470947070 339332209 /nfs/dbraw/zinc/33/22/09/339332209.db2.gz MWCVQDPHSODBKN-ONGXEEELSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000470953596 339332551 /nfs/dbraw/zinc/33/25/51/339332551.db2.gz QNJAUGZJHSPYPG-HBNTYKKESA-N 1 2 304.356 4.306 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000470953596 339332552 /nfs/dbraw/zinc/33/25/52/339332552.db2.gz QNJAUGZJHSPYPG-HBNTYKKESA-N 1 2 304.356 4.306 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ncc(-c2cccs2)o1 ZINC000470953250 339332671 /nfs/dbraw/zinc/33/26/71/339332671.db2.gz MQRHMPNFCZNKLU-VHSXEESVSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ncc(-c2cccs2)o1 ZINC000470953250 339332672 /nfs/dbraw/zinc/33/26/72/339332672.db2.gz MQRHMPNFCZNKLU-VHSXEESVSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ncc(-c2cccs2)o1 ZINC000470953248 339332780 /nfs/dbraw/zinc/33/27/80/339332780.db2.gz MQRHMPNFCZNKLU-NXEZZACHSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ncc(-c2cccs2)o1 ZINC000470953248 339332781 /nfs/dbraw/zinc/33/27/81/339332781.db2.gz MQRHMPNFCZNKLU-NXEZZACHSA-N 1 2 316.348 4.176 20 0 DIADLO Cc1cccc(-c2noc(C[N@H+]3C[C@@H](C)[C@H]3c3ccccc3)n2)c1 ZINC000471045299 339335531 /nfs/dbraw/zinc/33/55/31/339335531.db2.gz YLZFOQJXYVCAGD-BEFAXECRSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1cccc(-c2noc(C[N@@H+]3C[C@@H](C)[C@H]3c3ccccc3)n2)c1 ZINC000471045299 339335532 /nfs/dbraw/zinc/33/55/32/339335532.db2.gz YLZFOQJXYVCAGD-BEFAXECRSA-N 1 2 319.408 4.238 20 0 DIADLO CC1(C(=O)Nc2ccc3[nH]c(Cc4ccccc4F)[nH+]c3c2)CC1 ZINC000471054119 339335907 /nfs/dbraw/zinc/33/59/07/339335907.db2.gz UIZSKTNVMIZWRQ-UHFFFAOYSA-N 1 2 323.371 4.031 20 0 DIADLO COc1ccc(-c2cnc(C[N@@H+]3CC[C@@H]3c3ccccc3)o2)cc1 ZINC000471176536 339339755 /nfs/dbraw/zinc/33/97/55/339339755.db2.gz JHBLBDGKWDHURK-GOSISDBHSA-N 1 2 320.392 4.297 20 0 DIADLO COc1ccc(-c2cnc(C[N@H+]3CC[C@@H]3c3ccccc3)o2)cc1 ZINC000471176536 339339756 /nfs/dbraw/zinc/33/97/56/339339756.db2.gz JHBLBDGKWDHURK-GOSISDBHSA-N 1 2 320.392 4.297 20 0 DIADLO CCSc1cccc(CNc2ccc(N3CCCC3)[nH+]c2)c1 ZINC000471469594 339345589 /nfs/dbraw/zinc/34/55/89/339345589.db2.gz DFECSXKRUHFQFG-UHFFFAOYSA-N 1 2 313.470 4.406 20 0 DIADLO CCN(Cc1c[nH+]c2c(C)cccn12)c1ccc2[nH]ccc2c1 ZINC000471812113 339354880 /nfs/dbraw/zinc/35/48/80/339354880.db2.gz UQSXDZYTPFCGQO-UHFFFAOYSA-N 1 2 304.397 4.151 20 0 DIADLO CCCc1nc(C[N@@H+]2CC[C@H](c3ccccc3)[C@@H](CC)C2)no1 ZINC000472252842 339367766 /nfs/dbraw/zinc/36/77/66/339367766.db2.gz XPTLSADJJWEFJB-RDJZCZTQSA-N 1 2 313.445 4.038 20 0 DIADLO CCCc1nc(C[N@H+]2CC[C@H](c3ccccc3)[C@@H](CC)C2)no1 ZINC000472252842 339367767 /nfs/dbraw/zinc/36/77/67/339367767.db2.gz XPTLSADJJWEFJB-RDJZCZTQSA-N 1 2 313.445 4.038 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cn3ccsc3n2)[C@@H]1c1cccc(F)c1 ZINC000472353387 339370708 /nfs/dbraw/zinc/37/07/08/339370708.db2.gz RNGLSWDFNWDFJI-WBMJQRKESA-N 1 2 315.417 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cn3ccsc3n2)[C@@H]1c1cccc(F)c1 ZINC000472353387 339370709 /nfs/dbraw/zinc/37/07/09/339370709.db2.gz RNGLSWDFNWDFJI-WBMJQRKESA-N 1 2 315.417 4.118 20 0 DIADLO Fc1cccc(Cl)c1CCC[N@@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000472578011 339374052 /nfs/dbraw/zinc/37/40/52/339374052.db2.gz DNCRGGIZOJJUTM-MRXNPFEDSA-N 1 2 321.827 4.362 20 0 DIADLO Fc1cccc(Cl)c1CCC[N@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000472578011 339374053 /nfs/dbraw/zinc/37/40/53/339374053.db2.gz DNCRGGIZOJJUTM-MRXNPFEDSA-N 1 2 321.827 4.362 20 0 DIADLO C[C@]1(c2ccccc2)CCC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000473139375 339381338 /nfs/dbraw/zinc/38/13/38/339381338.db2.gz JELDOKYKXFLHHC-INIZCTEOSA-N 1 2 306.862 4.350 20 0 DIADLO C[C@]1(c2ccccc2)CCC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000473139375 339381339 /nfs/dbraw/zinc/38/13/39/339381339.db2.gz JELDOKYKXFLHHC-INIZCTEOSA-N 1 2 306.862 4.350 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CCO[C@@H](c4ccccc4)C3)cc2c1C ZINC000473139784 339382393 /nfs/dbraw/zinc/38/23/93/339382393.db2.gz JYNRRYCWLREQTQ-OAQYLSRUSA-N 1 2 320.436 4.358 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CCO[C@@H](c4ccccc4)C3)cc2c1C ZINC000473139784 339382394 /nfs/dbraw/zinc/38/23/94/339382394.db2.gz JYNRRYCWLREQTQ-OAQYLSRUSA-N 1 2 320.436 4.358 20 0 DIADLO CCSc1cccc(C[N@@H+]2CCO[C@H](c3ccsc3)C2)c1 ZINC000473140045 339382404 /nfs/dbraw/zinc/38/24/04/339382404.db2.gz ASIXDXUWRICTBV-KRWDZBQOSA-N 1 2 319.495 4.434 20 0 DIADLO CCSc1cccc(C[N@H+]2CCO[C@H](c3ccsc3)C2)c1 ZINC000473140045 339382405 /nfs/dbraw/zinc/38/24/05/339382405.db2.gz ASIXDXUWRICTBV-KRWDZBQOSA-N 1 2 319.495 4.434 20 0 DIADLO Clc1cnc(C[N@@H+]2CC[C@H](CSc3ccccc3)C2)s1 ZINC000473141887 339382423 /nfs/dbraw/zinc/38/24/23/339382423.db2.gz QGXASYFDVHZYKR-LBPRGKRZSA-N 1 2 324.902 4.411 20 0 DIADLO Clc1cnc(C[N@H+]2CC[C@H](CSc3ccccc3)C2)s1 ZINC000473141887 339382424 /nfs/dbraw/zinc/38/24/24/339382424.db2.gz QGXASYFDVHZYKR-LBPRGKRZSA-N 1 2 324.902 4.411 20 0 DIADLO CCc1[nH+]c(C)ccc1OCc1nc(-c2ccccc2)oc1C ZINC000473665655 339389850 /nfs/dbraw/zinc/38/98/50/339389850.db2.gz IRVGTKOXTHZNQR-UHFFFAOYSA-N 1 2 308.381 4.495 20 0 DIADLO C[C@H](CCOc1cccc(-n2cc[nH+]c2)c1)OCc1ccccc1 ZINC000473674519 339390061 /nfs/dbraw/zinc/39/00/61/339390061.db2.gz IIIWMOMNKPMNET-QGZVFWFLSA-N 1 2 322.408 4.247 20 0 DIADLO COc1c2ccccc2oc1C[NH2+][C@@H](C)c1ccc(Cl)cn1 ZINC000474038497 339398453 /nfs/dbraw/zinc/39/84/53/339398453.db2.gz UTHZMGMRPGDHBS-NSHDSACASA-N 1 2 316.788 4.341 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1csc([C@H](C)OC)n1 ZINC000474365539 339410994 /nfs/dbraw/zinc/41/09/94/339410994.db2.gz KGDDYWVIKGVZBA-NSHDSACASA-N 1 2 324.877 4.356 20 0 DIADLO Fc1cccc(OC(F)F)c1C[NH2+]Cc1ccsc1Cl ZINC000475427048 339451128 /nfs/dbraw/zinc/45/11/28/339451128.db2.gz ZUASDWVZECMPBR-UHFFFAOYSA-N 1 2 321.751 4.432 20 0 DIADLO CC1(C)CN(c2cc[nH+]c3ccncc32)CC[C@H]1C(F)(F)F ZINC000477800409 339501527 /nfs/dbraw/zinc/50/15/27/339501527.db2.gz OJZFFHMSQHQEBN-CQSZACIVSA-N 1 2 309.335 4.045 20 0 DIADLO Cc1ccc(CNc2cc(Br)ccc2C)c(C)[nH+]1 ZINC000478375774 339514335 /nfs/dbraw/zinc/51/43/35/339514335.db2.gz JHFXDYKUXIQSPJ-UHFFFAOYSA-N 1 2 305.219 4.381 20 0 DIADLO COc1ccc(CSCc2c[nH+]c3ccccn23)cc1Cl ZINC000478599898 339518903 /nfs/dbraw/zinc/51/89/03/339518903.db2.gz HRYPUFUKQSJPGB-UHFFFAOYSA-N 1 2 318.829 4.430 20 0 DIADLO Cc1ccc(COc2cccc(OCC(F)(F)F)c2)c(C)[nH+]1 ZINC000478927028 339524919 /nfs/dbraw/zinc/52/49/19/339524919.db2.gz FANPZGNNNSKHEZ-UHFFFAOYSA-N 1 2 311.303 4.219 20 0 DIADLO Clc1sccc1C[NH2+]Cc1csc(-c2ccco2)n1 ZINC000480277914 339566883 /nfs/dbraw/zinc/56/68/83/339566883.db2.gz YPVYXZXHOIQMHW-UHFFFAOYSA-N 1 2 310.831 4.408 20 0 DIADLO COC[C@@H]([NH2+]Cc1ccsc1Cl)c1ccc(F)c(F)c1 ZINC000480286492 339567314 /nfs/dbraw/zinc/56/73/14/339567314.db2.gz UQMYCWIOZWEFOE-CYBMUJFWSA-N 1 2 317.788 4.157 20 0 DIADLO Cc1cc(N[C@H](c2ccccc2)C(C)C)nc(-c2ccncc2)[nH+]1 ZINC000480402127 339572293 /nfs/dbraw/zinc/57/22/93/339572293.db2.gz IATQGPRVKVSEJN-IBGZPJMESA-N 1 2 318.424 4.078 20 0 DIADLO Cc1cc(N2CCC[C@@H]2C2CCCCC2)nc(-c2ccncc2)[nH+]1 ZINC000480410162 339572505 /nfs/dbraw/zinc/57/25/05/339572505.db2.gz ZHYYEKGVWPXVGF-GOSISDBHSA-N 1 2 322.456 4.396 20 0 DIADLO Cc1cc(N2CCC[C@@]3(CCCOC3)C2)c2cccc(F)c2[nH+]1 ZINC000482012067 339619781 /nfs/dbraw/zinc/61/97/81/339619781.db2.gz YPRUGEQGGJOMGA-LJQANCHMSA-N 1 2 314.404 4.079 20 0 DIADLO Cc1nc(N2C[C@@H](C)C[C@@H]2c2ccc(C(F)(F)F)cc2)cc[nH+]1 ZINC000482090419 339622644 /nfs/dbraw/zinc/62/26/44/339622644.db2.gz AZMHBCGJFLFKPZ-XHDPSFHLSA-N 1 2 321.346 4.391 20 0 DIADLO CC(C)c1nc(C[NH+]2CCC(c3cccc(Cl)c3)CC2)no1 ZINC000483095385 339651575 /nfs/dbraw/zinc/65/15/75/339651575.db2.gz AQCXDGYETKUEPP-UHFFFAOYSA-N 1 2 319.836 4.226 20 0 DIADLO FC(F)C1CC[NH+](Cc2csc(Cc3ccccc3)n2)CC1 ZINC000483533349 339668394 /nfs/dbraw/zinc/66/83/94/339668394.db2.gz PCRPAOVVEJVTQY-UHFFFAOYSA-N 1 2 322.424 4.211 20 0 DIADLO CCCC[C@H](CC)C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000483737116 339673560 /nfs/dbraw/zinc/67/35/60/339673560.db2.gz ZCYWCOAZKZIGAZ-AWEZNQCLSA-N 1 2 323.506 4.284 20 0 DIADLO c1nn(C2CCCC2)c(-c2ccccc2)c1CNc1c[nH]c[nH+]1 ZINC000516561133 339701313 /nfs/dbraw/zinc/70/13/13/339701313.db2.gz PJWHACXPSJOTBZ-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO Cc1ccc(C(C)C)c(OCC(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000485488220 339704352 /nfs/dbraw/zinc/70/43/52/339704352.db2.gz JQHJONNAFPRXSZ-UHFFFAOYSA-N 1 2 312.413 4.148 20 0 DIADLO Cc1cc(C)cc(C[C@H](C)NC(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000485531472 339705071 /nfs/dbraw/zinc/70/50/71/339705071.db2.gz YYWBFAIAXDUOGK-HNNXBMFYSA-N 1 2 311.429 4.068 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000485573221 339706226 /nfs/dbraw/zinc/70/62/26/339706226.db2.gz DQFCTIWBVMREOT-CQSZACIVSA-N 1 2 323.440 4.460 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NC[C@H](c1ccccc1)C(C)C ZINC000485582798 339706552 /nfs/dbraw/zinc/70/65/52/339706552.db2.gz UFUCXELEDMWUDD-KRWDZBQOSA-N 1 2 311.429 4.260 20 0 DIADLO CC(C)c1noc([C@H](C)[NH2+][C@H](C)c2ccc3ncsc3c2)n1 ZINC000485843522 339714297 /nfs/dbraw/zinc/71/42/97/339714297.db2.gz JHDJIFDVQVMKSN-MNOVXSKESA-N 1 2 316.430 4.215 20 0 DIADLO CC(C)c1nc(N2CCC(c3c(F)cccc3F)CC2)cc[nH+]1 ZINC000486053396 339719448 /nfs/dbraw/zinc/71/94/48/339719448.db2.gz MBPZSWNDVCICDT-UHFFFAOYSA-N 1 2 317.383 4.262 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2C(C)C)ccc1Oc1cc[nH+]cc1 ZINC000487708172 339761453 /nfs/dbraw/zinc/76/14/53/339761453.db2.gz LWHHKXGBIAYLOV-IAGOWNOFSA-N 1 2 310.397 4.413 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)c(C)c2)co1 ZINC000487715495 339761570 /nfs/dbraw/zinc/76/15/70/339761570.db2.gz NKCGEYNNLJJWHB-UHFFFAOYSA-N 1 2 308.337 4.336 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(N[C@H]2CS[C@H](C(C)(C)C)C2)c1 ZINC000488349945 339778060 /nfs/dbraw/zinc/77/80/60/339778060.db2.gz CRNFMXCDHQUEOQ-CVEARBPZSA-N 1 2 315.486 4.419 20 0 DIADLO CC(C)[C@H]1C[C@H](Nc2ccc(N3CCCCC3)[nH+]c2)CS1 ZINC000488518626 339786464 /nfs/dbraw/zinc/78/64/64/339786464.db2.gz SVESUDRJXFAKED-JKSUJKDBSA-N 1 2 305.491 4.014 20 0 DIADLO CSC1(C(=O)Nc2ccc(Oc3cc[nH+]cc3)c(C)c2)CC1 ZINC000489359921 339807098 /nfs/dbraw/zinc/80/70/98/339807098.db2.gz RTOYEFZWEWODTJ-UHFFFAOYSA-N 1 2 314.410 4.016 20 0 DIADLO c1nn(Cc2ccccc2)c2nc[nH+]c(S[C@@H]3C=CCCC3)c12 ZINC000489792594 339818749 /nfs/dbraw/zinc/81/87/49/339818749.db2.gz AVZFPWZMSANHFS-OAHLLOKOSA-N 1 2 322.437 4.075 20 0 DIADLO Cc1sc2nc(C[NH+]3CCCC3)nc(SC(C)C)c2c1C ZINC000498579522 339830213 /nfs/dbraw/zinc/83/02/13/339830213.db2.gz ZOFZFLSKAXUBDE-UHFFFAOYSA-N 1 2 321.515 4.404 20 0 DIADLO C[C@@H](C(=O)Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C)C(C)(F)F ZINC000492196781 339894083 /nfs/dbraw/zinc/89/40/83/339894083.db2.gz VIOZWHKIAKDSHB-JTQLQIEISA-N 1 2 323.387 4.101 20 0 DIADLO COc1c(O)cccc1C[NH2+]Cc1cc(Cl)sc1Cl ZINC000493638801 339930058 /nfs/dbraw/zinc/93/00/58/339930058.db2.gz ALTGUZKHCVLRCM-UHFFFAOYSA-N 1 2 318.225 4.059 20 0 DIADLO Cc1cc(SC(C)(C)C)ccc1NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493193412 339919453 /nfs/dbraw/zinc/91/94/53/339919453.db2.gz FOGBTVUFBDBDBX-BQYQJAHWSA-N 1 2 315.442 4.261 20 0 DIADLO CCOc1c(Cl)cccc1CN1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000494994867 339969391 /nfs/dbraw/zinc/96/93/91/339969391.db2.gz LFYOMDYYPGDOJS-HNNXBMFYSA-N 1 2 319.836 4.189 20 0 DIADLO FC(F)[C@@H](CCc1ccccc1)[NH2+]Cc1ccc2c(c1)COC2 ZINC000498804608 340023511 /nfs/dbraw/zinc/02/35/11/340023511.db2.gz BFWIULQNQVITMA-GOSISDBHSA-N 1 2 317.379 4.073 20 0 DIADLO Cc1cc(N(C)[C@H](C)c2ccccc2F)nc(-c2ccncc2)[nH+]1 ZINC000498832137 340024127 /nfs/dbraw/zinc/02/41/27/340024127.db2.gz JFHBGOFXRHQLKI-CQSZACIVSA-N 1 2 322.387 4.184 20 0 DIADLO CCc1cc(N(CCC(C)C)C2CC2)nc(-c2ccncc2)[nH+]1 ZINC000498835689 340024166 /nfs/dbraw/zinc/02/41/66/340024166.db2.gz JBODILUBXBOTIT-UHFFFAOYSA-N 1 2 310.445 4.116 20 0 DIADLO Cc1ccc([C@@H](C)N(C)c2cc(C)[nH+]c(-c3ccncc3)n2)cc1 ZINC000498837490 340024190 /nfs/dbraw/zinc/02/41/90/340024190.db2.gz LMVLZOMGZGLABY-MRXNPFEDSA-N 1 2 318.424 4.353 20 0 DIADLO CCCOc1cccc2c(N[C@@H](C)C3CCOCC3)cc[nH+]c12 ZINC000499141570 340030897 /nfs/dbraw/zinc/03/08/97/340030897.db2.gz LRENHOZQFOBYEW-AWEZNQCLSA-N 1 2 314.429 4.251 20 0 DIADLO CCC[C@@H](CC1CCCCC1)C(=O)Nc1c[nH+]ccc1OC ZINC000499587369 340040024 /nfs/dbraw/zinc/04/00/24/340040024.db2.gz NKEWBVCUXFPEGT-HNNXBMFYSA-N 1 2 304.434 4.415 20 0 DIADLO Cc1cc(C(=O)Nc2ccc3[nH]c(C(C)(C)C)[nH+]c3c2)ccc1O ZINC000499599614 340040387 /nfs/dbraw/zinc/04/03/87/340040387.db2.gz SXTUJEVXMNSHFJ-UHFFFAOYSA-N 1 2 323.396 4.127 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@@H](c2ccc(Cl)cc2)C2CCCC2)no1 ZINC000499908656 340046850 /nfs/dbraw/zinc/04/68/50/340046850.db2.gz KECBXBANXDXRPF-QGZVFWFLSA-N 1 2 319.836 4.395 20 0 DIADLO Cc1nc(C[N@H+](C)[C@@H](c2ccc(Cl)cc2)C2CCCC2)no1 ZINC000499908656 340046851 /nfs/dbraw/zinc/04/68/51/340046851.db2.gz KECBXBANXDXRPF-QGZVFWFLSA-N 1 2 319.836 4.395 20 0 DIADLO CCC[C@H](C)CC(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC000500004159 340048512 /nfs/dbraw/zinc/04/85/12/340048512.db2.gz HNAGDGMOYUDQSU-KBPBESRZSA-N 1 2 323.506 4.140 20 0 DIADLO CCC[C@H](C)CC(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC000500004159 340048513 /nfs/dbraw/zinc/04/85/13/340048513.db2.gz HNAGDGMOYUDQSU-KBPBESRZSA-N 1 2 323.506 4.140 20 0 DIADLO CCCC[C@H](CCC)NC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000500019882 340048664 /nfs/dbraw/zinc/04/86/64/340048664.db2.gz BEASZIXOAMUEOW-SFHVURJKSA-N 1 2 313.445 4.020 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1ccc(SC)cc1)C(=O)OC(C)(C)C ZINC000500247328 340053927 /nfs/dbraw/zinc/05/39/27/340053927.db2.gz WXCUPFSRQCKDGL-WFASDCNBSA-N 1 2 309.475 4.179 20 0 DIADLO COc1ccc(C[NH2+]C2(C(F)F)CC2)cc1OCCC(C)C ZINC000500500127 340060693 /nfs/dbraw/zinc/06/06/93/340060693.db2.gz QWISRDYLKSEPTH-UHFFFAOYSA-N 1 2 313.388 4.007 20 0 DIADLO C[C@H](Nc1cc(Cl)cc(Br)c1)c1[nH+]ccn1C ZINC000308317594 340079229 /nfs/dbraw/zinc/07/92/29/340079229.db2.gz CKORGHMHFCFQNU-QMMMGPOBSA-N 1 2 314.614 4.009 20 0 DIADLO C/C(=C/c1ccccc1)C[NH2+]c1ccc(N2CCOCC2)cc1C ZINC000501378593 340079583 /nfs/dbraw/zinc/07/95/83/340079583.db2.gz RWOKDQMEAWPKSB-VKAVYKQESA-N 1 2 322.452 4.347 20 0 DIADLO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+]1CC[C@](C)(F)C1 ZINC000501415850 340080524 /nfs/dbraw/zinc/08/05/24/340080524.db2.gz FYRZUGZPLQSYAJ-BZNIZROVSA-N 1 2 308.784 4.490 20 0 DIADLO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1CC[C@](C)(F)C1 ZINC000501415850 340080525 /nfs/dbraw/zinc/08/05/25/340080525.db2.gz FYRZUGZPLQSYAJ-BZNIZROVSA-N 1 2 308.784 4.490 20 0 DIADLO CC(C)c1nc([C@H]2CCCCC[N@@H+]2Cc2ccc(F)cc2)no1 ZINC000501710797 340087106 /nfs/dbraw/zinc/08/71/06/340087106.db2.gz CERJFUKMNLUYNN-MRXNPFEDSA-N 1 2 317.408 4.449 20 0 DIADLO CC(C)c1nc([C@H]2CCCCC[N@H+]2Cc2ccc(F)cc2)no1 ZINC000501710797 340087107 /nfs/dbraw/zinc/08/71/07/340087107.db2.gz CERJFUKMNLUYNN-MRXNPFEDSA-N 1 2 317.408 4.449 20 0 DIADLO CCCOc1cccc2c(NCc3cncc(C)c3)cc[nH+]c12 ZINC000501988694 340092206 /nfs/dbraw/zinc/09/22/06/340092206.db2.gz XPIPIRSCZWDKHE-UHFFFAOYSA-N 1 2 307.397 4.339 20 0 DIADLO c1cnn(-c2ccc([NH2+][C@H]3CCC[C@H](c4cccnc4)C3)cc2)c1 ZINC000502238770 340097449 /nfs/dbraw/zinc/09/74/49/340097449.db2.gz CHLNRFWYUMUZFE-LPHOPBHVSA-N 1 2 318.424 4.406 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2c(F)cccc2OC(F)F)oc1C ZINC000502419360 340102789 /nfs/dbraw/zinc/10/27/89/340102789.db2.gz XFVXZXWCVXOTOU-SNVBAGLBSA-N 1 2 313.319 4.488 20 0 DIADLO O=C(CCc1ccccc1)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1 ZINC000502419843 340102820 /nfs/dbraw/zinc/10/28/20/340102820.db2.gz SSCPZCNCXRIRCD-UHFFFAOYSA-N 1 2 319.408 4.402 20 0 DIADLO CCc1ccc(CCC(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000502466319 340104953 /nfs/dbraw/zinc/10/49/53/340104953.db2.gz HSPVJFUQSBLOQS-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO c1cn(-c2cccc(N[C@H]3CCC[C@H](c4cccnc4)C3)c2)c[nH+]1 ZINC000502472991 340105151 /nfs/dbraw/zinc/10/51/51/340105151.db2.gz BGUXHIOBHIZUHF-WMZOPIPTSA-N 1 2 318.424 4.406 20 0 DIADLO CC(C)c1noc([C@@H](C)[NH2+][C@H](c2ccc(F)cc2)C(C)C)n1 ZINC000502488435 340105978 /nfs/dbraw/zinc/10/59/78/340105978.db2.gz SCGIFEXSXIVHHT-DOMZBBRYSA-N 1 2 305.397 4.380 20 0 DIADLO CC[C@H]1C[C@]1([NH2+]Cc1nc(-c2ccco2)no1)c1cccc(C)c1 ZINC000502590845 340108654 /nfs/dbraw/zinc/10/86/54/340108654.db2.gz HVSKHBSDVQQSKU-IFXJQAMLSA-N 1 2 323.396 4.053 20 0 DIADLO CCc1noc(C)c1C[N@@H+]1CC[C@](F)(c2cc(C)cc(F)c2)C1 ZINC000502943581 340117212 /nfs/dbraw/zinc/11/72/12/340117212.db2.gz JMDXADYECARGCD-GOSISDBHSA-N 1 2 320.383 4.064 20 0 DIADLO CCc1noc(C)c1C[N@H+]1CC[C@](F)(c2cc(C)cc(F)c2)C1 ZINC000502943581 340117213 /nfs/dbraw/zinc/11/72/13/340117213.db2.gz JMDXADYECARGCD-GOSISDBHSA-N 1 2 320.383 4.064 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+](Cc2ccc(F)cc2)C2CC2)o1 ZINC000503163245 340122355 /nfs/dbraw/zinc/12/23/55/340122355.db2.gz GEISPDBARCFOES-UHFFFAOYSA-N 1 2 302.393 4.276 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+](Cc2ccc(F)cc2)C2CC2)o1 ZINC000503163245 340122356 /nfs/dbraw/zinc/12/23/56/340122356.db2.gz GEISPDBARCFOES-UHFFFAOYSA-N 1 2 302.393 4.276 20 0 DIADLO C(=C/[C@@H]1CCCN1c1cc[nH+]c2ccncc21)\c1ccccc1 ZINC000503317189 340125327 /nfs/dbraw/zinc/12/53/27/340125327.db2.gz SHQSHAQAGQEARY-IJDCCNJMSA-N 1 2 301.393 4.312 20 0 DIADLO C[C@@H]1C[C@]1([NH2+]Cc1ncc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000503395994 340127265 /nfs/dbraw/zinc/12/72/65/340127265.db2.gz WONDNJHADXTTTI-PIGZYNQJSA-N 1 2 302.805 4.230 20 0 DIADLO c1cc(Oc2ccccc2)oc1C[NH2+]Cc1cn2ccccc2n1 ZINC000503575024 340131204 /nfs/dbraw/zinc/13/12/04/340131204.db2.gz YKLGSIZZSNXCOG-UHFFFAOYSA-N 1 2 319.364 4.009 20 0 DIADLO Cc1ccc2[nH+]c(CN(C)Cc3ccc(F)cc3Cl)cn2c1 ZINC000503576181 340131323 /nfs/dbraw/zinc/13/13/23/340131323.db2.gz BUUGEZPIELCCAD-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)no1 ZINC000503887279 340135736 /nfs/dbraw/zinc/13/57/36/340135736.db2.gz QTEBSAXUXZUSBW-GHMZBOCLSA-N 1 2 314.307 4.293 20 0 DIADLO Cc1cccc2nc(C[N@@H+](C)[C@@H](C)c3ccccc3Cl)cn21 ZINC000504000486 340139439 /nfs/dbraw/zinc/13/94/39/340139439.db2.gz BPTFKJSCYXVVTA-AWEZNQCLSA-N 1 2 313.832 4.489 20 0 DIADLO Cc1cccc2nc(C[N@H+](C)[C@@H](C)c3ccccc3Cl)cn21 ZINC000504000486 340139440 /nfs/dbraw/zinc/13/94/40/340139440.db2.gz BPTFKJSCYXVVTA-AWEZNQCLSA-N 1 2 313.832 4.489 20 0 DIADLO CCC1(CC)CN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000504063205 340140226 /nfs/dbraw/zinc/14/02/26/340140226.db2.gz YSAZAMOIISVKJJ-UHFFFAOYSA-N 1 2 310.397 4.136 20 0 DIADLO Cc1cc(NC(=O)N(CC2CCC2)[C@@H](C)c2ccccc2)cc[nH+]1 ZINC000504151801 340141734 /nfs/dbraw/zinc/14/17/34/340141734.db2.gz RZGOBEKCIIJIAV-INIZCTEOSA-N 1 2 323.440 4.207 20 0 DIADLO CC[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cc[nH+]c(C)c1 ZINC000504151806 340141856 /nfs/dbraw/zinc/14/18/56/340141856.db2.gz SAXRHOBQYRUPEN-OALUTQOASA-N 1 2 323.440 4.002 20 0 DIADLO Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)Nc2cc[nH+]c(C)c2)cc1 ZINC000504161562 340142176 /nfs/dbraw/zinc/14/21/76/340142176.db2.gz FVXVGXSKNSBSIO-BEFAXECRSA-N 1 2 323.440 4.125 20 0 DIADLO Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)Nc2cc[nH+]c(C)c2)cc1 ZINC000504161566 340142230 /nfs/dbraw/zinc/14/22/30/340142230.db2.gz FVXVGXSKNSBSIO-HNAYVOBHSA-N 1 2 323.440 4.125 20 0 DIADLO Cc1cccc([C@@H]2CCCCCN2C(=O)Nc2cc[nH+]c(C)c2)c1 ZINC000504169482 340142396 /nfs/dbraw/zinc/14/23/96/340142396.db2.gz PHIBFYOOPFFOLZ-IBGZPJMESA-N 1 2 323.440 4.270 20 0 DIADLO Cc1cc(NC(=O)N[C@H](C)c2cccc(Cl)c2Cl)cc[nH+]1 ZINC000504171501 340142510 /nfs/dbraw/zinc/14/25/10/340142510.db2.gz XXWLHLDYPBXVJI-SNVBAGLBSA-N 1 2 324.211 4.001 20 0 DIADLO C(=C/c1ccc(-n2cc[nH+]c2)cc1)\c1nc(-c2cccs2)no1 ZINC000504368678 340146138 /nfs/dbraw/zinc/14/61/38/340146138.db2.gz UPGJCGILEVEJQP-VMPITWQZSA-N 1 2 320.377 4.154 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1cc(F)ccc1F ZINC000504376946 340146343 /nfs/dbraw/zinc/14/63/43/340146343.db2.gz RQGRCQGLHCKPPH-LBPRGKRZSA-N 1 2 320.383 4.388 20 0 DIADLO Cc1ccccc1CCC(=O)Nc1c[nH+]ccc1OC(C)(C)C ZINC000504619325 340150239 /nfs/dbraw/zinc/15/02/39/340150239.db2.gz DNGNDXMXJLXVNC-UHFFFAOYSA-N 1 2 312.413 4.139 20 0 DIADLO CCCn1c2ccccc2nc1C[N@H+](C)Cc1cccc(F)c1 ZINC000505564163 340171164 /nfs/dbraw/zinc/17/11/64/340171164.db2.gz LQWQVBBGMPPOBG-UHFFFAOYSA-N 1 2 311.404 4.217 20 0 DIADLO CCCn1c2ccccc2nc1C[N@@H+](C)Cc1cccc(F)c1 ZINC000505564163 340171165 /nfs/dbraw/zinc/17/11/65/340171165.db2.gz LQWQVBBGMPPOBG-UHFFFAOYSA-N 1 2 311.404 4.217 20 0 DIADLO Cc1cnc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000505609024 340172927 /nfs/dbraw/zinc/17/29/27/340172927.db2.gz IFIXJWSDHKAHBJ-NSHDSACASA-N 1 2 310.228 4.285 20 0 DIADLO Cc1cnc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000505609024 340172928 /nfs/dbraw/zinc/17/29/28/340172928.db2.gz IFIXJWSDHKAHBJ-NSHDSACASA-N 1 2 310.228 4.285 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+]3CCn4cccc4[C@H]3C)s2)o1 ZINC000505636693 340173765 /nfs/dbraw/zinc/17/37/65/340173765.db2.gz NSLPHMIUMDZIQV-CYBMUJFWSA-N 1 2 313.426 4.090 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+]3CCn4cccc4[C@H]3C)s2)o1 ZINC000505636693 340173766 /nfs/dbraw/zinc/17/37/66/340173766.db2.gz NSLPHMIUMDZIQV-CYBMUJFWSA-N 1 2 313.426 4.090 20 0 DIADLO COC(=O)c1cc(F)ccc1C[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000505828582 340179038 /nfs/dbraw/zinc/17/90/38/340179038.db2.gz VSAAHSIIZLIKTL-INIZCTEOSA-N 1 2 319.401 4.011 20 0 DIADLO COC(=O)c1cc(F)ccc1C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000505828582 340179039 /nfs/dbraw/zinc/17/90/39/340179039.db2.gz VSAAHSIIZLIKTL-INIZCTEOSA-N 1 2 319.401 4.011 20 0 DIADLO Cc1cnc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000505854081 340179812 /nfs/dbraw/zinc/17/98/12/340179812.db2.gz ZSUWGSKYJLKQOM-ZDUSSCGKSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1cnc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000505854081 340179813 /nfs/dbraw/zinc/17/98/13/340179813.db2.gz ZSUWGSKYJLKQOM-ZDUSSCGKSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1ccc(C(=O)N[C@@H](C)CC(C)C)cc1Oc1cc[nH+]cc1 ZINC000505865756 340180151 /nfs/dbraw/zinc/18/01/51/340180151.db2.gz GQEMYDRKZLXWDD-HNNXBMFYSA-N 1 2 312.413 4.347 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@H]2/C=C\c2ccccc2)no1 ZINC000505880907 340180640 /nfs/dbraw/zinc/18/06/40/340180640.db2.gz ZZDCXKSDGBVJIK-JNSOCZORSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@H]2/C=C\c2ccccc2)no1 ZINC000505880907 340180641 /nfs/dbraw/zinc/18/06/41/340180641.db2.gz ZZDCXKSDGBVJIK-JNSOCZORSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)no1 ZINC000505880910 340180663 /nfs/dbraw/zinc/18/06/63/340180663.db2.gz ZZDCXKSDGBVJIK-YUQCYMQKSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@@H]2/C=C\c2ccccc2)no1 ZINC000505880910 340180664 /nfs/dbraw/zinc/18/06/64/340180664.db2.gz ZZDCXKSDGBVJIK-YUQCYMQKSA-N 1 2 311.429 4.045 20 0 DIADLO C[N@H+](CCOc1ccccc1Cl)Cc1ncc(C(C)(C)C)o1 ZINC000506092320 340185358 /nfs/dbraw/zinc/18/53/58/340185358.db2.gz CXFZCTCHRLCFMQ-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO C[N@@H+](CCOc1ccccc1Cl)Cc1ncc(C(C)(C)C)o1 ZINC000506092320 340185359 /nfs/dbraw/zinc/18/53/59/340185359.db2.gz CXFZCTCHRLCFMQ-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO C[N@H+](CCOc1cccc(Cl)c1)Cc1ncc(C(C)(C)C)o1 ZINC000506093022 340185381 /nfs/dbraw/zinc/18/53/81/340185381.db2.gz HJJAXEPEWGREPK-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO C[N@@H+](CCOc1cccc(Cl)c1)Cc1ncc(C(C)(C)C)o1 ZINC000506093022 340185382 /nfs/dbraw/zinc/18/53/82/340185382.db2.gz HJJAXEPEWGREPK-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)o1 ZINC000506119504 340186070 /nfs/dbraw/zinc/18/60/70/340186070.db2.gz UYLZJWMJUUPBSE-OAHLLOKOSA-N 1 2 302.393 4.448 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)o1 ZINC000506119504 340186071 /nfs/dbraw/zinc/18/60/71/340186071.db2.gz UYLZJWMJUUPBSE-OAHLLOKOSA-N 1 2 302.393 4.448 20 0 DIADLO Oc1ccc(C2=CC[N@H+](Cc3cc(F)c(F)c(F)c3)CC2)cc1 ZINC000506270588 340190718 /nfs/dbraw/zinc/19/07/18/340190718.db2.gz TUJBSBGAWGUQLI-UHFFFAOYSA-N 1 2 319.326 4.099 20 0 DIADLO Oc1ccc(C2=CC[N@@H+](Cc3cc(F)c(F)c(F)c3)CC2)cc1 ZINC000506270588 340190719 /nfs/dbraw/zinc/19/07/19/340190719.db2.gz TUJBSBGAWGUQLI-UHFFFAOYSA-N 1 2 319.326 4.099 20 0 DIADLO Fc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c(Cl)c1 ZINC000506343189 340192860 /nfs/dbraw/zinc/19/28/60/340192860.db2.gz VDDMTTPJVVPKCH-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc(C[N@H+]2CCO[C@H](c3ccccc3)C2)c(Cl)c1 ZINC000506343189 340192861 /nfs/dbraw/zinc/19/28/61/340192861.db2.gz VDDMTTPJVVPKCH-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)s1 ZINC000506354870 340193176 /nfs/dbraw/zinc/19/31/76/340193176.db2.gz YRQRHGVCGULAJI-INIZCTEOSA-N 1 2 316.470 4.014 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CCO[C@H](c3ccccc3)C2)s1 ZINC000506354870 340193177 /nfs/dbraw/zinc/19/31/77/340193177.db2.gz YRQRHGVCGULAJI-INIZCTEOSA-N 1 2 316.470 4.014 20 0 DIADLO Fc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)cc1Cl ZINC000506385970 340193783 /nfs/dbraw/zinc/19/37/83/340193783.db2.gz MZYKTZODNHVDFO-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc(C[N@H+]2CCO[C@H](c3ccccc3)C2)cc1Cl ZINC000506385970 340193784 /nfs/dbraw/zinc/19/37/84/340193784.db2.gz MZYKTZODNHVDFO-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO FC(F)(F)c1ccccc1C[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000506385330 340193799 /nfs/dbraw/zinc/19/37/99/340193799.db2.gz KMQFZXJUYXDAFZ-QGZVFWFLSA-N 1 2 321.342 4.279 20 0 DIADLO FC(F)(F)c1ccccc1C[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000506385330 340193800 /nfs/dbraw/zinc/19/38/00/340193800.db2.gz KMQFZXJUYXDAFZ-QGZVFWFLSA-N 1 2 321.342 4.279 20 0 DIADLO COc1ccsc1C[N@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000506545022 340196403 /nfs/dbraw/zinc/19/64/03/340196403.db2.gz HJZDZFUZNDTACW-UHFFFAOYSA-N 1 2 309.381 4.200 20 0 DIADLO COc1ccsc1C[N@@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000506545022 340196404 /nfs/dbraw/zinc/19/64/04/340196404.db2.gz HJZDZFUZNDTACW-UHFFFAOYSA-N 1 2 309.381 4.200 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000506736303 340200589 /nfs/dbraw/zinc/20/05/89/340200589.db2.gz PQZWVKFDUWWODD-CYBMUJFWSA-N 1 2 309.438 4.258 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000506736303 340200590 /nfs/dbraw/zinc/20/05/90/340200590.db2.gz PQZWVKFDUWWODD-CYBMUJFWSA-N 1 2 309.438 4.258 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1c[nH]c(-c2ccccc2)n1 ZINC000506736303 340200591 /nfs/dbraw/zinc/20/05/91/340200591.db2.gz PQZWVKFDUWWODD-CYBMUJFWSA-N 1 2 309.438 4.258 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1c[nH]c(-c2ccccc2)n1 ZINC000506736303 340200592 /nfs/dbraw/zinc/20/05/92/340200592.db2.gz PQZWVKFDUWWODD-CYBMUJFWSA-N 1 2 309.438 4.258 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc3ccccc3s2)cc1F ZINC000506745255 340200671 /nfs/dbraw/zinc/20/06/71/340200671.db2.gz VXKYMCGSGUZBMG-UHFFFAOYSA-N 1 2 300.402 4.376 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc3ccccc3s2)cc1F ZINC000506745255 340200672 /nfs/dbraw/zinc/20/06/72/340200672.db2.gz VXKYMCGSGUZBMG-UHFFFAOYSA-N 1 2 300.402 4.376 20 0 DIADLO CCCn1nc(C)c(C[N@H+](C)Cc2c(F)cccc2Cl)c1C ZINC000506768775 340201309 /nfs/dbraw/zinc/20/13/09/340201309.db2.gz ZHDONSCPGNNEPG-UHFFFAOYSA-N 1 2 323.843 4.334 20 0 DIADLO CCCn1nc(C)c(C[N@@H+](C)Cc2c(F)cccc2Cl)c1C ZINC000506768775 340201310 /nfs/dbraw/zinc/20/13/10/340201310.db2.gz ZHDONSCPGNNEPG-UHFFFAOYSA-N 1 2 323.843 4.334 20 0 DIADLO C[C@H]1CCc2nc(C[N@@H+]3CCC[C@@H](C(F)(F)F)C3)sc2C1 ZINC000506803355 340202108 /nfs/dbraw/zinc/20/21/08/340202108.db2.gz GJSISBIGQZBBGZ-WDEREUQCSA-N 1 2 318.408 4.042 20 0 DIADLO C[C@H]1CCc2nc(C[N@H+]3CCC[C@@H](C(F)(F)F)C3)sc2C1 ZINC000506803355 340202109 /nfs/dbraw/zinc/20/21/09/340202109.db2.gz GJSISBIGQZBBGZ-WDEREUQCSA-N 1 2 318.408 4.042 20 0 DIADLO C[C@H](CCc1ccc(Br)cc1)Nc1cccc[nH+]1 ZINC000506977992 340204540 /nfs/dbraw/zinc/20/45/40/340204540.db2.gz XVOSNLBOUKJTQS-GFCCVEGCSA-N 1 2 305.219 4.277 20 0 DIADLO Oc1cccc(C[N@H+](Cc2ccccc2F)C2CC2)c1Cl ZINC000507022060 340205558 /nfs/dbraw/zinc/20/55/58/340205558.db2.gz MVEAUAMHIYHOMP-UHFFFAOYSA-N 1 2 305.780 4.349 20 0 DIADLO Oc1cccc(C[N@@H+](Cc2ccccc2F)C2CC2)c1Cl ZINC000507022060 340205559 /nfs/dbraw/zinc/20/55/59/340205559.db2.gz MVEAUAMHIYHOMP-UHFFFAOYSA-N 1 2 305.780 4.349 20 0 DIADLO Cc1ccc(O)c(C[N@@H+](C)Cc2c(Cl)cccc2Cl)n1 ZINC000507110367 340207766 /nfs/dbraw/zinc/20/77/66/340207766.db2.gz JPWJTPHFHVGVBJ-UHFFFAOYSA-N 1 2 311.212 4.034 20 0 DIADLO Cc1ccc(O)c(C[N@H+](C)Cc2c(Cl)cccc2Cl)n1 ZINC000507110367 340207767 /nfs/dbraw/zinc/20/77/67/340207767.db2.gz JPWJTPHFHVGVBJ-UHFFFAOYSA-N 1 2 311.212 4.034 20 0 DIADLO CC[N@H+](Cc1ccc(C)cn1)Cc1ccccc1Br ZINC000507115485 340208018 /nfs/dbraw/zinc/20/80/18/340208018.db2.gz HSPCYRFZOUURNY-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccc(C)cn1)Cc1ccccc1Br ZINC000507115485 340208019 /nfs/dbraw/zinc/20/80/19/340208019.db2.gz HSPCYRFZOUURNY-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@H+](Cc1cnn(C(C)(C)C)c1)Cc1ccccc1Cl ZINC000507135665 340209139 /nfs/dbraw/zinc/20/91/39/340209139.db2.gz UGJGFIVJPDYTMH-UHFFFAOYSA-N 1 2 305.853 4.314 20 0 DIADLO CC[N@@H+](Cc1cnn(C(C)(C)C)c1)Cc1ccccc1Cl ZINC000507135665 340209140 /nfs/dbraw/zinc/20/91/40/340209140.db2.gz UGJGFIVJPDYTMH-UHFFFAOYSA-N 1 2 305.853 4.314 20 0 DIADLO CCn1nccc1C[N@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000507194911 340212545 /nfs/dbraw/zinc/21/25/45/340212545.db2.gz SIJKRACKGFNTFQ-UHFFFAOYSA-N 1 2 309.413 4.007 20 0 DIADLO CCn1nccc1C[N@@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000507194911 340212546 /nfs/dbraw/zinc/21/25/46/340212546.db2.gz SIJKRACKGFNTFQ-UHFFFAOYSA-N 1 2 309.413 4.007 20 0 DIADLO Cc1nccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)n1 ZINC000507221345 340214295 /nfs/dbraw/zinc/21/42/95/340214295.db2.gz ILWXTWNDQDXQRC-INIZCTEOSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1nccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)n1 ZINC000507221345 340214296 /nfs/dbraw/zinc/21/42/96/340214296.db2.gz ILWXTWNDQDXQRC-INIZCTEOSA-N 1 2 322.239 4.429 20 0 DIADLO CCn1cc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000507229476 340214585 /nfs/dbraw/zinc/21/45/85/340214585.db2.gz MJHLXCQGIPZKHM-NSHDSACASA-N 1 2 312.244 4.403 20 0 DIADLO CCn1cc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000507229476 340214586 /nfs/dbraw/zinc/21/45/86/340214586.db2.gz MJHLXCQGIPZKHM-NSHDSACASA-N 1 2 312.244 4.403 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)s1 ZINC000507229440 340214597 /nfs/dbraw/zinc/21/45/97/340214597.db2.gz MAHAHDCUMUECFD-OAHLLOKOSA-N 1 2 322.474 4.482 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)s1 ZINC000507229440 340214598 /nfs/dbraw/zinc/21/45/98/340214598.db2.gz MAHAHDCUMUECFD-OAHLLOKOSA-N 1 2 322.474 4.482 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)Cc1ccc2c(c1)CCO2 ZINC000507247499 340215555 /nfs/dbraw/zinc/21/55/55/340215555.db2.gz OPDDLQWBVQGTIK-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccc2c(c1)CCO2 ZINC000507247499 340215556 /nfs/dbraw/zinc/21/55/56/340215556.db2.gz OPDDLQWBVQGTIK-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO CC(=O)Nc1ccc(C[N@@H+](C)[C@@H](C)c2c(F)cccc2F)cc1 ZINC000507252340 340215787 /nfs/dbraw/zinc/21/57/87/340215787.db2.gz MRVMXPUNUHUQTI-LBPRGKRZSA-N 1 2 318.367 4.116 20 0 DIADLO CC(=O)Nc1ccc(C[N@H+](C)[C@@H](C)c2c(F)cccc2F)cc1 ZINC000507252340 340215788 /nfs/dbraw/zinc/21/57/88/340215788.db2.gz MRVMXPUNUHUQTI-LBPRGKRZSA-N 1 2 318.367 4.116 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+](C)C[C@H]1OCCc2ccccc21 ZINC000507258437 340215920 /nfs/dbraw/zinc/21/59/20/340215920.db2.gz CAAPJKPUYRWVOT-FZKQIMNGSA-N 1 2 317.379 4.272 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)C[C@H]1OCCc2ccccc21 ZINC000507258437 340215921 /nfs/dbraw/zinc/21/59/21/340215921.db2.gz CAAPJKPUYRWVOT-FZKQIMNGSA-N 1 2 317.379 4.272 20 0 DIADLO COc1ccsc1C[N@@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000507352188 340217756 /nfs/dbraw/zinc/21/77/56/340217756.db2.gz ILQHBEGTEWOAJT-IBGZPJMESA-N 1 2 324.449 4.163 20 0 DIADLO COc1ccsc1C[N@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000507352188 340217757 /nfs/dbraw/zinc/21/77/57/340217757.db2.gz ILQHBEGTEWOAJT-IBGZPJMESA-N 1 2 324.449 4.163 20 0 DIADLO COc1ccccc1C[N@@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000507372158 340218208 /nfs/dbraw/zinc/21/82/08/340218208.db2.gz PAQORXXHZKIRMP-NRFANRHFSA-N 1 2 318.420 4.102 20 0 DIADLO COc1ccccc1C[N@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000507372158 340218209 /nfs/dbraw/zinc/21/82/09/340218209.db2.gz PAQORXXHZKIRMP-NRFANRHFSA-N 1 2 318.420 4.102 20 0 DIADLO CC[C@@H](C)CCC(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC000507433823 340219425 /nfs/dbraw/zinc/21/94/25/340219425.db2.gz NQXWBCYOGOWULT-ZIAGYGMSSA-N 1 2 323.506 4.140 20 0 DIADLO CC[C@@H](C)CCC(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000507433823 340219426 /nfs/dbraw/zinc/21/94/26/340219426.db2.gz NQXWBCYOGOWULT-ZIAGYGMSSA-N 1 2 323.506 4.140 20 0 DIADLO CCc1cccnc1[C@@H](C)Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000507441834 340219654 /nfs/dbraw/zinc/21/96/54/340219654.db2.gz MKTVTVRBZXDNDC-OAHLLOKOSA-N 1 2 310.445 4.202 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1ccc(SC)cc1)C(=O)OC(C)(C)C ZINC000507489428 340222254 /nfs/dbraw/zinc/22/22/54/340222254.db2.gz WXCUPFSRQCKDGL-IUODEOHRSA-N 1 2 309.475 4.179 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1ccc(SC)cc1)C(=O)OC(C)(C)C ZINC000507489427 340222415 /nfs/dbraw/zinc/22/24/15/340222415.db2.gz WXCUPFSRQCKDGL-DOMZBBRYSA-N 1 2 309.475 4.179 20 0 DIADLO Cn1cc[nH+]c1CN1CCCc2cc(-c3ccccc3)ccc21 ZINC000507709369 340229064 /nfs/dbraw/zinc/22/90/64/340229064.db2.gz QALIPCLHPIHLPF-UHFFFAOYSA-N 1 2 303.409 4.040 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@H](c3ccsc3)C2)ccc1Cl ZINC000507791599 340231581 /nfs/dbraw/zinc/23/15/81/340231581.db2.gz CYDMKKXNMJOCGJ-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@H](c3ccsc3)C2)ccc1Cl ZINC000507791599 340231582 /nfs/dbraw/zinc/23/15/82/340231582.db2.gz CYDMKKXNMJOCGJ-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO CC(C)(C)C[N@H+](Cc1noc(C(C)(C)C)n1)Cc1ccccc1 ZINC000507864626 340234548 /nfs/dbraw/zinc/23/45/48/340234548.db2.gz YCNHMVBZVAMBQA-UHFFFAOYSA-N 1 2 315.461 4.415 20 0 DIADLO CC(C)(C)C[N@@H+](Cc1noc(C(C)(C)C)n1)Cc1ccccc1 ZINC000507864626 340234549 /nfs/dbraw/zinc/23/45/49/340234549.db2.gz YCNHMVBZVAMBQA-UHFFFAOYSA-N 1 2 315.461 4.415 20 0 DIADLO Fc1ccc(F)c2c1CC[C@@H]2[NH2+][C@@H]1COc2ccc(Cl)cc21 ZINC000507869510 340234712 /nfs/dbraw/zinc/23/47/12/340234712.db2.gz AIENWDNQWCFPIX-LSDHHAIUSA-N 1 2 321.754 4.329 20 0 DIADLO CCc1ccccc1C[NH2+][C@H](c1nccn1C)c1cccc(F)c1 ZINC000507899999 340235538 /nfs/dbraw/zinc/23/55/38/340235538.db2.gz DIRVWDVEVLZNTN-IBGZPJMESA-N 1 2 323.415 4.001 20 0 DIADLO CCc1nocc1C[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC000508159327 340239822 /nfs/dbraw/zinc/23/98/22/340239822.db2.gz GDISFICGDLYCPO-UHFFFAOYSA-N 1 2 304.393 4.420 20 0 DIADLO Cc1sccc1C[N@@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000508204758 340240487 /nfs/dbraw/zinc/24/04/87/340240487.db2.gz CSTLCVBYDNXSPB-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1sccc1C[N@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000508204758 340240488 /nfs/dbraw/zinc/24/04/88/340240488.db2.gz CSTLCVBYDNXSPB-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO CC(C)(C)c1nc(CNc2[nH]c3cccc(Cl)c3[nH+]2)cs1 ZINC000508484689 340244659 /nfs/dbraw/zinc/24/46/59/340244659.db2.gz ADLDUCWSIWEVAP-UHFFFAOYSA-N 1 2 320.849 4.004 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+](C)Cc2nc3ccccc3n2C)c1 ZINC000508543688 340246192 /nfs/dbraw/zinc/24/61/92/340246192.db2.gz JHBZTUUATKFXMV-UHFFFAOYSA-N 1 2 313.832 4.167 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+](C)Cc2nc3ccccc3n2C)c1 ZINC000508543688 340246193 /nfs/dbraw/zinc/24/61/93/340246193.db2.gz JHBZTUUATKFXMV-UHFFFAOYSA-N 1 2 313.832 4.167 20 0 DIADLO CCC[N@H+](Cc1c(C)n[nH]c1C)Cc1c(F)cccc1Cl ZINC000508624199 340248653 /nfs/dbraw/zinc/24/86/53/340248653.db2.gz DPESFVMQDRVABT-UHFFFAOYSA-N 1 2 309.816 4.231 20 0 DIADLO CCC[N@@H+](Cc1c(C)n[nH]c1C)Cc1c(F)cccc1Cl ZINC000508624199 340248654 /nfs/dbraw/zinc/24/86/54/340248654.db2.gz DPESFVMQDRVABT-UHFFFAOYSA-N 1 2 309.816 4.231 20 0 DIADLO Cc1ccc(-c2cccc(C[N@@H+](C)Cc3nccn3C)c2)cc1 ZINC000508669087 340250068 /nfs/dbraw/zinc/25/00/68/340250068.db2.gz HGKOXLFGNRODSB-UHFFFAOYSA-N 1 2 305.425 4.028 20 0 DIADLO Cc1ccc(-c2cccc(C[N@H+](C)Cc3nccn3C)c2)cc1 ZINC000508669087 340250069 /nfs/dbraw/zinc/25/00/69/340250069.db2.gz HGKOXLFGNRODSB-UHFFFAOYSA-N 1 2 305.425 4.028 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1cccc(O)c1Cl ZINC000508968463 340256428 /nfs/dbraw/zinc/25/64/28/340256428.db2.gz QMXJWGGDRQRYMU-OAHLLOKOSA-N 1 2 304.821 4.111 20 0 DIADLO COc1cccc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)c1 ZINC000509014405 340258306 /nfs/dbraw/zinc/25/83/06/340258306.db2.gz KINWLFZFYYKLIX-UHFFFAOYSA-N 1 2 320.348 4.135 20 0 DIADLO CC(C)CC[C@H](C)NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509016065 340258373 /nfs/dbraw/zinc/25/83/73/340258373.db2.gz PBFPCRMOTHHPQV-HNNXBMFYSA-N 1 2 312.413 4.428 20 0 DIADLO CN(C(=O)c1ccccc1Oc1cc[nH+]cc1)C1CCCCC1 ZINC000509032697 340258899 /nfs/dbraw/zinc/25/88/99/340258899.db2.gz JBOUDVYYWBMHIY-UHFFFAOYSA-N 1 2 310.397 4.279 20 0 DIADLO Cc1nocc1C[N@@H+]1CCc2cc(Cl)c(Cl)cc2[C@H]1C ZINC000509050330 340259656 /nfs/dbraw/zinc/25/96/56/340259656.db2.gz VUVPAWMYPQYUJD-SNVBAGLBSA-N 1 2 311.212 4.409 20 0 DIADLO Cc1nocc1C[N@H+]1CCc2cc(Cl)c(Cl)cc2[C@H]1C ZINC000509050330 340259657 /nfs/dbraw/zinc/25/96/57/340259657.db2.gz VUVPAWMYPQYUJD-SNVBAGLBSA-N 1 2 311.212 4.409 20 0 DIADLO Cc1nocc1C[N@@H+]1CCc2cc(Cl)c(Cl)cc2[C@@H]1C ZINC000509050328 340259683 /nfs/dbraw/zinc/25/96/83/340259683.db2.gz VUVPAWMYPQYUJD-JTQLQIEISA-N 1 2 311.212 4.409 20 0 DIADLO Cc1nocc1C[N@H+]1CCc2cc(Cl)c(Cl)cc2[C@@H]1C ZINC000509050328 340259684 /nfs/dbraw/zinc/25/96/84/340259684.db2.gz VUVPAWMYPQYUJD-JTQLQIEISA-N 1 2 311.212 4.409 20 0 DIADLO CC(C)(C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)C1CC1 ZINC000509107106 340261448 /nfs/dbraw/zinc/26/14/48/340261448.db2.gz LJFUPGNJUHIUAF-UHFFFAOYSA-N 1 2 323.440 4.261 20 0 DIADLO C[C@@H](CCC1CC1)NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509311851 340265977 /nfs/dbraw/zinc/26/59/77/340265977.db2.gz BQUWSMNGJISLDU-AWEZNQCLSA-N 1 2 310.397 4.182 20 0 DIADLO Cc1nc(N2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)c(C)c(C)[nH+]1 ZINC000509475194 340270876 /nfs/dbraw/zinc/27/08/76/340270876.db2.gz HQYVTBAAIZMOQD-REPLKXPHSA-N 1 2 307.441 4.317 20 0 DIADLO C[C@H](F)CC[N@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000509673155 340276428 /nfs/dbraw/zinc/27/64/28/340276428.db2.gz NGSNQVGSQXQXFN-IINYFYTJSA-N 1 2 306.208 4.115 20 0 DIADLO C[C@H](F)CC[N@@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000509673155 340276427 /nfs/dbraw/zinc/27/64/27/340276427.db2.gz NGSNQVGSQXQXFN-IINYFYTJSA-N 1 2 306.208 4.115 20 0 DIADLO FC(F)(F)c1ccccc1C[N@@H+]1CCOC[C@H]1c1ccccc1 ZINC000509674479 340276577 /nfs/dbraw/zinc/27/65/77/340276577.db2.gz YTNPZYJBBBFPOY-KRWDZBQOSA-N 1 2 321.342 4.279 20 0 DIADLO FC(F)(F)c1ccccc1C[N@H+]1CCOC[C@H]1c1ccccc1 ZINC000509674479 340276578 /nfs/dbraw/zinc/27/65/78/340276578.db2.gz YTNPZYJBBBFPOY-KRWDZBQOSA-N 1 2 321.342 4.279 20 0 DIADLO FCCCC[N@@H+]1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000509698430 340277431 /nfs/dbraw/zinc/27/74/31/340277431.db2.gz NXKLQIBAYPTVIA-AWEZNQCLSA-N 1 2 324.198 4.256 20 0 DIADLO FCCCC[N@H+]1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000509698430 340277432 /nfs/dbraw/zinc/27/74/32/340277432.db2.gz NXKLQIBAYPTVIA-AWEZNQCLSA-N 1 2 324.198 4.256 20 0 DIADLO Cn1c(CCSc2ccc(F)c(F)c2)[nH+]c2ccccc21 ZINC000509969843 340284204 /nfs/dbraw/zinc/28/42/04/340284204.db2.gz OWJLDPIHZZPIFT-UHFFFAOYSA-N 1 2 304.365 4.186 20 0 DIADLO C[C@H]1CC(NC(=O)c2ccccc2Oc2cc[nH+]cc2)C[C@H](C)C1 ZINC000509989134 340284742 /nfs/dbraw/zinc/28/47/42/340284742.db2.gz LGNBFFYYLKNROV-HUUCEWRRSA-N 1 2 324.424 4.428 20 0 DIADLO CC(C)C[C@@H]1CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000510061602 340286891 /nfs/dbraw/zinc/28/68/91/340286891.db2.gz SLPKVKAJAQXSMW-INIZCTEOSA-N 1 2 324.424 4.382 20 0 DIADLO C[C@@H](CC1CCCCC1)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000510067753 340287132 /nfs/dbraw/zinc/28/71/32/340287132.db2.gz HYBAFVCZFDDZOO-HNNXBMFYSA-N 1 2 311.429 4.417 20 0 DIADLO C[C@H](CC1CCCCC1)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000510067754 340287225 /nfs/dbraw/zinc/28/72/25/340287225.db2.gz HYBAFVCZFDDZOO-OAHLLOKOSA-N 1 2 311.429 4.417 20 0 DIADLO CCN(C(=O)Cn1c(C)[nH+]c2ccccc21)c1cccc(C)c1C ZINC000510093080 340288476 /nfs/dbraw/zinc/28/84/76/340288476.db2.gz WDEFJTKNJGBLFP-UHFFFAOYSA-N 1 2 321.424 4.015 20 0 DIADLO CCCCCNC(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000510115891 340289336 /nfs/dbraw/zinc/28/93/36/340289336.db2.gz CYBZJRMDNOXVSV-UHFFFAOYSA-N 1 2 318.804 4.447 20 0 DIADLO FC(F)(F)c1ccccc1C[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000510128320 340289842 /nfs/dbraw/zinc/28/98/42/340289842.db2.gz RAVFDRWZWIRIBQ-HNNXBMFYSA-N 1 2 309.335 4.156 20 0 DIADLO FC(F)(F)c1ccccc1C[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000510128320 340289843 /nfs/dbraw/zinc/28/98/43/340289843.db2.gz RAVFDRWZWIRIBQ-HNNXBMFYSA-N 1 2 309.335 4.156 20 0 DIADLO CCc1cccc(C)c1NC(=O)C[NH2+]C1(C(F)F)CCCCC1 ZINC000510135835 340290152 /nfs/dbraw/zinc/29/01/52/340290152.db2.gz UJYMNCNBVSLMEO-UHFFFAOYSA-N 1 2 324.415 4.054 20 0 DIADLO COc1ccccc1[C@H]1CC[C@@H](C)C[N@@H+]1Cc1cscn1 ZINC000510224997 340293168 /nfs/dbraw/zinc/29/31/68/340293168.db2.gz WBLJEKIPFQPCOP-CZUORRHYSA-N 1 2 302.443 4.125 20 0 DIADLO COc1ccccc1[C@H]1CC[C@@H](C)C[N@H+]1Cc1cscn1 ZINC000510224997 340293169 /nfs/dbraw/zinc/29/31/69/340293169.db2.gz WBLJEKIPFQPCOP-CZUORRHYSA-N 1 2 302.443 4.125 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2nc3ccccc3n2C)c1 ZINC000510405260 340298325 /nfs/dbraw/zinc/29/83/25/340298325.db2.gz ZGSAGHDMXGVVDQ-LJQANCHMSA-N 1 2 323.415 4.358 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3n2C)c1 ZINC000510405260 340298326 /nfs/dbraw/zinc/29/83/26/340298326.db2.gz ZGSAGHDMXGVVDQ-LJQANCHMSA-N 1 2 323.415 4.358 20 0 DIADLO CC(C)(C)CNC(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000510472534 340300506 /nfs/dbraw/zinc/30/05/06/340300506.db2.gz AAXJSNNVMWXQRO-UHFFFAOYSA-N 1 2 318.804 4.303 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000511117863 340321252 /nfs/dbraw/zinc/32/12/52/340321252.db2.gz ZFFNVHNWIYFDOC-QGZVFWFLSA-N 1 2 317.429 4.121 20 0 DIADLO CSc1ccccc1C[N@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000511117863 340321253 /nfs/dbraw/zinc/32/12/53/340321253.db2.gz ZFFNVHNWIYFDOC-QGZVFWFLSA-N 1 2 317.429 4.121 20 0 DIADLO Cn1ccc(C[N@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)n1 ZINC000511187243 340323585 /nfs/dbraw/zinc/32/35/85/340323585.db2.gz RPTVXJUCRRKJKS-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1ccc(C[N@@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)n1 ZINC000511187243 340323586 /nfs/dbraw/zinc/32/35/86/340323586.db2.gz RPTVXJUCRRKJKS-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Clc1ccc([C@H]2CC[N@@H+]2Cc2ccc3c(c2)OCCO3)cc1 ZINC000511540498 340330057 /nfs/dbraw/zinc/33/00/57/340330057.db2.gz HUXLGHSSIBQFJT-MRXNPFEDSA-N 1 2 315.800 4.058 20 0 DIADLO Clc1ccc([C@H]2CC[N@H+]2Cc2ccc3c(c2)OCCO3)cc1 ZINC000511540498 340330058 /nfs/dbraw/zinc/33/00/58/340330058.db2.gz HUXLGHSSIBQFJT-MRXNPFEDSA-N 1 2 315.800 4.058 20 0 DIADLO COC(=O)c1ccccc1C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511556216 340330588 /nfs/dbraw/zinc/33/05/88/340330588.db2.gz QFLMFHZQITWJBC-QGZVFWFLSA-N 1 2 315.800 4.074 20 0 DIADLO COC(=O)c1ccccc1C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511556216 340330589 /nfs/dbraw/zinc/33/05/89/340330589.db2.gz QFLMFHZQITWJBC-QGZVFWFLSA-N 1 2 315.800 4.074 20 0 DIADLO Cc1cccc2[nH+]c(CN3CC[C@@H]3c3ccc(Cl)cc3)cn21 ZINC000511586277 340331363 /nfs/dbraw/zinc/33/13/63/340331363.db2.gz FXEDKKXUZCPJBY-QGZVFWFLSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1cccc2[nH+]c(CN3CC[C@H]3c3ccc(Cl)cc3)cn21 ZINC000511586276 340331375 /nfs/dbraw/zinc/33/13/75/340331375.db2.gz FXEDKKXUZCPJBY-KRWDZBQOSA-N 1 2 311.816 4.243 20 0 DIADLO CC(C)N(C(=O)[C@H](C)[N@@H+]1CC[C@H]1c1ccc(Cl)cc1)C(C)C ZINC000511621244 340332875 /nfs/dbraw/zinc/33/28/75/340332875.db2.gz BWWHKWMUTPEMNL-YOEHRIQHSA-N 1 2 322.880 4.121 20 0 DIADLO CC(C)N(C(=O)[C@H](C)[N@H+]1CC[C@H]1c1ccc(Cl)cc1)C(C)C ZINC000511621244 340332876 /nfs/dbraw/zinc/33/28/76/340332876.db2.gz BWWHKWMUTPEMNL-YOEHRIQHSA-N 1 2 322.880 4.121 20 0 DIADLO CCc1cc(N(C)[C@H]2CCCC[C@@H]2C)nc(-c2ccncc2)[nH+]1 ZINC000303608778 340337099 /nfs/dbraw/zinc/33/70/99/340337099.db2.gz QVMAOWNYBZNTJI-YOEHRIQHSA-N 1 2 310.445 4.116 20 0 DIADLO CCc1cc(N(C)[C@H]2CCCC[C@H]2C)nc(-c2ccncc2)[nH+]1 ZINC000303608772 340337139 /nfs/dbraw/zinc/33/71/39/340337139.db2.gz QVMAOWNYBZNTJI-PBHICJAKSA-N 1 2 310.445 4.116 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)CCC(F)(F)F)cc1Cl ZINC000511769807 340337752 /nfs/dbraw/zinc/33/77/52/340337752.db2.gz IAQZFUJTZVBFLO-UHFFFAOYSA-N 1 2 316.150 4.386 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)CCC(F)(F)F)cc1Cl ZINC000511769807 340337753 /nfs/dbraw/zinc/33/77/53/340337753.db2.gz IAQZFUJTZVBFLO-UHFFFAOYSA-N 1 2 316.150 4.386 20 0 DIADLO Fc1ccc(/C=C\CNc2cccc(-n3cc[nH+]c3)c2)cc1F ZINC000512070727 340347651 /nfs/dbraw/zinc/34/76/51/340347651.db2.gz GSAWSSNISPYFHZ-IHWYPQMZSA-N 1 2 311.335 4.276 20 0 DIADLO Cc1cc(NC(=O)CCCc2ccc(Cl)c(Cl)c2)cc[nH+]1 ZINC000512207768 340352338 /nfs/dbraw/zinc/35/23/38/340352338.db2.gz VTYGVOXKFCSAME-UHFFFAOYSA-N 1 2 323.223 4.080 20 0 DIADLO Cc1c(C(=O)Nc2ccc[nH+]c2N(C)C)oc2c1c(C)ccc2C ZINC000512334140 340357596 /nfs/dbraw/zinc/35/75/96/340357596.db2.gz MGAPTRNNZIPSQW-UHFFFAOYSA-N 1 2 323.396 4.071 20 0 DIADLO Cc1cc2cc(C[N@@H+]3CCCC[C@@H]3c3ncc[nH]3)oc2cc1C ZINC000512484598 340363584 /nfs/dbraw/zinc/36/35/84/340363584.db2.gz CPBUPHSLAUIWRH-QGZVFWFLSA-N 1 2 309.413 4.500 20 0 DIADLO Cc1cc2cc(C[N@H+]3CCCC[C@@H]3c3ncc[nH]3)oc2cc1C ZINC000512484598 340363585 /nfs/dbraw/zinc/36/35/85/340363585.db2.gz CPBUPHSLAUIWRH-QGZVFWFLSA-N 1 2 309.413 4.500 20 0 DIADLO CCc1cc(NCc2cc(-n3cc[nH+]c3)cs2)ccc1F ZINC000512491888 340363917 /nfs/dbraw/zinc/36/39/17/340363917.db2.gz LVVWUIRUGQFWHO-UHFFFAOYSA-N 1 2 301.390 4.247 20 0 DIADLO Clc1cccc(CN2CCCC[C@@H]2c2[nH]cc[nH+]2)c1Cl ZINC000512542714 340366242 /nfs/dbraw/zinc/36/62/42/340366242.db2.gz UANCABQTAACENI-CYBMUJFWSA-N 1 2 310.228 4.444 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)[C@@H](C)c1cccc(CC(C)C)c1 ZINC000512576445 340367702 /nfs/dbraw/zinc/36/77/02/340367702.db2.gz CMNJYSIHHGMLBI-HNNXBMFYSA-N 1 2 310.441 4.007 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000173603976 340368584 /nfs/dbraw/zinc/36/85/84/340368584.db2.gz PAHXYXPDNCSHCD-ZIAGYGMSSA-N 1 2 321.207 4.439 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000173603989 340368609 /nfs/dbraw/zinc/36/86/09/340368609.db2.gz PAHXYXPDNCSHCD-KGLIPLIRSA-N 1 2 321.207 4.439 20 0 DIADLO COc1ccc2sc(C(=O)Nc3cc[nH+]c(C)c3)c(C)c2c1 ZINC000173688143 340371582 /nfs/dbraw/zinc/37/15/82/340371582.db2.gz SYXVWGGPBCCQID-UHFFFAOYSA-N 1 2 312.394 4.174 20 0 DIADLO CCCCCc1[nH+]c2ccccc2n1C[C@@](C)(O)C(F)(F)F ZINC000512807729 340378588 /nfs/dbraw/zinc/37/85/88/340378588.db2.gz JUDSWBQTGJACOI-OAHLLOKOSA-N 1 2 314.351 4.082 20 0 DIADLO Cc1cc(C[N@H+](CCc2ccc(C)cc2)Cc2ccco2)no1 ZINC000174043517 340380876 /nfs/dbraw/zinc/38/08/76/340380876.db2.gz QMJHBKWMOFQGOE-UHFFFAOYSA-N 1 2 310.397 4.129 20 0 DIADLO Cc1cc(C[N@@H+](CCc2ccc(C)cc2)Cc2ccco2)no1 ZINC000174043517 340380877 /nfs/dbraw/zinc/38/08/77/340380877.db2.gz QMJHBKWMOFQGOE-UHFFFAOYSA-N 1 2 310.397 4.129 20 0 DIADLO Cc1ccccc1-c1noc([C@@H](C)[NH+]2Cc3ccccc3C2)n1 ZINC000174138198 340382728 /nfs/dbraw/zinc/38/27/28/340382728.db2.gz WRPWFPJSJKYRRQ-CQSZACIVSA-N 1 2 305.381 4.122 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000512907597 340383546 /nfs/dbraw/zinc/38/35/46/340383546.db2.gz SCELFCCPFVWBTL-GLJUWKHASA-N 1 2 317.379 4.488 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000512907597 340383547 /nfs/dbraw/zinc/38/35/47/340383547.db2.gz SCELFCCPFVWBTL-GLJUWKHASA-N 1 2 317.379 4.488 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000512907599 340383610 /nfs/dbraw/zinc/38/36/10/340383610.db2.gz SCELFCCPFVWBTL-LBTNJELSSA-N 1 2 317.379 4.488 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000512907599 340383611 /nfs/dbraw/zinc/38/36/11/340383611.db2.gz SCELFCCPFVWBTL-LBTNJELSSA-N 1 2 317.379 4.488 20 0 DIADLO FC(F)(F)C1CC[NH+](Cc2ncc(-c3cccs3)o2)CC1 ZINC000174184376 340383653 /nfs/dbraw/zinc/38/36/53/340383653.db2.gz OFXFPAKJDQRZHH-UHFFFAOYSA-N 1 2 316.348 4.177 20 0 DIADLO C[C@H](C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1)c1cccnc1 ZINC000174404704 340387645 /nfs/dbraw/zinc/38/76/45/340387645.db2.gz PAJZECBMXBFGEY-AWEZNQCLSA-N 1 2 319.364 4.011 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)s1)c1c(F)cncc1F ZINC000513112205 340393841 /nfs/dbraw/zinc/39/38/41/340393841.db2.gz VGMRIRNZDCOWOF-SSDOTTSWSA-N 1 2 322.302 4.291 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000513154722 340395331 /nfs/dbraw/zinc/39/53/31/340395331.db2.gz QWFFTWKJMDLMDN-LBPRGKRZSA-N 1 2 303.789 4.001 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCOc2cc(O)ccc2C1 ZINC000513154722 340395332 /nfs/dbraw/zinc/39/53/32/340395332.db2.gz QWFFTWKJMDLMDN-LBPRGKRZSA-N 1 2 303.789 4.001 20 0 DIADLO CCC1(NC(=O)c2ccc(C)c(Oc3cc[nH+]cc3)c2)CCC1 ZINC000174909924 340398938 /nfs/dbraw/zinc/39/89/38/340398938.db2.gz OGCNWMIKTJOZCM-UHFFFAOYSA-N 1 2 310.397 4.245 20 0 DIADLO CC[C@@H](CC1CCCC1)C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000513458969 340408714 /nfs/dbraw/zinc/40/87/14/340408714.db2.gz WGGNFLWEIHDXJU-JKSUJKDBSA-N 1 2 303.450 4.070 20 0 DIADLO C(=C\c1[nH+]ccn1Cc1ccccc1)\c1nc2ccccc2o1 ZINC000513502075 340411105 /nfs/dbraw/zinc/41/11/05/340411105.db2.gz YPRNYDNSJILGSY-KHPPLWFESA-N 1 2 301.349 4.243 20 0 DIADLO Cc1cc(N2CCC[C@H](C(C)C)CC2)nc(-c2ccncc2)[nH+]1 ZINC000513735352 340422646 /nfs/dbraw/zinc/42/26/46/340422646.db2.gz MOBKZWPPOIMDPD-INIZCTEOSA-N 1 2 310.445 4.110 20 0 DIADLO CC(=O)c1cc(C[NH+](Cc2ccccc2)Cc2ccccc2)on1 ZINC000516905371 340458518 /nfs/dbraw/zinc/45/85/18/340458518.db2.gz UDHRISGPWQEMEH-UHFFFAOYSA-N 1 2 320.392 4.080 20 0 DIADLO Cc1oc2ccccc2c1CNC(=O)Nc1ccc(C)[nH+]c1C ZINC000185398776 340500756 /nfs/dbraw/zinc/50/07/56/340500756.db2.gz VSYNSGOXEJOFTN-UHFFFAOYSA-N 1 2 309.369 4.075 20 0 DIADLO C[C@H]([NH2+]Cc1cn2ccccc2n1)c1cc(Cl)ccc1Cl ZINC000189466621 340536451 /nfs/dbraw/zinc/53/64/51/340536451.db2.gz WHGXXPDZEJKGHV-NSHDSACASA-N 1 2 320.223 4.492 20 0 DIADLO Cc1cc(N2CC[C@@H](C(F)(F)F)C(C)(C)C2)nc(C2CC2)[nH+]1 ZINC000189590039 340538195 /nfs/dbraw/zinc/53/81/95/340538195.db2.gz AAMKMKOAEIXNPM-GFCCVEGCSA-N 1 2 313.367 4.077 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2cc(OC)ccc2Cl)cs1 ZINC000192182654 340564132 /nfs/dbraw/zinc/56/41/32/340564132.db2.gz WUCGCNIKFFUBOB-JTQLQIEISA-N 1 2 310.850 4.218 20 0 DIADLO Cc1cccn2cc(-c3ccc(N[C@H]4CCOC[C@H]4C)cc3)[nH+]c12 ZINC000195084065 340573875 /nfs/dbraw/zinc/57/38/75/340573875.db2.gz IYYJKOYPFFEIPL-QAPCUYQASA-N 1 2 321.424 4.147 20 0 DIADLO COC[C@H]([NH2+]Cc1ncc(C(C)C)s1)c1ccc(Cl)cc1 ZINC000193276178 340575480 /nfs/dbraw/zinc/57/54/80/340575480.db2.gz XZZYCULRCYKLRT-AWEZNQCLSA-N 1 2 324.877 4.397 20 0 DIADLO Cc1ccccc1N1CC[NH+]([C@@H](C)c2c(F)cccc2F)CC1 ZINC000195662153 340584998 /nfs/dbraw/zinc/58/49/98/340584998.db2.gz RFXWFGXJNRWQEQ-HNNXBMFYSA-N 1 2 316.395 4.156 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1nc(C)cs1)c1ccc(Cl)cc1 ZINC000194019828 340588133 /nfs/dbraw/zinc/58/81/33/340588133.db2.gz QQMYNQYDPBAIMY-BXUZGUMPSA-N 1 2 310.850 4.143 20 0 DIADLO Fc1ccc(CNc2cccc(-n3cc[nH+]c3)c2)c(Cl)c1 ZINC000226650822 340589983 /nfs/dbraw/zinc/58/99/83/340589983.db2.gz COMALBMOZJWPJY-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO Cc1ccc(NC(=O)Cc2cccc(Cl)c2Cl)c(C)[nH+]1 ZINC000194378916 340591851 /nfs/dbraw/zinc/59/18/51/340591851.db2.gz GWDZQHOLJGQXQM-UHFFFAOYSA-N 1 2 309.196 4.186 20 0 DIADLO Cc1cc[nH+]cc1NCc1cc(Br)c(Cl)s1 ZINC000227830924 340603344 /nfs/dbraw/zinc/60/33/44/340603344.db2.gz XFIPWIBGADPTQB-UHFFFAOYSA-N 1 2 317.639 4.480 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1csc(Cl)c1)c1nnc2n1CCCCC2 ZINC000230407785 340619984 /nfs/dbraw/zinc/61/99/84/340619984.db2.gz IEWAQKRLQKQDEU-WDEREUQCSA-N 1 2 324.881 4.131 20 0 DIADLO c1cc2c(nc[nH+]c2Sc2nc(-c3ccccc3)cs2)[nH]1 ZINC000524234213 340650435 /nfs/dbraw/zinc/65/04/35/340650435.db2.gz BCXBJJYLLKEDFX-UHFFFAOYSA-N 1 2 310.407 4.233 20 0 DIADLO Fc1ccc([C@H](NCc2[nH]cc[nH+]2)c2ccccc2Cl)cc1 ZINC000237918356 340675134 /nfs/dbraw/zinc/67/51/34/340675134.db2.gz CHMNLEOWOMTACE-KRWDZBQOSA-N 1 2 315.779 4.081 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nnc2n1CCCCC2)c1ccccc1Cl ZINC000315934015 340677475 /nfs/dbraw/zinc/67/74/75/340677475.db2.gz WEFJSGRVNBZNNV-OLZOCXBDSA-N 1 2 318.852 4.070 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)c1cc(F)c(Cl)cc1Cl ZINC000525106196 340689740 /nfs/dbraw/zinc/68/97/40/340689740.db2.gz HIVMOXJUORIJNH-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1ccc(Br)o1 ZINC000393960742 340706368 /nfs/dbraw/zinc/70/63/68/340706368.db2.gz OPLRBKUOQKESMO-UHFFFAOYSA-N 1 2 318.573 4.124 20 0 DIADLO Cc1ncc(C[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)o1 ZINC000397956369 340715104 /nfs/dbraw/zinc/71/51/04/340715104.db2.gz RWRWFSAEWHUOCM-ZETCQYMHSA-N 1 2 303.164 4.280 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+]Cc1ncccc1Cl ZINC000528432355 340718683 /nfs/dbraw/zinc/71/86/83/340718683.db2.gz HZFQELWUPJSYED-HNNXBMFYSA-N 1 2 304.821 4.375 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncccc1F)c1cc(Cl)ccc1OC ZINC000530418495 340791124 /nfs/dbraw/zinc/79/11/24/340791124.db2.gz UPFJFFOVXSUNAA-CQSZACIVSA-N 1 2 308.784 4.124 20 0 DIADLO C[C@H]([NH2+][C@@H](C(=O)Nc1ccccc1)c1ccccc1)c1ccoc1 ZINC000537985609 340805575 /nfs/dbraw/zinc/80/55/75/340805575.db2.gz CRKMMUMZQVYQKS-HNAYVOBHSA-N 1 2 320.392 4.310 20 0 DIADLO COc1c(Cl)cccc1NCc1cn2cc(Cl)ccc2[nH+]1 ZINC000538824506 340855482 /nfs/dbraw/zinc/85/54/82/340855482.db2.gz OBAPVYNANNKANL-UHFFFAOYSA-N 1 2 322.195 4.262 20 0 DIADLO Cc1cc2[nH+]cn(Cc3nnc(-c4ccccc4)s3)c2cc1C ZINC000127794061 340856483 /nfs/dbraw/zinc/85/64/83/340856483.db2.gz NVCVOJHDDXIKAB-UHFFFAOYSA-N 1 2 320.421 4.220 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1ccccc1OC(F)F ZINC000539245286 340878149 /nfs/dbraw/zinc/87/81/49/340878149.db2.gz DBBCFGXQIBENTO-LLVKDONJSA-N 1 2 318.323 4.280 20 0 DIADLO Fc1ccccc1[C@@H]([NH2+]Cc1nnc(C2CC2)o1)C1CCCC1 ZINC000539327183 340881195 /nfs/dbraw/zinc/88/11/95/340881195.db2.gz VXYAEQGKEXVSPQ-KRWDZBQOSA-N 1 2 315.392 4.107 20 0 DIADLO COc1cc(Cl)c(C[NH+]2CCC(C(F)F)CC2)cc1Cl ZINC000539834802 340904411 /nfs/dbraw/zinc/90/44/11/340904411.db2.gz MQFYBHKYOCNJEJ-UHFFFAOYSA-N 1 2 324.198 4.479 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1cscn1 ZINC000540162548 340919224 /nfs/dbraw/zinc/91/92/24/340919224.db2.gz ADNPIAFLSJDRAG-ZWNOBZJWSA-N 1 2 306.406 4.235 20 0 DIADLO C[C@H]([NH2+][C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1cscn1 ZINC000540162544 340919235 /nfs/dbraw/zinc/91/92/35/340919235.db2.gz ADNPIAFLSJDRAG-GXFFZTMASA-N 1 2 306.406 4.235 20 0 DIADLO CCCOc1cccc2c(NCc3ncccc3F)cc[nH+]c12 ZINC000540956391 340953062 /nfs/dbraw/zinc/95/30/62/340953062.db2.gz FCTGYSQZZVMWIL-UHFFFAOYSA-N 1 2 311.360 4.170 20 0 DIADLO CO[C@@H](C)c1cccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000129445575 340960996 /nfs/dbraw/zinc/96/09/96/340960996.db2.gz WWRGWFQBWSLRSD-KBXCAEBGSA-N 1 2 307.397 4.319 20 0 DIADLO CCCCCOc1cc(C[NH2+][C@H](C)c2ccon2)ccc1OC ZINC000541783070 340984147 /nfs/dbraw/zinc/98/41/47/340984147.db2.gz NHAXKPBFWVNWIS-CQSZACIVSA-N 1 2 318.417 4.103 20 0 DIADLO Cc1nc2[nH]ccc2c(N2CC[C@@H](c3ccccc3)C[C@H]2C)[nH+]1 ZINC000542137835 340996825 /nfs/dbraw/zinc/99/68/25/340996825.db2.gz GJNGJNDUTUYAAG-CZUORRHYSA-N 1 2 306.413 4.039 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)CCCOC(C)C)cc2[nH+]1 ZINC000542222044 341000839 /nfs/dbraw/zinc/00/08/39/341000839.db2.gz ARCLQJYQHXTXMX-UHFFFAOYSA-N 1 2 317.433 4.049 20 0 DIADLO CCc1cnc(C[N@@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)s1 ZINC000542464747 341008269 /nfs/dbraw/zinc/00/82/69/341008269.db2.gz HTGXALUCKFVKLW-CXAGYDPISA-N 1 2 318.511 4.384 20 0 DIADLO CCc1cnc(C[N@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)s1 ZINC000542464747 341008270 /nfs/dbraw/zinc/00/82/70/341008270.db2.gz HTGXALUCKFVKLW-CXAGYDPISA-N 1 2 318.511 4.384 20 0 DIADLO CCc1cnc(C[N@H+](CC)Cc2ccc(Cl)s2)s1 ZINC000542465910 341008462 /nfs/dbraw/zinc/00/84/62/341008462.db2.gz BYGRKTHDJKSVQC-UHFFFAOYSA-N 1 2 300.880 4.443 20 0 DIADLO CCc1cnc(C[N@@H+](CC)Cc2ccc(Cl)s2)s1 ZINC000542465910 341008463 /nfs/dbraw/zinc/00/84/63/341008463.db2.gz BYGRKTHDJKSVQC-UHFFFAOYSA-N 1 2 300.880 4.443 20 0 DIADLO CCOc1cccc2cc([C@H](C)[NH2+][C@H](C)c3ccon3)oc21 ZINC000542698546 341017639 /nfs/dbraw/zinc/01/76/39/341017639.db2.gz WFHJWJQVHFWPAP-NEPJUHHUSA-N 1 2 300.358 4.231 20 0 DIADLO CC[C@H](Nc1cccc([NH+]2CCCCCC2)c1)c1ccn(C)n1 ZINC000542697884 341017738 /nfs/dbraw/zinc/01/77/38/341017738.db2.gz ZHCVCIBXXBSQLX-SFHVURJKSA-N 1 2 312.461 4.364 20 0 DIADLO CCn1cc(C[N@H+](C)Cc2ccc(-c3ccccc3)cc2F)cn1 ZINC000542816175 341021842 /nfs/dbraw/zinc/02/18/42/341021842.db2.gz MPXVMCCRPLBNOH-UHFFFAOYSA-N 1 2 323.415 4.341 20 0 DIADLO CCn1cc(C[N@@H+](C)Cc2ccc(-c3ccccc3)cc2F)cn1 ZINC000542816175 341021843 /nfs/dbraw/zinc/02/18/43/341021843.db2.gz MPXVMCCRPLBNOH-UHFFFAOYSA-N 1 2 323.415 4.341 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](CCCc3ccsc3)CCO2)cc1F ZINC000543030136 341028616 /nfs/dbraw/zinc/02/86/16/341028616.db2.gz KHZOGMUYZUTIKQ-QGZVFWFLSA-N 1 2 323.408 4.032 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](CCCc3ccsc3)CCO2)cc1F ZINC000543030136 341028617 /nfs/dbraw/zinc/02/86/17/341028617.db2.gz KHZOGMUYZUTIKQ-QGZVFWFLSA-N 1 2 323.408 4.032 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@@H+]2Cc3ccccc3[C@@H]2C)cc1F ZINC000543060558 341029917 /nfs/dbraw/zinc/02/99/17/341029917.db2.gz KHDQPSZTBBBRIM-KBPBESRZSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@H+]2Cc3ccccc3[C@@H]2C)cc1F ZINC000543060558 341029918 /nfs/dbraw/zinc/02/99/18/341029918.db2.gz KHDQPSZTBBBRIM-KBPBESRZSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@@H+]2Cc3ccccc3[C@H]2C)c(F)c1 ZINC000543063036 341030186 /nfs/dbraw/zinc/03/01/86/341030186.db2.gz WTCSLLFXKIINES-ZIAGYGMSSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@H+]2Cc3ccccc3[C@H]2C)c(F)c1 ZINC000543063036 341030187 /nfs/dbraw/zinc/03/01/87/341030187.db2.gz WTCSLLFXKIINES-ZIAGYGMSSA-N 1 2 312.388 4.038 20 0 DIADLO CC(C)CC[C@@H]1CCC[N@@H+]1Cc1ncc(Br)s1 ZINC000543079856 341030883 /nfs/dbraw/zinc/03/08/83/341030883.db2.gz RFFVNCWTZJUEQE-NSHDSACASA-N 1 2 317.296 4.306 20 0 DIADLO CC(C)CC[C@@H]1CCC[N@H+]1Cc1ncc(Br)s1 ZINC000543079856 341030884 /nfs/dbraw/zinc/03/08/84/341030884.db2.gz RFFVNCWTZJUEQE-NSHDSACASA-N 1 2 317.296 4.306 20 0 DIADLO CCc1cnc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)s1 ZINC000543236275 341037416 /nfs/dbraw/zinc/03/74/16/341037416.db2.gz FNRUCCJZHACCLD-UHFFFAOYSA-N 1 2 308.397 4.153 20 0 DIADLO COCC[C@H]([NH2+]Cc1c(Cl)cccc1Cl)c1ccco1 ZINC000543458612 341045747 /nfs/dbraw/zinc/04/57/47/341045747.db2.gz HSYJGVUFUKFZME-AWEZNQCLSA-N 1 2 314.212 4.454 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2ccccc2Oc2ccccc2)n1 ZINC000543509601 341048049 /nfs/dbraw/zinc/04/80/49/341048049.db2.gz OWFKTSXJKNYMHE-CYBMUJFWSA-N 1 2 309.369 4.021 20 0 DIADLO COc1ccc2oc([C@H](C)[NH2+][C@@H](C)c3ncc(C)o3)c(C)c2c1 ZINC000543510966 341048100 /nfs/dbraw/zinc/04/81/00/341048100.db2.gz XBHGCAQYRNYHJH-STQMWFEESA-N 1 2 314.385 4.458 20 0 DIADLO CCN(CC)c1ccc(CNC(=O)[C@@H](C)CCC(C)(C)C)c[nH+]1 ZINC000543550218 341048822 /nfs/dbraw/zinc/04/88/22/341048822.db2.gz MUBRUKYKFRWNAJ-HNNXBMFYSA-N 1 2 319.493 4.006 20 0 DIADLO Cc1cc(F)ccc1-c1ccc(C[NH2+][C@H](C)c2ccon2)o1 ZINC000543635927 341052421 /nfs/dbraw/zinc/05/24/21/341052421.db2.gz PFXWRGRDQQUDQI-GFCCVEGCSA-N 1 2 300.333 4.233 20 0 DIADLO CC[N@H+](Cc1cn2c(cccc2C)n1)Cc1ccccc1Cl ZINC000071951711 341055581 /nfs/dbraw/zinc/05/55/81/341055581.db2.gz RVQBWISXSLQQSC-UHFFFAOYSA-N 1 2 313.832 4.318 20 0 DIADLO CC[N@@H+](Cc1cn2c(cccc2C)n1)Cc1ccccc1Cl ZINC000071951711 341055582 /nfs/dbraw/zinc/05/55/82/341055582.db2.gz RVQBWISXSLQQSC-UHFFFAOYSA-N 1 2 313.832 4.318 20 0 DIADLO Cc1nnc(C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2)s1 ZINC000543739618 341055946 /nfs/dbraw/zinc/05/59/46/341055946.db2.gz HDOMPPBPDWDHGO-SSDOTTSWSA-N 1 2 302.230 4.004 20 0 DIADLO CCc1nc(C[N@H+]2[C@H](C)c3ccc(OC)cc3C[C@@H]2C)cs1 ZINC000543781090 341058340 /nfs/dbraw/zinc/05/83/40/341058340.db2.gz MVFKXTGUNJAAFE-QWHCGFSZSA-N 1 2 316.470 4.222 20 0 DIADLO CCc1nc(C[N@@H+]2[C@H](C)c3ccc(OC)cc3C[C@@H]2C)cs1 ZINC000543781090 341058341 /nfs/dbraw/zinc/05/83/41/341058341.db2.gz MVFKXTGUNJAAFE-QWHCGFSZSA-N 1 2 316.470 4.222 20 0 DIADLO FC(F)(F)c1nn(CCCc2ccsc2)c2cc[nH+]cc21 ZINC000543946151 341064003 /nfs/dbraw/zinc/06/40/03/341064003.db2.gz GWQCGLWGZOCXBP-UHFFFAOYSA-N 1 2 311.332 4.144 20 0 DIADLO O=C(CC1CCCCCC1)NCc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000544054037 341068271 /nfs/dbraw/zinc/06/82/71/341068271.db2.gz BVYHYDMNUZNBCN-UHFFFAOYSA-N 1 2 311.429 4.053 20 0 DIADLO CC[C@H](Cc1nc(Cc2ccc(C)[nH+]c2)no1)c1ccc(C)cc1 ZINC000544134501 341071598 /nfs/dbraw/zinc/07/15/98/341071598.db2.gz XAWDVKJOAQTFEA-QGZVFWFLSA-N 1 2 321.424 4.409 20 0 DIADLO Fc1cc2[nH+]cn(Cc3ccccc3Br)c2cc1F ZINC000131326026 341076341 /nfs/dbraw/zinc/07/63/41/341076341.db2.gz YQARSGKHVXCPPO-UHFFFAOYSA-N 1 2 323.140 4.125 20 0 DIADLO CC(C)C[C@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1cccs1 ZINC000544448155 341082533 /nfs/dbraw/zinc/08/25/33/341082533.db2.gz BCEBKSNWRLVCQM-YPMHNXCESA-N 1 2 305.447 4.447 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](CC(C)C)c2cccs2)no1 ZINC000544451247 341082810 /nfs/dbraw/zinc/08/28/10/341082810.db2.gz CKGSOTQRWHPCSE-CYBMUJFWSA-N 1 2 307.463 4.351 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]Cc2csc(C3CCCC3)n2)cn1 ZINC000544467792 341083327 /nfs/dbraw/zinc/08/33/27/341083327.db2.gz KZMAYXXNVUKHQU-ZDUSSCGKSA-N 1 2 318.490 4.429 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]Cc2cc(-c3cccs3)on2)cn1 ZINC000544467762 341083359 /nfs/dbraw/zinc/08/33/59/341083359.db2.gz DCDRFNUTFKGJPZ-LBPRGKRZSA-N 1 2 316.430 4.031 20 0 DIADLO CCOc1cccc2cc([C@@H](C)[NH2+]Cc3ncc(CC)o3)oc21 ZINC000544480691 341083991 /nfs/dbraw/zinc/08/39/91/341083991.db2.gz AGWASHVVRWIFIB-GFCCVEGCSA-N 1 2 314.385 4.233 20 0 DIADLO CC[N@H+](Cc1nc(C(F)(F)F)cs1)Cc1cccc(F)c1 ZINC000131395787 341084240 /nfs/dbraw/zinc/08/42/40/341084240.db2.gz OWMHUCXUOPYGCI-UHFFFAOYSA-N 1 2 318.339 4.323 20 0 DIADLO CC[N@@H+](Cc1nc(C(F)(F)F)cs1)Cc1cccc(F)c1 ZINC000131395787 341084241 /nfs/dbraw/zinc/08/42/41/341084241.db2.gz OWMHUCXUOPYGCI-UHFFFAOYSA-N 1 2 318.339 4.323 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2ccc(Cl)cc21)c1nc(C(C)(C)C)no1 ZINC000544511169 341084600 /nfs/dbraw/zinc/08/46/00/341084600.db2.gz UYNJDJMYCULASX-HZMBPMFUSA-N 1 2 319.836 4.359 20 0 DIADLO COc1ccc2oc([C@@H](C)[NH2+][C@H](C)c3ccon3)c(C)c2c1 ZINC000544605074 341088348 /nfs/dbraw/zinc/08/83/48/341088348.db2.gz XVSLBCWCSSIVAD-VXGBXAGGSA-N 1 2 300.358 4.150 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(OCc2ccccc2)c1)c1ccon1 ZINC000544617287 341089549 /nfs/dbraw/zinc/08/95/49/341089549.db2.gz MIJHIYOJUMGESE-OAHLLOKOSA-N 1 2 308.381 4.104 20 0 DIADLO CCCc1noc(C[N@H+](C2CC2)[C@@H]2CCCc3ccccc32)n1 ZINC000072580370 341092213 /nfs/dbraw/zinc/09/22/13/341092213.db2.gz CXCBCKZQAIWACX-QGZVFWFLSA-N 1 2 311.429 4.064 20 0 DIADLO CCCc1noc(C[N@@H+](C2CC2)[C@@H]2CCCc3ccccc32)n1 ZINC000072580370 341092214 /nfs/dbraw/zinc/09/22/14/341092214.db2.gz CXCBCKZQAIWACX-QGZVFWFLSA-N 1 2 311.429 4.064 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2c(C)cccc2C)n1 ZINC000544895645 341097812 /nfs/dbraw/zinc/09/78/12/341097812.db2.gz KAZWWJBOGMJYPP-HUUCEWRRSA-N 1 2 301.434 4.441 20 0 DIADLO CC[C@](C)([NH2+]Cc1ncc(-c2ccccc2)o1)c1nccs1 ZINC000072684404 341098070 /nfs/dbraw/zinc/09/80/70/341098070.db2.gz BTNZNHZGMNSMHC-KRWDZBQOSA-N 1 2 313.426 4.213 20 0 DIADLO Cc1cccc(C)c1[C@H](C)[NH2+]Cc1nc(Cc2ccccc2)no1 ZINC000544899055 341098373 /nfs/dbraw/zinc/09/83/73/341098373.db2.gz VVDKUPMSULHYJX-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1nc(Cc2ccccc2)no1 ZINC000544899057 341098382 /nfs/dbraw/zinc/09/83/82/341098382.db2.gz VVDKUPMSULHYJX-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO CCc1nn(C)c(CC)c1C[N@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000131604143 341101250 /nfs/dbraw/zinc/10/12/50/341101250.db2.gz DKHBFCPCBUQONG-LBPRGKRZSA-N 1 2 321.415 4.016 20 0 DIADLO CCc1nn(C)c(CC)c1C[N@@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000131604143 341101251 /nfs/dbraw/zinc/10/12/51/341101251.db2.gz DKHBFCPCBUQONG-LBPRGKRZSA-N 1 2 321.415 4.016 20 0 DIADLO C[C@H](C(=O)Nc1c[nH+]ccc1OC(C)(C)C)c1cccs1 ZINC000131735862 341110273 /nfs/dbraw/zinc/11/02/73/341110273.db2.gz OFKBWMWKHZRVKY-NSHDSACASA-N 1 2 304.415 4.063 20 0 DIADLO CCSc1cc(Cl)ccc1C(=O)Nc1cc(C)[nH+]cc1C ZINC000545184766 341112109 /nfs/dbraw/zinc/11/21/09/341112109.db2.gz SRNJSBSSODAWDX-UHFFFAOYSA-N 1 2 320.845 4.138 20 0 DIADLO CC[N@H+](Cc1ccccc1)[C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000132057428 341115653 /nfs/dbraw/zinc/11/56/53/341115653.db2.gz OSNDFZYUDOMJOR-INIZCTEOSA-N 1 2 321.424 4.244 20 0 DIADLO CC[N@@H+](Cc1ccccc1)[C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000132057428 341115654 /nfs/dbraw/zinc/11/56/54/341115654.db2.gz OSNDFZYUDOMJOR-INIZCTEOSA-N 1 2 321.424 4.244 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)[C@H](C)c1nc(C(C)C)no1 ZINC000132167607 341117710 /nfs/dbraw/zinc/11/77/10/341117710.db2.gz YRJPKCRARIKZIJ-SNVBAGLBSA-N 1 2 313.854 4.491 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)[C@H](C)c1nc(C(C)C)no1 ZINC000132167607 341117711 /nfs/dbraw/zinc/11/77/11/341117711.db2.gz YRJPKCRARIKZIJ-SNVBAGLBSA-N 1 2 313.854 4.491 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCC[N@@H+]2Cc2ccon2)c1 ZINC000545267757 341118312 /nfs/dbraw/zinc/11/83/12/341118312.db2.gz ABPZCDIKEIJPGA-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCC[N@H+]2Cc2ccon2)c1 ZINC000545267757 341118313 /nfs/dbraw/zinc/11/83/13/341118313.db2.gz ABPZCDIKEIJPGA-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO CC[C@@H](C)c1ccc([C@H]([NH2+]Cc2nc(C)no2)C(C)C)cc1 ZINC000073644380 341119486 /nfs/dbraw/zinc/11/94/86/341119486.db2.gz ZEZWKEXSMYBUHS-FZKQIMNGSA-N 1 2 301.434 4.378 20 0 DIADLO Cc1ccccc1-c1nc(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)no1 ZINC000132362825 341121309 /nfs/dbraw/zinc/12/13/09/341121309.db2.gz LLWADSPMJWGRSD-HNAYVOBHSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccccc1-c1nc(C[N@@H+]2C[C@H](C)[C@@H]2c2ccccc2)no1 ZINC000132362825 341121310 /nfs/dbraw/zinc/12/13/10/341121310.db2.gz LLWADSPMJWGRSD-HNAYVOBHSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2)c(C)[nH+]1 ZINC000132534146 341126384 /nfs/dbraw/zinc/12/63/84/341126384.db2.gz QTYWPILMIOVSRI-CVEARBPZSA-N 1 2 314.816 4.402 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2)c(C)[nH+]1 ZINC000132533960 341126438 /nfs/dbraw/zinc/12/64/38/341126438.db2.gz QTYWPILMIOVSRI-HZPDHXFCSA-N 1 2 314.816 4.402 20 0 DIADLO CC[C@@H](CC(F)(F)F)Nc1nc(C)[nH+]c2ccc(OC)cc21 ZINC000545469260 341126648 /nfs/dbraw/zinc/12/66/48/341126648.db2.gz MCJFRCIZBXOYTH-JTQLQIEISA-N 1 2 313.323 4.090 20 0 DIADLO c1ccc(COc2ccc[nH+]c2N[C@@H]2CCC[C@H]3OCC[C@H]32)cc1 ZINC000545474389 341126658 /nfs/dbraw/zinc/12/66/58/341126658.db2.gz WFTYVVMCVLBJNG-RCCFBDPRSA-N 1 2 324.424 4.030 20 0 DIADLO c1ccc2[nH+]c(CCc3nc(CCC4CCCCC4)no3)[nH]c2c1 ZINC000545636678 341134338 /nfs/dbraw/zinc/13/43/38/341134338.db2.gz PELFTASYSFQDIH-UHFFFAOYSA-N 1 2 324.428 4.244 20 0 DIADLO Cc1ccc(Cc2noc([C@]3(C)CCCc4ccccc43)n2)c[nH+]1 ZINC000545638421 341134441 /nfs/dbraw/zinc/13/44/41/341134441.db2.gz MZHZUGDUMWTNSZ-HXUWFJFHSA-N 1 2 319.408 4.006 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@H](Oc3ccccc3Cl)C2)cs1 ZINC000132962808 341150834 /nfs/dbraw/zinc/15/08/34/341150834.db2.gz OPCQVJJOSDHOGU-AWEZNQCLSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@H](Oc3ccccc3Cl)C2)cs1 ZINC000132962808 341150835 /nfs/dbraw/zinc/15/08/35/341150835.db2.gz OPCQVJJOSDHOGU-AWEZNQCLSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1cc(OCc2nc(C3CCCC3)no2)c2cccc(C)c2[nH+]1 ZINC000546181033 341156366 /nfs/dbraw/zinc/15/63/66/341156366.db2.gz IKTGCZFXRXHZOP-UHFFFAOYSA-N 1 2 323.396 4.471 20 0 DIADLO Cc1ccsc1-c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000546280294 341160944 /nfs/dbraw/zinc/16/09/44/341160944.db2.gz TYCHCOVXEHKWRB-UHFFFAOYSA-N 1 2 322.393 4.018 20 0 DIADLO C[C@@H]1CC/C(=C/c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)C1 ZINC000546284913 341161118 /nfs/dbraw/zinc/16/11/18/341161118.db2.gz NQVVURCYYZWXPA-ADVGAGMGSA-N 1 2 320.396 4.185 20 0 DIADLO CCc1ccc(C(C)(C)c2nc(Cc3ccc(C)[nH+]c3)no2)cc1 ZINC000546342097 341164194 /nfs/dbraw/zinc/16/41/94/341164194.db2.gz YJJVOBUWGCTKSF-UHFFFAOYSA-N 1 2 321.424 4.252 20 0 DIADLO Cc1ccc(Cc2noc(CC/C=C\c3ccccc3)n2)c[nH+]1 ZINC000546341922 341164263 /nfs/dbraw/zinc/16/42/63/341164263.db2.gz SSLWEFFVBHEHOY-UITAMQMPSA-N 1 2 305.381 4.010 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc([C@H]2CCCC[C@@H]2C)no1 ZINC000546397756 341166570 /nfs/dbraw/zinc/16/65/70/341166570.db2.gz KKEYWMKMFAFUCJ-JSGCOSHPSA-N 1 2 310.401 4.070 20 0 DIADLO Cc1ccc(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)c(F)c1 ZINC000546403011 341166887 /nfs/dbraw/zinc/16/68/87/341166887.db2.gz ZVZZDZZPFHBYCF-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Cc1ccc(C(=O)N2C[C@@H](C)CC[C@@H]2C)cc1Oc1cc[nH+]cc1 ZINC000075285104 341173818 /nfs/dbraw/zinc/17/38/18/341173818.db2.gz BMIJKDMNSIUYRC-HOCLYGCPSA-N 1 2 324.424 4.443 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000133512123 341177036 /nfs/dbraw/zinc/17/70/36/341177036.db2.gz GJUDLQXOVFSRHZ-NSHDSACASA-N 1 2 322.449 4.439 20 0 DIADLO Cc1ccc([NH2+]CC2CCOCC2)c(OCc2ccccc2)c1 ZINC000546886064 341185415 /nfs/dbraw/zinc/18/54/15/341185415.db2.gz GWFPFINGOAISTF-UHFFFAOYSA-N 1 2 311.425 4.413 20 0 DIADLO Cc1cc(C)cc(/C=C/c2nc(Cc3ccc(C)[nH+]c3)no2)c1 ZINC000547046970 341193510 /nfs/dbraw/zinc/19/35/10/341193510.db2.gz COVNIDOHZYWJQI-VOTSOKGWSA-N 1 2 305.381 4.151 20 0 DIADLO Cc1ccc(Cc2noc(-c3cccc(Cl)c3Cl)n2)c[nH+]1 ZINC000547049082 341193597 /nfs/dbraw/zinc/19/35/97/341193597.db2.gz XIAQJYQYCZQWHF-UHFFFAOYSA-N 1 2 320.179 4.338 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc([C@H]2CCC[C@H](C)C2)no1 ZINC000547061009 341194133 /nfs/dbraw/zinc/19/41/33/341194133.db2.gz WBQHBGSQVSURDG-JSGCOSHPSA-N 1 2 310.401 4.070 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3CC34CCCC4)n2)c(N2CCCC2)[nH+]1 ZINC000547079187 341194852 /nfs/dbraw/zinc/19/48/52/341194852.db2.gz RHHQLLSIWPYOPQ-HNNXBMFYSA-N 1 2 324.428 4.088 20 0 DIADLO Cc1cc(C)cc(-c2noc(CCc3[nH]c4ccccc4[nH+]3)n2)c1 ZINC000547100978 341195815 /nfs/dbraw/zinc/19/58/15/341195815.db2.gz GIXHBOAAIJIUDM-UHFFFAOYSA-N 1 2 318.380 4.015 20 0 DIADLO Cc1ccc(C)c(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)c1 ZINC000547104361 341196032 /nfs/dbraw/zinc/19/60/32/341196032.db2.gz RFLMJFRWYTYXHY-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Cc1cc(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)ccc1F ZINC000547111284 341196410 /nfs/dbraw/zinc/19/64/10/341196410.db2.gz MPSDLCQYUFMMAX-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc(-c3cccc(C)c3)no2)s1 ZINC000076342194 341205781 /nfs/dbraw/zinc/20/57/81/341205781.db2.gz RINCKOXPDUIBGN-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc(-c3cccc(C)c3)no2)s1 ZINC000076342194 341205782 /nfs/dbraw/zinc/20/57/82/341205782.db2.gz RINCKOXPDUIBGN-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO CCCCC[N@H+](Cc1nnc(CC)o1)Cc1ccc(Cl)cc1 ZINC000076394330 341206578 /nfs/dbraw/zinc/20/65/78/341206578.db2.gz FFQXVPZTSQZGBW-UHFFFAOYSA-N 1 2 321.852 4.478 20 0 DIADLO CCCCC[N@@H+](Cc1nnc(CC)o1)Cc1ccc(Cl)cc1 ZINC000076394330 341206579 /nfs/dbraw/zinc/20/65/79/341206579.db2.gz FFQXVPZTSQZGBW-UHFFFAOYSA-N 1 2 321.852 4.478 20 0 DIADLO c1coc(C[NH2+]Cc2nc3c(s2)C[C@H](c2ccccc2)CC3)c1 ZINC000547341876 341207406 /nfs/dbraw/zinc/20/74/06/341207406.db2.gz UCUVMSXKDPPGQU-OAHLLOKOSA-N 1 2 324.449 4.298 20 0 DIADLO CCc1cnc(C[NH+]2CCC(=Cc3ccc(F)c(F)c3)CC2)o1 ZINC000547397815 341211064 /nfs/dbraw/zinc/21/10/64/341211064.db2.gz XDHZBSVCALQZOD-UHFFFAOYSA-N 1 2 318.367 4.195 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1cnc(C2CC2)s1)c1ccco1 ZINC000134264154 341211346 /nfs/dbraw/zinc/21/13/46/341211346.db2.gz JTSRSMDQVBMIKQ-HNNXBMFYSA-N 1 2 320.458 4.117 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2nc3ccccc3[nH]2)[C@H]1c1ccccc1 ZINC000547506282 341218743 /nfs/dbraw/zinc/21/87/43/341218743.db2.gz UEXMEDCQSRIYBJ-AUUYWEPGSA-N 1 2 323.465 4.242 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2nc3ccccc3[nH]2)[C@H]1c1ccccc1 ZINC000547506282 341218744 /nfs/dbraw/zinc/21/87/44/341218744.db2.gz UEXMEDCQSRIYBJ-AUUYWEPGSA-N 1 2 323.465 4.242 20 0 DIADLO Cc1[nH]c2ccccc2c1C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000134807841 341224456 /nfs/dbraw/zinc/22/44/56/341224456.db2.gz WCDXDXNDZZGHSS-UHFFFAOYSA-N 1 2 316.364 4.119 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2csc(C3CC3)n2)cc1 ZINC000134874742 341225660 /nfs/dbraw/zinc/22/56/60/341225660.db2.gz CCIXMXGUCVXYAD-MRXNPFEDSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2csc(C3CC3)n2)cc1 ZINC000134874742 341225661 /nfs/dbraw/zinc/22/56/61/341225661.db2.gz CCIXMXGUCVXYAD-MRXNPFEDSA-N 1 2 302.418 4.497 20 0 DIADLO c1csc(C[NH+](Cc2cccs2)Cc2nccs2)c1 ZINC000134948626 341227123 /nfs/dbraw/zinc/22/71/23/341227123.db2.gz ACYDEFHFFSILRC-UHFFFAOYSA-N 1 2 306.481 4.469 20 0 DIADLO CC[C@]1(C)COCC[N@@H+]1Cc1csc(-c2ccc(C)cc2)n1 ZINC000547849027 341237540 /nfs/dbraw/zinc/23/75/40/341237540.db2.gz WLPPKUNWGQHQJR-GOSISDBHSA-N 1 2 316.470 4.119 20 0 DIADLO CC[C@]1(C)COCC[N@H+]1Cc1csc(-c2ccc(C)cc2)n1 ZINC000547849027 341237541 /nfs/dbraw/zinc/23/75/41/341237541.db2.gz WLPPKUNWGQHQJR-GOSISDBHSA-N 1 2 316.470 4.119 20 0 DIADLO Clc1snnc1C[N@@H+]1CCC[C@H]1CCCc1ccccc1 ZINC000135360990 341238069 /nfs/dbraw/zinc/23/80/69/341238069.db2.gz PPCFRRTXVCGNOJ-CQSZACIVSA-N 1 2 321.877 4.179 20 0 DIADLO Clc1snnc1C[N@H+]1CCC[C@H]1CCCc1ccccc1 ZINC000135360990 341238070 /nfs/dbraw/zinc/23/80/70/341238070.db2.gz PPCFRRTXVCGNOJ-CQSZACIVSA-N 1 2 321.877 4.179 20 0 DIADLO Cc1cc(C)c(NC(=O)c2coc(C3CCCCC3)n2)c(C)[nH+]1 ZINC000547944035 341239924 /nfs/dbraw/zinc/23/99/24/341239924.db2.gz UNHJGYJXBNZJCL-UHFFFAOYSA-N 1 2 313.401 4.295 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000547973588 341241373 /nfs/dbraw/zinc/24/13/73/341241373.db2.gz FPQBFNQMCBZDEL-KZULUSFZSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000547973588 341241374 /nfs/dbraw/zinc/24/13/74/341241374.db2.gz FPQBFNQMCBZDEL-KZULUSFZSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000547972526 341241446 /nfs/dbraw/zinc/24/14/46/341241446.db2.gz KDYFSRMRUJXUKE-XIKOKIGWSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000547972526 341241447 /nfs/dbraw/zinc/24/14/47/341241447.db2.gz KDYFSRMRUJXUKE-XIKOKIGWSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+]1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000548425633 341260089 /nfs/dbraw/zinc/26/00/89/341260089.db2.gz WDBOLFJIYWOMHD-XHBSWPGZSA-N 1 2 324.262 4.009 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+]1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000548425633 341260090 /nfs/dbraw/zinc/26/00/90/341260090.db2.gz WDBOLFJIYWOMHD-XHBSWPGZSA-N 1 2 324.262 4.009 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)C[N@H+]2[C@H](C)C[C@@H]2C)cc1 ZINC000548425507 341260130 /nfs/dbraw/zinc/26/01/30/341260130.db2.gz NMPSKVFJOFSAEU-IYBDPMFKSA-N 1 2 324.424 4.209 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)C[N@@H+]2[C@H](C)C[C@@H]2C)cc1 ZINC000548425507 341260131 /nfs/dbraw/zinc/26/01/31/341260131.db2.gz NMPSKVFJOFSAEU-IYBDPMFKSA-N 1 2 324.424 4.209 20 0 DIADLO Cc1cncc(NC(=O)c2ccc(C)c(Oc3cc[nH+]cc3)c2)c1 ZINC000079711091 341264174 /nfs/dbraw/zinc/26/41/74/341264174.db2.gz HQPXFNORSWBSFH-UHFFFAOYSA-N 1 2 319.364 4.138 20 0 DIADLO Cc1cccc(NC(=O)C[N@@H+](C)Cc2cc3ccccc3o2)c1C ZINC000080061075 341269086 /nfs/dbraw/zinc/26/90/86/341269086.db2.gz NVEHIYOVWQHPDN-UHFFFAOYSA-N 1 2 322.408 4.120 20 0 DIADLO Cc1cccc(NC(=O)C[N@H+](C)Cc2cc3ccccc3o2)c1C ZINC000080061075 341269087 /nfs/dbraw/zinc/26/90/87/341269087.db2.gz NVEHIYOVWQHPDN-UHFFFAOYSA-N 1 2 322.408 4.120 20 0 DIADLO CC(=O)c1ccc(OCc2ccc(C(C)C)[nH+]c2C)c(F)c1 ZINC000549033580 341284068 /nfs/dbraw/zinc/28/40/68/341284068.db2.gz YAZXWCKQUHNIHJ-UHFFFAOYSA-N 1 2 301.361 4.434 20 0 DIADLO C[C@]1(C(=O)Nc2ccc3c(c2)[nH+]c2n3CCCCC2)C[C@H]2C[C@H]2C1 ZINC000549137893 341286679 /nfs/dbraw/zinc/28/66/79/341286679.db2.gz CGWAMACIHITOGT-IKDJWVMYSA-N 1 2 323.440 4.137 20 0 DIADLO C[C@H]1C[N@H+](Cc2nccn2Cc2ccccc2)[C@H]1c1ccccc1 ZINC000245435874 341293859 /nfs/dbraw/zinc/29/38/59/341293859.db2.gz QQYRLQXCUXUZPU-LAUBAEHRSA-N 1 2 317.436 4.124 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nccn2Cc2ccccc2)[C@H]1c1ccccc1 ZINC000245435874 341293860 /nfs/dbraw/zinc/29/38/60/341293860.db2.gz QQYRLQXCUXUZPU-LAUBAEHRSA-N 1 2 317.436 4.124 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000245465597 341295611 /nfs/dbraw/zinc/29/56/11/341295611.db2.gz ITAOGFYQBHZTPA-WDEREUQCSA-N 1 2 304.356 4.307 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000245465597 341295612 /nfs/dbraw/zinc/29/56/12/341295612.db2.gz ITAOGFYQBHZTPA-WDEREUQCSA-N 1 2 304.356 4.307 20 0 DIADLO O=C(C/C=C/c1ccc(F)cc1)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000081661316 341301369 /nfs/dbraw/zinc/30/13/69/341301369.db2.gz SFONEXIZCNBKEH-HNQUOIGGSA-N 1 2 321.355 4.258 20 0 DIADLO Cc1nc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)sc1C ZINC000081672450 341301665 /nfs/dbraw/zinc/30/16/65/341301665.db2.gz WXCIVJVKTGKIOC-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1nc(C[N@H+]2CCSC[C@@H]2c2ccccc2)sc1C ZINC000081672450 341301666 /nfs/dbraw/zinc/30/16/66/341301666.db2.gz WXCIVJVKTGKIOC-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1nc(C[N@@H+]2CCSC[C@H]2c2ccccc2)sc1C ZINC000081672455 341301748 /nfs/dbraw/zinc/30/17/48/341301748.db2.gz WXCIVJVKTGKIOC-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1nc(C[N@H+]2CCSC[C@H]2c2ccccc2)sc1C ZINC000081672455 341301749 /nfs/dbraw/zinc/30/17/49/341301749.db2.gz WXCIVJVKTGKIOC-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO CC(F)(F)C[NH2+][C@@H]1CCCc2c(Br)cccc21 ZINC000550860235 341324822 /nfs/dbraw/zinc/32/48/22/341324822.db2.gz GSVREQPPFHTFMG-GFCCVEGCSA-N 1 2 304.178 4.071 20 0 DIADLO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+]1CCC[C@H]1CF ZINC000550008282 341308682 /nfs/dbraw/zinc/30/86/82/341308682.db2.gz MRVKGDOWLXCQEX-RISCZKNCSA-N 1 2 308.784 4.490 20 0 DIADLO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1CCC[C@H]1CF ZINC000550008282 341308683 /nfs/dbraw/zinc/30/86/83/341308683.db2.gz MRVKGDOWLXCQEX-RISCZKNCSA-N 1 2 308.784 4.490 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1cc(F)ccc1Cl ZINC000550644752 341320309 /nfs/dbraw/zinc/32/03/09/341320309.db2.gz NTQYYRKYIPIVKU-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccnc(O[C@@H](C)CC(C)C)c2)no1 ZINC000550887754 341325726 /nfs/dbraw/zinc/32/57/26/341325726.db2.gz RXWGWEJOAGGEEJ-ZFWWWQNUSA-N 1 2 317.433 4.042 20 0 DIADLO Cc1ccc(Cc2noc(-c3cc(F)c4ccccc4c3)n2)c[nH+]1 ZINC000550982453 341328298 /nfs/dbraw/zinc/32/82/98/341328298.db2.gz MKVOHGFYOOJJIB-UHFFFAOYSA-N 1 2 319.339 4.323 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1ccc(Cl)cc1 ZINC000551011917 341329043 /nfs/dbraw/zinc/32/90/43/341329043.db2.gz HGPOAJFHJMWOGB-KBXCAEBGSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1ccc(Cl)cc1 ZINC000551011917 341329044 /nfs/dbraw/zinc/32/90/44/341329044.db2.gz HGPOAJFHJMWOGB-KBXCAEBGSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1ccc(Cl)cc1 ZINC000551011919 341329171 /nfs/dbraw/zinc/32/91/71/341329171.db2.gz HGPOAJFHJMWOGB-KSSFIOAISA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1ccc(Cl)cc1 ZINC000551011919 341329172 /nfs/dbraw/zinc/32/91/72/341329172.db2.gz HGPOAJFHJMWOGB-KSSFIOAISA-N 1 2 301.817 4.302 20 0 DIADLO FCCCCCOc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000551360525 341339456 /nfs/dbraw/zinc/33/94/56/341339456.db2.gz UOEVPGFDRJZDLB-UHFFFAOYSA-N 1 2 302.393 4.405 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)cn1 ZINC000551560576 341345438 /nfs/dbraw/zinc/34/54/38/341345438.db2.gz ZICPQXQNEIHACU-INIZCTEOSA-N 1 2 315.848 4.375 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)cn1 ZINC000551560576 341345439 /nfs/dbraw/zinc/34/54/39/341345439.db2.gz ZICPQXQNEIHACU-INIZCTEOSA-N 1 2 315.848 4.375 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cc(C)cc4cccnc43)cn2c1 ZINC000551588046 341346653 /nfs/dbraw/zinc/34/66/53/341346653.db2.gz OKJOFQKNFMSTCW-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO C[C@H]1c2c(F)cccc2CC[N@H+]1Cc1ccc(C(F)(F)F)cn1 ZINC000551699660 341349273 /nfs/dbraw/zinc/34/92/73/341349273.db2.gz LFOICFJARWLOAS-NSHDSACASA-N 1 2 324.321 4.359 20 0 DIADLO C[C@H]1c2c(F)cccc2CC[N@@H+]1Cc1ccc(C(F)(F)F)cn1 ZINC000551699660 341349274 /nfs/dbraw/zinc/34/92/74/341349274.db2.gz LFOICFJARWLOAS-NSHDSACASA-N 1 2 324.321 4.359 20 0 DIADLO Cc1ccc(-c2cc(C[N@@H+]3CCCC[C@@H]3c3cc[nH]n3)on2)cc1 ZINC000551980717 341356744 /nfs/dbraw/zinc/35/67/44/341356744.db2.gz LVMRQEMFYUCUBW-LJQANCHMSA-N 1 2 322.412 4.100 20 0 DIADLO Cc1ccc(-c2cc(C[N@H+]3CCCC[C@@H]3c3cc[nH]n3)on2)cc1 ZINC000551980717 341356745 /nfs/dbraw/zinc/35/67/45/341356745.db2.gz LVMRQEMFYUCUBW-LJQANCHMSA-N 1 2 322.412 4.100 20 0 DIADLO CC[N@H+](Cc1csnn1)C(c1ccccc1)c1ccccc1 ZINC000551985397 341357173 /nfs/dbraw/zinc/35/71/73/341357173.db2.gz CUGQSHDETLMOFA-UHFFFAOYSA-N 1 2 309.438 4.150 20 0 DIADLO CC[N@@H+](Cc1csnn1)C(c1ccccc1)c1ccccc1 ZINC000551985397 341357174 /nfs/dbraw/zinc/35/71/74/341357174.db2.gz CUGQSHDETLMOFA-UHFFFAOYSA-N 1 2 309.438 4.150 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CC2(CCC2)Oc2ccccc21)c1cscn1 ZINC000552002268 341359020 /nfs/dbraw/zinc/35/90/20/341359020.db2.gz XVQDQQXWLAILOK-TZMCWYRMSA-N 1 2 300.427 4.240 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247311027 341363236 /nfs/dbraw/zinc/36/32/36/341363236.db2.gz IHIQRBSIYYUTDS-IAQYHMDHSA-N 1 2 309.381 4.161 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247311027 341363237 /nfs/dbraw/zinc/36/32/37/341363237.db2.gz IHIQRBSIYYUTDS-IAQYHMDHSA-N 1 2 309.381 4.161 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](Cc2ccncc2Cl)[C@@H](C)CO1 ZINC000247506557 341366083 /nfs/dbraw/zinc/36/60/83/341366083.db2.gz MDNXYYIZPUUAMI-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2ccncc2Cl)[C@@H](C)CO1 ZINC000247506557 341366084 /nfs/dbraw/zinc/36/60/84/341366084.db2.gz MDNXYYIZPUUAMI-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO CC1(C)C[N@H+](Cc2cc3ccc(F)cc3[nH]2)[C@@H]1c1ccncc1 ZINC000552068966 341367207 /nfs/dbraw/zinc/36/72/07/341367207.db2.gz XBTZEYTTZTZHIK-GOSISDBHSA-N 1 2 309.388 4.285 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc3ccc(F)cc3[nH]2)[C@@H]1c1ccncc1 ZINC000552068966 341367208 /nfs/dbraw/zinc/36/72/08/341367208.db2.gz XBTZEYTTZTZHIK-GOSISDBHSA-N 1 2 309.388 4.285 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+](C)Cc1cc(C)ccc1F ZINC000552153615 341374021 /nfs/dbraw/zinc/37/40/21/341374021.db2.gz NSPZRGLGWGVLJK-UHFFFAOYSA-N 1 2 311.404 4.136 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+](C)Cc1cc(C)ccc1F ZINC000552153615 341374022 /nfs/dbraw/zinc/37/40/22/341374022.db2.gz NSPZRGLGWGVLJK-UHFFFAOYSA-N 1 2 311.404 4.136 20 0 DIADLO Cc1nc([C@H]([NH2+]C[C@H]2CCCC[C@H]2C)c2ccccc2F)no1 ZINC000248469128 341378424 /nfs/dbraw/zinc/37/84/24/341378424.db2.gz UNYMSORFDOQCQC-SUYBPPKGSA-N 1 2 317.408 4.022 20 0 DIADLO CCc1ccc([C@H]2CCC[N@@H+](Cc3nnsc3Cl)C2)cc1 ZINC000552215586 341378831 /nfs/dbraw/zinc/37/88/31/341378831.db2.gz ZAMDGVNILNYTOG-AWEZNQCLSA-N 1 2 321.877 4.134 20 0 DIADLO CCc1ccc([C@H]2CCC[N@H+](Cc3nnsc3Cl)C2)cc1 ZINC000552215586 341378830 /nfs/dbraw/zinc/37/88/30/341378830.db2.gz ZAMDGVNILNYTOG-AWEZNQCLSA-N 1 2 321.877 4.134 20 0 DIADLO COc1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)c(Cl)c1 ZINC000552278736 341383486 /nfs/dbraw/zinc/38/34/86/341383486.db2.gz KGIOJZWPJYTXLS-QGZVFWFLSA-N 1 2 316.832 4.327 20 0 DIADLO COc1ccc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)c(Cl)c1 ZINC000552278736 341383487 /nfs/dbraw/zinc/38/34/87/341383487.db2.gz KGIOJZWPJYTXLS-QGZVFWFLSA-N 1 2 316.832 4.327 20 0 DIADLO CSc1cc(Br)ccc1C[N@@H+]1CCC[C@@H]1CF ZINC000552390747 341390822 /nfs/dbraw/zinc/39/08/22/341390822.db2.gz KSMCXNOHSVMKCR-GFCCVEGCSA-N 1 2 318.255 4.105 20 0 DIADLO CSc1cc(Br)ccc1C[N@H+]1CCC[C@@H]1CF ZINC000552390747 341390823 /nfs/dbraw/zinc/39/08/23/341390823.db2.gz KSMCXNOHSVMKCR-GFCCVEGCSA-N 1 2 318.255 4.105 20 0 DIADLO Cc1ncc(C[N@H+]2C[C@@H](c3cccc(Cl)c3)OC[C@H]2C)s1 ZINC000249382915 341396874 /nfs/dbraw/zinc/39/68/74/341396874.db2.gz PHYQQDIXFHBSFV-BZNIZROVSA-N 1 2 322.861 4.067 20 0 DIADLO Cc1ncc(C[N@@H+]2C[C@@H](c3cccc(Cl)c3)OC[C@H]2C)s1 ZINC000249382915 341396875 /nfs/dbraw/zinc/39/68/75/341396875.db2.gz PHYQQDIXFHBSFV-BZNIZROVSA-N 1 2 322.861 4.067 20 0 DIADLO CC(C)c1cccc(-c2ccc(C(=O)N[C@H](C)c3[nH]cc[nH+]3)o2)c1 ZINC000552559264 341398651 /nfs/dbraw/zinc/39/86/51/341398651.db2.gz SXOCMLHUHGTOKK-CYBMUJFWSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3c(C)cc(C)cc3C)ccc2n1C ZINC000090630326 341417941 /nfs/dbraw/zinc/41/79/41/341417941.db2.gz NOQDIKZGJIOVGV-UHFFFAOYSA-N 1 2 307.397 4.059 20 0 DIADLO CC(C)O[C@@H](COc1ccccc1-n1cc[nH+]c1)c1ccccc1 ZINC000555626979 341487668 /nfs/dbraw/zinc/48/76/68/341487668.db2.gz HNXKNJMVRBROLY-FQEVSTJZSA-N 1 2 322.408 4.417 20 0 DIADLO CN(Cc1cn2cc(Cl)ccc2[nH+]1)c1cccc2cccnc21 ZINC000556087750 341493873 /nfs/dbraw/zinc/49/38/73/341493873.db2.gz CPMGYYWKQIUHGG-UHFFFAOYSA-N 1 2 322.799 4.172 20 0 DIADLO CCC(CC)N(C(=O)C[C@H](C)n1cc[nH+]c1)c1cccc(C)c1 ZINC000565540786 341530443 /nfs/dbraw/zinc/53/04/43/341530443.db2.gz FGNWRTDGHLWXED-INIZCTEOSA-N 1 2 313.445 4.364 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)s1 ZINC000565619425 341533018 /nfs/dbraw/zinc/53/30/18/341533018.db2.gz GXYJAFBTZJRFHJ-ZDUSSCGKSA-N 1 2 324.453 4.013 20 0 DIADLO Cc1ccccc1[C@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)C(C)(C)C ZINC000565894567 341541786 /nfs/dbraw/zinc/54/17/86/341541786.db2.gz KALFWOTYGHUFEM-QAPCUYQASA-N 1 2 313.445 4.046 20 0 DIADLO C[C@@H](CC(=O)Nc1cccc(C(F)F)c1Cl)n1cc[nH+]c1 ZINC000566303719 341553390 /nfs/dbraw/zinc/55/33/90/341553390.db2.gz FZFDJSRBPUEPOO-VIFPVBQESA-N 1 2 313.735 4.064 20 0 DIADLO CC[C@H](C)Oc1cccc(NC(=O)c2ccn3c(C)c[nH+]c3c2)c1 ZINC000566435956 341558269 /nfs/dbraw/zinc/55/82/69/341558269.db2.gz UTLOQDIJXQQDCI-AWEZNQCLSA-N 1 2 323.396 4.072 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1cc(F)cc(F)c1 ZINC000163195147 341564613 /nfs/dbraw/zinc/56/46/13/341564613.db2.gz MXDKIPGUWHWNRI-CYBMUJFWSA-N 1 2 313.351 4.001 20 0 DIADLO Cc1cccc2[nH+]c(C[S@](=O)c3ccc4ccccc4c3)cn21 ZINC000155562350 341609470 /nfs/dbraw/zinc/60/94/70/341609470.db2.gz YYFRQAGOCIUKLJ-HSZRJFAPSA-N 1 2 320.417 4.104 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)Cc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000156057408 341616494 /nfs/dbraw/zinc/61/64/94/341616494.db2.gz IFTHPMKSQUBJGS-LLVKDONJSA-N 1 2 302.805 4.169 20 0 DIADLO CC[C@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1ccc(F)cc1F ZINC000156455090 341621721 /nfs/dbraw/zinc/62/17/21/341621721.db2.gz IIYYQECWAHRKEX-HOTGVXAUSA-N 1 2 309.356 4.295 20 0 DIADLO CO[C@@H](CSCCc1[nH+]cc(C)cc1C)c1ccccc1 ZINC000567883431 341638572 /nfs/dbraw/zinc/63/85/72/341638572.db2.gz VGXYDHUZVWOXQE-SFHVURJKSA-N 1 2 301.455 4.362 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2oc3ccccc3c2C)s1 ZINC000274157341 341641337 /nfs/dbraw/zinc/64/13/37/341641337.db2.gz FXYCRYNHXGDKPA-QWRGUYRKSA-N 1 2 301.415 4.313 20 0 DIADLO C[C@H](CC(=O)N(c1ccsc1)C1CCCCC1)n1cc[nH+]c1 ZINC000567992345 341644285 /nfs/dbraw/zinc/64/42/85/341644285.db2.gz OPXTZGFXQBZWQU-CQSZACIVSA-N 1 2 317.458 4.262 20 0 DIADLO Cc1cc(N[C@H](C[C@H]2CCOC2)c2ccccc2)nc(C2CC2)[nH+]1 ZINC000157959357 341648334 /nfs/dbraw/zinc/64/83/34/341648334.db2.gz QROJXBGGBSEPRP-CRAIPNDOSA-N 1 2 323.440 4.242 20 0 DIADLO FC(F)c1ccc(CNc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC000316432547 341669216 /nfs/dbraw/zinc/66/92/16/341669216.db2.gz ADACLTZSXARORZ-UHFFFAOYSA-N 1 2 303.356 4.232 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+]CC(C)(F)F)cc1OC ZINC000568892600 341684696 /nfs/dbraw/zinc/68/46/96/341684696.db2.gz WYQNMVBBJOVPJD-GFCCVEGCSA-N 1 2 301.377 4.180 20 0 DIADLO Cc1cnc([C@H](C)[NH+]2CCC(=Cc3cccc(F)c3)CC2)o1 ZINC000573335138 341725312 /nfs/dbraw/zinc/72/53/12/341725312.db2.gz HTPYCAFSDASFAJ-AWEZNQCLSA-N 1 2 300.377 4.363 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1cnc(C2CC2)s1 ZINC000167761981 341725863 /nfs/dbraw/zinc/72/58/63/341725863.db2.gz GHSCVHVFWIJDMI-UHFFFAOYSA-N 1 2 318.833 4.173 20 0 DIADLO CCO[C@H](C)c1nc(CSCCc2cccc(C)[nH+]2)cs1 ZINC000573966677 341744682 /nfs/dbraw/zinc/74/46/82/341744682.db2.gz HWDRVLSOCADKSK-CYBMUJFWSA-N 1 2 322.499 4.420 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2nc(-c3ccccc3)c[nH]2)o1 ZINC000574361631 341756449 /nfs/dbraw/zinc/75/64/49/341756449.db2.gz QGOIJKRRUGMQGN-XJKSGUPXSA-N 1 2 307.397 4.083 20 0 DIADLO Cc1cccc(-c2n[nH]cc2CNc2ccc3c(c2)CCC[NH2+]3)c1 ZINC000575020659 341772293 /nfs/dbraw/zinc/77/22/93/341772293.db2.gz CGSFJQJZMOICLK-UHFFFAOYSA-N 1 2 318.424 4.355 20 0 DIADLO CC1(c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)CCCCC1 ZINC000575024546 341772439 /nfs/dbraw/zinc/77/24/39/341772439.db2.gz HISUXEIFUCNMHO-UHFFFAOYSA-N 1 2 322.412 4.203 20 0 DIADLO CCC(CC)C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000575204623 341785581 /nfs/dbraw/zinc/78/55/81/341785581.db2.gz NJTFWBXPSJMSSM-UHFFFAOYSA-N 1 2 311.429 4.261 20 0 DIADLO Cc1[nH+]cccc1Cc1nc(-c2ccc3ccccc3c2)no1 ZINC000575573912 341799928 /nfs/dbraw/zinc/79/99/28/341799928.db2.gz WJOJLKREERSYMY-UHFFFAOYSA-N 1 2 301.349 4.184 20 0 DIADLO CC[C@@H](C)Oc1cccc(NCc2ccc(N(C)CC)[nH+]c2)c1 ZINC000576593411 341854261 /nfs/dbraw/zinc/85/42/61/341854261.db2.gz KBVIOABWEJAZFO-OAHLLOKOSA-N 1 2 313.445 4.327 20 0 DIADLO C[C@@H](CC(=O)N1c2ccccc2[C@@H](C)CC1(C)C)n1cc[nH+]c1 ZINC000580572228 341879210 /nfs/dbraw/zinc/87/92/10/341879210.db2.gz UUYPBEPYRGEQBH-GJZGRUSLSA-N 1 2 311.429 4.153 20 0 DIADLO FC(F)Oc1ccc(Cl)cc1C[NH+]1CC2(CCC2(F)F)C1 ZINC000577091130 341885051 /nfs/dbraw/zinc/88/50/51/341885051.db2.gz HPSHOTVEPLIUEN-UHFFFAOYSA-N 1 2 323.717 4.173 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)n1 ZINC000192825120 341890108 /nfs/dbraw/zinc/89/01/08/341890108.db2.gz BMBULHIHYNZTAD-QGZVFWFLSA-N 1 2 319.836 4.162 20 0 DIADLO CCO[C@H](C)c1noc(C[NH2+][C@H](CC(C)C)c2ccccc2)n1 ZINC000177381513 341919288 /nfs/dbraw/zinc/91/92/88/341919288.db2.gz NUGDHQPKAUPQGL-GDBMZVCRSA-N 1 2 317.433 4.044 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccccc2C(F)(F)F)s1 ZINC000348263698 341948966 /nfs/dbraw/zinc/94/89/66/341948966.db2.gz UHBWUUSZPCXXKM-BDAKNGLRSA-N 1 2 315.364 4.277 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccccc2C(F)(F)F)s1 ZINC000348263700 341949016 /nfs/dbraw/zinc/94/90/16/341949016.db2.gz UHBWUUSZPCXXKM-IUCAKERBSA-N 1 2 315.364 4.277 20 0 DIADLO C[C@H](c1ccccc1Br)[NH+]1CC(C(F)(F)F)C1 ZINC000578025064 341973703 /nfs/dbraw/zinc/97/37/03/341973703.db2.gz JPYVNZXDQGCSBO-MRVPVSSYSA-N 1 2 308.141 4.004 20 0 DIADLO CC[C@@H]([NH2+]Cc1nn(C)c(C)c1Cl)c1ccc(Cl)s1 ZINC000421361418 517778563 /nfs/dbraw/zinc/77/85/63/517778563.db2.gz GSDHSXLVPNFQCQ-SECBINFHSA-N 1 2 318.273 4.338 20 0 DIADLO Brc1ccc([C@H]2CCC[N@@H+]2Cc2cccs2)nc1 ZINC000339164292 518215595 /nfs/dbraw/zinc/21/55/95/518215595.db2.gz KCHKYFRNGGJUKW-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc([C@H]2CCC[N@H+]2Cc2cccs2)nc1 ZINC000339164292 518215598 /nfs/dbraw/zinc/21/55/98/518215598.db2.gz KCHKYFRNGGJUKW-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1cccc2cccnc21 ZINC000338335278 518898376 /nfs/dbraw/zinc/89/83/76/518898376.db2.gz ZIQBPIRUVMUHPJ-UHFFFAOYSA-N 1 2 307.397 4.419 20 0 DIADLO CC(C)(C)c1noc(C[NH2+][C@H](CC2CCC2)c2ccccc2)n1 ZINC000181350734 519133903 /nfs/dbraw/zinc/13/39/03/519133903.db2.gz TZBYIZZWKAYINY-MRXNPFEDSA-N 1 2 313.445 4.388 20 0 DIADLO CC(C)CCc1nc(C[NH2+][C@H](C)c2cccc(O)c2)cs1 ZINC000181566445 519698162 /nfs/dbraw/zinc/69/81/62/519698162.db2.gz MJOFWOBQGHJQNA-CYBMUJFWSA-N 1 2 304.459 4.288 20 0 DIADLO CC(=O)Nc1cccc([C@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)c1 ZINC000182954699 519748918 /nfs/dbraw/zinc/74/89/18/519748918.db2.gz DKCVFANCXKOVGG-AWEZNQCLSA-N 1 2 323.440 4.201 20 0 DIADLO CC(=O)Nc1cccc([C@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)c1 ZINC000182954699 519748920 /nfs/dbraw/zinc/74/89/20/519748920.db2.gz DKCVFANCXKOVGG-AWEZNQCLSA-N 1 2 323.440 4.201 20 0 DIADLO CC(C)CO[C@@H](C)c1noc(C[N@H+](C)[C@@H](C)c2cccs2)n1 ZINC000173868244 519759730 /nfs/dbraw/zinc/75/97/30/519759730.db2.gz PFGDEPGUUPMDQM-STQMWFEESA-N 1 2 323.462 4.058 20 0 DIADLO CC(C)CO[C@@H](C)c1noc(C[N@@H+](C)[C@@H](C)c2cccs2)n1 ZINC000173868244 519759733 /nfs/dbraw/zinc/75/97/33/519759733.db2.gz PFGDEPGUUPMDQM-STQMWFEESA-N 1 2 323.462 4.058 20 0 DIADLO CC(C)c1nnc(C[NH2+]C(C)(c2ccccc2)c2ccccc2)o1 ZINC000182203737 519887588 /nfs/dbraw/zinc/88/75/88/519887588.db2.gz DBZLIPWCRVEBER-UHFFFAOYSA-N 1 2 321.424 4.246 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000181290342 519888090 /nfs/dbraw/zinc/88/80/90/519888090.db2.gz IOKLKJPRLAJDPR-CQSZACIVSA-N 1 2 322.412 4.106 20 0 DIADLO CC(C)c1noc(C[NH2+]C2(c3ccc(F)cc3F)CCCC2)n1 ZINC000181249980 519904564 /nfs/dbraw/zinc/90/45/64/519904564.db2.gz XSLMFCMGQUPHEM-UHFFFAOYSA-N 1 2 321.371 4.030 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)n1 ZINC000182422031 519905124 /nfs/dbraw/zinc/90/51/24/519905124.db2.gz SHTFWAWSUUJQPA-SNVBAGLBSA-N 1 2 313.323 4.063 20 0 DIADLO CC(C)n1ccc(C[NH2+]C2(c3ccc(F)cc3F)CCCC2)n1 ZINC000181255748 520004322 /nfs/dbraw/zinc/00/43/22/520004322.db2.gz ZPPNUSHLJZQKJF-UHFFFAOYSA-N 1 2 319.399 4.301 20 0 DIADLO CC(C)n1cc[nH+]c1CN(C)Cc1c(Cl)cccc1Cl ZINC000337341085 520023454 /nfs/dbraw/zinc/02/34/54/520023454.db2.gz HRJIKKOXWKVCCV-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000107299234 520027946 /nfs/dbraw/zinc/02/79/46/520027946.db2.gz JIVUQVFZYUXYPK-MRXNPFEDSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000107299234 520027956 /nfs/dbraw/zinc/02/79/56/520027956.db2.gz JIVUQVFZYUXYPK-MRXNPFEDSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1cc[nH+]c1CNc1ccc(OC2CCC2)c(F)c1 ZINC000124740244 520035198 /nfs/dbraw/zinc/03/51/98/520035198.db2.gz BYEMZQSWAAGGJM-UHFFFAOYSA-N 1 2 303.381 4.147 20 0 DIADLO CCOCc1cccc(NCc2ccc(N(C)C(C)C)[nH+]c2)c1 ZINC000191424158 520206814 /nfs/dbraw/zinc/20/68/14/520206814.db2.gz FGYKSAUPEVARKE-UHFFFAOYSA-N 1 2 313.445 4.075 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+]2CC[C@H]2c2ccccc2)cs1 ZINC000336842306 520271082 /nfs/dbraw/zinc/27/10/82/520271082.db2.gz RTPKLSKHGUMOBB-BBRMVZONSA-N 1 2 302.443 4.188 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+]2CC[C@H]2c2ccccc2)cs1 ZINC000336842306 520271084 /nfs/dbraw/zinc/27/10/84/520271084.db2.gz RTPKLSKHGUMOBB-BBRMVZONSA-N 1 2 302.443 4.188 20 0 DIADLO CCCC[C@H]([NH2+]Cc1noc(C(C)C)n1)c1ccc(OC)cc1 ZINC000182147132 521241364 /nfs/dbraw/zinc/24/13/64/521241364.db2.gz VRVSEBUMPDTOAD-INIZCTEOSA-N 1 2 317.433 4.223 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1cc(Br)ccc1F ZINC000104948988 521395271 /nfs/dbraw/zinc/39/52/71/521395271.db2.gz UVRAWFKLEZYNSK-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1cc(Br)ccc1F ZINC000104948988 521395276 /nfs/dbraw/zinc/39/52/76/521395276.db2.gz UVRAWFKLEZYNSK-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@H+](Cc1csc(C2CC2)n1)[C@H](C)c1cccc(O)c1 ZINC000161969225 521442789 /nfs/dbraw/zinc/44/27/89/521442789.db2.gz NLTSCQVXMHUQRS-GFCCVEGCSA-N 1 2 302.443 4.309 20 0 DIADLO CC[N@@H+](Cc1csc(C2CC2)n1)[C@H](C)c1cccc(O)c1 ZINC000161969225 521442795 /nfs/dbraw/zinc/44/27/95/521442795.db2.gz NLTSCQVXMHUQRS-GFCCVEGCSA-N 1 2 302.443 4.309 20 0 DIADLO CCCc1noc(C[NH2+]C(C)(c2ccccc2)c2ccccc2)n1 ZINC000182180345 521583410 /nfs/dbraw/zinc/58/34/10/521583410.db2.gz RLRXDNOFFAZQEZ-UHFFFAOYSA-N 1 2 321.424 4.075 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+][C@H](COC)c1ccc(C)o1 ZINC000156502153 521585719 /nfs/dbraw/zinc/58/57/19/521585719.db2.gz MDTHOOXCZGHPHY-GOEBONIOSA-N 1 2 303.402 4.025 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2cccc(C)c2)C(C)(C)C)n1 ZINC000180787238 521586025 /nfs/dbraw/zinc/58/60/25/521586025.db2.gz FCKIUALSPZLFNM-QGZVFWFLSA-N 1 2 301.434 4.208 20 0 DIADLO CCCN(CC)C(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000265107224 521605452 /nfs/dbraw/zinc/60/54/52/521605452.db2.gz VNMGQEHOPCGNAV-UHFFFAOYSA-N 1 2 318.804 4.399 20 0 DIADLO CCCn1c(C)nnc1C[N@H+](C1CC1)[C@H]1CCCc2ccccc21 ZINC000161994165 521621655 /nfs/dbraw/zinc/62/16/55/521621655.db2.gz HERLKBUMWHQLSC-IBGZPJMESA-N 1 2 324.472 4.039 20 0 DIADLO CCCn1c(C)nnc1C[N@@H+](C1CC1)[C@H]1CCCc2ccccc21 ZINC000161994165 521621660 /nfs/dbraw/zinc/62/16/60/521621660.db2.gz HERLKBUMWHQLSC-IBGZPJMESA-N 1 2 324.472 4.039 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@H](C)c2ccc(C)cc2)n1 ZINC000182313904 521721928 /nfs/dbraw/zinc/72/19/28/521721928.db2.gz SEGFQWLHTGPFBX-OLZOCXBDSA-N 1 2 305.447 4.043 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@H](C)c2ccc(C)cc2)n1 ZINC000182313922 521729582 /nfs/dbraw/zinc/72/95/82/521729582.db2.gz SEGFQWLHTGPFBX-CHWSQXEVSA-N 1 2 305.447 4.043 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CCCOc3c(Cl)cccc32)cs1 ZINC000156415568 522352411 /nfs/dbraw/zinc/35/24/11/522352411.db2.gz YVONXPANKQQJEM-CQSZACIVSA-N 1 2 322.861 4.362 20 0 DIADLO COC(=O)c1oc([C@H](C)[NH2+][C@H](C)c2cccc(F)c2F)cc1C ZINC000181954154 522411167 /nfs/dbraw/zinc/41/11/67/522411167.db2.gz SCBRHBCRLGBWMM-MNOVXSKESA-N 1 2 323.339 4.065 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)o1 ZINC000365656462 522732318 /nfs/dbraw/zinc/73/23/18/522732318.db2.gz HVMDAJSTIUOVQB-CQSZACIVSA-N 1 2 305.809 4.013 20 0 DIADLO CCc1nnc(C[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)o1 ZINC000365656462 522732327 /nfs/dbraw/zinc/73/23/27/522732327.db2.gz HVMDAJSTIUOVQB-CQSZACIVSA-N 1 2 305.809 4.013 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)o1 ZINC000181808158 522747933 /nfs/dbraw/zinc/74/79/33/522747933.db2.gz RUMOQTGNDTWCFT-CQSZACIVSA-N 1 2 323.396 4.275 20 0 DIADLO CC[C@H](Nc1ccc(Br)c(C)c1)c1[nH+]ccn1C ZINC000182742757 522764987 /nfs/dbraw/zinc/76/49/87/522764987.db2.gz KSRMCRABFTZIOI-ZDUSSCGKSA-N 1 2 308.223 4.054 20 0 DIADLO CC[C@H](Nc1ccc(C)c(Br)c1)c1[nH+]ccn1C ZINC000182726871 522767868 /nfs/dbraw/zinc/76/78/68/522767868.db2.gz ICZVRTUMUKZXAU-ZDUSSCGKSA-N 1 2 308.223 4.054 20 0 DIADLO CC[C@H](Nc1cccc(-c2csc(C)n2)c1)c1[nH+]ccn1C ZINC000182804359 522769760 /nfs/dbraw/zinc/76/97/60/522769760.db2.gz JUOCCKFYZFUCFA-HNNXBMFYSA-N 1 2 312.442 4.415 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@H](C)c2ccc(-c3cccnc3)cc2)n1 ZINC000181314339 522907767 /nfs/dbraw/zinc/90/77/67/522907767.db2.gz MWFRGMGHZPVMJE-ZIAGYGMSSA-N 1 2 322.412 4.106 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3cccnc3)cc2)n1 ZINC000181314325 522914531 /nfs/dbraw/zinc/91/45/31/522914531.db2.gz MWFRGMGHZPVMJE-KBPBESRZSA-N 1 2 322.412 4.106 20 0 DIADLO CC[C@@H](Nc1ccc(-c2nc(C)cs2)cc1)c1[nH+]ccn1C ZINC000183014966 522955016 /nfs/dbraw/zinc/95/50/16/522955016.db2.gz IAJDVFZANHWVJO-OAHLLOKOSA-N 1 2 312.442 4.415 20 0 DIADLO CCc1nocc1CNc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000339301843 522957245 /nfs/dbraw/zinc/95/72/45/522957245.db2.gz KNVNTZYHEOVUHD-UHFFFAOYSA-N 1 2 322.412 4.049 20 0 DIADLO CCc1nocc1CNc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000339303943 522957311 /nfs/dbraw/zinc/95/73/11/522957311.db2.gz WQHCTPZXSKNXBK-UHFFFAOYSA-N 1 2 322.412 4.049 20 0 DIADLO CC[C@@H](Nc1ccc(OC(F)F)c(Cl)c1)c1[nH+]ccn1C ZINC000182781395 522958169 /nfs/dbraw/zinc/95/81/69/522958169.db2.gz FPZJOPRRTWUCCK-LLVKDONJSA-N 1 2 315.751 4.238 20 0 DIADLO CC[C@@H](Nc1ccc(OC(C)C)c(Cl)c1)c1[nH+]ccn1C ZINC000183092911 522959158 /nfs/dbraw/zinc/95/91/58/522959158.db2.gz VMGIHFNUWDFVSI-CQSZACIVSA-N 1 2 307.825 4.424 20 0 DIADLO CC[C@@H](Nc1ccc2c(c1)OC1(CCCC1)O2)c1[nH+]ccn1C ZINC000182578320 522960739 /nfs/dbraw/zinc/96/07/39/522960739.db2.gz XKVCXPOOVQTZOQ-CQSZACIVSA-N 1 2 313.401 4.025 20 0 DIADLO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@@H](C)c1ccncc1F ZINC000338012419 523292893 /nfs/dbraw/zinc/29/28/93/523292893.db2.gz MKLJINFXNCCJEA-QWHCGFSZSA-N 1 2 312.392 4.002 20 0 DIADLO CCn1cc([C@H](C)Nc2cccc([NH+]3CCCCCC3)c2)cn1 ZINC000179960014 523477321 /nfs/dbraw/zinc/47/73/21/523477321.db2.gz ZAVODPYGROBWFH-INIZCTEOSA-N 1 2 312.461 4.457 20 0 DIADLO CC[C@](C)([NH2+]Cc1coc(-c2ccccc2)n1)c1nccs1 ZINC000236925419 523492936 /nfs/dbraw/zinc/49/29/36/523492936.db2.gz VLGJMJSTQUKQKS-KRWDZBQOSA-N 1 2 313.426 4.213 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1csc(C(C)C)n1 ZINC000339151105 523552815 /nfs/dbraw/zinc/55/28/15/523552815.db2.gz ZLIVTTRSDARHNZ-HNNXBMFYSA-N 1 2 318.490 4.210 20 0 DIADLO C[N@H+](Cc1nc2c(s1)CCCC2)Cc1cnc2ccccc2c1 ZINC000337190085 523561183 /nfs/dbraw/zinc/56/11/83/523561183.db2.gz RNWYCUMHVSXERA-UHFFFAOYSA-N 1 2 323.465 4.202 20 0 DIADLO C[N@@H+](Cc1nc2c(s1)CCCC2)Cc1cnc2ccccc2c1 ZINC000337190085 523561189 /nfs/dbraw/zinc/56/11/89/523561189.db2.gz RNWYCUMHVSXERA-UHFFFAOYSA-N 1 2 323.465 4.202 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1nc(C(C)C)cs1 ZINC000128603402 523852417 /nfs/dbraw/zinc/85/24/17/523852417.db2.gz AVJWXVLXAZMWCS-CYBMUJFWSA-N 1 2 304.459 4.434 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](C)[C@H](C)c2ccccc2C)cs1 ZINC000267024805 523911500 /nfs/dbraw/zinc/91/15/00/523911500.db2.gz LAMQTXVFDZIRDJ-ZIAGYGMSSA-N 1 2 304.459 4.352 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](C)[C@H](C)c2ccccc2C)cs1 ZINC000267024805 523911504 /nfs/dbraw/zinc/91/15/04/523911504.db2.gz LAMQTXVFDZIRDJ-ZIAGYGMSSA-N 1 2 304.459 4.352 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2csc(-c3ccoc3)n2)cc1 ZINC000108356046 524008848 /nfs/dbraw/zinc/00/88/48/524008848.db2.gz HSWANCIJMNITDR-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2csc(-c3ccoc3)n2)cc1 ZINC000108356046 524008850 /nfs/dbraw/zinc/00/88/50/524008850.db2.gz HSWANCIJMNITDR-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000265841400 524053261 /nfs/dbraw/zinc/05/32/61/524053261.db2.gz WOEBHTJAWICBJX-OAHLLOKOSA-N 1 2 317.433 4.466 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000265841400 524053263 /nfs/dbraw/zinc/05/32/63/524053263.db2.gz WOEBHTJAWICBJX-OAHLLOKOSA-N 1 2 317.433 4.466 20 0 DIADLO COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nnc(C(C)C)o1 ZINC000181705074 524789957 /nfs/dbraw/zinc/78/99/57/524789957.db2.gz NOGINMCZPZEDEC-HNNXBMFYSA-N 1 2 317.433 4.079 20 0 DIADLO C[C@@H](C[C@@H](O)c1cccs1)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000128871365 524845490 /nfs/dbraw/zinc/84/54/90/524845490.db2.gz BKJVGKYPARDSNO-GXSJLCMTSA-N 1 2 316.348 4.086 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2coc(-c3cccs3)n2)o1 ZINC000237575799 524861345 /nfs/dbraw/zinc/86/13/45/524861345.db2.gz GMJJSQBYWGITTA-FZMZJTMJSA-N 1 2 314.410 4.409 20 0 DIADLO COc1cc[nH+]cc1NC(=O)c1c(C)c(C)oc1-c1ccccc1 ZINC000189224463 524866580 /nfs/dbraw/zinc/86/65/80/524866580.db2.gz QAMRCMDPFMLJII-UHFFFAOYSA-N 1 2 322.364 4.219 20 0 DIADLO Cc1ccc(NC(=O)N(C)Cc2c(F)cccc2Cl)c(C)[nH+]1 ZINC000268033558 525113385 /nfs/dbraw/zinc/11/33/85/525113385.db2.gz OVURVCSAWYYWMW-UHFFFAOYSA-N 1 2 321.783 4.155 20 0 DIADLO Cc1ccc(NC(=O)Nc2cc(C(C)C)c(O)cc2C)c(C)[nH+]1 ZINC000190086463 525185891 /nfs/dbraw/zinc/18/58/91/525185891.db2.gz HGDKCLQUFHCMOG-UHFFFAOYSA-N 1 2 313.401 4.480 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)c(C)[nH+]1 ZINC000268031071 525201310 /nfs/dbraw/zinc/20/13/10/525201310.db2.gz XRSMWGISQCTQAV-NEPJUHHUSA-N 1 2 300.324 4.006 20 0 DIADLO C[C@]1(C(=O)Nc2ccc3[nH]c(C4CCC4)[nH+]c3c2)C[C@H]2C[C@H]2C1 ZINC000339603133 525222501 /nfs/dbraw/zinc/22/25/01/525222501.db2.gz KKETYJQZBKYKHB-WURKVNMJSA-N 1 2 309.413 4.205 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2nc(C(C)C)cs2)c(F)c1 ZINC000128542070 525326141 /nfs/dbraw/zinc/32/61/41/525326141.db2.gz FOIDEBQJPPOYKK-NSHDSACASA-N 1 2 308.422 4.265 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ncc(C(C)(C)C)o2)cc1 ZINC000267093634 525328710 /nfs/dbraw/zinc/32/87/10/525328710.db2.gz XQDVVJBLXRPRGU-STQMWFEESA-N 1 2 302.418 4.393 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000124455885 525329456 /nfs/dbraw/zinc/32/94/56/525329456.db2.gz HRODIMLDEBOUGK-KBPBESRZSA-N 1 2 323.396 4.157 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2coc(-c3ccccc3)n2)o1 ZINC000237373409 525342019 /nfs/dbraw/zinc/34/20/19/525342019.db2.gz WINAHJBSNKUYLY-DYVFJYSZSA-N 1 2 308.381 4.348 20 0 DIADLO Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1noc(-c2ccccc2)n1 ZINC000124422055 525360775 /nfs/dbraw/zinc/36/07/75/525360775.db2.gz IIBNAJRTICDVJP-CABCVRRESA-N 1 2 307.397 4.457 20 0 DIADLO Cc1ccccc1[C@H](C)[NH2+][C@@H](c1nccn1C)c1cccc(F)c1 ZINC000128479726 525417377 /nfs/dbraw/zinc/41/73/77/525417377.db2.gz XJJAYBCIBGWXTA-HNAYVOBHSA-N 1 2 323.415 4.308 20 0 DIADLO C[C@H]([NH2+]Cc1cccc2[nH]ccc21)c1nc(C2CCCCC2)no1 ZINC000237499847 525457805 /nfs/dbraw/zinc/45/78/05/525457805.db2.gz ZGXQHLBTQCYNIU-ZDUSSCGKSA-N 1 2 324.428 4.449 20 0 DIADLO C[C@H]([NH2+]Cc1nccn1C(F)F)c1cc(Cl)ccc1Cl ZINC000161847618 525492262 /nfs/dbraw/zinc/49/22/62/525492262.db2.gz XTQDKRQHDUEROG-QMMMGPOBSA-N 1 2 320.170 4.436 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)nc1)c1nc(C2CCCCC2)no1 ZINC000177587683 525524714 /nfs/dbraw/zinc/52/47/14/525524714.db2.gz YXMDYCFRYSFTIY-LLVKDONJSA-N 1 2 320.824 4.017 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccncc1F)c1ncc(-c2ccccc2)o1 ZINC000338348881 525665871 /nfs/dbraw/zinc/66/58/71/525665871.db2.gz XBBPYUBIYONCLE-CHWSQXEVSA-N 1 2 311.360 4.288 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2ncnn2-c2ccccc2)c(C)c1 ZINC000337133657 525687819 /nfs/dbraw/zinc/68/78/19/525687819.db2.gz LCELXMXPFCJMBA-QGZVFWFLSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2ncnn2-c2ccccc2)c(C)c1 ZINC000337133657 525687827 /nfs/dbraw/zinc/68/78/27/525687827.db2.gz LCELXMXPFCJMBA-QGZVFWFLSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc(-c2cc(C[NH2+][C@@H](C)c3ccncc3F)on2)cc1 ZINC000338360068 525733640 /nfs/dbraw/zinc/73/36/40/525733640.db2.gz WHAPPLKVJMMNOQ-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nc(Cc3ccccc3C)no2)cc1 ZINC000182318801 525735990 /nfs/dbraw/zinc/73/59/90/525735990.db2.gz JURBPRBAOIGYAP-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)C=Cc2ccsc2)[nH+]1 ZINC000366354249 525962366 /nfs/dbraw/zinc/96/23/66/525962366.db2.gz HGJOSEJAQLITCQ-VOTSOKGWSA-N 1 2 309.394 4.099 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+]Cc2nc(C3CCCC3)no2)cc1 ZINC000337225338 526059353 /nfs/dbraw/zinc/05/93/53/526059353.db2.gz PYSBVZZLFKVKLX-GFCCVEGCSA-N 1 2 317.458 4.300 20 0 DIADLO CSc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C3CC3)no2)cc1 ZINC000337232921 526072883 /nfs/dbraw/zinc/07/28/83/526072883.db2.gz YLLGYJUWPZIKSS-QWRGUYRKSA-N 1 2 303.431 4.081 20 0 DIADLO CSc1ccc([C@H](C)[NH2+]Cc2nc(C3CCCC3)no2)cc1 ZINC000337225339 526074054 /nfs/dbraw/zinc/07/40/54/526074054.db2.gz PYSBVZZLFKVKLX-LBPRGKRZSA-N 1 2 317.458 4.300 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1csc(-c2cccs2)n1 ZINC000127953729 526125163 /nfs/dbraw/zinc/12/51/63/526125163.db2.gz DZBCNXOXNFDJIT-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1csc(-c2cccs2)n1 ZINC000127953729 526125169 /nfs/dbraw/zinc/12/51/69/526125169.db2.gz DZBCNXOXNFDJIT-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1csc(C2CCCC2)n1 ZINC000180793404 526131359 /nfs/dbraw/zinc/13/13/59/526131359.db2.gz MIHGQWWWQPBGAC-CYBMUJFWSA-N 1 2 301.459 4.389 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1csc(C2CCCC2)n1 ZINC000180793404 526131369 /nfs/dbraw/zinc/13/13/69/526131369.db2.gz MIHGQWWWQPBGAC-CYBMUJFWSA-N 1 2 301.459 4.389 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1csc(-c2cccs2)n1 ZINC000127498445 526152277 /nfs/dbraw/zinc/15/22/77/526152277.db2.gz KEYISPDTLIJYGP-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1csc(-c2cccs2)n1 ZINC000127498445 526152290 /nfs/dbraw/zinc/15/22/90/526152290.db2.gz KEYISPDTLIJYGP-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1noc(-c3ccccc3)n1)CC2 ZINC000124429072 526193755 /nfs/dbraw/zinc/19/37/55/526193755.db2.gz MCZZVMXQNXYSDQ-KDOFPFPSSA-N 1 2 319.408 4.383 20 0 DIADLO CSc1ccsc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000107239258 526201866 /nfs/dbraw/zinc/20/18/66/526201866.db2.gz CXTYANAILWWTJE-UHFFFAOYSA-N 1 2 315.423 4.112 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CCSc1ccccc1Cl ZINC000107293466 526238674 /nfs/dbraw/zinc/23/86/74/526238674.db2.gz BFNVOYGDTJCXIW-UHFFFAOYSA-N 1 2 306.818 4.164 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@@H](C)c1ccc(OC(C)C)cc1 ZINC000179848268 526240199 /nfs/dbraw/zinc/24/01/99/526240199.db2.gz RJFQVQHVPXTVEO-AWEZNQCLSA-N 1 2 313.401 4.060 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1oc2ccccc2c1COC(C)C ZINC000107289831 526241769 /nfs/dbraw/zinc/24/17/69/526241769.db2.gz NKPITCUUMMRBGI-UHFFFAOYSA-N 1 2 324.380 4.314 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccc(CCC(F)(F)F)cc1 ZINC000127702503 526242415 /nfs/dbraw/zinc/24/24/15/526242415.db2.gz OTEZTGUBBRHRRV-UHFFFAOYSA-N 1 2 308.303 4.137 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]C1(c2nccs2)CCCC1 ZINC000189117183 526302643 /nfs/dbraw/zinc/30/26/43/526302643.db2.gz VULHFQIJVYZPNN-UHFFFAOYSA-N 1 2 310.825 4.495 20 0 DIADLO Cc1csc(C2([NH2+][C@H](C)c3cc(F)ccc3F)CCC2)n1 ZINC000264824119 526327719 /nfs/dbraw/zinc/32/77/19/526327719.db2.gz BFMUISMFMOKNEP-LLVKDONJSA-N 1 2 308.397 4.460 20 0 DIADLO Fc1ccc2c(c1F)C[N@@H+](Cc1cnc3ccccc3c1)CC2 ZINC000337162887 526375844 /nfs/dbraw/zinc/37/58/44/526375844.db2.gz WEDDZEVLWOWWKR-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1ccc2c(c1F)C[N@H+](Cc1cnc3ccccc3c1)CC2 ZINC000337162887 526375850 /nfs/dbraw/zinc/37/58/50/526375850.db2.gz WEDDZEVLWOWWKR-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1ccc2cc[nH+]c(N[C@H]3CCCC[C@H]3OC(F)F)c2c1 ZINC000336904665 526376331 /nfs/dbraw/zinc/37/63/31/526376331.db2.gz SNSVEIXUUNFJOK-UONOGXRCSA-N 1 2 310.319 4.336 20 0 DIADLO Fc1ccc2cc[nH+]c(N[C@@H]3CCCC[C@@H]3OC(F)F)c2c1 ZINC000336904664 526377332 /nfs/dbraw/zinc/37/73/32/526377332.db2.gz SNSVEIXUUNFJOK-KGLIPLIRSA-N 1 2 310.319 4.336 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2sccc2Br)n1 ZINC000070733671 526437271 /nfs/dbraw/zinc/43/72/71/526437271.db2.gz ILNYCZMBPSDVJR-QMMMGPOBSA-N 1 2 317.277 4.126 20 0 DIADLO c1cncc([C@H]2CCC[C@H](Nc3ccc(N4CCCC4)c[nH+]3)C2)c1 ZINC000337372528 526550454 /nfs/dbraw/zinc/55/04/54/526550454.db2.gz DIVWWQCXMGPXHL-WMZOPIPTSA-N 1 2 322.456 4.215 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@@H](CCc1ccccc1)c1ccccc1 ZINC000237555536 526554444 /nfs/dbraw/zinc/55/44/44/526554444.db2.gz SYJBBSMKWVBZIX-FQEVSTJZSA-N 1 2 305.425 4.182 20 0 DIADLO Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]Cc1ccon1 ZINC000158324437 526574991 /nfs/dbraw/zinc/57/49/91/526574991.db2.gz SBPLCGRMHPDVLE-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1nc(-c2ccccc2)sc1C(=O)Nc1cc[nH+]cc1C ZINC000107285597 526603137 /nfs/dbraw/zinc/60/31/37/526603137.db2.gz LPPTUXIKZQWJMC-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[NH2+][C@@H](C)c1ccncc1F ZINC000338364291 526740940 /nfs/dbraw/zinc/74/09/40/526740940.db2.gz DXGFJZIRNCDDSB-LBPRGKRZSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1nc(C[NH+]2CCC(Oc3ccccc3Cl)CC2)cs1 ZINC000157328627 526851776 /nfs/dbraw/zinc/85/17/76/526851776.db2.gz VZWWTXACJNDVSC-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@](F)(c3ccccc3C)C2)sc1C ZINC000337377526 526871315 /nfs/dbraw/zinc/87/13/15/526871315.db2.gz AWUYIAWFKMKHDP-QGZVFWFLSA-N 1 2 304.434 4.139 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@](F)(c3ccccc3C)C2)sc1C ZINC000337377526 526871317 /nfs/dbraw/zinc/87/13/17/526871317.db2.gz AWUYIAWFKMKHDP-QGZVFWFLSA-N 1 2 304.434 4.139 20 0 DIADLO Cc1nc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)oc1C ZINC000180000609 526887369 /nfs/dbraw/zinc/88/73/69/526887369.db2.gz HDESRWDYOPHMLG-UHFFFAOYSA-N 1 2 324.346 4.479 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCCC2)no1 ZINC000182544824 526894546 /nfs/dbraw/zinc/89/45/46/526894546.db2.gz MZOYSHGKXJQBCS-INIZCTEOSA-N 1 2 305.809 4.053 20 0 DIADLO Cc1scc(C(=O)Nc2c[nH+]ccc2OC(C)(C)C)c1C ZINC000180464140 526908103 /nfs/dbraw/zinc/90/81/03/526908103.db2.gz VHSQKAYCXSIJBE-UHFFFAOYSA-N 1 2 304.415 4.190 20 0 DIADLO Clc1cccc(C2([NH2+]Cc3csc(C4CC4)n3)CC2)c1 ZINC000124427119 526974490 /nfs/dbraw/zinc/97/44/90/526974490.db2.gz RVZJJIWJIZVBRO-UHFFFAOYSA-N 1 2 304.846 4.453 20 0 DIADLO Cc1nc([C@H]([NH2+][C@@H](C)CC(C)C)c2ccc(Cl)cc2)no1 ZINC000179897760 527070659 /nfs/dbraw/zinc/07/06/59/527070659.db2.gz PLQSVCZNWFJSKD-XHDPSFHLSA-N 1 2 307.825 4.145 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2nc3ccccc3s2)cs1 ZINC000189750463 527081607 /nfs/dbraw/zinc/08/16/07/527081607.db2.gz AVQMGYWVEYMKOU-CQSZACIVSA-N 1 2 315.467 4.398 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2nc3ccccc3s2)cs1 ZINC000189750463 527081612 /nfs/dbraw/zinc/08/16/12/527081612.db2.gz AVQMGYWVEYMKOU-CQSZACIVSA-N 1 2 315.467 4.398 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2nc3ccccc3nc2C)cs1 ZINC000189783177 527081624 /nfs/dbraw/zinc/08/16/24/527081624.db2.gz OPMRIFMDGXBPBX-GOSISDBHSA-N 1 2 324.453 4.040 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2nc3ccccc3nc2C)cs1 ZINC000189783177 527081627 /nfs/dbraw/zinc/08/16/27/527081627.db2.gz OPMRIFMDGXBPBX-GOSISDBHSA-N 1 2 324.453 4.040 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)C[C@H]2CCCO2)c1C(C)C ZINC000191957010 527160037 /nfs/dbraw/zinc/16/00/37/527160037.db2.gz KEEIKAWNRHWBGD-CQSZACIVSA-N 1 2 312.413 4.174 20 0 DIADLO Cc1ncc(C[N@@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)s1 ZINC000338366692 527260496 /nfs/dbraw/zinc/26/04/96/527260496.db2.gz CEAKKORANGCARR-OAHLLOKOSA-N 1 2 310.825 4.176 20 0 DIADLO Cc1ncc(C[N@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)s1 ZINC000338366692 527260506 /nfs/dbraw/zinc/26/05/06/527260506.db2.gz CEAKKORANGCARR-OAHLLOKOSA-N 1 2 310.825 4.176 20 0 DIADLO O=C(Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1)c1sccc1F ZINC000339602800 527301002 /nfs/dbraw/zinc/30/10/02/527301002.db2.gz DIYXMERMZHEWBP-UHFFFAOYSA-N 1 2 315.373 4.283 20 0 DIADLO Cc1nc(N[C@H](c2cccc(C(F)(F)F)c2)C2CC2)cc[nH+]1 ZINC000338484456 527352969 /nfs/dbraw/zinc/35/29/69/527352969.db2.gz LOFOIEHORBRAAY-HNNXBMFYSA-N 1 2 307.319 4.367 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC=C(c3ccncc3)C2)s1 ZINC000289188785 535140980 /nfs/dbraw/zinc/14/09/80/535140980.db2.gz ARZDHGLYZNWAPS-UHFFFAOYSA-N 1 2 313.470 4.125 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC=C(c3ccncc3)C2)s1 ZINC000289188785 535140984 /nfs/dbraw/zinc/14/09/84/535140984.db2.gz ARZDHGLYZNWAPS-UHFFFAOYSA-N 1 2 313.470 4.125 20 0 DIADLO CCCC[C@@H](CC)C(=O)N1CCCC[C@@H]1c1[nH+]ccn1CC ZINC000366642721 535346158 /nfs/dbraw/zinc/34/61/58/535346158.db2.gz FKJZZULDNBGQTA-HZPDHXFCSA-N 1 2 305.466 4.173 20 0 DIADLO CCCc1nc(C[NH2+]C2(c3nc(C)cs3)CCC2)cs1 ZINC000274126774 535530050 /nfs/dbraw/zinc/53/00/50/535530050.db2.gz XUHZKWYDTQFQHS-UHFFFAOYSA-N 1 2 307.488 4.030 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1ccc(Cl)s1 ZINC000273485750 535806347 /nfs/dbraw/zinc/80/63/47/535806347.db2.gz JBQFQXQKUOPGAB-SECBINFHSA-N 1 2 313.854 4.323 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](c1ccccc1)c1cccc(F)c1 ZINC000297725668 536117373 /nfs/dbraw/zinc/11/73/73/536117373.db2.gz NKIIVIHKCZFARG-DNVCBOLYSA-N 1 2 323.415 4.482 20 0 DIADLO COCC[C@@H]([NH2+][C@H](C)c1csc(C(C)C)n1)c1ccco1 ZINC000274428564 536811729 /nfs/dbraw/zinc/81/17/29/536811729.db2.gz JMWIXBWRPKNXIQ-CHWSQXEVSA-N 1 2 308.447 4.288 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1csc(C)n1)c1cccc(Cl)c1 ZINC000288581273 536879610 /nfs/dbraw/zinc/87/96/10/536879610.db2.gz AANDOLMSNKQFJQ-HZMBPMFUSA-N 1 2 310.850 4.143 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2nnc(C(C)(C)C)s2)cc1C ZINC000272818757 536900658 /nfs/dbraw/zinc/90/06/58/536900658.db2.gz CSAGQYRQPZAFNE-LBPRGKRZSA-N 1 2 319.474 4.003 20 0 DIADLO COc1cc[nH+]cc1NCc1ccc(C)c(Br)c1C ZINC001201573169 1048322575 /nfs/dbraw/zinc/32/25/75/1048322575.db2.gz NVXYQNNMKYJKBD-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO Cc1cc(C)c(Nc2c[nH+]cc(C)c2C)c(Br)n1 ZINC001213525494 1050678449 /nfs/dbraw/zinc/67/84/49/1050678449.db2.gz ZUYCFIJHYWRICY-UHFFFAOYSA-N 1 2 306.207 4.216 20 0 DIADLO Cc1ccc(Br)cc1C[NH+]1Cc2ccccc2C1 ZINC000313774961 1052302740 /nfs/dbraw/zinc/30/27/40/1052302740.db2.gz GLQUIEDMRZPURH-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2cc(Cl)c(OC(C)C)c(Cl)c2)C1 ZINC001231727260 1053839679 /nfs/dbraw/zinc/83/96/79/1053839679.db2.gz DQCUFHONKQBMJX-GFCCVEGCSA-N 1 2 318.244 4.001 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2cc(Cl)c(OC(C)C)c(Cl)c2)C1 ZINC001231727260 1053839690 /nfs/dbraw/zinc/83/96/90/1053839690.db2.gz DQCUFHONKQBMJX-GFCCVEGCSA-N 1 2 318.244 4.001 20 0 DIADLO F[C@H]1CC[N@H+](Cc2cc(Br)c3ccccc3c2)C1 ZINC001250557889 1060894893 /nfs/dbraw/zinc/89/48/93/1060894893.db2.gz WOCIFTXOIOCXPV-ZDUSSCGKSA-N 1 2 308.194 4.146 20 0 DIADLO F[C@H]1CC[N@@H+](Cc2cc(Br)c3ccccc3c2)C1 ZINC001250557889 1060894902 /nfs/dbraw/zinc/89/49/02/1060894902.db2.gz WOCIFTXOIOCXPV-ZDUSSCGKSA-N 1 2 308.194 4.146 20 0 DIADLO CC(C)[C@@H]1[C@@H](C(C)C)C[N@@H+]1Cc1csc(C(F)(F)F)n1 ZINC001474521624 1062203838 /nfs/dbraw/zinc/20/38/38/1062203838.db2.gz NMNZBVRFZOKRLL-VXGBXAGGSA-N 1 2 306.397 4.274 20 0 DIADLO CC(C)[C@@H]1[C@@H](C(C)C)C[N@H+]1Cc1csc(C(F)(F)F)n1 ZINC001474521624 1062203860 /nfs/dbraw/zinc/20/38/60/1062203860.db2.gz NMNZBVRFZOKRLL-VXGBXAGGSA-N 1 2 306.397 4.274 20 0 DIADLO CCCC1(c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)CCC1 ZINC001211488171 1035524820 /nfs/dbraw/zinc/52/48/20/1035524820.db2.gz JPLWWEGFGXOJSS-UHFFFAOYSA-N 1 2 308.385 4.144 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3c(C)cccc3C(C)C)ccn12 ZINC000579728849 1035539056 /nfs/dbraw/zinc/53/90/56/1035539056.db2.gz KHCBLKKDGCWWCH-UHFFFAOYSA-N 1 2 307.397 4.327 20 0 DIADLO Cc1cc(NC(=O)C2c3ccccc3Oc3ccccc32)cc[nH+]1 ZINC000010163116 1035549269 /nfs/dbraw/zinc/54/92/69/1035549269.db2.gz PXZJCUVZRCRRKA-UHFFFAOYSA-N 1 2 316.360 4.266 20 0 DIADLO CC[N@H+](Cc1nc([C@H](c2ccc(C)cc2)C(C)C)no1)C1CC1 ZINC000579774167 1035580813 /nfs/dbraw/zinc/58/08/13/1035580813.db2.gz IOBRUMCOZLAKGK-SFHVURJKSA-N 1 2 313.445 4.150 20 0 DIADLO CC[N@@H+](Cc1nc([C@H](c2ccc(C)cc2)C(C)C)no1)C1CC1 ZINC000579774167 1035580826 /nfs/dbraw/zinc/58/08/26/1035580826.db2.gz IOBRUMCOZLAKGK-SFHVURJKSA-N 1 2 313.445 4.150 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2ccc(F)cc2)n1)c1ccccn1 ZINC000022742644 1035776006 /nfs/dbraw/zinc/77/60/06/1035776006.db2.gz CBJKDYCULDTHBY-LBPRGKRZSA-N 1 2 313.401 4.195 20 0 DIADLO C[N@H+](Cc1ccccc1F)Cc1cccc(F)c1OC(F)F ZINC001167076401 1035785497 /nfs/dbraw/zinc/78/54/97/1035785497.db2.gz GGZBNTFVJUFTKR-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO C[N@@H+](Cc1ccccc1F)Cc1cccc(F)c1OC(F)F ZINC001167076401 1035785506 /nfs/dbraw/zinc/78/55/06/1035785506.db2.gz GGZBNTFVJUFTKR-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO Clc1ccc(Cl)c(C[NH2+][C@@H](c2ccccn2)C2CC2)n1 ZINC000932384146 1035845306 /nfs/dbraw/zinc/84/53/06/1035845306.db2.gz PPTWIKAEYBCXCL-OAHLLOKOSA-N 1 2 308.212 4.024 20 0 DIADLO Clc1ccc(C[NH2+]Cc2nc(-c3ccccc3)cs2)o1 ZINC000069785176 1035858091 /nfs/dbraw/zinc/85/80/91/1035858091.db2.gz RTKPTEXEYCELOJ-UHFFFAOYSA-N 1 2 304.802 4.346 20 0 DIADLO CSc1cc(C(=O)Nc2c(C)cc(C)[nH+]c2C)ccc1F ZINC000179662834 1035920786 /nfs/dbraw/zinc/92/07/86/1035920786.db2.gz RUEHTGQLWYRXRN-UHFFFAOYSA-N 1 2 304.390 4.120 20 0 DIADLO CCCn1cc(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)cn1 ZINC000179733612 1035925416 /nfs/dbraw/zinc/92/54/16/1035925416.db2.gz ROLVXZQHBQLTPQ-ZDUSSCGKSA-N 1 2 314.458 4.096 20 0 DIADLO CCCn1cc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)cn1 ZINC000179733612 1035925435 /nfs/dbraw/zinc/92/54/35/1035925435.db2.gz ROLVXZQHBQLTPQ-ZDUSSCGKSA-N 1 2 314.458 4.096 20 0 DIADLO Clc1cccc(Cl)c1C1CC[NH+](Cc2ccnnc2)CC1 ZINC001139979834 1035953691 /nfs/dbraw/zinc/95/36/91/1035953691.db2.gz AJQGPVMMJPOMOH-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO COc1cc(Nc2c[nH+]c(C)cc2C)ccc1Br ZINC001213515632 1035970808 /nfs/dbraw/zinc/97/08/08/1035970808.db2.gz AAUCJLBZSXRAGJ-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO C[C@@]1(F)CC[N@H+](CCc2ccc(Cl)cc2Cl)C[C@H]1F ZINC001209081251 1036005867 /nfs/dbraw/zinc/00/58/67/1036005867.db2.gz NBLVQTBLXUFPSB-ZIAGYGMSSA-N 1 2 308.199 4.308 20 0 DIADLO C[C@@]1(F)CC[N@@H+](CCc2ccc(Cl)cc2Cl)C[C@H]1F ZINC001209081251 1036005891 /nfs/dbraw/zinc/00/58/91/1036005891.db2.gz NBLVQTBLXUFPSB-ZIAGYGMSSA-N 1 2 308.199 4.308 20 0 DIADLO C[C@@]1(F)CC[N@H+](CCc2ccc(Cl)cc2Cl)C[C@@H]1F ZINC001209081250 1036008387 /nfs/dbraw/zinc/00/83/87/1036008387.db2.gz NBLVQTBLXUFPSB-UONOGXRCSA-N 1 2 308.199 4.308 20 0 DIADLO C[C@@]1(F)CC[N@@H+](CCc2ccc(Cl)cc2Cl)C[C@@H]1F ZINC001209081250 1036008409 /nfs/dbraw/zinc/00/84/09/1036008409.db2.gz NBLVQTBLXUFPSB-UONOGXRCSA-N 1 2 308.199 4.308 20 0 DIADLO Cc1n[nH]cc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000180150688 1036044423 /nfs/dbraw/zinc/04/44/23/1036044423.db2.gz SEHTZSJDRFVGBG-HNNXBMFYSA-N 1 2 310.228 4.362 20 0 DIADLO Cc1n[nH]cc1C[N@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000180150688 1036044444 /nfs/dbraw/zinc/04/44/44/1036044444.db2.gz SEHTZSJDRFVGBG-HNNXBMFYSA-N 1 2 310.228 4.362 20 0 DIADLO CCSc1cc[nH+]c(N(C)[C@@H](C)c2ccccc2OC)c1 ZINC001167106897 1036088974 /nfs/dbraw/zinc/08/89/74/1036088974.db2.gz LGIWREHVUJAUOG-ZDUSSCGKSA-N 1 2 302.443 4.400 20 0 DIADLO CCC(CC)N(CC)c1cc([C@@H](CC(=O)OC)C2CC2)cc[nH+]1 ZINC001167111860 1036099372 /nfs/dbraw/zinc/09/93/72/1036099372.db2.gz ZSIGRBDHBJRKCW-KRWDZBQOSA-N 1 2 318.461 4.153 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155117692 1036132043 /nfs/dbraw/zinc/13/20/43/1036132043.db2.gz COPVPMIKSKZNFM-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155117692 1036132051 /nfs/dbraw/zinc/13/20/51/1036132051.db2.gz COPVPMIKSKZNFM-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1nc2ccc(F)cc2s1 ZINC000683352897 1036197572 /nfs/dbraw/zinc/19/75/72/1036197572.db2.gz LWQGOQQITPGWME-UHFFFAOYSA-N 1 2 306.328 4.210 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1nc2ccc(F)cc2s1 ZINC000683352897 1036197581 /nfs/dbraw/zinc/19/75/81/1036197581.db2.gz LWQGOQQITPGWME-UHFFFAOYSA-N 1 2 306.328 4.210 20 0 DIADLO CCC[N@H+](Cc1cnn(CC)n1)[C@@H](C)c1cc2ccccc2o1 ZINC001167179442 1036246603 /nfs/dbraw/zinc/24/66/03/1036246603.db2.gz ZVXDIQNCVIHYQR-AWEZNQCLSA-N 1 2 312.417 4.017 20 0 DIADLO CCC[N@@H+](Cc1cnn(CC)n1)[C@@H](C)c1cc2ccccc2o1 ZINC001167179442 1036246620 /nfs/dbraw/zinc/24/66/20/1036246620.db2.gz ZVXDIQNCVIHYQR-AWEZNQCLSA-N 1 2 312.417 4.017 20 0 DIADLO C[N@@H+](Cc1c(Cl)cccc1Cl)C[C@@H]1CC(C)(C)CO1 ZINC001167199456 1036263475 /nfs/dbraw/zinc/26/34/75/1036263475.db2.gz NMGAWHBQYNESRO-NSHDSACASA-N 1 2 302.245 4.240 20 0 DIADLO C[N@H+](Cc1c(Cl)cccc1Cl)C[C@@H]1CC(C)(C)CO1 ZINC001167199456 1036263492 /nfs/dbraw/zinc/26/34/92/1036263492.db2.gz NMGAWHBQYNESRO-NSHDSACASA-N 1 2 302.245 4.240 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1ncccc1Cl)CCC2 ZINC000528427156 1036278937 /nfs/dbraw/zinc/27/89/37/1036278937.db2.gz VFSXBAGSIPHGES-CQSZACIVSA-N 1 2 321.877 4.263 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1ncccc1Cl)CCC2 ZINC000528427156 1036278954 /nfs/dbraw/zinc/27/89/54/1036278954.db2.gz VFSXBAGSIPHGES-CQSZACIVSA-N 1 2 321.877 4.263 20 0 DIADLO C=Cc1cccc(Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)[nH+]c2)c1 ZINC001209915579 1036295827 /nfs/dbraw/zinc/29/58/27/1036295827.db2.gz NZIXJDPSIDVCLK-GASCZTMLSA-N 1 2 309.413 4.082 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cc(C(F)(F)F)ccc2F)cn1 ZINC001204478171 1036326293 /nfs/dbraw/zinc/32/62/93/1036326293.db2.gz UECGFGNGTNUMNF-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cc(C(F)(F)F)ccc2F)cn1 ZINC001204478171 1036326314 /nfs/dbraw/zinc/32/63/14/1036326314.db2.gz UECGFGNGTNUMNF-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO CCN(c1ccccc1)c1ccc(C[NH2+]Cc2cocn2)cc1 ZINC000237064929 1036332344 /nfs/dbraw/zinc/33/23/44/1036332344.db2.gz VKKGJRPZMQWUFI-UHFFFAOYSA-N 1 2 307.397 4.122 20 0 DIADLO Clc1ccc(C[NH2+]Cc2cc(-c3ccccc3)on2)s1 ZINC000237688488 1036393951 /nfs/dbraw/zinc/39/39/51/1036393951.db2.gz VCIJXKMXRCNELH-UHFFFAOYSA-N 1 2 304.802 4.346 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc(F)cc3cccnc32)no1 ZINC000046511321 1036469753 /nfs/dbraw/zinc/46/97/53/1036469753.db2.gz YDSDUPRJIRAZHU-QGZVFWFLSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cc(F)cc3cccnc32)no1 ZINC000046511321 1036469760 /nfs/dbraw/zinc/46/97/60/1036469760.db2.gz YDSDUPRJIRAZHU-QGZVFWFLSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@H]1CCCn2ccnc21 ZINC000655760898 1036526909 /nfs/dbraw/zinc/52/69/09/1036526909.db2.gz AHJNUPXWNLPXOH-GJZGRUSLSA-N 1 2 323.362 4.310 20 0 DIADLO CCC1(c2noc(-c3cccc(Cn4cc[nH+]c4)c3)n2)CCCC1 ZINC000683604171 1036546820 /nfs/dbraw/zinc/54/68/20/1036546820.db2.gz QACLHLQOPNLWIP-UHFFFAOYSA-N 1 2 322.412 4.203 20 0 DIADLO N#Cc1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1[N+](=O)[O-] ZINC000325535052 1036551961 /nfs/dbraw/zinc/55/19/61/1036551961.db2.gz LSUMJZMNOIKXTJ-UHFFFAOYSA-N 1 2 322.368 4.200 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)c(N(C)C)[nH+]1 ZINC001266516175 1036590377 /nfs/dbraw/zinc/59/03/77/1036590377.db2.gz UALTXHYNQJCBKR-ARFHVFGLSA-N 1 2 315.461 4.001 20 0 DIADLO COc1ccc(-c2ccccc2Nc2c[nH+]c(C)c(N)c2)cc1 ZINC001210289954 1036594337 /nfs/dbraw/zinc/59/43/37/1036594337.db2.gz BXNLVZXBQORUKE-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO Clc1cnc2oc(CNc3ccc(-n4cc[nH+]c4)cc3)cc2c1 ZINC001648864753 1036659483 /nfs/dbraw/zinc/65/94/83/1036659483.db2.gz XYBMKLXPACBUKO-UHFFFAOYSA-N 1 2 324.771 4.279 20 0 DIADLO Fc1cccc(Nc2cccc(Cn3cc[nH+]c3)c2)c1Cl ZINC001210542025 1036793898 /nfs/dbraw/zinc/79/38/98/1036793898.db2.gz ZXIXOHPDGIZBOI-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO CC(C)[C@H]1CC[C@@H](C)C[C@H]1c1noc(C[C@H](C)n2cc[nH+]c2)n1 ZINC000656041569 1036829749 /nfs/dbraw/zinc/82/97/49/1036829749.db2.gz AHGBZNWFTXJCMJ-QKPAOTATSA-N 1 2 316.449 4.246 20 0 DIADLO CC(C)[C@H]1CC[C@@H](C)C[C@H]1c1noc(C[C@@H](C)n2cc[nH+]c2)n1 ZINC000656041568 1036830867 /nfs/dbraw/zinc/83/08/67/1036830867.db2.gz AHGBZNWFTXJCMJ-KLHDSHLOSA-N 1 2 316.449 4.246 20 0 DIADLO Nc1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000315183034 1036831579 /nfs/dbraw/zinc/83/15/79/1036831579.db2.gz UMEIPXRCMTWDNZ-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000315183034 1036831605 /nfs/dbraw/zinc/83/16/05/1036831605.db2.gz UMEIPXRCMTWDNZ-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Fc1cc(F)c(F)c(C[NH2+]Cc2sccc2Cl)c1F ZINC000683771138 1036879711 /nfs/dbraw/zinc/87/97/11/1036879711.db2.gz IJDVZLAISZDHEY-UHFFFAOYSA-N 1 2 309.715 4.248 20 0 DIADLO O=C(Nc1ccc(C2CCC2)cc1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000683804632 1036945764 /nfs/dbraw/zinc/94/57/64/1036945764.db2.gz CESKQJZJBDSRDR-SFHVURJKSA-N 1 2 324.428 4.020 20 0 DIADLO CC(C)(C)c1nc(C[NH2+]C2(c3ccc(F)cc3)CC2)cs1 ZINC000530967568 1036948363 /nfs/dbraw/zinc/94/83/63/1036948363.db2.gz BBUWTSXLYOGWTF-UHFFFAOYSA-N 1 2 304.434 4.359 20 0 DIADLO CC(C)n1cc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)nn1 ZINC000580127470 1036968312 /nfs/dbraw/zinc/96/83/12/1036968312.db2.gz NARCXIQLHNBRQL-UHFFFAOYSA-N 1 2 320.440 4.177 20 0 DIADLO CC(C)n1cc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)nn1 ZINC000580127470 1036968324 /nfs/dbraw/zinc/96/83/24/1036968324.db2.gz NARCXIQLHNBRQL-UHFFFAOYSA-N 1 2 320.440 4.177 20 0 DIADLO Fc1c(F)c(F)c(C[N@@H+]2CCC[C@@H]2C2CCC2)c(F)c1F ZINC000728289986 1037032643 /nfs/dbraw/zinc/03/26/43/1037032643.db2.gz VCTLITFAHPWKOL-SNVBAGLBSA-N 1 2 305.290 4.147 20 0 DIADLO Fc1c(F)c(F)c(C[N@H+]2CCC[C@@H]2C2CCC2)c(F)c1F ZINC000728289986 1037032656 /nfs/dbraw/zinc/03/26/56/1037032656.db2.gz VCTLITFAHPWKOL-SNVBAGLBSA-N 1 2 305.290 4.147 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)Cc1csc(C)n1 ZINC000340657499 1037071531 /nfs/dbraw/zinc/07/15/31/1037071531.db2.gz GAYJWOFEMOGNLF-UHFFFAOYSA-N 1 2 300.427 4.392 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)Cc1csc(C)n1 ZINC000340657499 1037071544 /nfs/dbraw/zinc/07/15/44/1037071544.db2.gz GAYJWOFEMOGNLF-UHFFFAOYSA-N 1 2 300.427 4.392 20 0 DIADLO Cc1ccc(Nc2cc(OC(F)(F)F)c(Cl)cc2N)[nH+]c1 ZINC001211013367 1037094108 /nfs/dbraw/zinc/09/41/08/1037094108.db2.gz VSQOFZKTMAAJGC-UHFFFAOYSA-N 1 2 317.698 4.268 20 0 DIADLO c1c2ccccc2[nH]c1CNc1[nH+]c2ccccc2n1C1CC1 ZINC000683924523 1037106010 /nfs/dbraw/zinc/10/60/10/1037106010.db2.gz XEZOBNIYYPDRAZ-UHFFFAOYSA-N 1 2 302.381 4.465 20 0 DIADLO Fc1cc(NCc2cc3ccccc3[nH]2)ccc1-n1cc[nH+]c1 ZINC000683928534 1037116530 /nfs/dbraw/zinc/11/65/30/1037116530.db2.gz RMCXANZKCVQWCW-UHFFFAOYSA-N 1 2 306.344 4.105 20 0 DIADLO CC[C@@H](C)Oc1cccc(NCc2c[nH+]c3ccc(C)cn23)c1 ZINC000580469693 1037147675 /nfs/dbraw/zinc/14/76/75/1037147675.db2.gz DKHWSGSIKNCATA-OAHLLOKOSA-N 1 2 309.413 4.432 20 0 DIADLO CC[C@H](C)Oc1cccc(NCc2c[nH+]c3ccc(C)cn23)c1 ZINC000580469692 1037148507 /nfs/dbraw/zinc/14/85/07/1037148507.db2.gz DKHWSGSIKNCATA-HNNXBMFYSA-N 1 2 309.413 4.432 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@]23CCCC[C@H]2C3(F)F)c(C)[nH+]1 ZINC000622776309 1037196108 /nfs/dbraw/zinc/19/61/08/1037196108.db2.gz AIXRRCYSKUMSJY-CZUORRHYSA-N 1 2 308.372 4.161 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2noc(-c3ccccc3)n2)cc1 ZINC000047960167 1037212010 /nfs/dbraw/zinc/21/20/10/1037212010.db2.gz NMXQNGUDRNPQQK-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2noc(-c3ccccc3)n2)cc1 ZINC000047960167 1037212024 /nfs/dbraw/zinc/21/20/24/1037212024.db2.gz NMXQNGUDRNPQQK-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2noc(-c3ccccc3)n2)cc1 ZINC000047960168 1037212352 /nfs/dbraw/zinc/21/23/52/1037212352.db2.gz NMXQNGUDRNPQQK-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2noc(-c3ccccc3)n2)cc1 ZINC000047960168 1037212363 /nfs/dbraw/zinc/21/23/63/1037212363.db2.gz NMXQNGUDRNPQQK-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO CC(C)C[C@@H]1COCC[N@@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001167429689 1037248691 /nfs/dbraw/zinc/24/86/91/1037248691.db2.gz MILHSQBKFITFKF-MRXNPFEDSA-N 1 2 316.272 4.283 20 0 DIADLO CC(C)C[C@@H]1COCC[N@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001167429689 1037248695 /nfs/dbraw/zinc/24/86/95/1037248695.db2.gz MILHSQBKFITFKF-MRXNPFEDSA-N 1 2 316.272 4.283 20 0 DIADLO Cc1ncc(C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2F)o1 ZINC000692303462 1037286178 /nfs/dbraw/zinc/28/61/78/1037286178.db2.gz YQCGACXRDSPMAB-SSDOTTSWSA-N 1 2 303.164 4.280 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2ccc(F)cc2)o1)c1cscn1 ZINC000568778853 1037312920 /nfs/dbraw/zinc/31/29/20/1037312920.db2.gz JTRGHGMAPJTMLT-NSHDSACASA-N 1 2 302.374 4.393 20 0 DIADLO FC(F)(F)c1cccc([C@]2(F)CC[N@H+](CC3(F)CC3)C2)c1 ZINC000580905397 1037348836 /nfs/dbraw/zinc/34/88/36/1037348836.db2.gz HOGAFPVTNSOSRC-AWEZNQCLSA-N 1 2 305.290 4.078 20 0 DIADLO FC(F)(F)c1cccc([C@]2(F)CC[N@@H+](CC3(F)CC3)C2)c1 ZINC000580905397 1037348863 /nfs/dbraw/zinc/34/88/63/1037348863.db2.gz HOGAFPVTNSOSRC-AWEZNQCLSA-N 1 2 305.290 4.078 20 0 DIADLO Cc1c[nH+]cc(Nc2c(Cl)c(F)nc(F)c2Cl)c1C ZINC001213523461 1037374534 /nfs/dbraw/zinc/37/45/34/1037374534.db2.gz SPUVQSKSQZHCQG-UHFFFAOYSA-N 1 2 304.127 4.422 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1cc(Cl)nc(Cl)c1 ZINC000064030914 1037416714 /nfs/dbraw/zinc/41/67/14/1037416714.db2.gz SVYXMIJCLOYSGC-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1cc(Cl)nc(Cl)c1 ZINC000064030914 1037416721 /nfs/dbraw/zinc/41/67/21/1037416721.db2.gz SVYXMIJCLOYSGC-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO CC(C)CN(C(=O)C[C@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC000581134221 1037449036 /nfs/dbraw/zinc/44/90/36/1037449036.db2.gz NWAUNTALECQFFR-AWEZNQCLSA-N 1 2 319.836 4.177 20 0 DIADLO COc1cccc2c(N[C@@H](C)c3cnn(C(C)C)c3)cc[nH+]c12 ZINC000581170093 1037459737 /nfs/dbraw/zinc/45/97/37/1037459737.db2.gz IUFPBQBLFYVGIN-ZDUSSCGKSA-N 1 2 310.401 4.194 20 0 DIADLO COc1cc(Br)ccc1Nc1c[nH+]cc(C)c1C ZINC001213531006 1037468499 /nfs/dbraw/zinc/46/84/99/1037468499.db2.gz RTEOBFKWEPCUTP-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)c1Cl ZINC001204553747 1037489922 /nfs/dbraw/zinc/48/99/22/1037489922.db2.gz YAQXVRNHGBYBIE-KGLIPLIRSA-N 1 2 317.832 4.478 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCS[C@H]3CCCC[C@H]32)c1Cl ZINC001204553747 1037489934 /nfs/dbraw/zinc/48/99/34/1037489934.db2.gz YAQXVRNHGBYBIE-KGLIPLIRSA-N 1 2 317.832 4.478 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2csc(-c3ccco3)n2)o1 ZINC000067975098 1037527120 /nfs/dbraw/zinc/52/71/20/1037527120.db2.gz QIVOTNZPFFPTBZ-SMDDNHRTSA-N 1 2 314.410 4.409 20 0 DIADLO CCSc1nn(C[N@@H+]2CCC[C@@H](C(C)C)C2)c(=S)s1 ZINC000780494931 1037529211 /nfs/dbraw/zinc/52/92/11/1037529211.db2.gz FWFWHRPBFAFXJX-LLVKDONJSA-N 1 2 317.549 4.112 20 0 DIADLO CCSc1nn(C[N@H+]2CCC[C@@H](C(C)C)C2)c(=S)s1 ZINC000780494931 1037529225 /nfs/dbraw/zinc/52/92/25/1037529225.db2.gz FWFWHRPBFAFXJX-LLVKDONJSA-N 1 2 317.549 4.112 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC[C@@H]1c1ccccn1 ZINC000526047016 1037543377 /nfs/dbraw/zinc/54/33/77/1037543377.db2.gz PXZPGSKZPDBWGH-QGZVFWFLSA-N 1 2 319.408 4.288 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCc2ccc(O)cc2C1 ZINC000581342110 1037544369 /nfs/dbraw/zinc/54/43/69/1037544369.db2.gz WQCQMEUJKWRQIC-AWEZNQCLSA-N 1 2 320.392 4.167 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCc2ccc(O)cc2C1 ZINC000581342110 1037544379 /nfs/dbraw/zinc/54/43/79/1037544379.db2.gz WQCQMEUJKWRQIC-AWEZNQCLSA-N 1 2 320.392 4.167 20 0 DIADLO Cc1cc2c(s1)N(c1cc[nH+]cc1)c1ccccc1NC2=N ZINC001167456628 1037568634 /nfs/dbraw/zinc/56/86/34/1037568634.db2.gz JUTLQKFATYEABN-UHFFFAOYSA-N 1 2 306.394 4.272 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nc([C@H](C)OCC(C)C)no2)s1 ZINC000754667824 1037602377 /nfs/dbraw/zinc/60/23/77/1037602377.db2.gz LZODCSUZIVZEFI-STQMWFEESA-N 1 2 323.462 4.024 20 0 DIADLO COc1cc(C[N@@H+]2CCc3cc(Cl)ccc3C2)ccc1F ZINC001204559193 1037625018 /nfs/dbraw/zinc/62/50/18/1037625018.db2.gz QRAJRUMQEGYYHG-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(C[N@H+]2CCc3cc(Cl)ccc3C2)ccc1F ZINC001204559193 1037625027 /nfs/dbraw/zinc/62/50/27/1037625027.db2.gz QRAJRUMQEGYYHG-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2csc(Cl)c2)cs1 ZINC000276304558 1037691903 /nfs/dbraw/zinc/69/19/03/1037691903.db2.gz DKMZSZIWQUMVST-DTWKUNHWSA-N 1 2 316.879 4.416 20 0 DIADLO COc1ccccc1-c1ccc([C@H](C)[NH2+]Cc2cocn2)cc1 ZINC000581506670 1037702535 /nfs/dbraw/zinc/70/25/35/1037702535.db2.gz VXNKTNFNOYYCAM-AWEZNQCLSA-N 1 2 308.381 4.201 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)ccc1F ZINC001204561800 1037702568 /nfs/dbraw/zinc/70/25/68/1037702568.db2.gz VANARWVXSIQXBJ-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)ccc1F ZINC001204561800 1037702594 /nfs/dbraw/zinc/70/25/94/1037702594.db2.gz VANARWVXSIQXBJ-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2F)cn1 ZINC000692319993 1037718268 /nfs/dbraw/zinc/71/82/68/1037718268.db2.gz LAKQEVLDOQJGLK-VIFPVBQESA-N 1 2 314.191 4.082 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC=C(c3ccccn3)C2)cs1 ZINC000581556466 1037737611 /nfs/dbraw/zinc/73/76/11/1037737611.db2.gz HWEJAWMHCZYLGQ-UHFFFAOYSA-N 1 2 313.470 4.125 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC=C(c3ccccn3)C2)cs1 ZINC000581556466 1037737630 /nfs/dbraw/zinc/73/76/30/1037737630.db2.gz HWEJAWMHCZYLGQ-UHFFFAOYSA-N 1 2 313.470 4.125 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)CC2 ZINC000090228927 1037761662 /nfs/dbraw/zinc/76/16/62/1037761662.db2.gz GTQPVSQQNRFPON-CQSZACIVSA-N 1 2 313.269 4.159 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1c(F)c(F)cc(F)c1F ZINC000090228312 1037764494 /nfs/dbraw/zinc/76/44/94/1037764494.db2.gz WHGWNTOYYGDMRJ-VIFPVBQESA-N 1 2 313.294 4.102 20 0 DIADLO Cc1c[nH+]c(CNc2ccc3nc(C(C)C)sc3c2)n1C ZINC000341262886 1037823202 /nfs/dbraw/zinc/82/32/02/1037823202.db2.gz RERKJKHGSLJHRJ-UHFFFAOYSA-N 1 2 300.431 4.074 20 0 DIADLO Cc1cc(SC(C)(C)C)ccc1NC(=O)CCc1c[nH]c[nH+]1 ZINC000188851402 1037823576 /nfs/dbraw/zinc/82/35/76/1037823576.db2.gz SLWFNKZFAIFYMK-UHFFFAOYSA-N 1 2 317.458 4.180 20 0 DIADLO Cc1cc(SC(C)(C)C)ccc1NC(=O)CCc1c[nH+]c[nH]1 ZINC000188851402 1037823607 /nfs/dbraw/zinc/82/36/07/1037823607.db2.gz SLWFNKZFAIFYMK-UHFFFAOYSA-N 1 2 317.458 4.180 20 0 DIADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2Cc1csc(-c2ccco2)n1 ZINC000625683423 1037854591 /nfs/dbraw/zinc/85/45/91/1037854591.db2.gz DYAGSYSDIUEWNZ-TXEJJXNPSA-N 1 2 310.369 4.165 20 0 DIADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1csc(-c2ccco2)n1 ZINC000625683423 1037854611 /nfs/dbraw/zinc/85/46/11/1037854611.db2.gz DYAGSYSDIUEWNZ-TXEJJXNPSA-N 1 2 310.369 4.165 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)o1 ZINC000076804870 1037855020 /nfs/dbraw/zinc/85/50/20/1037855020.db2.gz IOBIVNUQOPTAPK-CYBMUJFWSA-N 1 2 303.406 4.077 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+]2CCCCC[C@@H]2c2ccco2)o1 ZINC000076804870 1037855040 /nfs/dbraw/zinc/85/50/40/1037855040.db2.gz IOBIVNUQOPTAPK-CYBMUJFWSA-N 1 2 303.406 4.077 20 0 DIADLO c1sc(-c2ccccn2)nc1CNc1c[nH+]cc2c1CCCC2 ZINC000656775743 1037861588 /nfs/dbraw/zinc/86/15/88/1037861588.db2.gz AARBUICANAPGOQ-UHFFFAOYSA-N 1 2 322.437 4.091 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2c(C)oc3ccccc32)s1 ZINC000926162252 1037862208 /nfs/dbraw/zinc/86/22/08/1037862208.db2.gz ANUKKIKFTBKUJR-VHSXEESVSA-N 1 2 301.415 4.313 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2csc(C(C)C)n2)cc1[N+](=O)[O-] ZINC000076900199 1037865099 /nfs/dbraw/zinc/86/50/99/1037865099.db2.gz DRZNXDPTNNDIEK-LBPRGKRZSA-N 1 2 319.430 4.334 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2csc(C(F)(F)F)c2)s1 ZINC000926163342 1037880980 /nfs/dbraw/zinc/88/09/80/1037880980.db2.gz HCCFSDWHPRBGIJ-BQBZGAKWSA-N 1 2 321.393 4.339 20 0 DIADLO Cc1ccc(Cl)nc1C[N@@H+](CC(=O)c1ccccc1)C(C)C ZINC001140443956 1037903551 /nfs/dbraw/zinc/90/35/51/1037903551.db2.gz GMPYMMBBYQZQGL-UHFFFAOYSA-N 1 2 316.832 4.137 20 0 DIADLO Cc1ccc(Cl)nc1C[N@H+](CC(=O)c1ccccc1)C(C)C ZINC001140443956 1037903562 /nfs/dbraw/zinc/90/35/62/1037903562.db2.gz GMPYMMBBYQZQGL-UHFFFAOYSA-N 1 2 316.832 4.137 20 0 DIADLO C[C@@]1([NH2+]Cc2c(Cl)cncc2Cl)CCOc2ccccc21 ZINC000933371777 1037909394 /nfs/dbraw/zinc/90/93/94/1037909394.db2.gz VMRSWZGHGCYINE-MRXNPFEDSA-N 1 2 323.223 4.176 20 0 DIADLO C[C@]1([NH2+]Cc2nc(Cl)ccc2Cl)CCOc2ccccc21 ZINC000933374663 1037923319 /nfs/dbraw/zinc/92/33/19/1037923319.db2.gz NCFUOAKEIDYFED-INIZCTEOSA-N 1 2 323.223 4.176 20 0 DIADLO CCCc1cc(N[C@@H](C)c2ccc(F)cn2)nc(CCC)[nH+]1 ZINC001167479407 1037934920 /nfs/dbraw/zinc/93/49/20/1037934920.db2.gz MEXGOLPWIUDLHH-LBPRGKRZSA-N 1 2 302.397 4.089 20 0 DIADLO CCOc1ccc(C[NH2+]Cc2ncc(Cl)s2)cc1Cl ZINC000341376394 1037941141 /nfs/dbraw/zinc/94/11/41/1037941141.db2.gz XVGOZHMDQUYROC-UHFFFAOYSA-N 1 2 317.241 4.138 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1cccc(=O)[nH]1 ZINC000933396618 1037952809 /nfs/dbraw/zinc/95/28/09/1037952809.db2.gz XNNMXADGXYLEHQ-JTQLQIEISA-N 1 2 311.212 4.287 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1cccc(=O)[nH]1 ZINC000933396618 1037952818 /nfs/dbraw/zinc/95/28/18/1037952818.db2.gz XNNMXADGXYLEHQ-JTQLQIEISA-N 1 2 311.212 4.287 20 0 DIADLO COCCCC[C@@H]([NH2+]Cc1n[nH]c2ccccc21)c1ccccc1 ZINC000684410762 1037955906 /nfs/dbraw/zinc/95/59/06/1037955906.db2.gz ITEMGRZFCJFOKD-GOSISDBHSA-N 1 2 323.440 4.211 20 0 DIADLO C[N@H+](Cc1cnc(CC(F)(F)F)s1)Cc1ccccc1F ZINC000891476629 1037979029 /nfs/dbraw/zinc/97/90/29/1037979029.db2.gz SIDGXFAEKXPPRI-UHFFFAOYSA-N 1 2 318.339 4.019 20 0 DIADLO C[N@@H+](Cc1cnc(CC(F)(F)F)s1)Cc1ccccc1F ZINC000891476629 1037979040 /nfs/dbraw/zinc/97/90/40/1037979040.db2.gz SIDGXFAEKXPPRI-UHFFFAOYSA-N 1 2 318.339 4.019 20 0 DIADLO CCn1cc(C[N@H+](Cc2ccco2)Cc2ccccc2)c(C)n1 ZINC000891487910 1037984811 /nfs/dbraw/zinc/98/48/11/1037984811.db2.gz PIKTWQOPFNVDMN-UHFFFAOYSA-N 1 2 309.413 4.007 20 0 DIADLO CCn1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2)c(C)n1 ZINC000891487910 1037984830 /nfs/dbraw/zinc/98/48/30/1037984830.db2.gz PIKTWQOPFNVDMN-UHFFFAOYSA-N 1 2 309.413 4.007 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(C(F)(F)F)cnc2Cl)[C@@H](C)C1 ZINC001232009941 1037998417 /nfs/dbraw/zinc/99/84/17/1037998417.db2.gz WMTREAUSQKVHDF-ZJUUUORDSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(C(F)(F)F)cnc2Cl)[C@@H](C)C1 ZINC001232009941 1037998430 /nfs/dbraw/zinc/99/84/30/1037998430.db2.gz WMTREAUSQKVHDF-ZJUUUORDSA-N 1 2 306.759 4.374 20 0 DIADLO COc1ccc(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)o1 ZINC000891517906 1038008120 /nfs/dbraw/zinc/00/81/20/1038008120.db2.gz ZSUANXZLQJZYQT-NSHDSACASA-N 1 2 302.399 4.091 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)o1 ZINC000891517906 1038008131 /nfs/dbraw/zinc/00/81/31/1038008131.db2.gz ZSUANXZLQJZYQT-NSHDSACASA-N 1 2 302.399 4.091 20 0 DIADLO CC(C)(CC(=O)N1CCC[C@@H](n2cc[nH+]c2)C1)C1CCCCC1 ZINC000684430558 1038021219 /nfs/dbraw/zinc/02/12/19/1038021219.db2.gz AAIRGKIQLQUPPW-QGZVFWFLSA-N 1 2 317.477 4.043 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000602572526 1038039571 /nfs/dbraw/zinc/03/95/71/1038039571.db2.gz ORJBNMSTRYMSGF-QWRGUYRKSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000602572526 1038039602 /nfs/dbraw/zinc/03/96/02/1038039602.db2.gz ORJBNMSTRYMSGF-QWRGUYRKSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1nc(Cl)ccc1Br ZINC001232060907 1038049435 /nfs/dbraw/zinc/04/94/35/1038049435.db2.gz JOTDGLHFMDNIEW-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1nc(Cl)ccc1Br ZINC001232060907 1038049457 /nfs/dbraw/zinc/04/94/57/1038049457.db2.gz JOTDGLHFMDNIEW-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nc(Cl)ccc2Br)[C@H](C)C1 ZINC001232060905 1038051187 /nfs/dbraw/zinc/05/11/87/1038051187.db2.gz JOTDGLHFMDNIEW-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nc(Cl)ccc2Br)[C@H](C)C1 ZINC001232060905 1038051204 /nfs/dbraw/zinc/05/12/04/1038051204.db2.gz JOTDGLHFMDNIEW-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO O=C(CCc1c[nH]c[nH+]1)Nc1cccc(Sc2ccccc2)c1 ZINC000684437595 1038052106 /nfs/dbraw/zinc/05/21/06/1038052106.db2.gz UDWNHZVARKCETO-UHFFFAOYSA-N 1 2 323.421 4.132 20 0 DIADLO O=C(CCc1c[nH+]c[nH]1)Nc1cccc(Sc2ccccc2)c1 ZINC000684437595 1038052124 /nfs/dbraw/zinc/05/21/24/1038052124.db2.gz UDWNHZVARKCETO-UHFFFAOYSA-N 1 2 323.421 4.132 20 0 DIADLO Cc1cc(N(C)[C@@H](C)c2ccc(F)c(F)c2)nc(C2CC2)[nH+]1 ZINC000341511234 1038063404 /nfs/dbraw/zinc/06/34/04/1038063404.db2.gz ZXAADXNUAHPQDH-NSHDSACASA-N 1 2 303.356 4.138 20 0 DIADLO Cc1noc2ncnc(Nc3ccc([NH2+]CC4CCCC4)cc3)c12 ZINC000669651226 1038073722 /nfs/dbraw/zinc/07/37/22/1038073722.db2.gz KRSVDBRXIYZGHA-UHFFFAOYSA-N 1 2 323.400 4.272 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1cnn(C2CCC2)c1 ZINC000891605655 1038074847 /nfs/dbraw/zinc/07/48/47/1038074847.db2.gz AJUUFBXXTOHJFS-GFCCVEGCSA-N 1 2 305.372 4.079 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cnn(C2CCC2)c1 ZINC000891605655 1038074866 /nfs/dbraw/zinc/07/48/66/1038074866.db2.gz AJUUFBXXTOHJFS-GFCCVEGCSA-N 1 2 305.372 4.079 20 0 DIADLO CC[N@H+](Cc1nc(C(C)(C)C)co1)Cc1ccc(OC)cc1 ZINC000891627486 1038087393 /nfs/dbraw/zinc/08/73/93/1038087393.db2.gz YRBFVGPILJJFMU-UHFFFAOYSA-N 1 2 302.418 4.003 20 0 DIADLO CC[N@@H+](Cc1nc(C(C)(C)C)co1)Cc1ccc(OC)cc1 ZINC000891627486 1038087411 /nfs/dbraw/zinc/08/74/11/1038087411.db2.gz YRBFVGPILJJFMU-UHFFFAOYSA-N 1 2 302.418 4.003 20 0 DIADLO Cc1cccc(-c2noc(C[N@@H+](C)[C@@H](C)c3cccs3)n2)c1 ZINC000029710487 1038114749 /nfs/dbraw/zinc/11/47/49/1038114749.db2.gz KRFSWSDFATWQRW-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1cccc(-c2noc(C[N@H+](C)[C@@H](C)c3cccs3)n2)c1 ZINC000029710487 1038114764 /nfs/dbraw/zinc/11/47/64/1038114764.db2.gz KRFSWSDFATWQRW-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@H+](C)Cc1ccc(C)s1 ZINC000341564993 1038136828 /nfs/dbraw/zinc/13/68/28/1038136828.db2.gz MDHXZGBVSFGGPH-UHFFFAOYSA-N 1 2 317.433 4.197 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@@H+](C)Cc1ccc(C)s1 ZINC000341564993 1038136831 /nfs/dbraw/zinc/13/68/31/1038136831.db2.gz MDHXZGBVSFGGPH-UHFFFAOYSA-N 1 2 317.433 4.197 20 0 DIADLO CC(C)n1ccnc1C[NH2+][C@@H](CC(F)(F)F)c1ccccc1 ZINC000341588557 1038155739 /nfs/dbraw/zinc/15/57/39/1038155739.db2.gz LHIRFGCEJJCNCH-AWEZNQCLSA-N 1 2 311.351 4.247 20 0 DIADLO CC(C)n1ccnc1C[NH2+][C@H](CC(F)(F)F)c1ccccc1 ZINC000341588560 1038157117 /nfs/dbraw/zinc/15/71/17/1038157117.db2.gz LHIRFGCEJJCNCH-CQSZACIVSA-N 1 2 311.351 4.247 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1OC(F)(F)F)c1cscn1 ZINC000581955159 1038172011 /nfs/dbraw/zinc/17/20/11/1038172011.db2.gz WMEIKXCNCHTARP-VHSXEESVSA-N 1 2 316.348 4.454 20 0 DIADLO Fc1cccc(C[N@@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC000581951169 1038172367 /nfs/dbraw/zinc/17/23/67/1038172367.db2.gz FPMBLWOLECWSTB-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1cccc(C[N@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC000581951169 1038172370 /nfs/dbraw/zinc/17/23/70/1038172370.db2.gz FPMBLWOLECWSTB-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cc2occc2s1 ZINC000684509440 1038195673 /nfs/dbraw/zinc/19/56/73/1038195673.db2.gz IDCIZWXHGKTJRP-UHFFFAOYSA-N 1 2 323.377 4.445 20 0 DIADLO CCC(=CC(=O)Nc1cc(C)[nH+]cc1C)c1cccc(Cl)c1 ZINC001266899467 1038206453 /nfs/dbraw/zinc/20/64/53/1038206453.db2.gz DSLBHROJDGZAQS-GXDHUFHOSA-N 1 2 314.816 4.206 20 0 DIADLO CSCc1cnc(C[NH2+][C@@H](c2ccccn2)C2CCC2)s1 ZINC000598993873 1038210792 /nfs/dbraw/zinc/21/07/92/1038210792.db2.gz SXGIZMJIVHKJGC-MRXNPFEDSA-N 1 2 319.499 4.032 20 0 DIADLO CCc1ccc(-c2noc([C@@H](C)[NH2+]Cc3cccs3)n2)cc1 ZINC000276786361 1038213355 /nfs/dbraw/zinc/21/33/55/1038213355.db2.gz RRVLNYFCHWCQQU-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)n1 ZINC000891847790 1038231738 /nfs/dbraw/zinc/23/17/38/1038231738.db2.gz RBWVAYKCHNPTII-UHFFFAOYSA-N 1 2 314.429 4.090 20 0 DIADLO CC(C)(C)c1coc(C[N@H+](Cc2cccc(O)c2)CC2CC2)n1 ZINC000891847790 1038231749 /nfs/dbraw/zinc/23/17/49/1038231749.db2.gz RBWVAYKCHNPTII-UHFFFAOYSA-N 1 2 314.429 4.090 20 0 DIADLO CCC(=O)Nc1cccc(CNc2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC000891884381 1038256569 /nfs/dbraw/zinc/25/65/69/1038256569.db2.gz UWHCJNHIFJGOKV-UHFFFAOYSA-N 1 2 324.428 4.013 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2noc3c2CCCC3)[C@@H](c2ccco2)C1 ZINC000247475264 1038257746 /nfs/dbraw/zinc/25/77/46/1038257746.db2.gz JPHUPXKRFHUZEM-CZUORRHYSA-N 1 2 300.402 4.120 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2noc3c2CCCC3)[C@@H](c2ccco2)C1 ZINC000247475264 1038257754 /nfs/dbraw/zinc/25/77/54/1038257754.db2.gz JPHUPXKRFHUZEM-CZUORRHYSA-N 1 2 300.402 4.120 20 0 DIADLO Oc1ccc2ccccc2c1/C=[NH+]/C[C@@H]1COc2ccccc2C1 ZINC000061242145 1038270496 /nfs/dbraw/zinc/27/04/96/1038270496.db2.gz BCTUZNLPDNEIHX-IKMPRTQCSA-N 1 2 317.388 4.216 20 0 DIADLO CCn1ccnc1C[N@H+](C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000341809230 1038274769 /nfs/dbraw/zinc/27/47/69/1038274769.db2.gz NHVLFTZGPNICAQ-LBPRGKRZSA-N 1 2 311.351 4.115 20 0 DIADLO CCn1ccnc1C[N@@H+](C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000341809230 1038274777 /nfs/dbraw/zinc/27/47/77/1038274777.db2.gz NHVLFTZGPNICAQ-LBPRGKRZSA-N 1 2 311.351 4.115 20 0 DIADLO CCCCCC[C@](C)(CCC)C(=O)N1CC(n2cc[nH+]c2)C1 ZINC000742675372 1038281745 /nfs/dbraw/zinc/28/17/45/1038281745.db2.gz BXIVYOVDGLNTJP-SFHVURJKSA-N 1 2 305.466 4.043 20 0 DIADLO Clc1cccc2c(N(Cc3cccnc3)C3CC3)cc[nH+]c12 ZINC000341826408 1038284818 /nfs/dbraw/zinc/28/48/18/1038284818.db2.gz SSLRIFKDHSSXRJ-UHFFFAOYSA-N 1 2 309.800 4.452 20 0 DIADLO CCC1(Cc2nc(-c3ccccc3-n3cc[nH+]c3)no2)CCC1 ZINC001211527575 1038287665 /nfs/dbraw/zinc/28/76/65/1038287665.db2.gz OMIIKWZVPNKXSW-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO CC(C)[C@@H](CC(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000603884935 1038312935 /nfs/dbraw/zinc/31/29/35/1038312935.db2.gz NVKNTWMJUGUODU-QGZVFWFLSA-N 1 2 307.397 4.103 20 0 DIADLO Cc1c(C(=O)Nc2cc(C)[nH+]cc2C)sc2cccc(F)c12 ZINC000535748226 1038326908 /nfs/dbraw/zinc/32/69/08/1038326908.db2.gz WPTTYWFDHJAYMA-UHFFFAOYSA-N 1 2 314.385 4.035 20 0 DIADLO Cc1c(C(=O)Nc2cc(C)[nH+]cc2C)oc2c1c(C)ccc2C ZINC000535748208 1038327060 /nfs/dbraw/zinc/32/70/60/1038327060.db2.gz QWYTXFUALAVABY-UHFFFAOYSA-N 1 2 308.381 4.044 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+](CC)Cc1cccc(F)c1 ZINC000535781628 1038334348 /nfs/dbraw/zinc/33/43/48/1038334348.db2.gz KJJUUBQDDIRBQK-UHFFFAOYSA-N 1 2 311.404 4.217 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+](CC)Cc1cccc(F)c1 ZINC000535781628 1038334363 /nfs/dbraw/zinc/33/43/63/1038334363.db2.gz KJJUUBQDDIRBQK-UHFFFAOYSA-N 1 2 311.404 4.217 20 0 DIADLO COc1ccc(C[N@H+](C)[C@H](C)c2c(F)cccc2F)cc1OC ZINC000535785811 1038336869 /nfs/dbraw/zinc/33/68/69/1038336869.db2.gz HQFOAZMUKTYFSI-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@H](C)c2c(F)cccc2F)cc1OC ZINC000535785811 1038336884 /nfs/dbraw/zinc/33/68/84/1038336884.db2.gz HQFOAZMUKTYFSI-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC000342048888 1038380473 /nfs/dbraw/zinc/38/04/73/1038380473.db2.gz NKHHEHMOJLPXMM-UONOGXRCSA-N 1 2 322.412 4.106 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC000342048884 1038381851 /nfs/dbraw/zinc/38/18/51/1038381851.db2.gz NKHHEHMOJLPXMM-KBPBESRZSA-N 1 2 322.412 4.106 20 0 DIADLO Cc1cc(Br)c(C[NH+]2CCC(F)(F)CC2)cc1F ZINC001232467178 1038430515 /nfs/dbraw/zinc/43/05/15/1038430515.db2.gz CVGCBQJZHRCJCG-UHFFFAOYSA-N 1 2 322.168 4.128 20 0 DIADLO Cc1noc([C@H](C)[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)n1 ZINC000657199469 1038433226 /nfs/dbraw/zinc/43/32/26/1038433226.db2.gz ZKYRCAMGNNCSDZ-WMLDXEAASA-N 1 2 311.429 4.446 20 0 DIADLO Cc1noc([C@H](C)[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)n1 ZINC000657199469 1038433230 /nfs/dbraw/zinc/43/32/30/1038433230.db2.gz ZKYRCAMGNNCSDZ-WMLDXEAASA-N 1 2 311.429 4.446 20 0 DIADLO C[C@H](CC(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1cccc(F)c1 ZINC000604700103 1038437675 /nfs/dbraw/zinc/43/76/75/1038437675.db2.gz RMXGMZFLJUBVLC-CQSZACIVSA-N 1 2 323.371 4.144 20 0 DIADLO Cc1cc(N2CCC[C@](C)(c3ccccc3)C2)nc(C2CC2)[nH+]1 ZINC000604756521 1038449327 /nfs/dbraw/zinc/44/93/27/1038449327.db2.gz JISNTAOUEVRGKI-FQEVSTJZSA-N 1 2 307.441 4.221 20 0 DIADLO C[N@H+](Cc1cc(F)cc(F)c1)Cc1ccc(C(F)(F)F)cn1 ZINC000342123605 1038449604 /nfs/dbraw/zinc/44/96/04/1038449604.db2.gz HBMMJYXPIKJASQ-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO C[N@@H+](Cc1cc(F)cc(F)c1)Cc1ccc(C(F)(F)F)cn1 ZINC000342123605 1038449613 /nfs/dbraw/zinc/44/96/13/1038449613.db2.gz HBMMJYXPIKJASQ-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1ccn(C(C)C)n1 ZINC000604885397 1038461329 /nfs/dbraw/zinc/46/13/29/1038461329.db2.gz MFQBWYATZRXZQE-SFHVURJKSA-N 1 2 313.445 4.200 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1ccn(C(C)C)n1 ZINC000604885397 1038461337 /nfs/dbraw/zinc/46/13/37/1038461337.db2.gz MFQBWYATZRXZQE-SFHVURJKSA-N 1 2 313.445 4.200 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nnc([C@@H](C)CC)[nH]1)c1cc(F)ccc1F ZINC000277232731 1038461297 /nfs/dbraw/zinc/46/12/97/1038461297.db2.gz MJOWPZPNZKHEMF-FIXISWKDSA-N 1 2 322.403 4.398 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)Cc1ccn(C(C)C)n1 ZINC000604884118 1038461738 /nfs/dbraw/zinc/46/17/38/1038461738.db2.gz UGCBVADDKYQVLQ-UHFFFAOYSA-N 1 2 311.429 4.405 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)Cc1ccn(C(C)C)n1 ZINC000604884118 1038461740 /nfs/dbraw/zinc/46/17/40/1038461740.db2.gz UGCBVADDKYQVLQ-UHFFFAOYSA-N 1 2 311.429 4.405 20 0 DIADLO CCc1noc(C[N@@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC000605000249 1038476244 /nfs/dbraw/zinc/47/62/44/1038476244.db2.gz APLOZFQKWHUBHJ-OAHLLOKOSA-N 1 2 319.836 4.403 20 0 DIADLO CCc1noc(C[N@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC000605000249 1038476246 /nfs/dbraw/zinc/47/62/46/1038476246.db2.gz APLOZFQKWHUBHJ-OAHLLOKOSA-N 1 2 319.836 4.403 20 0 DIADLO CCCC[C@H](CC)CC(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000605022207 1038478907 /nfs/dbraw/zinc/47/89/07/1038478907.db2.gz WVEIIMBDNTZNSC-INIZCTEOSA-N 1 2 313.445 4.095 20 0 DIADLO Cc1cccc([C@H]2CCCCC[N@@H+]2Cc2noc(C3CC3)n2)c1 ZINC000605157226 1038494209 /nfs/dbraw/zinc/49/42/09/1038494209.db2.gz ZCYRPIUNUSMEBR-QGZVFWFLSA-N 1 2 311.429 4.373 20 0 DIADLO Cc1cccc([C@H]2CCCCC[N@H+]2Cc2noc(C3CC3)n2)c1 ZINC000605157226 1038494214 /nfs/dbraw/zinc/49/42/14/1038494214.db2.gz ZCYRPIUNUSMEBR-QGZVFWFLSA-N 1 2 311.429 4.373 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1ncc(-c2ccccc2)o1 ZINC000103484495 1038507274 /nfs/dbraw/zinc/50/72/74/1038507274.db2.gz ULRVEMZMKNFELB-UHFFFAOYSA-N 1 2 322.408 4.375 20 0 DIADLO COc1ccc(Cl)cc1COc1ccccc1-n1cc[nH+]c1 ZINC000605434233 1038516407 /nfs/dbraw/zinc/51/64/07/1038516407.db2.gz PXYNPCQVEDQHEW-UHFFFAOYSA-N 1 2 314.772 4.113 20 0 DIADLO COc1c(C)c[nH+]c(CSc2ncnc3sccc32)c1C ZINC000605446446 1038517716 /nfs/dbraw/zinc/51/77/16/1038517716.db2.gz JUFGAFHDPUTTIS-UHFFFAOYSA-N 1 2 317.439 4.004 20 0 DIADLO Cc1ccc(F)c(C[NH2+][C@H](C)c2nccn2-c2ccccc2)c1 ZINC000342298365 1038520964 /nfs/dbraw/zinc/52/09/64/1038520964.db2.gz SHXDBIMVZWKFNX-OAHLLOKOSA-N 1 2 309.388 4.171 20 0 DIADLO Cc1cc(N2CCC(c3ccccc3F)CC2)nc(C2CC2)[nH+]1 ZINC000605570295 1038535373 /nfs/dbraw/zinc/53/53/73/1038535373.db2.gz CNJKWZUQCHFOSD-UHFFFAOYSA-N 1 2 311.404 4.186 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2ccc(Br)cc2)n1 ZINC000724374353 1038537979 /nfs/dbraw/zinc/53/79/79/1038537979.db2.gz VUEQPYUPPMRNIA-UHFFFAOYSA-N 1 2 323.234 4.024 20 0 DIADLO COc1ncc(Nc2cc[nH+]c3cc(Cl)ccc23)cc1F ZINC001203404314 1038546401 /nfs/dbraw/zinc/54/64/01/1038546401.db2.gz CJLIJQZJYFXPEL-UHFFFAOYSA-N 1 2 303.724 4.175 20 0 DIADLO Cc1cn2cc(NC(=O)CC/C=C/c3ccccc3)ccc2[nH+]1 ZINC000606188058 1038569878 /nfs/dbraw/zinc/56/98/78/1038569878.db2.gz OKNWPTVEGPKEJR-WEVVVXLNSA-N 1 2 305.381 4.075 20 0 DIADLO C/C(=C/C(C)(C)C)C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000588499825 1038574465 /nfs/dbraw/zinc/57/44/65/1038574465.db2.gz KAYVDUAEEMVMHN-RAXLEYEMSA-N 1 2 321.490 4.060 20 0 DIADLO C[C@H](c1ccco1)[N@H+](Cc1nc2cc(F)ccc2o1)C1CC1 ZINC000152205926 1038585905 /nfs/dbraw/zinc/58/59/05/1038585905.db2.gz FRUYIIUVQQQTDY-LLVKDONJSA-N 1 2 300.333 4.286 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](Cc1nc2cc(F)ccc2o1)C1CC1 ZINC000152205926 1038585912 /nfs/dbraw/zinc/58/59/12/1038585912.db2.gz FRUYIIUVQQQTDY-LLVKDONJSA-N 1 2 300.333 4.286 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000606432799 1038601454 /nfs/dbraw/zinc/60/14/54/1038601454.db2.gz MAGVMRXRKBUTHU-RTBURBONSA-N 1 2 317.379 4.489 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000606432799 1038601459 /nfs/dbraw/zinc/60/14/59/1038601459.db2.gz MAGVMRXRKBUTHU-RTBURBONSA-N 1 2 317.379 4.489 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000606432797 1038601665 /nfs/dbraw/zinc/60/16/65/1038601665.db2.gz MAGVMRXRKBUTHU-OALUTQOASA-N 1 2 317.379 4.489 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000606432797 1038601667 /nfs/dbraw/zinc/60/16/67/1038601667.db2.gz MAGVMRXRKBUTHU-OALUTQOASA-N 1 2 317.379 4.489 20 0 DIADLO C[C@H]1c2ccc(F)cc2CC[N@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000606448936 1038603381 /nfs/dbraw/zinc/60/33/81/1038603381.db2.gz JZVHSBUXTLLTEI-ZDUSSCGKSA-N 1 2 322.383 4.109 20 0 DIADLO C[C@H]1c2ccc(F)cc2CC[N@@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000606448936 1038603387 /nfs/dbraw/zinc/60/33/87/1038603387.db2.gz JZVHSBUXTLLTEI-ZDUSSCGKSA-N 1 2 322.383 4.109 20 0 DIADLO CCCCc1noc(C[N@@H+]2CCCCC[C@H]2c2ccc(C)o2)n1 ZINC000606454239 1038604560 /nfs/dbraw/zinc/60/45/60/1038604560.db2.gz BCBMSXOSKURZEJ-HNNXBMFYSA-N 1 2 317.433 4.431 20 0 DIADLO CCCCc1noc(C[N@H+]2CCCCC[C@H]2c2ccc(C)o2)n1 ZINC000606454239 1038604565 /nfs/dbraw/zinc/60/45/65/1038604565.db2.gz BCBMSXOSKURZEJ-HNNXBMFYSA-N 1 2 317.433 4.431 20 0 DIADLO CCCCc1noc(C[N@@H+]2CCCCC[C@@H]2c2ccc(C)o2)n1 ZINC000606454240 1038604773 /nfs/dbraw/zinc/60/47/73/1038604773.db2.gz BCBMSXOSKURZEJ-OAHLLOKOSA-N 1 2 317.433 4.431 20 0 DIADLO CCCCc1noc(C[N@H+]2CCCCC[C@@H]2c2ccc(C)o2)n1 ZINC000606454240 1038604778 /nfs/dbraw/zinc/60/47/78/1038604778.db2.gz BCBMSXOSKURZEJ-OAHLLOKOSA-N 1 2 317.433 4.431 20 0 DIADLO Clc1cccc2c1[C@H]([NH2+]Cc1cnc(C3CCC3)s1)CO2 ZINC000342454398 1038614504 /nfs/dbraw/zinc/61/45/04/1038614504.db2.gz VTYOZIKDTHOXCY-CYBMUJFWSA-N 1 2 320.845 4.287 20 0 DIADLO CCCC[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000606570054 1038615026 /nfs/dbraw/zinc/61/50/26/1038615026.db2.gz OPBITEQZWFGTTJ-ZBFHGGJFSA-N 1 2 314.433 4.123 20 0 DIADLO CC(C)(C)[C@@H]1CCCN(C(=O)Nc2ccc3[nH+]ccn3c2)CC1 ZINC000606581750 1038615802 /nfs/dbraw/zinc/61/58/02/1038615802.db2.gz OYUZAECREOFHBG-CQSZACIVSA-N 1 2 314.433 4.014 20 0 DIADLO CCCN(CC1CCCCC1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606583761 1038615852 /nfs/dbraw/zinc/61/58/52/1038615852.db2.gz MUBINGZCINUDDW-UHFFFAOYSA-N 1 2 314.433 4.159 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)N1CCCCC[C@@H]1c1ccco1 ZINC000606583056 1038616317 /nfs/dbraw/zinc/61/63/17/1038616317.db2.gz NTEIKIHKGKWGRE-OAHLLOKOSA-N 1 2 324.384 4.077 20 0 DIADLO CC[C@](C)([NH2+]Cc1ccc(F)c(F)c1F)c1nc(C)cs1 ZINC000657375094 1038619650 /nfs/dbraw/zinc/61/96/50/1038619650.db2.gz CXZXHQVYIIMXEE-HNNXBMFYSA-N 1 2 314.376 4.284 20 0 DIADLO CCc1cccc2cc(C[NH2+][C@H](COC)c3ccc(C)o3)oc21 ZINC000657384053 1038626958 /nfs/dbraw/zinc/62/69/58/1038626958.db2.gz RINJMIHOVDJEAD-QGZVFWFLSA-N 1 2 313.397 4.374 20 0 DIADLO Cc1cccc2[nH]c(C[NH2+][C@@H](C)c3nc(C(C)(C)C)no3)cc21 ZINC000657384688 1038627565 /nfs/dbraw/zinc/62/75/65/1038627565.db2.gz RWNBDQSMCZRDFN-LBPRGKRZSA-N 1 2 312.417 4.008 20 0 DIADLO CCCn1nccc1C[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000657395716 1038634777 /nfs/dbraw/zinc/63/47/77/1038634777.db2.gz JGOMUYRIMUUXMU-UHFFFAOYSA-N 1 2 324.255 4.379 20 0 DIADLO Cn1c2ccccc2nc1[C@H]([NH2+]C/C=C\Cl)c1ccccc1 ZINC000588513391 1038635150 /nfs/dbraw/zinc/63/51/50/1038635150.db2.gz RZKIFQLQQWFCSI-UUKWBXHYSA-N 1 2 311.816 4.005 20 0 DIADLO CCCCOc1cc(C[NH2+][C@H](C)c2cscn2)ccc1OC ZINC000582371624 1038643754 /nfs/dbraw/zinc/64/37/54/1038643754.db2.gz GQRYHYDLVMZTNT-CYBMUJFWSA-N 1 2 320.458 4.181 20 0 DIADLO c1cc2cc(NCc3ccccc3OC3CCCC3)[nH+]cc2[nH]1 ZINC000684839518 1038646882 /nfs/dbraw/zinc/64/68/82/1038646882.db2.gz UVBBCOLXSPOYCZ-UHFFFAOYSA-N 1 2 307.397 4.496 20 0 DIADLO CC[N@H+](Cc1coc(-c2ccccc2)n1)[C@@H](C)c1cccnc1 ZINC000342535135 1038656900 /nfs/dbraw/zinc/65/69/00/1038656900.db2.gz JZBHGCAVUUBNMU-HNNXBMFYSA-N 1 2 307.397 4.320 20 0 DIADLO CC[N@@H+](Cc1coc(-c2ccccc2)n1)[C@@H](C)c1cccnc1 ZINC000342535135 1038656906 /nfs/dbraw/zinc/65/69/06/1038656906.db2.gz JZBHGCAVUUBNMU-HNNXBMFYSA-N 1 2 307.397 4.320 20 0 DIADLO Cc1ccccc1[C@H]1C[C@H]([NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC000582413628 1038659255 /nfs/dbraw/zinc/65/92/55/1038659255.db2.gz WPDGJKKSSGTTGC-ZHALLVOQSA-N 1 2 324.472 4.270 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(F)cc3F)CCCCC2)[nH]c1C ZINC000657422566 1038659261 /nfs/dbraw/zinc/65/92/61/1038659261.db2.gz QDCKYVHBMUBDQH-UHFFFAOYSA-N 1 2 319.399 4.254 20 0 DIADLO CC(C)n1ccnc1C[NH2+][C@@H]1CCCOc2c(Cl)cccc21 ZINC000657427297 1038663977 /nfs/dbraw/zinc/66/39/77/1038663977.db2.gz CCLAHHNOYDZGDW-OAHLLOKOSA-N 1 2 319.836 4.121 20 0 DIADLO CCCOc1cccc2c(N3CCCOC(C)(C)C3)cc[nH+]c12 ZINC000684889575 1038681808 /nfs/dbraw/zinc/68/18/08/1038681808.db2.gz KZGLTOUETNOEAZ-UHFFFAOYSA-N 1 2 314.429 4.029 20 0 DIADLO Cc1cc(C)c(NC(=O)CCc2c[nH]c3ccccc23)c(C)[nH+]1 ZINC000097040051 1038684978 /nfs/dbraw/zinc/68/49/78/1038684978.db2.gz ZXYODDPXTDHYRU-UHFFFAOYSA-N 1 2 307.397 4.059 20 0 DIADLO Cl/C=C(\Cl)C[N@@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000173191507 1038690181 /nfs/dbraw/zinc/69/01/81/1038690181.db2.gz MGSFHLGHFFOGKL-HQQGHWSLSA-N 1 2 311.212 4.326 20 0 DIADLO Cl/C=C(\Cl)C[N@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000173191507 1038690185 /nfs/dbraw/zinc/69/01/85/1038690185.db2.gz MGSFHLGHFFOGKL-HQQGHWSLSA-N 1 2 311.212 4.326 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ccco2)Cc2cccc(C)n2)c1 ZINC000342635770 1038695589 /nfs/dbraw/zinc/69/55/89/1038695589.db2.gz QYWORBPXDHIQIK-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ccco2)Cc2cccc(C)n2)c1 ZINC000342635770 1038695594 /nfs/dbraw/zinc/69/55/94/1038695594.db2.gz QYWORBPXDHIQIK-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[N@H+](C)Cc1ccoc1 ZINC000342642248 1038697044 /nfs/dbraw/zinc/69/70/44/1038697044.db2.gz ZKHWGIAYRLQPOB-OAHLLOKOSA-N 1 2 314.429 4.170 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccoc1 ZINC000342642248 1038697047 /nfs/dbraw/zinc/69/70/47/1038697047.db2.gz ZKHWGIAYRLQPOB-OAHLLOKOSA-N 1 2 314.429 4.170 20 0 DIADLO CCc1nnc(C[NH2+]Cc2cccc(C3CCCC3)c2)s1 ZINC000657469027 1038704957 /nfs/dbraw/zinc/70/49/57/1038704957.db2.gz CYDBGQJCVMVIKF-UHFFFAOYSA-N 1 2 301.459 4.048 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2nc(C3CC3)cs2)cc1 ZINC000342696658 1038724490 /nfs/dbraw/zinc/72/44/90/1038724490.db2.gz QKRQKYFOUIFEIF-UHFFFAOYSA-N 1 2 302.443 4.051 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2nc(C3CC3)cs2)cc1 ZINC000342696658 1038724498 /nfs/dbraw/zinc/72/44/98/1038724498.db2.gz QKRQKYFOUIFEIF-UHFFFAOYSA-N 1 2 302.443 4.051 20 0 DIADLO Fc1ccc(COc2cccc(-n3cc[nH+]c3)c2)c(Cl)c1 ZINC000607723320 1038725187 /nfs/dbraw/zinc/72/51/87/1038725187.db2.gz AAXWUZSPPWTWIL-UHFFFAOYSA-N 1 2 302.736 4.244 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@@H]2CCCc3cccnc32)n1 ZINC000684955484 1038738839 /nfs/dbraw/zinc/73/88/39/1038738839.db2.gz NZZIANNDKBIOAU-CYBMUJFWSA-N 1 2 301.459 4.003 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc4c(o3)c(F)ccc4C)ccc2[nH+]1 ZINC001125613036 1038749674 /nfs/dbraw/zinc/74/96/74/1038749674.db2.gz FUQPZQYBBWXNOZ-UHFFFAOYSA-N 1 2 323.327 4.089 20 0 DIADLO Cc1cc(C)c(NC(=O)CCc2ccc(Cl)s2)c(C)[nH+]1 ZINC000097403285 1038764126 /nfs/dbraw/zinc/76/41/26/1038764126.db2.gz CLDISXLOFOTJKE-UHFFFAOYSA-N 1 2 308.834 4.293 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000075532033 1038798041 /nfs/dbraw/zinc/79/80/41/1038798041.db2.gz AWVAPYNZPNPTCT-HZPDHXFCSA-N 1 2 305.466 4.112 20 0 DIADLO CC[N@H+](Cc1csc(COC)n1)[C@@H](C)c1ccc(F)cc1 ZINC000075645794 1038812480 /nfs/dbraw/zinc/81/24/80/1038812480.db2.gz BGWDJRYUOAYDTR-LBPRGKRZSA-N 1 2 308.422 4.012 20 0 DIADLO CC[N@@H+](Cc1csc(COC)n1)[C@@H](C)c1ccc(F)cc1 ZINC000075645794 1038812510 /nfs/dbraw/zinc/81/25/10/1038812510.db2.gz BGWDJRYUOAYDTR-LBPRGKRZSA-N 1 2 308.422 4.012 20 0 DIADLO Cc1nnc(C[N@@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)o1 ZINC000075955788 1038820783 /nfs/dbraw/zinc/82/07/83/1038820783.db2.gz PZEAOXMMQUVPMU-AWEZNQCLSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1nnc(C[N@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)o1 ZINC000075955788 1038820807 /nfs/dbraw/zinc/82/08/07/1038820807.db2.gz PZEAOXMMQUVPMU-AWEZNQCLSA-N 1 2 307.397 4.238 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+]CCc2ccc3cn[nH]c3c2)cs1 ZINC000342805422 1038829501 /nfs/dbraw/zinc/82/95/01/1038829501.db2.gz GSEOVEBTIMATOK-LBPRGKRZSA-N 1 2 314.458 4.036 20 0 DIADLO CC(C)=C[C@H]1[C@H](C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)C1(C)C ZINC000029912786 1038843305 /nfs/dbraw/zinc/84/33/05/1038843305.db2.gz ZEKFOXKKNMHMIK-DLBZAZTESA-N 1 2 309.413 4.049 20 0 DIADLO CCc1noc(C[N@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC000608506606 1038872186 /nfs/dbraw/zinc/87/21/86/1038872186.db2.gz RMKQFPGSZXYGDB-HNNXBMFYSA-N 1 2 321.424 4.492 20 0 DIADLO CCc1noc(C[N@@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC000608506606 1038872208 /nfs/dbraw/zinc/87/22/08/1038872208.db2.gz RMKQFPGSZXYGDB-HNNXBMFYSA-N 1 2 321.424 4.492 20 0 DIADLO Cc1sc2ncnc(Oc3cccc(-n4cc[nH+]c4)c3)c2c1C ZINC000077982052 1038876734 /nfs/dbraw/zinc/87/67/34/1038876734.db2.gz ZRJFFGAPOIJUSJ-UHFFFAOYSA-N 1 2 322.393 4.286 20 0 DIADLO C[C@H]1C[N@H+](CCc2ccc3ccccc3c2)C[C@H](C(F)(F)F)O1 ZINC000608751722 1038915017 /nfs/dbraw/zinc/91/50/17/1038915017.db2.gz VXEFCXQPTQCIFF-SUMWQHHRSA-N 1 2 323.358 4.034 20 0 DIADLO C[C@H]1C[N@@H+](CCc2ccc3ccccc3c2)C[C@H](C(F)(F)F)O1 ZINC000608751722 1038915034 /nfs/dbraw/zinc/91/50/34/1038915034.db2.gz VXEFCXQPTQCIFF-SUMWQHHRSA-N 1 2 323.358 4.034 20 0 DIADLO CC[N@H+](Cc1ccc(F)cc1)Cc1ccncc1Br ZINC001137694966 1038923791 /nfs/dbraw/zinc/92/37/91/1038923791.db2.gz LMDVEYJDUTZUOZ-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1ccc(F)cc1)Cc1ccncc1Br ZINC001137694966 1038923801 /nfs/dbraw/zinc/92/38/01/1038923801.db2.gz LMDVEYJDUTZUOZ-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO C[C@H]([NH2+][C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1nccs1 ZINC000153363877 1038936519 /nfs/dbraw/zinc/93/65/19/1038936519.db2.gz VPWSUCIUVZXBOP-GXFFZTMASA-N 1 2 306.406 4.235 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1NCc1cc[nH+]c(N)c1 ZINC001167619281 1038938467 /nfs/dbraw/zinc/93/84/67/1038938467.db2.gz XOVCWTISPITXHM-UHFFFAOYSA-N 1 2 307.397 4.216 20 0 DIADLO Brc1ccsc1C[N@@H+]1CCc2ccsc2C1 ZINC000534126980 1038990888 /nfs/dbraw/zinc/99/08/88/1038990888.db2.gz SYXWOAJVWIGYJS-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO Brc1ccsc1C[N@H+]1CCc2ccsc2C1 ZINC000534126980 1038990903 /nfs/dbraw/zinc/99/09/03/1038990903.db2.gz SYXWOAJVWIGYJS-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO C[C@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)c1cscn1 ZINC000534329621 1039029826 /nfs/dbraw/zinc/02/98/26/1039029826.db2.gz REZWGTZBEBEVDO-CMPLNLGQSA-N 1 2 300.349 4.487 20 0 DIADLO Cc1nc(Cl)nc(Cl)c1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213086276 1039030136 /nfs/dbraw/zinc/03/01/36/1039030136.db2.gz LUTSJHJBBBPOTL-UHFFFAOYSA-N 1 2 320.183 4.226 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1C[N@@H+](C)Cc1ccc(F)cc1F ZINC000349804050 1039040183 /nfs/dbraw/zinc/04/01/83/1039040183.db2.gz OWNFIXQEJXIUAF-UHFFFAOYSA-N 1 2 321.415 4.165 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1C[N@H+](C)Cc1ccc(F)cc1F ZINC000349804050 1039040200 /nfs/dbraw/zinc/04/02/00/1039040200.db2.gz OWNFIXQEJXIUAF-UHFFFAOYSA-N 1 2 321.415 4.165 20 0 DIADLO Fc1cccc(C[N@@H+]2CCC[C@H]2c2ccccn2)c1OC(F)F ZINC000659993861 1039090834 /nfs/dbraw/zinc/09/08/34/1039090834.db2.gz KDRDRFOECOZENM-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(C[N@H+]2CCC[C@H]2c2ccccn2)c1OC(F)F ZINC000659993861 1039090853 /nfs/dbraw/zinc/09/08/53/1039090853.db2.gz KDRDRFOECOZENM-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1nc2c(s1)CCCC2 ZINC000091724601 1039111494 /nfs/dbraw/zinc/11/14/94/1039111494.db2.gz LWYVLNRVNNFYQY-GXSJLCMTSA-N 1 2 305.447 4.039 20 0 DIADLO COC1CCC(C)(CNc2cc(C(F)(F)F)cc[nH+]2)CC1 ZINC000343056895 1039140805 /nfs/dbraw/zinc/14/08/05/1039140805.db2.gz ZIEPOIHCENEPBP-UHFFFAOYSA-N 1 2 302.340 4.108 20 0 DIADLO COc1cc(C)[nH+]c(CN2C[C@@H](C)C[C@H]2c2ccccc2F)c1 ZINC000535281336 1039168317 /nfs/dbraw/zinc/16/83/17/1039168317.db2.gz RVQZLRDYLPRRCY-DJJJIMSYSA-N 1 2 314.404 4.121 20 0 DIADLO C[C@@H](C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)C1CCC1 ZINC000457757171 1039205954 /nfs/dbraw/zinc/20/59/54/1039205954.db2.gz LLFZAKIUXUNLKY-CQSZACIVSA-N 1 2 323.440 4.261 20 0 DIADLO c1cn(CCSCc2ccc(OCc3ccccc3)cc2)c[nH+]1 ZINC000535578067 1039245450 /nfs/dbraw/zinc/24/54/50/1039245450.db2.gz BJIUUFRIRXAJEP-UHFFFAOYSA-N 1 2 324.449 4.396 20 0 DIADLO Cc1cc(C)c(-c2nn(C[N@H+]3CC[C@H](C)C3)c(=S)o2)c(C)c1 ZINC000728561032 1039262131 /nfs/dbraw/zinc/26/21/31/1039262131.db2.gz PTPWYUXGXVTIER-NSHDSACASA-N 1 2 317.458 4.097 20 0 DIADLO Cc1cc(C)c(-c2nn(C[N@@H+]3CC[C@H](C)C3)c(=S)o2)c(C)c1 ZINC000728561032 1039262143 /nfs/dbraw/zinc/26/21/43/1039262143.db2.gz PTPWYUXGXVTIER-NSHDSACASA-N 1 2 317.458 4.097 20 0 DIADLO CC(C)(C)c1csc(C[NH2+]Cc2sccc2Cl)n1 ZINC000193090472 1039280073 /nfs/dbraw/zinc/28/00/73/1039280073.db2.gz YQFSXXPZBASWCX-UHFFFAOYSA-N 1 2 300.880 4.445 20 0 DIADLO Cc1nc(C[NH2+][C@H]2CCCOc3c(Cl)cc(C)cc32)cs1 ZINC000126575221 1039288122 /nfs/dbraw/zinc/28/81/22/1039288122.db2.gz HLMWNOKWLCGLIQ-HNNXBMFYSA-N 1 2 322.861 4.417 20 0 DIADLO FC(F)Oc1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001213088081 1039289611 /nfs/dbraw/zinc/28/96/11/1039289611.db2.gz OLILIURYAOHUJS-UHFFFAOYSA-N 1 2 301.296 4.422 20 0 DIADLO c1cn(-c2ccc(NCc3coc(-c4ccccc4)n3)cc2)c[nH+]1 ZINC000155939202 1039294975 /nfs/dbraw/zinc/29/49/75/1039294975.db2.gz GBCPQTRLXFHFLU-UHFFFAOYSA-N 1 2 316.364 4.139 20 0 DIADLO Cc1csc(C2([NH2+][C@H](C)c3ccc(F)cc3F)CCC2)n1 ZINC000539635221 1039303717 /nfs/dbraw/zinc/30/37/17/1039303717.db2.gz OIKCBNKOXDLWGJ-LLVKDONJSA-N 1 2 308.397 4.460 20 0 DIADLO Cc1ccc(-c2nn(C[N@@H+]3CCC[C@H]3C3CC3)c(=S)o2)cc1 ZINC000728563879 1039304396 /nfs/dbraw/zinc/30/43/96/1039304396.db2.gz WGYKJSFWGWRGJF-HNNXBMFYSA-N 1 2 315.442 4.013 20 0 DIADLO Cc1ccc(-c2nn(C[N@H+]3CCC[C@H]3C3CC3)c(=S)o2)cc1 ZINC000728563879 1039304405 /nfs/dbraw/zinc/30/44/05/1039304405.db2.gz WGYKJSFWGWRGJF-HNNXBMFYSA-N 1 2 315.442 4.013 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1cc2n(n1)CCCC2 ZINC000647289841 1039310382 /nfs/dbraw/zinc/31/03/82/1039310382.db2.gz LIYTYXSPGIBVCQ-NWDGAFQWSA-N 1 2 321.827 4.424 20 0 DIADLO Cc1ccc2c(c1)OCCC[C@@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000539659492 1039313758 /nfs/dbraw/zinc/31/37/58/1039313758.db2.gz PCSQPNIRWMDJRP-SFHVURJKSA-N 1 2 323.440 4.316 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccccc1N(C)C ZINC000539739240 1039331004 /nfs/dbraw/zinc/33/10/04/1039331004.db2.gz QYONMEKDGNMSTE-MRXNPFEDSA-N 1 2 324.472 4.311 20 0 DIADLO CC(C)[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1cccnc1 ZINC000539738745 1039331451 /nfs/dbraw/zinc/33/14/51/1039331451.db2.gz ZUOBWRKKDPNPCU-IBGZPJMESA-N 1 2 310.445 4.276 20 0 DIADLO FC(F)(F)C1=CC[N@H+](Cc2ccccc2Br)CC1 ZINC000536038878 1039338266 /nfs/dbraw/zinc/33/82/66/1039338266.db2.gz MOBRSHFIQRUTPU-UHFFFAOYSA-N 1 2 320.152 4.144 20 0 DIADLO FC(F)(F)C1=CC[N@@H+](Cc2ccccc2Br)CC1 ZINC000536038878 1039338282 /nfs/dbraw/zinc/33/82/82/1039338282.db2.gz MOBRSHFIQRUTPU-UHFFFAOYSA-N 1 2 320.152 4.144 20 0 DIADLO CCCCCOc1ccc(C[N@H+](C)Cc2nccs2)cc1 ZINC000539816788 1039343229 /nfs/dbraw/zinc/34/32/29/1039343229.db2.gz BKLFQGCKFPQQHS-UHFFFAOYSA-N 1 2 304.459 4.344 20 0 DIADLO CCCCCOc1ccc(C[N@@H+](C)Cc2nccs2)cc1 ZINC000539816788 1039343253 /nfs/dbraw/zinc/34/32/53/1039343253.db2.gz BKLFQGCKFPQQHS-UHFFFAOYSA-N 1 2 304.459 4.344 20 0 DIADLO c1cnn(-c2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2)c1 ZINC001213089102 1039361664 /nfs/dbraw/zinc/36/16/64/1039361664.db2.gz UGGFBZJIUQLEAQ-UHFFFAOYSA-N 1 2 301.353 4.006 20 0 DIADLO Cc1nnsc1C[N@@H+](C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000565046818 1039364560 /nfs/dbraw/zinc/36/45/60/1039364560.db2.gz JEVPUODALDPXBG-SNVBAGLBSA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nnsc1C[N@H+](C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000565046818 1039364572 /nfs/dbraw/zinc/36/45/72/1039364572.db2.gz JEVPUODALDPXBG-SNVBAGLBSA-N 1 2 315.364 4.058 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000728569932 1039370099 /nfs/dbraw/zinc/37/00/99/1039370099.db2.gz VJGVYPFCFQNZRQ-AWEZNQCLSA-N 1 2 323.415 4.315 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000728569932 1039370101 /nfs/dbraw/zinc/37/01/01/1039370101.db2.gz VJGVYPFCFQNZRQ-AWEZNQCLSA-N 1 2 323.415 4.315 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1ccc(Cl)s1 ZINC000539838988 1039371275 /nfs/dbraw/zinc/37/12/75/1039371275.db2.gz CERVRBGRPQANDW-IUODEOHRSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1ccc(Cl)s1 ZINC000539838988 1039371288 /nfs/dbraw/zinc/37/12/88/1039371288.db2.gz CERVRBGRPQANDW-IUODEOHRSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)nc1 ZINC000539896743 1039382782 /nfs/dbraw/zinc/38/27/82/1039382782.db2.gz ZCBRQMCEIWDRAK-GOSISDBHSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)nc1 ZINC000539896743 1039382797 /nfs/dbraw/zinc/38/27/97/1039382797.db2.gz ZCBRQMCEIWDRAK-GOSISDBHSA-N 1 2 302.368 4.395 20 0 DIADLO COCc1ccc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)o1 ZINC000539900775 1039385540 /nfs/dbraw/zinc/38/55/40/1039385540.db2.gz ZQZJVJUYOVDVNI-SFHVURJKSA-N 1 2 321.367 4.431 20 0 DIADLO COCc1ccc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)o1 ZINC000539900775 1039385548 /nfs/dbraw/zinc/38/55/48/1039385548.db2.gz ZQZJVJUYOVDVNI-SFHVURJKSA-N 1 2 321.367 4.431 20 0 DIADLO COCc1ccc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)o1 ZINC000539900774 1039385860 /nfs/dbraw/zinc/38/58/60/1039385860.db2.gz ZQZJVJUYOVDVNI-GOSISDBHSA-N 1 2 321.367 4.431 20 0 DIADLO COCc1ccc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)o1 ZINC000539900774 1039385871 /nfs/dbraw/zinc/38/58/71/1039385871.db2.gz ZQZJVJUYOVDVNI-GOSISDBHSA-N 1 2 321.367 4.431 20 0 DIADLO CCc1ccc(C2=CC[N@H+](Cc3ccn(C(C)C)n3)CC2)cc1 ZINC000540056390 1039409143 /nfs/dbraw/zinc/40/91/43/1039409143.db2.gz TZKLGWRFXSZHAB-UHFFFAOYSA-N 1 2 309.457 4.316 20 0 DIADLO CCc1ccc(C2=CC[N@@H+](Cc3ccn(C(C)C)n3)CC2)cc1 ZINC000540056390 1039409149 /nfs/dbraw/zinc/40/91/49/1039409149.db2.gz TZKLGWRFXSZHAB-UHFFFAOYSA-N 1 2 309.457 4.316 20 0 DIADLO Cc1nc(-c2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2)no1 ZINC001213090056 1039416904 /nfs/dbraw/zinc/41/69/04/1039416904.db2.gz ROJFLPCHLVVZIU-UHFFFAOYSA-N 1 2 317.352 4.179 20 0 DIADLO Brc1csc(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)n1 ZINC001137780996 1039453158 /nfs/dbraw/zinc/45/31/58/1039453158.db2.gz QDNQLPBSKYGCAH-MNOVXSKESA-N 1 2 315.280 4.060 20 0 DIADLO Brc1csc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)n1 ZINC001137780996 1039453168 /nfs/dbraw/zinc/45/31/68/1039453168.db2.gz QDNQLPBSKYGCAH-MNOVXSKESA-N 1 2 315.280 4.060 20 0 DIADLO C[C@H]([NH2+][C@@H](C(=O)Nc1ccccc1)c1ccccc1)c1ccco1 ZINC000540175564 1039439001 /nfs/dbraw/zinc/43/90/01/1039439001.db2.gz KBPDISHAFNLIGA-HNAYVOBHSA-N 1 2 320.392 4.310 20 0 DIADLO Clc1cc(C[N@@H+]2CC[C@@H](Oc3ccccc3Cl)C2)ccn1 ZINC000178973688 1039459456 /nfs/dbraw/zinc/45/94/56/1039459456.db2.gz GNAKZFDFPOYTBU-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cc(C[N@H+]2CC[C@@H](Oc3ccccc3Cl)C2)ccn1 ZINC000178973688 1039459463 /nfs/dbraw/zinc/45/94/63/1039459463.db2.gz GNAKZFDFPOYTBU-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO FC1=CCC[N@H+](Cc2c(-c3ccccc3)nc3ccccn32)C1 ZINC000540296421 1039470448 /nfs/dbraw/zinc/47/04/48/1039470448.db2.gz PDJXVLBLYKRHNH-UHFFFAOYSA-N 1 2 307.372 4.060 20 0 DIADLO FC1=CCC[N@@H+](Cc2c(-c3ccccc3)nc3ccccn32)C1 ZINC000540296421 1039470452 /nfs/dbraw/zinc/47/04/52/1039470452.db2.gz PDJXVLBLYKRHNH-UHFFFAOYSA-N 1 2 307.372 4.060 20 0 DIADLO C[C@@H](Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)c1ccccn1 ZINC000278450951 1039479595 /nfs/dbraw/zinc/47/95/95/1039479595.db2.gz LMZRQYVQUZMFMR-OAHLLOKOSA-N 1 2 318.424 4.455 20 0 DIADLO CCOc1cccc([C@H](C)[NH2+]Cc2ncc(C(C)(C)C)o2)c1 ZINC000540379761 1039485781 /nfs/dbraw/zinc/48/57/81/1039485781.db2.gz KFFQNRORKWRDNM-ZDUSSCGKSA-N 1 2 302.418 4.222 20 0 DIADLO Cc1ccc(C[NH2+][C@H](c2ccn(C)n2)c2ccc(F)cc2)c(C)c1 ZINC000540475627 1039501289 /nfs/dbraw/zinc/50/12/89/1039501289.db2.gz RSEVANAPZOJQMK-FQEVSTJZSA-N 1 2 323.415 4.055 20 0 DIADLO CC(C)C[C@H]1COCC[N@@H+]1Cc1ncc(-c2ccccc2)s1 ZINC000540506129 1039508150 /nfs/dbraw/zinc/50/81/50/1039508150.db2.gz URZZPYXCJOLGSJ-INIZCTEOSA-N 1 2 316.470 4.057 20 0 DIADLO CC(C)C[C@H]1COCC[N@H+]1Cc1ncc(-c2ccccc2)s1 ZINC000540506129 1039508165 /nfs/dbraw/zinc/50/81/65/1039508165.db2.gz URZZPYXCJOLGSJ-INIZCTEOSA-N 1 2 316.470 4.057 20 0 DIADLO Cc1cc(NCc2ccc(Br)cc2C)c[nH+]c1C ZINC001203484721 1039509877 /nfs/dbraw/zinc/50/98/77/1039509877.db2.gz CIFPHZNIPUSBQT-UHFFFAOYSA-N 1 2 305.219 4.381 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1cc(C(C)(C)C)on1)CCC2 ZINC000278531394 1039530140 /nfs/dbraw/zinc/53/01/40/1039530140.db2.gz FDPSABOOXLIZLJ-AWEZNQCLSA-N 1 2 319.474 4.246 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cc(C(C)(C)C)on1)CCC2 ZINC000278531394 1039530145 /nfs/dbraw/zinc/53/01/45/1039530145.db2.gz FDPSABOOXLIZLJ-AWEZNQCLSA-N 1 2 319.474 4.246 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2cc(C)c(F)c(C)c2)cs1 ZINC000165281646 1039531470 /nfs/dbraw/zinc/53/14/70/1039531470.db2.gz FYWYNGHUGCCSJB-STQMWFEESA-N 1 2 322.449 4.457 20 0 DIADLO CC(C)[C@]1(C)C[C@@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000685242863 1039531672 /nfs/dbraw/zinc/53/16/72/1039531672.db2.gz GCPVEMAZDFBQDD-APWZRJJASA-N 1 2 322.412 4.131 20 0 DIADLO CCOc1ccc(C[NH2+][C@@H](C)c2csc(CC)n2)cc1F ZINC000278544931 1039537600 /nfs/dbraw/zinc/53/76/00/1039537600.db2.gz UJHJHCBERWRPBJ-NSHDSACASA-N 1 2 308.422 4.094 20 0 DIADLO CC(C)c1nnc(C[N@H+](Cc2ccc(F)cc2)C(C)(C)C)o1 ZINC000132812448 1039556136 /nfs/dbraw/zinc/55/61/36/1039556136.db2.gz MRMDBZDPAWIPHM-UHFFFAOYSA-N 1 2 305.397 4.133 20 0 DIADLO CC(C)c1nnc(C[N@@H+](Cc2ccc(F)cc2)C(C)(C)C)o1 ZINC000132812448 1039556151 /nfs/dbraw/zinc/55/61/51/1039556151.db2.gz MRMDBZDPAWIPHM-UHFFFAOYSA-N 1 2 305.397 4.133 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ncc(C(F)(F)F)s2)ccc1F ZINC000278579745 1039562968 /nfs/dbraw/zinc/56/29/68/1039562968.db2.gz FOQZMMONFKJYIS-SECBINFHSA-N 1 2 318.339 4.460 20 0 DIADLO CCCCc1nc(C[N@H+](C)CCOc2cccc(C)c2)cs1 ZINC000642253473 1039565123 /nfs/dbraw/zinc/56/51/23/1039565123.db2.gz XOQIUNJGKWSJEE-UHFFFAOYSA-N 1 2 318.486 4.305 20 0 DIADLO CCCCc1nc(C[N@@H+](C)CCOc2cccc(C)c2)cs1 ZINC000642253473 1039565142 /nfs/dbraw/zinc/56/51/42/1039565142.db2.gz XOQIUNJGKWSJEE-UHFFFAOYSA-N 1 2 318.486 4.305 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1cscn1 ZINC000540790587 1039566854 /nfs/dbraw/zinc/56/68/54/1039566854.db2.gz WUWMUXDOMPOGTE-CYBMUJFWSA-N 1 2 322.437 4.231 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)CCC(=O)c1ccc(F)cc1 ZINC000540823058 1039575627 /nfs/dbraw/zinc/57/56/27/1039575627.db2.gz SDUVVAGBXDLBJW-LBPRGKRZSA-N 1 2 321.342 4.370 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)CCC(=O)c1ccc(F)cc1 ZINC000540823058 1039575642 /nfs/dbraw/zinc/57/56/42/1039575642.db2.gz SDUVVAGBXDLBJW-LBPRGKRZSA-N 1 2 321.342 4.370 20 0 DIADLO C[C@@H](Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)c1cccnc1 ZINC000278590655 1039576460 /nfs/dbraw/zinc/57/64/60/1039576460.db2.gz YVNGNERQKYMOOS-OAHLLOKOSA-N 1 2 318.424 4.455 20 0 DIADLO COc1cccc2c1CC[C@@H]2Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000540839537 1039578574 /nfs/dbraw/zinc/57/85/74/1039578574.db2.gz ZESHRXHFROWTAF-SFHVURJKSA-N 1 2 323.440 4.180 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1nc(-c2ccccc2)cs1 ZINC000584136182 1039616919 /nfs/dbraw/zinc/61/69/19/1039616919.db2.gz OPMHFDDILBEGQZ-DJJJIMSYSA-N 1 2 322.433 4.422 20 0 DIADLO Cc1[nH]c(CN[C@H](C)c2cc(F)c(Cl)cc2Cl)[nH+]c1C ZINC000584183365 1039631409 /nfs/dbraw/zinc/63/14/09/1039631409.db2.gz GJUJNPICQTVIGB-SECBINFHSA-N 1 2 316.207 4.323 20 0 DIADLO FC(F)(F)c1cnc(C[NH2+]Cc2cccc(Cl)c2)s1 ZINC000278688026 1039648736 /nfs/dbraw/zinc/64/87/36/1039648736.db2.gz PSDAWYZNKBOJMW-UHFFFAOYSA-N 1 2 306.740 4.105 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(-c4ccccc4)o3)ccc2[nH+]1 ZINC000541291444 1039657212 /nfs/dbraw/zinc/65/72/12/1039657212.db2.gz ULIGFJVJOBUBDX-UHFFFAOYSA-N 1 2 317.348 4.155 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2csc(C(F)(F)F)c2)n1 ZINC000628183095 1039661165 /nfs/dbraw/zinc/66/11/65/1039661165.db2.gz QKTIVSYXRVXNBH-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2csc(C(F)(F)F)c2)n1 ZINC000628183095 1039661175 /nfs/dbraw/zinc/66/11/75/1039661175.db2.gz QKTIVSYXRVXNBH-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO C[C@@H]1C[N@H+](CCc2cccc(F)c2F)C[C@H](c2ccsc2)O1 ZINC000541349602 1039672529 /nfs/dbraw/zinc/67/25/29/1039672529.db2.gz NLUAQKGQVIMFJH-MLGOLLRUSA-N 1 2 323.408 4.031 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2cccc(F)c2F)C[C@H](c2ccsc2)O1 ZINC000541349602 1039672536 /nfs/dbraw/zinc/67/25/36/1039672536.db2.gz NLUAQKGQVIMFJH-MLGOLLRUSA-N 1 2 323.408 4.031 20 0 DIADLO CC[N@H+](Cc1ncc(C(C)(C)C)o1)[C@@H](C)c1cccc(O)c1 ZINC000080933034 1039687911 /nfs/dbraw/zinc/68/79/11/1039687911.db2.gz SCTQLUMFBKGVJK-ZDUSSCGKSA-N 1 2 302.418 4.261 20 0 DIADLO CC[N@@H+](Cc1ncc(C(C)(C)C)o1)[C@@H](C)c1cccc(O)c1 ZINC000080933034 1039687918 /nfs/dbraw/zinc/68/79/18/1039687918.db2.gz SCTQLUMFBKGVJK-ZDUSSCGKSA-N 1 2 302.418 4.261 20 0 DIADLO Cc1nc([C@H]([NH2+][C@H]2CCC(C)(C)C2)c2ccc(Cl)cc2)no1 ZINC000541587387 1039712788 /nfs/dbraw/zinc/71/27/88/1039712788.db2.gz GKVVGBSWZDNZGS-LSDHHAIUSA-N 1 2 319.836 4.289 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1cccs1 ZINC000541627652 1039719518 /nfs/dbraw/zinc/71/95/18/1039719518.db2.gz UPXAPBVSUWJQNJ-GFCCVEGCSA-N 1 2 307.463 4.306 20 0 DIADLO CCCOc1ccc([C@@H](C)[NH2+]Cc2ccon2)cc1OCCC ZINC000172647542 1039724374 /nfs/dbraw/zinc/72/43/74/1039724374.db2.gz GBABEFJQPVCISN-CQSZACIVSA-N 1 2 318.417 4.103 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@@H](C)c2cccc(N3CCCC3)c2)[nH+]1 ZINC000088758904 1039767913 /nfs/dbraw/zinc/76/79/13/1039767913.db2.gz TTWHSNOIOZXUMN-ZDUSSCGKSA-N 1 2 321.428 4.040 20 0 DIADLO Cc1ccc(F)cc1NC(=O)[C@H](C)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000542132815 1039797806 /nfs/dbraw/zinc/79/78/06/1039797806.db2.gz JMRAXCBHXYTELU-KBPBESRZSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(F)cc1NC(=O)[C@H](C)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000542132815 1039797825 /nfs/dbraw/zinc/79/78/25/1039797825.db2.gz JMRAXCBHXYTELU-KBPBESRZSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(F)cc1NC(=O)[C@@H](C)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000542132820 1039798350 /nfs/dbraw/zinc/79/83/50/1039798350.db2.gz JMRAXCBHXYTELU-UONOGXRCSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(F)cc1NC(=O)[C@@H](C)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000542132820 1039798374 /nfs/dbraw/zinc/79/83/74/1039798374.db2.gz JMRAXCBHXYTELU-UONOGXRCSA-N 1 2 312.388 4.038 20 0 DIADLO CCc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2OC(F)F)o1 ZINC000090177396 1039803820 /nfs/dbraw/zinc/80/38/20/1039803820.db2.gz JFDNWJLXMHICCC-JTQLQIEISA-N 1 2 313.319 4.433 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1cnc(C(C)(C)C)s1 ZINC000542187032 1039809230 /nfs/dbraw/zinc/80/92/30/1039809230.db2.gz WUOSJOMJBCNSLU-CYBMUJFWSA-N 1 2 316.470 4.224 20 0 DIADLO Cc1cccc2nc(C[NH2+][C@@H](C)c3cc4ccccc4o3)[nH]c21 ZINC000090947835 1039809288 /nfs/dbraw/zinc/80/92/88/1039809288.db2.gz NQKPTCMBNKSDNH-ZDUSSCGKSA-N 1 2 305.381 4.468 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1cnc(C(C)(C)C)s1 ZINC000542187032 1039809249 /nfs/dbraw/zinc/80/92/49/1039809249.db2.gz WUOSJOMJBCNSLU-CYBMUJFWSA-N 1 2 316.470 4.224 20 0 DIADLO CC(C)CC(C)(C)C(=O)N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000084621967 1039845198 /nfs/dbraw/zinc/84/51/98/1039845198.db2.gz OWFQGZNLFVFZJS-OAHLLOKOSA-N 1 2 313.445 4.122 20 0 DIADLO C[C@H]([NH2+][C@@H](CO)c1ccc(Cl)cc1)c1c(F)cccc1F ZINC000091743714 1039858855 /nfs/dbraw/zinc/85/88/55/1039858855.db2.gz PBWHPXPUDRELIA-BONVTDFDSA-N 1 2 311.759 4.002 20 0 DIADLO Cc1ccc(C(=O)C2CC[NH+](Cc3ccc(Cl)o3)CC2)cc1 ZINC000092187360 1039859799 /nfs/dbraw/zinc/85/97/99/1039859799.db2.gz DYCUHAFMLYVKAK-UHFFFAOYSA-N 1 2 317.816 4.336 20 0 DIADLO Fc1cc(C2CC2)ccc1C[NH2+]Cc1nccn1-c1ccccc1 ZINC000491573076 1039862242 /nfs/dbraw/zinc/86/22/42/1039862242.db2.gz QNCWDTJVADCSDK-UHFFFAOYSA-N 1 2 321.399 4.179 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nnc(-c2ccc(C)cc2)o1 ZINC000092224076 1039862767 /nfs/dbraw/zinc/86/27/67/1039862767.db2.gz UQGIVVIIQSGEKV-KRWDZBQOSA-N 1 2 322.412 4.023 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nnc(-c2ccc(C)cc2)o1 ZINC000092224076 1039862791 /nfs/dbraw/zinc/86/27/91/1039862791.db2.gz UQGIVVIIQSGEKV-KRWDZBQOSA-N 1 2 322.412 4.023 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(-c2ccccc2F)o1)c1ccsc1 ZINC000669937309 1039869166 /nfs/dbraw/zinc/86/91/66/1039869166.db2.gz ZYRACZBDRBFKNU-NSHDSACASA-N 1 2 302.374 4.393 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+]2CC=C(c3cc(C)cc(C)c3)CC2)o1 ZINC000092428110 1039871984 /nfs/dbraw/zinc/87/19/84/1039871984.db2.gz FLIPPTXDQZWOFW-OAHLLOKOSA-N 1 2 311.429 4.099 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+]2CC=C(c3cc(C)cc(C)c3)CC2)o1 ZINC000092428110 1039871999 /nfs/dbraw/zinc/87/19/99/1039871999.db2.gz FLIPPTXDQZWOFW-OAHLLOKOSA-N 1 2 311.429 4.099 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccc(Cl)cc2)no1)c1ccsc1 ZINC000669938962 1039876103 /nfs/dbraw/zinc/87/61/03/1039876103.db2.gz GKODCHNFTAWBOM-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO Cc1c(Cl)cccc1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000491874250 1039888127 /nfs/dbraw/zinc/88/81/27/1039888127.db2.gz SKYWCMOPIWIETM-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1ccc(F)cc1C[N@H+](C)Cc1nc2ccccc2s1 ZINC000491919708 1039893218 /nfs/dbraw/zinc/89/32/18/1039893218.db2.gz GWBFMRXXGPHLTC-UHFFFAOYSA-N 1 2 300.402 4.376 20 0 DIADLO Cc1ccc(F)cc1C[N@@H+](C)Cc1nc2ccccc2s1 ZINC000491919708 1039893246 /nfs/dbraw/zinc/89/32/46/1039893246.db2.gz GWBFMRXXGPHLTC-UHFFFAOYSA-N 1 2 300.402 4.376 20 0 DIADLO CC1(C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)CCCC1 ZINC000611874806 1039900373 /nfs/dbraw/zinc/90/03/73/1039900373.db2.gz ZUTLMDCZQLMRMG-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1ccc(C(F)F)cc1)CCO2 ZINC000669941132 1039901843 /nfs/dbraw/zinc/90/18/43/1039901843.db2.gz RUYDXDJKJNEMNH-UHFFFAOYSA-N 1 2 307.315 4.158 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1ccc(C(F)F)cc1)CCO2 ZINC000669941132 1039901856 /nfs/dbraw/zinc/90/18/56/1039901856.db2.gz RUYDXDJKJNEMNH-UHFFFAOYSA-N 1 2 307.315 4.158 20 0 DIADLO C[C@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1ccnn1C ZINC000278773964 1039914612 /nfs/dbraw/zinc/91/46/12/1039914612.db2.gz PJZDBPQDEBKNSF-JTQLQIEISA-N 1 2 310.228 4.067 20 0 DIADLO C[C@@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1ccnn1C ZINC000278773968 1039915009 /nfs/dbraw/zinc/91/50/09/1039915009.db2.gz PJZDBPQDEBKNSF-SNVBAGLBSA-N 1 2 310.228 4.067 20 0 DIADLO CC(C)([NH2+]Cc1ccc2occc2c1)c1cc(C(F)(F)F)on1 ZINC000492101106 1039921394 /nfs/dbraw/zinc/92/13/94/1039921394.db2.gz AWLBTFYDUWYZCD-UHFFFAOYSA-N 1 2 324.302 4.465 20 0 DIADLO C[N@@H+](Cc1coc(-c2ccc(F)c(F)c2)n1)Cc1cccs1 ZINC000492125129 1039921582 /nfs/dbraw/zinc/92/15/82/1039921582.db2.gz BSFUYPXJPHOKHG-UHFFFAOYSA-N 1 2 320.364 4.313 20 0 DIADLO C[N@H+](Cc1coc(-c2ccc(F)c(F)c2)n1)Cc1cccs1 ZINC000492125129 1039921599 /nfs/dbraw/zinc/92/15/99/1039921599.db2.gz BSFUYPXJPHOKHG-UHFFFAOYSA-N 1 2 320.364 4.313 20 0 DIADLO CC(C)([NH2+]Cc1ccc(Cl)cc1)c1cc(C(F)(F)F)on1 ZINC000492149565 1039923518 /nfs/dbraw/zinc/92/35/18/1039923518.db2.gz FTMKFBUBKJLQLF-UHFFFAOYSA-N 1 2 318.726 4.372 20 0 DIADLO Cc1cccc2cc(C(=O)Nc3cccc(-n4cc[nH+]c4)c3)oc21 ZINC000149552190 1039961126 /nfs/dbraw/zinc/96/11/26/1039961126.db2.gz QEYHIMWECSOIIZ-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1nc(-c2ccccc2)oc1C ZINC000199019159 1039977211 /nfs/dbraw/zinc/97/72/11/1039977211.db2.gz KMGFVNPLIAWQOD-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1nc(-c2ccccc2)oc1C ZINC000199019159 1039977221 /nfs/dbraw/zinc/97/72/21/1039977221.db2.gz KMGFVNPLIAWQOD-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F)c1ccn(C)n1 ZINC000926577639 1039987007 /nfs/dbraw/zinc/98/70/07/1039987007.db2.gz RZKOWPQVBKTFNS-DTWKUNHWSA-N 1 2 316.207 4.278 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(C(F)F)nc2)cs1 ZINC000657877870 1039988591 /nfs/dbraw/zinc/98/85/91/1039988591.db2.gz KUGGHOHJTVGBLT-UWVGGRQHSA-N 1 2 311.401 4.450 20 0 DIADLO Cc1ncccc1C[NH2+][C@@H](c1cccc(Cl)c1)c1ccccn1 ZINC000153381990 1039994155 /nfs/dbraw/zinc/99/41/55/1039994155.db2.gz CVOJLQWHNQOBNI-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)c1 ZINC000660033105 1039995213 /nfs/dbraw/zinc/99/52/13/1039995213.db2.gz XZKVIPAYSMPPBY-CQSZACIVSA-N 1 2 310.319 4.092 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c1 ZINC000660033105 1039995222 /nfs/dbraw/zinc/99/52/22/1039995222.db2.gz XZKVIPAYSMPPBY-CQSZACIVSA-N 1 2 310.319 4.092 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2ccc(C(F)F)nc2)o1 ZINC000657886159 1039998342 /nfs/dbraw/zinc/99/83/42/1039998342.db2.gz CNJGTUOOOWGOLL-IAQYHMDHSA-N 1 2 324.371 4.213 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)Cc1noc(C2CC2)n1 ZINC000175438998 1040033873 /nfs/dbraw/zinc/03/38/73/1040033873.db2.gz RDXOAEHBCWPKAZ-NEPJUHHUSA-N 1 2 319.836 4.224 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000175438998 1040033890 /nfs/dbraw/zinc/03/38/90/1040033890.db2.gz RDXOAEHBCWPKAZ-NEPJUHHUSA-N 1 2 319.836 4.224 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H](C)c2csnn2)cc2ccccc21 ZINC000926590024 1040061247 /nfs/dbraw/zinc/06/12/47/1040061247.db2.gz JCBCZPFEYHSKIY-VXGBXAGGSA-N 1 2 313.426 4.112 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1nc2c(s1)CCC2 ZINC000685472874 1040070691 /nfs/dbraw/zinc/07/06/91/1040070691.db2.gz HJSBSGPMJABCCZ-HNNXBMFYSA-N 1 2 316.470 4.224 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1nc2c(s1)CCC2 ZINC000685472874 1040070706 /nfs/dbraw/zinc/07/07/06/1040070706.db2.gz HJSBSGPMJABCCZ-HNNXBMFYSA-N 1 2 316.470 4.224 20 0 DIADLO CCCN(C(=O)/C=C/c1[nH]cc[nH+]1)[C@H](C)c1cc2ccccc2o1 ZINC000493067417 1040076133 /nfs/dbraw/zinc/07/61/33/1040076133.db2.gz AQBCPKZNSBDFKT-MYSGNRETSA-N 1 2 323.396 4.169 20 0 DIADLO Cc1cc(C[N@H+](C)CC(=O)c2ccccc2)cc(C(F)(F)F)c1 ZINC001143458083 1040078807 /nfs/dbraw/zinc/07/88/07/1040078807.db2.gz MSFDKCUYZBSLGX-UHFFFAOYSA-N 1 2 321.342 4.329 20 0 DIADLO Cc1cc(C[N@@H+](C)CC(=O)c2ccccc2)cc(C(F)(F)F)c1 ZINC001143458083 1040078820 /nfs/dbraw/zinc/07/88/20/1040078820.db2.gz MSFDKCUYZBSLGX-UHFFFAOYSA-N 1 2 321.342 4.329 20 0 DIADLO CC[N@H+](Cc1nc(C2CC2)no1)[C@@H](C)c1cc2ccccc2o1 ZINC000140686417 1040086480 /nfs/dbraw/zinc/08/64/80/1040086480.db2.gz DOIWOLSRLGKULG-LBPRGKRZSA-N 1 2 311.385 4.276 20 0 DIADLO CC[N@@H+](Cc1nc(C2CC2)no1)[C@@H](C)c1cc2ccccc2o1 ZINC000140686417 1040086496 /nfs/dbraw/zinc/08/64/96/1040086496.db2.gz DOIWOLSRLGKULG-LBPRGKRZSA-N 1 2 311.385 4.276 20 0 DIADLO Cc1ncc(CSCc2ccc(-n3cc[nH+]c3)cc2)s1 ZINC000177849015 1040140750 /nfs/dbraw/zinc/14/07/50/1040140750.db2.gz BZTQFLHEXIUYPL-UHFFFAOYSA-N 1 2 301.440 4.071 20 0 DIADLO Cc1noc([C@H](C)[N@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)n1 ZINC000080916429 1040189179 /nfs/dbraw/zinc/18/91/79/1040189179.db2.gz LUOGMTRFDVADNN-ZDUSSCGKSA-N 1 2 322.412 4.018 20 0 DIADLO Cc1noc([C@H](C)[N@@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)n1 ZINC000080916429 1040189191 /nfs/dbraw/zinc/18/91/91/1040189191.db2.gz LUOGMTRFDVADNN-ZDUSSCGKSA-N 1 2 322.412 4.018 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(C(F)F)nc2)[nH]1 ZINC000657991348 1040256184 /nfs/dbraw/zinc/25/61/84/1040256184.db2.gz VERKYCWGIQVWPR-DCAQKATOSA-N 1 2 323.391 4.063 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(C(F)F)nc1 ZINC000658014277 1040261572 /nfs/dbraw/zinc/26/15/72/1040261572.db2.gz XFWBJQPGPGRGBJ-IUCAKERBSA-N 1 2 313.298 4.104 20 0 DIADLO C/C(=C/C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccccc1 ZINC000065729641 1040274154 /nfs/dbraw/zinc/27/41/54/1040274154.db2.gz LBZLSZUALNSQAJ-KAMYIIQDSA-N 1 2 321.355 4.053 20 0 DIADLO COc1ccnc(C[NH2+][C@H](c2ccc(C)o2)C2CCCC2)c1F ZINC000658228263 1040369458 /nfs/dbraw/zinc/36/94/58/1040369458.db2.gz QDVOWSRGUZTGNR-SFHVURJKSA-N 1 2 318.392 4.152 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@H]2CCc3ccc(O)cc32)cs1 ZINC000658237487 1040381186 /nfs/dbraw/zinc/38/11/86/1040381186.db2.gz MQDFXIRLMXYQSC-ABAIWWIYSA-N 1 2 302.443 4.310 20 0 DIADLO O=C(c1ccc(C2CCCC2)cc1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000685707985 1040453286 /nfs/dbraw/zinc/45/32/86/1040453286.db2.gz ZECSMXPMEXJKLJ-LJQANCHMSA-N 1 2 323.440 4.018 20 0 DIADLO c1cn(C2CC2)c(C[NH2+]C(c2ccccc2)c2ccccc2)n1 ZINC000892441685 1040464209 /nfs/dbraw/zinc/46/42/09/1040464209.db2.gz RTLCDSLANSVLER-UHFFFAOYSA-N 1 2 303.409 4.097 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000780896333 1040507097 /nfs/dbraw/zinc/50/70/97/1040507097.db2.gz AUCVJQNWXGNTAR-LMMKCTJWSA-N 1 2 319.493 4.289 20 0 DIADLO CC(C)C[N@H+](C)Cn1nc(-c2cccc(Cl)c2)oc1=S ZINC000065943612 1040609782 /nfs/dbraw/zinc/60/97/82/1040609782.db2.gz GKTNPBDYLRAFIV-UHFFFAOYSA-N 1 2 311.838 4.071 20 0 DIADLO CC(C)C[N@@H+](C)Cn1nc(-c2cccc(Cl)c2)oc1=S ZINC000065943612 1040609791 /nfs/dbraw/zinc/60/97/91/1040609791.db2.gz GKTNPBDYLRAFIV-UHFFFAOYSA-N 1 2 311.838 4.071 20 0 DIADLO CC(C)=C[C@@H]1[C@@H](C(=O)Nc2cccc(-n3cc[nH+]c3)c2)C1(C)C ZINC000612504016 1040616766 /nfs/dbraw/zinc/61/67/66/1040616766.db2.gz FJSJTWXWSDHTJU-SJORKVTESA-N 1 2 309.413 4.049 20 0 DIADLO Cc1ccc(NC(=O)c2cc(Cl)ccc2Cl)c(N(C)C)[nH+]1 ZINC000152792875 1040619549 /nfs/dbraw/zinc/61/95/49/1040619549.db2.gz ITUWJBWFVDSFPL-UHFFFAOYSA-N 1 2 324.211 4.015 20 0 DIADLO COCOc1ccc(Nc2c[nH+]c(CC(C)C)cc2C)cc1 ZINC001211635570 1040646161 /nfs/dbraw/zinc/64/61/61/1040646161.db2.gz IFPVUHFKYWTRFU-UHFFFAOYSA-N 1 2 300.402 4.315 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1cc(Br)cs1 ZINC000309506252 1040709313 /nfs/dbraw/zinc/70/93/13/1040709313.db2.gz BZRGLFOZZWAIER-GMSGAONNSA-N 1 2 310.207 4.349 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]C(C)(C)c2ccc(F)cc2)cs1 ZINC000177672349 1040740480 /nfs/dbraw/zinc/74/04/80/1040740480.db2.gz DDGDFMMTDGBRGL-LLVKDONJSA-N 1 2 308.422 4.015 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@@H](C)OC[C@@H]2c2ccccc2)s1 ZINC000685838039 1040776853 /nfs/dbraw/zinc/77/68/53/1040776853.db2.gz WTUDDURZUXIEFJ-CZUORRHYSA-N 1 2 319.495 4.432 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@@H](C)OC[C@@H]2c2ccccc2)s1 ZINC000685838039 1040776865 /nfs/dbraw/zinc/77/68/65/1040776865.db2.gz WTUDDURZUXIEFJ-CZUORRHYSA-N 1 2 319.495 4.432 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000448345527 1040783424 /nfs/dbraw/zinc/78/34/24/1040783424.db2.gz UCZQWKXNMGIJIE-LBPRGKRZSA-N 1 2 304.459 4.339 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000448345527 1040783404 /nfs/dbraw/zinc/78/34/04/1040783404.db2.gz UCZQWKXNMGIJIE-LBPRGKRZSA-N 1 2 304.459 4.339 20 0 DIADLO CC(C)=CC[N@H+](Cc1n[nH]cc1C)Cc1ccc(Cl)cc1 ZINC000685846231 1040793076 /nfs/dbraw/zinc/79/30/76/1040793076.db2.gz LKBZXZOKNZXFLJ-UHFFFAOYSA-N 1 2 303.837 4.340 20 0 DIADLO CC(C)=CC[N@@H+](Cc1n[nH]cc1C)Cc1ccc(Cl)cc1 ZINC000685846231 1040793091 /nfs/dbraw/zinc/79/30/91/1040793091.db2.gz LKBZXZOKNZXFLJ-UHFFFAOYSA-N 1 2 303.837 4.340 20 0 DIADLO Cc1ccccc1OCC[N@@H+](C)Cc1csc(C(C)C)n1 ZINC000613315040 1040872935 /nfs/dbraw/zinc/87/29/35/1040872935.db2.gz WPENMWMWSAMWPR-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO Cc1ccccc1OCC[N@H+](C)Cc1csc(C(C)C)n1 ZINC000613315040 1040872950 /nfs/dbraw/zinc/87/29/50/1040872950.db2.gz WPENMWMWSAMWPR-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO CCC[N@H+](Cc1noc(-c2ccccc2)n1)Cc1ccc(C)cc1 ZINC000613343907 1040893080 /nfs/dbraw/zinc/89/30/80/1040893080.db2.gz MIHCGTNMRGLLSY-UHFFFAOYSA-N 1 2 321.424 4.457 20 0 DIADLO CCC[N@@H+](Cc1noc(-c2ccccc2)n1)Cc1ccc(C)cc1 ZINC000613343907 1040893090 /nfs/dbraw/zinc/89/30/90/1040893090.db2.gz MIHCGTNMRGLLSY-UHFFFAOYSA-N 1 2 321.424 4.457 20 0 DIADLO Cc1ccc(OCC[N@@H+](C)Cc2csc(C(C)C)n2)cc1 ZINC000613388312 1040909310 /nfs/dbraw/zinc/90/93/10/1040909310.db2.gz ONJDUZWXMSXXFT-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO Cc1ccc(OCC[N@H+](C)Cc2csc(C(C)C)n2)cc1 ZINC000613388312 1040909331 /nfs/dbraw/zinc/90/93/31/1040909331.db2.gz ONJDUZWXMSXXFT-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO c1cc(N2CCCC2)ccc1[NH2+][C@@H]1CCCC12CCOCC2 ZINC000282454818 1040933436 /nfs/dbraw/zinc/93/34/36/1040933436.db2.gz FPEOWGVNSCDGHW-GOSISDBHSA-N 1 2 300.446 4.048 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CCCC12CCOCC2 ZINC000282454818 1040933457 /nfs/dbraw/zinc/93/34/57/1040933457.db2.gz FPEOWGVNSCDGHW-GOSISDBHSA-N 1 2 300.446 4.048 20 0 DIADLO CC[C@H]([NH2+]Cc1ccn(CC)n1)c1ccc(Cl)cc1Cl ZINC000414200379 1040989403 /nfs/dbraw/zinc/98/94/03/1040989403.db2.gz BBAFBFITSDPIOE-HNNXBMFYSA-N 1 2 312.244 4.451 20 0 DIADLO CCC[C@H]([NH2+]Cc1nccc(C(F)(F)F)n1)c1ccsc1 ZINC000414233752 1041034324 /nfs/dbraw/zinc/03/43/24/1041034324.db2.gz FIIZCHUBQJVWGN-NSHDSACASA-N 1 2 315.364 4.188 20 0 DIADLO FC(F)(F)COc1cc(NCc2cc3ccccc3[nH]2)cc[nH+]1 ZINC000685916097 1041149977 /nfs/dbraw/zinc/14/99/77/1041149977.db2.gz GRWFTQHOORXOLD-UHFFFAOYSA-N 1 2 321.302 4.116 20 0 DIADLO c1ccn(-c2ccc(NCc3nccc4ccccc43)[nH+]c2)c1 ZINC001167700715 1041171325 /nfs/dbraw/zinc/17/13/25/1041171325.db2.gz LKSGPSLRKKSTBF-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO C[N@H+](Cc1ccn(-c2ccccc2)n1)Cc1ccc2occc2c1 ZINC000809550088 1041191590 /nfs/dbraw/zinc/19/15/90/1041191590.db2.gz PGQXLALWPCJEPE-UHFFFAOYSA-N 1 2 317.392 4.251 20 0 DIADLO C[N@@H+](Cc1ccn(-c2ccccc2)n1)Cc1ccc2occc2c1 ZINC000809550088 1041191604 /nfs/dbraw/zinc/19/16/04/1041191604.db2.gz PGQXLALWPCJEPE-UHFFFAOYSA-N 1 2 317.392 4.251 20 0 DIADLO CCc1ncc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)cn1 ZINC000414376321 1041195757 /nfs/dbraw/zinc/19/57/57/1041195757.db2.gz HFVJIRUBGQAJAK-UHFFFAOYSA-N 1 2 322.239 4.125 20 0 DIADLO Cc1ccc(C[NH2+][C@H](c2cccc(Cl)c2)c2ccccn2)nc1 ZINC000134416692 1041199334 /nfs/dbraw/zinc/19/93/34/1041199334.db2.gz AUJXBBGZLQWFMB-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+]1CCc2ccccc2C1 ZINC000007782821 1041200461 /nfs/dbraw/zinc/20/04/61/1041200461.db2.gz FZTRSXJQHYSSIB-UHFFFAOYSA-N 1 2 322.452 4.115 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@H+]1CCc2ccccc2C1 ZINC000007782821 1041200478 /nfs/dbraw/zinc/20/04/78/1041200478.db2.gz FZTRSXJQHYSSIB-UHFFFAOYSA-N 1 2 322.452 4.115 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(NCc2nccc3ccccc32)c1 ZINC001167702907 1041206199 /nfs/dbraw/zinc/20/61/99/1041206199.db2.gz OOUZCPUQVQUIIF-UHFFFAOYSA-N 1 2 314.392 4.247 20 0 DIADLO Cc1ccccc1C[N@H+](Cc1cccnc1)Cc1ccc(F)nc1 ZINC000809735557 1041227910 /nfs/dbraw/zinc/22/79/10/1041227910.db2.gz KLPYLTZJUTZZIU-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ccccc1C[N@@H+](Cc1cccnc1)Cc1ccc(F)nc1 ZINC000809735557 1041227931 /nfs/dbraw/zinc/22/79/31/1041227931.db2.gz KLPYLTZJUTZZIU-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2c(Cl)nc(Cl)n2C)C1 ZINC000809716842 1041233966 /nfs/dbraw/zinc/23/39/66/1041233966.db2.gz ZRQHSVLJGWBMDM-AAEUAGOBSA-N 1 2 324.255 4.310 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2c(Cl)nc(Cl)n2C)C1 ZINC000809716842 1041233981 /nfs/dbraw/zinc/23/39/81/1041233981.db2.gz ZRQHSVLJGWBMDM-AAEUAGOBSA-N 1 2 324.255 4.310 20 0 DIADLO COc1ccc(CNc2[nH+]c3ccccc3cc2C)c(OC)c1 ZINC000301203482 1041238197 /nfs/dbraw/zinc/23/81/97/1041238197.db2.gz QJSFRQGFSQXQSO-UHFFFAOYSA-N 1 2 308.381 4.173 20 0 DIADLO Cc1ncc([C@H](C)[NH2+][C@H]2COCc3cccc(Cl)c32)s1 ZINC000926786001 1041239454 /nfs/dbraw/zinc/23/94/54/1041239454.db2.gz KSHLQNMVTCYSFB-ZANVPECISA-N 1 2 308.834 4.027 20 0 DIADLO COc1ccc(COc2cc(C)[nH+]c3ccc(OC)cc32)cc1 ZINC000809792173 1041259486 /nfs/dbraw/zinc/25/94/86/1041259486.db2.gz KZOPQRCHQRCHML-UHFFFAOYSA-N 1 2 309.365 4.139 20 0 DIADLO CCc1ccc(C[NH2+][C@H](c2ncc[nH]2)c2ccc(F)cc2)s1 ZINC000187773242 1041263029 /nfs/dbraw/zinc/26/30/29/1041263029.db2.gz SGWBNAZZBZBRAA-INIZCTEOSA-N 1 2 315.417 4.052 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccc(F)cc2)s1 ZINC000187773265 1041264314 /nfs/dbraw/zinc/26/43/14/1041264314.db2.gz SGWBNAZZBZBRAA-MRXNPFEDSA-N 1 2 315.417 4.052 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2ccc(Cl)cc2)nc2ccccc12 ZINC000031006981 1041272856 /nfs/dbraw/zinc/27/28/56/1041272856.db2.gz WJDWYBFTAUMCTN-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2ccc(Cl)cc2)nc2ccccc12 ZINC000031006981 1041272870 /nfs/dbraw/zinc/27/28/70/1041272870.db2.gz WJDWYBFTAUMCTN-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccccc1OC ZINC000809970965 1041278797 /nfs/dbraw/zinc/27/87/97/1041278797.db2.gz PVEQUXQCNGZZDB-OAHLLOKOSA-N 1 2 302.418 4.222 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2ccc(Cl)s2)cs1 ZINC000165223122 1041290227 /nfs/dbraw/zinc/29/02/27/1041290227.db2.gz VWFHIAVZYWINSF-RKDXNWHRSA-N 1 2 316.879 4.416 20 0 DIADLO C[C@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1ccnn1C1CCC1 ZINC000926807035 1041300646 /nfs/dbraw/zinc/30/06/46/1041300646.db2.gz AOGBELCGPMWDIZ-BLLLJJGKSA-N 1 2 305.372 4.109 20 0 DIADLO Fc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1csc(C(F)(F)F)n1 ZINC000892680462 1041313415 /nfs/dbraw/zinc/31/34/15/1041313415.db2.gz PICCZHLYMWQBOB-LBPRGKRZSA-N 1 2 316.323 4.078 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1cc(O)cc(C(F)(F)F)c1 ZINC000810131792 1041316667 /nfs/dbraw/zinc/31/66/67/1041316667.db2.gz PEKWDXJNPPZXFE-UHFFFAOYSA-N 1 2 324.346 4.398 20 0 DIADLO COc1ccc2ccc(NC[C@@H](C)c3c(C)noc3C)[nH+]c2c1 ZINC000892953416 1041439291 /nfs/dbraw/zinc/43/92/91/1041439291.db2.gz XHSRQTFDZMKXLD-LLVKDONJSA-N 1 2 311.385 4.064 20 0 DIADLO Cc1nn(C)c(C[NH2+][C@H](C)c2ccc(F)cc2Cl)c1Cl ZINC000893011542 1041456960 /nfs/dbraw/zinc/45/69/60/1041456960.db2.gz KXJFMJUPBGHRKI-MRVPVSSYSA-N 1 2 316.207 4.025 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1cscn1 ZINC000271024127 1041491247 /nfs/dbraw/zinc/49/12/47/1041491247.db2.gz AVKCPPADSKRZTL-ZIAGYGMSSA-N 1 2 304.459 4.480 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(C(C)(C)C)s1)c1cc2ccccc2[nH]1 ZINC000925518253 1041520724 /nfs/dbraw/zinc/52/07/24/1041520724.db2.gz OACJSDWBCYLWTJ-NSHDSACASA-N 1 2 314.458 4.168 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccnc(Cl)c2Cl)o1 ZINC000811475207 1041526721 /nfs/dbraw/zinc/52/67/21/1041526721.db2.gz XZEYCFCRGOKNIT-CABZTGNLSA-N 1 2 311.212 4.395 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1cccc(Cl)c1O)CCC2 ZINC000180231867 1041527383 /nfs/dbraw/zinc/52/73/83/1041527383.db2.gz SKCOLKWEPIRNFL-AWEZNQCLSA-N 1 2 322.861 4.320 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cccc(Cl)c1O)CCC2 ZINC000180231867 1041527390 /nfs/dbraw/zinc/52/73/90/1041527390.db2.gz SKCOLKWEPIRNFL-AWEZNQCLSA-N 1 2 322.861 4.320 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2nsc3ccccc23)sc1C ZINC000660088896 1041608108 /nfs/dbraw/zinc/60/81/08/1041608108.db2.gz FPOPXLGEZQCRMW-UHFFFAOYSA-N 1 2 317.483 4.395 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncsc1Br)c1ccccc1 ZINC000660177036 1041648990 /nfs/dbraw/zinc/64/89/90/1041648990.db2.gz BSCQAKRIGIQOQA-LLVKDONJSA-N 1 2 311.248 4.147 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)co1 ZINC000930751074 1041640557 /nfs/dbraw/zinc/64/05/57/1041640557.db2.gz XMBATISQOAAHCB-LLVKDONJSA-N 1 2 304.356 4.137 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)co1 ZINC000930751074 1041640563 /nfs/dbraw/zinc/64/05/63/1041640563.db2.gz XMBATISQOAAHCB-LLVKDONJSA-N 1 2 304.356 4.137 20 0 DIADLO Clc1ccc(Cl)c(C[NH+]2CCC(c3ccccn3)CC2)n1 ZINC000364059087 1041647607 /nfs/dbraw/zinc/64/76/07/1041647607.db2.gz VWWAERUTFNMJMW-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C)oc1C)c1ccccc1OC(F)F ZINC000660185323 1041654316 /nfs/dbraw/zinc/65/43/16/1041654316.db2.gz OJFFDNOIELOTPD-CYBMUJFWSA-N 1 2 310.344 4.134 20 0 DIADLO COc1cccc(C[NH2+][C@H](C)c2c(F)cccc2OC)c1Cl ZINC000660200162 1041664093 /nfs/dbraw/zinc/66/40/93/1041664093.db2.gz PJIPRPUARWAYFF-LLVKDONJSA-N 1 2 323.795 4.347 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CC(C)(C)[C@@H]3c3cccs3)cn2c1 ZINC000584798356 1041674842 /nfs/dbraw/zinc/67/48/42/1041674842.db2.gz JHVMCDMQOZLUKC-KRWDZBQOSA-N 1 2 311.454 4.287 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CC(C)(C)[C@@H]3c3cccs3)cn2c1 ZINC000584798356 1041674843 /nfs/dbraw/zinc/67/48/43/1041674843.db2.gz JHVMCDMQOZLUKC-KRWDZBQOSA-N 1 2 311.454 4.287 20 0 DIADLO N#Cc1ccc(F)c(C[NH2+]Cc2ncc(-c3ccccc3)s2)c1 ZINC000092409514 1041676259 /nfs/dbraw/zinc/67/62/59/1041676259.db2.gz RFXGRBWLIBOCCX-UHFFFAOYSA-N 1 2 323.396 4.111 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C=CCc1ccc(C(C)C)cc1 ZINC001133681963 1041690032 /nfs/dbraw/zinc/69/00/32/1041690032.db2.gz DKYJFWHQKGMXNR-AATRIKPKSA-N 1 2 308.425 4.286 20 0 DIADLO CC[C@H]([NH2+]Cc1nsc2ccccc12)c1nc(C)cs1 ZINC000660251762 1041691109 /nfs/dbraw/zinc/69/11/09/1041691109.db2.gz CGGAQJRNBCLWDO-LBPRGKRZSA-N 1 2 303.456 4.302 20 0 DIADLO COc1cccc(C[NH2+][C@H](c2ncc(C)s2)C2CC2)c1Cl ZINC000660253814 1041692149 /nfs/dbraw/zinc/69/21/49/1041692149.db2.gz MBMJOPJHXZRTIU-HNNXBMFYSA-N 1 2 322.861 4.354 20 0 DIADLO CCOc1cccc2cc([C@@H](C)[NH2+]Cc3nc(C)oc3C)oc21 ZINC000660258017 1041692673 /nfs/dbraw/zinc/69/26/73/1041692673.db2.gz XDALMVUVFMKJAX-LLVKDONJSA-N 1 2 314.385 4.287 20 0 DIADLO C[C@H]([NH2+]Cc1cnn(C(C)(C)C)c1)c1ncc(-c2ccccc2)o1 ZINC000660271527 1041698843 /nfs/dbraw/zinc/69/88/43/1041698843.db2.gz ZCZBFDKIJRHQLR-AWEZNQCLSA-N 1 2 324.428 4.144 20 0 DIADLO COc1ccc2oc([C@H](C)[NH2+]Cc3nc(C)oc3C)c(C)c2c1 ZINC000660267093 1041699280 /nfs/dbraw/zinc/69/92/80/1041699280.db2.gz VHOPDYQQJGXZMJ-NSHDSACASA-N 1 2 314.385 4.205 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(COCc2ccccc2)cc1 ZINC000417835843 1041704866 /nfs/dbraw/zinc/70/48/66/1041704866.db2.gz OHJQEFXHKPDLKR-UHFFFAOYSA-N 1 2 321.424 4.232 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH+]1CCC(Cc2cccc(F)c2F)CC1 ZINC000651472552 1041727193 /nfs/dbraw/zinc/72/71/93/1041727193.db2.gz XWTQELDTTSXSGW-ZDUSSCGKSA-N 1 2 319.399 4.012 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCC1(F)F)c1ccc(Br)cc1 ZINC000397935070 1041738724 /nfs/dbraw/zinc/73/87/24/1041738724.db2.gz DEPBDPIPGRWTAL-SKDRFNHKSA-N 1 2 304.178 4.288 20 0 DIADLO C[C@@H]([NH2+]Cc1cocn1)c1ccc(OCc2ccccc2)cc1 ZINC000397930048 1041739592 /nfs/dbraw/zinc/73/95/92/1041739592.db2.gz LVXQGRJCDKPVPR-OAHLLOKOSA-N 1 2 308.381 4.104 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCC[N@@H+]1C/C=C/Cl ZINC000759805838 1041744167 /nfs/dbraw/zinc/74/41/67/1041744167.db2.gz ZRSNGJWGQOYVOO-IYNGYCSASA-N 1 2 316.276 4.390 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCC[N@H+]1C/C=C/Cl ZINC000759805838 1041744174 /nfs/dbraw/zinc/74/41/74/1041744174.db2.gz ZRSNGJWGQOYVOO-IYNGYCSASA-N 1 2 316.276 4.390 20 0 DIADLO C[C@@H](c1ccc2ccccc2c1)[N@H+](C)Cc1ncc(Cl)n1C ZINC000053642671 1041769440 /nfs/dbraw/zinc/76/94/40/1041769440.db2.gz RDTKXEICWPULQG-ZDUSSCGKSA-N 1 2 313.832 4.420 20 0 DIADLO C[C@@H](c1ccc2ccccc2c1)[N@@H+](C)Cc1ncc(Cl)n1C ZINC000053642671 1041769449 /nfs/dbraw/zinc/76/94/49/1041769449.db2.gz RDTKXEICWPULQG-ZDUSSCGKSA-N 1 2 313.832 4.420 20 0 DIADLO COCc1ccccc1/C=C(\C)CNc1ccc([NH+](C)C)cc1 ZINC000814292757 1041804850 /nfs/dbraw/zinc/80/48/50/1041804850.db2.gz LHAAAOMUAKCYEG-DTQAZKPQSA-N 1 2 310.441 4.414 20 0 DIADLO CC(C)[N@H+](Cc1nc(Cc2ccccc2)no1)Cc1ccccc1 ZINC000047406713 1041826740 /nfs/dbraw/zinc/82/67/40/1041826740.db2.gz IBUSKSIHPUTVPU-UHFFFAOYSA-N 1 2 321.424 4.071 20 0 DIADLO CC(C)[N@@H+](Cc1nc(Cc2ccccc2)no1)Cc1ccccc1 ZINC000047406713 1041826742 /nfs/dbraw/zinc/82/67/42/1041826742.db2.gz IBUSKSIHPUTVPU-UHFFFAOYSA-N 1 2 321.424 4.071 20 0 DIADLO Fc1ccc(F)c(C[NH+]2CCC(c3ccccn3)CC2)c1Cl ZINC001138004045 1041835050 /nfs/dbraw/zinc/83/50/50/1041835050.db2.gz UMPHCSMLBUDWNG-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO CCCc1ccccc1NC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000047536989 1041839624 /nfs/dbraw/zinc/83/96/24/1041839624.db2.gz AJEHSPRELMFSLC-UHFFFAOYSA-N 1 2 305.381 4.077 20 0 DIADLO Cc1ccc(-c2nn(C[N@@H+](C)[C@H](C)C(C)(C)C)c(=S)[nH]2)cc1 ZINC000026630050 1041842244 /nfs/dbraw/zinc/84/22/44/1041842244.db2.gz MMGXKOXPTJCZHW-CYBMUJFWSA-N 1 2 318.490 4.240 20 0 DIADLO Cc1ccc(-c2nn(C[N@H+](C)[C@H](C)C(C)(C)C)c(=S)[nH]2)cc1 ZINC000026630050 1041842251 /nfs/dbraw/zinc/84/22/51/1041842251.db2.gz MMGXKOXPTJCZHW-CYBMUJFWSA-N 1 2 318.490 4.240 20 0 DIADLO C[C@H]([N@H+](C)Cn1nc(-c2ccccc2F)oc1=S)C(C)(C)C ZINC000026630038 1041842434 /nfs/dbraw/zinc/84/24/34/1041842434.db2.gz CJGGWWJDSFXDKB-NSHDSACASA-N 1 2 323.437 4.336 20 0 DIADLO C[C@H]([N@@H+](C)Cn1nc(-c2ccccc2F)oc1=S)C(C)(C)C ZINC000026630038 1041842436 /nfs/dbraw/zinc/84/24/36/1041842436.db2.gz CJGGWWJDSFXDKB-NSHDSACASA-N 1 2 323.437 4.336 20 0 DIADLO Cc1cc(Br)c(C[NH2+][C@H](C)c2nccs2)s1 ZINC000651582476 1041845189 /nfs/dbraw/zinc/84/51/89/1041845189.db2.gz ILYMRJSOWUPYNY-MRVPVSSYSA-N 1 2 317.277 4.126 20 0 DIADLO CCCC[C@H](CC)C[N@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660764372 1041860718 /nfs/dbraw/zinc/86/07/18/1041860718.db2.gz OBKYMFMVARUXDC-DOTOQJQBSA-N 1 2 300.450 4.042 20 0 DIADLO CCCC[C@H](CC)C[N@@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660764372 1041860726 /nfs/dbraw/zinc/86/07/26/1041860726.db2.gz OBKYMFMVARUXDC-DOTOQJQBSA-N 1 2 300.450 4.042 20 0 DIADLO C[N@H+](CC1CCC(C)(C)CC1)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660764632 1041860855 /nfs/dbraw/zinc/86/08/55/1041860855.db2.gz PIYUHEUSOYEHFX-QGZVFWFLSA-N 1 2 312.461 4.042 20 0 DIADLO C[N@@H+](CC1CCC(C)(C)CC1)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660764632 1041860860 /nfs/dbraw/zinc/86/08/60/1041860860.db2.gz PIYUHEUSOYEHFX-QGZVFWFLSA-N 1 2 312.461 4.042 20 0 DIADLO Brc1scnc1C[N@@H+]1CCCC[C@H]1C1CCC1 ZINC000660906676 1041870209 /nfs/dbraw/zinc/87/02/09/1041870209.db2.gz KQIJESXNZWHJSK-LBPRGKRZSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1scnc1C[N@H+]1CCCC[C@H]1C1CCC1 ZINC000660906676 1041870210 /nfs/dbraw/zinc/87/02/10/1041870210.db2.gz KQIJESXNZWHJSK-LBPRGKRZSA-N 1 2 315.280 4.060 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@@H+]2C[C@@H]3CCCC[C@@H]32)c(Cl)c1 ZINC000660929780 1041870902 /nfs/dbraw/zinc/87/09/02/1041870902.db2.gz HUIPBWKNTYRWJV-DZKIICNBSA-N 1 2 320.864 4.158 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@H+]2C[C@@H]3CCCC[C@@H]32)c(Cl)c1 ZINC000660929780 1041870910 /nfs/dbraw/zinc/87/09/10/1041870910.db2.gz HUIPBWKNTYRWJV-DZKIICNBSA-N 1 2 320.864 4.158 20 0 DIADLO CCO[C@@H](C)c1nc(C[NH+]2CCC(c3ccco3)CC2)cs1 ZINC000661161900 1041898777 /nfs/dbraw/zinc/89/87/77/1041898777.db2.gz AGCKBPJQQDDZMB-ZDUSSCGKSA-N 1 2 320.458 4.213 20 0 DIADLO CC(C)Cn1ccnc1C[NH2+][C@H]1CCc2ccc(F)c(Cl)c21 ZINC000651751695 1041904593 /nfs/dbraw/zinc/90/45/93/1041904593.db2.gz DOSKVWZNFWAOMP-AWEZNQCLSA-N 1 2 321.827 4.109 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccnc(Br)c2)[C@@H]1c1ccccc1 ZINC000815058067 1041907474 /nfs/dbraw/zinc/90/74/74/1041907474.db2.gz MESJDZQHFROTTQ-WBMJQRKESA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccnc(Br)c2)[C@@H]1c1ccccc1 ZINC000815058067 1041907481 /nfs/dbraw/zinc/90/74/81/1041907481.db2.gz MESJDZQHFROTTQ-WBMJQRKESA-N 1 2 317.230 4.037 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@@H](C)c2nc3ccccc3s2)c1 ZINC000815124694 1041916966 /nfs/dbraw/zinc/91/69/66/1041916966.db2.gz IDSPHZLGGHTIKQ-NSHDSACASA-N 1 2 316.401 4.295 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@H]1CCc2ccc(F)c(Cl)c21 ZINC000651822949 1041923958 /nfs/dbraw/zinc/92/39/58/1041923958.db2.gz PZJSOPAUFLNNDL-GWCFXTLKSA-N 1 2 307.800 4.034 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H]1CCc2ccc(F)c(Cl)c21 ZINC000651822952 1041925409 /nfs/dbraw/zinc/92/54/09/1041925409.db2.gz PZJSOPAUFLNNDL-ZWNOBZJWSA-N 1 2 307.800 4.034 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1)[N@@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661445574 1041938879 /nfs/dbraw/zinc/93/88/79/1041938879.db2.gz INJIOCOGKHRHAX-QAPCUYQASA-N 1 2 324.424 4.224 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1)[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661445574 1041938883 /nfs/dbraw/zinc/93/88/83/1041938883.db2.gz INJIOCOGKHRHAX-QAPCUYQASA-N 1 2 324.424 4.224 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1)[N@@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661445572 1041939243 /nfs/dbraw/zinc/93/92/43/1041939243.db2.gz INJIOCOGKHRHAX-CRAIPNDOSA-N 1 2 324.424 4.224 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1)[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661445572 1041939253 /nfs/dbraw/zinc/93/92/53/1041939253.db2.gz INJIOCOGKHRHAX-CRAIPNDOSA-N 1 2 324.424 4.224 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](c2ccccc2F)C(C)C)cs1 ZINC000661489130 1041943245 /nfs/dbraw/zinc/94/32/45/1041943245.db2.gz ZXPFYWGJZCYKHH-BLLLJJGKSA-N 1 2 322.449 4.477 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccc(Cl)c(Cl)c2)C2CC2)nn1C ZINC000487358607 1041960052 /nfs/dbraw/zinc/96/00/52/1041960052.db2.gz CIUIAOHGDUXNTC-UHFFFAOYSA-N 1 2 324.255 4.200 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccc(Cl)c(Cl)c2)C2CC2)nn1C ZINC000487358607 1041960054 /nfs/dbraw/zinc/96/00/54/1041960054.db2.gz CIUIAOHGDUXNTC-UHFFFAOYSA-N 1 2 324.255 4.200 20 0 DIADLO Nc1nc(Cl)ccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001159378644 1041960934 /nfs/dbraw/zinc/96/09/34/1041960934.db2.gz UIIFACFCVKLTAL-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893479355 1041964446 /nfs/dbraw/zinc/96/44/46/1041964446.db2.gz VFKJZPSHBUVTCA-GHMZBOCLSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893479355 1041964449 /nfs/dbraw/zinc/96/44/49/1041964449.db2.gz VFKJZPSHBUVTCA-GHMZBOCLSA-N 1 2 304.356 4.135 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)cn2)cc1F ZINC000661660595 1041966459 /nfs/dbraw/zinc/96/64/59/1041966459.db2.gz SBFRDADPFDCMGA-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)cn2)cc1F ZINC000661660595 1041966462 /nfs/dbraw/zinc/96/64/62/1041966462.db2.gz SBFRDADPFDCMGA-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H](C1CC1)[N@H+](Cc1noc(C(C)(C)C)n1)Cc1ccccc1 ZINC000047826022 1041971358 /nfs/dbraw/zinc/97/13/58/1041971358.db2.gz WIFDAYWCZHYMBI-AWEZNQCLSA-N 1 2 313.445 4.168 20 0 DIADLO C[C@@H](C1CC1)[N@@H+](Cc1noc(C(C)(C)C)n1)Cc1ccccc1 ZINC000047826022 1041971366 /nfs/dbraw/zinc/97/13/66/1041971366.db2.gz WIFDAYWCZHYMBI-AWEZNQCLSA-N 1 2 313.445 4.168 20 0 DIADLO COC(=O)CCC[C@H]1CCC[C@@H](Nc2ccc([NH+](C)C)cc2)C1 ZINC000815610899 1041974240 /nfs/dbraw/zinc/97/42/40/1041974240.db2.gz XYYIWIMYUQHQKL-NVXWUHKLSA-N 1 2 318.461 4.067 20 0 DIADLO COC(=O)CCC[C@H]1CCC[C@@H]([NH2+]c2ccc(N(C)C)cc2)C1 ZINC000815610899 1041974244 /nfs/dbraw/zinc/97/42/44/1041974244.db2.gz XYYIWIMYUQHQKL-NVXWUHKLSA-N 1 2 318.461 4.067 20 0 DIADLO CC[C@H](Nc1cc(CC(=O)OC)cc[nH+]1)c1cccc(Cl)c1 ZINC000596143937 1041975221 /nfs/dbraw/zinc/97/52/21/1041975221.db2.gz XEDMBBDXOVFUJT-HNNXBMFYSA-N 1 2 318.804 4.014 20 0 DIADLO Cc1cc([C@H](C)[NH2+]C2(c3ccccc3Cl)CCC2)nn1C ZINC000652216078 1041977636 /nfs/dbraw/zinc/97/76/36/1041977636.db2.gz IJHHKKCFFACOGM-ZDUSSCGKSA-N 1 2 303.837 4.112 20 0 DIADLO OCCSCc1cc[nH+]c(N[C@H]2CCCCC23CCCC3)c1 ZINC000815609108 1041980912 /nfs/dbraw/zinc/98/09/12/1041980912.db2.gz XCDVXRFWFVTYIL-INIZCTEOSA-N 1 2 320.502 4.222 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1cccc(F)c1F ZINC000815649454 1041984485 /nfs/dbraw/zinc/98/44/85/1041984485.db2.gz QGSHQBFHATWKFP-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1c(F)cc(F)cc1F ZINC000815649684 1041985124 /nfs/dbraw/zinc/98/51/24/1041985124.db2.gz WLQTWJDOOILBFY-LLVKDONJSA-N 1 2 309.331 4.272 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1c(F)cc(F)cc1F ZINC000815650607 1041985737 /nfs/dbraw/zinc/98/57/37/1041985737.db2.gz WSUKMCQASQYERS-NSHDSACASA-N 1 2 309.331 4.272 20 0 DIADLO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1c(F)cc(F)cc1F ZINC000815649685 1041986037 /nfs/dbraw/zinc/98/60/37/1041986037.db2.gz WLQTWJDOOILBFY-NSHDSACASA-N 1 2 309.331 4.272 20 0 DIADLO COCc1cc[nH+]c(N[C@H](c2ccc(F)c(C)c2)C2CC2)c1 ZINC000652330346 1042009318 /nfs/dbraw/zinc/00/93/18/1042009318.db2.gz CXULWOSTQAXHKA-SFHVURJKSA-N 1 2 300.377 4.239 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](c2cc(F)ccc2F)C(C)C)c1 ZINC000652330592 1042009535 /nfs/dbraw/zinc/00/95/35/1042009535.db2.gz KJJFDMCGKCGXQS-QGZVFWFLSA-N 1 2 306.356 4.315 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2cccc(OC(F)F)c2)c1 ZINC000652330476 1042010162 /nfs/dbraw/zinc/01/01/62/1042010162.db2.gz HOTRYQAUSYBBGS-NSHDSACASA-N 1 2 308.328 4.003 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2ccccc2OC(F)F)c1 ZINC000652329696 1042010176 /nfs/dbraw/zinc/01/01/76/1042010176.db2.gz FBDJBNZUZUWNCA-NSHDSACASA-N 1 2 308.328 4.003 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2ccc(SC)c(OC)c2)c1 ZINC000652331152 1042012918 /nfs/dbraw/zinc/01/29/18/1042012918.db2.gz ZNQUBMDVLUYYFY-GFCCVEGCSA-N 1 2 318.442 4.132 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2ccc(SC)c(OC)c2)c1 ZINC000652331153 1042013339 /nfs/dbraw/zinc/01/33/39/1042013339.db2.gz ZNQUBMDVLUYYFY-LBPRGKRZSA-N 1 2 318.442 4.132 20 0 DIADLO CC(C)c1ccc(NC(=O)Cc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001135492364 1042036968 /nfs/dbraw/zinc/03/69/68/1042036968.db2.gz CRAXOWCUYBZSHW-UHFFFAOYSA-N 1 2 319.408 4.177 20 0 DIADLO C[C@@H]1COCC[C@@H]1Nc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1 ZINC001170823735 1042051411 /nfs/dbraw/zinc/05/14/11/1042051411.db2.gz GNZDTTYBPIQQNN-CJNGLKHVSA-N 1 2 307.397 4.067 20 0 DIADLO C[C@H]1COCC[C@@H]1Nc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1 ZINC001170823734 1042051603 /nfs/dbraw/zinc/05/16/03/1042051603.db2.gz GNZDTTYBPIQQNN-BBRMVZONSA-N 1 2 307.397 4.067 20 0 DIADLO CCCC[N@H+](Cc1cnn(C)c1Cl)Cc1ccccc1F ZINC000816490804 1042057018 /nfs/dbraw/zinc/05/70/18/1042057018.db2.gz IKHJLIGYUAWAOG-UHFFFAOYSA-N 1 2 309.816 4.015 20 0 DIADLO CCCC[N@@H+](Cc1cnn(C)c1Cl)Cc1ccccc1F ZINC000816490804 1042057021 /nfs/dbraw/zinc/05/70/21/1042057021.db2.gz IKHJLIGYUAWAOG-UHFFFAOYSA-N 1 2 309.816 4.015 20 0 DIADLO FC(F)(F)CC[N@@H+]1CC[C@@H]1c1ccc(Br)cc1 ZINC000662090600 1042060176 /nfs/dbraw/zinc/06/01/76/1042060176.db2.gz AGULYFYLLDENQM-LLVKDONJSA-N 1 2 308.141 4.148 20 0 DIADLO FC(F)(F)CC[N@H+]1CC[C@@H]1c1ccc(Br)cc1 ZINC000662090600 1042060180 /nfs/dbraw/zinc/06/01/80/1042060180.db2.gz AGULYFYLLDENQM-LLVKDONJSA-N 1 2 308.141 4.148 20 0 DIADLO C[C@H]([NH2+][C@H](CO)c1ccc(F)cc1F)c1ccccc1Cl ZINC000662163052 1042076543 /nfs/dbraw/zinc/07/65/43/1042076543.db2.gz UMCFZOTYDLMSMY-MGPLVRAMSA-N 1 2 311.759 4.002 20 0 DIADLO CCCCC[C@H](C)NC(=O)C[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000816840028 1042084389 /nfs/dbraw/zinc/08/43/89/1042084389.db2.gz XSDYJNXDXNYPCC-DOTOQJQBSA-N 1 2 313.445 4.017 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(C(F)F)cc2)C[C@@H](CC(F)(F)F)O1 ZINC000662238968 1042096776 /nfs/dbraw/zinc/09/67/76/1042096776.db2.gz XEZWYVMHAGZCSW-ZWNOBZJWSA-N 1 2 323.305 4.166 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(C(F)F)cc2)C[C@@H](CC(F)(F)F)O1 ZINC000662238968 1042096781 /nfs/dbraw/zinc/09/67/81/1042096781.db2.gz XEZWYVMHAGZCSW-ZWNOBZJWSA-N 1 2 323.305 4.166 20 0 DIADLO Cc1nnc(C[N@H+](C)CCCc2cccc3ccccc32)s1 ZINC000662260522 1042099908 /nfs/dbraw/zinc/09/99/08/1042099908.db2.gz OKLUNQYUWDGSCM-UHFFFAOYSA-N 1 2 311.454 4.064 20 0 DIADLO Cc1nnc(C[N@@H+](C)CCCc2cccc3ccccc32)s1 ZINC000662260522 1042099913 /nfs/dbraw/zinc/09/99/13/1042099913.db2.gz OKLUNQYUWDGSCM-UHFFFAOYSA-N 1 2 311.454 4.064 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1ccc2sccc2c1)n1cc[nH+]c1 ZINC001135860081 1042101445 /nfs/dbraw/zinc/10/14/45/1042101445.db2.gz PYGOKLSJBPERRA-HNNXBMFYSA-N 1 2 313.426 4.324 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1ccc2sccc2c1)n1cc[nH+]c1 ZINC001135860082 1042101697 /nfs/dbraw/zinc/10/16/97/1042101697.db2.gz PYGOKLSJBPERRA-OAHLLOKOSA-N 1 2 313.426 4.324 20 0 DIADLO CCSCc1cc[nH+]c(NCc2nc3cc(F)ccc3o2)c1 ZINC000602014104 1042105322 /nfs/dbraw/zinc/10/53/22/1042105322.db2.gz AXKQKOKUZYNOSP-UHFFFAOYSA-N 1 2 317.389 4.227 20 0 DIADLO Fc1c(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)ccnc1Cl ZINC000817412135 1042108842 /nfs/dbraw/zinc/10/88/42/1042108842.db2.gz DMWYORDBALXZJG-SECBINFHSA-N 1 2 310.722 4.039 20 0 DIADLO Fc1c(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)ccnc1Cl ZINC000817412135 1042108845 /nfs/dbraw/zinc/10/88/45/1042108845.db2.gz DMWYORDBALXZJG-SECBINFHSA-N 1 2 310.722 4.039 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2ccc(OC)cc2F)o1 ZINC000165212653 1042111014 /nfs/dbraw/zinc/11/10/14/1042111014.db2.gz OUHGEPKWTXAFDB-SJCJKPOMSA-N 1 2 321.392 4.028 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2ccc(OC)cc2F)o1 ZINC000165212739 1042111234 /nfs/dbraw/zinc/11/12/34/1042111234.db2.gz OUHGEPKWTXAFDB-SJKOYZFVSA-N 1 2 321.392 4.028 20 0 DIADLO CC(C)c1cccc(C[NH2+]Cc2nnc(C(C)(C)C)s2)c1 ZINC000663318375 1042113512 /nfs/dbraw/zinc/11/35/12/1042113512.db2.gz LKAXQRYEBNDFBI-UHFFFAOYSA-N 1 2 303.475 4.249 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccncc1Cl ZINC000817584577 1042118273 /nfs/dbraw/zinc/11/82/73/1042118273.db2.gz BSXNOICLAINLAR-LBPRGKRZSA-N 1 2 301.821 4.291 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccncc1Cl ZINC000817584577 1042118274 /nfs/dbraw/zinc/11/82/74/1042118274.db2.gz BSXNOICLAINLAR-LBPRGKRZSA-N 1 2 301.821 4.291 20 0 DIADLO Cc1cc(CNC(=S)Nc2cccc(C(C)C)c2)cc(C)[nH+]1 ZINC000817563165 1042119511 /nfs/dbraw/zinc/11/95/11/1042119511.db2.gz VGMZJNZCCAGSBE-UHFFFAOYSA-N 1 2 313.470 4.308 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@H](C)c2cc(F)c(F)c(F)c2)n1 ZINC000162347241 1042125257 /nfs/dbraw/zinc/12/52/57/1042125257.db2.gz UIIAGCZPLHDSQU-BDAKNGLRSA-N 1 2 300.349 4.281 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2cccc(Cl)c2)cs1 ZINC000165247082 1042126565 /nfs/dbraw/zinc/12/65/65/1042126565.db2.gz ZVHGKVQMAKMODY-GHMZBOCLSA-N 1 2 310.850 4.355 20 0 DIADLO Cc1c([C@@H](C)Nc2ccc3c(c2)CC[NH2+]3)cnn1-c1ccccc1 ZINC000817949014 1042130732 /nfs/dbraw/zinc/13/07/32/1042130732.db2.gz GCIZAEIHOGVFIL-CQSZACIVSA-N 1 2 318.424 4.322 20 0 DIADLO FC(F)c1nc(C2([NH2+]C3CC4(C3)CCCCC4)CCC2)no1 ZINC000643293676 1042131686 /nfs/dbraw/zinc/13/16/86/1042131686.db2.gz XBLRYIQMKGNZKL-UHFFFAOYSA-N 1 2 311.376 4.089 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2cc3ccccc3o2)cs1 ZINC000165275763 1042136131 /nfs/dbraw/zinc/13/61/31/1042136131.db2.gz ADFJITZYKXXNBN-NEPJUHHUSA-N 1 2 316.426 4.448 20 0 DIADLO F[C@]1(c2ccccc2)C[C@H]1[NH2+]Cc1ccnc(Cl)c1Cl ZINC000818229673 1042145088 /nfs/dbraw/zinc/14/50/88/1042145088.db2.gz ADXUHLIOFUVWTP-DOMZBBRYSA-N 1 2 311.187 4.115 20 0 DIADLO CCn1c(C[NH2+][C@@H](C)c2ccc(F)cc2F)nc2ccccc21 ZINC000121607732 1042151306 /nfs/dbraw/zinc/15/13/06/1042151306.db2.gz CDNLZMIRFQINGP-LBPRGKRZSA-N 1 2 315.367 4.185 20 0 DIADLO CCCCN(C(=O)c1cccc2[nH+]ccn21)[C@@H]1CCC[C@@H](C)C1 ZINC000818809050 1042160367 /nfs/dbraw/zinc/16/03/67/1042160367.db2.gz HWNKTPMFFHQNMC-HZPDHXFCSA-N 1 2 313.445 4.155 20 0 DIADLO CCCCN(C(=O)c1cccc2[nH+]ccn21)[C@H]1CCC[C@H](C)C1 ZINC000818809049 1042160993 /nfs/dbraw/zinc/16/09/93/1042160993.db2.gz HWNKTPMFFHQNMC-HOTGVXAUSA-N 1 2 313.445 4.155 20 0 DIADLO CCn1c(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)nc2ccccc21 ZINC000071006120 1042174100 /nfs/dbraw/zinc/17/41/00/1042174100.db2.gz XOEBKIFSUWJYII-UKRRQHHQSA-N 1 2 309.413 4.062 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@H+](CCc2ccccc2Cl)CCO1 ZINC000303189693 1042194475 /nfs/dbraw/zinc/19/44/75/1042194475.db2.gz MKAHOFIABGLEKF-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@@H+](CCc2ccccc2Cl)CCO1 ZINC000303189693 1042194480 /nfs/dbraw/zinc/19/44/80/1042194480.db2.gz MKAHOFIABGLEKF-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1nc(C)cs1 ZINC000278910840 1042198084 /nfs/dbraw/zinc/19/80/84/1042198084.db2.gz VXDKAKKLYTWRSN-LBPRGKRZSA-N 1 2 315.364 4.106 20 0 DIADLO CC1(C)C[C@@H](c2ccccc2)[N@H+](Cn2ncsc2=S)C1 ZINC000819901324 1042198987 /nfs/dbraw/zinc/19/89/87/1042198987.db2.gz ZEIGCVDBDSQWLU-ZDUSSCGKSA-N 1 2 305.472 4.105 20 0 DIADLO CC1(C)C[C@@H](c2ccccc2)[N@@H+](Cn2ncsc2=S)C1 ZINC000819901324 1042198992 /nfs/dbraw/zinc/19/89/92/1042198992.db2.gz ZEIGCVDBDSQWLU-ZDUSSCGKSA-N 1 2 305.472 4.105 20 0 DIADLO CC[C@H]1C[N@H+](Cc2nc3ccccc3c(C)c2Cl)C[C@@H](C)O1 ZINC000303429499 1042204392 /nfs/dbraw/zinc/20/43/92/1042204392.db2.gz BQDGYIVWJFSUJM-OCCSQVGLSA-N 1 2 318.848 4.196 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2nc3ccccc3c(C)c2Cl)C[C@@H](C)O1 ZINC000303429499 1042204395 /nfs/dbraw/zinc/20/43/95/1042204395.db2.gz BQDGYIVWJFSUJM-OCCSQVGLSA-N 1 2 318.848 4.196 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](c2ccccc2)[C@@H]2CCCO2)cs1 ZINC001648933402 1042221829 /nfs/dbraw/zinc/22/18/29/1042221829.db2.gz UBCVPMBOETWBMU-DLBZAZTESA-N 1 2 316.470 4.276 20 0 DIADLO COc1cc([C@@H](C)Nc2ccc([NH+](C)C)cc2C)ccc1F ZINC000317285789 1042222915 /nfs/dbraw/zinc/22/29/15/1042222915.db2.gz PQRISMQXHUPFSZ-CYBMUJFWSA-N 1 2 302.393 4.382 20 0 DIADLO C[C@H]([NH2+]Cc1ccco1)c1ccc(C(F)(F)F)nc1Cl ZINC000820847279 1042231875 /nfs/dbraw/zinc/23/18/75/1042231875.db2.gz XQIXHGRPBSHYMZ-QMMMGPOBSA-N 1 2 304.699 4.198 20 0 DIADLO Nc1ccc(Cl)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001159870757 1042242448 /nfs/dbraw/zinc/24/24/48/1042242448.db2.gz FKTOFZWOALJSKO-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)C(C)(C)c2ccccc2)n1 ZINC000585754512 1042242703 /nfs/dbraw/zinc/24/27/03/1042242703.db2.gz PVCRNKJFYOYKSM-ZDUSSCGKSA-N 1 2 319.474 4.251 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)C(C)(C)c2ccccc2)n1 ZINC000585754512 1042242707 /nfs/dbraw/zinc/24/27/07/1042242707.db2.gz PVCRNKJFYOYKSM-ZDUSSCGKSA-N 1 2 319.474 4.251 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1c(F)cccc1F ZINC000278944637 1042250752 /nfs/dbraw/zinc/25/07/52/1042250752.db2.gz YGOHEFXITCIYFZ-SECBINFHSA-N 1 2 316.273 4.229 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2ncc(C(C)(C)C)s2)C2CC2)n1 ZINC000279119180 1042274458 /nfs/dbraw/zinc/27/44/58/1042274458.db2.gz LKYPNRFUGCYXTH-CQSZACIVSA-N 1 2 321.515 4.446 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(C)n1C(C)C ZINC000162719189 1042295384 /nfs/dbraw/zinc/29/53/84/1042295384.db2.gz RMDBRAZRVTXTHI-UHFFFAOYSA-N 1 2 322.412 4.328 20 0 DIADLO CCC[N@H+](Cn1c(=S)snc1-c1ccccc1)C1CC1 ZINC000728902325 1042303246 /nfs/dbraw/zinc/30/32/46/1042303246.db2.gz GEBOQERUZPJEAT-UHFFFAOYSA-N 1 2 305.472 4.173 20 0 DIADLO CCC[N@@H+](Cn1c(=S)snc1-c1ccccc1)C1CC1 ZINC000728902325 1042303251 /nfs/dbraw/zinc/30/32/51/1042303251.db2.gz GEBOQERUZPJEAT-UHFFFAOYSA-N 1 2 305.472 4.173 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)cn1 ZINC000163214919 1042308827 /nfs/dbraw/zinc/30/88/27/1042308827.db2.gz GBMOMXWAYFTIOE-HNAYVOBHSA-N 1 2 309.413 4.497 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc3cc(Cl)cnc3o2)no1 ZINC000823404125 1042323886 /nfs/dbraw/zinc/32/38/86/1042323886.db2.gz MFYRQOULRWNLDB-OAHLLOKOSA-N 1 2 317.776 4.115 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cc3cc(Cl)cnc3o2)no1 ZINC000823404125 1042323893 /nfs/dbraw/zinc/32/38/93/1042323893.db2.gz MFYRQOULRWNLDB-OAHLLOKOSA-N 1 2 317.776 4.115 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2ccnc(Cl)c2F)cc1 ZINC000823394994 1042324288 /nfs/dbraw/zinc/32/42/88/1042324288.db2.gz IESDZFHLXBEVEQ-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)ncc2F)cc1 ZINC000823390960 1042324207 /nfs/dbraw/zinc/32/42/07/1042324207.db2.gz NFRZDCUFXMMKIP-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)ncc2F)cc1 ZINC000823390960 1042324212 /nfs/dbraw/zinc/32/42/12/1042324212.db2.gz NFRZDCUFXMMKIP-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccnc(Cl)c2F)cc1 ZINC000823394994 1042324293 /nfs/dbraw/zinc/32/42/93/1042324293.db2.gz IESDZFHLXBEVEQ-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2ccnn2C(C)C)c2ccccn2)cc1 ZINC000279604600 1042325188 /nfs/dbraw/zinc/32/51/88/1042325188.db2.gz DXDYWEXZYQKMAD-FQEVSTJZSA-N 1 2 320.440 4.047 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(F)ncc2F)[C@H]1c1cccc(F)c1 ZINC000823470963 1042327705 /nfs/dbraw/zinc/32/77/05/1042327705.db2.gz PHUMCYQXSOJTOI-PIGZYNQJSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(F)ncc2F)[C@H]1c1cccc(F)c1 ZINC000823470963 1042327711 /nfs/dbraw/zinc/32/77/11/1042327711.db2.gz PHUMCYQXSOJTOI-PIGZYNQJSA-N 1 2 306.331 4.082 20 0 DIADLO Cc1nc(-c2cccs2)sc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000010165077 1042332354 /nfs/dbraw/zinc/33/23/54/1042332354.db2.gz GAHFSJWFDGUBIW-UHFFFAOYSA-N 1 2 315.423 4.136 20 0 DIADLO Brc1cnc(C[N@@H+]2CCCC[C@H]2C2CCC2)s1 ZINC000646139854 1042352558 /nfs/dbraw/zinc/35/25/58/1042352558.db2.gz DXPIXSYTUKQAHO-NSHDSACASA-N 1 2 315.280 4.060 20 0 DIADLO Brc1cnc(C[N@H+]2CCCC[C@H]2C2CCC2)s1 ZINC000646139854 1042352565 /nfs/dbraw/zinc/35/25/65/1042352565.db2.gz DXPIXSYTUKQAHO-NSHDSACASA-N 1 2 315.280 4.060 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432740529 1042356824 /nfs/dbraw/zinc/35/68/24/1042356824.db2.gz XQBZWEYJBAFUOJ-UHFFFAOYSA-N 1 2 316.401 4.076 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432740529 1042356831 /nfs/dbraw/zinc/35/68/31/1042356831.db2.gz XQBZWEYJBAFUOJ-UHFFFAOYSA-N 1 2 316.401 4.076 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+]Cc1cc2cccnc2o1 ZINC001648946489 1042377132 /nfs/dbraw/zinc/37/71/32/1042377132.db2.gz PONLJDZMNUVQFB-UHFFFAOYSA-N 1 2 307.180 4.424 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1nc(Cl)c(Cl)cc1N ZINC001213497509 1042381074 /nfs/dbraw/zinc/38/10/74/1042381074.db2.gz SBIYBNGXEGTMFB-UHFFFAOYSA-N 1 2 309.200 4.295 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1cc(OC(F)(F)F)ccc1F ZINC001143545326 1042397740 /nfs/dbraw/zinc/39/77/40/1042397740.db2.gz TYANCFLGJVDNKZ-UHFFFAOYSA-N 1 2 319.323 4.418 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1cc(OC(F)(F)F)ccc1F ZINC001143545326 1042397745 /nfs/dbraw/zinc/39/77/45/1042397745.db2.gz TYANCFLGJVDNKZ-UHFFFAOYSA-N 1 2 319.323 4.418 20 0 DIADLO Cc1ncoc1C[N@@H+]1CCC[C@H]1c1ccc(Br)cc1 ZINC000893969236 1042399547 /nfs/dbraw/zinc/39/95/47/1042399547.db2.gz SGVPGLWDONYVGB-AWEZNQCLSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ncoc1C[N@H+]1CCC[C@H]1c1ccc(Br)cc1 ZINC000893969236 1042399552 /nfs/dbraw/zinc/39/95/52/1042399552.db2.gz SGVPGLWDONYVGB-AWEZNQCLSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ncoc1C[N@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000894004249 1042401303 /nfs/dbraw/zinc/40/13/03/1042401303.db2.gz LDTFRNOEAJFLNN-UHFFFAOYSA-N 1 2 306.356 4.206 20 0 DIADLO Cc1ncoc1C[N@@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000894004249 1042401307 /nfs/dbraw/zinc/40/13/07/1042401307.db2.gz LDTFRNOEAJFLNN-UHFFFAOYSA-N 1 2 306.356 4.206 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+](C)Cc1cccc(Cl)c1 ZINC000534331252 1042404261 /nfs/dbraw/zinc/40/42/61/1042404261.db2.gz ABOUCIKTKPTYLE-UHFFFAOYSA-N 1 2 313.832 4.342 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+](C)Cc1cccc(Cl)c1 ZINC000534331252 1042404265 /nfs/dbraw/zinc/40/42/65/1042404265.db2.gz ABOUCIKTKPTYLE-UHFFFAOYSA-N 1 2 313.832 4.342 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+]Cc1nccn1C1CC1 ZINC000894062361 1042405911 /nfs/dbraw/zinc/40/59/11/1042405911.db2.gz WCEXYHKFEGIABD-HNNXBMFYSA-N 1 2 323.362 4.310 20 0 DIADLO C[C@@H](NCc1c(Cl)cccc1Cl)c1cn2c([nH+]1)CCCC2 ZINC000924860037 1042408117 /nfs/dbraw/zinc/40/81/17/1042408117.db2.gz IDNPHLFWRJZXNE-LLVKDONJSA-N 1 2 324.255 4.377 20 0 DIADLO C[C@H](NCc1c(Cl)cccc1Cl)c1cn2c([nH+]1)CCCC2 ZINC000924860040 1042408241 /nfs/dbraw/zinc/40/82/41/1042408241.db2.gz IDNPHLFWRJZXNE-NSHDSACASA-N 1 2 324.255 4.377 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2Cl)on1 ZINC000924859535 1042408403 /nfs/dbraw/zinc/40/84/03/1042408403.db2.gz UEKGDNDYVFXLAL-RKDXNWHRSA-N 1 2 315.200 4.402 20 0 DIADLO C[C@H](CSC(C)(C)C)[NH2+]c1ccc(N2CCO[C@H](C)C2)cc1 ZINC000246110166 1042415368 /nfs/dbraw/zinc/41/53/68/1042415368.db2.gz NETIMKYAMGFYPY-HUUCEWRRSA-N 1 2 322.518 4.244 20 0 DIADLO CCOc1cc(F)c(F)cc1Nc1cccn2cc(C)[nH+]c12 ZINC001211796825 1042453156 /nfs/dbraw/zinc/45/31/56/1042453156.db2.gz MZDGYYVWCCZCKQ-UHFFFAOYSA-N 1 2 303.312 4.063 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC(c3ccccn3)CC2)c1 ZINC000645200178 1042463702 /nfs/dbraw/zinc/46/37/02/1042463702.db2.gz WISQTKXVEMZZJB-UHFFFAOYSA-N 1 2 307.372 4.153 20 0 DIADLO CCC(C)(C)NC(=O)C[N@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000614329944 1042466732 /nfs/dbraw/zinc/46/67/32/1042466732.db2.gz VITMKDANKJGVFF-CYBMUJFWSA-N 1 2 322.880 4.170 20 0 DIADLO CCC(C)(C)NC(=O)C[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000614329944 1042466736 /nfs/dbraw/zinc/46/67/36/1042466736.db2.gz VITMKDANKJGVFF-CYBMUJFWSA-N 1 2 322.880 4.170 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccoc2)no1)c1ccc(C2CC2)cc1 ZINC000419354744 1042477339 /nfs/dbraw/zinc/47/73/39/1042477339.db2.gz MKTYLYNQSDZZMS-GFCCVEGCSA-N 1 2 309.369 4.058 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@@H](C)c1cc(O)cc(F)c1)c1ccco1 ZINC000924889002 1042487529 /nfs/dbraw/zinc/48/75/29/1042487529.db2.gz JGPBAMWVOCVSTQ-GUYCJALGSA-N 1 2 321.392 4.189 20 0 DIADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2cc(-c3ccco3)on2)c1 ZINC000052455105 1042490088 /nfs/dbraw/zinc/49/00/88/1042490088.db2.gz PTJKKFATDYMCSY-MRXNPFEDSA-N 1 2 312.344 4.411 20 0 DIADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2cc(-c3ccco3)on2)c1 ZINC000052455105 1042490091 /nfs/dbraw/zinc/49/00/91/1042490091.db2.gz PTJKKFATDYMCSY-MRXNPFEDSA-N 1 2 312.344 4.411 20 0 DIADLO CC(C)[C@H]1[N@H+](Cc2cnc(C(F)(F)F)s2)CC12CCC2 ZINC000430087374 1042494605 /nfs/dbraw/zinc/49/46/05/1042494605.db2.gz HBKLKHNOZNZJMT-LLVKDONJSA-N 1 2 304.381 4.172 20 0 DIADLO CC(C)[C@H]1[N@@H+](Cc2cnc(C(F)(F)F)s2)CC12CCC2 ZINC000430087374 1042494609 /nfs/dbraw/zinc/49/46/09/1042494609.db2.gz HBKLKHNOZNZJMT-LLVKDONJSA-N 1 2 304.381 4.172 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1cnn(-c2ccc(Cl)cc2)c1 ZINC000430145777 1042531768 /nfs/dbraw/zinc/53/17/68/1042531768.db2.gz JYGPXCSBAXKOLZ-UHFFFAOYSA-N 1 2 315.804 4.059 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1cnn(-c2ccc(Cl)cc2)c1 ZINC000430145777 1042531771 /nfs/dbraw/zinc/53/17/71/1042531771.db2.gz JYGPXCSBAXKOLZ-UHFFFAOYSA-N 1 2 315.804 4.059 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)c(C)c1 ZINC000513385829 1042538215 /nfs/dbraw/zinc/53/82/15/1042538215.db2.gz ATAATBXAVAXEDX-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)c(C)c1 ZINC000513385829 1042538220 /nfs/dbraw/zinc/53/82/20/1042538220.db2.gz ATAATBXAVAXEDX-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1conc1Cc1ccccc1)C2 ZINC000513406623 1042539351 /nfs/dbraw/zinc/53/93/51/1042539351.db2.gz VEWBQGZSPOREFT-UHFFFAOYSA-N 1 2 304.393 4.090 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1conc1Cc1ccccc1)C2 ZINC000513406623 1042539356 /nfs/dbraw/zinc/53/93/56/1042539356.db2.gz VEWBQGZSPOREFT-UHFFFAOYSA-N 1 2 304.393 4.090 20 0 DIADLO c1cc(C[N@@H+](Cc2cc3ccccc3o2)Cc2ccccc2)n[nH]1 ZINC000513435795 1042541098 /nfs/dbraw/zinc/54/10/98/1042541098.db2.gz XWDPXJMYCQLRFE-UHFFFAOYSA-N 1 2 317.392 4.358 20 0 DIADLO c1cc(C[N@H+](Cc2cc3ccccc3o2)Cc2ccccc2)n[nH]1 ZINC000513435795 1042541103 /nfs/dbraw/zinc/54/11/03/1042541103.db2.gz XWDPXJMYCQLRFE-UHFFFAOYSA-N 1 2 317.392 4.358 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+]C(C)(C)c1ncc(C)s1 ZINC000280212127 1042567306 /nfs/dbraw/zinc/56/73/06/1042567306.db2.gz KEPLXLUYLQIEPL-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO Cc1nc(C[N@H+]2CC=C(c3cccc(Cl)c3)CC2)oc1C ZINC000280318041 1042569642 /nfs/dbraw/zinc/56/96/42/1042569642.db2.gz XWFDOFPYYGQWLU-UHFFFAOYSA-N 1 2 302.805 4.234 20 0 DIADLO Cc1nc(C[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)oc1C ZINC000280318041 1042569645 /nfs/dbraw/zinc/56/96/45/1042569645.db2.gz XWFDOFPYYGQWLU-UHFFFAOYSA-N 1 2 302.805 4.234 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2ccnn2C(C)C)c2ccccn2)c1 ZINC000280377711 1042572123 /nfs/dbraw/zinc/57/21/23/1042572123.db2.gz TZSVPGHDISRFMO-FQEVSTJZSA-N 1 2 320.440 4.047 20 0 DIADLO Cc1ccc([C@H]2CCCN2C(=O)NCc2cc(C)[nH+]c(C)c2)cc1 ZINC000420852805 1042613707 /nfs/dbraw/zinc/61/37/07/1042613707.db2.gz SOBHEBPBQJHYDB-LJQANCHMSA-N 1 2 323.440 4.054 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)n1 ZINC000420943911 1042616366 /nfs/dbraw/zinc/61/63/66/1042616366.db2.gz ITMVHWZAAVGYOM-ZDUSSCGKSA-N 1 2 317.399 4.409 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)n1 ZINC000420943911 1042616373 /nfs/dbraw/zinc/61/63/73/1042616373.db2.gz ITMVHWZAAVGYOM-ZDUSSCGKSA-N 1 2 317.399 4.409 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2nc(-c3ccsc3)oc2C)C[C@H](CC)O1 ZINC000420955410 1042617480 /nfs/dbraw/zinc/61/74/80/1042617480.db2.gz LLXUIHWVTXKDBO-GASCZTMLSA-N 1 2 320.458 4.101 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2nc(-c3ccsc3)oc2C)C[C@H](CC)O1 ZINC000420955410 1042617482 /nfs/dbraw/zinc/61/74/82/1042617482.db2.gz LLXUIHWVTXKDBO-GASCZTMLSA-N 1 2 320.458 4.101 20 0 DIADLO CC(C)[N@H+](Cc1nnc(C(C)(C)C)[nH]1)[C@H](C)c1ccsc1 ZINC000421011903 1042619780 /nfs/dbraw/zinc/61/97/80/1042619780.db2.gz PQWXKIQLPAHGND-GFCCVEGCSA-N 1 2 306.479 4.135 20 0 DIADLO CC(C)[N@@H+](Cc1nnc(C(C)(C)C)[nH]1)[C@H](C)c1ccsc1 ZINC000421011903 1042619781 /nfs/dbraw/zinc/61/97/81/1042619781.db2.gz PQWXKIQLPAHGND-GFCCVEGCSA-N 1 2 306.479 4.135 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](CC(F)F)c2ccccc2)s1 ZINC000420998575 1042621125 /nfs/dbraw/zinc/62/11/25/1042621125.db2.gz UAMPTHDIHFTIGV-LBPRGKRZSA-N 1 2 311.401 4.148 20 0 DIADLO CCOc1ccc(Nc2[nH+]cc(C)cc2N)c(C(F)(F)F)c1 ZINC001213232087 1042625761 /nfs/dbraw/zinc/62/57/61/1042625761.db2.gz SWKAVVZXYOPECP-UHFFFAOYSA-N 1 2 311.307 4.133 20 0 DIADLO Cc1c(Cl)c(C[NH2+]C(C)(C)c2ccc(Cl)cc2)nn1C ZINC000421328106 1042630633 /nfs/dbraw/zinc/63/06/33/1042630633.db2.gz RUQADZGREAXDFJ-UHFFFAOYSA-N 1 2 312.244 4.060 20 0 DIADLO CC(C)[N@H+](Cc1cn(C(C)(C)C)nn1)[C@@H](C)c1ccsc1 ZINC000421369613 1042633137 /nfs/dbraw/zinc/63/31/37/1042633137.db2.gz IKYZWCATGGTDEA-ZDUSSCGKSA-N 1 2 306.479 4.066 20 0 DIADLO CC(C)[N@@H+](Cc1cn(C(C)(C)C)nn1)[C@@H](C)c1ccsc1 ZINC000421369613 1042633139 /nfs/dbraw/zinc/63/31/39/1042633139.db2.gz IKYZWCATGGTDEA-ZDUSSCGKSA-N 1 2 306.479 4.066 20 0 DIADLO COc1cc(C[N@H+](C)Cc2ccc(F)cc2Cl)cc(OC)c1 ZINC000513758640 1042652123 /nfs/dbraw/zinc/65/21/23/1042652123.db2.gz AMTZDIDARQZIBU-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2ccc(F)cc2Cl)cc(OC)c1 ZINC000513758640 1042652125 /nfs/dbraw/zinc/65/21/25/1042652125.db2.gz AMTZDIDARQZIBU-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1OC)c1ccc(C)o1 ZINC000421833280 1042655614 /nfs/dbraw/zinc/65/56/14/1042655614.db2.gz NPIJUFORUUXLAT-IUODEOHRSA-N 1 2 323.820 4.288 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2OC)n1 ZINC000271704429 1042666363 /nfs/dbraw/zinc/66/63/63/1042666363.db2.gz UPLSEELKBXJQFB-ZDUSSCGKSA-N 1 2 319.424 4.243 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@H](CC)c2ccccc2)n1 ZINC000271715764 1042666534 /nfs/dbraw/zinc/66/65/34/1042666534.db2.gz VUZAFBIWAYALOJ-TZMCWYRMSA-N 1 2 305.447 4.125 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(OC(F)F)cc1 ZINC000271827463 1042669400 /nfs/dbraw/zinc/66/94/00/1042669400.db2.gz WMKRUIYHMKYHGC-JTQLQIEISA-N 1 2 308.328 4.004 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1cccc(OC(F)F)c1 ZINC000271834361 1042669604 /nfs/dbraw/zinc/66/96/04/1042669604.db2.gz XJKQHZFWAQGMGV-NSHDSACASA-N 1 2 324.371 4.424 20 0 DIADLO COC[C@@H]([NH2+]Cc1nc(-c2ccccc2)oc1C)c1ccccc1 ZINC000271838992 1042670550 /nfs/dbraw/zinc/67/05/50/1042670550.db2.gz UJZKJWILVGAYEW-LJQANCHMSA-N 1 2 322.408 4.127 20 0 DIADLO Cc1cc(N2CC3(CCCC3)[C@H]2c2ccco2)nc(C2CC2)[nH+]1 ZINC000664277511 1042670933 /nfs/dbraw/zinc/67/09/33/1042670933.db2.gz WYEIWNJOOLOQLZ-QGZVFWFLSA-N 1 2 309.413 4.377 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2oc3ccccc3c2CC)[nH]1 ZINC000271896543 1042671702 /nfs/dbraw/zinc/67/17/02/1042671702.db2.gz UKTQUNWCIODADU-RYUDHWBXSA-N 1 2 312.417 4.088 20 0 DIADLO Cc1cc([C@H]([NH2+][C@H](C)c2nc(C(C)C)no2)C2CC2)ccc1F ZINC000272064365 1042676284 /nfs/dbraw/zinc/67/62/84/1042676284.db2.gz INZOFRKBOICJDU-MLGOLLRUSA-N 1 2 317.408 4.442 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H]2CCCOc3cc(F)ccc32)cs1 ZINC000272104372 1042677090 /nfs/dbraw/zinc/67/70/90/1042677090.db2.gz ZMHIULDGGIGFNX-HZMBPMFUSA-N 1 2 306.406 4.155 20 0 DIADLO COC[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1cccc(Cl)c1F ZINC000423220829 1042700966 /nfs/dbraw/zinc/70/09/66/1042700966.db2.gz VYTDOOWWAFAPKG-INIZCTEOSA-N 1 2 320.795 4.247 20 0 DIADLO CCc1ccccc1NC(=O)C[C@H](C)[NH2+]c1ccc2c(c1)CCN2 ZINC000423216849 1042701059 /nfs/dbraw/zinc/70/10/59/1042701059.db2.gz PFDSIFIHSNYJDY-AWEZNQCLSA-N 1 2 323.440 4.046 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1cnn(Cc2ccccc2)c1 ZINC000423218642 1042701497 /nfs/dbraw/zinc/70/14/97/1042701497.db2.gz SDTZWJAQGBWEGR-OAHLLOKOSA-N 1 2 318.424 4.073 20 0 DIADLO COc1cc2nc(C)sc2cc1NCc1c[nH+]cn1C(C)C ZINC000424141344 1042726754 /nfs/dbraw/zinc/72/67/54/1042726754.db2.gz GGWDRJBUUWQEID-UHFFFAOYSA-N 1 2 316.430 4.003 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc(Cl)c(OC(F)F)c1 ZINC000424178615 1042727493 /nfs/dbraw/zinc/72/74/93/1042727493.db2.gz RNQYGNOTBPPTSE-UHFFFAOYSA-N 1 2 315.751 4.331 20 0 DIADLO Cc1ccoc1C[NH2+]C(C)(C)c1nc(C(F)(F)F)cs1 ZINC000072923980 1042739642 /nfs/dbraw/zinc/73/96/42/1042739642.db2.gz ZIBRGRCFEZDEDL-UHFFFAOYSA-N 1 2 304.337 4.088 20 0 DIADLO Cc1ncc([C@@H](C)[N@H+](C)[C@H](C)c2cc(F)ccc2F)c(C)n1 ZINC000637902203 1042741108 /nfs/dbraw/zinc/74/11/08/1042741108.db2.gz JYYUNLPHVLYIOK-VXGBXAGGSA-N 1 2 305.372 4.126 20 0 DIADLO Cc1ncc([C@@H](C)[N@@H+](C)[C@H](C)c2cc(F)ccc2F)c(C)n1 ZINC000637902203 1042741112 /nfs/dbraw/zinc/74/11/12/1042741112.db2.gz JYYUNLPHVLYIOK-VXGBXAGGSA-N 1 2 305.372 4.126 20 0 DIADLO CC[N@H+](Cc1ncnn1C(C)(C)C)Cc1ccc2ccccc2c1 ZINC000513896829 1042762113 /nfs/dbraw/zinc/76/21/13/1042762113.db2.gz GBYWANLSIMGWPL-UHFFFAOYSA-N 1 2 322.456 4.208 20 0 DIADLO CC[N@@H+](Cc1ncnn1C(C)(C)C)Cc1ccc2ccccc2c1 ZINC000513896829 1042762118 /nfs/dbraw/zinc/76/21/18/1042762118.db2.gz GBYWANLSIMGWPL-UHFFFAOYSA-N 1 2 322.456 4.208 20 0 DIADLO CC(C)n1cncc1C[N@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000425319280 1042791129 /nfs/dbraw/zinc/79/11/29/1042791129.db2.gz AQOJMTHZHCACBP-KSSFIOAISA-N 1 2 313.445 4.345 20 0 DIADLO CC(C)n1cncc1C[N@@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000425319280 1042791133 /nfs/dbraw/zinc/79/11/33/1042791133.db2.gz AQOJMTHZHCACBP-KSSFIOAISA-N 1 2 313.445 4.345 20 0 DIADLO FC(F)CC1C[NH+](Cc2ccc(Cl)cc2Br)C1 ZINC000425363786 1042797280 /nfs/dbraw/zinc/79/72/80/1042797280.db2.gz CVYDATQMOHPNHR-UHFFFAOYSA-N 1 2 324.596 4.190 20 0 DIADLO CCN(C)c1ccc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)cn1 ZINC000514973694 1042802940 /nfs/dbraw/zinc/80/29/40/1042802940.db2.gz XIUYJMXPSGKVAH-QGZVFWFLSA-N 1 2 315.848 4.138 20 0 DIADLO CCN(C)c1ccc(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)cn1 ZINC000514973694 1042802947 /nfs/dbraw/zinc/80/29/47/1042802947.db2.gz XIUYJMXPSGKVAH-QGZVFWFLSA-N 1 2 315.848 4.138 20 0 DIADLO CCCCc1nc(C[N@H+](C)CCOc2ccc(F)cc2)cs1 ZINC000515193870 1042812370 /nfs/dbraw/zinc/81/23/70/1042812370.db2.gz JASIORUZGYQVPI-UHFFFAOYSA-N 1 2 322.449 4.136 20 0 DIADLO CCCCc1nc(C[N@@H+](C)CCOc2ccc(F)cc2)cs1 ZINC000515193870 1042812375 /nfs/dbraw/zinc/81/23/75/1042812375.db2.gz JASIORUZGYQVPI-UHFFFAOYSA-N 1 2 322.449 4.136 20 0 DIADLO Cc1ccc([C@H]2[C@@H](C)CCC[N@@H+]2Cc2nc(C(F)F)no2)cc1 ZINC000425414420 1042817823 /nfs/dbraw/zinc/81/78/23/1042817823.db2.gz FXSVROSXFACODB-SWLSCSKDSA-N 1 2 321.371 4.289 20 0 DIADLO Cc1ccc([C@H]2[C@@H](C)CCC[N@H+]2Cc2nc(C(F)F)no2)cc1 ZINC000425414420 1042817826 /nfs/dbraw/zinc/81/78/26/1042817826.db2.gz FXSVROSXFACODB-SWLSCSKDSA-N 1 2 321.371 4.289 20 0 DIADLO Cc1ccc([C@@H]2[C@@H](C)CCC[N@@H+]2Cc2nc(C(F)F)no2)cc1 ZINC000425414423 1042818267 /nfs/dbraw/zinc/81/82/67/1042818267.db2.gz FXSVROSXFACODB-WFASDCNBSA-N 1 2 321.371 4.289 20 0 DIADLO Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2Cc2nc(C(F)F)no2)cc1 ZINC000425414423 1042818276 /nfs/dbraw/zinc/81/82/76/1042818276.db2.gz FXSVROSXFACODB-WFASDCNBSA-N 1 2 321.371 4.289 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](Cc1noc(C2CC2)n1)C1CCCC1 ZINC000425464515 1042827404 /nfs/dbraw/zinc/82/74/04/1042827404.db2.gz ZKYHHWMWLXDEHK-CQSZACIVSA-N 1 2 311.429 4.453 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](Cc1noc(C2CC2)n1)C1CCCC1 ZINC000425464515 1042827408 /nfs/dbraw/zinc/82/74/08/1042827408.db2.gz ZKYHHWMWLXDEHK-CQSZACIVSA-N 1 2 311.429 4.453 20 0 DIADLO Cc1cc(N)nc(SCc2ccc(-c3ccsc3)cc2)[nH+]1 ZINC000436140068 1042828784 /nfs/dbraw/zinc/82/87/84/1042828784.db2.gz PWQHJSJXPHOLFM-UHFFFAOYSA-N 1 2 313.451 4.388 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000515781227 1042835103 /nfs/dbraw/zinc/83/51/03/1042835103.db2.gz SCYZLSIGOCSFPO-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000515781227 1042835105 /nfs/dbraw/zinc/83/51/05/1042835105.db2.gz SCYZLSIGOCSFPO-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc(CC2(C)CCCC2)no1)c1ccccc1 ZINC000517262165 1042873182 /nfs/dbraw/zinc/87/31/82/1042873182.db2.gz BDRNVOYZNCLLID-QGZVFWFLSA-N 1 2 313.445 4.234 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc(CC2(C)CCCC2)no1)c1ccccc1 ZINC000517262165 1042873189 /nfs/dbraw/zinc/87/31/89/1042873189.db2.gz BDRNVOYZNCLLID-QGZVFWFLSA-N 1 2 313.445 4.234 20 0 DIADLO Cc1nnc(C[N@H+](Cc2ccccc2)[C@H](C)c2ccccc2)o1 ZINC000291271289 1042875789 /nfs/dbraw/zinc/87/57/89/1042875789.db2.gz XYZLDMZRLVTVTM-OAHLLOKOSA-N 1 2 307.397 4.141 20 0 DIADLO Cc1nnc(C[N@@H+](Cc2ccccc2)[C@H](C)c2ccccc2)o1 ZINC000291271289 1042875795 /nfs/dbraw/zinc/87/57/95/1042875795.db2.gz XYZLDMZRLVTVTM-OAHLLOKOSA-N 1 2 307.397 4.141 20 0 DIADLO CCn1nccc1CNc1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000664683072 1042887604 /nfs/dbraw/zinc/88/76/04/1042887604.db2.gz WPEQFKBFZDRQMT-UHFFFAOYSA-N 1 2 320.318 4.082 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cnn(C3CCC3)c2)cs1 ZINC000925034480 1042901334 /nfs/dbraw/zinc/90/13/34/1042901334.db2.gz SAVBRJGSNWGVLL-NWDGAFQWSA-N 1 2 304.463 4.039 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccnn2C2CCC2)cs1 ZINC000925034525 1042902354 /nfs/dbraw/zinc/90/23/54/1042902354.db2.gz SZZRPYLODQBNHX-RYUDHWBXSA-N 1 2 304.463 4.039 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@H](c1oc2ccccc2c1C)C(C)C ZINC000925038345 1042907966 /nfs/dbraw/zinc/90/79/66/1042907966.db2.gz TUDFRCYBQHGSFS-WBMJQRKESA-N 1 2 313.401 4.481 20 0 DIADLO CCOc1cc(F)c(C[NH+]2CCC(C(F)(F)F)CC2)c(F)c1 ZINC001143564764 1042910950 /nfs/dbraw/zinc/91/09/50/1042910950.db2.gz KQYFFMIWWZANCS-UHFFFAOYSA-N 1 2 323.305 4.138 20 0 DIADLO CC(C)c1c[nH]c(C[N@H+]2CC=C(c3c[nH]c4ccccc34)CC2)n1 ZINC000894375654 1042914552 /nfs/dbraw/zinc/91/45/52/1042914552.db2.gz TXBNIWQZURDORP-UHFFFAOYSA-N 1 2 320.440 4.304 20 0 DIADLO CC(C)c1c[nH]c(C[N@@H+]2CC=C(c3c[nH]c4ccccc34)CC2)n1 ZINC000894375654 1042914555 /nfs/dbraw/zinc/91/45/55/1042914555.db2.gz TXBNIWQZURDORP-UHFFFAOYSA-N 1 2 320.440 4.304 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@H]3CCOC4(CCC4)C3)cc2)c1C ZINC000295940631 1042915789 /nfs/dbraw/zinc/91/57/89/1042915789.db2.gz GIJIAUQAWLRHLK-KRWDZBQOSA-N 1 2 311.429 4.003 20 0 DIADLO CC(C)([NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)c1cccs1 ZINC000638608484 1042917159 /nfs/dbraw/zinc/91/71/59/1042917159.db2.gz IIJZQSMYSNWNTL-CQSZACIVSA-N 1 2 304.463 4.013 20 0 DIADLO Cc1cc(CNc2ccc(F)c([C@H](C)O)c2)c2c([nH+]1)CCCC2 ZINC000894434830 1042957860 /nfs/dbraw/zinc/95/78/60/1042957860.db2.gz IJBYJTUOVVIOFC-ZDUSSCGKSA-N 1 2 314.404 4.073 20 0 DIADLO C[C@@H](Nc1ccc([NH+]2CCCC2)cc1)c1ccc2c(c1)OCO2 ZINC000319930285 1042962173 /nfs/dbraw/zinc/96/21/73/1042962173.db2.gz FRXDAACQOBOXHP-CQSZACIVSA-N 1 2 310.397 4.189 20 0 DIADLO Cn1cc(C[N@@H+]2CC(C)(C)[C@H]2c2cccnc2)c(C2CCCC2)n1 ZINC000894584736 1042969557 /nfs/dbraw/zinc/96/95/57/1042969557.db2.gz LODFWSHIFZAEOO-LJQANCHMSA-N 1 2 324.472 4.056 20 0 DIADLO Cn1cc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)c(C2CCCC2)n1 ZINC000894584736 1042969561 /nfs/dbraw/zinc/96/95/61/1042969561.db2.gz LODFWSHIFZAEOO-LJQANCHMSA-N 1 2 324.472 4.056 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(F)c(O)c(F)c1 ZINC000093008509 1042973315 /nfs/dbraw/zinc/97/33/15/1042973315.db2.gz VSJPZWOGXFBNST-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1cc(F)c(O)c(F)c1 ZINC000093008509 1042973318 /nfs/dbraw/zinc/97/33/18/1042973318.db2.gz VSJPZWOGXFBNST-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1ccccc1C[N@@H+]1Cc2cccc(Br)c2C1 ZINC000713234432 1043004251 /nfs/dbraw/zinc/00/42/51/1043004251.db2.gz XJMFVIUECUWMCY-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO Cc1ccccc1C[N@H+]1Cc2cccc(Br)c2C1 ZINC000713234432 1043004256 /nfs/dbraw/zinc/00/42/56/1043004256.db2.gz XJMFVIUECUWMCY-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1nccn1CC(C)C ZINC000164843645 1043018653 /nfs/dbraw/zinc/01/86/53/1043018653.db2.gz LTDDXQZZFLLZEO-ZDUSSCGKSA-N 1 2 321.852 4.052 20 0 DIADLO CCc1nc(C[N@@H+]2CCCCC[C@@H]2/C=C\c2ccccc2)no1 ZINC000441171800 1043025083 /nfs/dbraw/zinc/02/50/83/1043025083.db2.gz SINSDRQKBIVKQS-MUSGIIIZSA-N 1 2 311.429 4.090 20 0 DIADLO CCc1nc(C[N@H+]2CCCCC[C@@H]2/C=C\c2ccccc2)no1 ZINC000441171800 1043025087 /nfs/dbraw/zinc/02/50/87/1043025087.db2.gz SINSDRQKBIVKQS-MUSGIIIZSA-N 1 2 311.429 4.090 20 0 DIADLO CC(C)C[C@H]1CCC[N@H+](Cc2ncc(Br)s2)C1 ZINC000520277715 1043030789 /nfs/dbraw/zinc/03/07/89/1043030789.db2.gz QXONRYYUUXTKGH-LLVKDONJSA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)C[C@H]1CCC[N@@H+](Cc2ncc(Br)s2)C1 ZINC000520277715 1043030792 /nfs/dbraw/zinc/03/07/92/1043030792.db2.gz QXONRYYUUXTKGH-LLVKDONJSA-N 1 2 317.296 4.164 20 0 DIADLO Cc1ccc2c(Nc3ccc(F)c(C(=O)N(C)C)c3)cccc2[nH+]1 ZINC001211857866 1043046759 /nfs/dbraw/zinc/04/67/59/1043046759.db2.gz DVPULLATMLVZGH-UHFFFAOYSA-N 1 2 323.371 4.128 20 0 DIADLO C[C@@H](CC[N@H+](C)[C@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894960515 1043053112 /nfs/dbraw/zinc/05/31/12/1043053112.db2.gz MYYJEIDNHVHFRU-LPHOPBHVSA-N 1 2 320.440 4.020 20 0 DIADLO C[C@@H](CC[N@@H+](C)[C@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894960515 1043053127 /nfs/dbraw/zinc/05/31/27/1043053127.db2.gz MYYJEIDNHVHFRU-LPHOPBHVSA-N 1 2 320.440 4.020 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(Cc2ccccc2)no1)c1ccccc1 ZINC000173791182 1043054436 /nfs/dbraw/zinc/05/44/36/1043054436.db2.gz IKAAQLIPMBDMEL-CABCVRRESA-N 1 2 307.397 4.072 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nc(Cc2ccccc2)no1)c1ccccc1 ZINC000174014090 1043058684 /nfs/dbraw/zinc/05/86/84/1043058684.db2.gz LBMDEVPEWXOCRI-QAPCUYQASA-N 1 2 321.424 4.462 20 0 DIADLO CCc1ccccc1C[NH2+][C@H](C)c1nc(Cc2ccccc2)no1 ZINC000174122589 1043059249 /nfs/dbraw/zinc/05/92/49/1043059249.db2.gz JSTGJIGWUHGBOF-OAHLLOKOSA-N 1 2 321.424 4.074 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CCC[C@@H]2c2cccs2)cs1 ZINC000175030573 1043073694 /nfs/dbraw/zinc/07/36/94/1043073694.db2.gz NKPUWXVLWCUXFI-DGCLKSJQSA-N 1 2 308.472 4.249 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CCC[C@@H]2c2cccs2)cs1 ZINC000175030573 1043073703 /nfs/dbraw/zinc/07/37/03/1043073703.db2.gz NKPUWXVLWCUXFI-DGCLKSJQSA-N 1 2 308.472 4.249 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H](C)c1cccc(F)c1F ZINC000188462984 1043084830 /nfs/dbraw/zinc/08/48/30/1043084830.db2.gz PFQKKPPJSLAZCH-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO Fc1cc(CNc2ccc([NH+]3CCCC3)cc2)cnc1Cl ZINC000865420790 1043095413 /nfs/dbraw/zinc/09/54/13/1043095413.db2.gz KHFJDFVLKVVPRF-UHFFFAOYSA-N 1 2 305.784 4.086 20 0 DIADLO C[C@H]([NH2+]Cc1cn(C2CC2)cn1)c1cc(Cl)ccc1Cl ZINC000865436311 1043098338 /nfs/dbraw/zinc/09/83/38/1043098338.db2.gz ALQLBJJMLQWSCQ-JTQLQIEISA-N 1 2 310.228 4.376 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cnc(Cl)s2)cc1 ZINC000177153850 1043103464 /nfs/dbraw/zinc/10/34/64/1043103464.db2.gz WKCWGNDDBUNPGK-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cnc(Cl)s2)cc1 ZINC000177153850 1043103468 /nfs/dbraw/zinc/10/34/68/1043103468.db2.gz WKCWGNDDBUNPGK-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO CC(C)(C)[C@@H]([NH2+]Cc1cn(C2CC2)cn1)c1ccc(F)cc1F ZINC000865491002 1043104857 /nfs/dbraw/zinc/10/48/57/1043104857.db2.gz JIEYZMXOOUUDTK-KRWDZBQOSA-N 1 2 319.399 4.373 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2c(Cl)cncc2Cl)c2ccccc2O1 ZINC000865586014 1043115733 /nfs/dbraw/zinc/11/57/33/1043115733.db2.gz VQKMMXXFRMRRMF-MEBBXXQBSA-N 1 2 323.223 4.390 20 0 DIADLO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]Cc1ccon1 ZINC000178261789 1043125339 /nfs/dbraw/zinc/12/53/39/1043125339.db2.gz CKDBAEBOCSCOEY-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO c1cncc([C@H](Nc2ccc(N3CCCC3)[nH+]c2)C2CCC2)c1 ZINC000280805790 1043131113 /nfs/dbraw/zinc/13/11/13/1043131113.db2.gz IUBVSBHPXCVZHX-LJQANCHMSA-N 1 2 308.429 4.030 20 0 DIADLO Clc1ccccc1OC[C@@H]1CCC[N@H+](Cc2cscn2)C1 ZINC000179005438 1043138945 /nfs/dbraw/zinc/13/89/45/1043138945.db2.gz VJTZERPKQBYUDW-CYBMUJFWSA-N 1 2 322.861 4.088 20 0 DIADLO Clc1ccccc1OC[C@@H]1CCC[N@@H+](Cc2cscn2)C1 ZINC000179005438 1043138952 /nfs/dbraw/zinc/13/89/52/1043138952.db2.gz VJTZERPKQBYUDW-CYBMUJFWSA-N 1 2 322.861 4.088 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@H](c1nc2ccccc2[nH]1)C1CCCCC1 ZINC000865842951 1043139147 /nfs/dbraw/zinc/13/91/47/1043139147.db2.gz YNODBUYHSDBGSZ-SFHVURJKSA-N 1 2 323.444 4.006 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@H](c1nc2ccccc2[nH]1)C1CCCCC1 ZINC000865842951 1043139160 /nfs/dbraw/zinc/13/91/60/1043139160.db2.gz YNODBUYHSDBGSZ-SFHVURJKSA-N 1 2 323.444 4.006 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H](C)c2cc3cnccc3o2)s1 ZINC000865853986 1043142466 /nfs/dbraw/zinc/14/24/66/1043142466.db2.gz LEURSRQFCJFNQS-NSHDSACASA-N 1 2 301.415 4.259 20 0 DIADLO Cc1cc(C)c(NCCCn2cc[nH+]c2)c(C)c1Br ZINC001161684871 1043145464 /nfs/dbraw/zinc/14/54/64/1043145464.db2.gz ULIHXKPKOQNCET-UHFFFAOYSA-N 1 2 322.250 4.073 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1c(F)cc(CO)cc1F ZINC001214092627 1043151847 /nfs/dbraw/zinc/15/18/47/1043151847.db2.gz JPVAVSKWCNJFSE-UHFFFAOYSA-N 1 2 306.356 4.103 20 0 DIADLO CC1=Nc2ccccc2C12CCN(c1nc(C)[nH+]c(C)c1C)CC2 ZINC000866130731 1043155322 /nfs/dbraw/zinc/15/53/22/1043155322.db2.gz QKPPUUUFYUWSKF-UHFFFAOYSA-N 1 2 320.440 4.046 20 0 DIADLO C[C@@H](NCc1ccc(F)c(C[NH+](C)C)c1)c1cccc(F)c1F ZINC000183265199 1043159045 /nfs/dbraw/zinc/15/90/45/1043159045.db2.gz FSAGIHCDZVAEPN-GFCCVEGCSA-N 1 2 322.374 4.016 20 0 DIADLO F[C@@H]1COc2ccccc2[C@H]1[NH2+][C@H]1CCSc2ccccc21 ZINC000866233243 1043163951 /nfs/dbraw/zinc/16/39/51/1043163951.db2.gz UBYWYXHXXHAFKB-RVKKMQEKSA-N 1 2 315.413 4.285 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccn(-c3ccc(F)cc3)n2)s1 ZINC000441476437 1043164316 /nfs/dbraw/zinc/16/43/16/1043164316.db2.gz POSWMSBCLVCDAI-UHFFFAOYSA-N 1 2 315.417 4.013 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccn(-c3ccc(F)cc3)n2)s1 ZINC000441476437 1043164319 /nfs/dbraw/zinc/16/43/19/1043164319.db2.gz POSWMSBCLVCDAI-UHFFFAOYSA-N 1 2 315.417 4.013 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1cccc(Cl)c1 ZINC000073984212 1043167983 /nfs/dbraw/zinc/16/79/83/1043167983.db2.gz IDSMVJYQEREAIA-MNOVXSKESA-N 1 2 307.825 4.432 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)cs1 ZINC000866262814 1043167952 /nfs/dbraw/zinc/16/79/52/1043167952.db2.gz GWZUSBZHJKVZNV-SECBINFHSA-N 1 2 321.833 4.351 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+](C)[C@@H](C)c2cccnc2)s1 ZINC000183634827 1043168729 /nfs/dbraw/zinc/16/87/29/1043168729.db2.gz YOMSHQHUCSAPPG-VIFPVBQESA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+](C)[C@@H](C)c2cccnc2)s1 ZINC000183634827 1043168735 /nfs/dbraw/zinc/16/87/35/1043168735.db2.gz YOMSHQHUCSAPPG-VIFPVBQESA-N 1 2 315.364 4.058 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)n1 ZINC000866268932 1043169591 /nfs/dbraw/zinc/16/95/91/1043169591.db2.gz LDKLTYNYMOGLME-NSHDSACASA-N 1 2 318.808 4.109 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000183959296 1043174668 /nfs/dbraw/zinc/17/46/68/1043174668.db2.gz LAFGCSAVKOBPMZ-OAHLLOKOSA-N 1 2 309.381 4.259 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000183959296 1043174672 /nfs/dbraw/zinc/17/46/72/1043174672.db2.gz LAFGCSAVKOBPMZ-OAHLLOKOSA-N 1 2 309.381 4.259 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@H](C)c2cc3ccccc3s2)n1 ZINC000184358631 1043182090 /nfs/dbraw/zinc/18/20/90/1043182090.db2.gz FBSCZMXCSBEULI-MNOVXSKESA-N 1 2 301.415 4.259 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@H](C)c1cncc(C)c1)c1ccco1 ZINC000184416767 1043185478 /nfs/dbraw/zinc/18/54/78/1043185478.db2.gz XGWXKQQJBZTJDQ-QRWLVFNGSA-N 1 2 322.408 4.432 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@@H](CCc2ccccc2)c2ccccc2)n1 ZINC000614573275 1043195808 /nfs/dbraw/zinc/19/58/08/1043195808.db2.gz BJORMYDKTCSGHP-KXBFYZLASA-N 1 2 321.424 4.403 20 0 DIADLO Cc1cc(N2CCCC[C@H]2c2nccs2)nc(C(C)C)[nH+]1 ZINC000133940538 1043205907 /nfs/dbraw/zinc/20/59/07/1043205907.db2.gz BDMZLCXEIDEJSS-ZDUSSCGKSA-N 1 2 302.447 4.097 20 0 DIADLO C[C@H](c1ccccc1Cl)[NH+]1CCC(C(=O)C(F)(F)F)CC1 ZINC000186006532 1043210424 /nfs/dbraw/zinc/21/04/24/1043210424.db2.gz AHBJEUNJKVHJLZ-SNVBAGLBSA-N 1 2 319.754 4.244 20 0 DIADLO C/C(=C/c1ccccc1)CNc1ccc(-c2cnn(C)c2)c(C)[nH+]1 ZINC001202521493 1043217429 /nfs/dbraw/zinc/21/74/29/1043217429.db2.gz WAJREFYOFUGIHP-PTNGSMBKSA-N 1 2 318.424 4.306 20 0 DIADLO CCCOc1ccc(C[NH2+][C@H](C)c2csc(C(C)C)n2)cn1 ZINC000186329345 1043220969 /nfs/dbraw/zinc/22/09/69/1043220969.db2.gz OQZKKEGQWXJDAM-CYBMUJFWSA-N 1 2 319.474 4.301 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1csc(C(C)C)n1)c1ccccc1 ZINC000186405787 1043222686 /nfs/dbraw/zinc/22/26/86/1043222686.db2.gz WOVYGHRTQNYPPW-DZGCQCFKSA-N 1 2 304.459 4.305 20 0 DIADLO Clc1cc(C[N@@H+]2CC[C@H](Oc3ccccc3Cl)C2)ccn1 ZINC000178973697 1043230076 /nfs/dbraw/zinc/23/00/76/1043230076.db2.gz GNAKZFDFPOYTBU-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cc(C[N@H+]2CC[C@H](Oc3ccccc3Cl)C2)ccn1 ZINC000178973697 1043230081 /nfs/dbraw/zinc/23/00/81/1043230081.db2.gz GNAKZFDFPOYTBU-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO C[C@H]([NH2+][C@H](c1nc2ccccc2[nH]1)C1CCCCC1)c1ncc[nH]1 ZINC000866613522 1043236803 /nfs/dbraw/zinc/23/68/03/1043236803.db2.gz BXQLWZGBZJHFTL-GUYCJALGSA-N 1 2 323.444 4.258 20 0 DIADLO CC[N@H+](Cc1ccccc1Br)[C@H](C)c1cccnc1 ZINC000520623239 1043240791 /nfs/dbraw/zinc/24/07/91/1043240791.db2.gz HGMKZLLMJDSDDF-CYBMUJFWSA-N 1 2 319.246 4.427 20 0 DIADLO CC[N@@H+](Cc1ccccc1Br)[C@H](C)c1cccnc1 ZINC000520623239 1043240801 /nfs/dbraw/zinc/24/08/01/1043240801.db2.gz HGMKZLLMJDSDDF-CYBMUJFWSA-N 1 2 319.246 4.427 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2nc(C(C)(C)C)no2)C(C)C)cc1 ZINC000074044275 1043253660 /nfs/dbraw/zinc/25/36/60/1043253660.db2.gz BGBBCXLZECTHCH-KRWDZBQOSA-N 1 2 315.461 4.416 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)n1 ZINC000074071415 1043268202 /nfs/dbraw/zinc/26/82/02/1043268202.db2.gz HEXLBHTUCGPWQV-VXGBXAGGSA-N 1 2 307.825 4.477 20 0 DIADLO C[C@H](Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)[C@@H]1CC1(F)F ZINC000639123292 1043274020 /nfs/dbraw/zinc/27/40/20/1043274020.db2.gz IJEBJTTXQMKTCJ-LRDDRELGSA-N 1 2 317.383 4.342 20 0 DIADLO c1ccc2c(c1)NCCC[C@@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000193102215 1043280922 /nfs/dbraw/zinc/28/09/22/1043280922.db2.gz ZWFHLXTZZDMBMR-SFHVURJKSA-N 1 2 308.429 4.041 20 0 DIADLO CCC[N@H+](Cc1ncnn1CC)[C@@H](C)c1cc2ccccc2o1 ZINC000193316438 1043281329 /nfs/dbraw/zinc/28/13/29/1043281329.db2.gz PJQDQCJRTSDRSS-AWEZNQCLSA-N 1 2 312.417 4.017 20 0 DIADLO CCC[N@@H+](Cc1ncnn1CC)[C@@H](C)c1cc2ccccc2o1 ZINC000193316438 1043281342 /nfs/dbraw/zinc/28/13/42/1043281342.db2.gz PJQDQCJRTSDRSS-AWEZNQCLSA-N 1 2 312.417 4.017 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccccc2)c2ccncc2)sc1C ZINC000122348056 1043297030 /nfs/dbraw/zinc/29/70/30/1043297030.db2.gz AYBYVVCSPJZJIJ-SFHVURJKSA-N 1 2 309.438 4.034 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+][C@H](C)c1cccnc1Cl ZINC000122433307 1043304444 /nfs/dbraw/zinc/30/44/44/1043304444.db2.gz LDRDICZHGOULLM-GHMZBOCLSA-N 1 2 308.784 4.295 20 0 DIADLO Cc1ccccc1[C@@H](C)[NH2+][C@H](c1nccn1C)c1ccc(F)cc1 ZINC000268784632 1043330959 /nfs/dbraw/zinc/33/09/59/1043330959.db2.gz VDOFGYZUASRERV-BEFAXECRSA-N 1 2 323.415 4.308 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H]2CCOc3c(Cl)cccc32)cs1 ZINC000268870931 1043337692 /nfs/dbraw/zinc/33/76/92/1043337692.db2.gz GDBIUOXAIHGYNI-NOZJJQNGSA-N 1 2 308.834 4.279 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H]2CC(C)(C)Cc3occc32)cs1 ZINC000269087698 1043356492 /nfs/dbraw/zinc/35/64/92/1043356492.db2.gz PWDSVZWAOFOXFH-BXUZGUMPSA-N 1 2 320.458 4.247 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccnc(OC3CCCC3)c2)cs1 ZINC000269388384 1043363016 /nfs/dbraw/zinc/36/30/16/1043363016.db2.gz BUOYFQCAYLDESW-GFCCVEGCSA-N 1 2 317.458 4.019 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H](c2nc3ccccc3[nH]2)C(C)C)cs1 ZINC000269399086 1043364877 /nfs/dbraw/zinc/36/48/77/1043364877.db2.gz FUIRITJTGFDMNP-BZNIZROVSA-N 1 2 314.458 4.376 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]Cc2c(C)oc3ccccc32)cs1 ZINC000270271317 1043383029 /nfs/dbraw/zinc/38/30/29/1043383029.db2.gz ROSSFARDMUECKL-GFCCVEGCSA-N 1 2 316.426 4.195 20 0 DIADLO C[C@@H](C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2)C(C)(C)C ZINC000270440624 1043385973 /nfs/dbraw/zinc/38/59/73/1043385973.db2.gz JPOVALKHILEQID-AWEZNQCLSA-N 1 2 323.440 4.223 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)c(C)[nH+]1 ZINC000521344174 1043388288 /nfs/dbraw/zinc/38/82/88/1043388288.db2.gz LCUDWNYGXINAPO-OLZOCXBDSA-N 1 2 314.351 4.314 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ncc(C3CC3)o2)[C@@H]1c1cccc(F)c1 ZINC000270648523 1043393147 /nfs/dbraw/zinc/39/31/47/1043393147.db2.gz SXCCSVRPZMGKMX-XIKOKIGWSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ncc(C3CC3)o2)[C@@H]1c1cccc(F)c1 ZINC000270648523 1043393153 /nfs/dbraw/zinc/39/31/53/1043393153.db2.gz SXCCSVRPZMGKMX-XIKOKIGWSA-N 1 2 300.377 4.274 20 0 DIADLO COc1ccc(C[NH2+][C@H](C)c2cscn2)c(C(F)(F)F)c1 ZINC000271070017 1043402059 /nfs/dbraw/zinc/40/20/59/1043402059.db2.gz DXDOBIQGUCWIEQ-SECBINFHSA-N 1 2 316.348 4.021 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2cscn2)c(OC(C)(C)C)c1 ZINC000271071823 1043402812 /nfs/dbraw/zinc/40/28/12/1043402812.db2.gz FJVQBJKSHHFEID-ZDUSSCGKSA-N 1 2 304.459 4.480 20 0 DIADLO CCC[C@H]([NH2+][C@H](C)c1nn(CC)nc1C)c1ccc(F)cc1F ZINC000925264332 1043405198 /nfs/dbraw/zinc/40/51/98/1043405198.db2.gz MAJKARLENVOQAO-BZNIZROVSA-N 1 2 322.403 4.077 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)on1 ZINC000925265089 1043405260 /nfs/dbraw/zinc/40/52/60/1043405260.db2.gz QLXKCHXNSGGETQ-QLJPJBMISA-N 1 2 324.371 4.399 20 0 DIADLO CC(C)[C@H]([NH2+][C@H](C)c1cscn1)c1nc2ccccc2[nH]1 ZINC000271190988 1043408153 /nfs/dbraw/zinc/40/81/53/1043408153.db2.gz XOCVOJPLEJLPRM-ABAIWWIYSA-N 1 2 300.431 4.067 20 0 DIADLO C[C@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1ccc(Cl)s1 ZINC000271425286 1043415938 /nfs/dbraw/zinc/41/59/38/1043415938.db2.gz CRKNOFPMBFMCDD-GZMMTYOYSA-N 1 2 317.788 4.064 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1ccccc1OC1CCC1 ZINC000925437318 1043416163 /nfs/dbraw/zinc/41/61/63/1043416163.db2.gz AVGRTZUHBNJSPC-INIZCTEOSA-N 1 2 312.413 4.082 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1ccc(Cl)cc1Cl ZINC000271430958 1043416156 /nfs/dbraw/zinc/41/61/56/1043416156.db2.gz BBZBJDSPYTUQOC-OTYXRUKQSA-N 1 2 310.228 4.445 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1ccc(Cl)cc1Cl ZINC000271430958 1043416157 /nfs/dbraw/zinc/41/61/57/1043416157.db2.gz BBZBJDSPYTUQOC-OTYXRUKQSA-N 1 2 310.228 4.445 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@H]2CCC(F)(F)C2)no1)c1ccccc1 ZINC000347265000 1043418551 /nfs/dbraw/zinc/41/85/51/1043418551.db2.gz NWYKOWMCDRGZJT-UONOGXRCSA-N 1 2 321.371 4.014 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@H]2CCC(F)(F)C2)no1)c1ccccc1 ZINC000347265000 1043418557 /nfs/dbraw/zinc/41/85/57/1043418557.db2.gz NWYKOWMCDRGZJT-UONOGXRCSA-N 1 2 321.371 4.014 20 0 DIADLO CC(C)c1nnc([C@H](C)[NH2+][C@@H]2C[C@H](C)Sc3sccc32)[nH]1 ZINC000271481567 1043423504 /nfs/dbraw/zinc/42/35/04/1043423504.db2.gz JSIZSZVWUDLCAE-JBLDHEPKSA-N 1 2 322.503 4.266 20 0 DIADLO C[C@@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1cccc(Cl)c1 ZINC000271481523 1043424023 /nfs/dbraw/zinc/42/40/23/1043424023.db2.gz NJUDGQSTPYYJHZ-MEBBXXQBSA-N 1 2 311.759 4.002 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000271472402 1043424060 /nfs/dbraw/zinc/42/40/60/1043424060.db2.gz HPVAUNVLZYQPSI-NHYWBVRUSA-N 1 2 319.836 4.190 20 0 DIADLO C[C@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1cccc(Cl)c1 ZINC000271481520 1043424369 /nfs/dbraw/zinc/42/43/69/1043424369.db2.gz NJUDGQSTPYYJHZ-BONVTDFDSA-N 1 2 311.759 4.002 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc(C(F)(F)F)n[nH]2)c1 ZINC000442814710 1043428831 /nfs/dbraw/zinc/42/88/31/1043428831.db2.gz UCPMRVZJCBDIHE-CQSZACIVSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2cc(C(F)(F)F)n[nH]2)c1 ZINC000442814710 1043428835 /nfs/dbraw/zinc/42/88/35/1043428835.db2.gz UCPMRVZJCBDIHE-CQSZACIVSA-N 1 2 309.335 4.074 20 0 DIADLO CC(C)(C)[C@@H]1C[C@H](Nc2ccc([NH+]3CCCC3)cc2)CCO1 ZINC000872055400 1043439912 /nfs/dbraw/zinc/43/99/12/1043439912.db2.gz HUSIXZKFKCRYIE-AEFFLSMTSA-N 1 2 302.462 4.292 20 0 DIADLO CC(C)(C)[C@@H]1C[C@H]([NH2+]c2ccc(N3CCCC3)cc2)CCO1 ZINC000872055400 1043439917 /nfs/dbraw/zinc/43/99/17/1043439917.db2.gz HUSIXZKFKCRYIE-AEFFLSMTSA-N 1 2 302.462 4.292 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(Cl)nc1Cl)c1nc(C)cs1 ZINC000283295784 1043469661 /nfs/dbraw/zinc/46/96/61/1043469661.db2.gz YFUNMHSOSFTCIM-SNVBAGLBSA-N 1 2 316.257 4.394 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1cccc(O)c1F)c1cccc(Cl)c1 ZINC000872072355 1043450560 /nfs/dbraw/zinc/45/05/60/1043450560.db2.gz CTOMWFIRBQZLJJ-IAQYHMDHSA-N 1 2 323.795 4.223 20 0 DIADLO CCOc1cccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)n1 ZINC000558184335 1043453200 /nfs/dbraw/zinc/45/32/00/1043453200.db2.gz QMURDZANWMYOCN-INIZCTEOSA-N 1 2 302.443 4.125 20 0 DIADLO CCOc1cccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)n1 ZINC000558184335 1043453208 /nfs/dbraw/zinc/45/32/08/1043453208.db2.gz QMURDZANWMYOCN-INIZCTEOSA-N 1 2 302.443 4.125 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(C(F)(F)F)cc2C)s1 ZINC000443002919 1043465797 /nfs/dbraw/zinc/46/57/97/1043465797.db2.gz UENNYHXGZUVCGI-SECBINFHSA-N 1 2 315.364 4.025 20 0 DIADLO Cc1nc2ccc(C[N@@H+]3CCCC[C@@H]3c3cc[nH]n3)cc2s1 ZINC000348713234 1043465939 /nfs/dbraw/zinc/46/59/39/1043465939.db2.gz KEUZNJPRMSGPNU-MRXNPFEDSA-N 1 2 312.442 4.055 20 0 DIADLO Cc1nc2ccc(C[N@H+]3CCCC[C@@H]3c3cc[nH]n3)cc2s1 ZINC000348713234 1043465946 /nfs/dbraw/zinc/46/59/46/1043465946.db2.gz KEUZNJPRMSGPNU-MRXNPFEDSA-N 1 2 312.442 4.055 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(Cl)nc1Cl)c1nc(C)cs1 ZINC000283295779 1043469816 /nfs/dbraw/zinc/46/98/16/1043469816.db2.gz YFUNMHSOSFTCIM-JTQLQIEISA-N 1 2 316.257 4.394 20 0 DIADLO Cc1nccnc1[C@H](C)[NH2+][C@@H](C)c1csc(-c2ccccc2)n1 ZINC000872131691 1043472738 /nfs/dbraw/zinc/47/27/38/1043472738.db2.gz ZPEFAIUMNNQMMX-JSGCOSHPSA-N 1 2 324.453 4.320 20 0 DIADLO CCC[N@H+](Cc1noc(C(C)(C)C)n1)[C@@H]1CCc2ccccc21 ZINC000521820004 1043483977 /nfs/dbraw/zinc/48/39/77/1043483977.db2.gz QNUOMHOTCAZMHV-MRXNPFEDSA-N 1 2 313.445 4.267 20 0 DIADLO CCC[N@@H+](Cc1noc(C(C)(C)C)n1)[C@@H]1CCc2ccccc21 ZINC000521820004 1043483991 /nfs/dbraw/zinc/48/39/91/1043483991.db2.gz QNUOMHOTCAZMHV-MRXNPFEDSA-N 1 2 313.445 4.267 20 0 DIADLO c1ccc(-c2nnc(C[NH2+][C@H](CC3CC3)c3ccccc3)[nH]2)cc1 ZINC000777578862 1043488508 /nfs/dbraw/zinc/48/85/08/1043488508.db2.gz OICAVJGJTKDAGQ-GOSISDBHSA-N 1 2 318.424 4.103 20 0 DIADLO C[C@@H]([NH2+]C1(c2cccc(C(F)(F)F)c2)CCC1)c1ncco1 ZINC000925893898 1043489349 /nfs/dbraw/zinc/48/93/49/1043489349.db2.gz RZDALGPYZCOLPB-LLVKDONJSA-N 1 2 310.319 4.423 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]C1(c2ccc(F)cc2F)CCC1 ZINC000925954256 1043498647 /nfs/dbraw/zinc/49/86/47/1043498647.db2.gz YXQATWJAYYJWPT-HNNXBMFYSA-N 1 2 318.367 4.308 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1C[N@H+](Cc1cccnc1)C1CC1 ZINC000349287242 1043499237 /nfs/dbraw/zinc/49/92/37/1043499237.db2.gz UQXUVPPPTUQRCE-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1C[N@@H+](Cc1cccnc1)C1CC1 ZINC000349287242 1043499248 /nfs/dbraw/zinc/49/92/48/1043499248.db2.gz UQXUVPPPTUQRCE-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO CCSc1ccc(C(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)cc1 ZINC000349283648 1043500242 /nfs/dbraw/zinc/50/02/42/1043500242.db2.gz KVRDMJCBYOGLJE-UHFFFAOYSA-N 1 2 311.410 4.236 20 0 DIADLO CC[C@@H]1CC[C@H]1Nc1cccc(C[N@H+](C)Cc2cscn2)c1 ZINC000558403899 1043501177 /nfs/dbraw/zinc/50/11/77/1043501177.db2.gz POXUUGYUEAUMBA-CRAIPNDOSA-N 1 2 315.486 4.376 20 0 DIADLO CC[C@@H]1CC[C@H]1Nc1cccc(C[N@@H+](C)Cc2cscn2)c1 ZINC000558403899 1043501184 /nfs/dbraw/zinc/50/11/84/1043501184.db2.gz POXUUGYUEAUMBA-CRAIPNDOSA-N 1 2 315.486 4.376 20 0 DIADLO CSc1cccc(NC(=O)Nc2ccc3[nH+]c(C)cn3c2)c1 ZINC000349467085 1043507888 /nfs/dbraw/zinc/50/78/88/1043507888.db2.gz WQKOFMFGTIHREK-UHFFFAOYSA-N 1 2 312.398 4.009 20 0 DIADLO Cc1cc(N[C@@H]2CCc3c2nccc3Cl)ccc1[NH+](C)C ZINC000926053352 1043514506 /nfs/dbraw/zinc/51/45/06/1043514506.db2.gz ZUNPCYVROQTHBH-OAHLLOKOSA-N 1 2 301.821 4.209 20 0 DIADLO COc1ccc(C[NH+](Cc2ccco2)Cc2ccco2)cc1C ZINC000349617597 1043516350 /nfs/dbraw/zinc/51/63/50/1043516350.db2.gz QOKSOGZNODYKCA-UHFFFAOYSA-N 1 2 311.381 4.392 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000349650535 1043517706 /nfs/dbraw/zinc/51/77/06/1043517706.db2.gz AWWFPNXAWASCQB-RISCZKNCSA-N 1 2 315.442 4.053 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000349650535 1043517714 /nfs/dbraw/zinc/51/77/14/1043517714.db2.gz AWWFPNXAWASCQB-RISCZKNCSA-N 1 2 315.442 4.053 20 0 DIADLO COCc1nc(C[N@H+]([C@H](C)c2ccccc2)C2CC2)cs1 ZINC000349941550 1043530669 /nfs/dbraw/zinc/53/06/69/1043530669.db2.gz ARCRCLQRGAIXRO-CYBMUJFWSA-N 1 2 302.443 4.015 20 0 DIADLO COCc1nc(C[N@@H+]([C@H](C)c2ccccc2)C2CC2)cs1 ZINC000349941550 1043530675 /nfs/dbraw/zinc/53/06/75/1043530675.db2.gz ARCRCLQRGAIXRO-CYBMUJFWSA-N 1 2 302.443 4.015 20 0 DIADLO Cc1[nH]c(SCc2cc[nH+]c(N(C)C)c2)nc1-c1ccccc1 ZINC000777588096 1043532797 /nfs/dbraw/zinc/53/27/97/1043532797.db2.gz ZCNIUPIJWUELJB-UHFFFAOYSA-N 1 2 324.453 4.138 20 0 DIADLO c1cc2c(s1)CC[N@@H+](Cc1cnc(C3CCCC3)s1)C2 ZINC000349976926 1043534293 /nfs/dbraw/zinc/53/42/93/1043534293.db2.gz XZHASUZTLGXAMH-UHFFFAOYSA-N 1 2 304.484 4.421 20 0 DIADLO c1cc2c(s1)CC[N@H+](Cc1cnc(C3CCCC3)s1)C2 ZINC000349976926 1043534302 /nfs/dbraw/zinc/53/43/02/1043534302.db2.gz XZHASUZTLGXAMH-UHFFFAOYSA-N 1 2 304.484 4.421 20 0 DIADLO CCCOc1cccc2c(NCc3ccc(C)nc3)cc[nH+]c12 ZINC000350313076 1043542925 /nfs/dbraw/zinc/54/29/25/1043542925.db2.gz WQXDFUVAFHYEGD-UHFFFAOYSA-N 1 2 307.397 4.339 20 0 DIADLO CC[C@H](Cc1ccccc1)C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000522129471 1043546649 /nfs/dbraw/zinc/54/66/49/1043546649.db2.gz KKERCODXIJVURE-QGZVFWFLSA-N 1 2 319.408 4.080 20 0 DIADLO Cc1coc(C[NH2+]Cc2cc(Cl)ccc2Br)c1 ZINC000718096346 1043557239 /nfs/dbraw/zinc/55/72/39/1043557239.db2.gz HDXJGWHDVUIRTM-UHFFFAOYSA-N 1 2 314.610 4.294 20 0 DIADLO COc1ccc([C@H](Cc2ccccc2)[NH2+][C@@H](C)c2ncco2)cc1 ZINC000926448782 1043579558 /nfs/dbraw/zinc/57/95/58/1043579558.db2.gz BLVFSTBYDCAKHJ-KXBFYZLASA-N 1 2 322.408 4.318 20 0 DIADLO COc1ccc([C@H](Cc2ccccc2)[NH2+][C@H](C)c2ncco2)cc1 ZINC000926448778 1043580867 /nfs/dbraw/zinc/58/08/67/1043580867.db2.gz BLVFSTBYDCAKHJ-BEFAXECRSA-N 1 2 322.408 4.318 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)cn1 ZINC001137079675 1043581490 /nfs/dbraw/zinc/58/14/90/1043581490.db2.gz ZTGSPBUKTKUFKI-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1cc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)cn1 ZINC001137079675 1043581498 /nfs/dbraw/zinc/58/14/98/1043581498.db2.gz ZTGSPBUKTKUFKI-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO CCc1nc(C)c(C[NH2+][C@H](C)c2cc(-c3ccccc3)no2)o1 ZINC000926479929 1043581734 /nfs/dbraw/zinc/58/17/34/1043581734.db2.gz JOJFOWSUKWUYHA-GFCCVEGCSA-N 1 2 311.385 4.051 20 0 DIADLO Cn1cncc1C[N@@H+]1CCCC[C@@H]1c1ccccc1C(F)(F)F ZINC000353150718 1043588783 /nfs/dbraw/zinc/58/87/83/1043588783.db2.gz TUJMIIRWKNSZGB-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1cncc1C[N@H+]1CCCC[C@@H]1c1ccccc1C(F)(F)F ZINC000353150718 1043588793 /nfs/dbraw/zinc/58/87/93/1043588793.db2.gz TUJMIIRWKNSZGB-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1cc(C2CC2)ccc1F ZINC000926500525 1043589542 /nfs/dbraw/zinc/58/95/42/1043589542.db2.gz DJASVCKBSRNLQO-INIZCTEOSA-N 1 2 300.377 4.167 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1csc(C2CC2)n1 ZINC000113315403 1043592610 /nfs/dbraw/zinc/59/26/10/1043592610.db2.gz LIQCVQBCMFQXDD-GFCCVEGCSA-N 1 2 302.443 4.188 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](c1ccc(C)cc1)c1cccnc1 ZINC000926532938 1043594635 /nfs/dbraw/zinc/59/46/35/1043594635.db2.gz OCDGURVFMUCGFJ-APWZRJJASA-N 1 2 320.440 4.047 20 0 DIADLO Cc1ccccc1C[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1ccco1 ZINC000926532345 1043594759 /nfs/dbraw/zinc/59/47/59/1043594759.db2.gz LJHBVOLXRSRZGH-SZMVWBNQSA-N 1 2 321.424 4.364 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2csc(C(F)(F)F)c2)co1 ZINC000926536042 1043595019 /nfs/dbraw/zinc/59/50/19/1043595019.db2.gz IOCVJPSTYNHIPD-MRVPVSSYSA-N 1 2 304.337 4.168 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccnn2CC(C)C)s1 ZINC000648009932 1043596879 /nfs/dbraw/zinc/59/68/79/1043596879.db2.gz CXDPUKRBYVZFJQ-CQSZACIVSA-N 1 2 320.506 4.059 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccnn2CC(C)C)s1 ZINC000648009932 1043596890 /nfs/dbraw/zinc/59/68/90/1043596890.db2.gz CXDPUKRBYVZFJQ-CQSZACIVSA-N 1 2 320.506 4.059 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)cn1 ZINC001137081933 1043597578 /nfs/dbraw/zinc/59/75/78/1043597578.db2.gz WIWQDYZZSPZSIK-INIZCTEOSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1cc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)cn1 ZINC001137081933 1043597588 /nfs/dbraw/zinc/59/75/88/1043597588.db2.gz WIWQDYZZSPZSIK-INIZCTEOSA-N 1 2 305.372 4.079 20 0 DIADLO C[NH+](C)c1ccc(N[C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1 ZINC000777602305 1043602658 /nfs/dbraw/zinc/60/26/58/1043602658.db2.gz KHYLQAIVNVJALG-JXFKEZNVSA-N 1 2 310.441 4.332 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H](C)c2cc(C)on2)ccc1OC(C)C ZINC000353410315 1043603903 /nfs/dbraw/zinc/60/39/03/1043603903.db2.gz HBVOLMYNOMSSQM-ZIAGYGMSSA-N 1 2 318.417 4.191 20 0 DIADLO COc1cc([C@H](C)[NH2+]C2(c3ccccc3Cl)CCC2)on1 ZINC000926643137 1043611250 /nfs/dbraw/zinc/61/12/50/1043611250.db2.gz QLLNKRVHJCUOEO-NSHDSACASA-N 1 2 306.793 4.067 20 0 DIADLO CSc1ccc(/C=C\C(=O)Nc2c(C)cc(C)[nH+]c2C)s1 ZINC000875097439 1043613329 /nfs/dbraw/zinc/61/33/29/1043613329.db2.gz KMQCVVZIGFMSPX-ALCCZGGFSA-N 1 2 318.467 4.442 20 0 DIADLO COc1c(C)cccc1C[NH2+][C@H]1COCc2cccc(Cl)c21 ZINC000926664970 1043614805 /nfs/dbraw/zinc/61/48/05/1043614805.db2.gz AEBZYMADWDRUMV-INIZCTEOSA-N 1 2 317.816 4.018 20 0 DIADLO c1cc(C[NH2+][C@H](c2cc3ccccc3o2)c2cccnc2)co1 ZINC000353546800 1043616315 /nfs/dbraw/zinc/61/63/15/1043616315.db2.gz XACODSJMMXIVTC-IBGZPJMESA-N 1 2 304.349 4.300 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ncc(Cl)cc1Cl ZINC000353551522 1043616503 /nfs/dbraw/zinc/61/65/03/1043616503.db2.gz TUYDJFGHIOICAW-UHFFFAOYSA-N 1 2 314.216 4.018 20 0 DIADLO CCSc1ccccc1[C@@H](C)[NH2+]Cc1nnc(CC)s1 ZINC000353565719 1043617553 /nfs/dbraw/zinc/61/75/53/1043617553.db2.gz XEIXGIPISKRQSJ-LLVKDONJSA-N 1 2 307.488 4.063 20 0 DIADLO Clc1cccc2c1CC[C@@H]2[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000443620190 1043622575 /nfs/dbraw/zinc/62/25/75/1043622575.db2.gz JFXSKKYCIGMUOR-IRXDYDNUSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1cccc2c1CC[C@@H]2[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000443620190 1043622582 /nfs/dbraw/zinc/62/25/82/1043622582.db2.gz JFXSKKYCIGMUOR-IRXDYDNUSA-N 1 2 319.857 4.462 20 0 DIADLO Cc1ccncc1C[N@@H+](C)[C@H](C)c1ccccc1Br ZINC000474116600 1043630936 /nfs/dbraw/zinc/63/09/36/1043630936.db2.gz IVPWPLXZPZQRSA-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccncc1C[N@H+](C)[C@H](C)c1ccccc1Br ZINC000474116600 1043630941 /nfs/dbraw/zinc/63/09/41/1043630941.db2.gz IVPWPLXZPZQRSA-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+]Cc1ccc(F)cc1F ZINC001648961091 1043635058 /nfs/dbraw/zinc/63/50/58/1043635058.db2.gz XKPGZTWCGVFQGH-UHFFFAOYSA-N 1 2 320.364 4.280 20 0 DIADLO C[C@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1ccnn1CC1CCC1 ZINC000926810742 1043635352 /nfs/dbraw/zinc/63/53/52/1043635352.db2.gz WQSQBDZKHOEORN-GUYCJALGSA-N 1 2 319.399 4.184 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2c(Cl)oc3ccccc32)n1 ZINC000353752727 1043640590 /nfs/dbraw/zinc/64/05/90/1043640590.db2.gz UIACZUOZWSYJJB-UHFFFAOYSA-N 1 2 300.789 4.422 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2c(Cl)oc3ccccc32)n1 ZINC000353752727 1043640599 /nfs/dbraw/zinc/64/05/99/1043640599.db2.gz UIACZUOZWSYJJB-UHFFFAOYSA-N 1 2 300.789 4.422 20 0 DIADLO CCc1nc(C[N@@H+]2CCCC[C@H]2CCCc2ccccc2)no1 ZINC000443647134 1043641216 /nfs/dbraw/zinc/64/12/16/1043641216.db2.gz KYKWVYJMRJVHSS-KRWDZBQOSA-N 1 2 313.445 4.009 20 0 DIADLO CCc1nc(C[N@H+]2CCCC[C@H]2CCCc2ccccc2)no1 ZINC000443647134 1043641223 /nfs/dbraw/zinc/64/12/23/1043641223.db2.gz KYKWVYJMRJVHSS-KRWDZBQOSA-N 1 2 313.445 4.009 20 0 DIADLO COc1ccc(C2CC2)cc1C[NH2+][C@H]1CCCc2oc(C)nc21 ZINC000926844973 1043641277 /nfs/dbraw/zinc/64/12/77/1043641277.db2.gz NODNHOVCPUKUQV-INIZCTEOSA-N 1 2 312.413 4.036 20 0 DIADLO COc1ccc(C2CC2)cc1C[NH2+][C@@H]1CCCc2oc(C)nc21 ZINC000926844974 1043641645 /nfs/dbraw/zinc/64/16/45/1043641645.db2.gz NODNHOVCPUKUQV-MRXNPFEDSA-N 1 2 312.413 4.036 20 0 DIADLO Fc1ccc(Br)c(F)c1C[N@H+]1CCC[C@H](F)CC1 ZINC001141769600 1043641615 /nfs/dbraw/zinc/64/16/15/1043641615.db2.gz RIPOGIYHYQOOFR-VIFPVBQESA-N 1 2 322.168 4.051 20 0 DIADLO Fc1ccc(Br)c(F)c1C[N@@H+]1CCC[C@H](F)CC1 ZINC001141769600 1043641621 /nfs/dbraw/zinc/64/16/21/1043641621.db2.gz RIPOGIYHYQOOFR-VIFPVBQESA-N 1 2 322.168 4.051 20 0 DIADLO Cc1oc2ccccc2c1[C@H](C)[NH2+]C1(c2ncccn2)CCC1 ZINC000926851878 1043642304 /nfs/dbraw/zinc/64/23/04/1043642304.db2.gz MNTAJSMITGVRIC-ZDUSSCGKSA-N 1 2 307.397 4.261 20 0 DIADLO C[C@H]([NH2+][C@@H]1c2ccccc2CC[C@@H]1F)c1ccnn1C1CCC1 ZINC000926861000 1043644426 /nfs/dbraw/zinc/64/44/26/1043644426.db2.gz LQTKYMIIVXMEOF-SOVGHPHASA-N 1 2 313.420 4.284 20 0 DIADLO COCc1nc(C[N@@H+]2CC[C@H](C)[C@@H]2c2cccc(F)c2)cs1 ZINC000353969923 1043666189 /nfs/dbraw/zinc/66/61/89/1043666189.db2.gz AFRGSGBBPUAHRN-YVEFUNNKSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@H+]2CC[C@H](C)[C@@H]2c2cccc(F)c2)cs1 ZINC000353969923 1043666195 /nfs/dbraw/zinc/66/61/95/1043666195.db2.gz AFRGSGBBPUAHRN-YVEFUNNKSA-N 1 2 320.433 4.012 20 0 DIADLO Fc1cc(Br)cc(C[N@@H+]2CCC23CCCC3)c1F ZINC001141797053 1043672887 /nfs/dbraw/zinc/67/28/87/1043672887.db2.gz JVOWTMBQWULOMS-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1cc(Br)cc(C[N@H+]2CCC23CCCC3)c1F ZINC001141797053 1043672891 /nfs/dbraw/zinc/67/28/91/1043672891.db2.gz JVOWTMBQWULOMS-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@H]2CCCc3cccnc32)cs1 ZINC000927063604 1043677692 /nfs/dbraw/zinc/67/76/92/1043677692.db2.gz HTBQKMRDXLBFPY-OCCSQVGLSA-N 1 2 301.459 4.390 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Br)cc(F)c2F)C2(CC2)C1 ZINC001141805707 1043682182 /nfs/dbraw/zinc/68/21/82/1043682182.db2.gz YRIQFYJNBKIRNS-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Br)cc(F)c2F)C2(CC2)C1 ZINC001141805707 1043682186 /nfs/dbraw/zinc/68/21/86/1043682186.db2.gz YRIQFYJNBKIRNS-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO Cc1ccc(C)c(NC(=O)c2cc(C)ccc2-n2cc[nH+]c2)c1 ZINC000114110906 1043685447 /nfs/dbraw/zinc/68/54/47/1043685447.db2.gz IIXMTAJRSPRRAV-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO CCc1onc(C)c1C[NH2+][C@@H](c1ccc(C)cc1)c1cccnc1 ZINC000927132277 1043695283 /nfs/dbraw/zinc/69/52/83/1043695283.db2.gz NZKWIJLEFZNTPM-FQEVSTJZSA-N 1 2 321.424 4.128 20 0 DIADLO Fc1ccccc1-c1noc([C@@H]2CCC[C@@H](c3ccccc3)[NH2+]2)n1 ZINC001211883781 1043695484 /nfs/dbraw/zinc/69/54/84/1043695484.db2.gz BXDKFIVKIWZDOA-IRXDYDNUSA-N 1 2 323.371 4.432 20 0 DIADLO Cc1nc(N2CCC(c3ccccc3C(F)(F)F)CC2)cc[nH+]1 ZINC000354397340 1043698626 /nfs/dbraw/zinc/69/86/26/1043698626.db2.gz UTOAUDPHFPEFFN-UHFFFAOYSA-N 1 2 321.346 4.188 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1cccc(C(F)F)c1 ZINC000354435103 1043700617 /nfs/dbraw/zinc/70/06/17/1043700617.db2.gz BUIXNKGPAYSHER-UHFFFAOYSA-N 1 2 313.307 4.062 20 0 DIADLO Fc1ccc(-c2noc([C@H]3CCC[C@H](c4ccccc4)[NH2+]3)n2)cc1 ZINC001211884382 1043703118 /nfs/dbraw/zinc/70/31/18/1043703118.db2.gz FWJOTUKPIAFSCP-IAGOWNOFSA-N 1 2 323.371 4.432 20 0 DIADLO CC(C)COC1CC[NH+](Cc2c(Cl)cncc2Cl)CC1 ZINC000876628034 1043703574 /nfs/dbraw/zinc/70/35/74/1043703574.db2.gz WQOZWMPEYJJVFG-UHFFFAOYSA-N 1 2 317.260 4.025 20 0 DIADLO CC(C)Cc1ccccc1C[NH2+]Cc1nnc(C(C)C)s1 ZINC000895546413 1043704360 /nfs/dbraw/zinc/70/43/60/1043704360.db2.gz XPKKFWQAWCKWHZ-UHFFFAOYSA-N 1 2 303.475 4.150 20 0 DIADLO Clc1cnc(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)s1 ZINC001137110008 1043706395 /nfs/dbraw/zinc/70/63/95/1043706395.db2.gz FTFLPSLUTOVNMI-JTQLQIEISA-N 1 2 313.253 4.439 20 0 DIADLO Clc1cnc(C[N@H+]2CC[C@H](c3ccccc3Cl)C2)s1 ZINC001137110008 1043706414 /nfs/dbraw/zinc/70/64/14/1043706414.db2.gz FTFLPSLUTOVNMI-JTQLQIEISA-N 1 2 313.253 4.439 20 0 DIADLO CCO[P@@](C)(=O)CC[C@@H](C)Nc1ccc([NH+]2CCCC2)cc1 ZINC000876820691 1043713908 /nfs/dbraw/zinc/71/39/08/1043713908.db2.gz QSTYNJXSDSHVJO-IVZQSRNASA-N 1 2 324.405 4.422 20 0 DIADLO CCO[P@@](C)(=O)CC[C@@H](C)[NH2+]c1ccc(N2CCCC2)cc1 ZINC000876820691 1043713921 /nfs/dbraw/zinc/71/39/21/1043713921.db2.gz QSTYNJXSDSHVJO-IVZQSRNASA-N 1 2 324.405 4.422 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)[NH2+]c1ccc(N(C)C)c(C)c1 ZINC000876845309 1043717599 /nfs/dbraw/zinc/71/75/99/1043717599.db2.gz QONSVOJSEMATBO-SZNDQCEHSA-N 1 2 312.394 4.196 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)Nc1ccc([NH+](C)C)c(C)c1 ZINC000876845309 1043717606 /nfs/dbraw/zinc/71/76/06/1043717606.db2.gz QONSVOJSEMATBO-SZNDQCEHSA-N 1 2 312.394 4.196 20 0 DIADLO Cc1cc([NH2+][C@@H](C)[C@@H]2CC2(F)F)ccc1N1CCSCC1 ZINC000876854446 1043719003 /nfs/dbraw/zinc/71/90/03/1043719003.db2.gz GWZBNOAKCLEUPV-JSGCOSHPSA-N 1 2 312.429 4.004 20 0 DIADLO Fc1ccc2c(c1)CC[N@@H+](Cc1cnc(C3CCC3)s1)C2 ZINC000354780953 1043719407 /nfs/dbraw/zinc/71/94/07/1043719407.db2.gz FGURMNGHAOODDY-UHFFFAOYSA-N 1 2 302.418 4.108 20 0 DIADLO Fc1ccc2c(c1)CC[N@H+](Cc1cnc(C3CCC3)s1)C2 ZINC000354780953 1043719421 /nfs/dbraw/zinc/71/94/21/1043719421.db2.gz FGURMNGHAOODDY-UHFFFAOYSA-N 1 2 302.418 4.108 20 0 DIADLO Cc1cc(N[C@H](C)c2cnn(-c3ccccc3)c2)ccc1[NH+](C)C ZINC000777641810 1043723402 /nfs/dbraw/zinc/72/34/02/1043723402.db2.gz VSNVCJLTUOPEQM-MRXNPFEDSA-N 1 2 320.440 4.420 20 0 DIADLO CCc1nnc(C[N@H+]([C@H](C)c2ccc3ccccc3c2)C2CC2)[nH]1 ZINC000354836788 1043724946 /nfs/dbraw/zinc/72/49/46/1043724946.db2.gz BAISOSMORMTELT-CQSZACIVSA-N 1 2 320.440 4.246 20 0 DIADLO CCc1nnc(C[N@@H+]([C@H](C)c2ccc3ccccc3c2)C2CC2)[nH]1 ZINC000354836788 1043724957 /nfs/dbraw/zinc/72/49/57/1043724957.db2.gz BAISOSMORMTELT-CQSZACIVSA-N 1 2 320.440 4.246 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc([NH+](C)C)c(C)c2)cc1F ZINC000777643220 1043724820 /nfs/dbraw/zinc/72/48/20/1043724820.db2.gz KUTUCUBDQJQGJN-ZDUSSCGKSA-N 1 2 302.393 4.382 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc(-n3cccn3)cc2)ccc1[NH+](C)C ZINC000777644053 1043726010 /nfs/dbraw/zinc/72/60/10/1043726010.db2.gz YJKXTGRWXDQFQL-MRXNPFEDSA-N 1 2 320.440 4.420 20 0 DIADLO Cc1cc(N[C@H]2CCc3c2c(F)ccc3F)ccc1[NH+](C)C ZINC000777643145 1043726138 /nfs/dbraw/zinc/72/61/38/1043726138.db2.gz JHTAGSPVYXKQJX-INIZCTEOSA-N 1 2 302.368 4.439 20 0 DIADLO COc1cc([C@@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)ccc1F ZINC000777652689 1043728038 /nfs/dbraw/zinc/72/80/38/1043728038.db2.gz BOFDPKLTXCNKLF-CYBMUJFWSA-N 1 2 314.404 4.390 20 0 DIADLO COc1cc([C@@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)ccc1F ZINC000777652689 1043728049 /nfs/dbraw/zinc/72/80/49/1043728049.db2.gz BOFDPKLTXCNKLF-CYBMUJFWSA-N 1 2 314.404 4.390 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccccc1N(C)C ZINC000777652653 1043728124 /nfs/dbraw/zinc/72/81/24/1043728124.db2.gz AAULZOVGGNYURU-HNNXBMFYSA-N 1 2 309.457 4.308 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccccc1N(C)C ZINC000777652653 1043728136 /nfs/dbraw/zinc/72/81/36/1043728136.db2.gz AAULZOVGGNYURU-HNNXBMFYSA-N 1 2 309.457 4.308 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccnc(Cl)c1 ZINC000777658483 1043729546 /nfs/dbraw/zinc/72/95/46/1043729546.db2.gz ZCBDXGBOAMHENX-LBPRGKRZSA-N 1 2 301.821 4.291 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccnc(Cl)c1 ZINC000777658483 1043729555 /nfs/dbraw/zinc/72/95/55/1043729555.db2.gz ZCBDXGBOAMHENX-LBPRGKRZSA-N 1 2 301.821 4.291 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(Cl)cs1)c1cc(F)ccc1F ZINC000877054825 1043739108 /nfs/dbraw/zinc/73/91/08/1043739108.db2.gz LJDKCKZNQMLIHA-LLVKDONJSA-N 1 2 302.777 4.316 20 0 DIADLO Clc1csc(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)n1 ZINC000877094944 1043743129 /nfs/dbraw/zinc/74/31/29/1043743129.db2.gz OFMQZDHPUHWOPF-LBPRGKRZSA-N 1 2 320.845 4.333 20 0 DIADLO COc1c(C)c[nH+]c(CN[C@H](c2ccco2)c2ccccc2)c1C ZINC000877143889 1043748525 /nfs/dbraw/zinc/74/85/25/1043748525.db2.gz XPXPNTIPXYELST-IBGZPJMESA-N 1 2 322.408 4.179 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1ccc(OC(F)F)cc1F ZINC000877170373 1043750417 /nfs/dbraw/zinc/75/04/17/1043750417.db2.gz MQYMSGGPPUETMG-NSHDSACASA-N 1 2 310.319 4.015 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccc(OC(F)F)cc1F ZINC000877170373 1043750431 /nfs/dbraw/zinc/75/04/31/1043750431.db2.gz MQYMSGGPPUETMG-NSHDSACASA-N 1 2 310.319 4.015 20 0 DIADLO Fc1cc(CNc2ccc(-n3cc[nH+]c3)cc2)ccc1Cl ZINC000355326601 1043761795 /nfs/dbraw/zinc/76/17/95/1043761795.db2.gz WMZUCIFQVSJYCG-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO CCC[N@H+](Cc1nc(Cl)cs1)[C@@H]1CCCc2cccnc21 ZINC000877412274 1043761909 /nfs/dbraw/zinc/76/19/09/1043761909.db2.gz UGEKEIRULYPUFP-CYBMUJFWSA-N 1 2 321.877 4.481 20 0 DIADLO CCC[N@@H+](Cc1nc(Cl)cs1)[C@@H]1CCCc2cccnc21 ZINC000877412274 1043761920 /nfs/dbraw/zinc/76/19/20/1043761920.db2.gz UGEKEIRULYPUFP-CYBMUJFWSA-N 1 2 321.877 4.481 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccc(Cl)nc1 ZINC000777702838 1043765808 /nfs/dbraw/zinc/76/58/08/1043765808.db2.gz AXABKKFTSSAWFR-ZDUSSCGKSA-N 1 2 316.836 4.293 20 0 DIADLO C[N@H+](Cc1c(F)c(F)cc(F)c1F)[C@@H]1CCc2ccccc21 ZINC001138238465 1043766632 /nfs/dbraw/zinc/76/66/32/1043766632.db2.gz VLXJIDUJBVWZJR-OAHLLOKOSA-N 1 2 309.306 4.362 20 0 DIADLO C[N@@H+](Cc1c(F)c(F)cc(F)c1F)[C@@H]1CCc2ccccc21 ZINC001138238465 1043766644 /nfs/dbraw/zinc/76/66/44/1043766644.db2.gz VLXJIDUJBVWZJR-OAHLLOKOSA-N 1 2 309.306 4.362 20 0 DIADLO CC(C)([NH2+]Cc1nc(Cl)cs1)c1ccc(F)cc1F ZINC000895855856 1043769136 /nfs/dbraw/zinc/76/91/36/1043769136.db2.gz UNLDOJPGRVJOME-UHFFFAOYSA-N 1 2 302.777 4.100 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(CNc2ccc(-n3cc[nH+]c3)c(F)c2)o1 ZINC000355494348 1043772420 /nfs/dbraw/zinc/77/24/20/1043772420.db2.gz UUYVBBOGBFWCHJ-IUODEOHRSA-N 1 2 311.360 4.340 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(CNc2ccc(-n3cc[nH+]c3)c(F)c2)o1 ZINC000355494317 1043772705 /nfs/dbraw/zinc/77/27/05/1043772705.db2.gz UUYVBBOGBFWCHJ-DOMZBBRYSA-N 1 2 311.360 4.340 20 0 DIADLO C[N@H+](Cc1nc(Cl)cs1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000877544009 1043773471 /nfs/dbraw/zinc/77/34/71/1043773471.db2.gz JYNJFCDDZRYLMS-BDAKNGLRSA-N 1 2 312.788 4.349 20 0 DIADLO C[N@@H+](Cc1nc(Cl)cs1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000877544009 1043773480 /nfs/dbraw/zinc/77/34/80/1043773480.db2.gz JYNJFCDDZRYLMS-BDAKNGLRSA-N 1 2 312.788 4.349 20 0 DIADLO Cc1ccncc1C[N@@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000355595628 1043778196 /nfs/dbraw/zinc/77/81/96/1043778196.db2.gz BZAKEISNAZZTAN-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ccncc1C[N@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000355595628 1043778205 /nfs/dbraw/zinc/77/82/05/1043778205.db2.gz BZAKEISNAZZTAN-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO COc1cnc(F)c(C[NH2+]C2(c3ccccc3Cl)CCC2)c1 ZINC000877610329 1043779264 /nfs/dbraw/zinc/77/92/64/1043779264.db2.gz SNDLHRBUGXEZOV-UHFFFAOYSA-N 1 2 320.795 4.052 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2cc3cccc(F)c3o2)c(C)s1 ZINC000355729832 1043785644 /nfs/dbraw/zinc/78/56/44/1043785644.db2.gz OUKUNDVFNBNOTD-SECBINFHSA-N 1 2 304.390 4.496 20 0 DIADLO CC(C)(O)C1CC[NH+](Cc2csc(Cl)c2Cl)CC1 ZINC000877754084 1043792948 /nfs/dbraw/zinc/79/29/48/1043792948.db2.gz VKGJJHWUYMBCDN-UHFFFAOYSA-N 1 2 308.274 4.038 20 0 DIADLO Cc1nnsc1[C@H](C)[N@H+](C)Cc1ccccc1C(F)(F)F ZINC000929166773 1043796234 /nfs/dbraw/zinc/79/62/34/1043796234.db2.gz VPPPRYWCFJMCJY-JTQLQIEISA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nnsc1[C@H](C)[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC000929166773 1043796242 /nfs/dbraw/zinc/79/62/42/1043796242.db2.gz VPPPRYWCFJMCJY-JTQLQIEISA-N 1 2 315.364 4.058 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2csc(-c3ccco3)n2)C1 ZINC000877812065 1043801414 /nfs/dbraw/zinc/80/14/14/1043801414.db2.gz GOGGLAWKAORQLR-ZDUSSCGKSA-N 1 2 316.348 4.177 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2csc(-c3ccco3)n2)C1 ZINC000877812065 1043801426 /nfs/dbraw/zinc/80/14/26/1043801426.db2.gz GOGGLAWKAORQLR-ZDUSSCGKSA-N 1 2 316.348 4.177 20 0 DIADLO C[C@H]([NH2+]Cc1nc2ccccc2o1)c1ccc(C(F)(F)F)nc1 ZINC000877828916 1043802731 /nfs/dbraw/zinc/80/27/31/1043802731.db2.gz SYJVICFWXHGLFH-JTQLQIEISA-N 1 2 321.302 4.092 20 0 DIADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1cscc1C(F)(F)F ZINC000356107254 1043810389 /nfs/dbraw/zinc/81/03/89/1043810389.db2.gz CCBZCAONVUEHLB-UHFFFAOYSA-N 1 2 322.783 4.391 20 0 DIADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1cscc1C(F)(F)F ZINC000356107254 1043810407 /nfs/dbraw/zinc/81/04/07/1043810407.db2.gz CCBZCAONVUEHLB-UHFFFAOYSA-N 1 2 322.783 4.391 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2c(C)cccc2Cl)o1 ZINC000877933973 1043827610 /nfs/dbraw/zinc/82/76/10/1043827610.db2.gz XRABIKQRSUOXAF-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2c(C)cccc2Cl)o1 ZINC000877933973 1043827631 /nfs/dbraw/zinc/82/76/31/1043827631.db2.gz XRABIKQRSUOXAF-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@H](C)C(=O)Nc1c(C)cccc1Cl ZINC000877991978 1043835810 /nfs/dbraw/zinc/83/58/10/1043835810.db2.gz PZLJUXHMBWVVTA-GFCCVEGCSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1occc1C[N@H+](C)[C@H](C)C(=O)Nc1c(C)cccc1Cl ZINC000877991978 1043835829 /nfs/dbraw/zinc/83/58/29/1043835829.db2.gz PZLJUXHMBWVVTA-GFCCVEGCSA-N 1 2 320.820 4.009 20 0 DIADLO CC(C)(C)SCCC[N@@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000877981259 1043837219 /nfs/dbraw/zinc/83/72/19/1043837219.db2.gz RNRJAHLHYZRDHS-CQSZACIVSA-N 1 2 323.506 4.396 20 0 DIADLO CC(C)(C)SCCC[N@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000877981259 1043837235 /nfs/dbraw/zinc/83/72/35/1043837235.db2.gz RNRJAHLHYZRDHS-CQSZACIVSA-N 1 2 323.506 4.396 20 0 DIADLO Clc1ncsc1C[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000878114319 1043848854 /nfs/dbraw/zinc/84/88/54/1043848854.db2.gz INDKADLCHXKHFJ-GFCCVEGCSA-N 1 2 310.875 4.087 20 0 DIADLO CCc1cc(C[NH2+][C@@H](c2cccnc2)c2cc(C)cc(C)c2)on1 ZINC000925130805 1043848000 /nfs/dbraw/zinc/84/80/00/1043848000.db2.gz XTVVONPANUTOAA-FQEVSTJZSA-N 1 2 321.424 4.128 20 0 DIADLO Clc1ncsc1C[N@@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000878114319 1043848840 /nfs/dbraw/zinc/84/88/40/1043848840.db2.gz INDKADLCHXKHFJ-GFCCVEGCSA-N 1 2 310.875 4.087 20 0 DIADLO CCC(CC)c1noc(/C=C\c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000356539752 1043848977 /nfs/dbraw/zinc/84/89/77/1043848977.db2.gz KHOVPTCKQKOAOH-YFHOEESVSA-N 1 2 308.385 4.329 20 0 DIADLO C[C@H]1CCCC[C@H]1c1noc(-c2cccc(-n3cc[nH+]c3)c2)n1 ZINC000356586491 1043853170 /nfs/dbraw/zinc/85/31/70/1043853170.db2.gz XZNGLRBHHISHBT-XJKSGUPXSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nc3c(o2)CCCC3)[C@H](c2ccco2)C1 ZINC000878152622 1043855669 /nfs/dbraw/zinc/85/56/69/1043855669.db2.gz LXEMENPHHHROSG-HIFRSBDPSA-N 1 2 300.402 4.120 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nc3c(o2)CCCC3)[C@H](c2ccco2)C1 ZINC000878152622 1043855683 /nfs/dbraw/zinc/85/56/83/1043855683.db2.gz LXEMENPHHHROSG-HIFRSBDPSA-N 1 2 300.402 4.120 20 0 DIADLO Cc1ccc([C@@H](C)N(C)C(=O)c2cc3c[nH+]ccc3[nH]2)c(C)c1 ZINC000929951499 1043858297 /nfs/dbraw/zinc/85/82/97/1043858297.db2.gz DCGAJAZJTJSGGX-CQSZACIVSA-N 1 2 307.397 4.013 20 0 DIADLO Cc1cccc(NC2CC[NH+](Cc3scnc3Cl)CC2)c1 ZINC000878256670 1043864368 /nfs/dbraw/zinc/86/43/68/1043864368.db2.gz YZOIYALFHSNIMP-UHFFFAOYSA-N 1 2 321.877 4.181 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2cc(C(F)(F)F)co2)n1 ZINC000878248809 1043865037 /nfs/dbraw/zinc/86/50/37/1043865037.db2.gz FDPROJBEMDPJOO-UHFFFAOYSA-N 1 2 304.337 4.088 20 0 DIADLO CCc1ncc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3o2)o1 ZINC000930037228 1043868245 /nfs/dbraw/zinc/86/82/45/1043868245.db2.gz HSIZWJYCFMBOBV-HNNXBMFYSA-N 1 2 311.385 4.105 20 0 DIADLO CCc1ncc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3o2)o1 ZINC000930037228 1043868260 /nfs/dbraw/zinc/86/82/60/1043868260.db2.gz HSIZWJYCFMBOBV-HNNXBMFYSA-N 1 2 311.385 4.105 20 0 DIADLO C[C@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccc2c(c1)CCCC2 ZINC000878346976 1043873746 /nfs/dbraw/zinc/87/37/46/1043873746.db2.gz WSWACZAOCRPDDM-AWEZNQCLSA-N 1 2 310.441 4.283 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+]Cc1nc2c(o1)CCCC2 ZINC000878353639 1043875375 /nfs/dbraw/zinc/87/53/75/1043875375.db2.gz ORAUGURSOHHWNW-HNNXBMFYSA-N 1 2 314.429 4.193 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1nc2c(o1)CCCC2 ZINC000878353640 1043876603 /nfs/dbraw/zinc/87/66/03/1043876603.db2.gz ORAUGURSOHHWNW-OAHLLOKOSA-N 1 2 314.429 4.193 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@@H]2c2cccnc2)sc1C(C)(C)C ZINC000930114853 1043879310 /nfs/dbraw/zinc/87/93/10/1043879310.db2.gz KLVDDVFJYIGBEL-OAHLLOKOSA-N 1 2 315.486 4.481 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@@H]2c2cccnc2)sc1C(C)(C)C ZINC000930114853 1043879323 /nfs/dbraw/zinc/87/93/23/1043879323.db2.gz KLVDDVFJYIGBEL-OAHLLOKOSA-N 1 2 315.486 4.481 20 0 DIADLO CC(C)([NH2+]Cc1ncccc1Br)c1cccc(F)c1 ZINC000878363947 1043880031 /nfs/dbraw/zinc/88/00/31/1043880031.db2.gz BVKQFMXUOGCEQW-UHFFFAOYSA-N 1 2 323.209 4.008 20 0 DIADLO CC[N@H+](Cc1nc(C)c(C(C)(C)C)s1)Cc1ccncc1 ZINC000930152698 1043885540 /nfs/dbraw/zinc/88/55/40/1043885540.db2.gz LNRFBMFIVMZOAU-UHFFFAOYSA-N 1 2 303.475 4.166 20 0 DIADLO CC[N@@H+](Cc1nc(C)c(C(C)(C)C)s1)Cc1ccncc1 ZINC000930152698 1043885553 /nfs/dbraw/zinc/88/55/53/1043885553.db2.gz LNRFBMFIVMZOAU-UHFFFAOYSA-N 1 2 303.475 4.166 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+]Cc2coc(C(C)(C)C)n2)cc1 ZINC000930187762 1043889731 /nfs/dbraw/zinc/88/97/31/1043889731.db2.gz QKUSZAFXVLXWGA-ZDUSSCGKSA-N 1 2 302.418 4.222 20 0 DIADLO CC(C)CC[C@@H]([NH2+]Cc1nncs1)c1ccc(Cl)cc1 ZINC000930204579 1043892350 /nfs/dbraw/zinc/89/23/50/1043892350.db2.gz BJCTUHDIDIAPDH-CQSZACIVSA-N 1 2 309.866 4.459 20 0 DIADLO Cc1nc(-c2ccc([C@@H](C)[NH2+][C@@H](C)c3ncccn3)cc2)cs1 ZINC000930205577 1043894724 /nfs/dbraw/zinc/89/47/24/1043894724.db2.gz TYDXHLCICBDQBB-OLZOCXBDSA-N 1 2 324.453 4.320 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(C(F)(F)F)co1 ZINC000878534220 1043901779 /nfs/dbraw/zinc/90/17/79/1043901779.db2.gz MDYJPQMNXLOODN-XCBNKYQSSA-N 1 2 301.230 4.071 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(C(F)(F)F)co1 ZINC000878534220 1043901789 /nfs/dbraw/zinc/90/17/89/1043901789.db2.gz MDYJPQMNXLOODN-XCBNKYQSSA-N 1 2 301.230 4.071 20 0 DIADLO C[C@H](Nc1cc(N2CCCC2)nc[nH+]1)c1cc2ccccc2s1 ZINC000561208924 1043907415 /nfs/dbraw/zinc/90/74/15/1043907415.db2.gz AKTWOFBJVPVXRR-ZDUSSCGKSA-N 1 2 324.453 4.465 20 0 DIADLO C[C@H](Nc1cc(N2CCCC2)[nH+]cn1)c1cc2ccccc2s1 ZINC000561208924 1043907420 /nfs/dbraw/zinc/90/74/20/1043907420.db2.gz AKTWOFBJVPVXRR-ZDUSSCGKSA-N 1 2 324.453 4.465 20 0 DIADLO C[C@H]1CC[N@H+](Cc2noc(C3CCCCC3)n2)CC12CCC2 ZINC000357023073 1043909008 /nfs/dbraw/zinc/90/90/08/1043909008.db2.gz KOOZTJKFEXLUKG-AWEZNQCLSA-N 1 2 303.450 4.129 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2noc(C3CCCCC3)n2)CC12CCC2 ZINC000357023073 1043909018 /nfs/dbraw/zinc/90/90/18/1043909018.db2.gz KOOZTJKFEXLUKG-AWEZNQCLSA-N 1 2 303.450 4.129 20 0 DIADLO OC[C@@H](CNc1cc[nH+]c2c(Cl)cccc12)c1ccccc1 ZINC000561263015 1043914496 /nfs/dbraw/zinc/91/44/96/1043914496.db2.gz PWEGRMHBVRIPMV-CQSZACIVSA-N 1 2 312.800 4.076 20 0 DIADLO CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000426107487 1043914958 /nfs/dbraw/zinc/91/49/58/1043914958.db2.gz YPMDUANFZIYKKD-CZUORRHYSA-N 1 2 314.433 4.075 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2)s1 ZINC000290103205 1043919084 /nfs/dbraw/zinc/91/90/84/1043919084.db2.gz IDFSFIJJQQJVCM-MRVPVSSYSA-N 1 2 316.257 4.258 20 0 DIADLO Fc1ccc(C[N@H+](Cc2nc(-c3ccccc3)no2)C2CC2)cc1 ZINC000102695158 1043928744 /nfs/dbraw/zinc/92/87/44/1043928744.db2.gz OMNJPMSUFGNJHW-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2nc(-c3ccccc3)no2)C2CC2)cc1 ZINC000102695158 1043928753 /nfs/dbraw/zinc/92/87/53/1043928753.db2.gz OMNJPMSUFGNJHW-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO CC(C)c1cc(N[C@H](C)c2ccc(Cl)cn2)nc(C(C)C)[nH+]1 ZINC000561332964 1043929830 /nfs/dbraw/zinc/92/98/30/1043929830.db2.gz OVUKJOMMPYFYKR-GFCCVEGCSA-N 1 2 318.852 4.945 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1ccccc1OC(C)C)CC2 ZINC001137139510 1043933626 /nfs/dbraw/zinc/93/36/26/1043933626.db2.gz DGENRERBVYATJO-UHFFFAOYSA-N 1 2 323.436 4.235 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccccc1OC(C)C)CC2 ZINC001137139510 1043933633 /nfs/dbraw/zinc/93/36/33/1043933633.db2.gz DGENRERBVYATJO-UHFFFAOYSA-N 1 2 323.436 4.235 20 0 DIADLO CC[N@H+](Cc1ncc(C(C)(C)C)s1)[C@H](C)c1cccnc1 ZINC000290475354 1043953724 /nfs/dbraw/zinc/95/37/24/1043953724.db2.gz NTSJPPOTJMFRPA-CYBMUJFWSA-N 1 2 303.475 4.419 20 0 DIADLO CC[N@@H+](Cc1ncc(C(C)(C)C)s1)[C@H](C)c1cccnc1 ZINC000290475354 1043953728 /nfs/dbraw/zinc/95/37/28/1043953728.db2.gz NTSJPPOTJMFRPA-CYBMUJFWSA-N 1 2 303.475 4.419 20 0 DIADLO COC[C@H]([NH2+]Cc1nc(C(C)C)cs1)c1cccc(Cl)c1 ZINC000290610479 1043968194 /nfs/dbraw/zinc/96/81/94/1043968194.db2.gz HYFQETWNRJQIJN-AWEZNQCLSA-N 1 2 324.877 4.397 20 0 DIADLO Cc1nnsc1[C@@H](C)[N@@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000930966513 1043979518 /nfs/dbraw/zinc/97/95/18/1043979518.db2.gz PWWXTYRMDFQUHZ-DOMZBBRYSA-N 1 2 303.431 4.118 20 0 DIADLO Cc1nnsc1[C@@H](C)[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000930966513 1043979533 /nfs/dbraw/zinc/97/95/33/1043979533.db2.gz PWWXTYRMDFQUHZ-DOMZBBRYSA-N 1 2 303.431 4.118 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](C)c2cc3cnccc3o2)cs1 ZINC000879712073 1043983532 /nfs/dbraw/zinc/98/35/32/1043983532.db2.gz GTSVSLYFAINBRJ-LBPRGKRZSA-N 1 2 315.442 4.478 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2nccc3ccccc32)[nH]1 ZINC000290790169 1043985723 /nfs/dbraw/zinc/98/57/23/1043985723.db2.gz UPFBDDQUVFENAM-MELADBBJSA-N 1 2 323.444 4.278 20 0 DIADLO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2ccn(C3CCCC3)n2)c1 ZINC000879750250 1043986770 /nfs/dbraw/zinc/98/67/70/1043986770.db2.gz OSTJRQDLCAEFIL-IBGZPJMESA-N 1 2 310.445 4.039 20 0 DIADLO Cc1cncc([C@@H]2CCC[N@H+]2Cc2ccn(C3CCCC3)n2)c1 ZINC000879750250 1043986776 /nfs/dbraw/zinc/98/67/76/1043986776.db2.gz OSTJRQDLCAEFIL-IBGZPJMESA-N 1 2 310.445 4.039 20 0 DIADLO C[C@H](Cc1ccccc1)[N@H+](Cc1nncs1)Cc1ccccc1 ZINC000931066003 1043988368 /nfs/dbraw/zinc/98/83/68/1043988368.db2.gz GUMSQMRRAXRPIS-MRXNPFEDSA-N 1 2 323.465 4.172 20 0 DIADLO C[C@H](Cc1ccccc1)[N@@H+](Cc1nncs1)Cc1ccccc1 ZINC000931066003 1043988375 /nfs/dbraw/zinc/98/83/75/1043988375.db2.gz GUMSQMRRAXRPIS-MRXNPFEDSA-N 1 2 323.465 4.172 20 0 DIADLO CC(C)c1nsc(C[NH2+][C@]2(c3ccccc3)CC2(C)C)n1 ZINC000931081051 1043989211 /nfs/dbraw/zinc/98/92/11/1043989211.db2.gz IAMUAPKBUPMRIO-KRWDZBQOSA-N 1 2 301.459 4.077 20 0 DIADLO CC[C@@](C)([NH2+]Cc1ccnc(Cl)c1Cl)c1nccs1 ZINC000290809066 1043990543 /nfs/dbraw/zinc/99/05/43/1043990543.db2.gz FZAGQKJCEIKCQK-CYBMUJFWSA-N 1 2 316.257 4.260 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(-c3ccccc3)o2)[C@@H]1c1cccnc1 ZINC000931081731 1043990799 /nfs/dbraw/zinc/99/07/99/1043990799.db2.gz AJRIKOVATADPNE-GOSISDBHSA-N 1 2 319.408 4.320 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(-c3ccccc3)o2)[C@@H]1c1cccnc1 ZINC000931081731 1043990809 /nfs/dbraw/zinc/99/08/09/1043990809.db2.gz AJRIKOVATADPNE-GOSISDBHSA-N 1 2 319.408 4.320 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@@H](c2ccccn2)C1 ZINC001137883062 1043997340 /nfs/dbraw/zinc/99/73/40/1043997340.db2.gz RSTQMCYUFCDRDG-GFCCVEGCSA-N 1 2 322.786 4.393 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC001137883062 1043997345 /nfs/dbraw/zinc/99/73/45/1043997345.db2.gz RSTQMCYUFCDRDG-GFCCVEGCSA-N 1 2 322.786 4.393 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@@H](F)CC2)c(F)cc1Br ZINC001141910860 1044000392 /nfs/dbraw/zinc/00/03/92/1044000392.db2.gz YXJSFWGMWKIFMN-SNVBAGLBSA-N 1 2 322.168 4.051 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@@H](F)CC2)c(F)cc1Br ZINC001141910860 1044000404 /nfs/dbraw/zinc/00/04/04/1044000404.db2.gz YXJSFWGMWKIFMN-SNVBAGLBSA-N 1 2 322.168 4.051 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccnc(Cl)c1Cl)c1nc(C)cs1 ZINC000290937868 1044002632 /nfs/dbraw/zinc/00/26/32/1044002632.db2.gz SVBOVEDIDZWQSE-SNVBAGLBSA-N 1 2 316.257 4.394 20 0 DIADLO Cc1csc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c1Cl ZINC000357964455 1044003006 /nfs/dbraw/zinc/00/30/06/1044003006.db2.gz RLOIIWGNAJLFSD-UHFFFAOYSA-N 1 2 317.801 4.148 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2cc(Cl)nc(Cl)c2)C1 ZINC000880001498 1044004809 /nfs/dbraw/zinc/00/48/09/1044004809.db2.gz PWPLKVVXEZUBTD-NSHDSACASA-N 1 2 313.150 4.163 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2cc(Cl)nc(Cl)c2)C1 ZINC000880001498 1044004825 /nfs/dbraw/zinc/00/48/25/1044004825.db2.gz PWPLKVVXEZUBTD-NSHDSACASA-N 1 2 313.150 4.163 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccccc2OC2CCC2)cs1 ZINC000358054931 1044011856 /nfs/dbraw/zinc/01/18/56/1044011856.db2.gz AROJPGDERHVGQO-GFCCVEGCSA-N 1 2 302.443 4.234 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(Cl)n1)c1ccc(C(F)(F)F)nc1 ZINC000880098911 1044012366 /nfs/dbraw/zinc/01/23/66/1044012366.db2.gz YBYIRJLZBYORIZ-SSDOTTSWSA-N 1 2 321.755 4.061 20 0 DIADLO Fc1ccc(-c2cnc(C[N@@H+]3CCC[C@H]3c3cccnc3)o2)cc1 ZINC000561862115 1044016658 /nfs/dbraw/zinc/01/66/58/1044016658.db2.gz RQUXIWQQZQOZBJ-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(-c2cnc(C[N@H+]3CCC[C@H]3c3cccnc3)o2)cc1 ZINC000561862115 1044016670 /nfs/dbraw/zinc/01/66/70/1044016670.db2.gz RQUXIWQQZQOZBJ-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc(C(C)C)ns1)c1ccc(F)cc1 ZINC000931379996 1044017358 /nfs/dbraw/zinc/01/73/58/1044017358.db2.gz FXDUCMHOKNLHAR-INIZCTEOSA-N 1 2 307.438 4.216 20 0 DIADLO FC(c1nc(Cc2ccc(-n3cc[nH+]c3)cc2)no1)=C1CCCC1 ZINC000896822003 1044025895 /nfs/dbraw/zinc/02/58/95/1044025895.db2.gz YAPHZUYXDJTSSA-UHFFFAOYSA-N 1 2 324.359 4.101 20 0 DIADLO CC(C)CCc1nc(C[NH+]2CCC(c3ncco3)CC2)cs1 ZINC000931449265 1044027658 /nfs/dbraw/zinc/02/76/58/1044027658.db2.gz QKLMLLLBRDOGLV-UHFFFAOYSA-N 1 2 319.474 4.099 20 0 DIADLO Cc1cnn(C)c1C[N@@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000561943092 1044033705 /nfs/dbraw/zinc/03/37/05/1044033705.db2.gz GVKGLTQWXBNAJX-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO Cc1cnn(C)c1C[N@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000561943092 1044033717 /nfs/dbraw/zinc/03/37/17/1044033717.db2.gz GVKGLTQWXBNAJX-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO Cc1cnn(C)c1C[N@@H+](C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000561943093 1044033749 /nfs/dbraw/zinc/03/37/49/1044033749.db2.gz GVKGLTQWXBNAJX-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO Cc1cnn(C)c1C[N@H+](C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000561943093 1044033763 /nfs/dbraw/zinc/03/37/63/1044033763.db2.gz GVKGLTQWXBNAJX-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO CCSc1ccccc1[C@H](C)[NH2+][C@H](C)c1nnc(C(C)C)[nH]1 ZINC000358231689 1044036483 /nfs/dbraw/zinc/03/64/83/1044036483.db2.gz ADSFLPLKLORZSG-QWHCGFSZSA-N 1 2 318.490 4.452 20 0 DIADLO CCOc1cc(Cl)ccc1C[NH2+][C@H](C)c1csc(C)n1 ZINC000358232301 1044038767 /nfs/dbraw/zinc/03/87/67/1044038767.db2.gz UUCFFDSLHYVXCL-SNVBAGLBSA-N 1 2 310.850 4.354 20 0 DIADLO C[C@@H]([NH2+][C@H](c1cccc(F)c1)c1ccccn1)c1cncs1 ZINC000358260948 1044043319 /nfs/dbraw/zinc/04/33/19/1044043319.db2.gz CCSVVGVLJKUZFJ-SJKOYZFVSA-N 1 2 313.401 4.117 20 0 DIADLO CCOC1CC(C[NH2+][C@@H](c2cccc(Cl)c2)C(F)F)C1 ZINC000880533717 1044045667 /nfs/dbraw/zinc/04/56/67/1044045667.db2.gz GHMCVPUQHICABM-DBRPNBKGSA-N 1 2 303.780 4.051 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H]2CC(C)(C)Cc3occc32)s1 ZINC000358264348 1044045803 /nfs/dbraw/zinc/04/58/03/1044045803.db2.gz HSRAJPDLJSHSPX-LBPRGKRZSA-N 1 2 305.447 4.058 20 0 DIADLO C[C@H]([NH2+]Cc1nncs1)c1cccc(SC(F)(F)F)c1 ZINC000931755925 1044069163 /nfs/dbraw/zinc/06/91/63/1044069163.db2.gz NBSSTCMSCJFQLA-QMMMGPOBSA-N 1 2 319.377 4.001 20 0 DIADLO Cc1cc[nH+]c(C)c1O[C@H]1Cc2cccc(Br)c2C1 ZINC001227263057 1044073391 /nfs/dbraw/zinc/07/33/91/1044073391.db2.gz BSPVBXDYVOPMTB-ZDUSSCGKSA-N 1 2 318.214 4.007 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H]2CCc3cccc4cccc2c43)n1 ZINC000931805438 1044073696 /nfs/dbraw/zinc/07/36/96/1044073696.db2.gz DIGWWTDCEDYDDD-INIZCTEOSA-N 1 2 307.397 4.123 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@@H+]1CCC(F)(F)[C@@H](CO)C1 ZINC000291700348 1044098171 /nfs/dbraw/zinc/09/81/71/1044098171.db2.gz IAJZJRLLBAXQQB-VHSXEESVSA-N 1 2 324.198 4.004 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@H+]1CCC(F)(F)[C@@H](CO)C1 ZINC000291700348 1044098180 /nfs/dbraw/zinc/09/81/80/1044098180.db2.gz IAJZJRLLBAXQQB-VHSXEESVSA-N 1 2 324.198 4.004 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)s1 ZINC000562199441 1044082985 /nfs/dbraw/zinc/08/29/85/1044082985.db2.gz HJWIDHFRCXQNTD-HNNXBMFYSA-N 1 2 305.468 4.044 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@H](c3ccccc3)C2)s1 ZINC000562199441 1044082993 /nfs/dbraw/zinc/08/29/93/1044082993.db2.gz HJWIDHFRCXQNTD-HNNXBMFYSA-N 1 2 305.468 4.044 20 0 DIADLO Cc1csc(C(=O)Nc2ccccc2-n2cc[nH+]c2)c1Cl ZINC000358632826 1044089280 /nfs/dbraw/zinc/08/92/80/1044089280.db2.gz LAWFLNOCMJWCTL-UHFFFAOYSA-N 1 2 317.801 4.148 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+]1CCC(F)(F)[C@H](CO)C1 ZINC000291768587 1044101358 /nfs/dbraw/zinc/10/13/58/1044101358.db2.gz LPBUSXRQLMATHJ-UWVGGRQHSA-N 1 2 324.198 4.004 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+]1CCC(F)(F)[C@H](CO)C1 ZINC000291768587 1044101362 /nfs/dbraw/zinc/10/13/62/1044101362.db2.gz LPBUSXRQLMATHJ-UWVGGRQHSA-N 1 2 324.198 4.004 20 0 DIADLO Cc1cccc([C@@H](C)C[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)c1 ZINC000562340578 1044103449 /nfs/dbraw/zinc/10/34/49/1044103449.db2.gz KZFLUDRCUOMVSR-MAUKXSAKSA-N 1 2 312.461 4.128 20 0 DIADLO c1cc2c(s1)CCC[C@@H]2[NH2+][C@@H](c1nnc[nH]1)C1CCCCC1 ZINC000562340374 1044103826 /nfs/dbraw/zinc/10/38/26/1044103826.db2.gz FIUYKRZNCRZMME-GOEBONIOSA-N 1 2 316.474 4.155 20 0 DIADLO Brc1cnc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)s1 ZINC000713672976 1044114818 /nfs/dbraw/zinc/11/48/18/1044114818.db2.gz LYAYASSVSVDIFD-GHMZBOCLSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1cnc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)s1 ZINC000713672976 1044114827 /nfs/dbraw/zinc/11/48/27/1044114827.db2.gz LYAYASSVSVDIFD-GHMZBOCLSA-N 1 2 315.280 4.060 20 0 DIADLO Cc1ccc(-c2cnc(C[NH2+][C@H](c3ccccn3)C3CC3)o2)cc1 ZINC000932376256 1044122185 /nfs/dbraw/zinc/12/21/85/1044122185.db2.gz BPZOXUXISOQAPR-FQEVSTJZSA-N 1 2 319.408 4.286 20 0 DIADLO Clc1cnc(C[NH2+][C@@H](c2ccccn2)C2CC2)c(Cl)c1 ZINC000932382212 1044123558 /nfs/dbraw/zinc/12/35/58/1044123558.db2.gz HIVHSPGZZYYSAA-OAHLLOKOSA-N 1 2 308.212 4.024 20 0 DIADLO O=c1cccc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)[nH]1 ZINC001212787233 1044136356 /nfs/dbraw/zinc/13/63/56/1044136356.db2.gz QQZOIXCPJNOUDP-UHFFFAOYSA-N 1 2 305.259 4.098 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[NH+]1CCC(F)(C2CC2)CC1 ZINC000932626597 1044149760 /nfs/dbraw/zinc/14/97/60/1044149760.db2.gz KJTGQPLHQAJLLH-CYBMUJFWSA-N 1 2 315.392 4.012 20 0 DIADLO Cc1ccc(CCCC(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)s1 ZINC000359298809 1044152802 /nfs/dbraw/zinc/15/28/02/1044152802.db2.gz FLUDQQBTHXGTLE-UHFFFAOYSA-N 1 2 313.426 4.203 20 0 DIADLO Cc1ncccc1CNc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000444017408 1044154751 /nfs/dbraw/zinc/15/47/51/1044154751.db2.gz QQRMNWYBWBXBHV-UHFFFAOYSA-N 1 2 318.424 4.202 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1sc(C)nc1C(F)(F)F ZINC000292441930 1044172547 /nfs/dbraw/zinc/17/25/47/1044172547.db2.gz WZIGNLPXNAHVJG-UHFFFAOYSA-N 1 2 304.337 4.004 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1sc(C)nc1C(F)(F)F ZINC000292441930 1044172550 /nfs/dbraw/zinc/17/25/50/1044172550.db2.gz WZIGNLPXNAHVJG-UHFFFAOYSA-N 1 2 304.337 4.004 20 0 DIADLO CC(C)(C)c1ccc(NC(=O)c2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000522741010 1044157439 /nfs/dbraw/zinc/15/74/39/1044157439.db2.gz ZWPYJGFXGQYHFX-UHFFFAOYSA-N 1 2 319.408 4.422 20 0 DIADLO Cc1ccc(C[S@](=O)Cc2cccc(C(F)F)c2)c(C)[nH+]1 ZINC000359345619 1044158671 /nfs/dbraw/zinc/15/86/71/1044158671.db2.gz YOIZNXXLNYEQFP-OAQYLSRUSA-N 1 2 309.381 4.085 20 0 DIADLO CC(C)c1[nH]c2c([nH+]1)CC[C@@H](C(=O)Nc1ccc3ccoc3c1)C2 ZINC000562823409 1044161624 /nfs/dbraw/zinc/16/16/24/1044161624.db2.gz MKSCRMFHOXQHSA-CYBMUJFWSA-N 1 2 323.396 4.023 20 0 DIADLO CC(C)c1[nH]c2c([nH+]1)C[C@H](C(=O)Nc1ccc3ccoc3c1)CC2 ZINC000562823409 1044161630 /nfs/dbraw/zinc/16/16/30/1044161630.db2.gz MKSCRMFHOXQHSA-CYBMUJFWSA-N 1 2 323.396 4.023 20 0 DIADLO Cc1cnc(C[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)nc1 ZINC000359642892 1044185982 /nfs/dbraw/zinc/18/59/82/1044185982.db2.gz YZRDUSPRPVOQBU-INIZCTEOSA-N 1 2 307.800 4.064 20 0 DIADLO C[C@@]1([NH2+]Cc2ncc(-c3ccccc3)o2)CCOc2ccccc21 ZINC000933365529 1044195705 /nfs/dbraw/zinc/19/57/05/1044195705.db2.gz BVHSZQCVYUSQGG-HXUWFJFHSA-N 1 2 320.392 4.129 20 0 DIADLO CCc1cccc(NC(=O)NCc2c[nH+]c(C)cc2C)c1CC ZINC000455270315 1044197623 /nfs/dbraw/zinc/19/76/23/1044197623.db2.gz TUQQOMQCEAHROC-UHFFFAOYSA-N 1 2 311.429 4.145 20 0 DIADLO Cc1ncc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)s1 ZINC000347223467 1044208956 /nfs/dbraw/zinc/20/89/56/1044208956.db2.gz FFCNCEYONILASU-INIZCTEOSA-N 1 2 308.397 4.457 20 0 DIADLO Cc1ncc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)s1 ZINC000347223467 1044208967 /nfs/dbraw/zinc/20/89/67/1044208967.db2.gz FFCNCEYONILASU-INIZCTEOSA-N 1 2 308.397 4.457 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@H]2C)c(C)n1 ZINC000359878485 1044211552 /nfs/dbraw/zinc/21/15/52/1044211552.db2.gz PIXHFJYXFYZCCI-CYBMUJFWSA-N 1 2 302.368 4.096 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3c(F)cc(F)cc3[C@H]2C)c(C)n1 ZINC000359878485 1044211561 /nfs/dbraw/zinc/21/15/61/1044211561.db2.gz PIXHFJYXFYZCCI-CYBMUJFWSA-N 1 2 302.368 4.096 20 0 DIADLO Clc1ccc(C[NH2+][C@H](c2ccccc2)c2ccccn2)cn1 ZINC000026475300 1044214243 /nfs/dbraw/zinc/21/42/43/1044214243.db2.gz QMPRVKWJSMKTDL-GOSISDBHSA-N 1 2 309.800 4.009 20 0 DIADLO CSc1ccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)nc1 ZINC000347257681 1044218154 /nfs/dbraw/zinc/21/81/54/1044218154.db2.gz MMDXKTXNMVUUCU-ZDUSSCGKSA-N 1 2 310.426 4.162 20 0 DIADLO Cc1ncc(C[N@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)s1 ZINC000347263904 1044220494 /nfs/dbraw/zinc/22/04/94/1044220494.db2.gz HVYNAELKHORJFV-MEDUHNTESA-N 1 2 302.443 4.333 20 0 DIADLO Cc1csc(C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)n1 ZINC000359951378 1044219884 /nfs/dbraw/zinc/21/98/84/1044219884.db2.gz ZSLHCSYLXJRTGB-UHFFFAOYSA-N 1 2 320.364 4.280 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)s1 ZINC000347263904 1044220484 /nfs/dbraw/zinc/22/04/84/1044220484.db2.gz HVYNAELKHORJFV-MEDUHNTESA-N 1 2 302.443 4.333 20 0 DIADLO Fc1cc(-c2ncco2)ccc1C[N@H+](Cc1ccoc1)C1CC1 ZINC000934004269 1044221626 /nfs/dbraw/zinc/22/16/26/1044221626.db2.gz MXMYYRFXEFOCLK-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO Fc1cc(-c2ncco2)ccc1C[N@@H+](Cc1ccoc1)C1CC1 ZINC000934004269 1044221637 /nfs/dbraw/zinc/22/16/37/1044221637.db2.gz MXMYYRFXEFOCLK-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO FC(F)Sc1ccc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)cc1 ZINC000778226873 1044225964 /nfs/dbraw/zinc/22/59/64/1044225964.db2.gz UGONWSIJOXKEDJ-ZDUSSCGKSA-N 1 2 309.385 4.062 20 0 DIADLO FC(F)Sc1ccc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)cc1 ZINC000778226873 1044225977 /nfs/dbraw/zinc/22/59/77/1044225977.db2.gz UGONWSIJOXKEDJ-ZDUSSCGKSA-N 1 2 309.385 4.062 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1noc2c1CCCC2)C(C)(C)C ZINC000934293450 1044234714 /nfs/dbraw/zinc/23/47/14/1044234714.db2.gz WBRABAWLNWEHAI-GOSISDBHSA-N 1 2 313.445 4.134 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+]Cc1nc(C(C)C)c[nH]1 ZINC000883258511 1044247193 /nfs/dbraw/zinc/24/71/93/1044247193.db2.gz FDHUXHUVXRZPEX-UHFFFAOYSA-N 1 2 321.852 4.264 20 0 DIADLO CCc1noc(C)c1C[NH2+]Cc1csc(-c2cccs2)n1 ZINC000293101429 1044248580 /nfs/dbraw/zinc/24/85/80/1044248580.db2.gz XTHXISKVNDYWLP-UHFFFAOYSA-N 1 2 319.455 4.020 20 0 DIADLO Cc1cc(C)c(NC(=O)CCc2ccnc3ccccc23)c(C)[nH+]1 ZINC000522964218 1044252011 /nfs/dbraw/zinc/25/20/11/1044252011.db2.gz DHJCASKSRNCSRD-UHFFFAOYSA-N 1 2 319.408 4.126 20 0 DIADLO COc1ccc(C2CC2)cc1C[NH2+][C@H](C)c1csc(C)n1 ZINC000883265525 1044253601 /nfs/dbraw/zinc/25/36/01/1044253601.db2.gz DTIONZKQXCMVAW-LLVKDONJSA-N 1 2 302.443 4.188 20 0 DIADLO Cc1ccc(F)c(C[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)c1F ZINC000934561962 1044259474 /nfs/dbraw/zinc/25/94/74/1044259474.db2.gz WRVQPPANTMEXEE-ZDUSSCGKSA-N 1 2 319.399 4.121 20 0 DIADLO COc1cc([C@@H](C)[NH2+]Cc2nc(C)c(C)o2)cc2ccccc21 ZINC000934630536 1044263342 /nfs/dbraw/zinc/26/33/42/1044263342.db2.gz BERBRWFGFAVUKK-CYBMUJFWSA-N 1 2 310.397 4.304 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+]C2(c3ncccn3)CCC2)cc1 ZINC000883312582 1044264557 /nfs/dbraw/zinc/26/45/57/1044264557.db2.gz HZQHROVMQBZAGM-AWEZNQCLSA-N 1 2 313.470 4.319 20 0 DIADLO CCSc1ccccc1[C@@H](C)[NH2+]C1(c2ncccn2)CCC1 ZINC000883312631 1044265700 /nfs/dbraw/zinc/26/57/00/1044265700.db2.gz JESVCSRZDAPBFN-CQSZACIVSA-N 1 2 313.470 4.319 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]C2(c3ncccn3)CCC2)c2ccsc2S1 ZINC000883312616 1044266277 /nfs/dbraw/zinc/26/62/77/1044266277.db2.gz IWAFJIKZUDWZLS-WCQYABFASA-N 1 2 317.483 4.133 20 0 DIADLO COc1cc2cc[nH+]c(N3CC[C@@H](c4ccccc4)C3)c2cc1F ZINC000563473811 1044267498 /nfs/dbraw/zinc/26/74/98/1044267498.db2.gz XYVLYGOJJSAVHE-MRXNPFEDSA-N 1 2 322.383 4.376 20 0 DIADLO Cc1nocc1C[NH2+]C1(c2c(Cl)cccc2Cl)CCC1 ZINC000293328925 1044271403 /nfs/dbraw/zinc/27/14/03/1044271403.db2.gz RNWLXDQJMHZUIV-UHFFFAOYSA-N 1 2 311.212 4.459 20 0 DIADLO COc1cccc2c1OCCC[C@H]2[NH2+][C@@H](C)c1csc(C)n1 ZINC000883330275 1044275889 /nfs/dbraw/zinc/27/58/89/1044275889.db2.gz BHAIAECKTVNOAV-SMDDNHRTSA-N 1 2 318.442 4.025 20 0 DIADLO Cc1ccccc1O[C@@H]1CC[N@H+](Cc2cc(F)c(F)cc2F)C1 ZINC001137891209 1044278612 /nfs/dbraw/zinc/27/86/12/1044278612.db2.gz CVRWCQCJFCTIQS-CQSZACIVSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1ccccc1O[C@@H]1CC[N@@H+](Cc2cc(F)c(F)cc2F)C1 ZINC001137891209 1044278625 /nfs/dbraw/zinc/27/86/25/1044278625.db2.gz CVRWCQCJFCTIQS-CQSZACIVSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1cc(N[C@@H](C)c2cc(Br)ncc2F)c[nH+]c1C ZINC000883343057 1044279289 /nfs/dbraw/zinc/27/92/89/1044279289.db2.gz YLNFCTGUBSRXJT-JTQLQIEISA-N 1 2 324.197 4.168 20 0 DIADLO Cc1onc(-c2ccccc2)c1C[N@@H+]1Cc2ccc(F)cc2C1 ZINC001141988249 1044280103 /nfs/dbraw/zinc/28/01/03/1044280103.db2.gz NOASHEFWLOLANQ-UHFFFAOYSA-N 1 2 308.356 4.305 20 0 DIADLO Cc1onc(-c2ccccc2)c1C[N@H+]1Cc2ccc(F)cc2C1 ZINC001141988249 1044280117 /nfs/dbraw/zinc/28/01/17/1044280117.db2.gz NOASHEFWLOLANQ-UHFFFAOYSA-N 1 2 308.356 4.305 20 0 DIADLO C[C@H]([NH2+][C@H]1c2ccccc2CC[C@@H]1F)c1ccc(Cl)cn1 ZINC000883375955 1044287130 /nfs/dbraw/zinc/28/71/30/1044287130.db2.gz CJOQKCZWOSWPOC-KCTSRDHCSA-N 1 2 304.796 4.411 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc(N2CCCCC2)c(F)c1 ZINC000883375183 1044287697 /nfs/dbraw/zinc/28/76/97/1044287697.db2.gz FGDRORRXOBJPPK-UHFFFAOYSA-N 1 2 316.424 4.206 20 0 DIADLO C[C@H]([NH2+][C@@H]1c2ccccc2CC[C@H]1F)c1ccncc1Cl ZINC000883377539 1044289363 /nfs/dbraw/zinc/28/93/63/1044289363.db2.gz KIGVBGNJUCKVKR-YMRXKLBXSA-N 1 2 304.796 4.411 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cnc(C2CC2)s1 ZINC000883377965 1044291618 /nfs/dbraw/zinc/29/16/18/1044291618.db2.gz VICKHSXCRRVZPE-UHFFFAOYSA-N 1 2 305.472 4.281 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000475276784 1044339461 /nfs/dbraw/zinc/33/94/61/1044339461.db2.gz BTDFYKNKLPUNBY-ZJUUUORDSA-N 1 2 306.397 4.213 20 0 DIADLO CC(C)c1ncc(C[NH2+][C@@H]2c3ccccc3CC[C@H]2F)s1 ZINC000883383105 1044296453 /nfs/dbraw/zinc/29/64/53/1044296453.db2.gz TWZJBRSIBUWVDK-HZPDHXFCSA-N 1 2 304.434 4.382 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000475276784 1044339468 /nfs/dbraw/zinc/33/94/68/1044339468.db2.gz BTDFYKNKLPUNBY-ZJUUUORDSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@H]([NH2+]c1ccc(N2CCSCC2)cc1)C1CCSCC1 ZINC000187519197 1044298216 /nfs/dbraw/zinc/29/82/16/1044298216.db2.gz MEKFTEFXUJAGAY-AWEZNQCLSA-N 1 2 322.543 4.183 20 0 DIADLO Cc1nc([C@H]([NH2+][C@H]2CC=C(C)CC2)c2ccc(Cl)cc2)no1 ZINC000293553033 1044298764 /nfs/dbraw/zinc/29/87/64/1044298764.db2.gz HGYZSXXBDUXWOB-JKSUJKDBSA-N 1 2 317.820 4.209 20 0 DIADLO CC(C)c1ccc(-n2ccnc2SCc2c[nH+]cn2C)cc1 ZINC000360734441 1044304779 /nfs/dbraw/zinc/30/47/79/1044304779.db2.gz FFCZLUQOHGMUFL-UHFFFAOYSA-N 1 2 312.442 4.022 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1nsc2ccccc12 ZINC000883401961 1044305440 /nfs/dbraw/zinc/30/54/40/1044305440.db2.gz DMGXMZHIOGDZQD-JTQLQIEISA-N 1 2 301.415 4.006 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000563700656 1044305930 /nfs/dbraw/zinc/30/59/30/1044305930.db2.gz LHSXWSIWLUBWDQ-GFCCVEGCSA-N 1 2 321.424 4.057 20 0 DIADLO Cc1ccc2c(Nc3ccc(Br)cn3)cccc2[nH+]1 ZINC001212794039 1044310495 /nfs/dbraw/zinc/31/04/95/1044310495.db2.gz FOKIAJMYWFHRFO-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1cc(F)cc(C(F)(F)F)c1 ZINC000293698816 1044314044 /nfs/dbraw/zinc/31/40/44/1044314044.db2.gz RJIMHFUGPBXDGN-UHFFFAOYSA-N 1 2 316.298 4.027 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1cc(F)cc(C(F)(F)F)c1 ZINC000293698816 1044314054 /nfs/dbraw/zinc/31/40/54/1044314054.db2.gz RJIMHFUGPBXDGN-UHFFFAOYSA-N 1 2 316.298 4.027 20 0 DIADLO Cc1ccc2c(Nc3nn(C)c4nc(Cl)ccc34)cccc2[nH+]1 ZINC001212794868 1044314544 /nfs/dbraw/zinc/31/45/44/1044314544.db2.gz ALLOPWBOEBFEIU-UHFFFAOYSA-N 1 2 323.787 4.222 20 0 DIADLO Cc1ccc2c(Nc3cn(C)nc3C(F)(F)F)cccc2[nH+]1 ZINC001212795253 1044314629 /nfs/dbraw/zinc/31/46/29/1044314629.db2.gz XICIBABQQOEWIU-UHFFFAOYSA-N 1 2 306.291 4.039 20 0 DIADLO Cc1cc(C)c2c(Nc3cccc4[nH+]c(C)ccc34)nn(C)c2n1 ZINC001212795884 1044324913 /nfs/dbraw/zinc/32/49/13/1044324913.db2.gz HGOISDKIGZVERZ-UHFFFAOYSA-N 1 2 317.396 4.185 20 0 DIADLO Cc1ccc2c(Nc3cc(N4CCCCC4)ncn3)cccc2[nH+]1 ZINC001212796371 1044325817 /nfs/dbraw/zinc/32/58/17/1044325817.db2.gz WVTAJGUBYRWUHL-UHFFFAOYSA-N 1 2 319.412 4.067 20 0 DIADLO Cc1ccoc1C[NH2+]Cc1cc(F)c(C(F)(F)F)cc1F ZINC000564122822 1044342010 /nfs/dbraw/zinc/34/20/10/1044342010.db2.gz JZSGGENWFYXCPK-UHFFFAOYSA-N 1 2 305.246 4.175 20 0 DIADLO Cc1ccc2c(Nc3cc(C(F)(F)F)cnn3)cccc2[nH+]1 ZINC001212796909 1044348947 /nfs/dbraw/zinc/34/89/47/1044348947.db2.gz MBJIDJFXKXDQSJ-UHFFFAOYSA-N 1 2 304.275 4.096 20 0 DIADLO C[C@H](c1nnc(-c2ccccc2)o1)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000361075513 1044357339 /nfs/dbraw/zinc/35/73/39/1044357339.db2.gz ZHZMXNJKYOAWKF-ZIAGYGMSSA-N 1 2 305.381 4.374 20 0 DIADLO C[C@H](c1nnc(-c2ccccc2)o1)[N@H+]1Cc2ccccc2[C@H]1C ZINC000361075513 1044357350 /nfs/dbraw/zinc/35/73/50/1044357350.db2.gz ZHZMXNJKYOAWKF-ZIAGYGMSSA-N 1 2 305.381 4.374 20 0 DIADLO CC(C)Cn1cc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)cn1 ZINC000564245988 1044362702 /nfs/dbraw/zinc/36/27/02/1044362702.db2.gz ZPXNCUBVXIUIQI-QGZVFWFLSA-N 1 2 303.837 4.140 20 0 DIADLO CC(C)Cn1cc(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)cn1 ZINC000564245988 1044362718 /nfs/dbraw/zinc/36/27/18/1044362718.db2.gz ZPXNCUBVXIUIQI-QGZVFWFLSA-N 1 2 303.837 4.140 20 0 DIADLO Fc1cnc(Cl)c(C[NH2+]Cc2ccc(-c3ccccc3)o2)c1 ZINC001202604197 1044366568 /nfs/dbraw/zinc/36/65/68/1044366568.db2.gz XDTHHJGSTBMYGF-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H]1CC[C@@H]2C[C@@H]2CC1 ZINC000935760168 1044367218 /nfs/dbraw/zinc/36/72/18/1044367218.db2.gz WAACYQPDQGLBMF-QDMKHBRRSA-N 1 2 309.413 4.150 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+][C@@H]1CCOc2c(F)ccc(F)c21 ZINC000361175041 1044370244 /nfs/dbraw/zinc/37/02/44/1044370244.db2.gz CBLKAOUHUAYSJC-XHDPSFHLSA-N 1 2 318.367 4.097 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+][C@@H]1CCOc2c(F)ccc(F)c21 ZINC000361175039 1044371511 /nfs/dbraw/zinc/37/15/11/1044371511.db2.gz CBLKAOUHUAYSJC-IAQYHMDHSA-N 1 2 318.367 4.097 20 0 DIADLO CCC[C@@H]([NH2+][C@@H]1CCOc2c(F)ccc(F)c21)c1ccccn1 ZINC000361185748 1044372840 /nfs/dbraw/zinc/37/28/40/1044372840.db2.gz HUTAEVDCBZYSFV-HZPDHXFCSA-N 1 2 318.367 4.314 20 0 DIADLO Cn1ccnc1C[NH+]1CCC(c2cccc(Cl)c2Cl)CC1 ZINC000361250868 1044379598 /nfs/dbraw/zinc/37/95/98/1044379598.db2.gz LXCZCWDJYOKRIA-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1cncc(C(F)(F)F)c1 ZINC000361310990 1044390426 /nfs/dbraw/zinc/39/04/26/1044390426.db2.gz VNIPWSPIBDWROR-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1cncc(C(F)(F)F)c1 ZINC000361310990 1044390439 /nfs/dbraw/zinc/39/04/39/1044390439.db2.gz VNIPWSPIBDWROR-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@H](CC)c2c(C)noc2C)n1 ZINC000348282313 1044396449 /nfs/dbraw/zinc/39/64/49/1044396449.db2.gz PWQSVRHOEQMEEQ-MRXNPFEDSA-N 1 2 304.438 4.090 20 0 DIADLO C[C@@H]([NH2+]Cc1cncc(C(F)(F)F)c1)c1c(F)cccc1F ZINC000361352211 1044397551 /nfs/dbraw/zinc/39/75/51/1044397551.db2.gz CZUPLHTXSSJXAH-SECBINFHSA-N 1 2 316.273 4.229 20 0 DIADLO O=C(CCCC1CC1)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000643423828 1044407298 /nfs/dbraw/zinc/40/72/98/1044407298.db2.gz KGPLJETUPZVSCQ-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO CCCO[C@@H]1CCCN(c2[nH+]ccc3cc(F)ccc32)CC1 ZINC000564891915 1044407724 /nfs/dbraw/zinc/40/77/24/1044407724.db2.gz BOUNMYANHGJQIN-MRXNPFEDSA-N 1 2 302.393 4.159 20 0 DIADLO C[C@H](CC[NH2+][C@H](c1cccs1)c1nnc[nH]1)CC(C)(C)C ZINC000294374620 1044411846 /nfs/dbraw/zinc/41/18/46/1044411846.db2.gz RCNFOKFSKYVSLP-TZMCWYRMSA-N 1 2 306.479 4.008 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nccn2-c2ccccc2)[C@H]1c1ccccc1 ZINC000361573281 1044419281 /nfs/dbraw/zinc/41/92/81/1044419281.db2.gz YSEPUHBSFFHLLM-OXQOHEQNSA-N 1 2 303.409 4.065 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nccn2-c2ccccc2)[C@H]1c1ccccc1 ZINC000361573281 1044419290 /nfs/dbraw/zinc/41/92/90/1044419290.db2.gz YSEPUHBSFFHLLM-OXQOHEQNSA-N 1 2 303.409 4.065 20 0 DIADLO Cc1ccc2c(c1)C[N@H+]([C@@H](C)C(=O)Nc1c(C)cc(C)cc1C)C2 ZINC000361604821 1044424503 /nfs/dbraw/zinc/42/45/03/1044424503.db2.gz VTVALSCOBNZTGT-KRWDZBQOSA-N 1 2 322.452 4.263 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+]([C@@H](C)C(=O)Nc1c(C)cc(C)cc1C)C2 ZINC000361604821 1044424509 /nfs/dbraw/zinc/42/45/09/1044424509.db2.gz VTVALSCOBNZTGT-KRWDZBQOSA-N 1 2 322.452 4.263 20 0 DIADLO C[C@H](CC(=O)N(c1ccccc1)C1CCCCC1)n1cc[nH+]c1 ZINC000565306606 1044425442 /nfs/dbraw/zinc/42/54/42/1044425442.db2.gz CIXWSNTXQCKTRZ-MRXNPFEDSA-N 1 2 311.429 4.200 20 0 DIADLO COc1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)c(F)c1 ZINC000565485004 1044436149 /nfs/dbraw/zinc/43/61/49/1044436149.db2.gz MGIZDEJPTQOTSD-LLVKDONJSA-N 1 2 322.449 4.439 20 0 DIADLO CSCc1cnc(C[NH+]2CCC(c3ccsc3)CC2)s1 ZINC000294631369 1044440432 /nfs/dbraw/zinc/44/04/32/1044440432.db2.gz JSPYNXKLHIPACS-UHFFFAOYSA-N 1 2 324.540 4.447 20 0 DIADLO Cc1ccc(F)cc1C[N@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000565533546 1044441223 /nfs/dbraw/zinc/44/12/23/1044441223.db2.gz QTDSDCOTSSMRNH-UHFFFAOYSA-N 1 2 309.388 4.156 20 0 DIADLO Cc1ccc(F)cc1C[N@@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000565533546 1044441241 /nfs/dbraw/zinc/44/12/41/1044441241.db2.gz QTDSDCOTSSMRNH-UHFFFAOYSA-N 1 2 309.388 4.156 20 0 DIADLO Cc1ccc2c(Nc3cccc4c3CN(C)C(=O)N4)cccc2[nH+]1 ZINC001212798337 1044443864 /nfs/dbraw/zinc/44/38/64/1044443864.db2.gz FQBBAPHAGDRZRD-UHFFFAOYSA-N 1 2 318.380 4.264 20 0 DIADLO Cc1ccc2c(Nc3ccc(F)c4c3OCCC4=O)cccc2[nH+]1 ZINC001212798298 1044443928 /nfs/dbraw/zinc/44/39/28/1044443928.db2.gz CZXPSIITFDNPEZ-UHFFFAOYSA-N 1 2 322.339 4.391 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cccc(F)c3F)CCCC2)n1 ZINC000112711151 1044447382 /nfs/dbraw/zinc/44/73/82/1044447382.db2.gz XFYXPBFNGRNPCF-UHFFFAOYSA-N 1 2 308.397 4.289 20 0 DIADLO Cc1nc([C@H]2C[N@H+](Cc3ccccc3)CCO2)sc1C(C)C ZINC000565659618 1044448286 /nfs/dbraw/zinc/44/82/86/1044448286.db2.gz VGGOHZLBGIKZRQ-MRXNPFEDSA-N 1 2 316.470 4.148 20 0 DIADLO Cc1nc([C@H]2C[N@@H+](Cc3ccccc3)CCO2)sc1C(C)C ZINC000565659618 1044448292 /nfs/dbraw/zinc/44/82/92/1044448292.db2.gz VGGOHZLBGIKZRQ-MRXNPFEDSA-N 1 2 316.470 4.148 20 0 DIADLO Cc1ccc2c(Nc3cccc(OC(=O)N(C)C)c3)cccc2[nH+]1 ZINC001212798642 1044451874 /nfs/dbraw/zinc/45/18/74/1044451874.db2.gz LMCHTYBYJKFGKF-UHFFFAOYSA-N 1 2 321.380 4.347 20 0 DIADLO CCC[C@H]([NH2+]Cc1ncccn1)c1ccc(Cl)c(Cl)c1 ZINC000361863652 1044452733 /nfs/dbraw/zinc/45/27/33/1044452733.db2.gz XZJHFWYWAKMGOP-AWEZNQCLSA-N 1 2 310.228 4.414 20 0 DIADLO FC(F)(F)c1ccc([C@@H]2CCCC[N@@H+]2Cc2ncccn2)cc1 ZINC000361861577 1044453093 /nfs/dbraw/zinc/45/30/93/1044453093.db2.gz CUCOCYXFZJUFJF-HNNXBMFYSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1ccc([C@@H]2CCCC[N@H+]2Cc2ncccn2)cc1 ZINC000361861577 1044453110 /nfs/dbraw/zinc/45/31/10/1044453110.db2.gz CUCOCYXFZJUFJF-HNNXBMFYSA-N 1 2 321.346 4.223 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)n1 ZINC000114745678 1044459234 /nfs/dbraw/zinc/45/92/34/1044459234.db2.gz AEEIUDSZDGMWTA-UWVGGRQHSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1cn2cc(NC(=O)N(CC(C)C)C3CCCC3)ccc2[nH+]1 ZINC000444386149 1044459569 /nfs/dbraw/zinc/45/95/69/1044459569.db2.gz XWVUVTBQWAHXRO-UHFFFAOYSA-N 1 2 314.433 4.075 20 0 DIADLO Fc1ccc2[nH]c3c(c2c1)C[N@H+](CCCCC(F)(F)F)CC3 ZINC000361923935 1044460054 /nfs/dbraw/zinc/46/00/54/1044460054.db2.gz FEQNAMCASMUXTM-UHFFFAOYSA-N 1 2 314.326 4.398 20 0 DIADLO Fc1ccc2[nH]c3c(c2c1)C[N@@H+](CCCCC(F)(F)F)CC3 ZINC000361923935 1044460056 /nfs/dbraw/zinc/46/00/56/1044460056.db2.gz FEQNAMCASMUXTM-UHFFFAOYSA-N 1 2 314.326 4.398 20 0 DIADLO Cc1cc(N[C@@H](c2nccs2)c2ccccc2)nc(C2CC2)[nH+]1 ZINC000116260931 1044468764 /nfs/dbraw/zinc/46/87/64/1044468764.db2.gz YRYSCKDMTBUCAP-MRXNPFEDSA-N 1 2 322.437 4.320 20 0 DIADLO CSCc1cnc(C[N@H+](C)[C@@H](C)c2ccc(F)cc2)s1 ZINC000294891164 1044469475 /nfs/dbraw/zinc/46/94/75/1044469475.db2.gz LQJNQRRKNHCHDY-NSHDSACASA-N 1 2 310.463 4.338 20 0 DIADLO CSCc1cnc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)s1 ZINC000294891164 1044469490 /nfs/dbraw/zinc/46/94/90/1044469490.db2.gz LQJNQRRKNHCHDY-NSHDSACASA-N 1 2 310.463 4.338 20 0 DIADLO CCc1ccc(C[N@H+]2CC=C(c3c(F)cccc3F)CC2)nc1 ZINC000566022822 1044469773 /nfs/dbraw/zinc/46/97/73/1044469773.db2.gz XHSAHXZFXQJVPE-UHFFFAOYSA-N 1 2 314.379 4.212 20 0 DIADLO CCc1ccc(C[N@@H+]2CC=C(c3c(F)cccc3F)CC2)nc1 ZINC000566022822 1044469791 /nfs/dbraw/zinc/46/97/91/1044469791.db2.gz XHSAHXZFXQJVPE-UHFFFAOYSA-N 1 2 314.379 4.212 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1nc(C2CC2)cs1 ZINC000348306970 1044471997 /nfs/dbraw/zinc/47/19/97/1044471997.db2.gz NLDRMLQWZXFEJW-UHFFFAOYSA-N 1 2 304.484 4.374 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1nc(C2CC2)cs1 ZINC000348306970 1044472001 /nfs/dbraw/zinc/47/20/01/1044472001.db2.gz NLDRMLQWZXFEJW-UHFFFAOYSA-N 1 2 304.484 4.374 20 0 DIADLO CSCc1cnc(C[N@H+](C)[C@@H]2CCc3ccccc32)s1 ZINC000294912051 1044471923 /nfs/dbraw/zinc/47/19/23/1044471923.db2.gz NKKNKMHAGMZIEE-OAHLLOKOSA-N 1 2 304.484 4.125 20 0 DIADLO CSCc1cnc(C[N@@H+](C)[C@@H]2CCc3ccccc32)s1 ZINC000294912051 1044471925 /nfs/dbraw/zinc/47/19/25/1044471925.db2.gz NKKNKMHAGMZIEE-OAHLLOKOSA-N 1 2 304.484 4.125 20 0 DIADLO CSCc1cnc(C[NH2+][C@@H]2C[C@@H](C)Oc3ccccc32)s1 ZINC000295026952 1044482006 /nfs/dbraw/zinc/48/20/06/1044482006.db2.gz LEYGAISMSCCRHC-BXUZGUMPSA-N 1 2 320.483 4.008 20 0 DIADLO CCC[C@H](CC(C)C)C(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC001625946477 1044487746 /nfs/dbraw/zinc/48/77/46/1044487746.db2.gz GRTLFHLSNYRKAT-MRXNPFEDSA-N 1 2 320.477 4.128 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2csc(C(C)(C)C)n2)c2ccccc2O1 ZINC000295090341 1044490123 /nfs/dbraw/zinc/49/01/23/1044490123.db2.gz ROWNKEKHBVSQIH-IUODEOHRSA-N 1 2 316.470 4.443 20 0 DIADLO CCc1ccccc1NC(=O)C[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000119233460 1044491520 /nfs/dbraw/zinc/49/15/20/1044491520.db2.gz ILYIGWWOOHTHSI-CQSZACIVSA-N 1 2 312.413 4.006 20 0 DIADLO CCc1ccccc1NC(=O)C[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000119233460 1044491529 /nfs/dbraw/zinc/49/15/29/1044491529.db2.gz ILYIGWWOOHTHSI-CQSZACIVSA-N 1 2 312.413 4.006 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2ncc(C(F)(F)F)cn2)cc1 ZINC000295109916 1044492049 /nfs/dbraw/zinc/49/20/49/1044492049.db2.gz VZXJCJDMAWLGOQ-UHFFFAOYSA-N 1 2 323.362 4.083 20 0 DIADLO CSCc1cnc(C[N@H+](Cc2cccs2)C(C)C)s1 ZINC000295233493 1044503935 /nfs/dbraw/zinc/50/39/35/1044503935.db2.gz DCKQKVRNVNRWND-UHFFFAOYSA-N 1 2 312.529 4.478 20 0 DIADLO CSCc1cnc(C[N@@H+](Cc2cccs2)C(C)C)s1 ZINC000295233493 1044503954 /nfs/dbraw/zinc/50/39/54/1044503954.db2.gz DCKQKVRNVNRWND-UHFFFAOYSA-N 1 2 312.529 4.478 20 0 DIADLO CSc1ccccc1[C@H](C)[NH2+]Cc1nnc(C(C)C)s1 ZINC000295293600 1044508504 /nfs/dbraw/zinc/50/85/04/1044508504.db2.gz JNTLHISKUJFSCC-NSHDSACASA-N 1 2 307.488 4.234 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2csc(C(F)(F)F)c2)s1 ZINC000925151890 1044510422 /nfs/dbraw/zinc/51/04/22/1044510422.db2.gz MMDQKFBXBDDAAX-MRVPVSSYSA-N 1 2 306.378 4.383 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccco2)no1)c1cccc(C2CC2)c1 ZINC000295352229 1044515000 /nfs/dbraw/zinc/51/50/00/1044515000.db2.gz ISZYPYSWLWBPTM-LBPRGKRZSA-N 1 2 309.369 4.058 20 0 DIADLO Cc1nc(C[NH+]2CCC(c3c(F)cccc3F)CC2)c(C)s1 ZINC000362590979 1044533914 /nfs/dbraw/zinc/53/39/14/1044533914.db2.gz PWYVLFCUXAEQMU-UHFFFAOYSA-N 1 2 322.424 4.418 20 0 DIADLO CC[C@H](Nc1cc[nH+]c(C)n1)c1cc(F)cc(Br)c1 ZINC000362692908 1044544020 /nfs/dbraw/zinc/54/40/20/1044544020.db2.gz LNLPSSLZTYJXHC-ZDUSSCGKSA-N 1 2 324.197 4.250 20 0 DIADLO Clc1cccc2c(N3CCC[C@@H](c4ncccn4)C3)cc[nH+]c12 ZINC000884712660 1044551576 /nfs/dbraw/zinc/55/15/76/1044551576.db2.gz XHYIWNWQXKTQAS-CYBMUJFWSA-N 1 2 324.815 4.062 20 0 DIADLO Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ncc(C(F)(F)F)cn1 ZINC000295833115 1044564066 /nfs/dbraw/zinc/56/40/66/1044564066.db2.gz AABNGUWVLUCANM-FZMZJTMJSA-N 1 2 321.346 4.142 20 0 DIADLO CC[C@@H](C)c1nnc([C@H](C)[NH2+]Cc2cc3cc(F)ccc3o2)[nH]1 ZINC000362932867 1044567472 /nfs/dbraw/zinc/56/74/72/1044567472.db2.gz ZGFDKDJCJWZUBQ-MNOVXSKESA-N 1 2 316.380 4.054 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2nccs2)ccc1SC ZINC000362966958 1044572789 /nfs/dbraw/zinc/57/27/89/1044572789.db2.gz KPZYGSFGHAVDMX-CYBMUJFWSA-N 1 2 320.483 4.211 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2nccs2)ccc1SC ZINC000362966958 1044572801 /nfs/dbraw/zinc/57/28/01/1044572801.db2.gz KPZYGSFGHAVDMX-CYBMUJFWSA-N 1 2 320.483 4.211 20 0 DIADLO CCCCN(C(=O)C[C@H](C)n1cc[nH+]c1)[C@H]1CCC[C@@H](C)C1 ZINC000567593210 1044577264 /nfs/dbraw/zinc/57/72/64/1044577264.db2.gz UKLIUZPGNWHFQM-IKGGRYGDSA-N 1 2 305.466 4.042 20 0 DIADLO Cc1ccc2nc(C[N@@H+](C)Cc3cccc(F)c3F)ccc2c1 ZINC001137219080 1044578625 /nfs/dbraw/zinc/57/86/25/1044578625.db2.gz YLGSNWGUURUJTB-UHFFFAOYSA-N 1 2 312.363 4.453 20 0 DIADLO Cc1ccc2nc(C[N@H+](C)Cc3cccc(F)c3F)ccc2c1 ZINC001137219080 1044578630 /nfs/dbraw/zinc/57/86/30/1044578630.db2.gz YLGSNWGUURUJTB-UHFFFAOYSA-N 1 2 312.363 4.453 20 0 DIADLO Cc1nn(C)c(Cl)c1C[NH2+][C@@H](C)c1ccc(F)cc1Cl ZINC000296023720 1044583601 /nfs/dbraw/zinc/58/36/01/1044583601.db2.gz MPDXAZBQAMFDJR-QMMMGPOBSA-N 1 2 316.207 4.025 20 0 DIADLO c1sc(C[N@H+](Cc2ccncc2)C2CC2)nc1-c1ccccc1 ZINC000444661064 1044588001 /nfs/dbraw/zinc/58/80/01/1044588001.db2.gz KVWDYCIEXZWMPM-UHFFFAOYSA-N 1 2 321.449 4.370 20 0 DIADLO c1sc(C[N@@H+](Cc2ccncc2)C2CC2)nc1-c1ccccc1 ZINC000444661064 1044588016 /nfs/dbraw/zinc/58/80/16/1044588016.db2.gz KVWDYCIEXZWMPM-UHFFFAOYSA-N 1 2 321.449 4.370 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)[nH]1 ZINC000296286408 1044604900 /nfs/dbraw/zinc/60/49/00/1044604900.db2.gz FHCSNVBXNRAQBL-CYBMUJFWSA-N 1 2 310.401 4.039 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)[nH]1 ZINC000296286412 1044605793 /nfs/dbraw/zinc/60/57/93/1044605793.db2.gz FHCSNVBXNRAQBL-ZDUSSCGKSA-N 1 2 310.401 4.039 20 0 DIADLO C[C@H]1CC[C@H]([NH2+]Cc2ncc(C(F)(F)F)cn2)c2ccccc21 ZINC000296283986 1044605965 /nfs/dbraw/zinc/60/59/65/1044605965.db2.gz FDCYQZZEPMWUHA-NHYWBVRUSA-N 1 2 321.346 4.224 20 0 DIADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H](CC1CCCCC1)C(C)(C)C ZINC000568199254 1044609466 /nfs/dbraw/zinc/60/94/66/1044609466.db2.gz RJLRLVIGZRNDNL-PBHICJAKSA-N 1 2 319.493 4.090 20 0 DIADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H](CC1CCCCC1)C(C)(C)C ZINC000568199254 1044609470 /nfs/dbraw/zinc/60/94/70/1044609470.db2.gz RJLRLVIGZRNDNL-PBHICJAKSA-N 1 2 319.493 4.090 20 0 DIADLO CCCCc1noc(C[N@H+]2CC=C(c3ccc(C)cc3)CC2)n1 ZINC000042632495 1044610353 /nfs/dbraw/zinc/61/03/53/1044610353.db2.gz GGSCXYOUZDUCQW-UHFFFAOYSA-N 1 2 311.429 4.010 20 0 DIADLO CCCCc1noc(C[N@@H+]2CC=C(c3ccc(C)cc3)CC2)n1 ZINC000042632495 1044610363 /nfs/dbraw/zinc/61/03/63/1044610363.db2.gz GGSCXYOUZDUCQW-UHFFFAOYSA-N 1 2 311.429 4.010 20 0 DIADLO CC(C)[C@@H]1CCC[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000049077729 1044611372 /nfs/dbraw/zinc/61/13/72/1044611372.db2.gz JUPDUYRYUXLDHC-ZDUSSCGKSA-N 1 2 315.244 4.052 20 0 DIADLO CC(C)[C@@H]1CCC[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000049077729 1044611378 /nfs/dbraw/zinc/61/13/78/1044611378.db2.gz JUPDUYRYUXLDHC-ZDUSSCGKSA-N 1 2 315.244 4.052 20 0 DIADLO CCC[C@@H](CC1CCCC1)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000363410884 1044614094 /nfs/dbraw/zinc/61/40/94/1044614094.db2.gz HVJZWKDBJLAPPK-DLBZAZTESA-N 1 2 317.477 4.112 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2nnc(C(C)C)s2)c1 ZINC000296402223 1044614382 /nfs/dbraw/zinc/61/43/82/1044614382.db2.gz VWRKERHVJHPVKV-CYBMUJFWSA-N 1 2 319.474 4.300 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2cccc(OCc3ccccc3)c2)o1 ZINC000444720020 1044615040 /nfs/dbraw/zinc/61/50/40/1044615040.db2.gz BMLCJTDYZWZUTB-MRXNPFEDSA-N 1 2 322.408 4.413 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccn(C3CCCC3)n2)ccc1F ZINC000444744079 1044618453 /nfs/dbraw/zinc/61/84/53/1044618453.db2.gz NUJRRZNRAOUISX-UHFFFAOYSA-N 1 2 301.409 4.078 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccn(C3CCCC3)n2)ccc1F ZINC000444744079 1044618464 /nfs/dbraw/zinc/61/84/64/1044618464.db2.gz NUJRRZNRAOUISX-UHFFFAOYSA-N 1 2 301.409 4.078 20 0 DIADLO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccco3)cc2F)c2nccn21 ZINC000296500809 1044622547 /nfs/dbraw/zinc/62/25/47/1044622547.db2.gz QAUWNMMNTKWIOS-LRDDRELGSA-N 1 2 311.360 4.078 20 0 DIADLO c1cc(Oc2ccccc2)oc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000886270490 1044629152 /nfs/dbraw/zinc/62/91/52/1044629152.db2.gz FFOXNDWCFVXZBT-UHFFFAOYSA-N 1 2 310.353 4.227 20 0 DIADLO Fc1ccc(C[NH2+]Cc2cc(C3CC3)no2)c(Cl)c1Cl ZINC000886270987 1044630130 /nfs/dbraw/zinc/63/01/30/1044630130.db2.gz ULFFJLSIAHXPDC-UHFFFAOYSA-N 1 2 315.175 4.288 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)nn1C ZINC000444788817 1044630203 /nfs/dbraw/zinc/63/02/03/1044630203.db2.gz AYRCUOAMDYAUNZ-QGZVFWFLSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)nn1C ZINC000444788817 1044630212 /nfs/dbraw/zinc/63/02/12/1044630212.db2.gz AYRCUOAMDYAUNZ-QGZVFWFLSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1cc(Cl)cc(C[NH2+]Cc2ncc(-c3ccccc3)cn2)c1 ZINC000568538787 1044631658 /nfs/dbraw/zinc/63/16/58/1044631658.db2.gz JSNODWNNEBVNGF-UHFFFAOYSA-N 1 2 323.827 4.395 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2nc(C(C)(C)C)no2)c1 ZINC000523440348 1044638566 /nfs/dbraw/zinc/63/85/66/1044638566.db2.gz GQROOKSOGIHJMF-CQSZACIVSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@@H+](C)Cc2nc(C(C)(C)C)no2)c1 ZINC000523440348 1044638573 /nfs/dbraw/zinc/63/85/73/1044638573.db2.gz GQROOKSOGIHJMF-CQSZACIVSA-N 1 2 301.434 4.177 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2nnc(C(C)C)s2)cc1 ZINC000296664000 1044640171 /nfs/dbraw/zinc/64/01/71/1044640171.db2.gz YQTOZERLBITXCN-OAHLLOKOSA-N 1 2 317.458 4.007 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2nnc(C(C)C)s2)cc1 ZINC000296664000 1044640183 /nfs/dbraw/zinc/64/01/83/1044640183.db2.gz YQTOZERLBITXCN-OAHLLOKOSA-N 1 2 317.458 4.007 20 0 DIADLO COc1cccc2c(NCc3noc4ccccc34)c(C)c[nH+]c12 ZINC000568927861 1044661203 /nfs/dbraw/zinc/66/12/03/1044661203.db2.gz XYFACORKGUWURF-UHFFFAOYSA-N 1 2 319.364 4.305 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2csc(-c3ccccn3)n2)c1 ZINC000523610999 1044665882 /nfs/dbraw/zinc/66/58/82/1044665882.db2.gz HSKLCWHUVVTSMI-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2csc(-c3ccccn3)n2)c1 ZINC000523610999 1044665894 /nfs/dbraw/zinc/66/58/94/1044665894.db2.gz HSKLCWHUVVTSMI-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1ccc(C[NH2+][C@H](CO)c2c(Cl)cccc2Cl)cc1C ZINC000475620728 1044671843 /nfs/dbraw/zinc/67/18/43/1044671843.db2.gz DGOYRQDSANGPPM-MRXNPFEDSA-N 1 2 324.251 4.433 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(F)c(C(F)(F)F)c2)CCC1(F)F ZINC000569057885 1044672773 /nfs/dbraw/zinc/67/27/73/1044672773.db2.gz IQCCKWDXRFORAT-VIFPVBQESA-N 1 2 311.269 4.322 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(F)c(C(F)(F)F)c2)CCC1(F)F ZINC000569057885 1044672779 /nfs/dbraw/zinc/67/27/79/1044672779.db2.gz IQCCKWDXRFORAT-VIFPVBQESA-N 1 2 311.269 4.322 20 0 DIADLO FC(F)Oc1cccc(Cl)c1C[NH2+][C@@H]1CCc2cccnc21 ZINC000886648617 1044674964 /nfs/dbraw/zinc/67/49/64/1044674964.db2.gz ZERSYROTJSDTEO-CYBMUJFWSA-N 1 2 324.758 4.114 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1cncc(F)c1 ZINC000366263613 1044715197 /nfs/dbraw/zinc/71/51/97/1044715197.db2.gz ASLWYZNARJJXLK-KUHUBIRLSA-N 1 2 307.372 4.056 20 0 DIADLO CC[C@H]([NH2+]Cc1noc(C2CC2)n1)c1cccc2ccccc21 ZINC000886917656 1044716698 /nfs/dbraw/zinc/71/66/98/1044716698.db2.gz HKNBRKDXZMEIRC-KRWDZBQOSA-N 1 2 307.397 4.341 20 0 DIADLO CC(C)c1ccc(N(C)C(=O)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000155735708 1044722486 /nfs/dbraw/zinc/72/24/86/1044722486.db2.gz QRQDWDMARYBOIR-UHFFFAOYSA-N 1 2 319.408 4.272 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@H+]2Cc2ccccn2)s1 ZINC000368200419 1044770847 /nfs/dbraw/zinc/77/08/47/1044770847.db2.gz PBCLVXGJPYYONQ-LBPRGKRZSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ccoc3C3CC3)c2)[nH+]c1C ZINC000366967258 1044727795 /nfs/dbraw/zinc/72/77/95/1044727795.db2.gz VWDCZVWEROBJFO-UHFFFAOYSA-N 1 2 321.380 4.416 20 0 DIADLO Oc1cccc2ccc(/C=C\c3c[nH+]c4ccc(Cl)cn34)nc12 ZINC000524104058 1044737382 /nfs/dbraw/zinc/73/73/82/1044737382.db2.gz VIHAOWPAIVCZRA-FPLPWBNLSA-N 1 2 321.767 4.412 20 0 DIADLO c1cc2c(cccc2C[N@@H+]2CCCC[C@@H]2c2noc(C3CC3)n2)[nH]1 ZINC000367472296 1044741306 /nfs/dbraw/zinc/74/13/06/1044741306.db2.gz HXQKQSQVBLEYOH-QGZVFWFLSA-N 1 2 322.412 4.156 20 0 DIADLO c1cc2c(cccc2C[N@H+]2CCCC[C@@H]2c2noc(C3CC3)n2)[nH]1 ZINC000367472296 1044741321 /nfs/dbraw/zinc/74/13/21/1044741321.db2.gz HXQKQSQVBLEYOH-QGZVFWFLSA-N 1 2 322.412 4.156 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)Cc1cc[nH]n1 ZINC000093612759 1044757832 /nfs/dbraw/zinc/75/78/32/1044757832.db2.gz QSOYKYAMCHNBHX-ZDUSSCGKSA-N 1 2 312.442 4.035 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)Cc1cc[nH]n1 ZINC000093612759 1044757848 /nfs/dbraw/zinc/75/78/48/1044757848.db2.gz QSOYKYAMCHNBHX-ZDUSSCGKSA-N 1 2 312.442 4.035 20 0 DIADLO Cc1nnc(C[N@@H+]([C@@H](C)c2ccc3ccccc3c2)C2CC2)n1C ZINC000122006892 1044769045 /nfs/dbraw/zinc/76/90/45/1044769045.db2.gz URHPGHDAYXJVSS-AWEZNQCLSA-N 1 2 320.440 4.002 20 0 DIADLO Cc1nnc(C[N@H+]([C@@H](C)c2ccc3ccccc3c2)C2CC2)n1C ZINC000122006892 1044769063 /nfs/dbraw/zinc/76/90/63/1044769063.db2.gz URHPGHDAYXJVSS-AWEZNQCLSA-N 1 2 320.440 4.002 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@@H+]2Cc2ccccn2)s1 ZINC000368200419 1044770831 /nfs/dbraw/zinc/77/08/31/1044770831.db2.gz PBCLVXGJPYYONQ-LBPRGKRZSA-N 1 2 323.259 4.243 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@H](c2cnn(C)c2)c2ccccc2)o1 ZINC000368240704 1044770381 /nfs/dbraw/zinc/77/03/81/1044770381.db2.gz DRXBLQBHJPAUOD-WNYOCNMUSA-N 1 2 321.424 4.016 20 0 DIADLO c1[nH+]c(-c2cccc(N[C@H]3CC[C@H]3C3CC3)c2)n2c1CCCC2 ZINC000570748361 1044778677 /nfs/dbraw/zinc/77/86/77/1044778677.db2.gz FETCVPPKUACAOU-OALUTQOASA-N 1 2 307.441 4.487 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000570838904 1044785982 /nfs/dbraw/zinc/78/59/82/1044785982.db2.gz FYWWUSNVSXZFOU-CABCVRRESA-N 1 2 312.413 4.046 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000570838904 1044785992 /nfs/dbraw/zinc/78/59/92/1044785992.db2.gz FYWWUSNVSXZFOU-CABCVRRESA-N 1 2 312.413 4.046 20 0 DIADLO CCc1nc(C[N@H+](C)C[C@H](OC(C)C)c2ccccc2)cs1 ZINC000570998796 1044792499 /nfs/dbraw/zinc/79/24/99/1044792499.db2.gz KNTPXNBGHXEMDO-KRWDZBQOSA-N 1 2 318.486 4.304 20 0 DIADLO CCc1nc(C[N@@H+](C)C[C@H](OC(C)C)c2ccccc2)cs1 ZINC000570998796 1044792512 /nfs/dbraw/zinc/79/25/12/1044792512.db2.gz KNTPXNBGHXEMDO-KRWDZBQOSA-N 1 2 318.486 4.304 20 0 DIADLO Cc1ccc(C)c(NC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001202755829 1044797658 /nfs/dbraw/zinc/79/76/58/1044797658.db2.gz MXMDHZFPRLNJEG-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO c1coc(-c2nc(C[N@@H+]3CCC[C@H]3c3ccncc3)cs2)c1 ZINC000125432418 1044802567 /nfs/dbraw/zinc/80/25/67/1044802567.db2.gz UZARIPCROFYHJS-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO c1coc(-c2nc(C[N@H+]3CCC[C@H]3c3ccncc3)cs2)c1 ZINC000125432418 1044802585 /nfs/dbraw/zinc/80/25/85/1044802585.db2.gz UZARIPCROFYHJS-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO CCC1(c2noc(-c3ccc(Cn4cc[nH+]c4)cc3)n2)CCCC1 ZINC000445794377 1044817517 /nfs/dbraw/zinc/81/75/17/1044817517.db2.gz IYJFUFGHJJGCJS-UHFFFAOYSA-N 1 2 322.412 4.203 20 0 DIADLO CC(C)N(Cc1c[nH+]cn1Cc1ccccc1)c1ccccc1 ZINC000445816007 1044827565 /nfs/dbraw/zinc/82/75/65/1044827565.db2.gz RHMWMLXMJMXGHY-UHFFFAOYSA-N 1 2 305.425 4.346 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cc(F)c(F)c(F)c3)CCC2)n1 ZINC000263956867 1044836594 /nfs/dbraw/zinc/83/65/94/1044836594.db2.gz MBSBMQKHPWZMFH-UHFFFAOYSA-N 1 2 312.360 4.038 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](C)Cc1cscn1 ZINC000264004262 1044841589 /nfs/dbraw/zinc/84/15/89/1044841589.db2.gz GTLJFFUHWFHKBB-SNVBAGLBSA-N 1 2 300.349 4.355 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)Cc1cscn1 ZINC000264004262 1044841610 /nfs/dbraw/zinc/84/16/10/1044841610.db2.gz GTLJFFUHWFHKBB-SNVBAGLBSA-N 1 2 300.349 4.355 20 0 DIADLO CCOc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1csc(C)n1)CCO2 ZINC000370625020 1044844440 /nfs/dbraw/zinc/84/44/40/1044844440.db2.gz SZMMIKOIJMQTBQ-XHDPSFHLSA-N 1 2 318.442 4.025 20 0 DIADLO C[C@H]([NH2+]Cc1ccsc1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000371058174 1044860430 /nfs/dbraw/zinc/86/04/30/1044860430.db2.gz ZYNUUOWZHGXSFG-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC(Cc3cccnc3)CC2)c1 ZINC000572837179 1044879374 /nfs/dbraw/zinc/87/93/74/1044879374.db2.gz QHGNRZOUBPCHKV-UHFFFAOYSA-N 1 2 321.399 4.228 20 0 DIADLO CC(C)[N@@H+](Cc1csc(-c2ccoc2)n1)Cc1ccco1 ZINC000264457786 1044881679 /nfs/dbraw/zinc/88/16/79/1044881679.db2.gz JMQQFBUIUSOCMN-UHFFFAOYSA-N 1 2 302.399 4.407 20 0 DIADLO CC(C)[N@H+](Cc1csc(-c2ccoc2)n1)Cc1ccco1 ZINC000264457786 1044881688 /nfs/dbraw/zinc/88/16/88/1044881688.db2.gz JMQQFBUIUSOCMN-UHFFFAOYSA-N 1 2 302.399 4.407 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@](F)(c3ccccc3C)C2)c(C)s1 ZINC000337416131 1044896034 /nfs/dbraw/zinc/89/60/34/1044896034.db2.gz RKXWTFJRTLLEEE-QGZVFWFLSA-N 1 2 304.434 4.139 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@](F)(c3ccccc3C)C2)c(C)s1 ZINC000337416131 1044896048 /nfs/dbraw/zinc/89/60/48/1044896048.db2.gz RKXWTFJRTLLEEE-QGZVFWFLSA-N 1 2 304.434 4.139 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2nc(C3CC3)cs2)C1 ZINC000337462218 1044903044 /nfs/dbraw/zinc/90/30/44/1044903044.db2.gz QATJLSUXFGHCBS-SFHVURJKSA-N 1 2 316.445 4.400 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2nc(C3CC3)cs2)C1 ZINC000337462218 1044903054 /nfs/dbraw/zinc/90/30/54/1044903054.db2.gz QATJLSUXFGHCBS-SFHVURJKSA-N 1 2 316.445 4.400 20 0 DIADLO Cc1ccc2[nH+]c(CSc3ccnc4ccccc43)cn2c1 ZINC000524689378 1044905816 /nfs/dbraw/zinc/90/58/16/1044905816.db2.gz BCIGEKYCQUYCJS-UHFFFAOYSA-N 1 2 305.406 4.483 20 0 DIADLO Cc1cccc2nc(C[N@@H+](C)[C@H](C)c3ccc(F)c(F)c3)cn21 ZINC000337492466 1044910122 /nfs/dbraw/zinc/91/01/22/1044910122.db2.gz AYJDGHDSERPBCR-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1cccc2nc(C[N@H+](C)[C@H](C)c3ccc(F)c(F)c3)cn21 ZINC000337492466 1044910127 /nfs/dbraw/zinc/91/01/27/1044910127.db2.gz AYJDGHDSERPBCR-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO CCC[N@H+](Cc1ncc(CC)o1)[C@@H](C)c1ccccc1OC ZINC000524753378 1044911176 /nfs/dbraw/zinc/91/11/76/1044911176.db2.gz PHINDXZOXMIPRU-AWEZNQCLSA-N 1 2 302.418 4.219 20 0 DIADLO CCC[N@@H+](Cc1ncc(CC)o1)[C@@H](C)c1ccccc1OC ZINC000524753378 1044911183 /nfs/dbraw/zinc/91/11/83/1044911183.db2.gz PHINDXZOXMIPRU-AWEZNQCLSA-N 1 2 302.418 4.219 20 0 DIADLO CCC[N@H+](Cc1ncc(CC)o1)[C@H](C)c1ccccc1OC ZINC000524753379 1044911335 /nfs/dbraw/zinc/91/13/35/1044911335.db2.gz PHINDXZOXMIPRU-CQSZACIVSA-N 1 2 302.418 4.219 20 0 DIADLO CCC[N@@H+](Cc1ncc(CC)o1)[C@H](C)c1ccccc1OC ZINC000524753379 1044911341 /nfs/dbraw/zinc/91/13/41/1044911341.db2.gz PHINDXZOXMIPRU-CQSZACIVSA-N 1 2 302.418 4.219 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(Cc3ccccc3)n2)C[C@H](C)S1 ZINC000524756489 1044916221 /nfs/dbraw/zinc/91/62/21/1044916221.db2.gz OOGCYTNBCYGCDX-OKILXGFUSA-N 1 2 318.511 4.060 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(Cc3ccccc3)n2)C[C@H](C)S1 ZINC000524756489 1044916231 /nfs/dbraw/zinc/91/62/31/1044916231.db2.gz OOGCYTNBCYGCDX-OKILXGFUSA-N 1 2 318.511 4.060 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H]2CC(C)(C)Oc3cc(F)ccc32)no1 ZINC000337560235 1044919919 /nfs/dbraw/zinc/91/99/19/1044919919.db2.gz URMXDMSDBCVHIN-ABAIWWIYSA-N 1 2 304.365 4.075 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H]2CC(C)(C)Oc3cc(F)ccc32)no1 ZINC000337560240 1044921169 /nfs/dbraw/zinc/92/11/69/1044921169.db2.gz URMXDMSDBCVHIN-NHYWBVRUSA-N 1 2 304.365 4.075 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccc(-c3csc(C)n3)cc2)no1 ZINC000573767002 1044921820 /nfs/dbraw/zinc/92/18/20/1044921820.db2.gz RYEKDHIAGRUHLB-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO CC[NH+](CC)[C@@H](C(=O)OC(C)C)c1cccc(C(F)(F)F)c1 ZINC000524894940 1044942729 /nfs/dbraw/zinc/94/27/29/1044942729.db2.gz CPROGBIISKTUTD-CQSZACIVSA-N 1 2 317.351 4.040 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cscc1Br ZINC000574235375 1044946405 /nfs/dbraw/zinc/94/64/05/1044946405.db2.gz LFHBWKBRMLWUIK-XPTSAGLGSA-N 1 2 324.243 4.122 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@H]2c2ccncc2)c2ccccn21 ZINC000574331066 1044950361 /nfs/dbraw/zinc/95/03/61/1044950361.db2.gz GANFXUJVIPUNHX-SFHVURJKSA-N 1 2 320.440 4.190 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@H]2c2ccncc2)c2ccccn21 ZINC000574331066 1044950367 /nfs/dbraw/zinc/95/03/67/1044950367.db2.gz GANFXUJVIPUNHX-SFHVURJKSA-N 1 2 320.440 4.190 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2cccs2)n1)c1ccncc1F ZINC000337942169 1044966484 /nfs/dbraw/zinc/96/64/84/1044966484.db2.gz BOEDYXAEZXYQFP-JTQLQIEISA-N 1 2 319.430 4.257 20 0 DIADLO Fc1ccccc1C[NH2+]Cc1nc(-c2ccccc2F)cs1 ZINC000373343695 1044968439 /nfs/dbraw/zinc/96/84/39/1044968439.db2.gz JXMLQAOLSLUXMY-UHFFFAOYSA-N 1 2 316.376 4.378 20 0 DIADLO Fc1cc(F)c(C[NH2+]C2(c3nccs3)CCCC2)cc1F ZINC000136159530 1044984922 /nfs/dbraw/zinc/98/49/22/1044984922.db2.gz QUQOKJFGYKNQEA-UHFFFAOYSA-N 1 2 312.360 4.120 20 0 DIADLO CCc1ccc([C@H]2CCC[N@@H+]2[C@@H](C)c2nc(C3CC3)no2)o1 ZINC000265375527 1044992797 /nfs/dbraw/zinc/99/27/97/1044992797.db2.gz BJQKUIFVYJJLBU-SMDDNHRTSA-N 1 2 301.390 4.001 20 0 DIADLO CCc1ccc([C@H]2CCC[N@H+]2[C@@H](C)c2nc(C3CC3)no2)o1 ZINC000265375527 1044992812 /nfs/dbraw/zinc/99/28/12/1044992812.db2.gz BJQKUIFVYJJLBU-SMDDNHRTSA-N 1 2 301.390 4.001 20 0 DIADLO FC(F)Oc1cccc(COc2cccc(-n3cc[nH+]c3)c2)c1 ZINC000525127124 1044995361 /nfs/dbraw/zinc/99/53/61/1044995361.db2.gz PQTUKBVCHNCRBE-UHFFFAOYSA-N 1 2 316.307 4.053 20 0 DIADLO CSc1ccc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)cc1 ZINC000373691557 1045000007 /nfs/dbraw/zinc/00/00/07/1045000007.db2.gz ARXKLEDIWGUUAQ-UHFFFAOYSA-N 1 2 323.421 4.359 20 0 DIADLO FC1(F)CC[C@@H](C[N@@H+]2CCO[C@@H](c3ccccc3Cl)C2)C1 ZINC000575436166 1045000392 /nfs/dbraw/zinc/00/03/92/1045000392.db2.gz LFWPMYPDLLRUFQ-IUODEOHRSA-N 1 2 315.791 4.149 20 0 DIADLO FC1(F)CC[C@@H](C[N@H+]2CCO[C@@H](c3ccccc3Cl)C2)C1 ZINC000575436166 1045000407 /nfs/dbraw/zinc/00/04/07/1045000407.db2.gz LFWPMYPDLLRUFQ-IUODEOHRSA-N 1 2 315.791 4.149 20 0 DIADLO Cc1ccc(C)c(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1 ZINC000373698581 1045002390 /nfs/dbraw/zinc/00/23/90/1045002390.db2.gz UFTSESAVVXSNSW-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cccc2[nH]ccc21 ZINC000373699793 1045002657 /nfs/dbraw/zinc/00/26/57/1045002657.db2.gz XSAKYPHILQUWRK-UHFFFAOYSA-N 1 2 316.364 4.119 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1occc1C)c1ccccc1 ZINC000525182774 1045007274 /nfs/dbraw/zinc/00/72/74/1045007274.db2.gz DICAMYBFCJVGPO-FQEVSTJZSA-N 1 2 307.393 4.476 20 0 DIADLO Fc1cc(-c2ncco2)ccc1C[N@H+](Cc1ccccn1)C1CC1 ZINC000411445936 1045008064 /nfs/dbraw/zinc/00/80/64/1045008064.db2.gz PHKULNAGVCDOSW-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1cc(-c2ncco2)ccc1C[N@@H+](Cc1ccccn1)C1CC1 ZINC000411445936 1045008074 /nfs/dbraw/zinc/00/80/74/1045008074.db2.gz PHKULNAGVCDOSW-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO CCc1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)nc1 ZINC000411534332 1045015876 /nfs/dbraw/zinc/01/58/76/1045015876.db2.gz PGDRIQATJDXFNS-GFCCVEGCSA-N 1 2 303.475 4.249 20 0 DIADLO C[N@H+](CCOCC1CC1)Cc1csc(C2CCCCC2)n1 ZINC000446728911 1045025685 /nfs/dbraw/zinc/02/56/85/1045025685.db2.gz MKZPRVPPYQTWPA-UHFFFAOYSA-N 1 2 308.491 4.049 20 0 DIADLO C[N@@H+](CCOCC1CC1)Cc1csc(C2CCCCC2)n1 ZINC000446728911 1045025699 /nfs/dbraw/zinc/02/56/99/1045025699.db2.gz MKZPRVPPYQTWPA-UHFFFAOYSA-N 1 2 308.491 4.049 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)ccc1OCC1CC1)c1nccs1 ZINC000411876965 1045033934 /nfs/dbraw/zinc/03/39/34/1045033934.db2.gz BTACREXXOLMBEJ-NSHDSACASA-N 1 2 322.861 4.436 20 0 DIADLO COC(=O)c1sccc1C[N@@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000446779875 1045039647 /nfs/dbraw/zinc/03/96/47/1045039647.db2.gz DDXACYXTDIZSJI-GXTWGEPZSA-N 1 2 319.426 4.101 20 0 DIADLO COC(=O)c1sccc1C[N@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000446779875 1045039658 /nfs/dbraw/zinc/03/96/58/1045039658.db2.gz DDXACYXTDIZSJI-GXTWGEPZSA-N 1 2 319.426 4.101 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+][C@H](COCC(C)C)c1ccco1 ZINC000152583962 1045043715 /nfs/dbraw/zinc/04/37/15/1045043715.db2.gz YDWMGLHDDNXXNU-NVXWUHKLSA-N 1 2 317.429 4.353 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nnc(C(C)(C)C)o2)o1 ZINC000158660121 1045052533 /nfs/dbraw/zinc/05/25/33/1045052533.db2.gz ZBOXUCIJPSCOSQ-AWEZNQCLSA-N 1 2 317.433 4.386 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2nnc(C(C)(C)C)o2)o1 ZINC000158660121 1045052546 /nfs/dbraw/zinc/05/25/46/1045052546.db2.gz ZBOXUCIJPSCOSQ-AWEZNQCLSA-N 1 2 317.433 4.386 20 0 DIADLO CCc1ccc(C[NH2+][C@H](c2cccc(C)c2)c2ccccn2)o1 ZINC000153557289 1045059737 /nfs/dbraw/zinc/05/97/37/1045059737.db2.gz CXWUHOWIUBVILZ-HXUWFJFHSA-N 1 2 306.409 4.425 20 0 DIADLO CC(C)[C@@H](NC(=O)C[C@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC000576587431 1045065597 /nfs/dbraw/zinc/06/55/97/1045065597.db2.gz JDXBLYIFQVLTJR-SUMWQHHRSA-N 1 2 319.836 4.001 20 0 DIADLO CC(C)(C)OCC[N@@H+]1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000576572999 1045065704 /nfs/dbraw/zinc/06/57/04/1045065704.db2.gz DKJMYOBTXZIALM-OAHLLOKOSA-N 1 2 321.852 4.168 20 0 DIADLO CC(C)(C)OCC[N@H+]1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000576572999 1045065715 /nfs/dbraw/zinc/06/57/15/1045065715.db2.gz DKJMYOBTXZIALM-OAHLLOKOSA-N 1 2 321.852 4.168 20 0 DIADLO C[N@H+](Cc1c[nH]nc1C(C)(C)C)Cc1cc(Cl)ccc1F ZINC000446975646 1045080171 /nfs/dbraw/zinc/08/01/71/1045080171.db2.gz SDHFKCJELIGTNF-UHFFFAOYSA-N 1 2 309.816 4.132 20 0 DIADLO C[N@@H+](Cc1c[nH]nc1C(C)(C)C)Cc1cc(Cl)ccc1F ZINC000446975646 1045080180 /nfs/dbraw/zinc/08/01/80/1045080180.db2.gz SDHFKCJELIGTNF-UHFFFAOYSA-N 1 2 309.816 4.132 20 0 DIADLO CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000576866914 1045084161 /nfs/dbraw/zinc/08/41/61/1045084161.db2.gz HFGPGZZTIOKRRV-SFHVURJKSA-N 1 2 322.412 4.195 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](C)Cc2cc(C(C)(C)C)n[nH]2)o1 ZINC000447077739 1045095824 /nfs/dbraw/zinc/09/58/24/1045095824.db2.gz MEXVHELYOUAVHO-IUODEOHRSA-N 1 2 301.434 4.056 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2cc(C(C)(C)C)n[nH]2)o1 ZINC000447077739 1045095839 /nfs/dbraw/zinc/09/58/39/1045095839.db2.gz MEXVHELYOUAVHO-IUODEOHRSA-N 1 2 301.434 4.056 20 0 DIADLO C[N@H+](Cc1cc(C(C)(C)C)n[nH]1)Cc1cc(F)cc(Cl)c1 ZINC000447099908 1045096559 /nfs/dbraw/zinc/09/65/59/1045096559.db2.gz SQDVSJNBUCCTEQ-UHFFFAOYSA-N 1 2 309.816 4.132 20 0 DIADLO C[N@@H+](Cc1cc(C(C)(C)C)n[nH]1)Cc1cc(F)cc(Cl)c1 ZINC000447099908 1045096572 /nfs/dbraw/zinc/09/65/72/1045096572.db2.gz SQDVSJNBUCCTEQ-UHFFFAOYSA-N 1 2 309.816 4.132 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@H](C)C2)no1 ZINC000525638874 1045104208 /nfs/dbraw/zinc/10/42/08/1045104208.db2.gz HAVLIIYOQGUPRE-NVXWUHKLSA-N 1 2 313.445 4.038 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@@H](c3ccccc3)[C@H](C)C2)no1 ZINC000525638874 1045104213 /nfs/dbraw/zinc/10/42/13/1045104213.db2.gz HAVLIIYOQGUPRE-NVXWUHKLSA-N 1 2 313.445 4.038 20 0 DIADLO CCCc1csc(C[N@@H+]2CCC[C@H]2c2cccc(C)n2)n1 ZINC000577330745 1045117291 /nfs/dbraw/zinc/11/72/91/1045117291.db2.gz WHQMAOREZRZHSV-INIZCTEOSA-N 1 2 301.459 4.136 20 0 DIADLO CCCc1csc(C[N@H+]2CCC[C@H]2c2cccc(C)n2)n1 ZINC000577330745 1045117300 /nfs/dbraw/zinc/11/73/00/1045117300.db2.gz WHQMAOREZRZHSV-INIZCTEOSA-N 1 2 301.459 4.136 20 0 DIADLO COC(=O)c1sccc1C[N@H+](Cc1ccccc1C)C1CC1 ZINC000447372890 1045123192 /nfs/dbraw/zinc/12/31/92/1045123192.db2.gz JRARASXFQQGOCK-UHFFFAOYSA-N 1 2 315.438 4.008 20 0 DIADLO COC(=O)c1sccc1C[N@@H+](Cc1ccccc1C)C1CC1 ZINC000447372890 1045123198 /nfs/dbraw/zinc/12/31/98/1045123198.db2.gz JRARASXFQQGOCK-UHFFFAOYSA-N 1 2 315.438 4.008 20 0 DIADLO C[C@H](c1ccco1)[N@H+](Cc1cncn1Cc1ccccc1)C1CC1 ZINC000525832986 1045127041 /nfs/dbraw/zinc/12/70/41/1045127041.db2.gz VQIJOPXZJRPGMY-MRXNPFEDSA-N 1 2 321.424 4.250 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](Cc1cncn1Cc1ccccc1)C1CC1 ZINC000525832986 1045127044 /nfs/dbraw/zinc/12/70/44/1045127044.db2.gz VQIJOPXZJRPGMY-MRXNPFEDSA-N 1 2 321.424 4.250 20 0 DIADLO CCCCOc1ccccc1C[N@H+](C)Cc1conc1CC ZINC000577477092 1045127598 /nfs/dbraw/zinc/12/75/98/1045127598.db2.gz IZFSIAMNYDECQJ-UHFFFAOYSA-N 1 2 302.418 4.048 20 0 DIADLO CCCCOc1ccccc1C[N@@H+](C)Cc1conc1CC ZINC000577477092 1045127603 /nfs/dbraw/zinc/12/76/03/1045127603.db2.gz IZFSIAMNYDECQJ-UHFFFAOYSA-N 1 2 302.418 4.048 20 0 DIADLO c1csc(-c2cc(C[N@@H+]3CCC=C(c4ccccn4)C3)no2)c1 ZINC000577617454 1045143602 /nfs/dbraw/zinc/14/36/02/1045143602.db2.gz YHZUYWXNBHSEEY-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO c1csc(-c2cc(C[N@H+]3CCC=C(c4ccccn4)C3)no2)c1 ZINC000577617454 1045143612 /nfs/dbraw/zinc/14/36/12/1045143612.db2.gz YHZUYWXNBHSEEY-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO Cc1ccccc1[C@@H](C)c1noc([C@@H](CC(C)C)n2cc[nH+]c2)n1 ZINC000923955726 1045144457 /nfs/dbraw/zinc/14/44/57/1045144457.db2.gz INLHLTAZMJZBGS-NVXWUHKLSA-N 1 2 324.428 4.362 20 0 DIADLO Cc1ccccc1[C@H]([C@H](C)N[C@H]1CCCc2occc21)[NH+](C)C ZINC000447593660 1045155410 /nfs/dbraw/zinc/15/54/10/1045155410.db2.gz UHLXRAXLNGBTBK-QSFXBCCZSA-N 1 2 312.457 4.246 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@H](c3cccs3)C2)cc1Cl ZINC000447738332 1045172977 /nfs/dbraw/zinc/17/29/77/1045172977.db2.gz FETDVOUHHXVXRU-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@H](c3cccs3)C2)cc1Cl ZINC000447738332 1045172983 /nfs/dbraw/zinc/17/29/83/1045172983.db2.gz FETDVOUHHXVXRU-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO CC(C)(C)[C@@H]1C[N@H+](Cc2nc(-c3ccccc3)cs2)CCO1 ZINC000447836564 1045182792 /nfs/dbraw/zinc/18/27/92/1045182792.db2.gz QQSBFXABPUEHFB-INIZCTEOSA-N 1 2 316.470 4.057 20 0 DIADLO CC(C)(C)[C@@H]1C[N@@H+](Cc2nc(-c3ccccc3)cs2)CCO1 ZINC000447836564 1045182799 /nfs/dbraw/zinc/18/27/99/1045182799.db2.gz QQSBFXABPUEHFB-INIZCTEOSA-N 1 2 316.470 4.057 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2nc(C)cs2)c2cccnc2)cc1 ZINC000924612656 1045183884 /nfs/dbraw/zinc/18/38/84/1045183884.db2.gz ALWHGVMGHWMYRK-LJQANCHMSA-N 1 2 323.465 4.288 20 0 DIADLO Fc1cccc(Cl)c1CCC[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000577901862 1045186351 /nfs/dbraw/zinc/18/63/51/1045186351.db2.gz QJGCPVRLUJAHNS-QGZVFWFLSA-N 1 2 321.827 4.362 20 0 DIADLO Fc1cccc(Cl)c1CCC[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000577901862 1045186356 /nfs/dbraw/zinc/18/63/56/1045186356.db2.gz QJGCPVRLUJAHNS-QGZVFWFLSA-N 1 2 321.827 4.362 20 0 DIADLO C[C@@H](Nc1cc(N2CCCC2)nc[nH+]1)c1cccc2ccccc21 ZINC000557477655 1045187801 /nfs/dbraw/zinc/18/78/01/1045187801.db2.gz HQJDZWULKDUTRQ-OAHLLOKOSA-N 1 2 318.424 4.403 20 0 DIADLO C[C@@H](Nc1cc(N2CCCC2)[nH+]cn1)c1cccc2ccccc21 ZINC000557477655 1045187808 /nfs/dbraw/zinc/18/78/08/1045187808.db2.gz HQJDZWULKDUTRQ-OAHLLOKOSA-N 1 2 318.424 4.403 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@@H](C)c1ccccc1OC(C)C ZINC000924692124 1045188781 /nfs/dbraw/zinc/18/87/81/1045188781.db2.gz LBJRJFVJGZIPAP-BBRMVZONSA-N 1 2 314.429 4.498 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cnn(C2CCC2)c1 ZINC000924720682 1045195342 /nfs/dbraw/zinc/19/53/42/1045195342.db2.gz KFSLTCKIBBTRTC-NEPJUHHUSA-N 1 2 305.372 4.298 20 0 DIADLO Cc1noc(C)c1C[NH2+][C@H](c1cccnc1)c1cc(C)cc(C)c1 ZINC000924780751 1045198219 /nfs/dbraw/zinc/19/82/19/1045198219.db2.gz IAPCBAUJAXSKKD-HXUWFJFHSA-N 1 2 321.424 4.182 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+]([C@@H](C)c2ccc(F)c(F)c2)CCO1 ZINC000578060065 1045204137 /nfs/dbraw/zinc/20/41/37/1045204137.db2.gz DGMDDOHYUXHENQ-IFXJQAMLSA-N 1 2 317.379 4.408 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+]([C@@H](C)c2ccc(F)c(F)c2)CCO1 ZINC000578060065 1045204145 /nfs/dbraw/zinc/20/41/45/1045204145.db2.gz DGMDDOHYUXHENQ-IFXJQAMLSA-N 1 2 317.379 4.408 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+][C@@H]1CCCc2oc(C)nc21 ZINC000924858798 1045206306 /nfs/dbraw/zinc/20/63/06/1045206306.db2.gz NHMFHWVQXYVXKI-IUODEOHRSA-N 1 2 300.402 4.110 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cc(O)cc(F)c1 ZINC000924970824 1045215633 /nfs/dbraw/zinc/21/56/33/1045215633.db2.gz UMNXDUBFEBIAKW-JTQLQIEISA-N 1 2 308.422 4.136 20 0 DIADLO FCc1ccc(C[NH2+][C@@H](c2nccs2)c2ccccc2)cc1 ZINC000777539897 1045215688 /nfs/dbraw/zinc/21/56/88/1045215688.db2.gz FOTKYIFBNSJOCT-QGZVFWFLSA-N 1 2 312.413 4.492 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000448220659 1045220041 /nfs/dbraw/zinc/22/00/41/1045220041.db2.gz RCJJXXHIVHGSDA-AWEZNQCLSA-N 1 2 303.475 4.116 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000448220659 1045220046 /nfs/dbraw/zinc/22/00/46/1045220046.db2.gz RCJJXXHIVHGSDA-AWEZNQCLSA-N 1 2 303.475 4.116 20 0 DIADLO C[C@H]([NH2+]Cc1ncccn1)c1ccc(SC2CCCC2)cc1 ZINC000578207381 1045221794 /nfs/dbraw/zinc/22/17/94/1045221794.db2.gz VNOVMGJRSDGFKP-AWEZNQCLSA-N 1 2 313.470 4.362 20 0 DIADLO CC[C@@H]([NH2+][C@@H]1CCCc2oc(C)nc21)c1ccc(F)cc1F ZINC000925099860 1045225418 /nfs/dbraw/zinc/22/54/18/1045225418.db2.gz UKKFNJPYIQZBTQ-HUUCEWRRSA-N 1 2 306.356 4.380 20 0 DIADLO CC[C@H]([NH2+][C@@H]1CCCc2oc(C)nc21)c1ccc(F)cc1F ZINC000925099862 1045225700 /nfs/dbraw/zinc/22/57/00/1045225700.db2.gz UKKFNJPYIQZBTQ-LSDHHAIUSA-N 1 2 306.356 4.380 20 0 DIADLO C[C@@H]([NH2+]Cc1ccon1)c1ccccc1SC(F)(F)F ZINC000925210354 1045236331 /nfs/dbraw/zinc/23/63/31/1045236331.db2.gz FDSKNTZFELFMFA-SECBINFHSA-N 1 2 302.321 4.137 20 0 DIADLO CCCCN(C(=O)[C@@H]1CCCc2[nH+]c[nH]c21)[C@@H]1CCC[C@@H](C)C1 ZINC000578392406 1045239685 /nfs/dbraw/zinc/23/96/85/1045239685.db2.gz VRFUKZVZWHCOQE-BZUAXINKSA-N 1 2 317.477 4.037 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000578475213 1045247039 /nfs/dbraw/zinc/24/70/39/1045247039.db2.gz ZNQNXLYVJJXYNO-VIFPVBQESA-N 1 2 324.198 4.479 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000578475213 1045247049 /nfs/dbraw/zinc/24/70/49/1045247049.db2.gz ZNQNXLYVJJXYNO-VIFPVBQESA-N 1 2 324.198 4.479 20 0 DIADLO Cc1[nH]c(CNc2ccccc2N(C)Cc2ccccc2)[nH+]c1C ZINC000578523717 1045249509 /nfs/dbraw/zinc/24/95/09/1045249509.db2.gz NQDRDTSBBDGRLV-UHFFFAOYSA-N 1 2 320.440 4.275 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](Cc2cc(Cl)cs2)CCO1 ZINC000578582852 1045256770 /nfs/dbraw/zinc/25/67/70/1045256770.db2.gz PKXOPADZOYLVMB-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2cc(Cl)cs2)CCO1 ZINC000578582852 1045256777 /nfs/dbraw/zinc/25/67/77/1045256777.db2.gz PKXOPADZOYLVMB-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cnc(C[NH2+]C(C)(C)c2nc3ccccc3s2)s1 ZINC000527745449 1045257742 /nfs/dbraw/zinc/25/77/42/1045257742.db2.gz QNPBQGXMUNJKLC-UHFFFAOYSA-N 1 2 303.456 4.086 20 0 DIADLO Cc1cccc(-c2ccc(NCc3c[nH+]cn3C(C)C)nc2)c1 ZINC000527745468 1045258418 /nfs/dbraw/zinc/25/84/18/1045258418.db2.gz RAEHVFBRKAPXAG-UHFFFAOYSA-N 1 2 306.413 4.447 20 0 DIADLO CCS[C@@H]1CCC[C@@H]([NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC000578706150 1045267822 /nfs/dbraw/zinc/26/78/22/1045267822.db2.gz NHEFBWMNAMRYKB-BZUAXINKSA-N 1 2 322.522 4.080 20 0 DIADLO C[C@@H]1CN(c2[nH+]ccc3ccccc32)C[C@H](c2ccccc2)O1 ZINC000527865856 1045269922 /nfs/dbraw/zinc/26/99/22/1045269922.db2.gz VNDWAHMDZFYNAT-DNVCBOLYSA-N 1 2 304.393 4.201 20 0 DIADLO Clc1cccc2c(N3CCC[C@H]3[C@H]3CCCOC3)cc[nH+]c12 ZINC000578763856 1045270160 /nfs/dbraw/zinc/27/01/60/1045270160.db2.gz OMJMNUSYIGBLRF-BBRMVZONSA-N 1 2 316.832 4.284 20 0 DIADLO CCCCCC[C@@](C)(CCC)C(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000779096520 1045272797 /nfs/dbraw/zinc/27/27/97/1045272797.db2.gz QUMXJMCRTGEJGT-VQIMIIECSA-N 1 2 319.493 4.091 20 0 DIADLO c1ccc([C@H]2CN(c3[nH+]ccc4ccccc43)CCCO2)cc1 ZINC000527881408 1045273139 /nfs/dbraw/zinc/27/31/39/1045273139.db2.gz MPOZNHOZRNCYQD-LJQANCHMSA-N 1 2 304.393 4.203 20 0 DIADLO C[C@@H]1CCCC[C@@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000578858554 1045276435 /nfs/dbraw/zinc/27/64/35/1045276435.db2.gz SINAMZMWIYHGNG-PBHICJAKSA-N 1 2 322.412 4.275 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@@H]1CC12CC2 ZINC000527879707 1045276956 /nfs/dbraw/zinc/27/69/56/1045276956.db2.gz GUAFGLCAONGJRJ-PBHICJAKSA-N 1 2 305.425 4.202 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](Cc2ccc(C)cc2)c2ccccn2)no1 ZINC000578916965 1045281091 /nfs/dbraw/zinc/28/10/91/1045281091.db2.gz IWEWMPDITKTJOJ-JXFKEZNVSA-N 1 2 321.424 4.321 20 0 DIADLO c1ccc2c(c1)NCCC[C@H]2Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000578939456 1045282912 /nfs/dbraw/zinc/28/29/12/1045282912.db2.gz CGXIIVUKZXTOMO-LJQANCHMSA-N 1 2 322.456 4.431 20 0 DIADLO C[C@H]1CN(c2[nH+]ccc3ccccc32)C[C@@H](c2ccsc2)O1 ZINC000527931564 1045285669 /nfs/dbraw/zinc/28/56/69/1045285669.db2.gz SYQMFHLVMXVJQO-GUYCJALGSA-N 1 2 310.422 4.263 20 0 DIADLO C[C@@H]1CCC[C@H](c2noc(-c3ccc(Cn4cc[nH+]c4)cc3)n2)C1 ZINC000579299351 1045306586 /nfs/dbraw/zinc/30/65/86/1045306586.db2.gz TZYASWIFLVKPNR-PBHICJAKSA-N 1 2 322.412 4.275 20 0 DIADLO C[C@@H]1CCC[C@@H](c2noc(-c3ccc(Cn4cc[nH+]c4)cc3)n2)C1 ZINC000579299352 1045306602 /nfs/dbraw/zinc/30/66/02/1045306602.db2.gz TZYASWIFLVKPNR-RHSMWYFYSA-N 1 2 322.412 4.275 20 0 DIADLO COc1cc2ccccc2cc1C[N@@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000449018946 1045332679 /nfs/dbraw/zinc/33/26/79/1045332679.db2.gz PNQPSFRHJVCTMJ-SFHVURJKSA-N 1 2 321.424 4.299 20 0 DIADLO COc1cc2ccccc2cc1C[N@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000449018946 1045332684 /nfs/dbraw/zinc/33/26/84/1045332684.db2.gz PNQPSFRHJVCTMJ-SFHVURJKSA-N 1 2 321.424 4.299 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1ccnn1C1CCCC1 ZINC000449011850 1045333507 /nfs/dbraw/zinc/33/35/07/1045333507.db2.gz VMZFTPLKCXXFGM-AWEZNQCLSA-N 1 2 301.409 4.330 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccnn1C1CCCC1 ZINC000449011850 1045333512 /nfs/dbraw/zinc/33/35/12/1045333512.db2.gz VMZFTPLKCXXFGM-AWEZNQCLSA-N 1 2 301.409 4.330 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccnn2C2CCCC2)s1 ZINC000449032224 1045335603 /nfs/dbraw/zinc/33/56/03/1045335603.db2.gz YTBRJEDGCQDOPS-CYBMUJFWSA-N 1 2 318.490 4.265 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccnn2C2CCCC2)s1 ZINC000449032224 1045335608 /nfs/dbraw/zinc/33/56/08/1045335608.db2.gz YTBRJEDGCQDOPS-CYBMUJFWSA-N 1 2 318.490 4.265 20 0 DIADLO Cc1ccc2[nH+]cc(/C=C/C(=O)c3csc(Cl)c3)n2c1 ZINC000188865007 1045340365 /nfs/dbraw/zinc/34/03/65/1045340365.db2.gz OOPQCWWOLGCCSO-ONEGZZNKSA-N 1 2 302.786 4.254 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2nnc(C(C)(C)C)o2)C1 ZINC000075843131 1045340894 /nfs/dbraw/zinc/34/08/94/1045340894.db2.gz PHDRYHWKXAJCKR-WFASDCNBSA-N 1 2 317.408 4.089 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2nnc(C(C)(C)C)o2)C1 ZINC000075843131 1045340895 /nfs/dbraw/zinc/34/08/95/1045340895.db2.gz PHDRYHWKXAJCKR-WFASDCNBSA-N 1 2 317.408 4.089 20 0 DIADLO Cc1ccc(C[N@H+](C)CN2c3cccc4cccc(c34)C2=O)s1 ZINC000076265932 1045346287 /nfs/dbraw/zinc/34/62/87/1045346287.db2.gz VMKZGAHDTDTPBB-UHFFFAOYSA-N 1 2 322.433 4.259 20 0 DIADLO Cc1ccc(C[N@@H+](C)CN2c3cccc4cccc(c34)C2=O)s1 ZINC000076265932 1045346290 /nfs/dbraw/zinc/34/62/90/1045346290.db2.gz VMKZGAHDTDTPBB-UHFFFAOYSA-N 1 2 322.433 4.259 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccnc2C(F)(F)F)[C@@H]1c1ccccc1 ZINC000528393832 1045350377 /nfs/dbraw/zinc/35/03/77/1045350377.db2.gz GYHAFSIHRAHULZ-WFASDCNBSA-N 1 2 306.331 4.293 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccnc2C(F)(F)F)[C@@H]1c1ccccc1 ZINC000528393832 1045350383 /nfs/dbraw/zinc/35/03/83/1045350383.db2.gz GYHAFSIHRAHULZ-WFASDCNBSA-N 1 2 306.331 4.293 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)s1 ZINC000449456897 1045395967 /nfs/dbraw/zinc/39/59/67/1045395967.db2.gz DTMWATBLKDFGDM-QWRGUYRKSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)s1 ZINC000449456897 1045395970 /nfs/dbraw/zinc/39/59/70/1045395970.db2.gz DTMWATBLKDFGDM-QWRGUYRKSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1ccc(C(=O)NNc2cc[nH+]cc2Cl)cc1Cl ZINC000189775683 1045367878 /nfs/dbraw/zinc/36/78/78/1045367878.db2.gz DWKOTZIMDGZHAU-UHFFFAOYSA-N 1 2 324.211 4.269 20 0 DIADLO CC(C)CC[C@@H]1CC[C@H]([NH2+][C@H](c2nnc[nH]2)c2ccccc2)C1 ZINC000449239979 1045368850 /nfs/dbraw/zinc/36/88/50/1045368850.db2.gz XGWXLRIQNSIQDP-NJAFHUGGSA-N 1 2 312.461 4.089 20 0 DIADLO Cc1cnc(C[N@H+](CCc2ccccc2)Cc2ccncc2)s1 ZINC000449325568 1045375814 /nfs/dbraw/zinc/37/58/14/1045375814.db2.gz NPABFTSGRQBAGG-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO Cc1cnc(C[N@@H+](CCc2ccccc2)Cc2ccncc2)s1 ZINC000449325568 1045375822 /nfs/dbraw/zinc/37/58/22/1045375822.db2.gz NPABFTSGRQBAGG-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO c1c2cccnc2oc1C[N@@H+]1CCCn2c(cc3ccccc32)C1 ZINC000449332046 1045376220 /nfs/dbraw/zinc/37/62/20/1045376220.db2.gz PTBKEKGIHMJCJT-UHFFFAOYSA-N 1 2 317.392 4.188 20 0 DIADLO c1c2cccnc2oc1C[N@H+]1CCCn2c(cc3ccccc32)C1 ZINC000449332046 1045376222 /nfs/dbraw/zinc/37/62/22/1045376222.db2.gz PTBKEKGIHMJCJT-UHFFFAOYSA-N 1 2 317.392 4.188 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+]1CCc2nc(C(C)(C)C)ncc2C1 ZINC000528591931 1045385444 /nfs/dbraw/zinc/38/54/44/1045385444.db2.gz KHGAWSUHRCQJNB-CYBMUJFWSA-N 1 2 313.420 4.033 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+]1CCc2nc(C(C)(C)C)ncc2C1 ZINC000528591931 1045385448 /nfs/dbraw/zinc/38/54/48/1045385448.db2.gz KHGAWSUHRCQJNB-CYBMUJFWSA-N 1 2 313.420 4.033 20 0 DIADLO Clc1cnc(C[NH2+][C@H](c2ccccn2)C2CCC2)c(Cl)c1 ZINC000528660041 1045392963 /nfs/dbraw/zinc/39/29/63/1045392963.db2.gz PEJMYXHOCJREBZ-INIZCTEOSA-N 1 2 322.239 4.414 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nccn1-c1ccccc1 ZINC000449462412 1045399442 /nfs/dbraw/zinc/39/94/42/1045399442.db2.gz SXRRBRNJJBQPNE-KGLIPLIRSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1nccn1-c1ccccc1 ZINC000449462412 1045399443 /nfs/dbraw/zinc/39/94/43/1045399443.db2.gz SXRRBRNJJBQPNE-KGLIPLIRSA-N 1 2 323.362 4.035 20 0 DIADLO CC(F)(F)c1ccccc1NC1CCN(c2cccc[nH+]2)CC1 ZINC000449466054 1045399651 /nfs/dbraw/zinc/39/96/51/1045399651.db2.gz FVSZXIBCESRQSQ-UHFFFAOYSA-N 1 2 317.383 4.274 20 0 DIADLO Cc1ncc(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)s1 ZINC000528714536 1045400535 /nfs/dbraw/zinc/40/05/35/1045400535.db2.gz MPEBLRTYSYOCGN-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1ncc(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)s1 ZINC000528714536 1045400537 /nfs/dbraw/zinc/40/05/37/1045400537.db2.gz MPEBLRTYSYOCGN-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO CCO[C@H]1CC[N@H+](Cc2cc(Cl)sc2Cl)C[C@H]1C ZINC000449504521 1045404206 /nfs/dbraw/zinc/40/42/06/1045404206.db2.gz QLCACCOMJFOEDY-KOLCDFICSA-N 1 2 308.274 4.302 20 0 DIADLO CCO[C@H]1CC[N@@H+](Cc2cc(Cl)sc2Cl)C[C@H]1C ZINC000449504521 1045404210 /nfs/dbraw/zinc/40/42/10/1045404210.db2.gz QLCACCOMJFOEDY-KOLCDFICSA-N 1 2 308.274 4.302 20 0 DIADLO Cc1cnc(C[N@H+]2CC=C(c3ccc(Cl)cc3C)CC2)o1 ZINC000528742317 1045407896 /nfs/dbraw/zinc/40/78/96/1045407896.db2.gz UBFTXLMJUISPTG-UHFFFAOYSA-N 1 2 302.805 4.234 20 0 DIADLO Cc1cnc(C[N@@H+]2CC=C(c3ccc(Cl)cc3C)CC2)o1 ZINC000528742317 1045407899 /nfs/dbraw/zinc/40/78/99/1045407899.db2.gz UBFTXLMJUISPTG-UHFFFAOYSA-N 1 2 302.805 4.234 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCC(F)(F)C[C@@H]3C)co2)cc1 ZINC000528768714 1045411425 /nfs/dbraw/zinc/41/14/25/1045411425.db2.gz OFHIWVOVIBHKHN-ZDUSSCGKSA-N 1 2 306.356 4.270 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCC(F)(F)C[C@@H]3C)co2)cc1 ZINC000528768714 1045411430 /nfs/dbraw/zinc/41/14/30/1045411430.db2.gz OFHIWVOVIBHKHN-ZDUSSCGKSA-N 1 2 306.356 4.270 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+]3CCC(F)(F)C[C@H]3C)o2)cc1 ZINC000528771000 1045413017 /nfs/dbraw/zinc/41/30/17/1045413017.db2.gz WISPGUQOEZDJTL-CYBMUJFWSA-N 1 2 306.356 4.270 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+]3CCC(F)(F)C[C@H]3C)o2)cc1 ZINC000528771000 1045413019 /nfs/dbraw/zinc/41/30/19/1045413019.db2.gz WISPGUQOEZDJTL-CYBMUJFWSA-N 1 2 306.356 4.270 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3F)o2)c2nccn21 ZINC000449575042 1045415536 /nfs/dbraw/zinc/41/55/36/1045415536.db2.gz WSXVUNDWQOHKRG-WBMJQRKESA-N 1 2 311.360 4.078 20 0 DIADLO c1coc([C@H]2[N@H+](Cc3ccnn3-c3ccccc3)CC23CCC3)c1 ZINC000449640160 1045423021 /nfs/dbraw/zinc/42/30/21/1045423021.db2.gz RUQKULPJMORJQW-LJQANCHMSA-N 1 2 319.408 4.193 20 0 DIADLO c1coc([C@H]2[N@@H+](Cc3ccnn3-c3ccccc3)CC23CCC3)c1 ZINC000449640160 1045423024 /nfs/dbraw/zinc/42/30/24/1045423024.db2.gz RUQKULPJMORJQW-LJQANCHMSA-N 1 2 319.408 4.193 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC000449736717 1045432641 /nfs/dbraw/zinc/43/26/41/1045432641.db2.gz XJHJDJXQOMAAJA-SFHVURJKSA-N 1 2 319.399 4.388 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC000449736717 1045432642 /nfs/dbraw/zinc/43/26/42/1045432642.db2.gz XJHJDJXQOMAAJA-SFHVURJKSA-N 1 2 319.399 4.388 20 0 DIADLO CSCc1cnc(C[N@H+](C)Cc2ccc(C)c(C)c2)s1 ZINC000449762423 1045434595 /nfs/dbraw/zinc/43/45/95/1045434595.db2.gz HZXWJJOHRJIRPH-UHFFFAOYSA-N 1 2 306.500 4.255 20 0 DIADLO CSCc1cnc(C[N@@H+](C)Cc2ccc(C)c(C)c2)s1 ZINC000449762423 1045434598 /nfs/dbraw/zinc/43/45/98/1045434598.db2.gz HZXWJJOHRJIRPH-UHFFFAOYSA-N 1 2 306.500 4.255 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2c(C)n[nH]c2C)s1 ZINC000120440931 1045473164 /nfs/dbraw/zinc/47/31/64/1045473164.db2.gz GPJPLKCDLIBGJI-UHFFFAOYSA-N 1 2 315.442 4.192 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2c(C)n[nH]c2C)s1 ZINC000120440931 1045473168 /nfs/dbraw/zinc/47/31/68/1045473168.db2.gz GPJPLKCDLIBGJI-UHFFFAOYSA-N 1 2 315.442 4.192 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nnc(C(C)C)s2)cc1 ZINC000450212826 1045476059 /nfs/dbraw/zinc/47/60/59/1045476059.db2.gz TWIZDEPXACGPRK-HNNXBMFYSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nnc(C(C)C)s2)cc1 ZINC000450212826 1045476061 /nfs/dbraw/zinc/47/60/61/1045476061.db2.gz TWIZDEPXACGPRK-HNNXBMFYSA-N 1 2 301.459 4.307 20 0 DIADLO CC(C)c1nnc(C[N@H+](C)CCCCc2ccccc2)s1 ZINC000450272402 1045480687 /nfs/dbraw/zinc/48/06/87/1045480687.db2.gz XAECYZOINPCWDV-UHFFFAOYSA-N 1 2 303.475 4.116 20 0 DIADLO CC(C)c1nnc(C[N@@H+](C)CCCCc2ccccc2)s1 ZINC000450272402 1045480690 /nfs/dbraw/zinc/48/06/90/1045480690.db2.gz XAECYZOINPCWDV-UHFFFAOYSA-N 1 2 303.475 4.116 20 0 DIADLO CC[N@H+](Cc1noc(-c2ccsc2)n1)Cc1ccccc1C ZINC000120701717 1045486407 /nfs/dbraw/zinc/48/64/07/1045486407.db2.gz ROQVNZOCVNINBG-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO CC[N@@H+](Cc1noc(-c2ccsc2)n1)Cc1ccccc1C ZINC000120701717 1045486408 /nfs/dbraw/zinc/48/64/08/1045486408.db2.gz ROQVNZOCVNINBG-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ccsc2C(F)(F)F)n1 ZINC000529527953 1045487335 /nfs/dbraw/zinc/48/73/35/1045487335.db2.gz HREGOBFXFRICNF-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ccsc2C(F)(F)F)n1 ZINC000529527953 1045487337 /nfs/dbraw/zinc/48/73/37/1045487337.db2.gz HREGOBFXFRICNF-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Brc1sccc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000529517140 1045487364 /nfs/dbraw/zinc/48/73/64/1045487364.db2.gz HPDNLHWXQYRXCA-GFCCVEGCSA-N 1 2 311.248 4.176 20 0 DIADLO Brc1sccc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000529517140 1045487366 /nfs/dbraw/zinc/48/73/66/1045487366.db2.gz HPDNLHWXQYRXCA-GFCCVEGCSA-N 1 2 311.248 4.176 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccsc2C(F)(F)F)on1 ZINC000529524894 1045490166 /nfs/dbraw/zinc/49/01/66/1045490166.db2.gz KTMCZTTVXLDWEO-LLVKDONJSA-N 1 2 316.348 4.400 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccsc2C(F)(F)F)on1 ZINC000529524894 1045490170 /nfs/dbraw/zinc/49/01/70/1045490170.db2.gz KTMCZTTVXLDWEO-LLVKDONJSA-N 1 2 316.348 4.400 20 0 DIADLO COC[C@@H]([NH2+]Cc1ccsc1C(F)(F)F)c1ccc(C)o1 ZINC000529546673 1045492809 /nfs/dbraw/zinc/49/28/09/1045492809.db2.gz URMVQUXCZDEYSU-LLVKDONJSA-N 1 2 319.348 4.146 20 0 DIADLO CC1(C)C[N@H+](Cc2ccsc2C(F)(F)F)[C@H]1[C@H]1CCCO1 ZINC000529570483 1045497435 /nfs/dbraw/zinc/49/74/35/1045497435.db2.gz BKUVBFZNMDXYHW-NEPJUHHUSA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccsc2C(F)(F)F)[C@H]1[C@H]1CCCO1 ZINC000529570483 1045497436 /nfs/dbraw/zinc/49/74/36/1045497436.db2.gz BKUVBFZNMDXYHW-NEPJUHHUSA-N 1 2 319.392 4.156 20 0 DIADLO FC(F)(F)c1sccc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000529565436 1045497565 /nfs/dbraw/zinc/49/75/65/1045497565.db2.gz KORJUBIAHLGQFA-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1sccc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000529565436 1045497568 /nfs/dbraw/zinc/49/75/68/1045497568.db2.gz KORJUBIAHLGQFA-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO Brc1sccc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000529567013 1045498038 /nfs/dbraw/zinc/49/80/38/1045498038.db2.gz SJOMQDAPJCGJEP-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1sccc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000529567013 1045498039 /nfs/dbraw/zinc/49/80/39/1045498039.db2.gz SJOMQDAPJCGJEP-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2nnc(C(C)C)s2)s1 ZINC000450402709 1045500745 /nfs/dbraw/zinc/50/07/45/1045500745.db2.gz CFIOEQFPFQRYAS-GFCCVEGCSA-N 1 2 307.488 4.369 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nnc(C(C)C)s2)s1 ZINC000450402709 1045500749 /nfs/dbraw/zinc/50/07/49/1045500749.db2.gz CFIOEQFPFQRYAS-GFCCVEGCSA-N 1 2 307.488 4.369 20 0 DIADLO Clc1ccc([C@@H]2CCCCC[N@@H+]2Cc2cnns2)cc1 ZINC000450424308 1045502382 /nfs/dbraw/zinc/50/23/82/1045502382.db2.gz ZHDSIJJGIFSLNO-HNNXBMFYSA-N 1 2 307.850 4.309 20 0 DIADLO Clc1ccc([C@@H]2CCCCC[N@H+]2Cc2cnns2)cc1 ZINC000450424308 1045502389 /nfs/dbraw/zinc/50/23/89/1045502389.db2.gz ZHDSIJJGIFSLNO-HNNXBMFYSA-N 1 2 307.850 4.309 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nnc(C3CC3)s2)s1 ZINC000450414696 1045503433 /nfs/dbraw/zinc/50/34/33/1045503433.db2.gz ZGYLMGVGYZGMNP-GFCCVEGCSA-N 1 2 305.472 4.123 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2nnc(C3CC3)s2)s1 ZINC000450414696 1045503438 /nfs/dbraw/zinc/50/34/38/1045503438.db2.gz ZGYLMGVGYZGMNP-GFCCVEGCSA-N 1 2 305.472 4.123 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2nnc(C3CC3)s2)C1 ZINC000450437187 1045503964 /nfs/dbraw/zinc/50/39/64/1045503964.db2.gz HXJDGTVBRPUVCG-ABAIWWIYSA-N 1 2 317.433 4.138 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2nnc(C3CC3)s2)C1 ZINC000450437187 1045503969 /nfs/dbraw/zinc/50/39/69/1045503969.db2.gz HXJDGTVBRPUVCG-ABAIWWIYSA-N 1 2 317.433 4.138 20 0 DIADLO c1coc(CC2C[NH+](Cc3ncc(-c4ccccc4)s3)C2)c1 ZINC000529649130 1045507399 /nfs/dbraw/zinc/50/73/99/1045507399.db2.gz OVMDADKTBDKERK-UHFFFAOYSA-N 1 2 310.422 4.078 20 0 DIADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)Nc1cccc(C2CCCCC2)c1 ZINC000529650642 1045507663 /nfs/dbraw/zinc/50/76/63/1045507663.db2.gz XDGMOMJVRPNAKM-AWEZNQCLSA-N 1 2 311.429 4.275 20 0 DIADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)Nc1cccc(C2CCCCC2)c1 ZINC000529650642 1045507666 /nfs/dbraw/zinc/50/76/66/1045507666.db2.gz XDGMOMJVRPNAKM-AWEZNQCLSA-N 1 2 311.429 4.275 20 0 DIADLO C(=C/[C@H]1CCCCC[N@H+]1Cc1nncs1)\c1cccs1 ZINC001119729339 1045522909 /nfs/dbraw/zinc/52/29/09/1045522909.db2.gz OEMRDTOMESDCBD-SBDDDAINSA-N 1 2 305.472 4.058 20 0 DIADLO C(=C/[C@H]1CCCCC[N@@H+]1Cc1nncs1)\c1cccs1 ZINC001119729339 1045522925 /nfs/dbraw/zinc/52/29/25/1045522925.db2.gz OEMRDTOMESDCBD-SBDDDAINSA-N 1 2 305.472 4.058 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)[nH]c1C ZINC000628130618 1045524647 /nfs/dbraw/zinc/52/46/47/1045524647.db2.gz FXNQWHPIHPBIBZ-UHFFFAOYSA-N 1 2 305.425 4.344 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)[nH]c1C ZINC000628130618 1045524656 /nfs/dbraw/zinc/52/46/56/1045524656.db2.gz FXNQWHPIHPBIBZ-UHFFFAOYSA-N 1 2 305.425 4.344 20 0 DIADLO Cc1[nH]c(CN(Cc2ccc3ccccc3c2)C2CC2)[nH+]c1C ZINC000628130618 1045524667 /nfs/dbraw/zinc/52/46/67/1045524667.db2.gz FXNQWHPIHPBIBZ-UHFFFAOYSA-N 1 2 305.425 4.344 20 0 DIADLO CC[C@H]1c2ccccc2CN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001119768817 1045524619 /nfs/dbraw/zinc/52/46/19/1045524619.db2.gz JHOYBIJFLJEXFE-KRWDZBQOSA-N 1 2 320.396 4.142 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cnc(C3CC3)o2)C2CC2)o1 ZINC000628131293 1045527646 /nfs/dbraw/zinc/52/76/46/1045527646.db2.gz VXPAEULGFSDPKC-PXAZEXFGSA-N 1 2 312.413 4.433 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cnc(C3CC3)o2)C2CC2)o1 ZINC000628131293 1045527660 /nfs/dbraw/zinc/52/76/60/1045527660.db2.gz VXPAEULGFSDPKC-PXAZEXFGSA-N 1 2 312.413 4.433 20 0 DIADLO COc1cc(C[N@H+]2CC=C(C(F)(F)F)CC2)ccc1Cl ZINC000450627681 1045528778 /nfs/dbraw/zinc/52/87/78/1045528778.db2.gz UXOSHBYNEOBOLD-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO COc1cc(C[N@@H+]2CC=C(C(F)(F)F)CC2)ccc1Cl ZINC000450627681 1045528787 /nfs/dbraw/zinc/52/87/87/1045528787.db2.gz UXOSHBYNEOBOLD-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@@H](C)c2cccc(C(F)(F)F)c2)[nH]c1C ZINC000628133204 1045528681 /nfs/dbraw/zinc/52/86/81/1045528681.db2.gz WHTXCAXSRYEBEU-LBPRGKRZSA-N 1 2 311.351 4.238 20 0 DIADLO Cc1nc(C[N@H+](C)[C@@H](C)c2cccc(C(F)(F)F)c2)[nH]c1C ZINC000628133204 1045528688 /nfs/dbraw/zinc/52/86/88/1045528688.db2.gz WHTXCAXSRYEBEU-LBPRGKRZSA-N 1 2 311.351 4.238 20 0 DIADLO Cc1[nH]c(CN(C)[C@@H](C)c2cccc(C(F)(F)F)c2)[nH+]c1C ZINC000628133204 1045528701 /nfs/dbraw/zinc/52/87/01/1045528701.db2.gz WHTXCAXSRYEBEU-LBPRGKRZSA-N 1 2 311.351 4.238 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2csc(C(F)(F)F)c2)s1 ZINC000628148879 1045531256 /nfs/dbraw/zinc/53/12/56/1045531256.db2.gz CSARQMVLUOHUIN-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2csc(C(F)(F)F)c2)s1 ZINC000628148879 1045531264 /nfs/dbraw/zinc/53/12/64/1045531264.db2.gz CSARQMVLUOHUIN-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)cs1 ZINC001119964126 1045531674 /nfs/dbraw/zinc/53/16/74/1045531674.db2.gz WPDQHWPABSEBEH-ZDUSSCGKSA-N 1 2 318.490 4.114 20 0 DIADLO Cc1nc(C[N@H+]2CC=C(c3cccc4ccccc43)CC2)[nH]c1C ZINC000628157602 1045532515 /nfs/dbraw/zinc/53/25/15/1045532515.db2.gz NMHHKMFXGFQHGM-UHFFFAOYSA-N 1 2 317.436 4.469 20 0 DIADLO Cc1nc(C[N@@H+]2CC=C(c3cccc4ccccc43)CC2)[nH]c1C ZINC000628157602 1045532525 /nfs/dbraw/zinc/53/25/25/1045532525.db2.gz NMHHKMFXGFQHGM-UHFFFAOYSA-N 1 2 317.436 4.469 20 0 DIADLO COc1cccc(F)c1C[NH2+][C@H](C)c1cc(F)c(F)c(F)c1 ZINC001120366762 1045537206 /nfs/dbraw/zinc/53/72/06/1045537206.db2.gz XCPNCHLMSUESIX-SECBINFHSA-N 1 2 313.294 4.102 20 0 DIADLO CCC[N@H+](Cn1nc(C)sc1=S)[C@H]1CCc2ccccc21 ZINC000750600934 1045538688 /nfs/dbraw/zinc/53/86/88/1045538688.db2.gz DEQBHMQRJLIHOR-HNNXBMFYSA-N 1 2 319.499 4.340 20 0 DIADLO CCC[N@@H+](Cn1nc(C)sc1=S)[C@H]1CCc2ccccc21 ZINC000750600934 1045538698 /nfs/dbraw/zinc/53/86/98/1045538698.db2.gz DEQBHMQRJLIHOR-HNNXBMFYSA-N 1 2 319.499 4.340 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1oc(C)nc1C)c1ccccc1 ZINC000628213865 1045545255 /nfs/dbraw/zinc/54/52/55/1045545255.db2.gz BBUFNFMLOVNPHJ-HXUWFJFHSA-N 1 2 322.408 4.179 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc(C)c1F ZINC000450682818 1045546064 /nfs/dbraw/zinc/54/60/64/1045546064.db2.gz QVXQZMLLJYJXQJ-NSHDSACASA-N 1 2 305.422 4.022 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccc(F)cc1F ZINC000450674150 1045546458 /nfs/dbraw/zinc/54/64/58/1045546458.db2.gz AYLYBXDHNBFWNE-OAHLLOKOSA-N 1 2 323.412 4.181 20 0 DIADLO CC(C)C[C@H](C(=O)N1CCC[C@H]1C1CCCCC1)n1cc[nH+]c1 ZINC001626153673 1045560576 /nfs/dbraw/zinc/56/05/76/1045560576.db2.gz GNOBXNRTXQWATN-ZWKOTPCHSA-N 1 2 317.477 4.042 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[N@H+](C)Cc1cnc(C)o1 ZINC000628325845 1045567965 /nfs/dbraw/zinc/56/79/65/1045567965.db2.gz GZZDUSCNGSXSQU-HNNXBMFYSA-N 1 2 320.820 4.154 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[N@@H+](C)Cc1cnc(C)o1 ZINC000628325845 1045567973 /nfs/dbraw/zinc/56/79/73/1045567973.db2.gz GZZDUSCNGSXSQU-HNNXBMFYSA-N 1 2 320.820 4.154 20 0 DIADLO COCC[C@@H](Nc1cccc[nH+]1)c1cccc(C(F)(F)F)c1 ZINC000450799348 1045569181 /nfs/dbraw/zinc/56/91/81/1045569181.db2.gz AUPCGGRBOMOFNI-CQSZACIVSA-N 1 2 310.319 4.290 20 0 DIADLO Clc1cccc(Cl)c1CC[N@@H+]1CCc2ncsc2C1 ZINC000450828908 1045571685 /nfs/dbraw/zinc/57/16/85/1045571685.db2.gz ODNKHHSLUZCTFN-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO Clc1cccc(Cl)c1CC[N@H+]1CCc2ncsc2C1 ZINC000450828908 1045571688 /nfs/dbraw/zinc/57/16/88/1045571688.db2.gz ODNKHHSLUZCTFN-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc3nc(C)sc3c1)C2 ZINC000628463083 1045587181 /nfs/dbraw/zinc/58/71/81/1045587181.db2.gz RZARLGKHQYQZRS-UHFFFAOYSA-N 1 2 310.422 4.129 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc3nc(C)sc3c1)C2 ZINC000628463083 1045587189 /nfs/dbraw/zinc/58/71/89/1045587189.db2.gz RZARLGKHQYQZRS-UHFFFAOYSA-N 1 2 310.422 4.129 20 0 DIADLO C[C@@H]1C[C@]1([NH2+]Cc1nnc(C2CC2)s1)c1ccc(Cl)cc1 ZINC000450929645 1045592282 /nfs/dbraw/zinc/59/22/82/1045592282.db2.gz VBGJJQXDXCLIPI-QLJPJBMISA-N 1 2 319.861 4.094 20 0 DIADLO CC[C@H]1C[C@@]1([NH2+]Cc1nnc(C2CC2)s1)c1cccc(C)c1 ZINC000450924321 1045595384 /nfs/dbraw/zinc/59/53/84/1045595384.db2.gz UFEWFNLDDCGJPG-KSSFIOAISA-N 1 2 313.470 4.139 20 0 DIADLO CC(C)C[N@H+](Cc1cnns1)[C@@H](C)c1ccccc1Cl ZINC000450945958 1045597455 /nfs/dbraw/zinc/59/74/55/1045597455.db2.gz XJTRFAGVWQKOAX-LBPRGKRZSA-N 1 2 309.866 4.411 20 0 DIADLO CC(C)C[N@@H+](Cc1cnns1)[C@@H](C)c1ccccc1Cl ZINC000450945958 1045597467 /nfs/dbraw/zinc/59/74/67/1045597467.db2.gz XJTRFAGVWQKOAX-LBPRGKRZSA-N 1 2 309.866 4.411 20 0 DIADLO CC(C)C[N@H+](Cc1cnns1)[C@H](C)c1ccccc1Cl ZINC000450945955 1045597713 /nfs/dbraw/zinc/59/77/13/1045597713.db2.gz XJTRFAGVWQKOAX-GFCCVEGCSA-N 1 2 309.866 4.411 20 0 DIADLO CC(C)C[N@@H+](Cc1cnns1)[C@H](C)c1ccccc1Cl ZINC000450945955 1045597720 /nfs/dbraw/zinc/59/77/20/1045597720.db2.gz XJTRFAGVWQKOAX-GFCCVEGCSA-N 1 2 309.866 4.411 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C34CCC(CC3)C4)c2)[nH+]c1C ZINC000751441305 1045605419 /nfs/dbraw/zinc/60/54/19/1045605419.db2.gz CTNUOURCIABCKO-UHFFFAOYSA-N 1 2 309.413 4.212 20 0 DIADLO C[C@@H](OC(=O)CCc1ccc(N)[nH+]c1)c1cccc2ccccc21 ZINC000751441318 1045605428 /nfs/dbraw/zinc/60/54/28/1045605428.db2.gz DDYADJIIMWIRBQ-CQSZACIVSA-N 1 2 320.392 4.054 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+]1C[C@H](C)OC2(CCC2)C1 ZINC001460336581 1045606066 /nfs/dbraw/zinc/60/60/66/1045606066.db2.gz DBNBLEAHZVAPBD-STQMWFEESA-N 1 2 324.262 4.154 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+]1C[C@H](C)OC2(CCC2)C1 ZINC001460336581 1045606078 /nfs/dbraw/zinc/60/60/78/1045606078.db2.gz DBNBLEAHZVAPBD-STQMWFEESA-N 1 2 324.262 4.154 20 0 DIADLO Clc1cccc([C@@H]2CC[N@H+](Cc3nnc(C4CC4)s3)C2)c1 ZINC000451058877 1045619408 /nfs/dbraw/zinc/61/94/08/1045619408.db2.gz BGTSSPRTXRLZJN-CYBMUJFWSA-N 1 2 319.861 4.058 20 0 DIADLO Clc1cccc([C@@H]2CC[N@@H+](Cc3nnc(C4CC4)s3)C2)c1 ZINC000451058877 1045619412 /nfs/dbraw/zinc/61/94/12/1045619412.db2.gz BGTSSPRTXRLZJN-CYBMUJFWSA-N 1 2 319.861 4.058 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)s1 ZINC000451059015 1045620007 /nfs/dbraw/zinc/62/00/07/1045620007.db2.gz BRDPDDLHVLCLAF-ZDUSSCGKSA-N 1 2 321.877 4.304 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)s1 ZINC000451059015 1045620010 /nfs/dbraw/zinc/62/00/10/1045620010.db2.gz BRDPDDLHVLCLAF-ZDUSSCGKSA-N 1 2 321.877 4.304 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1cccc(CO)c1 ZINC000121544452 1045622145 /nfs/dbraw/zinc/62/21/45/1045622145.db2.gz LPTSERZBNIJJAX-KBXCAEBGSA-N 1 2 324.449 4.076 20 0 DIADLO Cc1cc(C)c(C(=O)N(C)Cc2c(F)cccc2Cl)c(C)[nH+]1 ZINC001124237431 1045625872 /nfs/dbraw/zinc/62/58/72/1045625872.db2.gz HPSIPHSBQMOXIM-UHFFFAOYSA-N 1 2 320.795 4.072 20 0 DIADLO CC[NH+](CC)[C@H](C(=O)Oc1ccccc1Cl)c1ccccc1 ZINC001124293069 1045643480 /nfs/dbraw/zinc/64/34/80/1045643480.db2.gz ZXKAYFIIYNAIAZ-KRWDZBQOSA-N 1 2 317.816 4.329 20 0 DIADLO Cc1cccc(C[N@@H+]2CCCC[C@@H]2C(=O)Oc2ccccc2C)c1 ZINC001124308082 1045646510 /nfs/dbraw/zinc/64/65/10/1045646510.db2.gz OITJVYOLIBCLLS-LJQANCHMSA-N 1 2 323.436 4.264 20 0 DIADLO Cc1cccc(C[N@H+]2CCCC[C@@H]2C(=O)Oc2ccccc2C)c1 ZINC001124308082 1045646518 /nfs/dbraw/zinc/64/65/18/1045646518.db2.gz OITJVYOLIBCLLS-LJQANCHMSA-N 1 2 323.436 4.264 20 0 DIADLO Cl/C=C/C[N@H+](Cc1csc(Br)c1)C1CC1 ZINC000752083669 1045656530 /nfs/dbraw/zinc/65/65/30/1045656530.db2.gz VHVZUVZDTHXZKE-DAFODLJHSA-N 1 2 306.656 4.228 20 0 DIADLO Cl/C=C/C[N@@H+](Cc1csc(Br)c1)C1CC1 ZINC000752083669 1045656537 /nfs/dbraw/zinc/65/65/37/1045656537.db2.gz VHVZUVZDTHXZKE-DAFODLJHSA-N 1 2 306.656 4.228 20 0 DIADLO C[NH2+]c1ccc(NCc2ccc(OCC(F)(F)F)cc2)cc1 ZINC000629389316 1045665061 /nfs/dbraw/zinc/66/50/61/1045665061.db2.gz JJOKSGIAVXVHGS-UHFFFAOYSA-N 1 2 310.319 4.282 20 0 DIADLO C[NH2+]c1ccc(NCc2cc(OC)c(OC)cc2SC)cc1 ZINC000629388246 1045665316 /nfs/dbraw/zinc/66/53/16/1045665316.db2.gz LNDFKRKUJITYCV-UHFFFAOYSA-N 1 2 318.442 4.080 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)o1 ZINC000451360474 1045671321 /nfs/dbraw/zinc/67/13/21/1045671321.db2.gz YKKMPISIZLVOLH-BJOHPYRUSA-N 1 2 323.799 4.226 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+][C@@H]2CCC[C@@H]2CCCF)cc1 ZINC000800982166 1045676152 /nfs/dbraw/zinc/67/61/52/1045676152.db2.gz OLGLXGKHWSKBQH-GPMSIDNRSA-N 1 2 320.452 4.242 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3ccc(Br)o3)ccc21 ZINC000191413469 1045697471 /nfs/dbraw/zinc/69/74/71/1045697471.db2.gz ZTWIFZBWQMRRDM-UHFFFAOYSA-N 1 2 321.218 4.037 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3ccc(Br)o3)ccc21 ZINC000191413469 1045697481 /nfs/dbraw/zinc/69/74/81/1045697481.db2.gz ZTWIFZBWQMRRDM-UHFFFAOYSA-N 1 2 321.218 4.037 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NCCc2ccc3ccccc3n2)c1 ZINC000530693636 1045709649 /nfs/dbraw/zinc/70/96/49/1045709649.db2.gz IPXNJTTYQBRXHN-UHFFFAOYSA-N 1 2 317.314 4.303 20 0 DIADLO COc1ccc(C[NH+](Cc2ccco2)Cc2ccco2)c(C)c1 ZINC000752857502 1045710701 /nfs/dbraw/zinc/71/07/01/1045710701.db2.gz WCWQQKOGGIZXRS-UHFFFAOYSA-N 1 2 311.381 4.392 20 0 DIADLO N#CCC[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1ccccc1 ZINC000191460947 1045712524 /nfs/dbraw/zinc/71/25/24/1045712524.db2.gz JADSCEGVLDEFCL-OAHLLOKOSA-N 1 2 318.779 4.319 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCC[C@@H]3c3ccccn3)cs2)co1 ZINC000530724452 1045718845 /nfs/dbraw/zinc/71/88/45/1045718845.db2.gz MHDAJGJPZGAHLQ-MRXNPFEDSA-N 1 2 311.410 4.135 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCC[C@@H]3c3ccccn3)cs2)co1 ZINC000530724452 1045718861 /nfs/dbraw/zinc/71/88/61/1045718861.db2.gz MHDAJGJPZGAHLQ-MRXNPFEDSA-N 1 2 311.410 4.135 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2cscc2Br)n1 ZINC000304527512 1045724336 /nfs/dbraw/zinc/72/43/36/1045724336.db2.gz GGPBYVMILQGNHF-QMMMGPOBSA-N 1 2 317.277 4.126 20 0 DIADLO Oc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)nc2Cl)cc1 ZINC000801520992 1045728431 /nfs/dbraw/zinc/72/84/31/1045728431.db2.gz DIJJSNLIRUDSDT-CQSZACIVSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)nc2Cl)cc1 ZINC000801520992 1045728447 /nfs/dbraw/zinc/72/84/47/1045728447.db2.gz DIJJSNLIRUDSDT-CQSZACIVSA-N 1 2 323.223 4.431 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(Cl)nc1Cl)c1nccs1 ZINC000801539974 1045733393 /nfs/dbraw/zinc/73/33/93/1045733393.db2.gz SASLOJFTCJWCGP-SECBINFHSA-N 1 2 302.230 4.086 20 0 DIADLO Cc1ncc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3[nH]2)s1 ZINC000451881335 1045739546 /nfs/dbraw/zinc/73/95/46/1045739546.db2.gz YDVYCWUHMRAZLB-INIZCTEOSA-N 1 2 312.442 4.055 20 0 DIADLO Cc1ncc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3[nH]2)s1 ZINC000451881335 1045739560 /nfs/dbraw/zinc/73/95/60/1045739560.db2.gz YDVYCWUHMRAZLB-INIZCTEOSA-N 1 2 312.442 4.055 20 0 DIADLO CCCCCC(C)(C)C(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000753326165 1045746963 /nfs/dbraw/zinc/74/69/63/1045746963.db2.gz DMSGWCAGZXGGFD-UHFFFAOYSA-N 1 2 313.445 4.095 20 0 DIADLO Cc1ccc(-c2noc(C[N@H+]3C[C@@H](C)[C@H]3c3ccccc3)n2)cc1 ZINC000530902650 1045748181 /nfs/dbraw/zinc/74/81/81/1045748181.db2.gz PQTVLNHVKDZMFR-BEFAXECRSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccc(-c2noc(C[N@@H+]3C[C@@H](C)[C@H]3c3ccccc3)n2)cc1 ZINC000530902650 1045748194 /nfs/dbraw/zinc/74/81/94/1045748194.db2.gz PQTVLNHVKDZMFR-BEFAXECRSA-N 1 2 319.408 4.238 20 0 DIADLO FC(F)(F)[C@H]1CC[N@H+](C/C(Cl)=C\Cl)CC12CCC2 ZINC000801590320 1045748933 /nfs/dbraw/zinc/74/89/33/1045748933.db2.gz IWOGYMJKOKABST-ZKXNXJMVSA-N 1 2 302.167 4.360 20 0 DIADLO FC(F)(F)[C@H]1CC[N@@H+](C/C(Cl)=C\Cl)CC12CCC2 ZINC000801590320 1045748946 /nfs/dbraw/zinc/74/89/46/1045748946.db2.gz IWOGYMJKOKABST-ZKXNXJMVSA-N 1 2 302.167 4.360 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)c(F)c(F)c(F)c1F)c1ccccc1 ZINC000753344902 1045749504 /nfs/dbraw/zinc/74/95/04/1045749504.db2.gz YFIZFVLWFASPPI-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO FC(F)(F)[C@H]1CC[N@H+](C/C(Cl)=C/Cl)CC12CCC2 ZINC000801590318 1045750022 /nfs/dbraw/zinc/75/00/22/1045750022.db2.gz IWOGYMJKOKABST-MBACFSSFSA-N 1 2 302.167 4.360 20 0 DIADLO FC(F)(F)[C@H]1CC[N@@H+](C/C(Cl)=C/Cl)CC12CCC2 ZINC000801590318 1045750037 /nfs/dbraw/zinc/75/00/37/1045750037.db2.gz IWOGYMJKOKABST-MBACFSSFSA-N 1 2 302.167 4.360 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@H+](C/C(Cl)=C/Cl)CC12CCC2 ZINC000801590306 1045750553 /nfs/dbraw/zinc/75/05/53/1045750553.db2.gz IWOGYMJKOKABST-ABRRARGCSA-N 1 2 302.167 4.360 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@@H+](C/C(Cl)=C/Cl)CC12CCC2 ZINC000801590306 1045750571 /nfs/dbraw/zinc/75/05/71/1045750571.db2.gz IWOGYMJKOKABST-ABRRARGCSA-N 1 2 302.167 4.360 20 0 DIADLO FC(F)C(F)(F)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000801601181 1045751942 /nfs/dbraw/zinc/75/19/42/1045751942.db2.gz BPFNSEBBJDSZJM-BTTYYORXSA-N 1 2 301.327 4.297 20 0 DIADLO FC(F)C(F)(F)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000801601181 1045751949 /nfs/dbraw/zinc/75/19/49/1045751949.db2.gz BPFNSEBBJDSZJM-BTTYYORXSA-N 1 2 301.327 4.297 20 0 DIADLO Brc1cc(C[N@@H+]2CCC[C@@H]2c2ccccn2)cs1 ZINC000530962392 1045760897 /nfs/dbraw/zinc/76/08/97/1045760897.db2.gz YQRRTGDUAURFRA-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cc(C[N@H+]2CCC[C@@H]2c2ccccn2)cs1 ZINC000530962392 1045760908 /nfs/dbraw/zinc/76/09/08/1045760908.db2.gz YQRRTGDUAURFRA-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cc(C[N@@H+]2CCC[C@H]2c2ccccn2)cs1 ZINC000530962393 1045761996 /nfs/dbraw/zinc/76/19/96/1045761996.db2.gz YQRRTGDUAURFRA-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cc(C[N@H+]2CCC[C@H]2c2ccccn2)cs1 ZINC000530962393 1045762006 /nfs/dbraw/zinc/76/20/06/1045762006.db2.gz YQRRTGDUAURFRA-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO CC(C)[N@H+](Cc1noc(Cc2ccccc2)n1)C1CC(C)(C)C1 ZINC000452101398 1045768641 /nfs/dbraw/zinc/76/86/41/1045768641.db2.gz GKUPUCFWKDCIIB-UHFFFAOYSA-N 1 2 313.445 4.059 20 0 DIADLO CC(C)[N@@H+](Cc1noc(Cc2ccccc2)n1)C1CC(C)(C)C1 ZINC000452101398 1045768653 /nfs/dbraw/zinc/76/86/53/1045768653.db2.gz GKUPUCFWKDCIIB-UHFFFAOYSA-N 1 2 313.445 4.059 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)/C=C3/CC[C@@H](C)C3)c2)[nH+]c1C ZINC000753590786 1045769899 /nfs/dbraw/zinc/76/98/99/1045769899.db2.gz DSUACHZVWKXUAO-DYTQJMLRSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C=C3CC[C@@H](C)C3)c2)[nH+]c1C ZINC000753590786 1045769916 /nfs/dbraw/zinc/76/99/16/1045769916.db2.gz DSUACHZVWKXUAO-DYTQJMLRSA-N 1 2 309.413 4.378 20 0 DIADLO Brc1ccc([C@H]2CCC[N@@H+]2Cc2ccoc2)s1 ZINC000753591336 1045769957 /nfs/dbraw/zinc/76/99/57/1045769957.db2.gz QPUDTTQCFXMLAR-LLVKDONJSA-N 1 2 312.232 4.441 20 0 DIADLO Brc1ccc([C@H]2CCC[N@H+]2Cc2ccoc2)s1 ZINC000753591336 1045769972 /nfs/dbraw/zinc/76/99/72/1045769972.db2.gz QPUDTTQCFXMLAR-LLVKDONJSA-N 1 2 312.232 4.441 20 0 DIADLO CCOc1ccc([C@@H]2CCC[N@@H+]2Cn2ncc(Cl)c2C)cc1 ZINC000753790532 1045802665 /nfs/dbraw/zinc/80/26/65/1045802665.db2.gz QBMUNNSAESNMKE-KRWDZBQOSA-N 1 2 319.836 4.038 20 0 DIADLO CCOc1ccc([C@@H]2CCC[N@H+]2Cn2ncc(Cl)c2C)cc1 ZINC000753790532 1045802685 /nfs/dbraw/zinc/80/26/85/1045802685.db2.gz QBMUNNSAESNMKE-KRWDZBQOSA-N 1 2 319.836 4.038 20 0 DIADLO c1ccc2cc(N[C@H]3CCOC4(CCSCC4)C3)[nH+]cc2c1 ZINC000631173746 1045827787 /nfs/dbraw/zinc/82/77/87/1045827787.db2.gz RGPCZARYSPICHJ-INIZCTEOSA-N 1 2 314.454 4.092 20 0 DIADLO Cc1cnc(C[NH2+][C@H](CCc2ccccc2)c2ccccn2)s1 ZINC000631201133 1045834351 /nfs/dbraw/zinc/83/43/51/1045834351.db2.gz VJWKTCKDOLFBCS-GOSISDBHSA-N 1 2 323.465 4.310 20 0 DIADLO FC[C@H]([NH2+]Cc1cnc(C2CCC2)s1)c1ccc(F)cc1 ZINC000631282492 1045845297 /nfs/dbraw/zinc/84/52/97/1045845297.db2.gz BMYCMVJPTRJECM-HNNXBMFYSA-N 1 2 308.397 4.350 20 0 DIADLO CCOc1cc(C[NH2+][C@@H](CF)c2ccc(F)cc2)ccc1OC ZINC000631280646 1045845581 /nfs/dbraw/zinc/84/55/81/1045845581.db2.gz UHXDVIXLANPEOV-INIZCTEOSA-N 1 2 321.367 4.033 20 0 DIADLO CC1(C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)CC=CC1 ZINC001125120229 1045856301 /nfs/dbraw/zinc/85/63/01/1045856301.db2.gz LAVJSIXJVOVKBQ-UHFFFAOYSA-N 1 2 321.424 4.181 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1occc1Br ZINC000754152910 1045856675 /nfs/dbraw/zinc/85/66/75/1045856675.db2.gz AIMHDYFXZDRMGM-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1occc1Br ZINC000754152910 1045856689 /nfs/dbraw/zinc/85/66/89/1045856689.db2.gz AIMHDYFXZDRMGM-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(Cl)cncc2Cl)CCC1(F)F ZINC001137604472 1045903700 /nfs/dbraw/zinc/90/37/00/1045903700.db2.gz UCZYUXLYFNYMQE-SECBINFHSA-N 1 2 309.187 4.256 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(Cl)cncc2Cl)CCC1(F)F ZINC001137604472 1045903705 /nfs/dbraw/zinc/90/37/05/1045903705.db2.gz UCZYUXLYFNYMQE-SECBINFHSA-N 1 2 309.187 4.256 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1ccc(Cl)s1 ZINC000754331950 1045876177 /nfs/dbraw/zinc/87/61/77/1045876177.db2.gz CFWMDMIMKDOGBT-SECBINFHSA-N 1 2 313.854 4.323 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1csc(C)n1)c1cccc(OC)c1OC ZINC000631583415 1045876766 /nfs/dbraw/zinc/87/67/66/1045876766.db2.gz XCYPGXKMYJLUQW-SMDDNHRTSA-N 1 2 320.458 4.271 20 0 DIADLO CCc1ccc(C[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)o1 ZINC000531612086 1045880755 /nfs/dbraw/zinc/88/07/55/1045880755.db2.gz YUJNKTQZKYPAQN-ZDUSSCGKSA-N 1 2 312.196 4.372 20 0 DIADLO CCC[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1cc(C)ccn1 ZINC000631600016 1045883098 /nfs/dbraw/zinc/88/30/98/1045883098.db2.gz AFHFVBPKIWYCHQ-AWEZNQCLSA-N 1 2 301.459 4.355 20 0 DIADLO COc1cc(C[NH2+]C(c2cccc(C)c2)c2cccc(C)c2)on1 ZINC000902009106 1045887469 /nfs/dbraw/zinc/88/74/69/1045887469.db2.gz UYTWYTZJWQQFLJ-UHFFFAOYSA-N 1 2 322.408 4.179 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(C2CCC2)cc1 ZINC000631632687 1045893126 /nfs/dbraw/zinc/89/31/26/1045893126.db2.gz SHBRFKSDAYMJBN-GFCCVEGCSA-N 1 2 303.837 4.192 20 0 DIADLO Clc1nc(C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)cs1 ZINC000828150235 1045894473 /nfs/dbraw/zinc/89/44/73/1045894473.db2.gz CYPXRKDBRVESQK-OAHLLOKOSA-N 1 2 304.846 4.448 20 0 DIADLO Clc1nc(C[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)cs1 ZINC000828150235 1045894493 /nfs/dbraw/zinc/89/44/93/1045894493.db2.gz CYPXRKDBRVESQK-OAHLLOKOSA-N 1 2 304.846 4.448 20 0 DIADLO C[C@H](CC(=O)OCc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000754494682 1045894983 /nfs/dbraw/zinc/89/49/83/1045894983.db2.gz ZLGKIXTYRKAAPK-MRXNPFEDSA-N 1 2 320.392 4.109 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@@H](C)c3ccc(F)cc3)cc2[nH+]1 ZINC000531686619 1045896802 /nfs/dbraw/zinc/89/68/02/1045896802.db2.gz QCPYQYNSVTWLRM-LLVKDONJSA-N 1 2 311.360 4.143 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](CCc2ccccc2)c2ccccn2)no1 ZINC000631672281 1045903336 /nfs/dbraw/zinc/90/33/36/1045903336.db2.gz HDIYWWGMFJIOSK-APWZRJJASA-N 1 2 321.424 4.403 20 0 DIADLO Clc1cccc([C@H]2CC[N@H+](Cc3cscn3)C2)c1Cl ZINC001137596227 1045904294 /nfs/dbraw/zinc/90/42/94/1045904294.db2.gz MSEPONRRGPGAEI-JTQLQIEISA-N 1 2 313.253 4.439 20 0 DIADLO Clc1cccc([C@H]2CC[N@@H+](Cc3cscn3)C2)c1Cl ZINC001137596227 1045904299 /nfs/dbraw/zinc/90/42/99/1045904299.db2.gz MSEPONRRGPGAEI-JTQLQIEISA-N 1 2 313.253 4.439 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+]1CCOC2(CCCC2)C1 ZINC000531733467 1045908578 /nfs/dbraw/zinc/90/85/78/1045908578.db2.gz UIVKASGHMHTGEN-CYBMUJFWSA-N 1 2 324.262 4.155 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+]1CCOC2(CCCC2)C1 ZINC000531733467 1045908585 /nfs/dbraw/zinc/90/85/85/1045908585.db2.gz UIVKASGHMHTGEN-CYBMUJFWSA-N 1 2 324.262 4.155 20 0 DIADLO Oc1cccc2c1CCC[C@@H]2[NH2+][C@H](CF)c1ccc(F)cc1 ZINC000631798180 1045919082 /nfs/dbraw/zinc/91/90/82/1045919082.db2.gz OBZPXIWVMUVODF-DLBZAZTESA-N 1 2 303.352 4.209 20 0 DIADLO Fc1cc(C[N@@H+]2CC[C@@H]2COCc2ccccc2)ccc1Cl ZINC001137653374 1045919519 /nfs/dbraw/zinc/91/95/19/1045919519.db2.gz LXWPBHFXCHQDAS-MRXNPFEDSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1cc(C[N@H+]2CC[C@@H]2COCc2ccccc2)ccc1Cl ZINC001137653374 1045919526 /nfs/dbraw/zinc/91/95/26/1045919526.db2.gz LXWPBHFXCHQDAS-MRXNPFEDSA-N 1 2 319.807 4.270 20 0 DIADLO COc1ccc(OC)c([C@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)c1 ZINC000631795141 1045919999 /nfs/dbraw/zinc/91/99/99/1045919999.db2.gz GPIMCTMPYQJCHR-SJCJKPOMSA-N 1 2 321.367 4.204 20 0 DIADLO Oc1ccc2c(c1)[C@@H]([NH2+][C@H](CF)c1ccc(F)cc1)CCC2 ZINC000631798415 1045920651 /nfs/dbraw/zinc/92/06/51/1045920651.db2.gz SEJYHTNGYUSBJV-ZWKOTPCHSA-N 1 2 303.352 4.209 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)ccc1F ZINC000631798426 1045920867 /nfs/dbraw/zinc/92/08/67/1045920867.db2.gz SLHPHKVNWUIYGB-BZNIZROVSA-N 1 2 309.331 4.335 20 0 DIADLO COc1cccc2c1CC[N@H+](Cc1ccc(Cl)c(F)c1)C2 ZINC001137655258 1045921828 /nfs/dbraw/zinc/92/18/28/1045921828.db2.gz DEZDSSXMWZZRPP-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc2c1CC[N@@H+](Cc1ccc(Cl)c(F)c1)C2 ZINC001137655258 1045921836 /nfs/dbraw/zinc/92/18/36/1045921836.db2.gz DEZDSSXMWZZRPP-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CC(C)CC[N@H+](Cn1nc(C2CC2)n(C2CC2)c1=S)C1CC1 ZINC000192767241 1045930203 /nfs/dbraw/zinc/93/02/03/1045930203.db2.gz DVCHHRLRFLGXCY-UHFFFAOYSA-N 1 2 320.506 4.094 20 0 DIADLO CC(C)CC[N@@H+](Cn1nc(C2CC2)n(C2CC2)c1=S)C1CC1 ZINC000192767241 1045930210 /nfs/dbraw/zinc/93/02/10/1045930210.db2.gz DVCHHRLRFLGXCY-UHFFFAOYSA-N 1 2 320.506 4.094 20 0 DIADLO CCC[C@H]([NH2+][C@H](C)c1nccn1CC)c1ccc(F)cc1F ZINC000453146178 1045949653 /nfs/dbraw/zinc/94/96/53/1045949653.db2.gz SQTILCAMPLDRET-WBMJQRKESA-N 1 2 307.388 4.373 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cccnc2Br)cc1C ZINC001137801444 1045968513 /nfs/dbraw/zinc/96/85/13/1045968513.db2.gz CGNMUXABZZCDDT-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cccnc2Br)cc1C ZINC001137801444 1045968518 /nfs/dbraw/zinc/96/85/18/1045968518.db2.gz CGNMUXABZZCDDT-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H](F)C2)c(Br)c1 ZINC001137802936 1045970991 /nfs/dbraw/zinc/97/09/91/1045970991.db2.gz QDAGIRVWABGIGX-ZDUSSCGKSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H](F)C2)c(Br)c1 ZINC001137802936 1045971006 /nfs/dbraw/zinc/97/10/06/1045971006.db2.gz QDAGIRVWABGIGX-ZDUSSCGKSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccsc2)c(Br)c1 ZINC001137807373 1045971092 /nfs/dbraw/zinc/97/10/92/1045971092.db2.gz VXVGNYOKEPWORN-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccsc2)c(Br)c1 ZINC001137807373 1045971104 /nfs/dbraw/zinc/97/11/04/1045971104.db2.gz VXVGNYOKEPWORN-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO C[C@]1(c2ccc(F)cc2)CC[N@H+](Cc2csc(Cl)n2)C1 ZINC000829391036 1045972211 /nfs/dbraw/zinc/97/22/11/1045972211.db2.gz UUXRKLCPUFXZKO-HNNXBMFYSA-N 1 2 310.825 4.099 20 0 DIADLO C[C@]1(c2ccc(F)cc2)CC[N@@H+](Cc2csc(Cl)n2)C1 ZINC000829391036 1045972229 /nfs/dbraw/zinc/97/22/29/1045972229.db2.gz UUXRKLCPUFXZKO-HNNXBMFYSA-N 1 2 310.825 4.099 20 0 DIADLO CCn1cnc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)c1 ZINC000902313735 1045973101 /nfs/dbraw/zinc/97/31/01/1045973101.db2.gz SWHKZQFPDVYUNH-INIZCTEOSA-N 1 2 307.388 4.058 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C/c2ccc(Cl)s2)c(C)[nH+]1 ZINC000193183401 1045974947 /nfs/dbraw/zinc/97/49/47/1045974947.db2.gz UNYBMIWBJDFRNO-FNORWQNLSA-N 1 2 306.818 4.374 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1ccc2c(c1)OCCCO2 ZINC000193202714 1045978355 /nfs/dbraw/zinc/97/83/55/1045978355.db2.gz AUAINEQQVPNPLL-AWEZNQCLSA-N 1 2 312.413 4.087 20 0 DIADLO C[NH+](C)c1ccc(N[C@H](c2ccccc2)c2ccccn2)cc1 ZINC000193202656 1045979549 /nfs/dbraw/zinc/97/95/49/1045979549.db2.gz UPZKHMWRDCFQJW-HXUWFJFHSA-N 1 2 303.409 4.349 20 0 DIADLO C[C@H]1CC[C@@H]([NH2+]Cc2ncn(-c3ccccc3)n2)c2sccc21 ZINC000453214596 1045985681 /nfs/dbraw/zinc/98/56/81/1045985681.db2.gz BWKVIIAHSHCKPI-XJKSGUPXSA-N 1 2 324.453 4.057 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001137881458 1045996836 /nfs/dbraw/zinc/99/68/36/1045996836.db2.gz RFJGTRGPCQGZCV-CYBMUJFWSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001137881458 1045996844 /nfs/dbraw/zinc/99/68/44/1045996844.db2.gz RFJGTRGPCQGZCV-CYBMUJFWSA-N 1 2 323.770 4.272 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cc(F)c(F)cc1F ZINC001137892053 1046002923 /nfs/dbraw/zinc/00/29/23/1046002923.db2.gz FSJUOWUZBYOSCG-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1cc(F)c(F)cc1F ZINC001137892053 1046002941 /nfs/dbraw/zinc/00/29/41/1046002941.db2.gz FSJUOWUZBYOSCG-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO Cc1ccc2nc(Cl)c(C[NH+]3CC4(C3)CC(F)(F)C4)cc2c1 ZINC001137918892 1046015578 /nfs/dbraw/zinc/01/55/78/1046015578.db2.gz TYTAIFPIDJVZJF-UHFFFAOYSA-N 1 2 322.786 4.428 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1c(F)ccc(F)c1F)CCC2 ZINC001137933316 1046022220 /nfs/dbraw/zinc/02/22/20/1046022220.db2.gz BHVCWIFLOFWTJO-UHFFFAOYSA-N 1 2 321.342 4.061 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1c(F)ccc(F)c1F)CCC2 ZINC001137933316 1046022233 /nfs/dbraw/zinc/02/22/33/1046022233.db2.gz BHVCWIFLOFWTJO-UHFFFAOYSA-N 1 2 321.342 4.061 20 0 DIADLO Fc1ccc(C[NH+]2CCC(Oc3ccccc3)CC2)c(F)c1F ZINC001137934861 1046022778 /nfs/dbraw/zinc/02/27/78/1046022778.db2.gz RBLUFYYYOPCCPA-UHFFFAOYSA-N 1 2 321.342 4.147 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc(F)c(F)c1F ZINC001137939010 1046026365 /nfs/dbraw/zinc/02/63/65/1046026365.db2.gz DYYPFKIHBIOUHX-OAHLLOKOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc(F)c(F)c1F ZINC001137939010 1046026379 /nfs/dbraw/zinc/02/63/79/1046026379.db2.gz DYYPFKIHBIOUHX-OAHLLOKOSA-N 1 2 321.342 4.450 20 0 DIADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc(SC(F)(F)F)cc1 ZINC001137956439 1046033804 /nfs/dbraw/zinc/03/38/04/1046033804.db2.gz OAEPOJFPXNPALU-AWEZNQCLSA-N 1 2 317.376 4.242 20 0 DIADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc(SC(F)(F)F)cc1 ZINC001137956439 1046033820 /nfs/dbraw/zinc/03/38/20/1046033820.db2.gz OAEPOJFPXNPALU-AWEZNQCLSA-N 1 2 317.376 4.242 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000453327611 1046040140 /nfs/dbraw/zinc/04/01/40/1046040140.db2.gz WGZBCHWBXDQMHU-CYBMUJFWSA-N 1 2 321.852 4.103 20 0 DIADLO Fc1c(Cl)ccc(C(F)(F)F)c1C[NH+]1CC2CC(C2)C1 ZINC001137985662 1046045710 /nfs/dbraw/zinc/04/57/10/1046045710.db2.gz WDCFTEQNTZHCKV-UHFFFAOYSA-N 1 2 307.718 4.340 20 0 DIADLO Fc1c(Cl)cc(C(F)(F)F)cc1C[NH+]1CC2CC(C2)C1 ZINC001137990389 1046046422 /nfs/dbraw/zinc/04/64/22/1046046422.db2.gz NKSQEPDPDNFCOW-UHFFFAOYSA-N 1 2 307.718 4.340 20 0 DIADLO CC(C)[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1cc(F)ccc1F ZINC000453347708 1046049843 /nfs/dbraw/zinc/04/98/43/1046049843.db2.gz KXZMUQHKYLIGJW-RLCCDNCMSA-N 1 2 305.372 4.154 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(F)ccc(F)c2Cl)CCC1(F)F ZINC001137999819 1046052081 /nfs/dbraw/zinc/05/20/81/1046052081.db2.gz ZUDZKSMTLOOYSA-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(F)ccc(F)c2Cl)CCC1(F)F ZINC001137999819 1046052096 /nfs/dbraw/zinc/05/20/96/1046052096.db2.gz ZUDZKSMTLOOYSA-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO CCCc1ncc(C[NH2+][C@@H](C)c2ccccc2Br)o1 ZINC000453352141 1046053880 /nfs/dbraw/zinc/05/38/80/1046053880.db2.gz CGPAVYXVLHOSJV-NSHDSACASA-N 1 2 323.234 4.240 20 0 DIADLO Fc1c(C[N@H+]2CCC[C@@H](C(F)F)C2)cccc1C(F)(F)F ZINC001138011482 1046054711 /nfs/dbraw/zinc/05/47/11/1046054711.db2.gz VUWQNHKLKQUFQN-SNVBAGLBSA-N 1 2 311.269 4.322 20 0 DIADLO Fc1c(C[N@@H+]2CCC[C@@H](C(F)F)C2)cccc1C(F)(F)F ZINC001138011482 1046054725 /nfs/dbraw/zinc/05/47/25/1046054725.db2.gz VUWQNHKLKQUFQN-SNVBAGLBSA-N 1 2 311.269 4.322 20 0 DIADLO CC1(C)CC(C(=O)Oc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C1 ZINC000802844299 1046058901 /nfs/dbraw/zinc/05/89/01/1046058901.db2.gz WBFLPAKXQQXVTC-UHFFFAOYSA-N 1 2 324.424 4.228 20 0 DIADLO Cc1ccc(C(F)(F)C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000779770440 1046059343 /nfs/dbraw/zinc/05/93/43/1046059343.db2.gz CPXWJYLEPOPYNC-UHFFFAOYSA-N 1 2 304.340 4.046 20 0 DIADLO CCCc1ncc(C[NH2+][C@@H](C)c2cc(Cl)ccc2OC)o1 ZINC000453388200 1046063132 /nfs/dbraw/zinc/06/31/32/1046063132.db2.gz PCKJDSOJFALODR-NSHDSACASA-N 1 2 308.809 4.140 20 0 DIADLO CC[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1cc(Cl)ccc1OC ZINC000453361288 1046063505 /nfs/dbraw/zinc/06/35/05/1046063505.db2.gz QUAJKQKHVQNLCO-TUKIKUTGSA-N 1 2 319.836 4.292 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c32)c2nccn21 ZINC000453370642 1046070786 /nfs/dbraw/zinc/07/07/86/1046070786.db2.gz VPLJPWHYLJZVFR-OWYVNGRQSA-N 1 2 322.239 4.473 20 0 DIADLO CCCn1cc([C@@H](C)[NH2+][C@@H](c2ccccc2Cl)C(C)C)nn1 ZINC000902807074 1046074347 /nfs/dbraw/zinc/07/43/47/1046074347.db2.gz VLNLOQIMKXIBPB-CXAGYDPISA-N 1 2 320.868 4.389 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@H](c2nccs2)c2ccccc2)c(C)n1 ZINC000634564662 1046076409 /nfs/dbraw/zinc/07/64/09/1046076409.db2.gz YNDCDTNCCNWTLJ-SFHVURJKSA-N 1 2 323.465 4.343 20 0 DIADLO CCCC[C@@H]([NH2+]Cc1n[nH]cc1Br)c1ccccc1 ZINC000532224909 1046119043 /nfs/dbraw/zinc/11/90/43/1046119043.db2.gz FZQKKQHGWDBYFM-CQSZACIVSA-N 1 2 322.250 4.193 20 0 DIADLO c1csc([C@@H]2CCC[N@H+]2Cc2ccc(N3CCCCC3)o2)n1 ZINC001138176949 1046111774 /nfs/dbraw/zinc/11/17/74/1046111774.db2.gz AFWYCEFQRWZWIF-HNNXBMFYSA-N 1 2 317.458 4.064 20 0 DIADLO c1csc([C@@H]2CCC[N@@H+]2Cc2ccc(N3CCCCC3)o2)n1 ZINC001138176949 1046111779 /nfs/dbraw/zinc/11/17/79/1046111779.db2.gz AFWYCEFQRWZWIF-HNNXBMFYSA-N 1 2 317.458 4.064 20 0 DIADLO C[N@H+](Cc1ccc(N2CCCCC2)o1)Cc1ccc(F)cc1F ZINC001138178741 1046114392 /nfs/dbraw/zinc/11/43/92/1046114392.db2.gz TZOCDEBREIIVSO-UHFFFAOYSA-N 1 2 320.383 4.180 20 0 DIADLO C[N@@H+](Cc1ccc(N2CCCCC2)o1)Cc1ccc(F)cc1F ZINC001138178741 1046114400 /nfs/dbraw/zinc/11/44/00/1046114400.db2.gz TZOCDEBREIIVSO-UHFFFAOYSA-N 1 2 320.383 4.180 20 0 DIADLO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1nc2ccc(C)cc2[nH]1 ZINC000532240766 1046124148 /nfs/dbraw/zinc/12/41/48/1046124148.db2.gz WKKMAYOTBUXFJT-AWEZNQCLSA-N 1 2 309.413 4.039 20 0 DIADLO COC(=O)c1sccc1C[N@@H+]1CCCCC[C@@H]1c1ccco1 ZINC000532291625 1046128560 /nfs/dbraw/zinc/12/85/60/1046128560.db2.gz NTKXOTBJNXULOE-CQSZACIVSA-N 1 2 319.426 4.245 20 0 DIADLO COC(=O)c1sccc1C[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000532291625 1046128566 /nfs/dbraw/zinc/12/85/66/1046128566.db2.gz NTKXOTBJNXULOE-CQSZACIVSA-N 1 2 319.426 4.245 20 0 DIADLO CCc1csc(NCc2cc[nH+]c(N3CCCCCC3)c2)n1 ZINC000756962896 1046155923 /nfs/dbraw/zinc/15/59/23/1046155923.db2.gz PULIDQNWEYWKTH-UHFFFAOYSA-N 1 2 316.474 4.093 20 0 DIADLO COc1ccc(F)cc1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001138373540 1046159986 /nfs/dbraw/zinc/15/99/86/1046159986.db2.gz FHLUELRLOPWWQJ-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)cc1C[N@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001138373540 1046159992 /nfs/dbraw/zinc/15/99/92/1046159992.db2.gz FHLUELRLOPWWQJ-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc2c(cc1OC)C[NH+](Cc1[nH]c3ccccc3c1C)C2 ZINC001138401354 1046164306 /nfs/dbraw/zinc/16/43/06/1046164306.db2.gz NRHRWSKPQCNCHR-UHFFFAOYSA-N 1 2 322.408 4.009 20 0 DIADLO Cc1c2cc(F)ccc2[nH]c1C[N@@H+]1CCC[C@H]1c1nccs1 ZINC001138413969 1046171375 /nfs/dbraw/zinc/17/13/75/1046171375.db2.gz JSNFUKJQEDAISQ-INIZCTEOSA-N 1 2 315.417 4.409 20 0 DIADLO Cc1c2cc(F)ccc2[nH]c1C[N@H+]1CCC[C@H]1c1nccs1 ZINC001138413969 1046171379 /nfs/dbraw/zinc/17/13/79/1046171379.db2.gz JSNFUKJQEDAISQ-INIZCTEOSA-N 1 2 315.417 4.409 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1[nH]c3ccc(F)cc3c1C)C2 ZINC001138414111 1046171900 /nfs/dbraw/zinc/17/19/00/1046171900.db2.gz PMDZGXYKOBQFED-UHFFFAOYSA-N 1 2 310.372 4.140 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1[nH]c3ccc(F)cc3c1C)C2 ZINC001138414111 1046171908 /nfs/dbraw/zinc/17/19/08/1046171908.db2.gz PMDZGXYKOBQFED-UHFFFAOYSA-N 1 2 310.372 4.140 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+](C)Cc3cnc(Cl)s3)cc2c1 ZINC001138417826 1046172506 /nfs/dbraw/zinc/17/25/06/1046172506.db2.gz BRRLBFMAXODLPI-UHFFFAOYSA-N 1 2 305.834 4.218 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+](C)Cc3cnc(Cl)s3)cc2c1 ZINC001138417826 1046172510 /nfs/dbraw/zinc/17/25/10/1046172510.db2.gz BRRLBFMAXODLPI-UHFFFAOYSA-N 1 2 305.834 4.218 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CCc4cc(F)c(F)cc4C3)cc2c1 ZINC001138420678 1046174504 /nfs/dbraw/zinc/17/45/04/1046174504.db2.gz OOOWDQLGCFYPOM-UHFFFAOYSA-N 1 2 312.363 4.313 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CCc4cc(F)c(F)cc4C3)cc2c1 ZINC001138420678 1046174511 /nfs/dbraw/zinc/17/45/11/1046174511.db2.gz OOOWDQLGCFYPOM-UHFFFAOYSA-N 1 2 312.363 4.313 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000635077427 1046175480 /nfs/dbraw/zinc/17/54/80/1046175480.db2.gz IBXRVILOENBUKS-HNNXBMFYSA-N 1 2 305.809 4.071 20 0 DIADLO c1ccc([C@H](Nc2ccc(N3CCCCC3)[nH+]c2)C2CC2)nc1 ZINC000903147940 1046176062 /nfs/dbraw/zinc/17/60/62/1046176062.db2.gz VEYICMMTCXGGKF-LJQANCHMSA-N 1 2 308.429 4.030 20 0 DIADLO CCOc1ccc2ccccc2c1C[N@@H+]1CCc2oc(C)nc2C1 ZINC001138444971 1046184657 /nfs/dbraw/zinc/18/46/57/1046184657.db2.gz PDUJMBYBWGWRNN-UHFFFAOYSA-N 1 2 322.408 4.093 20 0 DIADLO CCOc1ccc2ccccc2c1C[N@H+]1CCc2oc(C)nc2C1 ZINC001138444971 1046184661 /nfs/dbraw/zinc/18/46/61/1046184661.db2.gz PDUJMBYBWGWRNN-UHFFFAOYSA-N 1 2 322.408 4.093 20 0 DIADLO CC(C)c1nc(C[N@H+](C)[C@@H](C)[C@H](C)c2ccc(Cl)cc2)no1 ZINC000475744951 1046193626 /nfs/dbraw/zinc/19/36/26/1046193626.db2.gz SNVJGFKXVNMKPE-STQMWFEESA-N 1 2 321.852 4.470 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)[C@@H](C)[C@H](C)c2ccc(Cl)cc2)no1 ZINC000475744951 1046193640 /nfs/dbraw/zinc/19/36/40/1046193640.db2.gz SNVJGFKXVNMKPE-STQMWFEESA-N 1 2 321.852 4.470 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3c(F)cccc3C2)cc1Cl ZINC001138475380 1046194206 /nfs/dbraw/zinc/19/42/06/1046194206.db2.gz NGEMESAQAIRGDH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(C[N@H+]2CCc3c(F)cccc3C2)cc1Cl ZINC001138475380 1046194211 /nfs/dbraw/zinc/19/42/11/1046194211.db2.gz NGEMESAQAIRGDH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CCOc1cc(C)ccc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000925261888 1046194960 /nfs/dbraw/zinc/19/49/60/1046194960.db2.gz JZXZQZDZFIXAPL-HXUWFJFHSA-N 1 2 310.441 4.420 20 0 DIADLO Cc1c(Cl)ccc(C[N@H+](C)Cc2cccc(=O)[nH]2)c1Cl ZINC000897391156 1046197557 /nfs/dbraw/zinc/19/75/57/1046197557.db2.gz GTVMWEPGDVZJDY-UHFFFAOYSA-N 1 2 311.212 4.034 20 0 DIADLO Cc1c(Cl)ccc(C[N@@H+](C)Cc2cccc(=O)[nH]2)c1Cl ZINC000897391156 1046197569 /nfs/dbraw/zinc/19/75/69/1046197569.db2.gz GTVMWEPGDVZJDY-UHFFFAOYSA-N 1 2 311.212 4.034 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1)[NH2+]CC(F)(F)c1ccccn1 ZINC001168155919 1046202541 /nfs/dbraw/zinc/20/25/41/1046202541.db2.gz IMGPVOXVUPZLJK-GFCCVEGCSA-N 1 2 310.775 4.048 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCOC[C@@H]2c2ccccc2)s1 ZINC001138523553 1046210971 /nfs/dbraw/zinc/21/09/71/1046210971.db2.gz IFSVULRQGFSWCX-GOSISDBHSA-N 1 2 301.455 4.274 20 0 DIADLO CCCc1ccc(C[N@H+]2CCOC[C@@H]2c2ccccc2)s1 ZINC001138523553 1046210984 /nfs/dbraw/zinc/21/09/84/1046210984.db2.gz IFSVULRQGFSWCX-GOSISDBHSA-N 1 2 301.455 4.274 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1ccccc1C(F)F)n1cc[nH+]c1 ZINC000636066065 1046214275 /nfs/dbraw/zinc/21/42/75/1046214275.db2.gz TUAPPGIZDBJNBB-AWEZNQCLSA-N 1 2 307.344 4.047 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1cc(Cl)ccc1C ZINC000102517540 1046216543 /nfs/dbraw/zinc/21/65/43/1046216543.db2.gz LLTARFYNWSXZNT-ZDUSSCGKSA-N 1 2 320.820 4.091 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1cc(Cl)ccc1C ZINC000102517540 1046216555 /nfs/dbraw/zinc/21/65/55/1046216555.db2.gz LLTARFYNWSXZNT-ZDUSSCGKSA-N 1 2 320.820 4.091 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cc(Cl)cs1 ZINC000760209601 1046222298 /nfs/dbraw/zinc/22/22/98/1046222298.db2.gz UGVNMRDFUWKLIZ-UHFFFAOYSA-N 1 2 303.774 4.044 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccc(C(C)(C)O)cc1 ZINC000903313342 1046234130 /nfs/dbraw/zinc/23/41/30/1046234130.db2.gz NVOVCOOHAMZLDW-CYBMUJFWSA-N 1 2 316.445 4.050 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1ccccc1N1CCCC1)C2 ZINC001138613670 1046240506 /nfs/dbraw/zinc/24/05/06/1046240506.db2.gz MCFXCAOOQPHHLE-UHFFFAOYSA-N 1 2 312.844 4.456 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1ccccc1N1CCCC1)C2 ZINC001138613670 1046240522 /nfs/dbraw/zinc/24/05/22/1046240522.db2.gz MCFXCAOOQPHHLE-UHFFFAOYSA-N 1 2 312.844 4.456 20 0 DIADLO CSc1ccc([C@H](C)[NH2+][C@@H](c2ncccn2)C2CC2)cc1F ZINC000903327767 1046240863 /nfs/dbraw/zinc/24/08/63/1046240863.db2.gz YNYUUMHBGMTPDZ-MEDUHNTESA-N 1 2 317.433 4.140 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ncccn1)C1CC1)c1ccc(Cl)c(F)c1 ZINC000903327626 1046240927 /nfs/dbraw/zinc/24/09/27/1046240927.db2.gz WUNJQNILBYDANY-MEBBXXQBSA-N 1 2 305.784 4.071 20 0 DIADLO CCSc1ccccc1[C@@H](C)[NH2+][C@@H](c1ncccn1)C1CC1 ZINC000903327404 1046241187 /nfs/dbraw/zinc/24/11/87/1046241187.db2.gz SPHVCMOSHQVKFH-CXAGYDPISA-N 1 2 313.470 4.391 20 0 DIADLO CCSc1ccccc1[C@H](C)[NH2+][C@@H](c1ncccn1)C1CC1 ZINC000903327407 1046241697 /nfs/dbraw/zinc/24/16/97/1046241697.db2.gz SPHVCMOSHQVKFH-SUMWQHHRSA-N 1 2 313.470 4.391 20 0 DIADLO CCC[C@@H]([NH2+][C@H](C)c1cc(OC)no1)c1ccc(F)cc1F ZINC000925266081 1046244699 /nfs/dbraw/zinc/24/46/99/1046244699.db2.gz WYMRJAWTNVWBNY-QMTHXVAHSA-N 1 2 310.344 4.153 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)cc1C ZINC000897414461 1046248723 /nfs/dbraw/zinc/24/87/23/1046248723.db2.gz CDDFCPSOJZOUTQ-CYBMUJFWSA-N 1 2 302.418 4.140 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1csc(C)n1)c1cc(F)ccc1OC ZINC000903370124 1046257686 /nfs/dbraw/zinc/25/76/86/1046257686.db2.gz CQJNILZQYLXSKN-HZMBPMFUSA-N 1 2 308.422 4.401 20 0 DIADLO CC[C@@H]([NH2+][C@@H]1CCCc2scnc21)c1cc(F)ccc1OC ZINC000903370369 1046259697 /nfs/dbraw/zinc/25/96/97/1046259697.db2.gz FZDVFCZJLGQPSB-ZIAGYGMSSA-N 1 2 320.433 4.409 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC[C@H]2COCc2ccccc2)c1 ZINC001138674363 1046263353 /nfs/dbraw/zinc/26/33/53/1046263353.db2.gz STNXCLLKJVXDFY-KRWDZBQOSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC[C@H]2COCc2ccccc2)c1 ZINC001138674363 1046263364 /nfs/dbraw/zinc/26/33/64/1046263364.db2.gz STNXCLLKJVXDFY-KRWDZBQOSA-N 1 2 319.807 4.270 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H]2CCCc3[nH]ncc32)cc2ccccc21 ZINC000903413301 1046269583 /nfs/dbraw/zinc/26/95/83/1046269583.db2.gz KGFVAWNKDYIYFG-FZKQIMNGSA-N 1 2 321.424 4.300 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1c(Cl)[nH]c3ccccc31)C2 ZINC001138688792 1046271031 /nfs/dbraw/zinc/27/10/31/1046271031.db2.gz JJLCLYRNMDULOA-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1c(Cl)[nH]c3ccccc31)C2 ZINC001138688792 1046271043 /nfs/dbraw/zinc/27/10/43/1046271043.db2.gz JJLCLYRNMDULOA-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO CCC[C@@H]([NH2+]Cc1coc(C2CC2)n1)c1ccc(F)cc1F ZINC000758507845 1046275989 /nfs/dbraw/zinc/27/59/89/1046275989.db2.gz LOGIQXHRDIEFIF-MRXNPFEDSA-N 1 2 306.356 4.461 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc(-c3ccc(C)cc3)no2)s1 ZINC000102774401 1046277056 /nfs/dbraw/zinc/27/70/56/1046277056.db2.gz JXSXHNZQWYVVAG-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc(-c3ccc(C)cc3)no2)s1 ZINC000102774401 1046277062 /nfs/dbraw/zinc/27/70/62/1046277062.db2.gz JXSXHNZQWYVVAG-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO CSCc1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000795344944 1046286500 /nfs/dbraw/zinc/28/65/00/1046286500.db2.gz LIVMNJXIMYLDPV-LBPRGKRZSA-N 1 2 319.474 4.081 20 0 DIADLO Cc1csc([C@@H]2CCCC[N@H+]2[C@@H](C)c2cnc(C)nc2C)n1 ZINC000638000007 1046290401 /nfs/dbraw/zinc/29/04/01/1046290401.db2.gz MHCLHRNYUQJUNR-BBRMVZONSA-N 1 2 316.474 4.147 20 0 DIADLO Cc1csc([C@@H]2CCCC[N@@H+]2[C@@H](C)c2cnc(C)nc2C)n1 ZINC000638000007 1046290411 /nfs/dbraw/zinc/29/04/11/1046290411.db2.gz MHCLHRNYUQJUNR-BBRMVZONSA-N 1 2 316.474 4.147 20 0 DIADLO c1coc([C@@H]2CCCC[N@H+]2[C@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000638076289 1046291759 /nfs/dbraw/zinc/29/17/59/1046291759.db2.gz YHKSEVKEEBQJRA-RDJZCZTQSA-N 1 2 314.433 4.246 20 0 DIADLO c1coc([C@@H]2CCCC[N@@H+]2[C@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000638076289 1046291774 /nfs/dbraw/zinc/29/17/74/1046291774.db2.gz YHKSEVKEEBQJRA-RDJZCZTQSA-N 1 2 314.433 4.246 20 0 DIADLO C[C@H]1CC(C)(C)c2ccccc2N1C(=O)c1cccc2[nH+]ccn21 ZINC000780115565 1046294939 /nfs/dbraw/zinc/29/49/39/1046294939.db2.gz PBLLPXVCYXBPMF-AWEZNQCLSA-N 1 2 319.408 4.051 20 0 DIADLO Clc1cc(C[N@H+](Cc2ccccc2)Cc2cccnc2)ccn1 ZINC001138819824 1046300210 /nfs/dbraw/zinc/30/02/10/1046300210.db2.gz BBXJCRASHHMJPI-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1cc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)ccn1 ZINC001138819824 1046300217 /nfs/dbraw/zinc/30/02/17/1046300217.db2.gz BBXJCRASHHMJPI-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO C[C@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)[C@H]1CC1(F)F ZINC000638227014 1046302324 /nfs/dbraw/zinc/30/23/24/1046302324.db2.gz LWTNXMWDGAFLDW-BLLLJJGKSA-N 1 2 317.383 4.342 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cccc(Oc3ccccc3)c2)nn1C ZINC001138832406 1046303833 /nfs/dbraw/zinc/30/38/33/1046303833.db2.gz SSJMAOPFZMDLDQ-UHFFFAOYSA-N 1 2 321.424 4.153 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cccc(Oc3ccccc3)c2)nn1C ZINC001138832406 1046303847 /nfs/dbraw/zinc/30/38/47/1046303847.db2.gz SSJMAOPFZMDLDQ-UHFFFAOYSA-N 1 2 321.424 4.153 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1c[nH]c3c1cccc3Cl)C2 ZINC001138837082 1046306519 /nfs/dbraw/zinc/30/65/19/1046306519.db2.gz WPJDMWQHJYVBMG-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1c[nH]c3c1cccc3Cl)C2 ZINC001138837082 1046306543 /nfs/dbraw/zinc/30/65/43/1046306543.db2.gz WPJDMWQHJYVBMG-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1ccccc1C)c1ccccn1 ZINC000089797130 1046314850 /nfs/dbraw/zinc/31/48/50/1046314850.db2.gz XHNBWIFNAJWJJA-OAQYLSRUSA-N 1 2 318.420 4.278 20 0 DIADLO CC[N@H+](Cc1csc(C(C)C)n1)Cc1cccc(OC)c1 ZINC001138887690 1046317995 /nfs/dbraw/zinc/31/79/95/1046317995.db2.gz OGZIFXNSURWSIZ-UHFFFAOYSA-N 1 2 304.459 4.297 20 0 DIADLO CC[N@@H+](Cc1csc(C(C)C)n1)Cc1cccc(OC)c1 ZINC001138887690 1046318006 /nfs/dbraw/zinc/31/80/06/1046318006.db2.gz OGZIFXNSURWSIZ-UHFFFAOYSA-N 1 2 304.459 4.297 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(Cl)s1)c1nc2ccccc2s1 ZINC000718200028 1046322939 /nfs/dbraw/zinc/32/29/39/1046322939.db2.gz JQVGLCAFYUQRKW-QMMMGPOBSA-N 1 2 309.847 4.257 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Br)o2)Cc2ccccc21 ZINC001138902253 1046323501 /nfs/dbraw/zinc/32/35/01/1046323501.db2.gz NLMPITIGLNITGD-LLVKDONJSA-N 1 2 306.203 4.161 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Br)o2)Cc2ccccc21 ZINC001138902253 1046323509 /nfs/dbraw/zinc/32/35/09/1046323509.db2.gz NLMPITIGLNITGD-LLVKDONJSA-N 1 2 306.203 4.161 20 0 DIADLO C[C@H]1C(=O)CC[N@H+](Cc2ccccc2OC(F)F)C12CCCC2 ZINC001138911719 1046324982 /nfs/dbraw/zinc/32/49/82/1046324982.db2.gz GHIRVZSAGHMXMI-ZDUSSCGKSA-N 1 2 323.383 4.012 20 0 DIADLO C[C@H]1C(=O)CC[N@@H+](Cc2ccccc2OC(F)F)C12CCCC2 ZINC001138911719 1046324994 /nfs/dbraw/zinc/32/49/94/1046324994.db2.gz GHIRVZSAGHMXMI-ZDUSSCGKSA-N 1 2 323.383 4.012 20 0 DIADLO c1nnc([C@H]([NH2+]C2(c3ccccc3)CCC2)C2CCCCC2)[nH]1 ZINC000638457498 1046325112 /nfs/dbraw/zinc/32/51/12/1046325112.db2.gz SDLDEDFEQGITLM-QGZVFWFLSA-N 1 2 310.445 4.095 20 0 DIADLO CCn1c(=S)n(C[N@@H+]2CCC[C@@H](CC(C)C)C2)nc1C1CC1 ZINC000759143245 1046325649 /nfs/dbraw/zinc/32/56/49/1046325649.db2.gz CQMWAQFQMPGITH-AWEZNQCLSA-N 1 2 322.522 4.027 20 0 DIADLO CCn1c(=S)n(C[N@H+]2CCC[C@@H](CC(C)C)C2)nc1C1CC1 ZINC000759143245 1046325663 /nfs/dbraw/zinc/32/56/63/1046325663.db2.gz CQMWAQFQMPGITH-AWEZNQCLSA-N 1 2 322.522 4.027 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000103227833 1046325843 /nfs/dbraw/zinc/32/58/43/1046325843.db2.gz QWEKMQVZTXNICT-UHFFFAOYSA-N 1 2 318.323 4.235 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000103227833 1046325852 /nfs/dbraw/zinc/32/58/52/1046325852.db2.gz QWEKMQVZTXNICT-UHFFFAOYSA-N 1 2 318.323 4.235 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1cnc2[nH]ccc2c1Cl ZINC001138935669 1046333058 /nfs/dbraw/zinc/33/30/58/1046333058.db2.gz ISANJWFQKUTCDP-UHFFFAOYSA-N 1 2 317.795 4.329 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1cnc2[nH]ccc2c1Cl ZINC001138935669 1046333068 /nfs/dbraw/zinc/33/30/68/1046333068.db2.gz ISANJWFQKUTCDP-UHFFFAOYSA-N 1 2 317.795 4.329 20 0 DIADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccc(Cl)nc1 ZINC000179118116 1046335128 /nfs/dbraw/zinc/33/51/28/1046335128.db2.gz VGEJVZUYHVYRLB-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(Br)cnc1Cl ZINC001138945059 1046335727 /nfs/dbraw/zinc/33/57/27/1046335727.db2.gz PSSVXAMQDYPONM-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc(Br)cnc1Cl ZINC001138945059 1046335741 /nfs/dbraw/zinc/33/57/41/1046335741.db2.gz PSSVXAMQDYPONM-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2ccc3ccc(F)c(F)c3n2)s1 ZINC000638726269 1046339110 /nfs/dbraw/zinc/33/91/10/1046339110.db2.gz PVKQXYWSRCXOCR-JTQLQIEISA-N 1 2 319.380 4.129 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc(OCC(C)C)cc1)C2 ZINC001138969641 1046343356 /nfs/dbraw/zinc/34/33/56/1046343356.db2.gz DKQZMLDUHKHGOJ-UHFFFAOYSA-N 1 2 311.425 4.246 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc(OCC(C)C)cc1)C2 ZINC001138969641 1046343366 /nfs/dbraw/zinc/34/33/66/1046343366.db2.gz DKQZMLDUHKHGOJ-UHFFFAOYSA-N 1 2 311.425 4.246 20 0 DIADLO CCCOc1ccccc1C[N@@H+]1CCc2ccc(C(C)=O)cc2C1 ZINC001138999180 1046351459 /nfs/dbraw/zinc/35/14/59/1046351459.db2.gz XTQIEEPATMPAKR-UHFFFAOYSA-N 1 2 323.436 4.236 20 0 DIADLO CCCOc1ccccc1C[N@H+]1CCc2ccc(C(C)=O)cc2C1 ZINC001138999180 1046351476 /nfs/dbraw/zinc/35/14/76/1046351476.db2.gz XTQIEEPATMPAKR-UHFFFAOYSA-N 1 2 323.436 4.236 20 0 DIADLO COc1cccc([C@H]2C[C@H]([N@H+](C)C/C(Cl)=C\Cl)C2)c1 ZINC000832580327 1046353059 /nfs/dbraw/zinc/35/30/59/1046353059.db2.gz QFPITACWEBZRIR-ZAECQBEJSA-N 1 2 300.229 4.192 20 0 DIADLO COc1cccc([C@H]2C[C@H]([N@@H+](C)C/C(Cl)=C\Cl)C2)c1 ZINC000832580327 1046353071 /nfs/dbraw/zinc/35/30/71/1046353071.db2.gz QFPITACWEBZRIR-ZAECQBEJSA-N 1 2 300.229 4.192 20 0 DIADLO C[C@@H](CCCC(F)(F)F)[NH2+][C@H](c1ncn[nH]1)C1CCCCC1 ZINC000639106010 1046359609 /nfs/dbraw/zinc/35/96/09/1046359609.db2.gz KFIJYEPXWJYPHX-AAEUAGOBSA-N 1 2 318.387 4.137 20 0 DIADLO CC[N@H+](CCC(F)(F)F)CC(=O)Nc1ccc(C(C)C)cc1 ZINC000748305715 1046366178 /nfs/dbraw/zinc/36/61/78/1046366178.db2.gz OFOAFVYZCIEVDT-UHFFFAOYSA-N 1 2 316.367 4.023 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)CC(=O)Nc1ccc(C(C)C)cc1 ZINC000748305715 1046366183 /nfs/dbraw/zinc/36/61/83/1046366183.db2.gz OFOAFVYZCIEVDT-UHFFFAOYSA-N 1 2 316.367 4.023 20 0 DIADLO COc1ccc(-c2ccccc2)cc1C[NH+]1CC2(C1)CCCCO2 ZINC001139067654 1046375789 /nfs/dbraw/zinc/37/57/89/1046375789.db2.gz GIRPJDUCTBMDPC-UHFFFAOYSA-N 1 2 323.436 4.117 20 0 DIADLO Clc1cc(C[N@@H+]2CC[C@H]2c2ccccc2)cc2c1OCO2 ZINC001139076165 1046382021 /nfs/dbraw/zinc/38/20/21/1046382021.db2.gz HQEBFWUCWNHSSC-HNNXBMFYSA-N 1 2 301.773 4.016 20 0 DIADLO Clc1cc(C[N@H+]2CC[C@H]2c2ccccc2)cc2c1OCO2 ZINC001139076165 1046382035 /nfs/dbraw/zinc/38/20/35/1046382035.db2.gz HQEBFWUCWNHSSC-HNNXBMFYSA-N 1 2 301.773 4.016 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1)[N@@H+]1Cc2cnc(Cl)cc2C1 ZINC001168194225 1046382201 /nfs/dbraw/zinc/38/22/01/1046382201.db2.gz UOEHQMMSJANFOP-NSHDSACASA-N 1 2 307.224 4.335 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1)[N@H+]1Cc2cnc(Cl)cc2C1 ZINC001168194225 1046382217 /nfs/dbraw/zinc/38/22/17/1046382217.db2.gz UOEHQMMSJANFOP-NSHDSACASA-N 1 2 307.224 4.335 20 0 DIADLO CCc1cccc(NC(=O)N[C@@H](C)c2c[nH+]c3c(C)cccn23)c1 ZINC001202893951 1046383616 /nfs/dbraw/zinc/38/36/16/1046383616.db2.gz VHMSBPSFJPEDQS-AWEZNQCLSA-N 1 2 322.412 4.088 20 0 DIADLO Clc1oc2ccccc2c1C[NH2+]Cc1cc(C2CC2)no1 ZINC000639363340 1046384663 /nfs/dbraw/zinc/38/46/63/1046384663.db2.gz FACZLDSNTXPCDJ-UHFFFAOYSA-N 1 2 302.761 4.241 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Oc1ccc(Oc2ccccc2)cc1 ZINC000748602469 1046385646 /nfs/dbraw/zinc/38/56/46/1046385646.db2.gz FEXAZXHAJIXNPM-UHFFFAOYSA-N 1 2 322.364 4.061 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2ccc(Br)nc2Cl)CC1 ZINC001139109182 1046386829 /nfs/dbraw/zinc/38/68/29/1046386829.db2.gz GBZFINALJKHKFB-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2ccc(Br)nc2Cl)CC1 ZINC001139109182 1046386815 /nfs/dbraw/zinc/38/68/15/1046386815.db2.gz GBZFINALJKHKFB-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Oc1ccc2oc3ccccc3c2c1 ZINC000748601892 1046386840 /nfs/dbraw/zinc/38/68/40/1046386840.db2.gz OODNZBXDFTUSCJ-UHFFFAOYSA-N 1 2 320.348 4.168 20 0 DIADLO CCc1ccc(OC(=O)CCCn2cc[nH+]c2)c(C(C)(C)C)c1 ZINC000748605381 1046387375 /nfs/dbraw/zinc/38/73/75/1046387375.db2.gz KTLUDWNXXZCMCI-UHFFFAOYSA-N 1 2 314.429 4.129 20 0 DIADLO C[C@@H]1CCCCC[N@@H+]1Cc1ccc(Br)nc1Cl ZINC001139112322 1046389040 /nfs/dbraw/zinc/38/90/40/1046389040.db2.gz DWSIKKXLMWKBOJ-SNVBAGLBSA-N 1 2 317.658 4.262 20 0 DIADLO C[C@@H]1CCCCC[N@H+]1Cc1ccc(Br)nc1Cl ZINC001139112322 1046389054 /nfs/dbraw/zinc/38/90/54/1046389054.db2.gz DWSIKKXLMWKBOJ-SNVBAGLBSA-N 1 2 317.658 4.262 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@](C)(F)C2)c(Cl)c1OC ZINC001139115430 1046390633 /nfs/dbraw/zinc/39/06/33/1046390633.db2.gz ZOJLRCGEFMRTIF-INIZCTEOSA-N 1 2 315.816 4.071 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@](C)(F)C2)c(Cl)c1OC ZINC001139115430 1046390645 /nfs/dbraw/zinc/39/06/45/1046390645.db2.gz ZOJLRCGEFMRTIF-INIZCTEOSA-N 1 2 315.816 4.071 20 0 DIADLO CCn1ccc2c1cccc2C[N@@H+]1CCCC[C@H]1c1noc(C)n1 ZINC001139153047 1046394176 /nfs/dbraw/zinc/39/41/76/1046394176.db2.gz CSCFNPNKRQBPEH-SFHVURJKSA-N 1 2 324.428 4.080 20 0 DIADLO CCn1ccc2c1cccc2C[N@H+]1CCCC[C@H]1c1noc(C)n1 ZINC001139153047 1046394189 /nfs/dbraw/zinc/39/41/89/1046394189.db2.gz CSCFNPNKRQBPEH-SFHVURJKSA-N 1 2 324.428 4.080 20 0 DIADLO Clc1ccc(Cl)c(-c2ccc(C[N@H+]3C[C@H]4C[C@@H](C3)O4)o2)c1 ZINC001139165968 1046400921 /nfs/dbraw/zinc/40/09/21/1046400921.db2.gz RMPCFVYEKUBLLS-BETUJISGSA-N 1 2 324.207 4.227 20 0 DIADLO Clc1ccc(Cl)c(-c2ccc(C[N@@H+]3C[C@H]4C[C@@H](C3)O4)o2)c1 ZINC001139165968 1046400927 /nfs/dbraw/zinc/40/09/27/1046400927.db2.gz RMPCFVYEKUBLLS-BETUJISGSA-N 1 2 324.207 4.227 20 0 DIADLO CCCCc1nc(Cl)c(C[N@@H+]2CCCC(F)(F)CC2)[nH]1 ZINC001139176248 1046402166 /nfs/dbraw/zinc/40/21/66/1046402166.db2.gz LDCLOVRMBHLVQF-UHFFFAOYSA-N 1 2 305.800 4.027 20 0 DIADLO CCCCc1nc(Cl)c(C[N@H+]2CCCC(F)(F)CC2)[nH]1 ZINC001139176248 1046402173 /nfs/dbraw/zinc/40/21/73/1046402173.db2.gz LDCLOVRMBHLVQF-UHFFFAOYSA-N 1 2 305.800 4.027 20 0 DIADLO O=c1cc(C[N@@H+](Cc2c(Cl)cccc2Cl)C2CC2)cc[nH]1 ZINC000639462761 1046404716 /nfs/dbraw/zinc/40/47/16/1046404716.db2.gz IDDDQTMGGVVNLO-UHFFFAOYSA-N 1 2 323.223 4.259 20 0 DIADLO O=c1cc(C[N@H+](Cc2c(Cl)cccc2Cl)C2CC2)cc[nH]1 ZINC000639462761 1046404721 /nfs/dbraw/zinc/40/47/21/1046404721.db2.gz IDDDQTMGGVVNLO-UHFFFAOYSA-N 1 2 323.223 4.259 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@H+](Cc3coc(C4CC4)n3)CC2)c1 ZINC000780780592 1046404972 /nfs/dbraw/zinc/40/49/72/1046404972.db2.gz VJVOUAHQZYBYGG-UHFFFAOYSA-N 1 2 308.425 4.458 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@@H+](Cc3coc(C4CC4)n3)CC2)c1 ZINC000780780592 1046404979 /nfs/dbraw/zinc/40/49/79/1046404979.db2.gz VJVOUAHQZYBYGG-UHFFFAOYSA-N 1 2 308.425 4.458 20 0 DIADLO CC(C)c1nc(C[N@H+](C)Cc2ccc3c(ccn3C)c2)cs1 ZINC001139189590 1046406262 /nfs/dbraw/zinc/40/62/62/1046406262.db2.gz FSXPIRGWYOPVDF-UHFFFAOYSA-N 1 2 313.470 4.390 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)Cc2ccc3c(ccn3C)c2)cs1 ZINC001139189590 1046406267 /nfs/dbraw/zinc/40/62/67/1046406267.db2.gz FSXPIRGWYOPVDF-UHFFFAOYSA-N 1 2 313.470 4.390 20 0 DIADLO c1coc([C@H]2CCCCC[N@H+]2Cc2nc(C3CCC3)no2)c1 ZINC000639499270 1046407009 /nfs/dbraw/zinc/40/70/09/1046407009.db2.gz GJSYMSZLRFFSEP-CQSZACIVSA-N 1 2 301.390 4.047 20 0 DIADLO c1coc([C@H]2CCCCC[N@@H+]2Cc2nc(C3CCC3)no2)c1 ZINC000639499270 1046407018 /nfs/dbraw/zinc/40/70/18/1046407018.db2.gz GJSYMSZLRFFSEP-CQSZACIVSA-N 1 2 301.390 4.047 20 0 DIADLO Cc1cccc2[nH]cc(C[N@@H+]3CCOC[C@H]3c3ccc(F)cc3)c21 ZINC001139198696 1046408184 /nfs/dbraw/zinc/40/81/84/1046408184.db2.gz VNESJHNYBIJKPQ-IBGZPJMESA-N 1 2 324.399 4.189 20 0 DIADLO Cc1cccc2[nH]cc(C[N@H+]3CCOC[C@H]3c3ccc(F)cc3)c21 ZINC001139198696 1046408186 /nfs/dbraw/zinc/40/81/86/1046408186.db2.gz VNESJHNYBIJKPQ-IBGZPJMESA-N 1 2 324.399 4.189 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C[C@@H]1F ZINC001139201853 1046410871 /nfs/dbraw/zinc/41/08/71/1046410871.db2.gz HUMFHHCNSYOFFQ-CALCHBBNSA-N 1 2 312.363 4.327 20 0 DIADLO F[C@@H]1C[N@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C[C@@H]1F ZINC001139201853 1046410880 /nfs/dbraw/zinc/41/08/80/1046410880.db2.gz HUMFHHCNSYOFFQ-CALCHBBNSA-N 1 2 312.363 4.327 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C2CCC2)no1)c1cccc(Cl)c1 ZINC000639561326 1046411280 /nfs/dbraw/zinc/41/12/80/1046411280.db2.gz IDJURPPCHUBAQQ-AWEZNQCLSA-N 1 2 305.809 4.231 20 0 DIADLO CC/C(C)=C(\C)C(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC000780905748 1046411687 /nfs/dbraw/zinc/41/16/87/1046411687.db2.gz ZJETURNGDNZQJF-VEOJIXDASA-N 1 2 321.490 4.060 20 0 DIADLO CC/C(C)=C(\C)C(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000780905748 1046411695 /nfs/dbraw/zinc/41/16/95/1046411695.db2.gz ZJETURNGDNZQJF-VEOJIXDASA-N 1 2 321.490 4.060 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000780896337 1046411849 /nfs/dbraw/zinc/41/18/49/1046411849.db2.gz AUCVJQNWXGNTAR-SCTDSRPQSA-N 1 2 319.493 4.289 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C2CCC2)no1)c1cccc(Cl)c1 ZINC000639561327 1046411780 /nfs/dbraw/zinc/41/17/80/1046411780.db2.gz IDJURPPCHUBAQQ-CQSZACIVSA-N 1 2 305.809 4.231 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000780896335 1046412571 /nfs/dbraw/zinc/41/25/71/1046412571.db2.gz AUCVJQNWXGNTAR-LNLFQRSKSA-N 1 2 319.493 4.289 20 0 DIADLO CC[C@@H]([NH2+]Cc1oc(-c2ccccc2)nc1C)c1nccs1 ZINC000639581197 1046414982 /nfs/dbraw/zinc/41/49/82/1046414982.db2.gz WTTOPQSIAMBKFQ-CQSZACIVSA-N 1 2 313.426 4.347 20 0 DIADLO CC[N@H+](Cc1cnc(N)s1)Cc1ccc(Cl)cc1Cl ZINC001139229478 1046416486 /nfs/dbraw/zinc/41/64/86/1046416486.db2.gz ZEAGREKZYASSSR-UHFFFAOYSA-N 1 2 316.257 4.054 20 0 DIADLO CC[N@@H+](Cc1cnc(N)s1)Cc1ccc(Cl)cc1Cl ZINC001139229478 1046416494 /nfs/dbraw/zinc/41/64/94/1046416494.db2.gz ZEAGREKZYASSSR-UHFFFAOYSA-N 1 2 316.257 4.054 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(NCc2cccc3cn(C)nc32)c1 ZINC001168207947 1046419388 /nfs/dbraw/zinc/41/93/88/1046419388.db2.gz XASGIGDMWSZCIA-UHFFFAOYSA-N 1 2 322.456 4.340 20 0 DIADLO Clc1nc(-c2ccccc2)[nH]c1C[N@@H+]1CCc2ccccc2C1 ZINC001139277282 1046422038 /nfs/dbraw/zinc/42/20/38/1046422038.db2.gz RCPRVEGPWQGJFO-UHFFFAOYSA-N 1 2 323.827 4.288 20 0 DIADLO Clc1nc(-c2ccccc2)[nH]c1C[N@H+]1CCc2ccccc2C1 ZINC001139277282 1046422042 /nfs/dbraw/zinc/42/20/42/1046422042.db2.gz RCPRVEGPWQGJFO-UHFFFAOYSA-N 1 2 323.827 4.288 20 0 DIADLO Clc1ccc(Cl)c(CC[N@@H+]2CCC[C@@H]2c2ncccn2)c1 ZINC000639864461 1046431864 /nfs/dbraw/zinc/43/18/64/1046431864.db2.gz CZLCFRJSEOSYGU-OAHLLOKOSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1ccc(Cl)c(CC[N@H+]2CCC[C@@H]2c2ncccn2)c1 ZINC000639864461 1046431869 /nfs/dbraw/zinc/43/18/69/1046431869.db2.gz CZLCFRJSEOSYGU-OAHLLOKOSA-N 1 2 322.239 4.163 20 0 DIADLO Brc1cscc1C[N@@H+]1CCc2ccccc2C1 ZINC001139348406 1046435033 /nfs/dbraw/zinc/43/50/33/1046435033.db2.gz QFNYCDIOKZQPMF-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1cscc1C[N@H+]1CCc2ccccc2C1 ZINC001139348406 1046435037 /nfs/dbraw/zinc/43/50/37/1046435037.db2.gz QFNYCDIOKZQPMF-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Clc1cnc(Cl)c(C[NH+]2CCC(c3ccncc3)CC2)c1 ZINC001139353188 1046436254 /nfs/dbraw/zinc/43/62/54/1046436254.db2.gz JMKBMYPDBGYWOZ-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1cnc(Cl)c(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c1 ZINC001139353631 1046436538 /nfs/dbraw/zinc/43/65/38/1046436538.db2.gz VPAIXYRTJUHOBJ-OAHLLOKOSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cnc(Cl)c(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c1 ZINC001139353631 1046436543 /nfs/dbraw/zinc/43/65/43/1046436543.db2.gz VPAIXYRTJUHOBJ-OAHLLOKOSA-N 1 2 323.223 4.042 20 0 DIADLO Cc1ccc2[nH+]cc(CNC(=O)Nc3ccc(C(C)C)cc3)n2c1 ZINC001202926740 1046438030 /nfs/dbraw/zinc/43/80/30/1046438030.db2.gz FAZLZCCTVLYWNH-UHFFFAOYSA-N 1 2 322.412 4.088 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2cccc(C(F)(F)F)c2)c[nH+]1 ZINC000454162125 1046438838 /nfs/dbraw/zinc/43/88/38/1046438838.db2.gz JXJCBCUSMVXDOP-UHFFFAOYSA-N 1 2 323.318 4.039 20 0 DIADLO Fc1ccc(Cl)cc1C[NH2+]Cc1nc2c(s1)CCCC2 ZINC000719527785 1046440070 /nfs/dbraw/zinc/44/00/70/1046440070.db2.gz MLAZIWBWDBBTDM-UHFFFAOYSA-N 1 2 310.825 4.104 20 0 DIADLO FCc1ccc(C[N@H+](Cc2ccco2)Cc2cccnc2)cc1 ZINC000781340238 1046440707 /nfs/dbraw/zinc/44/07/07/1046440707.db2.gz UKNOTVYGCWHWJG-UHFFFAOYSA-N 1 2 310.372 4.347 20 0 DIADLO FCc1ccc(C[N@@H+](Cc2ccco2)Cc2cccnc2)cc1 ZINC000781340238 1046440712 /nfs/dbraw/zinc/44/07/12/1046440712.db2.gz UKNOTVYGCWHWJG-UHFFFAOYSA-N 1 2 310.372 4.347 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2ncc(-c3cccc(F)c3)o2)s1 ZINC000639996245 1046441049 /nfs/dbraw/zinc/44/10/49/1046441049.db2.gz WXLOSWKTSGWXNZ-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2ncc(-c3ccccc3C)o2)s1 ZINC000639993884 1046441086 /nfs/dbraw/zinc/44/10/86/1046441086.db2.gz FLQRAFHSBIJNGF-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2nc(-c3ccsc3)oc2C)s1 ZINC000639994849 1046441223 /nfs/dbraw/zinc/44/12/23/1046441223.db2.gz NQYPYROVNZGUGF-VIFPVBQESA-N 1 2 319.455 4.327 20 0 DIADLO CSc1cc(F)ccc1NCc1c[nH+]c2ccc(C)cn12 ZINC001202929888 1046441589 /nfs/dbraw/zinc/44/15/89/1046441589.db2.gz QFKHKXROVSPNMT-UHFFFAOYSA-N 1 2 301.390 4.116 20 0 DIADLO CCOc1ccc(C2=CC[N@H+](CC=C(Cl)Cl)CC2)cc1 ZINC001168245280 1046446268 /nfs/dbraw/zinc/44/62/68/1046446268.db2.gz ZZGRXHGYOKEMSI-UHFFFAOYSA-N 1 2 312.240 4.493 20 0 DIADLO CCOc1ccc(C2=CC[N@@H+](CC=C(Cl)Cl)CC2)cc1 ZINC001168245280 1046446277 /nfs/dbraw/zinc/44/62/77/1046446277.db2.gz ZZGRXHGYOKEMSI-UHFFFAOYSA-N 1 2 312.240 4.493 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)CCC1=O ZINC001139414885 1046446991 /nfs/dbraw/zinc/44/69/91/1046446991.db2.gz CTRKNHCVCDCFGP-GFCCVEGCSA-N 1 2 303.789 4.011 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)CCC1=O ZINC001139414885 1046446994 /nfs/dbraw/zinc/44/69/94/1046446994.db2.gz CTRKNHCVCDCFGP-GFCCVEGCSA-N 1 2 303.789 4.011 20 0 DIADLO Clc1ccnc(Cl)c1C[NH+]1CCC(c2ccncc2)CC1 ZINC001139479082 1046453981 /nfs/dbraw/zinc/45/39/81/1046453981.db2.gz VCSCBENZDCGCKV-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO CC[N@@H+](Cc1csc(-c2ccccn2)n1)Cc1cccs1 ZINC000124248084 1046454205 /nfs/dbraw/zinc/45/42/05/1046454205.db2.gz QKVLSAKFDYTZHU-UHFFFAOYSA-N 1 2 315.467 4.289 20 0 DIADLO CC[N@H+](Cc1csc(-c2ccccn2)n1)Cc1cccs1 ZINC000124248084 1046454211 /nfs/dbraw/zinc/45/42/11/1046454211.db2.gz QKVLSAKFDYTZHU-UHFFFAOYSA-N 1 2 315.467 4.289 20 0 DIADLO CCc1ccc(NC(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC001202940243 1046456769 /nfs/dbraw/zinc/45/67/69/1046456769.db2.gz CJHAETFSUUDPOV-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO Fc1ccc(F)c2c1CC[C@@H]2[NH2+][C@H]1COc2c1cccc2Cl ZINC000677042301 1046456770 /nfs/dbraw/zinc/45/67/70/1046456770.db2.gz FYKHRUVIRSPSTO-GJZGRUSLSA-N 1 2 321.754 4.329 20 0 DIADLO Fc1c(Br)cccc1C[N@H+](Cc1ccco1)C1CC1 ZINC001139534349 1046465124 /nfs/dbraw/zinc/46/51/24/1046465124.db2.gz LGRSYRMFRWQCJM-UHFFFAOYSA-N 1 2 324.193 4.346 20 0 DIADLO Fc1c(Br)cccc1C[N@@H+](Cc1ccco1)C1CC1 ZINC001139534349 1046465125 /nfs/dbraw/zinc/46/51/25/1046465125.db2.gz LGRSYRMFRWQCJM-UHFFFAOYSA-N 1 2 324.193 4.346 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCC[C@@H]3c3ccncc3)cs2)co1 ZINC000125380271 1046466213 /nfs/dbraw/zinc/46/62/13/1046466213.db2.gz WSTPEEJIEWHWGE-MRXNPFEDSA-N 1 2 311.410 4.135 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCC[C@@H]3c3ccncc3)cs2)co1 ZINC000125380271 1046466221 /nfs/dbraw/zinc/46/62/21/1046466221.db2.gz WSTPEEJIEWHWGE-MRXNPFEDSA-N 1 2 311.410 4.135 20 0 DIADLO Clc1cccc(C[N@H+](Cc2ccccc2)Cc2cccnc2)n1 ZINC001139549961 1046467835 /nfs/dbraw/zinc/46/78/35/1046467835.db2.gz CNYDBAVFGOPNTH-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1cccc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)n1 ZINC001139549961 1046467845 /nfs/dbraw/zinc/46/78/45/1046467845.db2.gz CNYDBAVFGOPNTH-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(-c3ccccc3)[nH]2)Cc2ccccc21 ZINC001139556548 1046470726 /nfs/dbraw/zinc/47/07/26/1046470726.db2.gz JUURDTIXNIOZAU-UHFFFAOYSA-N 1 2 317.436 4.370 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(-c3ccccc3)[nH]2)Cc2ccccc21 ZINC001139556548 1046470732 /nfs/dbraw/zinc/47/07/32/1046470732.db2.gz JUURDTIXNIOZAU-UHFFFAOYSA-N 1 2 317.436 4.370 20 0 DIADLO c1[nH]c(-c2ccccc2)nc1C[N@@H+]1CCSc2ccccc2C1 ZINC001139557197 1046471243 /nfs/dbraw/zinc/47/12/43/1046471243.db2.gz XZLNDMHALGZDAP-UHFFFAOYSA-N 1 2 321.449 4.185 20 0 DIADLO c1[nH]c(-c2ccccc2)nc1C[N@H+]1CCSc2ccccc2C1 ZINC001139557197 1046471249 /nfs/dbraw/zinc/47/12/49/1046471249.db2.gz XZLNDMHALGZDAP-UHFFFAOYSA-N 1 2 321.449 4.185 20 0 DIADLO c1nc(-c2ccccc2)[nH]c1C[N@@H+]1CCSc2ccccc2C1 ZINC001139557197 1046471258 /nfs/dbraw/zinc/47/12/58/1046471258.db2.gz XZLNDMHALGZDAP-UHFFFAOYSA-N 1 2 321.449 4.185 20 0 DIADLO c1nc(-c2ccccc2)[nH]c1C[N@H+]1CCSc2ccccc2C1 ZINC001139557197 1046471266 /nfs/dbraw/zinc/47/12/66/1046471266.db2.gz XZLNDMHALGZDAP-UHFFFAOYSA-N 1 2 321.449 4.185 20 0 DIADLO Cc1cn2c(cccc2NC(=O)Nc2c(C)cc(C)cc2C)[nH+]1 ZINC001202948648 1046474771 /nfs/dbraw/zinc/47/47/71/1046474771.db2.gz KXGWEVHYAJTNMA-UHFFFAOYSA-N 1 2 308.385 4.212 20 0 DIADLO C[N@@H+](Cc1ccccc1-c1ccccc1Cl)Cc1ncccn1 ZINC001139572415 1046475181 /nfs/dbraw/zinc/47/51/81/1046475181.db2.gz POPRRTAAUSXPHY-UHFFFAOYSA-N 1 2 323.827 4.429 20 0 DIADLO C[N@H+](Cc1ccccc1-c1ccccc1Cl)Cc1ncccn1 ZINC001139572415 1046475184 /nfs/dbraw/zinc/47/51/84/1046475184.db2.gz POPRRTAAUSXPHY-UHFFFAOYSA-N 1 2 323.827 4.429 20 0 DIADLO Cc1cnc(Cl)c(C[N@@H+]2CCSc3ccccc3C2)c1 ZINC001139592047 1046480235 /nfs/dbraw/zinc/48/02/35/1046480235.db2.gz ANABNZSQADSEEM-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO Cc1cnc(Cl)c(C[N@H+]2CCSc3ccccc3C2)c1 ZINC001139592047 1046480242 /nfs/dbraw/zinc/48/02/42/1046480242.db2.gz ANABNZSQADSEEM-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCC[C@@H]3c3ccccc3)no2)cs1 ZINC000127270590 1046482241 /nfs/dbraw/zinc/48/22/41/1046482241.db2.gz XKEQOCRKSQYDND-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCC[C@@H]3c3ccccc3)no2)cs1 ZINC000127270590 1046482245 /nfs/dbraw/zinc/48/22/45/1046482245.db2.gz XKEQOCRKSQYDND-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO Fc1cccn2cc(C[NH2+]Cc3cccc(Cl)c3Cl)nc12 ZINC000677321479 1046483872 /nfs/dbraw/zinc/48/38/72/1046483872.db2.gz QAQIGOISEUPQFX-UHFFFAOYSA-N 1 2 324.186 4.070 20 0 DIADLO CCOc1ccc(C)cc1C[N@H+](C)Cc1ccc(F)cc1F ZINC001139607180 1046485205 /nfs/dbraw/zinc/48/52/05/1046485205.db2.gz IZYVZRMSBRRCJO-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CCOc1ccc(C)cc1C[N@@H+](C)Cc1ccc(F)cc1F ZINC001139607180 1046485211 /nfs/dbraw/zinc/48/52/11/1046485211.db2.gz IZYVZRMSBRRCJO-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc(OC)c(C(C)C)c1)C2 ZINC001139622071 1046489392 /nfs/dbraw/zinc/48/93/92/1046489392.db2.gz VFIVYXWXQAGUGR-UHFFFAOYSA-N 1 2 311.425 4.343 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc(OC)c(C(C)C)c1)C2 ZINC001139622071 1046489395 /nfs/dbraw/zinc/48/93/95/1046489395.db2.gz VFIVYXWXQAGUGR-UHFFFAOYSA-N 1 2 311.425 4.343 20 0 DIADLO CCCCCC(C)(C)CNC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC001137293097 1046491729 /nfs/dbraw/zinc/49/17/29/1046491729.db2.gz CWJNTSPMLBYMCH-UHFFFAOYSA-N 1 2 313.445 4.209 20 0 DIADLO COc1cc(C)[nH+]c(CSc2nc(-c3ccccc3)c[nH]2)c1 ZINC000677415537 1046494704 /nfs/dbraw/zinc/49/47/04/1046494704.db2.gz KACCPZVGGBLDFF-UHFFFAOYSA-N 1 2 311.410 4.081 20 0 DIADLO CN(C)c1cc(CSc2cccc(Br)c2)cc[nH+]1 ZINC000782111580 1046495360 /nfs/dbraw/zinc/49/53/60/1046495360.db2.gz HYCIICRKZSJEPO-UHFFFAOYSA-N 1 2 323.259 4.202 20 0 DIADLO Cc1cc(NC(=O)[C@H]2C[C@@H]2c2cccc3ccccc32)c(C)c[nH+]1 ZINC000536575309 1046496683 /nfs/dbraw/zinc/49/66/83/1046496683.db2.gz JRUUTOAQUQDGKS-MOPGFXCFSA-N 1 2 316.404 4.016 20 0 DIADLO c1sc2ccccc2c1Nc1ccccc1C[NH+]1CCOCC1 ZINC001202966751 1046509725 /nfs/dbraw/zinc/50/97/25/1046509725.db2.gz XSFOBDOWZQQRRA-UHFFFAOYSA-N 1 2 324.449 4.477 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2C[C@H](c3ccccc3)OC[C@H]2C)s1 ZINC000130619732 1046513770 /nfs/dbraw/zinc/51/37/70/1046513770.db2.gz VRPCTSZQPMXHJP-RHSMWYFYSA-N 1 2 316.470 4.229 20 0 DIADLO CC(C)c1ncc(C[N@H+]2C[C@H](c3ccccc3)OC[C@H]2C)s1 ZINC000130619732 1046513778 /nfs/dbraw/zinc/51/37/78/1046513778.db2.gz VRPCTSZQPMXHJP-RHSMWYFYSA-N 1 2 316.470 4.229 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@H+](Cc2csc(-c3ccsc3)n2)C1 ZINC000677713836 1046513928 /nfs/dbraw/zinc/51/39/28/1046513928.db2.gz LDPYGBMSUWGOOQ-SNVBAGLBSA-N 1 2 318.389 4.256 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@@H+](Cc2csc(-c3ccsc3)n2)C1 ZINC000677713836 1046513948 /nfs/dbraw/zinc/51/39/48/1046513948.db2.gz LDPYGBMSUWGOOQ-SNVBAGLBSA-N 1 2 318.389 4.256 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[NH+]1CC2(C1)CC(F)(F)C2 ZINC000677733654 1046517201 /nfs/dbraw/zinc/51/72/01/1046517201.db2.gz OACRRTTWOODFNL-SNVBAGLBSA-N 1 2 316.189 4.241 20 0 DIADLO FC1(F)CC2(C[NH+](CCOc3cc(Cl)ccc3Cl)C2)C1 ZINC000677732398 1046517498 /nfs/dbraw/zinc/51/74/98/1046517498.db2.gz FZMKSQQRENEPJR-UHFFFAOYSA-N 1 2 322.182 4.103 20 0 DIADLO C[N@H+](Cc1ccccc1F)Cc1ccccc1OC(F)(F)F ZINC000641857434 1046519083 /nfs/dbraw/zinc/51/90/83/1046519083.db2.gz QUIBYUFONZPBBX-UHFFFAOYSA-N 1 2 313.294 4.356 20 0 DIADLO C[N@@H+](Cc1ccccc1F)Cc1ccccc1OC(F)(F)F ZINC000641857434 1046519097 /nfs/dbraw/zinc/51/90/97/1046519097.db2.gz QUIBYUFONZPBBX-UHFFFAOYSA-N 1 2 313.294 4.356 20 0 DIADLO COCc1ccc(C[N@H+](C)Cc2nc3ccccc3s2)s1 ZINC001139825182 1046526169 /nfs/dbraw/zinc/52/61/69/1046526169.db2.gz AOKNXCGTCKYXOS-UHFFFAOYSA-N 1 2 318.467 4.136 20 0 DIADLO COCc1ccc(C[N@@H+](C)Cc2nc3ccccc3s2)s1 ZINC001139825182 1046526181 /nfs/dbraw/zinc/52/61/81/1046526181.db2.gz AOKNXCGTCKYXOS-UHFFFAOYSA-N 1 2 318.467 4.136 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@@H]2CC2CCCCC2)c(C)c[nH+]1 ZINC000536618117 1046532655 /nfs/dbraw/zinc/53/26/55/1046532655.db2.gz GXWYFYGXZFLTKN-QGZVFWFLSA-N 1 2 315.461 4.087 20 0 DIADLO CC(C)c1csc(C[NH2+][C@@H](C)c2ccnn2C2CCC2)n1 ZINC000925281984 1046537096 /nfs/dbraw/zinc/53/70/96/1046537096.db2.gz GOXUQNVZHMLREL-LBPRGKRZSA-N 1 2 304.463 4.039 20 0 DIADLO Cc1nn(C[N@H+]2C[C@@H](c3ccc(C)cc3)C[C@H]2C)c(=S)s1 ZINC000782951563 1046547316 /nfs/dbraw/zinc/54/73/16/1046547316.db2.gz CULSFTPVNXDFHL-DOMZBBRYSA-N 1 2 319.499 4.126 20 0 DIADLO Cc1nn(C[N@@H+]2C[C@@H](c3ccc(C)cc3)C[C@H]2C)c(=S)s1 ZINC000782951563 1046547324 /nfs/dbraw/zinc/54/73/24/1046547324.db2.gz CULSFTPVNXDFHL-DOMZBBRYSA-N 1 2 319.499 4.126 20 0 DIADLO Cc1[nH]c2ccccc2c1C1=CC[N@H+](Cc2nccs2)CC1 ZINC000135195939 1046553452 /nfs/dbraw/zinc/55/34/52/1046553452.db2.gz IWGZPLWQIZOLDY-UHFFFAOYSA-N 1 2 309.438 4.222 20 0 DIADLO Cc1[nH]c2ccccc2c1C1=CC[N@@H+](Cc2nccs2)CC1 ZINC000135195939 1046553455 /nfs/dbraw/zinc/55/34/55/1046553455.db2.gz IWGZPLWQIZOLDY-UHFFFAOYSA-N 1 2 309.438 4.222 20 0 DIADLO C[C@H]([NH2+]Cc1ccnc(Oc2ccccc2)c1)c1cscn1 ZINC000678113182 1046554602 /nfs/dbraw/zinc/55/46/02/1046554602.db2.gz IBGCXTXGYIPBSC-ZDUSSCGKSA-N 1 2 311.410 4.181 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@H](C)C(=O)Nc1cc(Cl)ccc1C ZINC000055082529 1046559031 /nfs/dbraw/zinc/55/90/31/1046559031.db2.gz BOKWKYPOVLZWLR-GFCCVEGCSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1occc1C[N@H+](C)[C@H](C)C(=O)Nc1cc(Cl)ccc1C ZINC000055082529 1046559042 /nfs/dbraw/zinc/55/90/42/1046559042.db2.gz BOKWKYPOVLZWLR-GFCCVEGCSA-N 1 2 320.820 4.009 20 0 DIADLO c1cc2n(n1)CCC[C@@H]2[NH2+]Cc1csc(C2CCCCC2)n1 ZINC000640218859 1046559779 /nfs/dbraw/zinc/55/97/79/1046559779.db2.gz XIBCIGVUUAUMFN-HNNXBMFYSA-N 1 2 316.474 4.012 20 0 DIADLO C[N@H+](CCc1cccc(Cl)c1)Cc1csc(Cl)n1 ZINC001139977653 1046562224 /nfs/dbraw/zinc/56/22/24/1046562224.db2.gz AYMWERSGQUJBCY-UHFFFAOYSA-N 1 2 301.242 4.124 20 0 DIADLO C[N@@H+](CCc1cccc(Cl)c1)Cc1csc(Cl)n1 ZINC001139977653 1046562240 /nfs/dbraw/zinc/56/22/40/1046562240.db2.gz AYMWERSGQUJBCY-UHFFFAOYSA-N 1 2 301.242 4.124 20 0 DIADLO CC(C)Oc1cccc(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)c1 ZINC000783225913 1046564402 /nfs/dbraw/zinc/56/44/02/1046564402.db2.gz ZCPZSQLMHUTNMS-IBGZPJMESA-N 1 2 321.424 4.076 20 0 DIADLO O=C(Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1(C2CC2)CC1 ZINC000888222539 1046564360 /nfs/dbraw/zinc/56/43/60/1046564360.db2.gz LLOVGZCVCVMJKR-UHFFFAOYSA-N 1 2 321.424 4.015 20 0 DIADLO C[N@H+](Cc1nc2ccccc2s1)Cc1cc2ccccc2cn1 ZINC001139995852 1046566728 /nfs/dbraw/zinc/56/67/28/1046566728.db2.gz QKPOQDQHYVCLEV-UHFFFAOYSA-N 1 2 319.433 4.477 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2s1)Cc1cc2ccccc2cn1 ZINC001139995852 1046566739 /nfs/dbraw/zinc/56/67/39/1046566739.db2.gz QKPOQDQHYVCLEV-UHFFFAOYSA-N 1 2 319.433 4.477 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1ccccc1-c1cncnc1)C2 ZINC001140021065 1046568917 /nfs/dbraw/zinc/56/89/17/1046568917.db2.gz KEESXXDOCCYJSC-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1ccccc1-c1cncnc1)C2 ZINC001140021065 1046568929 /nfs/dbraw/zinc/56/89/29/1046568929.db2.gz KEESXXDOCCYJSC-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO c1ccc([C@@H]2CC[C@@H]([NH2+]c3ccc(N4CCOCC4)cc3)C2)cc1 ZINC000783267892 1046571316 /nfs/dbraw/zinc/57/13/16/1046571316.db2.gz LUZGFFAPXMJVIL-UYAOXDASSA-N 1 2 322.452 4.271 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccc(OCCC(C)C)cc1F ZINC001202994093 1046571424 /nfs/dbraw/zinc/57/14/24/1046571424.db2.gz VPXPOUBGWCGCJI-UHFFFAOYSA-N 1 2 319.424 4.469 20 0 DIADLO CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)[N@H+](C)Cc1ccco1 ZINC000057875886 1046572544 /nfs/dbraw/zinc/57/25/44/1046572544.db2.gz ISQIVNKMERRUCJ-LSDHHAIUSA-N 1 2 314.429 4.252 20 0 DIADLO CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccco1 ZINC000057875886 1046572556 /nfs/dbraw/zinc/57/25/56/1046572556.db2.gz ISQIVNKMERRUCJ-LSDHHAIUSA-N 1 2 314.429 4.252 20 0 DIADLO CSc1nccc(C[N@H+](C)[C@H](C)c2ccccc2Cl)n1 ZINC001140038672 1046575465 /nfs/dbraw/zinc/57/54/65/1046575465.db2.gz DFYZJQPUAVNQCC-LLVKDONJSA-N 1 2 307.850 4.045 20 0 DIADLO CSc1nccc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)n1 ZINC001140038672 1046575481 /nfs/dbraw/zinc/57/54/81/1046575481.db2.gz DFYZJQPUAVNQCC-LLVKDONJSA-N 1 2 307.850 4.045 20 0 DIADLO CSc1nccc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)n1 ZINC001140036877 1046575553 /nfs/dbraw/zinc/57/55/53/1046575553.db2.gz ODLNDMHTFGUSTF-HNNXBMFYSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1nccc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)n1 ZINC001140036877 1046575567 /nfs/dbraw/zinc/57/55/67/1046575567.db2.gz ODLNDMHTFGUSTF-HNNXBMFYSA-N 1 2 319.861 4.189 20 0 DIADLO C[N@H+](Cc1ccc(C(F)(F)F)cc1)Cc1cc(O)ccc1F ZINC001140051152 1046576210 /nfs/dbraw/zinc/57/62/10/1046576210.db2.gz FLJULQAECVGWFX-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cc1cc(O)ccc1F ZINC001140051152 1046576224 /nfs/dbraw/zinc/57/62/24/1046576224.db2.gz FLJULQAECVGWFX-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO COc1ccsc1C[N@@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000678172348 1046576477 /nfs/dbraw/zinc/57/64/77/1046576477.db2.gz WVBWMSFEGVXZBX-UHFFFAOYSA-N 1 2 312.438 4.105 20 0 DIADLO COc1ccsc1C[N@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000678172348 1046576484 /nfs/dbraw/zinc/57/64/84/1046576484.db2.gz WVBWMSFEGVXZBX-UHFFFAOYSA-N 1 2 312.438 4.105 20 0 DIADLO CC[C@H]1c2ccsc2CC[N@H+]1Cc1cn2cccc(F)c2n1 ZINC000678177540 1046578173 /nfs/dbraw/zinc/57/81/73/1046578173.db2.gz FRMYVBXWMQJSPQ-HNNXBMFYSA-N 1 2 315.417 4.044 20 0 DIADLO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1cn2cccc(F)c2n1 ZINC000678177540 1046578184 /nfs/dbraw/zinc/57/81/84/1046578184.db2.gz FRMYVBXWMQJSPQ-HNNXBMFYSA-N 1 2 315.417 4.044 20 0 DIADLO COc1c(Cl)cccc1C[N@@H+]1CCc2ccc(F)cc2C1 ZINC001140062333 1046581633 /nfs/dbraw/zinc/58/16/33/1046581633.db2.gz STYCIAACQQUZAG-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1c(Cl)cccc1C[N@H+]1CCc2ccc(F)cc2C1 ZINC001140062333 1046581648 /nfs/dbraw/zinc/58/16/48/1046581648.db2.gz STYCIAACQQUZAG-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1c(Cl)cccc1C[N@@H+]1CCOC[C@@H]1C1CCCCC1 ZINC001140063475 1046582748 /nfs/dbraw/zinc/58/27/48/1046582748.db2.gz WIGLHCALIYITLT-QGZVFWFLSA-N 1 2 323.864 4.130 20 0 DIADLO COc1c(Cl)cccc1C[N@H+]1CCOC[C@@H]1C1CCCCC1 ZINC001140063475 1046582757 /nfs/dbraw/zinc/58/27/57/1046582757.db2.gz WIGLHCALIYITLT-QGZVFWFLSA-N 1 2 323.864 4.130 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1cnc(Br)cc1Cl ZINC001140078585 1046584874 /nfs/dbraw/zinc/58/48/74/1046584874.db2.gz MDPCSPROGFXLHD-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1cnc(Br)cc1Cl ZINC001140078585 1046584889 /nfs/dbraw/zinc/58/48/89/1046584889.db2.gz MDPCSPROGFXLHD-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cnc(Br)cc2Cl)[C@@H](C)C1 ZINC001140078509 1046586508 /nfs/dbraw/zinc/58/65/08/1046586508.db2.gz IPPRBSRQGXSSSB-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cnc(Br)cc2Cl)[C@@H](C)C1 ZINC001140078509 1046586520 /nfs/dbraw/zinc/58/65/20/1046586520.db2.gz IPPRBSRQGXSSSB-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO c1cn(-c2ccc(CNc3ccccc3OCC3CC3)cc2)c[nH+]1 ZINC000236724193 1046589517 /nfs/dbraw/zinc/58/95/17/1046589517.db2.gz WXJRVBZUTHSXQS-UHFFFAOYSA-N 1 2 319.408 4.273 20 0 DIADLO Brc1csc(C[N@H+]2CCC[C@@H]2c2ccccn2)c1 ZINC000536637830 1046601893 /nfs/dbraw/zinc/60/18/93/1046601893.db2.gz UORKPQFZWKPTJL-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1csc(C[N@@H+]2CCC[C@H]2c2ccccn2)c1 ZINC000536637826 1046601852 /nfs/dbraw/zinc/60/18/52/1046601852.db2.gz UORKPQFZWKPTJL-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1csc(C[N@H+]2CCC[C@H]2c2ccccn2)c1 ZINC000536637826 1046601855 /nfs/dbraw/zinc/60/18/55/1046601855.db2.gz UORKPQFZWKPTJL-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1csc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1 ZINC000536637830 1046601888 /nfs/dbraw/zinc/60/18/88/1046601888.db2.gz UORKPQFZWKPTJL-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO CC(C)=CCC[C@@H](C)[NH2+]c1ccc(N2CCOCC2)c(C)c1 ZINC000783538040 1046605692 /nfs/dbraw/zinc/60/56/92/1046605692.db2.gz VAAHBBHYLREJIE-QGZVFWFLSA-N 1 2 302.462 4.378 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@@H](C(F)F)C2)ccc1Br ZINC001140213053 1046615805 /nfs/dbraw/zinc/61/58/05/1046615805.db2.gz OLGJTWYQTBFCOX-SNVBAGLBSA-N 1 2 322.168 4.065 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@@H](C(F)F)C2)ccc1Br ZINC001140213053 1046615809 /nfs/dbraw/zinc/61/58/09/1046615809.db2.gz OLGJTWYQTBFCOX-SNVBAGLBSA-N 1 2 322.168 4.065 20 0 DIADLO COc1ccc(Nc2cccc3[nH+]c(C)cn32)cc1OC(C)C ZINC001203014070 1046621540 /nfs/dbraw/zinc/62/15/40/1046621540.db2.gz WETFRMULWUCXQY-UHFFFAOYSA-N 1 2 311.385 4.182 20 0 DIADLO Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1 ZINC000678339071 1046622079 /nfs/dbraw/zinc/62/20/79/1046622079.db2.gz MVHHOOGJAKMGQE-INIZCTEOSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1 ZINC000678339071 1046622082 /nfs/dbraw/zinc/62/20/82/1046622082.db2.gz MVHHOOGJAKMGQE-INIZCTEOSA-N 1 2 324.255 4.372 20 0 DIADLO CC(C)(C)c1noc(C[N@H+](C2CC2)[C@H]2CCc3ccccc32)n1 ZINC000533028409 1046640381 /nfs/dbraw/zinc/64/03/81/1046640381.db2.gz FNEHINHBNDUEMP-INIZCTEOSA-N 1 2 311.429 4.019 20 0 DIADLO CC(C)(C)c1noc(C[N@@H+](C2CC2)[C@H]2CCc3ccccc32)n1 ZINC000533028409 1046640391 /nfs/dbraw/zinc/64/03/91/1046640391.db2.gz FNEHINHBNDUEMP-INIZCTEOSA-N 1 2 311.429 4.019 20 0 DIADLO O=C1CCC[N@@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC001140294957 1046641715 /nfs/dbraw/zinc/64/17/15/1046641715.db2.gz XGFOKWDIHWWICM-UHFFFAOYSA-N 1 2 320.845 4.019 20 0 DIADLO O=C1CCC[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC001140294957 1046641724 /nfs/dbraw/zinc/64/17/24/1046641724.db2.gz XGFOKWDIHWWICM-UHFFFAOYSA-N 1 2 320.845 4.019 20 0 DIADLO CCC1(O)CCC(Nc2cc(C(C)C)[nH+]c(C(C)C)n2)CC1 ZINC000678482089 1046645358 /nfs/dbraw/zinc/64/53/58/1046645358.db2.gz XTTUCJQJJYFNGP-UHFFFAOYSA-N 1 2 305.466 4.219 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CCc3ccc([C@@H]4C[C@H]4C)o3)cc2[nH+]1 ZINC000643247968 1046651593 /nfs/dbraw/zinc/65/15/93/1046651593.db2.gz PQDJSFRSZOABFE-IAQYHMDHSA-N 1 2 323.396 4.159 20 0 DIADLO C[C@@H]([NH2+]Cc1ccnc(Oc2ccccc2)c1)c1nccs1 ZINC000678541747 1046653121 /nfs/dbraw/zinc/65/31/21/1046653121.db2.gz IHYDDIMGCCSLRL-CYBMUJFWSA-N 1 2 311.410 4.181 20 0 DIADLO CCC[C@@H]([NH2+]c1ccc(N2CCC(O)CC2)cc1)C1CCC1 ZINC000834709919 1046653676 /nfs/dbraw/zinc/65/36/76/1046653676.db2.gz OHSSYGYHQTWMMB-LJQANCHMSA-N 1 2 302.462 4.028 20 0 DIADLO CCSc1nn(C[N@H+]2CC[C@H](C(C)(C)C)C2)c(=S)s1 ZINC000784036869 1046654346 /nfs/dbraw/zinc/65/43/46/1046654346.db2.gz VACMCEXTFFTOOA-JTQLQIEISA-N 1 2 317.549 4.112 20 0 DIADLO CCSc1nn(C[N@@H+]2CC[C@H](C(C)(C)C)C2)c(=S)s1 ZINC000784036869 1046654343 /nfs/dbraw/zinc/65/43/43/1046654343.db2.gz VACMCEXTFFTOOA-JTQLQIEISA-N 1 2 317.549 4.112 20 0 DIADLO C[C@@H]1CC[C@H]([NH2+]Cc2nnc(-c3ccccc3)[nH]2)c2sccc21 ZINC000834741207 1046660328 /nfs/dbraw/zinc/66/03/28/1046660328.db2.gz KTGDCWVJKZOERK-DOMZBBRYSA-N 1 2 324.453 4.261 20 0 DIADLO C[C@@H]1CC[C@H]([NH2+]Cc2nc(-c3ccccc3)n[nH]2)c2sccc21 ZINC000834741207 1046660331 /nfs/dbraw/zinc/66/03/31/1046660331.db2.gz KTGDCWVJKZOERK-DOMZBBRYSA-N 1 2 324.453 4.261 20 0 DIADLO C[C@H]1CC[C@H]([NH2+]Cc2nnc(-c3ccccc3)[nH]2)c2sccc21 ZINC000834741210 1046660360 /nfs/dbraw/zinc/66/03/60/1046660360.db2.gz KTGDCWVJKZOERK-WFASDCNBSA-N 1 2 324.453 4.261 20 0 DIADLO C[C@H]1CC[C@H]([NH2+]Cc2nc(-c3ccccc3)n[nH]2)c2sccc21 ZINC000834741210 1046660368 /nfs/dbraw/zinc/66/03/68/1046660368.db2.gz KTGDCWVJKZOERK-WFASDCNBSA-N 1 2 324.453 4.261 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H]2CCOc3ccc(F)cc32)c(C)s1 ZINC000678584014 1046662631 /nfs/dbraw/zinc/66/26/31/1046662631.db2.gz KWUOJCCDPUZPCY-XPTSAGLGSA-N 1 2 306.406 4.073 20 0 DIADLO O=C1c2cccc3cccc(c23)N1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000054493829 1046672130 /nfs/dbraw/zinc/67/21/30/1046672130.db2.gz IUJXKVGBVJVJAH-GOSISDBHSA-N 1 2 314.388 4.205 20 0 DIADLO O=C1c2cccc3cccc(c23)N1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000054493829 1046672137 /nfs/dbraw/zinc/67/21/37/1046672137.db2.gz IUJXKVGBVJVJAH-GOSISDBHSA-N 1 2 314.388 4.205 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cc(C)nc(Cl)c1 ZINC000795789035 1046679280 /nfs/dbraw/zinc/67/92/80/1046679280.db2.gz GIDZUQLGZRXRFG-UHFFFAOYSA-N 1 2 318.783 4.164 20 0 DIADLO CC[C@@H]([NH2+][C@@H]1CCn2ccnc21)c1ccc(Cl)cc1Cl ZINC000834835709 1046680075 /nfs/dbraw/zinc/68/00/75/1046680075.db2.gz IPQSSTALYOKRJF-ZIAGYGMSSA-N 1 2 310.228 4.376 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nc(-c3ccccc3C)no2)cc1 ZINC000678735181 1046691651 /nfs/dbraw/zinc/69/16/51/1046691651.db2.gz OWBPVSWYHFMDNH-HNNXBMFYSA-N 1 2 307.397 4.204 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1noc2c1CCCC2 ZINC000678743711 1046693344 /nfs/dbraw/zinc/69/33/44/1046693344.db2.gz HNSRYSZAAFNTNL-AWEZNQCLSA-N 1 2 314.429 4.191 20 0 DIADLO FC(F)C[NH2+][C@H](c1ccc(Br)cc1)C1CCC1 ZINC000678756686 1046694543 /nfs/dbraw/zinc/69/45/43/1046694543.db2.gz NZSPFYLRRKKQFT-ZDUSSCGKSA-N 1 2 304.178 4.145 20 0 DIADLO CCc1noc(C[NH2+][C@@H](CCc2ccccc2)c2ccccc2)n1 ZINC000678755063 1046694559 /nfs/dbraw/zinc/69/45/59/1046694559.db2.gz QBFYXJNBLGRNEC-SFHVURJKSA-N 1 2 321.424 4.096 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@@H](C)c2nccn2C)c2ccccc2)cc1 ZINC000678763419 1046694996 /nfs/dbraw/zinc/69/49/96/1046694996.db2.gz FQARDPCHISAJOL-QFBILLFUSA-N 1 2 305.425 4.169 20 0 DIADLO CCc1noc(C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)n1 ZINC000678762823 1046695556 /nfs/dbraw/zinc/69/55/56/1046695556.db2.gz PIWIYWKKXLISTF-AWEZNQCLSA-N 1 2 323.396 4.275 20 0 DIADLO CCc1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCCC2)n1 ZINC000678767770 1046696625 /nfs/dbraw/zinc/69/66/25/1046696625.db2.gz RGBHKTHLSACGDB-QGZVFWFLSA-N 1 2 319.836 4.307 20 0 DIADLO c1ccc([C@@H](CC2CC2)[NH2+]Cc2nc(C3CCCC3)no2)cc1 ZINC000678778293 1046699923 /nfs/dbraw/zinc/69/99/23/1046699923.db2.gz WAXUNSNTFHOYPZ-QGZVFWFLSA-N 1 2 311.429 4.358 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CCSc3cc(C)c(C)cc32)co1 ZINC000834896396 1046707048 /nfs/dbraw/zinc/70/70/48/1046707048.db2.gz AMDREHKMTZLKNX-OAHLLOKOSA-N 1 2 302.443 4.181 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CCSc3cc(C)c(C)cc32)co1 ZINC000834896395 1046707625 /nfs/dbraw/zinc/70/76/25/1046707625.db2.gz AMDREHKMTZLKNX-HNNXBMFYSA-N 1 2 302.443 4.181 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2ccc(SC(F)F)cc2)co1 ZINC000834899601 1046709629 /nfs/dbraw/zinc/70/96/29/1046709629.db2.gz IHXXDXVEADVCKX-SNVBAGLBSA-N 1 2 312.385 4.403 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CCSc3ccc(Cl)cc32)co1 ZINC000834901350 1046710809 /nfs/dbraw/zinc/71/08/09/1046710809.db2.gz SLLBVFWEROABTM-ZDUSSCGKSA-N 1 2 308.834 4.217 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2ccc(OC(C)(C)C)cc2)co1 ZINC000834900569 1046711053 /nfs/dbraw/zinc/71/10/53/1046711053.db2.gz VEFHOEJNOJCIII-ZDUSSCGKSA-N 1 2 302.418 4.265 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2ccc(OCC(C)C)cc2)co1 ZINC000834901603 1046712703 /nfs/dbraw/zinc/71/27/03/1046712703.db2.gz WSWKXJRDRLMINP-CQSZACIVSA-N 1 2 302.418 4.123 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc3ccc(Cl)cn23)Cc2ccccc21 ZINC001140426388 1046717910 /nfs/dbraw/zinc/71/79/10/1046717910.db2.gz LCSBVEBJMRGHAH-CYBMUJFWSA-N 1 2 311.816 4.107 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc3ccc(Cl)cn23)Cc2ccccc21 ZINC001140426388 1046717923 /nfs/dbraw/zinc/71/79/23/1046717923.db2.gz LCSBVEBJMRGHAH-CYBMUJFWSA-N 1 2 311.816 4.107 20 0 DIADLO Fc1cc(F)cc([C@H]2CCC[N@@H+]2Cc2[nH]nc3ccccc32)c1 ZINC001137353366 1046721074 /nfs/dbraw/zinc/72/10/74/1046721074.db2.gz NGYOAMCWMITZMA-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1cc(F)cc([C@H]2CCC[N@H+]2Cc2[nH]nc3ccccc32)c1 ZINC001137353366 1046721091 /nfs/dbraw/zinc/72/10/91/1046721091.db2.gz NGYOAMCWMITZMA-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1cc(F)cc([C@H]2CCC[N@@H+]2Cc2n[nH]c3ccccc32)c1 ZINC001137353366 1046721107 /nfs/dbraw/zinc/72/11/07/1046721107.db2.gz NGYOAMCWMITZMA-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1cc(F)cc([C@H]2CCC[N@H+]2Cc2n[nH]c3ccccc32)c1 ZINC001137353366 1046721123 /nfs/dbraw/zinc/72/11/23/1046721123.db2.gz NGYOAMCWMITZMA-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO FC(F)(F)c1ccc(Cl)c(C[N@@H+]2CCC[C@@]3(CCO3)C2)c1 ZINC001138085426 1046723740 /nfs/dbraw/zinc/72/37/40/1046723740.db2.gz DULFHCRUNYTATD-CQSZACIVSA-N 1 2 319.754 4.114 20 0 DIADLO FC(F)(F)c1ccc(Cl)c(C[N@H+]2CCC[C@@]3(CCO3)C2)c1 ZINC001138085426 1046723750 /nfs/dbraw/zinc/72/37/50/1046723750.db2.gz DULFHCRUNYTATD-CQSZACIVSA-N 1 2 319.754 4.114 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cc1Br ZINC000533487731 1046737405 /nfs/dbraw/zinc/73/74/05/1046737405.db2.gz YTSFPPRHFMXVFV-HNNXBMFYSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)cc1Br ZINC000533487731 1046737418 /nfs/dbraw/zinc/73/74/18/1046737418.db2.gz YTSFPPRHFMXVFV-HNNXBMFYSA-N 1 2 323.209 4.253 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2nc3c(s2)CCCC3)o1 ZINC000678945148 1046740517 /nfs/dbraw/zinc/74/05/17/1046740517.db2.gz CMQSTIASXKTBAI-WCQYABFASA-N 1 2 302.443 4.028 20 0 DIADLO COc1cc(F)cc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c1 ZINC001140482841 1046743942 /nfs/dbraw/zinc/74/39/42/1046743942.db2.gz DAUBJEANJBSMTJ-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)cc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)c1 ZINC001140482841 1046743956 /nfs/dbraw/zinc/74/39/56/1046743956.db2.gz DAUBJEANJBSMTJ-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ncc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccco2)cc1Cl ZINC000533558636 1046753661 /nfs/dbraw/zinc/75/36/61/1046753661.db2.gz XPHKMLSVVWTIMU-SWLSCSKDSA-N 1 2 320.820 4.310 20 0 DIADLO COc1ncc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccco2)cc1Cl ZINC000533558636 1046753677 /nfs/dbraw/zinc/75/36/77/1046753677.db2.gz XPHKMLSVVWTIMU-SWLSCSKDSA-N 1 2 320.820 4.310 20 0 DIADLO CC[C@H](C)Oc1cccc(NC(=O)Nc2ccc3[nH+]ccn3c2)c1 ZINC000645009759 1046754384 /nfs/dbraw/zinc/75/43/84/1046754384.db2.gz ABFDNUPSVPXBEC-ZDUSSCGKSA-N 1 2 324.384 4.156 20 0 DIADLO CC(C)[C@H]1CC[C@H]1[NH2+]c1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000796916808 1046759665 /nfs/dbraw/zinc/75/96/65/1046759665.db2.gz IGDSNQHDZRHJEN-OHDICMOHSA-N 1 2 302.462 4.147 20 0 DIADLO Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]Cc1cocn1 ZINC000679047683 1046765521 /nfs/dbraw/zinc/76/55/21/1046765521.db2.gz JJWQMCIKTXBRSV-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H]2CCC(C)C)c(C)[nH+]1 ZINC000455476423 1046768208 /nfs/dbraw/zinc/76/82/08/1046768208.db2.gz DUUYDENLMAOQLN-MRXNPFEDSA-N 1 2 303.450 4.439 20 0 DIADLO Oc1cccc(C[NH2+][C@@H](c2ccccc2)c2cccnc2)c1Cl ZINC000645151888 1046770696 /nfs/dbraw/zinc/77/06/96/1046770696.db2.gz CDFUTFOHIAMYJI-IBGZPJMESA-N 1 2 324.811 4.320 20 0 DIADLO Oc1cccc(C[NH2+][C@@H](c2ccccc2)c2ccncc2)c1Cl ZINC000645150596 1046771058 /nfs/dbraw/zinc/77/10/58/1046771058.db2.gz HPPAILIWMJVPSL-IBGZPJMESA-N 1 2 324.811 4.320 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC=C(c3ccccc3C)C2)c(C)[nH+]1 ZINC000455478361 1046771824 /nfs/dbraw/zinc/77/18/24/1046771824.db2.gz FRLMNEABHNDNDW-UHFFFAOYSA-N 1 2 321.424 4.246 20 0 DIADLO Cc1cc(C)c(NC(=O)N(Cc2ccccc2)C(C)C)c(C)[nH+]1 ZINC000455491191 1046774276 /nfs/dbraw/zinc/77/42/76/1046774276.db2.gz YAPXGIKNOBRRCU-UHFFFAOYSA-N 1 2 311.429 4.449 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)c(C)[nH+]1 ZINC000455490755 1046774334 /nfs/dbraw/zinc/77/43/34/1046774334.db2.gz XQDZDZPOEGMDSC-QAPCUYQASA-N 1 2 323.440 4.417 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cccc(O)c2Br)cc1 ZINC001140548645 1046775867 /nfs/dbraw/zinc/77/58/67/1046775867.db2.gz ROAMIPYFDTZRCB-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cccc(O)c2Br)cc1 ZINC001140548645 1046775879 /nfs/dbraw/zinc/77/58/79/1046775879.db2.gz ROAMIPYFDTZRCB-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1ccc(O)c(CNc2[nH+]c3ccccc3n2C2CCCC2)n1 ZINC000679117335 1046776158 /nfs/dbraw/zinc/77/61/58/1046776158.db2.gz CEZIQIDKRRWINK-UHFFFAOYSA-N 1 2 322.412 4.173 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](C)[C@H](C)c2ccccc2)c(C)[nH+]1 ZINC000455500068 1046777866 /nfs/dbraw/zinc/77/78/66/1046777866.db2.gz SRSOHEQROYJMOI-LSDHHAIUSA-N 1 2 311.429 4.321 20 0 DIADLO CCC[C@]1(C)CCCN(C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000455507182 1046778856 /nfs/dbraw/zinc/77/88/56/1046778856.db2.gz YQNGOVVATLMLGM-GOSISDBHSA-N 1 2 303.450 4.441 20 0 DIADLO CCS[C@H]1CC[C@H](N(C)C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000455508413 1046779280 /nfs/dbraw/zinc/77/92/80/1046779280.db2.gz ZTSRTLATPQRLKW-GJZGRUSLSA-N 1 2 321.490 4.145 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000067922576 1046788332 /nfs/dbraw/zinc/78/83/32/1046788332.db2.gz DQFDGTDTWXOALS-MRXNPFEDSA-N 1 2 305.466 4.043 20 0 DIADLO Cc1ccc([C@H]2CCCN2C(=O)NCc2c[nH+]c(C)cc2C)cc1 ZINC000455554350 1046793135 /nfs/dbraw/zinc/79/31/35/1046793135.db2.gz ICQFNTJAZVPAGN-LJQANCHMSA-N 1 2 323.440 4.054 20 0 DIADLO Clc1cc(C[N@@H+]2CC[C@@]3(C2)CCCCO3)c(Cl)s1 ZINC001140584915 1046795812 /nfs/dbraw/zinc/79/58/12/1046795812.db2.gz JVKLWSZVAWEPJQ-CYBMUJFWSA-N 1 2 306.258 4.200 20 0 DIADLO Clc1cc(C[N@H+]2CC[C@@]3(C2)CCCCO3)c(Cl)s1 ZINC001140584915 1046795818 /nfs/dbraw/zinc/79/58/18/1046795818.db2.gz JVKLWSZVAWEPJQ-CYBMUJFWSA-N 1 2 306.258 4.200 20 0 DIADLO Cc1cccc(-c2nc(CC(=O)Nc3cc[nH+]c(C)c3)cs2)c1 ZINC000072904415 1046798199 /nfs/dbraw/zinc/79/81/99/1046798199.db2.gz OZIWMIMPEHOKDX-UHFFFAOYSA-N 1 2 323.421 4.003 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)ncc2F)c1 ZINC001140610943 1046808193 /nfs/dbraw/zinc/80/81/93/1046808193.db2.gz PSWYJXJRYXQZNI-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2cc(Cl)ncc2F)c1 ZINC001140610943 1046808203 /nfs/dbraw/zinc/80/82/03/1046808203.db2.gz PSWYJXJRYXQZNI-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(Cl)ncc1F ZINC001140609242 1046808569 /nfs/dbraw/zinc/80/85/69/1046808569.db2.gz QLKDHXCRTKDLRI-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc(Cl)ncc1F ZINC001140609242 1046808596 /nfs/dbraw/zinc/80/85/96/1046808596.db2.gz QLKDHXCRTKDLRI-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)[C@H](C)c2cccc(C)c2)n1 ZINC000247320280 1046829639 /nfs/dbraw/zinc/82/96/39/1046829639.db2.gz WDGDXVRROHPDGS-ZIAGYGMSSA-N 1 2 319.474 4.385 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)[C@H](C)c2cccc(C)c2)n1 ZINC000247320280 1046829665 /nfs/dbraw/zinc/82/96/65/1046829665.db2.gz WDGDXVRROHPDGS-ZIAGYGMSSA-N 1 2 319.474 4.385 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+][C@H](CCc1ccccc1)C(F)F ZINC000679387836 1046833727 /nfs/dbraw/zinc/83/37/27/1046833727.db2.gz FVAMBYFTBAAEQZ-WMLDXEAASA-N 1 2 304.384 4.307 20 0 DIADLO Cc1cccc(-c2noc(C[NH2+]C3(c4ccccc4C)CC3)n2)c1 ZINC000645979523 1046837876 /nfs/dbraw/zinc/83/78/76/1046837876.db2.gz PGTFXUFCJSVHRO-UHFFFAOYSA-N 1 2 319.408 4.132 20 0 DIADLO Cc1cccc([C@H]2CCCC[N@@H+]2Cc2noc(C3CC3)n2)c1C ZINC000075999652 1046840007 /nfs/dbraw/zinc/84/00/07/1046840007.db2.gz KOOUZFFGBPZAOH-QGZVFWFLSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1cccc([C@H]2CCCC[N@H+]2Cc2noc(C3CC3)n2)c1C ZINC000075999652 1046840024 /nfs/dbraw/zinc/84/00/24/1046840024.db2.gz KOOUZFFGBPZAOH-QGZVFWFLSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2csc(C(C)C)n2)cc(C)c1O ZINC001140659259 1046841145 /nfs/dbraw/zinc/84/11/45/1046841145.db2.gz XAFPBJPVWVLZJO-UHFFFAOYSA-N 1 2 304.459 4.221 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2csc(C(C)C)n2)cc(C)c1O ZINC001140659259 1046841160 /nfs/dbraw/zinc/84/11/60/1046841160.db2.gz XAFPBJPVWVLZJO-UHFFFAOYSA-N 1 2 304.459 4.221 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cc(C(C)(C)C)on2)CC2CC2)cn1 ZINC000646020238 1046842975 /nfs/dbraw/zinc/84/29/75/1046842975.db2.gz QYPYAHUPCHXTDS-UHFFFAOYSA-N 1 2 313.445 4.088 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cc(C(C)(C)C)on2)CC2CC2)cn1 ZINC000646020238 1046842997 /nfs/dbraw/zinc/84/29/97/1046842997.db2.gz QYPYAHUPCHXTDS-UHFFFAOYSA-N 1 2 313.445 4.088 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3nnc(-c4ccccc4)o3)CCC2)c1 ZINC000646004732 1046843846 /nfs/dbraw/zinc/84/38/46/1046843846.db2.gz NBFJLWYEAFGPAO-UHFFFAOYSA-N 1 2 323.371 4.045 20 0 DIADLO Cc1ccc(C[N@H+](Cc2csc(C(C)C)n2)CC2CC2)cn1 ZINC000646019234 1046844866 /nfs/dbraw/zinc/84/48/66/1046844866.db2.gz WXCXHUQBEJWJIU-UHFFFAOYSA-N 1 2 315.486 4.382 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2csc(C(C)C)n2)CC2CC2)cn1 ZINC000646019234 1046844882 /nfs/dbraw/zinc/84/48/82/1046844882.db2.gz WXCXHUQBEJWJIU-UHFFFAOYSA-N 1 2 315.486 4.382 20 0 DIADLO Cn1c(Nc2cccc(Cn3cc[nH+]c3)c2)cc2ccccc21 ZINC001212047052 1046846549 /nfs/dbraw/zinc/84/65/49/1046846549.db2.gz WDADXABZEAKBSO-UHFFFAOYSA-N 1 2 302.381 4.167 20 0 DIADLO CCc1nocc1C[N@@H+]1CCC[C@@H]1c1nc2ccccc2s1 ZINC000646047626 1046848821 /nfs/dbraw/zinc/84/88/21/1046848821.db2.gz KNKUJEQTTANVDV-OAHLLOKOSA-N 1 2 313.426 4.184 20 0 DIADLO CCc1nocc1C[N@H+]1CCC[C@@H]1c1nc2ccccc2s1 ZINC000646047626 1046848843 /nfs/dbraw/zinc/84/88/43/1046848843.db2.gz KNKUJEQTTANVDV-OAHLLOKOSA-N 1 2 313.426 4.184 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2cc(-c3ccco3)on2)CCC1 ZINC000646026488 1046850362 /nfs/dbraw/zinc/85/03/62/1046850362.db2.gz QZFOOKMRGYGHPH-UHFFFAOYSA-N 1 2 312.344 4.243 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1nccn1C(F)F ZINC000076191529 1046851631 /nfs/dbraw/zinc/85/16/31/1046851631.db2.gz YWWGQXDEYJNOIY-LLVKDONJSA-N 1 2 305.328 4.217 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nccn1C(F)F ZINC000076191529 1046851649 /nfs/dbraw/zinc/85/16/49/1046851649.db2.gz YWWGQXDEYJNOIY-LLVKDONJSA-N 1 2 305.328 4.217 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2F)C2CC2)cc(Cl)n1 ZINC000797588977 1046857460 /nfs/dbraw/zinc/85/74/60/1046857460.db2.gz KRMJUVPMQHFWIM-UHFFFAOYSA-N 1 2 304.796 4.347 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2F)C2CC2)cc(Cl)n1 ZINC000797588977 1046857477 /nfs/dbraw/zinc/85/74/77/1046857477.db2.gz KRMJUVPMQHFWIM-UHFFFAOYSA-N 1 2 304.796 4.347 20 0 DIADLO Cc1cc(C[N@@H+]2CCSC[C@H]2c2ccccc2)cc(Cl)n1 ZINC000797589516 1046858101 /nfs/dbraw/zinc/85/81/01/1046858101.db2.gz VXENFHKMKQVFCT-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(C[N@H+]2CCSC[C@H]2c2ccccc2)cc(Cl)n1 ZINC000797589516 1046858119 /nfs/dbraw/zinc/85/81/19/1046858119.db2.gz VXENFHKMKQVFCT-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO C1=CCC2(C[N@@H+](Cc3ncc(C4CC4)o3)[C@@H]2c2ccccc2)C1 ZINC000646118272 1046859684 /nfs/dbraw/zinc/85/96/84/1046859684.db2.gz HAZIZAKIVMSMID-LJQANCHMSA-N 1 2 306.409 4.445 20 0 DIADLO C1=CCC2(C[N@H+](Cc3ncc(C4CC4)o3)[C@@H]2c2ccccc2)C1 ZINC000646118272 1046859708 /nfs/dbraw/zinc/85/97/08/1046859708.db2.gz HAZIZAKIVMSMID-LJQANCHMSA-N 1 2 306.409 4.445 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)cc(Cl)n1 ZINC000797594776 1046863500 /nfs/dbraw/zinc/86/35/00/1046863500.db2.gz URNDFTLPGGWGRJ-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO Cc1ccc(C2([NH2+]Cc3nc(-c4ccccc4)no3)CCC2)cc1 ZINC000646131854 1046864236 /nfs/dbraw/zinc/86/42/36/1046864236.db2.gz KXFROPNSOIUKJE-UHFFFAOYSA-N 1 2 319.408 4.214 20 0 DIADLO Fc1cc(C[NH+]2CCC(c3cccnc3)CC2)c(F)cc1Cl ZINC001140702590 1046865353 /nfs/dbraw/zinc/86/53/53/1046865353.db2.gz SJLWDXWHSHIAPS-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)Cc2ccccc2C)cs1 ZINC000076715811 1046865961 /nfs/dbraw/zinc/86/59/61/1046865961.db2.gz IJLPZPVWNXDSMQ-AWEZNQCLSA-N 1 2 304.459 4.181 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)Cc2ccccc2C)cs1 ZINC000076715811 1046865939 /nfs/dbraw/zinc/86/59/39/1046865939.db2.gz IJLPZPVWNXDSMQ-AWEZNQCLSA-N 1 2 304.459 4.181 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000679548512 1046866070 /nfs/dbraw/zinc/86/60/70/1046866070.db2.gz VDBZAJKXWWJIGG-KBPBESRZSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000679548512 1046866086 /nfs/dbraw/zinc/86/60/86/1046866086.db2.gz VDBZAJKXWWJIGG-KBPBESRZSA-N 1 2 323.362 4.035 20 0 DIADLO Cc1cc(C[NH2+][C@@H](COCC(C)C)c2ccco2)cc(Cl)n1 ZINC000797597060 1046866707 /nfs/dbraw/zinc/86/67/07/1046866707.db2.gz DQXWJSSTXGYTTG-HNNXBMFYSA-N 1 2 322.836 4.140 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cccc(O)c1Cl ZINC000646156443 1046869289 /nfs/dbraw/zinc/86/92/89/1046869289.db2.gz UQLYVOSSLURSIU-ONGXEEELSA-N 1 2 307.743 4.208 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cccc(O)c1Cl ZINC000646156443 1046869306 /nfs/dbraw/zinc/86/93/06/1046869306.db2.gz UQLYVOSSLURSIU-ONGXEEELSA-N 1 2 307.743 4.208 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](Cc1noc(C2CC2)n1)CC1CCC1 ZINC000077372526 1046881277 /nfs/dbraw/zinc/88/12/77/1046881277.db2.gz ZYZVWUMHXKRWGZ-AWEZNQCLSA-N 1 2 311.429 4.310 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](Cc1noc(C2CC2)n1)CC1CCC1 ZINC000077372526 1046881295 /nfs/dbraw/zinc/88/12/95/1046881295.db2.gz ZYZVWUMHXKRWGZ-AWEZNQCLSA-N 1 2 311.429 4.310 20 0 DIADLO O=C(/C=C/c1[nH]cc[nH+]1)c1ccc(Cl)c(Cl)c1Cl ZINC000067647701 1046881543 /nfs/dbraw/zinc/88/15/43/1046881543.db2.gz KGWDHICTGQLTEM-ONEGZZNKSA-N 1 2 301.560 4.266 20 0 DIADLO Cc1ccc(Br)c(C[NH+]2Cc3ccccc3C2)c1 ZINC001137380136 1046883147 /nfs/dbraw/zinc/88/31/47/1046883147.db2.gz AEHVOFNPGVWKNT-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO Cc1cc(Br)c(F)cc1C[NH+]1CCC(F)(F)CC1 ZINC001140794065 1046902978 /nfs/dbraw/zinc/90/29/78/1046902978.db2.gz WAIGRHBMXILVES-UHFFFAOYSA-N 1 2 322.168 4.128 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cccc(OC(C)(C)C)c3)cc2[nH+]1 ZINC001137392881 1046910566 /nfs/dbraw/zinc/91/05/66/1046910566.db2.gz ODXYNMXKSAKOSR-UHFFFAOYSA-N 1 2 323.396 4.301 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+]Cc1ncc(-c2ccc(F)cc2)o1 ZINC000679939074 1046912774 /nfs/dbraw/zinc/91/27/74/1046912774.db2.gz BHRDXPSEESTATK-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1cc(Br)ccc1C[N@@H+]1CCc2sccc2C1 ZINC001140815817 1046913790 /nfs/dbraw/zinc/91/37/90/1046913790.db2.gz KOMDQCXLENWAQN-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1cc(Br)ccc1C[N@H+]1CCc2sccc2C1 ZINC001140815817 1046913799 /nfs/dbraw/zinc/91/37/99/1046913799.db2.gz KOMDQCXLENWAQN-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO FC(F)(F)c1cccnc1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000666790379 1046914621 /nfs/dbraw/zinc/91/46/21/1046914621.db2.gz BLIGIFDXDVIYEW-UHFFFAOYSA-N 1 2 307.319 4.071 20 0 DIADLO Cc1nnc(C[N@@H+]2CCCCC[C@@H]2/C=C\c2cccs2)s1 ZINC000679951916 1046916554 /nfs/dbraw/zinc/91/65/54/1046916554.db2.gz CAUFMTJETLGEGQ-QIAWRQBBSA-N 1 2 319.499 4.366 20 0 DIADLO Cc1nnc(C[N@H+]2CCCCC[C@@H]2/C=C\c2cccs2)s1 ZINC000679951916 1046916569 /nfs/dbraw/zinc/91/65/69/1046916569.db2.gz CAUFMTJETLGEGQ-QIAWRQBBSA-N 1 2 319.499 4.366 20 0 DIADLO Cc1ccc(-c2cnc(C[NH2+][C@H](C)c3cnccc3C)o2)cc1 ZINC000679943688 1046917072 /nfs/dbraw/zinc/91/70/72/1046917072.db2.gz XQDOKWHSCAWHHL-OAHLLOKOSA-N 1 2 307.397 4.204 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1cc(Cl)c(O)c(Cl)c1 ZINC001140829711 1046918570 /nfs/dbraw/zinc/91/85/70/1046918570.db2.gz LPYQVCALLBHFBE-UHFFFAOYSA-N 1 2 311.212 4.116 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1cc(Cl)c(O)c(Cl)c1 ZINC001140829711 1046918576 /nfs/dbraw/zinc/91/85/76/1046918576.db2.gz LPYQVCALLBHFBE-UHFFFAOYSA-N 1 2 311.212 4.116 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1CCCCC[C@@H]1/C=C\c1cccs1 ZINC000680003020 1046925513 /nfs/dbraw/zinc/92/55/13/1046925513.db2.gz KRSQLMXWSQQNSC-HLRDLLSLSA-N 1 2 301.459 4.238 20 0 DIADLO CC[C@H]([NH2+][C@@H]1COCc2cccc(Cl)c21)c1c(C)noc1C ZINC000798181503 1046933562 /nfs/dbraw/zinc/93/35/62/1046933562.db2.gz KRBJBQFYANNKCX-LSDHHAIUSA-N 1 2 320.820 4.257 20 0 DIADLO C[N@H+](Cn1nc(-c2ccc(Cl)cc2)oc1=S)C1CCCC1 ZINC000798191817 1046934143 /nfs/dbraw/zinc/93/41/43/1046934143.db2.gz NJEJLSJAPNPMGY-UHFFFAOYSA-N 1 2 323.849 4.358 20 0 DIADLO C[N@@H+](Cn1nc(-c2ccc(Cl)cc2)oc1=S)C1CCCC1 ZINC000798191817 1046934154 /nfs/dbraw/zinc/93/41/54/1046934154.db2.gz NJEJLSJAPNPMGY-UHFFFAOYSA-N 1 2 323.849 4.358 20 0 DIADLO Cc1ccc(-c2nn(C[N@@H+](C)C3CCCC3)c(=S)o2)cc1 ZINC000798194007 1046935996 /nfs/dbraw/zinc/93/59/96/1046935996.db2.gz VCEDJYRZODMQQV-UHFFFAOYSA-N 1 2 303.431 4.013 20 0 DIADLO Cc1ccc(-c2nn(C[N@H+](C)C3CCCC3)c(=S)o2)cc1 ZINC000798194007 1046936008 /nfs/dbraw/zinc/93/60/08/1046936008.db2.gz VCEDJYRZODMQQV-UHFFFAOYSA-N 1 2 303.431 4.013 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1ccc(F)c(F)c1 ZINC000680040997 1046937242 /nfs/dbraw/zinc/93/72/42/1046937242.db2.gz DYSQFBIIAZQCRZ-XLKFXECMSA-N 1 2 311.278 4.027 20 0 DIADLO Nc1cccc(F)c1C[N@H+](Cc1ccccc1)Cc1ccncc1 ZINC001140872391 1046937547 /nfs/dbraw/zinc/93/75/47/1046937547.db2.gz CBNSCXZDFRVCNV-UHFFFAOYSA-N 1 2 321.399 4.005 20 0 DIADLO Nc1cccc(F)c1C[N@@H+](Cc1ccccc1)Cc1ccncc1 ZINC001140872391 1046937554 /nfs/dbraw/zinc/93/75/54/1046937554.db2.gz CBNSCXZDFRVCNV-UHFFFAOYSA-N 1 2 321.399 4.005 20 0 DIADLO Fc1cc(C[NH+]2Cc3ccccc3C2)ccc1OC(F)(F)F ZINC001140881559 1046941357 /nfs/dbraw/zinc/94/13/57/1046941357.db2.gz AHCQNVODAOVVRN-UHFFFAOYSA-N 1 2 311.278 4.240 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(O)c(F)c2F)c1 ZINC001140889817 1046944458 /nfs/dbraw/zinc/94/44/58/1046944458.db2.gz LRHKAKBQCXPWPI-HNNXBMFYSA-N 1 2 303.352 4.316 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1cnc(N)s1 ZINC000261732869 1046948292 /nfs/dbraw/zinc/94/82/92/1046948292.db2.gz HIRZHVPJUHOYKI-MRVPVSSYSA-N 1 2 316.257 4.225 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1cnc(N)s1 ZINC000261732869 1046948300 /nfs/dbraw/zinc/94/83/00/1046948300.db2.gz HIRZHVPJUHOYKI-MRVPVSSYSA-N 1 2 316.257 4.225 20 0 DIADLO CC[C@H](C)CCCCC(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC000680189074 1046955447 /nfs/dbraw/zinc/95/54/47/1046955447.db2.gz FKBMEAZVGGVZQU-AWEZNQCLSA-N 1 2 320.477 4.272 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1Cl)Cc1nccnc1C ZINC001140940018 1046956305 /nfs/dbraw/zinc/95/63/05/1046956305.db2.gz LOXRCRHTPXHYNQ-UHFFFAOYSA-N 1 2 310.228 4.114 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)cc1Cl)Cc1nccnc1C ZINC001140940018 1046956310 /nfs/dbraw/zinc/95/63/10/1046956310.db2.gz LOXRCRHTPXHYNQ-UHFFFAOYSA-N 1 2 310.228 4.114 20 0 DIADLO CCc1cnc(C[N@@H+]2CCCC[C@H]2c2ccccc2OC)s1 ZINC000680331374 1046963738 /nfs/dbraw/zinc/96/37/38/1046963738.db2.gz ZDIPTGGHHCRSBJ-INIZCTEOSA-N 1 2 316.470 4.441 20 0 DIADLO CCc1cnc(C[N@H+]2CCCC[C@H]2c2ccccc2OC)s1 ZINC000680331374 1046963748 /nfs/dbraw/zinc/96/37/48/1046963748.db2.gz ZDIPTGGHHCRSBJ-INIZCTEOSA-N 1 2 316.470 4.441 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)cc1F ZINC001140990905 1046971303 /nfs/dbraw/zinc/97/13/03/1046971303.db2.gz CHEARPHIVWBBLR-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO Clc1ccc(CCC2CC[NH+](Cc3csnn3)CC2)cc1 ZINC001140995620 1046972629 /nfs/dbraw/zinc/97/26/29/1046972629.db2.gz AHUCWCHHXKRTQC-UHFFFAOYSA-N 1 2 321.877 4.036 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1cc2n(n1)CCCC2 ZINC000647304438 1046973085 /nfs/dbraw/zinc/97/30/85/1046973085.db2.gz NCFBGGYVAJEQGQ-ZDUSSCGKSA-N 1 2 313.420 4.087 20 0 DIADLO C(c1nnc(C2CC2)s1)[NH+]1CCC(C2CCCCC2)CC1 ZINC000827425150 1046982507 /nfs/dbraw/zinc/98/25/07/1046982507.db2.gz GXUDQRICKNUKSN-UHFFFAOYSA-N 1 2 305.491 4.208 20 0 DIADLO Oc1cccc2ccc(C[N@@H+]3CCc4cccc(Cl)c4C3)nc12 ZINC001141024350 1046983107 /nfs/dbraw/zinc/98/31/07/1046983107.db2.gz MUYDHYQJQDHTCH-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1cccc2ccc(C[N@H+]3CCc4cccc(Cl)c4C3)nc12 ZINC001141024350 1046983113 /nfs/dbraw/zinc/98/31/13/1046983113.db2.gz MUYDHYQJQDHTCH-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO CCC[C@@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1cccnc1 ZINC000680466936 1046983810 /nfs/dbraw/zinc/98/38/10/1046983810.db2.gz BMLPWBMTAIOLSP-CQSZACIVSA-N 1 2 312.310 4.269 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](Cc1ccc(C)c(C)c1)C1CC1 ZINC000303810752 1046985633 /nfs/dbraw/zinc/98/56/33/1046985633.db2.gz CNUIOXCEILWASO-UHFFFAOYSA-N 1 2 317.864 4.163 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](Cc1ccc(C)c(C)c1)C1CC1 ZINC000303810752 1046985640 /nfs/dbraw/zinc/98/56/40/1046985640.db2.gz CNUIOXCEILWASO-UHFFFAOYSA-N 1 2 317.864 4.163 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000798931352 1046989323 /nfs/dbraw/zinc/98/93/23/1046989323.db2.gz KJNSUZPROHQJIG-IXDOHACOSA-N 1 2 302.462 4.068 20 0 DIADLO Cc1cc(N(C)C)ccc1[NH2+][C@@H]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000798931352 1046989338 /nfs/dbraw/zinc/98/93/38/1046989338.db2.gz KJNSUZPROHQJIG-IXDOHACOSA-N 1 2 302.462 4.068 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(SC(F)F)cc1)c1csnn1 ZINC000828702849 1046993130 /nfs/dbraw/zinc/99/31/30/1046993130.db2.gz BNHNSRSEAYEBQX-DTWKUNHWSA-N 1 2 315.414 4.265 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(SC(F)F)cc1)c1csnn1 ZINC000828702851 1046994322 /nfs/dbraw/zinc/99/43/22/1046994322.db2.gz BNHNSRSEAYEBQX-RKDXNWHRSA-N 1 2 315.414 4.265 20 0 DIADLO COc1ccc2nc(Cl)c(C[N@@H+]3CCC[C@@](C)(F)C3)cc2c1 ZINC001141062325 1046994433 /nfs/dbraw/zinc/99/44/33/1046994433.db2.gz DUBSWAUHOWAONK-QGZVFWFLSA-N 1 2 322.811 4.221 20 0 DIADLO COc1ccc2nc(Cl)c(C[N@H+]3CCC[C@@](C)(F)C3)cc2c1 ZINC001141062325 1046994444 /nfs/dbraw/zinc/99/44/44/1046994444.db2.gz DUBSWAUHOWAONK-QGZVFWFLSA-N 1 2 322.811 4.221 20 0 DIADLO CCCCc1ncc(C[N@@H+]2CCC[C@H]2c2ccc(OC)cc2)[nH]1 ZINC001141069874 1046995981 /nfs/dbraw/zinc/99/59/81/1046995981.db2.gz HIIHQQXIDLOEGC-SFHVURJKSA-N 1 2 313.445 4.098 20 0 DIADLO CCCCc1ncc(C[N@H+]2CCC[C@H]2c2ccc(OC)cc2)[nH]1 ZINC001141069874 1046995988 /nfs/dbraw/zinc/99/59/88/1046995988.db2.gz HIIHQQXIDLOEGC-SFHVURJKSA-N 1 2 313.445 4.098 20 0 DIADLO C[C@@H](CNc1[nH+]cccc1OCc1ccccc1)c1ccncc1 ZINC000680621864 1046996112 /nfs/dbraw/zinc/99/61/12/1046996112.db2.gz JHKKQQXZWJTAOY-INIZCTEOSA-N 1 2 319.408 4.271 20 0 DIADLO CCCCc1ncc(C[N@@H+]2CCC[C@H]2c2cccc(OC)c2)[nH]1 ZINC001141071677 1046996230 /nfs/dbraw/zinc/99/62/30/1046996230.db2.gz ABFMZVRSEXCVMA-SFHVURJKSA-N 1 2 313.445 4.098 20 0 DIADLO CCCCc1ncc(C[N@H+]2CCC[C@H]2c2cccc(OC)c2)[nH]1 ZINC001141071677 1046996233 /nfs/dbraw/zinc/99/62/33/1046996233.db2.gz ABFMZVRSEXCVMA-SFHVURJKSA-N 1 2 313.445 4.098 20 0 DIADLO CCCCc1ncc(C[N@@H+]2CCC[C@@H]2c2ccc(OC)cc2)[nH]1 ZINC001141069873 1046997207 /nfs/dbraw/zinc/99/72/07/1046997207.db2.gz HIIHQQXIDLOEGC-GOSISDBHSA-N 1 2 313.445 4.098 20 0 DIADLO CCCCc1ncc(C[N@H+]2CCC[C@@H]2c2ccc(OC)cc2)[nH]1 ZINC001141069873 1046997218 /nfs/dbraw/zinc/99/72/18/1046997218.db2.gz HIIHQQXIDLOEGC-GOSISDBHSA-N 1 2 313.445 4.098 20 0 DIADLO Clc1cscc1C[NH2+]Cc1nc2ccccc2n1C1CC1 ZINC000680651521 1046998539 /nfs/dbraw/zinc/99/85/39/1046998539.db2.gz XAWLWBZOYFTMQM-UHFFFAOYSA-N 1 2 317.845 4.376 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ncc(Cl)nc2Cl)c1 ZINC001141133238 1047022797 /nfs/dbraw/zinc/02/27/97/1047022797.db2.gz MOXSUDZCAZLTRH-CQSZACIVSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2ncc(Cl)nc2Cl)c1 ZINC001141133238 1047022809 /nfs/dbraw/zinc/02/28/09/1047022809.db2.gz MOXSUDZCAZLTRH-CQSZACIVSA-N 1 2 322.239 4.429 20 0 DIADLO O=C(CCCc1ccccc1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000162710741 1047024440 /nfs/dbraw/zinc/02/44/40/1047024440.db2.gz WYKYJUFHFXFRHT-UHFFFAOYSA-N 1 2 305.381 4.038 20 0 DIADLO CCOc1c(Cl)cccc1C[NH+]1CC(C)(CC(F)F)C1 ZINC000648059044 1047035208 /nfs/dbraw/zinc/03/52/08/1047035208.db2.gz SDWVHPOESNCXRL-UHFFFAOYSA-N 1 2 303.780 4.216 20 0 DIADLO CC[C@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)C[C@H](C)O1 ZINC000536654383 1047043736 /nfs/dbraw/zinc/04/37/36/1047043736.db2.gz PPHFHDKXCODYHJ-ZFWWWQNUSA-N 1 2 308.491 4.190 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)C[C@H](C)O1 ZINC000536654383 1047043747 /nfs/dbraw/zinc/04/37/47/1047043747.db2.gz PPHFHDKXCODYHJ-ZFWWWQNUSA-N 1 2 308.491 4.190 20 0 DIADLO COc1cccc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1F ZINC001141225369 1047053520 /nfs/dbraw/zinc/05/35/20/1047053520.db2.gz GNCYCTSFFBCFFS-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1F ZINC001141225369 1047053536 /nfs/dbraw/zinc/05/35/36/1047053536.db2.gz GNCYCTSFFBCFFS-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO CCc1ccccc1C[N@@H+]1Cc2cnc(-c3ccccc3)nc2C1 ZINC001141228677 1047054466 /nfs/dbraw/zinc/05/44/66/1047054466.db2.gz FYMSKDWGFQISCG-UHFFFAOYSA-N 1 2 315.420 4.222 20 0 DIADLO CCc1ccccc1C[N@H+]1Cc2cnc(-c3ccccc3)nc2C1 ZINC001141228677 1047054480 /nfs/dbraw/zinc/05/44/80/1047054480.db2.gz FYMSKDWGFQISCG-UHFFFAOYSA-N 1 2 315.420 4.222 20 0 DIADLO Fc1ccc2oc(C[N@@H+]3CCC=C(Br)C3)cc2c1 ZINC000799736849 1047061302 /nfs/dbraw/zinc/06/13/02/1047061302.db2.gz IPZIRVPWOFCETP-UHFFFAOYSA-N 1 2 310.166 4.056 20 0 DIADLO Fc1ccc2oc(C[N@H+]3CCC=C(Br)C3)cc2c1 ZINC000799736849 1047061314 /nfs/dbraw/zinc/06/13/14/1047061314.db2.gz IPZIRVPWOFCETP-UHFFFAOYSA-N 1 2 310.166 4.056 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccc(Cl)cc1C)CC2 ZINC001141232566 1047057889 /nfs/dbraw/zinc/05/78/89/1047057889.db2.gz IWCVYMSVYILAEO-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1ccc(Cl)cc1C)CC2 ZINC001141232566 1047057902 /nfs/dbraw/zinc/05/79/02/1047057902.db2.gz IWCVYMSVYILAEO-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1cccc(-n3ccnc3)c1)C2 ZINC001141244600 1047062547 /nfs/dbraw/zinc/06/25/47/1047062547.db2.gz QRGQYAZDZASNBW-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1cccc(-n3ccnc3)c1)C2 ZINC001141244600 1047062564 /nfs/dbraw/zinc/06/25/64/1047062564.db2.gz QRGQYAZDZASNBW-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO COc1cccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)c1F ZINC000648801721 1047091954 /nfs/dbraw/zinc/09/19/54/1047091954.db2.gz SZJNDGSGMOPUNU-QGZVFWFLSA-N 1 2 301.361 4.155 20 0 DIADLO COc1cccc(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)c1F ZINC000648801721 1047091968 /nfs/dbraw/zinc/09/19/68/1047091968.db2.gz SZJNDGSGMOPUNU-QGZVFWFLSA-N 1 2 301.361 4.155 20 0 DIADLO COc1cc(Cl)ncc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001141333433 1047097060 /nfs/dbraw/zinc/09/70/60/1047097060.db2.gz BUJIGONLKMTMSB-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(Cl)ncc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001141333433 1047097072 /nfs/dbraw/zinc/09/70/72/1047097072.db2.gz BUJIGONLKMTMSB-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(Cl)ncc1C[N@@H+]1CCC[C@H]1c1cccs1 ZINC001141341255 1047098907 /nfs/dbraw/zinc/09/89/07/1047098907.db2.gz UOVNUMQCSZFFNY-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cc(Cl)ncc1C[N@H+]1CCC[C@H]1c1cccs1 ZINC001141341255 1047098924 /nfs/dbraw/zinc/09/89/24/1047098924.db2.gz UOVNUMQCSZFFNY-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO CCCOc1ccc(CNc2cc(C)c3ccccc3[nH+]2)cn1 ZINC001116010983 1047100325 /nfs/dbraw/zinc/10/03/25/1047100325.db2.gz KLLUZZIFVSWDMJ-UHFFFAOYSA-N 1 2 307.397 4.339 20 0 DIADLO COc1cc(Cl)ncc1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001141341427 1047100779 /nfs/dbraw/zinc/10/07/79/1047100779.db2.gz BTHQZXSBAZSSRG-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(Cl)ncc1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001141341427 1047100781 /nfs/dbraw/zinc/10/07/81/1047100781.db2.gz BTHQZXSBAZSSRG-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1cc(NC[C@H]2OCCc3ccccc32)[nH+]c2ccccc12 ZINC001116051079 1047103465 /nfs/dbraw/zinc/10/34/65/1047103465.db2.gz XICVRDOPJMGVOB-LJQANCHMSA-N 1 2 304.393 4.269 20 0 DIADLO CC[NH+](CC)c1ccc(Nc2cc3ccc(O)cc3oc2=O)cc1 ZINC001212968907 1047116884 /nfs/dbraw/zinc/11/68/84/1047116884.db2.gz BIXOWKAIDVEPPD-UHFFFAOYSA-N 1 2 324.380 4.088 20 0 DIADLO FC(F)(F)c1ccc2c(cc[nH+]c2N2CCC(F)(F)CC2)c1 ZINC000649353371 1047121147 /nfs/dbraw/zinc/12/11/47/1047121147.db2.gz LXCDYVQCRQDTFQ-UHFFFAOYSA-N 1 2 316.273 4.489 20 0 DIADLO FC(F)[C@@H]1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C1 ZINC000649355459 1047121824 /nfs/dbraw/zinc/12/18/24/1047121824.db2.gz SNVPFDCQDXMPSJ-SNVBAGLBSA-N 1 2 316.273 4.345 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@@H+]2CC(C)(C)C2(C)C)c(Cl)c1 ZINC001116343878 1047131041 /nfs/dbraw/zinc/13/10/41/1047131041.db2.gz FCGFSBJMUXQKHT-ZDUSSCGKSA-N 1 2 322.880 4.404 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@H+]2CC(C)(C)C2(C)C)c(Cl)c1 ZINC001116343878 1047131045 /nfs/dbraw/zinc/13/10/45/1047131045.db2.gz FCGFSBJMUXQKHT-ZDUSSCGKSA-N 1 2 322.880 4.404 20 0 DIADLO CCC(CC)[C@@H]([NH2+]Cc1noc(C2CC2)n1)c1cccs1 ZINC000537078356 1047136289 /nfs/dbraw/zinc/13/62/89/1047136289.db2.gz BVSSIMLMEOSUQQ-OAHLLOKOSA-N 1 2 305.447 4.276 20 0 DIADLO CCCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1c[nH]cn1 ZINC000081197989 1047136478 /nfs/dbraw/zinc/13/64/78/1047136478.db2.gz VAMLWHUWORUEHO-KRWDZBQOSA-N 1 2 301.434 4.076 20 0 DIADLO Clc1nccc(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c1Cl ZINC000827639340 1047138032 /nfs/dbraw/zinc/13/80/32/1047138032.db2.gz IFUPXWILYASQJQ-CQSZACIVSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1nccc(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c1Cl ZINC000827639340 1047138040 /nfs/dbraw/zinc/13/80/40/1047138040.db2.gz IFUPXWILYASQJQ-CQSZACIVSA-N 1 2 323.223 4.042 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+][C@@H](c2cccc(F)c2)C(C)(C)C)o1 ZINC001116468158 1047145430 /nfs/dbraw/zinc/14/54/30/1047145430.db2.gz DFUHLFMQSRTNDL-HNNXBMFYSA-N 1 2 319.424 4.383 20 0 DIADLO COc1ccccc1C1([NH2+][C@@H](C)c2nc(C)sc2C)CCC1 ZINC001116482443 1047148177 /nfs/dbraw/zinc/14/81/77/1047148177.db2.gz GFNNSQJFGHTTCK-LBPRGKRZSA-N 1 2 316.470 4.499 20 0 DIADLO Fc1nc(Cl)ccc1C[NH+]1CCC(Cc2ccccc2)CC1 ZINC001137469137 1047150481 /nfs/dbraw/zinc/15/04/81/1047150481.db2.gz WJCIUHNGKWWUAF-UHFFFAOYSA-N 1 2 318.823 4.329 20 0 DIADLO Clc1ccccc1C1([NH2+]Cc2cc3n(n2)CCCC3)CCC1 ZINC000649644191 1047157414 /nfs/dbraw/zinc/15/74/14/1047157414.db2.gz VTFCFQNOZBOMEF-UHFFFAOYSA-N 1 2 315.848 4.042 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@@H+]([C@H](C)c2ccc(F)c(F)c2)C1 ZINC000682038370 1047164541 /nfs/dbraw/zinc/16/45/41/1047164541.db2.gz CWUXTTLHGCXSLN-YGRLFVJLSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@H+]([C@H](C)c2ccc(F)c(F)c2)C1 ZINC000682038370 1047164547 /nfs/dbraw/zinc/16/45/47/1047164547.db2.gz CWUXTTLHGCXSLN-YGRLFVJLSA-N 1 2 323.305 4.069 20 0 DIADLO Cc1ncc([C@@H](C)[N@H+](C)Cc2ccc(F)cc2Cl)c(C)n1 ZINC000682071064 1047168292 /nfs/dbraw/zinc/16/82/92/1047168292.db2.gz NVJKRZRFXTWXNR-LLVKDONJSA-N 1 2 307.800 4.079 20 0 DIADLO Cc1ncc([C@@H](C)[N@@H+](C)Cc2ccc(F)cc2Cl)c(C)n1 ZINC000682071064 1047168298 /nfs/dbraw/zinc/16/82/98/1047168298.db2.gz NVJKRZRFXTWXNR-LLVKDONJSA-N 1 2 307.800 4.079 20 0 DIADLO CCc1ccccc1C[NH2+]C1(c2noc(C)n2)CCCCCC1 ZINC000682084962 1047170296 /nfs/dbraw/zinc/17/02/96/1047170296.db2.gz VBAVHXQIGYBKIZ-UHFFFAOYSA-N 1 2 313.445 4.280 20 0 DIADLO Cc1ccccc1-c1cnc(C[NH2+][C@@H](c2cccnc2)C2CC2)o1 ZINC000682086830 1047170686 /nfs/dbraw/zinc/17/06/86/1047170686.db2.gz SOSPIAOQQDNLFY-HXUWFJFHSA-N 1 2 319.408 4.286 20 0 DIADLO Clc1nc(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)cs1 ZINC000827798093 1047172144 /nfs/dbraw/zinc/17/21/44/1047172144.db2.gz JYIVGMHFCUBCBQ-LLVKDONJSA-N 1 2 313.253 4.439 20 0 DIADLO Clc1nc(C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)cs1 ZINC000827798093 1047172153 /nfs/dbraw/zinc/17/21/53/1047172153.db2.gz JYIVGMHFCUBCBQ-LLVKDONJSA-N 1 2 313.253 4.439 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+][C@H](C)c3cccc(F)c3F)nc2c1 ZINC000537344247 1047172871 /nfs/dbraw/zinc/17/28/71/1047172871.db2.gz FAIURQGEQAXTPL-LLVKDONJSA-N 1 2 301.340 4.000 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@H](C)c3cccc(F)c3F)[nH]c2c1 ZINC000537344247 1047172876 /nfs/dbraw/zinc/17/28/76/1047172876.db2.gz FAIURQGEQAXTPL-LLVKDONJSA-N 1 2 301.340 4.000 20 0 DIADLO CC(=O)c1cccc(C[N@@H+]2[C@H](C)CO[C@@H](c3ccccc3)[C@@H]2C)c1 ZINC000827799511 1047172998 /nfs/dbraw/zinc/17/29/98/1047172998.db2.gz ZNLQHEYVLCAGLM-VWKPWSFCSA-N 1 2 323.436 4.240 20 0 DIADLO CC(=O)c1cccc(C[N@H+]2[C@H](C)CO[C@@H](c3ccccc3)[C@@H]2C)c1 ZINC000827799511 1047173003 /nfs/dbraw/zinc/17/30/03/1047173003.db2.gz ZNLQHEYVLCAGLM-VWKPWSFCSA-N 1 2 323.436 4.240 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+][C@@H](C)c3cccc(F)c3F)nc2c1 ZINC000537344253 1047173252 /nfs/dbraw/zinc/17/32/52/1047173252.db2.gz FAIURQGEQAXTPL-NSHDSACASA-N 1 2 301.340 4.000 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@@H](C)c3cccc(F)c3F)[nH]c2c1 ZINC000537344253 1047173260 /nfs/dbraw/zinc/17/32/60/1047173260.db2.gz FAIURQGEQAXTPL-NSHDSACASA-N 1 2 301.340 4.000 20 0 DIADLO CC(C)[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cc2ccccc2o1 ZINC000537351797 1047174770 /nfs/dbraw/zinc/17/47/70/1047174770.db2.gz JZGQWSGLEOJPSB-FQEVSTJZSA-N 1 2 312.457 4.346 20 0 DIADLO CC1(C)CC[C@@H](CSCc2ccc(-n3cc[nH+]c3)cc2)O1 ZINC001116762024 1047175844 /nfs/dbraw/zinc/17/58/44/1047175844.db2.gz XZCGBDHOLCEEEY-INIZCTEOSA-N 1 2 302.443 4.063 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2C[C@@H](C)c2cccc(Cl)c2)no1 ZINC000682150898 1047177861 /nfs/dbraw/zinc/17/78/61/1047177861.db2.gz BQKNFWHXHBAVFH-MLGOLLRUSA-N 1 2 319.836 4.362 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2C[C@@H](C)c2cccc(Cl)c2)no1 ZINC000682150898 1047177869 /nfs/dbraw/zinc/17/78/69/1047177869.db2.gz BQKNFWHXHBAVFH-MLGOLLRUSA-N 1 2 319.836 4.362 20 0 DIADLO CC[C@@H]1CCC[N@@H+]1Cc1c(F)cc(Br)cc1F ZINC001141559047 1047185766 /nfs/dbraw/zinc/18/57/66/1047185766.db2.gz DXAKZCHYLWZMPR-SNVBAGLBSA-N 1 2 304.178 4.102 20 0 DIADLO CC[C@@H]1CCC[N@H+]1Cc1c(F)cc(Br)cc1F ZINC001141559047 1047185772 /nfs/dbraw/zinc/18/57/72/1047185772.db2.gz DXAKZCHYLWZMPR-SNVBAGLBSA-N 1 2 304.178 4.102 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H]2CCOc3c(F)cccc32)c(C)s1 ZINC000682377564 1047187941 /nfs/dbraw/zinc/18/79/41/1047187941.db2.gz RVUAVOQLNLPJNI-OTYXRUKQSA-N 1 2 306.406 4.073 20 0 DIADLO Cc1ccccc1[C@H](O)C1CC[NH+](C/C(Cl)=C/Cl)CC1 ZINC000796406227 1047198596 /nfs/dbraw/zinc/19/85/96/1047198596.db2.gz JWTGOTJWWOWXHB-SCOADAFUSA-N 1 2 314.256 4.059 20 0 DIADLO C[NH+](C)c1ccc(NCc2cscc2Br)cc1 ZINC000306117311 1047208243 /nfs/dbraw/zinc/20/82/43/1047208243.db2.gz WSACYIRHHJEWCE-UHFFFAOYSA-N 1 2 311.248 4.189 20 0 DIADLO C[C@H]1CCC[N@@H+]1Cc1cc(Br)cc(Cl)c1F ZINC001141593971 1047210183 /nfs/dbraw/zinc/21/01/83/1047210183.db2.gz XMYKZKOWVIGNSH-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@H]1CCC[N@H+]1Cc1cc(Br)cc(Cl)c1F ZINC001141593971 1047210193 /nfs/dbraw/zinc/21/01/93/1047210193.db2.gz XMYKZKOWVIGNSH-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO Cn1cc(Cl)cc1C[N@H+](C)Cn1c(=S)oc2ccccc21 ZINC000757606688 1047215982 /nfs/dbraw/zinc/21/59/82/1047215982.db2.gz RTSZKSHNVXLXJL-UHFFFAOYSA-N 1 2 321.833 4.045 20 0 DIADLO Cn1cc(Cl)cc1C[N@@H+](C)Cn1c(=S)oc2ccccc21 ZINC000757606688 1047215995 /nfs/dbraw/zinc/21/59/95/1047215995.db2.gz RTSZKSHNVXLXJL-UHFFFAOYSA-N 1 2 321.833 4.045 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCc3ccccc3[C@H](C)C2)c(C)[nH+]1 ZINC000650210442 1047222675 /nfs/dbraw/zinc/22/26/75/1047222675.db2.gz MEOBLZNLUKQCTI-CQSZACIVSA-N 1 2 323.440 4.201 20 0 DIADLO COc1cc(C(F)(F)F)ccc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC001141611147 1047224131 /nfs/dbraw/zinc/22/41/31/1047224131.db2.gz OQILLXPSXWBQOA-GFCCVEGCSA-N 1 2 324.346 4.092 20 0 DIADLO COc1cc(C(F)(F)F)ccc1C[N@H+]1CCn2cccc2[C@H]1C ZINC001141611147 1047224142 /nfs/dbraw/zinc/22/41/42/1047224142.db2.gz OQILLXPSXWBQOA-GFCCVEGCSA-N 1 2 324.346 4.092 20 0 DIADLO COCc1cc[nH+]c(NCc2ccccc2OC2CCCC2)c1 ZINC000650244929 1047225577 /nfs/dbraw/zinc/22/55/77/1047225577.db2.gz VNFRPYHFCCPQDX-UHFFFAOYSA-N 1 2 312.413 4.162 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000682842736 1047229351 /nfs/dbraw/zinc/22/93/51/1047229351.db2.gz QYZMCITUBXRTHI-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000682842736 1047229364 /nfs/dbraw/zinc/22/93/64/1047229364.db2.gz QYZMCITUBXRTHI-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO C[S@@](=O)c1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)cc1 ZINC001117646327 1047232857 /nfs/dbraw/zinc/23/28/57/1047232857.db2.gz XRYDULPCHJGETH-IIBYNOLFSA-N 1 2 319.495 4.069 20 0 DIADLO C[S@@](=O)c1ccc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)cc1 ZINC001117646327 1047232866 /nfs/dbraw/zinc/23/28/66/1047232866.db2.gz XRYDULPCHJGETH-IIBYNOLFSA-N 1 2 319.495 4.069 20 0 DIADLO C[N@H+](Cc1ccc2cc(F)ccc2n1)Cc1ccc(F)cc1F ZINC001141650792 1047248830 /nfs/dbraw/zinc/24/88/30/1047248830.db2.gz IKJFALOWALXRQT-UHFFFAOYSA-N 1 2 316.326 4.284 20 0 DIADLO C[N@@H+](Cc1ccc2cc(F)ccc2n1)Cc1ccc(F)cc1F ZINC001141650792 1047248839 /nfs/dbraw/zinc/24/88/39/1047248839.db2.gz IKJFALOWALXRQT-UHFFFAOYSA-N 1 2 316.326 4.284 20 0 DIADLO Cc1ccnc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)c1 ZINC000683017788 1047257284 /nfs/dbraw/zinc/25/72/84/1047257284.db2.gz QRRQRGAPMVMTGK-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1ccnc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)c1 ZINC000683017788 1047257301 /nfs/dbraw/zinc/25/73/01/1047257301.db2.gz QRRQRGAPMVMTGK-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO C[C@@H](CC(C)(C)C)C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000476254328 1047263663 /nfs/dbraw/zinc/26/36/63/1047263663.db2.gz KEQKDXROMVWBPY-GJZGRUSLSA-N 1 2 322.518 4.026 20 0 DIADLO Fc1cc(Br)cc(C[N@H+]2CCC[C@@H](F)CC2)c1F ZINC001141797484 1047291298 /nfs/dbraw/zinc/29/12/98/1047291298.db2.gz SBDOWRIJRFKLQI-LLVKDONJSA-N 1 2 322.168 4.051 20 0 DIADLO FC1CC2(C1)CCC[N@H+](Cc1nc(C(F)(F)F)cs1)CC2 ZINC001141765002 1047286857 /nfs/dbraw/zinc/28/68/57/1047286857.db2.gz FZIILYNEHOUCEJ-UHFFFAOYSA-N 1 2 322.371 4.266 20 0 DIADLO FC1CC2(C1)CCC[N@@H+](Cc1nc(C(F)(F)F)cs1)CC2 ZINC001141765002 1047286863 /nfs/dbraw/zinc/28/68/63/1047286863.db2.gz FZIILYNEHOUCEJ-UHFFFAOYSA-N 1 2 322.371 4.266 20 0 DIADLO Fc1cc(Br)cc(C[N@@H+]2CCC[C@@H](F)CC2)c1F ZINC001141797484 1047291302 /nfs/dbraw/zinc/29/13/02/1047291302.db2.gz SBDOWRIJRFKLQI-LLVKDONJSA-N 1 2 322.168 4.051 20 0 DIADLO Fc1cc(Br)cc(C[N@@H+]2CC3CCC2CC3)c1F ZINC001141802936 1047292832 /nfs/dbraw/zinc/29/28/32/1047292832.db2.gz HFVPLTUGZAVANQ-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(Br)cc(C[N@H+]2CC3CCC2CC3)c1F ZINC001141802936 1047292842 /nfs/dbraw/zinc/29/28/42/1047292842.db2.gz HFVPLTUGZAVANQ-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H](C)c1ccc2c(c1)OCCO2 ZINC000390349694 1047296597 /nfs/dbraw/zinc/29/65/97/1047296597.db2.gz YIVVMFZPEAPHNW-CQSZACIVSA-N 1 2 312.413 4.005 20 0 DIADLO C[C@@H]1CCC[C@@]1(C)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000651201700 1047301260 /nfs/dbraw/zinc/30/12/60/1047301260.db2.gz XOSRJKYTVQCZIM-AUUYWEPGSA-N 1 2 322.412 4.059 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1OC(F)(F)F)c1cncs1 ZINC000897933544 1047301233 /nfs/dbraw/zinc/30/12/33/1047301233.db2.gz ZLWLZLNMVMFRNF-QMMMGPOBSA-N 1 2 320.311 4.032 20 0 DIADLO CCCn1nccc1CNc1[nH+]c2ccccc2n1C(C)(C)C ZINC001118576794 1047302479 /nfs/dbraw/zinc/30/24/79/1047302479.db2.gz WMSPNXASDVHBGD-UHFFFAOYSA-N 1 2 311.433 4.010 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@H]2CSCCc3ccccc32)n1 ZINC000897943957 1047303833 /nfs/dbraw/zinc/30/38/33/1047303833.db2.gz CHKQOGARUBYWPL-HNNXBMFYSA-N 1 2 316.470 4.092 20 0 DIADLO C[N@H+](CCC1CCCCC1)Cn1nc2n(c1=S)CCCCC2 ZINC000725786587 1047314792 /nfs/dbraw/zinc/31/47/92/1047314792.db2.gz ZYDBNZRKLQFSIW-UHFFFAOYSA-N 1 2 322.522 4.000 20 0 DIADLO C[N@@H+](CCC1CCCCC1)Cn1nc2n(c1=S)CCCCC2 ZINC000725786587 1047314806 /nfs/dbraw/zinc/31/48/06/1047314806.db2.gz ZYDBNZRKLQFSIW-UHFFFAOYSA-N 1 2 322.522 4.000 20 0 DIADLO CC(C)(C)[C@H]([NH2+]Cc1nc(C2CCC2)no1)c1cccc(F)c1 ZINC001119253060 1047324321 /nfs/dbraw/zinc/32/43/21/1047324321.db2.gz YDFXCLGUTUIPGT-MRXNPFEDSA-N 1 2 317.408 4.353 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)c(C)s1 ZINC000898179111 1047326246 /nfs/dbraw/zinc/32/62/46/1047326246.db2.gz HSPAWBMVXZXWKO-RYUDHWBXSA-N 1 2 318.490 4.168 20 0 DIADLO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1ccc(-c2ccccc2)cn1 ZINC000651822532 1047329946 /nfs/dbraw/zinc/32/99/46/1047329946.db2.gz AQFFNKPDSUQVNO-VCBZYWHSSA-N 1 2 318.424 4.302 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2sccc2Oc2ccccc2)C[C@H](C)O1 ZINC001141994614 1047334113 /nfs/dbraw/zinc/33/41/13/1047334113.db2.gz SKFYUHFBTZCVKZ-OKILXGFUSA-N 1 2 303.427 4.150 20 0 DIADLO C[C@@H]1C[N@H+](Cc2sccc2Oc2ccccc2)C[C@H](C)O1 ZINC001141994614 1047334120 /nfs/dbraw/zinc/33/41/20/1047334120.db2.gz SKFYUHFBTZCVKZ-OKILXGFUSA-N 1 2 303.427 4.150 20 0 DIADLO CC[C@H]1COCC[N@@H+]1Cc1sccc1Oc1ccccc1 ZINC001142000952 1047339209 /nfs/dbraw/zinc/33/92/09/1047339209.db2.gz CMXKIAITVKCVIE-AWEZNQCLSA-N 1 2 303.427 4.151 20 0 DIADLO CC[C@H]1COCC[N@H+]1Cc1sccc1Oc1ccccc1 ZINC001142000952 1047339225 /nfs/dbraw/zinc/33/92/25/1047339225.db2.gz CMXKIAITVKCVIE-AWEZNQCLSA-N 1 2 303.427 4.151 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2c[nH+]c(C)cc2C)c(Cl)c1 ZINC000652070587 1047341454 /nfs/dbraw/zinc/34/14/54/1047341454.db2.gz FAQBTBIYHMUVLF-UHFFFAOYSA-N 1 2 317.820 4.290 20 0 DIADLO O=C(Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)[C@H]1CC=CCC1 ZINC000044567409 1047346311 /nfs/dbraw/zinc/34/63/11/1047346311.db2.gz IITBFRIDJPIQQN-INIZCTEOSA-N 1 2 321.424 4.181 20 0 DIADLO O=C(Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)[C@@H]1CC=CCC1 ZINC000044567411 1047346970 /nfs/dbraw/zinc/34/69/70/1047346970.db2.gz IITBFRIDJPIQQN-MRXNPFEDSA-N 1 2 321.424 4.181 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[NH2+][C@@H](C)c1nccs1 ZINC000106250399 1047355769 /nfs/dbraw/zinc/35/57/69/1047355769.db2.gz DPSIEFASXVJLGK-QMMMGPOBSA-N 1 2 317.241 4.309 20 0 DIADLO F[C@@H]1CC[N@H+](Cc2ccc(Br)c3ccccc23)C1 ZINC001142049915 1047361574 /nfs/dbraw/zinc/36/15/74/1047361574.db2.gz LGRXRHZPFDSXCR-GFCCVEGCSA-N 1 2 308.194 4.146 20 0 DIADLO F[C@@H]1CC[N@@H+](Cc2ccc(Br)c3ccccc23)C1 ZINC001142049915 1047361579 /nfs/dbraw/zinc/36/15/79/1047361579.db2.gz LGRXRHZPFDSXCR-GFCCVEGCSA-N 1 2 308.194 4.146 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(F)ccc(Br)c2Cl)C1 ZINC001142080911 1047373398 /nfs/dbraw/zinc/37/33/98/1047373398.db2.gz PFVVNHRXEYAPCW-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(F)ccc(Br)c2Cl)C1 ZINC001142080911 1047373407 /nfs/dbraw/zinc/37/34/07/1047373407.db2.gz PFVVNHRXEYAPCW-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccccc2OCC(C)C)no1 ZINC000726788569 1047382429 /nfs/dbraw/zinc/38/24/29/1047382429.db2.gz FYNFKHXFRMVRIE-SFHVURJKSA-N 1 2 314.429 4.355 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccccc2OCC(C)C)no1 ZINC000726788569 1047382436 /nfs/dbraw/zinc/38/24/36/1047382436.db2.gz FYNFKHXFRMVRIE-SFHVURJKSA-N 1 2 314.429 4.355 20 0 DIADLO FC1(F)CC[NH+](Cc2ncc(-c3ccc(Cl)cc3)o2)CC1 ZINC000796541425 1047383751 /nfs/dbraw/zinc/38/37/51/1047383751.db2.gz JSLGWILHCXDLHL-UHFFFAOYSA-N 1 2 312.747 4.226 20 0 DIADLO CC[C@H](C)c1ccccc1NC(=O)[C@H](C)[NH+]1CCC(F)(F)CC1 ZINC000796540171 1047384129 /nfs/dbraw/zinc/38/41/29/1047384129.db2.gz HHPBTSRBTUZGKC-KBPBESRZSA-N 1 2 324.415 4.258 20 0 DIADLO FC(F)(F)c1ccc2oc(C[NH+]3CCC(F)(F)CC3)nc2c1 ZINC000796549050 1047385138 /nfs/dbraw/zinc/38/51/38/1047385138.db2.gz GNJRUNQZMXXBOR-UHFFFAOYSA-N 1 2 320.261 4.078 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c(Cl)n1 ZINC001142136584 1047386259 /nfs/dbraw/zinc/38/62/59/1047386259.db2.gz MCJKKXWFOGSJIN-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@H]2c2ccccc2)c(Cl)n1 ZINC001142136584 1047386272 /nfs/dbraw/zinc/38/62/72/1047386272.db2.gz MCJKKXWFOGSJIN-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO Brc1ccc(CNc2c[nH+]cc3c2CCCC3)cc1 ZINC001203118322 1047387531 /nfs/dbraw/zinc/38/75/31/1047387531.db2.gz DQFUYYONVQPCHH-UHFFFAOYSA-N 1 2 317.230 4.335 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@H](CC2CC2)c2ccccc2)c[nH+]1 ZINC000653271383 1047387463 /nfs/dbraw/zinc/38/74/63/1047387463.db2.gz IWIZMMQYDGKJNS-LJQANCHMSA-N 1 2 323.440 4.039 20 0 DIADLO CC(C)(C)c1nc[nH]c1C[N@@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001142234527 1047412817 /nfs/dbraw/zinc/41/28/17/1047412817.db2.gz AGYPWXAPHLXSKP-OAHLLOKOSA-N 1 2 319.399 4.323 20 0 DIADLO CC(C)(C)c1nc[nH]c1C[N@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001142234527 1047412825 /nfs/dbraw/zinc/41/28/25/1047412825.db2.gz AGYPWXAPHLXSKP-OAHLLOKOSA-N 1 2 319.399 4.323 20 0 DIADLO C/C(=C\c1ccc(F)cc1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000749362029 1047413158 /nfs/dbraw/zinc/41/31/58/1047413158.db2.gz FGAURKCLNDIQGB-OUKQBFOZSA-N 1 2 321.355 4.258 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H](C)C3CCCC3)c2)[nH+]c1C ZINC000749355819 1047413804 /nfs/dbraw/zinc/41/38/04/1047413804.db2.gz TZQONCIICNCISS-GFCCVEGCSA-N 1 2 311.429 4.458 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)C[C@H]2CCCCO2)c(Cl)c1 ZINC001142293032 1047423279 /nfs/dbraw/zinc/42/32/79/1047423279.db2.gz MZDVJUGNGSKTDS-LLVKDONJSA-N 1 2 318.244 4.003 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)C[C@H]2CCCCO2)c(Cl)c1 ZINC001142293032 1047423286 /nfs/dbraw/zinc/42/32/86/1047423286.db2.gz MZDVJUGNGSKTDS-LLVKDONJSA-N 1 2 318.244 4.003 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)C[C@@H]2CCCCO2)c(Cl)c1 ZINC001142293033 1047423893 /nfs/dbraw/zinc/42/38/93/1047423893.db2.gz MZDVJUGNGSKTDS-NSHDSACASA-N 1 2 318.244 4.003 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)C[C@@H]2CCCCO2)c(Cl)c1 ZINC001142293033 1047423902 /nfs/dbraw/zinc/42/39/02/1047423902.db2.gz MZDVJUGNGSKTDS-NSHDSACASA-N 1 2 318.244 4.003 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)/C=C/c3cccs3)c2)[nH+]c1C ZINC000749583445 1047427866 /nfs/dbraw/zinc/42/78/66/1047427866.db2.gz QMHYXVOTHZUGBU-CMDGGOBGSA-N 1 2 323.421 4.407 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCc3nc(Cl)ccc3C2)cc1 ZINC001142364138 1047436352 /nfs/dbraw/zinc/43/63/52/1047436352.db2.gz GUZXSGUXZCUSPF-UHFFFAOYSA-N 1 2 300.833 4.246 20 0 DIADLO CCCc1ccc(C[N@H+]2CCc3nc(Cl)ccc3C2)cc1 ZINC001142364138 1047436355 /nfs/dbraw/zinc/43/63/55/1047436355.db2.gz GUZXSGUXZCUSPF-UHFFFAOYSA-N 1 2 300.833 4.246 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2cc[nH]n2)c2ccc(Cl)cc2)cc1 ZINC000537612352 1047443801 /nfs/dbraw/zinc/44/38/01/1047443801.db2.gz WLZCINYHBCNNHU-QGZVFWFLSA-N 1 2 315.779 4.081 20 0 DIADLO CSc1ncc(C[N@@H+]2CCC[C@H]2c2ccccc2)c(Cl)n1 ZINC001142426955 1047445235 /nfs/dbraw/zinc/44/52/35/1047445235.db2.gz GPQWSKLJLUZDIY-AWEZNQCLSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1ncc(C[N@H+]2CCC[C@H]2c2ccccc2)c(Cl)n1 ZINC001142426955 1047445260 /nfs/dbraw/zinc/44/52/60/1047445260.db2.gz GPQWSKLJLUZDIY-AWEZNQCLSA-N 1 2 319.861 4.189 20 0 DIADLO CC(C)Cc1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000152351789 1047447700 /nfs/dbraw/zinc/44/77/00/1047447700.db2.gz ZKMCLHPGAULWIR-CQSZACIVSA-N 1 2 315.461 4.416 20 0 DIADLO Cc1nc(C[N@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)sc1C ZINC000088601986 1047466371 /nfs/dbraw/zinc/46/63/71/1047466371.db2.gz YWZMDBYLWXRIMM-CXAGYDPISA-N 1 2 316.470 4.030 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)sc1C ZINC000088601986 1047466372 /nfs/dbraw/zinc/46/63/72/1047466372.db2.gz YWZMDBYLWXRIMM-CXAGYDPISA-N 1 2 316.470 4.030 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)C(=O)C(C)(C)CC(C)(C)C)c1C ZINC001142561772 1047469925 /nfs/dbraw/zinc/46/99/25/1047469925.db2.gz KGVOFBMRHQDBAF-UHFFFAOYSA-N 1 2 320.477 4.128 20 0 DIADLO C/C(=C\C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1C ZINC001142588829 1047470771 /nfs/dbraw/zinc/47/07/71/1047470771.db2.gz HSTCBATWZQZZIF-FYWRMAATSA-N 1 2 317.392 4.427 20 0 DIADLO C[C@H]1C[N@@H+](Cc2occc2Br)Cc2ccccc21 ZINC001143116787 1047533763 /nfs/dbraw/zinc/53/37/63/1047533763.db2.gz UFYMFTSWQVAPNK-NSHDSACASA-N 1 2 306.203 4.161 20 0 DIADLO O=C(c1ccccc1)C1CC[NH+](Cc2csc(Cl)c2)CC1 ZINC001142760474 1047491541 /nfs/dbraw/zinc/49/15/41/1047491541.db2.gz VZJWXEIXGXRVID-UHFFFAOYSA-N 1 2 319.857 4.496 20 0 DIADLO CCO[C@@H](C)c1noc(C[NH2+][C@H](c2ccccc2)C(C)(C)C)n1 ZINC000120510844 1047493396 /nfs/dbraw/zinc/49/33/96/1047493396.db2.gz JWCTYHYHPMYLKN-XJKSGUPXSA-N 1 2 317.433 4.044 20 0 DIADLO C[C@H](SCCn1cc[nH+]c1)c1cccc(Br)c1 ZINC000090202490 1047499478 /nfs/dbraw/zinc/49/94/78/1047499478.db2.gz PKWHQCPKJZSQEF-NSHDSACASA-N 1 2 311.248 4.140 20 0 DIADLO Clc1cccc(C2([NH2+]Cc3coc(C4CC4)n3)CCC2)c1 ZINC000842771895 1047503543 /nfs/dbraw/zinc/50/35/43/1047503543.db2.gz QSHHFKMRTQGAQE-UHFFFAOYSA-N 1 2 302.805 4.374 20 0 DIADLO Cc1ccc(C)c(OCCC(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000121110060 1047510557 /nfs/dbraw/zinc/51/05/57/1047510557.db2.gz ZKTYVEFXXHAIFN-UHFFFAOYSA-N 1 2 312.413 4.031 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C/c2ccc3ccccc3n2)c(C)[nH+]1 ZINC000121112248 1047510984 /nfs/dbraw/zinc/51/09/84/1047510984.db2.gz YTFAUGWKGJVJEH-ZHACJKMWSA-N 1 2 317.392 4.207 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[NH+]1CCC(C(F)F)CC1 ZINC000537633728 1047514573 /nfs/dbraw/zinc/51/45/73/1047514573.db2.gz TYBMZTFDPLBDTD-UHFFFAOYSA-N 1 2 324.198 4.479 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000091702670 1047520987 /nfs/dbraw/zinc/52/09/87/1047520987.db2.gz KDGLEUHOTOCGFT-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)[C@@H](C)c1ccccn1 ZINC000091702670 1047520995 /nfs/dbraw/zinc/52/09/95/1047520995.db2.gz KDGLEUHOTOCGFT-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nccs2)c(OCC2CC2)c1 ZINC000091735216 1047521760 /nfs/dbraw/zinc/52/17/60/1047521760.db2.gz ZRWDMETXQQJSGJ-CYBMUJFWSA-N 1 2 302.443 4.091 20 0 DIADLO CC[C@@H](NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1)c1ccc(C)cc1 ZINC001143084291 1047530021 /nfs/dbraw/zinc/53/00/21/1047530021.db2.gz TZPKPYZGXQWGDN-QZTJIDSGSA-N 1 2 313.445 4.046 20 0 DIADLO CC(C)[N@H+](Cc1occc1Br)Cc1ccccc1 ZINC001143116653 1047533482 /nfs/dbraw/zinc/53/34/82/1047533482.db2.gz HRCIWRFYMMKYGJ-UHFFFAOYSA-N 1 2 308.219 4.453 20 0 DIADLO CC(C)[N@@H+](Cc1occc1Br)Cc1ccccc1 ZINC001143116653 1047533488 /nfs/dbraw/zinc/53/34/88/1047533488.db2.gz HRCIWRFYMMKYGJ-UHFFFAOYSA-N 1 2 308.219 4.453 20 0 DIADLO C[C@H]1C[N@H+](Cc2occc2Br)Cc2ccccc21 ZINC001143116787 1047533759 /nfs/dbraw/zinc/53/37/59/1047533759.db2.gz UFYMFTSWQVAPNK-NSHDSACASA-N 1 2 306.203 4.161 20 0 DIADLO Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]Cc1nccs1 ZINC000121991143 1047534301 /nfs/dbraw/zinc/53/43/01/1047534301.db2.gz QGWAVCWHQOXFSZ-CYBMUJFWSA-N 1 2 308.834 4.108 20 0 DIADLO C[N@H+](Cc1ccc(-c2ccccc2Cl)o1)Cc1cnccn1 ZINC000092591458 1047537552 /nfs/dbraw/zinc/53/75/52/1047537552.db2.gz KSPVGGKYIPYIDY-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1ccc(-c2ccccc2Cl)o1)Cc1cnccn1 ZINC000092591458 1047537557 /nfs/dbraw/zinc/53/75/57/1047537557.db2.gz KSPVGGKYIPYIDY-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO Fc1cc2c(cc1F)C[N@H+](Cc1ccc(C(F)F)cc1)CC2 ZINC001143256080 1047545154 /nfs/dbraw/zinc/54/51/54/1047545154.db2.gz CWBSCWRTWIKCBD-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO Fc1cc2c(cc1F)C[N@@H+](Cc1ccc(C(F)F)cc1)CC2 ZINC001143256080 1047545158 /nfs/dbraw/zinc/54/51/58/1047545158.db2.gz CWBSCWRTWIKCBD-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCCC[C@](C)(F)C2)c(F)c1F ZINC001143270011 1047546478 /nfs/dbraw/zinc/54/64/78/1047546478.db2.gz VLBSISVGNUBXPY-INIZCTEOSA-N 1 2 301.352 4.078 20 0 DIADLO CCOc1ccc(C[N@H+]2CCCC[C@](C)(F)C2)c(F)c1F ZINC001143270011 1047546486 /nfs/dbraw/zinc/54/64/86/1047546486.db2.gz VLBSISVGNUBXPY-INIZCTEOSA-N 1 2 301.352 4.078 20 0 DIADLO C1=CCC2(C[N@@H+](Cc3coc(C4CC4)n3)[C@H]2c2ccccc2)C1 ZINC000843435179 1047551877 /nfs/dbraw/zinc/55/18/77/1047551877.db2.gz KFJVMEGXGHSMOY-SFHVURJKSA-N 1 2 306.409 4.445 20 0 DIADLO C1=CCC2(C[N@H+](Cc3coc(C4CC4)n3)[C@H]2c2ccccc2)C1 ZINC000843435179 1047551882 /nfs/dbraw/zinc/55/18/82/1047551882.db2.gz KFJVMEGXGHSMOY-SFHVURJKSA-N 1 2 306.409 4.445 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2cc(C)ccc2OC(F)F)s1 ZINC000122892635 1047558827 /nfs/dbraw/zinc/55/88/27/1047558827.db2.gz OLEXEGLSNVGJGX-LLVKDONJSA-N 1 2 312.385 4.212 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2ccc(F)cc2OC(F)F)s1 ZINC000123024001 1047568198 /nfs/dbraw/zinc/56/81/98/1047568198.db2.gz ZRKGYYUCMHKYDY-VIFPVBQESA-N 1 2 316.348 4.043 20 0 DIADLO Cc1[nH]ncc1C[N@@H+]1CC[C@H](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000537654485 1047569611 /nfs/dbraw/zinc/56/96/11/1047569611.db2.gz AOINWNHZMSMLEK-ZBEGNZNMSA-N 1 2 323.362 4.320 20 0 DIADLO CCCn1cc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3o2)cn1 ZINC000537661402 1047571652 /nfs/dbraw/zinc/57/16/52/1047571652.db2.gz OXMAIGNVXBIKRS-QGZVFWFLSA-N 1 2 324.428 4.162 20 0 DIADLO CCCn1cc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3o2)cn1 ZINC000537661402 1047571656 /nfs/dbraw/zinc/57/16/56/1047571656.db2.gz OXMAIGNVXBIKRS-QGZVFWFLSA-N 1 2 324.428 4.162 20 0 DIADLO C[C@H](Nc1ccc(Cl)c(N(C)C)c1)c1cn2c([nH+]1)CCCC2 ZINC000926902027 1047575297 /nfs/dbraw/zinc/57/52/97/1047575297.db2.gz ZGHBUTZWSHSIQM-LBPRGKRZSA-N 1 2 318.852 4.112 20 0 DIADLO CC(C)(C)O[C@@H]1C[C@@H](Nc2c[nH+]cc3c2CCCC3)C1(C)C ZINC001206636602 1047588165 /nfs/dbraw/zinc/58/81/65/1047588165.db2.gz PWQGMROATHDZNV-IAGOWNOFSA-N 1 2 302.462 4.355 20 0 DIADLO C[N@H+](Cc1ccn(C2CCCC2)n1)Cc1ccc(Cl)cc1 ZINC000477156819 1047600324 /nfs/dbraw/zinc/60/03/24/1047600324.db2.gz OAFORRGFKAXPTP-UHFFFAOYSA-N 1 2 303.837 4.284 20 0 DIADLO C[N@@H+](Cc1ccn(C2CCCC2)n1)Cc1ccc(Cl)cc1 ZINC000477156819 1047600327 /nfs/dbraw/zinc/60/03/27/1047600327.db2.gz OAFORRGFKAXPTP-UHFFFAOYSA-N 1 2 303.837 4.284 20 0 DIADLO CC(C)Oc1cc(-c2ccc(-c3c[nH+]cn3C)cc2)c(F)cn1 ZINC001206642912 1047603691 /nfs/dbraw/zinc/60/36/91/1047603691.db2.gz HJMZIEGRVRTIDZ-UHFFFAOYSA-N 1 2 311.360 4.075 20 0 DIADLO Cc1ccc(Nc2cccc([C@H]3CN4C=CSC4=N3)c2)c(C)[nH+]1 ZINC001203376035 1047611013 /nfs/dbraw/zinc/61/10/13/1047611013.db2.gz HFNSEKVZIZBNPY-QGZVFWFLSA-N 1 2 322.437 4.373 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@]3(C)CCC[C@@H]3C)cc2)[nH+]c1C ZINC001153557065 1047627591 /nfs/dbraw/zinc/62/75/91/1047627591.db2.gz TXTOKUHVBLOFHB-BUXKBTBVSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3CCCC3(C)C)cc2)[nH+]c1C ZINC001153556988 1047627996 /nfs/dbraw/zinc/62/79/96/1047627996.db2.gz SRCVVHJYLWKETE-MRXNPFEDSA-N 1 2 311.429 4.458 20 0 DIADLO CC(C)C[C@H](C(=O)NCC[C@@H](C)CC(C)(C)C)n1cc[nH+]c1 ZINC001154338604 1047645664 /nfs/dbraw/zinc/64/56/64/1047645664.db2.gz BBLVRMTZVUBLFU-HZPDHXFCSA-N 1 2 307.482 4.049 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc(Cl)c(F)c2)s1 ZINC000537960239 1047647768 /nfs/dbraw/zinc/64/77/68/1047647768.db2.gz NPFKBKCHBWIWHX-VIFPVBQESA-N 1 2 313.829 4.305 20 0 DIADLO CO[C@@H](c1ccc(Br)cc1)[C@@H](C)Nc1cccc[nH+]1 ZINC000538004531 1047652471 /nfs/dbraw/zinc/65/24/71/1047652471.db2.gz PNQQMWZWTDKCCG-IAQYHMDHSA-N 1 2 321.218 4.032 20 0 DIADLO Cc1nc(NCc2cccc(OC(F)F)c2)cc(C(C)C)[nH+]1 ZINC001154667718 1047654156 /nfs/dbraw/zinc/65/41/56/1047654156.db2.gz CACSCEQGKWVOIL-UHFFFAOYSA-N 1 2 307.344 4.122 20 0 DIADLO Cc1cc(NCc2cccc(OC(F)F)c2)nc(C(C)(C)C)[nH+]1 ZINC001154670356 1047654224 /nfs/dbraw/zinc/65/42/24/1047654224.db2.gz KSQGSYYIFMUZOL-UHFFFAOYSA-N 1 2 321.371 4.296 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nnc(-c2ccc(F)cc2)[nH]1)c1ccccc1 ZINC000538117849 1047657545 /nfs/dbraw/zinc/65/75/45/1047657545.db2.gz YRLQELSELVLZJU-GOSISDBHSA-N 1 2 324.403 4.098 20 0 DIADLO C[C@H]([NH2+][C@H](c1cccs1)c1ccc(F)cc1)c1nccn1C ZINC000538210961 1047663163 /nfs/dbraw/zinc/66/31/63/1047663163.db2.gz OVLNNYRDUSRIGW-LRDDRELGSA-N 1 2 315.417 4.061 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000538225119 1047663729 /nfs/dbraw/zinc/66/37/29/1047663729.db2.gz BIDMVWWPTWFTHD-CQSZACIVSA-N 1 2 307.397 4.150 20 0 DIADLO C[N@H+](Cc1ncc(-c2ccccc2)s1)Cc1cccc(O)c1 ZINC000538308749 1047669200 /nfs/dbraw/zinc/66/92/00/1047669200.db2.gz XPFLBSQOBNWUNA-UHFFFAOYSA-N 1 2 310.422 4.148 20 0 DIADLO C[N@@H+](Cc1ncc(-c2ccccc2)s1)Cc1cccc(O)c1 ZINC000538308749 1047669207 /nfs/dbraw/zinc/66/92/07/1047669207.db2.gz XPFLBSQOBNWUNA-UHFFFAOYSA-N 1 2 310.422 4.148 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1cc(Cl)nc(Cc2ccccc2)n1 ZINC001155181604 1047670909 /nfs/dbraw/zinc/67/09/09/1047670909.db2.gz UOZSYFLXXUUJHW-UHFFFAOYSA-N 1 2 302.809 4.156 20 0 DIADLO CSc1ccc(Oc2cc(NC(=[NH2+])C(C)(C)C)ncn2)cc1 ZINC001155180344 1047671005 /nfs/dbraw/zinc/67/10/05/1047671005.db2.gz SJYOEWHIHZSYNA-UHFFFAOYSA-N 1 2 316.430 4.426 20 0 DIADLO Cc1cc(Cl)c(C)c(NCc2ccc(C(F)(F)F)n2C)[nH+]1 ZINC001155246927 1047673471 /nfs/dbraw/zinc/67/34/71/1047673471.db2.gz DOODFPFGHNVKEG-UHFFFAOYSA-N 1 2 317.742 4.321 20 0 DIADLO COC(=O)c1ccc(C2(Nc3cc4ccccc4c[nH+]3)CC2)cc1 ZINC001155308129 1047676699 /nfs/dbraw/zinc/67/66/99/1047676699.db2.gz LQDIMRJHYNPFFM-UHFFFAOYSA-N 1 2 318.376 4.123 20 0 DIADLO COCc1cc[nH+]c(N2CCc3ccc(Cl)cc3[C@@H](C)C2)c1 ZINC001155457605 1047681680 /nfs/dbraw/zinc/68/16/80/1047681680.db2.gz JXMUFAYGWPPWQD-ZDUSSCGKSA-N 1 2 316.832 4.048 20 0 DIADLO Cc1c(F)cc[nH+]c1N1CCc2c(cccc2C(F)(F)F)C1 ZINC001155449846 1047681847 /nfs/dbraw/zinc/68/18/47/1047681847.db2.gz MRBIDUHYTNKZPK-UHFFFAOYSA-N 1 2 310.294 4.111 20 0 DIADLO CC(C)=CCC[C@H](C)[NH2+]c1ccc(N2CCOCC2)cc1C ZINC000538509509 1047684324 /nfs/dbraw/zinc/68/43/24/1047684324.db2.gz YBITVVSDZZJLGD-KRWDZBQOSA-N 1 2 302.462 4.378 20 0 DIADLO CSc1cc[nH+]c(N[C@H](c2ccccc2)c2ccncc2)c1 ZINC001156095063 1047699705 /nfs/dbraw/zinc/69/97/05/1047699705.db2.gz HXPVRHJMOZBOBC-GOSISDBHSA-N 1 2 307.422 4.400 20 0 DIADLO FC(F)(F)[C@@H](Nc1[nH+]ccc2ccccc21)c1cccnc1 ZINC001156155356 1047702799 /nfs/dbraw/zinc/70/27/99/1047702799.db2.gz LMLWMZRZVXGKDB-AWEZNQCLSA-N 1 2 303.287 4.345 20 0 DIADLO Cc1cc(NCc2cnc3ccccc3c2)nc(C(C)(C)C)[nH+]1 ZINC001156176276 1047704339 /nfs/dbraw/zinc/70/43/39/1047704339.db2.gz NXHXBTXLNVSWHN-UHFFFAOYSA-N 1 2 306.413 4.243 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@H]2c2ccc(Cl)cc2)nc1 ZINC000538737952 1047704297 /nfs/dbraw/zinc/70/42/97/1047704297.db2.gz MVGCPECFMWGREL-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@H]2c2ccc(Cl)cc2)nc1 ZINC000538737952 1047704303 /nfs/dbraw/zinc/70/43/03/1047704303.db2.gz MVGCPECFMWGREL-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(Cl)c(C)c(N2Cc3cnn(-c4ccccc4)c3C2)[nH+]1 ZINC001156199554 1047706215 /nfs/dbraw/zinc/70/62/15/1047706215.db2.gz XLXLJDYVMDDTMV-UHFFFAOYSA-N 1 2 324.815 4.058 20 0 DIADLO CCC[C@@H]1C[N@H+](Cc2cnc(-c3ccc(C)cc3)s2)CCO1 ZINC000538725544 1047706333 /nfs/dbraw/zinc/70/63/33/1047706333.db2.gz CUFHPSINRIUYHW-MRXNPFEDSA-N 1 2 316.470 4.119 20 0 DIADLO CCC[C@@H]1C[N@@H+](Cc2cnc(-c3ccc(C)cc3)s2)CCO1 ZINC000538725544 1047706335 /nfs/dbraw/zinc/70/63/35/1047706335.db2.gz CUFHPSINRIUYHW-MRXNPFEDSA-N 1 2 316.470 4.119 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000538763154 1047710992 /nfs/dbraw/zinc/71/09/92/1047710992.db2.gz JOTWIDDJGBSVOC-INIZCTEOSA-N 1 2 308.347 4.170 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000538763154 1047710995 /nfs/dbraw/zinc/71/09/95/1047710995.db2.gz JOTWIDDJGBSVOC-INIZCTEOSA-N 1 2 308.347 4.170 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@H+](Cc3ncc(C4CC4)o3)CC2)c1 ZINC000538788661 1047712433 /nfs/dbraw/zinc/71/24/33/1047712433.db2.gz UGGDDNXBWXNCKU-UHFFFAOYSA-N 1 2 308.425 4.458 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@@H+](Cc3ncc(C4CC4)o3)CC2)c1 ZINC000538788661 1047712437 /nfs/dbraw/zinc/71/24/37/1047712437.db2.gz UGGDDNXBWXNCKU-UHFFFAOYSA-N 1 2 308.425 4.458 20 0 DIADLO CCCOc1c(Cl)cc(C[N@@H+]2CC[C@](C)(F)C2)cc1OC ZINC000538823887 1047715273 /nfs/dbraw/zinc/71/52/73/1047715273.db2.gz LKPVKMPFPLLWEC-INIZCTEOSA-N 1 2 315.816 4.071 20 0 DIADLO CCCOc1c(Cl)cc(C[N@H+]2CC[C@](C)(F)C2)cc1OC ZINC000538823887 1047715276 /nfs/dbraw/zinc/71/52/76/1047715276.db2.gz LKPVKMPFPLLWEC-INIZCTEOSA-N 1 2 315.816 4.071 20 0 DIADLO c1ccc(-c2cc[nH+]c(NCC3(c4ccccc4)COC3)c2)cc1 ZINC001156586458 1047718268 /nfs/dbraw/zinc/71/82/68/1047718268.db2.gz FSKJEGXTTIUEEG-UHFFFAOYSA-N 1 2 316.404 4.129 20 0 DIADLO CC(C)c1ccc(N(C)Cc2ccc(-n3ccnc3)cc2)[nH+]c1 ZINC001156784020 1047722752 /nfs/dbraw/zinc/72/27/52/1047722752.db2.gz MHXWPTQCOWRGPA-UHFFFAOYSA-N 1 2 306.413 4.027 20 0 DIADLO CCCc1cc(N2CCC[C@@H]2c2c(F)cccc2F)nc(C)[nH+]1 ZINC001156940767 1047729163 /nfs/dbraw/zinc/72/91/63/1047729163.db2.gz UTZICGNBYRFCIN-MRXNPFEDSA-N 1 2 317.383 4.357 20 0 DIADLO Cc1cccc2c(C)cc(NCc3ccc4c(c3)CCO4)[nH+]c12 ZINC001156968242 1047731084 /nfs/dbraw/zinc/73/10/84/1047731084.db2.gz JWVILXUYXMYWIP-UHFFFAOYSA-N 1 2 304.393 4.399 20 0 DIADLO COC(=O)[C@H]1CC[C@H](Nc2[nH+]ccc3cc(Cl)ccc32)CC1 ZINC001157035879 1047732691 /nfs/dbraw/zinc/73/26/91/1047732691.db2.gz YNHNBJLBKYRUNS-YEORSEQZSA-N 1 2 318.804 4.032 20 0 DIADLO CC(C)c1[nH]cc(CNC(=O)C2CC(C)(C)CC(C)(C)C2)[nH+]1 ZINC001157124745 1047735143 /nfs/dbraw/zinc/73/51/43/1047735143.db2.gz OFJKPRXJTBQCDM-UHFFFAOYSA-N 1 2 305.466 4.002 20 0 DIADLO CC(C)c1[nH]c(CNC(=O)C2CC(C)(C)CC(C)(C)C2)c[nH+]1 ZINC001157124745 1047735150 /nfs/dbraw/zinc/73/51/50/1047735150.db2.gz OFJKPRXJTBQCDM-UHFFFAOYSA-N 1 2 305.466 4.002 20 0 DIADLO FC(F)(F)c1n[nH]c2c1CCN(c1[nH+]ccc3ccccc31)C2 ZINC001157341449 1047739993 /nfs/dbraw/zinc/73/99/93/1047739993.db2.gz FHYAMZJHZCZYAJ-CQSZACIVSA-N 1 2 318.302 4.096 20 0 DIADLO Cc1cc(NCc2cccc3cn(C)nc32)[nH+]c2ccccc12 ZINC001157418160 1047743136 /nfs/dbraw/zinc/74/31/36/1047743136.db2.gz HNMIBWFDUUYOAQ-UHFFFAOYSA-N 1 2 302.381 4.042 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](c2cccs2)C(CC)CC)no1 ZINC000539279124 1047743873 /nfs/dbraw/zinc/74/38/73/1047743873.db2.gz DANFCXRZGCRCKR-MRXNPFEDSA-N 1 2 307.463 4.351 20 0 DIADLO Oc1cccc(C2CCN(c3[nH+]ccc4ccccc43)CC2)c1 ZINC001157564050 1047746330 /nfs/dbraw/zinc/74/63/30/1047746330.db2.gz QJYWARXQGBLSHF-UHFFFAOYSA-N 1 2 304.393 4.324 20 0 DIADLO Fc1cccc([C@H]([NH2+]Cc2nnc(C3CC3)o2)C2CCCC2)c1 ZINC000539333653 1047746834 /nfs/dbraw/zinc/74/68/34/1047746834.db2.gz BCHZADRPJUTEFV-QGZVFWFLSA-N 1 2 315.392 4.107 20 0 DIADLO CSCc1cc[nH+]c(N[C@H](c2ccccn2)C(F)(F)F)c1 ZINC001157686050 1047749371 /nfs/dbraw/zinc/74/93/71/1047749371.db2.gz JRKBZPRPYLNEKX-CYBMUJFWSA-N 1 2 313.348 4.055 20 0 DIADLO Cc1cc(N2CCC(c3ccc(N)cc3)CC2)nc(C(C)(C)C)[nH+]1 ZINC001157705893 1047749991 /nfs/dbraw/zinc/74/99/91/1047749991.db2.gz ADVWZOJLSJSZDP-UHFFFAOYSA-N 1 2 324.472 4.049 20 0 DIADLO CCSc1cc[nH+]c(N[C@H](c2ccccn2)C(F)(F)F)c1 ZINC001157687753 1047750031 /nfs/dbraw/zinc/75/00/31/1047750031.db2.gz YOZXHFSCMLGNJN-CYBMUJFWSA-N 1 2 313.348 4.304 20 0 DIADLO COc1ccc(C2=CCN(c3cc(C)[nH+]c(C(C)C)n3)CC2)cc1 ZINC001157734636 1047751555 /nfs/dbraw/zinc/75/15/55/1047751555.db2.gz SEPZRLXXWZMJKW-UHFFFAOYSA-N 1 2 323.440 4.211 20 0 DIADLO CC(C)(C)c1ccc(N2CCC3(CCOC3(C)C)CC2)[nH+]c1 ZINC001157806419 1047755408 /nfs/dbraw/zinc/75/54/08/1047755408.db2.gz WTIZFWLLHABVOY-UHFFFAOYSA-N 1 2 302.462 4.165 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H]1C[C@H](C)C[C@H](C)C1 ZINC000477990224 1047762894 /nfs/dbraw/zinc/76/28/94/1047762894.db2.gz KBPYNTSMIUXOCA-VIKVFOODSA-N 1 2 311.429 4.396 20 0 DIADLO Cc1cc(C)cc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1 ZINC000477986203 1047763486 /nfs/dbraw/zinc/76/34/86/1047763486.db2.gz HJUYHPVXFMZSGL-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO Cc1ccc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c(F)c1 ZINC000478005116 1047764281 /nfs/dbraw/zinc/76/42/81/1047764281.db2.gz RPRYAQOZACQQCP-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO c1ccc2sc(C[N@@H+]3CCOC4(C3)CCCCCC4)nc2c1 ZINC000478036674 1047764725 /nfs/dbraw/zinc/76/47/25/1047764725.db2.gz UNVRGJQGLLEUOR-UHFFFAOYSA-N 1 2 316.470 4.222 20 0 DIADLO c1ccc2sc(C[N@H+]3CCOC4(C3)CCCCCC4)nc2c1 ZINC000478036674 1047764730 /nfs/dbraw/zinc/76/47/30/1047764730.db2.gz UNVRGJQGLLEUOR-UHFFFAOYSA-N 1 2 316.470 4.222 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H](C)c3ccc(C)cn3)cc(C)c2c1 ZINC001158019877 1047767486 /nfs/dbraw/zinc/76/74/86/1047767486.db2.gz ODAWPLYQNGSCBO-AWEZNQCLSA-N 1 2 307.397 4.428 20 0 DIADLO COc1ccc2[nH+]c(N[C@H](C)c3ccc(C)cn3)cc(C)c2c1 ZINC001158019878 1047767544 /nfs/dbraw/zinc/76/75/44/1047767544.db2.gz ODAWPLYQNGSCBO-CQSZACIVSA-N 1 2 307.397 4.428 20 0 DIADLO CSCc1ccc(NCc2c(Cl)cncc2Cl)[nH+]c1 ZINC001158302670 1047774712 /nfs/dbraw/zinc/77/47/12/1047774712.db2.gz KGEMKYSCCADUOZ-UHFFFAOYSA-N 1 2 314.241 4.259 20 0 DIADLO Cc1cc(N[C@H](C2CCC2)C(F)(F)F)nc(C(C)(C)C)[nH+]1 ZINC001158401701 1047779482 /nfs/dbraw/zinc/77/94/82/1047779482.db2.gz UPMLEEDAVSVZSW-GFCCVEGCSA-N 1 2 301.356 4.225 20 0 DIADLO CCOC(=O)/C=C/c1ccc[nH+]c1N[C@H]1C[C@@H](C)c2ccccc21 ZINC001158469219 1047781944 /nfs/dbraw/zinc/78/19/44/1047781944.db2.gz RTBHKMFVLFVHIE-UTBWHBDQSA-N 1 2 322.408 4.318 20 0 DIADLO C[C@H]1C[C@@H](Nc2cc(N3CCC[C@@H](C)C3)nc[nH+]2)c2ccccc21 ZINC001158476630 1047785087 /nfs/dbraw/zinc/78/50/87/1047785087.db2.gz MAPYGWMTFUZMAS-RVKKMQEKSA-N 1 2 322.456 4.373 20 0 DIADLO C[C@H]1C[C@@H](Nc2cc(N3CCC[C@@H](C)C3)[nH+]cn2)c2ccccc21 ZINC001158476630 1047785093 /nfs/dbraw/zinc/78/50/93/1047785093.db2.gz MAPYGWMTFUZMAS-RVKKMQEKSA-N 1 2 322.456 4.373 20 0 DIADLO COc1cc(C)c[nH+]c1N[C@@H](CCO)c1cccc2ccccc21 ZINC001158510073 1047788287 /nfs/dbraw/zinc/78/82/87/1047788287.db2.gz UECUOQWQILEZLF-SFHVURJKSA-N 1 2 322.408 4.087 20 0 DIADLO C[C@@H](Nc1cc(SCc2ccccc2)cc[nH+]1)c1cnccn1 ZINC001158601677 1047789934 /nfs/dbraw/zinc/78/99/34/1047789934.db2.gz VTLVKLOELSNGLC-CQSZACIVSA-N 1 2 322.437 4.337 20 0 DIADLO CCOC(=O)c1cnc2cc(Nc3ccc(C)[nH+]c3C)ccc2c1 ZINC001203380793 1047792464 /nfs/dbraw/zinc/79/24/64/1047792464.db2.gz NOCOHBWFGMFLQK-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO CSc1nc(NCc2ccccc2-c2cccnc2)cc(C)[nH+]1 ZINC001159103124 1047811126 /nfs/dbraw/zinc/81/11/26/1047811126.db2.gz CFFPANQRFXJOQR-UHFFFAOYSA-N 1 2 322.437 4.181 20 0 DIADLO Nc1ccc(Nc2cc(Cl)cc(C(F)(F)F)c2F)c[nH+]1 ZINC001159281817 1047825658 /nfs/dbraw/zinc/82/56/58/1047825658.db2.gz CCOLVKWQXCLDMB-UHFFFAOYSA-N 1 2 305.662 4.219 20 0 DIADLO Nc1ccc2cc(Nc3cc(Cl)c4[nH+]ccn4c3)ccc2c1 ZINC001159266731 1047825908 /nfs/dbraw/zinc/82/59/08/1047825908.db2.gz QCMREHCZOVSWJT-UHFFFAOYSA-N 1 2 308.772 4.467 20 0 DIADLO Clc1cccc2c(N[C@@H]3CCC[C@H]4OCC[C@H]43)cc[nH+]c12 ZINC000553148910 1047826120 /nfs/dbraw/zinc/82/61/20/1047826120.db2.gz KBDOWVJDKXBQJD-SGIREYDYSA-N 1 2 302.805 4.258 20 0 DIADLO Fc1cccc2oc(Nc3cc([C@H]4CCCC[NH2+]4)no3)cc21 ZINC001159311651 1047830032 /nfs/dbraw/zinc/83/00/32/1047830032.db2.gz NHIWXCPFINVNOC-GFCCVEGCSA-N 1 2 301.321 4.118 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncco1)c1cccc(OCc2ccccn2)c1 ZINC000924715774 1047838202 /nfs/dbraw/zinc/83/82/02/1047838202.db2.gz POWRUCVMOKGTNB-CABCVRRESA-N 1 2 323.396 4.060 20 0 DIADLO COc1cc(Nc2ccc3c(c2)CCCN3)[nH+]cc1C(F)(F)F ZINC001159416216 1047841521 /nfs/dbraw/zinc/84/15/21/1047841521.db2.gz NZGDDVHHWXPQLI-UHFFFAOYSA-N 1 2 323.318 4.211 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@H]2CCc3c2nccc3Cl)c(F)c1 ZINC000927094369 1047842159 /nfs/dbraw/zinc/84/21/59/1047842159.db2.gz VJSJTFBTOXFHHY-HNNXBMFYSA-N 1 2 308.759 4.099 20 0 DIADLO Cc1cc(NC(=O)c2coc3ccc(C(C)C)cc23)c(C)c[nH+]1 ZINC000553432838 1047849669 /nfs/dbraw/zinc/84/96/69/1047849669.db2.gz XZFBVNYBKGCNRO-UHFFFAOYSA-N 1 2 308.381 4.242 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2cccc(N)c2)c[nH+]1 ZINC001159465391 1047849793 /nfs/dbraw/zinc/84/97/93/1047849793.db2.gz URSWCHIEQWIJPJ-UHFFFAOYSA-N 1 2 304.397 4.044 20 0 DIADLO Cc1cccnc1C[N@@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001205807739 1047851155 /nfs/dbraw/zinc/85/11/55/1047851155.db2.gz VWLDZYFBFPCFPT-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cccnc1C[N@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001205807739 1047851167 /nfs/dbraw/zinc/85/11/67/1047851167.db2.gz VWLDZYFBFPCFPT-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Nc1cc(F)cc(Nc2ccc(N3CCCCC3)[nH+]c2)c1Cl ZINC001174525444 1047855224 /nfs/dbraw/zinc/85/52/24/1047855224.db2.gz ZLPBXYKVHCMENV-UHFFFAOYSA-N 1 2 320.799 4.190 20 0 DIADLO Nc1cc(Cl)cc2ccn(-c3ccc([NH+]4CCCC4)cc3)c21 ZINC001174527248 1047856686 /nfs/dbraw/zinc/85/66/86/1047856686.db2.gz BFJITXIDRNUVGP-UHFFFAOYSA-N 1 2 311.816 4.466 20 0 DIADLO O=c1cccc2[nH]cc(Nc3ccc([NH+]4CCCC4)cc3)cc1-2 ZINC001174526923 1047858036 /nfs/dbraw/zinc/85/80/36/1047858036.db2.gz FQDVXLDZIYUAIC-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO COc1cccc(C[NH2+][C@@H](CCc2ccccc2)C(F)F)c1C ZINC001182990827 1047872428 /nfs/dbraw/zinc/87/24/28/1047872428.db2.gz ULCNAHHLADCOJO-KRWDZBQOSA-N 1 2 319.395 4.360 20 0 DIADLO Cc1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)c(Cl)n1 ZINC001174522592 1047885270 /nfs/dbraw/zinc/88/52/70/1047885270.db2.gz NHRKRBWGPVEWRA-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO O=c1cccc2[nH]cc(Nc3ccc(N4CCCCC4)[nH+]c3)cc1-2 ZINC001174522645 1047885308 /nfs/dbraw/zinc/88/53/08/1047885308.db2.gz QGGRNYLNQWXQSC-UHFFFAOYSA-N 1 2 320.396 4.069 20 0 DIADLO COc1c(Cl)cccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174522688 1047885537 /nfs/dbraw/zinc/88/55/37/1047885537.db2.gz UHHFZLGGRDDJAK-UHFFFAOYSA-N 1 2 317.820 4.478 20 0 DIADLO c1cnc(C2CCC2)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174522915 1047885598 /nfs/dbraw/zinc/88/55/98/1047885598.db2.gz ZAKATVGIGAEZJV-UHFFFAOYSA-N 1 2 308.429 4.478 20 0 DIADLO FC(F)Oc1cccc(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174524455 1047887545 /nfs/dbraw/zinc/88/75/45/1047887545.db2.gz KRIPNLNIPWASCO-UHFFFAOYSA-N 1 2 319.355 4.417 20 0 DIADLO O=c1ccc2cccc(Nc3ccc(N4CCCCC4)[nH+]c3)c2[nH]1 ZINC001174524272 1047887634 /nfs/dbraw/zinc/88/76/34/1047887634.db2.gz CKUXQCHGWUTBOC-UHFFFAOYSA-N 1 2 320.396 4.069 20 0 DIADLO Nc1ccc(Cl)cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174524050 1047888503 /nfs/dbraw/zinc/88/85/03/1047888503.db2.gz BGYSNMIGKKZUEP-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO Oc1cccc(Nc2ccc(N3CCCCC3)[nH+]c2)c1Cl ZINC001174523932 1047888877 /nfs/dbraw/zinc/88/88/77/1047888877.db2.gz YQFNYWUKGCNGNI-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO CC(C)(O)c1cncc(Nc2cc[nH+]c3cc(Cl)ccc23)c1 ZINC001174589569 1047895806 /nfs/dbraw/zinc/89/58/06/1047895806.db2.gz BCZCDEULGYCYRW-UHFFFAOYSA-N 1 2 313.788 4.254 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1ccc(F)cc1F ZINC000927106545 1047898133 /nfs/dbraw/zinc/89/81/33/1047898133.db2.gz CRTILSIBJQQFDF-SFHVURJKSA-N 1 2 319.399 4.063 20 0 DIADLO CNc1ccc(Nc2ccc3c(c2)C(=O)c2ccccc2-3)c[nH+]1 ZINC001159713701 1047907189 /nfs/dbraw/zinc/90/71/89/1047907189.db2.gz JZGFNOHVXUZHPZ-UHFFFAOYSA-N 1 2 301.349 4.078 20 0 DIADLO Cc1ccc(Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)[nH+]c2)cc1C ZINC001174632852 1047917156 /nfs/dbraw/zinc/91/71/56/1047917156.db2.gz CNPMOMFQSILTNR-IYBDPMFKSA-N 1 2 311.429 4.056 20 0 DIADLO CC(C)[N@H+](Cc1cn(C2CCC2)nn1)Cc1cccc(Cl)c1 ZINC000667505395 1047920177 /nfs/dbraw/zinc/92/01/77/1047920177.db2.gz NZPPHFMDLOPKAW-UHFFFAOYSA-N 1 2 318.852 4.067 20 0 DIADLO CC(C)[N@@H+](Cc1cn(C2CCC2)nn1)Cc1cccc(Cl)c1 ZINC000667505395 1047920197 /nfs/dbraw/zinc/92/01/97/1047920197.db2.gz NZPPHFMDLOPKAW-UHFFFAOYSA-N 1 2 318.852 4.067 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3C[C@@]3(C)C(C)C)c2)[nH+]c1C ZINC000775817800 1047925940 /nfs/dbraw/zinc/92/59/40/1047925940.db2.gz HNBSAJIENRVEFA-LPHOPBHVSA-N 1 2 311.429 4.314 20 0 DIADLO FC(F)(CNc1[nH+]ccc2cc(Cl)ccc21)c1ccccn1 ZINC001159793007 1047926959 /nfs/dbraw/zinc/92/69/59/1047926959.db2.gz HXWWHPOPEATHAP-UHFFFAOYSA-N 1 2 319.742 4.487 20 0 DIADLO CCc1c(C)cc(N(CCCOC)c2[nH+]cccc2N)cc1C ZINC001174678986 1047930577 /nfs/dbraw/zinc/93/05/77/1047930577.db2.gz IHURIEUWLGVWIV-UHFFFAOYSA-N 1 2 313.445 4.018 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1ccncc1Cl)CC1CC1 ZINC001174680291 1047931899 /nfs/dbraw/zinc/93/18/99/1047931899.db2.gz FFJKKOVWMWFIHT-UHFFFAOYSA-N 1 2 304.796 4.286 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1ccncc1Cl)CC1CC1 ZINC001174680291 1047931911 /nfs/dbraw/zinc/93/19/11/1047931911.db2.gz FFJKKOVWMWFIHT-UHFFFAOYSA-N 1 2 304.796 4.286 20 0 DIADLO Clc1ccnc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c1Cl ZINC001174691325 1047934762 /nfs/dbraw/zinc/93/47/62/1047934762.db2.gz QIYSOQCRZJSZNN-MRXNPFEDSA-N 1 2 322.239 4.414 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2c(N)cccc2F)c[nH+]1 ZINC001159903965 1047945674 /nfs/dbraw/zinc/94/56/74/1047945674.db2.gz LUUIFZIFXJTLEZ-UHFFFAOYSA-N 1 2 322.387 4.183 20 0 DIADLO COC(=O)c1cccc([C@H](C)Nc2ccc(C(C)(C)C)c[nH+]2)c1 ZINC001159960677 1047959145 /nfs/dbraw/zinc/95/91/45/1047959145.db2.gz ZEZJVVDAFHWYCZ-ZDUSSCGKSA-N 1 2 312.413 4.339 20 0 DIADLO CC(C)c1ccccc1NC(=O)[C@H]1CC[N@@H+]1Cc1ccccc1 ZINC001183744651 1047962193 /nfs/dbraw/zinc/96/21/93/1047962193.db2.gz JROLBPWYWXYJLU-LJQANCHMSA-N 1 2 308.425 4.023 20 0 DIADLO CC(C)c1ccccc1NC(=O)[C@H]1CC[N@H+]1Cc1ccccc1 ZINC001183744651 1047962203 /nfs/dbraw/zinc/96/22/03/1047962203.db2.gz JROLBPWYWXYJLU-LJQANCHMSA-N 1 2 308.425 4.023 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)[C@H]2CC[N@@H+]2Cc2ccccc2)cc1 ZINC001183745276 1047963602 /nfs/dbraw/zinc/96/36/02/1047963602.db2.gz QZCWTAIVCNTODM-OXQOHEQNSA-N 1 2 322.452 4.413 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)[C@H]2CC[N@H+]2Cc2ccccc2)cc1 ZINC001183745276 1047963615 /nfs/dbraw/zinc/96/36/15/1047963615.db2.gz QZCWTAIVCNTODM-OXQOHEQNSA-N 1 2 322.452 4.413 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cc(C(F)(F)F)ccc1OC ZINC001174774407 1047967709 /nfs/dbraw/zinc/96/77/09/1047967709.db2.gz AHNBVGADJOFXLX-UHFFFAOYSA-N 1 2 312.291 4.251 20 0 DIADLO COc1ccc2[nH+]c(N[C@H]3COCc4ccccc43)c(C)cc2c1 ZINC001160115224 1047981152 /nfs/dbraw/zinc/98/11/52/1047981152.db2.gz BDPFCEUAEVMXBQ-IBGZPJMESA-N 1 2 320.392 4.235 20 0 DIADLO CC(C)n1cc(CNc2ccc(Nc3ccccc3)c[nH+]2)cn1 ZINC001203194299 1047995993 /nfs/dbraw/zinc/99/59/93/1047995993.db2.gz GPEIRGRCQQCQHF-UHFFFAOYSA-N 1 2 307.401 4.215 20 0 DIADLO Cc1cccc(NC(=S)Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001198683408 1047996453 /nfs/dbraw/zinc/99/64/53/1047996453.db2.gz YZCDPYNDYFIHBB-UHFFFAOYSA-N 1 2 322.437 4.049 20 0 DIADLO c1cn(Cc2cccc(Nc3cccc4cccnc43)c2)c[nH+]1 ZINC001174861312 1048006190 /nfs/dbraw/zinc/00/61/90/1048006190.db2.gz GSZWIVRDSBGPIV-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO CC(C)(C)[C@H]1CC[C@H](C(=O)NCc2c[nH+]cn2C2CCC2)CC1 ZINC001184222832 1048011819 /nfs/dbraw/zinc/01/18/19/1048011819.db2.gz MKEFZDTWGOXUMB-SHTZXODSSA-N 1 2 317.477 4.077 20 0 DIADLO Fc1ccc(C[NH+]2CC(Cc3ccoc3)C2)c(C(F)(F)F)c1 ZINC001184196148 1048016716 /nfs/dbraw/zinc/01/67/16/1048016716.db2.gz FEMWQQWMSGTLJP-UHFFFAOYSA-N 1 2 313.294 4.112 20 0 DIADLO Cc1cc(Nc2ccc(Br)c(N)c2)ccc1[NH+](C)C ZINC001160303823 1048026160 /nfs/dbraw/zinc/02/61/60/1048026160.db2.gz UQGJIEYIZUSLOP-UHFFFAOYSA-N 1 2 320.234 4.149 20 0 DIADLO COc1cc(Nc2cc(-c3cccs3)ccc2N)cc(C)[nH+]1 ZINC001160320806 1048032650 /nfs/dbraw/zinc/03/26/50/1048032650.db2.gz YIMSCKXCTWCSCO-UHFFFAOYSA-N 1 2 311.410 4.453 20 0 DIADLO Cc1ccc(N)c(Nc2ccc(N(C)C3CCCCC3)[nH+]c2)c1 ZINC001160336329 1048036710 /nfs/dbraw/zinc/03/67/10/1048036710.db2.gz QABWTVICXJUUNF-UHFFFAOYSA-N 1 2 310.445 4.485 20 0 DIADLO Cc1ccc(Nc2ccc(N3CCOCC3)[nH+]c2)c2ccccc12 ZINC001174977678 1048036848 /nfs/dbraw/zinc/03/68/48/1048036848.db2.gz MUWIYYFFMBQDTI-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO Cc1ccccc1Nc1ccc(O[C@H]2CC[NH2+]CC2(F)F)cc1 ZINC001160341663 1048038275 /nfs/dbraw/zinc/03/82/75/1048038275.db2.gz VVRRFMOPMXPBCO-KRWDZBQOSA-N 1 2 318.367 4.115 20 0 DIADLO O=c1ccoc2ccc(Nc3cc[nH+]c4ccc(Cl)cc34)cc12 ZINC001174938843 1048039553 /nfs/dbraw/zinc/03/95/53/1048039553.db2.gz DPOHFTJKOJVRQK-UHFFFAOYSA-N 1 2 322.751 4.160 20 0 DIADLO CSCc1ccc(C[N@@H+]2CCc3cc(F)cc(F)c3C2)cc1 ZINC001184418919 1048039675 /nfs/dbraw/zinc/03/96/75/1048039675.db2.gz VDDWXOHBCZHYAN-UHFFFAOYSA-N 1 2 319.420 4.386 20 0 DIADLO CSCc1ccc(C[N@H+]2CCc3cc(F)cc(F)c3C2)cc1 ZINC001184418919 1048039690 /nfs/dbraw/zinc/03/96/90/1048039690.db2.gz VDDWXOHBCZHYAN-UHFFFAOYSA-N 1 2 319.420 4.386 20 0 DIADLO CO[C@@](C)(CNc1[nH+]c2ccccc2n1CCC(C)C)C1CC1 ZINC001184461909 1048043249 /nfs/dbraw/zinc/04/32/49/1048043249.db2.gz FVCSEGZZXRLRFQ-IBGZPJMESA-N 1 2 315.461 4.309 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2csc(C(C)(C)C)n2)C1 ZINC000554265633 1048050386 /nfs/dbraw/zinc/05/03/86/1048050386.db2.gz UHGXPJSZSUFERI-CJNGLKHVSA-N 1 2 315.486 4.419 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2csc(C(C)(C)C)n2)C1 ZINC000554265633 1048050399 /nfs/dbraw/zinc/05/03/99/1048050399.db2.gz UHGXPJSZSUFERI-CJNGLKHVSA-N 1 2 315.486 4.419 20 0 DIADLO C[C@](CO)(Nc1[nH+]ccc2cc(Cl)ccc21)c1ccccc1 ZINC001160435732 1048050758 /nfs/dbraw/zinc/05/07/58/1048050758.db2.gz NBQYWRYXFOZOIG-GOSISDBHSA-N 1 2 312.800 4.208 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]C2(c3ccc(F)cc3F)CCC2)cs1 ZINC000554265623 1048051460 /nfs/dbraw/zinc/05/14/60/1048051460.db2.gz PFFDYRKAKZVROL-SNVBAGLBSA-N 1 2 308.397 4.460 20 0 DIADLO COc1cc(Cl)ncc1NC(=[NH2+])c1cccc2ccccc21 ZINC001160501799 1048059751 /nfs/dbraw/zinc/05/97/51/1048059751.db2.gz IJUXATLKOYZASA-UHFFFAOYSA-N 1 2 311.772 4.334 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1nc2ccccc2[nH]1 ZINC000554311419 1048065611 /nfs/dbraw/zinc/06/56/11/1048065611.db2.gz YWJFSIDQXRMJOH-QGZVFWFLSA-N 1 2 309.413 4.155 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1nc2ccccc2[nH]1 ZINC000554311419 1048065628 /nfs/dbraw/zinc/06/56/28/1048065628.db2.gz YWJFSIDQXRMJOH-QGZVFWFLSA-N 1 2 309.413 4.155 20 0 DIADLO CCSc1cc[nH+]c(N[C@H](c2ccccc2)C2(O)CCC2)c1 ZINC001160543400 1048066419 /nfs/dbraw/zinc/06/64/19/1048066419.db2.gz KHZFLTSZBUKDLF-QGZVFWFLSA-N 1 2 314.454 4.262 20 0 DIADLO CC(C)CN(C(=O)C[N@@H+]1CC(C)(C)[C@@H]1c1cccs1)C(C)C ZINC000554309809 1048066504 /nfs/dbraw/zinc/06/65/04/1048066504.db2.gz WJECDXOYKZQBKB-KRWDZBQOSA-N 1 2 322.518 4.024 20 0 DIADLO CC(C)CN(C(=O)C[N@H+]1CC(C)(C)[C@@H]1c1cccs1)C(C)C ZINC000554309809 1048066518 /nfs/dbraw/zinc/06/65/18/1048066518.db2.gz WJECDXOYKZQBKB-KRWDZBQOSA-N 1 2 322.518 4.024 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@@H](c2ccccc2)C2(O)CCC2)[nH+]1 ZINC001160542182 1048066601 /nfs/dbraw/zinc/06/66/01/1048066601.db2.gz YNMIGPWXCCUOEH-INIZCTEOSA-N 1 2 316.832 4.420 20 0 DIADLO C[C@H]1c2cc(F)cc(F)c2CC[N@H+]1CCC(=O)c1ccccc1 ZINC000554355598 1048075778 /nfs/dbraw/zinc/07/57/78/1048075778.db2.gz XGGSDIUSWJDZRJ-ZDUSSCGKSA-N 1 2 315.363 4.157 20 0 DIADLO C[C@H]1c2cc(F)cc(F)c2CC[N@@H+]1CCC(=O)c1ccccc1 ZINC000554355598 1048075794 /nfs/dbraw/zinc/07/57/94/1048075794.db2.gz XGGSDIUSWJDZRJ-ZDUSSCGKSA-N 1 2 315.363 4.157 20 0 DIADLO Cc1csc2cnc(N[C@@H](C)c3c[nH+]c4c(C)cccn34)nc12 ZINC001160686925 1048076759 /nfs/dbraw/zinc/07/67/59/1048076759.db2.gz SKHAPLALRBJTCN-LBPRGKRZSA-N 1 2 323.425 4.129 20 0 DIADLO CSc1cnc(N[C@@H](C)c2c[nH+]c3c(C)cccn23)c(C)c1 ZINC001160687034 1048076820 /nfs/dbraw/zinc/07/68/20/1048076820.db2.gz YNVKKUUQSCQRLR-ZDUSSCGKSA-N 1 2 312.442 4.241 20 0 DIADLO COc1ccc(Nc2ccc[nH+]c2N2CCCCC2)c(F)c1F ZINC001175021460 1048076802 /nfs/dbraw/zinc/07/68/02/1048076802.db2.gz NSOUOFFXVZVRJA-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO C[C@@H]1c2cc(F)cc(F)c2CC[N@H+]1CCC(=O)c1ccccc1 ZINC000554355596 1048076992 /nfs/dbraw/zinc/07/69/92/1048076992.db2.gz XGGSDIUSWJDZRJ-CYBMUJFWSA-N 1 2 315.363 4.157 20 0 DIADLO C[C@@H]1c2cc(F)cc(F)c2CC[N@@H+]1CCC(=O)c1ccccc1 ZINC000554355596 1048077007 /nfs/dbraw/zinc/07/70/07/1048077007.db2.gz XGGSDIUSWJDZRJ-CYBMUJFWSA-N 1 2 315.363 4.157 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3cnc4cccc(C)c4n3)c[nH+]c12 ZINC001160683342 1048077511 /nfs/dbraw/zinc/07/75/11/1048077511.db2.gz LYCMVCYHSQVMSW-AWEZNQCLSA-N 1 2 317.396 4.067 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3ncnc4c(C)cccc34)c[nH+]c12 ZINC001160683378 1048077998 /nfs/dbraw/zinc/07/79/98/1048077998.db2.gz NQKINUFCCMXVAD-AWEZNQCLSA-N 1 2 317.396 4.067 20 0 DIADLO Cc1ccc2nc(N[C@@H](C)c3c[nH+]c4c(C)cccn34)ncc2c1 ZINC001160686993 1048078642 /nfs/dbraw/zinc/07/86/42/1048078642.db2.gz WQGCJFBVSXJLAL-AWEZNQCLSA-N 1 2 317.396 4.067 20 0 DIADLO CC[C@@H]1C[C@@H](CNc2ccc([NH+]3CCCC3)cc2C)CCO1 ZINC001199591591 1048079209 /nfs/dbraw/zinc/07/92/09/1048079209.db2.gz FFPIWOKQLBTIEM-FUHWJXTLSA-N 1 2 302.462 4.212 20 0 DIADLO CC[C@@H]1C[C@@H](C[NH2+]c2ccc(N3CCCC3)cc2C)CCO1 ZINC001199591591 1048079224 /nfs/dbraw/zinc/07/92/24/1048079224.db2.gz FFPIWOKQLBTIEM-FUHWJXTLSA-N 1 2 302.462 4.212 20 0 DIADLO COc1cc(C)c(CNc2ccc(CSC)c[nH+]2)cc1C ZINC001160776237 1048083217 /nfs/dbraw/zinc/08/32/17/1048083217.db2.gz QHRUBERUBMBJIU-UHFFFAOYSA-N 1 2 302.443 4.182 20 0 DIADLO COc1ccc2ccc(NCCc3c[nH]c4ccccc34)[nH+]c2c1 ZINC001160779801 1048084458 /nfs/dbraw/zinc/08/44/58/1048084458.db2.gz DKNFYFGQQGBBBY-UHFFFAOYSA-N 1 2 317.392 4.379 20 0 DIADLO Cc1noc2ccc(CNc3cc(C)[nH+]c(C(C)(C)C)n3)cc12 ZINC001160868966 1048093584 /nfs/dbraw/zinc/09/35/84/1048093584.db2.gz WUIJYSNFKFQCSO-UHFFFAOYSA-N 1 2 310.401 4.144 20 0 DIADLO CC[C@H](COC)Nc1cc(SCc2ccccc2)cc[nH+]1 ZINC001160935261 1048100007 /nfs/dbraw/zinc/10/00/07/1048100007.db2.gz DMVSNVSLGRCJBL-OAHLLOKOSA-N 1 2 302.443 4.211 20 0 DIADLO CCOc1ccc(F)c(Nc2ccc(-n3cc[nH+]c3)cc2)c1F ZINC001175037427 1048101913 /nfs/dbraw/zinc/10/19/13/1048101913.db2.gz GTPNACNXELIBLO-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO CC(=O)Nc1c(C)cc[nH+]c1N[C@H](C)c1ccc(Cl)cc1C ZINC001161001586 1048103370 /nfs/dbraw/zinc/10/33/70/1048103370.db2.gz RXFXZMQPWCSJTL-GFCCVEGCSA-N 1 2 317.820 4.483 20 0 DIADLO Cc1ccnc2cc(Nc3ccc[nH+]c3N3CCCC3)ccc12 ZINC001184965045 1048105957 /nfs/dbraw/zinc/10/59/57/1048105957.db2.gz QXGQGNTUGAZXDQ-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO Nc1cccc2cccc(Nc3ccc[nH+]c3N3CCCC3)c12 ZINC001184967978 1048107571 /nfs/dbraw/zinc/10/75/71/1048107571.db2.gz ICRDBQCICFTZAL-UHFFFAOYSA-N 1 2 304.397 4.161 20 0 DIADLO Fc1cc(Cl)cc(F)c1Nc1ccc[nH+]c1N1CCCC1 ZINC001184967303 1048107614 /nfs/dbraw/zinc/10/76/14/1048107614.db2.gz AESCFLQPMVAPGJ-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO CC(=O)c1ccc(Cl)c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001184968461 1048107979 /nfs/dbraw/zinc/10/79/79/1048107979.db2.gz MNCLQXKKFNXUEN-UHFFFAOYSA-N 1 2 315.804 4.281 20 0 DIADLO c1[nH]c2c(cccc2Nc2cccnc2OCc2ccccc2)[nH+]1 ZINC001213029504 1048108965 /nfs/dbraw/zinc/10/89/65/1048108965.db2.gz NMQAPVPBUYLAQU-UHFFFAOYSA-N 1 2 316.364 4.281 20 0 DIADLO CCOc1cc(Nc2[nH+]cccc2N2CCCCC2)ccc1F ZINC001175050416 1048110287 /nfs/dbraw/zinc/11/02/87/1048110287.db2.gz UBCZWWNNIJXWOU-UHFFFAOYSA-N 1 2 315.392 4.353 20 0 DIADLO CCOc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)ccc1F ZINC001175051924 1048110649 /nfs/dbraw/zinc/11/06/49/1048110649.db2.gz OTZDKSFCSVODBE-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO Cc1cnn(-c2ccccc2Cl)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213030538 1048112328 /nfs/dbraw/zinc/11/23/28/1048112328.db2.gz DOJBJXVEWKFKGF-UHFFFAOYSA-N 1 2 323.787 4.454 20 0 DIADLO Fc1cc(Br)cc(F)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213030818 1048112844 /nfs/dbraw/zinc/11/28/44/1048112844.db2.gz SNIMGDQVFCHOPU-UHFFFAOYSA-N 1 2 324.128 4.347 20 0 DIADLO COc1ccc(Nc2cccc3[nH+]c[nH]c32)c(C(F)(F)F)c1 ZINC001213030889 1048115982 /nfs/dbraw/zinc/11/59/82/1048115982.db2.gz VVTVASREZUCFPD-UHFFFAOYSA-N 1 2 307.275 4.334 20 0 DIADLO Clc1sccc1C[NH2+]Cc1ncoc1-c1ccccc1 ZINC000480305761 1048119219 /nfs/dbraw/zinc/11/92/19/1048119219.db2.gz HSDJQQUSVYKCFJ-UHFFFAOYSA-N 1 2 304.802 4.346 20 0 DIADLO CC(C)c1ccc(NC2(c3ccccc3Cl)COC2)[nH+]c1 ZINC001161265524 1048119731 /nfs/dbraw/zinc/11/97/31/1048119731.db2.gz MNVXAGZAJLUWBN-UHFFFAOYSA-N 1 2 302.805 4.196 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2cc(Cl)cc3c2OCC3)cs1 ZINC000927142755 1048121391 /nfs/dbraw/zinc/12/13/91/1048121391.db2.gz XAAYMYVHCQRQTD-ZJUUUORDSA-N 1 2 322.861 4.452 20 0 DIADLO CC(C)Oc1c(F)cccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001185043906 1048123410 /nfs/dbraw/zinc/12/34/10/1048123410.db2.gz QBNDBSUQNRIMPH-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO c1ccc(-c2cccnc2)c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001185043940 1048123489 /nfs/dbraw/zinc/12/34/89/1048123489.db2.gz RBTJKNMYWBGKST-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO COc1ccc(Nc2ccc3c(c2)[nH+]cn3C)cc1C(F)(F)F ZINC001175071613 1048127327 /nfs/dbraw/zinc/12/73/27/1048127327.db2.gz VPDIXEHZXWDZOB-UHFFFAOYSA-N 1 2 321.302 4.344 20 0 DIADLO Fc1c(C[N@H+]2CC=C(C(F)(F)F)CC2)cccc1OC1CC1 ZINC000667666301 1048128992 /nfs/dbraw/zinc/12/89/92/1048128992.db2.gz IWBSLCXKMSJBON-UHFFFAOYSA-N 1 2 315.310 4.061 20 0 DIADLO Fc1c(C[N@@H+]2CC=C(C(F)(F)F)CC2)cccc1OC1CC1 ZINC000667666301 1048129006 /nfs/dbraw/zinc/12/90/06/1048129006.db2.gz IWBSLCXKMSJBON-UHFFFAOYSA-N 1 2 315.310 4.061 20 0 DIADLO COc1ccc2[nH+]c(NC[C@H]3CCOC(C)(C)C3)c(C)cc2c1 ZINC001161422763 1048128954 /nfs/dbraw/zinc/12/89/54/1048128954.db2.gz BVVBTQQJNYIZIB-AWEZNQCLSA-N 1 2 314.429 4.169 20 0 DIADLO COc1cc(Br)cc(Nc2cccc3[nH+]c[nH]c32)c1 ZINC001213032733 1048130690 /nfs/dbraw/zinc/13/06/90/1048130690.db2.gz VPJFPHDGQVVYJN-UHFFFAOYSA-N 1 2 318.174 4.078 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cc(C(F)(F)F)ccc3F)ccc21 ZINC001175075941 1048130689 /nfs/dbraw/zinc/13/06/89/1048130689.db2.gz DESWQLPCUYNFPS-UHFFFAOYSA-N 1 2 309.266 4.475 20 0 DIADLO Nc1cc(F)c(C(F)(F)F)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213032741 1048131239 /nfs/dbraw/zinc/13/12/39/1048131239.db2.gz VUSCWLYZKYRLNO-UHFFFAOYSA-N 1 2 310.254 4.047 20 0 DIADLO CNc1cccc(Br)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213032783 1048131372 /nfs/dbraw/zinc/13/13/72/1048131372.db2.gz XSDAUNHVNABPBT-UHFFFAOYSA-N 1 2 317.190 4.111 20 0 DIADLO Cc1cccc(C2(CC(=O)Nc3ccn4cc[nH+]c4c3)CCC2)c1 ZINC001185083278 1048133564 /nfs/dbraw/zinc/13/35/64/1048133564.db2.gz JJMMHBQKVOHMLH-UHFFFAOYSA-N 1 2 319.408 4.093 20 0 DIADLO Cc1c(Cl)nc(C2CCC2)nc1NCc1c[nH+]cn1C(C)C ZINC001161570131 1048140469 /nfs/dbraw/zinc/14/04/69/1048140469.db2.gz VSBGJFYOHWAKRY-UHFFFAOYSA-N 1 2 319.840 4.095 20 0 DIADLO CC(C)c1nc(NCc2c[nH+]cn2C(C)C)cc(C(C)(C)C)n1 ZINC001161569059 1048141050 /nfs/dbraw/zinc/14/10/50/1048141050.db2.gz HEBZWXCARUMLEB-UHFFFAOYSA-N 1 2 315.465 4.287 20 0 DIADLO Cc1ccccc1[C@H](CC(C)C)NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000567392447 1048142532 /nfs/dbraw/zinc/14/25/32/1048142532.db2.gz RBSLRJWBJPWQLG-WMZOPIPTSA-N 1 2 313.445 4.046 20 0 DIADLO Cc1[nH]c2ccccc2c1CCNc1nc(C)[nH+]c2c1CCCC2 ZINC001185197735 1048145373 /nfs/dbraw/zinc/14/53/73/1048145373.db2.gz OYWVECHIYZFRTC-UHFFFAOYSA-N 1 2 320.440 4.108 20 0 DIADLO Cc1cc(NCC2(Cc3ccc(F)cc3)CC2)nc(C2CC2)[nH+]1 ZINC001161623276 1048148252 /nfs/dbraw/zinc/14/82/52/1048148252.db2.gz VYDYZAXUUGUQCC-UHFFFAOYSA-N 1 2 311.404 4.236 20 0 DIADLO CCCC[C@H]1CCC[C@H]1Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001185241239 1048150807 /nfs/dbraw/zinc/15/08/07/1048150807.db2.gz HHGJIDXHKOVRCT-DZGCQCFKSA-N 1 2 315.465 4.352 20 0 DIADLO Cc1cc(Oc2ccc(NC(=S)NC(C)(C)C)cc2)cc[nH+]1 ZINC001200908718 1048153658 /nfs/dbraw/zinc/15/36/58/1048153658.db2.gz FMFJAOGATQQLDE-UHFFFAOYSA-N 1 2 315.442 4.267 20 0 DIADLO COc1cc(NCCCn2cc[nH+]c2)ccc1Oc1ccccc1 ZINC001161689141 1048154771 /nfs/dbraw/zinc/15/47/71/1048154771.db2.gz JEDLVJXVMGJNMO-UHFFFAOYSA-N 1 2 323.396 4.186 20 0 DIADLO Cc1c(C)c(OCC(C)C)ccc1NCCCn1cc[nH+]c1 ZINC001161688864 1048155592 /nfs/dbraw/zinc/15/55/92/1048155592.db2.gz AANKYPMDPOEFAZ-UHFFFAOYSA-N 1 2 301.434 4.037 20 0 DIADLO Cc1cc(NCCc2ccc(F)cc2Cl)nc(C2CCC2)[nH+]1 ZINC001185297713 1048159743 /nfs/dbraw/zinc/15/97/43/1048159743.db2.gz CUPKSIBTDYJPAS-UHFFFAOYSA-N 1 2 319.811 4.500 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2Cl)C[N@@H+]1C[C@H]1CCC(C)(C)O1 ZINC000480522506 1048162330 /nfs/dbraw/zinc/16/23/30/1048162330.db2.gz DAGPRBJQKUTIFD-CKEIUWERSA-N 1 2 323.864 4.059 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2Cl)C[N@H+]1C[C@H]1CCC(C)(C)O1 ZINC000480522506 1048162333 /nfs/dbraw/zinc/16/23/33/1048162333.db2.gz DAGPRBJQKUTIFD-CKEIUWERSA-N 1 2 323.864 4.059 20 0 DIADLO CC(C)Oc1cc(F)cc(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175142255 1048164856 /nfs/dbraw/zinc/16/48/56/1048164856.db2.gz WJMIMYCMFINPCJ-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO COc1cc(C)c[nH+]c1N[C@H](CC1CC1)c1ccccc1F ZINC001161772411 1048169840 /nfs/dbraw/zinc/16/98/40/1048169840.db2.gz MPDGBTWDNZXREF-MRXNPFEDSA-N 1 2 300.377 4.491 20 0 DIADLO CCO[C@H]1C[C@@H](Nc2cc(C(C)C)[nH+]c(C(C)C)n2)C12CCC2 ZINC001185421430 1048175732 /nfs/dbraw/zinc/17/57/32/1048175732.db2.gz VOJLXPGPLZXVEG-CVEARBPZSA-N 1 2 317.477 4.483 20 0 DIADLO CCO[C@@H]1C[C@@H](Nc2cc(C(C)C)[nH+]c(C(C)C)n2)C12CCC2 ZINC001185421432 1048176285 /nfs/dbraw/zinc/17/62/85/1048176285.db2.gz VOJLXPGPLZXVEG-HZPDHXFCSA-N 1 2 317.477 4.483 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@H](c2cncc(F)c2)C2CC2)[nH+]1 ZINC001161815065 1048176729 /nfs/dbraw/zinc/17/67/29/1048176729.db2.gz MDNUPTMXELUBEK-HNNXBMFYSA-N 1 2 305.784 4.449 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000480564297 1048180428 /nfs/dbraw/zinc/18/04/28/1048180428.db2.gz RVMFLCYXUGSATQ-AAEUAGOBSA-N 1 2 324.346 4.329 20 0 DIADLO Cc1ccc(CN(c2nc(C)[nH+]c3c2CCCC3)C2CC2)cc1C ZINC001185478269 1048185298 /nfs/dbraw/zinc/18/52/98/1048185298.db2.gz JOBFEAGKXPSGGS-UHFFFAOYSA-N 1 2 321.468 4.450 20 0 DIADLO Cc1cn2c(cccc2Nc2cccc(O[C@@H]3CCCCO3)c2)[nH+]1 ZINC001175183044 1048187285 /nfs/dbraw/zinc/18/72/85/1048187285.db2.gz LSOUDKSUMILHMK-LJQANCHMSA-N 1 2 323.396 4.292 20 0 DIADLO Cc1nc2[nH]ccc2c(NC2(CC3CC3)CCC(F)(F)CC2)[nH+]1 ZINC001161896065 1048190756 /nfs/dbraw/zinc/19/07/56/1048190756.db2.gz LVFAZDWSBYUMAS-UHFFFAOYSA-N 1 2 320.387 4.426 20 0 DIADLO CN(C)c1cc(Cl)[nH+]c(N[C@@H](c2ccccc2)C2CC2)c1 ZINC001161954692 1048198251 /nfs/dbraw/zinc/19/82/51/1048198251.db2.gz GRRBCDJGESGHAH-KRWDZBQOSA-N 1 2 301.821 4.364 20 0 DIADLO CC[C@@H](Cc1ccccc1)N(C)c1nc(C)[nH+]c2c1CCCC2 ZINC001185535020 1048198659 /nfs/dbraw/zinc/19/86/59/1048198659.db2.gz MEVRLPBPHUNYLC-KRWDZBQOSA-N 1 2 309.457 4.121 20 0 DIADLO CC[C@H](Cc1ccccc1)N(C)c1nc(C)[nH+]c2c1CCCC2 ZINC001185535021 1048198684 /nfs/dbraw/zinc/19/86/84/1048198684.db2.gz MEVRLPBPHUNYLC-QGZVFWFLSA-N 1 2 309.457 4.121 20 0 DIADLO FC(F)(F)Cc1ccccc1NCc1cccc2[nH+]ccn21 ZINC001201124612 1048205107 /nfs/dbraw/zinc/20/51/07/1048205107.db2.gz VHWNYEKSLDZIBR-UHFFFAOYSA-N 1 2 305.303 4.051 20 0 DIADLO Cc1cc(NCCc2cccc(Cl)c2F)nc(C2CC2)[nH+]1 ZINC001161985484 1048207759 /nfs/dbraw/zinc/20/77/59/1048207759.db2.gz FLLZGBPFBOXDTE-UHFFFAOYSA-N 1 2 305.784 4.110 20 0 DIADLO CC(=O)c1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)cc1F ZINC001175233013 1048209730 /nfs/dbraw/zinc/20/97/30/1048209730.db2.gz NOJZTAUZSSALEJ-UHFFFAOYSA-N 1 2 309.344 4.017 20 0 DIADLO Cc1cn2cc(NC(=S)Nc3cc(C)cc(C)c3)ccc2[nH+]1 ZINC001201199017 1048215937 /nfs/dbraw/zinc/21/59/37/1048215937.db2.gz PTDURLUOGUEMLT-UHFFFAOYSA-N 1 2 310.426 4.068 20 0 DIADLO Cc1cc(C)cc(NC(=S)Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001201205812 1048218619 /nfs/dbraw/zinc/21/86/19/1048218619.db2.gz FHJINENZEPEXSF-UHFFFAOYSA-N 1 2 322.437 4.298 20 0 DIADLO Cc1cc(NCCCc2cncc(C(F)(F)F)c2)c[nH+]c1C ZINC001162044343 1048219360 /nfs/dbraw/zinc/21/93/60/1048219360.db2.gz NXAWWVBHOSFBNK-UHFFFAOYSA-N 1 2 309.335 4.157 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccccc1N(C)C1CCCC1 ZINC001201227299 1048220078 /nfs/dbraw/zinc/22/00/78/1048220078.db2.gz WEYVTLSAASCSQC-UHFFFAOYSA-N 1 2 312.461 4.284 20 0 DIADLO COc1ccc(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)cc1F ZINC001162068219 1048221300 /nfs/dbraw/zinc/22/13/00/1048221300.db2.gz MRVCIPDYNZLZJB-UHFFFAOYSA-N 1 2 317.408 4.483 20 0 DIADLO Cc1cc(N2CCC[C@@H]2Cc2ccccc2)nc(C2CCC2)[nH+]1 ZINC001162068068 1048221691 /nfs/dbraw/zinc/22/16/91/1048221691.db2.gz HCIORIGCSSFUHA-GOSISDBHSA-N 1 2 307.441 4.264 20 0 DIADLO Cc1cccc(NC(=O)OC(C)(C)C)c1Nc1ccc(N)[nH+]c1 ZINC001201291698 1048227884 /nfs/dbraw/zinc/22/78/84/1048227884.db2.gz NQTXFORALMOYHR-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO Nc1ccc(Nc2cccc(Oc3cc(F)cc(F)c3)c2)c[nH+]1 ZINC001201291704 1048228015 /nfs/dbraw/zinc/22/80/15/1048228015.db2.gz NYZOEBGFFUTNJX-UHFFFAOYSA-N 1 2 313.307 4.478 20 0 DIADLO COc1ccnc(C(C)(C)CNc2[nH+]c(C)cc(Cl)c2C)c1 ZINC001162129710 1048229236 /nfs/dbraw/zinc/22/92/36/1048229236.db2.gz NXCBKMSRYMAPJY-UHFFFAOYSA-N 1 2 319.836 4.145 20 0 DIADLO Cc1ccc(NC(=O)OC(C)(C)C)c(Nc2ccc(N)[nH+]c2)c1 ZINC001201300000 1048232557 /nfs/dbraw/zinc/23/25/57/1048232557.db2.gz JSQUUPSMKKLLTC-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO Cc1ccc(SCCNc2nc(C)[nH+]c3c2CCCC3)cc1 ZINC001162145784 1048232736 /nfs/dbraw/zinc/23/27/36/1048232736.db2.gz BAQXOUKOCMDEIG-UHFFFAOYSA-N 1 2 313.470 4.176 20 0 DIADLO Cc1cc(Cl)c(C)c(NCC2(c3ncccc3F)CC2)[nH+]1 ZINC001162164112 1048234265 /nfs/dbraw/zinc/23/42/65/1048234265.db2.gz LOCYADAQAOEONQ-UHFFFAOYSA-N 1 2 305.784 4.030 20 0 DIADLO Cc1ccc[nH+]c1Nc1ccc(NC(=O)c2ccccc2)cc1 ZINC001201305110 1048234496 /nfs/dbraw/zinc/23/44/96/1048234496.db2.gz MHSXDMVTBWNPNL-UHFFFAOYSA-N 1 2 303.365 4.386 20 0 DIADLO COc1cccc2c(NCc3ccc4c(ccn4C)c3)cc[nH+]c12 ZINC001162173266 1048237109 /nfs/dbraw/zinc/23/71/09/1048237109.db2.gz RZKLRCHKQGNRCU-UHFFFAOYSA-N 1 2 317.392 4.347 20 0 DIADLO Cn1ccc2cc(CNc3cccc(-c4c[nH+]cn4C)c3)ccc21 ZINC001162172662 1048237333 /nfs/dbraw/zinc/23/73/33/1048237333.db2.gz KCVTWXXTPASLOH-UHFFFAOYSA-N 1 2 316.408 4.191 20 0 DIADLO c1[nH+]c2cc(NCCC3CCOCC3)ccc2n1-c1ccccc1 ZINC001162221339 1048243527 /nfs/dbraw/zinc/24/35/27/1048243527.db2.gz OIWRYQNJXTUYMY-UHFFFAOYSA-N 1 2 321.424 4.254 20 0 DIADLO Cc1cc(NCc2csc(C3CC3)n2)ccc1-n1cc[nH+]c1 ZINC001201355248 1048246837 /nfs/dbraw/zinc/24/68/37/1048246837.db2.gz BERPIPPFBUSPQX-UHFFFAOYSA-N 1 2 310.426 4.127 20 0 DIADLO Cc1cc(Cl)c(Nc2ccc(N3CCCC3)[nH+]c2)cc1O ZINC001175349306 1048249797 /nfs/dbraw/zinc/24/97/97/1048249797.db2.gz NNEKBSIPFMOOLG-UHFFFAOYSA-N 1 2 303.793 4.093 20 0 DIADLO CN(C)c1ccc(Nc2cccc(Cc3cccc(N)c3)c2)c[nH+]1 ZINC001175345437 1048252318 /nfs/dbraw/zinc/25/23/18/1048252318.db2.gz BZNHXLNYCRNWAK-UHFFFAOYSA-N 1 2 318.424 4.064 20 0 DIADLO COc1cc(F)c(Cl)cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175349349 1048252426 /nfs/dbraw/zinc/25/24/26/1048252426.db2.gz NZADGZPCMMXGJD-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO CN(C)c1ccc(Nc2cccc3c(Cl)ncc(F)c23)c[nH+]1 ZINC001175345467 1048252958 /nfs/dbraw/zinc/25/29/58/1048252958.db2.gz COBPZRPGBOZGRY-UHFFFAOYSA-N 1 2 316.767 4.232 20 0 DIADLO Cc1nc(NCc2cc3ccccn3n2)cc(C2CCCCC2)[nH+]1 ZINC001162287211 1048257067 /nfs/dbraw/zinc/25/70/67/1048257067.db2.gz WRBVGFPQEYIESR-UHFFFAOYSA-N 1 2 321.428 4.093 20 0 DIADLO CCCCCOc1cc(C)ccc1C[NH2+]Cc1nccn1CC ZINC001201425206 1048263510 /nfs/dbraw/zinc/26/35/10/1048263510.db2.gz OHJNRACJEAAAPI-UHFFFAOYSA-N 1 2 315.461 4.070 20 0 DIADLO COc1cccc(Nc2ccc(N3CCCC3)[nH+]c2)c1Cl ZINC001175351595 1048271353 /nfs/dbraw/zinc/27/13/53/1048271353.db2.gz JQKDTCJHQCGOCI-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO Cc1c(C)c(Nc2ccc(N3CCCC3)[nH+]c2)c(C)c(C)c1N ZINC001175349871 1048271424 /nfs/dbraw/zinc/27/14/24/1048271424.db2.gz SYXRUYGAAYAOAW-UHFFFAOYSA-N 1 2 310.445 4.241 20 0 DIADLO CCOCc1cccc(Nc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001162374999 1048271662 /nfs/dbraw/zinc/27/16/62/1048271662.db2.gz ABSOZXVZBJMYEI-UHFFFAOYSA-N 1 2 318.380 4.163 20 0 DIADLO c1cncc(-c2ccc(Nc3ccc(N4CCCC4)[nH+]c3)cc2)c1 ZINC001175349722 1048271789 /nfs/dbraw/zinc/27/17/89/1048271789.db2.gz DLDHDWYMSMOAPD-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Oc1cc2ccccc2cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175351566 1048271803 /nfs/dbraw/zinc/27/18/03/1048271803.db2.gz JHBWMLSZJVMDSB-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO CCOc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1Cl ZINC001175349628 1048271904 /nfs/dbraw/zinc/27/19/04/1048271904.db2.gz BIKHYEODFLLVTN-UHFFFAOYSA-N 1 2 317.820 4.478 20 0 DIADLO Nc1ccc(C(F)(F)F)cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175351242 1048272175 /nfs/dbraw/zinc/27/21/75/1048272175.db2.gz NWDAGDCWWUOOAK-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO Fc1cnc2c(cccc2Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175349791 1048272666 /nfs/dbraw/zinc/27/26/66/1048272666.db2.gz QJMYUDPDXSKRSH-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO COc1cc(Cl)ccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175351526 1048272763 /nfs/dbraw/zinc/27/27/63/1048272763.db2.gz HHNYZIIROYXFOI-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO Cc1nc(NCC(C)(C)c2ccccc2F)c2c([nH+]1)CCCC2 ZINC001162390787 1048272906 /nfs/dbraw/zinc/27/29/06/1048272906.db2.gz ZEVMVKKVISYGTK-UHFFFAOYSA-N 1 2 313.420 4.193 20 0 DIADLO Fc1cc(Cl)c(Nc2ccc(N3CCCC3)[nH+]c2)cc1F ZINC001175351473 1048272855 /nfs/dbraw/zinc/27/28/55/1048272855.db2.gz NAUDIPUNRJTMDV-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO Fc1cc(F)c2c(c1)[C@@H](Nc1cc3ccccc3c[nH+]1)CCO2 ZINC001162399597 1048274041 /nfs/dbraw/zinc/27/40/41/1048274041.db2.gz JAYGACYYNLTPJI-INIZCTEOSA-N 1 2 312.319 4.449 20 0 DIADLO Fc1cc(F)c(Cl)c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175352549 1048274578 /nfs/dbraw/zinc/27/45/78/1048274578.db2.gz VRVKCGTWJKHBQY-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO CCSc1cc[nH+]c(N[C@H]2CCOc3c(F)cc(F)cc32)c1 ZINC001162405044 1048274624 /nfs/dbraw/zinc/27/46/24/1048274624.db2.gz CMRWQHMPYXCVMY-AWEZNQCLSA-N 1 2 322.380 4.408 20 0 DIADLO C[C@@H]1C[C@@H]1c1csc(Cc2[nH+]ccn2Cc2ccccc2)n1 ZINC000899241175 1048277555 /nfs/dbraw/zinc/27/75/55/1048277555.db2.gz KGTKKICPZBSQDE-HIFRSBDPSA-N 1 2 309.438 4.102 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cc(-c3ccncc3)c[nH]c2=O)cc1 ZINC001201489479 1048279954 /nfs/dbraw/zinc/27/99/54/1048279954.db2.gz PTWHYKXOCNFKRC-UHFFFAOYSA-N 1 2 320.396 4.413 20 0 DIADLO COC(=O)c1ccnc(Cl)c1Nc1ccc([NH2+]C(C)C)cc1 ZINC001201488776 1048280593 /nfs/dbraw/zinc/28/05/93/1048280593.db2.gz HZBLGBCSVFDRCQ-UHFFFAOYSA-N 1 2 319.792 4.086 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2ccc3nc(C4CC4)nn3c2)cc1 ZINC001201498415 1048287871 /nfs/dbraw/zinc/28/78/71/1048287871.db2.gz XVSLNLRYSXVJLC-UHFFFAOYSA-N 1 2 307.401 4.171 20 0 DIADLO CCC1(c2ccc(Cl)cc2)CCN(c2cc[nH+]c(C)n2)CC1 ZINC001186367865 1048288384 /nfs/dbraw/zinc/28/83/84/1048288384.db2.gz KBQCJBMLESMTOX-UHFFFAOYSA-N 1 2 315.848 4.387 20 0 DIADLO F[C@@H]1CCCC[C@H]1Nc1[nH]c2ccc(Br)cc2[nH+]1 ZINC001162508909 1048289241 /nfs/dbraw/zinc/28/92/41/1048289241.db2.gz ZHMDVFDFJMVQSI-NXEZZACHSA-N 1 2 312.186 4.018 20 0 DIADLO F[C@@H]1CCCC[C@H]1Nc1[nH]c2cc(Br)ccc2[nH+]1 ZINC001162508909 1048289257 /nfs/dbraw/zinc/28/92/57/1048289257.db2.gz ZHMDVFDFJMVQSI-NXEZZACHSA-N 1 2 312.186 4.018 20 0 DIADLO F[C@@H]1CCCC[C@H]1Nc1ccc(C2(C(F)(F)F)CC2)c[nH+]1 ZINC001162508772 1048289786 /nfs/dbraw/zinc/28/97/86/1048289786.db2.gz RZOHOBBPJAFEPA-VXGBXAGGSA-N 1 2 302.315 4.368 20 0 DIADLO CC(C)c1cc(N2CCCCC[C@@H]2C[C@@H](C)O)nc(C(C)C)[nH+]1 ZINC001186406845 1048297195 /nfs/dbraw/zinc/29/71/95/1048297195.db2.gz WLXRGUMZMKOFLA-HZPDHXFCSA-N 1 2 319.493 4.243 20 0 DIADLO Cc1cc(Oc2ccc(Nc3cnc4n[nH]cc4c3)cc2)cc[nH+]1 ZINC001175406350 1048298557 /nfs/dbraw/zinc/29/85/57/1048298557.db2.gz TYZHCFKKPRCYOA-UHFFFAOYSA-N 1 2 317.352 4.197 20 0 DIADLO Cn1ncc2c1cccc2CNc1[nH+]ccc2cc(Cl)ccc21 ZINC001162587180 1048307175 /nfs/dbraw/zinc/30/71/75/1048307175.db2.gz UAORLBUZCMGIEQ-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO Cc1cc(C)cc(Cc2noc([C@@H](CC(C)C)n3cc[nH+]c3)n2)c1 ZINC000923813127 1048316708 /nfs/dbraw/zinc/31/67/08/1048316708.db2.gz YVZBGLMBEZFFEJ-QGZVFWFLSA-N 1 2 324.428 4.109 20 0 DIADLO Cc1ccc(NCc2cccc(OCC(F)(F)F)c2)c(C)[nH+]1 ZINC001201573038 1048321312 /nfs/dbraw/zinc/32/13/12/1048321312.db2.gz LQFXNSIGMXAMIL-UHFFFAOYSA-N 1 2 310.319 4.252 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1CC=C(c2cccc(C)c2)CC1 ZINC001205360206 1048324835 /nfs/dbraw/zinc/32/48/35/1048324835.db2.gz OIBYZHUNPXRVDM-UHFFFAOYSA-N 1 2 315.848 4.154 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1CC=C(c2cccc(C)c2)CC1 ZINC001205360206 1048324846 /nfs/dbraw/zinc/32/48/46/1048324846.db2.gz OIBYZHUNPXRVDM-UHFFFAOYSA-N 1 2 315.848 4.154 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1ncc(C(F)(F)F)cc1Br ZINC001162661293 1048330547 /nfs/dbraw/zinc/33/05/47/1048330547.db2.gz SZNRDTLYWZDVGV-UHFFFAOYSA-N 1 2 324.144 4.298 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1ncccc1OCc1ccccc1F ZINC001162661743 1048331801 /nfs/dbraw/zinc/33/18/01/1048331801.db2.gz IWGYCUWDLKSPOQ-UHFFFAOYSA-N 1 2 301.365 4.235 20 0 DIADLO CSc1ccccc1NC(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001186708512 1048332138 /nfs/dbraw/zinc/33/21/38/1048332138.db2.gz NWBGVESXPNZZGE-UHFFFAOYSA-N 1 2 324.409 4.238 20 0 DIADLO Cc1cc(C)c(CNc2cc(-c3cccc(Cl)c3)ncn2)c[nH+]1 ZINC001186696672 1048332936 /nfs/dbraw/zinc/33/29/36/1048332936.db2.gz WFWCWSVZLLZYCP-UHFFFAOYSA-N 1 2 324.815 4.421 20 0 DIADLO Cc1ccc2sc(NCCc3cn4cccc(C)c4[nH+]3)nc2c1 ZINC001162668750 1048332682 /nfs/dbraw/zinc/33/26/82/1048332682.db2.gz BDYSYUBZBLCTLJ-UHFFFAOYSA-N 1 2 322.437 4.215 20 0 DIADLO Cc1nc(N2CC[C@](C)(CCc3ccccc3)C2)c(C)c(C)[nH+]1 ZINC001162691768 1048335279 /nfs/dbraw/zinc/33/52/79/1048335279.db2.gz BLDRUNXJFJSBRM-FQEVSTJZSA-N 1 2 309.457 4.251 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NC[C@H](O)c1cc2ccccc2o1 ZINC001162696007 1048337796 /nfs/dbraw/zinc/33/77/96/1048337796.db2.gz SLATUNAJUHUBGE-KRWDZBQOSA-N 1 2 318.376 4.435 20 0 DIADLO CCCCO[C@H]1C[C@@H](N(C)c2cc(C)[nH+]c(C3CC3)n2)C1(C)C ZINC001162711269 1048341440 /nfs/dbraw/zinc/34/14/40/1048341440.db2.gz GKWIXWPQAGAFQP-CVEARBPZSA-N 1 2 317.477 4.082 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1ccc(F)cc1C ZINC000555462250 1048354709 /nfs/dbraw/zinc/35/47/09/1048354709.db2.gz KTFLQBGRIZVVHS-KRWDZBQOSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1ccc(F)cc1C ZINC000555462250 1048354721 /nfs/dbraw/zinc/35/47/21/1048354721.db2.gz KTFLQBGRIZVVHS-KRWDZBQOSA-N 1 2 301.409 4.078 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(SCc3cc(C)ccc3OC)c12 ZINC001162805778 1048361701 /nfs/dbraw/zinc/36/17/01/1048361701.db2.gz HCSKHRHQISRXPH-UHFFFAOYSA-N 1 2 313.426 4.130 20 0 DIADLO Cc1cc(NCC(F)(F)c2cccc(F)c2)nc(C2CC2)[nH+]1 ZINC001186966068 1048362329 /nfs/dbraw/zinc/36/23/29/1048362329.db2.gz USGNJXPNSAQKNB-UHFFFAOYSA-N 1 2 307.319 4.005 20 0 DIADLO Cc1cc(N(CCc2ccc(F)cc2)C2CC2)nc(C2CC2)[nH+]1 ZINC001162813380 1048363604 /nfs/dbraw/zinc/36/36/04/1048363604.db2.gz YCLHZSMYBQRFIH-UHFFFAOYSA-N 1 2 311.404 4.013 20 0 DIADLO CC[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccccc1OC ZINC000775076143 1048367014 /nfs/dbraw/zinc/36/70/14/1048367014.db2.gz SOYVCGJPBZSYHG-AWEZNQCLSA-N 1 2 302.418 4.222 20 0 DIADLO COc1cccc2[nH+]c(NCc3cn(C)c4ccccc34)ccc21 ZINC001162827674 1048368038 /nfs/dbraw/zinc/36/80/38/1048368038.db2.gz PCEMAJBIVLRBEI-UHFFFAOYSA-N 1 2 317.392 4.347 20 0 DIADLO Cn1cc(CNc2cc(-c3ccncc3)cc[nH+]2)c2ccccc21 ZINC001162827207 1048368968 /nfs/dbraw/zinc/36/89/68/1048368968.db2.gz FOVOBGVIKFDVJX-UHFFFAOYSA-N 1 2 314.392 4.247 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccnc(Cl)c2Br)c1 ZINC001203654066 1048369360 /nfs/dbraw/zinc/36/93/60/1048369360.db2.gz BYEHVPWOTWHOTJ-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO CCc1cc(N[C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@@H]23)nc(CC)[nH+]1 ZINC001187107676 1048370598 /nfs/dbraw/zinc/37/05/98/1048370598.db2.gz DSEWTPLHKOBHJJ-BMGDILEWSA-N 1 2 313.832 4.005 20 0 DIADLO CCOc1ncc(Nc2ccc(Oc3cc[nH+]c(C)c3)cc2)cn1 ZINC001175559320 1048371273 /nfs/dbraw/zinc/37/12/73/1048371273.db2.gz YMJNMAGIYRRLNW-UHFFFAOYSA-N 1 2 322.368 4.115 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1cccc(Cl)c1N ZINC001201803160 1048374703 /nfs/dbraw/zinc/37/47/03/1048374703.db2.gz KPQMGJNITZXIKZ-UHFFFAOYSA-N 1 2 305.809 4.107 20 0 DIADLO CC(C)Cc1ccc(CNc2c[nH+]ccc2OC(C)(C)C)cn1 ZINC001201803413 1048375545 /nfs/dbraw/zinc/37/55/45/1048375545.db2.gz RMUPMTWTGSVKIN-UHFFFAOYSA-N 1 2 313.445 4.465 20 0 DIADLO Cc1nn(C)c(C)c1CNc1cc(-c2ccc(C)cc2)cc[nH+]1 ZINC001162878498 1048375546 /nfs/dbraw/zinc/37/55/46/1048375546.db2.gz MFBMTCPKKQMYCV-UHFFFAOYSA-N 1 2 306.413 4.019 20 0 DIADLO CCCCCC(CCCCC)Nc1[nH+]cnc2c1cnn2C ZINC001162922868 1048388625 /nfs/dbraw/zinc/38/86/25/1048388625.db2.gz ZRZXHKOQPJWWGB-UHFFFAOYSA-N 1 2 303.454 4.304 20 0 DIADLO CCC(CC)[C@H]1C[C@@H](Nc2nc(C)[nH+]c3c2CCCC3)CCO1 ZINC001162944022 1048393446 /nfs/dbraw/zinc/39/34/46/1048393446.db2.gz WOLIRRGMJXKDPS-MAUKXSAKSA-N 1 2 317.477 4.060 20 0 DIADLO CC(C)c1cc(NC2CCC3(COC3)CC2)nc(C(C)C)[nH+]1 ZINC001187421961 1048395387 /nfs/dbraw/zinc/39/53/87/1048395387.db2.gz CURHRIVPOSJESG-UHFFFAOYSA-N 1 2 303.450 4.095 20 0 DIADLO Cc1n[nH]c2ccc(Nc3ccc[nH+]c3N3CCCCC3)cc12 ZINC001175695427 1048400385 /nfs/dbraw/zinc/40/03/85/1048400385.db2.gz HVIBJTKEPPABFT-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO Cc1[nH]nc2ccc(Nc3ccc[nH+]c3N3CCCCC3)cc21 ZINC001175695427 1048400396 /nfs/dbraw/zinc/40/03/96/1048400396.db2.gz HVIBJTKEPPABFT-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO CCC1(CC)CN(c2cc(C)[nH+]c(C3CCC3)n2)CCS1 ZINC001163000567 1048401671 /nfs/dbraw/zinc/40/16/71/1048401671.db2.gz MFPRQVFNXRLBAS-UHFFFAOYSA-N 1 2 305.491 4.165 20 0 DIADLO Cc1nc(N2CCC[C@@]2(C)Cc2ccccc2)c2c([nH+]1)CCCC2 ZINC001162994481 1048402456 /nfs/dbraw/zinc/40/24/56/1048402456.db2.gz HBYISGHTTPYJOT-NRFANRHFSA-N 1 2 321.468 4.265 20 0 DIADLO CSCc1ccc(NCCOc2cccc3ccoc32)[nH+]c1 ZINC001163077842 1048413399 /nfs/dbraw/zinc/41/33/99/1048413399.db2.gz MEXBSAYAGGJSHH-UHFFFAOYSA-N 1 2 314.410 4.182 20 0 DIADLO CC(C)c1cc2c(ncnc2NCc2ccc3[nH+]ccn3c2)s1 ZINC001163135855 1048418685 /nfs/dbraw/zinc/41/86/85/1048418685.db2.gz OCSCTAGBPJTACA-UHFFFAOYSA-N 1 2 323.425 4.075 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc(C(F)F)c2)c[nH+]1 ZINC001175712178 1048419140 /nfs/dbraw/zinc/41/91/40/1048419140.db2.gz IYLRCPSJVRGMCG-UHFFFAOYSA-N 1 2 303.234 4.364 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(F)cc2Cl)c[nH+]1 ZINC001175713087 1048419166 /nfs/dbraw/zinc/41/91/66/1048419166.db2.gz PGCQQYJKJWXQCD-UHFFFAOYSA-N 1 2 305.662 4.219 20 0 DIADLO CCc1cc(N[C@H](C)c2ccc(SC)cc2)nc(CC)[nH+]1 ZINC001163133175 1048419344 /nfs/dbraw/zinc/41/93/44/1048419344.db2.gz PSQVUMZIXJQYKU-GFCCVEGCSA-N 1 2 301.459 4.496 20 0 DIADLO Clc1cc(NCc2ccc3[nH+]ccn3c2)c2sccc2n1 ZINC001163136794 1048421027 /nfs/dbraw/zinc/42/10/27/1048421027.db2.gz PJIWHQRRPUWWGN-UHFFFAOYSA-N 1 2 314.801 4.210 20 0 DIADLO Cc1cccc(Nc2c[nH+]c(N)cc2C(F)(F)F)c1Cl ZINC001175713401 1048421258 /nfs/dbraw/zinc/42/12/58/1048421258.db2.gz GLOBARVZMPGUMV-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc3sncc3c2)c[nH+]1 ZINC001175714883 1048421378 /nfs/dbraw/zinc/42/13/78/1048421378.db2.gz XYSBZBSFKIIGCI-UHFFFAOYSA-N 1 2 310.304 4.036 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc3c(c2)CCCC3)c[nH+]1 ZINC001175716789 1048422888 /nfs/dbraw/zinc/42/28/88/1048422888.db2.gz YTZKJPGPSBBWLW-UHFFFAOYSA-N 1 2 307.319 4.305 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(C(=O)C3CC3)cc2)c[nH+]1 ZINC001175717403 1048423226 /nfs/dbraw/zinc/42/32/26/1048423226.db2.gz TXBMUNVYHZQNIW-UHFFFAOYSA-N 1 2 321.302 4.019 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc(OC(F)F)c2)c[nH+]1 ZINC001175717566 1048423669 /nfs/dbraw/zinc/42/36/69/1048423669.db2.gz KCVNPTDHQUODPV-UHFFFAOYSA-N 1 2 319.233 4.028 20 0 DIADLO CCc1cc(N2CCC[C@@H]2[C@@H](C)c2ccccc2)nc(CC)[nH+]1 ZINC001187686085 1048425617 /nfs/dbraw/zinc/42/56/17/1048425617.db2.gz JACYIHIUHSURLF-MAUKXSAKSA-N 1 2 309.457 4.374 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cnc3c(F)cccc3c2)c[nH+]1 ZINC001175710505 1048438022 /nfs/dbraw/zinc/43/80/22/1048438022.db2.gz FIQZRNSXJAZQNF-UHFFFAOYSA-N 1 2 322.265 4.114 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cnccc2C2CCC2)c[nH+]1 ZINC001175710726 1048438311 /nfs/dbraw/zinc/43/83/11/1048438311.db2.gz KWSCXFOVPIERCT-UHFFFAOYSA-N 1 2 308.307 4.089 20 0 DIADLO Cc1cc(NCC[C@@H]2CCC(C)(C)CO2)nc(C2CCC2)[nH+]1 ZINC001187756850 1048440540 /nfs/dbraw/zinc/44/05/40/1048440540.db2.gz ALNZPUDXLPGMRE-HNNXBMFYSA-N 1 2 303.450 4.060 20 0 DIADLO Cc1nc(N2CCC[C@@H]2/C=C/c2ccccc2)c2c([nH+]1)CCCC2 ZINC001187765748 1048441169 /nfs/dbraw/zinc/44/11/69/1048441169.db2.gz PUZZMQLUFIARCF-KAUXGEHWSA-N 1 2 319.452 4.346 20 0 DIADLO Cc1cc(C)cc(CN(C)c2nc3ccccc3n3c[nH+]cc23)c1 ZINC001163232194 1048441515 /nfs/dbraw/zinc/44/15/15/1048441515.db2.gz QEJISLCMUUGFMB-UHFFFAOYSA-N 1 2 316.408 4.136 20 0 DIADLO c1nn2ccccc2c1CNc1cc(-c2ccccc2)cc[nH+]1 ZINC001163277179 1048447029 /nfs/dbraw/zinc/44/70/29/1048447029.db2.gz KSJHOLAQWDSLFS-UHFFFAOYSA-N 1 2 300.365 4.008 20 0 DIADLO CCc1cc(NCCc2c[nH]c3ccc(C)cc23)nc(CC)[nH+]1 ZINC001187880989 1048449571 /nfs/dbraw/zinc/44/95/71/1048449571.db2.gz SACZGFNCZSSYOJ-UHFFFAOYSA-N 1 2 308.429 4.046 20 0 DIADLO C[C@@H]1c2sccc2CC[N@H+]1Cc1cc(C(F)(F)F)co1 ZINC001175828553 1048456857 /nfs/dbraw/zinc/45/68/57/1048456857.db2.gz BSRCMGFUACPTSG-SECBINFHSA-N 1 2 301.333 4.479 20 0 DIADLO C[C@@H]1c2sccc2CC[N@@H+]1Cc1cc(C(F)(F)F)co1 ZINC001175828553 1048456865 /nfs/dbraw/zinc/45/68/65/1048456865.db2.gz BSRCMGFUACPTSG-SECBINFHSA-N 1 2 301.333 4.479 20 0 DIADLO COc1c(F)cccc1[C@H](C)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC001163338476 1048457361 /nfs/dbraw/zinc/45/73/61/1048457361.db2.gz TVLKNQVWXIQUBN-LBPRGKRZSA-N 1 2 303.381 4.229 20 0 DIADLO c1ccc(-c2ccc(Nc3ccc[nH+]c3N3CCCC3)cn2)cc1 ZINC001175832644 1048458382 /nfs/dbraw/zinc/45/83/82/1048458382.db2.gz JQZOXWDDICROGJ-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Clc1ccc(C[NH2+]Cc2csc(-c3ccccc3)n2)nc1 ZINC000776254784 1048467653 /nfs/dbraw/zinc/46/76/53/1048467653.db2.gz MUZGXJGZDHVSCU-UHFFFAOYSA-N 1 2 315.829 4.148 20 0 DIADLO c1cn2ccc(Nc3cccnc3OCc3ccccc3)cc2[nH+]1 ZINC001175877035 1048467784 /nfs/dbraw/zinc/46/77/84/1048467784.db2.gz UTVBBKYRABAOMR-UHFFFAOYSA-N 1 2 316.364 4.052 20 0 DIADLO c1cn(-c2ccccc2Nc2cnn(C3CCCCC3)c2)c[nH+]1 ZINC001175877362 1048468211 /nfs/dbraw/zinc/46/82/11/1048468211.db2.gz BJKZKGZQQUEASA-UHFFFAOYSA-N 1 2 307.401 4.318 20 0 DIADLO c1cn(Cc2cccc(Nc3cnn(C4CCCCC4)c3)c2)c[nH+]1 ZINC001175884707 1048472613 /nfs/dbraw/zinc/47/26/13/1048472613.db2.gz PRMNKOBUHDKLPF-UHFFFAOYSA-N 1 2 321.428 4.377 20 0 DIADLO c1csc(-c2cnc(C[N@@H+]3Cc4ccccc4C4(CC4)C3)o2)c1 ZINC000481735843 1048473799 /nfs/dbraw/zinc/47/37/99/1048473799.db2.gz YQEAIMVKMICGJW-UHFFFAOYSA-N 1 2 322.433 4.451 20 0 DIADLO c1csc(-c2cnc(C[N@H+]3Cc4ccccc4C4(CC4)C3)o2)c1 ZINC000481735843 1048473804 /nfs/dbraw/zinc/47/38/04/1048473804.db2.gz YQEAIMVKMICGJW-UHFFFAOYSA-N 1 2 322.433 4.451 20 0 DIADLO CCOC(CCCNc1[nH+]cccc1-c1ccccc1)OCC ZINC001163484135 1048475470 /nfs/dbraw/zinc/47/54/70/1048475470.db2.gz URZONUAOZDHISR-UHFFFAOYSA-N 1 2 314.429 4.340 20 0 DIADLO Cc1ccc(Nc2c(F)cccc2C(=O)C(F)(F)F)c(C)[nH+]1 ZINC001203381265 1048484655 /nfs/dbraw/zinc/48/46/55/1048484655.db2.gz SKOAABSCYVGPSA-UHFFFAOYSA-N 1 2 312.266 4.326 20 0 DIADLO Cc1nc(NCc2ccc(COc3ccc(F)cc3)cc2)cc[nH+]1 ZINC001163591384 1048492961 /nfs/dbraw/zinc/49/29/61/1048492961.db2.gz VXYNPDZVGHZDQH-UHFFFAOYSA-N 1 2 323.371 4.115 20 0 DIADLO COc1cccc(Nc2cccc(Cn3cc[nH+]c3)c2)c1Cl ZINC001175899310 1048493667 /nfs/dbraw/zinc/49/36/67/1048493667.db2.gz PNMRMPBJQSFQDZ-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO Cc1nc(N[C@H](C)C2CCC(F)(F)CC2)c2c([nH+]1)CCCC2 ZINC001163618750 1048494352 /nfs/dbraw/zinc/49/43/52/1048494352.db2.gz WSLUHXZUHFSLHI-LLVKDONJSA-N 1 2 309.404 4.290 20 0 DIADLO CCc1cc(N2CC3(CC=CC3)[C@@H]2c2ccccc2)nc(CC)[nH+]1 ZINC001163657422 1048499726 /nfs/dbraw/zinc/49/97/26/1048499726.db2.gz YTCKLVGLPHTSAG-FQEVSTJZSA-N 1 2 319.452 4.499 20 0 DIADLO CCC(C)(C)C1CCC(NC(=O)Nc2cc(C)[nH+]cc2C)CC1 ZINC001202244071 1048502980 /nfs/dbraw/zinc/50/29/80/1048502980.db2.gz DWBONBCZNXVARZ-UHFFFAOYSA-N 1 2 317.477 4.237 20 0 DIADLO COc1cc(Nc2cc(C)c(N)c(C)c2)[nH+]cc1C(F)(F)F ZINC001175932505 1048505024 /nfs/dbraw/zinc/50/50/24/1048505024.db2.gz WGXXLDPDOAURQN-UHFFFAOYSA-N 1 2 311.307 4.052 20 0 DIADLO CCOc1cccc(CCNc2cccc(-c3c[nH+]cn3C)c2)c1 ZINC001163713802 1048508783 /nfs/dbraw/zinc/50/87/83/1048508783.db2.gz IGEIACZMBJUNIO-UHFFFAOYSA-N 1 2 321.424 4.140 20 0 DIADLO Cc1cccc2c(C)cc(N3CC[C@@H](F)C(F)(F)CC3)[nH+]c12 ZINC001163773913 1048523046 /nfs/dbraw/zinc/52/30/46/1048523046.db2.gz YURDQAODTSNWPM-CQSZACIVSA-N 1 2 308.347 4.425 20 0 DIADLO COc1ccc2[nH+]c(N3CC[C@H](F)C(F)(F)CC3)cc(C)c2c1 ZINC001163780493 1048525113 /nfs/dbraw/zinc/52/51/13/1048525113.db2.gz QKJVWILQSTZDOP-HNNXBMFYSA-N 1 2 324.346 4.125 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2ccc(F)c3cccnc23)[nH]c1C ZINC001176078682 1048548119 /nfs/dbraw/zinc/54/81/19/1048548119.db2.gz TUEMPMBUVJEDQJ-QGZVFWFLSA-N 1 2 324.403 4.051 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2ccc(F)c3cccnc23)[nH]c1C ZINC001176078682 1048548130 /nfs/dbraw/zinc/54/81/30/1048548130.db2.gz TUEMPMBUVJEDQJ-QGZVFWFLSA-N 1 2 324.403 4.051 20 0 DIADLO Cn1c(CNc2cc3cc(F)ccc3c[nH+]2)cc2ccccc21 ZINC001163932050 1048551661 /nfs/dbraw/zinc/55/16/61/1048551661.db2.gz NBQLQQUKCCFYEQ-UHFFFAOYSA-N 1 2 305.356 4.478 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(C)c(F)cc1Br ZINC001176123452 1048575130 /nfs/dbraw/zinc/57/51/30/1048575130.db2.gz UQJCXRSAAMHTTD-UHFFFAOYSA-N 1 2 311.154 4.044 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)Nc1cccc2ccccc21 ZINC001188910464 1048569202 /nfs/dbraw/zinc/56/92/02/1048569202.db2.gz SIRJCXCLBZOLAE-UHFFFAOYSA-N 1 2 302.337 4.132 20 0 DIADLO O=C(NCc1c[nH+]cn1C1CCC1)Nc1cccc2ccccc21 ZINC001188960589 1048573594 /nfs/dbraw/zinc/57/35/94/1048573594.db2.gz FOZUQOFTLZWHQT-UHFFFAOYSA-N 1 2 320.396 4.083 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(OC(F)(F)F)c(F)cc1F ZINC001176123958 1048575419 /nfs/dbraw/zinc/57/54/19/1048575419.db2.gz ZWKLOFLMXDZAMO-UHFFFAOYSA-N 1 2 320.217 4.011 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(C(F)(F)F)ccc1C(C)=O ZINC001176123544 1048575473 /nfs/dbraw/zinc/57/54/73/1048575473.db2.gz BODYVERTHWVYMO-UHFFFAOYSA-N 1 2 310.275 4.055 20 0 DIADLO COc1cc[nH+]cc1Nc1cccc(Cc2cccc(N)c2)c1 ZINC001176125342 1048576931 /nfs/dbraw/zinc/57/69/31/1048576931.db2.gz ZQQBRAUVXSCLIL-UHFFFAOYSA-N 1 2 305.381 4.007 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(F)c(C)cc1Br ZINC001176122621 1048577470 /nfs/dbraw/zinc/57/74/70/1048577470.db2.gz DPGXBGSIGVNFER-UHFFFAOYSA-N 1 2 311.154 4.044 20 0 DIADLO FC[C@H]1CCN(c2cc(-c3ccccc3)cc[nH+]2)CC1(F)F ZINC001164092889 1048580314 /nfs/dbraw/zinc/58/03/14/1048580314.db2.gz WWBGKXADTFBHKF-OAHLLOKOSA-N 1 2 306.331 4.180 20 0 DIADLO CCN(C)c1ccc(Nc2c(F)ccc(OC)c2Cl)c[nH+]1 ZINC001250307363 1048582731 /nfs/dbraw/zinc/58/27/31/1048582731.db2.gz PUGMGGOIHZXJIS-UHFFFAOYSA-N 1 2 309.772 4.082 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)CCC(F)(F)F ZINC000338919660 1048583808 /nfs/dbraw/zinc/58/38/08/1048583808.db2.gz HSQPLCIFKSJONZ-UHFFFAOYSA-N 1 2 304.337 4.096 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)CCC(F)(F)F ZINC000338919660 1048583820 /nfs/dbraw/zinc/58/38/20/1048583820.db2.gz HSQPLCIFKSJONZ-UHFFFAOYSA-N 1 2 304.337 4.096 20 0 DIADLO C[C@H](Nc1[nH+]cnc2[nH]cc(F)c21)c1ccc2ccccc2c1 ZINC001164138730 1048590251 /nfs/dbraw/zinc/59/02/51/1048590251.db2.gz GDQZEJCEJOHYRB-NSHDSACASA-N 1 2 306.344 4.423 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(OC(C)C)cc1Cl ZINC001176158244 1048597968 /nfs/dbraw/zinc/59/79/68/1048597968.db2.gz IXWQIFYOOHDEFS-UHFFFAOYSA-N 1 2 315.804 4.357 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)Nc1cccc(Cl)c1Cl ZINC001189194271 1048599797 /nfs/dbraw/zinc/59/97/97/1048599797.db2.gz FWALZUIGSSZWFR-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(C(F)(F)F)cc1C ZINC001176206009 1048604634 /nfs/dbraw/zinc/60/46/34/1048604634.db2.gz PGTYJTWRYVWRGN-UHFFFAOYSA-N 1 2 305.303 4.243 20 0 DIADLO c1ccn(-c2ccc[nH+]c2NCc2cnc3ccccc3c2)c1 ZINC001164196930 1048604913 /nfs/dbraw/zinc/60/49/13/1048604913.db2.gz HAPUGERPLDBLRU-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO C/C(=C(\F)C(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1)C1CC1 ZINC001176221052 1048607541 /nfs/dbraw/zinc/60/75/41/1048607541.db2.gz ZQKYAHKCOPUMJV-MHWRWJLKSA-N 1 2 313.376 4.286 20 0 DIADLO CC(=C(F)C(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1)C1CC1 ZINC001176221052 1048607547 /nfs/dbraw/zinc/60/75/47/1048607547.db2.gz ZQKYAHKCOPUMJV-MHWRWJLKSA-N 1 2 313.376 4.286 20 0 DIADLO COc1cccc2[nH+]c(NCCSCc3ccco3)ccc21 ZINC001164220501 1048608121 /nfs/dbraw/zinc/60/81/21/1048608121.db2.gz QJNOMPKVBRNIEY-UHFFFAOYSA-N 1 2 314.410 4.182 20 0 DIADLO Cc1cc(NCCSCc2ccco2)[nH+]cc1C(F)(F)F ZINC001164215345 1048608136 /nfs/dbraw/zinc/60/81/36/1048608136.db2.gz COVMIEQHXXJDIP-UHFFFAOYSA-N 1 2 316.348 4.347 20 0 DIADLO CCc1cc(N2CCC[C@@H]2/C=C/c2ccccc2)nc(CC)[nH+]1 ZINC001164261737 1048614667 /nfs/dbraw/zinc/61/46/67/1048614667.db2.gz YXZWPHMFPPLRKZ-QFQMRYFISA-N 1 2 307.441 4.284 20 0 DIADLO Cc1cc(N2CCC[C@@H]2/C=C\c2ccccc2)nc(C2CC2)[nH+]1 ZINC001164260969 1048614740 /nfs/dbraw/zinc/61/47/40/1048614740.db2.gz JYTYHZHXYCSFDA-ZVBPTUHVSA-N 1 2 305.425 4.345 20 0 DIADLO FC[C@]1(C(F)(F)F)CCN(c2cc(-c3ccccc3)cc[nH+]2)C1 ZINC001164263956 1048615850 /nfs/dbraw/zinc/61/58/50/1048615850.db2.gz BUGZYVGQGUABHL-MRXNPFEDSA-N 1 2 324.321 4.477 20 0 DIADLO c1nc(-c2ccccc2)[nH]c1C[N@@H+]1Cc2ccccc2C2(CC2)C1 ZINC000482494738 1048618001 /nfs/dbraw/zinc/61/80/01/1048618001.db2.gz FLDRAXPNTJKUJD-UHFFFAOYSA-N 1 2 315.420 4.124 20 0 DIADLO c1nc(-c2ccccc2)[nH]c1C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000482494738 1048618004 /nfs/dbraw/zinc/61/80/04/1048618004.db2.gz FLDRAXPNTJKUJD-UHFFFAOYSA-N 1 2 315.420 4.124 20 0 DIADLO C[NH+](C)c1ccc(NCc2cc(F)ccc2OC(F)F)cc1 ZINC000850199556 1048622587 /nfs/dbraw/zinc/62/25/87/1048622587.db2.gz WJAKWTQYNOXINR-UHFFFAOYSA-N 1 2 310.319 4.105 20 0 DIADLO Cc1nc(N2CC[C@](C)(F)[C@@H](F)C2)cc(C2CCCCC2)[nH+]1 ZINC001164338484 1048623060 /nfs/dbraw/zinc/62/30/60/1048623060.db2.gz PLIRKCJASVUJQL-RDJZCZTQSA-N 1 2 309.404 4.109 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+]Cc1ccc(F)c(F)c1F)CCC2 ZINC000850241423 1048626038 /nfs/dbraw/zinc/62/60/38/1048626038.db2.gz FTUXZBBTXAKVOI-CQSZACIVSA-N 1 2 323.362 4.049 20 0 DIADLO CCCC1CCC(C[NH2+][C@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000482542136 1048627597 /nfs/dbraw/zinc/62/75/97/1048627597.db2.gz XSBYJXXQSXYPHK-HTWSVDAQSA-N 1 2 312.461 4.090 20 0 DIADLO Fc1cc(F)c(Nc2ccccc2-n2cc[nH+]c2)c(F)c1F ZINC001176348724 1048628061 /nfs/dbraw/zinc/62/80/61/1048628061.db2.gz DGIGXZIUHJASAU-UHFFFAOYSA-N 1 2 307.250 4.172 20 0 DIADLO COc1cc(Cl)cc(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001176342225 1048634909 /nfs/dbraw/zinc/63/49/09/1048634909.db2.gz KFDNZJGPWZAYAX-UHFFFAOYSA-N 1 2 308.168 4.393 20 0 DIADLO Fc1ccc(SCCSc2[nH+]cc3ccccn32)c(F)c1 ZINC001164551479 1048640096 /nfs/dbraw/zinc/64/00/96/1048640096.db2.gz KTEVKRIRIVMOSZ-UHFFFAOYSA-N 1 2 322.405 4.497 20 0 DIADLO COc1c(Cl)cc(Nc2ccc(N(C)C)[nH+]c2)cc1Cl ZINC001176307350 1048644121 /nfs/dbraw/zinc/64/41/21/1048644121.db2.gz JPTWGVIJCMUCBG-UHFFFAOYSA-N 1 2 312.200 4.207 20 0 DIADLO Cc1ccc(C)c(Nc2cccc3c2cnn3[C@@H]2CCCCO2)[nH+]1 ZINC001176319800 1048649625 /nfs/dbraw/zinc/64/96/25/1048649625.db2.gz SQDWVKTWEHDJRZ-SFHVURJKSA-N 1 2 322.412 4.491 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1cc2c(cccc2C)[nH]1 ZINC000668098834 1048656379 /nfs/dbraw/zinc/65/63/79/1048656379.db2.gz SJKMKWUFTZFLCI-LJQANCHMSA-N 1 2 322.456 4.420 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1cc2c(cccc2C)[nH]1 ZINC000668098834 1048656382 /nfs/dbraw/zinc/65/63/82/1048656382.db2.gz SJKMKWUFTZFLCI-LJQANCHMSA-N 1 2 322.456 4.420 20 0 DIADLO COC(=O)CC(C)(C)C[C@@H](C)Nc1ccc([NH+]2CCCC2)cc1 ZINC000850450650 1048662282 /nfs/dbraw/zinc/66/22/82/1048662282.db2.gz RTAOAZLBPDCOTA-OAHLLOKOSA-N 1 2 318.461 4.067 20 0 DIADLO COC(=O)CC(C)(C)C[C@@H](C)[NH2+]c1ccc(N2CCCC2)cc1 ZINC000850450650 1048662286 /nfs/dbraw/zinc/66/22/86/1048662286.db2.gz RTAOAZLBPDCOTA-OAHLLOKOSA-N 1 2 318.461 4.067 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)N1CCc2c([nH+]cn2CC)C1 ZINC001176431640 1048670378 /nfs/dbraw/zinc/67/03/78/1048670378.db2.gz HTHYJCSAUWHCRS-INIZCTEOSA-N 1 2 303.837 4.066 20 0 DIADLO c1ccc(-c2[nH]c3ccc(NC[C@@H]4CCCCO4)cc3[nH+]2)cc1 ZINC001165239120 1048670490 /nfs/dbraw/zinc/67/04/90/1048670490.db2.gz AGEMNEOWBAKXLT-INIZCTEOSA-N 1 2 307.397 4.211 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2C[C@H](O)c3ccccc32)cs1 ZINC000850527611 1048680700 /nfs/dbraw/zinc/68/07/00/1048680700.db2.gz HBQWKXAQOIHCQZ-PJODQICGSA-N 1 2 302.443 4.096 20 0 DIADLO Cc1ccc(C=CNc2ccc(N3C[C@@H](C)O[C@@H](C)C3)[nH+]c2)cc1 ZINC001176423625 1048686189 /nfs/dbraw/zinc/68/61/89/1048686189.db2.gz CFZXBXKUKHNRJA-STCWAVISSA-N 1 2 323.440 4.086 20 0 DIADLO c1c[nH+]c(N2CCCC2)c(Nc2cccc(OCC3CC3)c2)c1 ZINC001176491787 1048696881 /nfs/dbraw/zinc/69/68/81/1048696881.db2.gz GUILCTKOJSBDPA-UHFFFAOYSA-N 1 2 309.413 4.214 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cnc(N4CCCCC4)nc3)ccc12 ZINC001176508673 1048704283 /nfs/dbraw/zinc/70/42/83/1048704283.db2.gz ZUAPSGATWQXRFR-UHFFFAOYSA-N 1 2 319.412 4.067 20 0 DIADLO CCCCCCc1ccc([N@H+]2C(=N)C=C(Cl)C=C2N)cc1 ZINC001176525901 1048708586 /nfs/dbraw/zinc/70/85/86/1048708586.db2.gz MPFOXZHQZRJFMV-UHFFFAOYSA-N 1 2 303.837 4.315 20 0 DIADLO CCCCCCc1ccc([N@@H+]2C(=N)C=C(Cl)C=C2N)cc1 ZINC001176525901 1048708592 /nfs/dbraw/zinc/70/85/92/1048708592.db2.gz MPFOXZHQZRJFMV-UHFFFAOYSA-N 1 2 303.837 4.315 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@@H+]1CCO[C@H](c3cccc(F)c3)C1)CC2 ZINC000482953239 1048711542 /nfs/dbraw/zinc/71/15/42/1048711542.db2.gz WAJGLPOFCVOYAR-MOPGFXCFSA-N 1 2 315.363 4.026 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@H+]1CCO[C@H](c3cccc(F)c3)C1)CC2 ZINC000482953239 1048711545 /nfs/dbraw/zinc/71/15/45/1048711545.db2.gz WAJGLPOFCVOYAR-MOPGFXCFSA-N 1 2 315.363 4.026 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3CC(C)(C)[C@@H]3c3cccnc3)cc21 ZINC000668184740 1048717538 /nfs/dbraw/zinc/71/75/38/1048717538.db2.gz PEBTYBOUYTVJMK-IBGZPJMESA-N 1 2 305.425 4.454 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3CC(C)(C)[C@@H]3c3cccnc3)cc21 ZINC000668184740 1048717551 /nfs/dbraw/zinc/71/75/51/1048717551.db2.gz PEBTYBOUYTVJMK-IBGZPJMESA-N 1 2 305.425 4.454 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@@H]3CCCSCC3)cc2)c1C ZINC000668183975 1048718178 /nfs/dbraw/zinc/71/81/78/1048718178.db2.gz WKRBLSIFNVRMES-OAHLLOKOSA-N 1 2 301.459 4.187 20 0 DIADLO Cn1cc(Nc2cccc(-n3cc[nH+]c3)c2)c(-c2ccccc2)n1 ZINC001176568226 1048726446 /nfs/dbraw/zinc/72/64/46/1048726446.db2.gz DNVXOHFAWQKEBD-UHFFFAOYSA-N 1 2 315.380 4.016 20 0 DIADLO Cn1cc(Nc2ccc(-n3cc[nH+]c3)cc2)c(-c2ccccc2)n1 ZINC001176568542 1048728969 /nfs/dbraw/zinc/72/89/69/1048728969.db2.gz JYMWFMHHWCJVJT-UHFFFAOYSA-N 1 2 315.380 4.016 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@@](C)(CC)c2ccccc2)n1 ZINC000775386363 1048735935 /nfs/dbraw/zinc/73/59/35/1048735935.db2.gz CWONEWHNICRNKI-DYVFJYSZSA-N 1 2 319.474 4.299 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc(Cc2ccccc2)no1)c1ccccc1 ZINC000775389039 1048741330 /nfs/dbraw/zinc/74/13/30/1048741330.db2.gz COVTWYKNMQYGEM-HXUWFJFHSA-N 1 2 321.424 4.075 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1ccc(C(F)F)cc1)n1cc[nH+]c1 ZINC000885584975 1048742198 /nfs/dbraw/zinc/74/21/98/1048742198.db2.gz WRAAPESODOFLCD-AWEZNQCLSA-N 1 2 307.344 4.047 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+]([C@@H](C)c1cc(F)ccc1F)CC2 ZINC001190572281 1048756880 /nfs/dbraw/zinc/75/68/80/1048756880.db2.gz SYMTZHMINLPQCB-ZDUSSCGKSA-N 1 2 317.379 4.483 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+]([C@@H](C)c1cc(F)ccc1F)CC2 ZINC001190572281 1048756885 /nfs/dbraw/zinc/75/68/85/1048756885.db2.gz SYMTZHMINLPQCB-ZDUSSCGKSA-N 1 2 317.379 4.483 20 0 DIADLO F[C@@H]1C[C@@H]2C[C@H]1CN2c1cc(SCc2ccccc2)cc[nH+]1 ZINC001166531055 1048757016 /nfs/dbraw/zinc/75/70/16/1048757016.db2.gz PGGGHRNMAOPIOJ-YQQAZPJKSA-N 1 2 314.429 4.311 20 0 DIADLO c1c[nH+]c(N2CCCC2)c(Nc2ccc(-c3ccncc3)cc2)c1 ZINC001176694661 1048759270 /nfs/dbraw/zinc/75/92/70/1048759270.db2.gz TXKWKLKQHYEHIL-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO c1ccc(-c2cc[nH+]c(N3CC[C@H](c4ccncc4)C3)c2)cc1 ZINC001166570238 1048764075 /nfs/dbraw/zinc/76/40/75/1048764075.db2.gz YHQSLQXLSZYNAT-IBGZPJMESA-N 1 2 301.393 4.138 20 0 DIADLO Cc1cc(-c2noc(C[N@@H+]3CC[C@H]3c3ccccc3)n2)ccc1F ZINC000483232304 1048765017 /nfs/dbraw/zinc/76/50/17/1048765017.db2.gz GXMXQBBEGNVOBK-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cc(-c2noc(C[N@H+]3CC[C@H]3c3ccccc3)n2)ccc1F ZINC000483232304 1048765028 /nfs/dbraw/zinc/76/50/28/1048765028.db2.gz GXMXQBBEGNVOBK-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO c1ccc(COC2CN(c3cc(-c4ccccc4)cc[nH+]3)C2)cc1 ZINC001166630528 1048773306 /nfs/dbraw/zinc/77/33/06/1048773306.db2.gz ULDCJUVTSPOFKJ-UHFFFAOYSA-N 1 2 316.404 4.154 20 0 DIADLO N=C1C=C(Cl)C=C(N)[N@H+]1c1ccc(C2CCCCC2)cc1 ZINC001176730768 1048774289 /nfs/dbraw/zinc/77/42/89/1048774289.db2.gz OCIUABRFMVZDIU-UHFFFAOYSA-N 1 2 301.821 4.240 20 0 DIADLO N=C1C=C(Cl)C=C(N)[N@@H+]1c1ccc(C2CCCCC2)cc1 ZINC001176730768 1048774305 /nfs/dbraw/zinc/77/43/05/1048774305.db2.gz OCIUABRFMVZDIU-UHFFFAOYSA-N 1 2 301.821 4.240 20 0 DIADLO Clc1cnc(Nc2ccc[nH+]c2N2CCCC2)c(Cl)c1 ZINC001176742956 1048776856 /nfs/dbraw/zinc/77/68/56/1048776856.db2.gz FPYALZHYSPUCPI-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO c1ccc(-c2ccccc2Nc2ccc[nH+]c2N2CCCC2)nc1 ZINC001176750707 1048777644 /nfs/dbraw/zinc/77/76/44/1048777644.db2.gz IRJCEILHBTXZHC-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Cc1ccc2c(c1)C[N@H+]([C@H](C)C(=O)Nc1ccccc1C(C)C)C2 ZINC000483309260 1048777791 /nfs/dbraw/zinc/77/77/91/1048777791.db2.gz PNUZSZPRKDIXNI-MRXNPFEDSA-N 1 2 322.452 4.461 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+]([C@H](C)C(=O)Nc1ccccc1C(C)C)C2 ZINC000483309260 1048777800 /nfs/dbraw/zinc/77/78/00/1048777800.db2.gz PNUZSZPRKDIXNI-MRXNPFEDSA-N 1 2 322.452 4.461 20 0 DIADLO Cc1cccc2ccc(Nc3ccc[nH+]c3N3CCCC3)nc12 ZINC001176743787 1048777933 /nfs/dbraw/zinc/77/79/33/1048777933.db2.gz MMLRKTOORMJNOH-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO c1ccc(-c2ccncc2Nc2ccc[nH+]c2N2CCCC2)cc1 ZINC001176750485 1048778106 /nfs/dbraw/zinc/77/81/06/1048778106.db2.gz UTBLZXVMKYILHH-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Clc1ccc2oc(Nc3ccc[nH+]c3N3CCCC3)nc2c1 ZINC001176743694 1048778917 /nfs/dbraw/zinc/77/89/17/1048778917.db2.gz SJLRNPGXXVIBTE-UHFFFAOYSA-N 1 2 314.776 4.220 20 0 DIADLO c1ccc(-c2cc[nH+]c(N3CCO[C@@H](c4ccccc4)C3)c2)cc1 ZINC001166681547 1048782419 /nfs/dbraw/zinc/78/24/19/1048782419.db2.gz NHRQYKQWBAKAAC-HXUWFJFHSA-N 1 2 316.404 4.327 20 0 DIADLO CCSc1cc[nH+]c(N(C)Cc2cccc3cccnc32)c1 ZINC001166687866 1048783802 /nfs/dbraw/zinc/78/38/02/1048783802.db2.gz FBXZCKWYDYMRNQ-UHFFFAOYSA-N 1 2 309.438 4.378 20 0 DIADLO CSc1cc[nH+]c(N(C)Cc2cccc(C(F)(F)F)c2)c1 ZINC001166687599 1048784394 /nfs/dbraw/zinc/78/43/94/1048784394.db2.gz CIFKTHWNVZRBOQ-UHFFFAOYSA-N 1 2 312.360 4.459 20 0 DIADLO Cc1nc(N(C)Cc2cccc3cccnc32)cc(C(C)C)[nH+]1 ZINC001166689523 1048784602 /nfs/dbraw/zinc/78/46/02/1048784602.db2.gz REBZGWJVLBKICL-UHFFFAOYSA-N 1 2 306.413 4.093 20 0 DIADLO Cc1nc([C@@H]2CCCCN2c2cc(C)c3cccc(C)c3[nH+]2)no1 ZINC001166714060 1048786335 /nfs/dbraw/zinc/78/63/35/1048786335.db2.gz LMBXDTRCVBETGJ-INIZCTEOSA-N 1 2 322.412 4.275 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@@H+]2CCC(C)=C(C)C2)c(Cl)c1 ZINC000483381167 1048787097 /nfs/dbraw/zinc/78/70/97/1048787097.db2.gz VWFDCXKXNUXPTL-HNNXBMFYSA-N 1 2 320.864 4.326 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@H+]2CCC(C)=C(C)C2)c(Cl)c1 ZINC000483381167 1048787112 /nfs/dbraw/zinc/78/71/12/1048787112.db2.gz VWFDCXKXNUXPTL-HNNXBMFYSA-N 1 2 320.864 4.326 20 0 DIADLO Fc1cccc(C[N@@H+]2CCC[C@H]2c2nc3ccccc3s2)n1 ZINC000851718207 1048794890 /nfs/dbraw/zinc/79/48/90/1048794890.db2.gz FOCMLHUABHIHJW-AWEZNQCLSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1cccc(C[N@H+]2CCC[C@H]2c2nc3ccccc3s2)n1 ZINC000851718207 1048794905 /nfs/dbraw/zinc/79/49/05/1048794905.db2.gz FOCMLHUABHIHJW-AWEZNQCLSA-N 1 2 313.401 4.168 20 0 DIADLO CN(C)c1cc(CSc2nc3cc(F)ccc3s2)cc[nH+]1 ZINC001166811837 1048798501 /nfs/dbraw/zinc/79/85/01/1048798501.db2.gz TXEHPWCYPLJBTH-UHFFFAOYSA-N 1 2 319.430 4.189 20 0 DIADLO COc1cc2cc[nH+]c(N(C)Cc3ccsc3)c2cc1F ZINC001166829944 1048803294 /nfs/dbraw/zinc/80/32/94/1048803294.db2.gz ZDQBHSOCNOHYAN-UHFFFAOYSA-N 1 2 302.374 4.080 20 0 DIADLO FC(F)(F)c1c[nH]c2[nH+]ccc(NCCc3ccsc3)c12 ZINC001166851010 1048804542 /nfs/dbraw/zinc/80/45/42/1048804542.db2.gz VTBROQOYKIVENO-UHFFFAOYSA-N 1 2 311.332 4.298 20 0 DIADLO CC[N@H+](C[C@@H]1CCCN(C(=O)C(C)(C)C)C1)c1ccc(C)cc1 ZINC000851827655 1048805330 /nfs/dbraw/zinc/80/53/30/1048805330.db2.gz HNNKWLRVZGKCOT-KRWDZBQOSA-N 1 2 316.489 4.106 20 0 DIADLO CC[N@@H+](C[C@@H]1CCCN(C(=O)C(C)(C)C)C1)c1ccc(C)cc1 ZINC000851827655 1048805350 /nfs/dbraw/zinc/80/53/50/1048805350.db2.gz HNNKWLRVZGKCOT-KRWDZBQOSA-N 1 2 316.489 4.106 20 0 DIADLO Fc1cccc(C=C2CC[NH+](Cc3cccc(F)n3)CC2)c1 ZINC000851856947 1048807200 /nfs/dbraw/zinc/80/72/00/1048807200.db2.gz JAIFSXNDLQINBN-UHFFFAOYSA-N 1 2 300.352 4.039 20 0 DIADLO CCC[C@H]([NH2+]Cc1cnon1)c1ccc(Cl)c(Cl)c1 ZINC000851898944 1048810219 /nfs/dbraw/zinc/81/02/19/1048810219.db2.gz RJWJLIHVPJJGCA-ZDUSSCGKSA-N 1 2 300.189 4.007 20 0 DIADLO Cc1cn2cc(NC(=O)C[C@H](c3ccccc3)C(C)C)ccc2[nH+]1 ZINC000483611891 1048823391 /nfs/dbraw/zinc/82/33/91/1048823391.db2.gz HKYRVBUDJOJLPG-SFHVURJKSA-N 1 2 321.424 4.411 20 0 DIADLO CC(C)c1ccc(N2CCC3(CC2)OCCc2ccccc23)[nH+]c1 ZINC001167016611 1048829957 /nfs/dbraw/zinc/82/99/57/1048829957.db2.gz XRTMDTZAAUYBHN-UHFFFAOYSA-N 1 2 322.452 4.273 20 0 DIADLO c1ccc2c(c1)CCOC21CCN(c2cccc(C3CC3)[nH+]2)CC1 ZINC001167014632 1048830885 /nfs/dbraw/zinc/83/08/85/1048830885.db2.gz ZDKJOZQMTQWJNS-UHFFFAOYSA-N 1 2 320.436 4.027 20 0 DIADLO COCc1cccc(C[N@H+](Cc2c(F)cccc2F)C2CC2)c1 ZINC000483634681 1048833725 /nfs/dbraw/zinc/83/37/25/1048833725.db2.gz JJZCJPHUEZIQPU-UHFFFAOYSA-N 1 2 317.379 4.276 20 0 DIADLO COCc1cccc(C[N@@H+](Cc2c(F)cccc2F)C2CC2)c1 ZINC000483634681 1048833738 /nfs/dbraw/zinc/83/37/38/1048833738.db2.gz JJZCJPHUEZIQPU-UHFFFAOYSA-N 1 2 317.379 4.276 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1coc(-c3ccccc3)n1)C2 ZINC000483658022 1048835069 /nfs/dbraw/zinc/83/50/69/1048835069.db2.gz IRCFAJRYHQCPDB-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1coc(-c3ccccc3)n1)C2 ZINC000483658022 1048835085 /nfs/dbraw/zinc/83/50/85/1048835085.db2.gz IRCFAJRYHQCPDB-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO C[C@H]1COC2(CCC2)C[N@@H+]1Cc1cc2ccccc2nc1Cl ZINC000852440957 1048841077 /nfs/dbraw/zinc/84/10/77/1048841077.db2.gz IUJKBBFCYRROCO-ZDUSSCGKSA-N 1 2 316.832 4.032 20 0 DIADLO C[C@H]1COC2(CCC2)C[N@H+]1Cc1cc2ccccc2nc1Cl ZINC000852440957 1048841091 /nfs/dbraw/zinc/84/10/91/1048841091.db2.gz IUJKBBFCYRROCO-ZDUSSCGKSA-N 1 2 316.832 4.032 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](CCSC(F)(F)F)[C@@H](C)CO1 ZINC001191085855 1048863663 /nfs/dbraw/zinc/86/36/63/1048863663.db2.gz URXFSDIEQWSXBC-GXTWGEPZSA-N 1 2 319.392 4.010 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](CCSC(F)(F)F)[C@@H](C)CO1 ZINC001191085855 1048863676 /nfs/dbraw/zinc/86/36/76/1048863676.db2.gz URXFSDIEQWSXBC-GXTWGEPZSA-N 1 2 319.392 4.010 20 0 DIADLO Clc1cc(Cl)c2c(c1)C=C(CNc1cccc[nH+]1)CO2 ZINC001177371162 1048874100 /nfs/dbraw/zinc/87/41/00/1048874100.db2.gz SZMYIGUHCHSRFT-UHFFFAOYSA-N 1 2 307.180 4.276 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1ccc(OC(F)F)cc1F ZINC001177363088 1048880106 /nfs/dbraw/zinc/88/01/06/1048880106.db2.gz JDASDHHDCSOQDT-UHFFFAOYSA-N 1 2 324.346 4.414 20 0 DIADLO COc1cccc(Nc2ccc(C)[nH+]c2C)c1Br ZINC001203373825 1048885920 /nfs/dbraw/zinc/88/59/20/1048885920.db2.gz ORQQFENJSYTMFC-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](CC(=O)Nc1ccccc1C(C)C)C2 ZINC000484021400 1048893613 /nfs/dbraw/zinc/89/36/13/1048893613.db2.gz NZJHNWZDBXXOFE-UHFFFAOYSA-N 1 2 322.452 4.115 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](CC(=O)Nc1ccccc1C(C)C)C2 ZINC000484021400 1048893636 /nfs/dbraw/zinc/89/36/36/1048893636.db2.gz NZJHNWZDBXXOFE-UHFFFAOYSA-N 1 2 322.452 4.115 20 0 DIADLO Fc1cccc(Cl)c1C[N@@H+]1CCOC[C@@H]1C1CCCCC1 ZINC001203410454 1048894130 /nfs/dbraw/zinc/89/41/30/1048894130.db2.gz GXESKJBHBDBNPZ-QGZVFWFLSA-N 1 2 311.828 4.260 20 0 DIADLO Fc1cccc(Cl)c1C[N@H+]1CCOC[C@@H]1C1CCCCC1 ZINC001203410454 1048894142 /nfs/dbraw/zinc/89/41/42/1048894142.db2.gz GXESKJBHBDBNPZ-QGZVFWFLSA-N 1 2 311.828 4.260 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccccn1 ZINC000775444379 1048903700 /nfs/dbraw/zinc/90/37/00/1048903700.db2.gz ANNRALVVPKIJCI-MRXNPFEDSA-N 1 2 313.426 4.285 20 0 DIADLO CNc1ccc(-n2c(-c3ccccc3N)cc3ccccc32)c[nH+]1 ZINC001203459711 1048905008 /nfs/dbraw/zinc/90/50/08/1048905008.db2.gz PJEUBTOWYFJEGK-UHFFFAOYSA-N 1 2 314.392 4.316 20 0 DIADLO CNc1ccc(Nc2cc(-c3ccccc3)nn2C2CCC2)c[nH+]1 ZINC001203452627 1048905665 /nfs/dbraw/zinc/90/56/65/1048905665.db2.gz QQMYRNGLIRMDIO-UHFFFAOYSA-N 1 2 319.412 4.455 20 0 DIADLO CNc1ccc(Nc2cccc3c(Cl)ncc(F)c23)c[nH+]1 ZINC001203462603 1048907055 /nfs/dbraw/zinc/90/70/55/1048907055.db2.gz WHSSSKJJEKUQSU-UHFFFAOYSA-N 1 2 302.740 4.208 20 0 DIADLO CNc1ccc(Nc2cccc(Oc3cccc(N)c3)c2)c[nH+]1 ZINC001203462470 1048907213 /nfs/dbraw/zinc/90/72/13/1048907213.db2.gz SXRPHVSIQYGPBC-UHFFFAOYSA-N 1 2 306.369 4.241 20 0 DIADLO Cc1ccc(-c2ncc(CNc3[nH+]c4ccccc4n3C)s2)o1 ZINC001203471258 1048909337 /nfs/dbraw/zinc/90/93/37/1048909337.db2.gz LRMCTFQSRORLNB-UHFFFAOYSA-N 1 2 324.409 4.210 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1cc(C2CC2)no1 ZINC000853639053 1048910224 /nfs/dbraw/zinc/91/02/24/1048910224.db2.gz WTGSXACRNBXHDI-UHFFFAOYSA-N 1 2 310.401 4.162 20 0 DIADLO Cc1nc(C)c(COc2ccc(-c3[nH+]cc4n3CCCC4)cc2)o1 ZINC000853698720 1048915139 /nfs/dbraw/zinc/91/51/39/1048915139.db2.gz SFTZXHGFYSYHRD-UHFFFAOYSA-N 1 2 323.396 4.070 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1ccnn1CC1CCC1 ZINC001203521119 1048920108 /nfs/dbraw/zinc/92/01/08/1048920108.db2.gz DJOLDBAHXHZWPH-UHFFFAOYSA-N 1 2 323.444 4.226 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NCc1c(C)cc(C)cc1C ZINC001203536109 1048923800 /nfs/dbraw/zinc/92/38/00/1048923800.db2.gz FFNWIAWSGOTCRH-UHFFFAOYSA-N 1 2 323.440 4.220 20 0 DIADLO CCSc1cccc(CNc2[nH]c3cccc(OC)c3[nH+]2)c1 ZINC001203541899 1048924256 /nfs/dbraw/zinc/92/42/56/1048924256.db2.gz MASZTWJYAOGPAG-UHFFFAOYSA-N 1 2 313.426 4.296 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)o1 ZINC000484360400 1048926634 /nfs/dbraw/zinc/92/66/34/1048926634.db2.gz YVAPEQGKHXZZMP-LLVKDONJSA-N 1 2 318.383 4.383 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)o1 ZINC000484360400 1048926638 /nfs/dbraw/zinc/92/66/38/1048926638.db2.gz YVAPEQGKHXZZMP-LLVKDONJSA-N 1 2 318.383 4.383 20 0 DIADLO CC(C)c1nc([C@@H]2CCCC[N@@H+]2C[C@H]2CCC(F)(F)C2)no1 ZINC001191382014 1048931448 /nfs/dbraw/zinc/93/14/48/1048931448.db2.gz PAQDEHSHPYEQEI-STQMWFEESA-N 1 2 313.392 4.155 20 0 DIADLO CC(C)c1nc([C@@H]2CCCC[N@H+]2C[C@H]2CCC(F)(F)C2)no1 ZINC001191382014 1048931468 /nfs/dbraw/zinc/93/14/68/1048931468.db2.gz PAQDEHSHPYEQEI-STQMWFEESA-N 1 2 313.392 4.155 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c(C)c1 ZINC001203738986 1048941389 /nfs/dbraw/zinc/94/13/89/1048941389.db2.gz CIVBMATXXIOSTP-IBGZPJMESA-N 1 2 317.379 4.155 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c(C)c1 ZINC001203738986 1048941404 /nfs/dbraw/zinc/94/14/04/1048941404.db2.gz CIVBMATXXIOSTP-IBGZPJMESA-N 1 2 317.379 4.155 20 0 DIADLO Cc1cnn(Cc2ccccc2F)c1Nc1cc(C)c[nH+]c1C ZINC001203657160 1048950321 /nfs/dbraw/zinc/95/03/21/1048950321.db2.gz KDEKQVZOIANPIT-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO O[C@@H](c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1)C1CC1 ZINC000854202525 1048950798 /nfs/dbraw/zinc/95/07/98/1048950798.db2.gz HTCOWFLFKNGWMH-FQEVSTJZSA-N 1 2 304.393 4.042 20 0 DIADLO COc1cccc(Cn2nc(C)cc2Nc2cc(C)c[nH+]c2C)c1 ZINC001203657437 1048951274 /nfs/dbraw/zinc/95/12/74/1048951274.db2.gz MOBKJKRMVQSANL-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2nc(C)c(C)cc2Br)c1 ZINC001203657017 1048951380 /nfs/dbraw/zinc/95/13/80/1048951380.db2.gz GPFPNZMEQZLVNE-UHFFFAOYSA-N 1 2 306.207 4.216 20 0 DIADLO COCCCNc1cccc(F)c1Nc1cc(C)c[nH+]c1C ZINC001203667190 1048952803 /nfs/dbraw/zinc/95/28/03/1048952803.db2.gz LJQMTQZQKJTDNT-UHFFFAOYSA-N 1 2 303.381 4.030 20 0 DIADLO COc1ccc(Br)c(Nc2cc(C)c[nH+]c2C)c1 ZINC001203661715 1048955440 /nfs/dbraw/zinc/95/54/40/1048955440.db2.gz ZQOSTTVMMPQEDZ-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2c(F)cccc2C(=O)C(F)(F)F)c1 ZINC001203669791 1048956323 /nfs/dbraw/zinc/95/63/23/1048956323.db2.gz WIJVQVICJFANBS-UHFFFAOYSA-N 1 2 312.266 4.326 20 0 DIADLO CCOC(=O)c1cnc2c(cccc2Nc2cc(C)c[nH+]c2C)c1 ZINC001203667565 1048956660 /nfs/dbraw/zinc/95/66/60/1048956660.db2.gz ONXOSDPBBDAXSS-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO Cc1ccccc1Oc1ccccc1NC(=O)CCc1[nH]cc[nH+]1 ZINC001177997501 1048970443 /nfs/dbraw/zinc/97/04/43/1048970443.db2.gz FDPAOBDWVSGISQ-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1cc2ncc(C)c(Nc3ccc([NH+]4CCCCC4)cc3)n2n1 ZINC001203713097 1048972688 /nfs/dbraw/zinc/97/26/88/1048972688.db2.gz UWHIMGAAGSQSPV-UHFFFAOYSA-N 1 2 321.428 4.080 20 0 DIADLO Cn1ccc2cc(Nc3ccc([NH+]4CCCCC4)cc3)cnc21 ZINC001203712066 1048973686 /nfs/dbraw/zinc/97/36/86/1048973686.db2.gz APRKVTDAPJUZMO-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO FC(F)(F)Cn1cc(Nc2ccc([NH+]3CCCCC3)cc2)cn1 ZINC001203712059 1048974375 /nfs/dbraw/zinc/97/43/75/1048974375.db2.gz AHNSUXQYXYGPSX-UHFFFAOYSA-N 1 2 324.350 4.179 20 0 DIADLO FC(F)Oc1ccncc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718646 1048975227 /nfs/dbraw/zinc/97/52/27/1048975227.db2.gz JDGZQGIEFUFCSQ-UHFFFAOYSA-N 1 2 319.355 4.417 20 0 DIADLO O=C1CCc2cc(Nc3ccc([NH+]4CCCCC4)cc3)ccc2N1 ZINC001203719245 1048976172 /nfs/dbraw/zinc/97/61/72/1048976172.db2.gz LEKRUDCJINSSMZ-UHFFFAOYSA-N 1 2 321.424 4.305 20 0 DIADLO Oc1cnc(Cl)cc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718353 1048976467 /nfs/dbraw/zinc/97/64/67/1048976467.db2.gz DSTGQPQNCPJPJJ-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO c1ncn(-c2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc2)n1 ZINC001203718307 1048976750 /nfs/dbraw/zinc/97/67/50/1048976750.db2.gz BHHUZEINHWRFEE-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO c1cc(C2=NCCO2)ccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718800 1048977279 /nfs/dbraw/zinc/97/72/79/1048977279.db2.gz APSBWQOCCRZWPV-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO O=c1[nH]c2cc(Nc3ccc([NH+]4CCCCC4)cc3)ccc2o1 ZINC001203723825 1048978711 /nfs/dbraw/zinc/97/87/11/1048978711.db2.gz ADPVTIMHLKYNAY-UHFFFAOYSA-N 1 2 309.369 4.267 20 0 DIADLO OCc1cc(Nc2ccc([NH+]3CCCCC3)cc2)ccc1F ZINC001203719597 1048979853 /nfs/dbraw/zinc/97/98/53/1048979853.db2.gz QWBFTBIIFFOIAK-UHFFFAOYSA-N 1 2 300.377 4.052 20 0 DIADLO CC[C@H]1C[C@H](CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)CCO1 ZINC001178068664 1048979817 /nfs/dbraw/zinc/97/98/17/1048979817.db2.gz SZPOBEGYCIFBIJ-HIFRSBDPSA-N 1 2 319.836 4.143 20 0 DIADLO OCc1cc(F)ccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203725060 1048981747 /nfs/dbraw/zinc/98/17/47/1048981747.db2.gz ZTNSZAZWFRJAOS-UHFFFAOYSA-N 1 2 300.377 4.052 20 0 DIADLO O=C1Cc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc2C1 ZINC001203725300 1048981911 /nfs/dbraw/zinc/98/19/11/1048981911.db2.gz FOVQMJDPNMKTSJ-UHFFFAOYSA-N 1 2 306.409 4.088 20 0 DIADLO c1cc(Nc2ccc([NH+]3CCCCC3)cc2)cc(C2=NCCO2)c1 ZINC001203724873 1048982430 /nfs/dbraw/zinc/98/24/30/1048982430.db2.gz WLUFAQRLSIJBJF-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO CC(C)(CNc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccccc1 ZINC001178094523 1048988734 /nfs/dbraw/zinc/98/87/34/1048988734.db2.gz LHFHFOMXDHESPV-UHFFFAOYSA-N 1 2 309.388 4.401 20 0 DIADLO Cc1cc(NCc2cccc(O)c2Cl)ccc1-n1cc[nH+]c1 ZINC001178139201 1048990807 /nfs/dbraw/zinc/99/08/07/1048990807.db2.gz QWPFGWDOYMJLRE-UHFFFAOYSA-N 1 2 313.788 4.152 20 0 DIADLO CCc1cccc(F)c1CNc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001178139395 1048991350 /nfs/dbraw/zinc/99/13/50/1048991350.db2.gz VWSYGLSHJKGCSA-UHFFFAOYSA-N 1 2 309.388 4.494 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)cc1F ZINC001203796790 1048999700 /nfs/dbraw/zinc/99/97/00/1048999700.db2.gz YCHDPRJAQUVOSB-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)cc1F ZINC001203796790 1048999714 /nfs/dbraw/zinc/99/97/14/1048999714.db2.gz YCHDPRJAQUVOSB-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1ccc(Cl)c(Cl)c1 ZINC001203806848 1049002317 /nfs/dbraw/zinc/00/23/17/1049002317.db2.gz QUBHDRVNBUWYFI-UHFFFAOYSA-N 1 2 308.208 4.308 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1ccc(Cl)c(Cl)c1 ZINC001203806848 1049002328 /nfs/dbraw/zinc/00/23/28/1049002328.db2.gz QUBHDRVNBUWYFI-UHFFFAOYSA-N 1 2 308.208 4.308 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H]1CCc2c1cc(F)cc2F ZINC000776767380 1049002766 /nfs/dbraw/zinc/00/27/66/1049002766.db2.gz XMMYNJRHYZMQRD-GOSISDBHSA-N 1 2 302.368 4.439 20 0 DIADLO CCc1cccc2c1N(Cc1ccc(-n3cc[nH+]c3)cc1C)CC2 ZINC001191861201 1049005455 /nfs/dbraw/zinc/00/54/55/1049005455.db2.gz FOQMMZRDDFICRP-UHFFFAOYSA-N 1 2 317.436 4.306 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1noc([C@@H]2CC[C@@H](c3ccccc3)C2)n1 ZINC000904263140 1049008409 /nfs/dbraw/zinc/00/84/09/1049008409.db2.gz RYFBKVRGIQGTPQ-HUUCEWRRSA-N 1 2 320.396 4.074 20 0 DIADLO Cc1[nH]c(CN[C@@H](c2ccccc2)c2ccc(F)cc2)[nH+]c1C ZINC001191846030 1049011080 /nfs/dbraw/zinc/01/10/80/1049011080.db2.gz RSQFYPWUMRCCHF-IBGZPJMESA-N 1 2 309.388 4.045 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)[nH]c1C ZINC001191846030 1049011092 /nfs/dbraw/zinc/01/10/92/1049011092.db2.gz RSQFYPWUMRCCHF-IBGZPJMESA-N 1 2 309.388 4.045 20 0 DIADLO Cc1ccc2ncc(C[N@H+](C)Cc3nc4ccccc4o3)cc2c1 ZINC001191909201 1049014059 /nfs/dbraw/zinc/01/40/59/1049014059.db2.gz FOFQLRUEVOBSLJ-UHFFFAOYSA-N 1 2 317.392 4.316 20 0 DIADLO Cc1ccc2ncc(C[N@@H+](C)Cc3nc4ccccc4o3)cc2c1 ZINC001191909201 1049014072 /nfs/dbraw/zinc/01/40/72/1049014072.db2.gz FOFQLRUEVOBSLJ-UHFFFAOYSA-N 1 2 317.392 4.316 20 0 DIADLO COc1cccc2c1CC[C@@H]2Nc1ccc([NH+]2CCCC2)cc1 ZINC000776802452 1049024005 /nfs/dbraw/zinc/02/40/05/1049024005.db2.gz JDJVKHSPHKESPO-IBGZPJMESA-N 1 2 308.425 4.395 20 0 DIADLO C[C@@H](Cc1nc(-c2c(Cl)cccc2Cl)no1)n1cc[nH+]c1 ZINC000904305763 1049026065 /nfs/dbraw/zinc/02/60/65/1049026065.db2.gz HZYWJWMOHNQBDP-VIFPVBQESA-N 1 2 323.183 4.044 20 0 DIADLO CCC[C@@H](C)[N@@H+]1CCc2[nH]c3c(cccc3Br)c2C1 ZINC001191976713 1049027218 /nfs/dbraw/zinc/02/72/18/1049027218.db2.gz IWXAEKFKLCSOAU-LLVKDONJSA-N 1 2 321.262 4.477 20 0 DIADLO CCC[C@@H](C)[N@H+]1CCc2[nH]c3c(cccc3Br)c2C1 ZINC001191976713 1049027230 /nfs/dbraw/zinc/02/72/30/1049027230.db2.gz IWXAEKFKLCSOAU-LLVKDONJSA-N 1 2 321.262 4.477 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2cnn(C(C)C)c2)c2ccccn2)c1 ZINC001178404599 1049035641 /nfs/dbraw/zinc/03/56/41/1049035641.db2.gz QRICQJPBOKGVHO-FQEVSTJZSA-N 1 2 320.440 4.047 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+](C)Cc1ccc(F)cc1 ZINC000066608499 1049044899 /nfs/dbraw/zinc/04/48/99/1049044899.db2.gz MFCCPMDVQDKSFB-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+](C)Cc1ccc(F)cc1 ZINC000066608499 1049044911 /nfs/dbraw/zinc/04/49/11/1049044911.db2.gz MFCCPMDVQDKSFB-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO COc1ccc(-c2ccc(Nc3[nH+]cccc3CCO)cc2)cc1 ZINC001203966123 1049046031 /nfs/dbraw/zinc/04/60/31/1049046031.db2.gz AARKNWLYAARKJV-UHFFFAOYSA-N 1 2 320.392 4.036 20 0 DIADLO COc1ccc(CNc2[nH+]cccc2OC(C)C)cc1Cl ZINC001178504633 1049055892 /nfs/dbraw/zinc/05/58/92/1049055892.db2.gz BRGSGPQLEPPKPH-UHFFFAOYSA-N 1 2 306.793 4.143 20 0 DIADLO CCCCC[C@@H]1CCC[N@@H+]1Cc1ncsc1Br ZINC001192215601 1049061860 /nfs/dbraw/zinc/06/18/60/1049061860.db2.gz WBJPEAJXSZSUNL-LLVKDONJSA-N 1 2 317.296 4.450 20 0 DIADLO CCCCC[C@@H]1CCC[N@H+]1Cc1ncsc1Br ZINC001192215601 1049061869 /nfs/dbraw/zinc/06/18/69/1049061869.db2.gz WBJPEAJXSZSUNL-LLVKDONJSA-N 1 2 317.296 4.450 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3ccccc3C(C)C)ccc2[nH+]1 ZINC001192226175 1049064984 /nfs/dbraw/zinc/06/49/84/1049064984.db2.gz FCSCJNBKTLZPRJ-UHFFFAOYSA-N 1 2 308.385 4.410 20 0 DIADLO CCc1noc(C)c1[C@@H](C)Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000776846740 1049068615 /nfs/dbraw/zinc/06/86/15/1049068615.db2.gz GDKSFPFQGBTNEA-CYBMUJFWSA-N 1 2 314.433 4.104 20 0 DIADLO CC(C)N(C(=O)c1cccc2[nH+]ccn21)c1ccc(Cl)cc1 ZINC000776871950 1049074997 /nfs/dbraw/zinc/07/49/97/1049074997.db2.gz OAOJXTCXJASTHG-UHFFFAOYSA-N 1 2 313.788 4.043 20 0 DIADLO Cc1cc(NC(=O)Nc2ccc(Cn3cc[nH+]c3)cc2)ccc1F ZINC001192381986 1049090614 /nfs/dbraw/zinc/09/06/14/1049090614.db2.gz GANBBKDWDBHQBM-UHFFFAOYSA-N 1 2 324.359 4.023 20 0 DIADLO CC[C@H](O)C[N@H+](Cc1ccccc1)Cc1c(F)cccc1Cl ZINC001192346096 1049092038 /nfs/dbraw/zinc/09/20/38/1049092038.db2.gz AIOLBIRNCSVZID-HNNXBMFYSA-N 1 2 321.823 4.252 20 0 DIADLO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1c(F)cccc1Cl ZINC001192346096 1049092054 /nfs/dbraw/zinc/09/20/54/1049092054.db2.gz AIOLBIRNCSVZID-HNNXBMFYSA-N 1 2 321.823 4.252 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1cc(F)cc(F)c1 ZINC001204231039 1049101655 /nfs/dbraw/zinc/10/16/55/1049101655.db2.gz NJGFKJKLCJVCFX-UHFFFAOYSA-N 1 2 303.352 4.058 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1cc(F)cc(F)c1 ZINC001204231039 1049101664 /nfs/dbraw/zinc/10/16/64/1049101664.db2.gz NJGFKJKLCJVCFX-UHFFFAOYSA-N 1 2 303.352 4.058 20 0 DIADLO FC1(F)CCC[C@@H]1[NH2+]Cc1cc(Cl)cc(Br)c1 ZINC001178860233 1049106333 /nfs/dbraw/zinc/10/63/33/1049106333.db2.gz WKMHXAPGWAWDCJ-NSHDSACASA-N 1 2 324.596 4.380 20 0 DIADLO Fc1cccc(OC2CC[NH+](Cc3c(F)cccc3F)CC2)c1 ZINC001204201205 1049110187 /nfs/dbraw/zinc/11/01/87/1049110187.db2.gz DCUIXMAXROTHLK-UHFFFAOYSA-N 1 2 321.342 4.147 20 0 DIADLO Cc1ccc([C@@]2(C)C[N@H+](Cc3ccc(F)c(F)c3)CCO2)cc1 ZINC001204226540 1049113641 /nfs/dbraw/zinc/11/36/41/1049113641.db2.gz BUGQRBPHWQEYGN-LJQANCHMSA-N 1 2 317.379 4.021 20 0 DIADLO Cc1ccc([C@@]2(C)C[N@@H+](Cc3ccc(F)c(F)c3)CCO2)cc1 ZINC001204226540 1049113650 /nfs/dbraw/zinc/11/36/50/1049113650.db2.gz BUGQRBPHWQEYGN-LJQANCHMSA-N 1 2 317.379 4.021 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC001192546115 1049117500 /nfs/dbraw/zinc/11/75/00/1049117500.db2.gz KMHYRGVBLVERIJ-JTNHKYCSSA-N 1 2 300.215 4.190 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC001192546115 1049117504 /nfs/dbraw/zinc/11/75/04/1049117504.db2.gz KMHYRGVBLVERIJ-JTNHKYCSSA-N 1 2 300.215 4.190 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC001192546123 1049117922 /nfs/dbraw/zinc/11/79/22/1049117922.db2.gz KMHYRGVBLVERIJ-UHIISALHSA-N 1 2 300.215 4.190 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC001192546123 1049117931 /nfs/dbraw/zinc/11/79/31/1049117931.db2.gz KMHYRGVBLVERIJ-UHIISALHSA-N 1 2 300.215 4.190 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cc(F)c(F)c(F)c2)nc1Cl ZINC001192537841 1049118651 /nfs/dbraw/zinc/11/86/51/1049118651.db2.gz XHDIKOQDOJPMRA-UHFFFAOYSA-N 1 2 314.738 4.093 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cc(F)c(F)c(F)c2)nc1Cl ZINC001192537841 1049118654 /nfs/dbraw/zinc/11/86/54/1049118654.db2.gz XHDIKOQDOJPMRA-UHFFFAOYSA-N 1 2 314.738 4.093 20 0 DIADLO CC1(C)C[C@@H]([NH2+]Cc2c(F)cccc2F)c2cc(F)ccc2O1 ZINC001179086151 1049129005 /nfs/dbraw/zinc/12/90/05/1049129005.db2.gz NDKHUZAITHCUIT-MRXNPFEDSA-N 1 2 321.342 4.496 20 0 DIADLO Clc1ccc(CNc2ccc(Nc3ccccc3)c[nH+]2)cn1 ZINC001179204587 1049140793 /nfs/dbraw/zinc/14/07/93/1049140793.db2.gz AXONFZUXAGGPHV-UHFFFAOYSA-N 1 2 310.788 4.486 20 0 DIADLO c1cn2cc(CNc3ccc(Nc4ccccc4)c[nH+]3)sc2n1 ZINC001179205401 1049141498 /nfs/dbraw/zinc/14/14/98/1049141498.db2.gz NISRPHQRILUASI-UHFFFAOYSA-N 1 2 321.409 4.147 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)CCC2 ZINC000775555413 1049156774 /nfs/dbraw/zinc/15/67/74/1049156774.db2.gz MOQAXJHUXFTYEX-BLLLJJGKSA-N 1 2 318.852 4.241 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+](Cc1cc(O)cc(Cl)c1)CC2 ZINC001204421326 1049159659 /nfs/dbraw/zinc/15/96/59/1049159659.db2.gz DBYBFOIQHRNVQZ-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+](Cc1cc(O)cc(Cl)c1)CC2 ZINC001204421326 1049159667 /nfs/dbraw/zinc/15/96/67/1049159667.db2.gz DBYBFOIQHRNVQZ-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1ccn(-c2ccccc2)n1 ZINC001179433024 1049163999 /nfs/dbraw/zinc/16/39/99/1049163999.db2.gz LXBOPNIATICMOO-UHFFFAOYSA-N 1 2 324.453 4.133 20 0 DIADLO c1ccc2c(c1)[nH+]c(NC[C@@H]1CCSC1)n2C1CCCC1 ZINC001179479535 1049170318 /nfs/dbraw/zinc/17/03/18/1049170318.db2.gz OQHAQWAVGCBAHM-ZDUSSCGKSA-N 1 2 301.459 4.316 20 0 DIADLO CC[C@@H]1C[C@@H](CNc2[nH+]c3cc(Cl)ccc3n2CC)CCO1 ZINC001179484067 1049170394 /nfs/dbraw/zinc/17/03/94/1049170394.db2.gz AQAQCQKNZZPDAN-GXTWGEPZSA-N 1 2 321.852 4.327 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1C[N@H+]1CCC[C@@H](C(F)F)C1 ZINC001204474740 1049170439 /nfs/dbraw/zinc/17/04/39/1049170439.db2.gz WXNHBCMSWBIICH-SECBINFHSA-N 1 2 311.269 4.322 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1C[N@@H+]1CCC[C@@H](C(F)F)C1 ZINC001204474740 1049170445 /nfs/dbraw/zinc/17/04/45/1049170445.db2.gz WXNHBCMSWBIICH-SECBINFHSA-N 1 2 311.269 4.322 20 0 DIADLO Cn1ccc(CNc2[nH+]c3ccccc3n2C2CCCCC2)c1 ZINC001179473010 1049171386 /nfs/dbraw/zinc/17/13/86/1049171386.db2.gz IQGLZEDADXNUDP-UHFFFAOYSA-N 1 2 308.429 4.492 20 0 DIADLO CC(C)CCc1noc(C[N@@H+]2CCCC[C@H]2c2ccccc2)n1 ZINC001193052661 1049176601 /nfs/dbraw/zinc/17/66/01/1049176601.db2.gz CAATVPFMQZMOBV-KRWDZBQOSA-N 1 2 313.445 4.385 20 0 DIADLO CC(C)CCc1noc(C[N@H+]2CCCC[C@H]2c2ccccc2)n1 ZINC001193052661 1049176607 /nfs/dbraw/zinc/17/66/07/1049176607.db2.gz CAATVPFMQZMOBV-KRWDZBQOSA-N 1 2 313.445 4.385 20 0 DIADLO Cc1c(F)cccc1C[N@H+](Cc1cccnc1)Cc1ccccn1 ZINC001204512691 1049179329 /nfs/dbraw/zinc/17/93/29/1049179329.db2.gz LEYIKMSWCVYSOR-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1c(F)cccc1C[N@@H+](Cc1cccnc1)Cc1ccccn1 ZINC001204512691 1049179335 /nfs/dbraw/zinc/17/93/35/1049179335.db2.gz LEYIKMSWCVYSOR-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cc(C)c2cc(NCc3c4c(nn3C)CCCC4)ccc2[nH+]1 ZINC001179588562 1049180795 /nfs/dbraw/zinc/18/07/95/1049180795.db2.gz FULRKRPSUYPNOG-UHFFFAOYSA-N 1 2 320.440 4.076 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cnn(-c2ccccc2)c1 ZINC000339005531 1049184282 /nfs/dbraw/zinc/18/42/82/1049184282.db2.gz UOTOLMUYFJDCFT-HNNXBMFYSA-N 1 2 309.388 4.204 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cnn(-c2ccccc2)c1 ZINC000339005531 1049184289 /nfs/dbraw/zinc/18/42/89/1049184289.db2.gz UOTOLMUYFJDCFT-HNNXBMFYSA-N 1 2 309.388 4.204 20 0 DIADLO Clc1cccc([C@@H]2CC[N@H+](Cc3nccs3)C2)c1Cl ZINC001204547913 1049187595 /nfs/dbraw/zinc/18/75/95/1049187595.db2.gz PWCRVZNCCDQVPC-SNVBAGLBSA-N 1 2 313.253 4.439 20 0 DIADLO Clc1cccc([C@@H]2CC[N@@H+](Cc3nccs3)C2)c1Cl ZINC001204547913 1049187601 /nfs/dbraw/zinc/18/76/01/1049187601.db2.gz PWCRVZNCCDQVPC-SNVBAGLBSA-N 1 2 313.253 4.439 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)ccc1F ZINC001204560417 1049190342 /nfs/dbraw/zinc/19/03/42/1049190342.db2.gz AOCFCMSGTAMXBB-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)ccc1F ZINC001204560417 1049190347 /nfs/dbraw/zinc/19/03/47/1049190347.db2.gz AOCFCMSGTAMXBB-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C)[nH+]c(CN2CCCCc3c(Cl)cccc32)c1 ZINC001193187391 1049190488 /nfs/dbraw/zinc/19/04/88/1049190488.db2.gz BNGWOAKHHZQABQ-UHFFFAOYSA-N 1 2 316.832 4.395 20 0 DIADLO OCc1ccc2c(c1)CC[N@@H+](Cc1cc(Cl)ccc1Cl)C2 ZINC001204562405 1049190424 /nfs/dbraw/zinc/19/04/24/1049190424.db2.gz HYWBVYDCKLKGAY-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO OCc1ccc2c(c1)CC[N@H+](Cc1cc(Cl)ccc1Cl)C2 ZINC001204562405 1049190427 /nfs/dbraw/zinc/19/04/27/1049190427.db2.gz HYWBVYDCKLKGAY-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1scnc1Cl)[C@H]2C ZINC001193271890 1049191477 /nfs/dbraw/zinc/19/14/77/1049191477.db2.gz BWTASLIJELQRGE-QWRGUYRKSA-N 1 2 322.861 4.313 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1scnc1Cl)[C@H]2C ZINC001193271890 1049191480 /nfs/dbraw/zinc/19/14/80/1049191480.db2.gz BWTASLIJELQRGE-QWRGUYRKSA-N 1 2 322.861 4.313 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1scnc1Cl)[C@H]2C ZINC001193271761 1049191618 /nfs/dbraw/zinc/19/16/18/1049191618.db2.gz BWTASLIJELQRGE-MNOVXSKESA-N 1 2 322.861 4.313 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1scnc1Cl)[C@H]2C ZINC001193271761 1049191623 /nfs/dbraw/zinc/19/16/23/1049191623.db2.gz BWTASLIJELQRGE-MNOVXSKESA-N 1 2 322.861 4.313 20 0 DIADLO C[C@H](c1nccc2ccccc21)[N@H+](C)Cc1nccn1C(F)F ZINC001204584590 1049193904 /nfs/dbraw/zinc/19/39/04/1049193904.db2.gz GTMPJUBOCGKQNA-GFCCVEGCSA-N 1 2 316.355 4.019 20 0 DIADLO C[C@H](c1nccc2ccccc21)[N@@H+](C)Cc1nccn1C(F)F ZINC001204584590 1049193910 /nfs/dbraw/zinc/19/39/10/1049193910.db2.gz GTMPJUBOCGKQNA-GFCCVEGCSA-N 1 2 316.355 4.019 20 0 DIADLO Cc1nc[nH]c1C[N@H+](Cc1ccc(Cl)cc1Cl)C(C)C ZINC001204590170 1049193997 /nfs/dbraw/zinc/19/39/97/1049193997.db2.gz CZNALKSLSBXNDI-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO Cc1nc[nH]c1C[N@@H+](Cc1ccc(Cl)cc1Cl)C(C)C ZINC001204590170 1049194002 /nfs/dbraw/zinc/19/40/02/1049194002.db2.gz CZNALKSLSBXNDI-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO CC(C)(C)c1ccc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000485176675 1049194380 /nfs/dbraw/zinc/19/43/80/1049194380.db2.gz XJJBKDOBMTVUTE-UHFFFAOYSA-N 1 2 319.408 4.422 20 0 DIADLO COc1cc(Cl)c(F)cc1NCc1c[nH+]c2c(C)cccn12 ZINC001179670633 1049195785 /nfs/dbraw/zinc/19/57/85/1049195785.db2.gz ZEHFVTQYQMLYQG-UHFFFAOYSA-N 1 2 319.767 4.056 20 0 DIADLO COCCC1CC[NH+](Cc2cc(Cl)cc(Cl)c2F)CC1 ZINC001249945710 1049198736 /nfs/dbraw/zinc/19/87/36/1049198736.db2.gz NKAZYRGPQKFIMS-UHFFFAOYSA-N 1 2 320.235 4.381 20 0 DIADLO Cc1ccc2cc(C[N@H+]3C[C@@H](C)OC[C@H]3c3ccccc3)[nH]c2c1 ZINC001204615836 1049201405 /nfs/dbraw/zinc/20/14/05/1049201405.db2.gz MFQBRSLZBZTRRG-IERDGZPVSA-N 1 2 320.436 4.438 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3C[C@@H](C)OC[C@H]3c3ccccc3)[nH]c2c1 ZINC001204615836 1049201409 /nfs/dbraw/zinc/20/14/09/1049201409.db2.gz MFQBRSLZBZTRRG-IERDGZPVSA-N 1 2 320.436 4.438 20 0 DIADLO Fc1cccc([C@@H]([NH2+][C@H]2CCCc3cn[nH]c32)c2ccccc2)c1 ZINC000857857432 1049201666 /nfs/dbraw/zinc/20/16/66/1049201666.db2.gz UFWXMVFHASTSHC-OALUTQOASA-N 1 2 321.399 4.305 20 0 DIADLO Fc1cccc([C@@H]([NH2+][C@H]2CCCc3c[nH]nc32)c2ccccc2)c1 ZINC000857857432 1049201682 /nfs/dbraw/zinc/20/16/82/1049201682.db2.gz UFWXMVFHASTSHC-OALUTQOASA-N 1 2 321.399 4.305 20 0 DIADLO Fc1ccc([C@H]([NH2+][C@@H]2CCCc3cn[nH]c32)c2ccccc2)cc1 ZINC000857850491 1049202019 /nfs/dbraw/zinc/20/20/19/1049202019.db2.gz STRCXJWGMDOQES-RTBURBONSA-N 1 2 321.399 4.305 20 0 DIADLO Fc1ccc([C@H]([NH2+][C@@H]2CCCc3c[nH]nc32)c2ccccc2)cc1 ZINC000857850491 1049202028 /nfs/dbraw/zinc/20/20/28/1049202028.db2.gz STRCXJWGMDOQES-RTBURBONSA-N 1 2 321.399 4.305 20 0 DIADLO CC(C)(C)Oc1cccc(NC(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC001204648357 1049211052 /nfs/dbraw/zinc/21/10/52/1049211052.db2.gz IKKRQKROMDUNSC-UHFFFAOYSA-N 1 2 324.384 4.156 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](C/C=C/c2ccc(F)cc2)CCO1 ZINC001204648906 1049211654 /nfs/dbraw/zinc/21/16/54/1049211654.db2.gz XTVLVMGQWHTFHI-XXIDSNJLSA-N 1 2 311.400 4.221 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](C/C=C/c2ccc(F)cc2)CCO1 ZINC001204648906 1049211667 /nfs/dbraw/zinc/21/16/67/1049211667.db2.gz XTVLVMGQWHTFHI-XXIDSNJLSA-N 1 2 311.400 4.221 20 0 DIADLO Clc1ccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)cn1 ZINC000115740233 1049212666 /nfs/dbraw/zinc/21/26/66/1049212666.db2.gz XBOUEXOJYJTOQC-HNNXBMFYSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccc(C[N@H+]2CCSC[C@H]2c2ccccc2)cn1 ZINC000115740233 1049212678 /nfs/dbraw/zinc/21/26/78/1049212678.db2.gz XBOUEXOJYJTOQC-HNNXBMFYSA-N 1 2 304.846 4.025 20 0 DIADLO CC[C@@]1(C)C[N@@H+]([C@@H](C)c2cccc(Br)c2)CCO1 ZINC001193474340 1049213446 /nfs/dbraw/zinc/21/34/46/1049213446.db2.gz WMFJKOAIWJSNCM-WFASDCNBSA-N 1 2 312.251 4.011 20 0 DIADLO CC[C@@]1(C)C[N@H+]([C@@H](C)c2cccc(Br)c2)CCO1 ZINC001193474340 1049213451 /nfs/dbraw/zinc/21/34/51/1049213451.db2.gz WMFJKOAIWJSNCM-WFASDCNBSA-N 1 2 312.251 4.011 20 0 DIADLO Brc1sccc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC001179845066 1049213598 /nfs/dbraw/zinc/21/35/98/1049213598.db2.gz JGNVAQFRIKSNMA-ZDUSSCGKSA-N 1 2 308.244 4.458 20 0 DIADLO Brc1sccc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC001179845066 1049213606 /nfs/dbraw/zinc/21/36/06/1049213606.db2.gz JGNVAQFRIKSNMA-ZDUSSCGKSA-N 1 2 308.244 4.458 20 0 DIADLO Clc1cccc([C@H]2CCC[N@@H+]2Cc2cn(C3CC3)cn2)c1 ZINC001204658008 1049213965 /nfs/dbraw/zinc/21/39/65/1049213965.db2.gz OJTBWHCPVLSAGX-QGZVFWFLSA-N 1 2 301.821 4.209 20 0 DIADLO Clc1cccc([C@H]2CCC[N@H+]2Cc2cn(C3CC3)cn2)c1 ZINC001204658008 1049213976 /nfs/dbraw/zinc/21/39/76/1049213976.db2.gz OJTBWHCPVLSAGX-QGZVFWFLSA-N 1 2 301.821 4.209 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1c(F)ccc(OC(C)C)c1F ZINC001204656604 1049214126 /nfs/dbraw/zinc/21/41/26/1049214126.db2.gz YECSTPGJKKWPLT-UHFFFAOYSA-N 1 2 306.356 4.188 20 0 DIADLO Cc1noc([C@H]([NH2+]Cc2cccc(CC3CCC3)c2)C(C)C)n1 ZINC001179838203 1049214255 /nfs/dbraw/zinc/21/42/55/1049214255.db2.gz PBSPJDJYHDZKLL-GOSISDBHSA-N 1 2 313.445 4.208 20 0 DIADLO Fc1cccc2c1CC[N@H+](Cc1cccc(OC3CC3)c1F)C2 ZINC001179862961 1049223077 /nfs/dbraw/zinc/22/30/77/1049223077.db2.gz HRLWEKTXTJDRTF-UHFFFAOYSA-N 1 2 315.363 4.064 20 0 DIADLO Fc1cccc2c1CC[N@@H+](Cc1cccc(OC3CC3)c1F)C2 ZINC001179862961 1049223084 /nfs/dbraw/zinc/22/30/84/1049223084.db2.gz HRLWEKTXTJDRTF-UHFFFAOYSA-N 1 2 315.363 4.064 20 0 DIADLO CN(C)c1ccc(F)cc1C[N@@H+]1CCc2c(Cl)cccc2C1 ZINC001179864506 1049224311 /nfs/dbraw/zinc/22/43/11/1049224311.db2.gz WHBQBKTXOXPCCW-UHFFFAOYSA-N 1 2 318.823 4.103 20 0 DIADLO CN(C)c1ccc(F)cc1C[N@H+]1CCc2c(Cl)cccc2C1 ZINC001179864506 1049224319 /nfs/dbraw/zinc/22/43/19/1049224319.db2.gz WHBQBKTXOXPCCW-UHFFFAOYSA-N 1 2 318.823 4.103 20 0 DIADLO CC(C)c1ccc(CC[N@@H+]2C[C@H](C)O[C@H](C(F)(F)F)C2)cc1 ZINC001179879229 1049225186 /nfs/dbraw/zinc/22/51/86/1049225186.db2.gz YTTJZVMGYBLJRL-BBRMVZONSA-N 1 2 315.379 4.004 20 0 DIADLO CC(C)c1ccc(CC[N@H+]2C[C@H](C)O[C@H](C(F)(F)F)C2)cc1 ZINC001179879229 1049225195 /nfs/dbraw/zinc/22/51/95/1049225195.db2.gz YTTJZVMGYBLJRL-BBRMVZONSA-N 1 2 315.379 4.004 20 0 DIADLO CC(C)c1ccc(CC[N@H+]2C[C@H](C(F)(F)F)O[C@@H](C)C2)cc1 ZINC001179879232 1049225400 /nfs/dbraw/zinc/22/54/00/1049225400.db2.gz YTTJZVMGYBLJRL-XJKSGUPXSA-N 1 2 315.379 4.004 20 0 DIADLO CC(C)c1ccc(CC[N@@H+]2C[C@H](C(F)(F)F)O[C@@H](C)C2)cc1 ZINC001179879232 1049225409 /nfs/dbraw/zinc/22/54/09/1049225409.db2.gz YTTJZVMGYBLJRL-XJKSGUPXSA-N 1 2 315.379 4.004 20 0 DIADLO COc1nscc1C[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC001193604265 1049239275 /nfs/dbraw/zinc/23/92/75/1049239275.db2.gz FNWWLGYRCAMMJF-MRVPVSSYSA-N 1 2 317.241 4.309 20 0 DIADLO Fc1cc(F)c(F)c(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001206405889 1049243491 /nfs/dbraw/zinc/24/34/91/1049243491.db2.gz LWVGZAZNMZSJOT-UHFFFAOYSA-N 1 2 303.287 4.092 20 0 DIADLO CCC[C@H]([NH2+][C@@H]1CC(C)(C)CCc2ccccc21)C(=O)OCC ZINC001193733451 1049249319 /nfs/dbraw/zinc/24/93/19/1049249319.db2.gz FQKOTSSFAMXOEU-ZWKOTPCHSA-N 1 2 317.473 4.412 20 0 DIADLO CCC[C@H]([NH2+][C@H]1CC(C)(C)CCc2ccccc21)C(=O)OCC ZINC001193733448 1049249608 /nfs/dbraw/zinc/24/96/08/1049249608.db2.gz FQKOTSSFAMXOEU-ROUUACIJSA-N 1 2 317.473 4.412 20 0 DIADLO Nc1ncccc1C[N@H+](Cc1ccccc1)Cc1ccccc1F ZINC001180011305 1049257283 /nfs/dbraw/zinc/25/72/83/1049257283.db2.gz LRQDCCWCMZXJHQ-UHFFFAOYSA-N 1 2 321.399 4.005 20 0 DIADLO Nc1ncccc1C[N@@H+](Cc1ccccc1)Cc1ccccc1F ZINC001180011305 1049257290 /nfs/dbraw/zinc/25/72/90/1049257290.db2.gz LRQDCCWCMZXJHQ-UHFFFAOYSA-N 1 2 321.399 4.005 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@@H+]1CCOc3cccc(F)c3C1)CCC2 ZINC001193799004 1049266371 /nfs/dbraw/zinc/26/63/71/1049266371.db2.gz XBVWSCULZIXAET-GOSISDBHSA-N 1 2 315.363 4.237 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@H+]1CCOc3cccc(F)c3C1)CCC2 ZINC001193799004 1049266381 /nfs/dbraw/zinc/26/63/81/1049266381.db2.gz XBVWSCULZIXAET-GOSISDBHSA-N 1 2 315.363 4.237 20 0 DIADLO FC(F)C[N@@H+](Cc1ccccc1)C[C@H]1CCc2ccccc21 ZINC001180071610 1049270213 /nfs/dbraw/zinc/27/02/13/1049270213.db2.gz DCEPTIZIDHCZSK-QGZVFWFLSA-N 1 2 301.380 4.484 20 0 DIADLO FC(F)C[N@H+](Cc1ccccc1)C[C@H]1CCc2ccccc21 ZINC001180071610 1049270226 /nfs/dbraw/zinc/27/02/26/1049270226.db2.gz DCEPTIZIDHCZSK-QGZVFWFLSA-N 1 2 301.380 4.484 20 0 DIADLO CC[N@H+](Cc1nccn1C1CC1)Cc1ccc2ccccc2c1 ZINC001204803341 1049270386 /nfs/dbraw/zinc/27/03/86/1049270386.db2.gz LWYWSGSTOWOWFF-UHFFFAOYSA-N 1 2 305.425 4.393 20 0 DIADLO CC[N@@H+](Cc1nccn1C1CC1)Cc1ccc2ccccc2c1 ZINC001204803341 1049270400 /nfs/dbraw/zinc/27/04/00/1049270400.db2.gz LWYWSGSTOWOWFF-UHFFFAOYSA-N 1 2 305.425 4.393 20 0 DIADLO Oc1ccc(Cl)c(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)c1 ZINC001193830039 1049270884 /nfs/dbraw/zinc/27/08/84/1049270884.db2.gz ZQBIWWCDOHNMSZ-KRWDZBQOSA-N 1 2 305.780 4.116 20 0 DIADLO Oc1ccc(Cl)c(C[N@H+]2CC[C@@](F)(c3ccccc3)C2)c1 ZINC001193830039 1049270893 /nfs/dbraw/zinc/27/08/93/1049270893.db2.gz ZQBIWWCDOHNMSZ-KRWDZBQOSA-N 1 2 305.780 4.116 20 0 DIADLO COc1ccc(C[N@H+]2CC=C(C(F)(F)F)CC2)cc1Cl ZINC000485535227 1049271297 /nfs/dbraw/zinc/27/12/97/1049271297.db2.gz XLSVYIYLKZNQRH-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO COc1ccc(C[N@@H+]2CC=C(C(F)(F)F)CC2)cc1Cl ZINC000485535227 1049271311 /nfs/dbraw/zinc/27/13/11/1049271311.db2.gz XLSVYIYLKZNQRH-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO Clc1csc(N[C@H]2CC[C@H](Nc3cccc[nH+]3)CC2)n1 ZINC000858544883 1049273167 /nfs/dbraw/zinc/27/31/67/1049273167.db2.gz BWAQGPKRBKPRAQ-XYPYZODXSA-N 1 2 308.838 4.027 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)cc1F ZINC001204817312 1049273365 /nfs/dbraw/zinc/27/33/65/1049273365.db2.gz RXLBVSVAPKJZOO-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)cc1F ZINC001204817312 1049273380 /nfs/dbraw/zinc/27/33/80/1049273380.db2.gz RXLBVSVAPKJZOO-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2ccnn2C2CCC2)cc1F ZINC001204816078 1049273578 /nfs/dbraw/zinc/27/35/78/1049273578.db2.gz GDWZQZFPEXZPSZ-SFHVURJKSA-N 1 2 317.383 4.223 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2ccnn2C2CCC2)cc1F ZINC001204816078 1049273591 /nfs/dbraw/zinc/27/35/91/1049273591.db2.gz GDWZQZFPEXZPSZ-SFHVURJKSA-N 1 2 317.383 4.223 20 0 DIADLO COc1nccc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)c1F ZINC001180129400 1049277469 /nfs/dbraw/zinc/27/74/69/1049277469.db2.gz QWXNVIMEAXTULE-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)c1F ZINC001180129400 1049277481 /nfs/dbraw/zinc/27/74/81/1049277481.db2.gz QWXNVIMEAXTULE-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO CCCC[C@@H](CC)COC(=O)NCc1c[nH+]c2c(C)cccn12 ZINC001193976056 1049289652 /nfs/dbraw/zinc/28/96/52/1049289652.db2.gz KPUGLHPRXLSOBD-OAHLLOKOSA-N 1 2 317.433 4.085 20 0 DIADLO Cn1ncc(C[N@H+](C)Cc2cccc(Cl)c2Cl)c1C1CC1 ZINC001180111778 1049290047 /nfs/dbraw/zinc/29/00/47/1049290047.db2.gz DCLQBVNZHSGNRY-UHFFFAOYSA-N 1 2 324.255 4.236 20 0 DIADLO Cn1ncc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)c1C1CC1 ZINC001180111778 1049290057 /nfs/dbraw/zinc/29/00/57/1049290057.db2.gz DCLQBVNZHSGNRY-UHFFFAOYSA-N 1 2 324.255 4.236 20 0 DIADLO Cc1nn(C)c2ccc(Nc3ccc4c(C)cc[nH+]c4c3)cc12 ZINC001204878324 1049295467 /nfs/dbraw/zinc/29/54/67/1049295467.db2.gz QBTQNROLZJRDBV-UHFFFAOYSA-N 1 2 302.381 4.482 20 0 DIADLO CC(C)[N@H+](Cc1c(Cl)n[nH]c1C1CC1)Cc1cccc(F)c1 ZINC001180153153 1049300915 /nfs/dbraw/zinc/30/09/15/1049300915.db2.gz HBBBXDXXHLYVKA-UHFFFAOYSA-N 1 2 321.827 4.490 20 0 DIADLO CC(C)[N@@H+](Cc1c(Cl)n[nH]c1C1CC1)Cc1cccc(F)c1 ZINC001180153153 1049300927 /nfs/dbraw/zinc/30/09/27/1049300927.db2.gz HBBBXDXXHLYVKA-UHFFFAOYSA-N 1 2 321.827 4.490 20 0 DIADLO CC(C)c1cccc2c1CC[N@H+](Cc1noc3c1CCCC3)C2 ZINC001194042076 1049307157 /nfs/dbraw/zinc/30/71/57/1049307157.db2.gz KILMEXCRLBRIOZ-UHFFFAOYSA-N 1 2 310.441 4.235 20 0 DIADLO CC(C)c1cccc2c1CC[N@@H+](Cc1noc3c1CCCC3)C2 ZINC001194042076 1049307166 /nfs/dbraw/zinc/30/71/66/1049307166.db2.gz KILMEXCRLBRIOZ-UHFFFAOYSA-N 1 2 310.441 4.235 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2ccnc(F)c2)C2CC2)o1 ZINC000859053273 1049307573 /nfs/dbraw/zinc/30/75/73/1049307573.db2.gz ZXVTZBRLPDDBHN-WBMJQRKESA-N 1 2 300.377 4.102 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2ccnc(F)c2)C2CC2)o1 ZINC000859053273 1049307579 /nfs/dbraw/zinc/30/75/79/1049307579.db2.gz ZXVTZBRLPDDBHN-WBMJQRKESA-N 1 2 300.377 4.102 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2ccnc(F)c2)C2CC2)o1 ZINC000859053270 1049308400 /nfs/dbraw/zinc/30/84/00/1049308400.db2.gz ZXVTZBRLPDDBHN-BLLLJJGKSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2ccnc(F)c2)C2CC2)o1 ZINC000859053270 1049308417 /nfs/dbraw/zinc/30/84/17/1049308417.db2.gz ZXVTZBRLPDDBHN-BLLLJJGKSA-N 1 2 300.377 4.102 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@H]2c2nc3ccccc3s2)ccn1 ZINC000859062968 1049309655 /nfs/dbraw/zinc/30/96/55/1049309655.db2.gz MCDWNNLIVGPHNH-AWEZNQCLSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@H]2c2nc3ccccc3s2)ccn1 ZINC000859062968 1049309666 /nfs/dbraw/zinc/30/96/66/1049309666.db2.gz MCDWNNLIVGPHNH-AWEZNQCLSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@@H+](C/C=C/c1ccc(F)c(F)c1)CC2 ZINC001180220049 1049310664 /nfs/dbraw/zinc/31/06/64/1049310664.db2.gz YMJKGTPJJZLZDL-OWOJBTEDSA-N 1 2 321.317 4.315 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@H+](C/C=C/c1ccc(F)c(F)c1)CC2 ZINC001180220049 1049310678 /nfs/dbraw/zinc/31/06/78/1049310678.db2.gz YMJKGTPJJZLZDL-OWOJBTEDSA-N 1 2 321.317 4.315 20 0 DIADLO Cc1ccc(C[C@@H](C)[NH2+]c2ccc(N3CCOCC3)c(C)c2)cc1 ZINC001204937505 1049314920 /nfs/dbraw/zinc/31/49/20/1049314920.db2.gz MFPUHPSGAVTFHF-GOSISDBHSA-N 1 2 324.468 4.183 20 0 DIADLO Cc1cccc(C[C@H](C)[NH2+]c2ccc(N3CCOCC3)c(C)c2)c1 ZINC001204937113 1049316264 /nfs/dbraw/zinc/31/62/64/1049316264.db2.gz GGRWXUGTNOOWKL-SFHVURJKSA-N 1 2 324.468 4.183 20 0 DIADLO COc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)c1F ZINC001180233361 1049316254 /nfs/dbraw/zinc/31/62/54/1049316254.db2.gz DAIWMKZBKZVSJU-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(C[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)c1F ZINC001180233361 1049316267 /nfs/dbraw/zinc/31/62/67/1049316267.db2.gz DAIWMKZBKZVSJU-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c(F)c1 ZINC001204941128 1049317259 /nfs/dbraw/zinc/31/72/59/1049317259.db2.gz BUKKZIINPHAXEV-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)c(F)c1 ZINC001204941128 1049317269 /nfs/dbraw/zinc/31/72/69/1049317269.db2.gz BUKKZIINPHAXEV-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO CC[N@H+](Cc1nc(Cl)cs1)[C@@H](C)c1cccc(OC)c1 ZINC001180239146 1049319578 /nfs/dbraw/zinc/31/95/78/1049319578.db2.gz HQQZKTCEBVMCRF-NSHDSACASA-N 1 2 310.850 4.388 20 0 DIADLO CC[N@@H+](Cc1nc(Cl)cs1)[C@@H](C)c1cccc(OC)c1 ZINC001180239146 1049319587 /nfs/dbraw/zinc/31/95/87/1049319587.db2.gz HQQZKTCEBVMCRF-NSHDSACASA-N 1 2 310.850 4.388 20 0 DIADLO COc1nccc(C[N@H+](C)Cc2csc3ccccc23)c1F ZINC001180249036 1049321723 /nfs/dbraw/zinc/32/17/23/1049321723.db2.gz BINVETBCNGPTKL-UHFFFAOYSA-N 1 2 316.401 4.076 20 0 DIADLO COc1nccc(C[N@@H+](C)Cc2csc3ccccc23)c1F ZINC001180249036 1049321733 /nfs/dbraw/zinc/32/17/33/1049321733.db2.gz BINVETBCNGPTKL-UHFFFAOYSA-N 1 2 316.401 4.076 20 0 DIADLO C[C@@H]([NH2+]Cc1cccnc1C(F)(F)F)c1c(F)cccc1F ZINC000859227523 1049322123 /nfs/dbraw/zinc/32/21/23/1049322123.db2.gz IAWYIGUXTKKSTI-SECBINFHSA-N 1 2 316.273 4.229 20 0 DIADLO c1cn2ccc(Nc3ccc(Oc4ccncc4)cc3)cc2[nH+]1 ZINC001204978174 1049328585 /nfs/dbraw/zinc/32/85/85/1049328585.db2.gz OMNYSGMKQLGTDS-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO Nc1ccccc1N(Cc1ccccc1)c1ccn2cc[nH+]c2c1 ZINC001204990654 1049333130 /nfs/dbraw/zinc/33/31/30/1049333130.db2.gz DDZKMDVOVNBVIO-UHFFFAOYSA-N 1 2 314.392 4.255 20 0 DIADLO c1cn2ccc(Nc3ccc(OCc4ccncc4)cc3)cc2[nH+]1 ZINC001204991218 1049333618 /nfs/dbraw/zinc/33/36/18/1049333618.db2.gz MBCDQNLWXKLUQX-UHFFFAOYSA-N 1 2 316.364 4.052 20 0 DIADLO COC(=O)c1cc2cc(Nc3ccn4cc[nH+]c4c3)ccc2s1 ZINC001204991236 1049334097 /nfs/dbraw/zinc/33/40/97/1049334097.db2.gz MQFLJMBXWYZBSV-UHFFFAOYSA-N 1 2 323.377 4.079 20 0 DIADLO COC(=O)c1ccc2cc(Nc3ccn4cc[nH+]c4c3)ccc2c1 ZINC001204996997 1049334481 /nfs/dbraw/zinc/33/44/81/1049334481.db2.gz FSWFCTMNPDEWJG-UHFFFAOYSA-N 1 2 317.348 4.018 20 0 DIADLO COc1c(Cl)cc(Cl)cc1Nc1ccn2cc[nH+]c2c1 ZINC001204997284 1049335597 /nfs/dbraw/zinc/33/55/97/1049335597.db2.gz HQPRCOVZTPHDSB-UHFFFAOYSA-N 1 2 308.168 4.393 20 0 DIADLO CCCCCCOC(=O)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001194185312 1049338332 /nfs/dbraw/zinc/33/83/32/1049338332.db2.gz KEGSZWPJFYEMFF-UHFFFAOYSA-N 1 2 301.390 4.060 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)Cc3c(C)cccc3Cl)cc2[nH+]1 ZINC000485795276 1049340349 /nfs/dbraw/zinc/34/03/49/1049340349.db2.gz QVDCUVYOWMTCQZ-UHFFFAOYSA-N 1 2 313.788 4.014 20 0 DIADLO COc1c(C)c[nH+]c(CNc2cc(SC)ccc2C)c1C ZINC001180323208 1049344507 /nfs/dbraw/zinc/34/45/07/1049344507.db2.gz XBWUXHCXGYOPBW-UHFFFAOYSA-N 1 2 302.443 4.349 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc2ncsc2c1 ZINC000485851894 1049350214 /nfs/dbraw/zinc/35/02/14/1049350214.db2.gz WEYNWIDFDGRGEU-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO CC[C@@]([NH2+]C[C@@H]1CCCCC1(C)C)(C(=O)OC)c1ccccc1 ZINC001194260542 1049351658 /nfs/dbraw/zinc/35/16/58/1049351658.db2.gz DQUDSKIHJJMVNX-PXNSSMCTSA-N 1 2 317.473 4.271 20 0 DIADLO Fc1cnccc1C[NH+](Cc1ccccc1)Cc1ccccc1 ZINC001205046023 1049351756 /nfs/dbraw/zinc/35/17/56/1049351756.db2.gz IONPVFSOMBAWFM-UHFFFAOYSA-N 1 2 306.384 4.423 20 0 DIADLO CCn1ccc(C[NH+](Cc2ccccc2)Cc2ccccc2)n1 ZINC001205045691 1049352246 /nfs/dbraw/zinc/35/22/46/1049352246.db2.gz AZMNABYUFFAZFR-UHFFFAOYSA-N 1 2 305.425 4.105 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)[C@@H](C)c2ccco2)cc1OC ZINC001180393735 1049353261 /nfs/dbraw/zinc/35/32/61/1049353261.db2.gz PROYWSRHXMBVKQ-NSHDSACASA-N 1 2 309.793 4.143 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)[C@@H](C)c2ccco2)cc1OC ZINC001180393735 1049353274 /nfs/dbraw/zinc/35/32/74/1049353274.db2.gz PROYWSRHXMBVKQ-NSHDSACASA-N 1 2 309.793 4.143 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1CCCCC[C@@H]1c1ccncc1 ZINC001180488404 1049363971 /nfs/dbraw/zinc/36/39/71/1049363971.db2.gz LWCYISWYRGHDJF-OAHLLOKOSA-N 1 2 318.852 4.069 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1CCCCC[C@@H]1c1ccncc1 ZINC001180488404 1049363981 /nfs/dbraw/zinc/36/39/81/1049363981.db2.gz LWCYISWYRGHDJF-OAHLLOKOSA-N 1 2 318.852 4.069 20 0 DIADLO COc1nsc(C[N@H+](C)[C@H](C)c2ccc(C)cc2)c1Cl ZINC001205077666 1049366150 /nfs/dbraw/zinc/36/61/50/1049366150.db2.gz RCVUFATVSBYEOZ-LLVKDONJSA-N 1 2 310.850 4.307 20 0 DIADLO COc1nsc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2)c1Cl ZINC001205077666 1049366165 /nfs/dbraw/zinc/36/61/65/1049366165.db2.gz RCVUFATVSBYEOZ-LLVKDONJSA-N 1 2 310.850 4.307 20 0 DIADLO C[C@@H]1CCC[C@H](c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)C1 ZINC001205076620 1049366567 /nfs/dbraw/zinc/36/65/67/1049366567.db2.gz XTZGQRULYOREHC-HIFRSBDPSA-N 1 2 308.385 4.216 20 0 DIADLO COc1ccc2c(c1)C[N@H+]([C@@H](C)c1ccccc1Cl)CCO2 ZINC001194417895 1049372992 /nfs/dbraw/zinc/37/29/92/1049372992.db2.gz JPDCVCCPLOPDHT-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc2c(c1)C[N@@H+]([C@@H](C)c1ccccc1Cl)CCO2 ZINC001194417895 1049373006 /nfs/dbraw/zinc/37/30/06/1049373006.db2.gz JPDCVCCPLOPDHT-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO Cc1cn2c(cccc2NC(=O)Oc2ccc3ccccc3c2)[nH+]1 ZINC001194623767 1049405982 /nfs/dbraw/zinc/40/59/82/1049405982.db2.gz PFLXKFDWSWMKME-UHFFFAOYSA-N 1 2 317.348 4.407 20 0 DIADLO CN(C)c1ccc(F)cc1C[N@@H+]1CCc2cc(Cl)ccc2C1 ZINC001180835520 1049408098 /nfs/dbraw/zinc/40/80/98/1049408098.db2.gz JXKZGEFYENMARM-UHFFFAOYSA-N 1 2 318.823 4.103 20 0 DIADLO CN(C)c1ccc(F)cc1C[N@H+]1CCc2cc(Cl)ccc2C1 ZINC001180835520 1049408106 /nfs/dbraw/zinc/40/81/06/1049408106.db2.gz JXKZGEFYENMARM-UHFFFAOYSA-N 1 2 318.823 4.103 20 0 DIADLO CCCOc1ccc(C[NH2+]Cc2ccc(O)c(F)c2F)c(C)c1 ZINC001180872900 1049413826 /nfs/dbraw/zinc/41/38/26/1049413826.db2.gz HUJUZBXQKUXYQD-UHFFFAOYSA-N 1 2 321.367 4.057 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cccc(Br)c2F)o1 ZINC001203297663 1049422701 /nfs/dbraw/zinc/42/27/01/1049422701.db2.gz REKGXIKHOKIJBW-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cccc(Br)c2F)o1 ZINC001203297663 1049422705 /nfs/dbraw/zinc/42/27/05/1049422705.db2.gz REKGXIKHOKIJBW-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001194764531 1049427620 /nfs/dbraw/zinc/42/76/20/1049427620.db2.gz MFEIVBGKMCHYJO-CHWSQXEVSA-N 1 2 303.352 4.309 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001194764531 1049427626 /nfs/dbraw/zinc/42/76/26/1049427626.db2.gz MFEIVBGKMCHYJO-CHWSQXEVSA-N 1 2 303.352 4.309 20 0 DIADLO COc1cccc(C[N@H+]2Cc3ccccc3O[C@@H](C)C2)c1Cl ZINC001194764835 1049427699 /nfs/dbraw/zinc/42/76/99/1049427699.db2.gz NSXUTDZGQWQPPQ-ZDUSSCGKSA-N 1 2 317.816 4.132 20 0 DIADLO COc1cccc(C[N@@H+]2Cc3ccccc3O[C@@H](C)C2)c1Cl ZINC001194764835 1049427702 /nfs/dbraw/zinc/42/77/02/1049427702.db2.gz NSXUTDZGQWQPPQ-ZDUSSCGKSA-N 1 2 317.816 4.132 20 0 DIADLO Brc1ccc2c(c1)[C@H](Nc1cccc[nH+]1)CS2 ZINC000486481419 1049430336 /nfs/dbraw/zinc/43/03/36/1049430336.db2.gz UDOSYLHGCCIMQR-LLVKDONJSA-N 1 2 307.216 4.103 20 0 DIADLO Cc1ccc(CC2CC[NH+]([C@H](C)c3csnn3)CC2)cc1C ZINC001194853708 1049437411 /nfs/dbraw/zinc/43/74/11/1049437411.db2.gz DEMUNSJUODTXBV-OAHLLOKOSA-N 1 2 315.486 4.171 20 0 DIADLO Clc1cccc(C[N@@H+]2CCc3nn(-c4ccccc4)cc3C2)c1 ZINC001203801256 1049442256 /nfs/dbraw/zinc/44/22/56/1049442256.db2.gz OXDDRDZKNSQRTA-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1cccc(C[N@H+]2CCc3nn(-c4ccccc4)cc3C2)c1 ZINC001203801256 1049442262 /nfs/dbraw/zinc/44/22/62/1049442262.db2.gz OXDDRDZKNSQRTA-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Cc1cc(C[NH+]2CCC(F)(F)CC2)c(Br)cc1F ZINC001181185710 1049450064 /nfs/dbraw/zinc/45/00/64/1049450064.db2.gz VXGYOBPETJIWRF-UHFFFAOYSA-N 1 2 322.168 4.128 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC001194890879 1049450780 /nfs/dbraw/zinc/45/07/80/1049450780.db2.gz NEDYZDOPCNZVJG-TZMCWYRMSA-N 1 2 309.475 4.251 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC001194890879 1049450786 /nfs/dbraw/zinc/45/07/86/1049450786.db2.gz NEDYZDOPCNZVJG-TZMCWYRMSA-N 1 2 309.475 4.251 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CC[C@](F)(c4ccccc4C)C3)cn2c1 ZINC001181196615 1049452127 /nfs/dbraw/zinc/45/21/27/1049452127.db2.gz SOHZXNRRGQNGQA-HXUWFJFHSA-N 1 2 323.415 4.022 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CC[C@](F)(c4ccccc4C)C3)cn2c1 ZINC001181196615 1049452133 /nfs/dbraw/zinc/45/21/33/1049452133.db2.gz SOHZXNRRGQNGQA-HXUWFJFHSA-N 1 2 323.415 4.022 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1ncc(C(C)(C)C)s1)CC2 ZINC001205399341 1049460444 /nfs/dbraw/zinc/46/04/44/1049460444.db2.gz DYPLSQJLFJYSNI-UHFFFAOYSA-N 1 2 300.471 4.307 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1ncc(C(C)(C)C)s1)CC2 ZINC001205399341 1049460448 /nfs/dbraw/zinc/46/04/48/1049460448.db2.gz DYPLSQJLFJYSNI-UHFFFAOYSA-N 1 2 300.471 4.307 20 0 DIADLO CCOC(=O)[C@H]([NH2+][C@@H]1CC(C)(C)C[C@@H]1C)c1cccc(C)c1C ZINC001205465588 1049477216 /nfs/dbraw/zinc/47/72/16/1049477216.db2.gz JAUJAIZXPVZTET-BMGDILEWSA-N 1 2 317.473 4.322 20 0 DIADLO Cc1c(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)ccnc1F ZINC000862214038 1049478549 /nfs/dbraw/zinc/47/85/49/1049478549.db2.gz CDDSJJYVGKWRKG-LBPRGKRZSA-N 1 2 315.417 4.332 20 0 DIADLO Cc1c(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)ccnc1F ZINC000862214038 1049478562 /nfs/dbraw/zinc/47/85/62/1049478562.db2.gz CDDSJJYVGKWRKG-LBPRGKRZSA-N 1 2 315.417 4.332 20 0 DIADLO C/C=C\C[C@H]([NH2+]C1CC(c2ccc(Cl)cc2)C1)C(=O)OCC ZINC001181453683 1049479361 /nfs/dbraw/zinc/47/93/61/1049479361.db2.gz BOMUCOPBIJKGDG-MRLXKIKYSA-N 1 2 321.848 4.074 20 0 DIADLO C[N@H+](Cc1ccsc1C(F)(F)F)Cc1ccc(Cl)nc1 ZINC000862215811 1049479441 /nfs/dbraw/zinc/47/94/41/1049479441.db2.gz OGCRPBXNKRJJQF-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1ccsc1C(F)(F)F)Cc1ccc(Cl)nc1 ZINC000862215811 1049479446 /nfs/dbraw/zinc/47/94/46/1049479446.db2.gz OGCRPBXNKRJJQF-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO CCOc1cccc([C@H](C)Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC000777246935 1049484134 /nfs/dbraw/zinc/48/41/34/1049484134.db2.gz AIQZGFHYLTWDKR-HNNXBMFYSA-N 1 2 311.429 4.254 20 0 DIADLO Cn1cc(Cl)c(C[NH+]2CCC(c3cccc(Cl)c3)CC2)n1 ZINC001205506896 1049488184 /nfs/dbraw/zinc/48/81/84/1049488184.db2.gz JRTDFKSRUZEMGG-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO CCN(CC)c1ccc(N[C@H](C)c2cccnc2Cl)c[nH+]1 ZINC000777251145 1049488607 /nfs/dbraw/zinc/48/86/07/1049488607.db2.gz LAALBDKRIKUPJL-GFCCVEGCSA-N 1 2 304.825 4.149 20 0 DIADLO Oc1cccc(C[NH+]2CC(Cc3ccccc3Cl)C2)c1Cl ZINC001181544617 1049489847 /nfs/dbraw/zinc/48/98/47/1049489847.db2.gz SVDOIQDERLMDDJ-UHFFFAOYSA-N 1 2 322.235 4.374 20 0 DIADLO C[C@H]1C[NH+](Cc2ccnc(Cl)c2Cl)C[C@H](C)C1(F)F ZINC000862438342 1049493702 /nfs/dbraw/zinc/49/37/02/1049493702.db2.gz ADYMXDWPNSBFIA-IUCAKERBSA-N 1 2 309.187 4.112 20 0 DIADLO CC(=O)c1cc(Cl)nc(Cl)c1Nc1ccc(C)[nH+]c1C ZINC001203367566 1049499435 /nfs/dbraw/zinc/49/94/35/1049499435.db2.gz MHWOFEFYKQISTP-UHFFFAOYSA-N 1 2 310.184 4.346 20 0 DIADLO Fc1nccc(Cl)c1C[N@@H+]1CCC=C(c2ccccc2)C1 ZINC001181673554 1049503697 /nfs/dbraw/zinc/50/36/97/1049503697.db2.gz MAWHNOMVWZJMRA-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Fc1nccc(Cl)c1C[N@H+]1CCC=C(c2ccccc2)C1 ZINC001181673554 1049503714 /nfs/dbraw/zinc/50/37/14/1049503714.db2.gz MAWHNOMVWZJMRA-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)o1 ZINC000780396456 1049506503 /nfs/dbraw/zinc/50/65/03/1049506503.db2.gz CVVYZVCCNKOEFB-LPQFERQCSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)o1 ZINC000780396456 1049506520 /nfs/dbraw/zinc/50/65/20/1049506520.db2.gz CVVYZVCCNKOEFB-LPQFERQCSA-N 1 2 311.429 4.045 20 0 DIADLO COc1ccccc1Cn1nc(C)cc1Nc1ccc(C)[nH+]c1C ZINC001203367665 1049509064 /nfs/dbraw/zinc/50/90/64/1049509064.db2.gz NTWFTOZIHBIZOF-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO CC[C@@H]1C[NH+](Cc2nc(-c3ccccc3)cs2)C[C@@H](CC)O1 ZINC001195299183 1049513643 /nfs/dbraw/zinc/51/36/43/1049513643.db2.gz LYLOFGZMUKRXKH-HZPDHXFCSA-N 1 2 316.470 4.200 20 0 DIADLO FC(F)(F)c1sccc1C[N@@H+]1CCOCC12CCCCC2 ZINC001181786452 1049519382 /nfs/dbraw/zinc/51/93/82/1049519382.db2.gz MXQIHRUEZJLGBX-UHFFFAOYSA-N 1 2 319.392 4.302 20 0 DIADLO FC(F)(F)c1sccc1C[N@H+]1CCOCC12CCCCC2 ZINC001181786452 1049519398 /nfs/dbraw/zinc/51/93/98/1049519398.db2.gz MXQIHRUEZJLGBX-UHFFFAOYSA-N 1 2 319.392 4.302 20 0 DIADLO Fc1cc(C[NH2+]Cc2ccc(-c3ccco3)cc2F)c(F)cn1 ZINC001205643202 1049520785 /nfs/dbraw/zinc/52/07/85/1049520785.db2.gz WHLRRSRBMOLVBN-UHFFFAOYSA-N 1 2 318.298 4.049 20 0 DIADLO C[C@H]1COC(C)(C)C[N@@H+]1CCCc1c(Cl)cccc1Cl ZINC001205656010 1049522086 /nfs/dbraw/zinc/52/20/86/1049522086.db2.gz JCWLBGRONNQOAA-LBPRGKRZSA-N 1 2 316.272 4.425 20 0 DIADLO C[C@H]1COC(C)(C)C[N@H+]1CCCc1c(Cl)cccc1Cl ZINC001205656010 1049522100 /nfs/dbraw/zinc/52/21/00/1049522100.db2.gz JCWLBGRONNQOAA-LBPRGKRZSA-N 1 2 316.272 4.425 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2CCO[C@](C)(c3ccc(F)cc3)C2)c1 ZINC001205655726 1049522416 /nfs/dbraw/zinc/52/24/16/1049522416.db2.gz ZDPSCODKKGINJK-IBGZPJMESA-N 1 2 317.379 4.021 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2CCO[C@](C)(c3ccc(F)cc3)C2)c1 ZINC001205655726 1049522424 /nfs/dbraw/zinc/52/24/24/1049522424.db2.gz ZDPSCODKKGINJK-IBGZPJMESA-N 1 2 317.379 4.021 20 0 DIADLO CCOc1c(Cl)cccc1C[NH2+]Cc1csc(CC)n1 ZINC000487280111 1049542435 /nfs/dbraw/zinc/54/24/35/1049542435.db2.gz PVZPHIIWUBXARH-UHFFFAOYSA-N 1 2 310.850 4.047 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[N@H+](C)Cc1ccns1 ZINC001195730439 1049557624 /nfs/dbraw/zinc/55/76/24/1049557624.db2.gz ZAIQLCIXHDHDGU-AWEZNQCLSA-N 1 2 322.861 4.315 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[N@@H+](C)Cc1ccns1 ZINC001195730439 1049557638 /nfs/dbraw/zinc/55/76/38/1049557638.db2.gz ZAIQLCIXHDHDGU-AWEZNQCLSA-N 1 2 322.861 4.315 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Br)cc(C(F)(F)F)c2)[C@H]1C ZINC001182061278 1049565604 /nfs/dbraw/zinc/56/56/04/1049565604.db2.gz CYWVEYJAWSENAG-BDAKNGLRSA-N 1 2 322.168 4.308 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Br)cc(C(F)(F)F)c2)[C@H]1C ZINC001182061278 1049565615 /nfs/dbraw/zinc/56/56/15/1049565615.db2.gz CYWVEYJAWSENAG-BDAKNGLRSA-N 1 2 322.168 4.308 20 0 DIADLO CCCCC[C@H](CC)C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000775670565 1049568138 /nfs/dbraw/zinc/56/81/38/1049568138.db2.gz MNJWYXFZMCKCQA-JKSUJKDBSA-N 1 2 307.482 4.021 20 0 DIADLO CCc1cc(-c2ccc(-n3c[nH+]c(C)c3C)nn2)ccc1Cl ZINC001205799884 1049568119 /nfs/dbraw/zinc/56/81/19/1049568119.db2.gz DMFZTTHLXHSXGV-UHFFFAOYSA-N 1 2 312.804 4.162 20 0 DIADLO CCCCC[C@@H](CC)C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000775670562 1049568399 /nfs/dbraw/zinc/56/83/99/1049568399.db2.gz MNJWYXFZMCKCQA-CVEARBPZSA-N 1 2 307.482 4.021 20 0 DIADLO COc1nscc1C[N@H+](C)Cc1oc2c(cccc2C)c1C ZINC001195791149 1049570515 /nfs/dbraw/zinc/57/05/15/1049570515.db2.gz XPODTVXGZVXNOS-UHFFFAOYSA-N 1 2 316.426 4.147 20 0 DIADLO COc1nscc1C[N@@H+](C)Cc1oc2c(cccc2C)c1C ZINC001195791149 1049570529 /nfs/dbraw/zinc/57/05/29/1049570529.db2.gz XPODTVXGZVXNOS-UHFFFAOYSA-N 1 2 316.426 4.147 20 0 DIADLO [NH3+][C@@H](c1nc(-c2ccc(Cl)cc2)no1)c1cccc(Cl)c1 ZINC001205812238 1049571190 /nfs/dbraw/zinc/57/11/90/1049571190.db2.gz NXQYHRNHFHSKOK-CYBMUJFWSA-N 1 2 320.179 4.092 20 0 DIADLO Cc1ncc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000339059128 1049572414 /nfs/dbraw/zinc/57/24/14/1049572414.db2.gz NBTKCFKVVCNNPL-SNVBAGLBSA-N 1 2 310.228 4.285 20 0 DIADLO Cc1ncc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000339059128 1049572424 /nfs/dbraw/zinc/57/24/24/1049572424.db2.gz NBTKCFKVVCNNPL-SNVBAGLBSA-N 1 2 310.228 4.285 20 0 DIADLO CCOc1c(F)c(F)ccc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001205817204 1049572523 /nfs/dbraw/zinc/57/25/23/1049572523.db2.gz KWUOXPXGTNLLQE-UHFFFAOYSA-N 1 2 314.335 4.431 20 0 DIADLO COc1cc(-c2ccccc2)ccc1C[NH+]1CC(C(F)(F)F)C1 ZINC001205859317 1049583690 /nfs/dbraw/zinc/58/36/90/1049583690.db2.gz HJDIJGYWUNTUHK-UHFFFAOYSA-N 1 2 321.342 4.356 20 0 DIADLO CCC[C@@H](C)CCC[N@H+](C)[C@H](C(=O)OC)c1cccc(OC)c1 ZINC001195883666 1049585589 /nfs/dbraw/zinc/58/55/89/1049585589.db2.gz JGACOMMGDLYUGB-QAPCUYQASA-N 1 2 321.461 4.058 20 0 DIADLO CCC[C@@H](C)CCC[N@@H+](C)[C@H](C(=O)OC)c1cccc(OC)c1 ZINC001195883666 1049585605 /nfs/dbraw/zinc/58/56/05/1049585605.db2.gz JGACOMMGDLYUGB-QAPCUYQASA-N 1 2 321.461 4.058 20 0 DIADLO COC(C)(C)c1ccc(-c2cccc(Cn3cc[nH+]c3)c2)cc1 ZINC000863690605 1049587923 /nfs/dbraw/zinc/58/79/23/1049587923.db2.gz RLKGWCJVEXBBBZ-UHFFFAOYSA-N 1 2 306.409 4.480 20 0 DIADLO Cc1ccc(Nc2cnc(Br)c(Cl)c2)c(C)[nH+]1 ZINC001203370677 1049587996 /nfs/dbraw/zinc/58/79/96/1049587996.db2.gz SBOWZXVZCQXJAX-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1cc(C)c(Nc2cc(Cl)c3c(c2)CCC(=O)N3C)c[nH+]1 ZINC001205895042 1049594854 /nfs/dbraw/zinc/59/48/54/1049594854.db2.gz QZPJPGVLEJDFHD-UHFFFAOYSA-N 1 2 315.804 4.004 20 0 DIADLO C[C@@H](Cc1cccc(F)c1)[N@H+](C)Cc1c(Cl)ccnc1F ZINC001182273019 1049599618 /nfs/dbraw/zinc/59/96/18/1049599618.db2.gz YZJJRVUDPRUNAU-NSHDSACASA-N 1 2 310.775 4.076 20 0 DIADLO C[C@@H](Cc1cccc(F)c1)[N@@H+](C)Cc1c(Cl)ccnc1F ZINC001182273019 1049599627 /nfs/dbraw/zinc/59/96/27/1049599627.db2.gz YZJJRVUDPRUNAU-NSHDSACASA-N 1 2 310.775 4.076 20 0 DIADLO C[C@]1(C2CC2)C[N@H+](CCc2cc(Cl)cc(Cl)c2)CCO1 ZINC001196055335 1049606580 /nfs/dbraw/zinc/60/65/80/1049606580.db2.gz BBCWJKUNVLNHFG-MRXNPFEDSA-N 1 2 314.256 4.037 20 0 DIADLO C[C@]1(C2CC2)C[N@@H+](CCc2cc(Cl)cc(Cl)c2)CCO1 ZINC001196055335 1049606584 /nfs/dbraw/zinc/60/65/84/1049606584.db2.gz BBCWJKUNVLNHFG-MRXNPFEDSA-N 1 2 314.256 4.037 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)cn1 ZINC001205931663 1049606606 /nfs/dbraw/zinc/60/66/06/1049606606.db2.gz GZQJUOVTOYFMKB-LJQANCHMSA-N 1 2 309.457 4.258 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)cn1 ZINC001205931663 1049606615 /nfs/dbraw/zinc/60/66/15/1049606615.db2.gz GZQJUOVTOYFMKB-LJQANCHMSA-N 1 2 309.457 4.258 20 0 DIADLO COc1cccc2c1OCCC[C@H]2Nc1ccc([NH+](C)C)cc1 ZINC000863986064 1049609304 /nfs/dbraw/zinc/60/93/04/1049609304.db2.gz XKRAOGHIUVMENC-QGZVFWFLSA-N 1 2 312.413 4.087 20 0 DIADLO Cc1c[nH]c2ncc(Nc3ccc[nH+]c3N3CCCCC3)cc12 ZINC001206020388 1049631025 /nfs/dbraw/zinc/63/10/25/1049631025.db2.gz IDCBTYHGBHFLKY-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO Cc1c[nH]c2ncc(Nc3[nH+]cccc3N3CCCCC3)cc12 ZINC001206033505 1049635450 /nfs/dbraw/zinc/63/54/50/1049635450.db2.gz QTZXHFSAXSMYQO-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO Fc1ccc2cc(C[N@@H+]3CCCC[C@@H]3c3nccs3)[nH]c2c1 ZINC000488322546 1049636980 /nfs/dbraw/zinc/63/69/80/1049636980.db2.gz ABEUWYVSSUEZAU-MRXNPFEDSA-N 1 2 315.417 4.491 20 0 DIADLO Fc1ccc2cc(C[N@H+]3CCCC[C@@H]3c3nccs3)[nH]c2c1 ZINC000488322546 1049636987 /nfs/dbraw/zinc/63/69/87/1049636987.db2.gz ABEUWYVSSUEZAU-MRXNPFEDSA-N 1 2 315.417 4.491 20 0 DIADLO Fc1cc(C[N@@H+]2CCCc3occc3C2)cc(C(F)(F)F)c1 ZINC001206078855 1049649344 /nfs/dbraw/zinc/64/93/44/1049649344.db2.gz ZXWBSVYSCNQOIC-UHFFFAOYSA-N 1 2 313.294 4.386 20 0 DIADLO Fc1cc(C[N@H+]2CCCc3occc3C2)cc(C(F)(F)F)c1 ZINC001206078855 1049649346 /nfs/dbraw/zinc/64/93/46/1049649346.db2.gz ZXWBSVYSCNQOIC-UHFFFAOYSA-N 1 2 313.294 4.386 20 0 DIADLO Cc1[nH+]c2c(NC(=S)Nc3cccc(C)c3C)cccn2c1C ZINC001196395002 1049649521 /nfs/dbraw/zinc/64/95/21/1049649521.db2.gz SCCDSWCTHVVKAM-UHFFFAOYSA-N 1 2 324.453 4.377 20 0 DIADLO CCSc1nn(C[N@H+](C)[C@H]2CCC(C)(C)C2)c(=S)s1 ZINC000794683406 1049654178 /nfs/dbraw/zinc/65/41/78/1049654178.db2.gz FABNPVHBEUBJPQ-JTQLQIEISA-N 1 2 317.549 4.254 20 0 DIADLO CCSc1nn(C[N@@H+](C)[C@H]2CCC(C)(C)C2)c(=S)s1 ZINC000794683406 1049654181 /nfs/dbraw/zinc/65/41/81/1049654181.db2.gz FABNPVHBEUBJPQ-JTQLQIEISA-N 1 2 317.549 4.254 20 0 DIADLO CC(C)n1c[nH+]cc1CN1C[C@@H](C)CSc2ccccc21 ZINC001206099077 1049653552 /nfs/dbraw/zinc/65/35/52/1049653552.db2.gz LDYNLGCXKYDUEJ-CQSZACIVSA-N 1 2 301.459 4.212 20 0 DIADLO Cc1cccc(NC(=S)Nc2cccc(-n3cc[nH+]c3)c2)c1C ZINC001196414922 1049655221 /nfs/dbraw/zinc/65/52/21/1049655221.db2.gz VAJZCRNRLBOPEB-UHFFFAOYSA-N 1 2 322.437 4.298 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2cc3ccccc3o2)[nH]1 ZINC000488469730 1049661678 /nfs/dbraw/zinc/66/16/78/1049661678.db2.gz ZMNJVVGCRJXJFM-YNEHKIRRSA-N 1 2 312.417 4.476 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cc(F)cc(N3CCCC3)c2)cc1 ZINC001206130643 1049662299 /nfs/dbraw/zinc/66/22/99/1049662299.db2.gz QGSGIQQMTAACLO-UHFFFAOYSA-N 1 2 321.399 4.493 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(C(F)(F)F)c2)CN1c1cccc[nH+]1 ZINC000488490591 1049663482 /nfs/dbraw/zinc/66/34/82/1049663482.db2.gz QXZXHSZQOOJUMX-IUODEOHRSA-N 1 2 322.330 4.067 20 0 DIADLO Cc1cccc(C[C@@]2(C)CCC[N@@H+]2CC(F)(F)C(F)F)c1 ZINC001196594930 1049672573 /nfs/dbraw/zinc/67/25/73/1049672573.db2.gz QAKGJZLVRUZZBS-OAHLLOKOSA-N 1 2 303.343 4.292 20 0 DIADLO Cc1cccc(C[C@@]2(C)CCC[N@H+]2CC(F)(F)C(F)F)c1 ZINC001196594930 1049672577 /nfs/dbraw/zinc/67/25/77/1049672577.db2.gz QAKGJZLVRUZZBS-OAHLLOKOSA-N 1 2 303.343 4.292 20 0 DIADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2cc3ccc(F)cc3[nH]2)cs1 ZINC000488554961 1049673861 /nfs/dbraw/zinc/67/38/61/1049673861.db2.gz GWLVZGRCXQSXPL-KRWDZBQOSA-N 1 2 315.417 4.409 20 0 DIADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2cc3ccc(F)cc3[nH]2)cs1 ZINC000488554961 1049673867 /nfs/dbraw/zinc/67/38/67/1049673867.db2.gz GWLVZGRCXQSXPL-KRWDZBQOSA-N 1 2 315.417 4.409 20 0 DIADLO COc1ccc(/C=C/c2ccc(C)cc2)cc1C[NH+]1CCOCC1 ZINC001206176811 1049675861 /nfs/dbraw/zinc/67/58/61/1049675861.db2.gz PYCZCDIVCHIEMA-BQYQJAHWSA-N 1 2 323.436 4.006 20 0 DIADLO F[C@@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1cncc(Cl)c1Cl ZINC001182499930 1049679637 /nfs/dbraw/zinc/67/96/37/1049679637.db2.gz REQAHDDEBLJTSK-DZGCQCFKSA-N 1 2 311.187 4.115 20 0 DIADLO COc1nsc(C[N@@H+]2CCc3ccccc3C2(C)C)c1Cl ZINC001182508301 1049681101 /nfs/dbraw/zinc/68/11/01/1049681101.db2.gz KNQCTMQMPSIPRO-UHFFFAOYSA-N 1 2 322.861 4.099 20 0 DIADLO COc1nsc(C[N@H+]2CCc3ccccc3C2(C)C)c1Cl ZINC001182508301 1049681104 /nfs/dbraw/zinc/68/11/04/1049681104.db2.gz KNQCTMQMPSIPRO-UHFFFAOYSA-N 1 2 322.861 4.099 20 0 DIADLO NC(Cc1cccc(F)c1)=[NH+]OCc1cccc(C(F)F)c1 ZINC000794727717 1049681558 /nfs/dbraw/zinc/68/15/58/1049681558.db2.gz XLNJNMRQPXEBOP-UHFFFAOYSA-N 1 2 308.303 4.004 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(Cl)c(C)c3F)nn2)c1C ZINC001206271874 1049697048 /nfs/dbraw/zinc/69/70/48/1049697048.db2.gz GCYWWKGAPJTAJX-UHFFFAOYSA-N 1 2 316.767 4.047 20 0 DIADLO CCCc1nc(C[N@H+](C)[C@H](c2ccccc2C)C(C)C)no1 ZINC000488807070 1049697853 /nfs/dbraw/zinc/69/78/53/1049697853.db2.gz QGFRITNGXRNHDP-SFHVURJKSA-N 1 2 301.434 4.160 20 0 DIADLO CCCc1nc(C[N@@H+](C)[C@H](c2ccccc2C)C(C)C)no1 ZINC000488807070 1049697860 /nfs/dbraw/zinc/69/78/60/1049697860.db2.gz QGFRITNGXRNHDP-SFHVURJKSA-N 1 2 301.434 4.160 20 0 DIADLO CC[N@H+](Cc1occc1C)Cc1nc2ccc(Cl)cc2n1C ZINC001206319838 1049711486 /nfs/dbraw/zinc/71/14/86/1049711486.db2.gz DWXZNRIMBAUYID-UHFFFAOYSA-N 1 2 317.820 4.150 20 0 DIADLO CC[N@@H+](Cc1occc1C)Cc1nc2ccc(Cl)cc2n1C ZINC001206319838 1049711497 /nfs/dbraw/zinc/71/14/97/1049711497.db2.gz DWXZNRIMBAUYID-UHFFFAOYSA-N 1 2 317.820 4.150 20 0 DIADLO COc1cc(C[N@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)on1 ZINC000659859993 1049711654 /nfs/dbraw/zinc/71/16/54/1049711654.db2.gz RJBMQHGTSNOAJM-SECBINFHSA-N 1 2 315.200 4.183 20 0 DIADLO COc1cc(C[N@@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)on1 ZINC000659859993 1049711668 /nfs/dbraw/zinc/71/16/68/1049711668.db2.gz RJBMQHGTSNOAJM-SECBINFHSA-N 1 2 315.200 4.183 20 0 DIADLO CCC(CC)n1ccc(C[NH2+]C2(c3ccccc3OC)CC2)n1 ZINC000646001284 1049736337 /nfs/dbraw/zinc/73/63/37/1049736337.db2.gz SFICIIIHBXOFRJ-UHFFFAOYSA-N 1 2 313.445 4.032 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCCC[C@@H]1c1ncccn1 ZINC001197448562 1049749848 /nfs/dbraw/zinc/74/98/48/1049749848.db2.gz BWVSSQHBCVDJDX-GOSISDBHSA-N 1 2 310.445 4.031 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCCC[C@@H]1c1ncccn1 ZINC001197448562 1049749856 /nfs/dbraw/zinc/74/98/56/1049749856.db2.gz BWVSSQHBCVDJDX-GOSISDBHSA-N 1 2 310.445 4.031 20 0 DIADLO COc1nccc(C[N@@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)c1F ZINC001206537641 1049750949 /nfs/dbraw/zinc/75/09/49/1049750949.db2.gz LKUOBOBJJRAZBA-SFHVURJKSA-N 1 2 324.399 4.123 20 0 DIADLO COc1nccc(C[N@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)c1F ZINC001206537641 1049750956 /nfs/dbraw/zinc/75/09/56/1049750956.db2.gz LKUOBOBJJRAZBA-SFHVURJKSA-N 1 2 324.399 4.123 20 0 DIADLO Clc1ccc(/C=C/C[N@@H+]2CCCC[C@H]2c2ncccn2)cc1 ZINC001197450777 1049752882 /nfs/dbraw/zinc/75/28/82/1049752882.db2.gz SLJQXAWFFIOCPL-RCFWFJCLSA-N 1 2 313.832 4.370 20 0 DIADLO Clc1ccc(/C=C/C[N@H+]2CCCC[C@H]2c2ncccn2)cc1 ZINC001197450777 1049752884 /nfs/dbraw/zinc/75/28/84/1049752884.db2.gz SLJQXAWFFIOCPL-RCFWFJCLSA-N 1 2 313.832 4.370 20 0 DIADLO CC(C)[C@@H]1C[C@@H]([NH2+]CC(F)(F)c2cccc(F)c2)CS1 ZINC001206591875 1049764546 /nfs/dbraw/zinc/76/45/46/1049764546.db2.gz WFNGISLVXRHUOH-KGLIPLIRSA-N 1 2 303.393 4.037 20 0 DIADLO Cc1ccc(-c2ccc(C[NH+]3CCOCC3)cc2F)c2[nH]ccc21 ZINC001206720041 1049782982 /nfs/dbraw/zinc/78/29/82/1049782982.db2.gz VNZMJURJTBOXOV-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Fc1cc(CNc2ccc(Nc3ccccc3)c[nH+]2)c(F)cn1 ZINC001206727498 1049785649 /nfs/dbraw/zinc/78/56/49/1049785649.db2.gz JANZHZJVICMGJG-UHFFFAOYSA-N 1 2 312.323 4.111 20 0 DIADLO CCc1cccc(C)c1-c1ccc(C[NH+]2CCOCC2)cc1F ZINC001206733900 1049786164 /nfs/dbraw/zinc/78/61/64/1049786164.db2.gz HJJASIFBQSXGLN-UHFFFAOYSA-N 1 2 313.416 4.196 20 0 DIADLO S=c1sc(NC2CCCCC2)nn1C[NH+]1C2CCC1CC2 ZINC000912788729 1049793156 /nfs/dbraw/zinc/79/31/56/1049793156.db2.gz LWTYJQUWBLXYAY-UHFFFAOYSA-N 1 2 324.519 4.003 20 0 DIADLO CC(C)c1cc(N2CCC[C@@H](OCC3CC3)C2)nc(C(C)C)[nH+]1 ZINC000489945837 1049793709 /nfs/dbraw/zinc/79/37/09/1049793709.db2.gz KEAZAFHTYATOQT-MRXNPFEDSA-N 1 2 317.477 4.119 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccc(F)cn1 ZINC000490145957 1049803781 /nfs/dbraw/zinc/80/37/81/1049803781.db2.gz XHTIBDVINGWNRH-MRXNPFEDSA-N 1 2 311.360 4.117 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)no1 ZINC001206819899 1049806396 /nfs/dbraw/zinc/80/63/96/1049806396.db2.gz UDFYFBUOZCRDSV-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(Oc3ccccc3)cc2)no1 ZINC001206819899 1049806399 /nfs/dbraw/zinc/80/63/99/1049806399.db2.gz UDFYFBUOZCRDSV-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO c1csc(-c2ccc(C[N@@H+]3CCCc4[nH]ncc4C3)cc2)c1 ZINC001206826814 1049807318 /nfs/dbraw/zinc/80/73/18/1049807318.db2.gz FAWACOPIYJDYKQ-UHFFFAOYSA-N 1 2 309.438 4.087 20 0 DIADLO c1csc(-c2ccc(C[N@H+]3CCCc4[nH]ncc4C3)cc2)c1 ZINC001206826814 1049807324 /nfs/dbraw/zinc/80/73/24/1049807324.db2.gz FAWACOPIYJDYKQ-UHFFFAOYSA-N 1 2 309.438 4.087 20 0 DIADLO C[N@H+](Cc1cc(-c2ccc(F)cc2)on1)Cc1ccc(F)cc1 ZINC001206834851 1049810440 /nfs/dbraw/zinc/81/04/40/1049810440.db2.gz QFRIWQTYXMGHLE-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccc(F)cc2)on1)Cc1ccc(F)cc1 ZINC001206834851 1049810452 /nfs/dbraw/zinc/81/04/52/1049810452.db2.gz QFRIWQTYXMGHLE-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO Fc1cncc(F)c1C[N@@H+]1CC[C@H](c2ccccc2Cl)C1 ZINC001206860662 1049814728 /nfs/dbraw/zinc/81/47/28/1049814728.db2.gz JADTUIUCCBYTSN-NSHDSACASA-N 1 2 308.759 4.003 20 0 DIADLO Fc1cncc(F)c1C[N@H+]1CC[C@H](c2ccccc2Cl)C1 ZINC001206860662 1049814737 /nfs/dbraw/zinc/81/47/37/1049814737.db2.gz JADTUIUCCBYTSN-NSHDSACASA-N 1 2 308.759 4.003 20 0 DIADLO Fc1cccc(OC(F)F)c1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC001207113342 1049837023 /nfs/dbraw/zinc/83/70/23/1049837023.db2.gz ZFKTWQWSNSYFKP-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(OC(F)F)c1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC001207113342 1049837047 /nfs/dbraw/zinc/83/70/47/1049837047.db2.gz ZFKTWQWSNSYFKP-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(OC(F)F)c1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC001207112927 1049837642 /nfs/dbraw/zinc/83/76/42/1049837642.db2.gz UZPYISUAPGDGOP-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(OC(F)F)c1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC001207112927 1049837654 /nfs/dbraw/zinc/83/76/54/1049837654.db2.gz UZPYISUAPGDGOP-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Cc1noc(C)c1C[N@@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001207139759 1049842819 /nfs/dbraw/zinc/84/28/19/1049842819.db2.gz LCZKLDYWDNEACV-MRXNPFEDSA-N 1 2 322.861 4.235 20 0 DIADLO Cc1noc(C)c1C[N@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001207139759 1049842826 /nfs/dbraw/zinc/84/28/26/1049842826.db2.gz LCZKLDYWDNEACV-MRXNPFEDSA-N 1 2 322.861 4.235 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001207176798 1049849679 /nfs/dbraw/zinc/84/96/79/1049849679.db2.gz KEEUGGASWBWNAR-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001207176798 1049849699 /nfs/dbraw/zinc/84/96/99/1049849699.db2.gz KEEUGGASWBWNAR-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001207173261 1049850980 /nfs/dbraw/zinc/85/09/80/1049850980.db2.gz MKPVPPXTZOKBNW-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001207173261 1049850993 /nfs/dbraw/zinc/85/09/93/1049850993.db2.gz MKPVPPXTZOKBNW-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1coc(-c2ccc(C)cc2)n1 ZINC000586768207 1049895231 /nfs/dbraw/zinc/89/52/31/1049895231.db2.gz AZLJELIJQLSKTE-UHFFFAOYSA-N 1 2 312.335 4.424 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1coc(-c2ccc(C)cc2)n1 ZINC000586768207 1049895246 /nfs/dbraw/zinc/89/52/46/1049895246.db2.gz AZLJELIJQLSKTE-UHFFFAOYSA-N 1 2 312.335 4.424 20 0 DIADLO CC[N@@H+]1CCN(CC(c2ccccc2)c2ccccc2)C(C)(C)C1 ZINC001207527534 1049905654 /nfs/dbraw/zinc/90/56/54/1049905654.db2.gz GYIKKUNDDHAISY-UHFFFAOYSA-N 1 2 322.496 4.235 20 0 DIADLO CC[N@H+]1CCN(CC(c2ccccc2)c2ccccc2)C(C)(C)C1 ZINC001207527534 1049905661 /nfs/dbraw/zinc/90/56/61/1049905661.db2.gz GYIKKUNDDHAISY-UHFFFAOYSA-N 1 2 322.496 4.235 20 0 DIADLO CO[C@@H]1CCC[C@@H]([NH2+][C@@H](c2cccc(Cl)c2)C(F)F)C1 ZINC001207553302 1049907828 /nfs/dbraw/zinc/90/78/28/1049907828.db2.gz IYEATWUDYGYIEE-MCIONIFRSA-N 1 2 303.780 4.193 20 0 DIADLO COC(=O)[C@H]([NH2+]C1CCC2(CC2)CC1)c1cccc2ccccc21 ZINC001207564082 1049910047 /nfs/dbraw/zinc/91/00/47/1049910047.db2.gz JQNJARGCEQJXNO-LJQANCHMSA-N 1 2 323.436 4.366 20 0 DIADLO COC(=O)[C@@H]([NH2+]C1CCC2(CC2)CC1)c1cccc2ccccc21 ZINC001207564080 1049910707 /nfs/dbraw/zinc/91/07/07/1049910707.db2.gz JQNJARGCEQJXNO-IBGZPJMESA-N 1 2 323.436 4.366 20 0 DIADLO CCCCCC[N@H+](Cc1ccco1)Cc1cn(C)nc1Cl ZINC001207748384 1049933986 /nfs/dbraw/zinc/93/39/86/1049933986.db2.gz IPHCOUAJONXTRG-UHFFFAOYSA-N 1 2 309.841 4.249 20 0 DIADLO CCCCCC[N@@H+](Cc1ccco1)Cc1cn(C)nc1Cl ZINC001207748384 1049933994 /nfs/dbraw/zinc/93/39/94/1049933994.db2.gz IPHCOUAJONXTRG-UHFFFAOYSA-N 1 2 309.841 4.249 20 0 DIADLO CCCC[C@H](CCC)CNC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001207824975 1049941278 /nfs/dbraw/zinc/94/12/78/1049941278.db2.gz GRNGADSMZWZKCQ-AWEZNQCLSA-N 1 2 302.422 4.062 20 0 DIADLO CC(C)(C)[C@H]1CC[N@H+](Cc2c(F)ccc(F)c2Cl)CCO1 ZINC001207835311 1049943668 /nfs/dbraw/zinc/94/36/68/1049943668.db2.gz AQPLXUQVHOVKLF-CQSZACIVSA-N 1 2 317.807 4.255 20 0 DIADLO CC(C)(C)[C@H]1CC[N@@H+](Cc2c(F)ccc(F)c2Cl)CCO1 ZINC001207835311 1049943671 /nfs/dbraw/zinc/94/36/71/1049943671.db2.gz AQPLXUQVHOVKLF-CQSZACIVSA-N 1 2 317.807 4.255 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2OC(F)F)o1 ZINC000588803658 1050002459 /nfs/dbraw/zinc/00/24/59/1050002459.db2.gz DNICABYBOQMQNV-UHFFFAOYSA-N 1 2 315.747 4.475 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cc(Cl)ccc2OC(F)F)o1 ZINC000588803658 1050002464 /nfs/dbraw/zinc/00/24/64/1050002464.db2.gz DNICABYBOQMQNV-UHFFFAOYSA-N 1 2 315.747 4.475 20 0 DIADLO Cc1cn2cc(NC(=O)c3oc4c(cccc4C)c3C)ccc2[nH+]1 ZINC000588858168 1050006113 /nfs/dbraw/zinc/00/61/13/1050006113.db2.gz QMRXGAFNVVJPJS-UHFFFAOYSA-N 1 2 319.364 4.258 20 0 DIADLO CCCc1cc(C(=O)Nc2ccc3[nH+]c(C)cn3c2)sc1C ZINC000588859068 1050006679 /nfs/dbraw/zinc/00/66/79/1050006679.db2.gz GBWCPYDFISOYTO-UHFFFAOYSA-N 1 2 313.426 4.217 20 0 DIADLO CC(C)c1nc2ccc(Nc3[nH+]cnc4[nH]ccc43)cc2s1 ZINC000588896702 1050011250 /nfs/dbraw/zinc/01/12/50/1050011250.db2.gz UTXCBCFYOSHEOF-UHFFFAOYSA-N 1 2 309.398 4.435 20 0 DIADLO C[C@H]1CC[N@H+](CCCCCOCc2ccccc2)CC1(F)F ZINC001208811152 1050011553 /nfs/dbraw/zinc/01/15/53/1050011553.db2.gz JFCKIQNTDQXUQQ-INIZCTEOSA-N 1 2 311.416 4.351 20 0 DIADLO C[C@H]1CC[N@@H+](CCCCCOCc2ccccc2)CC1(F)F ZINC001208811152 1050011556 /nfs/dbraw/zinc/01/15/56/1050011556.db2.gz JFCKIQNTDQXUQQ-INIZCTEOSA-N 1 2 311.416 4.351 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1C[N@@H+](C)Cc1cc(C)ccc1F ZINC000572538467 1050035675 /nfs/dbraw/zinc/03/56/75/1050035675.db2.gz ZRYKBGJFQYDWAM-UHFFFAOYSA-N 1 2 317.452 4.334 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1C[N@H+](C)Cc1cc(C)ccc1F ZINC000572538467 1050035677 /nfs/dbraw/zinc/03/56/77/1050035677.db2.gz ZRYKBGJFQYDWAM-UHFFFAOYSA-N 1 2 317.452 4.334 20 0 DIADLO Cc1nc([C@@H]([NH2+]C[C@H](C)CC(C)C)c2ccc(Cl)cc2)no1 ZINC000572646786 1050039306 /nfs/dbraw/zinc/03/93/06/1050039306.db2.gz KSEZENFXDUQZPW-WBMJQRKESA-N 1 2 321.852 4.393 20 0 DIADLO Nc1cc2c(ccn2-c2cc[nH+]cc2Cl)c(Br)c1 ZINC001212160193 1050047811 /nfs/dbraw/zinc/04/78/11/1050047811.db2.gz MHJZAFYZCORDEZ-UHFFFAOYSA-N 1 2 322.593 4.024 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](Cc3ccccc3)CCO2)cc1Cl ZINC000589598631 1050050189 /nfs/dbraw/zinc/05/01/89/1050050189.db2.gz TZNRBFRIZOSOKQ-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](Cc3ccccc3)CCO2)cc1Cl ZINC000589598631 1050050196 /nfs/dbraw/zinc/05/01/96/1050050196.db2.gz TZNRBFRIZOSOKQ-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](Cc3ccccc3)CCO2)cc1Cl ZINC000589598630 1050050524 /nfs/dbraw/zinc/05/05/24/1050050524.db2.gz TZNRBFRIZOSOKQ-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](Cc3ccccc3)CCO2)cc1Cl ZINC000589598630 1050050530 /nfs/dbraw/zinc/05/05/30/1050050530.db2.gz TZNRBFRIZOSOKQ-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccc(F)c(Br)c2)cc1 ZINC000057611227 1050102986 /nfs/dbraw/zinc/10/29/86/1050102986.db2.gz IFTSLYUBIJGWSJ-UHFFFAOYSA-N 1 2 323.209 4.266 20 0 DIADLO COc1c(C)c[nH+]c(CN(Cc2cccc(F)c2)C(C)C)c1C ZINC000589706027 1050056108 /nfs/dbraw/zinc/05/61/08/1050056108.db2.gz PPYBGLZJGFBHSG-UHFFFAOYSA-N 1 2 316.420 4.257 20 0 DIADLO CCCn1c(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)nc2ccccc21 ZINC000589833994 1050059905 /nfs/dbraw/zinc/05/99/05/1050059905.db2.gz NBZLZGBDOROTLQ-HOCLYGCPSA-N 1 2 323.440 4.453 20 0 DIADLO Cc1ccccc1O[C@@H]1CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC001209470612 1050061385 /nfs/dbraw/zinc/06/13/85/1050061385.db2.gz LLDFHAHEZUJMEL-CYBMUJFWSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1ccccc1O[C@@H]1CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC001209470612 1050061391 /nfs/dbraw/zinc/06/13/91/1050061391.db2.gz LLDFHAHEZUJMEL-CYBMUJFWSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1cccc(OC2CC[NH+](Cc3cnc(Cl)s3)CC2)c1 ZINC001209472043 1050062405 /nfs/dbraw/zinc/06/24/05/1050062405.db2.gz BXZNVHWPLWUQIK-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO CCc1ccc([C@H](C)C(=O)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC000589942800 1050069327 /nfs/dbraw/zinc/06/93/27/1050069327.db2.gz PIRQPDAJQRFNII-HNNXBMFYSA-N 1 2 319.408 4.177 20 0 DIADLO COc1c(Cl)ccc(C[N@H+](Cc2ccco2)C2CC2)c1F ZINC001209703467 1050078065 /nfs/dbraw/zinc/07/80/65/1050078065.db2.gz YEGKANYUZHTVLI-UHFFFAOYSA-N 1 2 309.768 4.245 20 0 DIADLO COc1c(Cl)ccc(C[N@@H+](Cc2ccco2)C2CC2)c1F ZINC001209703467 1050078069 /nfs/dbraw/zinc/07/80/69/1050078069.db2.gz YEGKANYUZHTVLI-UHFFFAOYSA-N 1 2 309.768 4.245 20 0 DIADLO Clc1ccc2[nH]nc(C[N@H+](Cc3ccccc3)C3CC3)c2c1 ZINC001209757833 1050081544 /nfs/dbraw/zinc/08/15/44/1050081544.db2.gz BRUSRIUYUHILSD-UHFFFAOYSA-N 1 2 311.816 4.381 20 0 DIADLO Clc1ccc2[nH]nc(C[N@@H+](Cc3ccccc3)C3CC3)c2c1 ZINC001209757833 1050081549 /nfs/dbraw/zinc/08/15/49/1050081549.db2.gz BRUSRIUYUHILSD-UHFFFAOYSA-N 1 2 311.816 4.381 20 0 DIADLO c1[nH]c2ccc(Nc3ncccc3OCc3ccccc3)cc2[nH+]1 ZINC001209841421 1050093672 /nfs/dbraw/zinc/09/36/72/1050093672.db2.gz NWMKNXWNDSNECH-UHFFFAOYSA-N 1 2 316.364 4.281 20 0 DIADLO C[NH+](C)c1ccc(NCc2cc(F)ccc2Br)cc1 ZINC000057611282 1050102889 /nfs/dbraw/zinc/10/28/89/1050102889.db2.gz KZXUNZNOYYQLFK-UHFFFAOYSA-N 1 2 323.209 4.266 20 0 DIADLO CCCCOC(=O)Nc1ccc(Nc2c[nH+]ccc2OC)cc1 ZINC001209915941 1050106089 /nfs/dbraw/zinc/10/60/89/1050106089.db2.gz SDOVIXKGWAAASD-UHFFFAOYSA-N 1 2 315.373 4.182 20 0 DIADLO Fc1ccc(Cl)c(Nc2ccccc2C[NH+]2CCOCC2)c1 ZINC001209928543 1050107873 /nfs/dbraw/zinc/10/78/73/1050107873.db2.gz DTHLGWJBUHNLKG-UHFFFAOYSA-N 1 2 320.795 4.055 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(O)c(C(F)(F)F)c2)[nH+]1 ZINC001209983347 1050116156 /nfs/dbraw/zinc/11/61/56/1050116156.db2.gz ALKOYQPFEVSBBE-UHFFFAOYSA-N 1 2 307.275 4.111 20 0 DIADLO COc1ccc([C@@H](Cc2ccccc2)Nc2cc[nH+]c(C)n2)cc1 ZINC000573029943 1050116405 /nfs/dbraw/zinc/11/64/05/1050116405.db2.gz QMXILKRAFFFQPV-LJQANCHMSA-N 1 2 319.408 4.190 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@H+](Cc2ncc(-c3ccccc3)o2)C1 ZINC000573024433 1050116597 /nfs/dbraw/zinc/11/65/97/1050116597.db2.gz JCOZDCNQVBJTQN-HXUWFJFHSA-N 1 2 322.383 4.412 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@@H+](Cc2ncc(-c3ccccc3)o2)C1 ZINC000573024433 1050116599 /nfs/dbraw/zinc/11/65/99/1050116599.db2.gz JCOZDCNQVBJTQN-HXUWFJFHSA-N 1 2 322.383 4.412 20 0 DIADLO Cc1cc(Nc2ccc3c[nH+]ccc3c2)ncc1Br ZINC001210043440 1050127735 /nfs/dbraw/zinc/12/77/35/1050127735.db2.gz DSMKPEUOGCMTQB-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO c1ccc(-c2nnsc2Nc2ccc3c[nH+]ccc3c2)cc1 ZINC001210044819 1050128167 /nfs/dbraw/zinc/12/81/67/1050128167.db2.gz FKQLYPRZAXOOJX-UHFFFAOYSA-N 1 2 304.378 4.497 20 0 DIADLO COc1cc(Nc2ccc3c[nH+]ccc3c2)ncc1C(F)(F)F ZINC001210046940 1050129043 /nfs/dbraw/zinc/12/90/43/1050129043.db2.gz ADBOWONRSSULOY-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO c1cn(Cc2cccc(Nc3ccc4cccnc4c3)c2)c[nH+]1 ZINC001210055241 1050130959 /nfs/dbraw/zinc/13/09/59/1050130959.db2.gz FGPJZANJAMJBLB-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO c1cn(Cc2ccc(Nc3ccc4cccnc4c3)cc2)c[nH+]1 ZINC001210055420 1050131036 /nfs/dbraw/zinc/13/10/36/1050131036.db2.gz JWJNVCCTSHAONM-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO COc1ccc(C)cc1C[N@@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000591381581 1050143930 /nfs/dbraw/zinc/14/39/30/1050143930.db2.gz IBZKNWGCPUNZOC-UHFFFAOYSA-N 1 2 320.436 4.352 20 0 DIADLO COc1ccc(C)cc1C[N@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000591381581 1050143936 /nfs/dbraw/zinc/14/39/36/1050143936.db2.gz IBZKNWGCPUNZOC-UHFFFAOYSA-N 1 2 320.436 4.352 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)n1 ZINC000646117712 1050145076 /nfs/dbraw/zinc/14/50/76/1050145076.db2.gz NGDOZLCQACUTKD-LJQANCHMSA-N 1 2 307.441 4.357 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)n1 ZINC000646117712 1050145079 /nfs/dbraw/zinc/14/50/79/1050145079.db2.gz NGDOZLCQACUTKD-LJQANCHMSA-N 1 2 307.441 4.357 20 0 DIADLO Clc1ccccc1-c1noc(-c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000733739033 1050149258 /nfs/dbraw/zinc/14/92/58/1050149258.db2.gz NSXIAZWMFNBKNI-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@H]2CCCC[C@@H]2C)no1)c1ccccc1 ZINC000573246557 1050153739 /nfs/dbraw/zinc/15/37/39/1050153739.db2.gz QUYLJYZUOIXUAO-BHYGNILZSA-N 1 2 313.445 4.404 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@H]2CCCC[C@@H]2C)no1)c1ccccc1 ZINC000573246557 1050153744 /nfs/dbraw/zinc/15/37/44/1050153744.db2.gz QUYLJYZUOIXUAO-BHYGNILZSA-N 1 2 313.445 4.404 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000805838744 1050154292 /nfs/dbraw/zinc/15/42/92/1050154292.db2.gz GLFFDKGYMPJECL-ZDUSSCGKSA-N 1 2 309.866 4.027 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000805838744 1050154310 /nfs/dbraw/zinc/15/43/10/1050154310.db2.gz GLFFDKGYMPJECL-ZDUSSCGKSA-N 1 2 309.866 4.027 20 0 DIADLO CC/C(C)=C/C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000823770242 1050155136 /nfs/dbraw/zinc/15/51/36/1050155136.db2.gz NTYGFIHEONKCTL-WYMLVPIESA-N 1 2 309.413 4.181 20 0 DIADLO c1sc(Nc2cccc3cc[nH+]cc32)nc1-c1ccncc1 ZINC001210222427 1050162804 /nfs/dbraw/zinc/16/28/04/1050162804.db2.gz HEUKULGZASUUGK-UHFFFAOYSA-N 1 2 304.378 4.497 20 0 DIADLO Fc1cnc(Nc2cccc3cc[nH+]cc32)c(Br)c1 ZINC001210224010 1050165197 /nfs/dbraw/zinc/16/51/97/1050165197.db2.gz NUIQIVJBDXVQST-UHFFFAOYSA-N 1 2 318.149 4.275 20 0 DIADLO Cc1nc(Br)ccc1Nc1cccc2cc[nH+]cc21 ZINC001210223619 1050166067 /nfs/dbraw/zinc/16/60/67/1050166067.db2.gz AGRPSAQWAAZJHU-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO Cc1ccccc1-n1nccc1Nc1cccc2cc[nH+]cc21 ZINC001210225868 1050167993 /nfs/dbraw/zinc/16/79/93/1050167993.db2.gz MPEUTXWHUICFOD-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO Cc1cc(C)c(NC(=O)CCSCc2ccccc2)c(C)[nH+]1 ZINC000348021738 1050168156 /nfs/dbraw/zinc/16/81/56/1050168156.db2.gz WQXRPOAQPZQUOU-UHFFFAOYSA-N 1 2 314.454 4.269 20 0 DIADLO Brc1ncc(Nc2cccc3cc[nH+]cc32)s1 ZINC001210226194 1050168204 /nfs/dbraw/zinc/16/82/04/1050168204.db2.gz SVGSQIMMEJGVHX-UHFFFAOYSA-N 1 2 306.188 4.197 20 0 DIADLO CC(C)c1cc2ncc(Nc3cccc4cc[nH+]cc43)cn2n1 ZINC001210225837 1050168409 /nfs/dbraw/zinc/16/84/09/1050168409.db2.gz LHBLFRUVEIAYGJ-UHFFFAOYSA-N 1 2 303.369 4.145 20 0 DIADLO CO[C@@H]1CCOc2c(Nc3cccc4cc[nH+]cc43)cccc21 ZINC001210232217 1050170438 /nfs/dbraw/zinc/17/04/38/1050170438.db2.gz JFOZSHHRAFIFCX-GOSISDBHSA-N 1 2 306.365 4.448 20 0 DIADLO Fc1cccc(C2CC[NH+](Cc3coc(C4CC4)n3)CC2)c1F ZINC000770663400 1050182577 /nfs/dbraw/zinc/18/25/77/1050182577.db2.gz ASZLCRLZKSZXOD-UHFFFAOYSA-N 1 2 318.367 4.210 20 0 DIADLO Cc1[nH+]cc(Nc2cnc3ccc(C(F)(F)F)cc3c2)cc1N ZINC001210289102 1050191220 /nfs/dbraw/zinc/19/12/20/1050191220.db2.gz UWRWNMAVTUYVDO-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Cc1[nH+]cc(Nc2cnc3c(cccc3C(F)(F)F)c2)cc1N ZINC001210288463 1050191565 /nfs/dbraw/zinc/19/15/65/1050191565.db2.gz JKKGWUHLIIMZRF-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(C(F)(F)F)c(Cl)c2)cc1N ZINC001210288351 1050191819 /nfs/dbraw/zinc/19/18/19/1050191819.db2.gz NMMBLJBZEVHFJM-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Cc1[nH+]cc(Nc2c(Cl)cccc2Br)cc1N ZINC001210287953 1050192056 /nfs/dbraw/zinc/19/20/56/1050192056.db2.gz IPYLQTHIIDRKEP-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO COc1ccc(-c2ccccc2)cc1Nc1c[nH+]c(C)c(N)c1 ZINC001210288630 1050192240 /nfs/dbraw/zinc/19/22/40/1050192240.db2.gz QXVVPXPNUNPXHA-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO CCc1c(Cl)cc(Nc2c[nH+]c(C)c(N)c2)c(O)c1Cl ZINC001210289414 1050192404 /nfs/dbraw/zinc/19/24/04/1050192404.db2.gz KMLZOMWOYFOQEP-UHFFFAOYSA-N 1 2 312.200 4.291 20 0 DIADLO Cc1[nH+]cc(-n2c(-c3ccc(N)cc3)cc3ccccc32)cc1N ZINC001210289426 1050192529 /nfs/dbraw/zinc/19/25/29/1050192529.db2.gz LCFOEUUWWQPUIP-UHFFFAOYSA-N 1 2 314.392 4.165 20 0 DIADLO Cc1[nH+]cc(Nc2cccc(Cl)c2C(F)(F)F)cc1N ZINC001210291102 1050192840 /nfs/dbraw/zinc/19/28/40/1050192840.db2.gz KBHFIBWKOKMQFZ-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(Br)c(F)cc2F)C2(CC2)C1 ZINC001136855818 1050198707 /nfs/dbraw/zinc/19/87/07/1050198707.db2.gz VQDROXQGYSQNGV-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(Br)c(F)cc2F)C2(CC2)C1 ZINC001136855818 1050198713 /nfs/dbraw/zinc/19/87/13/1050198713.db2.gz VQDROXQGYSQNGV-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Br)c(F)cc2F)C2(CC2)C1 ZINC001136855819 1050199396 /nfs/dbraw/zinc/19/93/96/1050199396.db2.gz VQDROXQGYSQNGV-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Br)c(F)cc2F)C2(CC2)C1 ZINC001136855819 1050199400 /nfs/dbraw/zinc/19/94/00/1050199400.db2.gz VQDROXQGYSQNGV-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO FC(F)Oc1ccc(Nc2[nH+]cccc2N2CCCC2)cc1 ZINC001210326400 1050206600 /nfs/dbraw/zinc/20/66/00/1050206600.db2.gz XKRJKSXIBIRTBO-UHFFFAOYSA-N 1 2 305.328 4.027 20 0 DIADLO Cc1ccc[nH+]c1Nc1ccc2c(cnn2[C@@H]2CCCCO2)c1 ZINC001210331829 1050207341 /nfs/dbraw/zinc/20/73/41/1050207341.db2.gz XSHNFGKGTKECKI-KRWDZBQOSA-N 1 2 308.385 4.182 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)[C@@H](C)CC2CCCC2)n1 ZINC000733952192 1050208036 /nfs/dbraw/zinc/20/80/36/1050208036.db2.gz XVSNIIVLCQFPJG-ZDUSSCGKSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1cc(C)c(Nc2ccc3c(cnn3[C@@H]3CCCCO3)c2)c[nH+]1 ZINC001210331944 1050208094 /nfs/dbraw/zinc/20/80/94/1050208094.db2.gz AQVBUOPWSVPJAS-IBGZPJMESA-N 1 2 322.412 4.491 20 0 DIADLO Cc1cccc(Nc2ccc3c(cnn3[C@@H]3CCCCO3)c2)[nH+]1 ZINC001210330880 1050208326 /nfs/dbraw/zinc/20/83/26/1050208326.db2.gz ASSQGNRQJNWBES-SFHVURJKSA-N 1 2 308.385 4.182 20 0 DIADLO CC(C)[N@H+](CCC(=O)c1ccc2ccccc2c1)Cc1cnc[nH]1 ZINC001136873531 1050209055 /nfs/dbraw/zinc/20/90/55/1050209055.db2.gz RNAYGVUOVHRMKL-UHFFFAOYSA-N 1 2 321.424 4.046 20 0 DIADLO CC(C)[N@@H+](CCC(=O)c1ccc2ccccc2c1)Cc1cnc[nH]1 ZINC001136873531 1050209066 /nfs/dbraw/zinc/20/90/66/1050209066.db2.gz RNAYGVUOVHRMKL-UHFFFAOYSA-N 1 2 321.424 4.046 20 0 DIADLO Cc1nonc1C[N@H+](Cc1ccccc1)[C@H](C)c1ccccc1 ZINC000734146814 1050232913 /nfs/dbraw/zinc/23/29/13/1050232913.db2.gz JETDIYNCMXOBHR-MRXNPFEDSA-N 1 2 307.397 4.141 20 0 DIADLO Cc1nonc1C[N@@H+](Cc1ccccc1)[C@H](C)c1ccccc1 ZINC000734146814 1050232929 /nfs/dbraw/zinc/23/29/29/1050232929.db2.gz JETDIYNCMXOBHR-MRXNPFEDSA-N 1 2 307.397 4.141 20 0 DIADLO FC(F)(F)c1ccccc1C=CNc1cccc2[nH+]ccn21 ZINC001210427110 1050239440 /nfs/dbraw/zinc/23/94/40/1050239440.db2.gz FSIIPGJJSSVUFJ-CMDGGOBGSA-N 1 2 303.287 4.436 20 0 DIADLO Cn1ccnc1-c1ccc(Nc2cccc3cc[nH+]cc32)cc1 ZINC001210432783 1050243640 /nfs/dbraw/zinc/24/36/40/1050243640.db2.gz BIDQOHYSZCALJK-UHFFFAOYSA-N 1 2 300.365 4.379 20 0 DIADLO Cc1cc(Oc2ccc(Nc3cncc(N(C)C)c3)cc2)cc[nH+]1 ZINC001210478777 1050260812 /nfs/dbraw/zinc/26/08/12/1050260812.db2.gz VMLZBRNLFHBACV-UHFFFAOYSA-N 1 2 320.396 4.387 20 0 DIADLO CC(C)CO[C@@H](C)c1noc(C[NH+]2CCC(CC(C)C)CC2)n1 ZINC000760925349 1050265329 /nfs/dbraw/zinc/26/53/29/1050265329.db2.gz KKPUWQXLOGNSLF-HNNXBMFYSA-N 1 2 323.481 4.061 20 0 DIADLO COc1c(F)ccc(C[N@@H+]2CCSc3ccccc3C2)c1F ZINC001143329021 1050278823 /nfs/dbraw/zinc/27/88/23/1050278823.db2.gz HMZYOESBZVEDBC-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO COc1c(F)ccc(C[N@H+]2CCSc3ccccc3C2)c1F ZINC001143329021 1050278835 /nfs/dbraw/zinc/27/88/35/1050278835.db2.gz HMZYOESBZVEDBC-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO CCC1(c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)CCCC1 ZINC000771718629 1050279338 /nfs/dbraw/zinc/27/93/38/1050279338.db2.gz OYGREXSYCJSHQV-UHFFFAOYSA-N 1 2 308.385 4.144 20 0 DIADLO Cc1cccc(C[N@H+](Cc2nc(C(F)(F)F)c[nH]2)C2CC2)c1C ZINC001137020192 1050292837 /nfs/dbraw/zinc/29/28/37/1050292837.db2.gz GQLXKBMPUVPABE-UHFFFAOYSA-N 1 2 323.362 4.210 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2nc(C(F)(F)F)c[nH]2)C2CC2)c1C ZINC001137020192 1050292848 /nfs/dbraw/zinc/29/28/48/1050292848.db2.gz GQLXKBMPUVPABE-UHFFFAOYSA-N 1 2 323.362 4.210 20 0 DIADLO CCCCCCc1ccc([C@H](C)[NH2+][C@@H](C)c2ncn(C)n2)cc1 ZINC000783301160 1050309622 /nfs/dbraw/zinc/30/96/22/1050309622.db2.gz ZTTZMBUAYMJMLV-HOTGVXAUSA-N 1 2 314.477 4.350 20 0 DIADLO CCCCCCc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncn(C)n2)cc1 ZINC000783301159 1050309773 /nfs/dbraw/zinc/30/97/73/1050309773.db2.gz ZTTZMBUAYMJMLV-CVEARBPZSA-N 1 2 314.477 4.350 20 0 DIADLO F[C@@H]1C[N@H+](Cc2ccc(Cl)c(OC(F)(F)F)c2)C[C@@H]2C[C@@H]21 ZINC001143356943 1050314574 /nfs/dbraw/zinc/31/45/74/1050314574.db2.gz MCPPLXHBLUCQBL-JBLDHEPKSA-N 1 2 323.717 4.028 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2ccc(Cl)c(OC(F)(F)F)c2)C[C@@H]2C[C@@H]21 ZINC001143356943 1050314589 /nfs/dbraw/zinc/31/45/89/1050314589.db2.gz MCPPLXHBLUCQBL-JBLDHEPKSA-N 1 2 323.717 4.028 20 0 DIADLO COc1ccc(F)c(C[N@H+](C)Cc2cccc(C)c2)c1Cl ZINC001143364738 1050318335 /nfs/dbraw/zinc/31/83/35/1050318335.db2.gz IBMVZGIUBJVXBQ-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1ccc(F)c(C[N@@H+](C)Cc2cccc(C)c2)c1Cl ZINC001143364738 1050318345 /nfs/dbraw/zinc/31/83/45/1050318345.db2.gz IBMVZGIUBJVXBQ-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2ccccn2)c1Cl ZINC001143369511 1050319416 /nfs/dbraw/zinc/31/94/16/1050319416.db2.gz RTAUJBHBZFUERR-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@H]2c2ccccn2)c1Cl ZINC001143369511 1050319434 /nfs/dbraw/zinc/31/94/34/1050319434.db2.gz RTAUJBHBZFUERR-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(F)c(C[N@H+](C)Cc2ccccc2C)c1Cl ZINC001143368789 1050320212 /nfs/dbraw/zinc/32/02/12/1050320212.db2.gz CLRBXIIXWHTDLY-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1ccc(F)c(C[N@@H+](C)Cc2ccccc2C)c1Cl ZINC001143368789 1050320227 /nfs/dbraw/zinc/32/02/27/1050320227.db2.gz CLRBXIIXWHTDLY-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO CN(C)C(=O)Nc1ccc(Nc2ccc([NH+]3CCCC3)cc2)cc1 ZINC001210634159 1050321751 /nfs/dbraw/zinc/32/17/51/1050321751.db2.gz UFGTZYBNGFAFQI-UHFFFAOYSA-N 1 2 324.428 4.124 20 0 DIADLO Cc1ccc(C(F)(F)F)c(C[N@H+](C)CC(=O)c2ccccc2)c1 ZINC001143680684 1050335631 /nfs/dbraw/zinc/33/56/31/1050335631.db2.gz IOYXPSUWZKAWJM-UHFFFAOYSA-N 1 2 321.342 4.329 20 0 DIADLO Cc1ccc(C(F)(F)F)c(C[N@@H+](C)CC(=O)c2ccccc2)c1 ZINC001143680684 1050335638 /nfs/dbraw/zinc/33/56/38/1050335638.db2.gz IOYXPSUWZKAWJM-UHFFFAOYSA-N 1 2 321.342 4.329 20 0 DIADLO CCc1cc(OC)ccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001210713191 1050345418 /nfs/dbraw/zinc/34/54/18/1050345418.db2.gz OODRESVGZMVYHC-UHFFFAOYSA-N 1 2 307.397 4.246 20 0 DIADLO Clc1cc(Cl)c(C[N@@H+]2CC[C@@]3(CCCO3)C2)c(Cl)c1 ZINC001143797341 1050363667 /nfs/dbraw/zinc/36/36/67/1050363667.db2.gz HNNIYDZQFKWALZ-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1cc(Cl)c(C[N@H+]2CC[C@@]3(CCCO3)C2)c(Cl)c1 ZINC001143797341 1050363671 /nfs/dbraw/zinc/36/36/71/1050363671.db2.gz HNNIYDZQFKWALZ-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO CCC1(O)CC[NH+](Cc2c(Cl)cc(Cl)cc2Cl)CC1 ZINC001143800386 1050364007 /nfs/dbraw/zinc/36/40/07/1050364007.db2.gz GKGIBSSYCRCKAJ-UHFFFAOYSA-N 1 2 322.663 4.384 20 0 DIADLO CCOc1c(Cl)ccc(C[N@H+](CC)Cc2ccncc2)c1F ZINC001143824423 1050368248 /nfs/dbraw/zinc/36/82/48/1050368248.db2.gz CVGOTHZFFZAWDU-UHFFFAOYSA-N 1 2 322.811 4.295 20 0 DIADLO CCOc1c(Cl)ccc(C[N@@H+](CC)Cc2ccncc2)c1F ZINC001143824423 1050368262 /nfs/dbraw/zinc/36/82/62/1050368262.db2.gz CVGOTHZFFZAWDU-UHFFFAOYSA-N 1 2 322.811 4.295 20 0 DIADLO COc1cc(Nc2cc(C(F)(F)F)cc(Cl)n2)cc(C)[nH+]1 ZINC001210775718 1050368531 /nfs/dbraw/zinc/36/85/31/1050368531.db2.gz ZULRDTLRFMYYJE-UHFFFAOYSA-N 1 2 317.698 4.209 20 0 DIADLO COc1cc(Nc2ccc(Cc3ccccn3)cc2)cc(C)[nH+]1 ZINC001210780418 1050370295 /nfs/dbraw/zinc/37/02/95/1050370295.db2.gz JISQJYBLGJCQMQ-UHFFFAOYSA-N 1 2 305.381 4.128 20 0 DIADLO CC(C)Oc1ccccc1C[NH2+]Cc1occc1Br ZINC000735324468 1050370169 /nfs/dbraw/zinc/37/01/69/1050370169.db2.gz LZZYINXFGWECQR-UHFFFAOYSA-N 1 2 324.218 4.119 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@H](c1ccccc1F)C1CCCC1 ZINC000826626306 1050374480 /nfs/dbraw/zinc/37/44/80/1050374480.db2.gz HROUPYAZRLHLNN-GTNSWQLSSA-N 1 2 303.381 4.099 20 0 DIADLO CCOc1c(Cl)ccc(C[NH+]2CC(c3ccccc3)C2)c1F ZINC001143832577 1050375024 /nfs/dbraw/zinc/37/50/24/1050375024.db2.gz AMCGFWNWPLIPFO-UHFFFAOYSA-N 1 2 319.807 4.477 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[N@@H+]1CC[C@@]2(C1)CCCCO2 ZINC001143854719 1050385376 /nfs/dbraw/zinc/38/53/76/1050385376.db2.gz FUPGEYGHQFWGIQ-OAHLLOKOSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[N@H+]1CC[C@@]2(C1)CCCCO2 ZINC001143854719 1050385388 /nfs/dbraw/zinc/38/53/88/1050385388.db2.gz FUPGEYGHQFWGIQ-OAHLLOKOSA-N 1 2 318.219 4.278 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2c(F)ccc(Cl)c2Cl)[C@@H](C)C1 ZINC001143867377 1050387332 /nfs/dbraw/zinc/38/73/32/1050387332.db2.gz AEPDPVNHUSVBDT-UWVGGRQHSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2c(F)ccc(Cl)c2Cl)[C@@H](C)C1 ZINC001143867377 1050387344 /nfs/dbraw/zinc/38/73/44/1050387344.db2.gz AEPDPVNHUSVBDT-UWVGGRQHSA-N 1 2 306.208 4.132 20 0 DIADLO Cc1cc(C(C)(C)C)ccc1OC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000844286063 1050394353 /nfs/dbraw/zinc/39/43/53/1050394353.db2.gz QBMCVZBOPGWCMJ-AWEZNQCLSA-N 1 2 300.402 4.046 20 0 DIADLO Cc1cnc2c(c1)C[N@@H+](Cc1cccc(C(F)(F)F)c1C)CC2 ZINC001143928903 1050401877 /nfs/dbraw/zinc/40/18/77/1050401877.db2.gz APMPJSSFADMRGU-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cnc2c(c1)C[N@H+](Cc1cccc(C(F)(F)F)c1C)CC2 ZINC001143928903 1050401880 /nfs/dbraw/zinc/40/18/80/1050401880.db2.gz APMPJSSFADMRGU-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1nccn1C(C)C ZINC000593299401 1050402812 /nfs/dbraw/zinc/40/28/12/1050402812.db2.gz ALVLFJQZTYEZRJ-KRWDZBQOSA-N 1 2 313.445 4.200 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1nccn1C(C)C ZINC000593299401 1050402816 /nfs/dbraw/zinc/40/28/16/1050402816.db2.gz ALVLFJQZTYEZRJ-KRWDZBQOSA-N 1 2 313.445 4.200 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(Cl)ccc(F)c2F)CCC1(F)F ZINC001143945239 1050412460 /nfs/dbraw/zinc/41/24/60/1050412460.db2.gz AMNSSICPWPZDEJ-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO COc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2OC)c(F)c1F ZINC001143914722 1050403880 /nfs/dbraw/zinc/40/38/80/1050403880.db2.gz DZASSGSJMNSTCG-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2OC)c(F)c1F ZINC001143914722 1050403890 /nfs/dbraw/zinc/40/38/90/1050403890.db2.gz DZASSGSJMNSTCG-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(Cl)ccc(F)c2F)CCC1(F)F ZINC001143945239 1050412463 /nfs/dbraw/zinc/41/24/63/1050412463.db2.gz AMNSSICPWPZDEJ-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO CCc1[nH]nc2ncc(Nc3ccc([NH+]4CCCCC4)cc3)cc12 ZINC001210884226 1050405517 /nfs/dbraw/zinc/40/55/17/1050405517.db2.gz LMRGOYWQOHWUMF-UHFFFAOYSA-N 1 2 321.428 4.254 20 0 DIADLO Cc1c(C[N@@H+]2CC[C@](C)(F)[C@@H](F)C2)cccc1C(F)(F)F ZINC001143923274 1050409476 /nfs/dbraw/zinc/40/94/76/1050409476.db2.gz UJWSJAWTKSOJMV-KBPBESRZSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1c(C[N@H+]2CC[C@](C)(F)[C@@H](F)C2)cccc1C(F)(F)F ZINC001143923274 1050409478 /nfs/dbraw/zinc/40/94/78/1050409478.db2.gz UJWSJAWTKSOJMV-KBPBESRZSA-N 1 2 307.306 4.286 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(SC(C)(C)C)cc1)n1cc[nH+]c1 ZINC000844365596 1050409554 /nfs/dbraw/zinc/40/95/54/1050409554.db2.gz LXUXLDOAUPUNRR-CYBMUJFWSA-N 1 2 317.458 4.364 20 0 DIADLO CCOc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)c1F ZINC001143931604 1050414175 /nfs/dbraw/zinc/41/41/75/1050414175.db2.gz ZYIIYRMFOLCDCK-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2cccnc2)c1F ZINC001143931604 1050414177 /nfs/dbraw/zinc/41/41/77/1050414177.db2.gz ZYIIYRMFOLCDCK-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO Oc1c(Cl)cc(Nc2ccc[nH+]c2N2CCCC2)cc1Cl ZINC001210924009 1050415516 /nfs/dbraw/zinc/41/55/16/1050415516.db2.gz CJSPVUDXGJIFCN-UHFFFAOYSA-N 1 2 324.211 4.438 20 0 DIADLO CC(C)OC1CC[NH+](Cc2c(Cl)ccc(F)c2F)CC1 ZINC001143957449 1050416967 /nfs/dbraw/zinc/41/69/67/1050416967.db2.gz NRAVNCBVXZEMHV-UHFFFAOYSA-N 1 2 303.780 4.008 20 0 DIADLO C[N@@H+](Cc1c(Cl)ccc(F)c1F)C[C@@H]1Cc2ccccc2O1 ZINC001143969915 1050419602 /nfs/dbraw/zinc/41/96/02/1050419602.db2.gz FDZFXDBMYXDJHE-LBPRGKRZSA-N 1 2 323.770 4.054 20 0 DIADLO C[N@H+](Cc1c(Cl)ccc(F)c1F)C[C@@H]1Cc2ccccc2O1 ZINC001143969915 1050419609 /nfs/dbraw/zinc/41/96/09/1050419609.db2.gz FDZFXDBMYXDJHE-LBPRGKRZSA-N 1 2 323.770 4.054 20 0 DIADLO CC[C@@H](OC(=O)C[C@H](C)n1cc[nH+]c1)c1c(F)cccc1Cl ZINC000844428807 1050420811 /nfs/dbraw/zinc/42/08/11/1050420811.db2.gz LXZPPGVKWMTUKB-SMDDNHRTSA-N 1 2 324.783 4.321 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2c(F)ccc(OC)c2F)cc1 ZINC001143980089 1050425578 /nfs/dbraw/zinc/42/55/78/1050425578.db2.gz BKKRRLRPIDPNMG-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2c(F)ccc(OC)c2F)cc1 ZINC001143980089 1050425590 /nfs/dbraw/zinc/42/55/90/1050425590.db2.gz BKKRRLRPIDPNMG-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2ccc(C)nc2)c1F ZINC001143981063 1050425991 /nfs/dbraw/zinc/42/59/91/1050425991.db2.gz YUVZIQHXODWFJU-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@H]2c2ccc(C)nc2)c1F ZINC001143981063 1050425995 /nfs/dbraw/zinc/42/59/95/1050425995.db2.gz YUVZIQHXODWFJU-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO CC[N@H+](Cc1ccc(F)cc1)Cc1c(F)ccc(OC)c1F ZINC001143980351 1050426852 /nfs/dbraw/zinc/42/68/52/1050426852.db2.gz LBPPDHARPCBORB-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccc(F)cc1)Cc1c(F)ccc(OC)c1F ZINC001143980351 1050426856 /nfs/dbraw/zinc/42/68/56/1050426856.db2.gz LBPPDHARPCBORB-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO FC1(F)C[C@@]12CCC[N@H+](Cc1ncc(Cl)cc1Cl)C2 ZINC000844441540 1050427466 /nfs/dbraw/zinc/42/74/66/1050427466.db2.gz OCZCPMCALJVZKO-GFCCVEGCSA-N 1 2 307.171 4.010 20 0 DIADLO FC1(F)C[C@@]12CCC[N@@H+](Cc1ncc(Cl)cc1Cl)C2 ZINC000844441540 1050427475 /nfs/dbraw/zinc/42/74/75/1050427475.db2.gz OCZCPMCALJVZKO-GFCCVEGCSA-N 1 2 307.171 4.010 20 0 DIADLO FC(F)(F)c1cc(Cl)cc(C[N@@H+]2CCC[C@@]3(CCO3)C2)c1 ZINC001143990771 1050433162 /nfs/dbraw/zinc/43/31/62/1050433162.db2.gz JUUCELZRXPHMQG-CQSZACIVSA-N 1 2 319.754 4.114 20 0 DIADLO FC(F)(F)c1cc(Cl)cc(C[N@H+]2CCC[C@@]3(CCO3)C2)c1 ZINC001143990771 1050433169 /nfs/dbraw/zinc/43/31/69/1050433169.db2.gz JUUCELZRXPHMQG-CQSZACIVSA-N 1 2 319.754 4.114 20 0 DIADLO CC(=O)[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC001143990095 1050433475 /nfs/dbraw/zinc/43/34/75/1050433475.db2.gz FWCLGZDURRLGHH-GFCCVEGCSA-N 1 2 319.754 4.160 20 0 DIADLO CC(=O)[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC001143990095 1050433479 /nfs/dbraw/zinc/43/34/79/1050433479.db2.gz FWCLGZDURRLGHH-GFCCVEGCSA-N 1 2 319.754 4.160 20 0 DIADLO Cc1cc(Nc2[nH+]ccc3ccccc32)ccc1N1CCOCC1 ZINC001210969114 1050436282 /nfs/dbraw/zinc/43/62/82/1050436282.db2.gz IREUMHJYFBCLLQ-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO Cc1ccc(Nc2ccc3[nH]c(=O)cc(C(F)(F)F)c3c2)[nH+]c1 ZINC001211012537 1050444486 /nfs/dbraw/zinc/44/44/86/1050444486.db2.gz HUFCDQFZFPMCQV-UHFFFAOYSA-N 1 2 319.286 4.406 20 0 DIADLO Cc1ccc(Nc2ccc3ncc(-c4cnn(C)c4)cc3c2)[nH+]c1 ZINC001211010399 1050444957 /nfs/dbraw/zinc/44/49/57/1050444957.db2.gz HUYVFWRTDXLUAR-UHFFFAOYSA-N 1 2 315.380 4.082 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2CCC[C@@H]2c2ccccn2)cc1F ZINC001144026275 1050445177 /nfs/dbraw/zinc/44/51/77/1050445177.db2.gz NSQXGHDEDLMRJU-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2CCC[C@@H]2c2ccccn2)cc1F ZINC001144026275 1050445186 /nfs/dbraw/zinc/44/51/86/1050445186.db2.gz NSQXGHDEDLMRJU-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1ccc(Oc2cccc(C[N@H+]3CCC(=O)C[C@H]3C)c2)cc1 ZINC001144086407 1050456138 /nfs/dbraw/zinc/45/61/38/1050456138.db2.gz RMDJAEWENBUXOF-MRXNPFEDSA-N 1 2 309.409 4.341 20 0 DIADLO Cc1ccc(Oc2cccc(C[N@@H+]3CCC(=O)C[C@H]3C)c2)cc1 ZINC001144086407 1050456141 /nfs/dbraw/zinc/45/61/41/1050456141.db2.gz RMDJAEWENBUXOF-MRXNPFEDSA-N 1 2 309.409 4.341 20 0 DIADLO CC(C)c1cnc(C[NH+]2CCC(c3ccccc3F)CC2)o1 ZINC000736313439 1050466608 /nfs/dbraw/zinc/46/66/08/1050466608.db2.gz YPONQWDTQDPLGX-UHFFFAOYSA-N 1 2 302.393 4.317 20 0 DIADLO CCCCc1nc(C[N@H+](C)CCN(C)c2ccccc2)cs1 ZINC000594011350 1050472395 /nfs/dbraw/zinc/47/23/95/1050472395.db2.gz FFOHUKSMDLESMY-UHFFFAOYSA-N 1 2 317.502 4.054 20 0 DIADLO CCCCc1nc(C[N@@H+](C)CCN(C)c2ccccc2)cs1 ZINC000594011350 1050472405 /nfs/dbraw/zinc/47/24/05/1050472405.db2.gz FFOHUKSMDLESMY-UHFFFAOYSA-N 1 2 317.502 4.054 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Cl)c(F)cc2F)CCC1(F)F ZINC001144125480 1050474783 /nfs/dbraw/zinc/47/47/83/1050474783.db2.gz KHULFWPXMMPVBK-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2F)CCC1(F)F ZINC001144125480 1050474790 /nfs/dbraw/zinc/47/47/90/1050474790.db2.gz KHULFWPXMMPVBK-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO FC(F)(F)[C@H]1CC[N@H+](Cc2csc(-c3cccs3)n2)C1 ZINC000761044556 1050478025 /nfs/dbraw/zinc/47/80/25/1050478025.db2.gz AOESGPSTUNQPRZ-VIFPVBQESA-N 1 2 318.389 4.256 20 0 DIADLO FC(F)(F)[C@H]1CC[N@@H+](Cc2csc(-c3cccs3)n2)C1 ZINC000761044556 1050478029 /nfs/dbraw/zinc/47/80/29/1050478029.db2.gz AOESGPSTUNQPRZ-VIFPVBQESA-N 1 2 318.389 4.256 20 0 DIADLO CCCOC1CC[NH+](Cc2cc(Cl)c(F)cc2F)CC1 ZINC001144130184 1050479860 /nfs/dbraw/zinc/47/98/60/1050479860.db2.gz ABTLOMJHLMHQFK-UHFFFAOYSA-N 1 2 303.780 4.009 20 0 DIADLO Cc1ccc(N(CC(C)C)C(=O)c2cccc3[nH+]ccn32)c(C)c1 ZINC000844665557 1050480563 /nfs/dbraw/zinc/48/05/63/1050480563.db2.gz HZNDDUKTBSQQKY-UHFFFAOYSA-N 1 2 321.424 4.254 20 0 DIADLO CC[N@H+](Cc1csc(C)n1)Cc1ccc(C(F)(F)F)cc1 ZINC000736621359 1050482344 /nfs/dbraw/zinc/48/23/44/1050482344.db2.gz VOSDWZRGWWTCRD-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CC[N@@H+](Cc1csc(C)n1)Cc1ccc(C(F)(F)F)cc1 ZINC000736621359 1050482355 /nfs/dbraw/zinc/48/23/55/1050482355.db2.gz VOSDWZRGWWTCRD-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO Cc1c2cccc(C)c2oc1C[N@H+](C)Cn1cccnc1=S ZINC000844737412 1050492084 /nfs/dbraw/zinc/49/20/84/1050492084.db2.gz GCLCGBUCBMILRC-UHFFFAOYSA-N 1 2 313.426 4.065 20 0 DIADLO Cc1c2cccc(C)c2oc1C[N@@H+](C)Cn1cccnc1=S ZINC000844737412 1050492095 /nfs/dbraw/zinc/49/20/95/1050492095.db2.gz GCLCGBUCBMILRC-UHFFFAOYSA-N 1 2 313.426 4.065 20 0 DIADLO CCN(C)c1ccc(Nc2cccc(-c3cccnc3)c2)c[nH+]1 ZINC001211143520 1050495118 /nfs/dbraw/zinc/49/51/18/1050495118.db2.gz ZUMSLDCSXOPJLC-UHFFFAOYSA-N 1 2 304.397 4.343 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761055701 1050498727 /nfs/dbraw/zinc/49/87/27/1050498727.db2.gz VUVQSMGVQCYPET-JTQLQIEISA-N 1 2 316.348 4.096 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761055701 1050498734 /nfs/dbraw/zinc/49/87/34/1050498734.db2.gz VUVQSMGVQCYPET-JTQLQIEISA-N 1 2 316.348 4.096 20 0 DIADLO CCOc1cc(Nc2cc(C(F)(F)F)ccc2N)cc(C)[nH+]1 ZINC001211149987 1050498907 /nfs/dbraw/zinc/49/89/07/1050498907.db2.gz MVWKQEQSENUTEN-UHFFFAOYSA-N 1 2 311.307 4.133 20 0 DIADLO CC(C)[C@H](Nc1[nH+]cnc2[nH]cc(F)c21)c1ccc(F)cc1 ZINC001170059821 1050499828 /nfs/dbraw/zinc/49/98/28/1050499828.db2.gz COJBDMVUZXUWFG-AWEZNQCLSA-N 1 2 302.328 4.045 20 0 DIADLO CC(C)Cc1noc(C[NH2+]C(C)(C)c2ccc(C(C)C)cc2)n1 ZINC000594381204 1050506087 /nfs/dbraw/zinc/50/60/87/1050506087.db2.gz FUBCRWGYMHUJRX-UHFFFAOYSA-N 1 2 315.461 4.416 20 0 DIADLO CC(C)[C@H](Nc1ccc(Cn2cc[nH+]c2)cn1)c1ccc(F)cc1 ZINC001170063121 1050509253 /nfs/dbraw/zinc/50/92/53/1050509253.db2.gz MKVNCCFDMBGYEC-IBGZPJMESA-N 1 2 324.403 4.275 20 0 DIADLO FC(F)(F)c1ccc(Nc2cccn3cc[nH+]c23)c(Cl)n1 ZINC001211199413 1050514688 /nfs/dbraw/zinc/51/46/88/1050514688.db2.gz QQPVWSMYXUIADW-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO O=C(Oc1ccc2oc3ccccc3c2c1)[C@@H]1CCC[N@@H+]1C1CC1 ZINC000786761507 1050514696 /nfs/dbraw/zinc/51/46/96/1050514696.db2.gz RKNSSSCVKGZKPJ-KRWDZBQOSA-N 1 2 321.376 4.118 20 0 DIADLO O=C(Oc1ccc2oc3ccccc3c2c1)[C@@H]1CCC[N@H+]1C1CC1 ZINC000786761507 1050514713 /nfs/dbraw/zinc/51/47/13/1050514713.db2.gz RKNSSSCVKGZKPJ-KRWDZBQOSA-N 1 2 321.376 4.118 20 0 DIADLO O=C(Oc1ccc2oc3ccccc3c2c1)[C@H]1CCC[N@@H+]1C1CC1 ZINC000786761509 1050515625 /nfs/dbraw/zinc/51/56/25/1050515625.db2.gz RKNSSSCVKGZKPJ-QGZVFWFLSA-N 1 2 321.376 4.118 20 0 DIADLO O=C(Oc1ccc2oc3ccccc3c2c1)[C@H]1CCC[N@H+]1C1CC1 ZINC000786761509 1050515639 /nfs/dbraw/zinc/51/56/39/1050515639.db2.gz RKNSSSCVKGZKPJ-QGZVFWFLSA-N 1 2 321.376 4.118 20 0 DIADLO CC(C)Cc1noc(C[NH2+]C(C)(C)c2ccc3ccccc3c2)n1 ZINC000626115341 1050516864 /nfs/dbraw/zinc/51/68/64/1050516864.db2.gz PQJPCPOFNJRIOR-UHFFFAOYSA-N 1 2 323.440 4.446 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cn1sc2ccccc2c1=O ZINC000738243550 1050532165 /nfs/dbraw/zinc/53/21/65/1050532165.db2.gz QHNWYMGNJQDARE-KRWDZBQOSA-N 1 2 324.449 4.030 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cn1sc2ccccc2c1=O ZINC000738243550 1050532171 /nfs/dbraw/zinc/53/21/71/1050532171.db2.gz QHNWYMGNJQDARE-KRWDZBQOSA-N 1 2 324.449 4.030 20 0 DIADLO Cc1nc(F)ccc1C[N@H+](Cc1ccco1)Cc1cccs1 ZINC000787051547 1050544877 /nfs/dbraw/zinc/54/48/77/1050544877.db2.gz YTFCEUXCWZDFOV-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+](Cc1ccco1)Cc1cccs1 ZINC000787051547 1050544896 /nfs/dbraw/zinc/54/48/96/1050544896.db2.gz YTFCEUXCWZDFOV-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1csc(-c2ccoc2)n1 ZINC000594720847 1050549942 /nfs/dbraw/zinc/54/99/42/1050549942.db2.gz TVAXZPHYMVJSSG-UHFFFAOYSA-N 1 2 304.337 4.177 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1csc(-c2ccoc2)n1 ZINC000594720847 1050549960 /nfs/dbraw/zinc/54/99/60/1050549960.db2.gz TVAXZPHYMVJSSG-UHFFFAOYSA-N 1 2 304.337 4.177 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cc(COC)cs2)c1 ZINC000594735868 1050550168 /nfs/dbraw/zinc/55/01/68/1050550168.db2.gz XHFHBINVWVYHLC-UHFFFAOYSA-N 1 2 308.472 4.155 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+](C)Cc1cccc(Cl)c1Cl ZINC000787056414 1050552332 /nfs/dbraw/zinc/55/23/32/1050552332.db2.gz DQZFRJPWNFAOMY-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1nc(F)ccc1C[N@H+](C)Cc1cccc(Cl)c1Cl ZINC000787056414 1050552347 /nfs/dbraw/zinc/55/23/47/1050552347.db2.gz DQZFRJPWNFAOMY-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO CCCCOC(=O)C[N@H+](C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000746653273 1050560137 /nfs/dbraw/zinc/56/01/37/1050560137.db2.gz SJONJVJGRFALCH-GFCCVEGCSA-N 1 2 317.351 4.042 20 0 DIADLO CCCCOC(=O)C[N@@H+](C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000746653273 1050560148 /nfs/dbraw/zinc/56/01/48/1050560148.db2.gz SJONJVJGRFALCH-GFCCVEGCSA-N 1 2 317.351 4.042 20 0 DIADLO Clc1ccc2c(C[N@@H+]3Cc4cccc(Cl)c4C3)c[nH]c2n1 ZINC001144416221 1050569206 /nfs/dbraw/zinc/56/92/06/1050569206.db2.gz BVYKFRUWKDCGLI-UHFFFAOYSA-N 1 2 318.207 4.386 20 0 DIADLO Clc1ccc2c(C[N@H+]3Cc4cccc(Cl)c4C3)c[nH]c2n1 ZINC001144416221 1050569224 /nfs/dbraw/zinc/56/92/24/1050569224.db2.gz BVYKFRUWKDCGLI-UHFFFAOYSA-N 1 2 318.207 4.386 20 0 DIADLO CCC(C)(C)c1ccc(OC(=O)C[C@@H](C)n2cc[nH+]c2)cc1 ZINC000845441471 1050580008 /nfs/dbraw/zinc/58/00/08/1050580008.db2.gz SGPQGCQEYKWUSN-CQSZACIVSA-N 1 2 300.402 4.127 20 0 DIADLO c1cnn(-c2ccccc2Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213087791 1050582108 /nfs/dbraw/zinc/58/21/08/1050582108.db2.gz AMTXOEUPUBPLRZ-UHFFFAOYSA-N 1 2 301.353 4.006 20 0 DIADLO Oc1ccc2ncc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2c1 ZINC001213087166 1050583302 /nfs/dbraw/zinc/58/33/02/1050583302.db2.gz JZMGPFUBBVWPRG-UHFFFAOYSA-N 1 2 302.337 4.074 20 0 DIADLO COc1cc(F)c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(F)c1 ZINC001213088990 1050585350 /nfs/dbraw/zinc/58/53/50/1050585350.db2.gz NWCOVCUULBQGNR-UHFFFAOYSA-N 1 2 301.296 4.107 20 0 DIADLO COC(=O)c1c(C)cc(Nc2cccc(-n3cc[nH+]c3)c2)cc1C ZINC001213123144 1050597985 /nfs/dbraw/zinc/59/79/85/1050597985.db2.gz VWQYHPKFVSJIOE-UHFFFAOYSA-N 1 2 321.380 4.019 20 0 DIADLO Cc1ccc2c(Nc3ccc4c(c3)CCC(=O)N4C)cccc2[nH+]1 ZINC001213139816 1050599209 /nfs/dbraw/zinc/59/92/09/1050599209.db2.gz QXKIRZKSSYASGD-UHFFFAOYSA-N 1 2 317.392 4.196 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c(F)c1 ZINC001144558743 1050617487 /nfs/dbraw/zinc/61/74/87/1050617487.db2.gz BTUPASJKKQHGFK-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c(F)c1 ZINC001144558743 1050617496 /nfs/dbraw/zinc/61/74/96/1050617496.db2.gz BTUPASJKKQHGFK-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)c(F)c1 ZINC001144558744 1050617539 /nfs/dbraw/zinc/61/75/39/1050617539.db2.gz BTUPASJKKQHGFK-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)c(F)c1 ZINC001144558744 1050617547 /nfs/dbraw/zinc/61/75/47/1050617547.db2.gz BTUPASJKKQHGFK-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2c(F)cc(O)cc2F)c1 ZINC001144559614 1050619415 /nfs/dbraw/zinc/61/94/15/1050619415.db2.gz OPABUXCKTUHTGC-GOSISDBHSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2c(F)cc(O)cc2F)c1 ZINC001144559614 1050619417 /nfs/dbraw/zinc/61/94/17/1050619417.db2.gz OPABUXCKTUHTGC-GOSISDBHSA-N 1 2 319.351 4.016 20 0 DIADLO FC(F)COc1ccc(Nc2[nH+]cccc2N2CCCC2)cc1 ZINC001213305094 1050623747 /nfs/dbraw/zinc/62/37/47/1050623747.db2.gz KVTLXKJZNUHTNV-UHFFFAOYSA-N 1 2 319.355 4.069 20 0 DIADLO Clc1ccc([C@H]2CCC[N@@H+]2Cc2ncn3ccccc23)cc1 ZINC001144622212 1050633554 /nfs/dbraw/zinc/63/35/54/1050633554.db2.gz GLTFVYCXNJBIOW-QGZVFWFLSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1ccc([C@H]2CCC[N@H+]2Cc2ncn3ccccc23)cc1 ZINC001144622212 1050633562 /nfs/dbraw/zinc/63/35/62/1050633562.db2.gz GLTFVYCXNJBIOW-QGZVFWFLSA-N 1 2 311.816 4.325 20 0 DIADLO CCCC[N@H+](Cc1noc2c1CCCC2)Cc1ccccc1F ZINC000595557951 1050643279 /nfs/dbraw/zinc/64/32/79/1050643279.db2.gz MQRAYMILTQVFDH-UHFFFAOYSA-N 1 2 316.420 4.495 20 0 DIADLO CCCC[N@@H+](Cc1noc2c1CCCC2)Cc1ccccc1F ZINC000595557951 1050643284 /nfs/dbraw/zinc/64/32/84/1050643284.db2.gz MQRAYMILTQVFDH-UHFFFAOYSA-N 1 2 316.420 4.495 20 0 DIADLO Fc1cc(C[NH2+]C2(c3ccccc3Cl)CCC2)c(F)cn1 ZINC000845994690 1050649276 /nfs/dbraw/zinc/64/92/76/1050649276.db2.gz IOFNWPUUKYLZBD-UHFFFAOYSA-N 1 2 308.759 4.182 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)CC[C@]1(C)O ZINC001231480742 1050666392 /nfs/dbraw/zinc/66/63/92/1050666392.db2.gz XEKJQTIXNQEXTP-OTYXRUKQSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)CC[C@]1(C)O ZINC001231480742 1050666407 /nfs/dbraw/zinc/66/64/07/1050666407.db2.gz XEKJQTIXNQEXTP-OTYXRUKQSA-N 1 2 322.663 4.240 20 0 DIADLO Cc1cccc(NC2CC[NH+](Cc3ncc(C(C)C)o3)CC2)c1 ZINC000741255415 1050669129 /nfs/dbraw/zinc/66/91/29/1050669129.db2.gz KHSYYHBTNBXXEM-UHFFFAOYSA-N 1 2 313.445 4.183 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cccnc1Br ZINC001213491174 1050669644 /nfs/dbraw/zinc/66/96/44/1050669644.db2.gz APBACOGDNJZTJP-UHFFFAOYSA-N 1 2 304.191 4.169 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ncc(F)cc1Br ZINC001213491485 1050669735 /nfs/dbraw/zinc/66/97/35/1050669735.db2.gz KXSHJPUMNZRBIR-UHFFFAOYSA-N 1 2 322.181 4.308 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(Br)nc1 ZINC001213491353 1050669931 /nfs/dbraw/zinc/66/99/31/1050669931.db2.gz IDLJKUJOTCRXTR-UHFFFAOYSA-N 1 2 304.191 4.169 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccnc(Br)c1 ZINC001213492181 1050670563 /nfs/dbraw/zinc/67/05/63/1050670563.db2.gz YXGGBULKHJRCMQ-UHFFFAOYSA-N 1 2 304.191 4.169 20 0 DIADLO CC(=O)c1ccnc(Cl)c1Nc1cc(C2CC2)c[nH+]c1C ZINC001213491823 1050670829 /nfs/dbraw/zinc/67/08/29/1050670829.db2.gz RNSBFFPOEMKVTE-UHFFFAOYSA-N 1 2 301.777 4.262 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(-c2ccccn2)nc1 ZINC001213496932 1050671800 /nfs/dbraw/zinc/67/18/00/1050671800.db2.gz FKEKIYAGTZAIPU-UHFFFAOYSA-N 1 2 302.381 4.468 20 0 DIADLO Cc1ccc(Br)nc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213497563 1050671958 /nfs/dbraw/zinc/67/19/58/1050671958.db2.gz VNBWBSIQLRATFU-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2nc(C(C)(C)C)nn2c1 ZINC001213497296 1050672795 /nfs/dbraw/zinc/67/27/95/1050672795.db2.gz MRDINEYENJELDA-UHFFFAOYSA-N 1 2 321.428 4.351 20 0 DIADLO COC(=O)c1c(F)ccc(Nc2cc(C3CC3)c[nH+]c2C)c1C ZINC001213501447 1050673796 /nfs/dbraw/zinc/67/37/96/1050673796.db2.gz ZFMYFBFZWBJBPS-UHFFFAOYSA-N 1 2 314.360 4.245 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccccc1CN1CCCC1=O ZINC001213501162 1050674349 /nfs/dbraw/zinc/67/43/49/1050674349.db2.gz KJLZCQCGRWTKBT-UHFFFAOYSA-N 1 2 321.424 4.133 20 0 DIADLO CCOC(=O)Cc1cccc(Nc2cc(C3CC3)c[nH+]c2C)c1 ZINC001213503407 1050674565 /nfs/dbraw/zinc/67/45/65/1050674565.db2.gz DKIHFEBKOWWEJC-UHFFFAOYSA-N 1 2 310.397 4.117 20 0 DIADLO COC(Cc1ccc(Nc2cc(C3CC3)c[nH+]c2C)cc1)OC ZINC001213503613 1050675287 /nfs/dbraw/zinc/67/52/87/1050675287.db2.gz OQQNCSCBTGVRKB-UHFFFAOYSA-N 1 2 312.413 4.172 20 0 DIADLO COc1ccc(Cn2nc(C)cc2Nc2c[nH+]c(C)cc2C)cc1 ZINC001213510386 1050676195 /nfs/dbraw/zinc/67/61/95/1050676195.db2.gz ALYNCRQGHWWPRT-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1cc(C)c(Nc2ccc(OC3CCOCC3)c(F)c2)c[nH+]1 ZINC001213518435 1050676310 /nfs/dbraw/zinc/67/63/10/1050676310.db2.gz ODFREVZAIOUMTM-UHFFFAOYSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@H](C)C2CCCC2)c2ccc(Cl)cc2)no1 ZINC000179894730 1050676460 /nfs/dbraw/zinc/67/64/60/1050676460.db2.gz DPQAXADHENLJDF-BZNIZROVSA-N 1 2 319.836 4.289 20 0 DIADLO Cc1cc(C)c(Nc2cnc(Cl)c(Br)c2)c[nH+]1 ZINC001213505922 1050677130 /nfs/dbraw/zinc/67/71/30/1050677130.db2.gz TUHFZABSMCRTAH-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1cc(C)c(Nc2sc(-c3ccccc3)cc2C(N)=O)c[nH+]1 ZINC001213508125 1050677487 /nfs/dbraw/zinc/67/74/87/1050677487.db2.gz LUIFMHFYVWMRHK-UHFFFAOYSA-N 1 2 323.421 4.269 20 0 DIADLO Cc1cc(C)c(Nc2ccc3cnn([C@@H]4CCCCO4)c3c2)c[nH+]1 ZINC001213515974 1050677608 /nfs/dbraw/zinc/67/76/08/1050677608.db2.gz WDBBZZZMCOMKPO-IBGZPJMESA-N 1 2 322.412 4.491 20 0 DIADLO COc1cc(Br)cc(Nc2c[nH+]c(C)cc2C)c1 ZINC001213515849 1050677787 /nfs/dbraw/zinc/67/77/87/1050677787.db2.gz PAMKHBWQFOIXBL-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1cc(C)c(Nc2c(F)cccc2OC[C@@H]2CCCO2)c[nH+]1 ZINC001213521029 1050678671 /nfs/dbraw/zinc/67/86/71/1050678671.db2.gz OZUYGEYZIUXXFF-AWEZNQCLSA-N 1 2 316.376 4.139 20 0 DIADLO CCOC(=O)c1ccc2ccc(Nc3c[nH+]c(C)cc3C)cc2n1 ZINC001213521148 1050679085 /nfs/dbraw/zinc/67/90/85/1050679085.db2.gz WHLFXNUOUZHADG-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO COc1cccc(Cn2nc(C)cc2Nc2c[nH+]cc(C)c2C)c1 ZINC001213527696 1050679108 /nfs/dbraw/zinc/67/91/08/1050679108.db2.gz YVESKBOACWLAPP-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1c[nH+]cc(Nc2cncc(OCc3ccccc3)c2)c1C ZINC001213527321 1050679956 /nfs/dbraw/zinc/67/99/56/1050679956.db2.gz FYWNPQIUMXLDOU-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO CC(=O)c1cc(Nc2c[nH+]c(C)cc2C)ccc1Br ZINC001213520584 1050679971 /nfs/dbraw/zinc/67/99/71/1050679971.db2.gz FLNNUSASENAIFC-UHFFFAOYSA-N 1 2 319.202 4.407 20 0 DIADLO COC(=O)c1cc(Nc2c[nH+]c(C)cc2C)c(F)cc1Cl ZINC001213518644 1050680397 /nfs/dbraw/zinc/68/03/97/1050680397.db2.gz ZJWVUVANTGPDPN-UHFFFAOYSA-N 1 2 308.740 4.021 20 0 DIADLO Cc1c[nH+]cc(Nc2cc(Cl)ncc2Br)c1C ZINC001213523318 1050680459 /nfs/dbraw/zinc/68/04/59/1050680459.db2.gz PWBDKXJZWOKPDF-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1c[nH+]cc(Nc2cc(Br)c(C)cc2N)c1C ZINC001213530932 1050681356 /nfs/dbraw/zinc/68/13/56/1050681356.db2.gz QFPIPNJUDUJXLE-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO CCOC(=O)c1ccc(Nc2c[nH+]cc(C)c2C)cc1Cl ZINC001213530941 1050682386 /nfs/dbraw/zinc/68/23/86/1050682386.db2.gz QLWIFFGTGPIPFR-UHFFFAOYSA-N 1 2 304.777 4.272 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(C(=O)NC3CCCC3)cc2)c1C ZINC001213531269 1050682930 /nfs/dbraw/zinc/68/29/30/1050682930.db2.gz ZBSDRPOZFQNYLM-UHFFFAOYSA-N 1 2 309.413 4.114 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cnc(Cl)cn2)C2CC2)o1 ZINC000788471861 1050685299 /nfs/dbraw/zinc/68/52/99/1050685299.db2.gz VOPHORGDVHEFBX-ABAIWWIYSA-N 1 2 317.820 4.011 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cnc(Cl)cn2)C2CC2)o1 ZINC000788471861 1050685305 /nfs/dbraw/zinc/68/53/05/1050685305.db2.gz VOPHORGDVHEFBX-ABAIWWIYSA-N 1 2 317.820 4.011 20 0 DIADLO COCc1ccc(C)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001213571255 1050686095 /nfs/dbraw/zinc/68/60/95/1050686095.db2.gz OCCADYPOAVTKFL-UHFFFAOYSA-N 1 2 311.429 4.270 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@@H+]2Cc2cnc(Cl)cn2)o1 ZINC000788480021 1050688049 /nfs/dbraw/zinc/68/80/49/1050688049.db2.gz FOSVPJIDIFFABM-OAHLLOKOSA-N 1 2 319.836 4.403 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@H+]2Cc2cnc(Cl)cn2)o1 ZINC000788480021 1050688055 /nfs/dbraw/zinc/68/80/55/1050688055.db2.gz FOSVPJIDIFFABM-OAHLLOKOSA-N 1 2 319.836 4.403 20 0 DIADLO C[C@@H]([NH2+]CCN1CCC[C@@H]1C)c1cc(Cl)sc1Cl ZINC000766271931 1050689168 /nfs/dbraw/zinc/68/91/68/1050689168.db2.gz HIFOQNFPVCGTOE-VHSXEESVSA-N 1 2 307.290 4.190 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CCSc3c(F)cccc32)c1 ZINC000846213802 1050703820 /nfs/dbraw/zinc/70/38/20/1050703820.db2.gz VBQVVMAABGVNPY-AWEZNQCLSA-N 1 2 304.390 4.016 20 0 DIADLO Cc1cc[nH+]c(Nc2ccc3cnn(C(=O)OC(C)(C)C)c3c2)c1 ZINC001213721900 1050724777 /nfs/dbraw/zinc/72/47/77/1050724777.db2.gz MTPLDWXKDUXGEG-UHFFFAOYSA-N 1 2 324.384 4.267 20 0 DIADLO Cc1csc(C2([NH2+][C@@H]3CCc4ccc(Cl)nc43)CCC2)n1 ZINC000788705251 1050731480 /nfs/dbraw/zinc/73/14/80/1050731480.db2.gz PVTZDPQHYBIJKM-GFCCVEGCSA-N 1 2 319.861 4.156 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@@H]3CCc4ccc(Cl)nc43)ccc21 ZINC000788728448 1050734510 /nfs/dbraw/zinc/73/45/10/1050734510.db2.gz NGVCGMXVFAVQPK-OAHLLOKOSA-N 1 2 313.832 4.217 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@@H]3CCc4ccc(Cl)nc43)ccc21 ZINC000788728448 1050734517 /nfs/dbraw/zinc/73/45/17/1050734517.db2.gz NGVCGMXVFAVQPK-OAHLLOKOSA-N 1 2 313.832 4.217 20 0 DIADLO CC1=CC[C@@H]([NH2+]c2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000788734634 1050741932 /nfs/dbraw/zinc/74/19/32/1050741932.db2.gz HMYPLFTUPVVZNL-IXDOHACOSA-N 1 2 300.446 4.211 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cc1cnc(Cl)c(F)c1 ZINC000846762888 1050745506 /nfs/dbraw/zinc/74/55/06/1050745506.db2.gz NLCCRKNYIACARW-UHFFFAOYSA-N 1 2 305.205 4.221 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1cnc(Cl)c(F)c1 ZINC000846762888 1050745519 /nfs/dbraw/zinc/74/55/19/1050745519.db2.gz NLCCRKNYIACARW-UHFFFAOYSA-N 1 2 305.205 4.221 20 0 DIADLO O[C@H](c1ccc(-c2cc(F)cc(Cn3cc[nH+]c3)c2)cc1)C1CC1 ZINC000846783702 1050752386 /nfs/dbraw/zinc/75/23/86/1050752386.db2.gz ZJRURDBDHMHGNM-HXUWFJFHSA-N 1 2 322.383 4.181 20 0 DIADLO Cc1cnc(=S)n(C[N@H+]2CCc3c(cccc3C(C)C)C2)c1 ZINC000788783478 1050752455 /nfs/dbraw/zinc/75/24/55/1050752455.db2.gz UIHAOSOIKGMWJN-UHFFFAOYSA-N 1 2 313.470 4.060 20 0 DIADLO Cc1cnc(=S)n(C[N@@H+]2CCc3c(cccc3C(C)C)C2)c1 ZINC000788783478 1050752467 /nfs/dbraw/zinc/75/24/67/1050752467.db2.gz UIHAOSOIKGMWJN-UHFFFAOYSA-N 1 2 313.470 4.060 20 0 DIADLO c1nsnc1C[NH+]1CCC(c2cccc3ccccc32)CC1 ZINC000846792200 1050752871 /nfs/dbraw/zinc/75/28/71/1050752871.db2.gz SQEFZGNRHWZHFY-UHFFFAOYSA-N 1 2 309.438 4.071 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1SC(C)(C)C)c1ncnn1C ZINC000788778090 1050753644 /nfs/dbraw/zinc/75/36/44/1050753644.db2.gz QUHIBGQLWGNKFU-QWHCGFSZSA-N 1 2 318.490 4.118 20 0 DIADLO Fc1cc(N2CCCCC2)ccc1Nc1ccn2cc[nH+]c2c1 ZINC001213839928 1050761009 /nfs/dbraw/zinc/76/10/09/1050761009.db2.gz GRQDRDPGHQFFAF-UHFFFAOYSA-N 1 2 310.376 4.207 20 0 DIADLO Fc1cc(N2CCCC2)ccc1Nc1ccccc1-n1cc[nH+]c1 ZINC001213849906 1050763774 /nfs/dbraw/zinc/76/37/74/1050763774.db2.gz RWQAUAPPOGYGKT-UHFFFAOYSA-N 1 2 322.387 4.355 20 0 DIADLO CCSc1nn(C[N@H+]2C[C@H](C)CCC[C@@H]2C)c(=S)s1 ZINC000742154454 1050805428 /nfs/dbraw/zinc/80/54/28/1050805428.db2.gz JRSDVFFTCUSROR-MNOVXSKESA-N 1 2 317.549 4.254 20 0 DIADLO c1cc(N2CCCC2)ccc1[NH2+][C@@H]1CCCC[C@@H]1[C@H]1CCOC1 ZINC000788986674 1050772148 /nfs/dbraw/zinc/77/21/48/1050772148.db2.gz YPTBAIIFKSVNES-PWIZWCRZSA-N 1 2 314.473 4.294 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CCCC[C@@H]1[C@H]1CCOC1 ZINC000788986674 1050772164 /nfs/dbraw/zinc/77/21/64/1050772164.db2.gz YPTBAIIFKSVNES-PWIZWCRZSA-N 1 2 314.473 4.294 20 0 DIADLO CC(C)CC[C@H]([NH2+]Cc1cnsn1)c1ccc(Cl)cc1 ZINC000846846937 1050773094 /nfs/dbraw/zinc/77/30/94/1050773094.db2.gz ZCPUGPAFOLYSGQ-HNNXBMFYSA-N 1 2 309.866 4.459 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846936786 1050783030 /nfs/dbraw/zinc/78/30/30/1050783030.db2.gz NFKHTUJBUIMHCB-WPRPVWTQSA-N 1 2 310.722 4.037 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846936786 1050783044 /nfs/dbraw/zinc/78/30/44/1050783044.db2.gz NFKHTUJBUIMHCB-WPRPVWTQSA-N 1 2 310.722 4.037 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)cnc1Cl ZINC000847000571 1050795527 /nfs/dbraw/zinc/79/55/27/1050795527.db2.gz LAKIAGRGMPAFCL-SECBINFHSA-N 1 2 310.722 4.039 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)cnc1Cl ZINC000847000571 1050795534 /nfs/dbraw/zinc/79/55/34/1050795534.db2.gz LAKIAGRGMPAFCL-SECBINFHSA-N 1 2 310.722 4.039 20 0 DIADLO Cl/C=C(/Cl)C[NH+]1CCC(c2ccc3cccnc3n2)CC1 ZINC000847034168 1050796291 /nfs/dbraw/zinc/79/62/91/1050796291.db2.gz LVAQYLSTQZEVEX-GXDHUFHOSA-N 1 2 322.239 4.128 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)[NH2+]CCOc1ccccc1-c1ccccc1 ZINC000180294243 1050801902 /nfs/dbraw/zinc/80/19/02/1050801902.db2.gz JENTYQLLLWCTPM-OAHLLOKOSA-N 1 2 321.424 4.115 20 0 DIADLO COC(=O)c1c(F)cccc1Nc1ccc2c(C)cc[nH+]c2c1 ZINC001214052341 1050804718 /nfs/dbraw/zinc/80/47/18/1050804718.db2.gz IQXVGLBVJDRTQW-UHFFFAOYSA-N 1 2 310.328 4.213 20 0 DIADLO CCSc1nn(C[N@@H+]2C[C@H](C)CCC[C@@H]2C)c(=S)s1 ZINC000742154454 1050805417 /nfs/dbraw/zinc/80/54/17/1050805417.db2.gz JRSDVFFTCUSROR-MNOVXSKESA-N 1 2 317.549 4.254 20 0 DIADLO COc1cc(F)c(Nc2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC001214062589 1050807735 /nfs/dbraw/zinc/80/77/35/1050807735.db2.gz AQWAZVBBVPLBOG-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO CN(c1ccc(N(C)C2CCCCC2)[nH+]c1)c1cccc(N)c1 ZINC001212615172 1050810073 /nfs/dbraw/zinc/81/00/73/1050810073.db2.gz LDMLPNDQHFRJMP-UHFFFAOYSA-N 1 2 310.445 4.201 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1sc(C)nc1C ZINC000742349542 1050823369 /nfs/dbraw/zinc/82/33/69/1050823369.db2.gz ZXXDOGRWQZNUEF-UHFFFAOYSA-N 1 2 314.458 4.370 20 0 DIADLO COCOc1ccc(C)cc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001214240205 1050853925 /nfs/dbraw/zinc/85/39/25/1050853925.db2.gz ZISXIVXILIMHNR-UHFFFAOYSA-N 1 2 317.776 4.022 20 0 DIADLO CCCCC[C@@H](C)CC(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC000742597263 1050900475 /nfs/dbraw/zinc/90/04/75/1050900475.db2.gz RVHQERGOZSJDHQ-CQSZACIVSA-N 1 2 320.477 4.272 20 0 DIADLO CCCCCC[C@@](C)(CC)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000742634338 1050907948 /nfs/dbraw/zinc/90/79/48/1050907948.db2.gz NXBRMYFMGNHFMZ-IEBWSBKVSA-N 1 2 319.493 4.433 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C[C@@H]3CCc4ccccc43)cc2)CCO1 ZINC000790052575 1050910249 /nfs/dbraw/zinc/91/02/49/1050910249.db2.gz GXXIZZMDQXPGQS-AEFFLSMTSA-N 1 2 322.452 4.054 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000790154856 1050920379 /nfs/dbraw/zinc/92/03/79/1050920379.db2.gz MCFWAVRVYKQFFJ-SJLPKXTDSA-N 1 2 318.461 4.058 20 0 DIADLO Oc1c(F)cc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC001214486487 1050920356 /nfs/dbraw/zinc/92/03/56/1050920356.db2.gz KCJUFWXAXBATDG-UHFFFAOYSA-N 1 2 303.724 4.114 20 0 DIADLO CSc1cc(Nc2ccc(CO)c(C(F)(F)F)c2)cc[nH+]1 ZINC001214681088 1050978772 /nfs/dbraw/zinc/97/87/72/1050978772.db2.gz CSPMBCSHTIIQDK-UHFFFAOYSA-N 1 2 314.332 4.058 20 0 DIADLO CCOc1cc(Nc2c(F)ccc(C(C)=O)c2F)cc(C)[nH+]1 ZINC001214758024 1050993952 /nfs/dbraw/zinc/99/39/52/1050993952.db2.gz HKKMVXDIVTYLEG-UHFFFAOYSA-N 1 2 306.312 4.013 20 0 DIADLO CCSCc1cc[nH+]c(N[C@@H]2CCCC23CCOCC3)c1 ZINC000282750603 1050999253 /nfs/dbraw/zinc/99/92/53/1050999253.db2.gz NSWIMZBGMJMDIN-OAHLLOKOSA-N 1 2 306.475 4.096 20 0 DIADLO c1coc(C2CC[NH+](Cc3csc(C4CCCC4)n3)CC2)n1 ZINC000585576708 1051007893 /nfs/dbraw/zinc/00/78/93/1051007893.db2.gz CILNYMZUOFPEKZ-UHFFFAOYSA-N 1 2 317.458 4.168 20 0 DIADLO OCc1cc(Nc2cccc(C3CC3)[nH+]2)ccc1OC(F)(F)F ZINC001214829053 1051011954 /nfs/dbraw/zinc/01/19/54/1051011954.db2.gz ZDMPBKQJGXFXGF-UHFFFAOYSA-N 1 2 324.302 4.094 20 0 DIADLO Cc1nn(C[N@@H+]2CCCC3(C2)CCCCCC3)c(=S)s1 ZINC000743385517 1051021694 /nfs/dbraw/zinc/02/16/94/1051021694.db2.gz KIVDGJWLSBMOLJ-UHFFFAOYSA-N 1 2 311.520 4.376 20 0 DIADLO Cc1nn(C[N@H+]2CCCC3(C2)CCCCCC3)c(=S)s1 ZINC000743385517 1051021704 /nfs/dbraw/zinc/02/17/04/1051021704.db2.gz KIVDGJWLSBMOLJ-UHFFFAOYSA-N 1 2 311.520 4.376 20 0 DIADLO COc1c(F)cc(Nc2ccc(N3CCCC3)[nH+]c2)cc1Cl ZINC001214968907 1051038502 /nfs/dbraw/zinc/03/85/02/1051038502.db2.gz JKWHUUBJDJYFLX-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(C(C)=O)c(F)c2F)cc1 ZINC001214991253 1051048277 /nfs/dbraw/zinc/04/82/77/1051048277.db2.gz GGHTZOPWOHOUNA-UHFFFAOYSA-N 1 2 304.340 4.367 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(C(C)=O)c(F)c2F)cc1 ZINC001214991253 1051048282 /nfs/dbraw/zinc/04/82/82/1051048282.db2.gz GGHTZOPWOHOUNA-UHFFFAOYSA-N 1 2 304.340 4.367 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)nc(Cl)c1 ZINC000791583145 1051060712 /nfs/dbraw/zinc/06/07/12/1051060712.db2.gz LKWZZRANETYELB-VXNVDRBHSA-N 1 2 313.150 4.161 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(Cl)nc(Cl)c1 ZINC000791583145 1051060721 /nfs/dbraw/zinc/06/07/21/1051060721.db2.gz LKWZZRANETYELB-VXNVDRBHSA-N 1 2 313.150 4.161 20 0 DIADLO Cc1nnc(C[NH2+]Cc2ccc(-c3cccc(C)c3)cc2)s1 ZINC000773205653 1051109759 /nfs/dbraw/zinc/10/97/59/1051109759.db2.gz DPBGAEXRTNJLHZ-UHFFFAOYSA-N 1 2 309.438 4.112 20 0 DIADLO Cc1cc(C)cc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)c1 ZINC001215190366 1051109728 /nfs/dbraw/zinc/10/97/28/1051109728.db2.gz MRBXKPULSNIELF-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO CC(C)c1ccc(-c2noc(C[NH2+][C@H](C)c3cccnc3)n2)cc1 ZINC000181373135 1051134297 /nfs/dbraw/zinc/13/42/97/1051134297.db2.gz IKXFCVPUZPRFHJ-CQSZACIVSA-N 1 2 322.412 4.106 20 0 DIADLO COCOc1ccc(Nc2cccc(C3CC3)[nH+]2)cc1Cl ZINC001215257860 1051137703 /nfs/dbraw/zinc/13/77/03/1051137703.db2.gz XVUVXIMEAUOWRC-UHFFFAOYSA-N 1 2 304.777 4.339 20 0 DIADLO CCCc1cc[nH+]c(Nc2ccc(OCOC)c(Cl)c2)c1 ZINC001215257834 1051138104 /nfs/dbraw/zinc/13/81/04/1051138104.db2.gz WXVDSNNRXFNYIK-UHFFFAOYSA-N 1 2 306.793 4.414 20 0 DIADLO Fc1ccc(NCC2(c3ccccc3)CC2)cc1-n1cc[nH+]c1 ZINC001171466357 1051148125 /nfs/dbraw/zinc/14/81/25/1051148125.db2.gz WJSVXJXQWWYFNA-UHFFFAOYSA-N 1 2 307.372 4.155 20 0 DIADLO C[C@@H](Cc1ccccc1Cl)[NH2+]CC(F)(F)c1ccccn1 ZINC001170257343 1051166549 /nfs/dbraw/zinc/16/65/49/1051166549.db2.gz ZARPSLQZQLAQFJ-LBPRGKRZSA-N 1 2 310.775 4.048 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC001170254803 1051175468 /nfs/dbraw/zinc/17/54/68/1051175468.db2.gz WZMBJULYJBZNFI-KGLIPLIRSA-N 1 2 318.219 4.276 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC001170254803 1051175472 /nfs/dbraw/zinc/17/54/72/1051175472.db2.gz WZMBJULYJBZNFI-KGLIPLIRSA-N 1 2 318.219 4.276 20 0 DIADLO CC[C@H]1C[C@H](C)C[N@@H+]1Cn1nc(-c2sccc2C)oc1=S ZINC000744439656 1051176969 /nfs/dbraw/zinc/17/69/69/1051176969.db2.gz BPHBUOIHAAMAEC-JQWIXIFHSA-N 1 2 323.487 4.320 20 0 DIADLO CC[C@H]1C[C@H](C)C[N@H+]1Cn1nc(-c2sccc2C)oc1=S ZINC000744439656 1051176978 /nfs/dbraw/zinc/17/69/78/1051176978.db2.gz BPHBUOIHAAMAEC-JQWIXIFHSA-N 1 2 323.487 4.320 20 0 DIADLO FC1C[NH+](C2CCC(c3ccc(Br)cc3)CC2)C1 ZINC001171650429 1051184334 /nfs/dbraw/zinc/18/43/34/1051184334.db2.gz SYLKNYXRECFJFD-UHFFFAOYSA-N 1 2 312.226 4.129 20 0 DIADLO Cc1cc(CNc2ccc([NH+]3CCCC3)cc2)cc(Cl)n1 ZINC000401868114 1051187902 /nfs/dbraw/zinc/18/79/02/1051187902.db2.gz AHMLOFBLLNQCCF-UHFFFAOYSA-N 1 2 301.821 4.256 20 0 DIADLO CC1(C)CC(Nc2ccc(F)c(-n3cc[nH+]c3)c2)CC(C)(C)O1 ZINC001170363178 1051191663 /nfs/dbraw/zinc/19/16/63/1051191663.db2.gz SNRGJGBLPBUWDS-UHFFFAOYSA-N 1 2 317.408 4.160 20 0 DIADLO Fc1ccc([C@H]2COCC[N@@H+]2CC[C@H]2CCCC2(F)F)cc1 ZINC001170341600 1051192701 /nfs/dbraw/zinc/19/27/01/1051192701.db2.gz ARWJVPHBLNJSEY-GDBMZVCRSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1ccc([C@H]2COCC[N@H+]2CC[C@H]2CCCC2(F)F)cc1 ZINC001170341600 1051192709 /nfs/dbraw/zinc/19/27/09/1051192709.db2.gz ARWJVPHBLNJSEY-GDBMZVCRSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1ccc([C@@H]2COCC[N@@H+]2C[C@@H]2CCCCC2(F)F)cc1 ZINC001170342463 1051192722 /nfs/dbraw/zinc/19/27/22/1051192722.db2.gz NUVZFAOPWGYGPO-HOCLYGCPSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1ccc([C@@H]2COCC[N@H+]2C[C@@H]2CCCCC2(F)F)cc1 ZINC001170342463 1051192729 /nfs/dbraw/zinc/19/27/29/1051192729.db2.gz NUVZFAOPWGYGPO-HOCLYGCPSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1ccc([C@@H]2COCC[N@@H+]2CC[C@@H]2CCCC2(F)F)cc1 ZINC001170341603 1051193207 /nfs/dbraw/zinc/19/32/07/1051193207.db2.gz ARWJVPHBLNJSEY-HOCLYGCPSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1ccc([C@@H]2COCC[N@H+]2CC[C@@H]2CCCC2(F)F)cc1 ZINC001170341603 1051193215 /nfs/dbraw/zinc/19/32/15/1051193215.db2.gz ARWJVPHBLNJSEY-HOCLYGCPSA-N 1 2 313.363 4.025 20 0 DIADLO CCOc1c(F)c(F)ccc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001215412844 1051193285 /nfs/dbraw/zinc/19/32/85/1051193285.db2.gz CDOVZCMQEMLWAV-UHFFFAOYSA-N 1 2 323.730 4.408 20 0 DIADLO Fc1ccc([C@@H]2COCC[N@@H+]2C[C@H]2CCCCC2(F)F)cc1 ZINC001170342465 1051193970 /nfs/dbraw/zinc/19/39/70/1051193970.db2.gz NUVZFAOPWGYGPO-ZBFHGGJFSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1ccc([C@@H]2COCC[N@H+]2C[C@H]2CCCCC2(F)F)cc1 ZINC001170342465 1051193979 /nfs/dbraw/zinc/19/39/79/1051193979.db2.gz NUVZFAOPWGYGPO-ZBFHGGJFSA-N 1 2 313.363 4.025 20 0 DIADLO CCOc1c(F)c(F)ccc1Nc1ccccc1-n1cc[nH+]c1 ZINC001215415341 1051194926 /nfs/dbraw/zinc/19/49/26/1051194926.db2.gz PAEHPHMQNPOFRL-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1c(F)cc(C2OCCO2)cc1F ZINC001215437123 1051206256 /nfs/dbraw/zinc/20/62/56/1051206256.db2.gz ZTKXPDSUVHHPAQ-UHFFFAOYSA-N 1 2 320.339 4.020 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2cccc(C(F)(F)F)c2)[C@@H](CC)CO1 ZINC001171778813 1051213375 /nfs/dbraw/zinc/21/33/75/1051213375.db2.gz PUNBDDIWVKODMR-LSDHHAIUSA-N 1 2 301.352 4.095 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2)[C@@H](CC)CO1 ZINC001171778813 1051213380 /nfs/dbraw/zinc/21/33/80/1051213380.db2.gz PUNBDDIWVKODMR-LSDHHAIUSA-N 1 2 301.352 4.095 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000792821264 1051215377 /nfs/dbraw/zinc/21/53/77/1051215377.db2.gz CKVJFFBFYXRXSP-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000792821264 1051215393 /nfs/dbraw/zinc/21/53/93/1051215393.db2.gz CKVJFFBFYXRXSP-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)[C@H]1CCC[C@@H]([NH2+]c2ccc(N3CCC(O)CC3)cc2)C1 ZINC000792849927 1051221385 /nfs/dbraw/zinc/22/13/85/1051221385.db2.gz UNOWHDPZHDMJKB-FUHWJXTLSA-N 1 2 316.489 4.274 20 0 DIADLO Cc1ccccc1-n1nccc1CNc1ccc([NH+](C)C)cc1C ZINC000792841238 1051221801 /nfs/dbraw/zinc/22/18/01/1051221801.db2.gz LYVVIZCSHCMKFS-UHFFFAOYSA-N 1 2 320.440 4.167 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)OCc1c(C)cccc1C)c1ccccc1 ZINC000745097461 1051221986 /nfs/dbraw/zinc/22/19/86/1051221986.db2.gz DAERQQSNTNJNGJ-IBGZPJMESA-N 1 2 311.425 4.040 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)OCc1c(C)cccc1C)c1ccccc1 ZINC000745097461 1051221994 /nfs/dbraw/zinc/22/19/94/1051221994.db2.gz DAERQQSNTNJNGJ-IBGZPJMESA-N 1 2 311.425 4.040 20 0 DIADLO C[C@H]1COCCC[N@@H+]1Cn1c(-c2ccccc2)csc1=S ZINC000772822738 1051227416 /nfs/dbraw/zinc/22/74/16/1051227416.db2.gz QLTUDPVGUSTVMQ-ZDUSSCGKSA-N 1 2 320.483 4.014 20 0 DIADLO C[C@H]1COCCC[N@H+]1Cn1c(-c2ccccc2)csc1=S ZINC000772822738 1051227424 /nfs/dbraw/zinc/22/74/24/1051227424.db2.gz QLTUDPVGUSTVMQ-ZDUSSCGKSA-N 1 2 320.483 4.014 20 0 DIADLO COCc1cc(C)c(Nc2cccc(-n3cc[nH+]c3)c2)c(C)c1 ZINC001215530296 1051234212 /nfs/dbraw/zinc/23/42/12/1051234212.db2.gz MUUUPUOCZWXUHM-UHFFFAOYSA-N 1 2 307.397 4.379 20 0 DIADLO Cc1cccc(Nc2ccc3cnn([C@@H]4CCCCO4)c3c2)[nH+]1 ZINC001215560073 1051243187 /nfs/dbraw/zinc/24/31/87/1051243187.db2.gz ZLXHTPGSXXWUIG-SFHVURJKSA-N 1 2 308.385 4.182 20 0 DIADLO Cc1ccc[nH+]c1Nc1ccc2cnn([C@H]3CCCCO3)c2c1 ZINC001215560087 1051244169 /nfs/dbraw/zinc/24/41/69/1051244169.db2.gz ZXZPLSRODIGLQR-QGZVFWFLSA-N 1 2 308.385 4.182 20 0 DIADLO CCCOc1ccc(F)c(Nc2cccc3[nH+]c(C)cn32)c1F ZINC001215567587 1051247125 /nfs/dbraw/zinc/24/71/25/1051247125.db2.gz KWDWBQXEBAJOTQ-UHFFFAOYSA-N 1 2 317.339 4.453 20 0 DIADLO CC[C@H]1CCCC[C@@H]1C(=O)Nc1nc(C[NH+](CC)CC)cs1 ZINC000793154768 1051254049 /nfs/dbraw/zinc/25/40/49/1051254049.db2.gz SPLYDZIZITXGGZ-ZFWWWQNUSA-N 1 2 323.506 4.140 20 0 DIADLO Oc1cc(C(F)(F)F)ccc1Nc1ccccc1-n1cc[nH+]c1 ZINC001212632595 1051259119 /nfs/dbraw/zinc/25/91/19/1051259119.db2.gz JUSQTHQEAIKHRH-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H](C)c2ccccn2)nc2ccccc12 ZINC000182645047 1051260587 /nfs/dbraw/zinc/26/05/87/1051260587.db2.gz HJOCWYSUHXKUOE-ZDUSSCGKSA-N 1 2 311.816 4.442 20 0 DIADLO COc1c(F)c(C)ccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001215602845 1051270728 /nfs/dbraw/zinc/27/07/28/1051270728.db2.gz CWOMGXBGBSKELM-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)c(C)o1 ZINC000793251256 1051273279 /nfs/dbraw/zinc/27/32/79/1051273279.db2.gz PSWNXPHUSBTBOT-HXUWFJFHSA-N 1 2 306.409 4.479 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2ccc(C)cc2)c2ccccn2)c(C)o1 ZINC000793251252 1051273364 /nfs/dbraw/zinc/27/33/64/1051273364.db2.gz PSWNXPHUSBTBOT-FQEVSTJZSA-N 1 2 306.409 4.479 20 0 DIADLO Cc1ccc(-c2nc(C[NH+]3CCC(F)(F)CC3)cs2)cc1 ZINC000793353849 1051286037 /nfs/dbraw/zinc/28/60/37/1051286037.db2.gz WKSXJIGSYCLTLT-UHFFFAOYSA-N 1 2 308.397 4.350 20 0 DIADLO Cc1cc[nH+]c(Nc2ccc(C(=O)N(C(C)C)C(C)C)cc2)c1 ZINC001215655529 1051290288 /nfs/dbraw/zinc/29/02/88/1051290288.db2.gz NMAKHEACOOAOJF-UHFFFAOYSA-N 1 2 311.429 4.393 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(C2CC2)n1)c1ccc(-c2ccncc2)cc1 ZINC000746053012 1051313819 /nfs/dbraw/zinc/31/38/19/1051313819.db2.gz IGYVKYXIIODAGE-CQSZACIVSA-N 1 2 319.408 4.465 20 0 DIADLO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]c2ccc(N(C)C)cc2)cc1 ZINC000793541245 1051314041 /nfs/dbraw/zinc/31/40/41/1051314041.db2.gz CZEQQJGMDULAFB-JSNMRZPZSA-N 1 2 310.441 4.365 20 0 DIADLO COc1ccc([C@H]2C[C@@H]2[C@@H](C)Nc2ccc([NH+](C)C)cc2)cc1 ZINC000793541245 1051314049 /nfs/dbraw/zinc/31/40/49/1051314049.db2.gz CZEQQJGMDULAFB-JSNMRZPZSA-N 1 2 310.441 4.365 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(F)c(OC(C)C)c2F)[nH+]1 ZINC001215726577 1051326077 /nfs/dbraw/zinc/32/60/77/1051326077.db2.gz QYJZDFJREIYWOT-UHFFFAOYSA-N 1 2 317.339 4.452 20 0 DIADLO CC(C)([NH2+]Cc1nnc(C2CC2)o1)c1ccc2ccccc2c1 ZINC000626116243 1051344249 /nfs/dbraw/zinc/34/42/49/1051344249.db2.gz VRRWSRBRXFQFJM-UHFFFAOYSA-N 1 2 307.397 4.125 20 0 DIADLO Cn1c(NCc2cccc3cnccc32)[nH+]c2cccc(Cl)c21 ZINC000184311966 1051344963 /nfs/dbraw/zinc/34/49/63/1051344963.db2.gz NKYFLAYKVFFTQP-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO c1c[nH+]c(Nc2ccc(C3CCOCC3)cc2)c(N2CCCC2)c1 ZINC001212652193 1051347725 /nfs/dbraw/zinc/34/77/25/1051347725.db2.gz BWEIMONWEZKEKD-UHFFFAOYSA-N 1 2 323.440 4.319 20 0 DIADLO COc1cc[nH+]cc1Nc1cnc(OCc2ccccc2)cc1C ZINC001215778221 1051362648 /nfs/dbraw/zinc/36/26/48/1051362648.db2.gz WSWYJSHKYYEIQW-UHFFFAOYSA-N 1 2 321.380 4.116 20 0 DIADLO FC(F)C1([NH2+]Cc2cc(Br)cs2)CCCC1 ZINC000381514670 1051371758 /nfs/dbraw/zinc/37/17/58/1051371758.db2.gz ZMXIDFHJUPFVMV-UHFFFAOYSA-N 1 2 310.207 4.178 20 0 DIADLO C[N@H+](Cc1nccn1C(F)F)Cc1ccc2ccccc2c1 ZINC000194581198 1051377625 /nfs/dbraw/zinc/37/76/25/1051377625.db2.gz PHTJQRLGFNVZKA-UHFFFAOYSA-N 1 2 301.340 4.063 20 0 DIADLO C[N@@H+](Cc1nccn1C(F)F)Cc1ccc2ccccc2c1 ZINC000194581198 1051377639 /nfs/dbraw/zinc/37/76/39/1051377639.db2.gz PHTJQRLGFNVZKA-UHFFFAOYSA-N 1 2 301.340 4.063 20 0 DIADLO S=c1sc(C2CC2)nn1C[N@@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000746378946 1051388243 /nfs/dbraw/zinc/38/82/43/1051388243.db2.gz XRQYSECTDNWCSX-MRXNPFEDSA-N 1 2 321.515 4.331 20 0 DIADLO S=c1sc(C2CC2)nn1C[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000746378946 1051388249 /nfs/dbraw/zinc/38/82/49/1051388249.db2.gz XRQYSECTDNWCSX-MRXNPFEDSA-N 1 2 321.515 4.331 20 0 DIADLO CCO[C@H]1C[C@H](Nc2cccc(-n3cc[nH+]c3)c2)C12CCCC2 ZINC000390962242 1051405994 /nfs/dbraw/zinc/40/59/94/1051405994.db2.gz ZUJJCSPEPJTFDH-ROUUACIJSA-N 1 2 311.429 4.022 20 0 DIADLO CSc1cc(F)c(Nc2ccc(N3CCCC3)[nH+]c2)c(F)c1 ZINC001215841747 1051406065 /nfs/dbraw/zinc/40/60/65/1051406065.db2.gz YSKFIHAZWUQEFC-UHFFFAOYSA-N 1 2 321.396 4.426 20 0 DIADLO CSc1cc(F)c(Nc2ccc3c(c2)[nH+]cn3C)c(F)c1 ZINC001215843844 1051408557 /nfs/dbraw/zinc/40/85/57/1051408557.db2.gz VSQIGMVUDXQYIW-UHFFFAOYSA-N 1 2 305.353 4.317 20 0 DIADLO CC[C@H](Nc1[nH+]cnc2c1cnn2C(C)(C)C)c1ccccc1 ZINC000766403296 1051414860 /nfs/dbraw/zinc/41/48/60/1051414860.db2.gz LLLPAZAUDIPTFI-HNNXBMFYSA-N 1 2 309.417 4.145 20 0 DIADLO Cc1ncc2c(n1)CCC[C@@H]2Nc1cc[nH+]c2c(Cl)cccc12 ZINC000804465040 1051421570 /nfs/dbraw/zinc/42/15/70/1051421570.db2.gz AICGRYWNAKRISZ-INIZCTEOSA-N 1 2 324.815 4.476 20 0 DIADLO Cc1[nH+]c(C(C)(C)C)nc(NCCCCc2ccccn2)c1C ZINC001168792820 1051423259 /nfs/dbraw/zinc/42/32/59/1051423259.db2.gz DVVUQGHOHWNHKR-UHFFFAOYSA-N 1 2 312.461 4.221 20 0 DIADLO CSc1cccc(Nc2ccc(N3CCCC3)[nH+]c2)c1F ZINC001215868688 1051425162 /nfs/dbraw/zinc/42/51/62/1051425162.db2.gz ZMKZRUFYLQAHFP-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ncc(-c3cccs3)o2)c(C)o1 ZINC000183818666 1051430682 /nfs/dbraw/zinc/43/06/82/1051430682.db2.gz UINRPJMEOWVYLS-LLVKDONJSA-N 1 2 302.399 4.464 20 0 DIADLO CCC[C@H]1CCC[N@H+](Cn2nc(C3CC3)n(C3CC3)c2=S)C1 ZINC000121322743 1051441897 /nfs/dbraw/zinc/44/18/97/1051441897.db2.gz YCFOMFNNIIHODR-ZDUSSCGKSA-N 1 2 320.506 4.096 20 0 DIADLO CCC[C@H]1CCC[N@@H+](Cn2nc(C3CC3)n(C3CC3)c2=S)C1 ZINC000121322743 1051441901 /nfs/dbraw/zinc/44/19/01/1051441901.db2.gz YCFOMFNNIIHODR-ZDUSSCGKSA-N 1 2 320.506 4.096 20 0 DIADLO C[C@@H](C[C@@H](O)c1ccco1)Nc1cc[nH+]c2c(Cl)cccc12 ZINC000804549348 1051444772 /nfs/dbraw/zinc/44/47/72/1051444772.db2.gz AXZZAMLSKKOJIZ-XHDPSFHLSA-N 1 2 316.788 4.405 20 0 DIADLO CC[C@H](CC(=O)Nc1ccn2cc[nH+]c2c1)c1ccc(C)cc1 ZINC001129594865 1051453571 /nfs/dbraw/zinc/45/35/71/1051453571.db2.gz YEDZKSIFFIARAP-OAHLLOKOSA-N 1 2 307.397 4.165 20 0 DIADLO CSc1c(F)cc(Nc2ccc3c(c2)[nH+]cn3C)cc1F ZINC001215924962 1051460293 /nfs/dbraw/zinc/46/02/93/1051460293.db2.gz LKVREWKIOVNOBY-UHFFFAOYSA-N 1 2 305.353 4.317 20 0 DIADLO CSc1c(F)cc(Nc2cccc3[nH+]c(C)cn32)cc1F ZINC001215923005 1051460368 /nfs/dbraw/zinc/46/03/68/1051460368.db2.gz JSLSRIMSBGTJSI-UHFFFAOYSA-N 1 2 305.353 4.386 20 0 DIADLO Cc1ccc2cccc(Nc3ccc(C[NH+]4CC(O)C4)cc3)c2c1 ZINC001212671038 1051465001 /nfs/dbraw/zinc/46/50/01/1051465001.db2.gz CWHJDOWAOSSYGQ-UHFFFAOYSA-N 1 2 318.420 4.068 20 0 DIADLO Cc1cccc2cccc(Nc3ccc(C[NH+]4CC(O)C4)cc3)c12 ZINC001212673665 1051465474 /nfs/dbraw/zinc/46/54/74/1051465474.db2.gz SVHAICBIOPIIMS-UHFFFAOYSA-N 1 2 318.420 4.068 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CC[C@@H]3C[C@@H]32)cc(C(F)(F)F)c1 ZINC001168910872 1051465891 /nfs/dbraw/zinc/46/58/91/1051465891.db2.gz ISGLZDOOSXATGY-SKDRFNHKSA-N 1 2 309.253 4.318 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CC[C@@H]3C[C@@H]32)cc(C(F)(F)F)c1 ZINC001168910872 1051465893 /nfs/dbraw/zinc/46/58/93/1051465893.db2.gz ISGLZDOOSXATGY-SKDRFNHKSA-N 1 2 309.253 4.318 20 0 DIADLO c1ccc(CSCC[N@@H+]2CCc3c4ccccc4[nH]c3C2)cc1 ZINC001168917786 1051467890 /nfs/dbraw/zinc/46/78/90/1051467890.db2.gz AJNPKVXBAQZGHD-UHFFFAOYSA-N 1 2 322.477 4.459 20 0 DIADLO c1ccc(CSCC[N@H+]2CCc3c4ccccc4[nH]c3C2)cc1 ZINC001168917786 1051467895 /nfs/dbraw/zinc/46/78/95/1051467895.db2.gz AJNPKVXBAQZGHD-UHFFFAOYSA-N 1 2 322.477 4.459 20 0 DIADLO CC(C)(C)C1=CC[N@H+](CC(=O)Nc2ccc(F)c(Cl)c2)CC1 ZINC001168933870 1051470233 /nfs/dbraw/zinc/47/02/33/1051470233.db2.gz RICXCEJNFJWTMA-UHFFFAOYSA-N 1 2 324.827 4.096 20 0 DIADLO CC(C)(C)C1=CC[N@@H+](CC(=O)Nc2ccc(F)c(Cl)c2)CC1 ZINC001168933870 1051470237 /nfs/dbraw/zinc/47/02/37/1051470237.db2.gz RICXCEJNFJWTMA-UHFFFAOYSA-N 1 2 324.827 4.096 20 0 DIADLO Cc1ccc2ccc(NCCc3cn4ccccc4[nH+]3)cc2c1 ZINC001169009213 1051487475 /nfs/dbraw/zinc/48/74/75/1051487475.db2.gz PDEOYCYUNIPAJN-UHFFFAOYSA-N 1 2 301.393 4.451 20 0 DIADLO COc1cc2ccccc2cc1NCCc1cn2ccccc2[nH+]1 ZINC001169009158 1051488072 /nfs/dbraw/zinc/48/80/72/1051488072.db2.gz NLRWDPQFZJWROR-UHFFFAOYSA-N 1 2 317.392 4.151 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(Cl)c(OC)c2F)c[nH+]1 ZINC001212584125 1051495700 /nfs/dbraw/zinc/49/57/00/1051495700.db2.gz PVHOQJJZBGZXGW-UHFFFAOYSA-N 1 2 309.772 4.082 20 0 DIADLO CCC(C)(C)c1ccccc1C(=O)NCc1c[nH+]c(C)cc1C ZINC001129715422 1051496305 /nfs/dbraw/zinc/49/63/05/1051496305.db2.gz UXSUOVLHVGAHEE-UHFFFAOYSA-N 1 2 310.441 4.316 20 0 DIADLO COc1c(Cl)ccc(Nc2ccc(N3CCCC3)[nH+]c2)c1F ZINC001212583938 1051508587 /nfs/dbraw/zinc/50/85/87/1051508587.db2.gz IEEIKLOQYCZUCY-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO CC(C)c1nc(C[NH+]2CCC(Oc3ccccc3)CC2)cs1 ZINC000064795158 1051508697 /nfs/dbraw/zinc/50/86/97/1051508697.db2.gz FKIQNVPHAOWWKE-UHFFFAOYSA-N 1 2 316.470 4.310 20 0 DIADLO Cc1cccc(CNc2cc3cc[nH]c3c[nH+]2)c1Br ZINC000804645953 1051509141 /nfs/dbraw/zinc/50/91/41/1051509141.db2.gz HCQDSTXSTJDMJJ-UHFFFAOYSA-N 1 2 316.202 4.246 20 0 DIADLO COc1c(C)cc(C)cc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001215998429 1051513716 /nfs/dbraw/zinc/51/37/16/1051513716.db2.gz KBELFOVMHYGVAO-UHFFFAOYSA-N 1 2 307.397 4.300 20 0 DIADLO CCCCN(C(=O)Nc1cc(C)[nH+]cc1C)[C@H]1CCC[C@@H](C)C1 ZINC001216003156 1051519056 /nfs/dbraw/zinc/51/90/56/1051519056.db2.gz CLKXBTXUXSBWRB-PBHICJAKSA-N 1 2 317.477 4.333 20 0 DIADLO Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H](C)c1noc(-c2ccccc2)n1 ZINC000766603035 1051525241 /nfs/dbraw/zinc/52/52/41/1051525241.db2.gz VKIOPCFFNSIAHN-KSSFIOAISA-N 1 2 319.408 4.383 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+]([C@H](C)Cc1ccc(F)cc1Cl)C2 ZINC001172867937 1051526234 /nfs/dbraw/zinc/52/62/34/1051526234.db2.gz CMRMLTRRZHZPGG-GFCCVEGCSA-N 1 2 304.796 4.129 20 0 DIADLO Cc1cc2c(cn1)C[N@H+]([C@H](C)Cc1ccc(F)cc1Cl)C2 ZINC001172867937 1051526246 /nfs/dbraw/zinc/52/62/46/1051526246.db2.gz CMRMLTRRZHZPGG-GFCCVEGCSA-N 1 2 304.796 4.129 20 0 DIADLO CSc1ncc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC001216028231 1051533728 /nfs/dbraw/zinc/53/37/28/1051533728.db2.gz QIGBGGBDQNIHAP-UHFFFAOYSA-N 1 2 316.817 4.386 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001172847475 1051534165 /nfs/dbraw/zinc/53/41/65/1051534165.db2.gz MRFXZBAIWFNYEN-YGRLFVJLSA-N 1 2 323.761 4.479 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001172847475 1051534173 /nfs/dbraw/zinc/53/41/73/1051534173.db2.gz MRFXZBAIWFNYEN-YGRLFVJLSA-N 1 2 323.761 4.479 20 0 DIADLO Nc1ccc(Nc2cccc(C3CC3)[nH+]2)cc1OC(F)(F)F ZINC001216031926 1051536511 /nfs/dbraw/zinc/53/65/11/1051536511.db2.gz ORALXIYZQMPBCO-UHFFFAOYSA-N 1 2 309.291 4.183 20 0 DIADLO Cc1ccc2c(ccc(C)c2C(=O)NCc2cc(C)[nH+]c(C)c2)c1 ZINC001129857581 1051542142 /nfs/dbraw/zinc/54/21/42/1051542142.db2.gz BAJCDIAIZPQYFE-UHFFFAOYSA-N 1 2 318.420 4.398 20 0 DIADLO Cc1cc(NCc2c(Cl)cncc2Cl)ccc1[NH+](C)C ZINC001169186767 1051543145 /nfs/dbraw/zinc/54/31/45/1051543145.db2.gz TZCATZFGMOUTMV-UHFFFAOYSA-N 1 2 310.228 4.375 20 0 DIADLO Clc1cncc(Cl)c1CNc1ccc(-n2cccc2)c[nH+]1 ZINC001169183129 1051548603 /nfs/dbraw/zinc/54/86/03/1051548603.db2.gz CYLGLFYHPYAAFI-UHFFFAOYSA-N 1 2 319.195 4.186 20 0 DIADLO Nc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)cc1C(F)(F)F ZINC001216051501 1051549186 /nfs/dbraw/zinc/54/91/86/1051549186.db2.gz OYNBNRLCPTVAJH-UHFFFAOYSA-N 1 2 318.302 4.217 20 0 DIADLO FC1(F)CCC[C@@H](Nc2cccc(Cc3ccncc3)[nH+]2)C1 ZINC001169213515 1051550275 /nfs/dbraw/zinc/55/02/75/1051550275.db2.gz JTKGNLVQWOINDZ-OAHLLOKOSA-N 1 2 303.356 4.057 20 0 DIADLO FC1(F)CCC[C@H](Nc2cc3c4c(c2)CCC[NH+]4CCC3)C1 ZINC001169217341 1051555315 /nfs/dbraw/zinc/55/53/15/1051555315.db2.gz FRBUWFKGVAPHRE-HNNXBMFYSA-N 1 2 306.400 4.375 20 0 DIADLO FC1(F)CCC[C@H]([NH2+]c2cc3c4c(c2)CCCN4CCC3)C1 ZINC001169217341 1051555322 /nfs/dbraw/zinc/55/53/22/1051555322.db2.gz FRBUWFKGVAPHRE-HNNXBMFYSA-N 1 2 306.400 4.375 20 0 DIADLO CN(C)c1ccc(Nc2cccc(-n3cc[nH+]c3)c2)cc1Cl ZINC001216061668 1051557919 /nfs/dbraw/zinc/55/79/19/1051557919.db2.gz YCKVMJKLDJWWHU-UHFFFAOYSA-N 1 2 312.804 4.335 20 0 DIADLO Cc1ccccc1-c1nc(C[N@@H+](C)[C@H]2CCc3ccccc32)no1 ZINC000178044446 1051558146 /nfs/dbraw/zinc/55/81/46/1051558146.db2.gz JKLWSPYYIXTYRT-SFHVURJKSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1ccccc1-c1nc(C[N@H+](C)[C@H]2CCc3ccccc32)no1 ZINC000178044446 1051558154 /nfs/dbraw/zinc/55/81/54/1051558154.db2.gz JKLWSPYYIXTYRT-SFHVURJKSA-N 1 2 319.408 4.164 20 0 DIADLO COc1cncc(CCNc2cc(-c3ccc(C)cc3)cc[nH+]2)c1 ZINC001169263049 1051559150 /nfs/dbraw/zinc/55/91/50/1051559150.db2.gz NJLZSGHVZKBICV-UHFFFAOYSA-N 1 2 319.408 4.115 20 0 DIADLO C[C@H](CSc1ccc(Cl)cc1)[N@@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001172874423 1051559137 /nfs/dbraw/zinc/55/91/37/1051559137.db2.gz AYQCYKLBMKDGFM-MFKMUULPSA-N 1 2 323.811 4.500 20 0 DIADLO C[C@H](CSc1ccc(Cl)cc1)[N@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001172874423 1051559149 /nfs/dbraw/zinc/55/91/49/1051559149.db2.gz AYQCYKLBMKDGFM-MFKMUULPSA-N 1 2 323.811 4.500 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1cc(-c2ccccc2)cnc1F ZINC001216071753 1051561667 /nfs/dbraw/zinc/56/16/67/1051561667.db2.gz IISMEXPAXIQSIW-UHFFFAOYSA-N 1 2 318.355 4.117 20 0 DIADLO Clc1ccnc(C[NH+]2CCC(c3ccncc3)CC2)c1Cl ZINC001169253220 1051565499 /nfs/dbraw/zinc/56/54/99/1051565499.db2.gz RSGKEMJRPCYHOS-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Cc1cc(Nc2cccc(Cn3cc[nH+]c3)c2)cc(Cl)c1O ZINC001216088342 1051572269 /nfs/dbraw/zinc/57/22/69/1051572269.db2.gz URQAONKHRFSNLN-UHFFFAOYSA-N 1 2 313.788 4.342 20 0 DIADLO Cc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc(Cl)c1O ZINC001216087792 1051573118 /nfs/dbraw/zinc/57/31/18/1051573118.db2.gz NQTCLCGGHFBBIB-UHFFFAOYSA-N 1 2 313.788 4.342 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccc(C3CCC3)cc2)c(N(C)C)[nH+]1 ZINC001216089700 1051573842 /nfs/dbraw/zinc/57/38/42/1051573842.db2.gz FJEZYWOSFKEKEQ-UHFFFAOYSA-N 1 2 324.428 4.368 20 0 DIADLO Cc1cc(Cl)c(N)c(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001216091963 1051574032 /nfs/dbraw/zinc/57/40/32/1051574032.db2.gz LSQYKYOTITUYEB-UHFFFAOYSA-N 1 2 312.804 4.219 20 0 DIADLO Cc1cc(Cl)c(N)c(Nc2ccc[nH+]c2N2CCCCC2)c1 ZINC001216092769 1051575388 /nfs/dbraw/zinc/57/53/88/1051575388.db2.gz VHTAOMCXKGTGKQ-UHFFFAOYSA-N 1 2 316.836 4.360 20 0 DIADLO Oc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)ccc1Cl ZINC001212588441 1051578833 /nfs/dbraw/zinc/57/88/33/1051578833.db2.gz PUHALYQKXJQZFJ-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO CC1(C)Oc2ccc(Nc3ccc(Cn4cc[nH+]c4)cc3)cc2O1 ZINC001212696779 1051581736 /nfs/dbraw/zinc/58/17/36/1051581736.db2.gz LKKBIEUUFPKACE-UHFFFAOYSA-N 1 2 321.380 4.182 20 0 DIADLO Clc1ccc(Cl)c(Nc2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC001212695324 1051583463 /nfs/dbraw/zinc/58/34/63/1051583463.db2.gz ZJWHDZHJTHFGLR-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO c1cn(Cc2ccc(Nc3cncc(C4CCC4)c3)cc2)c[nH+]1 ZINC001212695225 1051583981 /nfs/dbraw/zinc/58/39/81/1051583981.db2.gz UOQLKBMIRLVFLJ-UHFFFAOYSA-N 1 2 304.397 4.338 20 0 DIADLO Fc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1Cl ZINC001212695626 1051584696 /nfs/dbraw/zinc/58/46/96/1051584696.db2.gz NSBCHOKIVVQBFU-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO O=C1CCCc2cccc(Nc3ccc(Cn4cc[nH+]c4)cc3)c21 ZINC001212699259 1051585286 /nfs/dbraw/zinc/58/52/86/1051585286.db2.gz WPSWOBAMSCDAAM-UHFFFAOYSA-N 1 2 317.392 4.194 20 0 DIADLO COc1cccc(Cl)c1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212698425 1051587503 /nfs/dbraw/zinc/58/75/03/1051587503.db2.gz SJUIPDPUKPWVGX-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO COc1cc[nH+]cc1N[C@H]1CCc2c1cccc2OC(F)(F)F ZINC001169360796 1051587834 /nfs/dbraw/zinc/58/78/34/1051587834.db2.gz YMSRGZIOSGAZDH-LBPRGKRZSA-N 1 2 324.302 4.088 20 0 DIADLO CCC(=O)c1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001212698319 1051588225 /nfs/dbraw/zinc/58/82/25/1051588225.db2.gz MMHXBXRVDZNKTK-UHFFFAOYSA-N 1 2 305.381 4.268 20 0 DIADLO CC(=O)c1ccc(C)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212698433 1051588600 /nfs/dbraw/zinc/58/86/00/1051588600.db2.gz TTXSPMIRGSWQGR-UHFFFAOYSA-N 1 2 305.381 4.186 20 0 DIADLO Nc1ccc(Nc2[nH+]cccc2N2CCCC2)c(C(F)(F)F)c1 ZINC001216130430 1051593162 /nfs/dbraw/zinc/59/31/62/1051593162.db2.gz ZATHQBNTBNYHMF-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO Cc1ccc(CNc2[nH+]cnc3[nH]cc(F)c32)c2ccccc12 ZINC001169410890 1051612310 /nfs/dbraw/zinc/61/23/10/1051612310.db2.gz FHTOINGCTLTKJT-UHFFFAOYSA-N 1 2 306.344 4.122 20 0 DIADLO CCc1ccccc1C[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC001169507511 1051631346 /nfs/dbraw/zinc/63/13/46/1051631346.db2.gz PNTWBSJGDBKANM-LJQANCHMSA-N 1 2 317.379 4.101 20 0 DIADLO CCc1ccccc1C[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC001169507511 1051631350 /nfs/dbraw/zinc/63/13/50/1051631350.db2.gz PNTWBSJGDBKANM-LJQANCHMSA-N 1 2 317.379 4.101 20 0 DIADLO CSc1ncc(C)cc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001216241344 1051647813 /nfs/dbraw/zinc/64/78/13/1051647813.db2.gz LMMXMXNCUSKWAQ-UHFFFAOYSA-N 1 2 304.806 4.157 20 0 DIADLO Cc1ccc(NC(=O)c2cccc(Cl)c2Cl)c(N(C)C)[nH+]1 ZINC000152746075 1051652293 /nfs/dbraw/zinc/65/22/93/1051652293.db2.gz NQRSZHHZWOGPOD-UHFFFAOYSA-N 1 2 324.211 4.015 20 0 DIADLO FC(F)(F)c1ccccc1C1(Nc2ccn3cc[nH+]c3c2)CC1 ZINC001169635657 1051661030 /nfs/dbraw/zinc/66/10/30/1051661030.db2.gz YDAYRSQKJNBGNE-UHFFFAOYSA-N 1 2 317.314 4.454 20 0 DIADLO Cc1nocc1Nc1cc[nH+]c2cc(Br)ccc12 ZINC001212719233 1051675826 /nfs/dbraw/zinc/67/58/26/1051675826.db2.gz BKFNOOZYSCTVRD-UHFFFAOYSA-N 1 2 304.147 4.037 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2cc(Cl)nc(Cl)c2)C1 ZINC000805750824 1051678054 /nfs/dbraw/zinc/67/80/54/1051678054.db2.gz VPFLWCASAVWAOU-BXUZGUMPSA-N 1 2 322.239 4.367 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cc(Cl)nc(Cl)c2)C1 ZINC000805750824 1051678063 /nfs/dbraw/zinc/67/80/63/1051678063.db2.gz VPFLWCASAVWAOU-BXUZGUMPSA-N 1 2 322.239 4.367 20 0 DIADLO Clc1ccc2c(cc3n2CC[N@H+](CC[C@@H]2CCCCO2)C3)c1 ZINC000494020446 1051681251 /nfs/dbraw/zinc/68/12/51/1051681251.db2.gz YNADIQIAHWRGER-KRWDZBQOSA-N 1 2 318.848 4.070 20 0 DIADLO Clc1ccc2c(cc3n2CC[N@@H+](CC[C@@H]2CCCCO2)C3)c1 ZINC000494020446 1051681259 /nfs/dbraw/zinc/68/12/59/1051681259.db2.gz YNADIQIAHWRGER-KRWDZBQOSA-N 1 2 318.848 4.070 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+](C)Cc2cccc3[nH]ccc32)n1 ZINC000494059006 1051685929 /nfs/dbraw/zinc/68/59/29/1051685929.db2.gz HJUQEQDRHYOYME-CYBMUJFWSA-N 1 2 312.417 4.087 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+](C)Cc2cccc3[nH]ccc32)n1 ZINC000494059006 1051685938 /nfs/dbraw/zinc/68/59/38/1051685938.db2.gz HJUQEQDRHYOYME-CYBMUJFWSA-N 1 2 312.417 4.087 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2nc(Cl)ccc2Cl)cc1 ZINC000766810852 1051695326 /nfs/dbraw/zinc/69/53/26/1051695326.db2.gz RCFOTCOXSNNOKW-HNNXBMFYSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@H+]2Cc2nc(Cl)ccc2Cl)cc1 ZINC000766810852 1051695334 /nfs/dbraw/zinc/69/53/34/1051695334.db2.gz RCFOTCOXSNNOKW-HNNXBMFYSA-N 1 2 323.223 4.431 20 0 DIADLO c1ccc(CSc2cc[nH+]c(NC[C@@H]3CCCCO3)c2)cc1 ZINC001156377874 1051697656 /nfs/dbraw/zinc/69/76/56/1051697656.db2.gz RNJVUTQTFVAWCD-INIZCTEOSA-N 1 2 314.454 4.355 20 0 DIADLO Cc1c(C)c(C)c(C[N@H+](C)CC(=O)OC(C)(C)C)c(C)c1C ZINC001169790635 1051701650 /nfs/dbraw/zinc/70/16/50/1051701650.db2.gz CIXRSBGWAZRJGV-UHFFFAOYSA-N 1 2 305.462 4.002 20 0 DIADLO Cc1c(C)c(C)c(C[N@@H+](C)CC(=O)OC(C)(C)C)c(C)c1C ZINC001169790635 1051701666 /nfs/dbraw/zinc/70/16/66/1051701666.db2.gz CIXRSBGWAZRJGV-UHFFFAOYSA-N 1 2 305.462 4.002 20 0 DIADLO Cc1c(Cl)c(Nc2ccc(-n3cc[nH+]c3)cc2)ccc1CO ZINC001216329018 1051701950 /nfs/dbraw/zinc/70/19/50/1051701950.db2.gz OHZYEBFPYMDDFW-UHFFFAOYSA-N 1 2 313.788 4.070 20 0 DIADLO CCCc1csc(C[NH2+]Cc2ccc(C)cc2OC(C)C)n1 ZINC000494187959 1051703103 /nfs/dbraw/zinc/70/31/03/1051703103.db2.gz FXYWUYXVTBFFKM-UHFFFAOYSA-N 1 2 318.486 4.481 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2ccc(-c3ccccn3)nc2)c1 ZINC001169821607 1051706403 /nfs/dbraw/zinc/70/64/03/1051706403.db2.gz MTWRJBQGPXLBAA-UHFFFAOYSA-N 1 2 321.399 4.223 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2ccc(-c3ccccn3)nc2)c1 ZINC001169821607 1051706407 /nfs/dbraw/zinc/70/64/07/1051706407.db2.gz MTWRJBQGPXLBAA-UHFFFAOYSA-N 1 2 321.399 4.223 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nnc(-c2ccccc2)s1)c1ccccn1 ZINC000766852053 1051709611 /nfs/dbraw/zinc/70/96/11/1051709611.db2.gz JQMHDCVIOLRHLX-KRWDZBQOSA-N 1 2 324.453 4.087 20 0 DIADLO c1ncc(CCNc2ccc3c(c2)[nH+]cn3-c2ccccc2)s1 ZINC001169866964 1051721054 /nfs/dbraw/zinc/72/10/54/1051721054.db2.gz VWRYQJUVMICKQD-UHFFFAOYSA-N 1 2 320.421 4.137 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccc4c(c3)CCCCC4)ccn12 ZINC001130489648 1051724980 /nfs/dbraw/zinc/72/49/80/1051724980.db2.gz RPNCHZHWOCRJOL-UHFFFAOYSA-N 1 2 319.408 4.164 20 0 DIADLO CCC1(C(=O)N(C)Cc2[nH+]cc(C)c(OC)c2C)CCCCC1 ZINC000184107798 1051728357 /nfs/dbraw/zinc/72/83/57/1051728357.db2.gz FKVHXCLVINUWEU-UHFFFAOYSA-N 1 2 318.461 4.026 20 0 DIADLO C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1Cc2cnn(C)c2C1 ZINC001173554397 1051744963 /nfs/dbraw/zinc/74/49/63/1051744963.db2.gz OASBWLCPTOLPDL-LLVKDONJSA-N 1 2 324.255 4.064 20 0 DIADLO C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1Cc2cnn(C)c2C1 ZINC001173554397 1051744969 /nfs/dbraw/zinc/74/49/69/1051744969.db2.gz OASBWLCPTOLPDL-LLVKDONJSA-N 1 2 324.255 4.064 20 0 DIADLO Oc1ccc(Cl)cc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001216398547 1051745510 /nfs/dbraw/zinc/74/55/10/1051745510.db2.gz UPGPMZKOPDMBCA-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO O[C@H](CNc1cc[nH+]c2c(Cl)cccc12)c1ccccc1F ZINC000804345371 1051747367 /nfs/dbraw/zinc/74/73/67/1051747367.db2.gz WJSUMSLZOKJKEE-MRXNPFEDSA-N 1 2 316.763 4.173 20 0 DIADLO CCc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1nccn1-c1ccccc1 ZINC000806175852 1051747604 /nfs/dbraw/zinc/74/76/04/1051747604.db2.gz GOPZQHJMBYVNDE-KGLIPLIRSA-N 1 2 324.428 4.143 20 0 DIADLO Clc1ccc2c(n1)CC[C@@H]2Nc1ccc([NH+]2CCCC2)cc1 ZINC000806151789 1051756889 /nfs/dbraw/zinc/75/68/89/1051756889.db2.gz LRZXYKIKNUUOAA-INIZCTEOSA-N 1 2 313.832 4.435 20 0 DIADLO Cn1c(NCc2cncc3ccccc32)[nH+]c2cccc(Cl)c21 ZINC000767289733 1051785217 /nfs/dbraw/zinc/78/52/17/1051785217.db2.gz CRKZSANTZWJEBY-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO CC(=O)c1cccc(Nc2ccc[nH+]c2N2CCCCC2)c1F ZINC001216497552 1051791263 /nfs/dbraw/zinc/79/12/63/1051791263.db2.gz PETXFFWSQVSPSA-UHFFFAOYSA-N 1 2 313.376 4.157 20 0 DIADLO Cc1ccccc1Nc1cc(Br)cn2cc[nH+]c12 ZINC001173814816 1051794184 /nfs/dbraw/zinc/79/41/84/1051794184.db2.gz CFMHROWVSXZQNF-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO C[C@@H]1c2cc(Cl)c(Cl)cc2CC[N@H+]1CCC(=O)C1CC1 ZINC000767414194 1051800419 /nfs/dbraw/zinc/80/04/19/1051800419.db2.gz HDUMVTNLYMNEQB-SNVBAGLBSA-N 1 2 312.240 4.282 20 0 DIADLO C[C@@H]1c2cc(Cl)c(Cl)cc2CC[N@@H+]1CCC(=O)C1CC1 ZINC000767414194 1051800431 /nfs/dbraw/zinc/80/04/31/1051800431.db2.gz HDUMVTNLYMNEQB-SNVBAGLBSA-N 1 2 312.240 4.282 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C[C@@H]3C[C@H]3c3ccccc3)cc2)CCO1 ZINC000767389604 1051802305 /nfs/dbraw/zinc/80/23/05/1051802305.db2.gz FCCIRAWRHSKPDD-MMOPVJDHSA-N 1 2 322.452 4.127 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C[C@H]3C[C@H]3c3ccccc3)cc2)CCO1 ZINC000767389602 1051803205 /nfs/dbraw/zinc/80/32/05/1051803205.db2.gz FCCIRAWRHSKPDD-BLIXFSHQSA-N 1 2 322.452 4.127 20 0 DIADLO Cc1cc(C)c(Nc2ccccc2C[NH+]2CCOCC2)c(C)c1 ZINC001173843284 1051818193 /nfs/dbraw/zinc/81/81/93/1051818193.db2.gz KSPPSSIEXCIBOR-UHFFFAOYSA-N 1 2 310.441 4.188 20 0 DIADLO Cc1nc([C@H]([NH2+][C@H](C)CCC2CC2)c2ccc(Cl)cc2)no1 ZINC000186471957 1051818357 /nfs/dbraw/zinc/81/83/57/1051818357.db2.gz LDRBPZHPBALCGY-BDJLRTHQSA-N 1 2 319.836 4.289 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1ccc(-c2ccn(C)n2)nc1 ZINC001216558603 1051818578 /nfs/dbraw/zinc/81/85/78/1051818578.db2.gz CPXNUVSHJVJYKW-UHFFFAOYSA-N 1 2 307.401 4.053 20 0 DIADLO CCOc1ccc(Nc2cc(OC)c(C(F)(F)F)c[nH+]2)cc1 ZINC001173851480 1051825998 /nfs/dbraw/zinc/82/59/98/1051825998.db2.gz HQZNHOLFIPJCTB-UHFFFAOYSA-N 1 2 312.291 4.251 20 0 DIADLO Brc1c[nH+]c2ccc(NC=Cc3ccccc3)cn12 ZINC001173869907 1051840308 /nfs/dbraw/zinc/84/03/08/1051840308.db2.gz DCQNRHFMLNGWER-CMDGGOBGSA-N 1 2 314.186 4.180 20 0 DIADLO Cc1cccc(C)c1Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001173873153 1051842390 /nfs/dbraw/zinc/84/23/90/1051842390.db2.gz HWKIXWWSCKQGBK-IYBDPMFKSA-N 1 2 311.429 4.056 20 0 DIADLO COCC1=CC[N@H+](Cc2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000187616693 1051850579 /nfs/dbraw/zinc/85/05/79/1051850579.db2.gz AIVIZDAKOJCETQ-UHFFFAOYSA-N 1 2 319.754 4.137 20 0 DIADLO COCC1=CC[N@@H+](Cc2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000187616693 1051850591 /nfs/dbraw/zinc/85/05/91/1051850591.db2.gz AIVIZDAKOJCETQ-UHFFFAOYSA-N 1 2 319.754 4.137 20 0 DIADLO FCc1ccc(C[N@@H+]2CCO[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000767877766 1051858332 /nfs/dbraw/zinc/85/83/32/1051858332.db2.gz YPHHNIDOOHZRFO-SFHVURJKSA-N 1 2 319.807 4.383 20 0 DIADLO FCc1ccc(C[N@H+]2CCO[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000767877766 1051858338 /nfs/dbraw/zinc/85/83/38/1051858338.db2.gz YPHHNIDOOHZRFO-SFHVURJKSA-N 1 2 319.807 4.383 20 0 DIADLO CSc1ccccc1CSCc1cc[nH+]c(N(C)C)c1 ZINC000767874636 1051860853 /nfs/dbraw/zinc/86/08/53/1051860853.db2.gz JVEXEHOQBWFXTE-UHFFFAOYSA-N 1 2 304.484 4.303 20 0 DIADLO Nc1ccc[nH+]c1Nc1ccc(-c2nc3ccccc3o2)cc1 ZINC001216686731 1051864447 /nfs/dbraw/zinc/86/44/47/1051864447.db2.gz YAWGIVSWLDGSIC-UHFFFAOYSA-N 1 2 302.337 4.216 20 0 DIADLO Cc1cc(F)ccc1-c1noc(-c2ccccc2-n2cc[nH+]c2)n1 ZINC001216755205 1051873796 /nfs/dbraw/zinc/87/37/96/1051873796.db2.gz GWEHQCKCHKIGFL-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO O[C@H](C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1)c1c(F)cccc1F ZINC000746494851 1051885817 /nfs/dbraw/zinc/88/58/17/1051885817.db2.gz LWYHGCPITHWQNJ-JKSUJKDBSA-N 1 2 323.770 4.099 20 0 DIADLO O[C@H](C[N@H+]1CC[C@H]1c1ccc(Cl)cc1)c1c(F)cccc1F ZINC000746494851 1051885822 /nfs/dbraw/zinc/88/58/22/1051885822.db2.gz LWYHGCPITHWQNJ-JKSUJKDBSA-N 1 2 323.770 4.099 20 0 DIADLO COc1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1OC ZINC001173886744 1051888091 /nfs/dbraw/zinc/88/80/91/1051888091.db2.gz WFIWEZDKENQAPB-UHFFFAOYSA-N 1 2 312.413 4.438 20 0 DIADLO COc1ccc2cc(C[N@H+](C)Cc3coc(C4CC4)n3)ccc2c1 ZINC000768203504 1051894945 /nfs/dbraw/zinc/89/49/45/1051894945.db2.gz JHWRTBHOEZZUNC-UHFFFAOYSA-N 1 2 322.408 4.346 20 0 DIADLO COc1ccc2cc(C[N@@H+](C)Cc3coc(C4CC4)n3)ccc2c1 ZINC000768203504 1051894958 /nfs/dbraw/zinc/89/49/58/1051894958.db2.gz JHWRTBHOEZZUNC-UHFFFAOYSA-N 1 2 322.408 4.346 20 0 DIADLO Cc1cc(Br)c2c(c1)C[N@@H+](CCC(F)(F)F)CC2 ZINC000494451910 1051897673 /nfs/dbraw/zinc/89/76/73/1051897673.db2.gz HULDWSHWRWMHSS-UHFFFAOYSA-N 1 2 322.168 4.068 20 0 DIADLO Cc1cc(Br)c2c(c1)C[N@H+](CCC(F)(F)F)CC2 ZINC000494451910 1051897676 /nfs/dbraw/zinc/89/76/76/1051897676.db2.gz HULDWSHWRWMHSS-UHFFFAOYSA-N 1 2 322.168 4.068 20 0 DIADLO Fc1ccc(F)c(Nc2cc(Br)c3[nH+]ccn3c2)c1 ZINC001173949870 1051914637 /nfs/dbraw/zinc/91/46/37/1051914637.db2.gz NAVYJRAIHBJWQM-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Cc1ccccc1-c1noc(-c2cccc(-c3c[nH+]cn3C)c2)n1 ZINC001217019380 1051930901 /nfs/dbraw/zinc/93/09/01/1051930901.db2.gz LXSHNJRIMQFDGY-UHFFFAOYSA-N 1 2 316.364 4.113 20 0 DIADLO CC[N@H+](Cc1occc1Br)[C@@H](C)c1cccc(O)c1 ZINC000768872167 1051974100 /nfs/dbraw/zinc/97/41/00/1051974100.db2.gz DZXWALNMZZOJJZ-NSHDSACASA-N 1 2 324.218 4.331 20 0 DIADLO CC[N@@H+](Cc1occc1Br)[C@@H](C)c1cccc(O)c1 ZINC000768872167 1051974110 /nfs/dbraw/zinc/97/41/10/1051974110.db2.gz DZXWALNMZZOJJZ-NSHDSACASA-N 1 2 324.218 4.331 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1ccc(C(=O)N2CCCCC2)cc1 ZINC001174073101 1051993704 /nfs/dbraw/zinc/99/37/04/1051993704.db2.gz CHIMITJDJXIELJ-UHFFFAOYSA-N 1 2 323.440 4.322 20 0 DIADLO Cc1ccc[nH+]c1Nc1ccc(C(=O)NC2CCCCC2)cc1 ZINC001174080808 1051996779 /nfs/dbraw/zinc/99/67/79/1051996779.db2.gz LRVGNVWTJPNHEF-UHFFFAOYSA-N 1 2 309.413 4.196 20 0 DIADLO Cc1ccc(C)c(NC(=O)COc2cc(C)[nH+]c3ccccc32)c1 ZINC000192193172 1052005391 /nfs/dbraw/zinc/00/53/91/1052005391.db2.gz PBJLPBQVUFHLOU-UHFFFAOYSA-N 1 2 320.392 4.178 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1cccc(C(=O)N(CC)CC)c1 ZINC001174165192 1052027297 /nfs/dbraw/zinc/02/72/97/1052027297.db2.gz LOPXPSVZURYPBS-UHFFFAOYSA-N 1 2 311.429 4.178 20 0 DIADLO Cc1ccc(-c2cc(C[N@@H+]3CCn4cccc4[C@@H]3C)on2)cc1 ZINC000193068431 1052028195 /nfs/dbraw/zinc/02/81/95/1052028195.db2.gz APVJMVLMVJMTAL-HNNXBMFYSA-N 1 2 307.397 4.028 20 0 DIADLO Cc1ccc(-c2cc(C[N@H+]3CCn4cccc4[C@@H]3C)on2)cc1 ZINC000193068431 1052028203 /nfs/dbraw/zinc/02/82/03/1052028203.db2.gz APVJMVLMVJMTAL-HNNXBMFYSA-N 1 2 307.397 4.028 20 0 DIADLO CCCCCC/C(=C/c1ccccc1)C[N@@H+]1CCn2cnnc2C1 ZINC000769359462 1052031395 /nfs/dbraw/zinc/03/13/95/1052031395.db2.gz LENIMSGRMYWJLK-RGEXLXHISA-N 1 2 324.472 4.148 20 0 DIADLO CCCCCC/C(=C/c1ccccc1)C[N@H+]1CCn2cnnc2C1 ZINC000769359462 1052031411 /nfs/dbraw/zinc/03/14/11/1052031411.db2.gz LENIMSGRMYWJLK-RGEXLXHISA-N 1 2 324.472 4.148 20 0 DIADLO Cn1cc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000195091299 1052033839 /nfs/dbraw/zinc/03/38/39/1052033839.db2.gz VBZLSQDDICITCI-HNNXBMFYSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1cc(C[N@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000195091299 1052033845 /nfs/dbraw/zinc/03/38/45/1052033845.db2.gz VBZLSQDDICITCI-HNNXBMFYSA-N 1 2 310.228 4.064 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc3c(s2)CCCC3)c(C)[nH+]1 ZINC000193182195 1052034708 /nfs/dbraw/zinc/03/47/08/1052034708.db2.gz JQGYNAMUUYTNNX-UHFFFAOYSA-N 1 2 300.427 4.199 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1cccc(C(=O)NC(C)C)c1 ZINC001174185964 1052036493 /nfs/dbraw/zinc/03/64/93/1052036493.db2.gz WYJMUUKWYXOFOO-UHFFFAOYSA-N 1 2 311.429 4.395 20 0 DIADLO CCCc1cc[nH+]c(Nc2cccc(C(=O)NC3CCCC3)c2)c1 ZINC001174196640 1052045151 /nfs/dbraw/zinc/04/51/51/1052045151.db2.gz XUFJONAPELXLSM-UHFFFAOYSA-N 1 2 323.440 4.450 20 0 DIADLO Cc1cc[nH+]c(Nc2cccc(C(=O)N3CCC(C)CC3)c2)c1 ZINC001174202633 1052046792 /nfs/dbraw/zinc/04/67/92/1052046792.db2.gz MBGHFJOJSVUSJE-UHFFFAOYSA-N 1 2 309.413 4.006 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(C(=O)c2ccccc2)cc1 ZINC001174222483 1052059799 /nfs/dbraw/zinc/05/97/99/1052059799.db2.gz RRMNQVUXOULKKL-UHFFFAOYSA-N 1 2 304.349 4.065 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458734 1052059958 /nfs/dbraw/zinc/05/99/58/1052059958.db2.gz ZMVSJOGCCSGFSN-PXAZEXFGSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458734 1052059972 /nfs/dbraw/zinc/05/99/72/1052059972.db2.gz ZMVSJOGCCSGFSN-PXAZEXFGSA-N 1 2 300.377 4.274 20 0 DIADLO c1cn2c(cccc2-c2nc(-c3ccc4ccccc4c3)no2)[nH+]1 ZINC001217501125 1052075529 /nfs/dbraw/zinc/07/55/29/1052075529.db2.gz SCJDJBVXAGODRA-UHFFFAOYSA-N 1 2 312.332 4.205 20 0 DIADLO Cc1cn2c(cccc2Nc2cccc(N3CCCCC3)c2)[nH+]1 ZINC001174301023 1052077000 /nfs/dbraw/zinc/07/70/00/1052077000.db2.gz KDDCQQYSVVUGFZ-UHFFFAOYSA-N 1 2 306.413 4.377 20 0 DIADLO C[C@H]1C[N@H+](Cc2occc2Br)[C@H]1c1ccccc1 ZINC000769541958 1052077449 /nfs/dbraw/zinc/07/74/49/1052077449.db2.gz XIODTTMOZXBDLI-XHDPSFHLSA-N 1 2 306.203 4.235 20 0 DIADLO C[C@H]1C[N@@H+](Cc2occc2Br)[C@H]1c1ccccc1 ZINC000769541958 1052077464 /nfs/dbraw/zinc/07/74/64/1052077464.db2.gz XIODTTMOZXBDLI-XHDPSFHLSA-N 1 2 306.203 4.235 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2coc(C3CC3)n2)o1 ZINC000769549525 1052080715 /nfs/dbraw/zinc/08/07/15/1052080715.db2.gz NLMFOZFWKUVRGS-LRDDRELGSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2coc(C3CC3)n2)o1 ZINC000769549525 1052080728 /nfs/dbraw/zinc/08/07/28/1052080728.db2.gz NLMFOZFWKUVRGS-LRDDRELGSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@@H]3CCC[C@H]3C)c2)[nH+]c1C ZINC000769560353 1052082101 /nfs/dbraw/zinc/08/21/01/1052082101.db2.gz PNAVBAPCUGCIRU-DOMZBBRYSA-N 1 2 311.429 4.458 20 0 DIADLO CCC1CC[NH+](CC(=O)Nc2c(C)cc(C)cc2Cl)CC1 ZINC000053376546 1052101612 /nfs/dbraw/zinc/10/16/12/1052101612.db2.gz GODYANKJBFDBIL-UHFFFAOYSA-N 1 2 308.853 4.017 20 0 DIADLO COc1cccc2cc([C@@H](C)[NH2+]Cc3ncc(Cl)s3)oc21 ZINC000769908068 1052120366 /nfs/dbraw/zinc/12/03/66/1052120366.db2.gz IDGXBUOFSKZMJW-SECBINFHSA-N 1 2 322.817 4.402 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1[C@H](C)Cc2cc(F)ccc2[C@H]1C ZINC000769953077 1052128227 /nfs/dbraw/zinc/12/82/27/1052128227.db2.gz JMAYLDDWJIENHK-ZYHUDNBSSA-N 1 2 321.827 4.029 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1[C@H](C)Cc2cc(F)ccc2[C@H]1C ZINC000769953077 1052128234 /nfs/dbraw/zinc/12/82/34/1052128234.db2.gz JMAYLDDWJIENHK-ZYHUDNBSSA-N 1 2 321.827 4.029 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(Cl)nnc3Cl)ccc21 ZINC001174380885 1052139400 /nfs/dbraw/zinc/13/94/00/1052139400.db2.gz OIRYJFBMQOJTPE-UHFFFAOYSA-N 1 2 322.199 4.458 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(c3)OCCO4)ccc21 ZINC001174381485 1052140219 /nfs/dbraw/zinc/14/02/19/1052140219.db2.gz LETHHGYYVKXLHS-UHFFFAOYSA-N 1 2 309.369 4.132 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3nccc4cnccc43)ccc21 ZINC001174382100 1052140418 /nfs/dbraw/zinc/14/04/18/1052140418.db2.gz XWVKSWFNFRNVQY-UHFFFAOYSA-N 1 2 303.369 4.304 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4c3OCCO4)ccc21 ZINC001174381710 1052140628 /nfs/dbraw/zinc/14/06/28/1052140628.db2.gz POZXGUZMKMWQTI-UHFFFAOYSA-N 1 2 309.369 4.132 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(-c3cnn(C)c3)cc2)cc1 ZINC001174381308 1052140640 /nfs/dbraw/zinc/14/06/40/1052140640.db2.gz VKKXSAGRXRCCHH-UHFFFAOYSA-N 1 2 306.413 4.287 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(-c3cnn(C)c3)cc2)cc1 ZINC001174381308 1052140648 /nfs/dbraw/zinc/14/06/48/1052140648.db2.gz VKKXSAGRXRCCHH-UHFFFAOYSA-N 1 2 306.413 4.287 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(C4CCC4)nn3C)ccc21 ZINC001174382156 1052140659 /nfs/dbraw/zinc/14/06/59/1052140659.db2.gz BIFFZTPUYLFBQP-UHFFFAOYSA-N 1 2 309.417 4.362 20 0 DIADLO COCOc1cccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)c1 ZINC001174383655 1052142984 /nfs/dbraw/zinc/14/29/84/1052142984.db2.gz QTHOHJAZCUTCBL-UHFFFAOYSA-N 1 2 311.385 4.344 20 0 DIADLO COc1ccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cc1OC ZINC001174383410 1052143096 /nfs/dbraw/zinc/14/30/96/1052143096.db2.gz PMSFWANYYPHALG-UHFFFAOYSA-N 1 2 311.385 4.378 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cnccc3OC(F)F)ccc21 ZINC001174382354 1052143709 /nfs/dbraw/zinc/14/37/09/1052143709.db2.gz LOBIETKQAVMLKA-UHFFFAOYSA-N 1 2 318.327 4.357 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3c(F)cc(O)cc3F)ccc21 ZINC001174384449 1052144475 /nfs/dbraw/zinc/14/44/75/1052144475.db2.gz GCXUJJPOTNEJJV-UHFFFAOYSA-N 1 2 303.312 4.345 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4c3CCC(=O)N4)ccc21 ZINC001174385976 1052144560 /nfs/dbraw/zinc/14/45/60/1052144560.db2.gz XDKLYNRIAAPAEH-UHFFFAOYSA-N 1 2 320.396 4.246 20 0 DIADLO O=C(Nc1ccccc1-c1ccccc1)c1cccc2[nH+]ccn21 ZINC000770052722 1052144771 /nfs/dbraw/zinc/14/47/71/1052144771.db2.gz LDIQDRJMSSMNRT-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(c3)[C@@H](O)CC4)ccc21 ZINC001174384458 1052144721 /nfs/dbraw/zinc/14/47/21/1052144721.db2.gz GNYDSBZTEZZKHR-IBGZPJMESA-N 1 2 307.397 4.340 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4nnsc4c3)ccc21 ZINC001174386014 1052145208 /nfs/dbraw/zinc/14/52/08/1052145208.db2.gz XTOVJAJQDZIGNC-UHFFFAOYSA-N 1 2 309.398 4.366 20 0 DIADLO CC(C)(O)c1cccc(Nc2cc[nH+]c3ccc(Cl)cc23)c1 ZINC001174405003 1052160060 /nfs/dbraw/zinc/16/00/60/1052160060.db2.gz ZSYNZUZIIPIHCQ-UHFFFAOYSA-N 1 2 312.800 4.281 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000227600041 1052162437 /nfs/dbraw/zinc/16/24/37/1052162437.db2.gz OAKBUGVSABUAKU-YPMHNXCESA-N 1 2 305.805 4.355 20 0 DIADLO CC[C@@H](C[NH2+][C@H](c1ncn[nH]1)C1CCCCC1)c1ccccc1 ZINC000494901945 1052163561 /nfs/dbraw/zinc/16/35/61/1052163561.db2.gz GWONKMNXOISUJA-YJBOKZPZSA-N 1 2 312.461 4.210 20 0 DIADLO c1cc2c([nH]1)[nH+]ccc2Nc1ccc(Cc2ccccn2)cc1 ZINC001174413448 1052166009 /nfs/dbraw/zinc/16/60/09/1052166009.db2.gz LSVZQKCWPLPWHH-UHFFFAOYSA-N 1 2 300.365 4.244 20 0 DIADLO COc1cc(Nc2cc[nH+]c3[nH]ccc32)ccc1Br ZINC001174412576 1052166204 /nfs/dbraw/zinc/16/62/04/1052166204.db2.gz VUZSHQVXYSQMJZ-UHFFFAOYSA-N 1 2 318.174 4.029 20 0 DIADLO c1cc2c([nH]1)[nH+]ccc2Nc1ccc(Cc2cccnc2)cc1 ZINC001174415095 1052166757 /nfs/dbraw/zinc/16/67/57/1052166757.db2.gz HEAITZREMAHEHB-UHFFFAOYSA-N 1 2 300.365 4.244 20 0 DIADLO COC(=O)c1cc2cc(Nc3cc[nH+]c4[nH]ccc43)ccc2s1 ZINC001174413880 1052167540 /nfs/dbraw/zinc/16/75/40/1052167540.db2.gz PCZZWNLSOFXVAH-UHFFFAOYSA-N 1 2 323.377 4.259 20 0 DIADLO CCOC(=O)c1coc2cc(Nc3cc[nH+]c4[nH]ccc43)ccc12 ZINC001174415350 1052168285 /nfs/dbraw/zinc/16/82/85/1052168285.db2.gz JREKQRMBMZVWOC-UHFFFAOYSA-N 1 2 321.336 4.181 20 0 DIADLO c1c[nH+]c(Nc2cccc(N3CCCC3)c2)c(N2CCCCC2)c1 ZINC001174487150 1052172145 /nfs/dbraw/zinc/17/21/45/1052172145.db2.gz KHDPDXZUETWKRR-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO Cc1sccc1Nc1cc(Br)c2[nH+]ccn2c1 ZINC001174459283 1052179486 /nfs/dbraw/zinc/17/94/86/1052179486.db2.gz LNHQZMSHTWAVAR-UHFFFAOYSA-N 1 2 308.204 4.210 20 0 DIADLO FC1(F)C[NH2+]CC[C@@H]1Oc1c(Cl)ccc(Cl)c1Cl ZINC001218012545 1052185071 /nfs/dbraw/zinc/18/50/71/1052185071.db2.gz RGOVURQHCHJKTN-QMMMGPOBSA-N 1 2 316.562 4.023 20 0 DIADLO COc1cccc([C@H](C)[NH2+][C@H](Cc2ccccc2)c2ncco2)c1 ZINC000653911596 1052190690 /nfs/dbraw/zinc/19/06/90/1052190690.db2.gz HJCYRWJGHLSVEQ-HNAYVOBHSA-N 1 2 322.408 4.318 20 0 DIADLO Clc1ccsc1C[N@@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000494985838 1052190840 /nfs/dbraw/zinc/19/08/40/1052190840.db2.gz NNXKLNPIYHWIAS-KRWDZBQOSA-N 1 2 319.857 4.075 20 0 DIADLO Clc1ccsc1C[N@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000494985838 1052190846 /nfs/dbraw/zinc/19/08/46/1052190846.db2.gz NNXKLNPIYHWIAS-KRWDZBQOSA-N 1 2 319.857 4.075 20 0 DIADLO CC1CCC(c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)CC1 ZINC000761791776 1052194116 /nfs/dbraw/zinc/19/41/16/1052194116.db2.gz JRBSFOUKEKLSRF-UHFFFAOYSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@@H]1CCC[C@H](c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)C1 ZINC000761797959 1052202396 /nfs/dbraw/zinc/20/23/96/1052202396.db2.gz XQQQISZLDPMAFD-HIFRSBDPSA-N 1 2 308.385 4.216 20 0 DIADLO Nc1[nH+]cccc1OC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC001218197798 1052207052 /nfs/dbraw/zinc/20/70/52/1052207052.db2.gz VFYPPGWLKKGHCF-UHFFFAOYSA-N 1 2 312.319 4.110 20 0 DIADLO Cc1cc2ccccc2c(NC(=O)NCc2c[nH+]c(C)cc2C)c1 ZINC001218208052 1052207680 /nfs/dbraw/zinc/20/76/80/1052207680.db2.gz RGYHMOQQPQLDBH-UHFFFAOYSA-N 1 2 319.408 4.482 20 0 DIADLO Cc1cn2cc(NC(=O)[C@H](C)c3ccc(Cl)s3)ccc2[nH+]1 ZINC000495094246 1052215463 /nfs/dbraw/zinc/21/54/63/1052215463.db2.gz OTCZAKDUHFMRKL-SNVBAGLBSA-N 1 2 319.817 4.100 20 0 DIADLO C[C@H](c1ccccc1)c1ccccc1O[C@@H]1C[NH2+]CC(F)(F)C1 ZINC001218280981 1052217473 /nfs/dbraw/zinc/21/74/73/1052217473.db2.gz YOPXAEURKBNWQY-ZBFHGGJFSA-N 1 2 317.379 4.214 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+](C)Cc1cnc(C)s1 ZINC000495170419 1052245064 /nfs/dbraw/zinc/24/50/64/1052245064.db2.gz VRYIHIHCGBNVIH-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+](C)Cc1cnc(C)s1 ZINC000495170419 1052245075 /nfs/dbraw/zinc/24/50/75/1052245075.db2.gz VRYIHIHCGBNVIH-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+]1CCC[C@H]1c1cc(C)no1 ZINC000495178480 1052245704 /nfs/dbraw/zinc/24/57/04/1052245704.db2.gz QQHPLLAIKOGMIJ-HNNXBMFYSA-N 1 2 320.820 4.372 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+]1CCC[C@H]1c1cc(C)no1 ZINC000495178480 1052245715 /nfs/dbraw/zinc/24/57/15/1052245715.db2.gz QQHPLLAIKOGMIJ-HNNXBMFYSA-N 1 2 320.820 4.372 20 0 DIADLO CCCCn1c(SCC2CCCC2)nnc1[C@H](CC)[NH+](C)C ZINC000193211271 1052250182 /nfs/dbraw/zinc/25/01/82/1052250182.db2.gz XFARQPBHSVODIN-HNNXBMFYSA-N 1 2 324.538 4.373 20 0 DIADLO CCSc1nn(C[N@H+](C)[C@H]2CCC[C@@H](C)C2)c(=S)s1 ZINC000914785167 1052250609 /nfs/dbraw/zinc/25/06/09/1052250609.db2.gz RBZBMMNUHZERJG-MNOVXSKESA-N 1 2 317.549 4.254 20 0 DIADLO CCSc1nn(C[N@@H+](C)[C@H]2CCC[C@@H](C)C2)c(=S)s1 ZINC000914785167 1052250615 /nfs/dbraw/zinc/25/06/15/1052250615.db2.gz RBZBMMNUHZERJG-MNOVXSKESA-N 1 2 317.549 4.254 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(C(C)(C)C)cc1 ZINC000393362158 1052265289 /nfs/dbraw/zinc/26/52/89/1052265289.db2.gz HAENLJLJIVZUNR-GFCCVEGCSA-N 1 2 305.853 4.222 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC2(CC(C)C)CCC2)c(C)[nH+]1 ZINC001219010060 1052267920 /nfs/dbraw/zinc/26/79/20/1052267920.db2.gz YLRLOFDRQHWSSL-UHFFFAOYSA-N 1 2 303.450 4.345 20 0 DIADLO C[C@H]1CCCN(C(=O)Nc2ccc3[nH+]ccn3c2)c2ccccc21 ZINC001219557266 1052293300 /nfs/dbraw/zinc/29/33/00/1052293300.db2.gz VMKISMLNPZTQQG-AWEZNQCLSA-N 1 2 320.396 4.270 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc(C)c3ccccc3n2)c(C)[nH+]1 ZINC000192761463 1052320828 /nfs/dbraw/zinc/32/08/28/1052320828.db2.gz PCKDCORNWUGMRR-UHFFFAOYSA-N 1 2 305.381 4.116 20 0 DIADLO CCN(CC)c1ccc(NCc2ccc(OC)c(Cl)c2)c[nH+]1 ZINC000315995776 1052359406 /nfs/dbraw/zinc/35/94/06/1052359406.db2.gz XHCNBXLDHZOIDH-UHFFFAOYSA-N 1 2 319.836 4.202 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@@H](C)c2ccc(C)s2)n1 ZINC000754672083 1052368557 /nfs/dbraw/zinc/36/85/57/1052368557.db2.gz HICXKQRMQLXVOT-QWRGUYRKSA-N 1 2 311.476 4.104 20 0 DIADLO CCCCCC[C@@](C)(CCC)c1nc(Cc2c[nH+]cn2C)no1 ZINC000762412560 1052378619 /nfs/dbraw/zinc/37/86/19/1052378619.db2.gz VFRRJQNLWREXAF-GOSISDBHSA-N 1 2 318.465 4.422 20 0 DIADLO COCc1ccc(C[N@H+](C/C=C/Cl)C/C=C\Cl)cc1 ZINC000915260070 1052378838 /nfs/dbraw/zinc/37/88/38/1052378838.db2.gz BNWAZPLFKYWAOW-GPBXNHIQSA-N 1 2 300.229 4.140 20 0 DIADLO COCc1ccc(C[N@@H+](C/C=C/Cl)C/C=C\Cl)cc1 ZINC000915260070 1052378840 /nfs/dbraw/zinc/37/88/40/1052378840.db2.gz BNWAZPLFKYWAOW-GPBXNHIQSA-N 1 2 300.229 4.140 20 0 DIADLO CCCc1ccc(C[NH2+][C@@H](c2nccn2C)c2ccccc2)cc1 ZINC000642339779 1052386294 /nfs/dbraw/zinc/38/62/94/1052386294.db2.gz RWTLMALIBSWMGR-HXUWFJFHSA-N 1 2 319.452 4.252 20 0 DIADLO O=c1[nH]c(C[N@@H+]2CCCC[C@H]2c2ccccc2)nc2ccccc21 ZINC000762633351 1052409868 /nfs/dbraw/zinc/40/98/68/1052409868.db2.gz KANLNLBYCGZFSP-SFHVURJKSA-N 1 2 319.408 4.063 20 0 DIADLO O=c1[nH]c(C[N@H+]2CCCC[C@H]2c2ccccc2)nc2ccccc21 ZINC000762633351 1052409873 /nfs/dbraw/zinc/40/98/73/1052409873.db2.gz KANLNLBYCGZFSP-SFHVURJKSA-N 1 2 319.408 4.063 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)N1CCCC[C@@H]1c1ccccc1 ZINC000762852878 1052426084 /nfs/dbraw/zinc/42/60/84/1052426084.db2.gz LOFJZSHGFQJNBH-QGZVFWFLSA-N 1 2 320.396 4.093 20 0 DIADLO CC(C)c1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000236657855 1052428870 /nfs/dbraw/zinc/42/88/70/1052428870.db2.gz VLXNVRPVQRTMAH-ZDUSSCGKSA-N 1 2 301.434 4.341 20 0 DIADLO CC(C)c1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000236659528 1052429240 /nfs/dbraw/zinc/42/92/40/1052429240.db2.gz VLXNVRPVQRTMAH-CYBMUJFWSA-N 1 2 301.434 4.341 20 0 DIADLO CCc1nc2cc(NCc3ccc(-n4cc[nH+]c4)cc3)ccc2o1 ZINC000237133672 1052436008 /nfs/dbraw/zinc/43/60/08/1052436008.db2.gz DLLWWUFSBGPXKV-UHFFFAOYSA-N 1 2 318.380 4.188 20 0 DIADLO CC(C)Cc1ccc([C@@H](C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000393374578 1052441813 /nfs/dbraw/zinc/44/18/13/1052441813.db2.gz RHJCSXHLBSJABF-CYBMUJFWSA-N 1 2 305.853 4.123 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cnc(N3CCCCC3)nc2)c1 ZINC001222139665 1052449372 /nfs/dbraw/zinc/44/93/72/1052449372.db2.gz XPHYOSWCMAZWJI-UHFFFAOYSA-N 1 2 324.472 4.289 20 0 DIADLO Clc1ccccc1[C@@H](OCCn1cc[nH+]c1)c1ccccc1 ZINC001222139812 1052449637 /nfs/dbraw/zinc/44/96/37/1052449637.db2.gz XOXLSBSWIGRCKC-SFHVURJKSA-N 1 2 312.800 4.343 20 0 DIADLO Clc1ccccc1[C@H](OCCn1cc[nH+]c1)c1ccccc1 ZINC001222139811 1052449702 /nfs/dbraw/zinc/44/97/02/1052449702.db2.gz XOXLSBSWIGRCKC-GOSISDBHSA-N 1 2 312.800 4.343 20 0 DIADLO Cc1cc(-c2ccccc2C[NH+]2CCOCC2)c(F)cc1Cl ZINC001222232844 1052465148 /nfs/dbraw/zinc/46/51/48/1052465148.db2.gz TWFWMJLGKIMTGD-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO CC(C)c1ccc(-c2noc([C@](C)([NH3+])c3ccccc3)n2)cc1 ZINC000320256122 1052493285 /nfs/dbraw/zinc/49/32/85/1052493285.db2.gz IWIRNNKLUFYQRH-LJQANCHMSA-N 1 2 307.397 4.082 20 0 DIADLO CCCCc1ccc(NC(=O)Cc2cn3cccc(C)c3[nH+]2)cc1 ZINC000096459151 1052506980 /nfs/dbraw/zinc/50/69/80/1052506980.db2.gz YRHXEAMMQYXXLQ-UHFFFAOYSA-N 1 2 321.424 4.167 20 0 DIADLO Cn1cc(-c2ccc(-c3c[nH+]cn3C)cc2)c(-c2ccccc2)n1 ZINC001222544400 1052510152 /nfs/dbraw/zinc/51/01/52/1052510152.db2.gz PTLYGRAZICESHV-UHFFFAOYSA-N 1 2 314.392 4.155 20 0 DIADLO Cn1c[nH+]cc1CO[C@H](c1ccccc1)C(Cl)(Cl)Cl ZINC001222595238 1052514987 /nfs/dbraw/zinc/51/49/87/1052514987.db2.gz UUGUUHCTHZREMG-GFCCVEGCSA-N 1 2 319.619 4.048 20 0 DIADLO Cn1c[nH+]cc1CO[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC001222594023 1052515171 /nfs/dbraw/zinc/51/51/71/1052515171.db2.gz BQCWYQRTPFJIQU-SFHVURJKSA-N 1 2 312.800 4.380 20 0 DIADLO Cn1c[nH+]cc1CO[C@@H](c1ccccc1)c1ccccc1Cl ZINC001222600443 1052516329 /nfs/dbraw/zinc/51/63/29/1052516329.db2.gz PHXWOSUTDONFIY-SFHVURJKSA-N 1 2 312.800 4.380 20 0 DIADLO COCC[N@H+](C)Cc1csc(-c2ccc(C(C)C)cc2)n1 ZINC000054355438 1052517006 /nfs/dbraw/zinc/51/70/06/1052517006.db2.gz CTJMEMMGZOIPEW-UHFFFAOYSA-N 1 2 304.459 4.012 20 0 DIADLO COCC[N@@H+](C)Cc1csc(-c2ccc(C(C)C)cc2)n1 ZINC000054355438 1052517011 /nfs/dbraw/zinc/51/70/11/1052517011.db2.gz CTJMEMMGZOIPEW-UHFFFAOYSA-N 1 2 304.459 4.012 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1cc(O)cc(Cl)c1)c1ccco1 ZINC001649025622 1052534146 /nfs/dbraw/zinc/53/41/46/1052534146.db2.gz SEAWMSQYUTYDMZ-INIZCTEOSA-N 1 2 323.820 4.142 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccsc2C(F)(F)F)on1 ZINC000529524895 1052604675 /nfs/dbraw/zinc/60/46/75/1052604675.db2.gz KTMCZTTVXLDWEO-NSHDSACASA-N 1 2 316.348 4.400 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccsc2C(F)(F)F)on1 ZINC000529524895 1052604682 /nfs/dbraw/zinc/60/46/82/1052604682.db2.gz KTMCZTTVXLDWEO-NSHDSACASA-N 1 2 316.348 4.400 20 0 DIADLO Clc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)c(Cl)c1 ZINC001235964636 1052606904 /nfs/dbraw/zinc/60/69/04/1052606904.db2.gz FDPKRWWPZSYEMX-UHFFFAOYSA-N 1 2 304.180 4.300 20 0 DIADLO Clc1cc(Cl)cc(NC2CCN(c3cccc[nH+]3)CC2)c1 ZINC000037199520 1052611343 /nfs/dbraw/zinc/61/13/43/1052611343.db2.gz QHVPTFRMHWGZOH-UHFFFAOYSA-N 1 2 322.239 4.469 20 0 DIADLO CCCCC[N@H+](Cc1nnc(C2CC2)o1)Cc1ccc(F)cc1 ZINC000125674490 1052650415 /nfs/dbraw/zinc/65/04/15/1052650415.db2.gz ALKJJDNPROFHAG-UHFFFAOYSA-N 1 2 317.408 4.279 20 0 DIADLO CCCCC[N@@H+](Cc1nnc(C2CC2)o1)Cc1ccc(F)cc1 ZINC000125674490 1052650418 /nfs/dbraw/zinc/65/04/18/1052650418.db2.gz ALKJJDNPROFHAG-UHFFFAOYSA-N 1 2 317.408 4.279 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCC[C@H]2c2ccc(C(C)C)cc2)o1 ZINC000125895165 1052655784 /nfs/dbraw/zinc/65/57/84/1052655784.db2.gz TUADPCCACZECOG-KRWDZBQOSA-N 1 2 313.445 4.483 20 0 DIADLO CCc1nnc(C[N@H+]2CCCC[C@H]2c2ccc(C(C)C)cc2)o1 ZINC000125895165 1052655786 /nfs/dbraw/zinc/65/57/86/1052655786.db2.gz TUADPCCACZECOG-KRWDZBQOSA-N 1 2 313.445 4.483 20 0 DIADLO Cc1csc(C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)n1 ZINC000126010454 1052665087 /nfs/dbraw/zinc/66/50/87/1052665087.db2.gz QHCLGLFPGHBLHJ-GOSISDBHSA-N 1 2 312.413 4.470 20 0 DIADLO CCc1ccc(-c2ccc(C[NH2+]Cc3ncccc3F)o2)cc1 ZINC000126406792 1052669434 /nfs/dbraw/zinc/66/94/34/1052669434.db2.gz RAXMRNCAHRWZOF-UHFFFAOYSA-N 1 2 310.372 4.333 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2ccc(C)c(F)c2)n1 ZINC000126637978 1052672902 /nfs/dbraw/zinc/67/29/02/1052672902.db2.gz ZJZIKJVJAIEPSM-OLZOCXBDSA-N 1 2 305.397 4.272 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1coc(C(C)(C)C)n1 ZINC000929961094 1052679867 /nfs/dbraw/zinc/67/98/67/1052679867.db2.gz DHPAZBPOPKDKJL-UHFFFAOYSA-N 1 2 302.418 4.006 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)CC(=O)NC1CCCCCCC1 ZINC000917064113 1052688730 /nfs/dbraw/zinc/68/87/30/1052688730.db2.gz JFPPZGQTOUJXAY-OAHLLOKOSA-N 1 2 320.452 4.048 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)CC(=O)NC1CCCCCCC1 ZINC000917064113 1052688735 /nfs/dbraw/zinc/68/87/35/1052688735.db2.gz JFPPZGQTOUJXAY-OAHLLOKOSA-N 1 2 320.452 4.048 20 0 DIADLO COc1ccc(Cl)cc1CNc1cc(C)[nH+]c(C(C)C)n1 ZINC000917078067 1052694085 /nfs/dbraw/zinc/69/40/85/1052694085.db2.gz YCFAFDUHFDZRBP-UHFFFAOYSA-N 1 2 305.809 4.183 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1ccc(F)cc1Br ZINC000127882667 1052703464 /nfs/dbraw/zinc/70/34/64/1052703464.db2.gz CZUTUMLNQISFTA-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccc(F)cc1Br ZINC000127882667 1052703471 /nfs/dbraw/zinc/70/34/71/1052703471.db2.gz CZUTUMLNQISFTA-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1ccc(F)cc1Br ZINC000127882899 1052703933 /nfs/dbraw/zinc/70/39/33/1052703933.db2.gz CZUTUMLNQISFTA-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccc(F)cc1Br ZINC000127882899 1052703937 /nfs/dbraw/zinc/70/39/37/1052703937.db2.gz CZUTUMLNQISFTA-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO c1ccc2nc(Nc3ccc([NH+]4CCCCC4)cc3)cnc2c1 ZINC000917385532 1052724968 /nfs/dbraw/zinc/72/49/68/1052724968.db2.gz SGDLPFGOAHHIHK-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO Cc1cccc(C[N@H+](C)CN2c3cccc4cccc(c34)C2=O)c1 ZINC000917483884 1052730594 /nfs/dbraw/zinc/73/05/94/1052730594.db2.gz YVJYWHCSANSVPQ-UHFFFAOYSA-N 1 2 316.404 4.198 20 0 DIADLO Cc1cccc(C[N@@H+](C)CN2c3cccc4cccc(c34)C2=O)c1 ZINC000917483884 1052730597 /nfs/dbraw/zinc/73/05/97/1052730597.db2.gz YVJYWHCSANSVPQ-UHFFFAOYSA-N 1 2 316.404 4.198 20 0 DIADLO C[C@H]1CCC[N@H+](CC(=O)Nc2c(Cl)cccc2Cl)CC1 ZINC000068837884 1052765130 /nfs/dbraw/zinc/76/51/30/1052765130.db2.gz YVWHITZHLUWRAA-NSHDSACASA-N 1 2 315.244 4.054 20 0 DIADLO C[C@H]1CCC[N@@H+](CC(=O)Nc2c(Cl)cccc2Cl)CC1 ZINC000068837884 1052765133 /nfs/dbraw/zinc/76/51/33/1052765133.db2.gz YVWHITZHLUWRAA-NSHDSACASA-N 1 2 315.244 4.054 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2nnc(C(C)(C)C)o2)c(C)c1 ZINC000918023572 1052773488 /nfs/dbraw/zinc/77/34/88/1052773488.db2.gz DKPZBAZIQNBRJH-CQSZACIVSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nnc(C(C)(C)C)o2)c(C)c1 ZINC000918023572 1052773492 /nfs/dbraw/zinc/77/34/92/1052773492.db2.gz DKPZBAZIQNBRJH-CQSZACIVSA-N 1 2 301.434 4.177 20 0 DIADLO O=C(/C=C/Sc1ccccc1)Nc1ccccc1-n1cc[nH+]c1 ZINC000918066472 1052777291 /nfs/dbraw/zinc/77/72/91/1052777291.db2.gz YCLAAOXRXFPNFL-JLHYYAGUSA-N 1 2 321.405 4.117 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)CC(=O)Nc1ccccc1C(C)(C)C ZINC000069068155 1052779551 /nfs/dbraw/zinc/77/95/51/1052779551.db2.gz CRLVIMLMCTUZJQ-AWEZNQCLSA-N 1 2 314.429 4.209 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)CC(=O)Nc1ccccc1C(C)(C)C ZINC000069068155 1052779555 /nfs/dbraw/zinc/77/95/55/1052779555.db2.gz CRLVIMLMCTUZJQ-AWEZNQCLSA-N 1 2 314.429 4.209 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)CC(=O)Nc1ccccc1C(C)(C)C ZINC000069068156 1052779664 /nfs/dbraw/zinc/77/96/64/1052779664.db2.gz CRLVIMLMCTUZJQ-CQSZACIVSA-N 1 2 314.429 4.209 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)CC(=O)Nc1ccccc1C(C)(C)C ZINC000069068156 1052779669 /nfs/dbraw/zinc/77/96/69/1052779669.db2.gz CRLVIMLMCTUZJQ-CQSZACIVSA-N 1 2 314.429 4.209 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000556054893 1052794232 /nfs/dbraw/zinc/79/42/32/1052794232.db2.gz SALIWTJWCFXTAT-UHFFFAOYSA-N 1 2 303.475 4.061 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000556054893 1052794237 /nfs/dbraw/zinc/79/42/37/1052794237.db2.gz SALIWTJWCFXTAT-UHFFFAOYSA-N 1 2 303.475 4.061 20 0 DIADLO CCn1nccc1C[N@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000129885884 1052813626 /nfs/dbraw/zinc/81/36/26/1052813626.db2.gz LMQJPOBTMFVRTK-ZDUSSCGKSA-N 1 2 303.837 4.282 20 0 DIADLO CCn1nccc1C[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000129885884 1052813630 /nfs/dbraw/zinc/81/36/30/1052813630.db2.gz LMQJPOBTMFVRTK-ZDUSSCGKSA-N 1 2 303.837 4.282 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1nccn1Cc1ccccc1 ZINC000129972154 1052816494 /nfs/dbraw/zinc/81/64/94/1052816494.db2.gz KFLCUUAGMFCGMQ-OAHLLOKOSA-N 1 2 311.454 4.186 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1nccn1Cc1ccccc1 ZINC000129972154 1052816497 /nfs/dbraw/zinc/81/64/97/1052816497.db2.gz KFLCUUAGMFCGMQ-OAHLLOKOSA-N 1 2 311.454 4.186 20 0 DIADLO Cc1nnsc1[C@@H](C)[NH+]1CCC(=Cc2cccc(F)c2)CC1 ZINC000930052585 1052846446 /nfs/dbraw/zinc/84/64/46/1052846446.db2.gz NRFDKTQMLLVJRL-CYBMUJFWSA-N 1 2 317.433 4.226 20 0 DIADLO CC[C@@H]1CCC[C@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000556418222 1052850685 /nfs/dbraw/zinc/85/06/85/1052850685.db2.gz ZQJHYQQFIZRNDZ-NVXWUHKLSA-N 1 2 322.412 4.275 20 0 DIADLO Cc1cccc(C2=CCN(C(=O)c3c(C)cc(C)[nH+]c3C)CC2)c1 ZINC001127483404 1052864435 /nfs/dbraw/zinc/86/44/35/1052864435.db2.gz MYVLOBMVCRIHKC-UHFFFAOYSA-N 1 2 320.436 4.245 20 0 DIADLO CC[N@H+](Cc1cnc(C(C)(C)C)nc1)Cc1ccccc1Cl ZINC000556601833 1052871001 /nfs/dbraw/zinc/87/10/01/1052871001.db2.gz KQGODUZNCROFTE-UHFFFAOYSA-N 1 2 317.864 4.450 20 0 DIADLO CC[N@@H+](Cc1cnc(C(C)(C)C)nc1)Cc1ccccc1Cl ZINC000556601833 1052871005 /nfs/dbraw/zinc/87/10/05/1052871005.db2.gz KQGODUZNCROFTE-UHFFFAOYSA-N 1 2 317.864 4.450 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2cccc(C3CCC3)c2)c[nH+]1 ZINC000556632217 1052872959 /nfs/dbraw/zinc/87/29/59/1052872959.db2.gz OOUWRLKREKKNOV-UHFFFAOYSA-N 1 2 309.413 4.288 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2C[C@H](c3ccccc3C)C2)c(C)[nH+]1 ZINC000556632241 1052873017 /nfs/dbraw/zinc/87/30/17/1052873017.db2.gz PYDKDLOMKKCKMX-QAQDUYKDSA-N 1 2 323.440 4.383 20 0 DIADLO CNc1ccc(Nc2cc(-c3ccc(Cl)s3)on2)c[nH+]1 ZINC001203454768 1052879687 /nfs/dbraw/zinc/87/96/87/1052879687.db2.gz LOOIHDNEYZLXTC-UHFFFAOYSA-N 1 2 306.778 4.237 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccn(C)n1)c1ccc(Oc2ccccc2)cn1 ZINC000556890034 1052894760 /nfs/dbraw/zinc/89/47/60/1052894760.db2.gz BRUKXUZZBOYWHP-CABCVRRESA-N 1 2 322.412 4.019 20 0 DIADLO CC1(C)C[N@H+](Cc2ncc(C(F)(F)F)s2)[C@H]2CCC[C@H]21 ZINC000556958946 1052905456 /nfs/dbraw/zinc/90/54/56/1052905456.db2.gz LMZDISATLVBDPM-ZJUUUORDSA-N 1 2 304.381 4.172 20 0 DIADLO CC1(C)C[N@@H+](Cc2ncc(C(F)(F)F)s2)[C@H]2CCC[C@H]21 ZINC000556958946 1052905460 /nfs/dbraw/zinc/90/54/60/1052905460.db2.gz LMZDISATLVBDPM-ZJUUUORDSA-N 1 2 304.381 4.172 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1nc2ccccc2o1 ZINC000556980359 1052908020 /nfs/dbraw/zinc/90/80/20/1052908020.db2.gz DOELSERPUXVZMF-OLZOCXBDSA-N 1 2 310.372 4.475 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1nc2ccccc2o1 ZINC000556980359 1052908022 /nfs/dbraw/zinc/90/80/22/1052908022.db2.gz DOELSERPUXVZMF-OLZOCXBDSA-N 1 2 310.372 4.475 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+](Cc1ncc(Cl)n1C)C1CC1 ZINC000920086880 1052918863 /nfs/dbraw/zinc/91/88/63/1052918863.db2.gz PTGYAGLSVBLTAU-LLVKDONJSA-N 1 2 324.255 4.453 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](Cc1ncc(Cl)n1C)C1CC1 ZINC000920086880 1052918866 /nfs/dbraw/zinc/91/88/66/1052918866.db2.gz PTGYAGLSVBLTAU-LLVKDONJSA-N 1 2 324.255 4.453 20 0 DIADLO C/C(=C\C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccc(F)cc1 ZINC000921279999 1052969568 /nfs/dbraw/zinc/96/95/68/1052969568.db2.gz BECMYVCCQFWEHL-SDNWHVSQSA-N 1 2 321.355 4.053 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccc(-n2ccnc2)cc1 ZINC000921482484 1052973887 /nfs/dbraw/zinc/97/38/87/1052973887.db2.gz NNSMXQMQULDBBZ-AWEZNQCLSA-N 1 2 324.428 4.009 20 0 DIADLO COc1ccccc1[C@@H](Oc1c(C)cc[nH+]c1C)C(F)(F)F ZINC001227263652 1052977484 /nfs/dbraw/zinc/97/74/84/1052977484.db2.gz GMBVQXBJDWCSBP-OAHLLOKOSA-N 1 2 311.303 4.389 20 0 DIADLO CC(C)(C)[NH+]1CC(Oc2ccc(-c3ccc(O)cc3)cc2F)C1 ZINC001227360976 1052984867 /nfs/dbraw/zinc/98/48/67/1052984867.db2.gz QSEZEOYHBKDMCY-UHFFFAOYSA-N 1 2 315.388 4.060 20 0 DIADLO CC(C)c1ccc([C@H]2CCC[N@@H+]2Cc2nnc(C3CC3)[nH]2)cc1 ZINC000347484920 1052986931 /nfs/dbraw/zinc/98/69/31/1052986931.db2.gz JDVXXMBLGSYDDE-QGZVFWFLSA-N 1 2 310.445 4.143 20 0 DIADLO CC(C)c1ccc([C@H]2CCC[N@H+]2Cc2nnc(C3CC3)[nH]2)cc1 ZINC000347484920 1052986932 /nfs/dbraw/zinc/98/69/32/1052986932.db2.gz JDVXXMBLGSYDDE-QGZVFWFLSA-N 1 2 310.445 4.143 20 0 DIADLO O=c1cc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)cc[nH]1 ZINC001212265601 1053006930 /nfs/dbraw/zinc/00/69/30/1053006930.db2.gz SNUGTHINTALFME-UHFFFAOYSA-N 1 2 305.259 4.098 20 0 DIADLO Oc1c(Cl)cccc1C[NH+]1CCC(Oc2ccccc2)CC1 ZINC000179728603 1053023414 /nfs/dbraw/zinc/02/34/14/1053023414.db2.gz AOBBYGVQMNGWBL-UHFFFAOYSA-N 1 2 317.816 4.089 20 0 DIADLO C[C@@H](CSC(C)(C)C)[NH2+]c1ccc(N2CCO[C@H](C)C2)cc1 ZINC000179949588 1053037484 /nfs/dbraw/zinc/03/74/84/1053037484.db2.gz NETIMKYAMGFYPY-LSDHHAIUSA-N 1 2 322.518 4.244 20 0 DIADLO COc1cc2c(cc1O[C@@H]1CCCc3ccccc31)C=[NH+]CC2 ZINC001228091080 1053042644 /nfs/dbraw/zinc/04/26/44/1053042644.db2.gz RMEMZVXYPVLESK-GOSISDBHSA-N 1 2 307.393 4.127 20 0 DIADLO COc1cc2c(cc1O[C@@H](C)c1ccc(Cl)cc1)C=[NH+]CC2 ZINC001228091117 1053042989 /nfs/dbraw/zinc/04/29/89/1053042989.db2.gz RYUKSIDJCUJODJ-LBPRGKRZSA-N 1 2 315.800 4.464 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1cccc(Cl)c1O)CCC2 ZINC000180231852 1053049921 /nfs/dbraw/zinc/04/99/21/1053049921.db2.gz SKCOLKWEPIRNFL-CQSZACIVSA-N 1 2 322.861 4.320 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1cccc(Cl)c1O)CCC2 ZINC000180231852 1053049924 /nfs/dbraw/zinc/04/99/24/1053049924.db2.gz SKCOLKWEPIRNFL-CQSZACIVSA-N 1 2 322.861 4.320 20 0 DIADLO CCCCCC(CCCCC)NC(=O)[C@@H]1CCn2cc[nH+]c2C1 ZINC000180513911 1053068028 /nfs/dbraw/zinc/06/80/28/1053068028.db2.gz SBPTXZJKMUOMAR-MRXNPFEDSA-N 1 2 319.493 4.091 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cc(Cl)cc(C)c2O)s1 ZINC000180559186 1053070001 /nfs/dbraw/zinc/07/00/01/1053070001.db2.gz ZNACRHDBBJUXOB-UHFFFAOYSA-N 1 2 310.850 4.005 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cc(Cl)cc(C)c2O)s1 ZINC000180559186 1053070011 /nfs/dbraw/zinc/07/00/11/1053070011.db2.gz ZNACRHDBBJUXOB-UHFFFAOYSA-N 1 2 310.850 4.005 20 0 DIADLO Cc1[nH]c2ccc(O[C@H](c3ccccc3)c3ccccn3)cc2[nH+]1 ZINC001228326590 1053074416 /nfs/dbraw/zinc/07/44/16/1053074416.db2.gz IXYFQVSHSJEZPZ-HXUWFJFHSA-N 1 2 315.376 4.435 20 0 DIADLO Cc1[nH]c2ccc(O[C@H]3CCCc4c(Cl)ccnc43)cc2[nH+]1 ZINC001228329940 1053075616 /nfs/dbraw/zinc/07/56/16/1053075616.db2.gz SLIBSNYVJAUVQS-INIZCTEOSA-N 1 2 313.788 4.376 20 0 DIADLO Oc1c(Cl)cccc1C[N@H+](CCC(F)(F)F)CC1CC1 ZINC000180703360 1053077703 /nfs/dbraw/zinc/07/77/03/1053077703.db2.gz UCONTVQOWUQACE-UHFFFAOYSA-N 1 2 307.743 4.210 20 0 DIADLO Oc1c(Cl)cccc1C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000180703360 1053077712 /nfs/dbraw/zinc/07/77/12/1053077712.db2.gz UCONTVQOWUQACE-UHFFFAOYSA-N 1 2 307.743 4.210 20 0 DIADLO CC(C)[N@@H+](Cc1ccccc1)Cn1ncn(C(C)(C)C)c1=S ZINC000068867852 1053078599 /nfs/dbraw/zinc/07/85/99/1053078599.db2.gz YWYIXXYKUABFKL-UHFFFAOYSA-N 1 2 318.490 4.037 20 0 DIADLO CC(C)[N@H+](Cc1ccccc1)Cn1ncn(C(C)(C)C)c1=S ZINC000068867852 1053078610 /nfs/dbraw/zinc/07/86/10/1053078610.db2.gz YWYIXXYKUABFKL-UHFFFAOYSA-N 1 2 318.490 4.037 20 0 DIADLO Cc1cccc(Cl)c1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001350617957 1053088340 /nfs/dbraw/zinc/08/83/40/1053088340.db2.gz RILKWCGYJKLJKG-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1cc(N[C@@H](c2ccccc2)[C@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC000538979106 1053089072 /nfs/dbraw/zinc/08/90/72/1053089072.db2.gz HDWAQEREQSRBQH-WMZOPIPTSA-N 1 2 311.429 4.098 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@H]1CCCC[C@H]1C1CC1 ZINC001350618014 1053089078 /nfs/dbraw/zinc/08/90/78/1053089078.db2.gz SPSOTUCQLMQQOA-ROUUACIJSA-N 1 2 309.413 4.027 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C=Cc3ccc(Cl)s3)cc2[nH+]1 ZINC000849365759 1053089790 /nfs/dbraw/zinc/08/97/90/1053089790.db2.gz GVNUZWRUOGQXBY-DAXSKMNVSA-N 1 2 317.801 4.238 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1cccnc1Cl ZINC000849347310 1053089967 /nfs/dbraw/zinc/08/99/67/1053089967.db2.gz BYTYPCJDEFSVPB-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO Cc1cc(N[C@@H](c2ccccc2)[C@@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC000538979101 1053089994 /nfs/dbraw/zinc/08/99/94/1053089994.db2.gz HDWAQEREQSRBQH-AEFFLSMTSA-N 1 2 311.429 4.098 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1cccc(COC)c1 ZINC000539708349 1053095399 /nfs/dbraw/zinc/09/53/99/1053095399.db2.gz SHLJCAWTHRNLEU-UHFFFAOYSA-N 1 2 309.413 4.205 20 0 DIADLO CC(C)c1ccc(NC(=O)C[N@H+](C)[C@H](C)c2ccco2)cc1 ZINC000069069747 1053109114 /nfs/dbraw/zinc/10/91/14/1053109114.db2.gz BWKTYJUTSSVRAF-CQSZACIVSA-N 1 2 300.402 4.035 20 0 DIADLO CC(C)c1ccc(NC(=O)C[N@@H+](C)[C@H](C)c2ccco2)cc1 ZINC000069069747 1053109117 /nfs/dbraw/zinc/10/91/17/1053109117.db2.gz BWKTYJUTSSVRAF-CQSZACIVSA-N 1 2 300.402 4.035 20 0 DIADLO Cc1ccc(O)c(Nc2ccc(CNc3ccccc3)cc2)[nH+]1 ZINC001212297748 1053139011 /nfs/dbraw/zinc/13/90/11/1053139011.db2.gz FMPXXBNSTKCHTH-UHFFFAOYSA-N 1 2 305.381 4.451 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C(F)(F)F)s1)c1ccc(C)cc1 ZINC000660175366 1053153092 /nfs/dbraw/zinc/15/30/92/1053153092.db2.gz PXYAFXPMPDZMJS-NSHDSACASA-N 1 2 315.364 4.106 20 0 DIADLO CSC1CC[NH+](Cc2cnc(Cl)c(C(F)(F)F)c2)CC1 ZINC001236635693 1053157019 /nfs/dbraw/zinc/15/70/19/1053157019.db2.gz MJQNQGGWTMHCRR-UHFFFAOYSA-N 1 2 324.799 4.081 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1cc(F)cc(F)c1 ZINC000090572518 1053236461 /nfs/dbraw/zinc/23/64/61/1053236461.db2.gz KQYYFGDEFPWYFP-LBPRGKRZSA-N 1 2 305.372 4.127 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@@H+]2CC(C)(C)C2(C)C)c(Cl)c1 ZINC001319359754 1053237005 /nfs/dbraw/zinc/23/70/05/1053237005.db2.gz GQEBCEPZGRMXDJ-LBPRGKRZSA-N 1 2 308.853 4.096 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@H+]2CC(C)(C)C2(C)C)c(Cl)c1 ZINC001319359754 1053237013 /nfs/dbraw/zinc/23/70/13/1053237013.db2.gz GQEBCEPZGRMXDJ-LBPRGKRZSA-N 1 2 308.853 4.096 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1cc(F)cc(F)c1 ZINC000090572520 1053236989 /nfs/dbraw/zinc/23/69/89/1053236989.db2.gz KQYYFGDEFPWYFP-GFCCVEGCSA-N 1 2 305.372 4.127 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CC[C@@H]3CCCC[C@H]3C2)n1 ZINC001319421639 1053242688 /nfs/dbraw/zinc/24/26/88/1053242688.db2.gz MNFCDERJFJECTL-QWRGUYRKSA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CC[C@@H]3CCCC[C@H]3C2)n1 ZINC001319421639 1053242694 /nfs/dbraw/zinc/24/26/94/1053242694.db2.gz MNFCDERJFJECTL-QWRGUYRKSA-N 1 2 304.381 4.174 20 0 DIADLO CCCC1CC[NH+](CC(=O)Nc2c(C)cccc2Cl)CC1 ZINC001319511348 1053247859 /nfs/dbraw/zinc/24/78/59/1053247859.db2.gz TZIHWQLJCLFSMB-UHFFFAOYSA-N 1 2 308.853 4.099 20 0 DIADLO CC(C)c1noc(C[N@@H+]2C[C@@H]3CCCC[C@]32c2ccccc2)n1 ZINC001319808168 1053275473 /nfs/dbraw/zinc/27/54/73/1053275473.db2.gz IYQMCLXLYRKGNS-LPHOPBHVSA-N 1 2 311.429 4.094 20 0 DIADLO CC(C)c1noc(C[N@H+]2C[C@@H]3CCCC[C@]32c2ccccc2)n1 ZINC001319808168 1053275480 /nfs/dbraw/zinc/27/54/80/1053275480.db2.gz IYQMCLXLYRKGNS-LPHOPBHVSA-N 1 2 311.429 4.094 20 0 DIADLO CC[N@H+](Cc1cnc([C@@H]2CCCO2)s1)Cc1ccccc1F ZINC001319799427 1053276471 /nfs/dbraw/zinc/27/64/71/1053276471.db2.gz YFEHDWWZDWSZEC-INIZCTEOSA-N 1 2 320.433 4.156 20 0 DIADLO CC[N@@H+](Cc1cnc([C@@H]2CCCO2)s1)Cc1ccccc1F ZINC001319799427 1053276479 /nfs/dbraw/zinc/27/64/79/1053276479.db2.gz YFEHDWWZDWSZEC-INIZCTEOSA-N 1 2 320.433 4.156 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2-c2ccccc2C)c(C)c[nH+]1 ZINC001127647306 1053280534 /nfs/dbraw/zinc/28/05/34/1053280534.db2.gz ONLPJHKNBUAUGR-UHFFFAOYSA-N 1 2 316.404 4.348 20 0 DIADLO C[C@H](CC(=O)Nc1cccc(-c2cccs2)c1)n1cc[nH+]c1 ZINC001352163044 1053286006 /nfs/dbraw/zinc/28/60/06/1053286006.db2.gz HGGQHYWYDOAPMC-CYBMUJFWSA-N 1 2 311.410 4.201 20 0 DIADLO CC(C)[N@H+](Cc1nc2c(s1)C[C@H](C)CC2)Cc1ccccn1 ZINC001319933542 1053286299 /nfs/dbraw/zinc/28/62/99/1053286299.db2.gz VFPKIKDPQVJBJN-CQSZACIVSA-N 1 2 315.486 4.074 20 0 DIADLO CC(C)[N@@H+](Cc1nc2c(s1)C[C@H](C)CC2)Cc1ccccn1 ZINC001319933542 1053286307 /nfs/dbraw/zinc/28/63/07/1053286307.db2.gz VFPKIKDPQVJBJN-CQSZACIVSA-N 1 2 315.486 4.074 20 0 DIADLO CCc1cc(OCc2cn(C)nc2C(F)F)c2ccccc2[nH+]1 ZINC001320450902 1053334547 /nfs/dbraw/zinc/33/45/47/1053334547.db2.gz HXRAGSKEYWCOBC-UHFFFAOYSA-N 1 2 317.339 4.047 20 0 DIADLO CCSCc1cc[nH+]c(NCc2ccc3cnccc3c2)c1 ZINC000618678270 1053348221 /nfs/dbraw/zinc/34/82/21/1053348221.db2.gz JIULKNKNJOLMPI-UHFFFAOYSA-N 1 2 309.438 4.495 20 0 DIADLO S=C(Nc1ccc2[nH+]ccn2c1)Nc1cccc2ccccc21 ZINC001200094732 1053374021 /nfs/dbraw/zinc/37/40/21/1053374021.db2.gz DJIBLYYIXVFENZ-UHFFFAOYSA-N 1 2 318.405 4.296 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cccc(OC(C)(C)C)c2)c(C)[nH+]1 ZINC001434889468 1053378646 /nfs/dbraw/zinc/37/86/46/1053378646.db2.gz HRKVFZZYHGALEW-UHFFFAOYSA-N 1 2 312.413 4.436 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CC[C@H]3CCCC[C@@H]3C2)s1 ZINC001321131466 1053392198 /nfs/dbraw/zinc/39/21/98/1053392198.db2.gz SRLIYVKHAZXZRO-GHMZBOCLSA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CC[C@H]3CCCC[C@@H]3C2)s1 ZINC001321131466 1053392210 /nfs/dbraw/zinc/39/22/10/1053392210.db2.gz SRLIYVKHAZXZRO-GHMZBOCLSA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CC[C@H]3CCCC[C@H]3C2)s1 ZINC001321131467 1053393262 /nfs/dbraw/zinc/39/32/62/1053393262.db2.gz SRLIYVKHAZXZRO-MNOVXSKESA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CC[C@H]3CCCC[C@H]3C2)s1 ZINC001321131467 1053393270 /nfs/dbraw/zinc/39/32/70/1053393270.db2.gz SRLIYVKHAZXZRO-MNOVXSKESA-N 1 2 304.381 4.174 20 0 DIADLO Cc1cc(SC(C)(C)C)ccc1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001321334389 1053409538 /nfs/dbraw/zinc/40/95/38/1053409538.db2.gz JSPTYYIIIKWUBI-ZDUSSCGKSA-N 1 2 317.458 4.282 20 0 DIADLO COc1cccc(C2CC[NH+](C/C(Cl)=C/Cl)CC2)c1 ZINC000763519173 1053414762 /nfs/dbraw/zinc/41/47/62/1053414762.db2.gz RGMNSRLJDPCJKV-UVTDQMKNSA-N 1 2 300.229 4.194 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](Cc2cnc(C(C)C)s2)CCO1 ZINC000093478317 1053415077 /nfs/dbraw/zinc/41/50/77/1053415077.db2.gz NUUUECASLFFLKD-QGZVFWFLSA-N 1 2 316.470 4.148 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2cnc(C(C)C)s2)CCO1 ZINC000093478317 1053415088 /nfs/dbraw/zinc/41/50/88/1053415088.db2.gz NUUUECASLFFLKD-QGZVFWFLSA-N 1 2 316.470 4.148 20 0 DIADLO Cc1ncsc1C[N@@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000093530112 1053421581 /nfs/dbraw/zinc/42/15/81/1053421581.db2.gz KUNYPPLWUFQZAN-AWEZNQCLSA-N 1 2 324.902 4.395 20 0 DIADLO Cc1ncsc1C[N@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000093530112 1053421598 /nfs/dbraw/zinc/42/15/98/1053421598.db2.gz KUNYPPLWUFQZAN-AWEZNQCLSA-N 1 2 324.902 4.395 20 0 DIADLO Cc1ccc(OC[C@@H](C)Oc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001229953537 1053438371 /nfs/dbraw/zinc/43/83/71/1053438371.db2.gz ARIPVILMURMIDJ-MRXNPFEDSA-N 1 2 308.381 4.027 20 0 DIADLO CCOc1ccc([C@@H](C)Oc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001229954554 1053438412 /nfs/dbraw/zinc/43/84/12/1053438412.db2.gz QZQWTCOJILOBHX-OAHLLOKOSA-N 1 2 308.381 4.411 20 0 DIADLO COc1ccc([C@@H](C)Oc2ccc(-n3cc[nH+]c3)cc2)c(F)c1 ZINC001229954900 1053438946 /nfs/dbraw/zinc/43/89/46/1053438946.db2.gz VSXXDISNUFJRSL-CYBMUJFWSA-N 1 2 312.344 4.160 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1ccc(N2CCCC2=O)cc1 ZINC000182494472 1053455719 /nfs/dbraw/zinc/45/57/19/1053455719.db2.gz ZCFUXOIZHHBAET-HNNXBMFYSA-N 1 2 323.440 4.053 20 0 DIADLO Cl/C=C(\Cl)C[N@@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000763566339 1053479164 /nfs/dbraw/zinc/47/91/64/1053479164.db2.gz NCTTXVYLULPCKD-UVQBRAAOSA-N 1 2 314.256 4.029 20 0 DIADLO Cl/C=C(\Cl)C[N@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000763566339 1053479169 /nfs/dbraw/zinc/47/91/69/1053479169.db2.gz NCTTXVYLULPCKD-UVQBRAAOSA-N 1 2 314.256 4.029 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc2c(c1)Cc1ccccc1-2)n1cc[nH+]c1 ZINC001353111946 1053483270 /nfs/dbraw/zinc/48/32/70/1053483270.db2.gz UXHCUWORRYTWJR-AWEZNQCLSA-N 1 2 317.392 4.044 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C)c3ccc(C(C)C)cc3)ccn12 ZINC000847581798 1053484279 /nfs/dbraw/zinc/48/42/79/1053484279.db2.gz PEVOLPRTKHMMBT-UHFFFAOYSA-N 1 2 307.397 4.043 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccnn2-c2ccccc2)ccc1[NH+](C)C ZINC001322576912 1053522791 /nfs/dbraw/zinc/52/27/91/1053522791.db2.gz VNGFNLFVZJHWLK-INIZCTEOSA-N 1 2 320.440 4.420 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc2c(s1)C[C@H](C)CC2)c1nccs1 ZINC000152763284 1053526609 /nfs/dbraw/zinc/52/66/09/1053526609.db2.gz KMVHUGUKOCTXIF-BZNIZROVSA-N 1 2 321.515 4.139 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)oc1C ZINC001322653525 1053534046 /nfs/dbraw/zinc/53/40/46/1053534046.db2.gz WBJKYBAZRFFFDA-XJKSGUPXSA-N 1 2 301.434 4.402 20 0 DIADLO C[C@@H](CC1CCCCC1)C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC001322859643 1053546733 /nfs/dbraw/zinc/54/67/33/1053546733.db2.gz MUPKODADVURTLL-DOTOQJQBSA-N 1 2 319.493 4.021 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccc(Cl)nc1 ZINC000182956089 1053561661 /nfs/dbraw/zinc/56/16/61/1053561661.db2.gz FZSMPCVDCHMQAT-GFCCVEGCSA-N 1 2 301.821 4.291 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccc(Cl)nc1 ZINC000182956089 1053561671 /nfs/dbraw/zinc/56/16/71/1053561671.db2.gz FZSMPCVDCHMQAT-GFCCVEGCSA-N 1 2 301.821 4.291 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1cccnc1Cl ZINC000182955067 1053562529 /nfs/dbraw/zinc/56/25/29/1053562529.db2.gz OMNFGLYTRLRZRB-GFCCVEGCSA-N 1 2 301.821 4.291 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1cccnc1Cl ZINC000182955067 1053562540 /nfs/dbraw/zinc/56/25/40/1053562540.db2.gz OMNFGLYTRLRZRB-GFCCVEGCSA-N 1 2 301.821 4.291 20 0 DIADLO Cc1ccc(NC(=S)Nc2ccc3[nH+]ccn3c2)c(Cl)c1 ZINC001200328447 1053563231 /nfs/dbraw/zinc/56/32/31/1053563231.db2.gz XUBONFJWPAFYGC-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO C[C@H]([NH2+]Cc1noc2c1CCCC2)c1ccc(Cl)c(F)c1 ZINC001323438724 1053582269 /nfs/dbraw/zinc/58/22/69/1053582269.db2.gz NHIRTLHNPCTMKB-JTQLQIEISA-N 1 2 308.784 4.197 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2cn(C)cn2)c2cccc(F)c2)cc1 ZINC001323441554 1053582603 /nfs/dbraw/zinc/58/26/03/1053582603.db2.gz FCFIPGQBDNZKAV-FQEVSTJZSA-N 1 2 323.415 4.001 20 0 DIADLO CC(C)(C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)C1CCCCC1 ZINC001353483636 1053586146 /nfs/dbraw/zinc/58/61/46/1053586146.db2.gz ZIVCAFASZXYPGO-UHFFFAOYSA-N 1 2 311.429 4.417 20 0 DIADLO Clc1ccc(CSCc2ccc(-n3cc[nH+]c3)cc2)nc1 ZINC001323528458 1053586279 /nfs/dbraw/zinc/58/62/79/1053586279.db2.gz AYEYQTSQMNUEKT-UHFFFAOYSA-N 1 2 315.829 4.354 20 0 DIADLO C/C(=C\c1ccc(Cl)cc1)C(=O)Nc1cccc2[nH+]ccn21 ZINC001353494790 1053590678 /nfs/dbraw/zinc/59/06/78/1053590678.db2.gz OPHBETBUBLOVKV-VAWYXSNFSA-N 1 2 311.772 4.030 20 0 DIADLO Cc1cc2c(cc1N[C@@H](C)c1ccc(-n3cc[nH+]c3)cc1)OCO2 ZINC000183171596 1053600392 /nfs/dbraw/zinc/60/03/92/1053600392.db2.gz NKJIOHBFYGBGCJ-AWEZNQCLSA-N 1 2 321.380 4.083 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000620127969 1053609098 /nfs/dbraw/zinc/60/90/98/1053609098.db2.gz GMQGULUZLWOGJZ-BIENJYKASA-N 1 2 317.379 4.488 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000620127969 1053609103 /nfs/dbraw/zinc/60/91/03/1053609103.db2.gz GMQGULUZLWOGJZ-BIENJYKASA-N 1 2 317.379 4.488 20 0 DIADLO C[C@@H](Oc1cc2c(cc1O)C=[NH+]CC2)c1cccc(Cl)c1 ZINC001230920068 1053625588 /nfs/dbraw/zinc/62/55/88/1053625588.db2.gz JBIFSJBHQFVFOA-LLVKDONJSA-N 1 2 301.773 4.161 20 0 DIADLO Cc1ccc(NC(=O)C[C@H]2C[C@H](C)CC(C)(C)C2)c(N(C)C)[nH+]1 ZINC001435646235 1053628315 /nfs/dbraw/zinc/62/83/15/1053628315.db2.gz VDAJANGWFJPVKX-DZGCQCFKSA-N 1 2 317.477 4.247 20 0 DIADLO Cl/C=C(/Cl)C[N@@H+]1CCC[C@@H](c2nc3ccccc3[nH]2)C1 ZINC001324297179 1053641732 /nfs/dbraw/zinc/64/17/32/1053641732.db2.gz IBLSTUOCHNUBIC-OYGDSYQHSA-N 1 2 310.228 4.061 20 0 DIADLO Cl/C=C(/Cl)C[N@H+]1CCC[C@@H](c2nc3ccccc3[nH]2)C1 ZINC001324297179 1053641737 /nfs/dbraw/zinc/64/17/37/1053641737.db2.gz IBLSTUOCHNUBIC-OYGDSYQHSA-N 1 2 310.228 4.061 20 0 DIADLO ClC1(Cl)C[C@H]1CSCc1ccc(-n2cc[nH+]c2)cc1 ZINC001324496650 1053658942 /nfs/dbraw/zinc/65/89/42/1053658942.db2.gz XRMGTAQKKQFEDU-LBPRGKRZSA-N 1 2 313.253 4.299 20 0 DIADLO Cc1cc(NC(=O)c2ccc(C(C)(C)C)c(Cl)c2)c(C)c[nH+]1 ZINC001435757182 1053665603 /nfs/dbraw/zinc/66/56/03/1053665603.db2.gz KJGGZMRWNXGXDI-UHFFFAOYSA-N 1 2 316.832 4.324 20 0 DIADLO Cc1cccc2c1CC[C@@H]2Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231079238 1053669054 /nfs/dbraw/zinc/66/90/54/1053669054.db2.gz JMKKWCQCUVWNAJ-FQEVSTJZSA-N 1 2 304.393 4.462 20 0 DIADLO COc1ccc([C@H](C)Oc2ccc(-c3[nH]cc[nH+]3)cc2)cc1OC ZINC001231082501 1053670882 /nfs/dbraw/zinc/67/08/82/1053670882.db2.gz WOSXHPUIPVDFPO-ZDUSSCGKSA-N 1 2 324.380 4.234 20 0 DIADLO C[C@H](COc1ccc(-c2[nH]cc[nH+]2)cc1)OCc1ccccc1 ZINC001231082516 1053670965 /nfs/dbraw/zinc/67/09/65/1053670965.db2.gz XDTUFEWDCPLMSJ-OAHLLOKOSA-N 1 2 308.381 4.061 20 0 DIADLO COc1ccc([C@H](C)Oc2ccc(-c3[nH]cc[nH+]3)cc2)c(F)c1 ZINC001231084222 1053671048 /nfs/dbraw/zinc/67/10/48/1053671048.db2.gz HSSUUQJTMRFVLI-LBPRGKRZSA-N 1 2 312.344 4.364 20 0 DIADLO C[C@@H](Oc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc(F)c1F ZINC001231082750 1053671595 /nfs/dbraw/zinc/67/15/95/1053671595.db2.gz YSLGBFPBPSHBRP-LLVKDONJSA-N 1 2 300.308 4.495 20 0 DIADLO Cc1ccc(OC[C@@H](C)Oc2ccc(-c3c[nH+]cn3C)cc2)cc1 ZINC001231083187 1053671706 /nfs/dbraw/zinc/67/17/06/1053671706.db2.gz DZVBJFDMYMPATM-MRXNPFEDSA-N 1 2 322.408 4.242 20 0 DIADLO Cc1ccc2c(c1)[C@@H](Oc1ccc(-c3c[nH+]cn3C)cc1)CC2 ZINC001231082450 1053672335 /nfs/dbraw/zinc/67/23/35/1053672335.db2.gz PPKSLWLCAWDISV-FQEVSTJZSA-N 1 2 304.393 4.462 20 0 DIADLO C[C@@H]1CCc2nc(C[N@@H+]3CCC[C@H]3c3ccccn3)sc2C1 ZINC001324716176 1053673930 /nfs/dbraw/zinc/67/39/30/1053673930.db2.gz HMXCRJSVIOYQLB-CJNGLKHVSA-N 1 2 313.470 4.000 20 0 DIADLO C[C@@H]1CCc2nc(C[N@H+]3CCC[C@H]3c3ccccn3)sc2C1 ZINC001324716176 1053673941 /nfs/dbraw/zinc/67/39/41/1053673941.db2.gz HMXCRJSVIOYQLB-CJNGLKHVSA-N 1 2 313.470 4.000 20 0 DIADLO CCc1nc2ccccc2c(C(=O)Nc2cc[nH+]c(C)c2)c1C ZINC000153791735 1053714389 /nfs/dbraw/zinc/71/43/89/1053714389.db2.gz UPNJPQZYVDSKAE-UHFFFAOYSA-N 1 2 305.381 4.061 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2cc(-c3ccco3)on2)CCC1 ZINC001325514029 1053720901 /nfs/dbraw/zinc/72/09/01/1053720901.db2.gz ZMFYGRGKHBHYDM-UHFFFAOYSA-N 1 2 324.380 4.112 20 0 DIADLO COC1(C(F)(F)F)CCN(c2cc(C)c3ccccc3[nH+]2)CC1 ZINC001326148340 1053760531 /nfs/dbraw/zinc/76/05/31/1053760531.db2.gz UZZRGFDAPSJCLV-UHFFFAOYSA-N 1 2 324.346 4.091 20 0 DIADLO C[C@H]1CC[C@H](CO)C[N@H+]1Cc1c(Cl)ccc(Cl)c1Cl ZINC001231479409 1053762277 /nfs/dbraw/zinc/76/22/77/1053762277.db2.gz KKUDNDSNIMDWJO-UWVGGRQHSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1CC[C@@H](CO)C[N@@H+]1Cc1c(Cl)ccc(Cl)c1Cl ZINC001231479410 1053761990 /nfs/dbraw/zinc/76/19/90/1053761990.db2.gz KKUDNDSNIMDWJO-VHSXEESVSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1CC[C@@H](CO)C[N@H+]1Cc1c(Cl)ccc(Cl)c1Cl ZINC001231479410 1053762001 /nfs/dbraw/zinc/76/20/01/1053762001.db2.gz KKUDNDSNIMDWJO-VHSXEESVSA-N 1 2 322.663 4.240 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CCCC3(COC3)C2)c1Cl ZINC001231478744 1053762161 /nfs/dbraw/zinc/76/21/61/1053762161.db2.gz FIUASQLPWOZKQL-UHFFFAOYSA-N 1 2 320.647 4.259 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CCCC3(COC3)C2)c1Cl ZINC001231478744 1053762170 /nfs/dbraw/zinc/76/21/70/1053762170.db2.gz FIUASQLPWOZKQL-UHFFFAOYSA-N 1 2 320.647 4.259 20 0 DIADLO C[C@H]1CC[C@H](CO)C[N@@H+]1Cc1c(Cl)ccc(Cl)c1Cl ZINC001231479409 1053762274 /nfs/dbraw/zinc/76/22/74/1053762274.db2.gz KKUDNDSNIMDWJO-UWVGGRQHSA-N 1 2 322.663 4.240 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1ccc(F)c2occc21 ZINC001354095018 1053763167 /nfs/dbraw/zinc/76/31/67/1053763167.db2.gz AYKGLIKUDCCOFP-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO Fc1cc(Cl)c(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c(Cl)c1 ZINC001237600487 1053773831 /nfs/dbraw/zinc/77/38/31/1053773831.db2.gz YGVTYPAILCCUKH-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1cc(Cl)c(C[N@H+]2CC[C@]3(CC3(F)F)C2)c(Cl)c1 ZINC001237600487 1053773841 /nfs/dbraw/zinc/77/38/41/1053773841.db2.gz YGVTYPAILCCUKH-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nnc(-c3ccccc3)s2)[C@@H]1c1ccccc1 ZINC000155310248 1053774711 /nfs/dbraw/zinc/77/47/11/1053774711.db2.gz WWEYFILDEVPHEE-KDOFPFPSSA-N 1 2 321.449 4.398 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccccc3)s2)[C@@H]1c1ccccc1 ZINC000155310248 1053774723 /nfs/dbraw/zinc/77/47/23/1053774723.db2.gz WWEYFILDEVPHEE-KDOFPFPSSA-N 1 2 321.449 4.398 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCc3c(Cl)cccc3C2)cn1 ZINC001231536141 1053779899 /nfs/dbraw/zinc/77/98/99/1053779899.db2.gz NCTNHAXPYMIRSE-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCc3c(Cl)cccc3C2)cn1 ZINC001231536141 1053779909 /nfs/dbraw/zinc/77/99/09/1053779909.db2.gz NCTNHAXPYMIRSE-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3CCC[C@H](F)C3)cc2)[nH+]c1C ZINC001354160128 1053784124 /nfs/dbraw/zinc/78/41/24/1053784124.db2.gz KLWUCYGCHMASAT-GJZGRUSLSA-N 1 2 315.392 4.160 20 0 DIADLO FC1CC[NH+](Cc2ccc(Cl)c(Br)c2)CC1 ZINC001231568189 1053787293 /nfs/dbraw/zinc/78/72/93/1053787293.db2.gz INGVQAHTEPFMDL-UHFFFAOYSA-N 1 2 306.606 4.036 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1nc2c(s1)CCCC2 ZINC001231582941 1053790283 /nfs/dbraw/zinc/79/02/83/1053790283.db2.gz DLBVMMITWIBCTK-CYBMUJFWSA-N 1 2 316.470 4.224 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1nc2c(s1)CCCC2 ZINC001231582941 1053790294 /nfs/dbraw/zinc/79/02/94/1053790294.db2.gz DLBVMMITWIBCTK-CYBMUJFWSA-N 1 2 316.470 4.224 20 0 DIADLO c1cn(-c2ccc(NCc3cnc(C4CCC4)s3)cc2)c[nH+]1 ZINC000155936792 1053791806 /nfs/dbraw/zinc/79/18/06/1053791806.db2.gz LNUSQZKGBCQGEX-UHFFFAOYSA-N 1 2 310.426 4.208 20 0 DIADLO Clc1cc(Cl)c(Cl)c(C[N@@H+]2CC[C@]3(CCCO3)C2)c1 ZINC001231597894 1053796082 /nfs/dbraw/zinc/79/60/82/1053796082.db2.gz JNAREHCKWUBEFM-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1cc(Cl)c(Cl)c(C[N@H+]2CC[C@]3(CCCO3)C2)c1 ZINC001231597894 1053796095 /nfs/dbraw/zinc/79/60/95/1053796095.db2.gz JNAREHCKWUBEFM-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)cs1 ZINC000620934083 1053798133 /nfs/dbraw/zinc/79/81/33/1053798133.db2.gz DCSFBCATEQDSLB-MRXNPFEDSA-N 1 2 316.470 4.483 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)cs1 ZINC000620934083 1053798145 /nfs/dbraw/zinc/79/81/45/1053798145.db2.gz DCSFBCATEQDSLB-MRXNPFEDSA-N 1 2 316.470 4.483 20 0 DIADLO c1ccc2c(c1)CC[C@@H]2[N@H+](Cc1nc(C2CCCC2)no1)C1CC1 ZINC000156177729 1053799002 /nfs/dbraw/zinc/79/90/02/1053799002.db2.gz WIBOPHBZXWQGAG-SFHVURJKSA-N 1 2 323.440 4.379 20 0 DIADLO c1ccc2c(c1)CC[C@@H]2[N@@H+](Cc1nc(C2CCCC2)no1)C1CC1 ZINC000156177729 1053799016 /nfs/dbraw/zinc/79/90/16/1053799016.db2.gz WIBOPHBZXWQGAG-SFHVURJKSA-N 1 2 323.440 4.379 20 0 DIADLO C[C@H](CC(=O)Nc1cccc(-c2ccccc2)c1)n1cc[nH+]c1 ZINC001436165326 1053799535 /nfs/dbraw/zinc/79/95/35/1053799535.db2.gz MONVWEKCYGQKPS-OAHLLOKOSA-N 1 2 305.381 4.140 20 0 DIADLO COc1cc(F)ccc1C[N@@H+]1CCc2cccc(Cl)c2C1 ZINC001231604968 1053800508 /nfs/dbraw/zinc/80/05/08/1053800508.db2.gz IBAPXUKKGXDVPM-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(F)ccc1C[N@H+]1CCc2cccc(Cl)c2C1 ZINC001231604968 1053800515 /nfs/dbraw/zinc/80/05/15/1053800515.db2.gz IBAPXUKKGXDVPM-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO OCC[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)C1 ZINC001231605443 1053800894 /nfs/dbraw/zinc/80/08/94/1053800894.db2.gz ZRFLUZAJQNAGLJ-JTQLQIEISA-N 1 2 322.663 4.241 20 0 DIADLO OCC[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)C1 ZINC001231605443 1053800905 /nfs/dbraw/zinc/80/09/05/1053800905.db2.gz ZRFLUZAJQNAGLJ-JTQLQIEISA-N 1 2 322.663 4.241 20 0 DIADLO CC(C)(CF)[NH2+]Cc1oc2ccccc2c1Br ZINC001326796383 1053805400 /nfs/dbraw/zinc/80/54/00/1053805400.db2.gz VCVQHFZTLMLKRQ-UHFFFAOYSA-N 1 2 300.171 4.033 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2Br)nc1 ZINC000156394384 1053806730 /nfs/dbraw/zinc/80/67/30/1053806730.db2.gz XQLDUOMDRRQYHT-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)c2ccccc2Br)nc1 ZINC000156394384 1053806745 /nfs/dbraw/zinc/80/67/45/1053806745.db2.gz XQLDUOMDRRQYHT-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2coc(-c3ccccc3)n2)cn1 ZINC001231632374 1053808279 /nfs/dbraw/zinc/80/82/79/1053808279.db2.gz PGERBVIJIOPAPV-LJQANCHMSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2coc(-c3ccccc3)n2)cn1 ZINC001231632374 1053808298 /nfs/dbraw/zinc/80/82/98/1053808298.db2.gz PGERBVIJIOPAPV-LJQANCHMSA-N 1 2 319.408 4.382 20 0 DIADLO COc1cc(C)c(C[N@@H+]2Cc3cnc(C)cc3C2)cc1C(C)C ZINC001231628663 1053809431 /nfs/dbraw/zinc/80/94/31/1053809431.db2.gz GBZLBUSXKNXMIX-UHFFFAOYSA-N 1 2 310.441 4.346 20 0 DIADLO COc1cc(C)c(C[N@H+]2Cc3cnc(C)cc3C2)cc1C(C)C ZINC001231628663 1053809442 /nfs/dbraw/zinc/80/94/42/1053809442.db2.gz GBZLBUSXKNXMIX-UHFFFAOYSA-N 1 2 310.441 4.346 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)cn1 ZINC001231657027 1053823380 /nfs/dbraw/zinc/82/33/80/1053823380.db2.gz VOJABVPXRYFESD-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)cn1 ZINC001231657027 1053823395 /nfs/dbraw/zinc/82/33/95/1053823395.db2.gz VOJABVPXRYFESD-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccccc2)cs1)Cc1cccnc1 ZINC001231684086 1053832583 /nfs/dbraw/zinc/83/25/83/1053832583.db2.gz LQDLCBPKASGBRV-UHFFFAOYSA-N 1 2 309.438 4.227 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccccc2)cs1)Cc1cccnc1 ZINC001231684086 1053832600 /nfs/dbraw/zinc/83/26/00/1053832600.db2.gz LQDLCBPKASGBRV-UHFFFAOYSA-N 1 2 309.438 4.227 20 0 DIADLO COCc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)o1 ZINC001231692979 1053833826 /nfs/dbraw/zinc/83/38/26/1053833826.db2.gz UGGNYXKQPUYTCT-QGZVFWFLSA-N 1 2 307.340 4.041 20 0 DIADLO COCc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)o1 ZINC001231692979 1053833838 /nfs/dbraw/zinc/83/38/38/1053833838.db2.gz UGGNYXKQPUYTCT-QGZVFWFLSA-N 1 2 307.340 4.041 20 0 DIADLO c1ccc([C@H]([NH2+]Cc2nc(C3CCCC3)no2)C2CCC2)cc1 ZINC000157149770 1053842169 /nfs/dbraw/zinc/84/21/69/1053842169.db2.gz JHSKUTIJGGBOMI-SFHVURJKSA-N 1 2 311.429 4.358 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)c(O)c2)cn1 ZINC001231734492 1053842007 /nfs/dbraw/zinc/84/20/07/1053842007.db2.gz AGFXFKROKXYLAM-INIZCTEOSA-N 1 2 302.805 4.086 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)c(O)c2)cn1 ZINC001231734492 1053842020 /nfs/dbraw/zinc/84/20/20/1053842020.db2.gz AGFXFKROKXYLAM-INIZCTEOSA-N 1 2 302.805 4.086 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H]2C[C@H](C)Sc3sccc32)s1 ZINC000274140704 1053859451 /nfs/dbraw/zinc/85/94/51/1053859451.db2.gz DCKVWYGELASDKH-VAOFZXAKSA-N 1 2 311.501 4.184 20 0 DIADLO COc1cccc2cc([C@@H](C)[NH2+][C@H](C)c3nnc(C)s3)oc21 ZINC000274288654 1053862766 /nfs/dbraw/zinc/86/27/66/1053862766.db2.gz ZYIZEWBGEHZFMD-NXEZZACHSA-N 1 2 317.414 4.013 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1coc(C(C)(C)C)n1 ZINC001354498608 1053886116 /nfs/dbraw/zinc/88/61/16/1053886116.db2.gz HQPPIFHWVSVMDH-GHMZBOCLSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1coc(C(C)(C)C)n1 ZINC001354498608 1053886131 /nfs/dbraw/zinc/88/61/31/1053886131.db2.gz HQPPIFHWVSVMDH-GHMZBOCLSA-N 1 2 304.356 4.135 20 0 DIADLO Cn1cc(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccco2)c(C(F)F)n1 ZINC001327897764 1053892550 /nfs/dbraw/zinc/89/25/50/1053892550.db2.gz MWJUWVXZKGRLDX-HNNXBMFYSA-N 1 2 321.371 4.068 20 0 DIADLO Cn1cc(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccco2)c(C(F)F)n1 ZINC001327897764 1053892563 /nfs/dbraw/zinc/89/25/63/1053892563.db2.gz MWJUWVXZKGRLDX-HNNXBMFYSA-N 1 2 321.371 4.068 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1cnc2ccccn12 ZINC000158241789 1053895451 /nfs/dbraw/zinc/89/54/51/1053895451.db2.gz ICDUIKYXNUCIAJ-ZDUSSCGKSA-N 1 2 322.437 4.137 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cnc2ccccn12 ZINC000158241789 1053895466 /nfs/dbraw/zinc/89/54/66/1053895466.db2.gz ICDUIKYXNUCIAJ-ZDUSSCGKSA-N 1 2 322.437 4.137 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)/C(F)=C/C1CCCCC1 ZINC001354542964 1053901893 /nfs/dbraw/zinc/90/18/93/1053901893.db2.gz VVDYQWFLXZUZFP-BOPFTXTBSA-N 1 2 313.376 4.245 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)cnc1F ZINC001231923140 1053914333 /nfs/dbraw/zinc/91/43/33/1053914333.db2.gz KCWDKXHBPRZINA-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)cnc1F ZINC001231923140 1053914345 /nfs/dbraw/zinc/91/43/45/1053914345.db2.gz KCWDKXHBPRZINA-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO CC(C)c1ccc2occ(C(=O)Nc3ccn4cc[nH+]c4c3)c2c1 ZINC001436599042 1053916351 /nfs/dbraw/zinc/91/63/51/1053916351.db2.gz QQIANCPWBFTDBH-UHFFFAOYSA-N 1 2 319.364 4.456 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2ccc3ccnc(Cl)c3c2)C[C@@H]1F ZINC001231976356 1053927031 /nfs/dbraw/zinc/92/70/31/1053927031.db2.gz OERDHBRFWALRKT-GOEBONIOSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2ccc3ccnc(Cl)c3c2)C[C@@H]1F ZINC001231976356 1053927042 /nfs/dbraw/zinc/92/70/42/1053927042.db2.gz OERDHBRFWALRKT-GOEBONIOSA-N 1 2 310.775 4.160 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001231983377 1053929248 /nfs/dbraw/zinc/92/92/48/1053929248.db2.gz WBAJXTSBZACOCG-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(F)ncc1C[N@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001231983377 1053929262 /nfs/dbraw/zinc/92/92/62/1053929262.db2.gz WBAJXTSBZACOCG-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)cc(C)n1 ZINC001232000347 1053931970 /nfs/dbraw/zinc/93/19/70/1053931970.db2.gz JAXATPFBUGDJNB-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)cc(C)n1 ZINC001232000347 1053931991 /nfs/dbraw/zinc/93/19/91/1053931991.db2.gz JAXATPFBUGDJNB-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(C(F)(F)F)cnc2Cl)[C@H](C)C1 ZINC001232009938 1053939866 /nfs/dbraw/zinc/93/98/66/1053939866.db2.gz WMTREAUSQKVHDF-NXEZZACHSA-N 1 2 306.759 4.374 20 0 DIADLO Fc1ncc(Cl)cc1C[NH+]1CCC(c2cccs2)CC1 ZINC001231991726 1053932577 /nfs/dbraw/zinc/93/25/77/1053932577.db2.gz FFKCPKXBPYPDEM-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(C(F)(F)F)cnc2Cl)[C@H](C)C1 ZINC001232009938 1053939874 /nfs/dbraw/zinc/93/98/74/1053939874.db2.gz WMTREAUSQKVHDF-NXEZZACHSA-N 1 2 306.759 4.374 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cc(Cl)cnc1F ZINC001231999303 1053933099 /nfs/dbraw/zinc/93/30/99/1053933099.db2.gz YXCITKQUMDYPOW-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(Cl)cnc1F ZINC001231999303 1053933113 /nfs/dbraw/zinc/93/31/13/1053933113.db2.gz YXCITKQUMDYPOW-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO Clc1cncc(C[N@@H+]2CC[C@@H](Oc3ccccc3Cl)C2)c1 ZINC000621269048 1053936894 /nfs/dbraw/zinc/93/68/94/1053936894.db2.gz HUAQHLXLGQLRLP-CQSZACIVSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cncc(C[N@H+]2CC[C@@H](Oc3ccccc3Cl)C2)c1 ZINC000621269048 1053936906 /nfs/dbraw/zinc/93/69/06/1053936906.db2.gz HUAQHLXLGQLRLP-CQSZACIVSA-N 1 2 323.223 4.042 20 0 DIADLO C[C@@H]([NH2+]Cc1cncc(Cl)c1)c1nc(C(F)(F)F)cs1 ZINC000621288336 1053941409 /nfs/dbraw/zinc/94/14/09/1053941409.db2.gz URCMGJMOKDUXLU-SSDOTTSWSA-N 1 2 321.755 4.061 20 0 DIADLO COc1cccc2c(N[C@@H]3CC[C@H]4[C@@H](C3)C4(F)F)cc[nH+]c12 ZINC001328572808 1053941630 /nfs/dbraw/zinc/94/16/30/1053941630.db2.gz MOTUUSOBUTWTRA-KGYLQXTDSA-N 1 2 304.340 4.089 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@H](C)c2nc3cc(Cl)ccc3[nH]2)ccn1 ZINC000621299997 1053945242 /nfs/dbraw/zinc/94/52/42/1053945242.db2.gz YLUVTGSQQZROHS-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1cc(C[N@H+](C)[C@H](C)c2nc3cc(Cl)ccc3[nH]2)ccn1 ZINC000621299997 1053945253 /nfs/dbraw/zinc/94/52/53/1053945253.db2.gz YLUVTGSQQZROHS-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO CC1(C)CC[NH+](Cc2nc(Cl)ccc2Br)CC1 ZINC001232061461 1053950600 /nfs/dbraw/zinc/95/06/00/1053950600.db2.gz YVXHYXBWIZICDL-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CCC[N@@H+]1Cc1cc2ncccc2[nH]1 ZINC001232069345 1053950725 /nfs/dbraw/zinc/95/07/25/1053950725.db2.gz ZFRSMKGVUIWVGR-KRWDZBQOSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CCC[N@H+]1Cc1cc2ncccc2[nH]1 ZINC001232069345 1053950739 /nfs/dbraw/zinc/95/07/39/1053950739.db2.gz ZFRSMKGVUIWVGR-KRWDZBQOSA-N 1 2 313.351 4.178 20 0 DIADLO CC1(C)CCCC[C@H]1CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001354722196 1053951898 /nfs/dbraw/zinc/95/18/98/1053951898.db2.gz OEONFEAMCOFPBW-HNNXBMFYSA-N 1 2 311.429 4.417 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cncc(Cl)c2)cc1F ZINC000621316186 1053956698 /nfs/dbraw/zinc/95/66/98/1053956698.db2.gz HNWKLXDGODKDNE-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cncc(Cl)c2)cc1F ZINC000621316186 1053956706 /nfs/dbraw/zinc/95/67/06/1053956706.db2.gz HNWKLXDGODKDNE-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C3(C(C)(F)F)CC3)c2)[nH+]c1C ZINC001328881543 1053958741 /nfs/dbraw/zinc/95/87/41/1053958741.db2.gz KSOUVBMTABFNLG-UHFFFAOYSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1cc(C)c(CNC(=O)C[C@H]2C[C@H](C)c3c2cccc3C)c[nH+]1 ZINC001436735458 1053958848 /nfs/dbraw/zinc/95/88/48/1053958848.db2.gz FEFAXYZHMVZWEG-DOTOQJQBSA-N 1 2 322.452 4.304 20 0 DIADLO CC1(C)C[N@H+](Cc2c(F)cc(F)cc2Cl)CCC1(F)F ZINC001232098541 1053961816 /nfs/dbraw/zinc/96/18/16/1053961816.db2.gz ZPQSOYJMSYCZHM-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(F)cc(F)cc2Cl)CCC1(F)F ZINC001232098541 1053961826 /nfs/dbraw/zinc/96/18/26/1053961826.db2.gz ZPQSOYJMSYCZHM-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO COc1ccnc(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001232152791 1053973132 /nfs/dbraw/zinc/97/31/32/1053973132.db2.gz UDHNDHUTTCQNDE-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccnc(Cl)c1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001232152791 1053973136 /nfs/dbraw/zinc/97/31/36/1053973136.db2.gz UDHNDHUTTCQNDE-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccnc(Cl)c1C[N@@H+]1CCC[C@H]1c1cccs1 ZINC001232153297 1053975926 /nfs/dbraw/zinc/97/59/26/1053975926.db2.gz LKDWHYGSTVBMHR-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccnc(Cl)c1C[N@H+]1CCC[C@H]1c1cccs1 ZINC001232153297 1053975944 /nfs/dbraw/zinc/97/59/44/1053975944.db2.gz LKDWHYGSTVBMHR-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO CC[C@@H](c1ccccc1)[N@H+](C)Cc1c(Cl)nccc1OC ZINC001232154117 1053976086 /nfs/dbraw/zinc/97/60/86/1053976086.db2.gz ICRWQGDNNSZVOP-HNNXBMFYSA-N 1 2 304.821 4.327 20 0 DIADLO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1c(Cl)nccc1OC ZINC001232154117 1053976101 /nfs/dbraw/zinc/97/61/01/1053976101.db2.gz ICRWQGDNNSZVOP-HNNXBMFYSA-N 1 2 304.821 4.327 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2nc(Cl)ccc2F)cc1 ZINC001232159161 1053976502 /nfs/dbraw/zinc/97/65/02/1053976502.db2.gz PZVHZTXMAKGLQP-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2nc(Cl)ccc2F)cc1 ZINC001232159161 1053976516 /nfs/dbraw/zinc/97/65/16/1053976516.db2.gz PZVHZTXMAKGLQP-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC(=O)Nc1ccc(C[N@@H+]2Cc3ccc(Cl)cc3C2)c(C)c1 ZINC001232187290 1053983385 /nfs/dbraw/zinc/98/33/85/1053983385.db2.gz HOSHEYARQWBPNR-UHFFFAOYSA-N 1 2 314.816 4.123 20 0 DIADLO CC(=O)Nc1ccc(C[N@H+]2Cc3ccc(Cl)cc3C2)c(C)c1 ZINC001232187290 1053983394 /nfs/dbraw/zinc/98/33/94/1053983394.db2.gz HOSHEYARQWBPNR-UHFFFAOYSA-N 1 2 314.816 4.123 20 0 DIADLO C[N@H+](Cc1nc2ccccc2o1)Cc1ccnc(C(C)(C)C)c1 ZINC001232217595 1053992817 /nfs/dbraw/zinc/99/28/17/1053992817.db2.gz MQVGXKCMSGWEOB-UHFFFAOYSA-N 1 2 309.413 4.152 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2o1)Cc1ccnc(C(C)(C)C)c1 ZINC001232217595 1053992827 /nfs/dbraw/zinc/99/28/27/1053992827.db2.gz MQVGXKCMSGWEOB-UHFFFAOYSA-N 1 2 309.413 4.152 20 0 DIADLO c1csc(C[N@H+](Cc2nc(-c3ccccc3)c[nH]2)C2CC2)c1 ZINC001329513126 1053993707 /nfs/dbraw/zinc/99/37/07/1053993707.db2.gz VHRUIOUTVURHHN-UHFFFAOYSA-N 1 2 309.438 4.303 20 0 DIADLO c1csc(C[N@@H+](Cc2nc(-c3ccccc3)c[nH]2)C2CC2)c1 ZINC001329513126 1053993720 /nfs/dbraw/zinc/99/37/20/1053993720.db2.gz VHRUIOUTVURHHN-UHFFFAOYSA-N 1 2 309.438 4.303 20 0 DIADLO Cc1nccnc1C[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000621711066 1053996834 /nfs/dbraw/zinc/99/68/34/1053996834.db2.gz CUHFLLPFMFVLIT-CYBMUJFWSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1nccnc1C[N@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000621711066 1053996841 /nfs/dbraw/zinc/99/68/41/1053996841.db2.gz CUHFLLPFMFVLIT-CYBMUJFWSA-N 1 2 301.821 4.164 20 0 DIADLO O=C(/C=C/c1ccc(Cl)cc1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000072058324 1053998903 /nfs/dbraw/zinc/99/89/03/1053998903.db2.gz KCFPCZKMDQHFNG-XCVCLJGOSA-N 1 2 323.783 4.382 20 0 DIADLO COc1cc(C[N@H+](Cc2ccco2)C2CC2)c(OC)cc1Cl ZINC001232375369 1054034052 /nfs/dbraw/zinc/03/40/52/1054034052.db2.gz JDFFNYGEURNXJL-UHFFFAOYSA-N 1 2 321.804 4.115 20 0 DIADLO COc1cc(C[N@@H+](Cc2ccco2)C2CC2)c(OC)cc1Cl ZINC001232375369 1054034059 /nfs/dbraw/zinc/03/40/59/1054034059.db2.gz JDFFNYGEURNXJL-UHFFFAOYSA-N 1 2 321.804 4.115 20 0 DIADLO Cc1ccc(OCc2ccccc2)c(C[N@H+](C)Cc2ccno2)c1 ZINC001232377381 1054034835 /nfs/dbraw/zinc/03/48/35/1054034835.db2.gz YZFWJZRXLKUNJC-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1ccc(OCc2ccccc2)c(C[N@@H+](C)Cc2ccno2)c1 ZINC001232377381 1054034845 /nfs/dbraw/zinc/03/48/45/1054034845.db2.gz YZFWJZRXLKUNJC-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cccc(C)c2OC(C)C)no1 ZINC001232388936 1054037124 /nfs/dbraw/zinc/03/71/24/1054037124.db2.gz CBJHIAIHVDHLDQ-SFHVURJKSA-N 1 2 314.429 4.416 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cccc(C)c2OC(C)C)no1 ZINC001232388936 1054037138 /nfs/dbraw/zinc/03/71/38/1054037138.db2.gz CBJHIAIHVDHLDQ-SFHVURJKSA-N 1 2 314.429 4.416 20 0 DIADLO COc1ccc(OC(C)C)c(C[N@H+](C)Cc2ccccc2F)c1 ZINC001232393401 1054038000 /nfs/dbraw/zinc/03/80/00/1054038000.db2.gz YGVOVXIKVNYJER-UHFFFAOYSA-N 1 2 317.404 4.254 20 0 DIADLO COc1ccc(OC(C)C)c(C[N@@H+](C)Cc2ccccc2F)c1 ZINC001232393401 1054038013 /nfs/dbraw/zinc/03/80/13/1054038013.db2.gz YGVOVXIKVNYJER-UHFFFAOYSA-N 1 2 317.404 4.254 20 0 DIADLO Cc1ccc(OC(C)C)c(C[N@@H+]2CCCC(F)(F)[C@@H](F)C2)c1 ZINC001232395945 1054038905 /nfs/dbraw/zinc/03/89/05/1054038905.db2.gz QSTZODCIKRLDPY-INIZCTEOSA-N 1 2 315.379 4.351 20 0 DIADLO Cc1ccc(OC(C)C)c(C[N@H+]2CCCC(F)(F)[C@@H](F)C2)c1 ZINC001232395945 1054038910 /nfs/dbraw/zinc/03/89/10/1054038910.db2.gz QSTZODCIKRLDPY-INIZCTEOSA-N 1 2 315.379 4.351 20 0 DIADLO C[C@H]([NH2+]Cc1nc(Cl)cs1)c1ccc(Cl)c(F)c1 ZINC001330608252 1054042383 /nfs/dbraw/zinc/04/23/83/1054042383.db2.gz NDBJHZASLOKECF-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(Cl)cs1)c1ccc(Cl)c(F)c1 ZINC001330608243 1054043133 /nfs/dbraw/zinc/04/31/33/1054043133.db2.gz NDBJHZASLOKECF-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2F)[N@H+](Cc2nc3ccccc3[nH]2)C1 ZINC001330855513 1054054962 /nfs/dbraw/zinc/05/49/62/1054054962.db2.gz JDCNEYCGUMLRLC-FZKQIMNGSA-N 1 2 309.388 4.285 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2nc3ccccc3[nH]2)C1 ZINC001330855513 1054054977 /nfs/dbraw/zinc/05/49/77/1054054977.db2.gz JDCNEYCGUMLRLC-FZKQIMNGSA-N 1 2 309.388 4.285 20 0 DIADLO Cc1cccc(F)c1C[N@H+](C)Cc1ncccc1C(F)(F)F ZINC001232490276 1054055666 /nfs/dbraw/zinc/05/56/66/1054055666.db2.gz PQLSEMHBSPVUKB-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1cccc(F)c1C[N@@H+](C)Cc1ncccc1C(F)(F)F ZINC001232490276 1054055686 /nfs/dbraw/zinc/05/56/86/1054055686.db2.gz PQLSEMHBSPVUKB-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1cccnc1C[NH2+]C(C)(C)c1nc2cc(Cl)ccc2o1 ZINC001331082634 1054059830 /nfs/dbraw/zinc/05/98/30/1054059830.db2.gz DXBYMKOEJZWKQD-UHFFFAOYSA-N 1 2 315.804 4.210 20 0 DIADLO C[N@H+](Cc1cc(F)ccc1N)Cc1cccc(Cl)c1Cl ZINC001232511177 1054060443 /nfs/dbraw/zinc/06/04/43/1054060443.db2.gz WWXBQZPSNLSWBC-UHFFFAOYSA-N 1 2 313.203 4.347 20 0 DIADLO C[N@@H+](Cc1cc(F)ccc1N)Cc1cccc(Cl)c1Cl ZINC001232511177 1054060448 /nfs/dbraw/zinc/06/04/48/1054060448.db2.gz WWXBQZPSNLSWBC-UHFFFAOYSA-N 1 2 313.203 4.347 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+](C)Cc1cccc(F)c1F ZINC001232501763 1054060605 /nfs/dbraw/zinc/06/06/05/1054060605.db2.gz DMZHROPQQUETID-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+](C)Cc1cccc(F)c1F ZINC001232501763 1054060619 /nfs/dbraw/zinc/06/06/19/1054060619.db2.gz DMZHROPQQUETID-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+]1CCC(=O)[C@H](C)C12CCCC2 ZINC001232500988 1054061480 /nfs/dbraw/zinc/06/14/80/1054061480.db2.gz UJSBICONGTYIBV-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+]1CCC(=O)[C@H](C)C12CCCC2 ZINC001232500988 1054061490 /nfs/dbraw/zinc/06/14/90/1054061490.db2.gz UJSBICONGTYIBV-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO CC(C)Cn1ccnc1C[NH2+][C@H](C)c1ccc(F)cc1Cl ZINC000164781112 1054063878 /nfs/dbraw/zinc/06/38/78/1054063878.db2.gz DKGLRPPSLBKGHR-GFCCVEGCSA-N 1 2 309.816 4.182 20 0 DIADLO Fc1cccc(F)c1[C@H]1CCC[N@@H+]1Cc1cc2ccoc2cn1 ZINC001232556649 1054069123 /nfs/dbraw/zinc/06/91/23/1054069123.db2.gz KMROMDREDFQAGP-MRXNPFEDSA-N 1 2 314.335 4.443 20 0 DIADLO Fc1cccc(F)c1[C@H]1CCC[N@H+]1Cc1cc2ccoc2cn1 ZINC001232556649 1054069133 /nfs/dbraw/zinc/06/91/33/1054069133.db2.gz KMROMDREDFQAGP-MRXNPFEDSA-N 1 2 314.335 4.443 20 0 DIADLO CCCC[C@H](C)C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001355164392 1054070580 /nfs/dbraw/zinc/07/05/80/1054070580.db2.gz XFWOLKSAZGZDEE-JKSUJKDBSA-N 1 2 319.493 4.170 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ncc(Cl)cc2Cl)CCC1(F)F ZINC001232571586 1054072468 /nfs/dbraw/zinc/07/24/68/1054072468.db2.gz UWBAUDGWJOBBKL-VIFPVBQESA-N 1 2 309.187 4.256 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ncc(Cl)cc2Cl)CCC1(F)F ZINC001232571586 1054072482 /nfs/dbraw/zinc/07/24/82/1054072482.db2.gz UWBAUDGWJOBBKL-VIFPVBQESA-N 1 2 309.187 4.256 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2cc(C)ccc2OC)o1 ZINC000165252972 1054073509 /nfs/dbraw/zinc/07/35/09/1054073509.db2.gz HODBNSMCYKIUAQ-WMLDXEAASA-N 1 2 317.429 4.197 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2ccc(F)cc2F)o1 ZINC000165233929 1054073983 /nfs/dbraw/zinc/07/39/83/1054073983.db2.gz CYWFFXSLYLTLNY-BDJLRTHQSA-N 1 2 309.356 4.159 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2cc(C)ccc2OC)o1 ZINC000165253317 1054074197 /nfs/dbraw/zinc/07/41/97/1054074197.db2.gz HODBNSMCYKIUAQ-PBHICJAKSA-N 1 2 317.429 4.197 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2cc(C)c(F)c(C)c2)cs1 ZINC000165281527 1054074494 /nfs/dbraw/zinc/07/44/94/1054074494.db2.gz FYWYNGHUGCCSJB-OLZOCXBDSA-N 1 2 322.449 4.457 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1cc(F)c(O)c(Br)c1 ZINC001232630190 1054088244 /nfs/dbraw/zinc/08/82/44/1054088244.db2.gz LOCOHEJBRZRPHC-UWVGGRQHSA-N 1 2 316.214 4.057 20 0 DIADLO c1cc2ccc(C[N@@H+]3CCc4nc(C5CC5)ncc4C3)cc2s1 ZINC001232613732 1054083475 /nfs/dbraw/zinc/08/34/75/1054083475.db2.gz AZYNUAHHCJYROG-UHFFFAOYSA-N 1 2 321.449 4.127 20 0 DIADLO c1cc2ccc(C[N@H+]3CCc4nc(C5CC5)ncc4C3)cc2s1 ZINC001232613732 1054083479 /nfs/dbraw/zinc/08/34/79/1054083479.db2.gz AZYNUAHHCJYROG-UHFFFAOYSA-N 1 2 321.449 4.127 20 0 DIADLO C[N@H+](CCc1ccccc1Cl)Cc1c(Cl)ccnc1F ZINC001232617179 1054085524 /nfs/dbraw/zinc/08/55/24/1054085524.db2.gz CQHCHODZKBPOPH-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1ccccc1Cl)Cc1c(Cl)ccnc1F ZINC001232617179 1054085540 /nfs/dbraw/zinc/08/55/40/1054085540.db2.gz CQHCHODZKBPOPH-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001331675839 1054086330 /nfs/dbraw/zinc/08/63/30/1054086330.db2.gz LEBWYUNFYFNWSV-JSGCOSHPSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001331675839 1054086343 /nfs/dbraw/zinc/08/63/43/1054086343.db2.gz LEBWYUNFYFNWSV-JSGCOSHPSA-N 1 2 323.362 4.240 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1c(Cl)ccnc1F ZINC001232618823 1054086494 /nfs/dbraw/zinc/08/64/94/1054086494.db2.gz GPJDTCTTYBADAE-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1c(Cl)ccnc1F ZINC001232618823 1054086504 /nfs/dbraw/zinc/08/65/04/1054086504.db2.gz GPJDTCTTYBADAE-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(O)c(Br)c1 ZINC001232633105 1054091542 /nfs/dbraw/zinc/09/15/42/1054091542.db2.gz DYCBEUMVDZVHIE-LLVKDONJSA-N 1 2 316.214 4.058 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1cc(F)c(O)c(Br)c1 ZINC001232633105 1054091556 /nfs/dbraw/zinc/09/15/56/1054091556.db2.gz DYCBEUMVDZVHIE-LLVKDONJSA-N 1 2 316.214 4.058 20 0 DIADLO Cc1cccc([C@H](NC(=O)c2cccc3[nH+]ccn32)C(C)(C)C)c1 ZINC001355237857 1054092266 /nfs/dbraw/zinc/09/22/66/1054092266.db2.gz BIRONTNRRMBAGJ-SFHVURJKSA-N 1 2 321.424 4.160 20 0 DIADLO CNc1ccccc1C[N@H+](C)Cc1ccccc1Br ZINC001232666046 1054094781 /nfs/dbraw/zinc/09/47/81/1054094781.db2.gz GMMMSZXOMZTSIK-UHFFFAOYSA-N 1 2 319.246 4.123 20 0 DIADLO CNc1ccccc1C[N@@H+](C)Cc1ccccc1Br ZINC001232666046 1054094792 /nfs/dbraw/zinc/09/47/92/1054094792.db2.gz GMMMSZXOMZTSIK-UHFFFAOYSA-N 1 2 319.246 4.123 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(Br)[nH]2)c1 ZINC001232688346 1054101054 /nfs/dbraw/zinc/10/10/54/1054101054.db2.gz RDMVVMANQXKALC-AWEZNQCLSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(Br)[nH]2)c1 ZINC001232688346 1054101058 /nfs/dbraw/zinc/10/10/58/1054101058.db2.gz RDMVVMANQXKALC-AWEZNQCLSA-N 1 2 323.209 4.253 20 0 DIADLO COC[C@H]1CCCC[N@@H+]1Cc1cc(F)c(Cl)cc1Cl ZINC001232698219 1054101150 /nfs/dbraw/zinc/10/11/50/1054101150.db2.gz KAPRMRABFUGAHY-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO COC[C@H]1CCCC[N@H+]1Cc1cc(F)c(Cl)cc1Cl ZINC001232698219 1054101158 /nfs/dbraw/zinc/10/11/58/1054101158.db2.gz KAPRMRABFUGAHY-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO O=C1CC[N@@H+](Cc2cc3ccc(Cl)cc3[nH]2)[C@H]2CCCC[C@@H]12 ZINC001232726726 1054107641 /nfs/dbraw/zinc/10/76/41/1054107641.db2.gz JOENYJCSFCBINC-WBVHZDCISA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2cc3ccc(Cl)cc3[nH]2)[C@H]2CCCC[C@@H]12 ZINC001232726726 1054107648 /nfs/dbraw/zinc/10/76/48/1054107648.db2.gz JOENYJCSFCBINC-WBVHZDCISA-N 1 2 316.832 4.155 20 0 DIADLO COc1ccccc1C1([NH2+][C@H]2CCCc3oc(C)nc32)CCC1 ZINC001332402681 1054117124 /nfs/dbraw/zinc/11/71/24/1054117124.db2.gz QYTOGVBQDOKOOW-HNNXBMFYSA-N 1 2 312.413 4.038 20 0 DIADLO Cc1ccc(N[C@@H](C)c2nc(Br)ccc2F)c(C)[nH+]1 ZINC001332401623 1054117368 /nfs/dbraw/zinc/11/73/68/1054117368.db2.gz MOVGANLPODZWPC-JTQLQIEISA-N 1 2 324.197 4.168 20 0 DIADLO Cc1cc(C)nc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC001332853582 1054129318 /nfs/dbraw/zinc/12/93/18/1054129318.db2.gz LUSYFETXNYBVRX-ZDUSSCGKSA-N 1 2 303.475 4.303 20 0 DIADLO CO[C@H]1CCC[N@H+](Cc2c(Cl)cc(Cl)nc2Cl)CC1 ZINC001232851776 1054130189 /nfs/dbraw/zinc/13/01/89/1054130189.db2.gz MUINBIXZYVHXRK-VIFPVBQESA-N 1 2 323.651 4.043 20 0 DIADLO CO[C@H]1CCC[N@@H+](Cc2c(Cl)cc(Cl)nc2Cl)CC1 ZINC001232851776 1054130201 /nfs/dbraw/zinc/13/02/01/1054130201.db2.gz MUINBIXZYVHXRK-VIFPVBQESA-N 1 2 323.651 4.043 20 0 DIADLO CC(C)c1nc(C[N@H+](C)Cc2c[nH]c3ccc(O)cc23)cs1 ZINC001232870907 1054134646 /nfs/dbraw/zinc/13/46/46/1054134646.db2.gz KUDVIEKBBMXMQA-UHFFFAOYSA-N 1 2 315.442 4.085 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)Cc2c[nH]c3ccc(O)cc23)cs1 ZINC001232870907 1054134656 /nfs/dbraw/zinc/13/46/56/1054134656.db2.gz KUDVIEKBBMXMQA-UHFFFAOYSA-N 1 2 315.442 4.085 20 0 DIADLO C[N@H+](CCC(=O)c1ccccc1)Cc1ccc(F)c(F)c1Cl ZINC001232877316 1054139054 /nfs/dbraw/zinc/13/90/54/1054139054.db2.gz GJQIVLXSHSJKBA-UHFFFAOYSA-N 1 2 323.770 4.323 20 0 DIADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1ccc(F)c(F)c1Cl ZINC001232877316 1054139070 /nfs/dbraw/zinc/13/90/70/1054139070.db2.gz GJQIVLXSHSJKBA-UHFFFAOYSA-N 1 2 323.770 4.323 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc(-c2cccc(F)c2)nc1 ZINC001232890551 1054142009 /nfs/dbraw/zinc/14/20/09/1054142009.db2.gz XEDJDTJHJHWODO-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccc(-c2cccc(F)c2)nc1 ZINC001232890551 1054142014 /nfs/dbraw/zinc/14/20/14/1054142014.db2.gz XEDJDTJHJHWODO-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO C[N@H+](Cc1ccc(F)c(O)c1F)Cc1cccc2ccccc21 ZINC001232935826 1054150227 /nfs/dbraw/zinc/15/02/27/1054150227.db2.gz NHPBJWKBSYOZFS-UHFFFAOYSA-N 1 2 313.347 4.456 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(F)c(O)c2F)c1 ZINC001232937972 1054152274 /nfs/dbraw/zinc/15/22/74/1054152274.db2.gz XLJPGRFAKWZJIV-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2ccc(F)c(O)c2F)c1 ZINC001232937972 1054152280 /nfs/dbraw/zinc/15/22/80/1054152280.db2.gz XLJPGRFAKWZJIV-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cc(Cl)cnc2Br)[C@H]1C ZINC001232961575 1054159508 /nfs/dbraw/zinc/15/95/08/1054159508.db2.gz PTMIZSUACNZBMY-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cc(Cl)cnc2Br)[C@H]1C ZINC001232961575 1054159517 /nfs/dbraw/zinc/15/95/17/1054159517.db2.gz PTMIZSUACNZBMY-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(Cl)cnc2Br)[C@@H](C)C1 ZINC001232961557 1054159700 /nfs/dbraw/zinc/15/97/00/1054159700.db2.gz PIFOKEYHHNUQNB-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(Cl)cnc2Br)[C@@H](C)C1 ZINC001232961557 1054159713 /nfs/dbraw/zinc/15/97/13/1054159713.db2.gz PIFOKEYHHNUQNB-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1C[C@H](C)O[C@@H](CC(F)(F)F)C1 ZINC001333741719 1054170127 /nfs/dbraw/zinc/17/01/27/1054170127.db2.gz TVSQGMSPEPWGQB-STQMWFEESA-N 1 2 324.346 4.089 20 0 DIADLO CCOC(=O)c1ccsc1C[N@H+](C)Cc1cccc(Cl)c1 ZINC001233018822 1054174866 /nfs/dbraw/zinc/17/48/66/1054174866.db2.gz BKLRGGLYAQMFTD-UHFFFAOYSA-N 1 2 323.845 4.210 20 0 DIADLO CCOC(=O)c1ccsc1C[N@@H+](C)Cc1cccc(Cl)c1 ZINC001233018822 1054174877 /nfs/dbraw/zinc/17/48/77/1054174877.db2.gz BKLRGGLYAQMFTD-UHFFFAOYSA-N 1 2 323.845 4.210 20 0 DIADLO Oc1cnc(Cl)cc1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001233035215 1054175186 /nfs/dbraw/zinc/17/51/86/1054175186.db2.gz ZUEHPFUKXNTYAM-AWEZNQCLSA-N 1 2 324.758 4.056 20 0 DIADLO Oc1cnc(Cl)cc1C[N@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001233035215 1054175193 /nfs/dbraw/zinc/17/51/93/1054175193.db2.gz ZUEHPFUKXNTYAM-AWEZNQCLSA-N 1 2 324.758 4.056 20 0 DIADLO CCOC(=O)c1ccsc1C[N@H+](CC)Cc1cccs1 ZINC001233021653 1054175407 /nfs/dbraw/zinc/17/54/07/1054175407.db2.gz NXRALUHLBBFIJM-UHFFFAOYSA-N 1 2 309.456 4.008 20 0 DIADLO CCOC(=O)c1ccsc1C[N@@H+](CC)Cc1cccs1 ZINC001233021653 1054175428 /nfs/dbraw/zinc/17/54/28/1054175428.db2.gz NXRALUHLBBFIJM-UHFFFAOYSA-N 1 2 309.456 4.008 20 0 DIADLO Oc1cnc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001233041094 1054177737 /nfs/dbraw/zinc/17/77/37/1054177737.db2.gz RJLPKTFGMXIURJ-CQSZACIVSA-N 1 2 324.758 4.056 20 0 DIADLO Oc1cnc(Cl)cc1C[N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001233041094 1054177738 /nfs/dbraw/zinc/17/77/38/1054177738.db2.gz RJLPKTFGMXIURJ-CQSZACIVSA-N 1 2 324.758 4.056 20 0 DIADLO CCOc1c(Cl)cc(C[N@@H+]2CCC[C@@H]3C[C@@H]32)cc1Cl ZINC001233106671 1054186250 /nfs/dbraw/zinc/18/62/50/1054186250.db2.gz GPPIGGRHENVPDT-RISCZKNCSA-N 1 2 300.229 4.376 20 0 DIADLO CCOc1c(Cl)cc(C[N@H+]2CCC[C@@H]3C[C@@H]32)cc1Cl ZINC001233106671 1054186254 /nfs/dbraw/zinc/18/62/54/1054186254.db2.gz GPPIGGRHENVPDT-RISCZKNCSA-N 1 2 300.229 4.376 20 0 DIADLO Fc1ccc2c(c1)[nH]nc2C[N@@H+]1CCC[C@H](c2ccccc2)C1 ZINC001233124325 1054188164 /nfs/dbraw/zinc/18/81/64/1054188164.db2.gz ILWPTWYAFLEICD-HNNXBMFYSA-N 1 2 309.388 4.082 20 0 DIADLO Fc1ccc2c(c1)[nH]nc2C[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC001233124325 1054188174 /nfs/dbraw/zinc/18/81/74/1054188174.db2.gz ILWPTWYAFLEICD-HNNXBMFYSA-N 1 2 309.388 4.082 20 0 DIADLO CCC[C@H]1CCCC[N@@H+]1Cc1nc(C)sc1Br ZINC001233155021 1054191590 /nfs/dbraw/zinc/19/15/90/1054191590.db2.gz VOKNWFQSKYECEG-NSHDSACASA-N 1 2 317.296 4.369 20 0 DIADLO CCC[C@H]1CCCC[N@H+]1Cc1nc(C)sc1Br ZINC001233155021 1054191592 /nfs/dbraw/zinc/19/15/92/1054191592.db2.gz VOKNWFQSKYECEG-NSHDSACASA-N 1 2 317.296 4.369 20 0 DIADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1cccc(Oc2ccc(F)cc2)c1 ZINC001233206822 1054200778 /nfs/dbraw/zinc/20/07/78/1054200778.db2.gz DLLKITWRAZBNQQ-CQSZACIVSA-N 1 2 313.372 4.171 20 0 DIADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1cccc(Oc2ccc(F)cc2)c1 ZINC001233206822 1054200793 /nfs/dbraw/zinc/20/07/93/1054200793.db2.gz DLLKITWRAZBNQQ-CQSZACIVSA-N 1 2 313.372 4.171 20 0 DIADLO C[N@H+](CCC(=O)c1ccccc1)Cc1ccc(Cl)c(F)c1F ZINC001233210146 1054201084 /nfs/dbraw/zinc/20/10/84/1054201084.db2.gz CSCAECKHVJNVEB-UHFFFAOYSA-N 1 2 323.770 4.323 20 0 DIADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1ccc(Cl)c(F)c1F ZINC001233210146 1054201096 /nfs/dbraw/zinc/20/10/96/1054201096.db2.gz CSCAECKHVJNVEB-UHFFFAOYSA-N 1 2 323.770 4.323 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1cc(Cl)ccc1C)CC2 ZINC001233250533 1054216299 /nfs/dbraw/zinc/21/62/99/1054216299.db2.gz OIWCIAPGHLYHLC-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1cc(Cl)ccc1C)CC2 ZINC001233250533 1054216312 /nfs/dbraw/zinc/21/63/12/1054216312.db2.gz OIWCIAPGHLYHLC-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO COc1c(O)cccc1C[N@@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001233257388 1054219428 /nfs/dbraw/zinc/21/94/28/1054219428.db2.gz FFMZHVIPSJFTPU-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO COc1c(O)cccc1C[N@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001233257388 1054219440 /nfs/dbraw/zinc/21/94/40/1054219440.db2.gz FFMZHVIPSJFTPU-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(Cl)o1 ZINC001233317284 1054227769 /nfs/dbraw/zinc/22/77/69/1054227769.db2.gz GFJCKFKCPCDZOR-HNNXBMFYSA-N 1 2 305.805 4.416 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(Cl)o1 ZINC001233317284 1054227777 /nfs/dbraw/zinc/22/77/77/1054227777.db2.gz GFJCKFKCPCDZOR-HNNXBMFYSA-N 1 2 305.805 4.416 20 0 DIADLO Cc1cnsc1C[N@@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001233320976 1054231098 /nfs/dbraw/zinc/23/10/98/1054231098.db2.gz VAPQUHQZKHKQAD-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1cnsc1C[N@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001233320976 1054231110 /nfs/dbraw/zinc/23/11/10/1054231110.db2.gz VAPQUHQZKHKQAD-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1cc(C)c(C(=O)NCC2(Cc3ccccc3)CCC2)c(C)[nH+]1 ZINC001355848416 1054232891 /nfs/dbraw/zinc/23/28/91/1054232891.db2.gz VHNLFWZWORXNQE-UHFFFAOYSA-N 1 2 322.452 4.150 20 0 DIADLO COc1cc(F)c(C[N@H+]2CC=C(c3ccccc3)CC2)cc1F ZINC001233343937 1054241503 /nfs/dbraw/zinc/24/15/03/1054241503.db2.gz GRLZYWFPNONQRE-UHFFFAOYSA-N 1 2 315.363 4.263 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CC=C(c3ccccc3)CC2)cc1F ZINC001233343937 1054241509 /nfs/dbraw/zinc/24/15/09/1054241509.db2.gz GRLZYWFPNONQRE-UHFFFAOYSA-N 1 2 315.363 4.263 20 0 DIADLO FC1(F)CC[C@H](C[N@@H+]2CCO[C@H](c3ccc(Cl)s3)C2)C1 ZINC001336756925 1054244222 /nfs/dbraw/zinc/24/42/22/1054244222.db2.gz NTVUXQFRDOGSJE-QWRGUYRKSA-N 1 2 321.820 4.210 20 0 DIADLO FC1(F)CC[C@H](C[N@H+]2CCO[C@H](c3ccc(Cl)s3)C2)C1 ZINC001336756925 1054244234 /nfs/dbraw/zinc/24/42/34/1054244234.db2.gz NTVUXQFRDOGSJE-QWRGUYRKSA-N 1 2 321.820 4.210 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1cnc2cccc(Cl)n12 ZINC001233355961 1054247778 /nfs/dbraw/zinc/24/77/78/1054247778.db2.gz UIYUXBRJLAXDSS-ZDUSSCGKSA-N 1 2 311.816 4.107 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cnc2cccc(Cl)n12 ZINC001233355961 1054247789 /nfs/dbraw/zinc/24/77/89/1054247789.db2.gz UIYUXBRJLAXDSS-ZDUSSCGKSA-N 1 2 311.816 4.107 20 0 DIADLO CC(C)N(Cc1cccc(N)[nH+]1)Cc1c(Cl)cccc1Cl ZINC001233372422 1054253768 /nfs/dbraw/zinc/25/37/68/1054253768.db2.gz NBISOIMOAQRYJM-UHFFFAOYSA-N 1 2 324.255 4.381 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CCCC[C@@H]2c2ccccc2)c1F ZINC001233393465 1054259276 /nfs/dbraw/zinc/25/92/76/1054259276.db2.gz WDMKNEDSDGJLEI-MRXNPFEDSA-N 1 2 303.352 4.398 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2ccc(OC)c(O)c2Cl)cc1 ZINC001233401383 1054263191 /nfs/dbraw/zinc/26/31/91/1054263191.db2.gz XPNAUGISGPUAJM-UHFFFAOYSA-N 1 2 319.832 4.249 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2ccc(OC)c(O)c2Cl)cc1 ZINC001233401383 1054263206 /nfs/dbraw/zinc/26/32/06/1054263206.db2.gz XPNAUGISGPUAJM-UHFFFAOYSA-N 1 2 319.832 4.249 20 0 DIADLO CC[N@H+](Cc1ccc(F)cc1)Cc1ccc(OC)c(O)c1Cl ZINC001233401283 1054263762 /nfs/dbraw/zinc/26/37/62/1054263762.db2.gz TXCVUEIFJFYDMD-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO CC[N@@H+](Cc1ccc(F)cc1)Cc1ccc(OC)c(O)c1Cl ZINC001233401283 1054263773 /nfs/dbraw/zinc/26/37/73/1054263773.db2.gz TXCVUEIFJFYDMD-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO CC[C@H]1CCC[N@H+](Cc2cc(Br)ncc2Cl)C1 ZINC001233428535 1054269931 /nfs/dbraw/zinc/26/99/31/1054269931.db2.gz QADIZLWMSFLZES-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@H]1CCC[N@@H+](Cc2cc(Br)ncc2Cl)C1 ZINC001233428535 1054269938 /nfs/dbraw/zinc/26/99/38/1054269938.db2.gz QADIZLWMSFLZES-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1ncoc1C(C)C)[C@H]2C ZINC001337548142 1054273174 /nfs/dbraw/zinc/27/31/74/1054273174.db2.gz DLXLGKFESDBQRW-KGLIPLIRSA-N 1 2 314.429 4.314 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1ncoc1C(C)C)[C@H]2C ZINC001337548142 1054273184 /nfs/dbraw/zinc/27/31/84/1054273184.db2.gz DLXLGKFESDBQRW-KGLIPLIRSA-N 1 2 314.429 4.314 20 0 DIADLO Cc1nc(Cl)c(C[N@H+]2CCC[C@H](C)C2)cc1Br ZINC001233464840 1054280391 /nfs/dbraw/zinc/28/03/91/1054280391.db2.gz IPOBPIKQLDAEEA-VIFPVBQESA-N 1 2 317.658 4.038 20 0 DIADLO Cc1nc(Cl)c(C[N@@H+]2CCC[C@H](C)C2)cc1Br ZINC001233464840 1054280405 /nfs/dbraw/zinc/28/04/05/1054280405.db2.gz IPOBPIKQLDAEEA-VIFPVBQESA-N 1 2 317.658 4.038 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](Cc1cnc(Cl)n1C)C1CC1 ZINC000848880917 1054280353 /nfs/dbraw/zinc/28/03/53/1054280353.db2.gz KVWXAJQWKVQFHD-NSHDSACASA-N 1 2 324.255 4.453 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](Cc1cnc(Cl)n1C)C1CC1 ZINC000848880917 1054280367 /nfs/dbraw/zinc/28/03/67/1054280367.db2.gz KVWXAJQWKVQFHD-NSHDSACASA-N 1 2 324.255 4.453 20 0 DIADLO Cn1c(Cl)ncc1C[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000848879733 1054280413 /nfs/dbraw/zinc/28/04/13/1054280413.db2.gz AQZWINOGWBXYOW-UHFFFAOYSA-N 1 2 318.635 4.012 20 0 DIADLO Cn1c(Cl)ncc1C[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000848879733 1054280428 /nfs/dbraw/zinc/28/04/28/1054280428.db2.gz AQZWINOGWBXYOW-UHFFFAOYSA-N 1 2 318.635 4.012 20 0 DIADLO Cn1c(Cl)ncc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000848880773 1054280917 /nfs/dbraw/zinc/28/09/17/1054280917.db2.gz HYUWYEWVSXFBFH-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1c(Cl)ncc1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000848880773 1054280932 /nfs/dbraw/zinc/28/09/32/1054280932.db2.gz HYUWYEWVSXFBFH-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO CCC[C@@H](C)CC(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001338443093 1054305409 /nfs/dbraw/zinc/30/54/09/1054305409.db2.gz HXIKEYPJXOWASS-CVEARBPZSA-N 1 2 319.493 4.170 20 0 DIADLO Cc1cc(C)c(CNC(=O)[C@@H](C)c2cccc(CC(C)C)c2)c[nH+]1 ZINC000622667331 1054323085 /nfs/dbraw/zinc/32/30/85/1054323085.db2.gz APRLIYGPBVKCES-KRWDZBQOSA-N 1 2 324.468 4.317 20 0 DIADLO Cc1ncc2c(n1)CCC[C@H]2Nc1cc(C)c2ccccc2[nH+]1 ZINC001339154314 1054325735 /nfs/dbraw/zinc/32/57/35/1054325735.db2.gz GEONJFSPSIFSMG-GOSISDBHSA-N 1 2 304.397 4.131 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)sc1C ZINC001233691911 1054334607 /nfs/dbraw/zinc/33/46/07/1054334607.db2.gz IEPYRFFPXHZDRY-QGZVFWFLSA-N 1 2 323.408 4.217 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)sc1C ZINC001233691911 1054334626 /nfs/dbraw/zinc/33/46/26/1054334626.db2.gz IEPYRFFPXHZDRY-QGZVFWFLSA-N 1 2 323.408 4.217 20 0 DIADLO CC[C@H](C)CCC(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001339299768 1054335059 /nfs/dbraw/zinc/33/50/59/1054335059.db2.gz FVPUZHIQCDYNHW-HOTGVXAUSA-N 1 2 319.493 4.170 20 0 DIADLO CCCCCCC(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001339301175 1054335251 /nfs/dbraw/zinc/33/52/51/1054335251.db2.gz SPORXCIYUYZLKA-MRXNPFEDSA-N 1 2 319.493 4.315 20 0 DIADLO Cc1cc(NC[C@@H](CCO)c2ccccc2)[nH+]c2ccccc12 ZINC001339412925 1054336820 /nfs/dbraw/zinc/33/68/20/1054336820.db2.gz AWVAZSOHZKDFJE-QGZVFWFLSA-N 1 2 306.409 4.121 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1ccnn1-c1ccccc1 ZINC001339826331 1054348086 /nfs/dbraw/zinc/34/80/86/1054348086.db2.gz KSWCTEKXGBAMOG-HNNXBMFYSA-N 1 2 306.413 4.111 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1csc(-c2ccccn2)n1 ZINC000171884184 1054396202 /nfs/dbraw/zinc/39/62/02/1054396202.db2.gz FJAMDXRDIXZFQI-AWEZNQCLSA-N 1 2 321.449 4.324 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1csc(-c2ccccn2)n1 ZINC000171884184 1054396213 /nfs/dbraw/zinc/39/62/13/1054396213.db2.gz FJAMDXRDIXZFQI-AWEZNQCLSA-N 1 2 321.449 4.324 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1csc(-c2ccccn2)n1 ZINC000171884183 1054396662 /nfs/dbraw/zinc/39/66/62/1054396662.db2.gz FJAMDXRDIXZFQI-CQSZACIVSA-N 1 2 321.449 4.324 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1csc(-c2ccccn2)n1 ZINC000171884183 1054396669 /nfs/dbraw/zinc/39/66/69/1054396669.db2.gz FJAMDXRDIXZFQI-CQSZACIVSA-N 1 2 321.449 4.324 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1ncoc1C(C)C ZINC001341729300 1054405532 /nfs/dbraw/zinc/40/55/32/1054405532.db2.gz NKTMUFXCNBWVPA-OAHLLOKOSA-N 1 2 302.418 4.438 20 0 DIADLO Cc1cccc(N(C)c2ccc(C[N@H+](C)Cc3ccon3)cc2)c1 ZINC001234177767 1054448972 /nfs/dbraw/zinc/44/89/72/1054448972.db2.gz BEGPUWZKNVUYAD-UHFFFAOYSA-N 1 2 321.424 4.383 20 0 DIADLO Cc1cccc(N(C)c2ccc(C[N@@H+](C)Cc3ccon3)cc2)c1 ZINC001234177767 1054448978 /nfs/dbraw/zinc/44/89/78/1054448978.db2.gz BEGPUWZKNVUYAD-UHFFFAOYSA-N 1 2 321.424 4.383 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+]2C[C@@H]3CCCC[C@@]32c2ccccc2)[nH]1 ZINC001343871120 1054455414 /nfs/dbraw/zinc/45/54/14/1054455414.db2.gz IJMZOSIKZBOFGA-OXJNMPFZSA-N 1 2 324.472 4.004 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+]2C[C@@H]3CCCC[C@@]32c2ccccc2)[nH]1 ZINC001343871120 1054455415 /nfs/dbraw/zinc/45/54/15/1054455415.db2.gz IJMZOSIKZBOFGA-OXJNMPFZSA-N 1 2 324.472 4.004 20 0 DIADLO Cc1ccccc1-c1nc(C[N@@H+](C)C(C)(C)c2ccccc2)no1 ZINC000671245867 1054458249 /nfs/dbraw/zinc/45/82/49/1054458249.db2.gz KDTBVUFPIHIUPT-UHFFFAOYSA-N 1 2 321.424 4.412 20 0 DIADLO Cc1ccccc1-c1nc(C[N@H+](C)C(C)(C)c2ccccc2)no1 ZINC000671245867 1054458259 /nfs/dbraw/zinc/45/82/59/1054458259.db2.gz KDTBVUFPIHIUPT-UHFFFAOYSA-N 1 2 321.424 4.412 20 0 DIADLO Cc1ccccc1N(C)c1ccc(C[N@H+](C)Cc2ccon2)cc1 ZINC001234269599 1054481486 /nfs/dbraw/zinc/48/14/86/1054481486.db2.gz QHUUVHOAALEOHA-UHFFFAOYSA-N 1 2 321.424 4.383 20 0 DIADLO Cc1ccccc1N(C)c1ccc(C[N@@H+](C)Cc2ccon2)cc1 ZINC001234269599 1054481493 /nfs/dbraw/zinc/48/14/93/1054481493.db2.gz QHUUVHOAALEOHA-UHFFFAOYSA-N 1 2 321.424 4.383 20 0 DIADLO CC[C@@H](c1ccccc1)N(C(=O)C[C@H](C)n1cc[nH+]c1)C(C)C ZINC000622977408 1054497654 /nfs/dbraw/zinc/49/76/54/1054497654.db2.gz ZZZCWABTADEFPC-WMZOPIPTSA-N 1 2 313.445 4.223 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)Cc2c(C)cccc2C)cs1 ZINC000174007421 1054501890 /nfs/dbraw/zinc/50/18/90/1054501890.db2.gz JPTASOFFXUHSTE-HNNXBMFYSA-N 1 2 318.486 4.489 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)Cc2c(C)cccc2C)cs1 ZINC000174007421 1054501909 /nfs/dbraw/zinc/50/19/09/1054501909.db2.gz JPTASOFFXUHSTE-HNNXBMFYSA-N 1 2 318.486 4.489 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1Cl)C(=O)Nc1ccccc1 ZINC000175021279 1054518903 /nfs/dbraw/zinc/51/89/03/1054518903.db2.gz WLLHOBIFSWMDGP-VXGBXAGGSA-N 1 2 320.795 4.157 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1coc(-c2cccs2)n1 ZINC000623121840 1054534735 /nfs/dbraw/zinc/53/47/35/1054534735.db2.gz OUIRGELXJXSUFQ-UHFFFAOYSA-N 1 2 304.337 4.177 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1coc(-c2cccs2)n1 ZINC000623121840 1054534753 /nfs/dbraw/zinc/53/47/53/1054534753.db2.gz OUIRGELXJXSUFQ-UHFFFAOYSA-N 1 2 304.337 4.177 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000623120682 1054534929 /nfs/dbraw/zinc/53/49/29/1054534929.db2.gz HCYVCASLXNVSRU-UHFFFAOYSA-N 1 2 316.298 4.255 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000623120682 1054534936 /nfs/dbraw/zinc/53/49/36/1054534936.db2.gz HCYVCASLXNVSRU-UHFFFAOYSA-N 1 2 316.298 4.255 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)nc(C)n1 ZINC000671302910 1054542276 /nfs/dbraw/zinc/54/22/76/1054542276.db2.gz IHZFGHLHUICTGG-JTQLQIEISA-N 1 2 310.228 4.251 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@H](C)COCc2ccccc2)cc1 ZINC001234588312 1054550286 /nfs/dbraw/zinc/55/02/86/1054550286.db2.gz LQVXGIVKXUTOLP-OAHLLOKOSA-N 1 2 313.397 4.033 20 0 DIADLO CCCN(C(=O)CCCn1cc[nH+]c1)[C@@H](CC)c1ccccc1 ZINC000623253543 1054551146 /nfs/dbraw/zinc/55/11/46/1054551146.db2.gz FVWHPRFQXIUDGX-SFHVURJKSA-N 1 2 313.445 4.053 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@H]2CCc3c2nccc3Cl)cc1 ZINC001234584576 1054551894 /nfs/dbraw/zinc/55/18/94/1054551894.db2.gz FIQFUNSIPLACKP-HNNXBMFYSA-N 1 2 316.788 4.163 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@H]2CCc3c2cc(F)cc3F)cc1 ZINC001234587974 1054552062 /nfs/dbraw/zinc/55/20/62/1054552062.db2.gz GUDNIAQEQCJAAU-KRWDZBQOSA-N 1 2 317.335 4.393 20 0 DIADLO Fc1c(Cl)cccc1C[NH2+]Cc1ccnc(Cl)c1Cl ZINC001347372868 1054568699 /nfs/dbraw/zinc/56/86/99/1054568699.db2.gz NDAQJOBQWLIJNI-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO CCC(C)(CC)C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001347537595 1054571593 /nfs/dbraw/zinc/57/15/93/1054571593.db2.gz YHCYKHKGZASBJB-HNNXBMFYSA-N 1 2 319.493 4.170 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+]Cc3ccc(F)c(F)c3)co2)cc1 ZINC000072927093 1054577138 /nfs/dbraw/zinc/57/71/38/1054577138.db2.gz DWIJJSPHFKUMEI-UHFFFAOYSA-N 1 2 314.335 4.218 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(F)cc(F)cc2Br)C2(CC2)C1 ZINC001234771402 1054588518 /nfs/dbraw/zinc/58/85/18/1054588518.db2.gz PIFODMIJQYWTBF-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c(F)cc(F)cc2Br)C2(CC2)C1 ZINC001234771402 1054588529 /nfs/dbraw/zinc/58/85/29/1054588529.db2.gz PIFODMIJQYWTBF-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO CC(C)([NH2+]Cc1csc(C(F)(F)F)c1)c1nccs1 ZINC000623421896 1054591764 /nfs/dbraw/zinc/59/17/64/1054591764.db2.gz ALZDAXXAVISODU-UHFFFAOYSA-N 1 2 306.378 4.248 20 0 DIADLO C[C@@H]1CC[C@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)C[C@H]1C ZINC001358066861 1054593344 /nfs/dbraw/zinc/59/33/44/1054593344.db2.gz HKSBYYDRXZWIIM-MCIONIFRSA-N 1 2 315.392 4.022 20 0 DIADLO COC[C@H]([NH2+]Cc1ccc(-c2ccccc2)o1)c1ccc(C)o1 ZINC000177565347 1054619869 /nfs/dbraw/zinc/61/98/69/1054619869.db2.gz HFULAXRFCOKMQE-KRWDZBQOSA-N 1 2 311.381 4.325 20 0 DIADLO COC[C@@H]([NH2+]Cc1ccc(-c2ccc(F)cc2)o1)c1ccco1 ZINC000177577456 1054622638 /nfs/dbraw/zinc/62/26/38/1054622638.db2.gz YHSXZYRRVWTWRM-MRXNPFEDSA-N 1 2 315.344 4.156 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(Cl)cc(Br)c2F)C1 ZINC001234968879 1054635001 /nfs/dbraw/zinc/63/50/01/1054635001.db2.gz PDNXYOCCKRHGKC-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(Cl)cc(Br)c2F)C1 ZINC001234968879 1054635006 /nfs/dbraw/zinc/63/50/06/1054635006.db2.gz PDNXYOCCKRHGKC-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO Fc1cnc(C[NH+]2CCC(c3ccc4ccccc4c3)CC2)nc1 ZINC001235006176 1054641137 /nfs/dbraw/zinc/64/11/37/1054641137.db2.gz SXHUAIWIBJLNNH-UHFFFAOYSA-N 1 2 321.399 4.149 20 0 DIADLO CCCCC[C@@H](C(=O)Nc1ccc2[nH+]c(C)cn2c1)C(C)C ZINC001358364257 1054665153 /nfs/dbraw/zinc/66/51/53/1054665153.db2.gz UKHVHHMRSBSVDD-MRXNPFEDSA-N 1 2 301.434 4.434 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)Cc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000179384216 1054679040 /nfs/dbraw/zinc/67/90/40/1054679040.db2.gz MXUXXYCGRDHOBS-GFCCVEGCSA-N 1 2 316.832 4.478 20 0 DIADLO Cc1cc(F)c(C[N@@H+]2CCCC[C@H]2c2cccnc2)c(F)c1 ZINC001235192559 1054680454 /nfs/dbraw/zinc/68/04/54/1054680454.db2.gz DPPUZMDCICSDCH-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1cc(F)c(C[N@H+]2CCCC[C@H]2c2cccnc2)c(F)c1 ZINC001235192559 1054680456 /nfs/dbraw/zinc/68/04/56/1054680456.db2.gz DPPUZMDCICSDCH-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO FC(F)(F)c1ccc(Cl)nc1C[N@@H+]1CC2CCC1CC2 ZINC001235226130 1054686645 /nfs/dbraw/zinc/68/66/45/1054686645.db2.gz CSUCCHOIVLRSGX-UHFFFAOYSA-N 1 2 304.743 4.128 20 0 DIADLO FC(F)(F)c1ccc(Cl)nc1C[N@H+]1CC2CCC1CC2 ZINC001235226130 1054686655 /nfs/dbraw/zinc/68/66/55/1054686655.db2.gz CSUCCHOIVLRSGX-UHFFFAOYSA-N 1 2 304.743 4.128 20 0 DIADLO CCc1cccc(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)n1 ZINC001235265542 1054693983 /nfs/dbraw/zinc/69/39/83/1054693983.db2.gz VJQJANJAFBNICJ-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO CCc1cccc(C[N@H+]2CCc3cccc(C(F)(F)F)c3C2)n1 ZINC001235265542 1054693990 /nfs/dbraw/zinc/69/39/90/1054693990.db2.gz VJQJANJAFBNICJ-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO Fc1ccc2oc(C[NH2+]C3(c4cccc(Cl)c4)CC3)nc2c1 ZINC000179670119 1054694942 /nfs/dbraw/zinc/69/49/42/1054694942.db2.gz NYRLNLVPTFJUBU-UHFFFAOYSA-N 1 2 316.763 4.399 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)c(F)cn1 ZINC001235323547 1054699275 /nfs/dbraw/zinc/69/92/75/1054699275.db2.gz ORJPJOBQZWMNJO-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)c(F)cn1 ZINC001235323547 1054699283 /nfs/dbraw/zinc/69/92/83/1054699283.db2.gz ORJPJOBQZWMNJO-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)c(F)cn1 ZINC001235318266 1054699857 /nfs/dbraw/zinc/69/98/57/1054699857.db2.gz YJKAHWDYNYXVEN-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)c(F)cn1 ZINC001235318266 1054699863 /nfs/dbraw/zinc/69/98/63/1054699863.db2.gz YJKAHWDYNYXVEN-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1cc(F)c(F)c(F)c1F ZINC001235347273 1054702274 /nfs/dbraw/zinc/70/22/74/1054702274.db2.gz ATLRNDJYIREEFO-UHFFFAOYSA-N 1 2 303.324 4.327 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1cc(F)c(F)c(F)c1F ZINC001235347273 1054702285 /nfs/dbraw/zinc/70/22/85/1054702285.db2.gz ATLRNDJYIREEFO-UHFFFAOYSA-N 1 2 303.324 4.327 20 0 DIADLO Fc1cc(C[N@@H+]2CCCC3(CCCC3)C2)c(F)c(F)c1F ZINC001235345793 1054702648 /nfs/dbraw/zinc/70/26/48/1054702648.db2.gz LXDAEPCKAFCNOZ-UHFFFAOYSA-N 1 2 301.327 4.399 20 0 DIADLO Fc1cc(C[N@H+]2CCCC3(CCCC3)C2)c(F)c(F)c1F ZINC001235345793 1054702664 /nfs/dbraw/zinc/70/26/64/1054702664.db2.gz LXDAEPCKAFCNOZ-UHFFFAOYSA-N 1 2 301.327 4.399 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2ccc(C(F)(F)F)cc2)n1 ZINC000921505171 1054725989 /nfs/dbraw/zinc/72/59/89/1054725989.db2.gz OBHGIVFQSHXBLT-UHFFFAOYSA-N 1 2 312.335 4.281 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)cc(F)c1F ZINC001235449214 1054727007 /nfs/dbraw/zinc/72/70/07/1054727007.db2.gz RZCGDVZHFSPZNU-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2F)cc(F)c1F ZINC001235449214 1054727024 /nfs/dbraw/zinc/72/70/24/1054727024.db2.gz RZCGDVZHFSPZNU-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO CN(C)c1cccc(C[N@H+](C)Cc2ncc(Cl)cc2Cl)c1 ZINC000180146379 1054738892 /nfs/dbraw/zinc/73/88/92/1054738892.db2.gz QLHBBQHWVYDOPT-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1cccc(C[N@@H+](C)Cc2ncc(Cl)cc2Cl)c1 ZINC000180146379 1054738906 /nfs/dbraw/zinc/73/89/06/1054738906.db2.gz QLHBBQHWVYDOPT-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO Cc1cnc(C[N@H+](C)Cc2ccccc2Br)c(C)c1 ZINC001238425097 1054749980 /nfs/dbraw/zinc/74/99/80/1054749980.db2.gz GGNXSFMUAWRDPN-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cnc(C[N@@H+](C)Cc2ccccc2Br)c(C)c1 ZINC001238425097 1054749989 /nfs/dbraw/zinc/74/99/89/1054749989.db2.gz GGNXSFMUAWRDPN-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@@H](c4ccccc4)C3)[nH]c2c1 ZINC001235691683 1054776863 /nfs/dbraw/zinc/77/68/63/1054776863.db2.gz IWVBDVJHKNKQOR-OAHLLOKOSA-N 1 2 309.388 4.082 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@@H](c4ccccc4)C3)[nH]c2c1 ZINC001235691683 1054776880 /nfs/dbraw/zinc/77/68/80/1054776880.db2.gz IWVBDVJHKNKQOR-OAHLLOKOSA-N 1 2 309.388 4.082 20 0 DIADLO O=C(Cc1cc2ccccc2o1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000623809933 1054778366 /nfs/dbraw/zinc/77/83/66/1054778366.db2.gz FVAFLFGJDOCIRI-UHFFFAOYSA-N 1 2 317.348 4.004 20 0 DIADLO CC(C)C[N@H+](Cc1nc2ccc(F)cc2[nH]1)Cc1ccccc1 ZINC001235685041 1054778592 /nfs/dbraw/zinc/77/85/92/1054778592.db2.gz XKBJDIYDQDBFGI-UHFFFAOYSA-N 1 2 311.404 4.360 20 0 DIADLO CC(C)C[N@@H+](Cc1nc2ccc(F)cc2[nH]1)Cc1ccccc1 ZINC001235685041 1054778611 /nfs/dbraw/zinc/77/86/11/1054778611.db2.gz XKBJDIYDQDBFGI-UHFFFAOYSA-N 1 2 311.404 4.360 20 0 DIADLO COc1ccc(CC[C@@H](C)Nc2cc(C)[nH+]c(C3CC3)n2)cc1 ZINC000523876044 1054781002 /nfs/dbraw/zinc/78/10/02/1054781002.db2.gz LQVHOKAPIBBOJB-CYBMUJFWSA-N 1 2 311.429 4.104 20 0 DIADLO C[N@H+](CCc1cccc(Cl)c1)Cc1nc2ccc(F)cc2[nH]1 ZINC001235697244 1054782117 /nfs/dbraw/zinc/78/21/17/1054782117.db2.gz PVPDOTKSFZDJHK-UHFFFAOYSA-N 1 2 317.795 4.030 20 0 DIADLO C[N@@H+](CCc1cccc(Cl)c1)Cc1nc2ccc(F)cc2[nH]1 ZINC001235697244 1054782132 /nfs/dbraw/zinc/78/21/32/1054782132.db2.gz PVPDOTKSFZDJHK-UHFFFAOYSA-N 1 2 317.795 4.030 20 0 DIADLO Fc1cccc(F)c1C1([NH2+]Cc2ccncc2Cl)CCC1 ZINC000623844985 1054783494 /nfs/dbraw/zinc/78/34/94/1054783494.db2.gz OENPXMUTNFLISD-UHFFFAOYSA-N 1 2 308.759 4.182 20 0 DIADLO Cc1cc(Br)cc(C[NH+]2CC3(C2)CCCC3)c1F ZINC001235721105 1054787697 /nfs/dbraw/zinc/78/76/97/1054787697.db2.gz CAJIAXFUCOYSAD-UHFFFAOYSA-N 1 2 312.226 4.273 20 0 DIADLO C[C@H]([NH2+]C1(c2c(F)cccc2F)CCC1)c1cncc(F)c1 ZINC000623844517 1054790326 /nfs/dbraw/zinc/79/03/26/1054790326.db2.gz ZONGTLCEAMNWDL-NSHDSACASA-N 1 2 306.331 4.229 20 0 DIADLO Cc1[nH+]c[nH]c1CC(=O)Nc1cccc(Oc2cccc(C)c2)c1 ZINC001455027517 1054790299 /nfs/dbraw/zinc/79/02/99/1054790299.db2.gz UIOXXWJOZHATKL-UHFFFAOYSA-N 1 2 321.380 4.000 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC001235741201 1054794591 /nfs/dbraw/zinc/79/45/91/1054794591.db2.gz QILRNXYJSDEPFW-OAHLLOKOSA-N 1 2 318.219 4.135 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC001235741201 1054794605 /nfs/dbraw/zinc/79/46/05/1054794605.db2.gz QILRNXYJSDEPFW-OAHLLOKOSA-N 1 2 318.219 4.135 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC001235741200 1054795070 /nfs/dbraw/zinc/79/50/70/1054795070.db2.gz QILRNXYJSDEPFW-HNNXBMFYSA-N 1 2 318.219 4.135 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[N@H+]1CCC[C@]2(CCOC2)C1 ZINC001235741200 1054795080 /nfs/dbraw/zinc/79/50/80/1054795080.db2.gz QILRNXYJSDEPFW-HNNXBMFYSA-N 1 2 318.219 4.135 20 0 DIADLO c1nc2c(s1)CCC[C@@H]2[NH2+][C@H](c1ccccc1)c1ccncc1 ZINC000623874994 1054796165 /nfs/dbraw/zinc/79/61/65/1054796165.db2.gz VJOSJCMSMPEOGF-FUHWJXTLSA-N 1 2 321.449 4.295 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@H](c2nc3ccccc3[nH]2)C(C)C)n1 ZINC000623873727 1054796645 /nfs/dbraw/zinc/79/66/45/1054796645.db2.gz PTVZPEGQUPLXHH-WFASDCNBSA-N 1 2 314.458 4.376 20 0 DIADLO C[C@H]1CC[N@@H+]1Cc1cc(F)c(OCc2ccccc2)c(F)c1 ZINC001235759307 1054802266 /nfs/dbraw/zinc/80/22/66/1054802266.db2.gz FZBOPYLPXMBFMF-ZDUSSCGKSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@H]1CC[N@H+]1Cc1cc(F)c(OCc2ccccc2)c(F)c1 ZINC001235759307 1054802276 /nfs/dbraw/zinc/80/22/76/1054802276.db2.gz FZBOPYLPXMBFMF-ZDUSSCGKSA-N 1 2 303.352 4.138 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001235820018 1054812227 /nfs/dbraw/zinc/81/22/27/1054812227.db2.gz UYLPXQDQCOBAPE-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(F)ccc1C[N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001235820018 1054812237 /nfs/dbraw/zinc/81/22/37/1054812237.db2.gz UYLPXQDQCOBAPE-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1ccc(OC(F)F)c(C[NH2+][C@H]2CCCc3scnc32)c1 ZINC000623905372 1054815292 /nfs/dbraw/zinc/81/52/92/1054815292.db2.gz ZOHHUUVTVWZWIY-LBPRGKRZSA-N 1 2 324.396 4.220 20 0 DIADLO COc1nccc(C[N@@H+]2Cc3ccccc3C(C)(C)C2)c1Cl ZINC001235840803 1054820282 /nfs/dbraw/zinc/82/02/82/1054820282.db2.gz YIPBQOZYTCGSQR-UHFFFAOYSA-N 1 2 316.832 4.037 20 0 DIADLO COc1nccc(C[N@H+]2Cc3ccccc3C(C)(C)C2)c1Cl ZINC001235840803 1054820295 /nfs/dbraw/zinc/82/02/95/1054820295.db2.gz YIPBQOZYTCGSQR-UHFFFAOYSA-N 1 2 316.832 4.037 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1c(Br)ccnc1Cl ZINC001235869446 1054828338 /nfs/dbraw/zinc/82/83/38/1054828338.db2.gz AYOAOINOEUJDKG-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@H]([NH2+][C@H]1CC=CCC1)c1cc(Br)cc(F)c1O ZINC000186056984 1054873735 /nfs/dbraw/zinc/87/37/35/1054873735.db2.gz GBNTZZCLQCLYCC-ONGXEEELSA-N 1 2 314.198 4.053 20 0 DIADLO Cc1cncc([C@@H](C)[NH2+][C@H](CCc2ccccc2)C(F)F)c1 ZINC000624125089 1054884727 /nfs/dbraw/zinc/88/47/27/1054884727.db2.gz SHUYJDZEHCADMM-RHSMWYFYSA-N 1 2 304.384 4.307 20 0 DIADLO CC[C@H]([NH2+][C@H](CCc1ccccc1)C(F)F)c1ccncc1 ZINC000624124627 1054887439 /nfs/dbraw/zinc/88/74/39/1054887439.db2.gz HYKJANIQAJCZCC-DLBZAZTESA-N 1 2 304.384 4.389 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc(-c2ccncc2)cc1 ZINC001236038728 1054907660 /nfs/dbraw/zinc/90/76/60/1054907660.db2.gz YPHSYRPEPKHMGI-UHFFFAOYSA-N 1 2 301.349 4.301 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1cccc2ccccc21 ZINC000181667231 1054926604 /nfs/dbraw/zinc/92/66/04/1054926604.db2.gz XDSFSOWKGTZALH-ZDUSSCGKSA-N 1 2 309.413 4.371 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@H](CC)c2ccc(C)cc2)n1 ZINC000181677185 1054928849 /nfs/dbraw/zinc/92/88/49/1054928849.db2.gz NDDYMIQUAZFIJS-UKRRQHHQSA-N 1 2 319.474 4.433 20 0 DIADLO COc1cc(C[NH+]2CCOCC2)ccc1-c1cccc(C2CC2)c1 ZINC001236087394 1054934192 /nfs/dbraw/zinc/93/41/92/1054934192.db2.gz IDPXSHNSCIPBTM-UHFFFAOYSA-N 1 2 323.436 4.072 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nc(CCC(C)C)no1)c1ccccc1 ZINC000181769257 1054937003 /nfs/dbraw/zinc/93/70/03/1054937003.db2.gz RUNBMOKKYCZTKY-MRXNPFEDSA-N 1 2 301.434 4.289 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+]Cc2nc(CC(C)C)no2)cc1 ZINC000182124432 1054962576 /nfs/dbraw/zinc/96/25/76/1054962576.db2.gz NRXRSZSSHZBTLJ-CYBMUJFWSA-N 1 2 319.474 4.231 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(-c2cccs2)on1)c1c(C)noc1C ZINC000182401157 1054985400 /nfs/dbraw/zinc/98/54/00/1054985400.db2.gz WAVAVYOTGRFGNI-ZDUSSCGKSA-N 1 2 317.414 4.249 20 0 DIADLO COc1cc(C)cc(F)c1-c1cc(N2CCCCC2)cc[nH+]1 ZINC001236211567 1055002771 /nfs/dbraw/zinc/00/27/71/1055002771.db2.gz MTLZCFZEDRHMRZ-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(F)c(Cl)c2F)c(C)[nH+]1 ZINC000182793622 1055010646 /nfs/dbraw/zinc/01/06/46/1055010646.db2.gz QSLGYHRQDRLWKB-UHFFFAOYSA-N 1 2 310.731 4.191 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccc(F)cc1F)C(C)(C)C)c1nccn1C ZINC000183117296 1055030054 /nfs/dbraw/zinc/03/00/54/1055030054.db2.gz XORIUPQTKZXTFX-NHYWBVRUSA-N 1 2 307.388 4.136 20 0 DIADLO C=Cc1ccc(-c2cccc(Cl)c2C[NH+]2CCOCC2)cc1 ZINC001236277672 1055047104 /nfs/dbraw/zinc/04/71/04/1055047104.db2.gz KMTXFUQJYNWIDX-UHFFFAOYSA-N 1 2 313.828 4.482 20 0 DIADLO CC(C)C(=O)Nc1ccc(-c2ccc(-c3c[nH+]cn3C)cc2)cc1 ZINC001236270209 1055047567 /nfs/dbraw/zinc/04/75/67/1055047567.db2.gz ZVFRSFLJDDNGSJ-UHFFFAOYSA-N 1 2 319.408 4.349 20 0 DIADLO CC(C)CCc1noc(C[NH2+]C2(c3ccccc3)CCCC2)n1 ZINC000183540445 1055050083 /nfs/dbraw/zinc/05/00/83/1055050083.db2.gz OUWJWYYXNXBGJP-UHFFFAOYSA-N 1 2 313.445 4.217 20 0 DIADLO CCOP(=O)(Cc1ccc(-c2ccc(N)[nH+]c2)cc1)OCC ZINC001236314648 1055054013 /nfs/dbraw/zinc/05/40/13/1055054013.db2.gz DTZYQKMKJFMSDA-UHFFFAOYSA-N 1 2 320.329 4.097 20 0 DIADLO CCCn1c(C)nnc1C[NH2+][C@H](c1ccccc1Cl)C(C)C ZINC000183704796 1055055152 /nfs/dbraw/zinc/05/51/52/1055055152.db2.gz NWKUAMPYDRLJTE-KRWDZBQOSA-N 1 2 320.868 4.137 20 0 DIADLO C[N@H+](Cc1ccncc1)Cc1cc(C(F)(F)F)ccc1Cl ZINC000183745410 1055057396 /nfs/dbraw/zinc/05/73/96/1055057396.db2.gz AGZOZOIYCRQYLX-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccncc1)Cc1cc(C(F)(F)F)ccc1Cl ZINC000183745410 1055057408 /nfs/dbraw/zinc/05/74/08/1055057408.db2.gz AGZOZOIYCRQYLX-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO CC[C@](C)([NH2+]Cc1ncc(C(C)C)s1)c1nc(C)cs1 ZINC000183817155 1055058468 /nfs/dbraw/zinc/05/84/68/1055058468.db2.gz BTHBXKJPFPFACP-HNNXBMFYSA-N 1 2 309.504 4.446 20 0 DIADLO O=C(Nc1ccc(-c2ccn3cc[nH+]c3c2)cc1)c1ccccc1 ZINC001236333602 1055062009 /nfs/dbraw/zinc/06/20/09/1055062009.db2.gz WCAHGYWWGAPREC-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO CC(C)c1cnc(C[NH2+]Cc2ccc(OC(C)(C)C)nc2)s1 ZINC000184117062 1055069075 /nfs/dbraw/zinc/06/90/75/1055069075.db2.gz GQVVTCKFRQSVFO-UHFFFAOYSA-N 1 2 319.474 4.129 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(-c2ccc(C)cc2)no1)c1nccs1 ZINC000185052876 1055087022 /nfs/dbraw/zinc/08/70/22/1055087022.db2.gz HZIRWZIRHULLDV-OAHLLOKOSA-N 1 2 313.426 4.347 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2nc(C(C)(C)C)cs2)C2CC2)s1 ZINC000185277141 1055090168 /nfs/dbraw/zinc/09/01/68/1055090168.db2.gz VRKVAZZABFHGRE-CQSZACIVSA-N 1 2 321.515 4.446 20 0 DIADLO C[C@@H](CNc1ccccc1OCCn1cc[nH+]c1)c1ccccc1 ZINC000194139705 1055116271 /nfs/dbraw/zinc/11/62/71/1055116271.db2.gz DRGBKOLZVKMUGY-KRWDZBQOSA-N 1 2 321.424 4.178 20 0 DIADLO C[C@H](CNc1ccccc1OCCn1cc[nH+]c1)c1ccccc1 ZINC000194139720 1055117058 /nfs/dbraw/zinc/11/70/58/1055117058.db2.gz DRGBKOLZVKMUGY-QGZVFWFLSA-N 1 2 321.424 4.178 20 0 DIADLO Clc1ccsc1C[N@@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000194353675 1055122519 /nfs/dbraw/zinc/12/25/19/1055122519.db2.gz PDKMDUWQOIGPDR-CYBMUJFWSA-N 1 2 311.834 4.176 20 0 DIADLO Clc1ccsc1C[N@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000194353675 1055122526 /nfs/dbraw/zinc/12/25/26/1055122526.db2.gz PDKMDUWQOIGPDR-CYBMUJFWSA-N 1 2 311.834 4.176 20 0 DIADLO CCN(C(=O)c1ccc(-n2cc[nH+]c2)cc1)c1cc(C)cc(C)c1 ZINC000194421654 1055125052 /nfs/dbraw/zinc/12/50/52/1055125052.db2.gz IMZKMEHVECZICG-UHFFFAOYSA-N 1 2 319.408 4.156 20 0 DIADLO C[C@@H]1CCN(C(=O)c2ccc(-n3cc[nH+]c3)cc2)c2ccccc21 ZINC000194604167 1055130071 /nfs/dbraw/zinc/13/00/71/1055130071.db2.gz RCEUJCJBRJVRHI-OAHLLOKOSA-N 1 2 317.392 4.026 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@H+](C)Cc1cccc(F)c1 ZINC001236598081 1055201911 /nfs/dbraw/zinc/20/19/11/1055201911.db2.gz HITYRBYZKQCZTR-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@@H+](C)Cc1cccc(F)c1 ZINC001236598081 1055201922 /nfs/dbraw/zinc/20/19/22/1055201922.db2.gz HITYRBYZKQCZTR-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO F[C@@H]1CCC[N@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)CC1 ZINC001236618984 1055205644 /nfs/dbraw/zinc/20/56/44/1055205644.db2.gz JYCKBAMCAAEUJB-SNVBAGLBSA-N 1 2 310.722 4.078 20 0 DIADLO F[C@@H]1CCC[N@@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)CC1 ZINC001236618984 1055205648 /nfs/dbraw/zinc/20/56/48/1055205648.db2.gz JYCKBAMCAAEUJB-SNVBAGLBSA-N 1 2 310.722 4.078 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)[C@@H]1C ZINC001236636560 1055209162 /nfs/dbraw/zinc/20/91/62/1055209162.db2.gz UZJVWWXNSLXKOS-NXEZZACHSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)[C@@H]1C ZINC001236636560 1055209172 /nfs/dbraw/zinc/20/91/72/1055209172.db2.gz UZJVWWXNSLXKOS-NXEZZACHSA-N 1 2 306.759 4.374 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)cc(C)n2)cn1 ZINC001236648649 1055212919 /nfs/dbraw/zinc/21/29/19/1055212919.db2.gz VVACLBJKFDSDKK-KRWDZBQOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc(Cl)cc(C)n2)cn1 ZINC001236648649 1055212925 /nfs/dbraw/zinc/21/29/25/1055212925.db2.gz VVACLBJKFDSDKK-KRWDZBQOSA-N 1 2 301.821 4.084 20 0 DIADLO CCCO[C@H]1CC[N@H+](Cc2cc(Cl)c(F)c(Cl)c2)C1 ZINC001236660637 1055215452 /nfs/dbraw/zinc/21/54/52/1055215452.db2.gz BBLPHCHPSDXOAG-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@H]1CC[N@@H+](Cc2cc(Cl)c(F)c(Cl)c2)C1 ZINC001236660637 1055215464 /nfs/dbraw/zinc/21/54/64/1055215464.db2.gz BBLPHCHPSDXOAG-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO Cc1ccc(NCc2cccc(F)c2Br)c(C)[nH+]1 ZINC000382496792 1055217158 /nfs/dbraw/zinc/21/71/58/1055217158.db2.gz LUBPZQJUZKBOHM-UHFFFAOYSA-N 1 2 309.182 4.212 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2cc(C)c(Cl)c(C)c2)c[nH+]1 ZINC001562691799 1055269517 /nfs/dbraw/zinc/26/95/17/1055269517.db2.gz LRIFFZWEDBYPLT-UHFFFAOYSA-N 1 2 317.820 4.290 20 0 DIADLO COc1cc(C[N@@H+]2CCSc3ccccc3C2)c(F)cc1F ZINC001236828201 1055280259 /nfs/dbraw/zinc/28/02/59/1055280259.db2.gz RFQITDNRWGCZRM-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO COc1cc(C[N@H+]2CCSc3ccccc3C2)c(F)cc1F ZINC001236828201 1055280267 /nfs/dbraw/zinc/28/02/67/1055280267.db2.gz RFQITDNRWGCZRM-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO CN(C(=O)Nc1ccc2[nH+]ccn2c1)c1cccc2ccccc21 ZINC001563092277 1055286770 /nfs/dbraw/zinc/28/67/70/1055286770.db2.gz FQDNYWLEUALHOF-UHFFFAOYSA-N 1 2 316.364 4.156 20 0 DIADLO CCOc1cncc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001236843947 1055287820 /nfs/dbraw/zinc/28/78/20/1055287820.db2.gz UFYLNWPRPRTNGU-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cncc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001236843947 1055287830 /nfs/dbraw/zinc/28/78/30/1055287830.db2.gz UFYLNWPRPRTNGU-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO C[N@H+](Cc1cc2sccc2nc1Cl)C1CC(F)(F)C1 ZINC001236858375 1055295542 /nfs/dbraw/zinc/29/55/42/1055295542.db2.gz AXAQZFNOXGQRFM-UHFFFAOYSA-N 1 2 302.777 4.179 20 0 DIADLO C[N@@H+](Cc1cc2sccc2nc1Cl)C1CC(F)(F)C1 ZINC001236858375 1055295552 /nfs/dbraw/zinc/29/55/52/1055295552.db2.gz AXAQZFNOXGQRFM-UHFFFAOYSA-N 1 2 302.777 4.179 20 0 DIADLO Oc1ccc2c(c1)CC[N@@H+](Cc1nc3ccccc3cc1Cl)C2 ZINC001236868481 1055300013 /nfs/dbraw/zinc/30/00/13/1055300013.db2.gz WIYJKCUHLLBRKZ-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1ccc2c(c1)CC[N@H+](Cc1nc3ccccc3cc1Cl)C2 ZINC001236868481 1055300026 /nfs/dbraw/zinc/30/00/26/1055300026.db2.gz WIYJKCUHLLBRKZ-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1cccc(F)c1Br ZINC000383778683 1055301636 /nfs/dbraw/zinc/30/16/36/1055301636.db2.gz WOHMIKZXDFHUJZ-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1cccc(F)c1Br ZINC000383778683 1055301654 /nfs/dbraw/zinc/30/16/54/1055301654.db2.gz WOHMIKZXDFHUJZ-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO Fc1ccc(C[N@@H+]2CCc3nc(Cl)ccc3C2)c2occc21 ZINC001236905512 1055312631 /nfs/dbraw/zinc/31/26/31/1055312631.db2.gz MDWPNFLNAOFYJD-UHFFFAOYSA-N 1 2 316.763 4.179 20 0 DIADLO Fc1ccc(C[N@H+]2CCc3nc(Cl)ccc3C2)c2occc21 ZINC001236905512 1055312648 /nfs/dbraw/zinc/31/26/48/1055312648.db2.gz MDWPNFLNAOFYJD-UHFFFAOYSA-N 1 2 316.763 4.179 20 0 DIADLO Cc1ccc(-c2cncc(C[N@@H+]3CC[C@](C)(F)[C@H](F)C3)c2)cc1 ZINC001236990500 1055331046 /nfs/dbraw/zinc/33/10/46/1055331046.db2.gz HLFMNDWEKUAZMK-MOPGFXCFSA-N 1 2 316.395 4.329 20 0 DIADLO Cc1ccc(-c2cncc(C[N@H+]3CC[C@](C)(F)[C@H](F)C3)c2)cc1 ZINC001236990500 1055331060 /nfs/dbraw/zinc/33/10/60/1055331060.db2.gz HLFMNDWEKUAZMK-MOPGFXCFSA-N 1 2 316.395 4.329 20 0 DIADLO CC(C)(C)Oc1ccccc1C[N@@H+]1CCC(=O)[C@@H]2CCCC[C@@H]21 ZINC001237026118 1055343403 /nfs/dbraw/zinc/34/34/03/1055343403.db2.gz KSBXZLHJRDYPED-SJORKVTESA-N 1 2 315.457 4.198 20 0 DIADLO CC(C)(C)Oc1ccccc1C[N@H+]1CCC(=O)[C@@H]2CCCC[C@@H]21 ZINC001237026118 1055343417 /nfs/dbraw/zinc/34/34/17/1055343417.db2.gz KSBXZLHJRDYPED-SJORKVTESA-N 1 2 315.457 4.198 20 0 DIADLO Oc1cc2ccccc2c(C[N@@H+]2CCc3nc(Cl)ccc3C2)c1 ZINC001237074088 1055358682 /nfs/dbraw/zinc/35/86/82/1055358682.db2.gz MRMOYSQBRWUIOZ-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1cc2ccccc2c(C[N@H+]2CCc3nc(Cl)ccc3C2)c1 ZINC001237074088 1055358698 /nfs/dbraw/zinc/35/86/98/1055358698.db2.gz MRMOYSQBRWUIOZ-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO C/C=C(/C=C\C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)CC ZINC000765352263 1055373776 /nfs/dbraw/zinc/37/37/76/1055373776.db2.gz WSAMCYODKFGOIP-IQTRCOIWSA-N 1 2 315.804 4.377 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C=Cc1ccc(F)c2ccccc12 ZINC001537610144 1055379031 /nfs/dbraw/zinc/37/90/31/1055379031.db2.gz TXJOIPHVSNHERM-NTMALXAHSA-N 1 2 320.367 4.065 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1sc(=O)[nH]c1Cl ZINC001237169411 1055390949 /nfs/dbraw/zinc/39/09/49/1055390949.db2.gz NIVBYGLQEWZBGX-QMMMGPOBSA-N 1 2 317.241 4.349 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1sc(=O)[nH]c1Cl ZINC001237169411 1055390972 /nfs/dbraw/zinc/39/09/72/1055390972.db2.gz NIVBYGLQEWZBGX-QMMMGPOBSA-N 1 2 317.241 4.349 20 0 DIADLO COC(=O)[C@H](C)[N@H+](C)Cc1ccc2sc3ccccc3c2c1 ZINC001237201560 1055404267 /nfs/dbraw/zinc/40/42/67/1055404267.db2.gz YKDZWOGSMYYKIH-LBPRGKRZSA-N 1 2 313.422 4.048 20 0 DIADLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccc2sc3ccccc3c2c1 ZINC001237201560 1055404269 /nfs/dbraw/zinc/40/42/69/1055404269.db2.gz YKDZWOGSMYYKIH-LBPRGKRZSA-N 1 2 313.422 4.048 20 0 DIADLO C[N@@H+](Cc1cc(O)cc(F)c1)Cc1ccc(Cl)cc1Cl ZINC001237285051 1055416038 /nfs/dbraw/zinc/41/60/38/1055416038.db2.gz MJJCIVXBPRQZNE-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO Oc1cc(F)cc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c1 ZINC001237276340 1055416510 /nfs/dbraw/zinc/41/65/10/1055416510.db2.gz BMZVVGYCEWSVEG-KRWDZBQOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)cc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)c1 ZINC001237276340 1055416516 /nfs/dbraw/zinc/41/65/16/1055416516.db2.gz BMZVVGYCEWSVEG-KRWDZBQOSA-N 1 2 307.315 4.147 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc4ccccc4c3)cc2[nH+]1 ZINC000010896039 1055419746 /nfs/dbraw/zinc/41/97/46/1055419746.db2.gz DGLSRLCVBQPFIW-UHFFFAOYSA-N 1 2 301.349 4.277 20 0 DIADLO COc1ccc(-c2ccccc2)c(C[N@@H+]2Cc3cccnc3C2)c1 ZINC001237314974 1055424835 /nfs/dbraw/zinc/42/48/35/1055424835.db2.gz YIJZUKWVFXEKRT-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccc(-c2ccccc2)c(C[N@H+]2Cc3cccnc3C2)c1 ZINC001237314974 1055424838 /nfs/dbraw/zinc/42/48/38/1055424838.db2.gz YIJZUKWVFXEKRT-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccc(-c2nc(C[N@@H+]3CCCC[C@@H](F)C3)cs2)cc1 ZINC001237336512 1055431739 /nfs/dbraw/zinc/43/17/39/1055431739.db2.gz RGVIXCSOHDDYQX-CQSZACIVSA-N 1 2 320.433 4.143 20 0 DIADLO COc1ccc(-c2nc(C[N@H+]3CCCC[C@@H](F)C3)cs2)cc1 ZINC001237336512 1055431746 /nfs/dbraw/zinc/43/17/46/1055431746.db2.gz RGVIXCSOHDDYQX-CQSZACIVSA-N 1 2 320.433 4.143 20 0 DIADLO CC(C)c1ccc([C@@H](Nc2[nH+]cnc3c2cnn3C)C(C)C)cc1 ZINC000014267646 1055433212 /nfs/dbraw/zinc/43/32/12/1055433212.db2.gz PELHHBZXYFKATJ-KRWDZBQOSA-N 1 2 323.444 4.296 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(Cl)nc(C(F)(F)F)c2)C2(CC2)C1 ZINC001237500870 1055461721 /nfs/dbraw/zinc/46/17/21/1055461721.db2.gz KIUFTMFGKRBZRA-SECBINFHSA-N 1 2 304.743 4.128 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(Cl)nc(C(F)(F)F)c2)C2(CC2)C1 ZINC001237500870 1055461723 /nfs/dbraw/zinc/46/17/23/1055461723.db2.gz KIUFTMFGKRBZRA-SECBINFHSA-N 1 2 304.743 4.128 20 0 DIADLO F[C@@H]1CCC[N@H+](Cc2cc(Cl)nc(C(F)(F)F)c2)CC1 ZINC001237493068 1055462494 /nfs/dbraw/zinc/46/24/94/1055462494.db2.gz ZYNLBHJROAHUOA-SNVBAGLBSA-N 1 2 310.722 4.078 20 0 DIADLO F[C@@H]1CCC[N@@H+](Cc2cc(Cl)nc(C(F)(F)F)c2)CC1 ZINC001237493068 1055462496 /nfs/dbraw/zinc/46/24/96/1055462496.db2.gz ZYNLBHJROAHUOA-SNVBAGLBSA-N 1 2 310.722 4.078 20 0 DIADLO O=c1[nH]c2ccccc2c(Cl)c1C[NH+]1Cc2ccccc2C1 ZINC001237503367 1055465085 /nfs/dbraw/zinc/46/50/85/1055465085.db2.gz HVCINMVOHBHRHG-UHFFFAOYSA-N 1 2 310.784 4.110 20 0 DIADLO Cc1cc(C[N@@H+](C)C2CC(F)(F)C2)c(Br)cc1F ZINC001237505838 1055465338 /nfs/dbraw/zinc/46/53/38/1055465338.db2.gz MVEPCENZXFLQBI-UHFFFAOYSA-N 1 2 322.168 4.126 20 0 DIADLO Cc1cc(C[N@H+](C)C2CC(F)(F)C2)c(Br)cc1F ZINC001237505838 1055465345 /nfs/dbraw/zinc/46/53/45/1055465345.db2.gz MVEPCENZXFLQBI-UHFFFAOYSA-N 1 2 322.168 4.126 20 0 DIADLO Fc1cc(NCc2cscc2Cl)ccc1-n1cc[nH+]c1 ZINC001620849021 1055476961 /nfs/dbraw/zinc/47/69/61/1055476961.db2.gz KKOIRZAENNGWRT-UHFFFAOYSA-N 1 2 307.781 4.338 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccc3ccc(F)c(F)c3n2)cc1 ZINC001620852659 1055480628 /nfs/dbraw/zinc/48/06/28/1055480628.db2.gz FHSZDRYMDAHICS-UHFFFAOYSA-N 1 2 313.351 4.191 20 0 DIADLO Fc1cc(Cl)c(C[N@@H+]2CC[C@]3(C2)CCCCO3)c(Cl)c1 ZINC001237594096 1055481884 /nfs/dbraw/zinc/48/18/84/1055481884.db2.gz RUXQLCSWQYENKA-HNNXBMFYSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1cc(Cl)c(C[N@H+]2CC[C@]3(C2)CCCCO3)c(Cl)c1 ZINC001237594096 1055481895 /nfs/dbraw/zinc/48/18/95/1055481895.db2.gz RUXQLCSWQYENKA-HNNXBMFYSA-N 1 2 318.219 4.278 20 0 DIADLO CCn1c[nH+]cc1CN(C)Cc1sc2ccccc2c1Cl ZINC001237597462 1055482263 /nfs/dbraw/zinc/48/22/63/1055482263.db2.gz QQJNQCFDYREMRF-UHFFFAOYSA-N 1 2 319.861 4.403 20 0 DIADLO Cc1cc(NCc2scnc2C2CC2)ccc1-n1cc[nH+]c1 ZINC001620853837 1055482824 /nfs/dbraw/zinc/48/28/24/1055482824.db2.gz CVBJYLZJSOOKKY-UHFFFAOYSA-N 1 2 310.426 4.127 20 0 DIADLO CCCO[C@H]1CC[N@H+](Cc2c(Cl)cc(F)cc2Cl)C1 ZINC001237597275 1055482937 /nfs/dbraw/zinc/48/29/37/1055482937.db2.gz QDSFTJDLPUQEBJ-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@H]1CC[N@@H+](Cc2c(Cl)cc(F)cc2Cl)C1 ZINC001237597275 1055482943 /nfs/dbraw/zinc/48/29/43/1055482943.db2.gz QDSFTJDLPUQEBJ-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C3(F)CCCCC3)cc2)[nH+]c1C ZINC001589436839 1055485422 /nfs/dbraw/zinc/48/54/22/1055485422.db2.gz HKCDJWXTBVUIDQ-UHFFFAOYSA-N 1 2 315.392 4.304 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+]C(C)(C)c1nc(C)cs1 ZINC000172078974 1055498704 /nfs/dbraw/zinc/49/87/04/1055498704.db2.gz GCVGXAJPSIZZDD-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO Cc1cc(C[NH+]2CC(c3cccnc3)C2)c(Cl)cc1Cl ZINC001237700654 1055506364 /nfs/dbraw/zinc/50/63/64/1055506364.db2.gz XIXZTZTVKZSWTO-UHFFFAOYSA-N 1 2 307.224 4.296 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)Nc1cccc2[nH+]ccn21 ZINC001538058684 1055514758 /nfs/dbraw/zinc/51/47/58/1055514758.db2.gz SWAQOHVWBFPIEJ-CABCVRRESA-N 1 2 319.408 4.262 20 0 DIADLO Cc1ccc(C(=O)Nc2cccc3[nH+]ccn32)c(Cl)c1Cl ZINC001538058417 1055515074 /nfs/dbraw/zinc/51/50/74/1055515074.db2.gz MKSIEHMIXYCRPE-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO Cc1cc2cc(C[NH2+][C@@H](C)c3nnc(C(C)C)[nH]3)oc2cc1C ZINC001620890676 1055515446 /nfs/dbraw/zinc/51/54/46/1055515446.db2.gz XOEFEOHBSSPHAS-ZDUSSCGKSA-N 1 2 312.417 4.142 20 0 DIADLO CCc1cc(C[NH+]2CC3(C2)CC(F)(F)CS3)ccc1Cl ZINC001237738545 1055517860 /nfs/dbraw/zinc/51/78/60/1055517860.db2.gz FCVMEUAAXROUIZ-UHFFFAOYSA-N 1 2 317.832 4.229 20 0 DIADLO CCc1cc(C[N@@H+]2CCC(=O)[C@@H]3CCCC[C@@H]32)ccc1Cl ZINC001237739433 1055519339 /nfs/dbraw/zinc/51/93/39/1055519339.db2.gz YGSPELGQUQLDAI-WBVHZDCISA-N 1 2 305.849 4.236 20 0 DIADLO CCc1cc(C[N@H+]2CCC(=O)[C@@H]3CCCC[C@@H]32)ccc1Cl ZINC001237739433 1055519354 /nfs/dbraw/zinc/51/93/54/1055519354.db2.gz YGSPELGQUQLDAI-WBVHZDCISA-N 1 2 305.849 4.236 20 0 DIADLO Clc1ccc(-c2nc(C[NH+]3CC4(CCC4)C3)cs2)cc1 ZINC001237764811 1055524916 /nfs/dbraw/zinc/52/49/16/1055524916.db2.gz MWZBARRGTCSPBI-UHFFFAOYSA-N 1 2 304.846 4.449 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c(Cl)n1 ZINC001237798151 1055531802 /nfs/dbraw/zinc/53/18/02/1055531802.db2.gz GOSSAZWWLBOZGY-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c(Cl)n1 ZINC001237798151 1055531810 /nfs/dbraw/zinc/53/18/10/1055531810.db2.gz GOSSAZWWLBOZGY-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1c(Cl)cncc1Cl ZINC001620908932 1055533538 /nfs/dbraw/zinc/53/35/38/1055533538.db2.gz SNBQPACREYSDRP-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO CCc1ncc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)s1 ZINC001237830314 1055539224 /nfs/dbraw/zinc/53/92/24/1055539224.db2.gz IRIXUTOJDIRHDA-HNNXBMFYSA-N 1 2 308.397 4.321 20 0 DIADLO CCc1ncc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)s1 ZINC001237830314 1055539232 /nfs/dbraw/zinc/53/92/32/1055539232.db2.gz IRIXUTOJDIRHDA-HNNXBMFYSA-N 1 2 308.397 4.321 20 0 DIADLO CCCOc1cc(F)ccc1C[N@H+](C)Cc1ccc(Cl)nc1 ZINC001237910423 1055557833 /nfs/dbraw/zinc/55/78/33/1055557833.db2.gz NYXYINZYPCEKQJ-UHFFFAOYSA-N 1 2 322.811 4.295 20 0 DIADLO CCCOc1cc(F)ccc1C[N@@H+](C)Cc1ccc(Cl)nc1 ZINC001237910423 1055557838 /nfs/dbraw/zinc/55/78/38/1055557838.db2.gz NYXYINZYPCEKQJ-UHFFFAOYSA-N 1 2 322.811 4.295 20 0 DIADLO Clc1cccc(Br)c1C[NH+]1CC2(CCC2)C1 ZINC001137810079 1055558160 /nfs/dbraw/zinc/55/81/60/1055558160.db2.gz VSMQOZKKYOKIEC-UHFFFAOYSA-N 1 2 300.627 4.088 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(F)c(O)c(Cl)c2)CCC1(F)F ZINC001237984923 1055572721 /nfs/dbraw/zinc/57/27/21/1055572721.db2.gz SCSWLALCKOAUDD-SECBINFHSA-N 1 2 307.743 4.052 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(F)c(O)c(Cl)c2)CCC1(F)F ZINC001237984923 1055572735 /nfs/dbraw/zinc/57/27/35/1055572735.db2.gz SCSWLALCKOAUDD-SECBINFHSA-N 1 2 307.743 4.052 20 0 DIADLO C[N@@H+](C/C=C/c1ccccc1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237994063 1055575923 /nfs/dbraw/zinc/57/59/23/1055575923.db2.gz BEEAWTCEMDXJSO-VMPITWQZSA-N 1 2 305.780 4.330 20 0 DIADLO Oc1c(F)cc(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)cc1Cl ZINC001237992972 1055576758 /nfs/dbraw/zinc/57/67/58/1055576758.db2.gz NZLFEKKFKMHIGP-GFCCVEGCSA-N 1 2 315.791 4.289 20 0 DIADLO Oc1c(F)cc(C[N@@H+](Cc2ccccc2)C2CC2)cc1Cl ZINC001237992578 1055577392 /nfs/dbraw/zinc/57/73/92/1055577392.db2.gz MIFYYBGZAATBBA-UHFFFAOYSA-N 1 2 305.780 4.349 20 0 DIADLO C[N@@H+](Cc1cccc(Cl)c1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237990844 1055578130 /nfs/dbraw/zinc/57/81/30/1055578130.db2.gz ZJJAMXWISHMBAC-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1cc(F)c(O)c(Cl)c1 ZINC001237998772 1055580504 /nfs/dbraw/zinc/58/05/04/1055580504.db2.gz WSAGLLQFFRTTBB-NSHDSACASA-N 1 2 323.795 4.386 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1cc(F)c(O)c(Cl)c1 ZINC001237998772 1055580515 /nfs/dbraw/zinc/58/05/15/1055580515.db2.gz WSAGLLQFFRTTBB-NSHDSACASA-N 1 2 323.795 4.386 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001238003476 1055580911 /nfs/dbraw/zinc/58/09/11/1055580911.db2.gz ICKCQFZJPNOFNG-CHWSQXEVSA-N 1 2 303.837 4.228 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[N@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001238003476 1055580921 /nfs/dbraw/zinc/58/09/21/1055580921.db2.gz ICKCQFZJPNOFNG-CHWSQXEVSA-N 1 2 303.837 4.228 20 0 DIADLO Cc1[nH]c2ccc(C[NH2+]Cc3nc(C(C)(C)C)co3)cc2c1C ZINC000921595003 1055581470 /nfs/dbraw/zinc/58/14/70/1055581470.db2.gz JFSGEJFLSHJHBB-UHFFFAOYSA-N 1 2 311.429 4.360 20 0 DIADLO Cc1cccc(CC[N@@H+](C)Cc2cc(F)c(O)c(Cl)c2)c1 ZINC001237998254 1055581834 /nfs/dbraw/zinc/58/18/34/1055581834.db2.gz SHSNDKJGUOXRAQ-UHFFFAOYSA-N 1 2 307.796 4.168 20 0 DIADLO Cc1cccc(CC[N@H+](C)Cc2cc(F)c(O)c(Cl)c2)c1 ZINC001237998254 1055581844 /nfs/dbraw/zinc/58/18/44/1055581844.db2.gz SHSNDKJGUOXRAQ-UHFFFAOYSA-N 1 2 307.796 4.168 20 0 DIADLO C[N@H+](Cc1scnc1Br)[C@H]1CCc2ccccc21 ZINC001238039366 1055591588 /nfs/dbraw/zinc/59/15/88/1055591588.db2.gz OBXTZDOMZZRLCX-LBPRGKRZSA-N 1 2 323.259 4.025 20 0 DIADLO C[N@@H+](Cc1scnc1Br)[C@H]1CCc2ccccc21 ZINC001238039366 1055591602 /nfs/dbraw/zinc/59/16/02/1055591602.db2.gz OBXTZDOMZZRLCX-LBPRGKRZSA-N 1 2 323.259 4.025 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1cccc2c1CCCC2 ZINC001595395724 1055594121 /nfs/dbraw/zinc/59/41/21/1055594121.db2.gz OAYDAEMQWPIMNA-UHFFFAOYSA-N 1 2 317.392 4.003 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@@H](F)CC2)c(F)c1Br ZINC001238079029 1055603784 /nfs/dbraw/zinc/60/37/84/1055603784.db2.gz UCFDPTAZKCUCBF-SNVBAGLBSA-N 1 2 322.168 4.051 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@@H](F)CC2)c(F)c1Br ZINC001238079029 1055603790 /nfs/dbraw/zinc/60/37/90/1055603790.db2.gz UCFDPTAZKCUCBF-SNVBAGLBSA-N 1 2 322.168 4.051 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2cccc(-c3cccs3)n2)C[C@H]1F ZINC001238211861 1055620834 /nfs/dbraw/zinc/62/08/34/1055620834.db2.gz SVJWYHHZZSQIEW-HZPDHXFCSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2cccc(-c3cccs3)n2)C[C@H]1F ZINC001238211861 1055620842 /nfs/dbraw/zinc/62/08/42/1055620842.db2.gz SVJWYHHZZSQIEW-HZPDHXFCSA-N 1 2 308.397 4.082 20 0 DIADLO CCc1cc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)sc1C ZINC000029918881 1055624923 /nfs/dbraw/zinc/62/49/23/1055624923.db2.gz KRKVBFWQUZENHU-UHFFFAOYSA-N 1 2 311.410 4.057 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@H+](C)Cc2ccco2)c(Cl)c1 ZINC000030277019 1055626464 /nfs/dbraw/zinc/62/64/64/1055626464.db2.gz WQWWPWFICJHCLG-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@@H+](C)Cc2ccco2)c(Cl)c1 ZINC000030277019 1055626465 /nfs/dbraw/zinc/62/64/65/1055626465.db2.gz WQWWPWFICJHCLG-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Fc1ccccc1C1CC[NH+](Cc2c(F)ccnc2Cl)CC1 ZINC001238232294 1055627654 /nfs/dbraw/zinc/62/76/54/1055627654.db2.gz ONNDYYUGYILTOH-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@H](F)CC2)c(F)c1C(F)(F)F ZINC001238244576 1055629552 /nfs/dbraw/zinc/62/95/52/1055629552.db2.gz ZVKABZVAKVNOOP-JTQLQIEISA-N 1 2 311.269 4.308 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@H](F)CC2)c(F)c1C(F)(F)F ZINC001238244576 1055629558 /nfs/dbraw/zinc/62/95/58/1055629558.db2.gz ZVKABZVAKVNOOP-JTQLQIEISA-N 1 2 311.269 4.308 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1c(Br)ccc(O)c1F ZINC001238307708 1055638523 /nfs/dbraw/zinc/63/85/23/1055638523.db2.gz GFNJCHFMINOGCV-JTQLQIEISA-N 1 2 316.214 4.058 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1c(Br)ccc(O)c1F ZINC001238307708 1055638527 /nfs/dbraw/zinc/63/85/27/1055638527.db2.gz GFNJCHFMINOGCV-JTQLQIEISA-N 1 2 316.214 4.058 20 0 DIADLO CC(C)Oc1c(F)cccc1C[N@H+](Cc1ccco1)C1CC1 ZINC001238322348 1055638675 /nfs/dbraw/zinc/63/86/75/1055638675.db2.gz KDFNEKNNNMBEMI-UHFFFAOYSA-N 1 2 303.377 4.371 20 0 DIADLO CC(C)Oc1c(F)cccc1C[N@@H+](Cc1ccco1)C1CC1 ZINC001238322348 1055638678 /nfs/dbraw/zinc/63/86/78/1055638678.db2.gz KDFNEKNNNMBEMI-UHFFFAOYSA-N 1 2 303.377 4.371 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@@H+]1CCCC(F)(F)CC1 ZINC001238335172 1055641311 /nfs/dbraw/zinc/64/13/11/1055641311.db2.gz OQLBOZLLJGSJQP-UHFFFAOYSA-N 1 2 307.743 4.109 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@H+]1CCCC(F)(F)CC1 ZINC001238335172 1055641315 /nfs/dbraw/zinc/64/13/15/1055641315.db2.gz OQLBOZLLJGSJQP-UHFFFAOYSA-N 1 2 307.743 4.109 20 0 DIADLO COc1cc(C[N@H+]2CC=C(c3ccccc3)CC2)c(Cl)cn1 ZINC001238353061 1055643486 /nfs/dbraw/zinc/64/34/86/1055643486.db2.gz CEOMPLSWLHHTNL-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1cc(C[N@@H+]2CC=C(c3ccccc3)CC2)c(Cl)cn1 ZINC001238353061 1055643493 /nfs/dbraw/zinc/64/34/93/1055643493.db2.gz CEOMPLSWLHHTNL-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@@H](F)C2)cc(OCc2ccccc2)c1 ZINC001238385899 1055648617 /nfs/dbraw/zinc/64/86/17/1055648617.db2.gz GEEXRANFLQVNFY-QGZVFWFLSA-N 1 2 317.379 4.339 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@@H](F)C2)cc(OCc2ccccc2)c1 ZINC001238385899 1055648621 /nfs/dbraw/zinc/64/86/21/1055648621.db2.gz GEEXRANFLQVNFY-QGZVFWFLSA-N 1 2 317.379 4.339 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(F)cc2F)cnc1OC(C)C ZINC001238388069 1055648695 /nfs/dbraw/zinc/64/86/95/1055648695.db2.gz VWSOQBMLEXDDHG-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(F)cc2F)cnc1OC(C)C ZINC001238388069 1055648700 /nfs/dbraw/zinc/64/87/00/1055648700.db2.gz VWSOQBMLEXDDHG-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ccnc(Br)c2Cl)[C@H]1C ZINC001238377704 1055649346 /nfs/dbraw/zinc/64/93/46/1055649346.db2.gz QSDTWHITLDGSSM-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ccnc(Br)c2Cl)[C@H]1C ZINC001238377704 1055649352 /nfs/dbraw/zinc/64/93/52/1055649352.db2.gz QSDTWHITLDGSSM-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[N@@H+](Cc1c(F)c(Cl)c(F)cc1Br)CC1CC1 ZINC001238403711 1055653133 /nfs/dbraw/zinc/65/31/33/1055653133.db2.gz PKPZRPIMOBPLQR-UHFFFAOYSA-N 1 2 324.596 4.223 20 0 DIADLO C[N@H+](Cc1c(F)c(Cl)c(F)cc1Br)CC1CC1 ZINC001238403711 1055653140 /nfs/dbraw/zinc/65/31/40/1055653140.db2.gz PKPZRPIMOBPLQR-UHFFFAOYSA-N 1 2 324.596 4.223 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3ncc(C)cc3C2)c(Cl)c1 ZINC001238404928 1055653673 /nfs/dbraw/zinc/65/36/73/1055653673.db2.gz KHVPHJFVIAAWDC-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3ncc(C)cc3C2)c(Cl)c1 ZINC001238404928 1055653674 /nfs/dbraw/zinc/65/36/74/1055653674.db2.gz KHVPHJFVIAAWDC-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2ccccc2C(F)(F)F)n1 ZINC000921620524 1055655021 /nfs/dbraw/zinc/65/50/21/1055655021.db2.gz ISEFCWPEYVXDEE-UHFFFAOYSA-N 1 2 312.335 4.281 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+]2CCc3sccc3C2)c1F ZINC001238423434 1055656154 /nfs/dbraw/zinc/65/61/54/1055656154.db2.gz KBZPTOYRFNNJOW-UHFFFAOYSA-N 1 2 305.418 4.233 20 0 DIADLO CC(C)Oc1cccc(C[N@H+]2CCc3sccc3C2)c1F ZINC001238423434 1055656158 /nfs/dbraw/zinc/65/61/58/1055656158.db2.gz KBZPTOYRFNNJOW-UHFFFAOYSA-N 1 2 305.418 4.233 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1ccc(F)c(F)c1OC ZINC001238471797 1055665162 /nfs/dbraw/zinc/66/51/62/1055665162.db2.gz GKGSEHBDXMIJOA-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1ccc(F)c(F)c1OC ZINC001238471797 1055665170 /nfs/dbraw/zinc/66/51/70/1055665170.db2.gz GKGSEHBDXMIJOA-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO Fc1ccc(C[N@@H+]2CCCC(F)(F)[C@@H](F)C2)cc1C1CC1 ZINC001238497339 1055673274 /nfs/dbraw/zinc/67/32/74/1055673274.db2.gz CYDMKZHSFCTDCP-HNNXBMFYSA-N 1 2 301.327 4.272 20 0 DIADLO Fc1ccc(C[N@H+]2CCCC(F)(F)[C@@H](F)C2)cc1C1CC1 ZINC001238497339 1055673279 /nfs/dbraw/zinc/67/32/79/1055673279.db2.gz CYDMKZHSFCTDCP-HNNXBMFYSA-N 1 2 301.327 4.272 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc(F)c(OC(C)C)c2F)cn1 ZINC001238537400 1055682575 /nfs/dbraw/zinc/68/25/75/1055682575.db2.gz SMFNRKAJORKYKQ-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc(F)c(OC(C)C)c2F)cn1 ZINC001238537400 1055682583 /nfs/dbraw/zinc/68/25/83/1055682583.db2.gz SMFNRKAJORKYKQ-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO Cc1cnc(-c2ccccc2)c(C[N@@H+]2CCC(F)(F)[C@H](F)C2)c1 ZINC001238615927 1055696454 /nfs/dbraw/zinc/69/64/54/1055696454.db2.gz ACAQCHGEFKHOMN-MRXNPFEDSA-N 1 2 320.358 4.236 20 0 DIADLO Cc1cnc(-c2ccccc2)c(C[N@H+]2CCC(F)(F)[C@H](F)C2)c1 ZINC001238615927 1055696459 /nfs/dbraw/zinc/69/64/59/1055696459.db2.gz ACAQCHGEFKHOMN-MRXNPFEDSA-N 1 2 320.358 4.236 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cccc(F)c2F)cnc1C1CC1 ZINC001238620667 1055702278 /nfs/dbraw/zinc/70/22/78/1055702278.db2.gz ALZDSDVXZFXYOD-UHFFFAOYSA-N 1 2 302.368 4.178 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cccc(F)c2F)cnc1C1CC1 ZINC001238620667 1055702290 /nfs/dbraw/zinc/70/22/90/1055702290.db2.gz ALZDSDVXZFXYOD-UHFFFAOYSA-N 1 2 302.368 4.178 20 0 DIADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cc(-c2ccccc2)ncc1Cl ZINC001238625727 1055704775 /nfs/dbraw/zinc/70/47/75/1055704775.db2.gz ZRNWGHGCCGMZHK-DOMZBBRYSA-N 1 2 304.796 4.334 20 0 DIADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cc(-c2ccccc2)ncc1Cl ZINC001238625727 1055704785 /nfs/dbraw/zinc/70/47/85/1055704785.db2.gz ZRNWGHGCCGMZHK-DOMZBBRYSA-N 1 2 304.796 4.334 20 0 DIADLO CC[N@H+](C)Cc1c(F)ccc(C(F)(F)F)c1Br ZINC001238634248 1055706628 /nfs/dbraw/zinc/70/66/28/1055706628.db2.gz SKLJINOAHBOEAB-UHFFFAOYSA-N 1 2 314.120 4.059 20 0 DIADLO CC[N@@H+](C)Cc1c(F)ccc(C(F)(F)F)c1Br ZINC001238634248 1055706640 /nfs/dbraw/zinc/70/66/40/1055706640.db2.gz SKLJINOAHBOEAB-UHFFFAOYSA-N 1 2 314.120 4.059 20 0 DIADLO Fc1ncc(-c2ccccc2)cc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC001238658422 1055712250 /nfs/dbraw/zinc/71/22/50/1055712250.db2.gz NWMBSGXMIKLXMP-UHFFFAOYSA-N 1 2 318.342 4.119 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000044736381 1055713381 /nfs/dbraw/zinc/71/33/81/1055713381.db2.gz BHRUAFQHNJVLQI-SFHVURJKSA-N 1 2 317.429 4.121 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000044736381 1055713392 /nfs/dbraw/zinc/71/33/92/1055713392.db2.gz BHRUAFQHNJVLQI-SFHVURJKSA-N 1 2 317.429 4.121 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C3(c4cccc(F)c4)CCC3)cc2[nH+]1 ZINC000044685934 1055713721 /nfs/dbraw/zinc/71/37/21/1055713721.db2.gz BBDWWSLCJMGMTO-UHFFFAOYSA-N 1 2 323.371 4.071 20 0 DIADLO CSc1ccc(Cl)cc1C[N@@H+]1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001238672429 1055714857 /nfs/dbraw/zinc/71/48/57/1055714857.db2.gz QRHLILXVYQPXDF-GJZGRUSLSA-N 1 2 323.889 4.396 20 0 DIADLO CSc1ccc(Cl)cc1C[N@H+]1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001238672429 1055714870 /nfs/dbraw/zinc/71/48/70/1055714870.db2.gz QRHLILXVYQPXDF-GJZGRUSLSA-N 1 2 323.889 4.396 20 0 DIADLO CC(C)c1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)c(Cl)n1 ZINC001238729907 1055733500 /nfs/dbraw/zinc/73/35/00/1055733500.db2.gz YQQWVNQHXZZFBQ-LLVKDONJSA-N 1 2 306.759 4.243 20 0 DIADLO CC1(C)CCC[C@H](OC(=O)c2cccc(Cn3cc[nH+]c3)c2)C1 ZINC001596571847 1055724496 /nfs/dbraw/zinc/72/44/96/1055724496.db2.gz GCIJWELQPDILNJ-KRWDZBQOSA-N 1 2 312.413 4.057 20 0 DIADLO CCCCCCc1ccc(C[N@@H+]2CCc3ncncc3C2)s1 ZINC001238703539 1055726338 /nfs/dbraw/zinc/72/63/38/1055726338.db2.gz PEBNFKQPDWADBZ-UHFFFAOYSA-N 1 2 315.486 4.219 20 0 DIADLO CCCCCCc1ccc(C[N@H+]2CCc3ncncc3C2)s1 ZINC001238703539 1055726347 /nfs/dbraw/zinc/72/63/47/1055726347.db2.gz PEBNFKQPDWADBZ-UHFFFAOYSA-N 1 2 315.486 4.219 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1F)Cc1cc(C)cnc1SC ZINC001238720436 1055732234 /nfs/dbraw/zinc/73/22/34/1055732234.db2.gz LMSSFWMQLICKOM-UHFFFAOYSA-N 1 2 322.424 4.412 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1F)Cc1cc(C)cnc1SC ZINC001238720436 1055732247 /nfs/dbraw/zinc/73/22/47/1055732247.db2.gz LMSSFWMQLICKOM-UHFFFAOYSA-N 1 2 322.424 4.412 20 0 DIADLO CC(C)c1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)c(Cl)n1 ZINC001238729907 1055733488 /nfs/dbraw/zinc/73/34/88/1055733488.db2.gz YQQWVNQHXZZFBQ-LLVKDONJSA-N 1 2 306.759 4.243 20 0 DIADLO Cc1c2ccccc2oc1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000046105589 1055734844 /nfs/dbraw/zinc/73/48/44/1055734844.db2.gz URWGBOKDQPDVGH-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO CC(C)c1ccc(C[N@H+](C)CCOc2ccccc2)c(Cl)n1 ZINC001238727745 1055735476 /nfs/dbraw/zinc/73/54/76/1055735476.db2.gz MHXVVZVRMILXOU-UHFFFAOYSA-N 1 2 318.848 4.369 20 0 DIADLO CC(C)c1ccc(C[N@@H+](C)CCOc2ccccc2)c(Cl)n1 ZINC001238727745 1055735488 /nfs/dbraw/zinc/73/54/88/1055735488.db2.gz MHXVVZVRMILXOU-UHFFFAOYSA-N 1 2 318.848 4.369 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc(F)cc3cccnc32)no1 ZINC000046511318 1055739605 /nfs/dbraw/zinc/73/96/05/1055739605.db2.gz YDSDUPRJIRAZHU-KRWDZBQOSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc(F)cc3cccnc32)no1 ZINC000046511318 1055739619 /nfs/dbraw/zinc/73/96/19/1055739619.db2.gz YDSDUPRJIRAZHU-KRWDZBQOSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc(F)c(F)c2OC(C)C)cn1 ZINC001238748224 1055740017 /nfs/dbraw/zinc/74/00/17/1055740017.db2.gz RHOJXRFNPPIDOV-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc(F)c(F)c2OC(C)C)cn1 ZINC001238748224 1055740026 /nfs/dbraw/zinc/74/00/26/1055740026.db2.gz RHOJXRFNPPIDOV-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO Cc1cc(C[N@@H+]2CCC(F)(F)[C@H](F)C2)cc(C)c1OC(C)C ZINC001238753628 1055741785 /nfs/dbraw/zinc/74/17/85/1055741785.db2.gz OKEOYXNNRGRWQI-OAHLLOKOSA-N 1 2 315.379 4.270 20 0 DIADLO Cc1cc(C[N@H+]2CCC(F)(F)[C@H](F)C2)cc(C)c1OC(C)C ZINC001238753628 1055741791 /nfs/dbraw/zinc/74/17/91/1055741791.db2.gz OKEOYXNNRGRWQI-OAHLLOKOSA-N 1 2 315.379 4.270 20 0 DIADLO Cc1cc(OC(C)C)ncc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001238825073 1055754774 /nfs/dbraw/zinc/75/47/74/1055754774.db2.gz DLDYYDLJKMEEHQ-UHFFFAOYSA-N 1 2 307.397 4.245 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cnc(OC(C)C)cc1C ZINC001238828063 1055756693 /nfs/dbraw/zinc/75/66/93/1055756693.db2.gz CBJZEUJJQRPRSA-UHFFFAOYSA-N 1 2 323.396 4.039 20 0 DIADLO Cc1cc(OCc2ccccc2)ncc1-c1cccc2[nH+]ccn21 ZINC001238871552 1055775735 /nfs/dbraw/zinc/77/57/35/1055775735.db2.gz YOVIRIGXCMXUBV-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO CCOc1ccc(Cl)cc1C[NH2+][C@@H](C)c1nc(C)cs1 ZINC001649055025 1055777350 /nfs/dbraw/zinc/77/73/50/1055777350.db2.gz VVORBOHBPTWUGV-NSHDSACASA-N 1 2 310.850 4.354 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2coc(-c3cccs3)n2)oc1C ZINC000282191699 1055782943 /nfs/dbraw/zinc/78/29/43/1055782943.db2.gz NKDWTRLLNDMIDN-LLVKDONJSA-N 1 2 302.399 4.464 20 0 DIADLO CC(C)CCCC(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC001597107137 1055788269 /nfs/dbraw/zinc/78/82/69/1055788269.db2.gz ITAUKMPIMNSKFW-CQSZACIVSA-N 1 2 323.506 4.140 20 0 DIADLO CC(C)CCCC(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC001597107137 1055788277 /nfs/dbraw/zinc/78/82/77/1055788277.db2.gz ITAUKMPIMNSKFW-CQSZACIVSA-N 1 2 323.506 4.140 20 0 DIADLO CCOc1cc(C)c(-c2c[nH+]c(N3CCCCC3)cc2C)cn1 ZINC001238976627 1055810437 /nfs/dbraw/zinc/81/04/37/1055810437.db2.gz KYAKYYLGUBNLTN-UHFFFAOYSA-N 1 2 311.429 4.149 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cccc(C(F)(F)F)c1)CC2 ZINC000060042467 1055828340 /nfs/dbraw/zinc/82/83/40/1055828340.db2.gz ROMPJMNHYHAERY-UHFFFAOYSA-N 1 2 321.342 4.272 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cccc(C(F)(F)F)c1)CC2 ZINC000060042467 1055828349 /nfs/dbraw/zinc/82/83/49/1055828349.db2.gz ROMPJMNHYHAERY-UHFFFAOYSA-N 1 2 321.342 4.272 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](Cc2ccccc2)c2ccccc2)o1 ZINC000060378791 1055835965 /nfs/dbraw/zinc/83/59/65/1055835965.db2.gz WAKJUIKSBVRLDC-GOSISDBHSA-N 1 2 321.424 4.267 20 0 DIADLO Cc1[nH+]c(-c2cc(Cl)cnc2OC(C)C)cc2[nH]ccc21 ZINC001239313410 1055866032 /nfs/dbraw/zinc/86/60/32/1055866032.db2.gz VQGAGODGIRNAGX-UHFFFAOYSA-N 1 2 301.777 4.374 20 0 DIADLO COc1ccc(C)cc1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000061556228 1055867760 /nfs/dbraw/zinc/86/77/60/1055867760.db2.gz KUTMLOHAPLSFKM-HXUWFJFHSA-N 1 2 307.393 4.476 20 0 DIADLO CNc1ccc(Nc2cc(C(F)(F)F)ccc2C(C)=O)c[nH+]1 ZINC001203459750 1055868420 /nfs/dbraw/zinc/86/84/20/1055868420.db2.gz QQTUZPGMXRMTBC-UHFFFAOYSA-N 1 2 309.291 4.088 20 0 DIADLO CC(C)C[C@H](C(=O)N1CC[C@H](C(C)(C)C)C[C@H]1C)n1cc[nH+]c1 ZINC001569936054 1055878238 /nfs/dbraw/zinc/87/82/38/1055878238.db2.gz GFWMBCZFWGNMLV-IXDOHACOSA-N 1 2 319.493 4.144 20 0 DIADLO Cc1cc(CNC(=O)C[C@@H]2C[C@H](C)CC(C)(C)C2)cc(C)[nH+]1 ZINC001597956375 1055897252 /nfs/dbraw/zinc/89/72/52/1055897252.db2.gz VNLWJOCFDGWLTN-BBRMVZONSA-N 1 2 302.462 4.167 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@@H]1CCCC[C@H]1C1CC1 ZINC001598071070 1055910445 /nfs/dbraw/zinc/91/04/45/1055910445.db2.gz AXBHEBZTIPYZTI-DLBZAZTESA-N 1 2 309.413 4.232 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2ccccc2-c2ccccc2)cc1 ZINC001239506701 1055918242 /nfs/dbraw/zinc/91/82/42/1055918242.db2.gz JIBATWQRSPWGEK-HXUWFJFHSA-N 1 2 317.388 4.193 20 0 DIADLO CS[C@@H]1CC[C@H]1[NH2+][C@H](CCC(C)(C)C)C(=O)OC(C)(C)C ZINC001621343530 1055927311 /nfs/dbraw/zinc/92/73/11/1055927311.db2.gz RKRJREDZMCTVKO-MGPQQGTHSA-N 1 2 315.523 4.007 20 0 DIADLO Fc1ccc(C[NH2+]Cc2csc(-c3cccs3)n2)c(F)c1 ZINC001620755044 1055927511 /nfs/dbraw/zinc/92/75/11/1055927511.db2.gz LYVLNBBASTVOAZ-UHFFFAOYSA-N 1 2 322.405 4.440 20 0 DIADLO CCc1cnc(C[N@H+](C)C[C@@H]2CC[C@@H](c3ccccc3)O2)s1 ZINC001615743777 1055932731 /nfs/dbraw/zinc/93/27/31/1055932731.db2.gz HBYXFWUJXCCKNQ-RDJZCZTQSA-N 1 2 316.470 4.058 20 0 DIADLO CCc1cnc(C[N@@H+](C)C[C@@H]2CC[C@@H](c3ccccc3)O2)s1 ZINC001615743777 1055932743 /nfs/dbraw/zinc/93/27/43/1055932743.db2.gz HBYXFWUJXCCKNQ-RDJZCZTQSA-N 1 2 316.470 4.058 20 0 DIADLO CCn1ccnc1C[NH2+]Cc1ccccc1Oc1ccc(C)cc1 ZINC001620780609 1055947884 /nfs/dbraw/zinc/94/78/84/1055947884.db2.gz UDOMSPRSNKOMGO-UHFFFAOYSA-N 1 2 321.424 4.294 20 0 DIADLO Fc1cccc(C(F)(F)C[NH2+]Cc2cccc3ncccc23)c1 ZINC001620998034 1055967994 /nfs/dbraw/zinc/96/79/94/1055967994.db2.gz IOQJWSUSSLKBQE-UHFFFAOYSA-N 1 2 316.326 4.256 20 0 DIADLO CCc1cc(C)cc(CC)c1-c1ccc(C[NH+]2CCOCC2)nc1 ZINC001239591083 1055968172 /nfs/dbraw/zinc/96/81/72/1055968172.db2.gz ZAOVSTHHHCESLG-UHFFFAOYSA-N 1 2 324.468 4.014 20 0 DIADLO Clc1cc2c(c(CNc3c[nH+]cc4c3CCCC4)c1)OCC2 ZINC001621004466 1055973077 /nfs/dbraw/zinc/97/30/77/1055973077.db2.gz YFNOLYFHEDAEDZ-UHFFFAOYSA-N 1 2 314.816 4.161 20 0 DIADLO CNc1ccc(C)cc1C[NH2+][C@H](CCc1ccccc1)C(F)F ZINC001621006669 1055974165 /nfs/dbraw/zinc/97/41/65/1055974165.db2.gz QFGUBGLEFVQIMK-GOSISDBHSA-N 1 2 318.411 4.393 20 0 DIADLO CCCSc1nnc([C@H](C)[NH+](C)C)n1-c1ccc(Cl)cc1 ZINC000066316777 1055977079 /nfs/dbraw/zinc/97/70/79/1055977079.db2.gz RYHNFQAPVMKBKP-NSHDSACASA-N 1 2 324.881 4.045 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc4ccccc4c3)CCCCC2)no1 ZINC000066376587 1055977843 /nfs/dbraw/zinc/97/78/43/1055977843.db2.gz YKHRLKVQEJXGNC-UHFFFAOYSA-N 1 2 321.424 4.480 20 0 DIADLO CC(C)(C)OC(=O)c1ccccc1C[NH2+]Cc1ccc(Cl)o1 ZINC001621022209 1055989138 /nfs/dbraw/zinc/98/91/38/1055989138.db2.gz NLUUQMMIYXFBDI-UHFFFAOYSA-N 1 2 321.804 4.178 20 0 DIADLO C[C@@H]([NH2+]Cc1cn(Cc2ccccc2)c2ccccc12)C(F)F ZINC001621045840 1056007363 /nfs/dbraw/zinc/00/73/63/1056007363.db2.gz JQDQSOJQAFYCFG-CQSZACIVSA-N 1 2 314.379 4.433 20 0 DIADLO Cn1ncc(CNc2[nH+]c3ccccc3n2C(C)(C)C)c1C1CC1 ZINC001621051060 1056009833 /nfs/dbraw/zinc/00/98/33/1056009833.db2.gz MDGRCSQWNLLESK-UHFFFAOYSA-N 1 2 323.444 4.014 20 0 DIADLO Cc1ccc(CNc2[nH]c3ccc(Br)cc3[nH+]2)cc1 ZINC001621051893 1056010348 /nfs/dbraw/zinc/01/03/48/1056010348.db2.gz XJOVBQROYNFQBW-UHFFFAOYSA-N 1 2 316.202 4.246 20 0 DIADLO Cc1ccc(CNc2[nH]c3cc(Br)ccc3[nH+]2)cc1 ZINC001621051893 1056010359 /nfs/dbraw/zinc/01/03/59/1056010359.db2.gz XJOVBQROYNFQBW-UHFFFAOYSA-N 1 2 316.202 4.246 20 0 DIADLO Cc1ccc(NC(=O)[C@H]2CC[C@@H](Nc3cccc[nH+]3)CC2)cc1C ZINC001540328501 1056017300 /nfs/dbraw/zinc/01/73/00/1056017300.db2.gz YNDGYWXDDPGWIA-CALCHBBNSA-N 1 2 323.440 4.308 20 0 DIADLO Cc1noc(C[N@@H+]([C@H](C)c2ccc3ccccc3c2)C2CC2)n1 ZINC000070694152 1056024434 /nfs/dbraw/zinc/02/44/34/1056024434.db2.gz HJCDTGGYWFMWBZ-CYBMUJFWSA-N 1 2 307.397 4.257 20 0 DIADLO Cc1noc(C[N@H+]([C@H](C)c2ccc3ccccc3c2)C2CC2)n1 ZINC000070694152 1056024446 /nfs/dbraw/zinc/02/44/46/1056024446.db2.gz HJCDTGGYWFMWBZ-CYBMUJFWSA-N 1 2 307.397 4.257 20 0 DIADLO Cc1ccc(C(=O)Nc2ccn3cc[nH+]c3c2)c2ccccc12 ZINC001583151295 1056029975 /nfs/dbraw/zinc/02/99/75/1056029975.db2.gz UNUKHRYNAQYURV-UHFFFAOYSA-N 1 2 301.349 4.048 20 0 DIADLO CC[C@@H](CC1CCCC1)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001583228323 1056043223 /nfs/dbraw/zinc/04/32/23/1056043223.db2.gz ATSNVNSJPKTJFL-HNNXBMFYSA-N 1 2 303.450 4.001 20 0 DIADLO Cc1cc(-c2cncc(Oc3ccccc3)c2)c2[nH+]ccn2c1 ZINC001239751185 1056056532 /nfs/dbraw/zinc/05/65/32/1056056532.db2.gz DFQZDTONGRTIME-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)[C@@H]1CCC[C@H]2CCCC[C@@H]21 ZINC001540719894 1056067159 /nfs/dbraw/zinc/06/71/59/1056067159.db2.gz ZETNSYYZAMWYLE-IXDOHACOSA-N 1 2 323.440 4.417 20 0 DIADLO CC[C@H](CC(C)C)C(=O)N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC001611051914 1056101298 /nfs/dbraw/zinc/10/12/98/1056101298.db2.gz FNVBSBRPNDNLLY-JKSUJKDBSA-N 1 2 313.445 4.122 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccnc2ccccc21 ZINC001239855039 1056109338 /nfs/dbraw/zinc/10/93/38/1056109338.db2.gz KDXWZHOYJJYPEF-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001542254433 1056113822 /nfs/dbraw/zinc/11/38/22/1056113822.db2.gz UTORQMLWTCYSPJ-LBPRGKRZSA-N 1 2 319.364 4.109 20 0 DIADLO Cc1ccc(-c2ccc(C[NH+]3CCOCC3)cc2F)c(Cl)c1 ZINC001239863528 1056115590 /nfs/dbraw/zinc/11/55/90/1056115590.db2.gz FSYTXNGZLZKQLA-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO Cc1cc(NC(=O)C[C@H]2CCCC[C@@H]2C)ccc1-n1cc[nH+]c1 ZINC001542875780 1056160089 /nfs/dbraw/zinc/16/00/89/1056160089.db2.gz TYZGVQAVTGDVSL-GOEBONIOSA-N 1 2 311.429 4.336 20 0 DIADLO Cc1cc(NC(=O)[C@H]2CCCC[C@H]2C2CC2)ccc1-n1cc[nH+]c1 ZINC001542877428 1056162081 /nfs/dbraw/zinc/16/20/81/1056162081.db2.gz VUCCHIHSSVPUIV-ROUUACIJSA-N 1 2 323.440 4.336 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2CCCC[C@H]2C2CC2)ccc1-n1cc[nH+]c1 ZINC001542877429 1056163087 /nfs/dbraw/zinc/16/30/87/1056163087.db2.gz VUCCHIHSSVPUIV-ZWKOTPCHSA-N 1 2 323.440 4.336 20 0 DIADLO CC[C@H](CC(F)F)C(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1 ZINC000921656139 1056167349 /nfs/dbraw/zinc/16/73/49/1056167349.db2.gz LQVHOZVKMAXFMM-GFCCVEGCSA-N 1 2 321.371 4.313 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccsc1Cl ZINC001583786767 1056168025 /nfs/dbraw/zinc/16/80/25/1056168025.db2.gz IZSZTNCGCQLJLP-UHFFFAOYSA-N 1 2 303.774 4.044 20 0 DIADLO CSCC(C)(C)C(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1 ZINC000921658087 1056168810 /nfs/dbraw/zinc/16/88/10/1056168810.db2.gz LBKZKGALYWEAEH-UHFFFAOYSA-N 1 2 317.458 4.021 20 0 DIADLO Cc1ccc([C@H](C)C(=O)Nc2ccc(-c3[nH]c(C)c(C)[nH+]3)cc2)o1 ZINC000921660020 1056169413 /nfs/dbraw/zinc/16/94/13/1056169413.db2.gz IFVNXHGOWAFXHR-LBPRGKRZSA-N 1 2 323.396 4.337 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cc(Cl)cc2cccnc21 ZINC000090207815 1056170782 /nfs/dbraw/zinc/17/07/82/1056170782.db2.gz NGQKOLYABHPDCZ-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO CNc1ccc(Nc2ccc(C(F)(F)F)c(F)c2F)c[nH+]1 ZINC001203462267 1056177723 /nfs/dbraw/zinc/17/77/23/1056177723.db2.gz NFUNYTGVWGTRPJ-UHFFFAOYSA-N 1 2 303.234 4.164 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C3(C)CC(F)(F)C3)cc2)[nH+]c1C ZINC000921671272 1056181147 /nfs/dbraw/zinc/18/11/47/1056181147.db2.gz VDMLJLNOBYEJFS-UHFFFAOYSA-N 1 2 319.355 4.067 20 0 DIADLO CCC(C)(C)C1CCC(NC(=O)C(C)(C)n2c[nH+]c(C)c2)CC1 ZINC001543164136 1056183174 /nfs/dbraw/zinc/18/31/74/1056183174.db2.gz PBJSTPAMFHWWSD-UHFFFAOYSA-N 1 2 319.493 4.038 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2ccc(OCC(F)(F)F)nc2)cc1 ZINC001239956325 1056191979 /nfs/dbraw/zinc/19/19/79/1056191979.db2.gz UYBOHDBYCDHVSZ-UHFFFAOYSA-N 1 2 324.302 4.052 20 0 DIADLO CCOc1ccc2cc(-c3ccn4cc(N)[nH+]c4c3)ccc2c1 ZINC001239956658 1056193752 /nfs/dbraw/zinc/19/37/52/1056193752.db2.gz DXAATQYJBOQDNI-UHFFFAOYSA-N 1 2 303.365 4.135 20 0 DIADLO Fc1ccc(OCc2ccccc2)c(-c2cc[nH+]c3c2CCN3)c1 ZINC001239983084 1056220887 /nfs/dbraw/zinc/22/08/87/1056220887.db2.gz HNNCWWOYYQRFLP-UHFFFAOYSA-N 1 2 320.367 4.435 20 0 DIADLO Cc1nc(N2CC[C@H](c3ccccc3)[C@@H](C)C2)c2c([nH+]1)CCCC2 ZINC001612036262 1056225589 /nfs/dbraw/zinc/22/55/89/1056225589.db2.gz VKYWNCBRNVJQJM-YJBOKZPZSA-N 1 2 321.468 4.294 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)NCc1[nH+]cc(C)c(OC)c1C ZINC001583975685 1056226245 /nfs/dbraw/zinc/22/62/45/1056226245.db2.gz BFHJJQWWTIHUNP-IBGZPJMESA-N 1 2 320.477 4.320 20 0 DIADLO Cc1nc(N2CC[C@@H](c3ccccc3)[C@H](C)C2)c2c([nH+]1)CCCC2 ZINC001612036259 1056226770 /nfs/dbraw/zinc/22/67/70/1056226770.db2.gz VKYWNCBRNVJQJM-CRAIPNDOSA-N 1 2 321.468 4.294 20 0 DIADLO CCCCNC(=O)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001239988216 1056227080 /nfs/dbraw/zinc/22/70/80/1056227080.db2.gz LMJAAXYKTITSEY-UHFFFAOYSA-N 1 2 319.408 4.274 20 0 DIADLO Cc1cc(NC[C@H](C)c2nc3ccccc3s2)nc(C2CC2)[nH+]1 ZINC001612114395 1056241174 /nfs/dbraw/zinc/24/11/74/1056241174.db2.gz GPDZCTWYDAHWRY-NSHDSACASA-N 1 2 324.453 4.488 20 0 DIADLO Cc1nc(N[C@@H](C)[C@H](C)c2ccccc2C(F)(F)F)cc[nH+]1 ZINC001612148805 1056245761 /nfs/dbraw/zinc/24/57/61/1056245761.db2.gz IWSGACIJMAENAL-QWRGUYRKSA-N 1 2 309.335 4.408 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(N2CCCCC2)cc1 ZINC001240014158 1056254008 /nfs/dbraw/zinc/25/40/08/1056254008.db2.gz WNWZQFXITTXVKD-UHFFFAOYSA-N 1 2 307.397 4.000 20 0 DIADLO COC1CCC(CCNc2cc(C)[nH+]c(C3CCC3)n2)CC1 ZINC001612231040 1056258676 /nfs/dbraw/zinc/25/86/76/1056258676.db2.gz DMFROSRHMNMNSO-UHFFFAOYSA-N 1 2 303.450 4.060 20 0 DIADLO Cc1nc(NCC2CC(c3ccccc3)C2)c2c([nH+]1)CCCC2 ZINC001612294728 1056267598 /nfs/dbraw/zinc/26/75/98/1056267598.db2.gz QBHGVZJCMPJCCN-UHFFFAOYSA-N 1 2 307.441 4.270 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cc(F)cc3[nH]ccc32)cc1F ZINC001240042442 1056276001 /nfs/dbraw/zinc/27/60/01/1056276001.db2.gz KYLBHFWTJOPQGU-UHFFFAOYSA-N 1 2 304.315 4.314 20 0 DIADLO O=C(Nc1ccccc1)c1ccc(-c2ccc3[nH+]ccn3c2)cc1 ZINC001240046954 1056281797 /nfs/dbraw/zinc/28/17/97/1056281797.db2.gz HBXCLUWNHIKHEK-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO Cc1nc(N2CC(c3cccc(C(F)(F)F)c3)C2)c(C)c(C)[nH+]1 ZINC001612378454 1056282178 /nfs/dbraw/zinc/28/21/78/1056282178.db2.gz PZQGQMJPFSANTB-UHFFFAOYSA-N 1 2 321.346 4.024 20 0 DIADLO CC[C@H](CNc1nc(C)[nH+]c2c1CCCC2)CC(F)(F)F ZINC001612497649 1056296401 /nfs/dbraw/zinc/29/64/01/1056296401.db2.gz TZIGPPVYMSXGPN-NSHDSACASA-N 1 2 301.356 4.054 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C[C@@H](C)c1ccc(C(C)C)cc1 ZINC001584250196 1056297566 /nfs/dbraw/zinc/29/75/66/1056297566.db2.gz HCKXASFASLDKQT-CQSZACIVSA-N 1 2 310.441 4.376 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1ccc(-c2ccccc2)cc1 ZINC001584251520 1056300584 /nfs/dbraw/zinc/30/05/84/1056300584.db2.gz PAQHVQJVPQEZIC-UHFFFAOYSA-N 1 2 302.377 4.040 20 0 DIADLO CC(C)c1cc(N[C@@H](C2CC2)[C@@H]2CCCCO2)nc(C(C)C)[nH+]1 ZINC001612549149 1056304046 /nfs/dbraw/zinc/30/40/46/1056304046.db2.gz WUAFJPORLMRTMZ-WMZOPIPTSA-N 1 2 317.477 4.483 20 0 DIADLO c1ccc2c(c1)NCC[C@@H]2Nc1cc(-c2ccncc2)cc[nH+]1 ZINC001168640232 1056309636 /nfs/dbraw/zinc/30/96/36/1056309636.db2.gz XQNYNIMFCMQINH-SFHVURJKSA-N 1 2 302.381 4.112 20 0 DIADLO CCc1cc(N[C@H]2C[C@H](Sc3ccccc3)C2)nc(CC)[nH+]1 ZINC001612678790 1056319325 /nfs/dbraw/zinc/31/93/25/1056319325.db2.gz RIMVTEDVXNQEMU-KOMQPUFPSA-N 1 2 313.470 4.337 20 0 DIADLO C[C@H]([NH2+][C@@H](COCc1ccccc1)c1ccccc1)c1ncc[nH]1 ZINC000353535495 1056328713 /nfs/dbraw/zinc/32/87/13/1056328713.db2.gz WDFZNUWMIQQQQJ-LPHOPBHVSA-N 1 2 321.424 4.018 20 0 DIADLO c1ccc2c(c1)NCC[C@@H]2Nc1cccc(Cc2ccncc2)[nH+]1 ZINC001168645883 1056343162 /nfs/dbraw/zinc/34/31/62/1056343162.db2.gz NJSRTCUNFYKCFN-IBGZPJMESA-N 1 2 316.408 4.036 20 0 DIADLO Cc1ccc(C)c(C(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)c1 ZINC001544050118 1056351579 /nfs/dbraw/zinc/35/15/79/1056351579.db2.gz IOSUWWBQHMQDHO-UHFFFAOYSA-N 1 2 319.408 4.170 20 0 DIADLO Cc1cc(N)nc(SCc2ccc(-c3cccs3)cc2)[nH+]1 ZINC001613370573 1056372627 /nfs/dbraw/zinc/37/26/27/1056372627.db2.gz RITFTFPNYJGBJS-UHFFFAOYSA-N 1 2 313.451 4.388 20 0 DIADLO CC(C)(C)OC(=O)c1ccc(-c2ccc3[nH+]ccn3c2)cc1F ZINC001240219527 1056375462 /nfs/dbraw/zinc/37/54/62/1056375462.db2.gz MAMRLUZELCUSFK-UHFFFAOYSA-N 1 2 312.344 4.096 20 0 DIADLO c1cn2cc(-c3nc(-c4ccccn4)nc4ccccc43)ccc2[nH+]1 ZINC001240216889 1056376099 /nfs/dbraw/zinc/37/60/99/1056376099.db2.gz QRSSCXMUDKZKMD-UHFFFAOYSA-N 1 2 323.359 4.007 20 0 DIADLO c1cn2cc(-c3nc(-c4cccnc4)nc4ccccc43)ccc2[nH+]1 ZINC001240216922 1056377128 /nfs/dbraw/zinc/37/71/28/1056377128.db2.gz SIWOTMBFPPQBID-UHFFFAOYSA-N 1 2 323.359 4.007 20 0 DIADLO C[N@H+](Cc1noc2c1CCCC2)Cc1ccccc1C(F)(F)F ZINC000108851847 1056377787 /nfs/dbraw/zinc/37/77/87/1056377787.db2.gz DPRHGIDDWBZDPT-UHFFFAOYSA-N 1 2 324.346 4.204 20 0 DIADLO C[N@@H+](Cc1noc2c1CCCC2)Cc1ccccc1C(F)(F)F ZINC000108851847 1056377806 /nfs/dbraw/zinc/37/78/06/1056377806.db2.gz DPRHGIDDWBZDPT-UHFFFAOYSA-N 1 2 324.346 4.204 20 0 DIADLO Cc1ccccc1SCc1cccc(C[NH+]2CCOCC2)c1 ZINC001613494080 1056384244 /nfs/dbraw/zinc/38/42/44/1056384244.db2.gz OVGGOTOXEMGXRG-UHFFFAOYSA-N 1 2 313.466 4.120 20 0 DIADLO COc1cccc2[nH+]c(N[C@@H]3CCCc4cccnc43)ccc21 ZINC001168655106 1056388973 /nfs/dbraw/zinc/38/89/73/1056388973.db2.gz CFQMMUVQXFVOLJ-MRXNPFEDSA-N 1 2 305.381 4.128 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccsc1C(F)F ZINC001544349947 1056411345 /nfs/dbraw/zinc/41/13/45/1056411345.db2.gz HAHMZQGISBQRSE-UHFFFAOYSA-N 1 2 319.336 4.328 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1cccn1C(F)F ZINC001621170658 1056424615 /nfs/dbraw/zinc/42/46/15/1056424615.db2.gz VEWDEBLYAIARLP-SNVBAGLBSA-N 1 2 300.299 4.354 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cccn1C(F)F ZINC001621170658 1056424618 /nfs/dbraw/zinc/42/46/18/1056424618.db2.gz VEWDEBLYAIARLP-SNVBAGLBSA-N 1 2 300.299 4.354 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cccc(CNC(C)=O)c2)c1 ZINC001240353419 1056444227 /nfs/dbraw/zinc/44/42/27/1056444227.db2.gz DWSAMMIRTDLUHJ-UHFFFAOYSA-N 1 2 310.441 4.144 20 0 DIADLO C[C@@H]1CC(C)(C)c2cccc(NC(=O)c3cccc4[nH+]ccn43)c21 ZINC001584947747 1056448215 /nfs/dbraw/zinc/44/82/15/1056448215.db2.gz PTTDUEXFWRZSCZ-CYBMUJFWSA-N 1 2 319.408 4.371 20 0 DIADLO Cc1cc(NC(=O)C2[C@H]3CCCCCC[C@H]23)ccc1-n1cc[nH+]c1 ZINC001584952855 1056449523 /nfs/dbraw/zinc/44/95/23/1056449523.db2.gz LEHCEHWXJAEZJC-IRXDYDNUSA-N 1 2 323.440 4.336 20 0 DIADLO c1cnc2c(c1)CCC[C@H]2Nc1cc2c3c(c1)CCC[NH+]3CCC2 ZINC001168660581 1056455676 /nfs/dbraw/zinc/45/56/76/1056455676.db2.gz GJLFNZCMORZKSX-LJQANCHMSA-N 1 2 319.452 4.270 20 0 DIADLO Cc1cc(NC(=O)C2C[C@@H](C)C[C@H](C)C2)ccc1-n1cc[nH+]c1 ZINC001614884215 1056455889 /nfs/dbraw/zinc/45/58/89/1056455889.db2.gz QIISMCFROGHEFR-KBPBESRZSA-N 1 2 311.429 4.192 20 0 DIADLO O=C(C=C1CCCC1)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001544566889 1056458312 /nfs/dbraw/zinc/45/83/12/1056458312.db2.gz DLDAAZCZOKACRG-UHFFFAOYSA-N 1 2 322.408 4.292 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2cc(C)cnc2Cl)sc1C ZINC000921760459 1056464914 /nfs/dbraw/zinc/46/49/14/1056464914.db2.gz HWJNZJPOZZVABJ-UHFFFAOYSA-N 1 2 309.866 4.142 20 0 DIADLO COc1ccccc1Cc1cn(CCCCC(F)(F)F)c[nH+]1 ZINC001615064344 1056466333 /nfs/dbraw/zinc/46/63/33/1056466333.db2.gz MCVXYPHPXWKEBP-UHFFFAOYSA-N 1 2 312.335 4.215 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccc(OC(F)(F)F)cc2)no1 ZINC000172621113 1056474511 /nfs/dbraw/zinc/47/45/11/1056474511.db2.gz XQQXQUASSJTFJT-NSHDSACASA-N 1 2 314.307 4.075 20 0 DIADLO Cc1cc(C[N@H+](C)[C@@H](C)c2ccc(OC(F)(F)F)cc2)no1 ZINC000172621113 1056474525 /nfs/dbraw/zinc/47/45/25/1056474525.db2.gz XQQXQUASSJTFJT-NSHDSACASA-N 1 2 314.307 4.075 20 0 DIADLO COCC[N@H+](Cc1ccc(C)cc1C)Cc1ncccc1Cl ZINC001615303551 1056488867 /nfs/dbraw/zinc/48/88/67/1056488867.db2.gz RTDSACCVHRKTNA-UHFFFAOYSA-N 1 2 318.848 4.000 20 0 DIADLO COCC[N@@H+](Cc1ccc(C)cc1C)Cc1ncccc1Cl ZINC001615303551 1056488873 /nfs/dbraw/zinc/48/88/73/1056488873.db2.gz RTDSACCVHRKTNA-UHFFFAOYSA-N 1 2 318.848 4.000 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2c(Cl)n[nH]c2C2CC2)on1 ZINC000921786954 1056491107 /nfs/dbraw/zinc/49/11/07/1056491107.db2.gz WJIQOPDDNPJKAK-UHFFFAOYSA-N 1 2 322.840 4.122 20 0 DIADLO CCCC[N@H+](CC(=O)NCC(C)(C)C)Cc1ccccc1Cl ZINC001615391933 1056504087 /nfs/dbraw/zinc/50/40/87/1056504087.db2.gz FOPQSGXRQZLCJK-UHFFFAOYSA-N 1 2 324.896 4.104 20 0 DIADLO CCCC[N@@H+](CC(=O)NCC(C)(C)C)Cc1ccccc1Cl ZINC001615391933 1056504101 /nfs/dbraw/zinc/50/41/01/1056504101.db2.gz FOPQSGXRQZLCJK-UHFFFAOYSA-N 1 2 324.896 4.104 20 0 DIADLO COc1ccc(F)c(F)c1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001240437080 1056507853 /nfs/dbraw/zinc/50/78/53/1056507853.db2.gz WCUPEQOKXYJOHP-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO C[C@@H]([NH2+]Cc1ccnn1C1CCC1)c1c(F)cccc1Cl ZINC000921808703 1056510554 /nfs/dbraw/zinc/51/05/54/1056510554.db2.gz CSBWZAPXNLHNBY-LLVKDONJSA-N 1 2 307.800 4.251 20 0 DIADLO Fc1cccc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)n1 ZINC001615469251 1056517994 /nfs/dbraw/zinc/51/79/94/1056517994.db2.gz IZZNNHYTSQKDFJ-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)n1 ZINC001615469251 1056518000 /nfs/dbraw/zinc/51/80/00/1056518000.db2.gz IZZNNHYTSQKDFJ-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO Cc1cn[nH]c1C[N@@H+]1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC001615520062 1056527774 /nfs/dbraw/zinc/52/77/74/1056527774.db2.gz QFCASCILYOOBNE-KRWDZBQOSA-N 1 2 303.837 4.489 20 0 DIADLO Cc1cn[nH]c1C[N@H+]1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC001615520062 1056527790 /nfs/dbraw/zinc/52/77/90/1056527790.db2.gz QFCASCILYOOBNE-KRWDZBQOSA-N 1 2 303.837 4.489 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@@H+]2CC/C=C/c2ccccc2)o1 ZINC001615583686 1056539775 /nfs/dbraw/zinc/53/97/75/1056539775.db2.gz NJUBWQWEBUBSPG-IUYMFKLXSA-N 1 2 311.425 4.319 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@H+]2CC/C=C/c2ccccc2)o1 ZINC001615583686 1056539785 /nfs/dbraw/zinc/53/97/85/1056539785.db2.gz NJUBWQWEBUBSPG-IUYMFKLXSA-N 1 2 311.425 4.319 20 0 DIADLO Fc1ccc(Oc2cccc(-c3ccn4cc[nH+]c4c3)n2)cc1 ZINC001240503985 1056541813 /nfs/dbraw/zinc/54/18/13/1056541813.db2.gz JNEJITGWFQHLHW-UHFFFAOYSA-N 1 2 305.312 4.328 20 0 DIADLO CC(C)C[C@@H](C(=O)N1CCCC[C@H]1CC1CCC1)n1cc[nH+]c1 ZINC001585376828 1056542055 /nfs/dbraw/zinc/54/20/55/1056542055.db2.gz WIXHRSWMYBVSFH-ROUUACIJSA-N 1 2 317.477 4.042 20 0 DIADLO Fc1ccccc1COc1cccnc1-c1ccn2cc[nH+]c2c1 ZINC001240503989 1056542408 /nfs/dbraw/zinc/54/24/08/1056542408.db2.gz JSLBFOFSEGXSGB-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO COC(=O)c1cc2cc(-c3ccn4cc[nH+]c4c3)ccc2s1 ZINC001240508557 1056543452 /nfs/dbraw/zinc/54/34/52/1056543452.db2.gz CDNPPLPKLXGGPT-UHFFFAOYSA-N 1 2 308.362 4.003 20 0 DIADLO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cc1ncsc1Br ZINC001615600721 1056543844 /nfs/dbraw/zinc/54/38/44/1056543844.db2.gz NFLKYFVLFSFMKN-ZYHUDNBSSA-N 1 2 317.296 4.306 20 0 DIADLO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1ncsc1Br ZINC001615600721 1056543849 /nfs/dbraw/zinc/54/38/49/1056543849.db2.gz NFLKYFVLFSFMKN-ZYHUDNBSSA-N 1 2 317.296 4.306 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)CC(=O)N[C@@H]1CCCC[C@H]1C ZINC000252096122 1056544028 /nfs/dbraw/zinc/54/40/28/1056544028.db2.gz FMGKGMZNHBEMIE-CKEIUWERSA-N 1 2 322.880 4.028 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)CC(=O)N[C@@H]1CCCC[C@H]1C ZINC000252096122 1056544036 /nfs/dbraw/zinc/54/40/36/1056544036.db2.gz FMGKGMZNHBEMIE-CKEIUWERSA-N 1 2 322.880 4.028 20 0 DIADLO FC(F)Oc1ccccc1C[N@@H+]1CCc2c(Cl)cccc2C1 ZINC001615595831 1056544412 /nfs/dbraw/zinc/54/44/12/1056544412.db2.gz LYLWAXKTEYCMLK-UHFFFAOYSA-N 1 2 323.770 4.500 20 0 DIADLO FC(F)Oc1ccccc1C[N@H+]1CCc2c(Cl)cccc2C1 ZINC001615595831 1056544423 /nfs/dbraw/zinc/54/44/23/1056544423.db2.gz LYLWAXKTEYCMLK-UHFFFAOYSA-N 1 2 323.770 4.500 20 0 DIADLO Cc1cc(N[C@@H](Cc2ccccc2)c2ncco2)nc(C2CC2)[nH+]1 ZINC000656229806 1056555319 /nfs/dbraw/zinc/55/53/19/1056555319.db2.gz DLCCKFMPWKYZPT-INIZCTEOSA-N 1 2 320.396 4.046 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC[C@@H](C)C[C@@H]1c1ccc(C)o1 ZINC001615679223 1056564446 /nfs/dbraw/zinc/56/44/46/1056564446.db2.gz SOYWCTHIGDPNBK-VNQPRFMTSA-N 1 2 307.434 4.093 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CC[C@@H](C)C[C@@H]1c1ccc(C)o1 ZINC001615679223 1056564459 /nfs/dbraw/zinc/56/44/59/1056564459.db2.gz SOYWCTHIGDPNBK-VNQPRFMTSA-N 1 2 307.434 4.093 20 0 DIADLO FC(F)O[C@H]1CCCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000672249935 1056589356 /nfs/dbraw/zinc/58/93/56/1056589356.db2.gz QWYYQFXZNPVNIV-JTQLQIEISA-N 1 2 312.747 4.096 20 0 DIADLO COC[C@H]1CCCCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000672252733 1056592410 /nfs/dbraw/zinc/59/24/10/1056592410.db2.gz LXWWYLQRKXGFSD-ZDUSSCGKSA-N 1 2 304.821 4.141 20 0 DIADLO Clc1cccc2c(N[C@@H]3CCO[C@@H](C4CC4)C3)cc[nH+]c12 ZINC000672251216 1056593475 /nfs/dbraw/zinc/59/34/75/1056593475.db2.gz LWZJRSCHFNTPEI-MLGOLLRUSA-N 1 2 302.805 4.258 20 0 DIADLO Fc1ccc(-c2ccc(N3CCCCC3)nc2)cc1-n1cc[nH+]c1 ZINC001240586203 1056595699 /nfs/dbraw/zinc/59/56/99/1056595699.db2.gz FRLSUCKQIJBVLP-UHFFFAOYSA-N 1 2 322.387 4.064 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(N4CCCC4)cc3)cc2)c[nH+]1 ZINC001240592080 1056599593 /nfs/dbraw/zinc/59/95/93/1056599593.db2.gz SASAZMSOYWDARP-UHFFFAOYSA-N 1 2 303.409 4.199 20 0 DIADLO C[C@H](C(=O)Nc1cccc2ccccc21)[N@H+](C)Cc1ccsc1 ZINC000007927050 1056602153 /nfs/dbraw/zinc/60/21/53/1056602153.db2.gz FJPSEPJRVBAQMB-CQSZACIVSA-N 1 2 324.449 4.360 20 0 DIADLO C[C@H](C(=O)Nc1cccc2ccccc21)[N@@H+](C)Cc1ccsc1 ZINC000007927050 1056602159 /nfs/dbraw/zinc/60/21/59/1056602159.db2.gz FJPSEPJRVBAQMB-CQSZACIVSA-N 1 2 324.449 4.360 20 0 DIADLO Cc1cc(C[N@H+](Cc2cccc(C)c2)Cc2ccccn2)sn1 ZINC001615990279 1056603345 /nfs/dbraw/zinc/60/33/45/1056603345.db2.gz AZDDJKZQGMPXJN-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO Cc1cc(C[N@@H+](Cc2cccc(C)c2)Cc2ccccn2)sn1 ZINC001615990279 1056603353 /nfs/dbraw/zinc/60/33/53/1056603353.db2.gz AZDDJKZQGMPXJN-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO CCCC[N@H+](Cc1occc1C(=O)OC)Cc1ccccc1F ZINC000063755160 1056604717 /nfs/dbraw/zinc/60/47/17/1056604717.db2.gz PTQIHVLTHUURON-UHFFFAOYSA-N 1 2 319.376 4.008 20 0 DIADLO CCCC[N@@H+](Cc1occc1C(=O)OC)Cc1ccccc1F ZINC000063755160 1056604727 /nfs/dbraw/zinc/60/47/27/1056604727.db2.gz PTQIHVLTHUURON-UHFFFAOYSA-N 1 2 319.376 4.008 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@H+]1Cc1nsc2ccccc21 ZINC001616043488 1056609457 /nfs/dbraw/zinc/60/94/57/1056609457.db2.gz YFRDSYKDTAFQLB-ZDUSSCGKSA-N 1 2 310.422 4.252 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1nsc2ccccc21 ZINC001616043488 1056609459 /nfs/dbraw/zinc/60/94/59/1056609459.db2.gz YFRDSYKDTAFQLB-ZDUSSCGKSA-N 1 2 310.422 4.252 20 0 DIADLO CC[C@@H](C)C[C@@H](C)Nc1ccc(C)cc1C[NH+]1CCOCC1 ZINC001168694393 1056609526 /nfs/dbraw/zinc/60/95/26/1056609526.db2.gz PTFHDAXMLXUEJR-NVXWUHKLSA-N 1 2 304.478 4.064 20 0 DIADLO Cc1ccccc1[N@@H+](CC1CCC2(CC1)OCCO2)C(C)C ZINC001616174632 1056616242 /nfs/dbraw/zinc/61/62/42/1056616242.db2.gz TUDBGPVXBOIRSC-UHFFFAOYSA-N 1 2 303.446 4.143 20 0 DIADLO Cc1ccccc1[N@H+](CC1CCC2(CC1)OCCO2)C(C)C ZINC001616174632 1056616251 /nfs/dbraw/zinc/61/62/51/1056616251.db2.gz TUDBGPVXBOIRSC-UHFFFAOYSA-N 1 2 303.446 4.143 20 0 DIADLO COc1cc(-c2ccc(-c3c[nH+]cn3C)cc2)cc(F)c1F ZINC001240661961 1056630167 /nfs/dbraw/zinc/63/01/67/1056630167.db2.gz DTFRIVINNDRAJG-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO Cc1ccc(-c2ncnc3c2C[N@H+](Cc2ccccc2)C3)cc1C ZINC001240700320 1056649322 /nfs/dbraw/zinc/64/93/22/1056649322.db2.gz FRWVEFZYVKSXPV-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1ccc(-c2ncnc3c2C[N@@H+](Cc2ccccc2)C3)cc1C ZINC001240700320 1056649328 /nfs/dbraw/zinc/64/93/28/1056649328.db2.gz FRWVEFZYVKSXPV-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1ccc(OC(F)F)c(C[N@@H+]2CCc3c(F)cccc3C2)c1 ZINC001616402004 1056650317 /nfs/dbraw/zinc/65/03/17/1056650317.db2.gz GZTYZJGYOMSJFH-UHFFFAOYSA-N 1 2 321.342 4.294 20 0 DIADLO Cc1ccc(OC(F)F)c(C[N@H+]2CCc3c(F)cccc3C2)c1 ZINC001616402004 1056650327 /nfs/dbraw/zinc/65/03/27/1056650327.db2.gz GZTYZJGYOMSJFH-UHFFFAOYSA-N 1 2 321.342 4.294 20 0 DIADLO CSc1ccccc1[C@@H](C)NC(=O)c1c(C)cc(C)[nH+]c1C ZINC001586004937 1056654999 /nfs/dbraw/zinc/65/49/99/1056654999.db2.gz SNEHAUSZNILUDD-CYBMUJFWSA-N 1 2 314.454 4.220 20 0 DIADLO CCc1c(C)cc(-c2c[nH+]c(N3CCOCC3)cc2C)cc1C ZINC001240740544 1056672135 /nfs/dbraw/zinc/67/21/35/1056672135.db2.gz DQIBFAQFOLWWRQ-UHFFFAOYSA-N 1 2 310.441 4.073 20 0 DIADLO Cl/C=C(/Cl)C[N@@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000254955594 1056677673 /nfs/dbraw/zinc/67/76/73/1056677673.db2.gz MGSFHLGHFFOGKL-OYGDSYQHSA-N 1 2 311.212 4.326 20 0 DIADLO Cl/C=C(/Cl)C[N@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000254955594 1056677679 /nfs/dbraw/zinc/67/76/79/1056677679.db2.gz MGSFHLGHFFOGKL-OYGDSYQHSA-N 1 2 311.212 4.326 20 0 DIADLO C[C@@H]1c2cc(Cl)c(Cl)cc2CC[N@H+]1CCOCC1CC1 ZINC001616584657 1056683075 /nfs/dbraw/zinc/68/30/75/1056683075.db2.gz RLDAFMJQEAWORU-LLVKDONJSA-N 1 2 314.256 4.339 20 0 DIADLO C[C@@H]1c2cc(Cl)c(Cl)cc2CC[N@@H+]1CCOCC1CC1 ZINC001616584657 1056683077 /nfs/dbraw/zinc/68/30/77/1056683077.db2.gz RLDAFMJQEAWORU-LLVKDONJSA-N 1 2 314.256 4.339 20 0 DIADLO COc1ccc(C(F)(F)F)cc1-c1cccc2[nH+]c(C)cn21 ZINC001240824868 1056720199 /nfs/dbraw/zinc/72/01/99/1056720199.db2.gz RHTHXALWHQKIOX-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@H+]1Cc1ccc2c(c1)CCC2 ZINC001616898454 1056735214 /nfs/dbraw/zinc/73/52/14/1056735214.db2.gz BYTUDEYCWGSVIA-ZDUSSCGKSA-N 1 2 300.833 4.207 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@@H+]1Cc1ccc2c(c1)CCC2 ZINC001616898454 1056735226 /nfs/dbraw/zinc/73/52/26/1056735226.db2.gz BYTUDEYCWGSVIA-ZDUSSCGKSA-N 1 2 300.833 4.207 20 0 DIADLO Cc1cn2c(cccc2-c2ccc(Oc3cccnc3)cc2)[nH+]1 ZINC001240881406 1056737713 /nfs/dbraw/zinc/73/77/13/1056737713.db2.gz DTXQETYOKWHTNC-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+][C@@H]1CCCC1(F)F ZINC000672622450 1056737944 /nfs/dbraw/zinc/73/79/44/1056737944.db2.gz IXBPQFBMJWYZSI-ZWNOBZJWSA-N 1 2 323.412 4.352 20 0 DIADLO COc1ccc2c(c1)[C@@H]([NH2+][C@H]1CCCC1(F)F)CCCS2 ZINC000672619994 1056738324 /nfs/dbraw/zinc/73/83/24/1056738324.db2.gz HHHWJYYGSGZYCR-ZFWWWQNUSA-N 1 2 313.413 4.400 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCC1(F)F)c1ccc(OCC(F)(F)F)cc1 ZINC000672621858 1056740062 /nfs/dbraw/zinc/74/00/62/1056740062.db2.gz MCVLSIOZQICEJF-MFKMUULPSA-N 1 2 323.305 4.466 20 0 DIADLO C[C@@H]1CCCC[C@H]1OCC[N@@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001616935964 1056743474 /nfs/dbraw/zinc/74/34/74/1056743474.db2.gz WDTXECOSDWYHAE-FOIQADDNSA-N 1 2 312.457 4.121 20 0 DIADLO C[C@@H]1CCCC[C@H]1OCC[N@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001616935964 1056743480 /nfs/dbraw/zinc/74/34/80/1056743480.db2.gz WDTXECOSDWYHAE-FOIQADDNSA-N 1 2 312.457 4.121 20 0 DIADLO CCCC[C@H]([NH2+][C@@H](C(=O)OC)c1ccccc1C)C1CCC1 ZINC001617096551 1056775430 /nfs/dbraw/zinc/77/54/30/1056775430.db2.gz QRROPXALNJXYHD-ZWKOTPCHSA-N 1 2 303.446 4.158 20 0 DIADLO CC(C)OC(=O)c1cccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001240947132 1056775485 /nfs/dbraw/zinc/77/54/85/1056775485.db2.gz NMDWDOJWEHMBNL-UHFFFAOYSA-N 1 2 306.365 4.309 20 0 DIADLO CCCC[C@@H]([NH2+][C@@H](C(=O)OC)c1ccccc1C)C1CCC1 ZINC001617096546 1056775558 /nfs/dbraw/zinc/77/55/58/1056775558.db2.gz QRROPXALNJXYHD-QZTJIDSGSA-N 1 2 303.446 4.158 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H]2CCC[C@@H](C(C)C)CC2)c(C)[nH+]1 ZINC001128319219 1056779865 /nfs/dbraw/zinc/77/98/65/1056779865.db2.gz PDFQAEUXLBVJPC-SJORKVTESA-N 1 2 302.462 4.342 20 0 DIADLO C[C@H]1CCCCC[N@@H+]1Cc1ncc(Br)cc1Cl ZINC001617337984 1056817734 /nfs/dbraw/zinc/81/77/34/1056817734.db2.gz CKJUYTLUYORDSA-JTQLQIEISA-N 1 2 317.658 4.262 20 0 DIADLO C[C@H]1CCCCC[N@H+]1Cc1ncc(Br)cc1Cl ZINC001617337984 1056817741 /nfs/dbraw/zinc/81/77/41/1056817741.db2.gz CKJUYTLUYORDSA-JTQLQIEISA-N 1 2 317.658 4.262 20 0 DIADLO C[C@H]1CC[N@H+](Cc2noc(C3CCC3)n2)CC12CCCCC2 ZINC001617382100 1056823486 /nfs/dbraw/zinc/82/34/86/1056823486.db2.gz OVTMXNRPJNCCFV-AWEZNQCLSA-N 1 2 303.450 4.129 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2noc(C3CCC3)n2)CC12CCCCC2 ZINC001617382100 1056823495 /nfs/dbraw/zinc/82/34/95/1056823495.db2.gz OVTMXNRPJNCCFV-AWEZNQCLSA-N 1 2 303.450 4.129 20 0 DIADLO CCOc1cc(F)cc(-c2ccc(-n3cc[nH+]c3)cc2OC)c1 ZINC001241026620 1056827133 /nfs/dbraw/zinc/82/71/33/1056827133.db2.gz LCERSCUFBWTXAI-UHFFFAOYSA-N 1 2 312.344 4.086 20 0 DIADLO COc1ccc2c(c1)OCC[N@H+]([C@H](C)c1ccccc1Cl)C2 ZINC001617498524 1056841491 /nfs/dbraw/zinc/84/14/91/1056841491.db2.gz KQVXDUODGKOGRW-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc2c(c1)OCC[N@@H+]([C@H](C)c1ccccc1Cl)C2 ZINC001617498524 1056841499 /nfs/dbraw/zinc/84/14/99/1056841499.db2.gz KQVXDUODGKOGRW-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO Cc1cc(-c2nc3[nH]ccc3c[nH+]2)ccc1OCc1ccccc1 ZINC001241049394 1056844784 /nfs/dbraw/zinc/84/47/84/1056844784.db2.gz GFGCEBQLFYJQLT-UHFFFAOYSA-N 1 2 315.376 4.464 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC001617531772 1056844683 /nfs/dbraw/zinc/84/46/83/1056844683.db2.gz DSLUZPAYZGRIQK-SFHVURJKSA-N 1 2 319.807 4.419 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC001617531772 1056844697 /nfs/dbraw/zinc/84/46/97/1056844697.db2.gz DSLUZPAYZGRIQK-SFHVURJKSA-N 1 2 319.807 4.419 20 0 DIADLO CCOc1ccc(-c2cc[nH+]c(N(C)C)c2)cc1C(F)(F)F ZINC001241055197 1056852987 /nfs/dbraw/zinc/85/29/87/1056852987.db2.gz RCVOHVYJSLHEQI-UHFFFAOYSA-N 1 2 310.319 4.232 20 0 DIADLO C[C@H]1C[N@@H+]([C@H](c2ccccc2)c2ccc(Cl)cc2)CCO1 ZINC000673064211 1056854258 /nfs/dbraw/zinc/85/42/58/1056854258.db2.gz ZIRPLFMZAAWDOO-KBXCAEBGSA-N 1 2 301.817 4.150 20 0 DIADLO C[C@H]1C[N@H+]([C@H](c2ccccc2)c2ccc(Cl)cc2)CCO1 ZINC000673064211 1056854270 /nfs/dbraw/zinc/85/42/70/1056854270.db2.gz ZIRPLFMZAAWDOO-KBXCAEBGSA-N 1 2 301.817 4.150 20 0 DIADLO CCOc1ccc(F)c(-c2ccc(-c3c[nH+]cn3C)cc2)c1F ZINC001241060786 1056857634 /nfs/dbraw/zinc/85/76/34/1056857634.db2.gz HNUNPYYYABBDIE-UHFFFAOYSA-N 1 2 314.335 4.431 20 0 DIADLO CCN(Cc1c[nH+]c(N(C)C)c2ccccc12)c1cccc(O)c1 ZINC001617675011 1056866941 /nfs/dbraw/zinc/86/69/41/1056866941.db2.gz WLPSDPAXDKOSCS-UHFFFAOYSA-N 1 2 321.424 4.033 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2occc2Br)cn1 ZINC001143128721 1056878085 /nfs/dbraw/zinc/87/80/85/1056878085.db2.gz SGNMIGHUEGVTCN-CQSZACIVSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2occc2Br)cn1 ZINC001143128721 1056878089 /nfs/dbraw/zinc/87/80/89/1056878089.db2.gz SGNMIGHUEGVTCN-CQSZACIVSA-N 1 2 321.218 4.083 20 0 DIADLO CCOc1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc1F ZINC001241089696 1056880592 /nfs/dbraw/zinc/88/05/92/1056880592.db2.gz VYPDCRMXERDWRF-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO COc1ccc(-c2cc[nH+]c(N3CCCC3)c2)cc1C(F)(F)F ZINC001241090583 1056881961 /nfs/dbraw/zinc/88/19/61/1056881961.db2.gz CLSDFVNAAJRILV-UHFFFAOYSA-N 1 2 322.330 4.376 20 0 DIADLO C/C(=C\C=C\[NH3+])c1ccc(OCc2ccccc2)c(F)c1F ZINC001241107070 1056897091 /nfs/dbraw/zinc/89/70/91/1056897091.db2.gz CCKAGKSKWMXOQQ-LRPJOWSMSA-N 1 2 301.336 4.420 20 0 DIADLO CCc1cccc(C[NH2+]C2(c3noc(C)n3)CCCCCC2)c1 ZINC000682530813 1056900637 /nfs/dbraw/zinc/90/06/37/1056900637.db2.gz XSUODWFWSMWALX-UHFFFAOYSA-N 1 2 313.445 4.280 20 0 DIADLO Clc1ccnc(Cl)c1CNc1cccc(-n2cc[nH+]c2)c1 ZINC001621194610 1056901611 /nfs/dbraw/zinc/90/16/11/1056901611.db2.gz ZUXLBWILMRGOLL-UHFFFAOYSA-N 1 2 319.195 4.186 20 0 DIADLO CC(C)(C)Oc1ncccc1-c1ccccc1Cn1cc[nH+]c1 ZINC001241143900 1056923906 /nfs/dbraw/zinc/92/39/06/1056923906.db2.gz YXOZIDPGUMNMNQ-UHFFFAOYSA-N 1 2 307.397 4.171 20 0 DIADLO Clc1sccc1C[NH2+][C@@H]1COc2c1cccc2Cl ZINC000682943940 1056927118 /nfs/dbraw/zinc/92/71/18/1056927118.db2.gz YRGGKBUUHTZDER-LLVKDONJSA-N 1 2 300.210 4.278 20 0 DIADLO Fc1c(-c2ccc(Cn3cc[nH+]c3)cn2)cccc1C(F)(F)F ZINC001241157400 1056932144 /nfs/dbraw/zinc/93/21/44/1056932144.db2.gz HFGTWXNPXDZMEH-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1ncc(-c2cccs2)o1 ZINC000067378856 1056937645 /nfs/dbraw/zinc/93/76/45/1056937645.db2.gz XMKAMKYIXVZHEY-UHFFFAOYSA-N 1 2 304.337 4.177 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1ncc(-c2cccs2)o1 ZINC000067378856 1056937656 /nfs/dbraw/zinc/93/76/56/1056937656.db2.gz XMKAMKYIXVZHEY-UHFFFAOYSA-N 1 2 304.337 4.177 20 0 DIADLO CCOc1cc(-c2ccn3cc[nH+]c3c2)cc(C(F)(F)F)c1 ZINC001241162273 1056938025 /nfs/dbraw/zinc/93/80/25/1056938025.db2.gz CTAIKJVEWKVZLT-UHFFFAOYSA-N 1 2 306.287 4.419 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc(Cl)ccc2Cl)s1 ZINC000693858500 1056940111 /nfs/dbraw/zinc/94/01/11/1056940111.db2.gz YAQLMZSSFCUDRU-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc(Cl)ccc2Cl)s1 ZINC000693858500 1056940119 /nfs/dbraw/zinc/94/01/19/1056940119.db2.gz YAQLMZSSFCUDRU-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO CN1CCC[C@H]([NH2+]Cc2nc(C(C)(C)C)co2)c2ccccc21 ZINC000922166547 1056941502 /nfs/dbraw/zinc/94/15/02/1056941502.db2.gz PUEXPXUBTGIFEI-HNNXBMFYSA-N 1 2 313.445 4.033 20 0 DIADLO Cc1nc2c(cc(-c3cc[nH+]c(N)c3)cc2F)n1C1CCCC1 ZINC001241176932 1056946287 /nfs/dbraw/zinc/94/62/87/1056946287.db2.gz ISQQQACXGIGROI-UHFFFAOYSA-N 1 2 310.376 4.243 20 0 DIADLO CCOc1ccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c(F)c1F ZINC001241176744 1056946608 /nfs/dbraw/zinc/94/66/08/1056946608.db2.gz DLJIHURHMNLXTI-UHFFFAOYSA-N 1 2 318.245 4.027 20 0 DIADLO CCOc1ccc(-c2ccc(-n3cc[nH+]c3)cc2OC)cc1C ZINC001241198249 1056953906 /nfs/dbraw/zinc/95/39/06/1056953906.db2.gz FUNSDFJUWGJYTB-UHFFFAOYSA-N 1 2 308.381 4.255 20 0 DIADLO Fc1cc(-c2ccc(C[NH+]3CCOCC3)cc2F)ccc1Cl ZINC001241232713 1056971625 /nfs/dbraw/zinc/97/16/25/1056971625.db2.gz OQOWWIYSIZLCDV-UHFFFAOYSA-N 1 2 323.770 4.117 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1nc(C(F)(F)F)cc2cc[nH]c21 ZINC001241234968 1056972441 /nfs/dbraw/zinc/97/24/41/1056972441.db2.gz HWOQZUWJWIXJRC-UHFFFAOYSA-N 1 2 320.318 4.018 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1c(F)cc(C(F)(F)F)cc1F ZINC001241243991 1056977656 /nfs/dbraw/zinc/97/76/56/1056977656.db2.gz QSIFOSXIAMHRFP-UHFFFAOYSA-N 1 2 316.273 4.420 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cc(OC(F)(F)F)ccc1F ZINC001241243731 1056977799 /nfs/dbraw/zinc/97/77/99/1056977799.db2.gz ZFKLFZPHVCPVSO-UHFFFAOYSA-N 1 2 314.282 4.161 20 0 DIADLO Cc1ccc(OC(F)(F)F)c(-c2c[nH+]c(N(C)C)cc2C)c1 ZINC001241248348 1056979039 /nfs/dbraw/zinc/97/90/39/1056979039.db2.gz GGMLBRPAKXGDLJ-UHFFFAOYSA-N 1 2 310.319 4.330 20 0 DIADLO CC(C)OC(=O)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001241284855 1056996108 /nfs/dbraw/zinc/99/61/08/1056996108.db2.gz KJNJGNWVIZEJDK-UHFFFAOYSA-N 1 2 306.365 4.309 20 0 DIADLO CCCCOc1cccc(-c2ccc(-n3c[nH+]c(C)c3C)nn2)c1 ZINC001241287972 1056997693 /nfs/dbraw/zinc/99/76/93/1056997693.db2.gz SVBIRTUMXUTHJH-UHFFFAOYSA-N 1 2 322.412 4.125 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)n1 ZINC000922296281 1056999385 /nfs/dbraw/zinc/99/93/85/1056999385.db2.gz CVSHSGZHLGVGJO-AWEZNQCLSA-N 1 2 304.821 4.403 20 0 DIADLO C[C@@H]1[C@H](C)SCC[N@@H+]1Cc1csc(-c2cccs2)n1 ZINC000118414605 1057017714 /nfs/dbraw/zinc/01/77/14/1057017714.db2.gz QJAYFTFCFDSPPB-MNOVXSKESA-N 1 2 310.513 4.197 20 0 DIADLO C[C@@H]1[C@H](C)SCC[N@H+]1Cc1csc(-c2cccs2)n1 ZINC000118414605 1057017718 /nfs/dbraw/zinc/01/77/18/1057017718.db2.gz QJAYFTFCFDSPPB-MNOVXSKESA-N 1 2 310.513 4.197 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(Cl)ccc1F ZINC001241332111 1057017810 /nfs/dbraw/zinc/01/78/10/1057017810.db2.gz GLTWFEOJQLWTLP-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2csc(-c3cccs3)n2)[C@H]1C ZINC000118414615 1057018106 /nfs/dbraw/zinc/01/81/06/1057018106.db2.gz QJAYFTFCFDSPPB-WDEREUQCSA-N 1 2 310.513 4.197 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2csc(-c3cccs3)n2)[C@H]1C ZINC000118414615 1057018111 /nfs/dbraw/zinc/01/81/11/1057018111.db2.gz QJAYFTFCFDSPPB-WDEREUQCSA-N 1 2 310.513 4.197 20 0 DIADLO Fc1ccccc1-c1ccc(C[NH2+][C@@H](c2ncccn2)C2CC2)o1 ZINC000922579243 1057033985 /nfs/dbraw/zinc/03/39/85/1057033985.db2.gz HBACAMGNWSRKDY-GOSISDBHSA-N 1 2 323.371 4.117 20 0 DIADLO Clc1cc(Cl)cc(C[NH2+][C@H](c2ncccn2)C2CC2)c1 ZINC000922581417 1057034671 /nfs/dbraw/zinc/03/46/71/1057034671.db2.gz VCBMTMYFERBLLK-AWEZNQCLSA-N 1 2 308.212 4.024 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@@H](c2ccccn2)C2CC2)n1 ZINC000922581667 1057034733 /nfs/dbraw/zinc/03/47/33/1057034733.db2.gz LJPRMKPMHHAATG-MRXNPFEDSA-N 1 2 301.459 4.077 20 0 DIADLO Fc1ccc(-c2ccc(C[NH2+][C@@H](c3ncccn3)C3CC3)o2)cc1 ZINC000922583206 1057034878 /nfs/dbraw/zinc/03/48/78/1057034878.db2.gz QYSSATZRLAVPGX-GOSISDBHSA-N 1 2 323.371 4.117 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(CO)o1)c1cc(Cl)cc(Cl)c1F ZINC000922669432 1057047473 /nfs/dbraw/zinc/04/74/73/1057047473.db2.gz JSVHGTHAKNVVQS-QMMMGPOBSA-N 1 2 318.175 4.069 20 0 DIADLO CC[N@H+](Cc1ncc(Cl)n1C)[C@H](C)c1cc2ccccc2o1 ZINC000140686237 1057052545 /nfs/dbraw/zinc/05/25/45/1057052545.db2.gz GTKYBHSNIFOZPT-GFCCVEGCSA-N 1 2 317.820 4.403 20 0 DIADLO CC[N@@H+](Cc1ncc(Cl)n1C)[C@H](C)c1cc2ccccc2o1 ZINC000140686237 1057052550 /nfs/dbraw/zinc/05/25/50/1057052550.db2.gz GTKYBHSNIFOZPT-GFCCVEGCSA-N 1 2 317.820 4.403 20 0 DIADLO C[C@@H](Oc1ccccc1NCc1c[nH+]cn1C)c1ccccc1 ZINC000347749194 1057065108 /nfs/dbraw/zinc/06/51/08/1057065108.db2.gz ADBYZZCZWLFOLF-OAHLLOKOSA-N 1 2 307.397 4.172 20 0 DIADLO Brc1cnccc1C[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000625079763 1057085158 /nfs/dbraw/zinc/08/51/58/1057085158.db2.gz JKLYYEHCEMLYDR-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cnccc1C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000625079763 1057085165 /nfs/dbraw/zinc/08/51/65/1057085165.db2.gz JKLYYEHCEMLYDR-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO CCC[N@H+](Cc1noc(C2CCC2)n1)[C@H]1CCc2ccccc21 ZINC000625113644 1057089777 /nfs/dbraw/zinc/08/97/77/1057089777.db2.gz PFJBPMMZTGNBGP-KRWDZBQOSA-N 1 2 311.429 4.237 20 0 DIADLO CCC[N@@H+](Cc1noc(C2CCC2)n1)[C@H]1CCc2ccccc21 ZINC000625113644 1057089781 /nfs/dbraw/zinc/08/97/81/1057089781.db2.gz PFJBPMMZTGNBGP-KRWDZBQOSA-N 1 2 311.429 4.237 20 0 DIADLO Cc1[nH+]cn(-c2ccc(/C=C/c3ccc(Cl)cc3)nn2)c1C ZINC001241587559 1057100793 /nfs/dbraw/zinc/10/07/93/1057100793.db2.gz IISRLPQCUCILQM-VMPITWQZSA-N 1 2 310.788 4.103 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)nn1C ZINC000282417311 1057100953 /nfs/dbraw/zinc/10/09/53/1057100953.db2.gz YMGCPOMBEVONTI-YWZLYKJASA-N 1 2 323.415 4.308 20 0 DIADLO Fc1ccccc1-c1nc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)co1 ZINC000625228862 1057104549 /nfs/dbraw/zinc/10/45/49/1057104549.db2.gz AJKUWYTVMVZPEQ-QGZVFWFLSA-N 1 2 311.360 4.146 20 0 DIADLO Fc1ccccc1-c1nc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)co1 ZINC000625228862 1057104550 /nfs/dbraw/zinc/10/45/50/1057104550.db2.gz AJKUWYTVMVZPEQ-QGZVFWFLSA-N 1 2 311.360 4.146 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2ccc(SC(C)C)cc2)cc1 ZINC001241613716 1057110052 /nfs/dbraw/zinc/11/00/52/1057110052.db2.gz XPJCPBMACLXFKJ-KRWDZBQOSA-N 1 2 315.438 4.027 20 0 DIADLO Cc1ccccc1-c1noc(C[N@H+]2C[C@H](C)[C@H]2c2ccccc2)n1 ZINC000673714305 1057119877 /nfs/dbraw/zinc/11/98/77/1057119877.db2.gz VVGRHJRMIXMUDE-KXBFYZLASA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccccc1-c1noc(C[N@@H+]2C[C@H](C)[C@H]2c2ccccc2)n1 ZINC000673714305 1057119882 /nfs/dbraw/zinc/11/98/82/1057119882.db2.gz VVGRHJRMIXMUDE-KXBFYZLASA-N 1 2 319.408 4.238 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]C2(c3ccc(F)cc3)CCC2)cs1 ZINC000673894592 1057147432 /nfs/dbraw/zinc/14/74/32/1057147432.db2.gz ZOGHXIQXPJQORI-LBPRGKRZSA-N 1 2 320.433 4.159 20 0 DIADLO COc1cc(-c2cc[nH+]c(N3CCCCC3)c2)ccc1Cl ZINC001241732768 1057150237 /nfs/dbraw/zinc/15/02/37/1057150237.db2.gz HEDGVCOFRAXWLH-UHFFFAOYSA-N 1 2 302.805 4.401 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)c2ccccc12)c1c(F)cccc1Cl ZINC000673929547 1057151455 /nfs/dbraw/zinc/15/14/55/1057151455.db2.gz KFFSWSMHARXANV-LLVKDONJSA-N 1 2 317.795 4.217 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1cc2cnccc2o1 ZINC000657967205 1057165679 /nfs/dbraw/zinc/16/56/79/1057165679.db2.gz MJQOOBHJNLXNQI-CQSZACIVSA-N 1 2 322.412 4.386 20 0 DIADLO Fc1ccc(-c2[nH+]ccc3c2ccn3Cc2ccccc2)nc1 ZINC001241806695 1057170958 /nfs/dbraw/zinc/17/09/58/1057170958.db2.gz WVUHDSRBAQOENM-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO COc1cc(C(F)(F)F)ccc1-c1ccc2[nH+]ccn2c1C ZINC001241812883 1057173143 /nfs/dbraw/zinc/17/31/43/1057173143.db2.gz SSMGCPBEYMRCCL-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Cc1[nH]c2ccccc2c1C(=O)C[N@@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000674013905 1057177442 /nfs/dbraw/zinc/17/74/42/1057177442.db2.gz UYBATIFZCKBTRX-GOSISDBHSA-N 1 2 322.383 4.245 20 0 DIADLO Cc1[nH]c2ccccc2c1C(=O)C[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000674013905 1057177444 /nfs/dbraw/zinc/17/74/44/1057177444.db2.gz UYBATIFZCKBTRX-GOSISDBHSA-N 1 2 322.383 4.245 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cccnc1OCc1ccccc1 ZINC001241829768 1057180579 /nfs/dbraw/zinc/18/05/79/1057180579.db2.gz FUQVCJQVGPHHNT-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc(C(F)(F)F)c(F)c1 ZINC001241914646 1057210200 /nfs/dbraw/zinc/21/02/00/1057210200.db2.gz RKVCVEFSMKSKBK-UHFFFAOYSA-N 1 2 310.250 4.396 20 0 DIADLO Fc1ccc(-c2ccccc2OC(F)F)cc1-n1cc[nH+]c1 ZINC001241953273 1057222047 /nfs/dbraw/zinc/22/20/47/1057222047.db2.gz HKQKRBBDSNKDDD-UHFFFAOYSA-N 1 2 304.271 4.280 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccccc1OC(F)F ZINC001241953344 1057222128 /nfs/dbraw/zinc/22/21/28/1057222128.db2.gz IPRUAKNUSUMMNG-UHFFFAOYSA-N 1 2 316.307 4.149 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc(-c2ccccn2)cc1 ZINC001241974000 1057227970 /nfs/dbraw/zinc/22/79/70/1057227970.db2.gz DISNVMPBZFXEBU-UHFFFAOYSA-N 1 2 301.349 4.301 20 0 DIADLO Cc1cc(-c2ccc(S(=O)(=O)c3ccccc3)cc2)cc(C)[nH+]1 ZINC001241992881 1057232630 /nfs/dbraw/zinc/23/26/30/1057232630.db2.gz VVDWFYXZKDSSNA-UHFFFAOYSA-N 1 2 323.417 4.198 20 0 DIADLO CCOC(=O)c1nc2cc(-c3cc(C)[nH+]c(C)c3)ccc2s1 ZINC001241995625 1057233361 /nfs/dbraw/zinc/23/33/61/1057233361.db2.gz QFCSJNARCSLHRL-UHFFFAOYSA-N 1 2 312.394 4.152 20 0 DIADLO CCOC(=O)c1cnc2cccc(-c3cc(C)[nH+]c(C)c3)c2c1 ZINC001241993858 1057233458 /nfs/dbraw/zinc/23/34/58/1057233458.db2.gz GOFTWZOQTCETRY-UHFFFAOYSA-N 1 2 306.365 4.090 20 0 DIADLO CCOC(=O)c1cc2ccc(-c3cc(C)[nH+]c(C)c3)cc2nc1C ZINC001241996501 1057234266 /nfs/dbraw/zinc/23/42/66/1057234266.db2.gz SVNRWBWRKYIOFT-UHFFFAOYSA-N 1 2 320.392 4.399 20 0 DIADLO C[C@H](C[NH+]1CCCCC1)NCc1cnc(C2CCCCC2)s1 ZINC000674487034 1057247765 /nfs/dbraw/zinc/24/77/65/1057247765.db2.gz JMNMQVZXXRRHMC-OAHLLOKOSA-N 1 2 321.534 4.155 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1nccc2ccn(Cc3ccccc3)c21 ZINC001242077921 1057255921 /nfs/dbraw/zinc/25/59/21/1057255921.db2.gz LMROMORMDSLNOY-UHFFFAOYSA-N 1 2 314.392 4.037 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1nc(C)nc2sc3c(c21)CC[C@@H](C)C3 ZINC001242078582 1057256431 /nfs/dbraw/zinc/25/64/31/1057256431.db2.gz MWEZIQLDPYHUPH-SECBINFHSA-N 1 2 324.453 4.077 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2F)on1 ZINC000701406975 1057258912 /nfs/dbraw/zinc/25/89/12/1057258912.db2.gz RZGOKCCAXZRVMK-MRVPVSSYSA-N 1 2 303.164 4.280 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(C(F)(F)F)cc1C ZINC001242130741 1057273809 /nfs/dbraw/zinc/27/38/09/1057273809.db2.gz UBSWIXXGLCJJAF-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Oc1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc1C(F)(F)F ZINC001242168977 1057286596 /nfs/dbraw/zinc/28/65/96/1057286596.db2.gz ZCUIAOWTQCRNIV-UHFFFAOYSA-N 1 2 322.261 4.403 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H]2CCOc3ccccc32)c2ccccn21 ZINC000674866784 1057292356 /nfs/dbraw/zinc/29/23/56/1057292356.db2.gz OUZMNKLKJNRBIR-MRXNPFEDSA-N 1 2 321.424 4.071 20 0 DIADLO CCn1cc(C[NH2+][C@H](C)c2cc3c(ccc4ccccc34)o2)nn1 ZINC000658176008 1057306667 /nfs/dbraw/zinc/30/66/67/1057306667.db2.gz JRKJFQHLEYYOOP-CYBMUJFWSA-N 1 2 320.396 4.048 20 0 DIADLO CCOC(=O)Cc1cccc(Nc2ccc3c(C)cc[nH+]c3c2)c1 ZINC001212527133 1057308667 /nfs/dbraw/zinc/30/86/67/1057308667.db2.gz IKLCPXDNDBNJJZ-UHFFFAOYSA-N 1 2 320.392 4.392 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@@H]2COc3c2cccc3Cl)o1 ZINC000675103575 1057316115 /nfs/dbraw/zinc/31/61/15/1057316115.db2.gz XHGRVTFZEZEFHR-RIEGTJTDSA-N 1 2 303.789 4.280 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cnccc2C(F)(F)F)cc1F ZINC001242278807 1057317176 /nfs/dbraw/zinc/31/71/76/1057317176.db2.gz SXOKSZHRAHVTAZ-UHFFFAOYSA-N 1 2 316.273 4.107 20 0 DIADLO O=C(Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)[C@@H]1CC12CCC2 ZINC000675296536 1057338221 /nfs/dbraw/zinc/33/82/21/1057338221.db2.gz IKAAMEAXKQUGOI-KRWDZBQOSA-N 1 2 321.424 4.015 20 0 DIADLO NC(Cc1cccnc1)=[NH+]OCc1ccc(-c2cccs2)cc1 ZINC000766116059 1057347562 /nfs/dbraw/zinc/34/75/62/1057347562.db2.gz ZCZAPUPQGGSLCY-UHFFFAOYSA-N 1 2 323.421 4.051 20 0 DIADLO CCOc1cc(Nc2ccc([N@H+](C)CC)cc2)ccc1OC ZINC001212545582 1057353549 /nfs/dbraw/zinc/35/35/49/1057353549.db2.gz JYPUTVYDHZXDBK-UHFFFAOYSA-N 1 2 300.402 4.294 20 0 DIADLO CCOc1cc(Nc2ccc([N@@H+](C)CC)cc2)ccc1OC ZINC001212545582 1057353554 /nfs/dbraw/zinc/35/35/54/1057353554.db2.gz JYPUTVYDHZXDBK-UHFFFAOYSA-N 1 2 300.402 4.294 20 0 DIADLO C[N@H+](CCc1cccc(F)c1)Cc1c(Cl)cncc1Cl ZINC001137610108 1057354597 /nfs/dbraw/zinc/35/45/97/1057354597.db2.gz BRBPNSGEDXYUDU-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1cccc(F)c1)Cc1c(Cl)cncc1Cl ZINC001137610108 1057354605 /nfs/dbraw/zinc/35/46/05/1057354605.db2.gz BRBPNSGEDXYUDU-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc(OC(F)F)cc2)cc1F ZINC001242442564 1057369486 /nfs/dbraw/zinc/36/94/86/1057369486.db2.gz MBVWQCOMPZVPDB-UHFFFAOYSA-N 1 2 313.294 4.295 20 0 DIADLO c1cn2ccc(-c3ccc4c(cnn4[C@@H]4CCCCO4)c3)cc2[nH+]1 ZINC001242445652 1057370871 /nfs/dbraw/zinc/37/08/71/1057370871.db2.gz FCHNJKFNQUTMLR-IBGZPJMESA-N 1 2 318.380 4.050 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1ccc(Br)nc1C ZINC001212564340 1057378758 /nfs/dbraw/zinc/37/87/58/1057378758.db2.gz QHXQYDCHEPNHMN-UHFFFAOYSA-N 1 2 306.207 4.162 20 0 DIADLO COCOc1ccc(-c2cc[nH+]c(N3CCCCC3)c2)c(C)c1 ZINC001242538220 1057397079 /nfs/dbraw/zinc/39/70/79/1057397079.db2.gz SXAYEJYWOMZOHK-UHFFFAOYSA-N 1 2 312.413 4.030 20 0 DIADLO COc1cccc2c1OCC[C@H]2[NH2+]Cc1c(F)cccc1Cl ZINC000675788747 1057415456 /nfs/dbraw/zinc/41/54/56/1057415456.db2.gz HQLMJCVRETYPNO-OAHLLOKOSA-N 1 2 321.779 4.101 20 0 DIADLO CCOc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1nc(C)cs1)CCO2 ZINC000675810281 1057417193 /nfs/dbraw/zinc/41/71/93/1057417193.db2.gz QKEXVFQFODXBIZ-SWLSCSKDSA-N 1 2 318.442 4.025 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@@H]2CCOc3c(Cl)cccc32)n1 ZINC000675809401 1057417586 /nfs/dbraw/zinc/41/75/86/1057417586.db2.gz HWTUBZGZFUHDLY-GXFFZTMASA-N 1 2 308.834 4.279 20 0 DIADLO Cc1ccc(F)cc1C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC001129120155 1057434528 /nfs/dbraw/zinc/43/45/28/1057434528.db2.gz LKGOULXNEITRRA-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cnc2sccc2c1 ZINC001242681646 1057446276 /nfs/dbraw/zinc/44/62/76/1057446276.db2.gz BQWVNQDSPAOXRZ-UHFFFAOYSA-N 1 2 307.378 4.158 20 0 DIADLO C[C@@]1(F)CCC[N@H+](Cc2cc(F)cc(OC(F)(F)F)c2)C1 ZINC001143256107 1057453555 /nfs/dbraw/zinc/45/35/55/1057453555.db2.gz DHMYEILFYZZTJK-CYBMUJFWSA-N 1 2 309.278 4.048 20 0 DIADLO C[C@@]1(F)CCC[N@@H+](Cc2cc(F)cc(OC(F)(F)F)c2)C1 ZINC001143256107 1057453562 /nfs/dbraw/zinc/45/35/62/1057453562.db2.gz DHMYEILFYZZTJK-CYBMUJFWSA-N 1 2 309.278 4.048 20 0 DIADLO Cc1c(-c2ccc(OCC(F)(F)F)cc2)ccc2[nH+]ccn21 ZINC001242720700 1057459393 /nfs/dbraw/zinc/45/93/93/1057459393.db2.gz MJSBOEXXWAVYDU-UHFFFAOYSA-N 1 2 306.287 4.251 20 0 DIADLO Oc1cc(-c2ccccc2Cn2cc[nH+]c2)cc(C(F)(F)F)c1 ZINC001242783124 1057475027 /nfs/dbraw/zinc/47/50/27/1057475027.db2.gz ARTIIBLTIXIWFH-UHFFFAOYSA-N 1 2 318.298 4.323 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1ccc(Cl)cc1C ZINC000676479863 1057477423 /nfs/dbraw/zinc/47/74/23/1057477423.db2.gz RNZKBFNVFAKUAB-CYBMUJFWSA-N 1 2 320.820 4.091 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1ccc(Cl)cc1C ZINC000676479863 1057477425 /nfs/dbraw/zinc/47/74/25/1057477425.db2.gz RNZKBFNVFAKUAB-CYBMUJFWSA-N 1 2 320.820 4.091 20 0 DIADLO CCCCOc1ncccc1C[NH2+][C@@H](C)c1nc(C)sc1C ZINC000676488400 1057478325 /nfs/dbraw/zinc/47/83/25/1057478325.db2.gz FYHFIGHFWRTHDL-LBPRGKRZSA-N 1 2 319.474 4.185 20 0 DIADLO COc1cccc(C[N@@H+]2CCc3[nH]c4ccc(C)cc4c3C2)c1 ZINC000676703115 1057496446 /nfs/dbraw/zinc/49/64/46/1057496446.db2.gz AFEARNQOJIZTNW-UHFFFAOYSA-N 1 2 306.409 4.043 20 0 DIADLO COc1cccc(C[N@H+]2CCc3[nH]c4ccc(C)cc4c3C2)c1 ZINC000676703115 1057496448 /nfs/dbraw/zinc/49/64/48/1057496448.db2.gz AFEARNQOJIZTNW-UHFFFAOYSA-N 1 2 306.409 4.043 20 0 DIADLO Cc1nc2c(cc(-c3c[nH+]c4c(c3)CCCN4)cc2F)n1C(C)C ZINC001242851145 1057498514 /nfs/dbraw/zinc/49/85/14/1057498514.db2.gz XSGQYQGRRMVWFL-UHFFFAOYSA-N 1 2 324.403 4.128 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2nc(Cl)ccc2Cl)C1 ZINC000708707732 1057501004 /nfs/dbraw/zinc/50/10/04/1057501004.db2.gz TUYZRFRPPCCOST-NSHDSACASA-N 1 2 313.150 4.163 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2nc(Cl)ccc2Cl)C1 ZINC000708707732 1057501008 /nfs/dbraw/zinc/50/10/08/1057501008.db2.gz TUYZRFRPPCCOST-NSHDSACASA-N 1 2 313.150 4.163 20 0 DIADLO C[N@H+](Cc1ccncc1)Cc1c(Cl)cccc1C(F)(F)F ZINC001143283154 1057503682 /nfs/dbraw/zinc/50/36/82/1057503682.db2.gz NQXNPKPSJYQJKJ-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccncc1)Cc1c(Cl)cccc1C(F)(F)F ZINC001143283154 1057503685 /nfs/dbraw/zinc/50/36/85/1057503685.db2.gz NQXNPKPSJYQJKJ-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO CC(C)(C)c1nc(C[NH2+]C2(c3ccccc3)CCCCC2)no1 ZINC000134033166 1057507402 /nfs/dbraw/zinc/50/74/02/1057507402.db2.gz DPOWSEUTTNIMGJ-UHFFFAOYSA-N 1 2 313.445 4.316 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+]Cc2cc(C3CC3)n(C)n2)c1Cl ZINC000922955830 1057516905 /nfs/dbraw/zinc/51/69/05/1057516905.db2.gz OGMSODIQVIEVFU-UHFFFAOYSA-N 1 2 324.255 4.203 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2cc(Cl)cc3c2OCC3)cs1 ZINC000922987564 1057520004 /nfs/dbraw/zinc/52/00/04/1057520004.db2.gz UVVNYSJLSPGLMA-JTQLQIEISA-N 1 2 322.861 4.145 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cc(C(F)(F)F)ccc2N)c1 ZINC001243004766 1057544065 /nfs/dbraw/zinc/54/40/65/1057544065.db2.gz GZQFDXBWPPFNKG-UHFFFAOYSA-N 1 2 317.314 4.355 20 0 DIADLO COc1ccccc1-c1ccc([C@H](C)Nc2cc[nH+]c(C)n2)cc1 ZINC000462892198 1057547066 /nfs/dbraw/zinc/54/70/66/1057547066.db2.gz IPKGOCWJZXCYIJ-AWEZNQCLSA-N 1 2 319.408 4.634 20 0 DIADLO Cn1ccc2c[nH+]c(-c3ccc(-c4ccc(F)cc4)cc3)nc21 ZINC001243030887 1057551189 /nfs/dbraw/zinc/55/11/89/1057551189.db2.gz VJKGEKLUYIQDHU-UHFFFAOYSA-N 1 2 303.340 4.441 20 0 DIADLO Cc1cc2ccc(-c3cc(F)ccc3C[NH+]3CCOCC3)cc2[nH]1 ZINC001243087136 1057567698 /nfs/dbraw/zinc/56/76/98/1057567698.db2.gz CGNNQPGHYIZLSM-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO CCCCOC(=O)c1cccc(-c2cc3[nH]c[nH+]c3cc2OC)c1 ZINC001243098997 1057572439 /nfs/dbraw/zinc/57/24/39/1057572439.db2.gz SXMQZYJKMXWWNC-UHFFFAOYSA-N 1 2 324.380 4.195 20 0 DIADLO c1coc(-c2nc(C[NH2+]Cc3scnc3C3CC3)cs2)c1 ZINC000487301313 1057573006 /nfs/dbraw/zinc/57/30/06/1057573006.db2.gz RLUBIHNPRXVLOE-UHFFFAOYSA-N 1 2 317.439 4.027 20 0 DIADLO COc1cc(-c2ccc3[nH+]ccn3c2C)cc(C(F)(F)F)c1 ZINC001243120356 1057578868 /nfs/dbraw/zinc/57/88/68/1057578868.db2.gz IEQYXTGEFLEMBG-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Cc1cc(C(C)(C)C)cc2c1OCCC[C@H]2[NH2+]Cc1cocn1 ZINC000611473943 1057602050 /nfs/dbraw/zinc/60/20/50/1057602050.db2.gz DAOOCOFVYBJUHF-QGZVFWFLSA-N 1 2 314.429 4.284 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cccc2cnccc21 ZINC000162050252 1057608972 /nfs/dbraw/zinc/60/89/72/1057608972.db2.gz KNMCLWIRLWLDQW-UHFFFAOYSA-N 1 2 320.371 4.356 20 0 DIADLO CCCN(CCC)C(=O)c1ccc(-c2cc[nH+]c(NC)c2)cc1 ZINC001243261058 1057623951 /nfs/dbraw/zinc/62/39/51/1057623951.db2.gz XGVRZXRVGKWEDJ-UHFFFAOYSA-N 1 2 311.429 4.053 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000727221773 1057642119 /nfs/dbraw/zinc/64/21/19/1057642119.db2.gz IEZZDZPHVAPFMQ-OAHLLOKOSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000727221773 1057642120 /nfs/dbraw/zinc/64/21/20/1057642120.db2.gz IEZZDZPHVAPFMQ-OAHLLOKOSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2nnc(-c3cccc(C)c3)o2)o1 ZINC000727223267 1057642932 /nfs/dbraw/zinc/64/29/32/1057642932.db2.gz IZTXTHJLIZQMRR-AWEZNQCLSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2nnc(-c3cccc(C)c3)o2)o1 ZINC000727223267 1057642933 /nfs/dbraw/zinc/64/29/33/1057642933.db2.gz IZTXTHJLIZQMRR-AWEZNQCLSA-N 1 2 311.385 4.139 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2cc(Cl)cc(Cl)c2C)cc1 ZINC001243331939 1057648382 /nfs/dbraw/zinc/64/83/82/1057648382.db2.gz BRGQXSPXRCPCSI-OAHLLOKOSA-N 1 2 324.207 4.142 20 0 DIADLO CC(C)Sc1c(Cl)cccc1NC(=O)CCc1c[nH]c[nH+]1 ZINC000280313528 1057654228 /nfs/dbraw/zinc/65/42/28/1057654228.db2.gz YPLIRCCZPCWKKV-UHFFFAOYSA-N 1 2 323.849 4.135 20 0 DIADLO CC(C)Sc1c(Cl)cccc1NC(=O)CCc1c[nH+]c[nH]1 ZINC000280313528 1057654232 /nfs/dbraw/zinc/65/42/32/1057654232.db2.gz YPLIRCCZPCWKKV-UHFFFAOYSA-N 1 2 323.849 4.135 20 0 DIADLO CC[C@@H]([NH2+]Cc1coc(C2CC2)n1)c1ccccc1OC(F)F ZINC000727466182 1057654576 /nfs/dbraw/zinc/65/45/76/1057654576.db2.gz YRVOSHMGCUESPD-CQSZACIVSA-N 1 2 322.355 4.394 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+]Cc1coc(C2CC2)n1 ZINC000727470437 1057655711 /nfs/dbraw/zinc/65/57/11/1057655711.db2.gz CZDBXYXDLWRSGG-INIZCTEOSA-N 1 2 300.402 4.192 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc(SC)c1F ZINC001243374565 1057663798 /nfs/dbraw/zinc/66/37/98/1057663798.db2.gz UDIHXBYVAKFSQL-UHFFFAOYSA-N 1 2 314.385 4.409 20 0 DIADLO C[N@H+]1Cc2ccccc2[C@H](NCc2cc(Cl)ccc2Cl)C1 ZINC000536021626 1057674281 /nfs/dbraw/zinc/67/42/81/1057674281.db2.gz DDBBVBJURKRVPW-QGZVFWFLSA-N 1 2 321.251 4.270 20 0 DIADLO C[N@@H+]1Cc2ccccc2[C@H](NCc2cc(Cl)ccc2Cl)C1 ZINC000536021626 1057674284 /nfs/dbraw/zinc/67/42/84/1057674284.db2.gz DDBBVBJURKRVPW-QGZVFWFLSA-N 1 2 321.251 4.270 20 0 DIADLO Cc1cn2cc(-c3cc(F)c(F)cc3OC(C)C)ccc2[nH+]1 ZINC001243412574 1057675132 /nfs/dbraw/zinc/67/51/32/1057675132.db2.gz IHILJIWSGMXUBY-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO CCC[N@@H+](Cc1ccccc1)Cn1ncn(C(C)(C)C)c1=S ZINC000727816010 1057675382 /nfs/dbraw/zinc/67/53/82/1057675382.db2.gz NUWFNEWUDGWAGG-UHFFFAOYSA-N 1 2 318.490 4.039 20 0 DIADLO CCC[N@H+](Cc1ccccc1)Cn1ncn(C(C)(C)C)c1=S ZINC000727816010 1057675384 /nfs/dbraw/zinc/67/53/84/1057675384.db2.gz NUWFNEWUDGWAGG-UHFFFAOYSA-N 1 2 318.490 4.039 20 0 DIADLO CCC[NH+](CCC)Cn1nc(Cc2ccccc2F)oc1=S ZINC000727816260 1057675450 /nfs/dbraw/zinc/67/54/50/1057675450.db2.gz CZWPZMXSHYMXJF-UHFFFAOYSA-N 1 2 323.437 4.015 20 0 DIADLO CC[C@H](c1nn(C[N@@H+]2CC[C@H](C)C2)c(=S)o1)c1ccccc1 ZINC000727823653 1057678080 /nfs/dbraw/zinc/67/80/80/1057678080.db2.gz WKIUSPVNNBDRDM-ZFWWWQNUSA-N 1 2 317.458 4.047 20 0 DIADLO CC[C@H](c1nn(C[N@H+]2CC[C@H](C)C2)c(=S)o1)c1ccccc1 ZINC000727823653 1057678081 /nfs/dbraw/zinc/67/80/81/1057678081.db2.gz WKIUSPVNNBDRDM-ZFWWWQNUSA-N 1 2 317.458 4.047 20 0 DIADLO CCCCC[C@H](NC(=O)CCCn1cc[nH+]c1)c1ccccc1 ZINC000728007211 1057683528 /nfs/dbraw/zinc/68/35/28/1057683528.db2.gz FQZAASOKPKJWPH-SFHVURJKSA-N 1 2 313.445 4.101 20 0 DIADLO CCCC[N@H+](Cn1c(=O)sc2c1CC[C@@H](CCC)C2)C1CC1 ZINC000728042037 1057684799 /nfs/dbraw/zinc/68/47/99/1057684799.db2.gz GCYGSVSMVCDPEG-CQSZACIVSA-N 1 2 322.518 4.037 20 0 DIADLO CCCC[N@@H+](Cn1c(=O)sc2c1CC[C@@H](CCC)C2)C1CC1 ZINC000728042037 1057684801 /nfs/dbraw/zinc/68/48/01/1057684801.db2.gz GCYGSVSMVCDPEG-CQSZACIVSA-N 1 2 322.518 4.037 20 0 DIADLO COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1cc(C(C)C)no1 ZINC000169278372 1057690546 /nfs/dbraw/zinc/69/05/46/1057690546.db2.gz HAXVUHITWMTORD-NSHDSACASA-N 1 2 308.809 4.311 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(-c2ccccc2)sc1=S ZINC000729980946 1057700334 /nfs/dbraw/zinc/70/03/34/1057700334.db2.gz DRHLBFWXAKBFHQ-UHFFFAOYSA-N 1 2 307.488 4.421 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(-c2ccccc2)sc1=S ZINC000729980946 1057700336 /nfs/dbraw/zinc/70/03/36/1057700336.db2.gz DRHLBFWXAKBFHQ-UHFFFAOYSA-N 1 2 307.488 4.421 20 0 DIADLO CCOc1c(F)cccc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001243536910 1057706612 /nfs/dbraw/zinc/70/66/12/1057706612.db2.gz RHOPXNOBRXASHG-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO Clc1cc(C[N@@H+]2CCCc3ccccc3C2)cc(Cl)n1 ZINC000730265398 1057709740 /nfs/dbraw/zinc/70/97/40/1057709740.db2.gz STRBLPXVWFLGNZ-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO Clc1cc(C[N@H+]2CCCc3ccccc3C2)cc(Cl)n1 ZINC000730265398 1057709744 /nfs/dbraw/zinc/70/97/44/1057709744.db2.gz STRBLPXVWFLGNZ-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO COc1c(Cl)ccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c1F ZINC001243574196 1057719498 /nfs/dbraw/zinc/71/94/98/1057719498.db2.gz UUSXQEDIJYMOJL-UHFFFAOYSA-N 1 2 320.673 4.151 20 0 DIADLO COc1c(Cl)ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c1F ZINC001243575841 1057720622 /nfs/dbraw/zinc/72/06/22/1057720622.db2.gz VOLGZEPZCNDNJT-UHFFFAOYSA-N 1 2 316.763 4.400 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2ccc(C(F)(F)F)cc2O)cc1 ZINC001243612027 1057733851 /nfs/dbraw/zinc/73/38/51/1057733851.db2.gz UPRQFJPSKZSUPH-UHFFFAOYSA-N 1 2 309.287 4.440 20 0 DIADLO CCCOc1c(F)cc(F)c(-c2c[nH+]c(C)cc2OC)c1F ZINC001243622039 1057736924 /nfs/dbraw/zinc/73/69/24/1057736924.db2.gz AXLNMYRGOZNMNN-UHFFFAOYSA-N 1 2 311.303 4.272 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1ccc(C(C)(F)F)cc1 ZINC001243643004 1057741949 /nfs/dbraw/zinc/74/19/49/1057741949.db2.gz HBAJCDXEEKRIGO-UHFFFAOYSA-N 1 2 318.367 4.005 20 0 DIADLO Fc1ccc(C(F)(F)F)nc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243656623 1057745294 /nfs/dbraw/zinc/74/52/94/1057745294.db2.gz HKILKRNFFZFXCI-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO COc1ccc2ccnc(-c3ccc(Cn4cc[nH+]c4)cc3)c2c1 ZINC001243656243 1057745563 /nfs/dbraw/zinc/74/55/63/1057745563.db2.gz GHXRGQQSOBRZJH-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO c1cn(Cc2ccc(-c3cncc(-c4ccccc4)n3)cc2)c[nH+]1 ZINC001243656768 1057745575 /nfs/dbraw/zinc/74/55/75/1057745575.db2.gz MSRXOJFKVVZRHT-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(OCC4CCC4)nc3)cc2)c[nH+]1 ZINC001243656382 1057745609 /nfs/dbraw/zinc/74/56/09/1057745609.db2.gz CRNPRQQHLWZVEC-UHFFFAOYSA-N 1 2 319.408 4.172 20 0 DIADLO Fc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)cc2cccnc12 ZINC001243656417 1057745729 /nfs/dbraw/zinc/74/57/29/1057745729.db2.gz DJVGIKVEDHXPCU-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO COc1ccc2cnc(-c3ccc(Cn4cc[nH+]c4)cc3)cc2c1 ZINC001243658413 1057746088 /nfs/dbraw/zinc/74/60/88/1057746088.db2.gz XALASVUKNNZTGP-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO FC(F)(F)Oc1ccccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243657957 1057746107 /nfs/dbraw/zinc/74/61/07/1057746107.db2.gz CEXPLNHDZOVOKC-UHFFFAOYSA-N 1 2 318.298 4.497 20 0 DIADLO CC(C)(C)Oc1cccc(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC001243658235 1057746272 /nfs/dbraw/zinc/74/62/72/1057746272.db2.gz USFIRHILMAOBSZ-UHFFFAOYSA-N 1 2 307.397 4.171 20 0 DIADLO c1cn(Cc2ccc(-c3cncc(-c4ccncc4)c3)cc2)c[nH+]1 ZINC001243658038 1057746624 /nfs/dbraw/zinc/74/66/24/1057746624.db2.gz AZJBCNXOLZLORQ-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO CCCc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)nc(CCC)n1 ZINC001243657608 1057746761 /nfs/dbraw/zinc/74/67/61/1057746761.db2.gz VRHGDMUVKUKRQB-UHFFFAOYSA-N 1 2 320.440 4.293 20 0 DIADLO CC(=O)Nc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c(C)c1C ZINC001243659882 1057747038 /nfs/dbraw/zinc/74/70/38/1057747038.db2.gz JRFYHNNTFIJLOM-UHFFFAOYSA-N 1 2 319.408 4.174 20 0 DIADLO Cc1nc(OC(C)C)ccc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001243660724 1057747212 /nfs/dbraw/zinc/74/72/12/1057747212.db2.gz IWRKCSVFKMXXQB-UHFFFAOYSA-N 1 2 307.397 4.245 20 0 DIADLO Cc1nc(OC(C)C)ccc1-c1ccccc1Cn1cc[nH+]c1 ZINC001243660586 1057747284 /nfs/dbraw/zinc/74/72/84/1057747284.db2.gz GIJCQLJPYXIESH-UHFFFAOYSA-N 1 2 307.397 4.089 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cn1ccc(-c2cccs2)n1 ZINC000731657251 1057750392 /nfs/dbraw/zinc/75/03/92/1057750392.db2.gz GDCPZMMZCULCHE-LBPRGKRZSA-N 1 2 315.467 4.250 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cn1ccc(-c2cccs2)n1 ZINC000731657251 1057750393 /nfs/dbraw/zinc/75/03/93/1057750393.db2.gz GDCPZMMZCULCHE-LBPRGKRZSA-N 1 2 315.467 4.250 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2cnc(-c3ccccc3)o2)s1 ZINC001119813057 1057755988 /nfs/dbraw/zinc/75/59/88/1057755988.db2.gz UMXLYNPGCWQEJK-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO CC(=O)OCc1cccc(C)c1-c1cc[nH+]c(N2CCCCC2)c1 ZINC001243717719 1057760970 /nfs/dbraw/zinc/76/09/70/1057760970.db2.gz IQZPFIPJUQRUQC-UHFFFAOYSA-N 1 2 324.424 4.110 20 0 DIADLO CC(=O)OCc1cccc(Cl)c1-c1cccc2[nH+]c(C)cn21 ZINC001243722566 1057762103 /nfs/dbraw/zinc/76/21/03/1057762103.db2.gz CGBOBDMUOSPHJZ-UHFFFAOYSA-N 1 2 314.772 4.026 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc2nc(C)ccc21 ZINC001243743858 1057768076 /nfs/dbraw/zinc/76/80/76/1057768076.db2.gz DBCKYHDCBBRCAQ-UHFFFAOYSA-N 1 2 315.376 4.405 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(OCC(C)C)nc2C)c1 ZINC001243801001 1057782543 /nfs/dbraw/zinc/78/25/43/1057782543.db2.gz UZXZCCYGIIOFKU-UHFFFAOYSA-N 1 2 312.413 4.454 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCc3ncc(C(C)C)o3)c2c1 ZINC000733208332 1057806656 /nfs/dbraw/zinc/80/66/56/1057806656.db2.gz WEJSLDUZVMAHTI-UHFFFAOYSA-N 1 2 312.369 4.242 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc2c(c1)CCC(C)(C)O2 ZINC001243916431 1057806763 /nfs/dbraw/zinc/80/67/63/1057806763.db2.gz MIJVHGSZZSQWOM-UHFFFAOYSA-N 1 2 308.381 4.342 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ncc(C(C)C)o2)cc1 ZINC000733305068 1057811231 /nfs/dbraw/zinc/81/12/31/1057811231.db2.gz WZEKKJBGFPWPDF-INIZCTEOSA-N 1 2 300.402 4.144 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ncc(C(C)C)o2)cc1 ZINC000733305068 1057811235 /nfs/dbraw/zinc/81/12/35/1057811235.db2.gz WZEKKJBGFPWPDF-INIZCTEOSA-N 1 2 300.402 4.144 20 0 DIADLO CC(C)c1cnc(C[NH+]2CCC(OC3CCC(C)CC3)CC2)o1 ZINC000733309975 1057812038 /nfs/dbraw/zinc/81/20/38/1057812038.db2.gz DMXJEQWFVYVNES-UHFFFAOYSA-N 1 2 320.477 4.358 20 0 DIADLO Fc1ccc(-c2csc3ncnc(C4=C[NH2+]CCC4)c23)cc1 ZINC001243949200 1057818098 /nfs/dbraw/zinc/81/80/98/1057818098.db2.gz UCBJTXFCEVVSIS-UHFFFAOYSA-N 1 2 311.385 4.222 20 0 DIADLO CC(=O)Oc1c[nH]c2cc(-c3ccc(-c4[nH]cc[nH+]4)cc3)ccc21 ZINC001243976927 1057826356 /nfs/dbraw/zinc/82/63/56/1057826356.db2.gz WUXNXJIBRBTCRS-UHFFFAOYSA-N 1 2 317.348 4.150 20 0 DIADLO CC(C)[S@@](=O)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001243976909 1057826401 /nfs/dbraw/zinc/82/64/01/1057826401.db2.gz VSECWQFJUFNAKL-JOCHJYFZSA-N 1 2 310.422 4.260 20 0 DIADLO CCOC(=O)/C=C/c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001243976597 1057826524 /nfs/dbraw/zinc/82/65/24/1057826524.db2.gz QEHFXGKNYVKWDX-LFYBBSHMSA-N 1 2 318.376 4.320 20 0 DIADLO CC1(C)Cc2c(cccc2-c2ccc(-c3[nH]cc[nH+]3)cc2)NC1=O ZINC001243980426 1057828214 /nfs/dbraw/zinc/82/82/14/1057828214.db2.gz NNBCNXMLJAERET-UHFFFAOYSA-N 1 2 317.392 4.265 20 0 DIADLO COc1cccc2c(-c3ccc(-c4[nH]cc[nH+]4)cc3)ccnc12 ZINC001243980396 1057828339 /nfs/dbraw/zinc/82/83/39/1057828339.db2.gz XWKZNUSAHQLBFB-UHFFFAOYSA-N 1 2 301.349 4.301 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc3c(c2)CCCC3=O)cc1F ZINC001243990615 1057831494 /nfs/dbraw/zinc/83/14/94/1057831494.db2.gz IFWLSNGGIRZWKA-UHFFFAOYSA-N 1 2 315.363 4.212 20 0 DIADLO Nc1cc(-c2ccc(F)c(Cl)c2F)[nH+]cc1C(F)(F)F ZINC001244035290 1057845340 /nfs/dbraw/zinc/84/53/40/1057845340.db2.gz QBKSOLHHMRNJFR-UHFFFAOYSA-N 1 2 308.637 4.281 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(F)c(Cl)c1F ZINC001244037929 1057846061 /nfs/dbraw/zinc/84/60/61/1057846061.db2.gz GTOSIMZGODIZKA-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO FC(F)COc1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001244068032 1057856394 /nfs/dbraw/zinc/85/63/94/1057856394.db2.gz TYZXOBFCJHXQNY-UHFFFAOYSA-N 1 2 300.308 4.388 20 0 DIADLO Cn1ccc2c[nH+]c(-c3ccc(F)c(-c4ccccc4)c3)nc21 ZINC001244091759 1057865887 /nfs/dbraw/zinc/86/58/87/1057865887.db2.gz BDHPMLWVFMCVBX-UHFFFAOYSA-N 1 2 303.340 4.441 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cc(F)c(OC(C)C)c(F)c1 ZINC001244109629 1057871808 /nfs/dbraw/zinc/87/18/08/1057871808.db2.gz GGEFQWFMRKTNGK-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO COc1cc(-c2ccn3cc(N)[nH+]c3c2)ccc1-c1ccccc1 ZINC001244142143 1057884645 /nfs/dbraw/zinc/88/46/45/1057884645.db2.gz PZUDNOOAPSQXLC-UHFFFAOYSA-N 1 2 315.376 4.259 20 0 DIADLO Cc1cc(C)c(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)cn1 ZINC001244150186 1057886949 /nfs/dbraw/zinc/88/69/49/1057886949.db2.gz LVVQHRWMBVRMJB-UHFFFAOYSA-N 1 2 319.408 4.008 20 0 DIADLO Cc1cc(C)c(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)cn1 ZINC001244150186 1057886952 /nfs/dbraw/zinc/88/69/52/1057886952.db2.gz LVVQHRWMBVRMJB-UHFFFAOYSA-N 1 2 319.408 4.008 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc(F)c(F)c(F)c1N ZINC001244166462 1057890042 /nfs/dbraw/zinc/89/00/42/1057890042.db2.gz RROCOSMSUQHUQK-UHFFFAOYSA-N 1 2 321.346 4.047 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccccc1N1CCCC1 ZINC001244185953 1057894893 /nfs/dbraw/zinc/89/48/93/1057894893.db2.gz OKBNOPATVTXQNG-UHFFFAOYSA-N 1 2 319.408 4.148 20 0 DIADLO Fc1cc(N2CCCC2)ccc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001244270600 1057918736 /nfs/dbraw/zinc/91/87/36/1057918736.db2.gz CZQLRGWGWVLABD-UHFFFAOYSA-N 1 2 307.372 4.279 20 0 DIADLO Cc1cc(-c2ccc3sccc3c2)c[nH+]c1N1CCOCC1 ZINC001244298772 1057926452 /nfs/dbraw/zinc/92/64/52/1057926452.db2.gz ZVNIQFAXAVXUKU-UHFFFAOYSA-N 1 2 310.422 4.108 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(N)c(C(C)C)c1 ZINC001244338726 1057936542 /nfs/dbraw/zinc/93/65/42/1057936542.db2.gz SXMGTJQKRAAPPC-UHFFFAOYSA-N 1 2 307.397 4.254 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cc(F)c(CO)c(F)c2)c1 ZINC001244342705 1057937609 /nfs/dbraw/zinc/93/76/09/1057937609.db2.gz KJBWGYYUPBMUCQ-UHFFFAOYSA-N 1 2 305.368 4.279 20 0 DIADLO COc1cc(F)c(-c2ccccc2Cn2cc[nH+]c2)cc1Cl ZINC001244353099 1057940371 /nfs/dbraw/zinc/94/03/71/1057940371.db2.gz VSTOSRDCLXEKOC-UHFFFAOYSA-N 1 2 316.763 4.400 20 0 DIADLO Cc1cc(-c2ccc(C(=O)Nc3cccc(F)c3)cc2)c[nH+]c1N ZINC001244379327 1057947477 /nfs/dbraw/zinc/94/74/77/1057947477.db2.gz JMESTMAZVIVOCU-UHFFFAOYSA-N 1 2 321.355 4.031 20 0 DIADLO CN(C)c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1Cl ZINC001244413735 1057954255 /nfs/dbraw/zinc/95/42/55/1057954255.db2.gz WCPIZPPYSGYDQX-UHFFFAOYSA-N 1 2 311.816 4.318 20 0 DIADLO CSc1ccc(-c2nc3c(ccn3C)c[nH+]2)cc1C(F)(F)F ZINC001244494059 1057975121 /nfs/dbraw/zinc/97/51/21/1057975121.db2.gz ZZMBQGRNZAOSQF-UHFFFAOYSA-N 1 2 323.343 4.376 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2c(Cl)ccc(O)c2F)c1 ZINC001244542570 1057992193 /nfs/dbraw/zinc/99/21/93/1057992193.db2.gz NKXBOXAOBGQCER-UHFFFAOYSA-N 1 2 302.736 4.252 20 0 DIADLO COc1c(F)cc(-c2cn3cc[nH+]c3cc2C)cc1C(F)(F)F ZINC001244572822 1057999566 /nfs/dbraw/zinc/99/95/66/1057999566.db2.gz WWTWTIVTTOMJRT-UHFFFAOYSA-N 1 2 324.277 4.476 20 0 DIADLO CCCOc1cc(-c2cccc3[nH+]c(C)cn32)c(Cl)cn1 ZINC001244604239 1058006432 /nfs/dbraw/zinc/00/64/32/1058006432.db2.gz BOLZYPLSOJAJFB-UHFFFAOYSA-N 1 2 301.777 4.147 20 0 DIADLO CCCOc1cc(-c2cn3cc[nH+]c3cc2C)c(Cl)cn1 ZINC001244607855 1058008214 /nfs/dbraw/zinc/00/82/14/1058008214.db2.gz UJPFMTKSHKZODK-UHFFFAOYSA-N 1 2 301.777 4.147 20 0 DIADLO CCCOc1cc(-c2cc(C)c3[nH+]ccn3c2)c(Cl)cn1 ZINC001244607775 1058008399 /nfs/dbraw/zinc/00/83/99/1058008399.db2.gz ROHUQOBMIBJSHD-UHFFFAOYSA-N 1 2 301.777 4.147 20 0 DIADLO Oc1c(Cl)ccc(-c2cnccc2C[NH+]2CCCCC2)c1F ZINC001244634567 1058015980 /nfs/dbraw/zinc/01/59/80/1058015980.db2.gz YJEYQLWRMIXFRH-UHFFFAOYSA-N 1 2 320.795 4.233 20 0 DIADLO Nc1cn2ccc(-c3ccc(NCc4ccccc4)cc3)cc2[nH+]1 ZINC001244644150 1058018456 /nfs/dbraw/zinc/01/84/56/1058018456.db2.gz TZEUQGZSKVQGJJ-UHFFFAOYSA-N 1 2 314.392 4.196 20 0 DIADLO O=C(O[C@@H]1CC=C(c2ccc3[nH+]ccn3c2)CC1)c1ccccc1 ZINC001244802552 1058050094 /nfs/dbraw/zinc/05/00/94/1058050094.db2.gz FJVQLDFDAITUDA-GOSISDBHSA-N 1 2 318.376 4.127 20 0 DIADLO Cc1ccc2[nH]ccc2c1-c1cccc(C[NH+]2CCOCC2)c1F ZINC001244859025 1058058848 /nfs/dbraw/zinc/05/88/48/1058058848.db2.gz QVVNKDKIWKQJLX-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO CSc1ncc(C)cc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001244880697 1058063956 /nfs/dbraw/zinc/06/39/56/1058063956.db2.gz ICKZBRVHRIKPFW-UHFFFAOYSA-N 1 2 313.470 4.473 20 0 DIADLO COc1cc(-c2ccccc2Cn2cc[nH+]c2)ccc1OC(C)C ZINC001244883461 1058064916 /nfs/dbraw/zinc/06/49/16/1058064916.db2.gz ALXWGLQUXQBXDF-UHFFFAOYSA-N 1 2 322.408 4.394 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc2c(cccc2F)o1 ZINC001244928477 1058073733 /nfs/dbraw/zinc/07/37/33/1058073733.db2.gz JBTAHIWBIOBNKG-UHFFFAOYSA-N 1 2 308.312 4.433 20 0 DIADLO Cc1c(Cl)cccc1-c1ccc(C[NH+]2CCOCC2)cc1F ZINC001244965877 1058082521 /nfs/dbraw/zinc/08/25/21/1058082521.db2.gz OZJNUMDWUWUTBO-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO CNc1cc(-c2ccc(-c3cn4ccccc4n3)cc2)cc[nH+]1 ZINC001244971382 1058084368 /nfs/dbraw/zinc/08/43/68/1058084368.db2.gz FNRAGWYEOODTJJ-UHFFFAOYSA-N 1 2 300.365 4.105 20 0 DIADLO Cc1ccc(-c2c(F)ccc(F)c2C)c(C[NH+]2CCOCC2)c1 ZINC001244988143 1058087660 /nfs/dbraw/zinc/08/76/60/1058087660.db2.gz UVQTXDCKHOMCMX-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO Cc1cc(Cl)ccc1-c1ccc(C[NH+]2CCOCC2)cc1F ZINC001245086239 1058109768 /nfs/dbraw/zinc/10/97/68/1058109768.db2.gz CVOUFTSSKFDNEK-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO COc1ccc(-c2c[nH+]cn2Cc2ccccc2)c2cc[nH]c21 ZINC001245196936 1058126562 /nfs/dbraw/zinc/12/65/62/1058126562.db2.gz OJPJPCKHOISLEH-UHFFFAOYSA-N 1 2 303.365 4.088 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1-c1ccnc(-c2ccccn2)c1 ZINC001245198403 1058126798 /nfs/dbraw/zinc/12/67/98/1058126798.db2.gz DMQPWLQLKFSJSY-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO COc1cc(-c2c[nH+]cn2Cc2ccccc2)cc2ccoc21 ZINC001245198780 1058126837 /nfs/dbraw/zinc/12/68/37/1058126837.db2.gz NTMCTKGFQQWUHQ-UHFFFAOYSA-N 1 2 304.349 4.353 20 0 DIADLO COc1cccc2c(-c3c[nH+]cn3Cc3ccccc3)ccnc12 ZINC001245198428 1058126927 /nfs/dbraw/zinc/12/69/27/1058126927.db2.gz FTUSENITXWVRFB-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO CCOc1c(F)cc(-c2c[nH+]cn2Cc2ccccc2)cc1F ZINC001245201895 1058127444 /nfs/dbraw/zinc/12/74/44/1058127444.db2.gz SAGQZPFLYSYVIY-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO CCn1ncc2cc(-c3cc[nH+]c(N4CCCCC4)c3)ccc21 ZINC001245236329 1058132070 /nfs/dbraw/zinc/13/20/70/1058132070.db2.gz OHAFMTOORLIXJX-UHFFFAOYSA-N 1 2 306.413 4.109 20 0 DIADLO COc1c(-c2c[nH+]c(N(C)C)cc2C)cccc1C(F)(F)F ZINC001245276498 1058138405 /nfs/dbraw/zinc/13/84/05/1058138405.db2.gz JAORWAIVXNWMNK-UHFFFAOYSA-N 1 2 310.319 4.150 20 0 DIADLO Cc1noc2ccc(-c3cc(F)c(C[NH+](C)C)c(F)c3)cc12 ZINC001245284044 1058140502 /nfs/dbraw/zinc/14/05/02/1058140502.db2.gz AWSKJBZMVNAVPW-UHFFFAOYSA-N 1 2 302.324 4.143 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2cc(N)ccc2c1 ZINC001245370119 1058154515 /nfs/dbraw/zinc/15/45/15/1058154515.db2.gz RYRDVKCXBKBOGZ-UHFFFAOYSA-N 1 2 315.376 4.283 20 0 DIADLO CC(=O)OCc1cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)ccc1C ZINC001245379532 1058157038 /nfs/dbraw/zinc/15/70/38/1058157038.db2.gz NYWXLPSNNDMYHJ-UHFFFAOYSA-N 1 2 306.365 4.115 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccncc2C(F)(F)F)cc1 ZINC001245446433 1058168121 /nfs/dbraw/zinc/16/81/21/1058168121.db2.gz OWZDRYOQGRRCIF-UHFFFAOYSA-N 1 2 303.287 4.168 20 0 DIADLO Cc1[nH+]c(-c2cccc(Br)c2F)cc2[nH]ccc21 ZINC001245481042 1058176075 /nfs/dbraw/zinc/17/60/75/1058176075.db2.gz CBSUCLFEALKZTA-UHFFFAOYSA-N 1 2 305.150 4.440 20 0 DIADLO CCC[C@@H](C(=O)Nc1cc(C)[nH+]cc1C)c1cccc(Cl)c1 ZINC001527661508 1058197678 /nfs/dbraw/zinc/19/76/78/1058197678.db2.gz GGFPZQGIEOFGSH-MRXNPFEDSA-N 1 2 316.832 4.296 20 0 DIADLO Cc1c(-c2c(F)cc(OC(C)C)cc2F)ccc2[nH+]ccn21 ZINC001245529607 1058210021 /nfs/dbraw/zinc/21/00/21/1058210021.db2.gz DWZFUYPJBVMEBQ-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Cc1cc(-c2ncnc3sc(-c4ccccc4)cc32)c[nH+]c1N ZINC001245534979 1058217009 /nfs/dbraw/zinc/21/70/09/1058217009.db2.gz CXFKLTKMMDBKFR-UHFFFAOYSA-N 1 2 318.405 4.311 20 0 DIADLO Cc1cc(-c2ccc(C(F)(F)F)c(C(F)(F)F)n2)c[nH+]c1N ZINC001245537940 1058217353 /nfs/dbraw/zinc/21/73/53/1058217353.db2.gz MDDZRTQGOMIKGE-UHFFFAOYSA-N 1 2 321.224 4.072 20 0 DIADLO Cc1cc(-c2ccc3nc(C(F)(F)F)ccc3c2)c[nH+]c1N ZINC001245538468 1058218610 /nfs/dbraw/zinc/21/86/10/1058218610.db2.gz KKHRVIUVFFHKGO-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO CCC1CCC(C(=O)N2CCCC[C@H]2c2c[nH+]cn2CC)CC1 ZINC001548831466 1058262601 /nfs/dbraw/zinc/26/26/01/1058262601.db2.gz BMFIEZHFKJNXDV-JCYILVPMSA-N 1 2 317.477 4.173 20 0 DIADLO C[C@H](CC1CCCCC1)C(=O)N1CCCC[C@H]1c1c[nH+]cn1C ZINC001548828319 1058264605 /nfs/dbraw/zinc/26/46/05/1058264605.db2.gz OOKFIEZJRXZGPN-WBVHZDCISA-N 1 2 317.477 4.080 20 0 DIADLO COC(=O)c1ccc(-c2ccc(-c3ccc(C)c(N)[nH+]3)cc2)cc1 ZINC001245665445 1058319383 /nfs/dbraw/zinc/31/93/83/1058319383.db2.gz JRHNFVLBXKCVMO-UHFFFAOYSA-N 1 2 318.376 4.093 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)CC(C)(C)C(F)F)cc2)[nH+]c1C ZINC001550616718 1058351814 /nfs/dbraw/zinc/35/18/14/1058351814.db2.gz QRVPREFOYBFZJA-UHFFFAOYSA-N 1 2 321.371 4.313 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CC(C)(C)Oc2ccc(F)cc21)c1ncccc1F ZINC001550704089 1058353773 /nfs/dbraw/zinc/35/37/73/1058353773.db2.gz OKIYUODMBNYDPN-IAQYHMDHSA-N 1 2 318.367 4.313 20 0 DIADLO CCOC(=O)c1ccc(-c2cccc(-c3c[nH+]cn3C)c2)cc1C ZINC001245718802 1058392276 /nfs/dbraw/zinc/39/22/76/1058392276.db2.gz CWYXTWJXZSUNJJ-UHFFFAOYSA-N 1 2 320.392 4.239 20 0 DIADLO CCOC(=O)c1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1C ZINC001245718550 1058393754 /nfs/dbraw/zinc/39/37/54/1058393754.db2.gz WNDVXFIYINDRHJ-UHFFFAOYSA-N 1 2 306.365 4.024 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc(Cl)s2)CC[C@@H](c2ccccc2)O1 ZINC001551397125 1058396150 /nfs/dbraw/zinc/39/61/50/1058396150.db2.gz UKQOMTCADXCYSG-WFASDCNBSA-N 1 2 322.861 4.149 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnc(Cl)s2)CC[C@@H](c2ccccc2)O1 ZINC001551397125 1058396158 /nfs/dbraw/zinc/39/61/58/1058396158.db2.gz UKQOMTCADXCYSG-WFASDCNBSA-N 1 2 322.861 4.149 20 0 DIADLO COc1c(Cl)ccc(F)c1-c1cc(N2CCCC2)cc[nH+]1 ZINC001245729486 1058407554 /nfs/dbraw/zinc/40/75/54/1058407554.db2.gz BUDXHRULXZTYNV-UHFFFAOYSA-N 1 2 306.768 4.150 20 0 DIADLO CC[C@H]1CCC[C@H]1C(=O)Nc1ccccc1-c1[nH]c(C)c(C)[nH+]1 ZINC001551738641 1058408680 /nfs/dbraw/zinc/40/86/80/1058408680.db2.gz IDXMGXFPHOADLM-LSDHHAIUSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2CCCC[C@H]2F)[nH+]c1C ZINC001551740830 1058409562 /nfs/dbraw/zinc/40/95/62/1058409562.db2.gz OGRYSWKNFJJZHI-DZGCQCFKSA-N 1 2 315.392 4.160 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2CCC[C@H](C)C2)[nH+]c1C ZINC001551736718 1058409821 /nfs/dbraw/zinc/40/98/21/1058409821.db2.gz AAAFSAQQANMGHL-WFASDCNBSA-N 1 2 311.429 4.458 20 0 DIADLO C[C@H]1CCC[C@]1(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001519381977 1058424239 /nfs/dbraw/zinc/42/42/39/1058424239.db2.gz RPCBOORSJFNYDP-SJCJKPOMSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H]3CC[C@@H]4CCCC[C@@H]4C3)ccc2[nH+]1 ZINC001519733592 1058467783 /nfs/dbraw/zinc/46/77/83/1058467783.db2.gz VPZPZTFVMIQWEP-ARFHVFGLSA-N 1 2 311.429 4.188 20 0 DIADLO Cc1ccc(NC(=S)Nc2ccc3[nH+]ccn3c2)cc1Cl ZINC001245815662 1058501020 /nfs/dbraw/zinc/50/10/20/1058501020.db2.gz BDXLAKXUAYITNR-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3C[C@@H]3c3ccco3)cc2)[nH+]c1C ZINC001553889037 1058509375 /nfs/dbraw/zinc/50/93/75/1058509375.db2.gz BFRJERKTFFXHDC-HOTGVXAUSA-N 1 2 321.380 4.029 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)c2ccc(C3CC3)o2)[nH+]c1C ZINC001553989498 1058511024 /nfs/dbraw/zinc/51/10/24/1058511024.db2.gz UFYPYVLRCFZQHO-UHFFFAOYSA-N 1 2 321.380 4.416 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1noc([C@@H]2CC[C@H](c3ccccc3)C2)n1 ZINC001554099456 1058517802 /nfs/dbraw/zinc/51/78/02/1058517802.db2.gz RYFBKVRGIQGTPQ-LSDHHAIUSA-N 1 2 320.396 4.074 20 0 DIADLO CCOc1nccc(-c2ccccc2Cn2cc[nH+]c2)c1Cl ZINC001245846240 1058550587 /nfs/dbraw/zinc/55/05/87/1058550587.db2.gz HQMXWKQMPBMLNH-UHFFFAOYSA-N 1 2 313.788 4.046 20 0 DIADLO Cc1ccc(NC(=O)/C=C/c2cc(C)c(C)cc2C)c(N(C)C)[nH+]1 ZINC001520236169 1058564599 /nfs/dbraw/zinc/56/45/99/1058564599.db2.gz CHVVYDXCDRYFIZ-CSKARUKUSA-N 1 2 323.440 4.033 20 0 DIADLO Cc1ccc(NC(=O)c2coc3cc(C)c(C)cc23)c(N(C)C)[nH+]1 ZINC001520237214 1058567063 /nfs/dbraw/zinc/56/70/63/1058567063.db2.gz GJNQBNAGNQFVJJ-UHFFFAOYSA-N 1 2 323.396 4.071 20 0 DIADLO CC(C)=CCC[C@@H](C)CC(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001520247956 1058568921 /nfs/dbraw/zinc/56/89/21/1058568921.db2.gz IYKONGDAOZJZBF-CQSZACIVSA-N 1 2 303.450 4.167 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](CC(C)(C)C)C(F)(F)F)c(C)[nH+]1 ZINC001520383233 1058599308 /nfs/dbraw/zinc/59/93/08/1058599308.db2.gz SUOGCFMGONHORZ-GFCCVEGCSA-N 1 2 316.367 4.104 20 0 DIADLO COc1ccc(F)c(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1Cl ZINC001245894805 1058602810 /nfs/dbraw/zinc/60/28/10/1058602810.db2.gz XWYXEGJKSVQEDZ-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO Cc1cc(C)c(C(=O)NCCCCCc2ccccc2)c(C)[nH+]1 ZINC001520490551 1058622502 /nfs/dbraw/zinc/62/25/02/1058622502.db2.gz HHQVFHUKFHIFSW-UHFFFAOYSA-N 1 2 310.441 4.150 20 0 DIADLO Cc1cccc(NC(=O)[C@@H](c2ccc(Cl)cc2)[NH+](C)C)c1F ZINC001520503437 1058625195 /nfs/dbraw/zinc/62/51/95/1058625195.db2.gz PKNRTUKXAVQOED-MRXNPFEDSA-N 1 2 320.795 4.029 20 0 DIADLO CC(C)C[C@@H](C)C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001529257331 1058657244 /nfs/dbraw/zinc/65/72/44/1058657244.db2.gz QDMNOEAOMOWCCN-CVEARBPZSA-N 1 2 319.493 4.026 20 0 DIADLO Cc1[nH+]c[nH]c1CC(=O)Nc1cccc(Sc2ccccc2)c1 ZINC001557545041 1058764543 /nfs/dbraw/zinc/76/45/43/1058764543.db2.gz SPHJHXQAAHBRHS-UHFFFAOYSA-N 1 2 323.421 4.051 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)C[C@H](C)C2CCCCC2)[nH+]c1C ZINC001558350994 1058859662 /nfs/dbraw/zinc/85/96/62/1058859662.db2.gz DPEOOJCFCOMILT-GUYCJALGSA-N 1 2 317.477 4.297 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)[C@H](C)[C@@H](C)C(C)(C)C)[nH+]c1C ZINC001558353224 1058859738 /nfs/dbraw/zinc/85/97/38/1058859738.db2.gz PMTDNIBMYSYGOT-JMSVASOKSA-N 1 2 305.466 4.008 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)[C@@H](C)[C@@H](C)C(C)(C)C)[nH+]c1C ZINC001558353226 1058859926 /nfs/dbraw/zinc/85/99/26/1058859926.db2.gz PMTDNIBMYSYGOT-ZOWXZIJZSA-N 1 2 305.466 4.008 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001558560264 1058885226 /nfs/dbraw/zinc/88/52/26/1058885226.db2.gz GQZOPUYHNKOVCZ-HNNXBMFYSA-N 1 2 305.466 4.146 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001558560264 1058885248 /nfs/dbraw/zinc/88/52/48/1058885248.db2.gz GQZOPUYHNKOVCZ-HNNXBMFYSA-N 1 2 305.466 4.146 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C2CCC2)C2CCCC2)c(C)[nH+]1 ZINC001530079538 1058929462 /nfs/dbraw/zinc/92/94/62/1058929462.db2.gz IJMMPRWHZVDMGF-GOSISDBHSA-N 1 2 300.446 4.096 20 0 DIADLO CCc1nc(N(Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)cc(C)[nH+]1 ZINC001559067004 1058963500 /nfs/dbraw/zinc/96/35/00/1058963500.db2.gz SMARECDWHQMHEK-MLGOLLRUSA-N 1 2 311.429 4.233 20 0 DIADLO CC[C@@H](Nc1cc(C)[nH+]c(C2CCC2)n1)c1nc(C)cs1 ZINC001559100792 1058988678 /nfs/dbraw/zinc/98/86/78/1058988678.db2.gz ZJCGIILPIXMMKV-CYBMUJFWSA-N 1 2 302.447 4.381 20 0 DIADLO CCc1ccccc1CNc1nc2ccccc2n2c[nH+]cc12 ZINC001559113844 1059002006 /nfs/dbraw/zinc/00/20/06/1059002006.db2.gz ZANBXDDZHCTAGV-UHFFFAOYSA-N 1 2 302.381 4.057 20 0 DIADLO CCCOC1(CNc2cc(CC)[nH+]c(CC)n2)CCCCC1 ZINC001559127263 1059016786 /nfs/dbraw/zinc/01/67/86/1059016786.db2.gz GHFFGOFLWUJWKN-UHFFFAOYSA-N 1 2 305.466 4.143 20 0 DIADLO CCS[C@@H]1CCC[C@@H](Nc2nc(C)[nH+]c3c2CCCC3)C1 ZINC001559127647 1059016954 /nfs/dbraw/zinc/01/69/54/1059016954.db2.gz RTDWOEXWYZVZGX-ZIAGYGMSSA-N 1 2 305.491 4.140 20 0 DIADLO CCS[C@H]1CCC[C@@H](Nc2nc(C)[nH+]c3c2CCCC3)C1 ZINC001559127645 1059017490 /nfs/dbraw/zinc/01/74/90/1059017490.db2.gz RTDWOEXWYZVZGX-KGLIPLIRSA-N 1 2 305.491 4.140 20 0 DIADLO CC[NH+](CC)[C@H](C(=O)Oc1cccc(Cl)c1)c1ccccc1 ZINC001530432149 1059042102 /nfs/dbraw/zinc/04/21/02/1059042102.db2.gz YCPMXLLNLYKTAV-KRWDZBQOSA-N 1 2 317.816 4.329 20 0 DIADLO Cc1nc(N2CC[C@@H]([C@@H]3CCCC3(C)C)C2)c2c([nH+]1)CCCC2 ZINC001559220244 1059099066 /nfs/dbraw/zinc/09/90/66/1059099066.db2.gz SXJBKUDUXCTGFC-WBVHZDCISA-N 1 2 313.489 4.316 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3cc(C)c(C)cc3Cl)ccn12 ZINC001522514300 1059108920 /nfs/dbraw/zinc/10/89/20/1059108920.db2.gz HQUKXRAEAZZARS-UHFFFAOYSA-N 1 2 313.788 4.165 20 0 DIADLO CCc1cc(NCC(CC)(CC)C(F)(F)F)nc(CC)[nH+]1 ZINC001559261727 1059128796 /nfs/dbraw/zinc/12/87/96/1059128796.db2.gz JUWFIMRJJXJVJN-UHFFFAOYSA-N 1 2 303.372 4.382 20 0 DIADLO Cc1nc(N2C[C@@H](c3ccccc3)CC2(C)C)c2c([nH+]1)CCCC2 ZINC001559293015 1059146023 /nfs/dbraw/zinc/14/60/23/1059146023.db2.gz NHOREGIRHIFXLH-KRWDZBQOSA-N 1 2 321.468 4.436 20 0 DIADLO CN(C)c1cc(COc2c(F)cc(Cl)cc2Cl)cc[nH+]1 ZINC001559428373 1059224715 /nfs/dbraw/zinc/22/47/15/1059224715.db2.gz FAFQWYIBZMTNQK-UHFFFAOYSA-N 1 2 315.175 4.173 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cccc(F)c2Cl)cc1F ZINC001559481116 1059254516 /nfs/dbraw/zinc/25/45/16/1059254516.db2.gz DTCVTMHLWLKRIS-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cccc(F)c2Cl)cc1F ZINC001559481116 1059254535 /nfs/dbraw/zinc/25/45/35/1059254535.db2.gz DTCVTMHLWLKRIS-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CC(C)CC[N@H+](Cc1c(F)c(F)c(F)c(F)c1F)C1CC1 ZINC001559482045 1059255130 /nfs/dbraw/zinc/25/51/30/1059255130.db2.gz NTZQJASEVCUSRH-UHFFFAOYSA-N 1 2 307.306 4.393 20 0 DIADLO CC(C)CC[N@@H+](Cc1c(F)c(F)c(F)c(F)c1F)C1CC1 ZINC001559482045 1059255149 /nfs/dbraw/zinc/25/51/49/1059255149.db2.gz NTZQJASEVCUSRH-UHFFFAOYSA-N 1 2 307.306 4.393 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2cccc(Br)c2)C[C@H](C)O1 ZINC001559544790 1059348503 /nfs/dbraw/zinc/34/85/03/1059348503.db2.gz HMVNQVMUZURIAP-SLEUVZQESA-N 1 2 312.251 4.009 20 0 DIADLO CC[C@@H]1C[N@H+]([C@@H](C)c2cccc(Br)c2)C[C@H](C)O1 ZINC001559544790 1059348516 /nfs/dbraw/zinc/34/85/16/1059348516.db2.gz HMVNQVMUZURIAP-SLEUVZQESA-N 1 2 312.251 4.009 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@H](C(C)C)CC1 ZINC001559546338 1059348633 /nfs/dbraw/zinc/34/86/33/1059348633.db2.gz TTZKNZRPHACBOX-YOEHRIQHSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H](C(C)C)CC1 ZINC001559546338 1059348649 /nfs/dbraw/zinc/34/86/49/1059348649.db2.gz TTZKNZRPHACBOX-YOEHRIQHSA-N 1 2 323.864 4.312 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@@H](C3CCCCC3)C2)c(C)[nH+]1 ZINC001531602521 1059363540 /nfs/dbraw/zinc/36/35/40/1059363540.db2.gz KVIALROFGYHICQ-QGZVFWFLSA-N 1 2 300.446 4.049 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@H](C3CCCCC3)C2)c(C)[nH+]1 ZINC001531602515 1059364390 /nfs/dbraw/zinc/36/43/90/1059364390.db2.gz KVIALROFGYHICQ-KRWDZBQOSA-N 1 2 300.446 4.049 20 0 DIADLO c1cc2cc(-c3noc([C@H]4CCCc5[nH]c[nH+]c54)n3)ccc2s1 ZINC001247273203 1059365302 /nfs/dbraw/zinc/36/53/02/1059365302.db2.gz SPOCTEIHFVKENY-LBPRGKRZSA-N 1 2 322.393 4.143 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2ncc(Br)cc2Cl)[C@H]1C ZINC001559559323 1059378195 /nfs/dbraw/zinc/37/81/95/1059378195.db2.gz ONOFHEICVMSHGQ-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2ncc(Br)cc2Cl)[C@H]1C ZINC001559559323 1059378217 /nfs/dbraw/zinc/37/82/17/1059378217.db2.gz ONOFHEICVMSHGQ-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO c1cn(-c2ccc(-c3noc(CC4CCCCC4)n3)cc2)c[nH+]1 ZINC001247383446 1059429018 /nfs/dbraw/zinc/42/90/18/1059429018.db2.gz DEJMIFPVCRGBTA-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)sn1 ZINC001559612671 1059445196 /nfs/dbraw/zinc/44/51/96/1059445196.db2.gz NCSXQUVJSZUORE-MRXNPFEDSA-N 1 2 308.397 4.457 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)sn1 ZINC001559612671 1059445215 /nfs/dbraw/zinc/44/52/15/1059445215.db2.gz NCSXQUVJSZUORE-MRXNPFEDSA-N 1 2 308.397 4.457 20 0 DIADLO CCCCC[N@H+](C)[C@H](C(=O)OC)c1ccc(Cl)c(Cl)c1 ZINC001559643500 1059468195 /nfs/dbraw/zinc/46/81/95/1059468195.db2.gz BBQFFEWTFPFXOC-AWEZNQCLSA-N 1 2 318.244 4.330 20 0 DIADLO CCCCC[N@@H+](C)[C@H](C(=O)OC)c1ccc(Cl)c(Cl)c1 ZINC001559643500 1059468200 /nfs/dbraw/zinc/46/82/00/1059468200.db2.gz BBQFFEWTFPFXOC-AWEZNQCLSA-N 1 2 318.244 4.330 20 0 DIADLO C[C@H]1CC[C@@](C)(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)C1(C)C ZINC001524208055 1059467595 /nfs/dbraw/zinc/46/75/95/1059467595.db2.gz ONHUKCVHMJSJJR-LIRRHRJNSA-N 1 2 311.429 4.273 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1ccnc(Cl)c1 ZINC001559658822 1059487932 /nfs/dbraw/zinc/48/79/32/1059487932.db2.gz SKVBENBWFCDCQM-RYUDHWBXSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1ccnc(Cl)c1 ZINC001559658822 1059487942 /nfs/dbraw/zinc/48/79/42/1059487942.db2.gz SKVBENBWFCDCQM-RYUDHWBXSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1Cc1ccnc(Cl)c1 ZINC001559658823 1059487976 /nfs/dbraw/zinc/48/79/76/1059487976.db2.gz SKVBENBWFCDCQM-VXGBXAGGSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1Cc1ccnc(Cl)c1 ZINC001559658823 1059487988 /nfs/dbraw/zinc/48/79/88/1059487988.db2.gz SKVBENBWFCDCQM-VXGBXAGGSA-N 1 2 304.796 4.382 20 0 DIADLO CCC[C@H](C(=O)OCC)[NH+]1CCC(=Cc2cccc(F)c2)CC1 ZINC001559664662 1059492145 /nfs/dbraw/zinc/49/21/45/1059492145.db2.gz OHVRLJNYNNIUJC-GOSISDBHSA-N 1 2 319.420 4.037 20 0 DIADLO Cc1ccc(N2CC[NH+]([C@@H](C)c3ccc(F)cc3F)CC2)cc1 ZINC001559671544 1059498653 /nfs/dbraw/zinc/49/86/53/1059498653.db2.gz VOZFLXUMYDVCAD-HNNXBMFYSA-N 1 2 316.395 4.156 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001559718750 1059548552 /nfs/dbraw/zinc/54/85/52/1059548552.db2.gz LELNSLDJCXAJPM-UHFFFAOYSA-N 1 2 308.450 4.448 20 0 DIADLO CSc1ccccc1C[N@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001559718750 1059548566 /nfs/dbraw/zinc/54/85/66/1059548566.db2.gz LELNSLDJCXAJPM-UHFFFAOYSA-N 1 2 308.450 4.448 20 0 DIADLO Clc1cccc(Cl)c1CC[N@@H+]1CCOCC12CCCC2 ZINC001559720817 1059549332 /nfs/dbraw/zinc/54/93/32/1059549332.db2.gz UXQOGTFPBWGIFM-UHFFFAOYSA-N 1 2 314.256 4.181 20 0 DIADLO Clc1cccc(Cl)c1CC[N@H+]1CCOCC12CCCC2 ZINC001559720817 1059549353 /nfs/dbraw/zinc/54/93/53/1059549353.db2.gz UXQOGTFPBWGIFM-UHFFFAOYSA-N 1 2 314.256 4.181 20 0 DIADLO COC(=O)[C@@H]([NH2+]Cc1cccc2ccccc21)C1CCCCC1 ZINC001559730292 1059561392 /nfs/dbraw/zinc/56/13/92/1059561392.db2.gz CNASCLBYKYIULX-IBGZPJMESA-N 1 2 311.425 4.051 20 0 DIADLO CCC[N@H+](C/C=C/c1ccc(Cl)cc1)CC(=O)OC(C)(C)C ZINC001559734378 1059567489 /nfs/dbraw/zinc/56/74/89/1059567489.db2.gz MXUXNSBDFYWWDL-VOTSOKGWSA-N 1 2 323.864 4.407 20 0 DIADLO CCC[N@@H+](C/C=C/c1ccc(Cl)cc1)CC(=O)OC(C)(C)C ZINC001559734378 1059567512 /nfs/dbraw/zinc/56/75/12/1059567512.db2.gz MXUXNSBDFYWWDL-VOTSOKGWSA-N 1 2 323.864 4.407 20 0 DIADLO CCOC(=O)[C@@H](CC)[N@H+](C/C=C\c1ccc(Cl)cc1)C1CC1 ZINC001559766039 1059600000 /nfs/dbraw/zinc/60/00/00/1059600000.db2.gz WMFGKFSVHFBYGV-KEGWNNHHSA-N 1 2 321.848 4.159 20 0 DIADLO CCOC(=O)[C@@H](CC)[N@@H+](C/C=C\c1ccc(Cl)cc1)C1CC1 ZINC001559766039 1059600019 /nfs/dbraw/zinc/60/00/19/1059600019.db2.gz WMFGKFSVHFBYGV-KEGWNNHHSA-N 1 2 321.848 4.159 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cscc1C(F)F ZINC001532358777 1059603561 /nfs/dbraw/zinc/60/35/61/1059603561.db2.gz ZYCILJCZZSUZBR-UHFFFAOYSA-N 1 2 319.336 4.124 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3F)C2)cc1 ZINC001559768352 1059604552 /nfs/dbraw/zinc/60/45/52/1059604552.db2.gz FKCNPIHCBWZONQ-IBGZPJMESA-N 1 2 317.379 4.101 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@H](c3ccc(F)cc3F)C2)cc1 ZINC001559768352 1059604559 /nfs/dbraw/zinc/60/45/59/1059604559.db2.gz FKCNPIHCBWZONQ-IBGZPJMESA-N 1 2 317.379 4.101 20 0 DIADLO CC1=C(Br)C[N@@H+]([C@@H]2C[C@@H]2c2cccc(F)c2)CC1 ZINC001559793694 1059628144 /nfs/dbraw/zinc/62/81/44/1059628144.db2.gz XXSBVULBBDKBNP-UKRRQHHQSA-N 1 2 310.210 4.056 20 0 DIADLO CC1=C(Br)C[N@H+]([C@@H]2C[C@@H]2c2cccc(F)c2)CC1 ZINC001559793694 1059628154 /nfs/dbraw/zinc/62/81/54/1059628154.db2.gz XXSBVULBBDKBNP-UKRRQHHQSA-N 1 2 310.210 4.056 20 0 DIADLO CC1=C(Br)C[N@@H+]([C@H]2C[C@H]2c2cccc(F)c2)CC1 ZINC001559793695 1059628999 /nfs/dbraw/zinc/62/89/99/1059628999.db2.gz XXSBVULBBDKBNP-ZFWWWQNUSA-N 1 2 310.210 4.056 20 0 DIADLO CC1=C(Br)C[N@H+]([C@H]2C[C@H]2c2cccc(F)c2)CC1 ZINC001559793695 1059629008 /nfs/dbraw/zinc/62/90/08/1059629008.db2.gz XXSBVULBBDKBNP-ZFWWWQNUSA-N 1 2 310.210 4.056 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ccns2)CC2CC2)c(Cl)c1 ZINC001559829510 1059662530 /nfs/dbraw/zinc/66/25/30/1059662530.db2.gz VNFNTUKORNQUDF-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ccns2)CC2CC2)c(Cl)c1 ZINC001559829510 1059662541 /nfs/dbraw/zinc/66/25/41/1059662541.db2.gz VNFNTUKORNQUDF-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO CC[C@]([NH2+]CC1CCCCCC1)(C(=O)OC)c1ccccc1 ZINC001559830786 1059665243 /nfs/dbraw/zinc/66/52/43/1059665243.db2.gz LIDXSJUOUYCNPB-LJQANCHMSA-N 1 2 303.446 4.025 20 0 DIADLO CCC1(CC)CCC(NC(=O)c2ccn3c(C)c[nH+]c3c2)CC1 ZINC001524887799 1059665766 /nfs/dbraw/zinc/66/57/66/1059665766.db2.gz OCIHJKLSMKJRRX-UHFFFAOYSA-N 1 2 313.445 4.122 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc(Cl)cc1C)CCO2 ZINC001559842874 1059670303 /nfs/dbraw/zinc/67/03/03/1059670303.db2.gz HFWVUPGUTKFQNE-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc(Cl)cc1C)CCO2 ZINC001559842874 1059670318 /nfs/dbraw/zinc/67/03/18/1059670318.db2.gz HFWVUPGUTKFQNE-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO CCCc1ccc(C[N@@H+]2C[C@H](C(F)(F)F)OC(C)(C)C2)cc1 ZINC001559858803 1059680224 /nfs/dbraw/zinc/68/02/24/1059680224.db2.gz KREJAPMVVIMEJF-OAHLLOKOSA-N 1 2 315.379 4.181 20 0 DIADLO CCCc1ccc(C[N@H+]2C[C@H](C(F)(F)F)OC(C)(C)C2)cc1 ZINC001559858803 1059680233 /nfs/dbraw/zinc/68/02/33/1059680233.db2.gz KREJAPMVVIMEJF-OAHLLOKOSA-N 1 2 315.379 4.181 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1cnc(Cl)s1)C(C)(C)C2 ZINC001559861012 1059682438 /nfs/dbraw/zinc/68/24/38/1059682438.db2.gz WXDIZYQRXGZBCB-UHFFFAOYSA-N 1 2 306.862 4.442 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1cnc(Cl)s1)C(C)(C)C2 ZINC001559861012 1059682443 /nfs/dbraw/zinc/68/24/43/1059682443.db2.gz WXDIZYQRXGZBCB-UHFFFAOYSA-N 1 2 306.862 4.442 20 0 DIADLO C[C@H]([NH2+]CC(=O)c1ccccc1F)c1ccc(F)cc1Cl ZINC001559862351 1059682737 /nfs/dbraw/zinc/68/27/37/1059682737.db2.gz NKTFOAHEUBWJJL-JTQLQIEISA-N 1 2 309.743 4.152 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2nc3ccc(C)cc3[nH]2)cc1 ZINC001559877466 1059696424 /nfs/dbraw/zinc/69/64/24/1059696424.db2.gz ZXFLAGZCNMCXMF-LJQANCHMSA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2nc3ccc(C)cc3[nH]2)cc1 ZINC001559877466 1059696433 /nfs/dbraw/zinc/69/64/33/1059696433.db2.gz ZXFLAGZCNMCXMF-LJQANCHMSA-N 1 2 321.424 4.217 20 0 DIADLO COc1c(C)c[nH+]c(CN2CCCc3ccc(C)c(F)c32)c1C ZINC001559892723 1059710496 /nfs/dbraw/zinc/71/04/96/1059710496.db2.gz XZIFACXXSGHYLL-UHFFFAOYSA-N 1 2 314.404 4.107 20 0 DIADLO CCSCC[N@@H+]1CCCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC001559891592 1059710967 /nfs/dbraw/zinc/71/09/67/1059710967.db2.gz MZCKMVJGTAQBJQ-HNNXBMFYSA-N 1 2 323.893 4.496 20 0 DIADLO CCSCC[N@H+]1CCCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC001559891592 1059710989 /nfs/dbraw/zinc/71/09/89/1059710989.db2.gz MZCKMVJGTAQBJQ-HNNXBMFYSA-N 1 2 323.893 4.496 20 0 DIADLO Cc1cccc(-c2noc([C@@H]3Cc4ccccc4C[N@H+]3C)n2)c1C ZINC001248121397 1059735555 /nfs/dbraw/zinc/73/55/55/1059735555.db2.gz WNXKLYNFJJNVEA-SFHVURJKSA-N 1 2 319.408 4.083 20 0 DIADLO Cc1cccc(-c2noc([C@@H]3Cc4ccccc4C[N@@H+]3C)n2)c1C ZINC001248121397 1059735580 /nfs/dbraw/zinc/73/55/80/1059735580.db2.gz WNXKLYNFJJNVEA-SFHVURJKSA-N 1 2 319.408 4.083 20 0 DIADLO CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)c1c(C)cc(C)[nH+]c1C ZINC001533021757 1059773670 /nfs/dbraw/zinc/77/36/70/1059773670.db2.gz NAUWEJGVMHZBDL-LJQANCHMSA-N 1 2 324.468 4.409 20 0 DIADLO CC(C)CC[N@@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC001559978066 1059785386 /nfs/dbraw/zinc/78/53/86/1059785386.db2.gz NMZDZURBSVVFMF-UHFFFAOYSA-N 1 2 321.262 4.335 20 0 DIADLO CC(C)CC[N@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC001559978066 1059785406 /nfs/dbraw/zinc/78/54/06/1059785406.db2.gz NMZDZURBSVVFMF-UHFFFAOYSA-N 1 2 321.262 4.335 20 0 DIADLO Fc1cc(F)cc([C@@H]2COCC[N@@H+]2CC2CCC3(CC3)CC2)c1 ZINC001560002566 1059807719 /nfs/dbraw/zinc/80/77/19/1059807719.db2.gz SMFUEBQATHGIMU-SFHVURJKSA-N 1 2 321.411 4.309 20 0 DIADLO Fc1cc(F)cc([C@@H]2COCC[N@H+]2CC2CCC3(CC3)CC2)c1 ZINC001560002566 1059807742 /nfs/dbraw/zinc/80/77/42/1059807742.db2.gz SMFUEBQATHGIMU-SFHVURJKSA-N 1 2 321.411 4.309 20 0 DIADLO Cc1cc(Cl)ccc1NC(=S)Nc1ccn2cc[nH+]c2c1 ZINC001248385549 1059810567 /nfs/dbraw/zinc/81/05/67/1059810567.db2.gz OQGLOQBCOBFOCG-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC001560012569 1059815335 /nfs/dbraw/zinc/81/53/35/1059815335.db2.gz YQKRJXQLSNJSQT-RHSMWYFYSA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@H+]1CCC[C@@H](C2CCC2)C1 ZINC001560012569 1059815363 /nfs/dbraw/zinc/81/53/63/1059815363.db2.gz YQKRJXQLSNJSQT-RHSMWYFYSA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)c1cc(Nc2ccc3c(C)cc[nH+]c3c2)cc(OC)c1 ZINC001248506070 1059859104 /nfs/dbraw/zinc/85/91/04/1059859104.db2.gz GQDLQWJDHBRFKF-UHFFFAOYSA-N 1 2 322.364 4.082 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(Cl)cc1Cl)c1cc2cnccc2o1 ZINC001560094247 1059904223 /nfs/dbraw/zinc/90/42/23/1059904223.db2.gz QGDHPTSXKARPSW-SECBINFHSA-N 1 2 322.195 4.380 20 0 DIADLO COc1c(C[N@H+]2CCCOC(C)(C)C2)ccc(Cl)c1Cl ZINC001248642194 1059920991 /nfs/dbraw/zinc/92/09/91/1059920991.db2.gz ZXFYNRXKOMVSJA-UHFFFAOYSA-N 1 2 318.244 4.003 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1c(C)cccc1Br ZINC001248613712 1059916154 /nfs/dbraw/zinc/91/61/54/1059916154.db2.gz OSSDZXYLBIBSEF-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1c(C)cccc1Br ZINC001248613712 1059916171 /nfs/dbraw/zinc/91/61/71/1059916171.db2.gz OSSDZXYLBIBSEF-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO COc1c(C[N@@H+]2CCCOC(C)(C)C2)ccc(Cl)c1Cl ZINC001248642194 1059920973 /nfs/dbraw/zinc/92/09/73/1059920973.db2.gz ZXFYNRXKOMVSJA-UHFFFAOYSA-N 1 2 318.244 4.003 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2Cc2ccc(Cl)c(F)c2)[nH+]c1C ZINC001560137552 1059939084 /nfs/dbraw/zinc/93/90/84/1059939084.db2.gz GVKYQYUMVHMIHV-HNNXBMFYSA-N 1 2 307.800 4.156 20 0 DIADLO CCCCCC[N@@H+](Cc1cc(C)n(C)n1)Cc1ccc(C)o1 ZINC001560159197 1059952623 /nfs/dbraw/zinc/95/26/23/1059952623.db2.gz KWAOZRPFVIVAQL-UHFFFAOYSA-N 1 2 303.450 4.212 20 0 DIADLO CCCCCC[N@H+](Cc1cc(C)n(C)n1)Cc1ccc(C)o1 ZINC001560159197 1059952644 /nfs/dbraw/zinc/95/26/44/1059952644.db2.gz KWAOZRPFVIVAQL-UHFFFAOYSA-N 1 2 303.450 4.212 20 0 DIADLO CCCC[N@H+](CC(=O)OCC(C)C)Cc1c(C)oc(C)c1C ZINC001560164053 1059959291 /nfs/dbraw/zinc/95/92/91/1059959291.db2.gz KFEDGGGOUFEALW-UHFFFAOYSA-N 1 2 309.450 4.006 20 0 DIADLO CCCC[N@@H+](CC(=O)OCC(C)C)Cc1c(C)oc(C)c1C ZINC001560164053 1059959311 /nfs/dbraw/zinc/95/93/11/1059959311.db2.gz KFEDGGGOUFEALW-UHFFFAOYSA-N 1 2 309.450 4.006 20 0 DIADLO C[N@H+](C/C=C/c1ccccc1)Cc1ncc(C(F)(F)F)cc1F ZINC001248790345 1059979903 /nfs/dbraw/zinc/97/99/03/1059979903.db2.gz NDOIPRDEOAGJFV-VMPITWQZSA-N 1 2 324.321 4.385 20 0 DIADLO C[N@@H+](C/C=C/c1ccccc1)Cc1ncc(C(F)(F)F)cc1F ZINC001248790345 1059979931 /nfs/dbraw/zinc/97/99/31/1059979931.db2.gz NDOIPRDEOAGJFV-VMPITWQZSA-N 1 2 324.321 4.385 20 0 DIADLO CC[C@@H](c1ccccc1)[N@H+](C)Cc1c(Cl)ccnc1OC ZINC001248795255 1059980478 /nfs/dbraw/zinc/98/04/78/1059980478.db2.gz WULWBNVDGAOWEH-INIZCTEOSA-N 1 2 304.821 4.327 20 0 DIADLO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1c(Cl)ccnc1OC ZINC001248795255 1059980491 /nfs/dbraw/zinc/98/04/91/1059980491.db2.gz WULWBNVDGAOWEH-INIZCTEOSA-N 1 2 304.821 4.327 20 0 DIADLO Cc1cc(C[NH+](Cc2cccnc2)Cc2cccnc2)cs1 ZINC001248803193 1059985713 /nfs/dbraw/zinc/98/57/13/1059985713.db2.gz KQDGJEYKUDJZQV-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO CC[C@@H](c1ccc(Br)cc1)[N@@H+]1CCC[C@@H](F)C1 ZINC001560205179 1059986340 /nfs/dbraw/zinc/98/63/40/1059986340.db2.gz NYGMNANRFLZGGR-KGLIPLIRSA-N 1 2 300.215 4.334 20 0 DIADLO CC[C@@H](c1ccc(Br)cc1)[N@H+]1CCC[C@@H](F)C1 ZINC001560205179 1059986365 /nfs/dbraw/zinc/98/63/65/1059986365.db2.gz NYGMNANRFLZGGR-KGLIPLIRSA-N 1 2 300.215 4.334 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1cnc2ccccc2c1Cl ZINC001248813225 1059990622 /nfs/dbraw/zinc/99/06/22/1059990622.db2.gz NEVQCZHDJRLOTM-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1cnc2ccccc2c1Cl ZINC001248813225 1059990642 /nfs/dbraw/zinc/99/06/42/1059990642.db2.gz NEVQCZHDJRLOTM-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO Clc1c(C[N@@H+]2CCC[C@@H]2c2cnccn2)cnc2ccccc12 ZINC001248813490 1059991176 /nfs/dbraw/zinc/99/11/76/1059991176.db2.gz ZDYDWPVUUTVERY-QGZVFWFLSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1c(C[N@H+]2CCC[C@@H]2c2cnccn2)cnc2ccccc12 ZINC001248813490 1059991201 /nfs/dbraw/zinc/99/12/01/1059991201.db2.gz ZDYDWPVUUTVERY-QGZVFWFLSA-N 1 2 324.815 4.015 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cnc2ccccc2c1Cl ZINC001248813309 1059993765 /nfs/dbraw/zinc/99/37/65/1059993765.db2.gz QXFBDTICXRNQNF-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cnc2ccccc2c1Cl ZINC001248813309 1059993786 /nfs/dbraw/zinc/99/37/86/1059993786.db2.gz QXFBDTICXRNQNF-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO Cc1cccnc1[C@@H](C)[NH2+]Cc1csc(Cc2ccccc2)n1 ZINC001560220710 1059997555 /nfs/dbraw/zinc/99/75/55/1059997555.db2.gz DJYVMBZDDVPOES-OAHLLOKOSA-N 1 2 323.465 4.288 20 0 DIADLO FC(F)(F)c1cccc2c1C[N@H+](Cc1ccc3n1CCC3)CC2 ZINC001248824193 1060002049 /nfs/dbraw/zinc/00/20/49/1060002049.db2.gz CLRAEXNXUXBBKK-UHFFFAOYSA-N 1 2 320.358 4.011 20 0 DIADLO FC(F)(F)c1cccc2c1C[N@@H+](Cc1ccc3n1CCC3)CC2 ZINC001248824193 1060002070 /nfs/dbraw/zinc/00/20/70/1060002070.db2.gz CLRAEXNXUXBBKK-UHFFFAOYSA-N 1 2 320.358 4.011 20 0 DIADLO COc1ccc(C)cc1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC001560246836 1060011146 /nfs/dbraw/zinc/01/11/46/1060011146.db2.gz RMAMJQLFDLDYGX-OAQYLSRUSA-N 1 2 318.420 4.278 20 0 DIADLO Cc1ccc2[nH]c(C[NH+]3CCC(c4ccccc4F)CC3)nc2c1 ZINC001248842253 1060016220 /nfs/dbraw/zinc/01/62/20/1060016220.db2.gz MMLRVQHLEMULHW-UHFFFAOYSA-N 1 2 323.415 4.390 20 0 DIADLO Cc1ccc2nc(C[NH+]3CCC(c4ccccc4F)CC3)[nH]c2c1 ZINC001248842253 1060016250 /nfs/dbraw/zinc/01/62/50/1060016250.db2.gz MMLRVQHLEMULHW-UHFFFAOYSA-N 1 2 323.415 4.390 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)c(C)n1)Cc1cccc(F)c1F ZINC001248871810 1060028086 /nfs/dbraw/zinc/02/80/86/1060028086.db2.gz ISQWEFHPFWRRAS-UHFFFAOYSA-N 1 2 310.775 4.344 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)c(C)n1)Cc1cccc(F)c1F ZINC001248871810 1060028102 /nfs/dbraw/zinc/02/81/02/1060028102.db2.gz ISQWEFHPFWRRAS-UHFFFAOYSA-N 1 2 310.775 4.344 20 0 DIADLO Cc1cc(C)c(C(=O)NCCc2csc3ccccc23)c(C)[nH+]1 ZINC001525805325 1060038368 /nfs/dbraw/zinc/03/83/68/1060038368.db2.gz ALYYLMKXXTUVNS-UHFFFAOYSA-N 1 2 324.449 4.194 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NC/C=C\c1ccc(F)c(F)c1 ZINC001560277306 1060053578 /nfs/dbraw/zinc/05/35/78/1060053578.db2.gz OXXLLLNMUHTMRO-PLNGDYQASA-N 1 2 302.368 4.465 20 0 DIADLO FC(F)Oc1cccc(NCc2cc(-n3cc[nH+]c3)cs2)c1 ZINC001560280493 1060057518 /nfs/dbraw/zinc/05/75/18/1060057518.db2.gz VWSYZJXWIVXYSD-UHFFFAOYSA-N 1 2 321.352 4.147 20 0 DIADLO Cc1cccn2c(CNc3cccc(OC(F)(F)F)c3)c[nH+]c12 ZINC001560280087 1060057826 /nfs/dbraw/zinc/05/78/26/1060057826.db2.gz PNQXGGGHBZEAHV-UHFFFAOYSA-N 1 2 321.302 4.153 20 0 DIADLO Cc1ccc(-c2noc([C@H]([NH3+])c3ccc(Cl)cc3)n2)c(C)c1 ZINC001248997432 1060103167 /nfs/dbraw/zinc/10/31/67/1060103167.db2.gz IGBCYHNXYXCWMY-OAHLLOKOSA-N 1 2 313.788 4.055 20 0 DIADLO Cc1cccc(-c2noc([C@@H]([NH3+])c3ccc(Cl)cc3)n2)c1C ZINC001248998009 1060103715 /nfs/dbraw/zinc/10/37/15/1060103715.db2.gz HAYKHQNQHPATEZ-HNNXBMFYSA-N 1 2 313.788 4.055 20 0 DIADLO Cc1cc(C[N@H+](C)C/C=C/c2ccccc2)c(Cl)nc1C ZINC001249027527 1060117867 /nfs/dbraw/zinc/11/78/67/1060117867.db2.gz ASXDMCDJJMGDJS-JXMROGBWSA-N 1 2 300.833 4.497 20 0 DIADLO Cc1cc(C[N@@H+](C)C/C=C/c2ccccc2)c(Cl)nc1C ZINC001249027527 1060117870 /nfs/dbraw/zinc/11/78/70/1060117870.db2.gz ASXDMCDJJMGDJS-JXMROGBWSA-N 1 2 300.833 4.497 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1cc(C)c(C)nc1Cl)C2 ZINC001249042013 1060129024 /nfs/dbraw/zinc/12/90/24/1060129024.db2.gz BDAZWGAXABPCLJ-UHFFFAOYSA-N 1 2 300.833 4.219 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1cc(C)c(C)nc1Cl)C2 ZINC001249042013 1060129031 /nfs/dbraw/zinc/12/90/31/1060129031.db2.gz BDAZWGAXABPCLJ-UHFFFAOYSA-N 1 2 300.833 4.219 20 0 DIADLO Cc1cccc(-c2noc([C@@H]([NH3+])c3cccc(Cl)c3)n2)c1C ZINC001249067550 1060141609 /nfs/dbraw/zinc/14/16/09/1060141609.db2.gz NKNWSTUXAJBROO-HNNXBMFYSA-N 1 2 313.788 4.055 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2cc(C)ccc2OC)on1 ZINC001560356282 1060143289 /nfs/dbraw/zinc/14/32/89/1060143289.db2.gz IUWRUEZSHGTOPV-UHFFFAOYSA-N 1 2 302.418 4.185 20 0 DIADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1sc(Cl)c2ccccc21 ZINC001249075384 1060146662 /nfs/dbraw/zinc/14/66/62/1060146662.db2.gz LDMFGQLPDHHMGF-CQSZACIVSA-N 1 2 307.846 4.498 20 0 DIADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1sc(Cl)c2ccccc21 ZINC001249075384 1060146667 /nfs/dbraw/zinc/14/66/67/1060146667.db2.gz LDMFGQLPDHHMGF-CQSZACIVSA-N 1 2 307.846 4.498 20 0 DIADLO Cc1cc(C[NH2+]Cc2csc(-c3ccco3)n2)cnc1Cl ZINC001560374347 1060160657 /nfs/dbraw/zinc/16/06/57/1060160657.db2.gz ZAOKMSOBOJZJMV-UHFFFAOYSA-N 1 2 319.817 4.050 20 0 DIADLO Clc1cc(NCc2ccc3c(n2)CCC3)ccc1-n1cc[nH+]c1 ZINC001560383508 1060169583 /nfs/dbraw/zinc/16/95/83/1060169583.db2.gz FOHXSBNCWBIHSE-UHFFFAOYSA-N 1 2 324.815 4.022 20 0 DIADLO CCCCc1ccc(-c2noc([C@H]3[NH2+]Cc4ccccc43)n2)cc1 ZINC001249132817 1060169577 /nfs/dbraw/zinc/16/95/77/1060169577.db2.gz LEWXKYZJPVTXNL-SFHVURJKSA-N 1 2 319.408 4.272 20 0 DIADLO c1ccc([C@@H]2C[C@H]2C[NH2+]c2ccc(N3CCSCC3)cc2)cc1 ZINC001560389528 1060173947 /nfs/dbraw/zinc/17/39/47/1060173947.db2.gz AGUAEMHTKGRTPS-PXNSSMCTSA-N 1 2 324.493 4.455 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3cc(O)cc(Cl)c3)ccc21 ZINC001560389724 1060176545 /nfs/dbraw/zinc/17/65/45/1060176545.db2.gz KTVTZVLHJPXIBG-UHFFFAOYSA-N 1 2 302.805 4.040 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3cc(O)cc(Cl)c3)ccc21 ZINC001560389724 1060176549 /nfs/dbraw/zinc/17/65/49/1060176549.db2.gz KTVTZVLHJPXIBG-UHFFFAOYSA-N 1 2 302.805 4.040 20 0 DIADLO CCOc1cccc(CNc2c[nH+]ccc2OC(C)(C)C)c1 ZINC001560425508 1060210248 /nfs/dbraw/zinc/21/02/48/1060210248.db2.gz MGYDQPLAJRIFSD-UHFFFAOYSA-N 1 2 300.402 4.270 20 0 DIADLO CC[N@@H+](Cc1csc(-c2ccncc2)n1)Cc1cccs1 ZINC001249304967 1060214604 /nfs/dbraw/zinc/21/46/04/1060214604.db2.gz ISUJLAVNNFJHBF-UHFFFAOYSA-N 1 2 315.467 4.289 20 0 DIADLO CC[N@H+](Cc1csc(-c2ccncc2)n1)Cc1cccs1 ZINC001249304967 1060214621 /nfs/dbraw/zinc/21/46/21/1060214621.db2.gz ISUJLAVNNFJHBF-UHFFFAOYSA-N 1 2 315.467 4.289 20 0 DIADLO Cc1cccn2c(CNc3ccc(OC(C)C)cc3F)c[nH+]c12 ZINC001560428483 1060215646 /nfs/dbraw/zinc/21/56/46/1060215646.db2.gz RQZCUTWWEJEVEK-UHFFFAOYSA-N 1 2 313.376 4.181 20 0 DIADLO Cc1ccc(-c2noc([C@@H]([NH3+])c3ccc4ccccc4c3)n2)cc1 ZINC001249325969 1060218817 /nfs/dbraw/zinc/21/88/17/1060218817.db2.gz RPCZATOKRWSWSP-SFHVURJKSA-N 1 2 315.376 4.246 20 0 DIADLO CC[N@H+](Cc1ccccc1)Cc1ccc(C)nc1Br ZINC001249416248 1060240816 /nfs/dbraw/zinc/24/08/16/1060240816.db2.gz FPVLDDPZRYPXHX-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccccc1)Cc1ccc(C)nc1Br ZINC001249416248 1060240834 /nfs/dbraw/zinc/24/08/34/1060240834.db2.gz FPVLDDPZRYPXHX-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ccc(C)nc2Br)c1 ZINC001249416667 1060243327 /nfs/dbraw/zinc/24/33/27/1060243327.db2.gz VEEJIRHAGZYEHY-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ccc(C)nc2Br)c1 ZINC001249416667 1060243348 /nfs/dbraw/zinc/24/33/48/1060243348.db2.gz VEEJIRHAGZYEHY-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO CCc1c(NCc2cc(C)[nH+]c(C)c2)cnn1-c1cccc(C)c1 ZINC001560460374 1060250183 /nfs/dbraw/zinc/25/01/83/1060250183.db2.gz XDKHIXDMNYQVSM-UHFFFAOYSA-N 1 2 320.440 4.367 20 0 DIADLO Fc1ccccc1[C@@H]1CCC[N@@H+]1Cc1nc(C2CC2)cs1 ZINC001249528966 1060276371 /nfs/dbraw/zinc/27/63/71/1060276371.db2.gz KRFRZNCPDHBUJJ-INIZCTEOSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1ccccc1[C@@H]1CCC[N@H+]1Cc1nc(C2CC2)cs1 ZINC001249528966 1060276385 /nfs/dbraw/zinc/27/63/85/1060276385.db2.gz KRFRZNCPDHBUJJ-INIZCTEOSA-N 1 2 302.418 4.497 20 0 DIADLO Cc1n[nH]cc1CNc1ccc2[nH]c(-c3ccc(F)cc3)[nH+]c2c1 ZINC001560497013 1060292860 /nfs/dbraw/zinc/29/28/60/1060292860.db2.gz VYBYSKUKZFIOLK-UHFFFAOYSA-N 1 2 321.359 4.013 20 0 DIADLO FC(F)(F)c1c[nH+]ccc1Nc1cc(C2CCCCC2)no1 ZINC001249583521 1060299499 /nfs/dbraw/zinc/29/94/99/1060299499.db2.gz JXIRJVVLPBAPMV-UHFFFAOYSA-N 1 2 311.307 4.302 20 0 DIADLO CC(C)(C)c1cc(=[NH+]c2ccncc2C(F)(F)F)s[nH]1 ZINC001249586329 1060302881 /nfs/dbraw/zinc/30/28/81/1060302881.db2.gz OBVHLHHHRMDYDG-UHFFFAOYSA-N 1 2 301.337 4.020 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(N(C)c2ccccc2)cc1)c1csnn1 ZINC001560507939 1060303244 /nfs/dbraw/zinc/30/32/44/1060303244.db2.gz GXRGVTRJZBOHLP-AWEZNQCLSA-N 1 2 324.453 4.157 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc2oc3ccccc3c2c1)c1csnn1 ZINC001560508435 1060305871 /nfs/dbraw/zinc/30/58/71/1060305871.db2.gz VVNAAKLZELMTCW-LLVKDONJSA-N 1 2 309.394 4.288 20 0 DIADLO Cc1cc(CNc2ccc(N(C)C)c(F)c2)c2c([nH+]1)CCCC2 ZINC001560565767 1060375650 /nfs/dbraw/zinc/37/56/50/1060375650.db2.gz QAUDXXXLYCPDFU-UHFFFAOYSA-N 1 2 313.420 4.086 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)OCc3cc4ccccc4s3)ccn12 ZINC001526958387 1060392579 /nfs/dbraw/zinc/39/25/79/1060392579.db2.gz FGAODCPIKNQBDS-UHFFFAOYSA-N 1 2 322.389 4.214 20 0 DIADLO Fc1ccc(/C=C\C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)c(F)c1 ZINC001560588474 1060400615 /nfs/dbraw/zinc/40/06/15/1060400615.db2.gz XSBAEJNAQVMDAS-OIWWRSOPSA-N 1 2 319.326 4.039 20 0 DIADLO Cc1cc(F)c(C[NH2+]Cc2nc3ccc(F)cc3s2)c(F)c1 ZINC001560600421 1060412133 /nfs/dbraw/zinc/41/21/33/1060412133.db2.gz JYXQZDHEMXZJOO-UHFFFAOYSA-N 1 2 322.355 4.312 20 0 DIADLO COC(=O)c1cc(Nc2ccc(-n3cc[nH+]c3)cc2)c(C)cc1C ZINC001249813100 1060413310 /nfs/dbraw/zinc/41/33/10/1060413310.db2.gz MLGWSVKTXWSANS-UHFFFAOYSA-N 1 2 321.380 4.019 20 0 DIADLO Cc1ccc2[nH]c(Nc3cccc(Cn4cc[nH+]c4)c3)cc2c1 ZINC001249846260 1060417790 /nfs/dbraw/zinc/41/77/90/1060417790.db2.gz PSRVBVPMIAFIMH-UHFFFAOYSA-N 1 2 302.381 4.465 20 0 DIADLO Cc1cccnc1[C@@H](C)[NH2+]Cc1ccsc1Br ZINC001560618878 1060432187 /nfs/dbraw/zinc/43/21/87/1060432187.db2.gz ZIGNLPBRCVTWAQ-SNVBAGLBSA-N 1 2 311.248 4.065 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1c(F)cccc1F ZINC001560622884 1060435367 /nfs/dbraw/zinc/43/53/67/1060435367.db2.gz OBSAHVAVCJCSBC-UHFFFAOYSA-N 1 2 305.303 4.086 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@H]2CCC[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC001527119019 1060439683 /nfs/dbraw/zinc/43/96/83/1060439683.db2.gz UXRKPBPZQWPBQR-RTBURBONSA-N 1 2 322.452 4.321 20 0 DIADLO Cc1c(F)cc(Br)c(C[N@@H+]2CCC[C@@H]3C[C@@H]32)c1F ZINC001249877278 1060439987 /nfs/dbraw/zinc/43/99/87/1060439987.db2.gz BLONELNMETVPHT-RNCFNFMXSA-N 1 2 316.189 4.020 20 0 DIADLO Cc1c(F)cc(Br)c(C[N@H+]2CCC[C@@H]3C[C@@H]32)c1F ZINC001249877278 1060440001 /nfs/dbraw/zinc/44/00/01/1060440001.db2.gz BLONELNMETVPHT-RNCFNFMXSA-N 1 2 316.189 4.020 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1cc(F)c(OC)cc1OC ZINC001560639352 1060455318 /nfs/dbraw/zinc/45/53/18/1060455318.db2.gz UYWKVENDZMRJHX-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1cc(F)c(OC)cc1OC ZINC001560639352 1060455326 /nfs/dbraw/zinc/45/53/26/1060455326.db2.gz UYWKVENDZMRJHX-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1C[C@@H](C)C[C@H]1c1ccccc1F ZINC001560641885 1060458929 /nfs/dbraw/zinc/45/89/29/1060458929.db2.gz DJWHICPERLECMO-WFASDCNBSA-N 1 2 321.827 4.279 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1F ZINC001560641885 1060458936 /nfs/dbraw/zinc/45/89/36/1060458936.db2.gz DJWHICPERLECMO-WFASDCNBSA-N 1 2 321.827 4.279 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001535108037 1060463830 /nfs/dbraw/zinc/46/38/30/1060463830.db2.gz JARHDJZMBZKWIN-HUUCEWRRSA-N 1 2 319.408 4.262 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(Cc3ccccc3)C(C)(C)C)ccn12 ZINC001527224917 1060468749 /nfs/dbraw/zinc/46/87/49/1060468749.db2.gz XRZOEDWDSCTVRN-UHFFFAOYSA-N 1 2 321.424 4.084 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)nc1C ZINC001249914706 1060477170 /nfs/dbraw/zinc/47/71/70/1060477170.db2.gz VPDDGEBAFWTOBC-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)nc1C ZINC001249914706 1060477179 /nfs/dbraw/zinc/47/71/79/1060477179.db2.gz VPDDGEBAFWTOBC-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO Cc1cc(C)c(NC(=O)CC(C)(C)c2ccc(F)cc2)c(C)[nH+]1 ZINC001535174301 1060478885 /nfs/dbraw/zinc/47/88/85/1060478885.db2.gz PIXVTWRXKBDAMR-UHFFFAOYSA-N 1 2 314.404 4.452 20 0 DIADLO Cc1cc(C)c(NC(=O)c2oc(C3CC3)nc2C(F)F)c(C)[nH+]1 ZINC001535174701 1060479320 /nfs/dbraw/zinc/47/93/20/1060479320.db2.gz TVQLQRRRULRLSD-UHFFFAOYSA-N 1 2 321.327 4.062 20 0 DIADLO c1coc(-c2ccc(Nc3ccc[nH+]c3N3CCCCC3)cc2)n1 ZINC001249924870 1060482766 /nfs/dbraw/zinc/48/27/66/1060482766.db2.gz OXLKHFKIUQSOJS-UHFFFAOYSA-N 1 2 320.396 4.471 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2F)[C@H](C)C1 ZINC001249944390 1060497378 /nfs/dbraw/zinc/49/73/78/1060497378.db2.gz XPKMNUFQUXCGMI-BXKDBHETSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)[C@H](C)C1 ZINC001249944390 1060497391 /nfs/dbraw/zinc/49/73/91/1060497391.db2.gz XPKMNUFQUXCGMI-BXKDBHETSA-N 1 2 306.208 4.132 20 0 DIADLO C[N@@H+](Cc1c(F)c(Cl)ccc1Br)C1CCC1 ZINC001560672745 1060508119 /nfs/dbraw/zinc/50/81/19/1060508119.db2.gz RGGPVLNRQMOLRM-UHFFFAOYSA-N 1 2 306.606 4.226 20 0 DIADLO C[N@H+](Cc1c(F)c(Cl)ccc1Br)C1CCC1 ZINC001560672745 1060508102 /nfs/dbraw/zinc/50/81/02/1060508102.db2.gz RGGPVLNRQMOLRM-UHFFFAOYSA-N 1 2 306.606 4.226 20 0 DIADLO COc1ccc(F)cc1C[N@@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC001560692262 1060541799 /nfs/dbraw/zinc/54/17/99/1060541799.db2.gz SFXCCEKLJJOBAV-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)cc1C[N@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC001560692262 1060541813 /nfs/dbraw/zinc/54/18/13/1060541813.db2.gz SFXCCEKLJJOBAV-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO Oc1cc(F)c(Nc2cccc(Cn3cc[nH+]c3)c2)cc1Cl ZINC001250024134 1060550727 /nfs/dbraw/zinc/55/07/27/1060550727.db2.gz SUROSULQRJTXDU-UHFFFAOYSA-N 1 2 317.751 4.173 20 0 DIADLO CC1(C)[C@@H]2C[N@@H+](Cc3cnc(Cl)c(Cl)c3Cl)C[C@@H]21 ZINC001250034218 1060559902 /nfs/dbraw/zinc/55/99/02/1060559902.db2.gz RTPAIKLBONDTLF-DTORHVGOSA-N 1 2 305.636 4.130 20 0 DIADLO CC1(C)[C@@H]2C[N@H+](Cc3cnc(Cl)c(Cl)c3Cl)C[C@@H]21 ZINC001250034218 1060559918 /nfs/dbraw/zinc/55/99/18/1060559918.db2.gz RTPAIKLBONDTLF-DTORHVGOSA-N 1 2 305.636 4.130 20 0 DIADLO COc1cncc(C[N@H+](Cc2ccco2)Cc2ccccc2)c1C ZINC001560713374 1060569627 /nfs/dbraw/zinc/56/96/27/1060569627.db2.gz QIAPYZVHSWYNDN-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1cncc(C[N@@H+](Cc2ccco2)Cc2ccccc2)c1C ZINC001560713374 1060569644 /nfs/dbraw/zinc/56/96/44/1060569644.db2.gz QIAPYZVHSWYNDN-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cccc(Oc2ccccn2)c1 ZINC001560720337 1060582880 /nfs/dbraw/zinc/58/28/80/1060582880.db2.gz RLYOBGBPHMTUNA-MRXNPFEDSA-N 1 2 319.408 4.252 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cccc(Oc2ccccn2)c1 ZINC001560720337 1060582899 /nfs/dbraw/zinc/58/28/99/1060582899.db2.gz RLYOBGBPHMTUNA-MRXNPFEDSA-N 1 2 319.408 4.252 20 0 DIADLO COc1cc(Nc2ccc(C)[nH+]c2C)ccc1OC(F)(F)F ZINC001250076606 1060590601 /nfs/dbraw/zinc/59/06/01/1060590601.db2.gz BNYZFPOVSPPKPA-UHFFFAOYSA-N 1 2 312.291 4.349 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@@H+]1CCCc1c(Cl)cccc1Cl ZINC001560726716 1060593335 /nfs/dbraw/zinc/59/33/35/1060593335.db2.gz BIFQQYJUIDJRMR-OLZOCXBDSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@H+]1CCCc1c(Cl)cccc1Cl ZINC001560726716 1060593353 /nfs/dbraw/zinc/59/33/53/1060593353.db2.gz BIFQQYJUIDJRMR-OLZOCXBDSA-N 1 2 316.272 4.425 20 0 DIADLO Cn1cc(C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)c(Cl)n1 ZINC001560728899 1060594209 /nfs/dbraw/zinc/59/42/09/1060594209.db2.gz NDQKOJGZHZQCBK-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1cc(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)c(Cl)n1 ZINC001560728899 1060594226 /nfs/dbraw/zinc/59/42/26/1060594226.db2.gz NDQKOJGZHZQCBK-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO C[N@H+](Cc1c(Cl)n[nH]c1C1CC1)Cc1cccc(Cl)c1 ZINC001560730433 1060596152 /nfs/dbraw/zinc/59/61/52/1060596152.db2.gz YHGRNBKAIFHLDF-UHFFFAOYSA-N 1 2 310.228 4.226 20 0 DIADLO C[N@@H+](Cc1c(Cl)n[nH]c1C1CC1)Cc1cccc(Cl)c1 ZINC001560730433 1060596164 /nfs/dbraw/zinc/59/61/64/1060596164.db2.gz YHGRNBKAIFHLDF-UHFFFAOYSA-N 1 2 310.228 4.226 20 0 DIADLO CC(C)c1cnc(C[N@H+](C)CCOc2ccc(Cl)cc2)s1 ZINC001560729612 1060598898 /nfs/dbraw/zinc/59/88/98/1060598898.db2.gz BWQBFHSYXOSIIF-UHFFFAOYSA-N 1 2 324.877 4.431 20 0 DIADLO CC(C)c1cnc(C[N@@H+](C)CCOc2ccc(Cl)cc2)s1 ZINC001560729612 1060598914 /nfs/dbraw/zinc/59/89/14/1060598914.db2.gz BWQBFHSYXOSIIF-UHFFFAOYSA-N 1 2 324.877 4.431 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(O)cc(Cl)c2)o1 ZINC001560732888 1060600962 /nfs/dbraw/zinc/60/09/62/1060600962.db2.gz GIGDPYGOZFKIHE-INIZCTEOSA-N 1 2 321.804 4.122 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cc(O)cc(Cl)c2)o1 ZINC001560732888 1060600966 /nfs/dbraw/zinc/60/09/66/1060600966.db2.gz GIGDPYGOZFKIHE-INIZCTEOSA-N 1 2 321.804 4.122 20 0 DIADLO COc1c(Cl)ccc(F)c1Nc1cccn2cc(C)[nH+]c12 ZINC001250099748 1060606454 /nfs/dbraw/zinc/60/64/54/1060606454.db2.gz UBUVQBNQECZAEX-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO FC(F)(F)c1ccccc1Cc1ccc[nH+]c1N1CCCC1 ZINC001250100353 1060609849 /nfs/dbraw/zinc/60/98/49/1060609849.db2.gz OINGCGVARYSDOR-UHFFFAOYSA-N 1 2 306.331 4.291 20 0 DIADLO C[N@H+](Cc1ccc(Oc2ccc(F)cc2)nc1)Cc1ccccn1 ZINC001560746594 1060613216 /nfs/dbraw/zinc/61/32/16/1060613216.db2.gz HDTBDJITNDGEGK-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[N@@H+](Cc1ccc(Oc2ccc(F)cc2)nc1)Cc1ccccn1 ZINC001560746594 1060613224 /nfs/dbraw/zinc/61/32/24/1060613224.db2.gz HDTBDJITNDGEGK-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Cc1[nH]nc(C[N@@H+]2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1C ZINC001560751271 1060617611 /nfs/dbraw/zinc/61/76/11/1060617611.db2.gz KPPLILMEEWMEKT-CQSZACIVSA-N 1 2 323.362 4.035 20 0 DIADLO Cc1[nH]nc(C[N@H+]2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1C ZINC001560751271 1060617625 /nfs/dbraw/zinc/61/76/25/1060617625.db2.gz KPPLILMEEWMEKT-CQSZACIVSA-N 1 2 323.362 4.035 20 0 DIADLO Fc1ccc(OCCCc2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001250117428 1060622724 /nfs/dbraw/zinc/62/27/24/1060622724.db2.gz ZTFCCWIQPVQTNY-UHFFFAOYSA-N 1 2 310.372 4.082 20 0 DIADLO Clc1ccc2c(cc3n2CC[N@H+](CC2CCSCC2)C3)c1 ZINC001560756649 1060623080 /nfs/dbraw/zinc/62/30/80/1060623080.db2.gz SFFGACZXKARSCG-UHFFFAOYSA-N 1 2 320.889 4.254 20 0 DIADLO Clc1ccc2c(cc3n2CC[N@@H+](CC2CCSCC2)C3)c1 ZINC001560756649 1060623088 /nfs/dbraw/zinc/62/30/88/1060623088.db2.gz SFFGACZXKARSCG-UHFFFAOYSA-N 1 2 320.889 4.254 20 0 DIADLO C[C@H](CC[NH2+][C@H](c1ncn[nH]1)C1CCCCC1)CC(C)(C)C ZINC001560759242 1060624370 /nfs/dbraw/zinc/62/43/70/1060624370.db2.gz WHPHIGZXXUTQFX-ZBFHGGJFSA-N 1 2 306.498 4.478 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@@H+]2CCC(F)(F)[C@H](C)C2)c(F)c1 ZINC001250142438 1060643247 /nfs/dbraw/zinc/64/32/47/1060643247.db2.gz NGMQWEQLNGSLGN-LLVKDONJSA-N 1 2 319.342 4.229 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@H+]2CCC(F)(F)[C@H](C)C2)c(F)c1 ZINC001250142438 1060643253 /nfs/dbraw/zinc/64/32/53/1060643253.db2.gz NGMQWEQLNGSLGN-LLVKDONJSA-N 1 2 319.342 4.229 20 0 DIADLO Cc1cc(Br)c(OC(C)C)c(C[N@@H+]2CC[C@H]2C)c1 ZINC001250155289 1060650139 /nfs/dbraw/zinc/65/01/39/1060650139.db2.gz MBSHJKBGCMXUMF-GFCCVEGCSA-N 1 2 312.251 4.139 20 0 DIADLO Cc1cc(Br)c(OC(C)C)c(C[N@H+]2CC[C@H]2C)c1 ZINC001250155289 1060650147 /nfs/dbraw/zinc/65/01/47/1060650147.db2.gz MBSHJKBGCMXUMF-GFCCVEGCSA-N 1 2 312.251 4.139 20 0 DIADLO CCCCCC[C@@H](C)Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001560798371 1060659193 /nfs/dbraw/zinc/65/91/93/1060659193.db2.gz FOBFBGLKYFPAJM-ZACQAIPSSA-N 1 2 319.493 4.466 20 0 DIADLO COc1c(F)c(Cl)ccc1Nc1ccccc1-n1cc[nH+]c1 ZINC001250190828 1060668625 /nfs/dbraw/zinc/66/86/25/1060668625.db2.gz DGDKHFWATAHAHW-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO CCc1cc(OC)ccc1C[N@H+](C)Cc1c(F)cccc1F ZINC001560847112 1060701773 /nfs/dbraw/zinc/70/17/73/1060701773.db2.gz IVEKQKCXXLVQBX-UHFFFAOYSA-N 1 2 305.368 4.168 20 0 DIADLO CCc1cc(OC)ccc1C[N@@H+](C)Cc1c(F)cccc1F ZINC001560847112 1060701789 /nfs/dbraw/zinc/70/17/89/1060701789.db2.gz IVEKQKCXXLVQBX-UHFFFAOYSA-N 1 2 305.368 4.168 20 0 DIADLO FC(F)(F)Oc1cccc(Cc2ccc[nH+]c2N2CCCC2)c1 ZINC001250222449 1060703048 /nfs/dbraw/zinc/70/30/48/1060703048.db2.gz NVUDKJUCHCFDCA-UHFFFAOYSA-N 1 2 322.330 4.171 20 0 DIADLO COc1ccc2oc(C[N@H+](C)Cc3c(F)cccc3F)cc2c1 ZINC001560847751 1060704933 /nfs/dbraw/zinc/70/49/33/1060704933.db2.gz UWBUFNIIQFWAQX-UHFFFAOYSA-N 1 2 317.335 4.352 20 0 DIADLO COc1ccc2oc(C[N@@H+](C)Cc3c(F)cccc3F)cc2c1 ZINC001560847751 1060704948 /nfs/dbraw/zinc/70/49/48/1060704948.db2.gz UWBUFNIIQFWAQX-UHFFFAOYSA-N 1 2 317.335 4.352 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2c(Cl)n[nH]c2C2CC2)c1C ZINC001560850198 1060708461 /nfs/dbraw/zinc/70/84/61/1060708461.db2.gz AIJXKVKDUQGCNJ-UHFFFAOYSA-N 1 2 303.837 4.189 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2c(Cl)n[nH]c2C2CC2)c1C ZINC001560850198 1060708465 /nfs/dbraw/zinc/70/84/65/1060708465.db2.gz AIJXKVKDUQGCNJ-UHFFFAOYSA-N 1 2 303.837 4.189 20 0 DIADLO COc1cc(C)ccc1C[N@@H+]1CCc2c(Cl)cc(F)cc2C1 ZINC001560860307 1060716880 /nfs/dbraw/zinc/71/68/80/1060716880.db2.gz IRSPUELLUYVXET-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO COc1cc(C)ccc1C[N@H+]1CCc2c(Cl)cc(F)cc2C1 ZINC001560860307 1060716897 /nfs/dbraw/zinc/71/68/97/1060716897.db2.gz IRSPUELLUYVXET-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO OCc1ccc(F)c(Nc2ccc([NH+]3CCCCC3)cc2)c1F ZINC001250255689 1060736917 /nfs/dbraw/zinc/73/69/17/1060736917.db2.gz LGSAWMCYNXIIPZ-UHFFFAOYSA-N 1 2 318.367 4.191 20 0 DIADLO COc1cc(Nc2cccn3cc(C)[nH+]c23)c(F)c(F)c1Cl ZINC001250262165 1060739093 /nfs/dbraw/zinc/73/90/93/1060739093.db2.gz FDOPOLMBABRUOY-UHFFFAOYSA-N 1 2 323.730 4.327 20 0 DIADLO COc1cc(Nc2ccc3c(c2)[nH+]cn3C)c(F)c(F)c1Cl ZINC001250265351 1060741321 /nfs/dbraw/zinc/74/13/21/1060741321.db2.gz FLXOSHTZOOTETR-UHFFFAOYSA-N 1 2 323.730 4.257 20 0 DIADLO C[N@H+](Cc1c(F)ccc(F)c1Cl)C1CC(OC(C)(C)C)C1 ZINC001560892204 1060754233 /nfs/dbraw/zinc/75/42/33/1060754233.db2.gz GZQPDENZVDNMJZ-UHFFFAOYSA-N 1 2 317.807 4.396 20 0 DIADLO C[N@@H+](Cc1c(F)ccc(F)c1Cl)C1CC(OC(C)(C)C)C1 ZINC001560892204 1060754245 /nfs/dbraw/zinc/75/42/45/1060754245.db2.gz GZQPDENZVDNMJZ-UHFFFAOYSA-N 1 2 317.807 4.396 20 0 DIADLO COC(=O)[C@@H](CC(C)(C)C)[NH2+]CCc1ccc(C(C)(C)C)cc1 ZINC001560901875 1060764000 /nfs/dbraw/zinc/76/40/00/1060764000.db2.gz GYJMDTWCFXLTPL-QGZVFWFLSA-N 1 2 319.489 4.094 20 0 DIADLO CC(C)(C)OC(=O)C[N@H+](Cc1coc2ccccc12)C1CCC1 ZINC001560909477 1060772234 /nfs/dbraw/zinc/77/22/34/1060772234.db2.gz WFYQPGBNOLTKQZ-UHFFFAOYSA-N 1 2 315.413 4.129 20 0 DIADLO CC(C)(C)OC(=O)C[N@@H+](Cc1coc2ccccc12)C1CCC1 ZINC001560909477 1060772242 /nfs/dbraw/zinc/77/22/42/1060772242.db2.gz WFYQPGBNOLTKQZ-UHFFFAOYSA-N 1 2 315.413 4.129 20 0 DIADLO FC(F)(F)c1cc(Cl)c(CCn2cc[nH+]c2)c(Cl)c1 ZINC001250320120 1060777290 /nfs/dbraw/zinc/77/72/90/1060777290.db2.gz IBTVDJLOXKARTF-UHFFFAOYSA-N 1 2 309.118 4.451 20 0 DIADLO CCOc1cc(C[N@H+](C)C/C=C/c2ccccc2)c(Cl)cn1 ZINC001250320144 1060778227 /nfs/dbraw/zinc/77/82/27/1060778227.db2.gz ZNGZDDJNXZCZRT-JXMROGBWSA-N 1 2 316.832 4.279 20 0 DIADLO CCOc1cc(C[N@@H+](C)C/C=C/c2ccccc2)c(Cl)cn1 ZINC001250320144 1060778234 /nfs/dbraw/zinc/77/82/34/1060778234.db2.gz ZNGZDDJNXZCZRT-JXMROGBWSA-N 1 2 316.832 4.279 20 0 DIADLO C[C@H]1CC(C[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)C[C@H](C)C1 ZINC001560924567 1060788137 /nfs/dbraw/zinc/78/81/37/1060788137.db2.gz LUQHUVBNMHFCFT-CPUCHLNUSA-N 1 2 304.482 4.088 20 0 DIADLO CCOc1nccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1Cl ZINC001250385843 1060791905 /nfs/dbraw/zinc/79/19/05/1060791905.db2.gz WEGPWAIBJZSTTI-OAHLLOKOSA-N 1 2 302.805 4.081 20 0 DIADLO CCOc1nccc(C[N@H+]2CC[C@@H]2c2ccccc2)c1Cl ZINC001250385843 1060791919 /nfs/dbraw/zinc/79/19/19/1060791919.db2.gz WEGPWAIBJZSTTI-OAHLLOKOSA-N 1 2 302.805 4.081 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@]2(C)C(=O)OC(C)(C)C)c1 ZINC001560957195 1060821419 /nfs/dbraw/zinc/82/14/19/1060821419.db2.gz YHYLYUFUVINTPB-SFHVURJKSA-N 1 2 323.864 4.345 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@]2(C)C(=O)OC(C)(C)C)c1 ZINC001560957195 1060821421 /nfs/dbraw/zinc/82/14/21/1060821421.db2.gz YHYLYUFUVINTPB-SFHVURJKSA-N 1 2 323.864 4.345 20 0 DIADLO CC(C)c1ccc(-c2[nH]c3ccc(N4CCOCC4)cc3[nH+]2)cc1 ZINC001250480356 1060837879 /nfs/dbraw/zinc/83/78/79/1060837879.db2.gz ZLGSSODVRKNDOK-UHFFFAOYSA-N 1 2 321.424 4.190 20 0 DIADLO C/C(=C/c1ccccc1C(F)(F)F)C[NH+]1CC(OC(C)C)C1 ZINC001560992558 1060853462 /nfs/dbraw/zinc/85/34/62/1060853462.db2.gz KGSDDMKRKKDJAQ-JYRVWZFOSA-N 1 2 313.363 4.218 20 0 DIADLO Fc1cc2[nH]c(-c3ccc4[nH]ccc4c3)nc2cc1-n1cc[nH+]c1 ZINC001250508335 1060861605 /nfs/dbraw/zinc/86/16/05/1060861605.db2.gz MBGTVWYQTKWAFK-UHFFFAOYSA-N 1 2 317.327 4.036 20 0 DIADLO CC[C@@H]1C[C@H]([NH2+][C@H](c2cccc(Cl)c2)C(F)F)CCO1 ZINC001561006869 1060865418 /nfs/dbraw/zinc/86/54/18/1060865418.db2.gz DKVQKBAPGLUGLP-MGPQQGTHSA-N 1 2 303.780 4.193 20 0 DIADLO COCC1(C[NH2+][C@@H](c2cccc(Cl)c2)C(F)F)CCC1 ZINC001561007051 1060866550 /nfs/dbraw/zinc/86/65/50/1060866550.db2.gz JFNWTZLPMXFVEW-ZDUSSCGKSA-N 1 2 303.780 4.053 20 0 DIADLO C[C@H](CC1CCC1)[NH2+][C@@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001561025334 1060879398 /nfs/dbraw/zinc/87/93/98/1060879398.db2.gz VMQLPXOTLHJUHE-QAPCUYQASA-N 1 2 317.473 4.108 20 0 DIADLO Cn1c(CCc2cccc(Cl)c2)[nH+]c2ccc(F)c(F)c21 ZINC001250553944 1060893950 /nfs/dbraw/zinc/89/39/50/1060893950.db2.gz SFIHBUMMADJDIW-UHFFFAOYSA-N 1 2 306.743 4.290 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cc(-c3ccccc3)n[nH]2)c(F)c1 ZINC001561041707 1060894487 /nfs/dbraw/zinc/89/44/87/1060894487.db2.gz BQLIKIQOCMKOTC-UHFFFAOYSA-N 1 2 309.388 4.156 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cc(-c3ccccc3)n[nH]2)c(F)c1 ZINC001561041707 1060894499 /nfs/dbraw/zinc/89/44/99/1060894499.db2.gz BQLIKIQOCMKOTC-UHFFFAOYSA-N 1 2 309.388 4.156 20 0 DIADLO CC(C)C1(O)CC[NH+](Cc2ccc(F)c(Cl)c2Cl)CC1 ZINC001561046235 1060896447 /nfs/dbraw/zinc/89/64/47/1060896447.db2.gz GHPDOFDZWJOKKF-UHFFFAOYSA-N 1 2 320.235 4.115 20 0 DIADLO C[C@H](c1nc2cc(-n3cc[nH+]c3)c(F)cc2[nH]1)c1ccccc1 ZINC001250562621 1060898186 /nfs/dbraw/zinc/89/81/86/1060898186.db2.gz NEMOWSHUKCVLSS-LBPRGKRZSA-N 1 2 306.344 4.040 20 0 DIADLO C[C@@H](c1nc2cc(-n3cc[nH+]c3)c(F)cc2[nH]1)c1ccccc1 ZINC001250562620 1060898279 /nfs/dbraw/zinc/89/82/79/1060898279.db2.gz NEMOWSHUKCVLSS-GFCCVEGCSA-N 1 2 306.344 4.040 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCO[C@H](C(C)(C)C)CC2)s1 ZINC001561052316 1060900736 /nfs/dbraw/zinc/90/07/36/1060900736.db2.gz YDWWKQXYJQIZJM-ZDUSSCGKSA-N 1 2 310.507 4.078 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCO[C@H](C(C)(C)C)CC2)s1 ZINC001561052316 1060900755 /nfs/dbraw/zinc/90/07/55/1060900755.db2.gz YDWWKQXYJQIZJM-ZDUSSCGKSA-N 1 2 310.507 4.078 20 0 DIADLO Cc1cc2[nH+]c(C3(c4ccccc4)CCOCC3)[nH]c2c(C)c1 ZINC001250567949 1060903610 /nfs/dbraw/zinc/90/36/10/1060903610.db2.gz PNPPVWIVFPZHIL-UHFFFAOYSA-N 1 2 306.409 4.276 20 0 DIADLO CCCCc1ccc2[nH]c(C3CCC4(CC3)OCCO4)[nH+]c2c1 ZINC001250597994 1060930593 /nfs/dbraw/zinc/93/05/93/1060930593.db2.gz ZRQARANFZQRFJL-UHFFFAOYSA-N 1 2 314.429 4.306 20 0 DIADLO CCOC(=O)CCCCCc1[nH+]c2ccc(F)c(F)c2n1CC ZINC001250611221 1060939897 /nfs/dbraw/zinc/93/98/97/1060939897.db2.gz DMVFZTANEWMOSE-UHFFFAOYSA-N 1 2 324.371 4.000 20 0 DIADLO COC(C)(C)Cc1[nH]c2ccc(OCc3ccccc3)cc2[nH+]1 ZINC001250614150 1060944541 /nfs/dbraw/zinc/94/45/41/1060944541.db2.gz YSGUSEWNRAQCBZ-UHFFFAOYSA-N 1 2 310.397 4.109 20 0 DIADLO O=C(C[NH+]1CCC(C2CCCC2)CC1)Nc1ccccc1Cl ZINC001473202710 1060963599 /nfs/dbraw/zinc/96/35/99/1060963599.db2.gz WDDGTZPCWGEURT-UHFFFAOYSA-N 1 2 320.864 4.181 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2cc3ccccc3[nH]2)c1Cl ZINC001473208681 1060975506 /nfs/dbraw/zinc/97/55/06/1060975506.db2.gz SSQBJJGZANLTBG-UHFFFAOYSA-N 1 2 314.816 4.462 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2cc3ccccc3[nH]2)c1Cl ZINC001473208681 1060975527 /nfs/dbraw/zinc/97/55/27/1060975527.db2.gz SSQBJJGZANLTBG-UHFFFAOYSA-N 1 2 314.816 4.462 20 0 DIADLO CC[C@H](CC(F)F)C[N@@H+]1CCCC[C@H]1c1noc(C(C)C)n1 ZINC001473207079 1060975571 /nfs/dbraw/zinc/97/55/71/1060975571.db2.gz XFOZHEKUIFCCKY-OLZOCXBDSA-N 1 2 315.408 4.401 20 0 DIADLO CC[C@H](CC(F)F)C[N@H+]1CCCC[C@H]1c1noc(C(C)C)n1 ZINC001473207079 1060975590 /nfs/dbraw/zinc/97/55/90/1060975590.db2.gz XFOZHEKUIFCCKY-OLZOCXBDSA-N 1 2 315.408 4.401 20 0 DIADLO CC[C@H](CC(F)F)C[N@@H+]1CCCC[C@@H]1c1noc(C(C)C)n1 ZINC001473207075 1060975947 /nfs/dbraw/zinc/97/59/47/1060975947.db2.gz XFOZHEKUIFCCKY-CHWSQXEVSA-N 1 2 315.408 4.401 20 0 DIADLO CC[C@H](CC(F)F)C[N@H+]1CCCC[C@@H]1c1noc(C(C)C)n1 ZINC001473207075 1060975969 /nfs/dbraw/zinc/97/59/69/1060975969.db2.gz XFOZHEKUIFCCKY-CHWSQXEVSA-N 1 2 315.408 4.401 20 0 DIADLO Fc1cccc2c1CC[C@H]2[N@@H+]1CCc2c(F)ccc(F)c2C1 ZINC001473210050 1060982225 /nfs/dbraw/zinc/98/22/25/1060982225.db2.gz BWEVKQXZVGMBTG-GOSISDBHSA-N 1 2 303.327 4.150 20 0 DIADLO Fc1cccc2c1CC[C@H]2[N@H+]1CCc2c(F)ccc(F)c2C1 ZINC001473210050 1060982250 /nfs/dbraw/zinc/98/22/50/1060982250.db2.gz BWEVKQXZVGMBTG-GOSISDBHSA-N 1 2 303.327 4.150 20 0 DIADLO Fc1cc(C[N@H+]2CC=C(c3cccc(Cl)c3)CC2)c(F)cn1 ZINC001462176443 1060995736 /nfs/dbraw/zinc/99/57/36/1060995736.db2.gz KDLVHMYJLGXJHT-UHFFFAOYSA-N 1 2 320.770 4.303 20 0 DIADLO Fc1cc(C[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)c(F)cn1 ZINC001462176443 1060995761 /nfs/dbraw/zinc/99/57/61/1060995761.db2.gz KDLVHMYJLGXJHT-UHFFFAOYSA-N 1 2 320.770 4.303 20 0 DIADLO C[C@@H]1CN(c2ccccc2F)CC[N@@H+]1Cc1cc(Cl)cs1 ZINC001462183528 1061006456 /nfs/dbraw/zinc/00/64/56/1061006456.db2.gz ZRQZICMRCNXERU-GFCCVEGCSA-N 1 2 324.852 4.251 20 0 DIADLO C[C@@H]1CN(c2ccccc2F)CC[N@H+]1Cc1cc(Cl)cs1 ZINC001462183528 1061006474 /nfs/dbraw/zinc/00/64/74/1061006474.db2.gz ZRQZICMRCNXERU-GFCCVEGCSA-N 1 2 324.852 4.251 20 0 DIADLO CC[N@H+](CC1CCC2(CC1)OCCO2)c1cc(C)cc(C)c1 ZINC001473231632 1061010318 /nfs/dbraw/zinc/01/03/18/1061010318.db2.gz OWSPSXUOBVTEME-UHFFFAOYSA-N 1 2 303.446 4.063 20 0 DIADLO CC[N@@H+](CC1CCC2(CC1)OCCO2)c1cc(C)cc(C)c1 ZINC001473231632 1061010338 /nfs/dbraw/zinc/01/03/38/1061010338.db2.gz OWSPSXUOBVTEME-UHFFFAOYSA-N 1 2 303.446 4.063 20 0 DIADLO Cc1c(-c2[nH]c3ccc(N(C)C)cc3[nH+]2)c2ccccc2n1C ZINC001250686932 1061016086 /nfs/dbraw/zinc/01/60/86/1061016086.db2.gz BMORHIUHKBOIQN-UHFFFAOYSA-N 1 2 304.397 4.096 20 0 DIADLO Cc1cn2cc(NC(=O)NCCCCCCC(C)C)ccc2[nH+]1 ZINC001562323062 1061029774 /nfs/dbraw/zinc/02/97/74/1061029774.db2.gz SZLKTVMFIMHJBL-UHFFFAOYSA-N 1 2 316.449 4.371 20 0 DIADLO COc1cc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)ccc1F ZINC001462222390 1061038581 /nfs/dbraw/zinc/03/85/81/1061038581.db2.gz CZXPJROWHUKEAR-MRXNPFEDSA-N 1 2 305.780 4.435 20 0 DIADLO COc1cc(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)ccc1F ZINC001462222390 1061038597 /nfs/dbraw/zinc/03/85/97/1061038597.db2.gz CZXPJROWHUKEAR-MRXNPFEDSA-N 1 2 305.780 4.435 20 0 DIADLO COc1cc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)ccc1F ZINC001462222387 1061039695 /nfs/dbraw/zinc/03/96/95/1061039695.db2.gz CZXPJROWHUKEAR-INIZCTEOSA-N 1 2 305.780 4.435 20 0 DIADLO COc1cc(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)ccc1F ZINC001462222387 1061039711 /nfs/dbraw/zinc/03/97/11/1061039711.db2.gz CZXPJROWHUKEAR-INIZCTEOSA-N 1 2 305.780 4.435 20 0 DIADLO CCc1ncc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)o1 ZINC001473288074 1061058339 /nfs/dbraw/zinc/05/83/39/1061058339.db2.gz NNKUPLWPQIIMQR-UHFFFAOYSA-N 1 2 302.805 4.180 20 0 DIADLO CCc1ncc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)o1 ZINC001473288074 1061058346 /nfs/dbraw/zinc/05/83/46/1061058346.db2.gz NNKUPLWPQIIMQR-UHFFFAOYSA-N 1 2 302.805 4.180 20 0 DIADLO CCCCc1ccc([C@@H]([NH2+]Cc2cnsn2)C(C)C)cc1 ZINC001473292906 1061060951 /nfs/dbraw/zinc/06/09/51/1061060951.db2.gz UCAVKQHPSKMZQN-KRWDZBQOSA-N 1 2 303.475 4.368 20 0 DIADLO CCn1c2cc(C)ccc2nc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001250771960 1061063241 /nfs/dbraw/zinc/06/32/41/1061063241.db2.gz JXBJAELKEYUHSI-UHFFFAOYSA-N 1 2 302.381 4.217 20 0 DIADLO CCn1c(-c2ccc(-n3cc[nH+]c3)cc2)nc2ccc(F)c(F)c21 ZINC001250772387 1061063361 /nfs/dbraw/zinc/06/33/61/1061063361.db2.gz SYSPTZAGYQUZEM-UHFFFAOYSA-N 1 2 324.334 4.187 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCc2c(F)cc(F)cc2C1 ZINC001473296745 1061065252 /nfs/dbraw/zinc/06/52/52/1061065252.db2.gz NOHAUPPVXAWMJN-UHFFFAOYSA-N 1 2 317.379 4.310 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCc2c(F)cc(F)cc2C1 ZINC001473296745 1061065260 /nfs/dbraw/zinc/06/52/60/1061065260.db2.gz NOHAUPPVXAWMJN-UHFFFAOYSA-N 1 2 317.379 4.310 20 0 DIADLO Cc1cc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)cnc1Cl ZINC001250787294 1061067228 /nfs/dbraw/zinc/06/72/28/1061067228.db2.gz GUDUHVVQEVACCL-UHFFFAOYSA-N 1 2 312.804 4.187 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2cccnc2Br)c1C ZINC001462282404 1061076153 /nfs/dbraw/zinc/07/61/53/1061076153.db2.gz XGZPYLUMTYQCKU-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2cccnc2Br)c1C ZINC001462282404 1061076164 /nfs/dbraw/zinc/07/61/64/1061076164.db2.gz XGZPYLUMTYQCKU-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cc(O)cc(C)c1-c1[nH]c2ccc(N3CCCC3)cc2[nH+]1 ZINC001250799824 1061075871 /nfs/dbraw/zinc/07/58/71/1061075871.db2.gz HIKGJMUACQAOPK-UHFFFAOYSA-N 1 2 307.397 4.153 20 0 DIADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@@H](c1ccccc1C)C1CC1 ZINC001473314729 1061080147 /nfs/dbraw/zinc/08/01/47/1061080147.db2.gz ZVMIMZWTBCJIQI-ZWKOTPCHSA-N 1 2 303.446 4.014 20 0 DIADLO CSc1ccc2nc(-c3ccccc3-n3cc[nH+]c3C)[nH]c2c1 ZINC001250837229 1061089888 /nfs/dbraw/zinc/08/98/88/1061089888.db2.gz WENANYWXHGYJQJ-UHFFFAOYSA-N 1 2 320.421 4.446 20 0 DIADLO CO[C@@H](C[N@@H+]1CCc2c3ccccc3[nH]c2C1)c1ccc(F)cc1 ZINC001473349328 1061105049 /nfs/dbraw/zinc/10/50/49/1061105049.db2.gz XUHPSUAZVYKFTN-FQEVSTJZSA-N 1 2 324.399 4.053 20 0 DIADLO CO[C@@H](C[N@H+]1CCc2c3ccccc3[nH]c2C1)c1ccc(F)cc1 ZINC001473349328 1061105056 /nfs/dbraw/zinc/10/50/56/1061105056.db2.gz XUHPSUAZVYKFTN-FQEVSTJZSA-N 1 2 324.399 4.053 20 0 DIADLO Cc1cccc(C[N@@H+](C)[C@H](C)c2ccncc2)c1Br ZINC001473352414 1061108037 /nfs/dbraw/zinc/10/80/37/1061108037.db2.gz JDXFDAHDRWQPBO-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cccc(C[N@H+](C)[C@H](C)c2ccncc2)c1Br ZINC001473352414 1061108044 /nfs/dbraw/zinc/10/80/44/1061108044.db2.gz JDXFDAHDRWQPBO-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO CCOC(=O)[C@@H](CC)[NH2+][C@H](C)c1sc2ccccc2c1C ZINC001473359715 1061111017 /nfs/dbraw/zinc/11/10/17/1061111017.db2.gz AZUISGSCQBZNGO-TZMCWYRMSA-N 1 2 305.443 4.202 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@H+](C/C=C/c1cccc(F)c1)C1CC1 ZINC001462339266 1061114811 /nfs/dbraw/zinc/11/48/11/1061114811.db2.gz XQEBEHRQHHEXNY-IZPAUZPXSA-N 1 2 319.420 4.034 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+](C/C=C/c1cccc(F)c1)C1CC1 ZINC001462339266 1061114819 /nfs/dbraw/zinc/11/48/19/1061114819.db2.gz XQEBEHRQHHEXNY-IZPAUZPXSA-N 1 2 319.420 4.034 20 0 DIADLO Fc1ccc(/C=C\CNc2ccc(N3CCCC3)c[nH+]2)cc1F ZINC001462363742 1061129722 /nfs/dbraw/zinc/12/97/22/1061129722.db2.gz KAUXPLHUYHXUQF-ARJAWSKDSA-N 1 2 315.367 4.085 20 0 DIADLO CCn1c(-c2cccc(-n3cc[nH+]c3)c2)nc2ccc(F)c(F)c21 ZINC001250940795 1061138130 /nfs/dbraw/zinc/13/81/30/1061138130.db2.gz YAFNXGMFWAXKIQ-UHFFFAOYSA-N 1 2 324.334 4.187 20 0 DIADLO FC(F)(F)Oc1cccc(CCNc2cc3cc[nH]c3c[nH+]2)c1 ZINC001462385924 1061141175 /nfs/dbraw/zinc/14/11/75/1061141175.db2.gz FMEILGZRIFEZAN-UHFFFAOYSA-N 1 2 321.302 4.116 20 0 DIADLO CC(C)(C)CNC(=O)C[N@@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC001473430378 1061154862 /nfs/dbraw/zinc/15/48/62/1061154862.db2.gz BYKVGJYXCAPXFG-MRXNPFEDSA-N 1 2 322.880 4.029 20 0 DIADLO CC(C)(C)CNC(=O)C[N@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC001473430378 1061154869 /nfs/dbraw/zinc/15/48/69/1061154869.db2.gz BYKVGJYXCAPXFG-MRXNPFEDSA-N 1 2 322.880 4.029 20 0 DIADLO CCCSc1ccc2[nH]c(-c3ccc4[nH+]ccn4c3)nc2c1 ZINC001250977307 1061155498 /nfs/dbraw/zinc/15/54/98/1061155498.db2.gz BGJQSKZUQGJWSJ-UHFFFAOYSA-N 1 2 308.410 4.380 20 0 DIADLO CCCOc1ccc2nc(-c3ccc4[nH+]ccn4c3)n(CC)c2c1 ZINC001250977271 1061156369 /nfs/dbraw/zinc/15/63/69/1061156369.db2.gz AJLGWXSZAWSNFK-UHFFFAOYSA-N 1 2 320.396 4.160 20 0 DIADLO c1cn2cc(-c3nc4ccccc4n3Cc3ccccc3)ccc2[nH+]1 ZINC001250979360 1061157359 /nfs/dbraw/zinc/15/73/59/1061157359.db2.gz ZWUYLYDAEAYXQC-UHFFFAOYSA-N 1 2 324.387 4.399 20 0 DIADLO Cc1ccc2c(c1)nc(-c1ccc3[nH+]ccn3c1)n2CC(C)C ZINC001250978257 1061158661 /nfs/dbraw/zinc/15/86/61/1061158661.db2.gz GCVWSDNZTSNFRW-UHFFFAOYSA-N 1 2 304.397 4.315 20 0 DIADLO Cc1cc(F)cc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)c1 ZINC001250988662 1061166897 /nfs/dbraw/zinc/16/68/97/1061166897.db2.gz CVTILUXUIQUJDH-UHFFFAOYSA-N 1 2 310.307 4.002 20 0 DIADLO C[C@@H](c1nc2ccc(Cl)cc2[nH]1)[N@H+](C)C[C@H]1CCC(C)(C)O1 ZINC001473483479 1061184615 /nfs/dbraw/zinc/18/46/15/1061184615.db2.gz JKNOOGZHXPHBJB-WCQYABFASA-N 1 2 321.852 4.167 20 0 DIADLO C[C@@H](c1nc2ccc(Cl)cc2[nH]1)[N@@H+](C)C[C@H]1CCC(C)(C)O1 ZINC001473483479 1061184621 /nfs/dbraw/zinc/18/46/21/1061184621.db2.gz JKNOOGZHXPHBJB-WCQYABFASA-N 1 2 321.852 4.167 20 0 DIADLO CCCc1cccc(C[N@H+]2C[C@@H](CC(F)(F)F)O[C@@H](C)C2)c1 ZINC001462458881 1061185522 /nfs/dbraw/zinc/18/55/22/1061185522.db2.gz WLEQPVYMLXUDKA-XJKSGUPXSA-N 1 2 315.379 4.181 20 0 DIADLO CCCc1cccc(C[N@@H+]2C[C@@H](CC(F)(F)F)O[C@@H](C)C2)c1 ZINC001462458881 1061185531 /nfs/dbraw/zinc/18/55/31/1061185531.db2.gz WLEQPVYMLXUDKA-XJKSGUPXSA-N 1 2 315.379 4.181 20 0 DIADLO CSc1ccc(OCC[N@H+](C)Cc2c(F)cccc2F)cc1 ZINC001473494912 1061190573 /nfs/dbraw/zinc/19/05/73/1061190573.db2.gz BPUPEHJVQQGCGM-UHFFFAOYSA-N 1 2 323.408 4.198 20 0 DIADLO CSc1ccc(OCC[N@@H+](C)Cc2c(F)cccc2F)cc1 ZINC001473494912 1061190576 /nfs/dbraw/zinc/19/05/76/1061190576.db2.gz BPUPEHJVQQGCGM-UHFFFAOYSA-N 1 2 323.408 4.198 20 0 DIADLO CSc1ccccc1-c1nc2cc(-n3cc[nH+]c3)c(F)cc2[nH]1 ZINC001251042080 1061197588 /nfs/dbraw/zinc/19/75/88/1061197588.db2.gz GIAIHHAODOFZKR-UHFFFAOYSA-N 1 2 324.384 4.277 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)CCSC2CCCCC2)c1C ZINC001473503748 1061201810 /nfs/dbraw/zinc/20/18/10/1061201810.db2.gz QXLVJBQKDWHWSS-UHFFFAOYSA-N 1 2 322.518 4.205 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(Cl)ccc2Cl)[C@H]1[C@H]1CCCO1 ZINC001473523364 1061220342 /nfs/dbraw/zinc/22/03/42/1061220342.db2.gz QIRJMCRTNUVMHJ-CABCVRRESA-N 1 2 314.256 4.383 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(Cl)ccc2Cl)[C@H]1[C@H]1CCCO1 ZINC001473523364 1061220358 /nfs/dbraw/zinc/22/03/58/1061220358.db2.gz QIRJMCRTNUVMHJ-CABCVRRESA-N 1 2 314.256 4.383 20 0 DIADLO CSc1cc(C)c(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)cn1 ZINC001251091633 1061230935 /nfs/dbraw/zinc/23/09/35/1061230935.db2.gz KKAXIGHLYYYABF-UHFFFAOYSA-N 1 2 324.453 4.255 20 0 DIADLO CCCCC[C@H](C)CC(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001455770319 1061232756 /nfs/dbraw/zinc/23/27/56/1061232756.db2.gz MBSXGQGOGWHLKO-BBRMVZONSA-N 1 2 305.466 4.297 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1nc2ccccc2n1Cc1ccccc1 ZINC001251092082 1061235412 /nfs/dbraw/zinc/23/54/12/1061235412.db2.gz ORBBDQRNRCJYFB-UHFFFAOYSA-N 1 2 314.392 4.037 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1nc2cc(Oc3ccccc3)ccc2[nH]1 ZINC001251092809 1061236413 /nfs/dbraw/zinc/23/64/13/1061236413.db2.gz XXMFHMQXBPANBK-UHFFFAOYSA-N 1 2 316.364 4.308 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[C@H](Nc1c[nH+]c(C)c(C)c1)CC3 ZINC001462534997 1061243971 /nfs/dbraw/zinc/24/39/71/1061243971.db2.gz HDEACOBKSQPJAB-OAHLLOKOSA-N 1 2 305.425 4.458 20 0 DIADLO CC(C)(C)OC(=O)CC[C@@H]1CCCC[N@@H+]1C/C(Cl)=C\Cl ZINC001473575225 1061262370 /nfs/dbraw/zinc/26/23/70/1061262370.db2.gz OFRFAWJBVZVOJN-XSNHNAGMSA-N 1 2 322.276 4.282 20 0 DIADLO CC(C)(C)OC(=O)CC[C@@H]1CCCC[N@H+]1C/C(Cl)=C\Cl ZINC001473575225 1061262387 /nfs/dbraw/zinc/26/23/87/1061262387.db2.gz OFRFAWJBVZVOJN-XSNHNAGMSA-N 1 2 322.276 4.282 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3cncc(-c4ccccc4)c3)[nH+]c2c1 ZINC001251229090 1061279199 /nfs/dbraw/zinc/27/91/99/1061279199.db2.gz IIHDACLMXLNTEE-UHFFFAOYSA-N 1 2 314.392 4.358 20 0 DIADLO COC(=O)[C@H]([NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1)c1cccc2ccccc21 ZINC001462590661 1061282392 /nfs/dbraw/zinc/28/23/92/1061282392.db2.gz XIMZJDYJXBPYEL-DOHHPOSVSA-N 1 2 323.436 4.222 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1cc(F)ccc1OC(F)F)CC2 ZINC001473624266 1061298360 /nfs/dbraw/zinc/29/83/60/1061298360.db2.gz RIAYCGJAPGAFNI-UHFFFAOYSA-N 1 2 321.342 4.294 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1cc(F)ccc1OC(F)F)CC2 ZINC001473624266 1061298381 /nfs/dbraw/zinc/29/83/81/1061298381.db2.gz RIAYCGJAPGAFNI-UHFFFAOYSA-N 1 2 321.342 4.294 20 0 DIADLO CCCCC[C@H](C)[NH2+][C@@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001462618022 1061301878 /nfs/dbraw/zinc/30/18/78/1061301878.db2.gz KGNINPASNBOSOB-WMZOPIPTSA-N 1 2 319.489 4.498 20 0 DIADLO C[N@H+](Cc1cnc[nH]1)Cc1cccc(SCc2ccccc2)c1 ZINC001473635960 1061308077 /nfs/dbraw/zinc/30/80/77/1061308077.db2.gz JKWPCZWLVYIKLX-UHFFFAOYSA-N 1 2 323.465 4.334 20 0 DIADLO C[N@@H+](Cc1cnc[nH]1)Cc1cccc(SCc2ccccc2)c1 ZINC001473635960 1061308091 /nfs/dbraw/zinc/30/80/91/1061308091.db2.gz JKWPCZWLVYIKLX-UHFFFAOYSA-N 1 2 323.465 4.334 20 0 DIADLO C[N@H+](Cc1c[nH]cn1)Cc1cccc(SCc2ccccc2)c1 ZINC001473635960 1061308106 /nfs/dbraw/zinc/30/81/06/1061308106.db2.gz JKWPCZWLVYIKLX-UHFFFAOYSA-N 1 2 323.465 4.334 20 0 DIADLO C[N@@H+](Cc1c[nH]cn1)Cc1cccc(SCc2ccccc2)c1 ZINC001473635960 1061308121 /nfs/dbraw/zinc/30/81/21/1061308121.db2.gz JKWPCZWLVYIKLX-UHFFFAOYSA-N 1 2 323.465 4.334 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+]1CCc2ccsc2C1 ZINC001462634513 1061310520 /nfs/dbraw/zinc/31/05/20/1061310520.db2.gz JKPIMZVJUWLBJZ-UHFFFAOYSA-N 1 2 307.846 4.359 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+]1CCc2ccsc2C1 ZINC001462634513 1061310532 /nfs/dbraw/zinc/31/05/32/1061310532.db2.gz JKPIMZVJUWLBJZ-UHFFFAOYSA-N 1 2 307.846 4.359 20 0 DIADLO CCCSc1ccc2[nH]c(-c3cccc4[nH+]ccn43)nc2c1 ZINC001251326759 1061316038 /nfs/dbraw/zinc/31/60/38/1061316038.db2.gz WJVVUQVXGGGYQD-UHFFFAOYSA-N 1 2 308.410 4.380 20 0 DIADLO CSCCCn1c2ccccc2nc1-c1cccc2[nH+]ccn21 ZINC001251326650 1061316687 /nfs/dbraw/zinc/31/66/87/1061316687.db2.gz RIEXBMCQXGLMFN-UHFFFAOYSA-N 1 2 322.437 4.104 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccc4nc(Cl)ccc4c3)[nH+]c2c1 ZINC001251346016 1061328317 /nfs/dbraw/zinc/32/83/17/1061328317.db2.gz CIHNJVZPWOJJDG-UHFFFAOYSA-N 1 2 322.799 4.498 20 0 DIADLO COCCCC1(CNc2[nH+]c3ccccc3n2C2CC2)CCC1 ZINC001462680241 1061333704 /nfs/dbraw/zinc/33/37/04/1061333704.db2.gz DIMXBHDGAYMXLK-UHFFFAOYSA-N 1 2 313.445 4.380 20 0 DIADLO CCOC(=O)[C@H](Cc1ccccc1)[NH2+]CCCC1CCCCC1 ZINC001473698533 1061354423 /nfs/dbraw/zinc/35/44/23/1061354423.db2.gz REGVLAWDAOQFEB-IBGZPJMESA-N 1 2 317.473 4.111 20 0 DIADLO CCc1noc(C)c1C[N@@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001473710076 1061362562 /nfs/dbraw/zinc/36/25/62/1061362562.db2.gz NGMAIFDNCTXTPI-UHFFFAOYSA-N 1 2 324.346 4.123 20 0 DIADLO CCc1noc(C)c1C[N@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001473710076 1061362578 /nfs/dbraw/zinc/36/25/78/1061362578.db2.gz NGMAIFDNCTXTPI-UHFFFAOYSA-N 1 2 324.346 4.123 20 0 DIADLO COc1ccc(CN2CCC[C@@H]2c2[nH]c(C)c(C)[nH+]2)cc1Cl ZINC001473790570 1061412029 /nfs/dbraw/zinc/41/20/29/1061412029.db2.gz KUHJPVRFUWUSLB-OAHLLOKOSA-N 1 2 319.836 4.026 20 0 DIADLO Cl/C=C(/Cl)C[N@@H+]1CCC[C@H](c2nc3c(s2)CCC3)C1 ZINC001473805353 1061414268 /nfs/dbraw/zinc/41/42/68/1061414268.db2.gz CUOAABWONJPWCJ-VUBLIPMDSA-N 1 2 317.285 4.130 20 0 DIADLO Cl/C=C(/Cl)C[N@H+]1CCC[C@H](c2nc3c(s2)CCC3)C1 ZINC001473805353 1061414275 /nfs/dbraw/zinc/41/42/75/1061414275.db2.gz CUOAABWONJPWCJ-VUBLIPMDSA-N 1 2 317.285 4.130 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@@H]3CCCc4cc(F)ccc43)ccn12 ZINC001457268362 1061430733 /nfs/dbraw/zinc/43/07/33/1061430733.db2.gz HXULURQNBGUNHH-QGZVFWFLSA-N 1 2 324.355 4.016 20 0 DIADLO CC(C)=CC[N@@H+]1CCc2c(Cl)ccc(Br)c2C1 ZINC001473844647 1061432552 /nfs/dbraw/zinc/43/25/52/1061432552.db2.gz KAWSOYNWLSDLGY-UHFFFAOYSA-N 1 2 314.654 4.427 20 0 DIADLO CC(C)=CC[N@H+]1CCc2c(Cl)ccc(Br)c2C1 ZINC001473844647 1061432556 /nfs/dbraw/zinc/43/25/56/1061432556.db2.gz KAWSOYNWLSDLGY-UHFFFAOYSA-N 1 2 314.654 4.427 20 0 DIADLO C[C@@]1(C2CC2)COCC[N@@H+]1CCc1cccc(Cl)c1Cl ZINC001473865919 1061439897 /nfs/dbraw/zinc/43/98/97/1061439897.db2.gz ZMTFLUGTUZUCCR-INIZCTEOSA-N 1 2 314.256 4.037 20 0 DIADLO C[C@@]1(C2CC2)COCC[N@H+]1CCc1cccc(Cl)c1Cl ZINC001473865919 1061439906 /nfs/dbraw/zinc/43/99/06/1061439906.db2.gz ZMTFLUGTUZUCCR-INIZCTEOSA-N 1 2 314.256 4.037 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3cc(O)ccc3C2)sc1C(C)(C)C ZINC001473901218 1061452658 /nfs/dbraw/zinc/45/26/58/1061452658.db2.gz HUPVSQLZTUBCTR-UHFFFAOYSA-N 1 2 316.470 4.013 20 0 DIADLO Cc1nc(C[N@H+]2CCc3cc(O)ccc3C2)sc1C(C)(C)C ZINC001473901218 1061452667 /nfs/dbraw/zinc/45/26/67/1061452667.db2.gz HUPVSQLZTUBCTR-UHFFFAOYSA-N 1 2 316.470 4.013 20 0 DIADLO CCCCOc1ccc(NCc2c[nH+]cn2CCC)c(C)c1 ZINC001473952151 1061494358 /nfs/dbraw/zinc/49/43/58/1061494358.db2.gz QLBYUOXBVIMBIO-UHFFFAOYSA-N 1 2 301.434 4.393 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N3CCCC[C@@H]3CCC(C)C)ccn12 ZINC001457900529 1061520520 /nfs/dbraw/zinc/52/05/20/1061520520.db2.gz BGNNCWIJPOXEIY-QGZVFWFLSA-N 1 2 313.445 4.074 20 0 DIADLO CC[N@@H+]1CCCC[C@@H]1C(=O)Nc1nc(C2CCCCC2)cs1 ZINC001457972153 1061530437 /nfs/dbraw/zinc/53/04/37/1061530437.db2.gz UOJFJVQUYDFKLU-OAHLLOKOSA-N 1 2 321.490 4.004 20 0 DIADLO CC[N@H+]1CCCC[C@@H]1C(=O)Nc1nc(C2CCCCC2)cs1 ZINC001457972153 1061530449 /nfs/dbraw/zinc/53/04/49/1061530449.db2.gz UOJFJVQUYDFKLU-OAHLLOKOSA-N 1 2 321.490 4.004 20 0 DIADLO CC[N@@H+]1CCCC[C@H]1C(=O)Nc1nc(C2CCCCC2)cs1 ZINC001457972152 1061530531 /nfs/dbraw/zinc/53/05/31/1061530531.db2.gz UOJFJVQUYDFKLU-HNNXBMFYSA-N 1 2 321.490 4.004 20 0 DIADLO CC[N@H+]1CCCC[C@H]1C(=O)Nc1nc(C2CCCCC2)cs1 ZINC001457972152 1061530547 /nfs/dbraw/zinc/53/05/47/1061530547.db2.gz UOJFJVQUYDFKLU-HNNXBMFYSA-N 1 2 321.490 4.004 20 0 DIADLO O[C@H](CNc1cc(-c2cccc(F)c2)cc[nH+]1)c1ccccc1 ZINC001251978803 1061544512 /nfs/dbraw/zinc/54/45/12/1061544512.db2.gz XEGNIWCKCMWXPG-GOSISDBHSA-N 1 2 308.356 4.033 20 0 DIADLO O[C@@H](CNc1cc(-c2cccc(F)c2)cc[nH+]1)c1ccccc1 ZINC001251978804 1061544990 /nfs/dbraw/zinc/54/49/90/1061544990.db2.gz XEGNIWCKCMWXPG-SFHVURJKSA-N 1 2 308.356 4.033 20 0 DIADLO CCc1ccc(CN(C)c2nc3ccccc3n3c[nH+]cc23)cc1 ZINC001458056876 1061549134 /nfs/dbraw/zinc/54/91/34/1061549134.db2.gz FDJOOMBPRIRPEG-UHFFFAOYSA-N 1 2 316.408 4.081 20 0 DIADLO CCOCc1ccc(NCc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001474024989 1061564591 /nfs/dbraw/zinc/56/45/91/1061564591.db2.gz VAVSCJVWBYOKEX-UHFFFAOYSA-N 1 2 307.397 4.021 20 0 DIADLO Fc1c(Cl)cccc1C[NH2+]Cc1cn2cc(Cl)ccc2n1 ZINC001474030965 1061572787 /nfs/dbraw/zinc/57/27/87/1061572787.db2.gz CXBYUCVMADFWBL-UHFFFAOYSA-N 1 2 324.186 4.070 20 0 DIADLO CC(C)(C)[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1ccccc1 ZINC001464291707 1061572797 /nfs/dbraw/zinc/57/27/97/1061572797.db2.gz LFPFXBKGZCDBFI-QGZVFWFLSA-N 1 2 307.397 4.080 20 0 DIADLO CCCC[C@H](O)CNc1ccc(Oc2cc[nH+]c(C)c2)cc1 ZINC001252103445 1061573200 /nfs/dbraw/zinc/57/32/00/1061573200.db2.gz ZKCZDAFTNOOXPW-INIZCTEOSA-N 1 2 300.402 4.145 20 0 DIADLO C[C@@H]([NH2+]Cc1cc2cccnc2o1)c1c(F)cccc1Cl ZINC001474037364 1061579704 /nfs/dbraw/zinc/57/97/04/1061579704.db2.gz GBBUHVJSIBQDRW-SNVBAGLBSA-N 1 2 304.752 4.471 20 0 DIADLO CC1(C)CCC[C@H](CNc2ccccc2C[NH+]2CCOCC2)C1 ZINC001474057124 1061601798 /nfs/dbraw/zinc/60/17/98/1061601798.db2.gz SCVIPFPNEPASJG-KRWDZBQOSA-N 1 2 316.489 4.147 20 0 DIADLO Clc1cc(NCc2cc3cccnc3o2)ccc1-n1cc[nH+]c1 ZINC001474055183 1061603277 /nfs/dbraw/zinc/60/32/77/1061603277.db2.gz NWNDBCOJASGNOO-UHFFFAOYSA-N 1 2 324.771 4.279 20 0 DIADLO Cc1nc(N2CCC[C@H](c3ccccc3)CC2)c2c([nH+]1)CCCC2 ZINC001458155814 1061604755 /nfs/dbraw/zinc/60/47/55/1061604755.db2.gz FIDFRMJXCHZNNB-SFHVURJKSA-N 1 2 321.468 4.438 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c2c1CCC2 ZINC001464572326 1061607320 /nfs/dbraw/zinc/60/73/20/1061607320.db2.gz XRHCYPNORAKHST-UHFFFAOYSA-N 1 2 317.392 4.126 20 0 DIADLO CSCc1ccc(Nc2nc3ccccc3n3c[nH+]cc23)cc1 ZINC001458168612 1061610752 /nfs/dbraw/zinc/61/07/52/1061610752.db2.gz TUTNXFJFCMMLNJ-UHFFFAOYSA-N 1 2 320.421 4.489 20 0 DIADLO CCOc1cccc(CNc2ccc(-n3cc[nH+]c3)c(C)c2)c1 ZINC001474063440 1061610847 /nfs/dbraw/zinc/61/08/47/1061610847.db2.gz MUWGSWLYHJGHJX-UHFFFAOYSA-N 1 2 307.397 4.192 20 0 DIADLO CCSCc1cc[nH+]c(NCc2nccc3ccccc32)c1 ZINC001474071100 1061618174 /nfs/dbraw/zinc/61/81/74/1061618174.db2.gz WBBBMCRLRDFSIQ-UHFFFAOYSA-N 1 2 309.438 4.495 20 0 DIADLO Cc1cc(NC(=O)C2CC(C(C)(C)C)C2)ccc1-n1cc[nH+]c1 ZINC001464827992 1061637834 /nfs/dbraw/zinc/63/78/34/1061637834.db2.gz GRMZZDOGDKCRLB-UHFFFAOYSA-N 1 2 311.429 4.192 20 0 DIADLO Cc1nc(NCc2ccc3ccccc3c2)c2c([nH+]1)CCCC2 ZINC001458218824 1061640408 /nfs/dbraw/zinc/64/04/08/1061640408.db2.gz JSQRPYZQYFUVTP-UHFFFAOYSA-N 1 2 303.409 4.429 20 0 DIADLO Cc1ncoc1C[NH2+][C@@H](C)c1cc(Cl)ccc1OC(F)F ZINC001474099617 1061646052 /nfs/dbraw/zinc/64/60/52/1061646052.db2.gz NUCRIKOBIFWSCF-QMMMGPOBSA-N 1 2 316.735 4.089 20 0 DIADLO Cc1cc(N(C)[C@@H](C)Cc2ccsc2)nc(C2CCC2)[nH+]1 ZINC001458230984 1061649036 /nfs/dbraw/zinc/64/90/36/1061649036.db2.gz JERLAJSIHSYKLY-ZDUSSCGKSA-N 1 2 301.459 4.181 20 0 DIADLO CCc1cc(NC[C@H](OC)c2ccccc2Cl)nc(CC)[nH+]1 ZINC001458237368 1061653439 /nfs/dbraw/zinc/65/34/39/1061653439.db2.gz LOCSPZJLXNSERM-HNNXBMFYSA-N 1 2 319.836 4.054 20 0 DIADLO CCCCO[C@H]1C[C@H](Nc2cc(C)[nH+]c(C3CC3)n2)C1(C)C ZINC001458235857 1061653568 /nfs/dbraw/zinc/65/35/68/1061653568.db2.gz ZPPDDJWYUFLBKC-GJZGRUSLSA-N 1 2 303.450 4.058 20 0 DIADLO Cc1cc(CNc2cnc3c(c2)CCCC3)c2c([nH+]1)CCCC2 ZINC001474110097 1061658325 /nfs/dbraw/zinc/65/83/25/1061658325.db2.gz BOSQWSDFETVXOT-UHFFFAOYSA-N 1 2 307.441 4.155 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[NH2+][C@H]1COc2cc(F)cc(F)c21 ZINC001474109256 1061659418 /nfs/dbraw/zinc/65/94/18/1061659418.db2.gz GPWLBXNBWSRVDL-AWEZNQCLSA-N 1 2 321.367 4.387 20 0 DIADLO Cc1cc(N[C@@H]2COc3c2cccc3Cl)nc(C2CCC2)[nH+]1 ZINC001458250216 1061659747 /nfs/dbraw/zinc/65/97/47/1061659747.db2.gz ABODKQNDUCGJOT-CQSZACIVSA-N 1 2 315.804 4.252 20 0 DIADLO CCCn1c[nH+]cc1CNc1cc(Br)c(C)cc1C ZINC001474116664 1061666567 /nfs/dbraw/zinc/66/65/67/1061666567.db2.gz BXTZTGIODXLXED-UHFFFAOYSA-N 1 2 322.250 4.285 20 0 DIADLO Cc1cnc([C@H](C)CNc2cc(C)[nH+]c(C3CCC3)n2)s1 ZINC001458304092 1061686105 /nfs/dbraw/zinc/68/61/05/1061686105.db2.gz ASPVTWRBOIFFRW-SNVBAGLBSA-N 1 2 302.447 4.033 20 0 DIADLO CCc1nc(C[NH2+]Cc2cccc(Oc3ccccc3)c2)co1 ZINC001474149691 1061693373 /nfs/dbraw/zinc/69/33/73/1061693373.db2.gz RDTJEYMNSKPKBS-UHFFFAOYSA-N 1 2 308.381 4.319 20 0 DIADLO Cc1cc(C[NH2+]CC(F)(F)c2ccccc2)cc2cccnc12 ZINC001474165668 1061709719 /nfs/dbraw/zinc/70/97/19/1061709719.db2.gz ZFOHIMNNKBCBTB-UHFFFAOYSA-N 1 2 312.363 4.425 20 0 DIADLO Cc1cc(CNc2ccc(F)c(F)c2C)c2c([nH+]1)CCCC2 ZINC001474177966 1061725836 /nfs/dbraw/zinc/72/58/36/1061725836.db2.gz GUAATAAQMGLQOU-UHFFFAOYSA-N 1 2 302.368 4.468 20 0 DIADLO Cc1cc(N2CC(c3ccccc3)(C(C)C)C2)nc(C2CCC2)[nH+]1 ZINC001458440711 1061764010 /nfs/dbraw/zinc/76/40/10/1061764010.db2.gz YVBPVSXSWUEUJK-UHFFFAOYSA-N 1 2 321.468 4.467 20 0 DIADLO Cc1cc(C[NH2+][C@H](CCc2ccccc2)C(F)F)ccc1F ZINC001474209562 1061765879 /nfs/dbraw/zinc/76/58/79/1061765879.db2.gz FJRDGKPYEGJSSO-QGZVFWFLSA-N 1 2 307.359 4.490 20 0 DIADLO COc1ccc(C[NH2+]CC(F)(F)C(C)(C)C)cc1OC1CC1 ZINC001474218926 1061779242 /nfs/dbraw/zinc/77/92/42/1061779242.db2.gz UHWZFUTYCGDGSO-UHFFFAOYSA-N 1 2 313.388 4.007 20 0 DIADLO CCc1cc(OC)ccc1C[NH2+]CC(F)(F)c1ccccc1C ZINC001474222527 1061783201 /nfs/dbraw/zinc/78/32/01/1061783201.db2.gz DUWSEJDVCWSLLE-UHFFFAOYSA-N 1 2 319.395 4.448 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3c(C)ccc4cnccc43)n2c1 ZINC001474235985 1061796796 /nfs/dbraw/zinc/79/67/96/1061796796.db2.gz KSTZANGVKPAOCZ-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO C[C@](O)(CNc1cc[nH+]c2c(Cl)cccc12)c1ccccc1 ZINC001253092738 1061799471 /nfs/dbraw/zinc/79/94/71/1061799471.db2.gz KLIHBMHAMMVYDS-SFHVURJKSA-N 1 2 312.800 4.208 20 0 DIADLO FC[C@@H]([NH2+]Cc1cc2cc(Cl)cnc2o1)c1ccc(F)cc1 ZINC001474241779 1061804810 /nfs/dbraw/zinc/80/48/10/1061804810.db2.gz DAGLKKOIIWGHKI-OAHLLOKOSA-N 1 2 322.742 4.421 20 0 DIADLO COc1cccc2[nH]c(NCc3cc(C)c4ncccc4c3)[nH+]c21 ZINC001474254006 1061822659 /nfs/dbraw/zinc/82/26/59/1061822659.db2.gz IBHFOUQWRDVBRW-UHFFFAOYSA-N 1 2 318.380 4.040 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NCc1cccc(C(C)C)c1 ZINC001474253905 1061822860 /nfs/dbraw/zinc/82/28/60/1061822860.db2.gz RZJQOIDVBBQVKG-UHFFFAOYSA-N 1 2 323.440 4.418 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cccc4c3CCCC4)cc2[nH+]1 ZINC001465897123 1061834055 /nfs/dbraw/zinc/83/40/55/1061834055.db2.gz YGXBHOPWGSACSE-UHFFFAOYSA-N 1 2 305.381 4.002 20 0 DIADLO CCc1cc(NCc2nc3cc(C)ccc3s2)nc(CC)[nH+]1 ZINC001458555745 1061834043 /nfs/dbraw/zinc/83/40/43/1061834043.db2.gz IHSVLEZLXDPJGB-UHFFFAOYSA-N 1 2 312.442 4.132 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1c(F)cc(C)cc1F ZINC001474301151 1061870290 /nfs/dbraw/zinc/87/02/90/1061870290.db2.gz GGSINXKLOIQPSF-UHFFFAOYSA-N 1 2 319.330 4.394 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(O)c(F)c2F)[C@@H](c2ccco2)C1 ZINC001474319928 1061897599 /nfs/dbraw/zinc/89/75/99/1061897599.db2.gz SYLFNOKOVDBUES-DGCLKSJQSA-N 1 2 307.340 4.237 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(O)c(F)c2F)[C@@H](c2ccco2)C1 ZINC001474319928 1061897609 /nfs/dbraw/zinc/89/76/09/1061897609.db2.gz SYLFNOKOVDBUES-DGCLKSJQSA-N 1 2 307.340 4.237 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC001474323970 1061910258 /nfs/dbraw/zinc/91/02/58/1061910258.db2.gz JTZNUITWIOCJSX-IUODEOHRSA-N 1 2 321.827 4.279 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC001474323970 1061910282 /nfs/dbraw/zinc/91/02/82/1061910282.db2.gz JTZNUITWIOCJSX-IUODEOHRSA-N 1 2 321.827 4.279 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2cnn(C)c2Cl)o1 ZINC001474326438 1061913487 /nfs/dbraw/zinc/91/34/87/1061913487.db2.gz DQQOPWXIVFBRLC-SWLSCSKDSA-N 1 2 321.852 4.202 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2cnn(C)c2Cl)o1 ZINC001474326438 1061913501 /nfs/dbraw/zinc/91/35/01/1061913501.db2.gz DQQOPWXIVFBRLC-SWLSCSKDSA-N 1 2 321.852 4.202 20 0 DIADLO CN(C)c1cc[nH+]c(NC(=O)c2ccc(C3CCCCC3)cc2)c1 ZINC001466377546 1061930901 /nfs/dbraw/zinc/93/09/01/1061930901.db2.gz XCSRAUPAEMKURO-UHFFFAOYSA-N 1 2 323.440 4.448 20 0 DIADLO C[C@H](CCC1CCCCC1)NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001466417320 1061935845 /nfs/dbraw/zinc/93/58/45/1061935845.db2.gz CYNOMXICGHKVBM-CQSZACIVSA-N 1 2 314.433 4.205 20 0 DIADLO Cc1ccc(F)c(OCc2c[nH+]c(N(C)C)c3ccccc23)c1 ZINC001458963080 1061958895 /nfs/dbraw/zinc/95/88/95/1061958895.db2.gz YAAVCPZNBNKBGP-UHFFFAOYSA-N 1 2 310.372 4.327 20 0 DIADLO Clc1ccc(-c2cccc(C[N@@H+]3CCc4c[nH]nc4C3)c2)cc1 ZINC001474360837 1061984711 /nfs/dbraw/zinc/98/47/11/1061984711.db2.gz GLHQGVNIPDSAEB-UHFFFAOYSA-N 1 2 323.827 4.288 20 0 DIADLO Clc1ccc(-c2cccc(C[N@H+]3CCc4c[nH]nc4C3)c2)cc1 ZINC001474360837 1061984732 /nfs/dbraw/zinc/98/47/32/1061984732.db2.gz GLHQGVNIPDSAEB-UHFFFAOYSA-N 1 2 323.827 4.288 20 0 DIADLO Clc1ccc(-c2cccc(C[N@@H+]3CCc4cn[nH]c4C3)c2)cc1 ZINC001474360837 1061984754 /nfs/dbraw/zinc/98/47/54/1061984754.db2.gz GLHQGVNIPDSAEB-UHFFFAOYSA-N 1 2 323.827 4.288 20 0 DIADLO Clc1ccc(-c2cccc(C[N@H+]3CCc4cn[nH]c4C3)c2)cc1 ZINC001474360837 1061984773 /nfs/dbraw/zinc/98/47/73/1061984773.db2.gz GLHQGVNIPDSAEB-UHFFFAOYSA-N 1 2 323.827 4.288 20 0 DIADLO C[C@@H]1CSCC[N@@H+]1Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC001474374996 1062019512 /nfs/dbraw/zinc/01/95/12/1062019512.db2.gz KHOJBLWHNGKKJK-SECBINFHSA-N 1 2 309.784 4.296 20 0 DIADLO C[C@@H]1CSCC[N@H+]1Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC001474374996 1062019534 /nfs/dbraw/zinc/01/95/34/1062019534.db2.gz KHOJBLWHNGKKJK-SECBINFHSA-N 1 2 309.784 4.296 20 0 DIADLO C[N@H+](Cc1ccccc1)[C@H](c1nnc(C2CC2)o1)c1ccccc1 ZINC001254082248 1062022525 /nfs/dbraw/zinc/02/25/25/1062022525.db2.gz PRMFIRJYFCXPMG-SFHVURJKSA-N 1 2 319.408 4.168 20 0 DIADLO C[N@@H+](Cc1ccccc1)[C@H](c1nnc(C2CC2)o1)c1ccccc1 ZINC001254082248 1062022550 /nfs/dbraw/zinc/02/25/50/1062022550.db2.gz PRMFIRJYFCXPMG-SFHVURJKSA-N 1 2 319.408 4.168 20 0 DIADLO C[N@H+](C/C=C\c1cccc(F)c1)Cc1nc2c(s1)CCCC2 ZINC001474380952 1062022566 /nfs/dbraw/zinc/02/25/66/1062022566.db2.gz IIJNAUCCMZJWSL-ALCCZGGFSA-N 1 2 316.445 4.306 20 0 DIADLO C[N@@H+](C/C=C\c1cccc(F)c1)Cc1nc2c(s1)CCCC2 ZINC001474380952 1062022585 /nfs/dbraw/zinc/02/25/85/1062022585.db2.gz IIJNAUCCMZJWSL-ALCCZGGFSA-N 1 2 316.445 4.306 20 0 DIADLO Clc1nccc2oc(CNc3cccc(-n4cc[nH+]c4)c3)cc21 ZINC001474388078 1062036889 /nfs/dbraw/zinc/03/68/89/1062036889.db2.gz WFNDZXBZGMQVLL-UHFFFAOYSA-N 1 2 324.771 4.279 20 0 DIADLO CCCc1ccc(C[N@H+](C)Cc2nc3ccccc3n2C)s1 ZINC001474387697 1062038437 /nfs/dbraw/zinc/03/84/37/1062038437.db2.gz ZJNLKHBWXZTQNW-UHFFFAOYSA-N 1 2 313.470 4.219 20 0 DIADLO CCCc1ccc(C[N@@H+](C)Cc2nc3ccccc3n2C)s1 ZINC001474387697 1062038457 /nfs/dbraw/zinc/03/84/57/1062038457.db2.gz ZJNLKHBWXZTQNW-UHFFFAOYSA-N 1 2 313.470 4.219 20 0 DIADLO COc1ccc(Cn2c[nH+]c(C(C)(C)C)c2)c(Br)c1 ZINC001459209273 1062042682 /nfs/dbraw/zinc/04/26/82/1062042682.db2.gz JFMTXMNQWJUAJY-UHFFFAOYSA-N 1 2 323.234 4.000 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)C(=O)OC(C)(C)C)[C@H](C)c1ccc(Cl)cc1 ZINC001474396162 1062051173 /nfs/dbraw/zinc/05/11/73/1062051173.db2.gz GTNZINUPFKQWNY-XQQFMLRXSA-N 1 2 311.853 4.152 20 0 DIADLO Cc1cc(C[NH+]2CCN(c3ccccc3F)CC2)ccc1Cl ZINC001474400112 1062052536 /nfs/dbraw/zinc/05/25/36/1062052536.db2.gz DIKFXBKQYBPVIG-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO CC1CC[NH+](Cc2cc(Br)c(Cl)s2)CC1 ZINC001474403988 1062064327 /nfs/dbraw/zinc/06/43/27/1062064327.db2.gz DRSDCLXMOBEUBK-UHFFFAOYSA-N 1 2 308.672 4.396 20 0 DIADLO CC(C)c1nc(C[NH2+]Cc2ccc(OC(C)(C)C)nc2)cs1 ZINC001254304364 1062071449 /nfs/dbraw/zinc/07/14/49/1062071449.db2.gz ZJOBZUBKHGENPW-UHFFFAOYSA-N 1 2 319.474 4.129 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+](C)Cc1csc2ccccc12 ZINC001459308098 1062074683 /nfs/dbraw/zinc/07/46/83/1062074683.db2.gz IJMMSDBJAKPDQI-ZDUSSCGKSA-N 1 2 305.443 4.065 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+](C)Cc1csc2ccccc12 ZINC001459308098 1062074707 /nfs/dbraw/zinc/07/47/07/1062074707.db2.gz IJMMSDBJAKPDQI-ZDUSSCGKSA-N 1 2 305.443 4.065 20 0 DIADLO C[N@H+](Cc1ccnn1CC1CCC1)Cc1ccc(F)c(Cl)c1 ZINC001474442452 1062121720 /nfs/dbraw/zinc/12/17/20/1062121720.db2.gz NCNXLIGTRFNCCE-UHFFFAOYSA-N 1 2 321.827 4.108 20 0 DIADLO C[N@@H+](Cc1ccnn1CC1CCC1)Cc1ccc(F)c(Cl)c1 ZINC001474442452 1062121733 /nfs/dbraw/zinc/12/17/33/1062121733.db2.gz NCNXLIGTRFNCCE-UHFFFAOYSA-N 1 2 321.827 4.108 20 0 DIADLO CCO[C@H]1C[C@H](Nc2[nH+]cccc2OC(C)C)C12CCCCC2 ZINC001474451258 1062128278 /nfs/dbraw/zinc/12/82/78/1062128278.db2.gz GZPAJYGMSGAMCZ-IRXDYDNUSA-N 1 2 318.461 4.409 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCO[C@H](c3cccc(F)c3)C2)cc1 ZINC001459429659 1062142275 /nfs/dbraw/zinc/14/22/75/1062142275.db2.gz VFDBXUZIGDXYLN-FQEVSTJZSA-N 1 2 313.416 4.352 20 0 DIADLO CCCc1ccc(C[N@H+]2CCO[C@H](c3cccc(F)c3)C2)cc1 ZINC001459429659 1062142280 /nfs/dbraw/zinc/14/22/80/1062142280.db2.gz VFDBXUZIGDXYLN-FQEVSTJZSA-N 1 2 313.416 4.352 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1c(Cl)ccnc1Cl ZINC001474463838 1062144444 /nfs/dbraw/zinc/14/44/44/1062144444.db2.gz AMNPOQBQYCWBQI-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+]Cc1ccc(O)c(F)c1F ZINC001474471312 1062152617 /nfs/dbraw/zinc/15/26/17/1062152617.db2.gz KTXJPOKHALUSTD-SNVBAGLBSA-N 1 2 309.381 4.243 20 0 DIADLO CC[C@H]1CCC[N@H+](Cc2nc(C)c(Br)s2)CC1 ZINC001459482840 1062162177 /nfs/dbraw/zinc/16/21/77/1062162177.db2.gz WAOPAUYLJAWODS-NSHDSACASA-N 1 2 317.296 4.226 20 0 DIADLO CC[C@H]1CCC[N@@H+](Cc2nc(C)c(Br)s2)CC1 ZINC001459482840 1062162191 /nfs/dbraw/zinc/16/21/91/1062162191.db2.gz WAOPAUYLJAWODS-NSHDSACASA-N 1 2 317.296 4.226 20 0 DIADLO Cc1cc(CN(C)c2ccc3cc[nH]c3c2)c2c([nH+]1)CCCC2 ZINC001474497982 1062179251 /nfs/dbraw/zinc/17/92/51/1062179251.db2.gz RKCKRNAZJSZLND-UHFFFAOYSA-N 1 2 305.425 4.387 20 0 DIADLO Cc1ccc2c(ccc(C)c2C[N@@H+]2CCO[C@@H](C(F)(F)F)C2)c1 ZINC001459524168 1062183119 /nfs/dbraw/zinc/18/31/19/1062183119.db2.gz BZFGSYCEPRWECK-QGZVFWFLSA-N 1 2 323.358 4.220 20 0 DIADLO Cc1ccc2c(ccc(C)c2C[N@H+]2CCO[C@@H](C(F)(F)F)C2)c1 ZINC001459524168 1062183127 /nfs/dbraw/zinc/18/31/27/1062183127.db2.gz BZFGSYCEPRWECK-QGZVFWFLSA-N 1 2 323.358 4.220 20 0 DIADLO Cc1cc(CN2CCc3cc(C)c(C)cc32)c2c([nH+]1)CCCC2 ZINC001474515323 1062197019 /nfs/dbraw/zinc/19/70/19/1062197019.db2.gz SVDQIYGGLMRHON-UHFFFAOYSA-N 1 2 306.453 4.448 20 0 DIADLO Cn1ncc(C[N@@H+]2CCCC[C@@H]2c2ccc(Cl)cc2)c1Cl ZINC001474524351 1062209322 /nfs/dbraw/zinc/20/93/22/1062209322.db2.gz VOSZDZYTYJICAH-OAHLLOKOSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1ncc(C[N@H+]2CCCC[C@@H]2c2ccc(Cl)cc2)c1Cl ZINC001474524351 1062209345 /nfs/dbraw/zinc/20/93/45/1062209345.db2.gz VOSZDZYTYJICAH-OAHLLOKOSA-N 1 2 324.255 4.454 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccn(-c3cccc(F)c3)n2)c(C)o1 ZINC001254674487 1062226762 /nfs/dbraw/zinc/22/67/62/1062226762.db2.gz AGCJUUJPUNMXND-ZDUSSCGKSA-N 1 2 313.376 4.072 20 0 DIADLO CCc1cccc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)c1 ZINC001459588479 1062228386 /nfs/dbraw/zinc/22/83/86/1062228386.db2.gz IPOUTVBAZVYSIX-UHFFFAOYSA-N 1 2 305.425 4.175 20 0 DIADLO CCc1cccc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)c1 ZINC001459588479 1062228413 /nfs/dbraw/zinc/22/84/13/1062228413.db2.gz IPOUTVBAZVYSIX-UHFFFAOYSA-N 1 2 305.425 4.175 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@@H+]1CC2(CCC2)[C@@H]1c1ccccc1 ZINC001474552521 1062250311 /nfs/dbraw/zinc/25/03/11/1062250311.db2.gz LWCPDKZAIRNWHY-INIZCTEOSA-N 1 2 315.848 4.353 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@H+]1CC2(CCC2)[C@@H]1c1ccccc1 ZINC001474552521 1062250330 /nfs/dbraw/zinc/25/03/30/1062250330.db2.gz LWCPDKZAIRNWHY-INIZCTEOSA-N 1 2 315.848 4.353 20 0 DIADLO Clc1ccc(C[NH2+]Cc2nc(-c3ccccc3)cs2)nc1 ZINC001474557315 1062259086 /nfs/dbraw/zinc/25/90/86/1062259086.db2.gz REQVFLQEWCYZSZ-UHFFFAOYSA-N 1 2 315.829 4.148 20 0 DIADLO CC1(C)C[N@H+](Cc2ccnn2C2CCC2)[C@@H]1c1cccs1 ZINC001474565618 1062272319 /nfs/dbraw/zinc/27/23/19/1062272319.db2.gz WFSLBPIKUWPSCB-MRXNPFEDSA-N 1 2 301.459 4.253 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccnn2C2CCC2)[C@@H]1c1cccs1 ZINC001474565618 1062272339 /nfs/dbraw/zinc/27/23/39/1062272339.db2.gz WFSLBPIKUWPSCB-MRXNPFEDSA-N 1 2 301.459 4.253 20 0 DIADLO COc1c(C)c[nH+]c(CN(c2ccc(F)cc2)C(C)C)c1C ZINC001459758368 1062372927 /nfs/dbraw/zinc/37/29/27/1062372927.db2.gz YMEVBEMIEMSWFE-UHFFFAOYSA-N 1 2 302.393 4.261 20 0 DIADLO CC(C)CCO[C@@H]1CC[N@H+](Cc2cncc(Cl)c2Cl)C1 ZINC001474648651 1062373658 /nfs/dbraw/zinc/37/36/58/1062373658.db2.gz KAZZFVMVTVHAME-CYBMUJFWSA-N 1 2 317.260 4.025 20 0 DIADLO CC(C)CCO[C@@H]1CC[N@@H+](Cc2cncc(Cl)c2Cl)C1 ZINC001474648651 1062373686 /nfs/dbraw/zinc/37/36/86/1062373686.db2.gz KAZZFVMVTVHAME-CYBMUJFWSA-N 1 2 317.260 4.025 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+]CCC(C)(C)C)cc1Cl ZINC001474653381 1062383556 /nfs/dbraw/zinc/38/35/56/1062383556.db2.gz UXQNRURVXMKNKI-CYBMUJFWSA-N 1 2 310.869 4.413 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1nc2ccccc2n1C ZINC001459775324 1062386823 /nfs/dbraw/zinc/38/68/23/1062386823.db2.gz LISNBPXSQZBODV-KGLIPLIRSA-N 1 2 323.415 4.220 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1nc2ccccc2n1C ZINC001459775324 1062386847 /nfs/dbraw/zinc/38/68/47/1062386847.db2.gz LISNBPXSQZBODV-KGLIPLIRSA-N 1 2 323.415 4.220 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC001459786952 1062399362 /nfs/dbraw/zinc/39/93/62/1062399362.db2.gz HTWGGKJNDIEZRF-UZLBHIALSA-N 1 2 323.436 4.128 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC001459786952 1062399386 /nfs/dbraw/zinc/39/93/86/1062399386.db2.gz HTWGGKJNDIEZRF-UZLBHIALSA-N 1 2 323.436 4.128 20 0 DIADLO Oc1ccc(Cl)c(C[NH2+]Cc2ccc(Cl)cc2F)c1 ZINC001474685991 1062415589 /nfs/dbraw/zinc/41/55/89/1062415589.db2.gz ISBIHERDIOTAPE-UHFFFAOYSA-N 1 2 300.160 4.128 20 0 DIADLO COc1ccc([C@@H](C)[C@@H](C)Nc2c[nH+]c(C)c(C)c2)cc1OC ZINC001474683815 1062416993 /nfs/dbraw/zinc/41/69/93/1062416993.db2.gz BYNJRFHQRGIJIO-DZGCQCFKSA-N 1 2 314.429 4.320 20 0 DIADLO C[C@@H]([NH2+]Cc1scnc1Cl)c1cc(Cl)ccc1F ZINC001459816123 1062423562 /nfs/dbraw/zinc/42/35/62/1062423562.db2.gz DNXGSKITIUSHNY-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccc(C)c(F)c1 ZINC001459818928 1062425005 /nfs/dbraw/zinc/42/50/05/1062425005.db2.gz VNXQOTHSMQHPRB-CQSZACIVSA-N 1 2 305.422 4.104 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@H](Cc3ccccc3)C2)c(Cl)c1 ZINC001459866283 1062456785 /nfs/dbraw/zinc/45/67/85/1062456785.db2.gz DEKYMFXDCIFDJA-GOSISDBHSA-N 1 2 315.844 4.092 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@H](Cc3ccccc3)C2)c(Cl)c1 ZINC001459866283 1062456798 /nfs/dbraw/zinc/45/67/98/1062456798.db2.gz DEKYMFXDCIFDJA-GOSISDBHSA-N 1 2 315.844 4.092 20 0 DIADLO COCc1cnc2n1CC[N@H+](C1CCC(C(C)(C)C)CC1)[C@@H]2C ZINC001255502960 1062464419 /nfs/dbraw/zinc/46/44/19/1062464419.db2.gz OGYCUDNWBAIKHU-QQFBHYJXSA-N 1 2 319.493 4.011 20 0 DIADLO COCc1cnc2n1CC[N@@H+](C1CCC(C(C)(C)C)CC1)[C@@H]2C ZINC001255502960 1062464423 /nfs/dbraw/zinc/46/44/23/1062464423.db2.gz OGYCUDNWBAIKHU-QQFBHYJXSA-N 1 2 319.493 4.011 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccc(C)c(F)c1 ZINC001459881375 1062469268 /nfs/dbraw/zinc/46/92/68/1062469268.db2.gz ZUUOUFKVROQMAM-HNNXBMFYSA-N 1 2 302.393 4.242 20 0 DIADLO Cc1conc1C[NH2+][C@@H](Cc1ccccc1)c1ccccc1F ZINC001459885515 1062471506 /nfs/dbraw/zinc/47/15/06/1062471506.db2.gz OYMJMXAWEVWNOB-SFHVURJKSA-N 1 2 310.372 4.196 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)sc1C(C)(C)C ZINC001459885728 1062471673 /nfs/dbraw/zinc/47/16/73/1062471673.db2.gz BUPSXTRZPBZHCB-SNVBAGLBSA-N 1 2 306.397 4.133 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)sc1C(C)(C)C ZINC001459885728 1062471678 /nfs/dbraw/zinc/47/16/78/1062471678.db2.gz BUPSXTRZPBZHCB-SNVBAGLBSA-N 1 2 306.397 4.133 20 0 DIADLO C[C@@H](CC(F)(F)F)[N@@H+]1CCO[C@@](C)(c2ccc(Cl)cc2)C1 ZINC001255654456 1062498723 /nfs/dbraw/zinc/49/87/23/1062498723.db2.gz DFQSXYWBLQMDAP-SMDDNHRTSA-N 1 2 321.770 4.228 20 0 DIADLO C[C@@H](CC(F)(F)F)[N@H+]1CCO[C@@](C)(c2ccc(Cl)cc2)C1 ZINC001255654456 1062498725 /nfs/dbraw/zinc/49/87/25/1062498725.db2.gz DFQSXYWBLQMDAP-SMDDNHRTSA-N 1 2 321.770 4.228 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1Cc2ccccc2OC[C@H]1C ZINC001459930901 1062503953 /nfs/dbraw/zinc/50/39/53/1062503953.db2.gz FPPFZWUJXDCZMD-CYBMUJFWSA-N 1 2 317.816 4.132 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1Cc2ccccc2OC[C@H]1C ZINC001459930901 1062503967 /nfs/dbraw/zinc/50/39/67/1062503967.db2.gz FPPFZWUJXDCZMD-CYBMUJFWSA-N 1 2 317.816 4.132 20 0 DIADLO Cn1cc([C@H]([NH2+]Cc2ccsc2Cl)c2ccccc2)cn1 ZINC001255690426 1062519045 /nfs/dbraw/zinc/51/90/45/1062519045.db2.gz SVBHEGXDKONKIA-OAHLLOKOSA-N 1 2 317.845 4.014 20 0 DIADLO CCC[C@H](C)CCC[N@@H+]1CCOC[C@H]1CC(=O)c1cccs1 ZINC001459971590 1062537447 /nfs/dbraw/zinc/53/74/47/1062537447.db2.gz MMYNVNRCEBDELV-JKSUJKDBSA-N 1 2 323.502 4.238 20 0 DIADLO CCC[C@H](C)CCC[N@H+]1CCOC[C@H]1CC(=O)c1cccs1 ZINC001459971590 1062537467 /nfs/dbraw/zinc/53/74/67/1062537467.db2.gz MMYNVNRCEBDELV-JKSUJKDBSA-N 1 2 323.502 4.238 20 0 DIADLO CC(C)[C@@H](C)C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001460015051 1062571602 /nfs/dbraw/zinc/57/16/02/1062571602.db2.gz MSUSBJOAIBCDCH-CQSZACIVSA-N 1 2 312.413 4.084 20 0 DIADLO Cc1cn2cc(NC(=O)NCCC3=CCCCCC3)ccc2[nH+]1 ZINC001476102435 1062589043 /nfs/dbraw/zinc/58/90/43/1062589043.db2.gz PGPXOHUQNZMRSI-UHFFFAOYSA-N 1 2 312.417 4.045 20 0 DIADLO FC(F)(F)c1nc([C@@H]2CCCC[N@@H+]2C2CCCCCC2)no1 ZINC001255891526 1062659965 /nfs/dbraw/zinc/65/99/65/1062659965.db2.gz XUYYMGOJCFNYGH-LBPRGKRZSA-N 1 2 317.355 4.338 20 0 DIADLO FC(F)(F)c1nc([C@@H]2CCCC[N@H+]2C2CCCCCC2)no1 ZINC001255891526 1062659971 /nfs/dbraw/zinc/65/99/71/1062659971.db2.gz XUYYMGOJCFNYGH-LBPRGKRZSA-N 1 2 317.355 4.338 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(Cl)cc2Cl)[C@@H]1[C@@H]1CCCO1 ZINC001460192717 1062691550 /nfs/dbraw/zinc/69/15/50/1062691550.db2.gz BDAXCZFKAPFOAQ-LSDHHAIUSA-N 1 2 314.256 4.383 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(Cl)cc2Cl)[C@@H]1[C@@H]1CCCO1 ZINC001460192717 1062691556 /nfs/dbraw/zinc/69/15/56/1062691556.db2.gz BDAXCZFKAPFOAQ-LSDHHAIUSA-N 1 2 314.256 4.383 20 0 DIADLO CCCCCc1nnc(/C=C/c2ccc(Cn3cc[nH+]c3)cc2)o1 ZINC001256058053 1062691621 /nfs/dbraw/zinc/69/16/21/1062691621.db2.gz AXQSUXFBMQAWQC-ZHACJKMWSA-N 1 2 322.412 4.218 20 0 DIADLO Cc1nc(C[N@@H+]2CC(C)(C)[C@@H]2[C@H]2CCCO2)sc1C(C)(C)C ZINC001460195847 1062693920 /nfs/dbraw/zinc/69/39/20/1062693920.db2.gz LIWXCQZDGQVJMU-HIFRSBDPSA-N 1 2 322.518 4.138 20 0 DIADLO Cc1nc(C[N@H+]2CC(C)(C)[C@@H]2[C@H]2CCCO2)sc1C(C)(C)C ZINC001460195847 1062693928 /nfs/dbraw/zinc/69/39/28/1062693928.db2.gz LIWXCQZDGQVJMU-HIFRSBDPSA-N 1 2 322.518 4.138 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CCC[C@H](C(C)C)C2)c(C)[nH+]1 ZINC001476697594 1062703127 /nfs/dbraw/zinc/70/31/27/1062703127.db2.gz BNQJFZVICJFCPW-JKSUJKDBSA-N 1 2 303.450 4.343 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CC(C)(C)C[C@@H]1C ZINC001460253660 1062734159 /nfs/dbraw/zinc/73/41/59/1062734159.db2.gz YPUKQZSNDHAJMR-WFASDCNBSA-N 1 2 309.837 4.065 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CC(C)(C)C[C@@H]1C ZINC001460253660 1062734181 /nfs/dbraw/zinc/73/41/81/1062734181.db2.gz YPUKQZSNDHAJMR-WFASDCNBSA-N 1 2 309.837 4.065 20 0 DIADLO C[C@@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1Cc2ccccc2NC(=O)C1 ZINC001460301253 1062768411 /nfs/dbraw/zinc/76/84/11/1062768411.db2.gz CCAYUCBCIRENMS-HNNXBMFYSA-N 1 2 322.452 4.499 20 0 DIADLO C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1Cc2ccccc2NC(=O)C1 ZINC001460301253 1062768435 /nfs/dbraw/zinc/76/84/35/1062768435.db2.gz CCAYUCBCIRENMS-HNNXBMFYSA-N 1 2 322.452 4.499 20 0 DIADLO CCc1nocc1C[N@@H+]1CCc2oc(-c3ccccc3)cc2C1 ZINC001460356126 1062804393 /nfs/dbraw/zinc/80/43/93/1062804393.db2.gz KEOHTNRJBHNZMB-UHFFFAOYSA-N 1 2 308.381 4.055 20 0 DIADLO CCc1nocc1C[N@H+]1CCc2oc(-c3ccccc3)cc2C1 ZINC001460356126 1062804419 /nfs/dbraw/zinc/80/44/19/1062804419.db2.gz KEOHTNRJBHNZMB-UHFFFAOYSA-N 1 2 308.381 4.055 20 0 DIADLO CCCC(CCC)C(=O)N1CC[NH2+][C@H](c2ccc(Cl)cc2)C1 ZINC001470636225 1062828152 /nfs/dbraw/zinc/82/81/52/1062828152.db2.gz MDXQIDHCHSPPPN-KRWDZBQOSA-N 1 2 322.880 4.029 20 0 DIADLO C[N@H+](CCc1ccccc1)[C@H](CCc1ccccc1)C(F)F ZINC001460572190 1062917453 /nfs/dbraw/zinc/91/74/53/1062917453.db2.gz DIDXIXGKRMFAKQ-GOSISDBHSA-N 1 2 303.396 4.427 20 0 DIADLO C[N@@H+](CCc1ccccc1)[C@H](CCc1ccccc1)C(F)F ZINC001460572190 1062917477 /nfs/dbraw/zinc/91/74/77/1062917477.db2.gz DIDXIXGKRMFAKQ-GOSISDBHSA-N 1 2 303.396 4.427 20 0 DIADLO Cc1cccc(Oc2cccc(NC(=O)[C@H](C)n3cc[nH+]c3)c2)c1 ZINC001471333971 1062965734 /nfs/dbraw/zinc/96/57/34/1062965734.db2.gz USMNEENACGCFTG-HNNXBMFYSA-N 1 2 321.380 4.184 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Cl)cc(Br)c2)CCS1 ZINC001460671243 1062975771 /nfs/dbraw/zinc/97/57/71/1062975771.db2.gz MZNYALZJUZGVRO-SECBINFHSA-N 1 2 320.683 4.040 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Cl)cc(Br)c2)CCS1 ZINC001460671243 1062975790 /nfs/dbraw/zinc/97/57/90/1062975790.db2.gz MZNYALZJUZGVRO-SECBINFHSA-N 1 2 320.683 4.040 20 0 DIADLO CC(C)(C)[C@H]1CSCC[N@@H+]1Cc1nc(Cl)ccc1Cl ZINC001460687045 1062985916 /nfs/dbraw/zinc/98/59/16/1062985916.db2.gz CPNBABKCORAMPV-GFCCVEGCSA-N 1 2 319.301 4.352 20 0 DIADLO CC(C)(C)[C@H]1CSCC[N@H+]1Cc1nc(Cl)ccc1Cl ZINC001460687045 1062985937 /nfs/dbraw/zinc/98/59/37/1062985937.db2.gz CPNBABKCORAMPV-GFCCVEGCSA-N 1 2 319.301 4.352 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)CCCCCC(C)C)[nH+]c1C ZINC001471859304 1063027130 /nfs/dbraw/zinc/02/71/30/1063027130.db2.gz MEMNQLKDPMWUGD-MRXNPFEDSA-N 1 2 305.466 4.297 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)CC/C=C\c2ccccc2)[nH+]c1C ZINC001471859696 1063027419 /nfs/dbraw/zinc/02/74/19/1063027419.db2.gz RPQXLXIYCKENLR-SNMSSPIJSA-N 1 2 323.440 4.184 20 0 DIADLO CCOC(=O)[C@@H](CC1CC1)[NH2+][C@H](C)c1cccc2ccccc21 ZINC001460739176 1063032210 /nfs/dbraw/zinc/03/22/10/1063032210.db2.gz VSAGSQUHTZGROK-AUUYWEPGSA-N 1 2 311.425 4.222 20 0 DIADLO CCOC(=O)[C@H](CC1CC1)[NH2+][C@@H](C)c1cccc2ccccc21 ZINC001460739188 1063033030 /nfs/dbraw/zinc/03/30/30/1063033030.db2.gz VSAGSQUHTZGROK-LIRRHRJNSA-N 1 2 311.425 4.222 20 0 DIADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2c(C)cccc2Cl)[nH]c1C ZINC001460761554 1063043432 /nfs/dbraw/zinc/04/34/32/1063043432.db2.gz INGGEKJGBWAIOY-INIZCTEOSA-N 1 2 303.837 4.325 20 0 DIADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2c(C)cccc2Cl)[nH]c1C ZINC001460761554 1063043444 /nfs/dbraw/zinc/04/34/44/1063043444.db2.gz INGGEKJGBWAIOY-INIZCTEOSA-N 1 2 303.837 4.325 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2Cc2c(C)cccc2Cl)[nH+]c1C ZINC001460761554 1063043468 /nfs/dbraw/zinc/04/34/68/1063043468.db2.gz INGGEKJGBWAIOY-INIZCTEOSA-N 1 2 303.837 4.325 20 0 DIADLO COCC[N@H+](Cc1nc(C)sc1C)Cc1ccc(C)c(C)c1 ZINC001460787109 1063056936 /nfs/dbraw/zinc/05/69/36/1063056936.db2.gz KFZTVYBNTARPLV-UHFFFAOYSA-N 1 2 318.486 4.025 20 0 DIADLO COCC[N@@H+](Cc1nc(C)sc1C)Cc1ccc(C)c(C)c1 ZINC001460787109 1063056955 /nfs/dbraw/zinc/05/69/55/1063056955.db2.gz KFZTVYBNTARPLV-UHFFFAOYSA-N 1 2 318.486 4.025 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001460794118 1063063877 /nfs/dbraw/zinc/06/38/77/1063063877.db2.gz XOXYPVKKPFKEOQ-CABZTGNLSA-N 1 2 309.784 4.381 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001460794118 1063063897 /nfs/dbraw/zinc/06/38/97/1063063897.db2.gz XOXYPVKKPFKEOQ-CABZTGNLSA-N 1 2 309.784 4.381 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cscc1Cl ZINC001472555162 1063100659 /nfs/dbraw/zinc/10/06/59/1063100659.db2.gz DDZMVBBICFUSBI-UHFFFAOYSA-N 1 2 317.801 4.352 20 0 DIADLO Cc1ccc(C)c(C2CC[NH+]([C@H](C)c3csnn3)CC2)c1 ZINC001460893901 1063120856 /nfs/dbraw/zinc/12/08/56/1063120856.db2.gz BLDYERAVRXBUOY-CQSZACIVSA-N 1 2 301.459 4.096 20 0 DIADLO Cc1nc(NCCCSc2ccccc2)c2c([nH+]1)CCCC2 ZINC001472652281 1063121932 /nfs/dbraw/zinc/12/19/32/1063121932.db2.gz GHYYVXVKFZUILI-UHFFFAOYSA-N 1 2 313.470 4.258 20 0 DIADLO Cc1cc(NCCc2cc3ccccc3o2)nc(C2CCC2)[nH+]1 ZINC001472701049 1063161596 /nfs/dbraw/zinc/16/15/96/1063161596.db2.gz APZPUTFUDITMQJ-UHFFFAOYSA-N 1 2 307.397 4.453 20 0 DIADLO CC[C@@H](Cc1ccc(C)cc1)N(C)c1nc(C)[nH+]c2c1CCCC2 ZINC001472709452 1063169209 /nfs/dbraw/zinc/16/92/09/1063169209.db2.gz NJEXEIJZOWHKHB-SFHVURJKSA-N 1 2 323.484 4.430 20 0 DIADLO CCc1cc(N2CCc3cc(-c4ccccc4)oc3C2)nc(C)[nH+]1 ZINC001472714293 1063175001 /nfs/dbraw/zinc/17/50/01/1063175001.db2.gz MQNMBHXBONDELX-UHFFFAOYSA-N 1 2 319.408 4.170 20 0 DIADLO CCCCO[C@H]1C[C@@H](Nc2nc(C)[nH+]c3c2CCCC3)C1(C)C ZINC001472718511 1063179415 /nfs/dbraw/zinc/17/94/15/1063179415.db2.gz DBGHKBHMVWNNOX-SJORKVTESA-N 1 2 317.477 4.060 20 0 DIADLO CCCCO[C@H]1C[C@H](Nc2nc(C)[nH+]c3c2CCCC3)C1(C)C ZINC001472718510 1063181032 /nfs/dbraw/zinc/18/10/32/1063181032.db2.gz DBGHKBHMVWNNOX-IRXDYDNUSA-N 1 2 317.477 4.060 20 0 DIADLO Cc1cc(CNC(=O)CCc2ccc3ccccc3c2)cc(C)[nH+]1 ZINC001461008277 1063183800 /nfs/dbraw/zinc/18/38/00/1063183800.db2.gz LMASTPFBIDJWLB-UHFFFAOYSA-N 1 2 318.420 4.101 20 0 DIADLO CCC(CC)[N@@H+]1CCOC[C@@H]1c1csc(-c2ccccc2)n1 ZINC001257296735 1063187172 /nfs/dbraw/zinc/18/71/72/1063187172.db2.gz MLAPUTYSXREVGT-QGZVFWFLSA-N 1 2 316.470 4.372 20 0 DIADLO CCC(CC)[N@H+]1CCOC[C@@H]1c1csc(-c2ccccc2)n1 ZINC001257296735 1063187185 /nfs/dbraw/zinc/18/71/85/1063187185.db2.gz MLAPUTYSXREVGT-QGZVFWFLSA-N 1 2 316.470 4.372 20 0 DIADLO Cc1cc(N2CCc3cc(Cl)ccc3C2)nc(C2CCC2)[nH+]1 ZINC001472756669 1063210048 /nfs/dbraw/zinc/21/00/48/1063210048.db2.gz UZFDWFQSGDEBSE-UHFFFAOYSA-N 1 2 313.832 4.269 20 0 DIADLO CCc1ccc([C@@H]2CCCN(c3nc(C)[nH+]c(C)c3C)C2)cc1 ZINC001472779765 1063227376 /nfs/dbraw/zinc/22/73/76/1063227376.db2.gz KBODLYOYHIKINX-LJQANCHMSA-N 1 2 309.457 4.348 20 0 DIADLO COc1cccc(COc2ccc(CNc3cccc[nH+]3)cc2)c1 ZINC001461074063 1063233224 /nfs/dbraw/zinc/23/32/24/1063233224.db2.gz LGJFNBHMHTZXSY-UHFFFAOYSA-N 1 2 320.392 4.281 20 0 DIADLO CCCCOC(=O)CC[C@H](C)[N@@H+]1Cc2cccc(Cl)c2C1 ZINC001257403923 1063255150 /nfs/dbraw/zinc/25/51/50/1063255150.db2.gz YMLKIFKIQWTVTI-ZDUSSCGKSA-N 1 2 309.837 4.168 20 0 DIADLO CCCCOC(=O)CC[C@H](C)[N@H+]1Cc2cccc(Cl)c2C1 ZINC001257403923 1063255168 /nfs/dbraw/zinc/25/51/68/1063255168.db2.gz YMLKIFKIQWTVTI-ZDUSSCGKSA-N 1 2 309.837 4.168 20 0 DIADLO CC(C)c1cc(NC[C@H]2CCc3cccnc32)nc(C(C)C)[nH+]1 ZINC001472818452 1063263358 /nfs/dbraw/zinc/26/33/58/1063263358.db2.gz KWRMYWMUMVMKKU-OAHLLOKOSA-N 1 2 310.445 4.260 20 0 DIADLO CCc1cc(N2CCc3ccc(C(C)C)cc3C2)nc(CC)[nH+]1 ZINC001472826313 1063267753 /nfs/dbraw/zinc/26/77/53/1063267753.db2.gz RLZKKKOWXVVHHD-UHFFFAOYSA-N 1 2 309.457 4.288 20 0 DIADLO Cc1cc(N[C@H]2C[C@H](OC(C)(C)C)C23CCC3)nc(C2CC2)[nH+]1 ZINC001472831850 1063273684 /nfs/dbraw/zinc/27/36/84/1063273684.db2.gz USCLPEFNCIBCAG-GJZGRUSLSA-N 1 2 315.461 4.201 20 0 DIADLO CC(C)c1cc(N[C@H](C2CCC2)[C@@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC001472856578 1063284958 /nfs/dbraw/zinc/28/49/58/1063284958.db2.gz CLUHJIOIXCGEQK-CRAIPNDOSA-N 1 2 317.477 4.341 20 0 DIADLO COc1cccc2cc(C[NH2+]Cc3ncc(C(C)C)s3)oc21 ZINC001461138504 1063288675 /nfs/dbraw/zinc/28/86/75/1063288675.db2.gz AZLSAHDWQBOCDS-UHFFFAOYSA-N 1 2 316.426 4.311 20 0 DIADLO Clc1ncccc1C[NH2+][C@H](c1ccccc1)c1cccnc1 ZINC001461145381 1063290659 /nfs/dbraw/zinc/29/06/59/1063290659.db2.gz CDUJVXRQLVRSGW-QGZVFWFLSA-N 1 2 309.800 4.009 20 0 DIADLO Cc1nc(N[C@@H]2C[C@@H](c3ccccc3)Oc3ccccc32)cc[nH+]1 ZINC001472893353 1063303100 /nfs/dbraw/zinc/30/31/00/1063303100.db2.gz GYZWPUDUKZJQNH-MJGOQNOKSA-N 1 2 317.392 4.462 20 0 DIADLO Cc1cc(N(C)[C@@H]2CCc3ccccc3C2)nc(C2CCC2)[nH+]1 ZINC001472900894 1063309739 /nfs/dbraw/zinc/30/97/39/1063309739.db2.gz RSJCYMPVRSHSMU-GOSISDBHSA-N 1 2 307.441 4.046 20 0 DIADLO FC1(F)C[N@@H+]([C@H]2CCCSC2)CC[C@@H]1Cc1ccccc1 ZINC001257685956 1063368300 /nfs/dbraw/zinc/36/83/00/1063368300.db2.gz XJUBEXGANBJVAC-CVEARBPZSA-N 1 2 311.441 4.082 20 0 DIADLO FC1(F)C[N@H+]([C@H]2CCCSC2)CC[C@@H]1Cc1ccccc1 ZINC001257685956 1063368325 /nfs/dbraw/zinc/36/83/25/1063368325.db2.gz XJUBEXGANBJVAC-CVEARBPZSA-N 1 2 311.441 4.082 20 0 DIADLO Cc1cc(C(F)(F)F)ccc1CNc1ccc(N(C)C)c[nH+]1 ZINC001461310723 1063408671 /nfs/dbraw/zinc/40/86/71/1063408671.db2.gz YDLMZSJCQGTAIT-UHFFFAOYSA-N 1 2 309.335 4.087 20 0 DIADLO c1csc(-c2cccc(NCc3cccc4[nH+]ccn43)c2)n1 ZINC001461315739 1063411814 /nfs/dbraw/zinc/41/18/14/1063411814.db2.gz ZQKZOPJMWWFLLV-UHFFFAOYSA-N 1 2 306.394 4.070 20 0 DIADLO COc1cc(Cl)c(CNc2ccc([NH+](C)C)cc2)cc1OC ZINC001461326827 1063421289 /nfs/dbraw/zinc/42/12/89/1063421289.db2.gz VCURWLCFMNZHBR-UHFFFAOYSA-N 1 2 320.820 4.035 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+](C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC001473128933 1063433710 /nfs/dbraw/zinc/43/37/10/1063433710.db2.gz YQOYWFXJGWSRRV-GHMZBOCLSA-N 1 2 318.244 4.328 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+](C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC001473128933 1063433728 /nfs/dbraw/zinc/43/37/28/1063433728.db2.gz YQOYWFXJGWSRRV-GHMZBOCLSA-N 1 2 318.244 4.328 20 0 DIADLO Cc1cc(NCc2nc3c(s2)C[C@@H](C)CC3)ccc1[NH+](C)C ZINC001461390648 1063469960 /nfs/dbraw/zinc/46/99/60/1063469960.db2.gz JCOPJNFYQSKBBF-LBPRGKRZSA-N 1 2 315.486 4.254 20 0 DIADLO COc1ccc(CNc2c[nH+]ccc2OC(C)(C)C)cc1C ZINC001461411063 1063481285 /nfs/dbraw/zinc/48/12/85/1063481285.db2.gz ZHCCHUXYPRGBDT-UHFFFAOYSA-N 1 2 300.402 4.188 20 0 DIADLO CC(C)C[C@H](C)C[C@H](C)[N@@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001258075711 1063502935 /nfs/dbraw/zinc/50/29/35/1063502935.db2.gz WKOKJLZCQZGCBX-HOTGVXAUSA-N 1 2 319.493 4.011 20 0 DIADLO CC(C)C[C@H](C)C[C@H](C)[N@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001258075711 1063502955 /nfs/dbraw/zinc/50/29/55/1063502955.db2.gz WKOKJLZCQZGCBX-HOTGVXAUSA-N 1 2 319.493 4.011 20 0 DIADLO CC1=C(C)C[C@](C)(C(=O)NCc2ccccc2-n2cc[nH+]c2)CC1 ZINC001546287598 1063504270 /nfs/dbraw/zinc/50/42/70/1063504270.db2.gz VXZYBFVBRWZMRS-HXUWFJFHSA-N 1 2 323.440 4.015 20 0 DIADLO COC(=O)[C@H](Cc1ccc(Cl)cc1)[NH2+][C@@H](C)CCC=C(C)C ZINC001258077752 1063504460 /nfs/dbraw/zinc/50/44/60/1063504460.db2.gz MZTAAHYDMDANQB-YOEHRIQHSA-N 1 2 323.864 4.149 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NCc1cccc2c1OC(C)(C)C2 ZINC001461440778 1063508771 /nfs/dbraw/zinc/50/87/71/1063508771.db2.gz FKMIQZPFRVTHHI-UHFFFAOYSA-N 1 2 312.413 4.194 20 0 DIADLO Fc1cc(-c2ccncc2)ccc1CNc1cc2cc[nH]c2c[nH+]1 ZINC001461604663 1063607280 /nfs/dbraw/zinc/60/72/80/1063607280.db2.gz GJRCPZYABUWSBN-UHFFFAOYSA-N 1 2 318.355 4.376 20 0 DIADLO CCC(CC)[C@H](NC(=O)c1cccc2[nH+]ccn21)c1ccccc1 ZINC001514975362 1063635120 /nfs/dbraw/zinc/63/51/20/1063635120.db2.gz PMMSWATYCSPXHO-IBGZPJMESA-N 1 2 321.424 4.242 20 0 DIADLO CCCCC[C@@H](CC)[N@@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001258441305 1063653635 /nfs/dbraw/zinc/65/36/35/1063653635.db2.gz HYBWSUPOQQBDAR-JKSUJKDBSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCC[C@@H](CC)[N@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001258441305 1063653648 /nfs/dbraw/zinc/65/36/48/1063653648.db2.gz HYBWSUPOQQBDAR-JKSUJKDBSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCC[C@@H](CC)[N@H+]1Cc2nnc(C(F)(F)F)n2[C@H](C)C1 ZINC001258443872 1063656466 /nfs/dbraw/zinc/65/64/66/1063656466.db2.gz PCWUTNZSMOSNEN-VXGBXAGGSA-N 1 2 318.387 4.032 20 0 DIADLO CCCCC[C@@H](CC)[N@@H+]1Cc2nnc(C(F)(F)F)n2[C@H](C)C1 ZINC001258443872 1063656474 /nfs/dbraw/zinc/65/64/74/1063656474.db2.gz PCWUTNZSMOSNEN-VXGBXAGGSA-N 1 2 318.387 4.032 20 0 DIADLO COCc1cccc(CNc2[nH+]c3ccccc3n2C(C)C)c1 ZINC001461724767 1063680627 /nfs/dbraw/zinc/68/06/27/1063680627.db2.gz QTKVOARCXDNQMY-UHFFFAOYSA-N 1 2 309.413 4.376 20 0 DIADLO Cc1cc(CNc2[nH+]c3ccccc3n2CCC(C)C)sn1 ZINC001461727878 1063681704 /nfs/dbraw/zinc/68/17/04/1063681704.db2.gz DWDBHHXVBIDINS-UHFFFAOYSA-N 1 2 314.458 4.459 20 0 DIADLO CCCC1CCC([N@@H+]2CCn3c(COCC)cnc3[C@H]2C)CC1 ZINC001258532371 1063685144 /nfs/dbraw/zinc/68/51/44/1063685144.db2.gz XIWZQDMRYGAAGS-KLAILNCOSA-N 1 2 319.493 4.155 20 0 DIADLO CCCC1CCC([N@H+]2CCn3c(COCC)cnc3[C@H]2C)CC1 ZINC001258532371 1063685150 /nfs/dbraw/zinc/68/51/50/1063685150.db2.gz XIWZQDMRYGAAGS-KLAILNCOSA-N 1 2 319.493 4.155 20 0 DIADLO CCCC1CCC([N@@H+]2CCn3cc(C(F)(F)F)nc3C2)CC1 ZINC001258533407 1063687313 /nfs/dbraw/zinc/68/73/13/1063687313.db2.gz XTLCLJFUIZCUTF-UHFFFAOYSA-N 1 2 315.383 4.076 20 0 DIADLO CCCC1CCC([N@H+]2CCn3cc(C(F)(F)F)nc3C2)CC1 ZINC001258533407 1063687323 /nfs/dbraw/zinc/68/73/23/1063687323.db2.gz XTLCLJFUIZCUTF-UHFFFAOYSA-N 1 2 315.383 4.076 20 0 DIADLO FC1(F)CCC[N@@H+](C2CCN(c3ccccc3Cl)CC2)C1 ZINC001258541640 1063689854 /nfs/dbraw/zinc/68/98/54/1063689854.db2.gz SSKHKJMZJVOLNT-UHFFFAOYSA-N 1 2 314.807 4.040 20 0 DIADLO FC1(F)CCC[N@H+](C2CCN(c3ccccc3Cl)CC2)C1 ZINC001258541640 1063689860 /nfs/dbraw/zinc/68/98/60/1063689860.db2.gz SSKHKJMZJVOLNT-UHFFFAOYSA-N 1 2 314.807 4.040 20 0 DIADLO C/C(=C\c1ccccc1Cl)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001461749699 1063693197 /nfs/dbraw/zinc/69/31/97/1063693197.db2.gz XUORCZSDCISEAY-ZRDIBKRKSA-N 1 2 311.772 4.030 20 0 DIADLO Clc1cccc(C[NH2+]Cc2noc3ccccc23)c1Cl ZINC001461750250 1063693614 /nfs/dbraw/zinc/69/36/14/1063693614.db2.gz HGWSHAJLZXFPBY-UHFFFAOYSA-N 1 2 307.180 4.424 20 0 DIADLO C/C(=C\c1ccc(Cl)cc1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001461750212 1063694216 /nfs/dbraw/zinc/69/42/16/1063694216.db2.gz ZVYIIZMXXAAASE-ZRDIBKRKSA-N 1 2 311.772 4.030 20 0 DIADLO Cc1cc(C)c2cc(NCc3cn4ccnc4s3)ccc2[nH+]1 ZINC001461750653 1063695966 /nfs/dbraw/zinc/69/59/66/1063695966.db2.gz KHMDOEHCWOMSPE-UHFFFAOYSA-N 1 2 308.410 4.173 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1ccc(C(F)F)nc1 ZINC001461821471 1063735847 /nfs/dbraw/zinc/73/58/47/1063735847.db2.gz CHRAYSVGPDSMPS-UHFFFAOYSA-N 1 2 322.746 4.171 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(O)c1Cl)c1cc(F)ccc1N(C)C ZINC001461835557 1063743662 /nfs/dbraw/zinc/74/36/62/1063743662.db2.gz NFRMMJPLRJZYJO-LLVKDONJSA-N 1 2 322.811 4.102 20 0 DIADLO Clc1n[nH]c(C2CC2)c1C[N@H+](Cc1ccccc1)C1CC1 ZINC001461859550 1063754627 /nfs/dbraw/zinc/75/46/27/1063754627.db2.gz LPFFSNPFJFTKGT-UHFFFAOYSA-N 1 2 301.821 4.105 20 0 DIADLO Clc1n[nH]c(C2CC2)c1C[N@@H+](Cc1ccccc1)C1CC1 ZINC001461859550 1063754636 /nfs/dbraw/zinc/75/46/36/1063754636.db2.gz LPFFSNPFJFTKGT-UHFFFAOYSA-N 1 2 301.821 4.105 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@@H]1C[C@H](C)CC(C)(C)C1)[C@H]2C ZINC001258698611 1063757778 /nfs/dbraw/zinc/75/77/78/1063757778.db2.gz XGICDHKZCGTGTO-HRCADAONSA-N 1 2 319.493 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@@H]1C[C@H](C)CC(C)(C)C1)[C@H]2C ZINC001258698611 1063757792 /nfs/dbraw/zinc/75/77/92/1063757792.db2.gz XGICDHKZCGTGTO-HRCADAONSA-N 1 2 319.493 4.011 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCO[C@@H](c3cccc(F)c3)C2)s1 ZINC001461906222 1063787873 /nfs/dbraw/zinc/78/78/73/1063787873.db2.gz CXCZBDOGWJIRQB-GOSISDBHSA-N 1 2 319.445 4.413 20 0 DIADLO CCCc1ccc(C[N@H+]2CCO[C@@H](c3cccc(F)c3)C2)s1 ZINC001461906222 1063787876 /nfs/dbraw/zinc/78/78/76/1063787876.db2.gz CXCZBDOGWJIRQB-GOSISDBHSA-N 1 2 319.445 4.413 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@H](CC)C[C@H](C)CC)[C@H]2C ZINC001258792149 1063829743 /nfs/dbraw/zinc/82/97/43/1063829743.db2.gz DXHNHLIWFREIHC-OWCLPIDISA-N 1 2 307.482 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@H](CC)C[C@H](C)CC)[C@H]2C ZINC001258792149 1063829754 /nfs/dbraw/zinc/82/97/54/1063829754.db2.gz DXHNHLIWFREIHC-OWCLPIDISA-N 1 2 307.482 4.011 20 0 DIADLO Cc1n[nH]c(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)c1C ZINC001461947755 1063832206 /nfs/dbraw/zinc/83/22/06/1063832206.db2.gz CWORFUGAPBGHOC-UHFFFAOYSA-N 1 2 319.399 4.250 20 0 DIADLO Cc1n[nH]c(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)c1C ZINC001461947755 1063832212 /nfs/dbraw/zinc/83/22/12/1063832212.db2.gz CWORFUGAPBGHOC-UHFFFAOYSA-N 1 2 319.399 4.250 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@@H+]2CCO[C@H](c3ccco3)C2)c(C)c1 ZINC001461966945 1063846225 /nfs/dbraw/zinc/84/62/25/1063846225.db2.gz JJIYECVTJMSLHF-XXIDSNJLSA-N 1 2 311.425 4.292 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@H+]2CCO[C@H](c3ccco3)C2)c(C)c1 ZINC001461966945 1063846248 /nfs/dbraw/zinc/84/62/48/1063846248.db2.gz JJIYECVTJMSLHF-XXIDSNJLSA-N 1 2 311.425 4.292 20 0 DIADLO C[C@@H](CCOCc1ccccc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001461986986 1063858761 /nfs/dbraw/zinc/85/87/61/1063858761.db2.gz GVYKGFGNIJTVCP-KRWDZBQOSA-N 1 2 321.424 4.280 20 0 DIADLO Cc1ccccc1OCC[N@@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC001462025780 1063886954 /nfs/dbraw/zinc/88/69/54/1063886954.db2.gz JSGJIIWCRSINQG-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO Cc1ccccc1OCC[N@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC001462025780 1063886968 /nfs/dbraw/zinc/88/69/68/1063886968.db2.gz JSGJIIWCRSINQG-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO COc1cnc(F)c(C[N@H+](C)[C@@H](C)c2cc3ccccc3o2)c1 ZINC001462035930 1063893577 /nfs/dbraw/zinc/89/35/77/1063893577.db2.gz LOCKKIKYVSXZSS-LBPRGKRZSA-N 1 2 314.360 4.169 20 0 DIADLO COc1cnc(F)c(C[N@@H+](C)[C@@H](C)c2cc3ccccc3o2)c1 ZINC001462035930 1063893586 /nfs/dbraw/zinc/89/35/86/1063893586.db2.gz LOCKKIKYVSXZSS-LBPRGKRZSA-N 1 2 314.360 4.169 20 0 DIADLO Fc1cc(C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)c(F)cn1 ZINC001462045435 1063900321 /nfs/dbraw/zinc/90/03/21/1063900321.db2.gz ZYZISTLGGGSFEC-UHFFFAOYSA-N 1 2 320.770 4.303 20 0 DIADLO Fc1cc(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)c(F)cn1 ZINC001462045435 1063900333 /nfs/dbraw/zinc/90/03/33/1063900333.db2.gz ZYZISTLGGGSFEC-UHFFFAOYSA-N 1 2 320.770 4.303 20 0 DIADLO Clc1cc(CSCc2ccc(-n3cc[nH+]c3)cc2)ccn1 ZINC001261132607 1063908640 /nfs/dbraw/zinc/90/86/40/1063908640.db2.gz OOUWYFHZNSRXRB-UHFFFAOYSA-N 1 2 315.829 4.354 20 0 DIADLO CCC[N@H+](Cc1cc(C(C)(C)C)oc1C)[C@@H](CC)C(=O)OCC ZINC001462083689 1063920351 /nfs/dbraw/zinc/92/03/51/1063920351.db2.gz AWGBCQLHHOBKPH-INIZCTEOSA-N 1 2 323.477 4.439 20 0 DIADLO CCC[N@@H+](Cc1cc(C(C)(C)C)oc1C)[C@@H](CC)C(=O)OCC ZINC001462083689 1063920358 /nfs/dbraw/zinc/92/03/58/1063920358.db2.gz AWGBCQLHHOBKPH-INIZCTEOSA-N 1 2 323.477 4.439 20 0 DIADLO C[C@@H](CCc1n[nH]c2ccccc21)Nc1c[nH+]c2c(c1)CCCC2 ZINC001462084756 1063921437 /nfs/dbraw/zinc/92/14/37/1063921437.db2.gz GZOYIEFFBGWCNK-AWEZNQCLSA-N 1 2 320.440 4.270 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C)sc1C)c1cccc(OC)c1OC ZINC001262015348 1063952709 /nfs/dbraw/zinc/95/27/09/1063952709.db2.gz JQHYIQPQTWJKDT-CQSZACIVSA-N 1 2 320.458 4.018 20 0 DIADLO Cn1cc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)c(C2CCCC2)n1 ZINC001262371539 1063965287 /nfs/dbraw/zinc/96/52/87/1063965287.db2.gz ORVQUYQQIGOHNA-IBGZPJMESA-N 1 2 324.472 4.056 20 0 DIADLO Cn1cc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)c(C2CCCC2)n1 ZINC001262371539 1063965290 /nfs/dbraw/zinc/96/52/90/1063965290.db2.gz ORVQUYQQIGOHNA-IBGZPJMESA-N 1 2 324.472 4.056 20 0 DIADLO COc1cc2[nH+]c(CCc3ccccc3Cl)[nH]c2cc1F ZINC000587058960 1063993600 /nfs/dbraw/zinc/99/36/00/1063993600.db2.gz KAGOPVYZHPAVAA-UHFFFAOYSA-N 1 2 304.752 4.149 20 0 DIADLO COc1cc2[nH]c(CCc3ccccc3Cl)[nH+]c2cc1F ZINC000587058960 1063993604 /nfs/dbraw/zinc/99/36/04/1063993604.db2.gz KAGOPVYZHPAVAA-UHFFFAOYSA-N 1 2 304.752 4.149 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3cc(Cl)ccc3Cl)ccn12 ZINC001264097870 1064018056 /nfs/dbraw/zinc/01/80/56/1064018056.db2.gz JGLPYOLOYGPJBO-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO O=C(/C=C/C1CCCCCC1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001264340002 1064079120 /nfs/dbraw/zinc/07/91/20/1064079120.db2.gz DCXGSXFDTVRUOW-KPKJPENVSA-N 1 2 309.413 4.337 20 0 DIADLO CCC[C@H](CC(C)C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001264722019 1064123857 /nfs/dbraw/zinc/12/38/57/1064123857.db2.gz ZOINHJNMYTZYHZ-CQSZACIVSA-N 1 2 317.408 4.412 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H]3CCC[C@@H]4CCCC[C@H]34)ccc2[nH+]1 ZINC001264857945 1064151454 /nfs/dbraw/zinc/15/14/54/1064151454.db2.gz NWQSICWCYDOWIX-BHYGNILZSA-N 1 2 311.429 4.188 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc(Br)c(F)c1F ZINC000701299017 1064246336 /nfs/dbraw/zinc/24/63/36/1064246336.db2.gz IZZVTNRIOAQABQ-VHSXEESVSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc(Br)c(F)c1F ZINC000701299017 1064246342 /nfs/dbraw/zinc/24/63/42/1064246342.db2.gz IZZVTNRIOAQABQ-VHSXEESVSA-N 1 2 318.205 4.348 20 0 DIADLO CCCc1ccc(CCCC(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001280276120 1064390451 /nfs/dbraw/zinc/39/04/51/1064390451.db2.gz YJFMITYABBHCSE-UHFFFAOYSA-N 1 2 321.424 4.248 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@]3(C)CCC[C@@H]3C)c2)[nH+]c1C ZINC001292072769 1064757993 /nfs/dbraw/zinc/75/79/93/1064757993.db2.gz KSOLDLYUZLWNGV-BUXKBTBVSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@]3(C)CCC[C@H]3C)c2)[nH+]c1C ZINC001292072768 1064758681 /nfs/dbraw/zinc/75/86/81/1064758681.db2.gz KSOLDLYUZLWNGV-BLVKFPJESA-N 1 2 311.429 4.458 20 0 DIADLO Cc1nc(NC[C@H]2CCCCC(F)(F)C2)c2c([nH+]1)CCCC2 ZINC001307130304 1064766182 /nfs/dbraw/zinc/76/61/82/1064766182.db2.gz PGHHTKCBZLVXGY-ZDUSSCGKSA-N 1 2 309.404 4.291 20 0 DIADLO Cc1cc(NC(=O)C2CCCCCCC2)ccc1-n1cc[nH+]c1 ZINC001292865149 1064791195 /nfs/dbraw/zinc/79/11/95/1064791195.db2.gz PNPZANZNSORNPQ-UHFFFAOYSA-N 1 2 311.429 4.480 20 0 DIADLO Cc1cc(N[C@H]2C[C@H](Sc3ccccc3)C2)nc(C2CC2)[nH+]1 ZINC001307177389 1064883010 /nfs/dbraw/zinc/88/30/10/1064883010.db2.gz TUACAPVIFACULH-KOMQPUFPSA-N 1 2 311.454 4.398 20 0 DIADLO CCCCN(C(=O)c1cc2c[nH+]ccc2[nH]1)[C@@H]1CCC[C@H](C)C1 ZINC001298620109 1065011678 /nfs/dbraw/zinc/01/16/78/1065011678.db2.gz VPRPNAFAONFROA-GOEBONIOSA-N 1 2 313.445 4.384 20 0 DIADLO CCC[C@@](C)(CC)C(=O)N1CC[NH2+][C@H](c2ccc(Cl)cc2)C1 ZINC001301662166 1065070231 /nfs/dbraw/zinc/07/02/31/1065070231.db2.gz NXVXNFGHMXAHPI-FUHWJXTLSA-N 1 2 322.880 4.029 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1noc(C)n1)c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C ZINC000666122458 1065079781 /nfs/dbraw/zinc/07/97/81/1065079781.db2.gz NYEJJDRVNFLXDA-PHKINGBFSA-N 1 2 319.836 4.145 20 0 DIADLO O=C(Nc1ccc(C2CC2)cc1F)c1ccc(-n2cc[nH+]c2)cc1 ZINC001302867663 1065101372 /nfs/dbraw/zinc/10/13/72/1065101372.db2.gz DXWRWVWODHSVHU-UHFFFAOYSA-N 1 2 321.355 4.141 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3cc4occc4[nH]3)cc2)[nH+]c1C ZINC001303122280 1065108059 /nfs/dbraw/zinc/10/80/59/1065108059.db2.gz KHADIWHQOKPJJR-UHFFFAOYSA-N 1 2 320.352 4.020 20 0 DIADLO CC(C)=CCC[C@H](C)CC(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001303609343 1065119217 /nfs/dbraw/zinc/11/92/17/1065119217.db2.gz SIELJEWVQHWBJQ-YOEHRIQHSA-N 1 2 317.477 4.463 20 0 DIADLO CC(C)CCCC(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1 ZINC001306237151 1065174148 /nfs/dbraw/zinc/17/41/48/1065174148.db2.gz AKOWPLIPWWZCQY-UHFFFAOYSA-N 1 2 323.506 4.140 20 0 DIADLO C[C@@H](NC(=O)[C@H]1CCCC2(CC2)C1)c1ccc(-n2cc[nH+]c2)cc1 ZINC001306753941 1065192680 /nfs/dbraw/zinc/19/26/80/1065192680.db2.gz GTAHWQXUHWNWBD-WBVHZDCISA-N 1 2 323.440 4.020 20 0 DIADLO CC(C)c1cc(N(C)CCOc2ccccc2)nc(C(C)C)[nH+]1 ZINC001306913353 1065202013 /nfs/dbraw/zinc/20/20/13/1065202013.db2.gz KBJKKEJNDXRMII-UHFFFAOYSA-N 1 2 313.445 4.239 20 0 DIADLO CCN(CCNc1cc(C)[nH+]c(C2CCC2)n1)c1cccc(C)c1 ZINC001306916887 1065204360 /nfs/dbraw/zinc/20/43/60/1065204360.db2.gz SDCPHBKQCOFWKO-UHFFFAOYSA-N 1 2 324.472 4.299 20 0 DIADLO COc1ccc([C@H](C)N(C)c2cc(C)[nH+]c(C3CCC3)n2)cc1 ZINC001306926506 1065208327 /nfs/dbraw/zinc/20/83/27/1065208327.db2.gz RERQDWHWXMXOPH-AWEZNQCLSA-N 1 2 311.429 4.259 20 0 DIADLO CCc1cc(N(C)Cc2cccc3ccccc32)nc(CC)[nH+]1 ZINC001306938791 1065212309 /nfs/dbraw/zinc/21/23/09/1065212309.db2.gz ZYIAKZVAANWAHC-UHFFFAOYSA-N 1 2 305.425 4.391 20 0 DIADLO CCc1cccc2c1OCC[C@H]2Nc1nc(C)[nH+]c2c1CCCC2 ZINC001306952240 1065218897 /nfs/dbraw/zinc/21/88/97/1065218897.db2.gz COCYPOXNWOGPBO-GOSISDBHSA-N 1 2 323.440 4.162 20 0 DIADLO CCO[C@H]1C[C@H](N(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)C1(C)C ZINC001306976279 1065230949 /nfs/dbraw/zinc/23/09/49/1065230949.db2.gz LZLKBUHFSYEPFC-HOTGVXAUSA-N 1 2 319.493 4.363 20 0 DIADLO CC(C)c1cc(NCC2(CCO)CCCC2)nc(C(C)C)[nH+]1 ZINC001306977087 1065231814 /nfs/dbraw/zinc/23/18/14/1065231814.db2.gz AJGBERKMMBLSIH-UHFFFAOYSA-N 1 2 305.466 4.078 20 0 DIADLO Cc1nc(N2CC[C@@H](c3ccccc3)[C@@H]2C)c2c([nH+]1)CCCC2 ZINC001306988876 1065237885 /nfs/dbraw/zinc/23/78/85/1065237885.db2.gz DKLGYQBFFUMANG-WMLDXEAASA-N 1 2 307.441 4.046 20 0 DIADLO Cc1nc(N2CC[C@H](c3ccccc3)[C@@H]2C)c2c([nH+]1)CCCC2 ZINC001306988877 1065239000 /nfs/dbraw/zinc/23/90/00/1065239000.db2.gz DKLGYQBFFUMANG-YOEHRIQHSA-N 1 2 307.441 4.046 20 0 DIADLO CCO[C@@H](CCNc1nc(C)[nH+]c2c1CCCC2)C1CCCC1 ZINC001306990947 1065240197 /nfs/dbraw/zinc/24/01/97/1065240197.db2.gz QDEXGKNAGTYOJK-SFHVURJKSA-N 1 2 317.477 4.061 20 0 DIADLO Cc1cccc(C)c1CNc1nc2ccccc2n2c[nH+]cc12 ZINC001307074878 1065250931 /nfs/dbraw/zinc/25/09/31/1065250931.db2.gz GWACKVUERFEMBC-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO C[C@H](CNc1nc2ccccc2n2c[nH+]cc12)c1ccccc1 ZINC001307089787 1065257153 /nfs/dbraw/zinc/25/71/53/1065257153.db2.gz DBHCOFLOGSHMDL-CQSZACIVSA-N 1 2 302.381 4.098 20 0 DIADLO Cc1cc(N2CCc3ccccc3[C@@H]2C(C)C)nc(C2CC2)[nH+]1 ZINC001307121779 1065271776 /nfs/dbraw/zinc/27/17/76/1065271776.db2.gz SXAMXDMUASUJHB-IBGZPJMESA-N 1 2 307.441 4.422 20 0 DIADLO CCc1cc(N[C@@H]2[C@H]3Cc4c(cccc4Cl)[C@@H]23)nc(CC)[nH+]1 ZINC001307185780 1065296896 /nfs/dbraw/zinc/29/68/96/1065296896.db2.gz TWFXDFGLTCWNID-MORSLUCNSA-N 1 2 313.832 4.005 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSc1nc(C(C)C)c[nH]1 ZINC001307373060 1065359629 /nfs/dbraw/zinc/35/96/29/1065359629.db2.gz BHXVNRYWLBXITC-UHFFFAOYSA-N 1 2 312.442 4.320 20 0 DIADLO Cc1cccc(OCC[N@@H+](C)Cc2c(F)cccc2Cl)c1 ZINC001307418773 1065379751 /nfs/dbraw/zinc/37/97/51/1065379751.db2.gz OYKUPVKZVZNWID-UHFFFAOYSA-N 1 2 307.796 4.298 20 0 DIADLO Cc1cccc(OCC[N@H+](C)Cc2c(F)cccc2Cl)c1 ZINC001307418773 1065379763 /nfs/dbraw/zinc/37/97/63/1065379763.db2.gz OYKUPVKZVZNWID-UHFFFAOYSA-N 1 2 307.796 4.298 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+](Cc1ccc(F)cc1Cl)CC2 ZINC001307432899 1065393259 /nfs/dbraw/zinc/39/32/59/1065393259.db2.gz CLWPWPAYWCSYEQ-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+](Cc1ccc(F)cc1Cl)CC2 ZINC001307432899 1065393263 /nfs/dbraw/zinc/39/32/63/1065393263.db2.gz CLWPWPAYWCSYEQ-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO Fc1ccc(C(F)(F)C[N@@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC001307432870 1065393355 /nfs/dbraw/zinc/39/33/55/1065393355.db2.gz BKDHOBCYJQKHBE-HNNXBMFYSA-N 1 2 305.343 4.407 20 0 DIADLO Fc1ccc(C(F)(F)C[N@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC001307432870 1065393358 /nfs/dbraw/zinc/39/33/58/1065393358.db2.gz BKDHOBCYJQKHBE-HNNXBMFYSA-N 1 2 305.343 4.407 20 0 DIADLO COC(=O)C[N@H+](Cc1ccc(-c2ccc(C)cc2)s1)C(C)C ZINC001307432443 1065393810 /nfs/dbraw/zinc/39/38/10/1065393810.db2.gz QKKIAXYVYTWITG-UHFFFAOYSA-N 1 2 317.454 4.107 20 0 DIADLO COC(=O)C[N@@H+](Cc1ccc(-c2ccc(C)cc2)s1)C(C)C ZINC001307432443 1065393813 /nfs/dbraw/zinc/39/38/13/1065393813.db2.gz QKKIAXYVYTWITG-UHFFFAOYSA-N 1 2 317.454 4.107 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@H](CC(C)C)C1 ZINC001307506899 1065449374 /nfs/dbraw/zinc/44/93/74/1065449374.db2.gz RCBFBEGVUCPVDE-PBHICJAKSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@H](CC(C)C)C1 ZINC001307506899 1065449380 /nfs/dbraw/zinc/44/93/80/1065449380.db2.gz RCBFBEGVUCPVDE-PBHICJAKSA-N 1 2 323.864 4.312 20 0 DIADLO CC(C)c1nc([C@H]2CCCC[N@@H+]2CCCc2ccsc2)no1 ZINC001307509291 1065450497 /nfs/dbraw/zinc/45/04/97/1065450497.db2.gz FWXUODGEQXQTDB-OAHLLOKOSA-N 1 2 319.474 4.414 20 0 DIADLO CC(C)c1nc([C@H]2CCCC[N@H+]2CCCc2ccsc2)no1 ZINC001307509291 1065450505 /nfs/dbraw/zinc/45/05/05/1065450505.db2.gz FWXUODGEQXQTDB-OAHLLOKOSA-N 1 2 319.474 4.414 20 0 DIADLO Fc1cccc(C[N@@H+]2CC[C@H]2c2ccccc2)c1OC(F)F ZINC001307515297 1065456428 /nfs/dbraw/zinc/45/64/28/1065456428.db2.gz ZRINQTXQOXLIDO-HNNXBMFYSA-N 1 2 307.315 4.374 20 0 DIADLO Fc1cccc(C[N@H+]2CC[C@H]2c2ccccc2)c1OC(F)F ZINC001307515297 1065456433 /nfs/dbraw/zinc/45/64/33/1065456433.db2.gz ZRINQTXQOXLIDO-HNNXBMFYSA-N 1 2 307.315 4.374 20 0 DIADLO C[C@H]1c2cc(Cl)cc(Cl)c2CC[N@H+]1CCOCC1CC1 ZINC001307529343 1065466540 /nfs/dbraw/zinc/46/65/40/1065466540.db2.gz JKZAMEQLDDEITJ-NSHDSACASA-N 1 2 314.256 4.339 20 0 DIADLO C[C@H]1c2cc(Cl)cc(Cl)c2CC[N@@H+]1CCOCC1CC1 ZINC001307529343 1065466543 /nfs/dbraw/zinc/46/65/43/1065466543.db2.gz JKZAMEQLDDEITJ-NSHDSACASA-N 1 2 314.256 4.339 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1CCOC2(C1)CCCCCC2 ZINC001307529743 1065467162 /nfs/dbraw/zinc/46/71/62/1065467162.db2.gz KRJJCIYHBHOQDM-AWEZNQCLSA-N 1 2 309.400 4.451 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+]1CCOC2(C1)CCCCCC2 ZINC001307529743 1065467165 /nfs/dbraw/zinc/46/71/65/1065467165.db2.gz KRJJCIYHBHOQDM-AWEZNQCLSA-N 1 2 309.400 4.451 20 0 DIADLO C[C@@H]1[N@H+](CCc2cccc(Cl)c2Cl)CCOC1(C)C ZINC001307528385 1065467486 /nfs/dbraw/zinc/46/74/86/1065467486.db2.gz FKTMJDAFTDRZJT-NSHDSACASA-N 1 2 302.245 4.035 20 0 DIADLO C[C@@H]1[N@@H+](CCc2cccc(Cl)c2Cl)CCOC1(C)C ZINC001307528385 1065467490 /nfs/dbraw/zinc/46/74/90/1065467490.db2.gz FKTMJDAFTDRZJT-NSHDSACASA-N 1 2 302.245 4.035 20 0 DIADLO CCOC(=O)CC(C)(C)CC[N@H+](CC)c1cc(C)ccc1C ZINC001307534809 1065469533 /nfs/dbraw/zinc/46/95/33/1065469533.db2.gz HAMHKVRABOUCBA-UHFFFAOYSA-N 1 2 305.462 4.499 20 0 DIADLO CCOC(=O)CC(C)(C)CC[N@@H+](CC)c1cc(C)ccc1C ZINC001307534809 1065469540 /nfs/dbraw/zinc/46/95/40/1065469540.db2.gz HAMHKVRABOUCBA-UHFFFAOYSA-N 1 2 305.462 4.499 20 0 DIADLO CCN(Cc1cc[nH+]c(N(C)C)c1)c1ccc2ccccc2c1 ZINC001307538964 1065472207 /nfs/dbraw/zinc/47/22/07/1065472207.db2.gz KATQAKHRYJGRBP-UHFFFAOYSA-N 1 2 305.425 4.327 20 0 DIADLO CCSCC[C@@H](C)[N@H+](C)Cc1c(Cl)cncc1Cl ZINC001307561863 1065484594 /nfs/dbraw/zinc/48/45/94/1065484594.db2.gz MXBUAYRKZQTNOR-SNVBAGLBSA-N 1 2 307.290 4.352 20 0 DIADLO CCSCC[C@@H](C)[N@@H+](C)Cc1c(Cl)cncc1Cl ZINC001307561863 1065484601 /nfs/dbraw/zinc/48/46/01/1065484601.db2.gz MXBUAYRKZQTNOR-SNVBAGLBSA-N 1 2 307.290 4.352 20 0 DIADLO Cc1ccc(N2CC[NH+](Cc3ccc(Cl)c(F)c3)CC2)cc1 ZINC001307600475 1065506289 /nfs/dbraw/zinc/50/62/89/1065506289.db2.gz CPSXCEGFHLAOHX-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cc2ccccc2o1)c1nc(C2CC2)no1 ZINC001307614982 1065519301 /nfs/dbraw/zinc/51/93/01/1065519301.db2.gz OKVIJJMXFUEDEZ-MRXNPFEDSA-N 1 2 311.385 4.180 20 0 DIADLO CCNc1nc(C[NH2+][C@@H](C)c2ccccc2OC(C)C)cs1 ZINC001307632132 1065530155 /nfs/dbraw/zinc/53/01/55/1065530155.db2.gz UOYQDPVJWLDTSN-ZDUSSCGKSA-N 1 2 319.474 4.213 20 0 DIADLO Fc1ccc(Br)c2c1C[N@H+](CC1=CCCC1)CC2 ZINC001307665763 1065551720 /nfs/dbraw/zinc/55/17/20/1065551720.db2.gz DAQOJBSYNANGLW-UHFFFAOYSA-N 1 2 310.210 4.057 20 0 DIADLO Fc1ccc(Br)c2c1C[N@@H+](CC1=CCCC1)CC2 ZINC001307665763 1065551730 /nfs/dbraw/zinc/55/17/30/1065551730.db2.gz DAQOJBSYNANGLW-UHFFFAOYSA-N 1 2 310.210 4.057 20 0 DIADLO CCC(C)(C)c1ccc(C[N@H+](C)CC(=O)OC(C)(C)C)cc1 ZINC001307725740 1065588994 /nfs/dbraw/zinc/58/89/94/1065588994.db2.gz YLWVKEFVCFEJAQ-UHFFFAOYSA-N 1 2 305.462 4.148 20 0 DIADLO CCC(C)(C)c1ccc(C[N@@H+](C)CC(=O)OC(C)(C)C)cc1 ZINC001307725740 1065589007 /nfs/dbraw/zinc/58/90/07/1065589007.db2.gz YLWVKEFVCFEJAQ-UHFFFAOYSA-N 1 2 305.462 4.148 20 0 DIADLO C[C@]12CC[N@H+](Cc3ccc(Cl)cc3F)C[C@H]1C2(Cl)Cl ZINC001307767193 1065612302 /nfs/dbraw/zinc/61/23/02/1065612302.db2.gz RPZKOKDMXFIVAZ-OLZOCXBDSA-N 1 2 322.638 4.495 20 0 DIADLO C[C@]12CC[N@@H+](Cc3ccc(Cl)cc3F)C[C@H]1C2(Cl)Cl ZINC001307767193 1065612308 /nfs/dbraw/zinc/61/23/08/1065612308.db2.gz RPZKOKDMXFIVAZ-OLZOCXBDSA-N 1 2 322.638 4.495 20 0 DIADLO CC[C@@H]1CC[C@H](C)[N@H+](Cc2nc(C)c(Br)s2)C1 ZINC001307768700 1065613664 /nfs/dbraw/zinc/61/36/64/1065613664.db2.gz UJPINGXHKVLLCN-GXSJLCMTSA-N 1 2 317.296 4.225 20 0 DIADLO CC[C@@H]1CC[C@H](C)[N@@H+](Cc2nc(C)c(Br)s2)C1 ZINC001307768700 1065613670 /nfs/dbraw/zinc/61/36/70/1065613670.db2.gz UJPINGXHKVLLCN-GXSJLCMTSA-N 1 2 317.296 4.225 20 0 DIADLO COc1c(C)c[nH+]c(CN[C@@H](C(F)F)C2CCCCC2)c1C ZINC001307945818 1065692816 /nfs/dbraw/zinc/69/28/16/1065692816.db2.gz QYRLETYOCDUGLB-OAHLLOKOSA-N 1 2 312.404 4.011 20 0 DIADLO CCC(CC)CCC[N@H+](C)[C@H](C(=O)OC)c1cccc(OC)c1 ZINC001307970398 1065704244 /nfs/dbraw/zinc/70/42/44/1065704244.db2.gz ZNHXNDFHLJSAFP-SFHVURJKSA-N 1 2 321.461 4.058 20 0 DIADLO CCC(CC)CCC[N@@H+](C)[C@H](C(=O)OC)c1cccc(OC)c1 ZINC001307970398 1065704256 /nfs/dbraw/zinc/70/42/56/1065704256.db2.gz ZNHXNDFHLJSAFP-SFHVURJKSA-N 1 2 321.461 4.058 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+]1CC=C(c2ccc(Cl)cc2C)CC1 ZINC001307980681 1065709068 /nfs/dbraw/zinc/70/90/68/1065709068.db2.gz BZXBCVYLCODAPK-CQSZACIVSA-N 1 2 321.848 4.079 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+]1CC=C(c2ccc(Cl)cc2C)CC1 ZINC001307980681 1065709081 /nfs/dbraw/zinc/70/90/81/1065709081.db2.gz BZXBCVYLCODAPK-CQSZACIVSA-N 1 2 321.848 4.079 20 0 DIADLO Cc1nocc1C[N@@H+](C)Cc1ccccc1OCc1ccccc1 ZINC001307996927 1065717335 /nfs/dbraw/zinc/71/73/35/1065717335.db2.gz ZFJNVUZRGMWQQO-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1nocc1C[N@H+](C)Cc1ccccc1OCc1ccccc1 ZINC001307996927 1065717342 /nfs/dbraw/zinc/71/73/42/1065717342.db2.gz ZFJNVUZRGMWQQO-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO CC(C)COC(=O)C[NH2+][C@H]1CCC(C)(C)C[C@@H]1c1ccccc1 ZINC001308024260 1065727448 /nfs/dbraw/zinc/72/74/48/1065727448.db2.gz SUHUIKZUBALQGW-MSOLQXFVSA-N 1 2 317.473 4.138 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2Cc2nc(C(C)(C)C)cs2)[nH+]c1C ZINC001308070251 1065749478 /nfs/dbraw/zinc/74/94/78/1065749478.db2.gz GJZFOCFSZAFGDT-CYBMUJFWSA-N 1 2 318.490 4.118 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[NH2+]Cc1ncc(-c2cccs2)o1 ZINC001308085387 1065754741 /nfs/dbraw/zinc/75/47/41/1065754741.db2.gz OMEXYSSFRYGJKP-AWEZNQCLSA-N 1 2 314.385 4.319 20 0 DIADLO c1c2cnccc2oc1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC001308181074 1065791207 /nfs/dbraw/zinc/79/12/07/1065791207.db2.gz SCNDFCQXTSQUIF-HXUWFJFHSA-N 1 2 315.376 4.102 20 0 DIADLO COc1ccc(C[NH2+]Cc2nc(C(C)(C)C)cs2)c(Cl)c1 ZINC001308250211 1065853647 /nfs/dbraw/zinc/85/36/47/1065853647.db2.gz ASKKLSKFDLFNSF-UHFFFAOYSA-N 1 2 324.877 4.392 20 0 DIADLO C[C@H]1COCCN1c1ccc([NH2+]CC(C)(C)c2ccccc2)cc1 ZINC001308312509 1065904538 /nfs/dbraw/zinc/90/45/38/1065904538.db2.gz YILGGSPEIJGUAC-KRWDZBQOSA-N 1 2 324.468 4.301 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3cccc4ncccc34)ccc21 ZINC001308321313 1065911002 /nfs/dbraw/zinc/91/10/02/1065911002.db2.gz BPUNRULCHLAPTB-UHFFFAOYSA-N 1 2 303.409 4.229 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3cccc4ncccc34)ccc21 ZINC001308321313 1065911015 /nfs/dbraw/zinc/91/10/15/1065911015.db2.gz BPUNRULCHLAPTB-UHFFFAOYSA-N 1 2 303.409 4.229 20 0 DIADLO Cc1cc(NCc2ccc3cnccc3c2)ccc1-n1cc[nH+]c1 ZINC001308324822 1065912825 /nfs/dbraw/zinc/91/28/25/1065912825.db2.gz QAENJADTQFBONY-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO CN(C)c1ccc(NCc2ccc(Oc3ccccc3)o2)c[nH+]1 ZINC001308325345 1065915502 /nfs/dbraw/zinc/91/55/02/1065915502.db2.gz CAYCOHZPDFHXPD-UHFFFAOYSA-N 1 2 309.369 4.145 20 0 DIADLO C[C@H]([NH2+]C/C=C\c1cccc(F)c1)c1noc(-c2ccccc2)n1 ZINC001308329241 1065918136 /nfs/dbraw/zinc/91/81/36/1065918136.db2.gz UJKLRDWXMABHRL-QPBFKRLHSA-N 1 2 323.371 4.240 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+]Cc1cscc1Cl)CCC2 ZINC001308342110 1065925955 /nfs/dbraw/zinc/92/59/55/1065925955.db2.gz FTJNJHCPFHRDPP-AWEZNQCLSA-N 1 2 309.866 4.346 20 0 DIADLO CC(C)Oc1ccc(CNc2[nH+]cccc2OC(C)C)cc1 ZINC001308373781 1065947907 /nfs/dbraw/zinc/94/79/07/1065947907.db2.gz JZAOTMNHIWNKLR-UHFFFAOYSA-N 1 2 300.402 4.268 20 0 DIADLO CC(=O)N(c1ccc(NCc2cc(C)[nH+]c(C)c2)cc1)[C@H]1C[C@H]1C ZINC001308415589 1065973638 /nfs/dbraw/zinc/97/36/38/1065973638.db2.gz YJTVJABDNSAZED-XCLFUZPHSA-N 1 2 323.440 4.072 20 0 DIADLO CC(=O)N(c1ccc(NCc2cc(C)[nH+]c(C)c2)cc1)[C@@H]1C[C@H]1C ZINC001308415591 1065973848 /nfs/dbraw/zinc/97/38/48/1065973848.db2.gz YJTVJABDNSAZED-ZUOKHONESA-N 1 2 323.440 4.072 20 0 DIADLO Fc1ccc2c(C[NH2+]Cc3ccc(F)cc3Cl)noc2c1 ZINC001308501477 1066030695 /nfs/dbraw/zinc/03/06/95/1066030695.db2.gz ZTRXSDZOOKCJCJ-UHFFFAOYSA-N 1 2 308.715 4.049 20 0 DIADLO Cc1ccc2[nH+]c(NCc3nc(C(C)(C)C)cs3)[nH]c2c1 ZINC001308500447 1066030958 /nfs/dbraw/zinc/03/09/58/1066030958.db2.gz BXOHEGHIFDYVLH-UHFFFAOYSA-N 1 2 300.431 4.237 20 0 DIADLO Cc1ccc(CNc2[nH+]c3ccccc3n2CCC(C)C)nc1 ZINC001308507615 1066036511 /nfs/dbraw/zinc/03/65/11/1066036511.db2.gz SDQVYFNIPQBHDF-UHFFFAOYSA-N 1 2 308.429 4.398 20 0 DIADLO CC[N@H+](Cc1cc(C)c(O)c(C)c1)Cc1c(F)cccc1F ZINC001308560796 1066070641 /nfs/dbraw/zinc/07/06/41/1066070641.db2.gz SNCOMTCIZBCWBS-UHFFFAOYSA-N 1 2 305.368 4.309 20 0 DIADLO CC[N@@H+](Cc1cc(C)c(O)c(C)c1)Cc1c(F)cccc1F ZINC001308560796 1066070651 /nfs/dbraw/zinc/07/06/51/1066070651.db2.gz SNCOMTCIZBCWBS-UHFFFAOYSA-N 1 2 305.368 4.309 20 0 DIADLO CC(C)[N@H+](Cc1cn(C)nc1Cl)Cc1cccc(Cl)c1 ZINC001308571556 1066080329 /nfs/dbraw/zinc/08/03/29/1066080329.db2.gz VKPBEORKQJDCPQ-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO CC(C)[N@@H+](Cc1cn(C)nc1Cl)Cc1cccc(Cl)c1 ZINC001308571556 1066080339 /nfs/dbraw/zinc/08/03/39/1066080339.db2.gz VKPBEORKQJDCPQ-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO CC(C)[C@@H]1CCC[N@H+](Cc2csc(C(F)(F)F)n2)CC1 ZINC001308572951 1066085362 /nfs/dbraw/zinc/08/53/62/1066085362.db2.gz AZBKNRYRLVWMBV-LLVKDONJSA-N 1 2 306.397 4.420 20 0 DIADLO CC(C)[C@@H]1CCC[N@@H+](Cc2csc(C(F)(F)F)n2)CC1 ZINC001308572951 1066085372 /nfs/dbraw/zinc/08/53/72/1066085372.db2.gz AZBKNRYRLVWMBV-LLVKDONJSA-N 1 2 306.397 4.420 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308574428 1066087843 /nfs/dbraw/zinc/08/78/43/1066087843.db2.gz VSZLETLKCNGSAN-NHYWBVRUSA-N 1 2 321.342 4.393 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308574428 1066087855 /nfs/dbraw/zinc/08/78/55/1066087855.db2.gz VSZLETLKCNGSAN-NHYWBVRUSA-N 1 2 321.342 4.393 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2nccn2C2CC2)o1 ZINC001308578829 1066093090 /nfs/dbraw/zinc/09/30/90/1066093090.db2.gz QTQPRHZSGSPXNI-RHSMWYFYSA-N 1 2 313.445 4.347 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2nccn2C2CC2)o1 ZINC001308578829 1066093095 /nfs/dbraw/zinc/09/30/95/1066093095.db2.gz QTQPRHZSGSPXNI-RHSMWYFYSA-N 1 2 313.445 4.347 20 0 DIADLO CCOC(=O)[C@@H]1CCCC[N@@H+]1C/C=C/c1cc(C)c(C)cc1C ZINC001308598574 1066108984 /nfs/dbraw/zinc/10/89/84/1066108984.db2.gz RNRZYVWAOQRNBW-SGQUHAKNSA-N 1 2 315.457 4.043 20 0 DIADLO CCOC(=O)[C@@H]1CCCC[N@H+]1C/C=C/c1cc(C)c(C)cc1C ZINC001308598574 1066108988 /nfs/dbraw/zinc/10/89/88/1066108988.db2.gz RNRZYVWAOQRNBW-SGQUHAKNSA-N 1 2 315.457 4.043 20 0 DIADLO Clc1ccc([C@H]2CCC[N@@H+]2Cc2cc3n(n2)CCCC3)cc1 ZINC001308606509 1066113716 /nfs/dbraw/zinc/11/37/16/1066113716.db2.gz XCURINTZPZCKBF-GOSISDBHSA-N 1 2 315.848 4.210 20 0 DIADLO Clc1ccc([C@H]2CCC[N@H+]2Cc2cc3n(n2)CCCC3)cc1 ZINC001308606509 1066113718 /nfs/dbraw/zinc/11/37/18/1066113718.db2.gz XCURINTZPZCKBF-GOSISDBHSA-N 1 2 315.848 4.210 20 0 DIADLO CCC[N@H+](Cc1ccc(F)cc1)Cc1c(F)ccc(O)c1F ZINC001308626430 1066125042 /nfs/dbraw/zinc/12/50/42/1066125042.db2.gz UMRVIOVJSLAMHV-UHFFFAOYSA-N 1 2 309.331 4.222 20 0 DIADLO CCC[N@@H+](Cc1ccc(F)cc1)Cc1c(F)ccc(O)c1F ZINC001308626430 1066125046 /nfs/dbraw/zinc/12/50/46/1066125046.db2.gz UMRVIOVJSLAMHV-UHFFFAOYSA-N 1 2 309.331 4.222 20 0 DIADLO c1coc(C[NH+](Cc2ccco2)Cc2cc3cccnc3o2)c1 ZINC001308649629 1066136611 /nfs/dbraw/zinc/13/66/11/1066136611.db2.gz KNRUGTXELVPJFI-UHFFFAOYSA-N 1 2 308.337 4.216 20 0 DIADLO Cc1cc(F)cc2c1C[N@H+](Cc1cc(F)cc(Cl)c1)CC2 ZINC001308715765 1066195903 /nfs/dbraw/zinc/19/59/03/1066195903.db2.gz NWJFZKYCNSBWDQ-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO Cc1cc(F)cc2c1C[N@@H+](Cc1cc(F)cc(Cl)c1)CC2 ZINC001308715765 1066195909 /nfs/dbraw/zinc/19/59/09/1066195909.db2.gz NWJFZKYCNSBWDQ-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO C/C=C/C[C@H]([NH2+][C@@H](CC)Cc1ccc(Cl)cc1)C(=O)OCC ZINC001308740087 1066213246 /nfs/dbraw/zinc/21/32/46/1066213246.db2.gz MURXXQVPNSWMEX-SFXFJHKKSA-N 1 2 323.864 4.149 20 0 DIADLO Fc1cccc(C=C2CC[NH+](Cc3cn(C4CC4)cn3)CC2)c1 ZINC001308740429 1066214375 /nfs/dbraw/zinc/21/43/75/1066214375.db2.gz LJKGTFJYBUJFFD-UHFFFAOYSA-N 1 2 311.404 4.037 20 0 DIADLO FC(F)(F)C1C[NH+](CCCc2c(Cl)cccc2Cl)C1 ZINC001308771091 1066243840 /nfs/dbraw/zinc/24/38/40/1066243840.db2.gz BYLMJDLAUJAMFI-UHFFFAOYSA-N 1 2 312.162 4.420 20 0 DIADLO COc1cc2c(cc1Cl)C[N@H+](Cc1cc(C)oc1C)CC2 ZINC001308788180 1066261163 /nfs/dbraw/zinc/26/11/63/1066261163.db2.gz GUWLAAGQTWRGMP-UHFFFAOYSA-N 1 2 305.805 4.117 20 0 DIADLO COc1cc2c(cc1Cl)C[N@@H+](Cc1cc(C)oc1C)CC2 ZINC001308788180 1066261173 /nfs/dbraw/zinc/26/11/73/1066261173.db2.gz GUWLAAGQTWRGMP-UHFFFAOYSA-N 1 2 305.805 4.117 20 0 DIADLO Cc1[nH]c(CN2C[C@H](C)CSc3ccc(Cl)cc32)[nH+]c1C ZINC001308796293 1066273293 /nfs/dbraw/zinc/27/32/93/1066273293.db2.gz FTEDPXSNNYPMOP-JTQLQIEISA-N 1 2 321.877 4.428 20 0 DIADLO CC(C)C1(O)C[NH+](Cc2ccc(-c3ccccc3)c(Cl)c2)C1 ZINC001308807350 1066283676 /nfs/dbraw/zinc/28/36/76/1066283676.db2.gz NLSSZTWNPAIQFH-UHFFFAOYSA-N 1 2 315.844 4.210 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)o1 ZINC001308817202 1066293647 /nfs/dbraw/zinc/29/36/47/1066293647.db2.gz CALSLEGNUWGNNP-MRXNPFEDSA-N 1 2 307.340 4.294 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)o1 ZINC001308817202 1066293661 /nfs/dbraw/zinc/29/36/61/1066293661.db2.gz CALSLEGNUWGNNP-MRXNPFEDSA-N 1 2 307.340 4.294 20 0 DIADLO CC(C)(C)C[C@@H]1CC[N@H+](Cc2nc(Br)cs2)C1 ZINC001308822439 1066298268 /nfs/dbraw/zinc/29/82/68/1066298268.db2.gz DXQJCRGUCOYYPE-JTQLQIEISA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)(C)C[C@@H]1CC[N@@H+](Cc2nc(Br)cs2)C1 ZINC001308822439 1066298275 /nfs/dbraw/zinc/29/82/75/1066298275.db2.gz DXQJCRGUCOYYPE-JTQLQIEISA-N 1 2 317.296 4.164 20 0 DIADLO Clc1cc(C[NH+]2CC(CC3CC3)C2)ccc1Br ZINC001308879321 1066357540 /nfs/dbraw/zinc/35/75/40/1066357540.db2.gz YYLYUWRSGCPRFS-UHFFFAOYSA-N 1 2 314.654 4.334 20 0 DIADLO Fc1nccc(Cl)c1C[NH2+]Cc1csc(C(F)(F)F)c1 ZINC001308889506 1066371276 /nfs/dbraw/zinc/37/12/76/1066371276.db2.gz POEMFUINWSAFPZ-UHFFFAOYSA-N 1 2 324.730 4.244 20 0 DIADLO COC(=O)CCC[C@@H]1CCC[C@H](Nc2c[nH+]c(C)c(C)c2)C1 ZINC001308917986 1066395699 /nfs/dbraw/zinc/39/56/99/1066395699.db2.gz IHEVTXDZXAQJOI-HOTGVXAUSA-N 1 2 304.434 4.012 20 0 DIADLO Cc1c2cccc(Cl)c2sc1C[NH+]1CC(OC(C)C)C1 ZINC001308926403 1066401906 /nfs/dbraw/zinc/40/19/06/1066401906.db2.gz WAUGDRYGIFWZLM-UHFFFAOYSA-N 1 2 309.862 4.472 20 0 DIADLO CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001310674625 1066549841 /nfs/dbraw/zinc/54/98/41/1066549841.db2.gz HRWWSUPVZLKMPR-CABCVRRESA-N 1 2 314.433 4.061 20 0 DIADLO CC[C@H](NC(=O)Nc1ccn2cc[nH+]c2c1)c1cc(C)ccc1C ZINC001310675128 1066550137 /nfs/dbraw/zinc/55/01/37/1066550137.db2.gz OAIOVBLSHKBDSU-KRWDZBQOSA-N 1 2 322.412 4.224 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@@H]2C(C)C)cc1Oc1cc[nH+]cc1 ZINC000343286898 334928835 /nfs/dbraw/zinc/92/88/35/334928835.db2.gz BDWDZZYOLWZFNP-QGZVFWFLSA-N 1 2 310.397 4.053 20 0 DIADLO c1coc(-c2noc(C[N@@H+]3CCCCC[C@@H]3c3ccco3)n2)c1 ZINC000076803694 185043235 /nfs/dbraw/zinc/04/32/35/185043235.db2.gz LVMHFJRCCVMGJN-CYBMUJFWSA-N 1 2 313.357 4.040 20 0 DIADLO c1coc(-c2noc(C[N@H+]3CCCCC[C@@H]3c3ccco3)n2)c1 ZINC000076803694 185043237 /nfs/dbraw/zinc/04/32/37/185043237.db2.gz LVMHFJRCCVMGJN-CYBMUJFWSA-N 1 2 313.357 4.040 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)C)no2)cc1 ZINC000079314368 185164882 /nfs/dbraw/zinc/16/48/82/185164882.db2.gz TUTRNZHJFLSZMQ-KBPBESRZSA-N 1 2 317.433 4.392 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)C)no2)cc1 ZINC000079314370 185164950 /nfs/dbraw/zinc/16/49/50/185164950.db2.gz TUTRNZHJFLSZMQ-ZIAGYGMSSA-N 1 2 317.433 4.392 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2cnc(Cl)s2)s1 ZINC000079325526 185165186 /nfs/dbraw/zinc/16/51/86/185165186.db2.gz AAPGWBKWDXOVDK-SECBINFHSA-N 1 2 315.895 4.317 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cnc(Cl)s2)s1 ZINC000079325526 185165187 /nfs/dbraw/zinc/16/51/87/185165187.db2.gz AAPGWBKWDXOVDK-SECBINFHSA-N 1 2 315.895 4.317 20 0 DIADLO Cc1cccc(C2=CC[N@H+]([C@H](C)c3nc(C4CC4)no3)CC2)c1 ZINC000092822066 185344314 /nfs/dbraw/zinc/34/43/14/185344314.db2.gz WYRLPKUAKDHYNV-CQSZACIVSA-N 1 2 309.413 4.106 20 0 DIADLO Cc1cccc(C2=CC[N@@H+]([C@H](C)c3nc(C4CC4)no3)CC2)c1 ZINC000092822066 185344315 /nfs/dbraw/zinc/34/43/15/185344315.db2.gz WYRLPKUAKDHYNV-CQSZACIVSA-N 1 2 309.413 4.106 20 0 DIADLO Cc1cc(C)c(NC(=O)COc2ccc3ccccc3c2)c(C)[nH+]1 ZINC000097040015 185401775 /nfs/dbraw/zinc/40/17/75/185401775.db2.gz ZLIAPQZYZLHCKF-UHFFFAOYSA-N 1 2 320.392 4.178 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2ccc(Cl)c(Cl)c2)c(C)[nH+]1 ZINC000097039940 185401866 /nfs/dbraw/zinc/40/18/66/185401866.db2.gz NDJCZNUDRKXHGO-UHFFFAOYSA-N 1 2 323.223 4.495 20 0 DIADLO CC[C@@H](Nc1ncc(C(F)(F)F)cc1Cl)c1[nH]cc[nH+]1 ZINC000139820748 186024007 /nfs/dbraw/zinc/02/40/07/186024007.db2.gz ZUUBHWFVTSSLCJ-SECBINFHSA-N 1 2 304.703 4.040 20 0 DIADLO CC(C)([NH2+]Cc1cc(Cl)ccc1Cl)c1nccs1 ZINC000072662852 191210276 /nfs/dbraw/zinc/21/02/76/191210276.db2.gz UDYQNQRMRAXQLX-UHFFFAOYSA-N 1 2 301.242 4.475 20 0 DIADLO CC(C)([NH2+]Cc1csc(C2CCCC2)n1)c1nccs1 ZINC000072662615 191210662 /nfs/dbraw/zinc/21/06/62/191210662.db2.gz KNDRRLRYQAEVMH-UHFFFAOYSA-N 1 2 307.488 4.282 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2nc3c(s2)CCCC3)cs1 ZINC000091723598 193096714 /nfs/dbraw/zinc/09/67/14/193096714.db2.gz IXMTUTXFDQPLHB-GHMZBOCLSA-N 1 2 321.515 4.453 20 0 DIADLO Cc1ccc(C[C@H]([NH2+][C@H](C)c2nccs2)c2ccccn2)cc1 ZINC000091725246 193098129 /nfs/dbraw/zinc/09/81/29/193098129.db2.gz DXQBJQSODOSKLE-QAPCUYQASA-N 1 2 323.465 4.481 20 0 DIADLO Cc1ccc(NC(=O)Nc2cccc(COC(C)C)c2)c(C)[nH+]1 ZINC000152357417 335012186 /nfs/dbraw/zinc/01/21/86/335012186.db2.gz DFEASUBJRNCIFM-UHFFFAOYSA-N 1 2 313.401 4.267 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2ccccc2Br)s1 ZINC000134911523 335012613 /nfs/dbraw/zinc/01/26/13/335012613.db2.gz LIODLINDPZHLNS-JTQLQIEISA-N 1 2 311.248 4.065 20 0 DIADLO CCc1ccc(C2=CC[N@H+](Cc3nnc(C(C)C)o3)CC2)cc1 ZINC000093263095 193221733 /nfs/dbraw/zinc/22/17/33/193221733.db2.gz YCRZGTYLFGIKLG-UHFFFAOYSA-N 1 2 311.429 4.045 20 0 DIADLO CCc1ccc(C2=CC[N@@H+](Cc3nnc(C(C)C)o3)CC2)cc1 ZINC000093263095 193221735 /nfs/dbraw/zinc/22/17/35/193221735.db2.gz YCRZGTYLFGIKLG-UHFFFAOYSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)[C@H]([NH2+]Cc1ccn[nH]1)c1cccc(C(F)(F)F)c1 ZINC000093969324 193331889 /nfs/dbraw/zinc/33/18/89/193331889.db2.gz YNDFCJSOEIWCMT-CQSZACIVSA-N 1 2 311.351 4.306 20 0 DIADLO COc1ccc(Cl)cc1Cn1c[nH+]c2cc(F)c(F)cc21 ZINC000024427341 182380377 /nfs/dbraw/zinc/38/03/77/182380377.db2.gz DIXJPAZXONQKRT-UHFFFAOYSA-N 1 2 308.715 4.025 20 0 DIADLO CCc1nnc(C[NH2+]C(CC)(CC)c2ccc(Cl)cc2)o1 ZINC000104683318 194025919 /nfs/dbraw/zinc/02/59/19/194025919.db2.gz FQOLHJQHPCMVCK-UHFFFAOYSA-N 1 2 307.825 4.091 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](c2ccc(F)cc2)C2CCC2)no1 ZINC000104706608 194028650 /nfs/dbraw/zinc/02/86/50/194028650.db2.gz DXDYUPXWHQOGKV-SFHVURJKSA-N 1 2 317.408 4.182 20 0 DIADLO CC(C)(C)c1noc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCC2)n1 ZINC000104703631 194028776 /nfs/dbraw/zinc/02/87/76/194028776.db2.gz BUXYJQNAZGHLJW-MRXNPFEDSA-N 1 2 317.408 4.137 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCC2)no1 ZINC000104703279 194029007 /nfs/dbraw/zinc/02/90/07/194029007.db2.gz ZENBVICTYQMDAZ-MRXNPFEDSA-N 1 2 317.408 4.137 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2nc(C(C)(C)C)cs2)o1 ZINC000105498624 194107420 /nfs/dbraw/zinc/10/74/20/194107420.db2.gz FIZLJEBMUKKFBA-YPMHNXCESA-N 1 2 304.459 4.447 20 0 DIADLO C[N@H+](CC(=O)Nc1ccccc1)Cc1cc(Cl)cc(Cl)c1 ZINC000059387611 184138151 /nfs/dbraw/zinc/13/81/51/184138151.db2.gz HSTOLDYYDRRZRZ-UHFFFAOYSA-N 1 2 323.223 4.064 20 0 DIADLO C[N@@H+](CC(=O)Nc1ccccc1)Cc1cc(Cl)cc(Cl)c1 ZINC000059387611 184138152 /nfs/dbraw/zinc/13/81/52/184138152.db2.gz HSTOLDYYDRRZRZ-UHFFFAOYSA-N 1 2 323.223 4.064 20 0 DIADLO Cc1cc(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)c(C)s1 ZINC000065011513 184308412 /nfs/dbraw/zinc/30/84/12/184308412.db2.gz VIJLGHYVLPUZKY-UHFFFAOYSA-N 1 2 311.410 4.018 20 0 DIADLO C[C@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1cnccn1 ZINC000272302985 130018303 /nfs/dbraw/zinc/01/83/03/130018303.db2.gz RSAAXPHVIFMKPR-JTQLQIEISA-N 1 2 308.212 4.123 20 0 DIADLO Cc1nn(C)cc1[C@H](C)[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000272301756 130019480 /nfs/dbraw/zinc/01/94/80/130019480.db2.gz RKNYXWGFATXRNS-JTQLQIEISA-N 1 2 324.255 4.375 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cc(-c2ccco2)on1 ZINC000272413368 130029470 /nfs/dbraw/zinc/02/94/70/130029470.db2.gz GTBQCZWQQLYPFK-CYBMUJFWSA-N 1 2 312.369 4.102 20 0 DIADLO CC[C@H](C)[C@H](C)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000272539352 130038845 /nfs/dbraw/zinc/03/88/45/130038845.db2.gz KXSNTJPVAIICAT-GJZGRUSLSA-N 1 2 323.440 4.223 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc(Cl)ccc1Cl)c1nccs1 ZINC000273185515 130096482 /nfs/dbraw/zinc/09/64/82/130096482.db2.gz LEPFNPCDODXFQZ-ZDUSSCGKSA-N 1 2 316.257 4.260 20 0 DIADLO Fc1ccc([C@H]2C[C@H](Nc3cc[nH+]c4ccncc34)CCO2)cc1 ZINC000273274540 130102146 /nfs/dbraw/zinc/10/21/46/130102146.db2.gz IBNOKSNBFAQWDL-DNVCBOLYSA-N 1 2 323.371 4.101 20 0 DIADLO CCc1ccc(-c2noc([C@H](C)[NH2+][C@@H](C)c3ccccn3)n2)cc1 ZINC000273319563 130106662 /nfs/dbraw/zinc/10/66/62/130106662.db2.gz PIRZOBZFKADWLH-KBPBESRZSA-N 1 2 322.412 4.106 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2ccn(C3CCCC3)n2)C2CC2)n1 ZINC000273413581 130119589 /nfs/dbraw/zinc/11/95/89/130119589.db2.gz QUQCCMGEYPCYOF-MRXNPFEDSA-N 1 2 316.474 4.004 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2ccccc2OC(C)C)cs1 ZINC000273424155 130120922 /nfs/dbraw/zinc/12/09/22/130120922.db2.gz VZUPMGGKAAATBR-ZDUSSCGKSA-N 1 2 304.459 4.344 20 0 DIADLO Cc1ccc(NC(=O)c2scnc2C2CCCC2)c(C)[nH+]1 ZINC000273545626 130135537 /nfs/dbraw/zinc/13/55/37/130135537.db2.gz BVOIJTLTDDDRFL-UHFFFAOYSA-N 1 2 301.415 4.065 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)s1 ZINC000273657644 130149581 /nfs/dbraw/zinc/14/95/81/130149581.db2.gz XNDJACDNQQGWQV-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1ccc(Cc2noc(C[C@@H](C)c3ccccc3C)n2)c[nH+]1 ZINC000273911638 130185360 /nfs/dbraw/zinc/18/53/60/130185360.db2.gz KDJYLFTYBWQPRE-CQSZACIVSA-N 1 2 307.397 4.018 20 0 DIADLO COc1cccc(C2([NH2+]Cc3nc(Cl)ccc3Cl)CC2)c1 ZINC000274360929 130228929 /nfs/dbraw/zinc/22/89/29/130228929.db2.gz ZPUZORWVZUXOMK-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO CCn1nc(C[NH2+][C@H](C)c2ccc(F)cc2F)c2ccccc21 ZINC000274433479 130233394 /nfs/dbraw/zinc/23/33/94/130233394.db2.gz MYDACMSBDYEEQK-GFCCVEGCSA-N 1 2 315.367 4.185 20 0 DIADLO Cc1ccc2[nH+]c(CN[C@@H](C)c3csc(C(C)C)n3)cn2c1 ZINC000274515763 130242820 /nfs/dbraw/zinc/24/28/20/130242820.db2.gz XLXGXZANGMDKEE-ZDUSSCGKSA-N 1 2 314.458 4.073 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3cncc(C)c3)co2)cc1 ZINC000274635828 130250315 /nfs/dbraw/zinc/25/03/15/130250315.db2.gz SJAPROXJWJIBQB-HNNXBMFYSA-N 1 2 307.397 4.204 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1nc(C(F)(F)F)cs1 ZINC000274634453 130250989 /nfs/dbraw/zinc/25/09/89/130250989.db2.gz RYQIJQHUPDQBAK-SCZZXKLOSA-N 1 2 316.348 4.483 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(F)c1)c1nc(C(F)(F)F)cs1 ZINC000274676354 130254008 /nfs/dbraw/zinc/25/40/08/130254008.db2.gz YYMARFHPERAYSW-QMMMGPOBSA-N 1 2 304.312 4.152 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ncc(-c2ccc(Cl)cc2)o1)c1cn[nH]c1 ZINC000275198379 130297208 /nfs/dbraw/zinc/29/72/08/130297208.db2.gz QBPCAYGIKQJQLK-QWRGUYRKSA-N 1 2 316.792 4.130 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncc(-c2ccc(Cl)cc2)o1)c1cn[nH]c1 ZINC000275198378 130297913 /nfs/dbraw/zinc/29/79/13/130297913.db2.gz QBPCAYGIKQJQLK-MNOVXSKESA-N 1 2 316.792 4.130 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]Cc2ccc(C)c(Cl)c2)cs1 ZINC000277759290 130637579 /nfs/dbraw/zinc/63/75/79/130637579.db2.gz RUSUMQYIKXRBBP-NSHDSACASA-N 1 2 310.850 4.102 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1c1nc2cc(C)ccc2o1 ZINC000281970146 130895322 /nfs/dbraw/zinc/89/53/22/130895322.db2.gz LQEQBDWPUDUSKW-OAHLLOKOSA-N 1 2 310.401 4.084 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@H](c3cccc(F)c3)C2)c(C)s1 ZINC000340183421 131018559 /nfs/dbraw/zinc/01/85/59/131018559.db2.gz BHUIQZMBPZFNBZ-KRWDZBQOSA-N 1 2 305.418 4.078 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@H](c3cccc(F)c3)C2)c(C)s1 ZINC000340183421 131018561 /nfs/dbraw/zinc/01/85/61/131018561.db2.gz BHUIQZMBPZFNBZ-KRWDZBQOSA-N 1 2 305.418 4.078 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(C(C)(C)C)nc1)c1c(F)cccc1Cl ZINC000284252230 131063849 /nfs/dbraw/zinc/06/38/49/131063849.db2.gz FSQAUUWVNRHZPQ-NSHDSACASA-N 1 2 321.827 4.417 20 0 DIADLO Cc1cc([C@@H](C)Nc2ccc(-c3cn4c([nH+]3)CCCC4)cc2)no1 ZINC000285420804 131166108 /nfs/dbraw/zinc/16/61/08/131166108.db2.gz YDMIYSPSWIUYIZ-CQSZACIVSA-N 1 2 322.412 4.356 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc4occc4c3)CCCCC2)no1 ZINC000285419261 131166262 /nfs/dbraw/zinc/16/62/62/131166262.db2.gz JQAFTWAKAGYVFQ-UHFFFAOYSA-N 1 2 311.385 4.073 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ccc(Cl)nc1Cl ZINC000285509291 131175810 /nfs/dbraw/zinc/17/58/10/131175810.db2.gz DHBUVORPAZMXQJ-UHFFFAOYSA-N 1 2 314.216 4.018 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1c(F)cncc1F)c1cc(F)ccc1F ZINC000285626474 131188265 /nfs/dbraw/zinc/18/82/65/131188265.db2.gz KEPLQQFGAWDBBA-PSLIRLAXSA-N 1 2 312.310 4.440 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccc(F)cc1F ZINC000285786260 131202894 /nfs/dbraw/zinc/20/28/94/131202894.db2.gz SUEAYXCCTHZZHH-PSLIRLAXSA-N 1 2 312.310 4.440 20 0 DIADLO c1c[nH]c([C@H]([NH2+]Cc2nc(C3CC3)cs2)C2CCCCC2)n1 ZINC000286011218 131215082 /nfs/dbraw/zinc/21/50/82/131215082.db2.gz IDTKSACSMKKXIO-MRXNPFEDSA-N 1 2 316.474 4.155 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+]Cc2cc(F)ccc2Br)c1 ZINC000286087123 131218959 /nfs/dbraw/zinc/21/89/59/131218959.db2.gz MOFQXBARUUWKJE-LLVKDONJSA-N 1 2 323.209 4.142 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@@H](C)c1cc(C)ccn1)c1ccco1 ZINC000286223074 131224864 /nfs/dbraw/zinc/22/48/64/131224864.db2.gz SJVFAXMIIKMACE-YWZLYKJASA-N 1 2 322.408 4.432 20 0 DIADLO CSc1cccc(F)c1C[NH2+][C@H](C)c1cccnc1Cl ZINC000287303642 131274685 /nfs/dbraw/zinc/27/46/85/131274685.db2.gz DRMDLXHULXTEQI-SNVBAGLBSA-N 1 2 310.825 4.447 20 0 DIADLO Cc1ccccc1[C@H]1CCN(C(=O)Nc2c(C)cc[nH+]c2C)C1 ZINC000287418714 131279743 /nfs/dbraw/zinc/27/97/43/131279743.db2.gz FQANCPJHTPRLCP-INIZCTEOSA-N 1 2 309.413 4.028 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCc1cccc(C(F)(F)F)c1 ZINC000287460061 131281893 /nfs/dbraw/zinc/28/18/93/131281893.db2.gz IQXCMWOZJYFPMN-UHFFFAOYSA-N 1 2 323.318 4.039 20 0 DIADLO Fc1ccc2cc[nH+]c(NC[C@H]3CCN(c4ccccc4)C3)c2c1 ZINC000340257141 131285085 /nfs/dbraw/zinc/28/50/85/131285085.db2.gz DPYSDHCWWFTNDY-OAHLLOKOSA-N 1 2 321.399 4.312 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@@H]1c1cccs1 ZINC000287629089 131291390 /nfs/dbraw/zinc/29/13/90/131291390.db2.gz UTHHDIRXVHEAGL-CYBMUJFWSA-N 1 2 301.415 4.129 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@H](c2ccccc2)[C@@H]1C ZINC000287621406 131291650 /nfs/dbraw/zinc/29/16/50/131291650.db2.gz UFOCRFPQRKZNFM-RDJZCZTQSA-N 1 2 309.413 4.108 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)Nc1ccc(F)cc1OC(C)C ZINC000287668191 131293141 /nfs/dbraw/zinc/29/31/41/131293141.db2.gz XMZRLAMEJCMWAZ-UHFFFAOYSA-N 1 2 317.364 4.269 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000287675834 131294247 /nfs/dbraw/zinc/29/42/47/131294247.db2.gz VZJGHEQVMHXPSM-NXEZZACHSA-N 1 2 315.364 4.277 20 0 DIADLO C[C@H]1CN(c2[nH+]ccc3ccc(F)cc32)C[C@@H](c2ccccc2)O1 ZINC000340261717 131300495 /nfs/dbraw/zinc/30/04/95/131300495.db2.gz VYAYHEPEPGUPBF-LIRRHRJNSA-N 1 2 322.383 4.340 20 0 DIADLO FC(F)Sc1ccc(C[NH2+]Cc2noc3c2CCCC3)cc1 ZINC000288357271 131321562 /nfs/dbraw/zinc/32/15/62/131321562.db2.gz CRCJQHYTMVRIMC-UHFFFAOYSA-N 1 2 324.396 4.158 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@H]2CCCCS2)no1)c1ccccc1 ZINC000288958850 131348384 /nfs/dbraw/zinc/34/83/84/131348384.db2.gz BMWCBRCFNAWNDO-HUUCEWRRSA-N 1 2 317.458 4.069 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@H]2CCCCS2)no1)c1ccccc1 ZINC000288958850 131348386 /nfs/dbraw/zinc/34/83/86/131348386.db2.gz BMWCBRCFNAWNDO-HUUCEWRRSA-N 1 2 317.458 4.069 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(OC(F)F)cc1 ZINC000289358530 131378261 /nfs/dbraw/zinc/37/82/61/131378261.db2.gz MLVCCBXTWNJQDS-LLVKDONJSA-N 1 2 324.371 4.424 20 0 DIADLO Cc1ncc(-c2ccc(NCCCc3c[nH+]ccc3C)cc2)o1 ZINC000289366161 131378609 /nfs/dbraw/zinc/37/86/09/131378609.db2.gz ZFJOKAOCTNPLNU-UHFFFAOYSA-N 1 2 307.397 4.398 20 0 DIADLO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1cc(C(C)(C)C)on1 ZINC000289458699 131387927 /nfs/dbraw/zinc/38/79/27/131387927.db2.gz FXJCUCDENWVVAW-GFCCVEGCSA-N 1 2 318.465 4.083 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2cc(Cl)sc2Cl)s1 ZINC000289597704 131399748 /nfs/dbraw/zinc/39/97/48/131399748.db2.gz BKFQTYYTZGLMCJ-LURJTMIESA-N 1 2 322.286 4.320 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cc(O)cc(C(F)(F)F)c2)s1 ZINC000289594217 131399756 /nfs/dbraw/zinc/39/97/56/131399756.db2.gz ULINXWXLLOCSBH-SECBINFHSA-N 1 2 316.348 4.027 20 0 DIADLO C[C@@H]1C[C@@H](Nc2cccc(N3CCC(C)CC3)c2)c2[nH+]ccn21 ZINC000296431896 131962565 /nfs/dbraw/zinc/96/25/65/131962565.db2.gz MDXSHQKJCZAOES-CRAIPNDOSA-N 1 2 310.445 4.237 20 0 DIADLO CC(=O)c1ccc(C[N@@H+]2CCCC[C@@H]2c2nccs2)cc1 ZINC000297147047 132001460 /nfs/dbraw/zinc/00/14/60/132001460.db2.gz NYUVVGUTLXRVNA-MRXNPFEDSA-N 1 2 300.427 4.073 20 0 DIADLO CC(=O)c1ccc(C[N@H+]2CCCC[C@@H]2c2nccs2)cc1 ZINC000297147047 132001461 /nfs/dbraw/zinc/00/14/61/132001461.db2.gz NYUVVGUTLXRVNA-MRXNPFEDSA-N 1 2 300.427 4.073 20 0 DIADLO CC(=O)c1ccc(C[N@@H+]2CCCC[C@H]2c2nccs2)cc1 ZINC000297147044 132001802 /nfs/dbraw/zinc/00/18/02/132001802.db2.gz NYUVVGUTLXRVNA-INIZCTEOSA-N 1 2 300.427 4.073 20 0 DIADLO CC(=O)c1ccc(C[N@H+]2CCCC[C@H]2c2nccs2)cc1 ZINC000297147044 132001805 /nfs/dbraw/zinc/00/18/05/132001805.db2.gz NYUVVGUTLXRVNA-INIZCTEOSA-N 1 2 300.427 4.073 20 0 DIADLO Clc1cccc(Cl)c1[C@@H]([NH2+][C@H]1CCn2ccnc21)C1CC1 ZINC000297357406 132012076 /nfs/dbraw/zinc/01/20/76/132012076.db2.gz POYCNSLIHJJCEB-ZFWWWQNUSA-N 1 2 322.239 4.376 20 0 DIADLO CCC[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1ccc(F)cc1F ZINC000297557010 132022645 /nfs/dbraw/zinc/02/26/45/132022645.db2.gz FZKQFGOPZNOJIZ-KNXALSJPSA-N 1 2 305.372 4.298 20 0 DIADLO CCC[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1ccc(F)cc1F ZINC000297557014 132022721 /nfs/dbraw/zinc/02/27/21/132022721.db2.gz FZKQFGOPZNOJIZ-UVBJJODRSA-N 1 2 305.372 4.298 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1nccn1CC ZINC000297818031 132035342 /nfs/dbraw/zinc/03/53/42/132035342.db2.gz REZHARHEXBYJTQ-HZPDHXFCSA-N 1 2 315.461 4.240 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1nccn1CC ZINC000297818025 132035516 /nfs/dbraw/zinc/03/55/16/132035516.db2.gz REZHARHEXBYJTQ-CVEARBPZSA-N 1 2 315.461 4.240 20 0 DIADLO CCc1ccc(C[N@H+](Cc2nccn2C(F)F)C2CC2)cc1 ZINC000298486185 132065369 /nfs/dbraw/zinc/06/53/69/132065369.db2.gz KLXUZRGGDLMGEX-UHFFFAOYSA-N 1 2 305.372 4.005 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2nccn2C(F)F)C2CC2)cc1 ZINC000298486185 132065370 /nfs/dbraw/zinc/06/53/70/132065370.db2.gz KLXUZRGGDLMGEX-UHFFFAOYSA-N 1 2 305.372 4.005 20 0 DIADLO CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1nc(=O)c2sccc2[nH]1 ZINC000298616600 132069983 /nfs/dbraw/zinc/06/99/83/132069983.db2.gz MWADSRSWVPTEOA-VXGBXAGGSA-N 1 2 319.474 4.091 20 0 DIADLO C[N@H+](Cc1nccn1C(F)F)Cc1cc(Cl)cc(Cl)c1 ZINC000298691997 132073918 /nfs/dbraw/zinc/07/39/18/132073918.db2.gz BMYZRXRLOHBCCC-UHFFFAOYSA-N 1 2 320.170 4.217 20 0 DIADLO C[N@@H+](Cc1nccn1C(F)F)Cc1cc(Cl)cc(Cl)c1 ZINC000298691997 132073919 /nfs/dbraw/zinc/07/39/19/132073919.db2.gz BMYZRXRLOHBCCC-UHFFFAOYSA-N 1 2 320.170 4.217 20 0 DIADLO Fc1cccc(C[N@H+](Cc2nc(C3CC3)no2)C2CCCC2)c1 ZINC000299436497 132105705 /nfs/dbraw/zinc/10/57/05/132105705.db2.gz WALBDTCTOBBUKF-UHFFFAOYSA-N 1 2 315.392 4.031 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2nc(C3CC3)no2)C2CCCC2)c1 ZINC000299436497 132105706 /nfs/dbraw/zinc/10/57/06/132105706.db2.gz WALBDTCTOBBUKF-UHFFFAOYSA-N 1 2 315.392 4.031 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2csc(Br)c2)cs1 ZINC000163939359 132127745 /nfs/dbraw/zinc/12/77/45/132127745.db2.gz HFOIZSRQNQOMCL-SSDOTTSWSA-N 1 2 317.277 4.126 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)OC2CCCCCC2)c(C)[nH+]1 ZINC000119629473 132134590 /nfs/dbraw/zinc/13/45/90/132134590.db2.gz OPUPUWVAPLTDEI-HNNXBMFYSA-N 1 2 304.434 4.073 20 0 DIADLO Cc1cnc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)nc1 ZINC000340684546 132149953 /nfs/dbraw/zinc/14/99/53/132149953.db2.gz LOPQMVHBVHLCKA-NSHDSACASA-N 1 2 310.228 4.285 20 0 DIADLO Cc1cnc(C[N@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)nc1 ZINC000340684546 132149955 /nfs/dbraw/zinc/14/99/55/132149955.db2.gz LOPQMVHBVHLCKA-NSHDSACASA-N 1 2 310.228 4.285 20 0 DIADLO CC[N@H+](Cc1ncc(C)cn1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000340688392 132154318 /nfs/dbraw/zinc/15/43/18/132154318.db2.gz UWKGRBWTOZJHJN-ZDUSSCGKSA-N 1 2 323.362 4.387 20 0 DIADLO CC[N@@H+](Cc1ncc(C)cn1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000340688392 132154320 /nfs/dbraw/zinc/15/43/20/132154320.db2.gz UWKGRBWTOZJHJN-ZDUSSCGKSA-N 1 2 323.362 4.387 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccc(F)cc2F)C2CCCC2)nc1 ZINC000340693290 132157073 /nfs/dbraw/zinc/15/70/73/132157073.db2.gz FQIDZWIAOVLBRX-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccc(F)cc2F)C2CCCC2)nc1 ZINC000340693290 132157075 /nfs/dbraw/zinc/15/70/75/132157075.db2.gz FQIDZWIAOVLBRX-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO C[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000340749495 132177318 /nfs/dbraw/zinc/17/73/18/132177318.db2.gz IAAZDFKQBAXPIA-TZMCWYRMSA-N 1 2 315.804 4.067 20 0 DIADLO C[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000340749491 132177514 /nfs/dbraw/zinc/17/75/14/132177514.db2.gz IAAZDFKQBAXPIA-JSGCOSHPSA-N 1 2 315.804 4.067 20 0 DIADLO Cc1ccc2oc(N3CCC(c4ccc(C)[nH+]c4)CC3)nc2c1 ZINC000340771964 132185386 /nfs/dbraw/zinc/18/53/86/132185386.db2.gz GJHXRXZLLZNUTC-UHFFFAOYSA-N 1 2 307.397 4.224 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc(Oc3cccnc3)cc2)nc[nH+]1 ZINC000340775563 132186458 /nfs/dbraw/zinc/18/64/58/132186458.db2.gz IXPRNAXTWMBDRW-AWEZNQCLSA-N 1 2 306.369 4.145 20 0 DIADLO Cc1cc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)n(C)n1 ZINC000417706443 335065432 /nfs/dbraw/zinc/06/54/32/335065432.db2.gz UEXQKHNNUUVTOJ-ZDUSSCGKSA-N 1 2 303.837 4.108 20 0 DIADLO Cc1cc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)n(C)n1 ZINC000417706443 335065433 /nfs/dbraw/zinc/06/54/33/335065433.db2.gz UEXQKHNNUUVTOJ-ZDUSSCGKSA-N 1 2 303.837 4.108 20 0 DIADLO Fc1ccc(N(CCCn2cc[nH+]c2)Cc2cccs2)cc1 ZINC000343316952 335070315 /nfs/dbraw/zinc/07/03/15/335070315.db2.gz YQUHTAYZWNTQMB-UHFFFAOYSA-N 1 2 315.417 4.181 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ccc(F)cc2)n(C)n1 ZINC000417723607 335073422 /nfs/dbraw/zinc/07/34/22/335073422.db2.gz HLUKZNRIZNCZBN-UHFFFAOYSA-N 1 2 323.415 4.070 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2ccc(F)cc2)n(C)n1 ZINC000417723607 335073424 /nfs/dbraw/zinc/07/34/24/335073424.db2.gz HLUKZNRIZNCZBN-UHFFFAOYSA-N 1 2 323.415 4.070 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC[C@@H](C)COC)c1 ZINC000525875263 335089284 /nfs/dbraw/zinc/08/92/84/335089284.db2.gz VNZUMGZZLVNAIK-OAHLLOKOSA-N 1 2 301.434 4.045 20 0 DIADLO CC(C)c1nc(NCc2ncccc2F)cc(C(C)(C)C)[nH+]1 ZINC000530480347 435046853 /nfs/dbraw/zinc/04/68/53/435046853.db2.gz FGNVSYHSECPNJU-UHFFFAOYSA-N 1 2 302.397 4.044 20 0 DIADLO CCc1cc(NCc2c(C)cc(Br)cc2C)nc[nH+]1 ZINC000603385448 435334577 /nfs/dbraw/zinc/33/45/77/435334577.db2.gz HXLLVJJZMZKEDZ-UHFFFAOYSA-N 1 2 320.234 4.030 20 0 DIADLO CCc1cccc2c1OCC[C@@H]2Nc1[nH+]c2ccccc2n1C ZINC000535691944 435344170 /nfs/dbraw/zinc/34/41/70/435344170.db2.gz QUXJWOFXIUUYEH-HNNXBMFYSA-N 1 2 307.397 4.071 20 0 DIADLO Cc1csc([C@H](C)Nc2[nH+]c(C(C)C)nc3[nH]ccc32)n1 ZINC000631096410 435400664 /nfs/dbraw/zinc/40/06/64/435400664.db2.gz RKYRMHWTIBFWGT-JTQLQIEISA-N 1 2 301.419 4.019 20 0 DIADLO CC(C)n1ccc(CNc2cc[nH+]c3c(Cl)cccc23)n1 ZINC000570749772 332810431 /nfs/dbraw/zinc/81/04/31/332810431.db2.gz UZAOGMRYKQERFO-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO CC[C@H](Oc1ccccc1C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000175727051 332905117 /nfs/dbraw/zinc/90/51/17/332905117.db2.gz JVDNWMBSCWZEJN-INIZCTEOSA-N 1 2 312.413 4.111 20 0 DIADLO CC[C@@H](C)N(Cc1ccccc1)C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000583943567 331477762 /nfs/dbraw/zinc/47/77/62/331477762.db2.gz NKSYZNGZQQLGCY-OAHLLOKOSA-N 1 2 321.424 4.084 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccccc2Cl)nc2ccccc12 ZINC000024376337 331541736 /nfs/dbraw/zinc/54/17/36/331541736.db2.gz ZFPCGLURJBKGGZ-GFCCVEGCSA-N 1 2 311.816 4.442 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](Cc2ccccc2)c2ccccc2)n1 ZINC000533480440 331543628 /nfs/dbraw/zinc/54/36/28/331543628.db2.gz ZMJSDJRZOZAHFT-GOSISDBHSA-N 1 2 321.424 4.267 20 0 DIADLO Cc1ccsc1[C@@H]1C[C@@H]1c1nc(Cc2ccc[nH+]c2C)no1 ZINC000580055458 332918741 /nfs/dbraw/zinc/91/87/41/332918741.db2.gz TUJSJPPTZPTDIM-KGLIPLIRSA-N 1 2 311.410 4.005 20 0 DIADLO Cc1cccc(C([NH2+]Cc2nccc(C)n2)c2cccc(C)c2)c1 ZINC000533691683 331646586 /nfs/dbraw/zinc/64/65/86/331646586.db2.gz ICSQEKINJTVPAM-UHFFFAOYSA-N 1 2 317.436 4.281 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)ccc1OC(F)F)c1nccs1 ZINC000080266709 331683910 /nfs/dbraw/zinc/68/39/10/331683910.db2.gz FCCMSEYRXHHJKW-QMMMGPOBSA-N 1 2 318.776 4.249 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[NH+]1CCC(CC(F)(F)F)CC1 ZINC000556505750 331709420 /nfs/dbraw/zinc/70/94/20/331709420.db2.gz MQPBIQYNCWDZKZ-JTQLQIEISA-N 1 2 319.371 4.093 20 0 DIADLO C[C@H]1C[C@@H](NC(=O)Nc2ccccc2C(C)(C)C)c2[nH+]ccn21 ZINC000556524836 331714456 /nfs/dbraw/zinc/71/44/56/331714456.db2.gz YZLLQRBUECMMKA-SWLSCSKDSA-N 1 2 312.417 4.008 20 0 DIADLO Cc1nc([C@H]([NH2+]CC(C(C)C)C(C)C)c2ccccc2F)no1 ZINC000556594795 331718116 /nfs/dbraw/zinc/71/81/16/331718116.db2.gz JQFIRLBJFALIKE-QGZVFWFLSA-N 1 2 319.424 4.124 20 0 DIADLO Cc1nc([C@@H]([NH2+]CC(C(C)C)C(C)C)c2ccccc2F)no1 ZINC000556594794 331718189 /nfs/dbraw/zinc/71/81/89/331718189.db2.gz JQFIRLBJFALIKE-KRWDZBQOSA-N 1 2 319.424 4.124 20 0 DIADLO Cc1nccnc1[C@@H](C)[NH2+]Cc1cc(Cl)sc1Cl ZINC000312751110 331727317 /nfs/dbraw/zinc/72/73/17/331727317.db2.gz WBFHONWKPFOWHJ-MRVPVSSYSA-N 1 2 302.230 4.004 20 0 DIADLO Clc1cc(C[NH2+][C@H]2COCc3ccccc32)c(Cl)s1 ZINC000312764140 331731309 /nfs/dbraw/zinc/73/13/09/331731309.db2.gz XEVSRDWNDAQAGB-LBPRGKRZSA-N 1 2 314.237 4.416 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)cc1O ZINC000564429196 331761440 /nfs/dbraw/zinc/76/14/40/331761440.db2.gz NPQVIIBCJKCYFK-JLTOFOAXSA-N 1 2 323.392 4.434 20 0 DIADLO Cc1cc(NCc2c[nH+]cn2C(C)C)cc(C)c1Br ZINC000232024767 331823437 /nfs/dbraw/zinc/82/34/37/331823437.db2.gz SWSOQPZBWSVLRZ-UHFFFAOYSA-N 1 2 322.250 4.455 20 0 DIADLO C/C=C/c1ccc(NC(=O)Cn2c3ccccc3[nH+]c2CC)cc1 ZINC000557937448 331827328 /nfs/dbraw/zinc/82/73/28/331827328.db2.gz LCOBMCBUKFTJOX-XVNBXDOJSA-N 1 2 319.408 4.271 20 0 DIADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1nc(-c2ccccc2)cs1 ZINC000584136181 331838730 /nfs/dbraw/zinc/83/87/30/331838730.db2.gz OPMHFDDILBEGQZ-BFUOFWGJSA-N 1 2 322.433 4.422 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](Cc2ccccc2)c2cccs2)no1 ZINC000558460210 331909175 /nfs/dbraw/zinc/90/91/75/331909175.db2.gz POLXXOKDDFCOBU-WFASDCNBSA-N 1 2 313.426 4.074 20 0 DIADLO C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000558505604 331914131 /nfs/dbraw/zinc/91/41/31/331914131.db2.gz LCJOMIHEYGGWJO-KGLIPLIRSA-N 1 2 314.433 4.013 20 0 DIADLO COC[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccco1 ZINC000449180335 331932954 /nfs/dbraw/zinc/93/29/54/331932954.db2.gz ZUXIFDYVWSZVMW-SECBINFHSA-N 1 2 306.214 4.125 20 0 DIADLO CC(C)c1cc(N2CCC[C@@H]2[C@H]2CCCOC2)nc(C(C)C)[nH+]1 ZINC000564903164 331946724 /nfs/dbraw/zinc/94/67/24/331946724.db2.gz INSPUGMJSIHMEX-DOTOQJQBSA-N 1 2 317.477 4.119 20 0 DIADLO Cc1cccc(-c2noc(C[N@@H+]([C@H](C)c3ccco3)C3CC3)n2)c1 ZINC000086234033 332019395 /nfs/dbraw/zinc/01/93/95/332019395.db2.gz OGWUZDDCUUPUBE-CQSZACIVSA-N 1 2 323.396 4.364 20 0 DIADLO Cc1cccc(-c2noc(C[N@H+]([C@H](C)c3ccco3)C3CC3)n2)c1 ZINC000086234033 332019396 /nfs/dbraw/zinc/01/93/96/332019396.db2.gz OGWUZDDCUUPUBE-CQSZACIVSA-N 1 2 323.396 4.364 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000559303599 332021342 /nfs/dbraw/zinc/02/13/42/332021342.db2.gz AGKVZJOBFZWXER-IBGZPJMESA-N 1 2 320.440 4.034 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000559303599 332021343 /nfs/dbraw/zinc/02/13/43/332021343.db2.gz AGKVZJOBFZWXER-IBGZPJMESA-N 1 2 320.440 4.034 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000559303603 332021484 /nfs/dbraw/zinc/02/14/84/332021484.db2.gz AGKVZJOBFZWXER-LJQANCHMSA-N 1 2 320.440 4.034 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000559303603 332021486 /nfs/dbraw/zinc/02/14/86/332021486.db2.gz AGKVZJOBFZWXER-LJQANCHMSA-N 1 2 320.440 4.034 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2ccccc2OC(F)F)s1 ZINC000130501157 332024308 /nfs/dbraw/zinc/02/43/08/332024308.db2.gz OIDVKJBHQQKXNX-JTQLQIEISA-N 1 2 312.385 4.158 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)o1 ZINC000409446927 332030805 /nfs/dbraw/zinc/03/08/05/332030805.db2.gz IFMWAGLVSWXRQV-JTQLQIEISA-N 1 2 304.356 4.135 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)o1 ZINC000409446927 332030806 /nfs/dbraw/zinc/03/08/06/332030806.db2.gz IFMWAGLVSWXRQV-JTQLQIEISA-N 1 2 304.356 4.135 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ncc(C(C)(C)C)o2)cc1 ZINC000409447575 332033150 /nfs/dbraw/zinc/03/31/50/332033150.db2.gz RFDZKBYIHJNPSP-MRXNPFEDSA-N 1 2 314.429 4.318 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ncc(C(C)(C)C)o2)cc1 ZINC000409447575 332033151 /nfs/dbraw/zinc/03/31/51/332033151.db2.gz RFDZKBYIHJNPSP-MRXNPFEDSA-N 1 2 314.429 4.318 20 0 DIADLO Cc1cc(N2CC[C@](F)(c3ccccc3C)C2)nc(C2CC2)[nH+]1 ZINC000409670209 332046302 /nfs/dbraw/zinc/04/63/02/332046302.db2.gz RANVDPROBCXSNT-LJQANCHMSA-N 1 2 311.404 4.046 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)CCc3ccco3)cc2[nH+]1 ZINC000409717867 332049707 /nfs/dbraw/zinc/04/97/07/332049707.db2.gz CQOQVNPGQIGQEU-UHFFFAOYSA-N 1 2 311.385 4.070 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc3ccccc3c2)[C@H](c2ccccc2)CO1 ZINC000410394730 332121960 /nfs/dbraw/zinc/12/19/60/332121960.db2.gz DSZAELPKCXSVEH-KKSFZXQISA-N 1 2 318.420 4.197 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnc3ccccc3c2)[C@H](c2ccccc2)CO1 ZINC000410394730 332121962 /nfs/dbraw/zinc/12/19/62/332121962.db2.gz DSZAELPKCXSVEH-KKSFZXQISA-N 1 2 318.420 4.197 20 0 DIADLO C[N@H+](Cc1ccoc1)Cc1ccc(Br)cc1Cl ZINC000133679894 332141251 /nfs/dbraw/zinc/14/12/51/332141251.db2.gz PNKRGEONADLKGA-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO C[N@@H+](Cc1ccoc1)Cc1ccc(Br)cc1Cl ZINC000133679894 332141252 /nfs/dbraw/zinc/14/12/52/332141252.db2.gz PNKRGEONADLKGA-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO Cc1ccc(Cc2noc(-c3ccccc3C(F)(F)F)n2)c[nH+]1 ZINC000445212466 332147490 /nfs/dbraw/zinc/14/74/90/332147490.db2.gz NGXZBRAOKJGESM-UHFFFAOYSA-N 1 2 319.286 4.050 20 0 DIADLO Cc1cc(N[C@H](COc2ccccc2)c2ccccc2)nc[nH+]1 ZINC000426899372 332160704 /nfs/dbraw/zinc/16/07/04/332160704.db2.gz SJVOPMBXPCUPFY-GOSISDBHSA-N 1 2 305.381 4.017 20 0 DIADLO CSc1ccc(CNc2ccc(N3CCCC3)[nH+]c2)s1 ZINC000584263958 332176080 /nfs/dbraw/zinc/17/60/80/332176080.db2.gz ZBVVLHQVZAZJKE-UHFFFAOYSA-N 1 2 305.472 4.077 20 0 DIADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2oc(C(C)C)nc2C)cs1 ZINC000428432174 332198330 /nfs/dbraw/zinc/19/83/30/332198330.db2.gz XRMXQKYIDXBDGY-AWEZNQCLSA-N 1 2 305.447 4.208 20 0 DIADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2oc(C(C)C)nc2C)cs1 ZINC000428432174 332198331 /nfs/dbraw/zinc/19/83/31/332198331.db2.gz XRMXQKYIDXBDGY-AWEZNQCLSA-N 1 2 305.447 4.208 20 0 DIADLO Fc1ccc(Br)cc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000065535059 332207249 /nfs/dbraw/zinc/20/72/49/332207249.db2.gz YFVSHDOKTICVHM-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1ccc(Br)cc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000065535059 332207251 /nfs/dbraw/zinc/20/72/51/332207251.db2.gz YFVSHDOKTICVHM-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccccc1C(F)(F)F ZINC000367518894 332233880 /nfs/dbraw/zinc/23/38/80/332233880.db2.gz KUCANGCIKXDNEW-QMTHXVAHSA-N 1 2 309.335 4.157 20 0 DIADLO CCC(CC)[C@@H](C)C(=O)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000536395896 332238130 /nfs/dbraw/zinc/23/81/30/332238130.db2.gz SCEIMILEHANGLP-CYBMUJFWSA-N 1 2 317.408 4.154 20 0 DIADLO CCC(CC)[C@@H](C)C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000536425320 332242553 /nfs/dbraw/zinc/24/25/53/332242553.db2.gz ZPAOCBXHKUEVES-CYBMUJFWSA-N 1 2 323.506 4.140 20 0 DIADLO FC(F)Oc1ccccc1C[N@@H+]1CCC[C@H]1c1nccs1 ZINC000370792553 332252533 /nfs/dbraw/zinc/25/25/33/332252533.db2.gz LVXNOPARAOHJSW-LBPRGKRZSA-N 1 2 310.369 4.082 20 0 DIADLO FC(F)Oc1ccccc1C[N@H+]1CCC[C@H]1c1nccs1 ZINC000370792553 332252536 /nfs/dbraw/zinc/25/25/36/332252536.db2.gz LVXNOPARAOHJSW-LBPRGKRZSA-N 1 2 310.369 4.082 20 0 DIADLO Cc1nsc(C)c1C[NH+](Cc1ccco1)Cc1ccco1 ZINC000559640206 332275257 /nfs/dbraw/zinc/27/52/57/332275257.db2.gz PLQRLHOINHCILR-UHFFFAOYSA-N 1 2 302.399 4.148 20 0 DIADLO C[C@@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1cccc(C2CC2)c1 ZINC000559785496 332281981 /nfs/dbraw/zinc/28/19/81/332281981.db2.gz CNMFIEJWPWBNDK-KZULUSFZSA-N 1 2 317.379 4.226 20 0 DIADLO CCCCc1nc(C[N@H+](C)[C@@H](C)c2cccc(O)c2)cs1 ZINC000109783098 332283934 /nfs/dbraw/zinc/28/39/34/332283934.db2.gz ADBJOASZZKORKK-ZDUSSCGKSA-N 1 2 304.459 4.384 20 0 DIADLO CCCCc1nc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)cs1 ZINC000109783098 332283936 /nfs/dbraw/zinc/28/39/36/332283936.db2.gz ADBJOASZZKORKK-ZDUSSCGKSA-N 1 2 304.459 4.384 20 0 DIADLO CCOc1ccc([C@@H](CC)[NH2+]CC(C)(F)F)cc1OCC ZINC000559885193 332289015 /nfs/dbraw/zinc/28/90/15/332289015.db2.gz HIWJLDAZSPDTCL-CYBMUJFWSA-N 1 2 301.377 4.180 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000559934414 332294984 /nfs/dbraw/zinc/29/49/84/332294984.db2.gz ZVBMLBRZRPXAJL-KZULUSFZSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000559934414 332294985 /nfs/dbraw/zinc/29/49/85/332294985.db2.gz ZVBMLBRZRPXAJL-KZULUSFZSA-N 1 2 321.342 4.238 20 0 DIADLO CC(C)(Cc1[nH]c2ccccc2[nH+]1)c1nc(CC2CCCC2)no1 ZINC000560033134 332303661 /nfs/dbraw/zinc/30/36/61/332303661.db2.gz BTLXOZUBXQBXBZ-UHFFFAOYSA-N 1 2 324.428 4.199 20 0 DIADLO CCn1c(C)cc(C(=O)C[N@H+](C)Cc2ccc(Cl)s2)c1C ZINC000048776577 332304869 /nfs/dbraw/zinc/30/48/69/332304869.db2.gz FMIUMVIQMPHRLW-UHFFFAOYSA-N 1 2 324.877 4.154 20 0 DIADLO CCn1c(C)cc(C(=O)C[N@@H+](C)Cc2ccc(Cl)s2)c1C ZINC000048776577 332304870 /nfs/dbraw/zinc/30/48/70/332304870.db2.gz FMIUMVIQMPHRLW-UHFFFAOYSA-N 1 2 324.877 4.154 20 0 DIADLO Cc1ccc2cc([C@@H](C)[NH2+][C@H](C)c3nnc(C(C)C)[nH]3)oc2c1 ZINC000426076429 335100902 /nfs/dbraw/zinc/10/09/02/335100902.db2.gz LBRHVGQPDRLAKZ-CHWSQXEVSA-N 1 2 312.417 4.395 20 0 DIADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000560260964 332324985 /nfs/dbraw/zinc/32/49/85/332324985.db2.gz FNSBSDKFLIQEIL-NEPJUHHUSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000560260964 332324987 /nfs/dbraw/zinc/32/49/87/332324987.db2.gz FNSBSDKFLIQEIL-NEPJUHHUSA-N 1 2 322.861 4.073 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)n1 ZINC000114747052 332328999 /nfs/dbraw/zinc/32/89/99/332328999.db2.gz XMTCVRHSNMNXMO-ZJUUUORDSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1cc(C)c(NC(=O)CCSc2ccccc2F)c(C)[nH+]1 ZINC000097213962 332334251 /nfs/dbraw/zinc/33/42/51/332334251.db2.gz VRHHQDRFZOTQJR-UHFFFAOYSA-N 1 2 318.417 4.267 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc([C@H]2CC=CCC2)n1 ZINC000583361163 332353310 /nfs/dbraw/zinc/35/33/10/332353310.db2.gz GSBXTCFBOQKFCB-AWEZNQCLSA-N 1 2 322.412 4.415 20 0 DIADLO Cc1c(COc2ccccc2)cccc1N[C@H](C)c1[nH]cc[nH+]1 ZINC000560553870 332359225 /nfs/dbraw/zinc/35/92/25/332359225.db2.gz MWOCDPWUJLOWNR-OAHLLOKOSA-N 1 2 307.397 4.470 20 0 DIADLO Clc1oc2ccccc2c1C[N@@H+]1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000560630349 332370898 /nfs/dbraw/zinc/37/08/98/332370898.db2.gz YQIWMHNRGVDEIC-WMZOPIPTSA-N 1 2 317.816 4.230 20 0 DIADLO Clc1oc2ccccc2c1C[N@H+]1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000560630349 332370900 /nfs/dbraw/zinc/37/09/00/332370900.db2.gz YQIWMHNRGVDEIC-WMZOPIPTSA-N 1 2 317.816 4.230 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccc(N(C)CC(C)C)cc1 ZINC000425585932 335107144 /nfs/dbraw/zinc/10/71/44/335107144.db2.gz JLFVGLSRMHZOAV-UHFFFAOYSA-N 1 2 311.429 4.043 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@H](C)c1ccc(-c2ccc(F)cc2)s1 ZINC000560900464 332392926 /nfs/dbraw/zinc/39/29/26/332392926.db2.gz HJYKFKHSNZMODW-GFCCVEGCSA-N 1 2 315.417 4.437 20 0 DIADLO Clc1c2ccc(NCc3cccnn3)cc2[nH+]c2c1CCCC2 ZINC000583414119 332393705 /nfs/dbraw/zinc/39/37/05/332393705.db2.gz NISRULFKFFIKDD-UHFFFAOYSA-N 1 2 324.815 4.169 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)c(Cl)c1 ZINC000583417625 332396277 /nfs/dbraw/zinc/39/62/77/332396277.db2.gz ZRVNENQJBITGFS-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000425590797 335108569 /nfs/dbraw/zinc/10/85/69/335108569.db2.gz XVOUHPYYRMFODP-RYUDHWBXSA-N 1 2 300.324 4.006 20 0 DIADLO C[C@@H]1CC[C@H](C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)C1 ZINC000425571298 335104541 /nfs/dbraw/zinc/10/45/41/335104541.db2.gz MYUIGGYHNQQGNC-CABCVRRESA-N 1 2 323.440 4.261 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2)C1CCC1 ZINC000425571636 335104550 /nfs/dbraw/zinc/10/45/50/335104550.db2.gz NEPCZQQHQXCXJL-CQSZACIVSA-N 1 2 323.440 4.261 20 0 DIADLO C[C@H](O)C[C@@H](CNc1cc(C(F)(F)F)cc[nH+]1)c1ccccc1 ZINC000561259036 332431131 /nfs/dbraw/zinc/43/11/31/332431131.db2.gz INWKJOPMMRBOQI-JSGCOSHPSA-N 1 2 324.346 4.067 20 0 DIADLO Cc1[nH+]cccc1Cc1noc(CC[C@H](C)c2ccccc2)n1 ZINC000561295959 332434432 /nfs/dbraw/zinc/43/44/32/332434432.db2.gz ZNKTZJVAAMTUPP-AWEZNQCLSA-N 1 2 307.397 4.100 20 0 DIADLO Cc1ccc(COc2cccc3c2C(=O)CC(C)(C)O3)c(C)[nH+]1 ZINC000427516599 332441723 /nfs/dbraw/zinc/44/17/23/332441723.db2.gz ZMYSFECSYTVHSD-UHFFFAOYSA-N 1 2 311.381 4.021 20 0 DIADLO Cc1ccc(OCCCC(=O)Nc2c(C)cc[nH+]c2C)c(C)c1 ZINC000425584579 335106859 /nfs/dbraw/zinc/10/68/59/335106859.db2.gz DPTJZDJSLKHNDH-UHFFFAOYSA-N 1 2 312.413 4.113 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccc(C)cc2OC(C)(C)C)cs1 ZINC000150968159 332463634 /nfs/dbraw/zinc/46/36/34/332463634.db2.gz DKZDRGZVABHIJU-UHFFFAOYSA-N 1 2 318.486 4.481 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1ccccc1C)c1ccco1 ZINC000151115488 332522345 /nfs/dbraw/zinc/52/23/45/332522345.db2.gz CBJQZLKESMZRKK-FQEVSTJZSA-N 1 2 307.393 4.476 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)c1nc2c(s1)CCC2 ZINC000427853004 332541967 /nfs/dbraw/zinc/54/19/67/332541967.db2.gz GQJKYIXSXKZGBD-SECBINFHSA-N 1 2 310.825 4.275 20 0 DIADLO Cc1oc2ccccc2c1CCNC(=O)Nc1c(C)cc[nH+]c1C ZINC000562288104 332568778 /nfs/dbraw/zinc/56/87/78/332568778.db2.gz VTDRGTCYSFSCJY-UHFFFAOYSA-N 1 2 323.396 4.117 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@@H](c2ccccc2)C(C)C)n1 ZINC000136294934 332629343 /nfs/dbraw/zinc/62/93/43/332629343.db2.gz XLAUJLQAFVRMQM-CZUORRHYSA-N 1 2 319.474 4.371 20 0 DIADLO CCN(Cc1ccc(C)cc1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000562892412 332636904 /nfs/dbraw/zinc/63/69/04/332636904.db2.gz RQIRRCUDADXERL-UHFFFAOYSA-N 1 2 311.429 4.369 20 0 DIADLO Cc1ccc(NC(=O)N[C@H](C)c2ccc(C)c(F)c2)c(C)[nH+]1 ZINC000176712055 332953349 /nfs/dbraw/zinc/95/33/49/332953349.db2.gz UOFOTMKMPSDGEO-GFCCVEGCSA-N 1 2 301.365 4.029 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(C)cc1Cl ZINC000178725028 333018819 /nfs/dbraw/zinc/01/88/19/333018819.db2.gz YKDCCDXOYKQRDT-LBPRGKRZSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1occc1C[N@H+](C)[C@@H](C)C(=O)Nc1ccc(C)cc1Cl ZINC000178725028 333018820 /nfs/dbraw/zinc/01/88/20/333018820.db2.gz YKDCCDXOYKQRDT-LBPRGKRZSA-N 1 2 320.820 4.009 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc2cc(C)ccc2s1)c1nccs1 ZINC000528420266 333022480 /nfs/dbraw/zinc/02/24/80/333022480.db2.gz YOQDRJJJQFMYQA-MRXNPFEDSA-N 1 2 317.483 4.476 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1nc2ccccc2s1 ZINC000179890032 333025791 /nfs/dbraw/zinc/02/57/91/333025791.db2.gz QUTILJIQOADSCG-LLVKDONJSA-N 1 2 316.401 4.295 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1nc2ccccc2s1 ZINC000179890015 333026244 /nfs/dbraw/zinc/02/62/44/333026244.db2.gz QUTILJIQOADSCG-NSHDSACASA-N 1 2 316.401 4.295 20 0 DIADLO CC(C)(C)[C@@H]1C[N@H+](Cc2ncc(-c3ccccc3)s2)CCO1 ZINC000580275556 333050644 /nfs/dbraw/zinc/05/06/44/333050644.db2.gz ADMNQIVZVBDEJI-INIZCTEOSA-N 1 2 316.470 4.057 20 0 DIADLO CC(C)(C)[C@@H]1C[N@@H+](Cc2ncc(-c3ccccc3)s2)CCO1 ZINC000580275556 333050646 /nfs/dbraw/zinc/05/06/46/333050646.db2.gz ADMNQIVZVBDEJI-INIZCTEOSA-N 1 2 316.470 4.057 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cccc(F)c1F ZINC000183148071 333052661 /nfs/dbraw/zinc/05/26/61/333052661.db2.gz NMPKLTSBEHXODC-GFCCVEGCSA-N 1 2 303.356 4.133 20 0 DIADLO CC1(C)CCCN1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000171975721 333056567 /nfs/dbraw/zinc/05/65/67/333056567.db2.gz UQRRUYBRBAMJKD-UHFFFAOYSA-N 1 2 311.385 4.280 20 0 DIADLO Cc1cc[nH+]c(NC[C@H]2CCN(c3ccc(F)cc3)C2)c1Cl ZINC000460428886 333085064 /nfs/dbraw/zinc/08/50/64/333085064.db2.gz SUBMCVKOLGUQBL-CYBMUJFWSA-N 1 2 319.811 4.121 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(C[C@@H]2CC[C@H](C)C2)n1 ZINC000460745348 333132624 /nfs/dbraw/zinc/13/26/24/333132624.db2.gz HNXNDICPQPILRD-UONOGXRCSA-N 1 2 324.428 4.009 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCS[C@H]1CCO[C@@H]1C ZINC000460868087 333178912 /nfs/dbraw/zinc/17/89/12/333178912.db2.gz AMWAYKKFKKAJTA-KDOFPFPSSA-N 1 2 318.486 4.426 20 0 DIADLO C[C@H](Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1)c1ccncc1 ZINC000182924519 333181354 /nfs/dbraw/zinc/18/13/54/333181354.db2.gz JSFLGHLNNVBQIQ-HNNXBMFYSA-N 1 2 318.424 4.455 20 0 DIADLO COC(=O)c1occc1C[NH2+][C@H](c1ccccc1Cl)C(C)C ZINC000183701775 333186927 /nfs/dbraw/zinc/18/69/27/333186927.db2.gz NJJWTFGKJWWDRR-HNNXBMFYSA-N 1 2 321.804 4.207 20 0 DIADLO Cc1ncncc1[C@H](C)[NH2+]Cc1cc(Cl)sc1Cl ZINC000580327655 333192886 /nfs/dbraw/zinc/19/28/86/333192886.db2.gz BIZBQJWPTNLTIP-ZETCQYMHSA-N 1 2 302.230 4.004 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2csc(C3CCCC3)n2)s1 ZINC000184992405 333203370 /nfs/dbraw/zinc/20/33/70/333203370.db2.gz PLLZVZABNBTMOI-NSHDSACASA-N 1 2 307.488 4.416 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)s1 ZINC000273111055 333218024 /nfs/dbraw/zinc/21/80/24/333218024.db2.gz GGXNRNGZQKNZOP-QMMMGPOBSA-N 1 2 316.257 4.258 20 0 DIADLO Cc1cc(C)c(NC(=O)C[N@@H+]2CCCC(C)(C)C2)c(Cl)c1 ZINC000497390084 333244542 /nfs/dbraw/zinc/24/45/42/333244542.db2.gz OGZKIWGNIPUWQR-UHFFFAOYSA-N 1 2 308.853 4.017 20 0 DIADLO Cc1cc(C)c(NC(=O)C[N@H+]2CCCC(C)(C)C2)c(Cl)c1 ZINC000497390084 333244543 /nfs/dbraw/zinc/24/45/43/333244543.db2.gz OGZKIWGNIPUWQR-UHFFFAOYSA-N 1 2 308.853 4.017 20 0 DIADLO C[C@@H](CC(=O)N1CCC[C@@H]1c1[nH]c2c([nH+]1)CCCC2)C(C)(C)C ZINC000497670674 333276520 /nfs/dbraw/zinc/27/65/20/333276520.db2.gz HNRICHZJPFVNKD-XJKSGUPXSA-N 1 2 317.477 4.024 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3ccncc3CC)cc2[nH+]1 ZINC000497732902 333284518 /nfs/dbraw/zinc/28/45/18/333284518.db2.gz SZNMTIDEMCJVGI-UHFFFAOYSA-N 1 2 322.412 4.115 20 0 DIADLO COc1cncc(/C=C/CC[NH2+][C@@H](c2ccccc2)C(F)F)c1 ZINC000582119475 333294672 /nfs/dbraw/zinc/29/46/72/333294672.db2.gz WDUGTKABFTXZDZ-UABRLCRWSA-N 1 2 318.367 4.090 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccc(F)cn1 ZINC000497827598 333297184 /nfs/dbraw/zinc/29/71/84/333297184.db2.gz GXUBEJRCMAJTRQ-MRXNPFEDSA-N 1 2 321.465 4.462 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2nc(C(F)(F)F)cs2)c1 ZINC000531343631 333345035 /nfs/dbraw/zinc/34/50/35/333345035.db2.gz MXXNYAJFLSKXBP-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2nc(C(F)(F)F)cs2)c1 ZINC000531343631 333345037 /nfs/dbraw/zinc/34/50/37/333345037.db2.gz MXXNYAJFLSKXBP-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO C[N@H+](Cc1nc2c(s1)CCCC2)Cc1cccc(Cl)c1 ZINC000531342010 333345077 /nfs/dbraw/zinc/34/50/77/333345077.db2.gz HJICKYQCTILWMM-UHFFFAOYSA-N 1 2 306.862 4.307 20 0 DIADLO C[N@@H+](Cc1nc2c(s1)CCCC2)Cc1cccc(Cl)c1 ZINC000531342010 333345079 /nfs/dbraw/zinc/34/50/79/333345079.db2.gz HJICKYQCTILWMM-UHFFFAOYSA-N 1 2 306.862 4.307 20 0 DIADLO Cc1cc[nH+]cc1CCCNc1ccc(C)c(OCC(F)F)c1 ZINC000583467695 333360035 /nfs/dbraw/zinc/36/00/35/333360035.db2.gz MZEZNJSGPOXNCL-UHFFFAOYSA-N 1 2 320.383 4.387 20 0 DIADLO COc1cc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)ccc1F ZINC000186745778 333377807 /nfs/dbraw/zinc/37/78/07/333377807.db2.gz MGPUIQCTYXXASV-ZDUSSCGKSA-N 1 2 311.360 4.193 20 0 DIADLO Cc1cc(-c2nnc(C[N@H+]3C[C@H](C)[C@@H]3c3ccccc3)o2)c(C)o1 ZINC000162085060 333378833 /nfs/dbraw/zinc/37/88/33/333378833.db2.gz CRKOWEQIWMCALE-KPZWWZAWSA-N 1 2 323.396 4.139 20 0 DIADLO Cc1cc(-c2nnc(C[N@@H+]3C[C@H](C)[C@@H]3c3ccccc3)o2)c(C)o1 ZINC000162085060 333378834 /nfs/dbraw/zinc/37/88/34/333378834.db2.gz CRKOWEQIWMCALE-KPZWWZAWSA-N 1 2 323.396 4.139 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000365343633 333404278 /nfs/dbraw/zinc/40/42/78/333404278.db2.gz LMPTWIMTDWMGMR-IRXDYDNUSA-N 1 2 305.466 4.043 20 0 DIADLO c1cc(C[NH2+][C@H](CCCc2ccccc2)c2ccccc2)[nH]n1 ZINC000066990318 335144790 /nfs/dbraw/zinc/14/47/90/335144790.db2.gz FBZKPYDKFZFXFQ-HXUWFJFHSA-N 1 2 305.425 4.264 20 0 DIADLO c1cn(-c2ccccc2OCc2ncc(-c3ccccc3)o2)c[nH+]1 ZINC000531792589 333559921 /nfs/dbraw/zinc/55/99/21/333559921.db2.gz FGPCQXHLULFQKW-UHFFFAOYSA-N 1 2 317.348 4.106 20 0 DIADLO Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(C)[nH+]c2C)c1 ZINC000152183064 333640324 /nfs/dbraw/zinc/64/03/24/333640324.db2.gz UYXQBOQURMPNDC-SFHVURJKSA-N 1 2 309.413 4.376 20 0 DIADLO Cc1ccc(NC(=O)N[C@H](C)c2ccc(Cl)s2)c(C)[nH+]1 ZINC000152189876 333641874 /nfs/dbraw/zinc/64/18/74/333641874.db2.gz MIKRGXCIROMYOA-SNVBAGLBSA-N 1 2 309.822 4.296 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@H](C)c2ccncc2F)c2ccccn2)c1 ZINC000563670187 333653506 /nfs/dbraw/zinc/65/35/06/333653506.db2.gz LFRXMERHXHRIIG-QRWLVFNGSA-N 1 2 321.399 4.364 20 0 DIADLO Fc1cc2[nH+]ccc(NCCCCn3ccnc3)c2cc1Cl ZINC000571255581 333690477 /nfs/dbraw/zinc/69/04/77/333690477.db2.gz JQDRBTANCUXIIM-UHFFFAOYSA-N 1 2 318.783 4.116 20 0 DIADLO C[C@H](CC(F)F)C(=O)Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000412217190 333739773 /nfs/dbraw/zinc/73/97/73/333739773.db2.gz KYNTZDVEYXZZPB-SNVBAGLBSA-N 1 2 323.387 4.101 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)o1 ZINC000343380600 335160462 /nfs/dbraw/zinc/16/04/62/335160462.db2.gz KYFHIRXFECQPNA-KFYUAXIPSA-N 1 2 319.836 4.333 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)o1 ZINC000343380598 335160570 /nfs/dbraw/zinc/16/05/70/335160570.db2.gz KYFHIRXFECQPNA-FNNPODNZSA-N 1 2 319.836 4.333 20 0 DIADLO Cc1csc(C[NH2+][C@H](C)c2csc(-c3ccccc3)n2)n1 ZINC000414062542 333889326 /nfs/dbraw/zinc/88/93/26/333889326.db2.gz LNYKAJGHWQZZNS-GFCCVEGCSA-N 1 2 315.467 4.426 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc2n(n1)CCC2)c1c(F)cccc1Cl ZINC000414097349 333895797 /nfs/dbraw/zinc/89/57/97/333895797.db2.gz RPZKOUOQGZKOAZ-WDEREUQCSA-N 1 2 307.800 4.034 20 0 DIADLO C[C@H]([NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1)c1ccn(C)n1 ZINC000414098785 333896113 /nfs/dbraw/zinc/89/61/13/333896113.db2.gz PFSRKGVJPAJWTO-JTQLQIEISA-N 1 2 310.228 4.067 20 0 DIADLO CCn1ccc(C[NH2+][C@H](C)c2cc(Cl)sc2Cl)n1 ZINC000414203138 333913603 /nfs/dbraw/zinc/91/36/03/333913603.db2.gz DOXWTZWKPIJMLY-MRVPVSSYSA-N 1 2 304.246 4.122 20 0 DIADLO CCn1ccc(C[NH2+][C@H](c2ccccc2)c2ccc(C)cc2C)n1 ZINC000414214362 333922790 /nfs/dbraw/zinc/92/27/90/333922790.db2.gz VYXPWWUWEMCKTQ-OAQYLSRUSA-N 1 2 319.452 4.399 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nccc(C(F)(F)F)n2)c(C)s1 ZINC000414271229 333931359 /nfs/dbraw/zinc/93/13/59/333931359.db2.gz ZKLAVKGCYNGSEO-VIFPVBQESA-N 1 2 315.364 4.025 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(OC(C)(C)C)cc1)c1csnn1 ZINC000414292241 333934569 /nfs/dbraw/zinc/93/45/69/333934569.db2.gz BVWJDUCAWNVRJS-VXGBXAGGSA-N 1 2 305.447 4.127 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2cc(Cl)cc(Cl)c21)c1csnn1 ZINC000414293505 333934930 /nfs/dbraw/zinc/93/49/30/333934930.db2.gz CVSQEPHIPZBOLM-HQJQHLMTSA-N 1 2 314.241 4.183 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c21)c1csnn1 ZINC000414293507 333935007 /nfs/dbraw/zinc/93/50/07/333935007.db2.gz CVSQEPHIPZBOLM-RDDDGLTNSA-N 1 2 314.241 4.183 20 0 DIADLO Clc1ccc(C[NH2+]Cc2nnc(C3CC3)s2)c(Cl)c1 ZINC000414558168 334017408 /nfs/dbraw/zinc/01/74/08/334017408.db2.gz RRIOYHXFIBLKNM-UHFFFAOYSA-N 1 2 314.241 4.012 20 0 DIADLO CCOc1ccc(C2=CC[N@H+](Cc3ncc(C4CC4)o3)CC2)cc1 ZINC000271092164 334018388 /nfs/dbraw/zinc/01/83/88/334018388.db2.gz IIVVDTMMSHXRIE-UHFFFAOYSA-N 1 2 324.424 4.240 20 0 DIADLO CCOc1ccc(C2=CC[N@@H+](Cc3ncc(C4CC4)o3)CC2)cc1 ZINC000271092164 334018390 /nfs/dbraw/zinc/01/83/90/334018390.db2.gz IIVVDTMMSHXRIE-UHFFFAOYSA-N 1 2 324.424 4.240 20 0 DIADLO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@@H](C)c1cccnc1Cl ZINC000271418601 334023096 /nfs/dbraw/zinc/02/30/96/334023096.db2.gz BJRJOIKGWHTIBU-SWLSCSKDSA-N 1 2 302.805 4.136 20 0 DIADLO CCS[C@@H](C)c1noc([C@H]2CCC[N@@H+]2Cc2ccccc2)n1 ZINC000274005390 334053789 /nfs/dbraw/zinc/05/37/89/334053789.db2.gz RQPMUOZHSMKUKB-DZGCQCFKSA-N 1 2 317.458 4.221 20 0 DIADLO CCS[C@@H](C)c1noc([C@H]2CCC[N@H+]2Cc2ccccc2)n1 ZINC000274005390 334053790 /nfs/dbraw/zinc/05/37/90/334053790.db2.gz RQPMUOZHSMKUKB-DZGCQCFKSA-N 1 2 317.458 4.221 20 0 DIADLO Cn1ncc(Cl)c1C[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC000437584771 334054219 /nfs/dbraw/zinc/05/42/19/334054219.db2.gz YAWPWJSVOXLCQI-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1ncc(Cl)c1C[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000437584771 334054220 /nfs/dbraw/zinc/05/42/20/334054220.db2.gz YAWPWJSVOXLCQI-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO CC(C)[C@@H](NC(=O)[C@H](C)c1ccc2ccccc2c1)c1[nH]cc[nH+]1 ZINC000278515559 334097248 /nfs/dbraw/zinc/09/72/48/334097248.db2.gz BHSLPZIKNFCNDN-RDTXWAMCSA-N 1 2 321.424 4.180 20 0 DIADLO CC(C)[C@H](NC(=O)[C@H](C)c1ccc2ccccc2c1)c1[nH]cc[nH+]1 ZINC000278515555 334097454 /nfs/dbraw/zinc/09/74/54/334097454.db2.gz BHSLPZIKNFCNDN-KDOFPFPSSA-N 1 2 321.424 4.180 20 0 DIADLO CC(C)(C)c1nc(C[NH2+]C2(c3ccc(F)cc3)CCCC2)no1 ZINC000170970693 334119775 /nfs/dbraw/zinc/11/97/75/334119775.db2.gz HUFLXIJOMDXXLJ-UHFFFAOYSA-N 1 2 317.408 4.065 20 0 DIADLO Fc1cc(CNc2ccc3c(c2)CCC[NH2+]3)ccc1OC(F)F ZINC000414851685 334125781 /nfs/dbraw/zinc/12/57/81/334125781.db2.gz OXBXCPWVFTYNTH-UHFFFAOYSA-N 1 2 322.330 4.397 20 0 DIADLO FC(F)(F)c1cnc(CNc2ccc3c(c2)CCC[NH2+]3)s1 ZINC000414854632 334127984 /nfs/dbraw/zinc/12/79/84/334127984.db2.gz UMWABPJMIVVFLA-UHFFFAOYSA-N 1 2 313.348 4.132 20 0 DIADLO CC(C)(C)c1cnc(CNc2ccc3c(c2)CCC[NH2+]3)s1 ZINC000414854526 334128372 /nfs/dbraw/zinc/12/83/72/334128372.db2.gz UJMDSHQNQBVKCB-UHFFFAOYSA-N 1 2 301.459 4.411 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@H+](C)Cc1ccc(C)s1 ZINC000343561824 335177707 /nfs/dbraw/zinc/17/77/07/335177707.db2.gz ZWUIAALQSRXTPZ-UHFFFAOYSA-N 1 2 317.433 4.197 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@@H+](C)Cc1ccc(C)s1 ZINC000343561824 335177709 /nfs/dbraw/zinc/17/77/09/335177709.db2.gz ZWUIAALQSRXTPZ-UHFFFAOYSA-N 1 2 317.433 4.197 20 0 DIADLO FC(F)(F)C[C@H]1CC[N@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000282402140 334134377 /nfs/dbraw/zinc/13/43/77/334134377.db2.gz FHPJRKRVNRSVRL-MRVPVSSYSA-N 1 2 313.150 4.163 20 0 DIADLO FC(F)(F)C[C@H]1CC[N@@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000282402140 334134378 /nfs/dbraw/zinc/13/43/78/334134378.db2.gz FHPJRKRVNRSVRL-MRVPVSSYSA-N 1 2 313.150 4.163 20 0 DIADLO COCC[C@@H](Cc1ccco1)Nc1[nH+]ccc2ccc(F)cc21 ZINC000343587639 335179734 /nfs/dbraw/zinc/17/97/34/335179734.db2.gz DKSFZCCEUZRIBQ-HNNXBMFYSA-N 1 2 314.360 4.027 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2nc(-c3cccc(F)c3)no2)cs1 ZINC000294956642 334214858 /nfs/dbraw/zinc/21/48/58/334214858.db2.gz DOSGYXOZFDPPME-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO CC(C)c1ccc(C[NH2+]Cc2noc(-c3cccs3)n2)cc1 ZINC000295077480 334217707 /nfs/dbraw/zinc/21/77/07/334217707.db2.gz RRAMUDRTHJNXFT-UHFFFAOYSA-N 1 2 313.426 4.211 20 0 DIADLO CCc1cnc(C[N@H+](C)C/C=C\c2ccc(F)c(F)c2)s1 ZINC000582149087 334273297 /nfs/dbraw/zinc/27/32/97/334273297.db2.gz VQNJHMQQGZXJBR-PLNGDYQASA-N 1 2 308.397 4.129 20 0 DIADLO CCc1cnc(C[N@@H+](C)C/C=C\c2ccc(F)c(F)c2)s1 ZINC000582149087 334273299 /nfs/dbraw/zinc/27/32/99/334273299.db2.gz VQNJHMQQGZXJBR-PLNGDYQASA-N 1 2 308.397 4.129 20 0 DIADLO Cc1ccoc1C[N@@H+]1CCCC[C@H]1c1nc(-c2ccccc2)no1 ZINC000514092082 334264180 /nfs/dbraw/zinc/26/41/80/334264180.db2.gz BURRPHOSFBRWLY-INIZCTEOSA-N 1 2 323.396 4.365 20 0 DIADLO Cc1ccoc1C[N@H+]1CCCC[C@H]1c1nc(-c2ccccc2)no1 ZINC000514092082 334264182 /nfs/dbraw/zinc/26/41/82/334264182.db2.gz BURRPHOSFBRWLY-INIZCTEOSA-N 1 2 323.396 4.365 20 0 DIADLO Fc1ccc([C@H](NCc2ccccc2Cl)c2[nH]cc[nH+]2)cc1 ZINC000187673624 334268798 /nfs/dbraw/zinc/26/87/98/334268798.db2.gz WEROKGYYTGOILT-INIZCTEOSA-N 1 2 315.779 4.081 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2cccc(Cl)c2)c2ncc[nH]2)cc1 ZINC000187673798 334268875 /nfs/dbraw/zinc/26/88/75/334268875.db2.gz KFIZCKBBUIQLAE-MRXNPFEDSA-N 1 2 315.779 4.081 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[NH+]1CCN(Cc2ccsc2)CC1 ZINC000534521544 334278646 /nfs/dbraw/zinc/27/86/46/334278646.db2.gz HJICQKXHRGTPOK-CQSZACIVSA-N 1 2 320.889 4.280 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[NH+]1CCN(Cc2ccsc2)CC1 ZINC000534521543 334278739 /nfs/dbraw/zinc/27/87/39/334278739.db2.gz HJICQKXHRGTPOK-AWEZNQCLSA-N 1 2 320.889 4.280 20 0 DIADLO CC(C)n1ccnc1C[NH+]1CCC(=Cc2cccc(F)c2)CC1 ZINC000534537616 334279767 /nfs/dbraw/zinc/27/97/67/334279767.db2.gz KWYPEUYVMXWOPM-UHFFFAOYSA-N 1 2 313.420 4.283 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)COc3cccc(C(C)C)c3)cc2[nH+]1 ZINC000531930483 334291159 /nfs/dbraw/zinc/29/11/59/334291159.db2.gz XDVHZFCNDWUDAY-UHFFFAOYSA-N 1 2 323.396 4.012 20 0 DIADLO CCC1CC[NH+](CC(=O)Nc2cccc(Cl)c2Cl)CC1 ZINC000048584370 334293813 /nfs/dbraw/zinc/29/38/13/334293813.db2.gz LTAJAWDGMTZRIU-UHFFFAOYSA-N 1 2 315.244 4.054 20 0 DIADLO Fc1ccccc1C1CC[NH+](Cc2ncc(C3CC3)o2)CC1 ZINC000534856847 334341524 /nfs/dbraw/zinc/34/15/24/334341524.db2.gz ZXOVNKAQUJEKCP-UHFFFAOYSA-N 1 2 300.377 4.071 20 0 DIADLO CCc1c(NCc2ccc(C)[nH+]c2C)cnn1-c1cccc(C)c1 ZINC000563679189 334343548 /nfs/dbraw/zinc/34/35/48/334343548.db2.gz RERKFHHHOXIRHC-UHFFFAOYSA-N 1 2 320.440 4.367 20 0 DIADLO CC(C)Cn1cc[nH+]c1CNC(=O)C[C@@H]1C[C@H](C)CC(C)(C)C1 ZINC000303927515 334347771 /nfs/dbraw/zinc/34/77/71/334347771.db2.gz PENWXYLTKYANGF-HOTGVXAUSA-N 1 2 319.493 4.008 20 0 DIADLO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1csc([C@H](C)OC)n1 ZINC000531979652 334350676 /nfs/dbraw/zinc/35/06/76/334350676.db2.gz XWFLIQCCAXLKRS-STQMWFEESA-N 1 2 320.458 4.018 20 0 DIADLO Cc1noc(C(C)(C)[NH2+]Cc2c(C)cc(C(C)(C)C)cc2C)n1 ZINC000563680178 334354479 /nfs/dbraw/zinc/35/44/79/334354479.db2.gz WDPSSMAGYNUWEA-UHFFFAOYSA-N 1 2 315.461 4.317 20 0 DIADLO Cc1cc(NC(=O)[C@@H](C)c2ccc3ccccc3c2)c(C)c[nH+]1 ZINC000535036248 334359154 /nfs/dbraw/zinc/35/91/54/334359154.db2.gz QPIXGTRFUIUSHO-HNNXBMFYSA-N 1 2 304.393 4.016 20 0 DIADLO Cc1ccc(-c2ccsc2C(=O)Nc2cc(C)[nH+]cc2C)cc1 ZINC000535036637 334359325 /nfs/dbraw/zinc/35/93/25/334359325.db2.gz YRTZIRQDYBXXAZ-UHFFFAOYSA-N 1 2 322.433 4.410 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2OC2CCCCC2)c(C)c[nH+]1 ZINC000535036375 334359428 /nfs/dbraw/zinc/35/94/28/334359428.db2.gz PYLONOPYJLPRIR-UHFFFAOYSA-N 1 2 324.424 4.084 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000535062967 334362069 /nfs/dbraw/zinc/36/20/69/334362069.db2.gz AAOZLSJRUPXRJZ-HIFRSBDPSA-N 1 2 308.491 4.190 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000535062967 334362070 /nfs/dbraw/zinc/36/20/70/334362070.db2.gz AAOZLSJRUPXRJZ-HIFRSBDPSA-N 1 2 308.491 4.190 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000535062955 334362114 /nfs/dbraw/zinc/36/21/14/334362114.db2.gz AAOZLSJRUPXRJZ-DZGCQCFKSA-N 1 2 308.491 4.190 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000535062955 334362115 /nfs/dbraw/zinc/36/21/15/334362115.db2.gz AAOZLSJRUPXRJZ-DZGCQCFKSA-N 1 2 308.491 4.190 20 0 DIADLO Cc1cc(N2CCC[C@H]2C2CCCC2)nc(-c2ccncc2)[nH+]1 ZINC000112075411 334364316 /nfs/dbraw/zinc/36/43/16/334364316.db2.gz CULAUZRDXXWGJC-KRWDZBQOSA-N 1 2 308.429 4.006 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2cccn2CCC(C)C)cs1 ZINC000535084606 334367015 /nfs/dbraw/zinc/36/70/15/334367015.db2.gz JMDITILTHWVXHK-UHFFFAOYSA-N 1 2 305.491 4.185 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2cccn2CCC(C)C)cs1 ZINC000535084606 334367016 /nfs/dbraw/zinc/36/70/16/334367016.db2.gz JMDITILTHWVXHK-UHFFFAOYSA-N 1 2 305.491 4.185 20 0 DIADLO CC[C@H](NC(=O)C[C@@H](C)c1ccc(C(C)C)cc1)c1[nH]cc[nH+]1 ZINC000443138821 338445376 /nfs/dbraw/zinc/44/53/76/338445376.db2.gz VIOFLRLRHYKFKX-PBHICJAKSA-N 1 2 313.445 4.294 20 0 DIADLO O=C(C[C@@H]1C[C@H]1c1ccccc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000340898067 334389279 /nfs/dbraw/zinc/38/92/79/334389279.db2.gz NWOLCIMBYIJAHS-LPHOPBHVSA-N 1 2 317.392 4.005 20 0 DIADLO CC(C)Cn1cc(C[N@H+](C)[C@@H](C)c2c(F)cccc2F)cn1 ZINC000340948602 334395914 /nfs/dbraw/zinc/39/59/14/334395914.db2.gz MHHWPISGDRAVTM-ZDUSSCGKSA-N 1 2 307.388 4.010 20 0 DIADLO CC(C)Cn1cc(C[N@@H+](C)[C@@H](C)c2c(F)cccc2F)cn1 ZINC000340948602 334395915 /nfs/dbraw/zinc/39/59/15/334395915.db2.gz MHHWPISGDRAVTM-ZDUSSCGKSA-N 1 2 307.388 4.010 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3csc4ccccc34)cc2[nH+]1 ZINC000340954294 334396398 /nfs/dbraw/zinc/39/63/98/334396398.db2.gz OOWPSBDLRRKYSR-UHFFFAOYSA-N 1 2 307.378 4.338 20 0 DIADLO Cc1[nH]c2cc(NC(=O)c3csc4ccccc34)ccc2[nH+]1 ZINC000340954294 334396399 /nfs/dbraw/zinc/39/63/99/334396399.db2.gz OOWPSBDLRRKYSR-UHFFFAOYSA-N 1 2 307.378 4.338 20 0 DIADLO Cc1c[nH+]c(CNc2ccc(Br)cc2C(C)C)n1C ZINC000341386591 334437820 /nfs/dbraw/zinc/43/78/20/334437820.db2.gz GQKAYOFCNUZRFV-UHFFFAOYSA-N 1 2 322.250 4.227 20 0 DIADLO Cc1cc(N(C)[C@H](C)c2c(F)cccc2F)nc(C2CC2)[nH+]1 ZINC000341476866 334451948 /nfs/dbraw/zinc/45/19/48/334451948.db2.gz GERLKIISTJFRBG-LLVKDONJSA-N 1 2 303.356 4.138 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(Cl)sc1Cl)c1nccn1C ZINC000341818318 334482063 /nfs/dbraw/zinc/48/20/63/334482063.db2.gz IRXSLAQLTKNMRA-VIFPVBQESA-N 1 2 304.246 4.029 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+][C@H](C)c2nnc(CC)o2)cc1 ZINC000341803905 334483870 /nfs/dbraw/zinc/48/38/70/334483870.db2.gz NRAGIYPGMFCRSR-VXGBXAGGSA-N 1 2 305.447 4.156 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3cccc(O)c3)cs2)o1 ZINC000341806559 334484142 /nfs/dbraw/zinc/48/41/42/334484142.db2.gz JTVXANCWBSDGEO-GFCCVEGCSA-N 1 2 314.410 4.268 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](c2ccc(Cl)cc2)[C@@H](C)CC)o1 ZINC000341857943 334485587 /nfs/dbraw/zinc/48/55/87/334485587.db2.gz FRYHAHRTELQTGR-MEDUHNTESA-N 1 2 307.825 4.162 20 0 DIADLO CCC(CC)n1ccc(CSCc2c[nH+]ccc2OC)n1 ZINC000342004471 334500358 /nfs/dbraw/zinc/50/03/58/334500358.db2.gz NFMZFMUADOJDEI-UHFFFAOYSA-N 1 2 305.447 4.081 20 0 DIADLO COc1ccc(Cl)c(CSCc2c[nH+]ccc2OC)c1 ZINC000342010445 334501056 /nfs/dbraw/zinc/50/10/56/334501056.db2.gz VIHSFCUEZXELCV-UHFFFAOYSA-N 1 2 309.818 4.186 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC000342066707 334506493 /nfs/dbraw/zinc/50/64/93/334506493.db2.gz JICYZJXRUROWNP-LSDHHAIUSA-N 1 2 307.397 4.457 20 0 DIADLO Cc1c[nH+]c(CN2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)n1C ZINC000342796804 334572262 /nfs/dbraw/zinc/57/22/62/334572262.db2.gz ZOGZUQAIHSFOFS-OAHLLOKOSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1ccc(C[S@@](=O)[C@H](C)c2ccc3c(c2)CCC3)c(C)[nH+]1 ZINC000417160431 334696240 /nfs/dbraw/zinc/69/62/40/334696240.db2.gz HZWJKPRVQALMJR-IVZQSRNASA-N 1 2 313.466 4.197 20 0 DIADLO CSc1cc(C)ccc1NC(=O)NCc1c[nH+]c(C)cc1C ZINC000417241026 334701627 /nfs/dbraw/zinc/70/16/27/334701627.db2.gz MVZWYBOSPCTCOX-UHFFFAOYSA-N 1 2 315.442 4.050 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(OC3CCC3)cc2)c(C)[nH+]1 ZINC000443832765 338461255 /nfs/dbraw/zinc/46/12/55/338461255.db2.gz BIHXYKPBXGDEPS-UHFFFAOYSA-N 1 2 310.397 4.190 20 0 DIADLO CCOc1cc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)ccc1C ZINC000113161429 334732769 /nfs/dbraw/zinc/73/27/69/334732769.db2.gz GUJQRTJFNSEMEO-UHFFFAOYSA-N 1 2 321.380 4.036 20 0 DIADLO CS[C@H]1CC[C@@H]1Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000425353618 334836270 /nfs/dbraw/zinc/83/62/70/334836270.db2.gz IUBVOJKGDIKRNV-IRXDYDNUSA-N 1 2 313.470 4.192 20 0 DIADLO Cc1ccccc1[C@@H]1C[C@@H](C)N(c2cc[nH+]c3ccncc32)C1 ZINC000444069505 338467952 /nfs/dbraw/zinc/46/79/52/338467952.db2.gz HXUPORVANASHLJ-HZPDHXFCSA-N 1 2 303.409 4.321 20 0 DIADLO c1ccc(C(Nc2cc[nH+]c3ccncc23)c2ccccc2)cc1 ZINC000444109020 338468361 /nfs/dbraw/zinc/46/83/61/338468361.db2.gz LSJXVXUKRDGQRD-UHFFFAOYSA-N 1 2 311.388 4.253 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+]Cc2ccc(Cl)cc2F)o1 ZINC000189185889 334888220 /nfs/dbraw/zinc/88/82/20/334888220.db2.gz PPTYRZFDWJIROQ-OAHLLOKOSA-N 1 2 311.784 4.112 20 0 DIADLO CC[C@@H](Nc1cc(C)[nH+]c(-c2cccnc2)n1)c1c(C)noc1C ZINC000161639773 334892699 /nfs/dbraw/zinc/89/26/99/334892699.db2.gz KRSBRWQDCQEOEA-OAHLLOKOSA-N 1 2 323.400 4.015 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2cc(F)ccc2Cl)o1 ZINC000189436847 334894840 /nfs/dbraw/zinc/89/48/40/334894840.db2.gz BGEVHQWYVIRPIQ-HNNXBMFYSA-N 1 2 311.784 4.112 20 0 DIADLO CCCc1ccc([C@@H]([NH2+]Cc2nc(C(F)F)no2)C(C)C)cc1 ZINC000425428525 334904753 /nfs/dbraw/zinc/90/47/53/334904753.db2.gz WICDYXRCWKUBQQ-HNNXBMFYSA-N 1 2 323.387 4.447 20 0 DIADLO C[C@@H](CN(C)c1[nH+]ccc2ccc(F)cc21)c1nccs1 ZINC000343713042 335186161 /nfs/dbraw/zinc/18/61/61/335186161.db2.gz OHFFZNXZSAOZLB-NSHDSACASA-N 1 2 301.390 4.070 20 0 DIADLO COc1cccc2c(N[C@@H](C)c3c(F)cncc3F)cc[nH+]c12 ZINC000343798976 335193609 /nfs/dbraw/zinc/19/36/09/335193609.db2.gz ZJUWQXIKGALXHL-JTQLQIEISA-N 1 2 315.323 4.090 20 0 DIADLO CCc1cnc(C[NH2+]C2(c3nc(C)cs3)CCCC2)s1 ZINC000344114451 335218320 /nfs/dbraw/zinc/21/83/20/335218320.db2.gz MNEWDQVQRDZONN-UHFFFAOYSA-N 1 2 307.488 4.030 20 0 DIADLO CC[C@@H](NC(=O)c1cccc(-n2cc[nH+]c2)c1)c1ccc(C)cc1 ZINC000344206158 335225175 /nfs/dbraw/zinc/22/51/75/335225175.db2.gz FICXXOVPELEVPN-LJQANCHMSA-N 1 2 319.408 4.062 20 0 DIADLO Brc1ccsc1C[N@@H+]1CCCc2occc2C1 ZINC000344238831 335231252 /nfs/dbraw/zinc/23/12/52/335231252.db2.gz BGLQWKQGZZIMGL-UHFFFAOYSA-N 1 2 312.232 4.052 20 0 DIADLO Brc1ccsc1C[N@H+]1CCCc2occc2C1 ZINC000344238831 335231253 /nfs/dbraw/zinc/23/12/53/335231253.db2.gz BGLQWKQGZZIMGL-UHFFFAOYSA-N 1 2 312.232 4.052 20 0 DIADLO CC[C@@]1(C)CCN(C(=O)c2ccc(C)c(Oc3cc[nH+]cc3)c2)C1 ZINC000344344822 335242839 /nfs/dbraw/zinc/24/28/39/335242839.db2.gz DEAUFEDNZBMQCR-FQEVSTJZSA-N 1 2 324.424 4.445 20 0 DIADLO Cc1ccc2c(c1)[C@@H](NC(=O)Nc1ccc(C)[nH+]c1C)CCC2 ZINC000344423266 335247569 /nfs/dbraw/zinc/24/75/69/335247569.db2.gz ICERZXVLXBMYII-SFHVURJKSA-N 1 2 309.413 4.206 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2cc3cc(F)ccc3o2)o1 ZINC000344453021 335250126 /nfs/dbraw/zinc/25/01/26/335250126.db2.gz UWTJSPQDXMAUQS-INIZCTEOSA-N 1 2 317.360 4.205 20 0 DIADLO COc1ccc(C(C)(C)[NH2+]Cc2ncc(C(C)(C)C)o2)cc1F ZINC000528674978 335258455 /nfs/dbraw/zinc/25/84/55/335258455.db2.gz KDDGSXAGCPJILN-UHFFFAOYSA-N 1 2 320.408 4.145 20 0 DIADLO COc1ccc(C[NH2+]C(C)(C)c2ncc(C)s2)c(Cl)c1 ZINC000344598635 335262597 /nfs/dbraw/zinc/26/25/97/335262597.db2.gz CODTWBUFMXYVKE-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C(C3CC3)C3CC3)c2)[nH+]c1C ZINC000366872749 335263621 /nfs/dbraw/zinc/26/36/21/335263621.db2.gz VJWCXMXNJZVMSS-UHFFFAOYSA-N 1 2 309.413 4.068 20 0 DIADLO CC(C)[C@H](N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1)C(F)(F)F ZINC000345162106 335302754 /nfs/dbraw/zinc/30/27/54/335302754.db2.gz KBOYSHWBCDRSPP-WFASDCNBSA-N 1 2 311.351 4.110 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2csc(Cl)c2)s1 ZINC000345329567 335317636 /nfs/dbraw/zinc/31/76/36/335317636.db2.gz ZBCXOZBTPVSSSC-QMMMGPOBSA-N 1 2 301.868 4.227 20 0 DIADLO CCCn1c(C(=O)Nc2ccc(C)[nH+]c2C)cc2ccccc21 ZINC000345736165 335346855 /nfs/dbraw/zinc/34/68/55/335346855.db2.gz AQQDOFNAYSQYIQ-UHFFFAOYSA-N 1 2 307.397 4.315 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2ccc(F)cn2)s1 ZINC000345743524 335347375 /nfs/dbraw/zinc/34/73/75/335347375.db2.gz XZQLJDYLNBTVQU-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2ccc(F)cn2)s1 ZINC000345743524 335347377 /nfs/dbraw/zinc/34/73/77/335347377.db2.gz XZQLJDYLNBTVQU-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2ccc(F)cn2)C2CC2)o1 ZINC000345775990 335350647 /nfs/dbraw/zinc/35/06/47/335350647.db2.gz RSTUJTZVGFVNIU-YVEFUNNKSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2ccc(F)cn2)C2CC2)o1 ZINC000345775990 335350648 /nfs/dbraw/zinc/35/06/48/335350648.db2.gz RSTUJTZVGFVNIU-YVEFUNNKSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@H]1CC=CC[C@@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000346007382 335369148 /nfs/dbraw/zinc/36/91/48/335369148.db2.gz AGGKFUAGEZLVIY-YOEHRIQHSA-N 1 2 320.396 4.051 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccc(C(F)F)cc1 ZINC000346092140 335374331 /nfs/dbraw/zinc/37/43/31/335374331.db2.gz UPRJZVHVDYORCW-UHFFFAOYSA-N 1 2 313.307 4.267 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@@H+]2Cc2cc(C)c3ncccc3c2)o1 ZINC000346221353 335385748 /nfs/dbraw/zinc/38/57/48/335385748.db2.gz OBZWXJJZWQQOLD-SFHVURJKSA-N 1 2 322.408 4.018 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@H+]2Cc2cc(C)c3ncccc3c2)o1 ZINC000346221353 335385749 /nfs/dbraw/zinc/38/57/49/335385749.db2.gz OBZWXJJZWQQOLD-SFHVURJKSA-N 1 2 322.408 4.018 20 0 DIADLO CC(C)C[C@H]1C[C@H](Nc2[nH+]ccc3ccc(F)cc32)CCO1 ZINC000346229187 335385897 /nfs/dbraw/zinc/38/58/97/335385897.db2.gz LSTSEAXAYMTBCW-CVEARBPZSA-N 1 2 302.393 4.380 20 0 DIADLO CC[C@H](NC(=O)c1ccc(C(C)C)c(Cl)c1)c1[nH]cc[nH+]1 ZINC000346251695 335394783 /nfs/dbraw/zinc/39/47/83/335394783.db2.gz LAGVGWDQPZFIRG-AWEZNQCLSA-N 1 2 305.809 4.068 20 0 DIADLO Cc1cc(C)c(NC(=O)C[N@H+](Cc2ccco2)C(C)C)c(C)c1 ZINC000346349739 335397060 /nfs/dbraw/zinc/39/70/60/335397060.db2.gz QAONVBFXXZSHAF-UHFFFAOYSA-N 1 2 314.429 4.054 20 0 DIADLO Cc1cc(C)c(NC(=O)C[N@@H+](Cc2ccco2)C(C)C)c(C)c1 ZINC000346349739 335397063 /nfs/dbraw/zinc/39/70/63/335397063.db2.gz QAONVBFXXZSHAF-UHFFFAOYSA-N 1 2 314.429 4.054 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)cn1)c1nc(-c2ccccc2)cs1 ZINC000346568158 335417061 /nfs/dbraw/zinc/41/70/61/335417061.db2.gz OGIDHADJUBULDP-GFCCVEGCSA-N 1 2 313.401 4.195 20 0 DIADLO Cc1nc(-c2ccc([C@@H](C)Nc3cc(C)[nH+]cn3)cc2)cs1 ZINC000346594258 335421940 /nfs/dbraw/zinc/42/19/40/335421940.db2.gz PXVAKDHJTZEYOT-GFCCVEGCSA-N 1 2 310.426 4.390 20 0 DIADLO Cc1ccc(-c2csc(C[NH2+][C@H](C)c3ccccn3)n2)cc1 ZINC000347002892 335458724 /nfs/dbraw/zinc/45/87/24/335458724.db2.gz ZIZBHTJJIROGAA-CQSZACIVSA-N 1 2 309.438 4.364 20 0 DIADLO Cc1ccc(N[C@@H]2CCc3c2cc(Br)cc3F)c[nH+]1 ZINC000347138368 335472725 /nfs/dbraw/zinc/47/27/25/335472725.db2.gz XPZNZRYWZJBDSF-OAHLLOKOSA-N 1 2 321.193 4.391 20 0 DIADLO CC[C@@H](C)n1ncc(NCc2cc(OC)cc(C)[nH+]2)c1C1CC1 ZINC000347630970 335511782 /nfs/dbraw/zinc/51/17/82/335511782.db2.gz IVDNXOIIEBFHHU-CYBMUJFWSA-N 1 2 314.433 4.056 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@@H](CC)c2nc(C)cs2)n1 ZINC000347647291 335517278 /nfs/dbraw/zinc/51/72/78/335517278.db2.gz LEDULTKRCSFVNG-HNNXBMFYSA-N 1 2 306.479 4.250 20 0 DIADLO Cc1cc[nH+]cc1CCCNc1cccc(Oc2cnccn2)c1 ZINC000347921328 335538604 /nfs/dbraw/zinc/53/86/04/335538604.db2.gz PVTPPYPJDQCMIQ-UHFFFAOYSA-N 1 2 320.396 4.017 20 0 DIADLO CC(C)(C)OCc1cccc(C[NH2+]Cc2ncc(Cl)s2)c1 ZINC000349601115 335683779 /nfs/dbraw/zinc/68/37/79/335683779.db2.gz RKJUWRNXSXZDCK-UHFFFAOYSA-N 1 2 324.877 4.401 20 0 DIADLO Fc1cc(F)cc(C[NH+](Cc2ccco2)Cc2ccco2)c1 ZINC000349613448 335685062 /nfs/dbraw/zinc/68/50/62/335685062.db2.gz MCWQNPIZKROPCF-UHFFFAOYSA-N 1 2 303.308 4.353 20 0 DIADLO COCC[C@H]([NH2+]Cc1csc(C(C)C)n1)c1ccc(C)o1 ZINC000350312930 335743882 /nfs/dbraw/zinc/74/38/82/335743882.db2.gz WERHYVKVRQLOAD-AWEZNQCLSA-N 1 2 308.447 4.035 20 0 DIADLO CC(C)[C@@H]1N(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1(C)C ZINC000350731145 335777575 /nfs/dbraw/zinc/77/75/75/335777575.db2.gz WTCZZCJWJRLBMA-SFHVURJKSA-N 1 2 324.424 4.381 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2c2cccc3ccccc32)c(C)c[nH+]1 ZINC000536575315 335840607 /nfs/dbraw/zinc/84/06/07/335840607.db2.gz JRUUTOAQUQDGKS-RTBURBONSA-N 1 2 316.404 4.016 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)c(C)c[nH+]1 ZINC000536575313 335840617 /nfs/dbraw/zinc/84/06/17/335840617.db2.gz JRUUTOAQUQDGKS-RBUKOAKNSA-N 1 2 316.404 4.016 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1nnc(C(C)C)s1 ZINC000519624660 335882687 /nfs/dbraw/zinc/88/26/87/335882687.db2.gz CIOWMWJHKRCXSD-ZDUSSCGKSA-N 1 2 319.474 4.300 20 0 DIADLO Cc1cc(N2CC=C(c3cccc4ccccc43)CC2)nc[nH+]1 ZINC000520328879 335962495 /nfs/dbraw/zinc/96/24/95/335962495.db2.gz NPWZUDICFLQDME-UHFFFAOYSA-N 1 2 301.393 4.232 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc([C@@H]2CCC[C@@H](C)C2)n1 ZINC000329630790 336020108 /nfs/dbraw/zinc/02/01/08/336020108.db2.gz VPCCDXUIUNQORS-UKRRQHHQSA-N 1 2 324.428 4.264 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cc4ccc(Cl)cc4[nH]3)cc2[nH+]1 ZINC000351484364 336037900 /nfs/dbraw/zinc/03/79/00/336037900.db2.gz DOFLYLOYEQUXHR-UHFFFAOYSA-N 1 2 324.771 4.258 20 0 DIADLO Cc1[nH]c2cc(NC(=O)c3cc4ccc(Cl)cc4[nH]3)ccc2[nH+]1 ZINC000351484364 336037902 /nfs/dbraw/zinc/03/79/02/336037902.db2.gz DOFLYLOYEQUXHR-UHFFFAOYSA-N 1 2 324.771 4.258 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(SC(C)C)cc2)no1 ZINC000351572203 336046121 /nfs/dbraw/zinc/04/61/21/336046121.db2.gz CHNYPRQCSBVMDK-VXGBXAGGSA-N 1 2 305.447 4.290 20 0 DIADLO Cc1[nH]ncc1C[N@H+](Cc1cccc(C(F)(F)F)c1)C(C)C ZINC000351594182 336048108 /nfs/dbraw/zinc/04/81/08/336048108.db2.gz CIIMYPSURPQORM-UHFFFAOYSA-N 1 2 311.351 4.148 20 0 DIADLO Cc1[nH]ncc1C[N@@H+](Cc1cccc(C(F)(F)F)c1)C(C)C ZINC000351594182 336048110 /nfs/dbraw/zinc/04/81/10/336048110.db2.gz CIIMYPSURPQORM-UHFFFAOYSA-N 1 2 311.351 4.148 20 0 DIADLO Cc1[nH]ncc1C[N@H+](Cc1ccccc1)Cc1ccccc1C ZINC000351661693 336055970 /nfs/dbraw/zinc/05/59/70/336055970.db2.gz OKEONJKRBZYCDI-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO Cc1[nH]ncc1C[N@@H+](Cc1ccccc1)Cc1ccccc1C ZINC000351661693 336055971 /nfs/dbraw/zinc/05/59/71/336055971.db2.gz OKEONJKRBZYCDI-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO Cc1c(C[N@H+](Cc2ccccc2)Cc2ccccc2F)cnn1C ZINC000351666648 336056462 /nfs/dbraw/zinc/05/64/62/336056462.db2.gz WFAVLROEWYRAMR-UHFFFAOYSA-N 1 2 323.415 4.070 20 0 DIADLO Cc1c(C[N@@H+](Cc2ccccc2)Cc2ccccc2F)cnn1C ZINC000351666648 336056464 /nfs/dbraw/zinc/05/64/64/336056464.db2.gz WFAVLROEWYRAMR-UHFFFAOYSA-N 1 2 323.415 4.070 20 0 DIADLO Fc1ccc2cc[nH+]c(N3CCC[C@@H](c4nccs4)C3)c2c1 ZINC000351768648 336066146 /nfs/dbraw/zinc/06/61/46/336066146.db2.gz IWOQOZGHUSZNGY-CYBMUJFWSA-N 1 2 313.401 4.214 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cccn3C3CCCC3)cc2[nH+]1 ZINC000351841636 336072598 /nfs/dbraw/zinc/07/25/98/336072598.db2.gz CNJAIKQSJCPYCO-UHFFFAOYSA-N 1 2 308.385 4.040 20 0 DIADLO Cc1[nH]c2cc(NC(=O)c3cccn3C3CCCC3)ccc2[nH+]1 ZINC000351841636 336072600 /nfs/dbraw/zinc/07/26/00/336072600.db2.gz CNJAIKQSJCPYCO-UHFFFAOYSA-N 1 2 308.385 4.040 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccc2c(c1)CCO2 ZINC000324255697 336121246 /nfs/dbraw/zinc/12/12/46/336121246.db2.gz CFHPWPMEBPMKKC-OAHLLOKOSA-N 1 2 323.440 4.180 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+]2CCC[C@@H]2c2ccc(C)o2)n1 ZINC000331375017 336134171 /nfs/dbraw/zinc/13/41/71/336134171.db2.gz CSXDMEULHFCPTN-UONOGXRCSA-N 1 2 303.406 4.212 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+]2CCC[C@@H]2c2ccc(C)o2)n1 ZINC000331375017 336134172 /nfs/dbraw/zinc/13/41/72/336134172.db2.gz CSXDMEULHFCPTN-UONOGXRCSA-N 1 2 303.406 4.212 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@@H+]2[C@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331403831 336134937 /nfs/dbraw/zinc/13/49/37/336134937.db2.gz NSPHKJUDNONMJR-OCCSQVGLSA-N 1 2 317.433 4.421 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@H+]2[C@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331403831 336134938 /nfs/dbraw/zinc/13/49/38/336134938.db2.gz NSPHKJUDNONMJR-OCCSQVGLSA-N 1 2 317.433 4.421 20 0 DIADLO C[C@@H]([C@H](C)[NH2+]Cc1nc(=O)c2sccc2[nH]1)C1CCCCC1 ZINC000332120625 336159350 /nfs/dbraw/zinc/15/93/50/336159350.db2.gz YVBIBWDWPHXNNA-RYUDHWBXSA-N 1 2 319.474 4.091 20 0 DIADLO Cc1csc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)n1 ZINC000351944090 336182073 /nfs/dbraw/zinc/18/20/73/336182073.db2.gz JILDPNOAKZFURU-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO Cc1csc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)n1 ZINC000351944090 336182074 /nfs/dbraw/zinc/18/20/74/336182074.db2.gz JILDPNOAKZFURU-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO CCc1[nH]ccc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000351960620 336183494 /nfs/dbraw/zinc/18/34/94/336183494.db2.gz VJZGKBHGDGSAHK-UHFFFAOYSA-N 1 2 307.353 4.017 20 0 DIADLO Cc1ncc(C[N@H+]2CC=C(c3c(F)cccc3F)CC2)s1 ZINC000351980624 336185452 /nfs/dbraw/zinc/18/54/52/336185452.db2.gz GFNCEKMTJVDUGF-UHFFFAOYSA-N 1 2 306.381 4.019 20 0 DIADLO Cc1ncc(C[N@@H+]2CC=C(c3c(F)cccc3F)CC2)s1 ZINC000351980624 336185454 /nfs/dbraw/zinc/18/54/54/336185454.db2.gz GFNCEKMTJVDUGF-UHFFFAOYSA-N 1 2 306.381 4.019 20 0 DIADLO CCc1cnc(C[N@H+]2CC=C(c3c(F)cccc3F)CC2)s1 ZINC000351983146 336185872 /nfs/dbraw/zinc/18/58/72/336185872.db2.gz QUXQPNZVZFJVAC-UHFFFAOYSA-N 1 2 320.408 4.273 20 0 DIADLO CCc1cnc(C[N@@H+]2CC=C(c3c(F)cccc3F)CC2)s1 ZINC000351983146 336185873 /nfs/dbraw/zinc/18/58/73/336185873.db2.gz QUXQPNZVZFJVAC-UHFFFAOYSA-N 1 2 320.408 4.273 20 0 DIADLO CN(C)c1cccc([C@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)c1 ZINC000351998251 336187023 /nfs/dbraw/zinc/18/70/23/336187023.db2.gz YXDTYLNTCBXXPK-CQSZACIVSA-N 1 2 321.877 4.200 20 0 DIADLO CN(C)c1cccc([C@H]2CCC[N@H+]2Cc2ncc(Cl)s2)c1 ZINC000351998251 336187025 /nfs/dbraw/zinc/18/70/25/336187025.db2.gz YXDTYLNTCBXXPK-CQSZACIVSA-N 1 2 321.877 4.200 20 0 DIADLO CCCn1c(C[N@@H+]2CCC[C@H]2c2cc(C)no2)nc2ccccc21 ZINC000352086184 336194129 /nfs/dbraw/zinc/19/41/29/336194129.db2.gz AUMCRAUBKZXHGT-KRWDZBQOSA-N 1 2 324.428 4.080 20 0 DIADLO CCCn1c(C[N@H+]2CCC[C@H]2c2cc(C)no2)nc2ccccc21 ZINC000352086184 336194131 /nfs/dbraw/zinc/19/41/31/336194131.db2.gz AUMCRAUBKZXHGT-KRWDZBQOSA-N 1 2 324.428 4.080 20 0 DIADLO Cc1nc([C@H](C)[NH+]2CCC([C@H](F)c3ccccc3F)CC2)no1 ZINC000352093969 336194556 /nfs/dbraw/zinc/19/45/56/336194556.db2.gz VUWDEEINEJGSEX-ZBEGNZNMSA-N 1 2 321.371 4.001 20 0 DIADLO CC1(C)CC[C@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000352130441 336195897 /nfs/dbraw/zinc/19/58/97/336195897.db2.gz GWTLWPBEQBOTHB-HNNXBMFYSA-N 1 2 310.397 4.182 20 0 DIADLO Cn1c2ccccc2nc1[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)o1 ZINC000352285565 336210153 /nfs/dbraw/zinc/21/01/53/336210153.db2.gz GUYKDLKVNCMSHZ-HNNXBMFYSA-N 1 2 315.804 4.157 20 0 DIADLO Cn1c2ccccc2nc1[C@@H]1CCC[N@H+]1Cc1ccc(Cl)o1 ZINC000352285565 336210154 /nfs/dbraw/zinc/21/01/54/336210154.db2.gz GUYKDLKVNCMSHZ-HNNXBMFYSA-N 1 2 315.804 4.157 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)[C@@H](C)[C@@H](C)O1 ZINC000526121300 336213032 /nfs/dbraw/zinc/21/30/32/336213032.db2.gz JFKWKJXMDHWSQI-HZSPNIEDSA-N 1 2 308.491 4.189 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)[C@@H](C)[C@@H](C)O1 ZINC000526121300 336213033 /nfs/dbraw/zinc/21/30/33/336213033.db2.gz JFKWKJXMDHWSQI-HZSPNIEDSA-N 1 2 308.491 4.189 20 0 DIADLO Clc1cnc(C[NH2+][C@H]2CCc3sc(Cl)cc32)s1 ZINC000352473638 336221004 /nfs/dbraw/zinc/22/10/04/336221004.db2.gz WLNDAOIMRATEOM-ZETCQYMHSA-N 1 2 305.255 4.289 20 0 DIADLO c1coc(-c2nc(C[N@@H+]3CCC=C(c4ccco4)C3)cs2)c1 ZINC000352562426 336224662 /nfs/dbraw/zinc/22/46/62/336224662.db2.gz KPPIWJHIOZCKQJ-UHFFFAOYSA-N 1 2 312.394 4.285 20 0 DIADLO c1coc(-c2nc(C[N@H+]3CCC=C(c4ccco4)C3)cs2)c1 ZINC000352562426 336224663 /nfs/dbraw/zinc/22/46/63/336224663.db2.gz KPPIWJHIOZCKQJ-UHFFFAOYSA-N 1 2 312.394 4.285 20 0 DIADLO Cc1cc(C(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)c(C(F)(F)F)o1 ZINC000352561049 336224673 /nfs/dbraw/zinc/22/46/73/336224673.db2.gz BMZYLFFIXRCJEG-UHFFFAOYSA-N 1 2 323.274 4.044 20 0 DIADLO Cc1cc(C(=O)Nc2ccc3[nH+]c(C)[nH]c3c2)c(C(F)(F)F)o1 ZINC000352561049 336224674 /nfs/dbraw/zinc/22/46/74/336224674.db2.gz BMZYLFFIXRCJEG-UHFFFAOYSA-N 1 2 323.274 4.044 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3coc4cc(C)c(C)cc34)cc2[nH+]1 ZINC000352563943 336224798 /nfs/dbraw/zinc/22/47/98/336224798.db2.gz XGWHKRBUVWFSNL-UHFFFAOYSA-N 1 2 319.364 4.487 20 0 DIADLO Cc1[nH]c2cc(NC(=O)c3coc4cc(C)c(C)cc34)ccc2[nH+]1 ZINC000352563943 336224799 /nfs/dbraw/zinc/22/47/99/336224799.db2.gz XGWHKRBUVWFSNL-UHFFFAOYSA-N 1 2 319.364 4.487 20 0 DIADLO CC(C)c1ncc(C[N@H+]2C[C@@H](c3ccccc3)O[C@@H](C)C2)s1 ZINC000352721097 336232303 /nfs/dbraw/zinc/23/23/03/336232303.db2.gz ZFADSFOFVQHXGZ-YOEHRIQHSA-N 1 2 316.470 4.229 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2C[C@@H](c3ccccc3)O[C@@H](C)C2)s1 ZINC000352721097 336232304 /nfs/dbraw/zinc/23/23/04/336232304.db2.gz ZFADSFOFVQHXGZ-YOEHRIQHSA-N 1 2 316.470 4.229 20 0 DIADLO CN(Cc1cccs1)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000352764518 336233656 /nfs/dbraw/zinc/23/36/56/336233656.db2.gz XGHUSFYOVGJEIO-UHFFFAOYSA-N 1 2 324.405 4.208 20 0 DIADLO CC[C@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccc(F)cn1 ZINC000352781531 336236132 /nfs/dbraw/zinc/23/61/32/336236132.db2.gz CISCXMLFGOIBLG-ZDUSSCGKSA-N 1 2 317.389 4.178 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)sc1C ZINC000352782287 336236275 /nfs/dbraw/zinc/23/62/75/336236275.db2.gz HBQFCOQERADINZ-SFHVURJKSA-N 1 2 309.438 4.034 20 0 DIADLO Fc1cc(NCc2ccc3occc3c2)ccc1-n1cc[nH+]c1 ZINC000352794110 336237140 /nfs/dbraw/zinc/23/71/40/336237140.db2.gz UQEIURXSNCDZGH-UHFFFAOYSA-N 1 2 307.328 4.370 20 0 DIADLO C[N@H+](Cc1ccccc1)Cc1ccc(F)cc1Br ZINC000042229601 336239275 /nfs/dbraw/zinc/23/92/75/336239275.db2.gz FXUMNEYCBGZWTQ-UHFFFAOYSA-N 1 2 308.194 4.220 20 0 DIADLO C[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1Br ZINC000042229601 336239276 /nfs/dbraw/zinc/23/92/76/336239276.db2.gz FXUMNEYCBGZWTQ-UHFFFAOYSA-N 1 2 308.194 4.220 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1cc(Cl)ccc1F ZINC000103965427 336243191 /nfs/dbraw/zinc/24/31/91/336243191.db2.gz NQHFMHJQQZMIAG-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO CCOCCC1(CNc2cc(C(F)(F)F)cc[nH+]2)CCCC1 ZINC000532365093 336244410 /nfs/dbraw/zinc/24/44/10/336244410.db2.gz PCVXRDLYGNCLSV-UHFFFAOYSA-N 1 2 316.367 4.499 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C3CC(c4cccc(F)c4)C3)cc2[nH+]1 ZINC000532440098 336247373 /nfs/dbraw/zinc/24/73/73/336247373.db2.gz QKKZDIJVLRBKAR-UHFFFAOYSA-N 1 2 323.371 4.143 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc2nc(C(C)C)sc2c1 ZINC000417967112 336249483 /nfs/dbraw/zinc/24/94/83/336249483.db2.gz KGACDCKUVNZLTP-UHFFFAOYSA-N 1 2 300.431 4.248 20 0 DIADLO C[C@H]([NH2+]Cc1ccn[nH]1)c1ccc(-c2ccc(F)cc2)s1 ZINC000532515274 336253100 /nfs/dbraw/zinc/25/31/00/336253100.db2.gz HKPYYIUMWYQKAE-NSHDSACASA-N 1 2 301.390 4.128 20 0 DIADLO CC(C)c1nc(C[N@H+](Cc2cccc(F)c2)C2CCCC2)no1 ZINC000532652485 336265915 /nfs/dbraw/zinc/26/59/15/336265915.db2.gz FPBRDCKLSRRXEC-UHFFFAOYSA-N 1 2 317.408 4.277 20 0 DIADLO CC(C)c1nc(C[N@@H+](Cc2cccc(F)c2)C2CCCC2)no1 ZINC000532652485 336265916 /nfs/dbraw/zinc/26/59/16/336265916.db2.gz FPBRDCKLSRRXEC-UHFFFAOYSA-N 1 2 317.408 4.277 20 0 DIADLO C[C@H](CC(=O)Nc1ccc2[nH]c(C(C)(C)C)[nH+]c2c1)n1cccc1 ZINC000526999876 336278931 /nfs/dbraw/zinc/27/89/31/336278931.db2.gz BHOCNKDGOALAEH-CYBMUJFWSA-N 1 2 324.428 4.252 20 0 DIADLO CSc1ccc(C[NH2+][C@@H](c2nc(C3CC3)no2)C(C)C)s1 ZINC000352849625 336279008 /nfs/dbraw/zinc/27/90/08/336279008.db2.gz XKVAJUJPRUBGFG-CYBMUJFWSA-N 1 2 323.487 4.217 20 0 DIADLO COCC[N@H+](Cc1cccs1)Cc1cc(F)ccc1Cl ZINC000527074311 336282637 /nfs/dbraw/zinc/28/26/37/336282637.db2.gz ZAHVVKHRBGKTTA-UHFFFAOYSA-N 1 2 313.825 4.189 20 0 DIADLO COCC[N@@H+](Cc1cccs1)Cc1cc(F)ccc1Cl ZINC000527074311 336282638 /nfs/dbraw/zinc/28/26/38/336282638.db2.gz ZAHVVKHRBGKTTA-UHFFFAOYSA-N 1 2 313.825 4.189 20 0 DIADLO CCc1ccccc1C[N@H+](C)Cc1nccn1Cc1ccccc1 ZINC000527075233 336282672 /nfs/dbraw/zinc/28/26/72/336282672.db2.gz VSPSFSHCYPVTLG-UHFFFAOYSA-N 1 2 319.452 4.126 20 0 DIADLO CCc1ccccc1C[N@@H+](C)Cc1nccn1Cc1ccccc1 ZINC000527075233 336282673 /nfs/dbraw/zinc/28/26/73/336282673.db2.gz VSPSFSHCYPVTLG-UHFFFAOYSA-N 1 2 319.452 4.126 20 0 DIADLO CC(C)COC[C@@H]([NH2+]Cc1ccc(F)cc1F)c1ccco1 ZINC000101597078 336283447 /nfs/dbraw/zinc/28/34/47/336283447.db2.gz DCMCTRWLRBXNLF-MRXNPFEDSA-N 1 2 309.356 4.061 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1ccc(F)cc1F)c1ccco1 ZINC000101597077 336283479 /nfs/dbraw/zinc/28/34/79/336283479.db2.gz DCMCTRWLRBXNLF-INIZCTEOSA-N 1 2 309.356 4.061 20 0 DIADLO COc1cc(CNc2cccc[nH+]2)ccc1OCc1ccccc1 ZINC000019778417 336283555 /nfs/dbraw/zinc/28/35/55/336283555.db2.gz GCNJVEPXYRXBFH-UHFFFAOYSA-N 1 2 320.392 4.281 20 0 DIADLO CC(C)c1nc2n(n1)CCC[C@H]2[NH2+][C@@H](C)c1cc2ccccc2o1 ZINC000168037329 336285710 /nfs/dbraw/zinc/28/57/10/336285710.db2.gz OBSSVFVEXKTAJB-DZGCQCFKSA-N 1 2 324.428 4.333 20 0 DIADLO c1cn(-c2ccc(CNc3ccc4ccccc4n3)cc2)c[nH+]1 ZINC000301079037 336288789 /nfs/dbraw/zinc/28/87/89/336288789.db2.gz IEVRRHNRXIRKBF-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO CC1CCN(c2ccc(CNc3nc4ccccc4o3)c[nH+]2)CC1 ZINC000301089356 336289425 /nfs/dbraw/zinc/28/94/25/336289425.db2.gz KLYJQWVTRLAWMF-UHFFFAOYSA-N 1 2 322.412 4.071 20 0 DIADLO Cc1cc(Nc2ccc(NC(=O)C(C)C)cc2)nc(C(C)C)[nH+]1 ZINC000301098768 336289889 /nfs/dbraw/zinc/28/98/89/336289889.db2.gz XEPNAPHHDWZYRG-UHFFFAOYSA-N 1 2 312.417 4.247 20 0 DIADLO Cc1ccc([C@H](C)Nc2cc(C)[nH+]c(-c3cccnc3)n2)cc1 ZINC000301101972 336290110 /nfs/dbraw/zinc/29/01/10/336290110.db2.gz LDCDMTFPQCLOOZ-HNNXBMFYSA-N 1 2 304.397 4.329 20 0 DIADLO Cc1cc(NCCSc2ccccc2)nc(-c2cccnc2)[nH+]1 ZINC000301128063 336291317 /nfs/dbraw/zinc/29/13/17/336291317.db2.gz XQMSBSUVDFSABJ-UHFFFAOYSA-N 1 2 322.437 4.051 20 0 DIADLO Cc1cc(NCc2cccc(OC(F)F)c2)nc(C(C)C)[nH+]1 ZINC000301127902 336291323 /nfs/dbraw/zinc/29/13/23/336291323.db2.gz VQVRNYAUXDBNMO-UHFFFAOYSA-N 1 2 307.344 4.122 20 0 DIADLO CCc1ccc(CNc2cc(C)[nH+]c(-c3cccnc3)n2)s1 ZINC000301128097 336291394 /nfs/dbraw/zinc/29/13/94/336291394.db2.gz XTBVHTCBFWIMEX-UHFFFAOYSA-N 1 2 310.426 4.083 20 0 DIADLO CCc1cc(NCc2ccc(Cl)cc2)nc(-c2ccncc2)[nH+]1 ZINC000301164317 336292789 /nfs/dbraw/zinc/29/27/89/336292789.db2.gz HKEVXBVGYNDOOX-UHFFFAOYSA-N 1 2 324.815 4.367 20 0 DIADLO CC(C)Oc1ccc(CNc2cccc[nH+]2)c(C(F)(F)F)c1 ZINC000301189810 336294029 /nfs/dbraw/zinc/29/40/29/336294029.db2.gz RBAURMUIDNRWRX-UHFFFAOYSA-N 1 2 310.319 4.500 20 0 DIADLO Cc1ccc2[nH+]cc(/C=C/c3ncc(Br)s3)n2c1 ZINC000193050939 336295457 /nfs/dbraw/zinc/29/54/57/336295457.db2.gz DQHXSSWUTXFYEY-HWKANZROSA-N 1 2 320.215 4.032 20 0 DIADLO CCc1cccc2c(C3CCN(c4cc(C)[nH+]cn4)CC3)c[nH]c21 ZINC000301233784 336295949 /nfs/dbraw/zinc/29/59/49/336295949.db2.gz JCMWXAXXIUECNV-UHFFFAOYSA-N 1 2 320.440 4.213 20 0 DIADLO Cc1cc(N2CCC(C(C)(C)C)CC2)nc(-c2ccncc2)[nH+]1 ZINC000301315129 336300370 /nfs/dbraw/zinc/30/03/70/336300370.db2.gz LWXARBOHWZFIOG-UHFFFAOYSA-N 1 2 310.445 4.110 20 0 DIADLO CCc1cc(Nc2ccc(NC(=O)CC(C)C)cc2)nc(C)[nH+]1 ZINC000301370007 336302941 /nfs/dbraw/zinc/30/29/41/336302941.db2.gz URVONWXYWANEPK-UHFFFAOYSA-N 1 2 312.417 4.076 20 0 DIADLO Cc1ccc(C[C@H](C)Nc2cc(C)[nH+]c(-c3cccnc3)n2)s1 ZINC000301384710 336303832 /nfs/dbraw/zinc/30/38/32/336303832.db2.gz VCTXSIKOZTWANX-LBPRGKRZSA-N 1 2 324.453 4.260 20 0 DIADLO Cc1csc([C@H]2CCCN(c3cc(C)[nH+]c(C(C)C)n3)C2)n1 ZINC000301409113 336304841 /nfs/dbraw/zinc/30/48/41/336304841.db2.gz NVJFWDPRPXBCGF-AWEZNQCLSA-N 1 2 316.474 4.057 20 0 DIADLO Cc1cc(NC[C@H]2CCO[C@@H]2c2ccccc2)nc(C(C)C)[nH+]1 ZINC000301429757 336306182 /nfs/dbraw/zinc/30/61/82/336306182.db2.gz PZOLRFUYDGBLNW-SJLPKXTDSA-N 1 2 311.429 4.098 20 0 DIADLO c1cncc(-c2ccc(CNc3cc[nH+]c(C4CC4)n3)cc2)c1 ZINC000301431487 336306314 /nfs/dbraw/zinc/30/63/14/336306314.db2.gz JAKPHROBCKDAKO-UHFFFAOYSA-N 1 2 302.381 4.028 20 0 DIADLO Cc1ccc(-c2nc(CNc3cc(C)[nH+]c(C(C)C)n3)co2)cc1 ZINC000301446313 336307302 /nfs/dbraw/zinc/30/73/02/336307302.db2.gz YJFHQWJYZUNMQQ-UHFFFAOYSA-N 1 2 322.412 4.484 20 0 DIADLO Cc1cc(N[C@@H](C)c2cccc(-n3ccnc3)c2)nc(C(C)C)[nH+]1 ZINC000301457650 336308008 /nfs/dbraw/zinc/30/80/08/336308008.db2.gz IBBMPBQHZZPWSB-HNNXBMFYSA-N 1 2 321.428 4.267 20 0 DIADLO CC(C)Oc1ccc(CNc2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000301520811 336312102 /nfs/dbraw/zinc/31/21/02/336312102.db2.gz NFIZXLKHTICGQZ-UHFFFAOYSA-N 1 2 310.319 4.500 20 0 DIADLO Cc1ccccc1[C@H]1CCCN1c1cc(N2CCCCC2)[nH+]cn1 ZINC000301529091 336312785 /nfs/dbraw/zinc/31/27/85/336312785.db2.gz OOBNOAWKBZMNBY-GOSISDBHSA-N 1 2 322.456 4.117 20 0 DIADLO Cc1ccccc1[C@H]1CCCN1c1cc(N2CCCCC2)nc[nH+]1 ZINC000301529091 336312786 /nfs/dbraw/zinc/31/27/86/336312786.db2.gz OOBNOAWKBZMNBY-GOSISDBHSA-N 1 2 322.456 4.117 20 0 DIADLO COc1ccccc1[C@H]1CCN(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000301538125 336313293 /nfs/dbraw/zinc/31/32/93/336313293.db2.gz UNLPHUQNRHZKKI-LBPRGKRZSA-N 1 2 322.330 4.103 20 0 DIADLO COc1ccccc1[C@H]1CCCN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000301550239 336314206 /nfs/dbraw/zinc/31/42/06/336314206.db2.gz QILCNJQNCSLIJE-CQSZACIVSA-N 1 2 322.330 4.451 20 0 DIADLO c1ccc(COC[C@@H](Nc2cccc[nH+]2)c2ccccc2)cc1 ZINC000301557026 336314669 /nfs/dbraw/zinc/31/46/69/336314669.db2.gz HVCBQCANAZIJAF-LJQANCHMSA-N 1 2 304.393 4.452 20 0 DIADLO Clc1ccc(C2=CCN(c3cc[nH+]c(C4CC4)n3)CC2)cc1 ZINC000301584384 336316550 /nfs/dbraw/zinc/31/65/50/336316550.db2.gz QSASYKVNQOKQQO-UHFFFAOYSA-N 1 2 311.816 4.301 20 0 DIADLO C[C@@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1ccccc1-n1cccn1 ZINC000301622605 336318885 /nfs/dbraw/zinc/31/88/85/336318885.db2.gz FVTAUJWKMYHUEY-CQSZACIVSA-N 1 2 321.428 4.133 20 0 DIADLO Cc1cc(N2CCC[C@H]2c2nc3ccccc3[nH]2)nc(C(C)C)[nH+]1 ZINC000301633546 336319616 /nfs/dbraw/zinc/31/96/16/336319616.db2.gz JZIZKZCNQUIVOE-INIZCTEOSA-N 1 2 321.428 4.126 20 0 DIADLO CC(C)[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1ccc(F)cc1F ZINC000301639334 336319953 /nfs/dbraw/zinc/31/99/53/336319953.db2.gz MRDRQFBTQVCUKW-MRXNPFEDSA-N 1 2 303.356 4.441 20 0 DIADLO Cc1csc([C@H](Nc2cc(C)[nH+]c(C(C)C)n2)C2CC2)n1 ZINC000301647996 336320661 /nfs/dbraw/zinc/32/06/61/336320661.db2.gz IQHSAIOKZHSSKY-CQSZACIVSA-N 1 2 302.447 4.237 20 0 DIADLO Cc1nc(CCNc2cc(C)[nH+]c3c(F)cccc23)cs1 ZINC000301651724 336320843 /nfs/dbraw/zinc/32/08/43/336320843.db2.gz GJLLOYKHVITHLQ-UHFFFAOYSA-N 1 2 301.390 4.102 20 0 DIADLO Cc1nc(CNc2cc(C)[nH+]cn2)oc1-c1ccc(Cl)cc1 ZINC000301689350 336323586 /nfs/dbraw/zinc/32/35/86/336323586.db2.gz XZMXFAFSPJTTBG-UHFFFAOYSA-N 1 2 314.776 4.014 20 0 DIADLO COc1ccc(CNc2cc[nH+]c(C(C)(C)C)n2)cc1Cl ZINC000301698087 336324110 /nfs/dbraw/zinc/32/41/10/336324110.db2.gz CXZFLDFKIDYXOB-UHFFFAOYSA-N 1 2 305.809 4.048 20 0 DIADLO CC(=O)Nc1ccc(CCNc2[nH+]c3ccccc3cc2C)cc1 ZINC000301705252 336324613 /nfs/dbraw/zinc/32/46/13/336324613.db2.gz GCWJZKJHZYESKI-UHFFFAOYSA-N 1 2 319.408 4.156 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NC[C@H]2[C@@H]3c4ccccc4C[C@H]23)c1 ZINC000301710208 336324897 /nfs/dbraw/zinc/32/48/97/336324897.db2.gz USGLHMPYRVEQRL-IIAWOOMASA-N 1 2 304.315 4.098 20 0 DIADLO C[C@@H](C[C@@H](O)c1ccc(F)cc1)Nc1ccc2ccccc2[nH+]1 ZINC000301750754 336327699 /nfs/dbraw/zinc/32/76/99/336327699.db2.gz ULCWUSQSGRAYKL-SCLBCKFNSA-N 1 2 310.372 4.298 20 0 DIADLO CCOc1cc(Cl)ccc1CNc1cc[nH+]c(C2CC2)n1 ZINC000301756937 336328011 /nfs/dbraw/zinc/32/80/11/336328011.db2.gz AIGLSPGXIVMTFH-UHFFFAOYSA-N 1 2 303.793 4.018 20 0 DIADLO O[C@@H](c1ccccc1)C1(CNc2ccc3ccccc3[nH+]2)CC1 ZINC000301791286 336330238 /nfs/dbraw/zinc/33/02/38/336330238.db2.gz NQRUVKBRCMSLGR-IBGZPJMESA-N 1 2 304.393 4.161 20 0 DIADLO Clc1ccccc1OC[C@@H]1CCCN(c2cccc[nH+]2)C1 ZINC000301797725 336330560 /nfs/dbraw/zinc/33/05/60/336330560.db2.gz ARUCZXYKQQBAEN-CQSZACIVSA-N 1 2 302.805 4.030 20 0 DIADLO CC(C)c1cc(NC[C@H](O)c2ccc(F)cc2)nc(C(C)C)[nH+]1 ZINC000301810797 336331558 /nfs/dbraw/zinc/33/15/58/336331558.db2.gz GWBCIDKERHMBNY-INIZCTEOSA-N 1 2 317.408 4.008 20 0 DIADLO Cc1c[nH+]ccc1CCNc1nc(-c2ccc(F)cc2)cs1 ZINC000301816202 336331974 /nfs/dbraw/zinc/33/19/74/336331974.db2.gz DNCWQSYABYXHJB-UHFFFAOYSA-N 1 2 313.401 4.307 20 0 DIADLO CCc1nc2sccc2c(Oc2cccc(-n3cc[nH+]c3)c2)n1 ZINC000301827651 336332721 /nfs/dbraw/zinc/33/27/21/336332721.db2.gz FSHZQSYLHJOHGD-UHFFFAOYSA-N 1 2 322.393 4.232 20 0 DIADLO CC(C)c1cc(NC[C@](C)(O)c2cccs2)nc(C(C)C)[nH+]1 ZINC000301854684 336334392 /nfs/dbraw/zinc/33/43/92/336334392.db2.gz HOTWYRQYHFCOJE-KRWDZBQOSA-N 1 2 319.474 4.105 20 0 DIADLO C[C@@H](Nc1[nH+]cnc2c1cnn2C(C)(C)C)[C@H](C)c1ccccc1 ZINC000301891150 336336631 /nfs/dbraw/zinc/33/66/31/336336631.db2.gz OBTSYFMNAWJFPQ-UONOGXRCSA-N 1 2 323.444 4.185 20 0 DIADLO Cc1cc([NH+]2CCCC2)ccc1Nc1nc(C2CC2)ns1 ZINC000301931633 336338596 /nfs/dbraw/zinc/33/85/96/336338596.db2.gz OGPHHBSHCPQDAI-UHFFFAOYSA-N 1 2 300.431 4.068 20 0 DIADLO c1ccc([C@@H]2CCc3nc(CNc4cccc[nH+]4)sc3C2)cc1 ZINC000301940313 336339049 /nfs/dbraw/zinc/33/90/49/336339049.db2.gz VWMHETBSJODPBO-OAHLLOKOSA-N 1 2 321.449 4.423 20 0 DIADLO CC(C)c1nc(N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)cc[nH+]1 ZINC000301992912 336341881 /nfs/dbraw/zinc/34/18/81/336341881.db2.gz OCKYZPJQRBUMEU-GDBMZVCRSA-N 1 2 317.820 4.196 20 0 DIADLO CC(C)c1nc(N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)cc[nH+]1 ZINC000301992915 336341974 /nfs/dbraw/zinc/34/19/74/336341974.db2.gz OCKYZPJQRBUMEU-ZBFHGGJFSA-N 1 2 317.820 4.196 20 0 DIADLO CC[C@@H](Nc1nc(C)[nH+]c2c1CCCC2)c1nc2ccccc2[nH]1 ZINC000302063164 336346405 /nfs/dbraw/zinc/34/64/05/336346405.db2.gz UQHUYJHLWODSKT-CQSZACIVSA-N 1 2 321.428 4.103 20 0 DIADLO Cc1csc([C@@H](C)CNc2cc(C(F)(F)F)cc[nH+]2)n1 ZINC000302134960 336350197 /nfs/dbraw/zinc/35/01/97/336350197.db2.gz LYUGCFWTBLBUHV-QMMMGPOBSA-N 1 2 301.337 4.081 20 0 DIADLO Cc1cc(NCc2nc3ccccc3n2C2CC2)nc(C(C)C)[nH+]1 ZINC000302136605 336350293 /nfs/dbraw/zinc/35/02/93/336350293.db2.gz BLAOVWFTTBJJNF-UHFFFAOYSA-N 1 2 321.428 4.205 20 0 DIADLO C[C@@](O)(CNc1ccc2ccccc2[nH+]1)c1ccccc1Cl ZINC000302150307 336350981 /nfs/dbraw/zinc/35/09/81/336350981.db2.gz BHGFNFJYXBTQSP-GOSISDBHSA-N 1 2 312.800 4.208 20 0 DIADLO Cc1cc(NCc2c(OC(C)C)ccc3ccccc32)nc[nH+]1 ZINC000302211542 336354113 /nfs/dbraw/zinc/35/41/13/336354113.db2.gz MRBPMLSPHYBXFB-UHFFFAOYSA-N 1 2 307.397 4.338 20 0 DIADLO COc1cccc2c(NCc3ccc(OC(C)C)nc3)cc[nH+]c12 ZINC000302388048 336357997 /nfs/dbraw/zinc/35/79/97/336357997.db2.gz BCHVIHKIDYUBPW-UHFFFAOYSA-N 1 2 323.396 4.038 20 0 DIADLO COCc1ccc(CNc2cc[nH+]c3c(OC)cccc23)cc1 ZINC000302462678 336359141 /nfs/dbraw/zinc/35/91/41/336359141.db2.gz RVSRMWCNJXFBKH-UHFFFAOYSA-N 1 2 308.381 4.002 20 0 DIADLO COc1cccc2c(N[C@H](C)c3nc4ccccc4[nH]3)cc[nH+]c12 ZINC000302462620 336359207 /nfs/dbraw/zinc/35/92/07/336359207.db2.gz RSXLOLLVGAJQPV-GFCCVEGCSA-N 1 2 318.380 4.293 20 0 DIADLO CCn1c2ccccc2nc1[C@H](C)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000302487037 336359769 /nfs/dbraw/zinc/35/97/69/336359769.db2.gz ZCMKOOVNYOOTSF-AWEZNQCLSA-N 1 2 323.444 4.451 20 0 DIADLO CC(C)c1nc(NC[C@H](c2ccccc2)C(F)(F)F)cc[nH+]1 ZINC000302497466 336360114 /nfs/dbraw/zinc/36/01/14/336360114.db2.gz UTEWXEJSPQMSMC-CYBMUJFWSA-N 1 2 309.335 4.358 20 0 DIADLO CC(C)C[C@@H]1OCCC[C@H]1Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000302507415 336360340 /nfs/dbraw/zinc/36/03/40/336360340.db2.gz WMSUDWACYDMLJO-OLZOCXBDSA-N 1 2 302.340 4.106 20 0 DIADLO CC(C)C[C@H]1OCCC[C@@H]1Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000302507416 336360382 /nfs/dbraw/zinc/36/03/82/336360382.db2.gz WMSUDWACYDMLJO-QWHCGFSZSA-N 1 2 302.340 4.106 20 0 DIADLO COc1cccc2c(N3C[C@H](C)C[C@H]3c3cccnc3)cc[nH+]c12 ZINC000302523731 336360825 /nfs/dbraw/zinc/36/08/25/336360825.db2.gz JJXHLECGOACUMA-KDOFPFPSSA-N 1 2 319.408 4.226 20 0 DIADLO CCN(CC)c1ccc(CNc2ccnc3c(F)cccc23)c[nH+]1 ZINC000302636703 336363140 /nfs/dbraw/zinc/36/31/40/336363140.db2.gz DCMKHHXPSVQFEY-UHFFFAOYSA-N 1 2 324.403 4.227 20 0 DIADLO Cc1ccc(NC(=O)N[C@H](C)c2c(F)cccc2Cl)c(C)[nH+]1 ZINC000152433111 336363441 /nfs/dbraw/zinc/36/34/41/336363441.db2.gz ILCWRQVOEJAEGV-LLVKDONJSA-N 1 2 321.783 4.374 20 0 DIADLO COc1ccc2[nH+]c(N[C@H]3CCOc4c(F)cccc43)ccc2c1 ZINC000302667421 336364170 /nfs/dbraw/zinc/36/41/70/336364170.db2.gz MWZXDKGMXZMDAM-KRWDZBQOSA-N 1 2 324.355 4.318 20 0 DIADLO Cc1cc(N2CC3(CCOCC3)c3ccccc32)nc(C(C)C)[nH+]1 ZINC000302698557 336365415 /nfs/dbraw/zinc/36/54/15/336365415.db2.gz HIUILVMHOICJIL-UHFFFAOYSA-N 1 2 323.440 4.108 20 0 DIADLO CC(C)c1nc(N2CC[C@H](C(F)(F)F)C(C)(C)C2)cc[nH+]1 ZINC000302701443 336365647 /nfs/dbraw/zinc/36/56/47/336365647.db2.gz IBJFOFKLHZCYBD-NSHDSACASA-N 1 2 301.356 4.015 20 0 DIADLO CC(C)c1nc(N(C)CCc2nccs2)cc(C(C)(C)C)[nH+]1 ZINC000302775313 336368523 /nfs/dbraw/zinc/36/85/23/336368523.db2.gz OOQITUQMZVASKY-UHFFFAOYSA-N 1 2 318.490 4.033 20 0 DIADLO Cc1ccnc([C@H](Nc2cc(C)[nH+]c3c(F)cccc23)C2CC2)n1 ZINC000302805712 336370055 /nfs/dbraw/zinc/37/00/55/336370055.db2.gz FSRADUFSFINIRR-QGZVFWFLSA-N 1 2 322.387 4.344 20 0 DIADLO C[C@@H](Nc1nc[nH+]c(N)c1Cl)c1cccc(Cl)c1Cl ZINC000302883896 336373108 /nfs/dbraw/zinc/37/31/08/336373108.db2.gz JVYXXFIQSJIPHQ-ZCFIWIBFSA-N 1 2 317.607 4.192 20 0 DIADLO C[C@@H](Nc1[nH+]cnc(N)c1Cl)c1cccc(Cl)c1Cl ZINC000302883896 336373109 /nfs/dbraw/zinc/37/31/09/336373109.db2.gz JVYXXFIQSJIPHQ-ZCFIWIBFSA-N 1 2 317.607 4.192 20 0 DIADLO CC(C)c1nc(N(C)[C@@H](C)c2cccnc2)cc(C(C)(C)C)[nH+]1 ZINC000302901172 336373777 /nfs/dbraw/zinc/37/37/77/336373777.db2.gz QQDIKYTXLNZREM-AWEZNQCLSA-N 1 2 312.461 4.490 20 0 DIADLO Cc1ccc(CNC(=O)c2cccc(Oc3cc[nH+]cc3)c2)cc1 ZINC000352900635 336375330 /nfs/dbraw/zinc/37/53/30/336375330.db2.gz NRTIGVKFBHWOOV-UHFFFAOYSA-N 1 2 318.376 4.112 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ncc(CSC)s1 ZINC000352926993 336377610 /nfs/dbraw/zinc/37/76/10/336377610.db2.gz SIZLQHUWUMXBFU-OAHLLOKOSA-N 1 2 318.511 4.343 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1ncc(CSC)s1 ZINC000352926993 336377611 /nfs/dbraw/zinc/37/76/11/336377611.db2.gz SIZLQHUWUMXBFU-OAHLLOKOSA-N 1 2 318.511 4.343 20 0 DIADLO CCc1nc(C[N@H+]2CC=C(c3cccc(OC)c3)CC2)cs1 ZINC000352948198 336378786 /nfs/dbraw/zinc/37/87/86/336378786.db2.gz RLTQVFFJZFFJHY-UHFFFAOYSA-N 1 2 314.454 4.003 20 0 DIADLO CCc1nc(C[N@@H+]2CC=C(c3cccc(OC)c3)CC2)cs1 ZINC000352948198 336378787 /nfs/dbraw/zinc/37/87/87/336378787.db2.gz RLTQVFFJZFFJHY-UHFFFAOYSA-N 1 2 314.454 4.003 20 0 DIADLO Cc1nc(N(Cc2cccc(-c3cccnc3)c2)C2CC2)cc[nH+]1 ZINC000152453192 336386859 /nfs/dbraw/zinc/38/68/59/336386859.db2.gz CCGYBCRSQVYIFO-UHFFFAOYSA-N 1 2 316.408 4.016 20 0 DIADLO Cc1cc(N[C@@H]2CCc3ccc(F)cc32)nc(-c2cccnc2)[nH+]1 ZINC000106477401 336390113 /nfs/dbraw/zinc/39/01/13/336390113.db2.gz CFMUMLXKEQXZOI-QGZVFWFLSA-N 1 2 320.371 4.086 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Br)o1)c1ccc(F)cc1F ZINC000035010810 336390674 /nfs/dbraw/zinc/39/06/74/336390674.db2.gz XJXAGBYUBZJDJP-MRVPVSSYSA-N 1 2 316.145 4.171 20 0 DIADLO Cn1c[nH+]cc1CNc1ccc(Oc2ccc(Cl)cc2)cc1 ZINC000353065047 336392217 /nfs/dbraw/zinc/39/22/17/336392217.db2.gz ZHFLUDBRUVTQIO-UHFFFAOYSA-N 1 2 313.788 4.478 20 0 DIADLO Cc1[nH]c(CN[C@@H](c2ccccc2F)C2CCCC2)[nH+]c1C ZINC000582252636 336395243 /nfs/dbraw/zinc/39/52/43/336395243.db2.gz NEKPOCIMBIMRJY-GOSISDBHSA-N 1 2 301.409 4.187 20 0 DIADLO Fc1cccc2c1SCC[C@H]2Nc1cc[nH+]c(C2CC2)n1 ZINC000110124228 336395764 /nfs/dbraw/zinc/39/57/64/336395764.db2.gz ALLIAQXZWKCHLF-CYBMUJFWSA-N 1 2 301.390 4.142 20 0 DIADLO Clc1ccc2[nH]c3c(c2c1)CN(c1cc[nH+]c(C2CC2)n1)CC3 ZINC000110238827 336396019 /nfs/dbraw/zinc/39/60/19/336396019.db2.gz FTKDGAQDJYGOIS-UHFFFAOYSA-N 1 2 324.815 4.051 20 0 DIADLO CCn1c2ccccc2nc1[C@@H](C)Nc1cc[nH+]c(C(C)C)n1 ZINC000110334118 336396159 /nfs/dbraw/zinc/39/61/59/336396159.db2.gz ZHZYGXOBDCGNJI-CYBMUJFWSA-N 1 2 309.417 4.143 20 0 DIADLO COCc1cnc(C[NH2+][C@H](C)c2cc3cccc(F)c3o2)s1 ZINC000353191764 336406060 /nfs/dbraw/zinc/40/60/60/336406060.db2.gz KPQHMYMNQREXTB-SNVBAGLBSA-N 1 2 320.389 4.026 20 0 DIADLO c1c2ccccc2oc1[C@H]([NH2+]Cc1cccnc1)c1cccnc1 ZINC000353338849 336412537 /nfs/dbraw/zinc/41/25/37/336412537.db2.gz VEILCIOVKYMMFL-HXUWFJFHSA-N 1 2 315.376 4.102 20 0 DIADLO CCOCc1nc([C@H](C)[NH2+][C@H](CC)c2ccc(Cl)cc2)no1 ZINC000353608210 336428429 /nfs/dbraw/zinc/42/84/29/336428429.db2.gz HWBJIJYSXWUOEX-SMDDNHRTSA-N 1 2 323.824 4.061 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+][C@@H](C)c2nc(-c3ccncc3)cs2)c1 ZINC000353617051 336429101 /nfs/dbraw/zinc/42/91/01/336429101.db2.gz CPSLPKDNHWSOND-KBPBESRZSA-N 1 2 324.453 4.320 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nccn1C)C1CC1)c1ccc(F)cc1Cl ZINC000353879755 336445568 /nfs/dbraw/zinc/44/55/68/336445568.db2.gz IDORXMMYVVHVMO-BMIGLBTASA-N 1 2 307.800 4.015 20 0 DIADLO FC(F)Oc1cccc(CNc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000355336221 336504550 /nfs/dbraw/zinc/50/45/50/336504550.db2.gz OYFAHFHBWSVOJJ-UHFFFAOYSA-N 1 2 315.323 4.086 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@@H]2COCc3ccccc32)c(Cl)c1 ZINC000418107708 336523783 /nfs/dbraw/zinc/52/37/83/336523783.db2.gz PRFRNGUTYNDVNB-QGZVFWFLSA-N 1 2 305.780 4.149 20 0 DIADLO FC(F)(F)c1cscc1CN1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000356192328 336540262 /nfs/dbraw/zinc/54/02/62/336540262.db2.gz LDPWBLJDEUXNEN-GFCCVEGCSA-N 1 2 315.364 4.217 20 0 DIADLO C[C@@H]1CCC[C@@H](c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)C1 ZINC000356229581 336541951 /nfs/dbraw/zinc/54/19/51/336541951.db2.gz YXGFTBVZTFPDNW-ZIAGYGMSSA-N 1 2 308.385 4.216 20 0 DIADLO COCCSc1ccc([C@@H](C)[NH2+][C@H](C)c2ncc(C)o2)cc1 ZINC000356273045 336543696 /nfs/dbraw/zinc/54/36/96/336543696.db2.gz QSHATBCDMGWLGT-ZIAGYGMSSA-N 1 2 320.458 4.133 20 0 DIADLO C[C@H](CC1CCCCC1)C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000114322296 336551842 /nfs/dbraw/zinc/55/18/42/336551842.db2.gz MDMYKAXNJCEPLP-GDBMZVCRSA-N 1 2 303.450 4.070 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCC(=O)Nc1ccsc1Cl ZINC000356895793 336565297 /nfs/dbraw/zinc/56/52/97/336565297.db2.gz UWLCYXGQKHVQNA-UHFFFAOYSA-N 1 2 319.817 4.088 20 0 DIADLO Fc1cccc(OCC[NH+](Cc2ccco2)Cc2ccco2)c1 ZINC000357324737 336580648 /nfs/dbraw/zinc/58/06/48/336580648.db2.gz RIXKZRCETCEEBM-UHFFFAOYSA-N 1 2 315.344 4.093 20 0 DIADLO COCc1cc(N2CC3(CCC3)C[C@@H]2C)c2cc(F)ccc2[nH+]1 ZINC000357669226 336593771 /nfs/dbraw/zinc/59/37/71/336593771.db2.gz XMRYQFIGTYJEDA-ZDUSSCGKSA-N 1 2 314.404 4.289 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000357786086 336598348 /nfs/dbraw/zinc/59/83/48/336598348.db2.gz VEACCKTUTFIRSY-YOEHRIQHSA-N 1 2 309.438 4.287 20 0 DIADLO CC1(C)C[C@@H]1NC(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000358192019 336616056 /nfs/dbraw/zinc/61/60/56/336616056.db2.gz YRRHTSSLQYLYON-HNNXBMFYSA-N 1 2 316.788 4.056 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc3ccccc3n2)s1 ZINC000358282176 336621106 /nfs/dbraw/zinc/62/11/06/336621106.db2.gz BNWBZYQHWXOERY-LBPRGKRZSA-N 1 2 312.442 4.061 20 0 DIADLO CCCOc1ccc([C@H](C)[NH2+]Cc2nnc(C(C)C)s2)cc1 ZINC000358300412 336622666 /nfs/dbraw/zinc/62/26/66/336622666.db2.gz OYJTVCPVQQUXLC-ZDUSSCGKSA-N 1 2 319.474 4.301 20 0 DIADLO CC(C)Sc1ccc(C(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC000358792051 336643326 /nfs/dbraw/zinc/64/33/26/336643326.db2.gz QJKSWFVSDZRTDP-UHFFFAOYSA-N 1 2 311.410 4.087 20 0 DIADLO CC[C@@H](C)CC(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000359184216 336662021 /nfs/dbraw/zinc/66/20/21/336662021.db2.gz HWNSGHAYOSCPGS-CQSZACIVSA-N 1 2 311.429 4.261 20 0 DIADLO Cc1cc(C)cc(NC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000359270268 336665170 /nfs/dbraw/zinc/66/51/70/336665170.db2.gz MWUMJAHSRXRLRQ-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO C[C@H]([NH2+][C@H](c1nccn1C)c1ccc(F)cc1)c1cccs1 ZINC000359729122 336685408 /nfs/dbraw/zinc/68/54/08/336685408.db2.gz JPLVFJWQBQUUOE-LRDDRELGSA-N 1 2 315.417 4.061 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ccsc1Cl)c1nc(C2CC2)no1 ZINC000359767455 336687138 /nfs/dbraw/zinc/68/71/38/336687138.db2.gz PTDLHKITKRJFSD-LLVKDONJSA-N 1 2 311.838 4.149 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)N1CC[C@H](C2CC2)C1 ZINC000360852980 336724510 /nfs/dbraw/zinc/72/45/10/336724510.db2.gz WPXFIVRRZSFZGS-HNNXBMFYSA-N 1 2 323.396 4.138 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2nccs2)c2ccccc2)cc(C)c1O ZINC000367373136 336730087 /nfs/dbraw/zinc/73/00/87/336730087.db2.gz WHQWPIBPBNEIRS-KRWDZBQOSA-N 1 2 324.449 4.345 20 0 DIADLO CCc1cnccc1[C@H](C)[NH2+][C@@H](C)c1nnc(-c2ccccc2)o1 ZINC000361118256 336739442 /nfs/dbraw/zinc/73/94/42/336739442.db2.gz APFFGFSTZOJAGW-KBPBESRZSA-N 1 2 322.412 4.106 20 0 DIADLO CCO[C@H](C)c1nc(C[NH2+][C@H](C)c2ccncc2CC)cs1 ZINC000361119751 336739558 /nfs/dbraw/zinc/73/95/58/336739558.db2.gz MFZVNQOWYJPQSM-CHWSQXEVSA-N 1 2 319.474 4.049 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@H]2CCOc3c(F)ccc(F)c32)o1 ZINC000361190121 336743601 /nfs/dbraw/zinc/74/36/01/336743601.db2.gz YBEAMQYGFBLERZ-YGRLFVJLSA-N 1 2 307.340 4.295 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)CSCc1ccc(Cl)cc1 ZINC000362395068 336795572 /nfs/dbraw/zinc/79/55/72/336795572.db2.gz HEOIMNLJEUFRKX-UHFFFAOYSA-N 1 2 320.845 4.224 20 0 DIADLO Cc1ccc(C(=O)N2CCCC2(C)C)cc1Oc1cc[nH+]cc1 ZINC000115362505 336824115 /nfs/dbraw/zinc/82/41/15/336824115.db2.gz XPMCBZOEBOHZGL-UHFFFAOYSA-N 1 2 310.397 4.197 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+][C@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000367533672 336824515 /nfs/dbraw/zinc/82/45/15/336824515.db2.gz NKSMZIWSUWQHAM-FOIQADDNSA-N 1 2 321.399 4.364 20 0 DIADLO Cc1cc(NC[C@@H]2CCCO[C@H]2c2ccccc2)nc(C2CC2)[nH+]1 ZINC000116260293 336834963 /nfs/dbraw/zinc/83/49/63/336834963.db2.gz JVNDRNXBZNGUAJ-HKUYNNGSSA-N 1 2 323.440 4.242 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3CCC(F)(F)C3)c2)[nH+]c1C ZINC000369085051 336858187 /nfs/dbraw/zinc/85/81/87/336858187.db2.gz POQOZLCFXFJOAJ-ZDUSSCGKSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1cc(NC(=O)N(C)Cc2csc3ccccc23)cc[nH+]1 ZINC000119427605 336889628 /nfs/dbraw/zinc/88/96/28/336889628.db2.gz KVXYNTNHYGSZRP-UHFFFAOYSA-N 1 2 311.410 4.269 20 0 DIADLO CC1(C)CCC(c2noc(-c3cc(-n4cc[nH+]c4)ccn3)n2)CC1 ZINC000582293654 336891355 /nfs/dbraw/zinc/89/13/55/336891355.db2.gz QATNKDIWMXDALM-UHFFFAOYSA-N 1 2 323.400 4.001 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cc(C)c(C)s2)[nH+]1 ZINC000371247868 336898387 /nfs/dbraw/zinc/89/83/87/336898387.db2.gz RILGVBDYZFBLJR-UHFFFAOYSA-N 1 2 311.410 4.316 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)CSCCC(C)C)[nH+]1 ZINC000371246694 336898448 /nfs/dbraw/zinc/89/84/48/336898448.db2.gz GINAJVYLSGBLGO-UHFFFAOYSA-N 1 2 317.458 4.103 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)Cc2cc(C)ccc2C)[nH+]1 ZINC000371246956 336898515 /nfs/dbraw/zinc/89/85/15/336898515.db2.gz IXROYMRFIONFGG-UHFFFAOYSA-N 1 2 319.408 4.183 20 0 DIADLO CC1(C)CCC(CC(=O)N2CCCC[C@H]2c2[nH]cc[nH+]2)CC1 ZINC000120243128 336904847 /nfs/dbraw/zinc/90/48/47/336904847.db2.gz AUSKMPCMAVOKQX-HNNXBMFYSA-N 1 2 303.450 4.070 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccccn2)cs1 ZINC000372075150 336921401 /nfs/dbraw/zinc/92/14/01/336921401.db2.gz GCSIGKJPZXUJHG-FZKQIMNGSA-N 1 2 309.438 4.287 20 0 DIADLO CC(C)Oc1ccccc1C[NH2+]Cc1ncoc1-c1ccccc1 ZINC000372788348 336939593 /nfs/dbraw/zinc/93/95/93/336939593.db2.gz PEBKCIIYVBKRRY-UHFFFAOYSA-N 1 2 322.408 4.419 20 0 DIADLO C[C@H]1C[C@@H](CSCc2cn3cc(Cl)ccc3[nH+]2)CCO1 ZINC000485562178 336961763 /nfs/dbraw/zinc/96/17/63/336961763.db2.gz RSSUIZSRITUZSW-RYUDHWBXSA-N 1 2 310.850 4.036 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C)s1)c1ccc(Cl)c(Cl)c1 ZINC000391921844 336964976 /nfs/dbraw/zinc/96/49/76/336964976.db2.gz GCQYSQWZCCHGNW-GFCCVEGCSA-N 1 2 316.257 4.394 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)CCc1ccc(F)cc1 ZINC000373618524 336966797 /nfs/dbraw/zinc/96/67/97/336966797.db2.gz LWTSESYZHXVKNX-UHFFFAOYSA-N 1 2 323.371 4.096 20 0 DIADLO CC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2[nH+]ccn2CC)CC1 ZINC000373768839 336972302 /nfs/dbraw/zinc/97/23/02/336972302.db2.gz FYIJXAILOCWGKV-BRWVUGGUSA-N 1 2 317.477 4.173 20 0 DIADLO C[C@H](C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1)c1ccc2ccccc2c1 ZINC000375065422 337002336 /nfs/dbraw/zinc/00/23/36/337002336.db2.gz MJTWLKXEZMSOEU-KBXCAEBGSA-N 1 2 319.408 4.030 20 0 DIADLO COc1cccc2c(N[C@H](CCCO)c3ccccc3)cc[nH+]c12 ZINC000193484026 337008490 /nfs/dbraw/zinc/00/84/90/337008490.db2.gz MXUXVEOQHWIESE-QGZVFWFLSA-N 1 2 322.408 4.169 20 0 DIADLO c1c[nH+]c([C@@H]2CCCN2Cc2ccc(Oc3ccccc3)o2)[nH]1 ZINC000375351964 337008783 /nfs/dbraw/zinc/00/87/83/337008783.db2.gz GZWZYPXAYFISIM-INIZCTEOSA-N 1 2 309.369 4.132 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nccn2C(F)F)cc1C ZINC000122511325 337012152 /nfs/dbraw/zinc/01/21/52/337012152.db2.gz OLCSNQQUBBVEOO-HNNXBMFYSA-N 1 2 305.372 4.232 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nccn2C(F)F)cc1C ZINC000122511325 337012153 /nfs/dbraw/zinc/01/21/53/337012153.db2.gz OLCSNQQUBBVEOO-HNNXBMFYSA-N 1 2 305.372 4.232 20 0 DIADLO Cc1csc([C@H]2CCCC[N@H+]2Cc2cnn(CC(C)C)c2)n1 ZINC000375829102 337020645 /nfs/dbraw/zinc/02/06/45/337020645.db2.gz IGBOGOYEAZWHHB-MRXNPFEDSA-N 1 2 318.490 4.031 20 0 DIADLO Cc1csc([C@H]2CCCC[N@@H+]2Cc2cnn(CC(C)C)c2)n1 ZINC000375829102 337020646 /nfs/dbraw/zinc/02/06/46/337020646.db2.gz IGBOGOYEAZWHHB-MRXNPFEDSA-N 1 2 318.490 4.031 20 0 DIADLO Clc1scc(CN2CCC[C@H]2c2[nH]cc[nH+]2)c1Cl ZINC000376113663 337027379 /nfs/dbraw/zinc/02/73/79/337027379.db2.gz LRWQNEDIDIFTGA-VIFPVBQESA-N 1 2 302.230 4.115 20 0 DIADLO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1csc(C(C)C)n1)CO2 ZINC000376317646 337031259 /nfs/dbraw/zinc/03/12/59/337031259.db2.gz AFRPUXQQKKCPFO-GXTWGEPZSA-N 1 2 302.443 4.359 20 0 DIADLO CCc1ccccc1C(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000376422384 337033197 /nfs/dbraw/zinc/03/31/97/337033197.db2.gz AEGHRKFFTZRKON-UHFFFAOYSA-N 1 2 305.381 4.200 20 0 DIADLO FC(F)(F)CCCC[N@@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000376578018 337037095 /nfs/dbraw/zinc/03/70/95/337037095.db2.gz ADILUOKBLSHKAK-LBPRGKRZSA-N 1 2 317.355 4.207 20 0 DIADLO FC(F)(F)CCCC[N@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000376578018 337037096 /nfs/dbraw/zinc/03/70/96/337037096.db2.gz ADILUOKBLSHKAK-LBPRGKRZSA-N 1 2 317.355 4.207 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1F)c1nccn1-c1ccccc1 ZINC000376607585 337037881 /nfs/dbraw/zinc/03/78/81/337037881.db2.gz YZOXPMPKEKPNGL-ZDUSSCGKSA-N 1 2 313.351 4.001 20 0 DIADLO Cc1ccc([C@]2(C)CCN(C(=O)Nc3c(C)cc[nH+]c3C)C2)cc1 ZINC000376606463 337037892 /nfs/dbraw/zinc/03/78/92/337037892.db2.gz ODADTAUHFAQZET-HXUWFJFHSA-N 1 2 323.440 4.202 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1cncs1 ZINC000123172346 337038678 /nfs/dbraw/zinc/03/86/78/337038678.db2.gz KDZMFMZYTKDIBM-SMDDNHRTSA-N 1 2 301.440 4.040 20 0 DIADLO Cc1ccc([C@@H]2CCN(C(=O)Nc3c(C)cc[nH+]c3C)C2)cc1 ZINC000376640262 337038794 /nfs/dbraw/zinc/03/87/94/337038794.db2.gz HMDICTKTDLPLJG-QGZVFWFLSA-N 1 2 309.413 4.028 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@H](c2ccccc2)[C@@H](C)C1 ZINC000376644998 337038859 /nfs/dbraw/zinc/03/88/59/337038859.db2.gz UQGHTTPWNSWGOM-YJBOKZPZSA-N 1 2 323.440 4.356 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000376644995 337038943 /nfs/dbraw/zinc/03/89/43/337038943.db2.gz UQGHTTPWNSWGOM-CRAIPNDOSA-N 1 2 323.440 4.356 20 0 DIADLO Cc1ccc([C@@H]2CCCN2C(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000376647259 337038989 /nfs/dbraw/zinc/03/89/89/337038989.db2.gz VMGGMQHFYKYWGB-KRWDZBQOSA-N 1 2 309.413 4.376 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)CCOc1ccccc1C(C)C ZINC000425595643 337044646 /nfs/dbraw/zinc/04/46/46/337044646.db2.gz IPKNCIBDYUEWLD-UHFFFAOYSA-N 1 2 312.413 4.229 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)C[C@@H]1CCC[C@@H](C)C1 ZINC000377228255 337048981 /nfs/dbraw/zinc/04/89/81/337048981.db2.gz ZYZOWUNHRBRGIH-ZACQAIPSSA-N 1 2 317.477 4.173 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2c1ccc(Cl)c2Cl)c1ccccn1 ZINC000378145483 337067140 /nfs/dbraw/zinc/06/71/40/337067140.db2.gz BLJAIZNRSKZPRX-TVQRCGJNSA-N 1 2 309.196 4.173 20 0 DIADLO Clc1nccc(C[NH+]2CCC(c3ccccn3)CC2)c1Cl ZINC000378152523 337067338 /nfs/dbraw/zinc/06/73/38/337067338.db2.gz ZGOUQAOCXUMULJ-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1nccs1 ZINC000378471960 337073629 /nfs/dbraw/zinc/07/36/29/337073629.db2.gz KKCQNLDDLLEAOV-ZDUSSCGKSA-N 1 2 322.437 4.231 20 0 DIADLO C[C@H](Nc1cccc(-c2cn3c([nH+]2)CCCC3)c1)c1ccncc1 ZINC000378509577 337074643 /nfs/dbraw/zinc/07/46/43/337074643.db2.gz BBIVTRAHGNFMEW-HNNXBMFYSA-N 1 2 318.424 4.455 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@@H+]2Cc2ccncc2)s1 ZINC000378649522 337077676 /nfs/dbraw/zinc/07/76/76/337077676.db2.gz MPUYNTYFYNIIGN-LBPRGKRZSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@H+]2Cc2ccncc2)s1 ZINC000378649522 337077677 /nfs/dbraw/zinc/07/76/77/337077677.db2.gz MPUYNTYFYNIIGN-LBPRGKRZSA-N 1 2 323.259 4.243 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000170781939 337082956 /nfs/dbraw/zinc/08/29/56/337082956.db2.gz UXJYBUJSHPPCMI-HOTGVXAUSA-N 1 2 305.466 4.460 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H]3CCCc4cn[nH]c43)cs2)cc1 ZINC000360037399 337084091 /nfs/dbraw/zinc/08/40/91/337084091.db2.gz CRIMVVSFWMSNBL-INIZCTEOSA-N 1 2 324.453 4.009 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H]3CCCc4c[nH]nc43)cs2)cc1 ZINC000360037399 337084092 /nfs/dbraw/zinc/08/40/92/337084092.db2.gz CRIMVVSFWMSNBL-INIZCTEOSA-N 1 2 324.453 4.009 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccn(C3CCCC3)n2)n1 ZINC000360080086 337085246 /nfs/dbraw/zinc/08/52/46/337085246.db2.gz UAXQJNRXLMDZMG-LJQANCHMSA-N 1 2 310.445 4.039 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccn(C3CCCC3)n2)n1 ZINC000360080086 337085247 /nfs/dbraw/zinc/08/52/47/337085247.db2.gz UAXQJNRXLMDZMG-LJQANCHMSA-N 1 2 310.445 4.039 20 0 DIADLO Cc1ccc2[nH+]c(CNc3ccc(C)c(-c4ncco4)c3)cn2c1 ZINC000582501691 337098990 /nfs/dbraw/zinc/09/89/90/337098990.db2.gz PEPOHVUXNUCPNP-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc(C(C)(C)C2CCC2)n1 ZINC000582648195 337120455 /nfs/dbraw/zinc/12/04/55/337120455.db2.gz WVWRTHRRWLBKFY-UHFFFAOYSA-N 1 2 324.428 4.048 20 0 DIADLO Cc1ccc(C(=O)N2CCC[C@@H](C)[C@H]2C)cc1Oc1cc[nH+]cc1 ZINC000172650207 337129296 /nfs/dbraw/zinc/12/92/96/337129296.db2.gz IJZHIULGSZETOK-GDBMZVCRSA-N 1 2 324.424 4.443 20 0 DIADLO CS[C@H](C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccccc1 ZINC000172539627 337129894 /nfs/dbraw/zinc/12/98/94/337129894.db2.gz HODTXEGCLYWXNG-INIZCTEOSA-N 1 2 323.421 4.120 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)nc1)c1ncc(-c2ccccc2)o1 ZINC000173967890 337138090 /nfs/dbraw/zinc/13/80/90/337138090.db2.gz UQEISFWQWRYCND-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)nc1)c1ncc(-c2ccccc2)o1 ZINC000173967900 337138123 /nfs/dbraw/zinc/13/81/23/337138123.db2.gz UQEISFWQWRYCND-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)cc(F)c1)c1ncc(-c2ccccc2)o1 ZINC000173896064 337138793 /nfs/dbraw/zinc/13/87/93/337138793.db2.gz JSHFLRDWWPIBNK-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO CCn1ccnc1C[N@H+](CCc1ccc(C)cc1)Cc1ccco1 ZINC000174042460 337138947 /nfs/dbraw/zinc/13/89/47/337138947.db2.gz CPDVIBSWXHIBCF-UHFFFAOYSA-N 1 2 323.440 4.049 20 0 DIADLO CCn1ccnc1C[N@@H+](CCc1ccc(C)cc1)Cc1ccco1 ZINC000174042460 337138948 /nfs/dbraw/zinc/13/89/48/337138948.db2.gz CPDVIBSWXHIBCF-UHFFFAOYSA-N 1 2 323.440 4.049 20 0 DIADLO Cc1cccn2c(C[NH2+][C@H](c3ccco3)c3ccccc3)cnc12 ZINC000174249355 337139991 /nfs/dbraw/zinc/13/99/91/337139991.db2.gz VRMHZMJUDTXOBA-IBGZPJMESA-N 1 2 317.392 4.115 20 0 DIADLO Cc1cccn2c(CN[C@H](c3ccco3)c3ccccc3)c[nH+]c12 ZINC000174249355 337139992 /nfs/dbraw/zinc/13/99/92/337139992.db2.gz VRMHZMJUDTXOBA-IBGZPJMESA-N 1 2 317.392 4.115 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2nccn2C(C)C)o1 ZINC000173996915 337140346 /nfs/dbraw/zinc/14/03/46/337140346.db2.gz JZOVRFXDWRHXGK-ZBFHGGJFSA-N 1 2 301.434 4.339 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2nccn2C(C)C)o1 ZINC000173996915 337140347 /nfs/dbraw/zinc/14/03/47/337140347.db2.gz JZOVRFXDWRHXGK-ZBFHGGJFSA-N 1 2 301.434 4.339 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2ccc(OC(C)C)cc2)s1 ZINC000175528651 337147876 /nfs/dbraw/zinc/14/78/76/337147876.db2.gz ZIXDDSWOIDWAJG-UHFFFAOYSA-N 1 2 304.459 4.125 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2ccc(OC(C)C)cc2)s1 ZINC000175528651 337147877 /nfs/dbraw/zinc/14/78/77/337147877.db2.gz ZIXDDSWOIDWAJG-UHFFFAOYSA-N 1 2 304.459 4.125 20 0 DIADLO Cc1cc(C)c(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)o1 ZINC000176290048 337150599 /nfs/dbraw/zinc/15/05/99/337150599.db2.gz XNAQVXXFXYTTQK-UHFFFAOYSA-N 1 2 308.337 4.336 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@@H](C)[C@H]2C)cc1Oc1cc[nH+]cc1 ZINC000177040105 337152922 /nfs/dbraw/zinc/15/29/22/337152922.db2.gz IAEOOFPXKBSYHC-UKRRQHHQSA-N 1 2 310.397 4.053 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nccn1C)c1cccc(F)c1)c1ccsc1 ZINC000177805791 337157570 /nfs/dbraw/zinc/15/75/70/337157570.db2.gz FKMMFMTYCCFPCE-BLLLJJGKSA-N 1 2 315.417 4.061 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Oc2ccccc2)nc1)c1nccs1 ZINC000179418231 337167831 /nfs/dbraw/zinc/16/78/31/337167831.db2.gz SKEDYCMAISINOB-CYBMUJFWSA-N 1 2 311.410 4.181 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1csc(C2CC2)n1 ZINC000179247668 337168556 /nfs/dbraw/zinc/16/85/56/337168556.db2.gz VXDNYMINIXFHCO-UHFFFAOYSA-N 1 2 302.443 4.051 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000179247668 337168557 /nfs/dbraw/zinc/16/85/57/337168557.db2.gz VXDNYMINIXFHCO-UHFFFAOYSA-N 1 2 302.443 4.051 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+](C)[C@@H](C)c1ccccn1 ZINC000582793674 337170622 /nfs/dbraw/zinc/17/06/22/337170622.db2.gz LNSIZXBVARCASS-ZDUSSCGKSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000582793674 337170623 /nfs/dbraw/zinc/17/06/23/337170623.db2.gz LNSIZXBVARCASS-ZDUSSCGKSA-N 1 2 304.821 4.327 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2ccc(Oc3ccccc3)o2)s1 ZINC000180424202 337174334 /nfs/dbraw/zinc/17/43/34/337174334.db2.gz ZMENSNCVWUOMOQ-UHFFFAOYSA-N 1 2 314.410 4.469 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2ccc(Oc3ccccc3)o2)s1 ZINC000180424202 337174335 /nfs/dbraw/zinc/17/43/35/337174335.db2.gz ZMENSNCVWUOMOQ-UHFFFAOYSA-N 1 2 314.410 4.469 20 0 DIADLO Clc1cnc(C[N@@H+]2CCC[C@H]2c2ccncc2)c(Cl)c1 ZINC000180196942 337175246 /nfs/dbraw/zinc/17/52/46/337175246.db2.gz FWLHNYPXKQQLJM-HNNXBMFYSA-N 1 2 308.212 4.121 20 0 DIADLO Clc1cnc(C[N@H+]2CCC[C@H]2c2ccncc2)c(Cl)c1 ZINC000180196942 337175247 /nfs/dbraw/zinc/17/52/47/337175247.db2.gz FWLHNYPXKQQLJM-HNNXBMFYSA-N 1 2 308.212 4.121 20 0 DIADLO Clc1cnc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c(Cl)c1 ZINC000180196964 337175328 /nfs/dbraw/zinc/17/53/28/337175328.db2.gz FWLHNYPXKQQLJM-OAHLLOKOSA-N 1 2 308.212 4.121 20 0 DIADLO Clc1cnc(C[N@H+]2CCC[C@@H]2c2ccncc2)c(Cl)c1 ZINC000180196964 337175329 /nfs/dbraw/zinc/17/53/29/337175329.db2.gz FWLHNYPXKQQLJM-OAHLLOKOSA-N 1 2 308.212 4.121 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@@H](CC)c2ccccc2F)o1 ZINC000180631486 337176749 /nfs/dbraw/zinc/17/67/49/337176749.db2.gz BLJZOBMNLIOOAI-DLBZAZTESA-N 1 2 305.393 4.410 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1ncc(-c2ccccc2F)o1 ZINC000180796329 337177908 /nfs/dbraw/zinc/17/79/08/337177908.db2.gz IDOAAPNYBREWKC-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ncc(-c2ccccc2F)o1 ZINC000180796329 337177909 /nfs/dbraw/zinc/17/79/09/337177909.db2.gz IDOAAPNYBREWKC-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1cn(-c2ccccc2)nn1)c1ccccc1F ZINC000180945893 337178836 /nfs/dbraw/zinc/17/88/36/337178836.db2.gz PAVFYXXQILFLJY-KDOFPFPSSA-N 1 2 324.403 4.208 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)Cc1ccc(Cl)cc1 ZINC000425599136 337179028 /nfs/dbraw/zinc/17/90/28/337179028.db2.gz ZCHCPVWKFKUXGP-GFCCVEGCSA-N 1 2 302.805 4.169 20 0 DIADLO Cc1cc(-c2noc(C[NH2+][C@@H](C)c3ccccc3)n2)ccc1F ZINC000181347223 337181632 /nfs/dbraw/zinc/18/16/32/337181632.db2.gz AALMBBOSAMNHFF-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(-c2cccc(Cl)c2)o1)c1cccnc1 ZINC000181395554 337181898 /nfs/dbraw/zinc/18/18/98/337181898.db2.gz RGAKQUXWGHVKON-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[NH2+][C@H](C)c3cccnc3)o2)cc1C ZINC000181652707 337183599 /nfs/dbraw/zinc/18/35/99/337183599.db2.gz LZDPNPYARVVFKG-HUUCEWRRSA-N 1 2 322.412 4.160 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCCC[C@H]2/C=C/c2cccs2)o1 ZINC000181958755 337185645 /nfs/dbraw/zinc/18/56/45/337185645.db2.gz FXRFRYHVQDQMNK-HBWSCVEGSA-N 1 2 317.458 4.152 20 0 DIADLO CCc1nnc(C[N@H+]2CCCCC[C@H]2/C=C/c2cccs2)o1 ZINC000181958755 337185646 /nfs/dbraw/zinc/18/56/46/337185646.db2.gz FXRFRYHVQDQMNK-HBWSCVEGSA-N 1 2 317.458 4.152 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1nnc(-c2ccco2)o1 ZINC000183556991 337192113 /nfs/dbraw/zinc/19/21/13/337192113.db2.gz GGHGTRVLVRHSBK-GFCCVEGCSA-N 1 2 323.352 4.235 20 0 DIADLO Cc1ccc(CSCc2nc(-c3cccs3)no2)c(C)[nH+]1 ZINC000184809942 337200343 /nfs/dbraw/zinc/20/03/43/337200343.db2.gz OJPCGCGLTDNYRJ-UHFFFAOYSA-N 1 2 317.439 4.243 20 0 DIADLO CO[C@@H](C)c1nc(CSCc2ccc(C)[nH+]c2C)cs1 ZINC000184828119 337200435 /nfs/dbraw/zinc/20/04/35/337200435.db2.gz MEBCZVZPSKUJGU-LBPRGKRZSA-N 1 2 308.472 4.296 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(Cl)s1)c1ncc(-c2ccccc2)o1 ZINC000184888953 337200635 /nfs/dbraw/zinc/20/06/35/337200635.db2.gz USGIYKHKTYQBDW-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO CCc1cnc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)o1 ZINC000582940109 337219997 /nfs/dbraw/zinc/21/99/97/337219997.db2.gz SAMSSAAAFAJSFU-UHFFFAOYSA-N 1 2 312.335 4.192 20 0 DIADLO CCc1cnc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)o1 ZINC000582940109 337219998 /nfs/dbraw/zinc/21/99/98/337219998.db2.gz SAMSSAAAFAJSFU-UHFFFAOYSA-N 1 2 312.335 4.192 20 0 DIADLO C[C@H]1Oc2cc(F)ccc2[C@H]1[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000582986574 337222865 /nfs/dbraw/zinc/22/28/65/337222865.db2.gz CHFKICJKMBDSCG-HWPZZCPQSA-N 1 2 320.433 4.192 20 0 DIADLO CC(=O)c1cc(C[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)on1 ZINC000583151692 337246633 /nfs/dbraw/zinc/24/66/33/337246633.db2.gz IPGQXYACYFKKOM-LJQANCHMSA-N 1 2 324.424 4.385 20 0 DIADLO CC(=O)c1cc(C[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)on1 ZINC000583151692 337246634 /nfs/dbraw/zinc/24/66/34/337246634.db2.gz IPGQXYACYFKKOM-LJQANCHMSA-N 1 2 324.424 4.385 20 0 DIADLO CC(=O)c1cc(C[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)on1 ZINC000583151691 337246702 /nfs/dbraw/zinc/24/67/02/337246702.db2.gz IPGQXYACYFKKOM-IBGZPJMESA-N 1 2 324.424 4.385 20 0 DIADLO CC(=O)c1cc(C[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)on1 ZINC000583151691 337246703 /nfs/dbraw/zinc/24/67/03/337246703.db2.gz IPGQXYACYFKKOM-IBGZPJMESA-N 1 2 324.424 4.385 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@H]1c1cccs1 ZINC000532902073 337252162 /nfs/dbraw/zinc/25/21/62/337252162.db2.gz ONHAJQZNSISJOF-NEPJUHHUSA-N 1 2 305.447 4.327 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@H]1c1cccs1 ZINC000532902073 337252163 /nfs/dbraw/zinc/25/21/63/337252163.db2.gz ONHAJQZNSISJOF-NEPJUHHUSA-N 1 2 305.447 4.327 20 0 DIADLO CCc1noc([C@H](C)[N@H+](C)Cc2ccc(C(C)(C)C)cc2)n1 ZINC000532904080 337254656 /nfs/dbraw/zinc/25/46/56/337254656.db2.gz AMRYYTLEBIBGMS-ZDUSSCGKSA-N 1 2 301.434 4.123 20 0 DIADLO CCc1noc([C@H](C)[N@@H+](C)Cc2ccc(C(C)(C)C)cc2)n1 ZINC000532904080 337254657 /nfs/dbraw/zinc/25/46/57/337254657.db2.gz AMRYYTLEBIBGMS-ZDUSSCGKSA-N 1 2 301.434 4.123 20 0 DIADLO Cc1ccc(CSc2ccc3c(c2)OCCCO3)c(C)[nH+]1 ZINC000186347716 337256695 /nfs/dbraw/zinc/25/66/95/337256695.db2.gz BRWQHFSXUYESTC-UHFFFAOYSA-N 1 2 301.411 4.152 20 0 DIADLO Cc1cc(C)cc(C[N@@H+]2CCSC[C@H]2c2nccs2)c1 ZINC000186661738 337258457 /nfs/dbraw/zinc/25/84/57/337258457.db2.gz DRRZQNRPANEDJJ-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1cc(C)cc(C[N@H+]2CCSC[C@H]2c2nccs2)c1 ZINC000186661738 337258458 /nfs/dbraw/zinc/25/84/58/337258458.db2.gz DRRZQNRPANEDJJ-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO COCCC1(C)C[NH+](Cc2cc(C(F)(F)F)ccc2Cl)C1 ZINC000459637422 337261119 /nfs/dbraw/zinc/26/11/19/337261119.db2.gz RWWRRMSQHGHYAT-UHFFFAOYSA-N 1 2 321.770 4.217 20 0 DIADLO CC(C)CSCCC[N@@H+]1CCSC[C@H]1c1nccs1 ZINC000187022705 337261309 /nfs/dbraw/zinc/26/13/09/337261309.db2.gz JESQPGLMDDTEAW-ZDUSSCGKSA-N 1 2 316.561 4.012 20 0 DIADLO CC(C)CSCCC[N@H+]1CCSC[C@H]1c1nccs1 ZINC000187022705 337261310 /nfs/dbraw/zinc/26/13/10/337261310.db2.gz JESQPGLMDDTEAW-ZDUSSCGKSA-N 1 2 316.561 4.012 20 0 DIADLO Cc1ccc(C[S@](=O)CCCc2ccccc2Cl)c(C)[nH+]1 ZINC000187225155 337263278 /nfs/dbraw/zinc/26/32/78/337263278.db2.gz JYZUMULLTAOORK-OAQYLSRUSA-N 1 2 321.873 4.233 20 0 DIADLO Cc1ccc(C[S@@](=O)[C@@H]2CCc3c2cccc3Cl)c(C)[nH+]1 ZINC000187174072 337263452 /nfs/dbraw/zinc/26/34/52/337263452.db2.gz VAJGCODRDQMAAV-DYESRHJHSA-N 1 2 319.857 4.288 20 0 DIADLO C[C@H]1OCC[N@H+](Cc2nc(-c3ccccc3Cl)cs2)[C@@H]1C ZINC000187180730 337263491 /nfs/dbraw/zinc/26/34/91/337263491.db2.gz UPZGYEIOGUQGTL-VXGBXAGGSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@H]1OCC[N@@H+](Cc2nc(-c3ccccc3Cl)cs2)[C@@H]1C ZINC000187180730 337263492 /nfs/dbraw/zinc/26/34/92/337263492.db2.gz UPZGYEIOGUQGTL-VXGBXAGGSA-N 1 2 322.861 4.073 20 0 DIADLO Cc1ccc(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)c(C)n1 ZINC000187200676 337263598 /nfs/dbraw/zinc/26/35/98/337263598.db2.gz CDKGTEHRKLSGIG-OAQYLSRUSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1ccc(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)c(C)n1 ZINC000187200676 337263599 /nfs/dbraw/zinc/26/35/99/337263599.db2.gz CDKGTEHRKLSGIG-OAQYLSRUSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1nnc(SCc2ccc(C)[nH+]c2C)n1-c1ccccc1C ZINC000187318456 337264144 /nfs/dbraw/zinc/26/41/44/337264144.db2.gz YOXPRUGWOTVSGB-UHFFFAOYSA-N 1 2 324.453 4.188 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2ccc(OC)cc2s1)c1nccs1 ZINC000187488183 337266247 /nfs/dbraw/zinc/26/62/47/337266247.db2.gz FYSLZXDCIDZYRS-NSHDSACASA-N 1 2 319.455 4.002 20 0 DIADLO CCc1cnc(C[NH2+]Cc2c(Cl)cccc2Cl)s1 ZINC000230706735 337274940 /nfs/dbraw/zinc/27/49/40/337274940.db2.gz KEVNILFJCBEBNP-UHFFFAOYSA-N 1 2 301.242 4.302 20 0 DIADLO Cc1cc(Br)cc(NCc2c[nH+]cn2C(C)C)c1 ZINC000232065321 337280578 /nfs/dbraw/zinc/28/05/78/337280578.db2.gz GNVDUDGJCMQUHU-UHFFFAOYSA-N 1 2 308.223 4.147 20 0 DIADLO CCCc1nc(C[NH2+][C@H]2CC(C)(C)CCc3ccccc32)no1 ZINC000583241903 337285721 /nfs/dbraw/zinc/28/57/21/337285721.db2.gz DDLVGGVBCCTXHY-INIZCTEOSA-N 1 2 313.445 4.216 20 0 DIADLO O=C(c1ccc(C2CCC2)cc1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000190789368 337290745 /nfs/dbraw/zinc/29/07/45/337290745.db2.gz YZOFPNDVHZYLIN-QGZVFWFLSA-N 1 2 309.413 4.045 20 0 DIADLO CC(C)N(C)c1ccc(CNc2cccc3cccnc32)c[nH+]1 ZINC000190807643 337291032 /nfs/dbraw/zinc/29/10/32/337291032.db2.gz QEJVGOYUKGNTRB-UHFFFAOYSA-N 1 2 306.413 4.087 20 0 DIADLO Cc1nnsc1C[N@@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000583266503 337295808 /nfs/dbraw/zinc/29/58/08/337295808.db2.gz MCKVOWMPTBCWBL-AWEZNQCLSA-N 1 2 307.850 4.227 20 0 DIADLO Cc1nnsc1C[N@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000583266503 337295809 /nfs/dbraw/zinc/29/58/09/337295809.db2.gz MCKVOWMPTBCWBL-AWEZNQCLSA-N 1 2 307.850 4.227 20 0 DIADLO CC(C)N(C)c1ccc(CNc2cccc3ncccc32)c[nH+]1 ZINC000191371250 337296348 /nfs/dbraw/zinc/29/63/48/337296348.db2.gz VUSJHXYJRBGULY-UHFFFAOYSA-N 1 2 306.413 4.087 20 0 DIADLO Cc1cccc([C@@H](NC(=O)C[C@H](C)n2cc[nH+]c2)C(C)(C)C)c1 ZINC000583266849 337296467 /nfs/dbraw/zinc/29/64/67/337296467.db2.gz YMNDJFYYYYWNPV-MAUKXSAKSA-N 1 2 313.445 4.046 20 0 DIADLO CC(C)N(C)c1ccc(CNc2cccc(-c3cnco3)c2)c[nH+]1 ZINC000191393796 337296541 /nfs/dbraw/zinc/29/65/41/337296541.db2.gz DZHJVTRCWLUKAA-UHFFFAOYSA-N 1 2 322.412 4.193 20 0 DIADLO Cc1nc(C)c(C[N@H+](Cc2c(F)cccc2F)C2CC2)s1 ZINC000191623092 337298022 /nfs/dbraw/zinc/29/80/22/337298022.db2.gz IECKZTYBDRQZIP-UHFFFAOYSA-N 1 2 308.397 4.203 20 0 DIADLO Cc1nc(C)c(C[N@@H+](Cc2c(F)cccc2F)C2CC2)s1 ZINC000191623092 337298023 /nfs/dbraw/zinc/29/80/23/337298023.db2.gz IECKZTYBDRQZIP-UHFFFAOYSA-N 1 2 308.397 4.203 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1ncc(C(C)C)s1 ZINC000191633303 337298254 /nfs/dbraw/zinc/29/82/54/337298254.db2.gz NSKJMLONVOHQPT-UHFFFAOYSA-N 1 2 310.850 4.218 20 0 DIADLO C[C@H]([NH2+]Cc1nccn1-c1ccccc1)c1cccc(F)c1F ZINC000191528740 337298840 /nfs/dbraw/zinc/29/88/40/337298840.db2.gz NFBAINOJHQVPAT-ZDUSSCGKSA-N 1 2 313.351 4.001 20 0 DIADLO CCSCc1cc[nH+]c(NCc2nccn2-c2ccccc2)c1 ZINC000191547799 337299010 /nfs/dbraw/zinc/29/90/10/337299010.db2.gz LQIXZAYTAOGNOH-UHFFFAOYSA-N 1 2 324.453 4.133 20 0 DIADLO CC[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccc(F)cn1 ZINC000321914640 337302716 /nfs/dbraw/zinc/30/27/16/337302716.db2.gz XSXFAIXKJLHIPZ-INIZCTEOSA-N 1 2 314.408 4.169 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cc2ccccc2s1)C(=O)OC(C)(C)C ZINC000525952557 337308981 /nfs/dbraw/zinc/30/89/81/337308981.db2.gz RWPCCBRQXSTBHX-RYUDHWBXSA-N 1 2 305.443 4.282 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccc1N(C)C)c1ccc(Cl)cc1Cl ZINC000583760257 337330669 /nfs/dbraw/zinc/33/06/69/337330669.db2.gz IZBBZUFVQDVDQV-LLVKDONJSA-N 1 2 324.255 4.305 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NC[C@H]1CCC[C@@H]1c1ccccc1 ZINC000584453252 337340279 /nfs/dbraw/zinc/34/02/79/337340279.db2.gz IYVBBVMOGZRVLI-QZTJIDSGSA-N 1 2 323.440 4.404 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3cccc(Cl)c3C)ccc2n1C ZINC000584505208 337351393 /nfs/dbraw/zinc/35/13/93/337351393.db2.gz XECJVKIGMTZECR-UHFFFAOYSA-N 1 2 313.788 4.096 20 0 DIADLO Fc1ccc(C[NH+]2CC3(CCC3(F)F)C2)cc1C(F)(F)F ZINC000583864558 337358150 /nfs/dbraw/zinc/35/81/50/337358150.db2.gz SXOHEROZCKCQNX-UHFFFAOYSA-N 1 2 309.253 4.076 20 0 DIADLO Cc1cccc(N(C)Cc2[nH+]ccn2Cc2ccccc2)c1C ZINC000532924901 337392978 /nfs/dbraw/zinc/39/29/78/337392978.db2.gz ZDIKMRXFVWTDOW-UHFFFAOYSA-N 1 2 305.425 4.185 20 0 DIADLO COc1ccc2oc(CNc3ccc(-n4cc[nH+]c4)cc3)cc2c1 ZINC000123806269 337401485 /nfs/dbraw/zinc/40/14/85/337401485.db2.gz MSSDRMAOGCZUSR-UHFFFAOYSA-N 1 2 319.364 4.239 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(-c2ccco2)no1)c1cccc(Cl)c1 ZINC000125287709 337410496 /nfs/dbraw/zinc/41/04/96/337410496.db2.gz HEEUQQDPUBLCCI-ZDUSSCGKSA-N 1 2 317.776 4.224 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(CC(C)C)no1)c1cccc(Cl)c1 ZINC000125286008 337410511 /nfs/dbraw/zinc/41/05/11/337410511.db2.gz YRBVYBRITAADLZ-CQSZACIVSA-N 1 2 307.825 4.162 20 0 DIADLO Cc1ccc([C@H](C)N(C)C(=O)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000045248244 337419638 /nfs/dbraw/zinc/41/96/38/337419638.db2.gz LQFFNUNWDXAQFW-INIZCTEOSA-N 1 2 319.408 4.014 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@H](c2nccn2C)c2cccc(F)c2)c1 ZINC000128544453 337425689 /nfs/dbraw/zinc/42/56/89/337425689.db2.gz XRCWDBMWVOCPEY-BEFAXECRSA-N 1 2 323.415 4.308 20 0 DIADLO CCC(CC)c1cc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)on1 ZINC000133029034 337444108 /nfs/dbraw/zinc/44/41/08/337444108.db2.gz OBZRAGZCCSTAFG-UHFFFAOYSA-N 1 2 324.384 4.016 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1cccc(O)c1 ZINC000194874142 337464034 /nfs/dbraw/zinc/46/40/34/337464034.db2.gz UEHKGAWOPGOURR-DYVFJYSZSA-N 1 2 310.422 4.289 20 0 DIADLO C[C@H]([NH2+][C@@H](c1cccc(F)c1)c1ccccn1)c1cccc(O)c1 ZINC000194941196 337464356 /nfs/dbraw/zinc/46/43/56/337464356.db2.gz XVEOGKUDGNYRAO-XOBRGWDASA-N 1 2 322.383 4.367 20 0 DIADLO CC(F)(F)CCOc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000419009204 337474442 /nfs/dbraw/zinc/47/44/42/337474442.db2.gz MZEAWCYHVWIQRS-UHFFFAOYSA-N 1 2 306.356 4.311 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccco2)no1)c1ccc(C2CC2)cc1 ZINC000419355498 337480695 /nfs/dbraw/zinc/48/06/95/337480695.db2.gz NFMHMCMNEMIUGS-LBPRGKRZSA-N 1 2 309.369 4.058 20 0 DIADLO Cc1ccc(CSCc2[nH+]ccn2CC(F)(F)F)c(C)c1 ZINC000419423409 337483947 /nfs/dbraw/zinc/48/39/47/337483947.db2.gz BWEYSBXVIDVISS-UHFFFAOYSA-N 1 2 314.376 4.496 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CSCc1nnc(C(C)C)o1 ZINC000419496871 337488060 /nfs/dbraw/zinc/48/80/60/337488060.db2.gz VJBLUCJEJDAJNW-UHFFFAOYSA-N 1 2 305.447 4.453 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@@H](C)CCCc2ccccc2)n1 ZINC000420510020 337505848 /nfs/dbraw/zinc/50/58/48/337505848.db2.gz HGXCBZSTYBGYFY-HNNXBMFYSA-N 1 2 321.424 4.490 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(-c2cscc2C)n1 ZINC000445383789 337515408 /nfs/dbraw/zinc/51/54/08/337515408.db2.gz ISFWDTWHBDIBNS-UHFFFAOYSA-N 1 2 324.409 4.067 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@@H](c2ccccc2)C1(C)C ZINC000421115631 337521977 /nfs/dbraw/zinc/52/19/77/337521977.db2.gz VJFAQIUNDHBRRQ-KRWDZBQOSA-N 1 2 323.440 4.498 20 0 DIADLO CC[C@@H]([NH2+]Cc1nn(C)c(C)c1Cl)c1ccc(Cl)cc1 ZINC000421332227 337526859 /nfs/dbraw/zinc/52/68/59/337526859.db2.gz LEKUDMDKHYDZDZ-CYBMUJFWSA-N 1 2 312.244 4.276 20 0 DIADLO CC[C@H]([NH2+]Cc1nn(C)c(C)c1Cl)c1ccc(Cl)cc1 ZINC000421332230 337526873 /nfs/dbraw/zinc/52/68/73/337526873.db2.gz LEKUDMDKHYDZDZ-ZDUSSCGKSA-N 1 2 312.244 4.276 20 0 DIADLO CC[C@H](C)[C@H](C(=O)NCc1cc(C)[nH+]c(C)c1)c1ccccc1 ZINC000421560448 337541280 /nfs/dbraw/zinc/54/12/80/337541280.db2.gz QPNXGNASHGTMJS-LIRRHRJNSA-N 1 2 310.441 4.145 20 0 DIADLO CC[C@H](CC(=O)NCc1cc(C)[nH+]c(C)c1)c1ccc(C)cc1 ZINC000421573742 337542167 /nfs/dbraw/zinc/54/21/67/337542167.db2.gz BWZWNGIKDVGMJL-GOSISDBHSA-N 1 2 310.441 4.207 20 0 DIADLO Cc1cc(NC(=O)N[C@H](c2ccc(F)cc2)C(C)C)cc[nH+]1 ZINC000074630735 337552356 /nfs/dbraw/zinc/55/23/56/337552356.db2.gz SGOSSWIHPJUJJO-INIZCTEOSA-N 1 2 301.365 4.048 20 0 DIADLO Cc1cc(NC(=O)CCCc2ncc(-c3ccccc3)o2)cc[nH+]1 ZINC000075936792 337561652 /nfs/dbraw/zinc/56/16/52/337561652.db2.gz WQCAXWVKCXZSQP-UHFFFAOYSA-N 1 2 321.380 4.006 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1cc(Cl)ccc1Cl ZINC000393328793 337576427 /nfs/dbraw/zinc/57/64/27/337576427.db2.gz XSVFINLUQKWAMB-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO CC(C)(C)OC(=O)CCCC[NH2+][C@H](C(C)(C)C)C(F)(F)F ZINC000571822346 337578154 /nfs/dbraw/zinc/57/81/54/337578154.db2.gz DAJQEMJOPKNGNE-GFCCVEGCSA-N 1 2 311.388 4.065 20 0 DIADLO Cc1[nH+]cccc1Cc1noc(/C(F)=C/C2CCCCC2)n1 ZINC000572018305 337586814 /nfs/dbraw/zinc/58/68/14/337586814.db2.gz GENWXIAXSDNYNX-GDNBJRDFSA-N 1 2 301.365 4.255 20 0 DIADLO O=C(C/C=C\c1cccc(F)c1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000255037417 337601428 /nfs/dbraw/zinc/60/14/28/337601428.db2.gz BOZFJCIHACLEIS-DJWKRKHSSA-N 1 2 321.355 4.053 20 0 DIADLO COc1cc(N[C@H]2CCc3ccc[nH+]c3CC2)ccc1Cl ZINC000421855754 337650531 /nfs/dbraw/zinc/65/05/31/337650531.db2.gz NTIIHZFYLCMVHD-ZDUSSCGKSA-N 1 2 302.805 4.103 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H](C)c1ccncc1Cl ZINC000421836489 337652279 /nfs/dbraw/zinc/65/22/79/337652279.db2.gz GZCAOCGCHRLOIF-SNVBAGLBSA-N 1 2 311.212 4.248 20 0 DIADLO C[C@H]([NH2+][C@@H]1c2ccc(F)cc2O[C@@H]1C)c1ccncc1Cl ZINC000421861750 337655971 /nfs/dbraw/zinc/65/59/71/337655971.db2.gz WHBUZIWMJCWVMW-IEVXNVSRSA-N 1 2 306.768 4.047 20 0 DIADLO Cc1nc(C2CCCC2)sc1C(=O)Nc1cc[nH+]cc1C ZINC000080111404 337660366 /nfs/dbraw/zinc/66/03/66/337660366.db2.gz PEYGUMQYUYRACX-UHFFFAOYSA-N 1 2 301.415 4.065 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ncc(-c2ccccc2)n1C ZINC000423210407 337704347 /nfs/dbraw/zinc/70/43/47/337704347.db2.gz GEEGVCOSQOITRI-CQSZACIVSA-N 1 2 318.424 4.228 20 0 DIADLO c1ccc([C@@H](C[C@H]2CCOC2)Nc2ccc3c(c2)CC[NH2+]3)cc1 ZINC000423215528 337704806 /nfs/dbraw/zinc/70/48/06/337704806.db2.gz MYABNKPRYXVJRY-FOIQADDNSA-N 1 2 308.425 4.234 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@@H]1C[C@H]1C1CC1 ZINC000527681683 337755384 /nfs/dbraw/zinc/75/53/84/337755384.db2.gz CCGABQFZRLSHSG-JLSDUUJJSA-N 1 2 319.452 4.448 20 0 DIADLO CCn1cc[nH+]c1CNc1cc(C(C)(C)C)cc2cccnc21 ZINC000527800855 337764919 /nfs/dbraw/zinc/76/49/19/337764919.db2.gz RRRQTFIHCUEZFD-UHFFFAOYSA-N 1 2 308.429 4.361 20 0 DIADLO CCOCc1nc([C@@H](C)[NH2+][C@H](C)c2cccc(C(C)C)c2)no1 ZINC000527900394 337772686 /nfs/dbraw/zinc/77/26/86/337772686.db2.gz LOXRAQXIWRXPFM-ZIAGYGMSSA-N 1 2 317.433 4.141 20 0 DIADLO CCOCc1nc([C@H](C)[NH2+][C@H](C)c2cccc(C(C)C)c2)no1 ZINC000527900386 337772785 /nfs/dbraw/zinc/77/27/85/337772785.db2.gz LOXRAQXIWRXPFM-KGLIPLIRSA-N 1 2 317.433 4.141 20 0 DIADLO COc1cc(Cl)c(Cl)cc1NCc1c[nH+]cn1C(C)C ZINC000424194156 337805690 /nfs/dbraw/zinc/80/56/90/337805690.db2.gz RUCFWSBZUZSZDY-UHFFFAOYSA-N 1 2 314.216 4.392 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2cncn2C(C)C)c2ccccn2)cc1 ZINC000424198234 337807787 /nfs/dbraw/zinc/80/77/87/337807787.db2.gz XLDQAFYBSVOLQA-HXUWFJFHSA-N 1 2 320.440 4.047 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccccc1N(C)c1ccccc1 ZINC000107293928 337828426 /nfs/dbraw/zinc/82/84/26/337828426.db2.gz XDNAOXZIPHSRFO-UHFFFAOYSA-N 1 2 317.392 4.410 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CCCOc1cccc2ccccc21 ZINC000107294070 337828443 /nfs/dbraw/zinc/82/84/43/337828443.db2.gz VJBXOGXFCLXSJY-UHFFFAOYSA-N 1 2 320.392 4.341 20 0 DIADLO Cc1c2cc(Cl)ccc2oc1C(=O)Nc1cc[nH+]cc1C ZINC000107290931 337828451 /nfs/dbraw/zinc/82/84/51/337828451.db2.gz SSOOXDJLKJAEDC-UHFFFAOYSA-N 1 2 300.745 4.350 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1ccc(C)o1)c1ccccc1 ZINC000108421213 337836964 /nfs/dbraw/zinc/83/69/64/337836964.db2.gz NTUARYCTZKOYMD-HXUWFJFHSA-N 1 2 307.393 4.476 20 0 DIADLO Cc1nc(-c2cccc(C(=O)Nc3ccc(C)[nH+]c3C)c2)cs1 ZINC000119085442 337854204 /nfs/dbraw/zinc/85/42/04/337854204.db2.gz ZHJMQVLBTRZQMC-UHFFFAOYSA-N 1 2 323.421 4.383 20 0 DIADLO Cc1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)c(C)[nH+]1 ZINC000119112617 337854428 /nfs/dbraw/zinc/85/44/28/337854428.db2.gz ZAXRRGOYXJRIII-UHFFFAOYSA-N 1 2 309.196 4.186 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)Sc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000119246365 337856840 /nfs/dbraw/zinc/85/68/40/337856840.db2.gz NEGUYGRMGDKOLP-LBPRGKRZSA-N 1 2 320.845 4.471 20 0 DIADLO Cc1ccc(S[C@H](C)C(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000119337043 337857829 /nfs/dbraw/zinc/85/78/29/337857829.db2.gz BWZHEWLNOCUEHM-CQSZACIVSA-N 1 2 300.427 4.126 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@@H](c2ncccc2C)C(C)C)n1 ZINC000120844453 337881326 /nfs/dbraw/zinc/88/13/26/337881326.db2.gz HHWGCIFXSFISOH-GOEBONIOSA-N 1 2 316.449 4.164 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1cccc(F)c1)c1ccccn1)c1cccnc1 ZINC000090955972 337887485 /nfs/dbraw/zinc/88/74/85/337887485.db2.gz VSTRFGKVDVDKKJ-KUHUBIRLSA-N 1 2 307.372 4.056 20 0 DIADLO CC[C@H](C)[C@@H]([NH2+]Cc1noc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000537086041 337887879 /nfs/dbraw/zinc/88/78/79/337887879.db2.gz YVKHOTFUJYYGBW-MEDUHNTESA-N 1 2 319.836 4.477 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](c2ccccc2F)C2CCCC2)o1 ZINC000537124985 337893566 /nfs/dbraw/zinc/89/35/66/337893566.db2.gz QEXZXQMKYVNROR-GOSISDBHSA-N 1 2 302.393 4.397 20 0 DIADLO c1c[nH+]c([C@@H]2CCCCN2Cc2cnc(C3CCCC3)s2)[nH]1 ZINC000092728795 337907567 /nfs/dbraw/zinc/90/75/67/337907567.db2.gz GVJFMOFDCJCGNG-HNNXBMFYSA-N 1 2 316.474 4.251 20 0 DIADLO C[C@H]1CC[C@H](C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C1 ZINC000537344076 337931641 /nfs/dbraw/zinc/93/16/41/337931641.db2.gz FZCDRGCRTKVCLU-HOCLYGCPSA-N 1 2 323.440 4.261 20 0 DIADLO C[C@@H](NC1(c2c(Cl)cccc2Cl)CC1)c1[nH+]ccn1C ZINC000537485728 337937739 /nfs/dbraw/zinc/93/77/39/337937739.db2.gz FHTJXELVUVNWQH-SNVBAGLBSA-N 1 2 310.228 4.067 20 0 DIADLO Cc1ccccc1[C@H]1CN(c2[nH+]ccc3ccc(F)cc32)CCO1 ZINC000537658929 337957165 /nfs/dbraw/zinc/95/71/65/337957165.db2.gz MJURPSSPLYSDPB-LJQANCHMSA-N 1 2 322.383 4.260 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc(Br)cc3)n2c1 ZINC000537760769 337961514 /nfs/dbraw/zinc/96/15/14/337961514.db2.gz SGXVFUALUFJYJL-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCSCCC(C)(C)O ZINC000514873885 337973047 /nfs/dbraw/zinc/97/30/47/337973047.db2.gz ZNPCNNPKNNGKDW-UHFFFAOYSA-N 1 2 320.502 4.409 20 0 DIADLO FC1(F)CCC12C[NH+](Cc1csc(-c3cccs3)n1)C2 ZINC000515099377 337979267 /nfs/dbraw/zinc/97/92/67/337979267.db2.gz IONSMUMCAPATOY-UHFFFAOYSA-N 1 2 312.410 4.103 20 0 DIADLO Cc1cc[nH+]c(NC[C@H](C[C@H](C)O)c2ccccc2)c1Cl ZINC000515262633 337983912 /nfs/dbraw/zinc/98/39/12/337983912.db2.gz XKMSPOLFNWBODH-ZFWWWQNUSA-N 1 2 304.821 4.010 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1csc(C2CCCCC2)n1 ZINC000516177553 338005874 /nfs/dbraw/zinc/00/58/74/338005874.db2.gz RPIHYLAVOVEFBR-UHFFFAOYSA-N 1 2 315.442 4.455 20 0 DIADLO Clc1cccc(Cl)c1C1CC[NH+](Cc2cnccn2)CC1 ZINC000516158440 338006610 /nfs/dbraw/zinc/00/66/10/338006610.db2.gz OXGGCOSHBZMAAQ-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO c1ccc2[nH+]c(CCc3nc(C4CCCCCC4)no3)[nH]c2c1 ZINC000516291403 338010001 /nfs/dbraw/zinc/01/00/01/338010001.db2.gz UASJILJMEDBILX-UHFFFAOYSA-N 1 2 310.401 4.169 20 0 DIADLO Cc1ccc([C@@H](C)c2noc([C@H](c3ccccc3)[NH+](C)C)n2)cc1 ZINC000516345963 338010397 /nfs/dbraw/zinc/01/03/97/338010397.db2.gz ZUXJRIOZZIQZEU-QAPCUYQASA-N 1 2 321.424 4.181 20 0 DIADLO Cc1ccc([C@@H](C)c2noc([C@@H](c3ccccc3)[NH+](C)C)n2)cc1 ZINC000516345961 338010460 /nfs/dbraw/zinc/01/04/60/338010460.db2.gz ZUXJRIOZZIQZEU-CRAIPNDOSA-N 1 2 321.424 4.181 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1Cl)N(C)Cc1[nH+]ccn1C ZINC000445457040 338017618 /nfs/dbraw/zinc/01/76/18/338017618.db2.gz QPLMAAPFTVMJAJ-CQSZACIVSA-N 1 2 312.244 4.310 20 0 DIADLO CCCc1csc(C[N@H+](C)Cc2cc(Cl)ccc2OC)n1 ZINC000426073664 338020288 /nfs/dbraw/zinc/02/02/88/338020288.db2.gz BWGFTHWUPFHGCJ-UHFFFAOYSA-N 1 2 324.877 4.390 20 0 DIADLO CCCc1csc(C[N@@H+](C)Cc2cc(Cl)ccc2OC)n1 ZINC000426073664 338020289 /nfs/dbraw/zinc/02/02/89/338020289.db2.gz BWGFTHWUPFHGCJ-UHFFFAOYSA-N 1 2 324.877 4.390 20 0 DIADLO CC(C)c1ccoc1-c1noc(CCc2[nH]c3ccccc3[nH+]2)n1 ZINC000426195058 338022633 /nfs/dbraw/zinc/02/26/33/338022633.db2.gz QPZXXVMJHFHLCW-UHFFFAOYSA-N 1 2 322.368 4.115 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[NH+]1CCC(O)(C(F)F)CC1 ZINC000426207497 338022864 /nfs/dbraw/zinc/02/28/64/338022864.db2.gz WHEIKVJPZIHJLD-SECBINFHSA-N 1 2 324.198 4.146 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[NH+]1CCC(O)(C(F)F)CC1 ZINC000426207498 338022894 /nfs/dbraw/zinc/02/28/94/338022894.db2.gz WHEIKVJPZIHJLD-VIFPVBQESA-N 1 2 324.198 4.146 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(-c2ccccc2)cc1F)c1nccn1C ZINC000426302015 338025561 /nfs/dbraw/zinc/02/55/61/338025561.db2.gz GRCMFFSLKBQWQZ-IBGZPJMESA-N 1 2 323.415 4.467 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(-c2ccccc2)cc1F)c1ccn(C)n1 ZINC000426300859 338025660 /nfs/dbraw/zinc/02/56/60/338025660.db2.gz JYAQSMCEKMXWST-IBGZPJMESA-N 1 2 323.415 4.467 20 0 DIADLO CCCOc1ccc(-c2noc(CCc3c[nH+]cc(C)c3)n2)cc1 ZINC000426391337 338030112 /nfs/dbraw/zinc/03/01/12/338030112.db2.gz PYVCSIKBEDDDFO-UHFFFAOYSA-N 1 2 323.396 4.014 20 0 DIADLO Cc1c[nH+]cc(CCc2nc(-c3ccc(C(C)C)cc3)no2)c1 ZINC000426395495 338030376 /nfs/dbraw/zinc/03/03/76/338030376.db2.gz JEZIYHHOWMKOJX-UHFFFAOYSA-N 1 2 307.397 4.349 20 0 DIADLO CCCc1csc(C[N@H+](C)[C@H]2CCCc3nc(C)sc32)n1 ZINC000426398535 338030561 /nfs/dbraw/zinc/03/05/61/338030561.db2.gz YSSSVDFALFWUKM-AWEZNQCLSA-N 1 2 321.515 4.370 20 0 DIADLO CCCc1csc(C[N@@H+](C)[C@H]2CCCc3nc(C)sc32)n1 ZINC000426398535 338030562 /nfs/dbraw/zinc/03/05/62/338030562.db2.gz YSSSVDFALFWUKM-AWEZNQCLSA-N 1 2 321.515 4.370 20 0 DIADLO CCCc1csc(C[N@H+](C)[C@H](C)c2sc(C)nc2C)n1 ZINC000426421603 338031815 /nfs/dbraw/zinc/03/18/15/338031815.db2.gz SNNKDKUZMVNOND-LLVKDONJSA-N 1 2 309.504 4.362 20 0 DIADLO CCCc1csc(C[N@@H+](C)[C@H](C)c2sc(C)nc2C)n1 ZINC000426421603 338031816 /nfs/dbraw/zinc/03/18/16/338031816.db2.gz SNNKDKUZMVNOND-LLVKDONJSA-N 1 2 309.504 4.362 20 0 DIADLO Cc1nc2ccc(C[N@@H+]3CCCC[C@H]3c3ncc[nH]3)cc2s1 ZINC000426423357 338031840 /nfs/dbraw/zinc/03/18/40/338031840.db2.gz YOPXBBFIVUFTJN-HNNXBMFYSA-N 1 2 312.442 4.055 20 0 DIADLO Cc1nc2ccc(C[N@H+]3CCCC[C@H]3c3ncc[nH]3)cc2s1 ZINC000426423357 338031841 /nfs/dbraw/zinc/03/18/41/338031841.db2.gz YOPXBBFIVUFTJN-HNNXBMFYSA-N 1 2 312.442 4.055 20 0 DIADLO Cc1nc2ccc(C[N@@H+]3CCCC[C@@H]3c3ncc[nH]3)cc2s1 ZINC000426423359 338031922 /nfs/dbraw/zinc/03/19/22/338031922.db2.gz YOPXBBFIVUFTJN-OAHLLOKOSA-N 1 2 312.442 4.055 20 0 DIADLO Cc1nc2ccc(C[N@H+]3CCCC[C@@H]3c3ncc[nH]3)cc2s1 ZINC000426423359 338031923 /nfs/dbraw/zinc/03/19/23/338031923.db2.gz YOPXBBFIVUFTJN-OAHLLOKOSA-N 1 2 312.442 4.055 20 0 DIADLO Cc1c[nH+]cc(CCc2nc(Cc3ccc(C(C)C)cc3)no2)c1 ZINC000426450771 338032469 /nfs/dbraw/zinc/03/24/69/338032469.db2.gz NMUCRXFKLHEYMG-UHFFFAOYSA-N 1 2 321.424 4.272 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[NH+]1CCC(O)(C(F)F)CC1 ZINC000426468159 338032998 /nfs/dbraw/zinc/03/29/98/338032998.db2.gz LOCIMGGGGUNFRN-VIFPVBQESA-N 1 2 324.198 4.146 20 0 DIADLO CCCc1nc(C)c(C[N@@H+]2CCc3ccc(Cl)cc3C2)o1 ZINC000428295951 338046071 /nfs/dbraw/zinc/04/60/71/338046071.db2.gz MYQHCVWEYAFDDQ-UHFFFAOYSA-N 1 2 304.821 4.147 20 0 DIADLO CCCc1nc(C)c(C[N@H+]2CCc3ccc(Cl)cc3C2)o1 ZINC000428295951 338046072 /nfs/dbraw/zinc/04/60/72/338046072.db2.gz MYQHCVWEYAFDDQ-UHFFFAOYSA-N 1 2 304.821 4.147 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2cc(C)ccc2OC(F)F)n1 ZINC000428343401 338048076 /nfs/dbraw/zinc/04/80/76/338048076.db2.gz BPUPANAFAJCAAK-NSHDSACASA-N 1 2 312.385 4.212 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000428363816 338048846 /nfs/dbraw/zinc/04/88/46/338048846.db2.gz MDLMOWFYCNTYOD-MLGOLLRUSA-N 1 2 320.458 4.130 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000428363816 338048847 /nfs/dbraw/zinc/04/88/47/338048847.db2.gz MDLMOWFYCNTYOD-MLGOLLRUSA-N 1 2 320.458 4.130 20 0 DIADLO CCc1nc(C)c(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)o1 ZINC000428360831 338048905 /nfs/dbraw/zinc/04/89/05/338048905.db2.gz LFPQOYUZVLUBTK-NSHDSACASA-N 1 2 307.463 4.150 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)ncn1 ZINC000428441348 338051737 /nfs/dbraw/zinc/05/17/37/338051737.db2.gz HISMBEKYJUBLDV-LLVKDONJSA-N 1 2 310.228 4.285 20 0 DIADLO Cc1cc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)ncn1 ZINC000428441348 338051738 /nfs/dbraw/zinc/05/17/38/338051738.db2.gz HISMBEKYJUBLDV-LLVKDONJSA-N 1 2 310.228 4.285 20 0 DIADLO Cc1cc[nH+]c(N2CCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)c1 ZINC000428695011 338058707 /nfs/dbraw/zinc/05/87/07/338058707.db2.gz UXOCNQHBECLHRJ-HNNXBMFYSA-N 1 2 312.804 4.261 20 0 DIADLO Cn1ccnc1C[NH+]1CCC(c2ccc(Cl)cc2Cl)CC1 ZINC000428715801 338059363 /nfs/dbraw/zinc/05/93/63/338059363.db2.gz HFKRCUBRQYYBHA-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)cs1 ZINC000428736366 338060105 /nfs/dbraw/zinc/06/01/05/338060105.db2.gz ZBEPAJOERZELSH-DZGCQCFKSA-N 1 2 314.445 4.209 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)cs1 ZINC000428736366 338060106 /nfs/dbraw/zinc/06/01/06/338060106.db2.gz ZBEPAJOERZELSH-DZGCQCFKSA-N 1 2 314.445 4.209 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2noc(-c3ccccc3C)n2)c1C ZINC000428752080 338060437 /nfs/dbraw/zinc/06/04/37/338060437.db2.gz NWWIMXPHYRMXGA-UHFFFAOYSA-N 1 2 321.424 4.294 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2noc(-c3ccccc3C)n2)c1C ZINC000428752080 338060438 /nfs/dbraw/zinc/06/04/38/338060438.db2.gz NWWIMXPHYRMXGA-UHFFFAOYSA-N 1 2 321.424 4.294 20 0 DIADLO Fc1ccc2nc(CNc3cccc(-n4cc[nH+]c4)c3)sc2c1 ZINC000428846929 338062055 /nfs/dbraw/zinc/06/20/55/338062055.db2.gz DWQMLMLOOGXNON-UHFFFAOYSA-N 1 2 324.384 4.233 20 0 DIADLO Fc1ccc2nc(C[NH2+]Cc3cc(F)ccc3F)sc2c1 ZINC000428851789 338062458 /nfs/dbraw/zinc/06/24/58/338062458.db2.gz SLQPINUCYQYANB-UHFFFAOYSA-N 1 2 308.328 4.003 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2ccc(F)cc2s1)c1nc(C)cs1 ZINC000428861622 338062923 /nfs/dbraw/zinc/06/29/23/338062923.db2.gz KJDJOSXMFQHOHU-LLVKDONJSA-N 1 2 321.446 4.441 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2nc3ccc(F)cc3s2)s1 ZINC000428872104 338063716 /nfs/dbraw/zinc/06/37/16/338063716.db2.gz LOFGHGQJBZTHBU-VIFPVBQESA-N 1 2 307.419 4.051 20 0 DIADLO C[C@@H]([NH2+]Cc1cocn1)c1ccccc1OCc1ccccc1 ZINC000428872007 338063884 /nfs/dbraw/zinc/06/38/84/338063884.db2.gz NPYPWMQHOTVJKD-OAHLLOKOSA-N 1 2 308.381 4.104 20 0 DIADLO Fc1ccc2nc(C[NH2+]Cc3nc(C4CC4)cs3)sc2c1 ZINC000428877593 338064099 /nfs/dbraw/zinc/06/40/99/338064099.db2.gz WQFHEOVMMYZWQV-UHFFFAOYSA-N 1 2 319.430 4.059 20 0 DIADLO CCCc1nc(C)c(C[N@@H+]2CC[C@](F)(c3ccccc3F)C2)o1 ZINC000428939214 338065757 /nfs/dbraw/zinc/06/57/57/338065757.db2.gz MDQNNVSUCDQBCZ-GOSISDBHSA-N 1 2 320.383 4.145 20 0 DIADLO CCCc1nc(C)c(C[N@H+]2CC[C@](F)(c3ccccc3F)C2)o1 ZINC000428939214 338065758 /nfs/dbraw/zinc/06/57/58/338065758.db2.gz MDQNNVSUCDQBCZ-GOSISDBHSA-N 1 2 320.383 4.145 20 0 DIADLO CCc1nc(C)c(C[N@@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)o1 ZINC000428979348 338067642 /nfs/dbraw/zinc/06/76/42/338067642.db2.gz RCLVJICYACRDRK-KRWDZBQOSA-N 1 2 322.811 4.270 20 0 DIADLO CCc1nc(C)c(C[N@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)o1 ZINC000428979348 338067643 /nfs/dbraw/zinc/06/76/43/338067643.db2.gz RCLVJICYACRDRK-KRWDZBQOSA-N 1 2 322.811 4.270 20 0 DIADLO CCc1nc(C)c(C[N@@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)o1 ZINC000428979349 338067684 /nfs/dbraw/zinc/06/76/84/338067684.db2.gz RCLVJICYACRDRK-QGZVFWFLSA-N 1 2 322.811 4.270 20 0 DIADLO CCc1nc(C)c(C[N@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)o1 ZINC000428979349 338067685 /nfs/dbraw/zinc/06/76/85/338067685.db2.gz RCLVJICYACRDRK-QGZVFWFLSA-N 1 2 322.811 4.270 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC000429164447 338072385 /nfs/dbraw/zinc/07/23/85/338072385.db2.gz CQIWHYUBMSYCID-KBPBESRZSA-N 1 2 314.429 4.316 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC000429164447 338072386 /nfs/dbraw/zinc/07/23/86/338072386.db2.gz CQIWHYUBMSYCID-KBPBESRZSA-N 1 2 314.429 4.316 20 0 DIADLO Cc1ccc(C(=O)N(C)[C@@H]2CC[C@@H](C)C2)cc1Oc1cc[nH+]cc1 ZINC000429255821 338074950 /nfs/dbraw/zinc/07/49/50/338074950.db2.gz QSVPPSKXHXCELB-RHSMWYFYSA-N 1 2 324.424 4.443 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1nnc(-c3ccccc3)s1)CC2 ZINC000429558327 338083811 /nfs/dbraw/zinc/08/38/11/338083811.db2.gz FBYQEGQAVQZCKA-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1nnc(-c3ccccc3)s1)CC2 ZINC000429558327 338083812 /nfs/dbraw/zinc/08/38/12/338083812.db2.gz FBYQEGQAVQZCKA-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1csc(-c3ccco3)n1)CC2 ZINC000429558170 338083868 /nfs/dbraw/zinc/08/38/68/338083868.db2.gz IGCHZXPHUSWQKX-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1csc(-c3ccco3)n1)CC2 ZINC000429558170 338083869 /nfs/dbraw/zinc/08/38/69/338083869.db2.gz IGCHZXPHUSWQKX-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)no1 ZINC000429685751 338087265 /nfs/dbraw/zinc/08/72/65/338087265.db2.gz MKCFFIULHRZOGT-MRXNPFEDSA-N 1 2 316.470 4.262 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CCSC[C@@H]2c2ccccc2)no1 ZINC000429685751 338087266 /nfs/dbraw/zinc/08/72/66/338087266.db2.gz MKCFFIULHRZOGT-MRXNPFEDSA-N 1 2 316.470 4.262 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(F)c(Cl)c2)[C@@H]1c1cccnc1 ZINC000430092973 338096018 /nfs/dbraw/zinc/09/60/18/338096018.db2.gz BXXXEGYJEHUOMU-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(F)c(Cl)c2)[C@@H]1c1cccnc1 ZINC000430092973 338096019 /nfs/dbraw/zinc/09/60/19/338096019.db2.gz BXXXEGYJEHUOMU-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(F)c(Cl)c2)[C@H]1c1cccnc1 ZINC000430092971 338096037 /nfs/dbraw/zinc/09/60/37/338096037.db2.gz BXXXEGYJEHUOMU-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(F)c(Cl)c2)[C@H]1c1cccnc1 ZINC000430092971 338096038 /nfs/dbraw/zinc/09/60/38/338096038.db2.gz BXXXEGYJEHUOMU-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(-c3ccccc3)n[nH]2)[C@H]1c1cccnc1 ZINC000430095429 338096169 /nfs/dbraw/zinc/09/61/69/338096169.db2.gz AWRPTAJDANIXKP-IBGZPJMESA-N 1 2 318.424 4.055 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(-c3ccccc3)n[nH]2)[C@H]1c1cccnc1 ZINC000430095429 338096170 /nfs/dbraw/zinc/09/61/70/338096170.db2.gz AWRPTAJDANIXKP-IBGZPJMESA-N 1 2 318.424 4.055 20 0 DIADLO CC1(C)C[N@H+](C/C=C/c2ccc(F)cc2F)[C@@H]1c1cccnc1 ZINC000430095569 338096315 /nfs/dbraw/zinc/09/63/15/338096315.db2.gz PUKCHTXEDQYOBO-MJICGBHWSA-N 1 2 314.379 4.456 20 0 DIADLO CC1(C)C[N@@H+](C/C=C/c2ccc(F)cc2F)[C@@H]1c1cccnc1 ZINC000430095569 338096316 /nfs/dbraw/zinc/09/63/16/338096316.db2.gz PUKCHTXEDQYOBO-MJICGBHWSA-N 1 2 314.379 4.456 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc3c2OC(C)(C)C3)[C@H]1c1cccnc1 ZINC000430106013 338096967 /nfs/dbraw/zinc/09/69/67/338096967.db2.gz MNUGBAHCVWJBBL-IBGZPJMESA-N 1 2 322.452 4.378 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc3c2OC(C)(C)C3)[C@H]1c1cccnc1 ZINC000430106013 338096968 /nfs/dbraw/zinc/09/69/68/338096968.db2.gz MNUGBAHCVWJBBL-IBGZPJMESA-N 1 2 322.452 4.378 20 0 DIADLO CC(C)Cc1ncc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccnc2)s1 ZINC000430106391 338097072 /nfs/dbraw/zinc/09/70/72/338097072.db2.gz NIPUCKQAEGEIQL-KRWDZBQOSA-N 1 2 315.486 4.320 20 0 DIADLO CC(C)Cc1ncc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)s1 ZINC000430106391 338097073 /nfs/dbraw/zinc/09/70/73/338097073.db2.gz NIPUCKQAEGEIQL-KRWDZBQOSA-N 1 2 315.486 4.320 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(Cl)c(F)c2)[C@@H]1c1cccnc1 ZINC000430111800 338097580 /nfs/dbraw/zinc/09/75/80/338097580.db2.gz UTHAYURSGFBPQF-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(Cl)c(F)c2)[C@@H]1c1cccnc1 ZINC000430111800 338097581 /nfs/dbraw/zinc/09/75/81/338097581.db2.gz UTHAYURSGFBPQF-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO Clc1scc(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)c1Cl ZINC000430142767 338099025 /nfs/dbraw/zinc/09/90/25/338099025.db2.gz DEXCRBGQYSUUJS-NSHDSACASA-N 1 2 320.285 4.303 20 0 DIADLO Clc1scc(C[N@H+]2CCOC[C@@H](C3CCC3)C2)c1Cl ZINC000430142767 338099026 /nfs/dbraw/zinc/09/90/26/338099026.db2.gz DEXCRBGQYSUUJS-NSHDSACASA-N 1 2 320.285 4.303 20 0 DIADLO C[C@@H]1C[C@@H](Nc2cccc(C[N@H+](C)Cc3cscn3)c2)[C@H]1C ZINC000430228515 338102168 /nfs/dbraw/zinc/10/21/68/338102168.db2.gz QVOWFBHDQSNFIG-QWQRMKEZSA-N 1 2 315.486 4.232 20 0 DIADLO C[C@@H]1C[C@@H](Nc2cccc(C[N@@H+](C)Cc3cscn3)c2)[C@H]1C ZINC000430228515 338102169 /nfs/dbraw/zinc/10/21/69/338102169.db2.gz QVOWFBHDQSNFIG-QWQRMKEZSA-N 1 2 315.486 4.232 20 0 DIADLO C[N@H+](Cc1ccccn1)Cc1cc(Cl)ccc1OCC1CC1 ZINC000430755253 338113812 /nfs/dbraw/zinc/11/38/12/338113812.db2.gz HQOMTFZYAHTFJL-UHFFFAOYSA-N 1 2 316.832 4.156 20 0 DIADLO C[N@@H+](Cc1ccccn1)Cc1cc(Cl)ccc1OCC1CC1 ZINC000430755253 338113813 /nfs/dbraw/zinc/11/38/13/338113813.db2.gz HQOMTFZYAHTFJL-UHFFFAOYSA-N 1 2 316.832 4.156 20 0 DIADLO c1cc([C@H]2C[N@H+](CCSCc3ccccc3)CCO2)cs1 ZINC000430755684 338113837 /nfs/dbraw/zinc/11/38/37/338113837.db2.gz RETAVGONSPSMHY-QGZVFWFLSA-N 1 2 319.495 4.055 20 0 DIADLO c1cc([C@H]2C[N@@H+](CCSCc3ccccc3)CCO2)cs1 ZINC000430755684 338113838 /nfs/dbraw/zinc/11/38/38/338113838.db2.gz RETAVGONSPSMHY-QGZVFWFLSA-N 1 2 319.495 4.055 20 0 DIADLO C[C@H]1[C@@H](c2ccccc2)[C@H]1C(=O)Nc1c[nH+]ccc1OC(C)(C)C ZINC000430800037 338115442 /nfs/dbraw/zinc/11/54/42/338115442.db2.gz OBFWKUXOIORSRY-KKXDTOCCSA-N 1 2 324.424 4.247 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1ccsc1Cl ZINC000430863363 338117232 /nfs/dbraw/zinc/11/72/32/338117232.db2.gz HKBLSBHPMDJXBT-CYBMUJFWSA-N 1 2 309.866 4.345 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1cnc(C(C)C)s1 ZINC000430879702 338118060 /nfs/dbraw/zinc/11/80/60/338118060.db2.gz UVPCEVLMYICUST-OAHLLOKOSA-N 1 2 318.490 4.210 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1cnc(C(C)C)s1 ZINC000430879702 338118061 /nfs/dbraw/zinc/11/80/61/338118061.db2.gz UVPCEVLMYICUST-OAHLLOKOSA-N 1 2 318.490 4.210 20 0 DIADLO COC(=O)c1cc([C@@H](C)SCc2ccc(C)[nH+]c2C)oc1C ZINC000431082459 338121921 /nfs/dbraw/zinc/12/19/21/338121921.db2.gz UOYMDXQJJIKSAQ-CYBMUJFWSA-N 1 2 319.426 4.381 20 0 DIADLO COC(=O)c1cc([C@H](C)SCc2ccc(C)[nH+]c2C)oc1C ZINC000431082460 338121945 /nfs/dbraw/zinc/12/19/45/338121945.db2.gz UOYMDXQJJIKSAQ-ZDUSSCGKSA-N 1 2 319.426 4.381 20 0 DIADLO Cc1ccc(NC(=O)N[C@H]2CC(C)(C)c3ccccc32)c(C)[nH+]1 ZINC000431801794 338139121 /nfs/dbraw/zinc/13/91/21/338139121.db2.gz QBYOZWKBYODTJT-KRWDZBQOSA-N 1 2 309.413 4.243 20 0 DIADLO Cc1cccc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)n1 ZINC000432024480 338143837 /nfs/dbraw/zinc/14/38/37/338143837.db2.gz FRPBKRILCPAAMD-GOSISDBHSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1cccc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)n1 ZINC000432024480 338143838 /nfs/dbraw/zinc/14/38/38/338143838.db2.gz FRPBKRILCPAAMD-GOSISDBHSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1cc(NCc2ccc3c(c2)COC3)c2cccc(F)c2[nH+]1 ZINC000432032482 338144062 /nfs/dbraw/zinc/14/40/62/338144062.db2.gz OLKVPILZTGMWSZ-UHFFFAOYSA-N 1 2 308.356 4.325 20 0 DIADLO CCN(c1ccccc1)c1cc(N[C@H](C)c2ccccn2)[nH+]cn1 ZINC000432137736 338146737 /nfs/dbraw/zinc/14/67/37/338146737.db2.gz FZKMXQCSSBKFBH-OAHLLOKOSA-N 1 2 319.412 4.203 20 0 DIADLO FC(F)(F)c1cccnc1CSCc1cn2ccccc2[nH+]1 ZINC000432244716 338150265 /nfs/dbraw/zinc/15/02/65/338150265.db2.gz DSTLMHLNCVVBCV-UHFFFAOYSA-N 1 2 323.343 4.182 20 0 DIADLO COC[C@@H]([NH2+]Cc1csc(Cl)c1Cl)c1ccco1 ZINC000432252717 338151088 /nfs/dbraw/zinc/15/10/88/338151088.db2.gz ZSSANMZUZPLTSM-SECBINFHSA-N 1 2 306.214 4.125 20 0 DIADLO Cc1nn(C)cc1CNc1ccc(-c2ccc(Cl)s2)c[nH+]1 ZINC000432731684 338164727 /nfs/dbraw/zinc/16/47/27/338164727.db2.gz ZBDAXXJFKNWPFH-UHFFFAOYSA-N 1 2 318.833 4.118 20 0 DIADLO FC(F)(F)c1ccc([C@@H]2CCCC[N@@H+]2Cc2cocn2)cc1 ZINC000432737106 338165139 /nfs/dbraw/zinc/16/51/39/338165139.db2.gz AMACHIVQYUBZRZ-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1ccc([C@@H]2CCCC[N@H+]2Cc2cocn2)cc1 ZINC000432737106 338165140 /nfs/dbraw/zinc/16/51/40/338165140.db2.gz AMACHIVQYUBZRZ-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO Cc1ccc(-c2ccc(CNc3cccc(CO)[nH+]3)s2)cc1 ZINC000432737458 338165197 /nfs/dbraw/zinc/16/51/97/338165197.db2.gz LHFWTQQODXFJLZ-UHFFFAOYSA-N 1 2 310.422 4.223 20 0 DIADLO OCc1cccc(NCc2ccc(-c3ccccc3Cl)o2)[nH+]1 ZINC000432745460 338165835 /nfs/dbraw/zinc/16/58/35/338165835.db2.gz CKCTUFPHOVPTNF-UHFFFAOYSA-N 1 2 314.772 4.099 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1nnc(C(C)(C)C)[nH]1 ZINC000432795666 338168357 /nfs/dbraw/zinc/16/83/57/338168357.db2.gz XMCWOSOOIIIQHA-GFCCVEGCSA-N 1 2 312.417 4.008 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432915189 338172831 /nfs/dbraw/zinc/17/28/31/338172831.db2.gz DFKDLOHHPCCFDH-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432915189 338172832 /nfs/dbraw/zinc/17/28/32/338172832.db2.gz DFKDLOHHPCCFDH-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCC[N@@H+]2Cc2cocn2)c1 ZINC000432923384 338173269 /nfs/dbraw/zinc/17/32/69/338173269.db2.gz SFVQRXHIWIUENU-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCC[N@H+]2Cc2cocn2)c1 ZINC000432923384 338173270 /nfs/dbraw/zinc/17/32/70/338173270.db2.gz SFVQRXHIWIUENU-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1nnc(C(C)(C)C)[nH]1 ZINC000432935423 338174122 /nfs/dbraw/zinc/17/41/22/338174122.db2.gz CTXYIHJHMSTRSZ-LBPRGKRZSA-N 1 2 312.417 4.041 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nnc(C(C)(C)C)[nH]1 ZINC000432935423 338174123 /nfs/dbraw/zinc/17/41/23/338174123.db2.gz CTXYIHJHMSTRSZ-LBPRGKRZSA-N 1 2 312.417 4.041 20 0 DIADLO CCOc1ccccc1OCC[NH2+][C@@H](c1ccccc1)C(F)F ZINC000433040172 338177805 /nfs/dbraw/zinc/17/78/05/338177805.db2.gz PFAGVVAZNBSYII-KRWDZBQOSA-N 1 2 321.367 4.060 20 0 DIADLO FC(F)[C@@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1ccccc1 ZINC000433059922 338179251 /nfs/dbraw/zinc/17/92/51/338179251.db2.gz FKTAMFNQOLFDKC-HOTGVXAUSA-N 1 2 309.400 4.464 20 0 DIADLO COc1cc(NCc2ccc(N(C)C(C)C)[nH+]c2)ccc1Cl ZINC000433190850 338184957 /nfs/dbraw/zinc/18/49/57/338184957.db2.gz SFZBTTFZPPQMAC-UHFFFAOYSA-N 1 2 319.836 4.200 20 0 DIADLO Fc1cc(C[NH2+]Cc2ncc(Cl)s2)c(F)cc1Cl ZINC000433201823 338185588 /nfs/dbraw/zinc/18/55/88/338185588.db2.gz NSPLUORVACZVCY-UHFFFAOYSA-N 1 2 309.168 4.018 20 0 DIADLO CSc1ccc(C[NH2+]Cc2ncc(C(F)(F)F)s2)cc1 ZINC000433328254 338192634 /nfs/dbraw/zinc/19/26/34/338192634.db2.gz CYQMKDKQGRLERP-UHFFFAOYSA-N 1 2 318.389 4.174 20 0 DIADLO CC[C@@](C)([NH2+]Cc1ncc(C(F)(F)F)s1)c1nccs1 ZINC000433326796 338192655 /nfs/dbraw/zinc/19/26/55/338192655.db2.gz MJUPTOYPQUTGCD-LLVKDONJSA-N 1 2 321.393 4.033 20 0 DIADLO Cc1cc(C)cc(CCC(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)c1 ZINC000433754284 338200623 /nfs/dbraw/zinc/20/06/23/338200623.db2.gz SWNXYNUNIBMOPM-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO CC(C)c1nc(N2CCC[C@@]2(C)CCCO)cc(C(C)(C)C)[nH+]1 ZINC000433753071 338200780 /nfs/dbraw/zinc/20/07/80/338200780.db2.gz GAWLZGBWIUHJMR-IBGZPJMESA-N 1 2 319.493 4.029 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000433782944 338201661 /nfs/dbraw/zinc/20/16/61/338201661.db2.gz LRFIOQOHPLINEH-IAQYHMDHSA-N 1 2 307.825 4.333 20 0 DIADLO Cc1ccc([C@@H]2CCCN2c2[nH+]c(C)nc3[nH]ccc32)cc1C ZINC000433792849 338202065 /nfs/dbraw/zinc/20/20/65/338202065.db2.gz KCHASILWJOCUEB-KRWDZBQOSA-N 1 2 306.413 4.225 20 0 DIADLO CC(C)(C)c1cc(NCc2nccs2)nc(C(C)(C)C)[nH+]1 ZINC000153115296 338216588 /nfs/dbraw/zinc/21/65/88/338216588.db2.gz MOYPIRXXMDDHGS-UHFFFAOYSA-N 1 2 304.463 4.140 20 0 DIADLO CC(C)n1ncnc1C[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000434489377 338218210 /nfs/dbraw/zinc/21/82/10/338218210.db2.gz QHQCSWPLOCUYEB-JTQLQIEISA-N 1 2 313.232 4.017 20 0 DIADLO CC(C)c1ccc([S@](=O)Cc2[nH+]ccn2-c2ccccc2)cc1 ZINC000434640015 338222259 /nfs/dbraw/zinc/22/22/59/338222259.db2.gz XQAGYIFAUUHPHN-HSZRJFAPSA-N 1 2 324.449 4.304 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@@](C)(CCc3ccccc3)C2)no1 ZINC000434904525 338227734 /nfs/dbraw/zinc/22/77/34/338227734.db2.gz FUTBCAUBZOVVEH-LJQANCHMSA-N 1 2 313.445 4.038 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@@](C)(CCc3ccccc3)C2)no1 ZINC000434904525 338227735 /nfs/dbraw/zinc/22/77/35/338227735.db2.gz FUTBCAUBZOVVEH-LJQANCHMSA-N 1 2 313.445 4.038 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(Cc3ccccc3)n2)CCS1 ZINC000434909974 338227879 /nfs/dbraw/zinc/22/78/79/338227879.db2.gz RKAQPLOIWJUGML-UHFFFAOYSA-N 1 2 318.511 4.061 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(Cc3ccccc3)n2)CCS1 ZINC000434909974 338227880 /nfs/dbraw/zinc/22/78/80/338227880.db2.gz RKAQPLOIWJUGML-UHFFFAOYSA-N 1 2 318.511 4.061 20 0 DIADLO Fc1ccc(C[N@H+](Cc2cnc(-c3ccccc3)[nH]2)C2CC2)cc1 ZINC000434979958 338228568 /nfs/dbraw/zinc/22/85/68/338228568.db2.gz YZFXLSFQPRGGIF-UHFFFAOYSA-N 1 2 321.399 4.380 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2cnc(-c3ccccc3)[nH]2)C2CC2)cc1 ZINC000434979958 338228569 /nfs/dbraw/zinc/22/85/69/338228569.db2.gz YZFXLSFQPRGGIF-UHFFFAOYSA-N 1 2 321.399 4.380 20 0 DIADLO CC(C)C1(C)CC[NH+](Cc2ncc(C(F)(F)F)s2)CC1 ZINC000434983611 338228808 /nfs/dbraw/zinc/22/88/08/338228808.db2.gz SGGOXHICBFWJJU-UHFFFAOYSA-N 1 2 306.397 4.420 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)s1 ZINC000435126306 338232477 /nfs/dbraw/zinc/23/24/77/338232477.db2.gz LMVLCLSWUMQLRY-CQSZACIVSA-N 1 2 316.392 4.484 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCC[C@]3(CC=CCC3)C2)s1 ZINC000435126306 338232478 /nfs/dbraw/zinc/23/24/78/338232478.db2.gz LMVLCLSWUMQLRY-CQSZACIVSA-N 1 2 316.392 4.484 20 0 DIADLO C[N@H+](Cc1ncc(C(F)(F)F)s1)[C@H]1CCc2ccccc21 ZINC000435125331 338232494 /nfs/dbraw/zinc/23/24/94/338232494.db2.gz WJEAGJWLUCGQDG-LBPRGKRZSA-N 1 2 312.360 4.281 20 0 DIADLO C[N@@H+](Cc1ncc(C(F)(F)F)s1)[C@H]1CCc2ccccc21 ZINC000435125331 338232495 /nfs/dbraw/zinc/23/24/95/338232495.db2.gz WJEAGJWLUCGQDG-LBPRGKRZSA-N 1 2 312.360 4.281 20 0 DIADLO CC[N@H+](Cc1ncc(C(F)(F)F)s1)Cc1ccccc1C ZINC000435134515 338232850 /nfs/dbraw/zinc/23/28/50/338232850.db2.gz XKRJBYZXBJKRDQ-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CC[N@@H+](Cc1ncc(C(F)(F)F)s1)Cc1ccccc1C ZINC000435134515 338232851 /nfs/dbraw/zinc/23/28/51/338232851.db2.gz XKRJBYZXBJKRDQ-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO C[C@@H]1[C@@H](C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)[C@H]1c1ccccc1 ZINC000435679279 338245019 /nfs/dbraw/zinc/24/50/19/338245019.db2.gz XSUMUDBCQHEVCM-MORSLUCNSA-N 1 2 317.392 4.065 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)[C@@H](C)CC(C)(C)C ZINC000435981149 338254937 /nfs/dbraw/zinc/25/49/37/338254937.db2.gz IFWOGRMRVHCRHL-GJZGRUSLSA-N 1 2 305.466 4.029 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)[C@@H](C)CC(C)(C)C ZINC000435981153 338254949 /nfs/dbraw/zinc/25/49/49/338254949.db2.gz IFWOGRMRVHCRHL-LSDHHAIUSA-N 1 2 305.466 4.029 20 0 DIADLO O=C(Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)C1CCCC1 ZINC000436173564 338260620 /nfs/dbraw/zinc/26/06/20/338260620.db2.gz SBQPCXVKFDAASI-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO O=C(Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)c1cccs1 ZINC000436174205 338260639 /nfs/dbraw/zinc/26/06/39/338260639.db2.gz UNUYLWHUTHDADW-UHFFFAOYSA-N 1 2 323.421 4.200 20 0 DIADLO O=C(CC1CCCC1)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436175101 338260716 /nfs/dbraw/zinc/26/07/16/338260716.db2.gz YBUGXWVOQHZHAZ-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO CC[C@]1(C)C[C@@H]1C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436188720 338261172 /nfs/dbraw/zinc/26/11/72/338261172.db2.gz RZMNJRXHCBEAOR-YLJYHZDGSA-N 1 2 323.440 4.261 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1)c1csnn1 ZINC000436470074 338273334 /nfs/dbraw/zinc/27/33/34/338273334.db2.gz IAYIYQPQMSZMSD-QWHCGFSZSA-N 1 2 310.426 4.012 20 0 DIADLO CCc1ccc([C@H](C)NC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000436490445 338274028 /nfs/dbraw/zinc/27/40/28/338274028.db2.gz HBCFRBDHAPNIHV-AWEZNQCLSA-N 1 2 311.429 4.452 20 0 DIADLO Cc1cc(C)c(NC(=O)N(Cc2cccs2)C2CC2)c(C)[nH+]1 ZINC000436498008 338274285 /nfs/dbraw/zinc/27/42/85/338274285.db2.gz UJGNVVUZFCSMQS-UHFFFAOYSA-N 1 2 315.442 4.265 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@@H](C)[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC000436500319 338274482 /nfs/dbraw/zinc/27/44/82/338274482.db2.gz ZLGBQBRKLKWIFM-FZKQIMNGSA-N 1 2 309.413 4.232 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[NH+]3Cc4ccccc4C3)o2)cc1 ZINC000155490047 338283620 /nfs/dbraw/zinc/28/36/20/338283620.db2.gz FDJYGZBPTIRXSL-CQSZACIVSA-N 1 2 305.381 4.122 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc(C(C)C)c(O)cc3C)ccc2[nH+]1 ZINC000436866796 338290473 /nfs/dbraw/zinc/29/04/73/338290473.db2.gz ZDWQUYRJQCWHKU-UHFFFAOYSA-N 1 2 323.396 4.032 20 0 DIADLO Cc1ccc(CSCc2[nH+]ccn2CC(F)(F)F)cc1 ZINC000437261904 338305067 /nfs/dbraw/zinc/30/50/67/338305067.db2.gz IDPCTKXKQGQTQV-UHFFFAOYSA-N 1 2 300.349 4.187 20 0 DIADLO Fc1ccc(F)c(CSCc2[nH+]ccn2CC(F)(F)F)c1 ZINC000437296194 338306479 /nfs/dbraw/zinc/30/64/79/338306479.db2.gz RLUOVNYVNVWHEF-UHFFFAOYSA-N 1 2 322.302 4.157 20 0 DIADLO Cn1ncc(Cl)c1C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000437584981 338314808 /nfs/dbraw/zinc/31/48/08/338314808.db2.gz YYAOADMVTFAUTE-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1ncc(Cl)c1C[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000437584981 338314809 /nfs/dbraw/zinc/31/48/09/338314809.db2.gz YYAOADMVTFAUTE-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO Fc1cc(Cl)ccc1C[N@@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000437686954 338318401 /nfs/dbraw/zinc/31/84/01/338318401.db2.gz JGNTULSITQPVKH-MRXNPFEDSA-N 1 2 323.795 4.253 20 0 DIADLO Fc1cc(Cl)ccc1C[N@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000437686954 338318402 /nfs/dbraw/zinc/31/84/02/338318402.db2.gz JGNTULSITQPVKH-MRXNPFEDSA-N 1 2 323.795 4.253 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3cccc(O)c3)co2)cc1 ZINC000155953556 338322891 /nfs/dbraw/zinc/32/28/91/338322891.db2.gz DPTCTVHPVOVGTQ-CQSZACIVSA-N 1 2 308.381 4.206 20 0 DIADLO Fc1cc(F)cc(CSCc2[nH+]ccn2CC(F)(F)F)c1 ZINC000437924447 338325389 /nfs/dbraw/zinc/32/53/89/338325389.db2.gz AVNJASGSMYEAFF-UHFFFAOYSA-N 1 2 322.302 4.157 20 0 DIADLO COCC1=CC[N@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)CC1 ZINC000437988760 338327495 /nfs/dbraw/zinc/32/74/95/338327495.db2.gz UDUCBFAYYSBKPK-UHFFFAOYSA-N 1 2 319.754 4.137 20 0 DIADLO COCC1=CC[N@@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)CC1 ZINC000437988760 338327496 /nfs/dbraw/zinc/32/74/96/338327496.db2.gz UDUCBFAYYSBKPK-UHFFFAOYSA-N 1 2 319.754 4.137 20 0 DIADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1ccc(Cl)cc1F ZINC000438109313 338332207 /nfs/dbraw/zinc/33/22/07/338332207.db2.gz JSXQIVHOMBQPOZ-UHFFFAOYSA-N 1 2 301.192 4.103 20 0 DIADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1ccc(Cl)cc1F ZINC000438109313 338332208 /nfs/dbraw/zinc/33/22/08/338332208.db2.gz JSXQIVHOMBQPOZ-UHFFFAOYSA-N 1 2 301.192 4.103 20 0 DIADLO Cc1cc(C)c(NCc2c[nH+]cn2Cc2ccccc2)c(C)c1 ZINC000438311839 338339347 /nfs/dbraw/zinc/33/93/47/338339347.db2.gz LVLSESOTOCUHMW-UHFFFAOYSA-N 1 2 305.425 4.469 20 0 DIADLO C[C@H]1CO[C@H](c2cccc(Cl)c2)C[N@@H+]1Cc1cccc(O)c1 ZINC000438538404 338347411 /nfs/dbraw/zinc/34/74/11/338347411.db2.gz CPCKXRZZVFQBOH-UGSOOPFHSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@H]1CO[C@H](c2cccc(Cl)c2)C[N@H+]1Cc1cccc(O)c1 ZINC000438538404 338347412 /nfs/dbraw/zinc/34/74/12/338347412.db2.gz CPCKXRZZVFQBOH-UGSOOPFHSA-N 1 2 317.816 4.008 20 0 DIADLO COc1ccnc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)c1 ZINC000438725011 338351231 /nfs/dbraw/zinc/35/12/31/338351231.db2.gz QAROBWLSBMOMGU-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1ccnc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)c1 ZINC000438725011 338351232 /nfs/dbraw/zinc/35/12/32/338351232.db2.gz QAROBWLSBMOMGU-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1cc[nH+]c(CN(Cc2ccco2)Cc2cccc(C)c2)c1 ZINC000438725011 338351233 /nfs/dbraw/zinc/35/12/33/338351233.db2.gz QAROBWLSBMOMGU-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1cc2[nH]c(-c3ccc(Oc4cnccn4)cc3)[nH+]c2cc1C ZINC000438826538 338352754 /nfs/dbraw/zinc/35/27/54/338352754.db2.gz DPTJHSUEDGLLSB-UHFFFAOYSA-N 1 2 316.364 4.429 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@H](c3ccccc3)C[C@H]2C)c(C)[nH+]1 ZINC000439447775 338369855 /nfs/dbraw/zinc/36/98/55/338369855.db2.gz FXUFIJKLJJTJEB-QAPCUYQASA-N 1 2 323.440 4.498 20 0 DIADLO COC(=O)[C@H]([NH2+][C@@H]1CC[C@@H]2CCC[C@@H]2C1)c1cccc(Cl)c1 ZINC000439616431 338374638 /nfs/dbraw/zinc/37/46/38/338374638.db2.gz JKSJMJWSIXIGEP-NSNWQYSKSA-N 1 2 321.848 4.113 20 0 DIADLO COC(=O)[C@H]([NH2+][C@@H]1CC[C@H]2CCC[C@H]2C1)c1cccc(Cl)c1 ZINC000439616430 338374676 /nfs/dbraw/zinc/37/46/76/338374676.db2.gz JKSJMJWSIXIGEP-DLTLXFJOSA-N 1 2 321.848 4.113 20 0 DIADLO CC[C@H](Nc1cnc2cc(Cl)c(Cl)cc2n1)c1[nH]cc[nH+]1 ZINC000439643010 338375224 /nfs/dbraw/zinc/37/52/24/338375224.db2.gz ISEQBMFPATVHMR-JTQLQIEISA-N 1 2 322.199 4.223 20 0 DIADLO CC(C)CC(C)(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000439826430 338379136 /nfs/dbraw/zinc/37/91/36/338379136.db2.gz YMXZMUWDMDTKKA-UHFFFAOYSA-N 1 2 303.381 4.022 20 0 DIADLO CC(C)(C)c1csc(C[NH2+]C2(c3ccc(F)cc3)CC2)n1 ZINC000440287427 338385029 /nfs/dbraw/zinc/38/50/29/338385029.db2.gz ZNRXCMJOPUTOAX-UHFFFAOYSA-N 1 2 304.434 4.359 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000440409746 338386876 /nfs/dbraw/zinc/38/68/76/338386876.db2.gz AVAOYOZPGAITTD-LBPRGKRZSA-N 1 2 304.459 4.339 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000440409746 338386877 /nfs/dbraw/zinc/38/68/77/338386877.db2.gz AVAOYOZPGAITTD-LBPRGKRZSA-N 1 2 304.459 4.339 20 0 DIADLO CC[C@@H](F)C[N@@H+]1CCCC[C@@H]1c1nc(-c2cccc(F)c2)c[nH]1 ZINC000440500164 338388604 /nfs/dbraw/zinc/38/86/04/338388604.db2.gz YJMIUGNMEUQFPD-RHSMWYFYSA-N 1 2 319.399 4.491 20 0 DIADLO CC[C@@H](F)C[N@H+]1CCCC[C@@H]1c1nc(-c2cccc(F)c2)c[nH]1 ZINC000440500164 338388605 /nfs/dbraw/zinc/38/86/05/338388605.db2.gz YJMIUGNMEUQFPD-RHSMWYFYSA-N 1 2 319.399 4.491 20 0 DIADLO Cc1ccc(/C=C/CC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000440524887 338389209 /nfs/dbraw/zinc/38/92/09/338389209.db2.gz LDIXTIGDMAWJRW-NSCUHMNNSA-N 1 2 317.392 4.223 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C(F)(F)F)n[nH]1)c1c(F)cccc1Cl ZINC000440624902 338392852 /nfs/dbraw/zinc/39/28/52/338392852.db2.gz BLVLCDGNHSDZRN-SSDOTTSWSA-N 1 2 321.705 4.072 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3cc(C4CC4)no3)cc2[nH+]1 ZINC000440691895 338395228 /nfs/dbraw/zinc/39/52/28/338395228.db2.gz LKZNZESXOAFMCE-UHFFFAOYSA-N 1 2 324.384 4.023 20 0 DIADLO CC[C@@H](F)C[N@@H+]1CCC[C@@H]1c1nc(-c2cccc(C)c2)c[nH]1 ZINC000440778120 338397180 /nfs/dbraw/zinc/39/71/80/338397180.db2.gz AGRPMMGWPHKHJH-NVXWUHKLSA-N 1 2 301.409 4.270 20 0 DIADLO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1nc(-c2cccc(C)c2)c[nH]1 ZINC000440778120 338397181 /nfs/dbraw/zinc/39/71/81/338397181.db2.gz AGRPMMGWPHKHJH-NVXWUHKLSA-N 1 2 301.409 4.270 20 0 DIADLO CCc1ccc(NC(=O)C[N@H+]([C@H](C)c2ccco2)C2CC2)cc1 ZINC000440912581 338399797 /nfs/dbraw/zinc/39/97/97/338399797.db2.gz WFAOVLQJHNXGDD-CQSZACIVSA-N 1 2 312.413 4.006 20 0 DIADLO CCc1ccc(NC(=O)C[N@@H+]([C@H](C)c2ccco2)C2CC2)cc1 ZINC000440912581 338399798 /nfs/dbraw/zinc/39/97/98/338399798.db2.gz WFAOVLQJHNXGDD-CQSZACIVSA-N 1 2 312.413 4.006 20 0 DIADLO Cc1cccn2cc(CNc3cc(Cl)cc(F)c3F)[nH+]c12 ZINC000442089993 338421217 /nfs/dbraw/zinc/42/12/17/338421217.db2.gz MTMWVYCRUNGKFA-UHFFFAOYSA-N 1 2 307.731 4.186 20 0 DIADLO CSc1ccccc1[C@H](C)[NH2+][C@@H](CO)c1c(F)cccc1F ZINC000442848778 338434476 /nfs/dbraw/zinc/43/44/76/338434476.db2.gz BFASENCKXUQRNZ-NHYWBVRUSA-N 1 2 323.408 4.071 20 0 DIADLO Cc1ccc(NC(=O)c2cc3c(s2)CC[C@H](C)C3)c(C)[nH+]1 ZINC000446436102 338528098 /nfs/dbraw/zinc/52/80/98/338528098.db2.gz LAZYWRILZPFILZ-JTQLQIEISA-N 1 2 300.427 4.137 20 0 DIADLO Cc1ccc(NC(=O)N(Cc2ccccc2F)C(C)C)c(C)[nH+]1 ZINC000447176220 338546880 /nfs/dbraw/zinc/54/68/80/338546880.db2.gz JVVGZALZRIIAAC-UHFFFAOYSA-N 1 2 315.392 4.280 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccccc2)c[nH]1)c1c(F)cccc1F ZINC000447829050 338568293 /nfs/dbraw/zinc/56/82/93/338568293.db2.gz GZSKZLFPLBVXOU-GFCCVEGCSA-N 1 2 313.351 4.206 20 0 DIADLO CCSCc1cc[nH+]c(NCc2ccnn2-c2ccccc2)c1 ZINC000447898218 338570974 /nfs/dbraw/zinc/57/09/74/338570974.db2.gz STMKNYMHTJDGTR-UHFFFAOYSA-N 1 2 324.453 4.133 20 0 DIADLO Clc1cc(CN2CCC[C@@H]2c2[nH]cc[nH+]2)c(Cl)s1 ZINC000449236400 338605160 /nfs/dbraw/zinc/60/51/60/338605160.db2.gz JYHMIDKPFKXGPT-SECBINFHSA-N 1 2 302.230 4.115 20 0 DIADLO Cn1cc[nH+]c1[C@@H]1N(Cc2cccc(C(F)(F)F)c2)CC1(C)C ZINC000449410771 338621936 /nfs/dbraw/zinc/62/19/36/338621936.db2.gz AGOKFOGDGNDYDA-AWEZNQCLSA-N 1 2 323.362 4.022 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@@H](C)n4ccnc43)o2)cc1 ZINC000449575296 338639209 /nfs/dbraw/zinc/63/92/09/338639209.db2.gz XPUHGSQBNOBIPY-RHSMWYFYSA-N 1 2 307.397 4.247 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)[C@H]1CCCCC1(F)F ZINC000450331409 338677989 /nfs/dbraw/zinc/67/79/89/338677989.db2.gz VLJMYLNYBVLJID-LLVKDONJSA-N 1 2 312.360 4.023 20 0 DIADLO COc1cccc2c1cc[nH+]c2NC[C@H](C)c1ncc(C)s1 ZINC000450436469 338684126 /nfs/dbraw/zinc/68/41/26/338684126.db2.gz GVRQDKGXKCCFNF-NSHDSACASA-N 1 2 313.426 4.224 20 0 DIADLO COc1cccc2c1cc[nH+]c2N1CCC(c2ccncc2)CC1 ZINC000450486235 338687119 /nfs/dbraw/zinc/68/71/19/338687119.db2.gz KSNAHIIAXWIDQE-UHFFFAOYSA-N 1 2 319.408 4.022 20 0 DIADLO CCc1nc(C)c(CNc2cc[nH+]c3cc(F)c(Cl)cc23)o1 ZINC000450543479 338690077 /nfs/dbraw/zinc/69/00/77/338690077.db2.gz XJVUZEIUAJWWDE-UHFFFAOYSA-N 1 2 319.767 4.498 20 0 DIADLO CC(C)Sc1ccc([C@@H](C)[NH2+][C@H](C)c2csnn2)cc1 ZINC000450666302 338697303 /nfs/dbraw/zinc/69/73/03/338697303.db2.gz HJRXQVUENREECU-VXGBXAGGSA-N 1 2 307.488 4.450 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc1 ZINC000450669825 338697451 /nfs/dbraw/zinc/69/74/51/338697451.db2.gz RCERVCVFHWJEOG-LBPRGKRZSA-N 1 2 317.458 4.054 20 0 DIADLO Cc1cc(N2CC[C@H](C(F)(F)F)C[C@H]2C)nc(C(C)C)[nH+]1 ZINC000450714918 338700608 /nfs/dbraw/zinc/70/06/08/338700608.db2.gz YNHNPSVJQGARNN-NEPJUHHUSA-N 1 2 301.356 4.076 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccc(F)c(Cl)c1)C1CC1)c1csnn1 ZINC000451358363 338731132 /nfs/dbraw/zinc/73/11/32/338731132.db2.gz URCTYMLPKXOTSY-XLKFXECMSA-N 1 2 311.813 4.133 20 0 DIADLO CCC[C@@H]1CCC[C@H]1C(=O)N1CCCC[C@H]1c1[nH+]ccn1CC ZINC000451388462 338732286 /nfs/dbraw/zinc/73/22/86/338732286.db2.gz CBXMBPCTXYJJLM-ZACQAIPSSA-N 1 2 317.477 4.173 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1 ZINC000451398322 338732751 /nfs/dbraw/zinc/73/27/51/338732751.db2.gz WDOUWULSKSWRIR-NXOAAHMSSA-N 1 2 317.477 4.029 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CNc1cc(CO)ccc1Cl ZINC000453078491 338791211 /nfs/dbraw/zinc/79/12/11/338791211.db2.gz IKDJHJGIZYNDJT-UHFFFAOYSA-N 1 2 304.821 4.271 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@H]1C[C@H](C)n2ccnc21 ZINC000453225847 338810618 /nfs/dbraw/zinc/81/06/18/338810618.db2.gz XIBXLQRWPNAZIH-QEJZJMRPSA-N 1 2 323.362 4.481 20 0 DIADLO COc1cc(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)ccc1C(F)(F)F ZINC000453232369 338811514 /nfs/dbraw/zinc/81/15/14/338811514.db2.gz WXDXATVXBMGFOV-BXKDBHETSA-N 1 2 311.307 4.028 20 0 DIADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1ccc(-c2ccccc2)o1 ZINC000453339315 338827347 /nfs/dbraw/zinc/82/73/47/338827347.db2.gz GLHFPMIJFPYUAZ-IJEWVQPXSA-N 1 2 307.397 4.500 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1OC(F)F ZINC000453358751 338830985 /nfs/dbraw/zinc/83/09/85/338830985.db2.gz QANIXZMVDCRWMZ-CHWSQXEVSA-N 1 2 323.387 4.225 20 0 DIADLO Cc1cc(Br)c(C[NH+]2CC3(CCC3(F)F)C2)s1 ZINC000453600626 338850029 /nfs/dbraw/zinc/85/00/29/338850029.db2.gz QMPWRMXKLSGGBR-UHFFFAOYSA-N 1 2 322.218 4.050 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2ccccc2C(C)(C)C)c[nH+]1 ZINC000454196515 338856780 /nfs/dbraw/zinc/85/67/80/338856780.db2.gz FRCOGJMXSPRSRN-UHFFFAOYSA-N 1 2 311.429 4.318 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2c(C)cccc2C(C)C)c[nH+]1 ZINC000454218566 338857900 /nfs/dbraw/zinc/85/79/00/338857900.db2.gz JNJKXKUUFXXJBA-UHFFFAOYSA-N 1 2 311.429 4.452 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC2(CCCC2)[C@@H]1C(C)C ZINC000455448100 338894780 /nfs/dbraw/zinc/89/47/80/338894780.db2.gz WDFAJSBICXJQCY-INIZCTEOSA-N 1 2 301.434 4.131 20 0 DIADLO COc1cc(NC(=O)Nc2c(C)cc(C)[nH+]c2C)c(C)cc1C ZINC000455467430 338895436 /nfs/dbraw/zinc/89/54/36/338895436.db2.gz BAVFIGMITBZZMI-UHFFFAOYSA-N 1 2 313.401 4.276 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@](C)(c3ccccc3)C2)c(C)[nH+]1 ZINC000455476710 338895725 /nfs/dbraw/zinc/89/57/25/338895725.db2.gz FAWUWXVIKWJLRY-HXUWFJFHSA-N 1 2 323.440 4.202 20 0 DIADLO Cc1cc(C)c(NC(=O)N([C@H](C)c2ccco2)C2CC2)c(C)[nH+]1 ZINC000455479305 338895789 /nfs/dbraw/zinc/89/57/89/338895789.db2.gz GGBYMZQJYSMSBX-CQSZACIVSA-N 1 2 313.401 4.357 20 0 DIADLO Cc1cccc([C@@H]2CCN(C(=O)Nc3c(C)cc(C)[nH+]c3C)C2)c1 ZINC000455478498 338895823 /nfs/dbraw/zinc/89/58/23/338895823.db2.gz GCOMKKGCPAHDTR-GOSISDBHSA-N 1 2 323.440 4.337 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@H](C(C)C)[C@H]2C(C)C)c(C)[nH+]1 ZINC000455493268 338896497 /nfs/dbraw/zinc/89/64/97/338896497.db2.gz CFASDLRSUOPVHS-NVXWUHKLSA-N 1 2 303.450 4.151 20 0 DIADLO CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455497102 338896617 /nfs/dbraw/zinc/89/66/17/338896617.db2.gz PSBHPTPOYKKHTR-WBMJQRKESA-N 1 2 303.450 4.439 20 0 DIADLO CCC[C@@H](CC1CCCC1)C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000456367660 338927835 /nfs/dbraw/zinc/92/78/35/338927835.db2.gz WYOZAPOFIDBSJV-HOCLYGCPSA-N 1 2 305.466 4.077 20 0 DIADLO CCC(C)(C)c1ccc(C(=O)N[C@H]2C[C@@H](C)n3cc[nH+]c32)cc1 ZINC000456439143 338930046 /nfs/dbraw/zinc/93/00/46/338930046.db2.gz XYNOGLVHGULRJR-CJNGLKHVSA-N 1 2 311.429 4.007 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C1CC(C(C)(C)C)C1 ZINC000457785069 338978905 /nfs/dbraw/zinc/97/89/05/338978905.db2.gz OBOMGFMSXAVAPB-UHFFFAOYSA-N 1 2 311.429 4.396 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)C1CC(C(C)(C)C)C1 ZINC000457795852 338979314 /nfs/dbraw/zinc/97/93/14/338979314.db2.gz XZDHRCBXVMIWQK-UYSNPLJNSA-N 1 2 317.477 4.029 20 0 DIADLO CCC(CC)N(CC(C)C)C(=O)NCc1c[nH+]c(C)cc1C ZINC000459067738 339012658 /nfs/dbraw/zinc/01/26/58/339012658.db2.gz BOOQACUHTQWYOV-UHFFFAOYSA-N 1 2 305.466 4.055 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cnc(C3CC3)nc2)C2CC2)o1 ZINC000459313155 339021004 /nfs/dbraw/zinc/02/10/04/339021004.db2.gz PCCXFDAJZPWDPP-ACJLOTCBSA-N 1 2 323.440 4.235 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cnc(C3CC3)nc2)C2CC2)o1 ZINC000459313155 339021005 /nfs/dbraw/zinc/02/10/05/339021005.db2.gz PCCXFDAJZPWDPP-ACJLOTCBSA-N 1 2 323.440 4.235 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cnc(C3CC3)nc2)C2CC2)o1 ZINC000459313158 339021067 /nfs/dbraw/zinc/02/10/67/339021067.db2.gz PCCXFDAJZPWDPP-UGSOOPFHSA-N 1 2 323.440 4.235 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cnc(C3CC3)nc2)C2CC2)o1 ZINC000459313158 339021068 /nfs/dbraw/zinc/02/10/68/339021068.db2.gz PCCXFDAJZPWDPP-UGSOOPFHSA-N 1 2 323.440 4.235 20 0 DIADLO Cc1ccc(NC(=O)N(C)[C@H]2CCC[C@H]2c2ccccc2)c(C)[nH+]1 ZINC000459433250 339028992 /nfs/dbraw/zinc/02/89/92/339028992.db2.gz LLYONBATGUXKJX-HKUYNNGSSA-N 1 2 323.440 4.498 20 0 DIADLO Cc1cc(C[NH2+]Cc2ccc(C)cc2O[C@H](C)CC(C)C)no1 ZINC000459438565 339029317 /nfs/dbraw/zinc/02/93/17/339029317.db2.gz HWZHOQPRNKNJDI-OAHLLOKOSA-N 1 2 316.445 4.395 20 0 DIADLO c1ccc(N2Cc3cccc(NC4CC5(CCC5)C4)c3C2)[nH+]c1 ZINC000459446536 339029615 /nfs/dbraw/zinc/02/96/15/339029615.db2.gz UNXDADIVTCPWRT-UHFFFAOYSA-N 1 2 305.425 4.346 20 0 DIADLO CC(C)(C)OCc1cc(C[NH2+]Cc2ccc(C3CC3)cc2)no1 ZINC000459509410 339033151 /nfs/dbraw/zinc/03/31/51/339033151.db2.gz XQKSNYIXUQFYBY-UHFFFAOYSA-N 1 2 314.429 4.157 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)n1 ZINC000459573528 339036772 /nfs/dbraw/zinc/03/67/72/339036772.db2.gz RCHOVEAFOLOEIJ-RHSMWYFYSA-N 1 2 311.429 4.310 20 0 DIADLO CCc1noc([C@@H](C)[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)n1 ZINC000459573528 339036773 /nfs/dbraw/zinc/03/67/73/339036773.db2.gz RCHOVEAFOLOEIJ-RHSMWYFYSA-N 1 2 311.429 4.310 20 0 DIADLO Cc1nnc(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)n1C1CC1 ZINC000459586726 339037374 /nfs/dbraw/zinc/03/73/74/339037374.db2.gz WEIZCSVXBYNLKM-IBGZPJMESA-N 1 2 322.456 4.039 20 0 DIADLO Cc1nnc(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)n1C1CC1 ZINC000459586726 339037375 /nfs/dbraw/zinc/03/73/75/339037375.db2.gz WEIZCSVXBYNLKM-IBGZPJMESA-N 1 2 322.456 4.039 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@@H](C)c2nc3c(s2)CCC3)n1 ZINC000459627429 339039220 /nfs/dbraw/zinc/03/92/20/339039220.db2.gz BMIRRCJQIRLFLJ-LBPRGKRZSA-N 1 2 318.490 4.040 20 0 DIADLO C[C@H]1CCc2nc(C[NH+]3CC(C)(CC(F)(F)F)C3)sc2C1 ZINC000459630909 339039300 /nfs/dbraw/zinc/03/93/00/339039300.db2.gz BLJIEODDWKIPPS-JTQLQIEISA-N 1 2 318.408 4.042 20 0 DIADLO COc1ccc(C[NH2+][C@H](C)c2nc3c(s2)CCC3)c(Cl)c1 ZINC000459633540 339039428 /nfs/dbraw/zinc/03/94/28/339039428.db2.gz PBNKBBMYWLPFCT-SNVBAGLBSA-N 1 2 322.861 4.145 20 0 DIADLO CC1(CC(F)(F)F)C[NH+](Cc2cnc(-c3ccco3)s2)C1 ZINC000459642644 339039835 /nfs/dbraw/zinc/03/98/35/339039835.db2.gz SZOSKABAUGXAAI-UHFFFAOYSA-N 1 2 316.348 4.177 20 0 DIADLO C[C@H]([NH2+][C@@H](CCc1ccccc1)C(F)F)c1cncc(F)c1 ZINC000459646545 339040183 /nfs/dbraw/zinc/04/01/83/339040183.db2.gz IVLRASCBRMOLEK-LRDDRELGSA-N 1 2 308.347 4.138 20 0 DIADLO CC(C)(C)C1C[NH+](Cc2csc(COc3ccccc3)n2)C1 ZINC000459651577 339040601 /nfs/dbraw/zinc/04/06/01/339040601.db2.gz ZMNMIDPMZYJQDE-UHFFFAOYSA-N 1 2 316.470 4.200 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H](C)c2nc3c(s2)CCC3)s1 ZINC000459652872 339040707 /nfs/dbraw/zinc/04/07/07/339040707.db2.gz RADJIVSGEGCGAC-JTQLQIEISA-N 1 2 307.488 4.063 20 0 DIADLO Cc1ccc(C[NH2+]Cc2csc(Cl)c2Cl)nc1C ZINC000459656409 339040813 /nfs/dbraw/zinc/04/08/13/339040813.db2.gz ASWOJBVNCDZXOQ-UHFFFAOYSA-N 1 2 301.242 4.357 20 0 DIADLO Cc1cnc(C[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)n1C ZINC000459716927 339044049 /nfs/dbraw/zinc/04/40/49/339044049.db2.gz QKAWVFVOWCSLSP-IBGZPJMESA-N 1 2 309.457 4.236 20 0 DIADLO Cc1cnc(C[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)n1C ZINC000459716927 339044050 /nfs/dbraw/zinc/04/40/50/339044050.db2.gz QKAWVFVOWCSLSP-IBGZPJMESA-N 1 2 309.457 4.236 20 0 DIADLO Cc1c[nH+]c(CN2CC3(CCCCC3)[C@@H]2c2ccccc2)n1C ZINC000459716927 339044051 /nfs/dbraw/zinc/04/40/51/339044051.db2.gz QKAWVFVOWCSLSP-IBGZPJMESA-N 1 2 309.457 4.236 20 0 DIADLO C/C=C/COc1cccc(CC(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000459931940 339050733 /nfs/dbraw/zinc/05/07/33/339050733.db2.gz OVONRWUYAQZGMO-AATRIKPKSA-N 1 2 324.424 4.143 20 0 DIADLO C/C=C\COc1cccc(CC(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000459931941 339050794 /nfs/dbraw/zinc/05/07/94/339050794.db2.gz OVONRWUYAQZGMO-WAYWQWQTSA-N 1 2 324.424 4.143 20 0 DIADLO CSC1(C(=O)Nc2ccc3[nH]c(C4CCC4)[nH+]c3c2)CCC1 ZINC000580512010 339053514 /nfs/dbraw/zinc/05/35/14/339053514.db2.gz WJFMXNQJKMGOMN-UHFFFAOYSA-N 1 2 315.442 4.055 20 0 DIADLO O=C(CCCCCc1cccs1)Nc1cccc2[nH+]ccn21 ZINC000460337222 339055641 /nfs/dbraw/zinc/05/56/41/339055641.db2.gz XICRNFZFJAWYEZ-UHFFFAOYSA-N 1 2 313.426 4.137 20 0 DIADLO CCCCC[S@@](=O)CCCCCn1c(C)[nH+]c2ccccc21 ZINC000461798381 339067335 /nfs/dbraw/zinc/06/73/35/339067335.db2.gz SLSDMONPYZPVHQ-JOCHJYFZSA-N 1 2 320.502 4.454 20 0 DIADLO COC(=O)[C@H]([NH2+][C@H](C)c1ccc(Cl)c2ccccc21)C1CC1 ZINC000462352653 339076366 /nfs/dbraw/zinc/07/63/66/339076366.db2.gz AULHHLXYRSEDMU-PIGZYNQJSA-N 1 2 317.816 4.095 20 0 DIADLO c1ccc(COc2ccc[nH+]c2N[C@H]2CCO[C@H](C3CC3)C2)cc1 ZINC000462689880 339084160 /nfs/dbraw/zinc/08/41/60/339084160.db2.gz FWYJQYPFLGZZBI-HKUYNNGSSA-N 1 2 324.424 4.030 20 0 DIADLO O=C(N[C@@H]1CCCCC12CCCC2)c1cccc(-n2cc[nH+]c2)c1 ZINC000462982719 339099569 /nfs/dbraw/zinc/09/95/69/339099569.db2.gz XUQDUOMWJXEZGR-GOSISDBHSA-N 1 2 323.440 4.105 20 0 DIADLO O=C(N[C@H]1CCCCC12CCCC2)c1cccc(-n2cc[nH+]c2)c1 ZINC000462982720 339099630 /nfs/dbraw/zinc/09/96/30/339099630.db2.gz XUQDUOMWJXEZGR-SFHVURJKSA-N 1 2 323.440 4.105 20 0 DIADLO C[C@H](CC(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1)C(C)(C)C ZINC000463031253 339101778 /nfs/dbraw/zinc/10/17/78/339101778.db2.gz FMELWQVNBPURFL-HUUCEWRRSA-N 1 2 322.518 4.026 20 0 DIADLO CC(C)C[C@@H](C)CC(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000463031245 339101821 /nfs/dbraw/zinc/10/18/21/339101821.db2.gz FJWSIRFZMVBFAS-CVEARBPZSA-N 1 2 322.518 4.026 20 0 DIADLO C[C@@H](CC(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1)C(C)(C)C ZINC000463031252 339101855 /nfs/dbraw/zinc/10/18/55/339101855.db2.gz FMELWQVNBPURFL-GJZGRUSLSA-N 1 2 322.518 4.026 20 0 DIADLO CSc1ccc(OCCSc2[nH+]cc3ccccn32)cc1 ZINC000463042918 339102901 /nfs/dbraw/zinc/10/29/01/339102901.db2.gz IMPDAOMXNRHYDE-UHFFFAOYSA-N 1 2 316.451 4.227 20 0 DIADLO Cc1nc2ccccc2n1CCCCC[N@H+](CC(F)F)C1CC1 ZINC000463079463 339104907 /nfs/dbraw/zinc/10/49/07/339104907.db2.gz BXCBSZHVSWTVCU-UHFFFAOYSA-N 1 2 321.415 4.245 20 0 DIADLO Cc1nc2ccccc2n1CCCCC[N@@H+](CC(F)F)C1CC1 ZINC000463079463 339104908 /nfs/dbraw/zinc/10/49/08/339104908.db2.gz BXCBSZHVSWTVCU-UHFFFAOYSA-N 1 2 321.415 4.245 20 0 DIADLO Cc1cc(N2C[C@H](C)C[C@@H]2c2ccccc2F)nc(C2CC2)[nH+]1 ZINC000463088917 339105316 /nfs/dbraw/zinc/10/53/16/339105316.db2.gz YZHLFEINVZYPFR-SJKOYZFVSA-N 1 2 311.404 4.389 20 0 DIADLO CC(C)[C@H](C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000463116106 339106235 /nfs/dbraw/zinc/10/62/35/339106235.db2.gz MTJCENILOCJCBD-IBGZPJMESA-N 1 2 319.408 4.251 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CCC(F)(F)[C@@H](CO)C1 ZINC000463227465 339110490 /nfs/dbraw/zinc/11/04/90/339110490.db2.gz AXRDUUIUDZEZQW-GXSJLCMTSA-N 1 2 324.198 4.004 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCC(F)(F)[C@@H](CO)C1 ZINC000463227465 339110491 /nfs/dbraw/zinc/11/04/91/339110491.db2.gz AXRDUUIUDZEZQW-GXSJLCMTSA-N 1 2 324.198 4.004 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CCC(F)(F)[C@@H](CO)C1 ZINC000463227467 339110531 /nfs/dbraw/zinc/11/05/31/339110531.db2.gz AXRDUUIUDZEZQW-MWLCHTKSSA-N 1 2 324.198 4.004 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCC(F)(F)[C@@H](CO)C1 ZINC000463227467 339110532 /nfs/dbraw/zinc/11/05/32/339110532.db2.gz AXRDUUIUDZEZQW-MWLCHTKSSA-N 1 2 324.198 4.004 20 0 DIADLO Clc1cccc(C2CC[NH+](Cc3ccon3)CC2)c1Cl ZINC000463357130 339115581 /nfs/dbraw/zinc/11/55/81/339115581.db2.gz HAEHSKRZCSCFJP-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463411373 339116895 /nfs/dbraw/zinc/11/68/95/339116895.db2.gz FPXJZSAOXPBWPE-GFCCVEGCSA-N 1 2 315.363 4.279 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463411373 339116896 /nfs/dbraw/zinc/11/68/96/339116896.db2.gz FPXJZSAOXPBWPE-GFCCVEGCSA-N 1 2 315.363 4.279 20 0 DIADLO CC(C)c1nc(N2CCc3c(F)cc(F)cc3[C@@H]2C)cc[nH+]1 ZINC000463496118 339119558 /nfs/dbraw/zinc/11/95/58/339119558.db2.gz KQPGKXGZLLPBLK-NSHDSACASA-N 1 2 303.356 4.002 20 0 DIADLO c1ccc(-c2nnc(C[N@@H+]3CC[C@H]3c3ccccc3)s2)cc1 ZINC000464679110 339148554 /nfs/dbraw/zinc/14/85/54/339148554.db2.gz USOLVIQYDJGGOX-INIZCTEOSA-N 1 2 307.422 4.152 20 0 DIADLO c1ccc(-c2nnc(C[N@H+]3CC[C@H]3c3ccccc3)s2)cc1 ZINC000464679110 339148555 /nfs/dbraw/zinc/14/85/55/339148555.db2.gz USOLVIQYDJGGOX-INIZCTEOSA-N 1 2 307.422 4.152 20 0 DIADLO CC(C)(C)C1=CC[N@H+](Cc2nnc(-c3ccccc3)s2)CC1 ZINC000464689316 339148879 /nfs/dbraw/zinc/14/88/79/339148879.db2.gz JUXFJVWVCMJBQQ-UHFFFAOYSA-N 1 2 313.470 4.383 20 0 DIADLO CC(C)(C)C1=CC[N@@H+](Cc2nnc(-c3ccccc3)s2)CC1 ZINC000464689316 339148880 /nfs/dbraw/zinc/14/88/80/339148880.db2.gz JUXFJVWVCMJBQQ-UHFFFAOYSA-N 1 2 313.470 4.383 20 0 DIADLO CCCCc1noc(C[N@@H+]2CC[C@H](C)C[C@H]2c2ccc(C)o2)n1 ZINC000464834827 339156119 /nfs/dbraw/zinc/15/61/19/339156119.db2.gz HHXWEEBAWIUZLR-ZFWWWQNUSA-N 1 2 317.433 4.287 20 0 DIADLO CCCCc1noc(C[N@H+]2CC[C@H](C)C[C@H]2c2ccc(C)o2)n1 ZINC000464834827 339156120 /nfs/dbraw/zinc/15/61/20/339156120.db2.gz HHXWEEBAWIUZLR-ZFWWWQNUSA-N 1 2 317.433 4.287 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Cl)cc2)[C@H](c2ccccc2)CO1 ZINC000464842913 339157031 /nfs/dbraw/zinc/15/70/31/339157031.db2.gz NIMBFIPCWCUJGE-KSSFIOAISA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Cl)cc2)[C@H](c2ccccc2)CO1 ZINC000464842913 339157032 /nfs/dbraw/zinc/15/70/32/339157032.db2.gz NIMBFIPCWCUJGE-KSSFIOAISA-N 1 2 301.817 4.302 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccccc2Cl)[C@@H](c2ccccc2)CO1 ZINC000464854373 339158108 /nfs/dbraw/zinc/15/81/08/339158108.db2.gz SOTNNDBWLAVJHH-RDTXWAMCSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccccc2Cl)[C@@H](c2ccccc2)CO1 ZINC000464854373 339158109 /nfs/dbraw/zinc/15/81/09/339158109.db2.gz SOTNNDBWLAVJHH-RDTXWAMCSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccccc2Cl)[C@H](c2ccccc2)CO1 ZINC000464854371 339158147 /nfs/dbraw/zinc/15/81/47/339158147.db2.gz SOTNNDBWLAVJHH-KSSFIOAISA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccccc2Cl)[C@H](c2ccccc2)CO1 ZINC000464854371 339158148 /nfs/dbraw/zinc/15/81/48/339158148.db2.gz SOTNNDBWLAVJHH-KSSFIOAISA-N 1 2 301.817 4.302 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1nc2cc(F)ccc2o1)C(C)C ZINC000464874076 339159669 /nfs/dbraw/zinc/15/96/69/339159669.db2.gz BBRRKMDFJKRMGD-KRWDZBQOSA-N 1 2 313.376 4.157 20 0 DIADLO CC(C)c1nc(N2CCC(=Cc3ccccc3F)CC2)cc[nH+]1 ZINC000465051540 339166790 /nfs/dbraw/zinc/16/67/90/339166790.db2.gz XZZXNISNBAWRAT-UHFFFAOYSA-N 1 2 311.404 4.423 20 0 DIADLO CCC(C)(C)CC(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC000465081545 339167831 /nfs/dbraw/zinc/16/78/31/339167831.db2.gz WPEIDODMQNMVFV-CYBMUJFWSA-N 1 2 323.506 4.140 20 0 DIADLO CCC(C)(C)CC(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000465081545 339167832 /nfs/dbraw/zinc/16/78/32/339167832.db2.gz WPEIDODMQNMVFV-CYBMUJFWSA-N 1 2 323.506 4.140 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@@H](CO)c2cccc(Cl)c2F)o1 ZINC000466381859 339201739 /nfs/dbraw/zinc/20/17/39/339201739.db2.gz DKSUATBIWZDJBP-YVLXSGLVSA-N 1 2 323.795 4.019 20 0 DIADLO COc1ccc(OC)c(CNc2[nH+]cccc2-c2ccccc2)c1 ZINC000466617524 339210518 /nfs/dbraw/zinc/21/05/18/339210518.db2.gz JGUZWGJFMFVFBI-UHFFFAOYSA-N 1 2 320.392 4.378 20 0 DIADLO COc1cc(CNc2[nH+]cccc2-c2ccccc2)cc(OC)c1 ZINC000466633430 339211209 /nfs/dbraw/zinc/21/12/09/339211209.db2.gz DVSBIIXUWYGEEI-UHFFFAOYSA-N 1 2 320.392 4.378 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+]1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000467180122 339227291 /nfs/dbraw/zinc/22/72/91/339227291.db2.gz JEJWSOBACMJQCB-KBXCAEBGSA-N 1 2 301.817 4.475 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+]1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000467180122 339227292 /nfs/dbraw/zinc/22/72/92/339227292.db2.gz JEJWSOBACMJQCB-KBXCAEBGSA-N 1 2 301.817 4.475 20 0 DIADLO FC(F)(F)CCCC[N@@H+]1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000467194929 339227665 /nfs/dbraw/zinc/22/76/65/339227665.db2.gz LDIJOOLWPYRAEO-AWEZNQCLSA-N 1 2 321.770 4.446 20 0 DIADLO FC(F)(F)CCCC[N@H+]1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000467194929 339227666 /nfs/dbraw/zinc/22/76/66/339227666.db2.gz LDIJOOLWPYRAEO-AWEZNQCLSA-N 1 2 321.770 4.446 20 0 DIADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@H](Nc2cccc(CCCO)c2)C1 ZINC000467350879 339233224 /nfs/dbraw/zinc/23/32/24/339233224.db2.gz VSABGADATCILAO-QUCCMNQESA-N 1 2 324.468 4.453 20 0 DIADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@@H](Nc2cccc3c2OCO3)C1 ZINC000467355017 339233694 /nfs/dbraw/zinc/23/36/94/339233694.db2.gz ORBHQSIROVFPQR-HUUCEWRRSA-N 1 2 310.397 4.257 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@@H](CO)c2cccc(Cl)c2F)o1 ZINC000467415502 339237350 /nfs/dbraw/zinc/23/73/50/339237350.db2.gz YPUAUJDVGPOERJ-YGRLFVJLSA-N 1 2 311.784 4.019 20 0 DIADLO Fc1cccc2c3c([nH]c21)C[N@@H+](Cc1ccsc1)CCC3 ZINC000467538812 339241305 /nfs/dbraw/zinc/24/13/05/339241305.db2.gz AYFYNYPQROCQBQ-UHFFFAOYSA-N 1 2 300.402 4.317 20 0 DIADLO Fc1cccc2c3c([nH]c21)C[N@H+](Cc1ccsc1)CCC3 ZINC000467538812 339241306 /nfs/dbraw/zinc/24/13/06/339241306.db2.gz AYFYNYPQROCQBQ-UHFFFAOYSA-N 1 2 300.402 4.317 20 0 DIADLO FC(F)(F)c1ccccc1COc1cccc(-n2cc[nH+]c2)c1 ZINC000467799961 339246928 /nfs/dbraw/zinc/24/69/28/339246928.db2.gz REOXECHFFBZSTP-UHFFFAOYSA-N 1 2 318.298 4.470 20 0 DIADLO C[C@@H](C(=O)Nc1ccc[nH+]c1N(C)C)c1ccc2ccccc2c1 ZINC000467931117 339249488 /nfs/dbraw/zinc/24/94/88/339249488.db2.gz VMCUUOMMVKXZPW-CQSZACIVSA-N 1 2 319.408 4.043 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2ccc(F)cc21)c1ccc(F)cc1Cl ZINC000468030024 339251720 /nfs/dbraw/zinc/25/17/20/339251720.db2.gz IJCNXCNFGNBYDL-PSLIRLAXSA-N 1 2 309.743 4.403 20 0 DIADLO Cc1ccsc1C[N@@H+]1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000468692361 339268715 /nfs/dbraw/zinc/26/87/15/339268715.db2.gz CQXCJCSMMXXZLG-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccsc1C[N@H+]1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000468692361 339268716 /nfs/dbraw/zinc/26/87/16/339268716.db2.gz CQXCJCSMMXXZLG-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)o1 ZINC000468698289 339269054 /nfs/dbraw/zinc/26/90/54/339269054.db2.gz IBKOLQFAVXMSFI-QGZVFWFLSA-N 1 2 305.805 4.069 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)o1 ZINC000468698289 339269055 /nfs/dbraw/zinc/26/90/55/339269055.db2.gz IBKOLQFAVXMSFI-QGZVFWFLSA-N 1 2 305.805 4.069 20 0 DIADLO COc1cc[nH+]cc1NC(=O)c1sc2ccc(C)cc2c1C ZINC000468847239 339272641 /nfs/dbraw/zinc/27/26/41/339272641.db2.gz FQSPCJMEIIMPBV-UHFFFAOYSA-N 1 2 312.394 4.174 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)ccc1Cl ZINC000468989478 339276972 /nfs/dbraw/zinc/27/69/72/339276972.db2.gz QGECHBPRUXAGMP-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO CCC(CC)CC(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1 ZINC000469255043 339284252 /nfs/dbraw/zinc/28/42/52/339284252.db2.gz RNMLZXFJYQUXQB-UHFFFAOYSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1nc(C[NH+]2CCC(=Cc3ccc(F)c(F)c3)CC2)cs1 ZINC000469444366 339289608 /nfs/dbraw/zinc/28/96/08/339289608.db2.gz KFCFHRJASQTPSQ-UHFFFAOYSA-N 1 2 320.408 4.409 20 0 DIADLO Fc1cc(Cl)ccc1CNc1[nH+]cccc1OC(F)F ZINC000469459986 339290275 /nfs/dbraw/zinc/29/02/75/339290275.db2.gz AGLUWOFBKNYWFY-UHFFFAOYSA-N 1 2 302.683 4.088 20 0 DIADLO Fc1ccc(CNc2[nH+]cccc2OC(F)F)c(Cl)c1 ZINC000469463869 339290391 /nfs/dbraw/zinc/29/03/91/339290391.db2.gz BBCBCTZNJNNPAJ-UHFFFAOYSA-N 1 2 302.683 4.088 20 0 DIADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccccc1Oc1ccc(C)cc1 ZINC000469502618 339291936 /nfs/dbraw/zinc/29/19/36/339291936.db2.gz AGTBHLBPTVVDQQ-UHFFFAOYSA-N 1 2 321.380 4.000 20 0 DIADLO Cn1ccc(C[N@@H+]2CCCC[C@H]2c2cccc(C(F)(F)F)c2)n1 ZINC000469529716 339292685 /nfs/dbraw/zinc/29/26/85/339292685.db2.gz UJMZZNJBQJLARK-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1ccc(C[N@H+]2CCCC[C@H]2c2cccc(C(F)(F)F)c2)n1 ZINC000469529716 339292686 /nfs/dbraw/zinc/29/26/86/339292686.db2.gz UJMZZNJBQJLARK-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Fc1ccc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)nc1 ZINC000469591784 339293839 /nfs/dbraw/zinc/29/38/39/339293839.db2.gz XOUHRUHIQRXGGQ-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)nc1 ZINC000469591784 339293840 /nfs/dbraw/zinc/29/38/40/339293840.db2.gz XOUHRUHIQRXGGQ-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO Cc1cc(SCc2c[nH+]c3ccccn23)nc2ccccc12 ZINC000469804574 339301269 /nfs/dbraw/zinc/30/12/69/339301269.db2.gz PNIADAVWOCLCJY-UHFFFAOYSA-N 1 2 305.406 4.483 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)[C@@H](C)CCC(C)(C)C ZINC000469971897 339306154 /nfs/dbraw/zinc/30/61/54/339306154.db2.gz HDJLGMSVTGSWER-INIZCTEOSA-N 1 2 321.509 4.147 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cc(C)c(F)cc3Cl)cc2[nH+]1 ZINC000470158826 339312175 /nfs/dbraw/zinc/31/21/75/339312175.db2.gz PSWWTQBGUXKPTB-UHFFFAOYSA-N 1 2 317.751 4.225 20 0 DIADLO Cc1[nH]c2cc(NC(=O)c3cc(C)c(F)cc3Cl)ccc2[nH+]1 ZINC000470158826 339312176 /nfs/dbraw/zinc/31/21/76/339312176.db2.gz PSWWTQBGUXKPTB-UHFFFAOYSA-N 1 2 317.751 4.225 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470213306 339314487 /nfs/dbraw/zinc/31/44/87/339314487.db2.gz GLOSVKMHDGJQKE-PBFPGSCMSA-N 1 2 305.418 4.410 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470213306 339314488 /nfs/dbraw/zinc/31/44/88/339314488.db2.gz GLOSVKMHDGJQKE-PBFPGSCMSA-N 1 2 305.418 4.410 20 0 DIADLO C[C@@H](CCc1ccc(Cl)s1)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000470328730 339317348 /nfs/dbraw/zinc/31/73/48/339317348.db2.gz RJMLRZFSFXSTFH-QWRGUYRKSA-N 1 2 317.882 4.042 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](Cc3cccc(C(F)F)c3)CCO2)cc1 ZINC000470716590 339325844 /nfs/dbraw/zinc/32/58/44/339325844.db2.gz CVJDAOYPBKQJSL-QGZVFWFLSA-N 1 2 321.342 4.337 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](Cc3cccc(C(F)F)c3)CCO2)cc1 ZINC000470716590 339325845 /nfs/dbraw/zinc/32/58/45/339325845.db2.gz CVJDAOYPBKQJSL-QGZVFWFLSA-N 1 2 321.342 4.337 20 0 DIADLO CC[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)CC[C@H]1c1ccccc1 ZINC000470869345 339329607 /nfs/dbraw/zinc/32/96/07/339329607.db2.gz BDQUJYVEFWYYND-CRAIPNDOSA-N 1 2 307.441 4.374 20 0 DIADLO Fc1cccc2c1OCC[N@@H+](Cc1cccc(C(F)F)c1)C2 ZINC000470875662 339329861 /nfs/dbraw/zinc/32/98/61/339329861.db2.gz ZVQSVWXHHYQIIP-UHFFFAOYSA-N 1 2 307.315 4.158 20 0 DIADLO Fc1cccc2c1OCC[N@H+](Cc1cccc(C(F)F)c1)C2 ZINC000470875662 339329862 /nfs/dbraw/zinc/32/98/62/339329862.db2.gz ZVQSVWXHHYQIIP-UHFFFAOYSA-N 1 2 307.315 4.158 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc(C3CCCCC3)cs2)C[C@@H](C2CC2)O1 ZINC000470907594 339330875 /nfs/dbraw/zinc/33/08/75/339330875.db2.gz TYDUANDNRPHDFE-DYVFJYSZSA-N 1 2 320.502 4.190 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc(C3CCCCC3)cs2)C[C@@H](C2CC2)O1 ZINC000470907594 339330876 /nfs/dbraw/zinc/33/08/76/339330876.db2.gz TYDUANDNRPHDFE-DYVFJYSZSA-N 1 2 320.502 4.190 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@@H+]1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000470910538 339331072 /nfs/dbraw/zinc/33/10/72/339331072.db2.gz ILBUEQUHIXZHQM-BFQNTYOBSA-N 1 2 324.262 4.009 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@H+]1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000470910538 339331073 /nfs/dbraw/zinc/33/10/73/339331073.db2.gz ILBUEQUHIXZHQM-BFQNTYOBSA-N 1 2 324.262 4.009 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1coc(-c2cccs2)n1 ZINC000470942054 339331989 /nfs/dbraw/zinc/33/19/89/339331989.db2.gz AJFPCNIXPIJBBV-GXSJLCMTSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1coc(-c2cccs2)n1 ZINC000470942054 339331990 /nfs/dbraw/zinc/33/19/90/339331990.db2.gz AJFPCNIXPIJBBV-GXSJLCMTSA-N 1 2 316.348 4.176 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000471043798 339335414 /nfs/dbraw/zinc/33/54/14/339335414.db2.gz HXYYLOGIKMPVBB-XOBRGWDASA-N 1 2 323.415 4.388 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000471043798 339335415 /nfs/dbraw/zinc/33/54/15/339335415.db2.gz HXYYLOGIKMPVBB-XOBRGWDASA-N 1 2 323.415 4.388 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000471181939 339339616 /nfs/dbraw/zinc/33/96/16/339339616.db2.gz OYAWAZWLQNXEED-INIZCTEOSA-N 1 2 309.388 4.142 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000471181939 339339617 /nfs/dbraw/zinc/33/96/17/339339617.db2.gz OYAWAZWLQNXEED-INIZCTEOSA-N 1 2 309.388 4.142 20 0 DIADLO Cc1cc(Cl)ccc1NC(=O)C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000471187326 339339927 /nfs/dbraw/zinc/33/99/27/339339927.db2.gz PNDCNWOVUYVYMW-KRWDZBQOSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1cc(Cl)ccc1NC(=O)C[N@H+]1CC[C@H]1c1ccccc1 ZINC000471187326 339339928 /nfs/dbraw/zinc/33/99/28/339339928.db2.gz PNDCNWOVUYVYMW-KRWDZBQOSA-N 1 2 314.816 4.034 20 0 DIADLO CCOc1ccc(CN(C)c2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000471250182 339341207 /nfs/dbraw/zinc/34/12/07/339341207.db2.gz NWARJMPDWFWSCT-UHFFFAOYSA-N 1 2 310.319 4.136 20 0 DIADLO Cc1ccc2[nH]c(CNc3ccc(N4CCCC4)[nH+]c3)cc2c1C ZINC000471471007 339345594 /nfs/dbraw/zinc/34/55/94/339345594.db2.gz LDFCUZJEKVBUPN-UHFFFAOYSA-N 1 2 320.440 4.392 20 0 DIADLO CC(C)(C)c1[nH]c2ccc(NC(=O)C(C)(C)C(F)F)cc2[nH+]1 ZINC000471634957 339350107 /nfs/dbraw/zinc/35/01/07/339350107.db2.gz PANMUFYCTNHSOR-UHFFFAOYSA-N 1 2 309.360 4.090 20 0 DIADLO Cc1ccc2[nH+]c(CNc3ccc(C(=O)C(C)(C)C)cc3)cn2c1 ZINC000471659795 339350374 /nfs/dbraw/zinc/35/03/74/339350374.db2.gz SJAQREWQWOJJGO-UHFFFAOYSA-N 1 2 321.424 4.484 20 0 DIADLO Cc1cn2cc(NC(=O)c3coc4cc(C)c(C)cc34)ccc2[nH+]1 ZINC000471792424 339354291 /nfs/dbraw/zinc/35/42/91/339354291.db2.gz KJUMYWFEYZHOJN-UHFFFAOYSA-N 1 2 319.364 4.258 20 0 DIADLO Cc1ccc(CCC(=O)Nc2ccc3[nH]c(C4CCC4)[nH+]c3c2)o1 ZINC000471976511 339358522 /nfs/dbraw/zinc/35/85/22/339358522.db2.gz FJIPTJJETBAEIU-UHFFFAOYSA-N 1 2 323.396 4.303 20 0 DIADLO CCCOc1cc(C)ccc1C[NH2+]Cc1ncc(Cl)s1 ZINC000472042463 339360258 /nfs/dbraw/zinc/36/02/58/339360258.db2.gz DSURZJCIMJOUAN-UHFFFAOYSA-N 1 2 310.850 4.184 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3ncc(Cl)s3)CCC2)c(F)c1 ZINC000472056366 339361313 /nfs/dbraw/zinc/36/13/13/339361313.db2.gz UQXIWYRYHRSVLP-UHFFFAOYSA-N 1 2 314.788 4.244 20 0 DIADLO CC(C)([NH2+]Cc1ncc(Cl)s1)c1ccc(F)c(F)c1 ZINC000472056415 339361336 /nfs/dbraw/zinc/36/13/36/339361336.db2.gz VGJDESHRRDOUIH-UHFFFAOYSA-N 1 2 302.777 4.100 20 0 DIADLO COc1ccc2ccccc2c1C[NH2+]Cc1ncc(Cl)s1 ZINC000472077933 339362830 /nfs/dbraw/zinc/36/28/30/339362830.db2.gz KJIANPNTIDRHNR-UHFFFAOYSA-N 1 2 318.829 4.248 20 0 DIADLO CC(C)(C)C1CC[NH+](Cc2nc(C(F)(F)F)cs2)CC1 ZINC000472178586 339365389 /nfs/dbraw/zinc/36/53/89/339365389.db2.gz KHPIIKNTENUFGZ-UHFFFAOYSA-N 1 2 306.397 4.420 20 0 DIADLO CCCCc1noc(C[N@@H+]2CC[C@@H](C)[C@@H]2c2cccc(F)c2)n1 ZINC000472312446 339369507 /nfs/dbraw/zinc/36/95/07/339369507.db2.gz DTXQMAQINVGADI-FZKQIMNGSA-N 1 2 317.408 4.134 20 0 DIADLO CCCCc1noc(C[N@H+]2CC[C@@H](C)[C@@H]2c2cccc(F)c2)n1 ZINC000472312446 339369508 /nfs/dbraw/zinc/36/95/08/339369508.db2.gz DTXQMAQINVGADI-FZKQIMNGSA-N 1 2 317.408 4.134 20 0 DIADLO Fc1ccccc1SCC[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000472814256 339377844 /nfs/dbraw/zinc/37/78/44/339377844.db2.gz VPFAYVHWAFZJAR-CQSZACIVSA-N 1 2 323.458 4.053 20 0 DIADLO Fc1ccccc1SCC[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000472814256 339377845 /nfs/dbraw/zinc/37/78/45/339377845.db2.gz VPFAYVHWAFZJAR-CQSZACIVSA-N 1 2 323.458 4.053 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCSC[C@@H]2c2nccs2)cc1 ZINC000473070755 339380912 /nfs/dbraw/zinc/38/09/12/339380912.db2.gz FMKPRCOIWBHFMZ-MRXNPFEDSA-N 1 2 318.511 4.386 20 0 DIADLO CCCc1ccc(C[N@H+]2CCSC[C@@H]2c2nccs2)cc1 ZINC000473070755 339380913 /nfs/dbraw/zinc/38/09/13/339380913.db2.gz FMKPRCOIWBHFMZ-MRXNPFEDSA-N 1 2 318.511 4.386 20 0 DIADLO COc1cccc([C@@H]2C[C@H](C)C[N@@H+]2Cc2ncc(Cl)s2)c1 ZINC000473125283 339381555 /nfs/dbraw/zinc/38/15/55/339381555.db2.gz HQRNIOXITYUEND-FZMZJTMJSA-N 1 2 322.861 4.388 20 0 DIADLO COc1cccc([C@@H]2C[C@H](C)C[N@H+]2Cc2ncc(Cl)s2)c1 ZINC000473125283 339381556 /nfs/dbraw/zinc/38/15/56/339381556.db2.gz HQRNIOXITYUEND-FZMZJTMJSA-N 1 2 322.861 4.388 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ncc(Cl)s2)CC[C@H]1c1ccccc1 ZINC000473149109 339381572 /nfs/dbraw/zinc/38/15/72/339381572.db2.gz SLYLPVAPPJMQDI-TZMCWYRMSA-N 1 2 306.862 4.422 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ncc(Cl)s2)CC[C@H]1c1ccccc1 ZINC000473149109 339381573 /nfs/dbraw/zinc/38/15/73/339381573.db2.gz SLYLPVAPPJMQDI-TZMCWYRMSA-N 1 2 306.862 4.422 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc(C)c(Cl)c3F)cc2[nH+]1 ZINC000473670176 339390006 /nfs/dbraw/zinc/39/00/06/339390006.db2.gz IWDOMPRMVTXACU-UHFFFAOYSA-N 1 2 317.751 4.225 20 0 DIADLO Cc1[nH]c2cc(NC(=O)c3ccc(C)c(Cl)c3F)ccc2[nH+]1 ZINC000473670176 339390007 /nfs/dbraw/zinc/39/00/07/339390007.db2.gz IWDOMPRMVTXACU-UHFFFAOYSA-N 1 2 317.751 4.225 20 0 DIADLO C[C@@H](CCn1c[nH+]c2cc(F)c(F)cc21)OCc1ccccc1 ZINC000473681355 339390267 /nfs/dbraw/zinc/39/02/67/339390267.db2.gz XMSXRALJAHKTFL-ZDUSSCGKSA-N 1 2 316.351 4.310 20 0 DIADLO Cc1cc(N2CC[C@H](C)[C@@H]2c2cccc(F)c2)nc(C2CC2)[nH+]1 ZINC000474152954 339404599 /nfs/dbraw/zinc/40/45/99/339404599.db2.gz JOAVPKVLSCDVSA-KPZWWZAWSA-N 1 2 311.404 4.389 20 0 DIADLO CCc1cccc(F)c1CNc1cccc(-c2[nH+]ccn2C)c1 ZINC000474383244 339411727 /nfs/dbraw/zinc/41/17/27/339411727.db2.gz ADKZVKVKRDNCBA-UHFFFAOYSA-N 1 2 309.388 4.401 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)C1CCSCC1 ZINC000474878171 339429580 /nfs/dbraw/zinc/42/95/80/339429580.db2.gz JEFNSPMJGRQGFP-CQSZACIVSA-N 1 2 305.491 4.016 20 0 DIADLO Cc1ccc(CCCN[C@@H](CC(C)(C)C)C(F)(F)F)c[nH+]1 ZINC000474940690 339432408 /nfs/dbraw/zinc/43/24/08/339432408.db2.gz FRXXUMVOSHRQOO-AWEZNQCLSA-N 1 2 302.384 4.279 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1C(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000474961235 339433572 /nfs/dbraw/zinc/43/35/72/339433572.db2.gz CLHYNXZBYPWEPE-PBHICJAKSA-N 1 2 311.429 4.242 20 0 DIADLO CCC[C@@](C)(CC)C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000475106632 339438788 /nfs/dbraw/zinc/43/87/88/339438788.db2.gz CDFQYRXXAZHEFG-QGZVFWFLSA-N 1 2 323.506 4.284 20 0 DIADLO CC(C)[C@H]1C[C@H]1C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000476006389 339467282 /nfs/dbraw/zinc/46/72/82/339467282.db2.gz GMPPRTBKKBEJLS-QZTJIDSGSA-N 1 2 323.440 4.117 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1csc(Cl)c1 ZINC000477979098 339506619 /nfs/dbraw/zinc/50/66/19/339506619.db2.gz BDKQYTVNTKHKKH-UHFFFAOYSA-N 1 2 317.801 4.352 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)CCCc1ccccc1 ZINC000477991120 339506858 /nfs/dbraw/zinc/50/68/58/339506858.db2.gz QPXMCJMWBFJCIR-UHFFFAOYSA-N 1 2 319.408 4.347 20 0 DIADLO CC(C)[C@]1(C)C[C@@H]1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000478059713 339507687 /nfs/dbraw/zinc/50/76/87/339507687.db2.gz PCHCPZMMKDGXNZ-MJGOQNOKSA-N 1 2 310.397 4.495 20 0 DIADLO CC(C)Cn1ccnc1C[NH2+][C@@H](c1cc(F)ccc1F)C(C)C ZINC000479072199 339526857 /nfs/dbraw/zinc/52/68/57/339526857.db2.gz BBMAFDAKLUCVEC-GOSISDBHSA-N 1 2 321.415 4.304 20 0 DIADLO CCc1cc(NC(=O)c2cccc(Cn3cc[nH+]c3)c2)ccc1C ZINC000479450103 339535562 /nfs/dbraw/zinc/53/55/62/339535562.db2.gz ZSCMCRZSZHSJEY-UHFFFAOYSA-N 1 2 319.408 4.055 20 0 DIADLO C[C@H](CCCC(F)(F)F)Nc1ccc(N2CCCC2)c[nH+]1 ZINC000480177370 339562250 /nfs/dbraw/zinc/56/22/50/339562250.db2.gz HKUOQDWWBZPEKJ-GFCCVEGCSA-N 1 2 301.356 4.215 20 0 DIADLO CCCOc1ccccc1NCc1ccc(N(C)C(C)C)[nH+]c1 ZINC000480309403 339568571 /nfs/dbraw/zinc/56/85/71/339568571.db2.gz OUNCRQPTBQNPOM-UHFFFAOYSA-N 1 2 313.445 4.327 20 0 DIADLO COCCCC[C@H](Nc1cc[nH+]c2ccncc12)c1ccccc1 ZINC000480557629 339577415 /nfs/dbraw/zinc/57/74/15/339577415.db2.gz WSOBZIZTNLFZDW-SFHVURJKSA-N 1 2 321.424 4.022 20 0 DIADLO CO[C@]1(C)CCCN(c2cc(C(C)C)[nH+]c(C(C)C)n2)CC1 ZINC000480830261 339588470 /nfs/dbraw/zinc/58/84/70/339588470.db2.gz SWCUZNTVBBSNSP-GOSISDBHSA-N 1 2 305.466 4.119 20 0 DIADLO CO[C@@]1(C)CCCN(c2cc(C)[nH+]c3c(F)cccc23)CC1 ZINC000480830679 339588531 /nfs/dbraw/zinc/58/85/31/339588531.db2.gz UGFWGTXGRDERQF-SFHVURJKSA-N 1 2 302.393 4.078 20 0 DIADLO Cc1cc(N2CCO[C@H](c3ccccc3)C2)c2cccc(F)c2[nH+]1 ZINC000481699851 339610047 /nfs/dbraw/zinc/61/00/47/339610047.db2.gz XRVCFOFRLNOEPM-IBGZPJMESA-N 1 2 322.383 4.260 20 0 DIADLO CC[C@H](Nc1cc(C)[nH+]c2c(F)cccc12)C1CCOCC1 ZINC000482009468 339619641 /nfs/dbraw/zinc/61/96/41/339619641.db2.gz VCHKCDMWSFDLNM-INIZCTEOSA-N 1 2 302.393 4.299 20 0 DIADLO CCCOc1ccc(C(C)(C)[NH2+]Cc2noc(C(C)C)n2)cc1 ZINC000483272130 339658958 /nfs/dbraw/zinc/65/89/58/339658958.db2.gz PZSLVNOASIKNIT-UHFFFAOYSA-N 1 2 317.433 4.007 20 0 DIADLO CCc1ccc(CN(C(=O)Nc2c(C)cc[nH+]c2C)C2CC2)cc1 ZINC000485496082 339704432 /nfs/dbraw/zinc/70/44/32/339704432.db2.gz KANCMVDOVHEPHQ-UHFFFAOYSA-N 1 2 323.440 4.457 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc2ncsc2c1 ZINC000485851896 339714403 /nfs/dbraw/zinc/71/44/03/339714403.db2.gz WEYNWIDFDGRGEU-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO COC[C@@H](Nc1[nH+]c2ccccc2n1C)c1ccc(Cl)cc1 ZINC000486012649 339718540 /nfs/dbraw/zinc/71/85/40/339718540.db2.gz XVANVSDQMYCTJQ-OAHLLOKOSA-N 1 2 315.804 4.026 20 0 DIADLO CC(=O)c1ccccc1OCCOc1cc(C)[nH+]c2ccccc21 ZINC000486226169 339723617 /nfs/dbraw/zinc/72/36/17/339723617.db2.gz FEBFUGCCXZCRQR-UHFFFAOYSA-N 1 2 321.376 4.204 20 0 DIADLO CCOc1c(Cl)cccc1C[NH2+]Cc1ncc(CC)s1 ZINC000487313173 339750780 /nfs/dbraw/zinc/75/07/80/339750780.db2.gz ZBOQPCCHWVDMGJ-UHFFFAOYSA-N 1 2 310.850 4.047 20 0 DIADLO Cc1cc(NC(=O)[C@H]2[C@H](C)C2(F)F)ccc1Oc1cc[nH+]cc1 ZINC000487716340 339761721 /nfs/dbraw/zinc/76/17/21/339761721.db2.gz PLVIUSZGKWHQEN-XHDPSFHLSA-N 1 2 318.323 4.022 20 0 DIADLO C[C@H](CF)[NH2+][C@H](C(=O)c1c[nH]c2ccccc12)c1ccccc1 ZINC000487855044 339764180 /nfs/dbraw/zinc/76/41/80/339764180.db2.gz LDCABVJZVDUZKR-ACJLOTCBSA-N 1 2 310.372 4.040 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000488789549 339793673 /nfs/dbraw/zinc/79/36/73/339793673.db2.gz VAVYTYLLGKRXCC-HLLBOEOZSA-N 1 2 323.440 4.063 20 0 DIADLO CCN(Cc1[nH+]ccn1CC(F)(F)F)c1cc(C)ccc1C ZINC000489624366 339814455 /nfs/dbraw/zinc/81/44/55/339814455.db2.gz SFROWNZIPDBMNG-UHFFFAOYSA-N 1 2 311.351 4.089 20 0 DIADLO C[C@@H](Oc1ccc[nH+]c1NCc1cncc(F)c1)c1ccccc1 ZINC000489814807 339819125 /nfs/dbraw/zinc/81/91/25/339819125.db2.gz PFQTVRMCRWSVHF-CQSZACIVSA-N 1 2 323.371 4.368 20 0 DIADLO CCCc1csc(C[NH2+]Cc2cc(-c3ccccc3)on2)n1 ZINC000491582138 339867899 /nfs/dbraw/zinc/86/78/99/339867899.db2.gz UMCHXHJMWXZJFA-UHFFFAOYSA-N 1 2 313.426 4.040 20 0 DIADLO CCn1cc[nH+]c1/C=C/C(=O)Nc1ccccc1SC(C)C ZINC000492413882 339900004 /nfs/dbraw/zinc/90/00/04/339900004.db2.gz YQLKPGARNJLELV-MDZDMXLPSA-N 1 2 315.442 4.055 20 0 DIADLO CCCC[C@@H](CC)C(=O)N(C)[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000492492830 339902159 /nfs/dbraw/zinc/90/21/59/339902159.db2.gz XIGQSFZLWDUFBP-WBVHZDCISA-N 1 2 313.445 4.174 20 0 DIADLO Cc1ccc(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)cc1 ZINC000492579202 339904408 /nfs/dbraw/zinc/90/44/08/339904408.db2.gz KMPWYHYSOQZYLA-UHFFFAOYSA-N 1 2 304.349 4.435 20 0 DIADLO CCCc1csc(C[NH2+][C@H](c2ccccc2)c2cccnc2)n1 ZINC000494330425 339946806 /nfs/dbraw/zinc/94/68/06/339946806.db2.gz NZPJFZOGDCODML-LJQANCHMSA-N 1 2 323.465 4.370 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H](C)c2ccsc2)[nH+]1 ZINC000494601632 339954797 /nfs/dbraw/zinc/95/47/97/339954797.db2.gz KKXCEQUUCSHHOH-GFCCVEGCSA-N 1 2 311.410 4.189 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)C(=O)CC2CCCCCC2)c1C ZINC000495135497 339975955 /nfs/dbraw/zinc/97/59/55/339975955.db2.gz GSUPUSLALFEWJI-UHFFFAOYSA-N 1 2 318.461 4.026 20 0 DIADLO Cc1cc(N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)nc[nH+]1 ZINC000495460087 339985302 /nfs/dbraw/zinc/98/53/02/339985302.db2.gz ILQMAFMZVLADDC-AWEZNQCLSA-N 1 2 308.212 4.433 20 0 DIADLO CCN(c1cc(C)[nH+]cn1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000498950483 340026888 /nfs/dbraw/zinc/02/68/88/340026888.db2.gz RPRPWJNAPRLYAY-LBPRGKRZSA-N 1 2 309.335 4.391 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+]1CCOC2(CCC2)C1 ZINC000499244765 340033076 /nfs/dbraw/zinc/03/30/76/340033076.db2.gz RZOPIAOYIVRBRQ-LLVKDONJSA-N 1 2 300.229 4.309 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@H+]1CCOC2(CCC2)C1 ZINC000499244765 340033077 /nfs/dbraw/zinc/03/30/77/340033077.db2.gz RZOPIAOYIVRBRQ-LLVKDONJSA-N 1 2 300.229 4.309 20 0 DIADLO COc1cc[nH+]cc1NC(=O)c1cc2c(s1)CCCCCC2 ZINC000499805399 340045059 /nfs/dbraw/zinc/04/50/59/340045059.db2.gz WNWKZVPIHGELCJ-UHFFFAOYSA-N 1 2 316.426 4.063 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1ccc(SC)cc1)C(=O)OC(C)(C)C ZINC000500247327 340054017 /nfs/dbraw/zinc/05/40/17/340054017.db2.gz WXCUPFSRQCKDGL-SWLSCSKDSA-N 1 2 309.475 4.179 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@@H+]1Cc1ccc(Cl)cc1Cl ZINC000500385208 340056204 /nfs/dbraw/zinc/05/62/04/340056204.db2.gz QUXBAWBJABANKI-MRXNPFEDSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@H+]1Cc1ccc(Cl)cc1Cl ZINC000500385208 340056205 /nfs/dbraw/zinc/05/62/05/340056205.db2.gz QUXBAWBJABANKI-MRXNPFEDSA-N 1 2 324.255 4.454 20 0 DIADLO CCc1nc(C[NH2+][C@]2(c3ccc(Cl)cc3)C[C@@H]2C)cs1 ZINC000500417584 340057355 /nfs/dbraw/zinc/05/73/55/340057355.db2.gz TZEZEKZHJLHVBS-MEDUHNTESA-N 1 2 306.862 4.384 20 0 DIADLO C[C@H]1C[C@@]1([NH2+]Cc1ncc(Cl)s1)c1ccc(Cl)cc1 ZINC000500449911 340059135 /nfs/dbraw/zinc/05/91/35/340059135.db2.gz FAMVBWADYHCQLJ-XPTSAGLGSA-N 1 2 313.253 4.475 20 0 DIADLO Cc1[nH+]c(-c2ccncc2)nc(N(C)CC2CCCCC2)c1C ZINC000500452502 340059267 /nfs/dbraw/zinc/05/92/67/340059267.db2.gz AXJJAABHXWRIKE-UHFFFAOYSA-N 1 2 310.445 4.172 20 0 DIADLO C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C1(C(F)F)CC1 ZINC000500513090 340061347 /nfs/dbraw/zinc/06/13/47/340061347.db2.gz LVGFEDWYSDLCLK-CSKARUKUSA-N 1 2 305.290 4.496 20 0 DIADLO CCCCCOc1cc(C[NH2+]C2(C(F)F)CC2)ccc1OC ZINC000500535395 340061635 /nfs/dbraw/zinc/06/16/35/340061635.db2.gz QHPLSZJSJFOKHZ-UHFFFAOYSA-N 1 2 313.388 4.152 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1ccc2c(c1)CCCC2 ZINC000500720498 340065907 /nfs/dbraw/zinc/06/59/07/340065907.db2.gz XOOQDAQMHPSOEI-UHFFFAOYSA-N 1 2 317.392 4.003 20 0 DIADLO CCC1(CC)CN(C(=O)c2ccc3[nH+]ccn3c2)c2ccccc21 ZINC000500855197 340068541 /nfs/dbraw/zinc/06/85/41/340068541.db2.gz KLWRSXQNFCLRJQ-UHFFFAOYSA-N 1 2 319.408 4.053 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)Cc1coc2cc(C)c(C(C)C)cc12 ZINC000501171213 340075432 /nfs/dbraw/zinc/07/54/32/340075432.db2.gz FFYWQNYIIQEKJY-UHFFFAOYSA-N 1 2 322.408 4.171 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccc(OCC2CCCCC2)cc1 ZINC000501175844 340075557 /nfs/dbraw/zinc/07/55/57/340075557.db2.gz QXVYOSQKOUKSMJ-UHFFFAOYSA-N 1 2 324.424 4.023 20 0 DIADLO C[C@@H]1Cc2ccc(Br)cc2C[N@@H+]1CCC(F)(F)F ZINC000501415001 340080263 /nfs/dbraw/zinc/08/02/63/340080263.db2.gz CCQZWIFPEASTRY-SECBINFHSA-N 1 2 322.168 4.148 20 0 DIADLO C[C@@H]1Cc2ccc(Br)cc2C[N@H+]1CCC(F)(F)F ZINC000501415001 340080264 /nfs/dbraw/zinc/08/02/64/340080264.db2.gz CCQZWIFPEASTRY-SECBINFHSA-N 1 2 322.168 4.148 20 0 DIADLO CC(C)c1nc([C@@H]2CCCCC[N@@H+]2Cc2ccc(F)cc2)no1 ZINC000501710796 340087093 /nfs/dbraw/zinc/08/70/93/340087093.db2.gz CERJFUKMNLUYNN-INIZCTEOSA-N 1 2 317.408 4.449 20 0 DIADLO CC(C)c1nc([C@@H]2CCCCC[N@H+]2Cc2ccc(F)cc2)no1 ZINC000501710796 340087094 /nfs/dbraw/zinc/08/70/94/340087094.db2.gz CERJFUKMNLUYNN-INIZCTEOSA-N 1 2 317.408 4.449 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1nc2c(s1)CCC2 ZINC000502010815 340092859 /nfs/dbraw/zinc/09/28/59/340092859.db2.gz ACYAXVQPTNDQHI-UWVGGRQHSA-N 1 2 308.397 4.322 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1cc(F)ccc1F ZINC000502017761 340093085 /nfs/dbraw/zinc/09/30/85/340093085.db2.gz ODMREHKHXGGUCV-ZJUUUORDSA-N 1 2 308.397 4.322 20 0 DIADLO C/C(=C/c1ccccc1)C[NH2+]C1(c2noc(C)n2)CCCCC1 ZINC000502249129 340097688 /nfs/dbraw/zinc/09/76/88/340097688.db2.gz MROFGFXRNFOCMY-SQFISAMPSA-N 1 2 311.429 4.231 20 0 DIADLO COCC[C@H]1CCC[C@@H]1[NH2+]c1ccc(N2CCCC2)cc1C ZINC000502369454 340100867 /nfs/dbraw/zinc/10/08/67/340100867.db2.gz YAMZCGQARBVNKE-APWZRJJASA-N 1 2 302.462 4.212 20 0 DIADLO CC[C@H]1C[C@@]1([NH2+]Cc1nnc(-c2ccco2)o1)c1cccc(C)c1 ZINC000502482026 340105648 /nfs/dbraw/zinc/10/56/48/340105648.db2.gz OSHKHXIHZAHBBY-LIRRHRJNSA-N 1 2 323.396 4.053 20 0 DIADLO CC[C@H]1C[C@]1([NH2+]Cc1nnc(-c2ccco2)o1)c1cccc(C)c1 ZINC000502482024 340105689 /nfs/dbraw/zinc/10/56/89/340105689.db2.gz OSHKHXIHZAHBBY-IFXJQAMLSA-N 1 2 323.396 4.053 20 0 DIADLO CC[C@@H]1C[C@]1([NH2+]Cc1nnc(-c2ccco2)o1)c1cccc(C)c1 ZINC000502482023 340105741 /nfs/dbraw/zinc/10/57/41/340105741.db2.gz OSHKHXIHZAHBBY-AUUYWEPGSA-N 1 2 323.396 4.053 20 0 DIADLO CC[C@@H]1C[C@@]1([NH2+]Cc1noc(C(C)(C)C)n1)c1cccc(C)c1 ZINC000502529409 340107118 /nfs/dbraw/zinc/10/71/18/340107118.db2.gz NAZJZXFPXRYCBL-KUHUBIRLSA-N 1 2 313.445 4.091 20 0 DIADLO c1ccc2sc([C@@H]3COCC[N@H+]3CC3CCCCC3)nc2c1 ZINC000502937218 340117056 /nfs/dbraw/zinc/11/70/56/340117056.db2.gz WNBVFSJUPWOCKH-INIZCTEOSA-N 1 2 316.470 4.250 20 0 DIADLO c1ccc2sc([C@@H]3COCC[N@@H+]3CC3CCCCC3)nc2c1 ZINC000502937218 340117057 /nfs/dbraw/zinc/11/70/57/340117057.db2.gz WNBVFSJUPWOCKH-INIZCTEOSA-N 1 2 316.470 4.250 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+]C[C@H]1C[C@H]1c1ccccc1 ZINC000503010398 340118664 /nfs/dbraw/zinc/11/86/64/340118664.db2.gz IEIYHNIFBVYQEQ-QUCCMNQESA-N 1 2 322.452 4.047 20 0 DIADLO CCC(CC)C[N@@H+]1CCOC[C@@H]1c1nc2ccccc2s1 ZINC000503061517 340119955 /nfs/dbraw/zinc/11/99/55/340119955.db2.gz NKAPOQPEPVOJRU-OAHLLOKOSA-N 1 2 304.459 4.106 20 0 DIADLO CCC(CC)C[N@H+]1CCOC[C@@H]1c1nc2ccccc2s1 ZINC000503061517 340119956 /nfs/dbraw/zinc/11/99/56/340119956.db2.gz NKAPOQPEPVOJRU-OAHLLOKOSA-N 1 2 304.459 4.106 20 0 DIADLO CCc1cnc(C[N@@H+]2CC[C@@](F)(c3ccccc3C)C2)s1 ZINC000503099798 340121009 /nfs/dbraw/zinc/12/10/09/340121009.db2.gz DTIPGEGXQRWCGH-KRWDZBQOSA-N 1 2 304.434 4.085 20 0 DIADLO CCc1cnc(C[N@H+]2CC[C@@](F)(c3ccccc3C)C2)s1 ZINC000503099798 340121010 /nfs/dbraw/zinc/12/10/10/340121010.db2.gz DTIPGEGXQRWCGH-KRWDZBQOSA-N 1 2 304.434 4.085 20 0 DIADLO Cc1cc(NC(=O)c2cccs2)c[nH+]c1N1CCCC[C@H]1C ZINC000503168350 340122496 /nfs/dbraw/zinc/12/24/96/340122496.db2.gz ZYNPASRKEXRCGJ-CYBMUJFWSA-N 1 2 315.442 4.083 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2)c[nH+]c1N1CCCC[C@H]1C ZINC000503181286 340122750 /nfs/dbraw/zinc/12/27/50/340122750.db2.gz YHNMSMMSRMRORI-OAHLLOKOSA-N 1 2 309.413 4.021 20 0 DIADLO COCC[C@@H](Nc1cc(C)[nH+]c2c(F)cccc12)c1ccco1 ZINC000503293708 340124895 /nfs/dbraw/zinc/12/48/95/340124895.db2.gz BHOGYCZGTVRGCA-OAHLLOKOSA-N 1 2 314.360 4.465 20 0 DIADLO COCC[C@H](Nc1cc(C)[nH+]c2c(F)cccc12)c1ccco1 ZINC000503293707 340124964 /nfs/dbraw/zinc/12/49/64/340124964.db2.gz BHOGYCZGTVRGCA-HNNXBMFYSA-N 1 2 314.360 4.465 20 0 DIADLO C[C@H]1C[C@@]1([NH2+]Cc1ncc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000503395991 340127161 /nfs/dbraw/zinc/12/71/61/340127161.db2.gz WONDNJHADXTTTI-GTNSWQLSSA-N 1 2 302.805 4.230 20 0 DIADLO C[C@H]([NH2+]C1(C(F)F)CC1)c1ccc(F)c(Br)c1 ZINC000503912040 340136578 /nfs/dbraw/zinc/13/65/78/340136578.db2.gz QWVOTQAFMRXTAV-ZETCQYMHSA-N 1 2 308.141 4.037 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@@H]2c2ccc(C(C)C)cc2)cc[nH+]1 ZINC000504148065 340141861 /nfs/dbraw/zinc/14/18/61/340141861.db2.gz AGWSYMMVDBJKAT-LJQANCHMSA-N 1 2 323.440 4.304 20 0 DIADLO C[NH+](C)[C@H](c1nc(-c2ccsc2)no1)c1cccc(Cl)c1 ZINC000504235635 340143614 /nfs/dbraw/zinc/14/36/14/340143614.db2.gz KTBFKCKDHUIBJM-ZDUSSCGKSA-N 1 2 319.817 4.103 20 0 DIADLO C[NH+](C)[C@H](c1nc(C2CCCCC2)no1)c1cccc(Cl)c1 ZINC000504236019 340143654 /nfs/dbraw/zinc/14/36/54/340143654.db2.gz OAENXDDZZCICNH-HNNXBMFYSA-N 1 2 319.836 4.422 20 0 DIADLO CC[C@H](CC(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccccc1 ZINC000504930667 340156671 /nfs/dbraw/zinc/15/66/71/340156671.db2.gz RRHRWMGINVAQNF-MRXNPFEDSA-N 1 2 319.408 4.395 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3c(F)cccc3F)CCC2)c(F)c1 ZINC000505472772 340169198 /nfs/dbraw/zinc/16/91/98/340169198.db2.gz SZQSJLCOKWJJCG-UHFFFAOYSA-N 1 2 309.306 4.412 20 0 DIADLO Cc1cnc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000505609023 340172876 /nfs/dbraw/zinc/17/28/76/340172876.db2.gz IFIXJWSDHKAHBJ-LLVKDONJSA-N 1 2 310.228 4.285 20 0 DIADLO Cc1cnc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000505609023 340172877 /nfs/dbraw/zinc/17/28/77/340172877.db2.gz IFIXJWSDHKAHBJ-LLVKDONJSA-N 1 2 310.228 4.285 20 0 DIADLO CC[N@H+](CC(=O)Nc1cc(Cl)ccc1C)Cc1occc1C ZINC000505636808 340173790 /nfs/dbraw/zinc/17/37/90/340173790.db2.gz QTSDNIWAKPQSKL-UHFFFAOYSA-N 1 2 320.820 4.010 20 0 DIADLO CC[N@@H+](CC(=O)Nc1cc(Cl)ccc1C)Cc1occc1C ZINC000505636808 340173791 /nfs/dbraw/zinc/17/37/91/340173791.db2.gz QTSDNIWAKPQSKL-UHFFFAOYSA-N 1 2 320.820 4.010 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccccc1OCC(F)(F)F ZINC000505659804 340174534 /nfs/dbraw/zinc/17/45/34/340174534.db2.gz KISBUROTHQLKKS-ZDUSSCGKSA-N 1 2 324.346 4.006 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccccc1OCC(F)(F)F ZINC000505659804 340174535 /nfs/dbraw/zinc/17/45/35/340174535.db2.gz KISBUROTHQLKKS-ZDUSSCGKSA-N 1 2 324.346 4.006 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cnc(-c2ccccc2)s1 ZINC000505708106 340175347 /nfs/dbraw/zinc/17/53/47/340175347.db2.gz WOJNVQGLCHCMDX-CQSZACIVSA-N 1 2 309.438 4.188 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cnc(-c2ccccc2)s1 ZINC000505708106 340175348 /nfs/dbraw/zinc/17/53/48/340175348.db2.gz WOJNVQGLCHCMDX-CQSZACIVSA-N 1 2 309.438 4.188 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccccc2)Cc2ccccc2F)cn1 ZINC000505784486 340177973 /nfs/dbraw/zinc/17/79/73/340177973.db2.gz QFYGREOIWGQQIV-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccccc2)Cc2ccccc2F)cn1 ZINC000505784486 340177974 /nfs/dbraw/zinc/17/79/74/340177974.db2.gz QFYGREOIWGQQIV-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO CC[N@H+](CCCNC(=O)c1sccc1Cl)c1ccccc1 ZINC000506040157 340184013 /nfs/dbraw/zinc/18/40/13/340184013.db2.gz JHONACVDFBEFTD-UHFFFAOYSA-N 1 2 322.861 4.048 20 0 DIADLO CC[N@@H+](CCCNC(=O)c1sccc1Cl)c1ccccc1 ZINC000506040157 340184014 /nfs/dbraw/zinc/18/40/14/340184014.db2.gz JHONACVDFBEFTD-UHFFFAOYSA-N 1 2 322.861 4.048 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1nc2ccccc2[nH]1 ZINC000506085862 340185258 /nfs/dbraw/zinc/18/52/58/340185258.db2.gz NLSIWAYXMIBNFB-UHFFFAOYSA-N 1 2 305.834 4.300 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1nc2ccccc2[nH]1 ZINC000506085862 340185259 /nfs/dbraw/zinc/18/52/59/340185259.db2.gz NLSIWAYXMIBNFB-UHFFFAOYSA-N 1 2 305.834 4.300 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cc1cc(F)c(F)c(F)c1 ZINC000506098195 340185699 /nfs/dbraw/zinc/18/56/99/340185699.db2.gz BJULYYOZYSRRRA-UHFFFAOYSA-N 1 2 305.752 4.451 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1cc(F)c(F)c(F)c1 ZINC000506098195 340185700 /nfs/dbraw/zinc/18/57/00/340185700.db2.gz BJULYYOZYSRRRA-UHFFFAOYSA-N 1 2 305.752 4.451 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)o1 ZINC000506119503 340186091 /nfs/dbraw/zinc/18/60/91/340186091.db2.gz UYLZJWMJUUPBSE-HNNXBMFYSA-N 1 2 302.393 4.448 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)o1 ZINC000506119503 340186092 /nfs/dbraw/zinc/18/60/92/340186092.db2.gz UYLZJWMJUUPBSE-HNNXBMFYSA-N 1 2 302.393 4.448 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](C)Cc2ccc(Br)o2)o1 ZINC000506187009 340187972 /nfs/dbraw/zinc/18/79/72/340187972.db2.gz CRAWDZRLZDORRY-MFKMUULPSA-N 1 2 324.218 4.391 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2ccc(Br)o2)o1 ZINC000506187009 340187973 /nfs/dbraw/zinc/18/79/73/340187973.db2.gz CRAWDZRLZDORRY-MFKMUULPSA-N 1 2 324.218 4.391 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1cc(-c2ccccc2)n[nH]1 ZINC000506217529 340188987 /nfs/dbraw/zinc/18/89/87/340188987.db2.gz DWTDOPUOWQHUQY-UHFFFAOYSA-N 1 2 321.424 4.107 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1cc(-c2ccccc2)n[nH]1 ZINC000506217529 340188988 /nfs/dbraw/zinc/18/89/88/340188988.db2.gz DWTDOPUOWQHUQY-UHFFFAOYSA-N 1 2 321.424 4.107 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2CCc3[nH]c4ccccc4c3C2)s1 ZINC000506296972 340191592 /nfs/dbraw/zinc/19/15/92/340191592.db2.gz FXNVOZIFLPNVCB-UHFFFAOYSA-N 1 2 311.454 4.306 20 0 DIADLO CC(C)c1ncc(C[N@H+]2CCc3[nH]c4ccccc4c3C2)s1 ZINC000506296972 340191593 /nfs/dbraw/zinc/19/15/93/340191593.db2.gz FXNVOZIFLPNVCB-UHFFFAOYSA-N 1 2 311.454 4.306 20 0 DIADLO COc1ccccc1/C=C\C[N@@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000506299259 340191669 /nfs/dbraw/zinc/19/16/69/340191669.db2.gz UMBSCEFGGONLLH-VURMDHGXSA-N 1 2 318.420 4.248 20 0 DIADLO COc1ccccc1/C=C\C[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000506299259 340191670 /nfs/dbraw/zinc/19/16/70/340191670.db2.gz UMBSCEFGGONLLH-VURMDHGXSA-N 1 2 318.420 4.248 20 0 DIADLO CC1(C)CC(C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C1 ZINC000506524328 340196044 /nfs/dbraw/zinc/19/60/44/340196044.db2.gz FZHVDTXULBPVJV-UHFFFAOYSA-N 1 2 323.440 4.261 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1ncccc1C(F)(F)F ZINC000506724621 340200152 /nfs/dbraw/zinc/20/01/52/340200152.db2.gz BLZVJIPORKWWNM-SNVBAGLBSA-N 1 2 312.360 4.281 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1ncccc1C(F)(F)F ZINC000506724621 340200153 /nfs/dbraw/zinc/20/01/53/340200153.db2.gz BLZVJIPORKWWNM-SNVBAGLBSA-N 1 2 312.360 4.281 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@H]2/C=C\c2ccccc2)c(C)[nH+]1 ZINC000506782142 340201595 /nfs/dbraw/zinc/20/15/95/340201595.db2.gz VEIZDAJWHGWWTQ-JYBLJSLWSA-N 1 2 321.424 4.408 20 0 DIADLO CCCN(CC)C(=O)Nc1c[nH+]c(N2CCCC[C@@H]2C)c(C)c1 ZINC000506984766 340204711 /nfs/dbraw/zinc/20/47/11/340204711.db2.gz MSOCFACMJACSCJ-HNNXBMFYSA-N 1 2 318.465 4.033 20 0 DIADLO CC[C@@H](C)N(C)C(=O)Nc1c[nH+]c(N2CCCC[C@@H]2C)c(C)c1 ZINC000506988172 340204776 /nfs/dbraw/zinc/20/47/76/340204776.db2.gz TUMZZGRBSMXSQH-CABCVRRESA-N 1 2 318.465 4.031 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)n1 ZINC000507038430 340206073 /nfs/dbraw/zinc/20/60/73/340206073.db2.gz KFJPOSYAZOQFMA-QGZVFWFLSA-N 1 2 319.424 4.284 20 0 DIADLO CCc1nocc1C[N@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000507159621 340210012 /nfs/dbraw/zinc/21/00/12/340210012.db2.gz JBFGNZQKUKGDKE-WBMJQRKESA-N 1 2 300.402 4.118 20 0 DIADLO CCc1nocc1C[N@@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000507159621 340210013 /nfs/dbraw/zinc/21/00/13/340210013.db2.gz JBFGNZQKUKGDKE-WBMJQRKESA-N 1 2 300.402 4.118 20 0 DIADLO CC(C)[N@H+](Cc1nc2ccccc2n1C)Cc1ccccc1F ZINC000507155553 340210136 /nfs/dbraw/zinc/21/01/36/340210136.db2.gz OLMHDYRMSIOPOV-UHFFFAOYSA-N 1 2 311.404 4.123 20 0 DIADLO CC(C)[N@@H+](Cc1nc2ccccc2n1C)Cc1ccccc1F ZINC000507155553 340210137 /nfs/dbraw/zinc/21/01/37/340210137.db2.gz OLMHDYRMSIOPOV-UHFFFAOYSA-N 1 2 311.404 4.123 20 0 DIADLO Oc1cccc(C[N@H+](Cc2cccc(F)c2)C2CC2)c1Cl ZINC000507169027 340210614 /nfs/dbraw/zinc/21/06/14/340210614.db2.gz HGFXAIWAVRWMEL-UHFFFAOYSA-N 1 2 305.780 4.349 20 0 DIADLO Oc1cccc(C[N@@H+](Cc2cccc(F)c2)C2CC2)c1Cl ZINC000507169027 340210615 /nfs/dbraw/zinc/21/06/15/340210615.db2.gz HGFXAIWAVRWMEL-UHFFFAOYSA-N 1 2 305.780 4.349 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000507200878 340212910 /nfs/dbraw/zinc/21/29/10/340212910.db2.gz DWCQIOAUOPRTDF-NSHDSACASA-N 1 2 321.396 4.175 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000507200878 340212911 /nfs/dbraw/zinc/21/29/11/340212911.db2.gz DWCQIOAUOPRTDF-NSHDSACASA-N 1 2 321.396 4.175 20 0 DIADLO CCn1nccc1C[N@H+](C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000507227581 340214413 /nfs/dbraw/zinc/21/44/13/340214413.db2.gz IQQGKVFDYXPSDN-NSHDSACASA-N 1 2 312.244 4.403 20 0 DIADLO CCn1nccc1C[N@@H+](C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000507227581 340214414 /nfs/dbraw/zinc/21/44/14/340214414.db2.gz IQQGKVFDYXPSDN-NSHDSACASA-N 1 2 312.244 4.403 20 0 DIADLO CCn1nccc1C[N@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000507227579 340214494 /nfs/dbraw/zinc/21/44/94/340214494.db2.gz IQQGKVFDYXPSDN-LLVKDONJSA-N 1 2 312.244 4.403 20 0 DIADLO CCn1nccc1C[N@@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000507227579 340214495 /nfs/dbraw/zinc/21/44/95/340214495.db2.gz IQQGKVFDYXPSDN-LLVKDONJSA-N 1 2 312.244 4.403 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)[C@H](C)c1ccc(F)cc1F ZINC000507233441 340214786 /nfs/dbraw/zinc/21/47/86/340214786.db2.gz VGLYXOGSLHRVET-LLVKDONJSA-N 1 2 321.396 4.175 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)[C@H](C)c1ccc(F)cc1F ZINC000507233441 340214787 /nfs/dbraw/zinc/21/47/87/340214787.db2.gz VGLYXOGSLHRVET-LLVKDONJSA-N 1 2 321.396 4.175 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc2n[nH]cc2c1)c1ncc(C(C)(C)C)o1 ZINC000507232586 340214818 /nfs/dbraw/zinc/21/48/18/340214818.db2.gz OFHNKEAUUNFYHK-RYUDHWBXSA-N 1 2 312.417 4.260 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncc(C(C)(C)C)o1)c1ccc2n[nH]cc2c1 ZINC000507232584 340214893 /nfs/dbraw/zinc/21/48/93/340214893.db2.gz OFHNKEAUUNFYHK-NEPJUHHUSA-N 1 2 312.417 4.260 20 0 DIADLO C[N@H+](CC(=O)OC(C)(C)C)Cc1ccccc1-c1ccccc1 ZINC000507237920 340215002 /nfs/dbraw/zinc/21/50/02/340215002.db2.gz VQLMQJYEWPWTAQ-UHFFFAOYSA-N 1 2 311.425 4.127 20 0 DIADLO C[N@@H+](CC(=O)OC(C)(C)C)Cc1ccccc1-c1ccccc1 ZINC000507237920 340215003 /nfs/dbraw/zinc/21/50/03/340215003.db2.gz VQLMQJYEWPWTAQ-UHFFFAOYSA-N 1 2 311.425 4.127 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1cc(F)ccc1Br ZINC000507251249 340215687 /nfs/dbraw/zinc/21/56/87/340215687.db2.gz GLHCBQAHMRMHBC-JTQLQIEISA-N 1 2 312.182 4.374 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1cc(F)ccc1Br ZINC000507251249 340215688 /nfs/dbraw/zinc/21/56/88/340215688.db2.gz GLHCBQAHMRMHBC-JTQLQIEISA-N 1 2 312.182 4.374 20 0 DIADLO COc1cc(C[N@H+](C)[C@@H](C)c2c(F)cccc2F)cc(OC)c1 ZINC000507251782 340215696 /nfs/dbraw/zinc/21/56/96/340215696.db2.gz JZAAZPYEPNAKHX-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1cc(C[N@@H+](C)[C@@H](C)c2c(F)cccc2F)cc(OC)c1 ZINC000507251782 340215697 /nfs/dbraw/zinc/21/56/97/340215697.db2.gz JZAAZPYEPNAKHX-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO CCC[N@H+](Cc1conc1C)Cc1ccccc1Br ZINC000507332660 340217533 /nfs/dbraw/zinc/21/75/33/340217533.db2.gz YWNAMPPCRAQGLU-UHFFFAOYSA-N 1 2 323.234 4.158 20 0 DIADLO CCC[N@@H+](Cc1conc1C)Cc1ccccc1Br ZINC000507332660 340217534 /nfs/dbraw/zinc/21/75/34/340217534.db2.gz YWNAMPPCRAQGLU-UHFFFAOYSA-N 1 2 323.234 4.158 20 0 DIADLO CCSCC[C@H](C)Nc1[nH+]ccc(C)c1Br ZINC000300213921 340218345 /nfs/dbraw/zinc/21/83/45/340218345.db2.gz GRBLGLNTNQAZRZ-JTQLQIEISA-N 1 2 303.269 4.096 20 0 DIADLO COCC[C@H]([NH2+][C@H](CCc1ccccc1)C(F)F)c1ccco1 ZINC000507479202 340221767 /nfs/dbraw/zinc/22/17/67/340221767.db2.gz NYFYGOVLUQHHCE-JKSUJKDBSA-N 1 2 323.383 4.213 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000507505509 340223207 /nfs/dbraw/zinc/22/32/07/340223207.db2.gz DWWYXEARUFKKFG-CQSZACIVSA-N 1 2 307.397 4.150 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1nc(C(C)C)c(C)s1 ZINC000507526879 340224362 /nfs/dbraw/zinc/22/43/62/340224362.db2.gz LQBJEJQZRKFWFX-GFCCVEGCSA-N 1 2 303.475 4.383 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(O)c2Cl)C[C@H](c2ccccc2)O1 ZINC000507783897 340231350 /nfs/dbraw/zinc/23/13/50/340231350.db2.gz HHTTZIOMMUZNHW-CXAGYDPISA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(O)c2Cl)C[C@H](c2ccccc2)O1 ZINC000507783897 340231351 /nfs/dbraw/zinc/23/13/51/340231351.db2.gz HHTTZIOMMUZNHW-CXAGYDPISA-N 1 2 317.816 4.008 20 0 DIADLO Fc1ccc(F)c2c1CC[C@H]2[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000507816704 340232999 /nfs/dbraw/zinc/23/29/99/340232999.db2.gz XFDQQYNNLXXVRZ-QGZVFWFLSA-N 1 2 317.383 4.054 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCO[C@H](c3cccs3)C2)c1 ZINC000507835179 340233665 /nfs/dbraw/zinc/23/36/65/340233665.db2.gz VTAYMOGLPKBUHH-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCO[C@H](c3cccs3)C2)c1 ZINC000507835179 340233666 /nfs/dbraw/zinc/23/36/66/340233666.db2.gz VTAYMOGLPKBUHH-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO Fc1ccc(F)c2c1CC[C@H]2[NH2+][C@@H]1COc2ccc(Cl)cc21 ZINC000507869509 340234678 /nfs/dbraw/zinc/23/46/78/340234678.db2.gz AIENWDNQWCFPIX-HUUCEWRRSA-N 1 2 321.754 4.329 20 0 DIADLO Cn1cc[nH+]c1[C@H](Nc1ccc(F)c(F)c1)c1cccc(F)c1 ZINC000507906215 340235638 /nfs/dbraw/zinc/23/56/38/340235638.db2.gz DKGAIOKFKMDGEB-MRXNPFEDSA-N 1 2 317.314 4.039 20 0 DIADLO CCCCCOc1ccc(C[N@H+](C)Cc2cc(C)on2)cc1 ZINC000508517012 340245382 /nfs/dbraw/zinc/24/53/82/340245382.db2.gz WYDGFKMNVRUEFD-UHFFFAOYSA-N 1 2 302.418 4.184 20 0 DIADLO CCCCCOc1ccc(C[N@@H+](C)Cc2cc(C)on2)cc1 ZINC000508517012 340245383 /nfs/dbraw/zinc/24/53/83/340245383.db2.gz WYDGFKMNVRUEFD-UHFFFAOYSA-N 1 2 302.418 4.184 20 0 DIADLO CC[C@@H](C)[C@H](C(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000508520346 340245544 /nfs/dbraw/zinc/24/55/44/340245544.db2.gz GMVOACXBIWJMTH-KUHUBIRLSA-N 1 2 321.424 4.411 20 0 DIADLO Cc1ccc(C(=O)NC2(C(C)C)CC2)cc1Oc1cc[nH+]cc1 ZINC000508586883 340247062 /nfs/dbraw/zinc/24/70/62/340247062.db2.gz HXCVAPGYRKSUFT-UHFFFAOYSA-N 1 2 310.397 4.101 20 0 DIADLO Cc1cc(NC(=O)[C@@H](C)C(C)(F)F)ccc1Oc1cc[nH+]cc1 ZINC000508740017 340252077 /nfs/dbraw/zinc/25/20/77/340252077.db2.gz FIGZFSXOQNSODL-GFCCVEGCSA-N 1 2 320.339 4.412 20 0 DIADLO Clc1cccc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)c1 ZINC000508764793 340252746 /nfs/dbraw/zinc/25/27/46/340252746.db2.gz NYOZSTCRRCBFHX-UHFFFAOYSA-N 1 2 311.816 4.266 20 0 DIADLO Clc1cccc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)c1 ZINC000508764793 340252747 /nfs/dbraw/zinc/25/27/47/340252747.db2.gz NYOZSTCRRCBFHX-UHFFFAOYSA-N 1 2 311.816 4.266 20 0 DIADLO C[N@H+](Cc1cccc(OC(C)(C)C)n1)Cc1ccccc1F ZINC000508838936 340254041 /nfs/dbraw/zinc/25/40/41/340254041.db2.gz PWLYDKRNHCIUNH-UHFFFAOYSA-N 1 2 302.393 4.030 20 0 DIADLO C[N@@H+](Cc1cccc(OC(C)(C)C)n1)Cc1ccccc1F ZINC000508838936 340254042 /nfs/dbraw/zinc/25/40/42/340254042.db2.gz PWLYDKRNHCIUNH-UHFFFAOYSA-N 1 2 302.393 4.030 20 0 DIADLO CC(=O)c1ccccc1OCC[N@@H+](C)Cc1ccccc1Cl ZINC000301607229 340256174 /nfs/dbraw/zinc/25/61/74/340256174.db2.gz XVPNZHFJQZZCEG-UHFFFAOYSA-N 1 2 317.816 4.053 20 0 DIADLO CC(=O)c1ccccc1OCC[N@H+](C)Cc1ccccc1Cl ZINC000301607229 340256175 /nfs/dbraw/zinc/25/61/75/340256175.db2.gz XVPNZHFJQZZCEG-UHFFFAOYSA-N 1 2 317.816 4.053 20 0 DIADLO C[C@H](CC(=O)Nc1cccc(-n2cc[nH+]c2)c1)C1CCCCC1 ZINC000508988785 340257025 /nfs/dbraw/zinc/25/70/25/340257025.db2.gz UZCZDNYDKXIAFE-OAHLLOKOSA-N 1 2 311.429 4.417 20 0 DIADLO Cn1cc(-c2ccc(CNc3c[nH+]c4c(c3)CCCC4)s2)cn1 ZINC000509048569 340259475 /nfs/dbraw/zinc/25/94/75/340259475.db2.gz WPPNCJFTMNMZEI-UHFFFAOYSA-N 1 2 324.453 4.035 20 0 DIADLO CO[C@H](Cn1c[nH+]c2cc(F)c(F)cc21)c1ccc(Cl)cc1 ZINC000509100559 340261303 /nfs/dbraw/zinc/26/13/03/340261303.db2.gz RLZQUTOHLRMNTG-MRXNPFEDSA-N 1 2 322.742 4.356 20 0 DIADLO CC(C)(C)[C@@H]1CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509299672 340265642 /nfs/dbraw/zinc/26/56/42/340265642.db2.gz CMPTYLFJTNGZHK-OAHLLOKOSA-N 1 2 324.424 4.382 20 0 DIADLO C[C@@H]1CC[C@@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)C[C@H]1C ZINC000509305136 340265817 /nfs/dbraw/zinc/26/58/17/340265817.db2.gz SQEHPACBTYSYRG-BZUAXINKSA-N 1 2 324.424 4.428 20 0 DIADLO C[C@@H]1CCCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509330435 340266432 /nfs/dbraw/zinc/26/64/32/340266432.db2.gz GJWKQOFTXLYXQR-OAHLLOKOSA-N 1 2 310.397 4.136 20 0 DIADLO Fc1ccc2c(c1)CC[N@@H+](Cc1cc(-c3ccccc3)no1)C2 ZINC000509435458 340269368 /nfs/dbraw/zinc/26/93/68/340269368.db2.gz HWLMEMHLDHUTAP-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1ccc2c(c1)CC[N@H+](Cc1cc(-c3ccccc3)no1)C2 ZINC000509435458 340269369 /nfs/dbraw/zinc/26/93/69/340269369.db2.gz HWLMEMHLDHUTAP-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO CC(C)c1nc(N2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc[nH+]1 ZINC000509469459 340270621 /nfs/dbraw/zinc/27/06/21/340270621.db2.gz JCJUHCYMNJHOHZ-LBPRGKRZSA-N 1 2 313.367 4.159 20 0 DIADLO CC[C@H]1C[N@H+](Cc2nc(-c3ccc(C)cc3)cs2)C[C@H](C)O1 ZINC000509681018 340276695 /nfs/dbraw/zinc/27/66/95/340276695.db2.gz CNOWDSOGPRZMPY-HOCLYGCPSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2nc(-c3ccc(C)cc3)cs2)C[C@H](C)O1 ZINC000509681018 340276696 /nfs/dbraw/zinc/27/66/96/340276696.db2.gz CNOWDSOGPRZMPY-HOCLYGCPSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@@H]1COCC[N@@H+]1Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000509825749 340280560 /nfs/dbraw/zinc/28/05/60/340280560.db2.gz DIAZVMAJHFSKOI-OAHLLOKOSA-N 1 2 322.861 4.074 20 0 DIADLO CC[C@@H]1COCC[N@H+]1Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000509825749 340280561 /nfs/dbraw/zinc/28/05/61/340280561.db2.gz DIAZVMAJHFSKOI-OAHLLOKOSA-N 1 2 322.861 4.074 20 0 DIADLO CCCCOc1cccc(C[NH2+]Cc2c(F)ccc(O)c2F)c1 ZINC000509959500 340283937 /nfs/dbraw/zinc/28/39/37/340283937.db2.gz LTBFDUNEQCMELG-UHFFFAOYSA-N 1 2 321.367 4.139 20 0 DIADLO O=C(c1ccccc1Oc1cc[nH+]cc1)N1CCC[C@@H]2CCC[C@H]21 ZINC000509993382 340284907 /nfs/dbraw/zinc/28/49/07/340284907.db2.gz FSZOMXIFAMOQPQ-MAUKXSAKSA-N 1 2 322.408 4.279 20 0 DIADLO CC[C@H](C)C[C@H](C)NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000510071728 340287343 /nfs/dbraw/zinc/28/73/43/340287343.db2.gz MQHAIZJMASCLMU-GJZGRUSLSA-N 1 2 312.413 4.428 20 0 DIADLO FC(F)C1([NH2+]Cc2ncccc2C(F)(F)F)CCCCC1 ZINC000510102577 340288789 /nfs/dbraw/zinc/28/87/89/340288789.db2.gz SUMXDNFVWTXCPP-UHFFFAOYSA-N 1 2 308.294 4.158 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[NH2+]C1(C(F)F)CCCCC1 ZINC000510105346 340288896 /nfs/dbraw/zinc/28/88/96/340288896.db2.gz NQAJYTQFKZCIJO-UHFFFAOYSA-N 1 2 324.415 4.306 20 0 DIADLO COc1cc(C[NH2+]C2(C(F)F)CCCCC2)ccc1SC ZINC000510107882 340289119 /nfs/dbraw/zinc/28/91/19/340289119.db2.gz FCCFTBNQJQENGL-UHFFFAOYSA-N 1 2 315.429 4.475 20 0 DIADLO CC(C)CC1(CNC(=O)c2ccccc2Oc2cc[nH+]cc2)CC1 ZINC000510258307 340294347 /nfs/dbraw/zinc/29/43/47/340294347.db2.gz PJNLFBXHLKJRDJ-UHFFFAOYSA-N 1 2 324.424 4.430 20 0 DIADLO Cc1[nH]c2ccc(C[NH2+]Cc3c(F)ccc(O)c3F)cc2c1C ZINC000510316736 340295713 /nfs/dbraw/zinc/29/57/13/340295713.db2.gz YKBIZOOKNLKTBQ-UHFFFAOYSA-N 1 2 316.351 4.058 20 0 DIADLO CC(C)C(C)(C)CNC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000510447313 340299786 /nfs/dbraw/zinc/29/97/86/340299786.db2.gz ZOQWSKPJFQRFQJ-UHFFFAOYSA-N 1 2 312.413 4.286 20 0 DIADLO Cc1cccc([C@@H](NCc2c[nH+]c3ccccn23)C(F)(F)F)c1 ZINC000510453352 340300010 /nfs/dbraw/zinc/30/00/10/340300010.db2.gz ASFASMAIWQTLQQ-MRXNPFEDSA-N 1 2 319.330 4.036 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NC(=O)CC2(C)CCCCC2)c1 ZINC000510635871 340304509 /nfs/dbraw/zinc/30/45/09/340304509.db2.gz XQUOXZNXHFOYRO-UHFFFAOYSA-N 1 2 311.429 4.386 20 0 DIADLO C[C@H]1CCC[C@@H]1CNC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000510751004 340309546 /nfs/dbraw/zinc/30/95/46/340309546.db2.gz MWFGZNIHOQFADM-LSDHHAIUSA-N 1 2 310.397 4.040 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000511115465 340321305 /nfs/dbraw/zinc/32/13/05/340321305.db2.gz MWWAFMKYJCTCIR-QGZVFWFLSA-N 1 2 317.429 4.121 20 0 DIADLO CSc1ccccc1C[N@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000511115465 340321306 /nfs/dbraw/zinc/32/13/06/340321306.db2.gz MWWAFMKYJCTCIR-QGZVFWFLSA-N 1 2 317.429 4.121 20 0 DIADLO CC[N@H+](CCCNC(=O)c1coc2ccccc12)c1ccccc1 ZINC000303590058 340336007 /nfs/dbraw/zinc/33/60/07/340336007.db2.gz ONADVUYTGMSYSP-UHFFFAOYSA-N 1 2 322.408 4.079 20 0 DIADLO CC[N@@H+](CCCNC(=O)c1coc2ccccc12)c1ccccc1 ZINC000303590058 340336008 /nfs/dbraw/zinc/33/60/08/340336008.db2.gz ONADVUYTGMSYSP-UHFFFAOYSA-N 1 2 322.408 4.079 20 0 DIADLO CCc1cc(N(C)[C@@H]2CCCC[C@@H]2C)nc(-c2ccncc2)[nH+]1 ZINC000303608775 340337156 /nfs/dbraw/zinc/33/71/56/340337156.db2.gz QVMAOWNYBZNTJI-WMLDXEAASA-N 1 2 310.445 4.116 20 0 DIADLO Cc1cc(N2CC=C(c3ccc(Cl)c(Cl)c3)CC2)nc[nH+]1 ZINC000511862291 340340738 /nfs/dbraw/zinc/34/07/38/340340738.db2.gz JWXQZEUZYPJGRO-UHFFFAOYSA-N 1 2 320.223 4.386 20 0 DIADLO C[C@H]([NH2+]Cc1ccc2occc2c1)c1noc(-c2ccccc2)n1 ZINC000512029015 340345959 /nfs/dbraw/zinc/34/59/59/340345959.db2.gz ZZISMTLUDGUNAP-ZDUSSCGKSA-N 1 2 319.364 4.334 20 0 DIADLO C[C@@H]1CC[C@H](c2ccccc2)[N@H+](Cc2noc(C(C)(C)C)n2)C1 ZINC000512188549 340351568 /nfs/dbraw/zinc/35/15/68/340351568.db2.gz ZYKWXLWWOHWDMY-GDBMZVCRSA-N 1 2 313.445 4.340 20 0 DIADLO C[C@@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2noc(C(C)(C)C)n2)C1 ZINC000512188549 340351569 /nfs/dbraw/zinc/35/15/69/340351569.db2.gz ZYKWXLWWOHWDMY-GDBMZVCRSA-N 1 2 313.445 4.340 20 0 DIADLO Cc1ccc2c(c1)C[N@H+]([C@@H](C)c1nc3ccccc3o1)CCO2 ZINC000512256824 340354284 /nfs/dbraw/zinc/35/42/84/340354284.db2.gz BACAOBNNOMGIIG-AWEZNQCLSA-N 1 2 308.381 4.092 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+]([C@@H](C)c1nc3ccccc3o1)CCO2 ZINC000512256824 340354285 /nfs/dbraw/zinc/35/42/85/340354285.db2.gz BACAOBNNOMGIIG-AWEZNQCLSA-N 1 2 308.381 4.092 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1coc(-c3ccccc3)n1)CCO2 ZINC000512264907 340354674 /nfs/dbraw/zinc/35/46/74/340354674.db2.gz WMLYFJXZFVZWQC-UHFFFAOYSA-N 1 2 320.392 4.045 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1coc(-c3ccccc3)n1)CCO2 ZINC000512264907 340354675 /nfs/dbraw/zinc/35/46/75/340354675.db2.gz WMLYFJXZFVZWQC-UHFFFAOYSA-N 1 2 320.392 4.045 20 0 DIADLO CCCC(CCC)C(=O)NCCCn1c(C)[nH+]c2ccccc21 ZINC000512269337 340354761 /nfs/dbraw/zinc/35/47/61/340354761.db2.gz WNHNNITURWBPJC-UHFFFAOYSA-N 1 2 315.461 4.067 20 0 DIADLO CCC(C)(C)C1CCC(CC(=O)NCCCn2cc[nH+]c2)CC1 ZINC000512326224 340357246 /nfs/dbraw/zinc/35/72/46/340357246.db2.gz ONBXODILCBDQHJ-UHFFFAOYSA-N 1 2 319.493 4.022 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+]1C[C@H](C)[S@](=O)[C@@H](CC)C1 ZINC000512426059 340361599 /nfs/dbraw/zinc/36/15/99/340361599.db2.gz DSPCLOLBPYVMKA-NZNSQFJMSA-N 1 2 313.894 4.023 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+]1C[C@H](C)[S@](=O)[C@@H](CC)C1 ZINC000512426059 340361600 /nfs/dbraw/zinc/36/16/00/340361600.db2.gz DSPCLOLBPYVMKA-NZNSQFJMSA-N 1 2 313.894 4.023 20 0 DIADLO CCCCOc1ccc(C[N@@H+]2CCCC[C@@H]2c2ncc[nH]2)cc1 ZINC000512485081 340363524 /nfs/dbraw/zinc/36/35/24/340363524.db2.gz FJADGVJNJZFXFV-GOSISDBHSA-N 1 2 313.445 4.316 20 0 DIADLO CCCCOc1ccc(C[N@H+]2CCCC[C@@H]2c2ncc[nH]2)cc1 ZINC000512485081 340363525 /nfs/dbraw/zinc/36/35/25/340363525.db2.gz FJADGVJNJZFXFV-GOSISDBHSA-N 1 2 313.445 4.316 20 0 DIADLO c1c[nH]c([C@@H]2CCCC[N@H+]2Cc2ccc(-c3ccccc3)o2)n1 ZINC000512521196 340365354 /nfs/dbraw/zinc/36/53/54/340365354.db2.gz ANTJCJNLVUISHW-KRWDZBQOSA-N 1 2 307.397 4.397 20 0 DIADLO c1c[nH]c([C@@H]2CCCC[N@@H+]2Cc2ccc(-c3ccccc3)o2)n1 ZINC000512521196 340365355 /nfs/dbraw/zinc/36/53/55/340365355.db2.gz ANTJCJNLVUISHW-KRWDZBQOSA-N 1 2 307.397 4.397 20 0 DIADLO Clc1ccc(CN2CCCC[C@@H]2c2[nH]cc[nH+]2)cc1Cl ZINC000512527934 340365688 /nfs/dbraw/zinc/36/56/88/340365688.db2.gz ZXUYXIKMXFXNMV-CQSZACIVSA-N 1 2 310.228 4.444 20 0 DIADLO CCOc1ccc(C[NH2+]C2(C(F)F)CCCCC2)cc1OC ZINC000512913928 340383859 /nfs/dbraw/zinc/38/38/59/340383859.db2.gz UVVMKSITYQGHJD-UHFFFAOYSA-N 1 2 313.388 4.152 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)c(F)c1)c1nc(C(C)(C)C)no1 ZINC000174660475 340393916 /nfs/dbraw/zinc/39/39/16/340393916.db2.gz OIZSMPJLHALBDA-VIFPVBQESA-N 1 2 311.788 4.010 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)c(F)c1)c1nc(C(C)(C)C)no1 ZINC000174660488 340393983 /nfs/dbraw/zinc/39/39/83/340393983.db2.gz OIZSMPJLHALBDA-SECBINFHSA-N 1 2 311.788 4.010 20 0 DIADLO Cc1[nH]ncc1C[N@@H+]1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000513127042 340394363 /nfs/dbraw/zinc/39/43/63/340394363.db2.gz BTFJNQMFKLVJFB-MRXNPFEDSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000513127042 340394364 /nfs/dbraw/zinc/39/43/64/340394364.db2.gz BTFJNQMFKLVJFB-MRXNPFEDSA-N 1 2 323.362 4.464 20 0 DIADLO C[C@H](C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)c1cccnc1 ZINC000174808239 340396603 /nfs/dbraw/zinc/39/66/03/340396603.db2.gz WJWOQYSXHNLWNU-AWEZNQCLSA-N 1 2 319.364 4.011 20 0 DIADLO Cc1cccc(-c2cncc(C(=O)Nc3ccc(C)[nH+]c3C)c2)c1 ZINC000178118203 340446968 /nfs/dbraw/zinc/44/69/68/340446968.db2.gz CILKVNDDHIURSA-UHFFFAOYSA-N 1 2 317.392 4.321 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1ccc(Br)o1 ZINC000178903211 340452401 /nfs/dbraw/zinc/45/24/01/340452401.db2.gz UFINBEUWBADVSO-UHFFFAOYSA-N 1 2 318.573 4.124 20 0 DIADLO CCCc1cccc(C[NH2+][C@@H](c2nc(C3CC3)no2)C(C)C)c1 ZINC000187239619 340518652 /nfs/dbraw/zinc/51/86/52/340518652.db2.gz YYYWLLVCAQJWKW-QGZVFWFLSA-N 1 2 313.445 4.386 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(Br)s2)o1 ZINC000220950635 340520318 /nfs/dbraw/zinc/52/03/18/340520318.db2.gz SEKFALKWSYXIIC-DTWKUNHWSA-N 1 2 315.236 4.219 20 0 DIADLO CCN(CC)c1ccc(N[C@H](C)c2cnn(C(C)C)c2C)c[nH+]1 ZINC000191451248 340554479 /nfs/dbraw/zinc/55/44/79/340554479.db2.gz NRBZXGYJWMBPCD-CQSZACIVSA-N 1 2 315.465 4.187 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(OC)ccc1Cl)c1nc(C)cs1 ZINC000192176957 340564059 /nfs/dbraw/zinc/56/40/59/340564059.db2.gz OQZYCCWRZMREBV-AWEZNQCLSA-N 1 2 310.850 4.354 20 0 DIADLO Cc1cc(N2CCC[C@H](Cc3ccccc3)C2)nc(C2CC2)[nH+]1 ZINC000522568873 340604537 /nfs/dbraw/zinc/60/45/37/340604537.db2.gz MRQUEOXRQQWCLH-QGZVFWFLSA-N 1 2 307.441 4.122 20 0 DIADLO CC1CCN(c2cc[nH+]c3c(Br)cccc23)CC1 ZINC000522624985 340605991 /nfs/dbraw/zinc/60/59/91/340605991.db2.gz FBOCFINDNNWFKH-UHFFFAOYSA-N 1 2 305.219 4.234 20 0 DIADLO FC(F)Oc1ccc(COc2ccccc2-n2cc[nH+]c2)cc1 ZINC000522890451 340609346 /nfs/dbraw/zinc/60/93/46/340609346.db2.gz KITZCUDNSBFEJN-UHFFFAOYSA-N 1 2 316.307 4.053 20 0 DIADLO CCc1cc(NCCC2=CCCCC2)nc(-c2ccncc2)[nH+]1 ZINC000303239996 340633923 /nfs/dbraw/zinc/63/39/23/340633923.db2.gz AROLAZBRIPVXMO-UHFFFAOYSA-N 1 2 308.429 4.403 20 0 DIADLO Cc1cc(N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000524067895 340646949 /nfs/dbraw/zinc/64/69/49/340646949.db2.gz NLNXEDNTMKHTTA-BBRMVZONSA-N 1 2 311.404 4.184 20 0 DIADLO CC[C@@H](C(=O)Nc1ccc2c(c1)[nH+]c(C)n2C)c1ccccc1 ZINC000525210771 340695427 /nfs/dbraw/zinc/69/54/27/340695427.db2.gz KYTXZZRKLFWRHU-MRXNPFEDSA-N 1 2 307.397 4.014 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1nc2ccccc2o1 ZINC000528653826 340728018 /nfs/dbraw/zinc/72/80/18/340728018.db2.gz ADNGNTHRQMCQIG-FZKQIMNGSA-N 1 2 307.397 4.415 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](c2cccc(C)c2)C(C)C)no1 ZINC000528767510 340733086 /nfs/dbraw/zinc/73/30/86/340733086.db2.gz OXXCWJAJSJRXAV-SFHVURJKSA-N 1 2 301.434 4.208 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1cc(C)ccc1C ZINC000528801338 340735027 /nfs/dbraw/zinc/73/50/27/340735027.db2.gz NAGPPGKHLUWPDP-HNNXBMFYSA-N 1 2 301.434 4.225 20 0 DIADLO Cc1cc(F)c(NC(=O)NCc2c[nH+]c(C)cc2C)c(Cl)c1 ZINC000529252827 340750753 /nfs/dbraw/zinc/75/07/53/340750753.db2.gz ICENYWIEYRUKAD-UHFFFAOYSA-N 1 2 321.783 4.121 20 0 DIADLO FC(F)(F)[C@@H]1CCC[C@@H](Nc2cccc(-n3cc[nH+]c3)c2)C1 ZINC000125968068 340818166 /nfs/dbraw/zinc/81/81/66/340818166.db2.gz GSXJWDWQXXBSSZ-CHWSQXEVSA-N 1 2 309.335 4.405 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc(C)[nH+]c2)c(Br)c1 ZINC000538551565 340832619 /nfs/dbraw/zinc/83/26/19/340832619.db2.gz NVZXFVOAHHRMLH-NSHDSACASA-N 1 2 321.218 4.334 20 0 DIADLO C[C@@H]1C[C@@H]1[C@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000539426857 340885085 /nfs/dbraw/zinc/88/50/85/340885085.db2.gz VZDVHOZCEWFPEV-FUEDEBDSSA-N 1 2 317.820 4.087 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccccc1-n1cccn1 ZINC000540362189 340928620 /nfs/dbraw/zinc/92/86/20/340928620.db2.gz IRIZLWFAIAPDMH-CQSZACIVSA-N 1 2 324.428 4.009 20 0 DIADLO COC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1-c1ccc(Cl)cc1 ZINC000540414343 340930452 /nfs/dbraw/zinc/93/04/52/340930452.db2.gz NVLMGMZOEQQIOK-QWHCGFSZSA-N 1 2 317.816 4.219 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(C)n1)c1cc2c(ccc3ccccc23)o1 ZINC000540605739 340938131 /nfs/dbraw/zinc/93/81/31/340938131.db2.gz JCTNJXDFDFNSMM-CYBMUJFWSA-N 1 2 305.381 4.170 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2nc(C)c3ccccc3n2)C2CCC2)o1 ZINC000542667795 341016437 /nfs/dbraw/zinc/01/64/37/341016437.db2.gz ZCSRLHGQEYEIHE-FQEVSTJZSA-N 1 2 321.424 4.471 20 0 DIADLO COc1c(C)cnc(C[N@H+](C)Cc2ccc([C@@H]3C[C@@H]3C)o2)c1C ZINC000542693506 341017519 /nfs/dbraw/zinc/01/75/19/341017519.db2.gz FHYBLPVEWZWFIW-BLLLJJGKSA-N 1 2 314.429 4.055 20 0 DIADLO COc1c(C)cnc(C[N@@H+](C)Cc2ccc([C@@H]3C[C@@H]3C)o2)c1C ZINC000542693506 341017520 /nfs/dbraw/zinc/01/75/20/341017520.db2.gz FHYBLPVEWZWFIW-BLLLJJGKSA-N 1 2 314.429 4.055 20 0 DIADLO CC[C@@H](Nc1cccc([NH+]2CCCCCC2)c1)c1ccn(C)n1 ZINC000542697880 341017727 /nfs/dbraw/zinc/01/77/27/341017727.db2.gz ZHCVCIBXXBSQLX-GOSISDBHSA-N 1 2 312.461 4.364 20 0 DIADLO Fc1ccc(C[N@H+](Cc2nc(C3CCCC3)no2)C2CC2)cc1 ZINC000130339078 341018693 /nfs/dbraw/zinc/01/86/93/341018693.db2.gz GYTQEJZJJBJDCV-UHFFFAOYSA-N 1 2 315.392 4.031 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2nc(C3CCCC3)no2)C2CC2)cc1 ZINC000130339078 341018694 /nfs/dbraw/zinc/01/86/94/341018694.db2.gz GYTQEJZJJBJDCV-UHFFFAOYSA-N 1 2 315.392 4.031 20 0 DIADLO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+]1CCOC(C)(C)C1 ZINC000130465171 341022403 /nfs/dbraw/zinc/02/24/03/341022403.db2.gz DSEYIVYKAXNTNP-GFCCVEGCSA-N 1 2 320.820 4.167 20 0 DIADLO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1CCOC(C)(C)C1 ZINC000130465171 341022404 /nfs/dbraw/zinc/02/24/04/341022404.db2.gz DSEYIVYKAXNTNP-GFCCVEGCSA-N 1 2 320.820 4.167 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000542852677 341023620 /nfs/dbraw/zinc/02/36/20/341023620.db2.gz ABLXJSYFLVLJBW-KRWDZBQOSA-N 1 2 321.342 4.279 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000542852677 341023621 /nfs/dbraw/zinc/02/36/21/341023621.db2.gz ABLXJSYFLVLJBW-KRWDZBQOSA-N 1 2 321.342 4.279 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@@H+]1CCOCC2(CC2)C1 ZINC000542986845 341027899 /nfs/dbraw/zinc/02/78/99/341027899.db2.gz STWBUJWRLJBWDL-LLVKDONJSA-N 1 2 300.229 4.167 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@H+]1CCOCC2(CC2)C1 ZINC000542986845 341027900 /nfs/dbraw/zinc/02/79/00/341027900.db2.gz STWBUJWRLJBWDL-LLVKDONJSA-N 1 2 300.229 4.167 20 0 DIADLO Cc1ccc(C)c(NC(=O)[C@@H](C)[N@@H+]2Cc3ccccc3[C@H]2C)c1 ZINC000543061400 341029951 /nfs/dbraw/zinc/02/99/51/341029951.db2.gz GQUFBKMZGWKCOM-HZPDHXFCSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1ccc(C)c(NC(=O)[C@@H](C)[N@H+]2Cc3ccccc3[C@H]2C)c1 ZINC000543061400 341029952 /nfs/dbraw/zinc/02/99/52/341029952.db2.gz GQUFBKMZGWKCOM-HZPDHXFCSA-N 1 2 308.425 4.207 20 0 DIADLO Fc1cccc2c3c([nH]c21)CN(c1[nH]c2ccccc2[nH+]1)CCC3 ZINC000543091682 341031421 /nfs/dbraw/zinc/03/14/21/341031421.db2.gz RMYYPNSPYNINMD-UHFFFAOYSA-N 1 2 320.371 4.136 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)[C@@H]3CCCCS3)cc2[nH+]1 ZINC000543092449 341031622 /nfs/dbraw/zinc/03/16/22/341031622.db2.gz DKEHVNDFCHUXTM-HNNXBMFYSA-N 1 2 317.458 4.130 20 0 DIADLO COc1ccc(Oc2ccc(C[N@H+](C)Cc3ccon3)cc2)cc1 ZINC000543397331 341042087 /nfs/dbraw/zinc/04/20/87/341042087.db2.gz HYGKGZJMLOPAMF-UHFFFAOYSA-N 1 2 324.380 4.108 20 0 DIADLO COc1ccc(Oc2ccc(C[N@@H+](C)Cc3ccon3)cc2)cc1 ZINC000543397331 341042088 /nfs/dbraw/zinc/04/20/88/341042088.db2.gz HYGKGZJMLOPAMF-UHFFFAOYSA-N 1 2 324.380 4.108 20 0 DIADLO CCc1ccccc1C[NH2+][C@@H](c1ccc(F)cc1)c1cnccn1 ZINC000543403616 341042559 /nfs/dbraw/zinc/04/25/59/341042559.db2.gz VYSYUAZYRBOWCQ-FQEVSTJZSA-N 1 2 321.399 4.057 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@@H](C)[C@@H]2CCCO2)c1 ZINC000543426605 341044045 /nfs/dbraw/zinc/04/40/45/341044045.db2.gz WJADRIIBMPRKJW-YJBOKZPZSA-N 1 2 313.445 4.330 20 0 DIADLO Fc1cccc(-c2cnc(C[NH2+][C@H](c3cccnc3)C3CC3)o2)c1 ZINC000543448133 341045217 /nfs/dbraw/zinc/04/52/17/341045217.db2.gz UVMACMRPJAIXFP-IBGZPJMESA-N 1 2 323.371 4.117 20 0 DIADLO COc1ccc2oc([C@@H](C)[NH2+][C@@H](C)c3ncc(C)o3)c(C)c2c1 ZINC000543510964 341048145 /nfs/dbraw/zinc/04/81/45/341048145.db2.gz XBHGCAQYRNYHJH-OLZOCXBDSA-N 1 2 314.385 4.458 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccn(C)n1 ZINC000543596308 341050137 /nfs/dbraw/zinc/05/01/37/341050137.db2.gz UNEIZRLGWNPCRY-SECBINFHSA-N 1 2 304.246 4.029 20 0 DIADLO CC[C@H]([NH2+][C@H](c1ccccc1)c1ccc(F)cc1)c1ccn(C)n1 ZINC000543603340 341050836 /nfs/dbraw/zinc/05/08/36/341050836.db2.gz VZDUJTUNSQUMTM-AZUAARDMSA-N 1 2 323.415 4.390 20 0 DIADLO CC[N@H+](CC(F)F)C[C@@H](C)c1cccc(Br)c1 ZINC000543620326 341051323 /nfs/dbraw/zinc/05/13/23/341051323.db2.gz GEMOTMYBTVLBEQ-SNVBAGLBSA-N 1 2 306.194 4.140 20 0 DIADLO CC[N@@H+](CC(F)F)C[C@@H](C)c1cccc(Br)c1 ZINC000543620326 341051324 /nfs/dbraw/zinc/05/13/24/341051324.db2.gz GEMOTMYBTVLBEQ-SNVBAGLBSA-N 1 2 306.194 4.140 20 0 DIADLO CCc1ccc(C[N@H+](Cc2nc(C(C)(C)C)no2)C2CC2)cc1 ZINC000071951820 341055559 /nfs/dbraw/zinc/05/55/59/341055559.db2.gz JQAVTYOQHBJDIN-UHFFFAOYSA-N 1 2 313.445 4.094 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2nc(C(C)(C)C)no2)C2CC2)cc1 ZINC000071951820 341055560 /nfs/dbraw/zinc/05/55/60/341055560.db2.gz JQAVTYOQHBJDIN-UHFFFAOYSA-N 1 2 313.445 4.094 20 0 DIADLO Fc1cccc(Cl)c1C[N@@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000072031781 341057327 /nfs/dbraw/zinc/05/73/27/341057327.db2.gz LIRQIDTVVISIAZ-AWEZNQCLSA-N 1 2 323.795 4.253 20 0 DIADLO Fc1cccc(Cl)c1C[N@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000072031781 341057328 /nfs/dbraw/zinc/05/73/28/341057328.db2.gz LIRQIDTVVISIAZ-AWEZNQCLSA-N 1 2 323.795 4.253 20 0 DIADLO CCc1cnccc1[C@H](C)[NH2+]Cc1ncc(-c2ccccc2)o1 ZINC000543980287 341064926 /nfs/dbraw/zinc/06/49/26/341064926.db2.gz PVPCBZSSDPTUIT-AWEZNQCLSA-N 1 2 307.397 4.150 20 0 DIADLO CCc1ccccc1NC(=O)[C@H](C)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000543988031 341065157 /nfs/dbraw/zinc/06/51/57/341065157.db2.gz VOVJUIHGMBTUKV-CABCVRRESA-N 1 2 308.425 4.153 20 0 DIADLO CCc1ccccc1NC(=O)[C@H](C)[N@H+]1Cc2ccccc2[C@H]1C ZINC000543988031 341065158 /nfs/dbraw/zinc/06/51/58/341065158.db2.gz VOVJUIHGMBTUKV-CABCVRRESA-N 1 2 308.425 4.153 20 0 DIADLO Cc1cccc(NC(=O)[C@@H](C)[N@@H+]2Cc3ccccc3[C@@H]2C)c1C ZINC000543990201 341065283 /nfs/dbraw/zinc/06/52/83/341065283.db2.gz VGPXZRDCTNLKJA-JKSUJKDBSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1cccc(NC(=O)[C@@H](C)[N@H+]2Cc3ccccc3[C@@H]2C)c1C ZINC000543990201 341065284 /nfs/dbraw/zinc/06/52/84/341065284.db2.gz VGPXZRDCTNLKJA-JKSUJKDBSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1cccc(NC(=O)[C@H](C)[N@@H+]2Cc3ccccc3[C@H]2C)c1C ZINC000543990198 341065363 /nfs/dbraw/zinc/06/53/63/341065363.db2.gz VGPXZRDCTNLKJA-CVEARBPZSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1cccc(NC(=O)[C@H](C)[N@H+]2Cc3ccccc3[C@H]2C)c1C ZINC000543990198 341065364 /nfs/dbraw/zinc/06/53/64/341065364.db2.gz VGPXZRDCTNLKJA-CVEARBPZSA-N 1 2 308.425 4.207 20 0 DIADLO CC1(CC(=O)NCc2cccc(-c3[nH]cc[nH+]3)c2)CCCCC1 ZINC000544053847 341068331 /nfs/dbraw/zinc/06/83/31/341068331.db2.gz NCUYOBBFTPIDKQ-UHFFFAOYSA-N 1 2 311.429 4.053 20 0 DIADLO CC(C)[C@H]1CC[C@H](c2nc(Cc3cn4ccccc4[nH+]3)no2)CC1 ZINC000544076866 341069499 /nfs/dbraw/zinc/06/94/99/341069499.db2.gz GTMKRNFFHZHGFU-SHTZXODSSA-N 1 2 324.428 4.238 20 0 DIADLO CC[N@H+](Cc1csc(Nc2ccccc2)n1)Cc1ccccn1 ZINC000131330608 341076647 /nfs/dbraw/zinc/07/66/47/341076647.db2.gz UOKOAJQXFFPVGC-UHFFFAOYSA-N 1 2 324.453 4.304 20 0 DIADLO CC[N@@H+](Cc1csc(Nc2ccccc2)n1)Cc1ccccn1 ZINC000131330608 341076648 /nfs/dbraw/zinc/07/66/48/341076648.db2.gz UOKOAJQXFFPVGC-UHFFFAOYSA-N 1 2 324.453 4.304 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ncc(C(C)C)s2)cc1 ZINC000544350346 341077401 /nfs/dbraw/zinc/07/74/01/341077401.db2.gz FOTLKULYUPKQBE-UHFFFAOYSA-N 1 2 304.459 4.297 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ncc(C(C)C)s2)cc1 ZINC000544350346 341077402 /nfs/dbraw/zinc/07/74/02/341077402.db2.gz FOTLKULYUPKQBE-UHFFFAOYSA-N 1 2 304.459 4.297 20 0 DIADLO Cc1ccccc1OCC[N@@H+](C)Cc1ncc(C(C)C)s1 ZINC000544351789 341077600 /nfs/dbraw/zinc/07/76/00/341077600.db2.gz WOESQQYZLLVDEL-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO Cc1ccccc1OCC[N@H+](C)Cc1ncc(C(C)C)s1 ZINC000544351789 341077601 /nfs/dbraw/zinc/07/76/01/341077601.db2.gz WOESQQYZLLVDEL-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO Cc1cccn2cc(-c3ccc(N[C@H](C)[C@H]4CCCO4)cc3)[nH+]c12 ZINC000544387139 341079752 /nfs/dbraw/zinc/07/97/52/341079752.db2.gz HQSPKLPPKAHTTK-DNVCBOLYSA-N 1 2 321.424 4.289 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](CC(C)C)c2cccs2)no1 ZINC000544451248 341082704 /nfs/dbraw/zinc/08/27/04/341082704.db2.gz CKGSOTQRWHPCSE-ZDUSSCGKSA-N 1 2 307.463 4.351 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccon2)cc1OC ZINC000544605964 341088426 /nfs/dbraw/zinc/08/84/26/341088426.db2.gz WCEIANFVTYTAQV-UONOGXRCSA-N 1 2 318.417 4.274 20 0 DIADLO Cc1ccc(F)c(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)c1 ZINC000544800047 341094153 /nfs/dbraw/zinc/09/41/53/341094153.db2.gz NGQZXKFYARTGQQ-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1ccccc1Cl ZINC000131567177 341096919 /nfs/dbraw/zinc/09/69/19/341096919.db2.gz KVJLIGYWVIGXCT-SNVBAGLBSA-N 1 2 304.752 4.471 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@@H](C)c2c(C)cccc2C)n1 ZINC000544895644 341097895 /nfs/dbraw/zinc/09/78/95/341097895.db2.gz KAZWWJBOGMJYPP-GJZGRUSLSA-N 1 2 301.434 4.441 20 0 DIADLO CC[C@@](C)([NH2+]Cc1ncc(-c2ccccc2)o1)c1nccs1 ZINC000072684407 341098025 /nfs/dbraw/zinc/09/80/25/341098025.db2.gz BTNZNHZGMNSMHC-QGZVFWFLSA-N 1 2 313.426 4.213 20 0 DIADLO Cc1ccc(Cc2nc(Cc3cccc4ccccc43)no2)c[nH+]1 ZINC000545027813 341105027 /nfs/dbraw/zinc/10/50/27/341105027.db2.gz XKUDPQBHFAEXIK-UHFFFAOYSA-N 1 2 315.376 4.108 20 0 DIADLO C[C@@H](c1noc(-c2cccc(Oc3cc[nH+]cc3)c2)n1)C1CC1 ZINC000545092798 341108033 /nfs/dbraw/zinc/10/80/33/341108033.db2.gz MLACMSDXNUCHHA-GFCCVEGCSA-N 1 2 307.353 4.437 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccc(OC2CCC2)cc1Cl ZINC000131710334 341109441 /nfs/dbraw/zinc/10/94/41/341109441.db2.gz DQXPDKFXJXPYPG-UHFFFAOYSA-N 1 2 316.788 4.227 20 0 DIADLO Cn1ccc2c1cccc2C(=O)Nc1c[nH+]ccc1OC(C)(C)C ZINC000131721374 341110049 /nfs/dbraw/zinc/11/00/49/341110049.db2.gz SOGOJURPLXTDMO-UHFFFAOYSA-N 1 2 323.396 4.003 20 0 DIADLO C[C@@H](C(=O)Nc1c[nH+]ccc1OC(C)(C)C)c1cccs1 ZINC000131736051 341110330 /nfs/dbraw/zinc/11/03/30/341110330.db2.gz OFKBWMWKHZRVKY-LLVKDONJSA-N 1 2 304.415 4.063 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3n2C)cn1 ZINC000545199315 341113185 /nfs/dbraw/zinc/11/31/85/341113185.db2.gz OOMMXMGCXWLJCK-LJQANCHMSA-N 1 2 320.440 4.004 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3n2C)cn1 ZINC000545199315 341113186 /nfs/dbraw/zinc/11/31/86/341113186.db2.gz OOMMXMGCXWLJCK-LJQANCHMSA-N 1 2 320.440 4.004 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)c(Cl)c1 ZINC000073120364 341113298 /nfs/dbraw/zinc/11/32/98/341113298.db2.gz DPLNUGADIGFBOQ-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO C[C@H](C(=O)Nc1c[nH+]ccc1OC(C)(C)C)c1cccc(F)c1 ZINC000132116421 341116608 /nfs/dbraw/zinc/11/66/08/341116608.db2.gz TUEWCNHONHCKBW-LBPRGKRZSA-N 1 2 316.376 4.140 20 0 DIADLO CCCC[C@@H](C)[NH2+]c1ccc(NS(=O)(=O)CCCC)cc1 ZINC000545239837 341116617 /nfs/dbraw/zinc/11/66/17/341116617.db2.gz OSGWSZUAEKSKAC-CQSZACIVSA-N 1 2 312.479 4.219 20 0 DIADLO CC[C@H](C)c1ccc([C@H]([NH2+]Cc2nc(C)no2)C(C)C)cc1 ZINC000073644381 341119523 /nfs/dbraw/zinc/11/95/23/341119523.db2.gz ZEZWKEXSMYBUHS-SCLBCKFNSA-N 1 2 301.434 4.378 20 0 DIADLO Fc1ccc2oc(C[N@H+](Cc3ccccc3F)C3CC3)nc2c1 ZINC000132294252 341120181 /nfs/dbraw/zinc/12/01/81/341120181.db2.gz DCDSORVUDUFERU-UHFFFAOYSA-N 1 2 314.335 4.271 20 0 DIADLO Fc1ccc2oc(C[N@@H+](Cc3ccccc3F)C3CC3)nc2c1 ZINC000132294252 341120182 /nfs/dbraw/zinc/12/01/82/341120182.db2.gz DCDSORVUDUFERU-UHFFFAOYSA-N 1 2 314.335 4.271 20 0 DIADLO Cc1ccccc1-c1nc(C[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)no1 ZINC000132363044 341121301 /nfs/dbraw/zinc/12/13/01/341121301.db2.gz LLWADSPMJWGRSD-DNVCBOLYSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccccc1-c1nc(C[N@@H+]2C[C@@H](C)[C@@H]2c2ccccc2)no1 ZINC000132363044 341121302 /nfs/dbraw/zinc/12/13/02/341121302.db2.gz LLWADSPMJWGRSD-DNVCBOLYSA-N 1 2 319.408 4.238 20 0 DIADLO C[C@H](C(=O)Nc1c[nH+]ccc1OC(C)(C)C)c1ccsc1 ZINC000132430809 341123044 /nfs/dbraw/zinc/12/30/44/341123044.db2.gz WLUVPXHORZXVJB-NSHDSACASA-N 1 2 304.415 4.063 20 0 DIADLO Cc1ccc(Cc2nc(-c3ccc(OC(C)(C)C)cc3)no2)c[nH+]1 ZINC000545577768 341131141 /nfs/dbraw/zinc/13/11/41/341131141.db2.gz RYFQCKZDYBMDHY-UHFFFAOYSA-N 1 2 323.396 4.208 20 0 DIADLO CCCCSCCC(=O)Nc1c[nH+]ccc1OC(C)(C)C ZINC000132611812 341131643 /nfs/dbraw/zinc/13/16/43/341131643.db2.gz WDFMUKVBTLVLNP-UHFFFAOYSA-N 1 2 310.463 4.121 20 0 DIADLO Cc1ccc(Cc2noc([C@H](C)CCCc3ccccc3)n2)c[nH+]1 ZINC000545631885 341133979 /nfs/dbraw/zinc/13/39/79/341133979.db2.gz HGXVJKUJNJSJNJ-OAHLLOKOSA-N 1 2 321.424 4.490 20 0 DIADLO Cc1ccc(Cc2noc(/C=C\c3ccc(Cl)cc3)n2)c[nH+]1 ZINC000545638345 341134468 /nfs/dbraw/zinc/13/44/68/341134468.db2.gz ZITSIDVFNXAFMU-TWGQIWQCSA-N 1 2 311.772 4.188 20 0 DIADLO C[C@@H](c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1)c1ccccc1 ZINC000545688550 341136378 /nfs/dbraw/zinc/13/63/78/341136378.db2.gz UEPGQGCZZNBLCT-CQSZACIVSA-N 1 2 316.364 4.074 20 0 DIADLO Cc1cc(F)cc(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)c1 ZINC000545697681 341136994 /nfs/dbraw/zinc/13/69/94/341136994.db2.gz YQBFSAVVVBAUIR-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Cc1[nH]c2ccc(COc3ccc(F)c4c3C(=O)C[C@H]4C)cc2[nH+]1 ZINC000545935511 341147091 /nfs/dbraw/zinc/14/70/91/341147091.db2.gz WXVPFRVABZWRRS-SNVBAGLBSA-N 1 2 324.355 4.279 20 0 DIADLO Cc1[nH]c2cc(COc3ccc(F)c4c3C(=O)C[C@H]4C)ccc2[nH+]1 ZINC000545935511 341147092 /nfs/dbraw/zinc/14/70/92/341147092.db2.gz WXVPFRVABZWRRS-SNVBAGLBSA-N 1 2 324.355 4.279 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1nc2cc(F)ccc2o1 ZINC000133006754 341151701 /nfs/dbraw/zinc/15/17/01/341151701.db2.gz MADBPHBNSOGUES-LLVKDONJSA-N 1 2 302.324 4.299 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1nc2cc(F)ccc2o1 ZINC000133006754 341151702 /nfs/dbraw/zinc/15/17/02/341151702.db2.gz MADBPHBNSOGUES-LLVKDONJSA-N 1 2 302.324 4.299 20 0 DIADLO CSCCc1ccc(NCCCc2c[nH+]ccc2C)cc1 ZINC000564299605 341153321 /nfs/dbraw/zinc/15/33/21/341153321.db2.gz ZTCNVSZXVMAMHD-UHFFFAOYSA-N 1 2 300.471 4.340 20 0 DIADLO Cc1ccc(-c2noc(-c3ccccc3C)n2)c(N2CCCC2)[nH+]1 ZINC000546372084 341165488 /nfs/dbraw/zinc/16/54/88/341165488.db2.gz GTIBTEPCVWYMHE-UHFFFAOYSA-N 1 2 320.396 4.016 20 0 DIADLO Cc1ccc(C(=O)N2C[C@H](C)CC[C@H]2C)cc1Oc1cc[nH+]cc1 ZINC000075285105 341173840 /nfs/dbraw/zinc/17/38/40/341173840.db2.gz BMIJKDMNSIUYRC-GDBMZVCRSA-N 1 2 324.424 4.443 20 0 DIADLO CCCCOc1ccccc1CN[C@H]1C[N@H+](C)Cc2ccccc21 ZINC000546626829 341175848 /nfs/dbraw/zinc/17/58/48/341175848.db2.gz YBUSIRZFALHIGT-FQEVSTJZSA-N 1 2 324.468 4.142 20 0 DIADLO CCCCOc1ccccc1CN[C@H]1C[N@@H+](C)Cc2ccccc21 ZINC000546626829 341175849 /nfs/dbraw/zinc/17/58/49/341175849.db2.gz YBUSIRZFALHIGT-FQEVSTJZSA-N 1 2 324.468 4.142 20 0 DIADLO CSC1(C[N@@H+]2CCn3c(cc4ccc(Cl)cc43)C2)CC1 ZINC000564306763 341177360 /nfs/dbraw/zinc/17/73/60/341177360.db2.gz KQTOHLOWIYZZGF-UHFFFAOYSA-N 1 2 306.862 4.006 20 0 DIADLO CSC1(C[N@H+]2CCn3c(cc4ccc(Cl)cc43)C2)CC1 ZINC000564306763 341177361 /nfs/dbraw/zinc/17/73/61/341177361.db2.gz KQTOHLOWIYZZGF-UHFFFAOYSA-N 1 2 306.862 4.006 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1ccncc1Cl ZINC000075590912 341179036 /nfs/dbraw/zinc/17/90/36/341179036.db2.gz NCNNQBXOSFLGDK-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1ccncc1Cl ZINC000075590912 341179037 /nfs/dbraw/zinc/17/90/37/341179037.db2.gz NCNNQBXOSFLGDK-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO c1cn(Cc2ccccc2)c(C[N@H+](Cc2ccccc2)C2CC2)n1 ZINC000075609274 341179499 /nfs/dbraw/zinc/17/94/99/341179499.db2.gz AAXUNOYZQOBAMU-UHFFFAOYSA-N 1 2 317.436 4.096 20 0 DIADLO c1cn(Cc2ccccc2)c(C[N@@H+](Cc2ccccc2)C2CC2)n1 ZINC000075609274 341179500 /nfs/dbraw/zinc/17/95/00/341179500.db2.gz AAXUNOYZQOBAMU-UHFFFAOYSA-N 1 2 317.436 4.096 20 0 DIADLO C[C@@H](c1nc(-c2cccs2)no1)[N@H+](C)Cc1ccccc1F ZINC000075608334 341179537 /nfs/dbraw/zinc/17/95/37/341179537.db2.gz SSUHDMHDBHEEAH-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO C[C@@H](c1nc(-c2cccs2)no1)[N@@H+](C)Cc1ccccc1F ZINC000075608334 341179538 /nfs/dbraw/zinc/17/95/38/341179538.db2.gz SSUHDMHDBHEEAH-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2ccncc2Cl)s1 ZINC000075766939 341182322 /nfs/dbraw/zinc/18/23/22/341182322.db2.gz KXMZKWNBMOHBQD-NSHDSACASA-N 1 2 309.866 4.255 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccncc2Cl)s1 ZINC000075766939 341182323 /nfs/dbraw/zinc/18/23/23/341182323.db2.gz KXMZKWNBMOHBQD-NSHDSACASA-N 1 2 309.866 4.255 20 0 DIADLO Clc1ccccc1-c1ccc(C[NH2+]Cc2nccs2)o1 ZINC000075825676 341184051 /nfs/dbraw/zinc/18/40/51/341184051.db2.gz TYBOOMQIHXOKAS-UHFFFAOYSA-N 1 2 304.802 4.346 20 0 DIADLO C[C@@H]1C[C@@H](Nc2[nH+]cccc2OCc2ccccc2)C[C@H](C)O1 ZINC000546887785 341185537 /nfs/dbraw/zinc/18/55/37/341185537.db2.gz SWUVCLFFLSLCQW-SCAQPMJSSA-N 1 2 312.413 4.029 20 0 DIADLO C[C@H]1CC(Nc2[nH+]cccc2OCc2ccccc2)C[C@H](C)O1 ZINC000546887783 341185565 /nfs/dbraw/zinc/18/55/65/341185565.db2.gz SWUVCLFFLSLCQW-GJZGRUSLSA-N 1 2 312.413 4.029 20 0 DIADLO c1cc(C[NH2+][C@@H](c2cc3ccccc3o2)c2ccccc2)n[nH]1 ZINC000236603193 341188637 /nfs/dbraw/zinc/18/86/37/341188637.db2.gz PTYRPIQQVUSRGK-LJQANCHMSA-N 1 2 303.365 4.035 20 0 DIADLO Cc1ccc(Cc2noc(COc3cccc(C(C)C)c3)n2)c[nH+]1 ZINC000547052016 341193751 /nfs/dbraw/zinc/19/37/51/341193751.db2.gz CFGKCNDDBVJWRD-UHFFFAOYSA-N 1 2 323.396 4.066 20 0 DIADLO Cc1[nH]c2ccc(-c3noc(Cc4ccc(C)[nH+]c4)n3)cc2c1C ZINC000547055434 341193874 /nfs/dbraw/zinc/19/38/74/341193874.db2.gz DZOIQKSQGFCAJG-UHFFFAOYSA-N 1 2 318.380 4.129 20 0 DIADLO C[C@H](c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1)c1ccccc1 ZINC000547109346 341196285 /nfs/dbraw/zinc/19/62/85/341196285.db2.gz UEPGQGCZZNBLCT-AWEZNQCLSA-N 1 2 316.364 4.074 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CCc2ccc(F)cc2C1 ZINC000133898334 341198259 /nfs/dbraw/zinc/19/82/59/341198259.db2.gz TXMIVEGQRBQVCB-LBPRGKRZSA-N 1 2 302.393 4.231 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCc2ccc(F)cc2C1 ZINC000133898334 341198260 /nfs/dbraw/zinc/19/82/60/341198260.db2.gz TXMIVEGQRBQVCB-LBPRGKRZSA-N 1 2 302.393 4.231 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1 ZINC000547399314 341211296 /nfs/dbraw/zinc/21/12/96/341211296.db2.gz UCELNKJRNFNBJX-INIZCTEOSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1 ZINC000547399314 341211297 /nfs/dbraw/zinc/21/12/97/341211297.db2.gz UCELNKJRNFNBJX-INIZCTEOSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1 ZINC000547399315 341211341 /nfs/dbraw/zinc/21/13/41/341211341.db2.gz UCELNKJRNFNBJX-MRXNPFEDSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1 ZINC000547399315 341211342 /nfs/dbraw/zinc/21/13/42/341211342.db2.gz UCELNKJRNFNBJX-MRXNPFEDSA-N 1 2 324.255 4.454 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1ccc(C)cn1)c1ccccc1 ZINC000134301156 341212561 /nfs/dbraw/zinc/21/25/61/341212561.db2.gz WXIOGKSIHZGTQU-NRFANRHFSA-N 1 2 318.420 4.278 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@@H](COCC(C)C)c2ccco2)o1 ZINC000152641744 341213655 /nfs/dbraw/zinc/21/36/55/341213655.db2.gz SXDFYXLVJURABI-ZBFHGGJFSA-N 1 2 305.418 4.500 20 0 DIADLO CCCc1cccc(C[NH2+][C@@H](c2nccn2C)c2ccccc2)c1 ZINC000547499757 341218089 /nfs/dbraw/zinc/21/80/89/341218089.db2.gz QTUWYAMNPZHPBZ-HXUWFJFHSA-N 1 2 319.452 4.252 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCCN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000547504378 341218489 /nfs/dbraw/zinc/21/84/89/341218489.db2.gz CUWDHDQSXXYDFZ-SCZZXKLOSA-N 1 2 312.257 4.268 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCCN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000547504379 341218542 /nfs/dbraw/zinc/21/85/42/341218542.db2.gz CUWDHDQSXXYDFZ-WCBMZHEXSA-N 1 2 312.257 4.268 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C1=CCCCCC1 ZINC000547521242 341220140 /nfs/dbraw/zinc/22/01/40/341220140.db2.gz DCSRJPXTRQJFIK-UHFFFAOYSA-N 1 2 315.804 4.355 20 0 DIADLO COc1ccccc1-c1nc(C[NH+]2Cc3ccccc3C2)cs1 ZINC000077283181 341222250 /nfs/dbraw/zinc/22/22/50/341222250.db2.gz QRNAPLOBKRUSRN-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](CCCc3ccsc3)CCO2)c(F)c1 ZINC000547649073 341224996 /nfs/dbraw/zinc/22/49/96/341224996.db2.gz JJCPAQQGTHXREB-QGZVFWFLSA-N 1 2 323.408 4.032 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](CCCc3ccsc3)CCO2)c(F)c1 ZINC000547649073 341224997 /nfs/dbraw/zinc/22/49/97/341224997.db2.gz JJCPAQQGTHXREB-QGZVFWFLSA-N 1 2 323.408 4.032 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](C/C=C/c3ccccc3)CCO2)c(F)c1 ZINC000547647694 341225000 /nfs/dbraw/zinc/22/50/00/341225000.db2.gz DDQBZKQNEQGNBV-QTWIXLPOSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](C/C=C/c3ccccc3)CCO2)c(F)c1 ZINC000547647694 341225001 /nfs/dbraw/zinc/22/50/01/341225001.db2.gz DDQBZKQNEQGNBV-QTWIXLPOSA-N 1 2 315.363 4.052 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1csc(C2CC2)n1 ZINC000134875644 341225774 /nfs/dbraw/zinc/22/57/74/341225774.db2.gz XMUQZVADEZDVCJ-SNVBAGLBSA-N 1 2 308.397 4.492 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000134875644 341225775 /nfs/dbraw/zinc/22/57/75/341225775.db2.gz XMUQZVADEZDVCJ-SNVBAGLBSA-N 1 2 308.397 4.492 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(CSC(F)F)o2)s1 ZINC000134909700 341226483 /nfs/dbraw/zinc/22/64/83/341226483.db2.gz CHLRPBMFOZTEQR-SECBINFHSA-N 1 2 318.414 4.351 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000547972524 341241381 /nfs/dbraw/zinc/24/13/81/341241381.db2.gz KDYFSRMRUJXUKE-SGTLLEGYSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000547972524 341241382 /nfs/dbraw/zinc/24/13/82/341241382.db2.gz KDYFSRMRUJXUKE-SGTLLEGYSA-N 1 2 321.342 4.238 20 0 DIADLO FC(F)(F)CC[N@@H+](Cc1csc(C2CC2)n1)CC1CC1 ZINC000135734218 341245055 /nfs/dbraw/zinc/24/50/55/341245055.db2.gz WYMBNFVRAHQNTR-UHFFFAOYSA-N 1 2 304.381 4.185 20 0 DIADLO FC(F)(F)CC[N@H+](Cc1csc(C2CC2)n1)CC1CC1 ZINC000135734218 341245056 /nfs/dbraw/zinc/24/50/56/341245056.db2.gz WYMBNFVRAHQNTR-UHFFFAOYSA-N 1 2 304.381 4.185 20 0 DIADLO CCC(=O)c1cccc(NCc2cn3cc(Cl)ccc3[nH+]2)c1 ZINC000135744691 341245316 /nfs/dbraw/zinc/24/53/16/341245316.db2.gz WJXPRNLRFNAUEX-UHFFFAOYSA-N 1 2 313.788 4.193 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)N[C@@H]1C=CCCC1 ZINC000135815457 341246434 /nfs/dbraw/zinc/24/64/34/341246434.db2.gz MULSMRXISNJKAA-CQSZACIVSA-N 1 2 309.369 4.104 20 0 DIADLO CC(C)C(=O)Nc1ccc(N[C@@H](C)c2cn3ccccc3[nH+]2)cc1 ZINC000548385023 341258168 /nfs/dbraw/zinc/25/81/68/341258168.db2.gz PZYNZASSRVALBG-AWEZNQCLSA-N 1 2 322.412 4.102 20 0 DIADLO Cc1cc(NC(=O)N2CCC(c3c[nH+]c[nH]3)CC2)ccc1C1CC1 ZINC000548499290 341264311 /nfs/dbraw/zinc/26/43/11/341264311.db2.gz CTUZBHBHPIMNMC-UHFFFAOYSA-N 1 2 324.428 4.007 20 0 DIADLO Cc1cc(NC(=O)N2CCC(c3c[nH]c[nH+]3)CC2)ccc1C1CC1 ZINC000548499290 341264312 /nfs/dbraw/zinc/26/43/12/341264312.db2.gz CTUZBHBHPIMNMC-UHFFFAOYSA-N 1 2 324.428 4.007 20 0 DIADLO c1[nH+]c(-c2ccc(N[C@@H]3CCC[C@H]4C[C@H]43)cc2)n2c1CCCC2 ZINC000548884919 341279892 /nfs/dbraw/zinc/27/98/92/341279892.db2.gz FXUDWNIHHIRFNK-KFKAGJAMSA-N 1 2 307.441 4.487 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@H](C)Cn2cccn2)c1 ZINC000137885878 341282638 /nfs/dbraw/zinc/28/26/38/341282638.db2.gz JWNFJTNBTJVLOJ-MRXNPFEDSA-N 1 2 323.444 4.047 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)o1 ZINC000549077488 341285429 /nfs/dbraw/zinc/28/54/29/341285429.db2.gz LEUZQZFESSNUNL-MRXNPFEDSA-N 1 2 324.346 4.497 20 0 DIADLO FC(F)O[C@H]1CC[N@H+](Cc2nc(C3CCCCC3)cs2)C1 ZINC000549407959 341293551 /nfs/dbraw/zinc/29/35/51/341293551.db2.gz IFQUXBNUKXJPOW-LBPRGKRZSA-N 1 2 316.417 4.004 20 0 DIADLO FC(F)O[C@H]1CC[N@@H+](Cc2nc(C3CCCCC3)cs2)C1 ZINC000549407959 341293552 /nfs/dbraw/zinc/29/35/52/341293552.db2.gz IFQUXBNUKXJPOW-LBPRGKRZSA-N 1 2 316.417 4.004 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)cn1 ZINC000549422986 341294144 /nfs/dbraw/zinc/29/41/44/341294144.db2.gz XEMAFQOZTYNSDA-QGZVFWFLSA-N 1 2 321.827 4.188 20 0 DIADLO CC(C)n1cc(C[N@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)cn1 ZINC000549422986 341294145 /nfs/dbraw/zinc/29/41/45/341294145.db2.gz XEMAFQOZTYNSDA-QGZVFWFLSA-N 1 2 321.827 4.188 20 0 DIADLO CCc1nc(C(C)C)ccc1C[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000549709394 341301032 /nfs/dbraw/zinc/30/10/32/341301032.db2.gz BLNIEMZEWKIPIS-IBGZPJMESA-N 1 2 312.461 4.218 20 0 DIADLO CCc1nc(C(C)C)ccc1C[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000549709394 341301033 /nfs/dbraw/zinc/30/10/33/341301033.db2.gz BLNIEMZEWKIPIS-IBGZPJMESA-N 1 2 312.461 4.218 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(C2CCC2)cc1)c1nc(C(C)(C)C)no1 ZINC000549760959 341302455 /nfs/dbraw/zinc/30/24/55/341302455.db2.gz NWLRKEGZLFVRBY-CYBMUJFWSA-N 1 2 313.445 4.485 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2c(F)cccc2F)c2ccccc2n1 ZINC000549947504 341307747 /nfs/dbraw/zinc/30/77/47/341307747.db2.gz SBKIJGWVSDNLQV-UHFFFAOYSA-N 1 2 312.363 4.453 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2c(F)cccc2F)c2ccccc2n1 ZINC000549947504 341307748 /nfs/dbraw/zinc/30/77/48/341307748.db2.gz SBKIJGWVSDNLQV-UHFFFAOYSA-N 1 2 312.363 4.453 20 0 DIADLO FC[C@@H]1CCC[N@@H+]1Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000550409757 341316381 /nfs/dbraw/zinc/31/63/81/341316381.db2.gz YSCVCEODOIMSED-AWEZNQCLSA-N 1 2 310.825 4.397 20 0 DIADLO FC[C@@H]1CCC[N@H+]1Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000550409757 341316382 /nfs/dbraw/zinc/31/63/82/341316382.db2.gz YSCVCEODOIMSED-AWEZNQCLSA-N 1 2 310.825 4.397 20 0 DIADLO Fc1ccc(C[N@@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000550473629 341317442 /nfs/dbraw/zinc/31/74/42/341317442.db2.gz ANBNQFCWKZJPCU-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc(C[N@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000550473629 341317443 /nfs/dbraw/zinc/31/74/43/341317443.db2.gz ANBNQFCWKZJPCU-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO CCCC[C@H](CCC)C[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000550679986 341321257 /nfs/dbraw/zinc/32/12/57/341321257.db2.gz DUYBWRAZONQKTL-DZGCQCFKSA-N 1 2 306.479 4.152 20 0 DIADLO CCCC[C@@H](CCC)C[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000550679988 341321372 /nfs/dbraw/zinc/32/13/72/341321372.db2.gz DUYBWRAZONQKTL-UKRRQHHQSA-N 1 2 306.479 4.152 20 0 DIADLO Clc1cnc(NCCCc2[nH]c3ccccc3[nH+]2)c(Cl)c1 ZINC000550786176 341322889 /nfs/dbraw/zinc/32/28/89/341322889.db2.gz LVNWVGYYOLRZJE-UHFFFAOYSA-N 1 2 321.211 4.309 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)o1 ZINC000246188358 341332497 /nfs/dbraw/zinc/33/24/97/341332497.db2.gz NWWAAQWTVHKQLZ-KCXAZCMYSA-N 1 2 303.402 4.036 20 0 DIADLO CSCCc1ccc(NCc2cn3cc(C)ccc3[nH+]2)cc1 ZINC000551239488 341334972 /nfs/dbraw/zinc/33/49/72/341334972.db2.gz IEVZHGBJJPJEPG-UHFFFAOYSA-N 1 2 311.454 4.160 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1cn2ccccc2n1 ZINC000551273001 341336563 /nfs/dbraw/zinc/33/65/63/341336563.db2.gz ZHWOAYLFHDYZLA-YWZLYKJASA-N 1 2 317.392 4.368 20 0 DIADLO Cc1ccn(-c2ccc([NH2+]CCCCC3CCOCC3)cc2)n1 ZINC000551373076 341339774 /nfs/dbraw/zinc/33/97/74/341339774.db2.gz GBZZBHUEELYGRD-UHFFFAOYSA-N 1 2 313.445 4.190 20 0 DIADLO Fc1cc(C[NH+]2CCC(CC(F)(F)F)CC2)cc(F)c1F ZINC000551586214 341346557 /nfs/dbraw/zinc/34/65/57/341346557.db2.gz MNTUEDWVKMFUME-UHFFFAOYSA-N 1 2 311.269 4.268 20 0 DIADLO Cc1c(C[N@@H+](C)[C@H](C)c2cc(Cl)ccc2Cl)cnn1C ZINC000551940665 341355652 /nfs/dbraw/zinc/35/56/52/341355652.db2.gz OZPZLRNELLQCOR-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO Cc1c(C[N@H+](C)[C@H](C)c2cc(Cl)ccc2Cl)cnn1C ZINC000551940665 341355653 /nfs/dbraw/zinc/35/56/53/341355653.db2.gz OZPZLRNELLQCOR-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)[C@H](C)c2ccccc2)cs1 ZINC000246691730 341355666 /nfs/dbraw/zinc/35/56/66/341355666.db2.gz FDWJDTACGHQPOC-ZIAGYGMSSA-N 1 2 304.459 4.434 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)[C@H](C)c2ccccc2)cs1 ZINC000246691730 341355667 /nfs/dbraw/zinc/35/56/67/341355667.db2.gz FDWJDTACGHQPOC-ZIAGYGMSSA-N 1 2 304.459 4.434 20 0 DIADLO Cc1nc(C[N@H+](CCC(F)(F)F)CC2CC2)nc2ccccc12 ZINC000084137928 341357606 /nfs/dbraw/zinc/35/76/06/341357606.db2.gz VSPILISJNRIKAE-UHFFFAOYSA-N 1 2 323.362 4.103 20 0 DIADLO Cc1nc(C[N@@H+](CCC(F)(F)F)CC2CC2)nc2ccccc12 ZINC000084137928 341357607 /nfs/dbraw/zinc/35/76/07/341357607.db2.gz VSPILISJNRIKAE-UHFFFAOYSA-N 1 2 323.362 4.103 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@H]2CCC2CCCC2)c(C)c[nH+]1 ZINC000551991935 341358141 /nfs/dbraw/zinc/35/81/41/341358141.db2.gz UALHUGIFRURWFJ-KRWDZBQOSA-N 1 2 315.461 4.087 20 0 DIADLO C[C@H]([NH2+][C@H]1CC2(CCC2)Oc2ccccc21)c1cscn1 ZINC000552002266 341359083 /nfs/dbraw/zinc/35/90/83/341359083.db2.gz XVQDQQXWLAILOK-JSGCOSHPSA-N 1 2 300.427 4.240 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+]2CCO[C@@H](c3cccc(F)c3)C2)o1 ZINC000552033128 341363383 /nfs/dbraw/zinc/36/33/83/341363383.db2.gz NPUXNIWMRCKTIM-XVGQJIODSA-N 1 2 315.388 4.116 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CCO[C@@H](c3cccc(F)c3)C2)o1 ZINC000552033128 341363384 /nfs/dbraw/zinc/36/33/84/341363384.db2.gz NPUXNIWMRCKTIM-XVGQJIODSA-N 1 2 315.388 4.116 20 0 DIADLO C[C@@H](Nc1cccc(OCc2cccc(F)c2)c1)c1[nH]cc[nH+]1 ZINC000552063232 341366535 /nfs/dbraw/zinc/36/65/35/341366535.db2.gz UAOSVQUMANWZOT-CYBMUJFWSA-N 1 2 311.360 4.301 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(F)cc2Cl)[C@H]1c1ccncc1 ZINC000552064441 341366727 /nfs/dbraw/zinc/36/67/27/341366727.db2.gz OVAOOSXNMZAIKL-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(F)cc2Cl)[C@H]1c1ccncc1 ZINC000552064441 341366728 /nfs/dbraw/zinc/36/67/28/341366728.db2.gz OVAOOSXNMZAIKL-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO Cc1c(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)cnn1CC(C)C ZINC000552065794 341366850 /nfs/dbraw/zinc/36/68/50/341366850.db2.gz OFSYXXIANQEDEN-QGZVFWFLSA-N 1 2 315.465 4.304 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)c1cc(F)c(Cl)cc1Cl ZINC000552192674 341377327 /nfs/dbraw/zinc/37/73/27/341377327.db2.gz CHBPBTCSBSGDCC-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO Cc1cc(NC(=O)[C@H]2[C@@H]3CCC[C@@H]32)ccc1Oc1cc[nH+]cc1 ZINC000248654792 341382989 /nfs/dbraw/zinc/38/29/89/341382989.db2.gz PWPRHTKJBZCOMT-VQFNDLOPSA-N 1 2 308.381 4.167 20 0 DIADLO OCCCc1cccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000552282148 341383789 /nfs/dbraw/zinc/38/37/89/341383789.db2.gz XPZOLJXLXHZZCY-GOSISDBHSA-N 1 2 313.445 4.068 20 0 DIADLO C[C@H](C[N@@H+]1Cc2cnn(-c3ccccc3)c2C1)c1ccc(F)cc1 ZINC000552442614 341394120 /nfs/dbraw/zinc/39/41/20/341394120.db2.gz FWFVQEPUATXWHI-OAHLLOKOSA-N 1 2 321.399 4.131 20 0 DIADLO C[C@H](C[N@H+]1Cc2cnn(-c3ccccc3)c2C1)c1ccc(F)cc1 ZINC000552442614 341394121 /nfs/dbraw/zinc/39/41/21/341394121.db2.gz FWFVQEPUATXWHI-OAHLLOKOSA-N 1 2 321.399 4.131 20 0 DIADLO Fc1ccccc1C=C1CC[NH+](Cc2nc3ccccc3[nH]2)CC1 ZINC000552470447 341395336 /nfs/dbraw/zinc/39/53/36/341395336.db2.gz QZBHGXDEPZXMAF-UHFFFAOYSA-N 1 2 321.399 4.381 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](C)C/C(C)=C\c2ccccc2)cs1 ZINC000552486849 341396005 /nfs/dbraw/zinc/39/60/05/341396005.db2.gz BVHMYTDUYKRUBW-LTBFUDJGSA-N 1 2 316.470 4.386 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](C)C/C(C)=C\c2ccccc2)cs1 ZINC000552486849 341396006 /nfs/dbraw/zinc/39/60/06/341396006.db2.gz BVHMYTDUYKRUBW-LTBFUDJGSA-N 1 2 316.470 4.386 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc(-c3ccccc3F)no2)[C@H]1c1ccccc1 ZINC000249295541 341396234 /nfs/dbraw/zinc/39/62/34/341396234.db2.gz BFNYUHVLTNATLC-FZKQIMNGSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc(-c3ccccc3F)no2)[C@H]1c1ccccc1 ZINC000249295541 341396235 /nfs/dbraw/zinc/39/62/35/341396235.db2.gz BFNYUHVLTNATLC-FZKQIMNGSA-N 1 2 323.371 4.069 20 0 DIADLO CCc1cccc(C[NH2+][C@H](c2nccn2C)c2cccc(F)c2)c1 ZINC000572531866 341405697 /nfs/dbraw/zinc/40/56/97/341405697.db2.gz NCCGTOUADOTCAY-IBGZPJMESA-N 1 2 323.415 4.001 20 0 DIADLO Clc1cccc2c(NCCc3c[nH]c4ncccc34)cc[nH+]c12 ZINC000553170186 341418643 /nfs/dbraw/zinc/41/86/43/341418643.db2.gz RQKVNYFIQYMQBK-UHFFFAOYSA-N 1 2 322.799 4.419 20 0 DIADLO Cc1cc[nH+]c(NCc2c(F)cc(F)c(F)c2F)c1Cl ZINC000553568745 341431802 /nfs/dbraw/zinc/43/18/02/341431802.db2.gz PDKXJRJIMYQRBY-UHFFFAOYSA-N 1 2 304.674 4.212 20 0 DIADLO CCC[C@H](CC1CCCCC1)C(=O)NCc1c[nH+]ccc1OC ZINC000554369485 341451651 /nfs/dbraw/zinc/45/16/51/341451651.db2.gz IWVQCSSUOIXOKV-MRXNPFEDSA-N 1 2 318.461 4.093 20 0 DIADLO COC(=O)CCC[C@@H]1CCC[C@H]([NH2+][C@@H](C(C)C)C(F)(F)F)C1 ZINC000556178938 341496529 /nfs/dbraw/zinc/49/65/29/341496529.db2.gz QBFLUFWCXNJVCK-YDHLFZDLSA-N 1 2 323.399 4.065 20 0 DIADLO Cc1cc(NCc2noc3ccccc23)c2cccc(F)c2[nH+]1 ZINC000564506530 341502790 /nfs/dbraw/zinc/50/27/90/341502790.db2.gz QOECXXKVXWMAFV-UHFFFAOYSA-N 1 2 307.328 4.436 20 0 DIADLO CCCO[C@H]1CCCN(c2[nH+]ccc3cc(F)ccc32)CC1 ZINC000564891914 341512601 /nfs/dbraw/zinc/51/26/01/341512601.db2.gz BOUNMYANHGJQIN-INIZCTEOSA-N 1 2 302.393 4.159 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1nc2ccc(Cl)cc2n1C ZINC000565490087 341528906 /nfs/dbraw/zinc/52/89/06/341528906.db2.gz FUBXIWRVDUZQRW-VHSXEESVSA-N 1 2 320.849 4.095 20 0 DIADLO CC(C)c1nc(N[C@H](C)c2cccc(N3CCCC3)c2)cc[nH+]1 ZINC000154051993 341583787 /nfs/dbraw/zinc/58/37/87/341583787.db2.gz MXPXARPTRNZNKX-OAHLLOKOSA-N 1 2 310.445 4.373 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccccc2OCc2ccccc2)no1 ZINC000567432401 341604408 /nfs/dbraw/zinc/60/44/08/341604408.db2.gz SQGZBGFCXQKVNA-INIZCTEOSA-N 1 2 322.408 4.413 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@H](C)c2ccccc2OC)n1 ZINC000271714016 341624266 /nfs/dbraw/zinc/62/42/66/341624266.db2.gz PYESBRJSHONUTQ-CQSZACIVSA-N 1 2 301.434 4.104 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nc(C(F)(F)F)cs2)cc1F ZINC000157307952 341636094 /nfs/dbraw/zinc/63/60/94/341636094.db2.gz LXAQWFYRTZSVNX-SECBINFHSA-N 1 2 318.339 4.460 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(OCC(C)C)cc2)s1 ZINC000274175424 341641450 /nfs/dbraw/zinc/64/14/50/341641450.db2.gz IBNGKYIDNBBAPH-QWHCGFSZSA-N 1 2 319.474 4.293 20 0 DIADLO C[C@@H](CC(=O)N(c1ccsc1)C1CCCCC1)n1cc[nH+]c1 ZINC000567992344 341644216 /nfs/dbraw/zinc/64/42/16/341644216.db2.gz OPXTZGFXQBZWQU-AWEZNQCLSA-N 1 2 317.458 4.262 20 0 DIADLO CC(C)CC[C@H](O)CNc1cccc(Oc2cc[nH+]cc2)c1 ZINC000568976903 341687032 /nfs/dbraw/zinc/68/70/32/341687032.db2.gz JRMILYXOCLARHW-INIZCTEOSA-N 1 2 300.402 4.083 20 0 DIADLO O=C(CCCn1cccc1)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000159253309 341692926 /nfs/dbraw/zinc/69/29/26/341692926.db2.gz WAQPMJRFNJBZNN-UHFFFAOYSA-N 1 2 321.380 4.094 20 0 DIADLO Cc1ccc2sc(C(=O)N[C@H](c3[nH]cc[nH+]3)C(C)C)cc2c1 ZINC000569176564 341693117 /nfs/dbraw/zinc/69/31/17/341693117.db2.gz CXSIFHKTRMMLGH-HNNXBMFYSA-N 1 2 313.426 4.060 20 0 DIADLO O=C(N[C@H](C1CC1)C1CCC1)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000572837657 341705999 /nfs/dbraw/zinc/70/59/99/341705999.db2.gz OSNZWHFUILSDTG-IBGZPJMESA-N 1 2 322.408 4.182 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2ccc(F)cc2F)o1 ZINC000165233682 341710400 /nfs/dbraw/zinc/71/04/00/341710400.db2.gz CYWFFXSLYLTLNY-MEDUHNTESA-N 1 2 309.356 4.159 20 0 DIADLO Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1noc(Cc2ccccc2)n1 ZINC000165419442 341711776 /nfs/dbraw/zinc/71/17/76/341711776.db2.gz XWGZNSWVVSHAQC-CVEARBPZSA-N 1 2 321.424 4.381 20 0 DIADLO Fc1cccc(F)c1C1CC[NH+](Cc2ccc(Cl)cn2)CC1 ZINC000574816813 341769786 /nfs/dbraw/zinc/76/97/86/341769786.db2.gz HZPXDPQPGHGCIS-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1nc([C@H](C)C(C)(C)C)no1 ZINC000575024454 341772436 /nfs/dbraw/zinc/77/24/36/341772436.db2.gz BZSTZKDKRWDTEH-LBPRGKRZSA-N 1 2 312.417 4.120 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1nc([C@@H](C)C(C)(C)C)no1 ZINC000575024453 341772552 /nfs/dbraw/zinc/77/25/52/341772552.db2.gz BZSTZKDKRWDTEH-GFCCVEGCSA-N 1 2 312.417 4.120 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]C(c2ccccc2)c2ccccc2)s1 ZINC000338301059 341817404 /nfs/dbraw/zinc/81/74/04/341817404.db2.gz LOBQLCGLUQRXGL-CYBMUJFWSA-N 1 2 309.438 4.287 20 0 DIADLO CC[C@H]([NH2+]Cc1ccn(Cc2ccccc2)n1)c1ccccc1F ZINC000342810658 341839315 /nfs/dbraw/zinc/83/93/15/341839315.db2.gz RALLWGAEHUXJDD-FQEVSTJZSA-N 1 2 323.415 4.311 20 0 DIADLO COc1ccc([C@H](Cc2ccccc2)Nc2cccc[nH+]2)cc1 ZINC000576389527 341843719 /nfs/dbraw/zinc/84/37/19/341843719.db2.gz ABRSTGVBBWBOLV-IBGZPJMESA-N 1 2 304.393 4.486 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccccc2OCc2ccccc2)s1 ZINC000344458718 341864303 /nfs/dbraw/zinc/86/43/03/341864303.db2.gz GNPLUAORHCAWKA-UHFFFAOYSA-N 1 2 324.449 4.320 20 0 DIADLO C[C@@H](CC(=O)N1c2ccccc2[C@H](C)CC1(C)C)n1cc[nH+]c1 ZINC000580572227 341879196 /nfs/dbraw/zinc/87/91/96/341879196.db2.gz UUYPBEPYRGEQBH-CABCVRRESA-N 1 2 311.429 4.153 20 0 DIADLO C[C@@H]1C[C@H](Nc2nc3cc(Cl)cc(Cl)c3o2)c2[nH+]ccn21 ZINC000580619048 341887498 /nfs/dbraw/zinc/88/74/98/341887498.db2.gz HLKOCJMKTUVUON-HQJQHLMTSA-N 1 2 323.183 4.449 20 0 DIADLO C[C@H]1C[C@H](Nc2nc3cc(Cl)cc(Cl)c3o2)c2[nH+]ccn21 ZINC000580619044 341887528 /nfs/dbraw/zinc/88/75/28/341887528.db2.gz HLKOCJMKTUVUON-CPCISQLKSA-N 1 2 323.183 4.449 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)c2ccc(C(=O)C(C)C)cc2)c(C)[nH+]1 ZINC000577393483 341907726 /nfs/dbraw/zinc/90/77/26/341907726.db2.gz BIZGRWJVSNXCRA-AWEZNQCLSA-N 1 2 324.424 4.279 20 0 DIADLO CCO[C@@H](C)c1noc(C[NH2+][C@H](CC(C)C)c2ccccc2)n1 ZINC000177381502 341919259 /nfs/dbraw/zinc/91/92/59/341919259.db2.gz NUGDHQPKAUPQGL-GOEBONIOSA-N 1 2 317.433 4.044 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccc(F)cc1)c1cnccn1 ZINC000177765710 341937711 /nfs/dbraw/zinc/93/77/11/341937711.db2.gz FBIGIJILKAUAED-KUHUBIRLSA-N 1 2 307.372 4.056 20 0 DIADLO CC(C)(C)c1cnc(CNc2ccc(-n3cc[nH+]c3)cc2)s1 ZINC000447938175 517394304 /nfs/dbraw/zinc/39/43/04/517394304.db2.gz ZGDQWUCNPWUOEV-UHFFFAOYSA-N 1 2 312.442 4.238 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1csnn1)c1ccc(Cl)c(Cl)c1 ZINC000398313427 518178441 /nfs/dbraw/zinc/17/84/41/518178441.db2.gz CXBGXPWXFMYSNX-SFYZADRCSA-N 1 2 302.230 4.257 20 0 DIADLO C[C@@H](Nc1[nH+]ccc2ccc(F)cc21)[C@@H]1COc2ccccc21 ZINC000354883145 518178532 /nfs/dbraw/zinc/17/85/32/518178532.db2.gz JCDICBOXODZDSF-PXAZEXFGSA-N 1 2 308.356 4.351 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H]2CCOc3c(F)ccc(F)c32)oc1C ZINC000361186782 518187869 /nfs/dbraw/zinc/18/78/69/518187869.db2.gz MSTACOWUSNSFMT-IINYFYTJSA-N 1 2 307.340 4.349 20 0 DIADLO CC(C)(C)SCC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000264809397 518904564 /nfs/dbraw/zinc/90/45/64/518904564.db2.gz SFKGJDGUZZYKHF-UHFFFAOYSA-N 1 2 316.426 4.344 20 0 DIADLO CC(C)(C)c1csc(C[N@H+](Cc2cccnc2)C2CC2)n1 ZINC000124717813 519079922 /nfs/dbraw/zinc/07/99/22/519079922.db2.gz GDWOPMUKLCFDSO-UHFFFAOYSA-N 1 2 301.459 4.000 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+](Cc2cccnc2)C2CC2)n1 ZINC000124717813 519079932 /nfs/dbraw/zinc/07/99/32/519079932.db2.gz GDWOPMUKLCFDSO-UHFFFAOYSA-N 1 2 301.459 4.000 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@H]2CCOc3c(F)cccc32)cs1 ZINC000191123459 519101780 /nfs/dbraw/zinc/10/17/80/519101780.db2.gz VWTGCMIPKLEOSK-AWEZNQCLSA-N 1 2 320.433 4.193 20 0 DIADLO CC(C)N(C)c1ccc(CNc2cccc(-c3ncco3)c2)c[nH+]1 ZINC000191481009 519633452 /nfs/dbraw/zinc/63/34/52/519633452.db2.gz BMYADBNWIFNZJZ-UHFFFAOYSA-N 1 2 322.412 4.193 20 0 DIADLO CC(=O)Nc1ccc(Cl)c(Cn2c(C)[nH+]c3ccccc32)c1 ZINC000110418439 519718933 /nfs/dbraw/zinc/71/89/33/519718933.db2.gz USIDBALJVOEUEI-UHFFFAOYSA-N 1 2 313.788 4.005 20 0 DIADLO CC(=O)Nc1ccc([C@@H](C)Nc2ccc([NH+](C)C)c(C)c2)cc1 ZINC000182214653 519733677 /nfs/dbraw/zinc/73/36/77/519733677.db2.gz HBIJZVSKVPPKDX-CQSZACIVSA-N 1 2 311.429 4.193 20 0 DIADLO CC(=O)Nc1ccc([C@H](C)Nc2ccc([NH+](C)C)c(C)c2)cc1 ZINC000182214632 519733891 /nfs/dbraw/zinc/73/38/91/519733891.db2.gz HBIJZVSKVPPKDX-AWEZNQCLSA-N 1 2 311.429 4.193 20 0 DIADLO CC(C)Oc1cccc(CN(C)c2cc[nH+]c3ccncc32)c1 ZINC000339361447 519782791 /nfs/dbraw/zinc/78/27/91/519782791.db2.gz XHYUCNBTFKMJDO-UHFFFAOYSA-N 1 2 307.397 4.053 20 0 DIADLO CC(C)c1nc(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccnc2)cs1 ZINC000363811398 519863578 /nfs/dbraw/zinc/86/35/78/519863578.db2.gz DAFPQAVYVDJHHS-BBRMVZONSA-N 1 2 301.459 4.245 20 0 DIADLO CC(C)c1nc(C[N@H+]2C[C@@H](C)C[C@H]2c2cccnc2)cs1 ZINC000363811398 519863580 /nfs/dbraw/zinc/86/35/80/519863580.db2.gz DAFPQAVYVDJHHS-BBRMVZONSA-N 1 2 301.459 4.245 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2)o1 ZINC000267672052 519886635 /nfs/dbraw/zinc/88/66/35/519886635.db2.gz OUNNIKGUCLVGPK-OAHLLOKOSA-N 1 2 303.381 4.059 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2)o1 ZINC000267672052 519886636 /nfs/dbraw/zinc/88/66/36/519886636.db2.gz OUNNIKGUCLVGPK-OAHLLOKOSA-N 1 2 303.381 4.059 20 0 DIADLO CCOCCCn1c2ccccc2[nH+]c1NCc1ccsc1 ZINC000158979350 519901639 /nfs/dbraw/zinc/90/16/39/519901639.db2.gz TYQPXQNEXKCDEB-UHFFFAOYSA-N 1 2 315.442 4.137 20 0 DIADLO CCN(C(=O)Nc1ccc(C)[nH+]c1C)[C@H](C)c1cccc(O)c1 ZINC000176763266 519995704 /nfs/dbraw/zinc/99/57/04/519995704.db2.gz YYCGKVGQUAQNJR-CQSZACIVSA-N 1 2 313.401 4.019 20 0 DIADLO CC(C)n1ccnc1C[NH2+]C1(c2ccc(F)cc2F)CCCC1 ZINC000181252248 520029270 /nfs/dbraw/zinc/02/92/70/520029270.db2.gz DIAYURKINSVKDH-UHFFFAOYSA-N 1 2 319.399 4.301 20 0 DIADLO CC(C)n1cc[nH+]c1CNc1ccc(Cl)c(OC(F)F)c1 ZINC000182616859 520034481 /nfs/dbraw/zinc/03/44/81/520034481.db2.gz VLZHEMZEIKBQNB-UHFFFAOYSA-N 1 2 315.751 4.331 20 0 DIADLO CC(C)n1nccc1C[N@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000337138569 520097829 /nfs/dbraw/zinc/09/78/29/520097829.db2.gz QTJKQVOYLAKWHO-KBXCAEBGSA-N 1 2 313.445 4.345 20 0 DIADLO CC(C)n1nccc1C[N@@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000337138569 520097834 /nfs/dbraw/zinc/09/78/34/520097834.db2.gz QTJKQVOYLAKWHO-KBXCAEBGSA-N 1 2 313.445 4.345 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](Cc2ccco2)C(C)C)cs1 ZINC000336835970 520267961 /nfs/dbraw/zinc/26/79/61/520267961.db2.gz KUXVNTBTJAZQRR-ZDUSSCGKSA-N 1 2 308.447 4.244 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](Cc2ccco2)C(C)C)cs1 ZINC000336835970 520267971 /nfs/dbraw/zinc/26/79/71/520267971.db2.gz KUXVNTBTJAZQRR-ZDUSSCGKSA-N 1 2 308.447 4.244 20 0 DIADLO CCCCN(C(=O)c1cccc(Oc2cc[nH+]cc2)c1)C1CC1 ZINC000264835074 520361148 /nfs/dbraw/zinc/36/11/48/520361148.db2.gz BFBANROOHCKMKV-UHFFFAOYSA-N 1 2 310.397 4.279 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)[C@H]2C[C@@H]2c2ccccc2)cs1 ZINC000336854244 520475179 /nfs/dbraw/zinc/47/51/79/520475179.db2.gz DFWPNCRVOOWQJV-XYPHTWIQSA-N 1 2 316.470 4.229 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)[C@H]2C[C@@H]2c2ccccc2)cs1 ZINC000336854244 520475189 /nfs/dbraw/zinc/47/51/89/520475189.db2.gz DFWPNCRVOOWQJV-XYPHTWIQSA-N 1 2 316.470 4.229 20 0 DIADLO CCCCS[C@@H](C)C(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000366355893 520967604 /nfs/dbraw/zinc/96/76/04/520967604.db2.gz OAOHJESEDBIUQC-ZDUSSCGKSA-N 1 2 317.458 4.245 20 0 DIADLO CCCC[C@@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc(OC)cc1 ZINC000367743216 521103888 /nfs/dbraw/zinc/10/38/88/521103888.db2.gz ZBAUUWLMNCVTKL-QZTJIDSGSA-N 1 2 313.445 4.317 20 0 DIADLO CCCC[C@@H]1CCC[C@@H]1NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000247576487 521108451 /nfs/dbraw/zinc/10/84/51/521108451.db2.gz HWHXDGQKVHEMRC-PMPSAXMXSA-N 1 2 318.465 4.005 20 0 DIADLO CCOc1ccc([C@H](CC)[NH2+]C2(C(F)F)CC2)cc1OCC ZINC000337555947 521262197 /nfs/dbraw/zinc/26/21/97/521262197.db2.gz RGJCOYIPLBXZKP-ZDUSSCGKSA-N 1 2 313.388 4.322 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](C)c2cn(C(C)(C)C)nc2C)cs1 ZINC000157588779 521514146 /nfs/dbraw/zinc/51/41/46/521514146.db2.gz FAMPSGVMNGEZOE-LBPRGKRZSA-N 1 2 320.506 4.206 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)no1 ZINC000180020942 521516911 /nfs/dbraw/zinc/51/69/11/521516911.db2.gz NOZTUKKSKRZPQT-YLVFBTJISA-N 1 2 319.836 4.162 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](c2cccc(C)c2)C(C)(C)C)n1 ZINC000180787217 521586002 /nfs/dbraw/zinc/58/60/02/521586002.db2.gz FCKIUALSPZLFNM-KRWDZBQOSA-N 1 2 301.434 4.208 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)n1 ZINC000182565009 521586491 /nfs/dbraw/zinc/58/64/91/521586491.db2.gz SCPXUZJHGLVIJF-KRWDZBQOSA-N 1 2 319.836 4.307 20 0 DIADLO CCCn1c(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)nc2ccccc21 ZINC000127363984 521629145 /nfs/dbraw/zinc/62/91/45/521629145.db2.gz UOPKYPFHNOPYBX-QGZVFWFLSA-N 1 2 308.429 4.112 20 0 DIADLO CCCn1c(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)nc2ccccc21 ZINC000127363984 521629150 /nfs/dbraw/zinc/62/91/50/521629150.db2.gz UOPKYPFHNOPYBX-QGZVFWFLSA-N 1 2 308.429 4.112 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@H](C)c2ccccc2C)n1 ZINC000181534685 521729551 /nfs/dbraw/zinc/72/95/51/521729551.db2.gz SQIAVKBVQWDPFQ-CHWSQXEVSA-N 1 2 305.447 4.043 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)C[C@@H](c1ccccc1)C(F)(F)F ZINC000265183161 522079759 /nfs/dbraw/zinc/07/97/59/522079759.db2.gz HGHMASXUEGTAMB-AWEZNQCLSA-N 1 2 322.330 4.319 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)CCCc1c[nH]c2ccccc12 ZINC000265076325 522080341 /nfs/dbraw/zinc/08/03/41/522080341.db2.gz VYUBJKNODIPMLO-UHFFFAOYSA-N 1 2 307.397 4.087 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(OC)cc2F)cs1 ZINC000162285687 522421319 /nfs/dbraw/zinc/42/13/19/522421319.db2.gz PAWKDFGYWLLSFT-GHMZBOCLSA-N 1 2 308.422 4.265 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1nc(C)sc1C)CCC2 ZINC000336837837 522471490 /nfs/dbraw/zinc/47/14/90/522471490.db2.gz FUELTNICKXSREG-AWEZNQCLSA-N 1 2 321.515 4.288 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1nc(C)sc1C)CCC2 ZINC000336837837 522471496 /nfs/dbraw/zinc/47/14/96/522471496.db2.gz FUELTNICKXSREG-AWEZNQCLSA-N 1 2 321.515 4.288 20 0 DIADLO CC[C@H](Nc1ccc2oc(C(C)(C)C)nc2c1)c1[nH+]ccn1C ZINC000179881936 522769557 /nfs/dbraw/zinc/76/95/57/522769557.db2.gz TVLFGHGFVGNRFI-ZDUSSCGKSA-N 1 2 312.417 4.422 20 0 DIADLO CC[C@H](Nc1ccc(OC2CCC2)c(F)c1)c1[nH+]ccn1C ZINC000180020860 522769935 /nfs/dbraw/zinc/76/99/35/522769935.db2.gz PNLKIKFPIKLLEJ-HNNXBMFYSA-N 1 2 303.381 4.054 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)Cc1nccn1C(C)C ZINC000337331400 523008283 /nfs/dbraw/zinc/00/82/83/523008283.db2.gz VTXOLPXUMLFIFX-UHFFFAOYSA-N 1 2 311.429 4.405 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)Cc1nccn1C(C)C ZINC000337331400 523008288 /nfs/dbraw/zinc/00/82/88/523008288.db2.gz VTXOLPXUMLFIFX-UHFFFAOYSA-N 1 2 311.429 4.405 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cc(-c2cccs2)on1 ZINC000130187150 523120181 /nfs/dbraw/zinc/12/01/81/523120181.db2.gz UMPQJUVNHGXAJL-HNNXBMFYSA-N 1 2 313.426 4.381 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cc(-c2cccs2)on1 ZINC000130187150 523120194 /nfs/dbraw/zinc/12/01/94/523120194.db2.gz UMPQJUVNHGXAJL-HNNXBMFYSA-N 1 2 313.426 4.381 20 0 DIADLO C[N@H+](Cc1nc(C(C)(C)C)cs1)Cc1ccc(Cl)nc1 ZINC000267978197 523549075 /nfs/dbraw/zinc/54/90/75/523549075.db2.gz FFDVMTNQEXIZOR-UHFFFAOYSA-N 1 2 309.866 4.121 20 0 DIADLO C[N@@H+](Cc1nc(C(C)(C)C)cs1)Cc1ccc(Cl)nc1 ZINC000267978197 523549087 /nfs/dbraw/zinc/54/90/87/523549087.db2.gz FFDVMTNQEXIZOR-UHFFFAOYSA-N 1 2 309.866 4.121 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1ccccc1Cl ZINC000339154231 523558297 /nfs/dbraw/zinc/55/82/97/523558297.db2.gz UBWLJLPTDFPHNT-MRXNPFEDSA-N 1 2 303.837 4.284 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1ccccc1Cl ZINC000339154231 523558309 /nfs/dbraw/zinc/55/83/09/523558309.db2.gz UBWLJLPTDFPHNT-MRXNPFEDSA-N 1 2 303.837 4.284 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1sccc1Cl ZINC000339148216 523559110 /nfs/dbraw/zinc/55/91/10/523559110.db2.gz GOGKCCLXRKYJOB-CYBMUJFWSA-N 1 2 309.866 4.345 20 0 DIADLO CCc1ccc(C2=CC[N@@H+]([C@H](C)c3nnc(C)s3)CC2)cc1 ZINC000338278808 523903300 /nfs/dbraw/zinc/90/33/00/523903300.db2.gz HVQFYEYIFGBTHB-CYBMUJFWSA-N 1 2 313.470 4.259 20 0 DIADLO CCc1ccc(C2=CC[N@H+]([C@H](C)c3nnc(C)s3)CC2)cc1 ZINC000338278808 523903303 /nfs/dbraw/zinc/90/33/03/523903303.db2.gz HVQFYEYIFGBTHB-CYBMUJFWSA-N 1 2 313.470 4.259 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cs1 ZINC000336846168 523913267 /nfs/dbraw/zinc/91/32/67/523913267.db2.gz KKZIQFOAMCRNPV-MWLCHTKSSA-N 1 2 322.396 4.013 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cs1 ZINC000336846168 523913271 /nfs/dbraw/zinc/91/32/71/523913271.db2.gz KKZIQFOAMCRNPV-MWLCHTKSSA-N 1 2 322.396 4.013 20 0 DIADLO CC(=O)Nc1ccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)cc1 ZINC000286311611 534746739 /nfs/dbraw/zinc/74/67/39/534746739.db2.gz XLEUKSROZSSBQA-QGZVFWFLSA-N 1 2 312.417 4.102 20 0 DIADLO COc1ccc(C[N@H+](C)[C@H](C)c2ccco2)c(Cl)c1OC ZINC000131142212 524009265 /nfs/dbraw/zinc/00/92/65/524009265.db2.gz DOBAUBOTQZUVPY-LLVKDONJSA-N 1 2 309.793 4.143 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@H](C)c2ccco2)c(Cl)c1OC ZINC000131142212 524009270 /nfs/dbraw/zinc/00/92/70/524009270.db2.gz DOBAUBOTQZUVPY-LLVKDONJSA-N 1 2 309.793 4.143 20 0 DIADLO CCc1ccc([C@H]2CCCN2C(=O)Nc2ccc(C)[nH+]c2C)o1 ZINC000268035988 524054465 /nfs/dbraw/zinc/05/44/65/524054465.db2.gz QEYKCVFPLPPWLJ-MRXNPFEDSA-N 1 2 313.401 4.223 20 0 DIADLO CCc1cccc(C[NH2+][C@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000189970062 524070121 /nfs/dbraw/zinc/07/01/21/524070121.db2.gz HATHEBYXOQHXOA-OAHLLOKOSA-N 1 2 321.424 4.074 20 0 DIADLO C[C@H](CC1CC1)NC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000112738376 524094124 /nfs/dbraw/zinc/09/41/24/524094124.db2.gz HYXGEHRZLQUXGU-CYBMUJFWSA-N 1 2 311.385 4.184 20 0 DIADLO Cc1cc(C(=O)Nc2ccc3c(c2)[nH+]c(C(C)(C)C)n3C)co1 ZINC000188943684 524173330 /nfs/dbraw/zinc/17/33/30/524173330.db2.gz LEVWFOOCXRXNSP-UHFFFAOYSA-N 1 2 311.385 4.025 20 0 DIADLO Cc1cccc(C)c1OC[C@@H]([NH2+]Cc1ccon1)c1ccccc1 ZINC000181379760 524318618 /nfs/dbraw/zinc/31/86/18/524318618.db2.gz DJMOEZFMPPVLFN-LJQANCHMSA-N 1 2 322.408 4.201 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1nc2ccccc2o1 ZINC000182066688 524330311 /nfs/dbraw/zinc/33/03/11/524330311.db2.gz WBRYTOGAYATHIU-NEPJUHHUSA-N 1 2 314.360 4.387 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2csc(-c3ccc(C)o3)n2)o1 ZINC000338393449 524394917 /nfs/dbraw/zinc/39/49/17/524394917.db2.gz VBBQBFPXVJYMLQ-UHFFFAOYSA-N 1 2 302.399 4.245 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2csc(-c3ccc(C)o3)n2)o1 ZINC000338393449 524394920 /nfs/dbraw/zinc/39/49/20/524394920.db2.gz VBBQBFPXVJYMLQ-UHFFFAOYSA-N 1 2 302.399 4.245 20 0 DIADLO Cc1cc(C)cc([C@H](C)[NH2+]Cc2noc(-c3ccsc3)n2)c1 ZINC000182941424 524469564 /nfs/dbraw/zinc/46/95/64/524469564.db2.gz PZUIUGASQNEZGR-ZDUSSCGKSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nc(Cc3ccccc3)no2)cc1C ZINC000191596681 524606164 /nfs/dbraw/zinc/60/61/64/524606164.db2.gz ADLTYHPLHYDYAH-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+][C@H](C)c1noc(-c2ccccc2)n1 ZINC000124339420 524726644 /nfs/dbraw/zinc/72/66/44/524726644.db2.gz PCVKJQPYORBASL-ZIAGYGMSSA-N 1 2 323.396 4.157 20 0 DIADLO COc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nc(C)c(C)o1 ZINC000181714458 524730448 /nfs/dbraw/zinc/73/04/48/524730448.db2.gz ZLNKTVIVBIVUIA-MRXNPFEDSA-N 1 2 302.418 4.177 20 0 DIADLO COc1cc[nH+]cc1NC(=O)c1sccc1-c1ccccc1 ZINC000336931758 524868123 /nfs/dbraw/zinc/86/81/23/524868123.db2.gz QHJZKCNIWKNFAG-UHFFFAOYSA-N 1 2 310.378 4.071 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000105149240 525131613 /nfs/dbraw/zinc/13/16/13/525131613.db2.gz BOHODAOAIIJDGH-LBPRGKRZSA-N 1 2 310.422 4.031 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000105149240 525131622 /nfs/dbraw/zinc/13/16/22/525131622.db2.gz BOHODAOAIIJDGH-LBPRGKRZSA-N 1 2 310.422 4.031 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@H](c3ccccc3C)C2)c(C)[nH+]1 ZINC000268050002 525142333 /nfs/dbraw/zinc/14/23/33/525142333.db2.gz ZTLMWDJGOZUUIH-INIZCTEOSA-N 1 2 309.413 4.028 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@@H]2c2cccc(Cl)c2)cc[nH+]1 ZINC000119875668 525177351 /nfs/dbraw/zinc/17/73/51/525177351.db2.gz VOJVYMIOWKXASD-MRXNPFEDSA-N 1 2 315.804 4.412 20 0 DIADLO Cc1ccc(NC(=O)c2cc(C(C)C)n(C(C)(C)C)n2)c(C)[nH+]1 ZINC000119055707 525231713 /nfs/dbraw/zinc/23/17/13/525231713.db2.gz TULUOLSOOJPYCP-UHFFFAOYSA-N 1 2 314.433 4.026 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](CC(F)(F)F)c2ccccc2)nn1C ZINC000337532091 525472259 /nfs/dbraw/zinc/47/22/59/525472259.db2.gz VVRXOPKGZZVDKW-DOMZBBRYSA-N 1 2 311.351 4.073 20 0 DIADLO C[C@@H]1C[C@H]1[C@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000180027305 525500846 /nfs/dbraw/zinc/50/08/46/525500846.db2.gz HVAYRIJNDZYEIR-QSGSBWRWSA-N 1 2 317.820 4.087 20 0 DIADLO Cc1cccnc1C[NH2+][C@H](C)c1nc(-c2ccccc2)cs1 ZINC000154657570 525527647 /nfs/dbraw/zinc/52/76/47/525527647.db2.gz OFFOCRMTZNMIRX-CQSZACIVSA-N 1 2 309.438 4.364 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(C2CCCC2)n1)c1cccc(O)c1 ZINC000181516427 525555816 /nfs/dbraw/zinc/55/58/16/525555816.db2.gz ZBLPSGLMEVZDAA-GFCCVEGCSA-N 1 2 302.443 4.357 20 0 DIADLO C[C@@H]([NH2+]Cc1nccn1CC(F)(F)F)c1cc2ccccc2o1 ZINC000190640278 525564677 /nfs/dbraw/zinc/56/46/77/525564677.db2.gz AZGNRQMRJXCMDQ-LLVKDONJSA-N 1 2 323.318 4.042 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000105149237 525735555 /nfs/dbraw/zinc/73/55/55/525735555.db2.gz BOHODAOAIIJDGH-GFCCVEGCSA-N 1 2 310.422 4.031 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000105149237 525735560 /nfs/dbraw/zinc/73/55/60/525735560.db2.gz BOHODAOAIIJDGH-GFCCVEGCSA-N 1 2 310.422 4.031 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2ccc(Cl)s2)s1 ZINC000339177763 525751736 /nfs/dbraw/zinc/75/17/36/525751736.db2.gz FAUHQSORRRGQPZ-UHFFFAOYSA-N 1 2 304.893 4.011 20 0 DIADLO Cc1ccc(-c2cnc(C[NH2+][C@@H](C)c3ccncc3F)o2)cc1 ZINC000338341822 525773167 /nfs/dbraw/zinc/77/31/67/525773167.db2.gz LEGMSBSZZWSQBT-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1c([C@@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)cnn1C(C)C ZINC000191474070 525905379 /nfs/dbraw/zinc/90/53/79/525905379.db2.gz GYDYPEKOEWKUMR-CQSZACIVSA-N 1 2 312.461 4.328 20 0 DIADLO Cc1c([C@@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)cnn1C(C)C ZINC000191474070 525905388 /nfs/dbraw/zinc/90/53/88/525905388.db2.gz GYDYPEKOEWKUMR-CQSZACIVSA-N 1 2 312.461 4.328 20 0 DIADLO Cc1c([C@H](C)Nc2ccc([NH+](C)C)c(C)c2)cnn1C(C)C ZINC000191472396 525926983 /nfs/dbraw/zinc/92/69/83/525926983.db2.gz CVHIDWJNXBYPBQ-AWEZNQCLSA-N 1 2 300.450 4.320 20 0 DIADLO Cc1cc(-c2nnc(C[N@@H+]3Cc4ccccc4[C@@H]3C)o2)c(C)o1 ZINC000336869895 526060347 /nfs/dbraw/zinc/06/03/47/526060347.db2.gz FXBFGHXDBIGAIJ-LBPRGKRZSA-N 1 2 309.369 4.023 20 0 DIADLO Cc1cc(-c2nnc(C[N@H+]3Cc4ccccc4[C@@H]3C)o2)c(C)o1 ZINC000336869895 526060357 /nfs/dbraw/zinc/06/03/57/526060357.db2.gz FXBFGHXDBIGAIJ-LBPRGKRZSA-N 1 2 309.369 4.023 20 0 DIADLO C[C@@H](c1ccccc1Cl)[NH+]1CCC(C(=O)C(F)(F)F)CC1 ZINC000186006516 526102285 /nfs/dbraw/zinc/10/22/85/526102285.db2.gz AHBJEUNJKVHJLZ-JTQLQIEISA-N 1 2 319.754 4.244 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1nnc(-c2cccc(Cl)c2)o1 ZINC000106860189 526147376 /nfs/dbraw/zinc/14/73/76/526147376.db2.gz KCUCECKCFKAUQG-LLVKDONJSA-N 1 2 317.776 4.176 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1nnc(-c2cccc(Cl)c2)o1 ZINC000106860189 526147384 /nfs/dbraw/zinc/14/73/84/526147384.db2.gz KCUCECKCFKAUQG-LLVKDONJSA-N 1 2 317.776 4.176 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cnc(-c3ccsc3)s2)o1 ZINC000337211246 526157807 /nfs/dbraw/zinc/15/78/07/526157807.db2.gz AHFDDJPTOVYJKW-JTQLQIEISA-N 1 2 305.428 4.019 20 0 DIADLO C[C@H](C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)c1ccccn1 ZINC000339275135 526158226 /nfs/dbraw/zinc/15/82/26/526158226.db2.gz VFMDHCVDGMXGFI-AWEZNQCLSA-N 1 2 319.364 4.011 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2cccc(O)c2Cl)C2CC2)s1 ZINC000339281723 526165511 /nfs/dbraw/zinc/16/55/11/526165511.db2.gz JAYMVETZOIQRAO-CQSZACIVSA-N 1 2 308.834 4.051 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+](C)Cc1cc(Cl)cn1C ZINC000181145894 526174108 /nfs/dbraw/zinc/17/41/08/526174108.db2.gz YMFOVCOMJNVYNU-NSHDSACASA-N 1 2 303.793 4.013 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+](C)Cc1cc(Cl)cn1C ZINC000181145894 526174123 /nfs/dbraw/zinc/17/41/23/526174123.db2.gz YMFOVCOMJNVYNU-NSHDSACASA-N 1 2 303.793 4.013 20 0 DIADLO Cc1ccc(C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)o1 ZINC000355390398 526226760 /nfs/dbraw/zinc/22/67/60/526226760.db2.gz KJDGBVQKQJATMK-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO Cc1nnc(C[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)s1 ZINC000365670313 526336759 /nfs/dbraw/zinc/33/67/59/526336759.db2.gz ROYQDUPEOLHLMC-AWEZNQCLSA-N 1 2 307.850 4.227 20 0 DIADLO Cc1nnc(C[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)s1 ZINC000365670313 526336760 /nfs/dbraw/zinc/33/67/60/526336760.db2.gz ROYQDUPEOLHLMC-AWEZNQCLSA-N 1 2 307.850 4.227 20 0 DIADLO Oc1cccc(C[NH2+][C@H]2CCCOc3ccc(F)cc32)c1Cl ZINC000339205948 526360340 /nfs/dbraw/zinc/36/03/40/526360340.db2.gz NGAAZAHTQZEMSD-AWEZNQCLSA-N 1 2 321.779 4.188 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+][C@H](c1ncc[nH]1)c1ccccc1)CCC2 ZINC000127801110 526374752 /nfs/dbraw/zinc/37/47/52/526374752.db2.gz AOVUCWLLNFIMBN-MOPGFXCFSA-N 1 2 321.399 4.305 20 0 DIADLO Fc1ccc2cc[nH+]c(N[C@@H]3CCCC34CCOCC4)c2c1 ZINC000336932071 526377321 /nfs/dbraw/zinc/37/73/21/526377321.db2.gz QOUFMOCUIUDFJZ-MRXNPFEDSA-N 1 2 300.377 4.135 20 0 DIADLO Fc1ccc2cc[nH+]c(N[C@H]3CCCC[C@@H]3OC(F)F)c2c1 ZINC000336904663 526377510 /nfs/dbraw/zinc/37/75/10/526377510.db2.gz SNSVEIXUUNFJOK-KBPBESRZSA-N 1 2 310.319 4.336 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)o1 ZINC000180020992 526405064 /nfs/dbraw/zinc/40/50/64/526405064.db2.gz CSXABLUCWCKPEQ-MISXLKTNSA-N 1 2 305.809 4.079 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)o1 ZINC000180021024 526406270 /nfs/dbraw/zinc/40/62/70/526406270.db2.gz CSXABLUCWCKPEQ-NBLIUIFLSA-N 1 2 305.809 4.079 20 0 DIADLO c1c[nH+]c([C@@H](Nc2ccc(OCC3CC3)cc2)c2ccccc2)[nH]1 ZINC000188343458 526407188 /nfs/dbraw/zinc/40/71/88/526407188.db2.gz ACELTOBBSJGTLX-IBGZPJMESA-N 1 2 319.408 4.400 20 0 DIADLO c1c[nH+]c([C@H](Nc2ccc(OCC3CC3)cc2)c2ccccc2)[nH]1 ZINC000188343484 526409500 /nfs/dbraw/zinc/40/95/00/526409500.db2.gz ACELTOBBSJGTLX-LJQANCHMSA-N 1 2 319.408 4.400 20 0 DIADLO c1ccc([C@@H](CC2CCCC2)[NH2+]Cc2noc(C3CC3)n2)cc1 ZINC000181939798 526489392 /nfs/dbraw/zinc/48/93/92/526489392.db2.gz AGMUIZSLLHXTKA-QGZVFWFLSA-N 1 2 311.429 4.358 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@H](c1cccc(C(F)(F)F)c1)C(C)C ZINC000236785179 526556594 /nfs/dbraw/zinc/55/65/94/526556594.db2.gz SYQSPADITGTFMN-HNNXBMFYSA-N 1 2 311.351 4.224 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@H](CCc1ccccc1)c1ccccc1 ZINC000237556715 526556808 /nfs/dbraw/zinc/55/68/08/526556808.db2.gz SYJBBSMKWVBZIX-HXUWFJFHSA-N 1 2 305.425 4.182 20 0 DIADLO Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]Cc1cocn1 ZINC000182065192 526568256 /nfs/dbraw/zinc/56/82/56/526568256.db2.gz OSFVCVQWMLKNJP-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO c1sc(C[NH2+][C@H](c2ccccc2)c2ccccn2)nc1C1CC1 ZINC000180951791 526632463 /nfs/dbraw/zinc/63/24/63/526632463.db2.gz YEWOCDIVDFYVTM-LJQANCHMSA-N 1 2 321.449 4.295 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)s1 ZINC000173867181 526724801 /nfs/dbraw/zinc/72/48/01/526724801.db2.gz OXUKYCCGQCDXEL-NSHDSACASA-N 1 2 320.462 4.041 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[NH2+][C@H](C)c1ccncc1F ZINC000338364290 526740698 /nfs/dbraw/zinc/74/06/98/526740698.db2.gz DXGFJZIRNCDDSB-GFCCVEGCSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[NH2+][C@@H](C)c1ccncc1F ZINC000338359971 526750355 /nfs/dbraw/zinc/75/03/55/526750355.db2.gz VBUZYUJFCSWJEJ-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@H]2CCCc3nc(C)sc32)c(C)s1 ZINC000336820259 526845514 /nfs/dbraw/zinc/84/55/14/526845514.db2.gz CHLIMSOQNLICGK-AWEZNQCLSA-N 1 2 307.488 4.034 20 0 DIADLO Cc1nc(C[N@H+](C)[C@H]2CCCc3nc(C)sc32)c(C)s1 ZINC000336820259 526845522 /nfs/dbraw/zinc/84/55/22/526845522.db2.gz CHLIMSOQNLICGK-AWEZNQCLSA-N 1 2 307.488 4.034 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(F)cc3F)CCCC2)oc1C ZINC000181255613 526886853 /nfs/dbraw/zinc/88/68/53/526886853.db2.gz ZDRDBYGYNCNHSU-UHFFFAOYSA-N 1 2 306.356 4.129 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2cccc(Cl)c2)C2CCCC2)no1 ZINC000181038903 526891473 /nfs/dbraw/zinc/89/14/73/526891473.db2.gz QFHHFURNIADIIE-MRXNPFEDSA-N 1 2 305.809 4.053 20 0 DIADLO Cc1nnc([C@@H]2CCCC[N@@H+]2Cc2ccc(C3CCC3)cc2)[nH]1 ZINC000338329452 527041443 /nfs/dbraw/zinc/04/14/43/527041443.db2.gz UIIYMUURTCPBBJ-SFHVURJKSA-N 1 2 310.445 4.108 20 0 DIADLO Cc1nnc([C@@H]2CCCC[N@H+]2Cc2ccc(C3CCC3)cc2)[nH]1 ZINC000338329452 527041448 /nfs/dbraw/zinc/04/14/48/527041448.db2.gz UIIYMUURTCPBBJ-SFHVURJKSA-N 1 2 310.445 4.108 20 0 DIADLO CCCC[C@H](CC)C(=O)N1CCCC[C@H]1c1[nH+]ccn1CC ZINC000366642720 534981724 /nfs/dbraw/zinc/98/17/24/534981724.db2.gz FKJZZULDNBGQTA-HOTGVXAUSA-N 1 2 305.466 4.173 20 0 DIADLO CC(C)[N@H+](Cc1nccn1C(F)F)Cc1cccc(Cl)c1 ZINC000298578018 535121801 /nfs/dbraw/zinc/12/18/01/535121801.db2.gz JTXRJFZXCFMGST-UHFFFAOYSA-N 1 2 313.779 4.342 20 0 DIADLO CC(C)[N@@H+](Cc1nccn1C(F)F)Cc1cccc(Cl)c1 ZINC000298578018 535121805 /nfs/dbraw/zinc/12/18/05/535121805.db2.gz JTXRJFZXCFMGST-UHFFFAOYSA-N 1 2 313.779 4.342 20 0 DIADLO CC(C)c1c(N[C@H]2C[C@@H](C)n3cc[nH+]c32)cnn1-c1ccccc1 ZINC000296398716 535332459 /nfs/dbraw/zinc/33/24/59/535332459.db2.gz KGLRQOXSRSRFKL-ZBFHGGJFSA-N 1 2 321.428 4.310 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(Cl)ccc1Cl)c1nc(C)cs1 ZINC000274303957 535922156 /nfs/dbraw/zinc/92/21/56/535922156.db2.gz KOQDNRQQLVTDGK-JTQLQIEISA-N 1 2 316.257 4.394 20 0 DIADLO CCn1ccnc1C[NH2+][C@H](c1ccc(Cl)cc1F)C(C)C ZINC000272751027 536111445 /nfs/dbraw/zinc/11/14/45/536111445.db2.gz NMARRWJVRKIESA-INIZCTEOSA-N 1 2 309.816 4.182 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)Nc1ccc(NC(=O)CC(C)C)cc1 ZINC000296913326 536124975 /nfs/dbraw/zinc/12/49/75/536124975.db2.gz PJVGOPMYRZHWOK-AWEZNQCLSA-N 1 2 314.433 4.061 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(Br)o1 ZINC001138901930 1046322821 /nfs/dbraw/zinc/32/28/21/1046322821.db2.gz NBWNVOFQEITHAO-NSHDSACASA-N 1 2 306.203 4.161 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc(Br)o1 ZINC001138901930 1046322844 /nfs/dbraw/zinc/32/28/44/1046322844.db2.gz NBWNVOFQEITHAO-NSHDSACASA-N 1 2 306.203 4.161 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2Cl)[C@@H](C)C1 ZINC001232704225 1054105513 /nfs/dbraw/zinc/10/55/13/1054105513.db2.gz WGSKVHKTGJTGBF-ONGXEEELSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2Cl)[C@@H](C)C1 ZINC001232704225 1054105519 /nfs/dbraw/zinc/10/55/19/1054105519.db2.gz WGSKVHKTGJTGBF-ONGXEEELSA-N 1 2 306.208 4.132 20 0 DIADLO Clc1cscc1C[NH2+][C@H]1COc2c1cccc2Cl ZINC000676419517 1057472046 /nfs/dbraw/zinc/47/20/46/1057472046.db2.gz OLVGBJSQDSRDDN-LBPRGKRZSA-N 1 2 300.210 4.278 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccccc2C(F)(F)F)no1 ZINC000044590537 1035511074 /nfs/dbraw/zinc/51/10/74/1035511074.db2.gz WBHQXSOKSIIHKX-OAHLLOKOSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccccc2C(F)(F)F)no1 ZINC000044590537 1035511082 /nfs/dbraw/zinc/51/10/82/1035511082.db2.gz WBHQXSOKSIIHKX-OAHLLOKOSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1conc1C[NH+]1CCC(Oc2ccc(C(C)C)cc2)CC1 ZINC001167048032 1035535813 /nfs/dbraw/zinc/53/58/13/1035535813.db2.gz FEXXXHMIKSJFJN-UHFFFAOYSA-N 1 2 314.429 4.150 20 0 DIADLO CC(C)(C)C1CCC(Nc2ccc(Cn3cc[nH+]c3)cn2)CC1 ZINC000579776313 1035583698 /nfs/dbraw/zinc/58/36/98/1035583698.db2.gz HGZUWKBDKUIUNG-UHFFFAOYSA-N 1 2 312.461 4.343 20 0 DIADLO Cc1ccc2cc([C@@H](C)[NH2+]Cc3csc(N(C)C)n3)oc2c1 ZINC000683159783 1035630083 /nfs/dbraw/zinc/63/00/83/1035630083.db2.gz HMJYXKDHXOJJHN-GFCCVEGCSA-N 1 2 315.442 4.115 20 0 DIADLO Cc1ccsc1C[N@@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000044996268 1035638614 /nfs/dbraw/zinc/63/86/14/1035638614.db2.gz ZAHNZWCYCVKLNN-UHFFFAOYSA-N 1 2 321.396 4.433 20 0 DIADLO Cc1ccsc1C[N@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000044996268 1035638625 /nfs/dbraw/zinc/63/86/25/1035638625.db2.gz ZAHNZWCYCVKLNN-UHFFFAOYSA-N 1 2 321.396 4.433 20 0 DIADLO Fc1cccc(-n2ccc(C[N@H+](Cc3ccccc3)C3CC3)n2)c1 ZINC000064556192 1035697663 /nfs/dbraw/zinc/69/76/63/1035697663.db2.gz QZLVZARIZOQPQQ-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO Fc1cccc(-n2ccc(C[N@@H+](Cc3ccccc3)C3CC3)n2)c1 ZINC000064556192 1035697675 /nfs/dbraw/zinc/69/76/75/1035697675.db2.gz QZLVZARIZOQPQQ-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO Fc1cccc(CC[N@@H+]2Cc3ccc(Br)cc3C2)c1 ZINC001208196413 1035724547 /nfs/dbraw/zinc/72/45/47/1035724547.db2.gz QCMNXCUTEQVRDA-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO Fc1cccc(CC[N@H+]2Cc3ccc(Br)cc3C2)c1 ZINC001208196413 1035724559 /nfs/dbraw/zinc/72/45/59/1035724559.db2.gz QCMNXCUTEQVRDA-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO Cc1cc(C)c(NC(=O)C[N@@H+](C)Cc2cccs2)c(Cl)c1 ZINC000007845792 1035737301 /nfs/dbraw/zinc/73/73/01/1035737301.db2.gz GIWUIIJMCGKKGO-UHFFFAOYSA-N 1 2 322.861 4.089 20 0 DIADLO Cc1cc(C)c(NC(=O)C[N@H+](C)Cc2cccs2)c(Cl)c1 ZINC000007845792 1035737318 /nfs/dbraw/zinc/73/73/18/1035737318.db2.gz GIWUIIJMCGKKGO-UHFFFAOYSA-N 1 2 322.861 4.089 20 0 DIADLO Cc1nc2ccc(C[N@@H+]3CCC=C(Br)C3)cc2s1 ZINC000799735691 1035778830 /nfs/dbraw/zinc/77/88/30/1035778830.db2.gz GCXMAAWQXYHTIW-UHFFFAOYSA-N 1 2 323.259 4.089 20 0 DIADLO Cc1nc2ccc(C[N@H+]3CCC=C(Br)C3)cc2s1 ZINC000799735691 1035778849 /nfs/dbraw/zinc/77/88/49/1035778849.db2.gz GCXMAAWQXYHTIW-UHFFFAOYSA-N 1 2 323.259 4.089 20 0 DIADLO Cc1ccncc1C[N@@H+](C)[C@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660711272 1035790778 /nfs/dbraw/zinc/79/07/78/1035790778.db2.gz VUSDFOILLGNILH-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1ccncc1C[N@H+](C)[C@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660711272 1035790793 /nfs/dbraw/zinc/79/07/93/1035790793.db2.gz VUSDFOILLGNILH-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO CCn1ccnc1C[N@@H+]1CCc2ccccc2[C@H]1c1ccccc1 ZINC000339608076 1035809461 /nfs/dbraw/zinc/80/94/61/1035809461.db2.gz ROLMQKDXDRJWNX-OAQYLSRUSA-N 1 2 317.436 4.051 20 0 DIADLO CCn1ccnc1C[N@H+]1CCc2ccccc2[C@H]1c1ccccc1 ZINC000339608076 1035809475 /nfs/dbraw/zinc/80/94/75/1035809475.db2.gz ROLMQKDXDRJWNX-OAQYLSRUSA-N 1 2 317.436 4.051 20 0 DIADLO C[C@H]([NH2+]Cc1nccn1C(F)F)c1ccc(Cl)cc1Cl ZINC000036804911 1035839935 /nfs/dbraw/zinc/83/99/35/1035839935.db2.gz FKTATMAPNZKEJQ-QMMMGPOBSA-N 1 2 320.170 4.436 20 0 DIADLO CC[C@@H]1CCC[C@@]1(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001125301514 1035845993 /nfs/dbraw/zinc/84/59/93/1035845993.db2.gz UJYPEYSXRBUVQO-FZKQIMNGSA-N 1 2 315.392 4.166 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccco2)no1)c1ccc2c(c1)CCCC2 ZINC000154326157 1035866754 /nfs/dbraw/zinc/86/67/54/1035866754.db2.gz MNCUNUZREDDXMG-CYBMUJFWSA-N 1 2 323.396 4.059 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H](C)c1nnc(C)o1 ZINC000154428096 1035893175 /nfs/dbraw/zinc/89/31/75/1035893175.db2.gz DNWYYLZFMLJJSF-VIFPVBQESA-N 1 2 314.216 4.268 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H](C)c1nnc(C)o1 ZINC000154428096 1035893192 /nfs/dbraw/zinc/89/31/92/1035893192.db2.gz DNWYYLZFMLJJSF-VIFPVBQESA-N 1 2 314.216 4.268 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1nnc2n1CCCCC2)c1ccc(Cl)s1 ZINC000037140686 1035951292 /nfs/dbraw/zinc/95/12/92/1035951292.db2.gz CHZQBOARMQPVET-QWRGUYRKSA-N 1 2 324.881 4.131 20 0 DIADLO FC1(F)CCC[C@@H](C[N@@H+]2Cc3cnn(-c4ccccc4)c3C2)C1 ZINC000339808759 1035969244 /nfs/dbraw/zinc/96/92/44/1035969244.db2.gz NAAZYKJUWMDWJQ-CQSZACIVSA-N 1 2 317.383 4.013 20 0 DIADLO FC1(F)CCC[C@@H](C[N@H+]2Cc3cnn(-c4ccccc4)c3C2)C1 ZINC000339808759 1035969253 /nfs/dbraw/zinc/96/92/53/1035969253.db2.gz NAAZYKJUWMDWJQ-CQSZACIVSA-N 1 2 317.383 4.013 20 0 DIADLO Cc1ccc(NC2CCN(c3cccc[nH+]3)CC2)c(Cl)c1 ZINC000037245010 1035984531 /nfs/dbraw/zinc/98/45/31/1035984531.db2.gz UJFZJLSMHOLSSM-UHFFFAOYSA-N 1 2 301.821 4.124 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H]1C[C@@H]1C1CCCC1 ZINC000651955910 1036002893 /nfs/dbraw/zinc/00/28/93/1036002893.db2.gz FLRSXGGFGDQPQR-CVEARBPZSA-N 1 2 309.413 4.150 20 0 DIADLO CCCCOc1ncccc1C[NH2+][C@H](C)c1cccnc1Cl ZINC000154747567 1036007927 /nfs/dbraw/zinc/00/79/27/1036007927.db2.gz JMXVVNRZBWXYRO-CYBMUJFWSA-N 1 2 319.836 4.160 20 0 DIADLO CC[C@H]([NH2+]Cc1ncccc1Cl)c1cc(F)ccc1OC ZINC000932472999 1036082983 /nfs/dbraw/zinc/08/29/83/1036082983.db2.gz SXBBGQJAQFEVOJ-AWEZNQCLSA-N 1 2 308.784 4.124 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1csc(-c2ccccn2)n1 ZINC000124294150 1036090677 /nfs/dbraw/zinc/09/06/77/1036090677.db2.gz XEMSMNYWYSUCAH-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1csc(-c2ccccn2)n1 ZINC000124294150 1036090698 /nfs/dbraw/zinc/09/06/98/1036090698.db2.gz XEMSMNYWYSUCAH-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO CCCCc1noc(C[NH2+]C(C)(C)c2cccc(Cl)c2)n1 ZINC000179598229 1036093127 /nfs/dbraw/zinc/09/31/27/1036093127.db2.gz VMANBWXKMZLFLU-UHFFFAOYSA-N 1 2 307.825 4.091 20 0 DIADLO CC[C@H](c1ccccc1)N(C)c1[nH+]cc(C)cc1/C=C/C(=O)OC ZINC001167127696 1036143467 /nfs/dbraw/zinc/14/34/67/1036143467.db2.gz IGHCVROFBROXDM-IENJSVCTSA-N 1 2 324.424 4.164 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@H]2COc3ccc(Cl)cc32)o1 ZINC000538426026 1036238972 /nfs/dbraw/zinc/23/89/72/1036238972.db2.gz UJSWTWPVTBTRGF-YVLXSGLVSA-N 1 2 303.789 4.280 20 0 DIADLO CC(C)Oc1ccc(Nc2ccc[nH+]c2N2CCCC2)c(F)c1 ZINC001209832316 1036268176 /nfs/dbraw/zinc/26/81/76/1036268176.db2.gz GBXVTYAWWXYPQL-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCn2ccnc21)c1ccc(Cl)cc1Cl ZINC000655693281 1036482807 /nfs/dbraw/zinc/48/28/07/1036482807.db2.gz WIRFCBSYFLKLHN-YGRLFVJLSA-N 1 2 310.228 4.376 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(NCC2(c3ccccc3)COC2)c1 ZINC001167297767 1036532617 /nfs/dbraw/zinc/53/26/17/1036532617.db2.gz PDNLEXSWTVGPND-UHFFFAOYSA-N 1 2 324.468 4.221 20 0 DIADLO Cc1[nH+]cc(Nc2ccccc2NC(=O)OC(C)(C)C)cc1N ZINC001210289909 1036595374 /nfs/dbraw/zinc/59/53/74/1036595374.db2.gz ATQUJRRBADKIBL-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO COc1cccc([C@H](C)[NH2+][C@@H](C)c2nnc(-c3ccccc3)o2)c1 ZINC000340431630 1036600780 /nfs/dbraw/zinc/60/07/80/1036600780.db2.gz VATXHPRZGHLERQ-KBPBESRZSA-N 1 2 323.396 4.157 20 0 DIADLO FC(F)Oc1ccc(Nc2[nH+]cccc2N2CCCCC2)cc1 ZINC001210326132 1036622619 /nfs/dbraw/zinc/62/26/19/1036622619.db2.gz VSNSKGWHHKAVNS-UHFFFAOYSA-N 1 2 319.355 4.417 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)n1 ZINC000063482597 1036634254 /nfs/dbraw/zinc/63/42/54/1036634254.db2.gz RXCWCNDVQSIRLM-LBPRGKRZSA-N 1 2 307.825 4.162 20 0 DIADLO c1c[nH]c([C@@H]([NH2+]Cc2coc3ccccc23)c2ccccc2)n1 ZINC000340445591 1036635906 /nfs/dbraw/zinc/63/59/06/1036635906.db2.gz FPFXRWKOINCCJO-SFHVURJKSA-N 1 2 303.365 4.035 20 0 DIADLO CC[C@@H]1C[C@@H](C[NH2+]c2ccc(N3CCCCC3)cc2)CCO1 ZINC001648856029 1036648382 /nfs/dbraw/zinc/64/83/82/1036648382.db2.gz QNPNWOJCISGICH-QFBILLFUSA-N 1 2 302.462 4.294 20 0 DIADLO Fc1cccc(F)c1C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC001167318827 1036686852 /nfs/dbraw/zinc/68/68/52/1036686852.db2.gz VNWQYWXKVYXNPD-INIZCTEOSA-N 1 2 317.335 4.031 20 0 DIADLO Fc1cccc(F)c1C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC001167318827 1036686859 /nfs/dbraw/zinc/68/68/59/1036686859.db2.gz VNWQYWXKVYXNPD-INIZCTEOSA-N 1 2 317.335 4.031 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2cc3ccccc3o2)cs1)c1cn[nH]c1 ZINC000340502455 1036765234 /nfs/dbraw/zinc/76/52/34/1036765234.db2.gz KHPKCIHNPLTKPE-NSHDSACASA-N 1 2 324.409 4.130 20 0 DIADLO C[C@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)c1nccs1 ZINC000080266778 1036773974 /nfs/dbraw/zinc/77/39/74/1036773974.db2.gz GTDPLLXSUMUYJI-CMPLNLGQSA-N 1 2 300.349 4.487 20 0 DIADLO CC[C@H](C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000047514661 1036780830 /nfs/dbraw/zinc/78/08/30/1036780830.db2.gz OHKKYOLNJUGESP-SFHVURJKSA-N 1 2 305.381 4.005 20 0 DIADLO c1nc(C2CC2)c(CNc2[nH+]c3ccccc3n2C2CC2)s1 ZINC000683750918 1036823454 /nfs/dbraw/zinc/82/34/54/1036823454.db2.gz RRERNYYTGFNXKG-UHFFFAOYSA-N 1 2 310.426 4.317 20 0 DIADLO Cn1ccnc1[C@@H]([NH2+]Cc1cc(Cl)cs1)c1ccccc1 ZINC000683765176 1036859973 /nfs/dbraw/zinc/85/99/73/1036859973.db2.gz CUIYVVVKXDHAJQ-HNNXBMFYSA-N 1 2 317.845 4.014 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H]2CCc3c2cccc3Cl)c(C)[nH+]1 ZINC001125416928 1036933240 /nfs/dbraw/zinc/93/32/40/1036933240.db2.gz IEAGLGROJYSLEK-INIZCTEOSA-N 1 2 314.816 4.078 20 0 DIADLO CO[C@H](c1ccccc1)[C@@H](C)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000683816069 1036962314 /nfs/dbraw/zinc/96/23/14/1036962314.db2.gz IZGOLCZGGFYTCV-BEFAXECRSA-N 1 2 307.397 4.060 20 0 DIADLO Cc1ncc([C@H](C)[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)s1 ZINC000683822084 1036971673 /nfs/dbraw/zinc/97/16/73/1036971673.db2.gz KRIRYJNFASSVAJ-NKWVEPMBSA-N 1 2 321.393 4.339 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)s1 ZINC000683822087 1036971892 /nfs/dbraw/zinc/97/18/92/1036971892.db2.gz KRIRYJNFASSVAJ-RQJHMYQMSA-N 1 2 321.393 4.339 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cnc(-c3ccco3)s2)C2CC2)o1 ZINC000683825650 1036977349 /nfs/dbraw/zinc/97/73/49/1036977349.db2.gz ODFDKWOARFDBPU-UHFFFAOYSA-N 1 2 314.410 4.469 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cnc(-c3ccco3)s2)C2CC2)o1 ZINC000683825650 1036977360 /nfs/dbraw/zinc/97/73/60/1036977360.db2.gz ODFDKWOARFDBPU-UHFFFAOYSA-N 1 2 314.410 4.469 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)c(F)c(F)c2)cn1 ZINC001204529658 1037012968 /nfs/dbraw/zinc/01/29/68/1037012968.db2.gz LFZRLEBBKOGUKO-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)c(F)c(F)c2)cn1 ZINC001204529658 1037012985 /nfs/dbraw/zinc/01/29/85/1037012985.db2.gz LFZRLEBBKOGUKO-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Nc1c(F)cc(Nc2ccc([NH+]3CCCCC3)cc2)cc1F ZINC001210909179 1037039682 /nfs/dbraw/zinc/03/96/82/1037039682.db2.gz FERRNDRMZMZQQK-UHFFFAOYSA-N 1 2 303.356 4.281 20 0 DIADLO CC[C@@H]1CCC[N@@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)CC1 ZINC001167382121 1037067500 /nfs/dbraw/zinc/06/75/00/1037067500.db2.gz VJBIDPQDKCHITD-CJNGLKHVSA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@@H]1CCC[N@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)CC1 ZINC001167382121 1037067522 /nfs/dbraw/zinc/06/75/22/1037067522.db2.gz VJBIDPQDKCHITD-CJNGLKHVSA-N 1 2 309.837 4.066 20 0 DIADLO Cc1nc(C)c(C[N@@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC000683896983 1037076068 /nfs/dbraw/zinc/07/60/68/1037076068.db2.gz GXRHIWFTXQRLRH-ZBEGNZNMSA-N 1 2 300.402 4.172 20 0 DIADLO Cc1nc(C)c(C[N@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC000683896983 1037076088 /nfs/dbraw/zinc/07/60/88/1037076088.db2.gz GXRHIWFTXQRLRH-ZBEGNZNMSA-N 1 2 300.402 4.172 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@H](CC(F)(F)F)c2ccc(F)cc2)o1 ZINC000683900344 1037077189 /nfs/dbraw/zinc/07/71/89/1037077189.db2.gz UBUJOZDJAYDEAB-CYBMUJFWSA-N 1 2 316.298 4.214 20 0 DIADLO C=C(Nc1cc(Br)c2[nH+]ccn2c1)c1ccccc1 ZINC001210983704 1037082206 /nfs/dbraw/zinc/08/22/06/1037082206.db2.gz RYIFLOUYIHYCRN-UHFFFAOYSA-N 1 2 314.186 4.180 20 0 DIADLO c1c2ccccc2[nH]c1CNc1ccc(N2CCCCC2)[nH+]c1 ZINC000683922813 1037102477 /nfs/dbraw/zinc/10/24/77/1037102477.db2.gz MMPBOEZEBPCFOZ-UHFFFAOYSA-N 1 2 306.413 4.165 20 0 DIADLO CCCCn1c(SCCC(C)C)nnc1[C@@H](CC)[NH+](C)C ZINC000078353737 1037133040 /nfs/dbraw/zinc/13/30/40/1037133040.db2.gz HXFQCROKYMCNCD-CQSZACIVSA-N 1 2 312.527 4.229 20 0 DIADLO CCn1c[nH+]cc1CNc1cc(Cl)c(Cl)c(Cl)c1 ZINC000404358908 1037144372 /nfs/dbraw/zinc/14/43/72/1037144372.db2.gz OTBUXGODQKILHM-UHFFFAOYSA-N 1 2 304.608 4.475 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@@]23CCCC[C@@H]2C3(F)F)c(C)[nH+]1 ZINC000622776307 1037195005 /nfs/dbraw/zinc/19/50/05/1037195005.db2.gz AIXRRCYSKUMSJY-BBRMVZONSA-N 1 2 308.372 4.161 20 0 DIADLO CC[N@H+](Cc1nnc(-c2ccco2)o1)Cc1cccc(Cl)c1 ZINC000047958401 1037212748 /nfs/dbraw/zinc/21/27/48/1037212748.db2.gz JYSNMYSPVGKIJM-UHFFFAOYSA-N 1 2 317.776 4.005 20 0 DIADLO CC[N@@H+](Cc1nnc(-c2ccco2)o1)Cc1cccc(Cl)c1 ZINC000047958401 1037212763 /nfs/dbraw/zinc/21/27/63/1037212763.db2.gz JYSNMYSPVGKIJM-UHFFFAOYSA-N 1 2 317.776 4.005 20 0 DIADLO c1c2ccccc2[nH]c1C[N@@H+]1CCO[C@H](CCc2ccccc2)C1 ZINC000684026241 1037254723 /nfs/dbraw/zinc/25/47/23/1037254723.db2.gz ZKZPKWMRPHUNKP-HXUWFJFHSA-N 1 2 320.436 4.002 20 0 DIADLO c1c2ccccc2[nH]c1C[N@H+]1CCO[C@H](CCc2ccccc2)C1 ZINC000684026241 1037254731 /nfs/dbraw/zinc/25/47/31/1037254731.db2.gz ZKZPKWMRPHUNKP-HXUWFJFHSA-N 1 2 320.436 4.002 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)CCc2ccc(F)cc2)c(C)[nH+]1 ZINC001125473793 1037303275 /nfs/dbraw/zinc/30/32/75/1037303275.db2.gz MRSPFEWBFDHCTK-LBPRGKRZSA-N 1 2 314.404 4.353 20 0 DIADLO Cc1cccc(-c2noc(C[N@H+](Cc3ccccc3)C3CC3)n2)c1 ZINC000048056787 1037311226 /nfs/dbraw/zinc/31/12/26/1037311226.db2.gz VEFXXNJJWFAHIA-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1cccc(-c2noc(C[N@@H+](Cc3ccccc3)C3CC3)n2)c1 ZINC000048056787 1037311243 /nfs/dbraw/zinc/31/12/43/1037311243.db2.gz VEFXXNJJWFAHIA-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1cccc(N2CC[NH+]([C@@H](C)c3c(F)cccc3F)CC2)c1 ZINC000059373910 1037313490 /nfs/dbraw/zinc/31/34/90/1037313490.db2.gz YFLCUNNLYKDKSP-HNNXBMFYSA-N 1 2 316.395 4.156 20 0 DIADLO Cc1nc(C[NH2+][C@H]2CCCOc3c(Cl)cccc32)cs1 ZINC000126557765 1037318370 /nfs/dbraw/zinc/31/83/70/1037318370.db2.gz KJJZSJABQUSVKY-AWEZNQCLSA-N 1 2 308.834 4.108 20 0 DIADLO Cc1cc(C)c(Nc2c(N)ccc(Br)c2C)c[nH+]1 ZINC001213515812 1037327066 /nfs/dbraw/zinc/32/70/66/1037327066.db2.gz MOJJBGWBVQQFNZ-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO CC1(C)C[N@H+](CCc2c(Cl)cccc2Cl)C(C)(C)CO1 ZINC001167437767 1037341611 /nfs/dbraw/zinc/34/16/11/1037341611.db2.gz JJMYHELZVYWXMA-UHFFFAOYSA-N 1 2 316.272 4.425 20 0 DIADLO CC1(C)C[N@@H+](CCc2c(Cl)cccc2Cl)C(C)(C)CO1 ZINC001167437767 1037341626 /nfs/dbraw/zinc/34/16/26/1037341626.db2.gz JJMYHELZVYWXMA-UHFFFAOYSA-N 1 2 316.272 4.425 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2cc(F)cc(F)c2)[C@H](C)CO1 ZINC001167438467 1037353729 /nfs/dbraw/zinc/35/37/29/1037353729.db2.gz ODFHIUDESVVKAH-KUHUBIRLSA-N 1 2 317.379 4.235 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2cc(F)cc(F)c2)[C@H](C)CO1 ZINC001167438467 1037353735 /nfs/dbraw/zinc/35/37/35/1037353735.db2.gz ODFHIUDESVVKAH-KUHUBIRLSA-N 1 2 317.379 4.235 20 0 DIADLO Fc1cc(-c2ccco2)ccc1C[NH2+]Cc1cn2ccccc2n1 ZINC000684111385 1037358731 /nfs/dbraw/zinc/35/87/31/1037358731.db2.gz WDGUHSKMQJPQMQ-UHFFFAOYSA-N 1 2 321.355 4.023 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccc(F)cc2Cl)cc1F ZINC000061783628 1037363956 /nfs/dbraw/zinc/36/39/56/1037363956.db2.gz KWMXXWJRGHCITH-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccc(F)cc2Cl)cc1F ZINC000061783628 1037363970 /nfs/dbraw/zinc/36/39/70/1037363970.db2.gz KWMXXWJRGHCITH-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CC(=O)c1cc(Cl)nc(Cl)c1Nc1c[nH+]cc(C)c1C ZINC001213524814 1037380366 /nfs/dbraw/zinc/38/03/66/1037380366.db2.gz FKQBSZZGNLWCTQ-UHFFFAOYSA-N 1 2 310.184 4.346 20 0 DIADLO COC[C@@H]([NH2+]Cc1csc(C(C)C)n1)c1cccc(Cl)c1 ZINC000580975229 1037395451 /nfs/dbraw/zinc/39/54/51/1037395451.db2.gz WWEWRUHUDHKCOZ-OAHLLOKOSA-N 1 2 324.877 4.397 20 0 DIADLO Cc1cncc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)c1 ZINC000276012267 1037400078 /nfs/dbraw/zinc/40/00/78/1037400078.db2.gz JMRSCVOYLAWGJE-UHFFFAOYSA-N 1 2 307.224 4.476 20 0 DIADLO CCCC[N@H+](Cc1cc(COC)on1)[C@H](C)c1ccc(C)o1 ZINC000656417106 1037451215 /nfs/dbraw/zinc/45/12/15/1037451215.db2.gz WNPHYBLOYHKZLT-CQSZACIVSA-N 1 2 306.406 4.086 20 0 DIADLO CCCC[N@@H+](Cc1cc(COC)on1)[C@H](C)c1ccc(C)o1 ZINC000656417106 1037451225 /nfs/dbraw/zinc/45/12/25/1037451225.db2.gz WNPHYBLOYHKZLT-CQSZACIVSA-N 1 2 306.406 4.086 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)c1Cl ZINC001204553749 1037489554 /nfs/dbraw/zinc/48/95/54/1037489554.db2.gz YAQXVRNHGBYBIE-UONOGXRCSA-N 1 2 317.832 4.478 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c1Cl ZINC001204553749 1037489560 /nfs/dbraw/zinc/48/95/60/1037489560.db2.gz YAQXVRNHGBYBIE-UONOGXRCSA-N 1 2 317.832 4.478 20 0 DIADLO c1csc([C@H]([NH2+]Cc2cc[nH]n2)c2ccc3c(c2)CCCC3)c1 ZINC000066970694 1037499561 /nfs/dbraw/zinc/49/95/61/1037499561.db2.gz QGTSVYIWZNWQIY-LJQANCHMSA-N 1 2 323.465 4.229 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CC[C@@H](c3c(F)cccc3F)C2)no1 ZINC000581338581 1037540105 /nfs/dbraw/zinc/54/01/05/1037540105.db2.gz IRAUMPARNYLRED-GFCCVEGCSA-N 1 2 320.383 4.240 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)no1 ZINC000581338581 1037540113 /nfs/dbraw/zinc/54/01/13/1037540113.db2.gz IRAUMPARNYLRED-GFCCVEGCSA-N 1 2 320.383 4.240 20 0 DIADLO COc1cccc2c(N[C@H]3COc4ccc(C)cc43)cc[nH+]c12 ZINC000581342672 1037544577 /nfs/dbraw/zinc/54/45/77/1037544577.db2.gz BNRVQERRIPKDSM-INIZCTEOSA-N 1 2 306.365 4.097 20 0 DIADLO c1csc(-c2nc(C[N@@H+]3CCc4ccccc4C3)cs2)c1 ZINC000015254176 1037602228 /nfs/dbraw/zinc/60/22/28/1037602228.db2.gz RTYMLCLBWLLCPJ-UHFFFAOYSA-N 1 2 312.463 4.430 20 0 DIADLO c1csc(-c2nc(C[N@H+]3CCc4ccccc4C3)cs2)c1 ZINC000015254176 1037602234 /nfs/dbraw/zinc/60/22/34/1037602234.db2.gz RTYMLCLBWLLCPJ-UHFFFAOYSA-N 1 2 312.463 4.430 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)o1 ZINC000341070658 1037663459 /nfs/dbraw/zinc/66/34/59/1037663459.db2.gz QIGISSHUCQETPH-ZJUUUORDSA-N 1 2 313.323 4.063 20 0 DIADLO Brc1cnc(C[N@@H+]2CCC3(C2)CCCCC3)s1 ZINC000341147814 1037692113 /nfs/dbraw/zinc/69/21/13/1037692113.db2.gz ZKPHQNKTJMCVSD-UHFFFAOYSA-N 1 2 315.280 4.062 20 0 DIADLO Brc1cnc(C[N@H+]2CCC3(C2)CCCCC3)s1 ZINC000341147814 1037692118 /nfs/dbraw/zinc/69/21/18/1037692118.db2.gz ZKPHQNKTJMCVSD-UHFFFAOYSA-N 1 2 315.280 4.062 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H]1c1ccccc1F ZINC001143394620 1037695656 /nfs/dbraw/zinc/69/56/56/1037695656.db2.gz JSPCDTPTMJDWJZ-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+]1CCC[C@@H]1c1ccccc1F ZINC001143394620 1037695667 /nfs/dbraw/zinc/69/56/67/1037695667.db2.gz JSPCDTPTMJDWJZ-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccccc1-c1ccc([C@@H](C)[NH2+]Cc2cocn2)cc1 ZINC000581506671 1037700638 /nfs/dbraw/zinc/70/06/38/1037700638.db2.gz VXNKTNFNOYYCAM-CQSZACIVSA-N 1 2 308.381 4.201 20 0 DIADLO COc1c(C)c[nH+]c(CN(Cc2ccc(C)c(C)c2)C2CC2)c1C ZINC001167467377 1037707695 /nfs/dbraw/zinc/70/76/95/1037707695.db2.gz JQTPXLGYQUOTGN-UHFFFAOYSA-N 1 2 324.468 4.488 20 0 DIADLO CC[C@H]([NH2+]Cc1noc(-c2ccccc2C)n1)c1ccccc1 ZINC000341217933 1037757841 /nfs/dbraw/zinc/75/78/41/1037757841.db2.gz ZVRGECWJWDTPEW-KRWDZBQOSA-N 1 2 307.397 4.286 20 0 DIADLO Cc1ccc(-c2nc(C[NH+]3CC4(CC(F)C4)C3)cs2)cc1 ZINC000656694546 1037798682 /nfs/dbraw/zinc/79/86/82/1037798682.db2.gz UWBSJTYQHJAYMA-UHFFFAOYSA-N 1 2 302.418 4.052 20 0 DIADLO Cc1ccc(-c2csc(NC(=O)C[NH+]3CCCC3)n2)c(C)c1 ZINC000051126571 1037819570 /nfs/dbraw/zinc/81/95/70/1037819570.db2.gz XACYBUBLMWEKII-UHFFFAOYSA-N 1 2 315.442 4.111 20 0 DIADLO Cc1c[nH+]c(CNc2cccc(COC3CCCCC3)c2)n1C ZINC000341266322 1037825291 /nfs/dbraw/zinc/82/52/91/1037825291.db2.gz WRZGBELNIOZBFX-UHFFFAOYSA-N 1 2 313.445 4.190 20 0 DIADLO CCCCn1ccnc1-c1cccc(NCc2[nH+]cc(C)n2C)c1 ZINC000341267742 1037827302 /nfs/dbraw/zinc/82/73/02/1037827302.db2.gz YMRVUCDXNVSLQF-UHFFFAOYSA-N 1 2 323.444 4.004 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2csc(C(F)(F)F)c2)s1 ZINC000926163345 1037880762 /nfs/dbraw/zinc/88/07/62/1037880762.db2.gz HCCFSDWHPRBGIJ-RQJHMYQMSA-N 1 2 321.393 4.339 20 0 DIADLO Cc1c[nH+]c(CNc2ccc(-c3ccc(Cl)s3)nc2)n1C ZINC000341341506 1037902555 /nfs/dbraw/zinc/90/25/55/1037902555.db2.gz LIYKEMKGSOQNGZ-UHFFFAOYSA-N 1 2 318.833 4.118 20 0 DIADLO Cc1cnc(C[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)n1C ZINC000341362301 1037921821 /nfs/dbraw/zinc/92/18/21/1037921821.db2.gz UKGRACJBDTWJIH-INIZCTEOSA-N 1 2 309.816 4.008 20 0 DIADLO C[C@]1([NH2+]Cc2ncc(Cl)cc2Cl)CCOc2ccccc21 ZINC000933376624 1037928259 /nfs/dbraw/zinc/92/82/59/1037928259.db2.gz ZFFFLWFKNRYDHS-INIZCTEOSA-N 1 2 323.223 4.176 20 0 DIADLO Cc1[nH+]c(C(C)(C)C)nc(N[C@@H](C)c2ccc(F)cn2)c1C ZINC001167479693 1037935160 /nfs/dbraw/zinc/93/51/60/1037935160.db2.gz RVGSNRFGRKOTKB-LBPRGKRZSA-N 1 2 302.397 4.098 20 0 DIADLO COCCCC[C@H]([NH2+]Cc1n[nH]c2ccccc21)c1ccccc1 ZINC000684410763 1037955859 /nfs/dbraw/zinc/95/58/59/1037955859.db2.gz ITEMGRZFCJFOKD-SFHVURJKSA-N 1 2 323.440 4.211 20 0 DIADLO Cc1c[nH+]c(CNC2(c3c(Cl)cccc3Cl)CCC2)n1C ZINC000341395946 1037967507 /nfs/dbraw/zinc/96/75/07/1037967507.db2.gz BESVWMNHJYYJLT-UHFFFAOYSA-N 1 2 324.255 4.204 20 0 DIADLO COC1CCC(Nc2[nH+]cccc2OCc2ccccc2)CC1 ZINC000413415706 1037968700 /nfs/dbraw/zinc/96/87/00/1037968700.db2.gz IFUBARXLPCIUOA-UHFFFAOYSA-N 1 2 312.413 4.030 20 0 DIADLO C[C@@H](CNc1cccc[nH+]1)Sc1ccc(Br)cc1 ZINC000597950333 1037982102 /nfs/dbraw/zinc/98/21/02/1037982102.db2.gz VWGGIMQKNBIQFZ-NSHDSACASA-N 1 2 323.259 4.437 20 0 DIADLO Fc1ccc(C(F)(F)C[N@@H+]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC001167482733 1037992589 /nfs/dbraw/zinc/99/25/89/1037992589.db2.gz PUHVRBIKMICSCH-INIZCTEOSA-N 1 2 319.370 4.482 20 0 DIADLO Fc1ccc(C(F)(F)C[N@H+]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC001167482733 1037992597 /nfs/dbraw/zinc/99/25/97/1037992597.db2.gz PUHVRBIKMICSCH-INIZCTEOSA-N 1 2 319.370 4.482 20 0 DIADLO C[C@]1(F)CCC[N@H+](Cc2cc(C(F)(F)F)cnc2Cl)CC1 ZINC001232006428 1037993117 /nfs/dbraw/zinc/99/31/17/1037993117.db2.gz XCIMNIMTYOEWIV-ZDUSSCGKSA-N 1 2 324.749 4.468 20 0 DIADLO C[C@]1(F)CCC[N@@H+](Cc2cc(C(F)(F)F)cnc2Cl)CC1 ZINC001232006428 1037993128 /nfs/dbraw/zinc/99/31/28/1037993128.db2.gz XCIMNIMTYOEWIV-ZDUSSCGKSA-N 1 2 324.749 4.468 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000891515463 1038002506 /nfs/dbraw/zinc/00/25/06/1038002506.db2.gz GMVMVJBTWACEKR-LBPRGKRZSA-N 1 2 315.417 4.332 20 0 DIADLO Cc1cc(F)ncc1C[N@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000891515463 1038002525 /nfs/dbraw/zinc/00/25/25/1038002525.db2.gz GMVMVJBTWACEKR-LBPRGKRZSA-N 1 2 315.417 4.332 20 0 DIADLO CCn1cc(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)c(C)n1 ZINC000891515843 1038003767 /nfs/dbraw/zinc/00/37/67/1038003767.db2.gz JOGYRTFVBLJZQB-CYBMUJFWSA-N 1 2 314.458 4.014 20 0 DIADLO CCn1cc(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)c(C)n1 ZINC000891515843 1038003792 /nfs/dbraw/zinc/00/37/92/1038003792.db2.gz JOGYRTFVBLJZQB-CYBMUJFWSA-N 1 2 314.458 4.014 20 0 DIADLO CSc1ncc(Nc2cccc3[nH+]c(C)cn32)cc1Cl ZINC001216024716 1038016308 /nfs/dbraw/zinc/01/63/08/1038016308.db2.gz DUWUKJVRUBKGCI-UHFFFAOYSA-N 1 2 304.806 4.157 20 0 DIADLO Cc1ncc([C@H](C)[NH2+][C@H](COCC(C)C)c2ccco2)s1 ZINC000090406795 1038039947 /nfs/dbraw/zinc/03/99/47/1038039947.db2.gz JJLOYXAWJMMDHB-GXTWGEPZSA-N 1 2 308.447 4.109 20 0 DIADLO C[C@H](Nc1cc2c3c(c1)CCC[NH+]3CCC2)c1ccc(F)cn1 ZINC001167486010 1038040615 /nfs/dbraw/zinc/04/06/15/1038040615.db2.gz JTGWWWVHLIDECT-ZDUSSCGKSA-N 1 2 311.404 4.093 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nc(Cl)ccc2Br)[C@@H](C)C1 ZINC001232060906 1038051104 /nfs/dbraw/zinc/05/11/04/1038051104.db2.gz JOTDGLHFMDNIEW-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nc(Cl)ccc2Br)[C@@H](C)C1 ZINC001232060906 1038051117 /nfs/dbraw/zinc/05/11/17/1038051117.db2.gz JOTDGLHFMDNIEW-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2Cc3ccccc3OC[C@@H]2C)s1 ZINC000341473229 1038057045 /nfs/dbraw/zinc/05/70/45/1038057045.db2.gz IBVQKMWWQITODR-ZDUSSCGKSA-N 1 2 302.443 4.050 20 0 DIADLO CC(C)c1ncc(C[N@H+]2Cc3ccccc3OC[C@@H]2C)s1 ZINC000341473229 1038057065 /nfs/dbraw/zinc/05/70/65/1038057065.db2.gz IBVQKMWWQITODR-ZDUSSCGKSA-N 1 2 302.443 4.050 20 0 DIADLO Cc1ccc(C2=CC[N@H+]([C@@H](C)c3nc(C4CC4)no3)CC2)cc1 ZINC000051287343 1038116895 /nfs/dbraw/zinc/11/68/95/1038116895.db2.gz HTYNYACDBUETQG-AWEZNQCLSA-N 1 2 309.413 4.106 20 0 DIADLO Cc1ccc(C2=CC[N@@H+]([C@@H](C)c3nc(C4CC4)no3)CC2)cc1 ZINC000051287343 1038116906 /nfs/dbraw/zinc/11/69/06/1038116906.db2.gz HTYNYACDBUETQG-AWEZNQCLSA-N 1 2 309.413 4.106 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC001143404425 1038127937 /nfs/dbraw/zinc/12/79/37/1038127937.db2.gz NACHRUWVDBRCPI-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC001143404425 1038127946 /nfs/dbraw/zinc/12/79/46/1038127946.db2.gz NACHRUWVDBRCPI-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+]1CCc2ccccc2[C@@H]1C ZINC001143405245 1038141560 /nfs/dbraw/zinc/14/15/60/1038141560.db2.gz WHXYCTOYQPFCMO-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+]1CCc2ccccc2[C@@H]1C ZINC001143405245 1038141569 /nfs/dbraw/zinc/14/15/69/1038141569.db2.gz WHXYCTOYQPFCMO-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)[nH]c1C ZINC000581954783 1038171758 /nfs/dbraw/zinc/17/17/58/1038171758.db2.gz JSFSZNGSLMRYOE-INIZCTEOSA-N 1 2 309.816 4.306 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc4c(c3)CCC=C4)cc2[nH+]1 ZINC000341629066 1038188317 /nfs/dbraw/zinc/18/83/17/1038188317.db2.gz JNEWQYPTKISHQR-UHFFFAOYSA-N 1 2 303.365 4.083 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nnc(C)o1)c1ccc(Cl)c(Cl)c1 ZINC000341640563 1038198563 /nfs/dbraw/zinc/19/85/63/1038198563.db2.gz PEUQNQPGECLSGR-CYBMUJFWSA-N 1 2 314.216 4.316 20 0 DIADLO Cc1cc(NC(=O)c2ccc(C(C)C)c(Cl)c2)c(C)c[nH+]1 ZINC001266899589 1038206290 /nfs/dbraw/zinc/20/62/90/1038206290.db2.gz IFEDIPBTSKOHFC-UHFFFAOYSA-N 1 2 302.805 4.149 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1ncc(C)o1)c1ccccc1OC(F)F ZINC000341659280 1038209951 /nfs/dbraw/zinc/20/99/51/1038209951.db2.gz NHXVXQSFFWCOMM-YPMHNXCESA-N 1 2 310.344 4.386 20 0 DIADLO CC[C@@H]([NH2+]Cc1csc([C@H](C)OC)n1)c1ccccc1OC ZINC000341661973 1038212407 /nfs/dbraw/zinc/21/24/07/1038212407.db2.gz SFANFVZXRGZBBI-SWLSCSKDSA-N 1 2 320.458 4.100 20 0 DIADLO CCC[C@@H](CC1CCCCC1)C(=O)NCCCCn1cc[nH+]c1 ZINC000603471027 1038214053 /nfs/dbraw/zinc/21/40/53/1038214053.db2.gz JRIRBMYYQJBWPB-SFHVURJKSA-N 1 2 319.493 4.166 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](CC)c2ccc(F)cc2F)[nH]1 ZINC000276845899 1038251732 /nfs/dbraw/zinc/25/17/32/1038251732.db2.gz CNHNERQOUVPXQB-PGUXBMHVSA-N 1 2 322.403 4.398 20 0 DIADLO CCOc1ccc(O)c(/C=[NH+]/CCCn2ccc3ccccc32)c1 ZINC000022729413 1038253995 /nfs/dbraw/zinc/25/39/95/1038253995.db2.gz SIZDDOTVWJVCRK-RCCKNPSSSA-N 1 2 322.408 4.255 20 0 DIADLO Clc1cnc(C[NH2+]Cc2ccc(-c3ccncc3)cc2)s1 ZINC000349604481 1038254935 /nfs/dbraw/zinc/25/49/35/1038254935.db2.gz ZNWOVVRQYGOYMT-UHFFFAOYSA-N 1 2 315.829 4.148 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+]Cc2occc2C(=O)OC)cc1 ZINC000341772820 1038265838 /nfs/dbraw/zinc/26/58/38/1038265838.db2.gz AAVVKZVCRUODER-LBPRGKRZSA-N 1 2 319.426 4.029 20 0 DIADLO CC[C@H](C)[C@@H](C(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000603785517 1038280236 /nfs/dbraw/zinc/28/02/36/1038280236.db2.gz SQDBPXKBEAIDMU-KBXCAEBGSA-N 1 2 307.397 4.103 20 0 DIADLO CCCc1sc(C(=O)Nc2ccc3[nH+]ccn3c2)cc1CC ZINC000603809008 1038284051 /nfs/dbraw/zinc/28/40/51/1038284051.db2.gz VYOCHWRNDORARH-UHFFFAOYSA-N 1 2 313.426 4.163 20 0 DIADLO O=C(Nc1ccc2ccccc2c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000024049704 1038296433 /nfs/dbraw/zinc/29/64/33/1038296433.db2.gz DXMUMBXJVRQQGT-UHFFFAOYSA-N 1 2 313.360 4.278 20 0 DIADLO Cc1cc(NC(=O)c2cccc(Oc3ccccc3)c2)c(C)c[nH+]1 ZINC000535749120 1038326736 /nfs/dbraw/zinc/32/67/36/1038326736.db2.gz KJDOFFGBEKJGHQ-UHFFFAOYSA-N 1 2 318.376 4.165 20 0 DIADLO c1nc(C[N@@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)cs1 ZINC000535807645 1038343638 /nfs/dbraw/zinc/34/36/38/1038343638.db2.gz XFFYYJRVLJGDIU-LJQANCHMSA-N 1 2 306.434 4.443 20 0 DIADLO c1nc(C[N@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)cs1 ZINC000535807645 1038343653 /nfs/dbraw/zinc/34/36/53/1038343653.db2.gz XFFYYJRVLJGDIU-LJQANCHMSA-N 1 2 306.434 4.443 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)cn1 ZINC000535804913 1038343873 /nfs/dbraw/zinc/34/38/73/1038343873.db2.gz BQNWIQITZOCOQW-SFHVURJKSA-N 1 2 319.399 4.469 20 0 DIADLO CC(C)n1cc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)cn1 ZINC000535804913 1038343885 /nfs/dbraw/zinc/34/38/85/1038343885.db2.gz BQNWIQITZOCOQW-SFHVURJKSA-N 1 2 319.399 4.469 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)[nH]1 ZINC000277066133 1038361186 /nfs/dbraw/zinc/36/11/86/1038361186.db2.gz DNGRFPXNXOCCHV-QJPTWQEYSA-N 1 2 306.841 4.383 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1cc(F)ccc1F ZINC000341989843 1038363833 /nfs/dbraw/zinc/36/38/33/1038363833.db2.gz AWSKOUHSTGRHCW-AWEZNQCLSA-N 1 2 320.314 4.486 20 0 DIADLO COc1nc(C)cc(C)c1CSCc1ccc(C)[nH+]c1C ZINC000342004886 1038365364 /nfs/dbraw/zinc/36/53/64/1038365364.db2.gz UFROBEOYFDDLJS-UHFFFAOYSA-N 1 2 302.443 4.152 20 0 DIADLO CSc1cccc(NC(=O)c2cccc(-n3cc[nH+]c3)c2)c1C ZINC000342032481 1038369952 /nfs/dbraw/zinc/36/99/52/1038369952.db2.gz ZXCCPRNDKKXZBJ-UHFFFAOYSA-N 1 2 323.421 4.155 20 0 DIADLO Fc1ccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)cc1F ZINC000604395423 1038411384 /nfs/dbraw/zinc/41/13/84/1038411384.db2.gz YFHSQRGMOYEREF-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1ccc(C[N@H+]2CCSC[C@@H]2c2ccccc2)cc1F ZINC000604395423 1038411388 /nfs/dbraw/zinc/41/13/88/1038411388.db2.gz YFHSQRGMOYEREF-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2nc3c(s2)CCC3)C1 ZINC000669717641 1038423875 /nfs/dbraw/zinc/42/38/75/1038423875.db2.gz XHNIKTNJVBMRSN-GOSISDBHSA-N 1 2 316.445 4.011 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2nc3c(s2)CCC3)C1 ZINC000669717641 1038423885 /nfs/dbraw/zinc/42/38/85/1038423885.db2.gz XHNIKTNJVBMRSN-GOSISDBHSA-N 1 2 316.445 4.011 20 0 DIADLO Cc1ccc([C@H](C)NC[C@@H](c2cccs2)[NH+]2CCCC2)o1 ZINC000150908557 1038424261 /nfs/dbraw/zinc/42/42/61/1038424261.db2.gz NNJOVTGGXFOOQK-GJZGRUSLSA-N 1 2 304.459 4.137 20 0 DIADLO Cc1noc([C@H](C)[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)n1 ZINC000657199477 1038431970 /nfs/dbraw/zinc/43/19/70/1038431970.db2.gz ZKYRCAMGNNCSDZ-YOEHRIQHSA-N 1 2 311.429 4.446 20 0 DIADLO Cc1noc([C@H](C)[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)n1 ZINC000657199477 1038431977 /nfs/dbraw/zinc/43/19/77/1038431977.db2.gz ZKYRCAMGNNCSDZ-YOEHRIQHSA-N 1 2 311.429 4.446 20 0 DIADLO CC(C)Oc1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000236721681 1038436645 /nfs/dbraw/zinc/43/66/45/1038436645.db2.gz XBYTVPWSFJFNGY-ZDUSSCGKSA-N 1 2 317.433 4.005 20 0 DIADLO CC(C)Oc1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000236722849 1038437770 /nfs/dbraw/zinc/43/77/70/1038437770.db2.gz XBYTVPWSFJFNGY-CYBMUJFWSA-N 1 2 317.433 4.005 20 0 DIADLO CCc1csc(C[N@H+](C)Cc2cccc(C(F)(F)F)c2)n1 ZINC001232473581 1038440193 /nfs/dbraw/zinc/44/01/93/1038440193.db2.gz XZTIAYINKVQYHV-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO CCc1csc(C[N@@H+](C)Cc2cccc(C(F)(F)F)c2)n1 ZINC001232473581 1038440195 /nfs/dbraw/zinc/44/01/95/1038440195.db2.gz XZTIAYINKVQYHV-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)cs1 ZINC000151620586 1038455906 /nfs/dbraw/zinc/45/59/06/1038455906.db2.gz FBKBCNPNOLJOSR-HNNXBMFYSA-N 1 2 314.454 4.242 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](CC)c2cc(F)ccc2F)[nH]1 ZINC000277232748 1038460613 /nfs/dbraw/zinc/46/06/13/1038460613.db2.gz MJOWPZPNZKHEMF-RWSFTLGLSA-N 1 2 322.403 4.398 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](CC)c2cc(F)ccc2F)[nH]1 ZINC000277232738 1038461419 /nfs/dbraw/zinc/46/14/19/1038461419.db2.gz MJOWPZPNZKHEMF-PGUXBMHVSA-N 1 2 322.403 4.398 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@@H+]1Cc1ccn(C(C)C)n1 ZINC000604885396 1038461683 /nfs/dbraw/zinc/46/16/83/1038461683.db2.gz MFQBWYATZRXZQE-GOSISDBHSA-N 1 2 313.445 4.200 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1ccn(C(C)C)n1 ZINC000604885396 1038461686 /nfs/dbraw/zinc/46/16/86/1038461686.db2.gz MFQBWYATZRXZQE-GOSISDBHSA-N 1 2 313.445 4.200 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nnc([C@@H](C)CC)[nH]1)c1ccccc1F ZINC000277275465 1038477121 /nfs/dbraw/zinc/47/71/21/1038477121.db2.gz QCWSVYKOYHVLMA-YWPYICTPSA-N 1 2 304.413 4.259 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)n1 ZINC000892053147 1038489752 /nfs/dbraw/zinc/48/97/52/1038489752.db2.gz STUNMOKFVVCEBC-OAHLLOKOSA-N 1 2 316.470 4.262 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)n1 ZINC000892053147 1038489758 /nfs/dbraw/zinc/48/97/58/1038489758.db2.gz STUNMOKFVVCEBC-OAHLLOKOSA-N 1 2 316.470 4.262 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2csc(Cl)c2)[nH]1 ZINC000277298858 1038491249 /nfs/dbraw/zinc/49/12/49/1038491249.db2.gz RVBULWMAXNZXEP-IVZWLZJFSA-N 1 2 312.870 4.445 20 0 DIADLO CCCc1nc(C[N@@H+]2CCCCC[C@@H]2c2cccc(C)c2)no1 ZINC000605157021 1038494108 /nfs/dbraw/zinc/49/41/08/1038494108.db2.gz GCOKDOFZBMRCQV-QGZVFWFLSA-N 1 2 313.445 4.448 20 0 DIADLO CCCc1nc(C[N@H+]2CCCCC[C@@H]2c2cccc(C)c2)no1 ZINC000605157021 1038494113 /nfs/dbraw/zinc/49/41/13/1038494113.db2.gz GCOKDOFZBMRCQV-QGZVFWFLSA-N 1 2 313.445 4.448 20 0 DIADLO FC(F)c1ccnc(C[NH2+]Cc2ccc(Cl)c(Cl)c2)n1 ZINC000342238565 1038494298 /nfs/dbraw/zinc/49/42/98/1038494298.db2.gz DAKFFNGOPXDHJZ-UHFFFAOYSA-N 1 2 318.154 4.011 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC(Cc3ccccc3C)C2)c(C)[nH+]1 ZINC000653180901 1038509374 /nfs/dbraw/zinc/50/93/74/1038509374.db2.gz BHEOYMPCTQRPSA-UHFFFAOYSA-N 1 2 323.440 4.022 20 0 DIADLO c1csc(-c2nc(COc3ccccc3-n3cc[nH+]c3)co2)c1 ZINC000605434130 1038515703 /nfs/dbraw/zinc/51/57/03/1038515703.db2.gz DJMWRLJWPKZELX-UHFFFAOYSA-N 1 2 323.377 4.168 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2ccc3ccccc3n2)[nH]1 ZINC000277402857 1038542868 /nfs/dbraw/zinc/54/28/68/1038542868.db2.gz YZTSJVFKXPEDFP-MJBXVCDLSA-N 1 2 323.444 4.278 20 0 DIADLO C[C@@H](c1ccc(-c2ccccc2)cc1)[N@H+](C)Cc1cnns1 ZINC001167521809 1038545848 /nfs/dbraw/zinc/54/58/48/1038545848.db2.gz JWNSXOAWEVAGFQ-AWEZNQCLSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@@H](c1ccc(-c2ccccc2)cc1)[N@@H+](C)Cc1cnns1 ZINC001167521809 1038545854 /nfs/dbraw/zinc/54/58/54/1038545854.db2.gz JWNSXOAWEVAGFQ-AWEZNQCLSA-N 1 2 309.438 4.398 20 0 DIADLO CC(C)n1ccnc1C[NH2+]Cc1ccccc1OC1CCCC1 ZINC000657319088 1038562604 /nfs/dbraw/zinc/56/26/04/1038562604.db2.gz RMMXNJUHRQLZQR-UHFFFAOYSA-N 1 2 313.445 4.075 20 0 DIADLO O=C(CC/C=C/c1ccccc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000606168236 1038574028 /nfs/dbraw/zinc/57/40/28/1038574028.db2.gz OYWADELGKNROMG-XBXARRHUSA-N 1 2 317.392 4.304 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1nnc(C(C)C)s1)C(C)(C)C ZINC000934288559 1038580347 /nfs/dbraw/zinc/58/03/47/1038580347.db2.gz WGHGYPHHACRHMN-HNNXBMFYSA-N 1 2 318.490 4.242 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cc4c(cccc4C)[nH]3)CCCCC2)no1 ZINC000657340254 1038583340 /nfs/dbraw/zinc/58/33/40/1038583340.db2.gz FXAMQZSIFFIQEX-UHFFFAOYSA-N 1 2 324.428 4.117 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@@H]2c2cccn2C)c2ccccn21 ZINC000563252733 1038584912 /nfs/dbraw/zinc/58/49/12/1038584912.db2.gz KKBNZHFKBQOOCT-LJQANCHMSA-N 1 2 322.456 4.133 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@@H]2c2cccn2C)c2ccccn21 ZINC000563252733 1038584915 /nfs/dbraw/zinc/58/49/15/1038584915.db2.gz KKBNZHFKBQOOCT-LJQANCHMSA-N 1 2 322.456 4.133 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc(COC(C)(C)C)cc1 ZINC000643767516 1038596671 /nfs/dbraw/zinc/59/66/71/1038596671.db2.gz LFOYAKJNGLPVDL-UHFFFAOYSA-N 1 2 301.434 4.391 20 0 DIADLO c1cc2c(s1)CCCCN2Cc1c[nH+]cn1Cc1ccccc1 ZINC000684772043 1038596934 /nfs/dbraw/zinc/59/69/34/1038596934.db2.gz MWNYGJLSZCQMPB-UHFFFAOYSA-N 1 2 323.465 4.336 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000606431421 1038600787 /nfs/dbraw/zinc/60/07/87/1038600787.db2.gz PTBJMOHCILLNMV-OALUTQOASA-N 1 2 317.379 4.489 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000606431421 1038600792 /nfs/dbraw/zinc/60/07/92/1038600792.db2.gz PTBJMOHCILLNMV-OALUTQOASA-N 1 2 317.379 4.489 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000606431423 1038601040 /nfs/dbraw/zinc/60/10/40/1038601040.db2.gz PTBJMOHCILLNMV-RTBURBONSA-N 1 2 317.379 4.489 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000606431423 1038601045 /nfs/dbraw/zinc/60/10/45/1038601045.db2.gz PTBJMOHCILLNMV-RTBURBONSA-N 1 2 317.379 4.489 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2nc(C(C)C)no2)o1 ZINC000606454125 1038605149 /nfs/dbraw/zinc/60/51/49/1038605149.db2.gz FFWBQRPLVCVRHE-AWEZNQCLSA-N 1 2 303.406 4.212 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nc(C(C)C)no2)o1 ZINC000606454125 1038605154 /nfs/dbraw/zinc/60/51/54/1038605154.db2.gz FFWBQRPLVCVRHE-AWEZNQCLSA-N 1 2 303.406 4.212 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000342443924 1038607935 /nfs/dbraw/zinc/60/79/35/1038607935.db2.gz HKCZKWVZWYVZHS-OAHLLOKOSA-N 1 2 318.442 4.097 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000342443924 1038607944 /nfs/dbraw/zinc/60/79/44/1038607944.db2.gz HKCZKWVZWYVZHS-OAHLLOKOSA-N 1 2 318.442 4.097 20 0 DIADLO CC(C)(C)c1coc(C[N@H+](CCC(F)(F)F)CC2CC2)n1 ZINC000892216739 1038608222 /nfs/dbraw/zinc/60/82/22/1038608222.db2.gz BQBGLRDAWTUXFT-UHFFFAOYSA-N 1 2 304.356 4.137 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+](CCC(F)(F)F)CC2CC2)n1 ZINC000892216739 1038608225 /nfs/dbraw/zinc/60/82/25/1038608225.db2.gz BQBGLRDAWTUXFT-UHFFFAOYSA-N 1 2 304.356 4.137 20 0 DIADLO CC[C@H]1CCC[N@H+](Cn2nc(C3CC3)n(C3CC3)c2=S)CC1 ZINC000172509593 1038614010 /nfs/dbraw/zinc/61/40/10/1038614010.db2.gz HSXRFJHCQHMSLY-ZDUSSCGKSA-N 1 2 320.506 4.096 20 0 DIADLO CC[C@H]1CCC[N@@H+](Cn2nc(C3CC3)n(C3CC3)c2=S)CC1 ZINC000172509593 1038614014 /nfs/dbraw/zinc/61/40/14/1038614014.db2.gz HSXRFJHCQHMSLY-ZDUSSCGKSA-N 1 2 320.506 4.096 20 0 DIADLO CC(C)c1ccc(CN(C)C(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC000606582833 1038615670 /nfs/dbraw/zinc/61/56/70/1038615670.db2.gz FXUAOWWJEASAQC-UHFFFAOYSA-N 1 2 322.412 4.122 20 0 DIADLO Cc1ccccc1[C@H](NC(=O)Nc1ccc2[nH+]ccn2c1)C(C)C ZINC000606580188 1038615873 /nfs/dbraw/zinc/61/58/73/1038615873.db2.gz DGBRRAGLHUXQTE-GOSISDBHSA-N 1 2 322.412 4.162 20 0 DIADLO FC[C@@H]([NH2+]Cc1cccnc1C(F)(F)F)c1ccc(F)cc1 ZINC000640155273 1038620991 /nfs/dbraw/zinc/62/09/91/1038620991.db2.gz SIUVKPPZWPTJMG-CYBMUJFWSA-N 1 2 316.273 4.040 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@@H+]2Cc2nc(C(C)C)no2)o1 ZINC000606899420 1038638095 /nfs/dbraw/zinc/63/80/95/1038638095.db2.gz LVIJTAKIKMKIRB-OAHLLOKOSA-N 1 2 317.433 4.466 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@H+]2Cc2nc(C(C)C)no2)o1 ZINC000606899420 1038638102 /nfs/dbraw/zinc/63/81/02/1038638102.db2.gz LVIJTAKIKMKIRB-OAHLLOKOSA-N 1 2 317.433 4.466 20 0 DIADLO Cn1c(Cl)cnc1C[N@H+](Cc1ccoc1)C1CCCCC1 ZINC000172872466 1038651875 /nfs/dbraw/zinc/65/18/75/1038651875.db2.gz WKVIJSGWZZYTPA-UHFFFAOYSA-N 1 2 307.825 4.001 20 0 DIADLO Cn1c(Cl)cnc1C[N@@H+](Cc1ccoc1)C1CCCCC1 ZINC000172872466 1038651878 /nfs/dbraw/zinc/65/18/78/1038651878.db2.gz WKVIJSGWZZYTPA-UHFFFAOYSA-N 1 2 307.825 4.001 20 0 DIADLO CC(=O)c1cc(C[N@@H+](C)C2c3ccccc3-c3ccccc32)on1 ZINC000582398668 1038657127 /nfs/dbraw/zinc/65/71/27/1038657127.db2.gz FFEXCAJLJSIQCU-UHFFFAOYSA-N 1 2 318.376 4.079 20 0 DIADLO CC(=O)c1cc(C[N@H+](C)C2c3ccccc3-c3ccccc32)on1 ZINC000582398668 1038657130 /nfs/dbraw/zinc/65/71/30/1038657130.db2.gz FFEXCAJLJSIQCU-UHFFFAOYSA-N 1 2 318.376 4.079 20 0 DIADLO Cc1cc(NCc2ccccc2Br)nc(C(C)C)[nH+]1 ZINC000048820978 1038670431 /nfs/dbraw/zinc/67/04/31/1038670431.db2.gz BOSRSFKRUZEPCQ-UHFFFAOYSA-N 1 2 320.234 4.283 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccsc2)oc1C)Cc1ccccn1 ZINC000119879099 1038683650 /nfs/dbraw/zinc/68/36/50/1038683650.db2.gz FXPRLBCJQWCEIC-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccsc2)oc1C)Cc1ccccn1 ZINC000119879099 1038683659 /nfs/dbraw/zinc/68/36/59/1038683659.db2.gz FXPRLBCJQWCEIC-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1coc(-c2ccccc2F)n1 ZINC000625981330 1038687741 /nfs/dbraw/zinc/68/77/41/1038687741.db2.gz OSOJEDHCDPAPMK-LLVKDONJSA-N 1 2 310.319 4.100 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1coc(-c2ccccc2F)n1 ZINC000625981330 1038687745 /nfs/dbraw/zinc/68/77/45/1038687745.db2.gz OSOJEDHCDPAPMK-LLVKDONJSA-N 1 2 310.319 4.100 20 0 DIADLO COCc1cnc(C[N@H+](C)Cc2ccc3ccccc3c2)s1 ZINC000342682256 1038719723 /nfs/dbraw/zinc/71/97/23/1038719723.db2.gz WREZENGTQOJLPO-UHFFFAOYSA-N 1 2 312.438 4.075 20 0 DIADLO COCc1cnc(C[N@@H+](C)Cc2ccc3ccccc3c2)s1 ZINC000342682256 1038719732 /nfs/dbraw/zinc/71/97/32/1038719732.db2.gz WREZENGTQOJLPO-UHFFFAOYSA-N 1 2 312.438 4.075 20 0 DIADLO COCc1cnc(C[N@H+]([C@@H](C)c2ccccc2)C2CC2)s1 ZINC000342686891 1038722167 /nfs/dbraw/zinc/72/21/67/1038722167.db2.gz ZVACAGHGDJJZNV-ZDUSSCGKSA-N 1 2 302.443 4.015 20 0 DIADLO COCc1cnc(C[N@@H+]([C@@H](C)c2ccccc2)C2CC2)s1 ZINC000342686891 1038722177 /nfs/dbraw/zinc/72/21/77/1038722177.db2.gz ZVACAGHGDJJZNV-ZDUSSCGKSA-N 1 2 302.443 4.015 20 0 DIADLO FC(F)Oc1ccc(COc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000607723340 1038725283 /nfs/dbraw/zinc/72/52/83/1038725283.db2.gz NJOLLCGLKJBHDU-UHFFFAOYSA-N 1 2 316.307 4.053 20 0 DIADLO Oc1ccc(C2=CC[N@H+](Cc3nc(C4CC4)cs3)CC2)cc1 ZINC000342701547 1038726934 /nfs/dbraw/zinc/72/69/34/1038726934.db2.gz YVLANXHQHIVNKH-UHFFFAOYSA-N 1 2 312.438 4.015 20 0 DIADLO Oc1ccc(C2=CC[N@@H+](Cc3nc(C4CC4)cs3)CC2)cc1 ZINC000342701547 1038726943 /nfs/dbraw/zinc/72/69/43/1038726943.db2.gz YVLANXHQHIVNKH-UHFFFAOYSA-N 1 2 312.438 4.015 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1ncc(-c2ccccc2F)o1 ZINC000607728144 1038727731 /nfs/dbraw/zinc/72/77/31/1038727731.db2.gz IOOFMOSWDNRELE-UHFFFAOYSA-N 1 2 316.298 4.255 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1ncc(-c2ccccc2F)o1 ZINC000607728144 1038727740 /nfs/dbraw/zinc/72/77/40/1038727740.db2.gz IOOFMOSWDNRELE-UHFFFAOYSA-N 1 2 316.298 4.255 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2o1)c1cnn(CC2CCC2)c1 ZINC000934562482 1038734551 /nfs/dbraw/zinc/73/45/51/1038734551.db2.gz QKIHIWVMIGYMTH-KGLIPLIRSA-N 1 2 324.428 4.236 20 0 DIADLO c1ccc([C@@H]([NH2+][C@H]2CCCc3cccnc32)c2ccccn2)cc1 ZINC000684954301 1038739912 /nfs/dbraw/zinc/73/99/12/1038739912.db2.gz YIAYMITVEOXURN-PZJWPPBQSA-N 1 2 315.420 4.233 20 0 DIADLO C[N@H+](CCOc1ccc(Cl)cc1)Cc1nc(C2CC2)cs1 ZINC000342764418 1038763522 /nfs/dbraw/zinc/76/35/22/1038763522.db2.gz HJPVAJSMUGIYEC-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO C[N@@H+](CCOc1ccc(Cl)cc1)Cc1nc(C2CC2)cs1 ZINC000342764418 1038763524 /nfs/dbraw/zinc/76/35/24/1038763524.db2.gz HJPVAJSMUGIYEC-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO Cc1noc([C@@H](C)[NH+]2CCC(F)(c3ccc(Cl)cc3)CC2)n1 ZINC000685005015 1038774514 /nfs/dbraw/zinc/77/45/14/1038774514.db2.gz GANAJEXUFAJRIT-LLVKDONJSA-N 1 2 323.799 4.053 20 0 DIADLO Cc1noc([C@H](C)[NH+]2CCC(F)(c3ccc(Cl)cc3)CC2)n1 ZINC000685005016 1038775043 /nfs/dbraw/zinc/77/50/43/1038775043.db2.gz GANAJEXUFAJRIT-NSHDSACASA-N 1 2 323.799 4.053 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+](Cc2ccccc2F)C2CC2)cn1 ZINC000342785721 1038775463 /nfs/dbraw/zinc/77/54/63/1038775463.db2.gz SDDIMMKYYKCSAS-UHFFFAOYSA-N 1 2 313.420 4.078 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+](Cc2ccccc2F)C2CC2)cn1 ZINC000342785721 1038775477 /nfs/dbraw/zinc/77/54/77/1038775477.db2.gz SDDIMMKYYKCSAS-UHFFFAOYSA-N 1 2 313.420 4.078 20 0 DIADLO CCCCC1CCC(C(=O)N2CCC[C@H](c3[nH]cc[nH+]3)C2)CC1 ZINC000075552454 1038803001 /nfs/dbraw/zinc/80/30/01/1038803001.db2.gz FLCWGDXZJLFCMK-JCYILVPMSA-N 1 2 317.477 4.112 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)n1 ZINC000075900502 1038820894 /nfs/dbraw/zinc/82/08/94/1038820894.db2.gz FHPFQCGIKUYCPV-RDTXWAMCSA-N 1 2 301.409 4.186 20 0 DIADLO CC(C)n1ccc(C[N@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)n1 ZINC000075900502 1038820918 /nfs/dbraw/zinc/82/09/18/1038820918.db2.gz FHPFQCGIKUYCPV-RDTXWAMCSA-N 1 2 301.409 4.186 20 0 DIADLO CCOc1ccc(Oc2cc(CNc3cccc[nH+]3)ccn2)cc1 ZINC000076871442 1038850682 /nfs/dbraw/zinc/85/06/82/1038850682.db2.gz PZXPKQCFLIVLCW-UHFFFAOYSA-N 1 2 321.380 4.280 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+]2CC(C)(C)OCC2(C)C)o1 ZINC000608497030 1038860007 /nfs/dbraw/zinc/86/00/07/1038860007.db2.gz CHMFJGZGDYPTLQ-UHFFFAOYSA-N 1 2 314.429 4.039 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+]2CC(C)(C)OCC2(C)C)o1 ZINC000608497030 1038860028 /nfs/dbraw/zinc/86/00/28/1038860028.db2.gz CHMFJGZGDYPTLQ-UHFFFAOYSA-N 1 2 314.429 4.039 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000076989694 1038861257 /nfs/dbraw/zinc/86/12/57/1038861257.db2.gz IWVJKFYDIJTOCM-WCQYABFASA-N 1 2 305.447 4.327 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000076989694 1038861284 /nfs/dbraw/zinc/86/12/84/1038861284.db2.gz IWVJKFYDIJTOCM-WCQYABFASA-N 1 2 305.447 4.327 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000076989698 1038861550 /nfs/dbraw/zinc/86/15/50/1038861550.db2.gz IWVJKFYDIJTOCM-DGCLKSJQSA-N 1 2 305.447 4.327 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000076989698 1038861568 /nfs/dbraw/zinc/86/15/68/1038861568.db2.gz IWVJKFYDIJTOCM-DGCLKSJQSA-N 1 2 305.447 4.327 20 0 DIADLO CCCc1noc(C[NH2+]C(C)(C)c2ccc(C(C)C)cc2)n1 ZINC000608563071 1038884075 /nfs/dbraw/zinc/88/40/75/1038884075.db2.gz WJZOCQQXYQOSQH-UHFFFAOYSA-N 1 2 301.434 4.170 20 0 DIADLO Brc1ccc2[nH]c3c(c2c1)C[N@H+](CCC1CC1)CC3 ZINC000608561874 1038884332 /nfs/dbraw/zinc/88/43/32/1038884332.db2.gz FPUZWZBYOQHJEB-UHFFFAOYSA-N 1 2 319.246 4.089 20 0 DIADLO Brc1ccc2[nH]c3c(c2c1)C[N@@H+](CCC1CC1)CC3 ZINC000608561874 1038884351 /nfs/dbraw/zinc/88/43/51/1038884351.db2.gz FPUZWZBYOQHJEB-UHFFFAOYSA-N 1 2 319.246 4.089 20 0 DIADLO CN(C)c1cccc(C[NH2+][C@H](c2nccs2)c2ccccc2)c1 ZINC000608561559 1038886985 /nfs/dbraw/zinc/88/69/85/1038886985.db2.gz VZZMFHWBWHWDCR-SFHVURJKSA-N 1 2 323.465 4.088 20 0 DIADLO CN(C)c1cccc(C[NH2+][C@@H](c2nccs2)c2ccccc2)c1 ZINC000608561554 1038887879 /nfs/dbraw/zinc/88/78/79/1038887879.db2.gz VZZMFHWBWHWDCR-GOSISDBHSA-N 1 2 323.465 4.088 20 0 DIADLO Cc1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)n(-c2ccccc2)n1 ZINC001213085527 1038897199 /nfs/dbraw/zinc/89/71/99/1038897199.db2.gz JYOVJRRNUSIOOK-UHFFFAOYSA-N 1 2 315.380 4.314 20 0 DIADLO Cc1cc2c(ncnc2Nc2ccc(-c3[nH]cc[nH+]3)cc2)s1 ZINC001213085529 1038898130 /nfs/dbraw/zinc/89/81/30/1038898130.db2.gz KAKWFHLLLGDKEC-UHFFFAOYSA-N 1 2 307.382 4.133 20 0 DIADLO CCN(Cc1[nH]c(C)c(C)[nH+]1)Cc1ccc(Cl)c(Cl)c1 ZINC000628152537 1038905690 /nfs/dbraw/zinc/90/56/90/1038905690.db2.gz FWGAGPLZACJXPF-UHFFFAOYSA-N 1 2 312.244 4.355 20 0 DIADLO Cc1[nH+]ccn1CCCCNc1ccnc2ccc(Cl)cc21 ZINC000078336180 1038920845 /nfs/dbraw/zinc/92/08/45/1038920845.db2.gz SIPYFLMFPDOTMV-UHFFFAOYSA-N 1 2 314.820 4.285 20 0 DIADLO Oc1cccc(C[NH2+]Cc2cccc(OC3CC3)c2F)c1Cl ZINC000657621577 1038921603 /nfs/dbraw/zinc/92/16/03/1038921603.db2.gz UVKTVFBIXCFIIU-UHFFFAOYSA-N 1 2 321.779 4.016 20 0 DIADLO FC(F)(F)c1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)nc1 ZINC001213085748 1038955745 /nfs/dbraw/zinc/95/57/45/1038955745.db2.gz VIIDJBQOHDMSHS-UHFFFAOYSA-N 1 2 304.275 4.234 20 0 DIADLO COc1cccc2c(N3C[C@H](C(F)(F)F)CC[C@H]3C)cc[nH+]c12 ZINC000685039672 1038984386 /nfs/dbraw/zinc/98/43/86/1038984386.db2.gz YYAWFIOQZUPSTJ-VXGBXAGGSA-N 1 2 324.346 4.411 20 0 DIADLO Clc1nc2ccccc2nc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213085972 1038988270 /nfs/dbraw/zinc/98/82/70/1038988270.db2.gz BCHQLMZSXAQYSG-UHFFFAOYSA-N 1 2 321.771 4.417 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCCC[C@@H]2CCc2ccccc2)no1 ZINC000534126756 1038990726 /nfs/dbraw/zinc/99/07/26/1038990726.db2.gz YKXYRGATIWWAIN-QGZVFWFLSA-N 1 2 313.445 4.180 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCCC[C@@H]2CCc2ccccc2)no1 ZINC000534126756 1038990744 /nfs/dbraw/zinc/99/07/44/1038990744.db2.gz YKXYRGATIWWAIN-QGZVFWFLSA-N 1 2 313.445 4.180 20 0 DIADLO COCc1cnc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccc(C)o2)s1 ZINC000342924499 1039015189 /nfs/dbraw/zinc/01/51/89/1039015189.db2.gz FGLRSLXKZVCDOB-DOMZBBRYSA-N 1 2 320.458 4.164 20 0 DIADLO COCc1cnc(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccc(C)o2)s1 ZINC000342924499 1039015205 /nfs/dbraw/zinc/01/52/05/1039015205.db2.gz FGLRSLXKZVCDOB-DOMZBBRYSA-N 1 2 320.458 4.164 20 0 DIADLO C[C@@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)c1cscn1 ZINC000534329624 1039029758 /nfs/dbraw/zinc/02/97/58/1039029758.db2.gz REZWGTZBEBEVDO-ZYHUDNBSSA-N 1 2 300.349 4.487 20 0 DIADLO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@H](C)c1nc(C)cs1 ZINC000091318670 1039041080 /nfs/dbraw/zinc/04/10/80/1039041080.db2.gz GAXNBJGSCRTXIG-CHWSQXEVSA-N 1 2 314.458 4.233 20 0 DIADLO CO[C@H](CCNc1cc[nH+]c2c(Cl)cccc12)C(F)(F)F ZINC000342968686 1039064306 /nfs/dbraw/zinc/06/43/06/1039064306.db2.gz ZTCIJHAEZRQVPR-GFCCVEGCSA-N 1 2 318.726 4.268 20 0 DIADLO Cc1cc(C)c(CNC(=O)[C@H](CC(C)C)c2ccccc2)c[nH+]1 ZINC000456844694 1039083416 /nfs/dbraw/zinc/08/34/16/1039083416.db2.gz RPWGVQANKRIMCE-LJQANCHMSA-N 1 2 310.441 4.145 20 0 DIADLO Cc1cc(C)c(CNC(=O)[C@@H](CC(C)C)c2ccccc2)c[nH+]1 ZINC000456844693 1039083497 /nfs/dbraw/zinc/08/34/97/1039083497.db2.gz RPWGVQANKRIMCE-IBGZPJMESA-N 1 2 310.441 4.145 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000728539905 1039105962 /nfs/dbraw/zinc/10/59/62/1039105962.db2.gz ZRGIQQIPZIQCPN-DLBZAZTESA-N 1 2 305.466 4.043 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2ccccc2Br)s1 ZINC000122889429 1039127347 /nfs/dbraw/zinc/12/73/47/1039127347.db2.gz NAXORBSUCGPKBJ-JTQLQIEISA-N 1 2 311.248 4.065 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H]2CCCC2(F)F)ccc1SC ZINC000672621931 1039129456 /nfs/dbraw/zinc/12/94/56/1039129456.db2.gz OQAAQUYGPMHYGE-IINYFYTJSA-N 1 2 301.402 4.256 20 0 DIADLO Cc1ccccc1C[N@@H+]1CCC[C@@H]1c1nnc(-c2ccccc2)[nH]1 ZINC000535316510 1039187189 /nfs/dbraw/zinc/18/71/89/1039187189.db2.gz ITLZZJFGSUYURP-GOSISDBHSA-N 1 2 318.424 4.117 20 0 DIADLO Cc1ccccc1C[N@H+]1CCC[C@@H]1c1nnc(-c2ccccc2)[nH]1 ZINC000535316510 1039187201 /nfs/dbraw/zinc/18/72/01/1039187201.db2.gz ITLZZJFGSUYURP-GOSISDBHSA-N 1 2 318.424 4.117 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1Cl)[N@H+]1CC=C(C(C)(C)C)CC1 ZINC000535405775 1039202416 /nfs/dbraw/zinc/20/24/16/1039202416.db2.gz JMBFHZBMEQHXCL-CYBMUJFWSA-N 1 2 320.864 4.345 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1Cl)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000535405775 1039202426 /nfs/dbraw/zinc/20/24/26/1039202426.db2.gz JMBFHZBMEQHXCL-CYBMUJFWSA-N 1 2 320.864 4.345 20 0 DIADLO CCc1cc(OCc2nc(-c3ccoc3)no2)c2ccccc2[nH+]1 ZINC000092333996 1039241996 /nfs/dbraw/zinc/24/19/96/1039241996.db2.gz GYUCEWBSLFVYCH-UHFFFAOYSA-N 1 2 321.336 4.019 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)ccc2OC(F)F)on1 ZINC000125657849 1039264183 /nfs/dbraw/zinc/26/41/83/1039264183.db2.gz ZDZLMFMGGYSWRB-VIFPVBQESA-N 1 2 316.735 4.089 20 0 DIADLO CC[C@H]([NH2+]Cc1csc(C)n1)c1cc(Cl)ccc1OC ZINC000126551632 1039277785 /nfs/dbraw/zinc/27/77/85/1039277785.db2.gz BIFBSLTYBSZXDK-AWEZNQCLSA-N 1 2 310.850 4.354 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3cncc(-c4ccccn4)c3)cc2)[nH]1 ZINC001213088084 1039293239 /nfs/dbraw/zinc/29/32/39/1039293239.db2.gz ORIVOFRVPWSMRS-UHFFFAOYSA-N 1 2 313.364 4.277 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc3ccccc32)o1 ZINC000007974982 1039297703 /nfs/dbraw/zinc/29/77/03/1039297703.db2.gz WOAFZRZJVVTQPZ-OAHLLOKOSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc3ccccc32)o1 ZINC000007974982 1039297715 /nfs/dbraw/zinc/29/77/15/1039297715.db2.gz WOAFZRZJVVTQPZ-OAHLLOKOSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1ccc(-c2nn(C[N@@H+]3CCC[C@@H]3C3CC3)c(=S)o2)cc1 ZINC000728563880 1039304596 /nfs/dbraw/zinc/30/45/96/1039304596.db2.gz WGYKJSFWGWRGJF-OAHLLOKOSA-N 1 2 315.442 4.013 20 0 DIADLO Cc1ccc(-c2nn(C[N@H+]3CCC[C@@H]3C3CC3)c(=S)o2)cc1 ZINC000728563880 1039304613 /nfs/dbraw/zinc/30/46/13/1039304613.db2.gz WGYKJSFWGWRGJF-OAHLLOKOSA-N 1 2 315.442 4.013 20 0 DIADLO Clc1cnc(COc2ccccc2-n2cc[nH+]c2)c(Cl)c1 ZINC000539638552 1039307100 /nfs/dbraw/zinc/30/71/00/1039307100.db2.gz UFRWKFFTPFQMHT-UHFFFAOYSA-N 1 2 320.179 4.153 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1cc2n(n1)CCCC2)c1ccc(F)cc1F ZINC000647289867 1039308881 /nfs/dbraw/zinc/30/88/81/1039308881.db2.gz MKDHLRCAOKQZFU-YVEFUNNKSA-N 1 2 319.399 4.300 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1cc2n(n1)CCCC2)c1ccc(F)cc1F ZINC000647289864 1039308999 /nfs/dbraw/zinc/30/89/99/1039308999.db2.gz MKDHLRCAOKQZFU-PXAZEXFGSA-N 1 2 319.399 4.300 20 0 DIADLO Fc1ccc(F)c2c1CC[C@@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000539657934 1039313589 /nfs/dbraw/zinc/31/35/89/1039313589.db2.gz FSCAFJKJZPAHGO-INIZCTEOSA-N 1 2 315.367 4.059 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+](C)Cc2cccc(F)c2)o1 ZINC000536020189 1039322245 /nfs/dbraw/zinc/32/22/45/1039322245.db2.gz QBUPMGPIUSLGFD-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+](C)Cc2cccc(F)c2)o1 ZINC000536020189 1039322261 /nfs/dbraw/zinc/32/22/61/1039322261.db2.gz QBUPMGPIUSLGFD-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO O=C(c1ccc(-n2cc[nH+]c2)cc1)N1CCC[C@@H]1C1CCCCC1 ZINC000080375794 1039327092 /nfs/dbraw/zinc/32/70/92/1039327092.db2.gz YXEBFGAAAGHNME-LJQANCHMSA-N 1 2 323.440 4.057 20 0 DIADLO COc1cc(C)[nH+]c(CN(Cc2ccco2)c2ccccc2)c1 ZINC000536042234 1039339661 /nfs/dbraw/zinc/33/96/61/1039339661.db2.gz UUKQSMRVVULDDG-UHFFFAOYSA-N 1 2 308.381 4.198 20 0 DIADLO CCn1cc(C[N@H+](C)Cc2cnc(C3CCCCC3)s2)cn1 ZINC000539826540 1039353554 /nfs/dbraw/zinc/35/35/54/1039353554.db2.gz TWSSHVSJUPVWOM-UHFFFAOYSA-N 1 2 318.490 4.039 20 0 DIADLO CCn1cc(C[N@@H+](C)Cc2cnc(C3CCCCC3)s2)cn1 ZINC000539826540 1039353574 /nfs/dbraw/zinc/35/35/74/1039353574.db2.gz TWSSHVSJUPVWOM-UHFFFAOYSA-N 1 2 318.490 4.039 20 0 DIADLO Cc1cc(Br)c(C[NH2+][C@@H](C)c2cscn2)s1 ZINC000583511267 1039356106 /nfs/dbraw/zinc/35/61/06/1039356106.db2.gz WHYLZBOZNYZCHJ-QMMMGPOBSA-N 1 2 317.277 4.126 20 0 DIADLO C[N@H+](C/C=C\c1ccc(F)cc1)Cc1nc2c(s1)CCCC2 ZINC000539830472 1039358259 /nfs/dbraw/zinc/35/82/59/1039358259.db2.gz YEMVRBIGXWKKLI-PLNGDYQASA-N 1 2 316.445 4.306 20 0 DIADLO C[N@@H+](C/C=C\c1ccc(F)cc1)Cc1nc2c(s1)CCCC2 ZINC000539830472 1039358271 /nfs/dbraw/zinc/35/82/71/1039358271.db2.gz YEMVRBIGXWKKLI-PLNGDYQASA-N 1 2 316.445 4.306 20 0 DIADLO CCCOc1cccc(C[N@@H+]2CCO[C@H](c3ccsc3)C2)c1 ZINC000539851012 1039375221 /nfs/dbraw/zinc/37/52/21/1039375221.db2.gz JVZFHTKNZMNVOM-SFHVURJKSA-N 1 2 317.454 4.110 20 0 DIADLO CCCOc1cccc(C[N@H+]2CCO[C@H](c3ccsc3)C2)c1 ZINC000539851012 1039375234 /nfs/dbraw/zinc/37/52/34/1039375234.db2.gz JVZFHTKNZMNVOM-SFHVURJKSA-N 1 2 317.454 4.110 20 0 DIADLO C[C@@]1(C(=O)Oc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C=CCC1 ZINC001272319003 1039386426 /nfs/dbraw/zinc/38/64/26/1039386426.db2.gz ADXCBQRCAJNSBV-HXUWFJFHSA-N 1 2 322.408 4.148 20 0 DIADLO Cc1nc(N[C@@H](C)c2ccc(Oc3ccccc3)cc2)cc[nH+]1 ZINC000462809744 1039397692 /nfs/dbraw/zinc/39/76/92/1039397692.db2.gz YFJKNIHBHPBZKQ-AWEZNQCLSA-N 1 2 305.381 4.750 20 0 DIADLO C[C@@H]([NH2+][C@H](C(=O)Nc1ccccc1)c1ccccc1)c1ccco1 ZINC000540175557 1039440020 /nfs/dbraw/zinc/44/00/20/1039440020.db2.gz KBPDISHAFNLIGA-BEFAXECRSA-N 1 2 320.392 4.310 20 0 DIADLO Cc1cc(C)c(CC(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(C)c1 ZINC000540207274 1039457520 /nfs/dbraw/zinc/45/75/20/1039457520.db2.gz JQPZQGABMJMHGD-UHFFFAOYSA-N 1 2 319.408 4.183 20 0 DIADLO COc1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c2ccncc12 ZINC001213090767 1039475155 /nfs/dbraw/zinc/47/51/55/1039475155.db2.gz FNYOFWXGHWKRCD-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)Cc1c(Cl)ccc2cccnc21 ZINC000052612678 1039476944 /nfs/dbraw/zinc/47/69/44/1039476944.db2.gz LPTCJGGDFWYOCJ-UHFFFAOYSA-N 1 2 315.804 4.125 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)Cc1c(Cl)ccc2cccnc21 ZINC000052612678 1039476949 /nfs/dbraw/zinc/47/69/49/1039476949.db2.gz LPTCJGGDFWYOCJ-UHFFFAOYSA-N 1 2 315.804 4.125 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)no1)c1cccc(F)c1F ZINC000540426167 1039490960 /nfs/dbraw/zinc/49/09/60/1039490960.db2.gz BUNNJZDRNZNXLM-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc(Cl)c1F ZINC000151236779 1039524142 /nfs/dbraw/zinc/52/41/42/1039524142.db2.gz ISUDMHWBYYSBHQ-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1cc(C(C)(C)C)on1)CCC2 ZINC000278531397 1039529565 /nfs/dbraw/zinc/52/95/65/1039529565.db2.gz FDPSABOOXLIZLJ-CQSZACIVSA-N 1 2 319.474 4.246 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1cc(C(C)(C)C)on1)CCC2 ZINC000278531397 1039529583 /nfs/dbraw/zinc/52/95/83/1039529583.db2.gz FDPSABOOXLIZLJ-CQSZACIVSA-N 1 2 319.474 4.246 20 0 DIADLO CC(C)[C@]1(C)C[C@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000685242864 1039530428 /nfs/dbraw/zinc/53/04/28/1039530428.db2.gz GCPVEMAZDFBQDD-LPHOPBHVSA-N 1 2 322.412 4.131 20 0 DIADLO C[C@@H]([NH2+]Cc1csnn1)c1ccc(-c2ccc(F)cc2)cc1 ZINC000540627663 1039532574 /nfs/dbraw/zinc/53/25/74/1039532574.db2.gz FUETUYCYDCIPRP-GFCCVEGCSA-N 1 2 313.401 4.195 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2cccc(OCc3ccccc3)c2)o1 ZINC000278561808 1039550464 /nfs/dbraw/zinc/55/04/64/1039550464.db2.gz BMLCJTDYZWZUTB-INIZCTEOSA-N 1 2 322.408 4.413 20 0 DIADLO CCC(CC)n1ccc(CSCc2cc(OC)cc(C)[nH+]2)n1 ZINC000540725609 1039554831 /nfs/dbraw/zinc/55/48/31/1039554831.db2.gz DEMDOJUWIISEOO-UHFFFAOYSA-N 1 2 319.474 4.390 20 0 DIADLO CCN(CC)c1ccc(N[C@@H](C)c2ccc3c(c2)COC3)c[nH+]1 ZINC000540758930 1039559840 /nfs/dbraw/zinc/55/98/40/1039559840.db2.gz OTABVRGMXFPDMS-AWEZNQCLSA-N 1 2 311.429 4.131 20 0 DIADLO Cc1oc2ccc(NC(=O)NCc3cc(C)[nH+]c(C)c3)cc2c1C ZINC000584225252 1039644921 /nfs/dbraw/zinc/64/49/21/1039644921.db2.gz BTBAWHCXVJAIES-UHFFFAOYSA-N 1 2 323.396 4.383 20 0 DIADLO COc1cccc([C@H](C)[NH2+]Cc2ncc(C(F)(F)F)s2)c1 ZINC000278717670 1039672884 /nfs/dbraw/zinc/67/28/84/1039672884.db2.gz SNYAQYPDVHLHCS-VIFPVBQESA-N 1 2 316.348 4.021 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+]1CCOCC2(CC2)C1 ZINC000542059513 1039788503 /nfs/dbraw/zinc/78/85/03/1039788503.db2.gz OHHBFXATJVWVNT-LLVKDONJSA-N 1 2 300.229 4.167 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@H+]1CCOCC2(CC2)C1 ZINC000542059513 1039788522 /nfs/dbraw/zinc/78/85/22/1039788522.db2.gz OHHBFXATJVWVNT-LLVKDONJSA-N 1 2 300.229 4.167 20 0 DIADLO c1cn(CCCC2CCN(c3ccc4ccccc4n3)CC2)c[nH+]1 ZINC000542118712 1039795746 /nfs/dbraw/zinc/79/57/46/1039795746.db2.gz YMRUKTQQMZXEJE-UHFFFAOYSA-N 1 2 320.440 4.128 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@H](C)c2ccc(F)cn2)c2ccccn2)c1 ZINC000090946511 1039807015 /nfs/dbraw/zinc/80/70/15/1039807015.db2.gz NWWYEJUAGKXCSC-QRWLVFNGSA-N 1 2 321.399 4.364 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2ncccc2F)c2ccccc2)cc1 ZINC000090722090 1039817009 /nfs/dbraw/zinc/81/70/09/1039817009.db2.gz SJEARZXXZOMEDS-IBGZPJMESA-N 1 2 310.347 4.239 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cccc(-c3ccncc3)c2)s1 ZINC000093807621 1039903054 /nfs/dbraw/zinc/90/30/54/1039903054.db2.gz VQJFPNMQSCKMRV-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cccc(-c3ccncc3)c2)s1 ZINC000093807621 1039903064 /nfs/dbraw/zinc/90/30/64/1039903064.db2.gz VQJFPNMQSCKMRV-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO Oc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)c(C(F)(F)F)c1 ZINC001205087543 1039934897 /nfs/dbraw/zinc/93/48/97/1039934897.db2.gz UFNIBLZAJGNCBS-UHFFFAOYSA-N 1 2 304.271 4.264 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nc(CCC(C)C)no2)cc1 ZINC000142822412 1039941221 /nfs/dbraw/zinc/94/12/21/1039941221.db2.gz BEBODHOYFZDIFA-OAHLLOKOSA-N 1 2 301.434 4.160 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2nc(CCC(C)C)no2)cc1 ZINC000142822412 1039941235 /nfs/dbraw/zinc/94/12/35/1039941235.db2.gz BEBODHOYFZDIFA-OAHLLOKOSA-N 1 2 301.434 4.160 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccn(C)n1)c1cc(Cl)cc(Cl)c1F ZINC000926577636 1039986810 /nfs/dbraw/zinc/98/68/10/1039986810.db2.gz RZKOWPQVBKTFNS-BDAKNGLRSA-N 1 2 316.207 4.278 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc(-c3ccc(F)cc3)no2)[C@@H]1c1ccccc1 ZINC000174986234 1039999134 /nfs/dbraw/zinc/99/91/34/1039999134.db2.gz IWCBXPZQXRUIQG-ACJLOTCBSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc(-c3ccc(F)cc3)no2)[C@@H]1c1ccccc1 ZINC000174986234 1039999147 /nfs/dbraw/zinc/99/91/47/1039999147.db2.gz IWCBXPZQXRUIQG-ACJLOTCBSA-N 1 2 323.371 4.069 20 0 DIADLO CCCc1nc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)cs1 ZINC000175136454 1040008757 /nfs/dbraw/zinc/00/87/57/1040008757.db2.gz AYLACDVTNZCWOE-MRXNPFEDSA-N 1 2 303.475 4.161 20 0 DIADLO CCCc1nc(C[N@H+]2CCCC[C@@H]2c2cccn2C)cs1 ZINC000175136454 1040008775 /nfs/dbraw/zinc/00/87/75/1040008775.db2.gz AYLACDVTNZCWOE-MRXNPFEDSA-N 1 2 303.475 4.161 20 0 DIADLO Brc1cscc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000685410444 1040033226 /nfs/dbraw/zinc/03/32/26/1040033226.db2.gz HITVXUCXPINDNJ-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cscc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000685410444 1040033238 /nfs/dbraw/zinc/03/32/38/1040033238.db2.gz HITVXUCXPINDNJ-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@H+](C)Cc1noc(C2CC2)n1 ZINC000175438980 1040034634 /nfs/dbraw/zinc/03/46/34/1040034634.db2.gz RDXOAEHBCWPKAZ-NWDGAFQWSA-N 1 2 319.836 4.224 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000175438980 1040034653 /nfs/dbraw/zinc/03/46/53/1040034653.db2.gz RDXOAEHBCWPKAZ-NWDGAFQWSA-N 1 2 319.836 4.224 20 0 DIADLO C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@H+](C)Cc1noc(C2CC2)n1 ZINC000175438961 1040035103 /nfs/dbraw/zinc/03/51/03/1040035103.db2.gz RDXOAEHBCWPKAZ-VXGBXAGGSA-N 1 2 319.836 4.224 20 0 DIADLO C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000175438961 1040035120 /nfs/dbraw/zinc/03/51/20/1040035120.db2.gz RDXOAEHBCWPKAZ-VXGBXAGGSA-N 1 2 319.836 4.224 20 0 DIADLO CC(C)(C)n1cc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)cn1 ZINC000685473606 1040069710 /nfs/dbraw/zinc/06/97/10/1040069710.db2.gz UMBAENAXPBMMSS-OAHLLOKOSA-N 1 2 303.475 4.283 20 0 DIADLO CC(C)(C)n1cc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)cn1 ZINC000685473606 1040069726 /nfs/dbraw/zinc/06/97/26/1040069726.db2.gz UMBAENAXPBMMSS-OAHLLOKOSA-N 1 2 303.475 4.283 20 0 DIADLO Cc1oc2ccccc2c1[C@@H](C)[NH2+]Cc1nnc(C2CC2)s1 ZINC000926596175 1040101593 /nfs/dbraw/zinc/10/15/93/1040101593.db2.gz LESDOXDLMXFGDH-SNVBAGLBSA-N 1 2 313.426 4.321 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)c2cc3ccccc3o2)c(C)[nH+]1 ZINC000177576953 1040127552 /nfs/dbraw/zinc/12/75/52/1040127552.db2.gz MVOHBPGLPSBCOE-CYBMUJFWSA-N 1 2 308.381 4.495 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)cc1 ZINC000685570799 1040139420 /nfs/dbraw/zinc/13/94/20/1040139420.db2.gz FAWZQQNQJNPEBT-CYBMUJFWSA-N 1 2 302.418 4.222 20 0 DIADLO C/C(=C/c1ccccc1OC(F)F)C[NH2+][C@H]1CCCC1(F)F ZINC000685623520 1040167212 /nfs/dbraw/zinc/16/72/12/1040167212.db2.gz MSDZZEJRIAFEBP-FPAJZGIOSA-N 1 2 317.326 4.469 20 0 DIADLO C[C@@H]([NH2+]Cc1cocn1)c1ccc(-c2c(F)cccc2F)cc1 ZINC000685652796 1040189585 /nfs/dbraw/zinc/18/95/85/1040189585.db2.gz WGXFEEBUMVPMIJ-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1nccc2ccccc21 ZINC000685654844 1040191633 /nfs/dbraw/zinc/19/16/33/1040191633.db2.gz QYVHDXJWALREKV-NWDGAFQWSA-N 1 2 313.351 4.320 20 0 DIADLO C[C@H]1CC[C@@](C)(C[NH2+][C@H](c2cccs2)c2nnc[nH]2)C1(C)C ZINC000658128411 1040324884 /nfs/dbraw/zinc/32/48/84/1040324884.db2.gz UXDCQTBJKCUMSP-QEORTHHSSA-N 1 2 318.490 4.008 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2cc(Cl)cc(Cl)c21)c1nccn1C ZINC000658336183 1040426709 /nfs/dbraw/zinc/42/67/09/1040426709.db2.gz OTUHXQIJFOZCGU-RNCFNFMXSA-N 1 2 310.228 4.065 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@@H](C)O)cs1 ZINC000658359794 1040441721 /nfs/dbraw/zinc/44/17/21/1040441721.db2.gz HVRKGZAMFHOMKF-WOSRLPQWSA-N 1 2 304.459 4.039 20 0 DIADLO Cc1noc(C)c1C[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC000101919786 1040466147 /nfs/dbraw/zinc/46/61/47/1040466147.db2.gz UZPQQHPDYDYQHI-UHFFFAOYSA-N 1 2 304.393 4.474 20 0 DIADLO FC(F)(F)c1nc(C[NH2+]Cc2cccc(Cl)c2)cs1 ZINC000892450925 1040475782 /nfs/dbraw/zinc/47/57/82/1040475782.db2.gz KIWDNGXDPAJLIS-UHFFFAOYSA-N 1 2 306.740 4.105 20 0 DIADLO COCOc1ccc(Nc2cc[nH+]c3ccc(Cl)cc23)cc1 ZINC001211630633 1040478219 /nfs/dbraw/zinc/47/82/19/1040478219.db2.gz ANTFQPOOXHKNCA-UHFFFAOYSA-N 1 2 314.772 4.036 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1cc(C(C)(C)C)on1)C(C)C ZINC000278784244 1040517476 /nfs/dbraw/zinc/51/74/76/1040517476.db2.gz ZRBWOXSMQLMLOQ-INIZCTEOSA-N 1 2 301.434 4.162 20 0 DIADLO FC(F)(F)c1nc(C[NH2+]Cc2ccc(Cl)cc2)cs1 ZINC000892476381 1040524770 /nfs/dbraw/zinc/52/47/70/1040524770.db2.gz SHAJFWUNNHPWIE-UHFFFAOYSA-N 1 2 306.740 4.105 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]C2(c3ccccc3Cl)CCC2)nn1 ZINC000926643426 1040537856 /nfs/dbraw/zinc/53/78/56/1040537856.db2.gz SSJYZWSLTQPNBZ-ZDUSSCGKSA-N 1 2 318.852 4.242 20 0 DIADLO COc1ccsc1C[NH2+][C@H](C)c1nc(C(F)(F)F)cs1 ZINC000278790396 1040558224 /nfs/dbraw/zinc/55/82/24/1040558224.db2.gz QLDDOFQBGMWKMP-SSDOTTSWSA-N 1 2 322.377 4.083 20 0 DIADLO Cc1cc(C)c(NC(=O)CO[C@H]2CCCc3ccccc32)c(C)[nH+]1 ZINC000569884285 1040570672 /nfs/dbraw/zinc/57/06/72/1040570672.db2.gz UNYYVNKISTYMKK-SFHVURJKSA-N 1 2 324.424 4.040 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000448345526 1040783212 /nfs/dbraw/zinc/78/32/12/1040783212.db2.gz UCZQWKXNMGIJIE-GFCCVEGCSA-N 1 2 304.459 4.339 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000448345526 1040783229 /nfs/dbraw/zinc/78/32/29/1040783229.db2.gz UCZQWKXNMGIJIE-GFCCVEGCSA-N 1 2 304.459 4.339 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000613409580 1040924375 /nfs/dbraw/zinc/92/43/75/1040924375.db2.gz URMVHSULDPAKCH-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000613409580 1040924395 /nfs/dbraw/zinc/92/43/95/1040924395.db2.gz URMVHSULDPAKCH-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C=Cc1cc(Cl)cc(Cl)c1 ZINC001625884891 1040973263 /nfs/dbraw/zinc/97/32/63/1040973263.db2.gz VYBKVJRFHPGQKY-ONEGZZNKSA-N 1 2 321.207 4.079 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)o1 ZINC000171137056 1041024119 /nfs/dbraw/zinc/02/41/19/1041024119.db2.gz AUJLEEPLKDYQCY-HNNXBMFYSA-N 1 2 305.809 4.087 20 0 DIADLO CCCc1ccc([C@@H](C)[NH2+]Cc2nccc(C(F)(F)F)n2)cc1 ZINC000414230646 1041029525 /nfs/dbraw/zinc/02/95/25/1041029525.db2.gz BFHWJKGKJNPQRK-GFCCVEGCSA-N 1 2 323.362 4.299 20 0 DIADLO CC1(C)C[C@H]([NH2+]Cc2nccc(C(F)(F)F)n2)c2ccccc21 ZINC000414237662 1041040657 /nfs/dbraw/zinc/04/06/57/1041040657.db2.gz JHZBKAZFGOZKRQ-ZDUSSCGKSA-N 1 2 321.346 4.008 20 0 DIADLO CC(C)CC[C@@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccoc1 ZINC000414335062 1041141751 /nfs/dbraw/zinc/14/17/51/1041141751.db2.gz XUEYURRIMBWRNF-CQSZACIVSA-N 1 2 305.447 4.276 20 0 DIADLO Cc1occc1C[NH2+]Cc1csc(CCc2ccccc2)n1 ZINC000414359136 1041169293 /nfs/dbraw/zinc/16/92/93/1041169293.db2.gz DGQBWSOGEUTEFR-UHFFFAOYSA-N 1 2 312.438 4.120 20 0 DIADLO Fc1ccc(Br)c2[nH+]ccc(N3CCC4(CC4)C3)c12 ZINC000685918783 1041169566 /nfs/dbraw/zinc/16/95/66/1041169566.db2.gz ONAFSPLBKDROMD-UHFFFAOYSA-N 1 2 321.193 4.127 20 0 DIADLO Fc1cccc(CC[N@H+](Cc2csc(Cl)n2)C2CC2)c1 ZINC000809574330 1041186607 /nfs/dbraw/zinc/18/66/07/1041186607.db2.gz JHUXTXBNRCDBNM-UHFFFAOYSA-N 1 2 310.825 4.143 20 0 DIADLO Fc1cccc(CC[N@@H+](Cc2csc(Cl)n2)C2CC2)c1 ZINC000809574330 1041186615 /nfs/dbraw/zinc/18/66/15/1041186615.db2.gz JHUXTXBNRCDBNM-UHFFFAOYSA-N 1 2 310.825 4.143 20 0 DIADLO Cc1cc(C[N@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)ccc1F ZINC000539850542 1041187626 /nfs/dbraw/zinc/18/76/26/1041187626.db2.gz TZVHAHJRLOYTFI-SUMWQHHRSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1cc(C[N@@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)ccc1F ZINC000539850542 1041187636 /nfs/dbraw/zinc/18/76/36/1041187636.db2.gz TZVHAHJRLOYTFI-SUMWQHHRSA-N 1 2 305.418 4.158 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+][C@@H]1CCCc2oc(C)nc21 ZINC000924582484 1041217922 /nfs/dbraw/zinc/21/79/22/1041217922.db2.gz RJIDIGNUCFHAQY-SWLSCSKDSA-N 1 2 300.402 4.028 20 0 DIADLO Fc1ccc(NCc2nccc3ccccc32)cc1-n1cc[nH+]c1 ZINC001167704222 1041218559 /nfs/dbraw/zinc/21/85/59/1041218559.db2.gz GIXPZTQVJBHNCO-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000176896327 1041218968 /nfs/dbraw/zinc/21/89/68/1041218968.db2.gz PKGQBXBOGZICHT-AWEZNQCLSA-N 1 2 303.475 4.116 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000176896327 1041218988 /nfs/dbraw/zinc/21/89/88/1041218988.db2.gz PKGQBXBOGZICHT-AWEZNQCLSA-N 1 2 303.475 4.116 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2nccs2)ccc1C(F)(F)F ZINC000414392759 1041226060 /nfs/dbraw/zinc/22/60/60/1041226060.db2.gz FFDRBGWQQNUFJU-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2nccs2)ccc1C(F)(F)F ZINC000414392759 1041226079 /nfs/dbraw/zinc/22/60/79/1041226079.db2.gz FFDRBGWQQNUFJU-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO CC(C)(C)[C@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc(F)cc1 ZINC000375894961 1041227213 /nfs/dbraw/zinc/22/72/13/1041227213.db2.gz IBZHQRXWOMZILJ-DOTOQJQBSA-N 1 2 301.409 4.303 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)c2ccccc12)c1ccc(F)cc1Cl ZINC000605592279 1041261983 /nfs/dbraw/zinc/26/19/83/1041261983.db2.gz JZHAFTOESQJGLQ-LLVKDONJSA-N 1 2 317.795 4.217 20 0 DIADLO CCCCOc1ccc([C@H](C)Nc2cccc[nH+]2)cc1OC ZINC000613546686 1041263867 /nfs/dbraw/zinc/26/38/67/1041263867.db2.gz LGXBKGFAUCUFRN-AWEZNQCLSA-N 1 2 300.402 4.442 20 0 DIADLO Cl/C=C(\Cl)C[N@@H+]1CC[C@H](Oc2ccc(Cl)cc2)C1 ZINC001170594944 1041298764 /nfs/dbraw/zinc/29/87/64/1041298764.db2.gz ZGRMENSAQSCEBQ-YLBKJLTLSA-N 1 2 306.620 4.112 20 0 DIADLO Cl/C=C(\Cl)C[N@H+]1CC[C@H](Oc2ccc(Cl)cc2)C1 ZINC001170594944 1041298776 /nfs/dbraw/zinc/29/87/76/1041298776.db2.gz ZGRMENSAQSCEBQ-YLBKJLTLSA-N 1 2 306.620 4.112 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cccc(Cl)c2F)c(OC)c1 ZINC001137962311 1041308970 /nfs/dbraw/zinc/30/89/70/1041308970.db2.gz AQZLETQLKXGSKK-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cccc(Cl)c2F)c(OC)c1 ZINC001137962311 1041308978 /nfs/dbraw/zinc/30/89/78/1041308978.db2.gz AQZLETQLKXGSKK-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO C[C@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1cnn(C2CCC2)c1 ZINC000926810643 1041311325 /nfs/dbraw/zinc/31/13/25/1041311325.db2.gz UNEJWOKCCNSMEV-YVEFUNNKSA-N 1 2 305.372 4.109 20 0 DIADLO CCCCCCOc1cc(C)ccc1C[NH2+]Cc1[nH]ncc1C ZINC000810147850 1041324877 /nfs/dbraw/zinc/32/48/77/1041324877.db2.gz LQINBBORRSMCIG-UHFFFAOYSA-N 1 2 315.461 4.275 20 0 DIADLO CCCCCCOc1cc(C)ccc1C[NH2+]Cc1n[nH]cc1C ZINC000810147850 1041324892 /nfs/dbraw/zinc/32/48/92/1041324892.db2.gz LQINBBORRSMCIG-UHFFFAOYSA-N 1 2 315.461 4.275 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C3(F)CCCCC3)c2)[nH+]c1C ZINC000810197112 1041335909 /nfs/dbraw/zinc/33/59/09/1041335909.db2.gz UTWMFYHZCSDICC-UHFFFAOYSA-N 1 2 315.392 4.304 20 0 DIADLO CC(C)(C)[C@@H]([NH2+]Cc1nc(C(F)F)no1)c1cccc(F)c1 ZINC000425465048 1041345075 /nfs/dbraw/zinc/34/50/75/1041345075.db2.gz YTJQWDOBVLYREO-LBPRGKRZSA-N 1 2 313.323 4.023 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1CC(=O)Nc1cccc(Cl)c1Cl ZINC000009997666 1041356767 /nfs/dbraw/zinc/35/67/67/1041356767.db2.gz LQDBWJXCDNVYMI-PHIMTYICSA-N 1 2 315.244 4.195 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1CC(=O)Nc1cccc(Cl)c1Cl ZINC000009997666 1041356779 /nfs/dbraw/zinc/35/67/79/1041356779.db2.gz LQDBWJXCDNVYMI-PHIMTYICSA-N 1 2 315.244 4.195 20 0 DIADLO CCCCCC[C@@H](CC)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001170602149 1041359878 /nfs/dbraw/zinc/35/98/78/1041359878.db2.gz WTWJVGHGVHPPTE-CYBMUJFWSA-N 1 2 317.399 4.467 20 0 DIADLO CCCCCC[C@@H](CC)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001170602149 1041359891 /nfs/dbraw/zinc/35/98/91/1041359891.db2.gz WTWJVGHGVHPPTE-CYBMUJFWSA-N 1 2 317.399 4.467 20 0 DIADLO C[N@H+](Cc1ncsc1Br)C1CCCCCC1 ZINC000659815700 1041375645 /nfs/dbraw/zinc/37/56/45/1041375645.db2.gz IWFAOZCNPBIASX-UHFFFAOYSA-N 1 2 303.269 4.060 20 0 DIADLO C[N@@H+](Cc1ncsc1Br)C1CCCCCC1 ZINC000659815700 1041375647 /nfs/dbraw/zinc/37/56/47/1041375647.db2.gz IWFAOZCNPBIASX-UHFFFAOYSA-N 1 2 303.269 4.060 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)nc(C)n1 ZINC000659826912 1041381198 /nfs/dbraw/zinc/38/11/98/1041381198.db2.gz LHKAWWMMSVBSSX-MRXNPFEDSA-N 1 2 324.453 4.040 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)nc(C)n1 ZINC000659826912 1041381211 /nfs/dbraw/zinc/38/12/11/1041381211.db2.gz LHKAWWMMSVBSSX-MRXNPFEDSA-N 1 2 324.453 4.040 20 0 DIADLO Cc1nc(C[NH+](Cc2ccccc2)Cc2ccccc2)c(C)o1 ZINC000659827584 1041381268 /nfs/dbraw/zinc/38/12/68/1041381268.db2.gz SDOWCXKOJJKUBE-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO COc1cc(C[N@H+](C)Cc2ccc(Cl)c(Cl)c2)sn1 ZINC000659829684 1041382571 /nfs/dbraw/zinc/38/25/71/1041382571.db2.gz AJBMUFFUZGXCRS-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)sn1 ZINC000659829684 1041382584 /nfs/dbraw/zinc/38/25/84/1041382584.db2.gz AJBMUFFUZGXCRS-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@H](C)c1ccccc1OC(F)F ZINC000924603061 1041395805 /nfs/dbraw/zinc/39/58/05/1041395805.db2.gz ZRLFBEHZZRYSDE-ZWNOBZJWSA-N 1 2 322.355 4.313 20 0 DIADLO Oc1ccc(Cl)c(C[NH2+][C@@H]2CCCc3c(Cl)ccnc32)c1 ZINC000926854360 1041411738 /nfs/dbraw/zinc/41/17/38/1041411738.db2.gz HJKUJEWZSOBNIV-OAHLLOKOSA-N 1 2 323.223 4.261 20 0 DIADLO CCOc1ccc(F)c(F)c1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC001143493811 1041418159 /nfs/dbraw/zinc/41/81/59/1041418159.db2.gz LSCUAPIMLCUHFJ-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(F)c(F)c1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC001143493811 1041418167 /nfs/dbraw/zinc/41/81/67/1041418167.db2.gz LSCUAPIMLCUHFJ-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1csc(C(F)(F)F)n1)CC2 ZINC000892921517 1041420877 /nfs/dbraw/zinc/42/08/77/1041420877.db2.gz UWWHTURJTFZLHP-GFCCVEGCSA-N 1 2 316.323 4.078 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(C2CC2)n1)c1ccc(-c2cccnc2)cc1 ZINC000747621924 1041421245 /nfs/dbraw/zinc/42/12/45/1041421245.db2.gz APEBNHXFJBASCY-CQSZACIVSA-N 1 2 319.408 4.465 20 0 DIADLO CC(C)(C)c1csc(C[NH2+]Cc2cc(O)cc(Cl)c2)n1 ZINC000892930563 1041422549 /nfs/dbraw/zinc/42/25/49/1041422549.db2.gz ZLVCICKJXQWMJB-UHFFFAOYSA-N 1 2 310.850 4.089 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccc(Br)cn1 ZINC000695221564 1041430931 /nfs/dbraw/zinc/43/09/31/1041430931.db2.gz QQDCDCKMXKHTJM-LLVKDONJSA-N 1 2 320.234 4.083 20 0 DIADLO CC1CCC([N@H+](Cc2nnc(C(F)(F)F)s2)C2CC2)CC1 ZINC000659847516 1041440915 /nfs/dbraw/zinc/44/09/15/1041440915.db2.gz YQYOBQIAMGGFME-UHFFFAOYSA-N 1 2 319.396 4.100 20 0 DIADLO CC1CCC([N@@H+](Cc2nnc(C(F)(F)F)s2)C2CC2)CC1 ZINC000659847516 1041440919 /nfs/dbraw/zinc/44/09/19/1041440919.db2.gz YQYOBQIAMGGFME-UHFFFAOYSA-N 1 2 319.396 4.100 20 0 DIADLO CC[C@H](Nc1cc(C)[nH+]c(C2CCC2)n1)c1c(C)noc1C ZINC000892998340 1041453412 /nfs/dbraw/zinc/45/34/12/1041453412.db2.gz MTXFKFLWBNNBSO-AWEZNQCLSA-N 1 2 300.406 4.221 20 0 DIADLO Cc1cc2ncn(C[NH2+]C3(c4ccccc4)CCC3)c2cc1C ZINC000728707403 1041460116 /nfs/dbraw/zinc/46/01/16/1041460116.db2.gz NPSXYYFYYWUOER-UHFFFAOYSA-N 1 2 305.425 4.280 20 0 DIADLO Cc1ccccc1-c1nc(C[NH2+][C@H](C)c2ccccc2C)no1 ZINC000181560465 1041480491 /nfs/dbraw/zinc/48/04/91/1041480491.db2.gz APSXSPOYGUIJIH-OAHLLOKOSA-N 1 2 307.397 4.204 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)s1 ZINC000282525945 1041480900 /nfs/dbraw/zinc/48/09/00/1041480900.db2.gz PXENXOKZXBUCGW-IUCAKERBSA-N 1 2 315.364 4.277 20 0 DIADLO CCCCCC[C@H](CC)C(=O)NC[C@H]1c2ccccc2C[N@H+]1C ZINC001132625161 1041483309 /nfs/dbraw/zinc/48/33/09/1041483309.db2.gz ZIUXDCKJHNBGMA-LPHOPBHVSA-N 1 2 316.489 4.286 20 0 DIADLO CCCCCC[C@H](CC)C(=O)NC[C@H]1c2ccccc2C[N@@H+]1C ZINC001132625161 1041483314 /nfs/dbraw/zinc/48/33/14/1041483314.db2.gz ZIUXDCKJHNBGMA-LPHOPBHVSA-N 1 2 316.489 4.286 20 0 DIADLO C[C@@]12CC[N@H+](Cc3c(F)ccc(F)c3Cl)C[C@@H]1C2(F)F ZINC000628290411 1041497107 /nfs/dbraw/zinc/49/71/07/1041497107.db2.gz CSGQCDRKRKOHQI-WCQYABFASA-N 1 2 307.718 4.095 20 0 DIADLO C[C@@]12CC[N@@H+](Cc3c(F)ccc(F)c3Cl)C[C@@H]1C2(F)F ZINC000628290411 1041497111 /nfs/dbraw/zinc/49/71/11/1041497111.db2.gz CSGQCDRKRKOHQI-WCQYABFASA-N 1 2 307.718 4.095 20 0 DIADLO O=C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(Cl)cc1C(F)(F)F ZINC001143503049 1041505634 /nfs/dbraw/zinc/50/56/34/1041505634.db2.gz KGWLRZYYEQRWIR-TXEJJXNPSA-N 1 2 317.738 4.055 20 0 DIADLO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(Cl)cc1C(F)(F)F ZINC001143503049 1041505638 /nfs/dbraw/zinc/50/56/38/1041505638.db2.gz KGWLRZYYEQRWIR-TXEJJXNPSA-N 1 2 317.738 4.055 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc3cc(C)c(C)cc3o2)[nH]1 ZINC000271460818 1041517735 /nfs/dbraw/zinc/51/77/35/1041517735.db2.gz HGNPJLOFZLPVCR-QWHCGFSZSA-N 1 2 312.417 4.142 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2cc3cc(C)c(C)cc3o2)[nH]1 ZINC000271460809 1041518119 /nfs/dbraw/zinc/51/81/19/1041518119.db2.gz HGNPJLOFZLPVCR-CHWSQXEVSA-N 1 2 312.417 4.142 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccnc(Cl)c2Cl)cc1 ZINC000811453298 1041518759 /nfs/dbraw/zinc/51/87/59/1041518759.db2.gz IZRPOYIMDWAOSX-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccnc(Cl)c2Cl)cc1 ZINC000811453298 1041518762 /nfs/dbraw/zinc/51/87/62/1041518762.db2.gz IZRPOYIMDWAOSX-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO CCOc1cc(Cl)ccc1C[NH2+]Cc1nc(C)c(C)s1 ZINC000893187634 1041544499 /nfs/dbraw/zinc/54/44/99/1041544499.db2.gz RUPUEOFFSJZSPP-UHFFFAOYSA-N 1 2 310.850 4.102 20 0 DIADLO Brc1scnc1C[N@@H+]1CCC2(C1)CCCCC2 ZINC000659956790 1041558573 /nfs/dbraw/zinc/55/85/73/1041558573.db2.gz VRIPPMOICKJLHG-UHFFFAOYSA-N 1 2 315.280 4.062 20 0 DIADLO Brc1scnc1C[N@H+]1CCC2(C1)CCCCC2 ZINC000659956790 1041558578 /nfs/dbraw/zinc/55/85/78/1041558578.db2.gz VRIPPMOICKJLHG-UHFFFAOYSA-N 1 2 315.280 4.062 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C ZINC000246059634 1041568618 /nfs/dbraw/zinc/56/86/18/1041568618.db2.gz ZAQYQBPFESIUMF-NGAQBULDSA-N 1 2 303.837 4.419 20 0 DIADLO CC1(C2CC2)CC[NH+](Cn2nc(C3CC3)sc2=S)CC1 ZINC000811785047 1041570952 /nfs/dbraw/zinc/57/09/52/1041570952.db2.gz UADUBSROYFFXEY-UHFFFAOYSA-N 1 2 309.504 4.021 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2nccn2Cc2ccccc2)cc1 ZINC000613707074 1041577071 /nfs/dbraw/zinc/57/70/71/1041577071.db2.gz BMGBBQSZDSHNGJ-GOSISDBHSA-N 1 2 319.452 4.433 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nccn2Cc2ccccc2)cc1 ZINC000613707074 1041577080 /nfs/dbraw/zinc/57/70/80/1041577080.db2.gz BMGBBQSZDSHNGJ-GOSISDBHSA-N 1 2 319.452 4.433 20 0 DIADLO CSc1cccc(C[N@@H+]2CCO[C@H](c3ccsc3)C2)c1 ZINC000660000463 1041577740 /nfs/dbraw/zinc/57/77/40/1041577740.db2.gz BAKIQKZJKQKTTK-INIZCTEOSA-N 1 2 305.468 4.044 20 0 DIADLO CSc1cccc(C[N@H+]2CCO[C@H](c3ccsc3)C2)c1 ZINC000660000463 1041577742 /nfs/dbraw/zinc/57/77/42/1041577742.db2.gz BAKIQKZJKQKTTK-INIZCTEOSA-N 1 2 305.468 4.044 20 0 DIADLO Cc1ccc(CCC(=O)Nc2ccccc2-n2cc[nH+]c2)c(C)c1 ZINC000613710181 1041584856 /nfs/dbraw/zinc/58/48/56/1041584856.db2.gz XNTXKJOAPLYHNA-UHFFFAOYSA-N 1 2 319.408 4.060 20 0 DIADLO Cc1nc(C[N@@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)c(C)o1 ZINC000660068604 1041599070 /nfs/dbraw/zinc/59/90/70/1041599070.db2.gz LIMLMVKVYCHDHN-LJQANCHMSA-N 1 2 309.413 4.500 20 0 DIADLO Cc1nc(C[N@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)c(C)o1 ZINC000660068604 1041599076 /nfs/dbraw/zinc/59/90/76/1041599076.db2.gz LIMLMVKVYCHDHN-LJQANCHMSA-N 1 2 309.413 4.500 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2c2ccc(C(F)(F)F)cc2)cc[nH+]1 ZINC000010634824 1041606379 /nfs/dbraw/zinc/60/63/79/1041606379.db2.gz VLWXWFMMCBAIDF-HUUCEWRRSA-N 1 2 320.314 4.151 20 0 DIADLO CC[N@H+](Cn1c(-c2ccccc2)csc1=S)[C@H]1CCOC1 ZINC000812295910 1041615461 /nfs/dbraw/zinc/61/54/61/1041615461.db2.gz LBHIAWIMHBKTBY-AWEZNQCLSA-N 1 2 320.483 4.014 20 0 DIADLO CC[N@@H+](Cn1c(-c2ccccc2)csc1=S)[C@H]1CCOC1 ZINC000812295910 1041615463 /nfs/dbraw/zinc/61/54/63/1041615463.db2.gz LBHIAWIMHBKTBY-AWEZNQCLSA-N 1 2 320.483 4.014 20 0 DIADLO CC[N@H+](Cn1c(-c2ccccc2)csc1=S)[C@@H]1CCOC1 ZINC000812295911 1041615574 /nfs/dbraw/zinc/61/55/74/1041615574.db2.gz LBHIAWIMHBKTBY-CQSZACIVSA-N 1 2 320.483 4.014 20 0 DIADLO CC[N@@H+](Cn1c(-c2ccccc2)csc1=S)[C@@H]1CCOC1 ZINC000812295911 1041615578 /nfs/dbraw/zinc/61/55/78/1041615578.db2.gz LBHIAWIMHBKTBY-CQSZACIVSA-N 1 2 320.483 4.014 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)nc(C)n1 ZINC000660103235 1041615613 /nfs/dbraw/zinc/61/56/13/1041615613.db2.gz BCMJKEBZKCVCRL-SFHVURJKSA-N 1 2 317.383 4.099 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)nc(C)n1 ZINC000660103235 1041615619 /nfs/dbraw/zinc/61/56/19/1041615619.db2.gz BCMJKEBZKCVCRL-SFHVURJKSA-N 1 2 317.383 4.099 20 0 DIADLO CCc1nocc1C[N@@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC000660104053 1041615732 /nfs/dbraw/zinc/61/57/32/1041615732.db2.gz LGUCTQJQFPJHEB-QGZVFWFLSA-N 1 2 306.356 4.242 20 0 DIADLO CCc1nocc1C[N@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC000660104053 1041615736 /nfs/dbraw/zinc/61/57/36/1041615736.db2.gz LGUCTQJQFPJHEB-QGZVFWFLSA-N 1 2 306.356 4.242 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)c1 ZINC000660135669 1041625230 /nfs/dbraw/zinc/62/52/30/1041625230.db2.gz BIVCLWLAEZWQTK-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@H+]2CCC[C@@H]2c2ccncc2)c1 ZINC000660135669 1041625234 /nfs/dbraw/zinc/62/52/34/1041625234.db2.gz BIVCLWLAEZWQTK-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(C[N@@H+]2CCC[C@H]2c2ccncc2)c1OC(F)F ZINC000660135960 1041625417 /nfs/dbraw/zinc/62/54/17/1041625417.db2.gz GEBLBSWAXSPFNB-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(C[N@H+]2CCC[C@H]2c2ccncc2)c1OC(F)F ZINC000660135960 1041625421 /nfs/dbraw/zinc/62/54/21/1041625421.db2.gz GEBLBSWAXSPFNB-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cncc(C(F)(F)F)c2)Cc2ccccc21 ZINC000812822960 1041649810 /nfs/dbraw/zinc/64/98/10/1041649810.db2.gz NHJZFFGKHQAUJK-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cncc(C(F)(F)F)c2)Cc2ccccc21 ZINC000812822960 1041649814 /nfs/dbraw/zinc/64/98/14/1041649814.db2.gz NHJZFFGKHQAUJK-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1ccccc1OC(C)C ZINC000584761984 1041665523 /nfs/dbraw/zinc/66/55/23/1041665523.db2.gz IVWBYUPVCQUSBS-CABCVRRESA-N 1 2 301.434 4.102 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2nsc3ccccc23)C2CC2)n1 ZINC000660215876 1041673735 /nfs/dbraw/zinc/67/37/35/1041673735.db2.gz XHLGXHVCLZQQQR-OAHLLOKOSA-N 1 2 315.467 4.302 20 0 DIADLO CC[C@@H]([NH2+]Cc1cccc(F)c1OC(F)F)c1nccs1 ZINC000660253231 1041691884 /nfs/dbraw/zinc/69/18/84/1041691884.db2.gz GFHKPYIOOQUHHZ-LLVKDONJSA-N 1 2 316.348 4.125 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000417810163 1041703016 /nfs/dbraw/zinc/70/30/16/1041703016.db2.gz IEIYHNIFBVYQEQ-ICSRJNTNSA-N 1 2 322.452 4.047 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+][C@H]1COCc2ccccc21 ZINC000418101832 1041726041 /nfs/dbraw/zinc/72/60/41/1041726041.db2.gz SOEMARKMRYTMGP-INIZCTEOSA-N 1 2 308.208 4.355 20 0 DIADLO CC([NH2+]Cc1nccn1C1CC1)(c1ccccc1)c1ccccc1 ZINC000893345765 1041744557 /nfs/dbraw/zinc/74/45/57/1041744557.db2.gz WZDCAWZMUHCXPC-UHFFFAOYSA-N 1 2 317.436 4.271 20 0 DIADLO CCc1ccc(C[N@H+](C)[C@@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000105732429 1041749292 /nfs/dbraw/zinc/74/92/92/1041749292.db2.gz ZPEUWDLPYNDPIY-ZDUSSCGKSA-N 1 2 301.434 4.123 20 0 DIADLO CCc1ccc(C[N@@H+](C)[C@@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000105732429 1041749298 /nfs/dbraw/zinc/74/92/98/1041749298.db2.gz ZPEUWDLPYNDPIY-ZDUSSCGKSA-N 1 2 301.434 4.123 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@@H](C)c3ccc(C)cc3C)nn2)c1C ZINC001170726158 1041771266 /nfs/dbraw/zinc/77/12/66/1041771266.db2.gz KOOYNAMJQQGOTO-HNNXBMFYSA-N 1 2 321.428 4.069 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2cccc(OCc3ccccc3)c2)co1 ZINC000660419990 1041783454 /nfs/dbraw/zinc/78/34/54/1041783454.db2.gz MZCJNQXGSKBJAO-OAHLLOKOSA-N 1 2 322.408 4.413 20 0 DIADLO Cc1nc2cc(CNc3ccc(F)c(-n4cc[nH+]c4)c3)ccc2o1 ZINC001167760822 1041784973 /nfs/dbraw/zinc/78/49/73/1041784973.db2.gz RCHMSPXBHVYKEJ-UHFFFAOYSA-N 1 2 322.343 4.073 20 0 DIADLO CC[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccc(OC)c(OC)c1 ZINC000319512569 1041786133 /nfs/dbraw/zinc/78/61/33/1041786133.db2.gz IJTFTQSIQZOAPM-QGZVFWFLSA-N 1 2 314.429 4.333 20 0 DIADLO CC(C)CCCCCC(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000747908942 1041786215 /nfs/dbraw/zinc/78/62/15/1041786215.db2.gz RWWPLUPUFCNXES-MRXNPFEDSA-N 1 2 307.482 4.021 20 0 DIADLO C[C@@H](CC(=O)Nc1cccc2c1[C@H](C)CC2(C)C)n1cc[nH+]c1 ZINC001134154341 1041786305 /nfs/dbraw/zinc/78/63/05/1041786305.db2.gz HONNWQIXHKZQFF-KGLIPLIRSA-N 1 2 311.429 4.258 20 0 DIADLO CCCCC[C@@H](CC)C(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC000775680030 1041836272 /nfs/dbraw/zinc/83/62/72/1041836272.db2.gz ZTQFYETZPPOAKK-MRXNPFEDSA-N 1 2 320.477 4.272 20 0 DIADLO Cn1cnc(C[NH+]2CCC(c3cccc(Cl)c3Cl)CC2)c1 ZINC000660596698 1041841096 /nfs/dbraw/zinc/84/10/96/1041841096.db2.gz NZFQLOFLXNFWDN-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO Cc1ccccc1-c1noc(C[N@H+](Cc2ccccc2)C2CC2)n1 ZINC000043687935 1041841467 /nfs/dbraw/zinc/84/14/67/1041841467.db2.gz VPPCMNWOXPMFKY-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1ccccc1-c1noc(C[N@@H+](Cc2ccccc2)C2CC2)n1 ZINC000043687935 1041841469 /nfs/dbraw/zinc/84/14/69/1041841469.db2.gz VPPCMNWOXPMFKY-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Clc1cnc(C[N@@H+]2CCC[C@H](c3ccccn3)C2)c(Cl)c1 ZINC000660626146 1041845108 /nfs/dbraw/zinc/84/51/08/1041845108.db2.gz HCZWLXDDUCVRQH-LBPRGKRZSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1cnc(C[N@H+]2CCC[C@H](c3ccccn3)C2)c(Cl)c1 ZINC000660626146 1041845117 /nfs/dbraw/zinc/84/51/17/1041845117.db2.gz HCZWLXDDUCVRQH-LBPRGKRZSA-N 1 2 322.239 4.163 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3ccc(-c4ccccc4)cc3C2)co1 ZINC000660647047 1041848001 /nfs/dbraw/zinc/84/80/01/1041848001.db2.gz ADPAZJXDEFGCJJ-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO Cc1nc(C[N@H+]2CCc3ccc(-c4ccccc4)cc3C2)co1 ZINC000660647047 1041848006 /nfs/dbraw/zinc/84/80/06/1041848006.db2.gz ADPAZJXDEFGCJJ-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2nc3cc(Cl)ccc3[nH]2)cn1 ZINC000660708911 1041855052 /nfs/dbraw/zinc/85/50/52/1041855052.db2.gz XGNAWAAHAWHKPF-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2nc3cc(Cl)ccc3[nH]2)cn1 ZINC000660708911 1041855058 /nfs/dbraw/zinc/85/50/58/1041855058.db2.gz XGNAWAAHAWHKPF-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)[nH]1 ZINC000660767390 1041859042 /nfs/dbraw/zinc/85/90/42/1041859042.db2.gz QVZOXORYCPQSKK-WMLDXEAASA-N 1 2 310.445 4.045 20 0 DIADLO CCc1nnc([C@H](C)[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)[nH]1 ZINC000660767390 1041859050 /nfs/dbraw/zinc/85/90/50/1041859050.db2.gz QVZOXORYCPQSKK-WMLDXEAASA-N 1 2 310.445 4.045 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@@H+]2C[C@@H]3CCCC[C@@H]32)c(Cl)c1 ZINC000660929797 1041870978 /nfs/dbraw/zinc/87/09/78/1041870978.db2.gz HUIPBWKNTYRWJV-YCPHGPKFSA-N 1 2 320.864 4.158 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@H+]2C[C@@H]3CCCC[C@@H]32)c(Cl)c1 ZINC000660929797 1041870982 /nfs/dbraw/zinc/87/09/82/1041870982.db2.gz HUIPBWKNTYRWJV-YCPHGPKFSA-N 1 2 320.864 4.158 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1nc(C(C)C)n2ccccc12 ZINC000651665940 1041871767 /nfs/dbraw/zinc/87/17/67/1041871767.db2.gz KAXCLMIAEXJKCO-OAHLLOKOSA-N 1 2 323.440 4.317 20 0 DIADLO COC[C@@H]([NH2+][C@@H]1CCc2ccc(F)c(Cl)c21)c1ccc(C)o1 ZINC000651728648 1041897802 /nfs/dbraw/zinc/89/78/02/1041897802.db2.gz FVEUEIAEWNHBRB-ZIAGYGMSSA-N 1 2 323.795 4.345 20 0 DIADLO CC/C(=C/C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000728815138 1041900627 /nfs/dbraw/zinc/90/06/27/1041900627.db2.gz PMHHIYAFEMCZJJ-SSZFMOIBSA-N 1 2 317.392 4.304 20 0 DIADLO Fc1cccc(F)c1C[N@H+](Cc1cc2cnccc2o1)C1CC1 ZINC000651784937 1041911047 /nfs/dbraw/zinc/91/10/47/1041911047.db2.gz JXXWOTLNHBGIMQ-UHFFFAOYSA-N 1 2 314.335 4.271 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](Cc1cc2cnccc2o1)C1CC1 ZINC000651784937 1041911054 /nfs/dbraw/zinc/91/10/54/1041911054.db2.gz JXXWOTLNHBGIMQ-UHFFFAOYSA-N 1 2 314.335 4.271 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2ccc(F)c(Cl)c2)c(F)c1 ZINC000815152102 1041919730 /nfs/dbraw/zinc/91/97/30/1041919730.db2.gz HOAQDGRGQCFTMA-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2cc(Cl)ccc2F)c(F)c1 ZINC000815152064 1041920100 /nfs/dbraw/zinc/92/01/00/1041920100.db2.gz GYVNUXAZNCZNHT-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO Clc1ccccc1C1([NH2+]Cc2nc3c(s2)CCC3)CCC1 ZINC000651861143 1041938143 /nfs/dbraw/zinc/93/81/43/1041938143.db2.gz HPOJBIKESLVDHF-UHFFFAOYSA-N 1 2 318.873 4.454 20 0 DIADLO CC/C(=C\C(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000728821019 1041940229 /nfs/dbraw/zinc/94/02/29/1041940229.db2.gz AECGJDNYXIAASO-RVDMUPIBSA-N 1 2 305.381 4.075 20 0 DIADLO C/C(=C/C(=O)Nc1cccc2[nH+]ccn21)c1cccc(Cl)c1 ZINC001126097734 1041947723 /nfs/dbraw/zinc/94/77/23/1041947723.db2.gz PZFOKJUJWLWMHN-BENRWUELSA-N 1 2 311.772 4.030 20 0 DIADLO Clc1ccsc1C[N@@H+]1CC2(CCOCC2)[C@H]1c1ccco1 ZINC000661561031 1041952713 /nfs/dbraw/zinc/95/27/13/1041952713.db2.gz JWZINOSBVLIIDA-OAHLLOKOSA-N 1 2 323.845 4.348 20 0 DIADLO Clc1ccsc1C[N@H+]1CC2(CCOCC2)[C@H]1c1ccco1 ZINC000661561031 1041952720 /nfs/dbraw/zinc/95/27/20/1041952720.db2.gz JWZINOSBVLIIDA-OAHLLOKOSA-N 1 2 323.845 4.348 20 0 DIADLO CC(C)CCCCCC[NH2+][C@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000815552962 1041961381 /nfs/dbraw/zinc/96/13/81/1041961381.db2.gz OHHNXYSXJAPATJ-KRWDZBQOSA-N 1 2 318.440 4.229 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC[C@H](C(C)(C)C)CC2)c(C)[nH+]1 ZINC001126115470 1041963485 /nfs/dbraw/zinc/96/34/85/1041963485.db2.gz VKBDNFXBYOQHJD-INIZCTEOSA-N 1 2 302.462 4.295 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2cccc(Br)c2)c1 ZINC000652329853 1042009823 /nfs/dbraw/zinc/00/98/23/1042009823.db2.gz LSCRVHAGVPQFFV-LLVKDONJSA-N 1 2 321.218 4.164 20 0 DIADLO COCc1cc[nH+]c(N[C@H](c2cc(F)ccc2F)C(C)C)c1 ZINC000652330591 1042009973 /nfs/dbraw/zinc/00/99/73/1042009973.db2.gz KJJFDMCGKCGXQS-KRWDZBQOSA-N 1 2 306.356 4.315 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CCCOc3cc(Cl)ccc32)c1 ZINC000652331069 1042010904 /nfs/dbraw/zinc/01/09/04/1042010904.db2.gz XCTUJTCNRBSKCG-OAHLLOKOSA-N 1 2 318.804 4.207 20 0 DIADLO Cc1oc(-c2ccccc2)cc1C(=O)Nc1cccc2[nH+]ccn21 ZINC001126178394 1042028316 /nfs/dbraw/zinc/02/83/16/1042028316.db2.gz XMQDEXNUNJJSSR-UHFFFAOYSA-N 1 2 317.348 4.155 20 0 DIADLO C[C@]12CC[N@H+](Cc3cccc(O)c3Cl)C[C@H]1C2(Cl)Cl ZINC000816603264 1042071378 /nfs/dbraw/zinc/07/13/78/1042071378.db2.gz DJUXXEZUXOZERZ-YPMHNXCESA-N 1 2 320.647 4.061 20 0 DIADLO C[C@]12CC[N@@H+](Cc3cccc(O)c3Cl)C[C@H]1C2(Cl)Cl ZINC000816603264 1042071383 /nfs/dbraw/zinc/07/13/83/1042071383.db2.gz DJUXXEZUXOZERZ-YPMHNXCESA-N 1 2 320.647 4.061 20 0 DIADLO CC[N@H+](Cc1cnn(C)c1Cl)[C@@H](C)c1cc2ccccc2o1 ZINC000816496333 1042056989 /nfs/dbraw/zinc/05/69/89/1042056989.db2.gz FZRQZOYLBGZVNQ-LBPRGKRZSA-N 1 2 317.820 4.403 20 0 DIADLO CC[N@@H+](Cc1cnn(C)c1Cl)[C@@H](C)c1cc2ccccc2o1 ZINC000816496333 1042056994 /nfs/dbraw/zinc/05/69/94/1042056994.db2.gz FZRQZOYLBGZVNQ-LBPRGKRZSA-N 1 2 317.820 4.403 20 0 DIADLO CCC[N@H+](Cc1cnn(C)c1Cl)[C@@H](C)c1ccccc1OC ZINC000816488532 1042058372 /nfs/dbraw/zinc/05/83/72/1042058372.db2.gz XDSWMGUBCBFSJM-ZDUSSCGKSA-N 1 2 321.852 4.055 20 0 DIADLO CCC[N@@H+](Cc1cnn(C)c1Cl)[C@@H](C)c1ccccc1OC ZINC000816488532 1042058378 /nfs/dbraw/zinc/05/83/78/1042058378.db2.gz XDSWMGUBCBFSJM-ZDUSSCGKSA-N 1 2 321.852 4.055 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1ccccc1-c1ccnn1C ZINC000816521993 1042064416 /nfs/dbraw/zinc/06/44/16/1042064416.db2.gz GSEBWFUPOJADDW-UHFFFAOYSA-N 1 2 320.440 4.074 20 0 DIADLO C[C@@]12CC[N@H+](Cc3cccc(O)c3Cl)C[C@@H]1C2(Cl)Cl ZINC000816603263 1042071510 /nfs/dbraw/zinc/07/15/10/1042071510.db2.gz DJUXXEZUXOZERZ-WCQYABFASA-N 1 2 320.647 4.061 20 0 DIADLO C[C@@]12CC[N@@H+](Cc3cccc(O)c3Cl)C[C@@H]1C2(Cl)Cl ZINC000816603263 1042071516 /nfs/dbraw/zinc/07/15/16/1042071516.db2.gz DJUXXEZUXOZERZ-WCQYABFASA-N 1 2 320.647 4.061 20 0 DIADLO Cn1ncc(C[N@@H+](Cc2ccccc2Cl)CC2CC2)c1Cl ZINC000816607892 1042071841 /nfs/dbraw/zinc/07/18/41/1042071841.db2.gz ISGCYMVXZACJFZ-UHFFFAOYSA-N 1 2 324.255 4.139 20 0 DIADLO Cn1ncc(C[N@H+](Cc2ccccc2Cl)CC2CC2)c1Cl ZINC000816607892 1042071846 /nfs/dbraw/zinc/07/18/46/1042071846.db2.gz ISGCYMVXZACJFZ-UHFFFAOYSA-N 1 2 324.255 4.139 20 0 DIADLO CC[N@H+](Cc1csc(N(C(C)=O)c2ccccc2)n1)C(C)C ZINC000164924515 1042075638 /nfs/dbraw/zinc/07/56/38/1042075638.db2.gz WQYCVVHLTCASNB-UHFFFAOYSA-N 1 2 317.458 4.058 20 0 DIADLO CC[N@@H+](Cc1csc(N(C(C)=O)c2ccccc2)n1)C(C)C ZINC000164924515 1042075643 /nfs/dbraw/zinc/07/56/43/1042075643.db2.gz WQYCVVHLTCASNB-UHFFFAOYSA-N 1 2 317.458 4.058 20 0 DIADLO C[C@@H]([NH2+][C@H](CO)c1ccc(F)cc1F)c1ccccc1Cl ZINC000662163055 1042076734 /nfs/dbraw/zinc/07/67/34/1042076734.db2.gz UMCFZOTYDLMSMY-QLJPJBMISA-N 1 2 311.759 4.002 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccnc(Cl)c2Cl)s1 ZINC000278857147 1042087557 /nfs/dbraw/zinc/08/75/57/1042087557.db2.gz FFWIHZHXTMQBPF-MRVPVSSYSA-N 1 2 302.230 4.004 20 0 DIADLO CCOc1ccc(C[NH2+][C@@H](CF)c2ccc(F)cc2)cc1OC ZINC000631280410 1042092033 /nfs/dbraw/zinc/09/20/33/1042092033.db2.gz LMCNYDZMULLQKK-INIZCTEOSA-N 1 2 321.367 4.033 20 0 DIADLO CC(C)[N@H+](Cc1nnc(C(C)(C)C)o1)[C@@H](C)c1ccsc1 ZINC000817285696 1042100100 /nfs/dbraw/zinc/10/01/00/1042100100.db2.gz BIMJQPDUUHDVDL-LBPRGKRZSA-N 1 2 307.463 4.400 20 0 DIADLO CC(C)[N@@H+](Cc1nnc(C(C)(C)C)o1)[C@@H](C)c1ccsc1 ZINC000817285696 1042100105 /nfs/dbraw/zinc/10/01/05/1042100105.db2.gz BIMJQPDUUHDVDL-LBPRGKRZSA-N 1 2 307.463 4.400 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H](C)c2csc3ccccc32)nn1C ZINC000817407535 1042107404 /nfs/dbraw/zinc/10/74/04/1042107404.db2.gz SGACXUJYUYJIAF-SNVBAGLBSA-N 1 2 319.861 4.447 20 0 DIADLO CC(C)N(C(=O)c1cccc2[nH+]ccn21)[C@H](C)c1ccsc1 ZINC000817485860 1042111145 /nfs/dbraw/zinc/11/11/45/1042111145.db2.gz QPQXFZVHKIXGGI-CYBMUJFWSA-N 1 2 313.426 4.008 20 0 DIADLO Cc1cc(C[NH2+]Cc2csc(C(F)(F)F)n2)ccc1Cl ZINC000893567724 1042114468 /nfs/dbraw/zinc/11/44/68/1042114468.db2.gz AGCOFGUGGHTMIY-UHFFFAOYSA-N 1 2 320.767 4.414 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2cccc(Cl)c2)cs1 ZINC000165246958 1042125860 /nfs/dbraw/zinc/12/58/60/1042125860.db2.gz ZVHGKVQMAKMODY-WDEREUQCSA-N 1 2 310.850 4.355 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1N[C@@H](c1ccccc1)C(F)(F)F ZINC001170881670 1042127311 /nfs/dbraw/zinc/12/73/11/1042127311.db2.gz UVYQXFOXUALHSE-HNNXBMFYSA-N 1 2 309.335 4.172 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc(N2CCCC2)c(Cl)c1 ZINC000818194924 1042143435 /nfs/dbraw/zinc/14/34/35/1042143435.db2.gz SFCGHYUHAPDSPD-UHFFFAOYSA-N 1 2 318.852 4.330 20 0 DIADLO CC(C)CCc1noc(C[N@@H+]2CCC[C@@H]2c2cccs2)n1 ZINC000067961060 1042144548 /nfs/dbraw/zinc/14/45/48/1042144548.db2.gz DZFXOLASROFBHJ-CYBMUJFWSA-N 1 2 305.447 4.057 20 0 DIADLO CC(C)CCc1noc(C[N@H+]2CCC[C@@H]2c2cccs2)n1 ZINC000067961060 1042144552 /nfs/dbraw/zinc/14/45/52/1042144552.db2.gz DZFXOLASROFBHJ-CYBMUJFWSA-N 1 2 305.447 4.057 20 0 DIADLO C[C@H](c1ccccc1Cl)N(C)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001136186363 1042169651 /nfs/dbraw/zinc/16/96/51/1042169651.db2.gz JZZKXPNWRUEAAD-LLVKDONJSA-N 1 2 313.788 4.050 20 0 DIADLO Cc1cc(CNC(=O)N[C@@H](CC2CC2)c2ccccc2)cc(C)[nH+]1 ZINC000643242007 1042183702 /nfs/dbraw/zinc/18/37/02/1042183702.db2.gz LLQIIDXRCAFZEM-IBGZPJMESA-N 1 2 323.440 4.039 20 0 DIADLO C/C=C(/CC)C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000819605199 1042189843 /nfs/dbraw/zinc/18/98/43/1042189843.db2.gz GQWGWVLKCHQUHG-BNNQUZSASA-N 1 2 309.413 4.181 20 0 DIADLO COc1cc(OC)cc([C@H](C)Nc2cc3cc(C)[nH]c3c[nH+]2)c1 ZINC001170930097 1042189874 /nfs/dbraw/zinc/18/98/74/1042189874.db2.gz LGPPVRLYGFIMQN-LBPRGKRZSA-N 1 2 311.385 4.062 20 0 DIADLO Fc1ccccc1[C@H]1C[N@H+](CCc2ccccc2Cl)CCO1 ZINC000303189692 1042194255 /nfs/dbraw/zinc/19/42/55/1042194255.db2.gz MKAHOFIABGLEKF-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccccc1[C@H]1C[N@@H+](CCc2ccccc2Cl)CCO1 ZINC000303189692 1042194259 /nfs/dbraw/zinc/19/42/59/1042194259.db2.gz MKAHOFIABGLEKF-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO COc1ccccc1[C@H]1CCCN1c1[nH+]ccc2c(N)cccc21 ZINC000663535521 1042223992 /nfs/dbraw/zinc/22/39/92/1042223992.db2.gz PJGQJYZPBNDQMX-GOSISDBHSA-N 1 2 319.408 4.167 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H]2CCc3ccc(Cl)nc32)cs1 ZINC000820810131 1042229420 /nfs/dbraw/zinc/22/94/20/1042229420.db2.gz PMOKIDVMCCNIAY-MWLCHTKSSA-N 1 2 307.850 4.092 20 0 DIADLO CC(C)C[C@H](C(=O)N(C)c1cccc2ccccc21)n1cc[nH+]c1 ZINC001136407613 1042239155 /nfs/dbraw/zinc/23/91/55/1042239155.db2.gz HUJCMYYLYQEZGR-LJQANCHMSA-N 1 2 321.424 4.287 20 0 DIADLO Cn1ccnc1[C@@H]([NH2+]Cc1cccc(C2CC2)c1)c1ccccc1 ZINC000643287208 1042252434 /nfs/dbraw/zinc/25/24/34/1042252434.db2.gz HMSAILRHYPHHAB-FQEVSTJZSA-N 1 2 317.436 4.177 20 0 DIADLO CCCc1ccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)s1 ZINC001136459242 1042255089 /nfs/dbraw/zinc/25/50/89/1042255089.db2.gz MNEBBCUYOBALCQ-UHFFFAOYSA-N 1 2 311.410 4.343 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)cc1 ZINC000319783519 1042259497 /nfs/dbraw/zinc/25/94/97/1042259497.db2.gz HCSGEGFFMXFWTK-OAHLLOKOSA-N 1 2 311.429 4.254 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cc(C)cnc2Cl)o1 ZINC000893644438 1042277468 /nfs/dbraw/zinc/27/74/68/1042277468.db2.gz ZHEKONRYAGDKSG-OAHLLOKOSA-N 1 2 320.820 4.120 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2cc(C)cnc2Cl)o1 ZINC000893644438 1042277476 /nfs/dbraw/zinc/27/74/76/1042277476.db2.gz ZHEKONRYAGDKSG-OAHLLOKOSA-N 1 2 320.820 4.120 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2csc(C3CC3)n2)c1 ZINC000162723902 1042295793 /nfs/dbraw/zinc/29/57/93/1042295793.db2.gz OJLOSVNBJDDVSV-KRWDZBQOSA-N 1 2 314.454 4.366 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2csc(C3CC3)n2)c1 ZINC000162723902 1042295800 /nfs/dbraw/zinc/29/58/00/1042295800.db2.gz OJLOSVNBJDDVSV-KRWDZBQOSA-N 1 2 314.454 4.366 20 0 DIADLO C/C(=C/C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1)c1ccccc1 ZINC001136624580 1042300075 /nfs/dbraw/zinc/30/00/75/1042300075.db2.gz AMOSLBDZZBGQRV-SQFISAMPSA-N 1 2 317.392 4.223 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc([NH+](C)C)cc2C)cc1OC ZINC000319997162 1042300518 /nfs/dbraw/zinc/30/05/18/1042300518.db2.gz GWHVTFQIEQLJNO-AWEZNQCLSA-N 1 2 314.429 4.251 20 0 DIADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccc(Oc2ccccc2)cc1C ZINC001136632566 1042302258 /nfs/dbraw/zinc/30/22/58/1042302258.db2.gz BZSLQCKTYRFIBU-UHFFFAOYSA-N 1 2 321.380 4.000 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000162920306 1042302294 /nfs/dbraw/zinc/30/22/94/1042302294.db2.gz KBHCINNVJZHDAY-INIZCTEOSA-N 1 2 314.454 4.366 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1csc(C2CC2)n1 ZINC000162920306 1042302299 /nfs/dbraw/zinc/30/22/99/1042302299.db2.gz KBHCINNVJZHDAY-INIZCTEOSA-N 1 2 314.454 4.366 20 0 DIADLO Cc1ccccc1[C@@H](C)[N@H+](C)Cc1ccncc1Br ZINC000625104534 1042321716 /nfs/dbraw/zinc/32/17/16/1042321716.db2.gz RHGBNZVUNFKXCP-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1ccncc1Br ZINC000625104534 1042321724 /nfs/dbraw/zinc/32/17/24/1042321724.db2.gz RHGBNZVUNFKXCP-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Fc1cc(Cl)cc2c(NCCCCn3cc[nH+]c3)ccnc12 ZINC000663771475 1042322552 /nfs/dbraw/zinc/32/25/52/1042322552.db2.gz LISPSDMBZVYJJS-UHFFFAOYSA-N 1 2 318.783 4.116 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1ccccc1OC(F)F ZINC000021810359 1042325017 /nfs/dbraw/zinc/32/50/17/1042325017.db2.gz GUMRLBAUZRVIQY-UHFFFAOYSA-N 1 2 315.722 4.370 20 0 DIADLO C[NH+](C)c1ccc(N[C@@H]2CCc3cc(F)c(F)c(F)c32)cc1 ZINC000823529081 1042330339 /nfs/dbraw/zinc/33/03/39/1042330339.db2.gz CYRCRWJUHUAHSG-CQSZACIVSA-N 1 2 306.331 4.269 20 0 DIADLO C[C@H]1COCCN1c1ccc([NH2+][C@@H]2CCCC23CCC3)cc1 ZINC000823554072 1042334176 /nfs/dbraw/zinc/33/41/76/1042334176.db2.gz GVUOFZZHWPYWLC-MAUKXSAKSA-N 1 2 300.446 4.046 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCCC34CCC4)cc2)CCO1 ZINC000823554087 1042334377 /nfs/dbraw/zinc/33/43/77/1042334377.db2.gz HGTCHPDWARXUDT-CRAIPNDOSA-N 1 2 300.446 4.046 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nc(Cc3ccccc3)no2)c(C)c1 ZINC000237593063 1042378173 /nfs/dbraw/zinc/37/81/73/1042378173.db2.gz IRQORIYITFBCCW-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1coc(C[NH+]2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 ZINC000893969016 1042399817 /nfs/dbraw/zinc/39/98/17/1042399817.db2.gz HTLFSBVBJHCSQX-NXEZZACHSA-N 1 2 315.257 4.151 20 0 DIADLO Oc1cccc2sc(C[N@@H+]3CCCC[C@@H]3c3ncc[nH]3)cc21 ZINC000893986804 1042400335 /nfs/dbraw/zinc/40/03/35/1042400335.db2.gz MQABREUALCDPBU-CQSZACIVSA-N 1 2 313.426 4.057 20 0 DIADLO Oc1cccc2sc(C[N@H+]3CCCC[C@@H]3c3ncc[nH]3)cc21 ZINC000893986804 1042400339 /nfs/dbraw/zinc/40/03/39/1042400339.db2.gz MQABREUALCDPBU-CQSZACIVSA-N 1 2 313.426 4.057 20 0 DIADLO CC(C)c1c[nH]c(C[NH+]2CCC(OC3CCC(C)CC3)CC2)n1 ZINC000894016300 1042402888 /nfs/dbraw/zinc/40/28/88/1042402888.db2.gz ACWAKXSXTZCBPQ-UHFFFAOYSA-N 1 2 319.493 4.093 20 0 DIADLO COc1c(F)cc(F)cc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001143551604 1042407418 /nfs/dbraw/zinc/40/74/18/1042407418.db2.gz DPTPTOATDKVIQQ-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cc(F)cc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001143551604 1042407420 /nfs/dbraw/zinc/40/74/20/1042407420.db2.gz DPTPTOATDKVIQQ-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(C2CCCC2)s1)c1c(F)cncc1F ZINC000353144460 1042418744 /nfs/dbraw/zinc/41/87/44/1042418744.db2.gz VAMFZUQXTNIWTO-JTQLQIEISA-N 1 2 323.412 4.325 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CC=C(c3cccc4ccccc43)CC2)[nH]1 ZINC000411217474 1042431836 /nfs/dbraw/zinc/43/18/36/1042431836.db2.gz YZBCVUZDCCXDCI-AWEZNQCLSA-N 1 2 318.424 4.117 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CC=C(c3cccc4ccccc43)CC2)[nH]1 ZINC000411217474 1042431837 /nfs/dbraw/zinc/43/18/37/1042431837.db2.gz YZBCVUZDCCXDCI-AWEZNQCLSA-N 1 2 318.424 4.117 20 0 DIADLO Cc1cc(NC2CCC(OC(F)F)CC2)nc(C2CCC2)[nH+]1 ZINC000894110523 1042432591 /nfs/dbraw/zinc/43/25/91/1042432591.db2.gz JBGDOKZAYBUVFE-UHFFFAOYSA-N 1 2 311.376 4.015 20 0 DIADLO CC[C@H](CC(F)F)Cn1nc(C(F)(F)F)c2c[nH+]ccc21 ZINC000663995783 1042439081 /nfs/dbraw/zinc/43/90/81/1042439081.db2.gz NHBBPCYUPCBZPL-MRVPVSSYSA-N 1 2 307.266 4.132 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2cc(OC(F)F)ccc21)c1ncco1 ZINC000924872996 1042445794 /nfs/dbraw/zinc/44/57/94/1042445794.db2.gz UDCVEYBECNLZQC-HZMBPMFUSA-N 1 2 308.328 4.004 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@]1(C)CC=C(C)CC1 ZINC000614280669 1042450936 /nfs/dbraw/zinc/45/09/36/1042450936.db2.gz DULKWZVPMOUHKB-IBGZPJMESA-N 1 2 309.413 4.460 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CCCc2c(cnn2C)C1 ZINC000411842899 1042462675 /nfs/dbraw/zinc/46/26/75/1042462675.db2.gz JTHNMKRKBBOXQZ-NSHDSACASA-N 1 2 324.255 4.236 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCCc2c(cnn2C)C1 ZINC000411842899 1042462679 /nfs/dbraw/zinc/46/26/79/1042462679.db2.gz JTHNMKRKBBOXQZ-NSHDSACASA-N 1 2 324.255 4.236 20 0 DIADLO Cc1ncoc1C[NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl ZINC000894141280 1042469193 /nfs/dbraw/zinc/46/91/93/1042469193.db2.gz DUROXLWUOYZYSY-SSDOTTSWSA-N 1 2 303.164 4.280 20 0 DIADLO Clc1ccccc1-c1ccc(C[NH+]2CC3(C2)CCCCO3)o1 ZINC001204725707 1042471296 /nfs/dbraw/zinc/47/12/96/1042471296.db2.gz PPRNEWXRQJUWOS-UHFFFAOYSA-N 1 2 317.816 4.355 20 0 DIADLO Cc1ccc(C)c(NC(=O)C[N@@H+](C)[C@H](C)c2ccccc2F)c1 ZINC000052074434 1042474161 /nfs/dbraw/zinc/47/41/61/1042474161.db2.gz RBWNPCWRLLXWIC-OAHLLOKOSA-N 1 2 314.404 4.074 20 0 DIADLO Cc1ccc(C)c(NC(=O)C[N@H+](C)[C@H](C)c2ccccc2F)c1 ZINC000052074434 1042474164 /nfs/dbraw/zinc/47/41/64/1042474164.db2.gz RBWNPCWRLLXWIC-OAHLLOKOSA-N 1 2 314.404 4.074 20 0 DIADLO CCCc1ccc([C@H]([NH2+]Cc2cnc[nH]2)c2cccs2)cc1 ZINC000894152607 1042474198 /nfs/dbraw/zinc/47/41/98/1042474198.db2.gz OTPZRQPFBNRNKY-SFHVURJKSA-N 1 2 311.454 4.303 20 0 DIADLO COc1cccc(-c2csc(C[NH+]3CCC(F)(F)CC3)n2)c1 ZINC000894178920 1042497593 /nfs/dbraw/zinc/49/75/93/1042497593.db2.gz QYSXCEPMAPBZRL-UHFFFAOYSA-N 1 2 324.396 4.050 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[N@H+](C)Cc1csc2ccccc12 ZINC000052806506 1042518752 /nfs/dbraw/zinc/51/87/52/1042518752.db2.gz DUFREEOIIINCGX-NSHDSACASA-N 1 2 313.426 4.355 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[N@@H+](C)Cc1csc2ccccc12 ZINC000052806506 1042518756 /nfs/dbraw/zinc/51/87/56/1042518756.db2.gz DUFREEOIIINCGX-NSHDSACASA-N 1 2 313.426 4.355 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@@H]2CCc3c2c(F)ccc3F)o1 ZINC000513344268 1042535615 /nfs/dbraw/zinc/53/56/15/1042535615.db2.gz YZKSIDRJBOFVEX-CVEARBPZSA-N 1 2 321.367 4.085 20 0 DIADLO Fc1cccc(F)c1C[N@H+](Cc1ccccn1)C1CCCC1 ZINC000513478901 1042545941 /nfs/dbraw/zinc/54/59/41/1042545941.db2.gz GUKLKNLALJVKSY-UHFFFAOYSA-N 1 2 302.368 4.305 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](Cc1ccccn1)C1CCCC1 ZINC000513478901 1042545944 /nfs/dbraw/zinc/54/59/44/1042545944.db2.gz GUKLKNLALJVKSY-UHFFFAOYSA-N 1 2 302.368 4.305 20 0 DIADLO Fc1cccc(F)c1C[N@H+](Cc1cccnc1)C1CCCC1 ZINC000513472722 1042546127 /nfs/dbraw/zinc/54/61/27/1042546127.db2.gz KSRXUKOPJPWNPV-UHFFFAOYSA-N 1 2 302.368 4.305 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](Cc1cccnc1)C1CCCC1 ZINC000513472722 1042546132 /nfs/dbraw/zinc/54/61/32/1042546132.db2.gz KSRXUKOPJPWNPV-UHFFFAOYSA-N 1 2 302.368 4.305 20 0 DIADLO COc1ccccc1-c1ccc([C@@H](C)[N@H+](C)Cc2cnc[nH]2)cc1 ZINC000280491929 1042574120 /nfs/dbraw/zinc/57/41/20/1042574120.db2.gz OXSUJWORDBHYNV-OAHLLOKOSA-N 1 2 321.424 4.278 20 0 DIADLO COc1ccccc1-c1ccc([C@@H](C)[N@@H+](C)Cc2cnc[nH]2)cc1 ZINC000280491929 1042574124 /nfs/dbraw/zinc/57/41/24/1042574124.db2.gz OXSUJWORDBHYNV-OAHLLOKOSA-N 1 2 321.424 4.278 20 0 DIADLO Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000280719470 1042578027 /nfs/dbraw/zinc/57/80/27/1042578027.db2.gz BZFHMWFAOJRXOX-QGZVFWFLSA-N 1 2 320.396 4.012 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](c2c(Cl)cccc2Cl)C2CC2)nn1 ZINC000414453263 1042599740 /nfs/dbraw/zinc/59/97/40/1042599740.db2.gz MVSDGAPKUCSQFZ-MRXNPFEDSA-N 1 2 322.239 4.333 20 0 DIADLO OCC[C@H]1CCCN(c2cc[nH+]c3cc(F)c(Cl)cc32)CC1 ZINC000420634469 1042610489 /nfs/dbraw/zinc/61/04/89/1042610489.db2.gz DAVRHQHAMVPFBD-LBPRGKRZSA-N 1 2 322.811 4.016 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NC[C@@H]2CC23CCSCC3)c1 ZINC000420650099 1042610788 /nfs/dbraw/zinc/61/07/88/1042610788.db2.gz HDRIFHNJJSJTNX-NSHDSACASA-N 1 2 302.365 4.046 20 0 DIADLO CCC[C@@H](NC(=O)NCc1cc(C)[nH+]c(C)c1)c1ccccc1 ZINC000420769461 1042612953 /nfs/dbraw/zinc/61/29/53/1042612953.db2.gz XWLKYKILRHWEBA-GOSISDBHSA-N 1 2 311.429 4.039 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2ccc(Cl)c3ccccc23)n1 ZINC000420937856 1042615440 /nfs/dbraw/zinc/61/54/40/1042615440.db2.gz LQGRPIANVLHBOH-SNVBAGLBSA-N 1 2 301.777 4.035 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2ccc(Cl)c3ccccc23)n1 ZINC000420937854 1042615551 /nfs/dbraw/zinc/61/55/51/1042615551.db2.gz LQGRPIANVLHBOH-JTQLQIEISA-N 1 2 301.777 4.035 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)n1 ZINC000420943905 1042616888 /nfs/dbraw/zinc/61/68/88/1042616888.db2.gz ITMVHWZAAVGYOM-CYBMUJFWSA-N 1 2 317.399 4.409 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)n1 ZINC000420943905 1042616891 /nfs/dbraw/zinc/61/68/91/1042616891.db2.gz ITMVHWZAAVGYOM-CYBMUJFWSA-N 1 2 317.399 4.409 20 0 DIADLO O=C(C[N@H+]1CCC[C@H](CC(F)(F)F)C1)c1c[nH]c2ccccc12 ZINC000420955278 1042618072 /nfs/dbraw/zinc/61/80/72/1042618072.db2.gz WCJFJEMGTSVYLO-GFCCVEGCSA-N 1 2 324.346 4.015 20 0 DIADLO O=C(C[N@@H+]1CCC[C@H](CC(F)(F)F)C1)c1c[nH]c2ccccc12 ZINC000420955278 1042618075 /nfs/dbraw/zinc/61/80/75/1042618075.db2.gz WCJFJEMGTSVYLO-GFCCVEGCSA-N 1 2 324.346 4.015 20 0 DIADLO CC(C)Cc1noc(C[N@H+](C(C)C)[C@@H](C)c2ccsc2)n1 ZINC000421005463 1042620583 /nfs/dbraw/zinc/62/05/83/1042620583.db2.gz JIFRCYNYPXJNHP-ZDUSSCGKSA-N 1 2 307.463 4.301 20 0 DIADLO CC(C)Cc1noc(C[N@@H+](C(C)C)[C@@H](C)c2ccsc2)n1 ZINC000421005463 1042620585 /nfs/dbraw/zinc/62/05/85/1042620585.db2.gz JIFRCYNYPXJNHP-ZDUSSCGKSA-N 1 2 307.463 4.301 20 0 DIADLO CCCn1c(C)nnc1C[N@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000421004833 1042621228 /nfs/dbraw/zinc/62/12/28/1042621228.db2.gz IQXYBMADTXVFPQ-ZDUSSCGKSA-N 1 2 306.479 4.030 20 0 DIADLO CCCn1c(C)nnc1C[N@@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000421004833 1042621229 /nfs/dbraw/zinc/62/12/29/1042621229.db2.gz IQXYBMADTXVFPQ-ZDUSSCGKSA-N 1 2 306.479 4.030 20 0 DIADLO Cc1cc(CNC(=O)Nc2cccc(C(C)(F)F)c2)cc(C)[nH+]1 ZINC000421095308 1042624866 /nfs/dbraw/zinc/62/48/66/1042624866.db2.gz IQVIAOAYPLNUSB-UHFFFAOYSA-N 1 2 319.355 4.132 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc(C3CC3)c(C)c2)cc(C)[nH+]1 ZINC000421091211 1042624890 /nfs/dbraw/zinc/62/48/90/1042624890.db2.gz DNKKSMMFMFEAJH-UHFFFAOYSA-N 1 2 309.413 4.206 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@]2(c3ccc(Cl)cc3)C[C@H]2C)nn1C ZINC000421358804 1042634145 /nfs/dbraw/zinc/63/41/45/1042634145.db2.gz UWMQEIXYHRUAKZ-QLJPJBMISA-N 1 2 324.255 4.060 20 0 DIADLO Cc1cc(C[NH2+][C@H](CCc2ccccc2)C(F)F)cc(C)n1 ZINC000421385555 1042635131 /nfs/dbraw/zinc/63/51/31/1042635131.db2.gz QELSUOZPBOEIJU-QGZVFWFLSA-N 1 2 304.384 4.055 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nc(-c3ccsc3)no2)ccc1F ZINC000271769139 1042667763 /nfs/dbraw/zinc/66/77/63/1042667763.db2.gz IAOYRFAJQZGUOY-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc2c(ccc3ccccc23)o1)c1nncn1C ZINC000271863412 1042671141 /nfs/dbraw/zinc/67/11/41/1042671141.db2.gz KUXBKWKEAOPMAN-QWHCGFSZSA-N 1 2 320.396 4.126 20 0 DIADLO C[C@H]([NH2+]C1(c2cccc(Br)c2)CC1)c1cscn1 ZINC000271944145 1042672992 /nfs/dbraw/zinc/67/29/92/1042672992.db2.gz ALVYLAZQFCEPIE-JTQLQIEISA-N 1 2 323.259 4.246 20 0 DIADLO Cc1cc([C@@H]([NH2+][C@H](C)c2nc(C(C)C)no2)C2CC2)ccc1F ZINC000272064367 1042676223 /nfs/dbraw/zinc/67/62/23/1042676223.db2.gz INZOFRKBOICJDU-WBMJQRKESA-N 1 2 317.408 4.442 20 0 DIADLO COc1cc(C)c([C@H](C)Nc2ccc3c(c2)CC[NH2+]3)cc1OC ZINC000423221747 1042701107 /nfs/dbraw/zinc/70/11/07/1042701107.db2.gz XXBKPZPBZHIEND-ZDUSSCGKSA-N 1 2 312.413 4.153 20 0 DIADLO CC[C@H](C)n1ncc(NCc2c[nH+]cn2C(C)C)c1C1CC1 ZINC000424177650 1042727379 /nfs/dbraw/zinc/72/73/79/1042727379.db2.gz QBYXUYDALHSXHL-ZDUSSCGKSA-N 1 2 301.438 4.121 20 0 DIADLO CCCc1c(NCc2c[nH+]cn2C(C)C)cnn1-c1ccccc1 ZINC000424160316 1042728331 /nfs/dbraw/zinc/72/83/31/1042728331.db2.gz ANJPEQHFOCEFLD-UHFFFAOYSA-N 1 2 323.444 4.214 20 0 DIADLO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1nc(C)cs1 ZINC000424207249 1042729904 /nfs/dbraw/zinc/72/99/04/1042729904.db2.gz XNGBQRIFULJZGP-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO CCCc1ncc(C[NH2+][C@H](C)c2ccc(OC)cc2Cl)o1 ZINC000424331244 1042734689 /nfs/dbraw/zinc/73/46/89/1042734689.db2.gz JIPAVFPYWNTOKR-LLVKDONJSA-N 1 2 308.809 4.140 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2Cl)nn1C ZINC000282162661 1042783736 /nfs/dbraw/zinc/78/37/36/1042783736.db2.gz LTOCDNLWXFMEFT-GHMZBOCLSA-N 1 2 312.244 4.447 20 0 DIADLO CC(C)n1cncc1C[N@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000425319277 1042791295 /nfs/dbraw/zinc/79/12/95/1042791295.db2.gz AQOJMTHZHCACBP-KBXCAEBGSA-N 1 2 313.445 4.345 20 0 DIADLO CC(C)n1cncc1C[N@@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000425319277 1042791301 /nfs/dbraw/zinc/79/13/01/1042791301.db2.gz AQOJMTHZHCACBP-KBXCAEBGSA-N 1 2 313.445 4.345 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC([C@H]3CCCCO3)CC2)c1 ZINC000664483423 1042795706 /nfs/dbraw/zinc/79/57/06/1042795706.db2.gz XSGZRGDRMSXDKH-GOSISDBHSA-N 1 2 314.404 4.159 20 0 DIADLO FC1(F)CCC12C[NH+](Cc1ccc(Oc3ccccc3)o1)C2 ZINC000514979692 1042802857 /nfs/dbraw/zinc/80/28/57/1042802857.db2.gz KMMUMOGSUIXJMU-UHFFFAOYSA-N 1 2 305.324 4.303 20 0 DIADLO COc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1cscn1)CCS2 ZINC000515357153 1042817137 /nfs/dbraw/zinc/81/71/37/1042817137.db2.gz WFXCZLRWIVWHSE-GWCFXTLKSA-N 1 2 306.456 4.039 20 0 DIADLO COc1cccc2c(NCc3noc4c3CCCC4)c(C)c[nH+]c12 ZINC000515398166 1042818071 /nfs/dbraw/zinc/81/80/71/1042818071.db2.gz NFJWDIRGFXSGIW-UHFFFAOYSA-N 1 2 323.396 4.031 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2nc(C(F)F)no2)C(C)C)cc1 ZINC000425424910 1042820119 /nfs/dbraw/zinc/82/01/19/1042820119.db2.gz NZIGHYCQYNTDHI-CQSZACIVSA-N 1 2 309.360 4.057 20 0 DIADLO Cc1ccccc1[C@H]([NH2+]Cc1nc(C(F)F)no1)C(C)(C)C ZINC000425454365 1042826202 /nfs/dbraw/zinc/82/62/02/1042826202.db2.gz GQEPOEVDYCOEOC-ZDUSSCGKSA-N 1 2 309.360 4.193 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@@H](C)c2cccs2)c(C)[nH+]1 ZINC000436491814 1042839934 /nfs/dbraw/zinc/83/99/34/1042839934.db2.gz IHXBKQCJIKTMCS-ZDUSSCGKSA-N 1 2 303.431 4.293 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@@H](c2cnn(C)c2)c2ccccc2)o1 ZINC000366673049 1042862634 /nfs/dbraw/zinc/86/26/34/1042862634.db2.gz CXBYLLQBRHYHDK-IFXJQAMLSA-N 1 2 309.413 4.016 20 0 DIADLO C[C@@H]1CC=C(c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)CC1 ZINC000517072811 1042865616 /nfs/dbraw/zinc/86/56/16/1042865616.db2.gz HHNZMFOTWHYINL-CQSZACIVSA-N 1 2 320.396 4.185 20 0 DIADLO Fc1cccc(F)c1C[N@H+](C/C=C/c1ccncc1)C1CC1 ZINC000425984458 1042892718 /nfs/dbraw/zinc/89/27/18/1042892718.db2.gz IGSWIOHJPCDICD-NSCUHMNNSA-N 1 2 300.352 4.038 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](C/C=C/c1ccncc1)C1CC1 ZINC000425984458 1042892722 /nfs/dbraw/zinc/89/27/22/1042892722.db2.gz IGSWIOHJPCDICD-NSCUHMNNSA-N 1 2 300.352 4.038 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2cnn(C3CCC3)c2)cs1 ZINC000925034479 1042901547 /nfs/dbraw/zinc/90/15/47/1042901547.db2.gz SAVBRJGSNWGVLL-NEPJUHHUSA-N 1 2 304.463 4.039 20 0 DIADLO Fc1cc(Br)cc(F)c1C[NH+]1CCC2(CC2)CC1 ZINC001141554725 1042916931 /nfs/dbraw/zinc/91/69/31/1042916931.db2.gz IGIOIGWYUAFEEW-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1nnc(-c2ccc(C)cc2)o1 ZINC000073603699 1042945251 /nfs/dbraw/zinc/94/52/51/1042945251.db2.gz NXUYHVJXZUESJI-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1nnc(-c2ccc(C)cc2)o1 ZINC000073603699 1042945252 /nfs/dbraw/zinc/94/52/52/1042945252.db2.gz NXUYHVJXZUESJI-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO COc1ccc(C[N@H+](Cc2cccnc2)Cc2ccccc2C)o1 ZINC000894457567 1042958806 /nfs/dbraw/zinc/95/88/06/1042958806.db2.gz DCVYAKYJOORBNG-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1ccc(C[N@@H+](Cc2cccnc2)Cc2ccccc2C)o1 ZINC000894457567 1042958809 /nfs/dbraw/zinc/95/88/09/1042958809.db2.gz DCVYAKYJOORBNG-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO CC1(C)C[N@H+](Cc2ccccc2OC2CC2)[C@H]1c1cccnc1 ZINC000664821640 1042963072 /nfs/dbraw/zinc/96/30/72/1042963072.db2.gz TYLGVEZZRYIUIF-IBGZPJMESA-N 1 2 308.425 4.206 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccccc2OC2CC2)[C@H]1c1cccnc1 ZINC000664821640 1042963073 /nfs/dbraw/zinc/96/30/73/1042963073.db2.gz TYLGVEZZRYIUIF-IBGZPJMESA-N 1 2 308.425 4.206 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000894705677 1042974203 /nfs/dbraw/zinc/97/42/03/1042974203.db2.gz BAVAKUMXAYRQPS-GHMZBOCLSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000894705677 1042974205 /nfs/dbraw/zinc/97/42/05/1042974205.db2.gz BAVAKUMXAYRQPS-GHMZBOCLSA-N 1 2 304.356 4.135 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2CCOc2ccccc2Cl)cs1 ZINC000426768253 1042980148 /nfs/dbraw/zinc/98/01/48/1042980148.db2.gz WORIMEYRXAASGG-OAHLLOKOSA-N 1 2 322.861 4.321 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2CCOc2ccccc2Cl)cs1 ZINC000426768253 1042980153 /nfs/dbraw/zinc/98/01/53/1042980153.db2.gz WORIMEYRXAASGG-OAHLLOKOSA-N 1 2 322.861 4.321 20 0 DIADLO COCC[N@H+](Cc1nc(C2CC2)cs1)[C@@H](C)c1ccccc1 ZINC000342663238 1042986088 /nfs/dbraw/zinc/98/60/88/1042986088.db2.gz LVOKGZCHWULRDH-AWEZNQCLSA-N 1 2 316.470 4.230 20 0 DIADLO COCC[N@@H+](Cc1nc(C2CC2)cs1)[C@@H](C)c1ccccc1 ZINC000342663238 1042986089 /nfs/dbraw/zinc/98/60/89/1042986089.db2.gz LVOKGZCHWULRDH-AWEZNQCLSA-N 1 2 316.470 4.230 20 0 DIADLO CC[C@@H](NC(=O)CCCn1cc[nH+]c1)c1cccc2ccccc21 ZINC000894855180 1042989816 /nfs/dbraw/zinc/98/98/16/1042989816.db2.gz NXAXYSSTNSGYSD-LJQANCHMSA-N 1 2 321.424 4.084 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1cn2c(n1)CCCC2 ZINC000925095254 1043014221 /nfs/dbraw/zinc/01/42/21/1043014221.db2.gz SRFWQZVEMGMSQS-NWDGAFQWSA-N 1 2 321.827 4.424 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000441031539 1043017058 /nfs/dbraw/zinc/01/70/58/1043017058.db2.gz PDRQIOBKAWPBEU-AWEZNQCLSA-N 1 2 309.388 4.409 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000441031539 1043017064 /nfs/dbraw/zinc/01/70/64/1043017064.db2.gz PDRQIOBKAWPBEU-AWEZNQCLSA-N 1 2 309.388 4.409 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1cc(-c3ccccc3)no1)CC2 ZINC000441026969 1043017146 /nfs/dbraw/zinc/01/71/46/1043017146.db2.gz CBWXMWOCBSJCHV-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1cc(-c3ccccc3)no1)CC2 ZINC000441026969 1043017150 /nfs/dbraw/zinc/01/71/50/1043017150.db2.gz CBWXMWOCBSJCHV-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO C[N@@H+](Cc1coc(-c2ccc(F)cc2)n1)Cc1cccs1 ZINC000073881379 1043020039 /nfs/dbraw/zinc/02/00/39/1043020039.db2.gz KUJAFXJVKWDQDT-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@H+](Cc1coc(-c2ccc(F)cc2)n1)Cc1cccs1 ZINC000073881379 1043020045 /nfs/dbraw/zinc/02/00/45/1043020045.db2.gz KUJAFXJVKWDQDT-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO CCCc1nc(C[N@@H+](CCC)[C@@H](CC)c2ccccc2)no1 ZINC000520171511 1043020670 /nfs/dbraw/zinc/02/06/70/1043020670.db2.gz OWPYHFOSXXPIQY-INIZCTEOSA-N 1 2 301.434 4.385 20 0 DIADLO CCCc1nc(C[N@H+](CCC)[C@@H](CC)c2ccccc2)no1 ZINC000520171511 1043020674 /nfs/dbraw/zinc/02/06/74/1043020674.db2.gz OWPYHFOSXXPIQY-INIZCTEOSA-N 1 2 301.434 4.385 20 0 DIADLO CCC[N@H+](Cc1nnc(OCC)s1)[C@@H](CC)c1ccccc1 ZINC000520171353 1043020916 /nfs/dbraw/zinc/02/09/16/1043020916.db2.gz FFYREGVYTXMZQY-HNNXBMFYSA-N 1 2 319.474 4.300 20 0 DIADLO CCC[N@@H+](Cc1nnc(OCC)s1)[C@@H](CC)c1ccccc1 ZINC000520171353 1043020921 /nfs/dbraw/zinc/02/09/21/1043020921.db2.gz FFYREGVYTXMZQY-HNNXBMFYSA-N 1 2 319.474 4.300 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2c(Cl)cccc2OC)c(F)c1 ZINC000188278134 1043020966 /nfs/dbraw/zinc/02/09/66/1043020966.db2.gz NKBASAWFOMLGKN-LLVKDONJSA-N 1 2 323.795 4.347 20 0 DIADLO CC(C)[N@@H+](Cc1ccn(-c2ccc(F)cc2)n1)Cc1ccco1 ZINC000441289940 1043033821 /nfs/dbraw/zinc/03/38/21/1043033821.db2.gz VVICBWVHQYDIHH-UHFFFAOYSA-N 1 2 313.376 4.015 20 0 DIADLO CC(C)[N@H+](Cc1ccn(-c2ccc(F)cc2)n1)Cc1ccco1 ZINC000441289940 1043033826 /nfs/dbraw/zinc/03/38/26/1043033826.db2.gz VVICBWVHQYDIHH-UHFFFAOYSA-N 1 2 313.376 4.015 20 0 DIADLO Cc1cc(F)cc(C[N@H+](C)Cc2nc3ccccc3s2)c1 ZINC001143580726 1043037459 /nfs/dbraw/zinc/03/74/59/1043037459.db2.gz TWXQNLTWUVDNTG-UHFFFAOYSA-N 1 2 300.402 4.376 20 0 DIADLO Cc1cc(F)cc(C[N@@H+](C)Cc2nc3ccccc3s2)c1 ZINC001143580726 1043037463 /nfs/dbraw/zinc/03/74/63/1043037463.db2.gz TWXQNLTWUVDNTG-UHFFFAOYSA-N 1 2 300.402 4.376 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000520383639 1043041031 /nfs/dbraw/zinc/04/10/31/1043041031.db2.gz JKVNLWULWLKAAN-BIENJYKASA-N 1 2 317.379 4.488 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000520383639 1043041033 /nfs/dbraw/zinc/04/10/33/1043041033.db2.gz JKVNLWULWLKAAN-BIENJYKASA-N 1 2 317.379 4.488 20 0 DIADLO CCc1nc(C[N@H+](C)CCSc2ccccc2F)cs1 ZINC000520387769 1043041455 /nfs/dbraw/zinc/04/14/55/1043041455.db2.gz KEQCHFIPJLMLDD-UHFFFAOYSA-N 1 2 310.463 4.069 20 0 DIADLO CCc1nc(C[N@@H+](C)CCSc2ccccc2F)cs1 ZINC000520387769 1043041460 /nfs/dbraw/zinc/04/14/60/1043041460.db2.gz KEQCHFIPJLMLDD-UHFFFAOYSA-N 1 2 310.463 4.069 20 0 DIADLO C[C@@H](CC[N@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894960516 1043051942 /nfs/dbraw/zinc/05/19/42/1043051942.db2.gz MYYJEIDNHVHFRU-QFBILLFUSA-N 1 2 320.440 4.020 20 0 DIADLO C[C@@H](CC[N@@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894960516 1043051949 /nfs/dbraw/zinc/05/19/49/1043051949.db2.gz MYYJEIDNHVHFRU-QFBILLFUSA-N 1 2 320.440 4.020 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1nc(Cc2ccccc2)no1 ZINC000173791195 1043053076 /nfs/dbraw/zinc/05/30/76/1043053076.db2.gz IKAAQLIPMBDMEL-LSDHHAIUSA-N 1 2 307.397 4.072 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1)c1nc(Cc2ccccc2)no1 ZINC000173791168 1043053509 /nfs/dbraw/zinc/05/35/09/1043053509.db2.gz IKAAQLIPMBDMEL-GJZGRUSLSA-N 1 2 307.397 4.072 20 0 DIADLO C[C@H](CC[N@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894960517 1043053469 /nfs/dbraw/zinc/05/34/69/1043053469.db2.gz MYYJEIDNHVHFRU-VQIMIIECSA-N 1 2 320.440 4.020 20 0 DIADLO C[C@H](CC[N@@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894960517 1043053477 /nfs/dbraw/zinc/05/34/77/1043053477.db2.gz MYYJEIDNHVHFRU-VQIMIIECSA-N 1 2 320.440 4.020 20 0 DIADLO CC[C@@H](C[N@H+](C)[C@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894963399 1043054690 /nfs/dbraw/zinc/05/46/90/1043054690.db2.gz YUVZLKHNOBJOOI-LPHOPBHVSA-N 1 2 320.440 4.020 20 0 DIADLO CC[C@@H](C[N@@H+](C)[C@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894963399 1043054702 /nfs/dbraw/zinc/05/47/02/1043054702.db2.gz YUVZLKHNOBJOOI-LPHOPBHVSA-N 1 2 320.440 4.020 20 0 DIADLO CC[C@H](C[N@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894963401 1043055539 /nfs/dbraw/zinc/05/55/39/1043055539.db2.gz YUVZLKHNOBJOOI-VQIMIIECSA-N 1 2 320.440 4.020 20 0 DIADLO CC[C@H](C[N@@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894963401 1043055547 /nfs/dbraw/zinc/05/55/47/1043055547.db2.gz YUVZLKHNOBJOOI-VQIMIIECSA-N 1 2 320.440 4.020 20 0 DIADLO CC[C@H](C[N@H+](C)[C@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894963398 1043055618 /nfs/dbraw/zinc/05/56/18/1043055618.db2.gz YUVZLKHNOBJOOI-APWZRJJASA-N 1 2 320.440 4.020 20 0 DIADLO CC[C@H](C[N@@H+](C)[C@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894963398 1043055630 /nfs/dbraw/zinc/05/56/30/1043055630.db2.gz YUVZLKHNOBJOOI-APWZRJJASA-N 1 2 320.440 4.020 20 0 DIADLO Cc1cncc([C@@H]2CCCN2c2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC000895039288 1043069518 /nfs/dbraw/zinc/06/95/18/1043069518.db2.gz XUIWLDVFQMTXSO-KRWDZBQOSA-N 1 2 308.429 4.097 20 0 DIADLO C[C@H]([NH2+]Cc1cccnc1F)c1nc(-c2ccccc2)cs1 ZINC000794831947 1043071276 /nfs/dbraw/zinc/07/12/76/1043071276.db2.gz AIQQWYSUIWTHSA-LBPRGKRZSA-N 1 2 313.401 4.195 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cnc(Cl)c(F)c2)c1 ZINC000865290979 1043079570 /nfs/dbraw/zinc/07/95/70/1043079570.db2.gz PXJGDHFBDRSYRC-UHFFFAOYSA-N 1 2 311.813 4.134 20 0 DIADLO FC(F)c1ccc(CNc2ccc([NH+]3CCCC3)cc2)cn1 ZINC000865420868 1043095302 /nfs/dbraw/zinc/09/53/02/1043095302.db2.gz KNKDVCPGRBWUQS-UHFFFAOYSA-N 1 2 303.356 4.232 20 0 DIADLO CC(C)n1cncc1C[N@@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000425342779 1043098726 /nfs/dbraw/zinc/09/87/26/1043098726.db2.gz ZZDUHGUXLGDNMP-QGZVFWFLSA-N 1 2 324.428 4.332 20 0 DIADLO CC(C)n1cncc1C[N@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000425342779 1043098740 /nfs/dbraw/zinc/09/87/40/1043098740.db2.gz ZZDUHGUXLGDNMP-QGZVFWFLSA-N 1 2 324.428 4.332 20 0 DIADLO CC(C)n1cncc1C[N@@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000425342776 1043099344 /nfs/dbraw/zinc/09/93/44/1043099344.db2.gz ZZDUHGUXLGDNMP-KRWDZBQOSA-N 1 2 324.428 4.332 20 0 DIADLO CC(C)n1cncc1C[N@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000425342776 1043099353 /nfs/dbraw/zinc/09/93/53/1043099353.db2.gz ZZDUHGUXLGDNMP-KRWDZBQOSA-N 1 2 324.428 4.332 20 0 DIADLO Clc1ccc(C2([NH2+]Cc3cn(C4CC4)cn3)CC2)cc1Cl ZINC000865443717 1043099992 /nfs/dbraw/zinc/09/99/92/1043099992.db2.gz BVDSTBHLTXQXTK-UHFFFAOYSA-N 1 2 322.239 4.304 20 0 DIADLO CCOc1cc(F)cc(C[NH2+][C@@H](C)c2csc(CC)n2)c1 ZINC000865459107 1043101064 /nfs/dbraw/zinc/10/10/64/1043101064.db2.gz XYIBQRLBSDTAJL-NSHDSACASA-N 1 2 308.422 4.094 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2ccc(OC(F)F)cc2F)s1 ZINC000865485769 1043105449 /nfs/dbraw/zinc/10/54/49/1043105449.db2.gz URVBFLUCVCYXHJ-VIFPVBQESA-N 1 2 316.348 4.043 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2ccccc2Cl)cs1 ZINC000177637131 1043109682 /nfs/dbraw/zinc/10/96/82/1043109682.db2.gz LYDRYOCQOJOHKL-GHMZBOCLSA-N 1 2 310.850 4.355 20 0 DIADLO COc1ccc(C[N@H+](C)[C@H](C)c2ncc(C(C)(C)C)o2)cc1 ZINC000177633265 1043110342 /nfs/dbraw/zinc/11/03/42/1043110342.db2.gz PWZCRBKWITWZQN-CYBMUJFWSA-N 1 2 302.418 4.174 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@H](C)c2ncc(C(C)(C)C)o2)cc1 ZINC000177633265 1043110349 /nfs/dbraw/zinc/11/03/49/1043110349.db2.gz PWZCRBKWITWZQN-CYBMUJFWSA-N 1 2 302.418 4.174 20 0 DIADLO Cc1c(Cl)cccc1C[NH2+]Cc1cc(COC(C)(C)C)on1 ZINC000865532926 1043111258 /nfs/dbraw/zinc/11/12/58/1043111258.db2.gz RSFQLUGRDIALFY-UHFFFAOYSA-N 1 2 322.836 4.241 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1nc(C)c(C)s1)CCC2 ZINC000177747199 1043111643 /nfs/dbraw/zinc/11/16/43/1043111643.db2.gz GVKMABAGFJOQPA-ZDUSSCGKSA-N 1 2 307.488 4.034 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1nc(C)c(C)s1)CCC2 ZINC000177747199 1043111654 /nfs/dbraw/zinc/11/16/54/1043111654.db2.gz GVKMABAGFJOQPA-ZDUSSCGKSA-N 1 2 307.488 4.034 20 0 DIADLO FC(F)c1ccnc(C[NH2+]Cc2cccc(CC3CCC3)c2)n1 ZINC000865568817 1043115470 /nfs/dbraw/zinc/11/54/70/1043115470.db2.gz CSPDEBCSGWQUKS-UHFFFAOYSA-N 1 2 317.383 4.047 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)c1cnccn1 ZINC000178053312 1043118266 /nfs/dbraw/zinc/11/82/66/1043118266.db2.gz HCNWMGSSFNPNRU-DTWKUNHWSA-N 1 2 314.191 4.334 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2nc3ccccc3[nH]2)C2CCCCC2)on1 ZINC000865841653 1043140467 /nfs/dbraw/zinc/14/04/67/1043140467.db2.gz GXPMEEWEEDMVDA-GOSISDBHSA-N 1 2 324.428 4.271 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1cc2cnccc2o1 ZINC000865854609 1043142608 /nfs/dbraw/zinc/14/26/08/1043142608.db2.gz QZVKOZNNDYEYKE-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+]C(C)(C)c2cccc(C)c2)n1 ZINC000179584295 1043147355 /nfs/dbraw/zinc/14/73/55/1043147355.db2.gz WJCXLWCYNAMKIB-CYBMUJFWSA-N 1 2 319.474 4.217 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC[C@@H](OC3CCC3)CC2)c1 ZINC000866145173 1043155278 /nfs/dbraw/zinc/15/52/78/1043155278.db2.gz HMGBXPLTQVFSLI-QGZVFWFLSA-N 1 2 314.404 4.302 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(Br)o2)o1 ZINC000189498144 1043155921 /nfs/dbraw/zinc/15/59/21/1043155921.db2.gz LDKLWZGWJMNZAX-BXKDBHETSA-N 1 2 310.191 4.048 20 0 DIADLO CC(C)c1cc(NCc2nn(C)cc2C(F)F)nc(C(C)C)[nH+]1 ZINC000866194918 1043160766 /nfs/dbraw/zinc/16/07/66/1043160766.db2.gz YZWVYZMNDHCRTH-UHFFFAOYSA-N 1 2 323.391 4.007 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)cs1 ZINC000866238673 1043164403 /nfs/dbraw/zinc/16/44/03/1043164403.db2.gz MSGNEBYSSCQARI-MRVPVSSYSA-N 1 2 307.806 4.097 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2nc3ccccc3s2)C2CC2)n1 ZINC000183501282 1043166690 /nfs/dbraw/zinc/16/66/90/1043166690.db2.gz LMOPQGSFDBPQTE-OAHLLOKOSA-N 1 2 315.467 4.302 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1)c1nc(C(C)(C)C)no1 ZINC000073984218 1043167015 /nfs/dbraw/zinc/16/70/15/1043167015.db2.gz IDSMVJYQEREAIA-GHMZBOCLSA-N 1 2 307.825 4.432 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCCN1c1cccc[nH+]1 ZINC000163290716 1043173366 /nfs/dbraw/zinc/17/33/66/1043173366.db2.gz HPWXRLMZUVVOTK-AWEZNQCLSA-N 1 2 318.852 4.237 20 0 DIADLO c1n[nH]c([C@@H]([NH2+]CC2(c3ccccc3)CCC2)C2CCCCC2)n1 ZINC000520481534 1043178570 /nfs/dbraw/zinc/17/85/70/1043178570.db2.gz IKIGJPFYDFUOMR-SFHVURJKSA-N 1 2 324.472 4.138 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2ccc(C(F)F)nc2)cs1 ZINC000639059466 1043182616 /nfs/dbraw/zinc/18/26/16/1043182616.db2.gz GIJLJXZYWQWJIQ-CQSZACIVSA-N 1 2 309.385 4.121 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2ccc(C(F)F)nc2)cs1 ZINC000639059466 1043182630 /nfs/dbraw/zinc/18/26/30/1043182630.db2.gz GIJLJXZYWQWJIQ-CQSZACIVSA-N 1 2 309.385 4.121 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2ccccc2s1)c1nc(C)cs1 ZINC000184351786 1043183574 /nfs/dbraw/zinc/18/35/74/1043183574.db2.gz LCTMNASMPCJZNR-LLVKDONJSA-N 1 2 303.456 4.302 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@@H](C)c2cc3ccccc3s2)n1 ZINC000184358595 1043183700 /nfs/dbraw/zinc/18/37/00/1043183700.db2.gz FBSCZMXCSBEULI-QWRGUYRKSA-N 1 2 301.415 4.259 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](C)c2cc3ccccc3s2)n1 ZINC000184374501 1043184771 /nfs/dbraw/zinc/18/47/71/1043184771.db2.gz OZKXEJLQEXTCJD-NSHDSACASA-N 1 2 301.415 4.088 20 0 DIADLO CCCc1noc(C[NH2+][C@H](C)c2cc3ccccc3s2)n1 ZINC000184374519 1043185247 /nfs/dbraw/zinc/18/52/47/1043185247.db2.gz OZKXEJLQEXTCJD-LLVKDONJSA-N 1 2 301.415 4.088 20 0 DIADLO Cc1cc2cc(C[NH2+][C@@H]3c4ccccc4OC[C@@H]3F)ccc2[nH]1 ZINC000866356510 1043187409 /nfs/dbraw/zinc/18/74/09/1043187409.db2.gz MICYCKZGCYJLLE-QFBILLFUSA-N 1 2 310.372 4.038 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2ccccc2OC(F)F)cs1 ZINC000184676832 1043189355 /nfs/dbraw/zinc/18/93/55/1043189355.db2.gz FYSBDFGDGHBGKW-JTQLQIEISA-N 1 2 312.385 4.158 20 0 DIADLO CC[C@H]1[C@@H](C)CC[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000185599801 1043204812 /nfs/dbraw/zinc/20/48/12/1043204812.db2.gz YVZCKXRJOYTZJY-GWCFXTLKSA-N 1 2 315.244 4.052 20 0 DIADLO CC[C@H]1[C@@H](C)CC[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000185599801 1043204817 /nfs/dbraw/zinc/20/48/17/1043204817.db2.gz YVZCKXRJOYTZJY-GWCFXTLKSA-N 1 2 315.244 4.052 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1C(=O)OC(C)(C)C)c1ccco1 ZINC000866484486 1043209235 /nfs/dbraw/zinc/20/92/35/1043209235.db2.gz WWSWWWCYRRCSGU-ZDUSSCGKSA-N 1 2 301.386 4.086 20 0 DIADLO C[C@H]1CCN(c2ncc(-c3ccccc3)s2)C[C@@H]1n1cc[nH+]c1 ZINC000134092067 1043213578 /nfs/dbraw/zinc/21/35/78/1043213578.db2.gz RKRXTNZDCDCCOA-HOCLYGCPSA-N 1 2 324.453 4.094 20 0 DIADLO CCC[C@H]([NH2+]Cc1ncc(-c2ccccc2)cn1)c1cccnc1 ZINC000186048807 1043213476 /nfs/dbraw/zinc/21/34/76/1043213476.db2.gz HXKJYNAJJJHZRV-IBGZPJMESA-N 1 2 318.424 4.170 20 0 DIADLO COc1ccsc1[C@H](C)[NH2+][C@H](COCC(C)C)c1ccco1 ZINC000186145074 1043215123 /nfs/dbraw/zinc/21/51/23/1043215123.db2.gz KZUIQHIOZRKUKG-UONOGXRCSA-N 1 2 323.458 4.414 20 0 DIADLO CSc1ccc(C[NH2+]Cc2cc(COC(C)(C)C)on2)cc1 ZINC000186413462 1043223621 /nfs/dbraw/zinc/22/36/21/1043223621.db2.gz DXYHWGJDDMGPBP-UHFFFAOYSA-N 1 2 320.458 4.001 20 0 DIADLO CC(C)c1nc([C@@H](C)Nc2ccc(N3CCCC3)[nH+]c2)cs1 ZINC000186467661 1043224575 /nfs/dbraw/zinc/22/45/75/1043224575.db2.gz CGGAYFOZEZONGC-CYBMUJFWSA-N 1 2 316.474 4.435 20 0 DIADLO C[C@H]([NH2+][C@H](CCO)c1ccco1)c1ccc(Cl)cc1Cl ZINC000186542061 1043226977 /nfs/dbraw/zinc/22/69/77/1043226977.db2.gz NAFDEWISXNHXOW-IINYFYTJSA-N 1 2 314.212 4.361 20 0 DIADLO C[C@H]([NH2+][C@@H](CCO)c1ccco1)c1ccc(Cl)cc1Cl ZINC000186542026 1043228245 /nfs/dbraw/zinc/22/82/45/1043228245.db2.gz NAFDEWISXNHXOW-HZMBPMFUSA-N 1 2 314.212 4.361 20 0 DIADLO CO[C@@H](C)c1nc(C[NH+]2CCC(c3ccsc3)CC2)cs1 ZINC000186912816 1043238262 /nfs/dbraw/zinc/23/82/62/1043238262.db2.gz JEJAZFMRPJWMMD-LBPRGKRZSA-N 1 2 322.499 4.292 20 0 DIADLO CCCc1cccc(CNc2ccc([NH+]3CCC(O)CC3)cc2)c1 ZINC000187149091 1043243445 /nfs/dbraw/zinc/24/34/45/1043243445.db2.gz OXUMJFNJWNUUHE-UHFFFAOYSA-N 1 2 324.468 4.212 20 0 DIADLO Cn1c[nH+]cc1CNc1cc(Cl)ccc1OC1CCCC1 ZINC000187396902 1043245492 /nfs/dbraw/zinc/24/54/92/1043245492.db2.gz LNALWZRVMITXNJ-UHFFFAOYSA-N 1 2 305.809 4.007 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)n1 ZINC000074071417 1043268357 /nfs/dbraw/zinc/26/83/57/1043268357.db2.gz HEXLBHTUCGPWQV-NEPJUHHUSA-N 1 2 307.825 4.477 20 0 DIADLO CC/C=C(/F)C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000867976205 1043269183 /nfs/dbraw/zinc/26/91/83/1043269183.db2.gz GKMGLIYIYPHOKR-VIZOYTHASA-N 1 2 313.376 4.088 20 0 DIADLO CCCCCOc1ccc([C@@H](C)[NH2+]Cc2cocn2)cc1OC ZINC000192287362 1043269404 /nfs/dbraw/zinc/26/94/04/1043269404.db2.gz NJLMBXFJDPQMRY-CQSZACIVSA-N 1 2 318.417 4.103 20 0 DIADLO c1csc(-c2nc(C[NH2+][C@@H]3CCCc4occc43)co2)c1 ZINC000192738346 1043275734 /nfs/dbraw/zinc/27/57/34/1043275734.db2.gz VKEIOFBUOGJHSI-CYBMUJFWSA-N 1 2 300.383 4.163 20 0 DIADLO CCCOc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c(OC)c1 ZINC000665211918 1043286133 /nfs/dbraw/zinc/28/61/33/1043286133.db2.gz KIUHWEIBEPQMHI-UHFFFAOYSA-N 1 2 322.408 4.396 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+][C@@H]1COc2ccc(Cl)cc21 ZINC000427866050 1043312344 /nfs/dbraw/zinc/31/23/44/1043312344.db2.gz JSSXEVSEOYCEEC-CQSZACIVSA-N 1 2 312.171 4.356 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@H](c2ccccc2Cl)C(C)C)nn1C ZINC000487407116 1043314985 /nfs/dbraw/zinc/31/49/85/1043314985.db2.gz KXMZDWYOVHJSOB-KRWDZBQOSA-N 1 2 305.853 4.211 20 0 DIADLO Cc1cc(C[N@H+](C)[C@H](c2ccccc2Cl)C(C)C)nn1C ZINC000487407116 1043314994 /nfs/dbraw/zinc/31/49/94/1043314994.db2.gz KXMZDWYOVHJSOB-KRWDZBQOSA-N 1 2 305.853 4.211 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+]Cc2ccc3ccccc3c2)s1 ZINC000268226294 1043315505 /nfs/dbraw/zinc/31/55/05/1043315505.db2.gz SKPHUIYNLJMDAN-UHFFFAOYSA-N 1 2 311.454 4.279 20 0 DIADLO CC(C)c1ccc(C[NH2+]Cc2nnc(C(C)(C)C)s2)cc1 ZINC000268224753 1043315672 /nfs/dbraw/zinc/31/56/72/1043315672.db2.gz SBCTWQDUJFBZBY-UHFFFAOYSA-N 1 2 303.475 4.249 20 0 DIADLO CC[C@@H]([NH2+][C@@H](c1nccn1C)c1ccc(F)cc1)c1ccccc1 ZINC000268777626 1043328291 /nfs/dbraw/zinc/32/82/91/1043328291.db2.gz SCVMEBWJEXJSBH-RTBURBONSA-N 1 2 323.415 4.390 20 0 DIADLO CC[C@@H]([NH2+][C@H](c1nccn1C)c1ccc(F)cc1)c1ccccc1 ZINC000268777623 1043329809 /nfs/dbraw/zinc/32/98/09/1043329809.db2.gz SCVMEBWJEXJSBH-MOPGFXCFSA-N 1 2 323.415 4.390 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2cn(C(C)(C)C)nc2C)cs1 ZINC000268962056 1043346411 /nfs/dbraw/zinc/34/64/11/1043346411.db2.gz XOBDTAMOXQHAPW-PWSUYJOCSA-N 1 2 306.479 4.123 20 0 DIADLO COc1cccc([C@H](C)[NH2+][C@@H](C)c2nc(-c3ccccc3)no2)c1 ZINC000269085046 1043357406 /nfs/dbraw/zinc/35/74/06/1043357406.db2.gz MBYKNNIFLYQYEC-KBPBESRZSA-N 1 2 323.396 4.157 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccccc2OCC2CC2)cs1 ZINC000269414136 1043366404 /nfs/dbraw/zinc/36/64/04/1043366404.db2.gz JWHBZLWPLAEPSW-GFCCVEGCSA-N 1 2 302.443 4.091 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](C)Cc1nccs1 ZINC000269637026 1043372108 /nfs/dbraw/zinc/37/21/08/1043372108.db2.gz JAMHSGNUVZKAEO-SNVBAGLBSA-N 1 2 300.349 4.355 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)Cc1nccs1 ZINC000269637026 1043372117 /nfs/dbraw/zinc/37/21/17/1043372117.db2.gz JAMHSGNUVZKAEO-SNVBAGLBSA-N 1 2 300.349 4.355 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccc(OC(F)F)c(F)c2)cs1 ZINC000269959827 1043377689 /nfs/dbraw/zinc/37/76/89/1043377689.db2.gz IVRSBNMWYZVDMB-MRVPVSSYSA-N 1 2 316.348 4.043 20 0 DIADLO CCC(=CC(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2)CC ZINC000270507458 1043388921 /nfs/dbraw/zinc/38/89/21/1043388921.db2.gz RCRSQWXCWGAUBR-UHFFFAOYSA-N 1 2 321.424 4.287 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2cccc(F)c2)c2ccccn2)c(C)o1 ZINC000123751923 1043389546 /nfs/dbraw/zinc/38/95/46/1043389546.db2.gz AYRWNQLHYUCMGF-LJQANCHMSA-N 1 2 310.372 4.310 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2F)[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270593971 1043391355 /nfs/dbraw/zinc/39/13/55/1043391355.db2.gz KRCBATBJKHKOOW-BLLLJJGKSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270593971 1043391363 /nfs/dbraw/zinc/39/13/63/1043391363.db2.gz KRCBATBJKHKOOW-BLLLJJGKSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1cnc([C@@H]2CCCO2)s1 ZINC000271023534 1043399681 /nfs/dbraw/zinc/39/96/81/1043399681.db2.gz DIOAPFILGIOMHN-FZMZJTMJSA-N 1 2 320.483 4.175 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1cnc([C@@H]2CCCO2)s1 ZINC000271023534 1043399686 /nfs/dbraw/zinc/39/96/86/1043399686.db2.gz DIOAPFILGIOMHN-FZMZJTMJSA-N 1 2 320.483 4.175 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](Cc1ccn(C)n1)Cc1ccccc1 ZINC000271092932 1043401615 /nfs/dbraw/zinc/40/16/15/1043401615.db2.gz WMBKCKGWXXXJOY-HNNXBMFYSA-N 1 2 311.454 4.245 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](Cc1ccn(C)n1)Cc1ccccc1 ZINC000271092932 1043401625 /nfs/dbraw/zinc/40/16/25/1043401625.db2.gz WMBKCKGWXXXJOY-HNNXBMFYSA-N 1 2 311.454 4.245 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2cscn2)c(OCC2CC2)c1 ZINC000271175075 1043404392 /nfs/dbraw/zinc/40/43/92/1043404392.db2.gz UVKFFJGEJRHICS-CYBMUJFWSA-N 1 2 302.443 4.091 20 0 DIADLO CC(C)CCOc1ccccc1C[NH2+][C@@H](C)c1cscn1 ZINC000271117677 1043404649 /nfs/dbraw/zinc/40/46/49/1043404649.db2.gz ITZNYOVMOUGWJT-AWEZNQCLSA-N 1 2 304.459 4.419 20 0 DIADLO CC(C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)c(Cl)c2)[nH]1 ZINC000271434722 1043416562 /nfs/dbraw/zinc/41/65/62/1043416562.db2.gz DRINFIBZGXQJIQ-VHSXEESVSA-N 1 2 310.804 4.132 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2ncc(Cl)s2)cc1Cl ZINC000871933367 1043417044 /nfs/dbraw/zinc/41/70/44/1043417044.db2.gz MZRZFKQIIZDRDW-QMMMGPOBSA-N 1 2 317.241 4.309 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1ccc(Cl)cc1Cl ZINC000271430965 1043417640 /nfs/dbraw/zinc/41/76/40/1043417640.db2.gz BBZBJDSPYTUQOC-YMTOWFKASA-N 1 2 310.228 4.445 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1ccc(Cl)cc1Cl ZINC000271430965 1043417645 /nfs/dbraw/zinc/41/76/45/1043417645.db2.gz BBZBJDSPYTUQOC-YMTOWFKASA-N 1 2 310.228 4.445 20 0 DIADLO CC[C@H]([NH2+][C@H]1CCCc2oc(C)nc21)c1cc(F)ccc1F ZINC000925453649 1043418914 /nfs/dbraw/zinc/41/89/14/1043418914.db2.gz OLVMJHWSJIUIFR-GJZGRUSLSA-N 1 2 306.356 4.380 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCC[C@@H](O)c3ccccc3)c2c1 ZINC000795197049 1043419751 /nfs/dbraw/zinc/41/97/51/1043419751.db2.gz KDGFFHXVPGVZFM-LJQANCHMSA-N 1 2 323.392 4.054 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+](C)[C@H](C)c3ccncc3)o2)cc1 ZINC000271450075 1043419898 /nfs/dbraw/zinc/41/98/98/1043419898.db2.gz XALDVGIOAANKAP-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+](C)[C@H](C)c3ccncc3)o2)cc1 ZINC000271450075 1043419904 /nfs/dbraw/zinc/41/99/04/1043419904.db2.gz XALDVGIOAANKAP-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO CC[N@H+](Cc1cc(C(F)(F)F)n[nH]1)Cc1ccc(Cl)s1 ZINC000442805495 1043421861 /nfs/dbraw/zinc/42/18/61/1043421861.db2.gz ANMOSKBVYYRVIT-UHFFFAOYSA-N 1 2 323.771 4.166 20 0 DIADLO CC[N@@H+](Cc1cc(C(F)(F)F)n[nH]1)Cc1ccc(Cl)s1 ZINC000442805495 1043421870 /nfs/dbraw/zinc/42/18/70/1043421870.db2.gz ANMOSKBVYYRVIT-UHFFFAOYSA-N 1 2 323.771 4.166 20 0 DIADLO CCc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1csc(C)n1 ZINC000271458608 1043422132 /nfs/dbraw/zinc/42/21/32/1043422132.db2.gz JQKNRJYUFMQFPW-ABAIWWIYSA-N 1 2 302.443 4.188 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+][C@@H](C)c1cc(O)ccc1F ZINC000872025593 1043424101 /nfs/dbraw/zinc/42/41/01/1043424101.db2.gz PPNMAVIWYVCMDW-QWRGUYRKSA-N 1 2 307.340 4.091 20 0 DIADLO Clc1ccnc2c1CC[C@@H]2[NH2+][C@@H]1COc2c1cccc2Cl ZINC000925519468 1043424381 /nfs/dbraw/zinc/42/43/81/1043424381.db2.gz RLLPTNWTDJHLRE-UONOGXRCSA-N 1 2 321.207 4.099 20 0 DIADLO CSc1ccc([C@H](C)[NH2+][C@H](C)c2nnc(C(C)C)[nH]2)cc1F ZINC000271473475 1043424949 /nfs/dbraw/zinc/42/49/49/1043424949.db2.gz ISEVVNVPLGMNNL-WDEREUQCSA-N 1 2 322.453 4.201 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+][C@H](C)c1cccc(O)c1F ZINC000872027893 1043426951 /nfs/dbraw/zinc/42/69/51/1043426951.db2.gz GRYBSYDSRBUEHV-SNVBAGLBSA-N 1 2 309.768 4.044 20 0 DIADLO Cc1cc(NC2CCN(c3cccc[nH+]3)CC2)cc(C)c1Cl ZINC000442810318 1043429953 /nfs/dbraw/zinc/42/99/53/1043429953.db2.gz LZENXHLKSRHUTJ-UHFFFAOYSA-N 1 2 315.848 4.433 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nnc(C(C)C)[nH]1)c1cc(F)ccc1F ZINC000271535650 1043430826 /nfs/dbraw/zinc/43/08/26/1043430826.db2.gz QGHUXQJDIRDASP-IINYFYTJSA-N 1 2 308.376 4.008 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nnc(C(C)C)[nH]1)c1ccc(F)cc1F ZINC000271535741 1043431888 /nfs/dbraw/zinc/43/18/88/1043431888.db2.gz QGVBOXZDXSMQHU-YGRLFVJLSA-N 1 2 308.376 4.008 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nnc(C(C)C)[nH]1)c1cc(C)ccc1OC ZINC000271557322 1043436808 /nfs/dbraw/zinc/43/68/08/1043436808.db2.gz SWLDZBYDMQUIAX-UKRRQHHQSA-N 1 2 316.449 4.047 20 0 DIADLO CC(C)(C)[C@H]1C[C@H](Nc2ccc([NH+]3CCCC3)cc2)CCO1 ZINC000872055402 1043439463 /nfs/dbraw/zinc/43/94/63/1043439463.db2.gz HUSIXZKFKCRYIE-SJLPKXTDSA-N 1 2 302.462 4.292 20 0 DIADLO CC(C)(C)[C@H]1C[C@H]([NH2+]c2ccc(N3CCCC3)cc2)CCO1 ZINC000872055402 1043439468 /nfs/dbraw/zinc/43/94/68/1043439468.db2.gz HUSIXZKFKCRYIE-SJLPKXTDSA-N 1 2 302.462 4.292 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@H](C)c1nnc(C(C)C)[nH]1 ZINC000271571769 1043439438 /nfs/dbraw/zinc/43/94/38/1043439438.db2.gz VVKCFNHBJKSXOZ-CMPLNLGQSA-N 1 2 321.494 4.228 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@H](C)c1nnc(C(C)C)[nH]1 ZINC000271593479 1043440704 /nfs/dbraw/zinc/44/07/04/1043440704.db2.gz YPQFEHLYUWIACY-CHWSQXEVSA-N 1 2 312.417 4.395 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2ncc(C3CC3)o2)c1 ZINC000271621925 1043443481 /nfs/dbraw/zinc/44/34/81/1043443481.db2.gz AATKXRHEXWZNSZ-ZDUSSCGKSA-N 1 2 300.402 4.190 20 0 DIADLO COC(=O)c1oc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)cc1C ZINC000558175862 1043449957 /nfs/dbraw/zinc/44/99/57/1043449957.db2.gz KOARBCUUBUQMBC-HNNXBMFYSA-N 1 2 319.426 4.019 20 0 DIADLO COC(=O)c1oc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)cc1C ZINC000558175862 1043449961 /nfs/dbraw/zinc/44/99/61/1043449961.db2.gz KOARBCUUBUQMBC-HNNXBMFYSA-N 1 2 319.426 4.019 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CC(C)(C)Sc2ccccc21)c1csnn1 ZINC000872080864 1043452300 /nfs/dbraw/zinc/45/23/00/1043452300.db2.gz TZAHBNMDGUXBKV-ZYHUDNBSSA-N 1 2 305.472 4.204 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1nnc(-c2ccccc2)[nH]1)c1ccccc1 ZINC000777572658 1043456952 /nfs/dbraw/zinc/45/69/52/1043456952.db2.gz MSUFNSKJQHMUTD-GOSISDBHSA-N 1 2 320.440 4.349 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1nc(-c2ccccc2)n[nH]1)c1ccccc1 ZINC000777572658 1043456960 /nfs/dbraw/zinc/45/69/60/1043456960.db2.gz MSUFNSKJQHMUTD-GOSISDBHSA-N 1 2 320.440 4.349 20 0 DIADLO c1cc(N2CCCCC2)ccc1[NH2+][C@@H](C1CC1)C1CCOCC1 ZINC000925724412 1043457580 /nfs/dbraw/zinc/45/75/80/1043457580.db2.gz AQRGTXXXKSHJEQ-FQEVSTJZSA-N 1 2 314.473 4.294 20 0 DIADLO COc1cc(Cl)ccc1[C@H](C)[NH2+]Cc1ncc(Cl)s1 ZINC000872113756 1043462788 /nfs/dbraw/zinc/46/27/88/1043462788.db2.gz SIXHNIMWFGAGFM-QMMMGPOBSA-N 1 2 317.241 4.309 20 0 DIADLO COc1cc(Cl)ccc1[C@@H](C)[NH2+]Cc1ncc(Cl)s1 ZINC000872113755 1043463344 /nfs/dbraw/zinc/46/33/44/1043463344.db2.gz SIXHNIMWFGAGFM-MRVPVSSYSA-N 1 2 317.241 4.309 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+]Cc2nc(-c3ccncc3)cs2)o1 ZINC000872121075 1043467035 /nfs/dbraw/zinc/46/70/35/1043467035.db2.gz JWOXAXLWRCWWLA-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2cc3cc(C)c(C)cc3o2)n1 ZINC000348817857 1043469952 /nfs/dbraw/zinc/46/99/52/1043469952.db2.gz QMEUYTWWBAWYOL-INIZCTEOSA-N 1 2 311.385 4.078 20 0 DIADLO Cc1noc([C@@H]2CCC[N@H+]2Cc2cc3cc(C)c(C)cc3o2)n1 ZINC000348817857 1043469960 /nfs/dbraw/zinc/46/99/60/1043469960.db2.gz QMEUYTWWBAWYOL-INIZCTEOSA-N 1 2 311.385 4.078 20 0 DIADLO C[C@@H]([NH2+]C1(c2cccc(Br)c2)CCC1)c1ncco1 ZINC000925778486 1043471817 /nfs/dbraw/zinc/47/18/17/1043471817.db2.gz DQMYCLQMIJCGAD-LLVKDONJSA-N 1 2 321.218 4.167 20 0 DIADLO Cc1nonc1C[NH2+][C@@H](C)c1ccccc1SC(C)(C)C ZINC000872136581 1043478052 /nfs/dbraw/zinc/47/80/52/1043478052.db2.gz NHWKGCHJJGSSAH-NSHDSACASA-N 1 2 305.447 4.119 20 0 DIADLO CCCC[C@@H]([NH2+]Cc1nnc(-c2ccccc2)[nH]1)c1ccccc1 ZINC000777579194 1043483932 /nfs/dbraw/zinc/48/39/32/1043483932.db2.gz SWNXSIBUSAOVHR-GOSISDBHSA-N 1 2 320.440 4.493 20 0 DIADLO CCCC[C@@H]([NH2+]Cc1nc(-c2ccccc2)n[nH]1)c1ccccc1 ZINC000777579194 1043483939 /nfs/dbraw/zinc/48/39/39/1043483939.db2.gz SWNXSIBUSAOVHR-GOSISDBHSA-N 1 2 320.440 4.493 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]Cc1nnc(-c2ccccc2)[nH]1 ZINC000777577999 1043485216 /nfs/dbraw/zinc/48/52/16/1043485216.db2.gz GIVZZWHNKWMAQR-PBHICJAKSA-N 1 2 318.424 4.118 20 0 DIADLO CCC[C@H](C)c1noc([C@@H]([NH3+])c2cccc(C(F)(F)F)c2)n1 ZINC000872174825 1043485248 /nfs/dbraw/zinc/48/52/48/1043485248.db2.gz DTHREISDRNKNJH-CABZTGNLSA-N 1 2 313.323 4.040 20 0 DIADLO CCC[C@@H](C)c1noc([C@H]([NH3+])c2cccc(C(F)(F)F)c2)n1 ZINC000872174824 1043485480 /nfs/dbraw/zinc/48/54/80/1043485480.db2.gz DTHREISDRNKNJH-BXKDBHETSA-N 1 2 313.323 4.040 20 0 DIADLO C[C@@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1ccnnc1 ZINC000925909313 1043490811 /nfs/dbraw/zinc/49/08/11/1043490811.db2.gz FLBGNQSMHINDOG-SNVBAGLBSA-N 1 2 308.212 4.123 20 0 DIADLO Cc1ccc(C)c([C@H]2CCC[N@@H+]2Cn2ncsc2=S)c1 ZINC000124079360 1043494375 /nfs/dbraw/zinc/49/43/75/1043494375.db2.gz CLHWLPSNTBHFPW-CQSZACIVSA-N 1 2 305.472 4.086 20 0 DIADLO Cc1ccc(C)c([C@H]2CCC[N@H+]2Cn2ncsc2=S)c1 ZINC000124079360 1043494377 /nfs/dbraw/zinc/49/43/77/1043494377.db2.gz CLHWLPSNTBHFPW-CQSZACIVSA-N 1 2 305.472 4.086 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@H]1CCCOc2cc(F)ccc21 ZINC000925970564 1043501056 /nfs/dbraw/zinc/50/10/56/1043501056.db2.gz VZCDNJGYVYIMPK-LSDHHAIUSA-N 1 2 316.376 4.003 20 0 DIADLO CC[C@H]1CC[C@@H]1Nc1cccc(C[N@H+](C)Cc2cscn2)c1 ZINC000558403902 1043501213 /nfs/dbraw/zinc/50/12/13/1043501213.db2.gz POXUUGYUEAUMBA-YJBOKZPZSA-N 1 2 315.486 4.376 20 0 DIADLO CC[C@H]1CC[C@@H]1Nc1cccc(C[N@@H+](C)Cc2cscn2)c1 ZINC000558403902 1043501222 /nfs/dbraw/zinc/50/12/22/1043501222.db2.gz POXUUGYUEAUMBA-YJBOKZPZSA-N 1 2 315.486 4.376 20 0 DIADLO CCCCOc1ccccc1C[NH2+]Cc1ncc(Cl)s1 ZINC000873166376 1043521116 /nfs/dbraw/zinc/52/11/16/1043521116.db2.gz ZWVVYEOIKUSEKM-UHFFFAOYSA-N 1 2 310.850 4.265 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(C(F)(F)F)nc1 ZINC000873185013 1043524526 /nfs/dbraw/zinc/52/45/26/1043524526.db2.gz ABMHWAHXODWVGE-ZETCQYMHSA-N 1 2 321.755 4.061 20 0 DIADLO FC(F)(C[NH2+][C@@H](c1cccnc1)C1CCC1)c1ccccc1 ZINC000558507630 1043525078 /nfs/dbraw/zinc/52/50/78/1043525078.db2.gz NSKOMGKFSHMLPI-QGZVFWFLSA-N 1 2 302.368 4.304 20 0 DIADLO CC(C)[N@H+](Cc1ccco1)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC000349834451 1043527433 /nfs/dbraw/zinc/52/74/33/1043527433.db2.gz XPUBHJZJWHDTMR-ZDUSSCGKSA-N 1 2 304.459 4.272 20 0 DIADLO CC(C)[N@@H+](Cc1ccco1)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC000349834451 1043527440 /nfs/dbraw/zinc/52/74/40/1043527440.db2.gz XPUBHJZJWHDTMR-ZDUSSCGKSA-N 1 2 304.459 4.272 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC3(CCCC3)OC(C)(C)C2)cs1 ZINC000443346534 1043530214 /nfs/dbraw/zinc/53/02/14/1043530214.db2.gz MWJVQJJTJRNTHE-UHFFFAOYSA-N 1 2 308.491 4.190 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC3(CCCC3)OC(C)(C)C2)cs1 ZINC000443346534 1043530220 /nfs/dbraw/zinc/53/02/20/1043530220.db2.gz MWJVQJJTJRNTHE-UHFFFAOYSA-N 1 2 308.491 4.190 20 0 DIADLO C[C@@H](N[C@H](CC(C)(C)C)C(F)(F)F)c1cn2c([nH+]1)CCCC2 ZINC000926109545 1043531250 /nfs/dbraw/zinc/53/12/50/1043531250.db2.gz LTHZGAUZISMFNW-DGCLKSJQSA-N 1 2 317.399 4.237 20 0 DIADLO COc1ccccc1C[N@H+](Cc1cnc(C(C)C)s1)C1CC1 ZINC000349942167 1043531300 /nfs/dbraw/zinc/53/13/00/1043531300.db2.gz DOUXRZCKTLQZFU-UHFFFAOYSA-N 1 2 316.470 4.440 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1cnc(C(C)C)s1)C1CC1 ZINC000349942167 1043531306 /nfs/dbraw/zinc/53/13/06/1043531306.db2.gz DOUXRZCKTLQZFU-UHFFFAOYSA-N 1 2 316.470 4.440 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2cc(Cl)cc3cccnc32)cs1 ZINC000349992793 1043533498 /nfs/dbraw/zinc/53/34/98/1043533498.db2.gz UFESNGWDDVCQTE-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2cc(Cl)cc3cccnc32)cs1 ZINC000349992793 1043533512 /nfs/dbraw/zinc/53/35/12/1043533512.db2.gz UFESNGWDDVCQTE-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)no1 ZINC000522096477 1043537632 /nfs/dbraw/zinc/53/76/32/1043537632.db2.gz FYTPIWDLDVIOHL-AWEZNQCLSA-N 1 2 319.836 4.055 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)no1 ZINC000522096477 1043537642 /nfs/dbraw/zinc/53/76/42/1043537642.db2.gz FYTPIWDLDVIOHL-AWEZNQCLSA-N 1 2 319.836 4.055 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1nc(-c2ccccc2)cs1 ZINC000350359453 1043545629 /nfs/dbraw/zinc/54/56/29/1043545629.db2.gz SARHZXKHNRLNFJ-CQSZACIVSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1nc(-c2ccccc2)cs1 ZINC000350359453 1043545635 /nfs/dbraw/zinc/54/56/35/1043545635.db2.gz SARHZXKHNRLNFJ-CQSZACIVSA-N 1 2 309.438 4.398 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2nnc(C(C)(C)C)o2)cc1 ZINC000124580702 1043548158 /nfs/dbraw/zinc/54/81/58/1043548158.db2.gz OYUASVSICGMLLV-MRXNPFEDSA-N 1 2 313.445 4.403 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2nnc(C(C)(C)C)o2)cc1 ZINC000124580702 1043548173 /nfs/dbraw/zinc/54/81/73/1043548173.db2.gz OYUASVSICGMLLV-MRXNPFEDSA-N 1 2 313.445 4.403 20 0 DIADLO CC(C)(C)OC(=O)Nc1ccsc1C[N@@H+]1CCC[C@H](F)C1 ZINC000895190853 1043556625 /nfs/dbraw/zinc/55/66/25/1043556625.db2.gz DCNHNGBSSZBWRM-NSHDSACASA-N 1 2 314.426 4.029 20 0 DIADLO CC(C)(C)OC(=O)Nc1ccsc1C[N@H+]1CCC[C@H](F)C1 ZINC000895190853 1043556631 /nfs/dbraw/zinc/55/66/31/1043556631.db2.gz DCNHNGBSSZBWRM-NSHDSACASA-N 1 2 314.426 4.029 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2csc(C(F)(F)F)c2)s1 ZINC000926462450 1043580464 /nfs/dbraw/zinc/58/04/64/1043580464.db2.gz YCUVMJGBVRZFGA-SSDOTTSWSA-N 1 2 321.393 4.032 20 0 DIADLO CCc1nc(C)c(C[NH2+][C@@H](C)c2cc(-c3ccccc3)no2)o1 ZINC000926479930 1043583354 /nfs/dbraw/zinc/58/33/54/1043583354.db2.gz JOJFOWSUKWUYHA-LBPRGKRZSA-N 1 2 311.385 4.051 20 0 DIADLO CCc1noc(C)c1C[NH2+][C@H](c1cccc(C)c1)c1ccccn1 ZINC000926481554 1043584619 /nfs/dbraw/zinc/58/46/19/1043584619.db2.gz LVMWUVFKEFXKFC-HXUWFJFHSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1cc(C2CC2)ccc1F ZINC000926500526 1043588378 /nfs/dbraw/zinc/58/83/78/1043588378.db2.gz DJASVCKBSRNLQO-MRXNPFEDSA-N 1 2 300.377 4.167 20 0 DIADLO Cn1cncc1C[N@@H+]1CCCC[C@H]1c1ccccc1C(F)(F)F ZINC000353150717 1043588732 /nfs/dbraw/zinc/58/87/32/1043588732.db2.gz TUJMIIRWKNSZGB-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1cncc1C[N@H+]1CCCC[C@H]1c1ccccc1C(F)(F)F ZINC000353150717 1043588742 /nfs/dbraw/zinc/58/87/42/1043588742.db2.gz TUJMIIRWKNSZGB-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO CCCc1ncc(C[NH2+][C@H](CCC)c2ncccc2Cl)o1 ZINC000926539918 1043597265 /nfs/dbraw/zinc/59/72/65/1043597265.db2.gz XXFWFANTUKSYRF-CQSZACIVSA-N 1 2 307.825 4.307 20 0 DIADLO COc1cccnc1C[NH2+][C@H](Cc1ccccc1C)c1ccco1 ZINC000926548931 1043599061 /nfs/dbraw/zinc/59/90/61/1043599061.db2.gz DFJFFLZEZHELOY-QGZVFWFLSA-N 1 2 322.408 4.065 20 0 DIADLO COc1cccnc1C[NH2+][C@@H](Cc1ccccc1C)c1ccco1 ZINC000926548928 1043599374 /nfs/dbraw/zinc/59/93/74/1043599374.db2.gz DFJFFLZEZHELOY-KRWDZBQOSA-N 1 2 322.408 4.065 20 0 DIADLO CCSc1cccc(NC(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC000353341504 1043600499 /nfs/dbraw/zinc/60/04/99/1043600499.db2.gz YEDJIYGDGSBKKK-UHFFFAOYSA-N 1 2 312.398 4.090 20 0 DIADLO CCn1ccc(C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2F)n1 ZINC000926577551 1043602751 /nfs/dbraw/zinc/60/27/51/1043602751.db2.gz JSIDVNYAYNCCMO-VIFPVBQESA-N 1 2 316.207 4.200 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H](C)c2cc(C)on2)ccc1OC(C)C ZINC000353410313 1043603675 /nfs/dbraw/zinc/60/36/75/1043603675.db2.gz HBVOLMYNOMSSQM-KGLIPLIRSA-N 1 2 318.417 4.191 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccc(-n2cccn2)cc1 ZINC000777602105 1043604749 /nfs/dbraw/zinc/60/47/49/1043604749.db2.gz GTBVSQSASIHZRO-OAHLLOKOSA-N 1 2 306.413 4.111 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H](C)c2csnn2)cc2ccccc21 ZINC000926590020 1043604948 /nfs/dbraw/zinc/60/49/48/1043604948.db2.gz JCBCZPFEYHSKIY-NWDGAFQWSA-N 1 2 313.426 4.112 20 0 DIADLO CC[C@@](C)([NH2+]Cc1c(Cl)cccc1OC)c1nccs1 ZINC000429682645 1043610594 /nfs/dbraw/zinc/61/05/94/1043610594.db2.gz ZNXZBFCSYMMWDX-OAHLLOKOSA-N 1 2 310.850 4.220 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F)c1nccn1C ZINC000926728309 1043622940 /nfs/dbraw/zinc/62/29/40/1043622940.db2.gz SCBBMHOPUJTTKZ-DTWKUNHWSA-N 1 2 316.207 4.278 20 0 DIADLO COCc1nc(C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)cs1 ZINC000353626036 1043624930 /nfs/dbraw/zinc/62/49/30/1043624930.db2.gz SYQGJVNBXREANM-LBPRGKRZSA-N 1 2 316.426 4.195 20 0 DIADLO Cn1c(Cl)nc(Cl)c1C[NH+]1CCC(c2ccccc2)CC1 ZINC000125412017 1043625137 /nfs/dbraw/zinc/62/51/37/1043625137.db2.gz TVUGPZGIACDIAI-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO COc1c(C)cc(C[N@H+](C)Cc2nc(C)sc2C)cc1C ZINC000443631595 1043629431 /nfs/dbraw/zinc/62/94/31/1043629431.db2.gz LTQHCQGKDHBHHS-UHFFFAOYSA-N 1 2 304.459 4.017 20 0 DIADLO COc1c(C)cc(C[N@@H+](C)Cc2nc(C)sc2C)cc1C ZINC000443631595 1043629436 /nfs/dbraw/zinc/62/94/36/1043629436.db2.gz LTQHCQGKDHBHHS-UHFFFAOYSA-N 1 2 304.459 4.017 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@H]1[NH2+][C@@H]1CCc2c1nccc2Cl ZINC000926859782 1043644565 /nfs/dbraw/zinc/64/45/65/1043644565.db2.gz CTKJNWTZCILVGU-BRWVUGGUSA-N 1 2 316.807 4.338 20 0 DIADLO CCCCC[C@H](C(=O)N1CC[C@H](C)[C@H](n2cc[nH+]c2)C1)C(C)C ZINC000125644502 1043645755 /nfs/dbraw/zinc/64/57/55/1043645755.db2.gz KDURGXDOLPKHOO-OKZBNKHCSA-N 1 2 319.493 4.145 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C2CC2)no1)c1cc(-c2ccccc2)no1 ZINC000926868982 1043646535 /nfs/dbraw/zinc/64/65/35/1043646535.db2.gz NUZSIMTYOVGKSW-LBPRGKRZSA-N 1 2 309.369 4.058 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2cc(C3CC3)no2)c2cccnc2)cc1 ZINC000926868598 1043646583 /nfs/dbraw/zinc/64/65/83/1043646583.db2.gz JZFCXZYKXJIKBR-FQEVSTJZSA-N 1 2 319.408 4.135 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(F)ccc(Br)c2F)C2(CC2)C1 ZINC001141778148 1043650587 /nfs/dbraw/zinc/65/05/87/1043650587.db2.gz IHEYMKMNNYOGPO-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(F)ccc(Br)c2F)C2(CC2)C1 ZINC001141778148 1043650581 /nfs/dbraw/zinc/65/05/81/1043650581.db2.gz IHEYMKMNNYOGPO-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F)c1cnccn1 ZINC000926903418 1043651948 /nfs/dbraw/zinc/65/19/48/1043651948.db2.gz VHCHXVBGRZBMIY-IUCAKERBSA-N 1 2 314.191 4.334 20 0 DIADLO C[N@H+](Cc1cnc(C2CCCC2)s1)Cc1ccc(Cl)nc1 ZINC000125718909 1043651924 /nfs/dbraw/zinc/65/19/24/1043651924.db2.gz RPIIVKCTLRPEIZ-UHFFFAOYSA-N 1 2 321.877 4.481 20 0 DIADLO C[N@@H+](Cc1cnc(C2CCCC2)s1)Cc1ccc(Cl)nc1 ZINC000125718909 1043651938 /nfs/dbraw/zinc/65/19/38/1043651938.db2.gz RPIIVKCTLRPEIZ-UHFFFAOYSA-N 1 2 321.877 4.481 20 0 DIADLO CC[C@@H]([NH2+][C@@H]1CCCc2oc(C)nc21)c1cc(F)ccc1OC ZINC000926901409 1043652848 /nfs/dbraw/zinc/65/28/48/1043652848.db2.gz RIYHXUSEVFYNRL-HUUCEWRRSA-N 1 2 318.392 4.249 20 0 DIADLO Fc1ccc(C[NH2+]Cc2ncc(-c3ccccc3)s2)c(F)c1 ZINC001648961178 1043656847 /nfs/dbraw/zinc/65/68/47/1043656847.db2.gz ZBASXEJAPQHURL-UHFFFAOYSA-N 1 2 316.376 4.378 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCC(=O)C(C)(C)C ZINC000191565300 1043661576 /nfs/dbraw/zinc/66/15/76/1043661576.db2.gz UUTFZQBBFGWTTC-UHFFFAOYSA-N 1 2 302.443 4.029 20 0 DIADLO COCc1nc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccc(C)o2)cs1 ZINC000353934314 1043662970 /nfs/dbraw/zinc/66/29/70/1043662970.db2.gz PQYRZCDSDKEADA-DOMZBBRYSA-N 1 2 320.458 4.164 20 0 DIADLO COCc1nc(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccc(C)o2)cs1 ZINC000353934314 1043662981 /nfs/dbraw/zinc/66/29/81/1043662981.db2.gz PQYRZCDSDKEADA-DOMZBBRYSA-N 1 2 320.458 4.164 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2c(C)oc3ccccc32)s1 ZINC000354010022 1043672428 /nfs/dbraw/zinc/67/24/28/1043672428.db2.gz LUAGFPRHXLEQRC-UHFFFAOYSA-N 1 2 300.427 4.392 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2c(C)oc3ccccc32)s1 ZINC000354010022 1043672433 /nfs/dbraw/zinc/67/24/33/1043672433.db2.gz LUAGFPRHXLEQRC-UHFFFAOYSA-N 1 2 300.427 4.392 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2ccc(F)c3cccnc23)s1 ZINC000354040238 1043673783 /nfs/dbraw/zinc/67/37/83/1043673783.db2.gz OGSNLRQGPFAHSM-UHFFFAOYSA-N 1 2 315.417 4.025 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2ccc(F)c3cccnc23)s1 ZINC000354040238 1043673791 /nfs/dbraw/zinc/67/37/91/1043673791.db2.gz OGSNLRQGPFAHSM-UHFFFAOYSA-N 1 2 315.417 4.025 20 0 DIADLO C[C@@H]([NH2+][C@@H]1C[C@@H](c2ccccc2)Oc2ccccc21)c1ncc[nH]1 ZINC000927064167 1043677301 /nfs/dbraw/zinc/67/73/01/1043677301.db2.gz LKIQYGHIORKHSS-BJZITVGISA-N 1 2 319.408 4.325 20 0 DIADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCCC2(C1)CCCCCC2 ZINC001137105915 1043680006 /nfs/dbraw/zinc/68/00/06/1043680006.db2.gz NDDAMJKZHJQFNY-UHFFFAOYSA-N 1 2 311.429 4.140 20 0 DIADLO Cc1ccc(NC(=O)c2cc(C)ccc2-n2cc[nH+]c2)c(C)c1 ZINC000114111559 1043683956 /nfs/dbraw/zinc/68/39/56/1043683956.db2.gz ALEZQCPHRDQJKP-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO Cc1ccccc1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000354122726 1043684548 /nfs/dbraw/zinc/68/45/48/1043684548.db2.gz NQXFJTIBLQASTM-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO COCC[N@H+](Cc1ccc(C)o1)Cc1cccc(Cl)c1F ZINC000354128977 1043684591 /nfs/dbraw/zinc/68/45/91/1043684591.db2.gz XJBFFBAFPOVXCD-UHFFFAOYSA-N 1 2 311.784 4.029 20 0 DIADLO COCC[N@@H+](Cc1ccc(C)o1)Cc1cccc(Cl)c1F ZINC000354128977 1043684599 /nfs/dbraw/zinc/68/45/99/1043684599.db2.gz XJBFFBAFPOVXCD-UHFFFAOYSA-N 1 2 311.784 4.029 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@H](C)c2ccnn2C2CCC2)c(F)c1 ZINC000927094404 1043684780 /nfs/dbraw/zinc/68/47/80/1043684780.db2.gz VONJRZYIEVYRRS-GFCCVEGCSA-N 1 2 305.372 4.046 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cccc(C(F)F)c3)cc2[nH+]1 ZINC000354296719 1043691201 /nfs/dbraw/zinc/69/12/01/1043691201.db2.gz OPJWEZBNSZSTCK-UHFFFAOYSA-N 1 2 301.296 4.061 20 0 DIADLO Fc1ccc2ccnc(NCc3cccc(-n4cc[nH+]c4)c3)c2c1 ZINC000354324824 1043694217 /nfs/dbraw/zinc/69/42/17/1043694217.db2.gz RBYRUVMAAQLXCN-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1cnc(-c2ccsc2)s1 ZINC000354359735 1043696114 /nfs/dbraw/zinc/69/61/14/1043696114.db2.gz SKEUDAZBPTWBTR-UHFFFAOYSA-N 1 2 319.455 4.054 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1cnc(-c2ccsc2)s1 ZINC000354359735 1043696122 /nfs/dbraw/zinc/69/61/22/1043696122.db2.gz SKEUDAZBPTWBTR-UHFFFAOYSA-N 1 2 319.455 4.054 20 0 DIADLO Cc1ccc(C)n1C1CC[NH+](Cc2nc(Cl)cs2)CC1 ZINC000876657118 1043702618 /nfs/dbraw/zinc/70/26/18/1043702618.db2.gz YHBYGPQKSOFHKW-UHFFFAOYSA-N 1 2 309.866 4.052 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)Nc1ccc([NH+](C)C)cc1C ZINC000876817603 1043713125 /nfs/dbraw/zinc/71/31/25/1043713125.db2.gz CGCYRYGKFXETRR-SZNDQCEHSA-N 1 2 312.394 4.196 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)[NH2+]c1ccc(N(C)C)cc1C ZINC000876817603 1043713133 /nfs/dbraw/zinc/71/31/33/1043713133.db2.gz CGCYRYGKFXETRR-SZNDQCEHSA-N 1 2 312.394 4.196 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1cc(F)cc(F)c1F ZINC001137873582 1043718685 /nfs/dbraw/zinc/71/86/85/1043718685.db2.gz LEMIQDDTZANMSG-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1cc(F)cc(F)c1F ZINC001137873582 1043718695 /nfs/dbraw/zinc/71/86/95/1043718695.db2.gz LEMIQDDTZANMSG-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO COc1c(C)c[nH+]c(CNc2cccc(-c3nc(C)co3)c2)c1C ZINC000876868715 1043719353 /nfs/dbraw/zinc/71/93/53/1043719353.db2.gz JMVCWLUUMPQISX-UHFFFAOYSA-N 1 2 323.396 4.283 20 0 DIADLO Fc1ccc(C[NH2+]Cc2nc(Cl)cs2)c(C(F)(F)F)c1 ZINC000876932189 1043726569 /nfs/dbraw/zinc/72/65/69/1043726569.db2.gz GJUGYVQZCUTGRL-UHFFFAOYSA-N 1 2 324.730 4.244 20 0 DIADLO COc1cc([C@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)ccc1F ZINC000777652690 1043727269 /nfs/dbraw/zinc/72/72/69/1043727269.db2.gz BOFDPKLTXCNKLF-ZDUSSCGKSA-N 1 2 314.404 4.390 20 0 DIADLO COc1cc([C@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)ccc1F ZINC000777652690 1043727281 /nfs/dbraw/zinc/72/72/81/1043727281.db2.gz BOFDPKLTXCNKLF-ZDUSSCGKSA-N 1 2 314.404 4.390 20 0 DIADLO Cc1csc(C[NH+]2CCC(=Cc3ccccc3F)CC2)n1 ZINC000354994011 1043734950 /nfs/dbraw/zinc/73/49/50/1043734950.db2.gz QNEBYUNSZDAQKJ-UHFFFAOYSA-N 1 2 302.418 4.270 20 0 DIADLO FC(F)(F)CN(Cc1ccc(-n2cc[nH+]c2)cc1)CC1CCC1 ZINC000355111047 1043741615 /nfs/dbraw/zinc/74/16/15/1043741615.db2.gz LWAJKFJZZCPLLH-UHFFFAOYSA-N 1 2 323.362 4.037 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(F)cc(Cl)cc2Br)C1 ZINC001141837675 1043741885 /nfs/dbraw/zinc/74/18/85/1043741885.db2.gz LWGAPGBEFXRLEW-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(F)cc(Cl)cc2Br)C1 ZINC001141837675 1043741898 /nfs/dbraw/zinc/74/18/98/1043741898.db2.gz LWGAPGBEFXRLEW-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)c1ccsc1 ZINC000355393535 1043765332 /nfs/dbraw/zinc/76/53/32/1043765332.db2.gz ZIUMKRAQKJECRF-UHFFFAOYSA-N 1 2 323.421 4.200 20 0 DIADLO Cc1ccncc1C[N@H+](C)Cc1cnc(C2CCCC2)s1 ZINC000355589553 1043778666 /nfs/dbraw/zinc/77/86/66/1043778666.db2.gz ZHFGIRQPFXCMJM-UHFFFAOYSA-N 1 2 301.459 4.136 20 0 DIADLO Cc1ccncc1C[N@@H+](C)Cc1cnc(C2CCCC2)s1 ZINC000355589553 1043778669 /nfs/dbraw/zinc/77/86/69/1043778669.db2.gz ZHFGIRQPFXCMJM-UHFFFAOYSA-N 1 2 301.459 4.136 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cc(C)c(Cl)cc3C)cc2[nH+]1 ZINC000474432211 1043778996 /nfs/dbraw/zinc/77/89/96/1043778996.db2.gz MHQKIXXKCVOUMP-UHFFFAOYSA-N 1 2 313.788 4.394 20 0 DIADLO Clc1ccc(C[N@@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)nn1 ZINC000877607862 1043780176 /nfs/dbraw/zinc/78/01/76/1043780176.db2.gz MXXDINIDPNLYIX-KRWDZBQOSA-N 1 2 311.816 4.023 20 0 DIADLO Clc1ccc(C[N@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)nn1 ZINC000877607862 1043780182 /nfs/dbraw/zinc/78/01/82/1043780182.db2.gz MXXDINIDPNLYIX-KRWDZBQOSA-N 1 2 311.816 4.023 20 0 DIADLO C[N@H+](Cc1nccn1C(F)F)[C@H]1CCc2cc(Cl)ccc21 ZINC000777717401 1043780172 /nfs/dbraw/zinc/78/01/72/1043780172.db2.gz MXWUWNCKUYEEQJ-ZDUSSCGKSA-N 1 2 311.763 4.051 20 0 DIADLO C[N@@H+](Cc1nccn1C(F)F)[C@H]1CCc2cc(Cl)ccc21 ZINC000777717401 1043780179 /nfs/dbraw/zinc/78/01/79/1043780179.db2.gz MXWUWNCKUYEEQJ-ZDUSSCGKSA-N 1 2 311.763 4.051 20 0 DIADLO CCO[P@@](C)(=O)CC[C@H](C)Nc1c[nH+]cc2c1CCCC2 ZINC000877621503 1043781820 /nfs/dbraw/zinc/78/18/20/1043781820.db2.gz XXLFYBGAQLORHC-YEJXKQKISA-N 1 2 310.378 4.095 20 0 DIADLO COc1cc(NCc2ccc(-n3cc[nH+]c3)cc2)c(C)cc1C ZINC000355672400 1043783895 /nfs/dbraw/zinc/78/38/95/1043783895.db2.gz OJFBARKZABDVLK-UHFFFAOYSA-N 1 2 307.397 4.110 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)n1 ZINC000097079400 1043783799 /nfs/dbraw/zinc/78/37/99/1043783799.db2.gz MQWQIFKCCBSWRE-KRWDZBQOSA-N 1 2 319.424 4.428 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)n1 ZINC000097079401 1043783992 /nfs/dbraw/zinc/78/39/92/1043783992.db2.gz MQWQIFKCCBSWRE-QGZVFWFLSA-N 1 2 319.424 4.428 20 0 DIADLO C[C@@H]1CCC[C@@H](CC(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)C1 ZINC000355808866 1043787590 /nfs/dbraw/zinc/78/75/90/1043787590.db2.gz CQWUVUABWPLCFQ-ZIAGYGMSSA-N 1 2 315.392 4.166 20 0 DIADLO FC(F)(F)c1sccc1C[NH2+]Cc1nc(Cl)cs1 ZINC000877663763 1043787646 /nfs/dbraw/zinc/78/76/46/1043787646.db2.gz YZVOMGUUDWEGDE-UHFFFAOYSA-N 1 2 312.769 4.167 20 0 DIADLO Cc1nnsc1[C@@H](C)[N@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000929137775 1043794998 /nfs/dbraw/zinc/79/49/98/1043794998.db2.gz BMJHPHLVXZHTKB-SNVBAGLBSA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nnsc1[C@@H](C)[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000929137775 1043795008 /nfs/dbraw/zinc/79/50/08/1043795008.db2.gz BMJHPHLVXZHTKB-SNVBAGLBSA-N 1 2 315.364 4.058 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000780533549 1043810078 /nfs/dbraw/zinc/81/00/78/1043810078.db2.gz RWWJNTBFIKJYFN-SFHVURJKSA-N 1 2 305.466 4.112 20 0 DIADLO Oc1cc(C[N@@H+]2CCc3ccsc3C2)cc(C(F)(F)F)c1 ZINC000356128393 1043814107 /nfs/dbraw/zinc/81/41/07/1043814107.db2.gz PHRBYOYLXYUFAZ-UHFFFAOYSA-N 1 2 313.344 4.031 20 0 DIADLO Oc1cc(C[N@H+]2CCc3ccsc3C2)cc(C(F)(F)F)c1 ZINC000356128393 1043814134 /nfs/dbraw/zinc/81/41/34/1043814134.db2.gz PHRBYOYLXYUFAZ-UHFFFAOYSA-N 1 2 313.344 4.031 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1ccc(Br)o1 ZINC000097489832 1043819293 /nfs/dbraw/zinc/81/92/93/1043819293.db2.gz DTSQYGURNBXNJG-SNVBAGLBSA-N 1 2 312.182 4.374 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccc(Br)o1 ZINC000097489832 1043819315 /nfs/dbraw/zinc/81/93/15/1043819315.db2.gz DTSQYGURNBXNJG-SNVBAGLBSA-N 1 2 312.182 4.374 20 0 DIADLO C[N@H+](Cc1nc2c(o1)CCCC2)Cc1ccc(C(F)(F)F)cc1 ZINC000877906013 1043819313 /nfs/dbraw/zinc/81/93/13/1043819313.db2.gz XCJHHEIGGBZPSY-UHFFFAOYSA-N 1 2 324.346 4.204 20 0 DIADLO C[N@@H+](Cc1nc2c(o1)CCCC2)Cc1ccc(C(F)(F)F)cc1 ZINC000877906013 1043819333 /nfs/dbraw/zinc/81/93/33/1043819333.db2.gz XCJHHEIGGBZPSY-UHFFFAOYSA-N 1 2 324.346 4.204 20 0 DIADLO Cc1conc1C[N@H+](Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000877918611 1043822291 /nfs/dbraw/zinc/82/22/91/1043822291.db2.gz IFXMRVUEPONZMI-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO Cc1conc1C[N@@H+](Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000877918611 1043822305 /nfs/dbraw/zinc/82/23/05/1043822305.db2.gz IFXMRVUEPONZMI-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO C[C@H]1CCC[C@@H](c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)C1 ZINC000356229580 1043823918 /nfs/dbraw/zinc/82/39/18/1043823918.db2.gz YXGFTBVZTFPDNW-UONOGXRCSA-N 1 2 308.385 4.216 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2oc(-c3ccccc3)nc2C)no1 ZINC000877922008 1043825186 /nfs/dbraw/zinc/82/51/86/1043825186.db2.gz NXEMSEVYMDBWCJ-QGZVFWFLSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2oc(-c3ccccc3)nc2C)no1 ZINC000877922008 1043825198 /nfs/dbraw/zinc/82/51/98/1043825198.db2.gz NXEMSEVYMDBWCJ-QGZVFWFLSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1conc1C[N@H+](Cc1ccccc1C(F)(F)F)C1CC1 ZINC000877973661 1043833608 /nfs/dbraw/zinc/83/36/08/1043833608.db2.gz WRAKYZTXTNYVOY-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO Cc1conc1C[N@@H+](Cc1ccccc1C(F)(F)F)C1CC1 ZINC000877973661 1043833627 /nfs/dbraw/zinc/83/36/27/1043833627.db2.gz WRAKYZTXTNYVOY-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2nc3c(o2)CCCC3)c1 ZINC000877985173 1043836671 /nfs/dbraw/zinc/83/66/71/1043836671.db2.gz UYQLDIOJNPYGJS-INIZCTEOSA-N 1 2 300.377 4.030 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2nc3c(o2)CCCC3)c1 ZINC000877985173 1043836687 /nfs/dbraw/zinc/83/66/87/1043836687.db2.gz UYQLDIOJNPYGJS-INIZCTEOSA-N 1 2 300.377 4.030 20 0 DIADLO COCC[N@H+](Cc1scnc1Cl)[C@H](C)c1ccccc1 ZINC000878010725 1043840453 /nfs/dbraw/zinc/84/04/53/1043840453.db2.gz KYAFEJOSIWZGHA-GFCCVEGCSA-N 1 2 310.850 4.006 20 0 DIADLO COCC[N@@H+](Cc1scnc1Cl)[C@H](C)c1ccccc1 ZINC000878010725 1043840471 /nfs/dbraw/zinc/84/04/71/1043840471.db2.gz KYAFEJOSIWZGHA-GFCCVEGCSA-N 1 2 310.850 4.006 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nc3c(o2)CCCC3)[C@H](c2ccco2)C1 ZINC000878152624 1043854017 /nfs/dbraw/zinc/85/40/17/1043854017.db2.gz LXEMENPHHHROSG-ZFWWWQNUSA-N 1 2 300.402 4.120 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nc3c(o2)CCCC3)[C@H](c2ccco2)C1 ZINC000878152624 1043854038 /nfs/dbraw/zinc/85/40/38/1043854038.db2.gz LXEMENPHHHROSG-ZFWWWQNUSA-N 1 2 300.402 4.120 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nc3c(o2)CCCC3)[C@@H](c2ccco2)C1 ZINC000878152623 1043855479 /nfs/dbraw/zinc/85/54/79/1043855479.db2.gz LXEMENPHHHROSG-UKRRQHHQSA-N 1 2 300.402 4.120 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nc3c(o2)CCCC3)[C@@H](c2ccco2)C1 ZINC000878152623 1043855498 /nfs/dbraw/zinc/85/54/98/1043855498.db2.gz LXEMENPHHHROSG-UKRRQHHQSA-N 1 2 300.402 4.120 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@H]2c2ccncc2)s1 ZINC000289660168 1043861780 /nfs/dbraw/zinc/86/17/80/1043861780.db2.gz CTHYEKOBZDMDFK-AWEZNQCLSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@H]2c2ccncc2)s1 ZINC000289660168 1043861796 /nfs/dbraw/zinc/86/17/96/1043861796.db2.gz CTHYEKOBZDMDFK-AWEZNQCLSA-N 1 2 301.459 4.173 20 0 DIADLO CC[C@](C)([NH2+]Cc1cnc(-c2ccccc2)o1)c1nccs1 ZINC000929990092 1043863311 /nfs/dbraw/zinc/86/33/11/1043863311.db2.gz BRUZYYFOFKSVFO-KRWDZBQOSA-N 1 2 313.426 4.213 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1scnc1Cl)CCC2 ZINC000878244574 1043864966 /nfs/dbraw/zinc/86/49/66/1043864966.db2.gz RIPVAVVPERVSFM-JTQLQIEISA-N 1 2 313.879 4.071 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1scnc1Cl)CCC2 ZINC000878244574 1043864980 /nfs/dbraw/zinc/86/49/80/1043864980.db2.gz RIPVAVVPERVSFM-JTQLQIEISA-N 1 2 313.879 4.071 20 0 DIADLO Cc1ccc(F)c(C[NH2+]C2(c3nccs3)CCCC2)c1F ZINC000930009358 1043865199 /nfs/dbraw/zinc/86/51/99/1043865199.db2.gz UYOXNGVDVAPINS-UHFFFAOYSA-N 1 2 308.397 4.289 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccc(Cl)cc1 ZINC000878348429 1043874199 /nfs/dbraw/zinc/87/41/99/1043874199.db2.gz MMHGQIQBJBWBEF-AWEZNQCLSA-N 1 2 304.821 4.448 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccc1C(F)(F)F)c1c(F)cccc1F ZINC000878351287 1043877939 /nfs/dbraw/zinc/87/79/39/1043877939.db2.gz VBNBPHQSPJQDBZ-SECBINFHSA-N 1 2 316.273 4.229 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@@H](C)c2ccncc2)sc1C(C)(C)C ZINC000930118351 1043878409 /nfs/dbraw/zinc/87/84/09/1043878409.db2.gz DHOQXHGTVADUMO-ZDUSSCGKSA-N 1 2 303.475 4.337 20 0 DIADLO Cc1nc(C[N@H+](C)[C@@H](C)c2ccncc2)sc1C(C)(C)C ZINC000930118351 1043878419 /nfs/dbraw/zinc/87/84/19/1043878419.db2.gz DHOQXHGTVADUMO-ZDUSSCGKSA-N 1 2 303.475 4.337 20 0 DIADLO CC(C)([NH2+]Cc1nc2c(o1)CCCC2)c1cccc(Cl)c1 ZINC000878364497 1043881090 /nfs/dbraw/zinc/88/10/90/1043881090.db2.gz FYFLKJXSINLMQQ-UHFFFAOYSA-N 1 2 304.821 4.232 20 0 DIADLO Cc1cc([C@H]([NH2+]Cc2nc3c(o2)CCCC3)C2CC2)ccc1F ZINC000878377841 1043882915 /nfs/dbraw/zinc/88/29/15/1043882915.db2.gz YTSZRAMALRFVAM-LJQANCHMSA-N 1 2 314.404 4.242 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2cc(C(F)(F)F)co2)C2CC2)n1 ZINC000878378611 1043883634 /nfs/dbraw/zinc/88/36/34/1043883634.db2.gz OOOASEJTCAWFJP-GFCCVEGCSA-N 1 2 316.348 4.304 20 0 DIADLO C[C@H](Nc1cc[nH+]c2c(Cl)cccc12)c1nnc2ccccn21 ZINC000561099832 1043883998 /nfs/dbraw/zinc/88/39/98/1043883998.db2.gz PURNQVOWWXDEKB-NSHDSACASA-N 1 2 323.787 4.104 20 0 DIADLO C[C@@H](Nc1cc[nH+]c2c(Cl)cccc12)c1nnc2ccccn21 ZINC000561099831 1043884396 /nfs/dbraw/zinc/88/43/96/1043884396.db2.gz PURNQVOWWXDEKB-LLVKDONJSA-N 1 2 323.787 4.104 20 0 DIADLO CC[C@H]([NH2+]Cc1noc2c1CC(C)(C)CC2)c1c(C)noc1C ZINC000878414503 1043886160 /nfs/dbraw/zinc/88/61/60/1043886160.db2.gz QXOQMGRIIZFRNC-AWEZNQCLSA-N 1 2 317.433 4.035 20 0 DIADLO CC[C@@H]([NH2+]Cc1c(Cl)cncc1Cl)c1c(C)noc1C ZINC000878414200 1043887271 /nfs/dbraw/zinc/88/72/71/1043887271.db2.gz OTRNDSREFXKWMP-CYBMUJFWSA-N 1 2 314.216 4.234 20 0 DIADLO C[C@@H]1CCC[N@@H+]1Cc1c(Cl)ccc(Br)c1F ZINC001141887291 1043887888 /nfs/dbraw/zinc/88/78/88/1043887888.db2.gz BLORMHORGQOYPJ-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@@H]1CCC[N@H+]1Cc1c(Cl)ccc(Br)c1F ZINC001141887291 1043887912 /nfs/dbraw/zinc/88/79/12/1043887912.db2.gz BLORMHORGQOYPJ-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1coc(C(C)(C)C)n1 ZINC000930185855 1043888314 /nfs/dbraw/zinc/88/83/14/1043888314.db2.gz OIORFASMEPFHPY-ZDUSSCGKSA-N 1 2 302.418 4.140 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2ccc(-c3cccc(F)c3)s2)n1 ZINC000356900814 1043889856 /nfs/dbraw/zinc/88/98/56/1043889856.db2.gz ZLPDYEZXIUABQA-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO CCOc1cccc([C@@H](C)[NH2+]Cc2coc(C(C)(C)C)n2)c1 ZINC000930209466 1043894587 /nfs/dbraw/zinc/89/45/87/1043894587.db2.gz CJHCGZZIVOILFY-CYBMUJFWSA-N 1 2 302.418 4.222 20 0 DIADLO Cc1ccc(C[NH+]2CCC(CC(F)(F)F)CC2)nc1Cl ZINC000878573621 1043903194 /nfs/dbraw/zinc/90/31/94/1043903194.db2.gz LSZQCZPTYOPEBV-UHFFFAOYSA-N 1 2 306.759 4.208 20 0 DIADLO CC(C)(CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)CC(F)F ZINC000878564081 1043903389 /nfs/dbraw/zinc/90/33/89/1043903389.db2.gz JFKYSYJDEMEUCC-UHFFFAOYSA-N 1 2 307.344 4.087 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001137134254 1043906022 /nfs/dbraw/zinc/90/60/22/1043906022.db2.gz MLIVYFVRYVUEMJ-HNNXBMFYSA-N 1 2 301.352 4.043 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001137134254 1043906034 /nfs/dbraw/zinc/90/60/34/1043906034.db2.gz MLIVYFVRYVUEMJ-HNNXBMFYSA-N 1 2 301.352 4.043 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2noc(C3CCCCC3)n2)CC12CCC2 ZINC000357023083 1043908266 /nfs/dbraw/zinc/90/82/66/1043908266.db2.gz KOOZTJKFEXLUKG-CQSZACIVSA-N 1 2 303.450 4.129 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2noc(C3CCCCC3)n2)CC12CCC2 ZINC000357023083 1043908279 /nfs/dbraw/zinc/90/82/79/1043908279.db2.gz KOOZTJKFEXLUKG-CQSZACIVSA-N 1 2 303.450 4.129 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1nc2c(o1)CCCC2 ZINC000878620699 1043908332 /nfs/dbraw/zinc/90/83/32/1043908332.db2.gz UOTIMAQHXCUBMM-MRXNPFEDSA-N 1 2 314.429 4.145 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1nc2c(o1)CCCC2 ZINC000878620699 1043908341 /nfs/dbraw/zinc/90/83/41/1043908341.db2.gz UOTIMAQHXCUBMM-MRXNPFEDSA-N 1 2 314.429 4.145 20 0 DIADLO CSc1ccc([C@H](C)[NH2+]Cc2nc(C(C)C)ns2)cc1 ZINC000930312179 1043909656 /nfs/dbraw/zinc/90/96/56/1043909656.db2.gz DBLJISAOBRUJLM-NSHDSACASA-N 1 2 307.488 4.234 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)C)ns2)cc1 ZINC000930317577 1043912861 /nfs/dbraw/zinc/91/28/61/1043912861.db2.gz DBLJISAOBRUJLM-LLVKDONJSA-N 1 2 307.488 4.234 20 0 DIADLO OC[C@H](CNc1cc[nH+]c2c(Cl)cccc12)c1ccccc1 ZINC000561263014 1043914706 /nfs/dbraw/zinc/91/47/06/1043914706.db2.gz PWEGRMHBVRIPMV-AWEZNQCLSA-N 1 2 312.800 4.076 20 0 DIADLO OCCC1(CNc2cc[nH+]c3c(Cl)cccc23)CCCC1 ZINC000561264975 1043915676 /nfs/dbraw/zinc/91/56/76/1043915676.db2.gz GYJKYCVKSRMQHZ-UHFFFAOYSA-N 1 2 304.821 4.243 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2ccc(Cl)cc2)n1)c1cccnc1 ZINC000357290820 1043934996 /nfs/dbraw/zinc/93/49/96/1043934996.db2.gz QNEJUVDZNMWUQQ-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO Clc1cncc(Cl)c1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000879035245 1043937850 /nfs/dbraw/zinc/93/78/50/1043937850.db2.gz QJFZWCCCNZLOEW-MRXNPFEDSA-N 1 2 322.239 4.414 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccc(F)c(Cl)c1)C1CC1)c1ncccn1 ZINC000930610716 1043948462 /nfs/dbraw/zinc/94/84/62/1043948462.db2.gz DUIQDUAZNQALFE-MEBBXXQBSA-N 1 2 305.784 4.071 20 0 DIADLO CC[N@H+](Cc1csc(-c2ccccn2)n1)[C@H](C)c1cccnc1 ZINC000290420058 1043949002 /nfs/dbraw/zinc/94/90/02/1043949002.db2.gz KRKKUWUCJXCAGZ-CQSZACIVSA-N 1 2 324.453 4.183 20 0 DIADLO CC[N@@H+](Cc1csc(-c2ccccn2)n1)[C@H](C)c1cccnc1 ZINC000290420058 1043949011 /nfs/dbraw/zinc/94/90/11/1043949011.db2.gz KRKKUWUCJXCAGZ-CQSZACIVSA-N 1 2 324.453 4.183 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2coc(C(C)(C)C)n2)CC2CC2)cn1 ZINC000930815009 1043965591 /nfs/dbraw/zinc/96/55/91/1043965591.db2.gz AMQICWPJRWONQU-UHFFFAOYSA-N 1 2 313.445 4.088 20 0 DIADLO Cc1ccc(C[N@H+](Cc2coc(C(C)(C)C)n2)CC2CC2)cn1 ZINC000930815009 1043965598 /nfs/dbraw/zinc/96/55/98/1043965598.db2.gz AMQICWPJRWONQU-UHFFFAOYSA-N 1 2 313.445 4.088 20 0 DIADLO Fc1cncc(F)c1C[NH2+]C1(c2cccc(Cl)c2)CCC1 ZINC000930823683 1043968385 /nfs/dbraw/zinc/96/83/85/1043968385.db2.gz SEJGHWAQPVQAIU-UHFFFAOYSA-N 1 2 308.759 4.182 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1cc2ccccc2nc1Cl ZINC000127801211 1043969625 /nfs/dbraw/zinc/96/96/25/1043969625.db2.gz LGLHWFVOJRYWEB-ZDUSSCGKSA-N 1 2 311.816 4.476 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1cc2ccccc2nc1Cl ZINC000127801211 1043969638 /nfs/dbraw/zinc/96/96/38/1043969638.db2.gz LGLHWFVOJRYWEB-ZDUSSCGKSA-N 1 2 311.816 4.476 20 0 DIADLO FC[C@@H]([NH2+]Cc1cncc(C(F)(F)F)c1)c1ccc(F)cc1 ZINC000879659989 1043978791 /nfs/dbraw/zinc/97/87/91/1043978791.db2.gz LVSXBIKCOKMERU-CQSZACIVSA-N 1 2 316.273 4.040 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2nnc3n2CCCCC3)cc1 ZINC000357730225 1043980087 /nfs/dbraw/zinc/98/00/87/1043980087.db2.gz NVCLXNSRZSUKAM-GOSISDBHSA-N 1 2 324.472 4.040 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2nnc3n2CCCCC3)cc1 ZINC000357730225 1043980091 /nfs/dbraw/zinc/98/00/91/1043980091.db2.gz NVCLXNSRZSUKAM-GOSISDBHSA-N 1 2 324.472 4.040 20 0 DIADLO Cc1cncc([C@H]2CCC[N@@H+]2Cc2cncc(C(F)(F)F)c2)c1 ZINC000879750859 1043989078 /nfs/dbraw/zinc/98/90/78/1043989078.db2.gz AAIQZWOHWPHDGW-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cncc([C@H]2CCC[N@H+]2Cc2cncc(C(F)(F)F)c2)c1 ZINC000879750859 1043989087 /nfs/dbraw/zinc/98/90/87/1043989087.db2.gz AAIQZWOHWPHDGW-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2cncc(C(F)(F)F)c2)c1 ZINC000879750858 1043989619 /nfs/dbraw/zinc/98/96/19/1043989619.db2.gz AAIQZWOHWPHDGW-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cncc([C@@H]2CCC[N@H+]2Cc2cncc(C(F)(F)F)c2)c1 ZINC000879750858 1043989635 /nfs/dbraw/zinc/98/96/35/1043989635.db2.gz AAIQZWOHWPHDGW-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2ncccc2C(F)(F)F)c1 ZINC000879752756 1043990334 /nfs/dbraw/zinc/99/03/34/1043990334.db2.gz WEZZLGCXQAKKBJ-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cncc([C@@H]2CCC[N@H+]2Cc2ncccc2C(F)(F)F)c1 ZINC000879752756 1043990348 /nfs/dbraw/zinc/99/03/48/1043990348.db2.gz WEZZLGCXQAKKBJ-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO CC(C)c1nsc(C[NH2+][C@@]2(c3ccccc3)CC2(C)C)n1 ZINC000931081052 1043990859 /nfs/dbraw/zinc/99/08/59/1043990859.db2.gz IAMUAPKBUPMRIO-QGZVFWFLSA-N 1 2 301.459 4.077 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1cc2ccccc2nc1Cl ZINC000128028798 1043993731 /nfs/dbraw/zinc/99/37/31/1043993731.db2.gz SVXBOUBEKOIXDZ-ZDUSSCGKSA-N 1 2 311.816 4.476 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1cc2ccccc2nc1Cl ZINC000128028798 1043993741 /nfs/dbraw/zinc/99/37/41/1043993741.db2.gz SVXBOUBEKOIXDZ-ZDUSSCGKSA-N 1 2 311.816 4.476 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@H](c2ccccn2)C1 ZINC001137883063 1043996752 /nfs/dbraw/zinc/99/67/52/1043996752.db2.gz RSTQMCYUFCDRDG-LBPRGKRZSA-N 1 2 322.786 4.393 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC001137883063 1043996763 /nfs/dbraw/zinc/99/67/63/1043996763.db2.gz RSTQMCYUFCDRDG-LBPRGKRZSA-N 1 2 322.786 4.393 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2ccnc(Cl)c2Cl)n1 ZINC000290939002 1044002213 /nfs/dbraw/zinc/00/22/13/1044002213.db2.gz SYAFRXZXDANLAX-UHFFFAOYSA-N 1 2 316.257 4.178 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2ncc(Cl)cc2Cl)C1 ZINC000880002585 1044005158 /nfs/dbraw/zinc/00/51/58/1044005158.db2.gz MAMXEZUWBDTGSJ-NSHDSACASA-N 1 2 313.150 4.163 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2ncc(Cl)cc2Cl)C1 ZINC000880002585 1044005168 /nfs/dbraw/zinc/00/51/68/1044005168.db2.gz MAMXEZUWBDTGSJ-NSHDSACASA-N 1 2 313.150 4.163 20 0 DIADLO CSc1ccccc1C[NH2+][C@H](c1nc(C2CC2)no1)C(C)C ZINC000358062013 1044014578 /nfs/dbraw/zinc/01/45/78/1044014578.db2.gz MAOBBMBLMFXXQW-HNNXBMFYSA-N 1 2 317.458 4.156 20 0 DIADLO CSc1ccccc1C[NH2+][C@@H](c1nc(C2CC2)no1)C(C)C ZINC000358062014 1044015957 /nfs/dbraw/zinc/01/59/57/1044015957.db2.gz MAOBBMBLMFXXQW-OAHLLOKOSA-N 1 2 317.458 4.156 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2cc(F)c(F)c(F)c2)cs1 ZINC000358092200 1044020666 /nfs/dbraw/zinc/02/06/66/1044020666.db2.gz YBQPFBDZNRGOFG-JGVFFNPUSA-N 1 2 300.349 4.281 20 0 DIADLO C[C@H]1CCC[N@@H+]1Cc1cc(F)c(Br)cc1Cl ZINC001141920128 1044023651 /nfs/dbraw/zinc/02/36/51/1044023651.db2.gz MJUNXMYAAGRNAK-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@H]1CCC[N@H+]1Cc1cc(F)c(Br)cc1Cl ZINC001141920128 1044023667 /nfs/dbraw/zinc/02/36/67/1044023667.db2.gz MJUNXMYAAGRNAK-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@@H]([NH2+]Cc1nncs1)c1cccc(SC(F)(F)F)c1 ZINC000931755924 1044069190 /nfs/dbraw/zinc/06/91/90/1044069190.db2.gz NBSSTCMSCJFQLA-MRVPVSSYSA-N 1 2 319.377 4.001 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@H]2CCc3cccc4cccc2c43)n1 ZINC000931805920 1044074737 /nfs/dbraw/zinc/07/47/37/1044074737.db2.gz IRBQICSVBLSZGZ-KRWDZBQOSA-N 1 2 321.424 4.198 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1ccc(C2CCC2)cc1 ZINC000358500978 1044076437 /nfs/dbraw/zinc/07/64/37/1044076437.db2.gz HHOQAANASGTQHF-UHFFFAOYSA-N 1 2 317.392 4.392 20 0 DIADLO Cc1ccc2oc(SCc3ccc(-n4cc[nH+]c4)cc3)nc2n1 ZINC000358513445 1044079310 /nfs/dbraw/zinc/07/93/10/1044079310.db2.gz SCQFZXRDRHEYGA-UHFFFAOYSA-N 1 2 322.393 4.009 20 0 DIADLO Cc1nnc(C[N@H+](CCc2ccccc2)Cc2ccccc2)s1 ZINC000358622655 1044088524 /nfs/dbraw/zinc/08/85/24/1044088524.db2.gz FFWKQMUHSIFDKQ-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO Cc1nnc(C[N@@H+](CCc2ccccc2)Cc2ccccc2)s1 ZINC000358622655 1044088534 /nfs/dbraw/zinc/08/85/34/1044088534.db2.gz FFWKQMUHSIFDKQ-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)N1CCCCC[C@H]1c1ccco1 ZINC000281063065 1044090946 /nfs/dbraw/zinc/09/09/46/1044090946.db2.gz SBZSFBDOMRHXLE-HNNXBMFYSA-N 1 2 324.384 4.077 20 0 DIADLO Cn1c2ccccc2nc1SCc1ccc(-n2cc[nH+]c2)cc1 ZINC000358666822 1044091334 /nfs/dbraw/zinc/09/13/34/1044091334.db2.gz ZGZIMSCNYOZVSK-UHFFFAOYSA-N 1 2 320.421 4.051 20 0 DIADLO CCC[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1cccnc1 ZINC000281109043 1044096143 /nfs/dbraw/zinc/09/61/43/1044096143.db2.gz LRGVYMYPYMNVNJ-CQSZACIVSA-N 1 2 312.310 4.269 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ccco2)Cc2ccc(F)cn2)c1 ZINC000346384244 1044097329 /nfs/dbraw/zinc/09/73/29/1044097329.db2.gz LWYUUTSFHYWNCE-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ccco2)Cc2ccc(F)cn2)c1 ZINC000346384244 1044097342 /nfs/dbraw/zinc/09/73/42/1044097342.db2.gz LWYUUTSFHYWNCE-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO c1ccc2oc(C[NH+]3CC(c4nc5ccccc5s4)C3)nc2c1 ZINC000358813881 1044101769 /nfs/dbraw/zinc/10/17/69/1044101769.db2.gz FXFWNEPZTAMKFN-UHFFFAOYSA-N 1 2 321.405 4.037 20 0 DIADLO Cc1ncsc1CC[N@@H+](C)[C@@H](CCc1ccccc1)C(F)F ZINC000626137124 1044103119 /nfs/dbraw/zinc/10/31/19/1044103119.db2.gz VGVZALMRCLGSQB-HNNXBMFYSA-N 1 2 324.440 4.192 20 0 DIADLO Cc1ncsc1CC[N@H+](C)[C@@H](CCc1ccccc1)C(F)F ZINC000626137124 1044103124 /nfs/dbraw/zinc/10/31/24/1044103124.db2.gz VGVZALMRCLGSQB-HNNXBMFYSA-N 1 2 324.440 4.192 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ccccn2)Cc2ccc(F)cn2)c1 ZINC000346516695 1044114938 /nfs/dbraw/zinc/11/49/38/1044114938.db2.gz ZVEUYSPMOYECTO-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ccccn2)Cc2ccc(F)cn2)c1 ZINC000346516695 1044114945 /nfs/dbraw/zinc/11/49/45/1044114945.db2.gz ZVEUYSPMOYECTO-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO COc1cc(C)[nH+]c(CSc2ncnc3sc(C)cc32)c1 ZINC000346588462 1044118596 /nfs/dbraw/zinc/11/85/96/1044118596.db2.gz WYBSRIBSVQXFDP-UHFFFAOYSA-N 1 2 317.439 4.004 20 0 DIADLO Fc1cccc(-c2nc(C[NH2+][C@H](c3ccccn3)C3CC3)co2)c1 ZINC000932375440 1044121752 /nfs/dbraw/zinc/12/17/52/1044121752.db2.gz QTDAUEHHLBCTIR-SFHVURJKSA-N 1 2 323.371 4.117 20 0 DIADLO Fc1ccccc1-c1cnc(C[NH2+][C@H](c2ccccn2)C2CC2)o1 ZINC000932377052 1044122552 /nfs/dbraw/zinc/12/25/52/1044122552.db2.gz GYLYPLFGFWYDLI-IBGZPJMESA-N 1 2 323.371 4.117 20 0 DIADLO c1csc(-c2cc(C[NH2+][C@@H](c3ccccn3)C3CC3)no2)c1 ZINC000932375803 1044122680 /nfs/dbraw/zinc/12/26/80/1044122680.db2.gz YQIUBOANIACXDZ-QGZVFWFLSA-N 1 2 311.410 4.039 20 0 DIADLO Clc1cncc(Cl)c1C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000932385946 1044123668 /nfs/dbraw/zinc/12/36/68/1044123668.db2.gz MHBTWEFELSOXKD-OAHLLOKOSA-N 1 2 308.212 4.024 20 0 DIADLO c1[nH+]c(-c2cccc(NC(C3CC3)C3CC3)c2)n2c1CCCC2 ZINC000562603592 1044135938 /nfs/dbraw/zinc/13/59/38/1044135938.db2.gz TUBVAYXRLYPSIC-UHFFFAOYSA-N 1 2 307.441 4.487 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(-n3cccc3)c(F)c2)c(C)[nH+]1 ZINC000346754161 1044137884 /nfs/dbraw/zinc/13/78/84/1044137884.db2.gz WDWJSXYTDWZCQD-UHFFFAOYSA-N 1 2 323.371 4.189 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ncc(C(C)(C)C)s2)n1 ZINC000562628428 1044140433 /nfs/dbraw/zinc/14/04/33/1044140433.db2.gz VZBHYXGRVQXWJX-OAHLLOKOSA-N 1 2 315.486 4.481 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2ncc(C(C)(C)C)s2)n1 ZINC000562628428 1044140438 /nfs/dbraw/zinc/14/04/38/1044140438.db2.gz VZBHYXGRVQXWJX-OAHLLOKOSA-N 1 2 315.486 4.481 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(Cl)nc1 ZINC001137169757 1044141906 /nfs/dbraw/zinc/14/19/06/1044141906.db2.gz RTHJTYDOUZGPMF-INIZCTEOSA-N 1 2 316.832 4.218 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(Cl)nc1 ZINC001137169757 1044141913 /nfs/dbraw/zinc/14/19/13/1044141913.db2.gz RTHJTYDOUZGPMF-INIZCTEOSA-N 1 2 316.832 4.218 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1ccc2c(n1)CCC2 ZINC000562679416 1044149187 /nfs/dbraw/zinc/14/91/87/1044149187.db2.gz WVLCDNAQGQLUOS-GFCCVEGCSA-N 1 2 302.368 4.042 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1ccc2c(n1)CCC2 ZINC000562679416 1044149194 /nfs/dbraw/zinc/14/91/94/1044149194.db2.gz WVLCDNAQGQLUOS-GFCCVEGCSA-N 1 2 302.368 4.042 20 0 DIADLO Clc1cccc(C[N@@H+]2CCC[C@@H]3C[C@@H]32)c1Br ZINC001137621625 1044156895 /nfs/dbraw/zinc/15/68/95/1044156895.db2.gz BPUJXKPGUICIMN-SKDRFNHKSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1cccc(C[N@H+]2CCC[C@@H]3C[C@@H]32)c1Br ZINC001137621625 1044156902 /nfs/dbraw/zinc/15/69/02/1044156902.db2.gz BPUJXKPGUICIMN-SKDRFNHKSA-N 1 2 300.627 4.087 20 0 DIADLO CC(C)[N@H+](Cc1ncnn1C(C)(C)C)[C@H](C)c1ccccc1 ZINC000292276518 1044159172 /nfs/dbraw/zinc/15/91/72/1044159172.db2.gz SOGMYRGZSRIBIF-OAHLLOKOSA-N 1 2 300.450 4.005 20 0 DIADLO CC(C)[N@@H+](Cc1ncnn1C(C)(C)C)[C@H](C)c1ccccc1 ZINC000292276518 1044159175 /nfs/dbraw/zinc/15/91/75/1044159175.db2.gz SOGMYRGZSRIBIF-OAHLLOKOSA-N 1 2 300.450 4.005 20 0 DIADLO CCO[C@H](C)c1nc(C[NH2+]C2(c3ccc(F)cc3)CC2)cs1 ZINC000346964101 1044178610 /nfs/dbraw/zinc/17/86/10/1044178610.db2.gz PQZJDPAWGVHJQI-GFCCVEGCSA-N 1 2 320.433 4.159 20 0 DIADLO C[C@H]1CC[C@@]2(CC[N@H+](Cc3noc(C4CCCCC4)n3)C2)C1 ZINC000359570590 1044179114 /nfs/dbraw/zinc/17/91/14/1044179114.db2.gz ZWNDSPKTIZTSQS-KBXCAEBGSA-N 1 2 303.450 4.129 20 0 DIADLO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3noc(C4CCCCC4)n3)C2)C1 ZINC000359570590 1044179118 /nfs/dbraw/zinc/17/91/18/1044179118.db2.gz ZWNDSPKTIZTSQS-KBXCAEBGSA-N 1 2 303.450 4.129 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC[C@@H]2c2cccnc2)cs1 ZINC000346982902 1044179347 /nfs/dbraw/zinc/17/93/47/1044179347.db2.gz OJZQQJYGXXSUHQ-QGZVFWFLSA-N 1 2 315.486 4.464 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC[C@@H]2c2cccnc2)cs1 ZINC000346982902 1044179352 /nfs/dbraw/zinc/17/93/52/1044179352.db2.gz OJZQQJYGXXSUHQ-QGZVFWFLSA-N 1 2 315.486 4.464 20 0 DIADLO Fc1cccc(-c2nc(C[N@@H+]3CCC[C@H]3c3cccnc3)co2)c1 ZINC000346984318 1044181021 /nfs/dbraw/zinc/18/10/21/1044181021.db2.gz ONJKEURKEOINJX-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1cccc(-c2nc(C[N@H+]3CCC[C@H]3c3cccnc3)co2)c1 ZINC000346984318 1044181026 /nfs/dbraw/zinc/18/10/26/1044181026.db2.gz ONJKEURKEOINJX-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1cncc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)c1 ZINC000347016408 1044185395 /nfs/dbraw/zinc/18/53/95/1044185395.db2.gz OLSFDJSJBBTEHZ-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Fc1cncc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)c1 ZINC000347016408 1044185402 /nfs/dbraw/zinc/18/54/02/1044185402.db2.gz OLSFDJSJBBTEHZ-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO CC[C@H]([NH2+]Cc1ncccc1C)c1nc(C(F)(F)F)cs1 ZINC000359692964 1044191325 /nfs/dbraw/zinc/19/13/25/1044191325.db2.gz WLJLXJLNMZJROU-JTQLQIEISA-N 1 2 315.364 4.106 20 0 DIADLO C[C@]1([NH2+]Cc2ncc(-c3ccccc3)o2)CCOc2ccccc21 ZINC000933365528 1044196457 /nfs/dbraw/zinc/19/64/57/1044196457.db2.gz BVHSZQCVYUSQGG-FQEVSTJZSA-N 1 2 320.392 4.129 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1cccc(Cl)c1N)c1ccco1 ZINC000882951767 1044207600 /nfs/dbraw/zinc/20/76/00/1044207600.db2.gz UFKUBDNDYZEBQS-HNNXBMFYSA-N 1 2 322.836 4.019 20 0 DIADLO C[C@@H]1CSCC[N@@H+]1Cc1nc(-c2ccccc2Cl)cs1 ZINC000359868078 1044211801 /nfs/dbraw/zinc/21/18/01/1044211801.db2.gz BYVAATZNXHUDDC-LLVKDONJSA-N 1 2 324.902 4.401 20 0 DIADLO C[C@@H]1CSCC[N@H+]1Cc1nc(-c2ccccc2Cl)cs1 ZINC000359868078 1044211815 /nfs/dbraw/zinc/21/18/15/1044211815.db2.gz BYVAATZNXHUDDC-LLVKDONJSA-N 1 2 324.902 4.401 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cccc3c2CCOC3)c1 ZINC000883078290 1044220103 /nfs/dbraw/zinc/22/01/03/1044220103.db2.gz MMBQMCKIHRKHQK-UHFFFAOYSA-N 1 2 314.454 4.020 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)s1 ZINC000347263902 1044222010 /nfs/dbraw/zinc/22/20/10/1044222010.db2.gz HVYNAELKHORJFV-BZNIZROVSA-N 1 2 302.443 4.333 20 0 DIADLO Cc1ncc(C[N@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)s1 ZINC000347263902 1044222015 /nfs/dbraw/zinc/22/20/15/1044222015.db2.gz HVYNAELKHORJFV-BZNIZROVSA-N 1 2 302.443 4.333 20 0 DIADLO CCC[C@](C)([NH2+]Cc1ncn(-c2ccccc2)n1)c1ccccc1 ZINC000934181849 1044229801 /nfs/dbraw/zinc/22/98/01/1044229801.db2.gz GQVOHJYMTNTFQC-FQEVSTJZSA-N 1 2 320.440 4.072 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+]Cc2c(Cl)oc3ccccc32)n1 ZINC000883187585 1044230696 /nfs/dbraw/zinc/23/06/96/1044230696.db2.gz QZEVSNFMGVWDCQ-UHFFFAOYSA-N 1 2 303.793 4.223 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nnc(C(C)C)[nH]1)c1sccc1Cl ZINC000883208322 1044235518 /nfs/dbraw/zinc/23/55/18/1044235518.db2.gz DBNJLJSJZKTISI-ONGXEEELSA-N 1 2 312.870 4.445 20 0 DIADLO Cc1ccc(CNc2[nH+]c3ccccc3n2C2CCCCC2)nn1 ZINC000883211137 1044237632 /nfs/dbraw/zinc/23/76/32/1044237632.db2.gz HGSLDKYEQNQGBL-UHFFFAOYSA-N 1 2 321.428 4.252 20 0 DIADLO CCc1nnc(C[NH2+][C@H](CC)c2sccc2Cl)s1 ZINC000883223781 1044238230 /nfs/dbraw/zinc/23/82/30/1044238230.db2.gz XCMILLRGTMQSBU-SECBINFHSA-N 1 2 301.868 4.056 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C(C)(C)C)[nH]1)c1ccc(Cl)s1 ZINC000293000892 1044238935 /nfs/dbraw/zinc/23/89/35/1044238935.db2.gz STZDCYZJRARLCI-VIFPVBQESA-N 1 2 312.870 4.058 20 0 DIADLO Cc1cnc(=S)n(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)c1 ZINC000131338936 1044251409 /nfs/dbraw/zinc/25/14/09/1044251409.db2.gz AWVOUWFVRXUWKJ-HNNXBMFYSA-N 1 2 319.861 4.369 20 0 DIADLO Cc1cnc(=S)n(C[N@H+]2CCC[C@H]2c2ccccc2Cl)c1 ZINC000131338936 1044251417 /nfs/dbraw/zinc/25/14/17/1044251417.db2.gz AWVOUWFVRXUWKJ-HNNXBMFYSA-N 1 2 319.861 4.369 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2cc3ccccc3c(OC)c2)o1 ZINC000934631310 1044263612 /nfs/dbraw/zinc/26/36/12/1044263612.db2.gz KBVRHNYVJSJLJY-CYBMUJFWSA-N 1 2 310.397 4.250 20 0 DIADLO Cc1ccc2cc([C@H](C)[NH2+]C3(c4ncccn4)CCC3)oc2c1 ZINC000883311634 1044265388 /nfs/dbraw/zinc/26/53/88/1044265388.db2.gz HIPMALZVOIQQJL-AWEZNQCLSA-N 1 2 307.397 4.261 20 0 DIADLO Oc1ccc(Cl)c(C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)c1 ZINC000883327038 1044273498 /nfs/dbraw/zinc/27/34/98/1044273498.db2.gz PLTQHLGKJRGEND-MRXNPFEDSA-N 1 2 319.836 4.180 20 0 DIADLO CCCc1nc(C)c(C[NH2+][C@H](C)c2nc3c(s2)CCCC3)o1 ZINC000293389645 1044279595 /nfs/dbraw/zinc/27/95/95/1044279595.db2.gz IUOOXTCWFILSNO-GFCCVEGCSA-N 1 2 319.474 4.122 20 0 DIADLO CCC[C@](C)(CC)C(=O)N[C@H]1CC[C@H](Nc2cccc[nH+]2)CC1 ZINC000563543275 1044280284 /nfs/dbraw/zinc/28/02/84/1044280284.db2.gz SWAHJQDGWFWJFS-BXWFABGCSA-N 1 2 317.477 4.137 20 0 DIADLO Cc1cccc(C2=CC[N@H+](Cc3nnc(C(C)C)o3)CC2)c1C ZINC000934844028 1044285812 /nfs/dbraw/zinc/28/58/12/1044285812.db2.gz JOJXHCXMRGYLMQ-UHFFFAOYSA-N 1 2 311.429 4.099 20 0 DIADLO Cc1cccc(C2=CC[N@@H+](Cc3nnc(C(C)C)o3)CC2)c1C ZINC000934844028 1044285828 /nfs/dbraw/zinc/28/58/28/1044285828.db2.gz JOJXHCXMRGYLMQ-UHFFFAOYSA-N 1 2 311.429 4.099 20 0 DIADLO C[C@H]([NH2+][C@@H]1c2ccccc2CC[C@@H]1F)c1ccc(Cl)cn1 ZINC000883375957 1044287337 /nfs/dbraw/zinc/28/73/37/1044287337.db2.gz CJOQKCZWOSWPOC-XNJJOIOASA-N 1 2 304.796 4.411 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+][C@@H]1c2ccccc2CC[C@H]1F ZINC000883376456 1044290954 /nfs/dbraw/zinc/29/09/54/1044290954.db2.gz LHMCIEOIJUVRCX-BKGUAONASA-N 1 2 302.393 4.222 20 0 DIADLO F[C@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1cnc(C2CC2)s1 ZINC000883382961 1044293720 /nfs/dbraw/zinc/29/37/20/1044293720.db2.gz QSGFAZMAWYGLNU-HOTGVXAUSA-N 1 2 302.418 4.136 20 0 DIADLO CCc1noc(C[N@H+]2CC=C(c3cccc4ccccc43)CC2)n1 ZINC000063762508 1044299632 /nfs/dbraw/zinc/29/96/32/1044299632.db2.gz BJWHOSXJMLKONB-UHFFFAOYSA-N 1 2 319.408 4.075 20 0 DIADLO CCc1noc(C[N@@H+]2CC=C(c3cccc4ccccc43)CC2)n1 ZINC000063762508 1044299638 /nfs/dbraw/zinc/29/96/38/1044299638.db2.gz BJWHOSXJMLKONB-UHFFFAOYSA-N 1 2 319.408 4.075 20 0 DIADLO Clc1cccc(C2=CC[N@H+](Cc3ncc(C4CC4)o3)CC2)c1 ZINC000360723722 1044304311 /nfs/dbraw/zinc/30/43/11/1044304311.db2.gz VZCMJYZFQZOEKE-UHFFFAOYSA-N 1 2 314.816 4.495 20 0 DIADLO Clc1cccc(C2=CC[N@@H+](Cc3ncc(C4CC4)o3)CC2)c1 ZINC000360723722 1044304316 /nfs/dbraw/zinc/30/43/16/1044304316.db2.gz VZCMJYZFQZOEKE-UHFFFAOYSA-N 1 2 314.816 4.495 20 0 DIADLO COCC[C@@H]1CCCCN(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000563710771 1044305443 /nfs/dbraw/zinc/30/54/43/1044305443.db2.gz VXLDAOBLWSONAY-AWEZNQCLSA-N 1 2 302.393 4.017 20 0 DIADLO Oc1cccc(C[NH2+][C@@H]2CCOc3c(Cl)cccc32)c1Cl ZINC000293637443 1044306800 /nfs/dbraw/zinc/30/68/00/1044306800.db2.gz RMNBUBZFFWQOLH-CYBMUJFWSA-N 1 2 324.207 4.312 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2cc(OC)ccc2F)on1 ZINC000293621710 1044307371 /nfs/dbraw/zinc/30/73/71/1044307371.db2.gz QLKHHCYFVKMTMT-UHFFFAOYSA-N 1 2 306.381 4.016 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1ccc(F)cc1C(F)(F)F ZINC000293662815 1044310105 /nfs/dbraw/zinc/31/01/05/1044310105.db2.gz NZCSCQCDKUQBAQ-UHFFFAOYSA-N 1 2 316.298 4.027 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1ccc(F)cc1C(F)(F)F ZINC000293662815 1044310117 /nfs/dbraw/zinc/31/01/17/1044310117.db2.gz NZCSCQCDKUQBAQ-UHFFFAOYSA-N 1 2 316.298 4.027 20 0 DIADLO CC1(CCC(=O)Nc2cccc3c2CN(c2cccc[nH+]2)C3)CC1 ZINC000935101580 1044312871 /nfs/dbraw/zinc/31/28/71/1044312871.db2.gz FXUHLUDRMNPBOV-UHFFFAOYSA-N 1 2 321.424 4.121 20 0 DIADLO CCCc1nc(C)c(C[NH2+][C@@H](COC)c2cccc(Cl)c2)o1 ZINC000293696530 1044315821 /nfs/dbraw/zinc/31/58/21/1044315821.db2.gz OBVXRSNRGSKUSZ-HNNXBMFYSA-N 1 2 322.836 4.066 20 0 DIADLO Cc1ccc2c(Nc3c(F)c(F)nc(F)c3F)cccc2[nH+]1 ZINC001212795284 1044315832 /nfs/dbraw/zinc/31/58/32/1044315832.db2.gz YXYIRMJCSPZBEX-UHFFFAOYSA-N 1 2 307.250 4.238 20 0 DIADLO Cc1ccc2c(Nc3nc(Cl)cnc3Cl)cccc2[nH+]1 ZINC001212795993 1044323775 /nfs/dbraw/zinc/32/37/75/1044323775.db2.gz MMJQGJYSNBJDNW-UHFFFAOYSA-N 1 2 305.168 4.384 20 0 DIADLO Cc1ccc2c(Nc3cnc4c(C5CC5)cnn4c3)cccc2[nH+]1 ZINC001212796038 1044324188 /nfs/dbraw/zinc/32/41/88/1044324188.db2.gz PABAGSQRGOTQFP-UHFFFAOYSA-N 1 2 315.380 4.207 20 0 DIADLO O=C(Nc1cccc(C2CCC2)c1)c1cccc(-n2cc[nH+]c2)c1 ZINC000360893482 1044324434 /nfs/dbraw/zinc/32/44/34/1044324434.db2.gz LWWRVZGYQAZAMB-UHFFFAOYSA-N 1 2 317.392 4.392 20 0 DIADLO Cc1ccc2c(Nc3nccnc3C(F)(F)F)cccc2[nH+]1 ZINC001212796383 1044325205 /nfs/dbraw/zinc/32/52/05/1044325205.db2.gz XKLWAQOHGNENTI-UHFFFAOYSA-N 1 2 304.275 4.096 20 0 DIADLO CCCc1nc(C)c(C[NH2+]C2(c3c(F)cccc3F)CCC2)o1 ZINC000626178635 1044327829 /nfs/dbraw/zinc/32/78/29/1044327829.db2.gz BOLTUYCOQCXDQI-UHFFFAOYSA-N 1 2 320.383 4.383 20 0 DIADLO Cc1ccc2c(Nc3cnc4c(C(C)C)cnn4c3)cccc2[nH+]1 ZINC001212796887 1044345971 /nfs/dbraw/zinc/34/59/71/1044345971.db2.gz KQBXYAHTDCQRNJ-UHFFFAOYSA-N 1 2 317.396 4.453 20 0 DIADLO CCC1(c2ccc(Cl)cc2)CC[NH+](Cc2csnn2)CC1 ZINC000475288393 1044347660 /nfs/dbraw/zinc/34/76/60/1044347660.db2.gz YLAUBAVDORVYML-UHFFFAOYSA-N 1 2 321.877 4.135 20 0 DIADLO Cc1ccc2c(Nc3ccc4nnc(C5CC5)n4c3)cccc2[nH+]1 ZINC001212796923 1044348777 /nfs/dbraw/zinc/34/87/77/1044348777.db2.gz MYJWQBXLOPDKKE-UHFFFAOYSA-N 1 2 315.380 4.207 20 0 DIADLO Cc1ccc2c(Nc3cncc(OC(F)F)c3)cccc2[nH+]1 ZINC001212797046 1044354182 /nfs/dbraw/zinc/35/41/82/1044354182.db2.gz VGWRHLBMDCXMSY-UHFFFAOYSA-N 1 2 301.296 4.283 20 0 DIADLO Cc1ccc2c(Nc3ccnn3CC(F)(F)F)cccc2[nH+]1 ZINC001212797077 1044355825 /nfs/dbraw/zinc/35/58/25/1044355825.db2.gz WSPPBMYQVXYNQU-UHFFFAOYSA-N 1 2 306.291 4.046 20 0 DIADLO Cc1ncc(C[N@@H+]2Cc3ccc(C)cc3C2)n1-c1ccccc1 ZINC000361113162 1044359334 /nfs/dbraw/zinc/35/93/34/1044359334.db2.gz KPMUDZMWQIRBDU-UHFFFAOYSA-N 1 2 303.409 4.005 20 0 DIADLO Cc1ncc(C[N@H+]2Cc3ccc(C)cc3C2)n1-c1ccccc1 ZINC000361113162 1044359345 /nfs/dbraw/zinc/35/93/45/1044359345.db2.gz KPMUDZMWQIRBDU-UHFFFAOYSA-N 1 2 303.409 4.005 20 0 DIADLO Cc1[nH+]cc(CN2Cc3ccc(C)cc3C2)n1-c1ccccc1 ZINC000361113162 1044359356 /nfs/dbraw/zinc/35/93/56/1044359356.db2.gz KPMUDZMWQIRBDU-UHFFFAOYSA-N 1 2 303.409 4.005 20 0 DIADLO CCO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2ccncc2CC)cs1 ZINC000361119754 1044363055 /nfs/dbraw/zinc/36/30/55/1044363055.db2.gz MFZVNQOWYJPQSM-STQMWFEESA-N 1 2 319.474 4.049 20 0 DIADLO CC(C)Cn1cc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)cn1 ZINC000564245987 1044363204 /nfs/dbraw/zinc/36/32/04/1044363204.db2.gz ZPXNCUBVXIUIQI-KRWDZBQOSA-N 1 2 303.837 4.140 20 0 DIADLO CC(C)Cn1cc(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)cn1 ZINC000564245987 1044363218 /nfs/dbraw/zinc/36/32/18/1044363218.db2.gz ZPXNCUBVXIUIQI-KRWDZBQOSA-N 1 2 303.837 4.140 20 0 DIADLO CCO[C@@H](C)c1nc(C[NH2+][C@H](C)c2ccncc2CC)cs1 ZINC000361119752 1044363893 /nfs/dbraw/zinc/36/38/93/1044363893.db2.gz MFZVNQOWYJPQSM-OLZOCXBDSA-N 1 2 319.474 4.049 20 0 DIADLO FC(F)(F)c1cccnc1C[N@@H+]1Cc2ccccc2C2(CC2)C1 ZINC000361144353 1044365966 /nfs/dbraw/zinc/36/59/66/1044365966.db2.gz XWOUWAABIABITR-UHFFFAOYSA-N 1 2 318.342 4.148 20 0 DIADLO FC(F)(F)c1cccnc1C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000361144353 1044365980 /nfs/dbraw/zinc/36/59/80/1044365980.db2.gz XWOUWAABIABITR-UHFFFAOYSA-N 1 2 318.342 4.148 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3cncc(F)c3)cs2)o1 ZINC000361134503 1044366457 /nfs/dbraw/zinc/36/64/57/1044366457.db2.gz GHHMMHOPDGGJLT-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ccc2c(Nc3ccc(C(N)=O)c(Cl)c3)cccc2[nH+]1 ZINC001212797715 1044370435 /nfs/dbraw/zinc/37/04/35/1044370435.db2.gz GBCQQRDXCROVKY-UHFFFAOYSA-N 1 2 311.772 4.039 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H]2CCOc3c(F)ccc(F)c32)c(C)o1 ZINC000361177127 1044371173 /nfs/dbraw/zinc/37/11/73/1044371173.db2.gz GUDHIZTYJATLHL-MEBBXXQBSA-N 1 2 307.340 4.349 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCOc2c(F)ccc(F)c21)c1ccc(Cl)cn1 ZINC000361182335 1044371234 /nfs/dbraw/zinc/37/12/34/1044371234.db2.gz YSGZYLUNHMPGQM-YMTOWFKASA-N 1 2 324.758 4.188 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ncc(CSC)s1 ZINC000294077124 1044375935 /nfs/dbraw/zinc/37/59/35/1044375935.db2.gz LCNWIMAOCIFRAA-GFCCVEGCSA-N 1 2 322.499 4.174 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@@H]2CCOc3c(F)ccc(F)c32)o1 ZINC000361236899 1044376961 /nfs/dbraw/zinc/37/69/61/1044376961.db2.gz MDLNNJJNBWFUAR-IXPVHAAZSA-N 1 2 319.351 4.295 20 0 DIADLO CC[C@H](C)N(Cc1ccccc1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000564422794 1044376884 /nfs/dbraw/zinc/37/68/84/1044376884.db2.gz AGSJTLJWZNRLEO-HNNXBMFYSA-N 1 2 322.412 4.167 20 0 DIADLO Cc1ccc2c(Nc3ccc4c(c3)S(=O)(=O)C=C4)cccc2[nH+]1 ZINC001212797885 1044377492 /nfs/dbraw/zinc/37/74/92/1044377492.db2.gz PZIQTQHNSDECCT-UHFFFAOYSA-N 1 2 322.389 4.045 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@@H]2CCOc3c(F)ccc(F)c32)o1 ZINC000361236898 1044377478 /nfs/dbraw/zinc/37/74/78/1044377478.db2.gz MDLNNJJNBWFUAR-IFUGULHKSA-N 1 2 319.351 4.295 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cncc(C(F)(F)F)c1 ZINC000361286920 1044386321 /nfs/dbraw/zinc/38/63/21/1044386321.db2.gz HYLJCGAOKCLJJQ-LLVKDONJSA-N 1 2 312.310 4.433 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cncc(C(F)(F)F)c1 ZINC000361286920 1044386339 /nfs/dbraw/zinc/38/63/39/1044386339.db2.gz HYLJCGAOKCLJJQ-LLVKDONJSA-N 1 2 312.310 4.433 20 0 DIADLO FC(F)(F)c1cncc(C[N@@H+]2CCC[C@@H]2c2ccsc2)c1 ZINC000361300582 1044387156 /nfs/dbraw/zinc/38/71/56/1044387156.db2.gz SBLVBLNLSFZCMH-CQSZACIVSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cncc(C[N@H+]2CCC[C@@H]2c2ccsc2)c1 ZINC000361300582 1044387173 /nfs/dbraw/zinc/38/71/73/1044387173.db2.gz SBLVBLNLSFZCMH-CQSZACIVSA-N 1 2 312.360 4.499 20 0 DIADLO CCCc1ccc(-c2ccc(NC(=O)Cn3cc[nH+]c3)cc2)cc1 ZINC000564642118 1044394701 /nfs/dbraw/zinc/39/47/01/1044394701.db2.gz VHIFKVZWKPIFJQ-UHFFFAOYSA-N 1 2 319.408 4.141 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+]Cc2nc(C3CCC3)no2)cc1 ZINC000639563972 1044396452 /nfs/dbraw/zinc/39/64/52/1044396452.db2.gz FQVXIFUBVMRWRL-LBPRGKRZSA-N 1 2 317.458 4.300 20 0 DIADLO CCCCn1ncc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1C ZINC000347325179 1044406431 /nfs/dbraw/zinc/40/64/31/1044406431.db2.gz ADJKSRJDDKHQHV-HNNXBMFYSA-N 1 2 323.444 4.350 20 0 DIADLO COc1ccccc1OCCSCCc1[nH+]cc(C)cc1C ZINC000564980907 1044408734 /nfs/dbraw/zinc/40/87/34/1044408734.db2.gz LFFCPOHRWNAGNA-UHFFFAOYSA-N 1 2 317.454 4.062 20 0 DIADLO FC(F)C1([NH2+]Cc2cccc(OC(F)(F)F)c2)CCCC1 ZINC001202629286 1044409806 /nfs/dbraw/zinc/40/98/06/1044409806.db2.gz PNKLTLOMRDWCJE-UHFFFAOYSA-N 1 2 309.278 4.253 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2nccn2-c2ccccc2)cc1 ZINC000361498606 1044410178 /nfs/dbraw/zinc/41/01/78/1044410178.db2.gz VDXXSYVMIUWZMH-IBGZPJMESA-N 1 2 321.399 4.349 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2nccn2-c2ccccc2)cc1 ZINC000361498606 1044410184 /nfs/dbraw/zinc/41/01/84/1044410184.db2.gz VDXXSYVMIUWZMH-IBGZPJMESA-N 1 2 321.399 4.349 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1nccn1-c1ccccc1 ZINC000361494898 1044410235 /nfs/dbraw/zinc/41/02/35/1044410235.db2.gz ARZYZUCUXLYYKX-OAHLLOKOSA-N 1 2 309.388 4.204 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1nccn1-c1ccccc1 ZINC000361494898 1044410236 /nfs/dbraw/zinc/41/02/36/1044410236.db2.gz ARZYZUCUXLYYKX-OAHLLOKOSA-N 1 2 309.388 4.204 20 0 DIADLO CC(C)n1ccnc1C[N@H+](C)[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000361579955 1044420042 /nfs/dbraw/zinc/42/00/42/1044420042.db2.gz YLSVEALRQPWTCO-CHWSQXEVSA-N 1 2 303.372 4.017 20 0 DIADLO CC(C)n1ccnc1C[N@@H+](C)[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000361579955 1044420047 /nfs/dbraw/zinc/42/00/47/1044420047.db2.gz YLSVEALRQPWTCO-CHWSQXEVSA-N 1 2 303.372 4.017 20 0 DIADLO Cc1ccccc1[C@H](C)c1noc([C@@H](c2ccccc2)[NH+](C)C)n1 ZINC000565330380 1044428136 /nfs/dbraw/zinc/42/81/36/1044428136.db2.gz GQLLDHFKSPKIRH-MAUKXSAKSA-N 1 2 321.424 4.181 20 0 DIADLO c1cc([NH+]2CCCCC2)ccc1Nc1nc(C2CC2)ns1 ZINC000301935961 1044430372 /nfs/dbraw/zinc/43/03/72/1044430372.db2.gz UBDRVSXJLMYQQB-UHFFFAOYSA-N 1 2 300.431 4.149 20 0 DIADLO FC(F)C1CC[NH+](Cc2csc(C3CCCC3)n2)CC1 ZINC000361698114 1044432050 /nfs/dbraw/zinc/43/20/50/1044432050.db2.gz BRLNIADIDIYVNF-UHFFFAOYSA-N 1 2 300.418 4.278 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)nc1 ZINC000565526678 1044438933 /nfs/dbraw/zinc/43/89/33/1044438933.db2.gz AUBQUNJECQHMEU-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)nc1 ZINC000565526678 1044438936 /nfs/dbraw/zinc/43/89/36/1044438936.db2.gz AUBQUNJECQHMEU-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1CCC[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000565494247 1044439701 /nfs/dbraw/zinc/43/97/01/1044439701.db2.gz FVLVHYXHWHYOQR-UHFFFAOYSA-N 1 2 317.436 4.129 20 0 DIADLO Cc1ccccc1CCC[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000565494247 1044439705 /nfs/dbraw/zinc/43/97/05/1044439705.db2.gz FVLVHYXHWHYOQR-UHFFFAOYSA-N 1 2 317.436 4.129 20 0 DIADLO Cc1ccc2c(Nc3ccc(C(=O)CCCO)cc3)cccc2[nH+]1 ZINC001212798330 1044443408 /nfs/dbraw/zinc/44/34/08/1044443408.db2.gz FGKSYQLPSNXCHU-UHFFFAOYSA-N 1 2 320.392 4.242 20 0 DIADLO Cc1ccc2c(Nc3ccc4c(c3C)OCCO4)cccc2[nH+]1 ZINC001212798400 1044445825 /nfs/dbraw/zinc/44/58/25/1044445825.db2.gz GFSSXDDUZQNASP-UHFFFAOYSA-N 1 2 306.365 4.366 20 0 DIADLO Clc1cc2c(s1)CC[N@H+](Cc1cc3cccnc3o1)C2 ZINC000565659474 1044448263 /nfs/dbraw/zinc/44/82/63/1044448263.db2.gz JXJSVYNOAOETRX-UHFFFAOYSA-N 1 2 304.802 4.101 20 0 DIADLO Clc1cc2c(s1)CC[N@@H+](Cc1cc3cccnc3o1)C2 ZINC000565659474 1044448273 /nfs/dbraw/zinc/44/82/73/1044448273.db2.gz JXJSVYNOAOETRX-UHFFFAOYSA-N 1 2 304.802 4.101 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccccc1OC1CCCC1 ZINC000294712720 1044449884 /nfs/dbraw/zinc/44/98/84/1044449884.db2.gz BPRBCIODLFOYIG-HNNXBMFYSA-N 1 2 313.445 4.075 20 0 DIADLO Cc1ccc2c(Nc3cccc4c3OCC[C@@H]4O)cccc2[nH+]1 ZINC001212798788 1044450587 /nfs/dbraw/zinc/45/05/87/1044450587.db2.gz SGKUXNUVLWKKGW-SFHVURJKSA-N 1 2 306.365 4.103 20 0 DIADLO Cc1cc(C)c(C[NH2+]Cc2noc(-c3cccs3)n2)cc1C ZINC000294712026 1044450885 /nfs/dbraw/zinc/45/08/85/1044450885.db2.gz BZLMPNZZWSIHOK-UHFFFAOYSA-N 1 2 313.426 4.013 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccccc1OC1CCCC1 ZINC000294712724 1044451491 /nfs/dbraw/zinc/45/14/91/1044451491.db2.gz BPRBCIODLFOYIG-OAHLLOKOSA-N 1 2 313.445 4.075 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)o1 ZINC000117346667 1044477647 /nfs/dbraw/zinc/47/76/47/1044477647.db2.gz RRAIKTAJQJDUIV-HNNXBMFYSA-N 1 2 319.836 4.403 20 0 DIADLO CCc1nnc(C[N@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)o1 ZINC000117346667 1044477654 /nfs/dbraw/zinc/47/76/54/1044477654.db2.gz RRAIKTAJQJDUIV-HNNXBMFYSA-N 1 2 319.836 4.403 20 0 DIADLO Cc1cc(C)c([C@H](C)[NH2+]Cc2ncn(-c3ccccc3)n2)cc1C ZINC000295047685 1044482956 /nfs/dbraw/zinc/48/29/56/1044482956.db2.gz QAAMGSHTTXIUKR-KRWDZBQOSA-N 1 2 320.440 4.043 20 0 DIADLO C[C@H](c1nnc(-c2cccs2)o1)[N@@H+]1CC[C@H]1c1ccccc1 ZINC000362178259 1044486188 /nfs/dbraw/zinc/48/61/88/1044486188.db2.gz BULFJOCPQFXIIF-OCCSQVGLSA-N 1 2 311.410 4.306 20 0 DIADLO C[C@H](c1nnc(-c2cccs2)o1)[N@H+]1CC[C@H]1c1ccccc1 ZINC000362178259 1044486192 /nfs/dbraw/zinc/48/61/92/1044486192.db2.gz BULFJOCPQFXIIF-OCCSQVGLSA-N 1 2 311.410 4.306 20 0 DIADLO Cc1ccc(-c2cc(C[NH2+]C(C)(C)c3nccs3)on2)cc1 ZINC000118848489 1044487674 /nfs/dbraw/zinc/48/76/74/1044487674.db2.gz MDIJZXRTPPZVCD-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO Cc1cccc(NC(=O)C[N@@H+]([C@@H](C)c2ccco2)C2CC2)c1C ZINC000119108404 1044489378 /nfs/dbraw/zinc/48/93/78/1044489378.db2.gz JDPJPNZPOZKQCC-HNNXBMFYSA-N 1 2 312.413 4.061 20 0 DIADLO Cc1cccc(NC(=O)C[N@H+]([C@@H](C)c2ccco2)C2CC2)c1C ZINC000119108404 1044489386 /nfs/dbraw/zinc/48/93/86/1044489386.db2.gz JDPJPNZPOZKQCC-HNNXBMFYSA-N 1 2 312.413 4.061 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2cccc3c2OC(C)(C)C3)cs1 ZINC000119185869 1044491877 /nfs/dbraw/zinc/49/18/77/1044491877.db2.gz HUPZQTVVADEDGP-LBPRGKRZSA-N 1 2 316.470 4.270 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2OC2CCCC2)c2nccn21 ZINC000295184379 1044498247 /nfs/dbraw/zinc/49/82/47/1044498247.db2.gz HZYZYLDLSQSHQF-RHSMWYFYSA-N 1 2 311.429 4.000 20 0 DIADLO Clc1cccc(Cl)c1[C@@H]([NH2+]Cc1cnns1)C1CC1 ZINC000295201585 1044499019 /nfs/dbraw/zinc/49/90/19/1044499019.db2.gz NJEBODQREPDKLD-ZDUSSCGKSA-N 1 2 314.241 4.086 20 0 DIADLO CC(F)(F)C[NH2+][C@@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000566810435 1044519234 /nfs/dbraw/zinc/51/92/34/1044519234.db2.gz DMBDSPOXHDEKMD-GFCCVEGCSA-N 1 2 308.397 4.432 20 0 DIADLO Cc1sccc1C[N@H+](C)CC(=O)Nc1c(C)cc(C)cc1C ZINC000295415976 1044524014 /nfs/dbraw/zinc/52/40/14/1044524014.db2.gz RZIDFZQFWQGLPX-UHFFFAOYSA-N 1 2 316.470 4.052 20 0 DIADLO Cc1sccc1C[N@@H+](C)CC(=O)Nc1c(C)cc(C)cc1C ZINC000295415976 1044524029 /nfs/dbraw/zinc/52/40/29/1044524029.db2.gz RZIDFZQFWQGLPX-UHFFFAOYSA-N 1 2 316.470 4.052 20 0 DIADLO CC[N@H+](Cc1ncc(CSC)s1)[C@@H](C)c1cccc(O)c1 ZINC000295436020 1044526354 /nfs/dbraw/zinc/52/63/54/1044526354.db2.gz UDVGKGNMDIPUIZ-LBPRGKRZSA-N 1 2 322.499 4.295 20 0 DIADLO CC[N@@H+](Cc1ncc(CSC)s1)[C@@H](C)c1cccc(O)c1 ZINC000295436020 1044526366 /nfs/dbraw/zinc/52/63/66/1044526366.db2.gz UDVGKGNMDIPUIZ-LBPRGKRZSA-N 1 2 322.499 4.295 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CCc3ccc(-c4ccccc4)cc3C2)o1 ZINC000295760864 1044555972 /nfs/dbraw/zinc/55/59/72/1044555972.db2.gz RNXCIBZHOFLSSI-AWEZNQCLSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CCc3ccc(-c4ccccc4)cc3C2)o1 ZINC000295760864 1044555985 /nfs/dbraw/zinc/55/59/85/1044555985.db2.gz RNXCIBZHOFLSSI-AWEZNQCLSA-N 1 2 319.408 4.164 20 0 DIADLO CCc1cnc(C[N@H+]2CC=C(c3cccc(Cl)c3)CC2)o1 ZINC000567300191 1044558749 /nfs/dbraw/zinc/55/87/49/1044558749.db2.gz GMWDUPCAVARSAE-UHFFFAOYSA-N 1 2 302.805 4.180 20 0 DIADLO CCc1cnc(C[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)o1 ZINC000567300191 1044558759 /nfs/dbraw/zinc/55/87/59/1044558759.db2.gz GMWDUPCAVARSAE-UHFFFAOYSA-N 1 2 302.805 4.180 20 0 DIADLO Cc1cc(Cl)nc(C[NH2+][C@H](C)c2nc3c(s2)CCCC3)c1 ZINC000282937018 1044574065 /nfs/dbraw/zinc/57/40/65/1044574065.db2.gz YQGCECNKOOMLIK-LLVKDONJSA-N 1 2 321.877 4.230 20 0 DIADLO Cc1ccccc1-c1ccccc1C[N@@H+]1CCC[C@@H]1c1ncon1 ZINC000567557710 1044575184 /nfs/dbraw/zinc/57/51/84/1044575184.db2.gz PFFKXLONORGGMU-LJQANCHMSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@@H]1c1ncon1 ZINC000567557710 1044575197 /nfs/dbraw/zinc/57/51/97/1044575197.db2.gz PFFKXLONORGGMU-LJQANCHMSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccccc1-c1ccccc1C[N@@H+]1CCC[C@H]1c1ncon1 ZINC000567557709 1044575276 /nfs/dbraw/zinc/57/52/76/1044575276.db2.gz PFFKXLONORGGMU-IBGZPJMESA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@H]1c1ncon1 ZINC000567557709 1044575286 /nfs/dbraw/zinc/57/52/86/1044575286.db2.gz PFFKXLONORGGMU-IBGZPJMESA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccc2c(c1)[nH]cc2C1=CC[N@H+](Cc2cscn2)CC1 ZINC000363013119 1044575658 /nfs/dbraw/zinc/57/56/58/1044575658.db2.gz CQPDPEVLRMGRNG-UHFFFAOYSA-N 1 2 309.438 4.222 20 0 DIADLO Cc1ccc2c(c1)[nH]cc2C1=CC[N@@H+](Cc2cscn2)CC1 ZINC000363013119 1044575669 /nfs/dbraw/zinc/57/56/69/1044575669.db2.gz CQPDPEVLRMGRNG-UHFFFAOYSA-N 1 2 309.438 4.222 20 0 DIADLO CCc1noc(C)c1C[N@@H+]1CCC[C@H]1c1nc2cc(C)ccc2[nH]1 ZINC000296013784 1044582701 /nfs/dbraw/zinc/58/27/01/1044582701.db2.gz QQCFGBHQWZAFLX-SFHVURJKSA-N 1 2 324.428 4.067 20 0 DIADLO CCc1noc(C)c1C[N@H+]1CCC[C@H]1c1nc2cc(C)ccc2[nH]1 ZINC000296013784 1044582718 /nfs/dbraw/zinc/58/27/18/1044582718.db2.gz QQCFGBHQWZAFLX-SFHVURJKSA-N 1 2 324.428 4.067 20 0 DIADLO CCc1noc(C)c1C[N@@H+]1CCC[C@H]1c1nc2ccc(C)cc2[nH]1 ZINC000296013784 1044582734 /nfs/dbraw/zinc/58/27/34/1044582734.db2.gz QQCFGBHQWZAFLX-SFHVURJKSA-N 1 2 324.428 4.067 20 0 DIADLO CCc1noc(C)c1C[N@H+]1CCC[C@H]1c1nc2ccc(C)cc2[nH]1 ZINC000296013784 1044582750 /nfs/dbraw/zinc/58/27/50/1044582750.db2.gz QQCFGBHQWZAFLX-SFHVURJKSA-N 1 2 324.428 4.067 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3cccnc3Cl)CCC2)c(F)c1 ZINC000136129433 1044586621 /nfs/dbraw/zinc/58/66/21/1044586621.db2.gz GRNXYNBGPPWDCW-UHFFFAOYSA-N 1 2 308.759 4.182 20 0 DIADLO Cc1cc(C(=O)Nc2cccc(-c3[nH]c(C)c(C)[nH+]3)c2)c(C)o1 ZINC000363115698 1044587485 /nfs/dbraw/zinc/58/74/85/1044587485.db2.gz SKAGEMLYFLICIB-UHFFFAOYSA-N 1 2 309.369 4.156 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ccccc3C)c2)[nH+]c1C ZINC000363185670 1044591457 /nfs/dbraw/zinc/59/14/57/1044591457.db2.gz DFLHKOVKQVVCJL-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@@H](C)c2cccc3c2OCO3)on1 ZINC000925158522 1044602776 /nfs/dbraw/zinc/60/27/76/1044602776.db2.gz VABUTVQHEHLCNB-LBPRGKRZSA-N 1 2 316.401 4.158 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)[C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000444712304 1044610864 /nfs/dbraw/zinc/61/08/64/1044610864.db2.gz YTTYBYIHSTWXBE-AWEZNQCLSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)[C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000444712304 1044610872 /nfs/dbraw/zinc/61/08/72/1044610872.db2.gz YTTYBYIHSTWXBE-AWEZNQCLSA-N 1 2 301.434 4.177 20 0 DIADLO CC(C)[C@H]1CCC[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000049077732 1044611520 /nfs/dbraw/zinc/61/15/20/1044611520.db2.gz JUPDUYRYUXLDHC-CYBMUJFWSA-N 1 2 315.244 4.052 20 0 DIADLO CC(C)[C@H]1CCC[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000049077732 1044611526 /nfs/dbraw/zinc/61/15/26/1044611526.db2.gz JUPDUYRYUXLDHC-CYBMUJFWSA-N 1 2 315.244 4.052 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cc(-c3cccs3)on2)ccc1F ZINC000444737695 1044614328 /nfs/dbraw/zinc/61/43/28/1044614328.db2.gz PODLQFYYYPOCKQ-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cc(-c3cccs3)on2)ccc1F ZINC000444737695 1044614338 /nfs/dbraw/zinc/61/43/38/1044614338.db2.gz PODLQFYYYPOCKQ-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)c1ncco1 ZINC000886273864 1044628431 /nfs/dbraw/zinc/62/84/31/1044628431.db2.gz HZCGTHNNAMHBGU-QMMMGPOBSA-N 1 2 304.699 4.198 20 0 DIADLO Clc1scc(C[NH2+]Cc2cc(C3CC3)no2)c1Cl ZINC000886270599 1044629295 /nfs/dbraw/zinc/62/92/95/1044629295.db2.gz IAJYNDPRYFADIV-UHFFFAOYSA-N 1 2 303.214 4.210 20 0 DIADLO Cc1cc(NC(=O)[C@@H](C)Sc2ccccc2Cl)cc[nH+]1 ZINC000195655925 1044632722 /nfs/dbraw/zinc/63/27/22/1044632722.db2.gz CPVZOCHDSUAXDF-LLVKDONJSA-N 1 2 306.818 4.163 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)[nH]1 ZINC000296605485 1044634131 /nfs/dbraw/zinc/63/41/31/1044634131.db2.gz VXTVBIJUMXAZSD-VIFPVBQESA-N 1 2 313.232 4.086 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccccc2-n2cc[nH+]c2)c(C)c1 ZINC001202734928 1044643850 /nfs/dbraw/zinc/64/38/50/1044643850.db2.gz MPPFFORGIICDGB-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO Cc1cccn2c(CNc3cccnc3-c3ccccc3)c[nH+]c12 ZINC000568894511 1044659166 /nfs/dbraw/zinc/65/91/66/1044659166.db2.gz SLWDUUPZDRPOSV-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO C[C@@H]([NH2+]Cc1ncoc1-c1ccccc1)c1cc(F)ccc1F ZINC000364492734 1044667325 /nfs/dbraw/zinc/66/73/25/1044667325.db2.gz HZQGNXSTTGZGPU-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO Cc1cc(C)c(CNC(=O)[C@](C)(Cc2ccccc2)C(C)C)c[nH+]1 ZINC001275917560 1044668217 /nfs/dbraw/zinc/66/82/17/1044668217.db2.gz UQZZBBJBXLGRQD-OAQYLSRUSA-N 1 2 324.468 4.220 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ccc(F)cc3)c2)[nH+]c1C ZINC000364516320 1044668786 /nfs/dbraw/zinc/66/87/86/1044668786.db2.gz DXGIJPFMMLIGLS-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000364520100 1044669116 /nfs/dbraw/zinc/66/91/16/1044669116.db2.gz VDVRVPBIQUEAAC-GOSISDBHSA-N 1 2 320.392 4.263 20 0 DIADLO COc1ccc([C@H]([NH2+][C@H]2CCc3cccnc32)c2ccco2)cc1 ZINC000886622440 1044670921 /nfs/dbraw/zinc/67/09/21/1044670921.db2.gz SRCBOHBENUQGDM-PXNSSMCTSA-N 1 2 320.392 4.050 20 0 DIADLO CC(C)(C)[C@@H]1CCC[N@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC000475621424 1044675397 /nfs/dbraw/zinc/67/53/97/1044675397.db2.gz DWDAXMZCNYOWGI-SNVBAGLBSA-N 1 2 306.397 4.420 20 0 DIADLO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC000475621424 1044675401 /nfs/dbraw/zinc/67/54/01/1044675401.db2.gz DWDAXMZCNYOWGI-SNVBAGLBSA-N 1 2 306.397 4.420 20 0 DIADLO Cc1nc(C2CC[NH+]([C@@H](C)c3c(F)cccc3F)CC2)[nH]c1C ZINC000886668137 1044677702 /nfs/dbraw/zinc/67/77/02/1044677702.db2.gz NZKGGJAACIGYEL-ZDUSSCGKSA-N 1 2 319.399 4.245 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2cc(C3CC3)no2)c(Cl)c1 ZINC000886683911 1044678847 /nfs/dbraw/zinc/67/88/47/1044678847.db2.gz AJTYBJZHXVLYOX-SNVBAGLBSA-N 1 2 306.793 4.065 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](C)Cc1ccc2ccccc2c1 ZINC000840992369 1044680891 /nfs/dbraw/zinc/68/08/91/1044680891.db2.gz PSIWCJZWSZOZNC-UHFFFAOYSA-N 1 2 313.832 4.167 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000840992369 1044680897 /nfs/dbraw/zinc/68/08/97/1044680897.db2.gz PSIWCJZWSZOZNC-UHFFFAOYSA-N 1 2 313.832 4.167 20 0 DIADLO Cc1ncc2c(n1)CC[N@@H+](Cc1ccc(Cl)c3ccccc13)C2 ZINC000569209704 1044682558 /nfs/dbraw/zinc/68/25/58/1044682558.db2.gz MXQUKUADAPUBRG-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1ncc2c(n1)CC[N@H+](Cc1ccc(Cl)c3ccccc13)C2 ZINC000569209704 1044682565 /nfs/dbraw/zinc/68/25/65/1044682565.db2.gz MXQUKUADAPUBRG-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000365284016 1044684701 /nfs/dbraw/zinc/68/47/01/1044684701.db2.gz SLJHWGLQKIUETC-QGZVFWFLSA-N 1 2 317.477 4.043 20 0 DIADLO C[C@H](CC(C)(C)C)C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000475623147 1044684995 /nfs/dbraw/zinc/68/49/95/1044684995.db2.gz JZUQIZWLWWQVBI-CYBMUJFWSA-N 1 2 323.506 4.140 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000365457866 1044692902 /nfs/dbraw/zinc/69/29/02/1044692902.db2.gz IIFKMWLWKZYNKO-IAGOWNOFSA-N 1 2 319.493 4.123 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2cnc(Cl)s2)c1 ZINC000078670214 1044710960 /nfs/dbraw/zinc/71/09/60/1044710960.db2.gz FBVXWDBCFRAUQN-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2cnc(Cl)s2)c1 ZINC000078670214 1044710970 /nfs/dbraw/zinc/71/09/70/1044710970.db2.gz FBVXWDBCFRAUQN-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1cncc(F)c1 ZINC000366263612 1044717289 /nfs/dbraw/zinc/71/72/89/1044717289.db2.gz ASLWYZNARJJXLK-IFXJQAMLSA-N 1 2 307.372 4.056 20 0 DIADLO Cc1cc(C)c(NC(=O)CO[C@@H]2CCCc3ccccc32)c(C)[nH+]1 ZINC000569884284 1044718961 /nfs/dbraw/zinc/71/89/61/1044718961.db2.gz UNYYVNKISTYMKK-GOSISDBHSA-N 1 2 324.424 4.040 20 0 DIADLO Cc1cc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)sc1C ZINC000366514132 1044721259 /nfs/dbraw/zinc/72/12/59/1044721259.db2.gz AAVNJTGIIRVITH-UHFFFAOYSA-N 1 2 311.410 4.316 20 0 DIADLO Clc1ccc2c(c1)CC[N@@H+](Cc1cnc(C3CC3)s1)C2 ZINC000570021432 1044725986 /nfs/dbraw/zinc/72/59/86/1044725986.db2.gz OCHRWAYHJNQGBK-UHFFFAOYSA-N 1 2 304.846 4.232 20 0 DIADLO Clc1ccc2c(c1)CC[N@H+](Cc1cnc(C3CC3)s1)C2 ZINC000570021432 1044725994 /nfs/dbraw/zinc/72/59/94/1044725994.db2.gz OCHRWAYHJNQGBK-UHFFFAOYSA-N 1 2 304.846 4.232 20 0 DIADLO C[N@@H+](Cc1ccccc1C(F)(F)F)Cc1cnccc1Cl ZINC001137236951 1044728664 /nfs/dbraw/zinc/72/86/64/1044728664.db2.gz RXGHTOMDVRSPDU-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@H+](Cc1ccccc1C(F)(F)F)Cc1cnccc1Cl ZINC001137236951 1044728679 /nfs/dbraw/zinc/72/86/79/1044728679.db2.gz RXGHTOMDVRSPDU-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO Cc1ccc(C[NH2+][C@H](CO)c2c(Cl)cccc2Cl)cc1 ZINC000475629870 1044741248 /nfs/dbraw/zinc/74/12/48/1044741248.db2.gz WSKOZYSDYFWMMJ-OAHLLOKOSA-N 1 2 310.224 4.125 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000524179627 1044760492 /nfs/dbraw/zinc/76/04/92/1044760492.db2.gz ZBNWTONZVRVBHV-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000524179627 1044760503 /nfs/dbraw/zinc/76/05/03/1044760503.db2.gz ZBNWTONZVRVBHV-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO COCC[N@H+](Cc1cc(C(C)(C)C)on1)[C@@H](C)c1ccccc1 ZINC000570609363 1044768968 /nfs/dbraw/zinc/76/89/68/1044768968.db2.gz XSPCBZNOQZANIF-HNNXBMFYSA-N 1 2 316.445 4.182 20 0 DIADLO COCC[N@@H+](Cc1cc(C(C)(C)C)on1)[C@@H](C)c1ccccc1 ZINC000570609363 1044768985 /nfs/dbraw/zinc/76/89/85/1044768985.db2.gz XSPCBZNOQZANIF-HNNXBMFYSA-N 1 2 316.445 4.182 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@@H](c2cnn(C)c2)c2ccccc2)o1 ZINC000368240699 1044770596 /nfs/dbraw/zinc/77/05/96/1044770596.db2.gz DRXBLQBHJPAUOD-HEFCMCLBSA-N 1 2 321.424 4.016 20 0 DIADLO COc1ccccc1SCc1c[nH+]cn1Cc1ccccc1 ZINC000445594102 1044771441 /nfs/dbraw/zinc/77/14/41/1044771441.db2.gz YUEJQRHMEODRAN-UHFFFAOYSA-N 1 2 310.422 4.232 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccccc2F)cs1)c1ccccn1 ZINC000368219427 1044771646 /nfs/dbraw/zinc/77/16/46/1044771646.db2.gz AVTVXDUOHHATKY-LBPRGKRZSA-N 1 2 313.401 4.195 20 0 DIADLO Cc1ccc(NC(=O)Nc2cccc(-n3cc[nH+]c3)c2)c(C)c1 ZINC001202747080 1044779347 /nfs/dbraw/zinc/77/93/47/1044779347.db2.gz OUSVRBIAGKKICB-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000570838905 1044786626 /nfs/dbraw/zinc/78/66/26/1044786626.db2.gz FYWWUSNVSXZFOU-GJZGRUSLSA-N 1 2 312.413 4.046 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000570838905 1044786637 /nfs/dbraw/zinc/78/66/37/1044786637.db2.gz FYWWUSNVSXZFOU-GJZGRUSLSA-N 1 2 312.413 4.046 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2ccccc2C(F)(F)F)no1 ZINC000368949827 1044794894 /nfs/dbraw/zinc/79/48/94/1044794894.db2.gz WLMZTINCHGGYOG-HNNXBMFYSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2ccccc2C(F)(F)F)no1 ZINC000368949827 1044794908 /nfs/dbraw/zinc/79/49/08/1044794908.db2.gz WLMZTINCHGGYOG-HNNXBMFYSA-N 1 2 310.319 4.339 20 0 DIADLO C[C@H]([NH2+][C@H](CO)c1c(Cl)cccc1Cl)c1ccccc1 ZINC000475633185 1044796733 /nfs/dbraw/zinc/79/67/33/1044796733.db2.gz GBDCVLAVUNEUQT-XHDPSFHLSA-N 1 2 310.224 4.378 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2cccc(Cl)n2)c2ccccn2)cc1 ZINC000369290777 1044802463 /nfs/dbraw/zinc/80/24/63/1044802463.db2.gz RCQLZGPEUDCRCD-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2ccc(Cl)cn2)c2ccccn2)cc1 ZINC000369303306 1044803895 /nfs/dbraw/zinc/80/38/95/1044803895.db2.gz OMNWZSLXYHHSJQ-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO Cc1cc(F)ncc1Nc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001212811867 1044813702 /nfs/dbraw/zinc/81/37/02/1044813702.db2.gz NWAINWIFOFJTEK-UHFFFAOYSA-N 1 2 318.352 4.015 20 0 DIADLO C[C@@H]1CN(Cc2c[nH+]cn2Cc2ccccc2)c2ccccc21 ZINC000445802319 1044823925 /nfs/dbraw/zinc/82/39/25/1044823925.db2.gz MBHIURMCIJUWSV-MRXNPFEDSA-N 1 2 303.409 4.055 20 0 DIADLO CC[C@@H](C)Sc1ccc(NC(=O)CCn2cc[nH+]c2)c(C)c1 ZINC000263856164 1044832584 /nfs/dbraw/zinc/83/25/84/1044832584.db2.gz ZSXUHSVLEPWBTK-CQSZACIVSA-N 1 2 317.458 4.111 20 0 DIADLO CC(C)Sc1ccc(C[N@@H+]2CCc3ncsc3C2)cc1 ZINC000445859799 1044837134 /nfs/dbraw/zinc/83/71/34/1044837134.db2.gz RLOHLGMOSCHZBL-UHFFFAOYSA-N 1 2 304.484 4.202 20 0 DIADLO CC(C)Sc1ccc(C[N@H+]2CCc3ncsc3C2)cc1 ZINC000445859799 1044837152 /nfs/dbraw/zinc/83/71/52/1044837152.db2.gz RLOHLGMOSCHZBL-UHFFFAOYSA-N 1 2 304.484 4.202 20 0 DIADLO CCOc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1csc(C)n1)CCO2 ZINC000370625017 1044845916 /nfs/dbraw/zinc/84/59/16/1044845916.db2.gz SZMMIKOIJMQTBQ-ABAIWWIYSA-N 1 2 318.442 4.025 20 0 DIADLO CCCCC1CCC(C(=O)N2CCC(c3c[nH]c[nH+]3)CC2)CC1 ZINC000371173095 1044863020 /nfs/dbraw/zinc/86/30/20/1044863020.db2.gz DQCJOEIWKYGONC-UHFFFAOYSA-N 1 2 317.477 4.112 20 0 DIADLO CCCCC1CCC(C(=O)N2CCC(c3c[nH+]c[nH]3)CC2)CC1 ZINC000371173095 1044863046 /nfs/dbraw/zinc/86/30/46/1044863046.db2.gz DQCJOEIWKYGONC-UHFFFAOYSA-N 1 2 317.477 4.112 20 0 DIADLO CC[N@H+](Cc1ccccn1)[C@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000371230373 1044863979 /nfs/dbraw/zinc/86/39/79/1044863979.db2.gz QMTOBQAWQXYGBV-OAHLLOKOSA-N 1 2 322.412 4.023 20 0 DIADLO CC[N@@H+](Cc1ccccn1)[C@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000371230373 1044863999 /nfs/dbraw/zinc/86/39/99/1044863999.db2.gz QMTOBQAWQXYGBV-OAHLLOKOSA-N 1 2 322.412 4.023 20 0 DIADLO Clc1cnc(C[NH+]2CCC(c3ccccn3)CC2)c(Cl)c1 ZINC000371514527 1044880311 /nfs/dbraw/zinc/88/03/11/1044880311.db2.gz NOOMQKFDFZPNCH-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2cn(-c3ccccc3)nn2)c1 ZINC000524594026 1044880418 /nfs/dbraw/zinc/88/04/18/1044880418.db2.gz BHKDRZXVQCGMMP-KRWDZBQOSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2cn(-c3ccccc3)nn2)c1 ZINC000524594026 1044880443 /nfs/dbraw/zinc/88/04/43/1044880443.db2.gz BHKDRZXVQCGMMP-KRWDZBQOSA-N 1 2 320.440 4.077 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000371646704 1044886020 /nfs/dbraw/zinc/88/60/20/1044886020.db2.gz GWOWNGNXABDKKD-HZPDHXFCSA-N 1 2 305.466 4.112 20 0 DIADLO CC(C)(C[NH2+][C@@H](c1cccs1)c1nnc[nH]1)C1=CCCCC1 ZINC000573310203 1044902509 /nfs/dbraw/zinc/90/25/09/1044902509.db2.gz KLDXOUXOCDMPDB-HNNXBMFYSA-N 1 2 316.474 4.072 20 0 DIADLO Cc1cc(NC(=O)c2ccc([C@@H](C)C(F)(F)F)cc2)c(C)c[nH+]1 ZINC000573419899 1044906938 /nfs/dbraw/zinc/90/69/38/1044906938.db2.gz LUPJCJIQHCLLGM-GFCCVEGCSA-N 1 2 322.330 4.038 20 0 DIADLO CC(C)SCCOc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000573431500 1044907166 /nfs/dbraw/zinc/90/71/66/1044907166.db2.gz OTPWEDXPASUNIS-UHFFFAOYSA-N 1 2 316.470 4.407 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@@H]2CCOc3c(F)cccc32)cs1 ZINC000372596937 1044916337 /nfs/dbraw/zinc/91/63/37/1044916337.db2.gz VWTGCMIPKLEOSK-CQSZACIVSA-N 1 2 320.433 4.193 20 0 DIADLO C[N@H+](Cc1c(F)cccc1Cl)[C@@H](CCO)c1ccccc1 ZINC000524757669 1044916286 /nfs/dbraw/zinc/91/62/86/1044916286.db2.gz ZPBRUWXSQCJGPT-KRWDZBQOSA-N 1 2 307.796 4.035 20 0 DIADLO C[N@@H+](Cc1c(F)cccc1Cl)[C@@H](CCO)c1ccccc1 ZINC000524757669 1044916293 /nfs/dbraw/zinc/91/62/93/1044916293.db2.gz ZPBRUWXSQCJGPT-KRWDZBQOSA-N 1 2 307.796 4.035 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000133539222 1044939831 /nfs/dbraw/zinc/93/98/31/1044939831.db2.gz OTTZDXZJJMMKIO-LLVKDONJSA-N 1 2 322.449 4.439 20 0 DIADLO Cc1ccccc1[C@H](c1noc(C[C@H](C)n2cc[nH+]c2)n1)C(C)C ZINC000574457934 1044955540 /nfs/dbraw/zinc/95/55/40/1044955540.db2.gz SJZJROAFPSDLCW-MAUKXSAKSA-N 1 2 324.428 4.166 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(-c2cccs2)n1)c1ccncc1F ZINC000337942171 1044965366 /nfs/dbraw/zinc/96/53/66/1044965366.db2.gz BOEDYXAEZXYQFP-SNVBAGLBSA-N 1 2 319.430 4.257 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccccc2)cs1)c1ccncc1F ZINC000337951414 1044967984 /nfs/dbraw/zinc/96/79/84/1044967984.db2.gz ZKRMARFSYFPUCU-GFCCVEGCSA-N 1 2 313.401 4.195 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2ccsc2)n1)c1ccncc1F ZINC000337947392 1044968732 /nfs/dbraw/zinc/96/87/32/1044968732.db2.gz STKLPRSORUKOCM-JTQLQIEISA-N 1 2 319.430 4.257 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc(C)cc3C)CCCCCC2)no1 ZINC000575197538 1044991523 /nfs/dbraw/zinc/99/15/23/1044991523.db2.gz DMZGUAOPCFOQRZ-UHFFFAOYSA-N 1 2 313.445 4.334 20 0 DIADLO C[C@@H]1C[N@@H+]([C@@H]2C[C@H]2c2cccc(F)c2)C[C@H](c2ccsc2)O1 ZINC000411313757 1044996363 /nfs/dbraw/zinc/99/63/63/1044996363.db2.gz CEJNFKJLURKOFY-QRVDHSFSSA-N 1 2 317.429 4.205 20 0 DIADLO C[C@@H]1C[N@H+]([C@@H]2C[C@H]2c2cccc(F)c2)C[C@H](c2ccsc2)O1 ZINC000411313757 1044996373 /nfs/dbraw/zinc/99/63/73/1044996373.db2.gz CEJNFKJLURKOFY-QRVDHSFSSA-N 1 2 317.429 4.205 20 0 DIADLO Cc1scc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1C ZINC000373691369 1045000098 /nfs/dbraw/zinc/00/00/98/1045000098.db2.gz ACKZIIPIPMMBMD-UHFFFAOYSA-N 1 2 311.410 4.316 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccccc2Oc2ccccc2)[nH]1 ZINC000411447045 1045008810 /nfs/dbraw/zinc/00/88/10/1045008810.db2.gz BJRXQSFERLJLQQ-KBPBESRZSA-N 1 2 322.412 4.317 20 0 DIADLO Cc1ccc2ncc(C[N@H+](C)Cc3cc(C(C)(C)C)n[nH]3)cc2c1 ZINC000411646238 1045024243 /nfs/dbraw/zinc/02/42/43/1045024243.db2.gz JRUDMGAAWYGXKA-UHFFFAOYSA-N 1 2 322.456 4.196 20 0 DIADLO Cc1ccc2ncc(C[N@@H+](C)Cc3cc(C(C)(C)C)n[nH]3)cc2c1 ZINC000411646238 1045024247 /nfs/dbraw/zinc/02/42/47/1045024247.db2.gz JRUDMGAAWYGXKA-UHFFFAOYSA-N 1 2 322.456 4.196 20 0 DIADLO CC1(C)CCC[C@@H]1c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000576146147 1045036742 /nfs/dbraw/zinc/03/67/42/1045036742.db2.gz KHQOGEWOBUEPGC-OAHLLOKOSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1OC(F)F)c1cscn1 ZINC000576242410 1045044118 /nfs/dbraw/zinc/04/41/18/1045044118.db2.gz YKWVRBIZHHRPTE-RKDXNWHRSA-N 1 2 316.348 4.295 20 0 DIADLO Cc1c2ccccc2[nH]c1C[N@H+](C)Cc1cnc(Cl)s1 ZINC001138397277 1045046727 /nfs/dbraw/zinc/04/67/27/1045046727.db2.gz NVBHVFNSEOSHLC-UHFFFAOYSA-N 1 2 305.834 4.218 20 0 DIADLO Cc1c2ccccc2[nH]c1C[N@@H+](C)Cc1cnc(Cl)s1 ZINC001138397277 1045046741 /nfs/dbraw/zinc/04/67/41/1045046741.db2.gz NVBHVFNSEOSHLC-UHFFFAOYSA-N 1 2 305.834 4.218 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(C(F)F)n1)c1ccc(Cl)cc1Cl ZINC000446836487 1045052738 /nfs/dbraw/zinc/05/27/38/1045052738.db2.gz RJYVJDDRLZJCJL-MRVPVSSYSA-N 1 2 320.170 4.436 20 0 DIADLO c1c(CNc2cccc[nH+]2)c(-c2ccccn2)nn1C1CCCC1 ZINC000576325067 1045053066 /nfs/dbraw/zinc/05/30/66/1045053066.db2.gz JSBZJJGBJBWFOI-UHFFFAOYSA-N 1 2 319.412 4.067 20 0 DIADLO C[N@H+](Cc1cnc(C2CCC2)s1)Cc1cc(F)cc(F)c1 ZINC000446974382 1045081967 /nfs/dbraw/zinc/08/19/67/1045081967.db2.gz IKMQIFUNNGNENL-UHFFFAOYSA-N 1 2 308.397 4.321 20 0 DIADLO C[N@@H+](Cc1cnc(C2CCC2)s1)Cc1cc(F)cc(F)c1 ZINC000446974382 1045081982 /nfs/dbraw/zinc/08/19/82/1045081982.db2.gz IKMQIFUNNGNENL-UHFFFAOYSA-N 1 2 308.397 4.321 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1cnc(C(C)C)s1 ZINC000158912645 1045082236 /nfs/dbraw/zinc/08/22/36/1045082236.db2.gz NRESJRVDYIJBLH-UHFFFAOYSA-N 1 2 300.431 4.248 20 0 DIADLO CCCCn1c(S[C@@H](C)C(C)C)nnc1[C@@H](CC)[NH+](C)C ZINC000412984848 1045116276 /nfs/dbraw/zinc/11/62/76/1045116276.db2.gz QNDHQKQNQZIIHN-UONOGXRCSA-N 1 2 312.527 4.228 20 0 DIADLO CCCCn1c(S[C@H](C)C(C)C)nnc1[C@@H](CC)[NH+](C)C ZINC000412984850 1045116746 /nfs/dbraw/zinc/11/67/46/1045116746.db2.gz QNDHQKQNQZIIHN-ZIAGYGMSSA-N 1 2 312.527 4.228 20 0 DIADLO Cc1ccc(-c2noc([C@@H](CC(C)C)n3cc[nH+]c3)n2)c(F)c1 ZINC000923969957 1045145713 /nfs/dbraw/zinc/14/57/13/1045145713.db2.gz GLONINPCRHXEKH-OAHLLOKOSA-N 1 2 314.364 4.016 20 0 DIADLO CC(C)C[C@@H](c1nc(-c2ccc(Cl)s2)no1)n1cc[nH+]c1 ZINC000924017509 1045146695 /nfs/dbraw/zinc/14/66/95/1045146695.db2.gz VTYCOKWHBXKJIN-JTQLQIEISA-N 1 2 322.821 4.284 20 0 DIADLO Cc1ccc(-c2noc([C@H](CC(C)C)n3cc[nH+]c3)n2)c(F)c1 ZINC000923969955 1045146594 /nfs/dbraw/zinc/14/65/94/1045146594.db2.gz GLONINPCRHXEKH-HNNXBMFYSA-N 1 2 314.364 4.016 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)on1 ZINC000924545920 1045176599 /nfs/dbraw/zinc/17/65/99/1045176599.db2.gz DNHXECYDABDAJP-DTWKUNHWSA-N 1 2 315.200 4.402 20 0 DIADLO CC(C)[N@H+](Cc1csc(-c2ccccn2)n1)Cc1ccccn1 ZINC000601061859 1045181687 /nfs/dbraw/zinc/18/16/87/1045181687.db2.gz DTSWNKVEYQLVMA-UHFFFAOYSA-N 1 2 324.453 4.011 20 0 DIADLO CC(C)[N@@H+](Cc1csc(-c2ccccn2)n1)Cc1ccccn1 ZINC000601061859 1045181692 /nfs/dbraw/zinc/18/16/92/1045181692.db2.gz DTSWNKVEYQLVMA-UHFFFAOYSA-N 1 2 324.453 4.011 20 0 DIADLO CCSCc1cc[nH+]c(NCc2ccc(C(F)F)nc2)c1 ZINC000601065678 1045182955 /nfs/dbraw/zinc/18/29/55/1045182955.db2.gz FCDYZTKMRRCBJR-UHFFFAOYSA-N 1 2 309.385 4.279 20 0 DIADLO c1[nH]c(C[NH2+][C@H]2CSc3ccccc32)nc1-c1ccccc1 ZINC000447855468 1045184838 /nfs/dbraw/zinc/18/48/38/1045184838.db2.gz RIIZETMHCFOYAM-INIZCTEOSA-N 1 2 307.422 4.013 20 0 DIADLO CCO[C@H]1C[C@H](Nc2ccc([NH+]3CCCC3)cc2)C12CCCC2 ZINC000320737129 1045187341 /nfs/dbraw/zinc/18/73/41/1045187341.db2.gz MZJKCSUCXDXTJL-OALUTQOASA-N 1 2 314.473 4.437 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(COCc2ccccc2)cc1)c1ncco1 ZINC000924659490 1045187767 /nfs/dbraw/zinc/18/77/67/1045187767.db2.gz LPVMZONXMFOTMY-MRXNPFEDSA-N 1 2 322.408 4.242 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1COCc1ccccc1)c1ncco1 ZINC000924659989 1045189431 /nfs/dbraw/zinc/18/94/31/1045189431.db2.gz NYKORWBWFLHNHZ-INIZCTEOSA-N 1 2 322.408 4.242 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+]C2(c3ccc(F)cc3)CC2)s1 ZINC000447930583 1045192181 /nfs/dbraw/zinc/19/21/81/1045192181.db2.gz MRUQKNCQHKNUMV-UHFFFAOYSA-N 1 2 304.434 4.359 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@H]1CCOc2c(Cl)cccc21 ZINC000924823819 1045201982 /nfs/dbraw/zinc/20/19/82/1045201982.db2.gz CWEJLBXWLCDPEI-UONOGXRCSA-N 1 2 318.804 4.127 20 0 DIADLO COC1CCC(N(C)c2cc[nH+]c3c(Cl)cccc23)CC1 ZINC000557598984 1045205710 /nfs/dbraw/zinc/20/57/10/1045205710.db2.gz QYRXLHXKHORFSW-UHFFFAOYSA-N 1 2 304.821 4.282 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+][C@H]1CCCc2oc(C)nc21 ZINC000924858797 1045206007 /nfs/dbraw/zinc/20/60/07/1045206007.db2.gz NHMFHWVQXYVXKI-DOMZBBRYSA-N 1 2 300.402 4.110 20 0 DIADLO Fc1cc(Br)cc([C@@H]2CCC[N@@H+]2CC2(F)CC2)c1 ZINC000527235093 1045206875 /nfs/dbraw/zinc/20/68/75/1045206875.db2.gz LQZQQESFQJWLDV-ZDUSSCGKSA-N 1 2 316.189 4.227 20 0 DIADLO Fc1cc(Br)cc([C@@H]2CCC[N@H+]2CC2(F)CC2)c1 ZINC000527235093 1045206887 /nfs/dbraw/zinc/20/68/87/1045206887.db2.gz LQZQQESFQJWLDV-ZDUSSCGKSA-N 1 2 316.189 4.227 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(Cl)n1C)c1csc(C(F)(F)F)c1 ZINC000924906617 1045208850 /nfs/dbraw/zinc/20/88/50/1045208850.db2.gz JUQHWHUOKBKJFO-ZETCQYMHSA-N 1 2 323.771 4.005 20 0 DIADLO CCCc1ccc([C@@H]([NH2+][C@H](C)c2noc(C)n2)C(C)C)cc1 ZINC000578101770 1045208566 /nfs/dbraw/zinc/20/85/66/1045208566.db2.gz YJKDULMRKUGNEJ-DYVFJYSZSA-N 1 2 301.434 4.378 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1Oc1ccccc1)c1cnn(C)n1 ZINC000924899356 1045209242 /nfs/dbraw/zinc/20/92/42/1045209242.db2.gz DKOLAIQYTURGJN-LSDHHAIUSA-N 1 2 322.412 4.019 20 0 DIADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccnn1C1CCC1 ZINC000924897911 1045209322 /nfs/dbraw/zinc/20/93/22/1045209322.db2.gz KDXOJONIQWLGNH-AWEZNQCLSA-N 1 2 322.412 4.114 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cnn(C)n1)c1ccccc1Oc1ccccc1 ZINC000924899343 1045209983 /nfs/dbraw/zinc/20/99/83/1045209983.db2.gz DKOLAIQYTURGJN-CABCVRRESA-N 1 2 322.412 4.019 20 0 DIADLO CC[N@H+](Cc1ncc(C(C)(C)C)s1)Cc1ccc(OC)cc1 ZINC000448218208 1045216524 /nfs/dbraw/zinc/21/65/24/1045216524.db2.gz SZJMDEMARSELGB-UHFFFAOYSA-N 1 2 318.486 4.471 20 0 DIADLO CC[N@@H+](Cc1ncc(C(C)(C)C)s1)Cc1ccc(OC)cc1 ZINC000448218208 1045216534 /nfs/dbraw/zinc/21/65/34/1045216534.db2.gz SZJMDEMARSELGB-UHFFFAOYSA-N 1 2 318.486 4.471 20 0 DIADLO COCC[N@H+](Cc1ncc(C(C)(C)C)s1)Cc1ccccc1 ZINC000448219952 1045221748 /nfs/dbraw/zinc/22/17/48/1045221748.db2.gz KIOWDHPPLKUCCY-UHFFFAOYSA-N 1 2 318.486 4.089 20 0 DIADLO COCC[N@@H+](Cc1ncc(C(C)(C)C)s1)Cc1ccccc1 ZINC000448219952 1045221757 /nfs/dbraw/zinc/22/17/57/1045221757.db2.gz KIOWDHPPLKUCCY-UHFFFAOYSA-N 1 2 318.486 4.089 20 0 DIADLO CC(C)c1cc(C[NH2+][C@H]2CCCc3c(Cl)ccnc32)on1 ZINC000925069830 1045221867 /nfs/dbraw/zinc/22/18/67/1045221867.db2.gz XAKTVVWESMSMPH-AWEZNQCLSA-N 1 2 305.809 4.014 20 0 DIADLO CCOC1CC2(C1)CCN(c1cc[nH+]c3c(Cl)cccc13)C2 ZINC000557720434 1045221903 /nfs/dbraw/zinc/22/19/03/1045221903.db2.gz RRELBMCJBJEOFP-UHFFFAOYSA-N 1 2 316.832 4.284 20 0 DIADLO CCn1nc(C)c([C@H](C)[NH2+][C@H](c2ccccc2Cl)C(C)C)n1 ZINC000925076986 1045223774 /nfs/dbraw/zinc/22/37/74/1045223774.db2.gz QVRUVRFWDFUFRV-LRDDRELGSA-N 1 2 320.868 4.308 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1cn2c(n1)CCCC2)c1ccc(F)cc1F ZINC000925097034 1045225784 /nfs/dbraw/zinc/22/57/84/1045225784.db2.gz JOTXGMRNSWZDLE-BLLLJJGKSA-N 1 2 319.399 4.300 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CCc3c2cccc3C)c(C)[nH+]1 ZINC000578296799 1045228726 /nfs/dbraw/zinc/22/87/26/1045228726.db2.gz XOJTYRIEUFGVGR-QGZVFWFLSA-N 1 2 309.413 4.124 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1ccns1)c1nc(C(F)(F)F)cs1 ZINC000925196350 1045234261 /nfs/dbraw/zinc/23/42/61/1045234261.db2.gz ZPARSESGNQGMJE-HTQZYQBOSA-N 1 2 321.393 4.420 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ccsc1Br ZINC000527708401 1045251612 /nfs/dbraw/zinc/25/16/12/1045251612.db2.gz GVXMPHHHGGTPKF-ZANVPECISA-N 1 2 324.243 4.122 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C3(C)CCC(F)(F)CC3)cc2[nH+]1 ZINC000527765214 1045258171 /nfs/dbraw/zinc/25/81/71/1045258171.db2.gz QHDZKXQNKJCRKL-UHFFFAOYSA-N 1 2 307.344 4.025 20 0 DIADLO c1oc(-c2ccccc2)nc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000527773211 1045262458 /nfs/dbraw/zinc/26/24/58/1045262458.db2.gz PYKMRJBAPYBTFT-LJQANCHMSA-N 1 2 319.408 4.368 20 0 DIADLO CCn1c[nH+]cc1CNc1cc(C(C)(C)C)cc2cccnc21 ZINC000527798681 1045265533 /nfs/dbraw/zinc/26/55/33/1045265533.db2.gz HBWMUUNZVDSCSZ-UHFFFAOYSA-N 1 2 308.429 4.361 20 0 DIADLO CCS[C@@H]1CCC[C@H]([NH2+][C@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC000578706152 1045267745 /nfs/dbraw/zinc/26/77/45/1045267745.db2.gz NHEFBWMNAMRYKB-XHSDSOJGSA-N 1 2 322.522 4.080 20 0 DIADLO CC(C)c1nnc([C@H](C)[NH2+][C@@H]2CCc3cc(F)c(Cl)cc32)[nH]1 ZINC000527875439 1045275587 /nfs/dbraw/zinc/27/55/87/1045275587.db2.gz DACQAXIQKJBIFM-LKFCYVNXSA-N 1 2 322.815 4.059 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@H]1CC12CC2 ZINC000527879711 1045276835 /nfs/dbraw/zinc/27/68/35/1045276835.db2.gz GUAFGLCAONGJRJ-RHSMWYFYSA-N 1 2 305.425 4.202 20 0 DIADLO CC(C)c1nc(C[NH2+]Cc2ccc(Cl)s2)c2ccccn21 ZINC000579481842 1045317053 /nfs/dbraw/zinc/31/70/53/1045317053.db2.gz CNJBFYQUJAUTAW-UHFFFAOYSA-N 1 2 319.861 4.462 20 0 DIADLO Fc1cccc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)c1Br ZINC000448991331 1045330429 /nfs/dbraw/zinc/33/04/29/1045330429.db2.gz JDYGXXRLILIKAO-AWEZNQCLSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1cccc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c1Br ZINC000448991331 1045330435 /nfs/dbraw/zinc/33/04/35/1045330435.db2.gz JDYGXXRLILIKAO-AWEZNQCLSA-N 1 2 323.209 4.253 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000118001132 1045330986 /nfs/dbraw/zinc/33/09/86/1045330986.db2.gz HAJKPJDQGWSALI-CYBMUJFWSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1occc1C[N@H+](C)[C@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000118001132 1045330989 /nfs/dbraw/zinc/33/09/89/1045330989.db2.gz HAJKPJDQGWSALI-CYBMUJFWSA-N 1 2 311.385 4.139 20 0 DIADLO C[N@H+](Cc1ccco1)Cc1cnc(CCc2ccccc2)s1 ZINC000449009014 1045333553 /nfs/dbraw/zinc/33/35/53/1045333553.db2.gz SVYLEYRBSUHZPQ-UHFFFAOYSA-N 1 2 312.438 4.153 20 0 DIADLO C[N@@H+](Cc1ccco1)Cc1cnc(CCc2ccccc2)s1 ZINC000449009014 1045333561 /nfs/dbraw/zinc/33/35/61/1045333561.db2.gz SVYLEYRBSUHZPQ-UHFFFAOYSA-N 1 2 312.438 4.153 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1ccnn1C1CCCC1 ZINC000449010135 1045334710 /nfs/dbraw/zinc/33/47/10/1045334710.db2.gz KNFLKPQAHYGPQE-UHFFFAOYSA-N 1 2 313.445 4.029 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1ccnn1C1CCCC1 ZINC000449010135 1045334716 /nfs/dbraw/zinc/33/47/16/1045334716.db2.gz KNFLKPQAHYGPQE-UHFFFAOYSA-N 1 2 313.445 4.029 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)Cc1cnc(-c2ccccc2)s1 ZINC000075696727 1045339632 /nfs/dbraw/zinc/33/96/32/1045339632.db2.gz DSEXAQQVISDZJH-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)Cc1cnc(-c2ccccc2)s1 ZINC000075696727 1045339635 /nfs/dbraw/zinc/33/96/35/1045339635.db2.gz DSEXAQQVISDZJH-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2cnc(-c3c(F)cccc3F)s2)C1 ZINC000449041977 1045339575 /nfs/dbraw/zinc/33/95/75/1045339575.db2.gz PSNQVEVXBMXDFJ-OAHLLOKOSA-N 1 2 312.360 4.022 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2cnc(-c3c(F)cccc3F)s2)C1 ZINC000449041977 1045339578 /nfs/dbraw/zinc/33/95/78/1045339578.db2.gz PSNQVEVXBMXDFJ-OAHLLOKOSA-N 1 2 312.360 4.022 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2nc3cc(C)ccc3s2)on1 ZINC000528357389 1045344922 /nfs/dbraw/zinc/34/49/22/1045344922.db2.gz NXVXTRYSLCYRJX-CQSZACIVSA-N 1 2 313.426 4.238 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2nc3cc(C)ccc3s2)on1 ZINC000528357389 1045344930 /nfs/dbraw/zinc/34/49/30/1045344930.db2.gz NXVXTRYSLCYRJX-CQSZACIVSA-N 1 2 313.426 4.238 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2ncccc2Cl)c1 ZINC000528430876 1045354807 /nfs/dbraw/zinc/35/48/07/1045354807.db2.gz XJIQHFRLKXXAJE-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](C)Cc2ncccc2Cl)c1 ZINC000528430876 1045354799 /nfs/dbraw/zinc/35/47/99/1045354799.db2.gz XJIQHFRLKXXAJE-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ncccc3Cl)CCCC2)n1 ZINC000528425877 1045356662 /nfs/dbraw/zinc/35/66/62/1045356662.db2.gz YHJSUTMJRFAOOB-UHFFFAOYSA-N 1 2 307.850 4.059 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1ncccc1Cl)CCC2 ZINC000528427154 1045356673 /nfs/dbraw/zinc/35/66/73/1045356673.db2.gz VFSXBAGSIPHGES-AWEZNQCLSA-N 1 2 321.877 4.263 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ncccc1Cl)CCC2 ZINC000528427154 1045356680 /nfs/dbraw/zinc/35/66/80/1045356680.db2.gz VFSXBAGSIPHGES-AWEZNQCLSA-N 1 2 321.877 4.263 20 0 DIADLO Fc1cccc(F)c1C[NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21 ZINC000449191439 1045358312 /nfs/dbraw/zinc/35/83/12/1045358312.db2.gz SJDLVFLWSDADBP-CYBMUJFWSA-N 1 2 313.269 4.159 20 0 DIADLO C[C@H]1C[N@H+](CCOC2CCCCCC2)C[C@H](c2ccsc2)O1 ZINC000470196408 1045379071 /nfs/dbraw/zinc/37/90/71/1045379071.db2.gz UWRATSFWGQTFKS-MAUKXSAKSA-N 1 2 323.502 4.249 20 0 DIADLO C[C@H]1C[N@@H+](CCOC2CCCCCC2)C[C@H](c2ccsc2)O1 ZINC000470196408 1045379074 /nfs/dbraw/zinc/37/90/74/1045379074.db2.gz UWRATSFWGQTFKS-MAUKXSAKSA-N 1 2 323.502 4.249 20 0 DIADLO CCCc1csc(C[NH2+]Cc2cc(C3CC3)ccc2F)n1 ZINC000449371967 1045383639 /nfs/dbraw/zinc/38/36/39/1045383639.db2.gz AMKGGKKVKLBOJZ-UHFFFAOYSA-N 1 2 304.434 4.402 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+]1CCc2nc(C(C)(C)C)ncc2C1 ZINC000528590398 1045385210 /nfs/dbraw/zinc/38/52/10/1045385210.db2.gz CVQAQLVBAPKADK-ZDUSSCGKSA-N 1 2 313.420 4.033 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+]1CCc2nc(C(C)(C)C)ncc2C1 ZINC000528590398 1045385212 /nfs/dbraw/zinc/38/52/12/1045385212.db2.gz CVQAQLVBAPKADK-ZDUSSCGKSA-N 1 2 313.420 4.033 20 0 DIADLO Cc1oc2ccccc2c1C[N@@H+]1CC(C)(C)[C@H]1c1nccn1C ZINC000449413449 1045388433 /nfs/dbraw/zinc/38/84/33/1045388433.db2.gz IXUSPXPROBRBSQ-QGZVFWFLSA-N 1 2 309.413 4.058 20 0 DIADLO Cc1oc2ccccc2c1C[N@H+]1CC(C)(C)[C@H]1c1nccn1C ZINC000449413449 1045388437 /nfs/dbraw/zinc/38/84/37/1045388437.db2.gz IXUSPXPROBRBSQ-QGZVFWFLSA-N 1 2 309.413 4.058 20 0 DIADLO CCc1nc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)C)cs1 ZINC000150880677 1045401475 /nfs/dbraw/zinc/40/14/75/1045401475.db2.gz FELBDYQJARLRFH-INIZCTEOSA-N 1 2 310.413 4.471 20 0 DIADLO CCc1nc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)C)cs1 ZINC000150880643 1045401640 /nfs/dbraw/zinc/40/16/40/1045401640.db2.gz FELBDYQJARLRFH-MRXNPFEDSA-N 1 2 310.413 4.471 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2csc(Cl)c2Cl)CC1(C)C ZINC000449504373 1045404771 /nfs/dbraw/zinc/40/47/71/1045404771.db2.gz VXHRAWJOPSVWDO-JTQLQIEISA-N 1 2 308.274 4.302 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2csc(Cl)c2Cl)CC1(C)C ZINC000449504373 1045404773 /nfs/dbraw/zinc/40/47/73/1045404773.db2.gz VXHRAWJOPSVWDO-JTQLQIEISA-N 1 2 308.274 4.302 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@@H+]1CCc2nc(C3CC3)ncc2C1 ZINC000528734260 1045405814 /nfs/dbraw/zinc/40/58/14/1045405814.db2.gz PGAHUVSXRREKAH-GOSISDBHSA-N 1 2 311.404 4.003 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@H+]1CCc2nc(C3CC3)ncc2C1 ZINC000528734260 1045405816 /nfs/dbraw/zinc/40/58/16/1045405816.db2.gz PGAHUVSXRREKAH-GOSISDBHSA-N 1 2 311.404 4.003 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1coc(-c2cccc(F)c2)n1 ZINC000528766008 1045411263 /nfs/dbraw/zinc/41/12/63/1045411263.db2.gz HZYYHPHSWMUMMH-NSHDSACASA-N 1 2 310.319 4.100 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1coc(-c2cccc(F)c2)n1 ZINC000528766008 1045411267 /nfs/dbraw/zinc/41/12/67/1045411267.db2.gz HZYYHPHSWMUMMH-NSHDSACASA-N 1 2 310.319 4.100 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+]1CCC(F)(F)C[C@@H]1C ZINC000528767965 1045411298 /nfs/dbraw/zinc/41/12/98/1045411298.db2.gz MPBIJBHFZJCYTJ-JTQLQIEISA-N 1 2 312.385 4.331 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+]1CCC(F)(F)C[C@@H]1C ZINC000528767965 1045411300 /nfs/dbraw/zinc/41/13/00/1045411300.db2.gz MPBIJBHFZJCYTJ-JTQLQIEISA-N 1 2 312.385 4.331 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2nc(CC(C)C)no2)C(C)C)c1 ZINC000528766614 1045411416 /nfs/dbraw/zinc/41/14/16/1045411416.db2.gz NQHGSKLTXBZPRV-GOSISDBHSA-N 1 2 301.434 4.063 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1ncc(-c2cccc(F)c2)o1 ZINC000528771598 1045412281 /nfs/dbraw/zinc/41/22/81/1045412281.db2.gz YFSVGVLIOPUZNV-NSHDSACASA-N 1 2 310.319 4.100 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1ncc(-c2cccc(F)c2)o1 ZINC000528771598 1045412283 /nfs/dbraw/zinc/41/22/83/1045412283.db2.gz YFSVGVLIOPUZNV-NSHDSACASA-N 1 2 310.319 4.100 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+]3CCC(F)(F)C[C@@H]3C)o2)cc1 ZINC000528771004 1045412650 /nfs/dbraw/zinc/41/26/50/1045412650.db2.gz WISPGUQOEZDJTL-ZDUSSCGKSA-N 1 2 306.356 4.270 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+]3CCC(F)(F)C[C@@H]3C)o2)cc1 ZINC000528771004 1045412654 /nfs/dbraw/zinc/41/26/54/1045412654.db2.gz WISPGUQOEZDJTL-ZDUSSCGKSA-N 1 2 306.356 4.270 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)[C@@H](C)c2ccccc2)n1 ZINC000119292475 1045414101 /nfs/dbraw/zinc/41/41/01/1045414101.db2.gz KTIVNTIHPKAKJY-STQMWFEESA-N 1 2 305.447 4.077 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)[C@@H](C)c2ccccc2)n1 ZINC000119292475 1045414103 /nfs/dbraw/zinc/41/41/03/1045414103.db2.gz KTIVNTIHPKAKJY-STQMWFEESA-N 1 2 305.447 4.077 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)o2)c2nccn21 ZINC000449575412 1045415833 /nfs/dbraw/zinc/41/58/33/1045415833.db2.gz XUYKUADSUGVMNV-MLGOLLRUSA-N 1 2 311.360 4.078 20 0 DIADLO CCCc1ncc(C[NH2+]Cc2ccc(-c3ccccc3F)o2)o1 ZINC000449615745 1045419319 /nfs/dbraw/zinc/41/93/19/1045419319.db2.gz ZUDISYTUAGLXJH-UHFFFAOYSA-N 1 2 314.360 4.316 20 0 DIADLO COc1ccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)c(OC)c1 ZINC000449630985 1045421849 /nfs/dbraw/zinc/42/18/49/1045421849.db2.gz JPGCCOFTZPEINL-GOSISDBHSA-N 1 2 313.397 4.024 20 0 DIADLO COc1ccc(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)c(OC)c1 ZINC000449630985 1045421850 /nfs/dbraw/zinc/42/18/50/1045421850.db2.gz JPGCCOFTZPEINL-GOSISDBHSA-N 1 2 313.397 4.024 20 0 DIADLO COc1c(O)cccc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC000449729677 1045430211 /nfs/dbraw/zinc/43/02/11/1045430211.db2.gz BJLBXDFJTZGQPD-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO COc1c(O)cccc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC000449729677 1045430213 /nfs/dbraw/zinc/43/02/13/1045430213.db2.gz BJLBXDFJTZGQPD-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO CC(=O)c1ccc(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)cc1 ZINC000450267907 1045482027 /nfs/dbraw/zinc/48/20/27/1045482027.db2.gz BZXOLPRLYOBSCO-GFCCVEGCSA-N 1 2 303.352 4.360 20 0 DIADLO CC(=O)c1ccc(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)cc1 ZINC000450267907 1045482031 /nfs/dbraw/zinc/48/20/31/1045482031.db2.gz BZXOLPRLYOBSCO-GFCCVEGCSA-N 1 2 303.352 4.360 20 0 DIADLO CC[N@H+](Cc1cn(CC2CC2)nn1)[C@@H](C)c1cc2ccccc2o1 ZINC000450289388 1045483102 /nfs/dbraw/zinc/48/31/02/1045483102.db2.gz VBBKVYOHOJKHSV-AWEZNQCLSA-N 1 2 324.428 4.017 20 0 DIADLO CC[N@@H+](Cc1cn(CC2CC2)nn1)[C@@H](C)c1cc2ccccc2o1 ZINC000450289388 1045483105 /nfs/dbraw/zinc/48/31/05/1045483105.db2.gz VBBKVYOHOJKHSV-AWEZNQCLSA-N 1 2 324.428 4.017 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nnc(C3CC3)s2)cc1C ZINC000450283633 1045483842 /nfs/dbraw/zinc/48/38/42/1045483842.db2.gz DPDUPRAQWPVMMW-INIZCTEOSA-N 1 2 313.470 4.369 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nnc(C3CC3)s2)cc1C ZINC000450283633 1045483845 /nfs/dbraw/zinc/48/38/45/1045483845.db2.gz DPDUPRAQWPVMMW-INIZCTEOSA-N 1 2 313.470 4.369 20 0 DIADLO C[N@H+](CCc1cscn1)Cc1c(Cl)cccc1Cl ZINC000450298307 1045483853 /nfs/dbraw/zinc/48/38/53/1045483853.db2.gz AQJNJRAOMHNURS-UHFFFAOYSA-N 1 2 301.242 4.124 20 0 DIADLO C[N@@H+](CCc1cscn1)Cc1c(Cl)cccc1Cl ZINC000450298307 1045483855 /nfs/dbraw/zinc/48/38/55/1045483855.db2.gz AQJNJRAOMHNURS-UHFFFAOYSA-N 1 2 301.242 4.124 20 0 DIADLO Cc1cnc(CC[N@@H+](C)Cc2c(F)ccc(F)c2Cl)s1 ZINC000529532678 1045489504 /nfs/dbraw/zinc/48/95/04/1045489504.db2.gz UOSMHKZIWGDJAU-UHFFFAOYSA-N 1 2 316.804 4.058 20 0 DIADLO Cc1cnc(CC[N@H+](C)Cc2c(F)ccc(F)c2Cl)s1 ZINC000529532678 1045489507 /nfs/dbraw/zinc/48/95/07/1045489507.db2.gz UOSMHKZIWGDJAU-UHFFFAOYSA-N 1 2 316.804 4.058 20 0 DIADLO Clc1ccccc1C[N@H+](Cc1cnns1)C1CCCC1 ZINC000450354171 1045495996 /nfs/dbraw/zinc/49/59/96/1045495996.db2.gz JSUBSPIHRBODBR-UHFFFAOYSA-N 1 2 307.850 4.136 20 0 DIADLO Clc1ccccc1C[N@@H+](Cc1cnns1)C1CCCC1 ZINC000450354171 1045495999 /nfs/dbraw/zinc/49/59/99/1045495999.db2.gz JSUBSPIHRBODBR-UHFFFAOYSA-N 1 2 307.850 4.136 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2Cl)C[N@@H+]1CC1CC(F)(F)C1 ZINC000450387951 1045499566 /nfs/dbraw/zinc/49/95/66/1045499566.db2.gz HDLKJBPJBWFEPS-IAQYHMDHSA-N 1 2 315.791 4.147 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2Cl)C[N@H+]1CC1CC(F)(F)C1 ZINC000450387951 1045499569 /nfs/dbraw/zinc/49/95/69/1045499569.db2.gz HDLKJBPJBWFEPS-IAQYHMDHSA-N 1 2 315.791 4.147 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nnc(C(C)C)s2)s1 ZINC000450402715 1045500398 /nfs/dbraw/zinc/50/03/98/1045500398.db2.gz CFIOEQFPFQRYAS-LBPRGKRZSA-N 1 2 307.488 4.369 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nnc(C(C)C)s2)s1 ZINC000450402715 1045500403 /nfs/dbraw/zinc/50/04/03/1045500403.db2.gz CFIOEQFPFQRYAS-LBPRGKRZSA-N 1 2 307.488 4.369 20 0 DIADLO c1cc(C[N@H+](Cc2nnc(C3CC3)s2)C2CCCCC2)co1 ZINC000450440285 1045505530 /nfs/dbraw/zinc/50/55/30/1045505530.db2.gz YOFYEEZFKIEEAT-UHFFFAOYSA-N 1 2 317.458 4.343 20 0 DIADLO c1cc(C[N@@H+](Cc2nnc(C3CC3)s2)C2CCCCC2)co1 ZINC000450440285 1045505533 /nfs/dbraw/zinc/50/55/33/1045505533.db2.gz YOFYEEZFKIEEAT-UHFFFAOYSA-N 1 2 317.458 4.343 20 0 DIADLO O=C(Nc1cccc(C2CCCCC2)c1)[C@H]1CCn2cc[nH+]c2C1 ZINC000529651614 1045507330 /nfs/dbraw/zinc/50/73/30/1045507330.db2.gz XYDJPDWUFBOAAO-KRWDZBQOSA-N 1 2 323.440 4.132 20 0 DIADLO C[N@H+](Cc1cnn(-c2ccccc2)c1)Cc1ccccc1Cl ZINC000302835947 1045509138 /nfs/dbraw/zinc/50/91/38/1045509138.db2.gz CPGVSCAMTGPPHZ-UHFFFAOYSA-N 1 2 311.816 4.158 20 0 DIADLO C[N@@H+](Cc1cnn(-c2ccccc2)c1)Cc1ccccc1Cl ZINC000302835947 1045509143 /nfs/dbraw/zinc/50/91/43/1045509143.db2.gz CPGVSCAMTGPPHZ-UHFFFAOYSA-N 1 2 311.816 4.158 20 0 DIADLO Cc1c[nH]c(C[N@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)n1 ZINC000628129590 1045526738 /nfs/dbraw/zinc/52/67/38/1045526738.db2.gz KHKVWTXEBMTZTI-KRWDZBQOSA-N 1 2 305.425 4.482 20 0 DIADLO Cc1c[nH]c(C[N@@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)n1 ZINC000628129590 1045526746 /nfs/dbraw/zinc/52/67/46/1045526746.db2.gz KHKVWTXEBMTZTI-KRWDZBQOSA-N 1 2 305.425 4.482 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2cnc(-c3ccccc3)s2)C[C@H]1F ZINC001138527681 1045527947 /nfs/dbraw/zinc/52/79/47/1045527947.db2.gz RZBQRLGJUGEMME-GDBMZVCRSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2cnc(-c3ccccc3)s2)C[C@H]1F ZINC001138527681 1045527956 /nfs/dbraw/zinc/52/79/56/1045527956.db2.gz RZBQRLGJUGEMME-GDBMZVCRSA-N 1 2 308.397 4.082 20 0 DIADLO Cc1[nH]c(CN2Cc3ccccc3-c3ccccc3C2)[nH+]c1C ZINC000628162597 1045533121 /nfs/dbraw/zinc/53/31/21/1045533121.db2.gz WTQQGJWGVXMHLO-UHFFFAOYSA-N 1 2 303.409 4.209 20 0 DIADLO Cc1ncc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3n2C(C)C)o1 ZINC000628174023 1045534762 /nfs/dbraw/zinc/53/47/62/1045534762.db2.gz UKKVLUMKVVQYIZ-GOSISDBHSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1ncc(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3n2C(C)C)o1 ZINC000628174023 1045534769 /nfs/dbraw/zinc/53/47/69/1045534769.db2.gz UKKVLUMKVVQYIZ-GOSISDBHSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2Cc3ccccc3C[C@H]2c2ccccc2)n1 ZINC000628183036 1045536527 /nfs/dbraw/zinc/53/65/27/1045536527.db2.gz OMVRLKDFXGDBAQ-IBGZPJMESA-N 1 2 303.409 4.018 20 0 DIADLO Cc1c[nH]c(C[N@H+]2Cc3ccccc3C[C@H]2c2ccccc2)n1 ZINC000628183036 1045536538 /nfs/dbraw/zinc/53/65/38/1045536538.db2.gz OMVRLKDFXGDBAQ-IBGZPJMESA-N 1 2 303.409 4.018 20 0 DIADLO Cc1[nH]c(CN(Cc2cc(F)ccc2F)C2CCCC2)[nH+]c1C ZINC000628187825 1045538854 /nfs/dbraw/zinc/53/88/54/1045538854.db2.gz BIUXZGPUHYYPRF-UHFFFAOYSA-N 1 2 319.399 4.250 20 0 DIADLO CC(C)CCOc1ccc([C@H](C)[NH2+][C@H](C)c2csnn2)cc1 ZINC000450667710 1045540928 /nfs/dbraw/zinc/54/09/28/1045540928.db2.gz MCXPAKBRZQZILI-UONOGXRCSA-N 1 2 319.474 4.375 20 0 DIADLO CCC[C@H]([NH2+]Cc1noc(-c2cncc(C)c2)n1)c1ccccc1 ZINC000450665588 1045541597 /nfs/dbraw/zinc/54/15/97/1045541597.db2.gz WPYJBSVGOBFFKS-KRWDZBQOSA-N 1 2 322.412 4.071 20 0 DIADLO COc1ccnc(C[NH2+][C@@H](CC(C)C)c2ccc(Cl)cc2)n1 ZINC000450686926 1045545529 /nfs/dbraw/zinc/54/55/29/1045545529.db2.gz YSRGZVOLGIFDAM-HNNXBMFYSA-N 1 2 319.836 4.016 20 0 DIADLO CC(C)c1nnc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)s1 ZINC000450688162 1045548074 /nfs/dbraw/zinc/54/80/74/1045548074.db2.gz XYMSYLJVHWCGLI-UHFFFAOYSA-N 1 2 307.850 4.094 20 0 DIADLO Cc1cc(N2CCO[C@@H](c3ccccc3)CC2)nc(C2CCC2)[nH+]1 ZINC001120912361 1045548650 /nfs/dbraw/zinc/54/86/50/1045548650.db2.gz NTCXRJFGNHKVCZ-GOSISDBHSA-N 1 2 323.440 4.021 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccc(Cl)s1 ZINC000450729879 1045553826 /nfs/dbraw/zinc/55/38/26/1045553826.db2.gz UOPUZPNGRBTUEW-VIFPVBQESA-N 1 2 313.879 4.371 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H](C)c1c(Cl)cccc1Cl ZINC001121231437 1045555222 /nfs/dbraw/zinc/55/52/22/1045555222.db2.gz NIPJUYONKPUHLB-NSHDSACASA-N 1 2 323.223 4.169 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CCC(c2c[nH+]cn2C)CC1 ZINC001121215827 1045555837 /nfs/dbraw/zinc/55/58/37/1045555837.db2.gz BQRWXUAHGKFECT-IBGZPJMESA-N 1 2 319.493 4.123 20 0 DIADLO C[C@@H](c1csnn1)[NH+]1CCC(c2ccc(Cl)cc2)CC1 ZINC000450778502 1045567411 /nfs/dbraw/zinc/56/74/11/1045567411.db2.gz ZGBLHMSKEFYAFB-NSHDSACASA-N 1 2 307.850 4.132 20 0 DIADLO CC1(C)C[C@H]([NH2+]Cc2cnc(C3CC3)o2)c2cc(F)ccc2O1 ZINC000628324903 1045569039 /nfs/dbraw/zinc/56/90/39/1045569039.db2.gz PCGCCFUJNQHEGG-HNNXBMFYSA-N 1 2 316.376 4.083 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C)s1)c1ccc(Cl)cc1Cl ZINC000391936422 1045624434 /nfs/dbraw/zinc/62/44/34/1045624434.db2.gz PJOJGWGKRUPIIX-GFCCVEGCSA-N 1 2 316.257 4.394 20 0 DIADLO C[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1ccc(F)cc1F ZINC000190678917 1045597689 /nfs/dbraw/zinc/59/76/89/1045597689.db2.gz NRCZMDUYGKBCNT-MRVPVSSYSA-N 1 2 315.722 4.314 20 0 DIADLO FC(F)(F)CC[N@@H+]1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000451019737 1045605036 /nfs/dbraw/zinc/60/50/36/1045605036.db2.gz SUVRHRUAEFGGPN-GFCCVEGCSA-N 1 2 317.742 4.306 20 0 DIADLO FC(F)(F)CC[N@H+]1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000451019737 1045605040 /nfs/dbraw/zinc/60/50/40/1045605040.db2.gz SUVRHRUAEFGGPN-GFCCVEGCSA-N 1 2 317.742 4.306 20 0 DIADLO FC(F)(F)CC[N@@H+]1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000451019738 1045605469 /nfs/dbraw/zinc/60/54/69/1045605469.db2.gz SUVRHRUAEFGGPN-LBPRGKRZSA-N 1 2 317.742 4.306 20 0 DIADLO FC(F)(F)CC[N@H+]1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000451019738 1045605472 /nfs/dbraw/zinc/60/54/72/1045605472.db2.gz SUVRHRUAEFGGPN-LBPRGKRZSA-N 1 2 317.742 4.306 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2occc2Br)ccc1F ZINC000751504973 1045609179 /nfs/dbraw/zinc/60/91/79/1045609179.db2.gz MKGBDLMNBMOVBS-SNVBAGLBSA-N 1 2 312.182 4.340 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@H](CCc2ccccc2)C(F)F)s1 ZINC000779345865 1045615635 /nfs/dbraw/zinc/61/56/35/1045615635.db2.gz FSSRVXLSDUNTFX-CQSZACIVSA-N 1 2 310.413 4.116 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1nnc(C3CC3)s1)C(C)(C)C2 ZINC000451075771 1045620934 /nfs/dbraw/zinc/62/09/34/1045620934.db2.gz YFGZXWFAZACRHR-UHFFFAOYSA-N 1 2 313.470 4.061 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1nnc(C3CC3)s1)C(C)(C)C2 ZINC000451075771 1045620940 /nfs/dbraw/zinc/62/09/40/1045620940.db2.gz YFGZXWFAZACRHR-UHFFFAOYSA-N 1 2 313.470 4.061 20 0 DIADLO CCc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1nnc(C)s1 ZINC000391844449 1045621839 /nfs/dbraw/zinc/62/18/39/1045621839.db2.gz GPTBJGVSRRZKHN-SNVBAGLBSA-N 1 2 301.415 4.006 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1cccc(CO)c1 ZINC000121544280 1045622407 /nfs/dbraw/zinc/62/24/07/1045622407.db2.gz LPTSERZBNIJJAX-KDOFPFPSSA-N 1 2 324.449 4.076 20 0 DIADLO Cc1cc(F)cc([C@@]2(F)CC[N@H+](C[C@@H]3CC3(Cl)Cl)C2)c1 ZINC000800473876 1045623008 /nfs/dbraw/zinc/62/30/08/1045623008.db2.gz COVZOEASRCFITM-GXTWGEPZSA-N 1 2 320.210 4.198 20 0 DIADLO Cc1cc(F)cc([C@@]2(F)CC[N@@H+](C[C@@H]3CC3(Cl)Cl)C2)c1 ZINC000800473876 1045623013 /nfs/dbraw/zinc/62/30/13/1045623013.db2.gz COVZOEASRCFITM-GXTWGEPZSA-N 1 2 320.210 4.198 20 0 DIADLO Cc1cc(F)cc([C@]2(F)CC[N@H+](C[C@@H]3CC3(Cl)Cl)C2)c1 ZINC000800473877 1045624109 /nfs/dbraw/zinc/62/41/09/1045624109.db2.gz COVZOEASRCFITM-JSGCOSHPSA-N 1 2 320.210 4.198 20 0 DIADLO Cc1cc(F)cc([C@]2(F)CC[N@@H+](C[C@@H]3CC3(Cl)Cl)C2)c1 ZINC000800473877 1045624116 /nfs/dbraw/zinc/62/41/16/1045624116.db2.gz COVZOEASRCFITM-JSGCOSHPSA-N 1 2 320.210 4.198 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[N@@H+]3CCC[C@@](C)(F)C3)o2)cc1C ZINC000451117845 1045625713 /nfs/dbraw/zinc/62/57/13/1045625713.db2.gz WLMFGSLKXQTAPR-RDTXWAMCSA-N 1 2 317.408 4.238 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[N@H+]3CCC[C@@](C)(F)C3)o2)cc1C ZINC000451117845 1045625719 /nfs/dbraw/zinc/62/57/19/1045625719.db2.gz WLMFGSLKXQTAPR-RDTXWAMCSA-N 1 2 317.408 4.238 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[N@@H+]3CCC[C@@](C)(F)C3)o2)cc1C ZINC000451117842 1045626647 /nfs/dbraw/zinc/62/66/47/1045626647.db2.gz WLMFGSLKXQTAPR-KBXCAEBGSA-N 1 2 317.408 4.238 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[N@H+]3CCC[C@@](C)(F)C3)o2)cc1C ZINC000451117842 1045626649 /nfs/dbraw/zinc/62/66/49/1045626649.db2.gz WLMFGSLKXQTAPR-KBXCAEBGSA-N 1 2 317.408 4.238 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[N@@H+]3CCC[C@](C)(F)C3)o2)cc1C ZINC000451117843 1045626789 /nfs/dbraw/zinc/62/67/89/1045626789.db2.gz WLMFGSLKXQTAPR-KDOFPFPSSA-N 1 2 317.408 4.238 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[N@H+]3CCC[C@](C)(F)C3)o2)cc1C ZINC000451117843 1045626795 /nfs/dbraw/zinc/62/67/95/1045626795.db2.gz WLMFGSLKXQTAPR-KDOFPFPSSA-N 1 2 317.408 4.238 20 0 DIADLO S=c1ncccn1C[N@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000751959596 1045645306 /nfs/dbraw/zinc/64/53/06/1045645306.db2.gz NOQVQQHNPHOVBE-UHFFFAOYSA-N 1 2 317.845 4.013 20 0 DIADLO S=c1ncccn1C[N@@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000751959596 1045645317 /nfs/dbraw/zinc/64/53/17/1045645317.db2.gz NOQVQQHNPHOVBE-UHFFFAOYSA-N 1 2 317.845 4.013 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2ccoc2)c2ccccc2OC)cc1 ZINC000752106317 1045660504 /nfs/dbraw/zinc/66/05/04/1045660504.db2.gz UMHFYJMUODUVBO-HXUWFJFHSA-N 1 2 323.392 4.176 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccccc2)c2cccnc2)sc1C ZINC000779400940 1045662847 /nfs/dbraw/zinc/66/28/47/1045662847.db2.gz VOPSQEFYKVYITJ-SFHVURJKSA-N 1 2 309.438 4.034 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccccc2)c2cccnc2)sc1C ZINC000779400930 1045662877 /nfs/dbraw/zinc/66/28/77/1045662877.db2.gz VOPSQEFYKVYITJ-GOSISDBHSA-N 1 2 309.438 4.034 20 0 DIADLO CCOc1cc(CNc2ccc([NH2+]C)cc2)cc(Cl)c1OC ZINC000629389733 1045665471 /nfs/dbraw/zinc/66/54/71/1045665471.db2.gz TYOXAEBJJIOABR-UHFFFAOYSA-N 1 2 320.820 4.401 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C(C)(C)C(C)(F)F ZINC000451358203 1045668790 /nfs/dbraw/zinc/66/87/90/1045668790.db2.gz IBBQMBFYCMTTKK-UHFFFAOYSA-N 1 2 307.344 4.005 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCC[C@@H]3CCCF)cc2)CCO1 ZINC000800982191 1045675762 /nfs/dbraw/zinc/67/57/62/1045675762.db2.gz OVRASGJLTUASIQ-GPMSIDNRSA-N 1 2 320.452 4.242 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCn2ccnc21)c1cccc(Cl)c1Cl ZINC000655726733 1045675925 /nfs/dbraw/zinc/67/59/25/1045675925.db2.gz PCUJDQXEUSTKDT-GWCFXTLKSA-N 1 2 310.228 4.376 20 0 DIADLO Cc1cc([NH2+][C@H]2CCC[C@H]2CCCF)ccc1N1CCOCC1 ZINC000800982230 1045676237 /nfs/dbraw/zinc/67/62/37/1045676237.db2.gz FFCXUAPGZJCDEQ-WMZOPIPTSA-N 1 2 320.452 4.162 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1nc(C2CC2)cs1 ZINC000451412166 1045678962 /nfs/dbraw/zinc/67/89/62/1045678962.db2.gz WKNBLJPXMQUWCO-MWLCHTKSSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1nc(C2CC2)cs1 ZINC000451412166 1045678969 /nfs/dbraw/zinc/67/89/69/1045678969.db2.gz WKNBLJPXMQUWCO-MWLCHTKSSA-N 1 2 304.381 4.183 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2c(O)ccc(Cl)c2F)n1 ZINC000191369722 1045686104 /nfs/dbraw/zinc/68/61/04/1045686104.db2.gz VJVWJNGQYPVALL-HNNXBMFYSA-N 1 2 320.795 4.225 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2c(O)ccc(Cl)c2F)n1 ZINC000191369722 1045686115 /nfs/dbraw/zinc/68/61/15/1045686115.db2.gz VJVWJNGQYPVALL-HNNXBMFYSA-N 1 2 320.795 4.225 20 0 DIADLO C[N@@H+]1CCC(=O)C[C@@H]1c1ccc(-c2cc(F)c(F)c(F)c2)cc1 ZINC000629710784 1045700002 /nfs/dbraw/zinc/70/00/02/1045700002.db2.gz KZBIKNGNCCXRKF-QGZVFWFLSA-N 1 2 319.326 4.107 20 0 DIADLO C[N@H+]1CCC(=O)C[C@@H]1c1ccc(-c2cc(F)c(F)c(F)c2)cc1 ZINC000629710784 1045700018 /nfs/dbraw/zinc/70/00/18/1045700018.db2.gz KZBIKNGNCCXRKF-QGZVFWFLSA-N 1 2 319.326 4.107 20 0 DIADLO NC(Cc1ccccc1Cl)=[NH+]OCCCCC(F)(F)F ZINC000752767672 1045703388 /nfs/dbraw/zinc/70/33/88/1045703388.db2.gz CIBLPUQDJZTCJO-UHFFFAOYSA-N 1 2 308.731 4.114 20 0 DIADLO C[N@@H+]1CCC(=O)C[C@@H]1c1ccc(-c2cncc(C(F)F)c2)cc1 ZINC000629745718 1045707849 /nfs/dbraw/zinc/70/78/49/1045707849.db2.gz BSQDRTQNFPXHRD-QGZVFWFLSA-N 1 2 316.351 4.022 20 0 DIADLO C[N@H+]1CCC(=O)C[C@@H]1c1ccc(-c2cncc(C(F)F)c2)cc1 ZINC000629745718 1045707858 /nfs/dbraw/zinc/70/78/58/1045707858.db2.gz BSQDRTQNFPXHRD-QGZVFWFLSA-N 1 2 316.351 4.022 20 0 DIADLO c1sc(C2CCCC2)nc1C[N@@H+]1CCSC[C@@H]1C1CC1 ZINC000451649725 1045708242 /nfs/dbraw/zinc/70/82/42/1045708242.db2.gz SJIKHOCTXDONHU-OAHLLOKOSA-N 1 2 308.516 4.128 20 0 DIADLO c1sc(C2CCCC2)nc1C[N@H+]1CCSC[C@@H]1C1CC1 ZINC000451649725 1045708249 /nfs/dbraw/zinc/70/82/49/1045708249.db2.gz SJIKHOCTXDONHU-OAHLLOKOSA-N 1 2 308.516 4.128 20 0 DIADLO COc1cc(C)ccc1-c1ccc([C@H]2CC(=O)CC[N@@H+]2C)cc1 ZINC000629754316 1045709570 /nfs/dbraw/zinc/70/95/70/1045709570.db2.gz NDGSNYXLEWBPEB-LJQANCHMSA-N 1 2 309.409 4.006 20 0 DIADLO COc1cc(C)ccc1-c1ccc([C@H]2CC(=O)CC[N@H+]2C)cc1 ZINC000629754316 1045709581 /nfs/dbraw/zinc/70/95/81/1045709581.db2.gz NDGSNYXLEWBPEB-LJQANCHMSA-N 1 2 309.409 4.006 20 0 DIADLO Fc1ccc(-c2cnc(C[N@@H+]3CC[C@@H]3c3ccccc3)o2)cc1 ZINC000530663406 1045709563 /nfs/dbraw/zinc/70/95/63/1045709563.db2.gz FWOZYFXRHQDWQR-QGZVFWFLSA-N 1 2 308.356 4.428 20 0 DIADLO Fc1ccc(-c2cnc(C[N@H+]3CC[C@@H]3c3ccccc3)o2)cc1 ZINC000530663406 1045709573 /nfs/dbraw/zinc/70/95/73/1045709573.db2.gz FWOZYFXRHQDWQR-QGZVFWFLSA-N 1 2 308.356 4.428 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000191493146 1045714793 /nfs/dbraw/zinc/71/47/93/1045714793.db2.gz IZXJGTHESDNNLP-IAQYHMDHSA-N 1 2 320.795 4.163 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000191493146 1045714807 /nfs/dbraw/zinc/71/48/07/1045714807.db2.gz IZXJGTHESDNNLP-IAQYHMDHSA-N 1 2 320.795 4.163 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)s1 ZINC000530723815 1045720788 /nfs/dbraw/zinc/72/07/88/1045720788.db2.gz GCDBRGGGSJIFOV-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@H]2c2ccccn2)s1 ZINC000530723815 1045720799 /nfs/dbraw/zinc/72/07/99/1045720799.db2.gz GCDBRGGGSJIFOV-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1ncc(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)s1 ZINC000193478168 1045722622 /nfs/dbraw/zinc/72/26/22/1045722622.db2.gz VTBAEFREHIXCLS-SNVBAGLBSA-N 1 2 303.456 4.254 20 0 DIADLO Cc1ncc(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)s1 ZINC000193478168 1045722631 /nfs/dbraw/zinc/72/26/31/1045722631.db2.gz VTBAEFREHIXCLS-SNVBAGLBSA-N 1 2 303.456 4.254 20 0 DIADLO CCc1nc(C)c(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3[nH]2)o1 ZINC000451877814 1045739228 /nfs/dbraw/zinc/73/92/28/1045739228.db2.gz KNNDLYOFAJBDKO-INIZCTEOSA-N 1 2 324.428 4.149 20 0 DIADLO CCc1nc(C)c(C[N@H+]2CCCC[C@H]2c2nc3ccccc3[nH]2)o1 ZINC000451877814 1045739238 /nfs/dbraw/zinc/73/92/38/1045739238.db2.gz KNNDLYOFAJBDKO-INIZCTEOSA-N 1 2 324.428 4.149 20 0 DIADLO CCCC[C@@H](CCC)NC(=O)c1ccc(Cn2cc[nH+]c2)cc1 ZINC000530898246 1045747316 /nfs/dbraw/zinc/74/73/16/1045747316.db2.gz XIEXKUMSMVPSGP-GOSISDBHSA-N 1 2 313.445 4.020 20 0 DIADLO Cc1ccc(-c2noc(C[N@H+]3C[C@H](C)[C@H]3c3ccccc3)n2)cc1 ZINC000530902655 1045749067 /nfs/dbraw/zinc/74/90/67/1045749067.db2.gz PQTVLNHVKDZMFR-KXBFYZLASA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccc(-c2noc(C[N@@H+]3C[C@H](C)[C@H]3c3ccccc3)n2)cc1 ZINC000530902655 1045749075 /nfs/dbraw/zinc/74/90/75/1045749075.db2.gz PQTVLNHVKDZMFR-KXBFYZLASA-N 1 2 319.408 4.238 20 0 DIADLO FC(F)(F)[C@H]1CCC[C@H](c2csc(Cn3cc[nH+]c3)n2)C1 ZINC000630386616 1045758591 /nfs/dbraw/zinc/75/85/91/1045758591.db2.gz SGCUUOMXSJPOKP-QWRGUYRKSA-N 1 2 315.364 4.224 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@@H]2c2ccccn2)cs1 ZINC000530963476 1045760809 /nfs/dbraw/zinc/76/08/09/1045760809.db2.gz ULEAUICODJVXGQ-MRXNPFEDSA-N 1 2 301.459 4.218 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@@H]2c2ccccn2)cs1 ZINC000530963476 1045760820 /nfs/dbraw/zinc/76/08/20/1045760820.db2.gz ULEAUICODJVXGQ-MRXNPFEDSA-N 1 2 301.459 4.218 20 0 DIADLO C[C@H]1CC/C(=C\C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1 ZINC000753597807 1045771740 /nfs/dbraw/zinc/77/17/40/1045771740.db2.gz COCWBOMAVPVFIV-OQZOHAQUSA-N 1 2 315.804 4.211 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@H](c2ccccc2)C(C)C)c(C)[nH+]1 ZINC001124898774 1045794137 /nfs/dbraw/zinc/79/41/37/1045794137.db2.gz WCWOUBPZDXTLOI-SFHVURJKSA-N 1 2 310.441 4.176 20 0 DIADLO CC(C)c1ccoc1C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC000452351795 1045801523 /nfs/dbraw/zinc/80/15/23/1045801523.db2.gz GHTCMUDWMQTLCD-UHFFFAOYSA-N 1 2 323.396 4.270 20 0 DIADLO CCOc1ccc([C@@H]([NH2+]Cc2cc(C)no2)c2ccccc2)cc1 ZINC000631044730 1045801354 /nfs/dbraw/zinc/80/13/54/1045801354.db2.gz ICBJQBDYUYJPHA-FQEVSTJZSA-N 1 2 322.408 4.261 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2csc(-c3cccs3)n2)s1 ZINC000631224433 1045839189 /nfs/dbraw/zinc/83/91/89/1045839189.db2.gz WUTFEPMVJFTGDD-VIFPVBQESA-N 1 2 321.496 4.487 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C3CCC4(CC4)CC3)cc2)CCO1 ZINC000754102204 1045847277 /nfs/dbraw/zinc/84/72/77/1045847277.db2.gz RCZDGINBMSXFBY-OAHLLOKOSA-N 1 2 300.446 4.046 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC001125083271 1045847849 /nfs/dbraw/zinc/84/78/49/1045847849.db2.gz BCHDORDBPDEBGC-BRWVUGGUSA-N 1 2 323.440 4.417 20 0 DIADLO C[N@H+](Cc1ccccn1)Cc1cc(C(F)(F)F)ccc1Cl ZINC000350454267 1045850023 /nfs/dbraw/zinc/85/00/23/1045850023.db2.gz FLUKJALDVPNNBS-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccccn1)Cc1cc(C(F)(F)F)ccc1Cl ZINC000350454267 1045850041 /nfs/dbraw/zinc/85/00/41/1045850041.db2.gz FLUKJALDVPNNBS-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO CCC[C@H]([NH2+]Cc1nc(C)c2ccccc2n1)c1cc(C)ccn1 ZINC000631574395 1045873227 /nfs/dbraw/zinc/87/32/27/1045873227.db2.gz DJJGWTWYWMNKNF-SFHVURJKSA-N 1 2 320.440 4.273 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1csc(C)n1)c1cccc(OC)c1OC ZINC000631583412 1045876260 /nfs/dbraw/zinc/87/62/60/1045876260.db2.gz XCYPGXKMYJLUQW-RISCZKNCSA-N 1 2 320.458 4.271 20 0 DIADLO CC[C@@H](CC(C)C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001125233091 1045880268 /nfs/dbraw/zinc/88/02/68/1045880268.db2.gz OCWRVGIKFAFMKV-ZDUSSCGKSA-N 1 2 303.381 4.022 20 0 DIADLO CC(C)c1ccccc1C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001125232721 1045880559 /nfs/dbraw/zinc/88/05/59/1045880559.db2.gz CDQTXGWMXNWFRP-UHFFFAOYSA-N 1 2 323.371 4.387 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1cc(C)ccn1 ZINC000631599253 1045882245 /nfs/dbraw/zinc/88/22/45/1045882245.db2.gz DZQZSTVAYJJRQY-GOSISDBHSA-N 1 2 312.461 4.333 20 0 DIADLO Clc1ccc(Br)c(C[N@@H+]2CCC[C@@H]3C[C@@H]32)c1 ZINC001137527806 1045883315 /nfs/dbraw/zinc/88/33/15/1045883315.db2.gz WHPMLOVCTAYKAG-RNCFNFMXSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1ccc(Br)c(C[N@H+]2CCC[C@@H]3C[C@@H]32)c1 ZINC001137527806 1045883333 /nfs/dbraw/zinc/88/33/33/1045883333.db2.gz WHPMLOVCTAYKAG-RNCFNFMXSA-N 1 2 300.627 4.087 20 0 DIADLO Brc1nc(C[N@@H+]2CCC3(C2)CCCCC3)cs1 ZINC001137586953 1045898695 /nfs/dbraw/zinc/89/86/95/1045898695.db2.gz KHHUKAXFQABHSO-UHFFFAOYSA-N 1 2 315.280 4.062 20 0 DIADLO Brc1nc(C[N@H+]2CCC3(C2)CCCCC3)cs1 ZINC001137586953 1045898701 /nfs/dbraw/zinc/89/87/01/1045898701.db2.gz KHHUKAXFQABHSO-UHFFFAOYSA-N 1 2 315.280 4.062 20 0 DIADLO Brc1nc(C[NH+]2CCCCCCCC2)cs1 ZINC001137585611 1045900472 /nfs/dbraw/zinc/90/04/72/1045900472.db2.gz CJLMVQMVTILUEA-UHFFFAOYSA-N 1 2 303.269 4.062 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+]1CCOC2(CCCC2)C1 ZINC000531733468 1045909119 /nfs/dbraw/zinc/90/91/19/1045909119.db2.gz UIVKASGHMHTGEN-ZDUSSCGKSA-N 1 2 324.262 4.155 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+]1CCOC2(CCCC2)C1 ZINC000531733468 1045909124 /nfs/dbraw/zinc/90/91/24/1045909124.db2.gz UIVKASGHMHTGEN-ZDUSSCGKSA-N 1 2 324.262 4.155 20 0 DIADLO Cc1ccc(C[NH2+]Cc2c(Cl)cccc2OC(F)F)o1 ZINC001461664511 1045918020 /nfs/dbraw/zinc/91/80/20/1045918020.db2.gz AAYUKMRDBKAMBG-UHFFFAOYSA-N 1 2 301.720 4.133 20 0 DIADLO C[C@@H]([NH2+]Cc1c(Cl)cccc1OC(F)F)c1ccco1 ZINC000631772365 1045918291 /nfs/dbraw/zinc/91/82/91/1045918291.db2.gz DLSPSXADCPHSFS-SECBINFHSA-N 1 2 301.720 4.385 20 0 DIADLO Oc1ccc2c(c1)[C@@H]([NH2+][C@@H](CF)c1ccc(F)cc1)CCC2 ZINC000631798414 1045918829 /nfs/dbraw/zinc/91/88/29/1045918829.db2.gz SEJYHTNGYUSBJV-ROUUACIJSA-N 1 2 303.352 4.209 20 0 DIADLO COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@H](CF)c1ccc(F)cc1 ZINC000631798459 1045919633 /nfs/dbraw/zinc/91/96/33/1045919633.db2.gz SYLMMMKESAMRAU-DLBZAZTESA-N 1 2 321.342 4.261 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)c(OC)c1 ZINC000631795970 1045919743 /nfs/dbraw/zinc/91/97/43/1045919743.db2.gz QFCBZJRSUNFBBZ-YVEFUNNKSA-N 1 2 321.367 4.204 20 0 DIADLO Cc1c([C@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)cnn1C(C)(C)C ZINC000631797922 1045919853 /nfs/dbraw/zinc/91/98/53/1045919853.db2.gz JYLXSAOESIVDOB-YVEFUNNKSA-N 1 2 321.415 4.447 20 0 DIADLO C[C@@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1cnn(C2CCCC2)c1 ZINC000631798656 1045920307 /nfs/dbraw/zinc/92/03/07/1045920307.db2.gz XBKDGENIDJHFPP-ACJLOTCBSA-N 1 2 319.399 4.499 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@H](C)c2csc3ccccc23)n1 ZINC000754734428 1045921426 /nfs/dbraw/zinc/92/14/26/1045921426.db2.gz RMJSCKKIMGTXSI-GFCCVEGCSA-N 1 2 315.442 4.334 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(Cl)n1)c1cccc(OC(F)F)c1 ZINC000828639398 1045924681 /nfs/dbraw/zinc/92/46/81/1045924681.db2.gz WEKCTHXPWNWDOM-MRVPVSSYSA-N 1 2 318.776 4.249 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ncccc2C(F)(F)F)c1F ZINC001137673705 1045926954 /nfs/dbraw/zinc/92/69/54/1045926954.db2.gz OGHJDQNWKQAMDD-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ncccc2C(F)(F)F)c1F ZINC001137673705 1045926969 /nfs/dbraw/zinc/92/69/69/1045926969.db2.gz OGHJDQNWKQAMDD-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO COc1ccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1OC ZINC000192901753 1045953621 /nfs/dbraw/zinc/95/36/21/1045953621.db2.gz WPXXEHUMVNTRJF-AWEZNQCLSA-N 1 2 323.396 4.063 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001137751988 1045956103 /nfs/dbraw/zinc/95/61/03/1045956103.db2.gz VXTBTFUXSYRKIH-OAHLLOKOSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001137751988 1045956110 /nfs/dbraw/zinc/95/61/10/1045956110.db2.gz VXTBTFUXSYRKIH-OAHLLOKOSA-N 1 2 324.255 4.372 20 0 DIADLO CCc1nc(CNc2[nH+]ccc3cc(C(F)(F)F)ccc32)co1 ZINC000829190501 1045961483 /nfs/dbraw/zinc/96/14/83/1045961483.db2.gz KZQZCMAMXCFYCK-UHFFFAOYSA-N 1 2 321.302 4.416 20 0 DIADLO CCCC[C@@H](C)[N@H+](CCCC)Cn1ncc2sccc2c1=O ZINC000902277544 1045961751 /nfs/dbraw/zinc/96/17/51/1045961751.db2.gz MJCRUDFJYBPYPP-CQSZACIVSA-N 1 2 321.490 4.096 20 0 DIADLO CCCC[C@@H](C)[N@@H+](CCCC)Cn1ncc2sccc2c1=O ZINC000902277544 1045961760 /nfs/dbraw/zinc/96/17/60/1045961760.db2.gz MJCRUDFJYBPYPP-CQSZACIVSA-N 1 2 321.490 4.096 20 0 DIADLO CCn1cnc(C[NH2+]C(c2cccc(C)c2)c2cccc(C)c2)c1 ZINC000902300072 1045969474 /nfs/dbraw/zinc/96/94/74/1045969474.db2.gz KNXVJHVKXZGXPD-UHFFFAOYSA-N 1 2 319.452 4.399 20 0 DIADLO COc1ccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1F ZINC000193161574 1045972676 /nfs/dbraw/zinc/97/26/76/1045972676.db2.gz VTSKOLDFPXJKKP-CYBMUJFWSA-N 1 2 311.360 4.193 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2nc(C)c3ccccc3n2)CC1 ZINC000829495431 1045981775 /nfs/dbraw/zinc/98/17/75/1045981775.db2.gz OPZRHFJPKUTIEQ-UHFFFAOYSA-N 1 2 303.409 4.026 20 0 DIADLO Cc1cccc(C)c1C[N@@H+]1CCn2cc(-c3ccccc3)nc2C1 ZINC001137852617 1045986382 /nfs/dbraw/zinc/98/63/82/1045986382.db2.gz JVVQEYKJYQSMGC-UHFFFAOYSA-N 1 2 317.436 4.183 20 0 DIADLO Cc1cccc(C)c1C[N@H+]1CCn2cc(-c3ccccc3)nc2C1 ZINC001137852617 1045986390 /nfs/dbraw/zinc/98/63/90/1045986390.db2.gz JVVQEYKJYQSMGC-UHFFFAOYSA-N 1 2 317.436 4.183 20 0 DIADLO Fc1cc(F)c(F)c(C[NH+]2CCC3(CC(F)(F)C3)CC2)c1 ZINC001137868495 1045992443 /nfs/dbraw/zinc/99/24/43/1045992443.db2.gz KZEHRMSXHKZPLE-UHFFFAOYSA-N 1 2 305.290 4.115 20 0 DIADLO Cc1cccc(F)c1NC(=O)C[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC001137875621 1045995380 /nfs/dbraw/zinc/99/53/80/1045995380.db2.gz DJXIJNZFDPMNIG-HNNXBMFYSA-N 1 2 323.371 4.018 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1sc(-c2cccnc2)nc1C)C(F)F ZINC000453233108 1045996231 /nfs/dbraw/zinc/99/62/31/1045996231.db2.gz HDPUXYYVAIIMDI-BXKDBHETSA-N 1 2 311.401 4.208 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[NH+]1CCC(c2ccccn2)CC1 ZINC001137881564 1045996355 /nfs/dbraw/zinc/99/63/55/1045996355.db2.gz VFYFQQYVKITTIE-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[NH+]1CCC2(CC(F)C2)CC1 ZINC001137878272 1045997261 /nfs/dbraw/zinc/99/72/61/1045997261.db2.gz PHVNKSQNGFITIG-UHFFFAOYSA-N 1 2 303.755 4.332 20 0 DIADLO COCc1ccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000193417186 1046006741 /nfs/dbraw/zinc/00/67/41/1046006741.db2.gz KNICCPREWLOXDL-HNNXBMFYSA-N 1 2 307.397 4.192 20 0 DIADLO C[N@H+](Cc1csc(Cl)n1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000829974106 1046028252 /nfs/dbraw/zinc/02/82/52/1046028252.db2.gz WHNYFLGSHZMAOD-ZJUUUORDSA-N 1 2 312.788 4.349 20 0 DIADLO C[N@@H+](Cc1csc(Cl)n1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000829974106 1046028270 /nfs/dbraw/zinc/02/82/70/1046028270.db2.gz WHNYFLGSHZMAOD-ZJUUUORDSA-N 1 2 312.788 4.349 20 0 DIADLO CNc1ccccc1C[NH2+][C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000902531418 1046016085 /nfs/dbraw/zinc/01/60/85/1046016085.db2.gz VKBXVXMIOBMVQS-VIFPVBQESA-N 1 2 315.364 4.054 20 0 DIADLO CCSc1ccccc1[C@@H](C)[NH2+]Cc1nn(C)cc1Cl ZINC000453330518 1046023633 /nfs/dbraw/zinc/02/36/33/1046023633.db2.gz WZWNOCZGOPUHJI-LLVKDONJSA-N 1 2 309.866 4.036 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@@H](Oc3ccccc3)C2)c(F)c1F ZINC001137939202 1046026275 /nfs/dbraw/zinc/02/62/75/1046026275.db2.gz OEUHHSBEEXRDRW-OAHLLOKOSA-N 1 2 321.342 4.147 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@@H](Oc3ccccc3)C2)c(F)c1F ZINC001137939202 1046026289 /nfs/dbraw/zinc/02/62/89/1046026289.db2.gz OEUHHSBEEXRDRW-OAHLLOKOSA-N 1 2 321.342 4.147 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1ccc(F)c(F)c1F ZINC001137940254 1046026408 /nfs/dbraw/zinc/02/64/08/1046026408.db2.gz PQKVLZNIMLBSHT-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1ccc(F)c(F)c1F ZINC001137940254 1046026424 /nfs/dbraw/zinc/02/64/24/1046026424.db2.gz PQKVLZNIMLBSHT-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO CC(C)[C@H]1C[C@H]([NH2+]Cc2nn(C)cc2Cl)c2ccccc21 ZINC000453309902 1046029021 /nfs/dbraw/zinc/02/90/21/1046029021.db2.gz FARCKCWSCTZDPB-ZBFHGGJFSA-N 1 2 303.837 4.048 20 0 DIADLO O=[N+]([O-])c1ccc(Cl)c(C[N@H+](Cc2ccccc2)C2CC2)c1 ZINC000384350758 1046030878 /nfs/dbraw/zinc/03/08/78/1046030878.db2.gz GCVWBZMCKFLGRI-UHFFFAOYSA-N 1 2 316.788 4.413 20 0 DIADLO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+](Cc2ccccc2)C2CC2)c1 ZINC000384350758 1046030890 /nfs/dbraw/zinc/03/08/90/1046030890.db2.gz GCVWBZMCKFLGRI-UHFFFAOYSA-N 1 2 316.788 4.413 20 0 DIADLO Oc1ccc2c(c1)CC[N@@H+](Cc1cc3ccccc3nc1Cl)C2 ZINC001137973729 1046040825 /nfs/dbraw/zinc/04/08/25/1046040825.db2.gz HBUHCDUODOPFMP-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1ccc2c(c1)CC[N@H+](Cc1cc3ccccc3nc1Cl)C2 ZINC001137973729 1046040841 /nfs/dbraw/zinc/04/08/41/1046040841.db2.gz HBUHCDUODOPFMP-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1cc2ccccc2nc1Cl ZINC001137977372 1046042866 /nfs/dbraw/zinc/04/28/66/1046042866.db2.gz LGOVPKGSJOEIRN-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1cc2ccccc2nc1Cl ZINC001137977372 1046042881 /nfs/dbraw/zinc/04/28/81/1046042881.db2.gz LGOVPKGSJOEIRN-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c1Cl ZINC001138004079 1046052976 /nfs/dbraw/zinc/05/29/76/1046052976.db2.gz WDWPJTIPETVCEI-CYBMUJFWSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c1Cl ZINC001138004079 1046052993 /nfs/dbraw/zinc/05/29/93/1046052993.db2.gz WDWPJTIPETVCEI-CYBMUJFWSA-N 1 2 323.770 4.272 20 0 DIADLO Cc1ccc(C[N@@H+]2CCOC[C@@H]2c2cccnc2)c2ccccc12 ZINC001138017957 1046061007 /nfs/dbraw/zinc/06/10/07/1046061007.db2.gz CFTNXLMBDXEZLO-OAQYLSRUSA-N 1 2 318.420 4.117 20 0 DIADLO Cc1ccc(C[N@H+]2CCOC[C@@H]2c2cccnc2)c2ccccc12 ZINC001138017957 1046061022 /nfs/dbraw/zinc/06/10/22/1046061022.db2.gz CFTNXLMBDXEZLO-OAQYLSRUSA-N 1 2 318.420 4.117 20 0 DIADLO COc1cccnc1C[NH2+][C@@H](C)c1cccc(Cl)c1Cl ZINC000453361892 1046065884 /nfs/dbraw/zinc/06/58/84/1046065884.db2.gz LKRIGTKSUKMNPJ-JTQLQIEISA-N 1 2 311.212 4.248 20 0 DIADLO COc1cccnc1C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000453363229 1046066541 /nfs/dbraw/zinc/06/65/41/1046066541.db2.gz MKFYGZDGMXVBFQ-SNVBAGLBSA-N 1 2 311.212 4.248 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3cc(Cl)cc(Cl)c32)c2nccn21 ZINC000453370636 1046070300 /nfs/dbraw/zinc/07/03/00/1046070300.db2.gz VPLJPWHYLJZVFR-BIGNPOOSSA-N 1 2 322.239 4.473 20 0 DIADLO CCc1ncc(C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cn2)o1 ZINC000453378633 1046074094 /nfs/dbraw/zinc/07/40/94/1046074094.db2.gz KMLKYLYRHXXKHH-AWEZNQCLSA-N 1 2 323.396 4.275 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+][C@H]1C[C@H](C)n2ccnc21 ZINC000453378646 1046074400 /nfs/dbraw/zinc/07/44/00/1046074400.db2.gz ZIIMFHDYXNXHOU-HUBLWGQQSA-N 1 2 319.836 4.292 20 0 DIADLO CCC[C@@H]([NH2+][C@H](C)c1cn(CCC)nn1)c1ccc(F)cc1F ZINC000902841253 1046083622 /nfs/dbraw/zinc/08/36/22/1046083622.db2.gz NIMKUHFUFLPOCP-MLGOLLRUSA-N 1 2 322.403 4.158 20 0 DIADLO CC(=O)C1CC[NH+](Cc2cc(C(F)(F)F)ccc2Cl)CC1 ZINC001138085391 1046088383 /nfs/dbraw/zinc/08/83/83/1046088383.db2.gz BWWSYVZCXIUFMQ-UHFFFAOYSA-N 1 2 319.754 4.160 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2c(F)ccc(C)c2F)cc1 ZINC001138119983 1046100340 /nfs/dbraw/zinc/10/03/40/1046100340.db2.gz YQKVHHATVQPKDT-ZDUSSCGKSA-N 1 2 305.368 4.475 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2c(F)ccc(C)c2F)cc1 ZINC001138119983 1046100345 /nfs/dbraw/zinc/10/03/45/1046100345.db2.gz YQKVHHATVQPKDT-ZDUSSCGKSA-N 1 2 305.368 4.475 20 0 DIADLO C[N@H+](Cc1cccnc1Cl)Cc1ccccc1C(F)(F)F ZINC000195113445 1046113399 /nfs/dbraw/zinc/11/33/99/1046113399.db2.gz JBNJUXNZJCOBJT-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1cccnc1Cl)Cc1ccccc1C(F)(F)F ZINC000195113445 1046113405 /nfs/dbraw/zinc/11/34/05/1046113405.db2.gz JBNJUXNZJCOBJT-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1ccnc(Cl)c1 ZINC000195408010 1046119201 /nfs/dbraw/zinc/11/92/01/1046119201.db2.gz IUXUGTUMTLEROP-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1ccnc(Cl)c1 ZINC000195408010 1046119205 /nfs/dbraw/zinc/11/92/05/1046119205.db2.gz IUXUGTUMTLEROP-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@@H](c2cccc(O)c2)C1 ZINC000532236131 1046123080 /nfs/dbraw/zinc/12/30/80/1046123080.db2.gz YGGFZYSCISGQMD-FZKQIMNGSA-N 1 2 317.816 4.180 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@@H](c2cccc(O)c2)C1 ZINC000532236131 1046123084 /nfs/dbraw/zinc/12/30/84/1046123084.db2.gz YGGFZYSCISGQMD-FZKQIMNGSA-N 1 2 317.816 4.180 20 0 DIADLO CC(C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)=C1CCC1 ZINC000831181247 1046123199 /nfs/dbraw/zinc/12/31/99/1046123199.db2.gz IIWWGWHTLKHXOH-UHFFFAOYSA-N 1 2 321.424 4.325 20 0 DIADLO CC(C)(C)Oc1cccc(C[N@H+](Cc2ccco2)C2CC2)n1 ZINC001138284936 1046138697 /nfs/dbraw/zinc/13/86/97/1046138697.db2.gz JQJZHOMGXXWQEN-UHFFFAOYSA-N 1 2 300.402 4.017 20 0 DIADLO CC(C)(C)Oc1cccc(C[N@@H+](Cc2ccco2)C2CC2)n1 ZINC001138284936 1046138706 /nfs/dbraw/zinc/13/87/06/1046138706.db2.gz JQJZHOMGXXWQEN-UHFFFAOYSA-N 1 2 300.402 4.017 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1cccc(C)c1)c1ccco1 ZINC000151118361 1046144212 /nfs/dbraw/zinc/14/42/12/1046144212.db2.gz JVJPAPGMNZYPRG-HXUWFJFHSA-N 1 2 307.393 4.476 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CCC[C@@H](C(F)F)C2)c(Cl)c1 ZINC001142293738 1046146863 /nfs/dbraw/zinc/14/68/63/1046146863.db2.gz ZKPUCBVLRCQUOZ-SECBINFHSA-N 1 2 324.198 4.479 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CCC[C@@H](C(F)F)C2)c(Cl)c1 ZINC001142293738 1046146867 /nfs/dbraw/zinc/14/68/67/1046146867.db2.gz ZKPUCBVLRCQUOZ-SECBINFHSA-N 1 2 324.198 4.479 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2)o1)c1nncn1C ZINC000903062357 1046153002 /nfs/dbraw/zinc/15/30/02/1046153002.db2.gz ULPAMIDQFAVQDS-KSSFIOAISA-N 1 2 324.428 4.123 20 0 DIADLO Oc1cc(O)cc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)s2)c1 ZINC001138329699 1046153549 /nfs/dbraw/zinc/15/35/49/1046153549.db2.gz FFMHLZPAWSEGJZ-ZDUSSCGKSA-N 1 2 309.818 4.150 20 0 DIADLO Oc1cc(O)cc(C[N@H+]2CCC[C@H]2c2ccc(Cl)s2)c1 ZINC001138329699 1046153553 /nfs/dbraw/zinc/15/35/53/1046153553.db2.gz FFMHLZPAWSEGJZ-ZDUSSCGKSA-N 1 2 309.818 4.150 20 0 DIADLO COc1ccc2c(c1Cl)[C@H]([NH2+]Cc1nc(C)cs1)CCC2 ZINC000903067205 1046154695 /nfs/dbraw/zinc/15/46/95/1046154695.db2.gz OHRCOGJLZIGSFA-GFCCVEGCSA-N 1 2 322.861 4.281 20 0 DIADLO c1ccc(COc2cc(NC3(c4ccccn4)CC3)cc[nH+]2)cc1 ZINC001168149837 1046157171 /nfs/dbraw/zinc/15/71/71/1046157171.db2.gz WIFZDIMJDHQIJM-UHFFFAOYSA-N 1 2 317.392 4.157 20 0 DIADLO Cn1c2ccccc2nc1C[N@@H+]1CCCC[C@H]1c1ccccc1F ZINC001138378629 1046159398 /nfs/dbraw/zinc/15/93/98/1046159398.db2.gz HSMOCYUYVAVTAA-SFHVURJKSA-N 1 2 323.415 4.440 20 0 DIADLO Cn1c2ccccc2nc1C[N@H+]1CCCC[C@H]1c1ccccc1F ZINC001138378629 1046159402 /nfs/dbraw/zinc/15/94/02/1046159402.db2.gz HSMOCYUYVAVTAA-SFHVURJKSA-N 1 2 323.415 4.440 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+](C)Cc3cn4ccc(C)cc4n3)cc2c1 ZINC001138420506 1046175485 /nfs/dbraw/zinc/17/54/85/1046175485.db2.gz LWKJNVVBOXYXOM-UHFFFAOYSA-N 1 2 318.424 4.064 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+](C)Cc3cn4ccc(C)cc4n3)cc2c1 ZINC001138420506 1046175488 /nfs/dbraw/zinc/17/54/88/1046175488.db2.gz LWKJNVVBOXYXOM-UHFFFAOYSA-N 1 2 318.424 4.064 20 0 DIADLO c1ccc([C@@H](Nc2ccc(N3CCCCC3)[nH+]c2)C2CC2)nc1 ZINC000903147939 1046176745 /nfs/dbraw/zinc/17/67/45/1046176745.db2.gz VEYICMMTCXGGKF-IBGZPJMESA-N 1 2 308.429 4.030 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCSc3ccccc3C2)cc1F ZINC001138426577 1046177213 /nfs/dbraw/zinc/17/72/13/1046177213.db2.gz DHPQMULVCMAPNF-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCSc3ccccc3C2)cc1F ZINC001138426577 1046177217 /nfs/dbraw/zinc/17/72/17/1046177217.db2.gz DHPQMULVCMAPNF-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCC[C@H]2c2ccc(C)nc2)cc1F ZINC001138426087 1046177716 /nfs/dbraw/zinc/17/77/16/1046177716.db2.gz LTUQRTLWJFVWJF-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCC[C@H]2c2ccc(C)nc2)cc1F ZINC001138426087 1046177722 /nfs/dbraw/zinc/17/77/22/1046177722.db2.gz LTUQRTLWJFVWJF-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO CC[N@H+](CC(=O)Nc1c(C)cccc1C(C)C)Cc1ccoc1 ZINC000102408873 1046179735 /nfs/dbraw/zinc/17/97/35/1046179735.db2.gz NMWVHXUNHKPDSB-UHFFFAOYSA-N 1 2 314.429 4.172 20 0 DIADLO CC[N@@H+](CC(=O)Nc1c(C)cccc1C(C)C)Cc1ccoc1 ZINC000102408873 1046179744 /nfs/dbraw/zinc/17/97/44/1046179744.db2.gz NMWVHXUNHKPDSB-UHFFFAOYSA-N 1 2 314.429 4.172 20 0 DIADLO Cc1ccc(NC(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1C ZINC001202829010 1046180172 /nfs/dbraw/zinc/18/01/72/1046180172.db2.gz TUMPJCZZHKZDON-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO Cc1cc([C@@H](C)NC(=O)[C@H](CC(C)C)n2cc[nH+]c2)c(C)s1 ZINC000635252250 1046182421 /nfs/dbraw/zinc/18/24/21/1046182421.db2.gz LUPSOXOITULTAT-CJNGLKHVSA-N 1 2 319.474 4.026 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CCCc3c(OC)ccc(Cl)c32)co1 ZINC000903188347 1046187925 /nfs/dbraw/zinc/18/79/25/1046187925.db2.gz ZCPFRRACFDIHSI-AWEZNQCLSA-N 1 2 320.820 4.066 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CCC1=O ZINC001204695755 1046194899 /nfs/dbraw/zinc/19/48/99/1046194899.db2.gz ZSKFEVFPDQCIDC-LBPRGKRZSA-N 1 2 303.789 4.011 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CCC1=O ZINC001204695755 1046194904 /nfs/dbraw/zinc/19/49/04/1046194904.db2.gz ZSKFEVFPDQCIDC-LBPRGKRZSA-N 1 2 303.789 4.011 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1)N1CC[C@H]([NH3+])c2ccccc21 ZINC001168154571 1046194972 /nfs/dbraw/zinc/19/49/72/1046194972.db2.gz NCPJSZSLNGXXRT-GUYCJALGSA-N 1 2 300.833 4.181 20 0 DIADLO COc1c(Cl)cc(C[N@H+]2CCC[C@H](C(F)F)C2)cc1Cl ZINC001138478061 1046196582 /nfs/dbraw/zinc/19/65/82/1046196582.db2.gz SGBHNSDTWGMAQB-JTQLQIEISA-N 1 2 324.198 4.479 20 0 DIADLO COc1c(Cl)cc(C[N@@H+]2CCC[C@H](C(F)F)C2)cc1Cl ZINC001138478061 1046196576 /nfs/dbraw/zinc/19/65/76/1046196576.db2.gz SGBHNSDTWGMAQB-JTQLQIEISA-N 1 2 324.198 4.479 20 0 DIADLO COc1c(Cl)cccc1C[NH2+][C@H](C)c1cccc(O)c1F ZINC000903245275 1046206259 /nfs/dbraw/zinc/20/62/59/1046206259.db2.gz CYZSBYPGSPIOLW-SNVBAGLBSA-N 1 2 309.768 4.044 20 0 DIADLO COc1ccc(-c2ccc(C[N@@H+]3C[C@@H](F)C[C@H]3CF)cc2)cc1 ZINC001138515853 1046210164 /nfs/dbraw/zinc/21/01/64/1046210164.db2.gz WMNYKCVXQGQIQF-ROUUACIJSA-N 1 2 317.379 4.244 20 0 DIADLO COc1ccc(-c2ccc(C[N@H+]3C[C@@H](F)C[C@H]3CF)cc2)cc1 ZINC001138515853 1046210171 /nfs/dbraw/zinc/21/01/71/1046210171.db2.gz WMNYKCVXQGQIQF-ROUUACIJSA-N 1 2 317.379 4.244 20 0 DIADLO CC(C)C[C@H]([NH2+][C@H]1c2ccccc2OC[C@@H]1F)c1ccncc1 ZINC000903266283 1046213886 /nfs/dbraw/zinc/21/38/86/1046213886.db2.gz MPJYCCGTKHRPDG-LNLFQRSKSA-N 1 2 314.404 4.230 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1ccccc1C(C)C ZINC000102519200 1046216614 /nfs/dbraw/zinc/21/66/14/1046216614.db2.gz IVSORARDNINGGR-OAHLLOKOSA-N 1 2 314.429 4.252 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1ccccc1C(C)C ZINC000102519200 1046216620 /nfs/dbraw/zinc/21/66/20/1046216620.db2.gz IVSORARDNINGGR-OAHLLOKOSA-N 1 2 314.429 4.252 20 0 DIADLO COc1ccc([NH2+]CCCCF)c(OCc2ccccc2)c1 ZINC000795255302 1046225829 /nfs/dbraw/zinc/22/58/29/1046225829.db2.gz AQLMBYFKZPHPAP-UHFFFAOYSA-N 1 2 303.377 4.436 20 0 DIADLO O=C(Nc1cscc1Cl)[C@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000636439761 1046226548 /nfs/dbraw/zinc/22/65/48/1046226548.db2.gz WTMWQOYWASFRQB-OAHLLOKOSA-N 1 2 320.845 4.005 20 0 DIADLO O=C(Nc1cscc1Cl)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000636439761 1046226557 /nfs/dbraw/zinc/22/65/57/1046226557.db2.gz WTMWQOYWASFRQB-OAHLLOKOSA-N 1 2 320.845 4.005 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(Br)cc2F)[nH+]1 ZINC001212868276 1046228806 /nfs/dbraw/zinc/22/88/06/1046228806.db2.gz MNGZNXFYRVRFIK-UHFFFAOYSA-N 1 2 320.165 4.288 20 0 DIADLO Cc1nc(C[N@@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@@H]2C)sc1C ZINC000088599246 1046234096 /nfs/dbraw/zinc/23/40/96/1046234096.db2.gz XGKYEZGSHXXJCU-IAISJRAMSA-N 1 2 316.470 4.110 20 0 DIADLO Cc1nc(C[N@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@@H]2C)sc1C ZINC000088599246 1046234104 /nfs/dbraw/zinc/23/41/04/1046234104.db2.gz XGKYEZGSHXXJCU-IAISJRAMSA-N 1 2 316.470 4.110 20 0 DIADLO Cc1cc(C)cc(NC(=O)Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001202845098 1046235051 /nfs/dbraw/zinc/23/50/51/1046235051.db2.gz ONVPNWPHGSRSCE-UHFFFAOYSA-N 1 2 320.396 4.192 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccncc1 ZINC000903313593 1046235872 /nfs/dbraw/zinc/23/58/72/1046235872.db2.gz UGFPYCMSKZUCRP-OAHLLOKOSA-N 1 2 301.434 4.244 20 0 DIADLO CCC[C@H]([NH2+][C@H](C)c1cn(C(C)C)nn1)c1ccc(F)cc1F ZINC000925265490 1046238063 /nfs/dbraw/zinc/23/80/63/1046238063.db2.gz UKRSJDVVSWZWQO-WBMJQRKESA-N 1 2 322.403 4.329 20 0 DIADLO Cc1cc(C[NH2+]Cc2occc2Br)ccc1Cl ZINC000758018332 1046238920 /nfs/dbraw/zinc/23/89/20/1046238920.db2.gz VYQQSOVXTLDGHV-UHFFFAOYSA-N 1 2 314.610 4.294 20 0 DIADLO Cc1ccc2cc([C@@H](C)[NH2+][C@@H](c3ncccn3)C3CC3)oc2c1 ZINC000903324229 1046239033 /nfs/dbraw/zinc/23/90/33/1046239033.db2.gz CWOSZCBCJDUSEX-FZKQIMNGSA-N 1 2 307.397 4.333 20 0 DIADLO CCSc1ccccc1[C@H](C)[NH2+][C@H](c1ncccn1)C1CC1 ZINC000903327406 1046240961 /nfs/dbraw/zinc/24/09/61/1046240961.db2.gz SPHVCMOSHQVKFH-GUYCJALGSA-N 1 2 313.470 4.391 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ncccn1)C1CC1)c1ccc(Cl)c(F)c1 ZINC000903327627 1046241298 /nfs/dbraw/zinc/24/12/98/1046241298.db2.gz WUNJQNILBYDANY-ZUZCIYMTSA-N 1 2 305.784 4.071 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+][C@H](C)c1cn(C(C)C)nn1)C(C)(C)C ZINC000903328877 1046242463 /nfs/dbraw/zinc/24/24/63/1046242463.db2.gz PRUTUBQXEQHXIJ-RHSMWYFYSA-N 1 2 315.465 4.000 20 0 DIADLO COc1ccc(-c2cccc(C[N@@H+]3Cc4ccncc4C3)c2)cc1 ZINC001138616696 1046243219 /nfs/dbraw/zinc/24/32/19/1046243219.db2.gz ZVIZPAFZHABMFZ-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccc(-c2cccc(C[N@H+]3Cc4ccncc4C3)c2)cc1 ZINC001138616696 1046243231 /nfs/dbraw/zinc/24/32/31/1046243231.db2.gz ZVIZPAFZHABMFZ-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cc(F)ccc1Cl)CC2 ZINC001138671473 1046262656 /nfs/dbraw/zinc/26/26/56/1046262656.db2.gz APDTVGHLSOLRAL-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cc(F)ccc1Cl)CC2 ZINC001138671473 1046262668 /nfs/dbraw/zinc/26/26/68/1046262668.db2.gz APDTVGHLSOLRAL-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CSc1ncc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)cn1 ZINC001138708895 1046273423 /nfs/dbraw/zinc/27/34/23/1046273423.db2.gz ZFWDVLDOPSQLOE-OAHLLOKOSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1ncc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)cn1 ZINC001138708895 1046273428 /nfs/dbraw/zinc/27/34/28/1046273428.db2.gz ZFWDVLDOPSQLOE-OAHLLOKOSA-N 1 2 319.861 4.189 20 0 DIADLO CCC[C@H]([NH2+]Cc1coc(C2CC2)n1)c1ccc(F)cc1F ZINC000758507844 1046275018 /nfs/dbraw/zinc/27/50/18/1046275018.db2.gz LOGIQXHRDIEFIF-INIZCTEOSA-N 1 2 306.356 4.461 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+](C)Cc1cccc2c1OCO2 ZINC001138723502 1046278459 /nfs/dbraw/zinc/27/84/59/1046278459.db2.gz RDEWFQXHEOVXIB-UHFFFAOYSA-N 1 2 303.789 4.009 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+](C)Cc1cccc2c1OCO2 ZINC001138723502 1046278470 /nfs/dbraw/zinc/27/84/70/1046278470.db2.gz RDEWFQXHEOVXIB-UHFFFAOYSA-N 1 2 303.789 4.009 20 0 DIADLO Cc1ncc([C@H](C)[N@H+](Cc2ccc(F)cc2F)C2CC2)c(C)n1 ZINC000637899395 1046283092 /nfs/dbraw/zinc/28/30/92/1046283092.db2.gz ODDFHDHHBNHXBJ-LBPRGKRZSA-N 1 2 317.383 4.097 20 0 DIADLO Cc1ncc([C@H](C)[N@@H+](Cc2ccc(F)cc2F)C2CC2)c(C)n1 ZINC000637899395 1046283105 /nfs/dbraw/zinc/28/31/05/1046283105.db2.gz ODDFHDHHBNHXBJ-LBPRGKRZSA-N 1 2 317.383 4.097 20 0 DIADLO Cc1ncc([C@@H](C)[N@H+](C)[C@@H](C)c2cc(F)ccc2F)c(C)n1 ZINC000637902201 1046284297 /nfs/dbraw/zinc/28/42/97/1046284297.db2.gz JYYUNLPHVLYIOK-NWDGAFQWSA-N 1 2 305.372 4.126 20 0 DIADLO Cc1ncc([C@@H](C)[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)c(C)n1 ZINC000637902201 1046284305 /nfs/dbraw/zinc/28/43/05/1046284305.db2.gz JYYUNLPHVLYIOK-NWDGAFQWSA-N 1 2 305.372 4.126 20 0 DIADLO COc1cc(Cl)cc(C[N@H+](Cc2ccco2)C2CC2)c1OC ZINC001138750865 1046285444 /nfs/dbraw/zinc/28/54/44/1046285444.db2.gz YSPWPYRDDZGNSD-UHFFFAOYSA-N 1 2 321.804 4.115 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+](Cc2ccco2)C2CC2)c1OC ZINC001138750865 1046285456 /nfs/dbraw/zinc/28/54/56/1046285456.db2.gz YSPWPYRDDZGNSD-UHFFFAOYSA-N 1 2 321.804 4.115 20 0 DIADLO c1cc([C@H]2CCC[N@@H+]2[C@H](c2nnc[nH]2)C2CCCCC2)cs1 ZINC000637909991 1046286318 /nfs/dbraw/zinc/28/63/18/1046286318.db2.gz MUCYUWQHMBWPGA-CVEARBPZSA-N 1 2 316.474 4.325 20 0 DIADLO c1cc([C@H]2CCC[N@H+]2[C@H](c2nnc[nH]2)C2CCCCC2)cs1 ZINC000637909991 1046286328 /nfs/dbraw/zinc/28/63/28/1046286328.db2.gz MUCYUWQHMBWPGA-CVEARBPZSA-N 1 2 316.474 4.325 20 0 DIADLO c1coc([C@H]2CCCC[N@H+]2[C@@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000638076288 1046292369 /nfs/dbraw/zinc/29/23/69/1046292369.db2.gz YHKSEVKEEBQJRA-NVXWUHKLSA-N 1 2 314.433 4.246 20 0 DIADLO c1coc([C@H]2CCCC[N@@H+]2[C@@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000638076288 1046292378 /nfs/dbraw/zinc/29/23/78/1046292378.db2.gz YHKSEVKEEBQJRA-NVXWUHKLSA-N 1 2 314.433 4.246 20 0 DIADLO Cc1ncc([C@@H](C)[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c(C)n1 ZINC000638120955 1046294751 /nfs/dbraw/zinc/29/47/51/1046294751.db2.gz HCRCZQXEDUIYMZ-SJKOYZFVSA-N 1 2 301.821 4.255 20 0 DIADLO Cc1ncc([C@@H](C)[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)c(C)n1 ZINC000638120955 1046294766 /nfs/dbraw/zinc/29/47/66/1046294766.db2.gz HCRCZQXEDUIYMZ-SJKOYZFVSA-N 1 2 301.821 4.255 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3o2)sn1 ZINC000638138937 1046297391 /nfs/dbraw/zinc/29/73/91/1046297391.db2.gz QCSIIHFUGZGPON-HNNXBMFYSA-N 1 2 313.426 4.320 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3o2)sn1 ZINC000638138937 1046297403 /nfs/dbraw/zinc/29/74/03/1046297403.db2.gz QCSIIHFUGZGPON-HNNXBMFYSA-N 1 2 313.426 4.320 20 0 DIADLO CC(C)(C)OC(=O)[C@H]1CCCC[N@@H+]1Cc1ccc2occc2c1 ZINC001138825021 1046301108 /nfs/dbraw/zinc/30/11/08/1046301108.db2.gz PBFQEGQALSJOIX-MRXNPFEDSA-N 1 2 315.413 4.129 20 0 DIADLO CC(C)(C)OC(=O)[C@H]1CCCC[N@H+]1Cc1ccc2occc2c1 ZINC001138825021 1046301124 /nfs/dbraw/zinc/30/11/24/1046301124.db2.gz PBFQEGQALSJOIX-MRXNPFEDSA-N 1 2 315.413 4.129 20 0 DIADLO C[C@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)[C@@H]1CC1(F)F ZINC000638227015 1046303321 /nfs/dbraw/zinc/30/33/21/1046303321.db2.gz LWTNXMWDGAFLDW-LRDDRELGSA-N 1 2 317.383 4.342 20 0 DIADLO C[C@H]([NH2+][C@H](c1nnc[nH]1)C1CCCCC1)c1cccc(Cl)c1 ZINC000638289915 1046308176 /nfs/dbraw/zinc/30/81/76/1046308176.db2.gz BZMXUQUPHZTGPK-LRDDRELGSA-N 1 2 318.852 4.430 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1ccc(F)cc1)c1ccccn1 ZINC000089797125 1046313870 /nfs/dbraw/zinc/31/38/70/1046313870.db2.gz IOXUAFRONGQYAA-HXUWFJFHSA-N 1 2 322.383 4.109 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)c(C)s1 ZINC000638336628 1046314426 /nfs/dbraw/zinc/31/44/26/1046314426.db2.gz WRVTTWDVXNZMSJ-LRDDRELGSA-N 1 2 318.490 4.455 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](Oc3ccc(F)cc3)C2)cs1 ZINC001138886705 1046319343 /nfs/dbraw/zinc/31/93/43/1046319343.db2.gz BBYBMLYNFUYILA-MRXNPFEDSA-N 1 2 320.433 4.059 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@@H](Oc3ccc(F)cc3)C2)cs1 ZINC001138886705 1046319355 /nfs/dbraw/zinc/31/93/55/1046319355.db2.gz BBYBMLYNFUYILA-MRXNPFEDSA-N 1 2 320.433 4.059 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2cc(F)cnc2Cl)c1 ZINC001138895301 1046320275 /nfs/dbraw/zinc/32/02/75/1046320275.db2.gz FTDWULZBYAOENC-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2cc(F)cnc2Cl)c1 ZINC001138895301 1046320280 /nfs/dbraw/zinc/32/02/80/1046320280.db2.gz FTDWULZBYAOENC-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(Cl)cc(-c2c[nH+]c3c(c2)CCCN3)cc1Cl ZINC001204843784 1046321592 /nfs/dbraw/zinc/32/15/92/1046321592.db2.gz ZDXYFSWIQVXDKP-UHFFFAOYSA-N 1 2 309.196 4.065 20 0 DIADLO Cc1ccc2c(c1)CC[C@H]2[NH2+][C@H](c1nnc[nH]1)C1CCCCC1 ZINC000638426747 1046321860 /nfs/dbraw/zinc/32/18/60/1046321860.db2.gz WEEZQSWGDRCSHG-MSOLQXFVSA-N 1 2 310.445 4.012 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc(Br)o1 ZINC001138901928 1046324228 /nfs/dbraw/zinc/32/42/28/1046324228.db2.gz NBWNVOFQEITHAO-LLVKDONJSA-N 1 2 306.203 4.161 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc(Br)o1 ZINC001138901928 1046324238 /nfs/dbraw/zinc/32/42/38/1046324238.db2.gz NBWNVOFQEITHAO-LLVKDONJSA-N 1 2 306.203 4.161 20 0 DIADLO Cn1c2ccccc2c2cc(C[N@H+](C)Cc3cscn3)ccc21 ZINC001138918313 1046327514 /nfs/dbraw/zinc/32/75/14/1046327514.db2.gz BPJVGAWOPQBYLU-UHFFFAOYSA-N 1 2 321.449 4.420 20 0 DIADLO Cn1c2ccccc2c2cc(C[N@@H+](C)Cc3cscn3)ccc21 ZINC001138918313 1046327517 /nfs/dbraw/zinc/32/75/17/1046327517.db2.gz BPJVGAWOPQBYLU-UHFFFAOYSA-N 1 2 321.449 4.420 20 0 DIADLO Cc1cccc2c1CC[C@@H]2[NH2+][C@@H](c1nnc[nH]1)C1CCCCC1 ZINC000638544814 1046329229 /nfs/dbraw/zinc/32/92/29/1046329229.db2.gz LEDSQFVPFWCSGI-ZWKOTPCHSA-N 1 2 310.445 4.012 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1cc(Br)cnc1Cl ZINC001138942355 1046330879 /nfs/dbraw/zinc/33/08/79/1046330879.db2.gz YXFQNOCEEAORIZ-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1nc(Cl)cs1)CCS2 ZINC000759184177 1046331249 /nfs/dbraw/zinc/33/12/49/1046331249.db2.gz IMHJWXDBZDWJHN-SNVBAGLBSA-N 1 2 314.838 4.262 20 0 DIADLO c1ccc2oc(C[NH2+]Cc3ccccc3OC3CCC3)nc2c1 ZINC000638608776 1046331881 /nfs/dbraw/zinc/33/18/81/1046331881.db2.gz LFUHPOBCRJHTEF-UHFFFAOYSA-N 1 2 308.381 4.049 20 0 DIADLO C[C@H]1CCCCC[N@@H+]1Cc1cc(Br)cnc1Cl ZINC001138944513 1046334923 /nfs/dbraw/zinc/33/49/23/1046334923.db2.gz QJERTKSPFSIWGM-JTQLQIEISA-N 1 2 317.658 4.262 20 0 DIADLO C[C@H]1CCCCC[N@H+]1Cc1cc(Br)cnc1Cl ZINC001138944513 1046334938 /nfs/dbraw/zinc/33/49/38/1046334938.db2.gz QJERTKSPFSIWGM-JTQLQIEISA-N 1 2 317.658 4.262 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)cc1F ZINC000638762199 1046339622 /nfs/dbraw/zinc/33/96/22/1046339622.db2.gz BWKVNCBXPIPBOY-CXAGYDPISA-N 1 2 316.424 4.224 20 0 DIADLO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)Cc1cscn1 ZINC000170871673 1046349386 /nfs/dbraw/zinc/34/93/86/1046349386.db2.gz RCXXTOJVOFTZJS-JTQLQIEISA-N 1 2 300.349 4.355 20 0 DIADLO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)Cc1cscn1 ZINC000170871673 1046349401 /nfs/dbraw/zinc/34/94/01/1046349401.db2.gz RCXXTOJVOFTZJS-JTQLQIEISA-N 1 2 300.349 4.355 20 0 DIADLO COc1ccc([C@@H]([NH2+][C@@H](C)c2nc(C(C)C)no2)C2CC2)cc1 ZINC000170874219 1046350705 /nfs/dbraw/zinc/35/07/05/1046350705.db2.gz ARTNYNYIZWDVRS-LRDDRELGSA-N 1 2 315.417 4.004 20 0 DIADLO CCCOc1ccccc1C[N@@H+]1CCC[C@H]1c1nccs1 ZINC001138998844 1046352249 /nfs/dbraw/zinc/35/22/49/1046352249.db2.gz REDLJUQOWJIOGO-HNNXBMFYSA-N 1 2 302.443 4.269 20 0 DIADLO CCCOc1ccccc1C[N@H+]1CCC[C@H]1c1nccs1 ZINC001138998844 1046352255 /nfs/dbraw/zinc/35/22/55/1046352255.db2.gz REDLJUQOWJIOGO-HNNXBMFYSA-N 1 2 302.443 4.269 20 0 DIADLO CCCOc1ccccc1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC001138998845 1046352275 /nfs/dbraw/zinc/35/22/75/1046352275.db2.gz REDLJUQOWJIOGO-OAHLLOKOSA-N 1 2 302.443 4.269 20 0 DIADLO CCCOc1ccccc1C[N@H+]1CCC[C@@H]1c1nccs1 ZINC001138998845 1046352282 /nfs/dbraw/zinc/35/22/82/1046352282.db2.gz REDLJUQOWJIOGO-OAHLLOKOSA-N 1 2 302.443 4.269 20 0 DIADLO COC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2cccs2)s1 ZINC001139017742 1046358147 /nfs/dbraw/zinc/35/81/47/1046358147.db2.gz ZIUGLVWWHSKAAY-ZDUSSCGKSA-N 1 2 321.467 4.004 20 0 DIADLO COC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc(-c2cccs2)s1 ZINC001139017742 1046358154 /nfs/dbraw/zinc/35/81/54/1046358154.db2.gz ZIUGLVWWHSKAAY-ZDUSSCGKSA-N 1 2 321.467 4.004 20 0 DIADLO CCSc1nn(C[N@H+](CC)C[C@@H](C)CC)c(=S)s1 ZINC000748260909 1046362796 /nfs/dbraw/zinc/36/27/96/1046362796.db2.gz DDDSWRPZNKJMNS-JTQLQIEISA-N 1 2 305.538 4.112 20 0 DIADLO CCSc1nn(C[N@@H+](CC)C[C@@H](C)CC)c(=S)s1 ZINC000748260909 1046362810 /nfs/dbraw/zinc/36/28/10/1046362810.db2.gz DDDSWRPZNKJMNS-JTQLQIEISA-N 1 2 305.538 4.112 20 0 DIADLO COc1ccccc1-c1ccc(C[N@@H+]2Cc3cccnc3C2)cc1 ZINC001139033867 1046364001 /nfs/dbraw/zinc/36/40/01/1046364001.db2.gz MIEHFLAVQLUZEL-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccccc1-c1ccc(C[N@H+]2Cc3cccnc3C2)cc1 ZINC001139033867 1046364013 /nfs/dbraw/zinc/36/40/13/1046364013.db2.gz MIEHFLAVQLUZEL-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccccc1-c1ccc(C[N@@H+]2Cc3ccncc3C2)cc1 ZINC001139036808 1046367390 /nfs/dbraw/zinc/36/73/90/1046367390.db2.gz XMMIPQCOXGGLKT-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccccc1-c1ccc(C[N@H+]2Cc3ccncc3C2)cc1 ZINC001139036808 1046367404 /nfs/dbraw/zinc/36/74/04/1046367404.db2.gz XMMIPQCOXGGLKT-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO CC1(C)CN(c2[nH+]ccc3c(N)cccc32)CC[C@@H]1C(F)(F)F ZINC000663838400 1046380259 /nfs/dbraw/zinc/38/02/59/1046380259.db2.gz JBOALGIRZNYYRI-AWEZNQCLSA-N 1 2 323.362 4.232 20 0 DIADLO C[C@H]1CCCC[N@H+](Cc2ccc(Br)nc2Cl)C1 ZINC001139108548 1046385623 /nfs/dbraw/zinc/38/56/23/1046385623.db2.gz VENJEJILIJIHKZ-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO C[C@H]1CCCC[N@@H+](Cc2ccc(Br)nc2Cl)C1 ZINC001139108548 1046385632 /nfs/dbraw/zinc/38/56/32/1046385632.db2.gz VENJEJILIJIHKZ-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ccc(Br)nc2Cl)CC1 ZINC001139109183 1046387215 /nfs/dbraw/zinc/38/72/15/1046387215.db2.gz GBZFINALJKHKFB-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ccc(Br)nc2Cl)CC1 ZINC001139109183 1046387227 /nfs/dbraw/zinc/38/72/27/1046387227.db2.gz GBZFINALJKHKFB-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO Cc1cc(NCc2c[nH]nc2-c2ccsc2)ccc1[NH+](C)C ZINC000780539599 1046391788 /nfs/dbraw/zinc/39/17/88/1046391788.db2.gz XRLAQQAHPRTJRA-UHFFFAOYSA-N 1 2 312.442 4.125 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nc(CC2CC2)no1)c1ccc(Cl)cc1 ZINC000639439150 1046401192 /nfs/dbraw/zinc/40/11/92/1046401192.db2.gz BQLZOWODDKQPIP-KRWDZBQOSA-N 1 2 319.836 4.162 20 0 DIADLO CCCCc1nc(Cl)c(C[N@@H+]2CCC(F)(F)C(C)(C)C2)[nH]1 ZINC001139175904 1046402757 /nfs/dbraw/zinc/40/27/57/1046402757.db2.gz FOSIHDCSNFRVBI-UHFFFAOYSA-N 1 2 319.827 4.273 20 0 DIADLO CCCCc1nc(Cl)c(C[N@H+]2CCC(F)(F)C(C)(C)C2)[nH]1 ZINC001139175904 1046402762 /nfs/dbraw/zinc/40/27/62/1046402762.db2.gz FOSIHDCSNFRVBI-UHFFFAOYSA-N 1 2 319.827 4.273 20 0 DIADLO CC[N@H+](CC(=O)[C@H]1CC[C@@H](C(F)(F)F)CC1)Cc1ccoc1 ZINC000639470248 1046404841 /nfs/dbraw/zinc/40/48/41/1046404841.db2.gz KWKJTMHJNPIIGX-OKILXGFUSA-N 1 2 317.351 4.039 20 0 DIADLO CC[N@@H+](CC(=O)[C@H]1CC[C@@H](C(F)(F)F)CC1)Cc1ccoc1 ZINC000639470248 1046404859 /nfs/dbraw/zinc/40/48/59/1046404859.db2.gz KWKJTMHJNPIIGX-OKILXGFUSA-N 1 2 317.351 4.039 20 0 DIADLO c1ccc([C@H](CC2CCC2)[NH2+]Cc2nc(C3CCC3)no2)cc1 ZINC000639573156 1046413053 /nfs/dbraw/zinc/41/30/53/1046413053.db2.gz YHHNPULURVPYTK-KRWDZBQOSA-N 1 2 311.429 4.358 20 0 DIADLO CCC(CC)N(CC(C)C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000748950352 1046416408 /nfs/dbraw/zinc/41/64/08/1046416408.db2.gz XEXRYOJASGLRFO-UHFFFAOYSA-N 1 2 302.422 4.013 20 0 DIADLO CC(C)[N@H+](Cc1nc(CC2CC2)no1)[C@H](C)c1ccsc1 ZINC000639683334 1046421469 /nfs/dbraw/zinc/42/14/69/1046421469.db2.gz CXZNOAMCERHYCS-GFCCVEGCSA-N 1 2 305.447 4.055 20 0 DIADLO CC(C)[N@@H+](Cc1nc(CC2CC2)no1)[C@H](C)c1ccsc1 ZINC000639683334 1046421475 /nfs/dbraw/zinc/42/14/75/1046421475.db2.gz CXZNOAMCERHYCS-GFCCVEGCSA-N 1 2 305.447 4.055 20 0 DIADLO CC(C)[N@H+](Cc1nc(CC2CC2)no1)[C@@H](C)c1ccsc1 ZINC000639683342 1046422805 /nfs/dbraw/zinc/42/28/05/1046422805.db2.gz CXZNOAMCERHYCS-LBPRGKRZSA-N 1 2 305.447 4.055 20 0 DIADLO CC(C)[N@@H+](Cc1nc(CC2CC2)no1)[C@@H](C)c1ccsc1 ZINC000639683342 1046422808 /nfs/dbraw/zinc/42/28/08/1046422808.db2.gz CXZNOAMCERHYCS-LBPRGKRZSA-N 1 2 305.447 4.055 20 0 DIADLO Cc1cn2c(cccc2NC(=O)Nc2ccc(C(C)C)cc2)[nH+]1 ZINC001202917105 1046424425 /nfs/dbraw/zinc/42/44/25/1046424425.db2.gz ARLCWDJKBMQNKG-UHFFFAOYSA-N 1 2 308.385 4.410 20 0 DIADLO O=C(Nc1cccc(C2CCCCC2)c1)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC001168215460 1046424579 /nfs/dbraw/zinc/42/45/79/1046424579.db2.gz FXJXLWBBSTXWEE-IAGOWNOFSA-N 1 2 309.413 4.200 20 0 DIADLO O=C(Nc1cccc(C2CCCCC2)c1)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC001168215460 1046424583 /nfs/dbraw/zinc/42/45/83/1046424583.db2.gz FXJXLWBBSTXWEE-IAGOWNOFSA-N 1 2 309.413 4.200 20 0 DIADLO COc1ccc(-c2ccc(C[N@@H+]3Cc4ccncc4C3)s2)cc1 ZINC001139287773 1046426246 /nfs/dbraw/zinc/42/62/46/1046426246.db2.gz QZPRUUFZEDFWSH-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO COc1ccc(-c2ccc(C[N@H+]3Cc4ccncc4C3)s2)cc1 ZINC001139287773 1046426254 /nfs/dbraw/zinc/42/62/54/1046426254.db2.gz QZPRUUFZEDFWSH-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@@H](Cc2ccccc2)c2ncco2)c(C)n1 ZINC000639751834 1046426997 /nfs/dbraw/zinc/42/69/97/1046426997.db2.gz XDYWGRUDAYUXEY-IBGZPJMESA-N 1 2 321.424 4.068 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@H](Cc2ccccc2)c2ncco2)c(C)n1 ZINC000639751835 1046427719 /nfs/dbraw/zinc/42/77/19/1046427719.db2.gz XDYWGRUDAYUXEY-LJQANCHMSA-N 1 2 321.424 4.068 20 0 DIADLO COc1ccc2cc(C[N@@H+]3C[C@@H](C)C[C@H]3CF)c(Cl)nc2c1 ZINC001139310892 1046429711 /nfs/dbraw/zinc/42/97/11/1046429711.db2.gz VXPCSCMKTJNXNJ-FZMZJTMJSA-N 1 2 322.811 4.077 20 0 DIADLO COc1ccc2cc(C[N@H+]3C[C@@H](C)C[C@H]3CF)c(Cl)nc2c1 ZINC001139310892 1046429713 /nfs/dbraw/zinc/42/97/13/1046429713.db2.gz VXPCSCMKTJNXNJ-FZMZJTMJSA-N 1 2 322.811 4.077 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2coc(-c3ccccc3F)n2)s1 ZINC000639996482 1046442004 /nfs/dbraw/zinc/44/20/04/1046442004.db2.gz KZGUDCGTKCSJSV-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1nc(C2CCCC2)no1 ZINC000676889193 1046444997 /nfs/dbraw/zinc/44/49/97/1046444997.db2.gz OTCUAVRXKSNACD-KRWDZBQOSA-N 1 2 311.429 4.237 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1nc(C2CCCC2)no1 ZINC000676889193 1046445001 /nfs/dbraw/zinc/44/50/01/1046445001.db2.gz OTCUAVRXKSNACD-KRWDZBQOSA-N 1 2 311.429 4.237 20 0 DIADLO Cc1cc(C)c(NC(=O)NC23CC(c4ccccc4)(C2)C3)c(C)[nH+]1 ZINC000640141982 1046450241 /nfs/dbraw/zinc/45/02/41/1046450241.db2.gz KVEUXSXFQBXKDI-UHFFFAOYSA-N 1 2 321.424 4.003 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(Cl)ccnc2Cl)CCC1(F)F ZINC001139475019 1046452459 /nfs/dbraw/zinc/45/24/59/1046452459.db2.gz LYMWKUCCTUZICA-SECBINFHSA-N 1 2 309.187 4.256 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(Cl)ccnc2Cl)CCC1(F)F ZINC001139475019 1046452461 /nfs/dbraw/zinc/45/24/61/1046452461.db2.gz LYMWKUCCTUZICA-SECBINFHSA-N 1 2 309.187 4.256 20 0 DIADLO C[N@H+](CCc1ccccc1F)Cc1c(Cl)ccnc1Cl ZINC001139481836 1046454079 /nfs/dbraw/zinc/45/40/79/1046454079.db2.gz MJLIDKRXXJHVFP-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1ccccc1F)Cc1c(Cl)ccnc1Cl ZINC001139481836 1046454084 /nfs/dbraw/zinc/45/40/84/1046454084.db2.gz MJLIDKRXXJHVFP-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1ccc(F)cc1Br ZINC000042375732 1046458101 /nfs/dbraw/zinc/45/81/01/1046458101.db2.gz JRYOTOBDYMDKCB-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1ccc(F)cc1Br ZINC000042375732 1046458102 /nfs/dbraw/zinc/45/81/02/1046458102.db2.gz JRYOTOBDYMDKCB-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2ccc(-c3ccsc3)nc2)C[C@@H]1F ZINC001139501518 1046458109 /nfs/dbraw/zinc/45/81/09/1046458109.db2.gz UBPWCJMJSHZHNY-JKSUJKDBSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2ccc(-c3ccsc3)nc2)C[C@@H]1F ZINC001139501518 1046458110 /nfs/dbraw/zinc/45/81/10/1046458110.db2.gz UBPWCJMJSHZHNY-JKSUJKDBSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@@H]1CC[C@]2(CC[N@H+](Cn3nc(C4CC4)sc3=S)C2)C1 ZINC000781588961 1046459138 /nfs/dbraw/zinc/45/91/38/1046459138.db2.gz YWOBZSQOUWNPOY-ABAIWWIYSA-N 1 2 309.504 4.021 20 0 DIADLO C[C@@H]1CC[C@]2(CC[N@@H+](Cn3nc(C4CC4)sc3=S)C2)C1 ZINC000781588961 1046459140 /nfs/dbraw/zinc/45/91/40/1046459140.db2.gz YWOBZSQOUWNPOY-ABAIWWIYSA-N 1 2 309.504 4.021 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2ccc(-c3ccccc3)nc2)C[C@H]1F ZINC001139520736 1046461276 /nfs/dbraw/zinc/46/12/76/1046461276.db2.gz PNXNFCUVSORYOG-QZTJIDSGSA-N 1 2 302.368 4.021 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2ccc(-c3ccccc3)nc2)C[C@H]1F ZINC001139520736 1046461285 /nfs/dbraw/zinc/46/12/85/1046461285.db2.gz PNXNFCUVSORYOG-QZTJIDSGSA-N 1 2 302.368 4.021 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2cccc(-c3cccnc3)c2)cs1 ZINC000125024953 1046462204 /nfs/dbraw/zinc/46/22/04/1046462204.db2.gz YYTPSTWBPJGLCO-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2cccc(-c3cccnc3)c2)cs1 ZINC000125024953 1046462208 /nfs/dbraw/zinc/46/22/08/1046462208.db2.gz YYTPSTWBPJGLCO-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO CCc1ccc(NC(=O)N[C@@H](C)c2c[nH+]c3c(C)cccn23)cc1 ZINC001202946210 1046468398 /nfs/dbraw/zinc/46/83/98/1046468398.db2.gz LVXQODJUKODKII-AWEZNQCLSA-N 1 2 322.412 4.088 20 0 DIADLO CC(C)(CCC(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000677145931 1046469378 /nfs/dbraw/zinc/46/93/78/1046469378.db2.gz GNFVDDLKQWLLQF-UHFFFAOYSA-N 1 2 307.397 4.031 20 0 DIADLO c1nc(-c2ccccc2)[nH]c1C[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001139555560 1046470119 /nfs/dbraw/zinc/47/01/19/1046470119.db2.gz LXBLEEDDSOUNBB-IBGZPJMESA-N 1 2 318.424 4.199 20 0 DIADLO c1nc(-c2ccccc2)[nH]c1C[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001139555560 1046470125 /nfs/dbraw/zinc/47/01/25/1046470125.db2.gz LXBLEEDDSOUNBB-IBGZPJMESA-N 1 2 318.424 4.199 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1c[nH]c(-c2ccccc2)n1 ZINC001139555421 1046470266 /nfs/dbraw/zinc/47/02/66/1046470266.db2.gz WIRKRIGDIVIGFA-OAHLLOKOSA-N 1 2 321.424 4.278 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1c[nH]c(-c2ccccc2)n1 ZINC001139555421 1046470271 /nfs/dbraw/zinc/47/02/71/1046470271.db2.gz WIRKRIGDIVIGFA-OAHLLOKOSA-N 1 2 321.424 4.278 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC001139555421 1046470276 /nfs/dbraw/zinc/47/02/76/1046470276.db2.gz WIRKRIGDIVIGFA-OAHLLOKOSA-N 1 2 321.424 4.278 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC001139555421 1046470281 /nfs/dbraw/zinc/47/02/81/1046470281.db2.gz WIRKRIGDIVIGFA-OAHLLOKOSA-N 1 2 321.424 4.278 20 0 DIADLO Cc1cc(C)c(NC(=O)Nc2ccccc2-n2cc[nH+]c2)c(C)c1 ZINC001202949125 1046474814 /nfs/dbraw/zinc/47/48/14/1046474814.db2.gz YNAQIHVVOUJITC-UHFFFAOYSA-N 1 2 320.396 4.442 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccccc2-c2ccccc2Cl)CCC1=O ZINC001139576219 1046477152 /nfs/dbraw/zinc/47/71/52/1046477152.db2.gz RPIQFLXDDWHEHP-CQSZACIVSA-N 1 2 313.828 4.418 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccccc2-c2ccccc2Cl)CCC1=O ZINC001139576219 1046477156 /nfs/dbraw/zinc/47/71/56/1046477156.db2.gz RPIQFLXDDWHEHP-CQSZACIVSA-N 1 2 313.828 4.418 20 0 DIADLO Cc1cnc(Cl)c(C[N@@H+]2CCCC[C@H]2c2cccnc2)c1 ZINC001139590646 1046478228 /nfs/dbraw/zinc/47/82/28/1046478228.db2.gz XHLGGMWAXKNDFN-INIZCTEOSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1cnc(Cl)c(C[N@H+]2CCCC[C@H]2c2cccnc2)c1 ZINC001139590646 1046478231 /nfs/dbraw/zinc/47/82/31/1046478231.db2.gz XHLGGMWAXKNDFN-INIZCTEOSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1cnc(Cl)c(C[N@@H+]2CCC[C@@H]2c2ccc(C)nc2)c1 ZINC001139595351 1046480462 /nfs/dbraw/zinc/48/04/62/1046480462.db2.gz LPDZXBOGRRNXRP-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cnc(Cl)c(C[N@H+]2CCC[C@@H]2c2ccc(C)nc2)c1 ZINC001139595351 1046480470 /nfs/dbraw/zinc/48/04/70/1046480470.db2.gz LPDZXBOGRRNXRP-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO CCOc1ccc(C[N@H+](C)CC(=O)c2ccccc2)cc1Cl ZINC001139598273 1046482837 /nfs/dbraw/zinc/48/28/37/1046482837.db2.gz RBEYCSOQFJVRRO-UHFFFAOYSA-N 1 2 317.816 4.053 20 0 DIADLO CCOc1ccc(C[N@@H+](C)CC(=O)c2ccccc2)cc1Cl ZINC001139598273 1046482841 /nfs/dbraw/zinc/48/28/41/1046482841.db2.gz RBEYCSOQFJVRRO-UHFFFAOYSA-N 1 2 317.816 4.053 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)Cc1cnc(C2CCCC2)s1 ZINC000091812572 1046483699 /nfs/dbraw/zinc/48/36/99/1046483699.db2.gz IGUAOEGYTFMMLK-UHFFFAOYSA-N 1 2 305.447 4.038 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)Cc1cnc(C2CCCC2)s1 ZINC000091812572 1046483701 /nfs/dbraw/zinc/48/37/01/1046483701.db2.gz IGUAOEGYTFMMLK-UHFFFAOYSA-N 1 2 305.447 4.038 20 0 DIADLO CCOc1ccc(C)cc1C[N@H+](C)Cc1nc2ccccc2o1 ZINC001139607069 1046484228 /nfs/dbraw/zinc/48/42/28/1046484228.db2.gz FUJGGPMBBKLYDJ-UHFFFAOYSA-N 1 2 310.397 4.167 20 0 DIADLO CCOc1ccc(C)cc1C[N@@H+](C)Cc1nc2ccccc2o1 ZINC001139607069 1046484233 /nfs/dbraw/zinc/48/42/33/1046484233.db2.gz FUJGGPMBBKLYDJ-UHFFFAOYSA-N 1 2 310.397 4.167 20 0 DIADLO COc1cc(C[N@H+](C)Cc2cccc(F)c2F)ccc1Cl ZINC001139616097 1046486694 /nfs/dbraw/zinc/48/66/94/1046486694.db2.gz ZBFCEIXHFOSZCZ-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2cccc(F)c2F)ccc1Cl ZINC001139616097 1046486695 /nfs/dbraw/zinc/48/66/95/1046486695.db2.gz ZBFCEIXHFOSZCZ-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CCCCC[C@H](C(=O)N1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1)C(C)C ZINC000247544639 1046488954 /nfs/dbraw/zinc/48/89/54/1046488954.db2.gz KDURGXDOLPKHOO-SQNIBIBYSA-N 1 2 319.493 4.145 20 0 DIADLO CCOc1ccc(C[N@@H+]2Cc3cccc(OC)c3C2)cc1CC ZINC001139625922 1046490719 /nfs/dbraw/zinc/49/07/19/1046490719.db2.gz KKFVZLOYQPRAAL-UHFFFAOYSA-N 1 2 311.425 4.172 20 0 DIADLO CCOc1ccc(C[N@H+]2Cc3cccc(OC)c3C2)cc1CC ZINC001139625922 1046490725 /nfs/dbraw/zinc/49/07/25/1046490725.db2.gz KKFVZLOYQPRAAL-UHFFFAOYSA-N 1 2 311.425 4.172 20 0 DIADLO Cc1oncc1C[N@@H+]1CCC[C@H]1c1ccc(Br)cc1 ZINC000128337841 1046493047 /nfs/dbraw/zinc/49/30/47/1046493047.db2.gz NGHHWVRYNIJHAR-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1oncc1C[N@H+]1CCC[C@H]1c1ccc(Br)cc1 ZINC000128337841 1046493055 /nfs/dbraw/zinc/49/30/55/1046493055.db2.gz NGHHWVRYNIJHAR-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000247678746 1046494207 /nfs/dbraw/zinc/49/42/07/1046494207.db2.gz ROHFCJBUDXCPPZ-BZSNNMDCSA-N 1 2 319.493 4.289 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1ncc(C(C)C)o1)[C@@H]2C ZINC000782096780 1046494556 /nfs/dbraw/zinc/49/45/56/1046494556.db2.gz GCCDTRFZCMETTG-UONOGXRCSA-N 1 2 314.429 4.314 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1ncc(C(C)C)o1)[C@@H]2C ZINC000782096780 1046494560 /nfs/dbraw/zinc/49/45/60/1046494560.db2.gz GCCDTRFZCMETTG-UONOGXRCSA-N 1 2 314.429 4.314 20 0 DIADLO CN(C)c1cc(CSC2=Nc3ccccc3CS2)cc[nH+]1 ZINC000782112422 1046495391 /nfs/dbraw/zinc/49/53/91/1046495391.db2.gz QMOANELTNGHZIP-UHFFFAOYSA-N 1 2 315.467 4.315 20 0 DIADLO Cc1cc(C)c(NC(=O)Nc2cccc(-n3cc[nH+]c3)c2)c(C)c1 ZINC001202957165 1046495318 /nfs/dbraw/zinc/49/53/18/1046495318.db2.gz FWFFVGVZRRWJJL-UHFFFAOYSA-N 1 2 320.396 4.442 20 0 DIADLO Cc1nc(SCc2ccc[nH+]c2N)n(C2CCCCC2)c1C ZINC000641425585 1046495664 /nfs/dbraw/zinc/49/56/64/1046495664.db2.gz KOHYODSAJIPGPL-UHFFFAOYSA-N 1 2 316.474 4.275 20 0 DIADLO Cc1nc(NC[C@H](C)c2nc3ccccc3o2)c2c([nH+]1)CCCC2 ZINC000782147911 1046496154 /nfs/dbraw/zinc/49/61/54/1046496154.db2.gz GLAHJBODBDTSNM-LBPRGKRZSA-N 1 2 322.412 4.021 20 0 DIADLO Fc1ccccc1C1CC[NH+](Cc2ccnc(Cl)c2F)CC1 ZINC001139663731 1046496353 /nfs/dbraw/zinc/49/63/53/1046496353.db2.gz WUKGBHYGVSNSCQ-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000188734661 1046499554 /nfs/dbraw/zinc/49/95/54/1046499554.db2.gz GEWAPQIUJMNPDN-LLVKDONJSA-N 1 2 308.422 4.265 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@H](C)c2ccc(OC(F)F)cc2)cs1 ZINC000130022037 1046508769 /nfs/dbraw/zinc/50/87/69/1046508769.db2.gz AIHORUAEGWDPGE-SNVBAGLBSA-N 1 2 312.385 4.246 20 0 DIADLO Cc1nc(C[N@H+](C)[C@H](C)c2ccc(OC(F)F)cc2)cs1 ZINC000130022037 1046508779 /nfs/dbraw/zinc/50/87/79/1046508779.db2.gz AIHORUAEGWDPGE-SNVBAGLBSA-N 1 2 312.385 4.246 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@@H](C)c1ccncc1)c1ccco1 ZINC000130729083 1046514181 /nfs/dbraw/zinc/51/41/81/1046514181.db2.gz UFEGSDBKVAJUCM-LIRRHRJNSA-N 1 2 308.381 4.123 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1nc2c(s1)C[C@H](C)CC2 ZINC000093315771 1046517270 /nfs/dbraw/zinc/51/72/70/1046517270.db2.gz VQUWSPIMPCXQJB-OLZOCXBDSA-N 1 2 316.470 4.167 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1nc2c(s1)C[C@H](C)CC2 ZINC000093315771 1046517277 /nfs/dbraw/zinc/51/72/77/1046517277.db2.gz VQUWSPIMPCXQJB-OLZOCXBDSA-N 1 2 316.470 4.167 20 0 DIADLO FC1(F)CC2(C[NH+](CCOc3ccc(Cl)cc3Cl)C2)C1 ZINC000677734655 1046517419 /nfs/dbraw/zinc/51/74/19/1046517419.db2.gz WRJIXUSPJHPSER-UHFFFAOYSA-N 1 2 322.182 4.103 20 0 DIADLO C[C@@H](c1ccccc1Br)[NH+]1CC2(C1)CC(F)(F)C2 ZINC000677733640 1046517783 /nfs/dbraw/zinc/51/77/83/1046517783.db2.gz VPBLHKGSZREUCQ-JTQLQIEISA-N 1 2 316.189 4.241 20 0 DIADLO Cc1cnc(C[NH+]2CCC(Oc3ccc(Cl)cc3)CC2)s1 ZINC001139808675 1046521093 /nfs/dbraw/zinc/52/10/93/1046521093.db2.gz BFIJNOAYFPYPCA-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO CCc1cc(OCc2noc3c2CCCC3)c2ccccc2[nH+]1 ZINC000677753009 1046522084 /nfs/dbraw/zinc/52/20/84/1046522084.db2.gz QHZVVBJMUGFJCB-UHFFFAOYSA-N 1 2 308.381 4.243 20 0 DIADLO Clc1oc2ccccc2c1C[NH2+]Cc1cn2ccccc2n1 ZINC000677749638 1046522309 /nfs/dbraw/zinc/52/23/09/1046522309.db2.gz MDUUJYOQCDKDLB-UHFFFAOYSA-N 1 2 311.772 4.024 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@@H]1Cc2ccc(Cl)cc21 ZINC001625981202 1046525101 /nfs/dbraw/zinc/52/51/01/1046525101.db2.gz FQCHAZQUJPCIRB-MRXNPFEDSA-N 1 2 323.783 4.009 20 0 DIADLO CCCc1nc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)cs1 ZINC000359874001 1046526568 /nfs/dbraw/zinc/52/65/68/1046526568.db2.gz MHKWAVUZNAYMLA-XJKSGUPXSA-N 1 2 301.459 4.074 20 0 DIADLO CCCc1nc(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)cs1 ZINC000359874001 1046526576 /nfs/dbraw/zinc/52/65/76/1046526576.db2.gz MHKWAVUZNAYMLA-XJKSGUPXSA-N 1 2 301.459 4.074 20 0 DIADLO Cn1c2ccccc2[nH+]c1NCc1nc(-c2ccccc2)cs1 ZINC000677805618 1046528208 /nfs/dbraw/zinc/52/82/08/1046528208.db2.gz DOGAXUAXTBBRHX-UHFFFAOYSA-N 1 2 320.421 4.309 20 0 DIADLO CCOC(=O)C[N@H+](C)Cc1cccc2c3ccccc3sc21 ZINC001139842818 1046529876 /nfs/dbraw/zinc/52/98/76/1046529876.db2.gz CJANEJDNJOOKHL-UHFFFAOYSA-N 1 2 313.422 4.049 20 0 DIADLO CCOC(=O)C[N@@H+](C)Cc1cccc2c3ccccc3sc21 ZINC001139842818 1046529881 /nfs/dbraw/zinc/52/98/81/1046529881.db2.gz CJANEJDNJOOKHL-UHFFFAOYSA-N 1 2 313.422 4.049 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C3(c4cccc(C)c4)CCC3)cc2[nH+]1 ZINC000641953435 1046530527 /nfs/dbraw/zinc/53/05/27/1046530527.db2.gz MMYUSXPAKANEJA-UHFFFAOYSA-N 1 2 319.408 4.240 20 0 DIADLO O=C1CCC[N@@H+](Cc2cccc3c4ccccc4oc32)C[C@H]1F ZINC001139857899 1046535480 /nfs/dbraw/zinc/53/54/80/1046535480.db2.gz RHVVRLGPLFRTTO-MRXNPFEDSA-N 1 2 311.356 4.089 20 0 DIADLO O=C1CCC[N@H+](Cc2cccc3c4ccccc4oc32)C[C@H]1F ZINC001139857899 1046535488 /nfs/dbraw/zinc/53/54/88/1046535488.db2.gz RHVVRLGPLFRTTO-MRXNPFEDSA-N 1 2 311.356 4.089 20 0 DIADLO Fc1ccc([C@@H]2COCC[N@@H+]2Cc2ccccc2C2CC2)cc1 ZINC001139883838 1046542236 /nfs/dbraw/zinc/54/22/36/1046542236.db2.gz KJYIUBQCRJEFEN-FQEVSTJZSA-N 1 2 311.400 4.277 20 0 DIADLO Fc1ccc([C@@H]2COCC[N@H+]2Cc2ccccc2C2CC2)cc1 ZINC001139883838 1046542250 /nfs/dbraw/zinc/54/22/50/1046542250.db2.gz KJYIUBQCRJEFEN-FQEVSTJZSA-N 1 2 311.400 4.277 20 0 DIADLO CC[C@@H](O)C[N@H+](Cc1csc(C(C)C)n1)Cc1ccccc1 ZINC000134491830 1046546651 /nfs/dbraw/zinc/54/66/51/1046546651.db2.gz WXCHVJBUXAGVEA-QGZVFWFLSA-N 1 2 318.486 4.040 20 0 DIADLO CC[C@@H](O)C[N@@H+](Cc1csc(C(C)C)n1)Cc1ccccc1 ZINC000134491830 1046546665 /nfs/dbraw/zinc/54/66/65/1046546665.db2.gz WXCHVJBUXAGVEA-QGZVFWFLSA-N 1 2 318.486 4.040 20 0 DIADLO Cc1cc(Oc2ccc(Nc3ccc(CCO)cc3)cc2)cc[nH+]1 ZINC001212931440 1046547439 /nfs/dbraw/zinc/54/74/39/1046547439.db2.gz CVYNOIKGJQGOPF-UHFFFAOYSA-N 1 2 320.392 4.461 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1cncc(Br)c1 ZINC000695239457 1046552025 /nfs/dbraw/zinc/55/20/25/1046552025.db2.gz JOBRDFCXTXGFLO-LLVKDONJSA-N 1 2 320.234 4.083 20 0 DIADLO FC(F)(F)c1ccccc1C1=CC[N@H+](Cc2nccs2)CC1 ZINC000135213155 1046552822 /nfs/dbraw/zinc/55/28/22/1046552822.db2.gz JDAUPOXZVULSOY-UHFFFAOYSA-N 1 2 324.371 4.451 20 0 DIADLO FC(F)(F)c1ccccc1C1=CC[N@@H+](Cc2nccs2)CC1 ZINC000135213155 1046552832 /nfs/dbraw/zinc/55/28/32/1046552832.db2.gz JDAUPOXZVULSOY-UHFFFAOYSA-N 1 2 324.371 4.451 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccc(Cl)nc1 ZINC000179141307 1046553027 /nfs/dbraw/zinc/55/30/27/1046553027.db2.gz BJLOYBPYYDQVNW-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO Fc1ccc2c(c1)[nH]cc2C1=CC[N@H+](Cc2nccs2)CC1 ZINC000135173186 1046553810 /nfs/dbraw/zinc/55/38/10/1046553810.db2.gz LIERNOAXVVFQFX-UHFFFAOYSA-N 1 2 313.401 4.053 20 0 DIADLO Fc1ccc2c(c1)[nH]cc2C1=CC[N@@H+](Cc2nccs2)CC1 ZINC000135173186 1046553817 /nfs/dbraw/zinc/55/38/17/1046553817.db2.gz LIERNOAXVVFQFX-UHFFFAOYSA-N 1 2 313.401 4.053 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1n[nH]c2ccccc21 ZINC000678124804 1046557687 /nfs/dbraw/zinc/55/76/87/1046557687.db2.gz JSGIYZYFHKHHBO-UHFFFAOYSA-N 1 2 305.834 4.300 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1n[nH]c2ccccc21 ZINC000678124804 1046557699 /nfs/dbraw/zinc/55/76/99/1046557699.db2.gz JSGIYZYFHKHHBO-UHFFFAOYSA-N 1 2 305.834 4.300 20 0 DIADLO C[N@H+](Cc1n[nH]c2ccccc21)Cc1ccccc1C(F)(F)F ZINC000678132050 1046560906 /nfs/dbraw/zinc/56/09/06/1046560906.db2.gz WJKQYNKTKRTGBU-UHFFFAOYSA-N 1 2 319.330 4.214 20 0 DIADLO C[N@@H+](Cc1n[nH]c2ccccc21)Cc1ccccc1C(F)(F)F ZINC000678132050 1046560919 /nfs/dbraw/zinc/56/09/19/1046560919.db2.gz WJKQYNKTKRTGBU-UHFFFAOYSA-N 1 2 319.330 4.214 20 0 DIADLO CC[N@@H+](Cc1cn2cccc(F)c2n1)Cc1ccc(Cl)s1 ZINC000678124867 1046562155 /nfs/dbraw/zinc/56/21/55/1046562155.db2.gz MCDUZMQQASHHSA-UHFFFAOYSA-N 1 2 323.824 4.210 20 0 DIADLO CC[N@H+](Cc1cn2cccc(F)c2n1)Cc1ccc(Cl)s1 ZINC000678124867 1046562170 /nfs/dbraw/zinc/56/21/70/1046562170.db2.gz MCDUZMQQASHHSA-UHFFFAOYSA-N 1 2 323.824 4.210 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1[nH]nc2ccccc21 ZINC000678136384 1046565711 /nfs/dbraw/zinc/56/57/11/1046565711.db2.gz HCCFLIYCPWCSCO-LLVKDONJSA-N 1 2 301.340 4.034 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1[nH]nc2ccccc21 ZINC000678136384 1046565724 /nfs/dbraw/zinc/56/57/24/1046565724.db2.gz HCCFLIYCPWCSCO-LLVKDONJSA-N 1 2 301.340 4.034 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1ccccc1-c1cncnc1)C2 ZINC001140021598 1046572496 /nfs/dbraw/zinc/57/24/96/1046572496.db2.gz XLJILIVKHLALLE-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1ccccc1-c1cncnc1)C2 ZINC001140021598 1046572504 /nfs/dbraw/zinc/57/25/04/1046572504.db2.gz XLJILIVKHLALLE-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO CN(CCO)c1ccc([NH2+][C@@H]2CC[C@@](C)(c3ccccc3)C2)cc1 ZINC000783280091 1046573607 /nfs/dbraw/zinc/57/36/07/1046573607.db2.gz IXFIJSBXHDFBFV-TZIWHRDSSA-N 1 2 324.468 4.037 20 0 DIADLO CSc1nccc(C[N@@H+]2CCCC[C@H]2c2ccccc2F)n1 ZINC001140037840 1046575835 /nfs/dbraw/zinc/57/58/35/1046575835.db2.gz DXSLEXDABRSWDM-INIZCTEOSA-N 1 2 317.433 4.065 20 0 DIADLO CSc1nccc(C[N@H+]2CCCC[C@H]2c2ccccc2F)n1 ZINC001140037840 1046575852 /nfs/dbraw/zinc/57/58/52/1046575852.db2.gz DXSLEXDABRSWDM-INIZCTEOSA-N 1 2 317.433 4.065 20 0 DIADLO CC1(C)CC[NH+](Cc2cnc(Br)cc2Cl)CC1 ZINC001140077393 1046582015 /nfs/dbraw/zinc/58/20/15/1046582015.db2.gz CHUYNCBCLRWPNL-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO COc1ccc2[nH]nc(C[N@H+](Cc3ccccc3)C3CCC3)c2c1 ZINC001140070612 1046583214 /nfs/dbraw/zinc/58/32/14/1046583214.db2.gz LFDGLHPQCVPMQD-UHFFFAOYSA-N 1 2 321.424 4.126 20 0 DIADLO COc1ccc2[nH]nc(C[N@@H+](Cc3ccccc3)C3CCC3)c2c1 ZINC001140070612 1046583229 /nfs/dbraw/zinc/58/32/29/1046583229.db2.gz LFDGLHPQCVPMQD-UHFFFAOYSA-N 1 2 321.424 4.126 20 0 DIADLO c1cc2cccc(C[N@@H+]3CCCC[C@@H]3c3noc(C4CC4)n3)c2[nH]1 ZINC000678203067 1046583433 /nfs/dbraw/zinc/58/34/33/1046583433.db2.gz NGKGWSCEIKDWSP-MRXNPFEDSA-N 1 2 322.412 4.156 20 0 DIADLO c1cc2cccc(C[N@H+]3CCCC[C@@H]3c3noc(C4CC4)n3)c2[nH]1 ZINC000678203067 1046583442 /nfs/dbraw/zinc/58/34/42/1046583442.db2.gz NGKGWSCEIKDWSP-MRXNPFEDSA-N 1 2 322.412 4.156 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@H+]1Cc1cc(-c2ccccc2)n[nH]1 ZINC000678196830 1046585072 /nfs/dbraw/zinc/58/50/72/1046585072.db2.gz JNPMAZODZFMLNZ-HNNXBMFYSA-N 1 2 319.408 4.032 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1cc(-c2ccccc2)n[nH]1 ZINC000678196830 1046585086 /nfs/dbraw/zinc/58/50/86/1046585086.db2.gz JNPMAZODZFMLNZ-HNNXBMFYSA-N 1 2 319.408 4.032 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cnc(Br)cc2Cl)[C@@H]1C ZINC001140077709 1046585368 /nfs/dbraw/zinc/58/53/68/1046585368.db2.gz MVJYTEYJCXTPFU-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cnc(Br)cc2Cl)[C@@H]1C ZINC001140077709 1046585379 /nfs/dbraw/zinc/58/53/79/1046585379.db2.gz MVJYTEYJCXTPFU-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO COc1cccc2cc(C(=O)Nc3c(C)cc(C)[nH+]c3C)oc21 ZINC000642292956 1046590812 /nfs/dbraw/zinc/59/08/12/1046590812.db2.gz ILOGDKFFZWWKSM-UHFFFAOYSA-N 1 2 310.353 4.014 20 0 DIADLO c1cc(C[N@@H+]2CCCC[C@@H]2c2nc(-c3ccccc3)no2)co1 ZINC000093005216 1046600893 /nfs/dbraw/zinc/60/08/93/1046600893.db2.gz WSWQXFUGSBODPK-MRXNPFEDSA-N 1 2 309.369 4.057 20 0 DIADLO c1cc(C[N@H+]2CCCC[C@@H]2c2nc(-c3ccccc3)no2)co1 ZINC000093005216 1046600899 /nfs/dbraw/zinc/60/08/99/1046600899.db2.gz WSWQXFUGSBODPK-MRXNPFEDSA-N 1 2 309.369 4.057 20 0 DIADLO Cc1ccc2cc(C[N@@H+](C)C3CC(F)(F)C3)c(Cl)nc2c1 ZINC001138858507 1046600910 /nfs/dbraw/zinc/60/09/10/1046600910.db2.gz KAJAZBJDVIQZFC-UHFFFAOYSA-N 1 2 310.775 4.426 20 0 DIADLO Cc1ccc2cc(C[N@H+](C)C3CC(F)(F)C3)c(Cl)nc2c1 ZINC001138858507 1046600913 /nfs/dbraw/zinc/60/09/13/1046600913.db2.gz KAJAZBJDVIQZFC-UHFFFAOYSA-N 1 2 310.775 4.426 20 0 DIADLO FC(F)(F)c1cccnc1C[N@@H+]1CCCc2sccc2C1 ZINC000678259220 1046601770 /nfs/dbraw/zinc/60/17/70/1046601770.db2.gz GJRDZHRARSFCFH-UHFFFAOYSA-N 1 2 312.360 4.110 20 0 DIADLO FC(F)(F)c1cccnc1C[N@H+]1CCCc2sccc2C1 ZINC000678259220 1046601779 /nfs/dbraw/zinc/60/17/79/1046601779.db2.gz GJRDZHRARSFCFH-UHFFFAOYSA-N 1 2 312.360 4.110 20 0 DIADLO OCCCC[N@H+](Cc1c(Cl)ccc(Cl)c1Cl)C1CC1 ZINC000678263521 1046604513 /nfs/dbraw/zinc/60/45/13/1046604513.db2.gz JVNYTGIMHCRTGF-UHFFFAOYSA-N 1 2 322.663 4.384 20 0 DIADLO OCCCC[N@@H+](Cc1c(Cl)ccc(Cl)c1Cl)C1CC1 ZINC000678263521 1046604519 /nfs/dbraw/zinc/60/45/19/1046604519.db2.gz JVNYTGIMHCRTGF-UHFFFAOYSA-N 1 2 322.663 4.384 20 0 DIADLO Cc1ncc(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)n1-c1ccccc1 ZINC000678284089 1046611102 /nfs/dbraw/zinc/61/11/02/1046611102.db2.gz UUBCPCCPCGYBCM-HXUWFJFHSA-N 1 2 321.399 4.267 20 0 DIADLO Cc1ncc(C[N@H+]2CC[C@@H]2c2cccc(F)c2)n1-c1ccccc1 ZINC000678284089 1046611106 /nfs/dbraw/zinc/61/11/06/1046611106.db2.gz UUBCPCCPCGYBCM-HXUWFJFHSA-N 1 2 321.399 4.267 20 0 DIADLO Cc1[nH+]cc(CN2CC[C@@H]2c2cccc(F)c2)n1-c1ccccc1 ZINC000678284089 1046611114 /nfs/dbraw/zinc/61/11/14/1046611114.db2.gz UUBCPCCPCGYBCM-HXUWFJFHSA-N 1 2 321.399 4.267 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3ccccc3s2)C[C@@H](C(F)(F)F)O1 ZINC000678282365 1046611382 /nfs/dbraw/zinc/61/13/82/1046611382.db2.gz ZRCAQQUXWGJZHA-HZMBPMFUSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3ccccc3s2)C[C@@H](C(F)(F)F)O1 ZINC000678282365 1046611391 /nfs/dbraw/zinc/61/13/91/1046611391.db2.gz ZRCAQQUXWGJZHA-HZMBPMFUSA-N 1 2 315.360 4.053 20 0 DIADLO Cc1cnc(C[N@H+]2CCS[C@H](C)[C@H]2c2ccccc2)s1 ZINC000245539359 1046611454 /nfs/dbraw/zinc/61/14/54/1046611454.db2.gz NUZCRNCTMOLPLP-CJNGLKHVSA-N 1 2 304.484 4.130 20 0 DIADLO Cc1cnc(C[N@@H+]2CCS[C@H](C)[C@H]2c2ccccc2)s1 ZINC000245539359 1046611464 /nfs/dbraw/zinc/61/14/64/1046611464.db2.gz NUZCRNCTMOLPLP-CJNGLKHVSA-N 1 2 304.484 4.130 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cn3cccc(F)c3n2)[C@H](c2ccco2)C1 ZINC000678285961 1046613469 /nfs/dbraw/zinc/61/34/69/1046613469.db2.gz QXESUJCTLADFEG-CJNGLKHVSA-N 1 2 313.376 4.040 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cn3cccc(F)c3n2)[C@H](c2ccco2)C1 ZINC000678285961 1046613472 /nfs/dbraw/zinc/61/34/72/1046613472.db2.gz QXESUJCTLADFEG-CJNGLKHVSA-N 1 2 313.376 4.040 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000678295141 1046615550 /nfs/dbraw/zinc/61/55/50/1046615550.db2.gz XLHWJISYRKOOFT-KRWDZBQOSA-N 1 2 305.805 4.123 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000678295141 1046615552 /nfs/dbraw/zinc/61/55/52/1046615552.db2.gz XLHWJISYRKOOFT-KRWDZBQOSA-N 1 2 305.805 4.123 20 0 DIADLO CCOc1cc[nH+]cc1Nc1ccc(OC)c(OC(C)C)c1 ZINC001203012443 1046615858 /nfs/dbraw/zinc/61/58/58/1046615858.db2.gz LFWWYXJJACCDCF-UHFFFAOYSA-N 1 2 302.374 4.020 20 0 DIADLO C[C@H]1CC[N@@H+]1Cc1cc(C(F)(F)F)ccc1Br ZINC001140217861 1046616860 /nfs/dbraw/zinc/61/68/60/1046616860.db2.gz ANZKMKPCZBVNKU-QMMMGPOBSA-N 1 2 308.141 4.062 20 0 DIADLO C[C@H]1CC[N@H+]1Cc1cc(C(F)(F)F)ccc1Br ZINC001140217861 1046616865 /nfs/dbraw/zinc/61/68/65/1046616865.db2.gz ANZKMKPCZBVNKU-QMMMGPOBSA-N 1 2 308.141 4.062 20 0 DIADLO COc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)cc1OC(C)C ZINC001203017605 1046624806 /nfs/dbraw/zinc/62/48/06/1046624806.db2.gz JMURECBROYIVQY-UHFFFAOYSA-N 1 2 323.396 4.412 20 0 DIADLO Cc1ccc(C)c([C@@H]([NH2+][C@@H]2CCn3ccnc32)c2ccccc2)c1 ZINC000834547366 1046628205 /nfs/dbraw/zinc/62/82/05/1046628205.db2.gz AXURUTFSRMGCKI-UXHICEINSA-N 1 2 317.436 4.324 20 0 DIADLO CC(C)c1noc(C[N@H+](Cc2cccc(F)c2)C2CCCC2)n1 ZINC000533027218 1046640235 /nfs/dbraw/zinc/64/02/35/1046640235.db2.gz AHDQSMXYARCCCR-UHFFFAOYSA-N 1 2 317.408 4.277 20 0 DIADLO CC(C)c1noc(C[N@@H+](Cc2cccc(F)c2)C2CCCC2)n1 ZINC000533027218 1046640243 /nfs/dbraw/zinc/64/02/43/1046640243.db2.gz AHDQSMXYARCCCR-UHFFFAOYSA-N 1 2 317.408 4.277 20 0 DIADLO C[C@@H](C(=O)Nc1cccc2ccccc21)[N@H+](C)CCC(F)(F)F ZINC000533034074 1046642057 /nfs/dbraw/zinc/64/20/57/1046642057.db2.gz SSSFRNXTNFSSSY-LBPRGKRZSA-N 1 2 324.346 4.051 20 0 DIADLO C[C@@H](C(=O)Nc1cccc2ccccc21)[N@@H+](C)CCC(F)(F)F ZINC000533034074 1046642059 /nfs/dbraw/zinc/64/20/59/1046642059.db2.gz SSSFRNXTNFSSSY-LBPRGKRZSA-N 1 2 324.346 4.051 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CCc3ccc([C@H]4C[C@@H]4C)o3)cc2[nH+]1 ZINC000643247969 1046651871 /nfs/dbraw/zinc/65/18/71/1046651871.db2.gz PQDJSFRSZOABFE-NHYWBVRUSA-N 1 2 323.396 4.159 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2c(F)c(F)cc(F)c2F)c(C)n1 ZINC000678594748 1046669213 /nfs/dbraw/zinc/66/92/13/1046669213.db2.gz HHAZLCKPYRXVSY-VIFPVBQESA-N 1 2 312.310 4.106 20 0 DIADLO CC(C)[N@H+](Cc1ccncn1)Cc1ccc(Cl)cc1Cl ZINC001140351474 1046670516 /nfs/dbraw/zinc/67/05/16/1046670516.db2.gz XMDVZFQZMHELHM-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO CC(C)[N@@H+](Cc1ccncn1)Cc1ccc(Cl)cc1Cl ZINC001140351474 1046670520 /nfs/dbraw/zinc/67/05/20/1046670520.db2.gz XMDVZFQZMHELHM-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO Cc1nn(C[N@@H+]2C[C@H](C)C[C@H]2c2ccccc2)c(=S)s1 ZINC000795744225 1046674604 /nfs/dbraw/zinc/67/46/04/1046674604.db2.gz LOHVZGRMNGSMOX-RISCZKNCSA-N 1 2 305.472 4.023 20 0 DIADLO Cc1nn(C[N@H+]2C[C@H](C)C[C@H]2c2ccccc2)c(=S)s1 ZINC000795744225 1046674611 /nfs/dbraw/zinc/67/46/11/1046674611.db2.gz LOHVZGRMNGSMOX-RISCZKNCSA-N 1 2 305.472 4.023 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2cc(Cl)sc2Cl)ncn1 ZINC000678605372 1046675556 /nfs/dbraw/zinc/67/55/56/1046675556.db2.gz PTDHUKSXQNOMOX-MRVPVSSYSA-N 1 2 302.230 4.004 20 0 DIADLO Cc1cccc(C[N@@H+](C)[C@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000533242782 1046675664 /nfs/dbraw/zinc/67/56/64/1046675664.db2.gz QSGSOOLUNQEMIE-MRXNPFEDSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1cccc(C[N@H+](C)[C@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000533242782 1046675673 /nfs/dbraw/zinc/67/56/73/1046675673.db2.gz QSGSOOLUNQEMIE-MRXNPFEDSA-N 1 2 321.424 4.162 20 0 DIADLO FC1(F)CCCC[N@H+](Cc2ccc(-c3ccccn3)cc2)C1 ZINC001140376618 1046677571 /nfs/dbraw/zinc/67/75/71/1046677571.db2.gz GCVHBRQRMMTGNR-UHFFFAOYSA-N 1 2 302.368 4.370 20 0 DIADLO FC1(F)CCCC[N@@H+](Cc2ccc(-c3ccccn3)cc2)C1 ZINC001140376618 1046677577 /nfs/dbraw/zinc/67/75/77/1046677577.db2.gz GCVHBRQRMMTGNR-UHFFFAOYSA-N 1 2 302.368 4.370 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@H]2CCn3ccnc32)c2cccc(F)c2)c1 ZINC000834830912 1046677614 /nfs/dbraw/zinc/67/76/14/1046677614.db2.gz HJHMHFHPAZZQQE-OALUTQOASA-N 1 2 321.399 4.155 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2cccc(OC(C)(C)C)n2)c(C)s1 ZINC000678610658 1046678643 /nfs/dbraw/zinc/67/86/43/1046678643.db2.gz RDSOFISMQMAWMP-LLVKDONJSA-N 1 2 319.474 4.183 20 0 DIADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2sc(NC(C)(C)C)nc2Cl)C1 ZINC001140392708 1046686075 /nfs/dbraw/zinc/68/60/75/1046686075.db2.gz YUFOTQWDSSESNA-UWVGGRQHSA-N 1 2 319.877 4.187 20 0 DIADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2sc(NC(C)(C)C)nc2Cl)C1 ZINC001140392708 1046686078 /nfs/dbraw/zinc/68/60/78/1046686078.db2.gz YUFOTQWDSSESNA-UWVGGRQHSA-N 1 2 319.877 4.187 20 0 DIADLO CC(C)(C)Nc1nc(Cl)c(C[NH+]2CCC(F)(F)CC2)s1 ZINC001140390047 1046686829 /nfs/dbraw/zinc/68/68/29/1046686829.db2.gz JIEPROBIAHFWNE-UHFFFAOYSA-N 1 2 323.840 4.238 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nc(-c3ccccc3C)no2)cc1 ZINC000678735183 1046690795 /nfs/dbraw/zinc/69/07/95/1046690795.db2.gz OWBPVSWYHFMDNH-OAHLLOKOSA-N 1 2 307.397 4.204 20 0 DIADLO C[C@H]([NH2+]Cc1noc2c1CCCC2)c1ccccc1OC(F)F ZINC000678737129 1046690920 /nfs/dbraw/zinc/69/09/20/1046690920.db2.gz KOSUYWPQNRPDKW-NSHDSACASA-N 1 2 322.355 4.006 20 0 DIADLO Fc1ccc(F)c([C@@H]2CCC[N@@H+]2Cc2[nH]nc3ccccc32)c1 ZINC001137348904 1046692967 /nfs/dbraw/zinc/69/29/67/1046692967.db2.gz WNTIVWGETPSGAQ-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc(F)c([C@@H]2CCC[N@H+]2Cc2[nH]nc3ccccc32)c1 ZINC001137348904 1046692971 /nfs/dbraw/zinc/69/29/71/1046692971.db2.gz WNTIVWGETPSGAQ-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc(F)c([C@@H]2CCC[N@@H+]2Cc2n[nH]c3ccccc32)c1 ZINC001137348904 1046692975 /nfs/dbraw/zinc/69/29/75/1046692975.db2.gz WNTIVWGETPSGAQ-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc(F)c([C@@H]2CCC[N@H+]2Cc2n[nH]c3ccccc32)c1 ZINC001137348904 1046692977 /nfs/dbraw/zinc/69/29/77/1046692977.db2.gz WNTIVWGETPSGAQ-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1c(Cl)cccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001203033942 1046698064 /nfs/dbraw/zinc/69/80/64/1046698064.db2.gz WTYQJACUNCDZDP-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO CCc1noc(C[NH2+][C@@H](c2oc3ccccc3c2C)C(C)C)n1 ZINC000678772690 1046698507 /nfs/dbraw/zinc/69/85/07/1046698507.db2.gz DNISRSBNCBORSQ-QGZVFWFLSA-N 1 2 313.401 4.174 20 0 DIADLO CCc1noc(C[NH2+][C@@H](CC(C)C)c2ccc(Cl)cc2)n1 ZINC000678784399 1046701340 /nfs/dbraw/zinc/70/13/40/1046701340.db2.gz UZUIWWBSMOHDKX-AWEZNQCLSA-N 1 2 307.825 4.162 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CCC[N@@H+]1Cc1[nH]nc2ccccc21 ZINC001137351056 1046702542 /nfs/dbraw/zinc/70/25/42/1046702542.db2.gz NIKYBTVMJZVHPZ-KRWDZBQOSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CCC[N@H+]1Cc1[nH]nc2ccccc21 ZINC001137351056 1046702557 /nfs/dbraw/zinc/70/25/57/1046702557.db2.gz NIKYBTVMJZVHPZ-KRWDZBQOSA-N 1 2 313.351 4.178 20 0 DIADLO CSc1cccc(C)c1NC(=O)NCc1c[nH+]c(C)cc1C ZINC000455144787 1046706598 /nfs/dbraw/zinc/70/65/98/1046706598.db2.gz FFZCYXIPWSDVQV-UHFFFAOYSA-N 1 2 315.442 4.050 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc2c(s1)CCC2 ZINC000678812990 1046708087 /nfs/dbraw/zinc/70/80/87/1046708087.db2.gz ZPYFKJAPAHLCLG-SNVBAGLBSA-N 1 2 308.397 4.103 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc2c(s1)CCC2 ZINC000678812990 1046708098 /nfs/dbraw/zinc/70/80/98/1046708098.db2.gz ZPYFKJAPAHLCLG-SNVBAGLBSA-N 1 2 308.397 4.103 20 0 DIADLO CCc1nc(C[NH2+][C@H](CC)c2cc(Cl)ccc2OC)co1 ZINC000834899472 1046709909 /nfs/dbraw/zinc/70/99/09/1046709909.db2.gz HLHKVFWSSSJKBR-CQSZACIVSA-N 1 2 308.809 4.140 20 0 DIADLO CCc1nn(C)cc1C[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC000678822544 1046711281 /nfs/dbraw/zinc/71/12/81/1046711281.db2.gz HKWBAIRVLKVMBD-UHFFFAOYSA-N 1 2 317.436 4.165 20 0 DIADLO Cc1ccoc1C[NH2+]Cc1c(Cl)cccc1OC(F)F ZINC000644431137 1046713009 /nfs/dbraw/zinc/71/30/09/1046713009.db2.gz SFPNMUCXSFPJKT-UHFFFAOYSA-N 1 2 301.720 4.133 20 0 DIADLO CCc1cnc(C[N@@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)o1 ZINC000533384706 1046713764 /nfs/dbraw/zinc/71/37/64/1046713764.db2.gz MLHQHDJOZKSJGA-SFHVURJKSA-N 1 2 309.413 4.446 20 0 DIADLO CCc1cnc(C[N@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)o1 ZINC000533384706 1046713779 /nfs/dbraw/zinc/71/37/79/1046713779.db2.gz MLHQHDJOZKSJGA-SFHVURJKSA-N 1 2 309.413 4.446 20 0 DIADLO F[C@H]1C[N@H+](Cc2c[nH]c3cccc(Cl)c23)CCCC1(F)F ZINC001140433257 1046723455 /nfs/dbraw/zinc/72/34/55/1046723455.db2.gz UDQFHUOHNNNFPV-ZDUSSCGKSA-N 1 2 316.754 4.391 20 0 DIADLO F[C@H]1C[N@@H+](Cc2c[nH]c3cccc(Cl)c23)CCCC1(F)F ZINC001140433257 1046723465 /nfs/dbraw/zinc/72/34/65/1046723465.db2.gz UDQFHUOHNNNFPV-ZDUSSCGKSA-N 1 2 316.754 4.391 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC[C@H]3CCCO[C@H]3C2)c1Cl ZINC001137354811 1046729252 /nfs/dbraw/zinc/72/92/52/1046729252.db2.gz RPNXOJGEDCZNDI-YGRLFVJLSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC[C@H]3CCCO[C@H]3C2)c1Cl ZINC001137354811 1046729268 /nfs/dbraw/zinc/72/92/68/1046729268.db2.gz RPNXOJGEDCZNDI-YGRLFVJLSA-N 1 2 318.219 4.133 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc(-c2cccnc2)cc1 ZINC000796778164 1046730280 /nfs/dbraw/zinc/73/02/80/1046730280.db2.gz GBAGMQVJTFRNET-AUUYWEPGSA-N 1 2 318.424 4.200 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1ccccc1-c1nccs1)C2 ZINC001140452944 1046731046 /nfs/dbraw/zinc/73/10/46/1046731046.db2.gz BIQFJMJZMWLPTK-UHFFFAOYSA-N 1 2 310.397 4.465 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1ccccc1-c1nccs1)C2 ZINC001140452944 1046731062 /nfs/dbraw/zinc/73/10/62/1046731062.db2.gz BIQFJMJZMWLPTK-UHFFFAOYSA-N 1 2 310.397 4.465 20 0 DIADLO C[C@H]([NH2+]Cc1ncccc1C(F)(F)F)c1cccc(F)c1F ZINC000678938400 1046739948 /nfs/dbraw/zinc/73/99/48/1046739948.db2.gz DMEUSSVKHGKRJF-VIFPVBQESA-N 1 2 316.273 4.229 20 0 DIADLO COc1cc(F)cc(C[N@@H+]2CCc3cccc(Cl)c3C2)c1 ZINC001140483897 1046743268 /nfs/dbraw/zinc/74/32/68/1046743268.db2.gz DAWZZCWQBDLXJQ-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(F)cc(C[N@H+]2CCc3cccc(Cl)c3C2)c1 ZINC001140483897 1046743278 /nfs/dbraw/zinc/74/32/78/1046743278.db2.gz DAWZZCWQBDLXJQ-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(F)cc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c1 ZINC001140484593 1046744243 /nfs/dbraw/zinc/74/42/43/1046744243.db2.gz VSKLTEJJAGUKKY-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)cc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)c1 ZINC001140484593 1046744259 /nfs/dbraw/zinc/74/42/59/1046744259.db2.gz VSKLTEJJAGUKKY-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO Clc1ccc(C[N@@H+]2CCC[C@@H]3C[C@@H]32)c(Br)c1 ZINC001140486292 1046746973 /nfs/dbraw/zinc/74/69/73/1046746973.db2.gz HDIGKFFMRSNAKJ-RNCFNFMXSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1ccc(C[N@H+]2CCC[C@@H]3C[C@@H]32)c(Br)c1 ZINC001140486292 1046746985 /nfs/dbraw/zinc/74/69/85/1046746985.db2.gz HDIGKFFMRSNAKJ-RNCFNFMXSA-N 1 2 300.627 4.087 20 0 DIADLO COC(=O)c1csc([C@@H](C)Nc2ccc([NH+](C)C)cc2C)c1 ZINC000796856716 1046747082 /nfs/dbraw/zinc/74/70/82/1046747082.db2.gz SKVFEMJSIZCJFL-GFCCVEGCSA-N 1 2 318.442 4.082 20 0 DIADLO C[N@H+](CCc1cccnc1)Cc1c(Cl)ccc(F)c1Cl ZINC001137358495 1046747481 /nfs/dbraw/zinc/74/74/81/1046747481.db2.gz QJBCATJETVBVHH-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1cccnc1)Cc1c(Cl)ccc(F)c1Cl ZINC001137358495 1046747489 /nfs/dbraw/zinc/74/74/89/1046747489.db2.gz QJBCATJETVBVHH-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[C@H](c1ccco1)[N@H+](Cc1nc2c(s1)CCCC2)C1CC1 ZINC000678972898 1046750818 /nfs/dbraw/zinc/75/08/18/1046750818.db2.gz XFWYBVMARUARAD-GFCCVEGCSA-N 1 2 302.443 4.341 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](Cc1nc2c(s1)CCCC2)C1CC1 ZINC000678972898 1046750835 /nfs/dbraw/zinc/75/08/35/1046750835.db2.gz XFWYBVMARUARAD-GFCCVEGCSA-N 1 2 302.443 4.341 20 0 DIADLO CC(C)(C)OCc1cc(C[NH2+]Cc2cccc(C3CC3)c2)no1 ZINC000421337456 1046762348 /nfs/dbraw/zinc/76/23/48/1046762348.db2.gz CIVRGBCDLUPUFW-UHFFFAOYSA-N 1 2 314.429 4.157 20 0 DIADLO CC[N@H+](Cc1ccnn1-c1ccccc1)Cc1ccccc1F ZINC001140528073 1046765820 /nfs/dbraw/zinc/76/58/20/1046765820.db2.gz LRGPDMMCNNEMFQ-UHFFFAOYSA-N 1 2 309.388 4.034 20 0 DIADLO CC[N@@H+](Cc1ccnn1-c1ccccc1)Cc1ccccc1F ZINC001140528073 1046765833 /nfs/dbraw/zinc/76/58/33/1046765833.db2.gz LRGPDMMCNNEMFQ-UHFFFAOYSA-N 1 2 309.388 4.034 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H](C(C)C)CC2)c(C)[nH+]1 ZINC000455468108 1046768712 /nfs/dbraw/zinc/76/87/12/1046768712.db2.gz GXWHYLKDCICDSS-MRXNPFEDSA-N 1 2 303.450 4.297 20 0 DIADLO CC[N@H+](Cc1ccc(OC)cc1)Cc1c(F)cc(F)cc1F ZINC001140535978 1046770366 /nfs/dbraw/zinc/77/03/66/1046770366.db2.gz JNPWQGSVNHTIFD-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)cc1)Cc1c(F)cc(F)cc1F ZINC001140535978 1046770382 /nfs/dbraw/zinc/77/03/82/1046770382.db2.gz JNPWQGSVNHTIFD-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1c(F)cc(F)cc1F)CCC2 ZINC001140535902 1046770522 /nfs/dbraw/zinc/77/05/22/1046770522.db2.gz HVETZBVEZJIAKR-UHFFFAOYSA-N 1 2 321.342 4.061 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1c(F)cc(F)cc1F)CCC2 ZINC001140535902 1046770535 /nfs/dbraw/zinc/77/05/35/1046770535.db2.gz HVETZBVEZJIAKR-UHFFFAOYSA-N 1 2 321.342 4.061 20 0 DIADLO COc1ccc2c(c1)CC[N@@H+](Cc1cc(F)cc(Cl)c1)C2 ZINC001140535488 1046770763 /nfs/dbraw/zinc/77/07/63/1046770763.db2.gz LYONXPZXIMUMIS-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc2c(c1)CC[N@H+](Cc1cc(F)cc(Cl)c1)C2 ZINC001140535488 1046770775 /nfs/dbraw/zinc/77/07/75/1046770775.db2.gz LYONXPZXIMUMIS-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Cc1cc(C)c(NC(=O)NC[C@H](C)Cc2cccs2)c(C)[nH+]1 ZINC000455497123 1046772349 /nfs/dbraw/zinc/77/23/49/1046772349.db2.gz PUAMFWQGXLHMNL-LLVKDONJSA-N 1 2 317.458 4.069 20 0 DIADLO CC[C@@H](CNC(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccccc1 ZINC000455491208 1046775002 /nfs/dbraw/zinc/77/50/02/1046775002.db2.gz YDFDEALUMNZQPA-INIZCTEOSA-N 1 2 311.429 4.322 20 0 DIADLO Cc1cc(C)c(NC(=O)NCCc2ccc(Cl)s2)c(C)[nH+]1 ZINC000455492084 1046775445 /nfs/dbraw/zinc/77/54/45/1046775445.db2.gz ZAOYUAKBZCELNB-UHFFFAOYSA-N 1 2 323.849 4.086 20 0 DIADLO Oc1cccc(C[NH2+]Cc2ccc(Cl)cc2F)c1Cl ZINC000645172533 1046775952 /nfs/dbraw/zinc/77/59/52/1046775952.db2.gz ISQJMZUDRINBBX-UHFFFAOYSA-N 1 2 300.160 4.128 20 0 DIADLO Oc1cccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1Br ZINC001140550891 1046776263 /nfs/dbraw/zinc/77/62/63/1046776263.db2.gz NNLLMPWGGDIJQR-CQSZACIVSA-N 1 2 318.214 4.102 20 0 DIADLO Oc1cccc(C[N@H+]2CC[C@@H]2c2ccccc2)c1Br ZINC001140550891 1046776274 /nfs/dbraw/zinc/77/62/74/1046776274.db2.gz NNLLMPWGGDIJQR-CQSZACIVSA-N 1 2 318.214 4.102 20 0 DIADLO Cc1cc(C)c(NC(=O)NC2(C(F)F)CCCCC2)c(C)[nH+]1 ZINC000455517784 1046777263 /nfs/dbraw/zinc/77/72/63/1046777263.db2.gz LEDHCOCCSRYKSF-UHFFFAOYSA-N 1 2 311.376 4.096 20 0 DIADLO Cc1c(F)cc(C[NH+]2CC3(C2)CCCC3)cc1Br ZINC001140551892 1046777311 /nfs/dbraw/zinc/77/73/11/1046777311.db2.gz NKBXCULUURMSCZ-UHFFFAOYSA-N 1 2 312.226 4.273 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C)[C@@H](C)c2ccccc2)c(C)[nH+]1 ZINC000455500062 1046777533 /nfs/dbraw/zinc/77/75/33/1046777533.db2.gz SRSOHEQROYJMOI-CABCVRRESA-N 1 2 311.429 4.321 20 0 DIADLO Cc1cc2nc(NCc3c[nH+]c4c(C)cccn34)oc2c(C)c1 ZINC000679122115 1046778263 /nfs/dbraw/zinc/77/82/63/1046778263.db2.gz NBHFHPPBIVFXIQ-UHFFFAOYSA-N 1 2 306.369 4.013 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)CCc2ccccc2C)c(C)[nH+]1 ZINC000455540555 1046784342 /nfs/dbraw/zinc/78/43/42/1046784342.db2.gz YQHOAQGNXKCEDX-UHFFFAOYSA-N 1 2 311.429 4.022 20 0 DIADLO Cc1cccc2c(C(=O)Nc3ccc(-c4[nH]cc[nH+]4)cc3)coc21 ZINC001625982075 1046785648 /nfs/dbraw/zinc/78/56/48/1046785648.db2.gz YEGHIKPFJOIUPQ-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO Cc1ccc([C@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)c(C)n1 ZINC000679152737 1046787533 /nfs/dbraw/zinc/78/75/33/1046787533.db2.gz GXVVVBYXEQOKPV-INIZCTEOSA-N 1 2 310.445 4.257 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2ncc[nH]2)c2cccs2)cc1 ZINC000067695720 1046788028 /nfs/dbraw/zinc/78/80/28/1046788028.db2.gz ZUMXTCVGEAXYKJ-HNNXBMFYSA-N 1 2 303.818 4.004 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1ncc(Cl)cc1Cl ZINC000679151051 1046788507 /nfs/dbraw/zinc/78/85/07/1046788507.db2.gz LWQTYXGUAIRTCX-SNVBAGLBSA-N 1 2 311.212 4.248 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1nc2ccccc2c(C)c1Cl ZINC000679186261 1046790165 /nfs/dbraw/zinc/79/01/65/1046790165.db2.gz GQXBONPHGSKTEG-GXTWGEPZSA-N 1 2 318.848 4.196 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1nc2ccccc2c(C)c1Cl ZINC000679186261 1046790172 /nfs/dbraw/zinc/79/01/72/1046790172.db2.gz GQXBONPHGSKTEG-GXTWGEPZSA-N 1 2 318.848 4.196 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cc(F)ccc3C)CCCCCC2)no1 ZINC000679203181 1046791768 /nfs/dbraw/zinc/79/17/68/1046791768.db2.gz UUOAFOKJXWDVJY-UHFFFAOYSA-N 1 2 317.408 4.165 20 0 DIADLO Cc1ccc(-c2nc(CC(=O)Nc3cc[nH+]c(C)c3)cs2)cc1 ZINC000070890672 1046793441 /nfs/dbraw/zinc/79/34/41/1046793441.db2.gz BJKSLIUZAPRXAI-UHFFFAOYSA-N 1 2 323.421 4.003 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccccc2C(C)C)o1 ZINC000070785907 1046793484 /nfs/dbraw/zinc/79/34/84/1046793484.db2.gz WRVPULHQBLYBAF-HNNXBMFYSA-N 1 2 314.429 4.170 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccccc2C(C)C)o1 ZINC000070785907 1046793493 /nfs/dbraw/zinc/79/34/93/1046793493.db2.gz WRVPULHQBLYBAF-HNNXBMFYSA-N 1 2 314.429 4.170 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc(Cl)c2C)o1 ZINC000070785903 1046793521 /nfs/dbraw/zinc/79/35/21/1046793521.db2.gz WRPMZRZKMDMBGF-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc(Cl)c2C)o1 ZINC000070785903 1046793532 /nfs/dbraw/zinc/79/35/32/1046793532.db2.gz WRPMZRZKMDMBGF-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO CCOCC1CC[NH+](Cc2cc(Cl)sc2Cl)CC1 ZINC001140589259 1046797748 /nfs/dbraw/zinc/79/77/48/1046797748.db2.gz GXGKZYHLUBQRAC-UHFFFAOYSA-N 1 2 308.274 4.303 20 0 DIADLO Cc1cccc([C@@H]2CCCN2C(=O)NCc2c[nH+]c(C)cc2C)c1 ZINC000455567445 1046800846 /nfs/dbraw/zinc/80/08/46/1046800846.db2.gz ZANWQWSPGAMBGL-IBGZPJMESA-N 1 2 323.440 4.054 20 0 DIADLO Clc1ccc(Cc2nc(C[N@H+]3CC=CCC3)cs2)cc1 ZINC000679322920 1046810232 /nfs/dbraw/zinc/81/02/32/1046810232.db2.gz GLMBRNSQGBIBQM-UHFFFAOYSA-N 1 2 304.846 4.149 20 0 DIADLO Clc1ccc(Cc2nc(C[N@@H+]3CC=CCC3)cs2)cc1 ZINC000679322920 1046810249 /nfs/dbraw/zinc/81/02/49/1046810249.db2.gz GLMBRNSQGBIBQM-UHFFFAOYSA-N 1 2 304.846 4.149 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nnc(-c3ccccc3)o2)[C@@H](c2ccco2)C1 ZINC000247707360 1046830708 /nfs/dbraw/zinc/83/07/08/1046830708.db2.gz ZGJBBDCYLIUSMV-GOEBONIOSA-N 1 2 323.396 4.303 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccccc3)o2)[C@@H](c2ccco2)C1 ZINC000247707360 1046830730 /nfs/dbraw/zinc/83/07/30/1046830730.db2.gz ZGJBBDCYLIUSMV-GOEBONIOSA-N 1 2 323.396 4.303 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2ncc(-c3ccccc3)o2)CC1 ZINC000645978935 1046835471 /nfs/dbraw/zinc/83/54/71/1046835471.db2.gz IFKXRBBOTTVAAH-UHFFFAOYSA-N 1 2 304.393 4.429 20 0 DIADLO Cc1ccccc1-c1noc(C[NH2+]C2(c3ccccc3C)CC2)n1 ZINC000645978969 1046837616 /nfs/dbraw/zinc/83/76/16/1046837616.db2.gz JWNHPNWDVUNOPE-UHFFFAOYSA-N 1 2 319.408 4.132 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]C2(c3cccc(F)c3)CCC2)cs1 ZINC000646003298 1046840017 /nfs/dbraw/zinc/84/00/17/1046840017.db2.gz ZYAIFZZHRSUWCG-GFCCVEGCSA-N 1 2 320.433 4.159 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2c(F)cccc2Cl)CC1 ZINC000645998350 1046840074 /nfs/dbraw/zinc/84/00/74/1046840074.db2.gz MCHFTMFULMBSHF-UHFFFAOYSA-N 1 2 305.780 4.267 20 0 DIADLO CC1=C[C@H](C)C[N@H+](Cc2ccc(Cl)nc2C(F)(F)F)C1 ZINC000797526530 1046844870 /nfs/dbraw/zinc/84/48/70/1046844870.db2.gz SWGFXIRDTJBAFS-VIFPVBQESA-N 1 2 304.743 4.152 20 0 DIADLO CC1=C[C@H](C)C[N@@H+](Cc2ccc(Cl)nc2C(F)(F)F)C1 ZINC000797526530 1046844890 /nfs/dbraw/zinc/84/48/90/1046844890.db2.gz SWGFXIRDTJBAFS-VIFPVBQESA-N 1 2 304.743 4.152 20 0 DIADLO CCCc1nc(C[NH2+]C2(c3ccccc3F)CCC2)cs1 ZINC000646026520 1046848359 /nfs/dbraw/zinc/84/83/59/1046848359.db2.gz SFCXMVMYNZVCEU-UHFFFAOYSA-N 1 2 304.434 4.404 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(F)cc2Cl)cc(Cl)n1 ZINC000797590720 1046858652 /nfs/dbraw/zinc/85/86/52/1046858652.db2.gz JXLJNRSLAWNLBJ-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(F)cc2Cl)cc(Cl)n1 ZINC000797590720 1046858677 /nfs/dbraw/zinc/85/86/77/1046858677.db2.gz JXLJNRSLAWNLBJ-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[N@@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646116851 1046859584 /nfs/dbraw/zinc/85/95/84/1046859584.db2.gz HJERXXJRSBAQJM-WMLDXEAASA-N 1 2 321.424 4.401 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[N@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646116851 1046859605 /nfs/dbraw/zinc/85/96/05/1046859605.db2.gz HJERXXJRSBAQJM-WMLDXEAASA-N 1 2 321.424 4.401 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccn(C2CCCC2)n1 ZINC000679540902 1046860292 /nfs/dbraw/zinc/86/02/92/1046860292.db2.gz IFZJYYZYVZWAET-STQMWFEESA-N 1 2 315.383 4.161 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccn(C2CCCC2)n1 ZINC000679540902 1046860310 /nfs/dbraw/zinc/86/03/10/1046860310.db2.gz IFZJYYZYVZWAET-STQMWFEESA-N 1 2 315.383 4.161 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cc(-c2ccco2)on1 ZINC000679539443 1046862314 /nfs/dbraw/zinc/86/23/14/1046862314.db2.gz AWXNPOABYUMDLA-GHMZBOCLSA-N 1 2 314.307 4.097 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cc(-c2ccco2)on1 ZINC000679539443 1046862339 /nfs/dbraw/zinc/86/23/39/1046862339.db2.gz AWXNPOABYUMDLA-GHMZBOCLSA-N 1 2 314.307 4.097 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2F)CCC1(F)F ZINC001140699602 1046862695 /nfs/dbraw/zinc/86/26/95/1046862695.db2.gz WKZUWTUAVFAMQK-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2F)CCC1(F)F ZINC001140699602 1046862713 /nfs/dbraw/zinc/86/27/13/1046862713.db2.gz WKZUWTUAVFAMQK-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO CC(C)c1nc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)cs1 ZINC000679542689 1046863960 /nfs/dbraw/zinc/86/39/60/1046863960.db2.gz BAXAUYXRBDCHAL-GHMZBOCLSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)cs1 ZINC000679542689 1046863981 /nfs/dbraw/zinc/86/39/81/1046863981.db2.gz BAXAUYXRBDCHAL-GHMZBOCLSA-N 1 2 306.397 4.429 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1csc(C2CC2)n1 ZINC000679540842 1046864670 /nfs/dbraw/zinc/86/46/70/1046864670.db2.gz HFCKKRDWYVMPNC-ONGXEEELSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1csc(C2CC2)n1 ZINC000679540842 1046864679 /nfs/dbraw/zinc/86/46/79/1046864679.db2.gz HFCKKRDWYVMPNC-ONGXEEELSA-N 1 2 304.381 4.183 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)Cc2ccccc2C)cs1 ZINC000076715813 1046865622 /nfs/dbraw/zinc/86/56/22/1046865622.db2.gz IJLPZPVWNXDSMQ-CQSZACIVSA-N 1 2 304.459 4.181 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)Cc2ccccc2C)cs1 ZINC000076715813 1046865650 /nfs/dbraw/zinc/86/56/50/1046865650.db2.gz IJLPZPVWNXDSMQ-CQSZACIVSA-N 1 2 304.459 4.181 20 0 DIADLO Cc1ccc(C2([NH2+]Cc3nc(CCC(C)C)no3)CCC2)cc1 ZINC000646131209 1046866678 /nfs/dbraw/zinc/86/66/78/1046866678.db2.gz DFAVBUQHYAYHHA-UHFFFAOYSA-N 1 2 313.445 4.136 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000679546301 1046867231 /nfs/dbraw/zinc/86/72/31/1046867231.db2.gz OOHYZROFSLAGAN-MNOVXSKESA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000679546301 1046867247 /nfs/dbraw/zinc/86/72/47/1046867247.db2.gz OOHYZROFSLAGAN-MNOVXSKESA-N 1 2 304.356 4.135 20 0 DIADLO Cc1nc(C[N@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)cs1 ZINC000076731869 1046867593 /nfs/dbraw/zinc/86/75/93/1046867593.db2.gz DCUBXVOYTLKZHS-BLLLJJGKSA-N 1 2 304.484 4.130 20 0 DIADLO Cc1nc(C[N@@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)cs1 ZINC000076731869 1046867611 /nfs/dbraw/zinc/86/76/11/1046867611.db2.gz DCUBXVOYTLKZHS-BLLLJJGKSA-N 1 2 304.484 4.130 20 0 DIADLO Cc1nc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)nc2ccccc12 ZINC000679549703 1046869931 /nfs/dbraw/zinc/86/99/31/1046869931.db2.gz YPHVJQJZHZZQEO-DGCLKSJQSA-N 1 2 323.362 4.101 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)nc2ccccc12 ZINC000679549703 1046869947 /nfs/dbraw/zinc/86/99/47/1046869947.db2.gz YPHVJQJZHZZQEO-DGCLKSJQSA-N 1 2 323.362 4.101 20 0 DIADLO C[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(Cl)c(Cl)c1 ZINC000393327950 1046871891 /nfs/dbraw/zinc/87/18/91/1046871891.db2.gz WFKXMLKIAZIJFF-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000077171030 1046877114 /nfs/dbraw/zinc/87/71/14/1046877114.db2.gz KBULLIZMFYFZNG-HNNXBMFYSA-N 1 2 313.426 4.377 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000077171030 1046877135 /nfs/dbraw/zinc/87/71/35/1046877135.db2.gz KBULLIZMFYFZNG-HNNXBMFYSA-N 1 2 313.426 4.377 20 0 DIADLO Cc1ccc(Br)c(C[N@@H+]2CCC[C@@](C)(F)C2)c1 ZINC001137382363 1046883004 /nfs/dbraw/zinc/88/30/04/1046883004.db2.gz TWCRGTWYXZNZPI-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1ccc(Br)c(C[N@H+]2CCC[C@@](C)(F)C2)c1 ZINC001137382363 1046883016 /nfs/dbraw/zinc/88/30/16/1046883016.db2.gz TWCRGTWYXZNZPI-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCCC[C@@H]2C2CCC2)c(C)[nH+]1 ZINC000646408380 1046896243 /nfs/dbraw/zinc/89/62/43/1046896243.db2.gz MGNSYCQTSVOIIT-MRXNPFEDSA-N 1 2 301.434 4.193 20 0 DIADLO Cc1cc(Br)c(F)cc1C[NH+]1CC2(C1)CCCC2 ZINC001140791155 1046900753 /nfs/dbraw/zinc/90/07/53/1046900753.db2.gz BRUVPOSRZYRALB-UHFFFAOYSA-N 1 2 312.226 4.273 20 0 DIADLO Oc1cc(Cl)cc(C[N@@H+]2CCSc3ccccc3C2)c1 ZINC001140790935 1046900857 /nfs/dbraw/zinc/90/08/57/1046900857.db2.gz RTAZKTFWLYCKOU-UHFFFAOYSA-N 1 2 305.830 4.154 20 0 DIADLO Oc1cc(Cl)cc(C[N@H+]2CCSc3ccccc3C2)c1 ZINC001140790935 1046900871 /nfs/dbraw/zinc/90/08/71/1046900871.db2.gz RTAZKTFWLYCKOU-UHFFFAOYSA-N 1 2 305.830 4.154 20 0 DIADLO c1cc(CCC[N@@H+]2CCCC[C@@H]2c2noc(C3CC3)n2)cs1 ZINC000679924681 1046914116 /nfs/dbraw/zinc/91/41/16/1046914116.db2.gz UQTLASKXLFALDZ-OAHLLOKOSA-N 1 2 317.458 4.168 20 0 DIADLO c1cc(CCC[N@H+]2CCCC[C@@H]2c2noc(C3CC3)n2)cs1 ZINC000679924681 1046914134 /nfs/dbraw/zinc/91/41/34/1046914134.db2.gz UQTLASKXLFALDZ-OAHLLOKOSA-N 1 2 317.458 4.168 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+]Cc1csc(CCC(C)C)n1 ZINC000679942643 1046914793 /nfs/dbraw/zinc/91/47/93/1046914793.db2.gz MYCWGQFZANHLIS-AWEZNQCLSA-N 1 2 303.475 4.286 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+]Cc1csc(Cc2ccccc2)n1 ZINC000679941393 1046915214 /nfs/dbraw/zinc/91/52/14/1046915214.db2.gz CBAOCJSWKDNKIW-HNNXBMFYSA-N 1 2 323.465 4.288 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+][C@H](C)c1ncc(-c2ccccc2)o1 ZINC000679943122 1046915395 /nfs/dbraw/zinc/91/53/95/1046915395.db2.gz BWJRFQLPUMNGDN-HUUCEWRRSA-N 1 2 307.397 4.457 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c(F)c1 ZINC001140824252 1046915640 /nfs/dbraw/zinc/91/56/40/1046915640.db2.gz BNAFOEPSKVCRHK-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c(F)c1 ZINC001140824252 1046915650 /nfs/dbraw/zinc/91/56/50/1046915650.db2.gz BNAFOEPSKVCRHK-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@@H]([NH2+]Cc1ccon1)c1ccc(OCc2ccccc2)cc1 ZINC000303379111 1046915979 /nfs/dbraw/zinc/91/59/79/1046915979.db2.gz KZOPNWDAFQFVDY-OAHLLOKOSA-N 1 2 308.381 4.104 20 0 DIADLO COc1ccc(C[N@@H+]2CCC(=O)[C@H](C)C23CCCC3)c(Cl)c1 ZINC001140823347 1046916114 /nfs/dbraw/zinc/91/61/14/1046916114.db2.gz CUNFBCYRBKPIGD-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO COc1ccc(C[N@H+]2CCC(=O)[C@H](C)C23CCCC3)c(Cl)c1 ZINC001140823347 1046916125 /nfs/dbraw/zinc/91/61/25/1046916125.db2.gz CUNFBCYRBKPIGD-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3c(F)cccc3C2)c(Cl)c1 ZINC001140823039 1046916950 /nfs/dbraw/zinc/91/69/50/1046916950.db2.gz QMKGVERMJQSAEX-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(C[N@H+]2CCc3c(F)cccc3C2)c(Cl)c1 ZINC001140823039 1046916963 /nfs/dbraw/zinc/91/69/63/1046916963.db2.gz QMKGVERMJQSAEX-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1)Cc1c(F)cc(OC)cc1F ZINC001140827475 1046919226 /nfs/dbraw/zinc/91/92/26/1046919226.db2.gz BNVKUHRGZRDEJC-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1)Cc1c(F)cc(OC)cc1F ZINC001140827475 1046919236 /nfs/dbraw/zinc/91/92/36/1046919236.db2.gz BNVKUHRGZRDEJC-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO C[C@H](c1nc2ccccc2c(=O)[nH]1)[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000253547945 1046921037 /nfs/dbraw/zinc/92/10/37/1046921037.db2.gz AGZWRJFLSNJOJX-HBUWYVDXSA-N 1 2 319.408 4.089 20 0 DIADLO C[C@H](c1nc2ccccc2c(=O)[nH]1)[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000253547945 1046921053 /nfs/dbraw/zinc/92/10/53/1046921053.db2.gz AGZWRJFLSNJOJX-HBUWYVDXSA-N 1 2 319.408 4.089 20 0 DIADLO CCC(CC)(CC)C(=O)N1CCC(CCCn2cc[nH+]c2)CC1 ZINC000679989706 1046921490 /nfs/dbraw/zinc/92/14/90/1046921490.db2.gz KPRRLJGKFDWGBO-UHFFFAOYSA-N 1 2 319.493 4.118 20 0 DIADLO Cc1cc2nc(NCc3cc(-n4cc[nH+]c4)cs3)oc2c(C)c1 ZINC000680020834 1046930470 /nfs/dbraw/zinc/93/04/70/1046930470.db2.gz RAACYNCIJJIIFS-UHFFFAOYSA-N 1 2 324.409 4.304 20 0 DIADLO Fc1cccc(C2([NH2+][C@H]3COCc4cccc(Cl)c43)CC2)c1 ZINC000798182957 1046934299 /nfs/dbraw/zinc/93/42/99/1046934299.db2.gz KLQZBPCJSVWJMG-INIZCTEOSA-N 1 2 317.791 4.329 20 0 DIADLO Clc1cc(Nc2ccccc2-n2cc[nH+]c2)cc(Cl)n1 ZINC001212094490 1046934925 /nfs/dbraw/zinc/93/49/25/1046934925.db2.gz QQAPYRFPIIWYIX-UHFFFAOYSA-N 1 2 305.168 4.318 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@@H+]2Cc2ccc(Cl)nc2)cc1 ZINC000303611497 1046936602 /nfs/dbraw/zinc/93/66/02/1046936602.db2.gz BQVRDUQXKTUTTM-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@H+]2Cc2ccc(Cl)nc2)cc1 ZINC000303611497 1046936614 /nfs/dbraw/zinc/93/66/14/1046936614.db2.gz BQVRDUQXKTUTTM-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1ccc(Cl)s1 ZINC000680041683 1046937347 /nfs/dbraw/zinc/93/73/47/1046937347.db2.gz MEQWUUCWWSNYKN-XVKPBYJWSA-N 1 2 315.772 4.464 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1cccc(Cl)c1 ZINC000680041915 1046937371 /nfs/dbraw/zinc/93/73/71/1046937371.db2.gz PGWIWZHRQWCZFJ-OTYXRUKQSA-N 1 2 309.743 4.403 20 0 DIADLO Fc1cc(C[N@H+]2CCCC[C@H](F)C2)cc(F)c1C(F)(F)F ZINC001140878595 1046939863 /nfs/dbraw/zinc/93/98/63/1046939863.db2.gz DHBQALOXAINHBE-JTQLQIEISA-N 1 2 311.269 4.308 20 0 DIADLO Fc1cc(C[N@@H+]2CCCC[C@H](F)C2)cc(F)c1C(F)(F)F ZINC001140878595 1046939871 /nfs/dbraw/zinc/93/98/71/1046939871.db2.gz DHBQALOXAINHBE-JTQLQIEISA-N 1 2 311.269 4.308 20 0 DIADLO C/C(=C\C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2)C1CC1 ZINC000798267465 1046943037 /nfs/dbraw/zinc/94/30/37/1046943037.db2.gz HKSUWEBAYKSFSK-WYMLVPIESA-N 1 2 321.424 4.181 20 0 DIADLO FC(F)(F)c1ccncc1C[N@@H+]1CCSc2ccccc2C1 ZINC001140922898 1046950877 /nfs/dbraw/zinc/95/08/77/1046950877.db2.gz IMIKHLBNTHDJLH-UHFFFAOYSA-N 1 2 324.371 4.208 20 0 DIADLO FC(F)(F)c1ccncc1C[N@H+]1CCSc2ccccc2C1 ZINC001140922898 1046950880 /nfs/dbraw/zinc/95/08/80/1046950880.db2.gz IMIKHLBNTHDJLH-UHFFFAOYSA-N 1 2 324.371 4.208 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cnccc2C(F)(F)F)cn1 ZINC001140919715 1046951434 /nfs/dbraw/zinc/95/14/34/1046951434.db2.gz AMOFKYIZHJCJPU-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cnccc2C(F)(F)F)cn1 ZINC001140919715 1046951443 /nfs/dbraw/zinc/95/14/43/1046951443.db2.gz AMOFKYIZHJCJPU-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO CC1(C)C[N@H+](Cc2cnccc2C(F)(F)F)Cc2ccccc21 ZINC001140920104 1046951600 /nfs/dbraw/zinc/95/16/00/1046951600.db2.gz JQOYCUFUBHMOCC-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnccc2C(F)(F)F)Cc2ccccc21 ZINC001140920104 1046951608 /nfs/dbraw/zinc/95/16/08/1046951608.db2.gz JQOYCUFUBHMOCC-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO CCCOc1cccc2c(NCc3cccnc3F)cc[nH+]c12 ZINC000798399025 1046951795 /nfs/dbraw/zinc/95/17/95/1046951795.db2.gz GXDFJGZRMOQGDA-UHFFFAOYSA-N 1 2 311.360 4.170 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@@H+]1Cc1cnco1 ZINC001140933603 1046953431 /nfs/dbraw/zinc/95/34/31/1046953431.db2.gz YZTNTLIIXSGFNW-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@H+]1Cc1cnco1 ZINC001140933603 1046953438 /nfs/dbraw/zinc/95/34/38/1046953438.db2.gz YZTNTLIIXSGFNW-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO Clc1cccc(Cl)c1C1CC[NH+](Cc2cnco2)CC1 ZINC001140927189 1046953899 /nfs/dbraw/zinc/95/38/99/1046953899.db2.gz IMIKTMKGECPYLK-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)n[nH]1 ZINC001203080831 1046954895 /nfs/dbraw/zinc/95/48/95/1046954895.db2.gz CXDPHELHJCLSRM-OAHLLOKOSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)n[nH]1 ZINC001203080831 1046954904 /nfs/dbraw/zinc/95/49/04/1046954904.db2.gz CXDPHELHJCLSRM-OAHLLOKOSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)n[nH]1 ZINC001203080830 1046956647 /nfs/dbraw/zinc/95/66/47/1046956647.db2.gz CXDPHELHJCLSRM-HNNXBMFYSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)n[nH]1 ZINC001203080830 1046956654 /nfs/dbraw/zinc/95/66/54/1046956654.db2.gz CXDPHELHJCLSRM-HNNXBMFYSA-N 1 2 309.335 4.074 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccccc1Cl)c1cc2n(n1)CCCC2 ZINC000647279992 1046964210 /nfs/dbraw/zinc/96/42/10/1046964210.db2.gz LSUJDDODQWKNHK-CHWSQXEVSA-N 1 2 303.837 4.285 20 0 DIADLO C[C@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1ccccc1Cl ZINC000162366953 1046964526 /nfs/dbraw/zinc/96/45/26/1046964526.db2.gz BPBNKZRATQPBFK-JTQLQIEISA-N 1 2 304.752 4.471 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1cccc(-c3ncccn3)c1)C2 ZINC001140981374 1046968974 /nfs/dbraw/zinc/96/89/74/1046968974.db2.gz RRNPKVMFVKQRJW-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1cccc(-c3ncccn3)c1)C2 ZINC001140981374 1046968979 /nfs/dbraw/zinc/96/89/79/1046968979.db2.gz RRNPKVMFVKQRJW-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+][C@H]1COc2cc(F)cc(F)c21 ZINC000680355276 1046971066 /nfs/dbraw/zinc/97/10/66/1046971066.db2.gz ULWLRYZCLUXWKQ-NHYWBVRUSA-N 1 2 319.351 4.148 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)cc1F ZINC001140990906 1046971639 /nfs/dbraw/zinc/97/16/39/1046971639.db2.gz CHEARPHIVWBBLR-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+][C@H]1COc2cc(F)cc(F)c21 ZINC000680354867 1046971761 /nfs/dbraw/zinc/97/17/61/1046971761.db2.gz JNEZORZGWKDHJS-ABAIWWIYSA-N 1 2 319.351 4.066 20 0 DIADLO CC1(C)Cc2occc2[C@@H]([NH2+][C@@H]2COc3cc(F)cc(F)c32)C1 ZINC000680355378 1046973832 /nfs/dbraw/zinc/97/38/32/1046973832.db2.gz OPLJPSHIVSCINS-UONOGXRCSA-N 1 2 319.351 4.295 20 0 DIADLO COc1ccccc1C1([NH2+][C@@H](C)c2nc(C)sc2C)CC1 ZINC000647329879 1046980035 /nfs/dbraw/zinc/98/00/35/1046980035.db2.gz YJXBWGQECWMCHU-NSHDSACASA-N 1 2 302.443 4.108 20 0 DIADLO CCC[C@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1cccnc1 ZINC000680466935 1046984272 /nfs/dbraw/zinc/98/42/72/1046984272.db2.gz BMLPWBMTAIOLSP-AWEZNQCLSA-N 1 2 312.310 4.269 20 0 DIADLO Fc1cncc([C@@H](Nc2ccc([NH+]3CCCC3)cc2)C2CC2)c1 ZINC000798931536 1046987015 /nfs/dbraw/zinc/98/70/15/1046987015.db2.gz LZMISFUWTOIHLX-IBGZPJMESA-N 1 2 311.404 4.384 20 0 DIADLO Fc1cccc(C[C@@H]2CCC[N@@H+]2Cc2csc(Cl)n2)c1 ZINC000827430446 1046989741 /nfs/dbraw/zinc/98/97/41/1046989741.db2.gz MTBDQBLHDXLKDQ-AWEZNQCLSA-N 1 2 310.825 4.143 20 0 DIADLO Fc1cccc(C[C@@H]2CCC[N@H+]2Cc2csc(Cl)n2)c1 ZINC000827430446 1046989748 /nfs/dbraw/zinc/98/97/48/1046989748.db2.gz MTBDQBLHDXLKDQ-AWEZNQCLSA-N 1 2 310.825 4.143 20 0 DIADLO Cc1cc(C[N@@H+]2CCSC[C@@H]2c2cccc(Cl)c2)ccn1 ZINC001137415097 1046990342 /nfs/dbraw/zinc/99/03/42/1046990342.db2.gz DVFGHFUFTUPFFD-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(C[N@H+]2CCSC[C@@H]2c2cccc(Cl)c2)ccn1 ZINC001137415097 1046990350 /nfs/dbraw/zinc/99/03/50/1046990350.db2.gz DVFGHFUFTUPFFD-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO COc1ccc2nc(Cl)c(C[N@@H+]3CCCC[C@@H](F)C3)cc2c1 ZINC001141062256 1046994930 /nfs/dbraw/zinc/99/49/30/1046994930.db2.gz BEQJCYFTIVTQRU-CQSZACIVSA-N 1 2 322.811 4.221 20 0 DIADLO COc1ccc2nc(Cl)c(C[N@H+]3CCCC[C@@H](F)C3)cc2c1 ZINC001141062256 1046994940 /nfs/dbraw/zinc/99/49/40/1046994940.db2.gz BEQJCYFTIVTQRU-CQSZACIVSA-N 1 2 322.811 4.221 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)nn1C ZINC000282070257 1046999976 /nfs/dbraw/zinc/99/99/76/1046999976.db2.gz HBPFYKUFEPVDPT-PXAZEXFGSA-N 1 2 321.415 4.445 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)nn1C ZINC000282070263 1047001487 /nfs/dbraw/zinc/00/14/87/1047001487.db2.gz HBPFYKUFEPVDPT-SJKOYZFVSA-N 1 2 321.415 4.445 20 0 DIADLO CC(C)=CCC[C@H](C)NC(=O)c1c[nH+]ccc1Nc1ccccc1 ZINC001141085620 1047003770 /nfs/dbraw/zinc/00/37/70/1047003770.db2.gz CPCOTBDOVCOFAX-INIZCTEOSA-N 1 2 323.440 4.112 20 0 DIADLO C[C@H](c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1)C1CCCC1 ZINC000680695609 1047012160 /nfs/dbraw/zinc/01/21/60/1047012160.db2.gz HYTVHINPLJHJEF-AWEZNQCLSA-N 1 2 322.412 4.275 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccnc(-c2ccc(F)cc2)c1 ZINC001141119938 1047020968 /nfs/dbraw/zinc/02/09/68/1047020968.db2.gz CUCHLTDJGJKEBD-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccnc(-c2ccc(F)cc2)c1 ZINC001141119938 1047020982 /nfs/dbraw/zinc/02/09/82/1047020982.db2.gz CUCHLTDJGJKEBD-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO Cc1cc(C)c(NC(=O)NC2(c3ccccc3)CCC2)c(C)[nH+]1 ZINC000647977234 1047026598 /nfs/dbraw/zinc/02/65/98/1047026598.db2.gz SNDXVWWUQYPWHR-UHFFFAOYSA-N 1 2 309.413 4.208 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ncc(-c3ccccc3C)o2)cc1 ZINC000533815532 1047026471 /nfs/dbraw/zinc/02/64/71/1047026471.db2.gz INQCPMRRFFDCCP-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ncc(-c3ccccc3C)o2)cc1 ZINC000533815532 1047026486 /nfs/dbraw/zinc/02/64/86/1047026486.db2.gz INQCPMRRFFDCCP-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO CC1(CC(F)F)C[NH+](Cc2ccccc2OC(F)(F)F)C1 ZINC000648058328 1047030673 /nfs/dbraw/zinc/03/06/73/1047030673.db2.gz DTUGQAJMMVUPOT-UHFFFAOYSA-N 1 2 309.278 4.062 20 0 DIADLO CSc1ccc(C)c(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC000162760370 1047032296 /nfs/dbraw/zinc/03/22/96/1047032296.db2.gz KAXHOBOLWGNFNB-UHFFFAOYSA-N 1 2 323.421 4.359 20 0 DIADLO CCc1noc(C)c1C[N@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000162796011 1047033745 /nfs/dbraw/zinc/03/37/45/1047033745.db2.gz WBGKSRAEFFWJFR-BLLLJJGKSA-N 1 2 314.429 4.426 20 0 DIADLO CCc1noc(C)c1C[N@@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000162796011 1047033758 /nfs/dbraw/zinc/03/37/58/1047033758.db2.gz WBGKSRAEFFWJFR-BLLLJJGKSA-N 1 2 314.429 4.426 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ncccc2C(F)(F)F)c(F)c1 ZINC001141191189 1047041628 /nfs/dbraw/zinc/04/16/28/1047041628.db2.gz BTACSQLKJDTUNA-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1ccc(-c3ncccn3)cc1)C2 ZINC001141190565 1047041367 /nfs/dbraw/zinc/04/13/67/1047041367.db2.gz LBABQYVMOGEXAR-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1ccc(-c3ncccn3)cc1)C2 ZINC001141190565 1047041379 /nfs/dbraw/zinc/04/13/79/1047041379.db2.gz LBABQYVMOGEXAR-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ncccc2C(F)(F)F)c(F)c1 ZINC001141191189 1047041614 /nfs/dbraw/zinc/04/16/14/1047041614.db2.gz BTACSQLKJDTUNA-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO c1cc2c(cccc2CNc2[nH+]c3ccccc3n2C2CC2)[nH]1 ZINC000680852761 1047054642 /nfs/dbraw/zinc/05/46/42/1047054642.db2.gz VQVOUABENJGXKC-UHFFFAOYSA-N 1 2 302.381 4.465 20 0 DIADLO FC(F)(F)C1=CC[N@H+](Cc2cnc(C3CCCC3)s2)CC1 ZINC000536662641 1047057044 /nfs/dbraw/zinc/05/70/44/1047057044.db2.gz OISHSCCQGHEWGF-UHFFFAOYSA-N 1 2 316.392 4.495 20 0 DIADLO FC(F)(F)C1=CC[N@@H+](Cc2cnc(C3CCCC3)s2)CC1 ZINC000536662641 1047057058 /nfs/dbraw/zinc/05/70/58/1047057058.db2.gz OISHSCCQGHEWGF-UHFFFAOYSA-N 1 2 316.392 4.495 20 0 DIADLO Cc1cnccc1C[N@H+]1C[C@@H](c2cccc(Cl)c2)OC[C@H]1C ZINC000648535260 1047064603 /nfs/dbraw/zinc/06/46/03/1047064603.db2.gz YRMYOEFZQNHZGQ-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cnccc1C[N@@H+]1C[C@@H](c2cccc(Cl)c2)OC[C@H]1C ZINC000648535260 1047064611 /nfs/dbraw/zinc/06/46/11/1047064611.db2.gz YRMYOEFZQNHZGQ-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO CC(C)C[C@H]1COCC[N@@H+]1Cc1nc(-c2ccccc2)cs1 ZINC000536671992 1047065229 /nfs/dbraw/zinc/06/52/29/1047065229.db2.gz YULKXBIKDVLVPH-INIZCTEOSA-N 1 2 316.470 4.057 20 0 DIADLO CC(C)C[C@H]1COCC[N@H+]1Cc1nc(-c2ccccc2)cs1 ZINC000536671992 1047065241 /nfs/dbraw/zinc/06/52/41/1047065241.db2.gz YULKXBIKDVLVPH-INIZCTEOSA-N 1 2 316.470 4.057 20 0 DIADLO CCC(CC)(CC)C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000680919618 1047066950 /nfs/dbraw/zinc/06/69/50/1047066950.db2.gz GZGDKEZJZAOBMN-HNNXBMFYSA-N 1 2 322.518 4.170 20 0 DIADLO CCC(CC)(CC)C(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000680919630 1047067872 /nfs/dbraw/zinc/06/78/72/1047067872.db2.gz GZGDKEZJZAOBMN-OAHLLOKOSA-N 1 2 322.518 4.170 20 0 DIADLO COc1ccsc1C[N@@H+]1CCSC[C@H]1c1ccc(F)cc1 ZINC001141326804 1047092823 /nfs/dbraw/zinc/09/28/23/1047092823.db2.gz PGXUEYMSSYZBMY-AWEZNQCLSA-N 1 2 323.458 4.186 20 0 DIADLO COc1ccsc1C[N@H+]1CCSC[C@H]1c1ccc(F)cc1 ZINC001141326804 1047092833 /nfs/dbraw/zinc/09/28/33/1047092833.db2.gz PGXUEYMSSYZBMY-AWEZNQCLSA-N 1 2 323.458 4.186 20 0 DIADLO CCC(C)(CC)C(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC000681090908 1047094102 /nfs/dbraw/zinc/09/41/02/1047094102.db2.gz RZKBHODIXXXIOD-CYBMUJFWSA-N 1 2 323.506 4.140 20 0 DIADLO CCC(C)(CC)C(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000681090908 1047094117 /nfs/dbraw/zinc/09/41/17/1047094117.db2.gz RZKBHODIXXXIOD-CYBMUJFWSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1cc(NC[C@]2(O)CCCc3ccccc32)[nH+]c2ccccc12 ZINC001116014281 1047100594 /nfs/dbraw/zinc/10/05/94/1047100594.db2.gz HKIHGXCDWZJGQJ-OAQYLSRUSA-N 1 2 318.420 4.179 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ccn(C)n1)c1ccc(Cl)cc1Cl ZINC000536830584 1047103554 /nfs/dbraw/zinc/10/35/54/1047103554.db2.gz CLQXTMCRAOOIGN-OAHLLOKOSA-N 1 2 312.244 4.358 20 0 DIADLO CCC[N@H+](Cc1csc(Cl)n1)Cc1ccc(OC)cc1 ZINC000827537159 1047114382 /nfs/dbraw/zinc/11/43/82/1047114382.db2.gz CJUWJHSYVHTFHE-UHFFFAOYSA-N 1 2 310.850 4.217 20 0 DIADLO CCC[N@@H+](Cc1csc(Cl)n1)Cc1ccc(OC)cc1 ZINC000827537159 1047114386 /nfs/dbraw/zinc/11/43/86/1047114386.db2.gz CJUWJHSYVHTFHE-UHFFFAOYSA-N 1 2 310.850 4.217 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[N@@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC001116188373 1047116908 /nfs/dbraw/zinc/11/69/08/1047116908.db2.gz YVCSMKVABIFZTC-RBUKOAKNSA-N 1 2 315.363 4.026 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[N@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC001116188373 1047116921 /nfs/dbraw/zinc/11/69/21/1047116921.db2.gz YVCSMKVABIFZTC-RBUKOAKNSA-N 1 2 315.363 4.026 20 0 DIADLO CC(C)c1cccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000681358941 1047117886 /nfs/dbraw/zinc/11/78/86/1047117886.db2.gz RLMUJPCMNGMXAS-ZDUSSCGKSA-N 1 2 301.434 4.341 20 0 DIADLO Cc1ccc(CSc2nnc(-c3ccccc3F)o2)c(C)[nH+]1 ZINC000681363084 1047117986 /nfs/dbraw/zinc/11/79/86/1047117986.db2.gz UMJKNAQSYYYMTL-UHFFFAOYSA-N 1 2 315.373 4.180 20 0 DIADLO FC(F)[C@H]1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C1 ZINC000649355458 1047122128 /nfs/dbraw/zinc/12/21/28/1047122128.db2.gz SNVPFDCQDXMPSJ-JTQLQIEISA-N 1 2 316.273 4.345 20 0 DIADLO Fc1ccc(C[NH+]2CC(c3nc4ccccc4s3)C2)c(F)c1 ZINC000536927349 1047124024 /nfs/dbraw/zinc/12/40/24/1047124024.db2.gz ZQGPRZNHQJJRCI-UHFFFAOYSA-N 1 2 316.376 4.174 20 0 DIADLO CCc1ncc(C[N@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC000929114793 1047126577 /nfs/dbraw/zinc/12/65/77/1047126577.db2.gz AJDGIGVBUKNBPD-LRDDRELGSA-N 1 2 300.402 4.118 20 0 DIADLO CCc1ncc(C[N@@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC000929114793 1047126585 /nfs/dbraw/zinc/12/65/85/1047126585.db2.gz AJDGIGVBUKNBPD-LRDDRELGSA-N 1 2 300.402 4.118 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccccc2C)[C@H]2CCC[C@H](C)C2)no1 ZINC000537059504 1047133575 /nfs/dbraw/zinc/13/35/75/1047133575.db2.gz LERJMVIKNGCGOM-AXHNFQJDSA-N 1 2 313.445 4.344 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)c(Cl)n1 ZINC000838924303 1047175722 /nfs/dbraw/zinc/17/57/22/1047175722.db2.gz CZHDPLPSGWKFQG-CMPLNLGQSA-N 1 2 306.759 4.206 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)c(Cl)n1 ZINC000838924303 1047175725 /nfs/dbraw/zinc/17/57/25/1047175725.db2.gz CZHDPLPSGWKFQG-CMPLNLGQSA-N 1 2 306.759 4.206 20 0 DIADLO CC(C)Oc1ccnc(C[N@H+](C)Cc2ccc(Cl)s2)c1 ZINC000649474514 1047136085 /nfs/dbraw/zinc/13/60/85/1047136085.db2.gz HNYCANCWXFERHU-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO CC(C)Oc1ccnc(C[N@@H+](C)Cc2ccc(Cl)s2)c1 ZINC000649474514 1047136092 /nfs/dbraw/zinc/13/60/92/1047136092.db2.gz HNYCANCWXFERHU-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO CCc1cnc(C[NH2+][C@H](c2ccccc2F)C2CCCC2)o1 ZINC000537124986 1047137813 /nfs/dbraw/zinc/13/78/13/1047137813.db2.gz QEXZXQMKYVNROR-SFHVURJKSA-N 1 2 302.393 4.397 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](C)Cc1cc2n(n1)CCC2 ZINC000649499398 1047138340 /nfs/dbraw/zinc/13/83/40/1047138340.db2.gz XGIVNSCBFBAWFW-LBPRGKRZSA-N 1 2 323.362 4.041 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)Cc1cc2n(n1)CCC2 ZINC000649499398 1047138343 /nfs/dbraw/zinc/13/83/43/1047138343.db2.gz XGIVNSCBFBAWFW-LBPRGKRZSA-N 1 2 323.362 4.041 20 0 DIADLO CC(C)Oc1ccc(C[NH+]2CC3(C2)CC(F)(F)C3)cc1Cl ZINC000681691406 1047141979 /nfs/dbraw/zinc/14/19/79/1047141979.db2.gz YIRZXLAUUQPPCA-UHFFFAOYSA-N 1 2 315.791 4.358 20 0 DIADLO c1ccc([C@H](CC2CCCC2)[NH2+]Cc2nnc(C3CC3)o2)cc1 ZINC000537132404 1047142072 /nfs/dbraw/zinc/14/20/72/1047142072.db2.gz CYCKYGKGSJKUSC-KRWDZBQOSA-N 1 2 311.429 4.358 20 0 DIADLO CCC[C@@H]([NH2+]Cc1cc2n(n1)CCCC2)c1ccc(F)cc1F ZINC000649576019 1047147227 /nfs/dbraw/zinc/14/72/27/1047147227.db2.gz JLNCXFRGSWIUGL-GOSISDBHSA-N 1 2 319.399 4.129 20 0 DIADLO CCCCN(C(=O)C[C@H](C)n1cc[nH+]c1)[C@@H](C)c1ccccc1 ZINC000649590201 1047150788 /nfs/dbraw/zinc/15/07/88/1047150788.db2.gz PEGCNLLNQIRODC-IRXDYDNUSA-N 1 2 313.445 4.224 20 0 DIADLO C1=CCC2(C[N@@H+](Cc3cc4n(n3)CCCC4)[C@H]2c2ccccc2)C1 ZINC000649636332 1047155801 /nfs/dbraw/zinc/15/58/01/1047155801.db2.gz UJPAIJMXJXVRNR-FQEVSTJZSA-N 1 2 319.452 4.113 20 0 DIADLO C1=CCC2(C[N@H+](Cc3cc4n(n3)CCCC4)[C@H]2c2ccccc2)C1 ZINC000649636332 1047155806 /nfs/dbraw/zinc/15/58/06/1047155806.db2.gz UJPAIJMXJXVRNR-FQEVSTJZSA-N 1 2 319.452 4.113 20 0 DIADLO CCn1nc(C[N@H+](C)Cc2cc3ccccc3[nH]2)c2ccccc21 ZINC001116630930 1047163285 /nfs/dbraw/zinc/16/32/85/1047163285.db2.gz WAGRJHWESYHJEC-UHFFFAOYSA-N 1 2 318.424 4.170 20 0 DIADLO CCn1nc(C[N@@H+](C)Cc2cc3ccccc3[nH]2)c2ccccc21 ZINC001116630930 1047163292 /nfs/dbraw/zinc/16/32/92/1047163292.db2.gz WAGRJHWESYHJEC-UHFFFAOYSA-N 1 2 318.424 4.170 20 0 DIADLO CC(C)c1cccc(C(=O)Nc2ccccc2-n2cc[nH+]c2)c1 ZINC001141525041 1047163463 /nfs/dbraw/zinc/16/34/63/1047163463.db2.gz ASSMKBCNILPGNZ-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@@H+]([C@H](C)c2cc(F)ccc2F)C1 ZINC000682041824 1047164217 /nfs/dbraw/zinc/16/42/17/1047164217.db2.gz NDAYCEVXIRXKLQ-QMTHXVAHSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@H+]([C@H](C)c2cc(F)ccc2F)C1 ZINC000682041824 1047164220 /nfs/dbraw/zinc/16/42/20/1047164220.db2.gz NDAYCEVXIRXKLQ-QMTHXVAHSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@@H+]([C@H](C)c2ccc(F)cc2F)C1 ZINC000682042753 1047164340 /nfs/dbraw/zinc/16/43/40/1047164340.db2.gz ZKHRXCFYPALMOB-YGRLFVJLSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@H+]([C@H](C)c2ccc(F)cc2F)C1 ZINC000682042753 1047164350 /nfs/dbraw/zinc/16/43/50/1047164350.db2.gz ZKHRXCFYPALMOB-YGRLFVJLSA-N 1 2 323.305 4.069 20 0 DIADLO Cc1ccccc1[C@H]([NH2+]Cc1nc(CCC(C)C)no1)C1CC1 ZINC000537289084 1047164660 /nfs/dbraw/zinc/16/46/60/1047164660.db2.gz BECSNLPFEFWYNC-LJQANCHMSA-N 1 2 313.445 4.208 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H]2c2cccn2C)c(Cl)n1 ZINC000838865654 1047165079 /nfs/dbraw/zinc/16/50/79/1047165079.db2.gz SXXCVQSWPNWUDN-INIZCTEOSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2cccn2C)c(Cl)n1 ZINC000838865654 1047165089 /nfs/dbraw/zinc/16/50/89/1047165089.db2.gz SXXCVQSWPNWUDN-INIZCTEOSA-N 1 2 303.837 4.109 20 0 DIADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1nc(-c2ccccc2)oc1C ZINC000649714516 1047167058 /nfs/dbraw/zinc/16/70/58/1047167058.db2.gz DVTJFKOPPNAQOX-INIZCTEOSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1nc(-c2ccccc2)oc1C ZINC000649714516 1047167064 /nfs/dbraw/zinc/16/70/64/1047167064.db2.gz DVTJFKOPPNAQOX-INIZCTEOSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ncc(-c3ccccc3C)o2)[C@@H](CC)CO1 ZINC000649721578 1047167442 /nfs/dbraw/zinc/16/74/42/1047167442.db2.gz ZXIVFEGFXSNDHH-JKSUJKDBSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ncc(-c3ccccc3C)o2)[C@@H](CC)CO1 ZINC000649721578 1047167453 /nfs/dbraw/zinc/16/74/53/1047167453.db2.gz ZXIVFEGFXSNDHH-JKSUJKDBSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2nc(-c3ccccc3)oc2C)[C@@H](CC)CO1 ZINC000649722121 1047167475 /nfs/dbraw/zinc/16/74/75/1047167475.db2.gz IQIFUDFRWOUJMW-DLBZAZTESA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2nc(-c3ccccc3)oc2C)[C@@H](CC)CO1 ZINC000649722121 1047167478 /nfs/dbraw/zinc/16/74/78/1047167478.db2.gz IQIFUDFRWOUJMW-DLBZAZTESA-N 1 2 314.429 4.039 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1ccc(C)nc1Cl)CCC2 ZINC000838896020 1047170442 /nfs/dbraw/zinc/17/04/42/1047170442.db2.gz WAYJUOCTLZFKTQ-AWEZNQCLSA-N 1 2 321.877 4.318 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccc(C)nc1Cl)CCC2 ZINC000838896020 1047170446 /nfs/dbraw/zinc/17/04/46/1047170446.db2.gz WAYJUOCTLZFKTQ-AWEZNQCLSA-N 1 2 321.877 4.318 20 0 DIADLO CC[C@@](C)([NH2+]Cc1ccc(C)nc1Cl)c1nc(C)cs1 ZINC000838898549 1047171647 /nfs/dbraw/zinc/17/16/47/1047171647.db2.gz AWTBAJWJBLXJLY-OAHLLOKOSA-N 1 2 309.866 4.223 20 0 DIADLO CC(C)[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cc2ccccc2o1 ZINC000537351800 1047174504 /nfs/dbraw/zinc/17/45/04/1047174504.db2.gz JZGQWSGLEOJPSB-HXUWFJFHSA-N 1 2 312.457 4.346 20 0 DIADLO Cc1cnc([C@@H](C)SCc2ccc(-n3cc[nH+]c3)cc2C)o1 ZINC001116761343 1047176041 /nfs/dbraw/zinc/17/60/41/1047176041.db2.gz ABAOCFFDKQLDFZ-CQSZACIVSA-N 1 2 313.426 4.472 20 0 DIADLO CC1(C)CC[C@H](CSCc2ccc(-n3cc[nH+]c3)cc2)O1 ZINC001116762025 1047176386 /nfs/dbraw/zinc/17/63/86/1047176386.db2.gz XZCGBDHOLCEEEY-MRXNPFEDSA-N 1 2 302.443 4.063 20 0 DIADLO Cc1cc(C)c(CNc2ncc(C(F)(F)F)cc2Cl)c[nH+]1 ZINC000396989320 1047205370 /nfs/dbraw/zinc/20/53/70/1047205370.db2.gz UCIVKOAKGSUMQD-UHFFFAOYSA-N 1 2 315.726 4.378 20 0 DIADLO COc1c2ccccc2oc1C[NH2+][C@H](C)c1nc(C)sc1C ZINC000682734650 1047218617 /nfs/dbraw/zinc/21/86/17/1047218617.db2.gz XRWXDWFMDWRWFL-SNVBAGLBSA-N 1 2 316.426 4.366 20 0 DIADLO COCc1cc[nH+]c(NCc2cc(C)c(C)cc2OC(F)F)c1 ZINC000650243951 1047226121 /nfs/dbraw/zinc/22/61/21/1047226121.db2.gz WKJJJUAHHZRNMA-UHFFFAOYSA-N 1 2 322.355 4.058 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)cs1 ZINC000682940212 1047241560 /nfs/dbraw/zinc/24/15/60/1047241560.db2.gz VKBNMTPOMKEXEV-UHFFFAOYSA-N 1 2 320.364 4.280 20 0 DIADLO Cc1cc(N[C@@H]2CCO[C@@H](c3ccncc3)C2)[nH+]c2ccccc12 ZINC001117758605 1047242188 /nfs/dbraw/zinc/24/21/88/1047242188.db2.gz RLAGGRAWNHMLSG-VQIMIIECSA-N 1 2 319.408 4.270 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cnc(Cl)s2)cc(F)c1F ZINC001143597178 1047246190 /nfs/dbraw/zinc/24/61/90/1047246190.db2.gz LRNVYMWDEKKSOH-UHFFFAOYSA-N 1 2 302.777 4.015 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cnc(Cl)s2)cc(F)c1F ZINC001143597178 1047246204 /nfs/dbraw/zinc/24/62/04/1047246204.db2.gz LRNVYMWDEKKSOH-UHFFFAOYSA-N 1 2 302.777 4.015 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccsc2Cl)cc1OC ZINC000682993837 1047247289 /nfs/dbraw/zinc/24/72/89/1047247289.db2.gz BLYRRSOZSLIBKQ-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccsc2Cl)cc1OC ZINC000682993837 1047247300 /nfs/dbraw/zinc/24/73/00/1047247300.db2.gz BLYRRSOZSLIBKQ-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(SC(F)(F)F)c1)c1csnn1 ZINC000839662984 1047253451 /nfs/dbraw/zinc/25/34/51/1047253451.db2.gz NOUZNLYPZUGIAZ-QMMMGPOBSA-N 1 2 319.377 4.001 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ccco2)Cc2cc(C)ccn2)c1 ZINC000683015572 1047256274 /nfs/dbraw/zinc/25/62/74/1047256274.db2.gz YWEJXAQXBQIYOZ-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ccco2)Cc2cc(C)ccn2)c1 ZINC000683015572 1047256277 /nfs/dbraw/zinc/25/62/77/1047256277.db2.gz YWEJXAQXBQIYOZ-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CC1 ZINC000147121880 1047275215 /nfs/dbraw/zinc/27/52/15/1047275215.db2.gz ZIWBCWRPOAOHCZ-CQSZACIVSA-N 1 2 323.440 4.261 20 0 DIADLO C[C@H]1CC[C@H](c2ccccc2)[N@H+](Cc2ncc(Cl)n2C)C1 ZINC000796436863 1047279490 /nfs/dbraw/zinc/27/94/90/1047279490.db2.gz ZANVGDFEJOYAMS-DZGCQCFKSA-N 1 2 303.837 4.047 20 0 DIADLO C[C@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2ncc(Cl)n2C)C1 ZINC000796436863 1047279510 /nfs/dbraw/zinc/27/95/10/1047279510.db2.gz ZANVGDFEJOYAMS-DZGCQCFKSA-N 1 2 303.837 4.047 20 0 DIADLO C[C@@H]1CC[C@H](c2ccccc2)[N@H+](Cc2ncc(Cl)n2C)C1 ZINC000796436865 1047279895 /nfs/dbraw/zinc/27/98/95/1047279895.db2.gz ZANVGDFEJOYAMS-UKRRQHHQSA-N 1 2 303.837 4.047 20 0 DIADLO C[C@@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2ncc(Cl)n2C)C1 ZINC000796436865 1047279902 /nfs/dbraw/zinc/27/99/02/1047279902.db2.gz ZANVGDFEJOYAMS-UKRRQHHQSA-N 1 2 303.837 4.047 20 0 DIADLO CCn1c(C2CC2)nn(C[N@@H+]2CC[C@@H](CC(C)(C)C)C2)c1=S ZINC000840149673 1047291609 /nfs/dbraw/zinc/29/16/09/1047291609.db2.gz JJFNQRRIRVUCRQ-ZDUSSCGKSA-N 1 2 322.522 4.027 20 0 DIADLO CCn1c(C2CC2)nn(C[N@H+]2CC[C@@H](CC(C)(C)C)C2)c1=S ZINC000840149673 1047291618 /nfs/dbraw/zinc/29/16/18/1047291618.db2.gz JJFNQRRIRVUCRQ-ZDUSSCGKSA-N 1 2 322.522 4.027 20 0 DIADLO Cc1ncc(C[N@H+](Cc2cccs2)Cc2ccncc2)s1 ZINC000897926285 1047300239 /nfs/dbraw/zinc/30/02/39/1047300239.db2.gz TYNNYUXFWNWHMA-UHFFFAOYSA-N 1 2 315.467 4.110 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2cccs2)Cc2ccncc2)s1 ZINC000897926285 1047300256 /nfs/dbraw/zinc/30/02/56/1047300256.db2.gz TYNNYUXFWNWHMA-UHFFFAOYSA-N 1 2 315.467 4.110 20 0 DIADLO Cc1ncsc1C[N@H+](Cc1cccs1)Cc1ccncc1 ZINC000897926028 1047300371 /nfs/dbraw/zinc/30/03/71/1047300371.db2.gz WJDOUAJUGAKYAZ-UHFFFAOYSA-N 1 2 315.467 4.110 20 0 DIADLO Cc1ncsc1C[N@@H+](Cc1cccs1)Cc1ccncc1 ZINC000897926028 1047300386 /nfs/dbraw/zinc/30/03/86/1047300386.db2.gz WJDOUAJUGAKYAZ-UHFFFAOYSA-N 1 2 315.467 4.110 20 0 DIADLO CCC[C@](C)([NH2+]Cc1ncc(CN(C)C)s1)c1ccccc1 ZINC000897926319 1047302734 /nfs/dbraw/zinc/30/27/34/1047302734.db2.gz URVDCCBGIHUHNI-SFHVURJKSA-N 1 2 317.502 4.010 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(F)c(Br)cc2F)C2(CC2)C1 ZINC001141917382 1047309931 /nfs/dbraw/zinc/30/99/31/1047309931.db2.gz NXAKOTMKDLWRLS-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(F)c(Br)cc2F)C2(CC2)C1 ZINC001141917382 1047309947 /nfs/dbraw/zinc/30/99/47/1047309947.db2.gz NXAKOTMKDLWRLS-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO CC(C)c1cc(N2CCC3(CC3(F)F)CC2)nc(C(C)C)[nH+]1 ZINC000651424400 1047312904 /nfs/dbraw/zinc/31/29/04/1047312904.db2.gz YJXUBAIXTFZLIZ-UHFFFAOYSA-N 1 2 309.404 4.349 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1cccc2c1OCO2 ZINC001141960552 1047318479 /nfs/dbraw/zinc/31/84/79/1047318479.db2.gz VSDRSZALLATAIA-GFCCVEGCSA-N 1 2 303.789 4.262 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1cccc2c1OCO2 ZINC001141960552 1047318495 /nfs/dbraw/zinc/31/84/95/1047318495.db2.gz VSDRSZALLATAIA-GFCCVEGCSA-N 1 2 303.789 4.262 20 0 DIADLO C[N@H+](Cc1cc(-c2ccccc2)n[nH]1)Cc1scnc1C1CC1 ZINC000898119044 1047319626 /nfs/dbraw/zinc/31/96/26/1047319626.db2.gz FIKILYNLMYZDGZ-UHFFFAOYSA-N 1 2 324.453 4.043 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccccc2)n[nH]1)Cc1scnc1C1CC1 ZINC000898119044 1047319642 /nfs/dbraw/zinc/31/96/42/1047319642.db2.gz FIKILYNLMYZDGZ-UHFFFAOYSA-N 1 2 324.453 4.043 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@@H](C)c1cccc(O)c1F)CCC2 ZINC001119067025 1047322212 /nfs/dbraw/zinc/32/22/12/1047322212.db2.gz ZKIAAASWEBXLIC-SWLSCSKDSA-N 1 2 317.408 4.037 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1ccc(-c2ccccc2)cn1 ZINC000651738205 1047324382 /nfs/dbraw/zinc/32/43/82/1047324382.db2.gz FBUZSONREKSDBU-LIRRHRJNSA-N 1 2 318.424 4.200 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1ccc(-c2ccccc2)cn1 ZINC000651738205 1047324397 /nfs/dbraw/zinc/32/43/97/1047324397.db2.gz FBUZSONREKSDBU-LIRRHRJNSA-N 1 2 318.424 4.200 20 0 DIADLO CCc1nc(C)c(C[NH2+][C@@H]2CCc3ccc(F)c(Cl)c32)o1 ZINC000651816548 1047329482 /nfs/dbraw/zinc/32/94/82/1047329482.db2.gz ZJPPTHZEEPSIII-GFCCVEGCSA-N 1 2 308.784 4.115 20 0 DIADLO O=C1CCC[N@H+](Cc2sccc2Oc2ccccc2)CC1 ZINC001141996690 1047337708 /nfs/dbraw/zinc/33/77/08/1047337708.db2.gz FCYRAHBWPZKPGQ-UHFFFAOYSA-N 1 2 301.411 4.095 20 0 DIADLO O=C1CCC[N@@H+](Cc2sccc2Oc2ccccc2)CC1 ZINC001141996690 1047337712 /nfs/dbraw/zinc/33/77/12/1047337712.db2.gz FCYRAHBWPZKPGQ-UHFFFAOYSA-N 1 2 301.411 4.095 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(-c3cccs3)s2)C2(CCC2)CO1 ZINC000651974808 1047338074 /nfs/dbraw/zinc/33/80/74/1047338074.db2.gz QCJOZBKFNMHRMW-GFCCVEGCSA-N 1 2 320.483 4.015 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(-c3cccs3)s2)C2(CCC2)CO1 ZINC000651974808 1047338085 /nfs/dbraw/zinc/33/80/85/1047338085.db2.gz QCJOZBKFNMHRMW-GFCCVEGCSA-N 1 2 320.483 4.015 20 0 DIADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1sccc1Oc1ccccc1 ZINC001142000936 1047339248 /nfs/dbraw/zinc/33/92/48/1047339248.db2.gz BUYQJMJMYBPENJ-INIZCTEOSA-N 1 2 315.438 4.484 20 0 DIADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1sccc1Oc1ccccc1 ZINC001142000936 1047339260 /nfs/dbraw/zinc/33/92/60/1047339260.db2.gz BUYQJMJMYBPENJ-INIZCTEOSA-N 1 2 315.438 4.484 20 0 DIADLO CC(C)c1nn(C[N@H+](CC2CCCCC2)C2CC2)c(=S)n1C ZINC000726181561 1047339406 /nfs/dbraw/zinc/33/94/06/1047339406.db2.gz ZUSQLZLGYNRDEQ-UHFFFAOYSA-N 1 2 322.522 4.077 20 0 DIADLO CC(C)c1nn(C[N@@H+](CC2CCCCC2)C2CC2)c(=S)n1C ZINC000726181561 1047339418 /nfs/dbraw/zinc/33/94/18/1047339418.db2.gz ZUSQLZLGYNRDEQ-UHFFFAOYSA-N 1 2 322.522 4.077 20 0 DIADLO c1cc(Oc2ccccc2)c(C[N@@H+]2CCc3ccncc3C2)s1 ZINC001142000980 1047339461 /nfs/dbraw/zinc/33/94/61/1047339461.db2.gz DDAADYLVDIKVHY-UHFFFAOYSA-N 1 2 322.433 4.494 20 0 DIADLO c1cc(Oc2ccccc2)c(C[N@H+]2CCc3ccncc3C2)s1 ZINC001142000980 1047339478 /nfs/dbraw/zinc/33/94/78/1047339478.db2.gz DDAADYLVDIKVHY-UHFFFAOYSA-N 1 2 322.433 4.494 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](Cc2ccccc2)c2nccn2C)oc1C ZINC000652275616 1047353179 /nfs/dbraw/zinc/35/31/79/1047353179.db2.gz SJLZKBKIJIYELU-YJBOKZPZSA-N 1 2 323.440 4.265 20 0 DIADLO CC[C@H](Nc1cc(COC)cc[nH+]1)c1cc(Cl)ccc1OC ZINC000652330240 1047354732 /nfs/dbraw/zinc/35/47/32/1047354732.db2.gz ADCNIRLPUMZYSU-HNNXBMFYSA-N 1 2 320.820 4.453 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2sc(C(C)(C)C)nc2C)c1 ZINC000652330586 1047355358 /nfs/dbraw/zinc/35/53/58/1047355358.db2.gz KDGVOJSYWKBRLW-NSHDSACASA-N 1 2 319.474 4.464 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CCCc3ccc(SC)cc32)c1 ZINC000652331566 1047356871 /nfs/dbraw/zinc/35/68/71/1047356871.db2.gz LIHQIBUMJJJBDV-QGZVFWFLSA-N 1 2 314.454 4.439 20 0 DIADLO CCCCc1oc2ccccc2c1C[N@H+](C)Cc1nccn1C ZINC000057621394 1047359458 /nfs/dbraw/zinc/35/94/58/1047359458.db2.gz QQOZBDODMXATRB-UHFFFAOYSA-N 1 2 311.429 4.141 20 0 DIADLO CCCCc1oc2ccccc2c1C[N@@H+](C)Cc1nccn1C ZINC000057621394 1047359466 /nfs/dbraw/zinc/35/94/66/1047359466.db2.gz QQOZBDODMXATRB-UHFFFAOYSA-N 1 2 311.429 4.141 20 0 DIADLO Cc1cc(OCc2nc(CC(C)C)no2)c2cccc(C)c2[nH+]1 ZINC000537542719 1047364969 /nfs/dbraw/zinc/36/49/69/1047364969.db2.gz DDFCUHXZUFZUAV-UHFFFAOYSA-N 1 2 311.385 4.012 20 0 DIADLO CC(C)c1ccc(-c2nc(C[N@H+](C)[C@H]3CCOC3)cs2)cc1 ZINC000106881372 1047369118 /nfs/dbraw/zinc/36/91/18/1047369118.db2.gz ZMTHBJZEBANLHZ-KRWDZBQOSA-N 1 2 316.470 4.154 20 0 DIADLO CC(C)c1ccc(-c2nc(C[N@@H+](C)[C@H]3CCOC3)cs2)cc1 ZINC000106881372 1047369129 /nfs/dbraw/zinc/36/91/29/1047369129.db2.gz ZMTHBJZEBANLHZ-KRWDZBQOSA-N 1 2 316.470 4.154 20 0 DIADLO Oc1cc(Cl)c(C[N@@H+]2CCC[C@H](C(F)F)C2)c(Cl)c1 ZINC001142114418 1047382340 /nfs/dbraw/zinc/38/23/40/1047382340.db2.gz HRHNWXKDBHHSKW-QMMMGPOBSA-N 1 2 310.171 4.176 20 0 DIADLO Oc1cc(Cl)c(C[N@H+]2CCC[C@H](C(F)F)C2)c(Cl)c1 ZINC001142114418 1047382349 /nfs/dbraw/zinc/38/23/49/1047382349.db2.gz HRHNWXKDBHHSKW-QMMMGPOBSA-N 1 2 310.171 4.176 20 0 DIADLO Oc1cc(Cl)c(C[NH+]2CC(c3ccccc3)C2)c(Cl)c1 ZINC001142114268 1047383226 /nfs/dbraw/zinc/38/32/26/1047383226.db2.gz DKMXIIVNUUUQLR-UHFFFAOYSA-N 1 2 308.208 4.298 20 0 DIADLO COCC[N@H+](Cc1ccc(C)cc1C)Cc1cccnc1Cl ZINC000726969472 1047396676 /nfs/dbraw/zinc/39/66/76/1047396676.db2.gz VUHOTORCMYOFCB-UHFFFAOYSA-N 1 2 318.848 4.000 20 0 DIADLO COCC[N@@H+](Cc1ccc(C)cc1C)Cc1cccnc1Cl ZINC000726969472 1047396688 /nfs/dbraw/zinc/39/66/88/1047396688.db2.gz VUHOTORCMYOFCB-UHFFFAOYSA-N 1 2 318.848 4.000 20 0 DIADLO C[C@@H](CC(F)(F)F)[N@@H+]1CCc2c(Br)cccc2C1 ZINC001255655309 1047398029 /nfs/dbraw/zinc/39/80/29/1047398029.db2.gz JRLJHOMSSFGKKT-VIFPVBQESA-N 1 2 322.168 4.148 20 0 DIADLO C[C@@H](CC(F)(F)F)[N@H+]1CCc2c(Br)cccc2C1 ZINC001255655309 1047398036 /nfs/dbraw/zinc/39/80/36/1047398036.db2.gz JRLJHOMSSFGKKT-VIFPVBQESA-N 1 2 322.168 4.148 20 0 DIADLO CC(C)(C)c1nc[nH]c1C[N@@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001142234526 1047412522 /nfs/dbraw/zinc/41/25/22/1047412522.db2.gz AGYPWXAPHLXSKP-HNNXBMFYSA-N 1 2 319.399 4.323 20 0 DIADLO CC(C)(C)c1nc[nH]c1C[N@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001142234526 1047412525 /nfs/dbraw/zinc/41/25/25/1047412525.db2.gz AGYPWXAPHLXSKP-HNNXBMFYSA-N 1 2 319.399 4.323 20 0 DIADLO Fc1ccccc1-c1nc(C[N@@H+]2CC[C@H]3[C@@H](C2)C3(F)F)cs1 ZINC001168311019 1047414044 /nfs/dbraw/zinc/41/40/44/1047414044.db2.gz XQBHINSZXOBLIZ-QWHCGFSZSA-N 1 2 324.371 4.036 20 0 DIADLO Fc1ccccc1-c1nc(C[N@H+]2CC[C@H]3[C@@H](C2)C3(F)F)cs1 ZINC001168311019 1047414050 /nfs/dbraw/zinc/41/40/50/1047414050.db2.gz XQBHINSZXOBLIZ-QWHCGFSZSA-N 1 2 324.371 4.036 20 0 DIADLO Cc1ccc(F)c(C[NH2+][C@H](COCC(C)C)c2ccco2)c1 ZINC000116915733 1047415228 /nfs/dbraw/zinc/41/52/28/1047415228.db2.gz KTGIIASBKRDLFG-QGZVFWFLSA-N 1 2 305.393 4.231 20 0 DIADLO CC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC001142247387 1047415490 /nfs/dbraw/zinc/41/54/90/1047415490.db2.gz XELYNCLWGQWVFI-YOEHRIQHSA-N 1 2 311.429 4.458 20 0 DIADLO CSc1ncc(C[N@H+](C)Cc2ccc(C)c(C)c2)c(Cl)n1 ZINC001142435730 1047448560 /nfs/dbraw/zinc/44/85/60/1047448560.db2.gz ONSMLNRPVWNZJK-UHFFFAOYSA-N 1 2 321.877 4.101 20 0 DIADLO CSc1ncc(C[N@@H+](C)Cc2ccc(C)c(C)c2)c(Cl)n1 ZINC001142435730 1047448566 /nfs/dbraw/zinc/44/85/66/1047448566.db2.gz ONSMLNRPVWNZJK-UHFFFAOYSA-N 1 2 321.877 4.101 20 0 DIADLO CCC1(CNc2[nH+]ccc3cccc(C(F)(F)F)c32)COC1 ZINC001168327695 1047457207 /nfs/dbraw/zinc/45/72/07/1047457207.db2.gz WBZZNBWFXRAISH-UHFFFAOYSA-N 1 2 310.319 4.092 20 0 DIADLO Cc1nc(CSCc2ccc(-n3cc[nH+]c3)cc2)sc1C ZINC000088309652 1047459252 /nfs/dbraw/zinc/45/92/52/1047459252.db2.gz YUUTVLKJFKDRCW-UHFFFAOYSA-N 1 2 315.467 4.379 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc(-c3ccccc3)[nH]2)[C@H]1c1ccccc1 ZINC000537622509 1047467567 /nfs/dbraw/zinc/46/75/67/1047467567.db2.gz ZXSBJEPXRKRQMI-HNAYVOBHSA-N 1 2 303.409 4.270 20 0 DIADLO CCCc1ccccc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001142588824 1047471405 /nfs/dbraw/zinc/47/14/05/1047471405.db2.gz HNFQRDQKBZPTID-UHFFFAOYSA-N 1 2 305.381 4.282 20 0 DIADLO CC(C)CO[C@@H]1CC[N@H+](Cc2csc(-c3cccs3)n2)C1 ZINC000119979245 1047477927 /nfs/dbraw/zinc/47/79/27/1047477927.db2.gz AEAVHMHJALEFHS-CQSZACIVSA-N 1 2 322.499 4.119 20 0 DIADLO CC(C)CO[C@@H]1CC[N@@H+](Cc2csc(-c3cccs3)n2)C1 ZINC000119979245 1047477932 /nfs/dbraw/zinc/47/79/32/1047477932.db2.gz AEAVHMHJALEFHS-CQSZACIVSA-N 1 2 322.499 4.119 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2csc(Cl)c2)c1OC ZINC001142775320 1047492944 /nfs/dbraw/zinc/49/29/44/1047492944.db2.gz AHQYEWPFVRFTEP-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2csc(Cl)c2)c1OC ZINC001142775320 1047492947 /nfs/dbraw/zinc/49/29/47/1047492947.db2.gz AHQYEWPFVRFTEP-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2csc(Cl)c2)c(OC)c1 ZINC001142770887 1047493575 /nfs/dbraw/zinc/49/35/75/1047493575.db2.gz KMRCTAMSDPSMMN-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2csc(Cl)c2)c(OC)c1 ZINC001142770887 1047493581 /nfs/dbraw/zinc/49/35/81/1047493581.db2.gz KMRCTAMSDPSMMN-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+][C@H](CN1CCCC1)c1ccccc1 ZINC000120826807 1047503276 /nfs/dbraw/zinc/50/32/76/1047503276.db2.gz BNYBLUMJZFAAKW-FXAWDEMLSA-N 1 2 324.468 4.183 20 0 DIADLO C[C@H]1CN(c2ccc([NH2+]C3CCC(F)(F)CC3)cc2)C[C@H](C)O1 ZINC000842862541 1047510112 /nfs/dbraw/zinc/51/01/12/1047510112.db2.gz RZYCMLYXYKWCHY-KBPBESRZSA-N 1 2 324.415 4.290 20 0 DIADLO COc1ccccc1C1([NH2+][C@@H](C)c2cccnc2Cl)CC1 ZINC000842903424 1047513971 /nfs/dbraw/zinc/51/39/71/1047513971.db2.gz PNUPVDVISRUEIQ-LBPRGKRZSA-N 1 2 302.805 4.084 20 0 DIADLO CCOc1ccc(C2=CC[N@H+](Cc3csc(C)n3)CC2)cc1 ZINC000091810475 1047523532 /nfs/dbraw/zinc/52/35/32/1047523532.db2.gz SKEXWZFVCQEPED-UHFFFAOYSA-N 1 2 314.454 4.140 20 0 DIADLO CCOc1ccc(C2=CC[N@@H+](Cc3csc(C)n3)CC2)cc1 ZINC000091810475 1047523536 /nfs/dbraw/zinc/52/35/36/1047523536.db2.gz SKEXWZFVCQEPED-UHFFFAOYSA-N 1 2 314.454 4.140 20 0 DIADLO CN(Cc1ccc2[nH+]ccn2c1)Cc1ccc(Cl)cc1Cl ZINC001143018113 1047524788 /nfs/dbraw/zinc/52/47/88/1047524788.db2.gz FWNAPXQXNSXEMT-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@H+](Cc1ccc2nccn2c1)Cc1ccc(Cl)cc1Cl ZINC001143018113 1047524793 /nfs/dbraw/zinc/52/47/93/1047524793.db2.gz FWNAPXQXNSXEMT-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1ccc2nccn2c1)Cc1ccc(Cl)cc1Cl ZINC001143018113 1047524800 /nfs/dbraw/zinc/52/48/00/1047524800.db2.gz FWNAPXQXNSXEMT-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO CC[N@H+](Cc1cc(-c2ccccc2)nn1C)Cc1ccccc1F ZINC001143016019 1047525057 /nfs/dbraw/zinc/52/50/57/1047525057.db2.gz SYSZJXPVWDQFFY-UHFFFAOYSA-N 1 2 323.415 4.248 20 0 DIADLO CC[N@@H+](Cc1cc(-c2ccccc2)nn1C)Cc1ccccc1F ZINC001143016019 1047525060 /nfs/dbraw/zinc/52/50/60/1047525060.db2.gz SYSZJXPVWDQFFY-UHFFFAOYSA-N 1 2 323.415 4.248 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1ncc(-c2ccccc2)s1 ZINC000091990467 1047526905 /nfs/dbraw/zinc/52/69/05/1047526905.db2.gz RYWVKFHDFKBAFM-CQSZACIVSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1ncc(-c2ccccc2)s1 ZINC000091990467 1047526909 /nfs/dbraw/zinc/52/69/09/1047526909.db2.gz RYWVKFHDFKBAFM-CQSZACIVSA-N 1 2 309.438 4.398 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CCC[N@@H+]1Cc1cc2cccnc2[nH]1 ZINC001143228564 1047543095 /nfs/dbraw/zinc/54/30/95/1047543095.db2.gz FPFMLPNMBQSIAJ-INIZCTEOSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CCC[N@H+]1Cc1cc2cccnc2[nH]1 ZINC001143228564 1047543100 /nfs/dbraw/zinc/54/31/00/1047543100.db2.gz FPFMLPNMBQSIAJ-INIZCTEOSA-N 1 2 313.351 4.178 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CCc3ncc(Cl)cc3C2)cc1 ZINC001143252686 1047544918 /nfs/dbraw/zinc/54/49/18/1047544918.db2.gz AJRPEWHDPHVZRR-UHFFFAOYSA-N 1 2 308.759 4.231 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CCc3ncc(Cl)cc3C2)cc1 ZINC001143252686 1047544922 /nfs/dbraw/zinc/54/49/22/1047544922.db2.gz AJRPEWHDPHVZRR-UHFFFAOYSA-N 1 2 308.759 4.231 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1c(F)cccc1F)CCC2 ZINC000093365220 1047545344 /nfs/dbraw/zinc/54/53/44/1047545344.db2.gz LUWNHYKIPAUWBS-OAHLLOKOSA-N 1 2 308.397 4.239 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1c(F)cccc1F)CCC2 ZINC000093365220 1047545349 /nfs/dbraw/zinc/54/53/49/1047545349.db2.gz LUWNHYKIPAUWBS-OAHLLOKOSA-N 1 2 308.397 4.239 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)c(F)c1F ZINC001143276666 1047547024 /nfs/dbraw/zinc/54/70/24/1047547024.db2.gz SVRIFYIMNFQHLC-HNNXBMFYSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@H]2c2ccncc2)c(F)c1F ZINC001143276666 1047547026 /nfs/dbraw/zinc/54/70/26/1047547026.db2.gz SVRIFYIMNFQHLC-HNNXBMFYSA-N 1 2 318.367 4.096 20 0 DIADLO Fc1ccc(Br)c(C[N@@H+]2CCC23CCCC3)c1F ZINC001143328371 1047552669 /nfs/dbraw/zinc/55/26/69/1047552669.db2.gz GGQYUWHDLJKALI-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1ccc(Br)c(C[N@H+]2CCC23CCCC3)c1F ZINC001143328371 1047552675 /nfs/dbraw/zinc/55/26/75/1047552675.db2.gz GGQYUWHDLJKALI-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO COc1c(F)ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c1F ZINC001143321190 1047553294 /nfs/dbraw/zinc/55/32/94/1047553294.db2.gz WRTQILQHAIOICI-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c1F ZINC001143321190 1047553300 /nfs/dbraw/zinc/55/33/00/1047553300.db2.gz WRTQILQHAIOICI-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1ccc(Br)c(C[N@@H+]2CC3CCC2CC3)c1F ZINC001143336180 1047554266 /nfs/dbraw/zinc/55/42/66/1047554266.db2.gz ZZKUGSKOSCBJLU-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1ccc(Br)c(C[N@H+]2CC3CCC2CC3)c1F ZINC001143336180 1047554271 /nfs/dbraw/zinc/55/42/71/1047554271.db2.gz ZZKUGSKOSCBJLU-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Cc1cc(N)c(Nc2ccc(C)[nH+]c2C)c(Br)c1 ZINC001203375268 1047605977 /nfs/dbraw/zinc/60/59/77/1047605977.db2.gz UVQZOWJTPFGTGG-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO CCC[C@](C)(CC)C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000476688900 1047565842 /nfs/dbraw/zinc/56/58/42/1047565842.db2.gz ACYOYGVAUQXZOJ-YJBOKZPZSA-N 1 2 322.518 4.170 20 0 DIADLO CC(C)CCNc1cccc(C[N@H+](C)Cc2cscn2)c1 ZINC000236741338 1047571977 /nfs/dbraw/zinc/57/19/77/1047571977.db2.gz POZIROVSVNISTI-UHFFFAOYSA-N 1 2 303.475 4.233 20 0 DIADLO CC(C)CCNc1cccc(C[N@@H+](C)Cc2cscn2)c1 ZINC000236741338 1047571980 /nfs/dbraw/zinc/57/19/80/1047571980.db2.gz POZIROVSVNISTI-UHFFFAOYSA-N 1 2 303.475 4.233 20 0 DIADLO Cc1c2cc(Cl)ccc2[nH]c1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001150726446 1047582181 /nfs/dbraw/zinc/58/21/81/1047582181.db2.gz OODKJRPNJMXWKC-UHFFFAOYSA-N 1 2 324.771 4.030 20 0 DIADLO CC[N@H+](Cc1ccn(C2CCCC2)n1)Cc1cccc(F)c1 ZINC000477144717 1047597561 /nfs/dbraw/zinc/59/75/61/1047597561.db2.gz OSLOBLKLXLIUHC-UHFFFAOYSA-N 1 2 301.409 4.159 20 0 DIADLO CC[N@@H+](Cc1ccn(C2CCCC2)n1)Cc1cccc(F)c1 ZINC000477144717 1047597566 /nfs/dbraw/zinc/59/75/66/1047597566.db2.gz OSLOBLKLXLIUHC-UHFFFAOYSA-N 1 2 301.409 4.159 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2ccn(C3CCCC3)n2)cc1 ZINC000477170605 1047601832 /nfs/dbraw/zinc/60/18/32/1047601832.db2.gz MWTVWJHVEYBZIZ-LJQANCHMSA-N 1 2 313.420 4.474 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2ccn(C3CCCC3)n2)cc1 ZINC000477170605 1047601837 /nfs/dbraw/zinc/60/18/37/1047601837.db2.gz MWTVWJHVEYBZIZ-LJQANCHMSA-N 1 2 313.420 4.474 20 0 DIADLO CCCCN(Cc1ccccc1)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001151969913 1047605359 /nfs/dbraw/zinc/60/53/59/1047605359.db2.gz GREYLNJYOGVIRZ-UHFFFAOYSA-N 1 2 307.397 4.005 20 0 DIADLO CC(C)c1ccc(C(=O)Nc2cc(N(C)C)cc[nH+]2)cc1Cl ZINC001152319880 1047610295 /nfs/dbraw/zinc/61/02/95/1047610295.db2.gz MTIGCFQPPVCLQN-UHFFFAOYSA-N 1 2 317.820 4.177 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1ccn(C2CCCC2)n1 ZINC000477301564 1047612229 /nfs/dbraw/zinc/61/22/29/1047612229.db2.gz JUKGXWVLOVTCDO-IBGZPJMESA-N 1 2 312.461 4.064 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1ccn(C2CCCC2)n1 ZINC000477301564 1047612233 /nfs/dbraw/zinc/61/22/33/1047612233.db2.gz JUKGXWVLOVTCDO-IBGZPJMESA-N 1 2 312.461 4.064 20 0 DIADLO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cscc1Br)CO2 ZINC000552012516 1047637602 /nfs/dbraw/zinc/63/76/02/1047637602.db2.gz ZZLWHJZIBBUFEI-ZDUSSCGKSA-N 1 2 324.243 4.042 20 0 DIADLO CCCCc1noc(C[N@H+]2CC=C(c3cccc(C)c3)CC2)n1 ZINC000537840948 1047640016 /nfs/dbraw/zinc/64/00/16/1047640016.db2.gz HUJLQCXFHKJHCZ-UHFFFAOYSA-N 1 2 311.429 4.010 20 0 DIADLO CCCCc1noc(C[N@@H+]2CC=C(c3cccc(C)c3)CC2)n1 ZINC000537840948 1047640021 /nfs/dbraw/zinc/64/00/21/1047640021.db2.gz HUJLQCXFHKJHCZ-UHFFFAOYSA-N 1 2 311.429 4.010 20 0 DIADLO FC(F)Oc1cccc(CNc2cc3ccccc3c[nH+]2)c1 ZINC001154667795 1047654402 /nfs/dbraw/zinc/65/44/02/1047654402.db2.gz FKRWYOBLQZXNLZ-UHFFFAOYSA-N 1 2 300.308 4.448 20 0 DIADLO C[C@@H](Nc1[nH+]ccc2cc(Cl)ccc21)c1nnc2ccccn21 ZINC001154806661 1047658259 /nfs/dbraw/zinc/65/82/59/1047658259.db2.gz BDYUCIADEOTCOB-LLVKDONJSA-N 1 2 323.787 4.104 20 0 DIADLO Cc1cc(NCc2cnccc2C(F)(F)F)nc(C(C)(C)C)[nH+]1 ZINC001154903527 1047661442 /nfs/dbraw/zinc/66/14/42/1047661442.db2.gz SWEMGAJKTDDZKT-UHFFFAOYSA-N 1 2 324.350 4.108 20 0 DIADLO CC[C@@H](C)[C@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000538192991 1047662684 /nfs/dbraw/zinc/66/26/84/1047662684.db2.gz NXFGWKJHTTWHPV-BZNIZROVSA-N 1 2 319.836 4.477 20 0 DIADLO Cn1cc(C[N@H+](C)Cc2ccccc2Cl)c(C(C)(C)C)n1 ZINC000538307606 1047666386 /nfs/dbraw/zinc/66/63/86/1047666386.db2.gz CSTJIKDPGSCXGP-UHFFFAOYSA-N 1 2 305.853 4.003 20 0 DIADLO Cn1cc(C[N@@H+](C)Cc2ccccc2Cl)c(C(C)(C)C)n1 ZINC000538307606 1047666389 /nfs/dbraw/zinc/66/63/89/1047666389.db2.gz CSTJIKDPGSCXGP-UHFFFAOYSA-N 1 2 305.853 4.003 20 0 DIADLO COc1cc2ccc(NC[C@H]3CCC(F)(F)C3)[nH+]c2cc1OC ZINC001155172279 1047670013 /nfs/dbraw/zinc/67/00/13/1047670013.db2.gz BMMMWQZRYRCFJV-NSHDSACASA-N 1 2 322.355 4.099 20 0 DIADLO Fc1ccc2c(c1)[nH]c1nc[nH+]c(NC[C@H]3CCC(F)(F)C3)c21 ZINC001155176141 1047670933 /nfs/dbraw/zinc/67/09/33/1047670933.db2.gz RBZYQXDCHZMYHX-VIFPVBQESA-N 1 2 320.318 4.098 20 0 DIADLO COC(=O)c1ccc(-c2ccc(N3CCC[C@@H](C)C3)[nH+]c2C)cc1 ZINC001155208544 1047671622 /nfs/dbraw/zinc/67/16/22/1047671622.db2.gz UEZWZBFOJAFYKY-CQSZACIVSA-N 1 2 324.424 4.080 20 0 DIADLO Cc1c(F)cc[nH+]c1N1CCC(n2ccc3ccccc32)CC1 ZINC001155254042 1047673426 /nfs/dbraw/zinc/67/34/26/1047673426.db2.gz XXBXRTKCEUWLDS-UHFFFAOYSA-N 1 2 309.388 4.325 20 0 DIADLO Cc1cc(NCc2cn(C)c3ccccc23)nc(C(C)(C)C)[nH+]1 ZINC001155286917 1047675643 /nfs/dbraw/zinc/67/56/43/1047675643.db2.gz LLCARLLCCYFOBO-UHFFFAOYSA-N 1 2 308.429 4.186 20 0 DIADLO Cc1ccc(CNc2cc(-c3ccnc(Cl)c3)cc[nH+]2)cn1 ZINC001155314930 1047676657 /nfs/dbraw/zinc/67/66/57/1047676657.db2.gz NPUROGVIBTZUKQ-UHFFFAOYSA-N 1 2 310.788 4.113 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@@H]2COc3ccc(Cl)cc32)o1 ZINC000538426024 1047677863 /nfs/dbraw/zinc/67/78/63/1047677863.db2.gz UJSWTWPVTBTRGF-RIEGTJTDSA-N 1 2 303.789 4.280 20 0 DIADLO C[C@H]1CN(c2cc(N)cc(Cl)[nH+]2)CCc2ccc(Cl)cc21 ZINC001155457619 1047681886 /nfs/dbraw/zinc/68/18/86/1047681886.db2.gz KSSCHDGXCANUNI-JTQLQIEISA-N 1 2 322.239 4.137 20 0 DIADLO CCCc1cc(N2CCc3c4ccccc4oc3C2)nc(C)[nH+]1 ZINC001155511499 1047683157 /nfs/dbraw/zinc/68/31/57/1047683157.db2.gz MPYMBDOBIXGTFC-UHFFFAOYSA-N 1 2 307.397 4.046 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2csc(C(C)C)n2)c1 ZINC000538525023 1047683297 /nfs/dbraw/zinc/68/32/97/1047683297.db2.gz NFMJRHYGFCAFGG-UHFFFAOYSA-N 1 2 308.472 4.412 20 0 DIADLO Cc1nc(N2CCc3c4ccccc4oc3C2)cc(C(C)C)[nH+]1 ZINC001155500047 1047683337 /nfs/dbraw/zinc/68/33/37/1047683337.db2.gz YDANOACSOASCTC-UHFFFAOYSA-N 1 2 307.397 4.217 20 0 DIADLO COc1cc(Cl)cc(NC(=[NH2+])C23CC4CC(CC(C4)C2)C3)n1 ZINC001155959588 1047693121 /nfs/dbraw/zinc/69/31/21/1047693121.db2.gz KYBLBVLNJBWYHM-UHFFFAOYSA-N 1 2 319.836 4.349 20 0 DIADLO COc1cnc(NC(=[NH2+])C23CC4CC(CC(C4)C2)C3)c(Cl)c1 ZINC001155959161 1047693136 /nfs/dbraw/zinc/69/31/36/1047693136.db2.gz IFOVECMZWOCAPR-UHFFFAOYSA-N 1 2 319.836 4.349 20 0 DIADLO Cc1cc(Cl)c(C)c(N(C)CCC(=O)c2cccs2)[nH+]1 ZINC001155966820 1047693577 /nfs/dbraw/zinc/69/35/77/1047693577.db2.gz UQPZSSUADWPZIA-UHFFFAOYSA-N 1 2 308.834 4.123 20 0 DIADLO COc1cc2c(cc1F)C[N@@H+]([C@H](C)c1ccccc1F)CC2 ZINC000538638481 1047693726 /nfs/dbraw/zinc/69/37/26/1047693726.db2.gz FLHRGJQIDIRDEE-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc2c(cc1F)C[N@H+]([C@H](C)c1ccccc1F)CC2 ZINC000538638481 1047693729 /nfs/dbraw/zinc/69/37/29/1047693729.db2.gz FLHRGJQIDIRDEE-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO C[C@@H]1CCc2nnc(NC(=[NH2+])C34CC5CC(CC(C5)C3)C4)cc2C1 ZINC001155962489 1047693738 /nfs/dbraw/zinc/69/37/38/1047693738.db2.gz PRUJKYHOCTWZDH-JSFDKUKPSA-N 1 2 324.472 4.207 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H](C3CCC3)C2)c(C)[nH+]1 ZINC000667119040 1047694433 /nfs/dbraw/zinc/69/44/33/1047694433.db2.gz GPZJXDVFBXPUIG-MRXNPFEDSA-N 1 2 301.434 4.051 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC(C3CCC3)CC2)c(C)[nH+]1 ZINC000667119051 1047694932 /nfs/dbraw/zinc/69/49/32/1047694932.db2.gz HIGNSTBSEOUJQU-UHFFFAOYSA-N 1 2 301.434 4.051 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC(c3ccco3)CC2)c(C)[nH+]1 ZINC000667119273 1047695517 /nfs/dbraw/zinc/69/55/17/1047695517.db2.gz NPMFGFDFUXNRPH-UHFFFAOYSA-N 1 2 313.401 4.011 20 0 DIADLO CSc1nc(NC2CCC(C(F)(F)F)CC2)cc(C)[nH+]1 ZINC001156416226 1047711784 /nfs/dbraw/zinc/71/17/84/1047711784.db2.gz ZLTNQFNFROCHKN-UHFFFAOYSA-N 1 2 305.369 4.040 20 0 DIADLO c1ccc(-c2cc[nH+]c(N3CCC[C@@H]3c3ccccn3)c2)cc1 ZINC001156027657 1047697175 /nfs/dbraw/zinc/69/71/75/1047697175.db2.gz YYWIJMCCUYRDKP-LJQANCHMSA-N 1 2 301.393 4.485 20 0 DIADLO COc1ccc(O[C@H](C)CNc2cc3ccccc3c[nH+]2)cc1 ZINC001156077207 1047698409 /nfs/dbraw/zinc/69/84/09/1047698409.db2.gz ZSUSZAVOUCLGKR-CQSZACIVSA-N 1 2 308.381 4.123 20 0 DIADLO C[N@H+](Cc1ccon1)Cc1ccc(F)c(-c2cccs2)c1 ZINC000538720306 1047699172 /nfs/dbraw/zinc/69/91/72/1047699172.db2.gz RZYFNYDAQDSUMV-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1ccon1)Cc1ccc(F)c(-c2cccs2)c1 ZINC000538720306 1047699175 /nfs/dbraw/zinc/69/91/75/1047699175.db2.gz RZYFNYDAQDSUMV-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO Cc1ccoc1C[N@H+]1C[C@H](c2ccccc2Cl)OC[C@H]1C ZINC000538729392 1047702439 /nfs/dbraw/zinc/70/24/39/1047702439.db2.gz MBKQMXPFOAUJDS-CXAGYDPISA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccoc1C[N@@H+]1C[C@H](c2ccccc2Cl)OC[C@H]1C ZINC000538729392 1047702444 /nfs/dbraw/zinc/70/24/44/1047702444.db2.gz MBKQMXPFOAUJDS-CXAGYDPISA-N 1 2 305.805 4.203 20 0 DIADLO COc1ccc(CCCNc2[nH+]cc(SC)cc2C)cc1 ZINC001156168451 1047703885 /nfs/dbraw/zinc/70/38/85/1047703885.db2.gz CIYLEVVNWSKDPX-UHFFFAOYSA-N 1 2 302.443 4.165 20 0 DIADLO CC(C)c1ccc(CN2CC[NH+]([C@@H](C)c3cccnc3)CC2)cc1 ZINC000538739721 1047704258 /nfs/dbraw/zinc/70/42/58/1047704258.db2.gz ULMATDSWPLPSAF-SFHVURJKSA-N 1 2 323.484 4.084 20 0 DIADLO CCCCC/C(=C\c1ccccc1)C[N@@H+]1CCn2nc(C)nc2C1 ZINC000538736780 1047704417 /nfs/dbraw/zinc/70/44/17/1047704417.db2.gz COTKCCVCILLWJA-XMHGGMMESA-N 1 2 324.472 4.066 20 0 DIADLO CCCCC/C(=C\c1ccccc1)C[N@H+]1CCn2nc(C)nc2C1 ZINC000538736780 1047704423 /nfs/dbraw/zinc/70/44/23/1047704423.db2.gz COTKCCVCILLWJA-XMHGGMMESA-N 1 2 324.472 4.066 20 0 DIADLO Cc1cc(NCCSCc2ccco2)nc(C(C)(C)C)[nH+]1 ZINC001156192196 1047705644 /nfs/dbraw/zinc/70/56/44/1047705644.db2.gz VWWYRYYTTIKBLZ-UHFFFAOYSA-N 1 2 305.447 4.021 20 0 DIADLO CCOC(=O)c1cnc2c(cccc2Nc2ccc(C)[nH+]c2C)c1 ZINC001203376558 1047708061 /nfs/dbraw/zinc/70/80/61/1047708061.db2.gz OHRPIJLMCHURBY-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)cc1 ZINC000538752829 1047708486 /nfs/dbraw/zinc/70/84/86/1047708486.db2.gz PBFXWOOLZOUQGB-CXAGYDPISA-N 1 2 319.495 4.432 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)cc1 ZINC000538752829 1047708489 /nfs/dbraw/zinc/70/84/89/1047708489.db2.gz PBFXWOOLZOUQGB-CXAGYDPISA-N 1 2 319.495 4.432 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+](C)[C@@H](C)c2ccncc2)o1 ZINC000538782412 1047712597 /nfs/dbraw/zinc/71/25/97/1047712597.db2.gz KXOVOMCMTUMWMC-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+](C)[C@@H](C)c2ccncc2)o1 ZINC000538782412 1047712605 /nfs/dbraw/zinc/71/26/05/1047712605.db2.gz KXOVOMCMTUMWMC-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO C[C@@H]1CCCN(c2cc(NCc3ccccc3C3CC3)[nH+]cn2)C1 ZINC001156544866 1047717654 /nfs/dbraw/zinc/71/76/54/1047717654.db2.gz WKYQDZIKDLFJDD-OAHLLOKOSA-N 1 2 322.456 4.202 20 0 DIADLO C[C@@H]1CCCN(c2cc(NCc3ccccc3C3CC3)nc[nH+]2)C1 ZINC001156544866 1047717659 /nfs/dbraw/zinc/71/76/59/1047717659.db2.gz WKYQDZIKDLFJDD-OAHLLOKOSA-N 1 2 322.456 4.202 20 0 DIADLO CC(C)c1ccc(N2CCOC[C@H]2c2ccc(Cl)cc2)[nH+]c1 ZINC001156728285 1047721101 /nfs/dbraw/zinc/72/11/01/1047721101.db2.gz QXZQXNJQRVIJIB-KRWDZBQOSA-N 1 2 316.832 4.436 20 0 DIADLO CN(Cc1ccc(-n2ccnc2)cc1)c1cc2ccccc2c[nH+]1 ZINC001156776040 1047722104 /nfs/dbraw/zinc/72/21/04/1047722104.db2.gz TXXSIGYIQCFIBF-UHFFFAOYSA-N 1 2 314.392 4.057 20 0 DIADLO CC(C)C[C@H](C(=O)N[C@H](C)c1ccccc1Cl)n1cc[nH+]c1 ZINC001156782403 1047722518 /nfs/dbraw/zinc/72/25/18/1047722518.db2.gz JRZKAJRHIFEUFX-CZUORRHYSA-N 1 2 319.836 4.001 20 0 DIADLO CC(C)c1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)c(F)c2)[nH]1 ZINC000539047206 1047731605 /nfs/dbraw/zinc/73/16/05/1047731605.db2.gz UFOKYNDLINKIAU-NXEZZACHSA-N 1 2 310.804 4.132 20 0 DIADLO CC(C)c1nnc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)c(F)c2)[nH]1 ZINC000539047219 1047731974 /nfs/dbraw/zinc/73/19/74/1047731974.db2.gz UFOKYNDLINKIAU-ZJUUUORDSA-N 1 2 310.804 4.132 20 0 DIADLO OCC1(Nc2cc(SCc3ccccc3)cc[nH+]2)CCCC1 ZINC001157008441 1047732625 /nfs/dbraw/zinc/73/26/25/1047732625.db2.gz LGHRNLHYEYSMEN-UHFFFAOYSA-N 1 2 314.454 4.091 20 0 DIADLO Cc1ccc(Nc2ccccc2-c2nc(CO)cs2)c(C)[nH+]1 ZINC001203379622 1047734900 /nfs/dbraw/zinc/73/49/00/1047734900.db2.gz DELSXTDBXAYECY-UHFFFAOYSA-N 1 2 311.410 4.058 20 0 DIADLO Cc1ccc(Nc2ccc3c(c2)C(C)(C)CC(=O)N3C)c(C)[nH+]1 ZINC001203379498 1047734912 /nfs/dbraw/zinc/73/49/12/1047734912.db2.gz BIQCZKWWPGKILW-UHFFFAOYSA-N 1 2 309.413 4.086 20 0 DIADLO CC(=O)Nc1c(C)cc[nH+]c1N(C)[C@H](C)c1ccccc1Cl ZINC001157367917 1047741331 /nfs/dbraw/zinc/74/13/31/1047741331.db2.gz PQXYXXBVHMDGLV-GFCCVEGCSA-N 1 2 317.820 4.199 20 0 DIADLO CC(=O)Nc1c(C)cc[nH+]c1N(C)[C@@H](C)c1ccccc1Cl ZINC001157367918 1047741534 /nfs/dbraw/zinc/74/15/34/1047741534.db2.gz PQXYXXBVHMDGLV-LBPRGKRZSA-N 1 2 317.820 4.199 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2cccs2)C(CC)CC)no1 ZINC000539279123 1047744482 /nfs/dbraw/zinc/74/44/82/1047744482.db2.gz DANFCXRZGCRCKR-INIZCTEOSA-N 1 2 307.463 4.351 20 0 DIADLO Fc1cc(Nc2cccc(-n3cc[nH+]c3)c2)cc(C(F)(F)F)n1 ZINC001213008804 1047744522 /nfs/dbraw/zinc/74/45/22/1047744522.db2.gz DFZSVECATIKKNS-UHFFFAOYSA-N 1 2 322.265 4.169 20 0 DIADLO Fc1ccccc1[C@H]([NH2+]Cc1nnc(C2CC2)o1)C1CCCC1 ZINC000539327187 1047748467 /nfs/dbraw/zinc/74/84/67/1047748467.db2.gz VXYAEQGKEXVSPQ-QGZVFWFLSA-N 1 2 315.392 4.107 20 0 DIADLO FC(F)(F)[C@@H](Nc1[nH+]ccc2ccccc21)c1ccccn1 ZINC001157684856 1047749262 /nfs/dbraw/zinc/74/92/62/1047749262.db2.gz RAEDUEBHJYPQIA-AWEZNQCLSA-N 1 2 303.287 4.345 20 0 DIADLO COc1ccc(C2=CCN(c3cccc(C4CC4)[nH+]3)CC2)cc1 ZINC001157734031 1047751770 /nfs/dbraw/zinc/75/17/70/1047751770.db2.gz UPGGAIYTIPDKJS-UHFFFAOYSA-N 1 2 306.409 4.261 20 0 DIADLO Cc1ccc(Nc2cccc(F)c2OC[C@H]2CCCO2)c(C)[nH+]1 ZINC001203380078 1047760362 /nfs/dbraw/zinc/76/03/62/1047760362.db2.gz HDOAECNEKSRSPQ-CQSZACIVSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C1C[C@@H](C)C[C@H](C)C1 ZINC000477990222 1047762778 /nfs/dbraw/zinc/76/27/78/1047762778.db2.gz KBPYNTSMIUXOCA-STQMWFEESA-N 1 2 311.429 4.396 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C1C[C@H](C)C[C@@H](C)C1 ZINC000477990220 1047762805 /nfs/dbraw/zinc/76/28/05/1047762805.db2.gz KBPYNTSMIUXOCA-CHWSQXEVSA-N 1 2 311.429 4.396 20 0 DIADLO COc1ccc2[nH+]c(NCCCCc3ccccn3)c(C)cc2c1 ZINC001157967880 1047764863 /nfs/dbraw/zinc/76/48/63/1047764863.db2.gz WOYCUSUQPCRBBQ-UHFFFAOYSA-N 1 2 321.424 4.382 20 0 DIADLO COc1cc2ccc(N[C@@H](C)c3ccc(C)cn3)[nH+]c2cc1OC ZINC001158019652 1047767370 /nfs/dbraw/zinc/76/73/70/1047767370.db2.gz ICGAJEOSAIACIM-ZDUSSCGKSA-N 1 2 323.396 4.129 20 0 DIADLO c1cnn(-c2ccccc2CNc2cc3ccccc3c[nH+]2)c1 ZINC001158112188 1047769828 /nfs/dbraw/zinc/76/98/28/1047769828.db2.gz ANENVYNOANXJPZ-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO Cc1cc(Cl)c(C)c(NCc2ccccc2-n2cccn2)[nH+]1 ZINC001158116590 1047769960 /nfs/dbraw/zinc/76/99/60/1047769960.db2.gz HQAFQRSSOFPJTM-UHFFFAOYSA-N 1 2 312.804 4.150 20 0 DIADLO Cc1ccc(CCCNc2cc(-c3ccccc3)cc[nH+]2)cn1 ZINC001158373399 1047776916 /nfs/dbraw/zinc/77/69/16/1047776916.db2.gz QHHLCGKFFSQOIJ-UHFFFAOYSA-N 1 2 303.409 4.497 20 0 DIADLO COc1ccc[nH+]c1NCCCc1ccc(C(F)(F)F)cc1 ZINC001158460520 1047779922 /nfs/dbraw/zinc/77/99/22/1047779922.db2.gz NMCSLJICGKLDAB-UHFFFAOYSA-N 1 2 310.319 4.154 20 0 DIADLO COC(=O)/C=C/c1cc(C)c[nH+]c1N[C@@H]1C[C@H](C)c2ccccc21 ZINC001158472939 1047783573 /nfs/dbraw/zinc/78/35/73/1047783573.db2.gz OHUZXMSIHOOYHA-MFUPGOHSSA-N 1 2 322.408 4.237 20 0 DIADLO C[C@H]1C[C@H](Nc2cc(N3CCC[C@@H](C)C3)nc[nH+]2)c2ccccc21 ZINC001158476631 1047784651 /nfs/dbraw/zinc/78/46/51/1047784651.db2.gz MAPYGWMTFUZMAS-VKJFTORMSA-N 1 2 322.456 4.373 20 0 DIADLO C[C@H]1C[C@H](Nc2cc(N3CCC[C@@H](C)C3)[nH+]cn2)c2ccccc21 ZINC001158476631 1047784654 /nfs/dbraw/zinc/78/46/54/1047784654.db2.gz MAPYGWMTFUZMAS-VKJFTORMSA-N 1 2 322.456 4.373 20 0 DIADLO C[C@H](CNc1[nH+]cnc2[nH]c3ccccc3c21)c1ccc(O)cc1 ZINC001158606441 1047790464 /nfs/dbraw/zinc/79/04/64/1047790464.db2.gz RAQHTFLCBSVXHZ-GFCCVEGCSA-N 1 2 318.380 4.032 20 0 DIADLO Cc1ccc(Nc2c(F)cccc2OC[C@@H]2CCCO2)c(C)[nH+]1 ZINC001203380721 1047792581 /nfs/dbraw/zinc/79/25/81/1047792581.db2.gz MQQKAPKSDVJNPN-AWEZNQCLSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1ccc(Nc2c(F)cccc2OC2CCOCC2)c(C)[nH+]1 ZINC001203380681 1047792645 /nfs/dbraw/zinc/79/26/45/1047792645.db2.gz LTYKIIRZFAVKTA-UHFFFAOYSA-N 1 2 316.376 4.139 20 0 DIADLO COCc1ccc(Br)c(Nc2ccc(C)[nH+]c2C)c1 ZINC001203380985 1047793208 /nfs/dbraw/zinc/79/32/08/1047793208.db2.gz OHAFJDBFHZXVGP-UHFFFAOYSA-N 1 2 321.218 4.351 20 0 DIADLO CSCc1ccc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)[nH+]c1 ZINC001158795299 1047799517 /nfs/dbraw/zinc/79/95/17/1047799517.db2.gz AYNIEYWDVBDZAB-IAGOWNOFSA-N 1 2 314.454 4.277 20 0 DIADLO CSc1cc[nH+]c(N[C@@H]2CCO[C@@H](c3ccccc3)C2)c1 ZINC001158795854 1047799546 /nfs/dbraw/zinc/79/95/46/1047799546.db2.gz OVKXWTCFODYRRI-GDBMZVCRSA-N 1 2 300.427 4.136 20 0 DIADLO Nc1[nH+]c(NC/C(=C/F)CCc2ccc(F)cc2)ccc1Cl ZINC001159051222 1047809100 /nfs/dbraw/zinc/80/91/00/1047809100.db2.gz HHHNATCLPVGKBR-FMIVXFBMSA-N 1 2 323.774 4.354 20 0 DIADLO CC1(C)[C@H](Nc2cc[nH+]c3c(Cl)cccc23)[C@H]2CCO[C@H]21 ZINC000553076049 1047821467 /nfs/dbraw/zinc/82/14/67/1047821467.db2.gz BQOYTFBATUNCLD-HFBAOOFYSA-N 1 2 302.805 4.114 20 0 DIADLO COc1cc(Oc2ccccc2)ccc1Nc1ccc(N)[nH+]c1 ZINC001159282098 1047825397 /nfs/dbraw/zinc/82/53/97/1047825397.db2.gz MUOOJBFKLUUIDF-UHFFFAOYSA-N 1 2 307.353 4.208 20 0 DIADLO C[C@@H](Nc1cc(N2CCCC2)nc[nH+]1)c1c(F)cccc1Cl ZINC000553150755 1047827399 /nfs/dbraw/zinc/82/73/99/1047827399.db2.gz CVWYLKGOXBUEJH-LLVKDONJSA-N 1 2 320.799 4.042 20 0 DIADLO C[C@@H](Nc1cc(N2CCCC2)[nH+]cn1)c1c(F)cccc1Cl ZINC000553150755 1047827406 /nfs/dbraw/zinc/82/74/06/1047827406.db2.gz CVWYLKGOXBUEJH-LLVKDONJSA-N 1 2 320.799 4.042 20 0 DIADLO FC(F)(F)c1ccccc1CC=Nc1cc([C@@H]2CCC[NH2+]2)no1 ZINC001159305717 1047828634 /nfs/dbraw/zinc/82/86/34/1047828634.db2.gz XZZIGNJMHJGUPX-XOVSCCBYSA-N 1 2 323.318 4.201 20 0 DIADLO Cc1cc(NC2CC(C)(C)OC(C)(C)C2)nc(C(C)(C)C)[nH+]1 ZINC001159324036 1047833950 /nfs/dbraw/zinc/83/39/50/1047833950.db2.gz QNDTZXQDASGCKV-UHFFFAOYSA-N 1 2 305.466 4.231 20 0 DIADLO CNc1ccc(Nc2ccn3cc(-c4ccccc4)nc3c2)c[nH+]1 ZINC001159372468 1047835967 /nfs/dbraw/zinc/83/59/67/1047835967.db2.gz SHIDVDNGKPAFLM-UHFFFAOYSA-N 1 2 315.380 4.182 20 0 DIADLO Fc1ccc2nc(C[NH2+]C3(c4ccc(Cl)cc4)CC3)oc2c1 ZINC000553333136 1047838339 /nfs/dbraw/zinc/83/83/39/1047838339.db2.gz FLOPEMCLURVMJZ-UHFFFAOYSA-N 1 2 316.763 4.399 20 0 DIADLO COC[C@H](C)CNc1ccc(Nc2cccc(SC)c2)c[nH+]1 ZINC001182781643 1047845810 /nfs/dbraw/zinc/84/58/10/1047845810.db2.gz MPERKNOAFAOITL-CYBMUJFWSA-N 1 2 317.458 4.242 20 0 DIADLO c1cn(Cc2ccc(Nc3ccc(N4CCCC4)cc3)cc2)c[nH+]1 ZINC001174526188 1047855387 /nfs/dbraw/zinc/85/53/87/1047855387.db2.gz KHBHMJZHULSTHP-UHFFFAOYSA-N 1 2 318.424 4.275 20 0 DIADLO Cc1ccc(Nc2ccc(OC[C@@H]3CCCO3)c(F)c2)c(C)[nH+]1 ZINC001203374042 1047857173 /nfs/dbraw/zinc/85/71/73/1047857173.db2.gz RIRZUMFWJYRVOT-HNNXBMFYSA-N 1 2 316.376 4.139 20 0 DIADLO c1cn(-c2ccc(Nc3ccc(N4CCCC4)cc3)cc2)c[nH+]1 ZINC001174527477 1047857770 /nfs/dbraw/zinc/85/77/70/1047857770.db2.gz ZCUPLDUAXXPPJU-UHFFFAOYSA-N 1 2 304.397 4.216 20 0 DIADLO O[C@H]1CCCc2ccc(Nc3ccc([NH+]4CCCC4)cc3)cc21 ZINC001174529314 1047858983 /nfs/dbraw/zinc/85/89/83/1047858983.db2.gz GLKJSVIKSKTBJW-FQEVSTJZSA-N 1 2 308.425 4.400 20 0 DIADLO Clc1cccc2c(N3CCC[C@@H]([C@@H]4CCOC4)C3)cc[nH+]c12 ZINC000553494975 1047861594 /nfs/dbraw/zinc/86/15/94/1047861594.db2.gz QROXUXGYHJVIRI-ZIAGYGMSSA-N 1 2 316.832 4.141 20 0 DIADLO Cc1cc(C[NH2+][C@H](CCc2ccccc2)C(F)F)cc(C)c1O ZINC001182910948 1047861976 /nfs/dbraw/zinc/86/19/76/1047861976.db2.gz SMHVZPHTUQZXTK-QGZVFWFLSA-N 1 2 319.395 4.365 20 0 DIADLO Nc1ncc(Nc2ccc([NH+]3CCCCC3)cc2)cc1Cl ZINC001159540401 1047863861 /nfs/dbraw/zinc/86/38/61/1047863861.db2.gz XCCBYUZTVGXBGC-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO CNc1ccc(Nc2cccc(Cl)c2Br)c[nH+]1 ZINC001159591581 1047875468 /nfs/dbraw/zinc/87/54/68/1047875468.db2.gz TVTDCLKQDRDXTE-UHFFFAOYSA-N 1 2 312.598 4.283 20 0 DIADLO Cn1ccc2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc21 ZINC001174515175 1047876533 /nfs/dbraw/zinc/87/65/33/1047876533.db2.gz QHZUGTHSJXYYPC-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccnn1CC1CCC1 ZINC000924719892 1047878503 /nfs/dbraw/zinc/87/85/03/1047878503.db2.gz AXIGSKKNSXTOBR-OLZOCXBDSA-N 1 2 319.399 4.373 20 0 DIADLO Cn1ncc(C2CC2)c1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC000667479621 1047884962 /nfs/dbraw/zinc/88/49/62/1047884962.db2.gz LTCHBYSBRCLDBK-UHFFFAOYSA-N 1 2 321.424 4.093 20 0 DIADLO Cn1ncc(C2CC2)c1C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000667479621 1047884975 /nfs/dbraw/zinc/88/49/75/1047884975.db2.gz LTCHBYSBRCLDBK-UHFFFAOYSA-N 1 2 321.424 4.093 20 0 DIADLO FC(F)(F)c1ncccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523078 1047885551 /nfs/dbraw/zinc/88/55/51/1047885551.db2.gz VJFLBYPRXSEAGI-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO CC(C)(C)OC(=O)C1(CC[N@H+](CC(F)F)C2CCC2)CCC1 ZINC001197837575 1047886228 /nfs/dbraw/zinc/88/62/28/1047886228.db2.gz YNJKWAABHASRGH-UHFFFAOYSA-N 1 2 317.420 4.008 20 0 DIADLO CC(C)(C)OC(=O)C1(CC[N@@H+](CC(F)F)C2CCC2)CCC1 ZINC001197837575 1047886243 /nfs/dbraw/zinc/88/62/43/1047886243.db2.gz YNJKWAABHASRGH-UHFFFAOYSA-N 1 2 317.420 4.008 20 0 DIADLO COc1c(F)cc(F)cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523866 1047887494 /nfs/dbraw/zinc/88/74/94/1047887494.db2.gz WCSDQSGQLNOYJM-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO O=c1[nH]ccc2c(Nc3ccc(N4CCCCC4)[nH+]c3)cccc12 ZINC001174524228 1047887599 /nfs/dbraw/zinc/88/75/99/1047887599.db2.gz JFTJBUDVGTULHH-UHFFFAOYSA-N 1 2 320.396 4.069 20 0 DIADLO CCC(=O)c1cccc(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174524353 1047888028 /nfs/dbraw/zinc/88/80/28/1047888028.db2.gz HNBXYKZFTGCLNC-UHFFFAOYSA-N 1 2 309.413 4.408 20 0 DIADLO Cc1nc2cc(Nc3ccc(N4CCCCC4)[nH+]c3)ccc2o1 ZINC001174524486 1047888064 /nfs/dbraw/zinc/88/80/64/1047888064.db2.gz LQUQRPKFVHWRJE-UHFFFAOYSA-N 1 2 308.385 4.265 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1cccc(C(F)(F)F)c1 ZINC001203887087 1047896287 /nfs/dbraw/zinc/89/62/87/1047896287.db2.gz VKJAVSGZWILGJJ-UHFFFAOYSA-N 1 2 307.315 4.020 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1cccc(C(F)(F)F)c1 ZINC001203887087 1047896299 /nfs/dbraw/zinc/89/62/99/1047896299.db2.gz VKJAVSGZWILGJJ-UHFFFAOYSA-N 1 2 307.315 4.020 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@H](C)c2ccc(F)cn2)c2ccccn2)cc1 ZINC000479463785 1047900492 /nfs/dbraw/zinc/90/04/92/1047900492.db2.gz GJCMOHJLLOGFHQ-QRWLVFNGSA-N 1 2 321.399 4.364 20 0 DIADLO CC(C)C(=O)Nc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC001197962306 1047909306 /nfs/dbraw/zinc/90/93/06/1047909306.db2.gz OTJOOQGRLJBJIM-UHFFFAOYSA-N 1 2 320.396 4.210 20 0 DIADLO CCC1(CC)C[N@H+](Cc2c(Cl)ccnc2Cl)CCS1 ZINC001205261695 1047912073 /nfs/dbraw/zinc/91/20/73/1047912073.db2.gz MEHNLAZYXLQZLH-UHFFFAOYSA-N 1 2 319.301 4.496 20 0 DIADLO CCC1(CC)C[N@@H+](Cc2c(Cl)ccnc2Cl)CCS1 ZINC001205261695 1047912081 /nfs/dbraw/zinc/91/20/81/1047912081.db2.gz MEHNLAZYXLQZLH-UHFFFAOYSA-N 1 2 319.301 4.496 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1c[nH+]c2n1CCC2 ZINC000667508937 1047921034 /nfs/dbraw/zinc/92/10/34/1047921034.db2.gz SCRLFKXUYNMYNF-NSHDSACASA-N 1 2 324.255 4.329 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1C[C@H]1CC(C)(C)C ZINC001183350447 1047922822 /nfs/dbraw/zinc/92/28/22/1047922822.db2.gz SBHSDWGEVTZGLV-LSDHHAIUSA-N 1 2 311.429 4.396 20 0 DIADLO C[C@@H]([NH2+][C@H](CO)c1c(Cl)cccc1Cl)c1ccsc1 ZINC000479560986 1047933069 /nfs/dbraw/zinc/93/30/69/1047933069.db2.gz SNFLOIGILDJZFN-NOZJJQNGSA-N 1 2 316.253 4.439 20 0 DIADLO CCCC[N@H+](Cc1cn(C2CCC2)nn1)[C@H](C)c1ccc(C)o1 ZINC000667526573 1047944423 /nfs/dbraw/zinc/94/44/23/1047944423.db2.gz KZXYPXHQAKMTMJ-OAHLLOKOSA-N 1 2 316.449 4.268 20 0 DIADLO CCCC[N@@H+](Cc1cn(C2CCC2)nn1)[C@H](C)c1ccc(C)o1 ZINC000667526573 1047944430 /nfs/dbraw/zinc/94/44/30/1047944430.db2.gz KZXYPXHQAKMTMJ-OAHLLOKOSA-N 1 2 316.449 4.268 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cccc(OC3CC3)c2F)on1 ZINC000667532427 1047945918 /nfs/dbraw/zinc/94/59/18/1047945918.db2.gz MNHQBWRAQKAYHN-OAHLLOKOSA-N 1 2 316.376 4.000 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cccc(OC3CC3)c2F)on1 ZINC000667532427 1047945921 /nfs/dbraw/zinc/94/59/21/1047945921.db2.gz MNHQBWRAQKAYHN-OAHLLOKOSA-N 1 2 316.376 4.000 20 0 DIADLO c1c[nH+]c(N2CCCCC2)c(Nc2ccc3c(c2)CCCO3)c1 ZINC001174718958 1047951337 /nfs/dbraw/zinc/95/13/37/1047951337.db2.gz CSFKIVRNZXTTKW-UHFFFAOYSA-N 1 2 309.413 4.141 20 0 DIADLO Cc1cccc(C)c1NC(=S)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001198350707 1047951936 /nfs/dbraw/zinc/95/19/36/1047951936.db2.gz RQQDXNFXMRWFFT-UHFFFAOYSA-N 1 2 322.437 4.298 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2cncc(Cl)c2Cl)C1 ZINC001183672433 1047953944 /nfs/dbraw/zinc/95/39/44/1047953944.db2.gz LUJPMQMZYBSQTD-LLVKDONJSA-N 1 2 313.150 4.163 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cncc(Cl)c2Cl)C1 ZINC001183672433 1047953952 /nfs/dbraw/zinc/95/39/52/1047953952.db2.gz LUJPMQMZYBSQTD-LLVKDONJSA-N 1 2 313.150 4.163 20 0 DIADLO COC(=O)c1cccc([C@H](C)Nc2[nH+]c(C)cc(Cl)c2C)c1 ZINC001159959089 1047958148 /nfs/dbraw/zinc/95/81/48/1047958148.db2.gz OCEHQLUHXQDFDV-LBPRGKRZSA-N 1 2 318.804 4.312 20 0 DIADLO COC(=O)c1cccc([C@@H](C)Nc2[nH+]c(C)cc(Cl)c2C)c1 ZINC001159959087 1047958677 /nfs/dbraw/zinc/95/86/77/1047958677.db2.gz OCEHQLUHXQDFDV-GFCCVEGCSA-N 1 2 318.804 4.312 20 0 DIADLO CCO[C@H](C)n1cc(Nc2c[nH+]c(CC(C)C)cc2C)cn1 ZINC001174697441 1047962154 /nfs/dbraw/zinc/96/21/54/1047962154.db2.gz UEUIVGBGHLIKAB-CQSZACIVSA-N 1 2 302.422 4.084 20 0 DIADLO CC[C@@H](C)Oc1ccc(C(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)cc1 ZINC000479774116 1047965647 /nfs/dbraw/zinc/96/56/47/1047965647.db2.gz LILRHIGXNYYYRB-GFCCVEGCSA-N 1 2 323.396 4.301 20 0 DIADLO CC[C@H](C)Oc1ccc(C(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)cc1 ZINC000479774117 1047966062 /nfs/dbraw/zinc/96/60/62/1047966062.db2.gz LILRHIGXNYYYRB-LBPRGKRZSA-N 1 2 323.396 4.301 20 0 DIADLO Cc1ccc2c(Nc3ccc4sc(N)nc4c3)cccc2[nH+]1 ZINC001160005491 1047966265 /nfs/dbraw/zinc/96/62/65/1047966265.db2.gz IUJPJWUQIPNIKQ-UHFFFAOYSA-N 1 2 306.394 4.479 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H](C)c3ccc(Cl)s3)cc2[nH+]1 ZINC000479775043 1047968497 /nfs/dbraw/zinc/96/84/97/1047968497.db2.gz LUMJHXFRMZYHPC-QMMMGPOBSA-N 1 2 319.817 4.328 20 0 DIADLO COC(=O)[C@@H]([NH2+][C@H](C)C1CCCC1)c1cccc2ccccc21 ZINC001183833468 1047970305 /nfs/dbraw/zinc/97/03/05/1047970305.db2.gz QIRHDCHLDJERNU-KUHUBIRLSA-N 1 2 311.425 4.222 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)cccc2Cl)nc1 ZINC001198597231 1047981430 /nfs/dbraw/zinc/98/14/30/1047981430.db2.gz RRDYWBKDOXCNGN-QGZVFWFLSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2c(F)cccc2Cl)nc1 ZINC001198597231 1047981437 /nfs/dbraw/zinc/98/14/37/1047981437.db2.gz RRDYWBKDOXCNGN-QGZVFWFLSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H]3COCc4ccccc43)cc(C)c2c1 ZINC001160117007 1047981402 /nfs/dbraw/zinc/98/14/02/1047981402.db2.gz LPCYZKWJPXGQIX-LJQANCHMSA-N 1 2 320.392 4.235 20 0 DIADLO CN(C)c1ccc[nH+]c1Nc1ccc(Oc2cccnc2)cc1 ZINC001174849640 1047998067 /nfs/dbraw/zinc/99/80/67/1047998067.db2.gz RHCFBBOJIWOCCN-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2ccc(N)c(F)c2)c[nH+]1 ZINC001160208664 1047998061 /nfs/dbraw/zinc/99/80/61/1047998061.db2.gz VJHDYCFWTPBLPE-UHFFFAOYSA-N 1 2 322.387 4.183 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(Oc2cccnc2)cc1 ZINC001174849288 1047999076 /nfs/dbraw/zinc/99/90/76/1047999076.db2.gz OMPRJHITZBEDDS-UHFFFAOYSA-N 1 2 316.364 4.103 20 0 DIADLO Cc1ccc(Cl)cc1C[NH2+][C@@H](c1nnc[nH]1)C1CCCCC1 ZINC001184153296 1047999194 /nfs/dbraw/zinc/99/91/94/1047999194.db2.gz DTPXQEIOZXVUSX-MRXNPFEDSA-N 1 2 318.852 4.178 20 0 DIADLO C[C@@H]([NH2+][C@@H](CN(C)C)c1ccc(F)cc1)c1ccc(F)cc1F ZINC000554086571 1048004628 /nfs/dbraw/zinc/00/46/28/1048004628.db2.gz OAGNPFXTKVKKGQ-XIKOKIGWSA-N 1 2 322.374 4.057 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CCc2cc(C(C)C)ccc2C1 ZINC001198844726 1048009297 /nfs/dbraw/zinc/00/92/97/1048009297.db2.gz RUARWOCGSBFJLQ-UHFFFAOYSA-N 1 2 317.864 4.064 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CCc2cc(C(C)C)ccc2C1 ZINC001198844726 1048009309 /nfs/dbraw/zinc/00/93/09/1048009309.db2.gz RUARWOCGSBFJLQ-UHFFFAOYSA-N 1 2 317.864 4.064 20 0 DIADLO C[C@@H]([NH2+]C[C@H]1CCC[C@@H](CO)C1)c1cccc(-c2ccncc2)c1 ZINC000554139701 1048017058 /nfs/dbraw/zinc/01/70/58/1048017058.db2.gz MUBMIPOSJFYQIH-FGTMMUONSA-N 1 2 324.468 4.198 20 0 DIADLO c1[nH+]c2n(c1CN1Cc3ccccc3-c3ccccc3C1)CCC2 ZINC000667586522 1048020286 /nfs/dbraw/zinc/02/02/86/1048020286.db2.gz RDYTUDVPOHSHKZ-UHFFFAOYSA-N 1 2 315.420 4.012 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NC[C@@H](C)C1CCCCC1 ZINC001184278854 1048024556 /nfs/dbraw/zinc/02/45/56/1048024556.db2.gz WEKGXRWWABOXLA-OAHLLOKOSA-N 1 2 315.461 4.311 20 0 DIADLO CCOC(=O)[C@H](c1ccccc1)[N@@H+]1CCC[C@H]1c1cccs1 ZINC000554172171 1048025343 /nfs/dbraw/zinc/02/53/43/1048025343.db2.gz UVMFDZBJIFXKNC-RDJZCZTQSA-N 1 2 315.438 4.189 20 0 DIADLO CCOC(=O)[C@H](c1ccccc1)[N@H+]1CCC[C@H]1c1cccs1 ZINC000554172171 1048025353 /nfs/dbraw/zinc/02/53/53/1048025353.db2.gz UVMFDZBJIFXKNC-RDJZCZTQSA-N 1 2 315.438 4.189 20 0 DIADLO Cc1cscc1Nc1ccc(O[C@H]2CC[NH2+]CC2(F)F)cc1 ZINC001160350074 1048039789 /nfs/dbraw/zinc/03/97/89/1048039789.db2.gz KEGPBHSCONHJJT-HNNXBMFYSA-N 1 2 324.396 4.176 20 0 DIADLO Clc1ccc2c(cc[nH+]c2NCC2Oc3ccccc3O2)c1 ZINC001160407631 1048048282 /nfs/dbraw/zinc/04/82/82/1048048282.db2.gz UHIPVKNAKXCNFD-UHFFFAOYSA-N 1 2 312.756 4.098 20 0 DIADLO Fc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc(F)c1F ZINC001174958972 1048049593 /nfs/dbraw/zinc/04/95/93/1048049593.db2.gz XNXPRTIBIZOKOB-UHFFFAOYSA-N 1 2 303.287 4.092 20 0 DIADLO C[C@H](C[N@@H+]1CCn2c(C3CCCC3)nnc2[C@H]1C)c1ccccc1 ZINC000554288550 1048057221 /nfs/dbraw/zinc/05/72/21/1048057221.db2.gz YFLBKJLXXVSENZ-HZPDHXFCSA-N 1 2 324.472 4.116 20 0 DIADLO C[C@H](C[N@H+]1CCn2c(C3CCCC3)nnc2[C@H]1C)c1ccccc1 ZINC000554288550 1048057235 /nfs/dbraw/zinc/05/72/35/1048057235.db2.gz YFLBKJLXXVSENZ-HZPDHXFCSA-N 1 2 324.472 4.116 20 0 DIADLO COc1c[nH+]c(N[C@@H](c2ccccc2)c2ccc(O)cc2)c(C)c1 ZINC001160496702 1048059868 /nfs/dbraw/zinc/05/98/68/1048059868.db2.gz RSRGVVQTNJXYJZ-IBGZPJMESA-N 1 2 320.392 4.306 20 0 DIADLO C[C@H]1C[C@H](C(C)(C)C)CC[N@@H+]1Cc1nccn1CC(F)(F)F ZINC000554308852 1048062481 /nfs/dbraw/zinc/06/24/81/1048062481.db2.gz HBCXGUZEDYAKBV-QWHCGFSZSA-N 1 2 317.399 4.092 20 0 DIADLO C[C@H]1C[C@H](C(C)(C)C)CC[N@H+]1Cc1nccn1CC(F)(F)F ZINC000554308852 1048062496 /nfs/dbraw/zinc/06/24/96/1048062496.db2.gz HBCXGUZEDYAKBV-QWHCGFSZSA-N 1 2 317.399 4.092 20 0 DIADLO CC(C)CN(C(=O)C[N@@H+]1CC(C)(C)[C@H]1c1cccs1)C(C)C ZINC000554309810 1048064352 /nfs/dbraw/zinc/06/43/52/1048064352.db2.gz WJECDXOYKZQBKB-QGZVFWFLSA-N 1 2 322.518 4.024 20 0 DIADLO CC(C)CN(C(=O)C[N@H+]1CC(C)(C)[C@H]1c1cccs1)C(C)C ZINC000554309810 1048064365 /nfs/dbraw/zinc/06/43/65/1048064365.db2.gz WJECDXOYKZQBKB-QGZVFWFLSA-N 1 2 322.518 4.024 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3cccc(OC(C)(C)C)n3)c[nH+]c12 ZINC001160686501 1048076678 /nfs/dbraw/zinc/07/66/78/1048076678.db2.gz JGGYYDWEKZRSSO-AWEZNQCLSA-N 1 2 324.428 4.388 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3ncnc4cccc(C)c43)c[nH+]c12 ZINC001160686301 1048077152 /nfs/dbraw/zinc/07/71/52/1048077152.db2.gz FLOOCVRTCGGUCK-AWEZNQCLSA-N 1 2 317.396 4.067 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H](C)c2cnc3c(C)cccn23)c1 ZINC001160688638 1048077788 /nfs/dbraw/zinc/07/77/88/1048077788.db2.gz SADNFTWBJBABFK-ZDUSSCGKSA-N 1 2 312.442 4.323 20 0 DIADLO Cc1cc(Cl)cc(N[C@@H](C)c2c[nH+]c3c(C)cccn23)n1 ZINC001160683294 1048077950 /nfs/dbraw/zinc/07/79/50/1048077950.db2.gz OZJHADHCDUORBY-LBPRGKRZSA-N 1 2 300.793 4.173 20 0 DIADLO Cc1c[nH]c2nc(N[C@@H](C)c3c[nH+]c4c(C)cccn34)ccc12 ZINC001160682354 1048078562 /nfs/dbraw/zinc/07/85/62/1048078562.db2.gz BGWHCODASIAUSI-ZDUSSCGKSA-N 1 2 305.385 4.001 20 0 DIADLO Cc1cccc2cccc(Nc3ccc(N4CCOCC4)[nH+]c3)c12 ZINC001174980300 1048078899 /nfs/dbraw/zinc/07/88/99/1048078899.db2.gz PAYJXDANZHHDLN-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO CCOc1cc(CNc2cc(-c3ccccc3)cc[nH+]2)ccc1O ZINC001160784845 1048085793 /nfs/dbraw/zinc/08/57/93/1048085793.db2.gz CYFKBLIJOLEXCM-UHFFFAOYSA-N 1 2 320.392 4.465 20 0 DIADLO Cc1cc(NCc2ccc(C3OCCO3)cc2)[nH+]c2ccccc12 ZINC001160815609 1048087814 /nfs/dbraw/zinc/08/78/14/1048087814.db2.gz SLEMWJRTJMILRZ-UHFFFAOYSA-N 1 2 320.392 4.201 20 0 DIADLO Cc1nc(N(C)[C@@H](C)c2ccc(F)c(F)c2)c2c([nH+]1)CCCC2 ZINC001184774833 1048091628 /nfs/dbraw/zinc/09/16/28/1048091628.db2.gz BEYMYQBTJIRGGT-NSHDSACASA-N 1 2 317.383 4.139 20 0 DIADLO COc1ccc(CNc2ccc(Nc3ccccc3)c[nH+]2)cc1O ZINC001203195127 1048092581 /nfs/dbraw/zinc/09/25/81/1048092581.db2.gz ZQUQKFYKDGLKMM-UHFFFAOYSA-N 1 2 321.380 4.152 20 0 DIADLO Cc1cc(Nc2cccc3[nH+]c[nH]c32)n(-c2ccccc2Cl)n1 ZINC001213027052 1048093945 /nfs/dbraw/zinc/09/39/45/1048093945.db2.gz GOKODZCUHLRNSS-UHFFFAOYSA-N 1 2 323.787 4.454 20 0 DIADLO FC(F)(F)c1ccc(Nc2cccc3[nH+]c[nH]c32)c(Cl)n1 ZINC001213027360 1048095339 /nfs/dbraw/zinc/09/53/39/1048095339.db2.gz WBUGDQHCFSQOFK-UHFFFAOYSA-N 1 2 312.682 4.374 20 0 DIADLO CCN(Cc1ccccc1Cl)c1nc(C)[nH+]c2c1CCCC2 ZINC001184819673 1048095925 /nfs/dbraw/zinc/09/59/25/1048095925.db2.gz FFIHQJJAMGENAW-UHFFFAOYSA-N 1 2 315.848 4.344 20 0 DIADLO CCCOCc1ccccc1CNc1cc(CC)[nH+]c(CC)n1 ZINC001184893801 1048098168 /nfs/dbraw/zinc/09/81/68/1048098168.db2.gz ZOUKIKFRFOTMGN-UHFFFAOYSA-N 1 2 313.445 4.140 20 0 DIADLO Cc1cc(Cl)ccc1[C@@H](C)Nc1[nH+]c(C)nc2[nH]ccc21 ZINC001160998697 1048102339 /nfs/dbraw/zinc/10/23/39/1048102339.db2.gz URZUOZMQXHZQSL-SNVBAGLBSA-N 1 2 300.793 4.401 20 0 DIADLO Cc1cc(Cl)ccc1[C@@H](C)Nc1nc(C)[nH+]c2c1CCC2 ZINC001161001126 1048103276 /nfs/dbraw/zinc/10/32/76/1048103276.db2.gz NUJWKUADGLXMME-LLVKDONJSA-N 1 2 301.821 4.409 20 0 DIADLO CC[C@H](Nc1cc(N(C)C)nc[nH+]1)c1cccc(C(F)(F)F)c1 ZINC001161071077 1048106739 /nfs/dbraw/zinc/10/67/39/1048106739.db2.gz JWUANHAEXZYCEA-ZDUSSCGKSA-N 1 2 324.350 4.125 20 0 DIADLO CC[C@H](Nc1cc(N(C)C)[nH+]cn1)c1cccc(C(F)(F)F)c1 ZINC001161071077 1048106748 /nfs/dbraw/zinc/10/67/48/1048106748.db2.gz JWUANHAEXZYCEA-ZDUSSCGKSA-N 1 2 324.350 4.125 20 0 DIADLO Oc1cc(C(F)(F)F)ccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001184967553 1048107638 /nfs/dbraw/zinc/10/76/38/1048107638.db2.gz GOCFMIRQTDLDDJ-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO CCc1cc(Br)ncc1Nc1cccc2[nH+]c[nH]c21 ZINC001213029872 1048111146 /nfs/dbraw/zinc/11/11/46/1048111146.db2.gz WIGGORHVNVVNIS-UHFFFAOYSA-N 1 2 317.190 4.026 20 0 DIADLO C/C=C/C[C@@H]1CCC[N@@H+]([C@@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001175054489 1048112427 /nfs/dbraw/zinc/11/24/27/1048112427.db2.gz SBNOYSFOXMCRCA-LMIZRQEKSA-N 1 2 321.848 4.232 20 0 DIADLO C/C=C/C[C@@H]1CCC[N@H+]([C@@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001175054489 1048112433 /nfs/dbraw/zinc/11/24/33/1048112433.db2.gz SBNOYSFOXMCRCA-LMIZRQEKSA-N 1 2 321.848 4.232 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1cccc2ccccc21 ZINC000774805547 1048114705 /nfs/dbraw/zinc/11/47/05/1048114705.db2.gz FSSMWMYSGDGBOV-ZDUSSCGKSA-N 1 2 309.413 4.371 20 0 DIADLO Cc1cc([C@@H]([NH2+]Cc2ncc(C(C)C)o2)C2CC2)ccc1F ZINC000776032660 1048115169 /nfs/dbraw/zinc/11/51/69/1048115169.db2.gz ZNSVOZVSUISKFB-SFHVURJKSA-N 1 2 302.393 4.486 20 0 DIADLO CCSc1cc[nH+]c(NC2(c3ccccc3Cl)COC2)c1 ZINC001161270840 1048119344 /nfs/dbraw/zinc/11/93/44/1048119344.db2.gz SVCDLGKFKAFPGT-UHFFFAOYSA-N 1 2 320.845 4.185 20 0 DIADLO Clc1ccccc1C1(Nc2cc3ccccc3c[nH+]2)COC1 ZINC001161265556 1048119564 /nfs/dbraw/zinc/11/95/64/1048119564.db2.gz OHWUDCXAQJNUNC-UHFFFAOYSA-N 1 2 310.784 4.226 20 0 DIADLO Fc1cc(Br)ccc1Nc1cccc2[nH+]c[nH]c21 ZINC001213031660 1048119795 /nfs/dbraw/zinc/11/97/95/1048119795.db2.gz LQKXFQHMNNDPDO-UHFFFAOYSA-N 1 2 306.138 4.208 20 0 DIADLO Clc1cc2ncoc2c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001185043949 1048123393 /nfs/dbraw/zinc/12/33/93/1048123393.db2.gz RQFXPEYOBNKXIZ-UHFFFAOYSA-N 1 2 314.776 4.220 20 0 DIADLO COc1cc(C)c(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1C ZINC001175114406 1048124041 /nfs/dbraw/zinc/12/40/41/1048124041.db2.gz FBCXDNMXEKBEOW-UHFFFAOYSA-N 1 2 307.397 4.300 20 0 DIADLO CC(=O)c1ccc(Nc2ccc[nH+]c2N2CCCC2)c(Cl)c1 ZINC001185043911 1048124217 /nfs/dbraw/zinc/12/42/17/1048124217.db2.gz QGIRQVRPCBUNEP-UHFFFAOYSA-N 1 2 315.804 4.281 20 0 DIADLO Fc1cc(F)c(Nc2cccc3[nH+]c[nH]c32)c(Br)c1 ZINC001213032161 1048125458 /nfs/dbraw/zinc/12/54/58/1048125458.db2.gz WCTPMFQSTUCPBX-UHFFFAOYSA-N 1 2 324.128 4.347 20 0 DIADLO CCOc1cc[nH+]cc1Nc1ccc(OC)c(C(F)(F)F)c1 ZINC001175069820 1048126315 /nfs/dbraw/zinc/12/63/15/1048126315.db2.gz YLJVNGYNXVTINU-UHFFFAOYSA-N 1 2 312.291 4.251 20 0 DIADLO COc1cccc(Nc2cccc3[nH+]c[nH]c32)c1C(F)(F)F ZINC001213032486 1048126483 /nfs/dbraw/zinc/12/64/83/1048126483.db2.gz IMTJNUWJMJQPDD-UHFFFAOYSA-N 1 2 307.275 4.334 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1nc(Cl)cc2cc(F)ccc21 ZINC001161562911 1048138419 /nfs/dbraw/zinc/13/84/19/1048138419.db2.gz GZFVBYUGDHITMN-UHFFFAOYSA-N 1 2 318.783 4.417 20 0 DIADLO Cc1nc2c3ccccc3oc2c(NCc2c[nH+]cn2C(C)C)n1 ZINC001161565362 1048138841 /nfs/dbraw/zinc/13/88/41/1048138841.db2.gz NWEIIQDSTFLOLT-UHFFFAOYSA-N 1 2 321.384 4.074 20 0 DIADLO CC(C)(C)c1csc(C[NH2+]Cc2cc3ccccc3o2)n1 ZINC000105498639 1048139599 /nfs/dbraw/zinc/13/95/99/1048139599.db2.gz XRUMNRQKZXVEKN-UHFFFAOYSA-N 1 2 300.427 4.477 20 0 DIADLO COc1ccc(C)cc1C[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000105498637 1048139751 /nfs/dbraw/zinc/13/97/51/1048139751.db2.gz WIPQWNKVUMGJHX-UHFFFAOYSA-N 1 2 304.459 4.047 20 0 DIADLO CC[C@@H](C)c1nc(Cl)c(C)c(NCc2c[nH+]cn2C(C)C)n1 ZINC001161569158 1048140751 /nfs/dbraw/zinc/14/07/51/1048140751.db2.gz DAKUASQTORSSAZ-LLVKDONJSA-N 1 2 321.856 4.341 20 0 DIADLO CC(C)c1ccc2ncnc(NCc3c[nH+]cn3C(C)C)c2c1 ZINC001161569123 1048141258 /nfs/dbraw/zinc/14/12/58/1048141258.db2.gz IHJUDCZXTZANFT-UHFFFAOYSA-N 1 2 309.417 4.143 20 0 DIADLO COc1cccc(Br)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213033594 1048142547 /nfs/dbraw/zinc/14/25/47/1048142547.db2.gz OCEJWDTXYBNWJJ-UHFFFAOYSA-N 1 2 318.174 4.078 20 0 DIADLO CCOc1ccc(Nc2ccccc2-n2cc[nH+]c2)c(F)c1F ZINC001175152143 1048143854 /nfs/dbraw/zinc/14/38/54/1048143854.db2.gz KVICBMJLZDEPLO-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO CC(C)Sc1ccc([C@@H](C)[NH2+][C@H](C)c2ncccn2)cc1 ZINC000930214398 1048147136 /nfs/dbraw/zinc/14/71/36/1048147136.db2.gz AZCXGEHSUJGQHT-ZIAGYGMSSA-N 1 2 301.459 4.389 20 0 DIADLO CSCc1cc[nH+]c(NCC(C)(C)c2cccc(C)n2)c1 ZINC001161643786 1048149694 /nfs/dbraw/zinc/14/96/94/1048149694.db2.gz HECALNYPHMGJQZ-UHFFFAOYSA-N 1 2 301.459 4.038 20 0 DIADLO CSc1c[nH+]c(NCC2(CC3CC3)CCOCC2)c(C)c1 ZINC001161651718 1048151701 /nfs/dbraw/zinc/15/17/01/1048151701.db2.gz GXGXQGBCSFICNH-UHFFFAOYSA-N 1 2 306.475 4.121 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1NCCCn1cc[nH+]c1 ZINC001161689499 1048154585 /nfs/dbraw/zinc/15/45/85/1048154585.db2.gz WLNADMKOJOJXCI-UHFFFAOYSA-N 1 2 309.413 4.326 20 0 DIADLO C[C@@H]1C[C@@H](Nc2cc(SCc3ccccc3)cc[nH+]2)CCO1 ZINC001161695692 1048154720 /nfs/dbraw/zinc/15/47/20/1048154720.db2.gz GBRHUYAOAHDVLS-ZBFHGGJFSA-N 1 2 314.454 4.353 20 0 DIADLO FC(F)C1(CNc2[nH+]cccc2OCc2ccccc2)CC1 ZINC000480499331 1048158812 /nfs/dbraw/zinc/15/88/12/1048158812.db2.gz OWGPKOBYADWXII-UHFFFAOYSA-N 1 2 304.340 4.118 20 0 DIADLO Fc1ccccc1C[N@@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC001175141251 1048163278 /nfs/dbraw/zinc/16/32/78/1048163278.db2.gz XWISICKGRZPKAS-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Fc1ccccc1C[N@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC001175141251 1048163289 /nfs/dbraw/zinc/16/32/89/1048163289.db2.gz XWISICKGRZPKAS-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@@H](CC2CC2)c2ccccc2F)[nH+]1 ZINC001161772775 1048169624 /nfs/dbraw/zinc/16/96/24/1048169624.db2.gz SJQSEMIYTRCTBL-INIZCTEOSA-N 1 2 310.376 4.359 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@H](CC2CC2)c2ccccc2F)[nH+]1 ZINC001161772777 1048169668 /nfs/dbraw/zinc/16/96/68/1048169668.db2.gz SJQSEMIYTRCTBL-MRXNPFEDSA-N 1 2 310.376 4.359 20 0 DIADLO CCn1cnc(Cl)c1C[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC001200953893 1048170420 /nfs/dbraw/zinc/17/04/20/1048170420.db2.gz XTMVQFSKLKSGKV-VIFPVBQESA-N 1 2 316.207 4.200 20 0 DIADLO CCn1cnc(Cl)c1C[NH2+][C@H](C)c1c(F)cccc1Cl ZINC001200953892 1048170708 /nfs/dbraw/zinc/17/07/08/1048170708.db2.gz XTMVQFSKLKSGKV-SECBINFHSA-N 1 2 316.207 4.200 20 0 DIADLO COc1ncccc1[C@H](Nc1[nH+]c(C)cc(Cl)c1C)C1CC1 ZINC001161783650 1048171220 /nfs/dbraw/zinc/17/12/20/1048171220.db2.gz QSLLJIWJYSXZQZ-OAHLLOKOSA-N 1 2 317.820 4.319 20 0 DIADLO COc1ccc2[nH+]c(NCc3cn(CC(C)C)cn3)c(C)cc2c1 ZINC001161795183 1048173834 /nfs/dbraw/zinc/17/38/34/1048173834.db2.gz YKDALSFUHDMGKD-UHFFFAOYSA-N 1 2 324.428 4.016 20 0 DIADLO Cc1cc(N2C[C@H](c3ccccc3)C[C@@H]2C)nc(C2CCC2)[nH+]1 ZINC001185367771 1048174071 /nfs/dbraw/zinc/17/40/71/1048174071.db2.gz ZHKIJPYUCVJZKA-MAUKXSAKSA-N 1 2 307.441 4.435 20 0 DIADLO CC(C)c1csc(C[NH2+]Cc2cc(Cl)cc3c2OCC3)n1 ZINC001200989217 1048175212 /nfs/dbraw/zinc/17/52/12/1048175212.db2.gz KGQRIZGBDCSTBH-UHFFFAOYSA-N 1 2 322.861 4.145 20 0 DIADLO Fc1cc(Nc2ccccc2C[NH+]2CCOCC2)ccc1Cl ZINC001175205582 1048175857 /nfs/dbraw/zinc/17/58/57/1048175857.db2.gz QXXUETPEXBWEAQ-UHFFFAOYSA-N 1 2 320.795 4.055 20 0 DIADLO Fc1ccccc1COc1ccc[nH+]c1NCCC(F)(F)F ZINC001161823262 1048179241 /nfs/dbraw/zinc/17/92/41/1048179241.db2.gz PHRWBHMOLGCKAT-UHFFFAOYSA-N 1 2 314.282 4.164 20 0 DIADLO Cc1ccc(C)c(CCNc2cc(-c3ccncc3)cc[nH+]2)c1 ZINC001161830548 1048180414 /nfs/dbraw/zinc/18/04/14/1048180414.db2.gz VLCANYABBIJJGF-UHFFFAOYSA-N 1 2 303.409 4.415 20 0 DIADLO Cc1cn2cccc(Nc3cccc(O[C@@H]4CCCCO4)c3)c2[nH+]1 ZINC001175184820 1048186746 /nfs/dbraw/zinc/18/67/46/1048186746.db2.gz VLAQNXIEHFPCKQ-GOSISDBHSA-N 1 2 323.396 4.292 20 0 DIADLO CSCc1cc[nH+]c(N[C@@H](c2ccnc(F)c2)C2CC2)c1 ZINC001161846937 1048187210 /nfs/dbraw/zinc/18/72/10/1048187210.db2.gz FIDHOCMTADWHNZ-MRXNPFEDSA-N 1 2 303.406 4.042 20 0 DIADLO COc1cc(Nc2cccc(O[C@H]3CCCCO3)c2)cc(C)[nH+]1 ZINC001175188638 1048192418 /nfs/dbraw/zinc/19/24/18/1048192418.db2.gz WVJUVGICCBQOSK-SFHVURJKSA-N 1 2 314.385 4.048 20 0 DIADLO CN(Cc1ccc(Cl)cc1)c1nc2ccccc2n2c[nH+]cc12 ZINC001161947869 1048196917 /nfs/dbraw/zinc/19/69/17/1048196917.db2.gz PCEZWAJMKRWPQW-UHFFFAOYSA-N 1 2 322.799 4.172 20 0 DIADLO CCc1ccccc1NC(=S)Nc1cccc2[nH+]c(C)cn21 ZINC001201137029 1048197196 /nfs/dbraw/zinc/19/71/96/1048197196.db2.gz ABTCIIDNJYOGQK-UHFFFAOYSA-N 1 2 310.426 4.014 20 0 DIADLO Cc1cc(N(C)Cc2c(F)cccc2Cl)nc(C2CCC2)[nH+]1 ZINC001161951878 1048198097 /nfs/dbraw/zinc/19/80/97/1048198097.db2.gz LJMKNOLZDQOTPF-UHFFFAOYSA-N 1 2 319.811 4.481 20 0 DIADLO CCO[C@@H]1C[C@@H](Nc2nc(C)[nH+]c3c2CCCC3)C1(CC)CC ZINC001185545142 1048200680 /nfs/dbraw/zinc/20/06/80/1048200680.db2.gz XIQMGAVNFYOXDE-IAGOWNOFSA-N 1 2 317.477 4.060 20 0 DIADLO Cc1ccc2[nH]c([C@H]3CCC[N@@H+]3Cc3cccc(F)c3)nc2c1 ZINC000554853241 1048206415 /nfs/dbraw/zinc/20/64/15/1048206415.db2.gz OOQCUZXAJMBWFR-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2[nH]c([C@H]3CCC[N@H+]3Cc3cccc(F)c3)nc2c1 ZINC000554853241 1048206426 /nfs/dbraw/zinc/20/64/26/1048206426.db2.gz OOQCUZXAJMBWFR-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc([C@H]3CCC[N@@H+]3Cc3cccc(F)c3)[nH]c2c1 ZINC000554853241 1048206435 /nfs/dbraw/zinc/20/64/35/1048206435.db2.gz OOQCUZXAJMBWFR-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc([C@H]3CCC[N@H+]3Cc3cccc(F)c3)[nH]c2c1 ZINC000554853241 1048206445 /nfs/dbraw/zinc/20/64/45/1048206445.db2.gz OOQCUZXAJMBWFR-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2[nH]c([C@@H]3CCC[N@@H+]3Cc3cccc(F)c3)nc2c1 ZINC000554853242 1048206868 /nfs/dbraw/zinc/20/68/68/1048206868.db2.gz OOQCUZXAJMBWFR-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2[nH]c([C@@H]3CCC[N@H+]3Cc3cccc(F)c3)nc2c1 ZINC000554853242 1048206882 /nfs/dbraw/zinc/20/68/82/1048206882.db2.gz OOQCUZXAJMBWFR-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc([C@@H]3CCC[N@@H+]3Cc3cccc(F)c3)[nH]c2c1 ZINC000554853242 1048206896 /nfs/dbraw/zinc/20/68/96/1048206896.db2.gz OOQCUZXAJMBWFR-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc([C@@H]3CCC[N@H+]3Cc3cccc(F)c3)[nH]c2c1 ZINC000554853242 1048206907 /nfs/dbraw/zinc/20/69/07/1048206907.db2.gz OOQCUZXAJMBWFR-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO CC(=O)c1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1F ZINC001175231308 1048207067 /nfs/dbraw/zinc/20/70/67/1048207067.db2.gz XIWARKXZOWABMG-UHFFFAOYSA-N 1 2 309.344 4.017 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2ccccc21)c1nc(C2CCCCC2)no1 ZINC000554864539 1048215639 /nfs/dbraw/zinc/21/56/39/1048215639.db2.gz APWKRVSCOFVLII-DYVFJYSZSA-N 1 2 311.429 4.455 20 0 DIADLO CSc1ccc(Nc2nc3ccccc3n3c[nH+]cc23)cc1 ZINC001162020983 1048216087 /nfs/dbraw/zinc/21/60/87/1048216087.db2.gz RTQCOKBRPKSKDL-UHFFFAOYSA-N 1 2 306.394 4.348 20 0 DIADLO C[C@@H](Nc1ccc(Cn2cc[nH+]c2)cn1)[C@H](C)C1CCCCC1 ZINC000554878252 1048218656 /nfs/dbraw/zinc/21/86/56/1048218656.db2.gz HFELXUPSQQOFFO-JKSUJKDBSA-N 1 2 312.461 4.343 20 0 DIADLO Nc1ccc(/C=C/c2ccc(Nc3ccc(N)[nH+]c3)cc2)cc1 ZINC001201287077 1048229126 /nfs/dbraw/zinc/22/91/26/1048229126.db2.gz RWKGGFAGONCZGS-OWOJBTEDSA-N 1 2 302.381 4.160 20 0 DIADLO C[C@H](C[NH2+]c1ccc(N2CCO[C@H](C)C2)cc1)c1ccccc1 ZINC000774939410 1048231906 /nfs/dbraw/zinc/23/19/06/1048231906.db2.gz UUEWOWBEVFIUJP-IAGOWNOFSA-N 1 2 310.441 4.127 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCC1(c2ncccc2F)CC1 ZINC001162159406 1048233697 /nfs/dbraw/zinc/23/36/97/1048233697.db2.gz ZYLYKQMJGVAYKG-UHFFFAOYSA-N 1 2 307.372 4.221 20 0 DIADLO CCOc1cc(Cl)ccc1CNc1cc(C)[nH+]c(C2CC2)n1 ZINC001185880868 1048241884 /nfs/dbraw/zinc/24/18/84/1048241884.db2.gz BXMWDRLNDXJVGM-UHFFFAOYSA-N 1 2 317.820 4.327 20 0 DIADLO CC(C)OC(=O)c1ccc(Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC001175259287 1048242976 /nfs/dbraw/zinc/24/29/76/1048242976.db2.gz KKZIUOBXGRWFMT-UHFFFAOYSA-N 1 2 321.380 4.181 20 0 DIADLO Cc1ccc(C)c([C@@H](C)Nc2[nH+]cnc3c2cnn3C(C)(C)C)c1 ZINC001185988180 1048246199 /nfs/dbraw/zinc/24/61/99/1048246199.db2.gz VZBAXPDRAHUACU-CQSZACIVSA-N 1 2 323.444 4.371 20 0 DIADLO CN(C)c1ccc(Nc2cccc(-c3ccc(O)cc3)c2)c[nH+]1 ZINC001175343277 1048249770 /nfs/dbraw/zinc/24/97/70/1048249770.db2.gz DOOXYMCGEFHIMP-UHFFFAOYSA-N 1 2 305.381 4.264 20 0 DIADLO Cc1cnc(CCNc2cc(C)c3cccc(C(C)C)c3[nH+]2)nc1 ZINC001162240390 1048249659 /nfs/dbraw/zinc/24/96/59/1048249659.db2.gz VVBYXNFQEQIQDU-UHFFFAOYSA-N 1 2 320.440 4.420 20 0 DIADLO Cc1nc(-c2cccc(Nc3ccc(N(C)C)[nH+]c3)c2)cs1 ZINC001175341160 1048250380 /nfs/dbraw/zinc/25/03/80/1048250380.db2.gz CPHFKCQXNDBBEJ-UHFFFAOYSA-N 1 2 310.426 4.323 20 0 DIADLO CC(C)n1ncc2cc(Nc3ccc(N4CCCC4)[nH+]c3)ccc21 ZINC001175348504 1048251672 /nfs/dbraw/zinc/25/16/72/1048251672.db2.gz FLZGVUNBEREDDA-UHFFFAOYSA-N 1 2 321.428 4.356 20 0 DIADLO Clc1nccc(Nc2ccc(N3CCCC3)[nH+]c2)c1Cl ZINC001175345899 1048251861 /nfs/dbraw/zinc/25/18/61/1048251861.db2.gz IHKDBNXMHCPYHW-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO CC(C)Oc1c(F)cccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175348503 1048252942 /nfs/dbraw/zinc/25/29/42/1048252942.db2.gz FLBILTPYYSUBSW-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO Cc1ccc(C(=O)CC[N@@H+]2[C@@H](C)COC[C@@H]2c2ccccc2)cc1 ZINC000480842669 1048256454 /nfs/dbraw/zinc/25/64/54/1048256454.db2.gz KPHUGXOASHWWSJ-FXAWDEMLSA-N 1 2 323.436 4.030 20 0 DIADLO Cc1ccc(C(=O)CC[N@H+]2[C@@H](C)COC[C@@H]2c2ccccc2)cc1 ZINC000480842669 1048256457 /nfs/dbraw/zinc/25/64/57/1048256457.db2.gz KPHUGXOASHWWSJ-FXAWDEMLSA-N 1 2 323.436 4.030 20 0 DIADLO C[S@@](=O)c1ccccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001175309543 1048256868 /nfs/dbraw/zinc/25/68/68/1048256868.db2.gz QKGHXNPPUCIYKG-JOCHJYFZSA-N 1 2 314.454 4.158 20 0 DIADLO C[S@](=O)c1ccccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001175309547 1048257028 /nfs/dbraw/zinc/25/70/28/1048257028.db2.gz QKGHXNPPUCIYKG-QFIPXVFZSA-N 1 2 314.454 4.158 20 0 DIADLO CCCN(CCc1cccs1)c1cc(CC)[nH+]c(CC)n1 ZINC001186043480 1048259492 /nfs/dbraw/zinc/25/94/92/1048259492.db2.gz LPCAOUNRTZCYNR-UHFFFAOYSA-N 1 2 303.475 4.122 20 0 DIADLO CCCN(CCc1cccs1)c1cc(C)[nH+]c(C2CC2)n1 ZINC001186043932 1048260448 /nfs/dbraw/zinc/26/04/48/1048260448.db2.gz QPJFVQRATBFQBY-UHFFFAOYSA-N 1 2 301.459 4.183 20 0 DIADLO CC(C)Oc1ccc(F)cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175348908 1048260427 /nfs/dbraw/zinc/26/04/27/1048260427.db2.gz JIHJVCPIMGSHIC-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO CC(=O)n1ccc2cc(Nc3ccc(N4CCCC4)[nH+]c3)ccc21 ZINC001175348905 1048260822 /nfs/dbraw/zinc/26/08/22/1048260822.db2.gz JGKXTCBBMJNEEJ-UHFFFAOYSA-N 1 2 320.396 4.040 20 0 DIADLO CC(C)(C)C1=CC[N@H+](Cc2cccc(Br)n2)CC1 ZINC000794437747 1048261136 /nfs/dbraw/zinc/26/11/36/1048261136.db2.gz SBOIBOGIVNOFMU-UHFFFAOYSA-N 1 2 309.251 4.022 20 0 DIADLO CC(C)(C)C1=CC[N@@H+](Cc2cccc(Br)n2)CC1 ZINC000794437747 1048261145 /nfs/dbraw/zinc/26/11/45/1048261145.db2.gz SBOIBOGIVNOFMU-UHFFFAOYSA-N 1 2 309.251 4.022 20 0 DIADLO Cc1ccc2cc(NCc3cnc4cccc(C)n34)[nH+]cc2c1 ZINC001162344945 1048264884 /nfs/dbraw/zinc/26/48/84/1048264884.db2.gz ZQLVMAINKBUPPB-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO CCSCc1cc[nH+]c(NCc2ccc(OC)cc2C)c1 ZINC001201457682 1048269091 /nfs/dbraw/zinc/26/90/91/1048269091.db2.gz CTIYMRCUALJRRA-UHFFFAOYSA-N 1 2 302.443 4.264 20 0 DIADLO FC(F)(F)Oc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC001175350702 1048271119 /nfs/dbraw/zinc/27/11/19/1048271119.db2.gz BHNOBFDZNZQVQU-UHFFFAOYSA-N 1 2 323.318 4.324 20 0 DIADLO Oc1cc(Cl)c(Nc2ccc(N3CCCC3)[nH+]c2)cc1Cl ZINC001175350578 1048271148 /nfs/dbraw/zinc/27/11/48/1048271148.db2.gz AYBAPLMWQNZNPC-UHFFFAOYSA-N 1 2 324.211 4.438 20 0 DIADLO Oc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c(C(F)(F)F)c1 ZINC001175350507 1048271624 /nfs/dbraw/zinc/27/16/24/1048271624.db2.gz GGHVLLUPLQLAHO-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO COc1ccc(Cl)c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175351796 1048271640 /nfs/dbraw/zinc/27/16/40/1048271640.db2.gz VBKVRGSLIYNCMC-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO CC(=O)c1cc(Cl)ccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175349713 1048271894 /nfs/dbraw/zinc/27/18/94/1048271894.db2.gz DHDOSTJCIOHUTG-UHFFFAOYSA-N 1 2 315.804 4.281 20 0 DIADLO Cc1cncc2cccc(Nc3ccc(N4CCCC4)[nH+]c3)c12 ZINC001175349755 1048271919 /nfs/dbraw/zinc/27/19/19/1048271919.db2.gz FIPVMMNGXPEGDB-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO FC(F)Oc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC001175351093 1048271952 /nfs/dbraw/zinc/27/19/52/1048271952.db2.gz LRJRNFOZKQSQPV-UHFFFAOYSA-N 1 2 305.328 4.027 20 0 DIADLO Fc1cncc2cccc(Nc3ccc(N4CCCC4)[nH+]c3)c12 ZINC001175349675 1048272233 /nfs/dbraw/zinc/27/22/33/1048272233.db2.gz OUMBIPILECERJX-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO Fc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c(F)c1Cl ZINC001175351614 1048272594 /nfs/dbraw/zinc/27/25/94/1048272594.db2.gz KCEYPHWLHIAUGS-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO Fc1cc2cccnc2c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175352641 1048273465 /nfs/dbraw/zinc/27/34/65/1048273465.db2.gz YSUCHGNXWXGWCO-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO c1ccc(-c2ccccc2Nc2ccc(N3CCCC3)[nH+]c2)nc1 ZINC001175352864 1048273632 /nfs/dbraw/zinc/27/36/32/1048273632.db2.gz UMMMJIDDYQQSOY-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO c1cc(Nc2ccc(N3CCCC3)[nH+]c2)cc(-c2ccncc2)c1 ZINC001175353040 1048273669 /nfs/dbraw/zinc/27/36/69/1048273669.db2.gz XKXHRZWTDPRYNI-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Cc1cc(NCCc2cccc3[nH]ccc32)nc(C2CCC2)[nH+]1 ZINC001186247831 1048275217 /nfs/dbraw/zinc/27/52/17/1048275217.db2.gz GGGRHZCOZPRIOX-UHFFFAOYSA-N 1 2 306.413 4.188 20 0 DIADLO C[C@H]1C[C@@H]1c1csc(Cc2[nH+]ccn2Cc2ccccc2)n1 ZINC000899241177 1048277578 /nfs/dbraw/zinc/27/75/78/1048277578.db2.gz KGTKKICPZBSQDE-ZFWWWQNUSA-N 1 2 309.438 4.102 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2ccnn2Cc2ccccc2)cc1 ZINC001201486946 1048278100 /nfs/dbraw/zinc/27/81/00/1048278100.db2.gz CSPBRSVCSFOCEW-UHFFFAOYSA-N 1 2 306.413 4.495 20 0 DIADLO CCOC(=O)c1cnc(C)c(Nc2ccc([NH2+]C(C)C)cc2)c1 ZINC001201489888 1048280980 /nfs/dbraw/zinc/28/09/80/1048280980.db2.gz WQGIYFCISWUWNK-UHFFFAOYSA-N 1 2 313.401 4.131 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cc(-c3ccccn3)c[nH]c2=O)cc1 ZINC001201491590 1048282189 /nfs/dbraw/zinc/28/21/89/1048282189.db2.gz QBJKQYOQEYDBPA-UHFFFAOYSA-N 1 2 320.396 4.413 20 0 DIADLO CC[C@H]1CCC[C@H]1CNc1nc(C)[nH+]c(C)c1Br ZINC001186478808 1048308133 /nfs/dbraw/zinc/30/81/33/1048308133.db2.gz GIPIZCJZTXLLII-RYUDHWBXSA-N 1 2 312.255 4.094 20 0 DIADLO CC(C)[C@@H]1CCC[C@@H](Nc2[nH+]cnc3c2cnn3C(C)(C)C)C1 ZINC001162460536 1048282699 /nfs/dbraw/zinc/28/26/99/1048282699.db2.gz MIMNFPUNUFKWIU-ZIAGYGMSSA-N 1 2 315.465 4.208 20 0 DIADLO Cc1cnn(C2CCOCC2)c1Nc1ccc([NH2+]C(C)C)cc1 ZINC001201491588 1048282934 /nfs/dbraw/zinc/28/29/34/1048282934.db2.gz QAQINOLQALLFIR-UHFFFAOYSA-N 1 2 314.433 4.107 20 0 DIADLO C[C@@H]1CCC[C@H](CNc2[nH+]cnc3c2cnn3C(C)(C)C)[C@@H]1C ZINC001186303546 1048282794 /nfs/dbraw/zinc/28/27/94/1048282794.db2.gz DPGRVXJVTJFBOH-MGPQQGTHSA-N 1 2 315.465 4.066 20 0 DIADLO CCc1cc(NCCCc2c[nH]c3ccccc23)nc(CC)[nH+]1 ZINC001162451253 1048283134 /nfs/dbraw/zinc/28/31/34/1048283134.db2.gz UXFAAJXKRANULI-UHFFFAOYSA-N 1 2 308.429 4.127 20 0 DIADLO C[C@@H]1CCC[C@@H](CNc2[nH+]cnc3c2cnn3C(C)(C)C)[C@H]1C ZINC001186303548 1048283860 /nfs/dbraw/zinc/28/38/60/1048283860.db2.gz DPGRVXJVTJFBOH-RDBSUJKOSA-N 1 2 315.465 4.066 20 0 DIADLO CCS[C@@H]1CCCCN(c2cc(C)[nH+]c(C3CCC3)n2)C1 ZINC001162476402 1048286183 /nfs/dbraw/zinc/28/61/83/1048286183.db2.gz OQSXCVHMRSHJRY-OAHLLOKOSA-N 1 2 305.491 4.165 20 0 DIADLO Cc1cccnc1CCCNc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC001186430768 1048304953 /nfs/dbraw/zinc/30/49/53/1048304953.db2.gz DMMPUHUALNZTMB-UHFFFAOYSA-N 1 2 312.461 4.472 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@@H]3CCc4ccccc4C3)cc2[nH+]1 ZINC000481086502 1048306688 /nfs/dbraw/zinc/30/66/88/1048306688.db2.gz DSASQWWCEDYVJE-CQSZACIVSA-N 1 2 319.408 4.005 20 0 DIADLO Cn1ncc2c1cccc2Nc1ccc([NH+]2CCCCC2)cc1 ZINC001175437244 1048307262 /nfs/dbraw/zinc/30/72/62/1048307262.db2.gz UKVLHVRXIWGQCK-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO Cn1ncc2c1cccc2CNc1cc(-c2ccccc2)cc[nH+]1 ZINC001162586735 1048307905 /nfs/dbraw/zinc/30/79/05/1048307905.db2.gz ICOYKRVHNCTPNS-UHFFFAOYSA-N 1 2 314.392 4.247 20 0 DIADLO CC[C@@H]1CCC[C@H]1CNc1nc(C)[nH+]c(C)c1Br ZINC001186478806 1048307970 /nfs/dbraw/zinc/30/79/70/1048307970.db2.gz GIPIZCJZTXLLII-NEPJUHHUSA-N 1 2 312.255 4.094 20 0 DIADLO Cc1ccccc1[C@H]1C[C@H](C)N(c2nc(C)[nH+]c3c2CCCC3)C1 ZINC001162590780 1048309229 /nfs/dbraw/zinc/30/92/29/1048309229.db2.gz FYZWDWHQEDSQNH-RDJZCZTQSA-N 1 2 321.468 4.355 20 0 DIADLO c1ccc([C@@H]2C[C@H]2CNc2ccc(N3CCCCC3)[nH+]c2)cc1 ZINC001201566224 1048319904 /nfs/dbraw/zinc/31/99/04/1048319904.db2.gz CPTGSGWIRKHRIL-HKUYNNGSSA-N 1 2 307.441 4.288 20 0 DIADLO C[C@]1(C2CCCCC2)CCN1C(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC001175484526 1048322495 /nfs/dbraw/zinc/32/24/95/1048322495.db2.gz STWRYYDQPYLGCA-HXUWFJFHSA-N 1 2 323.440 4.057 20 0 DIADLO Cc1nc(N[C@H]2C[C@H](c3ccc(F)cc3)C2)c2c([nH+]1)CCCC2 ZINC001186594634 1048325270 /nfs/dbraw/zinc/32/52/70/1048325270.db2.gz VYBLTFDQKUTVSJ-KOMQPUFPSA-N 1 2 311.404 4.161 20 0 DIADLO CSc1ccccc1NC(=O)Nc1cccc2[nH+]c(C)cn21 ZINC001186708712 1048331834 /nfs/dbraw/zinc/33/18/34/1048331834.db2.gz XVBIBKQIBQLQQU-UHFFFAOYSA-N 1 2 312.398 4.009 20 0 DIADLO CC(C)(C)OC(=O)c1cccc(Nc2ccn3cc[nH+]c3c2)c1 ZINC001175544200 1048334104 /nfs/dbraw/zinc/33/41/04/1048334104.db2.gz DAYDSRPEGWFKHM-UHFFFAOYSA-N 1 2 309.369 4.033 20 0 DIADLO c1cn2cccc(Nc3cncc(OCc4ccccc4)c3)c2[nH+]1 ZINC001201622101 1048335828 /nfs/dbraw/zinc/33/58/28/1048335828.db2.gz RWRONLQTYAHNDO-UHFFFAOYSA-N 1 2 316.364 4.052 20 0 DIADLO O[C@@H](CNc1cc2ccccc2c[nH+]1)c1cc2ccccc2o1 ZINC001162694528 1048337166 /nfs/dbraw/zinc/33/71/66/1048337166.db2.gz FVNRVZGBEPTPRN-INIZCTEOSA-N 1 2 304.349 4.127 20 0 DIADLO CCCCO[C@H]1C[C@H](N(C)c2cc(C)[nH+]c(C3CC3)n2)C1(C)C ZINC001162711272 1048341105 /nfs/dbraw/zinc/34/11/05/1048341105.db2.gz GKWIXWPQAGAFQP-HOTGVXAUSA-N 1 2 317.477 4.082 20 0 DIADLO Cc1nc(N[C@@H]2CCC[C@H](C3CC3)C2)c(Br)c(C)[nH+]1 ZINC001186763911 1048342384 /nfs/dbraw/zinc/34/23/84/1048342384.db2.gz KZTCCHKVBGMWKP-QWHCGFSZSA-N 1 2 324.266 4.237 20 0 DIADLO Cc1cc(N2CCC[C@@H](Nc3ccccc3)C2)nc(C2CCC2)[nH+]1 ZINC001162732667 1048343901 /nfs/dbraw/zinc/34/39/01/1048343901.db2.gz SNHZNFKAUYHPIP-GOSISDBHSA-N 1 2 322.456 4.133 20 0 DIADLO CCO[C@@H]1C[C@@H](Nc2cc(C(C)C)[nH+]c(C(C)C)n2)[C@@H]1SC ZINC001186814927 1048348146 /nfs/dbraw/zinc/34/81/46/1048348146.db2.gz PTNZVOJSLNTYQX-FMKPAKJESA-N 1 2 323.506 4.044 20 0 DIADLO Cc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)cc2c[nH]nc21 ZINC001175516524 1048350232 /nfs/dbraw/zinc/35/02/32/1048350232.db2.gz DYMSGZREKNXXIG-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO Cc1ccc2n[nH]cc2c1Nc1ccc[nH+]c1N1CCCCC1 ZINC001175525538 1048356273 /nfs/dbraw/zinc/35/62/73/1048356273.db2.gz MBJBDKUBROSLHQ-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO Cc1cc([N@H+]2CCCC[C@@H]2C)ccc1Nc1cc(F)ncn1 ZINC001162819467 1048364131 /nfs/dbraw/zinc/36/41/31/1048364131.db2.gz XWSGTOVVFFWSAV-ZDUSSCGKSA-N 1 2 300.381 4.047 20 0 DIADLO Cc1cc([N@@H+]2CCCC[C@@H]2C)ccc1Nc1cc(F)ncn1 ZINC001162819467 1048364144 /nfs/dbraw/zinc/36/41/44/1048364144.db2.gz XWSGTOVVFFWSAV-ZDUSSCGKSA-N 1 2 300.381 4.047 20 0 DIADLO Cc1cc([N@H+]2CCCC[C@H]2C)ccc1Nc1ncnc2c1CCC2 ZINC001162819308 1048364594 /nfs/dbraw/zinc/36/45/94/1048364594.db2.gz WHQDGUKFVGQIQJ-OAHLLOKOSA-N 1 2 322.456 4.396 20 0 DIADLO Cc1cc([N@@H+]2CCCC[C@H]2C)ccc1Nc1ncnc2c1CCC2 ZINC001162819308 1048364603 /nfs/dbraw/zinc/36/46/03/1048364603.db2.gz WHQDGUKFVGQIQJ-OAHLLOKOSA-N 1 2 322.456 4.396 20 0 DIADLO COc1ccc2cc(NCc3cn(C)c4ccccc34)[nH+]cc2c1 ZINC001162827721 1048369042 /nfs/dbraw/zinc/36/90/42/1048369042.db2.gz RBLWPPBFEROCQW-UHFFFAOYSA-N 1 2 317.392 4.347 20 0 DIADLO CC(C)CSCCCNc1nc2ccccc2n2c[nH+]cc12 ZINC001162832658 1048370575 /nfs/dbraw/zinc/37/05/75/1048370575.db2.gz FTOMFOHPZHCUMM-UHFFFAOYSA-N 1 2 314.458 4.074 20 0 DIADLO CCC1(CC)[C@H](Nc2cc(C)[nH+]c(C3CCC3)n2)C[C@H]1OC ZINC001162891731 1048377075 /nfs/dbraw/zinc/37/70/75/1048377075.db2.gz JPCQEDVCUGAGGX-HUUCEWRRSA-N 1 2 303.450 4.058 20 0 DIADLO CCCOc1ccc(Nc2[nH+]cnc3[nH]cc(CC)c32)cc1C ZINC001187208285 1048386620 /nfs/dbraw/zinc/38/66/20/1048386620.db2.gz RHMPNHOQMCTGMF-UHFFFAOYSA-N 1 2 310.401 4.361 20 0 DIADLO Cc1cc(N[C@H]2CCO[C@@H](CC(C)C)C2)nc(C2CCC2)[nH+]1 ZINC001162921632 1048388447 /nfs/dbraw/zinc/38/84/47/1048388447.db2.gz IRKKMPDZSGSNIL-HOTGVXAUSA-N 1 2 303.450 4.058 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@@H](c3ccc(F)cc3)CC2)no1 ZINC000481404342 1048392276 /nfs/dbraw/zinc/39/22/76/1048392276.db2.gz HQBCRRDRAORWCZ-CQSZACIVSA-N 1 2 317.408 4.102 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@@H](c3ccc(F)cc3)CC2)no1 ZINC000481404342 1048392287 /nfs/dbraw/zinc/39/22/87/1048392287.db2.gz HQBCRRDRAORWCZ-CQSZACIVSA-N 1 2 317.408 4.102 20 0 DIADLO CCC(CC)[C@@H]1C[C@H](Nc2nc(C)[nH+]c3c2CCCC3)CCO1 ZINC001162944023 1048394547 /nfs/dbraw/zinc/39/45/47/1048394547.db2.gz WOLIRRGMJXKDPS-QAPCUYQASA-N 1 2 317.477 4.060 20 0 DIADLO Cc1cc(Nc2ccc3c(c2)[nH+]c(C(C)(C)C)n3C)nc(C)n1 ZINC001162986555 1048399721 /nfs/dbraw/zinc/39/97/21/1048399721.db2.gz AFJUJIODMRUFCS-UHFFFAOYSA-N 1 2 309.417 4.021 20 0 DIADLO Cc1nc(N2CCCC[C@H]2c2ccccc2)c2c([nH+]1)CCCC2 ZINC001162994547 1048401887 /nfs/dbraw/zinc/40/18/87/1048401887.db2.gz IGZXWAFAFAQJAW-IBGZPJMESA-N 1 2 307.441 4.395 20 0 DIADLO CC[C@@H](NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1)c1cccc2ccccc21 ZINC000899654073 1048410508 /nfs/dbraw/zinc/41/05/08/1048410508.db2.gz FTGOQUVIZFUXDG-IFXJQAMLSA-N 1 2 321.424 4.009 20 0 DIADLO CC[C@@H](NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1)c1cccc2ccccc21 ZINC000899654073 1048410511 /nfs/dbraw/zinc/41/05/11/1048410511.db2.gz FTGOQUVIZFUXDG-IFXJQAMLSA-N 1 2 321.424 4.009 20 0 DIADLO COc1cc(Nc2cc[nH+]c3cc(Cl)ccc23)c(F)cn1 ZINC001175690865 1048417677 /nfs/dbraw/zinc/41/76/77/1048417677.db2.gz OQNUVYCCDBXUMN-UHFFFAOYSA-N 1 2 303.724 4.175 20 0 DIADLO COc1ccc(Cl)c(Nc2c[nH+]c(N)cc2C(F)(F)F)c1 ZINC001175711958 1048418817 /nfs/dbraw/zinc/41/88/17/1048418817.db2.gz BQLQOUDXJINZDZ-UHFFFAOYSA-N 1 2 317.698 4.088 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(OC(F)F)cc2)c[nH+]1 ZINC001175713013 1048419048 /nfs/dbraw/zinc/41/90/48/1048419048.db2.gz XTFKLKRSEPSFPH-UHFFFAOYSA-N 1 2 319.233 4.028 20 0 DIADLO Cc1ccc(Nc2c[nH+]c(N)cc2C(F)(F)F)cc1Cl ZINC001175711994 1048419427 /nfs/dbraw/zinc/41/94/27/1048419427.db2.gz DQHOUYYOXNVZEP-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO CC(C)Oc1ccccc1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175713239 1048419542 /nfs/dbraw/zinc/41/95/42/1048419542.db2.gz YEBLVTKLSJEJIA-UHFFFAOYSA-N 1 2 311.307 4.213 20 0 DIADLO Cc1cncc2cccc(Nc3c[nH+]c(N)cc3C(F)(F)F)c12 ZINC001175713912 1048420587 /nfs/dbraw/zinc/42/05/87/1048420587.db2.gz GJWLGFHDKKKCDZ-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc(F)c(F)cc2Cl)c[nH+]1 ZINC001175714542 1048421632 /nfs/dbraw/zinc/42/16/32/1048421632.db2.gz ORHDZKSZZITWGG-UHFFFAOYSA-N 1 2 323.652 4.358 20 0 DIADLO COc1cc(F)c(Nc2ccc[nH+]c2N2CCCCC2)c(F)c1 ZINC001175720766 1048422623 /nfs/dbraw/zinc/42/26/23/1048422623.db2.gz QBYQTWCHZCHTGX-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H]3CCCc4ccncc43)c(C)cc2c1 ZINC001163161104 1048424725 /nfs/dbraw/zinc/42/47/25/1048424725.db2.gz CDQGJTWAVIKSQD-LJQANCHMSA-N 1 2 319.408 4.436 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H]3CCCc4ccncc43)cc(C)c2c1 ZINC001163166403 1048426363 /nfs/dbraw/zinc/42/63/63/1048426363.db2.gz GONICPMZVFTLOT-GOSISDBHSA-N 1 2 319.408 4.436 20 0 DIADLO Cc1ccc2sc(N3CCC(Nc4cccc[nH+]4)CC3)nc2c1 ZINC001187647907 1048426534 /nfs/dbraw/zinc/42/65/34/1048426534.db2.gz SASCTZVRWPJGHS-UHFFFAOYSA-N 1 2 324.453 4.081 20 0 DIADLO O=C(Nc1ccccc1Cl)Nc1ccccc1-n1cc[nH+]c1 ZINC001202051749 1048430539 /nfs/dbraw/zinc/43/05/39/1048430539.db2.gz BUPKGXHOKPWGBW-UHFFFAOYSA-N 1 2 312.760 4.170 20 0 DIADLO COc1ccc2[nH+]c(N[C@H]3CCc4c3cccc4O)c(C)cc2c1 ZINC001163192395 1048431123 /nfs/dbraw/zinc/43/11/23/1048431123.db2.gz JXCGFJHHKIOUEB-SFHVURJKSA-N 1 2 320.392 4.357 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H]3CCc4c3cccc4O)c(C)cc2c1 ZINC001163192391 1048431327 /nfs/dbraw/zinc/43/13/27/1048431327.db2.gz JXCGFJHHKIOUEB-GOSISDBHSA-N 1 2 320.392 4.357 20 0 DIADLO CCOC(=O)c1ccc2c(cccc2Nc2cc(C)c[nH+]c2C)n1 ZINC001203667120 1048432822 /nfs/dbraw/zinc/43/28/22/1048432822.db2.gz HTKONVCUIYLTIE-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccnc(Br)c3)ccc12 ZINC001175749558 1048434418 /nfs/dbraw/zinc/43/44/18/1048434418.db2.gz COQHRMDCCTUFRB-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO Cc1cccc2sc(Nc3c[nH+]c(N)cc3C(F)(F)F)nc21 ZINC001175709190 1048437667 /nfs/dbraw/zinc/43/76/67/1048437667.db2.gz ZWVDGGNEMCKQSY-UHFFFAOYSA-N 1 2 324.331 4.344 20 0 DIADLO Cc1cccc2ccc(Nc3c[nH+]c(N)cc3C(F)(F)F)nc12 ZINC001175709983 1048437685 /nfs/dbraw/zinc/43/76/85/1048437685.db2.gz PWGAWMCXBIOLIH-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Cc1nc(N2CCC(C)(C)[C@H](c3ccccc3)C2)c(C)c(C)[nH+]1 ZINC001187753053 1048440326 /nfs/dbraw/zinc/44/03/26/1048440326.db2.gz ZENYRXBQRYYNER-SFHVURJKSA-N 1 2 309.457 4.422 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NCc1cc(Cl)cc2c1OCC2 ZINC001202031460 1048440450 /nfs/dbraw/zinc/44/04/50/1048440450.db2.gz LDZNGGRWIIZSHW-UHFFFAOYSA-N 1 2 318.804 4.069 20 0 DIADLO Cc1cscc1Nc1cc(Br)cn2cc[nH+]c12 ZINC001175765108 1048444565 /nfs/dbraw/zinc/44/45/65/1048444565.db2.gz DEWMJMOERGTFCF-UHFFFAOYSA-N 1 2 308.204 4.210 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc(Cl)cn2)nc(C2CCC2)[nH+]1 ZINC001163249914 1048444644 /nfs/dbraw/zinc/44/46/44/1048444644.db2.gz VXBRADWFWDCNOX-LLVKDONJSA-N 1 2 302.809 4.274 20 0 DIADLO Cc1nc(NCc2cnn3ccccc23)cc(C2CCCCC2)[nH+]1 ZINC001163282217 1048448416 /nfs/dbraw/zinc/44/84/16/1048448416.db2.gz BLFCYWHSFQEKLT-UHFFFAOYSA-N 1 2 321.428 4.093 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)Nc1c(Cl)cccc1Cl ZINC001202096338 1048449046 /nfs/dbraw/zinc/44/90/46/1048449046.db2.gz XIRJUDHKTLQZNH-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO c1nn(-c2ccccc2)cc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001175791621 1048453540 /nfs/dbraw/zinc/45/35/40/1048453540.db2.gz WCBXVXYFOZFDDR-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO COc1c(F)cccc1[C@@H](C)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC001163338475 1048457284 /nfs/dbraw/zinc/45/72/84/1048457284.db2.gz TVLKNQVWXIQUBN-GFCCVEGCSA-N 1 2 303.381 4.229 20 0 DIADLO CSc1cccc(NC(=O)Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001188044431 1048463674 /nfs/dbraw/zinc/46/36/74/1048463674.db2.gz ODPQSKNZCVSCLA-UHFFFAOYSA-N 1 2 324.409 4.238 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2Cl)c(F)c1 ZINC000481719030 1048465178 /nfs/dbraw/zinc/46/51/78/1048465178.db2.gz OTQCYZSYIGXXOZ-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H](c2ccncc2OC)C2CC2)c1 ZINC001163401930 1048468087 /nfs/dbraw/zinc/46/80/87/1048468087.db2.gz ZPZHURGGNHLFPS-QGZVFWFLSA-N 1 2 315.442 4.160 20 0 DIADLO Cc1ccc(-c2cc[nH+]c(NCCC(=O)OC(C)(C)C)c2)cc1 ZINC001163408114 1048469761 /nfs/dbraw/zinc/46/97/61/1048469761.db2.gz MZUKBKJPSGHXCS-UHFFFAOYSA-N 1 2 312.413 4.201 20 0 DIADLO CC(C)(CNc1nc2ccccc2n2c[nH+]cc12)C1=CCCC1 ZINC001163449869 1048472247 /nfs/dbraw/zinc/47/22/47/1048472247.db2.gz ILPLLYUXRVOMSG-UHFFFAOYSA-N 1 2 306.413 4.431 20 0 DIADLO Cc1cn2cccc(Nc3ccc(-c4cccnc4)cc3)c2[nH+]1 ZINC001175887898 1048473611 /nfs/dbraw/zinc/47/36/11/1048473611.db2.gz LJOAFNGTZNEMTC-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO CSc1ccc(NC(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC001188107970 1048476563 /nfs/dbraw/zinc/47/65/63/1048476563.db2.gz SYMDZLCHEJQWRD-UHFFFAOYSA-N 1 2 324.409 4.238 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC001175875276 1048489083 /nfs/dbraw/zinc/48/90/83/1048489083.db2.gz WLPGUGQVPGCKDI-NRUUGDAUSA-N 1 2 323.305 4.068 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC001175875276 1048489085 /nfs/dbraw/zinc/48/90/85/1048489085.db2.gz WLPGUGQVPGCKDI-NRUUGDAUSA-N 1 2 323.305 4.068 20 0 DIADLO O=C(Nc1ccc(Cl)c(Cl)c1)Nc1cccc2[nH+]ccn21 ZINC001202252915 1048490583 /nfs/dbraw/zinc/49/05/83/1048490583.db2.gz DQUHQRGJVZQSSR-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO c1nc2cc(Nc3ccc[nH+]c3N3CCCCC3)ccc2s1 ZINC001175911251 1048497789 /nfs/dbraw/zinc/49/77/89/1048497789.db2.gz IATZGAQJYYHDBJ-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO COC(=O)C1(c2ccc(Nc3[nH+]cccc3C(C)C)cc2)CC1 ZINC001175919738 1048500000 /nfs/dbraw/zinc/50/00/00/1048500000.db2.gz QFRRZXKLTIZHJB-UHFFFAOYSA-N 1 2 310.397 4.153 20 0 DIADLO Cc1cccc(C2(NC(=O)Nc3cc(C)[nH+]cc3C)CCCC2)c1 ZINC001202246201 1048502319 /nfs/dbraw/zinc/50/23/19/1048502319.db2.gz VASLWUGRNOHRIS-UHFFFAOYSA-N 1 2 323.440 4.020 20 0 DIADLO CCOc1cccc(CCNc2cc(-c3ccncc3)cc[nH+]2)c1 ZINC001163711606 1048508916 /nfs/dbraw/zinc/50/89/16/1048508916.db2.gz DXYMQURZVHQMME-UHFFFAOYSA-N 1 2 319.408 4.197 20 0 DIADLO CO[C@H](CSCc1ccc(C)[nH+]c1C)c1ccc(F)cc1 ZINC000600630588 1048517516 /nfs/dbraw/zinc/51/75/16/1048517516.db2.gz VAMZBUBQPBMROE-QGZVFWFLSA-N 1 2 305.418 4.458 20 0 DIADLO Cc1cccc2c(C)cc(N3CCC(=O)[C@H]4CCCC[C@@H]43)[nH+]c12 ZINC001163786867 1048525200 /nfs/dbraw/zinc/52/52/00/1048525200.db2.gz VJWIGESPNKCLEQ-IRXDYDNUSA-N 1 2 308.425 4.190 20 0 DIADLO c1cc(Nc2ccc([NH+]3CCCCCC3)cc2)cc2nn[nH]c12 ZINC001176002652 1048528061 /nfs/dbraw/zinc/52/80/61/1048528061.db2.gz PRBGDVWBMRCHJZ-UHFFFAOYSA-N 1 2 307.401 4.082 20 0 DIADLO c1cc(Nc2ccc([NH+]3CCCCCC3)cc2)cc2[nH]nnc12 ZINC001176002652 1048528074 /nfs/dbraw/zinc/52/80/74/1048528074.db2.gz PRBGDVWBMRCHJZ-UHFFFAOYSA-N 1 2 307.401 4.082 20 0 DIADLO Cc1cc(Oc2ccc(Nc3ccc4[nH]nnc4c3)cc2)cc[nH+]1 ZINC001176003931 1048528646 /nfs/dbraw/zinc/52/86/46/1048528646.db2.gz WVFUFQNIKJUEQO-UHFFFAOYSA-N 1 2 317.352 4.197 20 0 DIADLO CC(C)c1ccc(CNc2cc(C3(C)OCCO3)cc[nH+]2)cc1 ZINC001163820515 1048529433 /nfs/dbraw/zinc/52/94/33/1048529433.db2.gz LJWUAIJXBMUVDI-UHFFFAOYSA-N 1 2 312.413 4.037 20 0 DIADLO [NH2+]=C(Nc1cnc2cc(F)ccc2n1)C12CC3CC(CC(C3)C1)C2 ZINC001163840376 1048534249 /nfs/dbraw/zinc/53/42/49/1048534249.db2.gz WPTIGUXXMGSKBT-UHFFFAOYSA-N 1 2 324.403 4.374 20 0 DIADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2ccc(F)c3cccnc23)[nH]c1C ZINC001176078681 1048546782 /nfs/dbraw/zinc/54/67/82/1048546782.db2.gz TUEMPMBUVJEDQJ-KRWDZBQOSA-N 1 2 324.403 4.051 20 0 DIADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2ccc(F)c3cccnc23)[nH]c1C ZINC001176078681 1048546792 /nfs/dbraw/zinc/54/67/92/1048546792.db2.gz TUEMPMBUVJEDQJ-KRWDZBQOSA-N 1 2 324.403 4.051 20 0 DIADLO Cc1ccc2c(Nc3cc(C(=O)N(C)C)ccc3F)cccc2[nH+]1 ZINC001176048517 1048554025 /nfs/dbraw/zinc/55/40/25/1048554025.db2.gz AEISIUGJJXDNLZ-UHFFFAOYSA-N 1 2 323.371 4.128 20 0 DIADLO Fc1ccc2c[nH+]c(NCCOc3ccccc3F)cc2c1 ZINC001163950872 1048554245 /nfs/dbraw/zinc/55/42/45/1048554245.db2.gz SQJSIOUXQFCOEZ-UHFFFAOYSA-N 1 2 300.308 4.004 20 0 DIADLO COc1cccc2[nH]c([N@H+]3c4ccc(N)cc4CC[C@H]3C)cc21 ZINC001176064417 1048557672 /nfs/dbraw/zinc/55/76/72/1048557672.db2.gz RJTNNHJSVGNWNP-GFCCVEGCSA-N 1 2 307.397 4.232 20 0 DIADLO COc1cccc2[nH]c([N@@H+]3c4ccc(N)cc4CC[C@H]3C)cc21 ZINC001176064417 1048557682 /nfs/dbraw/zinc/55/76/82/1048557682.db2.gz RJTNNHJSVGNWNP-GFCCVEGCSA-N 1 2 307.397 4.232 20 0 DIADLO CCCOc1ccc(Nc2cccn3cc(C)[nH+]c23)c(F)c1F ZINC001203690831 1048559652 /nfs/dbraw/zinc/55/96/52/1048559652.db2.gz NBIREWPZELPBMI-UHFFFAOYSA-N 1 2 317.339 4.453 20 0 DIADLO Cc1ccccc1OCCCNc1cc(-c2ccncc2)cc[nH+]1 ZINC001163970163 1048562305 /nfs/dbraw/zinc/56/23/05/1048562305.db2.gz DNBGOEOXEHTHKB-UHFFFAOYSA-N 1 2 319.408 4.333 20 0 DIADLO Cc1ccccc1OCCCNc1cccc(-c2c[nH+]cn2C)c1 ZINC001163975326 1048564127 /nfs/dbraw/zinc/56/41/27/1048564127.db2.gz QBFLOYGGTHPPFC-UHFFFAOYSA-N 1 2 321.424 4.277 20 0 DIADLO Cc1cn2c(cccc2Nc2c(F)ccc3ccc(C)nc32)[nH+]1 ZINC001176113953 1048571012 /nfs/dbraw/zinc/57/10/12/1048571012.db2.gz PEFXXJDAMSGPOG-UHFFFAOYSA-N 1 2 306.344 4.382 20 0 DIADLO COc1ccc(O[C@@H](C)CNc2cc3ccc(C)cc3c[nH+]2)cc1 ZINC001164037094 1048571507 /nfs/dbraw/zinc/57/15/07/1048571507.db2.gz IEVYTOSRQYFRHQ-HNNXBMFYSA-N 1 2 322.408 4.431 20 0 DIADLO COc1cc[nH+]cc1Nc1cccnc1Oc1ccccc1F ZINC001176119318 1048573087 /nfs/dbraw/zinc/57/30/87/1048573087.db2.gz VOOHEEWSTJXECL-UHFFFAOYSA-N 1 2 311.316 4.160 20 0 DIADLO COc1cc[nH+]cc1Nc1cccnc1Oc1ccc(F)cc1 ZINC001176119063 1048573400 /nfs/dbraw/zinc/57/34/00/1048573400.db2.gz UOPDKUPUUQOOMA-UHFFFAOYSA-N 1 2 311.316 4.160 20 0 DIADLO COc1cc[nH+]cc1Nc1cnc2cc(C(F)(F)F)ccc2c1 ZINC001176118125 1048574229 /nfs/dbraw/zinc/57/42/29/1048574229.db2.gz CITUITDUWPKQPV-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc2c(c1)OC1(CCCCC1)O2 ZINC001176120761 1048575515 /nfs/dbraw/zinc/57/55/15/1048575515.db2.gz JTWSVDWOFRJOPN-UHFFFAOYSA-N 1 2 312.369 4.265 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(C)c(Br)c(F)c1 ZINC001176122847 1048575932 /nfs/dbraw/zinc/57/59/32/1048575932.db2.gz AQYIUHMPBMNNTF-UHFFFAOYSA-N 1 2 311.154 4.044 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(Br)c(F)cc1C ZINC001176123928 1048577015 /nfs/dbraw/zinc/57/70/15/1048577015.db2.gz YDYKSSQRTFQCNL-UHFFFAOYSA-N 1 2 311.154 4.044 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(Br)c(F)c1C ZINC001176125283 1048577636 /nfs/dbraw/zinc/57/76/36/1048577636.db2.gz XZGVUJNZQFZOBP-UHFFFAOYSA-N 1 2 311.154 4.044 20 0 DIADLO COC(=[NH2+])c1cccc(N[C@H](c2ccccc2)c2ccncc2)c1 ZINC001164077701 1048577773 /nfs/dbraw/zinc/57/77/73/1048577773.db2.gz IZYQJWIQYFMFIR-LJQANCHMSA-N 1 2 317.392 4.255 20 0 DIADLO CC(C)([NH2+]Cc1cc(O)ccc1Cl)c1ccc(F)cc1F ZINC001176174908 1048579933 /nfs/dbraw/zinc/57/99/33/1048579933.db2.gz HMJRFGQALMHNFP-UHFFFAOYSA-N 1 2 311.759 4.349 20 0 DIADLO CCCCc1nc(N[C@H](c2cccnc2)C(F)(F)F)cc(C)[nH+]1 ZINC001164180084 1048598786 /nfs/dbraw/zinc/59/87/86/1048598786.db2.gz KMMAGRKSQUGWKO-OAHLLOKOSA-N 1 2 324.350 4.238 20 0 DIADLO C[C@@H]1CN(c2ccc(Nc3cccc(Cl)c3)c[nH+]2)C[C@H](C)O1 ZINC001176219166 1048607638 /nfs/dbraw/zinc/60/76/38/1048607638.db2.gz AXVIUECZBLUXIA-BETUJISGSA-N 1 2 317.820 4.092 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1nc2ccc(F)cc2o1 ZINC000162937255 1048608501 /nfs/dbraw/zinc/60/85/01/1048608501.db2.gz FUANIFFNAJCCAZ-LLVKDONJSA-N 1 2 302.324 4.299 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1nc2ccc(F)cc2o1 ZINC000162937255 1048608506 /nfs/dbraw/zinc/60/85/06/1048608506.db2.gz FUANIFFNAJCCAZ-LLVKDONJSA-N 1 2 302.324 4.299 20 0 DIADLO CC(C)c1[nH]cc(CNc2nc(C(F)F)nc3ccccc32)[nH+]1 ZINC001164225425 1048610741 /nfs/dbraw/zinc/61/07/41/1048610741.db2.gz GSUXJMXVZRCBKV-UHFFFAOYSA-N 1 2 317.343 4.026 20 0 DIADLO CC(C)c1[nH]c(CNc2nc(C(F)F)nc3ccccc32)c[nH+]1 ZINC001164225425 1048610750 /nfs/dbraw/zinc/61/07/50/1048610750.db2.gz GSUXJMXVZRCBKV-UHFFFAOYSA-N 1 2 317.343 4.026 20 0 DIADLO CCN(CC)C(=O)c1cc(F)cc(Nc2ccc(C)[nH+]c2C)c1 ZINC001176295420 1048621849 /nfs/dbraw/zinc/62/18/49/1048621849.db2.gz MZAKOGQQKNHQBV-UHFFFAOYSA-N 1 2 315.392 4.063 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)c1cccc(-c2ccsc2)c1 ZINC001189363523 1048624456 /nfs/dbraw/zinc/62/44/56/1048624456.db2.gz LOYJOEMHRFPYRP-UHFFFAOYSA-N 1 2 319.389 4.315 20 0 DIADLO Cc1cccc2c(C)cc(N3CC(F)(F)C[C@]3(C)CF)[nH+]c12 ZINC001164557753 1048642753 /nfs/dbraw/zinc/64/27/53/1048642753.db2.gz NQHLULSXRBRUJS-MRXNPFEDSA-N 1 2 308.347 4.425 20 0 DIADLO COc1ccc2[nH+]c(N3CC(F)(F)C[C@]3(C)CF)cc(C)c2c1 ZINC001164563088 1048643298 /nfs/dbraw/zinc/64/32/98/1048643298.db2.gz KAEYRDYASWYRRT-MRXNPFEDSA-N 1 2 324.346 4.125 20 0 DIADLO CNc1ccc(Br)cc1Nc1ccc(C)[nH+]c1C ZINC001203381451 1048650708 /nfs/dbraw/zinc/65/07/08/1048650708.db2.gz YDRSSJJUQXIVQM-UHFFFAOYSA-N 1 2 306.207 4.246 20 0 DIADLO Oc1ccc2cc(Nc3[nH+]cccc3N3CCCC3)ccc2c1 ZINC001176387834 1048653519 /nfs/dbraw/zinc/65/35/19/1048653519.db2.gz XLJQACBAKRRHRY-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO CC(=O)OCc1cccc(Cl)c1Nc1[nH+]c(C)ccc1C ZINC001212774819 1048657839 /nfs/dbraw/zinc/65/78/39/1048657839.db2.gz CUAIAVPXBRCVED-UHFFFAOYSA-N 1 2 304.777 4.159 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nonc1C)c1ccc(Cl)c(Cl)c1 ZINC000775314077 1048667166 /nfs/dbraw/zinc/66/71/66/1048667166.db2.gz NPKWXEXDWRMSLQ-CYBMUJFWSA-N 1 2 314.216 4.316 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccc(C(F)F)nc1 ZINC000850471432 1048667323 /nfs/dbraw/zinc/66/73/23/1048667323.db2.gz QGPAAYKOACDWBA-MRVPVSSYSA-N 1 2 316.273 4.287 20 0 DIADLO c1[nH+]c2cc(NC[C@H]3CCCCO3)ccc2n1-c1ccccc1 ZINC001165229721 1048668219 /nfs/dbraw/zinc/66/82/19/1048668219.db2.gz LCCWLEBLSNLPOX-QGZVFWFLSA-N 1 2 307.397 4.007 20 0 DIADLO CN(Cc1ncccc1C(F)(F)F)c1cccc(C2CC2)[nH+]1 ZINC001165225420 1048668471 /nfs/dbraw/zinc/66/84/71/1048668471.db2.gz WXNFWZNCKPMFHN-UHFFFAOYSA-N 1 2 307.319 4.009 20 0 DIADLO Cc1cc(N)nc(SC[C@@H](C)CSc2ccccc2C)[nH+]1 ZINC001165289263 1048675421 /nfs/dbraw/zinc/67/54/21/1048675421.db2.gz VDQRERFHIGMRRA-NSHDSACASA-N 1 2 319.499 4.196 20 0 DIADLO Cc1cn2cccc(Nc3cc(F)cc(N4CCCC4)c3)c2[nH+]1 ZINC001176418190 1048681927 /nfs/dbraw/zinc/68/19/27/1048681927.db2.gz IVYWUYWXZUTXBO-UHFFFAOYSA-N 1 2 310.376 4.126 20 0 DIADLO Cc1cc([C@H]2CCCC[N@@H+]2CCCc2c(F)cccc2F)n[nH]1 ZINC001176485500 1048694617 /nfs/dbraw/zinc/69/46/17/1048694617.db2.gz PAUQIUGDGXVAHL-GOSISDBHSA-N 1 2 319.399 4.156 20 0 DIADLO Cc1cc([C@H]2CCCC[N@H+]2CCCc2c(F)cccc2F)n[nH]1 ZINC001176485500 1048694628 /nfs/dbraw/zinc/69/46/28/1048694628.db2.gz PAUQIUGDGXVAHL-GOSISDBHSA-N 1 2 319.399 4.156 20 0 DIADLO CC(C)Oc1cc(NC2CCC(C(F)(F)F)CC2)cc[nH+]1 ZINC001165624080 1048702544 /nfs/dbraw/zinc/70/25/44/1048702544.db2.gz CTSOEHJPEZEZPK-UHFFFAOYSA-N 1 2 302.340 4.402 20 0 DIADLO Brc1cccc([C@H]2CCC[N@H+]2Cc2ccns2)c1 ZINC001190407834 1048733823 /nfs/dbraw/zinc/73/38/23/1048733823.db2.gz QTUFGJBKWUIUDA-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@@H+]1CCO[C@H](c3ccccc3F)C1)CC2 ZINC000482945906 1048709479 /nfs/dbraw/zinc/70/94/79/1048709479.db2.gz KLQPXBVDSQMERV-OALUTQOASA-N 1 2 315.363 4.026 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@H+]1CCO[C@H](c3ccccc3F)C1)CC2 ZINC000482945906 1048709489 /nfs/dbraw/zinc/70/94/89/1048709489.db2.gz KLQPXBVDSQMERV-OALUTQOASA-N 1 2 315.363 4.026 20 0 DIADLO Cc1cn2c(cccc2Nc2cccc(OC(F)(F)F)c2)[nH+]1 ZINC001176536485 1048710721 /nfs/dbraw/zinc/71/07/21/1048710721.db2.gz ZIBLVJIIYZLKKI-UHFFFAOYSA-N 1 2 307.275 4.285 20 0 DIADLO COc1ccccc1Cc1cn(Cc2c(C)cc(C)cc2C)c[nH+]1 ZINC001190273456 1048713317 /nfs/dbraw/zinc/71/33/17/1048713317.db2.gz JICRBIYWSSKPBS-UHFFFAOYSA-N 1 2 320.436 4.456 20 0 DIADLO C[C@@H]1CN(c2ccc(Nc3ccccc3Cl)c[nH+]2)C[C@H](C)O1 ZINC001176551075 1048723897 /nfs/dbraw/zinc/72/38/97/1048723897.db2.gz CQQFYDAKXLBRKU-BETUJISGSA-N 1 2 317.820 4.092 20 0 DIADLO COC[C@@]12CCC[C@@H]1CN(c1[nH+]ccc3cc(Cl)ccc31)C2 ZINC001165926579 1048725148 /nfs/dbraw/zinc/72/51/48/1048725148.db2.gz WMXNGHSCDIXSBM-KDOFPFPSSA-N 1 2 316.832 4.141 20 0 DIADLO CN(C)c1[nH+]cc(CN(C)c2ccc(F)cc2)c2ccccc21 ZINC001190400456 1048729604 /nfs/dbraw/zinc/72/96/04/1048729604.db2.gz ZPPMBPFXEUKGDH-UHFFFAOYSA-N 1 2 309.388 4.076 20 0 DIADLO Brc1cccc([C@H]2CCC[N@@H+]2Cc2ccns2)c1 ZINC001190407834 1048733820 /nfs/dbraw/zinc/73/38/20/1048733820.db2.gz QTUFGJBKWUIUDA-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO c1ccc2c(c1)cc[nH+]c2N1C[C@H]2[C@@H](C1)CCC[C@@H]2OCC1CC1 ZINC001166112813 1048736861 /nfs/dbraw/zinc/73/68/61/1048736861.db2.gz COPGVDZPHLTKPJ-HOJAQTOUSA-N 1 2 322.452 4.266 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N3CCC[C@@H](C)c4ccccc43)ccn12 ZINC000568206353 1048758513 /nfs/dbraw/zinc/75/85/13/1048758513.db2.gz KPKVQGQOJPNMLR-CQSZACIVSA-N 1 2 319.408 4.187 20 0 DIADLO CC(C)n1ccnc1C[NH+]1CC(c2cccc(C(F)(F)F)c2)C1 ZINC000668225127 1048762464 /nfs/dbraw/zinc/76/24/64/1048762464.db2.gz FHWSJAWPCSRUCN-UHFFFAOYSA-N 1 2 323.362 4.082 20 0 DIADLO Clc1ccc([C@H]2CCCCN2Cc2c[nH+]c3n2CCC3)cc1 ZINC000668223571 1048762994 /nfs/dbraw/zinc/76/29/94/1048762994.db2.gz KDZJFRYVZWZWNO-QGZVFWFLSA-N 1 2 315.848 4.210 20 0 DIADLO Cc1nc(N2CC[C@H](c3ccncc3)C2)cc(C2CCCCC2)[nH+]1 ZINC001166567148 1048763663 /nfs/dbraw/zinc/76/36/63/1048763663.db2.gz BXMYVARGSCNKDP-SFHVURJKSA-N 1 2 322.456 4.222 20 0 DIADLO COCc1cc[nH+]c(N2CCC(CCc3ccccc3)CC2)c1 ZINC001166571238 1048763878 /nfs/dbraw/zinc/76/38/78/1048763878.db2.gz FNWZXGZQPQZOFD-UHFFFAOYSA-N 1 2 310.441 4.077 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cc(F)ccc2OCOC)cc1 ZINC001176722931 1048769012 /nfs/dbraw/zinc/76/90/12/1048769012.db2.gz JIQQJIWWWJAVTD-UHFFFAOYSA-N 1 2 304.365 4.008 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cc(F)ccc2OCOC)cc1 ZINC001176722931 1048769023 /nfs/dbraw/zinc/76/90/23/1048769023.db2.gz JIQQJIWWWJAVTD-UHFFFAOYSA-N 1 2 304.365 4.008 20 0 DIADLO COc1cc(C)[nH+]c(CSc2ccc3c(c2)CC(C)(C)O3)c1 ZINC001166601185 1048770187 /nfs/dbraw/zinc/77/01/87/1048770187.db2.gz RPAVAJKBFXQZNC-UHFFFAOYSA-N 1 2 315.438 4.404 20 0 DIADLO C[N@H+](Cc1ccc[nH]1)Cc1cc(Br)c(Cl)s1 ZINC000483291035 1048772071 /nfs/dbraw/zinc/77/20/71/1048772071.db2.gz CYUFARLRXRRTNL-UHFFFAOYSA-N 1 2 319.655 4.124 20 0 DIADLO C[N@@H+](Cc1ccc[nH]1)Cc1cc(Br)c(Cl)s1 ZINC000483291035 1048772080 /nfs/dbraw/zinc/77/20/80/1048772080.db2.gz CYUFARLRXRRTNL-UHFFFAOYSA-N 1 2 319.655 4.124 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1cc(-c3ccc(F)cc3)no1)C2 ZINC000483317296 1048775851 /nfs/dbraw/zinc/77/58/51/1048775851.db2.gz ULPSNFXDKPFWIC-UHFFFAOYSA-N 1 2 308.356 4.305 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1cc(-c3ccc(F)cc3)no1)C2 ZINC000483317296 1048775863 /nfs/dbraw/zinc/77/58/63/1048775863.db2.gz ULPSNFXDKPFWIC-UHFFFAOYSA-N 1 2 308.356 4.305 20 0 DIADLO Cc1cc(OC(F)F)ccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176750978 1048777837 /nfs/dbraw/zinc/77/78/37/1048777837.db2.gz PEABJGARDKOHBF-UHFFFAOYSA-N 1 2 319.355 4.335 20 0 DIADLO Cc1nc(C(F)(F)F)ccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176750457 1048778584 /nfs/dbraw/zinc/77/85/84/1048778584.db2.gz UAVZYBCXTPISHE-UHFFFAOYSA-N 1 2 322.334 4.148 20 0 DIADLO Cc1cc(Cl)c(C)c(N2CC[C@H]2COCc2ccccc2)[nH+]1 ZINC001166671926 1048778958 /nfs/dbraw/zinc/77/89/58/1048778958.db2.gz WQKWGXPNURCLRV-INIZCTEOSA-N 1 2 316.832 4.147 20 0 DIADLO Cc1nc([C@@H]2CCCCN2c2cc(-c3ccccc3)cc[nH+]2)no1 ZINC001166713205 1048785099 /nfs/dbraw/zinc/78/50/99/1048785099.db2.gz DCMQNLRPXUAUQK-KRWDZBQOSA-N 1 2 320.396 4.172 20 0 DIADLO COC(=O)c1ccc(Cl)cc1SCc1ccc(C)[nH+]c1C ZINC001166754136 1048788587 /nfs/dbraw/zinc/78/85/87/1048788587.db2.gz SOFZTFAVJMLQFM-UHFFFAOYSA-N 1 2 321.829 4.431 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H](F)C2)cc1SC(F)(F)F ZINC001176805019 1048790123 /nfs/dbraw/zinc/79/01/23/1048790123.db2.gz VJUNRVCCLWKSFJ-NSHDSACASA-N 1 2 323.355 4.241 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H](F)C2)cc1SC(F)(F)F ZINC001176805019 1048790138 /nfs/dbraw/zinc/79/01/38/1048790138.db2.gz VJUNRVCCLWKSFJ-NSHDSACASA-N 1 2 323.355 4.241 20 0 DIADLO CC(C)[N@H+](Cc1cn(C2CCC2)nn1)[C@@H](C)c1ccsc1 ZINC000668244793 1048790694 /nfs/dbraw/zinc/79/06/94/1048790694.db2.gz KVDWPDHJKJSHFT-ZDUSSCGKSA-N 1 2 304.463 4.036 20 0 DIADLO CC(C)[N@@H+](Cc1cn(C2CCC2)nn1)[C@@H](C)c1ccsc1 ZINC000668244793 1048790706 /nfs/dbraw/zinc/79/07/06/1048790706.db2.gz KVDWPDHJKJSHFT-ZDUSSCGKSA-N 1 2 304.463 4.036 20 0 DIADLO Fc1cccc(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)n1 ZINC000851718209 1048795080 /nfs/dbraw/zinc/79/50/80/1048795080.db2.gz FOCMLHUABHIHJW-CQSZACIVSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1cccc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)n1 ZINC000851718209 1048795090 /nfs/dbraw/zinc/79/50/90/1048795090.db2.gz FOCMLHUABHIHJW-CQSZACIVSA-N 1 2 313.401 4.168 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2CCSc2ccc(F)cc2F)no1 ZINC000851716200 1048796496 /nfs/dbraw/zinc/79/64/96/1048796496.db2.gz KQPUYAAJURSTMA-HNNXBMFYSA-N 1 2 324.396 4.190 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2CCSc2ccc(F)cc2F)no1 ZINC000851716200 1048796507 /nfs/dbraw/zinc/79/65/07/1048796507.db2.gz KQPUYAAJURSTMA-HNNXBMFYSA-N 1 2 324.396 4.190 20 0 DIADLO Cc1c(C)c(C)c(C[N@H+](C)Cc2nccn2C(F)F)c(C)c1C ZINC000483435009 1048796871 /nfs/dbraw/zinc/79/68/71/1048796871.db2.gz FYMBRDYEGFYTCB-UHFFFAOYSA-N 1 2 321.415 4.452 20 0 DIADLO Cc1c(C)c(C)c(C[N@@H+](C)Cc2nccn2C(F)F)c(C)c1C ZINC000483435009 1048796884 /nfs/dbraw/zinc/79/68/84/1048796884.db2.gz FYMBRDYEGFYTCB-UHFFFAOYSA-N 1 2 321.415 4.452 20 0 DIADLO c1ccc(CN(c2cccc(C3CC3)[nH+]2)C2CCOCC2)cc1 ZINC001166814007 1048798833 /nfs/dbraw/zinc/79/88/33/1048798833.db2.gz AVPBJPWXSYPEIW-UHFFFAOYSA-N 1 2 308.425 4.145 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(C3CC3)no2)cc1F ZINC000851770694 1048800855 /nfs/dbraw/zinc/80/08/55/1048800855.db2.gz UJSZQLWTSGMUKM-KRWDZBQOSA-N 1 2 304.340 4.167 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2cc(C3CC3)no2)cc1F ZINC000851770694 1048800874 /nfs/dbraw/zinc/80/08/74/1048800874.db2.gz UJSZQLWTSGMUKM-KRWDZBQOSA-N 1 2 304.340 4.167 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@@H+]1CCOC2(CCCC2)C1 ZINC000483489999 1048804064 /nfs/dbraw/zinc/80/40/64/1048804064.db2.gz HNHBYVMZFSQBQJ-CYBMUJFWSA-N 1 2 324.262 4.155 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@H+]1CCOC2(CCCC2)C1 ZINC000483489999 1048804076 /nfs/dbraw/zinc/80/40/76/1048804076.db2.gz HNHBYVMZFSQBQJ-CYBMUJFWSA-N 1 2 324.262 4.155 20 0 DIADLO CC(=O)C1CC[NH+](Cc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000852125578 1048825382 /nfs/dbraw/zinc/82/53/82/1048825382.db2.gz LSFFLRVXNXISPT-UHFFFAOYSA-N 1 2 319.754 4.160 20 0 DIADLO c1ccc2cc(N3CCC(Sc4ccncc4)CC3)[nH+]cc2c1 ZINC001166987691 1048825242 /nfs/dbraw/zinc/82/52/42/1048825242.db2.gz MYTBTNOWBNDVNX-UHFFFAOYSA-N 1 2 321.449 4.391 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2scnc2Cl)[C@H]1c1ccccc1 ZINC001191029317 1048826763 /nfs/dbraw/zinc/82/67/63/1048826763.db2.gz GLFGZQRXODHTGI-BXUZGUMPSA-N 1 2 324.902 4.475 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2scnc2Cl)[C@H]1c1ccccc1 ZINC001191029317 1048826780 /nfs/dbraw/zinc/82/67/80/1048826780.db2.gz GLFGZQRXODHTGI-BXUZGUMPSA-N 1 2 324.902 4.475 20 0 DIADLO CC(C)c1ccc(N2CCC(n3ncc4ccccc43)CC2)[nH+]c1 ZINC001167017965 1048829295 /nfs/dbraw/zinc/82/92/95/1048829295.db2.gz ZSYFPSDMKVXLBW-UHFFFAOYSA-N 1 2 320.440 4.396 20 0 DIADLO CCNc1nc(C[N@H+](CC)Cc2cccc(Cl)c2)cs1 ZINC001167038618 1048835388 /nfs/dbraw/zinc/83/53/88/1048835388.db2.gz QHIRPBICOBXSLO-UHFFFAOYSA-N 1 2 309.866 4.250 20 0 DIADLO CCNc1nc(C[N@@H+](CC)Cc2cccc(Cl)c2)cs1 ZINC001167038618 1048835408 /nfs/dbraw/zinc/83/54/08/1048835408.db2.gz QHIRPBICOBXSLO-UHFFFAOYSA-N 1 2 309.866 4.250 20 0 DIADLO c1cn(Cc2ccc(NCc3ccccc3C3CC3)cc2)c[nH+]1 ZINC001167038995 1048836924 /nfs/dbraw/zinc/83/69/24/1048836924.db2.gz FFXZPWGITXQJFE-UHFFFAOYSA-N 1 2 303.409 4.421 20 0 DIADLO CCCCCC[N@@H+]1CCC[C@@H]1c1nccc(C(F)(F)F)n1 ZINC000852476754 1048843870 /nfs/dbraw/zinc/84/38/70/1048843870.db2.gz NUEYHNAXQQYIGQ-GFCCVEGCSA-N 1 2 301.356 4.213 20 0 DIADLO CCCCCC[N@H+]1CCC[C@@H]1c1nccc(C(F)(F)F)n1 ZINC000852476754 1048843897 /nfs/dbraw/zinc/84/38/97/1048843897.db2.gz NUEYHNAXQQYIGQ-GFCCVEGCSA-N 1 2 301.356 4.213 20 0 DIADLO c1[nH]c(-c2ccccc2)nc1C[NH2+]Cc1cc2ccccc2o1 ZINC001177290779 1048856561 /nfs/dbraw/zinc/85/65/61/1048856561.db2.gz XMOCKOROGVKYEN-UHFFFAOYSA-N 1 2 303.365 4.113 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@@H+]2C[C@H]2CCCCC2(F)F)o1 ZINC001191122946 1048856615 /nfs/dbraw/zinc/85/66/15/1048856615.db2.gz UKHGNWJOMUNXFD-HIFRSBDPSA-N 1 2 313.388 4.041 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@H+]2C[C@H]2CCCCC2(F)F)o1 ZINC001191122946 1048856632 /nfs/dbraw/zinc/85/66/32/1048856632.db2.gz UKHGNWJOMUNXFD-HIFRSBDPSA-N 1 2 313.388 4.041 20 0 DIADLO Cc1nc(C[NH2+][C@@]2(c3ccccc3)CC2(C)C)nc2ccccc12 ZINC000852771279 1048858543 /nfs/dbraw/zinc/85/85/43/1048858543.db2.gz CXCDBBXTZVZNEN-OAQYLSRUSA-N 1 2 317.436 4.353 20 0 DIADLO CCc1ccc([C@H]2COCC[N@@H+]2C[C@H]2CCCCC2(F)F)o1 ZINC001191122947 1048858626 /nfs/dbraw/zinc/85/86/26/1048858626.db2.gz UKHGNWJOMUNXFD-UKRRQHHQSA-N 1 2 313.388 4.041 20 0 DIADLO CCc1ccc([C@H]2COCC[N@H+]2C[C@H]2CCCCC2(F)F)o1 ZINC001191122947 1048858644 /nfs/dbraw/zinc/85/86/44/1048858644.db2.gz UKHGNWJOMUNXFD-UKRRQHHQSA-N 1 2 313.388 4.041 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1nc2ccc(C)cc2[nH]1 ZINC000483850802 1048866452 /nfs/dbraw/zinc/86/64/52/1048866452.db2.gz KNSUTAMFCMGGRF-AWEZNQCLSA-N 1 2 309.413 4.039 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+]Cc1nc2cc(C)ccc2[nH]1 ZINC000483867982 1048873965 /nfs/dbraw/zinc/87/39/65/1048873965.db2.gz FWVOZTCHXTTXLA-AWEZNQCLSA-N 1 2 309.413 4.121 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+]Cc1nc2ccc(C)cc2[nH]1 ZINC000483867982 1048873971 /nfs/dbraw/zinc/87/39/71/1048873971.db2.gz FWVOZTCHXTTXLA-AWEZNQCLSA-N 1 2 309.413 4.121 20 0 DIADLO Clc1ccc(-c2nc(CNc3cccc[nH+]3)cs2)cc1 ZINC001177371326 1048876429 /nfs/dbraw/zinc/87/64/29/1048876429.db2.gz ZYKNCRCPLHETFF-UHFFFAOYSA-N 1 2 301.802 4.471 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+][C@@H](C)c3ccc4ccccc4n3)nc2c1 ZINC000483877574 1048882191 /nfs/dbraw/zinc/88/21/91/1048882191.db2.gz FUINYKCZKKYEFM-AWEZNQCLSA-N 1 2 316.408 4.270 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@@H](C)c3ccc4ccccc4n3)[nH]c2c1 ZINC000483877574 1048882208 /nfs/dbraw/zinc/88/22/08/1048882208.db2.gz FUINYKCZKKYEFM-AWEZNQCLSA-N 1 2 316.408 4.270 20 0 DIADLO CCc1ncc(Br)cc1Nc1ccc(C)[nH+]c1C ZINC001203370043 1048882471 /nfs/dbraw/zinc/88/24/71/1048882471.db2.gz WFZGOUYBOFURDN-UHFFFAOYSA-N 1 2 306.207 4.162 20 0 DIADLO Cc1ccc(Nc2ncccc2OCc2ccccc2)c(C)[nH+]1 ZINC001203362963 1048882978 /nfs/dbraw/zinc/88/29/78/1048882978.db2.gz ISHXNBPCCDQVFB-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CC=C(c3ccc(Cl)nc3)CC2)c1 ZINC000773663854 1048884650 /nfs/dbraw/zinc/88/46/50/1048884650.db2.gz AMWZJDSZLYLOAH-UHFFFAOYSA-N 1 2 320.770 4.303 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)c1 ZINC000773663854 1048884668 /nfs/dbraw/zinc/88/46/68/1048884668.db2.gz AMWZJDSZLYLOAH-UHFFFAOYSA-N 1 2 320.770 4.303 20 0 DIADLO Cc1ccc(Nc2ccc(C(=O)NC3CCCC3)cc2)c(C)[nH+]1 ZINC001203373156 1048886271 /nfs/dbraw/zinc/88/62/71/1048886271.db2.gz IKMDSZOQTGCKJH-UHFFFAOYSA-N 1 2 309.413 4.114 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1F)Cc1cccc(OC)c1OC ZINC001203452605 1048904513 /nfs/dbraw/zinc/90/45/13/1048904513.db2.gz NBUHHBPNYSYJMO-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1F)Cc1cccc(OC)c1OC ZINC001203452605 1048904521 /nfs/dbraw/zinc/90/45/21/1048904521.db2.gz NBUHHBPNYSYJMO-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO FC(F)(F)C[C@@H]1CCC[N@H+](Cn2ncc(Cl)c2C2CC2)C1 ZINC000853517745 1048908662 /nfs/dbraw/zinc/90/86/62/1048908662.db2.gz CYIYTHJYNQQBTG-JTQLQIEISA-N 1 2 321.774 4.036 20 0 DIADLO FC(F)(F)C[C@@H]1CCC[N@@H+](Cn2ncc(Cl)c2C2CC2)C1 ZINC000853517745 1048908674 /nfs/dbraw/zinc/90/86/74/1048908674.db2.gz CYIYTHJYNQQBTG-JTQLQIEISA-N 1 2 321.774 4.036 20 0 DIADLO Clc1ccc(/C=C\C[N@@H+]2CCOC[C@@H]2c2ccccc2)cc1 ZINC001191243064 1048910268 /nfs/dbraw/zinc/91/02/68/1048910268.db2.gz BKBHWCVLPZMZOT-PHWHVTFISA-N 1 2 313.828 4.427 20 0 DIADLO Clc1ccc(/C=C\C[N@H+]2CCOC[C@@H]2c2ccccc2)cc1 ZINC001191243064 1048910283 /nfs/dbraw/zinc/91/02/83/1048910283.db2.gz BKBHWCVLPZMZOT-PHWHVTFISA-N 1 2 313.828 4.427 20 0 DIADLO Cc1cc(NCc2csc(-c3ccsc3)n2)c[nH+]c1C ZINC001203485110 1048911670 /nfs/dbraw/zinc/91/16/70/1048911670.db2.gz HSJWQPNKMYGCLZ-UHFFFAOYSA-N 1 2 301.440 4.496 20 0 DIADLO Cc1ccc2[nH+]c(NCc3ccccc3OCC(F)F)[nH]c2c1 ZINC001203478821 1048912385 /nfs/dbraw/zinc/91/23/85/1048912385.db2.gz JUGPOSYMRLWJSF-UHFFFAOYSA-N 1 2 317.339 4.127 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2cc3n(n2)CCCC3)o1 ZINC001191276918 1048914414 /nfs/dbraw/zinc/91/44/14/1048914414.db2.gz GTXCJHXMJOTPMI-RDTXWAMCSA-N 1 2 313.445 4.094 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2cc3n(n2)CCCC3)o1 ZINC001191276918 1048914422 /nfs/dbraw/zinc/91/44/22/1048914422.db2.gz GTXCJHXMJOTPMI-RDTXWAMCSA-N 1 2 313.445 4.094 20 0 DIADLO Cc1cc(Nc2ccc(N(C)Cc3ccccc3)[nH+]c2)sn1 ZINC001203513449 1048915563 /nfs/dbraw/zinc/91/55/63/1048915563.db2.gz LVLFSZMVMFTREM-UHFFFAOYSA-N 1 2 310.426 4.227 20 0 DIADLO Cc1ccnc(F)c1Nc1ccc(N(C)Cc2ccccc2)[nH+]c1 ZINC001203514316 1048915807 /nfs/dbraw/zinc/91/58/07/1048915807.db2.gz WVPMPFPIBWYBNX-UHFFFAOYSA-N 1 2 322.387 4.304 20 0 DIADLO Cc1noc(C)c1Nc1ccc(N(C)Cc2ccccc2)[nH+]c1 ZINC001203512507 1048917236 /nfs/dbraw/zinc/91/72/36/1048917236.db2.gz BBRIDMVFAUEDQD-UHFFFAOYSA-N 1 2 308.385 4.066 20 0 DIADLO CN(C)c1ccccc1C[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC001177580212 1048918099 /nfs/dbraw/zinc/91/80/99/1048918099.db2.gz AVMMJQHBRZXIKQ-GOSISDBHSA-N 1 2 323.465 4.088 20 0 DIADLO Cc1cc(Oc2ccc(NC(=O)Nc3ccccn3)cc2)cc[nH+]1 ZINC001191341953 1048920178 /nfs/dbraw/zinc/92/01/78/1048920178.db2.gz WMUJKUPQDHUQEX-UHFFFAOYSA-N 1 2 320.352 4.221 20 0 DIADLO Cc1sccc1CNc1[nH]c2ccc(Br)cc2[nH+]1 ZINC001203529488 1048921732 /nfs/dbraw/zinc/92/17/32/1048921732.db2.gz IGGIMNSXRPEKAD-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO Cc1sccc1CNc1[nH]c2cc(Br)ccc2[nH+]1 ZINC001203529488 1048921742 /nfs/dbraw/zinc/92/17/42/1048921742.db2.gz IGGIMNSXRPEKAD-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO CCOc1ccccc1C[N@@H+]1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC001203546989 1048924144 /nfs/dbraw/zinc/92/41/44/1048924144.db2.gz FWJPGEZXUNFJIJ-QFBILLFUSA-N 1 2 311.425 4.047 20 0 DIADLO CCOc1ccccc1C[N@H+]1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC001203546989 1048924151 /nfs/dbraw/zinc/92/41/51/1048924151.db2.gz FWJPGEZXUNFJIJ-QFBILLFUSA-N 1 2 311.425 4.047 20 0 DIADLO Cc1n[nH]c(CNc2[nH+]c3ccccc3n2CCC(C)C)c1C ZINC001203536189 1048924832 /nfs/dbraw/zinc/92/48/32/1048924832.db2.gz HZNZREIMIDIFQJ-UHFFFAOYSA-N 1 2 311.433 4.034 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cccc(F)c1OC(F)F ZINC001191330545 1048927223 /nfs/dbraw/zinc/92/72/23/1048927223.db2.gz QUCSVABJWFRHGD-GFCCVEGCSA-N 1 2 321.342 4.374 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cccc(F)c1OC(F)F ZINC001191330545 1048927237 /nfs/dbraw/zinc/92/72/37/1048927237.db2.gz QUCSVABJWFRHGD-GFCCVEGCSA-N 1 2 321.342 4.374 20 0 DIADLO Oc1cccc(CNc2[nH]c3ccc(Cl)cc3[nH+]2)c1Cl ZINC001203571928 1048933836 /nfs/dbraw/zinc/93/38/36/1048933836.db2.gz LYIDWTDUAGFCEH-UHFFFAOYSA-N 1 2 308.168 4.187 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccccc2OCCC(C)C)s1 ZINC001177764562 1048940615 /nfs/dbraw/zinc/94/06/15/1048940615.db2.gz GIOVAVLFGXJZTJ-UHFFFAOYSA-N 1 2 318.486 4.420 20 0 DIADLO Cc1c[nH]c(C[NH2+][C@H](c2ccccc2)c2cccc(Cl)c2)n1 ZINC001177779724 1048943291 /nfs/dbraw/zinc/94/32/91/1048943291.db2.gz OYMUWFGKJKTIGG-GOSISDBHSA-N 1 2 311.816 4.251 20 0 DIADLO CC[NH2+]Cc1noc([C@H](CC(C)C)c2ccc(Cl)cc2)n1 ZINC000854132131 1048943427 /nfs/dbraw/zinc/94/34/27/1048943427.db2.gz MOABHSRTBXCRQY-CQSZACIVSA-N 1 2 307.825 4.011 20 0 DIADLO Clc1ccnc(C[N@@H+]2CC[C@H]2Cc2ccccc2)c1Cl ZINC001191437368 1048946618 /nfs/dbraw/zinc/94/66/18/1048946618.db2.gz SCAOFEUCGGMFSC-ZDUSSCGKSA-N 1 2 307.224 4.205 20 0 DIADLO Clc1ccnc(C[N@H+]2CC[C@H]2Cc2ccccc2)c1Cl ZINC001191437368 1048946626 /nfs/dbraw/zinc/94/66/26/1048946626.db2.gz SCAOFEUCGGMFSC-ZDUSSCGKSA-N 1 2 307.224 4.205 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccnc(NC(=O)OC(C)(C)C)c2)c1 ZINC001203654581 1048950131 /nfs/dbraw/zinc/95/01/31/1048950131.db2.gz LCSWZXOVOPGKDB-UHFFFAOYSA-N 1 2 314.389 4.184 20 0 DIADLO COc1cccc(Cn2ncc(C)c2Nc2cc(C)c[nH+]c2C)c1 ZINC001203658152 1048951409 /nfs/dbraw/zinc/95/14/09/1048951409.db2.gz YEAUCFSHDUYTMZ-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO CCOC(=O)c1cnc2cccc(Nc3cc(C)c[nH+]c3C)c2c1 ZINC001203666718 1048953798 /nfs/dbraw/zinc/95/37/98/1048953798.db2.gz CRWLRTNLAAEUIG-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO CCOC(=O)Cc1ccc(Nc2cc(C)c[nH+]c2C)c(Cl)c1 ZINC001203663353 1048955154 /nfs/dbraw/zinc/95/51/54/1048955154.db2.gz IQMVQHLDCNEANC-UHFFFAOYSA-N 1 2 318.804 4.201 20 0 DIADLO COC(=O)c1c(F)ccc(Nc2cc(C)c[nH+]c2C)c1Cl ZINC001203667478 1048956441 /nfs/dbraw/zinc/95/64/41/1048956441.db2.gz MLFXPKOYBQHPTB-UHFFFAOYSA-N 1 2 308.740 4.021 20 0 DIADLO COc1cccc(C(=O)C(F)(F)F)c1Nc1cc(C)c[nH+]c1C ZINC001203668778 1048956578 /nfs/dbraw/zinc/95/65/78/1048956578.db2.gz IQUOEQFKGZUEQM-UHFFFAOYSA-N 1 2 324.302 4.196 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cccc(F)c2OC[C@@H]2CCCO2)c1 ZINC001203668674 1048957345 /nfs/dbraw/zinc/95/73/45/1048957345.db2.gz YELVVHBYVIGEJY-AWEZNQCLSA-N 1 2 316.376 4.139 20 0 DIADLO CCCOc1ccc(Nc2cccc3[nH+]c(C)cn32)c(F)c1F ZINC001203690503 1048964830 /nfs/dbraw/zinc/96/48/30/1048964830.db2.gz DGXSFRTZWWBPPM-UHFFFAOYSA-N 1 2 317.339 4.453 20 0 DIADLO c1cn(-c2ccc(CN3CCCCc4ccccc43)cc2)c[nH+]1 ZINC001191618565 1048968370 /nfs/dbraw/zinc/96/83/70/1048968370.db2.gz VBRNPHPVRCXLJY-UHFFFAOYSA-N 1 2 303.409 4.215 20 0 DIADLO CCC[C@@H](C)c1noc([C@@H]([NH3+])c2ccccc2C(F)(F)F)n1 ZINC000904090364 1048969510 /nfs/dbraw/zinc/96/95/10/1048969510.db2.gz WANWOUVORBLNAD-SKDRFNHKSA-N 1 2 313.323 4.040 20 0 DIADLO Cc1cc(C[NH2+]Cc2c(F)c(F)cc(F)c2F)ccc1Cl ZINC001177954496 1048970356 /nfs/dbraw/zinc/97/03/56/1048970356.db2.gz GCMPFZWGAOWYFG-UHFFFAOYSA-N 1 2 317.713 4.495 20 0 DIADLO CCC(CC)c1noc([C@@H]([NH3+])c2ccccc2C(F)(F)F)n1 ZINC000904092502 1048973936 /nfs/dbraw/zinc/97/39/36/1048973936.db2.gz MIJUIUDJUZXGGF-LBPRGKRZSA-N 1 2 313.323 4.040 20 0 DIADLO OCc1ccc(Nc2ccc([NH+]3CCCCC3)cc2)c(F)c1 ZINC001203719885 1048977903 /nfs/dbraw/zinc/97/79/03/1048977903.db2.gz XIZQBOTVWLULRR-UHFFFAOYSA-N 1 2 300.377 4.052 20 0 DIADLO Oc1c(Cl)nccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203719445 1048978188 /nfs/dbraw/zinc/97/81/88/1048978188.db2.gz XBRGRCZBYDOASR-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO Oc1cc(Nc2ccc([NH+]3CCCCC3)cc2)c(F)cc1F ZINC001203719943 1048978297 /nfs/dbraw/zinc/97/82/97/1048978297.db2.gz ZWVIHQCMIKOSBC-UHFFFAOYSA-N 1 2 304.340 4.404 20 0 DIADLO OCc1c(F)cc(F)cc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203724186 1048978969 /nfs/dbraw/zinc/97/89/69/1048978969.db2.gz IBEBATZZEUDQIL-UHFFFAOYSA-N 1 2 318.367 4.191 20 0 DIADLO COc1cc(C)[nH+]c(CN2CCCc3cc(C(C)C)ccc32)c1 ZINC001191721828 1048981808 /nfs/dbraw/zinc/98/18/08/1048981808.db2.gz HDFMIHGQIDSDPB-UHFFFAOYSA-N 1 2 310.441 4.475 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3c(F)cccc3Cl)ccc21 ZINC001178114661 1048986911 /nfs/dbraw/zinc/98/69/11/1048986911.db2.gz NZGJYIWPSWXKSX-UHFFFAOYSA-N 1 2 304.796 4.474 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3c(F)cccc3Cl)ccc21 ZINC001178114661 1048986924 /nfs/dbraw/zinc/98/69/24/1048986924.db2.gz NZGJYIWPSWXKSX-UHFFFAOYSA-N 1 2 304.796 4.474 20 0 DIADLO Fc1ccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c(F)c1 ZINC001204210933 1048994037 /nfs/dbraw/zinc/99/40/37/1048994037.db2.gz JYATTYIXBLGXOS-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1ccc(C[N@H+]2CCSC[C@H]2c2ccccc2)c(F)c1 ZINC001204210933 1048994050 /nfs/dbraw/zinc/99/40/50/1048994050.db2.gz JYATTYIXBLGXOS-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1ccc([C@@H]2CSCC[N@@H+]2Cc2cccc(F)c2)cc1 ZINC001203785339 1048996949 /nfs/dbraw/zinc/99/69/49/1048996949.db2.gz BDNJUYVGNLUUMG-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1ccc([C@@H]2CSCC[N@H+]2Cc2cccc(F)c2)cc1 ZINC001203785339 1048996952 /nfs/dbraw/zinc/99/69/52/1048996952.db2.gz BDNJUYVGNLUUMG-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO CCSCc1cc[nH+]c(NC[C@H]2CCOc3ccccc32)c1 ZINC001178192031 1048998166 /nfs/dbraw/zinc/99/81/66/1048998166.db2.gz PRYRATGCXAMAHA-OAHLLOKOSA-N 1 2 314.454 4.313 20 0 DIADLO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cc1ncc(Br)s1 ZINC001191790132 1049001424 /nfs/dbraw/zinc/00/14/24/1049001424.db2.gz UKXONLFOACDQAT-QWRGUYRKSA-N 1 2 317.296 4.306 20 0 DIADLO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1ncc(Br)s1 ZINC001191790132 1049001433 /nfs/dbraw/zinc/00/14/33/1049001433.db2.gz UKXONLFOACDQAT-QWRGUYRKSA-N 1 2 317.296 4.306 20 0 DIADLO CC(C)n1ccn(C[NH+]2CCC(c3ccsc3)CC2)c1=S ZINC000776781354 1049008777 /nfs/dbraw/zinc/00/87/77/1049008777.db2.gz FAQPHJYOQFNBJP-UHFFFAOYSA-N 1 2 321.515 4.499 20 0 DIADLO CC[C@H]([NH2+]c1ccc(N2CCCCC2)cc1)C1CCOCC1 ZINC000776795240 1049013742 /nfs/dbraw/zinc/01/37/42/1049013742.db2.gz QODNJJLQFNUVOS-IBGZPJMESA-N 1 2 302.462 4.294 20 0 DIADLO COc1cc[nH+]cc1NCc1cccc(Oc2ccccc2)c1 ZINC001178259425 1049013825 /nfs/dbraw/zinc/01/38/25/1049013825.db2.gz KYZNEHAQGJLOKE-UHFFFAOYSA-N 1 2 306.365 4.495 20 0 DIADLO CCCCN(C(=O)c1cccc2[nH+]ccn21)[C@@H](C)c1ccccc1 ZINC000776804019 1049026380 /nfs/dbraw/zinc/02/63/80/1049026380.db2.gz AGGNOKDELMMDFS-INIZCTEOSA-N 1 2 321.424 4.338 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C(C)(C)c3ccc(C)cc3)cc2[nH+]1 ZINC000484754299 1049026725 /nfs/dbraw/zinc/02/67/25/1049026725.db2.gz ZRXXYKUVEWHHHV-UHFFFAOYSA-N 1 2 307.397 4.096 20 0 DIADLO CCC[C@H](C)[N@@H+]1CCc2[nH]c3c(cccc3Br)c2C1 ZINC001191976714 1049027079 /nfs/dbraw/zinc/02/70/79/1049027079.db2.gz IWXAEKFKLCSOAU-NSHDSACASA-N 1 2 321.262 4.477 20 0 DIADLO CCC[C@H](C)[N@H+]1CCc2[nH]c3c(cccc3Br)c2C1 ZINC001191976714 1049027091 /nfs/dbraw/zinc/02/70/91/1049027091.db2.gz IWXAEKFKLCSOAU-NSHDSACASA-N 1 2 321.262 4.477 20 0 DIADLO c1ccc(COc2ccc(C[NH+]3CC4(C3)CCCCO4)cc2)cc1 ZINC001203959061 1049044938 /nfs/dbraw/zinc/04/49/38/1049044938.db2.gz DMMDJJUDQFHFGF-UHFFFAOYSA-N 1 2 323.436 4.021 20 0 DIADLO COc1ccnc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2Cl)c1 ZINC000925489114 1049046310 /nfs/dbraw/zinc/04/63/10/1049046310.db2.gz NOMCNUPDGUSWDD-GHMZBOCLSA-N 1 2 308.784 4.295 20 0 DIADLO CCCCOc1ccc(C[N@H+](C)CC(=O)c2ccccc2)cc1 ZINC001203971588 1049048689 /nfs/dbraw/zinc/04/86/89/1049048689.db2.gz DHLBJFWWDJIKQH-UHFFFAOYSA-N 1 2 311.425 4.180 20 0 DIADLO CCCCOc1ccc(C[N@@H+](C)CC(=O)c2ccccc2)cc1 ZINC001203971588 1049048693 /nfs/dbraw/zinc/04/86/93/1049048693.db2.gz DHLBJFWWDJIKQH-UHFFFAOYSA-N 1 2 311.425 4.180 20 0 DIADLO CC(C)[N@H+](CCC(=O)c1ccc2ccccc2c1)Cc1ncc[nH]1 ZINC001203979835 1049049952 /nfs/dbraw/zinc/04/99/52/1049049952.db2.gz FLCJGLVAQSAWOP-UHFFFAOYSA-N 1 2 321.424 4.046 20 0 DIADLO CC(C)[N@@H+](CCC(=O)c1ccc2ccccc2c1)Cc1ncc[nH]1 ZINC001203979835 1049049963 /nfs/dbraw/zinc/04/99/63/1049049963.db2.gz FLCJGLVAQSAWOP-UHFFFAOYSA-N 1 2 321.424 4.046 20 0 DIADLO C[C@@H]([NH2+]Cc1cc2cc(Cl)cnc2o1)c1c(F)cncc1F ZINC001178688063 1049075098 /nfs/dbraw/zinc/07/50/98/1049075098.db2.gz AEGCLJDLQSWOSF-MRVPVSSYSA-N 1 2 323.730 4.005 20 0 DIADLO FC1(F)[C@@H]2CC[N@H+](Cc3nc(C4CCCCC4)cs3)C[C@@H]21 ZINC001192390724 1049084465 /nfs/dbraw/zinc/08/44/65/1049084465.db2.gz OACOCENSIXBFAU-OLZOCXBDSA-N 1 2 312.429 4.278 20 0 DIADLO FC1(F)[C@@H]2CC[N@@H+](Cc3nc(C4CCCCC4)cs3)C[C@@H]21 ZINC001192390724 1049084477 /nfs/dbraw/zinc/08/44/77/1049084477.db2.gz OACOCENSIXBFAU-OLZOCXBDSA-N 1 2 312.429 4.278 20 0 DIADLO C[C@@H](c1nc(-c2cccs2)no1)[N@@H+]1CC[C@H]1c1ccccc1 ZINC000484926754 1049086981 /nfs/dbraw/zinc/08/69/81/1049086981.db2.gz MIYTVPSTZXTJKM-JSGCOSHPSA-N 1 2 311.410 4.306 20 0 DIADLO C[C@@H](c1nc(-c2cccs2)no1)[N@H+]1CC[C@H]1c1ccccc1 ZINC000484926754 1049086994 /nfs/dbraw/zinc/08/69/94/1049086994.db2.gz MIYTVPSTZXTJKM-JSGCOSHPSA-N 1 2 311.410 4.306 20 0 DIADLO FCC(CF)[NH2+]Cc1ccc(Oc2cc(F)cc(F)c2)cc1 ZINC001178787522 1049088242 /nfs/dbraw/zinc/08/82/42/1049088242.db2.gz XQKQMXOVMBOFJZ-UHFFFAOYSA-N 1 2 313.294 4.154 20 0 DIADLO CCOc1cc(C[N@@H+]2CCc3cccc(Cl)c3C2)ccc1O ZINC001204133372 1049090788 /nfs/dbraw/zinc/09/07/88/1049090788.db2.gz RMWMSOBNZZSEHF-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1cc(C[N@H+]2CCc3cccc(Cl)c3C2)ccc1O ZINC001204133372 1049090801 /nfs/dbraw/zinc/09/08/01/1049090801.db2.gz RMWMSOBNZZSEHF-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO Cc1ccnc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1Br ZINC001204144894 1049097493 /nfs/dbraw/zinc/09/74/93/1049097493.db2.gz KYAOTSXCLHSHER-OAHLLOKOSA-N 1 2 317.230 4.100 20 0 DIADLO Cc1ccnc(C[N@H+]2CC[C@@H]2c2ccccc2)c1Br ZINC001204144894 1049097507 /nfs/dbraw/zinc/09/75/07/1049097507.db2.gz KYAOTSXCLHSHER-OAHLLOKOSA-N 1 2 317.230 4.100 20 0 DIADLO CCCc1nc(C)c(C[NH2+]Cc2cc(Cl)ccc2OCC)o1 ZINC001178851956 1049100885 /nfs/dbraw/zinc/10/08/85/1049100885.db2.gz OYUNGDWNVMJQST-UHFFFAOYSA-N 1 2 322.836 4.277 20 0 DIADLO Cc1ccc([C@@]2(C)C[N@H+](Cc3cc(F)cc(F)c3)CCO2)cc1 ZINC001204230353 1049116337 /nfs/dbraw/zinc/11/63/37/1049116337.db2.gz ANAFIMVXTLKORI-LJQANCHMSA-N 1 2 317.379 4.021 20 0 DIADLO Cc1ccc([C@@]2(C)C[N@@H+](Cc3cc(F)cc(F)c3)CCO2)cc1 ZINC001204230353 1049116344 /nfs/dbraw/zinc/11/63/44/1049116344.db2.gz ANAFIMVXTLKORI-LJQANCHMSA-N 1 2 317.379 4.021 20 0 DIADLO Cc1ccc(-c2cccc(CNc3cc(CO)cc[nH+]3)c2)cc1 ZINC001178991781 1049118680 /nfs/dbraw/zinc/11/86/80/1049118680.db2.gz HVWJLPCITPKXTG-UHFFFAOYSA-N 1 2 304.393 4.161 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC001192546118 1049118812 /nfs/dbraw/zinc/11/88/12/1049118812.db2.gz KMHYRGVBLVERIJ-SUNKGSAMSA-N 1 2 300.215 4.190 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC001192546118 1049118817 /nfs/dbraw/zinc/11/88/17/1049118817.db2.gz KMHYRGVBLVERIJ-SUNKGSAMSA-N 1 2 300.215 4.190 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@H](C)C2(CCC2)C1 ZINC001192585414 1049120138 /nfs/dbraw/zinc/12/01/38/1049120138.db2.gz UUNFSJHCSUAUJZ-BBRMVZONSA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@H](C)C2(CCC2)C1 ZINC001192585414 1049120144 /nfs/dbraw/zinc/12/01/44/1049120144.db2.gz UUNFSJHCSUAUJZ-BBRMVZONSA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CC[C@H](C)C2(CCC2)C1 ZINC001192585417 1049120480 /nfs/dbraw/zinc/12/04/80/1049120480.db2.gz UUNFSJHCSUAUJZ-XJKSGUPXSA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CC[C@H](C)C2(CCC2)C1 ZINC001192585417 1049120484 /nfs/dbraw/zinc/12/04/84/1049120484.db2.gz UUNFSJHCSUAUJZ-XJKSGUPXSA-N 1 2 321.848 4.066 20 0 DIADLO CCCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nonc1C ZINC000775543993 1049126596 /nfs/dbraw/zinc/12/65/96/1049126596.db2.gz BFMNGHXTUGJNTA-MRXNPFEDSA-N 1 2 317.433 4.044 20 0 DIADLO CC/C=C/CC[N@@H+]1CCc2cc(Br)cc(F)c2C1 ZINC001192635839 1049127218 /nfs/dbraw/zinc/12/72/18/1049127218.db2.gz RPIFPTXFGCPEOQ-ONEGZZNKSA-N 1 2 312.226 4.303 20 0 DIADLO CC/C=C/CC[N@H+]1CCc2cc(Br)cc(F)c2C1 ZINC001192635839 1049127225 /nfs/dbraw/zinc/12/72/25/1049127225.db2.gz RPIFPTXFGCPEOQ-ONEGZZNKSA-N 1 2 312.226 4.303 20 0 DIADLO CCCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nonc1C ZINC000775543992 1049127498 /nfs/dbraw/zinc/12/74/98/1049127498.db2.gz BFMNGHXTUGJNTA-INIZCTEOSA-N 1 2 317.433 4.044 20 0 DIADLO CC1(C)C[C@H]([NH2+]Cc2c(F)cccc2F)c2cc(F)ccc2O1 ZINC001179086150 1049128739 /nfs/dbraw/zinc/12/87/39/1049128739.db2.gz NDKHUZAITHCUIT-INIZCTEOSA-N 1 2 321.342 4.496 20 0 DIADLO c1cn(-c2ccc(Cc3nc(C4CCCCCC4)no3)cc2)c[nH+]1 ZINC000904688216 1049130314 /nfs/dbraw/zinc/13/03/14/1049130314.db2.gz QWMZKDBMEYIVLQ-UHFFFAOYSA-N 1 2 322.412 4.284 20 0 DIADLO Cc1cc(C)cc(-c2ccc(C[NH2+]Cc3csnn3)cc2)c1 ZINC001179277440 1049152171 /nfs/dbraw/zinc/15/21/71/1049152171.db2.gz GJNFSJVCFIYYPR-UHFFFAOYSA-N 1 2 309.438 4.112 20 0 DIADLO Clc1ccc(-c2ccc(C[NH2+]Cc3csnn3)s2)cc1 ZINC001179278766 1049152235 /nfs/dbraw/zinc/15/22/35/1049152235.db2.gz ZPQFMCCOWJBXPC-UHFFFAOYSA-N 1 2 321.858 4.210 20 0 DIADLO C[C@@H]1C[N@H+](CCCc2c(Cl)cccc2Cl)[C@@H](C)CO1 ZINC001204429434 1049161480 /nfs/dbraw/zinc/16/14/80/1049161480.db2.gz DKRSPAWAHZEXDW-NWDGAFQWSA-N 1 2 302.245 4.035 20 0 DIADLO C[C@@H]1C[N@@H+](CCCc2c(Cl)cccc2Cl)[C@@H](C)CO1 ZINC001204429434 1049161485 /nfs/dbraw/zinc/16/14/85/1049161485.db2.gz DKRSPAWAHZEXDW-NWDGAFQWSA-N 1 2 302.245 4.035 20 0 DIADLO C[C@H]1C[N@H+](CCCc2c(Cl)cccc2Cl)[C@@H](C)CO1 ZINC001204429435 1049161801 /nfs/dbraw/zinc/16/18/01/1049161801.db2.gz DKRSPAWAHZEXDW-RYUDHWBXSA-N 1 2 302.245 4.035 20 0 DIADLO C[C@H]1C[N@@H+](CCCc2c(Cl)cccc2Cl)[C@@H](C)CO1 ZINC001204429435 1049161805 /nfs/dbraw/zinc/16/18/05/1049161805.db2.gz DKRSPAWAHZEXDW-RYUDHWBXSA-N 1 2 302.245 4.035 20 0 DIADLO CC(C)c1ccc([C@H]2CCCC[N@@H+]2Cc2nncs2)cc1 ZINC001192975885 1049163516 /nfs/dbraw/zinc/16/35/16/1049163516.db2.gz IGRIPBQBSMSWGZ-MRXNPFEDSA-N 1 2 301.459 4.389 20 0 DIADLO CC(C)c1ccc([C@H]2CCCC[N@H+]2Cc2nncs2)cc1 ZINC001192975885 1049163522 /nfs/dbraw/zinc/16/35/22/1049163522.db2.gz IGRIPBQBSMSWGZ-MRXNPFEDSA-N 1 2 301.459 4.389 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCC[C@@H]2c2ccc(C(C)C)cc2)[nH]1 ZINC001192977039 1049164640 /nfs/dbraw/zinc/16/46/40/1049164640.db2.gz TWZSLBCBZWAGSL-QGZVFWFLSA-N 1 2 312.461 4.218 20 0 DIADLO CCc1nnc(C[N@H+]2CCCC[C@@H]2c2ccc(C(C)C)cc2)[nH]1 ZINC001192977039 1049164644 /nfs/dbraw/zinc/16/46/44/1049164644.db2.gz TWZSLBCBZWAGSL-QGZVFWFLSA-N 1 2 312.461 4.218 20 0 DIADLO Cn1c2ccccc2[nH+]c1NCc1cnc(C2CCCC2)s1 ZINC001179442967 1049166208 /nfs/dbraw/zinc/16/62/08/1049166208.db2.gz JNOUYWXJSXZEJX-UHFFFAOYSA-N 1 2 312.442 4.300 20 0 DIADLO CC[C@H](CNc1[nH+]c2ccccc2n1CCOC)c1ccccc1 ZINC001179489486 1049170240 /nfs/dbraw/zinc/17/02/40/1049170240.db2.gz PWNKXFIESOFALN-MRXNPFEDSA-N 1 2 323.440 4.288 20 0 DIADLO CC[C@H]1C[C@@H](CNc2[nH+]c3cc(Cl)ccc3n2CC)CCO1 ZINC001179484069 1049170691 /nfs/dbraw/zinc/17/06/91/1049170691.db2.gz AQAQCQKNZZPDAN-JSGCOSHPSA-N 1 2 321.852 4.327 20 0 DIADLO CCc1ncc(C[NH2+][C@H](CC(F)(F)F)c2ccc(C)cc2)o1 ZINC001193070248 1049171380 /nfs/dbraw/zinc/17/13/80/1049171380.db2.gz PDFMQPZOMAVHCC-CQSZACIVSA-N 1 2 312.335 4.329 20 0 DIADLO CC(C)c1cnc(CNc2[nH]c3ccc(Cl)cc3[nH+]2)s1 ZINC001179516317 1049171988 /nfs/dbraw/zinc/17/19/88/1049171988.db2.gz XHDRZPIOLXSTFZ-UHFFFAOYSA-N 1 2 306.822 4.408 20 0 DIADLO CC(C)c1cnc(CNc2[nH]c3cc(Cl)ccc3[nH+]2)s1 ZINC001179516317 1049171994 /nfs/dbraw/zinc/17/19/94/1049171994.db2.gz XHDRZPIOLXSTFZ-UHFFFAOYSA-N 1 2 306.822 4.408 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(F)c2OC(F)(F)F)C[C@H](C)S1 ZINC001204489719 1049174091 /nfs/dbraw/zinc/17/40/91/1049174091.db2.gz WWWCKBPZDCSPNP-AOOOYVTPSA-N 1 2 323.355 4.050 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(F)c2OC(F)(F)F)C[C@H](C)S1 ZINC001204489719 1049174093 /nfs/dbraw/zinc/17/40/93/1049174093.db2.gz WWWCKBPZDCSPNP-AOOOYVTPSA-N 1 2 323.355 4.050 20 0 DIADLO Cc1c(F)cccc1C[NH+](Cc1cccnc1)Cc1cccnc1 ZINC001204513081 1049178499 /nfs/dbraw/zinc/17/84/99/1049178499.db2.gz RIUONCGZURCINU-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ccccn2)oc1C ZINC001204538214 1049184309 /nfs/dbraw/zinc/18/43/09/1049184309.db2.gz YDWJPRVCPVYERS-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)oc1C ZINC001204538214 1049184326 /nfs/dbraw/zinc/18/43/26/1049184326.db2.gz YDWJPRVCPVYERS-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Clc1ccccc1C[N@@H+]1CCO[C@@H](CCc2ccccc2)C1 ZINC001193198610 1049186412 /nfs/dbraw/zinc/18/64/12/1049186412.db2.gz RVRYOTYVUBKOIK-SFHVURJKSA-N 1 2 315.844 4.174 20 0 DIADLO Clc1ccccc1C[N@H+]1CCO[C@@H](CCc2ccccc2)C1 ZINC001193198610 1049186418 /nfs/dbraw/zinc/18/64/18/1049186418.db2.gz RVRYOTYVUBKOIK-SFHVURJKSA-N 1 2 315.844 4.174 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)ccc1F ZINC001204560416 1049190149 /nfs/dbraw/zinc/19/01/49/1049190149.db2.gz AOCFCMSGTAMXBB-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)ccc1F ZINC001204560416 1049190151 /nfs/dbraw/zinc/19/01/51/1049190151.db2.gz AOCFCMSGTAMXBB-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO CCC[C@H](C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000485145221 1049190186 /nfs/dbraw/zinc/19/01/86/1049190186.db2.gz DBWIZKHXCVHANL-IBGZPJMESA-N 1 2 319.408 4.395 20 0 DIADLO CC[C@@H](c1ccccc1)N(C(=O)c1cccc2[nH+]ccn21)C(C)C ZINC000857676293 1049191415 /nfs/dbraw/zinc/19/14/15/1049191415.db2.gz MMPCZGKPAPVRJE-KRWDZBQOSA-N 1 2 321.424 4.336 20 0 DIADLO Cc1[nH+]cc(CNc2ccc3c(c2)C[C@@H](C)O3)n1-c1ccccc1 ZINC001179695930 1049193659 /nfs/dbraw/zinc/19/36/59/1049193659.db2.gz MWJULGMLZVINRD-CQSZACIVSA-N 1 2 319.408 4.116 20 0 DIADLO Fc1ccc([C@@H]([NH2+][C@H]2CCCc3cn[nH]c32)c2ccccc2)cc1 ZINC000857850489 1049202813 /nfs/dbraw/zinc/20/28/13/1049202813.db2.gz STRCXJWGMDOQES-OALUTQOASA-N 1 2 321.399 4.305 20 0 DIADLO Fc1ccc([C@@H]([NH2+][C@H]2CCCc3c[nH]nc32)c2ccccc2)cc1 ZINC000857850489 1049202822 /nfs/dbraw/zinc/20/28/22/1049202822.db2.gz STRCXJWGMDOQES-OALUTQOASA-N 1 2 321.399 4.305 20 0 DIADLO Clc1ccccc1C1([NH2+][C@@H]2CCCc3cn[nH]c32)CCC1 ZINC000857872819 1049204420 /nfs/dbraw/zinc/20/44/20/1049204420.db2.gz QKLIHLCVKRFGPY-OAHLLOKOSA-N 1 2 301.821 4.110 20 0 DIADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000857865658 1049205845 /nfs/dbraw/zinc/20/58/45/1049205845.db2.gz PPSXSGNGBXKEFW-LSDHHAIUSA-N 1 2 323.362 4.379 20 0 DIADLO CC[N@H+](Cc1ncsc1Br)[C@@H]1CCCC[C@@H]1C ZINC001193412822 1049208695 /nfs/dbraw/zinc/20/86/95/1049208695.db2.gz HWPWIOUEKHLGJV-CMPLNLGQSA-N 1 2 317.296 4.306 20 0 DIADLO CC[N@@H+](Cc1ncsc1Br)[C@@H]1CCCC[C@@H]1C ZINC001193412822 1049208710 /nfs/dbraw/zinc/20/87/10/1049208710.db2.gz HWPWIOUEKHLGJV-CMPLNLGQSA-N 1 2 317.296 4.306 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cccc(C)c1F ZINC001179817978 1049211244 /nfs/dbraw/zinc/21/12/44/1049211244.db2.gz UGHCXFIOXAMHFL-UHFFFAOYSA-N 1 2 301.340 4.255 20 0 DIADLO CC(C)CC[C@H](NC(=O)Nc1ccn2cc[nH+]c2c1)C(C)(C)C ZINC001204647761 1049212107 /nfs/dbraw/zinc/21/21/07/1049212107.db2.gz CLHIVOBUWJFSSF-HNNXBMFYSA-N 1 2 316.449 4.307 20 0 DIADLO CCCCCC[C@](C)(CCC)C(=O)N[C@@H]1CCn2c[nH+]cc21 ZINC000857982865 1049213596 /nfs/dbraw/zinc/21/35/96/1049213596.db2.gz NEIVSMQMNSYAOR-QAPCUYQASA-N 1 2 305.466 4.221 20 0 DIADLO O=C1CC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CC[C@@H]1F ZINC001204693742 1049227666 /nfs/dbraw/zinc/22/76/66/1049227666.db2.gz GEPZODZKIJPYJW-HNNXBMFYSA-N 1 2 321.779 4.103 20 0 DIADLO O=C1CC[N@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CC[C@@H]1F ZINC001204693742 1049227676 /nfs/dbraw/zinc/22/76/76/1049227676.db2.gz GEPZODZKIJPYJW-HNNXBMFYSA-N 1 2 321.779 4.103 20 0 DIADLO Cc1[nH+]cc(CN(Cc2ccccc2F)C2CCCCC2)n1C ZINC001179924022 1049228847 /nfs/dbraw/zinc/22/88/47/1049228847.db2.gz APJXQHZRVXUERN-UHFFFAOYSA-N 1 2 315.436 4.203 20 0 DIADLO Cc1nn(C)c(Cl)c1C[NH2+]Cc1c(Cl)oc2ccccc21 ZINC000858240557 1049229657 /nfs/dbraw/zinc/22/96/57/1049229657.db2.gz OZVBTOOZAUQKJW-UHFFFAOYSA-N 1 2 324.211 4.071 20 0 DIADLO Cc1ccccc1N1CC[NH+](Cc2ccsc2Cl)CC1 ZINC001179952017 1049237226 /nfs/dbraw/zinc/23/72/26/1049237226.db2.gz NSIIHKMHNRXJJE-UHFFFAOYSA-N 1 2 306.862 4.032 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncc(CN(C)C)s1)c1cc(C)ccc1C ZINC000858295634 1049237871 /nfs/dbraw/zinc/23/78/71/1049237871.db2.gz HAOMSHFKIOVKCR-QGZVFWFLSA-N 1 2 317.502 4.062 20 0 DIADLO C[N@H+](Cc1ccno1)Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001204717554 1049239543 /nfs/dbraw/zinc/23/95/43/1049239543.db2.gz NWYSOQNJLHCTQG-UHFFFAOYSA-N 1 2 302.761 4.220 20 0 DIADLO C[N@@H+](Cc1ccno1)Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001204717554 1049239552 /nfs/dbraw/zinc/23/95/52/1049239552.db2.gz NWYSOQNJLHCTQG-UHFFFAOYSA-N 1 2 302.761 4.220 20 0 DIADLO CCC[C@@H]1CCc2ccccc2N1C(=O)c1cccc2[nH+]ccn21 ZINC000777015145 1049241581 /nfs/dbraw/zinc/24/15/81/1049241581.db2.gz QFZKTBKMXOIKRP-MRXNPFEDSA-N 1 2 319.408 4.096 20 0 DIADLO CCc1cnccc1[C@H](C)[C@@H](c1[nH+]ccn1C)c1cccc(F)c1 ZINC000485432929 1049245152 /nfs/dbraw/zinc/24/51/52/1049245152.db2.gz CDXKLPSSAVEYHS-IFXJQAMLSA-N 1 2 323.415 4.452 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2cc(F)ncc2F)o1 ZINC001179955946 1049249183 /nfs/dbraw/zinc/24/91/83/1049249183.db2.gz BWNCCIYGWQGTBO-XHDPSFHLSA-N 1 2 306.356 4.234 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2cc(F)ncc2F)o1 ZINC001179955946 1049249196 /nfs/dbraw/zinc/24/91/96/1049249196.db2.gz BWNCCIYGWQGTBO-XHDPSFHLSA-N 1 2 306.356 4.234 20 0 DIADLO CCC[C@@H]([NH2+][C@H]1CC(C)(C)CCc2ccccc21)C(=O)OCC ZINC001193733442 1049249680 /nfs/dbraw/zinc/24/96/80/1049249680.db2.gz FQKOTSSFAMXOEU-MSOLQXFVSA-N 1 2 317.473 4.412 20 0 DIADLO O=c1nc(Cl)cc(Nc2ccc([NH2+]C3CCCCC3)cc2)[nH]1 ZINC000858388410 1049250531 /nfs/dbraw/zinc/25/05/31/1049250531.db2.gz CNSPYPOBGLZTDZ-UHFFFAOYSA-N 1 2 318.808 4.324 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1ccc(OCc2ccccc2)nc1 ZINC001204750494 1049252757 /nfs/dbraw/zinc/25/27/57/1049252757.db2.gz OSLMSFFTJZTZPY-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO CCCC[N@H+](Cc1cnc2n1CCC2)Cc1ccccc1Cl ZINC001180048023 1049255570 /nfs/dbraw/zinc/25/55/70/1049255570.db2.gz QVVAXTOSLPAWGZ-UHFFFAOYSA-N 1 2 317.864 4.285 20 0 DIADLO CCCC[N@@H+](Cc1cnc2n1CCC2)Cc1ccccc1Cl ZINC001180048023 1049255583 /nfs/dbraw/zinc/25/55/83/1049255583.db2.gz QVVAXTOSLPAWGZ-UHFFFAOYSA-N 1 2 317.864 4.285 20 0 DIADLO C[C@@H]1C[NH+](Cc2ccc(F)c(Cl)c2Cl)C[C@@H](C)S1 ZINC001180025318 1049262332 /nfs/dbraw/zinc/26/23/32/1049262332.db2.gz ZOKZEJMLSJEXGW-RKDXNWHRSA-N 1 2 308.249 4.458 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CCc4c(F)cc(F)cc4C3)[nH]c2c1 ZINC001204797404 1049267608 /nfs/dbraw/zinc/26/76/08/1049267608.db2.gz YAMKITJODRNDJK-UHFFFAOYSA-N 1 2 312.363 4.313 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CCc4c(F)cc(F)cc4C3)[nH]c2c1 ZINC001204797404 1049267623 /nfs/dbraw/zinc/26/76/23/1049267623.db2.gz YAMKITJODRNDJK-UHFFFAOYSA-N 1 2 312.363 4.313 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)nc1Cl ZINC001193826683 1049269987 /nfs/dbraw/zinc/26/99/87/1049269987.db2.gz HBRFFZIGKXHMEC-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@@](F)(c3ccccc3)C2)nc1Cl ZINC001193826683 1049269997 /nfs/dbraw/zinc/26/99/97/1049269997.db2.gz HBRFFZIGKXHMEC-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)nc1Cl ZINC001193826685 1049271029 /nfs/dbraw/zinc/27/10/29/1049271029.db2.gz HBRFFZIGKXHMEC-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@](F)(c3ccccc3)C2)nc1Cl ZINC001193826685 1049271040 /nfs/dbraw/zinc/27/10/40/1049271040.db2.gz HBRFFZIGKXHMEC-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO CC(C)c1ccc(Cl)c(C(=O)Nc2cccc3[nH+]ccn32)c1 ZINC001193845460 1049271861 /nfs/dbraw/zinc/27/18/61/1049271861.db2.gz RGBUBZSEUFSZTA-UHFFFAOYSA-N 1 2 313.788 4.363 20 0 DIADLO c1cn(-c2ccc(CN3CCCCc4sccc43)cc2)c[nH+]1 ZINC001193888878 1049272319 /nfs/dbraw/zinc/27/23/19/1049272319.db2.gz KCLSKEWWDWDUTP-UHFFFAOYSA-N 1 2 309.438 4.277 20 0 DIADLO CC(C)c1ccc(Cl)c(C(=O)Nc2cc[nH+]c3c2CCC3)c1 ZINC001193844903 1049273090 /nfs/dbraw/zinc/27/30/90/1049273090.db2.gz KQMWFFMLUPLPBA-UHFFFAOYSA-N 1 2 314.816 4.021 20 0 DIADLO C[C@@H]1C[N@H+](C/C=C\c2cccc(F)c2)C[C@@H](c2ccsc2)O1 ZINC001180076303 1049275450 /nfs/dbraw/zinc/27/54/50/1049275450.db2.gz DMUZICPPCWEHEV-HUAIYETOSA-N 1 2 317.429 4.362 20 0 DIADLO C[C@@H]1C[N@@H+](C/C=C\c2cccc(F)c2)C[C@@H](c2ccsc2)O1 ZINC001180076303 1049275462 /nfs/dbraw/zinc/27/54/62/1049275462.db2.gz DMUZICPPCWEHEV-HUAIYETOSA-N 1 2 317.429 4.362 20 0 DIADLO CCn1ccc(C[N@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC001180103850 1049285834 /nfs/dbraw/zinc/28/58/34/1049285834.db2.gz YDJAYORYZCWLGK-NSHDSACASA-N 1 2 312.244 4.403 20 0 DIADLO CCn1ccc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC001180103850 1049285840 /nfs/dbraw/zinc/28/58/40/1049285840.db2.gz YDJAYORYZCWLGK-NSHDSACASA-N 1 2 312.244 4.403 20 0 DIADLO COc1cc(C)ccc1C[N@@H+]1CCc2c(F)cc(F)cc2[C@@H]1C ZINC001180112119 1049289288 /nfs/dbraw/zinc/28/92/88/1049289288.db2.gz GZNOUSFQCWWYAK-ZDUSSCGKSA-N 1 2 317.379 4.401 20 0 DIADLO COc1cc(C)ccc1C[N@H+]1CCc2c(F)cc(F)cc2[C@@H]1C ZINC001180112119 1049289301 /nfs/dbraw/zinc/28/93/01/1049289301.db2.gz GZNOUSFQCWWYAK-ZDUSSCGKSA-N 1 2 317.379 4.401 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](C/C=C/c2cccc(F)c2)CCO1 ZINC001180121325 1049292049 /nfs/dbraw/zinc/29/20/49/1049292049.db2.gz QNPKIDYPGBSUSM-FKIZTMCRSA-N 1 2 311.400 4.221 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](C/C=C/c2cccc(F)c2)CCO1 ZINC001180121325 1049292062 /nfs/dbraw/zinc/29/20/62/1049292062.db2.gz QNPKIDYPGBSUSM-FKIZTMCRSA-N 1 2 311.400 4.221 20 0 DIADLO c1cn2c(cccc2-c2cccc3c2cnn3[C@H]2CCCCO2)[nH+]1 ZINC001204881848 1049295057 /nfs/dbraw/zinc/29/50/57/1049295057.db2.gz MLCWIHDTBBJICS-LJQANCHMSA-N 1 2 318.380 4.050 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2nn(C)cc2Cl)CC(C)C)c1 ZINC001180153656 1049299719 /nfs/dbraw/zinc/29/97/19/1049299719.db2.gz KEZZTFIXMWCCHJ-UHFFFAOYSA-N 1 2 305.853 4.040 20 0 DIADLO Cc1cccc(C[N@H+](Cc2nn(C)cc2Cl)CC(C)C)c1 ZINC001180153656 1049299732 /nfs/dbraw/zinc/29/97/32/1049299732.db2.gz KEZZTFIXMWCCHJ-UHFFFAOYSA-N 1 2 305.853 4.040 20 0 DIADLO COc1cc(OCc2ccccc2)ccc1-c1c[nH+]c(N)c(C)c1 ZINC001204889390 1049300995 /nfs/dbraw/zinc/30/09/95/1049300995.db2.gz KNRQCEOQDJPZNO-UHFFFAOYSA-N 1 2 320.392 4.227 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+](Cc1ccc(C)s1)C(C)C ZINC001204899368 1049303822 /nfs/dbraw/zinc/30/38/22/1049303822.db2.gz PZIPZLMEZNEKAB-UHFFFAOYSA-N 1 2 311.882 4.337 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+](Cc1ccc(C)s1)C(C)C ZINC001204899368 1049303831 /nfs/dbraw/zinc/30/38/31/1049303831.db2.gz PZIPZLMEZNEKAB-UHFFFAOYSA-N 1 2 311.882 4.337 20 0 DIADLO Cc1cc2cc(Nc3cc[nH+]c4ccc(Cl)cc34)cnc2[nH]1 ZINC001204896132 1049304329 /nfs/dbraw/zinc/30/43/29/1049304329.db2.gz GQBASQREALYRKO-UHFFFAOYSA-N 1 2 308.772 4.238 20 0 DIADLO CC[C@H]1C[N@H+](Cc2ccc(Oc3ccccc3)o2)C[C@H](C)O1 ZINC001204898929 1049304719 /nfs/dbraw/zinc/30/47/19/1049304719.db2.gz NIUFUMVMHLAOFJ-GJZGRUSLSA-N 1 2 301.386 4.071 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)o2)C[C@H](C)O1 ZINC001204898929 1049304729 /nfs/dbraw/zinc/30/47/29/1049304729.db2.gz NIUFUMVMHLAOFJ-GJZGRUSLSA-N 1 2 301.386 4.071 20 0 DIADLO C[C@@H]1[C@H](C)SCC[N@@H+]1Cc1ccc(F)c(C(F)(F)F)c1 ZINC001180199063 1049316866 /nfs/dbraw/zinc/31/68/66/1049316866.db2.gz OSHFLXMWDRSJEB-ZJUUUORDSA-N 1 2 307.356 4.170 20 0 DIADLO C[C@@H]1[C@H](C)SCC[N@H+]1Cc1ccc(F)c(C(F)(F)F)c1 ZINC001180199063 1049316882 /nfs/dbraw/zinc/31/68/82/1049316882.db2.gz OSHFLXMWDRSJEB-ZJUUUORDSA-N 1 2 307.356 4.170 20 0 DIADLO CC[N@H+](Cc1nc(Cl)cs1)[C@H](C)c1cccc(OC)c1 ZINC001180239145 1049318244 /nfs/dbraw/zinc/31/82/44/1049318244.db2.gz HQQZKTCEBVMCRF-LLVKDONJSA-N 1 2 310.850 4.388 20 0 DIADLO CC[N@@H+](Cc1nc(Cl)cs1)[C@H](C)c1cccc(OC)c1 ZINC001180239145 1049318257 /nfs/dbraw/zinc/31/82/57/1049318257.db2.gz HQQZKTCEBVMCRF-LLVKDONJSA-N 1 2 310.850 4.388 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3ncccc3Cl)CC2)cn1 ZINC000859225587 1049321849 /nfs/dbraw/zinc/32/18/49/1049321849.db2.gz UTPPGDKNCVVDCT-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3ncccc3Cl)CC2)cn1 ZINC000859225587 1049321859 /nfs/dbraw/zinc/32/18/59/1049321859.db2.gz UTPPGDKNCVVDCT-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO FC(F)(F)c1cc(Nc2ccn3cc[nH+]c3c2)cc(Cl)n1 ZINC001204958720 1049321833 /nfs/dbraw/zinc/32/18/33/1049321833.db2.gz AXIPKUYYVWVUQR-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO COc1ccc(Nc2ccn3cc[nH+]c3c2)c(C(F)(F)F)c1 ZINC001204970945 1049325665 /nfs/dbraw/zinc/32/56/65/1049325665.db2.gz CKMGSEIYQBWMSC-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(O)ccc1Cl)c1nc2c(s1)CCCC2 ZINC000859262970 1049325900 /nfs/dbraw/zinc/32/59/00/1049325900.db2.gz VFYSFVSIECTYQX-SNVBAGLBSA-N 1 2 322.861 4.232 20 0 DIADLO Cc1cnn(-c2cccc(Cl)c2)c1Nc1ccn2cc[nH+]c2c1 ZINC001204971368 1049326640 /nfs/dbraw/zinc/32/66/40/1049326640.db2.gz JQHPAJFEOIVUOP-UHFFFAOYSA-N 1 2 323.787 4.225 20 0 DIADLO Cc1cnn(-c2ccc(Cl)cc2)c1Nc1ccn2cc[nH+]c2c1 ZINC001204971982 1049328308 /nfs/dbraw/zinc/32/83/08/1049328308.db2.gz RWEFXMWLTBBWEQ-UHFFFAOYSA-N 1 2 323.787 4.225 20 0 DIADLO COc1cc(Nc2ccn3cc[nH+]c3c2)c(Cl)cc1Cl ZINC001204978610 1049330332 /nfs/dbraw/zinc/33/03/32/1049330332.db2.gz WIBDAGADUZOQFO-UHFFFAOYSA-N 1 2 308.168 4.393 20 0 DIADLO CNc1ccc(C(F)(F)F)cc1Nc1ccn2cc[nH+]c2c1 ZINC001204982739 1049330921 /nfs/dbraw/zinc/33/09/21/1049330921.db2.gz HHIKPHQDSWRLAQ-UHFFFAOYSA-N 1 2 306.291 4.138 20 0 DIADLO C[C@H]1C[NH+](Cc2nc(Cl)ccc2Cl)C[C@H](C)C1(F)F ZINC000859415646 1049332355 /nfs/dbraw/zinc/33/23/55/1049332355.db2.gz SVIVTNLMZYIOED-IUCAKERBSA-N 1 2 309.187 4.112 20 0 DIADLO COc1cc(Cl)c(Nc2ccn3cc[nH+]c3c2)c(Cl)c1 ZINC001204991658 1049333433 /nfs/dbraw/zinc/33/34/33/1049333433.db2.gz QSGVXGKWQWONQN-UHFFFAOYSA-N 1 2 308.168 4.393 20 0 DIADLO c1cn2ccc(Nc3ccc(Cc4cccnc4)cc3)cc2[nH+]1 ZINC001204990970 1049333719 /nfs/dbraw/zinc/33/37/19/1049333719.db2.gz JUCJUUOZSZVJMO-UHFFFAOYSA-N 1 2 300.365 4.064 20 0 DIADLO Fc1cc(Nc2ccn3cc[nH+]c3c2)cc(F)c1C(F)(F)F ZINC001204997385 1049335027 /nfs/dbraw/zinc/33/50/27/1049335027.db2.gz JKDIZKUEVMISAT-UHFFFAOYSA-N 1 2 313.229 4.375 20 0 DIADLO CCCCCCOC(=O)N(C)Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001194175480 1049336022 /nfs/dbraw/zinc/33/60/22/1049336022.db2.gz XYLIQKFCMKXKDQ-UHFFFAOYSA-N 1 2 315.417 4.021 20 0 DIADLO CCc1ccc(C)[nH+]c1Nc1cnc(Cl)n1[C@@H]1CCCCO1 ZINC001205005303 1049337683 /nfs/dbraw/zinc/33/76/83/1049337683.db2.gz DCEFDVQISUINLY-AWEZNQCLSA-N 1 2 320.824 4.245 20 0 DIADLO CCCCCCOC(=O)N[C@@H](C)c1c[nH+]c2c(C)cccn12 ZINC001194203939 1049341275 /nfs/dbraw/zinc/34/12/75/1049341275.db2.gz OCIMIEATADKKFB-AWEZNQCLSA-N 1 2 303.406 4.010 20 0 DIADLO CC(C)c1noc([C@H](C)[NH2+][C@@H](C)c2ccc3ncsc3c2)n1 ZINC000485843523 1049349818 /nfs/dbraw/zinc/34/98/18/1049349818.db2.gz JHDJIFDVQVMKSN-QWRGUYRKSA-N 1 2 316.430 4.215 20 0 DIADLO CCCn1cncc1C[N@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC001180403478 1049350870 /nfs/dbraw/zinc/35/08/70/1049350870.db2.gz LCNBBPZAWCZSIA-RDTXWAMCSA-N 1 2 313.445 4.174 20 0 DIADLO CCCn1cncc1C[N@@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC001180403478 1049350888 /nfs/dbraw/zinc/35/08/88/1049350888.db2.gz LCNBBPZAWCZSIA-RDTXWAMCSA-N 1 2 313.445 4.174 20 0 DIADLO COCOc1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1Cl ZINC001205042023 1049351184 /nfs/dbraw/zinc/35/11/84/1049351184.db2.gz CZFLDTMHGJVYPT-UHFFFAOYSA-N 1 2 314.772 4.380 20 0 DIADLO CC[C@]([NH2+]C[C@@H]1CCCCC1(C)C)(C(=O)OC)c1ccccc1 ZINC001194260541 1049351230 /nfs/dbraw/zinc/35/12/30/1049351230.db2.gz DQUDSKIHJJMVNX-FXAWDEMLSA-N 1 2 317.473 4.271 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1ccnn1CC1CCC1 ZINC001180393236 1049351338 /nfs/dbraw/zinc/35/13/38/1049351338.db2.gz MGYMBJUBXFZGPJ-CQSZACIVSA-N 1 2 301.409 4.015 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccnn1CC1CCC1 ZINC001180393236 1049351354 /nfs/dbraw/zinc/35/13/54/1049351354.db2.gz MGYMBJUBXFZGPJ-CQSZACIVSA-N 1 2 301.409 4.015 20 0 DIADLO Cc1ccc(-c2csc(C[NH2+][C@H](C)c3ccns3)n2)cc1 ZINC000860062242 1049366187 /nfs/dbraw/zinc/36/61/87/1049366187.db2.gz SDSDOTQYMQPSQO-GFCCVEGCSA-N 1 2 315.467 4.426 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+][C@H](C)c1ccns1 ZINC000860051753 1049366421 /nfs/dbraw/zinc/36/64/21/1049366421.db2.gz QTYQWFUXHDTEBI-SECBINFHSA-N 1 2 305.428 4.019 20 0 DIADLO Oc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c(C(F)(F)F)c1 ZINC001205092994 1049372723 /nfs/dbraw/zinc/37/27/23/1049372723.db2.gz TWKZBLPOELZTIG-UHFFFAOYSA-N 1 2 318.298 4.323 20 0 DIADLO Cc1ccc(C[NH2+]C2(c3c(F)cccc3F)CCC2)c(Cl)n1 ZINC000860205769 1049375395 /nfs/dbraw/zinc/37/53/95/1049375395.db2.gz UKTCXXGKNIGSIK-UHFFFAOYSA-N 1 2 322.786 4.491 20 0 DIADLO Fc1cccc(F)c1C1([NH2+]Cc2cccc(Cl)n2)CCC1 ZINC000860202154 1049375987 /nfs/dbraw/zinc/37/59/87/1049375987.db2.gz OJEMTISJMMOKIA-UHFFFAOYSA-N 1 2 308.759 4.182 20 0 DIADLO CC(C)(C)c1ccc(C2CC[NH+](Cc3nncs3)CC2)cc1 ZINC001194496988 1049382145 /nfs/dbraw/zinc/38/21/45/1049382145.db2.gz CJCQRRGEQFJWIM-UHFFFAOYSA-N 1 2 315.486 4.215 20 0 DIADLO CC(C)C[C@H]([NH2+]C[C@@H](C)c1ccc(F)cc1)C(=O)OC(C)(C)C ZINC001205136854 1049389628 /nfs/dbraw/zinc/38/96/28/1049389628.db2.gz KVTRTDRKXPFQIF-PBHICJAKSA-N 1 2 323.452 4.275 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[NH+]1CCC2(CCCC2)CC1 ZINC001194600807 1049397482 /nfs/dbraw/zinc/39/74/82/1049397482.db2.gz YLMYALXBSBRCKH-MRXNPFEDSA-N 1 2 321.848 4.210 20 0 DIADLO CC[N@H+](Cc1ccsc1Cl)Cc1ccc2c(c1)OCO2 ZINC001205161817 1049399039 /nfs/dbraw/zinc/39/90/39/1049399039.db2.gz IQECJZRKRPKVGN-UHFFFAOYSA-N 1 2 309.818 4.152 20 0 DIADLO CC[N@@H+](Cc1ccsc1Cl)Cc1ccc2c(c1)OCO2 ZINC001205161817 1049399051 /nfs/dbraw/zinc/39/90/51/1049399051.db2.gz IQECJZRKRPKVGN-UHFFFAOYSA-N 1 2 309.818 4.152 20 0 DIADLO CC1(C)C[N@H+](Cc2ccccc2CF)C[C@](C)(C(F)(F)F)O1 ZINC001194647657 1049403350 /nfs/dbraw/zinc/40/33/50/1049403350.db2.gz BJKMTPHKZFUYKW-OAHLLOKOSA-N 1 2 319.342 4.088 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccccc2CF)C[C@](C)(C(F)(F)F)O1 ZINC001194647657 1049403356 /nfs/dbraw/zinc/40/33/56/1049403356.db2.gz BJKMTPHKZFUYKW-OAHLLOKOSA-N 1 2 319.342 4.088 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccc(COc2ccccc2)cc1 ZINC001180788742 1049405313 /nfs/dbraw/zinc/40/53/13/1049405313.db2.gz YWKNBMKJFNNKSX-UHFFFAOYSA-N 1 2 321.424 4.484 20 0 DIADLO Fc1cc(F)c(-c2ccccc2Cn2cc[nH+]c2)c(F)c1F ZINC001205185384 1049405696 /nfs/dbraw/zinc/40/56/96/1049405696.db2.gz JKDWXIHJRJREFT-UHFFFAOYSA-N 1 2 306.262 4.155 20 0 DIADLO CC(C)Cc1ccc([C@H](C)C(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC001180900971 1049415422 /nfs/dbraw/zinc/41/54/22/1049415422.db2.gz HMPMBPKIRMIRAP-HNNXBMFYSA-N 1 2 321.424 4.275 20 0 DIADLO CCCCC[C@H]([NH2+]CCc1ccc(C(C)C)cc1)C(=O)OC ZINC001180954446 1049423311 /nfs/dbraw/zinc/42/33/11/1049423311.db2.gz VXLKSSDBZSVZRY-SFHVURJKSA-N 1 2 305.462 4.064 20 0 DIADLO Nc1c(F)cccc1C[N@@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC001204286569 1049423541 /nfs/dbraw/zinc/42/35/41/1049423541.db2.gz BMVNNZXFBYDJJB-KRWDZBQOSA-N 1 2 320.358 4.413 20 0 DIADLO Nc1c(F)cccc1C[N@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC001204286569 1049423548 /nfs/dbraw/zinc/42/35/48/1049423548.db2.gz BMVNNZXFBYDJJB-KRWDZBQOSA-N 1 2 320.358 4.413 20 0 DIADLO CC(C)c1cnc(C[NH2+]Cc2cc(Cl)cc3c2OCC3)s1 ZINC001205306664 1049434310 /nfs/dbraw/zinc/43/43/10/1049434310.db2.gz VDQRQZLNWPQXKF-UHFFFAOYSA-N 1 2 322.861 4.145 20 0 DIADLO CC[C@H](CC1CCCCC1)[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC001205320993 1049437491 /nfs/dbraw/zinc/43/74/91/1049437491.db2.gz XPPURWTVBJDPRG-QZTJIDSGSA-N 1 2 312.461 4.233 20 0 DIADLO CC[C@H](CC(C)C)c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001205322100 1049438255 /nfs/dbraw/zinc/43/82/55/1049438255.db2.gz UVHONHSDSCRHQL-CQSZACIVSA-N 1 2 310.401 4.462 20 0 DIADLO C[C@H](CC(=O)O[C@@H]1CCCc2ccc(Cl)cc21)n1cc[nH+]c1 ZINC000861402740 1049446429 /nfs/dbraw/zinc/44/64/29/1049446429.db2.gz FSSXFJXSYBCGTM-MLGOLLRUSA-N 1 2 318.804 4.108 20 0 DIADLO C[C@@H](CC(=O)O[C@H]1CCCc2ccc(Cl)cc21)n1cc[nH+]c1 ZINC000861404903 1049446651 /nfs/dbraw/zinc/44/66/51/1049446651.db2.gz FSSXFJXSYBCGTM-LRDDRELGSA-N 1 2 318.804 4.108 20 0 DIADLO COc1ccc2c(c1)OCC[N@@H+](Cc1ccc(Cl)c(C)c1)C2 ZINC001181184238 1049450173 /nfs/dbraw/zinc/45/01/73/1049450173.db2.gz FURLVQISDVGEQR-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO COc1ccc2c(c1)OCC[N@H+](Cc1ccc(Cl)c(C)c1)C2 ZINC001181184238 1049450176 /nfs/dbraw/zinc/45/01/76/1049450176.db2.gz FURLVQISDVGEQR-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO CC(C)c1ccccc1NC(=O)c1cccc(-c2c[nH+]cn2C)c1 ZINC001194887230 1049450848 /nfs/dbraw/zinc/45/08/48/1049450848.db2.gz LWCXSJQIEVJZIB-UHFFFAOYSA-N 1 2 319.408 4.463 20 0 DIADLO CC[N@H+](CC1CCN(C(=O)C(C)(C)C)CC1)c1ccc(C)cc1 ZINC000775623771 1049452449 /nfs/dbraw/zinc/45/24/49/1049452449.db2.gz NPZAIGFSYJVXGY-UHFFFAOYSA-N 1 2 316.489 4.106 20 0 DIADLO CC[N@@H+](CC1CCN(C(=O)C(C)(C)C)CC1)c1ccc(C)cc1 ZINC000775623771 1049452451 /nfs/dbraw/zinc/45/24/51/1049452451.db2.gz NPZAIGFSYJVXGY-UHFFFAOYSA-N 1 2 316.489 4.106 20 0 DIADLO CCCn1cncc1C[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001205367038 1049452846 /nfs/dbraw/zinc/45/28/46/1049452846.db2.gz PBGHDNRCOMJBIH-UHFFFAOYSA-N 1 2 315.848 4.236 20 0 DIADLO CCCn1cncc1C[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001205367038 1049452853 /nfs/dbraw/zinc/45/28/53/1049452853.db2.gz PBGHDNRCOMJBIH-UHFFFAOYSA-N 1 2 315.848 4.236 20 0 DIADLO O=C(CCC1CCC1)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000486765355 1049467837 /nfs/dbraw/zinc/46/78/37/1049467837.db2.gz WLSRPQYCMJVPEC-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCOCC3(CCCC3)C2)c1Cl ZINC001205453333 1049474325 /nfs/dbraw/zinc/47/43/25/1049474325.db2.gz CIWHJCFMRZQNAV-UHFFFAOYSA-N 1 2 315.791 4.011 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCOCC3(CCCC3)C2)c1Cl ZINC001205453333 1049474336 /nfs/dbraw/zinc/47/43/36/1049474336.db2.gz CIWHJCFMRZQNAV-UHFFFAOYSA-N 1 2 315.791 4.011 20 0 DIADLO CCOC(=O)[C@H]([NH2+][C@H]1CC(C)(C)C[C@@H]1C)c1cccc(C)c1C ZINC001205465590 1049478035 /nfs/dbraw/zinc/47/80/35/1049478035.db2.gz JAUJAIZXPVZTET-JCGIZDLHSA-N 1 2 317.473 4.322 20 0 DIADLO Cc1scc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)c1C ZINC001205475772 1049480458 /nfs/dbraw/zinc/48/04/58/1049480458.db2.gz WEXAAOKXVLRPJG-QGZVFWFLSA-N 1 2 323.408 4.217 20 0 DIADLO Cc1scc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)c1C ZINC001205475772 1049480467 /nfs/dbraw/zinc/48/04/67/1049480467.db2.gz WEXAAOKXVLRPJG-QGZVFWFLSA-N 1 2 323.408 4.217 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2cnc(C3CC3)o2)cc1F ZINC000862245793 1049481567 /nfs/dbraw/zinc/48/15/67/1049481567.db2.gz XVOJKKSKNCNTNL-MRXNPFEDSA-N 1 2 304.340 4.167 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2cnc(C3CC3)o2)cc1F ZINC000862245793 1049481573 /nfs/dbraw/zinc/48/15/73/1049481573.db2.gz XVOJKKSKNCNTNL-MRXNPFEDSA-N 1 2 304.340 4.167 20 0 DIADLO CC[C@@H](C)c1nnc([C@@H](C)[NH2+]Cc2ccc(-c3ccccc3)o2)[nH]1 ZINC000486876302 1049486315 /nfs/dbraw/zinc/48/63/15/1049486315.db2.gz CANGGLYZBMZFGV-ZIAGYGMSSA-N 1 2 324.428 4.429 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+]Cc2ccc(-c3ccccc3)o2)[nH]1 ZINC000486876301 1049486812 /nfs/dbraw/zinc/48/68/12/1049486812.db2.gz CANGGLYZBMZFGV-UONOGXRCSA-N 1 2 324.428 4.429 20 0 DIADLO CCN(CC)c1ccc(N[C@H](C)c2ccnc(Cl)c2)c[nH+]1 ZINC000777251068 1049488535 /nfs/dbraw/zinc/48/85/35/1049488535.db2.gz JTRBMYKVMGIBQC-GFCCVEGCSA-N 1 2 304.825 4.149 20 0 DIADLO COC1(c2ccccc2)C[NH+](C/C=C\c2cc(C)c(C)cc2C)C1 ZINC001181543557 1049488997 /nfs/dbraw/zinc/48/89/97/1049488997.db2.gz FMXREKSJUVPEDG-HJWRWDBZSA-N 1 2 321.464 4.483 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)c1Cl ZINC000862402613 1049492283 /nfs/dbraw/zinc/49/22/83/1049492283.db2.gz JFFUYZKWVXKYNF-ZDUSSCGKSA-N 1 2 307.718 4.239 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCC[C@]3(CC3(F)F)C2)c1Cl ZINC000862402613 1049492286 /nfs/dbraw/zinc/49/22/86/1049492286.db2.gz JFFUYZKWVXKYNF-ZDUSSCGKSA-N 1 2 307.718 4.239 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@@H](c3ccc(F)c(F)c3)C2)c(F)cn1 ZINC000862438495 1049494489 /nfs/dbraw/zinc/49/44/89/1049494489.db2.gz BOCFDDYKJOVDOG-GFCCVEGCSA-N 1 2 324.321 4.018 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@@H](c3ccc(F)c(F)c3)C2)c(F)cn1 ZINC000862438495 1049494497 /nfs/dbraw/zinc/49/44/97/1049494497.db2.gz BOCFDDYKJOVDOG-GFCCVEGCSA-N 1 2 324.321 4.018 20 0 DIADLO CC[N@@H+](Cc1cscc1Br)Cc1occc1C ZINC001195225939 1049499872 /nfs/dbraw/zinc/49/98/72/1049499872.db2.gz XYCFFNAGIPNWIR-UHFFFAOYSA-N 1 2 314.248 4.434 20 0 DIADLO CC[N@H+](Cc1cscc1Br)Cc1occc1C ZINC001195225939 1049499879 /nfs/dbraw/zinc/49/98/79/1049499879.db2.gz XYCFFNAGIPNWIR-UHFFFAOYSA-N 1 2 314.248 4.434 20 0 DIADLO CC(C)n1c[nH+]cc1CN1CC[C@@H](C)Sc2ccccc21 ZINC001181728419 1049507683 /nfs/dbraw/zinc/50/76/83/1049507683.db2.gz CYSMVNVSZJQRSB-CQSZACIVSA-N 1 2 301.459 4.355 20 0 DIADLO CC[C@H]1C[NH+](Cc2nc(-c3ccccc3)cs2)C[C@H](CC)O1 ZINC001195299181 1049512216 /nfs/dbraw/zinc/51/22/16/1049512216.db2.gz LYLOFGZMUKRXKH-HOTGVXAUSA-N 1 2 316.470 4.200 20 0 DIADLO Cc1ccc(Nc2ccnc(Cl)c2Br)c(C)[nH+]1 ZINC001203368041 1049513485 /nfs/dbraw/zinc/51/34/85/1049513485.db2.gz SYYWUKLNOJIFMI-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2CCO[C@@](C)(c3ccc(F)cc3)C2)c1 ZINC001205655727 1049523498 /nfs/dbraw/zinc/52/34/98/1049523498.db2.gz ZDPSCODKKGINJK-LJQANCHMSA-N 1 2 317.379 4.021 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2CCO[C@@](C)(c3ccc(F)cc3)C2)c1 ZINC001205655727 1049523509 /nfs/dbraw/zinc/52/35/09/1049523509.db2.gz ZDPSCODKKGINJK-LJQANCHMSA-N 1 2 317.379 4.021 20 0 DIADLO Cc1cc(F)c(C[NH2+]Cc2cccc3c2OC(C)(C)C3)c(F)c1 ZINC001203808936 1049534237 /nfs/dbraw/zinc/53/42/37/1049534237.db2.gz BLCXMJHKALCDQI-UHFFFAOYSA-N 1 2 317.379 4.277 20 0 DIADLO COCc1cccc(C[N@@H+]2CCc3sc(Cl)cc3C2)c1 ZINC001195509264 1049539826 /nfs/dbraw/zinc/53/98/26/1049539826.db2.gz VBCROHWNEGEVJA-UHFFFAOYSA-N 1 2 307.846 4.106 20 0 DIADLO COCc1cccc(C[N@H+]2CCc3sc(Cl)cc3C2)c1 ZINC001195509264 1049539838 /nfs/dbraw/zinc/53/98/38/1049539838.db2.gz VBCROHWNEGEVJA-UHFFFAOYSA-N 1 2 307.846 4.106 20 0 DIADLO C[C@H]1C[N@H+](Cc2nc(C(C)(C)C)cs2)CC2(CCCCC2)O1 ZINC001195650965 1049555198 /nfs/dbraw/zinc/55/51/98/1049555198.db2.gz TVKVBZUNLRKLCC-AWEZNQCLSA-N 1 2 322.518 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nc(C(C)(C)C)cs2)CC2(CCCCC2)O1 ZINC001195650965 1049555207 /nfs/dbraw/zinc/55/52/07/1049555207.db2.gz TVKVBZUNLRKLCC-AWEZNQCLSA-N 1 2 322.518 4.364 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(OC(C)C)c(Cl)c2)[C@H](C)CO1 ZINC001195748557 1049566642 /nfs/dbraw/zinc/56/66/42/1049566642.db2.gz LMGATJCYXHDDEZ-UKRRQHHQSA-N 1 2 311.853 4.127 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(OC(C)C)c(Cl)c2)[C@H](C)CO1 ZINC001195748557 1049566655 /nfs/dbraw/zinc/56/66/55/1049566655.db2.gz LMGATJCYXHDDEZ-UKRRQHHQSA-N 1 2 311.853 4.127 20 0 DIADLO CC[C@H]1C[N@H+](Cc2ccc(OC(C)C)c(Cl)c2)[C@@H](C)CO1 ZINC001195748561 1049567441 /nfs/dbraw/zinc/56/74/41/1049567441.db2.gz LMGATJCYXHDDEZ-ZFWWWQNUSA-N 1 2 311.853 4.127 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2ccc(OC(C)C)c(Cl)c2)[C@@H](C)CO1 ZINC001195748561 1049567451 /nfs/dbraw/zinc/56/74/51/1049567451.db2.gz LMGATJCYXHDDEZ-ZFWWWQNUSA-N 1 2 311.853 4.127 20 0 DIADLO CCc1ccc(-c2noc([C@H]([NH3+])c3cccc(Cl)c3)n2)cc1 ZINC001205812163 1049570445 /nfs/dbraw/zinc/57/04/45/1049570445.db2.gz MVLSAFKZUFOJRW-OAHLLOKOSA-N 1 2 313.788 4.001 20 0 DIADLO C[C@@H](SCc1c[nH+]cn1C)c1cccc(Br)c1 ZINC000487868472 1049580772 /nfs/dbraw/zinc/58/07/72/1049580772.db2.gz JGRLHOXRPHTQSK-SNVBAGLBSA-N 1 2 311.248 4.177 20 0 DIADLO CC(C)OC(=O)[C@H](C)[NH2+][C@H]1CCCC[C@H]1c1ccccc1Cl ZINC001205849019 1049581733 /nfs/dbraw/zinc/58/17/33/1049581733.db2.gz KUDNBKUDPVDHLJ-QRTARXTBSA-N 1 2 323.864 4.296 20 0 DIADLO Cc1ccc(Nc2cn3cc(C(F)(F)F)ccc3n2)c(C)[nH+]1 ZINC001203370257 1049584986 /nfs/dbraw/zinc/58/49/86/1049584986.db2.gz YJVNTJVMPUNKES-UHFFFAOYSA-N 1 2 306.291 4.109 20 0 DIADLO Cc1ccc(C[S@@](=O)Cc2ccc(Cl)cc2C)c(C)[nH+]1 ZINC000773994303 1049585822 /nfs/dbraw/zinc/58/58/22/1049585822.db2.gz MNVLCLUQPOHIQK-FQEVSTJZSA-N 1 2 307.846 4.109 20 0 DIADLO CC[NH+](CC)[C@H](C(=O)Nc1ccccc1)c1ccccc1Cl ZINC001182217896 1049591116 /nfs/dbraw/zinc/59/11/16/1049591116.db2.gz FJHQSAHPSGWSPQ-KRWDZBQOSA-N 1 2 316.832 4.362 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@@H+](Cc1cncc(Cl)c1)CC2 ZINC001195917615 1049591146 /nfs/dbraw/zinc/59/11/46/1049591146.db2.gz DFQVTEZANZYRAJ-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@H+](Cc1cncc(Cl)c1)CC2 ZINC001195917615 1049591161 /nfs/dbraw/zinc/59/11/61/1049591161.db2.gz DFQVTEZANZYRAJ-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1ncc(-c2cccs2)o1 ZINC000488034892 1049594679 /nfs/dbraw/zinc/59/46/79/1049594679.db2.gz VLQBLMONUZVYPV-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1ncc(-c2cccs2)o1 ZINC000488034892 1049594694 /nfs/dbraw/zinc/59/46/94/1049594694.db2.gz VLQBLMONUZVYPV-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](Cc1ccc(C2CC2)cc1)C1CC1 ZINC001182298875 1049610184 /nfs/dbraw/zinc/61/01/84/1049610184.db2.gz SGEOHBRWCBOUDM-AWEZNQCLSA-N 1 2 315.457 4.259 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](Cc1ccc(C2CC2)cc1)C1CC1 ZINC001182298875 1049610189 /nfs/dbraw/zinc/61/01/89/1049610189.db2.gz SGEOHBRWCBOUDM-AWEZNQCLSA-N 1 2 315.457 4.259 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCOC[C@@H]2c2cccc(F)c2)c(C)c1 ZINC001196142777 1049618172 /nfs/dbraw/zinc/61/81/72/1049618172.db2.gz RMTFVJZEKHGCCN-HXUWFJFHSA-N 1 2 313.416 4.324 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCOC[C@@H]2c2cccc(F)c2)c(C)c1 ZINC001196142777 1049618173 /nfs/dbraw/zinc/61/81/73/1049618173.db2.gz RMTFVJZEKHGCCN-HXUWFJFHSA-N 1 2 313.416 4.324 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccccc2CC(F)(F)F)cc1 ZINC000864022536 1049627642 /nfs/dbraw/zinc/62/76/42/1049627642.db2.gz JVOXZUNARNULSK-UHFFFAOYSA-N 1 2 308.347 4.470 20 0 DIADLO CCC[N@H+](Cc1nc(C)oc1C)[C@H](C)c1ccccc1OC ZINC000659857904 1049633238 /nfs/dbraw/zinc/63/32/38/1049633238.db2.gz AGGUKPAAVRZJSR-CYBMUJFWSA-N 1 2 302.418 4.273 20 0 DIADLO CCC[N@@H+](Cc1nc(C)oc1C)[C@H](C)c1ccccc1OC ZINC000659857904 1049633247 /nfs/dbraw/zinc/63/32/47/1049633247.db2.gz AGGUKPAAVRZJSR-CYBMUJFWSA-N 1 2 302.418 4.273 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1Cl)c1nccn1-c1ccccc1 ZINC000488319660 1049633302 /nfs/dbraw/zinc/63/33/02/1049633302.db2.gz AANQKXGERDUKJL-AWEZNQCLSA-N 1 2 311.816 4.377 20 0 DIADLO CCC[N@H+](Cc1nc(C)oc1C)[C@@H](C)c1ccccc1OC ZINC000659857906 1049634307 /nfs/dbraw/zinc/63/43/07/1049634307.db2.gz AGGUKPAAVRZJSR-ZDUSSCGKSA-N 1 2 302.418 4.273 20 0 DIADLO CCC[N@@H+](Cc1nc(C)oc1C)[C@@H](C)c1ccccc1OC ZINC000659857906 1049634317 /nfs/dbraw/zinc/63/43/17/1049634317.db2.gz AGGUKPAAVRZJSR-ZDUSSCGKSA-N 1 2 302.418 4.273 20 0 DIADLO Cc1nn(C[NH+]2CCC3(CCCCC3)CC2)c(=S)n1C1CC1 ZINC000102393531 1049637268 /nfs/dbraw/zinc/63/72/68/1049637268.db2.gz LMHOEWGQKJRCOV-UHFFFAOYSA-N 1 2 320.506 4.061 20 0 DIADLO Oc1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccccc2)c(F)c1F ZINC001206047564 1049638986 /nfs/dbraw/zinc/63/89/86/1049638986.db2.gz JJYIFPKNQDOUMP-SFHVURJKSA-N 1 2 315.363 4.398 20 0 DIADLO Oc1ccc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccccc2)c(F)c1F ZINC001206047564 1049638990 /nfs/dbraw/zinc/63/89/90/1049638990.db2.gz JJYIFPKNQDOUMP-SFHVURJKSA-N 1 2 315.363 4.398 20 0 DIADLO Cc1cc(CN2C[C@@H]3CCCCN3c3ccccc32)cc(C)[nH+]1 ZINC001206054347 1049640942 /nfs/dbraw/zinc/64/09/42/1049640942.db2.gz FNQOSYLXZRYBKZ-SFHVURJKSA-N 1 2 307.441 4.078 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cn1ccn(C(C)C)c1=S ZINC000794664530 1049649479 /nfs/dbraw/zinc/64/94/79/1049649479.db2.gz UDERBYQAXJZVFF-UHFFFAOYSA-N 1 2 321.515 4.411 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cn1ccn(C(C)C)c1=S ZINC000794664530 1049649483 /nfs/dbraw/zinc/64/94/83/1049649483.db2.gz UDERBYQAXJZVFF-UHFFFAOYSA-N 1 2 321.515 4.411 20 0 DIADLO Cc1nc(C[N@@H+]2CCSC[C@@H]2c2cccc3ccccc32)co1 ZINC001206086601 1049650395 /nfs/dbraw/zinc/65/03/95/1049650395.db2.gz FPFAWJGJIBSYJW-LJQANCHMSA-N 1 2 324.449 4.426 20 0 DIADLO Cc1nc(C[N@H+]2CCSC[C@@H]2c2cccc3ccccc32)co1 ZINC001206086601 1049650397 /nfs/dbraw/zinc/65/03/97/1049650397.db2.gz FPFAWJGJIBSYJW-LJQANCHMSA-N 1 2 324.449 4.426 20 0 DIADLO S=c1ncccn1C[N@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC000794673210 1049652760 /nfs/dbraw/zinc/65/27/60/1049652760.db2.gz RFEBRZNGILUSBA-UHFFFAOYSA-N 1 2 317.845 4.013 20 0 DIADLO S=c1ncccn1C[N@@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC000794673210 1049652773 /nfs/dbraw/zinc/65/27/73/1049652773.db2.gz RFEBRZNGILUSBA-UHFFFAOYSA-N 1 2 317.845 4.013 20 0 DIADLO O[C@@H](c1ccccc1)[C@H]([NH2+]C/C(Cl)=C/Cl)c1ccccc1 ZINC000794658841 1049652816 /nfs/dbraw/zinc/65/28/16/1049652816.db2.gz PORJMFTZQJDUNA-ZMGFTNJLSA-N 1 2 322.235 4.370 20 0 DIADLO Cc1ccc2[nH+]cc(CN3C[C@H](C)CSc4ccccc43)n2c1 ZINC001206098459 1049653104 /nfs/dbraw/zinc/65/31/04/1049653104.db2.gz FNTBOYHAXFXHAN-HNNXBMFYSA-N 1 2 323.465 4.391 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2cc(F)cc(N3CCCC3)c2)c1 ZINC001206121420 1049659065 /nfs/dbraw/zinc/65/90/65/1049659065.db2.gz JKAJWNZPODEMNV-UHFFFAOYSA-N 1 2 312.388 4.455 20 0 DIADLO Fc1cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc(N2CCCC2)c1 ZINC001206121967 1049660817 /nfs/dbraw/zinc/66/08/17/1049660817.db2.gz MXZDZFXUCJJQMO-UHFFFAOYSA-N 1 2 307.372 4.483 20 0 DIADLO CCOC1(C)CCN(c2cc[nH+]c3c(Cl)cccc23)CC1 ZINC000488473853 1049661190 /nfs/dbraw/zinc/66/11/90/1049661190.db2.gz ADLGGDKWKMBZLK-UHFFFAOYSA-N 1 2 304.821 4.284 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2cc3ccccc3o2)[nH]1 ZINC000488469727 1049661922 /nfs/dbraw/zinc/66/19/22/1049661922.db2.gz ZMNJVVGCRJXJFM-XQQFMLRXSA-N 1 2 312.417 4.476 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(-c3ccccn3)n[nH]2)[C@H]1c1cccs1 ZINC001206136035 1049663883 /nfs/dbraw/zinc/66/38/83/1049663883.db2.gz QBGGJOMBMNBROX-KRWDZBQOSA-N 1 2 324.453 4.116 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(-c3ccccn3)n[nH]2)[C@H]1c1cccs1 ZINC001206136035 1049663890 /nfs/dbraw/zinc/66/38/90/1049663890.db2.gz QBGGJOMBMNBROX-KRWDZBQOSA-N 1 2 324.453 4.116 20 0 DIADLO CC(C)[C@@H]1C[C@H](Nc2ccc(N3CCCCC3)[nH+]c2)CS1 ZINC000488518624 1049672928 /nfs/dbraw/zinc/67/29/28/1049672928.db2.gz SVESUDRJXFAKED-HOTGVXAUSA-N 1 2 305.491 4.014 20 0 DIADLO c1ccc([C@H]2CC[C@@H](Nc3ccc(N4CCCC4)c[nH+]3)C2)cc1 ZINC001182499284 1049679409 /nfs/dbraw/zinc/67/94/09/1049679409.db2.gz NRBIVJCAAUDFAH-ZWKOTPCHSA-N 1 2 307.441 4.430 20 0 DIADLO F[C@]1(c2ccccc2)C[C@H]1[NH2+]Cc1cncc(Cl)c1Cl ZINC001182499935 1049679822 /nfs/dbraw/zinc/67/98/22/1049679822.db2.gz REQAHDDEBLJTSK-HIFRSBDPSA-N 1 2 311.187 4.115 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2nc(C(F)(F)F)cs2)CC1 ZINC000645980432 1049680280 /nfs/dbraw/zinc/68/02/80/1049680280.db2.gz HEKLMTOANJEASK-UHFFFAOYSA-N 1 2 312.360 4.249 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@@H](C)[C@H]2C(=O)OC(C)(C)C)c(F)c1 ZINC001182488579 1049680960 /nfs/dbraw/zinc/68/09/60/1049680960.db2.gz BTHVQJVEYFJYGF-PBHICJAKSA-N 1 2 321.436 4.076 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@@H](C)[C@H]2C(=O)OC(C)(C)C)c(F)c1 ZINC001182488579 1049680963 /nfs/dbraw/zinc/68/09/63/1049680963.db2.gz BTHVQJVEYFJYGF-PBHICJAKSA-N 1 2 321.436 4.076 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2ccc(Br)cc2)C[C@H](C)O1 ZINC000488614974 1049684573 /nfs/dbraw/zinc/68/45/73/1049684573.db2.gz SUKQAIFBIOONAS-SLEUVZQESA-N 1 2 312.251 4.009 20 0 DIADLO CC[C@@H]1C[N@H+]([C@@H](C)c2ccc(Br)cc2)C[C@H](C)O1 ZINC000488614974 1049684578 /nfs/dbraw/zinc/68/45/78/1049684578.db2.gz SUKQAIFBIOONAS-SLEUVZQESA-N 1 2 312.251 4.009 20 0 DIADLO CCC(C)(C)CC[NH2+][C@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001196735066 1049685815 /nfs/dbraw/zinc/68/58/15/1049685815.db2.gz CMQCTQGACVQODM-QGZVFWFLSA-N 1 2 319.489 4.355 20 0 DIADLO Cc1c(Cl)ccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c1F ZINC001206266287 1049694345 /nfs/dbraw/zinc/69/43/45/1049694345.db2.gz CMIPVSXICKXASW-UHFFFAOYSA-N 1 2 304.674 4.451 20 0 DIADLO CCCc1nc(C[N@H+](C)[C@@H](c2ccccc2C)C(C)C)no1 ZINC000488807069 1049698407 /nfs/dbraw/zinc/69/84/07/1049698407.db2.gz QGFRITNGXRNHDP-GOSISDBHSA-N 1 2 301.434 4.160 20 0 DIADLO CCCc1nc(C[N@@H+](C)[C@@H](c2ccccc2C)C(C)C)no1 ZINC000488807069 1049698418 /nfs/dbraw/zinc/69/84/18/1049698418.db2.gz QGFRITNGXRNHDP-GOSISDBHSA-N 1 2 301.434 4.160 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](c3ccccc3F)C2(C)C)no1 ZINC001197042139 1049713791 /nfs/dbraw/zinc/71/37/91/1049713791.db2.gz XOMPHIWNQKWPER-AWEZNQCLSA-N 1 2 317.408 4.100 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@@H](c3ccccc3F)C2(C)C)no1 ZINC001197042139 1049713797 /nfs/dbraw/zinc/71/37/97/1049713797.db2.gz XOMPHIWNQKWPER-AWEZNQCLSA-N 1 2 317.408 4.100 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@H+](Cc2cc(C3CC3)no2)C1 ZINC001197078596 1049720127 /nfs/dbraw/zinc/72/01/27/1049720127.db2.gz YIDLMKJFSCJUTM-GOSISDBHSA-N 1 2 300.377 4.013 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@@H+](Cc2cc(C3CC3)no2)C1 ZINC001197078596 1049720134 /nfs/dbraw/zinc/72/01/34/1049720134.db2.gz YIDLMKJFSCJUTM-GOSISDBHSA-N 1 2 300.377 4.013 20 0 DIADLO Cn1cc(Cl)c(C[N@@H+]2CC(C)(C)C[C@H]2c2ccccc2)n1 ZINC001206385078 1049723653 /nfs/dbraw/zinc/72/36/53/1049723653.db2.gz RQEGQRUJJCEUIF-INIZCTEOSA-N 1 2 303.837 4.047 20 0 DIADLO Cn1cc(Cl)c(C[N@H+]2CC(C)(C)C[C@H]2c2ccccc2)n1 ZINC001206385078 1049723658 /nfs/dbraw/zinc/72/36/58/1049723658.db2.gz RQEGQRUJJCEUIF-INIZCTEOSA-N 1 2 303.837 4.047 20 0 DIADLO CCCCO[C@H]1C[C@H](Nc2ccc(N3CCCC3)c[nH+]2)C1(C)C ZINC001206376402 1049723749 /nfs/dbraw/zinc/72/37/49/1049723749.db2.gz GBWCQIILZBAWIS-IRXDYDNUSA-N 1 2 317.477 4.078 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCc3ccccc3C2(C)C)s1 ZINC001206384894 1049724368 /nfs/dbraw/zinc/72/43/68/1049724368.db2.gz PXFOOMLUFDTGOS-UHFFFAOYSA-N 1 2 318.511 4.300 20 0 DIADLO CSCc1cnc(C[N@H+]2CCc3ccccc3C2(C)C)s1 ZINC001206384894 1049724380 /nfs/dbraw/zinc/72/43/80/1049724380.db2.gz PXFOOMLUFDTGOS-UHFFFAOYSA-N 1 2 318.511 4.300 20 0 DIADLO Cc1cncc(C[N@@H+](C)Cc2ccccc2Oc2ccccc2)n1 ZINC001203176454 1049748713 /nfs/dbraw/zinc/74/87/13/1049748713.db2.gz ZOGLJTVXEFZXLT-UHFFFAOYSA-N 1 2 319.408 4.209 20 0 DIADLO Cc1cncc(C[N@H+](C)Cc2ccccc2Oc2ccccc2)n1 ZINC001203176454 1049748723 /nfs/dbraw/zinc/74/87/23/1049748723.db2.gz ZOGLJTVXEFZXLT-UHFFFAOYSA-N 1 2 319.408 4.209 20 0 DIADLO Clc1ccc(/C=C\C[N@@H+]2CCCC[C@@H]2c2ncccn2)cc1 ZINC001197450771 1049752336 /nfs/dbraw/zinc/75/23/36/1049752336.db2.gz SLJQXAWFFIOCPL-MAVJXHJTSA-N 1 2 313.832 4.370 20 0 DIADLO Clc1ccc(/C=C\C[N@H+]2CCCC[C@@H]2c2ncccn2)cc1 ZINC001197450771 1049752343 /nfs/dbraw/zinc/75/23/43/1049752343.db2.gz SLJQXAWFFIOCPL-MAVJXHJTSA-N 1 2 313.832 4.370 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Oc3ccccc3)o2)C2(CCC2)CO1 ZINC001206545204 1049752997 /nfs/dbraw/zinc/75/29/97/1049752997.db2.gz UGAVQBAYJQRODV-HNNXBMFYSA-N 1 2 313.397 4.215 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)o2)C2(CCC2)CO1 ZINC001206545204 1049753004 /nfs/dbraw/zinc/75/30/04/1049753004.db2.gz UGAVQBAYJQRODV-HNNXBMFYSA-N 1 2 313.397 4.215 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc2n[nH]cc2c(F)c1 ZINC001206579789 1049760543 /nfs/dbraw/zinc/76/05/43/1049760543.db2.gz ZFQBFHSCFWLDJV-UHFFFAOYSA-N 1 2 310.376 4.063 20 0 DIADLO Cc1cc2[nH]ccc2c(-c2ccc(C[NH+]3CCOCC3)cc2F)c1 ZINC001206719636 1049783509 /nfs/dbraw/zinc/78/35/09/1049783509.db2.gz MIPYHOQSAGJRRA-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Fc1cc(C[NH+]2CCOCC2)ccc1-c1ccccc1C1CC1 ZINC001206733809 1049785950 /nfs/dbraw/zinc/78/59/50/1049785950.db2.gz BWVVFDDZRIZPCY-UHFFFAOYSA-N 1 2 311.400 4.202 20 0 DIADLO COc1cc(C)ccc1C[N@H+](CC(=O)c1ccccc1)C(C)C ZINC001206768893 1049795536 /nfs/dbraw/zinc/79/55/36/1049795536.db2.gz FHMRZUVORCIWTC-UHFFFAOYSA-N 1 2 311.425 4.097 20 0 DIADLO COc1cc(C)ccc1C[N@@H+](CC(=O)c1ccccc1)C(C)C ZINC001206768893 1049795543 /nfs/dbraw/zinc/79/55/43/1049795543.db2.gz FHMRZUVORCIWTC-UHFFFAOYSA-N 1 2 311.425 4.097 20 0 DIADLO Cc1cc(C[N@@H+]2C[C@H]3C[C@@]3(c3ccc(Cl)c(Cl)c3)C2)no1 ZINC001206820161 1049805806 /nfs/dbraw/zinc/80/58/06/1049805806.db2.gz FEPGWTPGGJCSNH-WBMJQRKESA-N 1 2 323.223 4.063 20 0 DIADLO Cc1cc(C[N@H+]2C[C@H]3C[C@@]3(c3ccc(Cl)c(Cl)c3)C2)no1 ZINC001206820161 1049805816 /nfs/dbraw/zinc/80/58/16/1049805816.db2.gz FEPGWTPGGJCSNH-WBMJQRKESA-N 1 2 323.223 4.063 20 0 DIADLO COc1ccc(-c2cc(C[N@@H+]3CCCC[C@](C)(F)C3)no2)cc1 ZINC001206825959 1049807514 /nfs/dbraw/zinc/80/75/14/1049807514.db2.gz SGDMRZYGUFQYHW-SFHVURJKSA-N 1 2 318.392 4.064 20 0 DIADLO COc1ccc(-c2cc(C[N@H+]3CCCC[C@](C)(F)C3)no2)cc1 ZINC001206825959 1049807516 /nfs/dbraw/zinc/80/75/16/1049807516.db2.gz SGDMRZYGUFQYHW-SFHVURJKSA-N 1 2 318.392 4.064 20 0 DIADLO c1c(C[N@@H+]2CCCC[C@H]2c2cccnc2)noc1-c1ccccc1 ZINC001206844593 1049813769 /nfs/dbraw/zinc/81/37/69/1049813769.db2.gz XHFJFKDIRYHKOP-IBGZPJMESA-N 1 2 319.408 4.464 20 0 DIADLO c1c(C[N@H+]2CCCC[C@H]2c2cccnc2)noc1-c1ccccc1 ZINC001206844593 1049813773 /nfs/dbraw/zinc/81/37/73/1049813773.db2.gz XHFJFKDIRYHKOP-IBGZPJMESA-N 1 2 319.408 4.464 20 0 DIADLO COc1cccc([C@H]2CCCC[N@@H+]2Cc2c(F)cncc2F)c1 ZINC001206860386 1049814711 /nfs/dbraw/zinc/81/47/11/1049814711.db2.gz CDYYCTVIAJQDQP-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cccc([C@H]2CCCC[N@H+]2Cc2c(F)cncc2F)c1 ZINC001206860386 1049814717 /nfs/dbraw/zinc/81/47/17/1049814717.db2.gz CDYYCTVIAJQDQP-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO Fc1cncc(F)c1C[NH+]1CCC(Sc2ccccc2)CC1 ZINC001206859487 1049814975 /nfs/dbraw/zinc/81/49/75/1049814975.db2.gz CKGNZURRQAZSDU-UHFFFAOYSA-N 1 2 320.408 4.117 20 0 DIADLO CCCOc1ccc(NCc2[nH+]cc(C)c(OC)c2C)cc1C ZINC001206999637 1049818593 /nfs/dbraw/zinc/81/85/93/1049818593.db2.gz LNFDHHBHXYWGQL-UHFFFAOYSA-N 1 2 314.429 4.416 20 0 DIADLO COc1cccc([C@H]2CCCC[N@@H+]2Cc2ncc3ccccn32)c1 ZINC001207053399 1049826415 /nfs/dbraw/zinc/82/64/15/1049826415.db2.gz QQMSQFHPQLGPCF-LJQANCHMSA-N 1 2 321.424 4.070 20 0 DIADLO COc1cccc([C@H]2CCCC[N@H+]2Cc2ncc3ccccn32)c1 ZINC001207053399 1049826423 /nfs/dbraw/zinc/82/64/23/1049826423.db2.gz QQMSQFHPQLGPCF-LJQANCHMSA-N 1 2 321.424 4.070 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ncc3ccccn32)C2CC2)c1C ZINC001207055402 1049826554 /nfs/dbraw/zinc/82/65/54/1049826554.db2.gz WLXGMMBBLHARKA-UHFFFAOYSA-N 1 2 305.425 4.116 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ncc3ccccn32)C2CC2)c1C ZINC001207055402 1049826562 /nfs/dbraw/zinc/82/65/62/1049826562.db2.gz WLXGMMBBLHARKA-UHFFFAOYSA-N 1 2 305.425 4.116 20 0 DIADLO Cc1ncc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)s1 ZINC001207061134 1049827428 /nfs/dbraw/zinc/82/74/28/1049827428.db2.gz CBUDPNWQQMCULW-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1ncc(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)s1 ZINC001207061134 1049827434 /nfs/dbraw/zinc/82/74/34/1049827434.db2.gz CBUDPNWQQMCULW-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1cnc(C[N@@H+](C)Cc2ccccc2Oc2ccccc2)cn1 ZINC001207078591 1049831988 /nfs/dbraw/zinc/83/19/88/1049831988.db2.gz LQXMILSIPGQLKG-UHFFFAOYSA-N 1 2 319.408 4.209 20 0 DIADLO Cc1cnc(C[N@H+](C)Cc2ccccc2Oc2ccccc2)cn1 ZINC001207078591 1049832005 /nfs/dbraw/zinc/83/20/05/1049832005.db2.gz LQXMILSIPGQLKG-UHFFFAOYSA-N 1 2 319.408 4.209 20 0 DIADLO CCC[NH+](CCC)Cn1nc(-c2cccc(C)c2)n(C)c1=S ZINC000913058234 1049834593 /nfs/dbraw/zinc/83/45/93/1049834593.db2.gz VEQYQGAVIFKRIB-UHFFFAOYSA-N 1 2 318.490 4.006 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1c(F)cccc1OC(F)F ZINC001207119057 1049838638 /nfs/dbraw/zinc/83/86/38/1049838638.db2.gz XHMMEUGVDGVXOR-UHFFFAOYSA-N 1 2 301.333 4.121 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1c(F)cccc1OC(F)F ZINC001207119057 1049838654 /nfs/dbraw/zinc/83/86/54/1049838654.db2.gz XHMMEUGVDGVXOR-UHFFFAOYSA-N 1 2 301.333 4.121 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001207175333 1049849895 /nfs/dbraw/zinc/84/98/95/1049849895.db2.gz KRINZARXHUJGCE-INIZCTEOSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001207175333 1049849905 /nfs/dbraw/zinc/84/99/05/1049849905.db2.gz KRINZARXHUJGCE-INIZCTEOSA-N 1 2 305.372 4.079 20 0 DIADLO FC[C@@H]1CC[N@H+](C[C@H]2C[C@H]2c2ccc(Cl)cc2)CC1(F)F ZINC001207184105 1049855030 /nfs/dbraw/zinc/85/50/30/1049855030.db2.gz ZELMHVBJVLQGMQ-IPYPFGDCSA-N 1 2 317.782 4.370 20 0 DIADLO FC[C@@H]1CC[N@@H+](C[C@H]2C[C@H]2c2ccc(Cl)cc2)CC1(F)F ZINC001207184105 1049855045 /nfs/dbraw/zinc/85/50/45/1049855045.db2.gz ZELMHVBJVLQGMQ-IPYPFGDCSA-N 1 2 317.782 4.370 20 0 DIADLO Cc1[nH]c(CNc2ccc3oc(CC(C)(C)C)nc3c2)[nH+]c1C ZINC000570826934 1049877767 /nfs/dbraw/zinc/87/77/67/1049877767.db2.gz IKFDOCLOJUBTCB-UHFFFAOYSA-N 1 2 312.417 4.368 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc3c(c2)CCCCC3)cc(C)[nH+]1 ZINC001207378398 1049886387 /nfs/dbraw/zinc/88/63/87/1049886387.db2.gz IWVIICBHWCGPQV-UHFFFAOYSA-N 1 2 323.440 4.289 20 0 DIADLO CC[N@H+](C)[C@H](c1nc(C2(CC)CCCC2)no1)c1ccccc1 ZINC000570890041 1049890494 /nfs/dbraw/zinc/89/04/94/1049890494.db2.gz DJKNFKDWFYICHG-INIZCTEOSA-N 1 2 313.445 4.333 20 0 DIADLO CC[N@@H+](C)[C@H](c1nc(C2(CC)CCCC2)no1)c1ccccc1 ZINC000570890041 1049890498 /nfs/dbraw/zinc/89/04/98/1049890498.db2.gz DJKNFKDWFYICHG-INIZCTEOSA-N 1 2 313.445 4.333 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc(C2(CC)CCCC2)no1)c1ccccc1 ZINC000570890042 1049890660 /nfs/dbraw/zinc/89/06/60/1049890660.db2.gz DJKNFKDWFYICHG-MRXNPFEDSA-N 1 2 313.445 4.333 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc(C2(CC)CCCC2)no1)c1ccccc1 ZINC000570890042 1049890664 /nfs/dbraw/zinc/89/06/64/1049890664.db2.gz DJKNFKDWFYICHG-MRXNPFEDSA-N 1 2 313.445 4.333 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1coc(-c2cccc(F)c2)n1 ZINC000586768347 1049895694 /nfs/dbraw/zinc/89/56/94/1049895694.db2.gz SNLNZPOXMIUGTC-UHFFFAOYSA-N 1 2 316.298 4.255 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1coc(-c2cccc(F)c2)n1 ZINC000586768347 1049895711 /nfs/dbraw/zinc/89/57/11/1049895711.db2.gz SNLNZPOXMIUGTC-UHFFFAOYSA-N 1 2 316.298 4.255 20 0 DIADLO Fc1ccc(C(F)(F)C[NH2+]C2CC3(C2)CCCC3)c(F)c1 ZINC001207459953 1049895807 /nfs/dbraw/zinc/89/58/07/1049895807.db2.gz QEVRLDABOLDLKE-UHFFFAOYSA-N 1 2 301.327 4.369 20 0 DIADLO COC(=O)[C@H]([NH2+]C1CCC(C)CC1)c1cccc2ccccc21 ZINC001207563693 1049909326 /nfs/dbraw/zinc/90/93/26/1049909326.db2.gz CUPVYUPAHXCHGR-GSQSYGFSSA-N 1 2 311.425 4.222 20 0 DIADLO CCc1cccc(F)c1C[NH2+][C@H](C)c1nccn1-c1ccccc1 ZINC000570963932 1049915915 /nfs/dbraw/zinc/91/59/15/1049915915.db2.gz XXUWCYLBLNKGQV-OAHLLOKOSA-N 1 2 323.415 4.425 20 0 DIADLO C[C@@H](CCCC(C)(C)O)CC[N@@H+]1Cc2cnc(Cl)cc2C1 ZINC001207693118 1049928254 /nfs/dbraw/zinc/92/82/54/1049928254.db2.gz NOQWKLNZYNXVGF-ZDUSSCGKSA-N 1 2 310.869 4.018 20 0 DIADLO C[C@@H](CCCC(C)(C)O)CC[N@H+]1Cc2cnc(Cl)cc2C1 ZINC001207693118 1049928260 /nfs/dbraw/zinc/92/82/60/1049928260.db2.gz NOQWKLNZYNXVGF-ZDUSSCGKSA-N 1 2 310.869 4.018 20 0 DIADLO CC[N@@H+](Cc1ccoc1C)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC001207814585 1049941142 /nfs/dbraw/zinc/94/11/42/1049941142.db2.gz YTDWEDMRSNQNIV-LBPRGKRZSA-N 1 2 304.459 4.191 20 0 DIADLO CC[N@H+](Cc1ccoc1C)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC001207814585 1049941148 /nfs/dbraw/zinc/94/11/48/1049941148.db2.gz YTDWEDMRSNQNIV-LBPRGKRZSA-N 1 2 304.459 4.191 20 0 DIADLO COC1CCC(CNc2[nH+]c3ccccc3n2C(C)C)CC1 ZINC001207872239 1049948695 /nfs/dbraw/zinc/94/86/95/1049948695.db2.gz AFMCZONXMIOPIA-UHFFFAOYSA-N 1 2 301.434 4.234 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](CCCC3CCCC3)CCO2)cc1F ZINC001208094268 1049973064 /nfs/dbraw/zinc/97/30/64/1049973064.db2.gz HPHVXRVBQZCJNH-GOSISDBHSA-N 1 2 309.400 4.309 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](CCCC3CCCC3)CCO2)cc1F ZINC001208094268 1049973069 /nfs/dbraw/zinc/97/30/69/1049973069.db2.gz HPHVXRVBQZCJNH-GOSISDBHSA-N 1 2 309.400 4.309 20 0 DIADLO CC1=C[C@@H](C)[C@H](C[N@@H+]2Cc3cc(Br)cnc3C2)CC1 ZINC001208180599 1049982124 /nfs/dbraw/zinc/98/21/24/1049982124.db2.gz HEEPUVCLSOKGHN-OLZOCXBDSA-N 1 2 321.262 4.152 20 0 DIADLO CC1=C[C@@H](C)[C@H](C[N@H+]2Cc3cc(Br)cnc3C2)CC1 ZINC001208180599 1049982130 /nfs/dbraw/zinc/98/21/30/1049982130.db2.gz HEEPUVCLSOKGHN-OLZOCXBDSA-N 1 2 321.262 4.152 20 0 DIADLO Cc1cccn2cc(CC(=O)Nc3ccccc3C(C)(C)C)[nH+]c12 ZINC000588352172 1049982946 /nfs/dbraw/zinc/98/29/46/1049982946.db2.gz GXWVKXGMFAASES-UHFFFAOYSA-N 1 2 321.424 4.121 20 0 DIADLO C[C@H](CC[N@@H+]1Cc2cnn(C3CCOCC3)c2C1)CC(C)(C)C ZINC001208663316 1050000567 /nfs/dbraw/zinc/00/05/67/1050000567.db2.gz GNHZANHODVZNNP-OAHLLOKOSA-N 1 2 319.493 4.013 20 0 DIADLO C[C@H](CC[N@H+]1Cc2cnn(C3CCOCC3)c2C1)CC(C)(C)C ZINC001208663316 1050000569 /nfs/dbraw/zinc/00/05/69/1050000569.db2.gz GNHZANHODVZNNP-OAHLLOKOSA-N 1 2 319.493 4.013 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2cscn2)c(OC(F)F)cc1C ZINC000572379315 1050001737 /nfs/dbraw/zinc/00/17/37/1050001737.db2.gz BTEGUDRHJDYPLC-NSHDSACASA-N 1 2 312.385 4.212 20 0 DIADLO C[C@@H](C[N@@H+]1Cc2ccc(Cl)cc2C1)OCc1ccccc1 ZINC001208701796 1050003746 /nfs/dbraw/zinc/00/37/46/1050003746.db2.gz CZOVPUGOFZHBSY-AWEZNQCLSA-N 1 2 301.817 4.261 20 0 DIADLO C[C@@H](C[N@H+]1Cc2ccc(Cl)cc2C1)OCc1ccccc1 ZINC001208701796 1050003752 /nfs/dbraw/zinc/00/37/52/1050003752.db2.gz CZOVPUGOFZHBSY-AWEZNQCLSA-N 1 2 301.817 4.261 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(CC(C)C)cc3)ccc2[nH+]1 ZINC000588859934 1050006206 /nfs/dbraw/zinc/00/62/06/1050006206.db2.gz WLGKMFCXOQMMBP-UHFFFAOYSA-N 1 2 307.397 4.094 20 0 DIADLO CC/C=C\CCN1CCC[C@@]2(CC[N@@H+]2Cc2cccc(F)c2)C1 ZINC001208728999 1050006872 /nfs/dbraw/zinc/00/68/72/1050006872.db2.gz YJLSJPJZJRUNBH-HZQHCPKGSA-N 1 2 316.464 4.222 20 0 DIADLO CC/C=C\CCN1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001208728999 1050006878 /nfs/dbraw/zinc/00/68/78/1050006878.db2.gz YJLSJPJZJRUNBH-HZQHCPKGSA-N 1 2 316.464 4.222 20 0 DIADLO C[C@@H](C[N@@H+]1CCO[C@](C)(c2ccc(Cl)cc2)C1)C(F)(F)F ZINC001208890324 1050020938 /nfs/dbraw/zinc/02/09/38/1050020938.db2.gz DEZBJGIHLQGYHO-FZMZJTMJSA-N 1 2 321.770 4.086 20 0 DIADLO C[C@@H](C[N@H+]1CCO[C@](C)(c2ccc(Cl)cc2)C1)C(F)(F)F ZINC001208890324 1050020944 /nfs/dbraw/zinc/02/09/44/1050020944.db2.gz DEZBJGIHLQGYHO-FZMZJTMJSA-N 1 2 321.770 4.086 20 0 DIADLO CC[N@H+](C)c1ccc(NC2=CCN(c3ccccc3)CC2)cc1 ZINC001209165325 1050040583 /nfs/dbraw/zinc/04/05/83/1050040583.db2.gz MFVNBGXOZBEWEU-UHFFFAOYSA-N 1 2 307.441 4.349 20 0 DIADLO CC[N@@H+](C)c1ccc(NC2=CCN(c3ccccc3)CC2)cc1 ZINC001209165325 1050040588 /nfs/dbraw/zinc/04/05/88/1050040588.db2.gz MFVNBGXOZBEWEU-UHFFFAOYSA-N 1 2 307.441 4.349 20 0 DIADLO FC1(F)C[N@H+](CCc2cccs2)CC[C@@H]1c1ccccc1 ZINC001209229114 1050045627 /nfs/dbraw/zinc/04/56/27/1050045627.db2.gz WDSNDXCRFZJWDF-MRXNPFEDSA-N 1 2 307.409 4.415 20 0 DIADLO FC1(F)C[N@@H+](CCc2cccs2)CC[C@@H]1c1ccccc1 ZINC001209229114 1050045633 /nfs/dbraw/zinc/04/56/33/1050045633.db2.gz WDSNDXCRFZJWDF-MRXNPFEDSA-N 1 2 307.409 4.415 20 0 DIADLO FC1(F)C[N@H+](CCc2cccs2)CC[C@H]1c1ccccc1 ZINC001209229113 1050046046 /nfs/dbraw/zinc/04/60/46/1050046046.db2.gz WDSNDXCRFZJWDF-INIZCTEOSA-N 1 2 307.409 4.415 20 0 DIADLO FC1(F)C[N@@H+](CCc2cccs2)CC[C@H]1c1ccccc1 ZINC001209229113 1050046049 /nfs/dbraw/zinc/04/60/49/1050046049.db2.gz WDSNDXCRFZJWDF-INIZCTEOSA-N 1 2 307.409 4.415 20 0 DIADLO c1coc([C@@H]([NH2+]Cc2ccc3nc[nH]c3c2)c2ccccc2)c1 ZINC000589638245 1050051850 /nfs/dbraw/zinc/05/18/50/1050051850.db2.gz QRLDFRTZCCCOIE-IBGZPJMESA-N 1 2 303.365 4.035 20 0 DIADLO CC(C)(C)c1ccc(OCC[NH2+]Cc2n[nH]c3ccccc32)cc1 ZINC000589645419 1050053380 /nfs/dbraw/zinc/05/33/80/1050053380.db2.gz PSCXCAWECOSVEP-UHFFFAOYSA-N 1 2 323.440 4.029 20 0 DIADLO Cc1[nH]ncc1C[NH+]1CCC(c2csc3ccccc23)CC1 ZINC001209562451 1050068375 /nfs/dbraw/zinc/06/83/75/1050068375.db2.gz WPQNVNLOJDRWLY-UHFFFAOYSA-N 1 2 311.454 4.312 20 0 DIADLO Cc1ccc(C[N@H+]2Cc3cc(Br)ccc3C[C@@H]2C)[nH]1 ZINC001209577301 1050069136 /nfs/dbraw/zinc/06/91/36/1050069136.db2.gz NJDJAEWTPLBCKF-LBPRGKRZSA-N 1 2 319.246 4.032 20 0 DIADLO Cc1ccc(C[N@@H+]2Cc3cc(Br)ccc3C[C@@H]2C)[nH]1 ZINC001209577301 1050069141 /nfs/dbraw/zinc/06/91/41/1050069141.db2.gz NJDJAEWTPLBCKF-LBPRGKRZSA-N 1 2 319.246 4.032 20 0 DIADLO CCCN(Cc1ccccc1)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000590014050 1050070130 /nfs/dbraw/zinc/07/01/30/1050070130.db2.gz UEDNKEMVXDNSDO-UHFFFAOYSA-N 1 2 322.412 4.087 20 0 DIADLO Cc1cn2cc(NC(=O)N[C@H](c3ccccc3)C(C)C)ccc2[nH+]1 ZINC000590014077 1050070143 /nfs/dbraw/zinc/07/01/43/1050070143.db2.gz WGSJTMZGAQIXPQ-SFHVURJKSA-N 1 2 322.412 4.162 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccccn2)c(F)cc1Cl ZINC001209665435 1050074902 /nfs/dbraw/zinc/07/49/02/1050074902.db2.gz ZODZQUKWGZROKN-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccccn2)c(F)cc1Cl ZINC001209665435 1050074908 /nfs/dbraw/zinc/07/49/08/1050074908.db2.gz ZODZQUKWGZROKN-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c(F)cc1Cl ZINC001209665395 1050075255 /nfs/dbraw/zinc/07/52/55/1050075255.db2.gz YBEBBVGYIZQKJD-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccncc2)c(F)cc1Cl ZINC001209665395 1050075258 /nfs/dbraw/zinc/07/52/58/1050075258.db2.gz YBEBBVGYIZQKJD-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(Cl)ccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c1F ZINC001209699014 1050077628 /nfs/dbraw/zinc/07/76/28/1050077628.db2.gz MOMYCGAZVQYWDS-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(Cl)ccc(C[N@H+]2CCC[C@@H]2c2cccnc2)c1F ZINC001209699014 1050077634 /nfs/dbraw/zinc/07/76/34/1050077634.db2.gz MOMYCGAZVQYWDS-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO F[C@@H]1C[N@H+](Cc2cc3cc(Cl)ccc3[nH]2)CCCC1(F)F ZINC001209718567 1050078286 /nfs/dbraw/zinc/07/82/86/1050078286.db2.gz PIDUJVCJAMXXFS-CQSZACIVSA-N 1 2 316.754 4.391 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2cc3cc(Cl)ccc3[nH]2)CCCC1(F)F ZINC001209718567 1050078292 /nfs/dbraw/zinc/07/82/92/1050078292.db2.gz PIDUJVCJAMXXFS-CQSZACIVSA-N 1 2 316.754 4.391 20 0 DIADLO Cc1ccc(N(C)C(=O)Nc2cc[nH+]c(N3CCCCC3)c2)cc1 ZINC001209729294 1050080876 /nfs/dbraw/zinc/08/08/76/1050080876.db2.gz XODYHFVLLBDMFT-UHFFFAOYSA-N 1 2 324.428 4.049 20 0 DIADLO CN(C)c1ccccc1C[N@@H+]1CCc2c3ccccc3oc2C1 ZINC001209780030 1050083424 /nfs/dbraw/zinc/08/34/24/1050083424.db2.gz YKPWXMCOYWIWCZ-UHFFFAOYSA-N 1 2 306.409 4.057 20 0 DIADLO CN(C)c1ccccc1C[N@H+]1CCc2c3ccccc3oc2C1 ZINC001209780030 1050083430 /nfs/dbraw/zinc/08/34/30/1050083430.db2.gz YKPWXMCOYWIWCZ-UHFFFAOYSA-N 1 2 306.409 4.057 20 0 DIADLO COc1c(F)ccc(Nc2[nH+]c3ccccc3n2C)c1Cl ZINC001209800448 1050086188 /nfs/dbraw/zinc/08/61/88/1050086188.db2.gz OARLVNIBEHFFSJ-UHFFFAOYSA-N 1 2 305.740 4.118 20 0 DIADLO COc1c(F)ccc(Nc2ccc3c(c2)[nH+]cn3C)c1Cl ZINC001209804487 1050087143 /nfs/dbraw/zinc/08/71/43/1050087143.db2.gz RCVIQWHBAKPNDQ-UHFFFAOYSA-N 1 2 305.740 4.118 20 0 DIADLO Cc1cc(C)c(Nc2ccccc2C[NH+]2CCOCC2)cc1C ZINC001209831412 1050090763 /nfs/dbraw/zinc/09/07/63/1050090763.db2.gz KOTYWBZYXCHDLE-UHFFFAOYSA-N 1 2 310.441 4.188 20 0 DIADLO Nc1n[nH]c2ccc(Nc3cc[nH+]c4cc(Cl)ccc34)cc12 ZINC001209859945 1050096577 /nfs/dbraw/zinc/09/65/77/1050096577.db2.gz LQEZPCUFFUYUTP-UHFFFAOYSA-N 1 2 309.760 4.090 20 0 DIADLO OCc1cc(Nc2cc[nH+]c3cc(Cl)ccc23)ccc1F ZINC001209876449 1050098344 /nfs/dbraw/zinc/09/83/44/1050098344.db2.gz ZBMYEWWDRJFVLL-UHFFFAOYSA-N 1 2 302.736 4.263 20 0 DIADLO COc1cc(Cl)ccc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001209907840 1050104182 /nfs/dbraw/zinc/10/41/82/1050104182.db2.gz AWMFYOYNPFXXOO-UHFFFAOYSA-N 1 2 308.168 4.393 20 0 DIADLO c1cc2c(cccc2Nc2ccccc2C[NH+]2CCOCC2)s1 ZINC001209931683 1050107774 /nfs/dbraw/zinc/10/77/74/1050107774.db2.gz CBMSHHRNAYGAGZ-UHFFFAOYSA-N 1 2 324.449 4.477 20 0 DIADLO Cc1c(Cl)cccc1Nc1ccccc1C[NH+]1CCOCC1 ZINC001209927592 1050107926 /nfs/dbraw/zinc/10/79/26/1050107926.db2.gz XGRDAYAGDGCGHN-UHFFFAOYSA-N 1 2 316.832 4.224 20 0 DIADLO Cc1cc(Nc2ccccc2C[NH+]2CCOCC2)cc(C)c1F ZINC001209931058 1050108223 /nfs/dbraw/zinc/10/82/23/1050108223.db2.gz YIKDDJVWJJJZSV-UHFFFAOYSA-N 1 2 314.404 4.018 20 0 DIADLO CO[C@@H](C)c1cccc(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001209951321 1050110663 /nfs/dbraw/zinc/11/06/63/1050110663.db2.gz OXCACOVZMXJUDW-HNNXBMFYSA-N 1 2 307.397 4.382 20 0 DIADLO CCOc1cccc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000068839565 1050111195 /nfs/dbraw/zinc/11/11/95/1050111195.db2.gz WJIUUWJQBCOXSV-CHWSQXEVSA-N 1 2 317.433 4.178 20 0 DIADLO CO[C@@H](C)c1cccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001209952507 1050111372 /nfs/dbraw/zinc/11/13/72/1050111372.db2.gz WABNJWUCEFZXIJ-HNNXBMFYSA-N 1 2 307.397 4.382 20 0 DIADLO Cn1c2ccccc2[nH+]c1Nc1cc(C(F)(F)F)ccc1O ZINC001209979508 1050114875 /nfs/dbraw/zinc/11/48/75/1050114875.db2.gz WZMKUSXAWBKLMA-UHFFFAOYSA-N 1 2 307.275 4.041 20 0 DIADLO Cc1cn2cccc(Nc3ccc(O)c(C(F)(F)F)c3)c2[nH+]1 ZINC001209984117 1050116176 /nfs/dbraw/zinc/11/61/76/1050116176.db2.gz GMPFDMUXQFYGAN-UHFFFAOYSA-N 1 2 307.275 4.111 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(C(C)(C)C)on1 ZINC000573047352 1050117407 /nfs/dbraw/zinc/11/74/07/1050117407.db2.gz GZFXDLRKSLJCGG-PWSUYJOCSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cc(C(C)(C)C)on1 ZINC000573047352 1050117409 /nfs/dbraw/zinc/11/74/09/1050117409.db2.gz GZFXDLRKSLJCGG-PWSUYJOCSA-N 1 2 304.356 4.135 20 0 DIADLO CC(=O)Nc1ccc(Cl)c(Nc2ccc([NH+](C)C)c(C)c2)c1 ZINC001210041319 1050127557 /nfs/dbraw/zinc/12/75/57/1050127557.db2.gz LJXWLANAAPWALM-UHFFFAOYSA-N 1 2 317.820 4.416 20 0 DIADLO Cc1cc(Nc2ccc(C(=O)N3CCCC3)cc2)ccc1[NH+](C)C ZINC001210040880 1050127772 /nfs/dbraw/zinc/12/77/72/1050127772.db2.gz DNXDEORRZSMJJK-UHFFFAOYSA-N 1 2 323.440 4.041 20 0 DIADLO Brc1cccnc1Nc1ccc2c[nH+]ccc2c1 ZINC001210043874 1050127827 /nfs/dbraw/zinc/12/78/27/1050127827.db2.gz LDUUZEDNDIHJDO-UHFFFAOYSA-N 1 2 300.159 4.136 20 0 DIADLO COc1cc(Nc2ccc([NH+](C)C)c(C)c2)ccc1-c1cnco1 ZINC001210044399 1050128205 /nfs/dbraw/zinc/12/82/05/1050128205.db2.gz ZGWONHDPYQUKJK-UHFFFAOYSA-N 1 2 323.396 4.468 20 0 DIADLO Cc1cc(Nc2ccc3c(c2)NC(=O)CCC3)ccc1[NH+](C)C ZINC001210044297 1050128368 /nfs/dbraw/zinc/12/83/68/1050128368.db2.gz WSNVOYNZLWFHSH-UHFFFAOYSA-N 1 2 309.413 4.079 20 0 DIADLO c1cnc2cc(Nc3ccc[nH+]c3N3CCCCC3)ccc2c1 ZINC001210054913 1050130954 /nfs/dbraw/zinc/13/09/54/1050130954.db2.gz VVJGVRJPXWUVSC-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO Cc1cc2[nH]ncc2cc1Nc1c[nH+]ccc1N1CCCCC1 ZINC001210101113 1050136793 /nfs/dbraw/zinc/13/67/93/1050136793.db2.gz DXYBAHWDCOGPSE-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO Cc1cc2n[nH]cc2cc1Nc1[nH+]cccc1N1CCCCC1 ZINC001210102171 1050137147 /nfs/dbraw/zinc/13/71/47/1050137147.db2.gz MEFXIBJHIBCMNN-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)n1 ZINC000646117711 1050145273 /nfs/dbraw/zinc/14/52/73/1050145273.db2.gz NGDOZLCQACUTKD-IBGZPJMESA-N 1 2 307.441 4.357 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)n1 ZINC000646117711 1050145274 /nfs/dbraw/zinc/14/52/74/1050145274.db2.gz NGDOZLCQACUTKD-IBGZPJMESA-N 1 2 307.441 4.357 20 0 DIADLO Oc1ccc2c(c1)C[C@@H](Nc1cc3cc(F)ccc3c[nH+]1)CC2 ZINC001171026911 1050150278 /nfs/dbraw/zinc/15/02/78/1050150278.db2.gz CZXNEJNXDANALA-KRWDZBQOSA-N 1 2 308.356 4.049 20 0 DIADLO Oc1ccc2c(c1)C[C@H](Nc1cc3cc(F)ccc3c[nH+]1)CC2 ZINC001171026912 1050150297 /nfs/dbraw/zinc/15/02/97/1050150297.db2.gz CZXNEJNXDANALA-QGZVFWFLSA-N 1 2 308.356 4.049 20 0 DIADLO Cc1cc(N[C@H]2CCc3ccc(O)cc3C2)[nH+]cc1C(F)(F)F ZINC001171027967 1050151948 /nfs/dbraw/zinc/15/19/48/1050151948.db2.gz IWABLYXETCHDEP-ZDUSSCGKSA-N 1 2 322.330 4.084 20 0 DIADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ncc(-c2ccccc2)s1 ZINC000573283230 1050153575 /nfs/dbraw/zinc/15/35/75/1050153575.db2.gz DMZWQEFKLCHORP-BFUOFWGJSA-N 1 2 322.433 4.422 20 0 DIADLO CCCCC[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C(C)(C)C ZINC001136774150 1050153567 /nfs/dbraw/zinc/15/35/67/1050153567.db2.gz SZHKHCODGDASMM-INIZCTEOSA-N 1 2 301.434 4.288 20 0 DIADLO CC(C)=C(C)C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000823770272 1050154745 /nfs/dbraw/zinc/15/47/45/1050154745.db2.gz PDTOBYJHFLYSAJ-UHFFFAOYSA-N 1 2 309.413 4.181 20 0 DIADLO CCCC[C@@H](C)N(CCCC)C(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000573259390 1050155977 /nfs/dbraw/zinc/15/59/77/1050155977.db2.gz VOIAQURKQJTKDU-HUUCEWRRSA-N 1 2 305.466 4.037 20 0 DIADLO CC(C)C[C@@H]1COCC[N@@H+]1Cc1cc2ccccc2nc1Cl ZINC000733796385 1050156655 /nfs/dbraw/zinc/15/66/55/1050156655.db2.gz RMPGVXRSTKDFFJ-MRXNPFEDSA-N 1 2 318.848 4.135 20 0 DIADLO CC(C)C[C@@H]1COCC[N@H+]1Cc1cc2ccccc2nc1Cl ZINC000733796385 1050156661 /nfs/dbraw/zinc/15/66/61/1050156661.db2.gz RMPGVXRSTKDFFJ-MRXNPFEDSA-N 1 2 318.848 4.135 20 0 DIADLO Cl/C=C(\Cl)C[NH+]1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000746503335 1050158749 /nfs/dbraw/zinc/15/87/49/1050158749.db2.gz YUVCKOOPAVNZOC-XFXZXTDPSA-N 1 2 310.228 4.061 20 0 DIADLO Cc1cc(Nc2cccc3cc[nH+]cc32)n(-c2ccccc2)n1 ZINC001210222394 1050162896 /nfs/dbraw/zinc/16/28/96/1050162896.db2.gz FUNYZWOPWCZJFE-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO c1ccc2c(c1)C=C(CNc1ccc([NH+]3CCCC3)cc1)CO2 ZINC000770480082 1050165438 /nfs/dbraw/zinc/16/54/38/1050165438.db2.gz AFBKRJIYFYZXAC-UHFFFAOYSA-N 1 2 306.409 4.175 20 0 DIADLO Fc1ccc(Br)c(Nc2cccc3cc[nH+]cc32)n1 ZINC001210224164 1050165716 /nfs/dbraw/zinc/16/57/16/1050165716.db2.gz GHONTLROSQYISH-UHFFFAOYSA-N 1 2 318.149 4.275 20 0 DIADLO FC(F)(F)Oc1cccnc1Nc1cccc2cc[nH+]cc21 ZINC001210224493 1050167743 /nfs/dbraw/zinc/16/77/43/1050167743.db2.gz PMVJMRMHEKLZKH-UHFFFAOYSA-N 1 2 305.259 4.272 20 0 DIADLO Fc1ccc(Nc2cccc3cc[nH+]cc32)c(Br)n1 ZINC001210224461 1050167934 /nfs/dbraw/zinc/16/79/34/1050167934.db2.gz NRIFBYSMLRSZJH-UHFFFAOYSA-N 1 2 318.149 4.275 20 0 DIADLO Fc1ccc(-n2nccc2Nc2cccc3cc[nH+]cc32)cc1 ZINC001210224448 1050168085 /nfs/dbraw/zinc/16/80/85/1050168085.db2.gz MXGYWBWWDRZZTD-UHFFFAOYSA-N 1 2 304.328 4.303 20 0 DIADLO c1cc2cc[nH+]cc2c(Nc2cncc(N3CCCCC3)c2)c1 ZINC001210226476 1050168632 /nfs/dbraw/zinc/16/86/32/1050168632.db2.gz XWNXYPSMQDJZED-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO COCCOc1ccc(F)cc1Nc1cccc2cc[nH+]cc21 ZINC001210232046 1050169554 /nfs/dbraw/zinc/16/95/54/1050169554.db2.gz XHHPPSFSNXCENU-UHFFFAOYSA-N 1 2 312.344 4.143 20 0 DIADLO Oc1ccc(Br)cc1Nc1cccc2cc[nH+]cc21 ZINC001210232007 1050170225 /nfs/dbraw/zinc/17/02/25/1050170225.db2.gz VRYVYWGCWOTKHB-UHFFFAOYSA-N 1 2 315.170 4.447 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2ccnc(Cl)c2F)on1 ZINC000823937638 1050170345 /nfs/dbraw/zinc/17/03/45/1050170345.db2.gz FAHPUXKIPKUXPI-UHFFFAOYSA-N 1 2 311.788 4.056 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(C)on2)cc1OCC ZINC000282669626 1050172237 /nfs/dbraw/zinc/17/22/37/1050172237.db2.gz JAYHGSZYAAASRM-KBPBESRZSA-N 1 2 318.417 4.192 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)c(F)cn1 ZINC000824136044 1050183663 /nfs/dbraw/zinc/18/36/63/1050183663.db2.gz SUVWAOAVZFIYHC-ROJDOSBLSA-N 1 2 300.352 4.038 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)c(F)cn1 ZINC000824136044 1050183669 /nfs/dbraw/zinc/18/36/69/1050183669.db2.gz SUVWAOAVZFIYHC-ROJDOSBLSA-N 1 2 300.352 4.038 20 0 DIADLO Cc1[nH+]cc(Nc2cccnc2Oc2ccccc2F)cc1N ZINC001210287244 1050189945 /nfs/dbraw/zinc/18/99/45/1050189945.db2.gz OGPOMOLNJYDOBQ-UHFFFAOYSA-N 1 2 310.332 4.042 20 0 DIADLO Fc1c(Cl)nccc1C[NH+]1CCC(c2ccsc2)CC1 ZINC000824203305 1050190981 /nfs/dbraw/zinc/19/09/81/1050190981.db2.gz SXRNJROQCSPTOS-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(C(F)(F)F)cc2Cl)cc1N ZINC001210287817 1050191095 /nfs/dbraw/zinc/19/10/95/1050191095.db2.gz AZKJWKBGTCPTPB-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Cc1[nH+]cc(Nc2cc3ccccc3nc2C(F)(F)F)cc1N ZINC001210288614 1050191528 /nfs/dbraw/zinc/19/15/28/1050191528.db2.gz LTBMVMZGBVDUTO-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(OC(F)(F)F)c(Cl)c2)cc1N ZINC001210287813 1050191557 /nfs/dbraw/zinc/19/15/57/1050191557.db2.gz ASXOXMDXLVKLTA-UHFFFAOYSA-N 1 2 317.698 4.268 20 0 DIADLO Cc1[nH+]cc(Nc2c(Cl)cccc2C(F)(F)F)cc1N ZINC001210290523 1050191874 /nfs/dbraw/zinc/19/18/74/1050191874.db2.gz MUSFXQJNMBAQKP-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Cc1[nH+]cc(Nc2ccc3c(c2)OC2(CCCCC2)O3)cc1N ZINC001210288631 1050191960 /nfs/dbraw/zinc/19/19/60/1050191960.db2.gz UHMWVPZPTDIOHL-UHFFFAOYSA-N 1 2 311.385 4.147 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(C(F)(F)F)c3ncccc23)cc1N ZINC001210291480 1050192106 /nfs/dbraw/zinc/19/21/06/1050192106.db2.gz MOTCJEYQNQYKME-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(Cl)cc2OC(F)(F)F)cc1N ZINC001210288552 1050192291 /nfs/dbraw/zinc/19/22/91/1050192291.db2.gz SGEJZRYDPIQYDZ-UHFFFAOYSA-N 1 2 317.698 4.268 20 0 DIADLO COc1ccc(-c2cccc(Nc3c[nH+]c(C)c(N)c3)c2)cc1 ZINC001210288198 1050192454 /nfs/dbraw/zinc/19/24/54/1050192454.db2.gz NCTQFIHWSCSMGQ-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO CCCc1noc(C[NH2+]C(C)(C)c2ccc3ccccc3c2)n1 ZINC000626114987 1050194581 /nfs/dbraw/zinc/19/45/81/1050194581.db2.gz BTZJCOJDJQVFQN-UHFFFAOYSA-N 1 2 309.413 4.200 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CCC23CCCC3)cc1Br ZINC001136849813 1050197354 /nfs/dbraw/zinc/19/73/54/1050197354.db2.gz ZCLAQNDWQCBTQP-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CCC23CCCC3)cc1Br ZINC001136849813 1050197358 /nfs/dbraw/zinc/19/73/58/1050197358.db2.gz ZCLAQNDWQCBTQP-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1cc(F)c(C[NH+]2CCCCCC2)cc1Br ZINC001136849784 1050197614 /nfs/dbraw/zinc/19/76/14/1050197614.db2.gz XMEAQXSRUFESSX-UHFFFAOYSA-N 1 2 304.178 4.103 20 0 DIADLO Clc1cccc2[nH]c(C[N@@H+]3CCc4sccc4C3)cc21 ZINC001136857875 1050199030 /nfs/dbraw/zinc/19/90/30/1050199030.db2.gz IAMBRTMXGYCCCD-UHFFFAOYSA-N 1 2 302.830 4.441 20 0 DIADLO Clc1cccc2[nH]c(C[N@H+]3CCc4sccc4C3)cc21 ZINC001136857875 1050199041 /nfs/dbraw/zinc/19/90/41/1050199041.db2.gz IAMBRTMXGYCCCD-UHFFFAOYSA-N 1 2 302.830 4.441 20 0 DIADLO CC(C)(C)/C=C/C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000733927208 1050201361 /nfs/dbraw/zinc/20/13/61/1050201361.db2.gz KDCLMYQUOWRPGU-VOTSOKGWSA-N 1 2 303.793 4.067 20 0 DIADLO CC1(C)CC[C@H]([NH2+]Cc2n[nH]c3ccccc32)c2ccccc21 ZINC000591712999 1050202193 /nfs/dbraw/zinc/20/21/93/1050202193.db2.gz FDCBRVLMXHKKCI-KRWDZBQOSA-N 1 2 305.425 4.465 20 0 DIADLO FC(F)Oc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC001210327892 1050205996 /nfs/dbraw/zinc/20/59/96/1050205996.db2.gz UOCDSQHYIGHMRP-UHFFFAOYSA-N 1 2 301.296 4.217 20 0 DIADLO FC(F)Oc1ccc(Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC001210327996 1050206232 /nfs/dbraw/zinc/20/62/32/1050206232.db2.gz VTMOFEMOGLAIKO-UHFFFAOYSA-N 1 2 301.296 4.217 20 0 DIADLO FC(F)Oc1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)cc1 ZINC001210326633 1050206332 /nfs/dbraw/zinc/20/63/32/1050206332.db2.gz UYSBVXKTGNZGBI-UHFFFAOYSA-N 1 2 309.703 4.333 20 0 DIADLO Cc1cc[nH+]c(Nc2ccc3c(cnn3[C@@H]3CCCCO3)c2)c1 ZINC001210330841 1050207162 /nfs/dbraw/zinc/20/71/62/1050207162.db2.gz ABOXSCDAZQQBQF-SFHVURJKSA-N 1 2 308.385 4.182 20 0 DIADLO CC(C)c1ccc2cc(C(=O)Nc3ccc4[nH+]ccn4c3)[nH]c2c1 ZINC000733966804 1050209569 /nfs/dbraw/zinc/20/95/69/1050209569.db2.gz FZIAZDXXIODACM-UHFFFAOYSA-N 1 2 318.380 4.191 20 0 DIADLO CCN(CC)c1ccc(N[C@H]2CCCNc3ccccc32)c[nH+]1 ZINC000573573910 1050215632 /nfs/dbraw/zinc/21/56/32/1050215632.db2.gz FNQOHPPTLGMLGT-SFHVURJKSA-N 1 2 310.445 4.287 20 0 DIADLO Fc1ccc(C2CC2)cc1C[NH2+]Cc1occc1Br ZINC000824548857 1050223037 /nfs/dbraw/zinc/22/30/37/1050223037.db2.gz NZVDIOVLDUSBNA-UHFFFAOYSA-N 1 2 324.193 4.348 20 0 DIADLO Cc1nonc1C[N@H+](Cc1ccc(Cl)c(Cl)c1)C(C)C ZINC000734147820 1050232162 /nfs/dbraw/zinc/23/21/62/1050232162.db2.gz YRWJCOVRVDSBPU-UHFFFAOYSA-N 1 2 314.216 4.095 20 0 DIADLO Cc1nonc1C[N@@H+](Cc1ccc(Cl)c(Cl)c1)C(C)C ZINC000734147820 1050232176 /nfs/dbraw/zinc/23/21/76/1050232176.db2.gz YRWJCOVRVDSBPU-UHFFFAOYSA-N 1 2 314.216 4.095 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@H](C)c2csc3ccccc23)n1 ZINC000734160643 1050233585 /nfs/dbraw/zinc/23/35/85/1050233585.db2.gz YLYIHHQOPOHVFH-MNOVXSKESA-N 1 2 301.415 4.259 20 0 DIADLO O=C1CC[NH+](Cc2ccc3ccc(-c4ccccc4)nc3c2)CC1 ZINC001136943736 1050244073 /nfs/dbraw/zinc/24/40/73/1050244073.db2.gz RSORMVORJZQOFL-UHFFFAOYSA-N 1 2 316.404 4.067 20 0 DIADLO Cn1cc[nH+]c1-c1ccc(-n2ccc3c2cc(Cl)cc3N)cc1 ZINC001210435799 1050244978 /nfs/dbraw/zinc/24/49/78/1050244978.db2.gz NAPJYMDXLCETSS-UHFFFAOYSA-N 1 2 322.799 4.267 20 0 DIADLO C[C@H]1C(=O)CC[N@H+](Cc2nc3ccccc3s2)C12CCCC2 ZINC001136957553 1050255804 /nfs/dbraw/zinc/25/58/04/1050255804.db2.gz IOULLMOMUAIVIA-ZDUSSCGKSA-N 1 2 314.454 4.020 20 0 DIADLO C[C@H]1C(=O)CC[N@@H+](Cc2nc3ccccc3s2)C12CCCC2 ZINC001136957553 1050255811 /nfs/dbraw/zinc/25/58/11/1050255811.db2.gz IOULLMOMUAIVIA-ZDUSSCGKSA-N 1 2 314.454 4.020 20 0 DIADLO CCc1nc(C[NH2+]Cc2cc(-c3ccccc3)ccc2OC)co1 ZINC000825056629 1050270166 /nfs/dbraw/zinc/27/01/66/1050270166.db2.gz IAYDQOULCFGMEI-UHFFFAOYSA-N 1 2 322.408 4.202 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1ncc(C)s1 ZINC000771655633 1050270918 /nfs/dbraw/zinc/27/09/18/1050270918.db2.gz ZWBIKKQHDILRAF-UHFFFAOYSA-N 1 2 300.431 4.062 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)co1 ZINC000825050496 1050271276 /nfs/dbraw/zinc/27/12/76/1050271276.db2.gz ONZVUUWFUUGQGU-UHFFFAOYSA-N 1 2 318.726 4.199 20 0 DIADLO Fc1ccc(Br)c(C[N@H+]2CCC[C@H](F)CC2)c1F ZINC001143329762 1050282377 /nfs/dbraw/zinc/28/23/77/1050282377.db2.gz VQOAHNIGHSPAHC-VIFPVBQESA-N 1 2 322.168 4.051 20 0 DIADLO Fc1ccc(Br)c(C[N@@H+]2CCC[C@H](F)CC2)c1F ZINC001143329762 1050282391 /nfs/dbraw/zinc/28/23/91/1050282391.db2.gz VQOAHNIGHSPAHC-VIFPVBQESA-N 1 2 322.168 4.051 20 0 DIADLO C[N@H+](Cc1cc(Cl)ccc1Br)C1CC(F)(F)C1 ZINC001137522265 1050282763 /nfs/dbraw/zinc/28/27/63/1050282763.db2.gz KCYNJKQAPRUTEB-UHFFFAOYSA-N 1 2 324.596 4.332 20 0 DIADLO C[N@@H+](Cc1cc(Cl)ccc1Br)C1CC(F)(F)C1 ZINC001137522265 1050282777 /nfs/dbraw/zinc/28/27/77/1050282777.db2.gz KCYNJKQAPRUTEB-UHFFFAOYSA-N 1 2 324.596 4.332 20 0 DIADLO Cc1c[nH+]c(CCSCc2noc3c2CCCC3)c(C)c1 ZINC000592453338 1050305236 /nfs/dbraw/zinc/30/52/36/1050305236.db2.gz ZQSOVVOJKHNQCE-UHFFFAOYSA-N 1 2 302.443 4.041 20 0 DIADLO Cc1ccc2c(Nc3cccnc3OC(F)F)cccc2[nH+]1 ZINC001210628178 1050318168 /nfs/dbraw/zinc/31/81/68/1050318168.db2.gz ZCXRAEKERADWNW-UHFFFAOYSA-N 1 2 301.296 4.283 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2cccnc2)c1Cl ZINC001143365809 1050318394 /nfs/dbraw/zinc/31/83/94/1050318394.db2.gz WNZYPUVWQWDIBZ-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@H]2c2cccnc2)c1Cl ZINC001143365809 1050318402 /nfs/dbraw/zinc/31/84/02/1050318402.db2.gz WNZYPUVWQWDIBZ-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1ccc(NC(=O)N(C)C)cc1 ZINC001210632531 1050320019 /nfs/dbraw/zinc/32/00/19/1050320019.db2.gz IXPJZVUPSXVFRP-UHFFFAOYSA-N 1 2 312.417 4.351 20 0 DIADLO CCCCC[N@H+](Cn1nnc2ccccc2c1=S)C(C)C ZINC000734829344 1050322517 /nfs/dbraw/zinc/32/25/17/1050322517.db2.gz KDDRRAPBTHFSOL-UHFFFAOYSA-N 1 2 304.463 4.019 20 0 DIADLO CCCCC[N@@H+](Cn1nnc2ccccc2c1=S)C(C)C ZINC000734829344 1050322529 /nfs/dbraw/zinc/32/25/29/1050322529.db2.gz KDDRRAPBTHFSOL-UHFFFAOYSA-N 1 2 304.463 4.019 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@](C)(F)C2)cc1C(F)(F)F ZINC001143636480 1050323259 /nfs/dbraw/zinc/32/32/59/1050323259.db2.gz IWGCAVYUPXDNJH-CQSZACIVSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@](C)(F)C2)cc1C(F)(F)F ZINC001143636480 1050323265 /nfs/dbraw/zinc/32/32/65/1050323265.db2.gz IWGCAVYUPXDNJH-CQSZACIVSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@@H](F)C2)cc1C(F)(F)F ZINC001143637082 1050324098 /nfs/dbraw/zinc/32/40/98/1050324098.db2.gz ZBIGUQSDUVLKMQ-GFCCVEGCSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@@H](F)C2)cc1C(F)(F)F ZINC001143637082 1050324116 /nfs/dbraw/zinc/32/41/16/1050324116.db2.gz ZBIGUQSDUVLKMQ-GFCCVEGCSA-N 1 2 305.315 4.038 20 0 DIADLO Cc1ccc2c(Nc3cnc(C(F)(F)F)nc3)cccc2[nH+]1 ZINC001210672058 1050334421 /nfs/dbraw/zinc/33/44/21/1050334421.db2.gz XFJYDGLHGZQANI-UHFFFAOYSA-N 1 2 304.275 4.096 20 0 DIADLO C[N@H+](Cc1c(Cl)cc(Cl)cc1Cl)[C@H]1CCCOC1 ZINC001143799830 1050363885 /nfs/dbraw/zinc/36/38/85/1050363885.db2.gz AGXCOINSMMFYHI-JTQLQIEISA-N 1 2 308.636 4.258 20 0 DIADLO C[N@@H+](Cc1c(Cl)cc(Cl)cc1Cl)[C@H]1CCCOC1 ZINC001143799830 1050363899 /nfs/dbraw/zinc/36/38/99/1050363899.db2.gz AGXCOINSMMFYHI-JTQLQIEISA-N 1 2 308.636 4.258 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1ccn(C(C)C)n1 ZINC000735077409 1050345203 /nfs/dbraw/zinc/34/52/03/1050345203.db2.gz WZFSRCDQBWAOLY-UHFFFAOYSA-N 1 2 311.433 4.074 20 0 DIADLO CCOc1c(F)cc(C[NH+]2CCC(F)(F)CC2)cc1Cl ZINC001143734670 1050345324 /nfs/dbraw/zinc/34/53/24/1050345324.db2.gz WOUNLIMLJXRZHW-UHFFFAOYSA-N 1 2 307.743 4.109 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2C[C@@H](C)C[C@H]2CF)cc1Cl ZINC001143734596 1050345413 /nfs/dbraw/zinc/34/54/13/1050345413.db2.gz TWCBKTNZDKIJGN-JQWIXIFHSA-N 1 2 303.780 4.058 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2C[C@@H](C)C[C@H]2CF)cc1Cl ZINC001143734596 1050345421 /nfs/dbraw/zinc/34/54/21/1050345421.db2.gz TWCBKTNZDKIJGN-JQWIXIFHSA-N 1 2 303.780 4.058 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccccc3-n3cccn3)ccc12 ZINC001210734527 1050355703 /nfs/dbraw/zinc/35/57/03/1050355703.db2.gz ZDNCOIACZTUBNA-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO Fc1cc(OC(F)(F)F)ccc1C[N@H+]1CCCC[C@H](F)C1 ZINC001143780629 1050357147 /nfs/dbraw/zinc/35/71/47/1050357147.db2.gz BLNRMUPOANUVCR-NSHDSACASA-N 1 2 309.278 4.048 20 0 DIADLO Fc1cc(OC(F)(F)F)ccc1C[N@@H+]1CCCC[C@H](F)C1 ZINC001143780629 1050357158 /nfs/dbraw/zinc/35/71/58/1050357158.db2.gz BLNRMUPOANUVCR-NSHDSACASA-N 1 2 309.278 4.048 20 0 DIADLO C[C@@]1(F)CCC[N@H+](Cc2ccc(OC(F)(F)F)cc2F)C1 ZINC001143781277 1050359185 /nfs/dbraw/zinc/35/91/85/1050359185.db2.gz NHQPPGDCWWFWJE-CYBMUJFWSA-N 1 2 309.278 4.048 20 0 DIADLO C[C@@]1(F)CCC[N@@H+](Cc2ccc(OC(F)(F)F)cc2F)C1 ZINC001143781277 1050359192 /nfs/dbraw/zinc/35/91/92/1050359192.db2.gz NHQPPGDCWWFWJE-CYBMUJFWSA-N 1 2 309.278 4.048 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(Cl)cc(Cl)cc2Cl)CC[C@]1(C)O ZINC001143797048 1050361215 /nfs/dbraw/zinc/36/12/15/1050361215.db2.gz DFVCGZOAXBVACD-XPTSAGLGSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c(Cl)cc(Cl)cc2Cl)CC[C@]1(C)O ZINC001143797048 1050361223 /nfs/dbraw/zinc/36/12/23/1050361223.db2.gz DFVCGZOAXBVACD-XPTSAGLGSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(Cl)cc(Cl)cc2Cl)CC[C@@]1(C)O ZINC001143797046 1050361326 /nfs/dbraw/zinc/36/13/26/1050361326.db2.gz DFVCGZOAXBVACD-LKFCYVNXSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c(Cl)cc(Cl)cc2Cl)CC[C@@]1(C)O ZINC001143797046 1050361341 /nfs/dbraw/zinc/36/13/41/1050361341.db2.gz DFVCGZOAXBVACD-LKFCYVNXSA-N 1 2 322.663 4.240 20 0 DIADLO CCOc1c(Cl)ccc(C[N@H+](C)Cc2cccc(O)c2)c1F ZINC001143824680 1050368153 /nfs/dbraw/zinc/36/81/53/1050368153.db2.gz MUMGNCXBZAYSFD-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO CCOc1c(Cl)ccc(C[N@@H+](C)Cc2cccc(O)c2)c1F ZINC001143824680 1050368170 /nfs/dbraw/zinc/36/81/70/1050368170.db2.gz MUMGNCXBZAYSFD-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CC3CCC2CC3)c1Br ZINC001143819578 1050368852 /nfs/dbraw/zinc/36/88/52/1050368852.db2.gz FAPBWFFHIFBRMM-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CC3CCC2CC3)c1Br ZINC001143819578 1050368867 /nfs/dbraw/zinc/36/88/67/1050368867.db2.gz FAPBWFFHIFBRMM-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO COc1cc(Nc2nc(C(F)(F)F)ccc2Cl)cc(C)[nH+]1 ZINC001210780468 1050369498 /nfs/dbraw/zinc/36/94/98/1050369498.db2.gz UFFUOSUPRZMQBV-UHFFFAOYSA-N 1 2 317.698 4.209 20 0 DIADLO Brc1ccoc1C[NH2+][C@H]1CSCc2ccccc21 ZINC000735324186 1050370079 /nfs/dbraw/zinc/37/00/79/1050370079.db2.gz GSHZUGDWKIJDTG-ZDUSSCGKSA-N 1 2 324.243 4.120 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1occc1Br)C(C)C ZINC000735321586 1050371793 /nfs/dbraw/zinc/37/17/93/1050371793.db2.gz XJWKRFUYAUSBTB-CQSZACIVSA-N 1 2 323.234 4.232 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+][C@@H]1CCc2c1nccc2Cl ZINC000924859324 1050372048 /nfs/dbraw/zinc/37/20/48/1050372048.db2.gz UPZQSENAFRYKRE-CQSZACIVSA-N 1 2 311.187 4.305 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCC[C@@H]2c2cccnc2)cc1Cl ZINC001143839645 1050375718 /nfs/dbraw/zinc/37/57/18/1050375718.db2.gz OCNKDCXBWFKTJV-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCC[C@@H]2c2cccnc2)cc1Cl ZINC001143839645 1050375731 /nfs/dbraw/zinc/37/57/31/1050375731.db2.gz OCNKDCXBWFKTJV-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)(C)C[C@@H]1CN(C[N@@H+]2CCC[C@@H]2c2ccsc2)C(=O)O1 ZINC000785498797 1050383031 /nfs/dbraw/zinc/38/30/31/1050383031.db2.gz IKCLLIYILBKEMG-HUUCEWRRSA-N 1 2 322.474 4.100 20 0 DIADLO CC(C)(C)C[C@@H]1CN(C[N@H+]2CCC[C@@H]2c2ccsc2)C(=O)O1 ZINC000785498797 1050383041 /nfs/dbraw/zinc/38/30/41/1050383041.db2.gz IKCLLIYILBKEMG-HUUCEWRRSA-N 1 2 322.474 4.100 20 0 DIADLO COC[C@H]1CCCC[N@@H+]1Cc1c(F)ccc(Cl)c1Cl ZINC001143854640 1050385447 /nfs/dbraw/zinc/38/54/47/1050385447.db2.gz BNIDUQPVACLFDY-SNVBAGLBSA-N 1 2 306.208 4.133 20 0 DIADLO COC[C@H]1CCCC[N@H+]1Cc1c(F)ccc(Cl)c1Cl ZINC001143854640 1050385452 /nfs/dbraw/zinc/38/54/52/1050385452.db2.gz BNIDUQPVACLFDY-SNVBAGLBSA-N 1 2 306.208 4.133 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+]Cc1sccc1Cl)CCC2 ZINC000785515515 1050385792 /nfs/dbraw/zinc/38/57/92/1050385792.db2.gz ZITZJUHUWGRBPT-ZDUSSCGKSA-N 1 2 309.866 4.346 20 0 DIADLO CCCC(=CC(=O)Nc1nc(C[NH+](CC)CC)cs1)CCC ZINC001143857952 1050386574 /nfs/dbraw/zinc/38/65/74/1050386574.db2.gz TZDDTDYKKAJTPR-UHFFFAOYSA-N 1 2 323.506 4.450 20 0 DIADLO COc1ccc(C[NH+]2Cc3ccccc3C2)cc1OC(F)(F)F ZINC001143868681 1050388440 /nfs/dbraw/zinc/38/84/40/1050388440.db2.gz ZGOZJAHTQLNISH-UHFFFAOYSA-N 1 2 323.314 4.110 20 0 DIADLO CC[C@]1(C)Oc2ccc(NCc3c[nH+]c4c(C)cccn34)cc2O1 ZINC000785554214 1050389424 /nfs/dbraw/zinc/38/94/24/1050389424.db2.gz LNMQPWXXJCCJDX-LJQANCHMSA-N 1 2 323.396 4.152 20 0 DIADLO c1c[nH+]c(N2CCCCC2)c(Nc2cccc(OC3CC3)c2)c1 ZINC001210859082 1050392268 /nfs/dbraw/zinc/39/22/68/1050392268.db2.gz NADANKOIOMLAMZ-UHFFFAOYSA-N 1 2 309.413 4.357 20 0 DIADLO FC[C@@H]1CC[N@@H+]([C@H]2CCc3cc(Cl)ccc3C2)CC1(F)F ZINC001171116329 1050397031 /nfs/dbraw/zinc/39/70/31/1050397031.db2.gz NKLUGZMYZIKXSG-ZFWWWQNUSA-N 1 2 317.782 4.124 20 0 DIADLO FC[C@@H]1CC[N@H+]([C@H]2CCc3cc(Cl)ccc3C2)CC1(F)F ZINC001171116329 1050397046 /nfs/dbraw/zinc/39/70/46/1050397046.db2.gz NKLUGZMYZIKXSG-ZFWWWQNUSA-N 1 2 317.782 4.124 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c(F)c1F ZINC001143904292 1050399735 /nfs/dbraw/zinc/39/97/35/1050399735.db2.gz NZUPJVUQUHBQNR-OAHLLOKOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c(F)c1F ZINC001143904292 1050399740 /nfs/dbraw/zinc/39/97/40/1050399740.db2.gz NZUPJVUQUHBQNR-OAHLLOKOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c(F)c1F ZINC001143911256 1050403553 /nfs/dbraw/zinc/40/35/53/1050403553.db2.gz XJPGSPBQQYDPPK-HNNXBMFYSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c(F)c1F ZINC001143911256 1050403562 /nfs/dbraw/zinc/40/35/62/1050403562.db2.gz XJPGSPBQQYDPPK-HNNXBMFYSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(C)nc2)c(F)c1F ZINC001143916650 1050406657 /nfs/dbraw/zinc/40/66/57/1050406657.db2.gz QXXSSOUUCYTLML-OAHLLOKOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(C)nc2)c(F)c1F ZINC001143916650 1050406664 /nfs/dbraw/zinc/40/66/64/1050406664.db2.gz QXXSSOUUCYTLML-OAHLLOKOSA-N 1 2 318.367 4.014 20 0 DIADLO CCOc1ccc(F)c(C[N@H+](C)[C@H]2CCc3ccccc32)c1F ZINC001143945909 1050413116 /nfs/dbraw/zinc/41/31/16/1050413116.db2.gz LCZGYBUKJMWGBB-KRWDZBQOSA-N 1 2 317.379 4.483 20 0 DIADLO CCOc1ccc(F)c(C[N@@H+](C)[C@H]2CCc3ccccc32)c1F ZINC001143945909 1050413120 /nfs/dbraw/zinc/41/31/20/1050413120.db2.gz LCZGYBUKJMWGBB-KRWDZBQOSA-N 1 2 317.379 4.483 20 0 DIADLO CCCCC[C@H](NC(=O)C[C@H](C)n1cc[nH+]c1)c1ccccc1 ZINC000844376949 1050414753 /nfs/dbraw/zinc/41/47/53/1050414753.db2.gz URBFSPMJABGWOO-WMZOPIPTSA-N 1 2 313.445 4.272 20 0 DIADLO Cc1cc(NC(=O)CCC2CCCCC2)ccc1-n1cc[nH+]c1 ZINC001143933724 1050415127 /nfs/dbraw/zinc/41/51/27/1050415127.db2.gz MZYZYWVQRLQMMF-UHFFFAOYSA-N 1 2 311.429 4.480 20 0 DIADLO CCCCC[C@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)c1ccccc1 ZINC000844376944 1050415481 /nfs/dbraw/zinc/41/54/81/1050415481.db2.gz URBFSPMJABGWOO-AEFFLSMTSA-N 1 2 313.445 4.272 20 0 DIADLO CC[N@H+](Cc1ccc(C)cc1)Cc1c(F)ccc(OC)c1F ZINC001143982825 1050419351 /nfs/dbraw/zinc/41/93/51/1050419351.db2.gz AWBPNDAOMDQBRA-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CC[N@@H+](Cc1ccc(C)cc1)Cc1c(F)ccc(OC)c1F ZINC001143982825 1050419357 /nfs/dbraw/zinc/41/93/57/1050419357.db2.gz AWBPNDAOMDQBRA-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO O=C1CCCc2ccc(Nc3cc(Cl)c4[nH+]ccn4c3)cc21 ZINC001210932960 1050422187 /nfs/dbraw/zinc/42/21/87/1050422187.db2.gz PGFFZHKBLMFDPL-UHFFFAOYSA-N 1 2 311.772 4.250 20 0 DIADLO O=C1CCCc2ccc(Nc3ccc(Cn4cc[nH+]c4)cc3)cc21 ZINC001210934324 1050423959 /nfs/dbraw/zinc/42/39/59/1050423959.db2.gz MOAHSPMYUIGGFT-UHFFFAOYSA-N 1 2 317.392 4.194 20 0 DIADLO CC(C)c1ccc([C@@H](C)OC(=O)C[C@H](C)n2cc[nH+]c2)cc1 ZINC000844471761 1050434958 /nfs/dbraw/zinc/43/49/58/1050434958.db2.gz FSOGIHJLLGIMJB-LSDHHAIUSA-N 1 2 300.402 4.262 20 0 DIADLO Nc1cc2c(ccn2-c2ccccc2[NH+]2CCCCC2)c(F)c1 ZINC001210964613 1050436652 /nfs/dbraw/zinc/43/66/52/1050436652.db2.gz YASSANDQHQEPOI-UHFFFAOYSA-N 1 2 309.388 4.342 20 0 DIADLO CCc1ccc(N(CC(C)C)C(=O)C[C@H](C)n2cc[nH+]c2)cc1 ZINC000844509306 1050437774 /nfs/dbraw/zinc/43/77/74/1050437774.db2.gz KMFRSVXXPRBJFI-INIZCTEOSA-N 1 2 313.445 4.086 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2CC[C@@H]2c2ccccc2)cc1F ZINC001144030538 1050438070 /nfs/dbraw/zinc/43/80/70/1050438070.db2.gz CQHNFMVOJQZJTP-QGZVFWFLSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2CC[C@@H]2c2ccccc2)cc1F ZINC001144030538 1050438076 /nfs/dbraw/zinc/43/80/76/1050438076.db2.gz CQHNFMVOJQZJTP-QGZVFWFLSA-N 1 2 303.352 4.311 20 0 DIADLO Cc1ccc(Nc2ccc(N3CCC(F)(F)CC3)cc2)[nH+]c1 ZINC001211012768 1050444444 /nfs/dbraw/zinc/44/44/44/1050444444.db2.gz OLITWXHPCAHQIN-UHFFFAOYSA-N 1 2 303.356 4.369 20 0 DIADLO CC(C)[C@@H]1C[C@@H](OC(=O)C[C@H](C)n2cc[nH+]c2)c2ccccc21 ZINC000844506734 1050444689 /nfs/dbraw/zinc/44/46/89/1050444689.db2.gz MAZQEAJOVRZYQM-JCGIZDLHSA-N 1 2 312.413 4.262 20 0 DIADLO Cc1ccc(Nc2cccc(CNC(=O)OC(C)(C)C)c2)[nH+]c1 ZINC001211012031 1050445049 /nfs/dbraw/zinc/44/50/49/1050445049.db2.gz QFEGLZMMMDZFLD-UHFFFAOYSA-N 1 2 313.401 4.158 20 0 DIADLO CN(c1ccc(Nc2ccnc(F)c2)c[nH+]1)C1CCCCC1 ZINC001212613275 1050451516 /nfs/dbraw/zinc/45/15/16/1050451516.db2.gz LXPICFXYWYKJDF-UHFFFAOYSA-N 1 2 300.381 4.128 20 0 DIADLO CCOc1ccc(F)c(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001211052031 1050459273 /nfs/dbraw/zinc/45/92/73/1050459273.db2.gz INGNDJAUYQACQO-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO Fc1cc(F)c(C[NH+]2CCC(OC3CCC3)CC2)cc1Cl ZINC001144125013 1050475390 /nfs/dbraw/zinc/47/53/90/1050475390.db2.gz AMOJGURWBSIXMJ-UHFFFAOYSA-N 1 2 315.791 4.152 20 0 DIADLO Cc1noc(C)c1Nc1ccc(N(C)C2CCCCC2)[nH+]c1 ZINC001212613363 1050479810 /nfs/dbraw/zinc/47/98/10/1050479810.db2.gz QELMMCKSGROUBT-UHFFFAOYSA-N 1 2 300.406 4.199 20 0 DIADLO Fc1cc(F)cc(Oc2ccc(C[NH2+]Cc3cocn3)cc2)c1 ZINC000594062687 1050481527 /nfs/dbraw/zinc/48/15/27/1050481527.db2.gz QSCUQOAQBMNILX-UHFFFAOYSA-N 1 2 316.307 4.035 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CC[C@H](C(F)(F)F)C3)cs2)o1 ZINC000761049245 1050484584 /nfs/dbraw/zinc/48/45/84/1050484584.db2.gz OTCVXTLWPZAUSB-JTQLQIEISA-N 1 2 316.348 4.096 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CC[C@H](C(F)(F)F)C3)cs2)o1 ZINC000761049245 1050484594 /nfs/dbraw/zinc/48/45/94/1050484594.db2.gz OTCVXTLWPZAUSB-JTQLQIEISA-N 1 2 316.348 4.096 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CC[C@@H](C(F)(F)F)C3)cs2)o1 ZINC000761049246 1050485584 /nfs/dbraw/zinc/48/55/84/1050485584.db2.gz OTCVXTLWPZAUSB-SNVBAGLBSA-N 1 2 316.348 4.096 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CC[C@@H](C(F)(F)F)C3)cs2)o1 ZINC000761049246 1050485591 /nfs/dbraw/zinc/48/55/91/1050485591.db2.gz OTCVXTLWPZAUSB-SNVBAGLBSA-N 1 2 316.348 4.096 20 0 DIADLO COCc1cc[nH+]c(NCc2ccc(SC(F)F)cc2)c1 ZINC000844709526 1050487576 /nfs/dbraw/zinc/48/75/76/1050487576.db2.gz RYMKFUZZWBKKTC-UHFFFAOYSA-N 1 2 310.369 4.155 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+]3CC[C@H](C(F)(F)F)C3)o2)cc1 ZINC000761049616 1050488370 /nfs/dbraw/zinc/48/83/70/1050488370.db2.gz IIUCEINTFUKTOJ-ZDUSSCGKSA-N 1 2 310.319 4.034 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+]3CC[C@H](C(F)(F)F)C3)o2)cc1 ZINC000761049616 1050488377 /nfs/dbraw/zinc/48/83/77/1050488377.db2.gz IIUCEINTFUKTOJ-ZDUSSCGKSA-N 1 2 310.319 4.034 20 0 DIADLO CCCc1cc[nH+]c(Nc2cc(O)cc(OC(F)(F)F)c2)c1 ZINC001211124595 1050488586 /nfs/dbraw/zinc/48/85/86/1050488586.db2.gz RBILUQQRUNAUKT-UHFFFAOYSA-N 1 2 312.291 4.382 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC[C@H]1c1cc(C)on1 ZINC000786764141 1050516197 /nfs/dbraw/zinc/51/61/97/1050516197.db2.gz RBAWHXVRXTWBRT-INIZCTEOSA-N 1 2 323.396 4.190 20 0 DIADLO CCn1c(=S)n(C[N@H+](C)CC(C)(C)C)nc1-c1cccs1 ZINC000738091201 1050521317 /nfs/dbraw/zinc/52/13/17/1050521317.db2.gz XGNUJCMIWFIQII-UHFFFAOYSA-N 1 2 324.519 4.098 20 0 DIADLO CCn1c(=S)n(C[N@@H+](C)CC(C)(C)C)nc1-c1cccs1 ZINC000738091201 1050521335 /nfs/dbraw/zinc/52/13/35/1050521335.db2.gz XGNUJCMIWFIQII-UHFFFAOYSA-N 1 2 324.519 4.098 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccccc3NC(C)(C)C)n2c1 ZINC000798499738 1050522432 /nfs/dbraw/zinc/52/24/32/1050522432.db2.gz HMMHEWUXUYJLEM-UHFFFAOYSA-N 1 2 308.429 4.465 20 0 DIADLO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cn1nnc2ccccc2c1=S ZINC000738060052 1050523054 /nfs/dbraw/zinc/52/30/54/1050523054.db2.gz ZUHDBUWKBAAYFE-XJKSGUPXSA-N 1 2 316.474 4.019 20 0 DIADLO CC[C@H](C)[C@H]1CCCC[N@H+]1Cn1nnc2ccccc2c1=S ZINC000738060052 1050523059 /nfs/dbraw/zinc/52/30/59/1050523059.db2.gz ZUHDBUWKBAAYFE-XJKSGUPXSA-N 1 2 316.474 4.019 20 0 DIADLO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cn1nnc2ccccc2c1=S ZINC000738060048 1050523324 /nfs/dbraw/zinc/52/33/24/1050523324.db2.gz ZUHDBUWKBAAYFE-CZUORRHYSA-N 1 2 316.474 4.019 20 0 DIADLO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cn1nnc2ccccc2c1=S ZINC000738060048 1050523334 /nfs/dbraw/zinc/52/33/34/1050523334.db2.gz ZUHDBUWKBAAYFE-CZUORRHYSA-N 1 2 316.474 4.019 20 0 DIADLO C[C@@H](c1ccc2ccccc2c1)[N@H+](Cn1ccsc1=O)C1CC1 ZINC000746612158 1050524036 /nfs/dbraw/zinc/52/40/36/1050524036.db2.gz RFGWETPDVKGBEG-AWEZNQCLSA-N 1 2 324.449 4.246 20 0 DIADLO C[C@@H](c1ccc2ccccc2c1)[N@@H+](Cn1ccsc1=O)C1CC1 ZINC000746612158 1050524049 /nfs/dbraw/zinc/52/40/49/1050524049.db2.gz RFGWETPDVKGBEG-AWEZNQCLSA-N 1 2 324.449 4.246 20 0 DIADLO Cc1ccc([C@H]2[C@H](C)CCC[N@@H+]2Cn2ncsc2=S)cc1 ZINC000738284975 1050527444 /nfs/dbraw/zinc/52/74/44/1050527444.db2.gz NSEXNUKFCAHLDR-UKRRQHHQSA-N 1 2 319.499 4.413 20 0 DIADLO Cc1ccc([C@H]2[C@H](C)CCC[N@H+]2Cn2ncsc2=S)cc1 ZINC000738284975 1050527459 /nfs/dbraw/zinc/52/74/59/1050527459.db2.gz NSEXNUKFCAHLDR-UKRRQHHQSA-N 1 2 319.499 4.413 20 0 DIADLO CCSc1nn(C[N@@H+]2CCCCC[C@@H]2C)c(=S)s1 ZINC000738226665 1050527953 /nfs/dbraw/zinc/52/79/53/1050527953.db2.gz YRKAZJHUAAPNIZ-JTQLQIEISA-N 1 2 303.522 4.008 20 0 DIADLO CCSc1nn(C[N@H+]2CCCCC[C@@H]2C)c(=S)s1 ZINC000738226665 1050527967 /nfs/dbraw/zinc/52/79/67/1050527967.db2.gz YRKAZJHUAAPNIZ-JTQLQIEISA-N 1 2 303.522 4.008 20 0 DIADLO Cc1ccc([C@@H]2[C@@H](C)CCC[N@@H+]2Cc2ncc(Cl)n2C)cc1 ZINC000738340206 1050531878 /nfs/dbraw/zinc/53/18/78/1050531878.db2.gz KYURLZIVWMDMDX-KSSFIOAISA-N 1 2 317.864 4.355 20 0 DIADLO Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2Cc2ncc(Cl)n2C)cc1 ZINC000738340206 1050531894 /nfs/dbraw/zinc/53/18/94/1050531894.db2.gz KYURLZIVWMDMDX-KSSFIOAISA-N 1 2 317.864 4.355 20 0 DIADLO CCc1cccc(C[N@@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c1 ZINC001144326738 1050544205 /nfs/dbraw/zinc/54/42/05/1050544205.db2.gz QGYZJSXVQOUWDA-IBGZPJMESA-N 1 2 317.379 4.101 20 0 DIADLO CCc1cccc(C[N@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c1 ZINC001144326738 1050544218 /nfs/dbraw/zinc/54/42/18/1050544218.db2.gz QGYZJSXVQOUWDA-IBGZPJMESA-N 1 2 317.379 4.101 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1ccc(O)cc1C(F)(F)F)C2 ZINC001144381197 1050554791 /nfs/dbraw/zinc/55/47/91/1050554791.db2.gz MRMCUPZONKNMRN-UHFFFAOYSA-N 1 2 307.315 4.235 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1ccc(O)cc1C(F)(F)F)C2 ZINC001144381197 1050554803 /nfs/dbraw/zinc/55/48/03/1050554803.db2.gz MRMCUPZONKNMRN-UHFFFAOYSA-N 1 2 307.315 4.235 20 0 DIADLO Cc1cc(C)c([C@H](C)OC(=O)C[C@@H](C)n2cc[nH+]c2)c(C)c1 ZINC000845283356 1050558995 /nfs/dbraw/zinc/55/89/95/1050558995.db2.gz VULZVKFBXGIQLX-CVEARBPZSA-N 1 2 300.402 4.064 20 0 DIADLO C[C@H](CC(=O)O[C@H](C)c1ccc2ccccc2c1)n1cc[nH+]c1 ZINC000845281523 1050559185 /nfs/dbraw/zinc/55/91/85/1050559185.db2.gz KUXKZFOMTNKMFL-HUUCEWRRSA-N 1 2 308.381 4.292 20 0 DIADLO C[C@H](SCCn1cc[nH+]c1)c1cccc(C(F)(F)F)c1 ZINC000594909080 1050559673 /nfs/dbraw/zinc/55/96/73/1050559673.db2.gz AGNUWKWEZAEMOH-NSHDSACASA-N 1 2 300.349 4.396 20 0 DIADLO CCCCOC(=O)C[N@H+](C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000746653364 1050560552 /nfs/dbraw/zinc/56/05/52/1050560552.db2.gz TXBZYQFVDMLMMH-LBPRGKRZSA-N 1 2 317.351 4.042 20 0 DIADLO CCCCOC(=O)C[N@@H+](C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000746653364 1050560568 /nfs/dbraw/zinc/56/05/68/1050560568.db2.gz TXBZYQFVDMLMMH-LBPRGKRZSA-N 1 2 317.351 4.042 20 0 DIADLO CC[N@H+](C/C=C\Cl)Cc1cc(Br)ccc1F ZINC000746652412 1050560612 /nfs/dbraw/zinc/56/06/12/1050560612.db2.gz MGMBOZWWDYBELI-UTCJRWHESA-N 1 2 306.606 4.163 20 0 DIADLO CC[N@@H+](C/C=C\Cl)Cc1cc(Br)ccc1F ZINC000746652412 1050560628 /nfs/dbraw/zinc/56/06/28/1050560628.db2.gz MGMBOZWWDYBELI-UTCJRWHESA-N 1 2 306.606 4.163 20 0 DIADLO Fc1ccc(Br)cc1C[N@H+](C/C=C/Cl)C1CC1 ZINC000746651211 1050567100 /nfs/dbraw/zinc/56/71/00/1050567100.db2.gz PWUQZGYLRQLZRT-LZCJLJQNSA-N 1 2 318.617 4.305 20 0 DIADLO Fc1ccc(Br)cc1C[N@@H+](C/C=C/Cl)C1CC1 ZINC000746651211 1050567110 /nfs/dbraw/zinc/56/71/10/1050567110.db2.gz PWUQZGYLRQLZRT-LZCJLJQNSA-N 1 2 318.617 4.305 20 0 DIADLO CC(C)(C)c1ccc(-c2noc([C@](C)([NH3+])c3ccccc3)n2)cc1 ZINC001211442682 1050569000 /nfs/dbraw/zinc/56/90/00/1050569000.db2.gz MNJPJMXRRATWOZ-HXUWFJFHSA-N 1 2 321.424 4.256 20 0 DIADLO C[C@]([NH3+])(c1nc(-c2ccc3sccc3c2)no1)c1ccccc1 ZINC001211442729 1050569073 /nfs/dbraw/zinc/56/90/73/1050569073.db2.gz OWGRJRCPYHLXCC-GOSISDBHSA-N 1 2 321.405 4.174 20 0 DIADLO Cc1nc(F)ccc1C[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000787270978 1050583808 /nfs/dbraw/zinc/58/38/08/1050583808.db2.gz LCTZYGGUWSGRFG-UHFFFAOYSA-N 1 2 316.807 4.472 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000787270978 1050583827 /nfs/dbraw/zinc/58/38/27/1050583827.db2.gz LCTZYGGUWSGRFG-UHFFFAOYSA-N 1 2 316.807 4.472 20 0 DIADLO O=c1[nH]cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c2ccccc12 ZINC001213086611 1050584540 /nfs/dbraw/zinc/58/45/40/1050584540.db2.gz UBINFOJVMLFTFJ-UHFFFAOYSA-N 1 2 302.337 4.074 20 0 DIADLO CN(c1ccc(Nc2cc(N)ccc2F)c[nH+]1)C1CCCCC1 ZINC001212614344 1050584495 /nfs/dbraw/zinc/58/44/95/1050584495.db2.gz LOKWZAJZKXBXIZ-UHFFFAOYSA-N 1 2 314.408 4.315 20 0 DIADLO C[C@@H]1c2ccccc2C[N@H+]1CC(=O)Nc1ccc2ccccc2c1 ZINC000746672800 1050585559 /nfs/dbraw/zinc/58/55/59/1050585559.db2.gz UPJBZXMLUNKWSM-OAHLLOKOSA-N 1 2 316.404 4.355 20 0 DIADLO C[C@@H]1c2ccccc2C[N@@H+]1CC(=O)Nc1ccc2ccccc2c1 ZINC000746672800 1050585570 /nfs/dbraw/zinc/58/55/70/1050585570.db2.gz UPJBZXMLUNKWSM-OAHLLOKOSA-N 1 2 316.404 4.355 20 0 DIADLO CC(C)OC(=O)c1cccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213089713 1050586136 /nfs/dbraw/zinc/58/61/36/1050586136.db2.gz AECGZSMMGGIVJG-UHFFFAOYSA-N 1 2 321.380 4.386 20 0 DIADLO COc1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc(F)c1F ZINC001213092076 1050586225 /nfs/dbraw/zinc/58/62/25/1050586225.db2.gz ZYJKYYWWBSBFPX-UHFFFAOYSA-N 1 2 301.296 4.107 20 0 DIADLO Nc1cccc(C(F)(F)F)c1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213090702 1050586711 /nfs/dbraw/zinc/58/67/11/1050586711.db2.gz BWCOSSPZVHOIBF-UHFFFAOYSA-N 1 2 318.302 4.421 20 0 DIADLO Cc1cc2nsnc2cc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213090870 1050587136 /nfs/dbraw/zinc/58/71/36/1050587136.db2.gz KLTGJBSHSGCPHH-UHFFFAOYSA-N 1 2 307.382 4.133 20 0 DIADLO COc1ncc(C[N@@H+]2CCCC[C@H]2c2ccccc2F)cc1F ZINC001144463443 1050590833 /nfs/dbraw/zinc/59/08/33/1050590833.db2.gz QKTOBWIPMJXYJY-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1ncc(C[N@H+]2CCCC[C@H]2c2ccccc2F)cc1F ZINC001144463443 1050590845 /nfs/dbraw/zinc/59/08/45/1050590845.db2.gz QKTOBWIPMJXYJY-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CN(c1ccc(Nc2ccccc2CO)c[nH+]1)C1CCCCC1 ZINC001212614788 1050598888 /nfs/dbraw/zinc/59/88/88/1050598888.db2.gz VSAFVUUDWBQCIV-UHFFFAOYSA-N 1 2 311.429 4.086 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCCC[C@H]2c2ccccc2)c(F)c1 ZINC001144542396 1050610409 /nfs/dbraw/zinc/61/04/09/1050610409.db2.gz WAJFBOQRUGWUQE-SFHVURJKSA-N 1 2 303.352 4.398 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCCC[C@H]2c2ccccc2)c(F)c1 ZINC001144542396 1050610415 /nfs/dbraw/zinc/61/04/15/1050610415.db2.gz WAJFBOQRUGWUQE-SFHVURJKSA-N 1 2 303.352 4.398 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c(F)cc(O)cc1F ZINC001144555131 1050614751 /nfs/dbraw/zinc/61/47/51/1050614751.db2.gz WQGRLMNXVYEXOF-KRWDZBQOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1c(F)cc(O)cc1F ZINC001144555131 1050614758 /nfs/dbraw/zinc/61/47/58/1050614758.db2.gz WQGRLMNXVYEXOF-KRWDZBQOSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC(C)(CC(C)C)CC2)c(C)[nH+]1 ZINC001160652302 1050624046 /nfs/dbraw/zinc/62/40/46/1050624046.db2.gz SMDYKVLIOVNAHM-UHFFFAOYSA-N 1 2 302.462 4.295 20 0 DIADLO FC(F)COc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC001213305349 1050625307 /nfs/dbraw/zinc/62/53/07/1050625307.db2.gz YASHTNFQBSXIAA-UHFFFAOYSA-N 1 2 319.355 4.069 20 0 DIADLO Clc1cccc([C@@H]2CCC[N@@H+]2Cc2ncn3ccccc23)c1 ZINC001144626224 1050629808 /nfs/dbraw/zinc/62/98/08/1050629808.db2.gz ZYZBDBMZSCALPA-KRWDZBQOSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1cccc([C@@H]2CCC[N@H+]2Cc2ncn3ccccc23)c1 ZINC001144626224 1050629817 /nfs/dbraw/zinc/62/98/17/1050629817.db2.gz ZYZBDBMZSCALPA-KRWDZBQOSA-N 1 2 311.816 4.325 20 0 DIADLO Fc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1ncn2ccccc12 ZINC001144623527 1050632093 /nfs/dbraw/zinc/63/20/93/1050632093.db2.gz YGPPFGKNWRGIPE-SFHVURJKSA-N 1 2 309.388 4.201 20 0 DIADLO Fc1ccccc1[C@@H]1CCCC[N@H+]1Cc1ncn2ccccc12 ZINC001144623527 1050632099 /nfs/dbraw/zinc/63/20/99/1050632099.db2.gz YGPPFGKNWRGIPE-SFHVURJKSA-N 1 2 309.388 4.201 20 0 DIADLO Oc1cc(F)c(C[NH+]2CCC(c3cccs3)CC2)cc1F ZINC001144666170 1050646031 /nfs/dbraw/zinc/64/60/31/1050646031.db2.gz HYVIUOCFMCHHIK-UHFFFAOYSA-N 1 2 309.381 4.112 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccccc2F)cc1F ZINC001144666114 1050646060 /nfs/dbraw/zinc/64/60/60/1050646060.db2.gz GTBNLFXKEXECHX-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCC[C@H]2c2ccccc2F)cc1F ZINC001144666114 1050646065 /nfs/dbraw/zinc/64/60/65/1050646065.db2.gz GTBNLFXKEXECHX-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO C[C@H]([NH2+]Cc1noc2c1CCCC2)c1cccc(OC(F)F)c1 ZINC000179588367 1050648099 /nfs/dbraw/zinc/64/80/99/1050648099.db2.gz CVDUBSZIVNKICP-NSHDSACASA-N 1 2 322.355 4.006 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)cc1F ZINC001144658202 1050648929 /nfs/dbraw/zinc/64/89/29/1050648929.db2.gz UIFBNWJREKBMDA-NSHDSACASA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@H](c3ccccc3Cl)C2)cc1F ZINC001144658202 1050648935 /nfs/dbraw/zinc/64/89/35/1050648935.db2.gz UIFBNWJREKBMDA-NSHDSACASA-N 1 2 323.770 4.313 20 0 DIADLO CC(C)(C)c1ccccc1OCC[NH2+]Cc1n[nH]c2ccccc21 ZINC000595625168 1050651468 /nfs/dbraw/zinc/65/14/68/1050651468.db2.gz KWOQGALKWCWPQM-UHFFFAOYSA-N 1 2 323.440 4.029 20 0 DIADLO Fc1ccc(C[NH2+]Cc2occc2Br)cc1Cl ZINC000227369594 1050662933 /nfs/dbraw/zinc/66/29/33/1050662933.db2.gz BLYXXWTUODYXOG-UHFFFAOYSA-N 1 2 318.573 4.124 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)OCc1ccccc1Cl)c1ccccc1 ZINC000741149927 1050663018 /nfs/dbraw/zinc/66/30/18/1050663018.db2.gz WLTMIMNNYWWGPE-KRWDZBQOSA-N 1 2 317.816 4.076 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)OCc1ccccc1Cl)c1ccccc1 ZINC000741149927 1050663025 /nfs/dbraw/zinc/66/30/25/1050663025.db2.gz WLTMIMNNYWWGPE-KRWDZBQOSA-N 1 2 317.816 4.076 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)OCc1ccc(Cl)cc1)c1ccccc1 ZINC000741150661 1050663052 /nfs/dbraw/zinc/66/30/52/1050663052.db2.gz KPGJZDQSYAISPR-QGZVFWFLSA-N 1 2 317.816 4.076 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)OCc1ccc(Cl)cc1)c1ccccc1 ZINC000741150661 1050663065 /nfs/dbraw/zinc/66/30/65/1050663065.db2.gz KPGJZDQSYAISPR-QGZVFWFLSA-N 1 2 317.816 4.076 20 0 DIADLO Cn1c2cc(Cl)ccc2nc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC000788336023 1050669532 /nfs/dbraw/zinc/66/95/32/1050669532.db2.gz CAWCLCGUMKOXFH-UHFFFAOYSA-N 1 2 308.772 4.079 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnc(-c2ccccc2)cn1 ZINC001213489555 1050669980 /nfs/dbraw/zinc/66/99/80/1050669980.db2.gz RPISOXNVQDHBIW-UHFFFAOYSA-N 1 2 302.381 4.468 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ncccc1Br ZINC001213488916 1050670056 /nfs/dbraw/zinc/67/00/56/1050670056.db2.gz GKTMBXRCRCQUHA-UHFFFAOYSA-N 1 2 304.191 4.169 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2nc(C(C)C)nn2c1 ZINC001213496905 1050671735 /nfs/dbraw/zinc/67/17/35/1050671735.db2.gz DCNHPQNQDKDPSZ-UHFFFAOYSA-N 1 2 307.401 4.177 20 0 DIADLO Cc1cc(Nc2cc(C3CC3)c[nH+]c2C)ccc1N1CCOCC1 ZINC001213499668 1050672732 /nfs/dbraw/zinc/67/27/32/1050672732.db2.gz VKLXJGRODNURAJ-UHFFFAOYSA-N 1 2 323.440 4.156 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cc(-c2ccccc2)cnn1 ZINC001213497132 1050672773 /nfs/dbraw/zinc/67/27/73/1050672773.db2.gz JYVAIZVJOGMUKW-UHFFFAOYSA-N 1 2 302.381 4.468 20 0 DIADLO Cc1cc(=O)c2ccc(Nc3cc(C4CC4)c[nH+]c3C)cc2o1 ZINC001213501067 1050675106 /nfs/dbraw/zinc/67/51/06/1050675106.db2.gz GJGRQUAECUTVRS-UHFFFAOYSA-N 1 2 306.365 4.426 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2c(c1)C(=O)N(C1CC1)C2 ZINC001213503620 1050675198 /nfs/dbraw/zinc/67/51/98/1050675198.db2.gz OXPLWYNAXSZOEL-UHFFFAOYSA-N 1 2 319.408 4.129 20 0 DIADLO COc1ccc2c(c1Nc1cc(C3CC3)c[nH+]c1C)C(=O)CC2 ZINC001213501074 1050675413 /nfs/dbraw/zinc/67/54/13/1050675413.db2.gz GTRVHAXDZPWKRT-UHFFFAOYSA-N 1 2 308.381 4.149 20 0 DIADLO Cc1cc(C)c(Nc2cc(Br)c(C)cc2N)c[nH+]1 ZINC001213515922 1050676542 /nfs/dbraw/zinc/67/65/42/1050676542.db2.gz TXSPKWDKDHZKAP-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO COc1cccc(Cn2nc(C)cc2Nc2c[nH+]c(C)cc2C)c1 ZINC001213510936 1050677036 /nfs/dbraw/zinc/67/70/36/1050677036.db2.gz MZCVYMQSQPMTHA-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1cc(C)c(Nc2ccc(OCc3ccncc3)cc2)c[nH+]1 ZINC001213518545 1050677276 /nfs/dbraw/zinc/67/72/76/1050677276.db2.gz UNKKXPUCXODEAE-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO Cc1c[nH+]cc(Nc2c(Cl)nccc2Br)c1C ZINC001213528583 1050679440 /nfs/dbraw/zinc/67/94/40/1050679440.db2.gz HBDBYYGXXQWOIZ-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO COc1c(Br)cccc1Nc1c[nH+]cc(C)c1C ZINC001213532490 1050682537 /nfs/dbraw/zinc/68/25/37/1050682537.db2.gz LCBSMBXVTDKFIH-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(OC[C@H]3CCCO3)c(F)c2)c1C ZINC001213530857 1050681387 /nfs/dbraw/zinc/68/13/87/1050681387.db2.gz OLXFXHJCPCCROL-OAHLLOKOSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1c[nH+]cc(Nc2cccc(F)c2OC[C@@H]2CCCO2)c1C ZINC001213534221 1050681583 /nfs/dbraw/zinc/68/15/83/1050681583.db2.gz RZSLGXALFIJVIZ-AWEZNQCLSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1c[nH+]cc(Nc2c(F)cccc2C(=O)C(F)(F)F)c1C ZINC001213536947 1050682518 /nfs/dbraw/zinc/68/25/18/1050682518.db2.gz UDEKBKLQZAIGOO-UHFFFAOYSA-N 1 2 312.266 4.326 20 0 DIADLO COCc1ccc(C)c(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001213571733 1050686319 /nfs/dbraw/zinc/68/63/19/1050686319.db2.gz PEIRPYDAPYDKSY-UHFFFAOYSA-N 1 2 301.777 4.186 20 0 DIADLO c1ccc(N2CCCC2)c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001213601722 1050690718 /nfs/dbraw/zinc/69/07/18/1050690718.db2.gz BGFCQFSYUDHEJY-UHFFFAOYSA-N 1 2 308.429 4.026 20 0 DIADLO c1cn(-c2cccc(Nc3ccccc3N3CCCC3)c2)c[nH+]1 ZINC001213608070 1050694504 /nfs/dbraw/zinc/69/45/04/1050694504.db2.gz NOXLGTWZBVQZQH-UHFFFAOYSA-N 1 2 304.397 4.216 20 0 DIADLO c1cn(-c2ccc(CSCC[C@H]3CCCCO3)cc2)c[nH+]1 ZINC000596355449 1050722376 /nfs/dbraw/zinc/72/23/76/1050722376.db2.gz AOLRSTGFHRYTEW-QGZVFWFLSA-N 1 2 302.443 4.065 20 0 DIADLO c1ccc2ncc(CNc3ccc(N4CCCCC4)[nH+]c3)cc2c1 ZINC000772935810 1050723226 /nfs/dbraw/zinc/72/32/26/1050723226.db2.gz GPGHMROPMSNMIX-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO c1cn(-c2ccc(CSCc3cc(C4CC4)no3)cc2)c[nH+]1 ZINC000596357667 1050724366 /nfs/dbraw/zinc/72/43/66/1050724366.db2.gz PIEGSNFKWWGMAZ-UHFFFAOYSA-N 1 2 311.410 4.171 20 0 DIADLO C[NH+](C)c1ccc(N[C@@H]2COCc3cccc(Cl)c32)cc1 ZINC000788717012 1050733460 /nfs/dbraw/zinc/73/34/60/1050733460.db2.gz BCHGTQKNLJUFPO-MRXNPFEDSA-N 1 2 302.805 4.089 20 0 DIADLO Cc1cc(N[C@@H]2COCc3cccc(Cl)c32)ccc1[NH+](C)C ZINC000788729987 1050736392 /nfs/dbraw/zinc/73/63/92/1050736392.db2.gz VUFIOKXIWVMUMC-MRXNPFEDSA-N 1 2 316.832 4.398 20 0 DIADLO COc1cccc(C2CC2)c1Nc1ccc[nH+]c1N1CCCC1 ZINC001213812074 1050749301 /nfs/dbraw/zinc/74/93/01/1050749301.db2.gz MKRUYVQVOAAGFR-UHFFFAOYSA-N 1 2 309.413 4.311 20 0 DIADLO COc1cccc(C2CC2)c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001213816837 1050751790 /nfs/dbraw/zinc/75/17/90/1050751790.db2.gz YFIUEMCGJYTMMG-UHFFFAOYSA-N 1 2 309.413 4.311 20 0 DIADLO Cc1cn2cccc(Nc3cc(C(F)(F)F)cnc3C)c2[nH+]1 ZINC001213824803 1050754222 /nfs/dbraw/zinc/75/42/22/1050754222.db2.gz MQPDWJOAYKJSLW-UHFFFAOYSA-N 1 2 306.291 4.109 20 0 DIADLO Cc1cc(Cl)nc(C[NH2+][C@H]2COCc3cccc(Cl)c32)c1 ZINC000788825273 1050760021 /nfs/dbraw/zinc/76/00/21/1050760021.db2.gz XVCPLONDOYFXFW-AWEZNQCLSA-N 1 2 323.223 4.058 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cnsn1)c1ccc(C(C)(C)C)cc1 ZINC000846815947 1050763856 /nfs/dbraw/zinc/76/38/56/1050763856.db2.gz BYMCWLMLBYBKOR-INIZCTEOSA-N 1 2 303.475 4.323 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(Cl)c(F)c2)CC[C@H]1C(F)(F)F ZINC000846870092 1050767355 /nfs/dbraw/zinc/76/73/55/1050767355.db2.gz AXECERDTWVHTHT-LLVKDONJSA-N 1 2 324.749 4.285 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(Cl)c(F)c2)CC[C@H]1C(F)(F)F ZINC000846870092 1050767371 /nfs/dbraw/zinc/76/73/71/1050767371.db2.gz AXECERDTWVHTHT-LLVKDONJSA-N 1 2 324.749 4.285 20 0 DIADLO CC(C)(C)C[C@@H]([NH2+]Cc1cnsn1)c1ccc(Cl)cc1 ZINC000846844731 1050768813 /nfs/dbraw/zinc/76/88/13/1050768813.db2.gz DZYZUDRDRZKZKW-CQSZACIVSA-N 1 2 309.866 4.459 20 0 DIADLO Cc1cc(N[C@@H]2CCCC[C@@H]2[C@@H]2CCOC2)ccc1[NH+](C)C ZINC000788982907 1050769385 /nfs/dbraw/zinc/76/93/85/1050769385.db2.gz GESIKSXPSKYJNS-KBAYOESNSA-N 1 2 302.462 4.068 20 0 DIADLO CC(C)CC[C@@H]([NH2+]Cc1cnsn1)c1ccc(Cl)cc1 ZINC000846846939 1050772833 /nfs/dbraw/zinc/77/28/33/1050772833.db2.gz ZCPUGPAFOLYSGQ-OAHLLOKOSA-N 1 2 309.866 4.459 20 0 DIADLO Fc1cc(C[NH+]2CCC(c3ccsc3)CC2)cnc1Cl ZINC000846860712 1050774698 /nfs/dbraw/zinc/77/46/98/1050774698.db2.gz HBOQQQNQISZSLE-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)cc2ccccc21)c1csnn1 ZINC001171259452 1050790160 /nfs/dbraw/zinc/79/01/60/1050790160.db2.gz UPABTCIVJZKADD-SNVBAGLBSA-N 1 2 303.818 4.196 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)cnc1Cl ZINC000847000575 1050795737 /nfs/dbraw/zinc/79/57/37/1050795737.db2.gz LAKIAGRGMPAFCL-VIFPVBQESA-N 1 2 310.722 4.039 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cnc1Cl ZINC000847000575 1050795752 /nfs/dbraw/zinc/79/57/52/1050795752.db2.gz LAKIAGRGMPAFCL-VIFPVBQESA-N 1 2 310.722 4.039 20 0 DIADLO Cc1nn(C[N@@H+]2CCC[C@@H]2c2cccc(C)c2C)c(=S)s1 ZINC000742153789 1050805546 /nfs/dbraw/zinc/80/55/46/1050805546.db2.gz YWIUZGZUKPMIII-OAHLLOKOSA-N 1 2 319.499 4.394 20 0 DIADLO Cc1nn(C[N@H+]2CCC[C@@H]2c2cccc(C)c2C)c(=S)s1 ZINC000742153789 1050805553 /nfs/dbraw/zinc/80/55/53/1050805553.db2.gz YWIUZGZUKPMIII-OAHLLOKOSA-N 1 2 319.499 4.394 20 0 DIADLO Cc1nn(C[N@@H+]2CC[C@H](c3ccccc3)[C@H](C)C2)c(=S)s1 ZINC000742167978 1050805668 /nfs/dbraw/zinc/80/56/68/1050805668.db2.gz XBTLBPXPGKCOOH-DOMZBBRYSA-N 1 2 319.499 4.066 20 0 DIADLO Cc1nn(C[N@H+]2CC[C@H](c3ccccc3)[C@H](C)C2)c(=S)s1 ZINC000742167978 1050805683 /nfs/dbraw/zinc/80/56/83/1050805683.db2.gz XBTLBPXPGKCOOH-DOMZBBRYSA-N 1 2 319.499 4.066 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H](c1ccc(F)cc1)C1CCCC1 ZINC000180322615 1050810041 /nfs/dbraw/zinc/81/00/41/1050810041.db2.gz WASJJEVKXUFYPW-SGTLLEGYSA-N 1 2 301.409 4.439 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2cc(O)ccc2Br)c(C)o1 ZINC000126860209 1050827111 /nfs/dbraw/zinc/82/71/11/1050827111.db2.gz RKBJAXPZCAUDCM-SNVBAGLBSA-N 1 2 324.218 4.215 20 0 DIADLO COCOc1cccc(Cl)c1Nc1cccc2[nH+]c(C)cn21 ZINC001214302878 1050863945 /nfs/dbraw/zinc/86/39/45/1050863945.db2.gz GYSAOYBRUHYJNZ-UHFFFAOYSA-N 1 2 317.776 4.022 20 0 DIADLO CCOc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)ccc1C ZINC001214325619 1050870394 /nfs/dbraw/zinc/87/03/94/1050870394.db2.gz JWJDOLWQPDJQPH-UHFFFAOYSA-N 1 2 307.397 4.382 20 0 DIADLO C[C@@H](c1nc(C2(c3ccc(F)cc3)CCCCC2)no1)[NH+](C)C ZINC000789819836 1050890215 /nfs/dbraw/zinc/89/02/15/1050890215.db2.gz OIJOKOXWORBDHP-ZDUSSCGKSA-N 1 2 317.408 4.082 20 0 DIADLO CSc1cc(Nc2ccc(OC(F)(F)F)cc2O)cc[nH+]1 ZINC001214389983 1050890291 /nfs/dbraw/zinc/89/02/91/1050890291.db2.gz QAIBMGZAJDLSPM-UHFFFAOYSA-N 1 2 316.304 4.151 20 0 DIADLO C[C@H]1COCCN1c1ccc([NH2+]C[C@@H]2CCc3ccccc32)cc1 ZINC000790051597 1050909310 /nfs/dbraw/zinc/90/93/10/1050909310.db2.gz BBABJFKTFVUUAV-WMZOPIPTSA-N 1 2 322.452 4.054 20 0 DIADLO Oc1c(F)cc(Nc2ccc(N3CCCCC3)[nH+]c2)cc1Cl ZINC001214480673 1050917523 /nfs/dbraw/zinc/91/75/23/1050917523.db2.gz XVNUSABJYZIMBJ-UHFFFAOYSA-N 1 2 321.783 4.314 20 0 DIADLO CN(C(=O)Nc1ccc2[nH+]ccn2c1)c1ccc(C(C)(C)C)cc1 ZINC001626455162 1050918929 /nfs/dbraw/zinc/91/89/29/1050918929.db2.gz OZBSEEJXRLAWEK-UHFFFAOYSA-N 1 2 322.412 4.300 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cccc(OC(F)(F)F)c1F ZINC001241243061 1050927921 /nfs/dbraw/zinc/92/79/21/1050927921.db2.gz NZUUOLIGAXECCU-UHFFFAOYSA-N 1 2 314.282 4.161 20 0 DIADLO Oc1ccc(Cl)c(Nc2cccc(-n3cc[nH+]c3)c2)c1F ZINC001214559647 1050941580 /nfs/dbraw/zinc/94/15/80/1050941580.db2.gz RUMFEGKHBCFREA-UHFFFAOYSA-N 1 2 303.724 4.114 20 0 DIADLO COc1ccc(C)c(F)c1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001214629271 1050966582 /nfs/dbraw/zinc/96/65/82/1050966582.db2.gz QEHOPQIEFRMFOB-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO COc1ccc(F)c(Nc2c(C)cc[nH+]c2C(C)C)c1OC ZINC001214695563 1050981580 /nfs/dbraw/zinc/98/15/80/1050981580.db2.gz MQMUJUOWEWZOQZ-UHFFFAOYSA-N 1 2 304.365 4.413 20 0 DIADLO CC(=O)c1ccc(F)c(Nc2ccccc2-n2cc[nH+]c2)c1F ZINC001214760682 1050995959 /nfs/dbraw/zinc/99/59/59/1050995959.db2.gz RZUIYTCFLCGCNE-UHFFFAOYSA-N 1 2 313.307 4.097 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2Cl)nn1C ZINC000282782279 1051000164 /nfs/dbraw/zinc/00/01/64/1051000164.db2.gz PPQVXJZCYCXUGR-GHMZBOCLSA-N 1 2 312.244 4.447 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1cccnc1Cl ZINC000773038793 1051035523 /nfs/dbraw/zinc/03/55/23/1051035523.db2.gz CFOLCFUCAGLGDD-NOZJJQNGSA-N 1 2 309.196 4.173 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1cccnc1Cl ZINC000773038795 1051036608 /nfs/dbraw/zinc/03/66/08/1051036608.db2.gz CFOLCFUCAGLGDD-TVQRCGJNSA-N 1 2 309.196 4.173 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1cccnc1Cl ZINC000773061419 1051043487 /nfs/dbraw/zinc/04/34/87/1051043487.db2.gz XOXHLRFWOXOBKY-ZANVPECISA-N 1 2 309.196 4.173 20 0 DIADLO CC(=O)c1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)c(F)c1F ZINC001214983707 1051044517 /nfs/dbraw/zinc/04/45/17/1051044517.db2.gz MDRMRHHBRZXPLX-UHFFFAOYSA-N 1 2 313.307 4.097 20 0 DIADLO CCN(CC)C(=O)c1cccc(Nc2c[nH+]c(C)cc2C)c1F ZINC001215011199 1051052991 /nfs/dbraw/zinc/05/29/91/1051052991.db2.gz JJYQGTBHTIKYNM-UHFFFAOYSA-N 1 2 315.392 4.063 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(F)n1)c1cc(Cl)sc1Cl ZINC000773083980 1051054713 /nfs/dbraw/zinc/05/47/13/1051054713.db2.gz ADTDTPZMIXDVJC-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(F)n1)c1nc(-c2ccccc2)cs1 ZINC000773092084 1051061083 /nfs/dbraw/zinc/06/10/83/1051061083.db2.gz YLEWZOVECVABAO-LBPRGKRZSA-N 1 2 313.401 4.195 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@@H+]2Cc2cccc(Cl)n2)cc1 ZINC000743849818 1051074298 /nfs/dbraw/zinc/07/42/98/1051074298.db2.gz HRWPQTAITRWRMH-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@H+]2Cc2cccc(Cl)n2)cc1 ZINC000743849818 1051074304 /nfs/dbraw/zinc/07/43/04/1051074304.db2.gz HRWPQTAITRWRMH-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2cccc(Cl)n2)[C@@H]1c1ccccc1 ZINC000743850212 1051075366 /nfs/dbraw/zinc/07/53/66/1051075366.db2.gz PSSURGIRZWKHGA-DYVFJYSZSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2cccc(Cl)n2)[C@@H]1c1ccccc1 ZINC000743850212 1051075371 /nfs/dbraw/zinc/07/53/71/1051075371.db2.gz PSSURGIRZWKHGA-DYVFJYSZSA-N 1 2 318.873 4.414 20 0 DIADLO Cc1cccc([C@@H]2CCCC[N@H+]2Cc2ncc(Cl)n2C)c1C ZINC000743862799 1051087480 /nfs/dbraw/zinc/08/74/80/1051087480.db2.gz KTTAHOFPHRXQLQ-INIZCTEOSA-N 1 2 317.864 4.418 20 0 DIADLO Cc1cccc([C@@H]2CCCC[N@@H+]2Cc2ncc(Cl)n2C)c1C ZINC000743862799 1051087487 /nfs/dbraw/zinc/08/74/87/1051087487.db2.gz KTTAHOFPHRXQLQ-INIZCTEOSA-N 1 2 317.864 4.418 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CCCC[C@@H]1c1ccc(F)cc1 ZINC000752090417 1051089660 /nfs/dbraw/zinc/08/96/60/1051089660.db2.gz WPTJWJQIBRWGBW-MRXNPFEDSA-N 1 2 321.827 4.248 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CCCC[C@@H]1c1ccc(F)cc1 ZINC000752090417 1051089670 /nfs/dbraw/zinc/08/96/70/1051089670.db2.gz WPTJWJQIBRWGBW-MRXNPFEDSA-N 1 2 321.827 4.248 20 0 DIADLO COc1cc(F)cc(CNc2cc(C)c(C(F)(F)F)c[nH+]2)c1 ZINC001171411513 1051100133 /nfs/dbraw/zinc/10/01/33/1051100133.db2.gz YGLBGWQYCHTTJU-UHFFFAOYSA-N 1 2 314.282 4.169 20 0 DIADLO CC(C)c1ccc([C@@H](C)CC(=O)OCc2cc[nH+]c(N)c2)cc1 ZINC000791932558 1051106833 /nfs/dbraw/zinc/10/68/33/1051106833.db2.gz ZVLKDJMQLTVYRO-AWEZNQCLSA-N 1 2 312.413 4.024 20 0 DIADLO CC(C)c1ccc([C@H](C)CC(=O)OCc2cc[nH+]c(N)c2)cc1 ZINC000791932559 1051107179 /nfs/dbraw/zinc/10/71/79/1051107179.db2.gz ZVLKDJMQLTVYRO-CQSZACIVSA-N 1 2 312.413 4.024 20 0 DIADLO COC(=O)c1c(F)ccc(Nc2c(C)cc[nH+]c2C(C)C)c1F ZINC001215189400 1051108304 /nfs/dbraw/zinc/10/83/04/1051108304.db2.gz CCUOOKDHWBIEQX-UHFFFAOYSA-N 1 2 320.339 4.322 20 0 DIADLO Clc1ccc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)cc1 ZINC001215195567 1051111033 /nfs/dbraw/zinc/11/10/33/1051111033.db2.gz ZFLPJIUMLDUURQ-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO Brc1ccc2c(c1)CC[N@@H+](Cc1ccsc1)C2 ZINC001204034590 1051112672 /nfs/dbraw/zinc/11/26/72/1051112672.db2.gz HWRHLMFLHAFIIL-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1ccc2c(c1)CC[N@H+](Cc1ccsc1)C2 ZINC001204034590 1051112684 /nfs/dbraw/zinc/11/26/84/1051112684.db2.gz HWRHLMFLHAFIIL-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)OC(=O)CCCn1cc[nH+]c1 ZINC000792553382 1051145842 /nfs/dbraw/zinc/14/58/42/1051145842.db2.gz SRYYTBMNYCZDIF-AWEZNQCLSA-N 1 2 312.369 4.022 20 0 DIADLO COc1ccc2cc(NCCOC3CCCCC3)[nH+]cc2c1 ZINC001171474020 1051149166 /nfs/dbraw/zinc/14/91/66/1051149166.db2.gz UNNWNPPMAWJHOT-UHFFFAOYSA-N 1 2 300.402 4.005 20 0 DIADLO CCSc1nn(C[N@@H+]2CC[C@H](CC(C)C)C2)c(=S)s1 ZINC000744437877 1051176458 /nfs/dbraw/zinc/17/64/58/1051176458.db2.gz ZLXDHGDVPZYBRW-LLVKDONJSA-N 1 2 317.549 4.112 20 0 DIADLO CCSc1nn(C[N@H+]2CC[C@H](CC(C)C)C2)c(=S)s1 ZINC000744437877 1051176463 /nfs/dbraw/zinc/17/64/63/1051176463.db2.gz ZLXDHGDVPZYBRW-LLVKDONJSA-N 1 2 317.549 4.112 20 0 DIADLO Fc1ccc(Nc2ccc([NH+]3CCCCC3)cc2)c2c[nH]nc21 ZINC001215377300 1051181154 /nfs/dbraw/zinc/18/11/54/1051181154.db2.gz DVOIXFFIBMTMBP-UHFFFAOYSA-N 1 2 310.376 4.436 20 0 DIADLO CCC[C@H]([NH2+]Cc1noc2c1CCCC2)c1ccc(F)cc1F ZINC000181669205 1051195876 /nfs/dbraw/zinc/19/58/76/1051195876.db2.gz XHEKLKINHZHXNM-INIZCTEOSA-N 1 2 320.383 4.463 20 0 DIADLO Cc1cnc(C[N@@H+](C)Cc2oc3c(cccc3C)c2C)s1 ZINC001171730029 1051202660 /nfs/dbraw/zinc/20/26/60/1051202660.db2.gz PUACSUSOSXQTII-UHFFFAOYSA-N 1 2 300.427 4.447 20 0 DIADLO Cc1cnc(C[N@H+](C)Cc2oc3c(cccc3C)c2C)s1 ZINC001171730029 1051202671 /nfs/dbraw/zinc/20/26/71/1051202671.db2.gz PUACSUSOSXQTII-UHFFFAOYSA-N 1 2 300.427 4.447 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+]1C[C@@H](C)OC2(CCCC2)C1 ZINC001171735019 1051213187 /nfs/dbraw/zinc/21/31/87/1051213187.db2.gz NZYPVYKSHGBZCA-CQSZACIVSA-N 1 2 323.864 4.272 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+]1C[C@@H](C)OC2(CCCC2)C1 ZINC001171735019 1051213194 /nfs/dbraw/zinc/21/31/94/1051213194.db2.gz NZYPVYKSHGBZCA-CQSZACIVSA-N 1 2 323.864 4.272 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000792821269 1051215045 /nfs/dbraw/zinc/21/50/45/1051215045.db2.gz CKVJFFBFYXRXSP-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000792821269 1051215054 /nfs/dbraw/zinc/21/50/54/1051215054.db2.gz CKVJFFBFYXRXSP-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)O[C@H](C)c1cccc(F)c1)c1ccccc1 ZINC000745097963 1051221377 /nfs/dbraw/zinc/22/13/77/1051221377.db2.gz OKAVJYOHOHTDAL-RDTXWAMCSA-N 1 2 315.388 4.123 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)O[C@H](C)c1cccc(F)c1)c1ccccc1 ZINC000745097963 1051221394 /nfs/dbraw/zinc/22/13/94/1051221394.db2.gz OKAVJYOHOHTDAL-RDTXWAMCSA-N 1 2 315.388 4.123 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)OCc1c(C)cccc1C)c1ccccc1 ZINC000745097462 1051221651 /nfs/dbraw/zinc/22/16/51/1051221651.db2.gz DAERQQSNTNJNGJ-LJQANCHMSA-N 1 2 311.425 4.040 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)OCc1c(C)cccc1C)c1ccccc1 ZINC000745097462 1051221663 /nfs/dbraw/zinc/22/16/63/1051221663.db2.gz DAERQQSNTNJNGJ-LJQANCHMSA-N 1 2 311.425 4.040 20 0 DIADLO CC(C)[C@@H]1CCC[C@@H]([NH2+]c2ccc(N3CCC(O)CC3)cc2)C1 ZINC000792849929 1051221669 /nfs/dbraw/zinc/22/16/69/1051221669.db2.gz UNOWHDPZHDMJKB-SJLPKXTDSA-N 1 2 316.489 4.274 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1csc(Br)c1)CC2 ZINC001171815517 1051228290 /nfs/dbraw/zinc/22/82/90/1051228290.db2.gz OYZMOIVFMDGZMC-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1csc(Br)c1)CC2 ZINC001171815517 1051228304 /nfs/dbraw/zinc/22/83/04/1051228304.db2.gz OYZMOIVFMDGZMC-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Clc1cc(Br)cc2nc(/C=C/c3[nH]cc[nH+]3)oc21 ZINC000792918350 1051229784 /nfs/dbraw/zinc/22/97/84/1051229784.db2.gz ZJIAROCCULSZAW-OWOJBTEDSA-N 1 2 324.565 4.137 20 0 DIADLO Cc1nonc1C[N@@H+](CC(C)C)[C@@H](C)c1ccccc1Cl ZINC000792929181 1051230613 /nfs/dbraw/zinc/23/06/13/1051230613.db2.gz XGRBWEHLMPSTOA-ZDUSSCGKSA-N 1 2 307.825 4.251 20 0 DIADLO Cc1nonc1C[N@H+](CC(C)C)[C@@H](C)c1ccccc1Cl ZINC000792929181 1051230624 /nfs/dbraw/zinc/23/06/24/1051230624.db2.gz XGRBWEHLMPSTOA-ZDUSSCGKSA-N 1 2 307.825 4.251 20 0 DIADLO COc1cc(C[N@@H+]2CC[C@H]2c2ccc(F)cc2)ccc1Cl ZINC001171847514 1051232877 /nfs/dbraw/zinc/23/28/77/1051232877.db2.gz NQEWNLUKRKPFSS-INIZCTEOSA-N 1 2 305.780 4.435 20 0 DIADLO COc1cc(C[N@H+]2CC[C@H]2c2ccc(F)cc2)ccc1Cl ZINC001171847514 1051232892 /nfs/dbraw/zinc/23/28/92/1051232892.db2.gz NQEWNLUKRKPFSS-INIZCTEOSA-N 1 2 305.780 4.435 20 0 DIADLO COCc1cc(C)c(Nc2[nH+]cccc2N2CCCC2)c(C)c1 ZINC001215529887 1051235220 /nfs/dbraw/zinc/23/52/20/1051235220.db2.gz APBFESJCETZWKR-UHFFFAOYSA-N 1 2 311.429 4.189 20 0 DIADLO CCC1(CC)CCC[N@@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001171953917 1051241691 /nfs/dbraw/zinc/24/16/91/1051241691.db2.gz ATQKVSBBCYJJAD-INIZCTEOSA-N 1 2 323.864 4.456 20 0 DIADLO CCC1(CC)CCC[N@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001171953917 1051241700 /nfs/dbraw/zinc/24/17/00/1051241700.db2.gz ATQKVSBBCYJJAD-INIZCTEOSA-N 1 2 323.864 4.456 20 0 DIADLO CCc1cccc(Nc2ccc3cnn([C@@H]4CCCCO4)c3c2)[nH+]1 ZINC001215561639 1051245381 /nfs/dbraw/zinc/24/53/81/1051245381.db2.gz KDHCBDCJWVEJCG-IBGZPJMESA-N 1 2 322.412 4.436 20 0 DIADLO C[C@@H](Cc1ccc(C(F)(F)F)cc1)[N@@H+]1CCCC(F)(F)C1 ZINC001171968053 1051250435 /nfs/dbraw/zinc/25/04/35/1051250435.db2.gz DPRUGUCEPIQQGW-NSHDSACASA-N 1 2 307.306 4.368 20 0 DIADLO C[C@@H](Cc1ccc(C(F)(F)F)cc1)[N@H+]1CCCC(F)(F)C1 ZINC001171968053 1051250442 /nfs/dbraw/zinc/25/04/42/1051250442.db2.gz DPRUGUCEPIQQGW-NSHDSACASA-N 1 2 307.306 4.368 20 0 DIADLO OCc1c(F)ccc(Nc2ccc([NH+]3CCCCC3)cc2)c1F ZINC001215651689 1051285550 /nfs/dbraw/zinc/28/55/50/1051285550.db2.gz JALFZAGEWZYWSL-UHFFFAOYSA-N 1 2 318.367 4.191 20 0 DIADLO COc1ccc(-c2nc(C[NH+]3CCC(F)(F)CC3)cs2)cc1 ZINC000793361128 1051288433 /nfs/dbraw/zinc/28/84/33/1051288433.db2.gz FUWIIRIEUDCLRU-UHFFFAOYSA-N 1 2 324.396 4.050 20 0 DIADLO CCC(CC)C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000793378700 1051290766 /nfs/dbraw/zinc/29/07/66/1051290766.db2.gz PTJNJHPBBOKKPK-UHFFFAOYSA-N 1 2 312.413 4.228 20 0 DIADLO COc1cc(Nc2cccc(Cn3cc[nH+]c3)c2)cc(C)c1F ZINC001215703258 1051313635 /nfs/dbraw/zinc/31/36/35/1051313635.db2.gz VIHKMQNJDJNPCL-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO Cc1cc(F)cc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)c1 ZINC001215706573 1051314650 /nfs/dbraw/zinc/31/46/50/1051314650.db2.gz NWLNVPBJYQADNP-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@@H+](Cc2cccc3cnccc32)C1 ZINC000183365912 1051314771 /nfs/dbraw/zinc/31/47/71/1051314771.db2.gz OKCARPPTJSDYNE-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@H+](Cc2cccc3cnccc32)C1 ZINC000183365912 1051314778 /nfs/dbraw/zinc/31/47/78/1051314778.db2.gz OKCARPPTJSDYNE-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO CCCOc1c(F)cc(F)c(Nc2cccc3[nH+]ccn32)c1F ZINC001212647252 1051324296 /nfs/dbraw/zinc/32/42/96/1051324296.db2.gz SCLCWWOKXLLWFA-UHFFFAOYSA-N 1 2 321.302 4.284 20 0 DIADLO CC(C)Oc1c(F)ccc(Nc2[nH+]c3ccccc3n2C)c1F ZINC001215726709 1051326717 /nfs/dbraw/zinc/32/67/17/1051326717.db2.gz WFUFTRJTNJCCAH-UHFFFAOYSA-N 1 2 317.339 4.382 20 0 DIADLO CCOc1cc[nH+]cc1Nc1ccc(F)c(OC(C)C)c1F ZINC001215727277 1051327855 /nfs/dbraw/zinc/32/78/55/1051327855.db2.gz JVFCTZFWHVGEIT-UHFFFAOYSA-N 1 2 308.328 4.289 20 0 DIADLO CCC[N@H+](Cc1ncc(Cl)n1C)[C@H](C)c1ccccc1OC ZINC000746145794 1051329976 /nfs/dbraw/zinc/32/99/76/1051329976.db2.gz QMAKAWYHOXIDDK-CYBMUJFWSA-N 1 2 321.852 4.055 20 0 DIADLO CCC[N@@H+](Cc1ncc(Cl)n1C)[C@H](C)c1ccccc1OC ZINC000746145794 1051329983 /nfs/dbraw/zinc/32/99/83/1051329983.db2.gz QMAKAWYHOXIDDK-CYBMUJFWSA-N 1 2 321.852 4.055 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cc(Cl)ccc1SC ZINC001243610436 1051354390 /nfs/dbraw/zinc/35/43/90/1051354390.db2.gz WIRAOSJVLYJHAM-UHFFFAOYSA-N 1 2 304.802 4.385 20 0 DIADLO CC[C@@H](C)Sc1ccc(NC(=O)CCc2c[nH]c[nH+]2)c(C)c1 ZINC000193030238 1051369893 /nfs/dbraw/zinc/36/98/93/1051369893.db2.gz UHOWXYDXXNHRMC-CYBMUJFWSA-N 1 2 317.458 4.180 20 0 DIADLO CC[C@@H](C)Sc1ccc(NC(=O)CCc2c[nH+]c[nH]2)c(C)c1 ZINC000193030238 1051369897 /nfs/dbraw/zinc/36/98/97/1051369897.db2.gz UHOWXYDXXNHRMC-CYBMUJFWSA-N 1 2 317.458 4.180 20 0 DIADLO CSc1cc(Nc2ccc(N3CCCC3)[nH+]c2)ccc1F ZINC001215793145 1051373293 /nfs/dbraw/zinc/37/32/93/1051373293.db2.gz AIDLALIMEPVTBC-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO CSc1cc(Nc2[nH+]cccc2N2CCCC2)ccc1F ZINC001215794577 1051374086 /nfs/dbraw/zinc/37/40/86/1051374086.db2.gz UCSDZHKQINFVSE-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO CC[C@H](CC(C)C)[N@@H+]1CCCC[C@H]1c1noc(C(F)(F)F)n1 ZINC001172406164 1051379999 /nfs/dbraw/zinc/37/99/99/1051379999.db2.gz GFGQLMYOXLKPIM-NEPJUHHUSA-N 1 2 319.371 4.440 20 0 DIADLO CC[C@H](CC(C)C)[N@H+]1CCCC[C@H]1c1noc(C(F)(F)F)n1 ZINC001172406164 1051380017 /nfs/dbraw/zinc/38/00/17/1051380017.db2.gz GFGQLMYOXLKPIM-NEPJUHHUSA-N 1 2 319.371 4.440 20 0 DIADLO O[C@@H](CNc1cc[nH+]c2c(Cl)cccc12)c1cccc(F)c1 ZINC000804378720 1051386811 /nfs/dbraw/zinc/38/68/11/1051386811.db2.gz BNVAKLDSWDFHSU-INIZCTEOSA-N 1 2 316.763 4.173 20 0 DIADLO CSc1ncc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1C ZINC001215828547 1051394321 /nfs/dbraw/zinc/39/43/21/1051394321.db2.gz NWWUZDFMOGJMGJ-UHFFFAOYSA-N 1 2 310.426 4.100 20 0 DIADLO CC(C)c1ccc(C(=O)Nc2ccn3cc[nH+]c3c2)cc1Cl ZINC001129482637 1051403162 /nfs/dbraw/zinc/40/31/62/1051403162.db2.gz VTAKEHGHXJWUAP-UHFFFAOYSA-N 1 2 313.788 4.363 20 0 DIADLO CCO[C@@H]1C[C@@H](Nc2cccc(-n3cc[nH+]c3)c2)C12CCCC2 ZINC000390962238 1051406227 /nfs/dbraw/zinc/40/62/27/1051406227.db2.gz ZUJJCSPEPJTFDH-QZTJIDSGSA-N 1 2 311.429 4.022 20 0 DIADLO Clc1cc2n[nH]cc2c(Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001215858735 1051418262 /nfs/dbraw/zinc/41/82/62/1051418262.db2.gz CTCIKZWJWOTCTP-UHFFFAOYSA-N 1 2 309.760 4.146 20 0 DIADLO Cc1ccc(Nc2ccc(C[NH+]3CC(O)C3)cc2)c2ccccc12 ZINC001212670210 1051449902 /nfs/dbraw/zinc/44/99/02/1051449902.db2.gz MJULMBUSRXQIHH-UHFFFAOYSA-N 1 2 318.420 4.068 20 0 DIADLO Clc1cccc2c(NC[C@@H]3CSCCS3)cc[nH+]c12 ZINC000804539337 1051451747 /nfs/dbraw/zinc/45/17/47/1051451747.db2.gz ZYQLQQZOGAGSQW-SNVBAGLBSA-N 1 2 310.875 4.149 20 0 DIADLO COc1ccc(Nc2[nH+]cccc2N2CCCC2)cc1SC ZINC001215932545 1051464840 /nfs/dbraw/zinc/46/48/40/1051464840.db2.gz JVNIPJHNSRSRMH-UHFFFAOYSA-N 1 2 315.442 4.156 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1coc(-c2ccccc2F)n1 ZINC001168948912 1051473613 /nfs/dbraw/zinc/47/36/13/1051473613.db2.gz IPNGJMPPEPBGAO-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1coc(-c2ccccc2F)n1 ZINC001168948912 1051473624 /nfs/dbraw/zinc/47/36/24/1051473624.db2.gz IPNGJMPPEPBGAO-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO Fc1ncc(Nc2ccn3cc[nH+]c3c2)cc1-c1ccccc1 ZINC001215961283 1051487089 /nfs/dbraw/zinc/48/70/89/1051487089.db2.gz YFHAVOHSQPGLIS-UHFFFAOYSA-N 1 2 304.328 4.279 20 0 DIADLO CC1(C)CCNc2cc(NCCc3cn4ccccc4[nH+]3)ccc21 ZINC001169008374 1051487657 /nfs/dbraw/zinc/48/76/57/1051487657.db2.gz AEJRXRCJBMKOJY-UHFFFAOYSA-N 1 2 320.440 4.082 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(NCCc2cn3ccccc3n2)c1 ZINC001169009553 1051487719 /nfs/dbraw/zinc/48/77/19/1051487719.db2.gz QHEYAGPPCGIBJR-UHFFFAOYSA-N 1 2 322.456 4.144 20 0 DIADLO COc1c(C)cc(C)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001215998526 1051514933 /nfs/dbraw/zinc/51/49/33/1051514933.db2.gz OASPCBJGLLVRJJ-UHFFFAOYSA-N 1 2 307.397 4.300 20 0 DIADLO Cc1ccc2c(c1)CC[C@H]2[NH2+][C@H](C)c1noc(-c2ccccc2)n1 ZINC000766603037 1051525485 /nfs/dbraw/zinc/52/54/85/1051525485.db2.gz VKIOPCFFNSIAHN-RDTXWAMCSA-N 1 2 319.408 4.383 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+]([C@@H](C)Cc1ccc(F)cc1Cl)C2 ZINC001172867938 1051525859 /nfs/dbraw/zinc/52/58/59/1051525859.db2.gz CMRMLTRRZHZPGG-LBPRGKRZSA-N 1 2 304.796 4.129 20 0 DIADLO Cc1cc2c(cn1)C[N@H+]([C@@H](C)Cc1ccc(F)cc1Cl)C2 ZINC001172867938 1051525875 /nfs/dbraw/zinc/52/58/75/1051525875.db2.gz CMRMLTRRZHZPGG-LBPRGKRZSA-N 1 2 304.796 4.129 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cccc1F)c1nc2ccccc2s1 ZINC000766605185 1051528391 /nfs/dbraw/zinc/52/83/91/1051528391.db2.gz RSHBXDIXYKSPFT-SNVBAGLBSA-N 1 2 304.365 4.425 20 0 DIADLO Clc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)c2n[nH]cc21 ZINC001216056367 1051553173 /nfs/dbraw/zinc/55/31/73/1051553173.db2.gz CDJGKXPQMZNBPI-UHFFFAOYSA-N 1 2 309.760 4.146 20 0 DIADLO C[C@@H](CSc1ccc(Cl)cc1)[N@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001172874421 1051558726 /nfs/dbraw/zinc/55/87/26/1051558726.db2.gz AYQCYKLBMKDGFM-GWCFXTLKSA-N 1 2 323.811 4.500 20 0 DIADLO C[C@@H](CSc1ccc(Cl)cc1)[N@@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001172874421 1051558718 /nfs/dbraw/zinc/55/87/18/1051558718.db2.gz AYQCYKLBMKDGFM-GWCFXTLKSA-N 1 2 323.811 4.500 20 0 DIADLO Fc1ncc(-c2ccccc2)cc1Nc1cccc2[nH+]ccn21 ZINC001216068506 1051560211 /nfs/dbraw/zinc/56/02/11/1051560211.db2.gz OBNDKHOMEFESOL-UHFFFAOYSA-N 1 2 304.328 4.279 20 0 DIADLO CC(C)(C)CCCCC(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000804313246 1051562863 /nfs/dbraw/zinc/56/28/63/1051562863.db2.gz MXKBQZKUSCHQIB-UHFFFAOYSA-N 1 2 313.445 4.095 20 0 DIADLO COc1cc(Nc2cc(C)cc(C)c2N)[nH+]cc1C(F)(F)F ZINC001216100278 1051579482 /nfs/dbraw/zinc/57/94/82/1051579482.db2.gz LZOFBLQZEPYOMN-UHFFFAOYSA-N 1 2 311.307 4.052 20 0 DIADLO CC(C)(C)c1cncc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212695337 1051583547 /nfs/dbraw/zinc/58/35/47/1051583547.db2.gz AEZGGHQSJQRTFR-UHFFFAOYSA-N 1 2 306.413 4.368 20 0 DIADLO FC(F)c1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)nc1 ZINC001212695911 1051585793 /nfs/dbraw/zinc/58/57/93/1051585793.db2.gz XZRDJQWDPXVQCY-UHFFFAOYSA-N 1 2 300.312 4.008 20 0 DIADLO c1cn(Cc2ccc(Nc3cccc4c3OCCC4)cc2)c[nH+]1 ZINC001212697972 1051586625 /nfs/dbraw/zinc/58/66/25/1051586625.db2.gz FATXQSNMPJTQJV-UHFFFAOYSA-N 1 2 305.381 4.000 20 0 DIADLO CC(=O)c1ccc(C)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212698332 1051586708 /nfs/dbraw/zinc/58/67/08/1051586708.db2.gz NDQSPPIJNZYEBW-UHFFFAOYSA-N 1 2 305.381 4.186 20 0 DIADLO CCC(=O)c1cccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212699006 1051586731 /nfs/dbraw/zinc/58/67/31/1051586731.db2.gz ILBMNUBMUBQJBN-UHFFFAOYSA-N 1 2 305.381 4.268 20 0 DIADLO Cc1nc2cc(Nc3ccc(Cn4cc[nH+]c4)cc3)ccc2o1 ZINC001212696957 1051586822 /nfs/dbraw/zinc/58/68/22/1051586822.db2.gz XDOVHCUXNYCWPV-UHFFFAOYSA-N 1 2 304.353 4.125 20 0 DIADLO CNc1ccc(Cl)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212697906 1051586952 /nfs/dbraw/zinc/58/69/52/1051586952.db2.gz ALAZOPCUTDYNPH-UHFFFAOYSA-N 1 2 312.804 4.370 20 0 DIADLO Cc1c(Cl)ccc(N)c1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212698440 1051587236 /nfs/dbraw/zinc/58/72/36/1051587236.db2.gz UDNFFNXTJMRZOX-UHFFFAOYSA-N 1 2 312.804 4.219 20 0 DIADLO O[C@H]1CCCc2ccc(Nc3ccc(Cn4cc[nH+]c4)cc3)cc21 ZINC001212699017 1051589073 /nfs/dbraw/zinc/58/90/73/1051589073.db2.gz JKYHJQQJMLJOHT-FQEVSTJZSA-N 1 2 319.408 4.045 20 0 DIADLO COC(=O)c1cc2[nH+]c[nH]c2c(N[C@@H]2C[C@H](C)c3ccccc32)c1 ZINC001169371137 1051592514 /nfs/dbraw/zinc/59/25/14/1051592514.db2.gz CGALCBQHNNYWRN-XHDPSFHLSA-N 1 2 321.380 4.010 20 0 DIADLO CCOC(=O)CCc1ccc[nH+]c1N[C@@H]1C[C@@H](C)c2ccccc21 ZINC001169371919 1051592870 /nfs/dbraw/zinc/59/28/70/1051592870.db2.gz DHMINFPUGJVHLJ-RDTXWAMCSA-N 1 2 324.424 4.238 20 0 DIADLO COc1c(C)[nH+]c(C2CC2)nc1N[C@@H]1C[C@H](C)c2ccccc21 ZINC001169374304 1051595861 /nfs/dbraw/zinc/59/58/61/1051595861.db2.gz JGBXPMKLOFMJPZ-MEDUHNTESA-N 1 2 309.413 4.331 20 0 DIADLO Cc1cc(CNC(=O)c2ccc(Oc3ccccc3)o2)cc(C)[nH+]1 ZINC001130044644 1051600956 /nfs/dbraw/zinc/60/09/56/1051600956.db2.gz FEZSMGFWYMBASO-UHFFFAOYSA-N 1 2 322.364 4.014 20 0 DIADLO C[C@H](c1ccc(Oc2ccccc2)cc1)[N@@H+]1CCC(=O)[C@H](C)C1 ZINC001169409770 1051604590 /nfs/dbraw/zinc/60/45/90/1051604590.db2.gz QGWHQQVVPRIQGR-HZPDHXFCSA-N 1 2 309.409 4.451 20 0 DIADLO C[C@H](c1ccc(Oc2ccccc2)cc1)[N@H+]1CCC(=O)[C@H](C)C1 ZINC001169409770 1051604623 /nfs/dbraw/zinc/60/46/23/1051604623.db2.gz QGWHQQVVPRIQGR-HZPDHXFCSA-N 1 2 309.409 4.451 20 0 DIADLO Cc1cc(NC[C@@H](C)c2nc3ccccc3o2)nc(C2CC2)[nH+]1 ZINC000747226441 1051607132 /nfs/dbraw/zinc/60/71/32/1051607132.db2.gz IOLYEEXRJBFHKK-LLVKDONJSA-N 1 2 308.385 4.019 20 0 DIADLO Fc1cc(Nc2cccn3cc[nH+]c23)cc(N2CCCCC2)c1 ZINC001216178866 1051612860 /nfs/dbraw/zinc/61/28/60/1051612860.db2.gz WGQALNWWODBWHD-UHFFFAOYSA-N 1 2 310.376 4.207 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@@H](C)c1ccnc(Cl)c1)c1ccco1 ZINC000152610515 1051627893 /nfs/dbraw/zinc/62/78/93/1051627893.db2.gz XMEAOGGZNOQRLO-ZFWWWQNUSA-N 1 2 322.836 4.393 20 0 DIADLO CSc1ncc(C)cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001216239834 1051646419 /nfs/dbraw/zinc/64/64/19/1051646419.db2.gz QQORFBWCVIRNQY-UHFFFAOYSA-N 1 2 314.458 4.241 20 0 DIADLO CCc1ccc(C[C@H](C)[N@@H+]2Cc3cnc(Cl)cc3C2)cc1 ZINC001173247373 1051651288 /nfs/dbraw/zinc/65/12/88/1051651288.db2.gz PHEGXNZTROOQPE-ZDUSSCGKSA-N 1 2 300.833 4.244 20 0 DIADLO CCc1ccc(C[C@H](C)[N@H+]2Cc3cnc(Cl)cc3C2)cc1 ZINC001173247373 1051651298 /nfs/dbraw/zinc/65/12/98/1051651298.db2.gz PHEGXNZTROOQPE-ZDUSSCGKSA-N 1 2 300.833 4.244 20 0 DIADLO COc1cc(Nc2cc[nH+]c(SC)c2)ccc1OC(C)C ZINC001216246320 1051652074 /nfs/dbraw/zinc/65/20/74/1051652074.db2.gz BCBYLOMPDRSFEA-UHFFFAOYSA-N 1 2 304.415 4.343 20 0 DIADLO CCCC[C@H](CC(C)C)[N@@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001173262091 1051663214 /nfs/dbraw/zinc/66/32/14/1051663214.db2.gz RZDCCTMRPDIEKS-HZPDHXFCSA-N 1 2 307.482 4.011 20 0 DIADLO CCCC[C@H](CC(C)C)[N@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001173262091 1051663218 /nfs/dbraw/zinc/66/32/18/1051663218.db2.gz RZDCCTMRPDIEKS-HZPDHXFCSA-N 1 2 307.482 4.011 20 0 DIADLO CCCC[C@H](CC(C)C)[N@@H+]1CCOC[C@H]1c1csc(C)n1 ZINC001173261568 1051663805 /nfs/dbraw/zinc/66/38/05/1051663805.db2.gz OYTKUTQWWGRXPS-WBVHZDCISA-N 1 2 310.507 4.430 20 0 DIADLO CCCC[C@H](CC(C)C)[N@H+]1CCOC[C@H]1c1csc(C)n1 ZINC001173261568 1051663813 /nfs/dbraw/zinc/66/38/13/1051663813.db2.gz OYTKUTQWWGRXPS-WBVHZDCISA-N 1 2 310.507 4.430 20 0 DIADLO CCCC[C@@H](CC(C)C)[N@@H+]1CCOC[C@H]1c1csc(C)n1 ZINC001173261567 1051663908 /nfs/dbraw/zinc/66/39/08/1051663908.db2.gz OYTKUTQWWGRXPS-RDJZCZTQSA-N 1 2 310.507 4.430 20 0 DIADLO CCCC[C@@H](CC(C)C)[N@H+]1CCOC[C@H]1c1csc(C)n1 ZINC001173261567 1051663918 /nfs/dbraw/zinc/66/39/18/1051663918.db2.gz OYTKUTQWWGRXPS-RDJZCZTQSA-N 1 2 310.507 4.430 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1nnc(-c3ccccc3)s1)C2 ZINC000766770497 1051663904 /nfs/dbraw/zinc/66/39/04/1051663904.db2.gz XDHJOTYQTAHBBN-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1nnc(-c3ccccc3)s1)C2 ZINC000766770497 1051663913 /nfs/dbraw/zinc/66/39/13/1051663913.db2.gz XDHJOTYQTAHBBN-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)n1 ZINC000766795183 1051677586 /nfs/dbraw/zinc/67/75/86/1051677586.db2.gz CAOUQRDZXSZNSC-OLZOCXBDSA-N 1 2 317.285 4.248 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CCS[C@H]3CCCC[C@H]32)n1 ZINC000766795183 1051677591 /nfs/dbraw/zinc/67/75/91/1051677591.db2.gz CAOUQRDZXSZNSC-OLZOCXBDSA-N 1 2 317.285 4.248 20 0 DIADLO CCCCCC[C@@](C)(CCC)C(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000804336221 1051679369 /nfs/dbraw/zinc/67/93/69/1051679369.db2.gz HRHJUHNLQSLEHP-VQIMIIECSA-N 1 2 319.493 4.091 20 0 DIADLO CCCCCC[C@](C)(CCC)C(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000804336219 1051680052 /nfs/dbraw/zinc/68/00/52/1051680052.db2.gz HRHJUHNLQSLEHP-LPHOPBHVSA-N 1 2 319.493 4.091 20 0 DIADLO CCCc1csc(C[NH2+][C@H](c2ccccc2)c2ccncc2)n1 ZINC000494020637 1051681276 /nfs/dbraw/zinc/68/12/76/1051681276.db2.gz ZHDZAIJYKPUJHH-LJQANCHMSA-N 1 2 323.465 4.370 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1ncc(C(C)C)o1 ZINC000805833785 1051686671 /nfs/dbraw/zinc/68/66/71/1051686671.db2.gz AMIARZOIZIWNOY-HNNXBMFYSA-N 1 2 302.418 4.390 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1ncc(C(C)C)o1 ZINC000805833785 1051686682 /nfs/dbraw/zinc/68/66/82/1051686682.db2.gz AMIARZOIZIWNOY-HNNXBMFYSA-N 1 2 302.418 4.390 20 0 DIADLO CCCc1csc(C[NH2+]Cc2cc(-c3ccccc3)no2)n1 ZINC000494108104 1051693201 /nfs/dbraw/zinc/69/32/01/1051693201.db2.gz OBBQRZQQCZKCQR-UHFFFAOYSA-N 1 2 313.426 4.040 20 0 DIADLO Cc1ccc2ccccc2c1C[NH2+][C@H](C(=O)OC(C)C)C(C)C ZINC001170491650 1051699733 /nfs/dbraw/zinc/69/97/33/1051699733.db2.gz WVHNCSZRUXDAFM-IBGZPJMESA-N 1 2 313.441 4.214 20 0 DIADLO CC(C)Cn1ncnc1C[NH2+][C@@H](c1ccccc1Cl)C(C)C ZINC000183107178 1051707297 /nfs/dbraw/zinc/70/72/97/1051707297.db2.gz ONUOFEBPDBIOJP-QGZVFWFLSA-N 1 2 320.868 4.074 20 0 DIADLO c1ccc([C@@H]2C[C@H]2Nc2cc[nH+]c(OCc3ccccn3)c2)cc1 ZINC001169816126 1051707547 /nfs/dbraw/zinc/70/75/47/1051707547.db2.gz KEFXWGFTCAFGIX-RBUKOAKNSA-N 1 2 317.392 4.024 20 0 DIADLO CSc1cc(NCc2ccc(-c3ccccn3)cc2)nc(C)[nH+]1 ZINC001169888258 1051717224 /nfs/dbraw/zinc/71/72/24/1051717224.db2.gz OEQQHFHJCFVWAW-UHFFFAOYSA-N 1 2 322.437 4.181 20 0 DIADLO CCC[N@H+](Cc1cc(Cl)cc(Cl)c1)[C@H](C)C(=O)OCC ZINC001169933813 1051729277 /nfs/dbraw/zinc/72/92/77/1051729277.db2.gz SDCRUFGYCMXICK-LLVKDONJSA-N 1 2 318.244 4.157 20 0 DIADLO CCC[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@H](C)C(=O)OCC ZINC001169933813 1051729289 /nfs/dbraw/zinc/72/92/89/1051729289.db2.gz SDCRUFGYCMXICK-LLVKDONJSA-N 1 2 318.244 4.157 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H]2CCc3nc(Cl)ccc32)cs1 ZINC000806139020 1051740304 /nfs/dbraw/zinc/74/03/04/1051740304.db2.gz HDGOCQDBMXTDAV-MWLCHTKSSA-N 1 2 307.850 4.092 20 0 DIADLO C[C@H]([NH2+]Cc1csnn1)c1ccc(Cl)c2ccccc21 ZINC000184969241 1051750350 /nfs/dbraw/zinc/75/03/50/1051750350.db2.gz QSCZKXCTVHGDTP-JTQLQIEISA-N 1 2 303.818 4.196 20 0 DIADLO CCN(CC)c1ccc(N[C@H]2CCc3nc(Cl)ccc32)c[nH+]1 ZINC000806154138 1051757125 /nfs/dbraw/zinc/75/71/25/1051757125.db2.gz BJMXKGQHNMNVHU-AWEZNQCLSA-N 1 2 316.836 4.076 20 0 DIADLO O[C@H](CNc1cc[nH+]c2c(Cl)cccc12)c1ccc(F)cc1 ZINC000804347439 1051767683 /nfs/dbraw/zinc/76/76/83/1051767683.db2.gz KZXNQLURXNVZLE-MRXNPFEDSA-N 1 2 316.763 4.173 20 0 DIADLO Cc1cc(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)c(C)o1 ZINC000767390976 1051802864 /nfs/dbraw/zinc/80/28/64/1051802864.db2.gz QUHRCVBVAIDHPI-UHFFFAOYSA-N 1 2 301.777 4.348 20 0 DIADLO Cc1cc(C)c(C(=O)NCCc2cc3ccccc3s2)c(C)[nH+]1 ZINC001129365299 1051803020 /nfs/dbraw/zinc/80/30/20/1051803020.db2.gz BXXHWHGFTAHORZ-UHFFFAOYSA-N 1 2 324.449 4.194 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCC[C@H](O)c3ccccc3)c2c1 ZINC000806582149 1051814683 /nfs/dbraw/zinc/81/46/83/1051814683.db2.gz KDGFFHXVPGVZFM-IBGZPJMESA-N 1 2 323.392 4.054 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cncc(OCC4CC4)c3)ccc12 ZINC001216599285 1051834774 /nfs/dbraw/zinc/83/47/74/1051834774.db2.gz FSSUGENPCFHBBC-UHFFFAOYSA-N 1 2 305.381 4.471 20 0 DIADLO CCCc1cccc(C[NH2+][C@H](c2nc(C3CC3)no2)C(C)C)c1 ZINC000187239638 1051841210 /nfs/dbraw/zinc/84/12/10/1051841210.db2.gz YYYWLLVCAQJWKW-KRWDZBQOSA-N 1 2 313.445 4.386 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cccc(C(F)(F)F)c1OC ZINC001216632793 1051843087 /nfs/dbraw/zinc/84/30/87/1051843087.db2.gz CETDYHMGNAVEAU-UHFFFAOYSA-N 1 2 312.291 4.251 20 0 DIADLO Cc1noc2ccc(Nc3ccc[nH+]c3N3CCCCC3)cc12 ZINC001216638068 1051846653 /nfs/dbraw/zinc/84/66/53/1051846653.db2.gz YNALCJOBYXZVOD-UHFFFAOYSA-N 1 2 308.385 4.265 20 0 DIADLO CCCCC[C@@H]1CCC[N@@H+]1Cn1nc(C2CC2)n(CC)c1=S ZINC000767760294 1051848128 /nfs/dbraw/zinc/84/81/28/1051848128.db2.gz AMGIIKZFXOZJAQ-OAHLLOKOSA-N 1 2 322.522 4.314 20 0 DIADLO CCCCC[C@@H]1CCC[N@H+]1Cn1nc(C2CC2)n(CC)c1=S ZINC000767760294 1051848138 /nfs/dbraw/zinc/84/81/38/1051848138.db2.gz AMGIIKZFXOZJAQ-OAHLLOKOSA-N 1 2 322.522 4.314 20 0 DIADLO S=c1n(C2CC2)cnn1C[N@@H+]1CCC[C@H]1CCC1CCCC1 ZINC000767754509 1051849512 /nfs/dbraw/zinc/84/95/12/1051849512.db2.gz PYPFSBSYSTUAPO-HNNXBMFYSA-N 1 2 320.506 4.141 20 0 DIADLO S=c1n(C2CC2)cnn1C[N@H+]1CCC[C@H]1CCC1CCCC1 ZINC000767754509 1051849524 /nfs/dbraw/zinc/84/95/24/1051849524.db2.gz PYPFSBSYSTUAPO-HNNXBMFYSA-N 1 2 320.506 4.141 20 0 DIADLO Cc1noc2ccc(Nc3cccc(Cn4cc[nH+]c4)c3)cc12 ZINC001216641955 1051850722 /nfs/dbraw/zinc/85/07/22/1051850722.db2.gz KODUNKQPUUFQIL-UHFFFAOYSA-N 1 2 304.353 4.125 20 0 DIADLO C[C@H]1C[N@H+](Cc2nnc(-c3cccc(F)c3)o2)[C@H]1c1ccccc1 ZINC000746490161 1051850843 /nfs/dbraw/zinc/85/08/43/1051850843.db2.gz QZRVYALFKVPBEM-SCLBCKFNSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nnc(-c3cccc(F)c3)o2)[C@H]1c1ccccc1 ZINC000746490161 1051850853 /nfs/dbraw/zinc/85/08/53/1051850853.db2.gz QZRVYALFKVPBEM-SCLBCKFNSA-N 1 2 323.371 4.069 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccccc2C(F)(F)F)nn1C ZINC000767893435 1051860182 /nfs/dbraw/zinc/86/01/82/1051860182.db2.gz NRWMZFSRVATQRX-MRXNPFEDSA-N 1 2 323.362 4.084 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2C(F)(F)F)nn1C ZINC000767893435 1051860189 /nfs/dbraw/zinc/86/01/89/1051860189.db2.gz NRWMZFSRVATQRX-MRXNPFEDSA-N 1 2 323.362 4.084 20 0 DIADLO CN(C)c1cc(CSCc2ccc(OC(F)F)cc2)cc[nH+]1 ZINC000767872557 1051861090 /nfs/dbraw/zinc/86/10/90/1051861090.db2.gz YJBWFAGKTLHFHD-UHFFFAOYSA-N 1 2 324.396 4.182 20 0 DIADLO CCc1cccc(-c2noc(-c3ccccc3-n3cc[nH+]c3)n2)c1 ZINC001216757352 1051873865 /nfs/dbraw/zinc/87/38/65/1051873865.db2.gz SGGMTXRTPVYJNA-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@H](C)c1ccccc1F)c1ccco1 ZINC000152562603 1051881702 /nfs/dbraw/zinc/88/17/02/1051881702.db2.gz YYXIQDCFHMEWCE-PBHICJAKSA-N 1 2 305.393 4.483 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1cn2cc(Cl)ccc2n1 ZINC000189195741 1051889183 /nfs/dbraw/zinc/88/91/83/1051889183.db2.gz SEZJLEMCGRUERF-UHFFFAOYSA-N 1 2 324.186 4.070 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)Cc1coc(C2CC2)n1 ZINC000768207332 1051896566 /nfs/dbraw/zinc/89/65/66/1051896566.db2.gz DHUPBYTUYXOWCR-UHFFFAOYSA-N 1 2 310.397 4.493 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)Cc1coc(C2CC2)n1 ZINC000768207332 1051896579 /nfs/dbraw/zinc/89/65/79/1051896579.db2.gz DHUPBYTUYXOWCR-UHFFFAOYSA-N 1 2 310.397 4.493 20 0 DIADLO FC(F)SCc1ccc(C[N@@H+]2CCc3sccc3C2)o1 ZINC000768234931 1051907410 /nfs/dbraw/zinc/90/74/10/1051907410.db2.gz SGTOPFXCLDVPAT-UHFFFAOYSA-N 1 2 315.410 4.355 20 0 DIADLO FC(F)SCc1ccc(C[N@H+]2CCc3sccc3C2)o1 ZINC000768234931 1051907417 /nfs/dbraw/zinc/90/74/17/1051907417.db2.gz SGTOPFXCLDVPAT-UHFFFAOYSA-N 1 2 315.410 4.355 20 0 DIADLO Cc1cc(C[N@@H+]2CCSC[C@H]2c2ccccc2)cnc1Cl ZINC000768249629 1051910311 /nfs/dbraw/zinc/91/03/11/1051910311.db2.gz WZCRWJXOMBDFNA-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(C[N@H+]2CCSC[C@H]2c2ccccc2)cnc1Cl ZINC000768249629 1051910326 /nfs/dbraw/zinc/91/03/26/1051910326.db2.gz WZCRWJXOMBDFNA-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCc3cnc(Cl)s3)c2c1 ZINC000768291233 1051914177 /nfs/dbraw/zinc/91/41/77/1051914177.db2.gz KIFKGEGLBAXTED-UHFFFAOYSA-N 1 2 320.801 4.241 20 0 DIADLO C=Cc1cccc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)c1 ZINC001216973169 1051921538 /nfs/dbraw/zinc/92/15/38/1051921538.db2.gz STFLHOYRJITWLG-UHFFFAOYSA-N 1 2 314.348 4.232 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)c(C)o1 ZINC000768374752 1051924698 /nfs/dbraw/zinc/92/46/98/1051924698.db2.gz KJXGCGFFQOYZTL-KRWDZBQOSA-N 1 2 305.805 4.123 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)c(C)o1 ZINC000768374752 1051924713 /nfs/dbraw/zinc/92/47/13/1051924713.db2.gz KJXGCGFFQOYZTL-KRWDZBQOSA-N 1 2 305.805 4.123 20 0 DIADLO c1ccc2ncc(Nc3ccc[nH+]c3N3CCCCC3)cc2c1 ZINC001174001555 1051925850 /nfs/dbraw/zinc/92/58/50/1051925850.db2.gz XVDMQTULYCEQFS-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO Cc1ccccc1-c1noc(-c2ccc(-c3c[nH+]cn3C)cc2)n1 ZINC001217010118 1051929925 /nfs/dbraw/zinc/92/99/25/1051929925.db2.gz KEKCOPXYFLCSPW-UHFFFAOYSA-N 1 2 316.364 4.113 20 0 DIADLO Cc1ccc(-c2noc(-c3cccc(-c4c[nH+]cn4C)c3)n2)cc1 ZINC001217018929 1051931202 /nfs/dbraw/zinc/93/12/02/1051931202.db2.gz CSLFRMONEDMFFW-UHFFFAOYSA-N 1 2 316.364 4.113 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cccn2CCC(C)C)no1 ZINC000768437975 1051932015 /nfs/dbraw/zinc/93/20/15/1051932015.db2.gz MCIAPRZHVJOXFY-SFHVURJKSA-N 1 2 301.434 4.168 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cccn2CCC(C)C)no1 ZINC000768437975 1051932022 /nfs/dbraw/zinc/93/20/22/1051932022.db2.gz MCIAPRZHVJOXFY-SFHVURJKSA-N 1 2 301.434 4.168 20 0 DIADLO CC[N@H+](Cc1coc(C2CC2)n1)[C@H](C)c1cccc(OC)c1 ZINC000768520128 1051943651 /nfs/dbraw/zinc/94/36/51/1051943651.db2.gz YZDZUTOSECBYAA-CYBMUJFWSA-N 1 2 300.402 4.144 20 0 DIADLO CC[N@@H+](Cc1coc(C2CC2)n1)[C@H](C)c1cccc(OC)c1 ZINC000768520128 1051943661 /nfs/dbraw/zinc/94/36/61/1051943661.db2.gz YZDZUTOSECBYAA-CYBMUJFWSA-N 1 2 300.402 4.144 20 0 DIADLO CC(C)c1ccccc1Nc1ccccc1C[NH+]1CCOCC1 ZINC001174046594 1051965447 /nfs/dbraw/zinc/96/54/47/1051965447.db2.gz AAEQPCYGGSTLSE-UHFFFAOYSA-N 1 2 310.441 4.386 20 0 DIADLO Cn1ccc2cc(Nc3ccc[nH+]c3N3CCCCC3)ccc21 ZINC001174096756 1051971242 /nfs/dbraw/zinc/97/12/42/1051971242.db2.gz MRGGJCWBBVSGCA-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO Cn1ccc2cc(Nc3[nH+]cccc3N3CCCCC3)ccc21 ZINC001174097415 1051971987 /nfs/dbraw/zinc/97/19/87/1051971987.db2.gz PRCFHJUPBCKDFV-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO Cn1ccc2cc(Nc3cccc(Cn4cc[nH+]c4)c3)ccc21 ZINC001174098052 1051972726 /nfs/dbraw/zinc/97/27/26/1051972726.db2.gz DRHLVDFCTRWJJD-UHFFFAOYSA-N 1 2 302.381 4.167 20 0 DIADLO Cn1ccc2cc(Nc3ccc(Cn4cc[nH+]c4)cc3)ccc21 ZINC001174097988 1051972779 /nfs/dbraw/zinc/97/27/79/1051972779.db2.gz AKDNJIIXZLNEOO-UHFFFAOYSA-N 1 2 302.381 4.167 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2CCOc3ccccc3[C@@H]2C)s1 ZINC000768930177 1051980849 /nfs/dbraw/zinc/98/08/49/1051980849.db2.gz LZYIAAHNVSUEFL-ZDUSSCGKSA-N 1 2 302.443 4.222 20 0 DIADLO CC(C)c1ncc(C[N@H+]2CCOc3ccccc3[C@@H]2C)s1 ZINC000768930177 1051980855 /nfs/dbraw/zinc/98/08/55/1051980855.db2.gz LZYIAAHNVSUEFL-ZDUSSCGKSA-N 1 2 302.443 4.222 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)C2CCC(C)(C)CC2)n1 ZINC000768971953 1051985811 /nfs/dbraw/zinc/98/58/11/1051985811.db2.gz KAZWJGMVKZWALB-UHFFFAOYSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1cnc(=S)n(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)c1 ZINC000808225268 1051987645 /nfs/dbraw/zinc/98/76/45/1051987645.db2.gz ZTMSJOIXOSEBOO-ZDUSSCGKSA-N 1 2 305.472 4.023 20 0 DIADLO Cc1cnc(=S)n(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)c1 ZINC000808225268 1051987656 /nfs/dbraw/zinc/98/76/56/1051987656.db2.gz ZTMSJOIXOSEBOO-ZDUSSCGKSA-N 1 2 305.472 4.023 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(C(=O)N3CCCC3)cc2)cc1 ZINC001174070914 1051992011 /nfs/dbraw/zinc/99/20/11/1051992011.db2.gz XTYIUXYBLYFDND-UHFFFAOYSA-N 1 2 323.440 4.122 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(C(=O)N3CCCC3)cc2)cc1 ZINC001174070914 1051992026 /nfs/dbraw/zinc/99/20/26/1051992026.db2.gz XTYIUXYBLYFDND-UHFFFAOYSA-N 1 2 323.440 4.122 20 0 DIADLO c1sc(C2CCCC2)nc1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000494652568 1051992467 /nfs/dbraw/zinc/99/24/67/1051992467.db2.gz IVQMKGKBHAXCHT-KRWDZBQOSA-N 1 2 320.502 4.192 20 0 DIADLO c1sc(C2CCCC2)nc1C[N@@H+]1CCC[C@H](OCC2CC2)C1 ZINC000494652568 1051992485 /nfs/dbraw/zinc/99/24/85/1051992485.db2.gz IVQMKGKBHAXCHT-KRWDZBQOSA-N 1 2 320.502 4.192 20 0 DIADLO CC[C@](C)([NH2+]Cc1cc(OC)ccc1Cl)c1nccs1 ZINC000192109318 1051996944 /nfs/dbraw/zinc/99/69/44/1051996944.db2.gz ZTKVBENDOMFAIJ-HNNXBMFYSA-N 1 2 310.850 4.220 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cc(OC)ccc1Cl)c1nccs1 ZINC000192109324 1051997478 /nfs/dbraw/zinc/99/74/78/1051997478.db2.gz ZTKVBENDOMFAIJ-OAHLLOKOSA-N 1 2 310.850 4.220 20 0 DIADLO Cc1nnsc1[C@H](C)[NH+]1CCC(=Cc2ccccc2F)CC1 ZINC000929828641 1052005817 /nfs/dbraw/zinc/00/58/17/1052005817.db2.gz YXUCOAXHRVNTIY-ZDUSSCGKSA-N 1 2 317.433 4.226 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)C1(C)CCCCCC1 ZINC000192245697 1052007181 /nfs/dbraw/zinc/00/71/81/1052007181.db2.gz AMSXLKVOYQEEHM-UHFFFAOYSA-N 1 2 319.493 4.045 20 0 DIADLO Cc1ccc(-c2n[nH]cc2CNc2ccc([NH+]3CCCC3)cc2)o1 ZINC000324357228 1052024845 /nfs/dbraw/zinc/02/48/45/1052024845.db2.gz GYSHPNGFAJOYPD-UHFFFAOYSA-N 1 2 322.412 4.190 20 0 DIADLO CCCCNC(=O)c1ccc(Nc2cc(CCC)cc[nH+]2)cc1 ZINC001174122396 1052030724 /nfs/dbraw/zinc/03/07/24/1052030724.db2.gz HLRITSRSYKGOCY-UHFFFAOYSA-N 1 2 311.429 4.308 20 0 DIADLO Cc1cc(C)c(Nc2cccc(C(=O)N3CCCCC3)c2)c[nH+]1 ZINC001174175871 1052035282 /nfs/dbraw/zinc/03/52/82/1052035282.db2.gz VYTAOZIQBIOUHB-UHFFFAOYSA-N 1 2 309.413 4.068 20 0 DIADLO Cc1ccc[nH+]c1Nc1cccc(C(=O)NCc2ccccc2)c1 ZINC001174181915 1052035381 /nfs/dbraw/zinc/03/53/81/1052035381.db2.gz SRJPADJZNQCUBS-UHFFFAOYSA-N 1 2 317.392 4.064 20 0 DIADLO CCOc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)n1 ZINC000769428705 1052046761 /nfs/dbraw/zinc/04/67/61/1052046761.db2.gz RGTKMTJFIJXXGL-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cccc(C[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)n1 ZINC000769428705 1052046773 /nfs/dbraw/zinc/04/67/73/1052046773.db2.gz RGTKMTJFIJXXGL-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1ccccc1C[N@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000195348900 1052046895 /nfs/dbraw/zinc/04/68/95/1052046895.db2.gz PAFSTRJNBOMDII-ZDUSSCGKSA-N 1 2 312.438 4.498 20 0 DIADLO COc1ccccc1C[N@@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000195348900 1052046902 /nfs/dbraw/zinc/04/69/02/1052046902.db2.gz PAFSTRJNBOMDII-ZDUSSCGKSA-N 1 2 312.438 4.498 20 0 DIADLO CCCCCCOc1ccc(C[N@H+](C)Cc2ccon2)cc1 ZINC000769466338 1052060832 /nfs/dbraw/zinc/06/08/32/1052060832.db2.gz LXGKNVJZZWVPMJ-UHFFFAOYSA-N 1 2 302.418 4.266 20 0 DIADLO CCCCCCOc1ccc(C[N@@H+](C)Cc2ccon2)cc1 ZINC000769466338 1052060842 /nfs/dbraw/zinc/06/08/42/1052060842.db2.gz LXGKNVJZZWVPMJ-UHFFFAOYSA-N 1 2 302.418 4.266 20 0 DIADLO Cc1ccc(Nc2cc[nH+]c3cc(Br)ccc23)cn1 ZINC001174282098 1052069167 /nfs/dbraw/zinc/06/91/67/1052069167.db2.gz XNGJFOMXNFWEGH-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO COc1cccc2cc(C[N@@H+]3CCOC[C@H]3c3ccccc3)oc21 ZINC000769502895 1052069587 /nfs/dbraw/zinc/06/95/87/1052069587.db2.gz DVZVHZKJPFNWFS-SFHVURJKSA-N 1 2 323.392 4.015 20 0 DIADLO COc1cccc2cc(C[N@H+]3CCOC[C@H]3c3ccccc3)oc21 ZINC000769502895 1052069589 /nfs/dbraw/zinc/06/95/89/1052069589.db2.gz DVZVHZKJPFNWFS-SFHVURJKSA-N 1 2 323.392 4.015 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1coc(C3CC3)n1)CCC2 ZINC000769514346 1052071701 /nfs/dbraw/zinc/07/17/01/1052071701.db2.gz KXPNTDKXYZPGLG-AWEZNQCLSA-N 1 2 317.458 4.080 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1coc(C3CC3)n1)CCC2 ZINC000769514346 1052071715 /nfs/dbraw/zinc/07/17/15/1052071715.db2.gz KXPNTDKXYZPGLG-AWEZNQCLSA-N 1 2 317.458 4.080 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1coc(C3CC3)n1)CCC2 ZINC000769514348 1052071770 /nfs/dbraw/zinc/07/17/70/1052071770.db2.gz KXPNTDKXYZPGLG-CQSZACIVSA-N 1 2 317.458 4.080 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1coc(C3CC3)n1)CCC2 ZINC000769514348 1052071777 /nfs/dbraw/zinc/07/17/77/1052071777.db2.gz KXPNTDKXYZPGLG-CQSZACIVSA-N 1 2 317.458 4.080 20 0 DIADLO CCCC[C@@H](C)[C@H](C)[NH2+]c1ccc(N2CCC(O)CC2)cc1 ZINC000808709861 1052073217 /nfs/dbraw/zinc/07/32/17/1052073217.db2.gz WQABUKCPNWHKMC-CVEARBPZSA-N 1 2 304.478 4.274 20 0 DIADLO CCCC[C@H](C)[C@@H](C)[NH2+]c1ccc(N2CCC(O)CC2)cc1 ZINC000808710022 1052073427 /nfs/dbraw/zinc/07/34/27/1052073427.db2.gz WQABUKCPNWHKMC-JKSUJKDBSA-N 1 2 304.478 4.274 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cccc(-n4cccn4)c3)ccc12 ZINC001174302433 1052078588 /nfs/dbraw/zinc/07/85/88/1052078588.db2.gz FLVNKVGYZGHTMM-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H](F)c3ccccc3)c2)[nH+]c1C ZINC000769558451 1052082723 /nfs/dbraw/zinc/08/27/23/1052082723.db2.gz COTKSBGUCJGLDA-KRWDZBQOSA-N 1 2 323.371 4.343 20 0 DIADLO FC(F)(F)c1ccc(Nc2ccccc2-n2cc[nH+]c2)cn1 ZINC001174309647 1052091292 /nfs/dbraw/zinc/09/12/92/1052091292.db2.gz KQELCZIAGZQAJE-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1cc(C(F)(F)F)nn1C ZINC001174324438 1052099371 /nfs/dbraw/zinc/09/93/71/1052099371.db2.gz PDKPJPCIJPJPJW-UHFFFAOYSA-N 1 2 312.339 4.084 20 0 DIADLO CC(C)c1ccc(-c2nnc([C@@H]3Cc4ccccc4C[NH2+]3)o2)cc1 ZINC001217720215 1052124370 /nfs/dbraw/zinc/12/43/70/1052124370.db2.gz HXZUDSBNCKRDLN-SFHVURJKSA-N 1 2 319.408 4.247 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000769876983 1052126200 /nfs/dbraw/zinc/12/62/00/1052126200.db2.gz SJJNQBLUGPEMDW-LBPRGKRZSA-N 1 2 311.385 4.051 20 0 DIADLO CC(C)(C)c1ccc(-c2nnc([C@H]3[NH2+]Cc4ccccc43)o2)cc1 ZINC001217726705 1052126680 /nfs/dbraw/zinc/12/66/80/1052126680.db2.gz KKWCRZOQSRZADR-KRWDZBQOSA-N 1 2 319.408 4.227 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1[C@H](C)c2ccc(F)cc2C[C@@H]1C ZINC000769953068 1052127844 /nfs/dbraw/zinc/12/78/44/1052127844.db2.gz JMAYLDDWJIENHK-CMPLNLGQSA-N 1 2 321.827 4.029 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1[C@H](C)c2ccc(F)cc2C[C@@H]1C ZINC000769953068 1052127853 /nfs/dbraw/zinc/12/78/53/1052127853.db2.gz JMAYLDDWJIENHK-CMPLNLGQSA-N 1 2 321.827 4.029 20 0 DIADLO FC(F)(F)c1cc(Nc2cccc(Cn3cc[nH+]c3)c2)ccn1 ZINC001174361474 1052127974 /nfs/dbraw/zinc/12/79/74/1052127974.db2.gz KTBWSBRJMJTCRX-UHFFFAOYSA-N 1 2 318.302 4.089 20 0 DIADLO Cc1cccc(C2(Nc3cc4cc(F)ccc4c[nH+]3)COC2)c1 ZINC001168471842 1052138209 /nfs/dbraw/zinc/13/82/09/1052138209.db2.gz YFFUTLVMEFOCDN-UHFFFAOYSA-N 1 2 308.356 4.020 20 0 DIADLO COC(=O)c1ccsc1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174380397 1052138898 /nfs/dbraw/zinc/13/88/98/1052138898.db2.gz FIAOMPOMNVYGKI-UHFFFAOYSA-N 1 2 315.398 4.209 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4ncn(C)c4c3)ccc21 ZINC001174380927 1052139081 /nfs/dbraw/zinc/13/90/81/1052139081.db2.gz AWTXCJNNICKLMK-UHFFFAOYSA-N 1 2 305.385 4.248 20 0 DIADLO CC(=O)Nc1cccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)c1 ZINC001174380960 1052139360 /nfs/dbraw/zinc/13/93/60/1052139360.db2.gz CCNGXLQHMAESDH-UHFFFAOYSA-N 1 2 308.385 4.319 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3c(F)cnc(F)c3F)ccc21 ZINC001174381420 1052140573 /nfs/dbraw/zinc/14/05/73/1052140573.db2.gz ZZUGYJQQVQIVHZ-UHFFFAOYSA-N 1 2 306.291 4.173 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3nsc4ncccc34)ccc21 ZINC001174381647 1052140726 /nfs/dbraw/zinc/14/07/26/1052140726.db2.gz MMSSBZVHOAWZLI-UHFFFAOYSA-N 1 2 309.398 4.366 20 0 DIADLO COC(=O)Cc1ccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cc1 ZINC001174381611 1052140802 /nfs/dbraw/zinc/14/08/02/1052140802.db2.gz OUDMBHDRUZNXPD-UHFFFAOYSA-N 1 2 323.396 4.076 20 0 DIADLO Cc1cnc(Cl)c(Nc2ccc3c(c2)[nH+]cn3C(C)C)n1 ZINC001174381926 1052140835 /nfs/dbraw/zinc/14/08/35/1052140835.db2.gz SRIWKLBDBDXSPF-UHFFFAOYSA-N 1 2 301.781 4.113 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(Cl)ncc3O)ccc21 ZINC001174382302 1052141124 /nfs/dbraw/zinc/14/11/24/1052141124.db2.gz JCWUKULWASRGGE-UHFFFAOYSA-N 1 2 302.765 4.115 20 0 DIADLO Cc1cc(C)n2nc(Nc3ccc4c(c3)[nH+]cn4C(C)C)cc2n1 ZINC001174381958 1052141185 /nfs/dbraw/zinc/14/11/85/1052141185.db2.gz TVYLLFKSQFPLHR-UHFFFAOYSA-N 1 2 320.400 4.020 20 0 DIADLO COC(=O)Cc1cccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)c1 ZINC001174383644 1052143191 /nfs/dbraw/zinc/14/31/91/1052143191.db2.gz QNXJIBGIWDNYGZ-UHFFFAOYSA-N 1 2 323.396 4.076 20 0 DIADLO COc1cc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cnc1Cl ZINC001174382454 1052143280 /nfs/dbraw/zinc/14/32/80/1052143280.db2.gz QUELMECJUMFCHO-UHFFFAOYSA-N 1 2 316.792 4.418 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc(F)c(F)c3O)ccc21 ZINC001174384100 1052143537 /nfs/dbraw/zinc/14/35/37/1052143537.db2.gz FUHQRLBUGOMEIS-UHFFFAOYSA-N 1 2 303.312 4.345 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(F)c(F)cc3O)ccc21 ZINC001174382992 1052143682 /nfs/dbraw/zinc/14/36/82/1052143682.db2.gz HNBAPLCEYLHCSV-UHFFFAOYSA-N 1 2 303.312 4.345 20 0 DIADLO Cc1ccccc1[C@H](O[C@H]1C[NH2+]CC(F)(F)C1)c1ccccc1 ZINC001217855175 1052156973 /nfs/dbraw/zinc/15/69/73/1052156973.db2.gz KRLZNRPEUNTHJW-SJLPKXTDSA-N 1 2 317.379 4.098 20 0 DIADLO Fc1cc(Nc2cc[nH+]c3[nH]ccc32)cc(F)c1OC1CCC1 ZINC001174412194 1052165303 /nfs/dbraw/zinc/16/53/03/1052165303.db2.gz JIVGBMQEMOCFME-UHFFFAOYSA-N 1 2 315.323 4.468 20 0 DIADLO Cc1cc(Br)cc(Nc2cc[nH+]c3[nH]ccc32)c1 ZINC001174412561 1052165538 /nfs/dbraw/zinc/16/55/38/1052165538.db2.gz VMYUPWQHSWYDIE-UHFFFAOYSA-N 1 2 302.175 4.329 20 0 DIADLO COc1cc(Br)cc(Nc2cc[nH+]c3[nH]ccc32)c1 ZINC001174413578 1052166763 /nfs/dbraw/zinc/16/67/63/1052166763.db2.gz OIQVKXOMCHCAEQ-UHFFFAOYSA-N 1 2 318.174 4.029 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Cl)cs2)C[C@H](c2ccccc2)O1 ZINC000494955560 1052180755 /nfs/dbraw/zinc/18/07/55/1052180755.db2.gz SQLXMZMZEKYKBZ-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Cl)cs2)C[C@H](c2ccccc2)O1 ZINC000494955560 1052180762 /nfs/dbraw/zinc/18/07/62/1052180762.db2.gz SQLXMZMZEKYKBZ-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1cnc(-c3ccco3)s1)CC2 ZINC000494961331 1052183758 /nfs/dbraw/zinc/18/37/58/1052183758.db2.gz QMLWQELPUGVPIV-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1cnc(-c3ccco3)s1)CC2 ZINC000494961331 1052183767 /nfs/dbraw/zinc/18/37/67/1052183767.db2.gz QMLWQELPUGVPIV-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+](C)Cc1scnc1C ZINC000494970110 1052185857 /nfs/dbraw/zinc/18/58/57/1052185857.db2.gz CAILFJDXAMEXBH-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+](C)Cc1scnc1C ZINC000494970110 1052185864 /nfs/dbraw/zinc/18/58/64/1052185864.db2.gz CAILFJDXAMEXBH-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CC(C)[C@@H]1CCC[C@@H]([NH2+][C@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC000495045371 1052200990 /nfs/dbraw/zinc/20/09/90/1052200990.db2.gz LVDXCBMMMKWKCH-ZACQAIPSSA-N 1 2 304.482 4.231 20 0 DIADLO Cc1ccc(C(Oc2cc(N)cc[nH+]2)c2ccc(C)cc2)cc1 ZINC001218193212 1052206056 /nfs/dbraw/zinc/20/60/56/1052206056.db2.gz OLPGITKBNKMUJA-UHFFFAOYSA-N 1 2 304.393 4.449 20 0 DIADLO Nc1cc[nH+]c(O[C@H](c2ccccc2)c2ccc(Cl)cc2)c1 ZINC001218214326 1052208711 /nfs/dbraw/zinc/20/87/11/1052208711.db2.gz NPOVTZDJGGFPSM-GOSISDBHSA-N 1 2 310.784 4.486 20 0 DIADLO Cc1cc(O[C@@H]2C[NH2+]CC(F)(F)C2)cc(C)c1-c1ccccc1 ZINC001218278894 1052217242 /nfs/dbraw/zinc/21/72/42/1052217242.db2.gz QHEFEMOAMXXFHD-KRWDZBQOSA-N 1 2 317.379 4.346 20 0 DIADLO Nc1cc[nH+]c(O[C@@H](/C=C/c2ccccc2)c2ccccc2)c1 ZINC001218354775 1052230107 /nfs/dbraw/zinc/23/01/07/1052230107.db2.gz XIBZUTPFCMTBDJ-CVTTXWKISA-N 1 2 302.377 4.497 20 0 DIADLO Nc1cc[nH+]c(O[C@@H](c2ccccc2)c2ccccc2Cl)c1 ZINC001218371749 1052232208 /nfs/dbraw/zinc/23/22/08/1052232208.db2.gz MHRNFQSTUOAQOH-SFHVURJKSA-N 1 2 310.784 4.486 20 0 DIADLO Cc1nn(C[N@@H+]2CCC[C@@H]2c2cc(C)ccc2C)c(=S)s1 ZINC000761830893 1052242096 /nfs/dbraw/zinc/24/20/96/1052242096.db2.gz LCZGMKPKVMPXIY-OAHLLOKOSA-N 1 2 319.499 4.394 20 0 DIADLO Cc1nn(C[N@H+]2CCC[C@@H]2c2cc(C)ccc2C)c(=S)s1 ZINC000761830893 1052242107 /nfs/dbraw/zinc/24/21/07/1052242107.db2.gz LCZGMKPKVMPXIY-OAHLLOKOSA-N 1 2 319.499 4.394 20 0 DIADLO Nc1[nH+]cccc1O[C@@H]1CCN(c2ccccc2)c2ccccc21 ZINC001218490612 1052250177 /nfs/dbraw/zinc/25/01/77/1052250177.db2.gz MWLDABFNHMRSLD-GOSISDBHSA-N 1 2 317.392 4.326 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C)CC2CCCCC2)c(C)[nH+]1 ZINC001219009959 1052267638 /nfs/dbraw/zinc/26/76/38/1052267638.db2.gz UUBIYRGDBZWNRS-AWEZNQCLSA-N 1 2 303.450 4.487 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ccc(F)c(F)c2)C2CC2)c(F)c1 ZINC000613464511 1052309454 /nfs/dbraw/zinc/30/94/54/1052309454.db2.gz BNXGVRQDJREQGT-UHFFFAOYSA-N 1 2 309.306 4.408 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ccc(F)c(F)c2)C2CC2)c(F)c1 ZINC000613464511 1052309463 /nfs/dbraw/zinc/30/94/63/1052309463.db2.gz BNXGVRQDJREQGT-UHFFFAOYSA-N 1 2 309.306 4.408 20 0 DIADLO Cc1cccc(N(C)C(=O)Nc2cc[nH+]c(N3CCCCC3)c2)c1 ZINC001220194700 1052323300 /nfs/dbraw/zinc/32/33/00/1052323300.db2.gz BQYHBFQYEAZCCO-UHFFFAOYSA-N 1 2 324.428 4.049 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc([NH+](C)C)cc2C)c(F)c1 ZINC000315472715 1052337702 /nfs/dbraw/zinc/33/77/02/1052337702.db2.gz OYOJAYXDRJFYLS-ZDUSSCGKSA-N 1 2 302.393 4.382 20 0 DIADLO COc1cccc(C(F)(F)F)c1CNc1c[nH+]c(C)c(C)c1 ZINC001168488984 1052364505 /nfs/dbraw/zinc/36/45/05/1052364505.db2.gz DCKGJZNRBZLTPP-UHFFFAOYSA-N 1 2 310.319 4.338 20 0 DIADLO CC(C)[C@@H](C)[N@H+](C)Cn1[nH]c(-c2ccc(Cl)cc2)nc1=S ZINC000915207997 1052367362 /nfs/dbraw/zinc/36/73/62/1052367362.db2.gz AVGKWGAYVNITHS-LLVKDONJSA-N 1 2 324.881 4.195 20 0 DIADLO CC(C)[C@@H](C)[N@@H+](C)Cn1[nH]c(-c2ccc(Cl)cc2)nc1=S ZINC000915207997 1052367369 /nfs/dbraw/zinc/36/73/69/1052367369.db2.gz AVGKWGAYVNITHS-LLVKDONJSA-N 1 2 324.881 4.195 20 0 DIADLO Cc1cc(N[C@@H](c2ccccn2)C(F)(F)F)ccc1[NH+](C)C ZINC001168489144 1052368454 /nfs/dbraw/zinc/36/84/54/1052368454.db2.gz DTWOVQSYVPMZOE-HNNXBMFYSA-N 1 2 309.335 4.172 20 0 DIADLO CNc1ccc(Nc2c(C)cnn2-c2ccccc2Cl)c[nH+]1 ZINC001203451825 1052373242 /nfs/dbraw/zinc/37/32/42/1052373242.db2.gz DPPMGBDMYRONHA-UHFFFAOYSA-N 1 2 313.792 4.014 20 0 DIADLO O=c1c2ccccc2sn1C[N@@H+]1CCCC[C@H]1c1ccccc1 ZINC000762469596 1052387999 /nfs/dbraw/zinc/38/79/99/1052387999.db2.gz YMNMOMJSZMOVLO-KRWDZBQOSA-N 1 2 324.449 4.248 20 0 DIADLO O=c1c2ccccc2sn1C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000762469596 1052388004 /nfs/dbraw/zinc/38/80/04/1052388004.db2.gz YMNMOMJSZMOVLO-KRWDZBQOSA-N 1 2 324.449 4.248 20 0 DIADLO CC1(C)C[NH+](Cc2cc3ccccc3nc2Cl)CC(C)(C)O1 ZINC000317940400 1052398530 /nfs/dbraw/zinc/39/85/30/1052398530.db2.gz NMLITGSOCHQLCO-UHFFFAOYSA-N 1 2 318.848 4.278 20 0 DIADLO CCOc1ccc(Nc2ccc([N@H+](C)CC)cc2)c(OC)c1 ZINC001213121138 1052412151 /nfs/dbraw/zinc/41/21/51/1052412151.db2.gz RBMSIHUXLJVSEG-UHFFFAOYSA-N 1 2 300.402 4.294 20 0 DIADLO CCOc1ccc(Nc2ccc([N@@H+](C)CC)cc2)c(OC)c1 ZINC001213121138 1052412154 /nfs/dbraw/zinc/41/21/54/1052412154.db2.gz RBMSIHUXLJVSEG-UHFFFAOYSA-N 1 2 300.402 4.294 20 0 DIADLO FC(F)(F)c1cccc(CNc2ccc(N3CCCC3)[nH+]c2)c1 ZINC000237678321 1052444215 /nfs/dbraw/zinc/44/42/15/1052444215.db2.gz NVBKBPUAKVLZNB-UHFFFAOYSA-N 1 2 321.346 4.313 20 0 DIADLO Cc1ccc2cccc(NC3CCN(c4cccc[nH+]4)CC3)c2n1 ZINC000237821676 1052445484 /nfs/dbraw/zinc/44/54/84/1052445484.db2.gz KSGWSWZMLGXYDH-UHFFFAOYSA-N 1 2 318.424 4.019 20 0 DIADLO Clc1ccc([C@H](OCCn2cc[nH+]c2)c2ccccc2)cc1 ZINC001222135124 1052448628 /nfs/dbraw/zinc/44/86/28/1052448628.db2.gz WDZYVACTMMYSCR-GOSISDBHSA-N 1 2 312.800 4.343 20 0 DIADLO COc1ccc2cc(CC[C@H](C)OCCn3cc[nH+]c3)ccc2c1 ZINC001222138871 1052449470 /nfs/dbraw/zinc/44/94/70/1052449470.db2.gz LCMVAWFRFJYGLO-INIZCTEOSA-N 1 2 324.424 4.083 20 0 DIADLO CCCCOc1ccc(-c2ccn3cc(N)[nH+]c3c2)c(F)c1F ZINC001222207006 1052461893 /nfs/dbraw/zinc/46/18/93/1052461893.db2.gz YSPDQIKKOVXOIN-UHFFFAOYSA-N 1 2 317.339 4.041 20 0 DIADLO Clc1cccc2c1CN(Cc1c[nH+]cn1Cc1ccccc1)C2 ZINC000347447186 1052477976 /nfs/dbraw/zinc/47/79/76/1052477976.db2.gz HYUREVSTPGKEJP-UHFFFAOYSA-N 1 2 323.827 4.101 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)Cc1ccc(C(F)(F)F)s1 ZINC000762974302 1052482874 /nfs/dbraw/zinc/48/28/74/1052482874.db2.gz OILUNDPZGSXARD-UHFFFAOYSA-N 1 2 304.337 4.004 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)Cc1ccc(C(F)(F)F)s1 ZINC000762974302 1052482881 /nfs/dbraw/zinc/48/28/81/1052482881.db2.gz OILUNDPZGSXARD-UHFFFAOYSA-N 1 2 304.337 4.004 20 0 DIADLO COc1c(F)c(C)ccc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001222323286 1052482940 /nfs/dbraw/zinc/48/29/40/1052482940.db2.gz RNQPJBZNRVJBCR-UHFFFAOYSA-N 1 2 309.331 4.150 20 0 DIADLO CC[N@H+](CC(=O)Nc1ccccc1C)Cc1ccc(Cl)s1 ZINC000018936084 1052484688 /nfs/dbraw/zinc/48/46/88/1052484688.db2.gz SCTHJPOJXAIFGX-UHFFFAOYSA-N 1 2 322.861 4.171 20 0 DIADLO CC[N@@H+](CC(=O)Nc1ccccc1C)Cc1ccc(Cl)s1 ZINC000018936084 1052484696 /nfs/dbraw/zinc/48/46/96/1052484696.db2.gz SCTHJPOJXAIFGX-UHFFFAOYSA-N 1 2 322.861 4.171 20 0 DIADLO Cc1cc(-c2ccc(Cl)c(Cl)c2)c[nH+]c1N1CCOCC1 ZINC001222352994 1052489830 /nfs/dbraw/zinc/48/98/30/1052489830.db2.gz XAEOULBXSABXGZ-UHFFFAOYSA-N 1 2 323.223 4.200 20 0 DIADLO Cn1c[nH+]cc1CO[C@H](c1ccccc1)c1ccccc1Cl ZINC001222600442 1052516429 /nfs/dbraw/zinc/51/64/29/1052516429.db2.gz PHXWOSUTDONFIY-GOSISDBHSA-N 1 2 312.800 4.380 20 0 DIADLO COc1ccc2cc(CC[C@@H](C)OCc3c[nH+]cn3C)ccc2c1 ZINC001222600671 1052516798 /nfs/dbraw/zinc/51/67/98/1052516798.db2.gz UFQSGUWWHLSPBM-OAHLLOKOSA-N 1 2 324.424 4.120 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2csc(-c3ccco3)n2)c1 ZINC000055472220 1052532013 /nfs/dbraw/zinc/53/20/13/1052532013.db2.gz MXQPTJUESWSFHE-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2csc(-c3ccco3)n2)c1 ZINC000055472220 1052532023 /nfs/dbraw/zinc/53/20/23/1052532023.db2.gz MXQPTJUESWSFHE-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO C[C@H]([NH2+]C1CC(c2cccc(Cl)c2)C1)C(=O)OC1CCCC1 ZINC000763286628 1052555559 /nfs/dbraw/zinc/55/55/59/1052555559.db2.gz CTKXUCXIRABDEG-YGONEPDPSA-N 1 2 321.848 4.050 20 0 DIADLO Cc1ccc(-c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)c(F)c1 ZINC000763312944 1052561455 /nfs/dbraw/zinc/56/14/55/1052561455.db2.gz OVPXZWFALFCHJO-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO S=c1sc(-c2ccccc2)nn1C[N@@H+]1CC[C@@H](C2CC2)C1 ZINC000763334743 1052565107 /nfs/dbraw/zinc/56/51/07/1052565107.db2.gz UYXOQOILZWWSSJ-CQSZACIVSA-N 1 2 317.483 4.030 20 0 DIADLO S=c1sc(-c2ccccc2)nn1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000763334743 1052565113 /nfs/dbraw/zinc/56/51/13/1052565113.db2.gz UYXOQOILZWWSSJ-CQSZACIVSA-N 1 2 317.483 4.030 20 0 DIADLO CCC(NC(=O)Nc1c(C)cc(C)[nH+]c1C)(C1CC1)C1CC1 ZINC000529104330 1052593603 /nfs/dbraw/zinc/59/36/03/1052593603.db2.gz PFPFOKHJGFQBHF-UHFFFAOYSA-N 1 2 301.434 4.097 20 0 DIADLO Cc1cc(CO[C@H]2CCCc3c(Cl)ccnc32)cc(C)[nH+]1 ZINC001223424354 1052600445 /nfs/dbraw/zinc/60/04/45/1052600445.db2.gz LCVFSDVOCKWHKD-INIZCTEOSA-N 1 2 302.805 4.341 20 0 DIADLO CC[C@@H]1CCCC[C@H]1OC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000916293975 1052601302 /nfs/dbraw/zinc/60/13/02/1052601302.db2.gz QIGTVFJTTKZDOY-SJLPKXTDSA-N 1 2 312.413 4.057 20 0 DIADLO CC[C@H]1CCCC[C@H]1OC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000916293974 1052601545 /nfs/dbraw/zinc/60/15/45/1052601545.db2.gz QIGTVFJTTKZDOY-FUHWJXTLSA-N 1 2 312.413 4.057 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCC[C@@H]2c2ccc(C(C)C)cc2)o1 ZINC000125894980 1052656331 /nfs/dbraw/zinc/65/63/31/1052656331.db2.gz TUADPCCACZECOG-QGZVFWFLSA-N 1 2 313.445 4.483 20 0 DIADLO CCc1nnc(C[N@H+]2CCCC[C@@H]2c2ccc(C(C)C)cc2)o1 ZINC000125894980 1052656335 /nfs/dbraw/zinc/65/63/35/1052656335.db2.gz TUADPCCACZECOG-QGZVFWFLSA-N 1 2 313.445 4.483 20 0 DIADLO C[N@H+](C/C=C/c1ccccc1)Cc1ccn(-c2ccccc2)n1 ZINC000917068286 1052690771 /nfs/dbraw/zinc/69/07/71/1052690771.db2.gz QJRUBUQDHBPMTD-DHZHZOJOSA-N 1 2 303.409 4.018 20 0 DIADLO C[N@@H+](C/C=C/c1ccccc1)Cc1ccn(-c2ccccc2)n1 ZINC000917068286 1052690773 /nfs/dbraw/zinc/69/07/73/1052690773.db2.gz QJRUBUQDHBPMTD-DHZHZOJOSA-N 1 2 303.409 4.018 20 0 DIADLO Cl/C=C\C[N@@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000917086889 1052697565 /nfs/dbraw/zinc/69/75/65/1052697565.db2.gz LMACNDJWZALAOE-ZUNOPDERSA-N 1 2 300.627 4.339 20 0 DIADLO Cl/C=C\C[N@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000917086889 1052697568 /nfs/dbraw/zinc/69/75/68/1052697568.db2.gz LMACNDJWZALAOE-ZUNOPDERSA-N 1 2 300.627 4.339 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2cc[nH]n2)c2ccsc2)cc1 ZINC000066990577 1052699200 /nfs/dbraw/zinc/69/92/00/1052699200.db2.gz PIUCKDWHBPWNQK-OAHLLOKOSA-N 1 2 303.818 4.004 20 0 DIADLO CCCc1noc(C[N@H+](CC)[C@H](C)c2cc3ccccc3o2)n1 ZINC000067458252 1052704230 /nfs/dbraw/zinc/70/42/30/1052704230.db2.gz VQLHMNGWDQVUIQ-CYBMUJFWSA-N 1 2 313.401 4.351 20 0 DIADLO CCCc1noc(C[N@@H+](CC)[C@H](C)c2cc3ccccc3o2)n1 ZINC000067458252 1052704233 /nfs/dbraw/zinc/70/42/33/1052704233.db2.gz VQLHMNGWDQVUIQ-CYBMUJFWSA-N 1 2 313.401 4.351 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000128001698 1052707112 /nfs/dbraw/zinc/70/71/12/1052707112.db2.gz CIUTWYWEEWIHEP-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000128001698 1052707115 /nfs/dbraw/zinc/70/71/15/1052707115.db2.gz CIUTWYWEEWIHEP-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO Clc1ccccc1O[C@H]1CC[N@@H+](Cc2ccncc2Cl)C1 ZINC000128297506 1052714592 /nfs/dbraw/zinc/71/45/92/1052714592.db2.gz HXIATCJADXUREM-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccccc1O[C@H]1CC[N@H+](Cc2ccncc2Cl)C1 ZINC000128297506 1052714596 /nfs/dbraw/zinc/71/45/96/1052714596.db2.gz HXIATCJADXUREM-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccccc1O[C@@H]1CC[N@@H+](Cc2ccncc2Cl)C1 ZINC000128297274 1052714897 /nfs/dbraw/zinc/71/48/97/1052714897.db2.gz HXIATCJADXUREM-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccccc1O[C@@H]1CC[N@H+](Cc2ccncc2Cl)C1 ZINC000128297274 1052714903 /nfs/dbraw/zinc/71/49/03/1052714903.db2.gz HXIATCJADXUREM-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1ccc2c(c1)CCCC2 ZINC000154343533 1052719516 /nfs/dbraw/zinc/71/95/16/1052719516.db2.gz BUOOYDYKEBTCKM-ZDUSSCGKSA-N 1 2 313.445 4.097 20 0 DIADLO CCOC(=[NH2+])CCCCO[C@@H](c1ccccc1)C1CCOCC1 ZINC001224965537 1052739385 /nfs/dbraw/zinc/73/93/85/1052739385.db2.gz KLUOVGXFWIMFRM-IBGZPJMESA-N 1 2 319.445 4.355 20 0 DIADLO O=C(c1ccsc1)[C@@H](Oc1cc[nH+]cc1)c1ccsc1 ZINC001225291715 1052769313 /nfs/dbraw/zinc/76/93/13/1052769313.db2.gz WYMQHEVZKIJVGE-HNNXBMFYSA-N 1 2 301.392 4.208 20 0 DIADLO O=C(c1cccs1)[C@@H](Oc1cc[nH+]cc1)c1cccs1 ZINC001225290662 1052769795 /nfs/dbraw/zinc/76/97/95/1052769795.db2.gz FFMXLWQDDWAIPR-HNNXBMFYSA-N 1 2 301.392 4.208 20 0 DIADLO O=C(c1cccs1)[C@H](Oc1cc[nH+]cc1)c1cccs1 ZINC001225290663 1052769803 /nfs/dbraw/zinc/76/98/03/1052769803.db2.gz FFMXLWQDDWAIPR-OAHLLOKOSA-N 1 2 301.392 4.208 20 0 DIADLO Cc1nccnc1C[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1F ZINC000699949073 1052775687 /nfs/dbraw/zinc/77/56/87/1052775687.db2.gz ZEJFZONBYBBISE-MRVPVSSYSA-N 1 2 314.191 4.082 20 0 DIADLO O=C(/C=C\c1ccc(Cl)cc1)Nc1ccccc1-n1cc[nH+]c1 ZINC000918066228 1052777263 /nfs/dbraw/zinc/77/72/63/1052777263.db2.gz PBJRGLUIJNQFLT-YFHOEESVSA-N 1 2 323.783 4.178 20 0 DIADLO O=C(/C=C\Sc1ccccc1)Nc1ccccc1-n1cc[nH+]c1 ZINC000918066473 1052777485 /nfs/dbraw/zinc/77/74/85/1052777485.db2.gz YCLAAOXRXFPNFL-RAXLEYEMSA-N 1 2 321.405 4.117 20 0 DIADLO CCc1cccc(CC)c1NC(=O)C[N@H+](C)[C@@H](C)c1ccco1 ZINC000069069367 1052779696 /nfs/dbraw/zinc/77/96/96/1052779696.db2.gz WCKOMQYYBQUITA-AWEZNQCLSA-N 1 2 314.429 4.036 20 0 DIADLO CCc1cccc(CC)c1NC(=O)C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000069069367 1052779699 /nfs/dbraw/zinc/77/96/99/1052779699.db2.gz WCKOMQYYBQUITA-AWEZNQCLSA-N 1 2 314.429 4.036 20 0 DIADLO C[C@@H]1[N@H+](Cc2cnc(C3CCCCC3)s2)CCOC1(C)C ZINC000556901977 1052895340 /nfs/dbraw/zinc/89/53/40/1052895340.db2.gz XIFOKDMEEFXOEE-ZDUSSCGKSA-N 1 2 308.491 4.190 20 0 DIADLO C[C@@H]1[N@@H+](Cc2cnc(C3CCCCC3)s2)CCOC1(C)C ZINC000556901977 1052895345 /nfs/dbraw/zinc/89/53/45/1052895345.db2.gz XIFOKDMEEFXOEE-ZDUSSCGKSA-N 1 2 308.491 4.190 20 0 DIADLO CC1(C)C[N@H+](CN2C(=O)C[C@@H]2c2ccccc2)[C@H]1c1ccccc1 ZINC000919949460 1052904463 /nfs/dbraw/zinc/90/44/63/1052904463.db2.gz VWIJNSYYUZZDLN-QUCCMNQESA-N 1 2 320.436 4.001 20 0 DIADLO CC1(C)C[N@@H+](CN2C(=O)C[C@@H]2c2ccccc2)[C@H]1c1ccccc1 ZINC000919949460 1052904465 /nfs/dbraw/zinc/90/44/65/1052904465.db2.gz VWIJNSYYUZZDLN-QUCCMNQESA-N 1 2 320.436 4.001 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)Cc3ccccc3C)c2)[nH+]c1C ZINC000920252578 1052930647 /nfs/dbraw/zinc/93/06/47/1052930647.db2.gz VOCCDUSVLFTGIS-UHFFFAOYSA-N 1 2 319.408 4.183 20 0 DIADLO Clc1ncc(OC2C[NH+](Cc3ccccc3)C2)c2ccccc12 ZINC001227173125 1052967821 /nfs/dbraw/zinc/96/78/21/1052967821.db2.gz LTDRTRINBAQJNI-UHFFFAOYSA-N 1 2 324.811 4.151 20 0 DIADLO Cc1cc[nH+]c(C)c1OCc1cc(Cl)cnc1OC(C)C ZINC001227262422 1052977004 /nfs/dbraw/zinc/97/70/04/1052977004.db2.gz NUELUXDEQROUNV-UHFFFAOYSA-N 1 2 306.793 4.113 20 0 DIADLO Cc1nc(N[C@@H](C)C2CCCCC2)c(Br)c(C)[nH+]1 ZINC000322926661 1052977034 /nfs/dbraw/zinc/97/70/34/1052977034.db2.gz YAIPNPYYVFUYMK-VIFPVBQESA-N 1 2 312.255 4.237 20 0 DIADLO Cc1cc[nH+]c(C)c1O[C@H]1Cc2ccc(Br)cc2C1 ZINC001227258914 1052977330 /nfs/dbraw/zinc/97/73/30/1052977330.db2.gz BVHQSNOZGNBFTH-HNNXBMFYSA-N 1 2 318.214 4.007 20 0 DIADLO CCCC[C@H](CC)CNc1nc(C)[nH+]c(C)c1Br ZINC000322978866 1052982978 /nfs/dbraw/zinc/98/29/78/1052982978.db2.gz VBPULXIMYVMSJF-LBPRGKRZSA-N 1 2 314.271 4.484 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2noc(-c3ccccc3)n2)c1 ZINC000615462824 1053019175 /nfs/dbraw/zinc/01/91/75/1053019175.db2.gz KTICQRRQKJQYDN-GOSISDBHSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2noc(-c3ccccc3)n2)c1 ZINC000615462824 1053019179 /nfs/dbraw/zinc/01/91/79/1053019179.db2.gz KTICQRRQKJQYDN-GOSISDBHSA-N 1 2 319.408 4.382 20 0 DIADLO CC(C)(C)c1csc(C[NH2+]C2(c3ccccc3F)CC2)n1 ZINC000179653457 1053021597 /nfs/dbraw/zinc/02/15/97/1053021597.db2.gz BZGGYVNCCPPPHB-UHFFFAOYSA-N 1 2 304.434 4.359 20 0 DIADLO N#Cc1ccc(C[N@@H+](Cc2cccc(Cl)c2O)C2CC2)cc1 ZINC000179679086 1053021775 /nfs/dbraw/zinc/02/17/75/1053021775.db2.gz YIKRIQGIYUURIH-UHFFFAOYSA-N 1 2 312.800 4.082 20 0 DIADLO N#Cc1ccc(C[N@H+](Cc2cccc(Cl)c2O)C2CC2)cc1 ZINC000179679086 1053021780 /nfs/dbraw/zinc/02/17/80/1053021780.db2.gz YIKRIQGIYUURIH-UHFFFAOYSA-N 1 2 312.800 4.082 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2cccc(Cl)c2O)cc1 ZINC000179664596 1053022229 /nfs/dbraw/zinc/02/22/29/1053022229.db2.gz DIPPTLBMOUFIFU-GFCCVEGCSA-N 1 2 305.805 4.247 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2cccc(Cl)c2O)cc1 ZINC000179664596 1053022233 /nfs/dbraw/zinc/02/22/33/1053022233.db2.gz DIPPTLBMOUFIFU-GFCCVEGCSA-N 1 2 305.805 4.247 20 0 DIADLO CC[C@H](Oc1cc2c(cc1OC)CC[NH+]=C2)c1ccccc1F ZINC001228092253 1053043212 /nfs/dbraw/zinc/04/32/12/1053043212.db2.gz PKYGLZQHONZEAM-KRWDZBQOSA-N 1 2 313.372 4.339 20 0 DIADLO CC[C@H](C)Oc1cccc(C(=O)C[N@H+](C)Cc2ccccc2)c1 ZINC001228104323 1053044630 /nfs/dbraw/zinc/04/46/30/1053044630.db2.gz OVKMQXUGZCTGSW-INIZCTEOSA-N 1 2 311.425 4.179 20 0 DIADLO CC[C@H](C)Oc1cccc(C(=O)C[N@@H+](C)Cc2ccccc2)c1 ZINC001228104323 1053044632 /nfs/dbraw/zinc/04/46/32/1053044632.db2.gz OVKMQXUGZCTGSW-INIZCTEOSA-N 1 2 311.425 4.179 20 0 DIADLO COc1ccc([C@@H](C)Oc2ccc3[nH]c(C)[nH+]c3c2)c(F)c1 ZINC001228329560 1053075759 /nfs/dbraw/zinc/07/57/59/1053075759.db2.gz NLDVEUBJYDDBJV-SNVBAGLBSA-N 1 2 300.333 4.159 20 0 DIADLO Fc1ccc([C@@H]([NH2+][C@H]2CCCc3[nH]ncc32)C2CCCC2)cc1 ZINC000353383902 1053077425 /nfs/dbraw/zinc/07/74/25/1053077425.db2.gz HKALQQXXHQVUBV-HKUYNNGSSA-N 1 2 313.420 4.447 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C=Cc3ccc(Cl)s3)cc2[nH+]1 ZINC000849365760 1053088674 /nfs/dbraw/zinc/08/86/74/1053088674.db2.gz GVNUZWRUOGQXBY-QPJJXVBHSA-N 1 2 317.801 4.238 20 0 DIADLO Cc1cc(N[C@H](c2ccccc2)[C@H]2CCOC2)nc(C(C)C)[nH+]1 ZINC000538979103 1053090099 /nfs/dbraw/zinc/09/00/99/1053090099.db2.gz HDWAQEREQSRBQH-FUHWJXTLSA-N 1 2 311.429 4.098 20 0 DIADLO CCn1c(-c2cccs2)nn(C[N@H+](C)CCC(C)C)c1=S ZINC000068961182 1053091618 /nfs/dbraw/zinc/09/16/18/1053091618.db2.gz JNNPWQFUPHHUBQ-UHFFFAOYSA-N 1 2 324.519 4.098 20 0 DIADLO CCn1c(-c2cccs2)nn(C[N@@H+](C)CCC(C)C)c1=S ZINC000068961182 1053091631 /nfs/dbraw/zinc/09/16/31/1053091631.db2.gz JNNPWQFUPHHUBQ-UHFFFAOYSA-N 1 2 324.519 4.098 20 0 DIADLO COc1ccc(OC)c(CNc2cc(C)c3ccccc3[nH+]2)c1 ZINC001317777136 1053132419 /nfs/dbraw/zinc/13/24/19/1053132419.db2.gz OSTMWNIDUKTWLL-UHFFFAOYSA-N 1 2 308.381 4.173 20 0 DIADLO Cc1cc(O)c[nH+]c1Nc1ccc(CNc2ccccc2)cc1 ZINC001212297864 1053139118 /nfs/dbraw/zinc/13/91/18/1053139118.db2.gz JCQADLAGPBFPAL-UHFFFAOYSA-N 1 2 305.381 4.451 20 0 DIADLO CC(C)OC(=O)C[N@H+]([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC001318295658 1053161160 /nfs/dbraw/zinc/16/11/60/1053161160.db2.gz ZFDFCALTLQNNNO-OAHLLOKOSA-N 1 2 311.425 4.317 20 0 DIADLO CC(C)OC(=O)C[N@@H+]([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC001318295658 1053161166 /nfs/dbraw/zinc/16/11/66/1053161166.db2.gz ZFDFCALTLQNNNO-OAHLLOKOSA-N 1 2 311.425 4.317 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+][C@H]2CCCc3[nH]ncc32)cc1 ZINC000353498637 1053176744 /nfs/dbraw/zinc/17/67/44/1053176744.db2.gz ASBUPHHHFNUHKV-LRDDRELGSA-N 1 2 301.459 4.250 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+][C@@H]2CCCc3[nH]ncc32)cc1 ZINC000353498639 1053176886 /nfs/dbraw/zinc/17/68/86/1053176886.db2.gz ASBUPHHHFNUHKV-MLGOLLRUSA-N 1 2 301.459 4.250 20 0 DIADLO CC(C)C[C@@H](NC(=O)[C@@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC001318682316 1053183040 /nfs/dbraw/zinc/18/30/40/1053183040.db2.gz SHQZKLJUWPBWDS-CZUORRHYSA-N 1 2 319.836 4.001 20 0 DIADLO C[C@H](CO)[N@H+](Cc1ccccc1)Cc1c(Cl)cccc1Cl ZINC001319182325 1053224115 /nfs/dbraw/zinc/22/41/15/1053224115.db2.gz YXCXVYHXGMRBEQ-CYBMUJFWSA-N 1 2 324.251 4.376 20 0 DIADLO C[C@H](CO)[N@@H+](Cc1ccccc1)Cc1c(Cl)cccc1Cl ZINC001319182325 1053224118 /nfs/dbraw/zinc/22/41/18/1053224118.db2.gz YXCXVYHXGMRBEQ-CYBMUJFWSA-N 1 2 324.251 4.376 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc2ccccc2n1 ZINC000090547184 1053236432 /nfs/dbraw/zinc/23/64/32/1053236432.db2.gz GZCRMNRRWAXWAU-OAHLLOKOSA-N 1 2 320.440 4.397 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001319334820 1053236495 /nfs/dbraw/zinc/23/64/95/1053236495.db2.gz NNBRKWCPNJFMAI-GDBMZVCRSA-N 1 2 303.450 4.129 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001319334820 1053236504 /nfs/dbraw/zinc/23/65/04/1053236504.db2.gz NNBRKWCPNJFMAI-GDBMZVCRSA-N 1 2 303.450 4.129 20 0 DIADLO C[C@@H](CC(=O)N(C)c1ccccc1-c1ccccc1)n1cc[nH+]c1 ZINC001351919111 1053242910 /nfs/dbraw/zinc/24/29/10/1053242910.db2.gz OJMWCTNTTSSJFV-INIZCTEOSA-N 1 2 319.408 4.164 20 0 DIADLO C[C@H](CC(=O)N(C)c1ccccc1-c1ccccc1)n1cc[nH+]c1 ZINC001351919114 1053243011 /nfs/dbraw/zinc/24/30/11/1053243011.db2.gz OJMWCTNTTSSJFV-MRXNPFEDSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1cc(N[C@@H]2CC[C@H]3SCCS[C@@H]23)[nH+]c2ccccc12 ZINC001319583218 1053253523 /nfs/dbraw/zinc/25/35/23/1053253523.db2.gz IJYPSGCCDFORNO-INMHGKMJSA-N 1 2 316.495 4.335 20 0 DIADLO S=C(Nc1ccn2cc[nH+]c2c1)Nc1cccc2ccccc21 ZINC001200094019 1053375039 /nfs/dbraw/zinc/37/50/39/1053375039.db2.gz BHWAUBNKCZJZLR-UHFFFAOYSA-N 1 2 318.405 4.296 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccnc3c(F)cccc23)c1C ZINC001321104226 1053390819 /nfs/dbraw/zinc/39/08/19/1053390819.db2.gz DCXOHFKNBFCSHY-UHFFFAOYSA-N 1 2 311.360 4.006 20 0 DIADLO Cc1cccn2cc(CC(=O)Nc3ccc4sccc4c3)[nH+]c12 ZINC001352833912 1053413985 /nfs/dbraw/zinc/41/39/85/1053413985.db2.gz BGXLPOOMXFZODA-UHFFFAOYSA-N 1 2 321.405 4.039 20 0 DIADLO CCCC1CC[NH+](Cc2noc(-c3ccc(F)cc3F)n2)CC1 ZINC001321577885 1053422524 /nfs/dbraw/zinc/42/25/24/1053422524.db2.gz OYJRDUAITOGVGM-UHFFFAOYSA-N 1 2 321.371 4.027 20 0 DIADLO Cc1cc(N2CCO[C@H](c3ccc(F)cc3)C2)[nH+]c2ccccc12 ZINC001321646274 1053426765 /nfs/dbraw/zinc/42/67/65/1053426765.db2.gz PWZQESGVDFGSLL-IBGZPJMESA-N 1 2 322.383 4.260 20 0 DIADLO C[C@H](CCc1ccc(O)cc1)[NH2+][C@H](c1ccccc1)C(F)F ZINC001474761589 1053430866 /nfs/dbraw/zinc/43/08/66/1053430866.db2.gz BEZRQQNMTHJETO-CXAGYDPISA-N 1 2 305.368 4.309 20 0 DIADLO COc1cccc2c1CC[C@@H]([NH2+][C@H](c1ccccc1)C(F)F)C2 ZINC001474761666 1053430871 /nfs/dbraw/zinc/43/08/71/1053430871.db2.gz CYAPKQRZKIHBMU-CRAIPNDOSA-N 1 2 317.379 4.149 20 0 DIADLO COC[C@@H](C)CNc1[nH+]c2ccccc2n1C1CCCCC1 ZINC001474762162 1053431714 /nfs/dbraw/zinc/43/17/14/1053431714.db2.gz HTABMAPRMAOQCB-AWEZNQCLSA-N 1 2 301.434 4.236 20 0 DIADLO C[C@H](Oc1ccc(-n2cc[nH+]c2)cc1)c1cccc(N(C)C)c1 ZINC001229954961 1053438861 /nfs/dbraw/zinc/43/88/61/1053438861.db2.gz WMDJRLVAMSLYOA-HNNXBMFYSA-N 1 2 307.397 4.078 20 0 DIADLO Cc1cccc(Cl)c1NC(=S)Nc1ccc2[nH+]ccn2c1 ZINC001200188775 1053446917 /nfs/dbraw/zinc/44/69/17/1053446917.db2.gz VGMJWMZUUSYBOZ-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO COc1cc(CNc2[nH+]c3ccccc3n2C2CC2)ccc1F ZINC001353002505 1053453003 /nfs/dbraw/zinc/45/30/03/1053453003.db2.gz FCOCVAVQBIXVAI-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1cn2ccccc2n1 ZINC001353003273 1053453602 /nfs/dbraw/zinc/45/36/02/1053453602.db2.gz LQRVRNPYJIXUOF-UHFFFAOYSA-N 1 2 319.412 4.051 20 0 DIADLO Cc1ccc(C(=O)Nc2cccc3[nH+]ccn32)c2ccccc12 ZINC001435150738 1053454331 /nfs/dbraw/zinc/45/43/31/1053454331.db2.gz VAQRRJKTQQDNJV-UHFFFAOYSA-N 1 2 301.349 4.048 20 0 DIADLO Clc1ccc([C@@H]2C[N@@H+]([C@@H]3CCc4ccccc43)CCO2)s1 ZINC001322173717 1053466116 /nfs/dbraw/zinc/46/61/16/1053466116.db2.gz BNCVKRJHSVZGSZ-CABCVRRESA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc([C@@H]2C[N@H+]([C@@H]3CCc4ccccc43)CCO2)s1 ZINC001322173717 1053466122 /nfs/dbraw/zinc/46/61/22/1053466122.db2.gz BNCVKRJHSVZGSZ-CABCVRRESA-N 1 2 319.857 4.462 20 0 DIADLO CCCC1(CCC)CCCN1C(=O)NCc1c[nH+]c(C)cc1C ZINC001230062232 1053469021 /nfs/dbraw/zinc/46/90/21/1053469021.db2.gz GVOWIIHARYVHNY-UHFFFAOYSA-N 1 2 317.477 4.343 20 0 DIADLO Cl/C=C(\Cl)C[N@@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000763566330 1053478272 /nfs/dbraw/zinc/47/82/72/1053478272.db2.gz NCTTXVYLULPCKD-QZFKAFNDSA-N 1 2 314.256 4.029 20 0 DIADLO Cl/C=C(\Cl)C[N@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000763566330 1053478280 /nfs/dbraw/zinc/47/82/80/1053478280.db2.gz NCTTXVYLULPCKD-QZFKAFNDSA-N 1 2 314.256 4.029 20 0 DIADLO Cc1cc(C)c(C(=O)NCCc2cccc3ccccc32)c(C)[nH+]1 ZINC001353109238 1053483097 /nfs/dbraw/zinc/48/30/97/1053483097.db2.gz XKTMGGBAPWHKJA-UHFFFAOYSA-N 1 2 318.420 4.133 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc(-n3ccnc3)cc2)ccc1[NH+](C)C ZINC000182849872 1053532589 /nfs/dbraw/zinc/53/25/89/1053532589.db2.gz KNBQWHCXYWFHPR-INIZCTEOSA-N 1 2 320.440 4.420 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H]2CCCc3cn(C(C)C)nc32)oc1C ZINC001322653523 1053532805 /nfs/dbraw/zinc/53/28/05/1053532805.db2.gz WBJKYBAZRFFFDA-CJNGLKHVSA-N 1 2 301.434 4.402 20 0 DIADLO CC(C)Oc1ccc[nH+]c1N[C@@H]1CCC[C@H](c2cccnc2)C1 ZINC001322653032 1053533792 /nfs/dbraw/zinc/53/37/92/1053533792.db2.gz SRUBTURERBHFGD-DOTOQJQBSA-N 1 2 311.429 4.402 20 0 DIADLO FC(F)(F)c1cccnc1C[NH2+]Cc1cscc1Cl ZINC001353354444 1053549068 /nfs/dbraw/zinc/54/90/68/1053549068.db2.gz QHMJAAQLHOVFIA-UHFFFAOYSA-N 1 2 306.740 4.105 20 0 DIADLO Cc1nc(C)c([C@@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)s1 ZINC000182954035 1053560430 /nfs/dbraw/zinc/56/04/30/1053560430.db2.gz HSCOFSKIYQTDRV-GFCCVEGCSA-N 1 2 301.459 4.315 20 0 DIADLO Cc1nc(C)c([C@@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)s1 ZINC000182954035 1053560440 /nfs/dbraw/zinc/56/04/40/1053560440.db2.gz HSCOFSKIYQTDRV-GFCCVEGCSA-N 1 2 301.459 4.315 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000182955688 1053562393 /nfs/dbraw/zinc/56/23/93/1053562393.db2.gz HGKFMJUVCKUYIQ-ZDUSSCGKSA-N 1 2 311.385 4.150 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000182955688 1053562407 /nfs/dbraw/zinc/56/24/07/1053562407.db2.gz HGKFMJUVCKUYIQ-ZDUSSCGKSA-N 1 2 311.385 4.150 20 0 DIADLO Cc1nc(N[C@H](c2cccc(Cl)c2)c2ccccn2)cc[nH+]1 ZINC000152992873 1053566964 /nfs/dbraw/zinc/56/69/64/1053566964.db2.gz XGBVKYKAQNCXDA-QGZVFWFLSA-N 1 2 310.788 4.035 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N[C@@H](C)CCC3CCCCC3)ccn12 ZINC001353441679 1053574972 /nfs/dbraw/zinc/57/49/72/1053574972.db2.gz GGMGSZZHUDMFGR-AWEZNQCLSA-N 1 2 313.445 4.122 20 0 DIADLO CC(C)c1ocnc1C[N@@H+]1[C@@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC001323368235 1053576922 /nfs/dbraw/zinc/57/69/22/1053576922.db2.gz SXILZKAUHWSDLM-STQMWFEESA-N 1 2 302.393 4.445 20 0 DIADLO CC(C)c1ocnc1C[N@H+]1[C@@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC001323368235 1053576930 /nfs/dbraw/zinc/57/69/30/1053576930.db2.gz SXILZKAUHWSDLM-STQMWFEESA-N 1 2 302.393 4.445 20 0 DIADLO CC(C)c1ccc(CN2CC[NH+]([C@H](C)c3ccncc3)CC2)cc1 ZINC000619969695 1053588216 /nfs/dbraw/zinc/58/82/16/1053588216.db2.gz FFJXHIWDIQUHER-GOSISDBHSA-N 1 2 323.484 4.084 20 0 DIADLO Fc1cc(CNc2nccc3sccc32)ccc1-n1cc[nH+]c1 ZINC000620058810 1053599517 /nfs/dbraw/zinc/59/95/17/1053599517.db2.gz GKROFZJPWUWIKJ-UHFFFAOYSA-N 1 2 324.384 4.233 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000620128045 1053608825 /nfs/dbraw/zinc/60/88/25/1053608825.db2.gz UKPRFAGVYHSDBM-TYILLQQXSA-N 1 2 317.379 4.488 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000620128045 1053608830 /nfs/dbraw/zinc/60/88/30/1053608830.db2.gz UKPRFAGVYHSDBM-TYILLQQXSA-N 1 2 317.379 4.488 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000620127975 1053609785 /nfs/dbraw/zinc/60/97/85/1053609785.db2.gz GMQGULUZLWOGJZ-TYILLQQXSA-N 1 2 317.379 4.488 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000620127975 1053609796 /nfs/dbraw/zinc/60/97/96/1053609796.db2.gz GMQGULUZLWOGJZ-TYILLQQXSA-N 1 2 317.379 4.488 20 0 DIADLO Cc1ccc(Cl)cc1[C@H](C)Oc1cc2c(cc1O)C=[NH+]CC2 ZINC001230919935 1053625054 /nfs/dbraw/zinc/62/50/54/1053625054.db2.gz GWAQKGCSXCJYFF-LBPRGKRZSA-N 1 2 315.800 4.469 20 0 DIADLO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2nnc(C(F)(F)F)s2)c1 ZINC000660198044 1053627419 /nfs/dbraw/zinc/62/74/19/1053627419.db2.gz SIPJDWZACYMSOT-SNVBAGLBSA-N 1 2 315.364 4.025 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nc(CCC(C)C)no2)c(C)c1 ZINC000620278343 1053640398 /nfs/dbraw/zinc/64/03/98/1053640398.db2.gz NEVIFEKGOXASFO-MRXNPFEDSA-N 1 2 315.461 4.468 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2nc(CCC(C)C)no2)c(C)c1 ZINC000620278343 1053640401 /nfs/dbraw/zinc/64/04/01/1053640401.db2.gz NEVIFEKGOXASFO-MRXNPFEDSA-N 1 2 315.461 4.468 20 0 DIADLO CCc1nc([C@H]2CCCC[N@@H+]2Cc2c(C)cc(C)cc2C)no1 ZINC000620342412 1053647934 /nfs/dbraw/zinc/64/79/34/1053647934.db2.gz JTTBIPBADKOKDH-QGZVFWFLSA-N 1 2 313.445 4.284 20 0 DIADLO CCc1nc([C@H]2CCCC[N@H+]2Cc2c(C)cc(C)cc2C)no1 ZINC000620342412 1053647938 /nfs/dbraw/zinc/64/79/38/1053647938.db2.gz JTTBIPBADKOKDH-QGZVFWFLSA-N 1 2 313.445 4.284 20 0 DIADLO Cc1ccc(N[C@H](C)c2ccc(Br)nc2)c(C)[nH+]1 ZINC001324587296 1053662657 /nfs/dbraw/zinc/66/26/57/1053662657.db2.gz HNULAJHXUFOGSV-SNVBAGLBSA-N 1 2 306.207 4.029 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2nc3c(s2)C[C@H](C)CC3)o1 ZINC001324643162 1053667635 /nfs/dbraw/zinc/66/76/35/1053667635.db2.gz UPXLXFKCMIKXSU-YRGRVCCFSA-N 1 2 316.470 4.274 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[NH+]1CCN(Cc2ccco2)CC1 ZINC000620480824 1053668171 /nfs/dbraw/zinc/66/81/71/1053668171.db2.gz ICIXJKLQMZXXNH-SFHVURJKSA-N 1 2 318.848 4.202 20 0 DIADLO C[C@H](COCc1ccccc1)Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231084046 1053671082 /nfs/dbraw/zinc/67/10/82/1053671082.db2.gz UVMRGLCUTWKHQB-MRXNPFEDSA-N 1 2 322.408 4.071 20 0 DIADLO Cc1cnc(F)c([C@@H](C)Oc2ccc(-c3c[nH+]cn3C)cc2)c1 ZINC001231084066 1053671379 /nfs/dbraw/zinc/67/13/79/1053671379.db2.gz VVPBKKPNTCBHCS-CYBMUJFWSA-N 1 2 311.360 4.070 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(O[C@H](c2cccnc2)C2CC2)cc1 ZINC001231083019 1053671559 /nfs/dbraw/zinc/67/15/59/1053671559.db2.gz AJEABEYWFJWKRH-IBGZPJMESA-N 1 2 305.381 4.012 20 0 DIADLO CC1(C)CC(Oc2ccc(-c3[nH]cc[nH+]3)cc2)CC(C)(C)O1 ZINC001231085291 1053671637 /nfs/dbraw/zinc/67/16/37/1053671637.db2.gz RWJYQJJKFDIRIT-UHFFFAOYSA-N 1 2 300.402 4.192 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CC[C@H]3CCCC[C@H]3C2)c(C)[nH+]1 ZINC001353885124 1053696421 /nfs/dbraw/zinc/69/64/21/1053696421.db2.gz HGOFREMJRWVCTP-IXDOHACOSA-N 1 2 300.446 4.096 20 0 DIADLO Cc1cccc2nc(C[NH2+]Cc3cccn3CCC(C)C)[nH]c21 ZINC000153602380 1053699435 /nfs/dbraw/zinc/69/94/35/1053699435.db2.gz WVGUWFMJQWHGBW-UHFFFAOYSA-N 1 2 310.445 4.009 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C)c2cc3ccccc3o2)c(C)[nH+]1 ZINC001435907512 1053720352 /nfs/dbraw/zinc/72/03/52/1053720352.db2.gz XBJLTTFMTZNCOP-ZDUSSCGKSA-N 1 2 308.381 4.244 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2c(F)ccc(F)c2OC)cc1 ZINC001231414160 1053746514 /nfs/dbraw/zinc/74/65/14/1053746514.db2.gz IGAVHVNEYUOICC-UHFFFAOYSA-N 1 2 305.368 4.168 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2c(F)ccc(F)c2OC)cc1 ZINC001231414160 1053746522 /nfs/dbraw/zinc/74/65/22/1053746522.db2.gz IGAVHVNEYUOICC-UHFFFAOYSA-N 1 2 305.368 4.168 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+]1CCC[C@@H]1c1ccc(C)nc1 ZINC001231414130 1053746673 /nfs/dbraw/zinc/74/66/73/1053746673.db2.gz GMWPTVOMFRJZMZ-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+]1CCC[C@@H]1c1ccc(C)nc1 ZINC001231414130 1053746679 /nfs/dbraw/zinc/74/66/79/1053746679.db2.gz GMWPTVOMFRJZMZ-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001231414369 1053747495 /nfs/dbraw/zinc/74/74/95/1053747495.db2.gz QJEOJUNIQHWWMW-UHFFFAOYSA-N 1 2 315.363 4.263 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+]1CC=C(c2ccccc2)CC1 ZINC001231414369 1053747507 /nfs/dbraw/zinc/74/75/07/1053747507.db2.gz QJEOJUNIQHWWMW-UHFFFAOYSA-N 1 2 315.363 4.263 20 0 DIADLO c1csc(-c2ccc(C[NH+]3CC(Oc4cccnc4)C3)cc2)c1 ZINC001231431764 1053751345 /nfs/dbraw/zinc/75/13/45/1053751345.db2.gz BYDLNHLAJVMHBA-UHFFFAOYSA-N 1 2 322.433 4.073 20 0 DIADLO FC1CC[NH+](Cc2ccc(Br)c(Cl)c2)CC1 ZINC001231434853 1053752978 /nfs/dbraw/zinc/75/29/78/1053752978.db2.gz FNSYUKGWPNLCOE-UHFFFAOYSA-N 1 2 306.606 4.036 20 0 DIADLO CCO[C@@H]1CC[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC001231481579 1053764506 /nfs/dbraw/zinc/76/45/06/1053764506.db2.gz HUKRYIXCHNMGPC-SECBINFHSA-N 1 2 308.636 4.258 20 0 DIADLO CCO[C@@H]1CC[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC001231481579 1053764522 /nfs/dbraw/zinc/76/45/22/1053764522.db2.gz HUKRYIXCHNMGPC-SECBINFHSA-N 1 2 308.636 4.258 20 0 DIADLO FC1(F)C[C@]12CC[N@H+](Cn1cc(-c3ccccc3)oc1=S)C2 ZINC001326405895 1053780857 /nfs/dbraw/zinc/78/08/57/1053780857.db2.gz GZUBLWLVUUKWDS-HNNXBMFYSA-N 1 2 322.380 4.166 20 0 DIADLO FC1(F)C[C@]12CC[N@@H+](Cn1cc(-c3ccccc3)oc1=S)C2 ZINC001326405895 1053780865 /nfs/dbraw/zinc/78/08/65/1053780865.db2.gz GZUBLWLVUUKWDS-HNNXBMFYSA-N 1 2 322.380 4.166 20 0 DIADLO Clc1ccc([C@@H]2C[N@H+](Cc3cccn3C3CC3)CCO2)cc1 ZINC001326447230 1053782256 /nfs/dbraw/zinc/78/22/56/1053782256.db2.gz SCJIDOVBBXHADH-SFHVURJKSA-N 1 2 316.832 4.050 20 0 DIADLO Clc1ccc([C@@H]2C[N@@H+](Cc3cccn3C3CC3)CCO2)cc1 ZINC001326447230 1053782274 /nfs/dbraw/zinc/78/22/74/1053782274.db2.gz SCJIDOVBBXHADH-SFHVURJKSA-N 1 2 316.832 4.050 20 0 DIADLO Cc1cc(C)c(C(=O)NC2CCC(c3ccccc3)CC2)c(C)[nH+]1 ZINC001354161791 1053783907 /nfs/dbraw/zinc/78/39/07/1053783907.db2.gz WYZJPSHCGHKJJG-UHFFFAOYSA-N 1 2 322.452 4.463 20 0 DIADLO C[C@@H]([NH2+]Cc1ccnn1C1CCC1)c1nc(C(C)(C)C)cs1 ZINC001354159755 1053784219 /nfs/dbraw/zinc/78/42/19/1053784219.db2.gz DKCMGVGWVVISQN-GFCCVEGCSA-N 1 2 318.490 4.213 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3CCC[C@H](F)C3)cc2)[nH+]c1C ZINC001354160126 1053784240 /nfs/dbraw/zinc/78/42/40/1053784240.db2.gz KLWUCYGCHMASAT-CABCVRRESA-N 1 2 315.392 4.160 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)C[C@@]1(C)O ZINC001231598624 1053797947 /nfs/dbraw/zinc/79/79/47/1053797947.db2.gz RBIHSMWDYUEBGG-YMTOWFKASA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)C[C@@]1(C)O ZINC001231598624 1053797958 /nfs/dbraw/zinc/79/79/58/1053797958.db2.gz RBIHSMWDYUEBGG-YMTOWFKASA-N 1 2 322.663 4.240 20 0 DIADLO COc1cc(F)ccc1C[N@@H+]1CCc2ccc(Cl)cc2C1 ZINC001231603310 1053799679 /nfs/dbraw/zinc/79/96/79/1053799679.db2.gz YXRGXPUODBRMLA-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(F)ccc1C[N@H+]1CCc2ccc(Cl)cc2C1 ZINC001231603310 1053799688 /nfs/dbraw/zinc/79/96/88/1053799688.db2.gz YXRGXPUODBRMLA-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO OCC[C@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)C1 ZINC001231605444 1053802405 /nfs/dbraw/zinc/80/24/05/1053802405.db2.gz ZRFLUZAJQNAGLJ-SNVBAGLBSA-N 1 2 322.663 4.241 20 0 DIADLO OCC[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)C1 ZINC001231605444 1053802417 /nfs/dbraw/zinc/80/24/17/1053802417.db2.gz ZRFLUZAJQNAGLJ-SNVBAGLBSA-N 1 2 322.663 4.241 20 0 DIADLO c1oc(-c2ccccc2)nc1C[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001231630998 1053809537 /nfs/dbraw/zinc/80/95/37/1053809537.db2.gz LQFJFWAUJYPMQM-IBGZPJMESA-N 1 2 319.408 4.464 20 0 DIADLO c1oc(-c2ccccc2)nc1C[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001231630998 1053809548 /nfs/dbraw/zinc/80/95/48/1053809548.db2.gz LQFJFWAUJYPMQM-IBGZPJMESA-N 1 2 319.408 4.464 20 0 DIADLO CCc1ccc(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)nc1 ZINC001231642526 1053813316 /nfs/dbraw/zinc/81/33/16/1053813316.db2.gz CQAQVJASPFWRDJ-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO CCc1ccc(C[N@H+]2CCc3cccc(C(F)(F)F)c3C2)nc1 ZINC001231642526 1053813330 /nfs/dbraw/zinc/81/33/30/1053813330.db2.gz CQAQVJASPFWRDJ-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(CC)cn1 ZINC001231647483 1053816630 /nfs/dbraw/zinc/81/66/30/1053816630.db2.gz XRKXKMSQJNOLPX-LJQANCHMSA-N 1 2 310.441 4.127 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(CC)cn1 ZINC001231647483 1053816645 /nfs/dbraw/zinc/81/66/45/1053816645.db2.gz XRKXKMSQJNOLPX-LJQANCHMSA-N 1 2 310.441 4.127 20 0 DIADLO Cc1cccc2cc(C[N@H+]3CCOC[C@H]3C(C)C)c(Cl)nc12 ZINC001231652599 1053823831 /nfs/dbraw/zinc/82/38/31/1053823831.db2.gz QREBLGMFXBKSAM-INIZCTEOSA-N 1 2 318.848 4.053 20 0 DIADLO Cc1cccc2cc(C[N@@H+]3CCOC[C@H]3C(C)C)c(Cl)nc12 ZINC001231652599 1053823845 /nfs/dbraw/zinc/82/38/45/1053823845.db2.gz QREBLGMFXBKSAM-INIZCTEOSA-N 1 2 318.848 4.053 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+][C@H]1COc2cc(F)cc(F)c21 ZINC001327031254 1053827847 /nfs/dbraw/zinc/82/78/47/1053827847.db2.gz CNNDWDJRBULQFS-YGRLFVJLSA-N 1 2 321.392 4.471 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)c(O)c1)Cc1cccc(F)c1F ZINC001231735085 1053844062 /nfs/dbraw/zinc/84/40/62/1053844062.db2.gz IVMUOPGXARVDPB-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)c(O)c1)Cc1cccc(F)c1F ZINC001231735085 1053844075 /nfs/dbraw/zinc/84/40/75/1053844075.db2.gz IVMUOPGXARVDPB-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO COc1ncc(F)cc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC001231741944 1053845950 /nfs/dbraw/zinc/84/59/50/1053845950.db2.gz BCRAEHQYHCFBMQ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(F)cc1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC001231741944 1053845963 /nfs/dbraw/zinc/84/59/63/1053845963.db2.gz BCRAEHQYHCFBMQ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO c1coc(C[N@H+](Cc2cnc3ccccn23)Cc2ccccc2)c1 ZINC000157389822 1053853340 /nfs/dbraw/zinc/85/33/40/1053853340.db2.gz MIUGVZHUSVEZFH-UHFFFAOYSA-N 1 2 317.392 4.130 20 0 DIADLO c1coc(C[N@@H+](Cc2cnc3ccccn23)Cc2ccccc2)c1 ZINC000157389822 1053853354 /nfs/dbraw/zinc/85/33/54/1053853354.db2.gz MIUGVZHUSVEZFH-UHFFFAOYSA-N 1 2 317.392 4.130 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1cnc(C2CC2)nc1 ZINC001327375492 1053856672 /nfs/dbraw/zinc/85/66/72/1053856672.db2.gz NOIRXDJMHBPCLJ-UHFFFAOYSA-N 1 2 321.428 4.071 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2oc3ccccc3c2C)s1 ZINC000274157337 1053860201 /nfs/dbraw/zinc/86/02/01/1053860201.db2.gz FXYCRYNHXGDKPA-MNOVXSKESA-N 1 2 301.415 4.313 20 0 DIADLO COc1cccc2cc([C@H](C)[NH2+][C@H](C)c3nnc(C)s3)oc21 ZINC000274288659 1053862705 /nfs/dbraw/zinc/86/27/05/1053862705.db2.gz ZYIZEWBGEHZFMD-VHSXEESVSA-N 1 2 317.414 4.013 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc(OC(C)(C)C)cc1)C2 ZINC001231804359 1053865365 /nfs/dbraw/zinc/86/53/65/1053865365.db2.gz AJRZPNPKTDEOMA-UHFFFAOYSA-N 1 2 311.425 4.388 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc(OC(C)(C)C)cc1)C2 ZINC001231804359 1053865372 /nfs/dbraw/zinc/86/53/72/1053865372.db2.gz AJRZPNPKTDEOMA-UHFFFAOYSA-N 1 2 311.425 4.388 20 0 DIADLO CC[C@@H](C)CNc1cccc(C[N@H+](C)Cc2cscn2)c1 ZINC000157875093 1053874440 /nfs/dbraw/zinc/87/44/40/1053874440.db2.gz CXGSQZUOJJVDTK-CQSZACIVSA-N 1 2 303.475 4.233 20 0 DIADLO CC[C@@H](C)CNc1cccc(C[N@@H+](C)Cc2cscn2)c1 ZINC000157875093 1053874445 /nfs/dbraw/zinc/87/44/45/1053874445.db2.gz CXGSQZUOJJVDTK-CQSZACIVSA-N 1 2 303.475 4.233 20 0 DIADLO c1cc(-c2ccccc2)oc1C[N@@H+]1CCC[C@@H]1c1ncccn1 ZINC001231815516 1053876908 /nfs/dbraw/zinc/87/69/08/1053876908.db2.gz OGBXHUUPCOQWKK-QGZVFWFLSA-N 1 2 305.381 4.074 20 0 DIADLO c1cc(-c2ccccc2)oc1C[N@H+]1CCC[C@@H]1c1ncccn1 ZINC001231815516 1053876928 /nfs/dbraw/zinc/87/69/28/1053876928.db2.gz OGBXHUUPCOQWKK-QGZVFWFLSA-N 1 2 305.381 4.074 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc(C)[nH+]c2C)c(C)c1OC ZINC001327891883 1053891493 /nfs/dbraw/zinc/89/14/93/1053891493.db2.gz PVZYICFVPNBGFI-CYBMUJFWSA-N 1 2 300.402 4.197 20 0 DIADLO FC(F)c1cc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)ccn1 ZINC001231890094 1053904829 /nfs/dbraw/zinc/90/48/29/1053904829.db2.gz UAENDDGZXHDPSL-MRXNPFEDSA-N 1 2 320.408 4.309 20 0 DIADLO FC(F)c1cc(C[N@H+]2CCSC[C@@H]2c2ccccc2)ccn1 ZINC001231890094 1053904836 /nfs/dbraw/zinc/90/48/36/1053904836.db2.gz UAENDDGZXHDPSL-MRXNPFEDSA-N 1 2 320.408 4.309 20 0 DIADLO CCc1cc(C[NH2+]Cc2ccccc2OCc2ccccc2)on1 ZINC001200703232 1053907225 /nfs/dbraw/zinc/90/72/25/1053907225.db2.gz MUHSWUZDKDPQBY-UHFFFAOYSA-N 1 2 322.408 4.106 20 0 DIADLO COc1cccc2c(C[N@@H+]3Cc4cccc(Cl)c4C3)c[nH]c21 ZINC001231899861 1053910034 /nfs/dbraw/zinc/91/00/34/1053910034.db2.gz VVHXKRSZZHKXCL-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1cccc2c(C[N@H+]3Cc4cccc(Cl)c4C3)c[nH]c21 ZINC001231899861 1053910052 /nfs/dbraw/zinc/91/00/52/1053910052.db2.gz VVHXKRSZZHKXCL-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO Brc1cccc([C@@H]2CCC[N@@H+]2Cc2cncs2)c1 ZINC000158629788 1053911511 /nfs/dbraw/zinc/91/15/11/1053911511.db2.gz KUANTKCPHAYJCD-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cccc([C@@H]2CCC[N@H+]2Cc2cncs2)c1 ZINC000158629788 1053911527 /nfs/dbraw/zinc/91/15/27/1053911527.db2.gz KUANTKCPHAYJCD-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+]C[C@H]2CCSC2)C(F)F)c1 ZINC000671123168 1053919107 /nfs/dbraw/zinc/91/91/07/1053919107.db2.gz PHEMTEMAQLBLBI-DOMZBBRYSA-N 1 2 315.429 4.123 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001231986305 1053928410 /nfs/dbraw/zinc/92/84/10/1053928410.db2.gz JPCPIXDPKQZIAJ-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(F)ncc1C[N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001231986305 1053928426 /nfs/dbraw/zinc/92/84/26/1053928426.db2.gz JPCPIXDPKQZIAJ-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(F)ncc1C[N@H+](Cc1ccccc1)Cc1cccnc1 ZINC001231984822 1053931229 /nfs/dbraw/zinc/93/12/29/1053931229.db2.gz OWEWKGHJMXUEHF-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+](Cc1ccccc1)Cc1cccnc1 ZINC001231984822 1053931241 /nfs/dbraw/zinc/93/12/41/1053931241.db2.gz OWEWKGHJMXUEHF-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)cnc2F)c1 ZINC001231994013 1053932825 /nfs/dbraw/zinc/93/28/25/1053932825.db2.gz ACKQFORZYAJIKI-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2cc(Cl)cnc2F)c1 ZINC001231994013 1053932834 /nfs/dbraw/zinc/93/28/34/1053932834.db2.gz ACKQFORZYAJIKI-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)cc(C)n1 ZINC001232003895 1053936508 /nfs/dbraw/zinc/93/65/08/1053936508.db2.gz YWKXIJLHYMOCGU-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)cc(C)n1 ZINC001232003895 1053936516 /nfs/dbraw/zinc/93/65/16/1053936516.db2.gz YWKXIJLHYMOCGU-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(C(F)(F)F)cnc1Cl ZINC001232009200 1053939979 /nfs/dbraw/zinc/93/99/79/1053939979.db2.gz RAAOPYHIHHBTEY-VHSXEESVSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc(C(F)(F)F)cnc1Cl ZINC001232009200 1053939985 /nfs/dbraw/zinc/93/99/85/1053939985.db2.gz RAAOPYHIHHBTEY-VHSXEESVSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(C(F)(F)F)cnc2Cl)C2(CC2)C1 ZINC001232010580 1053940157 /nfs/dbraw/zinc/94/01/57/1053940157.db2.gz IJXDEYMBGCXJAP-SECBINFHSA-N 1 2 304.743 4.128 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(C(F)(F)F)cnc2Cl)C2(CC2)C1 ZINC001232010580 1053940171 /nfs/dbraw/zinc/94/01/71/1053940171.db2.gz IJXDEYMBGCXJAP-SECBINFHSA-N 1 2 304.743 4.128 20 0 DIADLO Clc1oc2ccccc2c1C[N@@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000621288286 1053941666 /nfs/dbraw/zinc/94/16/66/1053941666.db2.gz SGGYKGXKMFXZSW-AWEZNQCLSA-N 1 2 301.777 4.146 20 0 DIADLO Clc1oc2ccccc2c1C[N@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000621288286 1053941672 /nfs/dbraw/zinc/94/16/72/1053941672.db2.gz SGGYKGXKMFXZSW-AWEZNQCLSA-N 1 2 301.777 4.146 20 0 DIADLO CCC[N@H+](Cc1cn2c(cccc2C)n1)Cc1ccccc1F ZINC000621297005 1053947049 /nfs/dbraw/zinc/94/70/49/1053947049.db2.gz XJLJPPQMULQEFS-UHFFFAOYSA-N 1 2 311.404 4.194 20 0 DIADLO CCC[N@@H+](Cc1cn2c(cccc2C)n1)Cc1ccccc1F ZINC000621297005 1053947059 /nfs/dbraw/zinc/94/70/59/1053947059.db2.gz XJLJPPQMULQEFS-UHFFFAOYSA-N 1 2 311.404 4.194 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1ncc(C(C)C)o1)CCC2 ZINC000763655384 1053947734 /nfs/dbraw/zinc/94/77/34/1053947734.db2.gz VAACFAKIAYHLKI-CYBMUJFWSA-N 1 2 319.474 4.326 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1ncc(C(C)C)o1)CCC2 ZINC000763655384 1053947751 /nfs/dbraw/zinc/94/77/51/1053947751.db2.gz VAACFAKIAYHLKI-CYBMUJFWSA-N 1 2 319.474 4.326 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1ncc(C(C)C)o1)CCC2 ZINC000763655385 1053948357 /nfs/dbraw/zinc/94/83/57/1053948357.db2.gz VAACFAKIAYHLKI-ZDUSSCGKSA-N 1 2 319.474 4.326 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ncc(C(C)C)o1)CCC2 ZINC000763655385 1053948365 /nfs/dbraw/zinc/94/83/65/1053948365.db2.gz VAACFAKIAYHLKI-ZDUSSCGKSA-N 1 2 319.474 4.326 20 0 DIADLO COc1cccc2[nH]cc(C[N@@H+]3Cc4ccc(Cl)cc4C3)c21 ZINC001232039010 1053948312 /nfs/dbraw/zinc/94/83/12/1053948312.db2.gz URNXQASRQOBBMZ-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1cccc2[nH]cc(C[N@H+]3Cc4ccc(Cl)cc4C3)c21 ZINC001232039010 1053948323 /nfs/dbraw/zinc/94/83/23/1053948323.db2.gz URNXQASRQOBBMZ-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO CCCc1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)s1 ZINC000621338449 1053952497 /nfs/dbraw/zinc/95/24/97/1053952497.db2.gz AFDUMGIQKTVNLW-LLVKDONJSA-N 1 2 307.463 4.232 20 0 DIADLO C[C@H]([NH2+]Cc1cncc(Cl)c1)c1nc(C(C)(C)C)cs1 ZINC001328757135 1053953549 /nfs/dbraw/zinc/95/35/49/1053953549.db2.gz LULGOWCUDHPBQR-JTQLQIEISA-N 1 2 309.866 4.340 20 0 DIADLO CCCC[N@H+](Cc1nc(C(C)C)no1)[C@@H](C)c1ccc(C)o1 ZINC000621317409 1053956303 /nfs/dbraw/zinc/95/63/03/1053956303.db2.gz AKMCRGFNNWITCZ-AWEZNQCLSA-N 1 2 305.422 4.458 20 0 DIADLO CCCC[N@@H+](Cc1nc(C(C)C)no1)[C@@H](C)c1ccc(C)o1 ZINC000621317409 1053956315 /nfs/dbraw/zinc/95/63/15/1053956315.db2.gz AKMCRGFNNWITCZ-AWEZNQCLSA-N 1 2 305.422 4.458 20 0 DIADLO Cc1cc(C)c(CNC(=O)C[C@H]2C[C@@H](C)c3c2cccc3C)c[nH+]1 ZINC001436735466 1053958895 /nfs/dbraw/zinc/95/88/95/1053958895.db2.gz FEFAXYZHMVZWEG-NVXWUHKLSA-N 1 2 322.452 4.304 20 0 DIADLO Brc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccns1 ZINC001232188113 1053981446 /nfs/dbraw/zinc/98/14/46/1053981446.db2.gz BGTNKMIBAIGLJG-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccns1 ZINC001232188113 1053981459 /nfs/dbraw/zinc/98/14/59/1053981459.db2.gz BGTNKMIBAIGLJG-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO O=c1[nH]c2ccccc2cc1C[NH2+][C@@H](C(F)F)C1CCCCC1 ZINC000621403927 1053967855 /nfs/dbraw/zinc/96/78/55/1053967855.db2.gz CNUVTLHCMXGVAC-MRXNPFEDSA-N 1 2 320.383 4.244 20 0 DIADLO C[N@H+](Cc1cnc(-c2cccnc2)o1)Cc1ccccc1Cl ZINC001232134421 1053968539 /nfs/dbraw/zinc/96/85/39/1053968539.db2.gz CSKXKWCVJMLPKD-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1cnc(-c2cccnc2)o1)Cc1ccccc1Cl ZINC001232134421 1053968553 /nfs/dbraw/zinc/96/85/53/1053968553.db2.gz CSKXKWCVJMLPKD-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2nc(Cl)ccc2F)c1 ZINC001232162735 1053974534 /nfs/dbraw/zinc/97/45/34/1053974534.db2.gz SYABGCGJLLROAP-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2nc(Cl)ccc2F)c1 ZINC001232162735 1053974543 /nfs/dbraw/zinc/97/45/43/1053974543.db2.gz SYABGCGJLLROAP-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1nc(Cl)ccc1F ZINC001232162122 1053974864 /nfs/dbraw/zinc/97/48/64/1053974864.db2.gz ANCICSRBSOOJRC-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1nc(Cl)ccc1F ZINC001232162122 1053974875 /nfs/dbraw/zinc/97/48/75/1053974875.db2.gz ANCICSRBSOOJRC-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2nc(Cl)ccc2F)c1 ZINC001232162733 1053974998 /nfs/dbraw/zinc/97/49/98/1053974998.db2.gz SYABGCGJLLROAP-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2nc(Cl)ccc2F)c1 ZINC001232162733 1053975009 /nfs/dbraw/zinc/97/50/09/1053975009.db2.gz SYABGCGJLLROAP-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(CC(C)C)c3ccc(C)cc3)ccn12 ZINC001436878161 1053982687 /nfs/dbraw/zinc/98/26/87/1053982687.db2.gz HACJSVINWVPGBO-UHFFFAOYSA-N 1 2 321.424 4.254 20 0 DIADLO Clc1ccc(-c2ccccc2C[N@@H+]2CCn3cncc3C2)cc1 ZINC001232195065 1053985687 /nfs/dbraw/zinc/98/56/87/1053985687.db2.gz OCFVDWBZACHPRT-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Clc1ccc(-c2ccccc2C[N@H+]2CCn3cncc3C2)cc1 ZINC001232195065 1053985693 /nfs/dbraw/zinc/98/56/93/1053985693.db2.gz OCFVDWBZACHPRT-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccnc3c(F)cccc23)no1 ZINC001232207375 1053988161 /nfs/dbraw/zinc/98/81/61/1053988161.db2.gz IDJMEGXGRBCHIE-QGZVFWFLSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccnc3c(F)cccc23)no1 ZINC001232207375 1053988176 /nfs/dbraw/zinc/98/81/76/1053988176.db2.gz IDJMEGXGRBCHIE-QGZVFWFLSA-N 1 2 311.360 4.007 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001329521163 1053993927 /nfs/dbraw/zinc/99/39/27/1053993927.db2.gz GRYZFGGJBDJLDU-TZMCWYRMSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001329521163 1053993942 /nfs/dbraw/zinc/99/39/42/1053993942.db2.gz GRYZFGGJBDJLDU-TZMCWYRMSA-N 1 2 323.362 4.240 20 0 DIADLO Cc1nccnc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000621711521 1053995449 /nfs/dbraw/zinc/99/54/49/1053995449.db2.gz XLYLDMPLVSXNSA-INIZCTEOSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1nccnc1C[N@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000621711521 1053995460 /nfs/dbraw/zinc/99/54/60/1053995460.db2.gz XLYLDMPLVSXNSA-INIZCTEOSA-N 1 2 322.239 4.429 20 0 DIADLO F[C@H]1C[N@H+](Cc2cccn2Cc2ccccc2)CCCC1(F)F ZINC001232236083 1053997742 /nfs/dbraw/zinc/99/77/42/1053997742.db2.gz PVIUISYPEZHVJU-KRWDZBQOSA-N 1 2 322.374 4.106 20 0 DIADLO F[C@H]1C[N@@H+](Cc2cccn2Cc2ccccc2)CCCC1(F)F ZINC001232236083 1053997748 /nfs/dbraw/zinc/99/77/48/1053997748.db2.gz PVIUISYPEZHVJU-KRWDZBQOSA-N 1 2 322.374 4.106 20 0 DIADLO F[C@@H]1C[N@H+](Cc2cccn2Cc2ccccc2)CCCC1(F)F ZINC001232236084 1053999709 /nfs/dbraw/zinc/99/97/09/1053999709.db2.gz PVIUISYPEZHVJU-QGZVFWFLSA-N 1 2 322.374 4.106 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2cccn2Cc2ccccc2)CCCC1(F)F ZINC001232236084 1053999723 /nfs/dbraw/zinc/99/97/23/1053999723.db2.gz PVIUISYPEZHVJU-QGZVFWFLSA-N 1 2 322.374 4.106 20 0 DIADLO Cc1nnc(C[N@@H+]2CCCC[C@H]2c2ccc(C)c(C)c2)s1 ZINC001232246835 1054003716 /nfs/dbraw/zinc/00/37/16/1054003716.db2.gz UOVJIIDENAXTSF-INIZCTEOSA-N 1 2 301.459 4.191 20 0 DIADLO Cc1nnc(C[N@H+]2CCCC[C@H]2c2ccc(C)c(C)c2)s1 ZINC001232246835 1054003727 /nfs/dbraw/zinc/00/37/27/1054003727.db2.gz UOVJIIDENAXTSF-INIZCTEOSA-N 1 2 301.459 4.191 20 0 DIADLO CC1(c2ccccc2)C[NH+](Cc2coc(-c3ccccc3)n2)C1 ZINC000621734194 1054004891 /nfs/dbraw/zinc/00/48/91/1054004891.db2.gz HNXXSPQLVUZTGY-UHFFFAOYSA-N 1 2 304.393 4.115 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+]CC[C@H]2CC2(F)F)C(F)F)c1 ZINC000621767311 1054013344 /nfs/dbraw/zinc/01/33/44/1054013344.db2.gz BMWJCXUCXQQTOV-JSGCOSHPSA-N 1 2 319.342 4.415 20 0 DIADLO CSc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)cn1 ZINC001232328695 1054019178 /nfs/dbraw/zinc/01/91/78/1054019178.db2.gz LMGQLEXNMZCVMH-MRXNPFEDSA-N 1 2 320.408 4.419 20 0 DIADLO CSc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)cn1 ZINC001232328695 1054019187 /nfs/dbraw/zinc/01/91/87/1054019187.db2.gz LMGQLEXNMZCVMH-MRXNPFEDSA-N 1 2 320.408 4.419 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ccccc2Cl)c(C)n1 ZINC001232310969 1054019416 /nfs/dbraw/zinc/01/94/16/1054019416.db2.gz CYBPXVUCHQDRBV-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ccccc2Cl)c(C)n1 ZINC001232310969 1054019431 /nfs/dbraw/zinc/01/94/31/1054019431.db2.gz CYBPXVUCHQDRBV-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CC(C)C[C@@H](C(=O)N[C@@H]1CCCC12CCCCC2)n1cc[nH+]c1 ZINC001300770100 1054020847 /nfs/dbraw/zinc/02/08/47/1054020847.db2.gz NQZVGDLZIIESHZ-DLBZAZTESA-N 1 2 317.477 4.090 20 0 DIADLO C[C@H](c1ccco1)c1noc([C@H]2CCC[N@@H+]2Cc2ccccc2)n1 ZINC000621795447 1054022447 /nfs/dbraw/zinc/02/24/47/1054022447.db2.gz ISNPQLILRIPLTN-GDBMZVCRSA-N 1 2 323.396 4.152 20 0 DIADLO C[C@H](c1ccco1)c1noc([C@H]2CCC[N@H+]2Cc2ccccc2)n1 ZINC000621795447 1054022453 /nfs/dbraw/zinc/02/24/53/1054022453.db2.gz ISNPQLILRIPLTN-GDBMZVCRSA-N 1 2 323.396 4.152 20 0 DIADLO COc1cc(C)c(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)cn1 ZINC001232352371 1054027585 /nfs/dbraw/zinc/02/75/85/1054027585.db2.gz LLDXOYACISJJMC-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C)c(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)cn1 ZINC001232352371 1054027593 /nfs/dbraw/zinc/02/75/93/1054027593.db2.gz LLDXOYACISJJMC-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C[N@@H+]2CC[C@H]2c2ccccc2)c(OC)cc1Cl ZINC001232372573 1054030153 /nfs/dbraw/zinc/03/01/53/1054030153.db2.gz AIBHPMBVZJYYBJ-INIZCTEOSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(C[N@H+]2CC[C@H]2c2ccccc2)c(OC)cc1Cl ZINC001232372573 1054030163 /nfs/dbraw/zinc/03/01/63/1054030163.db2.gz AIBHPMBVZJYYBJ-INIZCTEOSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@](C)(F)C2)c(OC)cc1Cl ZINC001232370728 1054030778 /nfs/dbraw/zinc/03/07/78/1054030778.db2.gz ULPBNUFBXVZLRR-INIZCTEOSA-N 1 2 315.816 4.071 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@](C)(F)C2)c(OC)cc1Cl ZINC001232370728 1054030794 /nfs/dbraw/zinc/03/07/94/1054030794.db2.gz ULPBNUFBXVZLRR-INIZCTEOSA-N 1 2 315.816 4.071 20 0 DIADLO CCOc1ccc(OC)cc1C[N@H+](C)Cc1ccccc1Cl ZINC001232381834 1054034758 /nfs/dbraw/zinc/03/47/58/1054034758.db2.gz ARLFLVBEOOELJT-UHFFFAOYSA-N 1 2 319.832 4.379 20 0 DIADLO CCOc1ccc(OC)cc1C[N@@H+](C)Cc1ccccc1Cl ZINC001232381834 1054034770 /nfs/dbraw/zinc/03/47/70/1054034770.db2.gz ARLFLVBEOOELJT-UHFFFAOYSA-N 1 2 319.832 4.379 20 0 DIADLO Cc1cn2cc(NC(=S)Nc3ccccc3Cl)ccc2[nH+]1 ZINC001200852923 1054041533 /nfs/dbraw/zinc/04/15/33/1054041533.db2.gz QPIQESILHRUPCK-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO FC(F)(F)c1ccc(C[NH+]2CCC(C(F)(F)F)CC2)o1 ZINC001232442046 1054042785 /nfs/dbraw/zinc/04/27/85/1054042785.db2.gz WGHMMFDTULRLOO-UHFFFAOYSA-N 1 2 301.230 4.073 20 0 DIADLO CC(C)(C)[C@@H]([NH2+]Cc1nc(CC2CC2)no1)c1cccc(F)c1 ZINC001330673127 1054045003 /nfs/dbraw/zinc/04/50/03/1054045003.db2.gz UZMKKIFDMMLCCF-KRWDZBQOSA-N 1 2 317.408 4.038 20 0 DIADLO Cc1[nH]c(CN(Cc2c(Cl)cccc2Cl)C(C)C)c[nH+]1 ZINC001232464827 1054049849 /nfs/dbraw/zinc/04/98/49/1054049849.db2.gz MIGRICJBFZZRHG-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO Cc1[nH]cc(CN(Cc2c(Cl)cccc2Cl)C(C)C)[nH+]1 ZINC001232464827 1054049859 /nfs/dbraw/zinc/04/98/59/1054049859.db2.gz MIGRICJBFZZRHG-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO Cc1[nH]c(CN2CCCC[C@H]2c2ccccc2C(F)(F)F)c[nH+]1 ZINC001232467283 1054054684 /nfs/dbraw/zinc/05/46/84/1054054684.db2.gz FJSDGGMJQFJXLE-INIZCTEOSA-N 1 2 323.362 4.464 20 0 DIADLO Nc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001232512203 1054060639 /nfs/dbraw/zinc/06/06/39/1054060639.db2.gz YLLHYSXHHVJONG-MRXNPFEDSA-N 1 2 306.331 4.023 20 0 DIADLO Nc1ccc(F)cc1C[N@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001232512203 1054060648 /nfs/dbraw/zinc/06/06/48/1054060648.db2.gz YLLHYSXHHVJONG-MRXNPFEDSA-N 1 2 306.331 4.023 20 0 DIADLO Fc1cc(F)cc([C@H]2CCC[N@@H+]2Cc2nc3ccccc3o2)c1 ZINC001232559756 1054073808 /nfs/dbraw/zinc/07/38/08/1054073808.db2.gz DMSORXBCPXRIRY-MRXNPFEDSA-N 1 2 314.335 4.443 20 0 DIADLO Fc1cc(F)cc([C@H]2CCC[N@H+]2Cc2nc3ccccc3o2)c1 ZINC001232559756 1054073820 /nfs/dbraw/zinc/07/38/20/1054073820.db2.gz DMSORXBCPXRIRY-MRXNPFEDSA-N 1 2 314.335 4.443 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)c(C)[nH+]1 ZINC001355213440 1054083928 /nfs/dbraw/zinc/08/39/28/1054083928.db2.gz YVZBTZIZCZXSBR-SJLPKXTDSA-N 1 2 308.425 4.025 20 0 DIADLO CO[C@H](C)c1nc(CNc2cc(C)c3ccccc3[nH+]2)cs1 ZINC001331662236 1054084806 /nfs/dbraw/zinc/08/48/06/1054084806.db2.gz WADPROYZINNLNY-GFCCVEGCSA-N 1 2 313.426 4.319 20 0 DIADLO Fc1nccc(Cl)c1C[NH+]1CCC(c2cccs2)CC1 ZINC001232617166 1054086735 /nfs/dbraw/zinc/08/67/35/1054086735.db2.gz OBBBISBFLBFLOA-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO CC[N@H+](CC(=O)OC(C)(C)C)Cc1ccc2ccsc2c1 ZINC001232616260 1054086746 /nfs/dbraw/zinc/08/67/46/1054086746.db2.gz ODKOQYIBKWRTFS-UHFFFAOYSA-N 1 2 305.443 4.065 20 0 DIADLO CC[N@@H+](CC(=O)OC(C)(C)C)Cc1ccc2ccsc2c1 ZINC001232616260 1054086755 /nfs/dbraw/zinc/08/67/55/1054086755.db2.gz ODKOQYIBKWRTFS-UHFFFAOYSA-N 1 2 305.443 4.065 20 0 DIADLO FC(F)[C@@H](CCc1ccccc1)[NH2+]Cc1cccn1C1CC1 ZINC001331803736 1054090938 /nfs/dbraw/zinc/09/09/38/1054090938.db2.gz PHYCHNNGQHXGIU-QGZVFWFLSA-N 1 2 304.384 4.179 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2cnc(Cl)cc2Br)[C@H]1C ZINC001232682121 1054098379 /nfs/dbraw/zinc/09/83/79/1054098379.db2.gz WCDUIBQVFOCAHT-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2cnc(Cl)cc2Br)[C@H]1C ZINC001232682121 1054098386 /nfs/dbraw/zinc/09/83/86/1054098386.db2.gz WCDUIBQVFOCAHT-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cnc(Cl)cc2Br)[C@H]1C ZINC001232682123 1054098840 /nfs/dbraw/zinc/09/88/40/1054098840.db2.gz WCDUIBQVFOCAHT-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cnc(Cl)cc2Br)[C@H]1C ZINC001232682123 1054098851 /nfs/dbraw/zinc/09/88/51/1054098851.db2.gz WCDUIBQVFOCAHT-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cnc(Cl)cc1Br ZINC001232680674 1054100307 /nfs/dbraw/zinc/10/03/07/1054100307.db2.gz GFBJTBBGTTYQMO-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO c1csc([C@@H]2CCC[N@H+]2Cc2ccc3ncsc3c2)n1 ZINC001232742966 1054113799 /nfs/dbraw/zinc/11/37/99/1054113799.db2.gz JBCDOXJNJNUKSI-ZDUSSCGKSA-N 1 2 301.440 4.090 20 0 DIADLO c1csc([C@@H]2CCC[N@@H+]2Cc2ccc3ncsc3c2)n1 ZINC001232742966 1054113810 /nfs/dbraw/zinc/11/38/10/1054113810.db2.gz JBCDOXJNJNUKSI-ZDUSSCGKSA-N 1 2 301.440 4.090 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc3ncsc3c2)[C@@H](c2ccccc2)CO1 ZINC001232744324 1054115956 /nfs/dbraw/zinc/11/59/56/1054115956.db2.gz PDVVBCICIWZRSF-KBXCAEBGSA-N 1 2 324.449 4.258 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc3ncsc3c2)[C@@H](c2ccccc2)CO1 ZINC001232744324 1054115965 /nfs/dbraw/zinc/11/59/65/1054115965.db2.gz PDVVBCICIWZRSF-KBXCAEBGSA-N 1 2 324.449 4.258 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)c(F)c2)nn1 ZINC001332419966 1054119404 /nfs/dbraw/zinc/11/94/04/1054119404.db2.gz HXPLKUQSGOYRCA-QWRGUYRKSA-N 1 2 310.804 4.063 20 0 DIADLO Cc1cc(N[C@H](c2ccccc2)[C@@H]2CCCO2)nc(C(C)C)[nH+]1 ZINC000505778197 1054125059 /nfs/dbraw/zinc/12/50/59/1054125059.db2.gz RNGAWIKJQZYEHW-FUHWJXTLSA-N 1 2 311.429 4.241 20 0 DIADLO COc1cc(O)cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c1 ZINC001232806162 1054126009 /nfs/dbraw/zinc/12/60/09/1054126009.db2.gz BBVHGERZQRMFPS-SFHVURJKSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cc(O)cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)c1 ZINC001232806162 1054126016 /nfs/dbraw/zinc/12/60/16/1054126016.db2.gz BBVHGERZQRMFPS-SFHVURJKSA-N 1 2 319.351 4.016 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(F)c(F)c2Cl)CCC1(F)F ZINC001232873841 1054134683 /nfs/dbraw/zinc/13/46/83/1054134683.db2.gz JBTYCMFIQUJOEY-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(F)c(F)c2Cl)CCC1(F)F ZINC001232873841 1054134698 /nfs/dbraw/zinc/13/46/98/1054134698.db2.gz JBTYCMFIQUJOEY-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO CC(C)c1ccccc1C[NH2+]Cc1nnc(-c2ccc(F)cc2)[nH]1 ZINC000848541030 1054135358 /nfs/dbraw/zinc/13/53/58/1054135358.db2.gz YFUBYDHGSSSQOZ-UHFFFAOYSA-N 1 2 324.403 4.024 20 0 DIADLO CC(C)c1ccccc1C[NH2+]Cc1nc(-c2ccc(F)cc2)n[nH]1 ZINC000848541030 1054135370 /nfs/dbraw/zinc/13/53/70/1054135370.db2.gz YFUBYDHGSSSQOZ-UHFFFAOYSA-N 1 2 324.403 4.024 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2cncc(-c3ccccc3)c2)C[C@H]1F ZINC001232899787 1054144488 /nfs/dbraw/zinc/14/44/88/1054144488.db2.gz UIQZDLOQZZXHCD-MSOLQXFVSA-N 1 2 302.368 4.021 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2cncc(-c3ccccc3)c2)C[C@H]1F ZINC001232899787 1054144497 /nfs/dbraw/zinc/14/44/97/1054144497.db2.gz UIQZDLOQZZXHCD-MSOLQXFVSA-N 1 2 302.368 4.021 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2cncc(-c3ccccc3)c2)C[C@@H]1F ZINC001232899795 1054144688 /nfs/dbraw/zinc/14/46/88/1054144688.db2.gz UIQZDLOQZZXHCD-ROUUACIJSA-N 1 2 302.368 4.021 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2cncc(-c3ccccc3)c2)C[C@@H]1F ZINC001232899795 1054144694 /nfs/dbraw/zinc/14/46/94/1054144694.db2.gz UIQZDLOQZZXHCD-ROUUACIJSA-N 1 2 302.368 4.021 20 0 DIADLO CC[C@@H]([NH2+]Cc1occc1Br)c1ccccc1F ZINC000848556803 1054147729 /nfs/dbraw/zinc/14/77/29/1054147729.db2.gz CNBYBBANPVUUEW-CYBMUJFWSA-N 1 2 312.182 4.422 20 0 DIADLO CC(C)[C@@H]([NH2+][C@H](C)c1ncccn1)c1ccc(Cl)cc1F ZINC001333300019 1054148803 /nfs/dbraw/zinc/14/88/03/1054148803.db2.gz OXKKCSQHJTUGOZ-IAQYHMDHSA-N 1 2 307.800 4.317 20 0 DIADLO Oc1c(F)ccc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c1F ZINC001232936357 1054148955 /nfs/dbraw/zinc/14/89/55/1054148955.db2.gz BFNHWJJPKVMMGU-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1c(F)ccc(C[N@@H+]2CCC[C@H](Cc3ccccc3)C2)c1F ZINC001232935812 1054151007 /nfs/dbraw/zinc/15/10/07/1054151007.db2.gz MYFDYLKCIORDEE-OAHLLOKOSA-N 1 2 317.379 4.125 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)nc1)c1nc(C(F)(F)F)cs1 ZINC001333495801 1054156241 /nfs/dbraw/zinc/15/62/41/1054156241.db2.gz FHMWIUUMMKUPLD-YUMQZZPRSA-N 1 2 319.327 4.108 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1csc(C(F)(F)F)n1 ZINC001333646637 1054163769 /nfs/dbraw/zinc/16/37/69/1054163769.db2.gz SESBDEAEJKWORX-UHFFFAOYSA-N 1 2 315.364 4.148 20 0 DIADLO Cc1nn(C(C)C)c(C)c1CNc1ccc([NH+]2CCCC2)cc1 ZINC001333645126 1054164465 /nfs/dbraw/zinc/16/44/65/1054164465.db2.gz CZVQQDJLXZVPHT-UHFFFAOYSA-N 1 2 312.461 4.293 20 0 DIADLO Cc1ncc(F)cc1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001232990412 1054165810 /nfs/dbraw/zinc/16/58/10/1054165810.db2.gz YMJRITYEONDOQP-KRWDZBQOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1ncc(F)cc1C[N@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001232990412 1054165816 /nfs/dbraw/zinc/16/58/16/1054165816.db2.gz YMJRITYEONDOQP-KRWDZBQOSA-N 1 2 306.331 4.144 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]CCCC(F)(F)F)cc2)C[C@@H](C)O1 ZINC001333697406 1054168626 /nfs/dbraw/zinc/16/86/26/1054168626.db2.gz OGEZRQICRRFUTB-CHWSQXEVSA-N 1 2 316.367 4.055 20 0 DIADLO Cc1ncc(F)cc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001232991467 1054168715 /nfs/dbraw/zinc/16/87/15/1054168715.db2.gz BPZLKNQGUATDQY-QGZVFWFLSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1ncc(F)cc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001232991467 1054168719 /nfs/dbraw/zinc/16/87/19/1054168719.db2.gz BPZLKNQGUATDQY-QGZVFWFLSA-N 1 2 306.331 4.144 20 0 DIADLO C[C@H]1CN(c2ccc([NH2+]CCCC(F)(F)F)cc2)C[C@H](C)O1 ZINC001333697407 1054168927 /nfs/dbraw/zinc/16/89/27/1054168927.db2.gz OGEZRQICRRFUTB-STQMWFEESA-N 1 2 316.367 4.055 20 0 DIADLO CC(C)c1ocnc1C[NH2+][C@H]1CC2(CCC2)Oc2ccccc21 ZINC001333738890 1054170435 /nfs/dbraw/zinc/17/04/35/1054170435.db2.gz GBYJMWMMTMPFMX-HNNXBMFYSA-N 1 2 312.413 4.334 20 0 DIADLO FC(F)(F)CCC[N@@H+]1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC001333766476 1054170776 /nfs/dbraw/zinc/17/07/76/1054170776.db2.gz AJQHSGBZKXLILT-CYBMUJFWSA-N 1 2 307.743 4.056 20 0 DIADLO FC(F)(F)CCC[N@H+]1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC001333766476 1054170787 /nfs/dbraw/zinc/17/07/87/1054170787.db2.gz AJQHSGBZKXLILT-CYBMUJFWSA-N 1 2 307.743 4.056 20 0 DIADLO CCOC(=O)c1ccsc1C[N@H+](CC)Cc1cccc(F)c1 ZINC001233021872 1054173161 /nfs/dbraw/zinc/17/31/61/1054173161.db2.gz SRMWZRQMYOOPGM-UHFFFAOYSA-N 1 2 321.417 4.086 20 0 DIADLO CCOC(=O)c1ccsc1C[N@@H+](CC)Cc1cccc(F)c1 ZINC001233021872 1054173173 /nfs/dbraw/zinc/17/31/73/1054173173.db2.gz SRMWZRQMYOOPGM-UHFFFAOYSA-N 1 2 321.417 4.086 20 0 DIADLO CCOC(=O)c1ccsc1C[N@@H+]1CCc2ccccc2[C@H]1C ZINC001233016968 1054174844 /nfs/dbraw/zinc/17/48/44/1054174844.db2.gz BVKHFZMMQCNKEY-CYBMUJFWSA-N 1 2 315.438 4.044 20 0 DIADLO CCOC(=O)c1ccsc1C[N@H+]1CCc2ccccc2[C@H]1C ZINC001233016968 1054174855 /nfs/dbraw/zinc/17/48/55/1054174855.db2.gz BVKHFZMMQCNKEY-CYBMUJFWSA-N 1 2 315.438 4.044 20 0 DIADLO CCOC(=O)c1ccsc1C[N@H+](C)Cc1ccc(Cl)cc1 ZINC001233020675 1054175210 /nfs/dbraw/zinc/17/52/10/1054175210.db2.gz PHOSXWBUPARHOY-UHFFFAOYSA-N 1 2 323.845 4.210 20 0 DIADLO CCOC(=O)c1ccsc1C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001233020675 1054175218 /nfs/dbraw/zinc/17/52/18/1054175218.db2.gz PHOSXWBUPARHOY-UHFFFAOYSA-N 1 2 323.845 4.210 20 0 DIADLO C[N@H+](Cc1cccc(C(F)(F)F)c1)Cc1cccc(O)c1F ZINC001233053043 1054176424 /nfs/dbraw/zinc/17/64/24/1054176424.db2.gz HXJWLXNRTSKFNU-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO C[N@@H+](Cc1cccc(C(F)(F)F)c1)Cc1cccc(O)c1F ZINC001233053043 1054176429 /nfs/dbraw/zinc/17/64/29/1054176429.db2.gz HXJWLXNRTSKFNU-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO COCC[C@H]([NH2+]Cc1nc(C)c(C(C)(C)C)s1)c1ccco1 ZINC001334050357 1054180578 /nfs/dbraw/zinc/18/05/78/1054180578.db2.gz ZGKYDYZHUVLGPH-ZDUSSCGKSA-N 1 2 322.474 4.209 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3nccn3C3CC3)CCCC2)c(F)c1 ZINC001334202096 1054184212 /nfs/dbraw/zinc/18/42/12/1054184212.db2.gz WYVOAGDWFJPLRQ-UHFFFAOYSA-N 1 2 317.383 4.055 20 0 DIADLO CCOc1c(Cl)cc(C[N@H+](C)Cc2ccno2)cc1Cl ZINC001233107424 1054185046 /nfs/dbraw/zinc/18/50/46/1054185046.db2.gz LWPIXVISWMQCEI-UHFFFAOYSA-N 1 2 315.200 4.012 20 0 DIADLO CCOc1c(Cl)cc(C[N@@H+](C)Cc2ccno2)cc1Cl ZINC001233107424 1054185050 /nfs/dbraw/zinc/18/50/50/1054185050.db2.gz LWPIXVISWMQCEI-UHFFFAOYSA-N 1 2 315.200 4.012 20 0 DIADLO Fc1ccc2c(c1)[nH]nc2C[N@@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC001233123827 1054187737 /nfs/dbraw/zinc/18/77/37/1054187737.db2.gz CWSPRKCDWXAHSS-INIZCTEOSA-N 1 2 323.415 4.157 20 0 DIADLO Fc1ccc2c(c1)[nH]nc2C[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC001233123827 1054187743 /nfs/dbraw/zinc/18/77/43/1054187743.db2.gz CWSPRKCDWXAHSS-INIZCTEOSA-N 1 2 323.415 4.157 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccc(Cl)c(F)c2F)CCC1(F)F ZINC001233207993 1054202221 /nfs/dbraw/zinc/20/22/21/1054202221.db2.gz SVDBUESJRXCGES-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccc(Cl)c(F)c2F)CCC1(F)F ZINC001233207993 1054202228 /nfs/dbraw/zinc/20/22/28/1054202228.db2.gz SVDBUESJRXCGES-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO COc1ccccc1C1([NH2+][C@@H]2CCCc3scnc32)CCC1 ZINC001334908384 1054204422 /nfs/dbraw/zinc/20/44/22/1054204422.db2.gz WSWSPNHXCOVJJS-CQSZACIVSA-N 1 2 314.454 4.198 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@]2(C)CCOc3ccccc32)cs1 ZINC001335191056 1054210610 /nfs/dbraw/zinc/21/06/10/1054210610.db2.gz YDNUGBPFNKYBKS-KRWDZBQOSA-N 1 2 302.443 4.054 20 0 DIADLO Cc1cc(CNc2cc(C(F)(F)F)cc(Cl)n2)cc(C)[nH+]1 ZINC000848726865 1054211637 /nfs/dbraw/zinc/21/16/37/1054211637.db2.gz XUZSDIIRABGHOB-UHFFFAOYSA-N 1 2 315.726 4.378 20 0 DIADLO C[N@H+](Cc1c(Cl)cc(Br)cc1Cl)C1CC1 ZINC001233246488 1054214319 /nfs/dbraw/zinc/21/43/19/1054214319.db2.gz LRNBTLCVXRURCA-UHFFFAOYSA-N 1 2 309.034 4.350 20 0 DIADLO C[N@@H+](Cc1c(Cl)cc(Br)cc1Cl)C1CC1 ZINC001233246488 1054214326 /nfs/dbraw/zinc/21/43/26/1054214326.db2.gz LRNBTLCVXRURCA-UHFFFAOYSA-N 1 2 309.034 4.350 20 0 DIADLO COCC[N@H+](Cc1nc(C)sc1C)Cc1ccc(C)cc1C ZINC001335414380 1054215344 /nfs/dbraw/zinc/21/53/44/1054215344.db2.gz XTTTWRBWCCETPA-UHFFFAOYSA-N 1 2 318.486 4.025 20 0 DIADLO COCC[N@@H+](Cc1nc(C)sc1C)Cc1ccc(C)cc1C ZINC001335414380 1054215354 /nfs/dbraw/zinc/21/53/54/1054215354.db2.gz XTTTWRBWCCETPA-UHFFFAOYSA-N 1 2 318.486 4.025 20 0 DIADLO Cc1cc(NCc2cccc(C(F)(F)F)n2)nc(C2CCC2)[nH+]1 ZINC001335501275 1054219623 /nfs/dbraw/zinc/21/96/23/1054219623.db2.gz PNDVVFPAKXHCAE-UHFFFAOYSA-N 1 2 322.334 4.078 20 0 DIADLO COc1c(O)cccc1C[N@@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001233257389 1054220400 /nfs/dbraw/zinc/22/04/00/1054220400.db2.gz FFMZHVIPSJFTPU-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1c(O)cccc1C[N@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001233257389 1054220411 /nfs/dbraw/zinc/22/04/11/1054220411.db2.gz FFMZHVIPSJFTPU-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1cnsc1C[N@@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC001233322265 1054232888 /nfs/dbraw/zinc/23/28/88/1054232888.db2.gz YKWOYOCQVKDHJN-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1cnsc1C[N@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC001233322265 1054232898 /nfs/dbraw/zinc/23/28/98/1054232898.db2.gz YKWOYOCQVKDHJN-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO c1ccc(Cc2ccc(C[N@@H+]3Cc4ccncc4C3)cc2)cc1 ZINC001233331085 1054235285 /nfs/dbraw/zinc/23/52/85/1054235285.db2.gz GVECUKVPBAMFBR-UHFFFAOYSA-N 1 2 300.405 4.188 20 0 DIADLO c1ccc(Cc2ccc(C[N@H+]3Cc4ccncc4C3)cc2)cc1 ZINC001233331085 1054235294 /nfs/dbraw/zinc/23/52/94/1054235294.db2.gz GVECUKVPBAMFBR-UHFFFAOYSA-N 1 2 300.405 4.188 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCCC[C@H]2c2cccnc2)cc1F ZINC001233343741 1054242786 /nfs/dbraw/zinc/24/27/86/1054242786.db2.gz ZEUQYAINNDUSPZ-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCCC[C@H]2c2cccnc2)cc1F ZINC001233343741 1054242803 /nfs/dbraw/zinc/24/28/03/1054242803.db2.gz ZEUQYAINNDUSPZ-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccc(C)nc2)cc1F ZINC001233344210 1054243557 /nfs/dbraw/zinc/24/35/57/1054243557.db2.gz TVQMQSFJOGQECC-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@H]2c2ccc(C)nc2)cc1F ZINC001233344210 1054243567 /nfs/dbraw/zinc/24/35/67/1054243567.db2.gz TVQMQSFJOGQECC-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO Cc1cc(N2CC3(CCC3)[C@@H]2c2cccnc2)nc(C2CCC2)[nH+]1 ZINC001336726412 1054244264 /nfs/dbraw/zinc/24/42/64/1054244264.db2.gz PLDBVKLBWQRPJS-SFHVURJKSA-N 1 2 320.440 4.179 20 0 DIADLO Cn1cc(-c2ccc(C[N@@H+]3Cc4cccc(Cl)c4C3)cc2)cn1 ZINC001336768208 1054246803 /nfs/dbraw/zinc/24/68/03/1054246803.db2.gz UXHQTOCQQNZYJD-UHFFFAOYSA-N 1 2 323.827 4.256 20 0 DIADLO Cn1cc(-c2ccc(C[N@H+]3Cc4cccc(Cl)c4C3)cc2)cn1 ZINC001336768208 1054246816 /nfs/dbraw/zinc/24/68/16/1054246816.db2.gz UXHQTOCQQNZYJD-UHFFFAOYSA-N 1 2 323.827 4.256 20 0 DIADLO Brc1ncsc1C[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC001238033866 1054254763 /nfs/dbraw/zinc/25/47/63/1054254763.db2.gz XLUPMQLSSYJCHE-GFCCVEGCSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ncsc1C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC001238033866 1054254777 /nfs/dbraw/zinc/25/47/77/1054254777.db2.gz XLUPMQLSSYJCHE-GFCCVEGCSA-N 1 2 323.259 4.243 20 0 DIADLO C[N@H+](Cc1cccc2ccccc21)Cc1c(F)ccc(O)c1F ZINC001233395803 1054258738 /nfs/dbraw/zinc/25/87/38/1054258738.db2.gz QVHIXMOLMRUECP-UHFFFAOYSA-N 1 2 313.347 4.456 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1)Cc1ccc(OC)c(O)c1Cl ZINC001233400909 1054258852 /nfs/dbraw/zinc/25/88/52/1054258852.db2.gz DGIVSCIIPGILBH-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)ccc(O)c2F)cc1 ZINC001233395618 1054261085 /nfs/dbraw/zinc/26/10/85/1054261085.db2.gz FQKZUPZLBBLKIR-INIZCTEOSA-N 1 2 303.352 4.316 20 0 DIADLO CC[C@H](C)[C@H](C)C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001337683702 1054279898 /nfs/dbraw/zinc/27/98/98/1054279898.db2.gz GROZBEZYSSVNAV-JYJNAYRXSA-N 1 2 319.493 4.026 20 0 DIADLO CC[C@H](C)[C@H](C)C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001337683701 1054280803 /nfs/dbraw/zinc/28/08/03/1054280803.db2.gz GROZBEZYSSVNAV-HRCADAONSA-N 1 2 319.493 4.026 20 0 DIADLO Cn1c(Cl)ncc1C[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC000848881764 1054281349 /nfs/dbraw/zinc/28/13/49/1054281349.db2.gz RUEVXTJSJNIQQM-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1c(Cl)ncc1C[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000848881764 1054281362 /nfs/dbraw/zinc/28/13/62/1054281362.db2.gz RUEVXTJSJNIQQM-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO CC(C)c1ccccc1C[NH2+]Cc1nc(-c2ccccc2)no1 ZINC000848902379 1054291949 /nfs/dbraw/zinc/29/19/49/1054291949.db2.gz CLVQOXRJUHLWGZ-UHFFFAOYSA-N 1 2 307.397 4.150 20 0 DIADLO Cn1c(Cl)ncc1C[N@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC000848908431 1054293629 /nfs/dbraw/zinc/29/36/29/1054293629.db2.gz UFGOLAOWOFSVHD-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1c(Cl)ncc1C[N@@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC000848908431 1054293637 /nfs/dbraw/zinc/29/36/37/1054293637.db2.gz UFGOLAOWOFSVHD-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Clc1cccc2nc(C[N@@H+]3CCC[C@H]3c3cccs3)cn21 ZINC001233592857 1054305498 /nfs/dbraw/zinc/30/54/98/1054305498.db2.gz VXLVVASDKLZFDF-ZDUSSCGKSA-N 1 2 317.845 4.386 20 0 DIADLO Clc1cccc2nc(C[N@H+]3CCC[C@H]3c3cccs3)cn21 ZINC001233592857 1054305510 /nfs/dbraw/zinc/30/55/10/1054305510.db2.gz VXLVVASDKLZFDF-ZDUSSCGKSA-N 1 2 317.845 4.386 20 0 DIADLO C[C@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)[C@H](C)C(C)(C)C ZINC001356297765 1054316725 /nfs/dbraw/zinc/31/67/25/1054316725.db2.gz YRWFIHLOCICQIW-STQMWFEESA-N 1 2 317.408 4.268 20 0 DIADLO Cc1cc(C)c(CNC(=O)CC(C)(C)C2CCCCC2)c[nH+]1 ZINC000622667879 1054331513 /nfs/dbraw/zinc/33/15/13/1054331513.db2.gz WWYIUSAVAYFGSL-UHFFFAOYSA-N 1 2 302.462 4.311 20 0 DIADLO Cc1cc(NC[C@H](CCO)c2ccccc2)[nH+]c2ccccc12 ZINC001339412924 1054336232 /nfs/dbraw/zinc/33/62/32/1054336232.db2.gz AWVAZSOHZKDFJE-KRWDZBQOSA-N 1 2 306.409 4.121 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccccc1F ZINC000171121917 1054347458 /nfs/dbraw/zinc/34/74/58/1054347458.db2.gz SJXBSDZCPBIUCB-NSHDSACASA-N 1 2 302.374 4.393 20 0 DIADLO NC(Cc1ccccc1)=[NH+]OCc1cnc(-c2ccccc2)s1 ZINC001340323650 1054359880 /nfs/dbraw/zinc/35/98/80/1054359880.db2.gz FBINRSJCYVEOKY-UHFFFAOYSA-N 1 2 323.421 4.051 20 0 DIADLO CCc1ccccc1NC(=O)[C@H]1CC[C@@H](Nc2cccc[nH+]2)CC1 ZINC001440900154 1054374763 /nfs/dbraw/zinc/37/47/63/1054374763.db2.gz SYGKHBUEGVICOB-CALCHBBNSA-N 1 2 323.440 4.253 20 0 DIADLO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1coc(C(C)(C)C)n1 ZINC001341106405 1054378481 /nfs/dbraw/zinc/37/84/81/1054378481.db2.gz TUHISNFJHSLOEX-GFCCVEGCSA-N 1 2 318.465 4.083 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc([S@@](C)=O)cc2)[nH+]c2ccccc12 ZINC001341155293 1054379011 /nfs/dbraw/zinc/37/90/11/1054379011.db2.gz NFSVEDGBUGDJQW-QKFKETGDSA-N 1 2 324.449 4.454 20 0 DIADLO CC(C)C[C@H](C(=O)N(CC1CCCCC1)C1CC1)n1cc[nH+]c1 ZINC001441887500 1054400699 /nfs/dbraw/zinc/40/06/99/1054400699.db2.gz GAKCYIKHVDKWAK-GOSISDBHSA-N 1 2 317.477 4.042 20 0 DIADLO Cc1cc(NCc2ccc(OC(F)F)cc2)nc(C(C)C)[nH+]1 ZINC000484129045 1054401416 /nfs/dbraw/zinc/40/14/16/1054401416.db2.gz BFYBLXYHQGNEAB-UHFFFAOYSA-N 1 2 307.344 4.122 20 0 DIADLO Cc1cc(NC[C@@H](c2ccccc2)C(F)(F)F)nc(C2CC2)[nH+]1 ZINC000486026214 1054410047 /nfs/dbraw/zinc/41/00/47/1054410047.db2.gz FQGWBBZEYCWBSY-AWEZNQCLSA-N 1 2 321.346 4.420 20 0 DIADLO Cc1cc(N[C@H](C)[C@H]2OCCc3sccc32)nc(C(C)C)[nH+]1 ZINC000488741966 1054433645 /nfs/dbraw/zinc/43/36/45/1054433645.db2.gz CPNKLISYGSTLAF-MLGOLLRUSA-N 1 2 317.458 4.084 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1cccnc1Cl ZINC001343320970 1054441604 /nfs/dbraw/zinc/44/16/04/1054441604.db2.gz FPPYHBATYDUBPG-UHFFFAOYSA-N 1 2 314.820 4.452 20 0 DIADLO Cc1cc(C)c(C(=O)NCC2(c3ccccc3)CCCC2)c(C)[nH+]1 ZINC001357254925 1054445922 /nfs/dbraw/zinc/44/59/22/1054445922.db2.gz RBOIPYIAFGGGGW-UHFFFAOYSA-N 1 2 322.452 4.249 20 0 DIADLO Cc1cc(NC(=O)CCCc2ccccc2)ccc1-n1cc[nH+]c1 ZINC001443313442 1054446388 /nfs/dbraw/zinc/44/63/88/1054446388.db2.gz OBSPKAZILDERON-UHFFFAOYSA-N 1 2 319.408 4.142 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCc1cccnc1C ZINC001343588560 1054450546 /nfs/dbraw/zinc/45/05/46/1054450546.db2.gz VMQAYLULZXADCN-UHFFFAOYSA-N 1 2 309.438 4.318 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@@H]1CCC[C@@H]2CCCC[C@@H]12 ZINC001357288498 1054452104 /nfs/dbraw/zinc/45/21/04/1054452104.db2.gz AWUIVCRVPHBQPT-KFKAGJAMSA-N 1 2 323.440 4.417 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@@H]1CCC[C@@H]2CCCC[C@H]12 ZINC001357288499 1054452198 /nfs/dbraw/zinc/45/21/98/1054452198.db2.gz AWUIVCRVPHBQPT-ZYSHUDEJSA-N 1 2 323.440 4.417 20 0 DIADLO CC[C@@H]([NH2+]Cc1cccc(OC)c1Cl)c1nc(C)cs1 ZINC000660252025 1054453353 /nfs/dbraw/zinc/45/33/53/1054453353.db2.gz FURHYCUWPOCIDL-GFCCVEGCSA-N 1 2 310.850 4.354 20 0 DIADLO C[N@H+](Cc1noc(-c2ccccc2)n1)C(C)(C)c1ccccc1 ZINC000671245383 1054459348 /nfs/dbraw/zinc/45/93/48/1054459348.db2.gz AXKUSUOTEKHFRP-UHFFFAOYSA-N 1 2 307.397 4.104 20 0 DIADLO C[N@@H+](Cc1noc(-c2ccccc2)n1)C(C)(C)c1ccccc1 ZINC000671245383 1054459352 /nfs/dbraw/zinc/45/93/52/1054459352.db2.gz AXKUSUOTEKHFRP-UHFFFAOYSA-N 1 2 307.397 4.104 20 0 DIADLO CC(C)C[C@H](C(=O)N[C@@H](C)CCC1CCCCC1)n1cc[nH+]c1 ZINC001443972892 1054463997 /nfs/dbraw/zinc/46/39/97/1054463997.db2.gz ILDBZUZEEURJDD-FUHWJXTLSA-N 1 2 319.493 4.336 20 0 DIADLO CC[C@H](c1ccccc1)N(C(=O)C[C@@H](C)n1cc[nH+]c1)C(C)C ZINC000622977407 1054498681 /nfs/dbraw/zinc/49/86/81/1054498681.db2.gz ZZZCWABTADEFPC-SJLPKXTDSA-N 1 2 313.445 4.223 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CCC[C@H](F)C3)c2)[nH+]c1C ZINC001345639452 1054506072 /nfs/dbraw/zinc/50/60/72/1054506072.db2.gz UCCFCBVOVCIRCA-CABCVRRESA-N 1 2 315.392 4.160 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CCC[C@@H](F)C3)c2)[nH+]c1C ZINC001345639454 1054506259 /nfs/dbraw/zinc/50/62/59/1054506259.db2.gz UCCFCBVOVCIRCA-HUUCEWRRSA-N 1 2 315.392 4.160 20 0 DIADLO CC(C)Cn1ccnc1C[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC000174454272 1054508667 /nfs/dbraw/zinc/50/86/67/1054508667.db2.gz FNAPIVYINLLHDE-UHFFFAOYSA-N 1 2 309.413 4.089 20 0 DIADLO Cc1[nH]c(CNC(=O)c2ccc(C3CCCCC3)cc2)[nH+]c1C ZINC001445476066 1054509572 /nfs/dbraw/zinc/50/95/72/1054509572.db2.gz IONQDFGWZNKIMX-UHFFFAOYSA-N 1 2 311.429 4.004 20 0 DIADLO COc1ccc(/C(C)=C/C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC001357672113 1054523766 /nfs/dbraw/zinc/52/37/66/1054523766.db2.gz INNZTZWKCZNZSG-VAWYXSNFSA-N 1 2 310.397 4.057 20 0 DIADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCC[C@H]1CCC1CCCC1 ZINC001446106295 1054527044 /nfs/dbraw/zinc/52/70/44/1054527044.db2.gz IDGMAYXVMXQUDI-INIZCTEOSA-N 1 2 311.429 4.138 20 0 DIADLO Cc1c(Cl)c(Br)ccc1C[NH+]1CCC(F)CC1 ZINC001238215853 1054545800 /nfs/dbraw/zinc/54/58/00/1054545800.db2.gz OBKSPCKIUGLSHQ-UHFFFAOYSA-N 1 2 320.633 4.345 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@H](C)COc2cccc(C)c2)cc1 ZINC001234589249 1054551594 /nfs/dbraw/zinc/55/15/94/1054551594.db2.gz YDOAQJRJYFEEEJ-OAHLLOKOSA-N 1 2 313.397 4.203 20 0 DIADLO C[C@H]1CCC[N@H+]1Cc1cc(Cl)cc(Br)c1F ZINC001234968408 1054635158 /nfs/dbraw/zinc/63/51/58/1054635158.db2.gz JJKHRALEIHYMKH-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO CCC(C)(CC)C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001347537598 1054571956 /nfs/dbraw/zinc/57/19/56/1054571956.db2.gz YHCYKHKGZASBJB-OAHLLOKOSA-N 1 2 319.493 4.170 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CCC[C@H](F)CC2)c(Br)c1 ZINC001234734440 1054583527 /nfs/dbraw/zinc/58/35/27/1054583527.db2.gz LRWQRSBWRMNRJX-VIFPVBQESA-N 1 2 322.168 4.051 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CCC[C@H](F)CC2)c(Br)c1 ZINC001234734440 1054583540 /nfs/dbraw/zinc/58/35/40/1054583540.db2.gz LRWQRSBWRMNRJX-VIFPVBQESA-N 1 2 322.168 4.051 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CCCCC23CC3)c(Br)c1 ZINC001234771364 1054588102 /nfs/dbraw/zinc/58/81/02/1054588102.db2.gz OKIZWMAXOQRSQM-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CCCCC23CC3)c(Br)c1 ZINC001234771364 1054588119 /nfs/dbraw/zinc/58/81/19/1054588119.db2.gz OKIZWMAXOQRSQM-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO CC(C)[C@]1(C)C[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001358056035 1054589323 /nfs/dbraw/zinc/58/93/23/1054589323.db2.gz KLJLCFPQZTYXGY-DYVFJYSZSA-N 1 2 317.820 4.146 20 0 DIADLO COC[C@H]([NH2+]Cc1csc(C(F)(F)F)c1)c1ccc(C)o1 ZINC000623438155 1054593128 /nfs/dbraw/zinc/59/31/28/1054593128.db2.gz OHTBUHMBXNRYAT-NSHDSACASA-N 1 2 319.348 4.146 20 0 DIADLO CCCC[C@@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)C(C)C ZINC001358066641 1054592795 /nfs/dbraw/zinc/59/27/95/1054592795.db2.gz BHEKHZIZEAGJLH-OAHLLOKOSA-N 1 2 317.408 4.412 20 0 DIADLO CCc1cnc(C[NH2+]Cc2csc(C(F)(F)F)c2)s1 ZINC000623433178 1054595322 /nfs/dbraw/zinc/59/53/22/1054595322.db2.gz DCAWROASDNLNOQ-UHFFFAOYSA-N 1 2 306.378 4.076 20 0 DIADLO C[C@H](CC(=O)Nc1ccccc1-c1ccccc1)n1cc[nH+]c1 ZINC001348068005 1054610402 /nfs/dbraw/zinc/61/04/02/1054610402.db2.gz ZASCNIONGWWPPR-OAHLLOKOSA-N 1 2 305.381 4.140 20 0 DIADLO CC(C)(C)c1nc(C[NH+]2CC(c3ccc(F)cc3)C2)cs1 ZINC001348074951 1054610884 /nfs/dbraw/zinc/61/08/84/1054610884.db2.gz MCKGNNCWZWVDGF-UHFFFAOYSA-N 1 2 304.434 4.179 20 0 DIADLO C[C@H]([NH2+]Cc1csc(C(F)(F)F)c1)c1c(F)cncc1F ZINC000623524276 1054612472 /nfs/dbraw/zinc/61/24/72/1054612472.db2.gz MOTDTCJEOLARSA-ZETCQYMHSA-N 1 2 322.302 4.291 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncc(C(C)(C)C)o1)c1ccc2c(c1)OCO2 ZINC000177418058 1054620790 /nfs/dbraw/zinc/62/07/90/1054620790.db2.gz JKNOBKPMYBXGFX-NEPJUHHUSA-N 1 2 316.401 4.113 20 0 DIADLO C/C=C(/C=C\C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1)CC ZINC001449817544 1054631507 /nfs/dbraw/zinc/63/15/07/1054631507.db2.gz MINJIHYUAOGDOQ-SOQHDQFTSA-N 1 2 309.413 4.152 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccc(F)cc1)c1cnccn1 ZINC000177765737 1054634420 /nfs/dbraw/zinc/63/44/20/1054634420.db2.gz FBIGIJILKAUAED-AUUYWEPGSA-N 1 2 307.372 4.056 20 0 DIADLO C[C@H]1CCC[N@@H+]1Cc1cc(Cl)cc(Br)c1F ZINC001234968408 1054635145 /nfs/dbraw/zinc/63/51/45/1054635145.db2.gz JJKHRALEIHYMKH-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO CC(=O)[C@H]1CCC[N@H+](Cc2c(Cl)cc(C)cc2Cl)C1 ZINC001235166947 1054669211 /nfs/dbraw/zinc/66/92/11/1054669211.db2.gz AMEZGOGKLYARDJ-LBPRGKRZSA-N 1 2 300.229 4.103 20 0 DIADLO CC(=O)[C@H]1CCC[N@@H+](Cc2c(Cl)cc(C)cc2Cl)C1 ZINC001235166947 1054669220 /nfs/dbraw/zinc/66/92/20/1054669220.db2.gz AMEZGOGKLYARDJ-LBPRGKRZSA-N 1 2 300.229 4.103 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccccc2C(F)(F)F)s1 ZINC000348263701 1054650028 /nfs/dbraw/zinc/65/00/28/1054650028.db2.gz UHBWUUSZPCXXKM-RKDXNWHRSA-N 1 2 315.364 4.277 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc(C(C)(C)C)oc3C)ccc2[nH+]1 ZINC001358363793 1054665381 /nfs/dbraw/zinc/66/53/81/1054665381.db2.gz PORZSUDXMFJDLM-UHFFFAOYSA-N 1 2 311.385 4.094 20 0 DIADLO Cc1cn2cc(NC(=O)c3cccc4c3CCCCC4)ccc2[nH+]1 ZINC001358363431 1054665552 /nfs/dbraw/zinc/66/55/52/1054665552.db2.gz OBGUCPDTAROGBK-UHFFFAOYSA-N 1 2 319.408 4.164 20 0 DIADLO CC[N@H+](CCn1cccn1)Cc1c(Cl)cc(C)cc1Cl ZINC001235170952 1054669246 /nfs/dbraw/zinc/66/92/46/1054669246.db2.gz WKBPSAOKPIKFRX-UHFFFAOYSA-N 1 2 312.244 4.020 20 0 DIADLO CC[N@@H+](CCn1cccn1)Cc1c(Cl)cc(C)cc1Cl ZINC001235170952 1054669256 /nfs/dbraw/zinc/66/92/56/1054669256.db2.gz WKBPSAOKPIKFRX-UHFFFAOYSA-N 1 2 312.244 4.020 20 0 DIADLO CC/C(C)=C(/C)C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001348644593 1054670004 /nfs/dbraw/zinc/67/00/04/1054670004.db2.gz OFIXJGXKBXQRFT-YARYAAFXSA-N 1 2 317.477 4.091 20 0 DIADLO c1cc(-c2csc(C[NH+]3CC4(C3)CCCCO4)c2)cs1 ZINC001235175034 1054671988 /nfs/dbraw/zinc/67/19/88/1054671988.db2.gz FTNSVPXDJZRMGM-UHFFFAOYSA-N 1 2 305.468 4.232 20 0 DIADLO Cc1nc2ccc(CNc3ccc(N4CCCC4)c[nH+]3)cc2s1 ZINC000491939844 1054673378 /nfs/dbraw/zinc/67/33/78/1054673378.db2.gz XEDWWPGIGMDRLR-UHFFFAOYSA-N 1 2 324.453 4.212 20 0 DIADLO c1cc2n(c1)CC[N@@H+](Cc1cc(-c3ccsc3)cs1)C2 ZINC001235186648 1054678581 /nfs/dbraw/zinc/67/85/81/1054678581.db2.gz RCTYKNFFXJBLGR-UHFFFAOYSA-N 1 2 300.452 4.294 20 0 DIADLO c1cc2n(c1)CC[N@H+](Cc1cc(-c3ccsc3)cs1)C2 ZINC001235186648 1054678587 /nfs/dbraw/zinc/67/85/87/1054678587.db2.gz RCTYKNFFXJBLGR-UHFFFAOYSA-N 1 2 300.452 4.294 20 0 DIADLO c1coc(C[N@H+](Cc2cccs2)Cc2cccc3nccn32)c1 ZINC000179564486 1054687686 /nfs/dbraw/zinc/68/76/86/1054687686.db2.gz LCRKPCPZIMRBAI-UHFFFAOYSA-N 1 2 323.421 4.191 20 0 DIADLO c1coc(C[N@@H+](Cc2cccs2)Cc2cccc3nccn32)c1 ZINC000179564486 1054687692 /nfs/dbraw/zinc/68/76/92/1054687692.db2.gz LCRKPCPZIMRBAI-UHFFFAOYSA-N 1 2 323.421 4.191 20 0 DIADLO c1coc(CN(Cc2cccs2)Cc2cccc3[nH+]ccn32)c1 ZINC000179564486 1054687693 /nfs/dbraw/zinc/68/76/93/1054687693.db2.gz LCRKPCPZIMRBAI-UHFFFAOYSA-N 1 2 323.421 4.191 20 0 DIADLO C[N@H+](Cc1c(C2CC2)nc2sccn12)Cc1ccccc1F ZINC000179565928 1054687885 /nfs/dbraw/zinc/68/78/85/1054687885.db2.gz DDBAOLPSPFFFGA-UHFFFAOYSA-N 1 2 315.417 4.044 20 0 DIADLO C[N@@H+](Cc1c(C2CC2)nc2sccn12)Cc1ccccc1F ZINC000179565928 1054687888 /nfs/dbraw/zinc/68/78/88/1054687888.db2.gz DDBAOLPSPFFFGA-UHFFFAOYSA-N 1 2 315.417 4.044 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1cccc2nccn21 ZINC000179607999 1054690194 /nfs/dbraw/zinc/69/01/94/1054690194.db2.gz ILESMZKYDKJWDF-CYBMUJFWSA-N 1 2 322.437 4.137 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cccc2nccn21 ZINC000179607999 1054690198 /nfs/dbraw/zinc/69/01/98/1054690198.db2.gz ILESMZKYDKJWDF-CYBMUJFWSA-N 1 2 322.437 4.137 20 0 DIADLO C[C@H](c1nc2ccccc2s1)N(C)Cc1cccc2[nH+]ccn21 ZINC000179607999 1054690201 /nfs/dbraw/zinc/69/02/01/1054690201.db2.gz ILESMZKYDKJWDF-CYBMUJFWSA-N 1 2 322.437 4.137 20 0 DIADLO Cc1nc(C[NH2+]C2(c3cccc(Cl)c3)CC2)nc2ccccc12 ZINC000179673698 1054695075 /nfs/dbraw/zinc/69/50/75/1054695075.db2.gz FKBZDVRBHYFIHL-UHFFFAOYSA-N 1 2 323.827 4.371 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000179718809 1054699761 /nfs/dbraw/zinc/69/97/61/1054699761.db2.gz XEVSHZIGQVHECB-HNNXBMFYSA-N 1 2 319.836 4.477 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c(F)cn1 ZINC001235318267 1054700343 /nfs/dbraw/zinc/70/03/43/1054700343.db2.gz YJKAHWDYNYXVEN-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c(F)cn1 ZINC001235318267 1054700357 /nfs/dbraw/zinc/70/03/57/1054700357.db2.gz YJKAHWDYNYXVEN-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1cc(F)ccc1F ZINC000179782271 1054701163 /nfs/dbraw/zinc/70/11/63/1054701163.db2.gz UYPSTYBCZGGHOT-AWEZNQCLSA-N 1 2 320.314 4.486 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1cc(F)ccc1F ZINC000179782283 1054702147 /nfs/dbraw/zinc/70/21/47/1054702147.db2.gz UYPSTYBCZGGHOT-CQSZACIVSA-N 1 2 320.314 4.486 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)c(F)c(F)c1F ZINC001235356003 1054706123 /nfs/dbraw/zinc/70/61/23/1054706123.db2.gz WIFSBLDNXNKTGY-LLVKDONJSA-N 1 2 324.321 4.018 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@@H](c3ccccn3)C2)c(F)c(F)c1F ZINC001235356003 1054706139 /nfs/dbraw/zinc/70/61/39/1054706139.db2.gz WIFSBLDNXNKTGY-LLVKDONJSA-N 1 2 324.321 4.018 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1cccc2ccsc21)n1cc[nH+]c1 ZINC001546040336 1054706262 /nfs/dbraw/zinc/70/62/62/1054706262.db2.gz CCRVXOBTMJWSDA-HNNXBMFYSA-N 1 2 313.426 4.324 20 0 DIADLO Cc1cc(NCCc2ccccc2C(F)(F)F)nc(C2CC2)[nH+]1 ZINC000604758643 1054707187 /nfs/dbraw/zinc/70/71/87/1054707187.db2.gz OVZPFQAYVYVIRK-UHFFFAOYSA-N 1 2 321.346 4.336 20 0 DIADLO COc1cc2c(cc1F)CC[C@H]2Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000509474910 1054707565 /nfs/dbraw/zinc/70/75/65/1054707565.db2.gz DDXJBHIDALNRRG-OAHLLOKOSA-N 1 2 315.392 4.156 20 0 DIADLO CC1(F)CC[NH+](Cc2cccc(Br)c2Cl)CC1 ZINC001235593060 1054749542 /nfs/dbraw/zinc/74/95/42/1054749542.db2.gz FRKVMXZXNBXPKC-UHFFFAOYSA-N 1 2 320.633 4.427 20 0 DIADLO CN(C)c1[nH+]cc(CN2CCc3ccc(F)cc32)c2ccccc21 ZINC001473436430 1054713719 /nfs/dbraw/zinc/71/37/19/1054713719.db2.gz RQTOBBOLWYEZCG-UHFFFAOYSA-N 1 2 321.399 4.003 20 0 DIADLO COC[C@H]1CCC[N@@H+]1Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235589798 1054747541 /nfs/dbraw/zinc/74/75/41/1054747541.db2.gz DWOLXQIZNVOAMH-SNVBAGLBSA-N 1 2 308.636 4.258 20 0 DIADLO COC[C@H]1CCC[N@H+]1Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235589798 1054747557 /nfs/dbraw/zinc/74/75/57/1054747557.db2.gz DWOLXQIZNVOAMH-SNVBAGLBSA-N 1 2 308.636 4.258 20 0 DIADLO Clc1cc(C[N@H+](C2CC2)C2COC2)cc(Cl)c1Cl ZINC001235596582 1054749988 /nfs/dbraw/zinc/74/99/88/1054749988.db2.gz DFRMJXODRPIRAN-UHFFFAOYSA-N 1 2 306.620 4.010 20 0 DIADLO Clc1cc(C[N@@H+](C2CC2)C2COC2)cc(Cl)c1Cl ZINC001235596582 1054750002 /nfs/dbraw/zinc/75/00/02/1054750002.db2.gz DFRMJXODRPIRAN-UHFFFAOYSA-N 1 2 306.620 4.010 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)n1 ZINC000180030625 1054726607 /nfs/dbraw/zinc/72/66/07/1054726607.db2.gz QTUCKWWJNGLBNG-DJSGYFEHSA-N 1 2 319.836 4.333 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2cncc(F)c2Cl)c1 ZINC001235501104 1054735414 /nfs/dbraw/zinc/73/54/14/1054735414.db2.gz VVENFWVLYWWMMP-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2cncc(F)c2Cl)c1 ZINC001235501104 1054735431 /nfs/dbraw/zinc/73/54/31/1054735431.db2.gz VVENFWVLYWWMMP-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+](C)Cc2cnc(Cl)s2)c1 ZINC001235535609 1054741366 /nfs/dbraw/zinc/74/13/66/1054741366.db2.gz VCCINMRRTUDPRA-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+](C)Cc2cnc(Cl)s2)c1 ZINC001235535609 1054741381 /nfs/dbraw/zinc/74/13/81/1054741381.db2.gz VCCINMRRTUDPRA-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1ccnc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1Cl ZINC001235586261 1054748495 /nfs/dbraw/zinc/74/84/95/1054748495.db2.gz RGSXXHZEFJLEAX-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccnc(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1Cl ZINC001235586261 1054748505 /nfs/dbraw/zinc/74/85/05/1054748505.db2.gz RGSXXHZEFJLEAX-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO C[N@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)Cc1cnccn1 ZINC001235601520 1054752733 /nfs/dbraw/zinc/75/27/33/1054752733.db2.gz JUUTXNSCTJZPEX-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO C[N@@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)Cc1cnccn1 ZINC001235601520 1054752752 /nfs/dbraw/zinc/75/27/52/1054752752.db2.gz JUUTXNSCTJZPEX-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO OCC[C@@H]1CCC[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC001235600931 1054753922 /nfs/dbraw/zinc/75/39/22/1054753922.db2.gz IBHRAMTTWHBNHB-JTQLQIEISA-N 1 2 322.663 4.241 20 0 DIADLO F[C@H]1CCC[N@H+](Cc2ccccc2-c2ccncc2)CC1(F)F ZINC001235610767 1054753056 /nfs/dbraw/zinc/75/30/56/1054753056.db2.gz DFRZEAQIBVOMHZ-KRWDZBQOSA-N 1 2 320.358 4.318 20 0 DIADLO F[C@H]1CCC[N@@H+](Cc2ccccc2-c2ccncc2)CC1(F)F ZINC001235610767 1054753074 /nfs/dbraw/zinc/75/30/74/1054753074.db2.gz DFRZEAQIBVOMHZ-KRWDZBQOSA-N 1 2 320.358 4.318 20 0 DIADLO OCC[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC001235600931 1054753940 /nfs/dbraw/zinc/75/39/40/1054753940.db2.gz IBHRAMTTWHBNHB-JTQLQIEISA-N 1 2 322.663 4.241 20 0 DIADLO CC[N@H+](Cc1ccccc1)Cc1c(C)cncc1Br ZINC001235639375 1054758955 /nfs/dbraw/zinc/75/89/55/1054758955.db2.gz WCXSFAMRZUZVLE-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccccc1)Cc1c(C)cncc1Br ZINC001235639375 1054758969 /nfs/dbraw/zinc/75/89/69/1054758969.db2.gz WCXSFAMRZUZVLE-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(Nc3ccccc3)n2)CCC1(F)F ZINC000519235009 1054767687 /nfs/dbraw/zinc/76/76/87/1054767687.db2.gz RKMVTXUCIYRHFY-GFCCVEGCSA-N 1 2 323.412 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(Nc3ccccc3)n2)CCC1(F)F ZINC000519235009 1054767701 /nfs/dbraw/zinc/76/77/01/1054767701.db2.gz RKMVTXUCIYRHFY-GFCCVEGCSA-N 1 2 323.412 4.364 20 0 DIADLO Nc1nc(Cl)ccc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001235674855 1054771403 /nfs/dbraw/zinc/77/14/03/1054771403.db2.gz RCJVJDFNEDLDNH-CQSZACIVSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nc(Cl)ccc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001235674855 1054771418 /nfs/dbraw/zinc/77/14/18/1054771418.db2.gz RCJVJDFNEDLDNH-CQSZACIVSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nccc(Cl)c1C[N@@H+]1CCCC[C@@H]1c1ccccc1F ZINC001235679840 1054773674 /nfs/dbraw/zinc/77/36/74/1054773674.db2.gz RKGLVFGHLGIHBU-MRXNPFEDSA-N 1 2 319.811 4.184 20 0 DIADLO Nc1nccc(Cl)c1C[N@H+]1CCCC[C@@H]1c1ccccc1F ZINC001235679840 1054773690 /nfs/dbraw/zinc/77/36/90/1054773690.db2.gz RKGLVFGHLGIHBU-MRXNPFEDSA-N 1 2 319.811 4.184 20 0 DIADLO C/C(=C/c1ccc(C)cc1)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001349616922 1054774883 /nfs/dbraw/zinc/77/48/83/1054774883.db2.gz XHDUBQKNSUMPEQ-SSZFMOIBSA-N 1 2 317.392 4.223 20 0 DIADLO Fc1ccc2[nH]c(C[N@@H+]3CCC[C@H]3c3cccc(F)c3)nc2c1 ZINC001235697784 1054781568 /nfs/dbraw/zinc/78/15/68/1054781568.db2.gz UAPJQLYIEYGLEI-KRWDZBQOSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc2[nH]c(C[N@H+]3CCC[C@H]3c3cccc(F)c3)nc2c1 ZINC001235697784 1054781583 /nfs/dbraw/zinc/78/15/83/1054781583.db2.gz UAPJQLYIEYGLEI-KRWDZBQOSA-N 1 2 313.351 4.178 20 0 DIADLO CC1(c2ccccc2)CC[NH+](Cc2nc3ccc(F)cc3[nH]2)CC1 ZINC001235700288 1054783194 /nfs/dbraw/zinc/78/31/94/1054783194.db2.gz JZUHGWPUNCHTMX-UHFFFAOYSA-N 1 2 323.415 4.256 20 0 DIADLO Fc1cccc(F)c1C1([NH2+]Cc2cc3cnccc3o2)CCC1 ZINC000623844178 1054789411 /nfs/dbraw/zinc/78/94/11/1054789411.db2.gz KBFCMHBTCDWFMG-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2scnc21)c1ccccc1OC(F)F ZINC000623856320 1054790201 /nfs/dbraw/zinc/79/02/01/1054790201.db2.gz RVZMYCUONQKFRF-PWSUYJOCSA-N 1 2 324.396 4.473 20 0 DIADLO CCOc1ccc(Cl)c(NCc2c[nH+]c3ccc(C)cn23)c1 ZINC001474154877 1054792155 /nfs/dbraw/zinc/79/21/55/1054792155.db2.gz VQDPKLMWBLQXRE-UHFFFAOYSA-N 1 2 315.804 4.307 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[N@H+]1C[C@H]2[C@H](CC2(F)F)C1 ZINC001235739442 1054795320 /nfs/dbraw/zinc/79/53/20/1054795320.db2.gz IPCOAUKIVLQBJC-XCBNKYQSSA-N 1 2 310.146 4.220 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[N@@H+]1C[C@H]2[C@H](CC2(F)F)C1 ZINC001235739442 1054795334 /nfs/dbraw/zinc/79/53/34/1054795334.db2.gz IPCOAUKIVLQBJC-XCBNKYQSSA-N 1 2 310.146 4.220 20 0 DIADLO C[N@@H+](Cc1c(F)cc(Cl)cc1Cl)C[C@H]1CCCCO1 ZINC001235747068 1054795769 /nfs/dbraw/zinc/79/57/69/1054795769.db2.gz PMLOPGCHAXITPJ-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO C[N@H+](Cc1c(F)cc(Cl)cc1Cl)C[C@H]1CCCCO1 ZINC001235747068 1054795780 /nfs/dbraw/zinc/79/57/80/1054795780.db2.gz PMLOPGCHAXITPJ-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO COCCC1CC[NH+](Cc2c(F)cc(Cl)cc2Cl)CC1 ZINC001235746907 1054796293 /nfs/dbraw/zinc/79/62/93/1054796293.db2.gz NONXNWTXAPROJT-UHFFFAOYSA-N 1 2 320.235 4.381 20 0 DIADLO C[C@@H]1CC[N@@H+]1Cc1cc(F)c(OCc2ccccc2)c(F)c1 ZINC001235759304 1054799838 /nfs/dbraw/zinc/79/98/38/1054799838.db2.gz FZBOPYLPXMBFMF-CYBMUJFWSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@@H]1CC[N@H+]1Cc1cc(F)c(OCc2ccccc2)c(F)c1 ZINC001235759304 1054799852 /nfs/dbraw/zinc/79/98/52/1054799852.db2.gz FZBOPYLPXMBFMF-CYBMUJFWSA-N 1 2 303.352 4.138 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(F)cc2C(F)(F)F)cs1 ZINC000623868807 1054802278 /nfs/dbraw/zinc/80/22/78/1054802278.db2.gz IBMOGOBNPRKVAG-QMMMGPOBSA-N 1 2 318.339 4.460 20 0 DIADLO CC(C)COc1ccccc1C[NH2+][C@H]1CCCc2scnc21 ZINC000623869968 1054805251 /nfs/dbraw/zinc/80/52/51/1054805251.db2.gz MGZYNFXJQJUDJE-HNNXBMFYSA-N 1 2 316.470 4.345 20 0 DIADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1c(C)cc(Br)cc1C ZINC001235787578 1054807538 /nfs/dbraw/zinc/80/75/38/1054807538.db2.gz DMJSSNKDZOGVFS-MRXNPFEDSA-N 1 2 324.262 4.009 20 0 DIADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1c(C)cc(Br)cc1C ZINC001235787578 1054807544 /nfs/dbraw/zinc/80/75/44/1054807544.db2.gz DMJSSNKDZOGVFS-MRXNPFEDSA-N 1 2 324.262 4.009 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001235813990 1054812740 /nfs/dbraw/zinc/81/27/40/1054812740.db2.gz FCXCZMISFMHXOY-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(F)ccc1C[N@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001235813990 1054812754 /nfs/dbraw/zinc/81/27/54/1054812754.db2.gz FCXCZMISFMHXOY-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(F)nc1C ZINC001235820199 1054812893 /nfs/dbraw/zinc/81/28/93/1054812893.db2.gz LQBCSQLIKLNQAU-QGZVFWFLSA-N 1 2 314.404 4.013 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(F)nc1C ZINC001235820199 1054812903 /nfs/dbraw/zinc/81/29/03/1054812903.db2.gz LQBCSQLIKLNQAU-QGZVFWFLSA-N 1 2 314.404 4.013 20 0 DIADLO CCCCCn1cc(C[NH2+][C@H]2CCCc3scnc32)c(C)n1 ZINC000623926427 1054816938 /nfs/dbraw/zinc/81/69/38/1054816938.db2.gz GAKUPRWEDJBMMB-HNNXBMFYSA-N 1 2 318.490 4.005 20 0 DIADLO COc1nccc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c1Cl ZINC001235838278 1054817682 /nfs/dbraw/zinc/81/76/82/1054817682.db2.gz QNKZKFQXVXRQHG-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c1Cl ZINC001235838278 1054817697 /nfs/dbraw/zinc/81/76/97/1054817697.db2.gz QNKZKFQXVXRQHG-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(C[N@H+](C)Cc2ccc(Cl)cc2)c1Cl ZINC001235842683 1054821413 /nfs/dbraw/zinc/82/14/13/1054821413.db2.gz RNDHIQZNKCAHAD-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1nccc(C[N@@H+](C)Cc2ccc(Cl)cc2)c1Cl ZINC001235842683 1054821423 /nfs/dbraw/zinc/82/14/23/1054821423.db2.gz RNDHIQZNKCAHAD-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO c1nc2c(s1)CCC[C@H]2Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000623932176 1054822118 /nfs/dbraw/zinc/82/21/18/1054822118.db2.gz CMKPFGDYCQRJSV-CQSZACIVSA-N 1 2 314.458 4.018 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc3sc(C)nc3c2)no1 ZINC001235850859 1054822471 /nfs/dbraw/zinc/82/24/71/1054822471.db2.gz QGVRFQHXEAFCQM-INIZCTEOSA-N 1 2 313.426 4.238 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc3sc(C)nc3c2)no1 ZINC001235850859 1054822485 /nfs/dbraw/zinc/82/24/85/1054822485.db2.gz QGVRFQHXEAFCQM-INIZCTEOSA-N 1 2 313.426 4.238 20 0 DIADLO Cc1ccccc1[C@@H](CO)Nc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC000536389778 1054824656 /nfs/dbraw/zinc/82/46/56/1054824656.db2.gz FHOGHPXCUBJYER-QGZVFWFLSA-N 1 2 313.445 4.177 20 0 DIADLO CSc1cc(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)ccn1 ZINC000536657114 1054827227 /nfs/dbraw/zinc/82/72/27/1054827227.db2.gz JXOUTRLGZXFZQX-UHFFFAOYSA-N 1 2 316.474 4.452 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1c(Br)ccnc1Cl ZINC001235869444 1054828415 /nfs/dbraw/zinc/82/84/15/1054828415.db2.gz AYOAOINOEUJDKG-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO Cc1csc([C@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)n1 ZINC000623954523 1054835039 /nfs/dbraw/zinc/83/50/39/1054835039.db2.gz QWUBDGCFPOQGOP-ZDUSSCGKSA-N 1 2 302.447 4.010 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1ccc(COC)cc1 ZINC000537505613 1054839849 /nfs/dbraw/zinc/83/98/49/1054839849.db2.gz XYYXECODOROJQS-UHFFFAOYSA-N 1 2 309.413 4.205 20 0 DIADLO COC[C@@H]([NH2+][C@H]1CCCc2scnc21)c1ccc(Cl)cc1 ZINC000623972253 1054842537 /nfs/dbraw/zinc/84/25/37/1054842537.db2.gz XADBBLJYKGCTSL-UONOGXRCSA-N 1 2 322.861 4.151 20 0 DIADLO CSc1cccc(F)c1C[NH2+][C@@H]1CCCc2scnc21 ZINC000623981827 1054844239 /nfs/dbraw/zinc/84/42/39/1054844239.db2.gz WPHJJSSGVVLVMG-GFCCVEGCSA-N 1 2 308.447 4.171 20 0 DIADLO CC(C)(C)Oc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)cc1 ZINC001235926730 1054851141 /nfs/dbraw/zinc/85/11/41/1054851141.db2.gz NWCINPSWKXAIKD-UHFFFAOYSA-N 1 2 307.397 4.171 20 0 DIADLO Fc1ccccc1C1([NH2+][C@H]2CCCc3scnc32)CCC1 ZINC000624006103 1054860090 /nfs/dbraw/zinc/86/00/90/1054860090.db2.gz LYEWWUUABGEPIE-AWEZNQCLSA-N 1 2 302.418 4.329 20 0 DIADLO Cn1ccc2c[nH+]c(/C=C/c3ccc(C(F)(F)F)cc3)nc21 ZINC001235977833 1054878708 /nfs/dbraw/zinc/87/87/08/1054878708.db2.gz DMFYNMOJJDIGNO-QPJJXVBHSA-N 1 2 303.287 4.158 20 0 DIADLO CC[C@@H]([NH2+]Cc1c(Cl)oc2ccccc21)c1nccn1C ZINC000624108450 1054879098 /nfs/dbraw/zinc/87/90/98/1054879098.db2.gz VQCOGGARXXKXPC-CYBMUJFWSA-N 1 2 303.793 4.061 20 0 DIADLO CCC(F)(F)C[NH2+][C@@H](Cc1ccncc1)c1ccc(OC)cc1 ZINC000624148906 1054890553 /nfs/dbraw/zinc/89/05/53/1054890553.db2.gz QWFRRSFJIOGBIK-KRWDZBQOSA-N 1 2 320.383 4.009 20 0 DIADLO C/C(=C\C(C)(C)C)C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000186108101 1054911078 /nfs/dbraw/zinc/91/10/78/1054911078.db2.gz KAYVDUAEEMVMHN-JLHYYAGUSA-N 1 2 321.490 4.060 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ccn(C(C)C)n1)c1ccc(F)cc1F ZINC000181652814 1054926173 /nfs/dbraw/zinc/92/61/73/1054926173.db2.gz HBWZNQMYXRDSNQ-KRWDZBQOSA-N 1 2 307.388 4.229 20 0 DIADLO COC[C@@H]([NH2+]Cc1csc(CCC(C)C)n1)c1ccccc1 ZINC000181693471 1054929532 /nfs/dbraw/zinc/92/95/32/1054929532.db2.gz KCJLCUUXTDDEOJ-QGZVFWFLSA-N 1 2 318.486 4.209 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)cc1-c1cccc(C2CC2)c1 ZINC001236087445 1054933981 /nfs/dbraw/zinc/93/39/81/1054933981.db2.gz IMWRJAHXETWNFO-UHFFFAOYSA-N 1 2 311.400 4.202 20 0 DIADLO CCC[C@@H]([NH2+]Cc1noc(-c2ccccc2)n1)c1ccccc1 ZINC000181782253 1054936047 /nfs/dbraw/zinc/93/60/47/1054936047.db2.gz PCWZCEAMTIKBPJ-QGZVFWFLSA-N 1 2 307.397 4.368 20 0 DIADLO CCC[C@H]([NH2+]Cc1noc(-c2ccccc2)n1)c1ccccc1 ZINC000181782232 1054936237 /nfs/dbraw/zinc/93/62/37/1054936237.db2.gz PCWZCEAMTIKBPJ-KRWDZBQOSA-N 1 2 307.397 4.368 20 0 DIADLO Nc1cn2ccc(-c3cc(C(F)(F)F)ccc3Cl)cc2[nH+]1 ZINC001236100319 1054944410 /nfs/dbraw/zinc/94/44/10/1054944410.db2.gz FQZMJCUZUWWYFV-UHFFFAOYSA-N 1 2 311.694 4.256 20 0 DIADLO Cc1ccc(Cl)c(C[N@@H+]2CCc3cc(N)ccc3C2)c1Cl ZINC001236104893 1054949603 /nfs/dbraw/zinc/94/96/03/1054949603.db2.gz CCCGCSJXBMCEPI-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO Cc1ccc(Cl)c(C[N@H+]2CCc3cc(N)ccc3C2)c1Cl ZINC001236104893 1054949615 /nfs/dbraw/zinc/94/96/15/1054949615.db2.gz CCCGCSJXBMCEPI-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO CCO[C@H](C)c1nc(C[NH2+][C@H](CC)c2c(C)noc2C)cs1 ZINC000182407244 1054984594 /nfs/dbraw/zinc/98/45/94/1054984594.db2.gz CXNHWEFSCYENMV-TZMCWYRMSA-N 1 2 323.462 4.086 20 0 DIADLO CC[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1c(C)noc1C ZINC000182403354 1054984788 /nfs/dbraw/zinc/98/47/88/1054984788.db2.gz YBGLLQOTTBNGOE-CYBMUJFWSA-N 1 2 317.414 4.249 20 0 DIADLO CCC[C@@H](C)C[NH2+][C@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000182681314 1055003115 /nfs/dbraw/zinc/00/31/15/1055003115.db2.gz FYAIFMOFFNVYTB-ABAIWWIYSA-N 1 2 307.825 4.147 20 0 DIADLO CCC(CC)C[NH2+][C@@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000182680839 1055003269 /nfs/dbraw/zinc/00/32/69/1055003269.db2.gz DTWAKZCERQKAFD-OAHLLOKOSA-N 1 2 307.825 4.147 20 0 DIADLO Cc1nc([C@H]([NH2+][C@H]2CCC[C@H](C)C2)c2ccc(Cl)cc2)no1 ZINC000182681759 1055004983 /nfs/dbraw/zinc/00/49/83/1055004983.db2.gz ZHGSHRHCMGDEHA-KNXALSJPSA-N 1 2 319.836 4.289 20 0 DIADLO CCCCCOc1cc(C)ccc1C[NH2+][C@@H](C)c1nccn1C ZINC000183106490 1055030115 /nfs/dbraw/zinc/03/01/15/1055030115.db2.gz KQENKXAZSSHBDC-INIZCTEOSA-N 1 2 315.461 4.148 20 0 DIADLO Cc1[nH+]cn(-c2ccc(C3=CC[C@H](C(F)(F)F)CC3)nn2)c1C ZINC001236252448 1055036153 /nfs/dbraw/zinc/03/61/53/1055036153.db2.gz QLNYKMFQVABRCN-ZDUSSCGKSA-N 1 2 322.334 4.025 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccc(Oc3ccccc3)o2)c[nH+]1 ZINC001536110248 1055048227 /nfs/dbraw/zinc/04/82/27/1055048227.db2.gz TWBBKUADUBFSNF-UHFFFAOYSA-N 1 2 322.364 4.014 20 0 DIADLO CCCOc1ccc(C[NH2+][C@H](c2ccco2)c2ccccc2)cn1 ZINC000183565883 1055049125 /nfs/dbraw/zinc/04/91/25/1055049125.db2.gz XSCCKDRTOIVPIJ-FQEVSTJZSA-N 1 2 322.408 4.343 20 0 DIADLO CCCOc1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)cn1 ZINC000183565900 1055050137 /nfs/dbraw/zinc/05/01/37/1055050137.db2.gz XSCCKDRTOIVPIJ-HXUWFJFHSA-N 1 2 322.408 4.343 20 0 DIADLO Nc1ccc(-c2cc(F)c(F)c(OCc3ccccc3)c2)c[nH+]1 ZINC001236316582 1055053496 /nfs/dbraw/zinc/05/34/96/1055053496.db2.gz NMZLZAXDNYWZCZ-UHFFFAOYSA-N 1 2 312.319 4.188 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2ccncc2)c(Br)c1 ZINC000183716601 1055055184 /nfs/dbraw/zinc/05/51/84/1055055184.db2.gz WKEWYQSMPDLQAE-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccncc2)c(Br)c1 ZINC000183716601 1055055195 /nfs/dbraw/zinc/05/51/95/1055055195.db2.gz WKEWYQSMPDLQAE-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2cccnc2)c(Br)c1 ZINC000183732035 1055056220 /nfs/dbraw/zinc/05/62/20/1055056220.db2.gz RLAVYOSYLPBYIW-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)c2cccnc2)c(Br)c1 ZINC000183732035 1055056231 /nfs/dbraw/zinc/05/62/31/1055056231.db2.gz RLAVYOSYLPBYIW-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@H+](C)Cc1ccncc1 ZINC000183742876 1055056744 /nfs/dbraw/zinc/05/67/44/1055056744.db2.gz GLMJGXUWSCYTRS-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@@H+](C)Cc1ccncc1 ZINC000183742876 1055056757 /nfs/dbraw/zinc/05/67/57/1055056757.db2.gz GLMJGXUWSCYTRS-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000183730224 1055057108 /nfs/dbraw/zinc/05/71/08/1055057108.db2.gz GAOBURSDPRJANW-NSHDSACASA-N 1 2 312.310 4.433 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000183730224 1055057121 /nfs/dbraw/zinc/05/71/21/1055057121.db2.gz GAOBURSDPRJANW-NSHDSACASA-N 1 2 312.310 4.433 20 0 DIADLO CCc1cc(-c2ccc(N)[nH+]c2)ccc1OCc1ccccc1 ZINC001236322679 1055057654 /nfs/dbraw/zinc/05/76/54/1055057654.db2.gz FWTXCEMYVXFMID-UHFFFAOYSA-N 1 2 304.393 4.472 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1cccc(C(F)(F)F)c1 ZINC000367617454 1055080280 /nfs/dbraw/zinc/08/02/80/1055080280.db2.gz NITDJDBGZBXJOD-HZMBPMFUSA-N 1 2 309.335 4.157 20 0 DIADLO c1ccc2c(c1)NCCC[C@H]2Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000193084171 1055099470 /nfs/dbraw/zinc/09/94/70/1055099470.db2.gz MPXCXVBMDQLVQI-LJQANCHMSA-N 1 2 322.456 4.431 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c(C)o1 ZINC000768231693 1055100852 /nfs/dbraw/zinc/10/08/52/1055100852.db2.gz PMISBNNWXNWJAN-MRVPVSSYSA-N 1 2 304.337 4.223 20 0 DIADLO COc1nc(C(C)C)ccc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001236446913 1055117445 /nfs/dbraw/zinc/11/74/45/1055117445.db2.gz STSLKVWRZPBLTE-UHFFFAOYSA-N 1 2 307.397 4.281 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@H+](Cc2nc3ccccc3s2)C1 ZINC000194273610 1055118931 /nfs/dbraw/zinc/11/89/31/1055118931.db2.gz VZCGNJKVBTWYBH-JTQLQIEISA-N 1 2 300.349 4.071 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@@H+](Cc2nc3ccccc3s2)C1 ZINC000194273610 1055118936 /nfs/dbraw/zinc/11/89/36/1055118936.db2.gz VZCGNJKVBTWYBH-JTQLQIEISA-N 1 2 300.349 4.071 20 0 DIADLO CC(C)(C)c1noc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)n1 ZINC000194373063 1055122646 /nfs/dbraw/zinc/12/26/46/1055122646.db2.gz KUDRCPKEOVRXKN-HNNXBMFYSA-N 1 2 319.836 4.261 20 0 DIADLO CCSCc1cc[nH+]c(NCc2nc(-c3ccccc3)c[nH]2)c1 ZINC000194401192 1055124878 /nfs/dbraw/zinc/12/48/78/1055124878.db2.gz GOIIPLPDIAQZOI-UHFFFAOYSA-N 1 2 324.453 4.337 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)c1ccc(F)cc1 ZINC000195032451 1055142787 /nfs/dbraw/zinc/14/27/87/1055142787.db2.gz SNEHPGJGHLJMOF-BXUZGUMPSA-N 1 2 305.397 4.308 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1ccc(Br)cc1F ZINC000381338387 1055164310 /nfs/dbraw/zinc/16/43/10/1055164310.db2.gz JXFWPOGAFBMARN-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1ccc(Br)cc1F ZINC000381338387 1055164314 /nfs/dbraw/zinc/16/43/14/1055164314.db2.gz JXFWPOGAFBMARN-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1cccc(C[N@H+](Cc2c(Cl)ccnc2N)C2CC2)c1C ZINC001236534301 1055165274 /nfs/dbraw/zinc/16/52/74/1055165274.db2.gz JTOIDKBIKQYLRN-UHFFFAOYSA-N 1 2 315.848 4.099 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2c(Cl)ccnc2N)C2CC2)c1C ZINC001236534301 1055165278 /nfs/dbraw/zinc/16/52/78/1055165278.db2.gz JTOIDKBIKQYLRN-UHFFFAOYSA-N 1 2 315.848 4.099 20 0 DIADLO CC[C@@H]1CCC[N@H+](Cc2c(Br)ccnc2Cl)C1 ZINC001236590910 1055202015 /nfs/dbraw/zinc/20/20/15/1055202015.db2.gz IZFLNCOJISGJBZ-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@@H]1CCC[N@@H+](Cc2c(Br)ccnc2Cl)C1 ZINC001236590910 1055202025 /nfs/dbraw/zinc/20/20/25/1055202025.db2.gz IZFLNCOJISGJBZ-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@@H+]1CCCC(F)(F)CC1 ZINC001236600571 1055202464 /nfs/dbraw/zinc/20/24/64/1055202464.db2.gz YOXDAXWJVUUILI-UHFFFAOYSA-N 1 2 309.187 4.318 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@H+]1CCCC(F)(F)CC1 ZINC001236600571 1055202473 /nfs/dbraw/zinc/20/24/73/1055202473.db2.gz YOXDAXWJVUUILI-UHFFFAOYSA-N 1 2 309.187 4.318 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@@H+]1CCn2cccc2[C@H]1C ZINC001236608591 1055203868 /nfs/dbraw/zinc/20/38/68/1055203868.db2.gz SIEDNPGANAQCGK-LLVKDONJSA-N 1 2 310.228 4.075 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@H+]1CCn2cccc2[C@H]1C ZINC001236608591 1055203878 /nfs/dbraw/zinc/20/38/78/1055203878.db2.gz SIEDNPGANAQCGK-LLVKDONJSA-N 1 2 310.228 4.075 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@H+](C)Cc1cccs1 ZINC001236604739 1055204397 /nfs/dbraw/zinc/20/43/97/1055204397.db2.gz LSTLFRBWYZYFND-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@@H+](C)Cc1cccs1 ZINC001236604739 1055204400 /nfs/dbraw/zinc/20/44/00/1055204400.db2.gz LSTLFRBWYZYFND-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO C[C@H](c1cccc2ccccc21)[N@H+](C)Cc1nccnc1Cl ZINC001236623152 1055206436 /nfs/dbraw/zinc/20/64/36/1055206436.db2.gz DCPFYSGIDWJAHW-CYBMUJFWSA-N 1 2 311.816 4.476 20 0 DIADLO C[C@H](c1cccc2ccccc21)[N@@H+](C)Cc1nccnc1Cl ZINC001236623152 1055206440 /nfs/dbraw/zinc/20/64/40/1055206440.db2.gz DCPFYSGIDWJAHW-CYBMUJFWSA-N 1 2 311.816 4.476 20 0 DIADLO Cc1c(Br)cccc1C[N@@H+]1CCc2sccc2C1 ZINC001236614092 1055206766 /nfs/dbraw/zinc/20/67/66/1055206766.db2.gz ZROOJCMQJLVDKV-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1c(Br)cccc1C[N@H+]1CCc2sccc2C1 ZINC001236614092 1055206771 /nfs/dbraw/zinc/20/67/71/1055206771.db2.gz ZROOJCMQJLVDKV-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1cc(C)c(C(=O)N(C)Cc2ccc(Cl)c(F)c2)c(C)[nH+]1 ZINC001127784283 1055222517 /nfs/dbraw/zinc/22/25/17/1055222517.db2.gz SJIYACFEWKWQHK-UHFFFAOYSA-N 1 2 320.795 4.072 20 0 DIADLO Oc1cc(C[N@H+](Cc2ccccc2)Cc2ccccn2)ccc1F ZINC001236703534 1055232584 /nfs/dbraw/zinc/23/25/84/1055232584.db2.gz OVMBIGQFEXKUCE-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO Oc1cc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)ccc1F ZINC001236703534 1055232598 /nfs/dbraw/zinc/23/25/98/1055232598.db2.gz OVMBIGQFEXKUCE-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO CC[C@@H](C)N1CC[C@]2(CCC[N@@H+](c3ccc(C)cc3)CC2)C1=O ZINC001278000419 1055237443 /nfs/dbraw/zinc/23/74/43/1055237443.db2.gz HHUCEWWWKLPTCM-YLJYHZDGSA-N 1 2 314.473 4.003 20 0 DIADLO CC[C@@H](C)N1CC[C@]2(CCC[N@H+](c3ccc(C)cc3)CC2)C1=O ZINC001278000419 1055237458 /nfs/dbraw/zinc/23/74/58/1055237458.db2.gz HHUCEWWWKLPTCM-YLJYHZDGSA-N 1 2 314.473 4.003 20 0 DIADLO Oc1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)c(OC(F)(F)F)c1 ZINC001236730390 1055244148 /nfs/dbraw/zinc/24/41/48/1055244148.db2.gz NFCSFKLLOGUTPQ-HNNXBMFYSA-N 1 2 323.314 4.238 20 0 DIADLO Oc1ccc(C[N@H+]2CC[C@H]2c2ccccc2)c(OC(F)(F)F)c1 ZINC001236730390 1055244161 /nfs/dbraw/zinc/24/41/61/1055244161.db2.gz NFCSFKLLOGUTPQ-HNNXBMFYSA-N 1 2 323.314 4.238 20 0 DIADLO C[N@H+](Cc1ccc(Br)o1)Cc1ccccc1Cl ZINC000383146543 1055246712 /nfs/dbraw/zinc/24/67/12/1055246712.db2.gz YVVSGDOODXZIBF-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO C[N@@H+](Cc1ccc(Br)o1)Cc1ccccc1Cl ZINC000383146543 1055246722 /nfs/dbraw/zinc/24/67/22/1055246722.db2.gz YVVSGDOODXZIBF-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO C[C@@H](CC(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CC1 ZINC001587253332 1055252126 /nfs/dbraw/zinc/25/21/26/1055252126.db2.gz YRKNDPSIZWNYMO-AWEZNQCLSA-N 1 2 324.424 4.228 20 0 DIADLO C[N@@H+]1CCCC[C@@H]1C(=O)Nc1nc(C2CCCCCC2)cs1 ZINC001587280890 1055259606 /nfs/dbraw/zinc/25/96/06/1055259606.db2.gz IYLXXTBECAAXBB-OAHLLOKOSA-N 1 2 321.490 4.004 20 0 DIADLO C[N@H+]1CCCC[C@@H]1C(=O)Nc1nc(C2CCCCCC2)cs1 ZINC001587280890 1055259621 /nfs/dbraw/zinc/25/96/21/1055259621.db2.gz IYLXXTBECAAXBB-OAHLLOKOSA-N 1 2 321.490 4.004 20 0 DIADLO CCCCCC(C)(C)CNC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001563092611 1055286616 /nfs/dbraw/zinc/28/66/16/1055286616.db2.gz RPPRBKOBLAPZHO-UHFFFAOYSA-N 1 2 302.422 4.062 20 0 DIADLO CCOc1cncc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c1 ZINC001236841558 1055289749 /nfs/dbraw/zinc/28/97/49/1055289749.db2.gz RSDBVTBGWAJEOI-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cncc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)c1 ZINC001236841558 1055289758 /nfs/dbraw/zinc/28/97/58/1055289758.db2.gz RSDBVTBGWAJEOI-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cncc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)c1 ZINC001236840609 1055290270 /nfs/dbraw/zinc/29/02/70/1055290270.db2.gz GTBYBHSXRYYWHR-ZDUSSCGKSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1cncc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)c1 ZINC001236840609 1055290277 /nfs/dbraw/zinc/29/02/77/1055290277.db2.gz GTBYBHSXRYYWHR-ZDUSSCGKSA-N 1 2 304.821 4.327 20 0 DIADLO Fc1cc(F)c2cc(C[NH+]3CC4(CCC4)C3)c(Cl)nc2c1 ZINC001236873823 1055299069 /nfs/dbraw/zinc/29/90/69/1055299069.db2.gz QOHOBIUBTQDBGM-UHFFFAOYSA-N 1 2 308.759 4.152 20 0 DIADLO Cc1cccc(-c2ccc(C[N@@H+]3CCC(=O)C(C)(C)C3)cn2)c1C ZINC001236989543 1055325647 /nfs/dbraw/zinc/32/56/47/1055325647.db2.gz OYAXVIPYKXBZQL-UHFFFAOYSA-N 1 2 322.452 4.166 20 0 DIADLO Cc1cccc(-c2ccc(C[N@H+]3CCC(=O)C(C)(C)C3)cn2)c1C ZINC001236989543 1055325670 /nfs/dbraw/zinc/32/56/70/1055325670.db2.gz OYAXVIPYKXBZQL-UHFFFAOYSA-N 1 2 322.452 4.166 20 0 DIADLO Cc1ccc(-c2cncc(C[N@@H+]3CCc4ncsc4C3)c2)cc1 ZINC001237002254 1055334185 /nfs/dbraw/zinc/33/41/85/1055334185.db2.gz JNZBUWUMCOQHBO-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1ccc(-c2cncc(C[N@H+]3CCc4ncsc4C3)c2)cc1 ZINC001237002254 1055334199 /nfs/dbraw/zinc/33/41/99/1055334199.db2.gz JNZBUWUMCOQHBO-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO CC(C)(C)Oc1ccccc1C[N@@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001237024026 1055342171 /nfs/dbraw/zinc/34/21/71/1055342171.db2.gz WFZMOXSMZSJEDP-HNNXBMFYSA-N 1 2 315.379 4.433 20 0 DIADLO CC(C)(C)Oc1ccccc1C[N@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001237024026 1055342182 /nfs/dbraw/zinc/34/21/82/1055342182.db2.gz WFZMOXSMZSJEDP-HNNXBMFYSA-N 1 2 315.379 4.433 20 0 DIADLO CN(C)c1ccc([NH2+][C@H]2CCCC23CCOCC3)cc1Cl ZINC000384957548 1055350145 /nfs/dbraw/zinc/35/01/45/1055350145.db2.gz CWEKXEOCKGWIHR-INIZCTEOSA-N 1 2 308.853 4.167 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccnc(Cl)c1 ZINC000765333146 1055364785 /nfs/dbraw/zinc/36/47/85/1055364785.db2.gz LSSZTOLYVVXNFM-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1cccc(OC(C)(C)C)c1 ZINC001237106364 1055371146 /nfs/dbraw/zinc/37/11/46/1055371146.db2.gz POLJWMLZEZTHMJ-AWEZNQCLSA-N 1 2 321.461 4.026 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1cccc(OC(C)(C)C)c1 ZINC001237106364 1055371154 /nfs/dbraw/zinc/37/11/54/1055371154.db2.gz POLJWMLZEZTHMJ-AWEZNQCLSA-N 1 2 321.461 4.026 20 0 DIADLO CCC(=CC(=O)Nc1c(C)c[nH+]cc1C)c1cccc(Cl)c1 ZINC001537603328 1055377839 /nfs/dbraw/zinc/37/78/39/1055377839.db2.gz DGMYFRXPLHPVKD-ZROIWOOFSA-N 1 2 314.816 4.206 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@@]2(c3ccccc3)CC2(C)C)c(C)[nH+]1 ZINC001587953456 1055404534 /nfs/dbraw/zinc/40/45/34/1055404534.db2.gz TUABXWJSTKHKQG-OAQYLSRUSA-N 1 2 322.452 4.105 20 0 DIADLO COc1nc(Cl)ccc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001237241224 1055407088 /nfs/dbraw/zinc/40/70/88/1055407088.db2.gz JOAVAWLRKNOXDG-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nc(Cl)ccc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001237241224 1055407093 /nfs/dbraw/zinc/40/70/93/1055407093.db2.gz JOAVAWLRKNOXDG-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO C[N@H+](Cc1ccccc1Cl)Cc1ccncc1C(F)(F)F ZINC001237290940 1055418360 /nfs/dbraw/zinc/41/83/60/1055418360.db2.gz QJTIDNLVDJBIIG-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccccc1Cl)Cc1ccncc1C(F)(F)F ZINC001237290940 1055418367 /nfs/dbraw/zinc/41/83/67/1055418367.db2.gz QJTIDNLVDJBIIG-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)COc3ccccc3C(C)C)cc2[nH+]1 ZINC000010895701 1055420087 /nfs/dbraw/zinc/42/00/87/1055420087.db2.gz UGAPGSSTJPIPDE-UHFFFAOYSA-N 1 2 323.396 4.012 20 0 DIADLO CCC[C@H](C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1)c1ccccc1 ZINC000010656906 1055420258 /nfs/dbraw/zinc/42/02/58/1055420258.db2.gz VLTHVVXXUIWDFR-INIZCTEOSA-N 1 2 307.397 4.394 20 0 DIADLO CC[N@H+](CCn1cccn1)Cc1c(Cl)ccc(C)c1Cl ZINC001237332709 1055428648 /nfs/dbraw/zinc/42/86/48/1055428648.db2.gz XDFAOELYENKULP-UHFFFAOYSA-N 1 2 312.244 4.020 20 0 DIADLO CC[N@@H+](CCn1cccn1)Cc1c(Cl)ccc(C)c1Cl ZINC001237332709 1055428657 /nfs/dbraw/zinc/42/86/57/1055428657.db2.gz XDFAOELYENKULP-UHFFFAOYSA-N 1 2 312.244 4.020 20 0 DIADLO Cc1ccc(Cl)c(C[NH+]2CC3(C2)C[C@@H](F)CS3)c1Cl ZINC001237332021 1055429473 /nfs/dbraw/zinc/42/94/73/1055429473.db2.gz QMLITMWDIYCEER-SNVBAGLBSA-N 1 2 320.260 4.331 20 0 DIADLO CC(C)O[C@@H]1CC[N@H+](Cc2c(Cl)cc(F)cc2Cl)C1 ZINC001237599669 1055482804 /nfs/dbraw/zinc/48/28/04/1055482804.db2.gz RJNRGHFCNISMEA-LLVKDONJSA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@@H]1CC[N@@H+](Cc2c(Cl)cc(F)cc2Cl)C1 ZINC001237599669 1055482806 /nfs/dbraw/zinc/48/28/06/1055482806.db2.gz RJNRGHFCNISMEA-LLVKDONJSA-N 1 2 306.208 4.132 20 0 DIADLO Fc1cc(C[N@H+]2CC=C(c3ccccc3)CC2)cnc1Cl ZINC001237404164 1055447801 /nfs/dbraw/zinc/44/78/01/1055447801.db2.gz IWLGEHCISRLNFD-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Fc1cc(C[N@@H+]2CC=C(c3ccccc3)CC2)cnc1Cl ZINC001237404164 1055447805 /nfs/dbraw/zinc/44/78/05/1055447805.db2.gz IWLGEHCISRLNFD-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Clc1ccc([C@@H]2CCC[N@@H+]2Cc2cc3ccccn3n2)cc1 ZINC001237442027 1055452832 /nfs/dbraw/zinc/45/28/32/1055452832.db2.gz GXFVULHBWYSCKQ-SFHVURJKSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1ccc([C@@H]2CCC[N@H+]2Cc2cc3ccccn3n2)cc1 ZINC001237442027 1055452840 /nfs/dbraw/zinc/45/28/40/1055452840.db2.gz GXFVULHBWYSCKQ-SFHVURJKSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc2ccccn2n1 ZINC001237444697 1055454380 /nfs/dbraw/zinc/45/43/80/1055454380.db2.gz ZMMVJWJXFHVPAH-GOSISDBHSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1ccccc1[C@H]1CCC[N@H+]1Cc1cc2ccccn2n1 ZINC001237444697 1055454386 /nfs/dbraw/zinc/45/43/86/1055454386.db2.gz ZMMVJWJXFHVPAH-GOSISDBHSA-N 1 2 311.816 4.325 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1nc(-c2ccc(F)cc2)no1 ZINC000016434837 1055456004 /nfs/dbraw/zinc/45/60/04/1055456004.db2.gz HVYMFDNMUQENHW-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1nc(-c2ccc(F)cc2)no1 ZINC000016434837 1055456010 /nfs/dbraw/zinc/45/60/10/1055456010.db2.gz HVYMFDNMUQENHW-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1nc(-c2ccsc2)no1 ZINC000016431654 1055456060 /nfs/dbraw/zinc/45/60/60/1055456060.db2.gz GVULRPKNONXVRJ-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc(-c2ccsc2)no1 ZINC000016431654 1055456064 /nfs/dbraw/zinc/45/60/64/1055456064.db2.gz GVULRPKNONXVRJ-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO C[N@H+](Cc1c(Cl)[nH]c2cnccc21)Cc1ccc(F)cc1F ZINC001237459361 1055456781 /nfs/dbraw/zinc/45/67/81/1055456781.db2.gz QZIXMCJLZLOQHP-UHFFFAOYSA-N 1 2 321.758 4.127 20 0 DIADLO C[N@@H+](Cc1c(Cl)[nH]c2cnccc21)Cc1ccc(F)cc1F ZINC001237459361 1055456787 /nfs/dbraw/zinc/45/67/87/1055456787.db2.gz QZIXMCJLZLOQHP-UHFFFAOYSA-N 1 2 321.758 4.127 20 0 DIADLO Cc1cc(C[N@@H+]2C[C@@H](C)C[C@H]2CF)c(Br)cc1F ZINC001237507409 1055463516 /nfs/dbraw/zinc/46/35/16/1055463516.db2.gz RYDBLKSDTXFECG-CABZTGNLSA-N 1 2 318.205 4.077 20 0 DIADLO Cc1cc(C[N@H+]2C[C@@H](C)C[C@H]2CF)c(Br)cc1F ZINC001237507409 1055463524 /nfs/dbraw/zinc/46/35/24/1055463524.db2.gz RYDBLKSDTXFECG-CABZTGNLSA-N 1 2 318.205 4.077 20 0 DIADLO Cc1cc(NC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)cc[nH+]1 ZINC000017820848 1055465443 /nfs/dbraw/zinc/46/54/43/1055465443.db2.gz MJHVLNKXDFMFJI-UHFFFAOYSA-N 1 2 305.381 4.002 20 0 DIADLO Cc1cc(NC(=O)c2cc3c(s2)-c2ccccc2CC3)cc[nH+]1 ZINC000017820876 1055465657 /nfs/dbraw/zinc/46/56/57/1055465657.db2.gz LPHDFQZGRLMMFU-UHFFFAOYSA-N 1 2 320.417 4.469 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)nc(Cl)c2O)cc1 ZINC001237536001 1055470386 /nfs/dbraw/zinc/47/03/86/1055470386.db2.gz VVEAUIBTMJNBKZ-UHFFFAOYSA-N 1 2 311.212 4.034 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cc(Cl)nc(Cl)c2O)cc1 ZINC001237536001 1055470395 /nfs/dbraw/zinc/47/03/95/1055470395.db2.gz VVEAUIBTMJNBKZ-UHFFFAOYSA-N 1 2 311.212 4.034 20 0 DIADLO CC1(C)CCC[N@@H+]1Cc1c(F)ccc(Br)c1F ZINC000230345258 1055472766 /nfs/dbraw/zinc/47/27/66/1055472766.db2.gz WCKFVUGKZHHZFS-UHFFFAOYSA-N 1 2 304.178 4.102 20 0 DIADLO CC1(C)CCC[N@H+]1Cc1c(F)ccc(Br)c1F ZINC000230345258 1055472776 /nfs/dbraw/zinc/47/27/76/1055472776.db2.gz WCKFVUGKZHHZFS-UHFFFAOYSA-N 1 2 304.178 4.102 20 0 DIADLO COc1ccccc1/C=C/CNc1cccc(-n2cc[nH+]c2)c1 ZINC001620853577 1055480567 /nfs/dbraw/zinc/48/05/67/1055480567.db2.gz MSFNORHRGJBUIA-FNORWQNLSA-N 1 2 305.381 4.006 20 0 DIADLO c1cn(-c2cccc(NCc3ccccc3OCC3CC3)c2)c[nH+]1 ZINC001620853469 1055480969 /nfs/dbraw/zinc/48/09/69/1055480969.db2.gz GYPWUPAPGPQZRB-UHFFFAOYSA-N 1 2 319.408 4.273 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1ccc3ncnc(Cl)c3c1)C2 ZINC001237591210 1055482825 /nfs/dbraw/zinc/48/28/25/1055482825.db2.gz MLJLQHVCGQLKCV-UHFFFAOYSA-N 1 2 309.800 4.107 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1ccc3ncnc(Cl)c3c1)C2 ZINC001237591210 1055482828 /nfs/dbraw/zinc/48/28/28/1055482828.db2.gz MLJLQHVCGQLKCV-UHFFFAOYSA-N 1 2 309.800 4.107 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)/C=C/C3CCCC3)cc2)[nH+]c1C ZINC001589465789 1055484499 /nfs/dbraw/zinc/48/44/99/1055484499.db2.gz DXHUDNXAYZAZSG-KPKJPENVSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C=CC3CCCC3)cc2)[nH+]c1C ZINC001589465789 1055484505 /nfs/dbraw/zinc/48/45/05/1055484505.db2.gz DXHUDNXAYZAZSG-KPKJPENVSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3CCCC34CC4)cc2)[nH+]c1C ZINC001589467723 1055485075 /nfs/dbraw/zinc/48/50/75/1055485075.db2.gz XECYQPMXDLPSRU-INIZCTEOSA-N 1 2 309.413 4.212 20 0 DIADLO CCc1[nH]ncc1C[N@@H+]1CC[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001237658786 1055496740 /nfs/dbraw/zinc/49/67/40/1055496740.db2.gz LJHPBTAISPDAHY-GFCCVEGCSA-N 1 2 324.255 4.268 20 0 DIADLO CCc1[nH]ncc1C[N@H+]1CC[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001237658786 1055496749 /nfs/dbraw/zinc/49/67/49/1055496749.db2.gz LJHPBTAISPDAHY-GFCCVEGCSA-N 1 2 324.255 4.268 20 0 DIADLO Cc1cc(C)c(Cl)c(C[N@H+](C)Cc2cnc3ccccn23)c1 ZINC001237698344 1055506466 /nfs/dbraw/zinc/50/64/66/1055506466.db2.gz NIHLDNBSGHYAPN-UHFFFAOYSA-N 1 2 313.832 4.237 20 0 DIADLO Cc1cc(C)c(Cl)c(C[N@@H+](C)Cc2cnc3ccccn23)c1 ZINC001237698344 1055506477 /nfs/dbraw/zinc/50/64/77/1055506477.db2.gz NIHLDNBSGHYAPN-UHFFFAOYSA-N 1 2 313.832 4.237 20 0 DIADLO Cc1cc(NCc2ccc(OC(F)F)c(F)c2)ccc1[NH+](C)C ZINC001620884648 1055508635 /nfs/dbraw/zinc/50/86/35/1055508635.db2.gz PJADQFUDYYQWEK-UHFFFAOYSA-N 1 2 324.346 4.414 20 0 DIADLO Cc1cc(C)c(Cl)c(C[N@@H+]2CCC[C@@H]2c2ncccn2)c1 ZINC001237704513 1055508872 /nfs/dbraw/zinc/50/88/72/1055508872.db2.gz ITOHLNCNEHYBTD-OAHLLOKOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C)c(Cl)c(C[N@H+]2CCC[C@@H]2c2ncccn2)c1 ZINC001237704513 1055508884 /nfs/dbraw/zinc/50/88/84/1055508884.db2.gz ITOHLNCNEHYBTD-OAHLLOKOSA-N 1 2 301.821 4.084 20 0 DIADLO Fc1cc(C(F)(F)F)cc(F)c1C[NH+]1CC2(C1)CCCC2 ZINC001237714164 1055514207 /nfs/dbraw/zinc/51/42/07/1055514207.db2.gz JTMVFAPAROKDJH-UHFFFAOYSA-N 1 2 305.290 4.360 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1ncc(Cl)cc1Br ZINC001237758662 1055524967 /nfs/dbraw/zinc/52/49/67/1055524967.db2.gz BPMDBTOCSGNWQI-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1ncc(Cl)cc1Br ZINC001237758662 1055524979 /nfs/dbraw/zinc/52/49/79/1055524979.db2.gz BPMDBTOCSGNWQI-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2)c(Cl)n1 ZINC001237804901 1055531390 /nfs/dbraw/zinc/53/13/90/1055531390.db2.gz ZRCXUDTYZUNZPV-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2)c(Cl)n1 ZINC001237804901 1055531397 /nfs/dbraw/zinc/53/13/97/1055531397.db2.gz ZRCXUDTYZUNZPV-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)ccc1F ZINC001237818889 1055536707 /nfs/dbraw/zinc/53/67/07/1055536707.db2.gz WUANJCFHHQJCOL-QGZVFWFLSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)ccc1F ZINC001237818889 1055536723 /nfs/dbraw/zinc/53/67/23/1055536723.db2.gz WUANJCFHHQJCOL-QGZVFWFLSA-N 1 2 306.331 4.144 20 0 DIADLO CCc1ncc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)s1 ZINC001237830093 1055539825 /nfs/dbraw/zinc/53/98/25/1055539825.db2.gz FNLZGKJEGAPUES-CQSZACIVSA-N 1 2 308.397 4.321 20 0 DIADLO CCc1ncc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)s1 ZINC001237830093 1055539833 /nfs/dbraw/zinc/53/98/33/1055539833.db2.gz FNLZGKJEGAPUES-CQSZACIVSA-N 1 2 308.397 4.321 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cc(C)cnc1Cl ZINC000921548305 1055543477 /nfs/dbraw/zinc/54/34/77/1055543477.db2.gz HYZAEBYFNGGUDI-NSHDSACASA-N 1 2 308.784 4.042 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cc(C)cnc1Cl ZINC000921548303 1055544130 /nfs/dbraw/zinc/54/41/30/1055544130.db2.gz HYZAEBYFNGGUDI-LLVKDONJSA-N 1 2 308.784 4.042 20 0 DIADLO FC1CC[NH+](Cc2c(Cl)cccc2Br)CC1 ZINC001137809562 1055548114 /nfs/dbraw/zinc/54/81/14/1055548114.db2.gz JCJGPBGJDYXVQM-UHFFFAOYSA-N 1 2 306.606 4.036 20 0 DIADLO c1cc2c(c(CNc3ccc([NH+]4CCCC4)cc3)n1)CCCC2 ZINC000921569974 1055571091 /nfs/dbraw/zinc/57/10/91/1055571091.db2.gz SVWLUKNGXFISAN-UHFFFAOYSA-N 1 2 307.441 4.173 20 0 DIADLO CC(C)(C)Oc1ccc(C[NH2+]Cc2nc(C(C)(C)C)co2)cc1 ZINC000921591142 1055574609 /nfs/dbraw/zinc/57/46/09/1055574609.db2.gz GOFKFXXAVDFBJV-UHFFFAOYSA-N 1 2 316.445 4.439 20 0 DIADLO CC[N@H+](Cc1cc(F)c(O)c(Cl)c1)Cc1ccccc1F ZINC001237998210 1055582154 /nfs/dbraw/zinc/58/21/54/1055582154.db2.gz RTBIOZIDADCEKO-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC[N@@H+](Cc1cc(F)c(O)c(Cl)c1)Cc1ccccc1F ZINC001237998210 1055582164 /nfs/dbraw/zinc/58/21/64/1055582164.db2.gz RTBIOZIDADCEKO-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cnc(F)cc2Cl)cc1 ZINC001238026269 1055586249 /nfs/dbraw/zinc/58/62/49/1055586249.db2.gz RGZGOAITXYWDHE-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cnc(F)cc2Cl)cc1 ZINC001238026269 1055586256 /nfs/dbraw/zinc/58/62/56/1055586256.db2.gz RGZGOAITXYWDHE-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc(F)c(C(F)F)c3)cc2[nH+]1 ZINC001595321663 1055586475 /nfs/dbraw/zinc/58/64/75/1055586475.db2.gz PVUMYSFLEGNLJZ-UHFFFAOYSA-N 1 2 319.286 4.200 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCCC[C@H](F)C3)cs2)cc1 ZINC001238037790 1055591078 /nfs/dbraw/zinc/59/10/78/1055591078.db2.gz TXHOETMFOXSGAZ-HNNXBMFYSA-N 1 2 304.434 4.443 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCCC[C@H](F)C3)cs2)cc1 ZINC001238037790 1055591093 /nfs/dbraw/zinc/59/10/93/1055591093.db2.gz TXHOETMFOXSGAZ-HNNXBMFYSA-N 1 2 304.434 4.443 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)c2ccc(F)cc2Cl)c(C)[nH+]1 ZINC001595431457 1055599636 /nfs/dbraw/zinc/59/96/36/1055599636.db2.gz NWNQFVFRZLQYFF-LLVKDONJSA-N 1 2 320.795 4.290 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(OCC3CCCCC3)c2)CCC1=O ZINC001238067542 1055600758 /nfs/dbraw/zinc/60/07/58/1055600758.db2.gz UQPUMKOVYTWWBD-MRXNPFEDSA-N 1 2 315.457 4.057 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(OCC3CCCCC3)c2)CCC1=O ZINC001238067542 1055600763 /nfs/dbraw/zinc/60/07/63/1055600763.db2.gz UQPUMKOVYTWWBD-MRXNPFEDSA-N 1 2 315.457 4.057 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC23CCCC3)c(F)c1Br ZINC001238077287 1055600853 /nfs/dbraw/zinc/60/08/53/1055600853.db2.gz FOPLCBIIEHZGBG-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1ccc(C[N@H+]2CCC23CCCC3)c(F)c1Br ZINC001238077287 1055600856 /nfs/dbraw/zinc/60/08/56/1055600856.db2.gz FOPLCBIIEHZGBG-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(OCC3CCCCC3)c2)CCC1=O ZINC001238067540 1055600899 /nfs/dbraw/zinc/60/08/99/1055600899.db2.gz UQPUMKOVYTWWBD-INIZCTEOSA-N 1 2 315.457 4.057 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(OCC3CCCCC3)c2)CCC1=O ZINC001238067540 1055600904 /nfs/dbraw/zinc/60/09/04/1055600904.db2.gz UQPUMKOVYTWWBD-INIZCTEOSA-N 1 2 315.457 4.057 20 0 DIADLO C[N@H+](Cc1cncc(C2CC2)c1)Cc1ncccc1C(F)(F)F ZINC001238181970 1055615040 /nfs/dbraw/zinc/61/50/40/1055615040.db2.gz OJLFQNCTLSIDKR-UHFFFAOYSA-N 1 2 321.346 4.005 20 0 DIADLO C[N@@H+](Cc1cncc(C2CC2)c1)Cc1ncccc1C(F)(F)F ZINC001238181970 1055615043 /nfs/dbraw/zinc/61/50/43/1055615043.db2.gz OJLFQNCTLSIDKR-UHFFFAOYSA-N 1 2 321.346 4.005 20 0 DIADLO Nc1ccnc(F)c1C[NH+](Cc1ccccc1)Cc1ccccc1 ZINC001238159615 1055615367 /nfs/dbraw/zinc/61/53/67/1055615367.db2.gz HWCSJMRWDIYFHC-UHFFFAOYSA-N 1 2 321.399 4.005 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)cc1Cl ZINC001238153142 1055615526 /nfs/dbraw/zinc/61/55/26/1055615526.db2.gz XMFHZMMNFAHGRR-CQSZACIVSA-N 1 2 319.807 4.249 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@H](Cc3ccccc3)C2)cc1Cl ZINC001238153142 1055615534 /nfs/dbraw/zinc/61/55/34/1055615534.db2.gz XMFHZMMNFAHGRR-CQSZACIVSA-N 1 2 319.807 4.249 20 0 DIADLO Cc1ccc(CC[N@@H+](C)Cc2cc(Cl)c(O)cc2F)cc1 ZINC001238153243 1055615605 /nfs/dbraw/zinc/61/56/05/1055615605.db2.gz YXAIJWWLRRNHAY-UHFFFAOYSA-N 1 2 307.796 4.168 20 0 DIADLO Cc1ccc(CC[N@H+](C)Cc2cc(Cl)c(O)cc2F)cc1 ZINC001238153243 1055615611 /nfs/dbraw/zinc/61/56/11/1055615611.db2.gz YXAIJWWLRRNHAY-UHFFFAOYSA-N 1 2 307.796 4.168 20 0 DIADLO CC(C)c1cc(C[N@@H+]2CCc3cccnc3C2)ccc1Cl ZINC001238225441 1055624724 /nfs/dbraw/zinc/62/47/24/1055624724.db2.gz NNNAZYOYAOUUNH-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1cc(C[N@H+]2CCc3cccnc3C2)ccc1Cl ZINC001238225441 1055624731 /nfs/dbraw/zinc/62/47/31/1055624731.db2.gz NNNAZYOYAOUUNH-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1c(F)ccnc1Cl ZINC001238235509 1055627589 /nfs/dbraw/zinc/62/75/89/1055627589.db2.gz UFKMWFJJSDYTQS-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1c(F)ccnc1Cl ZINC001238235509 1055627593 /nfs/dbraw/zinc/62/75/93/1055627593.db2.gz UFKMWFJJSDYTQS-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO Fc1ccc(C[N@@H+]2CC3CCC2CC3)c(F)c1C(F)(F)F ZINC001238251267 1055629403 /nfs/dbraw/zinc/62/94/03/1055629403.db2.gz WHGDIUMQUYUKLV-UHFFFAOYSA-N 1 2 305.290 4.358 20 0 DIADLO Fc1ccc(C[N@H+]2CC3CCC2CC3)c(F)c1C(F)(F)F ZINC001238251267 1055629410 /nfs/dbraw/zinc/62/94/10/1055629410.db2.gz WHGDIUMQUYUKLV-UHFFFAOYSA-N 1 2 305.290 4.358 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(F)c(OCc3ccccc3)c2)C[C@@H]1F ZINC001238340350 1055640435 /nfs/dbraw/zinc/64/04/35/1055640435.db2.gz RRUQXKPLZGQZKT-KDOFPFPSSA-N 1 2 317.379 4.195 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(F)c(OCc3ccccc3)c2)C[C@@H]1F ZINC001238340350 1055640439 /nfs/dbraw/zinc/64/04/39/1055640439.db2.gz RRUQXKPLZGQZKT-KDOFPFPSSA-N 1 2 317.379 4.195 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@@H](F)C2)cc1OCc1ccccc1 ZINC001238345575 1055642952 /nfs/dbraw/zinc/64/29/52/1055642952.db2.gz SHPBAXUPMZTGHI-QGZVFWFLSA-N 1 2 317.379 4.339 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@@H](F)C2)cc1OCc1ccccc1 ZINC001238345575 1055642957 /nfs/dbraw/zinc/64/29/57/1055642957.db2.gz SHPBAXUPMZTGHI-QGZVFWFLSA-N 1 2 317.379 4.339 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@H](F)C2)cc(OCc2ccccc2)c1 ZINC001238385896 1055649517 /nfs/dbraw/zinc/64/95/17/1055649517.db2.gz GEEXRANFLQVNFY-KRWDZBQOSA-N 1 2 317.379 4.339 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@H](F)C2)cc(OCc2ccccc2)c1 ZINC001238385896 1055649522 /nfs/dbraw/zinc/64/95/22/1055649522.db2.gz GEEXRANFLQVNFY-KRWDZBQOSA-N 1 2 317.379 4.339 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1c(Cl)cncc1Br ZINC001238391253 1055650466 /nfs/dbraw/zinc/65/04/66/1055650466.db2.gz QFBKNYHJRUOURU-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO CC[NH+](CC)Cc1c(F)c(Cl)c(F)cc1Br ZINC001238404407 1055653352 /nfs/dbraw/zinc/65/33/52/1055653352.db2.gz WIJDSYHEADNOJS-UHFFFAOYSA-N 1 2 312.585 4.223 20 0 DIADLO CCOc1ccc(C[N@H+](CC)Cc2ccccn2)c(Cl)c1 ZINC001238403949 1055653549 /nfs/dbraw/zinc/65/35/49/1055653549.db2.gz TZUZSHJBGCIZOH-UHFFFAOYSA-N 1 2 304.821 4.156 20 0 DIADLO CCOc1ccc(C[N@@H+](CC)Cc2ccccn2)c(Cl)c1 ZINC001238403949 1055653555 /nfs/dbraw/zinc/65/35/55/1055653555.db2.gz TZUZSHJBGCIZOH-UHFFFAOYSA-N 1 2 304.821 4.156 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](C)Cc2ccccc2F)c1F ZINC001238426470 1055655432 /nfs/dbraw/zinc/65/54/32/1055655432.db2.gz ISRRAIKMNZJSJY-UHFFFAOYSA-N 1 2 305.368 4.384 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2ccccc2F)c1F ZINC001238426470 1055655441 /nfs/dbraw/zinc/65/54/41/1055655441.db2.gz ISRRAIKMNZJSJY-UHFFFAOYSA-N 1 2 305.368 4.384 20 0 DIADLO CC[N@H+](Cc1cncc(OC(C)C)c1)Cc1ccccc1F ZINC001238472133 1055668521 /nfs/dbraw/zinc/66/85/21/1055668521.db2.gz VBRIREZNIVQGQU-UHFFFAOYSA-N 1 2 302.393 4.030 20 0 DIADLO CC[N@@H+](Cc1cncc(OC(C)C)c1)Cc1ccccc1F ZINC001238472133 1055668527 /nfs/dbraw/zinc/66/85/27/1055668527.db2.gz VBRIREZNIVQGQU-UHFFFAOYSA-N 1 2 302.393 4.030 20 0 DIADLO COc1cnc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c(Cl)c1 ZINC001238485913 1055670939 /nfs/dbraw/zinc/67/09/39/1055670939.db2.gz XWOONJUJLMBLLG-KRWDZBQOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cnc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c(Cl)c1 ZINC001238485913 1055670943 /nfs/dbraw/zinc/67/09/43/1055670943.db2.gz XWOONJUJLMBLLG-KRWDZBQOSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H]1CC[N@@H+]1Cc1cc(F)c(OCc2ccccc2)cc1F ZINC001238512706 1055675553 /nfs/dbraw/zinc/67/55/53/1055675553.db2.gz WGHDUKKESALFKL-CYBMUJFWSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@@H]1CC[N@H+]1Cc1cc(F)c(OCc2ccccc2)cc1F ZINC001238512706 1055675556 /nfs/dbraw/zinc/67/55/56/1055675556.db2.gz WGHDUKKESALFKL-CYBMUJFWSA-N 1 2 303.352 4.138 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@@H+]2CCCC[C@@](C)(F)C2)c1F ZINC001238528229 1055680970 /nfs/dbraw/zinc/68/09/70/1055680970.db2.gz PYWKLDAADNHRPT-QGZVFWFLSA-N 1 2 315.379 4.466 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@H+]2CCCC[C@@](C)(F)C2)c1F ZINC001238528229 1055680975 /nfs/dbraw/zinc/68/09/75/1055680975.db2.gz PYWKLDAADNHRPT-QGZVFWFLSA-N 1 2 315.379 4.466 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@](C)(F)[C@H](F)C2)cnc1-c1ccccc1 ZINC001238605233 1055693520 /nfs/dbraw/zinc/69/35/20/1055693520.db2.gz CDXHNBOEBFMECX-MJGOQNOKSA-N 1 2 316.395 4.329 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@](C)(F)[C@H](F)C2)cnc1-c1ccccc1 ZINC001238605233 1055693526 /nfs/dbraw/zinc/69/35/26/1055693526.db2.gz CDXHNBOEBFMECX-MJGOQNOKSA-N 1 2 316.395 4.329 20 0 DIADLO CC[N@H+](Cc1cnc(F)c(OC(C)C)c1)Cc1ccccc1F ZINC001238602051 1055694408 /nfs/dbraw/zinc/69/44/08/1055694408.db2.gz HGKUIQYVPFNMEI-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO CC[N@@H+](Cc1cnc(F)c(OC(C)C)c1)Cc1ccccc1F ZINC001238602051 1055694411 /nfs/dbraw/zinc/69/44/11/1055694411.db2.gz HGKUIQYVPFNMEI-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO Fc1ncc(-c2ccccc2)cc1C[NH+]1CCC(F)(F)CC1 ZINC001238656422 1055709824 /nfs/dbraw/zinc/70/98/24/1055709824.db2.gz CACHKAZKVKDUQY-UHFFFAOYSA-N 1 2 306.331 4.119 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1cc(-c2ccccc2)cnc1F ZINC001238663184 1055713243 /nfs/dbraw/zinc/71/32/43/1055713243.db2.gz SSUOIAXJFMMWKP-UHFFFAOYSA-N 1 2 321.399 4.305 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1cc(-c2ccccc2)cnc1F ZINC001238663184 1055713255 /nfs/dbraw/zinc/71/32/55/1055713255.db2.gz SSUOIAXJFMMWKP-UHFFFAOYSA-N 1 2 321.399 4.305 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1nc(-c2cccs2)no1 ZINC000045606673 1055726103 /nfs/dbraw/zinc/72/61/03/1055726103.db2.gz VLPMPJYRSOVONQ-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc(-c2cccs2)no1 ZINC000045606673 1055726114 /nfs/dbraw/zinc/72/61/14/1055726114.db2.gz VLPMPJYRSOVONQ-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO CSc1ncc(C)cc1C[N@@H+]1CCc2cc(Cl)ccc2C1 ZINC001238718423 1055732978 /nfs/dbraw/zinc/73/29/78/1055732978.db2.gz OQXAVGGJSJSYJF-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CSc1ncc(C)cc1C[N@H+]1CCc2cc(Cl)ccc2C1 ZINC001238718423 1055732986 /nfs/dbraw/zinc/73/29/86/1055732986.db2.gz OQXAVGGJSJSYJF-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1csc2c1CCCC2 ZINC000045955554 1055733326 /nfs/dbraw/zinc/73/33/26/1055733326.db2.gz WKDQESQALVZDOC-UHFFFAOYSA-N 1 2 323.421 4.065 20 0 DIADLO CC(C)c1ccc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)c(Cl)n1 ZINC001238722191 1055733703 /nfs/dbraw/zinc/73/37/03/1055733703.db2.gz LYAKXZCTRGWIPZ-LLVKDONJSA-N 1 2 302.796 4.336 20 0 DIADLO CC(C)c1ccc(C[N@H+]2CCC(F)(F)[C@H](C)C2)c(Cl)n1 ZINC001238722191 1055733709 /nfs/dbraw/zinc/73/37/09/1055733709.db2.gz LYAKXZCTRGWIPZ-LLVKDONJSA-N 1 2 302.796 4.336 20 0 DIADLO CC[N@H+](Cc1csc(C(C)C)n1)Cc1ccc2c(c1)OCO2 ZINC000046060281 1055735016 /nfs/dbraw/zinc/73/50/16/1055735016.db2.gz GFXAXUYYWJGBSC-UHFFFAOYSA-N 1 2 318.442 4.017 20 0 DIADLO CC[N@@H+](Cc1csc(C(C)C)n1)Cc1ccc2c(c1)OCO2 ZINC000046060281 1055735029 /nfs/dbraw/zinc/73/50/29/1055735029.db2.gz GFXAXUYYWJGBSC-UHFFFAOYSA-N 1 2 318.442 4.017 20 0 DIADLO COc1cc(C)c(C)cc1C[N@H+](C)Cc1ccc(F)cc1F ZINC001238765941 1055743795 /nfs/dbraw/zinc/74/37/95/1055743795.db2.gz HJKDGHCPLYMQCR-UHFFFAOYSA-N 1 2 305.368 4.222 20 0 DIADLO COc1cc(C)c(C)cc1C[N@@H+](C)Cc1ccc(F)cc1F ZINC001238765941 1055743807 /nfs/dbraw/zinc/74/38/07/1055743807.db2.gz HJKDGHCPLYMQCR-UHFFFAOYSA-N 1 2 305.368 4.222 20 0 DIADLO Cc1cc(F)cc(Cl)c1C[N@@H+]1CCc2cc(O)ccc2C1 ZINC001238783217 1055751088 /nfs/dbraw/zinc/75/10/88/1055751088.db2.gz MRCCKSFKZMMANB-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Cc1cc(F)cc(Cl)c1C[N@H+]1CCc2cc(O)ccc2C1 ZINC001238783217 1055751101 /nfs/dbraw/zinc/75/11/01/1055751101.db2.gz MRCCKSFKZMMANB-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO COc1cc(F)c(C[NH+]2CC(c3ccccc3)C2)cc1Cl ZINC001238792222 1055752919 /nfs/dbraw/zinc/75/29/19/1055752919.db2.gz GITCOZPRHJMNSN-UHFFFAOYSA-N 1 2 305.780 4.087 20 0 DIADLO COc1cc(F)c(C[N@H+](C)Cc2cccc(F)c2)cc1Cl ZINC001238787328 1055753383 /nfs/dbraw/zinc/75/33/83/1055753383.db2.gz FENAYWWKLQYNIF-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(F)c(C[N@@H+](C)Cc2cccc(F)c2)cc1Cl ZINC001238787328 1055753395 /nfs/dbraw/zinc/75/33/95/1055753395.db2.gz FENAYWWKLQYNIF-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1cc(Cl)c(OC)cc1F ZINC001238788823 1055753476 /nfs/dbraw/zinc/75/34/76/1055753476.db2.gz DEOKXHVFDRWYQK-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1cc(Cl)c(OC)cc1F ZINC001238788823 1055753486 /nfs/dbraw/zinc/75/34/86/1055753486.db2.gz DEOKXHVFDRWYQK-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO CC(C)Oc1cc(C[N@@H+]2CCc3ccccc3[C@H]2C)c(F)cn1 ZINC001238794716 1055753632 /nfs/dbraw/zinc/75/36/32/1055753632.db2.gz SJMSSJNODOZJCB-CQSZACIVSA-N 1 2 314.404 4.127 20 0 DIADLO CC(C)Oc1cc(C[N@H+]2CCc3ccccc3[C@H]2C)c(F)cn1 ZINC001238794716 1055753641 /nfs/dbraw/zinc/75/36/41/1055753641.db2.gz SJMSSJNODOZJCB-CQSZACIVSA-N 1 2 314.404 4.127 20 0 DIADLO Cc1cc(OC(C)C)ncc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001238830198 1055756736 /nfs/dbraw/zinc/75/67/36/1055756736.db2.gz SXWYZADQMDLCFC-UHFFFAOYSA-N 1 2 320.383 4.184 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1csc2c1CCCC2 ZINC000047533724 1055757641 /nfs/dbraw/zinc/75/76/41/1055757641.db2.gz OHVBXHGEBOAWHH-UHFFFAOYSA-N 1 2 323.421 4.065 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccccc3C3(C)CC3)cc2[nH+]1 ZINC001566328864 1055761941 /nfs/dbraw/zinc/76/19/41/1055761941.db2.gz GUMWPIRZBOGNGJ-UHFFFAOYSA-N 1 2 305.381 4.175 20 0 DIADLO CCCSc1nnc([C@@H](C)[NH+](C)C)n1-c1ccc(Cl)cc1 ZINC000058165642 1055796112 /nfs/dbraw/zinc/79/61/12/1055796112.db2.gz RYHNFQAPVMKBKP-LLVKDONJSA-N 1 2 324.881 4.045 20 0 DIADLO Cc1cccc([C@H](NC(=O)c2cc3c[nH+]ccc3[nH]2)C(C)(C)C)c1 ZINC001597149840 1055797843 /nfs/dbraw/zinc/79/78/43/1055797843.db2.gz DGTPNXOSNOQQSS-SFHVURJKSA-N 1 2 321.424 4.389 20 0 DIADLO Cc1ccc2oc(C(=O)Nc3cccc(-n4cc[nH+]c4)c3)cc2c1 ZINC000058383753 1055798090 /nfs/dbraw/zinc/79/80/90/1055798090.db2.gz AVTVQDMECAGTIW-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001567346143 1055800009 /nfs/dbraw/zinc/80/00/09/1055800009.db2.gz OAPWLADBDAUABQ-YJYMSZOUSA-N 1 2 319.408 4.006 20 0 DIADLO CCc1nc(C[NH+]2CCC(c3cccc4ccccc43)CC2)no1 ZINC000058524990 1055804252 /nfs/dbraw/zinc/80/42/52/1055804252.db2.gz NMPMBLRWMOLREA-UHFFFAOYSA-N 1 2 321.424 4.165 20 0 DIADLO C[C@H]1CO[C@H](C(F)(F)F)C[N@@H+]1Cc1csc2ccccc12 ZINC000671712831 1055804403 /nfs/dbraw/zinc/80/44/03/1055804403.db2.gz JEPZDGHDXZBWCK-HZMBPMFUSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@H]1CO[C@H](C(F)(F)F)C[N@H+]1Cc1csc2ccccc12 ZINC000671712831 1055804412 /nfs/dbraw/zinc/80/44/12/1055804412.db2.gz JEPZDGHDXZBWCK-HZMBPMFUSA-N 1 2 315.360 4.053 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)CCCCC(C)(C)C ZINC001567546608 1055806534 /nfs/dbraw/zinc/80/65/34/1055806534.db2.gz BWQBJGRAOYWXSC-UHFFFAOYSA-N 1 2 321.509 4.291 20 0 DIADLO Cc1ccccc1C(C)(C)C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000058686702 1055810119 /nfs/dbraw/zinc/81/01/19/1055810119.db2.gz APUJHTWJUPMCJO-UHFFFAOYSA-N 1 2 319.408 4.097 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1nc(C)sc1C ZINC000347568304 1055834177 /nfs/dbraw/zinc/83/41/77/1055834177.db2.gz UYDCCVBLPOYBPX-MRXNPFEDSA-N 1 2 304.459 4.352 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1nc(C)sc1C ZINC000347568304 1055834186 /nfs/dbraw/zinc/83/41/86/1055834186.db2.gz UYDCCVBLPOYBPX-MRXNPFEDSA-N 1 2 304.459 4.352 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](Cc2ccccc2)c2ccccc2)o1 ZINC000060378790 1055835835 /nfs/dbraw/zinc/83/58/35/1055835835.db2.gz WAKJUIKSBVRLDC-SFHVURJKSA-N 1 2 321.424 4.267 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)cc1-c1coc2ccccc21 ZINC001239065449 1055836797 /nfs/dbraw/zinc/83/67/97/1055836797.db2.gz WMFDYGXBTYVENP-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO O=C(N[C@@H]1CCC[C@H](c2ccccc2)C1)c1cc2c[nH+]ccc2[nH]1 ZINC001568683580 1055843590 /nfs/dbraw/zinc/84/35/90/1055843590.db2.gz MVLHKOUQZDFEQL-DOTOQJQBSA-N 1 2 319.408 4.019 20 0 DIADLO CCc1ccc(CCC(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000060868448 1055854241 /nfs/dbraw/zinc/85/42/41/1055854241.db2.gz YSGXTMQGWXNWBP-UHFFFAOYSA-N 1 2 319.408 4.006 20 0 DIADLO Cc1c(-c2cc(Cl)cnc2OC(C)C)ccc2[nH+]ccn21 ZINC001239333011 1055873627 /nfs/dbraw/zinc/87/36/27/1055873627.db2.gz WCWDXFIXFVMGAN-UHFFFAOYSA-N 1 2 301.777 4.145 20 0 DIADLO CC(C)C[C@@H](C(=O)NC1CC(C)(C)CC(C)(C)C1)n1cc[nH+]c1 ZINC001597807029 1055878392 /nfs/dbraw/zinc/87/83/92/1055878392.db2.gz XJMUMWZIZLWLJK-INIZCTEOSA-N 1 2 319.493 4.191 20 0 DIADLO CC(C)CCc1noc(C[N@@H+]2CCC[C@H]2c2ccsc2)n1 ZINC000063503837 1055893167 /nfs/dbraw/zinc/89/31/67/1055893167.db2.gz WDPGGMXQBZFBNC-AWEZNQCLSA-N 1 2 305.447 4.057 20 0 DIADLO CC(C)CCc1noc(C[N@H+]2CCC[C@H]2c2ccsc2)n1 ZINC000063503837 1055893178 /nfs/dbraw/zinc/89/31/78/1055893178.db2.gz WDPGGMXQBZFBNC-AWEZNQCLSA-N 1 2 305.447 4.057 20 0 DIADLO CC(C)(C)c1noc(C[NH2+][C@@H](c2ccccc2)C(C)(C)C)n1 ZINC000063550527 1055896800 /nfs/dbraw/zinc/89/68/00/1055896800.db2.gz XSGIGXRUUMJFBY-HNNXBMFYSA-N 1 2 301.434 4.244 20 0 DIADLO CCCC[C@H](C(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C)C(C)C ZINC001598028454 1055905411 /nfs/dbraw/zinc/90/54/11/1055905411.db2.gz KJIHWOXXJYZZJC-INIZCTEOSA-N 1 2 320.477 4.128 20 0 DIADLO Cc1ccccc1-c1ccc(-c2nc3c(o2)CC[N@@H+](C)C3)cc1 ZINC001239503984 1055916071 /nfs/dbraw/zinc/91/60/71/1055916071.db2.gz JMIRASICZUSJIV-UHFFFAOYSA-N 1 2 304.393 4.305 20 0 DIADLO Cc1ccccc1-c1ccc(-c2nc3c(o2)CC[N@H+](C)C3)cc1 ZINC001239503984 1055916086 /nfs/dbraw/zinc/91/60/86/1055916086.db2.gz JMIRASICZUSJIV-UHFFFAOYSA-N 1 2 304.393 4.305 20 0 DIADLO CC(C)Cc1cccc([C@@H](C)C(=O)Nc2ccc3[nH+]ccn3c2)c1 ZINC001539936090 1055935086 /nfs/dbraw/zinc/93/50/86/1055935086.db2.gz ZWJLQDYWVOVLTD-OAHLLOKOSA-N 1 2 321.424 4.275 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2nc(CC(C)C)no2)C(C)C)s1 ZINC000065161901 1055940365 /nfs/dbraw/zinc/94/03/65/1055940365.db2.gz OIWOAHYLKFGVMG-UHFFFAOYSA-N 1 2 307.463 4.049 20 0 DIADLO Cc1ccc(C[N@H+](Cc2nc(CC(C)C)no2)C(C)C)s1 ZINC000065161901 1055940369 /nfs/dbraw/zinc/94/03/69/1055940369.db2.gz OIWOAHYLKFGVMG-UHFFFAOYSA-N 1 2 307.463 4.049 20 0 DIADLO COc1ccccc1-c1ccc(-c2nc3c(o2)CC[N@H+](C)C3)cc1 ZINC001239542708 1055940979 /nfs/dbraw/zinc/94/09/79/1055940979.db2.gz FUZRDYJDGZQMMB-UHFFFAOYSA-N 1 2 320.392 4.005 20 0 DIADLO COc1ccccc1-c1ccc(-c2nc3c(o2)CC[N@@H+](C)C3)cc1 ZINC001239542708 1055940989 /nfs/dbraw/zinc/94/09/89/1055940989.db2.gz FUZRDYJDGZQMMB-UHFFFAOYSA-N 1 2 320.392 4.005 20 0 DIADLO CCOC(=O)c1c[nH+]c2ccccc2c1NCc1ccsc1 ZINC000065227411 1055943534 /nfs/dbraw/zinc/94/35/34/1055943534.db2.gz JSCRIJOXGXXMDP-UHFFFAOYSA-N 1 2 312.394 4.085 20 0 DIADLO CC[N@H+](Cc1nc(C(C)(C)C)no1)[C@@H](C)c1ccc(F)cc1 ZINC000065433345 1055947436 /nfs/dbraw/zinc/94/74/36/1055947436.db2.gz FEPPOSHUEOTILM-LBPRGKRZSA-N 1 2 305.397 4.089 20 0 DIADLO CC[N@@H+](Cc1nc(C(C)(C)C)no1)[C@@H](C)c1ccc(F)cc1 ZINC000065433345 1055947445 /nfs/dbraw/zinc/94/74/45/1055947445.db2.gz FEPPOSHUEOTILM-LBPRGKRZSA-N 1 2 305.397 4.089 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@@H](C)c3ccc(F)cc3C)ccn12 ZINC001598415936 1055949691 /nfs/dbraw/zinc/94/96/91/1055949691.db2.gz NHUCKJZTENZURB-ZDUSSCGKSA-N 1 2 312.344 4.008 20 0 DIADLO CC[N@H+](CC(=O)N[C@@H](C)CCC(C)C)Cc1ccccc1Cl ZINC001540040768 1055957544 /nfs/dbraw/zinc/95/75/44/1055957544.db2.gz ALGAAXGTVJXEQN-HNNXBMFYSA-N 1 2 324.896 4.103 20 0 DIADLO CC[N@@H+](CC(=O)N[C@@H](C)CCC(C)C)Cc1ccccc1Cl ZINC001540040768 1055957553 /nfs/dbraw/zinc/95/75/53/1055957553.db2.gz ALGAAXGTVJXEQN-HNNXBMFYSA-N 1 2 324.896 4.103 20 0 DIADLO Cc1cc(C[NH2+]Cc2cc(C(C)C)no2)c(OC(F)F)cc1C ZINC001620790169 1055963907 /nfs/dbraw/zinc/96/39/07/1055963907.db2.gz XBHUZIYOMUDFHD-UHFFFAOYSA-N 1 2 324.371 4.306 20 0 DIADLO CC(C)c1cc(C[NH2+]Cc2ccc(-c3ccccc3F)o2)on1 ZINC001620789992 1055964503 /nfs/dbraw/zinc/96/45/03/1055964503.db2.gz QLEXMROSLFXWSC-UHFFFAOYSA-N 1 2 314.360 4.487 20 0 DIADLO Clc1ccccc1C1([NH2+][C@@H]2CCCc3scnc32)CC1 ZINC000624005252 1055965416 /nfs/dbraw/zinc/96/54/16/1055965416.db2.gz KWLBFAKIELPVOO-CYBMUJFWSA-N 1 2 304.846 4.453 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccccn2)CC(C)C)c(Cl)n1 ZINC001620601830 1055973922 /nfs/dbraw/zinc/97/39/22/1055973922.db2.gz NEMKHYNROHNPSG-UHFFFAOYSA-N 1 2 303.837 4.097 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccccn2)CC(C)C)c(Cl)n1 ZINC001620601830 1055973935 /nfs/dbraw/zinc/97/39/35/1055973935.db2.gz NEMKHYNROHNPSG-UHFFFAOYSA-N 1 2 303.837 4.097 20 0 DIADLO Cc1cccnc1[C@H](C)[NH2+]Cc1coc(-c2ccccc2F)n1 ZINC001620665040 1055976792 /nfs/dbraw/zinc/97/67/92/1055976792.db2.gz UYKVHYARANCQHM-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ncc(-c3cccs3)o2)c1 ZINC000067374700 1055992221 /nfs/dbraw/zinc/99/22/21/1055992221.db2.gz HPOKARLLXCRIHB-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ncc(-c3cccs3)o2)c1 ZINC000067374700 1055992234 /nfs/dbraw/zinc/99/22/34/1055992234.db2.gz HPOKARLLXCRIHB-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(s1)CCC2)c1nc2ccccc2s1 ZINC001620801364 1055996174 /nfs/dbraw/zinc/99/61/74/1055996174.db2.gz ZPQHFLKICUMRQO-SNVBAGLBSA-N 1 2 315.467 4.092 20 0 DIADLO CCOc1cc(F)cc(C[NH2+][C@H](CF)c2ccc(F)cc2)c1 ZINC001621040238 1056000764 /nfs/dbraw/zinc/00/07/64/1056000764.db2.gz PSKSEMCTJOUPKM-QGZVFWFLSA-N 1 2 309.331 4.164 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2nc3c(s2)CCCC3)C2CC2)n1 ZINC001620812664 1056005344 /nfs/dbraw/zinc/00/53/44/1056005344.db2.gz OVHQUKDGMFGXRP-HNNXBMFYSA-N 1 2 319.499 4.028 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2nc3c(s2)CCCC3)C2CC2)n1 ZINC001620812665 1056005478 /nfs/dbraw/zinc/00/54/78/1056005478.db2.gz OVHQUKDGMFGXRP-OAHLLOKOSA-N 1 2 319.499 4.028 20 0 DIADLO Cc1ccc2[nH+]c(NCc3ccc(OCC4CC4)cc3)[nH]c2c1 ZINC001621046183 1056006118 /nfs/dbraw/zinc/00/61/18/1056006118.db2.gz WJHVMLOSWHHTSI-UHFFFAOYSA-N 1 2 307.397 4.272 20 0 DIADLO COc1ccc(C(C)C)cc1-c1ccc(-n2c[nH+]c(C)c2C)nn1 ZINC001239659558 1056008159 /nfs/dbraw/zinc/00/81/59/1056008159.db2.gz CIQQEZMFLUQUTF-UHFFFAOYSA-N 1 2 322.412 4.078 20 0 DIADLO COc1cccc2[nH]c(NCc3ccc(Cl)c(C)c3)[nH+]c21 ZINC001621053255 1056011222 /nfs/dbraw/zinc/01/12/22/1056011222.db2.gz JWCPZIUFNPVLII-UHFFFAOYSA-N 1 2 301.777 4.145 20 0 DIADLO CCNc1ccccc1CNc1[nH]c2ccc(Cl)cc2[nH+]1 ZINC001621056785 1056013887 /nfs/dbraw/zinc/01/38/87/1056013887.db2.gz DFSHUQQKTJRZCY-UHFFFAOYSA-N 1 2 300.793 4.260 20 0 DIADLO COC1(c2ccccc2)C[NH+](Cc2cc(C)cc(Cl)c2)C1 ZINC001621316175 1056018458 /nfs/dbraw/zinc/01/84/58/1056018458.db2.gz ZBIBDXDSUVNZCK-UHFFFAOYSA-N 1 2 301.817 4.006 20 0 DIADLO CCSc1cccc(C[NH+]2CC(OC)(c3ccccc3)C2)c1 ZINC001621316317 1056019780 /nfs/dbraw/zinc/01/97/80/1056019780.db2.gz CUXJZBDOZZBJFW-UHFFFAOYSA-N 1 2 313.466 4.156 20 0 DIADLO O=C(Nc1cccc(Cl)c1)c1c[nH+]ccc1Nc1ccccc1 ZINC001540363746 1056021108 /nfs/dbraw/zinc/02/11/08/1056021108.db2.gz GAPLQGPTXDXLKN-UHFFFAOYSA-N 1 2 323.783 4.153 20 0 DIADLO Cc1cc(C)cc(NC(=O)[C@H]2CC[C@@H](Nc3cccc[nH+]3)CC2)c1 ZINC001540384373 1056024411 /nfs/dbraw/zinc/02/44/11/1056024411.db2.gz DBISCDWPPPBNHS-CALCHBBNSA-N 1 2 323.440 4.308 20 0 DIADLO COc1ccc2c(c1)nccc2-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001239683998 1056026316 /nfs/dbraw/zinc/02/63/16/1056026316.db2.gz QCPUBUFJQWKBFZ-UHFFFAOYSA-N 1 2 315.376 4.311 20 0 DIADLO COc1ccc2c(c1)nccc2-c1ccccc1Cn1cc[nH+]c1 ZINC001239683447 1056026626 /nfs/dbraw/zinc/02/66/26/1056026626.db2.gz MGWNCTHRYHUSMO-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO COc1cccc(OC)c1C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC001621328008 1056034090 /nfs/dbraw/zinc/03/40/90/1056034090.db2.gz IPWRACGEJFDIBG-INIZCTEOSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cccc(OC)c1C[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC001621328008 1056034103 /nfs/dbraw/zinc/03/41/03/1056034103.db2.gz IPWRACGEJFDIBG-INIZCTEOSA-N 1 2 317.816 4.304 20 0 DIADLO Cc1cc(F)ccc1-c1ccc(-c2nc3c(o2)CC[N@@H+](C)C3)cc1 ZINC001239740743 1056049803 /nfs/dbraw/zinc/04/98/03/1056049803.db2.gz HRPGLZKBLYKAPA-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO Cc1cc(F)ccc1-c1ccc(-c2nc3c(o2)CC[N@H+](C)C3)cc1 ZINC001239740743 1056049813 /nfs/dbraw/zinc/04/98/13/1056049813.db2.gz HRPGLZKBLYKAPA-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO CC(=O)Nc1ccccc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001239778517 1056070871 /nfs/dbraw/zinc/07/08/71/1056070871.db2.gz BVCXFDQOFYIJTL-UHFFFAOYSA-N 1 2 309.413 4.006 20 0 DIADLO CN(C)c1ccc(C[N@H+](C)Cc2csc(C(C)(C)C)n2)cc1 ZINC000051588403 1056106376 /nfs/dbraw/zinc/10/63/76/1056106376.db2.gz HZOKWUXROYINJX-UHFFFAOYSA-N 1 2 317.502 4.139 20 0 DIADLO CN(C)c1ccc(C[N@@H+](C)Cc2csc(C(C)(C)C)n2)cc1 ZINC000051588403 1056106380 /nfs/dbraw/zinc/10/63/80/1056106380.db2.gz HZOKWUXROYINJX-UHFFFAOYSA-N 1 2 317.502 4.139 20 0 DIADLO CCC[C@H](CC)C(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC001542205289 1056109522 /nfs/dbraw/zinc/10/95/22/1056109522.db2.gz WTDCRPWNNAVCJZ-KGLIPLIRSA-N 1 2 323.506 4.140 20 0 DIADLO CCC[C@H](CC)C(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC001542205289 1056109526 /nfs/dbraw/zinc/10/95/26/1056109526.db2.gz WTDCRPWNNAVCJZ-KGLIPLIRSA-N 1 2 323.506 4.140 20 0 DIADLO COC1CCC(Nc2cc[nH+]c(OCc3ccccc3)c2)CC1 ZINC001168614644 1056110898 /nfs/dbraw/zinc/11/08/98/1056110898.db2.gz ODVFCNGNFWOATI-UHFFFAOYSA-N 1 2 312.413 4.030 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001542254432 1056113665 /nfs/dbraw/zinc/11/36/65/1056113665.db2.gz UTORQMLWTCYSPJ-GFCCVEGCSA-N 1 2 319.364 4.109 20 0 DIADLO Cc1ccccc1C[C@@H](C)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001542442067 1056123241 /nfs/dbraw/zinc/12/32/41/1056123241.db2.gz GXRRENIJROKTFN-OAHLLOKOSA-N 1 2 319.408 4.202 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1cccnc1Cl)CCC2 ZINC000765812453 1056157482 /nfs/dbraw/zinc/15/74/82/1056157482.db2.gz AXYBMZCQHZBJRQ-WFASDCNBSA-N 1 2 318.852 4.241 20 0 DIADLO Cc1cccc(C)c1C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001542875496 1056160433 /nfs/dbraw/zinc/16/04/33/1056160433.db2.gz JVLVOWKHBRFHLE-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H](C)Cc3ccco3)cc2)[nH+]c1C ZINC000921656802 1056168707 /nfs/dbraw/zinc/16/87/07/1056168707.db2.gz XSOSNFSNKKGPCD-LBPRGKRZSA-N 1 2 323.396 4.104 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)CCC(C)(F)F)cc2)[nH+]c1C ZINC000921664423 1056174176 /nfs/dbraw/zinc/17/41/76/1056174176.db2.gz AATLQTPXRGSUKG-UHFFFAOYSA-N 1 2 307.344 4.067 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2c(ccn2C)c1 ZINC001239943785 1056177347 /nfs/dbraw/zinc/17/73/47/1056177347.db2.gz PXGPNXVSCSFMLU-UHFFFAOYSA-N 1 2 303.365 4.040 20 0 DIADLO CCn1ccc(C(=O)Nc2ccc(-c3[nH]c(C)c(C)[nH+]3)cc2)c1C ZINC000921669029 1056177615 /nfs/dbraw/zinc/17/76/15/1056177615.db2.gz FSBFQARDZZJZCB-UHFFFAOYSA-N 1 2 322.412 4.076 20 0 DIADLO CCOc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)nc1 ZINC000674389041 1056185871 /nfs/dbraw/zinc/18/58/71/1056185871.db2.gz NJUBGCLRKFPDCS-ZDUSSCGKSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)nc1 ZINC000674389041 1056185888 /nfs/dbraw/zinc/18/58/88/1056185888.db2.gz NJUBGCLRKFPDCS-ZDUSSCGKSA-N 1 2 304.821 4.327 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@H]2CCCc3cn(C(C)C)nc32)o1 ZINC000765820142 1056211114 /nfs/dbraw/zinc/21/11/14/1056211114.db2.gz SVAGZIUPLHWKMH-CJNGLKHVSA-N 1 2 301.434 4.348 20 0 DIADLO CC[C@@H](Cc1ccccc1)Nc1nc2ccccc2n2c[nH+]cc12 ZINC001611929959 1056211011 /nfs/dbraw/zinc/21/10/11/1056211011.db2.gz HPOHVPRWOFDCJA-INIZCTEOSA-N 1 2 316.408 4.316 20 0 DIADLO CCCOc1ccc(-c2c[nH+]c(N(C)C)cc2C)c(F)c1F ZINC001239971237 1056212695 /nfs/dbraw/zinc/21/26/95/1056212695.db2.gz XIVMLNLLMWBNPI-UHFFFAOYSA-N 1 2 306.356 4.190 20 0 DIADLO Cc1cc(N(CCC(F)(F)F)CC2CC2)nc(C2CCC2)[nH+]1 ZINC001612069944 1056234789 /nfs/dbraw/zinc/23/47/89/1056234789.db2.gz KKENEMHKTPQPQL-UHFFFAOYSA-N 1 2 313.367 4.221 20 0 DIADLO CCC(CC)(C(=O)Nc1cc[nH+]c(C)c1)c1ccc(Cl)cc1 ZINC001584004482 1056235662 /nfs/dbraw/zinc/23/56/62/1056235662.db2.gz DKRSRHUGRXYOMM-UHFFFAOYSA-N 1 2 316.832 4.162 20 0 DIADLO CN(c1nc2ccccc2n2c[nH+]cc12)C1CCC(C)(C)CC1 ZINC001612102292 1056238998 /nfs/dbraw/zinc/23/89/98/1056238998.db2.gz PBTOMQPHYVALLR-UHFFFAOYSA-N 1 2 308.429 4.288 20 0 DIADLO CCc1nccc(Nc2ccc([N@@H+]3CCCC[C@H]3C)cc2C)n1 ZINC001612135528 1056246173 /nfs/dbraw/zinc/24/61/73/1056246173.db2.gz IDZCZTHTPMQHJV-OAHLLOKOSA-N 1 2 310.445 4.470 20 0 DIADLO CCc1nccc(Nc2ccc([N@H+]3CCCC[C@H]3C)cc2C)n1 ZINC001612135528 1056246182 /nfs/dbraw/zinc/24/61/82/1056246182.db2.gz IDZCZTHTPMQHJV-OAHLLOKOSA-N 1 2 310.445 4.470 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1sccc1C(F)F ZINC001543553668 1056249528 /nfs/dbraw/zinc/24/95/28/1056249528.db2.gz RLTLJHNRHGUIFF-UHFFFAOYSA-N 1 2 319.336 4.124 20 0 DIADLO CC[C@H](C)[C@H]1CCCCN1c1nc2ccccc2n2c[nH+]cc12 ZINC001612199772 1056252124 /nfs/dbraw/zinc/25/21/24/1056252124.db2.gz IGIDVEZXTOGMOM-GOEBONIOSA-N 1 2 308.429 4.288 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc(N2CCCCC2)cc1 ZINC001240013002 1056252921 /nfs/dbraw/zinc/25/29/21/1056252921.db2.gz RSISJWPFHSRKCZ-UHFFFAOYSA-N 1 2 307.397 4.229 20 0 DIADLO Cc1cc(N2CCC[C@@]2(C)Cc2ccccc2)nc(C2CC2)[nH+]1 ZINC001612224911 1056256153 /nfs/dbraw/zinc/25/61/53/1056256153.db2.gz VTPGSLFDYZFLPJ-FQEVSTJZSA-N 1 2 307.441 4.264 20 0 DIADLO Cc1cc(-c2ccc(C(=O)N3CCC(C)CC3)cc2)cc(C)[nH+]1 ZINC001240040710 1056275843 /nfs/dbraw/zinc/27/58/43/1056275843.db2.gz CVFSEDNMTXEKOK-UHFFFAOYSA-N 1 2 308.425 4.238 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(F)cc2[nH]ccc21 ZINC001240042837 1056278762 /nfs/dbraw/zinc/27/87/62/1056278762.db2.gz VPEFOLUAROGGCK-UHFFFAOYSA-N 1 2 307.328 4.168 20 0 DIADLO Cc1nc(N2CC[C@H](C(C)(C)C)C[C@H]2C)c2c([nH+]1)CCCC2 ZINC001612443648 1056288424 /nfs/dbraw/zinc/28/84/24/1056288424.db2.gz JAFUEHKNLTWKGM-HIFRSBDPSA-N 1 2 301.478 4.315 20 0 DIADLO Cc1nc(N[C@H]2CCCc3c(F)cccc32)c2c([nH+]1)CCCC2 ZINC001612438425 1056288995 /nfs/dbraw/zinc/28/89/95/1056288995.db2.gz IDQOEALPYMJYIY-KRWDZBQOSA-N 1 2 311.404 4.292 20 0 DIADLO CC[N@@H+](Cc1ccc(Br)cn1)Cc1ccccc1F ZINC001116438150 1056293785 /nfs/dbraw/zinc/29/37/85/1056293785.db2.gz DZAQAAPSMUHMSQ-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@H+](Cc1ccc(Br)cn1)Cc1ccccc1F ZINC001116438150 1056293772 /nfs/dbraw/zinc/29/37/72/1056293772.db2.gz DZAQAAPSMUHMSQ-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO Cc1[nH+]c(C(C)(C)C)nc(N[C@H]2CCNc3ccccc32)c1C ZINC001168640120 1056311845 /nfs/dbraw/zinc/31/18/45/1056311845.db2.gz GJSSJIRGZYQLIJ-INIZCTEOSA-N 1 2 310.445 4.360 20 0 DIADLO CC(C)c1cc(N[C@@H](c2ccccc2)[C@H](C)O)nc(C(C)C)[nH+]1 ZINC001612656529 1056317577 /nfs/dbraw/zinc/31/75/77/1056317577.db2.gz DHXLOLKMVDXGJR-KBXCAEBGSA-N 1 2 313.445 4.257 20 0 DIADLO C/C=C/C[C@@H]1CCCN(c2nc3ccccc3n3c[nH+]cc23)C1 ZINC001612685303 1056318505 /nfs/dbraw/zinc/31/85/05/1056318505.db2.gz PYZBOEBVZNNXCA-XYBNCVKDSA-N 1 2 306.413 4.065 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2cccc(C(=O)NCC(C)C)c2)cc1 ZINC001240092255 1056318366 /nfs/dbraw/zinc/31/83/66/1056318366.db2.gz KFOUKWFIKDZQSI-UHFFFAOYSA-N 1 2 324.424 4.101 20 0 DIADLO Cc1cccc(Oc2cc(C[NH2+][C@@H](C)c3ncc[nH]3)ccn2)c1C ZINC000353515919 1056325908 /nfs/dbraw/zinc/32/59/08/1056325908.db2.gz IMLXAAMUMSXZNC-HNNXBMFYSA-N 1 2 322.412 4.065 20 0 DIADLO CC[C@H](Nc1[nH+]cnc2c1cnn2C)c1cccc2ccccc21 ZINC001612924687 1056339274 /nfs/dbraw/zinc/33/92/74/1056339274.db2.gz CGNFVMXOAPADEQ-KRWDZBQOSA-N 1 2 317.396 4.080 20 0 DIADLO Cc1cc(N[C@H]2C[C@H](c3ccc(F)cc3F)C2)nc(C2CC2)[nH+]1 ZINC001612978852 1056341950 /nfs/dbraw/zinc/34/19/50/1056341950.db2.gz AAYBYVRDNCEQQZ-MQMHXKEQSA-N 1 2 315.367 4.299 20 0 DIADLO Cc1ccc(Cl)cc1CNc1nc2ccccc2n2c[nH+]cc12 ZINC001613026923 1056343867 /nfs/dbraw/zinc/34/38/67/1056343867.db2.gz OCVZOYMXTKJFNO-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO C[C@@H]1CCc2c(sc3ncnc(-c4ccc5[nH+]ccn5c4)c23)C1 ZINC001240213310 1056371170 /nfs/dbraw/zinc/37/11/70/1056371170.db2.gz CAUBGYNVLXFWNK-LLVKDONJSA-N 1 2 320.421 4.131 20 0 DIADLO CCCN(C(=O)c1cc2c[nH+]ccc2[nH]1)[C@@H]1CCc2ccccc21 ZINC001544159407 1056373141 /nfs/dbraw/zinc/37/31/41/1056373141.db2.gz PFWRBPDMBSJWQZ-LJQANCHMSA-N 1 2 319.408 4.103 20 0 DIADLO CC(C)COc1c(F)cc(-c2ccc3[nH+]ccn3c2)cc1F ZINC001240218821 1056375024 /nfs/dbraw/zinc/37/50/24/1056375024.db2.gz KPYUDAGXKUAGRG-UHFFFAOYSA-N 1 2 302.324 4.314 20 0 DIADLO Fc1ccc(Oc2cccc(-c3ccc4[nH+]ccn4c3)n2)cc1 ZINC001240217641 1056375108 /nfs/dbraw/zinc/37/51/08/1056375108.db2.gz STIVKBMXEYXXOS-UHFFFAOYSA-N 1 2 305.312 4.328 20 0 DIADLO COC(=O)c1cc2c(cccc2-c2ccc3[nH+]ccn3c2)s1 ZINC001240217525 1056376013 /nfs/dbraw/zinc/37/60/13/1056376013.db2.gz HNOHTTJGVZVUJI-UHFFFAOYSA-N 1 2 308.362 4.003 20 0 DIADLO Fc1c(F)c(-c2ccc3[nH+]ccn3c2)ccc1OC(F)(F)F ZINC001240219678 1056376290 /nfs/dbraw/zinc/37/62/90/1056376290.db2.gz RDTOOINOTVLKFM-UHFFFAOYSA-N 1 2 314.213 4.178 20 0 DIADLO CN(C)c1ccc(-c2ccc3[nH+]ccn3c2)cc1C(F)(F)F ZINC001240219679 1056376908 /nfs/dbraw/zinc/37/69/08/1056376908.db2.gz RESNZGWAPKPBRP-UHFFFAOYSA-N 1 2 305.303 4.086 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1noc2c1CCCC2 ZINC000108851965 1056379539 /nfs/dbraw/zinc/37/95/39/1056379539.db2.gz NKOOEIWPFVSYOB-CYBMUJFWSA-N 1 2 310.397 4.493 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1noc2c1CCCC2 ZINC000108851965 1056379554 /nfs/dbraw/zinc/37/95/54/1056379554.db2.gz NKOOEIWPFVSYOB-CYBMUJFWSA-N 1 2 310.397 4.493 20 0 DIADLO CCCc1cc(N[C@@H]2CCCc3cccnc32)nc(CCC)[nH+]1 ZINC001168655337 1056386455 /nfs/dbraw/zinc/38/64/55/1056386455.db2.gz DFQNFCJZMQVRMK-MRXNPFEDSA-N 1 2 310.445 4.266 20 0 DIADLO CC(C)(C)C[C@H]1CCN(C(=O)c2cccc3[nH+]ccn32)C1(C)C ZINC001584834598 1056430222 /nfs/dbraw/zinc/43/02/22/1056430222.db2.gz RMVIQXKLWWUFNT-CQSZACIVSA-N 1 2 313.445 4.011 20 0 DIADLO COc1ccc2cc(N[C@H]3CCCc4cccnc43)[nH+]cc2c1 ZINC001168657396 1056447356 /nfs/dbraw/zinc/44/73/56/1056447356.db2.gz ZKEKGPZQMQRSMM-KRWDZBQOSA-N 1 2 305.381 4.128 20 0 DIADLO Cc1cc(NC(=O)[C@H]2[C@@H]3CCCCCC[C@@H]32)ccc1-n1cc[nH+]c1 ZINC001584952851 1056449986 /nfs/dbraw/zinc/44/99/86/1056449986.db2.gz LEHCEHWXJAEZJC-DZFIZOCASA-N 1 2 323.440 4.336 20 0 DIADLO Cn1cc(-c2ccc(-c3cccc(-c4c[nH+]cn4C)c3)cc2)cn1 ZINC001240365215 1056450263 /nfs/dbraw/zinc/45/02/63/1056450263.db2.gz KYTSCUOUMRFHJG-UHFFFAOYSA-N 1 2 314.392 4.155 20 0 DIADLO CC(C)[C@@H]1N(C(=O)C[C@@H](C)n2cc[nH+]c2)CC12CCCCCC2 ZINC001544619367 1056467932 /nfs/dbraw/zinc/46/79/32/1056467932.db2.gz QHQGBZRXPCTMKT-AEFFLSMTSA-N 1 2 317.477 4.042 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2nccc3c2CCCC3)on1 ZINC000921785587 1056489650 /nfs/dbraw/zinc/48/96/50/1056489650.db2.gz MJHMVKUKLIKRGB-UHFFFAOYSA-N 1 2 313.445 4.142 20 0 DIADLO CCc1noc(C)c1CNc1cc[nH+]c2c(Cl)cccc12 ZINC000338731271 1056504782 /nfs/dbraw/zinc/50/47/82/1056504782.db2.gz WAZOAZVVBPEVCT-UHFFFAOYSA-N 1 2 301.777 4.359 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccc(-n2cccn2)cc1 ZINC000921806137 1056506439 /nfs/dbraw/zinc/50/64/39/1056506439.db2.gz JCTJQZNLBYCUFE-CQSZACIVSA-N 1 2 324.428 4.009 20 0 DIADLO COC(=O)[C@H](c1ccc(F)cc1)[N@@H+]1CCCC2(CCCCC2)C1 ZINC001615454074 1056512868 /nfs/dbraw/zinc/51/28/68/1056512868.db2.gz MIVAHBTWZDNAAM-KRWDZBQOSA-N 1 2 319.420 4.086 20 0 DIADLO COC(=O)[C@H](c1ccc(F)cc1)[N@H+]1CCCC2(CCCCC2)C1 ZINC001615454074 1056512872 /nfs/dbraw/zinc/51/28/72/1056512872.db2.gz MIVAHBTWZDNAAM-KRWDZBQOSA-N 1 2 319.420 4.086 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@@H+]2CC=C(Cl)Cl)cc1 ZINC001615484333 1056518686 /nfs/dbraw/zinc/51/86/86/1056518686.db2.gz FHZWPXDTNWAUGO-ZDUSSCGKSA-N 1 2 302.270 4.404 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@H+]2CC=C(Cl)Cl)cc1 ZINC001615484333 1056518698 /nfs/dbraw/zinc/51/86/98/1056518698.db2.gz FHZWPXDTNWAUGO-ZDUSSCGKSA-N 1 2 302.270 4.404 20 0 DIADLO CC(C)(C)c1cc2c(ncnc2-c2ccn3cc[nH+]c3c2)s1 ZINC001240497131 1056537711 /nfs/dbraw/zinc/53/77/11/1056537711.db2.gz ZATBMFMRJIBJOL-UHFFFAOYSA-N 1 2 308.410 4.304 20 0 DIADLO CC(C)C[C@H](C(=O)N1CCCC[C@H]1CC1CCC1)n1cc[nH+]c1 ZINC001585376829 1056541188 /nfs/dbraw/zinc/54/11/88/1056541188.db2.gz WIXHRSWMYBVSFH-ZWKOTPCHSA-N 1 2 317.477 4.042 20 0 DIADLO CC[C@H]1CCCCC[N@@H+]1Cc1ncsc1Br ZINC001615595805 1056542300 /nfs/dbraw/zinc/54/23/00/1056542300.db2.gz LLUUVUIULGPZEK-JTQLQIEISA-N 1 2 303.269 4.060 20 0 DIADLO CC[C@H]1CCCCC[N@H+]1Cc1ncsc1Br ZINC001615595805 1056542312 /nfs/dbraw/zinc/54/23/12/1056542312.db2.gz LLUUVUIULGPZEK-JTQLQIEISA-N 1 2 303.269 4.060 20 0 DIADLO CCc1cc(-c2ccn3cc[nH+]c3c2)nnc1-c1ccccc1 ZINC001240504744 1056542982 /nfs/dbraw/zinc/54/29/82/1056542982.db2.gz WVPKLCIHIDEJGO-UHFFFAOYSA-N 1 2 300.365 4.021 20 0 DIADLO c1cn2ccc(-c3nc(-c4ccncc4)nc4ccccc43)cc2[nH+]1 ZINC001240504443 1056543011 /nfs/dbraw/zinc/54/30/11/1056543011.db2.gz OXFMWOGQFSERBD-UHFFFAOYSA-N 1 2 323.359 4.007 20 0 DIADLO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cc1ncsc1Br ZINC001615600717 1056543088 /nfs/dbraw/zinc/54/30/88/1056543088.db2.gz NFLKYFVLFSFMKN-PWSUYJOCSA-N 1 2 317.296 4.306 20 0 DIADLO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1ncsc1Br ZINC001615600717 1056543098 /nfs/dbraw/zinc/54/30/98/1056543098.db2.gz NFLKYFVLFSFMKN-PWSUYJOCSA-N 1 2 317.296 4.306 20 0 DIADLO CC[C@@H]1CCCCC[N@@H+]1Cc1ncsc1Br ZINC001615595806 1056544610 /nfs/dbraw/zinc/54/46/10/1056544610.db2.gz LLUUVUIULGPZEK-SNVBAGLBSA-N 1 2 303.269 4.060 20 0 DIADLO CC[C@@H]1CCCCC[N@H+]1Cc1ncsc1Br ZINC001615595806 1056544621 /nfs/dbraw/zinc/54/46/21/1056544621.db2.gz LLUUVUIULGPZEK-SNVBAGLBSA-N 1 2 303.269 4.060 20 0 DIADLO FC(F)(F)Oc1ccccc1CNc1cc2cc[nH]c2c[nH+]1 ZINC000672157768 1056550865 /nfs/dbraw/zinc/55/08/65/1056550865.db2.gz SCRKKEZYXVZGTG-UHFFFAOYSA-N 1 2 307.275 4.074 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@H](C)c1nc(-c2ccccc2C)no1 ZINC000074990008 1056559956 /nfs/dbraw/zinc/55/99/56/1056559956.db2.gz GRSRAKFECLBUED-CQSZACIVSA-N 1 2 311.385 4.221 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@H](C)c1nc(-c2ccccc2C)no1 ZINC000074990008 1056559972 /nfs/dbraw/zinc/55/99/72/1056559972.db2.gz GRSRAKFECLBUED-CQSZACIVSA-N 1 2 311.385 4.221 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cc(F)c(OC(F)F)c(F)c1 ZINC001212444507 1056564725 /nfs/dbraw/zinc/56/47/25/1056564725.db2.gz ATZUXXCZDQAIJG-UHFFFAOYSA-N 1 2 316.254 4.104 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+][C@@H]2CCCc3cn[nH]c32)c1Cl ZINC000921862463 1056570779 /nfs/dbraw/zinc/57/07/79/1056570779.db2.gz RLUNAFZJQJEVJG-CYBMUJFWSA-N 1 2 310.228 4.192 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+][C@@H]2CCCc3c[nH]nc32)c1Cl ZINC000921862463 1056570789 /nfs/dbraw/zinc/57/07/89/1056570789.db2.gz RLUNAFZJQJEVJG-CYBMUJFWSA-N 1 2 310.228 4.192 20 0 DIADLO c1ccc([C@H](CC2CC2)Nc2cc(N3CCCC3)nc[nH+]2)cc1 ZINC000672224291 1056573385 /nfs/dbraw/zinc/57/33/85/1056573385.db2.gz AMCOFXMAVCIGEB-KRWDZBQOSA-N 1 2 308.429 4.030 20 0 DIADLO c1ccc([C@H](CC2CC2)Nc2cc(N3CCCC3)[nH+]cn2)cc1 ZINC000672224291 1056573400 /nfs/dbraw/zinc/57/34/00/1056573400.db2.gz AMCOFXMAVCIGEB-KRWDZBQOSA-N 1 2 308.429 4.030 20 0 DIADLO C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)Cc1ncccc1F ZINC001621184281 1056579476 /nfs/dbraw/zinc/57/94/76/1056579476.db2.gz MLZCAEYMKGDVES-LLVKDONJSA-N 1 2 312.310 4.433 20 0 DIADLO C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)Cc1ncccc1F ZINC001621184281 1056579491 /nfs/dbraw/zinc/57/94/91/1056579491.db2.gz MLZCAEYMKGDVES-LLVKDONJSA-N 1 2 312.310 4.433 20 0 DIADLO Clc1cccc2c(N[C@H]3CCO[C@@H](C4CC4)C3)cc[nH+]c12 ZINC000672251214 1056593663 /nfs/dbraw/zinc/59/36/63/1056593663.db2.gz LWZJRSCHFNTPEI-BLLLJJGKSA-N 1 2 302.805 4.258 20 0 DIADLO C[C@@H](C(=O)Nc1cccc2ccccc21)[N@H+](C)Cc1ccsc1 ZINC000007927049 1056602798 /nfs/dbraw/zinc/60/27/98/1056602798.db2.gz FJPSEPJRVBAQMB-AWEZNQCLSA-N 1 2 324.449 4.360 20 0 DIADLO C[C@@H](C(=O)Nc1cccc2ccccc21)[N@@H+](C)Cc1ccsc1 ZINC000007927049 1056602802 /nfs/dbraw/zinc/60/28/02/1056602802.db2.gz FJPSEPJRVBAQMB-AWEZNQCLSA-N 1 2 324.449 4.360 20 0 DIADLO CCCC[N@H+](Cc1ccoc1C(=O)OC)Cc1ccccc1F ZINC000063755227 1056604849 /nfs/dbraw/zinc/60/48/49/1056604849.db2.gz VWJAZGVRIUQFDR-UHFFFAOYSA-N 1 2 319.376 4.008 20 0 DIADLO CCCC[N@@H+](Cc1ccoc1C(=O)OC)Cc1ccccc1F ZINC000063755227 1056604855 /nfs/dbraw/zinc/60/48/55/1056604855.db2.gz VWJAZGVRIUQFDR-UHFFFAOYSA-N 1 2 319.376 4.008 20 0 DIADLO Cc1ccc(F)c2c1CCCN2Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001616014138 1056605177 /nfs/dbraw/zinc/60/51/77/1056605177.db2.gz VESNLXMSBNACTI-UHFFFAOYSA-N 1 2 321.399 4.273 20 0 DIADLO CC[C@H](C)C[C@@H](C)Nc1ccc(C)cc1C[NH+]1CCOCC1 ZINC001168694392 1056608402 /nfs/dbraw/zinc/60/84/02/1056608402.db2.gz PTFHDAXMLXUEJR-DOTOQJQBSA-N 1 2 304.478 4.064 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2csc(C(C)C)n2)cc1 ZINC000076429581 1056624322 /nfs/dbraw/zinc/62/43/22/1056624322.db2.gz YIRRSCFBNHJKBP-ZDUSSCGKSA-N 1 2 304.459 4.468 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2csc(C(C)C)n2)cc1 ZINC000076429581 1056624325 /nfs/dbraw/zinc/62/43/25/1056624325.db2.gz YIRRSCFBNHJKBP-ZDUSSCGKSA-N 1 2 304.459 4.468 20 0 DIADLO COc1cc(-c2cccc(-c3c[nH+]cn3C)c2)cc(F)c1F ZINC001240662455 1056629840 /nfs/dbraw/zinc/62/98/40/1056629840.db2.gz RXEROMMEFYUQEI-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO Brc1cscc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000347676280 1056662539 /nfs/dbraw/zinc/66/25/39/1056662539.db2.gz PVCHBAKZECORFN-CYBMUJFWSA-N 1 2 311.248 4.176 20 0 DIADLO Brc1cscc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000347676280 1056662529 /nfs/dbraw/zinc/66/25/29/1056662529.db2.gz PVCHBAKZECORFN-CYBMUJFWSA-N 1 2 311.248 4.176 20 0 DIADLO Cc1cc(F)cc(-c2cccc(F)c2C)c1C[NH+]1CCOCC1 ZINC001240732037 1056666338 /nfs/dbraw/zinc/66/63/38/1056666338.db2.gz FJLNSHJLPMYPRR-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@H]2CCCc3cc(F)ccc32)n1 ZINC000921948799 1056671796 /nfs/dbraw/zinc/67/17/96/1056671796.db2.gz HPHUYOLHXOBEOR-HNNXBMFYSA-N 1 2 302.393 4.278 20 0 DIADLO CC(C)(C)c1cccc(C[NH2+][C@H](CO)c2c(F)cccc2F)c1 ZINC001616538023 1056673622 /nfs/dbraw/zinc/67/36/22/1056673622.db2.gz CCSXMBFEZZGAFA-QGZVFWFLSA-N 1 2 319.395 4.086 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@@H]2CCCc3ccc(F)cc32)n1 ZINC000921959458 1056681977 /nfs/dbraw/zinc/68/19/77/1056681977.db2.gz GSJURKYTSAHFOL-OAHLLOKOSA-N 1 2 302.393 4.278 20 0 DIADLO COCOc1cc(C)ccc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001240762729 1056685350 /nfs/dbraw/zinc/68/53/50/1056685350.db2.gz HRYXQSQKOKGPBA-UHFFFAOYSA-N 1 2 308.381 4.045 20 0 DIADLO Cc1ccccc1[C@H]([NH2+][C@H](C(=O)OC(C)(C)C)C1CC1)C1CC1 ZINC001616637339 1056692321 /nfs/dbraw/zinc/69/23/21/1056692321.db2.gz VJTLJQBNNSVNFI-MSOLQXFVSA-N 1 2 315.457 4.156 20 0 DIADLO Cc1ccccc1[C@@H]([NH2+][C@@H](C(=O)OC(C)(C)C)C1CC1)C1CC1 ZINC001616637346 1056692598 /nfs/dbraw/zinc/69/25/98/1056692598.db2.gz VJTLJQBNNSVNFI-ZWKOTPCHSA-N 1 2 315.457 4.156 20 0 DIADLO CCC[N@H+](Cc1nc(CC)no1)[C@H](C)c1cc2ccccc2o1 ZINC000065021167 1056703600 /nfs/dbraw/zinc/70/36/00/1056703600.db2.gz VTOUJLQNLXCVCV-CYBMUJFWSA-N 1 2 313.401 4.351 20 0 DIADLO CCC[N@@H+](Cc1nc(CC)no1)[C@H](C)c1cc2ccccc2o1 ZINC000065021167 1056703610 /nfs/dbraw/zinc/70/36/10/1056703610.db2.gz VTOUJLQNLXCVCV-CYBMUJFWSA-N 1 2 313.401 4.351 20 0 DIADLO c1nsnc1C[NH2+][C@@H](CCc1ccccc1)c1ccccc1 ZINC001616699107 1056703839 /nfs/dbraw/zinc/70/38/39/1056703839.db2.gz HBXZFZJAJTUOME-SFHVURJKSA-N 1 2 309.438 4.002 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H]2CCCC2(F)F)ccc1OC(F)F ZINC000672621700 1056741129 /nfs/dbraw/zinc/74/11/29/1056741129.db2.gz DZYSIINMFGHMOP-ZANVPECISA-N 1 2 321.314 4.135 20 0 DIADLO Nc1[nH+]cccc1-c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC001240885751 1056741381 /nfs/dbraw/zinc/74/13/81/1056741381.db2.gz LVIMNWAGTMLEMF-UHFFFAOYSA-N 1 2 306.209 4.368 20 0 DIADLO CC1=CC[N@H+](Cc2ccc(Cl)c(Br)c2)CC1 ZINC001616935572 1056744627 /nfs/dbraw/zinc/74/46/27/1056744627.db2.gz FBOBNBAWVHSUIB-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO CC1=CC[N@@H+](Cc2ccc(Cl)c(Br)c2)CC1 ZINC001616935572 1056744638 /nfs/dbraw/zinc/74/46/38/1056744638.db2.gz FBOBNBAWVHSUIB-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO C[C@H]1CCCC[C@H]1OCC[N@@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001616935965 1056744400 /nfs/dbraw/zinc/74/44/00/1056744400.db2.gz WDTXECOSDWYHAE-MGPUTAFESA-N 1 2 312.457 4.121 20 0 DIADLO C[C@H]1CCCC[C@H]1OCC[N@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001616935965 1056744409 /nfs/dbraw/zinc/74/44/09/1056744409.db2.gz WDTXECOSDWYHAE-MGPUTAFESA-N 1 2 312.457 4.121 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2sc3ccccc3c2C)no1 ZINC001617030996 1056764018 /nfs/dbraw/zinc/76/40/18/1056764018.db2.gz MOIWSYWRLBUIKD-MNOVXSKESA-N 1 2 301.415 4.313 20 0 DIADLO CCCOc1cccc(C[N@H+](CCC)CC(=O)OC(C)(C)C)c1 ZINC001617081541 1056774596 /nfs/dbraw/zinc/77/45/96/1056774596.db2.gz QKGPKIKIXKSKES-UHFFFAOYSA-N 1 2 321.461 4.029 20 0 DIADLO CCCOc1cccc(C[N@@H+](CCC)CC(=O)OC(C)(C)C)c1 ZINC001617081541 1056774602 /nfs/dbraw/zinc/77/46/02/1056774602.db2.gz QKGPKIKIXKSKES-UHFFFAOYSA-N 1 2 321.461 4.029 20 0 DIADLO CCCC[C@@H]([NH2+][C@H](C(=O)OC)c1ccccc1C)C1CCC1 ZINC001617096543 1056775064 /nfs/dbraw/zinc/77/50/64/1056775064.db2.gz QRROPXALNJXYHD-MSOLQXFVSA-N 1 2 303.446 4.158 20 0 DIADLO CC(C)OC(=O)c1cccc(-c2ccc(-c3c[nH+]cn3C)cc2)c1 ZINC001240947186 1056775383 /nfs/dbraw/zinc/77/53/83/1056775383.db2.gz HWLUCSDKABLNGS-UHFFFAOYSA-N 1 2 320.392 4.319 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc(F)c(F)c2F)cc1F ZINC001240993703 1056805086 /nfs/dbraw/zinc/80/50/86/1056805086.db2.gz NUEAHSQXBRKRNT-UHFFFAOYSA-N 1 2 301.258 4.111 20 0 DIADLO CN(Cc1ccc(C(C)(C)C)cc1)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001586801566 1056808670 /nfs/dbraw/zinc/80/86/70/1056808670.db2.gz OQITZMUQOOAJNA-UHFFFAOYSA-N 1 2 321.424 4.133 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@H](C(C)C)C1 ZINC001617285377 1056809090 /nfs/dbraw/zinc/80/90/90/1056809090.db2.gz VHLSDJILTZTXGN-RDJZCZTQSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H](C(C)C)C1 ZINC001617285377 1056809096 /nfs/dbraw/zinc/80/90/96/1056809096.db2.gz VHLSDJILTZTXGN-RDJZCZTQSA-N 1 2 323.864 4.312 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(C)c4ccccc43)nn2)c1C ZINC001241005528 1056809758 /nfs/dbraw/zinc/80/97/58/1056809758.db2.gz YEBISIHRMRIQLM-UHFFFAOYSA-N 1 2 314.392 4.408 20 0 DIADLO CCCCC[C@@H]1CCCCN1C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC001586809165 1056809978 /nfs/dbraw/zinc/80/99/78/1056809978.db2.gz WXHAVUUGBMQTDC-QGZVFWFLSA-N 1 2 313.445 4.218 20 0 DIADLO CCOc1ccc(-c2nc3c(ccn3C)c[nH+]2)cc1C(F)(F)F ZINC001241053615 1056849896 /nfs/dbraw/zinc/84/98/96/1056849896.db2.gz GARVQFUHJIZDGU-UHFFFAOYSA-N 1 2 321.302 4.053 20 0 DIADLO CCOc1ccc(-c2cccn3cc[nH+]c23)cc1C(F)(F)F ZINC001241054414 1056851639 /nfs/dbraw/zinc/85/16/39/1056851639.db2.gz FEEHGJFXWDVKHS-UHFFFAOYSA-N 1 2 306.287 4.419 20 0 DIADLO CCOc1ccc(F)c(-c2ccc(Cn3cc[nH+]c3)cc2)c1F ZINC001241058852 1056856089 /nfs/dbraw/zinc/85/60/89/1056856089.db2.gz ZFFGJAXJWVXNRJ-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO Fc1ccc(C[NH+]2CCC(OC3CCC3)CC2)c(F)c1Cl ZINC001143615357 1056856562 /nfs/dbraw/zinc/85/65/62/1056856562.db2.gz CSIGXCCYOQHLLV-UHFFFAOYSA-N 1 2 315.791 4.152 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1CC(=O)Nc1cccc(Cl)c1Cl ZINC000009997668 1056856996 /nfs/dbraw/zinc/85/69/96/1056856996.db2.gz LQDBWJXCDNVYMI-GHMZBOCLSA-N 1 2 315.244 4.195 20 0 DIADLO CCOc1ccc(F)c(-c2cccc(-c3c[nH+]cn3C)c2)c1F ZINC001241060817 1056857087 /nfs/dbraw/zinc/85/70/87/1056857087.db2.gz JEPRISWDLLVMIR-UHFFFAOYSA-N 1 2 314.335 4.431 20 0 DIADLO C[C@H]1CCSCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1F ZINC001617719480 1056873154 /nfs/dbraw/zinc/87/31/54/1056873154.db2.gz GEZHCZSPYACXPM-VIFPVBQESA-N 1 2 308.249 4.460 20 0 DIADLO C[C@H]1CCSCC[N@H+]1Cc1cc(Cl)cc(Cl)c1F ZINC001617719480 1056873162 /nfs/dbraw/zinc/87/31/62/1056873162.db2.gz GEZHCZSPYACXPM-VIFPVBQESA-N 1 2 308.249 4.460 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cc(F)cc(C(F)(F)F)c1 ZINC001241083891 1056875281 /nfs/dbraw/zinc/87/52/81/1056875281.db2.gz FEFVRYWEFICWHK-UHFFFAOYSA-N 1 2 310.250 4.168 20 0 DIADLO CCOc1ccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)cc1F ZINC001241089663 1056880620 /nfs/dbraw/zinc/88/06/20/1056880620.db2.gz VQGHYOKMWUJSNN-UHFFFAOYSA-N 1 2 309.331 4.231 20 0 DIADLO C[C@H](C[N@@H+]1CCOC[C@@H]1c1ccco1)c1cccc(Cl)c1 ZINC000682155330 1056890231 /nfs/dbraw/zinc/89/02/31/1056890231.db2.gz ULWDIJUDQITHFC-CZUORRHYSA-N 1 2 305.805 4.110 20 0 DIADLO C[C@H](C[N@H+]1CCOC[C@@H]1c1ccco1)c1cccc(Cl)c1 ZINC000682155330 1056890238 /nfs/dbraw/zinc/89/02/38/1056890238.db2.gz ULWDIJUDQITHFC-CZUORRHYSA-N 1 2 305.805 4.110 20 0 DIADLO CC(C)c1noc(C[N@H+](Cc2ccoc2)C2CCCCC2)n1 ZINC000172872488 1056903255 /nfs/dbraw/zinc/90/32/55/1056903255.db2.gz DITRIOWYLQWWMT-UHFFFAOYSA-N 1 2 303.406 4.121 20 0 DIADLO CC(C)c1noc(C[N@@H+](Cc2ccoc2)C2CCCCC2)n1 ZINC000172872488 1056903258 /nfs/dbraw/zinc/90/32/58/1056903258.db2.gz DITRIOWYLQWWMT-UHFFFAOYSA-N 1 2 303.406 4.121 20 0 DIADLO Cc1ccccc1C[N@H+](Cc1ccccn1)Cc1cccc(F)n1 ZINC001618171175 1056928473 /nfs/dbraw/zinc/92/84/73/1056928473.db2.gz NWFBWLWQKMXIPA-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ccccc1C[N@@H+](Cc1ccccn1)Cc1cccc(F)n1 ZINC001618171175 1056928480 /nfs/dbraw/zinc/92/84/80/1056928480.db2.gz NWFBWLWQKMXIPA-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO CCn1ccc(C[N@H+](C)Cc2nc(-c3ccccc3)cs2)c1 ZINC000682999695 1056929896 /nfs/dbraw/zinc/92/98/96/1056929896.db2.gz NGBICSVSUUOVFS-UHFFFAOYSA-N 1 2 311.454 4.264 20 0 DIADLO CCn1ccc(C[N@@H+](C)Cc2nc(-c3ccccc3)cs2)c1 ZINC000682999695 1056929907 /nfs/dbraw/zinc/92/99/07/1056929907.db2.gz NGBICSVSUUOVFS-UHFFFAOYSA-N 1 2 311.454 4.264 20 0 DIADLO CCn1ccc(C[N@H+](C)Cc2csc(-c3ccsc3)n2)c1 ZINC000683000364 1056930555 /nfs/dbraw/zinc/93/05/55/1056930555.db2.gz WPRPEBAKBDITTQ-UHFFFAOYSA-N 1 2 317.483 4.325 20 0 DIADLO CCn1ccc(C[N@@H+](C)Cc2csc(-c3ccsc3)n2)c1 ZINC000683000364 1056930559 /nfs/dbraw/zinc/93/05/59/1056930559.db2.gz WPRPEBAKBDITTQ-UHFFFAOYSA-N 1 2 317.483 4.325 20 0 DIADLO CCOc1cc(-c2cc[nH+]c(N(C)C)c2)cc(C(F)(F)F)c1 ZINC001241162311 1056938442 /nfs/dbraw/zinc/93/84/42/1056938442.db2.gz DBLMTLSKUDEUNB-UHFFFAOYSA-N 1 2 310.319 4.232 20 0 DIADLO Nc1cc(-c2ccc(-c3cc(F)c(F)c(F)c3)cc2)cc[nH+]1 ZINC001241163770 1056939023 /nfs/dbraw/zinc/93/90/23/1056939023.db2.gz ZUDJRUXJFRNAER-UHFFFAOYSA-N 1 2 300.283 4.415 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(Cl)c(C)c1Cl ZINC000922164084 1056940149 /nfs/dbraw/zinc/94/01/49/1056940149.db2.gz IKIJHCFMDPPUOS-NSHDSACASA-N 1 2 312.244 4.369 20 0 DIADLO c1csc(-c2cnc(C[N@@H+]3CCCc4sccc4C3)o2)c1 ZINC000067399687 1056940416 /nfs/dbraw/zinc/94/04/16/1056940416.db2.gz KQIQQMHRRRSHKL-UHFFFAOYSA-N 1 2 316.451 4.413 20 0 DIADLO c1csc(-c2cnc(C[N@H+]3CCCc4sccc4C3)o2)c1 ZINC000067399687 1056940424 /nfs/dbraw/zinc/94/04/24/1056940424.db2.gz KQIQQMHRRRSHKL-UHFFFAOYSA-N 1 2 316.451 4.413 20 0 DIADLO CCO[C@H](C)Oc1ccc2cc(-c3cc[nH+]c(N)c3)ccc2c1 ZINC001241170068 1056943249 /nfs/dbraw/zinc/94/32/49/1056943249.db2.gz IBDXMMCZONOQKW-ZDUSSCGKSA-N 1 2 308.381 4.245 20 0 DIADLO Cc1cn2cc(-c3cccc(O[C@H]4CCCCO4)c3)ccc2[nH+]1 ZINC001241211267 1056960391 /nfs/dbraw/zinc/96/03/91/1056960391.db2.gz AOJOIQLTAIYVQG-IBGZPJMESA-N 1 2 308.381 4.215 20 0 DIADLO c1cc(O[C@H]2CCCCO2)cc(-c2cc[nH+]c(N3CCCC3)c2)c1 ZINC001241212031 1056961680 /nfs/dbraw/zinc/96/16/80/1056961680.db2.gz JULLMNVWESMFRQ-FQEVSTJZSA-N 1 2 324.424 4.254 20 0 DIADLO Cc1cn2c(cccc2-c2cccc(O[C@H]3CCCCO3)c2)[nH+]1 ZINC001241213224 1056962885 /nfs/dbraw/zinc/96/28/85/1056962885.db2.gz MGDXBIXMGYSQFK-IBGZPJMESA-N 1 2 308.381 4.215 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(OC(C)C)c(C)c3)nn2)c1C ZINC001241221121 1056967665 /nfs/dbraw/zinc/96/76/65/1056967665.db2.gz FVISILYAGVNKGD-UHFFFAOYSA-N 1 2 322.412 4.042 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)n1 ZINC000080471987 1056973343 /nfs/dbraw/zinc/97/33/43/1056973343.db2.gz CNTCVIQXOMCPCW-NHYWBVRUSA-N 1 2 305.397 4.345 20 0 DIADLO Fc1ccc(C[N@H+]2CC[C@@H](F)C(F)(F)CC2)c(F)c1Cl ZINC001143616686 1056976239 /nfs/dbraw/zinc/97/62/39/1056976239.db2.gz URCIGOUVWFMREZ-SNVBAGLBSA-N 1 2 313.697 4.187 20 0 DIADLO Fc1ccc(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c(F)c1Cl ZINC001143616686 1056976243 /nfs/dbraw/zinc/97/62/43/1056976243.db2.gz URCIGOUVWFMREZ-SNVBAGLBSA-N 1 2 313.697 4.187 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ncnc2ccc(C(C)C)cc21 ZINC001241239728 1056975063 /nfs/dbraw/zinc/97/50/63/1056975063.db2.gz BHJSLSODVIGWIW-UHFFFAOYSA-N 1 2 306.413 4.190 20 0 DIADLO Fc1ccc(C[N@H+]2CC[C@H](F)C(F)(F)CC2)c(F)c1Cl ZINC001143616685 1056976556 /nfs/dbraw/zinc/97/65/56/1056976556.db2.gz URCIGOUVWFMREZ-JTQLQIEISA-N 1 2 313.697 4.187 20 0 DIADLO Fc1ccc(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c(F)c1Cl ZINC001143616685 1056976563 /nfs/dbraw/zinc/97/65/63/1056976563.db2.gz URCIGOUVWFMREZ-JTQLQIEISA-N 1 2 313.697 4.187 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1nnc(-c2ccccc2F)cc1C ZINC001241240626 1056976720 /nfs/dbraw/zinc/97/67/20/1056976720.db2.gz QEDAFUNHTFXQDA-UHFFFAOYSA-N 1 2 322.387 4.028 20 0 DIADLO CCOc1ccc(OC)cc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001241241259 1056976775 /nfs/dbraw/zinc/97/67/75/1056976775.db2.gz AVFQSHRTJSZNSS-UHFFFAOYSA-N 1 2 321.367 4.101 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cccc(Oc2ccc(F)cc2)n1 ZINC001241240318 1056976790 /nfs/dbraw/zinc/97/67/90/1056976790.db2.gz LBTGDTZDCVKLKO-UHFFFAOYSA-N 1 2 323.371 4.449 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cccnc1Oc1ccccc1 ZINC001241244188 1056978018 /nfs/dbraw/zinc/97/80/18/1056978018.db2.gz WPPNSNVVXKMYCY-UHFFFAOYSA-N 1 2 305.381 4.310 20 0 DIADLO CCOc1cccc(F)c1-c1cc(N2CCCCC2)cc[nH+]1 ZINC001241249714 1056979388 /nfs/dbraw/zinc/97/93/88/1056979388.db2.gz XTGKDSJFLTXGCA-UHFFFAOYSA-N 1 2 300.377 4.277 20 0 DIADLO CC(=O)c1ccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)cc1F ZINC001241260284 1056984809 /nfs/dbraw/zinc/98/48/09/1056984809.db2.gz OEQYCYYRPHSUCO-UHFFFAOYSA-N 1 2 307.315 4.035 20 0 DIADLO CCOc1cccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1F ZINC001241266347 1056987615 /nfs/dbraw/zinc/98/76/15/1056987615.db2.gz DRIQEMXUGKDHCD-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO CCOc1cccc(-c2ccc(-n3cc[nH+]c3)cc2OC)c1F ZINC001241267076 1056987904 /nfs/dbraw/zinc/98/79/04/1056987904.db2.gz PALBXQCQQDRGPE-UHFFFAOYSA-N 1 2 312.344 4.086 20 0 DIADLO Fc1ccc(Cl)cc1-c1ccc(C[NH+]2CCOCC2)cc1F ZINC001241332582 1057017419 /nfs/dbraw/zinc/01/74/19/1057017419.db2.gz QMPMYIWVUHCJLM-UHFFFAOYSA-N 1 2 323.770 4.117 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+][C@@H](c3ncccn3)C3CC3)o2)cc1 ZINC000922579883 1057034786 /nfs/dbraw/zinc/03/47/86/1057034786.db2.gz LTHOZXQCFZJFGO-LJQANCHMSA-N 1 2 319.408 4.286 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc([C@H]2CCCO2)s1)c1c(F)cccc1F ZINC000922652002 1057045365 /nfs/dbraw/zinc/04/53/65/1057045365.db2.gz JJZJZPGQHJQYSI-QMTHXVAHSA-N 1 2 324.396 4.124 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccc([S@](C)=O)cc2)c1 ZINC001241490298 1057065759 /nfs/dbraw/zinc/06/57/59/1057065759.db2.gz MSXBHQJAURUERH-NRFANRHFSA-N 1 2 301.455 4.246 20 0 DIADLO COc1c(F)ccc(-c2ccccc2Cn2cc[nH+]c2)c1Cl ZINC001241513925 1057081196 /nfs/dbraw/zinc/08/11/96/1057081196.db2.gz XZIRKKIOKLSBSL-UHFFFAOYSA-N 1 2 316.763 4.400 20 0 DIADLO Fc1ccc(F)c(C[NH2+][C@H]2CCCc3cccnc32)c1Cl ZINC000922885755 1057083697 /nfs/dbraw/zinc/08/36/97/1057083697.db2.gz XASHXQZIUGKYKH-AWEZNQCLSA-N 1 2 308.759 4.180 20 0 DIADLO CC(C)(C)OC(=O)c1cccc(-c2cc[nH+]c(N3CCCC3)c2)c1 ZINC001241536886 1057086798 /nfs/dbraw/zinc/08/67/98/1057086798.db2.gz GHMRSMDYOLATJL-UHFFFAOYSA-N 1 2 324.424 4.304 20 0 DIADLO Cc1c(-c2cccc(C(=O)OC(C)(C)C)c2)ccc2[nH+]ccn21 ZINC001241539147 1057088303 /nfs/dbraw/zinc/08/83/03/1057088303.db2.gz ROGLBLOIUUXHGI-UHFFFAOYSA-N 1 2 308.381 4.265 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1cccc(C(=O)OC(C)(C)C)c1 ZINC001241538307 1057088375 /nfs/dbraw/zinc/08/83/75/1057088375.db2.gz QLLLJIZTXJJHSS-UHFFFAOYSA-N 1 2 324.380 4.194 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2cc(O)ccc2Cl)s1 ZINC000625156192 1057093582 /nfs/dbraw/zinc/09/35/82/1057093582.db2.gz VSRAPOCHTFIHRN-SNVBAGLBSA-N 1 2 310.850 4.312 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cc(O)ccc2Cl)s1 ZINC000625156192 1057093588 /nfs/dbraw/zinc/09/35/88/1057093588.db2.gz VSRAPOCHTFIHRN-SNVBAGLBSA-N 1 2 310.850 4.312 20 0 DIADLO C[N@H+](Cc1ncc(-c2ccc(F)cc2)o1)Cc1cccc(F)c1 ZINC000096954237 1057095987 /nfs/dbraw/zinc/09/59/87/1057095987.db2.gz DQZDVYVYQLFPJR-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1ncc(-c2ccc(F)cc2)o1)Cc1cccc(F)c1 ZINC000096954237 1057095996 /nfs/dbraw/zinc/09/59/96/1057095996.db2.gz DQZDVYVYQLFPJR-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2nc(C3CC3)cs2)C2CC2)n1 ZINC000347788571 1057106810 /nfs/dbraw/zinc/10/68/10/1057106810.db2.gz DARNCQSETSJEHS-AWEZNQCLSA-N 1 2 305.472 4.026 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)o1)c1nc(-c2ccncc2)cs1 ZINC000347837757 1057151711 /nfs/dbraw/zinc/15/17/11/1057151711.db2.gz LIIVCCNBCCPYLA-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO CCc1ccc(C[N@@H+]2CCCC[C@@H]2c2nc(C)cs2)cn1 ZINC000347848013 1057159915 /nfs/dbraw/zinc/15/99/15/1057159915.db2.gz LVGKCCSLRPRHIR-MRXNPFEDSA-N 1 2 301.459 4.136 20 0 DIADLO CCc1ccc(C[N@H+]2CCCC[C@@H]2c2nc(C)cs2)cn1 ZINC000347848013 1057159918 /nfs/dbraw/zinc/15/99/18/1057159918.db2.gz LVGKCCSLRPRHIR-MRXNPFEDSA-N 1 2 301.459 4.136 20 0 DIADLO Cc1cnccc1C[N@@H+]1CC[C@H]1c1ccc(Br)cc1 ZINC000625562781 1057164084 /nfs/dbraw/zinc/16/40/84/1057164084.db2.gz YXJWLPTZPWPKIX-INIZCTEOSA-N 1 2 317.230 4.100 20 0 DIADLO Cc1cnccc1C[N@H+]1CC[C@H]1c1ccc(Br)cc1 ZINC000625562781 1057164088 /nfs/dbraw/zinc/16/40/88/1057164088.db2.gz YXJWLPTZPWPKIX-INIZCTEOSA-N 1 2 317.230 4.100 20 0 DIADLO CC(C)[N@H+](C/C=C\c1ccc(Cl)cc1)CC(=O)OC(C)(C)C ZINC001307587776 1057172482 /nfs/dbraw/zinc/17/24/82/1057172482.db2.gz AAKYJRNGHWZENO-SREVYHEPSA-N 1 2 323.864 4.405 20 0 DIADLO CC(C)[N@@H+](C/C=C\c1ccc(Cl)cc1)CC(=O)OC(C)(C)C ZINC001307587776 1057172486 /nfs/dbraw/zinc/17/24/86/1057172486.db2.gz AAKYJRNGHWZENO-SREVYHEPSA-N 1 2 323.864 4.405 20 0 DIADLO Fc1cccc([C@H]2CC[N@H+]2Cc2ccccc2OC(F)F)c1 ZINC000674011833 1057177484 /nfs/dbraw/zinc/17/74/84/1057177484.db2.gz YAHCNPLODSTWKK-OAHLLOKOSA-N 1 2 307.315 4.374 20 0 DIADLO Fc1cccc([C@H]2CC[N@@H+]2Cc2ccccc2OC(F)F)c1 ZINC000674011833 1057177486 /nfs/dbraw/zinc/17/74/86/1057177486.db2.gz YAHCNPLODSTWKK-OAHLLOKOSA-N 1 2 307.315 4.374 20 0 DIADLO Fc1cccc([C@H]2CC[N@@H+]2Cc2cnc(-c3ccccc3)nc2)c1 ZINC000674012405 1057178647 /nfs/dbraw/zinc/17/86/47/1057178647.db2.gz ZRQZPRNPJXDBGH-LJQANCHMSA-N 1 2 319.383 4.230 20 0 DIADLO Fc1cccc([C@H]2CC[N@H+]2Cc2cnc(-c3ccccc3)nc2)c1 ZINC000674012405 1057178650 /nfs/dbraw/zinc/17/86/50/1057178650.db2.gz ZRQZPRNPJXDBGH-LJQANCHMSA-N 1 2 319.383 4.230 20 0 DIADLO Cc1cn2c(cccc2-c2cccnc2OCc2ccccc2)[nH+]1 ZINC001241830411 1057180269 /nfs/dbraw/zinc/18/02/69/1057180269.db2.gz VLISWJBBKPUHOY-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccc(F)cc2Cl)c(OC)c1 ZINC000058888234 1057180839 /nfs/dbraw/zinc/18/08/39/1057180839.db2.gz KTPVCNAMQTWOEV-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccc(F)cc2Cl)c(OC)c1 ZINC000058888234 1057180840 /nfs/dbraw/zinc/18/08/40/1057180840.db2.gz KTPVCNAMQTWOEV-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO C[C@H]1C[NH+](Cc2csc(-c3ccco3)n2)C[C@H](C)C1(F)F ZINC000625648711 1057183700 /nfs/dbraw/zinc/18/37/00/1057183700.db2.gz RVSQDCITWRREHX-QWRGUYRKSA-N 1 2 312.385 4.126 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CCC[C@@H](c3ccc(F)c(F)c3)C2)s1 ZINC000625654114 1057184044 /nfs/dbraw/zinc/18/40/44/1057184044.db2.gz BSZGEBMSNSKPEX-GXFFZTMASA-N 1 2 323.412 4.065 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CCC[C@@H](c3ccc(F)c(F)c3)C2)s1 ZINC000625654114 1057184048 /nfs/dbraw/zinc/18/40/48/1057184048.db2.gz BSZGEBMSNSKPEX-GXFFZTMASA-N 1 2 323.412 4.065 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CCC[C@H](c3ccc(F)c(F)c3)C2)s1 ZINC000625654116 1057184151 /nfs/dbraw/zinc/18/41/51/1057184151.db2.gz BSZGEBMSNSKPEX-MFKMUULPSA-N 1 2 323.412 4.065 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CCC[C@H](c3ccc(F)c(F)c3)C2)s1 ZINC000625654116 1057184153 /nfs/dbraw/zinc/18/41/53/1057184153.db2.gz BSZGEBMSNSKPEX-MFKMUULPSA-N 1 2 323.412 4.065 20 0 DIADLO C[C@@H]1C[NH+](Cc2ncc(Cl)cc2Cl)C[C@@H](C)C1(F)F ZINC000625656090 1057184808 /nfs/dbraw/zinc/18/48/08/1057184808.db2.gz YZLZPCGUXNXSNR-RKDXNWHRSA-N 1 2 309.187 4.112 20 0 DIADLO CCOC(=O)Cc1ccc(Nc2cccc(C3CCC3)[nH+]2)cc1 ZINC001212518681 1057185119 /nfs/dbraw/zinc/18/51/19/1057185119.db2.gz UCSJIEHCXPYLCM-UHFFFAOYSA-N 1 2 310.397 4.198 20 0 DIADLO O=C(C[N@H+]1CCC[C@@H]1c1ccccc1Cl)Nc1ccccc1 ZINC000059390486 1057192387 /nfs/dbraw/zinc/19/23/87/1057192387.db2.gz GTQYQAAXQMLIKF-QGZVFWFLSA-N 1 2 314.816 4.116 20 0 DIADLO O=C(C[N@@H+]1CCC[C@@H]1c1ccccc1Cl)Nc1ccccc1 ZINC000059390486 1057192391 /nfs/dbraw/zinc/19/23/91/1057192391.db2.gz GTQYQAAXQMLIKF-QGZVFWFLSA-N 1 2 314.816 4.116 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)CC(=O)N[C@H]1CCCC[C@H]1C ZINC000059389766 1057192942 /nfs/dbraw/zinc/19/29/42/1057192942.db2.gz FMGKGMZNHBEMIE-KEYYUXOJSA-N 1 2 322.880 4.028 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)CC(=O)N[C@H]1CCCC[C@H]1C ZINC000059389766 1057192945 /nfs/dbraw/zinc/19/29/45/1057192945.db2.gz FMGKGMZNHBEMIE-KEYYUXOJSA-N 1 2 322.880 4.028 20 0 DIADLO COc1cccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)c1Cl ZINC001241859669 1057194214 /nfs/dbraw/zinc/19/42/14/1057194214.db2.gz BYWXYUZOWGDCGK-UHFFFAOYSA-N 1 2 311.759 4.355 20 0 DIADLO COc1cc(Cl)ccc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001241906591 1057207059 /nfs/dbraw/zinc/20/70/59/1057207059.db2.gz MIUJWUBUWKDVFD-UHFFFAOYSA-N 1 2 311.759 4.355 20 0 DIADLO CCCOc1cc(C[NH2+]C2(C(F)F)CCCC2)ccc1OC ZINC000674135211 1057211883 /nfs/dbraw/zinc/21/18/83/1057211883.db2.gz GGSIMZQIGGMMLB-UHFFFAOYSA-N 1 2 313.388 4.152 20 0 DIADLO Cc1cc(-c2ccc3ncn(C4CCOCC4)c3c2)cc(C)[nH+]1 ZINC001241992777 1057232389 /nfs/dbraw/zinc/23/23/89/1057232389.db2.gz RFMKBXGDXLSMLO-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO Cc1cc(-c2ccc(C(=O)Nc3ccccn3)cc2)cc(C)[nH+]1 ZINC001241992846 1057232698 /nfs/dbraw/zinc/23/26/98/1057232698.db2.gz SYFWYOHZZYXCMX-UHFFFAOYSA-N 1 2 303.365 4.013 20 0 DIADLO CCOC(=O)c1ncoc1-c1ccc(-c2cc(C)[nH+]c(C)c2)cc1 ZINC001241991681 1057232793 /nfs/dbraw/zinc/23/27/93/1057232793.db2.gz KVPFXMBWOGYAGZ-UHFFFAOYSA-N 1 2 322.364 4.197 20 0 DIADLO CSc1cccc(-c2ccccc2C[NH+]2CCOCC2)c1F ZINC001241995020 1057233759 /nfs/dbraw/zinc/23/37/59/1057233759.db2.gz KIEYSTUADUWMPV-UHFFFAOYSA-N 1 2 317.429 4.047 20 0 DIADLO CCOC(=O)c1nccc2c(-c3cc(C)[nH+]c(C)c3)cccc21 ZINC001241993712 1057234046 /nfs/dbraw/zinc/23/40/46/1057234046.db2.gz NQAPYAZJERYKED-UHFFFAOYSA-N 1 2 306.365 4.090 20 0 DIADLO Cc1cc(-c2ccc([C@H](C)NC(=O)C(F)(F)F)cc2)cc(C)[nH+]1 ZINC001241996642 1057234358 /nfs/dbraw/zinc/23/43/58/1057234358.db2.gz XWAFSOUHZDVPEN-LBPRGKRZSA-N 1 2 322.330 4.105 20 0 DIADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2noc3c2CCCC3)c1 ZINC000171733900 1057239228 /nfs/dbraw/zinc/23/92/28/1057239228.db2.gz LTFAICLANXIUOW-QGZVFWFLSA-N 1 2 300.377 4.030 20 0 DIADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2noc3c2CCCC3)c1 ZINC000171733900 1057239233 /nfs/dbraw/zinc/23/92/33/1057239233.db2.gz LTFAICLANXIUOW-QGZVFWFLSA-N 1 2 300.377 4.030 20 0 DIADLO C[C@H](c1ccc(OC(F)F)cc1)[N@@H+]1Cc2ccc(O)cc2C1 ZINC000625727360 1057243253 /nfs/dbraw/zinc/24/32/53/1057243253.db2.gz XOPVJSPWFAIARY-LLVKDONJSA-N 1 2 305.324 4.070 20 0 DIADLO C[C@H](c1ccc(OC(F)F)cc1)[N@H+]1Cc2ccc(O)cc2C1 ZINC000625727360 1057243259 /nfs/dbraw/zinc/24/32/59/1057243259.db2.gz XOPVJSPWFAIARY-LLVKDONJSA-N 1 2 305.324 4.070 20 0 DIADLO Fc1ccc([C@H]2CCCC[N@@H+]2Cc2noc3c2CCCC3)cc1 ZINC000674469266 1057244815 /nfs/dbraw/zinc/24/48/15/1057244815.db2.gz POXURXGYNHLFQS-GOSISDBHSA-N 1 2 314.404 4.420 20 0 DIADLO Fc1ccc([C@H]2CCCC[N@H+]2Cc2noc3c2CCCC3)cc1 ZINC000674469266 1057244820 /nfs/dbraw/zinc/24/48/20/1057244820.db2.gz POXURXGYNHLFQS-GOSISDBHSA-N 1 2 314.404 4.420 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1nc2ccccc2cc1C(F)(F)F ZINC001242073166 1057255239 /nfs/dbraw/zinc/25/52/39/1057255239.db2.gz ZSSFQABCEHGDIW-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1nc(C)nc2sc3c(c21)CC[C@H](C)C3 ZINC001242078583 1057255663 /nfs/dbraw/zinc/25/56/63/1057255663.db2.gz MWEZIQLDPYHUPH-VIFPVBQESA-N 1 2 324.453 4.077 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1nc(C)nc2sc3c(c21)CCCCC3 ZINC001242078050 1057256374 /nfs/dbraw/zinc/25/63/74/1057256374.db2.gz AJRUATUTIFFSIE-UHFFFAOYSA-N 1 2 324.453 4.221 20 0 DIADLO Cc1c(C)n(C2CCCC2)c2ncnc(-c3c[nH+]c(N)cc3C)c12 ZINC001242084915 1057257793 /nfs/dbraw/zinc/25/77/93/1057257793.db2.gz ZIJSYPLTOGHHCM-UHFFFAOYSA-N 1 2 321.428 4.116 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(OC(C)C)cc1Cl ZINC001242088792 1057260372 /nfs/dbraw/zinc/26/03/72/1057260372.db2.gz KVRGQXOEPURAIK-UHFFFAOYSA-N 1 2 316.788 4.451 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2cnn(Cc3cccs3)c2)c1 ZINC001242094771 1057263119 /nfs/dbraw/zinc/26/31/19/1057263119.db2.gz VQFGHWVFNTULGG-UHFFFAOYSA-N 1 2 311.410 4.022 20 0 DIADLO Oc1ccc(C(F)(F)F)cc1-c1ccccc1Cn1cc[nH+]c1 ZINC001242141960 1057277755 /nfs/dbraw/zinc/27/77/55/1057277755.db2.gz ZBNCJUCKZODURK-UHFFFAOYSA-N 1 2 318.298 4.323 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+]2CCCc3sccc3C2)n1 ZINC000674864113 1057292997 /nfs/dbraw/zinc/29/29/97/1057292997.db2.gz WMBPURJNVZXCDZ-UHFFFAOYSA-N 1 2 306.500 4.451 20 0 DIADLO CC(C)(C)c1csc(C[N@H+]2CCCc3sccc3C2)n1 ZINC000674864113 1057293000 /nfs/dbraw/zinc/29/30/00/1057293000.db2.gz WMBPURJNVZXCDZ-UHFFFAOYSA-N 1 2 306.500 4.451 20 0 DIADLO Clc1ccc([C@H]2CC[N@@H+]2Cc2cccc3nsnc32)cc1 ZINC000766085970 1057307467 /nfs/dbraw/zinc/30/74/67/1057307467.db2.gz XCRQYRJWTPGICI-OAHLLOKOSA-N 1 2 315.829 4.292 20 0 DIADLO Clc1ccc([C@H]2CC[N@H+]2Cc2cccc3nsnc32)cc1 ZINC000766085970 1057307471 /nfs/dbraw/zinc/30/74/71/1057307471.db2.gz XCRQYRJWTPGICI-OAHLLOKOSA-N 1 2 315.829 4.292 20 0 DIADLO CC1(C(=O)Oc2ccc(-c3[nH+]cc4n3CCCC4)cc2)CC=CC1 ZINC001128938682 1057310882 /nfs/dbraw/zinc/31/08/82/1057310882.db2.gz BMGJLZWABLHNKJ-UHFFFAOYSA-N 1 2 322.408 4.148 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@@H]2COc3c2cccc3Cl)o1 ZINC000675103576 1057315706 /nfs/dbraw/zinc/31/57/06/1057315706.db2.gz XHGRVTFZEZEFHR-WDBKCZKBSA-N 1 2 303.789 4.280 20 0 DIADLO FC(F)(F)c1ccncc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001242279647 1057317993 /nfs/dbraw/zinc/31/79/93/1057317993.db2.gz LNMQEIYMUWZAKK-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO CCOc1cc(Nc2ccc(N3CCCC3)[nH+]c2)c(F)cc1F ZINC001212530844 1057321825 /nfs/dbraw/zinc/32/18/25/1057321825.db2.gz VCOUDNDCISRCKA-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH+]2CCC(CC(C)C)CC2)n1 ZINC000766094134 1057324759 /nfs/dbraw/zinc/32/47/59/1057324759.db2.gz YKZRLAUZQQNWDX-ZDUSSCGKSA-N 1 2 311.495 4.142 20 0 DIADLO COc1ccnc(C[NH2+][C@@H](C)c2oc3ccccc3c2C)c1F ZINC000658228249 1057329376 /nfs/dbraw/zinc/32/93/76/1057329376.db2.gz PVTDGBGHLMIIHL-LBPRGKRZSA-N 1 2 314.360 4.135 20 0 DIADLO COc1ccc(OC(F)(F)F)cc1-c1cc(C)cn2cc[nH+]c12 ZINC001242320491 1057334294 /nfs/dbraw/zinc/33/42/94/1057334294.db2.gz HRKFWMIIHIHHOH-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO COc1ccc(OC(F)(F)F)cc1-c1ccc2[nH+]c(C)cn2c1 ZINC001242320682 1057334436 /nfs/dbraw/zinc/33/44/36/1057334436.db2.gz QEVKEWHFBZQCKU-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO O=C(Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)[C@H]1CC12CCC2 ZINC000675296537 1057338000 /nfs/dbraw/zinc/33/80/00/1057338000.db2.gz IKAAMEAXKQUGOI-QGZVFWFLSA-N 1 2 321.424 4.015 20 0 DIADLO CCn1c2cc(Br)ccc2[nH+]c1NCc1ccoc1 ZINC000766108358 1057345649 /nfs/dbraw/zinc/34/56/49/1057345649.db2.gz NQNYJRGYFOBKSX-UHFFFAOYSA-N 1 2 320.190 4.024 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cccnc2C(F)(F)F)c1 ZINC001242377208 1057353714 /nfs/dbraw/zinc/35/37/14/1057353714.db2.gz UGTSFRCLVYFBKI-UHFFFAOYSA-N 1 2 303.287 4.168 20 0 DIADLO CCc1cc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)cs1 ZINC001212569072 1057384595 /nfs/dbraw/zinc/38/45/95/1057384595.db2.gz LRXKZURJMVZNCZ-UHFFFAOYSA-N 1 2 322.393 4.213 20 0 DIADLO C[N@H+](CC/C=C/c1cccnc1)Cc1c(Cl)cncc1Cl ZINC001137610401 1057385218 /nfs/dbraw/zinc/38/52/18/1057385218.db2.gz QBXZLWWCTZVAII-GORDUTHDSA-N 1 2 322.239 4.319 20 0 DIADLO C[N@@H+](CC/C=C/c1cccnc1)Cc1c(Cl)cncc1Cl ZINC001137610401 1057385224 /nfs/dbraw/zinc/38/52/24/1057385224.db2.gz QBXZLWWCTZVAII-GORDUTHDSA-N 1 2 322.239 4.319 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@@H]2CCOc3c(Cl)cccc32)n1 ZINC000675809403 1057417686 /nfs/dbraw/zinc/41/76/86/1057417686.db2.gz HWTUBZGZFUHDLY-ZWNOBZJWSA-N 1 2 308.834 4.279 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[NH+]1CC(c2nc3ccccc3[nH]2)C1 ZINC000675976232 1057441420 /nfs/dbraw/zinc/44/14/20/1057441420.db2.gz KVIANYMTJBBAQL-GFCCVEGCSA-N 1 2 324.428 4.009 20 0 DIADLO Fc1ccc2oc(-c3cccc(C[NH+]4CCOCC4)c3)cc2c1 ZINC001242707305 1057454595 /nfs/dbraw/zinc/45/45/95/1057454595.db2.gz IRFYKBCKNKXQEG-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO FC(F)(F)COc1ccc(-c2cc[nH+]c(N3CCCC3)c2)cc1 ZINC001242718702 1057458363 /nfs/dbraw/zinc/45/83/63/1057458363.db2.gz HCTSBWFFUZUOBT-UHFFFAOYSA-N 1 2 322.330 4.290 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)n(C)n1)c1ccc(Cl)cc1Cl ZINC000706198985 1057462789 /nfs/dbraw/zinc/46/27/89/1057462789.db2.gz JUJYBUFKTBANTL-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(OC(F)(F)F)nc2)c1 ZINC001242778878 1057472148 /nfs/dbraw/zinc/47/21/48/1057472148.db2.gz RRWLBYMDRSYULL-UHFFFAOYSA-N 1 2 310.275 4.009 20 0 DIADLO COc1c(F)cc(F)cc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001242811425 1057487152 /nfs/dbraw/zinc/48/71/52/1057487152.db2.gz ZZNYKACTXHMCAL-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO CNc1cc(-c2ccc(OC(F)F)c(OC3CCC3)c2)cc[nH+]1 ZINC001242820954 1057491385 /nfs/dbraw/zinc/49/13/85/1057491385.db2.gz IKKODUJUMOYRBQ-UHFFFAOYSA-N 1 2 320.339 4.323 20 0 DIADLO Cc1nc2c(cc(-c3cc[nH+]c4c3CCN4)cc2F)n1C(C)C ZINC001242850556 1057497595 /nfs/dbraw/zinc/49/75/95/1057497595.db2.gz NQSGOJHEHGAODW-UHFFFAOYSA-N 1 2 310.376 4.095 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000708692872 1057500896 /nfs/dbraw/zinc/50/08/96/1057500896.db2.gz LUSCGWVWKXCFSD-LLVKDONJSA-N 1 2 313.150 4.163 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000708692872 1057500899 /nfs/dbraw/zinc/50/08/99/1057500899.db2.gz LUSCGWVWKXCFSD-LLVKDONJSA-N 1 2 313.150 4.163 20 0 DIADLO Cc1cccn2cc(C[N@@H+](C)[C@H](C)c3ccc(F)c(F)c3)nc12 ZINC000073431933 1057507379 /nfs/dbraw/zinc/50/73/79/1057507379.db2.gz TZJVPHVTVYBDDI-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1cccn2cc(C[N@H+](C)[C@H](C)c3ccc(F)c(F)c3)nc12 ZINC000073431933 1057507383 /nfs/dbraw/zinc/50/73/83/1057507383.db2.gz TZJVPHVTVYBDDI-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO C=C(c1ccccc1)c1ccc(-c2ccc(-n3cc[nH+]c3)cc2)nn1 ZINC001242891801 1057514514 /nfs/dbraw/zinc/51/45/14/1057514514.db2.gz YAGLWMSTKOGUFM-UHFFFAOYSA-N 1 2 324.387 4.391 20 0 DIADLO CCOc1ccc(F)c(-c2cc(F)c(C[NH+](C)C)c(F)c2)c1 ZINC001242938438 1057523658 /nfs/dbraw/zinc/52/36/58/1057523658.db2.gz NCAANVCGIUMZID-UHFFFAOYSA-N 1 2 309.331 4.231 20 0 DIADLO Cc1ccc(OCc2nc(C[NH+](C3CC3)C3CC3)cs2)cc1 ZINC000625836976 1057524959 /nfs/dbraw/zinc/52/49/59/1057524959.db2.gz BKFMQCXRPWHOKE-UHFFFAOYSA-N 1 2 314.454 4.157 20 0 DIADLO Cc1cc(Br)ccc1[C@@H]1CCC[N@@H+]1Cc1ccno1 ZINC000626009178 1057548704 /nfs/dbraw/zinc/54/87/04/1057548704.db2.gz AJJUQNORNGWTMQ-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1cc(Br)ccc1[C@@H]1CCC[N@H+]1Cc1ccno1 ZINC000626009178 1057548710 /nfs/dbraw/zinc/54/87/10/1057548710.db2.gz AJJUQNORNGWTMQ-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO COC(=O)c1ccc(-c2c[nH+]c(N3CCCCC3)cc2C)cc1C ZINC001243018662 1057548738 /nfs/dbraw/zinc/54/87/38/1057548738.db2.gz DKCWSNNQSVIGDO-UHFFFAOYSA-N 1 2 324.424 4.142 20 0 DIADLO Cc1cc(Br)ccc1[C@H]1CCC[N@@H+]1Cc1ccno1 ZINC000626009179 1057548837 /nfs/dbraw/zinc/54/88/37/1057548837.db2.gz AJJUQNORNGWTMQ-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1cc(Br)ccc1[C@H]1CCC[N@H+]1Cc1ccno1 ZINC000626009179 1057548842 /nfs/dbraw/zinc/54/88/42/1057548842.db2.gz AJJUQNORNGWTMQ-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO CCc1ccc(C2CC[NH+]([C@@H](C)c3csnn3)CC2)cc1 ZINC000626086463 1057555805 /nfs/dbraw/zinc/55/58/05/1057555805.db2.gz BUWDOIYIVXBIEN-ZDUSSCGKSA-N 1 2 301.459 4.041 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)c(-c2cccc(C3CC3)c2)c1 ZINC001243083124 1057565830 /nfs/dbraw/zinc/56/58/30/1057565830.db2.gz CRESTMOQYUVUKV-UHFFFAOYSA-N 1 2 311.400 4.202 20 0 DIADLO Cc1ccc(-c2cc(F)ccc2C[NH+]2CCOCC2)c2[nH]ccc21 ZINC001243088678 1057567034 /nfs/dbraw/zinc/56/70/34/1057567034.db2.gz ZLKYQMRRNYXBBB-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)c(-c2ccc3ccoc3c2)c1 ZINC001243087921 1057567219 /nfs/dbraw/zinc/56/72/19/1057567219.db2.gz PRQPJESGPSQHQX-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(Cl)nc2Cl)c1 ZINC001243088060 1057567732 /nfs/dbraw/zinc/56/77/32/1057567732.db2.gz IHARECPUXAKGDD-UHFFFAOYSA-N 1 2 304.180 4.456 20 0 DIADLO Fc1ccc(-c2ccc(Cl)nc2Cl)cc1-n1cc[nH+]c1 ZINC001243089189 1057568532 /nfs/dbraw/zinc/56/85/32/1057568532.db2.gz KMAJIUUBSHTGJR-UHFFFAOYSA-N 1 2 308.143 4.380 20 0 DIADLO c1nc(C2CC2)c(C[NH2+][C@H](c2ccccc2)c2ccccn2)s1 ZINC000486936502 1057570479 /nfs/dbraw/zinc/57/04/79/1057570479.db2.gz KCNTYOALUOFIJC-GOSISDBHSA-N 1 2 321.449 4.295 20 0 DIADLO C=Cc1cc(F)ccc1-c1cc(F)ccc1C[NH+]1CCOCC1 ZINC001243102931 1057573459 /nfs/dbraw/zinc/57/34/59/1057573459.db2.gz QRWGZUDNTJFSEU-UHFFFAOYSA-N 1 2 315.363 4.107 20 0 DIADLO Nc1[nH+]cccc1-c1cc(F)cc(F)c1OCc1ccccc1 ZINC001243170585 1057592871 /nfs/dbraw/zinc/59/28/71/1057592871.db2.gz WAEGCHUPXHZALL-UHFFFAOYSA-N 1 2 312.319 4.188 20 0 DIADLO Cc1cn2c(cccc2-c2ccccc2NC(=O)C(C)(C)C)[nH+]1 ZINC001243178049 1057594659 /nfs/dbraw/zinc/59/46/59/1057594659.db2.gz MXKBGNGCWAEJEM-UHFFFAOYSA-N 1 2 307.397 4.294 20 0 DIADLO CCCCOc1ccc(-c2cn3cc[nH+]c3cc2OC)cc1F ZINC001243199332 1057601648 /nfs/dbraw/zinc/60/16/48/1057601648.db2.gz MFIFXKCNUQFRHH-UHFFFAOYSA-N 1 2 314.360 4.328 20 0 DIADLO C[N@H+](Cc1scnc1C1CC1)Cc1ccc(F)cc1Cl ZINC000494936519 1057617935 /nfs/dbraw/zinc/61/79/35/1057617935.db2.gz KRQXWZXAXRPBMC-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO C[N@@H+](Cc1scnc1C1CC1)Cc1ccc(F)cc1Cl ZINC000494936519 1057617940 /nfs/dbraw/zinc/61/79/40/1057617940.db2.gz KRQXWZXAXRPBMC-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO CCCN(CCC)C(=O)c1ccc(-c2cccc3[nH+]ccn32)cc1 ZINC001243256561 1057622715 /nfs/dbraw/zinc/62/27/15/1057622715.db2.gz FBRRUGDUFQWUHY-UHFFFAOYSA-N 1 2 321.424 4.264 20 0 DIADLO CCOc1cc(F)c(F)cc1-c1ccccc1Cn1cc[nH+]c1 ZINC001243277550 1057633170 /nfs/dbraw/zinc/63/31/70/1057633170.db2.gz VXTFDJMQPQITGO-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO c1ccc(-c2nc(C[N@@H+]3CCC[C@@H]3c3ccccc3)no2)cc1 ZINC000054993509 1057641257 /nfs/dbraw/zinc/64/12/57/1057641257.db2.gz CFOFIGPJMWFPGO-QGZVFWFLSA-N 1 2 305.381 4.074 20 0 DIADLO c1ccc(-c2nc(C[N@H+]3CCC[C@@H]3c3ccccc3)no2)cc1 ZINC000054993509 1057641264 /nfs/dbraw/zinc/64/12/64/1057641264.db2.gz CFOFIGPJMWFPGO-QGZVFWFLSA-N 1 2 305.381 4.074 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(Cl)cc2n[nH]cc21 ZINC001243322242 1057645423 /nfs/dbraw/zinc/64/54/23/1057645423.db2.gz YPKBEYYBGCDORT-UHFFFAOYSA-N 1 2 324.771 4.078 20 0 DIADLO COc1ccc2cc(C[NH2+]Cc3n[nH]c4ccccc43)ccc2c1 ZINC000727465949 1057654902 /nfs/dbraw/zinc/65/49/02/1057654902.db2.gz UOOUVRGVIFTYLX-UHFFFAOYSA-N 1 2 317.392 4.015 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1coc(C2CC2)n1 ZINC000727470438 1057655666 /nfs/dbraw/zinc/65/56/66/1057655666.db2.gz CZDBXYXDLWRSGG-MRXNPFEDSA-N 1 2 300.402 4.192 20 0 DIADLO COc1ccc[nH+]c1N[C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000526983650 1057659961 /nfs/dbraw/zinc/65/99/61/1057659961.db2.gz HPCZKRYZOPUOMH-UNXYVOJBSA-N 1 2 302.340 4.259 20 0 DIADLO Cc1cc(-c2cccc(OCC(F)(F)F)c2)c2[nH+]ccn2c1 ZINC001243390605 1057668213 /nfs/dbraw/zinc/66/82/13/1057668213.db2.gz ZHSICMZYZANCOG-UHFFFAOYSA-N 1 2 306.287 4.251 20 0 DIADLO Cc1cc(-c2cc(F)cc(C(=O)N3CCCCC3)c2)cc(C)[nH+]1 ZINC001243404167 1057672691 /nfs/dbraw/zinc/67/26/91/1057672691.db2.gz OLVQQYRLXXJESN-UHFFFAOYSA-N 1 2 312.388 4.131 20 0 DIADLO Nc1cc(-c2ccnc(Cl)c2Cl)[nH+]cc1C(F)(F)F ZINC001243416000 1057676713 /nfs/dbraw/zinc/67/67/13/1057676713.db2.gz SXITWSYLFVEDIJ-UHFFFAOYSA-N 1 2 308.090 4.051 20 0 DIADLO Cn1ccc2c[nH+]c(-c3ccc(CNc4ccccc4)cc3)nc21 ZINC001243436172 1057683365 /nfs/dbraw/zinc/68/33/65/1057683365.db2.gz DSLXLPVUVLCOAH-UHFFFAOYSA-N 1 2 314.392 4.247 20 0 DIADLO FC(F)(F)c1cccc(C2([NH2+]Cc3coc(C4CC4)n3)CC2)c1 ZINC000728063246 1057684284 /nfs/dbraw/zinc/68/42/84/1057684284.db2.gz AVYRMPZYGSXGRU-UHFFFAOYSA-N 1 2 322.330 4.350 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)N1CCCC[C@@H]1c1ccccc1 ZINC000290712314 1057690753 /nfs/dbraw/zinc/69/07/53/1057690753.db2.gz NZJLEYCVNPETSR-QGZVFWFLSA-N 1 2 320.396 4.093 20 0 DIADLO Nc1[nH+]cccc1-c1ccc(-c2cc(F)c(F)c(F)c2)cc1 ZINC001243475404 1057691398 /nfs/dbraw/zinc/69/13/98/1057691398.db2.gz YJYDDBUVVAEIRD-UHFFFAOYSA-N 1 2 300.283 4.415 20 0 DIADLO Cc1nc2c(cc(-c3ccc[nH+]c3N)cc2F)n1C1CCCC1 ZINC001243477875 1057691554 /nfs/dbraw/zinc/69/15/54/1057691554.db2.gz QJNZNALYMYNSCC-UHFFFAOYSA-N 1 2 310.376 4.243 20 0 DIADLO Cc1cn2c(cccc2-c2cc(F)c(OC(F)F)c(F)c2)[nH+]1 ZINC001243492553 1057695189 /nfs/dbraw/zinc/69/51/89/1057695189.db2.gz RYWYREASTZQFDK-UHFFFAOYSA-N 1 2 310.250 4.189 20 0 DIADLO CC[C@H]1CCC[N@@H+]1Cn1nc(-c2ccccc2)sc1=S ZINC000729982769 1057699833 /nfs/dbraw/zinc/69/98/33/1057699833.db2.gz HHSOPLIGLFTBAI-ZDUSSCGKSA-N 1 2 305.472 4.173 20 0 DIADLO COc1c(F)ccc(-c2ccc(-c3c[nH+]cn3C)cc2)c1F ZINC001243510940 1057699722 /nfs/dbraw/zinc/69/97/22/1057699722.db2.gz QDGSVPZOJQEUJF-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO CC[C@H]1CCC[N@H+]1Cn1nc(-c2ccccc2)sc1=S ZINC000729982769 1057699837 /nfs/dbraw/zinc/69/98/37/1057699837.db2.gz HHSOPLIGLFTBAI-ZDUSSCGKSA-N 1 2 305.472 4.173 20 0 DIADLO CCOc1cc(-c2ccc(-c3c[nH+]cn3C)cc2)c(F)cc1F ZINC001243529804 1057704365 /nfs/dbraw/zinc/70/43/65/1057704365.db2.gz BDHIHUSBKIMOLL-UHFFFAOYSA-N 1 2 314.335 4.431 20 0 DIADLO CCOc1cc(-c2ccc(-c3c[nH+]cn3C)cc2)ccc1OC ZINC001243541259 1057708444 /nfs/dbraw/zinc/70/84/44/1057708444.db2.gz UYVXWPHHWBYNAC-UHFFFAOYSA-N 1 2 308.381 4.161 20 0 DIADLO Cc1ccsc1-c1nn(C[N@@H+](C)[C@H](C)C(C)C)c(=S)o1 ZINC000730253052 1057709295 /nfs/dbraw/zinc/70/92/95/1057709295.db2.gz PUWGYWKVDHDWDA-LLVKDONJSA-N 1 2 311.476 4.176 20 0 DIADLO Cc1ccsc1-c1nn(C[N@H+](C)[C@H](C)C(C)C)c(=S)o1 ZINC000730253052 1057709299 /nfs/dbraw/zinc/70/92/99/1057709299.db2.gz PUWGYWKVDHDWDA-LLVKDONJSA-N 1 2 311.476 4.176 20 0 DIADLO Cc1ccsc1-c1nn(C[N@H+]2CCC[C@@H]2C(C)C)c(=S)o1 ZINC000730253057 1057709599 /nfs/dbraw/zinc/70/95/99/1057709599.db2.gz PZLHWSZNKUJWNB-GFCCVEGCSA-N 1 2 323.487 4.320 20 0 DIADLO Cc1ccsc1-c1nn(C[N@@H+]2CCC[C@@H]2C(C)C)c(=S)o1 ZINC000730253057 1057709602 /nfs/dbraw/zinc/70/96/02/1057709602.db2.gz PZLHWSZNKUJWNB-GFCCVEGCSA-N 1 2 323.487 4.320 20 0 DIADLO NC(Cc1cccs1)=[NH+]OCc1c(Cl)cccc1Cl ZINC000731028987 1057732308 /nfs/dbraw/zinc/73/23/08/1057732308.db2.gz LYHZYZHTQVRGBX-UHFFFAOYSA-N 1 2 315.225 4.296 20 0 DIADLO CCOc1cc(-c2ccc(Cn3cc[nH+]c3)cn2)ccc1Cl ZINC001243572122 1057718921 /nfs/dbraw/zinc/71/89/21/1057718921.db2.gz IOHMNYRVWAAWLW-UHFFFAOYSA-N 1 2 313.788 4.046 20 0 DIADLO CN(c1ccc(-c2ccn3cc[nH+]c3c2)cn1)C1CCCCC1 ZINC001243596402 1057728202 /nfs/dbraw/zinc/72/82/02/1057728202.db2.gz XVESONTYSOIABH-UHFFFAOYSA-N 1 2 306.413 4.165 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(C(F)(F)F)cc2O)c1 ZINC001243610978 1057733370 /nfs/dbraw/zinc/73/33/70/1057733370.db2.gz DCDYSLHDGHOBOE-UHFFFAOYSA-N 1 2 318.298 4.479 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1ncc(-c3cccs3)o1)C2 ZINC000731482125 1057745151 /nfs/dbraw/zinc/74/51/51/1057745151.db2.gz AYUKILPDGVCPLH-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1ncc(-c3cccs3)o1)C2 ZINC000731482125 1057745153 /nfs/dbraw/zinc/74/51/53/1057745153.db2.gz AYUKILPDGVCPLH-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)nc(C(F)(F)F)c1 ZINC001243656690 1057745459 /nfs/dbraw/zinc/74/54/59/1057745459.db2.gz LLQSJQYTGCZIGQ-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO COc1ccc2nc(-c3ccc(Cn4cc[nH+]c4)cc3)ccc2c1 ZINC001243656055 1057745557 /nfs/dbraw/zinc/74/55/57/1057745557.db2.gz HCXJKTPOJNTKIB-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO c1cn(Cc2ccc(-c3nccc(-c4ccccc4)n3)cc2)c[nH+]1 ZINC001243656135 1057745592 /nfs/dbraw/zinc/74/55/92/1057745592.db2.gz CPKZGIUZWDGOOL-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO Fc1cc(F)c2nc(-c3ccc(Cn4cc[nH+]c4)cc3)ccc2c1 ZINC001243655687 1057745661 /nfs/dbraw/zinc/74/56/61/1057745661.db2.gz BGLDYVWRZUZIKR-UHFFFAOYSA-N 1 2 321.330 4.425 20 0 DIADLO COc1ccc2cc(-c3ccc(Cn4cc[nH+]c4)cc3)ncc2c1 ZINC001243658503 1057746092 /nfs/dbraw/zinc/74/60/92/1057746092.db2.gz ZHUXXVVYCJHUAZ-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Fc1ccc2ncc(-c3ccc(Cn4cc[nH+]c4)cc3)cc2c1 ZINC001243657506 1057746190 /nfs/dbraw/zinc/74/61/90/1057746190.db2.gz MXKHTOIANNEGAS-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO CC(=O)n1ccc2cc(-c3ccc(Cn4cc[nH+]c4)cc3)ccc21 ZINC001243657462 1057746415 /nfs/dbraw/zinc/74/64/15/1057746415.db2.gz MBIDZCYADSGOOF-UHFFFAOYSA-N 1 2 315.376 4.213 20 0 DIADLO Fc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1OC(F)F ZINC001243658579 1057746457 /nfs/dbraw/zinc/74/64/57/1057746457.db2.gz UXQYDUUAAWLXHD-UHFFFAOYSA-N 1 2 318.298 4.339 20 0 DIADLO c1cn(Cc2ccc(-c3ncncc3-c3ccccc3)cc2)c[nH+]1 ZINC001243657728 1057746484 /nfs/dbraw/zinc/74/64/84/1057746484.db2.gz QUEWVWBGQGSCEU-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO Cc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)cnc1C(F)(F)F ZINC001243659204 1057746876 /nfs/dbraw/zinc/74/68/76/1057746876.db2.gz NQNSBWZJTYPLKH-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO COCOc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c(C)c1C ZINC001243659201 1057747148 /nfs/dbraw/zinc/74/71/48/1057747148.db2.gz NJVOBMNBCLPGKX-UHFFFAOYSA-N 1 2 322.408 4.198 20 0 DIADLO COc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)cc2ncccc21 ZINC001243659486 1057747233 /nfs/dbraw/zinc/74/72/33/1057747233.db2.gz VUFHVUXDODALIS-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO COc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)ccc1OC(C)C ZINC001243660222 1057747439 /nfs/dbraw/zinc/74/74/39/1057747439.db2.gz QNFNBVVMMKAZGC-UHFFFAOYSA-N 1 2 322.408 4.394 20 0 DIADLO Cc1cnc(OC(C)C)c(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243659561 1057747447 /nfs/dbraw/zinc/74/74/47/1057747447.db2.gz YQELZNRZSOXGLX-UHFFFAOYSA-N 1 2 307.397 4.089 20 0 DIADLO Fc1cccc2c1cncc2-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243661508 1057748110 /nfs/dbraw/zinc/74/81/10/1057748110.db2.gz FGHRVNFHOQDKBP-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cn1ccc(-c2ccccc2)n1 ZINC000731657642 1057749730 /nfs/dbraw/zinc/74/97/30/1057749730.db2.gz NXWQJARZKLWLDP-AWEZNQCLSA-N 1 2 309.438 4.188 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cn1ccc(-c2ccccc2)n1 ZINC000731657642 1057749733 /nfs/dbraw/zinc/74/97/33/1057749733.db2.gz NXWQJARZKLWLDP-AWEZNQCLSA-N 1 2 309.438 4.188 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cc(F)c(SC)c(F)c1 ZINC001243691104 1057754406 /nfs/dbraw/zinc/75/44/06/1057754406.db2.gz VROQCUXRBBCLJF-UHFFFAOYSA-N 1 2 306.337 4.010 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1cc(F)c(SC)c(F)c1 ZINC001243690046 1057754545 /nfs/dbraw/zinc/75/45/45/1057754545.db2.gz YMLLIAQUDXMEHG-UHFFFAOYSA-N 1 2 306.337 4.239 20 0 DIADLO CC(=O)OCc1cccc(Cl)c1-c1ccc2[nH+]ccn2c1C ZINC001243723295 1057762685 /nfs/dbraw/zinc/76/26/85/1057762685.db2.gz IROJQYPMXNVLDC-UHFFFAOYSA-N 1 2 314.772 4.026 20 0 DIADLO CC(=O)OCc1cccc(Cl)c1-c1cc(C)cn2cc[nH+]c12 ZINC001243723062 1057762709 /nfs/dbraw/zinc/76/27/09/1057762709.db2.gz JNIAZMHXWOXTEV-UHFFFAOYSA-N 1 2 314.772 4.026 20 0 DIADLO CC(=O)OCc1cccc(C)c1-c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001243728569 1057764480 /nfs/dbraw/zinc/76/44/80/1057764480.db2.gz KESKPDBRQNKHCY-UHFFFAOYSA-N 1 2 306.365 4.115 20 0 DIADLO Cc1c(C)c(C)c(-c2cc[nH+]c(N3CCOCC3)c2)c(C)c1C ZINC001243901364 1057801520 /nfs/dbraw/zinc/80/15/20/1057801520.db2.gz ALXFHHMWFMYNES-UHFFFAOYSA-N 1 2 310.441 4.127 20 0 DIADLO COCC[N@H+](Cc1ncc(C(C)C)o1)Cc1ccc(C)cc1C ZINC000733308639 1057810890 /nfs/dbraw/zinc/81/08/90/1057810890.db2.gz OFJIFIVLTADLTH-UHFFFAOYSA-N 1 2 316.445 4.063 20 0 DIADLO COCC[N@@H+](Cc1ncc(C(C)C)o1)Cc1ccc(C)cc1C ZINC000733308639 1057810893 /nfs/dbraw/zinc/81/08/93/1057810893.db2.gz OFJIFIVLTADLTH-UHFFFAOYSA-N 1 2 316.445 4.063 20 0 DIADLO Cc1ccc(-c2csc3ncnc(C4=C[NH2+]CCC4)c23)cc1 ZINC001243947587 1057816703 /nfs/dbraw/zinc/81/67/03/1057816703.db2.gz MHLCCHOMMJIMGY-UHFFFAOYSA-N 1 2 307.422 4.391 20 0 DIADLO Fc1ccc(F)c(-c2nnc(C3=C[NH2+]CCC3)c3ccccc32)c1 ZINC001243949575 1057818041 /nfs/dbraw/zinc/81/80/41/1057818041.db2.gz UTSOIXFWODMUBL-UHFFFAOYSA-N 1 2 323.346 4.299 20 0 DIADLO CCOC(=O)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1F ZINC001243976898 1057826495 /nfs/dbraw/zinc/82/64/95/1057826495.db2.gz VEGPTICAKNSNJO-UHFFFAOYSA-N 1 2 310.328 4.060 20 0 DIADLO CCc1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1C(=O)OC ZINC001243976382 1057826681 /nfs/dbraw/zinc/82/66/81/1057826681.db2.gz PEYSSGKFFYCAFF-UHFFFAOYSA-N 1 2 306.365 4.093 20 0 DIADLO S=c1[nH]cc(-c2ccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)cc2)[nH]1 ZINC001243977719 1057827087 /nfs/dbraw/zinc/82/70/87/1057827087.db2.gz UAILQBSOHZKBMO-UHFFFAOYSA-N 1 2 318.405 4.423 20 0 DIADLO CC1(C)CC(=O)Nc2cc(-c3ccc(-c4[nH]cc[nH+]4)cc3)ccc21 ZINC001243979205 1057828006 /nfs/dbraw/zinc/82/80/06/1057828006.db2.gz PROBBIQAENPFMA-UHFFFAOYSA-N 1 2 317.392 4.364 20 0 DIADLO CC[S@](=N)(=O)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001243979473 1057828031 /nfs/dbraw/zinc/82/80/31/1057828031.db2.gz QZZIVDJOASEPDS-QFIPXVFZSA-N 1 2 311.410 4.169 20 0 DIADLO Cc1cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc(OC(F)F)n1 ZINC001243979505 1057828072 /nfs/dbraw/zinc/82/80/72/1057828072.db2.gz JFPDZAAEIQCQSW-UHFFFAOYSA-N 1 2 301.296 4.049 20 0 DIADLO COC(=O)c1c[nH]c2cc(-c3ccc(-c4[nH]cc[nH+]4)cc3)ccc21 ZINC001243980139 1057828235 /nfs/dbraw/zinc/82/82/35/1057828235.db2.gz VGJLGBWAVODSCS-UHFFFAOYSA-N 1 2 317.348 4.012 20 0 DIADLO COC(=O)[C@@H](C)c1cccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001243981760 1057828782 /nfs/dbraw/zinc/82/87/82/1057828782.db2.gz UCNVJRAJLCMQJY-ZDUSSCGKSA-N 1 2 306.365 4.020 20 0 DIADLO COc1cccc(C(F)(F)F)c1-c1cccc2[nH+]c(C)cn21 ZINC001244083730 1057863002 /nfs/dbraw/zinc/86/30/02/1057863002.db2.gz ZMINAAJRBAMFNF-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccccc2N2CCCC2)cc1 ZINC001244183586 1057893683 /nfs/dbraw/zinc/89/36/83/1057893683.db2.gz UEPRDDVRNQUESI-UHFFFAOYSA-N 1 2 303.409 4.354 20 0 DIADLO CC(C)COc1cccc(-c2ccc(Cn3cc[nH+]c3)cn2)c1 ZINC001244192292 1057896872 /nfs/dbraw/zinc/89/68/72/1057896872.db2.gz NASXLOQLHJJRAU-UHFFFAOYSA-N 1 2 307.397 4.028 20 0 DIADLO COc1ccc(-c2c[nH+]c(N)c(C)c2)cc1OCc1ccccc1 ZINC001244209625 1057900490 /nfs/dbraw/zinc/90/04/90/1057900490.db2.gz SBXBLXTVHZIEKY-UHFFFAOYSA-N 1 2 320.392 4.227 20 0 DIADLO C/C(=C\C=C\[NH3+])c1c(F)c(Cl)cc(Br)c1F ZINC001244233149 1057905337 /nfs/dbraw/zinc/90/53/37/1057905337.db2.gz AVVYWGJEASIVNS-PIXFVPMGSA-N 1 2 308.553 4.256 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1ccc2sccc2c1 ZINC001244296311 1057925656 /nfs/dbraw/zinc/92/56/56/1057925656.db2.gz DQVAGAYVSGHOAG-UHFFFAOYSA-N 1 2 310.422 4.108 20 0 DIADLO COc1cc(F)c(-c2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC001244349721 1057939076 /nfs/dbraw/zinc/93/90/76/1057939076.db2.gz JSNCECCCXBQUDG-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO Nc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1C(F)(F)F ZINC001244363063 1057944249 /nfs/dbraw/zinc/94/42/49/1057944249.db2.gz BEGHDVRDPLRQJC-UHFFFAOYSA-N 1 2 303.287 4.140 20 0 DIADLO COCOc1cccc(Cl)c1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001244433511 1057956540 /nfs/dbraw/zinc/95/65/40/1057956540.db2.gz RUAOLPSRBBZZKU-UHFFFAOYSA-N 1 2 314.772 4.175 20 0 DIADLO COCOc1ccc(C)c(-c2cc[nH+]c(N3CCCCC3)c2)c1 ZINC001244455658 1057963177 /nfs/dbraw/zinc/96/31/77/1057963177.db2.gz GGRABPWTEJSZJM-UHFFFAOYSA-N 1 2 312.413 4.030 20 0 DIADLO Oc1c(F)cc(-c2ccccc2C[NH+]2CCCC2)cc1Cl ZINC001244500044 1057976643 /nfs/dbraw/zinc/97/66/43/1057976643.db2.gz AMNRLJWGRMGPPT-UHFFFAOYSA-N 1 2 305.780 4.448 20 0 DIADLO COc1ccc(C)c(F)c1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001244569308 1057997684 /nfs/dbraw/zinc/99/76/84/1057997684.db2.gz SYLUXASBDMOCPW-UHFFFAOYSA-N 1 2 309.331 4.150 20 0 DIADLO CC(=O)c1ccc(F)c(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1F ZINC001244624101 1058012592 /nfs/dbraw/zinc/01/25/92/1058012592.db2.gz JSFOHPWYDLDQRF-UHFFFAOYSA-N 1 2 316.282 4.159 20 0 DIADLO C[N@@H+]1CCCC[C@@H]1c1ccc(-c2ccc(Cl)c(O)c2F)nc1 ZINC001244631892 1058014508 /nfs/dbraw/zinc/01/45/08/1058014508.db2.gz XVZDURXAFCTXFW-OAHLLOKOSA-N 1 2 320.795 4.404 20 0 DIADLO C[N@H+]1CCCC[C@@H]1c1ccc(-c2ccc(Cl)c(O)c2F)nc1 ZINC001244631892 1058014512 /nfs/dbraw/zinc/01/45/12/1058014512.db2.gz XVZDURXAFCTXFW-OAHLLOKOSA-N 1 2 320.795 4.404 20 0 DIADLO c1cc2c[nH+]c(-c3ccc(NCc4ccccc4)cc3)nc2[nH]1 ZINC001244641925 1058018044 /nfs/dbraw/zinc/01/80/44/1058018044.db2.gz FHDUICKAPCQHGW-UHFFFAOYSA-N 1 2 300.365 4.189 20 0 DIADLO Cn1ccc2c[nH+]c(-c3ccc(NCc4ccccc4)cc3)nc21 ZINC001244644193 1058018537 /nfs/dbraw/zinc/01/85/37/1058018537.db2.gz YXRQLPVAZREFPB-UHFFFAOYSA-N 1 2 314.392 4.247 20 0 DIADLO CN(C)c1cc(-c2ccc(NCc3ccccc3)cc2)cc[nH+]1 ZINC001244644566 1058018941 /nfs/dbraw/zinc/01/89/41/1058018941.db2.gz VIALQFKACCMVIX-UHFFFAOYSA-N 1 2 303.409 4.427 20 0 DIADLO COCOc1c(C)cccc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001244656857 1058021135 /nfs/dbraw/zinc/02/11/35/1058021135.db2.gz GYFBAZQHWFOVMU-UHFFFAOYSA-N 1 2 308.381 4.045 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccc(C(=O)NC)cc2F)c1 ZINC001244665157 1058022141 /nfs/dbraw/zinc/02/21/41/1058022141.db2.gz YRHQDLKRXBAMRT-UHFFFAOYSA-N 1 2 314.404 4.007 20 0 DIADLO Cc1cc(-c2ccccc2Cn2cc[nH+]c2)cnc1OC(C)C ZINC001244687645 1058026065 /nfs/dbraw/zinc/02/60/65/1058026065.db2.gz DMXYKLKFBSBTKK-UHFFFAOYSA-N 1 2 307.397 4.089 20 0 DIADLO COc1c(F)cc(-c2ccccc2Cn2cc[nH+]c2)cc1Cl ZINC001244699468 1058029916 /nfs/dbraw/zinc/02/99/16/1058029916.db2.gz RADHZONCDRQAAG-UHFFFAOYSA-N 1 2 316.763 4.400 20 0 DIADLO CC(=O)c1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c(F)c1F ZINC001244704334 1058031524 /nfs/dbraw/zinc/03/15/24/1058031524.db2.gz IQRDLRXVURMISV-UHFFFAOYSA-N 1 2 316.282 4.159 20 0 DIADLO Cc1cc(-c2c(F)c(F)ccc2OC(C)C)cn2cc[nH+]c12 ZINC001244740455 1058038835 /nfs/dbraw/zinc/03/88/35/1058038835.db2.gz FLGIHCNWIWIPDB-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Cc1cc(-c2c(F)c(F)ccc2OC(C)C)c2[nH+]ccn2c1 ZINC001244741420 1058039674 /nfs/dbraw/zinc/03/96/74/1058039674.db2.gz QWZAHWHEFLIVPX-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Nc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)c(C(F)(F)F)c1 ZINC001244746965 1058040445 /nfs/dbraw/zinc/04/04/45/1058040445.db2.gz NELBLEATETZVRP-UHFFFAOYSA-N 1 2 303.287 4.140 20 0 DIADLO O=C(O[C@H]1CC=C(c2ccc3[nH+]ccn3c2)CC1)c1ccccc1 ZINC001244802556 1058050232 /nfs/dbraw/zinc/05/02/32/1058050232.db2.gz FJVQLDFDAITUDA-SFHVURJKSA-N 1 2 318.376 4.127 20 0 DIADLO Cc1cc(-c2cc(F)cc(N3CCCCC3)c2)c2[nH+]ccn2c1 ZINC001244821310 1058052909 /nfs/dbraw/zinc/05/29/09/1058052909.db2.gz CXRWHBUOYHHRJX-UHFFFAOYSA-N 1 2 309.388 4.439 20 0 DIADLO Fc1c(C[NH+]2CCOCC2)cccc1-c1cccc2ccoc21 ZINC001244853276 1058058974 /nfs/dbraw/zinc/05/89/74/1058058974.db2.gz HCHJALGLFWRJPX-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO CCOc1ccc(C)c(-c2ccc(-n3cc[nH+]c3)cc2OC)c1 ZINC001244875172 1058062912 /nfs/dbraw/zinc/06/29/12/1058062912.db2.gz YLPRKGBQSVABGB-UHFFFAOYSA-N 1 2 308.381 4.255 20 0 DIADLO Cc1cc(Cl)ncc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001244915562 1058071238 /nfs/dbraw/zinc/07/12/38/1058071238.db2.gz GFBTYHKOAGQEIA-UHFFFAOYSA-N 1 2 301.821 4.404 20 0 DIADLO Clc1ccnc(Cl)c1-c1ccccc1Cn1cc[nH+]c1 ZINC001244938344 1058075706 /nfs/dbraw/zinc/07/57/06/1058075706.db2.gz APSWZYKNMVLQMO-UHFFFAOYSA-N 1 2 304.180 4.300 20 0 DIADLO CNc1cc(-c2ccc(-c3cn4ccsc4n3)cc2)cc[nH+]1 ZINC001244970996 1058083617 /nfs/dbraw/zinc/08/36/17/1058083617.db2.gz DHHXMUPFZAIALT-UHFFFAOYSA-N 1 2 306.394 4.167 20 0 DIADLO CNc1cc(-c2cnc3ccc(C(F)(F)F)cc3c2)cc[nH+]1 ZINC001244972935 1058084326 /nfs/dbraw/zinc/08/43/26/1058084326.db2.gz QDJKVVLXQAXGTJ-UHFFFAOYSA-N 1 2 303.287 4.357 20 0 DIADLO COc1cc(C)c(C)cc1-c1ccc(-n2cc[nH+]c2)cc1OC ZINC001245022439 1058096111 /nfs/dbraw/zinc/09/61/11/1058096111.db2.gz RWBPSFZTMAMANI-UHFFFAOYSA-N 1 2 308.381 4.173 20 0 DIADLO CCOc1cc(C)c(C)cc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001245026115 1058097083 /nfs/dbraw/zinc/09/70/83/1058097083.db2.gz UXNLNZJUGNGZRM-UHFFFAOYSA-N 1 2 307.397 4.009 20 0 DIADLO Cc1cc(Cl)ccc1-c1cc(C[NH+]2CCOCC2)ccc1F ZINC001245086261 1058109773 /nfs/dbraw/zinc/10/97/73/1058109773.db2.gz FGOODKASKRVHSG-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO CCOc1ccc(Cl)cc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001245105617 1058115192 /nfs/dbraw/zinc/11/51/92/1058115192.db2.gz FIENUWNAOSEDDV-UHFFFAOYSA-N 1 2 313.788 4.046 20 0 DIADLO Fc1ccc(Cl)c(-c2cc(C[NH+]3CCOCC3)ccc2F)c1 ZINC001245137135 1058119397 /nfs/dbraw/zinc/11/93/97/1058119397.db2.gz MOGUOJLOAGIGHH-UHFFFAOYSA-N 1 2 323.770 4.117 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cc(F)cc(C(C)(C)O)c2)cc1 ZINC001245143342 1058120336 /nfs/dbraw/zinc/12/03/36/1058120336.db2.gz XGYNMHKSFHXZGJ-UHFFFAOYSA-N 1 2 310.372 4.121 20 0 DIADLO CCOC(=O)c1ccc(-c2c[nH+]cn2Cc2ccccc2)c(C)c1 ZINC001245196377 1058125888 /nfs/dbraw/zinc/12/58/88/1058125888.db2.gz CLNWMRICJBEEOX-UHFFFAOYSA-N 1 2 320.392 4.084 20 0 DIADLO Cc1nc(OC(C)C)ccc1-c1c[nH+]cn1Cc1ccccc1 ZINC001245199486 1058127149 /nfs/dbraw/zinc/12/71/49/1058127149.db2.gz ULLISCJAIWGUFA-UHFFFAOYSA-N 1 2 307.397 4.089 20 0 DIADLO COC(=O)c1ccc(C)c(-c2c[nH+]cn2Cc2ccccc2)c1C ZINC001245202222 1058127647 /nfs/dbraw/zinc/12/76/47/1058127647.db2.gz WQTXZQGQFHQLIS-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO COc1c(F)cc(SC)cc1-c1cn2cc[nH+]c2cc1C ZINC001245226562 1058130016 /nfs/dbraw/zinc/13/00/16/1058130016.db2.gz WOZJPJAVULPULW-UHFFFAOYSA-N 1 2 302.374 4.179 20 0 DIADLO COc1c(F)cc(SC)cc1-c1ccc2[nH+]ccn2c1C ZINC001245227279 1058130556 /nfs/dbraw/zinc/13/05/56/1058130556.db2.gz NCVVRFJUEOAHAI-UHFFFAOYSA-N 1 2 302.374 4.179 20 0 DIADLO CC[C@H](C)c1ccc(-c2cncc(C[NH+]3CCOCC3)c2)cc1 ZINC001245251290 1058135215 /nfs/dbraw/zinc/13/52/15/1058135215.db2.gz QXBVLTQEMHYJOH-INIZCTEOSA-N 1 2 310.441 4.094 20 0 DIADLO Cc1cc(-c2ccc(-c3nc4ccccc4o3)cc2)c[nH+]c1N ZINC001245321256 1058145189 /nfs/dbraw/zinc/14/51/89/1058145189.db2.gz JDAFVFIUZNRURA-UHFFFAOYSA-N 1 2 301.349 4.447 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccncc1C(F)(F)F ZINC001245444491 1058167154 /nfs/dbraw/zinc/16/71/54/1058167154.db2.gz FBAAZKQDWLUOFN-UHFFFAOYSA-N 1 2 321.346 4.461 20 0 DIADLO CC(C)(C)[C@H]1CCC[C@H](NC(=O)c2cccc3[nH+]ccn32)CC1 ZINC001516564432 1058182418 /nfs/dbraw/zinc/18/24/18/1058182418.db2.gz PIOFCWWNJNNZBI-GJZGRUSLSA-N 1 2 313.445 4.059 20 0 DIADLO CCC(CC)N(CC(C)C)C(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001545173772 1058185671 /nfs/dbraw/zinc/18/56/71/1058185671.db2.gz FUMMUHMMKOTUNB-QGZVFWFLSA-N 1 2 307.482 4.144 20 0 DIADLO CC(C)[C@@H](CCc1ccccc1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001527606584 1058186335 /nfs/dbraw/zinc/18/63/35/1058186335.db2.gz VJFYWGGJAXQJCS-GOSISDBHSA-N 1 2 321.424 4.178 20 0 DIADLO CCC(CC)N(CC(C)C)C(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001545173771 1058186445 /nfs/dbraw/zinc/18/64/45/1058186445.db2.gz FUMMUHMMKOTUNB-KRWDZBQOSA-N 1 2 307.482 4.144 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(N)cc1Cl ZINC001245505519 1058187755 /nfs/dbraw/zinc/18/77/55/1058187755.db2.gz IFOYIWGLXOHKIS-UHFFFAOYSA-N 1 2 301.821 4.283 20 0 DIADLO Cc1cc(NC(=O)C2(c3ccc(C(C)C)cc3)CCC2)c(C)c[nH+]1 ZINC001527662889 1058199762 /nfs/dbraw/zinc/19/97/62/1058199762.db2.gz WMYFMJMJRGTPMB-UHFFFAOYSA-N 1 2 322.452 4.304 20 0 DIADLO CC(C)COc1ncc(-c2cccc3[nH+]ccn32)cc1Cl ZINC001245532522 1058211251 /nfs/dbraw/zinc/21/12/51/1058211251.db2.gz FQEIEYMZULFYMM-UHFFFAOYSA-N 1 2 301.777 4.085 20 0 DIADLO CC(C)COc1ncc(-c2ccc3[nH+]ccn3c2)cc1Cl ZINC001245532435 1058212266 /nfs/dbraw/zinc/21/22/66/1058212266.db2.gz AZUKQXDVLVLBKO-UHFFFAOYSA-N 1 2 301.777 4.085 20 0 DIADLO Cc1cc(-c2nc(-c3cccs3)nc3ccccc32)c[nH+]c1N ZINC001245537827 1058216846 /nfs/dbraw/zinc/21/68/46/1058216846.db2.gz IRMIAUCAHHKEQP-UHFFFAOYSA-N 1 2 318.405 4.311 20 0 DIADLO Cc1cc(-c2ccnc3c(OC(F)(F)F)cccc23)c[nH+]c1N ZINC001245541681 1058218754 /nfs/dbraw/zinc/21/87/54/1058218754.db2.gz VDLKFXZNXYUQHN-UHFFFAOYSA-N 1 2 319.286 4.086 20 0 DIADLO Cc1cc(-c2nccc3cc(C(F)(F)F)ccc32)c[nH+]c1N ZINC001245539237 1058219937 /nfs/dbraw/zinc/21/99/37/1058219937.db2.gz VJEFWICVZTYEMB-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1ccc(-c2cc(F)c(C)cc2F)c(C[NH+]2CCOCC2)c1 ZINC001245544681 1058221481 /nfs/dbraw/zinc/22/14/81/1058221481.db2.gz KHYNHUHPFJMZLT-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO CCCn1nccc1C[N@@H+]1CCCC[C@@H]1c1nc(C)c(C)s1 ZINC001549368042 1058291525 /nfs/dbraw/zinc/29/15/25/1058291525.db2.gz FRGUXGBGGLHFEV-MRXNPFEDSA-N 1 2 318.490 4.094 20 0 DIADLO CCCn1nccc1C[N@H+]1CCCC[C@@H]1c1nc(C)c(C)s1 ZINC001549368042 1058291542 /nfs/dbraw/zinc/29/15/42/1058291542.db2.gz FRGUXGBGGLHFEV-MRXNPFEDSA-N 1 2 318.490 4.094 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc(-c3ncco3)cc2)cc1F ZINC001245624646 1058294402 /nfs/dbraw/zinc/29/44/02/1058294402.db2.gz HXUGJORSQBUKKO-UHFFFAOYSA-N 1 2 314.335 4.348 20 0 DIADLO c1coc(-c2ccc(-c3ccccc3Cn3cc[nH+]c3)cc2)n1 ZINC001245623310 1058294918 /nfs/dbraw/zinc/29/49/18/1058294918.db2.gz ZZIJSIJLLGPQFT-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO c1oc(C2CC2)nc1C[N@@H+]1CCC[C@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC001550134205 1058319885 /nfs/dbraw/zinc/31/98/85/1058319885.db2.gz KUYSMWKWHUYBNP-OTWHNJEPSA-N 1 2 324.424 4.047 20 0 DIADLO c1oc(C2CC2)nc1C[N@H+]1CCC[C@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC001550134205 1058319907 /nfs/dbraw/zinc/31/99/07/1058319907.db2.gz KUYSMWKWHUYBNP-OTWHNJEPSA-N 1 2 324.424 4.047 20 0 DIADLO COc1c(Br)cccc1-c1cccc2[nH+]c(C)cn21 ZINC001245682527 1058345879 /nfs/dbraw/zinc/34/58/79/1058345879.db2.gz DXNQKIOBDHKOJR-UHFFFAOYSA-N 1 2 317.186 4.081 20 0 DIADLO COc1cc(C)c(-c2ccc(-n3cc[nH+]c3)cc2OC)c(C)c1 ZINC001245683080 1058345969 /nfs/dbraw/zinc/34/59/69/1058345969.db2.gz PCIQHTDCURSPIR-UHFFFAOYSA-N 1 2 308.381 4.173 20 0 DIADLO CCn1c[nH+]cc1[C@H]1CCCCN1C(=O)CC1C(C)(C)C1(C)C ZINC001550783280 1058356246 /nfs/dbraw/zinc/35/62/46/1058356246.db2.gz FMJVCGVMFKWOQP-CQSZACIVSA-N 1 2 317.477 4.029 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CC[C@H]3CCCC[C@H]3C2)c(C)[nH+]1 ZINC001562900837 1058356783 /nfs/dbraw/zinc/35/67/83/1058356783.db2.gz SUDCASITPGQGAS-IXDOHACOSA-N 1 2 315.461 4.487 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C)c2ccc(F)cc2C)c(C)[nH+]1 ZINC001562901074 1058357473 /nfs/dbraw/zinc/35/74/73/1058357473.db2.gz BULZIBXAIKSAHW-ZDUSSCGKSA-N 1 2 315.392 4.337 20 0 DIADLO Nc1cn2ccc(-c3cc(Cl)ccc3C(F)(F)F)cc2[nH+]1 ZINC001245696862 1058363353 /nfs/dbraw/zinc/36/33/53/1058363353.db2.gz YZOAZGFTFSESHV-UHFFFAOYSA-N 1 2 311.694 4.256 20 0 DIADLO CCOc1cc(F)c(-c2cc(-n3ccnc3)cc[nH+]2)cc1Cl ZINC001245704608 1058372560 /nfs/dbraw/zinc/37/25/60/1058372560.db2.gz SMNCRIQIEZGZJN-UHFFFAOYSA-N 1 2 317.751 4.126 20 0 DIADLO COc1cc(-c2cc(C)cn3cc[nH+]c23)ccc1OC(F)(F)F ZINC001245714713 1058388838 /nfs/dbraw/zinc/38/88/38/1058388838.db2.gz NOQPCDIPFNSTCD-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO CCSc1ccccc1CC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001528346714 1058398908 /nfs/dbraw/zinc/39/89/08/1058398908.db2.gz DAMPDXKSWQSBQS-UHFFFAOYSA-N 1 2 314.454 4.300 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2CCCC2(F)F)[nH+]c1C ZINC001551737980 1058408280 /nfs/dbraw/zinc/40/82/80/1058408280.db2.gz FQVGTFDPAWMXPZ-CYBMUJFWSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)CC2CC(F)(F)C2)[nH+]c1C ZINC001551740458 1058408831 /nfs/dbraw/zinc/40/88/31/1058408831.db2.gz NALKNWIMANABDK-UHFFFAOYSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2CCCC2(C)C)[nH+]c1C ZINC001551737364 1058409459 /nfs/dbraw/zinc/40/94/59/1058409459.db2.gz CVYAVVCIZFUWOR-OAHLLOKOSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2CCC[C@@H](C)C2)[nH+]c1C ZINC001551736715 1058409795 /nfs/dbraw/zinc/40/97/95/1058409795.db2.gz AAAFSAQQANMGHL-DOMZBBRYSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C[C@@H]2CC[C@H](C)C2)[nH+]c1C ZINC001551743541 1058410873 /nfs/dbraw/zinc/41/08/73/1058410873.db2.gz WMYYSRIZXPNUGX-SWLSCSKDSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)CC(C2CC2)C2CC2)[nH+]c1C ZINC001551745324 1058411577 /nfs/dbraw/zinc/41/15/77/1058411577.db2.gz GAVMKVLKTBWFKL-UHFFFAOYSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H]3CC[C@H]4CCCC[C@@H]4C3)ccc2[nH+]1 ZINC001519733593 1058468445 /nfs/dbraw/zinc/46/84/45/1058468445.db2.gz VPZPZTFVMIQWEP-BZUAXINKSA-N 1 2 311.429 4.188 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2ccc(C)c3ccccc23)c(C)[nH+]1 ZINC001528676722 1058488234 /nfs/dbraw/zinc/48/82/34/1058488234.db2.gz GYRMXQYMYNELBH-UHFFFAOYSA-N 1 2 318.420 4.398 20 0 DIADLO COc1ccc(Cl)cc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001245809322 1058493211 /nfs/dbraw/zinc/49/32/11/1058493211.db2.gz COHYIBSFGGBNGU-UHFFFAOYSA-N 1 2 302.683 4.012 20 0 DIADLO CCn1c[nH+]cc1[C@@H]1CCCCN1c1nc2cccc(C)c2o1 ZINC001553701377 1058500513 /nfs/dbraw/zinc/50/05/13/1058500513.db2.gz DMTVKUXYVHWZDG-HNNXBMFYSA-N 1 2 310.401 4.084 20 0 DIADLO Cc1cc(N[C@H]2CCO[C@H](c3ccccn3)C2)[nH+]c2ccccc12 ZINC001553701549 1058501526 /nfs/dbraw/zinc/50/15/26/1058501526.db2.gz BRWLOJXFRVRMDX-KXBFYZLASA-N 1 2 319.408 4.270 20 0 DIADLO CC1=C(C)C[C@@](C)(C(=O)NCc2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001528835056 1058534696 /nfs/dbraw/zinc/53/46/96/1058534696.db2.gz GHFDCBVTDJEVMS-FQEVSTJZSA-N 1 2 323.440 4.015 20 0 DIADLO CCOc1nccc(-c2cccc(-c3c[nH+]cn3C)c2)c1Cl ZINC001245848652 1058555316 /nfs/dbraw/zinc/55/53/16/1058555316.db2.gz YWEIEUSYAOTUSI-UHFFFAOYSA-N 1 2 313.788 4.201 20 0 DIADLO CCC1(CC)CCCN(C(=O)[C@@H](CC(C)C)n2cc[nH+]c2)CC1 ZINC001556210304 1058559671 /nfs/dbraw/zinc/55/96/71/1058559671.db2.gz UDTRDWAGLYGJJU-QGZVFWFLSA-N 1 2 319.493 4.289 20 0 DIADLO CC[C@@H](C)c1ccc(C(=O)Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC001528983003 1058568931 /nfs/dbraw/zinc/56/89/31/1058568931.db2.gz JJNMYZUDEXPTGR-CYBMUJFWSA-N 1 2 307.397 4.409 20 0 DIADLO COc1cc(-c2cc(C)cn3cc[nH+]c23)c(F)c(F)c1Cl ZINC001245862080 1058571622 /nfs/dbraw/zinc/57/16/22/1058571622.db2.gz LLGRASYKHGCLMT-UHFFFAOYSA-N 1 2 308.715 4.250 20 0 DIADLO CC(C)Oc1c(F)cc(-c2c[nH+]c3c(c2)CCCN3)cc1Cl ZINC001245868002 1058574587 /nfs/dbraw/zinc/57/45/87/1058574587.db2.gz KYQXYMPHTJBSLM-UHFFFAOYSA-N 1 2 320.795 4.329 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)c(C)[nH+]1 ZINC001520383234 1058598829 /nfs/dbraw/zinc/59/88/29/1058598829.db2.gz SUOGCFMGONHORZ-LBPRGKRZSA-N 1 2 316.367 4.104 20 0 DIADLO C/C(=C\c1ccccc1Cl)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001529383992 1058693567 /nfs/dbraw/zinc/69/35/67/1058693567.db2.gz CKVIQXQYLHZNPD-XYOKQWHBSA-N 1 2 314.816 4.072 20 0 DIADLO CCCc1sc(C(=O)NCc2c[nH]c(C(C)C)[nH+]2)cc1CC ZINC001558559798 1058885507 /nfs/dbraw/zinc/88/55/07/1058885507.db2.gz BYRJAQDDVVDCIL-UHFFFAOYSA-N 1 2 319.474 4.040 20 0 DIADLO CCCc1sc(C(=O)NCc2c[nH+]c(C(C)C)[nH]2)cc1CC ZINC001558559798 1058885528 /nfs/dbraw/zinc/88/55/28/1058885528.db2.gz BYRJAQDDVVDCIL-UHFFFAOYSA-N 1 2 319.474 4.040 20 0 DIADLO CCC[C@H](C(=O)N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1)C(C)C ZINC001558953076 1058926719 /nfs/dbraw/zinc/92/67/19/1058926719.db2.gz AKUBGEHRICQLFV-YJBOKZPZSA-N 1 2 313.445 4.122 20 0 DIADLO CCCCC[C@H](NC(=O)c1ccn2c(C)c[nH+]c2c1)C(C)(C)C ZINC001521621477 1058926722 /nfs/dbraw/zinc/92/67/22/1058926722.db2.gz YHCAVMPWJVAXPV-INIZCTEOSA-N 1 2 315.461 4.368 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3ccc(C4CCC4)cc3)ccn12 ZINC001521645261 1058931392 /nfs/dbraw/zinc/93/13/92/1058931392.db2.gz LEHCVCLJNWVTFR-UHFFFAOYSA-N 1 2 306.365 4.129 20 0 DIADLO COc1ccc(Sc2nc3ccccc3n3c[nH+]cc23)cc1 ZINC001559047046 1058946323 /nfs/dbraw/zinc/94/63/23/1058946323.db2.gz CNOGKYQXULQZSA-UHFFFAOYSA-N 1 2 307.378 4.042 20 0 DIADLO CCc1cc(N(C)Cc2ccccc2C(F)(F)F)nc(CC)[nH+]1 ZINC001559062479 1058958154 /nfs/dbraw/zinc/95/81/54/1058958154.db2.gz YZZWVCCFQJTFKB-UHFFFAOYSA-N 1 2 323.362 4.257 20 0 DIADLO CCc1nc(N2CCC[C@@H]2c2ccc(Cl)cc2)cc(C)[nH+]1 ZINC001559064106 1058959446 /nfs/dbraw/zinc/95/94/46/1058959446.db2.gz ALTYQLJJXFEUQQ-OAHLLOKOSA-N 1 2 301.821 4.342 20 0 DIADLO Cc1cc(N(Cc2ccc(Cl)cc2)C2CC2)nc(C2CC2)[nH+]1 ZINC001559074574 1058969079 /nfs/dbraw/zinc/96/90/79/1058969079.db2.gz XFNUWBZKILWFHR-UHFFFAOYSA-N 1 2 313.832 4.485 20 0 DIADLO Cc1cc(N[C@H](C)COc2c(C)cccc2C)nc(C2CC2)[nH+]1 ZINC001559084241 1058974993 /nfs/dbraw/zinc/97/49/93/1058974993.db2.gz NBRCHXYYJYCABM-OAHLLOKOSA-N 1 2 311.429 4.159 20 0 DIADLO Cc1c2ccccc2oc1CNc1nc(C)[nH+]c2c1CCCC2 ZINC001559105004 1058990022 /nfs/dbraw/zinc/99/00/22/1058990022.db2.gz FEUPXPOERJLUIZ-UHFFFAOYSA-N 1 2 307.397 4.331 20 0 DIADLO CCO[C@@H]1C[C@H](Nc2cc(C)[nH+]c(C3CC3)n2)C12CCCCC2 ZINC001559105642 1058991842 /nfs/dbraw/zinc/99/18/42/1058991842.db2.gz XEHRBWJAHZPPEQ-JKSUJKDBSA-N 1 2 315.461 4.202 20 0 DIADLO C[C@@H](CC(=O)N1Cc2ccccc2-c2ccccc21)n1cc[nH+]c1 ZINC001530291323 1058995311 /nfs/dbraw/zinc/99/53/11/1058995311.db2.gz ZDSJHPPFACNKAJ-HNNXBMFYSA-N 1 2 317.392 4.048 20 0 DIADLO CCc1cc(N2C[C@H](c3ccccc3C)C[C@@H]2C)nc(CC)[nH+]1 ZINC001559114328 1059001342 /nfs/dbraw/zinc/00/13/42/1059001342.db2.gz PMUAODXQETZRHY-JKSUJKDBSA-N 1 2 309.457 4.292 20 0 DIADLO Cc1nc(NC[C@@H](Cc2ccccc2)c2ccccc2)cc[nH+]1 ZINC001559120896 1059008916 /nfs/dbraw/zinc/00/89/16/1059008916.db2.gz INRNCXIGISLGRH-LJQANCHMSA-N 1 2 303.409 4.223 20 0 DIADLO C[C@H](Nc1nc2ccccc2n2c[nH+]cc12)[C@@H](C)c1ccccc1 ZINC001559124132 1059013070 /nfs/dbraw/zinc/01/30/70/1059013070.db2.gz XHJRJLHJOMFUCA-CABCVRRESA-N 1 2 316.408 4.487 20 0 DIADLO CCS[C@H]1CCC[C@H](Nc2nc(C)[nH+]c3c2CCCC3)C1 ZINC001559127644 1059016338 /nfs/dbraw/zinc/01/63/38/1059016338.db2.gz RTDWOEXWYZVZGX-KBPBESRZSA-N 1 2 305.491 4.140 20 0 DIADLO CCc1cc(NC[C@]2(C)CCCc3ccccc32)nc(CC)[nH+]1 ZINC001559156730 1059040535 /nfs/dbraw/zinc/04/05/35/1059040535.db2.gz IBXDNCOJFZABIB-FQEVSTJZSA-N 1 2 309.457 4.308 20 0 DIADLO CC[NH+](CC)[C@@H](C(=O)Oc1cccc(Cl)c1)c1ccccc1 ZINC001530432150 1059043347 /nfs/dbraw/zinc/04/33/47/1059043347.db2.gz YCPMXLLNLYKTAV-QGZVFWFLSA-N 1 2 317.816 4.329 20 0 DIADLO Cc1nc(N2CCC[C@H](Cc3csc4ccccc34)C2)cc[nH+]1 ZINC001559159822 1059043955 /nfs/dbraw/zinc/04/39/55/1059043955.db2.gz SPRNXTSZRMCIEZ-OAHLLOKOSA-N 1 2 323.465 4.459 20 0 DIADLO Cc1cc(N[C@@H](C)c2nc3ccccc3[nH]2)nc(C2CCC2)[nH+]1 ZINC001559217536 1059096425 /nfs/dbraw/zinc/09/64/25/1059096425.db2.gz NUNKIDZTBAEBHC-LBPRGKRZSA-N 1 2 307.401 4.102 20 0 DIADLO Cc1nc(N(C)[C@@H]2CCC[C@@H]2C(C)(C)C)c2c([nH+]1)CCCC2 ZINC001559216042 1059097250 /nfs/dbraw/zinc/09/72/50/1059097250.db2.gz MILRSYWTYHLTPG-DOTOQJQBSA-N 1 2 301.478 4.315 20 0 DIADLO CC(C)c1cc(N[C@@H](C2CC2)C2CCOCC2)nc(C(C)C)[nH+]1 ZINC001559227530 1059103847 /nfs/dbraw/zinc/10/38/47/1059103847.db2.gz UFADSSONNWDBFR-SFHVURJKSA-N 1 2 317.477 4.341 20 0 DIADLO Cc1ccccc1[C@H](C)N(C)c1nc2ccccc2n2c[nH+]cc12 ZINC001559248378 1059119774 /nfs/dbraw/zinc/11/97/74/1059119774.db2.gz RHYFOYCFRJXGOF-HNNXBMFYSA-N 1 2 316.408 4.388 20 0 DIADLO CCNc1ccc(Nc2ccc(C(F)(F)F)c(Cl)n2)c[nH+]1 ZINC001559305585 1059152714 /nfs/dbraw/zinc/15/27/14/1059152714.db2.gz OJYOXBGTKPLZSA-UHFFFAOYSA-N 1 2 316.714 4.324 20 0 DIADLO Fc1ccccc1CSc1nc2ccccc2n2c[nH+]cc12 ZINC001559306164 1059155242 /nfs/dbraw/zinc/15/52/42/1059155242.db2.gz KHBXOCVYEOVICS-UHFFFAOYSA-N 1 2 309.369 4.314 20 0 DIADLO FC(F)(F)c1cc2nc([C@H]3CCCC[NH2+]3)[nH]c2c(Cl)c1 ZINC001247007089 1059233755 /nfs/dbraw/zinc/23/37/55/1059233755.db2.gz CAXZJSFSBMKKRG-SECBINFHSA-N 1 2 303.715 4.050 20 0 DIADLO c1cc(N2CCCC2)cc2[nH+]c(-c3ccc4c(c3)NCCC4)[nH]c12 ZINC001247013326 1059243625 /nfs/dbraw/zinc/24/36/25/1059243625.db2.gz CXNSNMUEYUZDJI-UHFFFAOYSA-N 1 2 318.424 4.188 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@@H+]1CCc2cc(C(C)(C)C)ccc2C1 ZINC001559513262 1059308532 /nfs/dbraw/zinc/30/85/32/1059308532.db2.gz MATORNAPXQQYKU-OAHLLOKOSA-N 1 2 317.473 4.074 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@H+]1CCc2cc(C(C)(C)C)ccc2C1 ZINC001559513262 1059308557 /nfs/dbraw/zinc/30/85/57/1059308557.db2.gz MATORNAPXQQYKU-OAHLLOKOSA-N 1 2 317.473 4.074 20 0 DIADLO CC[N@H+](Cc1c(C)cc(C)nc1C)Cc1c(F)cccc1F ZINC001559516522 1059312458 /nfs/dbraw/zinc/31/24/58/1059312458.db2.gz UJZYBACRZPBVMB-UHFFFAOYSA-N 1 2 304.384 4.307 20 0 DIADLO CC[N@@H+](Cc1c(C)cc(C)nc1C)Cc1c(F)cccc1F ZINC001559516522 1059312476 /nfs/dbraw/zinc/31/24/76/1059312476.db2.gz UJZYBACRZPBVMB-UHFFFAOYSA-N 1 2 304.384 4.307 20 0 DIADLO Cc1ccc(-c2noc([C@H]3CCC[N@@H+]3Cc3ccco3)n2)c(C)c1 ZINC001247223426 1059349516 /nfs/dbraw/zinc/34/95/16/1059349516.db2.gz FTFQOBULOJVUMY-QGZVFWFLSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1ccc(-c2noc([C@H]3CCC[N@H+]3Cc3ccco3)n2)c(C)c1 ZINC001247223426 1059349531 /nfs/dbraw/zinc/34/95/31/1059349531.db2.gz FTFQOBULOJVUMY-QGZVFWFLSA-N 1 2 323.396 4.284 20 0 DIADLO CCc1ccc(-c2noc([C@@H]3CCC[N@@H+]3Cc3ccco3)n2)cc1 ZINC001247224710 1059350462 /nfs/dbraw/zinc/35/04/62/1059350462.db2.gz JFGOWKIEAYTWSJ-KRWDZBQOSA-N 1 2 323.396 4.229 20 0 DIADLO CCc1ccc(-c2noc([C@@H]3CCC[N@H+]3Cc3ccco3)n2)cc1 ZINC001247224710 1059350478 /nfs/dbraw/zinc/35/04/78/1059350478.db2.gz JFGOWKIEAYTWSJ-KRWDZBQOSA-N 1 2 323.396 4.229 20 0 DIADLO CC(C)(C)c1ccc(-c2noc([C@H]3CCCc4[nH]c[nH+]c43)n2)cc1 ZINC001247272046 1059363594 /nfs/dbraw/zinc/36/35/94/1059363594.db2.gz IGYHFHVPRZEXTK-AWEZNQCLSA-N 1 2 322.412 4.225 20 0 DIADLO c1cc2cc(-c3noc([C@@H]4CCCc5[nH]c[nH+]c54)n3)ccc2s1 ZINC001247273199 1059365925 /nfs/dbraw/zinc/36/59/25/1059365925.db2.gz SPOCTEIHFVKENY-GFCCVEGCSA-N 1 2 322.393 4.143 20 0 DIADLO Cc1ccc(Cl)c(OC(=O)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001523823759 1059369014 /nfs/dbraw/zinc/36/90/14/1059369014.db2.gz OCGLOAVGXUHXCV-UHFFFAOYSA-N 1 2 312.756 4.053 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cscc1Br ZINC001559574466 1059403993 /nfs/dbraw/zinc/40/39/93/1059403993.db2.gz ACWKYCNLWFBXJC-LLVKDONJSA-N 1 2 322.271 4.457 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cscc1Br ZINC001559574466 1059403999 /nfs/dbraw/zinc/40/39/99/1059403999.db2.gz ACWKYCNLWFBXJC-LLVKDONJSA-N 1 2 322.271 4.457 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1noc2c1CC(C)(C)CC2 ZINC001559576150 1059409532 /nfs/dbraw/zinc/40/95/32/1059409532.db2.gz UBZZZFPTJPZCMZ-AWEZNQCLSA-N 1 2 310.441 4.136 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1noc2c1CC(C)(C)CC2 ZINC001559576150 1059409537 /nfs/dbraw/zinc/40/95/37/1059409537.db2.gz UBZZZFPTJPZCMZ-AWEZNQCLSA-N 1 2 310.441 4.136 20 0 DIADLO CC1(C)C[N@H+](Cc2c(F)cccc2Br)C1(C)C ZINC001559581418 1059415107 /nfs/dbraw/zinc/41/51/07/1059415107.db2.gz HAQSJNDNEMVUDE-UHFFFAOYSA-N 1 2 300.215 4.209 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(F)cccc2Br)C1(C)C ZINC001559581418 1059415109 /nfs/dbraw/zinc/41/51/09/1059415109.db2.gz HAQSJNDNEMVUDE-UHFFFAOYSA-N 1 2 300.215 4.209 20 0 DIADLO CC1(C)CO[C@H](C[N@@H+]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001559590284 1059425529 /nfs/dbraw/zinc/42/55/29/1059425529.db2.gz JVNTZDOUYKFRPZ-ZDUSSCGKSA-N 1 2 314.256 4.167 20 0 DIADLO CC1(C)CO[C@H](C[N@H+]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001559590284 1059425535 /nfs/dbraw/zinc/42/55/35/1059425535.db2.gz JVNTZDOUYKFRPZ-ZDUSSCGKSA-N 1 2 314.256 4.167 20 0 DIADLO CC1(C)CC[C@H](C[N@@H+]2CCc3cc(Cl)cc(Cl)c3C2)O1 ZINC001559590126 1059425615 /nfs/dbraw/zinc/42/56/15/1059425615.db2.gz IHNYRLVGFMKCGV-CYBMUJFWSA-N 1 2 314.256 4.309 20 0 DIADLO CC1(C)CC[C@H](C[N@H+]2CCc3cc(Cl)cc(Cl)c3C2)O1 ZINC001559590126 1059425618 /nfs/dbraw/zinc/42/56/18/1059425618.db2.gz IHNYRLVGFMKCGV-CYBMUJFWSA-N 1 2 314.256 4.309 20 0 DIADLO CCOC(=O)CC(C)(C)CC[N@H+](CC)c1cc(C)cc(C)c1 ZINC001559604677 1059437910 /nfs/dbraw/zinc/43/79/10/1059437910.db2.gz NPPYIGRLYBMVDK-UHFFFAOYSA-N 1 2 305.462 4.499 20 0 DIADLO CCOC(=O)CC(C)(C)CC[N@@H+](CC)c1cc(C)cc(C)c1 ZINC001559604677 1059437913 /nfs/dbraw/zinc/43/79/13/1059437913.db2.gz NPPYIGRLYBMVDK-UHFFFAOYSA-N 1 2 305.462 4.499 20 0 DIADLO CCN(Cc1[nH+]cc(C)c(OC)c1C)c1cccc(Cl)c1 ZINC001559605216 1059440152 /nfs/dbraw/zinc/44/01/52/1059440152.db2.gz IFPNYENFKJUDGL-UHFFFAOYSA-N 1 2 304.821 4.387 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@H+]1Cc1cc(F)ccc1Cl ZINC001559623090 1059452085 /nfs/dbraw/zinc/45/20/85/1059452085.db2.gz HROAPAMLYADNPJ-LBPRGKRZSA-N 1 2 305.780 4.435 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1cc(F)ccc1Cl ZINC001559623090 1059452095 /nfs/dbraw/zinc/45/20/95/1059452095.db2.gz HROAPAMLYADNPJ-LBPRGKRZSA-N 1 2 305.780 4.435 20 0 DIADLO OC[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(Cl)cc(Cl)c1 ZINC001559624698 1059452560 /nfs/dbraw/zinc/45/25/60/1059452560.db2.gz SNOPJKMGUSQJSV-QGZVFWFLSA-N 1 2 322.235 4.085 20 0 DIADLO OC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc(Cl)cc(Cl)c1 ZINC001559624698 1059452571 /nfs/dbraw/zinc/45/25/71/1059452571.db2.gz SNOPJKMGUSQJSV-QGZVFWFLSA-N 1 2 322.235 4.085 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1C[C@@H](C)CC(C)(C)C1 ZINC001559675257 1059501270 /nfs/dbraw/zinc/50/12/70/1059501270.db2.gz DOWZLANODGRSCA-XJKSGUPXSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1C[C@@H](C)CC(C)(C)C1 ZINC001559675257 1059501289 /nfs/dbraw/zinc/50/12/89/1059501289.db2.gz DOWZLANODGRSCA-XJKSGUPXSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1C[C@H](C)CC(C)(C)C1 ZINC001559675256 1059503664 /nfs/dbraw/zinc/50/36/64/1059503664.db2.gz DOWZLANODGRSCA-CZUORRHYSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1C[C@H](C)CC(C)(C)C1 ZINC001559675256 1059503685 /nfs/dbraw/zinc/50/36/85/1059503685.db2.gz DOWZLANODGRSCA-CZUORRHYSA-N 1 2 323.864 4.312 20 0 DIADLO [NH3+][C@@H](c1nc(-c2cccc(Cl)c2Cl)no1)c1ccccc1 ZINC001247651683 1059584977 /nfs/dbraw/zinc/58/49/77/1059584977.db2.gz PAALFYLBZSIZIJ-CYBMUJFWSA-N 1 2 320.179 4.092 20 0 DIADLO CC(C)Cc1ccccc1C[N@@H+]1C[C@@H](C(F)(F)F)OC[C@H]1C ZINC001559825076 1059658605 /nfs/dbraw/zinc/65/86/05/1059658605.db2.gz DHRMGGJSUULJMK-CJNGLKHVSA-N 1 2 315.379 4.037 20 0 DIADLO CC(C)Cc1ccccc1C[N@H+]1C[C@@H](C(F)(F)F)OC[C@H]1C ZINC001559825076 1059658614 /nfs/dbraw/zinc/65/86/14/1059658614.db2.gz DHRMGGJSUULJMK-CJNGLKHVSA-N 1 2 315.379 4.037 20 0 DIADLO Cc1ccc(F)cc1C[N@@H+]1CCCn2c(cc3ccccc32)C1 ZINC001559875074 1059692433 /nfs/dbraw/zinc/69/24/33/1059692433.db2.gz KVIDAGLYJLCLAW-UHFFFAOYSA-N 1 2 308.400 4.495 20 0 DIADLO Cc1ccc(F)cc1C[N@H+]1CCCn2c(cc3ccccc32)C1 ZINC001559875074 1059692438 /nfs/dbraw/zinc/69/24/38/1059692438.db2.gz KVIDAGLYJLCLAW-UHFFFAOYSA-N 1 2 308.400 4.495 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2nc3ccc(C)cc3[nH]2)cc1 ZINC001559877465 1059695799 /nfs/dbraw/zinc/69/57/99/1059695799.db2.gz ZXFLAGZCNMCXMF-IBGZPJMESA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2nc3ccc(C)cc3[nH]2)cc1 ZINC001559877465 1059695815 /nfs/dbraw/zinc/69/58/15/1059695815.db2.gz ZXFLAGZCNMCXMF-IBGZPJMESA-N 1 2 321.424 4.217 20 0 DIADLO Cc1cc(C)cc(-c2noc([C@@H]3Cc4ccccc4C[N@H+]3C)n2)c1 ZINC001248121503 1059735628 /nfs/dbraw/zinc/73/56/28/1059735628.db2.gz ZOZIISOMIMBCBZ-SFHVURJKSA-N 1 2 319.408 4.083 20 0 DIADLO Cc1cc(C)cc(-c2noc([C@@H]3Cc4ccccc4C[N@@H+]3C)n2)c1 ZINC001248121503 1059735655 /nfs/dbraw/zinc/73/56/55/1059735655.db2.gz ZOZIISOMIMBCBZ-SFHVURJKSA-N 1 2 319.408 4.083 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2)[C@@H]1C(=O)OC(C)(C)C ZINC001559929601 1059740585 /nfs/dbraw/zinc/74/05/85/1059740585.db2.gz OJHSKCWCSGZEDN-CJNGLKHVSA-N 1 2 323.864 4.282 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2)[C@@H]1C(=O)OC(C)(C)C ZINC001559929601 1059740605 /nfs/dbraw/zinc/74/06/05/1059740605.db2.gz OJHSKCWCSGZEDN-CJNGLKHVSA-N 1 2 323.864 4.282 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2)[C@H]1C(=O)OC(C)(C)C ZINC001559929602 1059742205 /nfs/dbraw/zinc/74/22/05/1059742205.db2.gz OJHSKCWCSGZEDN-CZUORRHYSA-N 1 2 323.864 4.282 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2)[C@H]1C(=O)OC(C)(C)C ZINC001559929602 1059742217 /nfs/dbraw/zinc/74/22/17/1059742217.db2.gz OJHSKCWCSGZEDN-CZUORRHYSA-N 1 2 323.864 4.282 20 0 DIADLO Clc1ccnc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c1Cl ZINC001559942720 1059759119 /nfs/dbraw/zinc/75/91/19/1059759119.db2.gz MJIPRRAFVNPOBX-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccnc(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c1Cl ZINC001559942720 1059759137 /nfs/dbraw/zinc/75/91/37/1059759137.db2.gz MJIPRRAFVNPOBX-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@H+](C)C/C=C/c1ccc(Cl)cc1 ZINC001559960117 1059767397 /nfs/dbraw/zinc/76/73/97/1059767397.db2.gz KPHQJEZKRJTJSK-WAVCKPEOSA-N 1 2 323.864 4.405 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)C/C=C/c1ccc(Cl)cc1 ZINC001559960117 1059767410 /nfs/dbraw/zinc/76/74/10/1059767410.db2.gz KPHQJEZKRJTJSK-WAVCKPEOSA-N 1 2 323.864 4.405 20 0 DIADLO CC(C)c1nsc(C[NH+]2CCC(C3CCCCC3)CC2)n1 ZINC001559974007 1059781003 /nfs/dbraw/zinc/78/10/03/1059781003.db2.gz PKSBXEHRAUIIKD-UHFFFAOYSA-N 1 2 307.507 4.454 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1C)[C@H](C)C(=O)OC(C)(C)C ZINC001559993728 1059802365 /nfs/dbraw/zinc/80/23/65/1059802365.db2.gz GRBDYLUMOCNEOZ-CYBMUJFWSA-N 1 2 311.853 4.201 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)cc1C)[C@H](C)C(=O)OC(C)(C)C ZINC001559993728 1059802379 /nfs/dbraw/zinc/80/23/79/1059802379.db2.gz GRBDYLUMOCNEOZ-CYBMUJFWSA-N 1 2 311.853 4.201 20 0 DIADLO Cc1nnc(C[N@@H+](C)Cc2c(C)ccc3cc(C)ccc32)s1 ZINC001560020871 1059832940 /nfs/dbraw/zinc/83/29/40/1059832940.db2.gz PHHHABYRTGFGMA-UHFFFAOYSA-N 1 2 311.454 4.249 20 0 DIADLO Cc1nnc(C[N@H+](C)Cc2c(C)ccc3cc(C)ccc32)s1 ZINC001560020871 1059832962 /nfs/dbraw/zinc/83/29/62/1059832962.db2.gz PHHHABYRTGFGMA-UHFFFAOYSA-N 1 2 311.454 4.249 20 0 DIADLO CCc1ccc2ccccc2c1C[N@H+](C)Cc1nnc(C)s1 ZINC001560020958 1059833350 /nfs/dbraw/zinc/83/33/50/1059833350.db2.gz RTQOYNSISVJMLZ-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO CCc1ccc2ccccc2c1C[N@@H+](C)Cc1nnc(C)s1 ZINC001560020958 1059833369 /nfs/dbraw/zinc/83/33/69/1059833369.db2.gz RTQOYNSISVJMLZ-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO C[N@H+](Cc1cc(Cl)cn2ccnc12)Cc1ccccc1Cl ZINC001248447431 1059839988 /nfs/dbraw/zinc/83/99/88/1059839988.db2.gz NEJARLOXLNAZPB-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1cc(Cl)cn2ccnc12)Cc1ccccc1Cl ZINC001248447431 1059840012 /nfs/dbraw/zinc/84/00/12/1059840012.db2.gz NEJARLOXLNAZPB-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO CC/C=C\CC[NH2+][C@@H](Cc1ccccc1)C(=O)OC1CCCC1 ZINC001560051452 1059866849 /nfs/dbraw/zinc/86/68/49/1059866849.db2.gz DAPTYPYOLFNRDT-LLHWWHOWSA-N 1 2 315.457 4.029 20 0 DIADLO CC/C=C/CC[NH2+][C@@H](Cc1ccccc1)C(=O)OC1CCCC1 ZINC001560051453 1059868950 /nfs/dbraw/zinc/86/89/50/1059868950.db2.gz DAPTYPYOLFNRDT-RTLBZRNLSA-N 1 2 315.457 4.029 20 0 DIADLO CC(C)(C)OC(=O)C(C)(C)[NH2+]CCCSCc1ccccc1 ZINC001560061129 1059875944 /nfs/dbraw/zinc/87/59/44/1059875944.db2.gz FGRDSNKGLSXRFO-UHFFFAOYSA-N 1 2 323.502 4.020 20 0 DIADLO CC(=O)OCc1cc(Nc2[nH+]ccc3ccccc32)ccc1C ZINC001248561382 1059885059 /nfs/dbraw/zinc/88/50/59/1059885059.db2.gz PNJIKNOCSPKVNQ-UHFFFAOYSA-N 1 2 306.365 4.350 20 0 DIADLO CC(=O)OCc1cc(Nc2cccc(C3CCC3)[nH+]2)ccc1C ZINC001248572924 1059894876 /nfs/dbraw/zinc/89/48/76/1059894876.db2.gz BZJWSDKUOLWSOD-UHFFFAOYSA-N 1 2 310.397 4.464 20 0 DIADLO Cc1cccc(Br)c1C[N@@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001248603295 1059909802 /nfs/dbraw/zinc/90/98/02/1059909802.db2.gz GUHADJPOQQSDLY-ZIAGYGMSSA-N 1 2 318.205 4.030 20 0 DIADLO Cc1cccc(Br)c1C[N@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001248603295 1059909823 /nfs/dbraw/zinc/90/98/23/1059909823.db2.gz GUHADJPOQQSDLY-ZIAGYGMSSA-N 1 2 318.205 4.030 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+]1CCc2cc(F)c(F)cc2C1 ZINC001560104767 1059911115 /nfs/dbraw/zinc/91/11/15/1059911115.db2.gz FNKAZDZQCRWXFR-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+]1CCc2cc(F)c(F)cc2C1 ZINC001560104767 1059911126 /nfs/dbraw/zinc/91/11/26/1059911126.db2.gz FNKAZDZQCRWXFR-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO COc1c(C[N@@H+]2CCC[C@@H](C(F)F)C2)ccc(Cl)c1Cl ZINC001248642166 1059921937 /nfs/dbraw/zinc/92/19/37/1059921937.db2.gz ZBODEQHNQNJHNX-SNVBAGLBSA-N 1 2 324.198 4.479 20 0 DIADLO COc1c(C[N@H+]2CCC[C@@H](C(F)F)C2)ccc(Cl)c1Cl ZINC001248642166 1059921961 /nfs/dbraw/zinc/92/19/61/1059921961.db2.gz ZBODEQHNQNJHNX-SNVBAGLBSA-N 1 2 324.198 4.479 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+]1CCCC[C@@H]1c1ncccn1 ZINC001560114990 1059921912 /nfs/dbraw/zinc/92/19/12/1059921912.db2.gz JVMNKMVVLJWEJM-MRXNPFEDSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+]1CCCC[C@@H]1c1ncccn1 ZINC001560114990 1059921936 /nfs/dbraw/zinc/92/19/36/1059921936.db2.gz JVMNKMVVLJWEJM-MRXNPFEDSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3ccsc3[C@@H]2C)nc2ccccc12 ZINC001560113014 1059922894 /nfs/dbraw/zinc/92/28/94/1059922894.db2.gz VSXXUFRYZMHQCM-ZDUSSCGKSA-N 1 2 309.438 4.119 20 0 DIADLO Cc1nc(C[N@H+]2CCc3ccsc3[C@@H]2C)nc2ccccc12 ZINC001560113014 1059922919 /nfs/dbraw/zinc/92/29/19/1059922919.db2.gz VSXXUFRYZMHQCM-ZDUSSCGKSA-N 1 2 309.438 4.119 20 0 DIADLO Clc1cccc(C[N@@H+]2Cc3ccccc3OC3(CCC3)C2)n1 ZINC001560135606 1059938682 /nfs/dbraw/zinc/93/86/82/1059938682.db2.gz VHNAZBNKIDCBJW-UHFFFAOYSA-N 1 2 314.816 4.052 20 0 DIADLO Clc1cccc(C[N@H+]2Cc3ccccc3OC3(CCC3)C2)n1 ZINC001560135606 1059938699 /nfs/dbraw/zinc/93/86/99/1059938699.db2.gz VHNAZBNKIDCBJW-UHFFFAOYSA-N 1 2 314.816 4.052 20 0 DIADLO CCc1cccc(C)c1NC(=S)Nc1ccc2[nH+]c(C)cn2c1 ZINC001248730259 1059958142 /nfs/dbraw/zinc/95/81/42/1059958142.db2.gz ICRZHJYHQUIMNZ-UHFFFAOYSA-N 1 2 324.453 4.322 20 0 DIADLO CCn1c[nH+]c2c1CCN([C@@H](C)c1ccc(Cl)cc1Cl)C2 ZINC001560169055 1059961783 /nfs/dbraw/zinc/96/17/83/1059961783.db2.gz XTPPACVWTKSJTE-NSHDSACASA-N 1 2 324.255 4.329 20 0 DIADLO CC(C)C[C@H](C)C[NH2+][C@@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001560179587 1059966683 /nfs/dbraw/zinc/96/66/83/1059966683.db2.gz PQDXSCDRMNIPRO-WMZOPIPTSA-N 1 2 319.489 4.211 20 0 DIADLO Cc1cccc2c(C(=O)Nc3ccc(-n4cc[nH+]c4)cc3)coc21 ZINC001525657545 1059976529 /nfs/dbraw/zinc/97/65/29/1059976529.db2.gz IGTYYWHXWVZHQQ-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO CC1(C)C2CCC1(C(=O)Nc1ccc(-n3cc[nH+]c3)cc1)CC2 ZINC001525657431 1059977320 /nfs/dbraw/zinc/97/73/20/1059977320.db2.gz DTZVYWKQISYYIF-UHFFFAOYSA-N 1 2 309.413 4.027 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccccc2F)c(OC)c1Cl ZINC001248798807 1059980338 /nfs/dbraw/zinc/98/03/38/1059980338.db2.gz FJBYUSFAVJHATF-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccccc2F)c(OC)c1Cl ZINC001248798807 1059980361 /nfs/dbraw/zinc/98/03/61/1059980361.db2.gz FJBYUSFAVJHATF-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1nccc(Cl)c1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001248794424 1059981017 /nfs/dbraw/zinc/98/10/17/1059981017.db2.gz OCOQWUJCXRJXSR-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(Cl)c1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001248794424 1059981040 /nfs/dbraw/zinc/98/10/40/1059981040.db2.gz OCOQWUJCXRJXSR-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ncc(C(F)(F)F)cc1F ZINC001248790084 1059981342 /nfs/dbraw/zinc/98/13/42/1059981342.db2.gz AONJCUITZNZXBS-NSHDSACASA-N 1 2 324.321 4.186 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ncc(C(F)(F)F)cc1F ZINC001248790084 1059981362 /nfs/dbraw/zinc/98/13/62/1059981362.db2.gz AONJCUITZNZXBS-NSHDSACASA-N 1 2 324.321 4.186 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c(OC)c1Cl ZINC001248799566 1059982073 /nfs/dbraw/zinc/98/20/73/1059982073.db2.gz JMKLUFHDUQADCZ-OAHLLOKOSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)c(OC)c1Cl ZINC001248799566 1059982100 /nfs/dbraw/zinc/98/21/00/1059982100.db2.gz JMKLUFHDUQADCZ-OAHLLOKOSA-N 1 2 317.816 4.304 20 0 DIADLO COc1nccc(Cl)c1C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC001248794599 1059982284 /nfs/dbraw/zinc/98/22/84/1059982284.db2.gz USRKCYGYWQOOTD-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO COc1nccc(Cl)c1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC001248794599 1059982307 /nfs/dbraw/zinc/98/23/07/1059982307.db2.gz USRKCYGYWQOOTD-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO CC[C@H](c1ccc(Br)cc1)[N@@H+]1CCC[C@@H](F)C1 ZINC001560205181 1059985261 /nfs/dbraw/zinc/98/52/61/1059985261.db2.gz NYGMNANRFLZGGR-ZIAGYGMSSA-N 1 2 300.215 4.334 20 0 DIADLO CC[C@H](c1ccc(Br)cc1)[N@H+]1CCC[C@@H](F)C1 ZINC001560205181 1059985284 /nfs/dbraw/zinc/98/52/84/1059985284.db2.gz NYGMNANRFLZGGR-ZIAGYGMSSA-N 1 2 300.215 4.334 20 0 DIADLO Clc1c(C[N@@H+]2CCC[C@H]2c2cnccn2)cnc2ccccc12 ZINC001248813489 1059994285 /nfs/dbraw/zinc/99/42/85/1059994285.db2.gz ZDYDWPVUUTVERY-KRWDZBQOSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1c(C[N@H+]2CCC[C@H]2c2cnccn2)cnc2ccccc12 ZINC001248813489 1059994304 /nfs/dbraw/zinc/99/43/04/1059994304.db2.gz ZDYDWPVUUTVERY-KRWDZBQOSA-N 1 2 324.815 4.015 20 0 DIADLO C[C@@H]1Cc2cc(Cl)ccc2N1Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001560238928 1060005921 /nfs/dbraw/zinc/00/59/21/1060005921.db2.gz ALZWIRZYAPALQI-CQSZACIVSA-N 1 2 323.827 4.477 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CCC[C@@H]3c3ccc(F)cc3)nc2c1 ZINC001248839522 1060014185 /nfs/dbraw/zinc/01/41/85/1060014185.db2.gz MLJUQEMAJFHJAM-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CCC[C@@H]3c3ccc(F)cc3)nc2c1 ZINC001248839522 1060014201 /nfs/dbraw/zinc/01/42/01/1060014201.db2.gz MLJUQEMAJFHJAM-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CCC[C@@H]3c3ccc(F)cc3)[nH]c2c1 ZINC001248839522 1060014223 /nfs/dbraw/zinc/01/42/23/1060014223.db2.gz MLJUQEMAJFHJAM-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CCC[C@@H]3c3ccc(F)cc3)[nH]c2c1 ZINC001248839522 1060014244 /nfs/dbraw/zinc/01/42/44/1060014244.db2.gz MLJUQEMAJFHJAM-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2nc3ccc(C)cc3[nH]2)c1 ZINC001248843103 1060015983 /nfs/dbraw/zinc/01/59/83/1060015983.db2.gz XRKCKJFLGTYRCO-IBGZPJMESA-N 1 2 321.424 4.217 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2nc3ccc(C)cc3[nH]2)c1 ZINC001248843103 1060016006 /nfs/dbraw/zinc/01/60/06/1060016006.db2.gz XRKCKJFLGTYRCO-IBGZPJMESA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1nc2cc(C)ccc2[nH]1 ZINC001248842554 1060017586 /nfs/dbraw/zinc/01/75/86/1060017586.db2.gz ZMXJCTMCNJKXTB-GOSISDBHSA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1nc2cc(C)ccc2[nH]1 ZINC001248842554 1060017607 /nfs/dbraw/zinc/01/76/07/1060017607.db2.gz ZMXJCTMCNJKXTB-GOSISDBHSA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1nc2ccc(C)cc2[nH]1 ZINC001248842554 1060017633 /nfs/dbraw/zinc/01/76/33/1060017633.db2.gz ZMXJCTMCNJKXTB-GOSISDBHSA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1nc2ccc(C)cc2[nH]1 ZINC001248842554 1060017658 /nfs/dbraw/zinc/01/76/58/1060017658.db2.gz ZMXJCTMCNJKXTB-GOSISDBHSA-N 1 2 321.424 4.217 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CCC[C@H]3c3ccc(F)cc3)nc2c1 ZINC001248839523 1060018281 /nfs/dbraw/zinc/01/82/81/1060018281.db2.gz MLJUQEMAJFHJAM-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CCC[C@H]3c3ccc(F)cc3)nc2c1 ZINC001248839523 1060018301 /nfs/dbraw/zinc/01/83/01/1060018301.db2.gz MLJUQEMAJFHJAM-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CCC[C@H]3c3ccc(F)cc3)[nH]c2c1 ZINC001248839523 1060018323 /nfs/dbraw/zinc/01/83/23/1060018323.db2.gz MLJUQEMAJFHJAM-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CCC[C@H]3c3ccc(F)cc3)[nH]c2c1 ZINC001248839523 1060018345 /nfs/dbraw/zinc/01/83/45/1060018345.db2.gz MLJUQEMAJFHJAM-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1cc(CNC(=O)CCc2ccc(C(C)(C)C)cc2)cc(C)[nH+]1 ZINC001525865498 1060058671 /nfs/dbraw/zinc/05/86/71/1060058671.db2.gz RIYDOIFDNVPNQZ-UHFFFAOYSA-N 1 2 324.468 4.245 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](COCC(C)C)c2ccco2)c(F)c1 ZINC001560304875 1060090845 /nfs/dbraw/zinc/09/08/45/1060090845.db2.gz GJLJTNAHLHGCGS-KRWDZBQOSA-N 1 2 305.393 4.231 20 0 DIADLO Cc1cc(C)nc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)n1 ZINC001248966980 1060096020 /nfs/dbraw/zinc/09/60/20/1060096020.db2.gz YAMKJCTVIHBJDD-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C)nc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)n1 ZINC001248966980 1060095996 /nfs/dbraw/zinc/09/59/96/1060095996.db2.gz YAMKJCTVIHBJDD-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc(-c2noc([C@H]([NH3+])c3ccc(Cl)cc3)n2)cc1C ZINC001248998391 1060106998 /nfs/dbraw/zinc/10/69/98/1060106998.db2.gz XTCRKHLQUSKYGK-OAHLLOKOSA-N 1 2 313.788 4.055 20 0 DIADLO COc1ccc(NCc2cc(C)[nH+]c(C)c2)cc1Br ZINC001560327672 1060115080 /nfs/dbraw/zinc/11/50/80/1060115080.db2.gz QZHIACHTVALPPZ-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO COc1ccccc1Oc1ccc(C[NH2+]Cc2ncc(C)o2)cc1 ZINC001560336956 1060123641 /nfs/dbraw/zinc/12/36/41/1060123641.db2.gz LEHLHIXLNZEOET-UHFFFAOYSA-N 1 2 324.380 4.074 20 0 DIADLO Clc1sc(C[N@@H+]2CCCCC23COC3)c2ccccc12 ZINC001249068123 1060143105 /nfs/dbraw/zinc/14/31/05/1060143105.db2.gz RPRJEXAGLYQBJM-UHFFFAOYSA-N 1 2 307.846 4.310 20 0 DIADLO Clc1sc(C[N@H+]2CCCCC23COC3)c2ccccc12 ZINC001249068123 1060143109 /nfs/dbraw/zinc/14/31/09/1060143109.db2.gz RPRJEXAGLYQBJM-UHFFFAOYSA-N 1 2 307.846 4.310 20 0 DIADLO CC(C)CCCCC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001526169230 1060151012 /nfs/dbraw/zinc/15/10/12/1060151012.db2.gz YLNCFTWOVUGBAV-UHFFFAOYSA-N 1 2 303.381 4.166 20 0 DIADLO c1cn2c(cccc2CNc2ccccc2N2CCCCCC2)[nH+]1 ZINC001560380455 1060166874 /nfs/dbraw/zinc/16/68/74/1060166874.db2.gz JHXYJMJKELRYAJ-UHFFFAOYSA-N 1 2 320.440 4.327 20 0 DIADLO Cc1nn(-c2ccc(C)cc2)cc1CNc1ccc([NH+](C)C)cc1 ZINC001560391103 1060175784 /nfs/dbraw/zinc/17/57/84/1060175784.db2.gz OKGGDBXBDGXZMJ-UHFFFAOYSA-N 1 2 320.440 4.167 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccc3c(c2)CCC(C)(C)O3)cc1 ZINC001560391087 1060176277 /nfs/dbraw/zinc/17/62/77/1060176277.db2.gz NMXQCSMKQQLBPD-UHFFFAOYSA-N 1 2 310.441 4.468 20 0 DIADLO COc1ccc(F)cc1NCc1cc(C)[nH+]c2c1CCCC2 ZINC001560399666 1060185342 /nfs/dbraw/zinc/18/53/42/1060185342.db2.gz WDURZCREHDNXHL-UHFFFAOYSA-N 1 2 300.377 4.029 20 0 DIADLO Cc1scc(CNc2ccc(N3CCCCC3)[nH+]c2)c1C ZINC001560407069 1060192914 /nfs/dbraw/zinc/19/29/14/1060192914.db2.gz DHHJLWDFZAOBBV-UHFFFAOYSA-N 1 2 301.459 4.362 20 0 DIADLO CCCc1c(NCc2c[nH+]cn2CCC)cnn1-c1ccccc1 ZINC001560412709 1060197555 /nfs/dbraw/zinc/19/75/55/1060197555.db2.gz GNXJKOXHDFKFBV-UHFFFAOYSA-N 1 2 323.444 4.043 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N[C@H](C)c3cccc(C4CC4)c3)ccn12 ZINC001534263878 1060199803 /nfs/dbraw/zinc/19/98/03/1060199803.db2.gz FNMRBWQDIYQRFL-CQSZACIVSA-N 1 2 319.408 4.011 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2cccc(F)c2)c2ccccn2)cs1 ZINC001560423497 1060209632 /nfs/dbraw/zinc/20/96/32/1060209632.db2.gz LTWVLDGKDIFWOU-GOSISDBHSA-N 1 2 312.413 4.470 20 0 DIADLO C/C(=C\C(C)(C)C)C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC001526417752 1060213359 /nfs/dbraw/zinc/21/33/59/1060213359.db2.gz IBOJVNOQXISUDP-OUKQBFOZSA-N 1 2 311.429 4.232 20 0 DIADLO Cc1ccccc1-c1noc([C@@H]([NH3+])c2ccc3ccccc3c2)n1 ZINC001249326042 1060218691 /nfs/dbraw/zinc/21/86/91/1060218691.db2.gz UJPSJCDHEUNKEI-SFHVURJKSA-N 1 2 315.376 4.246 20 0 DIADLO Clc1sc(Br)cc1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC001249380922 1060231799 /nfs/dbraw/zinc/23/17/99/1060231799.db2.gz DGHXELIDVNLBIG-IONNQARKSA-N 1 2 306.656 4.148 20 0 DIADLO Clc1sc(Br)cc1C[N@H+]1C[C@H]2CC[C@@H]1C2 ZINC001249380922 1060231814 /nfs/dbraw/zinc/23/18/14/1060231814.db2.gz DGHXELIDVNLBIG-IONNQARKSA-N 1 2 306.656 4.148 20 0 DIADLO COc1ccc2nc(C[NH+]3CCC4(CCCCC4)CC3)[nH]c2c1 ZINC001249411657 1060240535 /nfs/dbraw/zinc/24/05/35/1060240535.db2.gz FHFNOTSRGLIRJI-UHFFFAOYSA-N 1 2 313.445 4.118 20 0 DIADLO CC[C@@H](C)c1nn(C)cc1C[N@H+](CC)Cc1cccc(F)c1F ZINC001249410587 1060242349 /nfs/dbraw/zinc/24/23/49/1060242349.db2.gz ZIUHUNNZYWWGJC-CYBMUJFWSA-N 1 2 321.415 4.234 20 0 DIADLO CC[C@@H](C)c1nn(C)cc1C[N@@H+](CC)Cc1cccc(F)c1F ZINC001249410587 1060242368 /nfs/dbraw/zinc/24/23/68/1060242368.db2.gz ZIUHUNNZYWWGJC-CYBMUJFWSA-N 1 2 321.415 4.234 20 0 DIADLO CCSc1ccccc1C[N@@H+]1CCc2nc(Cl)ccc2C1 ZINC001249439779 1060250481 /nfs/dbraw/zinc/25/04/81/1060250481.db2.gz HCMIGJBIUXFSMV-UHFFFAOYSA-N 1 2 318.873 4.405 20 0 DIADLO CCSc1ccccc1C[N@H+]1CCc2nc(Cl)ccc2C1 ZINC001249439779 1060250495 /nfs/dbraw/zinc/25/04/95/1060250495.db2.gz HCMIGJBIUXFSMV-UHFFFAOYSA-N 1 2 318.873 4.405 20 0 DIADLO CCCn1c[nH+]cc1CNc1cnn(CCC(C)C)c1C(C)C ZINC001560463684 1060255705 /nfs/dbraw/zinc/25/57/05/1060255705.db2.gz AJSDMOHYUZMIEA-UHFFFAOYSA-N 1 2 317.481 4.271 20 0 DIADLO Fc1ccccc1[C@H]1CCC[N@@H+]1Cc1nc(C2CC2)cs1 ZINC001249528967 1060274969 /nfs/dbraw/zinc/27/49/69/1060274969.db2.gz KRFRZNCPDHBUJJ-MRXNPFEDSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1ccccc1[C@H]1CCC[N@H+]1Cc1nc(C2CC2)cs1 ZINC001249528967 1060274988 /nfs/dbraw/zinc/27/49/88/1060274988.db2.gz KRFRZNCPDHBUJJ-MRXNPFEDSA-N 1 2 302.418 4.497 20 0 DIADLO COc1cc2ccccc2cc1-n1c(C)[nH+]c2ccc(N)cc21 ZINC001249551165 1060287993 /nfs/dbraw/zinc/28/79/93/1060287993.db2.gz WPJULWDULJPTHS-UHFFFAOYSA-N 1 2 303.365 4.078 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC001534712550 1060346807 /nfs/dbraw/zinc/34/68/07/1060346807.db2.gz MIBRMXXVTIVTRM-RBUKOAKNSA-N 1 2 316.404 4.016 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC001534712548 1060347676 /nfs/dbraw/zinc/34/76/76/1060347676.db2.gz MIBRMXXVTIVTRM-MOPGFXCFSA-N 1 2 316.404 4.016 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[NH2+]Cc1ccc(Cl)cn1 ZINC001560560547 1060369711 /nfs/dbraw/zinc/36/97/11/1060369711.db2.gz MJJMKHXCYGIKMZ-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO Cc1ccc(C2(CNC(=O)c3c(C)cc(C)[nH+]c3C)CC2)c(C)c1 ZINC001526918757 1060379615 /nfs/dbraw/zinc/37/96/15/1060379615.db2.gz NRVRULDKYCZGAJ-UHFFFAOYSA-N 1 2 322.452 4.085 20 0 DIADLO Oc1cccc(CNc2[nH+]c3ccccc3n2C2CC2)c1Cl ZINC001560576163 1060388713 /nfs/dbraw/zinc/38/87/13/1060388713.db2.gz XVZVIUSNQPYHJI-UHFFFAOYSA-N 1 2 313.788 4.342 20 0 DIADLO CC(C)CCn1c2ccccc2[nH+]c1NCc1cn(C2CC2)cn1 ZINC001560575267 1060389431 /nfs/dbraw/zinc/38/94/31/1060389431.db2.gz CJFQKIUMOXLIJT-UHFFFAOYSA-N 1 2 323.444 4.226 20 0 DIADLO CCc1cccc(Cl)c1CNc1[nH]c2cccc(OC)c2[nH+]1 ZINC001560576813 1060391338 /nfs/dbraw/zinc/39/13/38/1060391338.db2.gz KVZUJPXWPGVTTC-UHFFFAOYSA-N 1 2 315.804 4.399 20 0 DIADLO Clc1ccc2[nH]c(NCc3ccc(-n4cccn4)cc3)[nH+]c2c1 ZINC001560578963 1060395404 /nfs/dbraw/zinc/39/54/04/1060395404.db2.gz PYQXJXNGDAQMSY-UHFFFAOYSA-N 1 2 323.787 4.014 20 0 DIADLO Fc1ccc(/C=C\C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)c(F)c1 ZINC001560588472 1060400210 /nfs/dbraw/zinc/40/02/10/1060400210.db2.gz XSBAEJNAQVMDAS-MUURBNQUSA-N 1 2 319.326 4.039 20 0 DIADLO COc1ccc(CNc2ccc3[nH+]c(C)cc(C)c3c2)c(OC)c1 ZINC001560590112 1060402518 /nfs/dbraw/zinc/40/25/18/1060402518.db2.gz MWIRSAXUHQJIOF-UHFFFAOYSA-N 1 2 322.408 4.481 20 0 DIADLO COc1cc(C[N@H+](C)Cc2cccs2)c(F)c(F)c1Cl ZINC001249796311 1060404673 /nfs/dbraw/zinc/40/46/73/1060404673.db2.gz HGUXXVXJEUOWMU-UHFFFAOYSA-N 1 2 317.788 4.320 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2cccs2)c(F)c(F)c1Cl ZINC001249796311 1060404682 /nfs/dbraw/zinc/40/46/82/1060404682.db2.gz HGUXXVXJEUOWMU-UHFFFAOYSA-N 1 2 317.788 4.320 20 0 DIADLO CC(C)([NH2+]Cc1nc2cc(F)ccc2o1)c1ccc(F)cc1F ZINC001560591394 1060405269 /nfs/dbraw/zinc/40/52/69/1060405269.db2.gz AAMUHJIJHWQHOC-UHFFFAOYSA-N 1 2 320.314 4.270 20 0 DIADLO COC(=O)c1cc(Nc2cccc(-n3cc[nH+]c3)c2)c(C)cc1C ZINC001249813660 1060412894 /nfs/dbraw/zinc/41/28/94/1060412894.db2.gz SDSHLLOZWXGAJP-UHFFFAOYSA-N 1 2 321.380 4.019 20 0 DIADLO Cc1cc(CNc2ccc3c(c2)C[C@H](C)O3)c2c([nH+]1)CCCC2 ZINC001560604864 1060419232 /nfs/dbraw/zinc/41/92/32/1060419232.db2.gz MSNCISSFSGFJRS-AWEZNQCLSA-N 1 2 308.425 4.204 20 0 DIADLO Fc1ccc2[nH]c(Nc3cccc(Cn4cc[nH+]c4)c3)cc2c1 ZINC001249854131 1060423273 /nfs/dbraw/zinc/42/32/73/1060423273.db2.gz AMTJTGVESBYCRN-UHFFFAOYSA-N 1 2 306.344 4.295 20 0 DIADLO COCC[N@H+](Cc1c(F)cc(C)cc1F)[C@H](C)c1ccccc1 ZINC001560641625 1060461262 /nfs/dbraw/zinc/46/12/62/1060461262.db2.gz JZAQUJBFGALYMW-OAHLLOKOSA-N 1 2 319.395 4.483 20 0 DIADLO COCC[N@@H+](Cc1c(F)cc(C)cc1F)[C@H](C)c1ccccc1 ZINC001560641625 1060461279 /nfs/dbraw/zinc/46/12/79/1060461279.db2.gz JZAQUJBFGALYMW-OAHLLOKOSA-N 1 2 319.395 4.483 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)c1ccccc1-c1ccccc1 ZINC001535108552 1060463447 /nfs/dbraw/zinc/46/34/47/1060463447.db2.gz XQDDVCCDYBDWHK-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@H+]2CCC[C@H]2C(=O)OC(C)C)c(C)c1 ZINC001560645989 1060466239 /nfs/dbraw/zinc/46/62/39/1060466239.db2.gz LNJKARMLMMTJBM-FNQPIQQGSA-N 1 2 315.457 4.041 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@@H+]2CCC[C@H]2C(=O)OC(C)C)c(C)c1 ZINC001560645989 1060466249 /nfs/dbraw/zinc/46/62/49/1060466249.db2.gz LNJKARMLMMTJBM-FNQPIQQGSA-N 1 2 315.457 4.041 20 0 DIADLO COc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)nc1C ZINC001249913706 1060476250 /nfs/dbraw/zinc/47/62/50/1060476250.db2.gz FZZDDRODRONBBX-ZDUSSCGKSA-N 1 2 304.821 4.245 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)nc1C ZINC001249913706 1060476267 /nfs/dbraw/zinc/47/62/67/1060476267.db2.gz FZZDDRODRONBBX-ZDUSSCGKSA-N 1 2 304.821 4.245 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@H+](Cc2cccc(C3CC3)c2)CCO1 ZINC001560659754 1060482554 /nfs/dbraw/zinc/48/25/54/1060482554.db2.gz SDFSBPHSKJAAOX-FQEVSTJZSA-N 1 2 311.400 4.277 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@@H+](Cc2cccc(C3CC3)c2)CCO1 ZINC001560659754 1060482564 /nfs/dbraw/zinc/48/25/64/1060482564.db2.gz SDFSBPHSKJAAOX-FQEVSTJZSA-N 1 2 311.400 4.277 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@H+]1C[C@H]2[C@H](CC2(F)F)C1 ZINC001249933047 1060488191 /nfs/dbraw/zinc/48/81/91/1060488191.db2.gz FTBAIZONEIODHC-SCZZXKLOSA-N 1 2 310.146 4.220 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@@H+]1C[C@H]2[C@H](CC2(F)F)C1 ZINC001249933047 1060488199 /nfs/dbraw/zinc/48/81/99/1060488199.db2.gz FTBAIZONEIODHC-SCZZXKLOSA-N 1 2 310.146 4.220 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H](C)c3ccc(Cl)cc3)ccc2[nH+]1 ZINC001527357405 1060498567 /nfs/dbraw/zinc/49/85/67/1060498567.db2.gz WKSHCCFWPTZRMY-LBPRGKRZSA-N 1 2 313.788 4.038 20 0 DIADLO Cc1cn2cc(NC(=O)c3cccc(OC(C)(C)C)c3)ccc2[nH+]1 ZINC001527354908 1060500012 /nfs/dbraw/zinc/50/00/12/1060500012.db2.gz DQUVIUAVTVRACV-UHFFFAOYSA-N 1 2 323.396 4.072 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H]2CCc3cc(Cl)ccc32)c(C)[nH+]1 ZINC001535256749 1060505961 /nfs/dbraw/zinc/50/59/61/1060505961.db2.gz PPOMXZFHCUEJBX-INIZCTEOSA-N 1 2 314.816 4.078 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+](Cc1cccc(F)c1)C(C)C ZINC001560678730 1060516783 /nfs/dbraw/zinc/51/67/83/1060516783.db2.gz OZYZJQKEKMZADW-UHFFFAOYSA-N 1 2 309.816 4.106 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+](Cc1cccc(F)c1)C(C)C ZINC001560678730 1060516788 /nfs/dbraw/zinc/51/67/88/1060516788.db2.gz OZYZJQKEKMZADW-UHFFFAOYSA-N 1 2 309.816 4.106 20 0 DIADLO Clc1ncc(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)c(Cl)c1Cl ZINC001250017635 1060543474 /nfs/dbraw/zinc/54/34/74/1060543474.db2.gz GIDQVNJETQHFNP-DTORHVGOSA-N 1 2 305.636 4.274 20 0 DIADLO Clc1ncc(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)c(Cl)c1Cl ZINC001250017635 1060543451 /nfs/dbraw/zinc/54/34/51/1060543451.db2.gz GIDQVNJETQHFNP-DTORHVGOSA-N 1 2 305.636 4.274 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1cccc(Br)c1)CC2 ZINC001560701396 1060557983 /nfs/dbraw/zinc/55/79/83/1060557983.db2.gz LXOVJAZVLSNCFO-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1cccc(Br)c1)CC2 ZINC001560701396 1060558000 /nfs/dbraw/zinc/55/80/00/1060558000.db2.gz LXOVJAZVLSNCFO-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCC[C@H]1c1ccccc1)C(=O)OC(C)(C)C ZINC001560712595 1060571309 /nfs/dbraw/zinc/57/13/09/1060571309.db2.gz OVKGTKKRRBAHOC-BHYGNILZSA-N 1 2 303.446 4.033 20 0 DIADLO CCOc1cc(F)c(Nc2ccc(N(C)C)[nH+]c2)cc1Cl ZINC001250062842 1060575727 /nfs/dbraw/zinc/57/57/27/1060575727.db2.gz JWCQLUNXDPKZIA-UHFFFAOYSA-N 1 2 309.772 4.082 20 0 DIADLO CCOc1cc(F)c(-n2c(C)[nH+]c3ccc(N)cc32)cc1Cl ZINC001250066818 1060578623 /nfs/dbraw/zinc/57/86/23/1060578623.db2.gz FNCRKDOFUCPLCG-UHFFFAOYSA-N 1 2 319.767 4.107 20 0 DIADLO CCOc1cc(F)c(Nc2cccn3cc[nH+]c23)cc1Cl ZINC001250068295 1060581277 /nfs/dbraw/zinc/58/12/77/1060581277.db2.gz LDNBYJCPXBVKKL-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@H]2c2cccs2)cn1 ZINC001560718882 1060581817 /nfs/dbraw/zinc/58/18/17/1060581817.db2.gz LHBMHLMBRRTPJZ-LBPRGKRZSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@H]2c2cccs2)cn1 ZINC001560718882 1060581827 /nfs/dbraw/zinc/58/18/27/1060581827.db2.gz LHBMHLMBRRTPJZ-LBPRGKRZSA-N 1 2 323.259 4.243 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+]1CCc2sccc2C1 ZINC001560726554 1060591193 /nfs/dbraw/zinc/59/11/93/1060591193.db2.gz VNXNLOMFZCXFQI-UHFFFAOYSA-N 1 2 307.846 4.359 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+]1CCc2sccc2C1 ZINC001560726554 1060591207 /nfs/dbraw/zinc/59/12/07/1060591207.db2.gz VNXNLOMFZCXFQI-UHFFFAOYSA-N 1 2 307.846 4.359 20 0 DIADLO Cc1nn(C(C)C)c(C)c1C[N@H+](C)Cc1ccccc1Cl ZINC001560727199 1060592602 /nfs/dbraw/zinc/59/26/02/1060592602.db2.gz VHMLKLOVNGGALI-UHFFFAOYSA-N 1 2 305.853 4.366 20 0 DIADLO Cc1nn(C(C)C)c(C)c1C[N@@H+](C)Cc1ccccc1Cl ZINC001560727199 1060592620 /nfs/dbraw/zinc/59/26/20/1060592620.db2.gz VHMLKLOVNGGALI-UHFFFAOYSA-N 1 2 305.853 4.366 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1CCCc1c(Cl)cccc1Cl ZINC001560726717 1060595015 /nfs/dbraw/zinc/59/50/15/1060595015.db2.gz BIFQQYJUIDJRMR-QWHCGFSZSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1CCCc1c(Cl)cccc1Cl ZINC001560726717 1060595021 /nfs/dbraw/zinc/59/50/21/1060595021.db2.gz BIFQQYJUIDJRMR-QWHCGFSZSA-N 1 2 316.272 4.425 20 0 DIADLO COC(=O)[C@H](CC1CCCCC1)[NH2+]CC[C@H](C)c1ccccc1 ZINC001560756081 1060623207 /nfs/dbraw/zinc/62/32/07/1060623207.db2.gz AADNOONHCWXVFO-LPHOPBHVSA-N 1 2 317.473 4.282 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NCc1cncc(Cl)c1Cl ZINC001560764690 1060629374 /nfs/dbraw/zinc/62/93/74/1060629374.db2.gz OBHUGSVBIDFEHW-UHFFFAOYSA-N 1 2 312.200 4.183 20 0 DIADLO CSc1cnc(F)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001250136300 1060640766 /nfs/dbraw/zinc/64/07/66/1060640766.db2.gz DPTUFDJJGXNGIW-UHFFFAOYSA-N 1 2 318.421 4.072 20 0 DIADLO Oc1cccc(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)c1Cl ZINC001560786218 1060646267 /nfs/dbraw/zinc/64/62/67/1060646267.db2.gz TVWAMVQMIDIQOF-KRWDZBQOSA-N 1 2 305.780 4.116 20 0 DIADLO Oc1cccc(C[N@H+]2CC[C@@](F)(c3ccccc3)C2)c1Cl ZINC001560786218 1060646276 /nfs/dbraw/zinc/64/62/76/1060646276.db2.gz TVWAMVQMIDIQOF-KRWDZBQOSA-N 1 2 305.780 4.116 20 0 DIADLO Cn1ncc(C[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)c1Cl ZINC001560792436 1060651702 /nfs/dbraw/zinc/65/17/02/1060651702.db2.gz JCLAJOXHRRUJDD-HNNXBMFYSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1ncc(C[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)c1Cl ZINC001560792436 1060651710 /nfs/dbraw/zinc/65/17/10/1060651710.db2.gz JCLAJOXHRRUJDD-HNNXBMFYSA-N 1 2 324.255 4.454 20 0 DIADLO CCCC[C@H](CC)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001560798285 1060658260 /nfs/dbraw/zinc/65/82/60/1060658260.db2.gz CGNNQJBUQXRRQG-JYJNAYRXSA-N 1 2 305.466 4.076 20 0 DIADLO CCOc1cc(C)ccc1C[N@@H+]1CCC[C@H]1c1nccs1 ZINC001250180873 1060661631 /nfs/dbraw/zinc/66/16/31/1060661631.db2.gz ULZGPQXTCDMXJN-HNNXBMFYSA-N 1 2 302.443 4.187 20 0 DIADLO CCOc1cc(C)ccc1C[N@H+]1CCC[C@H]1c1nccs1 ZINC001250180873 1060661640 /nfs/dbraw/zinc/66/16/40/1060661640.db2.gz ULZGPQXTCDMXJN-HNNXBMFYSA-N 1 2 302.443 4.187 20 0 DIADLO CCCC[C@H](COC)[NH2+]CC(F)(F)c1ccc(Cl)cc1 ZINC001560820665 1060679799 /nfs/dbraw/zinc/67/97/99/1060679799.db2.gz FWTOLMYBGZIDOH-CQSZACIVSA-N 1 2 305.796 4.227 20 0 DIADLO Cc1cc(CC(=O)c2ccc(OC(F)(F)F)cc2)cc(C)[nH+]1 ZINC001250199473 1060679710 /nfs/dbraw/zinc/67/97/10/1060679710.db2.gz JEKROYMXSHNOJW-UHFFFAOYSA-N 1 2 309.287 4.022 20 0 DIADLO CCCC[C@@H](COC)[NH2+]CC(F)(F)c1ccc(Cl)cc1 ZINC001560820664 1060679848 /nfs/dbraw/zinc/67/98/48/1060679848.db2.gz FWTOLMYBGZIDOH-AWEZNQCLSA-N 1 2 305.796 4.227 20 0 DIADLO Cc1cccc(C[N@@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)c1F ZINC001560847368 1060701652 /nfs/dbraw/zinc/70/16/52/1060701652.db2.gz VWIABIJDBZUJCH-QGZVFWFLSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1cccc(C[N@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)c1F ZINC001560847368 1060701665 /nfs/dbraw/zinc/70/16/65/1060701665.db2.gz VWIABIJDBZUJCH-QGZVFWFLSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1[nH]c2ccc(Cc3cccc(OC(F)(F)F)c3)cc2[nH+]1 ZINC001250222980 1060703373 /nfs/dbraw/zinc/70/33/73/1060703373.db2.gz ASCWJXXAOUWNCK-UHFFFAOYSA-N 1 2 306.287 4.361 20 0 DIADLO Oc1ccc(F)c(Nc2ccc(-n3cc[nH+]c3)cc2)c1Cl ZINC001250234062 1060713470 /nfs/dbraw/zinc/71/34/70/1060713470.db2.gz KGRNITDAWHPVPZ-UHFFFAOYSA-N 1 2 303.724 4.114 20 0 DIADLO Fc1cccc(F)c1CC1C[NH+](Cc2sccc2Cl)C1 ZINC001560875543 1060735925 /nfs/dbraw/zinc/73/59/25/1060735925.db2.gz VAGZJDAPOAWEGM-UHFFFAOYSA-N 1 2 313.800 4.354 20 0 DIADLO c1oc2ccccc2c1C[NH+]1CC(OCCCc2ccccc2)C1 ZINC001560876014 1060736186 /nfs/dbraw/zinc/73/61/86/1060736186.db2.gz QNMFWWISVIRYLK-UHFFFAOYSA-N 1 2 321.420 4.266 20 0 DIADLO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1nc(Cl)ccc1Br ZINC001560889986 1060751972 /nfs/dbraw/zinc/75/19/72/1060751972.db2.gz XEPDTMDTLXHKQX-SECBINFHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC(C)(C)C[N@H+]1Cc1nc(Cl)ccc1Br ZINC001560889986 1060751984 /nfs/dbraw/zinc/75/19/84/1060751984.db2.gz XEPDTMDTLXHKQX-SECBINFHSA-N 1 2 317.658 4.118 20 0 DIADLO CC(C)Oc1c(F)cc(C[N@@H+]2C[C@@H](C)C[C@H]2CF)cc1Cl ZINC001250287542 1060755974 /nfs/dbraw/zinc/75/59/74/1060755974.db2.gz FNOWOGPGASZJNG-AAEUAGOBSA-N 1 2 317.807 4.446 20 0 DIADLO CC(C)Oc1c(F)cc(C[N@H+]2C[C@@H](C)C[C@H]2CF)cc1Cl ZINC001250287542 1060755985 /nfs/dbraw/zinc/75/59/85/1060755985.db2.gz FNOWOGPGASZJNG-AAEUAGOBSA-N 1 2 317.807 4.446 20 0 DIADLO CCOc1cc(C[N@H+](C)Cc2ccccc2C)c(Cl)cn1 ZINC001250317453 1060775877 /nfs/dbraw/zinc/77/58/77/1060775877.db2.gz OTTOADACNOOFRQ-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCOc1cc(C[N@@H+](C)Cc2ccccc2C)c(Cl)cn1 ZINC001250317453 1060775890 /nfs/dbraw/zinc/77/58/90/1060775890.db2.gz OTTOADACNOOFRQ-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCc1cc(CCn2cc[nH+]c2)ccc1OCc1ccccc1 ZINC001250320461 1060778334 /nfs/dbraw/zinc/77/83/34/1060778334.db2.gz MDFDUDBLCPZEPO-UHFFFAOYSA-N 1 2 306.409 4.267 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1nc3ccc(F)cc3s1)CC2 ZINC001560922142 1060786221 /nfs/dbraw/zinc/78/62/21/1060786221.db2.gz LIIJJRPRUDDEBK-UHFFFAOYSA-N 1 2 312.413 4.302 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1nc3ccc(F)cc3s1)CC2 ZINC001560922142 1060786236 /nfs/dbraw/zinc/78/62/36/1060786236.db2.gz LIIJJRPRUDDEBK-UHFFFAOYSA-N 1 2 312.413 4.302 20 0 DIADLO C[C@H]1CC(C[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)C[C@H](C)C1 ZINC001560924566 1060788923 /nfs/dbraw/zinc/78/89/23/1060788923.db2.gz LUQHUVBNMHFCFT-CKEIUWERSA-N 1 2 304.482 4.088 20 0 DIADLO CCCCO[C@H]1C[C@H](Nc2c[nH+]cc3c2CCCC3)C1(C)C ZINC001560927479 1060790086 /nfs/dbraw/zinc/79/00/86/1060790086.db2.gz RIJUFHRSVZTVIH-ROUUACIJSA-N 1 2 302.462 4.356 20 0 DIADLO CCOc1nccc(C[N@@H+]2CCc3c(C)cccc3C2)c1Cl ZINC001250361154 1060790253 /nfs/dbraw/zinc/79/02/53/1060790253.db2.gz MBOPRWLEYOXXHX-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1nccc(C[N@H+]2CCc3c(C)cccc3C2)c1Cl ZINC001250361154 1060790271 /nfs/dbraw/zinc/79/02/71/1060790271.db2.gz MBOPRWLEYOXXHX-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1nccc(C[N@H+](C)C/C=C/c2ccccc2)c1Cl ZINC001250385306 1060791548 /nfs/dbraw/zinc/79/15/48/1060791548.db2.gz LNQUXWYHMXAREO-JXMROGBWSA-N 1 2 316.832 4.279 20 0 DIADLO CCOc1nccc(C[N@@H+](C)C/C=C/c2ccccc2)c1Cl ZINC001250385306 1060791561 /nfs/dbraw/zinc/79/15/61/1060791561.db2.gz LNQUXWYHMXAREO-JXMROGBWSA-N 1 2 316.832 4.279 20 0 DIADLO CCOc1nccc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)c1Cl ZINC001250385928 1060792445 /nfs/dbraw/zinc/79/24/45/1060792445.db2.gz YWBRTJGZYWMARK-ZDUSSCGKSA-N 1 2 316.832 4.081 20 0 DIADLO CCOc1nccc(C[N@H+]2Cc3ccccc3C[C@@H]2C)c1Cl ZINC001250385928 1060792456 /nfs/dbraw/zinc/79/24/56/1060792456.db2.gz YWBRTJGZYWMARK-ZDUSSCGKSA-N 1 2 316.832 4.081 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(C3CC3)cc2)C[C@H](CC(F)(F)F)O1 ZINC001560941001 1060805014 /nfs/dbraw/zinc/80/50/14/1060805014.db2.gz BZQGOVFFSAKEJA-LRDDRELGSA-N 1 2 313.363 4.106 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(C3CC3)cc2)C[C@H](CC(F)(F)F)O1 ZINC001560941001 1060805022 /nfs/dbraw/zinc/80/50/22/1060805022.db2.gz BZQGOVFFSAKEJA-LRDDRELGSA-N 1 2 313.363 4.106 20 0 DIADLO Cc1[nH]nc(C[N@@H+]2CCC[C@]2(C)Cc2ccccc2Cl)c1C ZINC001560951987 1060818763 /nfs/dbraw/zinc/81/87/63/1060818763.db2.gz XEOHNHXBNVBPFA-GOSISDBHSA-N 1 2 317.864 4.277 20 0 DIADLO Cc1[nH]nc(C[N@H+]2CCC[C@]2(C)Cc2ccccc2Cl)c1C ZINC001560951987 1060818772 /nfs/dbraw/zinc/81/87/72/1060818772.db2.gz XEOHNHXBNVBPFA-GOSISDBHSA-N 1 2 317.864 4.277 20 0 DIADLO COc1ccc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)cc1C ZINC001250468052 1060828215 /nfs/dbraw/zinc/82/82/15/1060828215.db2.gz SLUMHIITMNUIHA-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1cncc(Br)c1Cl ZINC001250470037 1060829725 /nfs/dbraw/zinc/82/97/25/1060829725.db2.gz JZTYINYKMLXBFP-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1cncc(Br)c1Cl ZINC001250470037 1060829748 /nfs/dbraw/zinc/82/97/48/1060829748.db2.gz JZTYINYKMLXBFP-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)CCS1 ZINC001560979354 1060844412 /nfs/dbraw/zinc/84/44/12/1060844412.db2.gz FQEHMZJTAKEJHQ-SECBINFHSA-N 1 2 309.784 4.296 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)CCS1 ZINC001560979354 1060844423 /nfs/dbraw/zinc/84/44/23/1060844423.db2.gz FQEHMZJTAKEJHQ-SECBINFHSA-N 1 2 309.784 4.296 20 0 DIADLO Cc1cc(C)cc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)c1 ZINC001250494342 1060848214 /nfs/dbraw/zinc/84/82/14/1060848214.db2.gz IYSICBWOOMDLKO-UHFFFAOYSA-N 1 2 306.344 4.172 20 0 DIADLO C[C@H](CCc1ccco1)[NH2+]CC(F)(F)c1ccc(F)cc1F ZINC001560998370 1060859249 /nfs/dbraw/zinc/85/92/49/1060859249.db2.gz WGECXZHXBRVYTL-LLVKDONJSA-N 1 2 315.310 4.261 20 0 DIADLO CCOc1cc2[nH]c([C@@H]3CCOC(C)(C)C3)[nH+]c2cc1OCC ZINC001250544648 1060885914 /nfs/dbraw/zinc/88/59/14/1060885914.db2.gz IXONGGRGYYFFKP-GFCCVEGCSA-N 1 2 318.417 4.033 20 0 DIADLO Cc1cc2[nH+]c(Cc3c(Cl)nc(C)nc3Cl)[nH]c2c(C)c1 ZINC001250544193 1060886078 /nfs/dbraw/zinc/88/60/78/1060886078.db2.gz ZAIBCTGEAOOHFL-UHFFFAOYSA-N 1 2 321.211 4.176 20 0 DIADLO CCn1c(CCc2ccc(OC)cc2)[nH+]c2ccc(F)c(F)c21 ZINC001250553443 1060890806 /nfs/dbraw/zinc/89/08/06/1060890806.db2.gz BANFLBWBYJMRIZ-UHFFFAOYSA-N 1 2 316.351 4.128 20 0 DIADLO CCn1c(CCc2cccc(OC)c2)[nH+]c2ccc(F)c(F)c21 ZINC001250553901 1060893025 /nfs/dbraw/zinc/89/30/25/1060893025.db2.gz QJXMGARHWWIMDH-UHFFFAOYSA-N 1 2 316.351 4.128 20 0 DIADLO Cn1c(CCc2ccc(Cl)cc2)[nH+]c2ccc(F)c(F)c21 ZINC001250554032 1060893542 /nfs/dbraw/zinc/89/35/42/1060893542.db2.gz VKTXXJNBTBRHDV-UHFFFAOYSA-N 1 2 306.743 4.290 20 0 DIADLO COc1ccc2[nH+]c(C[C@H](C)CCCC(C)(C)OC)n(C)c2c1 ZINC001250567439 1060902769 /nfs/dbraw/zinc/90/27/69/1060902769.db2.gz JNQURCVSGIBYRB-CQSZACIVSA-N 1 2 318.461 4.356 20 0 DIADLO CCOc1ccc2[nH]c([C@H](C)Cc3ccc4c(c3)OCO4)[nH+]c2c1 ZINC001250568391 1060903224 /nfs/dbraw/zinc/90/32/24/1060903224.db2.gz VSEHAPXUFNGJKO-GFCCVEGCSA-N 1 2 324.380 4.037 20 0 DIADLO Cc1cc(CNc2cnc3[nH]ccc3c2C)c2c([nH+]1)CCCC2 ZINC001561055349 1060905477 /nfs/dbraw/zinc/90/54/77/1060905477.db2.gz WRFVPOZQAZVAEO-UHFFFAOYSA-N 1 2 306.413 4.017 20 0 DIADLO COC(=O)CCCCCCCCc1[nH]c2ccc(C)cc2[nH+]1 ZINC001250597604 1060931312 /nfs/dbraw/zinc/93/13/12/1060931312.db2.gz QDQXGSIXKBUDMY-UHFFFAOYSA-N 1 2 302.418 4.318 20 0 DIADLO Cn1c(CCCOCc2ccccc2)[nH+]c2ccc(F)c(F)c21 ZINC001250605045 1060935040 /nfs/dbraw/zinc/93/50/40/1060935040.db2.gz HRBLCNQJFLCQIW-UHFFFAOYSA-N 1 2 316.351 4.001 20 0 DIADLO c1cc2ccc(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)cc2[nH]1 ZINC001250618325 1060948278 /nfs/dbraw/zinc/94/82/78/1060948278.db2.gz OSIGZTBMLGDOKX-UHFFFAOYSA-N 1 2 302.381 4.311 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1C/C=C/c1cccc(F)c1 ZINC001462152963 1060973202 /nfs/dbraw/zinc/97/32/02/1060973202.db2.gz CZIWQBQYOVQCTI-IWHGQQBYSA-N 1 2 313.420 4.283 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1C/C=C/c1cccc(F)c1 ZINC001462152963 1060973220 /nfs/dbraw/zinc/97/32/20/1060973220.db2.gz CZIWQBQYOVQCTI-IWHGQQBYSA-N 1 2 313.420 4.283 20 0 DIADLO C[C@H]1C[N@H+](Cc2ncccc2Br)[C@@H]1c1ccccc1 ZINC001473208067 1060975124 /nfs/dbraw/zinc/97/51/24/1060975124.db2.gz HPPKRZVEPWGBOU-LRDDRELGSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ncccc2Br)[C@@H]1c1ccccc1 ZINC001473208067 1060975144 /nfs/dbraw/zinc/97/51/44/1060975144.db2.gz HPPKRZVEPWGBOU-LRDDRELGSA-N 1 2 317.230 4.037 20 0 DIADLO CCc1cnc(C[N@@H+]2CCc3c(cccc3C(C)C)C2)s1 ZINC001462178000 1060995885 /nfs/dbraw/zinc/99/58/85/1060995885.db2.gz KAPIIGOGBLRZQY-UHFFFAOYSA-N 1 2 300.471 4.387 20 0 DIADLO CCc1cnc(C[N@H+]2CCc3c(cccc3C(C)C)C2)s1 ZINC001462178000 1060995907 /nfs/dbraw/zinc/99/59/07/1060995907.db2.gz KAPIIGOGBLRZQY-UHFFFAOYSA-N 1 2 300.471 4.387 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1CCC[N@@H+]1C/C=C/c1ccc(Cl)cc1 ZINC001473219234 1060996782 /nfs/dbraw/zinc/99/67/82/1060996782.db2.gz CVAAHPMSPXHKIN-NBUZRDOWSA-N 1 2 321.848 4.159 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1CCC[N@H+]1C/C=C/c1ccc(Cl)cc1 ZINC001473219234 1060996802 /nfs/dbraw/zinc/99/68/02/1060996802.db2.gz CVAAHPMSPXHKIN-NBUZRDOWSA-N 1 2 321.848 4.159 20 0 DIADLO Fc1cccc(C[N@@H+]2CCOC3(C2)CCCCCC3)c1Cl ZINC001473221779 1061003364 /nfs/dbraw/zinc/00/33/64/1061003364.db2.gz LIINYNZGAVDTLA-UHFFFAOYSA-N 1 2 311.828 4.404 20 0 DIADLO Fc1cccc(C[N@H+]2CCOC3(C2)CCCCCC3)c1Cl ZINC001473221779 1061003384 /nfs/dbraw/zinc/00/33/84/1061003384.db2.gz LIINYNZGAVDTLA-UHFFFAOYSA-N 1 2 311.828 4.404 20 0 DIADLO C[C@H]1CN(c2ccccc2F)CC[N@@H+]1Cc1cc(Cl)cs1 ZINC001462183532 1061006581 /nfs/dbraw/zinc/00/65/81/1061006581.db2.gz ZRQZICMRCNXERU-LBPRGKRZSA-N 1 2 324.852 4.251 20 0 DIADLO C[C@H]1CN(c2ccccc2F)CC[N@H+]1Cc1cc(Cl)cs1 ZINC001462183532 1061006598 /nfs/dbraw/zinc/00/65/98/1061006598.db2.gz ZRQZICMRCNXERU-LBPRGKRZSA-N 1 2 324.852 4.251 20 0 DIADLO CC(C)CCC1CC[NH+](CC(=O)Nc2cc(F)ccc2F)CC1 ZINC001473227914 1061009149 /nfs/dbraw/zinc/00/91/49/1061009149.db2.gz SHFHKTCKBFXSLR-UHFFFAOYSA-N 1 2 324.415 4.052 20 0 DIADLO C[C@H](c1cccc(Cl)c1F)[NH+]1CCN(c2cccs2)CC1 ZINC001473265993 1061041340 /nfs/dbraw/zinc/04/13/40/1061041340.db2.gz PDWRLKDYPIWWBJ-GFCCVEGCSA-N 1 2 324.852 4.424 20 0 DIADLO CN(C)c1cc(CN2CCCc3cc(C(C)(C)C)ccc32)cc[nH+]1 ZINC001473282271 1061050992 /nfs/dbraw/zinc/05/09/92/1061050992.db2.gz NPAWGRYPPLKXFG-UHFFFAOYSA-N 1 2 323.484 4.398 20 0 DIADLO CC(C)n1c2ccccc2nc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001250772203 1061061222 /nfs/dbraw/zinc/06/12/22/1061061222.db2.gz RJBUFMNNUDNLGI-UHFFFAOYSA-N 1 2 302.381 4.470 20 0 DIADLO c1cn(-c2ccc(-c3nc4ccccc4n3CC3CC3)cc2)c[nH+]1 ZINC001250771981 1061061787 /nfs/dbraw/zinc/06/17/87/1061061787.db2.gz KZJFYIITHQIWRX-UHFFFAOYSA-N 1 2 314.392 4.299 20 0 DIADLO Cc1ccc(Cl)c2nc(-c3ccc(-n4cc[nH+]c4)cc3)[nH]c21 ZINC001250771738 1061062770 /nfs/dbraw/zinc/06/27/70/1061062770.db2.gz BETCQCQYJCTVST-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO Cc1ccc(N2CC[NH+]([C@@H](C)c3c(F)cccc3F)CC2)cc1 ZINC001473301304 1061067238 /nfs/dbraw/zinc/06/72/38/1061067238.db2.gz MFMJUSOICSLOQI-HNNXBMFYSA-N 1 2 316.395 4.156 20 0 DIADLO Cc1ccc(N2CC[NH+]([C@H](C)c3c(F)cccc3F)CC2)cc1 ZINC001473301305 1061068327 /nfs/dbraw/zinc/06/83/27/1061068327.db2.gz MFMJUSOICSLOQI-OAHLLOKOSA-N 1 2 316.395 4.156 20 0 DIADLO CCn1c[nH+]cc1CN1CC[C@H](C)Sc2ccc(Cl)cc21 ZINC001462306834 1061094638 /nfs/dbraw/zinc/09/46/38/1061094638.db2.gz VJFXPSIBJWGOPW-LBPRGKRZSA-N 1 2 321.877 4.447 20 0 DIADLO CCc1ccc(C2=CC[N@@H+]([C@@H](C)C(=O)OC(C)(C)C)CC2)cc1 ZINC001473337134 1061097813 /nfs/dbraw/zinc/09/78/13/1061097813.db2.gz ZXZWXSIZJLHEMT-HNNXBMFYSA-N 1 2 315.457 4.068 20 0 DIADLO CCc1ccc(C2=CC[N@H+]([C@@H](C)C(=O)OC(C)(C)C)CC2)cc1 ZINC001473337134 1061097821 /nfs/dbraw/zinc/09/78/21/1061097821.db2.gz ZXZWXSIZJLHEMT-HNNXBMFYSA-N 1 2 315.457 4.068 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+](CC)Cc1ccncc1 ZINC001473352388 1061107843 /nfs/dbraw/zinc/10/78/43/1061107843.db2.gz GTUQZERSRQTWEL-UHFFFAOYSA-N 1 2 304.821 4.156 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+](CC)Cc1ccncc1 ZINC001473352388 1061107848 /nfs/dbraw/zinc/10/78/48/1061107848.db2.gz GTUQZERSRQTWEL-UHFFFAOYSA-N 1 2 304.821 4.156 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1coc(-c2ccccc2F)n1 ZINC001473352889 1061108276 /nfs/dbraw/zinc/10/82/76/1061108276.db2.gz QSEPBZLSUQOYDL-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1coc(-c2ccccc2F)n1 ZINC001473352889 1061108285 /nfs/dbraw/zinc/10/82/85/1061108285.db2.gz QSEPBZLSUQOYDL-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO Cn1cccc1[C@@H]1COCC[N@@H+]1Cc1ccc(C2CCCC2)cc1 ZINC001473354078 1061108393 /nfs/dbraw/zinc/10/83/93/1061108393.db2.gz FIOLSTXMIPYUAO-NRFANRHFSA-N 1 2 324.468 4.256 20 0 DIADLO Cn1cccc1[C@@H]1COCC[N@H+]1Cc1ccc(C2CCCC2)cc1 ZINC001473354078 1061108405 /nfs/dbraw/zinc/10/84/05/1061108405.db2.gz FIOLSTXMIPYUAO-NRFANRHFSA-N 1 2 324.468 4.256 20 0 DIADLO Cn1cccc1[C@H]1COCC[N@@H+]1Cc1ccc(C2CCCC2)cc1 ZINC001473354079 1061109407 /nfs/dbraw/zinc/10/94/07/1061109407.db2.gz FIOLSTXMIPYUAO-OAQYLSRUSA-N 1 2 324.468 4.256 20 0 DIADLO Cn1cccc1[C@H]1COCC[N@H+]1Cc1ccc(C2CCCC2)cc1 ZINC001473354079 1061109413 /nfs/dbraw/zinc/10/94/13/1061109413.db2.gz FIOLSTXMIPYUAO-OAQYLSRUSA-N 1 2 324.468 4.256 20 0 DIADLO C[C@H]1C[NH+](Cc2ccc(C3CCCCC3)cc2)C[C@H](C)S1=O ZINC001473383158 1061124474 /nfs/dbraw/zinc/12/44/74/1061124474.db2.gz CPSMWHPMNADVOZ-HOTGVXAUSA-N 1 2 319.514 4.076 20 0 DIADLO Clc1ccc2[nH]c(-c3ccn4cc[nH+]c4c3)nc2c1Cl ZINC001250927789 1061129103 /nfs/dbraw/zinc/12/91/03/1061129103.db2.gz KDRPDUVWOQMROP-UHFFFAOYSA-N 1 2 303.152 4.184 20 0 DIADLO CCCOc1ccc2nc(-c3ccn4cc[nH+]c4c3)n(CC)c2c1 ZINC001250927537 1061129420 /nfs/dbraw/zinc/12/94/20/1061129420.db2.gz AGILTLGNPINABJ-UHFFFAOYSA-N 1 2 320.396 4.160 20 0 DIADLO CC[C@H]1CCCC[C@@H]1[N@H+](C)Cc1ncsc1Br ZINC001473387640 1061130414 /nfs/dbraw/zinc/13/04/14/1061130414.db2.gz AUCIMQOSKKYFCV-JQWIXIFHSA-N 1 2 317.296 4.306 20 0 DIADLO CC[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1ncsc1Br ZINC001473387640 1061130421 /nfs/dbraw/zinc/13/04/21/1061130421.db2.gz AUCIMQOSKKYFCV-JQWIXIFHSA-N 1 2 317.296 4.306 20 0 DIADLO Fc1cc2[nH]c(-c3cccc(-n4cc[nH+]c4)c3)nc2c(Cl)c1 ZINC001250940124 1061136065 /nfs/dbraw/zinc/13/60/65/1061136065.db2.gz FDPZQXZZRXIROG-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO CCc1ccccc1-c1nc2cc(-n3cc[nH+]c3)c(F)cc2[nH]1 ZINC001250940562 1061138562 /nfs/dbraw/zinc/13/85/62/1061138562.db2.gz SXEHGKOIZFJWAW-UHFFFAOYSA-N 1 2 306.344 4.117 20 0 DIADLO Fc1cccc(Cl)c1CCCNc1cc2cc[nH]c2c[nH+]1 ZINC001462386947 1061141287 /nfs/dbraw/zinc/14/12/87/1061141287.db2.gz KFLKSSLXHVQOFI-UHFFFAOYSA-N 1 2 303.768 4.400 20 0 DIADLO COc1ccc(C[C@@H](C)CNc2cc3cc[nH]c3c[nH+]2)cc1F ZINC001462387895 1061144577 /nfs/dbraw/zinc/14/45/77/1061144577.db2.gz NIVCMXYAOQTIRP-GFCCVEGCSA-N 1 2 313.376 4.001 20 0 DIADLO CC[C@@H]([NH2+][C@@H](c1ccc(C(C)(C)C)cc1)C(C)C)C(=O)OC ZINC001473419942 1061149855 /nfs/dbraw/zinc/14/98/55/1061149855.db2.gz WFXOCRSHNJPTJC-IAGOWNOFSA-N 1 2 305.462 4.222 20 0 DIADLO CC(C)(C)n1c2cc(F)ccc2nc1-c1ccc2[nH+]ccn2c1 ZINC001250977273 1061155154 /nfs/dbraw/zinc/15/51/54/1061155154.db2.gz AJNGNCMRCZCJOF-UHFFFAOYSA-N 1 2 308.360 4.245 20 0 DIADLO CSCCCn1c2ccccc2nc1-c1ccc2[nH+]ccn2c1 ZINC001250978317 1061158011 /nfs/dbraw/zinc/15/80/11/1061158011.db2.gz HDPVFLPKCVOCRF-UHFFFAOYSA-N 1 2 322.437 4.104 20 0 DIADLO Cc1ccc(-c2nc3ccccc3n2-c2ccccc2F)c(N)[nH+]1 ZINC001250981409 1061160985 /nfs/dbraw/zinc/16/09/85/1061160985.db2.gz DPQVVHHPODIOMF-UHFFFAOYSA-N 1 2 318.355 4.117 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCC[C@H]1c1ccccc1Cl)C(=O)OC(C)(C)C ZINC001462426858 1061166200 /nfs/dbraw/zinc/16/62/00/1061166200.db2.gz MYLMOSJZPCWPHF-IVMMDQJWSA-N 1 2 323.864 4.296 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCC[C@H]1c1ccccc1Cl)C(=O)OC(C)(C)C ZINC001462426850 1061166231 /nfs/dbraw/zinc/16/62/31/1061166231.db2.gz MYLMOSJZPCWPHF-INWMFGNUSA-N 1 2 323.864 4.296 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCC[C@@H]1c1ccccc1Cl)C(=O)OC(C)(C)C ZINC001462426871 1061166357 /nfs/dbraw/zinc/16/63/57/1061166357.db2.gz MYLMOSJZPCWPHF-XPKDYRNWSA-N 1 2 323.864 4.296 20 0 DIADLO CCCOc1ccc(C[NH+]2CC(OC(C)(C)CC)C2)c(C)c1 ZINC001462444977 1061177988 /nfs/dbraw/zinc/17/79/88/1061177988.db2.gz QVAQCWSZRLRQNK-UHFFFAOYSA-N 1 2 305.462 4.173 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@H+]1C[C@H](C)O[C@@](C)(C(F)F)C1 ZINC001462449754 1061181059 /nfs/dbraw/zinc/18/10/59/1061181059.db2.gz GULGRQMEDZHPJT-BLLLJJGKSA-N 1 2 317.807 4.201 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@@H+]1C[C@H](C)O[C@@](C)(C(F)F)C1 ZINC001462449754 1061181067 /nfs/dbraw/zinc/18/10/67/1061181067.db2.gz GULGRQMEDZHPJT-BLLLJJGKSA-N 1 2 317.807 4.201 20 0 DIADLO CCc1cccc(Cl)c1C[N@@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC001462451451 1061181565 /nfs/dbraw/zinc/18/15/65/1061181565.db2.gz LMBFZFBJCZZCFZ-BDJLRTHQSA-N 1 2 317.807 4.147 20 0 DIADLO CCc1cccc(Cl)c1C[N@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC001462451451 1061181575 /nfs/dbraw/zinc/18/15/75/1061181575.db2.gz LMBFZFBJCZZCFZ-BDJLRTHQSA-N 1 2 317.807 4.147 20 0 DIADLO CCc1cccc(Cl)c1C[N@@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC001462451453 1061182042 /nfs/dbraw/zinc/18/20/42/1061182042.db2.gz LMBFZFBJCZZCFZ-BZNIZROVSA-N 1 2 317.807 4.147 20 0 DIADLO CCc1cccc(Cl)c1C[N@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC001462451453 1061182046 /nfs/dbraw/zinc/18/20/46/1061182046.db2.gz LMBFZFBJCZZCFZ-BZNIZROVSA-N 1 2 317.807 4.147 20 0 DIADLO CC(C)(C)c1ccc(C2CC[NH+](Cc3cnsn3)CC2)cc1 ZINC001473487832 1061187265 /nfs/dbraw/zinc/18/72/65/1061187265.db2.gz CXXSDRRPKNZZSJ-UHFFFAOYSA-N 1 2 315.486 4.215 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@@H+]1C[C@@H](C(F)(F)F)OC(C)(C)C1 ZINC001473496320 1061190714 /nfs/dbraw/zinc/19/07/14/1061190714.db2.gz BUJGXWKRQKGCJZ-KGLIPLIRSA-N 1 2 319.342 4.319 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@H+]1C[C@@H](C(F)(F)F)OC(C)(C)C1 ZINC001473496320 1061190720 /nfs/dbraw/zinc/19/07/20/1061190720.db2.gz BUJGXWKRQKGCJZ-KGLIPLIRSA-N 1 2 319.342 4.319 20 0 DIADLO CC(C)C[C@@H](C)[NH2+]c1ccc(N2CCOC[C@@H]2C)c(Cl)c1 ZINC001462483002 1061203221 /nfs/dbraw/zinc/20/32/21/1061203221.db2.gz UBQFWYRWNRNKMQ-KGLIPLIRSA-N 1 2 310.869 4.412 20 0 DIADLO c1csc(C[N@@H+]2CCc3ccc(-c4ccccc4)cc3C2)n1 ZINC001473513282 1061207885 /nfs/dbraw/zinc/20/78/85/1061207885.db2.gz RMQNWIUAVFYMFX-UHFFFAOYSA-N 1 2 306.434 4.368 20 0 DIADLO c1csc(C[N@H+]2CCc3ccc(-c4ccccc4)cc3C2)n1 ZINC001473513282 1061207903 /nfs/dbraw/zinc/20/79/03/1061207903.db2.gz RMQNWIUAVFYMFX-UHFFFAOYSA-N 1 2 306.434 4.368 20 0 DIADLO CCc1cc(Cl)cnc1NCc1cc(-n2cc[nH+]c2)cs1 ZINC001462507722 1061216248 /nfs/dbraw/zinc/21/62/48/1061216248.db2.gz DVYOZKOAKLAXPY-UHFFFAOYSA-N 1 2 318.833 4.157 20 0 DIADLO F[C@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(Br)o1 ZINC001462524845 1061235735 /nfs/dbraw/zinc/23/57/35/1061235735.db2.gz BVRNCQYUPXBNLO-DZGCQCFKSA-N 1 2 324.193 4.157 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(Br)o1 ZINC001462524846 1061235780 /nfs/dbraw/zinc/23/57/80/1061235780.db2.gz BVRNCQYUPXBNLO-HIFRSBDPSA-N 1 2 324.193 4.157 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1nc2cc(-c3cccs3)ccc2[nH]1 ZINC001251092067 1061236296 /nfs/dbraw/zinc/23/62/96/1061236296.db2.gz OGGZMRPGXQQCGL-UHFFFAOYSA-N 1 2 306.394 4.244 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1nc2ccc(-c3cccs3)cc2[nH]1 ZINC001251092067 1061236318 /nfs/dbraw/zinc/23/63/18/1061236318.db2.gz OGGZMRPGXQQCGL-UHFFFAOYSA-N 1 2 306.394 4.244 20 0 DIADLO CCCn1c(-c2ccc(N)[nH+]c2C)nc2cccc(Cl)c21 ZINC001251092601 1061236720 /nfs/dbraw/zinc/23/67/20/1061236720.db2.gz SZRIQZKLQAGGRL-UHFFFAOYSA-N 1 2 300.793 4.052 20 0 DIADLO Cc1cc(N[C@@H](C)CC(=O)Nc2cccc(Cl)c2)c[nH+]c1C ZINC001462535016 1061242165 /nfs/dbraw/zinc/24/21/65/1061242165.db2.gz HHRLWHQAPKHWKU-LBPRGKRZSA-N 1 2 317.820 4.181 20 0 DIADLO CC1(C)c2ccccc2CC[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC001473574848 1061262720 /nfs/dbraw/zinc/26/27/20/1061262720.db2.gz CADSDFTUSFPEKG-UHFFFAOYSA-N 1 2 304.796 4.168 20 0 DIADLO CC1(C)c2ccccc2CC[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC001473574848 1061262739 /nfs/dbraw/zinc/26/27/39/1061262739.db2.gz CADSDFTUSFPEKG-UHFFFAOYSA-N 1 2 304.796 4.168 20 0 DIADLO COC(=O)[C@H](c1ccsc1)[NH+]1CCC(C2CCCCC2)CC1 ZINC001473617126 1061289801 /nfs/dbraw/zinc/28/98/01/1061289801.db2.gz FAMOJYMOYNUGBV-KRWDZBQOSA-N 1 2 321.486 4.255 20 0 DIADLO Fc1cccc(Cl)c1[C@@H]1C[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CCO1 ZINC001473616808 1061289858 /nfs/dbraw/zinc/28/98/58/1061289858.db2.gz JRVMXUSQCRBCSG-WVZRYYJFSA-N 1 2 323.839 4.289 20 0 DIADLO Fc1cccc(Cl)c1[C@@H]1C[N@@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)CCO1 ZINC001473616808 1061289876 /nfs/dbraw/zinc/28/98/76/1061289876.db2.gz JRVMXUSQCRBCSG-WVZRYYJFSA-N 1 2 323.839 4.289 20 0 DIADLO CC(C)[C@@](C)(Cc1ccccc1)C(=O)Nc1cccc2[nH+]ccn21 ZINC001456373584 1061305073 /nfs/dbraw/zinc/30/50/73/1061305073.db2.gz QKJZLDJVQUJSPI-HXUWFJFHSA-N 1 2 321.424 4.178 20 0 DIADLO CC(C)[C@](C)(Cc1ccccc1)C(=O)Nc1cccc2[nH+]ccn21 ZINC001456373581 1061305163 /nfs/dbraw/zinc/30/51/63/1061305163.db2.gz QKJZLDJVQUJSPI-FQEVSTJZSA-N 1 2 321.424 4.178 20 0 DIADLO CCN(Cc1cc[nH+]c(N(C)C)c1)c1cccc2ccccc21 ZINC001473641372 1061309661 /nfs/dbraw/zinc/30/96/61/1061309661.db2.gz QGGJSNHRFWUSJS-UHFFFAOYSA-N 1 2 305.425 4.327 20 0 DIADLO CCCn1c(-c2cccc3[nH+]ccn32)nc2cccc(Cl)c21 ZINC001251326727 1061315315 /nfs/dbraw/zinc/31/53/15/1061315315.db2.gz UKNKXFDXJCOVGO-UHFFFAOYSA-N 1 2 310.788 4.414 20 0 DIADLO Nc1ccc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c(Cl)c1 ZINC001251332198 1061319744 /nfs/dbraw/zinc/31/97/44/1061319744.db2.gz MBMOBSMCUFNIFF-UHFFFAOYSA-N 1 2 312.804 4.066 20 0 DIADLO CO[C@H](CC(C)C)C[N@H+](C)[C@H](CCc1ccccc1)C(F)F ZINC001473691273 1061350255 /nfs/dbraw/zinc/35/02/55/1061350255.db2.gz GBVZMTQEVBQWIL-IAGOWNOFSA-N 1 2 313.432 4.246 20 0 DIADLO CO[C@H](CC(C)C)C[N@@H+](C)[C@H](CCc1ccccc1)C(F)F ZINC001473691273 1061350275 /nfs/dbraw/zinc/35/02/75/1061350275.db2.gz GBVZMTQEVBQWIL-IAGOWNOFSA-N 1 2 313.432 4.246 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCc2cc(F)c(F)cc2C1 ZINC001473755040 1061393674 /nfs/dbraw/zinc/39/36/74/1061393674.db2.gz LUOHYOOKZJHQGD-UHFFFAOYSA-N 1 2 317.379 4.310 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCc2cc(F)c(F)cc2C1 ZINC001473755040 1061393693 /nfs/dbraw/zinc/39/36/93/1061393693.db2.gz LUOHYOOKZJHQGD-UHFFFAOYSA-N 1 2 317.379 4.310 20 0 DIADLO CC(C)c1cccc(-c2[nH]c3ccc(N4CCOCC4)cc3[nH+]2)c1 ZINC001251604418 1061413369 /nfs/dbraw/zinc/41/33/69/1061413369.db2.gz MOTKCIYOXBUTJN-UHFFFAOYSA-N 1 2 321.424 4.190 20 0 DIADLO CCCC[N@H+](Cc1c(C)oc(C)c1C)Cc1nccc(C)n1 ZINC001473817191 1061423121 /nfs/dbraw/zinc/42/31/21/1061423121.db2.gz RBXAVYIJTJNPLY-UHFFFAOYSA-N 1 2 301.434 4.106 20 0 DIADLO CCCC[N@@H+](Cc1c(C)oc(C)c1C)Cc1nccc(C)n1 ZINC001473817191 1061423129 /nfs/dbraw/zinc/42/31/29/1061423129.db2.gz RBXAVYIJTJNPLY-UHFFFAOYSA-N 1 2 301.434 4.106 20 0 DIADLO Cc1ccnc2cccc(-c3[nH]c4ccc(N(C)C)cc4[nH+]3)c12 ZINC001251634619 1061427217 /nfs/dbraw/zinc/42/72/17/1061427217.db2.gz JJZQDAXNVIXVAZ-UHFFFAOYSA-N 1 2 302.381 4.153 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@H](Cc3ccccc3)[C@@H]2C)c(C)[nH+]1 ZINC001457434518 1061457209 /nfs/dbraw/zinc/45/72/09/1061457209.db2.gz JTMBWUCUIXXLJJ-PKOBYXMFSA-N 1 2 322.452 4.100 20 0 DIADLO Cc1cc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)cnc1C1CC1 ZINC001251757663 1061473255 /nfs/dbraw/zinc/47/32/55/1061473255.db2.gz NVUWFXYYGORYSD-UHFFFAOYSA-N 1 2 318.424 4.411 20 0 DIADLO c1cn(-c2ccc(NCc3nccc4ccccc43)cc2)c[nH+]1 ZINC001473946165 1061488085 /nfs/dbraw/zinc/48/80/85/1061488085.db2.gz MCHKCQCQNCDMIC-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO CC(C)(C)c1nc2cc(NCc3cccc4[nH+]ccn43)ccc2o1 ZINC001473947254 1061490722 /nfs/dbraw/zinc/49/07/22/1061490722.db2.gz JYZBJZFPPLXKPO-UHFFFAOYSA-N 1 2 320.396 4.385 20 0 DIADLO Cc1cccn2c(CNc3cccc(COC(C)C)c3)c[nH+]c12 ZINC001473955469 1061496308 /nfs/dbraw/zinc/49/63/08/1061496308.db2.gz CKHFBWOCKUXPKS-UHFFFAOYSA-N 1 2 309.413 4.180 20 0 DIADLO CCCCOc1ncccc1C[NH2+]Cc1c(F)cc(C)cc1F ZINC001473960264 1061502576 /nfs/dbraw/zinc/50/25/76/1061502576.db2.gz HYQQTCXJIGYPQF-UHFFFAOYSA-N 1 2 320.383 4.137 20 0 DIADLO CC[NH+](CC)[C@@H](CNCc1cccc(Cl)c1F)c1ccco1 ZINC001473966241 1061510831 /nfs/dbraw/zinc/51/08/31/1061510831.db2.gz FVTOMSUSCRRSHF-HNNXBMFYSA-N 1 2 324.827 4.245 20 0 DIADLO Cc1cc(C)c(CNC(=O)NCC2(C)CCC(C)(C)CC2)c[nH+]1 ZINC001251861374 1061514717 /nfs/dbraw/zinc/51/47/17/1061514717.db2.gz DGIFFTTXRAXHMF-UHFFFAOYSA-N 1 2 317.477 4.104 20 0 DIADLO Cc1cccc(NC(=O)[C@H]2CC[C@@H](Nc3cccc[nH+]3)CC2)c1C ZINC001463848531 1061525996 /nfs/dbraw/zinc/52/59/96/1061525996.db2.gz RWISSJJANKNDMW-CALCHBBNSA-N 1 2 323.440 4.308 20 0 DIADLO Cc1ccn2cc(C[NH2+]Cc3cccc(Cl)c3Cl)nc2c1 ZINC001473987694 1061528720 /nfs/dbraw/zinc/52/87/20/1061528720.db2.gz JMEQXCYAJOOTEV-UHFFFAOYSA-N 1 2 320.223 4.239 20 0 DIADLO CCCCC[C@H](C)NC(=O)[C@H]1CC[C@@H](Nc2cccc[nH+]2)CC1 ZINC001464022611 1061544598 /nfs/dbraw/zinc/54/45/98/1061544598.db2.gz BPQJANNGMJQASD-YESZJQIVSA-N 1 2 317.477 4.137 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)[C@H]1[C@@H]2CCCCCC[C@@H]21 ZINC001464071579 1061553688 /nfs/dbraw/zinc/55/36/88/1061553688.db2.gz DUDXEGIMBQNPPN-HWWDLCQESA-N 1 2 309.413 4.027 20 0 DIADLO Cc1cc(CNC(=O)N2CC[C@@H](C(C)(C)C)C[C@H]2C)cc(C)[nH+]1 ZINC001252029593 1061559706 /nfs/dbraw/zinc/55/97/06/1061559706.db2.gz ZPFFWXITHJIMID-NVXWUHKLSA-N 1 2 317.477 4.055 20 0 DIADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccccc1Oc1c(C)cccc1C ZINC001464391029 1061585249 /nfs/dbraw/zinc/58/52/49/1061585249.db2.gz YHHQXTLZKKUNQB-KRWDZBQOSA-N 1 2 324.424 4.128 20 0 DIADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccccc1Oc1c(C)cccc1C ZINC001464391029 1061585272 /nfs/dbraw/zinc/58/52/72/1061585272.db2.gz YHHQXTLZKKUNQB-KRWDZBQOSA-N 1 2 324.424 4.128 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccc(C)cc2OC(C)C)s1 ZINC001474044779 1061592719 /nfs/dbraw/zinc/59/27/19/1061592719.db2.gz DZUTVDOYEDURRA-UHFFFAOYSA-N 1 2 304.459 4.091 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1cc(C)nc(C)c1)c1ccco1 ZINC001474053266 1061601054 /nfs/dbraw/zinc/60/10/54/1061601054.db2.gz QEUBFZYIHYYHTI-FQEVSTJZSA-N 1 2 322.408 4.179 20 0 DIADLO Cc1cc(CNc2cccc(OCCF)c2)c2c([nH+]1)CCCC2 ZINC001474056243 1061602080 /nfs/dbraw/zinc/60/20/80/1061602080.db2.gz LLQYGIVCKNWWPH-UHFFFAOYSA-N 1 2 314.404 4.229 20 0 DIADLO Fc1cc(NCc2ccc3scnc3c2)ccc1-n1cc[nH+]c1 ZINC001474058020 1061604641 /nfs/dbraw/zinc/60/46/41/1061604641.db2.gz FTSHPBOLPLQTGU-UHFFFAOYSA-N 1 2 324.384 4.233 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3nc(C(C)(C)C)cs3)ccc21 ZINC001474060422 1061607718 /nfs/dbraw/zinc/60/77/18/1061607718.db2.gz GLIWORCSJIAALB-UHFFFAOYSA-N 1 2 315.486 4.435 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3nc(C(C)(C)C)cs3)ccc21 ZINC001474060422 1061607732 /nfs/dbraw/zinc/60/77/32/1061607732.db2.gz GLIWORCSJIAALB-UHFFFAOYSA-N 1 2 315.486 4.435 20 0 DIADLO Cc1nc(N[C@@H](Cc2ccccc2)C2CC2)c2c([nH+]1)CCCC2 ZINC001458178232 1061614141 /nfs/dbraw/zinc/61/41/41/1061614141.db2.gz KTVNCTQRGLAOJH-IBGZPJMESA-N 1 2 307.441 4.097 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC[C@H](c3ccccc3)CC2)c(C)[nH+]1 ZINC001464772387 1061631814 /nfs/dbraw/zinc/63/18/14/1061631814.db2.gz ZYRGQIBCELJHDJ-IBGZPJMESA-N 1 2 322.452 4.417 20 0 DIADLO CC[C@@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1)c1ccccc1 ZINC001464824347 1061636758 /nfs/dbraw/zinc/63/67/58/1061636758.db2.gz GVEUWHHBIGNCTN-GOSISDBHSA-N 1 2 319.408 4.313 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2CC[C@H](C)[C@@H](C)C2)ccc1-n1cc[nH+]c1 ZINC001464832399 1061639485 /nfs/dbraw/zinc/63/94/85/1061639485.db2.gz XMWJHRUZHVPEBE-OFQRWUPVSA-N 1 2 311.429 4.192 20 0 DIADLO Cc1cc(N[C@H]2COc3c2cccc3Cl)nc(C2CCC2)[nH+]1 ZINC001458250209 1061659886 /nfs/dbraw/zinc/65/98/86/1061659886.db2.gz ABODKQNDUCGJOT-AWEZNQCLSA-N 1 2 315.804 4.252 20 0 DIADLO Cc1ccc2sc(NCc3ccn4cc[nH+]c4c3)nc2c1C ZINC001458292113 1061679681 /nfs/dbraw/zinc/67/96/81/1061679681.db2.gz LKZOFFWUTAJOKK-UHFFFAOYSA-N 1 2 308.410 4.173 20 0 DIADLO CC(C)c1cc(N[C@@H](CO)CC2CCCC2)nc(C(C)C)[nH+]1 ZINC001458332502 1061702567 /nfs/dbraw/zinc/70/25/67/1061702567.db2.gz AZOVCFZFCPQYHJ-OAHLLOKOSA-N 1 2 305.466 4.077 20 0 DIADLO CC(C)(C)c1ccc(-c2nnc([C@H]3CCCc4[nH]c[nH+]c43)o2)cc1 ZINC001252812827 1061727518 /nfs/dbraw/zinc/72/75/18/1061727518.db2.gz KHYDDIDIDIZMMG-AWEZNQCLSA-N 1 2 322.412 4.225 20 0 DIADLO Cc1cc2cc(CNc3nc(C)[nH+]c4c3CCCC4)ccc2[nH]1 ZINC001458373332 1061727964 /nfs/dbraw/zinc/72/79/64/1061727964.db2.gz YCECAMLJUMBPDC-UHFFFAOYSA-N 1 2 306.413 4.066 20 0 DIADLO Cc1nc(N2[C@H](C)C[C@@H](c3ccccc3)[C@H]2C)c2c([nH+]1)CCCC2 ZINC001458402370 1061744042 /nfs/dbraw/zinc/74/40/42/1061744042.db2.gz QXQLOCUJDRWIEQ-SPYBWZPUSA-N 1 2 321.468 4.435 20 0 DIADLO Cc1nc(N2[C@H](C)C[C@@H](c3ccccc3)[C@@H]2C)c2c([nH+]1)CCCC2 ZINC001458402386 1061744082 /nfs/dbraw/zinc/74/40/82/1061744082.db2.gz QXQLOCUJDRWIEQ-ZRGWGRIASA-N 1 2 321.468 4.435 20 0 DIADLO CCc1cc(N2CC(C)(C)[C@@H]2c2cccs2)nc(CC)[nH+]1 ZINC001458414645 1061749737 /nfs/dbraw/zinc/74/97/37/1061749737.db2.gz NLEZOFLTMFQVCI-INIZCTEOSA-N 1 2 301.459 4.250 20 0 DIADLO CCc1ccc(CC)c(NC(=O)[C@@H](CC(C)C)n2cc[nH+]c2)c1 ZINC001465472026 1061760436 /nfs/dbraw/zinc/76/04/36/1061760436.db2.gz ICTUZYQIRLAKGX-GOSISDBHSA-N 1 2 313.445 4.234 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2cc3c[nH+]ccc3[nH]2)o1 ZINC001465476483 1061761063 /nfs/dbraw/zinc/76/10/63/1061761063.db2.gz ITJDOFZMPWJGEZ-SJKOYZFVSA-N 1 2 323.396 4.078 20 0 DIADLO CCc1ccc(CC)c(NC(=O)[C@H](CC(C)C)n2cc[nH+]c2)c1 ZINC001465472027 1061761411 /nfs/dbraw/zinc/76/14/11/1061761411.db2.gz ICTUZYQIRLAKGX-SFHVURJKSA-N 1 2 313.445 4.234 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2cc3c[nH+]ccc3[nH]2)o1 ZINC001465476484 1061762292 /nfs/dbraw/zinc/76/22/92/1061762292.db2.gz ITJDOFZMPWJGEZ-YVEFUNNKSA-N 1 2 323.396 4.078 20 0 DIADLO CC[C@@H](Nc1[nH+]cnc2c1cnn2-c1ccccc1)[C@@H]1CC1(C)C ZINC001458442591 1061767731 /nfs/dbraw/zinc/76/77/31/1061767731.db2.gz CNLYQOCKUBGZRU-JKSUJKDBSA-N 1 2 321.428 4.052 20 0 DIADLO Fc1cccc(C[NH2+]Cc2cscc2Br)c1F ZINC001474226034 1061787264 /nfs/dbraw/zinc/78/72/64/1061787264.db2.gz GLBQGVMTSCRUIR-UHFFFAOYSA-N 1 2 318.186 4.079 20 0 DIADLO CCc1ccc(-c2nnc(-c3ccc(-n4cc[nH+]c4)cc3)o2)cc1 ZINC001253021548 1061787330 /nfs/dbraw/zinc/78/73/30/1061787330.db2.gz WDWFHNZSHQNYCI-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO CCNc1cc(CNc2ncnc3ccc(C(C)C)cc32)cc[nH+]1 ZINC001458524447 1061817666 /nfs/dbraw/zinc/81/76/66/1061817666.db2.gz BLAJTVHACDZTLD-UHFFFAOYSA-N 1 2 321.428 4.192 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+]Cc3cc4cnccc4o3)co2)cc1 ZINC001474264031 1061829187 /nfs/dbraw/zinc/82/91/87/1061829187.db2.gz LXWFYUKHXKNJAM-UHFFFAOYSA-N 1 2 319.364 4.081 20 0 DIADLO Cc1cc(N[C@@H]2c3ccccc3CC[C@@H]2F)nc(C2CCC2)[nH+]1 ZINC001458550060 1061830350 /nfs/dbraw/zinc/83/03/50/1061830350.db2.gz QZDQQFJRRLCJEI-FUHWJXTLSA-N 1 2 311.404 4.490 20 0 DIADLO F[C@@H]1COc2ccccc2[C@H]1[NH2+]Cc1csc2ccccc12 ZINC001474266834 1061833218 /nfs/dbraw/zinc/83/32/18/1061833218.db2.gz ZYVVLXIHVQKEPY-CRAIPNDOSA-N 1 2 313.397 4.463 20 0 DIADLO CCc1cc(N(Cc2nc3ccccc3s2)C2CC2)nc(C)[nH+]1 ZINC001458620656 1061857273 /nfs/dbraw/zinc/85/72/73/1061857273.db2.gz WKDZSDIBJFJZKR-UHFFFAOYSA-N 1 2 324.453 4.126 20 0 DIADLO Cc1ccc(F)c(CNc2[nH+]c3cc(Cl)ccc3n2C)c1 ZINC001474301795 1061869988 /nfs/dbraw/zinc/86/99/88/1061869988.db2.gz KNFUKGKUFVWEIG-UHFFFAOYSA-N 1 2 303.768 4.286 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1sc(C)cc1Br ZINC001474311021 1061880679 /nfs/dbraw/zinc/88/06/79/1061880679.db2.gz CMTKTBIRZOXZNA-UHFFFAOYSA-N 1 2 314.248 4.434 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1sc(C)cc1Br ZINC001474311021 1061880688 /nfs/dbraw/zinc/88/06/88/1061880688.db2.gz CMTKTBIRZOXZNA-UHFFFAOYSA-N 1 2 314.248 4.434 20 0 DIADLO CCc1cc(OC)ccc1C[N@@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001474310400 1061881459 /nfs/dbraw/zinc/88/14/59/1061881459.db2.gz WDWRPMFAHUBGFW-UHFFFAOYSA-N 1 2 320.436 4.297 20 0 DIADLO CCc1cc(OC)ccc1C[N@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001474310400 1061881469 /nfs/dbraw/zinc/88/14/69/1061881469.db2.gz WDWRPMFAHUBGFW-UHFFFAOYSA-N 1 2 320.436 4.297 20 0 DIADLO COC(=O)c1sccc1C[N@H+](C)Cc1ccc(C(C)C)cc1 ZINC001474315985 1061884559 /nfs/dbraw/zinc/88/45/59/1061884559.db2.gz DKWQNEMZCUBDOP-UHFFFAOYSA-N 1 2 317.454 4.290 20 0 DIADLO COC(=O)c1sccc1C[N@@H+](C)Cc1ccc(C(C)C)cc1 ZINC001474315985 1061884571 /nfs/dbraw/zinc/88/45/71/1061884571.db2.gz DKWQNEMZCUBDOP-UHFFFAOYSA-N 1 2 317.454 4.290 20 0 DIADLO CC[N@H+](Cc1c(C)nc2scc(C)n12)Cc1ccccc1F ZINC001474319399 1061889469 /nfs/dbraw/zinc/88/94/69/1061889469.db2.gz KAFBFWVYCCNLHX-UHFFFAOYSA-N 1 2 317.433 4.174 20 0 DIADLO CC[N@@H+](Cc1c(C)nc2scc(C)n12)Cc1ccccc1F ZINC001474319399 1061889477 /nfs/dbraw/zinc/88/94/77/1061889477.db2.gz KAFBFWVYCCNLHX-UHFFFAOYSA-N 1 2 317.433 4.174 20 0 DIADLO CCn1cc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)c(C)n1 ZINC001474321954 1061901117 /nfs/dbraw/zinc/90/11/17/1061901117.db2.gz AFZMMHXRQNFJQS-UHFFFAOYSA-N 1 2 323.440 4.315 20 0 DIADLO CCn1cc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)c(C)n1 ZINC001474321954 1061901132 /nfs/dbraw/zinc/90/11/32/1061901132.db2.gz AFZMMHXRQNFJQS-UHFFFAOYSA-N 1 2 323.440 4.315 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC001474323974 1061907676 /nfs/dbraw/zinc/90/76/76/1061907676.db2.gz JTZNUITWIOCJSX-WFASDCNBSA-N 1 2 321.827 4.279 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC001474323974 1061907696 /nfs/dbraw/zinc/90/76/96/1061907696.db2.gz JTZNUITWIOCJSX-WFASDCNBSA-N 1 2 321.827 4.279 20 0 DIADLO CCCCC[C@H](O)CNc1[nH+]cccc1OCc1ccccc1 ZINC001253523082 1061910590 /nfs/dbraw/zinc/91/05/90/1061910590.db2.gz UMGNAOXRVFSSJX-KRWDZBQOSA-N 1 2 314.429 4.014 20 0 DIADLO CCCCC[C@@H](O)CNc1[nH+]cccc1OCc1ccccc1 ZINC001253523083 1061912150 /nfs/dbraw/zinc/91/21/50/1061912150.db2.gz UMGNAOXRVFSSJX-QGZVFWFLSA-N 1 2 314.429 4.014 20 0 DIADLO CN(C)c1[nH+]cc(COc2c(F)cccc2F)c2ccccc21 ZINC001458836799 1061918084 /nfs/dbraw/zinc/91/80/84/1061918084.db2.gz TWICLGZDTGRFFZ-UHFFFAOYSA-N 1 2 314.335 4.158 20 0 DIADLO Fc1cc(Br)cc(F)c1C[N@@H+]1CCC[C@@H]1C1CC1 ZINC001474335686 1061930598 /nfs/dbraw/zinc/93/05/98/1061930598.db2.gz CNALJMBIOXFWRC-CQSZACIVSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(Br)cc(F)c1C[N@H+]1CCC[C@@H]1C1CC1 ZINC001474335686 1061930617 /nfs/dbraw/zinc/93/06/17/1061930617.db2.gz CNALJMBIOXFWRC-CQSZACIVSA-N 1 2 316.189 4.102 20 0 DIADLO CN(C)c1cc[nH+]c(NC(=O)c2ccc(C3CCCC3)cc2)c1 ZINC001466378666 1061931607 /nfs/dbraw/zinc/93/16/07/1061931607.db2.gz MHZNOGQMUPISDT-UHFFFAOYSA-N 1 2 309.413 4.058 20 0 DIADLO Cc1coc(C[N@H+](Cc2cccc(C)c2)Cc2ccccn2)c1 ZINC001474335811 1061932389 /nfs/dbraw/zinc/93/23/89/1061932389.db2.gz HZHWDZXNSQZTQG-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Cc1coc(C[N@@H+](Cc2cccc(C)c2)Cc2ccccn2)c1 ZINC001474335811 1061932411 /nfs/dbraw/zinc/93/24/11/1061932411.db2.gz HZHWDZXNSQZTQG-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO CCCC[N@H+](Cc1cc(C)nn1C)Cc1ccccc1Cl ZINC001474342996 1061940363 /nfs/dbraw/zinc/94/03/63/1061940363.db2.gz HULKPEGEINWLOI-UHFFFAOYSA-N 1 2 305.853 4.184 20 0 DIADLO CCCC[N@@H+](Cc1cc(C)nn1C)Cc1ccccc1Cl ZINC001474342996 1061940383 /nfs/dbraw/zinc/94/03/83/1061940383.db2.gz HULKPEGEINWLOI-UHFFFAOYSA-N 1 2 305.853 4.184 20 0 DIADLO CCCC1CC[NH+](Cc2nc(=O)c3c(C)c(C)sc3[nH]2)CC1 ZINC001253744307 1061972802 /nfs/dbraw/zinc/97/28/02/1061972802.db2.gz PQVGRHOJCLGPHU-UHFFFAOYSA-N 1 2 319.474 4.026 20 0 DIADLO CCCn1cc(C[N@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)nn1 ZINC001474363283 1061991729 /nfs/dbraw/zinc/99/17/29/1061991729.db2.gz HWILTNHVDRAMDN-ZDUSSCGKSA-N 1 2 318.852 4.067 20 0 DIADLO CCCn1cc(C[N@@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)nn1 ZINC001474363283 1061991757 /nfs/dbraw/zinc/99/17/57/1061991757.db2.gz HWILTNHVDRAMDN-ZDUSSCGKSA-N 1 2 318.852 4.067 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3cccc(F)c3[C@H]2C)c(F)c1 ZINC001474377216 1062021403 /nfs/dbraw/zinc/02/14/03/1062021403.db2.gz YOIMKGVHPVGLOX-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(C[N@H+]2CCc3cccc(F)c3[C@H]2C)c(F)c1 ZINC001474377216 1062021432 /nfs/dbraw/zinc/02/14/32/1062021432.db2.gz YOIMKGVHPVGLOX-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1ccc(C[N@H+](Cc2c(Cl)c(C)nn2C)C(C)C)s1 ZINC001474383009 1062029813 /nfs/dbraw/zinc/02/98/13/1062029813.db2.gz VWWORFBNCMGVRG-UHFFFAOYSA-N 1 2 311.882 4.162 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2c(Cl)c(C)nn2C)C(C)C)s1 ZINC001474383009 1062029835 /nfs/dbraw/zinc/02/98/35/1062029835.db2.gz VWWORFBNCMGVRG-UHFFFAOYSA-N 1 2 311.882 4.162 20 0 DIADLO CCC[C@H](O)CCCSCc1ccc(-n2cc[nH+]c2)cc1 ZINC001459209551 1062042256 /nfs/dbraw/zinc/04/22/56/1062042256.db2.gz FHSFBTPVNAGTTQ-KRWDZBQOSA-N 1 2 304.459 4.047 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(Oc3ccc(F)cc3)nc2)C[C@@H]1F ZINC001474393287 1062044961 /nfs/dbraw/zinc/04/49/61/1062044961.db2.gz NCJWDRKTGPOTBS-DYVFJYSZSA-N 1 2 318.367 4.193 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)nc2)C[C@@H]1F ZINC001474393287 1062044981 /nfs/dbraw/zinc/04/49/81/1062044981.db2.gz NCJWDRKTGPOTBS-DYVFJYSZSA-N 1 2 318.367 4.193 20 0 DIADLO COCCOc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)o1 ZINC001474401681 1062057074 /nfs/dbraw/zinc/05/70/74/1062057074.db2.gz RLNHKCRRXNRBMO-ZDUSSCGKSA-N 1 2 323.820 4.151 20 0 DIADLO COCCOc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)o1 ZINC001474401681 1062057102 /nfs/dbraw/zinc/05/71/02/1062057102.db2.gz RLNHKCRRXNRBMO-ZDUSSCGKSA-N 1 2 323.820 4.151 20 0 DIADLO CC(C)C[C@@H]([NH2+]C[C@H](C)c1ccc(F)cc1)C(=O)OC(C)(C)C ZINC001474408070 1062069179 /nfs/dbraw/zinc/06/91/79/1062069179.db2.gz KVTRTDRKXPFQIF-WMLDXEAASA-N 1 2 323.452 4.275 20 0 DIADLO Cc1cn(C)nc1C[N@H+](C)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC001474411056 1062077406 /nfs/dbraw/zinc/07/74/06/1062077406.db2.gz TUCZZMCOQOCSDO-FQEVSTJZSA-N 1 2 323.415 4.089 20 0 DIADLO Cc1cn(C)nc1C[N@@H+](C)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC001474411056 1062077443 /nfs/dbraw/zinc/07/74/43/1062077443.db2.gz TUCZZMCOQOCSDO-FQEVSTJZSA-N 1 2 323.415 4.089 20 0 DIADLO Cc1ccc([C@H](CC(F)(F)F)[NH2+]Cc2ncccc2F)cc1 ZINC001474419525 1062093027 /nfs/dbraw/zinc/09/30/27/1062093027.db2.gz JTPNHWGYXUKHRQ-AWEZNQCLSA-N 1 2 312.310 4.312 20 0 DIADLO Cc1ccc2c(c1)N(Cc1cc(C)[nH+]c3c1CCCC3)C[C@H](C)O2 ZINC001474423190 1062097131 /nfs/dbraw/zinc/09/71/31/1062097131.db2.gz WYMJYFYJRHDHRW-INIZCTEOSA-N 1 2 322.452 4.365 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCc3cc(F)ccc3C2)c(F)c1 ZINC001474433896 1062110430 /nfs/dbraw/zinc/11/04/30/1062110430.db2.gz CVQOGNKGKQAIGC-UPHRSURJSA-N 1 2 303.327 4.175 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCc3cc(F)ccc3C2)c(F)c1 ZINC001474433896 1062110438 /nfs/dbraw/zinc/11/04/38/1062110438.db2.gz CVQOGNKGKQAIGC-UPHRSURJSA-N 1 2 303.327 4.175 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2coc(-c3ccccc3F)n2)s1 ZINC001459421901 1062137976 /nfs/dbraw/zinc/13/79/76/1062137976.db2.gz HGHHZURLLJWXEL-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2coc(-c3ccccc3F)n2)s1 ZINC001459421901 1062137987 /nfs/dbraw/zinc/13/79/87/1062137987.db2.gz HGHHZURLLJWXEL-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Fc1cccc(C[N@@H+]2CCCC3(CC3)C2)c1OC(F)(F)F ZINC001474464511 1062144570 /nfs/dbraw/zinc/14/45/70/1062144570.db2.gz CSDWXXWMDAXPMA-UHFFFAOYSA-N 1 2 303.299 4.100 20 0 DIADLO Fc1cccc(C[N@H+]2CCCC3(CC3)C2)c1OC(F)(F)F ZINC001474464511 1062144575 /nfs/dbraw/zinc/14/45/75/1062144575.db2.gz CSDWXXWMDAXPMA-UHFFFAOYSA-N 1 2 303.299 4.100 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2cccc(O)c2Cl)C1 ZINC001474473010 1062152195 /nfs/dbraw/zinc/15/21/95/1062152195.db2.gz JBCKKUZPRGSERE-SFHVURJKSA-N 1 2 319.807 4.425 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2cccc(O)c2Cl)C1 ZINC001474473010 1062152203 /nfs/dbraw/zinc/15/22/03/1062152203.db2.gz JBCKKUZPRGSERE-SFHVURJKSA-N 1 2 319.807 4.425 20 0 DIADLO CCn1nc(C[N@@H+]2CCc3cc(F)cc(C)c3C2)c2ccccc21 ZINC001474471960 1062152503 /nfs/dbraw/zinc/15/25/03/1062152503.db2.gz BYXVEPHCTXBJBI-UHFFFAOYSA-N 1 2 323.415 4.062 20 0 DIADLO CCn1nc(C[N@H+]2CCc3cc(F)cc(C)c3C2)c2ccccc21 ZINC001474471960 1062152510 /nfs/dbraw/zinc/15/25/10/1062152510.db2.gz BYXVEPHCTXBJBI-UHFFFAOYSA-N 1 2 323.415 4.062 20 0 DIADLO O=c1ccc(C[N@@H+](Cc2c(Cl)cccc2Cl)C2CC2)c[nH]1 ZINC001474507379 1062190433 /nfs/dbraw/zinc/19/04/33/1062190433.db2.gz LTRXXQZSUXSMDB-UHFFFAOYSA-N 1 2 323.223 4.259 20 0 DIADLO O=c1ccc(C[N@H+](Cc2c(Cl)cccc2Cl)C2CC2)c[nH]1 ZINC001474507379 1062190439 /nfs/dbraw/zinc/19/04/39/1062190439.db2.gz LTRXXQZSUXSMDB-UHFFFAOYSA-N 1 2 323.223 4.259 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2cc(Cl)n(C)n2)cc1 ZINC001459536546 1062191164 /nfs/dbraw/zinc/19/11/64/1062191164.db2.gz BEXPWIZLCRHDNI-INIZCTEOSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2cc(Cl)n(C)n2)cc1 ZINC001459536546 1062191174 /nfs/dbraw/zinc/19/11/74/1062191174.db2.gz BEXPWIZLCRHDNI-INIZCTEOSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1ccn(-c2ccc([NH2+]C[C@@H]3CCc4ccccc4C3)cc2)n1 ZINC001474514685 1062197683 /nfs/dbraw/zinc/19/76/83/1062197683.db2.gz DGXGXSUIBJPKCF-QGZVFWFLSA-N 1 2 317.436 4.398 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccn(-c3cccc(F)c3)n2)c(C)o1 ZINC001254674486 1062226668 /nfs/dbraw/zinc/22/66/68/1062226668.db2.gz AGCJUUJPUNMXND-CYBMUJFWSA-N 1 2 313.376 4.072 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(Cl)n2)CC[C@@H]1c1ccccc1 ZINC001459646515 1062276861 /nfs/dbraw/zinc/27/68/61/1062276861.db2.gz LSQHHSLEYFBOQY-DOMZBBRYSA-N 1 2 306.862 4.422 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(Cl)n2)CC[C@@H]1c1ccccc1 ZINC001459646515 1062276878 /nfs/dbraw/zinc/27/68/78/1062276878.db2.gz LSQHHSLEYFBOQY-DOMZBBRYSA-N 1 2 306.862 4.422 20 0 DIADLO Cc1nn(C)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2C)c1Cl ZINC001474578603 1062287317 /nfs/dbraw/zinc/28/73/17/1062287317.db2.gz BPYHDYYTEYDSSI-HNNXBMFYSA-N 1 2 321.827 4.167 20 0 DIADLO Cc1nn(C)c(C[N@H+]2CCC[C@H]2c2ccc(F)cc2C)c1Cl ZINC001474578603 1062287342 /nfs/dbraw/zinc/28/73/42/1062287342.db2.gz BPYHDYYTEYDSSI-HNNXBMFYSA-N 1 2 321.827 4.167 20 0 DIADLO FC1(F)C[N@@H+](C2Cc3ccccc3C2)CC[C@@H]1c1ccccc1 ZINC001255028719 1062302622 /nfs/dbraw/zinc/30/26/22/1062302622.db2.gz BUCFSHQBLXSCEG-LJQANCHMSA-N 1 2 313.391 4.279 20 0 DIADLO FC1(F)C[N@H+](C2Cc3ccccc3C2)CC[C@@H]1c1ccccc1 ZINC001255028719 1062302648 /nfs/dbraw/zinc/30/26/48/1062302648.db2.gz BUCFSHQBLXSCEG-LJQANCHMSA-N 1 2 313.391 4.279 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2nn(C)cc2Cl)CC(C)C)c(C)c1 ZINC001474594545 1062309124 /nfs/dbraw/zinc/30/91/24/1062309124.db2.gz WERMGWQFMFGQMJ-UHFFFAOYSA-N 1 2 319.880 4.349 20 0 DIADLO Cc1ccc(C[N@H+](Cc2nn(C)cc2Cl)CC(C)C)c(C)c1 ZINC001474594545 1062309144 /nfs/dbraw/zinc/30/91/44/1062309144.db2.gz WERMGWQFMFGQMJ-UHFFFAOYSA-N 1 2 319.880 4.349 20 0 DIADLO CC[C@@H]([NH2+]CCc1ccc(C(C)C)cc1)C(=O)OC(C)(C)C ZINC001474598676 1062310912 /nfs/dbraw/zinc/31/09/12/1062310912.db2.gz HDEJEPSLIZWFJP-QGZVFWFLSA-N 1 2 305.462 4.062 20 0 DIADLO Fc1ccc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)c(F)c1F ZINC001474617300 1062339253 /nfs/dbraw/zinc/33/92/53/1062339253.db2.gz VKRMCJNJPXGZHV-OAHLLOKOSA-N 1 2 323.383 4.394 20 0 DIADLO Fc1ccc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)c(F)c1F ZINC001474617300 1062339271 /nfs/dbraw/zinc/33/92/71/1062339271.db2.gz VKRMCJNJPXGZHV-OAHLLOKOSA-N 1 2 323.383 4.394 20 0 DIADLO Clc1csc(C[NH2+]Cc2cc(Cl)cc(Cl)c2)n1 ZINC001474623545 1062345153 /nfs/dbraw/zinc/34/51/53/1062345153.db2.gz VBDKYCUOZHKJOX-UHFFFAOYSA-N 1 2 307.633 4.393 20 0 DIADLO Clc1ccc([C@H](c2nnc(C3CCC3)o2)[NH+]2CCCC2)cc1 ZINC001255202526 1062357365 /nfs/dbraw/zinc/35/73/65/1062357365.db2.gz VBJIGDQYPJCBCS-OAHLLOKOSA-N 1 2 317.820 4.176 20 0 DIADLO C/C=C/C[C@@H]1CCC[N@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001474652028 1062382732 /nfs/dbraw/zinc/38/27/32/1062382732.db2.gz AZYZZGPPTJZQRS-KXMPLOMGSA-N 1 2 304.381 4.340 20 0 DIADLO C/C=C/C[C@@H]1CCC[N@@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001474652028 1062382756 /nfs/dbraw/zinc/38/27/56/1062382756.db2.gz AZYZZGPPTJZQRS-KXMPLOMGSA-N 1 2 304.381 4.340 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1nc2ccccc2n1C ZINC001459775312 1062386997 /nfs/dbraw/zinc/38/69/97/1062386997.db2.gz LISNBPXSQZBODV-KBPBESRZSA-N 1 2 323.415 4.220 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1nc2ccccc2n1C ZINC001459775312 1062387019 /nfs/dbraw/zinc/38/70/19/1062387019.db2.gz LISNBPXSQZBODV-KBPBESRZSA-N 1 2 323.415 4.220 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC001459786951 1062401080 /nfs/dbraw/zinc/40/10/80/1062401080.db2.gz HTWGGKJNDIEZRF-OXQOHEQNSA-N 1 2 323.436 4.128 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC001459786951 1062401084 /nfs/dbraw/zinc/40/10/84/1062401084.db2.gz HTWGGKJNDIEZRF-OXQOHEQNSA-N 1 2 323.436 4.128 20 0 DIADLO FC[C@H]([NH2+]Cc1cc2c(ccnc2Cl)o1)c1ccc(F)cc1 ZINC001474674906 1062404276 /nfs/dbraw/zinc/40/42/76/1062404276.db2.gz KTNZVGKUABFPLB-AWEZNQCLSA-N 1 2 322.742 4.421 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1ccc(-c2ncco2)cc1F ZINC001459900629 1062484365 /nfs/dbraw/zinc/48/43/65/1062484365.db2.gz MLWUBCKKPUSLMQ-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(-c2ncco2)cc1F ZINC001459900629 1062484383 /nfs/dbraw/zinc/48/43/83/1062484383.db2.gz MLWUBCKKPUSLMQ-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO F[C@@H]1CCC[N@@H+]([C@H]2CCC[C@H](C(F)(F)F)C2)CC1(F)F ZINC001255706046 1062533615 /nfs/dbraw/zinc/53/36/15/1062533615.db2.gz OLURRWWABCNWHP-GARJFASQSA-N 1 2 303.290 4.177 20 0 DIADLO F[C@@H]1CCC[N@H+]([C@H]2CCC[C@H](C(F)(F)F)C2)CC1(F)F ZINC001255706046 1062533642 /nfs/dbraw/zinc/53/36/42/1062533642.db2.gz OLURRWWABCNWHP-GARJFASQSA-N 1 2 303.290 4.177 20 0 DIADLO F[C@@H]1CCC[N@@H+]([C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1(F)F ZINC001255706047 1062534093 /nfs/dbraw/zinc/53/40/93/1062534093.db2.gz OLURRWWABCNWHP-GMTAPVOTSA-N 1 2 303.290 4.177 20 0 DIADLO F[C@@H]1CCC[N@H+]([C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1(F)F ZINC001255706047 1062534102 /nfs/dbraw/zinc/53/41/02/1062534102.db2.gz OLURRWWABCNWHP-GMTAPVOTSA-N 1 2 303.290 4.177 20 0 DIADLO CCC[C@H](C)CCC[N@@H+]1CCOC[C@@H]1CC(=O)c1cccs1 ZINC001459971585 1062535907 /nfs/dbraw/zinc/53/59/07/1062535907.db2.gz MMYNVNRCEBDELV-HOTGVXAUSA-N 1 2 323.502 4.238 20 0 DIADLO CCC[C@H](C)CCC[N@H+]1CCOC[C@@H]1CC(=O)c1cccs1 ZINC001459971585 1062535927 /nfs/dbraw/zinc/53/59/27/1062535927.db2.gz MMYNVNRCEBDELV-HOTGVXAUSA-N 1 2 323.502 4.238 20 0 DIADLO CC[C@H]1C[N@H+](Cc2cc(Cl)cc(Cl)c2F)CCCO1 ZINC001460009267 1062568161 /nfs/dbraw/zinc/56/81/61/1062568161.db2.gz ZUNVWTUVLUWEDA-LBPRGKRZSA-N 1 2 306.208 4.133 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2F)CCCO1 ZINC001460009267 1062568186 /nfs/dbraw/zinc/56/81/86/1062568186.db2.gz ZUNVWTUVLUWEDA-LBPRGKRZSA-N 1 2 306.208 4.133 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3F)C2)c(C)c1 ZINC001459995634 1062554269 /nfs/dbraw/zinc/55/42/69/1062554269.db2.gz WAIZDOSUOIVCFI-IBGZPJMESA-N 1 2 317.379 4.155 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@H](c3ccc(F)cc3F)C2)c(C)c1 ZINC001459995634 1062554288 /nfs/dbraw/zinc/55/42/88/1062554288.db2.gz WAIZDOSUOIVCFI-IBGZPJMESA-N 1 2 317.379 4.155 20 0 DIADLO Cc1cnc(C[N@H+](C)CCOc2ccccc2C(C)(C)C)s1 ZINC001460029126 1062583488 /nfs/dbraw/zinc/58/34/88/1062583488.db2.gz GTYSTXDQGYFSCH-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO Cc1cnc(C[N@@H+](C)CCOc2ccccc2C(C)(C)C)s1 ZINC001460029126 1062583515 /nfs/dbraw/zinc/58/35/15/1062583515.db2.gz GTYSTXDQGYFSCH-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO Cc1ccc(SC[C@@H](C)[N@@H+]2CCC(F)(F)[C@H](F)C2)cc1 ZINC001255765182 1062584741 /nfs/dbraw/zinc/58/47/41/1062584741.db2.gz KCQPYDQRAQNWMJ-TZMCWYRMSA-N 1 2 303.393 4.155 20 0 DIADLO Cc1ccc(SC[C@@H](C)[N@H+]2CCC(F)(F)[C@H](F)C2)cc1 ZINC001255765182 1062584760 /nfs/dbraw/zinc/58/47/60/1062584760.db2.gz KCQPYDQRAQNWMJ-TZMCWYRMSA-N 1 2 303.393 4.155 20 0 DIADLO C[N@H+](Cc1cc(F)cc(F)c1)Cc1cccc(OC(C)(C)C)n1 ZINC001460058137 1062605143 /nfs/dbraw/zinc/60/51/43/1062605143.db2.gz LLSZGWRXGMHYLB-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO C[N@@H+](Cc1cc(F)cc(F)c1)Cc1cccc(OC(C)(C)C)n1 ZINC001460058137 1062605161 /nfs/dbraw/zinc/60/51/61/1062605161.db2.gz LLSZGWRXGMHYLB-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO Clc1ncsc1C[N@@H+]1Cc2ccccc2C2(CCC2)C1 ZINC001460084293 1062625793 /nfs/dbraw/zinc/62/57/93/1062625793.db2.gz NCSKXCHZCIKTOI-UHFFFAOYSA-N 1 2 304.846 4.234 20 0 DIADLO Clc1ncsc1C[N@H+]1Cc2ccccc2C2(CCC2)C1 ZINC001460084293 1062625811 /nfs/dbraw/zinc/62/58/11/1062625811.db2.gz NCSKXCHZCIKTOI-UHFFFAOYSA-N 1 2 304.846 4.234 20 0 DIADLO Fc1ccccc1Oc1ccc(C[N@H+]2CC[C@H](F)C2)cc1F ZINC001460127085 1062651256 /nfs/dbraw/zinc/65/12/56/1062651256.db2.gz SOYUFZGMJSHFIX-ZDUSSCGKSA-N 1 2 307.315 4.301 20 0 DIADLO Fc1ccccc1Oc1ccc(C[N@@H+]2CC[C@H](F)C2)cc1F ZINC001460127085 1062651276 /nfs/dbraw/zinc/65/12/76/1062651276.db2.gz SOYUFZGMJSHFIX-ZDUSSCGKSA-N 1 2 307.315 4.301 20 0 DIADLO CC(C)C[C@H](C(=O)N1CCC2(CCCCC2)CC1)n1cc[nH+]c1 ZINC001469914810 1062656696 /nfs/dbraw/zinc/65/66/96/1062656696.db2.gz PSRVCDSQWMFTEU-QGZVFWFLSA-N 1 2 317.477 4.043 20 0 DIADLO C[N@H+](Cc1sccc1Cl)[C@@H](CO)c1ccc(Cl)cc1 ZINC001460145063 1062661292 /nfs/dbraw/zinc/66/12/92/1062661292.db2.gz WYWDITFUFQZRPD-ZDUSSCGKSA-N 1 2 316.253 4.220 20 0 DIADLO C[N@@H+](Cc1sccc1Cl)[C@@H](CO)c1ccc(Cl)cc1 ZINC001460145063 1062661301 /nfs/dbraw/zinc/66/13/01/1062661301.db2.gz WYWDITFUFQZRPD-ZDUSSCGKSA-N 1 2 316.253 4.220 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@@H+]1CCC[C@@](C)(F)C1 ZINC001460145532 1062664232 /nfs/dbraw/zinc/66/42/32/1062664232.db2.gz QROPPGKICAUGRK-SMDDNHRTSA-N 1 2 300.215 4.334 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@H+]1CCC[C@@](C)(F)C1 ZINC001460145532 1062664243 /nfs/dbraw/zinc/66/42/43/1062664243.db2.gz QROPPGKICAUGRK-SMDDNHRTSA-N 1 2 300.215 4.334 20 0 DIADLO Cc1ccc2sc(C[N@@H+]3Cc4ccccc4O[C@@H](C)C3)nc2c1 ZINC001460174286 1062678580 /nfs/dbraw/zinc/67/85/80/1062678580.db2.gz JBFPRDQLTICHGF-AWEZNQCLSA-N 1 2 324.449 4.388 20 0 DIADLO Cc1ccc2sc(C[N@H+]3Cc4ccccc4O[C@@H](C)C3)nc2c1 ZINC001460174286 1062678586 /nfs/dbraw/zinc/67/85/86/1062678586.db2.gz JBFPRDQLTICHGF-AWEZNQCLSA-N 1 2 324.449 4.388 20 0 DIADLO C(=C/c1ccccc1)\CC[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC001460180561 1062681169 /nfs/dbraw/zinc/68/11/69/1062681169.db2.gz UGKOITCJNMXRMO-YRNVUSSQSA-N 1 2 315.420 4.291 20 0 DIADLO C(=C/c1ccccc1)\CC[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC001460180561 1062681188 /nfs/dbraw/zinc/68/11/88/1062681188.db2.gz UGKOITCJNMXRMO-YRNVUSSQSA-N 1 2 315.420 4.291 20 0 DIADLO COc1cc2c(cc1Cl)C[N@H+](Cc1ccc(F)cc1C)CC2 ZINC001460179931 1062682439 /nfs/dbraw/zinc/68/24/39/1062682439.db2.gz HKBRABVCXHITNP-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO COc1cc2c(cc1Cl)C[N@@H+](Cc1ccc(F)cc1C)CC2 ZINC001460179931 1062682445 /nfs/dbraw/zinc/68/24/45/1062682445.db2.gz HKBRABVCXHITNP-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO Fc1c(F)c(F)c(C[N@@H+]2CC[C@H](C3CCCC3)C2)c(F)c1F ZINC001460270251 1062746432 /nfs/dbraw/zinc/74/64/32/1062746432.db2.gz ITTVZCGOCWJRBD-JTQLQIEISA-N 1 2 319.317 4.394 20 0 DIADLO Fc1c(F)c(F)c(C[N@H+]2CC[C@H](C3CCCC3)C2)c(F)c1F ZINC001460270251 1062746449 /nfs/dbraw/zinc/74/64/49/1062746449.db2.gz ITTVZCGOCWJRBD-JTQLQIEISA-N 1 2 319.317 4.394 20 0 DIADLO Cc1cccc(C)c1C[N@@H+](Cc1noc(C2CC2)n1)CC(C)C ZINC001460279939 1062752505 /nfs/dbraw/zinc/75/25/05/1062752505.db2.gz WFQIXHSRBIFQKQ-UHFFFAOYSA-N 1 2 313.445 4.222 20 0 DIADLO Cc1cccc(C)c1C[N@H+](Cc1noc(C2CC2)n1)CC(C)C ZINC001460279939 1062752530 /nfs/dbraw/zinc/75/25/30/1062752530.db2.gz WFQIXHSRBIFQKQ-UHFFFAOYSA-N 1 2 313.445 4.222 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](Cc2ccccc2)c2ncco2)cc1F ZINC001460312451 1062775860 /nfs/dbraw/zinc/77/58/60/1062775860.db2.gz YPESVRYDMSZNFD-SFHVURJKSA-N 1 2 310.372 4.196 20 0 DIADLO CCCCCCc1nnc(-c2ccc(-c3c[nH+]cn3C)cc2)o1 ZINC001256396171 1062804946 /nfs/dbraw/zinc/80/49/46/1062804946.db2.gz XFEJGQOTQADCPN-UHFFFAOYSA-N 1 2 310.401 4.260 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1cccc(F)c1OC(F)F)CC2 ZINC001460362396 1062809236 /nfs/dbraw/zinc/80/92/36/1062809236.db2.gz LQBCDYLYESEAKB-UHFFFAOYSA-N 1 2 321.342 4.294 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1cccc(F)c1OC(F)F)CC2 ZINC001460362396 1062809254 /nfs/dbraw/zinc/80/92/54/1062809254.db2.gz LQBCDYLYESEAKB-UHFFFAOYSA-N 1 2 321.342 4.294 20 0 DIADLO CC(C)CCOCC[N@@H+]1CCc2ccc(Cl)c(Cl)c2C1 ZINC001460366326 1062812222 /nfs/dbraw/zinc/81/22/22/1062812222.db2.gz UOHVAOFGIHALNJ-UHFFFAOYSA-N 1 2 316.272 4.414 20 0 DIADLO CC(C)CCOCC[N@H+]1CCc2ccc(Cl)c(Cl)c2C1 ZINC001460366326 1062812248 /nfs/dbraw/zinc/81/22/48/1062812248.db2.gz UOHVAOFGIHALNJ-UHFFFAOYSA-N 1 2 316.272 4.414 20 0 DIADLO CC(C)c1nnc(C[NH+]2CCC(C3CCCCC3)CC2)s1 ZINC001460371964 1062819616 /nfs/dbraw/zinc/81/96/16/1062819616.db2.gz RJPYEPNIQHHBMH-UHFFFAOYSA-N 1 2 307.507 4.454 20 0 DIADLO CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ncc(Br)cc1F ZINC001460479967 1062873101 /nfs/dbraw/zinc/87/31/01/1062873101.db2.gz FXRBQZYKLJYZLI-CMPLNLGQSA-N 1 2 315.230 4.136 20 0 DIADLO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1ncc(Br)cc1F ZINC001460479967 1062873119 /nfs/dbraw/zinc/87/31/19/1062873119.db2.gz FXRBQZYKLJYZLI-CMPLNLGQSA-N 1 2 315.230 4.136 20 0 DIADLO C[C@H](c1ccc(F)c(Cl)c1)[N@@H+]1CCc2c(O)cccc2C1 ZINC001460578425 1062920531 /nfs/dbraw/zinc/92/05/31/1062920531.db2.gz COFFCQSHYBPXCC-LLVKDONJSA-N 1 2 305.780 4.304 20 0 DIADLO C[C@H](c1ccc(F)c(Cl)c1)[N@H+]1CCc2c(O)cccc2C1 ZINC001460578425 1062920548 /nfs/dbraw/zinc/92/05/48/1062920548.db2.gz COFFCQSHYBPXCC-LLVKDONJSA-N 1 2 305.780 4.304 20 0 DIADLO CC[NH+](CC)[C@@H](c1nnc([C@H]2C[C@H]2C)o1)c1ccc(Cl)cc1 ZINC001256683214 1062945307 /nfs/dbraw/zinc/94/53/07/1062945307.db2.gz OBBQEIUCHDAWBF-BYCMXARLSA-N 1 2 319.836 4.278 20 0 DIADLO CC(C)(CCCc1ccccc1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001460689038 1062989593 /nfs/dbraw/zinc/98/95/93/1062989593.db2.gz LBXJHJULEGBLPO-UHFFFAOYSA-N 1 2 321.424 4.322 20 0 DIADLO CCC[C@@H](C)CCC[NH2+][C@](C)(Cc1ccc(F)cc1)C(=O)OC ZINC001460707055 1063004456 /nfs/dbraw/zinc/00/44/56/1063004456.db2.gz PWWUGGZWOFPLNI-DNVCBOLYSA-N 1 2 323.452 4.106 20 0 DIADLO CCOC(=O)[C@@H](CC1CC1)[NH2+][C@@H](C)c1cccc2ccccc21 ZINC001460739180 1063031320 /nfs/dbraw/zinc/03/13/20/1063031320.db2.gz VSAGSQUHTZGROK-IFXJQAMLSA-N 1 2 311.425 4.222 20 0 DIADLO CCN(C(=O)[C@H](CC(C)C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC001472015868 1063042701 /nfs/dbraw/zinc/04/27/01/1063042701.db2.gz CALCPPFFAUFDHC-INIZCTEOSA-N 1 2 319.836 4.177 20 0 DIADLO CC1=CC[C@@](C)(C(=O)N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001472533105 1063098218 /nfs/dbraw/zinc/09/82/18/1063098218.db2.gz RXLLDPYPKWBPCT-OXJNMPFZSA-N 1 2 323.440 4.186 20 0 DIADLO c1cn(Cc2ccc(-c3nnc(CC4CCCCC4)o3)cc2)c[nH+]1 ZINC001257072804 1063099716 /nfs/dbraw/zinc/09/97/16/1063099716.db2.gz MSIJEWPAYHQROI-UHFFFAOYSA-N 1 2 322.412 4.104 20 0 DIADLO Cc1ccc(C)c(C2CC[NH+]([C@@H](C)c3csnn3)CC2)c1 ZINC001460893899 1063120193 /nfs/dbraw/zinc/12/01/93/1063120193.db2.gz BLDYERAVRXBUOY-AWEZNQCLSA-N 1 2 301.459 4.096 20 0 DIADLO CC1(C)C[N@H+](Cc2c(F)c(F)c(F)c(F)c2F)[C@@H]2CCC[C@@H]21 ZINC001460895928 1063120218 /nfs/dbraw/zinc/12/02/18/1063120218.db2.gz MZVJPYINOUFQDW-VHSXEESVSA-N 1 2 319.317 4.393 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(F)c(F)c(F)c(F)c2F)[C@@H]2CCC[C@@H]21 ZINC001460895928 1063120224 /nfs/dbraw/zinc/12/02/24/1063120224.db2.gz MZVJPYINOUFQDW-VHSXEESVSA-N 1 2 319.317 4.393 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H](F)C2)nc(-c2ccc(Cl)cc2)n1 ZINC001460896399 1063122244 /nfs/dbraw/zinc/12/22/44/1063122244.db2.gz MGUGZNOYGSRIAT-HNNXBMFYSA-N 1 2 319.811 4.039 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H](F)C2)nc(-c2ccc(Cl)cc2)n1 ZINC001460896399 1063122255 /nfs/dbraw/zinc/12/22/55/1063122255.db2.gz MGUGZNOYGSRIAT-HNNXBMFYSA-N 1 2 319.811 4.039 20 0 DIADLO Cc1nc(N(Cc2ccccc2)CC(C)C)c2c([nH+]1)CCCC2 ZINC001472673723 1063139845 /nfs/dbraw/zinc/13/98/45/1063139845.db2.gz BDXORVOECIEXRV-UHFFFAOYSA-N 1 2 309.457 4.326 20 0 DIADLO CCOc1cccc([C@@H](C)Nc2nc(C)[nH+]c3c2CCCC3)c1 ZINC001472675535 1063142923 /nfs/dbraw/zinc/14/29/23/1063142923.db2.gz QRHNQYZAPHGMFK-CYBMUJFWSA-N 1 2 311.429 4.236 20 0 DIADLO Cc1csc(CCCCNc2cc(C)[nH+]c(C3CCC3)n2)n1 ZINC001472683757 1063147694 /nfs/dbraw/zinc/14/76/94/1063147694.db2.gz RBZOGSVKQDRXLT-UHFFFAOYSA-N 1 2 316.474 4.252 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@@H+](Cc1ccc3ncccc3c1)C2 ZINC001460969853 1063160817 /nfs/dbraw/zinc/16/08/17/1063160817.db2.gz AKPRCNIYTLGPGY-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@H+](Cc1ccc3ncccc3c1)C2 ZINC001460969853 1063160825 /nfs/dbraw/zinc/16/08/25/1063160825.db2.gz AKPRCNIYTLGPGY-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@@H+](Cc1ccc(Cl)cn1)C2 ZINC001460983373 1063168248 /nfs/dbraw/zinc/16/82/48/1063168248.db2.gz ZUKBYSQKILFUGY-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@H+](Cc1ccc(Cl)cn1)C2 ZINC001460983373 1063168263 /nfs/dbraw/zinc/16/82/63/1063168263.db2.gz ZUKBYSQKILFUGY-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CCc1cc(NC[C@H]2SCCc3ccccc32)nc(CC)[nH+]1 ZINC001472710562 1063170080 /nfs/dbraw/zinc/17/00/80/1063170080.db2.gz LECIJLQNVURUSW-MRXNPFEDSA-N 1 2 313.470 4.044 20 0 DIADLO Cc1cc(N(C)Cc2cc3ccccc3[nH]2)nc(C2CCC2)[nH+]1 ZINC001472715936 1063174181 /nfs/dbraw/zinc/17/41/81/1063174181.db2.gz AKPOTCVMUPUEJC-UHFFFAOYSA-N 1 2 306.413 4.170 20 0 DIADLO Cc1ccc([C@@H]2C[C@H]2c2nnc([C@@H]3CC[N@@H+]3C(C)(C)C)o2)cc1 ZINC001257280125 1063175905 /nfs/dbraw/zinc/17/59/05/1063175905.db2.gz QJSRSYUZHKRFAI-XHSDSOJGSA-N 1 2 311.429 4.194 20 0 DIADLO Cc1ccc([C@@H]2C[C@H]2c2nnc([C@@H]3CC[N@H+]3C(C)(C)C)o2)cc1 ZINC001257280125 1063175914 /nfs/dbraw/zinc/17/59/14/1063175914.db2.gz QJSRSYUZHKRFAI-XHSDSOJGSA-N 1 2 311.429 4.194 20 0 DIADLO COc1ccc2cc(CC[C@H](C)[NH+]3CC(C)(F)C3)ccc2c1 ZINC001257275243 1063176544 /nfs/dbraw/zinc/17/65/44/1063176544.db2.gz HCOBEJALFSOPEM-AWEZNQCLSA-N 1 2 301.405 4.213 20 0 DIADLO CCCCO[C@@H]1C[C@H](Nc2nc(C)[nH+]c3c2CCCC3)C1(C)C ZINC001472718508 1063177196 /nfs/dbraw/zinc/17/71/96/1063177196.db2.gz DBGHKBHMVWNNOX-DLBZAZTESA-N 1 2 317.477 4.060 20 0 DIADLO Cc1cc(CNC(=O)C2=C(c3ccccc3)CCCC2)cc(C)[nH+]1 ZINC001461005835 1063182700 /nfs/dbraw/zinc/18/27/00/1063182700.db2.gz DHEISDIYRCTPJA-UHFFFAOYSA-N 1 2 320.436 4.342 20 0 DIADLO CCCC(CCC)[NH2+][C@@H](COC(C)(C)C)C(=O)OC(C)(C)C ZINC001257328422 1063210485 /nfs/dbraw/zinc/21/04/85/1063210485.db2.gz ZFOFBXJQPFMUIA-HNNXBMFYSA-N 1 2 315.498 4.070 20 0 DIADLO Cc1cc(N2CC[C@@](F)(c3ccccc3)C2)nc(C2CCC2)[nH+]1 ZINC001472766227 1063218998 /nfs/dbraw/zinc/21/89/98/1063218998.db2.gz RKQGEKYMHFNUQZ-IBGZPJMESA-N 1 2 311.404 4.128 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1nc2c(s1)CCCC2 ZINC001461058207 1063225956 /nfs/dbraw/zinc/22/59/56/1063225956.db2.gz WQMCNCIHENALMD-LLVKDONJSA-N 1 2 320.433 4.020 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+]Cc1ccc(Cl)nc1 ZINC001461062973 1063227735 /nfs/dbraw/zinc/22/77/35/1063227735.db2.gz BZMRMLSXDAMEHO-UHFFFAOYSA-N 1 2 319.817 4.050 20 0 DIADLO Cc1nc(N2CCC[C@@H](c3ccccc3)C2)c2c([nH+]1)CCCC2 ZINC001472789678 1063235242 /nfs/dbraw/zinc/23/52/42/1063235242.db2.gz QZONUKUHDGIWRB-QGZVFWFLSA-N 1 2 307.441 4.048 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(SCc3c(F)cccc3F)c12 ZINC001472797788 1063244545 /nfs/dbraw/zinc/24/45/45/1063244545.db2.gz MQNAWDZNVGEMJJ-UHFFFAOYSA-N 1 2 305.353 4.091 20 0 DIADLO CCc1cc(N2CC3(CCC3)[C@@H]2c2ccccc2)nc(CC)[nH+]1 ZINC001472795724 1063244772 /nfs/dbraw/zinc/24/47/72/1063244772.db2.gz NEWWUUVSAIAMLF-IBGZPJMESA-N 1 2 307.441 4.333 20 0 DIADLO CCc1cc(N[C@@H](CC)Cc2ccc(F)cc2)nc(CC)[nH+]1 ZINC001472829750 1063270363 /nfs/dbraw/zinc/27/03/63/1063270363.db2.gz YWXCYLMXKWMCLW-HNNXBMFYSA-N 1 2 301.409 4.174 20 0 DIADLO CC(C)c1cc(NC[C@@H]2CC3(CCC3)CO2)nc(C(C)C)[nH+]1 ZINC001472879467 1063296671 /nfs/dbraw/zinc/29/66/71/1063296671.db2.gz YWVNQATYZUDHEB-AWEZNQCLSA-N 1 2 303.450 4.095 20 0 DIADLO Cc1cc(N[C@H]2Cc3ccc(Cl)cc3C2)nc(C2CCC2)[nH+]1 ZINC001472897979 1063305558 /nfs/dbraw/zinc/30/55/58/1063305558.db2.gz WVGDWYMOPZCORV-INIZCTEOSA-N 1 2 313.832 4.285 20 0 DIADLO Cc1cc(N(C)[C@H]2CCc3ccccc3C2)nc(C2CCC2)[nH+]1 ZINC001472900895 1063308462 /nfs/dbraw/zinc/30/84/62/1063308462.db2.gz RSJCYMPVRSHSMU-SFHVURJKSA-N 1 2 307.441 4.046 20 0 DIADLO Cc1ccn2cc(C[NH2+]Cc3ccc(Cl)cc3Cl)nc2c1 ZINC001461171454 1063308668 /nfs/dbraw/zinc/30/86/68/1063308668.db2.gz WIOJIHDNGHGFDX-UHFFFAOYSA-N 1 2 320.223 4.239 20 0 DIADLO CCCCC[C@@H](C)[NH2+][C@@H](c1nnc(C)o1)c1ccccc1OC ZINC001257506698 1063317181 /nfs/dbraw/zinc/31/71/81/1063317181.db2.gz SCJLNTYNBZBHHV-CXAGYDPISA-N 1 2 317.433 4.034 20 0 DIADLO Cc1ccc(CSc2nccn2-c2cccc(F)c2)c(C)[nH+]1 ZINC001472948144 1063327247 /nfs/dbraw/zinc/32/72/47/1063327247.db2.gz WQAWNLOGWQLADV-UHFFFAOYSA-N 1 2 313.401 4.316 20 0 DIADLO CCCCC[C@H](C)[N@@H+]1CCc2nc(Br)sc2C1 ZINC001257517379 1063327512 /nfs/dbraw/zinc/32/75/12/1063327512.db2.gz WNXMXIMAEQZJEA-JTQLQIEISA-N 1 2 317.296 4.233 20 0 DIADLO CCCCC[C@H](C)[N@H+]1CCc2nc(Br)sc2C1 ZINC001257517379 1063327532 /nfs/dbraw/zinc/32/75/32/1063327532.db2.gz WNXMXIMAEQZJEA-JTQLQIEISA-N 1 2 317.296 4.233 20 0 DIADLO Cc1cccnc1SCc1c[nH+]c(N(C)C)c2ccccc12 ZINC001473040511 1063371545 /nfs/dbraw/zinc/37/15/45/1063371545.db2.gz XDTPMBBUHVSTGP-UHFFFAOYSA-N 1 2 309.438 4.297 20 0 DIADLO COc1ccc(Br)c(Cn2c[nH+]c(C(C)(C)C)c2)c1 ZINC001473069709 1063384823 /nfs/dbraw/zinc/38/48/23/1063384823.db2.gz KCXKLJKLDUNUJH-UHFFFAOYSA-N 1 2 323.234 4.000 20 0 DIADLO COc1ccccc1Cc1cn(Cc2cccc(Cl)c2)c[nH+]1 ZINC001473100868 1063398096 /nfs/dbraw/zinc/39/80/96/1063398096.db2.gz IERZRYMFHOJRBR-UHFFFAOYSA-N 1 2 312.800 4.184 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1CCc1cccc(Cl)c1Cl ZINC001473105504 1063400983 /nfs/dbraw/zinc/40/09/83/1063400983.db2.gz MCBBGYKTQYCWGQ-AAEUAGOBSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@H+]1CCc1cccc(Cl)c1Cl ZINC001473105504 1063400991 /nfs/dbraw/zinc/40/09/91/1063400991.db2.gz MCBBGYKTQYCWGQ-AAEUAGOBSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(OC(C)C)c(Cl)c1 ZINC001473105760 1063404170 /nfs/dbraw/zinc/40/41/70/1063404170.db2.gz NVPNXQRWDJWOGJ-DZGCQCFKSA-N 1 2 311.853 4.127 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(OC(C)C)c(Cl)c1 ZINC001473105760 1063404193 /nfs/dbraw/zinc/40/41/93/1063404193.db2.gz NVPNXQRWDJWOGJ-DZGCQCFKSA-N 1 2 311.853 4.127 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(OC(C)C)c(Cl)c1 ZINC001473105763 1063406778 /nfs/dbraw/zinc/40/67/78/1063406778.db2.gz NVPNXQRWDJWOGJ-ZFWWWQNUSA-N 1 2 311.853 4.127 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(OC(C)C)c(Cl)c1 ZINC001473105763 1063406803 /nfs/dbraw/zinc/40/68/03/1063406803.db2.gz NVPNXQRWDJWOGJ-ZFWWWQNUSA-N 1 2 311.853 4.127 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1CCc1c(Cl)cccc1Cl ZINC001473106413 1063407233 /nfs/dbraw/zinc/40/72/33/1063407233.db2.gz VEZDPTFBCQTPTQ-RYUDHWBXSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@H+]1CCc1c(Cl)cccc1Cl ZINC001473106413 1063407239 /nfs/dbraw/zinc/40/72/39/1063407239.db2.gz VEZDPTFBCQTPTQ-RYUDHWBXSA-N 1 2 302.245 4.035 20 0 DIADLO Cc1cc(CNc2ccc(C)c(OCC(F)F)c2)cc(C)[nH+]1 ZINC001461317997 1063413607 /nfs/dbraw/zinc/41/36/07/1063413607.db2.gz SJKKFDFJMFZODP-UHFFFAOYSA-N 1 2 306.356 4.263 20 0 DIADLO Cn1cc(CNc2ccc3c(c2)CCC[N@H+]3C)c(C2CCCC2)n1 ZINC001461328558 1063421748 /nfs/dbraw/zinc/42/17/48/1063421748.db2.gz CSMZVJCWRYQMSR-UHFFFAOYSA-N 1 2 324.472 4.072 20 0 DIADLO Cn1cc(CNc2ccc3c(c2)CCC[N@@H+]3C)c(C2CCCC2)n1 ZINC001461328558 1063421762 /nfs/dbraw/zinc/42/17/62/1063421762.db2.gz CSMZVJCWRYQMSR-UHFFFAOYSA-N 1 2 324.472 4.072 20 0 DIADLO CCc1nc(C[N@H+](C)C[C@@H]2CCC3(CCCCCC3)O2)cs1 ZINC001473120868 1063424731 /nfs/dbraw/zinc/42/47/31/1063424731.db2.gz CBXDWBMPHCDBNB-INIZCTEOSA-N 1 2 322.518 4.409 20 0 DIADLO CCc1nc(C[N@@H+](C)C[C@@H]2CCC3(CCCCCC3)O2)cs1 ZINC001473120868 1063424737 /nfs/dbraw/zinc/42/47/37/1063424737.db2.gz CBXDWBMPHCDBNB-INIZCTEOSA-N 1 2 322.518 4.409 20 0 DIADLO C[N@@H+](Cc1c(Cl)cccc1Cl)C[C@@H]1CCC(C)(C)O1 ZINC001473125300 1063431111 /nfs/dbraw/zinc/43/11/11/1063431111.db2.gz WYZAERXBNCRYQL-NSHDSACASA-N 1 2 302.245 4.383 20 0 DIADLO C[N@H+](Cc1c(Cl)cccc1Cl)C[C@@H]1CCC(C)(C)O1 ZINC001473125300 1063431116 /nfs/dbraw/zinc/43/11/16/1063431116.db2.gz WYZAERXBNCRYQL-NSHDSACASA-N 1 2 302.245 4.383 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC001473130447 1063438539 /nfs/dbraw/zinc/43/85/39/1063438539.db2.gz ZONPJSFWXLCPEG-INIZCTEOSA-N 1 2 323.436 4.271 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC001473130447 1063438552 /nfs/dbraw/zinc/43/85/52/1063438552.db2.gz ZONPJSFWXLCPEG-INIZCTEOSA-N 1 2 323.436 4.271 20 0 DIADLO Cc1cccc2cc(C[NH2+]Cc3cccc(F)n3)c(Cl)nc12 ZINC001461364545 1063446964 /nfs/dbraw/zinc/44/69/64/1063446964.db2.gz LZHWNKLUKOLPBJ-UHFFFAOYSA-N 1 2 315.779 4.021 20 0 DIADLO CCN(CC)c1ccc(NCc2c(F)cc(C)cc2F)c[nH+]1 ZINC001461366661 1063449904 /nfs/dbraw/zinc/44/99/04/1063449904.db2.gz MCTPAFWSVJBMSH-UHFFFAOYSA-N 1 2 305.372 4.127 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1cc(Br)cs1)C2 ZINC001473154856 1063459281 /nfs/dbraw/zinc/45/92/81/1063459281.db2.gz CPLXGPNCTFTKCR-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1cc(Br)cs1)C2 ZINC001473154856 1063459299 /nfs/dbraw/zinc/45/92/99/1063459299.db2.gz CPLXGPNCTFTKCR-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+]Cc1cc(Cl)ccc1F)CCC2 ZINC001461382436 1063462854 /nfs/dbraw/zinc/46/28/54/1063462854.db2.gz MLOZODVUVYIIKC-INIZCTEOSA-N 1 2 321.827 4.424 20 0 DIADLO Cc1cccc(-c2n[nH]cc2CNc2ccc([NH+](C)C)c(C)c2)c1 ZINC001461394882 1063472751 /nfs/dbraw/zinc/47/27/51/1063472751.db2.gz SSBBVZMDAXDDSP-UHFFFAOYSA-N 1 2 320.440 4.372 20 0 DIADLO CC(C)C[C@H](C)C[C@@H](C)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258070326 1063497253 /nfs/dbraw/zinc/49/72/53/1063497253.db2.gz PBOVWWLTAPSCDT-QWHCGFSZSA-N 1 2 317.399 4.178 20 0 DIADLO CC(C)C[C@H](C)C[C@@H](C)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258070326 1063497263 /nfs/dbraw/zinc/49/72/63/1063497263.db2.gz PBOVWWLTAPSCDT-QWHCGFSZSA-N 1 2 317.399 4.178 20 0 DIADLO CC(C)C[C@H](C)C[C@@H](C)[N@@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001258075714 1063503824 /nfs/dbraw/zinc/50/38/24/1063503824.db2.gz WKOKJLZCQZGCBX-JKSUJKDBSA-N 1 2 319.493 4.011 20 0 DIADLO CC(C)C[C@H](C)C[C@@H](C)[N@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001258075714 1063503834 /nfs/dbraw/zinc/50/38/34/1063503834.db2.gz WKOKJLZCQZGCBX-JKSUJKDBSA-N 1 2 319.493 4.011 20 0 DIADLO CC1=C(C)C[C@@](C)(C(=O)NCc2ccccc2-n2cc[nH+]c2)CC1 ZINC001546287597 1063505738 /nfs/dbraw/zinc/50/57/38/1063505738.db2.gz VXZYBFVBRWZMRS-FQEVSTJZSA-N 1 2 323.440 4.015 20 0 DIADLO C[C@@H](Nc1cc(N2CCCC2)nc[nH+]1)c1ccc(Cl)c(F)c1 ZINC001258123980 1063527943 /nfs/dbraw/zinc/52/79/43/1063527943.db2.gz KUWOBNPWJXDSPS-LLVKDONJSA-N 1 2 320.799 4.042 20 0 DIADLO C[C@@H](Nc1cc(N2CCCC2)[nH+]cn1)c1ccc(Cl)c(F)c1 ZINC001258123980 1063527955 /nfs/dbraw/zinc/52/79/55/1063527955.db2.gz KUWOBNPWJXDSPS-LLVKDONJSA-N 1 2 320.799 4.042 20 0 DIADLO Cc1cc(CNc2cncc3c2CCCC3)c2c([nH+]1)CCCC2 ZINC001461630382 1063625077 /nfs/dbraw/zinc/62/50/77/1063625077.db2.gz IYCJKFZOGYLYOY-UHFFFAOYSA-N 1 2 307.441 4.155 20 0 DIADLO COc1ccc(CC[C@H](C)[N@@H+]2CCC[C@@H](F)C(F)(F)C2)cc1 ZINC001258398253 1063637716 /nfs/dbraw/zinc/63/77/16/1063637716.db2.gz QYCJFWUPVNFHTO-XJKSGUPXSA-N 1 2 315.379 4.086 20 0 DIADLO COc1ccc(CC[C@H](C)[N@H+]2CCC[C@@H](F)C(F)(F)C2)cc1 ZINC001258398253 1063637725 /nfs/dbraw/zinc/63/77/25/1063637725.db2.gz QYCJFWUPVNFHTO-XJKSGUPXSA-N 1 2 315.379 4.086 20 0 DIADLO COc1ccc(CC[C@@H](C)[N@@H+]2Cc3cnc(Cl)cc3C2)cc1 ZINC001258409801 1063643143 /nfs/dbraw/zinc/64/31/43/1063643143.db2.gz IBZSHBIVUSYBGA-CYBMUJFWSA-N 1 2 316.832 4.081 20 0 DIADLO COc1ccc(CC[C@@H](C)[N@H+]2Cc3cnc(Cl)cc3C2)cc1 ZINC001258409801 1063643151 /nfs/dbraw/zinc/64/31/51/1063643151.db2.gz IBZSHBIVUSYBGA-CYBMUJFWSA-N 1 2 316.832 4.081 20 0 DIADLO Fc1cccc(C[NH2+]C2(c3c(F)cccc3F)CCC2)c1F ZINC001461665657 1063645218 /nfs/dbraw/zinc/64/52/18/1063645218.db2.gz ANVZALRSFSGUFV-UHFFFAOYSA-N 1 2 309.306 4.412 20 0 DIADLO CCn1nc(C[NH2+]Cc2ccc(C(C)(C)C)o2)c2ccccc21 ZINC001461697896 1063663764 /nfs/dbraw/zinc/66/37/64/1063663764.db2.gz MPAHIPBBSDWKMQ-UHFFFAOYSA-N 1 2 311.429 4.237 20 0 DIADLO COc1ccccc1CNc1[nH+]c2ccccc2n1C(C)(C)C ZINC001461723687 1063677771 /nfs/dbraw/zinc/67/77/71/1063677771.db2.gz UQPNBYDJLHCCFN-UHFFFAOYSA-N 1 2 309.413 4.412 20 0 DIADLO COc1ccc(CNc2[nH+]c3ccccc3n2C2CCCC2)o1 ZINC001461732290 1063686470 /nfs/dbraw/zinc/68/64/70/1063686470.db2.gz RVJKKFLHUQXXCD-UHFFFAOYSA-N 1 2 311.385 4.365 20 0 DIADLO Cc1cc(C)c2cc(NCc3cn4cccc(F)c4n3)ccc2[nH+]1 ZINC001461751940 1063695918 /nfs/dbraw/zinc/69/59/18/1063695918.db2.gz OSJITJXDWHIZFJ-UHFFFAOYSA-N 1 2 320.371 4.251 20 0 DIADLO Cc1cc(C)c2cc(NCc3cccc4c3OCC4)ccc2[nH+]1 ZINC001461753149 1063696093 /nfs/dbraw/zinc/69/60/93/1063696093.db2.gz SFCWDOJDJNNDDX-UHFFFAOYSA-N 1 2 304.393 4.399 20 0 DIADLO Cc1cc(C)c(C(=O)N(C)CCCCc2ccccc2)c(C)[nH+]1 ZINC001516418100 1063740527 /nfs/dbraw/zinc/74/05/27/1063740527.db2.gz ICLLSCPMXUOCJN-UHFFFAOYSA-N 1 2 310.441 4.102 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1cccc(Br)c1F ZINC001461840590 1063743752 /nfs/dbraw/zinc/74/37/52/1063743752.db2.gz AGIBEALDMISAMR-UHFFFAOYSA-N 1 2 312.182 4.203 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1cccc(Br)c1F ZINC001461840590 1063743758 /nfs/dbraw/zinc/74/37/58/1063743758.db2.gz AGIBEALDMISAMR-UHFFFAOYSA-N 1 2 312.182 4.203 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@@H]1C[C@@H](C)CC(C)(C)C1)[C@H]2C ZINC001258698612 1063757881 /nfs/dbraw/zinc/75/78/81/1063757881.db2.gz XGICDHKZCGTGTO-OWCLPIDISA-N 1 2 319.493 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@@H]1C[C@@H](C)CC(C)(C)C1)[C@H]2C ZINC001258698612 1063757894 /nfs/dbraw/zinc/75/78/94/1063757894.db2.gz XGICDHKZCGTGTO-OWCLPIDISA-N 1 2 319.493 4.011 20 0 DIADLO Cc1ccccc1N1CC[NH+](Cc2ccc(F)c(Cl)c2)CC1 ZINC001461874073 1063763700 /nfs/dbraw/zinc/76/37/00/1063763700.db2.gz LRGMACVRNMNMMY-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO COc1cc(Cl)c(C[NH+]2C[C@H](C)S[C@@H](C)C2)cc1Cl ZINC001461893821 1063782347 /nfs/dbraw/zinc/78/23/47/1063782347.db2.gz BELUUTVONVPLFY-UWVGGRQHSA-N 1 2 320.285 4.328 20 0 DIADLO Clc1cccc(Cl)c1CCC[N@@H+]1CCOC[C@H]1C1CC1 ZINC001461920902 1063803787 /nfs/dbraw/zinc/80/37/87/1063803787.db2.gz NKSBBSWNFOVPSG-INIZCTEOSA-N 1 2 314.256 4.037 20 0 DIADLO Clc1cccc(Cl)c1CCC[N@H+]1CCOC[C@H]1C1CC1 ZINC001461920902 1063803795 /nfs/dbraw/zinc/80/37/95/1063803795.db2.gz NKSBBSWNFOVPSG-INIZCTEOSA-N 1 2 314.256 4.037 20 0 DIADLO CCCC[C@H](CCC)[N@@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001258761474 1063807343 /nfs/dbraw/zinc/80/73/43/1063807343.db2.gz MDDWOWLMALMGFU-CVEARBPZSA-N 1 2 307.482 4.155 20 0 DIADLO CCCC[C@H](CCC)[N@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001258761474 1063807358 /nfs/dbraw/zinc/80/73/58/1063807358.db2.gz MDDWOWLMALMGFU-CVEARBPZSA-N 1 2 307.482 4.155 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)o1 ZINC001461936952 1063824950 /nfs/dbraw/zinc/82/49/50/1063824950.db2.gz SZUHNMFCPCACTR-RHSMWYFYSA-N 1 2 317.454 4.272 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)o1 ZINC001461936952 1063824967 /nfs/dbraw/zinc/82/49/67/1063824967.db2.gz SZUHNMFCPCACTR-RHSMWYFYSA-N 1 2 317.454 4.272 20 0 DIADLO COc1ccc(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)c(F)c1 ZINC001461943498 1063827617 /nfs/dbraw/zinc/82/76/17/1063827617.db2.gz ZPTXFIPMUQFNMJ-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)c(F)c1 ZINC001461943498 1063827625 /nfs/dbraw/zinc/82/76/25/1063827625.db2.gz ZPTXFIPMUQFNMJ-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO Nc1ncccc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC001461945373 1063829919 /nfs/dbraw/zinc/82/99/19/1063829919.db2.gz OTFBCWWZZRIJDQ-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ncccc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC001461945373 1063829939 /nfs/dbraw/zinc/82/99/39/1063829939.db2.gz OTFBCWWZZRIJDQ-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO CCOCc1cnc2n1CC[N@H+](C1CCC(C(C)C)CC1)[C@H]2C ZINC001258803931 1063837179 /nfs/dbraw/zinc/83/71/79/1063837179.db2.gz IAUHLAXDPMNMBV-GTPINHCMSA-N 1 2 319.493 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+](C1CCC(C(C)C)CC1)[C@H]2C ZINC001258803931 1063837192 /nfs/dbraw/zinc/83/71/92/1063837192.db2.gz IAUHLAXDPMNMBV-GTPINHCMSA-N 1 2 319.493 4.011 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@@H+]2CCO[C@@H](c3ccco3)C2)c(C)c1 ZINC001461966944 1063845489 /nfs/dbraw/zinc/84/54/89/1063845489.db2.gz JJIYECVTJMSLHF-RDBXKPKDSA-N 1 2 311.425 4.292 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@H+]2CCO[C@@H](c3ccco3)C2)c(C)c1 ZINC001461966944 1063845502 /nfs/dbraw/zinc/84/55/02/1063845502.db2.gz JJIYECVTJMSLHF-RDBXKPKDSA-N 1 2 311.425 4.292 20 0 DIADLO CCOc1cccc(F)c1C[N@H+](C)[C@@H](C)c1sc(C)nc1C ZINC001461973596 1063851457 /nfs/dbraw/zinc/85/14/57/1063851457.db2.gz GGJHUSGTWRTENC-LBPRGKRZSA-N 1 2 322.449 4.491 20 0 DIADLO CCOc1cccc(F)c1C[N@@H+](C)[C@@H](C)c1sc(C)nc1C ZINC001461973596 1063851474 /nfs/dbraw/zinc/85/14/74/1063851474.db2.gz GGJHUSGTWRTENC-LBPRGKRZSA-N 1 2 322.449 4.491 20 0 DIADLO C[C@H](CCOCc1ccccc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001461987346 1063858022 /nfs/dbraw/zinc/85/80/22/1063858022.db2.gz GVYKGFGNIJTVCP-QGZVFWFLSA-N 1 2 321.424 4.280 20 0 DIADLO CC(C)CC(CC(C)C)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258835364 1063859060 /nfs/dbraw/zinc/85/90/60/1063859060.db2.gz RJELLWAGEITGNI-UHFFFAOYSA-N 1 2 317.399 4.178 20 0 DIADLO CC(C)CC(CC(C)C)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258835364 1063859073 /nfs/dbraw/zinc/85/90/73/1063859073.db2.gz RJELLWAGEITGNI-UHFFFAOYSA-N 1 2 317.399 4.178 20 0 DIADLO CC[C@@H]1C[N@H+](CCCc2c(Cl)cccc2Cl)C[C@@H](C)O1 ZINC001461985159 1063860441 /nfs/dbraw/zinc/86/04/41/1063860441.db2.gz DRLLGBRHTFPPHG-CHWSQXEVSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@@H]1C[N@@H+](CCCc2c(Cl)cccc2Cl)C[C@@H](C)O1 ZINC001461985159 1063860452 /nfs/dbraw/zinc/86/04/52/1063860452.db2.gz DRLLGBRHTFPPHG-CHWSQXEVSA-N 1 2 316.272 4.425 20 0 DIADLO C[C@H]([NH2+][C@@H]1CC[C@H](c2ccc(Cl)cc2)C1)C(=O)OC(C)(C)C ZINC001462016176 1063880927 /nfs/dbraw/zinc/88/09/27/1063880927.db2.gz ZAZOYCGNIBGQAB-DUVNUKRYSA-N 1 2 323.864 4.296 20 0 DIADLO COc1ccc(C[N@H+](Cc2nc(C(C)(C)C)co2)C2CC2)cc1 ZINC001462048625 1063902886 /nfs/dbraw/zinc/90/28/86/1063902886.db2.gz SWOADPFVOIILDZ-UHFFFAOYSA-N 1 2 314.429 4.145 20 0 DIADLO COc1ccc(C[N@@H+](Cc2nc(C(C)(C)C)co2)C2CC2)cc1 ZINC001462048625 1063902897 /nfs/dbraw/zinc/90/28/97/1063902897.db2.gz SWOADPFVOIILDZ-UHFFFAOYSA-N 1 2 314.429 4.145 20 0 DIADLO C[C@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2ncc[nH]2)c2ccsc2S1 ZINC001462061652 1063908545 /nfs/dbraw/zinc/90/85/45/1063908545.db2.gz QTFCFCBAPKCASM-CYZMBNFOSA-N 1 2 305.472 4.234 20 0 DIADLO C[C@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ncc[nH]2)c2ccsc2S1 ZINC001462061652 1063908562 /nfs/dbraw/zinc/90/85/62/1063908562.db2.gz QTFCFCBAPKCASM-CYZMBNFOSA-N 1 2 305.472 4.234 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2cccc(O)c2Cl)CCC1 ZINC001261237815 1063914353 /nfs/dbraw/zinc/91/43/53/1063914353.db2.gz GLHWZMWPESJBSZ-UHFFFAOYSA-N 1 2 317.816 4.223 20 0 DIADLO Cc1ccc(N[C@H](C)c2ncc(-c3ccccc3)n2C)c(C)[nH+]1 ZINC001261276397 1063918143 /nfs/dbraw/zinc/91/81/43/1063918143.db2.gz HPOPQEINQLNPND-OAHLLOKOSA-N 1 2 306.413 4.272 20 0 DIADLO CC(C)Oc1ccc[nH+]c1N[C@H](C)CCc1ccccc1F ZINC001462106478 1063932784 /nfs/dbraw/zinc/93/27/84/1063932784.db2.gz RBUJJKNQBAQOBB-CQSZACIVSA-N 1 2 302.393 4.441 20 0 DIADLO CCCCC[C@H]([NH2+]C[C@@H](C)c1cccc(Cl)c1)C(=O)OC ZINC001462117986 1063937889 /nfs/dbraw/zinc/93/78/89/1063937889.db2.gz ZMAOFNKIWMNVEI-CJNGLKHVSA-N 1 2 311.853 4.155 20 0 DIADLO FC(F)CCNc1[nH+]ccc2cc(Br)ccc21 ZINC001262726125 1063972777 /nfs/dbraw/zinc/97/27/77/1063972777.db2.gz XJCFVTKNDLUMFF-UHFFFAOYSA-N 1 2 301.134 4.064 20 0 DIADLO COc1cc(CNc2ccc(C)[nH+]c2C)ccc1OC(C)C ZINC000378897034 1063979671 /nfs/dbraw/zinc/97/96/71/1063979671.db2.gz AUHVHKYIFAVIAY-UHFFFAOYSA-N 1 2 300.402 4.106 20 0 DIADLO COc1ccc(Cl)cc1CNc1cccc(-n2cc[nH+]c2)c1 ZINC000378885082 1063980016 /nfs/dbraw/zinc/98/00/16/1063980016.db2.gz LIKPWRLVMHNKDN-UHFFFAOYSA-N 1 2 313.788 4.146 20 0 DIADLO CC1(C)CCC(CC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001264340539 1064078708 /nfs/dbraw/zinc/07/87/08/1064078708.db2.gz ZNECWGNIGJAAHU-UHFFFAOYSA-N 1 2 311.429 4.417 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccccc3CC(C)(C)C)ccc2[nH+]1 ZINC001264858060 1064151848 /nfs/dbraw/zinc/15/18/48/1064151848.db2.gz RHIWRNBOBGDFHP-UHFFFAOYSA-N 1 2 321.424 4.484 20 0 DIADLO CCN(CC)c1ccc(NCc2ccc(OC(C)C)cc2)c[nH+]1 ZINC000390268143 1064154057 /nfs/dbraw/zinc/15/40/57/1064154057.db2.gz AAQLJGQBMHVZKM-UHFFFAOYSA-N 1 2 313.445 4.327 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)c1cc(Cl)cc2ccccc21 ZINC001265164937 1064198217 /nfs/dbraw/zinc/19/82/17/1064198217.db2.gz ABVPMURWTGTYHU-UHFFFAOYSA-N 1 2 321.767 4.393 20 0 DIADLO CC[C@@H]1CCC[N@@H+]1Cc1ccc(Br)c(F)c1F ZINC000701281880 1064245022 /nfs/dbraw/zinc/24/50/22/1064245022.db2.gz OACHWWKZHKBYGX-SNVBAGLBSA-N 1 2 304.178 4.102 20 0 DIADLO CC[C@@H]1CCC[N@H+]1Cc1ccc(Br)c(F)c1F ZINC000701281880 1064245025 /nfs/dbraw/zinc/24/50/25/1064245025.db2.gz OACHWWKZHKBYGX-SNVBAGLBSA-N 1 2 304.178 4.102 20 0 DIADLO CC[C@@]1(C)CC[N@H+](Cc2ccc(Br)c(F)c2F)C1 ZINC000701295643 1064246545 /nfs/dbraw/zinc/24/65/45/1064246545.db2.gz RUJUINIUBNLZIW-AWEZNQCLSA-N 1 2 318.205 4.349 20 0 DIADLO CC[C@@]1(C)CC[N@@H+](Cc2ccc(Br)c(F)c2F)C1 ZINC000701295643 1064246553 /nfs/dbraw/zinc/24/65/53/1064246553.db2.gz RUJUINIUBNLZIW-AWEZNQCLSA-N 1 2 318.205 4.349 20 0 DIADLO Fc1cccc(C2CC(Nc3cccc(-n4cc[nH+]c4)c3)C2)c1 ZINC000393412206 1064279174 /nfs/dbraw/zinc/27/91/74/1064279174.db2.gz QRHCJTLTOYCSRV-UHFFFAOYSA-N 1 2 307.372 4.370 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001290756213 1064710276 /nfs/dbraw/zinc/71/02/76/1064710276.db2.gz CKWRIYBHJLIXDJ-NSHDSACASA-N 1 2 313.788 4.050 20 0 DIADLO CCc1cc(NCCc2c[nH]c3c2cccc3CC)nc(CC)[nH+]1 ZINC001306970056 1064727547 /nfs/dbraw/zinc/72/75/47/1064727547.db2.gz MXDZFJMAHFLDNW-UHFFFAOYSA-N 1 2 322.456 4.300 20 0 DIADLO Cc1cc(N(Cc2cccc(O)c2)CC2CC2)nc(C2CCC2)[nH+]1 ZINC001307075383 1064738688 /nfs/dbraw/zinc/73/86/88/1064738688.db2.gz NECOMXMSKAGFPS-UHFFFAOYSA-N 1 2 323.440 4.175 20 0 DIADLO Cc1nc(NC[C@@H]2CCCCC(F)(F)C2)c2c([nH+]1)CCCC2 ZINC001307130294 1064765462 /nfs/dbraw/zinc/76/54/62/1064765462.db2.gz PGHHTKCBZLVXGY-CYBMUJFWSA-N 1 2 309.404 4.291 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cscc1C(F)F ZINC001292296929 1064766800 /nfs/dbraw/zinc/76/68/00/1064766800.db2.gz AGMLWAOKLFGWLI-UHFFFAOYSA-N 1 2 319.336 4.328 20 0 DIADLO O=C(CCCCc1ccccc1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001292299964 1064767431 /nfs/dbraw/zinc/76/74/31/1064767431.db2.gz WFGDPADYYTZIFS-UHFFFAOYSA-N 1 2 319.408 4.428 20 0 DIADLO CCCCSCCC(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001292864295 1064791715 /nfs/dbraw/zinc/79/17/15/1064791715.db2.gz IKVOZJXDDDFVEV-UHFFFAOYSA-N 1 2 317.458 4.043 20 0 DIADLO Cc1ccc2c(c1)[C@@H](Nc1nc(C)[nH+]c3c1CCCC3)[C@H](C)C2 ZINC001307167856 1064832196 /nfs/dbraw/zinc/83/21/96/1064832196.db2.gz GWIQYWVZGFPPIB-YJYMSZOUSA-N 1 2 307.441 4.318 20 0 DIADLO CCc1cc(N2CC[C@H](c3ccc(C)cc3)C2(C)C)nc(C)[nH+]1 ZINC001307193552 1064912994 /nfs/dbraw/zinc/91/29/94/1064912994.db2.gz FWZZHFUZEWMFJF-GOSISDBHSA-N 1 2 309.457 4.428 20 0 DIADLO CN(C)c1cc[nH+]c(NC(=O)c2ccccc2-c2ccccc2)c1 ZINC001295561113 1064917047 /nfs/dbraw/zinc/91/70/47/1064917047.db2.gz YBPBBGKMKIKCGC-UHFFFAOYSA-N 1 2 317.392 4.067 20 0 DIADLO Cc1cc(NC[C@]2(c3ccccc3)CCCO2)nc(C2CCC2)[nH+]1 ZINC001307216706 1064961848 /nfs/dbraw/zinc/96/18/48/1064961848.db2.gz PLECGGWQWCMJJP-FQEVSTJZSA-N 1 2 323.440 4.170 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1ccc2c(c1)C=CCCC2)n1cc[nH+]c1 ZINC001300913711 1065046174 /nfs/dbraw/zinc/04/61/74/1065046174.db2.gz NFDYMUYMGTWQIY-LJQANCHMSA-N 1 2 323.440 4.459 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1 ZINC001305934058 1065167834 /nfs/dbraw/zinc/16/78/34/1065167834.db2.gz NRYRAKCYDDXEPK-INIZCTEOSA-N 1 2 319.493 4.187 20 0 DIADLO Cc1cc(C)cc(CC(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1 ZINC001306837611 1065195298 /nfs/dbraw/zinc/19/52/98/1065195298.db2.gz JZOFOYQESQWHAM-UHFFFAOYSA-N 1 2 319.408 4.183 20 0 DIADLO COc1cccc([C@H]2CCCN2c2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC001306922399 1065206411 /nfs/dbraw/zinc/20/64/11/1065206411.db2.gz MJVOVWXMYCCMHL-GOSISDBHSA-N 1 2 323.440 4.403 20 0 DIADLO COc1cccc([C@@H]2CCCN2c2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC001306922400 1065207169 /nfs/dbraw/zinc/20/71/69/1065207169.db2.gz MJVOVWXMYCCMHL-SFHVURJKSA-N 1 2 323.440 4.403 20 0 DIADLO CC(C)c1cc(N[C@H](CCO)C2CCCCC2)nc(C(C)C)[nH+]1 ZINC001306965862 1065224441 /nfs/dbraw/zinc/22/44/41/1065224441.db2.gz QZVFTXAAEMMCSU-MRXNPFEDSA-N 1 2 319.493 4.467 20 0 DIADLO Cc1ccc2sc(N3CCC(c4c[nH]c[nH+]4)CC3)nc2c1C ZINC001306989499 1065238966 /nfs/dbraw/zinc/23/89/66/1065238966.db2.gz MMKORMKTXXICRH-UHFFFAOYSA-N 1 2 312.442 4.020 20 0 DIADLO CCS[C@H]1CCCC[C@@H]1Nc1nc(C)[nH+]c2c1CCCC2 ZINC001306992538 1065239557 /nfs/dbraw/zinc/23/95/57/1065239557.db2.gz BXFIVZFRQFKOCF-HOTGVXAUSA-N 1 2 305.491 4.140 20 0 DIADLO CCS[C@H]1CCCC[C@H]1Nc1nc(C)[nH+]c2c1CCCC2 ZINC001306992536 1065239961 /nfs/dbraw/zinc/23/99/61/1065239961.db2.gz BXFIVZFRQFKOCF-CVEARBPZSA-N 1 2 305.491 4.140 20 0 DIADLO CCO[C@H](CCNc1nc(C)[nH+]c2c1CCCC2)C1CCCC1 ZINC001306990946 1065240081 /nfs/dbraw/zinc/24/00/81/1065240081.db2.gz QDEXGKNAGTYOJK-GOSISDBHSA-N 1 2 317.477 4.061 20 0 DIADLO CO[C@@H]1[C@H](C)[C@@H](Nc2cc(C(C)C)[nH+]c(C(C)C)n2)C1(C)C ZINC001307079535 1065251696 /nfs/dbraw/zinc/25/16/96/1065251696.db2.gz XWVUPRXMHFOYOI-DAXOMENPSA-N 1 2 305.466 4.195 20 0 DIADLO CC(C)c1cc(NCC2([C@@H](C)CCO)CCC2)nc(C(C)C)[nH+]1 ZINC001307082417 1065253385 /nfs/dbraw/zinc/25/33/85/1065253385.db2.gz BOSVRXSHIFMULG-HNNXBMFYSA-N 1 2 319.493 4.324 20 0 DIADLO Cc1nc(NCCn2c3ccccc3c3ccccc32)cc[nH+]1 ZINC001307080422 1065253920 /nfs/dbraw/zinc/25/39/20/1065253920.db2.gz HYYVVSWMHZEHTM-UHFFFAOYSA-N 1 2 302.381 4.005 20 0 DIADLO Cc1cc(NCCCc2c[nH]c3ccc(F)cc23)nc(C2CC2)[nH+]1 ZINC001307118102 1065270329 /nfs/dbraw/zinc/27/03/29/1065270329.db2.gz JHUHGXFLSMRJEP-UHFFFAOYSA-N 1 2 324.403 4.328 20 0 DIADLO FC1(F)CCCC[C@@H]1CNc1nc2ccccc2n2c[nH+]cc12 ZINC001307126772 1065273049 /nfs/dbraw/zinc/27/30/49/1065273049.db2.gz IXNOJDDCMVJUJQ-GFCCVEGCSA-N 1 2 316.355 4.120 20 0 DIADLO Cc1cc(N2[C@H](C)C[C@@H](c3ccccc3)[C@@H]2C)nc(C2CC2)[nH+]1 ZINC001307129329 1065276318 /nfs/dbraw/zinc/27/63/18/1065276318.db2.gz ZBCZKECZNSQXSM-RVKKMQEKSA-N 1 2 307.441 4.433 20 0 DIADLO Cc1cc(N2CC[C@@H](c3ccccc3)C2(C)C)nc(C2CC2)[nH+]1 ZINC001307146822 1065283999 /nfs/dbraw/zinc/28/39/99/1065283999.db2.gz TWTZNDVAHAERTA-KRWDZBQOSA-N 1 2 307.441 4.435 20 0 DIADLO Cc1ccc2[nH]cc(CCNc3cc(C)[nH+]c(C4CCC4)n3)c2c1 ZINC001307230118 1065309551 /nfs/dbraw/zinc/30/95/51/1065309551.db2.gz LNIBDTXXFJWRPE-UHFFFAOYSA-N 1 2 320.440 4.497 20 0 DIADLO FC1(F)CC[C@H](CCNc2nc3ccccc3n3c[nH+]cc23)C1 ZINC001307229785 1065310141 /nfs/dbraw/zinc/31/01/41/1065310141.db2.gz VYIHZHVYUZFQHC-GFCCVEGCSA-N 1 2 316.355 4.120 20 0 DIADLO Cc1cc(C)c(CSc2nnc(Cc3ccccc3)[nH]2)c(C)[nH+]1 ZINC001307334179 1065346164 /nfs/dbraw/zinc/34/61/64/1065346164.db2.gz WTTRDMKNFBLYRE-UHFFFAOYSA-N 1 2 324.453 4.008 20 0 DIADLO Cc1cc(C)c(CSc2nc(Cc3ccccc3)n[nH]2)c(C)[nH+]1 ZINC001307334179 1065346174 /nfs/dbraw/zinc/34/61/74/1065346174.db2.gz WTTRDMKNFBLYRE-UHFFFAOYSA-N 1 2 324.453 4.008 20 0 DIADLO CCC[N@H+](C/C=C/Cl)Cc1ccccc1Br ZINC001307437213 1065396123 /nfs/dbraw/zinc/39/61/23/1065396123.db2.gz DIWONFIBTANTRU-VMPITWQZSA-N 1 2 302.643 4.414 20 0 DIADLO CCC[N@@H+](C/C=C/Cl)Cc1ccccc1Br ZINC001307437213 1065396129 /nfs/dbraw/zinc/39/61/29/1065396129.db2.gz DIWONFIBTANTRU-VMPITWQZSA-N 1 2 302.643 4.414 20 0 DIADLO C[N@H+](CCCOc1ccc(Cl)cc1)C/C(Cl)=C/Cl ZINC001307422086 1065384082 /nfs/dbraw/zinc/38/40/82/1065384082.db2.gz GQIVVIFASUMRDT-XFXZXTDPSA-N 1 2 308.636 4.360 20 0 DIADLO C[N@@H+](CCCOc1ccc(Cl)cc1)C/C(Cl)=C/Cl ZINC001307422086 1065384087 /nfs/dbraw/zinc/38/40/87/1065384087.db2.gz GQIVVIFASUMRDT-XFXZXTDPSA-N 1 2 308.636 4.360 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+](CC)Cc2ccc3ccccc3c2)[nH]1 ZINC001307429861 1065391823 /nfs/dbraw/zinc/39/18/23/1065391823.db2.gz XNFCHZFQRMDGED-CQSZACIVSA-N 1 2 308.429 4.103 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+](CC)Cc2ccc3ccccc3c2)[nH]1 ZINC001307429861 1065391829 /nfs/dbraw/zinc/39/18/29/1065391829.db2.gz XNFCHZFQRMDGED-CQSZACIVSA-N 1 2 308.429 4.103 20 0 DIADLO Cc1ccc([C@H]2COCC[N@H+]2Cc2ccccc2CC(C)C)o1 ZINC001307472948 1065421069 /nfs/dbraw/zinc/42/10/69/1065421069.db2.gz OMNYTRSGYCWEKI-LJQANCHMSA-N 1 2 313.441 4.360 20 0 DIADLO Cc1ccc([C@H]2COCC[N@@H+]2Cc2ccccc2CC(C)C)o1 ZINC001307472948 1065421077 /nfs/dbraw/zinc/42/10/77/1065421077.db2.gz OMNYTRSGYCWEKI-LJQANCHMSA-N 1 2 313.441 4.360 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2CC(=O)c2ccccc2F)o1 ZINC001307498582 1065442244 /nfs/dbraw/zinc/44/22/44/1065442244.db2.gz YRSDYYJCGZWLCK-GUYCJALGSA-N 1 2 315.388 4.383 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2CC(=O)c2ccccc2F)o1 ZINC001307498582 1065442246 /nfs/dbraw/zinc/44/22/46/1065442246.db2.gz YRSDYYJCGZWLCK-GUYCJALGSA-N 1 2 315.388 4.383 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CN1CCCc2cc(F)ccc21 ZINC001307541119 1065472342 /nfs/dbraw/zinc/47/23/42/1065472342.db2.gz LDECVTBAKHWXRD-UHFFFAOYSA-N 1 2 321.399 4.273 20 0 DIADLO CN(C)c1cc(CN(c2ccccc2F)C2CCCC2)cc[nH+]1 ZINC001307548307 1065476894 /nfs/dbraw/zinc/47/68/94/1065476894.db2.gz QUPXARIXQNWCGS-UHFFFAOYSA-N 1 2 313.420 4.236 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1cc(F)ccc1OC(F)F ZINC001307562584 1065484271 /nfs/dbraw/zinc/48/42/71/1065484271.db2.gz MFPUDPXVPQLBLJ-HNNXBMFYSA-N 1 2 324.346 4.103 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1cc(F)ccc1OC(F)F ZINC001307562584 1065484276 /nfs/dbraw/zinc/48/42/76/1065484276.db2.gz MFPUDPXVPQLBLJ-HNNXBMFYSA-N 1 2 324.346 4.103 20 0 DIADLO CC(C)(C)OC(=O)C[N@H+](Cc1ccccc1F)C1CCCCC1 ZINC001307592617 1065503776 /nfs/dbraw/zinc/50/37/76/1065503776.db2.gz PFSLXWZWQTZQAW-UHFFFAOYSA-N 1 2 321.436 4.302 20 0 DIADLO CC(C)(C)OC(=O)C[N@@H+](Cc1ccccc1F)C1CCCCC1 ZINC001307592617 1065503783 /nfs/dbraw/zinc/50/37/83/1065503783.db2.gz PFSLXWZWQTZQAW-UHFFFAOYSA-N 1 2 321.436 4.302 20 0 DIADLO CCNc1nc(C[NH2+][C@H](C)c2ccc(Cl)c(F)c2)cs1 ZINC001307636121 1065533498 /nfs/dbraw/zinc/53/34/98/1065533498.db2.gz CZDZYEHRUPDUKO-SECBINFHSA-N 1 2 313.829 4.218 20 0 DIADLO CC(C)(C)C[N@H+](CC1CCC2(CC1)OCCO2)c1ccccc1 ZINC001307700587 1065571131 /nfs/dbraw/zinc/57/11/31/1065571131.db2.gz QCAHPBXZYVNELT-UHFFFAOYSA-N 1 2 317.473 4.472 20 0 DIADLO CC(C)(C)C[N@@H+](CC1CCC2(CC1)OCCO2)c1ccccc1 ZINC001307700587 1065571139 /nfs/dbraw/zinc/57/11/39/1065571139.db2.gz QCAHPBXZYVNELT-UHFFFAOYSA-N 1 2 317.473 4.472 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCC[N@@H+]2CC2=NOCC2)c1 ZINC001307711329 1065579432 /nfs/dbraw/zinc/57/94/32/1065579432.db2.gz ZBYGOTYJNLSSHW-OAHLLOKOSA-N 1 2 312.335 4.009 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCC[N@H+]2CC2=NOCC2)c1 ZINC001307711329 1065579442 /nfs/dbraw/zinc/57/94/42/1065579442.db2.gz ZBYGOTYJNLSSHW-OAHLLOKOSA-N 1 2 312.335 4.009 20 0 DIADLO CCCC[C@@H](CC)C[NH2+][C@@](CC)(C(=O)OC)c1ccccc1 ZINC001307759591 1065609273 /nfs/dbraw/zinc/60/92/73/1065609273.db2.gz AGDKVLPHUFIZGK-VQIMIIECSA-N 1 2 305.462 4.271 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(C3CCCC3)cc2)C[C@H](C)[S@@]1=O ZINC001307758989 1065609898 /nfs/dbraw/zinc/60/98/98/1065609898.db2.gz DVLJTQFVUGVGEX-LYLBAIIYSA-N 1 2 319.514 4.076 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(C3CCCC3)cc2)C[C@H](C)[S@@]1=O ZINC001307758989 1065609902 /nfs/dbraw/zinc/60/99/02/1065609902.db2.gz DVLJTQFVUGVGEX-LYLBAIIYSA-N 1 2 319.514 4.076 20 0 DIADLO CC[N@H+](Cc1occc1C)Cc1cc2c(cc1Cl)OCCO2 ZINC001307851576 1065652452 /nfs/dbraw/zinc/65/24/52/1065652452.db2.gz RZEKOGIGGYHZTN-UHFFFAOYSA-N 1 2 321.804 4.035 20 0 DIADLO CC[N@@H+](Cc1occc1C)Cc1cc2c(cc1Cl)OCCO2 ZINC001307851576 1065652465 /nfs/dbraw/zinc/65/24/65/1065652465.db2.gz RZEKOGIGGYHZTN-UHFFFAOYSA-N 1 2 321.804 4.035 20 0 DIADLO CC[C@H]1C[NH+](CCc2cc(Cl)cc(Cl)c2)C[C@H](CC)O1 ZINC001307856552 1065656241 /nfs/dbraw/zinc/65/62/41/1065656241.db2.gz LTJGIEOFADYHAB-HOTGVXAUSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@@H]1C[N@@H+](CCc2cc(Cl)cc(Cl)c2)C[C@H](CC)O1 ZINC001307856554 1065656824 /nfs/dbraw/zinc/65/68/24/1065656824.db2.gz LTJGIEOFADYHAB-IYBDPMFKSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@@H]1C[N@H+](CCc2cc(Cl)cc(Cl)c2)C[C@H](CC)O1 ZINC001307856554 1065656830 /nfs/dbraw/zinc/65/68/30/1065656830.db2.gz LTJGIEOFADYHAB-IYBDPMFKSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ncc(-c3ccc(C)cc3)o2)[C@H](CC)CO1 ZINC001307907888 1065678697 /nfs/dbraw/zinc/67/86/97/1065678697.db2.gz OANQZHMGEMCWBR-IAGOWNOFSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ncc(-c3ccc(C)cc3)o2)[C@H](CC)CO1 ZINC001307907888 1065678701 /nfs/dbraw/zinc/67/87/01/1065678701.db2.gz OANQZHMGEMCWBR-IAGOWNOFSA-N 1 2 314.429 4.039 20 0 DIADLO Cc1ccc(C[C@]2(C)CCC[N@@H+]2CC(F)(F)C(F)F)cc1 ZINC001307972968 1065707530 /nfs/dbraw/zinc/70/75/30/1065707530.db2.gz UKIWXOBGGIVGMR-HNNXBMFYSA-N 1 2 303.343 4.292 20 0 DIADLO Cc1ccc(C[C@]2(C)CCC[N@H+]2CC(F)(F)C(F)F)cc1 ZINC001307972968 1065707539 /nfs/dbraw/zinc/70/75/39/1065707539.db2.gz UKIWXOBGGIVGMR-HNNXBMFYSA-N 1 2 303.343 4.292 20 0 DIADLO COc1cc(C)[nH+]c(CN2CC(C)(C)c3cc(Cl)ccc32)c1 ZINC001307992514 1065714058 /nfs/dbraw/zinc/71/40/58/1065714058.db2.gz XPHVSFBLYNDYEP-UHFFFAOYSA-N 1 2 316.832 4.350 20 0 DIADLO Clc1ccc(C[N@@H+]2Cc3ccccc3OC3(CCC3)C2)cn1 ZINC001308066061 1065747370 /nfs/dbraw/zinc/74/73/70/1065747370.db2.gz LJDAQTASGZDACR-UHFFFAOYSA-N 1 2 314.816 4.052 20 0 DIADLO Clc1ccc(C[N@H+]2Cc3ccccc3OC3(CCC3)C2)cn1 ZINC001308066061 1065747378 /nfs/dbraw/zinc/74/73/78/1065747378.db2.gz LJDAQTASGZDACR-UHFFFAOYSA-N 1 2 314.816 4.052 20 0 DIADLO FC(F)C[N@H+](CCc1cccc(OC(F)(F)F)c1)C1CCC1 ZINC001308081727 1065755214 /nfs/dbraw/zinc/75/52/14/1065755214.db2.gz KDXQQBNARRXBDD-UHFFFAOYSA-N 1 2 323.305 4.247 20 0 DIADLO FC(F)C[N@@H+](CCc1cccc(OC(F)(F)F)c1)C1CCC1 ZINC001308081727 1065755227 /nfs/dbraw/zinc/75/52/27/1065755227.db2.gz KDXQQBNARRXBDD-UHFFFAOYSA-N 1 2 323.305 4.247 20 0 DIADLO CCOc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)c(C)c1 ZINC001308212141 1065819233 /nfs/dbraw/zinc/81/92/33/1065819233.db2.gz MLJXHAJZNOUXSJ-UHFFFAOYSA-N 1 2 307.397 4.192 20 0 DIADLO Fc1ccc2oc(C[NH2+]Cc3ccn(-c4ccccc4)n3)cc2c1 ZINC001308229017 1065836563 /nfs/dbraw/zinc/83/65/63/1065836563.db2.gz PBENJKMYNWMEMG-UHFFFAOYSA-N 1 2 321.355 4.047 20 0 DIADLO CC(C)c1[nH+]c(CN[C@H](C)COc2ccccc2)c2ccccn21 ZINC001308228913 1065837258 /nfs/dbraw/zinc/83/72/58/1065837258.db2.gz LDWCRXIXJXUNSG-MRXNPFEDSA-N 1 2 323.440 4.015 20 0 DIADLO CC[C@H]([NH2+]Cc1c(Cl)ncn1CC)c1cc(F)ccc1F ZINC001308276500 1065876945 /nfs/dbraw/zinc/87/69/45/1065876945.db2.gz NUSBJSPBXABKPC-ZDUSSCGKSA-N 1 2 313.779 4.076 20 0 DIADLO CC(C)c1ncc(C[NH2+]Cc2c(F)c(F)cc(F)c2F)s1 ZINC001308302309 1065897692 /nfs/dbraw/zinc/89/76/92/1065897692.db2.gz ZJEXPKNPCIUVGY-UHFFFAOYSA-N 1 2 318.339 4.113 20 0 DIADLO CC(C)Cc1ccc(CNc2ccc([NH+]3CCCC3)cc2)cn1 ZINC001308324435 1065912287 /nfs/dbraw/zinc/91/22/87/1065912287.db2.gz KBZRMANGKINUSF-UHFFFAOYSA-N 1 2 309.457 4.492 20 0 DIADLO CCN(CC)c1ccc(NCc2ccc3c(c2)CCCC3)c[nH+]1 ZINC001308339271 1065924414 /nfs/dbraw/zinc/92/44/14/1065924414.db2.gz KICBNSHUSZZGRO-UHFFFAOYSA-N 1 2 309.457 4.419 20 0 DIADLO Fc1cc(C[NH2+]C2(C(F)F)CCCC2)ccc1Br ZINC001308421924 1065977195 /nfs/dbraw/zinc/97/71/95/1065977195.db2.gz JLEYEZDITWXKOD-UHFFFAOYSA-N 1 2 322.168 4.256 20 0 DIADLO Cc1cc(F)c(C[NH2+]Cc2cc(F)c(Cl)cc2F)c(F)c1 ZINC001308393904 1065960301 /nfs/dbraw/zinc/96/03/01/1065960301.db2.gz ZTJALSNZWNTVJN-UHFFFAOYSA-N 1 2 317.713 4.495 20 0 DIADLO CC(=O)N(c1ccc(NCc2cc(C)[nH+]c(C)c2)cc1)[C@H]1C[C@@H]1C ZINC001308415560 1065973749 /nfs/dbraw/zinc/97/37/49/1065973749.db2.gz YJTVJABDNSAZED-RBZFPXEDSA-N 1 2 323.440 4.072 20 0 DIADLO CCOc1ccc(C[NH2+]CC(F)(F)c2ccccc2)c(C)c1 ZINC001308421356 1065976221 /nfs/dbraw/zinc/97/62/21/1065976221.db2.gz DJKGFUVOTNTBSO-UHFFFAOYSA-N 1 2 305.368 4.275 20 0 DIADLO CSc1c(F)cccc1NCc1c[nH+]c2c(C)cccn12 ZINC001308461232 1066003180 /nfs/dbraw/zinc/00/31/80/1066003180.db2.gz MPYPNYFKECRWDY-UHFFFAOYSA-N 1 2 301.390 4.116 20 0 DIADLO Cc1ccc(-c2ccccc2C[NH2+]Cc2csnn2)c(C)c1 ZINC001308478731 1066018039 /nfs/dbraw/zinc/01/80/39/1066018039.db2.gz AFLOSSJLPYIABD-UHFFFAOYSA-N 1 2 309.438 4.112 20 0 DIADLO COc1ccc2oc(C[NH2+][C@@H](CF)c3ccc(F)cc3)cc2c1 ZINC001308497372 1066027727 /nfs/dbraw/zinc/02/77/27/1066027727.db2.gz YZSPDSAFMRSUTG-KRWDZBQOSA-N 1 2 317.335 4.381 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1ccc(C)c(OC)c1 ZINC001308502359 1066032683 /nfs/dbraw/zinc/03/26/83/1066032683.db2.gz YUMFXOUVQOYVIM-UHFFFAOYSA-N 1 2 302.443 4.264 20 0 DIADLO Cc1nn(-c2ccc(F)cc2)c(C)c1CNc1c[nH+]c(C)c(C)c1 ZINC001308503393 1066032805 /nfs/dbraw/zinc/03/28/05/1066032805.db2.gz LRUCGSFMLXKZLM-UHFFFAOYSA-N 1 2 324.403 4.252 20 0 DIADLO Fc1ccc(F)c(C[NH2+]Cc2nccc3c2CCCC3)c1Cl ZINC001308520551 1066042941 /nfs/dbraw/zinc/04/29/41/1066042941.db2.gz CBWJNHIJRHDWKP-UHFFFAOYSA-N 1 2 322.786 4.182 20 0 DIADLO Cc1cc(C)c2cc(NCc3ccc4[nH]c(=O)[nH]c4c3)ccc2[nH+]1 ZINC001308522833 1066043617 /nfs/dbraw/zinc/04/36/17/1066043617.db2.gz ZJDATKZRVRACHY-UHFFFAOYSA-N 1 2 318.380 4.046 20 0 DIADLO Cc1cc(C)c2cc(NCc3ccnn3CC3CC3)ccc2[nH+]1 ZINC001308522365 1066043734 /nfs/dbraw/zinc/04/37/34/1066043734.db2.gz SQHOULBTZWPXNZ-UHFFFAOYSA-N 1 2 306.413 4.070 20 0 DIADLO CCn1c2cc(Br)ccc2[nH+]c1NCC1(C)CCC1 ZINC001308552668 1066064855 /nfs/dbraw/zinc/06/48/55/1066064855.db2.gz FHPRPZXADYFKJZ-UHFFFAOYSA-N 1 2 322.250 4.421 20 0 DIADLO C[C@H]([NH2+]Cc1csc(C2CC2)n1)c1cc(F)ccc1N(C)C ZINC001308556177 1066067584 /nfs/dbraw/zinc/06/75/84/1066067584.db2.gz XBJIILREIXYKFO-NSHDSACASA-N 1 2 319.449 4.076 20 0 DIADLO CC[N@H+](Cc1ccc(F)c(OC)c1)Cc1c(F)cccc1F ZINC001308560385 1066070843 /nfs/dbraw/zinc/07/08/43/1066070843.db2.gz NNICFPCAQJIKIC-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccc(F)c(OC)c1)Cc1c(F)cccc1F ZINC001308560385 1066070851 /nfs/dbraw/zinc/07/08/51/1066070851.db2.gz NNICFPCAQJIKIC-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC(C)[N@H+](Cc1ccnn1C1CCC1)Cc1ccccc1F ZINC001308571571 1066081246 /nfs/dbraw/zinc/08/12/46/1066081246.db2.gz VOTIPFWSUXQGPZ-UHFFFAOYSA-N 1 2 301.409 4.158 20 0 DIADLO CC(C)[N@@H+](Cc1ccnn1C1CCC1)Cc1ccccc1F ZINC001308571571 1066081257 /nfs/dbraw/zinc/08/12/57/1066081257.db2.gz VOTIPFWSUXQGPZ-UHFFFAOYSA-N 1 2 301.409 4.158 20 0 DIADLO Oc1ccc(C[N@@H+]2CCCCC[C@H]2c2ccco2)c(F)c1F ZINC001308572374 1066083400 /nfs/dbraw/zinc/08/34/00/1066083400.db2.gz BIOHYZOHXZZQOC-ZDUSSCGKSA-N 1 2 307.340 4.381 20 0 DIADLO Oc1ccc(C[N@H+]2CCCCC[C@H]2c2ccco2)c(F)c1F ZINC001308572374 1066083409 /nfs/dbraw/zinc/08/34/09/1066083409.db2.gz BIOHYZOHXZZQOC-ZDUSSCGKSA-N 1 2 307.340 4.381 20 0 DIADLO CCCn1cc(C[N@H+](CC)[C@H](C)c2cc3ccccc3o2)nn1 ZINC001308592220 1066105601 /nfs/dbraw/zinc/10/56/01/1066105601.db2.gz ZOHFYDVROFHNMY-CQSZACIVSA-N 1 2 312.417 4.017 20 0 DIADLO CCCn1cc(C[N@@H+](CC)[C@H](C)c2cc3ccccc3o2)nn1 ZINC001308592220 1066105605 /nfs/dbraw/zinc/10/56/05/1066105605.db2.gz ZOHFYDVROFHNMY-CQSZACIVSA-N 1 2 312.417 4.017 20 0 DIADLO Cc1c(Cl)cccc1C[N@@H+](CC(=O)OC(C)(C)C)C(C)C ZINC001308593127 1066105820 /nfs/dbraw/zinc/10/58/20/1066105820.db2.gz CYHIPZRVEKLXIQ-UHFFFAOYSA-N 1 2 311.853 4.201 20 0 DIADLO Cc1c(Cl)cccc1C[N@H+](CC(=O)OC(C)(C)C)C(C)C ZINC001308593127 1066105825 /nfs/dbraw/zinc/10/58/25/1066105825.db2.gz CYHIPZRVEKLXIQ-UHFFFAOYSA-N 1 2 311.853 4.201 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2cncc(Cl)c2Cl)cc1 ZINC001308595993 1066106729 /nfs/dbraw/zinc/10/67/29/1066106729.db2.gz YDRYSGCLPPOZLK-HNNXBMFYSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@H+]2Cc2cncc(Cl)c2Cl)cc1 ZINC001308595993 1066106732 /nfs/dbraw/zinc/10/67/32/1066106732.db2.gz YDRYSGCLPPOZLK-HNNXBMFYSA-N 1 2 323.223 4.431 20 0 DIADLO COc1cc(C)ccc1C[N@@H+]1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC001308597458 1066108540 /nfs/dbraw/zinc/10/85/40/1066108540.db2.gz BNVPDTOIYOOCPT-KBXCAEBGSA-N 1 2 317.454 4.027 20 0 DIADLO COc1cc(C)ccc1C[N@H+]1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC001308597458 1066108548 /nfs/dbraw/zinc/10/85/48/1066108548.db2.gz BNVPDTOIYOOCPT-KBXCAEBGSA-N 1 2 317.454 4.027 20 0 DIADLO CCc1cccc(F)c1C[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC001308598250 1066109084 /nfs/dbraw/zinc/10/90/84/1066109084.db2.gz ISVDAVZAMFQSHO-ACJLOTCBSA-N 1 2 319.445 4.412 20 0 DIADLO CCc1cccc(F)c1C[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC001308598250 1066109089 /nfs/dbraw/zinc/10/90/89/1066109089.db2.gz ISVDAVZAMFQSHO-ACJLOTCBSA-N 1 2 319.445 4.412 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccnc2Br)[C@H]1c1ccccc1 ZINC001308609758 1066116229 /nfs/dbraw/zinc/11/62/29/1066116229.db2.gz SWTRPSPRJNIVTC-IUODEOHRSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccnc2Br)[C@H]1c1ccccc1 ZINC001308609758 1066116234 /nfs/dbraw/zinc/11/62/34/1066116234.db2.gz SWTRPSPRJNIVTC-IUODEOHRSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccnc2Br)[C@@H]1c1ccccc1 ZINC001308609757 1066116443 /nfs/dbraw/zinc/11/64/43/1066116443.db2.gz SWTRPSPRJNIVTC-DOMZBBRYSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccnc2Br)[C@@H]1c1ccccc1 ZINC001308609757 1066116454 /nfs/dbraw/zinc/11/64/54/1066116454.db2.gz SWTRPSPRJNIVTC-DOMZBBRYSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccnc2Br)[C@H]1c1ccccc1 ZINC001308609759 1066116537 /nfs/dbraw/zinc/11/65/37/1066116537.db2.gz SWTRPSPRJNIVTC-SWLSCSKDSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccnc2Br)[C@H]1c1ccccc1 ZINC001308609759 1066116539 /nfs/dbraw/zinc/11/65/39/1066116539.db2.gz SWTRPSPRJNIVTC-SWLSCSKDSA-N 1 2 317.230 4.037 20 0 DIADLO CC[N@H+](CC(=O)OC)Cc1cccc(-c2ccc(Cl)cc2)c1 ZINC001308618657 1066121854 /nfs/dbraw/zinc/12/18/54/1066121854.db2.gz IEPZZONREBYMSA-UHFFFAOYSA-N 1 2 317.816 4.002 20 0 DIADLO CC[N@@H+](CC(=O)OC)Cc1cccc(-c2ccc(Cl)cc2)c1 ZINC001308618657 1066121857 /nfs/dbraw/zinc/12/18/57/1066121857.db2.gz IEPZZONREBYMSA-UHFFFAOYSA-N 1 2 317.816 4.002 20 0 DIADLO CCc1cccc(F)c1C[N@@H+]1CCc2c(F)cc(F)cc2C1 ZINC001308620661 1066122302 /nfs/dbraw/zinc/12/23/02/1066122302.db2.gz ATJNHZMYWMKHOZ-UHFFFAOYSA-N 1 2 305.343 4.225 20 0 DIADLO CCc1cccc(F)c1C[N@H+]1CCc2c(F)cc(F)cc2C1 ZINC001308620661 1066122306 /nfs/dbraw/zinc/12/23/06/1066122306.db2.gz ATJNHZMYWMKHOZ-UHFFFAOYSA-N 1 2 305.343 4.225 20 0 DIADLO Cc1cc(F)ncc1C[N@H+](Cc1ccco1)Cc1cccs1 ZINC001308658743 1066140498 /nfs/dbraw/zinc/14/04/98/1066140498.db2.gz AVUKLKWTHFKRPG-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+](Cc1ccco1)Cc1cccs1 ZINC001308658743 1066140500 /nfs/dbraw/zinc/14/05/00/1066140500.db2.gz AVUKLKWTHFKRPG-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1snc(OC)c1Cl ZINC001308665818 1066145005 /nfs/dbraw/zinc/14/50/05/1066145005.db2.gz GEPNNROPDZOARA-CYBMUJFWSA-N 1 2 322.861 4.142 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1snc(OC)c1Cl ZINC001308665818 1066145007 /nfs/dbraw/zinc/14/50/07/1066145007.db2.gz GEPNNROPDZOARA-CYBMUJFWSA-N 1 2 322.861 4.142 20 0 DIADLO CCC[N@H+](CC(=O)OC(C)(C)C)Cc1cc2c(cccc2C)[nH]1 ZINC001308672447 1066147921 /nfs/dbraw/zinc/14/79/21/1066147921.db2.gz JSJPOTGBRDCSJZ-UHFFFAOYSA-N 1 2 316.445 4.030 20 0 DIADLO CCC[N@@H+](CC(=O)OC(C)(C)C)Cc1cc2c(cccc2C)[nH]1 ZINC001308672447 1066147923 /nfs/dbraw/zinc/14/79/23/1066147923.db2.gz JSJPOTGBRDCSJZ-UHFFFAOYSA-N 1 2 316.445 4.030 20 0 DIADLO Cc1cc(F)ncc1C[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001308678309 1066152088 /nfs/dbraw/zinc/15/20/88/1066152088.db2.gz CLGPTVXLZGQYFW-UHFFFAOYSA-N 1 2 316.807 4.472 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001308678309 1066152091 /nfs/dbraw/zinc/15/20/91/1066152091.db2.gz CLGPTVXLZGQYFW-UHFFFAOYSA-N 1 2 316.807 4.472 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1ccsc1Br)CC2 ZINC001308685842 1066155174 /nfs/dbraw/zinc/15/51/74/1066155174.db2.gz JHFXOIQPRPTHHN-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1ccsc1Br)CC2 ZINC001308685842 1066155176 /nfs/dbraw/zinc/15/51/76/1066155176.db2.gz JHFXOIQPRPTHHN-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NC1CCC2(CCOCC2)CC1 ZINC001308698201 1066186094 /nfs/dbraw/zinc/18/60/94/1066186094.db2.gz YSPLOTFRVYRWJG-UHFFFAOYSA-N 1 2 304.434 4.020 20 0 DIADLO Cc1[nH]c(CN2C[C@H](c3ccccc3)c3ccccc32)[nH+]c1C ZINC001308726702 1066203266 /nfs/dbraw/zinc/20/32/66/1066203266.db2.gz JXXRCTDMXAMMPF-GOSISDBHSA-N 1 2 303.409 4.179 20 0 DIADLO CC1CCC([NH2+]c2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC001308734187 1066208705 /nfs/dbraw/zinc/20/87/05/1066208705.db2.gz LPAHMHCTIUNJFH-HPZPOOBXSA-N 1 2 302.462 4.291 20 0 DIADLO COc1cccc(-c2csc(C[N@@H+]3CCC[C@@](C)(F)C3)n2)c1 ZINC001308781568 1066254255 /nfs/dbraw/zinc/25/42/55/1066254255.db2.gz HOWOVNDXUAICMV-QGZVFWFLSA-N 1 2 320.433 4.143 20 0 DIADLO COc1cccc(-c2csc(C[N@H+]3CCC[C@@](C)(F)C3)n2)c1 ZINC001308781568 1066254264 /nfs/dbraw/zinc/25/42/64/1066254264.db2.gz HOWOVNDXUAICMV-QGZVFWFLSA-N 1 2 320.433 4.143 20 0 DIADLO CCC1(CC)C[NH+](Cc2c(Cl)nc3cc(Cl)ccn32)C1 ZINC001308806833 1066283992 /nfs/dbraw/zinc/28/39/92/1066283992.db2.gz ASPVXBYJFMVYKO-UHFFFAOYSA-N 1 2 312.244 4.263 20 0 DIADLO Cc1nc2ccccc2nc1C[N@@H+]1CCc2cccc(Cl)c2C1 ZINC001308808614 1066285312 /nfs/dbraw/zinc/28/53/12/1066285312.db2.gz IAPLFLAWYGDGOS-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1nc2ccccc2nc1C[N@H+]1CCc2cccc(Cl)c2C1 ZINC001308808614 1066285324 /nfs/dbraw/zinc/28/53/24/1066285324.db2.gz IAPLFLAWYGDGOS-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1cccc(CC[C@H](C)Nc2ccc(N3CCCC3)c[nH+]2)c1 ZINC001308829864 1066304597 /nfs/dbraw/zinc/30/45/97/1066304597.db2.gz DMYDZHRWKZKUSP-KRWDZBQOSA-N 1 2 309.457 4.423 20 0 DIADLO Fc1ccc(CCCNc2ccc(N3CCCC3)c[nH+]2)cc1F ZINC001308830920 1066306673 /nfs/dbraw/zinc/30/66/73/1066306673.db2.gz YEFHAJYJDKDAIA-UHFFFAOYSA-N 1 2 317.383 4.005 20 0 DIADLO C[C@@H]([NH2+][C@H]1C[C@@H](C)C[C@H](c2ccccc2)C1)C(=O)OC(C)(C)C ZINC001308859247 1066339734 /nfs/dbraw/zinc/33/97/34/1066339734.db2.gz KRJFYWKUECQILB-MVJTYMMSSA-N 1 2 317.473 4.279 20 0 DIADLO COc1cccc(Nc2ccc(NCc3ncccc3C)[nH+]c2)c1 ZINC001308864943 1066346137 /nfs/dbraw/zinc/34/61/37/1066346137.db2.gz SHUXTLXHGMJRIX-UHFFFAOYSA-N 1 2 320.396 4.149 20 0 DIADLO ClC1(Cl)C[C@@H]1CNc1ccc(Nc2ccccc2)c[nH+]1 ZINC001308871646 1066350656 /nfs/dbraw/zinc/35/06/56/1066350656.db2.gz FIBMQMQVBKEYGJ-LLVKDONJSA-N 1 2 308.212 4.431 20 0 DIADLO CO[C@@H](C[NH2+]CC(F)(F)c1ccc(F)cc1)C1CCCCC1 ZINC001308880663 1066361434 /nfs/dbraw/zinc/36/14/34/1066361434.db2.gz OCCFQQVEUXUXHJ-INIZCTEOSA-N 1 2 315.379 4.102 20 0 DIADLO Cc1c(Cl)cccc1C[N@@H+]1CCOc2cc(F)ccc2C1 ZINC001308887746 1066369457 /nfs/dbraw/zinc/36/94/57/1066369457.db2.gz JASPSKMIKLJKML-UHFFFAOYSA-N 1 2 305.780 4.182 20 0 DIADLO Cc1c(Cl)cccc1C[N@H+]1CCOc2cc(F)ccc2C1 ZINC001308887746 1066369468 /nfs/dbraw/zinc/36/94/68/1066369468.db2.gz JASPSKMIKLJKML-UHFFFAOYSA-N 1 2 305.780 4.182 20 0 DIADLO CC(C)COC(=O)[C@H](C)[NH2+][C@H]1C[C@H](c2ccccc2)C[C@H](C)C1 ZINC001308908089 1066384781 /nfs/dbraw/zinc/38/47/81/1066384781.db2.gz WGLWLOBMDSRIBT-RNIPGJKVSA-N 1 2 317.473 4.136 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCc3cc(F)c(F)cc3C2)cc1F ZINC001308917967 1066397651 /nfs/dbraw/zinc/39/76/51/1066397651.db2.gz HNKHSFPUJTVIDK-UPHRSURJSA-N 1 2 321.317 4.315 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCc3cc(F)c(F)cc3C2)cc1F ZINC001308917967 1066397667 /nfs/dbraw/zinc/39/76/67/1066397667.db2.gz HNKHSFPUJTVIDK-UPHRSURJSA-N 1 2 321.317 4.315 20 0 DIADLO CCOC(=O)C(C)(C)CCC[C@@H](C)Nc1c[nH+]c(C)c(C)c1 ZINC001308919860 1066398912 /nfs/dbraw/zinc/39/89/12/1066398912.db2.gz UDISQCDKQNULMA-CQSZACIVSA-N 1 2 306.450 4.258 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1cc3ccncc3s1)C2 ZINC001308968366 1066424461 /nfs/dbraw/zinc/42/44/61/1066424461.db2.gz GIWBYARMKXEBHO-UHFFFAOYSA-N 1 2 300.814 4.466 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1cc3ccncc3s1)C2 ZINC001308968366 1066424464 /nfs/dbraw/zinc/42/44/64/1066424464.db2.gz GIWBYARMKXEBHO-UHFFFAOYSA-N 1 2 300.814 4.466 20 0 DIADLO Oc1ccc2c(c1)CC[N@@H+](Cc1ccc(C(F)(F)F)s1)C2 ZINC001308984036 1066433853 /nfs/dbraw/zinc/43/38/53/1066433853.db2.gz FEWHRVDJRILHPQ-UHFFFAOYSA-N 1 2 313.344 4.031 20 0 DIADLO Oc1ccc2c(c1)CC[N@H+](Cc1ccc(C(F)(F)F)s1)C2 ZINC001308984036 1066433861 /nfs/dbraw/zinc/43/38/61/1066433861.db2.gz FEWHRVDJRILHPQ-UHFFFAOYSA-N 1 2 313.344 4.031 20 0 DIADLO CC[C@](C)(CNc1[nH+]c2ccccc2n1C1CCCC1)OC ZINC001308991012 1066434442 /nfs/dbraw/zinc/43/44/42/1066434442.db2.gz GQEJANIBQNKVSK-GOSISDBHSA-N 1 2 301.434 4.378 20 0 DIADLO Cc1cccnc1CNc1[nH+]c2ccccc2n1C1CCCC1 ZINC001308989869 1066434866 /nfs/dbraw/zinc/43/48/66/1066434866.db2.gz NPJOKTPXTDVLAZ-UHFFFAOYSA-N 1 2 306.413 4.467 20 0 DIADLO CN(C(=O)Nc1ccn2cc[nH+]c2c1)c1ccc2ccccc2c1 ZINC001310675332 1066550500 /nfs/dbraw/zinc/55/05/00/1066550500.db2.gz WBELTDYMOPEWHA-UHFFFAOYSA-N 1 2 316.364 4.156 20 0 DIADLO O=C(Nc1ccc(C2CCC2)cc1)Nc1ccc2[nH+]ccn2c1 ZINC001311025807 1066588750 /nfs/dbraw/zinc/58/87/50/1066588750.db2.gz GJRCPIMUNFCQNV-UHFFFAOYSA-N 1 2 306.369 4.246 20 0 DIADLO CC[C@H](C(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccccc1 ZINC000095552760 185379293 /nfs/dbraw/zinc/37/92/93/185379293.db2.gz JGPBVZXHYZJAON-INIZCTEOSA-N 1 2 305.381 4.005 20 0 DIADLO CC(C)CC[C@@H]1CCC[C@H]1[NH2+]Cc1nc(=O)c2sccc2[nH]1 ZINC000298480981 534929487 /nfs/dbraw/zinc/92/94/87/534929487.db2.gz JEIOWHIYUUAAHO-QWHCGFSZSA-N 1 2 319.474 4.091 20 0 DIADLO CC(C)n1ncnc1C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000088588551 185258837 /nfs/dbraw/zinc/25/88/37/185258837.db2.gz MLXAFFHIYDBJDV-SNVBAGLBSA-N 1 2 313.232 4.017 20 0 DIADLO CCc1ccc([C@H](C)[NH2+]Cc2nnc(-c3ccccc3)s2)o1 ZINC000090401502 185294566 /nfs/dbraw/zinc/29/45/66/185294566.db2.gz BSIZINZZMBOELW-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc2ccccc2n1 ZINC000090458961 185297711 /nfs/dbraw/zinc/29/77/11/185297711.db2.gz GCYGRZUQSMJWQX-GFCCVEGCSA-N 1 2 309.438 4.420 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1cc(F)c(F)c(F)c1 ZINC000090460181 185297832 /nfs/dbraw/zinc/29/78/32/185297832.db2.gz GYQGQNRZEDPMLU-QMMMGPOBSA-N 1 2 312.360 4.289 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000090572438 185304498 /nfs/dbraw/zinc/30/44/98/185304498.db2.gz QYFLUAFKCVJRMG-OAHLLOKOSA-N 1 2 313.445 4.166 20 0 DIADLO C[C@@H](CC(=O)N[C@@H](C)c1cccc2ccccc21)C1CC[NH2+]CC1 ZINC000150723252 186060286 /nfs/dbraw/zinc/06/02/86/186060286.db2.gz GZCKUQBLZKLBCN-HOTGVXAUSA-N 1 2 324.468 4.043 20 0 DIADLO CC(C)([NH2+]Cc1c(Cl)cccc1Cl)c1nccs1 ZINC000072662636 191210704 /nfs/dbraw/zinc/21/07/04/191210704.db2.gz KSIATYHUTZKYGF-UHFFFAOYSA-N 1 2 301.242 4.475 20 0 DIADLO COC[C@@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1ccco1 ZINC000080240609 192015063 /nfs/dbraw/zinc/01/50/63/192015063.db2.gz MTUNNHYKVOHYOC-CYBMUJFWSA-N 1 2 300.185 4.064 20 0 DIADLO COC[C@@H]([NH2+]Cc1cccc(Cl)c1Cl)c1ccco1 ZINC000080240359 192015450 /nfs/dbraw/zinc/01/54/50/192015450.db2.gz WWZJJVVFRFSYOT-GFCCVEGCSA-N 1 2 300.185 4.064 20 0 DIADLO Cc1nc(C[N@@H+](Cc2cccs2)C[C@H]2CCCO2)sc1C ZINC000081646028 192305987 /nfs/dbraw/zinc/30/59/87/192305987.db2.gz ISPAQVKZKJCHQL-CQSZACIVSA-N 1 2 322.499 4.003 20 0 DIADLO Cc1nc(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)sc1C ZINC000081646028 192305990 /nfs/dbraw/zinc/30/59/90/192305990.db2.gz ISPAQVKZKJCHQL-CQSZACIVSA-N 1 2 322.499 4.003 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1nc2ccccc2n1C ZINC000091409482 193051480 /nfs/dbraw/zinc/05/14/80/193051480.db2.gz GXMIHXPIYABVET-NWDGAFQWSA-N 1 2 315.367 4.263 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1nccs1 ZINC000091735978 193099220 /nfs/dbraw/zinc/09/92/20/193099220.db2.gz PEYOKMSMORLYIV-KBPBESRZSA-N 1 2 304.459 4.480 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000092224245 193176485 /nfs/dbraw/zinc/17/64/85/193176485.db2.gz UKAUDRQVISPKPN-HNNXBMFYSA-N 1 2 303.475 4.419 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000092224245 193176487 /nfs/dbraw/zinc/17/64/87/193176487.db2.gz UKAUDRQVISPKPN-HNNXBMFYSA-N 1 2 303.475 4.419 20 0 DIADLO Clc1ccc([C@H]2CSCC[N@@H+]2Cc2cncs2)cc1 ZINC000093530041 193265389 /nfs/dbraw/zinc/26/53/89/193265389.db2.gz DABWBOFIHIETFK-CQSZACIVSA-N 1 2 310.875 4.087 20 0 DIADLO Clc1ccc([C@H]2CSCC[N@H+]2Cc2cncs2)cc1 ZINC000093530041 193265391 /nfs/dbraw/zinc/26/53/91/193265391.db2.gz DABWBOFIHIETFK-CQSZACIVSA-N 1 2 310.875 4.087 20 0 DIADLO Clc1ccc([C@@H]2CSCC[N@@H+]2Cc2cncs2)cc1 ZINC000093530040 193265528 /nfs/dbraw/zinc/26/55/28/193265528.db2.gz DABWBOFIHIETFK-AWEZNQCLSA-N 1 2 310.875 4.087 20 0 DIADLO Clc1ccc([C@@H]2CSCC[N@H+]2Cc2cncs2)cc1 ZINC000093530040 193265530 /nfs/dbraw/zinc/26/55/30/193265530.db2.gz DABWBOFIHIETFK-AWEZNQCLSA-N 1 2 310.875 4.087 20 0 DIADLO CC(C)Cn1cc[nH+]c1CNc1ncc(-c2ccccc2)s1 ZINC000135304283 335029412 /nfs/dbraw/zinc/02/94/12/335029412.db2.gz XJHICRKJXWNNAM-UHFFFAOYSA-N 1 2 312.442 4.275 20 0 DIADLO C[C@H](Cc1nc2ccccc2s1)Nc1cc[nH+]c(C2CC2)n1 ZINC000135508780 335036414 /nfs/dbraw/zinc/03/64/14/335036414.db2.gz XXIGUXQCLJCYHK-LLVKDONJSA-N 1 2 310.426 4.007 20 0 DIADLO CCc1nnc(C[NH2+]C2(c3ccc(Cl)cc3)CCCCC2)o1 ZINC000104682206 194026698 /nfs/dbraw/zinc/02/66/98/194026698.db2.gz XPTSKTQBWBURKU-UHFFFAOYSA-N 1 2 319.836 4.235 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@H](c2ccc(F)cc2)C2CCC2)no1 ZINC000104703283 194030208 /nfs/dbraw/zinc/03/02/08/194030208.db2.gz ZENBVICTYQMDAZ-INIZCTEOSA-N 1 2 317.408 4.137 20 0 DIADLO CCCC[C@@H]1CCC[C@@H]1NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000106558566 194230933 /nfs/dbraw/zinc/23/09/33/194230933.db2.gz HWHXDGQKVHEMRC-OWCLPIDISA-N 1 2 318.465 4.005 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@H+](Cc2coc(-c3cccs3)n2)C1 ZINC000061760969 184186285 /nfs/dbraw/zinc/18/62/85/184186285.db2.gz RVTWLVIETHTHMM-SNVBAGLBSA-N 1 2 316.348 4.177 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2coc(-c3cccs3)n2)C1 ZINC000061760969 184186287 /nfs/dbraw/zinc/18/62/87/184186287.db2.gz RVTWLVIETHTHMM-SNVBAGLBSA-N 1 2 316.348 4.177 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2cc(Cl)sc2Cl)[nH]1 ZINC000271503816 129926179 /nfs/dbraw/zinc/92/61/79/129926179.db2.gz MLYQFFUUXVPKRS-RQJHMYQMSA-N 1 2 319.261 4.147 20 0 DIADLO Cc1ccncc1C[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000271684935 129946640 /nfs/dbraw/zinc/94/66/40/129946640.db2.gz CPZIKQNSZVSSSU-UHFFFAOYSA-N 1 2 307.224 4.476 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@H](C)c2ccc(F)c(C)c2)n1 ZINC000271836749 129968704 /nfs/dbraw/zinc/96/87/04/129968704.db2.gz YFEAASITQUADMN-VXGBXAGGSA-N 1 2 323.437 4.182 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](C)Cc2ccccc2SC)cs1 ZINC000272954509 130077316 /nfs/dbraw/zinc/07/73/16/130077316.db2.gz VOZANIMAYSXQFM-LBPRGKRZSA-N 1 2 322.499 4.204 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](C)Cc2ccccc2SC)cs1 ZINC000272954509 130077318 /nfs/dbraw/zinc/07/73/18/130077318.db2.gz VOZANIMAYSXQFM-LBPRGKRZSA-N 1 2 322.499 4.204 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2cc(-c3ccccc3)no2)cs1 ZINC000273243883 130099791 /nfs/dbraw/zinc/09/97/91/130099791.db2.gz AQGJOUZRQBQZJE-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO CCc1ccc(-c2noc([C@H](C)[NH2+]Cc3ccccc3)n2)cc1 ZINC000273292748 130103982 /nfs/dbraw/zinc/10/39/82/130103982.db2.gz IZZKHVQLMOXOHC-AWEZNQCLSA-N 1 2 307.397 4.150 20 0 DIADLO Cc1ccc(Cc2noc(C[C@H](C)c3ccccc3C)n2)c[nH+]1 ZINC000273911633 130185835 /nfs/dbraw/zinc/18/58/35/130185835.db2.gz KDJYLFTYBWQPRE-AWEZNQCLSA-N 1 2 307.397 4.018 20 0 DIADLO CC[C@H](Cc1nc(Cc2ccc(C)[nH+]c2)no1)c1ccccc1 ZINC000273919424 130186866 /nfs/dbraw/zinc/18/68/66/130186866.db2.gz KZUMANUDUGAXEE-MRXNPFEDSA-N 1 2 307.397 4.100 20 0 DIADLO Cc1ccsc1[C@@H]1C[C@@H]1c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000273977426 130194879 /nfs/dbraw/zinc/19/48/79/130194879.db2.gz QZWWTZCBEZYHIR-KGLIPLIRSA-N 1 2 311.410 4.005 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cncc(F)c1)c1nc(C(F)(F)F)cs1 ZINC000274409659 130233033 /nfs/dbraw/zinc/23/30/33/130233033.db2.gz RPYJLCAOQAYJFV-HTQZYQBOSA-N 1 2 319.327 4.108 20 0 DIADLO Cc1ccc2[nH+]c(CN[C@H](C)c3csc(C(C)C)n3)cn2c1 ZINC000274515761 130243272 /nfs/dbraw/zinc/24/32/72/130243272.db2.gz XLXGXZANGMDKEE-CYBMUJFWSA-N 1 2 314.458 4.073 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+][C@H](C)c1nc(C(F)(F)F)cs1 ZINC000274616197 130250271 /nfs/dbraw/zinc/25/02/71/130250271.db2.gz OOMRQEWHFAVTEH-VHSXEESVSA-N 1 2 315.364 4.277 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1cncc(F)c1 ZINC000274847201 130266595 /nfs/dbraw/zinc/26/65/95/130266595.db2.gz LUJLJOPHNVTPRP-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cncc(F)c1 ZINC000274847201 130266597 /nfs/dbraw/zinc/26/65/97/130266597.db2.gz LUJLJOPHNVTPRP-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO Cc1nc([C@@H]2CCCN2c2cc(C(F)(F)F)cc[nH+]2)cs1 ZINC000275004739 130282066 /nfs/dbraw/zinc/28/20/66/130282066.db2.gz HGQNQLKRWAMQMR-LBPRGKRZSA-N 1 2 313.348 4.207 20 0 DIADLO FC(F)(F)Cn1cc[nH+]c1CNc1ccc(C2CCC2)cc1 ZINC000278700659 130713800 /nfs/dbraw/zinc/71/38/00/130713800.db2.gz JUDYPITYWZIHRO-UHFFFAOYSA-N 1 2 309.335 4.325 20 0 DIADLO Cc1nc(C)c([C@@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)s1 ZINC000281105188 130837195 /nfs/dbraw/zinc/83/71/95/130837195.db2.gz LLCNEASGHJBJQK-ZCFIWIBFSA-N 1 2 318.339 4.167 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)Nc1cscc1C ZINC000281364168 130855910 /nfs/dbraw/zinc/85/59/10/130855910.db2.gz LPIJDARASVNWBF-CQSZACIVSA-N 1 2 318.446 4.032 20 0 DIADLO Cc1cc([NH2+]C2CCC(C(F)F)CC2)ccc1N1CCOCC1 ZINC000282434640 130921758 /nfs/dbraw/zinc/92/17/58/130921758.db2.gz UEFQHDRRPFDPSJ-UHFFFAOYSA-N 1 2 324.415 4.067 20 0 DIADLO C[N@H+](CCOc1ccc(Cl)cc1)Cc1csc(C2CC2)n1 ZINC000340159590 130961611 /nfs/dbraw/zinc/96/16/11/130961611.db2.gz ZPPSROOFLCVDBU-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO C[N@@H+](CCOc1ccc(Cl)cc1)Cc1csc(C2CC2)n1 ZINC000340159590 130961613 /nfs/dbraw/zinc/96/16/13/130961613.db2.gz ZPPSROOFLCVDBU-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO CCCN(C(=O)C=Cc1c[nH]c[nH+]1)[C@H](C)c1cc2ccccc2o1 ZINC000283526952 131000212 /nfs/dbraw/zinc/00/02/12/131000212.db2.gz RBUQUMIWBVRYEN-MYSGNRETSA-N 1 2 323.396 4.169 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@@H](c3cccc(F)c3)C2)c(C)s1 ZINC000340183422 131018211 /nfs/dbraw/zinc/01/82/11/131018211.db2.gz BHUIQZMBPZFNBZ-QGZVFWFLSA-N 1 2 305.418 4.078 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@@H](c3cccc(F)c3)C2)c(C)s1 ZINC000340183422 131018213 /nfs/dbraw/zinc/01/82/13/131018213.db2.gz BHUIQZMBPZFNBZ-QGZVFWFLSA-N 1 2 305.418 4.078 20 0 DIADLO Cc1ccc2[nH+]c(CNc3ccc(COC(C)C)cc3)cn2c1 ZINC000283850712 131029025 /nfs/dbraw/zinc/02/90/25/131029025.db2.gz HVHUULJDIKCLGJ-UHFFFAOYSA-N 1 2 309.413 4.180 20 0 DIADLO Cc1noc(C(C)(C)[NH2+]Cc2cccc(-c3ccc(C)cc3)c2)n1 ZINC000283894581 131031533 /nfs/dbraw/zinc/03/15/33/131031533.db2.gz HQALAGILFVGVPI-UHFFFAOYSA-N 1 2 321.424 4.378 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H]2CCCOc3cc(Cl)ccc32)no1 ZINC000284952345 131125394 /nfs/dbraw/zinc/12/53/94/131125394.db2.gz FDVSMKVLEDYPCJ-FZMZJTMJSA-N 1 2 306.793 4.201 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCSc2ccc(F)cc21)c1c(F)cncc1F ZINC000285497269 131174233 /nfs/dbraw/zinc/17/42/33/131174233.db2.gz ACUJREYDPHBJIX-YMTOWFKASA-N 1 2 324.371 4.387 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cc(F)ccc1F ZINC000285626480 131187957 /nfs/dbraw/zinc/18/79/57/131187957.db2.gz KEPLQQFGAWDBBA-VFZGTOFNSA-N 1 2 312.310 4.440 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cc(C)ccc1OC ZINC000285643899 131189373 /nfs/dbraw/zinc/18/93/73/131189373.db2.gz LBSHKADQHQGMHT-BLLLJJGKSA-N 1 2 320.383 4.479 20 0 DIADLO c1cc(C[N@@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)cs1 ZINC000286167613 131223003 /nfs/dbraw/zinc/22/30/03/131223003.db2.gz IORQCMBZTQAQNE-CQSZACIVSA-N 1 2 303.431 4.126 20 0 DIADLO c1cc(C[N@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)cs1 ZINC000286167613 131223004 /nfs/dbraw/zinc/22/30/04/131223004.db2.gz IORQCMBZTQAQNE-CQSZACIVSA-N 1 2 303.431 4.126 20 0 DIADLO Cn1cc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)c(C(F)F)n1 ZINC000287082780 131263046 /nfs/dbraw/zinc/26/30/46/131263046.db2.gz WNZRPLHBQVCPPH-ZDUSSCGKSA-N 1 2 311.401 4.002 20 0 DIADLO Cn1cc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)c(C(F)F)n1 ZINC000287082780 131263047 /nfs/dbraw/zinc/26/30/47/131263047.db2.gz WNZRPLHBQVCPPH-ZDUSSCGKSA-N 1 2 311.401 4.002 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)Nc1cccc(CC(F)(F)F)c1 ZINC000287414183 131279219 /nfs/dbraw/zinc/27/92/19/131279219.db2.gz FKMVLJYWAUOPNL-UHFFFAOYSA-N 1 2 323.318 4.447 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@@H]1c1ccsc1 ZINC000287451384 131280394 /nfs/dbraw/zinc/28/03/94/131280394.db2.gz IAWZLPGNAJRTPB-CQSZACIVSA-N 1 2 301.415 4.129 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1 ZINC000287437568 131281093 /nfs/dbraw/zinc/28/10/93/131281093.db2.gz PXHGJLUKKUYWGN-KRWDZBQOSA-N 1 2 311.429 4.373 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1 ZINC000287437568 131281095 /nfs/dbraw/zinc/28/10/95/131281095.db2.gz PXHGJLUKKUYWGN-KRWDZBQOSA-N 1 2 311.429 4.373 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1C[C@H](c2ccccc2)C[C@@H]1C ZINC000287462172 131281501 /nfs/dbraw/zinc/28/15/01/131281501.db2.gz ITNWLQIJJUBRFA-WMLDXEAASA-N 1 2 309.413 4.108 20 0 DIADLO CC[C@H](C)Sc1ccc(NC(=O)CCc2[nH]cc[nH+]2)c(C)c1 ZINC000287519477 131284411 /nfs/dbraw/zinc/28/44/11/131284411.db2.gz ZJYVRSRUWCCWMH-ZDUSSCGKSA-N 1 2 317.458 4.180 20 0 DIADLO Fc1cccc(C[N@@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)c1 ZINC000287526781 131285371 /nfs/dbraw/zinc/28/53/71/131285371.db2.gz VFRJUIPCGZLWEO-MRXNPFEDSA-N 1 2 315.392 4.203 20 0 DIADLO Fc1cccc(C[N@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)c1 ZINC000287526781 131285373 /nfs/dbraw/zinc/28/53/73/131285373.db2.gz VFRJUIPCGZLWEO-MRXNPFEDSA-N 1 2 315.392 4.203 20 0 DIADLO CCSc1cccc(NC(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000287545725 131286408 /nfs/dbraw/zinc/28/64/08/131286408.db2.gz OOYHLKOZBQEEGX-UHFFFAOYSA-N 1 2 301.415 4.454 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@@H](C)c1ccccc1F ZINC000287571939 131288044 /nfs/dbraw/zinc/28/80/44/131288044.db2.gz QFUOEGRWTJOREQ-ZDUSSCGKSA-N 1 2 301.365 4.062 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@@H](C)c1ccc(F)cc1 ZINC000287593605 131288826 /nfs/dbraw/zinc/28/88/26/131288826.db2.gz ROOMRDPYIAWWRG-ZDUSSCGKSA-N 1 2 301.365 4.062 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)CCc1ccc(Cl)cc1 ZINC000287586365 131289647 /nfs/dbraw/zinc/28/96/47/131289647.db2.gz RDEKRHDSAPGQMT-UHFFFAOYSA-N 1 2 317.820 4.058 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000288574463 131330574 /nfs/dbraw/zinc/33/05/74/131330574.db2.gz NENXGTNZZLHSTC-ZBEGNZNMSA-N 1 2 302.443 4.052 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1csc(C)n1)c1cccc(Cl)c1 ZINC000288581280 131332050 /nfs/dbraw/zinc/33/20/50/131332050.db2.gz AANDOLMSNKQFJQ-QMTHXVAHSA-N 1 2 310.850 4.143 20 0 DIADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1csc(C(C)(C)C)n1 ZINC000288710731 131336503 /nfs/dbraw/zinc/33/65/03/131336503.db2.gz ZGHWKGMOTVFJCB-ABAIWWIYSA-N 1 2 302.443 4.052 20 0 DIADLO CC[N@H+](Cc1cn(C(C)C)nn1)[C@@H](C)c1cc2ccccc2o1 ZINC000289005409 131351299 /nfs/dbraw/zinc/35/12/99/131351299.db2.gz FDCORWPXELYYCD-AWEZNQCLSA-N 1 2 312.417 4.188 20 0 DIADLO CC[N@@H+](Cc1cn(C(C)C)nn1)[C@@H](C)c1cc2ccccc2o1 ZINC000289005409 131351301 /nfs/dbraw/zinc/35/13/01/131351301.db2.gz FDCORWPXELYYCD-AWEZNQCLSA-N 1 2 312.417 4.188 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccncc1F ZINC000340306209 131363510 /nfs/dbraw/zinc/36/35/10/131363510.db2.gz PJQPZVXDPPWNNR-AUUYWEPGSA-N 1 2 307.372 4.056 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(OC(F)F)cc1 ZINC000289358531 131377790 /nfs/dbraw/zinc/37/77/90/131377790.db2.gz MLVCCBXTWNJQDS-NSHDSACASA-N 1 2 324.371 4.424 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(-c3ccsc3)n2)CCC1(F)F ZINC000289359831 131377941 /nfs/dbraw/zinc/37/79/41/131377941.db2.gz AEDCIZHZLOUCLK-SNVBAGLBSA-N 1 2 314.426 4.349 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(-c3ccsc3)n2)CCC1(F)F ZINC000289359831 131377942 /nfs/dbraw/zinc/37/79/42/131377942.db2.gz AEDCIZHZLOUCLK-SNVBAGLBSA-N 1 2 314.426 4.349 20 0 DIADLO Cn1c(CCSCCCC2CCOCC2)[nH+]c2ccccc21 ZINC000289428429 131385102 /nfs/dbraw/zinc/38/51/02/131385102.db2.gz QSUNRDINLSYFHT-UHFFFAOYSA-N 1 2 318.486 4.056 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2cc(C(C)(C)C)on2)s1 ZINC000289551000 131395522 /nfs/dbraw/zinc/39/55/22/131395522.db2.gz DGBAUMVTWYDQML-NSHDSACASA-N 1 2 307.463 4.238 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2cc(C(C)(C)C)on2)s1 ZINC000289551000 131395523 /nfs/dbraw/zinc/39/55/23/131395523.db2.gz DGBAUMVTWYDQML-NSHDSACASA-N 1 2 307.463 4.238 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(Cl)n1)c1ccc(F)cc1Cl ZINC000294882239 131868428 /nfs/dbraw/zinc/86/84/28/131868428.db2.gz CCWWMYMWLSTSBG-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]Cc2ccccc2OC2CCCC2)c2nccn21 ZINC000295184376 131888483 /nfs/dbraw/zinc/88/84/83/131888483.db2.gz HZYZYLDLSQSHQF-PBHICJAKSA-N 1 2 311.429 4.000 20 0 DIADLO C[C@H]1C[C@@H](Nc2cc(C(F)(F)F)ccc2N(C)C)c2[nH+]ccn21 ZINC000296257321 131952395 /nfs/dbraw/zinc/95/23/95/131952395.db2.gz BJUJEYFCXVNDGJ-GXFFZTMASA-N 1 2 324.350 4.086 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](Cc1cnns1)Cc1ccccc1 ZINC000297313981 132009393 /nfs/dbraw/zinc/00/93/93/132009393.db2.gz ZGSZYXAJAUJRQF-ZDUSSCGKSA-N 1 2 315.467 4.363 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](Cc1cnns1)Cc1ccccc1 ZINC000297313981 132009394 /nfs/dbraw/zinc/00/93/94/132009394.db2.gz ZGSZYXAJAUJRQF-ZDUSSCGKSA-N 1 2 315.467 4.363 20 0 DIADLO Clc1cccc(Cl)c1[C@H]([NH2+][C@H]1CCn2ccnc21)C1CC1 ZINC000297357389 132012129 /nfs/dbraw/zinc/01/21/29/132012129.db2.gz POYCNSLIHJJCEB-DZGCQCFKSA-N 1 2 322.239 4.376 20 0 DIADLO O=C(Nc1ccc2c(c1)CCCC2)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000297449633 132016423 /nfs/dbraw/zinc/01/64/23/132016423.db2.gz QIHDASJLSVVACV-QGZVFWFLSA-N 1 2 324.428 4.048 20 0 DIADLO COCc1cc(C[NH2+]Cc2ccc(C3CCCCC3)cc2)no1 ZINC000297506586 132019738 /nfs/dbraw/zinc/01/97/38/132019738.db2.gz VLCSZVBQXPGXBS-UHFFFAOYSA-N 1 2 314.429 4.159 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cccc(-c4ccoc4)c3)cc2[nH+]1 ZINC000340573002 132022270 /nfs/dbraw/zinc/02/22/70/132022270.db2.gz PNYCAIIQEYFAFL-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO Cc1[nH]c2cc(NC(=O)c3cccc(-c4ccoc4)c3)ccc2[nH+]1 ZINC000340573002 132022272 /nfs/dbraw/zinc/02/22/72/132022272.db2.gz PNYCAIIQEYFAFL-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO COCc1cc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)no1 ZINC000297754744 132032159 /nfs/dbraw/zinc/03/21/59/132032159.db2.gz LFTMSHCFPUBKNW-UHFFFAOYSA-N 1 2 322.408 4.139 20 0 DIADLO COCc1cc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)no1 ZINC000297754744 132032161 /nfs/dbraw/zinc/03/21/61/132032161.db2.gz LFTMSHCFPUBKNW-UHFFFAOYSA-N 1 2 322.408 4.139 20 0 DIADLO C[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2)c2cccc(F)c2)c2nccn21 ZINC000297794757 132034894 /nfs/dbraw/zinc/03/48/94/132034894.db2.gz QBUWZRZDFNRDPX-MDASCCDHSA-N 1 2 321.399 4.407 20 0 DIADLO Cc1ccc(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)c(OC(C)(C)C)c1 ZINC000297834129 132035996 /nfs/dbraw/zinc/03/59/96/132035996.db2.gz SAFKQOORAOSABO-GDBMZVCRSA-N 1 2 313.445 4.164 20 0 DIADLO CC(C)(C)[C@H]1CCCC[C@H]1[NH2+]Cc1nc(=O)c2sccc2[nH]1 ZINC000298616582 132069935 /nfs/dbraw/zinc/06/99/35/132069935.db2.gz MWADSRSWVPTEOA-NWDGAFQWSA-N 1 2 319.474 4.091 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000299339866 132099816 /nfs/dbraw/zinc/09/98/16/132099816.db2.gz ACVHYQAMLPOZCD-HNNXBMFYSA-N 1 2 321.424 4.148 20 0 DIADLO O=C(c1cc(Cl)cc(Cl)c1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000299567018 132111034 /nfs/dbraw/zinc/11/10/34/132111034.db2.gz SZPIRASUQUYKCD-ZDUSSCGKSA-N 1 2 324.211 4.084 20 0 DIADLO CCCC1(C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)CCC1 ZINC000340665339 132134578 /nfs/dbraw/zinc/13/45/78/132134578.db2.gz GAMXCJUDABUFPN-UHFFFAOYSA-N 1 2 311.429 4.360 20 0 DIADLO C[C@H]1CCC[C@@H](C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)C1 ZINC000340670190 132139314 /nfs/dbraw/zinc/13/93/14/132139314.db2.gz XENSIYWZQKEJKC-GXTWGEPZSA-N 1 2 311.429 4.216 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1nc2ccccc2n1C ZINC000121494345 132155603 /nfs/dbraw/zinc/15/56/03/132155603.db2.gz QXGLIHKIQNAFHZ-RYUDHWBXSA-N 1 2 315.367 4.263 20 0 DIADLO CCn1c[nH+]cc1CN(Cc1ccccc1)Cc1ccccc1F ZINC000417736248 335081036 /nfs/dbraw/zinc/08/10/36/335081036.db2.gz UAIGLNSGTKDBAJ-UHFFFAOYSA-N 1 2 323.415 4.245 20 0 DIADLO C[N@H+](Cc1ccc(Br)o1)Cc1sccc1Cl ZINC000563872654 335083883 /nfs/dbraw/zinc/08/38/83/335083883.db2.gz PMRBYJQDXLTAEA-UHFFFAOYSA-N 1 2 320.639 4.389 20 0 DIADLO C[N@@H+](Cc1ccc(Br)o1)Cc1sccc1Cl ZINC000563872654 335083884 /nfs/dbraw/zinc/08/38/84/335083884.db2.gz PMRBYJQDXLTAEA-UHFFFAOYSA-N 1 2 320.639 4.389 20 0 DIADLO CC(C)c1cc(N[C@H](CO)c2cccc(F)c2)nc(C(C)C)[nH+]1 ZINC000536389709 435381024 /nfs/dbraw/zinc/38/10/24/435381024.db2.gz VSJAIFNEZMWWPR-MRXNPFEDSA-N 1 2 317.408 4.008 20 0 DIADLO CC(C)c1nc(NCCCCOc2ccc(F)cc2)cc[nH+]1 ZINC000520308287 435735535 /nfs/dbraw/zinc/73/55/35/435735535.db2.gz NDJQSZRSWFDTHW-UHFFFAOYSA-N 1 2 303.381 4.010 20 0 DIADLO Cc1cc(Nc2nnc(C(C)C)o2)c[nH+]c1N1CCCC[C@@H]1C ZINC000520505696 435749100 /nfs/dbraw/zinc/74/91/00/435749100.db2.gz GWTNACOHZCMOMU-ZDUSSCGKSA-N 1 2 315.421 4.019 20 0 DIADLO CC(C)=CCC[C@@H](C)CC(=O)N1CC(C)(C)[C@H]1c1[nH+]ccn1C ZINC000570684353 332800393 /nfs/dbraw/zinc/80/03/93/332800393.db2.gz CJTZTGPZHDQDJP-NVXWUHKLSA-N 1 2 317.477 4.102 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc([C@H]2CC[C@H](C)C2)n1 ZINC000570768868 332813337 /nfs/dbraw/zinc/81/33/37/332813337.db2.gz SNZNFYTZKMQFIE-KBPBESRZSA-N 1 2 324.428 4.495 20 0 DIADLO Cc1cnc(-c2cccc(NCc3cn4cc(C)ccc4[nH+]3)c2)o1 ZINC000570853922 332829530 /nfs/dbraw/zinc/82/95/30/332829530.db2.gz KDRMRERASULNOQ-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ncc(C(C)(C)C)s2)o1 ZINC000570896762 332837110 /nfs/dbraw/zinc/83/71/10/332837110.db2.gz VASYQYJFYCXZGG-WCQYABFASA-N 1 2 304.459 4.447 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc(C2=CC[C@H](C)CC2)n1 ZINC000574958497 332889900 /nfs/dbraw/zinc/88/99/00/332889900.db2.gz GRBIIQLPRUAQPK-ZDUSSCGKSA-N 1 2 322.412 4.174 20 0 DIADLO Cc1ccc(CCCC(=O)Nc2c(C)cc(C)[nH+]c2C)s1 ZINC000175557912 332895536 /nfs/dbraw/zinc/89/55/36/332895536.db2.gz YHRBXJCNEHHTRU-UHFFFAOYSA-N 1 2 302.443 4.338 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)c2ccc(Cl)s2)c(C)[nH+]1 ZINC000175727008 332904950 /nfs/dbraw/zinc/90/49/50/332904950.db2.gz DABIGYRPRIOSPR-JTQLQIEISA-N 1 2 308.834 4.464 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N(C)Cc1csc2ccccc12 ZINC000179857043 331547967 /nfs/dbraw/zinc/54/79/67/331547967.db2.gz ZSBVUYXNLZQNEY-UHFFFAOYSA-N 1 2 311.410 4.269 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1csnn1)c1cc(Cl)ccc1Cl ZINC000398291741 331604976 /nfs/dbraw/zinc/60/49/76/331604976.db2.gz CMOIPCNVRIWUFW-SFYZADRCSA-N 1 2 302.230 4.257 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2cc(Cl)sc2Cl)s1 ZINC000312575388 331662652 /nfs/dbraw/zinc/66/26/52/331662652.db2.gz DPFJYLQLEZMPCX-RXMQYKEDSA-N 1 2 308.259 4.066 20 0 DIADLO Cn1c2ccc(NC(=O)c3ccsc3)cc2[nH+]c1C(C)(C)C ZINC000536319146 331696623 /nfs/dbraw/zinc/69/66/23/331696623.db2.gz FOCYAZDXFQTOIO-UHFFFAOYSA-N 1 2 313.426 4.185 20 0 DIADLO Cc1oc(C(C)C)cc1C(=O)Nc1ccc2c(c1)[nH+]c(C)n2C ZINC000556858888 331742524 /nfs/dbraw/zinc/74/25/24/331742524.db2.gz ALHJFZDCIMZKBA-UHFFFAOYSA-N 1 2 311.385 4.159 20 0 DIADLO FC(F)(CN[C@@H](c1[nH]cc[nH+]1)C1CCCCC1)c1ccccc1 ZINC000556890930 331749171 /nfs/dbraw/zinc/74/91/71/331749171.db2.gz UJAKDVTVNYHLDR-MRXNPFEDSA-N 1 2 319.399 4.413 20 0 DIADLO Cc1ccccc1COc1cccc(N[C@@H](C)c2[nH]cc[nH+]2)c1 ZINC000556890664 331749241 /nfs/dbraw/zinc/74/92/41/331749241.db2.gz UUTLXMXDNHAXSZ-HNNXBMFYSA-N 1 2 307.397 4.470 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)sc1Cl)c1cncc(F)c1 ZINC000312872405 331769649 /nfs/dbraw/zinc/76/96/49/331769649.db2.gz DWXWJSUAKLZYIH-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2cccc(-c3ccccc3C)c2)n1 ZINC000557177074 331774708 /nfs/dbraw/zinc/77/47/08/331774708.db2.gz BEPWBNLLBXNAIJ-CQSZACIVSA-N 1 2 307.397 4.204 20 0 DIADLO Cc1nc(-c2ccccc2)c(C(=O)Nc2ccc(C)[nH+]c2C)s1 ZINC000176186237 332926987 /nfs/dbraw/zinc/92/69/87/332926987.db2.gz SDIBTCWLDNRFNV-UHFFFAOYSA-N 1 2 323.421 4.383 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccc1F)c1cc2cc(Cl)ccc2o1 ZINC000557800094 331817255 /nfs/dbraw/zinc/81/72/55/331817255.db2.gz OUXYMNFTZXFRMT-SNVBAGLBSA-N 1 2 304.752 4.471 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+][C@@H](C)c1nccn1-c1ccccc1 ZINC000558260339 331890632 /nfs/dbraw/zinc/89/06/32/331890632.db2.gz XRSICHPUIQKVNC-CVEARBPZSA-N 1 2 320.440 4.242 20 0 DIADLO COc1cc(Cl)c(C[NH+]2CC3(CCC3(F)F)C2)cc1Cl ZINC000558577484 331925385 /nfs/dbraw/zinc/92/53/85/331925385.db2.gz PHZVLBXMTWILJB-UHFFFAOYSA-N 1 2 322.182 4.233 20 0 DIADLO C[C@@H]([NH2+]Cc1noc2ccccc21)c1nc2c(s1)CCCC2 ZINC000580095549 332938891 /nfs/dbraw/zinc/93/88/91/332938891.db2.gz YFEZSVLIRNPHEQ-LLVKDONJSA-N 1 2 313.426 4.014 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)cs1 ZINC000517863140 331974751 /nfs/dbraw/zinc/97/47/51/331974751.db2.gz VMIRQHWSLBPBGB-WMLDXEAASA-N 1 2 311.454 4.230 20 0 DIADLO c1c(CSCc2cn3ccccc3[nH+]2)noc1-c1ccccc1 ZINC000084495391 332003244 /nfs/dbraw/zinc/00/32/44/332003244.db2.gz XDHBBCKIUNBZJZ-UHFFFAOYSA-N 1 2 321.405 4.423 20 0 DIADLO CC(C)[C@H](CC(=O)Nc1ccn2cc[nH+]c2c1)c1ccccc1 ZINC000559249341 332004385 /nfs/dbraw/zinc/00/43/85/332004385.db2.gz OKYWDYOTALBWQU-KRWDZBQOSA-N 1 2 307.397 4.103 20 0 DIADLO Cc1cc(Cl)cc(C[NH2+]Cc2nc(C)c3ccccc3n2)c1 ZINC000559259852 332007982 /nfs/dbraw/zinc/00/79/82/332007982.db2.gz IINGSLYFCYTDFN-UHFFFAOYSA-N 1 2 311.816 4.190 20 0 DIADLO CCc1cnc(C[N@H+](C)C[C@@H]2CCC3(CCCCC3)O2)s1 ZINC000409446832 332032533 /nfs/dbraw/zinc/03/25/33/332032533.db2.gz NMCIANDHWIFQFX-AWEZNQCLSA-N 1 2 308.491 4.019 20 0 DIADLO CCc1cnc(C[N@@H+](C)C[C@@H]2CCC3(CCCCC3)O2)s1 ZINC000409446832 332032534 /nfs/dbraw/zinc/03/25/34/332032534.db2.gz NMCIANDHWIFQFX-AWEZNQCLSA-N 1 2 308.491 4.019 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+]Cc3cn4ccsc4n3)o2)cc1 ZINC000409487359 332035095 /nfs/dbraw/zinc/03/50/95/332035095.db2.gz SLMKSADZUKIPLP-UHFFFAOYSA-N 1 2 323.421 4.254 20 0 DIADLO Cc1ccc(NC(=O)c2cc(C(F)(F)F)ccc2F)c(C)[nH+]1 ZINC000176449917 332941556 /nfs/dbraw/zinc/94/15/56/332941556.db2.gz ISPAGHITIKQSDS-UHFFFAOYSA-N 1 2 312.266 4.109 20 0 DIADLO CSC1(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)CC1 ZINC000569410249 332078140 /nfs/dbraw/zinc/07/81/40/332078140.db2.gz NUIZNMFMWVKIKI-UHFFFAOYSA-N 1 2 313.470 4.194 20 0 DIADLO Cc1c[nH+]cc(NCc2cc(Br)c(Cl)s2)c1 ZINC000235943993 332083317 /nfs/dbraw/zinc/08/33/17/332083317.db2.gz NWIPAQGSXJJDHA-UHFFFAOYSA-N 1 2 317.639 4.480 20 0 DIADLO CCc1noc([C@H](C)[N@H+]2CC=C(c3ccccc3Cl)CC2)n1 ZINC000091842835 332089330 /nfs/dbraw/zinc/08/93/30/332089330.db2.gz ZNCUZYYAEAOTNM-LBPRGKRZSA-N 1 2 317.820 4.136 20 0 DIADLO CCc1noc([C@H](C)[N@@H+]2CC=C(c3ccccc3Cl)CC2)n1 ZINC000091842835 332089332 /nfs/dbraw/zinc/08/93/32/332089332.db2.gz ZNCUZYYAEAOTNM-LBPRGKRZSA-N 1 2 317.820 4.136 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cccc(-c3ccncc3)c2)CC1(F)F ZINC000426378737 332097906 /nfs/dbraw/zinc/09/79/06/332097906.db2.gz QQPPPBQRMKAAEL-CQSZACIVSA-N 1 2 302.368 4.226 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cccc(-c3ccncc3)c2)CC1(F)F ZINC000426378737 332097907 /nfs/dbraw/zinc/09/79/07/332097907.db2.gz QQPPPBQRMKAAEL-CQSZACIVSA-N 1 2 302.368 4.226 20 0 DIADLO c1cc([C@H]2CCC[N@H+]2Cc2nc(C3CCCC3)no2)cs1 ZINC000132179333 332106959 /nfs/dbraw/zinc/10/69/59/332106959.db2.gz YQESYSPABAYENP-CQSZACIVSA-N 1 2 303.431 4.126 20 0 DIADLO c1cc([C@H]2CCC[N@@H+]2Cc2nc(C3CCCC3)no2)cs1 ZINC000132179333 332106961 /nfs/dbraw/zinc/10/69/61/332106961.db2.gz YQESYSPABAYENP-CQSZACIVSA-N 1 2 303.431 4.126 20 0 DIADLO Fc1ccc2c(c1)CC[N@@H+](Cc1ncc(-c3cccs3)o1)C2 ZINC000091896497 332113915 /nfs/dbraw/zinc/11/39/15/332113915.db2.gz CEWHZGPHUVGBFY-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1ccc2c(c1)CC[N@H+](Cc1ncc(-c3cccs3)o1)C2 ZINC000091896497 332113917 /nfs/dbraw/zinc/11/39/17/332113917.db2.gz CEWHZGPHUVGBFY-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO CCCc1csc(C[NH+]2CCC(CC(F)(F)F)CC2)n1 ZINC000569514174 332118096 /nfs/dbraw/zinc/11/80/96/332118096.db2.gz ZBNXBRQBBDRIOR-UHFFFAOYSA-N 1 2 306.397 4.260 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc3ccccc3c2)[C@@H](c2ccccc2)CO1 ZINC000410394727 332121895 /nfs/dbraw/zinc/12/18/95/332121895.db2.gz DSZAELPKCXSVEH-HRAATJIYSA-N 1 2 318.420 4.197 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnc3ccccc3c2)[C@@H](c2ccccc2)CO1 ZINC000410394727 332121897 /nfs/dbraw/zinc/12/18/97/332121897.db2.gz DSZAELPKCXSVEH-HRAATJIYSA-N 1 2 318.420 4.197 20 0 DIADLO C[N@H+](Cc1nc(-c2cccc(Cl)c2)no1)Cc1ccccc1 ZINC000016333889 332130741 /nfs/dbraw/zinc/13/07/41/332130741.db2.gz JUNHVCGDDFCCJS-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1nc(-c2cccc(Cl)c2)no1)Cc1ccccc1 ZINC000016333889 332130743 /nfs/dbraw/zinc/13/07/43/332130743.db2.gz JUNHVCGDDFCCJS-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+]2CCO[C@H](c3cccs3)C2)o1 ZINC000092594238 332134633 /nfs/dbraw/zinc/13/46/33/332134633.db2.gz PMHJZDMXGGZRNA-INWMFGNUSA-N 1 2 303.427 4.038 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CCO[C@H](c3cccs3)C2)o1 ZINC000092594238 332134635 /nfs/dbraw/zinc/13/46/35/332134635.db2.gz PMHJZDMXGGZRNA-INWMFGNUSA-N 1 2 303.427 4.038 20 0 DIADLO Fc1ccc(C[N@@H+]2CCO[C@@H](c3cccs3)C2)cc1Cl ZINC000092593777 332135202 /nfs/dbraw/zinc/13/52/02/332135202.db2.gz GMSXHLPNGCXVAK-CQSZACIVSA-N 1 2 311.809 4.114 20 0 DIADLO Fc1ccc(C[N@H+]2CCO[C@@H](c3cccs3)C2)cc1Cl ZINC000092593777 332135203 /nfs/dbraw/zinc/13/52/03/332135203.db2.gz GMSXHLPNGCXVAK-CQSZACIVSA-N 1 2 311.809 4.114 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCc1cc(C2CC2)ccc1F ZINC000569561677 332138489 /nfs/dbraw/zinc/13/84/89/332138489.db2.gz AATUYBYYYMXIMW-UHFFFAOYSA-N 1 2 313.376 4.037 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1nc2c(s1)CCC2)c1nc2ccccc2o1 ZINC000569566862 332140763 /nfs/dbraw/zinc/14/07/63/332140763.db2.gz TWGPACYRHNBDKM-GHMZBOCLSA-N 1 2 313.426 4.185 20 0 DIADLO CC[C@@H](CC(C)C)C(=O)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000410538052 332150011 /nfs/dbraw/zinc/15/00/11/332150011.db2.gz ACAVXPLEBBXNFC-AWEZNQCLSA-N 1 2 317.408 4.154 20 0 DIADLO CCCC(CCC)C(=O)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000410542804 332150238 /nfs/dbraw/zinc/15/02/38/332150238.db2.gz JQMLRDBECVULSU-UHFFFAOYSA-N 1 2 317.408 4.298 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2ccco2)cc1F)c1nccs1 ZINC000448020965 332179233 /nfs/dbraw/zinc/17/92/33/332179233.db2.gz FYJJYONLOZYSLO-NSHDSACASA-N 1 2 302.374 4.393 20 0 DIADLO CCc1cc(C)c(C(=O)Nc2ccccc2-c2[nH]cc(C)[nH+]2)o1 ZINC000427189593 332182682 /nfs/dbraw/zinc/18/26/82/332182682.db2.gz OGMHGVUJOSNBSO-UHFFFAOYSA-N 1 2 309.369 4.101 20 0 DIADLO Cc1nccnc1[C@@H](C)[NH2+]Cc1ccc(-c2ccco2)cc1F ZINC000448022181 332188010 /nfs/dbraw/zinc/18/80/10/332188010.db2.gz MVLCLOMEZNAPIX-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(-c2ccco2)cc1F)c1nccn1C ZINC000448022536 332188388 /nfs/dbraw/zinc/18/83/88/332188388.db2.gz OIVSSKLDQFPBAU-INIZCTEOSA-N 1 2 313.376 4.060 20 0 DIADLO C[N@H+](Cc1csc(Cl)c1Cl)[C@H](CO)c1ccccc1 ZINC000449453672 332207384 /nfs/dbraw/zinc/20/73/84/332207384.db2.gz NBSJXXNRORLKRH-GFCCVEGCSA-N 1 2 316.253 4.220 20 0 DIADLO C[N@@H+](Cc1csc(Cl)c1Cl)[C@H](CO)c1ccccc1 ZINC000449453672 332207386 /nfs/dbraw/zinc/20/73/86/332207386.db2.gz NBSJXXNRORLKRH-GFCCVEGCSA-N 1 2 316.253 4.220 20 0 DIADLO FC(F)(F)c1cccc(C[N@H+]2CC=C(C(F)(F)F)CC2)c1 ZINC000533833953 332216800 /nfs/dbraw/zinc/21/68/00/332216800.db2.gz NCHGNRGPJLJRHW-UHFFFAOYSA-N 1 2 309.253 4.400 20 0 DIADLO FC(F)(F)c1cccc(C[N@@H+]2CC=C(C(F)(F)F)CC2)c1 ZINC000533833953 332216801 /nfs/dbraw/zinc/21/68/01/332216801.db2.gz NCHGNRGPJLJRHW-UHFFFAOYSA-N 1 2 309.253 4.400 20 0 DIADLO Cc1ccc(NC(=O)c2ccnc(Oc3ccccc3)c2)c(C)[nH+]1 ZINC000531035015 332218137 /nfs/dbraw/zinc/21/81/37/332218137.db2.gz GKGUCBVCGAHAEH-UHFFFAOYSA-N 1 2 319.364 4.138 20 0 DIADLO CC[N@H+](Cc1cc(OC)cc(C)n1)Cc1ccccc1Cl ZINC000533839998 332218470 /nfs/dbraw/zinc/21/84/70/332218470.db2.gz AMPBRCXZLBLVCK-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CC[N@@H+](Cc1cc(OC)cc(C)n1)Cc1ccccc1Cl ZINC000533839998 332218472 /nfs/dbraw/zinc/21/84/72/332218472.db2.gz AMPBRCXZLBLVCK-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCC(C)(C)OCc1ccccc1NCc1[nH]c(C)c(C)[nH+]1 ZINC000584302449 332230813 /nfs/dbraw/zinc/23/08/13/332230813.db2.gz DORMXMZGMBZCIW-UHFFFAOYSA-N 1 2 301.434 4.344 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1csnn1)c1ccc(Cl)cc1Cl ZINC000398318695 332230905 /nfs/dbraw/zinc/23/09/05/332230905.db2.gz GYHRQTWXKXNULG-SFYZADRCSA-N 1 2 302.230 4.257 20 0 DIADLO Fc1ccc(-c2cnc(C[N@@H+]3CCc4ccsc4C3)o2)cc1 ZINC000536368650 332232844 /nfs/dbraw/zinc/23/28/44/332232844.db2.gz HLEWMLYMQMGGPY-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1ccc(-c2cnc(C[N@H+]3CCc4ccsc4C3)o2)cc1 ZINC000536368650 332232845 /nfs/dbraw/zinc/23/28/45/332232845.db2.gz HLEWMLYMQMGGPY-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO COC[C@@H]([NH2+]Cc1c(Cl)oc2ccccc21)c1ccc(C)o1 ZINC000536373336 332234712 /nfs/dbraw/zinc/23/47/12/332234712.db2.gz CRWMOZXNQFLAQU-CQSZACIVSA-N 1 2 319.788 4.465 20 0 DIADLO CCCc1nc(CSCc2cc(OC)cc(C)[nH+]2)cs1 ZINC000538525271 332243062 /nfs/dbraw/zinc/24/30/62/332243062.db2.gz FIKMTPBAQCRSNU-UHFFFAOYSA-N 1 2 308.472 4.241 20 0 DIADLO Cc1cn2cc(NC(=O)c3c(Cl)cccc3Cl)ccc2[nH+]1 ZINC000531099702 332261504 /nfs/dbraw/zinc/26/15/04/332261504.db2.gz FAAPFJDJUPMZCF-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO CC[C@@H](c1ccccc1)[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000559479532 332263837 /nfs/dbraw/zinc/26/38/37/332263837.db2.gz KDUYMLKHENQLRW-IBGZPJMESA-N 1 2 303.409 4.339 20 0 DIADLO CC[C@@H](c1ccccc1)[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000559479532 332263839 /nfs/dbraw/zinc/26/38/39/332263839.db2.gz KDUYMLKHENQLRW-IBGZPJMESA-N 1 2 303.409 4.339 20 0 DIADLO Cc1coc(C)c1C(=O)Nc1ccc2[nH]c(C(C)(C)C)[nH+]c2c1 ZINC000559503879 332267369 /nfs/dbraw/zinc/26/73/69/332267369.db2.gz GFLFZPZPTWCYJC-UHFFFAOYSA-N 1 2 311.385 4.323 20 0 DIADLO CSC[C@@H]([NH2+]CC(C)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000559890833 332289804 /nfs/dbraw/zinc/28/98/04/332289804.db2.gz ISFLQCIKFKNAOH-LLVKDONJSA-N 1 2 313.335 4.354 20 0 DIADLO CC(F)(F)C[NH2+][C@@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000559890939 332289867 /nfs/dbraw/zinc/28/98/67/332289867.db2.gz KZJIKMIXJIDHNL-GFCCVEGCSA-N 1 2 309.278 4.281 20 0 DIADLO Cc1noc(C(C)(C)[NH2+]Cc2ccc(-c3ccccc3)s2)n1 ZINC000560070967 332308638 /nfs/dbraw/zinc/30/86/38/332308638.db2.gz FLMNATPIWRRPPQ-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO CC(C)C[N@H+](Cc1nccn1C)[C@H](C)c1ccccc1Cl ZINC000560182297 332317297 /nfs/dbraw/zinc/31/72/97/332317297.db2.gz HQHMHNGXWSQUJH-CQSZACIVSA-N 1 2 305.853 4.293 20 0 DIADLO CC(C)C[N@@H+](Cc1nccn1C)[C@H](C)c1ccccc1Cl ZINC000560182297 332317299 /nfs/dbraw/zinc/31/72/99/332317299.db2.gz HQHMHNGXWSQUJH-CQSZACIVSA-N 1 2 305.853 4.293 20 0 DIADLO CC(C)C[N@H+](Cc1nccn1C)[C@@H](C)c1ccccc1Cl ZINC000560182294 332317402 /nfs/dbraw/zinc/31/74/02/332317402.db2.gz HQHMHNGXWSQUJH-AWEZNQCLSA-N 1 2 305.853 4.293 20 0 DIADLO CC(C)C[N@@H+](Cc1nccn1C)[C@@H](C)c1ccccc1Cl ZINC000560182294 332317403 /nfs/dbraw/zinc/31/74/03/332317403.db2.gz HQHMHNGXWSQUJH-AWEZNQCLSA-N 1 2 305.853 4.293 20 0 DIADLO Cc1ccc[nH+]c1CCc1noc([C@@H]2C[C@@H]2C2CCCCC2)n1 ZINC000560354404 332334037 /nfs/dbraw/zinc/33/40/37/332334037.db2.gz RMCXAENOPJIETN-HZPDHXFCSA-N 1 2 311.429 4.242 20 0 DIADLO Cc1cc(C)c(NC(=O)CCCOc2ccccc2C)c(C)[nH+]1 ZINC000097214084 332334257 /nfs/dbraw/zinc/33/42/57/332334257.db2.gz MZFBXGLZOXABLP-UHFFFAOYSA-N 1 2 312.413 4.113 20 0 DIADLO O=C(Cc1coc2ccccc12)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000560411133 332337337 /nfs/dbraw/zinc/33/73/37/332337337.db2.gz LDNLBMZFNZBYCM-UHFFFAOYSA-N 1 2 317.348 4.004 20 0 DIADLO Oc1ccc(F)c(C[NH2+]Cc2ccc3sccc3c2)c1F ZINC000560533766 332353723 /nfs/dbraw/zinc/35/37/23/332353723.db2.gz UYNDEFVERNMCIE-UHFFFAOYSA-N 1 2 305.349 4.175 20 0 DIADLO Cc1c(COc2ccccc2)cccc1N[C@@H](C)c1[nH]cc[nH+]1 ZINC000560553869 332359042 /nfs/dbraw/zinc/35/90/42/332359042.db2.gz MWOCDPWUJLOWNR-HNNXBMFYSA-N 1 2 307.397 4.470 20 0 DIADLO CCc1ccc(NC2CC[NH+](CC(F)F)CC2)cc1Cl ZINC000560585095 332365442 /nfs/dbraw/zinc/36/54/42/332365442.db2.gz QHNZAJWMHHXLIW-UHFFFAOYSA-N 1 2 302.796 4.044 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000560608417 332369272 /nfs/dbraw/zinc/36/92/72/332369272.db2.gz NPQZJAZINSTOSV-UHFFFAOYSA-N 1 2 317.191 4.315 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000560608417 332369273 /nfs/dbraw/zinc/36/92/73/332369273.db2.gz NPQZJAZINSTOSV-UHFFFAOYSA-N 1 2 317.191 4.315 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)CSc1ccc(F)cc1 ZINC000425585793 335107086 /nfs/dbraw/zinc/10/70/86/335107086.db2.gz ISSZTCRNNAURJN-LBPRGKRZSA-N 1 2 318.417 4.204 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@@H](C)Cc1cccc(F)c1 ZINC000425586343 335107281 /nfs/dbraw/zinc/10/72/81/335107281.db2.gz KHSFBMRBFXWBFY-LBPRGKRZSA-N 1 2 300.377 4.045 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1cc(C)c(OC(F)F)c(C)c1 ZINC000425587385 335107384 /nfs/dbraw/zinc/10/73/84/335107384.db2.gz NTTKFLVIPDYILW-UHFFFAOYSA-N 1 2 320.339 4.169 20 0 DIADLO Cc1cccc(OCCCCC(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000425586859 335107395 /nfs/dbraw/zinc/10/73/95/335107395.db2.gz LXANBQOFNOHAFF-UHFFFAOYSA-N 1 2 312.413 4.195 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1csc2c1CC[C@@H](C)C2 ZINC000425587426 335107451 /nfs/dbraw/zinc/10/74/51/335107451.db2.gz OENKZMMHJBZRNR-SNVBAGLBSA-N 1 2 300.427 4.137 20 0 DIADLO C[C@H]1CC[C@@H](C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)C1 ZINC000425571301 335104538 /nfs/dbraw/zinc/10/45/38/335104538.db2.gz MYUIGGYHNQQGNC-LSDHHAIUSA-N 1 2 323.440 4.261 20 0 DIADLO CCOc1ccc([C@H]2CCCN2c2cc(C)[nH+]c(CC)n2)cc1 ZINC000561107684 332412069 /nfs/dbraw/zinc/41/20/69/332412069.db2.gz NNQGCLOEHVTLDD-QGZVFWFLSA-N 1 2 311.429 4.088 20 0 DIADLO C[C@@H](O)C[C@@H](CNc1cc(C(F)(F)F)cc[nH+]1)c1ccccc1 ZINC000561259037 332431232 /nfs/dbraw/zinc/43/12/32/332431232.db2.gz INWKJOPMMRBOQI-OCCSQVGLSA-N 1 2 324.346 4.067 20 0 DIADLO COc1cc[nH+]cc1CSCc1cccc(Br)c1 ZINC000561440569 332451048 /nfs/dbraw/zinc/45/10/48/332451048.db2.gz FHCOZMIRRUOINO-UHFFFAOYSA-N 1 2 324.243 4.286 20 0 DIADLO OCc1ccc(NCc2ccc(-c3ccccc3F)s2)[nH+]c1 ZINC000562208537 332559959 /nfs/dbraw/zinc/55/99/59/332559959.db2.gz WKQTTXVCZUBIMO-UHFFFAOYSA-N 1 2 314.385 4.054 20 0 DIADLO Cc1cc(NC(=O)N2C[C@@H](C)CC[C@@H]2c2ccccc2)c(C)c[nH+]1 ZINC000562250202 332564167 /nfs/dbraw/zinc/56/41/67/332564167.db2.gz OGMGBPVALHBFAU-IFXJQAMLSA-N 1 2 323.440 4.125 20 0 DIADLO Cc1ccc(CC(=O)Nc2ccc(Oc3cc[nH+]cc3)c(C)c2)o1 ZINC000562349036 332582210 /nfs/dbraw/zinc/58/22/10/332582210.db2.gz ITBBKZAKJGJLSP-UHFFFAOYSA-N 1 2 322.364 4.265 20 0 DIADLO CCc1c(NCc2ccc(C)[nH+]c2C)cnn1-c1ccccc1 ZINC000562505699 332599955 /nfs/dbraw/zinc/59/99/55/332599955.db2.gz FJTZDVCXLKEBNU-UHFFFAOYSA-N 1 2 306.413 4.059 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc(/C=C2\CC[C@@H](C)C2)n1 ZINC000562551204 332603197 /nfs/dbraw/zinc/60/31/97/332603197.db2.gz WEPVUDVJVDPTDQ-MLJWKTOOSA-N 1 2 322.412 4.174 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H](C)c1cc(F)ccc1F ZINC000169282336 332627668 /nfs/dbraw/zinc/62/76/68/332627668.db2.gz YEDYCDVLLAFADK-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO CS[C@@H](C)C[NH2+][C@H](c1cccc(OC(C)C)c1)C(F)F ZINC000562933445 332646983 /nfs/dbraw/zinc/64/69/83/332646983.db2.gz VFGFZGOMUKOYAB-SMDDNHRTSA-N 1 2 303.418 4.121 20 0 DIADLO CC[C@@H](CC(=O)N[C@@H](c1[nH]cc[nH+]1)C(C)C)c1ccc(C)cc1 ZINC000570465511 332759978 /nfs/dbraw/zinc/75/99/78/332759978.db2.gz LHVXKGZIMVNDBT-MAUKXSAKSA-N 1 2 313.445 4.115 20 0 DIADLO Cc1cccn2cc(C[S@@](=O)c3ccc4ccccc4c3)[nH+]c12 ZINC000176637937 332950323 /nfs/dbraw/zinc/95/03/23/332950323.db2.gz BAAOAHTXJLLGRB-HSZRJFAPSA-N 1 2 320.417 4.104 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C)[C@H](C)c3ccc(C)cc3C)ccn12 ZINC000580213498 333013205 /nfs/dbraw/zinc/01/32/05/333013205.db2.gz RVIIVWJIBYKWRM-MRXNPFEDSA-N 1 2 321.424 4.093 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@@H](Oc3ccccc3Cl)C2)sc1C ZINC000178973613 333022892 /nfs/dbraw/zinc/02/28/92/333022892.db2.gz FZQRJXHBIVOBAZ-CYBMUJFWSA-N 1 2 322.861 4.067 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@@H](Oc3ccccc3Cl)C2)sc1C ZINC000178973613 333022893 /nfs/dbraw/zinc/02/28/93/333022893.db2.gz FZQRJXHBIVOBAZ-CYBMUJFWSA-N 1 2 322.861 4.067 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nc(-c3cccs3)no2)cc1F ZINC000181351577 333029478 /nfs/dbraw/zinc/02/94/78/333029478.db2.gz CSRADDXIERNCGU-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccccc2)no1)c1cc2ccccc2o1 ZINC000181767758 333032199 /nfs/dbraw/zinc/03/21/99/333032199.db2.gz MESIGBJGTNVEKL-CYBMUJFWSA-N 1 2 319.364 4.334 20 0 DIADLO COC(=O)c1sccc1C[N@H+](C)[C@@H](C)c1ccccc1Cl ZINC000378665510 333042687 /nfs/dbraw/zinc/04/26/87/333042687.db2.gz JHGXEIFSLNLJMU-NSHDSACASA-N 1 2 323.845 4.381 20 0 DIADLO COC(=O)c1sccc1C[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC000378665510 333042688 /nfs/dbraw/zinc/04/26/88/333042688.db2.gz JHGXEIFSLNLJMU-NSHDSACASA-N 1 2 323.845 4.381 20 0 DIADLO Fc1ccc([C@H](Nc2cccc(Cl)c2)c2[nH]cc[nH+]2)cc1 ZINC000188341358 333043595 /nfs/dbraw/zinc/04/35/95/333043595.db2.gz FQLBGPMFKFPQGI-HNNXBMFYSA-N 1 2 301.752 4.404 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC(C)(C)C2=CCCC2)c(C)[nH+]1 ZINC000580281448 333055094 /nfs/dbraw/zinc/05/50/94/333055094.db2.gz FBIBMKVUWRLGGW-UHFFFAOYSA-N 1 2 301.434 4.265 20 0 DIADLO CC(F)(F)C[NH2+][C@@H](c1ccc(Br)s1)C1CC1 ZINC000378855183 333056266 /nfs/dbraw/zinc/05/62/66/333056266.db2.gz JNXCGZMUTOEMRO-SNVBAGLBSA-N 1 2 310.207 4.207 20 0 DIADLO CCCN(C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)C1CC1 ZINC000171975508 333056673 /nfs/dbraw/zinc/05/66/73/333056673.db2.gz JBNRWHXZUTYHOI-UHFFFAOYSA-N 1 2 311.385 4.280 20 0 DIADLO COc1c(C)c[nH+]c(CN[C@H](C)c2ccc(F)cc2Cl)c1C ZINC000183785152 333063151 /nfs/dbraw/zinc/06/31/51/333063151.db2.gz BVWNALRDFJYZPV-GFCCVEGCSA-N 1 2 322.811 4.350 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2nc(C(C)(C)C)cs2)C1 ZINC000460348562 333068225 /nfs/dbraw/zinc/06/82/25/333068225.db2.gz MHMKSPLMBGGPDS-DZGCQCFKSA-N 1 2 315.486 4.419 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2nc(C(C)(C)C)cs2)C1 ZINC000460348562 333068226 /nfs/dbraw/zinc/06/82/26/333068226.db2.gz MHMKSPLMBGGPDS-DZGCQCFKSA-N 1 2 315.486 4.419 20 0 DIADLO Cc1ccc(C[NH2+]Cc2cc(Cl)sc2Cl)nc1C ZINC000313807834 333070303 /nfs/dbraw/zinc/07/03/03/333070303.db2.gz ANYBRBMDXGLATL-UHFFFAOYSA-N 1 2 301.242 4.357 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2ccc(-c3ccccc3)s2)no1 ZINC000518774431 333109805 /nfs/dbraw/zinc/10/98/05/333109805.db2.gz HGMCKNMKKXHJSV-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO CCC(=Cc1nc(Cn2c(CC)[nH+]c3ccccc32)no1)CC ZINC000460731522 333130014 /nfs/dbraw/zinc/13/00/14/333130014.db2.gz SKUFXLDYQKHOCW-UHFFFAOYSA-N 1 2 310.401 4.233 20 0 DIADLO Fc1cccc(C[C@@H]([NH2+]Cc2cocn2)c2cccc(F)c2)c1 ZINC000182077531 333148562 /nfs/dbraw/zinc/14/85/62/333148562.db2.gz ZPPFVYCJLAAOGI-GOSISDBHSA-N 1 2 314.335 4.026 20 0 DIADLO CCn1cc([C@H](C)[NH2+][C@@H](c2cccc(C)c2)c2ccccn2)cn1 ZINC000179535428 333152321 /nfs/dbraw/zinc/15/23/21/333152321.db2.gz GIWXKWZZMDTMGV-JXFKEZNVSA-N 1 2 320.440 4.047 20 0 DIADLO Cc1ccc(NC(=O)N(C)Cc2ccc(Cl)c(F)c2)c(C)[nH+]1 ZINC000179546229 333152522 /nfs/dbraw/zinc/15/25/22/333152522.db2.gz TZTQVLWFFJWSDR-UHFFFAOYSA-N 1 2 321.783 4.155 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@@H](c2ccccc2)C2CC2)n1 ZINC000179688691 333154382 /nfs/dbraw/zinc/15/43/82/333154382.db2.gz QMQGVDYXJQJMIU-LRDDRELGSA-N 1 2 317.458 4.125 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](Cc3cccs3)CCO2)cc1Cl ZINC000092972807 333156697 /nfs/dbraw/zinc/15/66/97/333156697.db2.gz SVDMEEUFGLQSIM-OAHLLOKOSA-N 1 2 311.809 4.114 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](Cc3cccs3)CCO2)cc1Cl ZINC000092972807 333156698 /nfs/dbraw/zinc/15/66/98/333156698.db2.gz SVDMEEUFGLQSIM-OAHLLOKOSA-N 1 2 311.809 4.114 20 0 DIADLO Cc1cc(C)cc([C@H](C)[NH2+]Cc2noc(-c3ccccc3)n2)c1 ZINC000182930616 333181662 /nfs/dbraw/zinc/18/16/62/333181662.db2.gz GGIFEYSPQKRHLX-HNNXBMFYSA-N 1 2 307.397 4.204 20 0 DIADLO CCCn1c(C)nnc1C[NH2+][C@@H](c1ccccc1Cl)C(C)C ZINC000183704785 333187321 /nfs/dbraw/zinc/18/73/21/333187321.db2.gz NWKUAMPYDRLJTE-QGZVFWFLSA-N 1 2 320.868 4.137 20 0 DIADLO Fc1cc2[nH+]cn(C[C@@H]3CCC4(CCCCC4)O3)c2cc1F ZINC000318586357 333191199 /nfs/dbraw/zinc/19/11/99/333191199.db2.gz XVGMFVYILPZGQV-LBPRGKRZSA-N 1 2 306.356 4.196 20 0 DIADLO Cc1cc(C)cc([C@H](C)Nc2cc(N3CCCCC3)nc[nH+]2)c1 ZINC000514084763 333231001 /nfs/dbraw/zinc/23/10/01/333231001.db2.gz RPWDXYOBHACLIC-INIZCTEOSA-N 1 2 310.445 4.257 20 0 DIADLO Cc1cc(C)cc([C@H](C)Nc2cc(N3CCCCC3)[nH+]cn2)c1 ZINC000514084763 333231003 /nfs/dbraw/zinc/23/10/03/333231003.db2.gz RPWDXYOBHACLIC-INIZCTEOSA-N 1 2 310.445 4.257 20 0 DIADLO COc1cncc(/C=C\CC[NH2+][C@H](C(C)(C)C)C(F)(F)F)c1 ZINC000581187847 333240873 /nfs/dbraw/zinc/24/08/73/333240873.db2.gz IXDDTQABHKLSEP-BRLPQQTGSA-N 1 2 316.367 4.060 20 0 DIADLO COc1ccc(CNc2cccc[nH+]2)cc1OCc1ccccc1 ZINC000019778419 333245795 /nfs/dbraw/zinc/24/57/95/333245795.db2.gz UIPUVNBIUZKIFZ-UHFFFAOYSA-N 1 2 320.392 4.281 20 0 DIADLO C/C=C/c1ccc(NC(=O)NCCCCNc2cccc[nH+]2)cc1 ZINC000497404444 333247035 /nfs/dbraw/zinc/24/70/35/333247035.db2.gz ABFOALZQAJLPTA-FARCUNLSSA-N 1 2 324.428 4.129 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000497590352 333266408 /nfs/dbraw/zinc/26/64/08/333266408.db2.gz FGQYYMSNQJZEGX-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000497590352 333266409 /nfs/dbraw/zinc/26/64/09/333266409.db2.gz FGQYYMSNQJZEGX-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccc(F)cn1 ZINC000497827597 333297227 /nfs/dbraw/zinc/29/72/27/333297227.db2.gz GXUBEJRCMAJTRQ-INIZCTEOSA-N 1 2 321.465 4.462 20 0 DIADLO CCCCCC(=O)N1CC[NH+]([C@@H](C)c2ccccc2Cl)CC1 ZINC000497890263 333305839 /nfs/dbraw/zinc/30/58/39/333305839.db2.gz OSEJYSDRRYHAQB-HNNXBMFYSA-N 1 2 322.880 4.126 20 0 DIADLO C[C@H]([NH2+][C@H](CO)c1cccc(Cl)c1F)c1ccccc1F ZINC000499946441 333320327 /nfs/dbraw/zinc/32/03/27/333320327.db2.gz LXLHBUVMPRHLSH-ZUZCIYMTSA-N 1 2 311.759 4.002 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccn(-c3ccccc3)n2)[C@H]1c1ccccc1 ZINC000531378336 333347366 /nfs/dbraw/zinc/34/73/66/333347366.db2.gz FXMHRFURAHDNIH-OXQOHEQNSA-N 1 2 303.409 4.065 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccn(-c3ccccc3)n2)[C@H]1c1ccccc1 ZINC000531378336 333347367 /nfs/dbraw/zinc/34/73/67/333347367.db2.gz FXMHRFURAHDNIH-OXQOHEQNSA-N 1 2 303.409 4.065 20 0 DIADLO O[C@@]1(CNc2ccc3ccccc3[nH+]2)CCC[C@H](C(F)(F)F)C1 ZINC000186727393 333377410 /nfs/dbraw/zinc/37/74/10/333377410.db2.gz MFKRDWCEVCMSIJ-BBRMVZONSA-N 1 2 324.346 4.130 20 0 DIADLO CC[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc(OC)cc1 ZINC000319639743 333392137 /nfs/dbraw/zinc/39/21/37/333392137.db2.gz CXSDVNKRBVUVDR-SFHVURJKSA-N 1 2 311.429 4.254 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)Nc1ccc(N2CCCC2)[nH+]c1 ZINC000319662954 333393933 /nfs/dbraw/zinc/39/39/33/333393933.db2.gz GXIBFPWSFDBWJU-OAHLLOKOSA-N 1 2 311.429 4.172 20 0 DIADLO Cc1cc(CNc2ccc(N3CCCCC3)[nH+]c2)cc(C)c1O ZINC000319769503 333403636 /nfs/dbraw/zinc/40/36/36/333403636.db2.gz FMDAWUMWHLNELZ-UHFFFAOYSA-N 1 2 311.429 4.006 20 0 DIADLO Cc1ccc(NC(=O)NCc2c(Cl)cccc2Cl)c(C)[nH+]1 ZINC000531523111 333531965 /nfs/dbraw/zinc/53/19/65/333531965.db2.gz OMYPTNBTMJRLCW-UHFFFAOYSA-N 1 2 324.211 4.327 20 0 DIADLO Cc1cc(NCCc2cnc(C3CC3)nc2)c2cccc(F)c2[nH+]1 ZINC000534422981 333586676 /nfs/dbraw/zinc/58/66/76/333586676.db2.gz PBZRJKXNYQXJCN-UHFFFAOYSA-N 1 2 322.387 4.004 20 0 DIADLO Cc1ccc(NC(=O)N[C@H](C)c2cc3ccccc3o2)c(C)[nH+]1 ZINC000152154380 333633058 /nfs/dbraw/zinc/63/30/58/333633058.db2.gz WLOSHVLSFIJFKO-CYBMUJFWSA-N 1 2 309.369 4.327 20 0 DIADLO CCc1cc(N(C)C2CCC(C)CC2)nc(-c2ccncc2)[nH+]1 ZINC000303382495 333640619 /nfs/dbraw/zinc/64/06/19/333640619.db2.gz LYEKWAXKPRFNOK-UHFFFAOYSA-N 1 2 310.445 4.116 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@@](C)(c3ccccc3)C2)c(C)[nH+]1 ZINC000152217961 333644897 /nfs/dbraw/zinc/64/48/97/333644897.db2.gz REXKVLPHVGLUKG-HXUWFJFHSA-N 1 2 323.440 4.284 20 0 DIADLO Cc1c[nH+]c(C)nc1N1CCC(c2nc3ccccc3s2)CC1 ZINC000563655697 333648427 /nfs/dbraw/zinc/64/84/27/333648427.db2.gz HVTJZNGMAMCZOS-UHFFFAOYSA-N 1 2 324.453 4.087 20 0 DIADLO Cc1ccc(-n2cc[nH+]c2)c(-c2nc(-c3ccccc3C)no2)c1 ZINC000571243395 333689500 /nfs/dbraw/zinc/68/95/00/333689500.db2.gz LBWLKKXBNJZJEN-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Cc1[nH+]c2cc(CNC(=O)C3=CC[C@@H](C)CC3)ccc2n1C1CC1 ZINC000412329051 333747619 /nfs/dbraw/zinc/74/76/19/333747619.db2.gz IRMWUWOUEZXDSQ-CYBMUJFWSA-N 1 2 323.440 4.042 20 0 DIADLO CC(C)[C@@H](NC(=O)CC(C)(C)C1CCCCC1)c1[nH]cc[nH+]1 ZINC000571348499 333769150 /nfs/dbraw/zinc/76/91/50/333769150.db2.gz UWXVPBYIOZXEKB-MRXNPFEDSA-N 1 2 305.466 4.220 20 0 DIADLO COCC[C@H](C)C[NH2+][C@H](c1cccc(OC(C)C)c1)C(F)F ZINC000571536491 333815168 /nfs/dbraw/zinc/81/51/68/333815168.db2.gz JUXHVGWPVLJCSR-XJKSGUPXSA-N 1 2 315.404 4.042 20 0 DIADLO COCC[C@@H](C)C[NH2+][C@H](c1cccc(OC(C)C)c1)C(F)F ZINC000571536490 333815291 /nfs/dbraw/zinc/81/52/91/333815291.db2.gz JUXHVGWPVLJCSR-CZUORRHYSA-N 1 2 315.404 4.042 20 0 DIADLO CCC(CC)[C@@H](C)C(=O)N1CCCC[C@@H]1c1[nH+]ccn1CC ZINC000435981204 333831568 /nfs/dbraw/zinc/83/15/68/333831568.db2.gz IOGYISZPHSQPSK-GDBMZVCRSA-N 1 2 305.466 4.029 20 0 DIADLO CC(C)(C)c1ccncc1CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000413516420 333853579 /nfs/dbraw/zinc/85/35/79/333853579.db2.gz OEGYAMCZYNIWAV-UHFFFAOYSA-N 1 2 309.335 4.405 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000413667109 333862835 /nfs/dbraw/zinc/86/28/35/333862835.db2.gz LCEZUVYTIXOPOZ-HZPDHXFCSA-N 1 2 303.450 4.070 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccn(C)n1)c1cc(F)c(Cl)cc1Cl ZINC000414057904 333888415 /nfs/dbraw/zinc/88/84/15/333888415.db2.gz SIOANYWAVVNXLU-BDAKNGLRSA-N 1 2 316.207 4.278 20 0 DIADLO CCC[C@H]([NH2+][C@@H](C)c1cc2n(n1)CCC2)c1ccc(F)cc1F ZINC000414097628 333895705 /nfs/dbraw/zinc/89/57/05/333895705.db2.gz IIFKAMUXUFBLLJ-SJCJKPOMSA-N 1 2 319.399 4.300 20 0 DIADLO CCn1ccc(C[NH2+][C@H](c2ccccc2)c2cc(C)ccc2C)n1 ZINC000414203872 333913900 /nfs/dbraw/zinc/91/39/00/333913900.db2.gz FNLSCUYXEUUOKW-OAQYLSRUSA-N 1 2 319.452 4.399 20 0 DIADLO CN(C(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1)C1CCC1 ZINC000266043580 333970380 /nfs/dbraw/zinc/97/03/80/333970380.db2.gz LVWMJSWZIGFJOA-UHFFFAOYSA-N 1 2 316.788 4.152 20 0 DIADLO CCc1ccc(-c2noc([C@@H](C)[NH2+]Cc3ccoc3C)n2)cc1 ZINC000414430931 333973212 /nfs/dbraw/zinc/97/32/12/333973212.db2.gz GWYUYLWSHPPKTM-GFCCVEGCSA-N 1 2 311.385 4.051 20 0 DIADLO Clc1cccc(C[NH2+]Cc2nnc(C3CC3)s2)c1Cl ZINC000414553212 334016174 /nfs/dbraw/zinc/01/61/74/334016174.db2.gz IOWBMKJGWUXJDG-UHFFFAOYSA-N 1 2 314.241 4.012 20 0 DIADLO COCC[C@H]([NH2+]Cc1csc(C(C)(C)C)n1)c1ccc(C)o1 ZINC000272273244 334032592 /nfs/dbraw/zinc/03/25/92/334032592.db2.gz KTOQSUMFKZKUPB-AWEZNQCLSA-N 1 2 322.474 4.209 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+]1CCc2c(F)cc(F)cc2[C@@H]1C ZINC000343528961 335175133 /nfs/dbraw/zinc/17/51/33/335175133.db2.gz CHJCOYXSRYPUNI-ZDUSSCGKSA-N 1 2 319.399 4.170 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+]1CCc2c(F)cc(F)cc2[C@@H]1C ZINC000343528961 335175134 /nfs/dbraw/zinc/17/51/34/335175134.db2.gz CHJCOYXSRYPUNI-ZDUSSCGKSA-N 1 2 319.399 4.170 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+](C)Cc1cc(Cl)ccc1F ZINC000343602359 335176360 /nfs/dbraw/zinc/17/63/60/335176360.db2.gz KWZVKGHNBOXSST-UHFFFAOYSA-N 1 2 309.816 4.197 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+](C)Cc1cc(Cl)ccc1F ZINC000343602359 335176363 /nfs/dbraw/zinc/17/63/63/335176363.db2.gz KWZVKGHNBOXSST-UHFFFAOYSA-N 1 2 309.816 4.197 20 0 DIADLO CC1(C)CCc2ccccc2[C@H]([NH2+]Cc2noc(C3CC3)n2)C1 ZINC000281834604 334128652 /nfs/dbraw/zinc/12/86/52/334128652.db2.gz YAWOMVGUYYXTLO-MRXNPFEDSA-N 1 2 311.429 4.140 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000343559644 335177981 /nfs/dbraw/zinc/17/79/81/335177981.db2.gz YAMHLVKOLNAVFO-CYBMUJFWSA-N 1 2 307.388 4.244 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000343559644 335177982 /nfs/dbraw/zinc/17/79/82/335177982.db2.gz YAMHLVKOLNAVFO-CYBMUJFWSA-N 1 2 307.388 4.244 20 0 DIADLO c1cc([C@@H]2CCCC[N@H+]2Cc2cnc(-c3ccccc3)s2)n[nH]1 ZINC000285329928 334147102 /nfs/dbraw/zinc/14/71/02/334147102.db2.gz JQTLPFSRMHPPEX-KRWDZBQOSA-N 1 2 324.453 4.260 20 0 DIADLO c1cc([C@@H]2CCCC[N@@H+]2Cc2cnc(-c3ccccc3)s2)n[nH]1 ZINC000285329928 334147104 /nfs/dbraw/zinc/14/71/04/334147104.db2.gz JQTLPFSRMHPPEX-KRWDZBQOSA-N 1 2 324.453 4.260 20 0 DIADLO Cc1ccc(NC(=O)[C@H](c2ccc(F)cc2)C(C)C)c(C)[nH+]1 ZINC000534474722 334271918 /nfs/dbraw/zinc/27/19/18/334271918.db2.gz NSIOOJJAFJNLQB-KRWDZBQOSA-N 1 2 300.377 4.216 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccncn1 ZINC000453052881 334228543 /nfs/dbraw/zinc/22/85/43/334228543.db2.gz DVMVEIDCPKKPPZ-DTWKUNHWSA-N 1 2 314.191 4.334 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccncn1)c1c(Cl)ccc(F)c1Cl ZINC000453067485 334229776 /nfs/dbraw/zinc/22/97/76/334229776.db2.gz WPTGFFAOEOKFDZ-DTWKUNHWSA-N 1 2 314.191 4.334 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(Cl)n1)c1ccccc1OC(F)F ZINC000296391197 334233604 /nfs/dbraw/zinc/23/36/04/334233604.db2.gz UZOQUTYPTMASDM-MRVPVSSYSA-N 1 2 318.776 4.249 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)no1 ZINC000582150593 334276294 /nfs/dbraw/zinc/27/62/94/334276294.db2.gz HZHQEGITSBWCMV-SFHVURJKSA-N 1 2 302.393 4.043 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CC[C@@](F)(c3ccccc3)C2)no1 ZINC000582150593 334276295 /nfs/dbraw/zinc/27/62/95/334276295.db2.gz HZHQEGITSBWCMV-SFHVURJKSA-N 1 2 302.393 4.043 20 0 DIADLO CC[C@H]([NH2+]Cc1ccsc1Br)c1nccs1 ZINC000388752567 334265605 /nfs/dbraw/zinc/26/56/05/334265605.db2.gz PFGHHKZYGBUYJV-VIFPVBQESA-N 1 2 317.277 4.208 20 0 DIADLO CCC1CC[NH+](CC(=O)Nc2c(Cl)cccc2Cl)CC1 ZINC000048584377 334293644 /nfs/dbraw/zinc/29/36/44/334293644.db2.gz POJSXXIUORMLHR-UHFFFAOYSA-N 1 2 315.244 4.054 20 0 DIADLO Cc1cccc(CC(=O)Nc2ccc3[nH]c(C4CCC4)[nH+]c3c2)c1 ZINC000303110285 334300784 /nfs/dbraw/zinc/30/07/84/334300784.db2.gz FVLHEMYRTUIDEZ-UHFFFAOYSA-N 1 2 319.408 4.320 20 0 DIADLO CCCCc1ccc([C@@H]([NH2+]Cc2noc(CC)n2)C(C)C)cc1 ZINC000303467809 334321462 /nfs/dbraw/zinc/32/14/62/334321462.db2.gz MZELZGKFFQEOGR-IBGZPJMESA-N 1 2 315.461 4.462 20 0 DIADLO Cc1ccc(NC(=O)NCc2ccc3ccccc3c2)c(C)[nH+]1 ZINC000152277261 334334071 /nfs/dbraw/zinc/33/40/71/334334071.db2.gz DRCVFJZXLURTKL-UHFFFAOYSA-N 1 2 305.381 4.173 20 0 DIADLO Cc1ccc(NC(=O)NC2(c3cccc(Cl)c3)CC2)c(C)[nH+]1 ZINC000152279507 334334342 /nfs/dbraw/zinc/33/43/42/334334342.db2.gz NNAOPKAJDZKYNV-UHFFFAOYSA-N 1 2 315.804 4.163 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@@H](C)c1ccc(Oc2ccccc2)cc1 ZINC000101599298 334336522 /nfs/dbraw/zinc/33/65/22/334336522.db2.gz FMQNONVATBCBRK-AWEZNQCLSA-N 1 2 307.397 4.361 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)cc1C ZINC000534810790 334338115 /nfs/dbraw/zinc/33/81/15/334338115.db2.gz YTICUGBUFYVARZ-UHFFFAOYSA-N 1 2 319.408 4.320 20 0 DIADLO COCCCC[NH2+]c1ccc(Oc2ccccc2)cc1OC ZINC000534793944 334339195 /nfs/dbraw/zinc/33/91/95/334339195.db2.gz ZLKRBGNFDQMEAU-UHFFFAOYSA-N 1 2 301.386 4.326 20 0 DIADLO CC[C@@H](Cc1ccccc1)c1nc(Cc2ccc[nH+]c2C)no1 ZINC000563677917 334341199 /nfs/dbraw/zinc/34/11/99/334341199.db2.gz CWPQUTNHEMXEDG-INIZCTEOSA-N 1 2 307.397 4.100 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2)C[C@H](c2ccc(F)cc2)O1 ZINC000303927315 334347503 /nfs/dbraw/zinc/34/75/03/334347503.db2.gz PYXDCZDIWTUAJH-FZKQIMNGSA-N 1 2 319.807 4.441 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2)C[C@H](c2ccc(F)cc2)O1 ZINC000303927315 334347505 /nfs/dbraw/zinc/34/75/05/334347505.db2.gz PYXDCZDIWTUAJH-FZKQIMNGSA-N 1 2 319.807 4.441 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)NC(=O)Nc1cc(C)[nH+]cc1C ZINC000535060789 334361904 /nfs/dbraw/zinc/36/19/04/334361904.db2.gz NGYHSAGGFXOSHZ-CQSZACIVSA-N 1 2 323.396 4.058 20 0 DIADLO CCn1c(C[N@H+](Cc2cccs2)C2CC2)nc2ccccc21 ZINC000535069570 334363978 /nfs/dbraw/zinc/36/39/78/334363978.db2.gz KAPLHERRCBDPPW-UHFFFAOYSA-N 1 2 311.454 4.282 20 0 DIADLO CCn1c(C[N@@H+](Cc2cccs2)C2CC2)nc2ccccc21 ZINC000535069570 334363979 /nfs/dbraw/zinc/36/39/79/334363979.db2.gz KAPLHERRCBDPPW-UHFFFAOYSA-N 1 2 311.454 4.282 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)NC1CCCCC1 ZINC000112211267 334373914 /nfs/dbraw/zinc/37/39/14/334373914.db2.gz HQUVXUWVDWKUMV-UHFFFAOYSA-N 1 2 311.385 4.328 20 0 DIADLO Cc1ccccc1[C@H](C(C)C)[N@H+](C)Cc1noc(C(C)C)n1 ZINC000112357612 334384699 /nfs/dbraw/zinc/38/46/99/334384699.db2.gz NBAANRXFOPNKAK-KRWDZBQOSA-N 1 2 301.434 4.331 20 0 DIADLO Cc1ccccc1[C@H](C(C)C)[N@@H+](C)Cc1noc(C(C)C)n1 ZINC000112357612 334384700 /nfs/dbraw/zinc/38/47/00/334384700.db2.gz NBAANRXFOPNKAK-KRWDZBQOSA-N 1 2 301.434 4.331 20 0 DIADLO Cc1ccccc1[C@@H](C(C)C)[N@H+](C)Cc1noc(C(C)C)n1 ZINC000112357611 334384783 /nfs/dbraw/zinc/38/47/83/334384783.db2.gz NBAANRXFOPNKAK-QGZVFWFLSA-N 1 2 301.434 4.331 20 0 DIADLO Cc1ccccc1[C@@H](C(C)C)[N@@H+](C)Cc1noc(C(C)C)n1 ZINC000112357611 334384785 /nfs/dbraw/zinc/38/47/85/334384785.db2.gz NBAANRXFOPNKAK-QGZVFWFLSA-N 1 2 301.434 4.331 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+](Cc2ccccn2)C(C)C)o1 ZINC000535262339 334385038 /nfs/dbraw/zinc/38/50/38/334385038.db2.gz XSQRPUZEOFDBST-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+](Cc2ccccn2)C(C)C)o1 ZINC000535262339 334385039 /nfs/dbraw/zinc/38/50/39/334385039.db2.gz XSQRPUZEOFDBST-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO Cc1ccc(NC(=O)C[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c(C)c1 ZINC000340799675 334386434 /nfs/dbraw/zinc/38/64/34/334386434.db2.gz NOKJHEYQJJZJAB-QGZVFWFLSA-N 1 2 319.408 4.187 20 0 DIADLO CC[N@H+](Cc1nnc(C)n1C1CC1)Cc1ccc2ccccc2c1 ZINC000340941172 334395327 /nfs/dbraw/zinc/39/53/27/334395327.db2.gz PHDIWEKLFAEDFU-UHFFFAOYSA-N 1 2 320.440 4.097 20 0 DIADLO CC[N@@H+](Cc1nnc(C)n1C1CC1)Cc1ccc2ccccc2c1 ZINC000340941172 334395329 /nfs/dbraw/zinc/39/53/29/334395329.db2.gz PHDIWEKLFAEDFU-UHFFFAOYSA-N 1 2 320.440 4.097 20 0 DIADLO C[N@H+](Cc1ncc(Br)s1)[C@@H]1CCc2ccccc21 ZINC000340949402 334396040 /nfs/dbraw/zinc/39/60/40/334396040.db2.gz MZBCURIZSJRVLX-GFCCVEGCSA-N 1 2 323.259 4.025 20 0 DIADLO C[N@@H+](Cc1ncc(Br)s1)[C@@H]1CCc2ccccc21 ZINC000340949402 334396041 /nfs/dbraw/zinc/39/60/41/334396041.db2.gz MZBCURIZSJRVLX-GFCCVEGCSA-N 1 2 323.259 4.025 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(C(C)(C)C)cc2)o1 ZINC000341097753 334408756 /nfs/dbraw/zinc/40/87/56/334408756.db2.gz IFUUFAFNPXHIRK-CHWSQXEVSA-N 1 2 301.434 4.341 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(SC4CC4)cc3)ccc2[nH+]1 ZINC000341132879 334416912 /nfs/dbraw/zinc/41/69/12/334416912.db2.gz WAQYTHSLPYUXKP-UHFFFAOYSA-N 1 2 323.421 4.150 20 0 DIADLO COc1cc[nH+]cc1COc1cccc(-c2nc(C)cs2)c1 ZINC000341406518 334439829 /nfs/dbraw/zinc/43/98/29/334439829.db2.gz ZDUJWPMBLYUALY-UHFFFAOYSA-N 1 2 312.394 4.101 20 0 DIADLO CCn1nccc1CNc1[nH+]cccc1O[C@H](C)c1ccccc1 ZINC000341942521 334494724 /nfs/dbraw/zinc/49/47/24/334494724.db2.gz BQGBLKZRAPSBOF-OAHLLOKOSA-N 1 2 322.412 4.050 20 0 DIADLO Cc1nc(CSCCc2[nH+]c3ccccc3n2C)sc1C ZINC000341954536 334497318 /nfs/dbraw/zinc/49/73/18/334497318.db2.gz YBTOYKRFTGDWKJ-UHFFFAOYSA-N 1 2 317.483 4.123 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccccc2C(F)(F)F)o1 ZINC000341992745 334503925 /nfs/dbraw/zinc/50/39/25/334503925.db2.gz COXPOMBUFNDXQT-VHSXEESVSA-N 1 2 313.323 4.063 20 0 DIADLO FC(F)c1ccnc(C[NH2+]Cc2cccc(Cl)c2Cl)n1 ZINC000342248314 334520105 /nfs/dbraw/zinc/52/01/05/334520105.db2.gz NLEHOGBNILYLAB-UHFFFAOYSA-N 1 2 318.154 4.011 20 0 DIADLO C[C@H]([NH2+]Cc1ccsc1Cl)c1nccn1-c1ccccc1 ZINC000342326344 334532626 /nfs/dbraw/zinc/53/26/26/334532626.db2.gz YFRITOCVMIBYEI-LBPRGKRZSA-N 1 2 317.845 4.438 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2nc(C3CC3)cs2)c1C ZINC000342567875 334551169 /nfs/dbraw/zinc/55/11/69/334551169.db2.gz MSKITFWKKSOKLA-UHFFFAOYSA-N 1 2 320.483 4.474 20 0 DIADLO CCC(C)(C)CC[S@@](=O)Cc1[nH+]ccn1Cc1ccccc1 ZINC000342680262 334560192 /nfs/dbraw/zinc/56/01/92/334560192.db2.gz NWTRKJDYCYIRLG-JOCHJYFZSA-N 1 2 318.486 4.006 20 0 DIADLO COCC[C@@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1ccc(C)o1 ZINC000342928838 334589723 /nfs/dbraw/zinc/58/97/23/334589723.db2.gz DEDRUBPQJQAOIG-GFCCVEGCSA-N 1 2 314.307 4.192 20 0 DIADLO Fc1ccc2cc[nH+]c(NCc3ccc4c(n3)CCCC4)c2c1 ZINC000443959142 338464321 /nfs/dbraw/zinc/46/43/21/338464321.db2.gz HFAUWRAAZHILGX-UHFFFAOYSA-N 1 2 307.372 4.260 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cnc(C(F)(F)F)s1)c1nccs1 ZINC000443982835 338465328 /nfs/dbraw/zinc/46/53/28/338465328.db2.gz BQJATRBBCDSUCR-LLVKDONJSA-N 1 2 321.393 4.033 20 0 DIADLO Cc1ccc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)nc1 ZINC000444007998 338466830 /nfs/dbraw/zinc/46/68/30/338466830.db2.gz INVRVZPMNUEUDT-UHFFFAOYSA-N 1 2 318.424 4.202 20 0 DIADLO CS[C@H]1CC[C@H]1Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000425356768 334837590 /nfs/dbraw/zinc/83/75/90/334837590.db2.gz MMSPZKUBWVLVIR-WBVHZDCISA-N 1 2 313.470 4.192 20 0 DIADLO FC(F)CC1C[NH+](Cc2cc(Br)ccc2Cl)C1 ZINC000425367337 334859318 /nfs/dbraw/zinc/85/93/18/334859318.db2.gz SLKZQJPWVBSPKN-UHFFFAOYSA-N 1 2 324.596 4.190 20 0 DIADLO C[C@@H]1CN(c2cc[nH+]c3ccncc32)CC[C@H]1c1ccccc1 ZINC000444090953 338468206 /nfs/dbraw/zinc/46/82/06/338468206.db2.gz UAQGXSLMKSMQJF-NVXWUHKLSA-N 1 2 303.409 4.260 20 0 DIADLO c1ccc(SC[C@@H]2CCN(c3cc[nH+]c4ccncc43)C2)cc1 ZINC000444095176 338468332 /nfs/dbraw/zinc/46/83/32/338468332.db2.gz ZLVDBFYTVIARQV-OAHLLOKOSA-N 1 2 321.449 4.248 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2ccc(Cl)cc2F)C2CC2)s1 ZINC000189186527 334888309 /nfs/dbraw/zinc/88/83/09/334888309.db2.gz DBRQHCYJGLNXDD-CQSZACIVSA-N 1 2 310.825 4.485 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(C(F)F)n1)c1cc2cccc(F)c2o1 ZINC000353234706 334888739 /nfs/dbraw/zinc/88/87/39/334888739.db2.gz IRNKVHBGBSTYTG-VIFPVBQESA-N 1 2 309.291 4.014 20 0 DIADLO Cc1cc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)c(C)n1C(C)C ZINC000343274299 334899796 /nfs/dbraw/zinc/89/97/96/334899796.db2.gz GLNJKZXUCLAHJQ-UHFFFAOYSA-N 1 2 322.412 4.124 20 0 DIADLO Cc1ccccc1[C@@H]([NH2+]Cc1nc(C(F)F)no1)C(C)(C)C ZINC000425454361 334912018 /nfs/dbraw/zinc/91/20/18/334912018.db2.gz GQEPOEVDYCOEOC-CYBMUJFWSA-N 1 2 309.360 4.193 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1csc(C3CC3)n1)CCCO2 ZINC000343686619 335188248 /nfs/dbraw/zinc/18/82/48/335188248.db2.gz BWUBFAXVWWNSTK-HNNXBMFYSA-N 1 2 318.417 4.163 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+]Cc2nnc(CC)s2)cc1 ZINC000343748988 335190332 /nfs/dbraw/zinc/19/03/32/335190332.db2.gz IRRQAUGZFITIJP-LLVKDONJSA-N 1 2 307.488 4.063 20 0 DIADLO COc1cc[nH+]cc1CSc1ncc(-c2ccc(F)cc2)o1 ZINC000343848737 335196973 /nfs/dbraw/zinc/19/69/73/335196973.db2.gz YFQRHCCCRTXTMM-UHFFFAOYSA-N 1 2 316.357 4.177 20 0 DIADLO CCc1nc(C[N@H+](C)CCSc2ccc(F)cc2)cs1 ZINC000518831508 335205690 /nfs/dbraw/zinc/20/56/90/335205690.db2.gz KORYSZRWLKJOLR-UHFFFAOYSA-N 1 2 310.463 4.069 20 0 DIADLO CCc1nc(C[N@@H+](C)CCSc2ccc(F)cc2)cs1 ZINC000518831508 335205693 /nfs/dbraw/zinc/20/56/93/335205693.db2.gz KORYSZRWLKJOLR-UHFFFAOYSA-N 1 2 310.463 4.069 20 0 DIADLO COc1cccc2c(NCC3(c4ccccn4)CCC3)cc[nH+]c12 ZINC000343965337 335208490 /nfs/dbraw/zinc/20/84/90/335208490.db2.gz NISLWAUATHVOBM-UHFFFAOYSA-N 1 2 319.408 4.172 20 0 DIADLO Cn1cncc1C[NH+]1CCC(c2c(Cl)cccc2Cl)CC1 ZINC000344028053 335210461 /nfs/dbraw/zinc/21/04/61/335210461.db2.gz MAEBZTLMJWEZPI-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO Cn1c[nH+]cc1CN1CCC(c2c(Cl)cccc2Cl)CC1 ZINC000344028053 335210462 /nfs/dbraw/zinc/21/04/62/335210462.db2.gz MAEBZTLMJWEZPI-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2ccc(Oc3cccnc3)cc2)no1 ZINC000344089391 335217024 /nfs/dbraw/zinc/21/70/24/335217024.db2.gz IXIDTBFZKIZYDV-AWEZNQCLSA-N 1 2 309.369 4.021 20 0 DIADLO O=C(c1cccc(-n2cc[nH+]c2)c1)N(CC1CCCCC1)C1CC1 ZINC000344210482 335225447 /nfs/dbraw/zinc/22/54/47/335225447.db2.gz KXKXGCIALYCXMR-UHFFFAOYSA-N 1 2 323.440 4.057 20 0 DIADLO Cc1sc(C[NH2+]Cc2cc(F)c(F)cc2F)nc1C(C)C ZINC000344179042 335227726 /nfs/dbraw/zinc/22/77/26/335227726.db2.gz LGLKISBZRSHRQM-UHFFFAOYSA-N 1 2 314.376 4.282 20 0 DIADLO c1cc2c(o1)CCC[N@@H+](Cc1csc(Cc3ccccc3)n1)C2 ZINC000344239285 335231099 /nfs/dbraw/zinc/23/10/99/335231099.db2.gz QSCINIQQJBBPQA-UHFFFAOYSA-N 1 2 324.449 4.275 20 0 DIADLO c1cc2c(o1)CCC[N@H+](Cc1csc(Cc3ccccc3)n1)C2 ZINC000344239285 335231101 /nfs/dbraw/zinc/23/11/01/335231101.db2.gz QSCINIQQJBBPQA-UHFFFAOYSA-N 1 2 324.449 4.275 20 0 DIADLO CC(C)c1cnc(C[NH2+]Cc2cccc(OC(C)(C)C)n2)s1 ZINC000344319372 335240527 /nfs/dbraw/zinc/24/05/27/335240527.db2.gz BERUJPSSQMWKPS-UHFFFAOYSA-N 1 2 319.474 4.129 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3cc(C)n(C)c3C)cc2[nH+]1 ZINC000344445597 335249605 /nfs/dbraw/zinc/24/96/05/335249605.db2.gz JOSNHQRJVFJMLL-UHFFFAOYSA-N 1 2 324.428 4.113 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+]Cc2cc3cc(F)ccc3o2)o1 ZINC000344453022 335250066 /nfs/dbraw/zinc/25/00/66/335250066.db2.gz UWTJSPQDXMAUQS-MRXNPFEDSA-N 1 2 317.360 4.205 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc2cc[nH]c21)c1noc(-c2ccccc2)n1 ZINC000344637599 335261357 /nfs/dbraw/zinc/26/13/57/335261357.db2.gz HSLPDHMPUJFCHS-CYBMUJFWSA-N 1 2 318.380 4.069 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCS[C@H](C)[C@@H]3C)cs2)o1 ZINC000345111797 335299021 /nfs/dbraw/zinc/29/90/21/335299021.db2.gz OMYDWMGQFHACDD-NWDGAFQWSA-N 1 2 308.472 4.037 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCS[C@H](C)[C@@H]3C)cs2)o1 ZINC000345111797 335299023 /nfs/dbraw/zinc/29/90/23/335299023.db2.gz OMYDWMGQFHACDD-NWDGAFQWSA-N 1 2 308.472 4.037 20 0 DIADLO Cc1sccc1CC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000345528122 335331118 /nfs/dbraw/zinc/33/11/18/335331118.db2.gz VEXYTVITWRSQTJ-UHFFFAOYSA-N 1 2 324.405 4.425 20 0 DIADLO c1cc([C@H]2C[N@H+](C[C@@H]3CCC4(CCCCC4)O3)CCO2)cs1 ZINC000190982420 335376993 /nfs/dbraw/zinc/37/69/93/335376993.db2.gz HSKYVQLICORLCB-DLBZAZTESA-N 1 2 321.486 4.003 20 0 DIADLO c1cc([C@H]2C[N@@H+](C[C@@H]3CCC4(CCCCC4)O3)CCO2)cs1 ZINC000190982420 335376995 /nfs/dbraw/zinc/37/69/95/335376995.db2.gz HSKYVQLICORLCB-DLBZAZTESA-N 1 2 321.486 4.003 20 0 DIADLO CC(C)C[C@@H]1C[C@@H](Nc2[nH+]ccc3ccc(F)cc32)CCO1 ZINC000346229190 335386245 /nfs/dbraw/zinc/38/62/45/335386245.db2.gz LSTSEAXAYMTBCW-JKSUJKDBSA-N 1 2 302.393 4.380 20 0 DIADLO CCCCn1cc(C[NH2+][C@H](C)c2csc(C(C)C)n2)c(C)n1 ZINC000346521202 335418164 /nfs/dbraw/zinc/41/81/64/335418164.db2.gz IJIMLOZFTCXUIQ-CQSZACIVSA-N 1 2 320.506 4.422 20 0 DIADLO COc1cc[nH+]cc1NC(=O)c1sc2ccc(F)cc2c1C ZINC000346720310 335435115 /nfs/dbraw/zinc/43/51/15/335435115.db2.gz MEKMLEPRZBPGLF-UHFFFAOYSA-N 1 2 316.357 4.005 20 0 DIADLO Cc1c(COC(C)(C)C)cccc1N[C@@H](C)c1[nH+]ccn1C ZINC000346901668 335449602 /nfs/dbraw/zinc/44/96/02/335449602.db2.gz HYKSYBNHQDASIL-AWEZNQCLSA-N 1 2 301.434 4.217 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2cc(Cl)ccc2s1)c1ccccn1 ZINC000346976730 335460711 /nfs/dbraw/zinc/46/07/11/335460711.db2.gz HLUGDHZTGPUSEU-SNVBAGLBSA-N 1 2 303.818 4.196 20 0 DIADLO CCc1c(NCc2[nH+]ccn2C(C)C)cnn1C(CC)CC ZINC000347434753 335496391 /nfs/dbraw/zinc/49/63/91/335496391.db2.gz UMFCZYHMJGEVDI-UHFFFAOYSA-N 1 2 303.454 4.196 20 0 DIADLO Cc1ccc(F)c(CN(C)Cc2c[nH+]cn2Cc2ccccc2)c1 ZINC000444744475 338486558 /nfs/dbraw/zinc/48/65/58/338486558.db2.gz PPSKDRQEAGOWHC-UHFFFAOYSA-N 1 2 323.415 4.011 20 0 DIADLO FC(F)(C[NH2+][C@H]1CCCNc2ccccc21)c1ccccc1 ZINC000348444483 335591301 /nfs/dbraw/zinc/59/13/01/335591301.db2.gz ZDOLUVUYEWLEDT-KRWDZBQOSA-N 1 2 302.368 4.315 20 0 DIADLO c1cn(Cc2ccc(N[C@@H]3CC[C@H](c4ccccc4)C3)nc2)c[nH+]1 ZINC000348836424 335611994 /nfs/dbraw/zinc/61/19/94/335611994.db2.gz WDJNEHMJTWTURN-RBUKOAKNSA-N 1 2 318.424 4.075 20 0 DIADLO CCSc1cccc(C[NH2+]Cc2nnc(C(C)C)s2)c1 ZINC000349570161 335681802 /nfs/dbraw/zinc/68/18/02/335681802.db2.gz RTGLLKDFCNSTLI-UHFFFAOYSA-N 1 2 307.488 4.063 20 0 DIADLO Clc1cnc(C[NH2+]Cc2ccc(-c3cccnc3)cc2)s1 ZINC000349675663 335691236 /nfs/dbraw/zinc/69/12/36/335691236.db2.gz YTWPMSYJEPDWEH-UHFFFAOYSA-N 1 2 315.829 4.148 20 0 DIADLO Cc1cc(NC(=O)C2CCC(c3ccccc3)CC2)c(C)c[nH+]1 ZINC000535748774 335754172 /nfs/dbraw/zinc/75/41/72/335754172.db2.gz ZEGOULVSTJIVPO-UHFFFAOYSA-N 1 2 308.425 4.033 20 0 DIADLO CCc1cc(OCc2cccc(NC(C)=O)c2)c2ccccc2[nH+]1 ZINC000536131941 335822167 /nfs/dbraw/zinc/82/21/67/335822167.db2.gz WEWSZZSDQDDCPA-UHFFFAOYSA-N 1 2 320.392 4.335 20 0 DIADLO CCc1cc(OCc2nc(C(C)(C)C)no2)c2ccccc2[nH+]1 ZINC000536138446 335822200 /nfs/dbraw/zinc/82/22/00/335822200.db2.gz UPGZGDHZDAVTDL-UHFFFAOYSA-N 1 2 311.385 4.057 20 0 DIADLO Cc1ccc(C(=O)Nc2ccccc2)cc1Oc1cc[nH+]cc1 ZINC000114995366 335834448 /nfs/dbraw/zinc/83/44/48/335834448.db2.gz ZAXUTTUXWGMEOD-UHFFFAOYSA-N 1 2 304.349 4.435 20 0 DIADLO CCCc1ccc([C@@H]([NH2+]Cc2noc(C3CC3)n2)C(C)C)cc1 ZINC000097078880 335839503 /nfs/dbraw/zinc/83/95/03/335839503.db2.gz RGZBDMYZSKZDLR-SFHVURJKSA-N 1 2 313.445 4.386 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2noc(C(C)C)n2)C(C)C)cc1 ZINC000097078868 335839564 /nfs/dbraw/zinc/83/95/64/335839564.db2.gz ITQFIODVTOYJRA-QGZVFWFLSA-N 1 2 301.434 4.242 20 0 DIADLO Cc1cscc1-c1noc(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC000445628749 338503318 /nfs/dbraw/zinc/50/33/18/338503318.db2.gz MWZBATWLXHQVST-UHFFFAOYSA-N 1 2 322.393 4.018 20 0 DIADLO CCc1cc(C[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)on1 ZINC000532231949 335922219 /nfs/dbraw/zinc/92/22/19/335922219.db2.gz BMMXMAHOBOWRQP-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO CC[C@]1(C)C[C@H]1c1nc(Cn2c3ccccc3[nH+]c2C(C)C)no1 ZINC000445663104 338505063 /nfs/dbraw/zinc/50/50/63/338505063.db2.gz WNVOPPSSUZEWRM-ORAYPTAESA-N 1 2 324.428 4.495 20 0 DIADLO Cc1cc(N2CCCC3(CCCC3)C2)nc(-c2ccncc2)[nH+]1 ZINC000445667772 338505106 /nfs/dbraw/zinc/50/51/06/338505106.db2.gz SSXQJSFGCDCQAV-UHFFFAOYSA-N 1 2 308.429 4.008 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCc1c(Cl)cccc1Cl ZINC000520270132 335952436 /nfs/dbraw/zinc/95/24/36/335952436.db2.gz SDFHNHCRZSNGTB-UHFFFAOYSA-N 1 2 324.211 4.327 20 0 DIADLO Cc1ccc(Cc2noc(-c3coc(C4CCCCC4)n3)n2)c[nH+]1 ZINC000520654339 336002172 /nfs/dbraw/zinc/00/21/72/336002172.db2.gz JIUOKBMRBNQXII-UHFFFAOYSA-N 1 2 324.384 4.067 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[N@@H+]3CCCc4occc4C3)o2)cc1 ZINC000329613695 336010179 /nfs/dbraw/zinc/01/01/79/336010179.db2.gz CUDSEWQBODVQRH-AWEZNQCLSA-N 1 2 323.396 4.147 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[N@H+]3CCCc4occc4C3)o2)cc1 ZINC000329613695 336010180 /nfs/dbraw/zinc/01/01/80/336010180.db2.gz CUDSEWQBODVQRH-AWEZNQCLSA-N 1 2 323.396 4.147 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2cc(C)ccc2[nH]1)c1ccc(F)cc1F ZINC000351390046 336031752 /nfs/dbraw/zinc/03/17/52/336031752.db2.gz UTXPPKKMDPSVPK-HNNXBMFYSA-N 1 2 315.367 4.390 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2ccc(C)cc2[nH]1)c1ccc(F)cc1F ZINC000351390046 336031753 /nfs/dbraw/zinc/03/17/53/336031753.db2.gz UTXPPKKMDPSVPK-HNNXBMFYSA-N 1 2 315.367 4.390 20 0 DIADLO Cc1nc([C@H](C)[N@H+]2Cc3ccccc3[C@@H](c3ccccc3)C2)no1 ZINC000351390090 336031817 /nfs/dbraw/zinc/03/18/17/336031817.db2.gz VLDVEIYEIJIBDV-IFXJQAMLSA-N 1 2 319.408 4.087 20 0 DIADLO Cc1nc([C@H](C)[N@@H+]2Cc3ccccc3[C@@H](c3ccccc3)C2)no1 ZINC000351390090 336031819 /nfs/dbraw/zinc/03/18/19/336031819.db2.gz VLDVEIYEIJIBDV-IFXJQAMLSA-N 1 2 319.408 4.087 20 0 DIADLO O=C(CCc1ccco1)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000351614439 336050609 /nfs/dbraw/zinc/05/06/09/336050609.db2.gz GCQYXBOGOQQQRK-UHFFFAOYSA-N 1 2 308.337 4.038 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)c1ccc(F)cc1 ZINC000351632658 336053298 /nfs/dbraw/zinc/05/32/98/336053298.db2.gz UZKZAVGBNGDWDI-UHFFFAOYSA-N 1 2 308.312 4.265 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)c1ccccc1F ZINC000351629697 336053335 /nfs/dbraw/zinc/05/33/35/336053335.db2.gz OEQQELJFTJSSMT-UHFFFAOYSA-N 1 2 308.312 4.265 20 0 DIADLO Cc1nccc(C[N@@H+]2CCc3cc(Cl)c(Cl)cc3[C@H]2C)n1 ZINC000351776092 336068561 /nfs/dbraw/zinc/06/85/61/336068561.db2.gz YDGIHWDITBXBAI-SNVBAGLBSA-N 1 2 322.239 4.211 20 0 DIADLO Cc1nccc(C[N@H+]2CCc3cc(Cl)c(Cl)cc3[C@H]2C)n1 ZINC000351776092 336068562 /nfs/dbraw/zinc/06/85/62/336068562.db2.gz YDGIHWDITBXBAI-SNVBAGLBSA-N 1 2 322.239 4.211 20 0 DIADLO CC(C)c1cc(N2CCCC[C@@H]2c2cc[nH]n2)nc(C(C)C)[nH+]1 ZINC000329764980 336079192 /nfs/dbraw/zinc/07/91/92/336079192.db2.gz WLGPJUJGKPESFX-MRXNPFEDSA-N 1 2 313.449 4.178 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2nc(C3CC3)no2)c2ccccc2)cc1 ZINC000029455067 336110227 /nfs/dbraw/zinc/11/02/27/336110227.db2.gz LBJSCWZVIGCGRX-LJQANCHMSA-N 1 2 319.408 4.135 20 0 DIADLO CC[C@H]1CCCN1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000351895416 336111902 /nfs/dbraw/zinc/11/19/02/336111902.db2.gz ZUYDMRJXHAIZCK-HNNXBMFYSA-N 1 2 311.385 4.280 20 0 DIADLO Cc1cc(C)c(C(=O)Nc2ccc(Oc3cc[nH+]cc3)c(C)c2)[nH]1 ZINC000192592507 336172340 /nfs/dbraw/zinc/17/23/40/336172340.db2.gz PLEOLBLYFGUBNV-UHFFFAOYSA-N 1 2 321.380 4.380 20 0 DIADLO Cc1nc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)cs1 ZINC000351921119 336178458 /nfs/dbraw/zinc/17/84/58/336178458.db2.gz LANIYHPIRVQZPG-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO Cc1nc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)cs1 ZINC000351921119 336178460 /nfs/dbraw/zinc/17/84/60/336178460.db2.gz LANIYHPIRVQZPG-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO Cc1[nH]c2ccc(CNC(=O)Nc3c(C)cc[nH+]c3C)cc2c1C ZINC000351936719 336181405 /nfs/dbraw/zinc/18/14/05/336181405.db2.gz NKQKTLOVUNKXPT-UHFFFAOYSA-N 1 2 322.412 4.118 20 0 DIADLO Oc1ccc2c(c1)C[N@@H+](Cc1nc(-c3ccccc3)cs1)CC2 ZINC000351959565 336183008 /nfs/dbraw/zinc/18/30/08/336183008.db2.gz PQWXABMOMINDSE-UHFFFAOYSA-N 1 2 322.433 4.074 20 0 DIADLO Oc1ccc2c(c1)C[N@H+](Cc1nc(-c3ccccc3)cs1)CC2 ZINC000351959565 336183010 /nfs/dbraw/zinc/18/30/10/336183010.db2.gz PQWXABMOMINDSE-UHFFFAOYSA-N 1 2 322.433 4.074 20 0 DIADLO Oc1ccc2c(c1)C[N@@H+](Cc1cnc(C3CCCC3)s1)CC2 ZINC000351959809 336183333 /nfs/dbraw/zinc/18/33/33/336183333.db2.gz QONCXSZXUANFLF-UHFFFAOYSA-N 1 2 314.454 4.065 20 0 DIADLO Oc1ccc2c(c1)C[N@H+](Cc1cnc(C3CCCC3)s1)CC2 ZINC000351959809 336183334 /nfs/dbraw/zinc/18/33/34/336183334.db2.gz QONCXSZXUANFLF-UHFFFAOYSA-N 1 2 314.454 4.065 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)Nc1cccc(COC(C)C)c1 ZINC000351942318 336184238 /nfs/dbraw/zinc/18/42/38/336184238.db2.gz FBEAFFWEBVPCQQ-UHFFFAOYSA-N 1 2 313.401 4.267 20 0 DIADLO Cc1csc(C[N@@H+](C)Cc2cc(Cl)cc(Cl)c2)n1 ZINC000351972261 336184837 /nfs/dbraw/zinc/18/48/37/336184837.db2.gz LBXSRESYWFDOEW-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1csc(C[N@H+](C)Cc2cc(Cl)cc(Cl)c2)n1 ZINC000351972261 336184838 /nfs/dbraw/zinc/18/48/38/336184838.db2.gz LBXSRESYWFDOEW-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Oc1cc(F)cc(C[N@H+](Cc2ccco2)Cc2cccs2)c1 ZINC000351994341 336186750 /nfs/dbraw/zinc/18/67/50/336186750.db2.gz FVMBDBPWZLPQAS-UHFFFAOYSA-N 1 2 317.385 4.388 20 0 DIADLO Oc1cc(F)cc(C[N@@H+](Cc2ccco2)Cc2cccs2)c1 ZINC000351994341 336186752 /nfs/dbraw/zinc/18/67/52/336186752.db2.gz FVMBDBPWZLPQAS-UHFFFAOYSA-N 1 2 317.385 4.388 20 0 DIADLO Clc1cnc(C[N@@H+]2CCCCC[C@H]2c2ccncc2)s1 ZINC000351996620 336187067 /nfs/dbraw/zinc/18/70/67/336187067.db2.gz PYBYFFJNBSYURV-ZDUSSCGKSA-N 1 2 307.850 4.309 20 0 DIADLO Clc1cnc(C[N@H+]2CCCCC[C@H]2c2ccncc2)s1 ZINC000351996620 336187069 /nfs/dbraw/zinc/18/70/69/336187069.db2.gz PYBYFFJNBSYURV-ZDUSSCGKSA-N 1 2 307.850 4.309 20 0 DIADLO Cc1nc([C@H](C)[NH+]2CCC([C@@H](F)c3ccccc3F)CC2)no1 ZINC000352093968 336194537 /nfs/dbraw/zinc/19/45/37/336194537.db2.gz VUWDEEINEJGSEX-MEDUHNTESA-N 1 2 321.371 4.001 20 0 DIADLO Cc1nc([C@@H](C)[NH+]2CCC([C@@H](F)c3ccccc3F)CC2)no1 ZINC000352093966 336194613 /nfs/dbraw/zinc/19/46/13/336194613.db2.gz VUWDEEINEJGSEX-BDJLRTHQSA-N 1 2 321.371 4.001 20 0 DIADLO CC1(C)CC[C@@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000352130442 336195906 /nfs/dbraw/zinc/19/59/06/336195906.db2.gz GWTLWPBEQBOTHB-OAHLLOKOSA-N 1 2 310.397 4.182 20 0 DIADLO Cc1noc(C)c1NC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000352195519 336200785 /nfs/dbraw/zinc/20/07/85/336200785.db2.gz RHWGBEIXUBKSOZ-UHFFFAOYSA-N 1 2 324.340 4.123 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+]3C[C@H](C)O[C@H](C)[C@@H]3C)n2)cc1 ZINC000352413888 336217013 /nfs/dbraw/zinc/21/70/13/336217013.db2.gz RERRPNQHJCCCSA-SOUVJXGZSA-N 1 2 316.470 4.116 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+]3C[C@H](C)O[C@H](C)[C@@H]3C)n2)cc1 ZINC000352413888 336217014 /nfs/dbraw/zinc/21/70/14/336217014.db2.gz RERRPNQHJCCCSA-SOUVJXGZSA-N 1 2 316.470 4.116 20 0 DIADLO Cc1ncc(C[NH2+]C2(c3c(Cl)cccc3Cl)CCC2)cn1 ZINC000352421628 336217736 /nfs/dbraw/zinc/21/77/36/336217736.db2.gz MSDOXHDVYBRIIQ-UHFFFAOYSA-N 1 2 322.239 4.261 20 0 DIADLO COC[C@H](C)CNc1ccc(-c2cn3cccc(C)c3[nH+]2)cc1 ZINC000526123352 336219008 /nfs/dbraw/zinc/21/90/08/336219008.db2.gz PBIHROCULXFYRI-CQSZACIVSA-N 1 2 309.413 4.004 20 0 DIADLO Fc1cc(Cl)ccc1C[N@@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000352447958 336219514 /nfs/dbraw/zinc/21/95/14/336219514.db2.gz PLAAIQNYBVDDOL-CVEARBPZSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cc(Cl)ccc1C[N@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000352447958 336219515 /nfs/dbraw/zinc/21/95/15/336219515.db2.gz PLAAIQNYBVDDOL-CVEARBPZSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2nccs2)CC2CC2)c(Cl)c1 ZINC000352543727 336223519 /nfs/dbraw/zinc/22/35/19/336223519.db2.gz IXPNDWIJMIZHCT-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO Fc1ccc(C[N@H+](Cc2nccs2)CC2CC2)c(Cl)c1 ZINC000352543727 336223520 /nfs/dbraw/zinc/22/35/20/336223520.db2.gz IXPNDWIJMIZHCT-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO CCc1[nH+]c(C)ccc1OCc1sc(C)nc1C(F)(F)F ZINC000352563262 336224747 /nfs/dbraw/zinc/22/47/47/336224747.db2.gz SBIQKYVXPCXGSN-UHFFFAOYSA-N 1 2 316.348 4.315 20 0 DIADLO Fc1ccc(NCc2[nH+]ccn2CC(F)(F)F)cc1C1CC1 ZINC000352613572 336227163 /nfs/dbraw/zinc/22/71/63/336227163.db2.gz WUYLSQOLHZQUKB-UHFFFAOYSA-N 1 2 313.298 4.074 20 0 DIADLO Cc1nn(-c2ccc(Cl)cc2)cc1C[N@H+](C)Cc1ccoc1 ZINC000352654015 336228935 /nfs/dbraw/zinc/22/89/35/336228935.db2.gz GHCKQPKXMZTJJP-UHFFFAOYSA-N 1 2 315.804 4.059 20 0 DIADLO Cc1nn(-c2ccc(Cl)cc2)cc1C[N@@H+](C)Cc1ccoc1 ZINC000352654015 336228936 /nfs/dbraw/zinc/22/89/36/336228936.db2.gz GHCKQPKXMZTJJP-UHFFFAOYSA-N 1 2 315.804 4.059 20 0 DIADLO CC[C@@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccc(F)cn1 ZINC000352781530 336236156 /nfs/dbraw/zinc/23/61/56/336236156.db2.gz CISCXMLFGOIBLG-CYBMUJFWSA-N 1 2 317.389 4.178 20 0 DIADLO CC1CCC(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000352809398 336244115 /nfs/dbraw/zinc/24/41/15/336244115.db2.gz HQHWKJDYMMITTP-UHFFFAOYSA-N 1 2 310.397 4.182 20 0 DIADLO CCc1cnc(C[NH2+][C@H](c2ccccc2)c2cccc(F)c2)o1 ZINC000532369327 336244612 /nfs/dbraw/zinc/24/46/12/336244612.db2.gz VRLNZTCPHBEXBP-LJQANCHMSA-N 1 2 310.372 4.255 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cc4sccc4s3)cc2[nH+]1 ZINC000532440211 336247322 /nfs/dbraw/zinc/24/73/22/336247322.db2.gz PGAGQWCPJRLGLZ-UHFFFAOYSA-N 1 2 313.407 4.400 20 0 DIADLO Cc1[nH]c2cc(NC(=O)c3cc4sccc4s3)ccc2[nH+]1 ZINC000532440211 336247323 /nfs/dbraw/zinc/24/73/23/336247323.db2.gz PGAGQWCPJRLGLZ-UHFFFAOYSA-N 1 2 313.407 4.400 20 0 DIADLO Cc1cc(C)cc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)c1 ZINC000532452345 336250126 /nfs/dbraw/zinc/25/01/26/336250126.db2.gz MJPYPGBQGGWTNG-YLJYHZDGSA-N 1 2 319.452 4.477 20 0 DIADLO CC(C)c1ccc([C@H](C)[NH2+]Cc2n[nH]cc2Br)cc1 ZINC000532502706 336252403 /nfs/dbraw/zinc/25/24/03/336252403.db2.gz BZKKZMVRZLCYNF-NSHDSACASA-N 1 2 322.250 4.146 20 0 DIADLO c1ccc2c(c1)SCC[C@@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000192751523 336260523 /nfs/dbraw/zinc/26/05/23/336260523.db2.gz DOIULOHQQACKTP-INIZCTEOSA-N 1 2 311.454 4.331 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc(F)c(F)c1 ZINC000192751544 336260656 /nfs/dbraw/zinc/26/06/56/336260656.db2.gz AAHSFRMQDYWALE-LBPRGKRZSA-N 1 2 303.356 4.133 20 0 DIADLO Brc1ccsc1C[N@@H+]1CCc2sccc2C1 ZINC000043503193 336263546 /nfs/dbraw/zinc/26/35/46/336263546.db2.gz UGEDBXXWGVIHFH-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO Brc1ccsc1C[N@H+]1CCc2sccc2C1 ZINC000043503193 336263547 /nfs/dbraw/zinc/26/35/47/336263547.db2.gz UGEDBXXWGVIHFH-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO C[N@H+](Cc1sccc1Br)Cc1cccc(F)c1 ZINC000043501882 336263573 /nfs/dbraw/zinc/26/35/73/336263573.db2.gz UWZYQYWJPIHMFC-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[N@@H+](Cc1sccc1Br)Cc1cccc(F)c1 ZINC000043501882 336263574 /nfs/dbraw/zinc/26/35/74/336263574.db2.gz UWZYQYWJPIHMFC-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO CCc1cnc(C[NH+]2CCC(=Cc3cccc(F)c3)CC2)o1 ZINC000532748395 336269509 /nfs/dbraw/zinc/26/95/09/336269509.db2.gz JSMUWIASPRMUSY-UHFFFAOYSA-N 1 2 300.377 4.056 20 0 DIADLO CCc1noc([C@H](C)[NH+]2CCC(=Cc3cccc(F)c3)CC2)n1 ZINC000532748379 336269565 /nfs/dbraw/zinc/26/95/65/336269565.db2.gz GCIOJABXTHHQCQ-ZDUSSCGKSA-N 1 2 315.392 4.012 20 0 DIADLO Fc1ccccc1[C@H](F)C1CC[NH+](Cc2cscn2)CC1 ZINC000367136879 336269808 /nfs/dbraw/zinc/26/98/08/336269808.db2.gz CUROVKQFRHKMCR-MRXNPFEDSA-N 1 2 308.397 4.205 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2cc(O)cc(C(F)(F)F)c2)n1 ZINC000352837818 336273190 /nfs/dbraw/zinc/27/31/90/336273190.db2.gz CAVQJEUNBJGRCW-VIFPVBQESA-N 1 2 316.348 4.027 20 0 DIADLO Cc1noc(-c2ccc(C)c(NCCCc3ccc(C)[nH+]c3)c2)n1 ZINC000526972921 336276951 /nfs/dbraw/zinc/27/69/51/336276951.db2.gz ZLBABYXIPVOXFN-UHFFFAOYSA-N 1 2 322.412 4.102 20 0 DIADLO Fc1ccc(Br)cc1C[N@H+](CC1(F)CC1)C1CC1 ZINC000526970053 336277291 /nfs/dbraw/zinc/27/72/91/336277291.db2.gz MTWRKYWOBQJCLX-UHFFFAOYSA-N 1 2 316.189 4.055 20 0 DIADLO Fc1ccc(Br)cc1C[N@@H+](CC1(F)CC1)C1CC1 ZINC000526970053 336277292 /nfs/dbraw/zinc/27/72/92/336277292.db2.gz MTWRKYWOBQJCLX-UHFFFAOYSA-N 1 2 316.189 4.055 20 0 DIADLO CC(C)c1nc2n(n1)CCC[C@@H]2[NH2+][C@H](C)c1cc2ccccc2o1 ZINC000168037430 336285808 /nfs/dbraw/zinc/28/58/08/336285808.db2.gz OBSSVFVEXKTAJB-HIFRSBDPSA-N 1 2 324.428 4.333 20 0 DIADLO CCOc1ccc(CNc2ccc3ccccc3[nH+]2)cc1OC ZINC000301066902 336288183 /nfs/dbraw/zinc/28/81/83/336288183.db2.gz DYLYLOUQYREEDI-UHFFFAOYSA-N 1 2 308.381 4.254 20 0 DIADLO Cc1cc(N[C@@H]2CCc3cc(F)ccc32)nc(-c2cccnc2)[nH+]1 ZINC000301084115 336289182 /nfs/dbraw/zinc/28/91/82/336289182.db2.gz JCJPAQQTFXMJOH-QGZVFWFLSA-N 1 2 320.371 4.086 20 0 DIADLO c1ccc2[nH+]c(NCc3ccc(OCC4CC4)nc3)ccc2c1 ZINC000301108014 336290331 /nfs/dbraw/zinc/29/03/31/336290331.db2.gz IZEDTRKTCOFVKD-UHFFFAOYSA-N 1 2 305.381 4.031 20 0 DIADLO Cc1cc(Nc2cccc(NC(=O)C3CC3)c2)nc(C(C)C)[nH+]1 ZINC000301116784 336290857 /nfs/dbraw/zinc/29/08/57/336290857.db2.gz YIQCTYKAPPESKU-UHFFFAOYSA-N 1 2 310.401 4.001 20 0 DIADLO CCN(CC)c1ccc(CNc2ccc3ccccc3n2)c[nH+]1 ZINC000301121238 336290927 /nfs/dbraw/zinc/29/09/27/336290927.db2.gz XCPCHBOKXNROBD-UHFFFAOYSA-N 1 2 306.413 4.088 20 0 DIADLO CCc1cc(N[C@H](C)Cc2cccs2)nc(-c2ccncc2)[nH+]1 ZINC000301190035 336294168 /nfs/dbraw/zinc/29/41/68/336294168.db2.gz YEVIRJKQIVSKJA-CYBMUJFWSA-N 1 2 324.453 4.206 20 0 DIADLO Cc1cc([C@@H](C)Nc2cc(N3CCC[C@@H](C)C3)nc[nH+]2)c(C)o1 ZINC000301265567 336297554 /nfs/dbraw/zinc/29/75/54/336297554.db2.gz UBIHPYXJXDEZHI-TZMCWYRMSA-N 1 2 314.433 4.096 20 0 DIADLO Cc1cc([C@@H](C)Nc2cc(N3CCC[C@@H](C)C3)[nH+]cn2)c(C)o1 ZINC000301265567 336297555 /nfs/dbraw/zinc/29/75/55/336297555.db2.gz UBIHPYXJXDEZHI-TZMCWYRMSA-N 1 2 314.433 4.096 20 0 DIADLO Cc1cc(NC[C@@H]2C[C@H]2c2ccccc2)nc(-c2cccnc2)[nH+]1 ZINC000301293214 336299195 /nfs/dbraw/zinc/29/91/95/336299195.db2.gz XKVFEPUJFCUPTB-ROUUACIJSA-N 1 2 316.408 4.063 20 0 DIADLO CCc1cc(N2CCC[C@@H]2c2nc3ccccc3s2)nc(C)[nH+]1 ZINC000301339912 336301471 /nfs/dbraw/zinc/30/14/71/336301471.db2.gz HYQPIPKRPBJYDG-OAHLLOKOSA-N 1 2 324.453 4.299 20 0 DIADLO Fc1cccc(Cl)c1[C@@H]1C[C@@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000301380746 336303674 /nfs/dbraw/zinc/30/36/74/336303674.db2.gz YGHYDPHPLRTWRP-MFKMUULPSA-N 1 2 303.768 4.115 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc(-n3cccn3)cc2)nc(C(C)C)[nH+]1 ZINC000301455416 336307815 /nfs/dbraw/zinc/30/78/15/336307815.db2.gz RUSHJKPUTUVWQC-HNNXBMFYSA-N 1 2 321.428 4.267 20 0 DIADLO C[C@@H]1CN(c2cc(C(F)(F)F)cc[nH+]2)C[C@H](c2ccccc2)O1 ZINC000301456078 336307923 /nfs/dbraw/zinc/30/79/23/336307923.db2.gz WOCITLHCQPBJJK-IUODEOHRSA-N 1 2 322.330 4.067 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NC[C@@H]2CCOc3ccccc32)c1 ZINC000301495439 336310389 /nfs/dbraw/zinc/31/03/89/336310389.db2.gz BMHPFJFBNCPQFM-NSHDSACASA-N 1 2 308.303 4.079 20 0 DIADLO Cc1cc([C@H](C)Nc2cc(N3CCCCC3)nc[nH+]2)c(C)s1 ZINC000301504976 336311053 /nfs/dbraw/zinc/31/10/53/336311053.db2.gz GLWOSASFCVBKDJ-ZDUSSCGKSA-N 1 2 316.474 4.318 20 0 DIADLO Cc1cc([C@H](C)Nc2cc(N3CCCCC3)[nH+]cn2)c(C)s1 ZINC000301504976 336311054 /nfs/dbraw/zinc/31/10/54/336311054.db2.gz GLWOSASFCVBKDJ-ZDUSSCGKSA-N 1 2 316.474 4.318 20 0 DIADLO CCS[C@H]1CCCCN(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000301509419 336311319 /nfs/dbraw/zinc/31/13/19/336311319.db2.gz KCFAASXHUFXRQJ-LBPRGKRZSA-N 1 2 304.381 4.212 20 0 DIADLO CCc1nc(CCNc2cc(C(F)(F)F)cc[nH+]2)sc1C ZINC000301525745 336312482 /nfs/dbraw/zinc/31/24/82/336312482.db2.gz PQJQRLKXPAKYPU-UHFFFAOYSA-N 1 2 315.364 4.082 20 0 DIADLO CC(C)[C@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1nc2ccccc2[nH]1 ZINC000301564141 336315258 /nfs/dbraw/zinc/31/52/58/336315258.db2.gz YUBHXGKBJDKGAX-INIZCTEOSA-N 1 2 323.444 4.460 20 0 DIADLO Cc1cc(N2CCC[C@H]2c2cccc(N(C)C)c2)nc(C(C)C)[nH+]1 ZINC000301567946 336315585 /nfs/dbraw/zinc/31/55/85/336315585.db2.gz WXBTVOXDUXGEDN-SFHVURJKSA-N 1 2 324.472 4.316 20 0 DIADLO Clc1cc(Cl)c2c(c1)CCN(c1cc[nH+]c(C3CC3)n1)C2 ZINC000301586538 336316633 /nfs/dbraw/zinc/31/66/33/336316633.db2.gz VWMYPIAKSMEIMG-UHFFFAOYSA-N 1 2 320.223 4.224 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NCCCOC2CCCCC2)c1 ZINC000301590256 336316901 /nfs/dbraw/zinc/31/69/01/336316901.db2.gz QJPCHEKEKUNIEX-UHFFFAOYSA-N 1 2 302.340 4.252 20 0 DIADLO Cc1cc(N[C@H](C)C(=O)Nc2ccccc2)c2cccc(F)c2[nH+]1 ZINC000301654333 336321104 /nfs/dbraw/zinc/32/11/04/336321104.db2.gz HIJVNUMRLKOHFV-CYBMUJFWSA-N 1 2 323.371 4.121 20 0 DIADLO Cc1cc(NC[C@@](C)(O)c2ccccc2)c2cccc(F)c2[nH+]1 ZINC000301666708 336322019 /nfs/dbraw/zinc/32/20/19/336322019.db2.gz LWILQJVBMXDFNQ-LJQANCHMSA-N 1 2 310.372 4.002 20 0 DIADLO Cc1cc(NC[C@](C)(O)c2ccccc2)c2cccc(F)c2[nH+]1 ZINC000301666706 336322081 /nfs/dbraw/zinc/32/20/81/336322081.db2.gz LWILQJVBMXDFNQ-IBGZPJMESA-N 1 2 310.372 4.002 20 0 DIADLO Cc1nc2c(s1)[C@@H](N(C)c1cc(C)[nH+]c(C(C)C)n1)CCC2 ZINC000301681339 336323157 /nfs/dbraw/zinc/32/31/57/336323157.db2.gz VFUIMLSWZSOQLX-AWEZNQCLSA-N 1 2 316.474 4.187 20 0 DIADLO CCCO[C@H]1CCCN(c2cc(C)[nH+]c3c(F)cccc23)CC1 ZINC000301684378 336323218 /nfs/dbraw/zinc/32/32/18/336323218.db2.gz TULZMMHMEXQLFA-HNNXBMFYSA-N 1 2 316.420 4.468 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N(C)Cc1nc2ccccc2n1C ZINC000301713025 336325065 /nfs/dbraw/zinc/32/50/65/336325065.db2.gz IQOZXEQZMNBADV-UHFFFAOYSA-N 1 2 316.408 4.066 20 0 DIADLO CCc1cc(CNc2cc(C(C)(C)C)[nH+]c(C(C)(C)C)n2)on1 ZINC000301749010 336327564 /nfs/dbraw/zinc/32/75/64/336327564.db2.gz HQLDDTOENSTSAJ-UHFFFAOYSA-N 1 2 316.449 4.234 20 0 DIADLO C[C@H](C[C@H](O)c1ccccc1)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000301753516 336327727 /nfs/dbraw/zinc/32/77/27/336327727.db2.gz WCJGAVQCVCQQGT-RISCZKNCSA-N 1 2 310.319 4.025 20 0 DIADLO C[C@@H](Nc1cc(C(F)(F)F)cc[nH+]1)[C@H]1COc2ccccc21 ZINC000301825813 336332636 /nfs/dbraw/zinc/33/26/36/336332636.db2.gz IVYYLYGILOLLBK-ZWNOBZJWSA-N 1 2 308.303 4.077 20 0 DIADLO c1ccc2[nH+]c(NCc3ccnc(OC4CCC4)c3)ccc2c1 ZINC000301840909 336333488 /nfs/dbraw/zinc/33/34/88/336333488.db2.gz BCFXSLBIEJVEBR-UHFFFAOYSA-N 1 2 305.381 4.173 20 0 DIADLO CC(C)[C@H](Nc1[nH+]cnc2c1cnn2C(C)(C)C)c1ccccc1 ZINC000301844793 336333769 /nfs/dbraw/zinc/33/37/69/336333769.db2.gz SONCBHQTTVYYAH-INIZCTEOSA-N 1 2 323.444 4.391 20 0 DIADLO Cc1ccc([C@@H](C)Nc2[nH+]cnc3c2cnn3C(C)(C)C)cc1 ZINC000301851914 336334119 /nfs/dbraw/zinc/33/41/19/336334119.db2.gz ARGFRWWFYJCCLE-CYBMUJFWSA-N 1 2 309.417 4.063 20 0 DIADLO Cc1cc(C)c(CNc2[nH+]cnc3c2cnn3C(C)(C)C)c(C)c1 ZINC000301872492 336335346 /nfs/dbraw/zinc/33/53/46/336335346.db2.gz HQQFEGIHWCMJKJ-UHFFFAOYSA-N 1 2 323.444 4.119 20 0 DIADLO CC(C)c1cc(N[C@@H]2CCC[C@@H]3OCC[C@H]32)nc(C(C)C)[nH+]1 ZINC000301875924 336335659 /nfs/dbraw/zinc/33/56/59/336335659.db2.gz RWMQJRWWECCXGT-LZWOXQAQSA-N 1 2 303.450 4.093 20 0 DIADLO CC(C)c1cc(N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)nc(C(C)C)[nH+]1 ZINC000301875378 336335714 /nfs/dbraw/zinc/33/57/14/336335714.db2.gz RQOPFXAIXBHOMP-XKQJLSEDSA-N 1 2 315.461 4.093 20 0 DIADLO Cc1cc(N[C@@H](C)C[C@@H](O)c2ccco2)c2cccc(F)c2[nH+]1 ZINC000301892281 336336592 /nfs/dbraw/zinc/33/65/92/336336592.db2.gz MGTDVFGFLQSTQH-BLLLJJGKSA-N 1 2 314.360 4.199 20 0 DIADLO Cc1c2cc(F)ccc2oc1CNc1nc(N)c2ccccc2[nH+]1 ZINC000301900048 336337088 /nfs/dbraw/zinc/33/70/88/336337088.db2.gz YSOUQJVOJPTJBR-UHFFFAOYSA-N 1 2 322.343 4.018 20 0 DIADLO c1ccc([C@H]2CCc3nc(CNc4cccc[nH+]4)sc3C2)cc1 ZINC000301940312 336339053 /nfs/dbraw/zinc/33/90/53/336339053.db2.gz VWMHETBSJODPBO-HNNXBMFYSA-N 1 2 321.449 4.423 20 0 DIADLO Cc1cccn2cc(CNc3ncc(-c4ccccc4)s3)[nH+]c12 ZINC000301991389 336341841 /nfs/dbraw/zinc/34/18/41/336341841.db2.gz NISOCEHVOGKUSG-UHFFFAOYSA-N 1 2 320.421 4.378 20 0 DIADLO CCC(CC)[C@H]1C[C@@H](Nc2cc(C(F)(F)F)cc[nH+]2)CCO1 ZINC000302081868 336347740 /nfs/dbraw/zinc/34/77/40/336347740.db2.gz YDCWSDMNGNODFR-UONOGXRCSA-N 1 2 316.367 4.496 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)N(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000302112718 336349090 /nfs/dbraw/zinc/34/90/90/336349090.db2.gz BCSGHEOZZAAAII-FZMZJTMJSA-N 1 2 307.319 4.083 20 0 DIADLO COc1ccc2[nH+]c(NC[C@H](C)c3nc(C)cs3)ccc2c1 ZINC000302125147 336349627 /nfs/dbraw/zinc/34/96/27/336349627.db2.gz HZWGSYGGVUQRIV-NSHDSACASA-N 1 2 313.426 4.224 20 0 DIADLO CC(C)c1cc(N(C)C[C@@H](C)c2nccs2)nc(C(C)C)[nH+]1 ZINC000302197041 336353419 /nfs/dbraw/zinc/35/34/19/336353419.db2.gz XUHANJRQCKGVOL-CYBMUJFWSA-N 1 2 318.490 4.420 20 0 DIADLO COc1cccc2c(NC[C@@H](OC)c3ccccc3)cc[nH+]c12 ZINC000302439467 336358793 /nfs/dbraw/zinc/35/87/93/336358793.db2.gz MWCRNZSIQWVLOV-GOSISDBHSA-N 1 2 308.381 4.043 20 0 DIADLO CCOCc1ccccc1CNc1cc[nH+]c2c(OC)cccc12 ZINC000302462710 336359245 /nfs/dbraw/zinc/35/92/45/336359245.db2.gz RYLZZTHUAVJQGS-UHFFFAOYSA-N 1 2 322.408 4.392 20 0 DIADLO CC(C)c1cc(N2CCC([C@H]3CCCO3)CC2)nc(C(C)C)[nH+]1 ZINC000302556971 336361513 /nfs/dbraw/zinc/36/15/13/336361513.db2.gz LTZQXEFCCDKZKV-QGZVFWFLSA-N 1 2 317.477 4.119 20 0 DIADLO CC(C)c1nc(N[C@H](C)C2CCOCC2)cc(C(C)(C)C)[nH+]1 ZINC000302891250 336373489 /nfs/dbraw/zinc/37/34/89/336373489.db2.gz NUOIYUTUFZAKBO-CYBMUJFWSA-N 1 2 305.466 4.125 20 0 DIADLO CSc1cccc(F)c1C[NH2+]Cc1ncc(C(C)C)s1 ZINC000352902509 336375540 /nfs/dbraw/zinc/37/55/40/336375540.db2.gz NJSUARZTSKFUNL-UHFFFAOYSA-N 1 2 310.463 4.417 20 0 DIADLO Fc1ccc(OC2CC[NH+](Cc3c(F)cccc3F)CC2)cc1 ZINC000352949615 336378901 /nfs/dbraw/zinc/37/89/01/336378901.db2.gz XRQKRLZYKOFMFW-UHFFFAOYSA-N 1 2 321.342 4.147 20 0 DIADLO CCCc1nc(C[N@@H+]2CCC[C@H]2c2ccccc2OC)cs1 ZINC000303222042 336383233 /nfs/dbraw/zinc/38/32/33/336383233.db2.gz VBMNOMJDTAMXDS-INIZCTEOSA-N 1 2 316.470 4.441 20 0 DIADLO CCCc1nc(C[N@H+]2CCC[C@H]2c2ccccc2OC)cs1 ZINC000303222042 336383234 /nfs/dbraw/zinc/38/32/34/336383234.db2.gz VBMNOMJDTAMXDS-INIZCTEOSA-N 1 2 316.470 4.441 20 0 DIADLO Brc1cscc1C[N@@H+]1CCCc2occc2C1 ZINC000563915070 336383373 /nfs/dbraw/zinc/38/33/73/336383373.db2.gz LUSLVYYKMLCGPO-UHFFFAOYSA-N 1 2 312.232 4.052 20 0 DIADLO Brc1cscc1C[N@H+]1CCCc2occc2C1 ZINC000563915070 336383374 /nfs/dbraw/zinc/38/33/74/336383374.db2.gz LUSLVYYKMLCGPO-UHFFFAOYSA-N 1 2 312.232 4.052 20 0 DIADLO CN(CC[N@H+](C)Cc1csc(C(C)(C)C)n1)c1ccccc1 ZINC000303283214 336383702 /nfs/dbraw/zinc/38/37/02/336383702.db2.gz KQJNSSNGOHZIMV-UHFFFAOYSA-N 1 2 317.502 4.009 20 0 DIADLO CN(CC[N@@H+](C)Cc1csc(C(C)(C)C)n1)c1ccccc1 ZINC000303283214 336383703 /nfs/dbraw/zinc/38/37/03/336383703.db2.gz KQJNSSNGOHZIMV-UHFFFAOYSA-N 1 2 317.502 4.009 20 0 DIADLO Cn1ccnc1[C@@H]([NH2+]Cc1ccc(Oc2ccccc2)o1)C1CC1 ZINC000353036229 336385724 /nfs/dbraw/zinc/38/57/24/336385724.db2.gz QTNUTRGEKROKKD-SFHVURJKSA-N 1 2 323.396 4.046 20 0 DIADLO CCCC1CCC(NC(=O)N2CCCC[C@@H]2c2[nH]cc[nH+]2)CC1 ZINC000106543780 336390101 /nfs/dbraw/zinc/39/01/01/336390101.db2.gz PANKBKSXCJZBGC-UYSNPLJNSA-N 1 2 318.465 4.005 20 0 DIADLO c1[nH]c2ccccc2c1C1CCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000110126044 336395931 /nfs/dbraw/zinc/39/59/31/336395931.db2.gz WKNBKCQGKOYORT-UHFFFAOYSA-N 1 2 318.424 4.219 20 0 DIADLO Cc1ccc(NCc2ccccc2OCC(F)(F)F)c(C)[nH+]1 ZINC000353198353 336406120 /nfs/dbraw/zinc/40/61/20/336406120.db2.gz ZKLFYXJNSJQDLH-UHFFFAOYSA-N 1 2 310.319 4.252 20 0 DIADLO CSc1ccc(C)c(NC(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC000353355919 336413274 /nfs/dbraw/zinc/41/32/74/336413274.db2.gz SYHBETHBZIQNLZ-UHFFFAOYSA-N 1 2 312.398 4.009 20 0 DIADLO CC[C@@H](NC(=O)c1ccc2[nH+]c(C)n(C)c2c1)c1ccc(C)cc1 ZINC000353514303 336421902 /nfs/dbraw/zinc/42/19/02/336421902.db2.gz JSORKHZLNGXNSJ-QGZVFWFLSA-N 1 2 321.424 4.071 20 0 DIADLO FC1(F)CCC12C[NH+](Cc1ccc(Sc3ccccn3)o1)C2 ZINC000353557104 336424832 /nfs/dbraw/zinc/42/48/32/336424832.db2.gz TVMCLWNYDXPLGC-UHFFFAOYSA-N 1 2 322.380 4.057 20 0 DIADLO CCOCc1nc([C@H](C)[NH2+][C@@H](CC)c2ccc(Cl)cc2)no1 ZINC000353608207 336428486 /nfs/dbraw/zinc/42/84/86/336428486.db2.gz HWBJIJYSXWUOEX-FZMZJTMJSA-N 1 2 323.824 4.061 20 0 DIADLO Cc1[nH+]c2ccc(C(=O)N(C)[C@H](C)c3ccc(C)cc3)cc2n1C ZINC000354318623 336466644 /nfs/dbraw/zinc/46/66/44/336466644.db2.gz MJVQPCVIIKMQCY-CQSZACIVSA-N 1 2 321.424 4.023 20 0 DIADLO C[C@@H](C[C@@H]1CCCO1)Nc1[nH+]cccc1OCc1ccccc1 ZINC000354578738 336475635 /nfs/dbraw/zinc/47/56/35/336475635.db2.gz QQWIJVVAZKAKLV-RDJZCZTQSA-N 1 2 312.413 4.030 20 0 DIADLO C[C@H](C[C@H]1CCCO1)Nc1[nH+]cccc1OCc1ccccc1 ZINC000354578737 336475663 /nfs/dbraw/zinc/47/56/63/336475663.db2.gz QQWIJVVAZKAKLV-NVXWUHKLSA-N 1 2 312.413 4.030 20 0 DIADLO C[C@@H](Nc1[nH+]ccc2ccc(F)cc21)[C@H]1COc2ccccc21 ZINC000354883152 336486351 /nfs/dbraw/zinc/48/63/51/336486351.db2.gz JCDICBOXODZDSF-SJKOYZFVSA-N 1 2 308.356 4.351 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NCc2cnc(C)nc2)c1 ZINC000355410485 336507830 /nfs/dbraw/zinc/50/78/30/336507830.db2.gz TVARSFKRGKATBR-UHFFFAOYSA-N 1 2 321.428 4.061 20 0 DIADLO Cc1cscc1-c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000356000659 336531590 /nfs/dbraw/zinc/53/15/90/336531590.db2.gz BWQIZLHGJSJTIC-UHFFFAOYSA-N 1 2 322.393 4.018 20 0 DIADLO Cc1ccc2oc(-c3nc(Cc4ccc(C)[nH+]c4)no3)cc2c1 ZINC000356123805 336536854 /nfs/dbraw/zinc/53/68/54/336536854.db2.gz ITKFPBXZVKAQBF-UHFFFAOYSA-N 1 2 305.337 4.085 20 0 DIADLO CCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ncc(C)o2)cc1OC ZINC000356265966 336543360 /nfs/dbraw/zinc/54/33/60/336543360.db2.gz BLDZDQUXQPOVEQ-ZIAGYGMSSA-N 1 2 318.417 4.192 20 0 DIADLO Cc1ccoc1C[NH2+]Cc1nc(-c2ccccc2F)cs1 ZINC000356419116 336549068 /nfs/dbraw/zinc/54/90/68/336549068.db2.gz HCTLZUVQGNEDEP-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO C[C@@H](C1CCC1)N(C)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000356603409 336556061 /nfs/dbraw/zinc/55/60/61/336556061.db2.gz VABBTHMJLSYPEY-AWEZNQCLSA-N 1 2 310.397 4.135 20 0 DIADLO CC1(C)CC[C@@H](c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)C1 ZINC000356642540 336556959 /nfs/dbraw/zinc/55/69/59/336556959.db2.gz KCGWRLGYLZVHOX-CQSZACIVSA-N 1 2 308.385 4.216 20 0 DIADLO COc1cccc(C[NH2+][C@H](c2ccccc2)c2ccccn2)c1F ZINC000367243782 336559857 /nfs/dbraw/zinc/55/98/57/336559857.db2.gz MLTXXCNSLCCPOT-HXUWFJFHSA-N 1 2 322.383 4.109 20 0 DIADLO COCc1cc(N2CCCC3(CCC3)C2)c2cc(F)ccc2[nH+]1 ZINC000357687048 336594561 /nfs/dbraw/zinc/59/45/61/336594561.db2.gz RMVCLZJILQXMMX-UHFFFAOYSA-N 1 2 314.404 4.291 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2nc3c(s2)CCCC3)cs1 ZINC000357800454 336599377 /nfs/dbraw/zinc/59/93/77/336599377.db2.gz WIDKXKICDPRCLQ-UWVGGRQHSA-N 1 2 307.488 4.199 20 0 DIADLO C[C@@H]1CCCCCN1C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000357804491 336599633 /nfs/dbraw/zinc/59/96/33/336599633.db2.gz JNIWBJRFCONPNX-OAHLLOKOSA-N 1 2 310.397 4.279 20 0 DIADLO Cc1cccc2[nH+]c(CN[C@@H](c3ccccc3)C(F)(F)F)cn21 ZINC000357933476 336603754 /nfs/dbraw/zinc/60/37/54/336603754.db2.gz IUBTYLAPSSITOK-INIZCTEOSA-N 1 2 319.330 4.036 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C(C)(C)C)s1)c1ccccc1OC ZINC000358292557 336622033 /nfs/dbraw/zinc/62/20/33/336622033.db2.gz WCWZKLGKCSSUPA-ZDUSSCGKSA-N 1 2 319.474 4.085 20 0 DIADLO CS[C@@H](C)CCC(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000358432773 336629744 /nfs/dbraw/zinc/62/97/44/336629744.db2.gz YPVLENZXFDSINV-ZDUSSCGKSA-N 1 2 316.426 4.344 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2cccs2)n1)c1cncc(F)c1 ZINC000358996532 336652061 /nfs/dbraw/zinc/65/20/61/336652061.db2.gz UAXWJQNABLRZFF-JTQLQIEISA-N 1 2 319.430 4.257 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(CC)no2)cc1 ZINC000114751792 336671243 /nfs/dbraw/zinc/67/12/43/336671243.db2.gz FFHKGVHMILTNNA-VXGBXAGGSA-N 1 2 305.447 4.156 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)[C@@H]1CCC(F)(F)C1 ZINC000359517229 336675700 /nfs/dbraw/zinc/67/57/00/336675700.db2.gz NVWQLQJNRGRELA-GFCCVEGCSA-N 1 2 318.323 4.248 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nccn1C)c1ccc(F)cc1)c1ccsc1 ZINC000359725039 336685286 /nfs/dbraw/zinc/68/52/86/336685286.db2.gz YLWJJOVFOSJZEO-MLGOLLRUSA-N 1 2 315.417 4.061 20 0 DIADLO COC(=O)c1ccccc1-c1ccc(CNc2ccc(C)[nH+]c2)o1 ZINC000360894142 336726214 /nfs/dbraw/zinc/72/62/14/336726214.db2.gz MLAKOIRAOLLXOC-UHFFFAOYSA-N 1 2 322.364 4.049 20 0 DIADLO CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1nnc(-c2ccccc2)o1 ZINC000361118257 336739488 /nfs/dbraw/zinc/73/94/88/336739488.db2.gz APFFGFSTZOJAGW-KGLIPLIRSA-N 1 2 322.412 4.106 20 0 DIADLO CC[C@@H]([NH2+]Cc1cn2ccc(C)cc2n1)c1cc(F)ccc1F ZINC000361139554 336740621 /nfs/dbraw/zinc/74/06/21/336740621.db2.gz HCXNEVSBLPTFOK-QGZVFWFLSA-N 1 2 315.367 4.162 20 0 DIADLO CCC1(C(=O)Nc2ccc(-c3cn4c([nH+]3)CCCC4)cc2)CC1 ZINC000362919675 336814754 /nfs/dbraw/zinc/81/47/54/336814754.db2.gz XNEMJANPJFAKIK-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO O=C(C/C=C\c1cccc(F)c1)Nc1ccccc1-n1cc[nH+]c1 ZINC000362962864 336816359 /nfs/dbraw/zinc/81/63/59/336816359.db2.gz GPZJFCOXRWMNDN-XQRVVYSFSA-N 1 2 321.355 4.053 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2nccn2-c2ccccc2)n1 ZINC000367855492 336831084 /nfs/dbraw/zinc/83/10/84/336831084.db2.gz HVZGBSOHTZUUOP-UONOGXRCSA-N 1 2 312.442 4.049 20 0 DIADLO Clc1cc([NH2+][C@H]2CCC23CCOCC3)ccc1N1CCCC1 ZINC000368524977 336846743 /nfs/dbraw/zinc/84/67/43/336846743.db2.gz CKZSBMXVXQWKGW-KRWDZBQOSA-N 1 2 320.864 4.311 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2cc(O)cc(F)c2)c2ccccn2)cc1 ZINC000369545090 336866730 /nfs/dbraw/zinc/86/67/30/336866730.db2.gz CQFHSCJIZZNILR-FQEVSTJZSA-N 1 2 322.383 4.114 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H]2CC23CCCCC3)[nH+]1 ZINC000370270756 336881355 /nfs/dbraw/zinc/88/13/55/336881355.db2.gz MILFMQPCJMUUHT-OAHLLOKOSA-N 1 2 309.413 4.294 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@H]2c2ccccc2Cl)cc[nH+]1 ZINC000119263161 336883751 /nfs/dbraw/zinc/88/37/51/336883751.db2.gz ZLUAFGGVDWGHNV-INIZCTEOSA-N 1 2 315.804 4.412 20 0 DIADLO Cc1cc(NC(=O)N(Cc2ccc(Cl)cc2)C2CC2)cc[nH+]1 ZINC000119275430 336883938 /nfs/dbraw/zinc/88/39/38/336883938.db2.gz ONXDGOFYIIAXKL-UHFFFAOYSA-N 1 2 315.804 4.240 20 0 DIADLO c1c(-c2cccc(NC[C@H]3CCSC3)c2)[nH+]c2n1CCCC2 ZINC000370520196 336886617 /nfs/dbraw/zinc/88/66/17/336886617.db2.gz UXNSHYYHKSPNRQ-CQSZACIVSA-N 1 2 313.470 4.051 20 0 DIADLO Cc1cc([C@H]2CCCN2c2cc(C)[nH+]c3c(F)cccc23)no1 ZINC000370652749 336889714 /nfs/dbraw/zinc/88/97/14/336889714.db2.gz IKQOMLFBMUVVMY-MRXNPFEDSA-N 1 2 311.360 4.320 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cccc3cc[nH]c32)[nH+]1 ZINC000371247067 336898467 /nfs/dbraw/zinc/89/84/67/336898467.db2.gz JUWGRMFOJXDBJA-UHFFFAOYSA-N 1 2 316.364 4.119 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N(Cc1ccco1)Cc1ccccc1 ZINC000120304856 336908250 /nfs/dbraw/zinc/90/82/50/336908250.db2.gz JABQWFFWKITSPK-UHFFFAOYSA-N 1 2 321.380 4.217 20 0 DIADLO Fc1ccc(CNc2cccc(-c3cn4c([nH+]3)CCCC4)c2)cn1 ZINC000372300590 336927309 /nfs/dbraw/zinc/92/73/09/336927309.db2.gz JALYJPZYPOKYGA-UHFFFAOYSA-N 1 2 322.387 4.033 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3cc(C(C)C)on3)c2)[nH+]c1C ZINC000372333769 336928202 /nfs/dbraw/zinc/92/82/02/336928202.db2.gz PKBLHDYWWGQZNL-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO C[C@H](c1ccccc1Cl)N(C)Cc1cn2c([nH+]1)CCCC2 ZINC000372995198 336944576 /nfs/dbraw/zinc/94/45/76/336944576.db2.gz APGIGGLWURHYIX-CYBMUJFWSA-N 1 2 303.837 4.066 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]Cc2ccc(C)cc2Cl)cs1 ZINC000582364616 336945687 /nfs/dbraw/zinc/94/56/87/336945687.db2.gz MQQBEUJGYGKNTM-LLVKDONJSA-N 1 2 310.850 4.102 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000373063178 336946917 /nfs/dbraw/zinc/94/69/17/336946917.db2.gz KHTNPESGROYAEG-VQIMIIECSA-N 1 2 319.493 4.123 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCSc1nccn1C ZINC000582393843 336955582 /nfs/dbraw/zinc/95/55/82/336955582.db2.gz WEUXFHQOQHWRLD-UHFFFAOYSA-N 1 2 314.458 4.041 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1ccccc1Cl ZINC000373620199 336966736 /nfs/dbraw/zinc/96/67/36/336966736.db2.gz XXQGENDBIDFOQA-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1ccc(Cl)s1 ZINC000373660330 336968035 /nfs/dbraw/zinc/96/80/35/336968035.db2.gz NYTKURQTICHLOK-UHFFFAOYSA-N 1 2 317.801 4.352 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)CCC1CCCCC1 ZINC000373734811 336970377 /nfs/dbraw/zinc/97/03/77/336970377.db2.gz DTHKOIIEZOFIGC-KRWDZBQOSA-N 1 2 317.477 4.317 20 0 DIADLO Cc1cc(N2CCC(c3cccc4ccccc43)CC2)nc[nH+]1 ZINC000582426732 336973608 /nfs/dbraw/zinc/97/36/08/336973608.db2.gz BZDFBIRCFKWZQU-UHFFFAOYSA-N 1 2 303.409 4.322 20 0 DIADLO Cc1ccc(C2CCN(c3cccc(C(F)(F)F)n3)CC2)c[nH+]1 ZINC000374677226 336994764 /nfs/dbraw/zinc/99/47/64/336994764.db2.gz JEDXXQXQZJZEDL-UHFFFAOYSA-N 1 2 321.346 4.188 20 0 DIADLO Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]Cc1cscn1 ZINC000122154010 336996190 /nfs/dbraw/zinc/99/61/90/336996190.db2.gz BGYXGQRQJUVVBL-AWEZNQCLSA-N 1 2 308.834 4.108 20 0 DIADLO COc1cc[nH+]cc1CSCCOc1ccc(Cl)cc1 ZINC000582442854 337000486 /nfs/dbraw/zinc/00/04/86/337000486.db2.gz OVULDKNYKUURRQ-UHFFFAOYSA-N 1 2 309.818 4.056 20 0 DIADLO Fc1cc(Cl)cc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c1 ZINC000485689833 337000510 /nfs/dbraw/zinc/00/05/10/337000510.db2.gz AAVYSYFLYYMJOJ-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1cc(Cl)cc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)c1 ZINC000485689833 337000511 /nfs/dbraw/zinc/00/05/11/337000511.db2.gz AAVYSYFLYYMJOJ-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Cc1cc(NC(=O)c2cccc(-c3ccccn3)c2C)cc[nH+]1 ZINC000122451663 337008710 /nfs/dbraw/zinc/00/87/10/337008710.db2.gz MEJNEFLBCRMOBX-UHFFFAOYSA-N 1 2 303.365 4.013 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nccn2C(F)F)cc1C ZINC000122511456 337012275 /nfs/dbraw/zinc/01/22/75/337012275.db2.gz OLCSNQQUBBVEOO-OAHLLOKOSA-N 1 2 305.372 4.232 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2nccn2C(F)F)cc1C ZINC000122511456 337012276 /nfs/dbraw/zinc/01/22/76/337012276.db2.gz OLCSNQQUBBVEOO-OAHLLOKOSA-N 1 2 305.372 4.232 20 0 DIADLO CCC[C@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc(F)cc1F ZINC000375812077 337020183 /nfs/dbraw/zinc/02/01/83/337020183.db2.gz XMMLGSFHSLEAHG-JKSUJKDBSA-N 1 2 305.372 4.196 20 0 DIADLO Cc1ccc(-c2nc(CN3CCC[C@H]3c3[nH]cc[nH+]3)cs2)cc1 ZINC000376493653 337034926 /nfs/dbraw/zinc/03/49/26/337034926.db2.gz AWYNPKPTCYXEGG-INIZCTEOSA-N 1 2 324.453 4.179 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1cncc(F)c1 ZINC000123283773 337041955 /nfs/dbraw/zinc/04/19/55/337041955.db2.gz KEGHRQYLGRJIGH-MLGOLLRUSA-N 1 2 313.401 4.117 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)CCc1cccc(C(F)(F)F)c1 ZINC000425595708 337044807 /nfs/dbraw/zinc/04/48/07/337044807.db2.gz IZAUEVLFLFGQBA-UHFFFAOYSA-N 1 2 322.330 4.289 20 0 DIADLO c1coc([C@H]([NH2+]Cc2ccc(-c3cc[nH]n3)o2)c2ccccc2)c1 ZINC000377105428 337046890 /nfs/dbraw/zinc/04/68/90/337046890.db2.gz VLBHBJCZHVNVII-LJQANCHMSA-N 1 2 319.364 4.142 20 0 DIADLO O=C([C@@H]1CCC[C@@H]2CCCC[C@H]12)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000377155235 337047695 /nfs/dbraw/zinc/04/76/95/337047695.db2.gz PZHKQJZUYORHDC-NXOAAHMSSA-N 1 2 315.461 4.070 20 0 DIADLO O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]12)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000377155236 337047703 /nfs/dbraw/zinc/04/77/03/337047703.db2.gz PZHKQJZUYORHDC-YLFCFFPRSA-N 1 2 315.461 4.070 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000378073715 337065907 /nfs/dbraw/zinc/06/59/07/337065907.db2.gz HRYSEFUKEDOGBZ-MRXNPFEDSA-N 1 2 317.477 4.112 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000378073715 337065908 /nfs/dbraw/zinc/06/59/08/337065908.db2.gz HRYSEFUKEDOGBZ-MRXNPFEDSA-N 1 2 317.477 4.112 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2c1ccc(Cl)c2Cl)c1ccccn1 ZINC000378145481 337067219 /nfs/dbraw/zinc/06/72/19/337067219.db2.gz BLJAIZNRSKZPRX-NOZJJQNGSA-N 1 2 309.196 4.173 20 0 DIADLO O=C(C[C@@H]1CCC[N@H+]1Cc1ccc(Cl)cn1)c1cccs1 ZINC000378480365 337073900 /nfs/dbraw/zinc/07/39/00/337073900.db2.gz ATVZWJNNAKFLTP-AWEZNQCLSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)cn1)c1cccs1 ZINC000378480365 337073901 /nfs/dbraw/zinc/07/39/01/337073901.db2.gz ATVZWJNNAKFLTP-AWEZNQCLSA-N 1 2 320.845 4.034 20 0 DIADLO Cc1cccc(-c2nnc([C@H](C)[NH2+][C@H](C)c3cccc(O)c3)o2)c1 ZINC000378486839 337073985 /nfs/dbraw/zinc/07/39/85/337073985.db2.gz DYKMYRRYEXIZTN-KGLIPLIRSA-N 1 2 323.396 4.162 20 0 DIADLO Cc1cccc(-c2nnc([C@@H](C)[NH2+][C@@H](C)c3cccc(O)c3)o2)c1 ZINC000378486840 337074080 /nfs/dbraw/zinc/07/40/80/337074080.db2.gz DYKMYRRYEXIZTN-UONOGXRCSA-N 1 2 323.396 4.162 20 0 DIADLO Cc1cccc(-c2nnc([C@H](C)[NH2+][C@@H](C)c3cccc(O)c3)o2)c1 ZINC000378486838 337074100 /nfs/dbraw/zinc/07/41/00/337074100.db2.gz DYKMYRRYEXIZTN-KBPBESRZSA-N 1 2 323.396 4.162 20 0 DIADLO CCC1(C(=O)Nc2nc(C[NH+]3CCCCC3)cs2)CCCC1 ZINC000193894683 337079804 /nfs/dbraw/zinc/07/98/04/337079804.db2.gz WFMILXPTXNDNSB-UHFFFAOYSA-N 1 2 321.490 4.038 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H]3CCCc4cn[nH]c43)cs2)cc1 ZINC000360037401 337084183 /nfs/dbraw/zinc/08/41/83/337084183.db2.gz CRIMVVSFWMSNBL-MRXNPFEDSA-N 1 2 324.453 4.009 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H]3CCCc4c[nH]nc43)cs2)cc1 ZINC000360037401 337084184 /nfs/dbraw/zinc/08/41/84/337084184.db2.gz CRIMVVSFWMSNBL-MRXNPFEDSA-N 1 2 324.453 4.009 20 0 DIADLO Fc1ccc(F)c2c1OCC[C@H]2Nc1ccc2ccccc2[nH+]1 ZINC000461985681 337086524 /nfs/dbraw/zinc/08/65/24/337086524.db2.gz QLBMCRORWYNTQT-OAHLLOKOSA-N 1 2 312.319 4.449 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc(C(F)F)c1 ZINC000171482910 337087442 /nfs/dbraw/zinc/08/74/42/337087442.db2.gz ZXUQDRJYACJEJY-UHFFFAOYSA-N 1 2 313.307 4.267 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1cccc(C(F)F)c1 ZINC000171543130 337088037 /nfs/dbraw/zinc/08/80/37/337088037.db2.gz PZHMQDZZKPECJZ-UHFFFAOYSA-N 1 2 313.307 4.062 20 0 DIADLO Cc1cc[nH+]cc1CCCNc1ccccc1OCC(F)F ZINC000582573088 337107706 /nfs/dbraw/zinc/10/77/06/337107706.db2.gz FMLURKOBWLTXIN-UHFFFAOYSA-N 1 2 306.356 4.079 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc(CC2CCCCC2)no1)c1ccccc1 ZINC000582691194 337123131 /nfs/dbraw/zinc/12/31/31/337123131.db2.gz REQNNXJLLDNTKB-GOSISDBHSA-N 1 2 313.445 4.234 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc(CC2CCCCC2)no1)c1ccccc1 ZINC000582691194 337123132 /nfs/dbraw/zinc/12/31/32/337123132.db2.gz REQNNXJLLDNTKB-GOSISDBHSA-N 1 2 313.445 4.234 20 0 DIADLO Cc1ccc(-n2cc[nH+]c2)c(-c2nc(-c3cccc(F)c3)no2)c1 ZINC000582690575 337123202 /nfs/dbraw/zinc/12/32/02/337123202.db2.gz LLGQGPPUIUIPLM-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Cc1ccc(C(=O)N2CCC[C@@H](C)[C@@H]2C)cc1Oc1cc[nH+]cc1 ZINC000172650199 337129283 /nfs/dbraw/zinc/12/92/83/337129283.db2.gz IJZHIULGSZETOK-ZBFHGGJFSA-N 1 2 324.424 4.443 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccc(OC(C)C)cc1Cl ZINC000425596705 337130316 /nfs/dbraw/zinc/13/03/16/337130316.db2.gz OOHHYPUTLYTKIP-UHFFFAOYSA-N 1 2 318.804 4.391 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1 ZINC000425596760 337133709 /nfs/dbraw/zinc/13/37/09/337133709.db2.gz PBTOCTBYCKFGLD-CQSZACIVSA-N 1 2 324.424 4.279 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)cs1 ZINC000175139758 337144655 /nfs/dbraw/zinc/14/46/55/337144655.db2.gz FHDSRVWECKDTBH-MRXNPFEDSA-N 1 2 303.475 4.332 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCCC[C@@H]2c2cccn2C)cs1 ZINC000175139758 337144656 /nfs/dbraw/zinc/14/46/56/337144656.db2.gz FHDSRVWECKDTBH-MRXNPFEDSA-N 1 2 303.475 4.332 20 0 DIADLO Clc1ncc(C[NH2+][C@H](c2nccs2)c2ccccc2)s1 ZINC000175417215 337145963 /nfs/dbraw/zinc/14/59/63/337145963.db2.gz LITUEPCHXLYDHL-LBPRGKRZSA-N 1 2 321.858 4.132 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cc(C)nc3ccccc23)s1 ZINC000175510070 337147802 /nfs/dbraw/zinc/14/78/02/337147802.db2.gz PGCJTZBIKUMNGP-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cc(C)nc3ccccc23)s1 ZINC000175510070 337147803 /nfs/dbraw/zinc/14/78/03/337147803.db2.gz PGCJTZBIKUMNGP-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2ccccc2C(F)(F)F)s1 ZINC000175530417 337147897 /nfs/dbraw/zinc/14/78/97/337147897.db2.gz KMBVZFLVICXUNU-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2ccccc2C(F)(F)F)s1 ZINC000175530417 337147898 /nfs/dbraw/zinc/14/78/98/337147898.db2.gz KMBVZFLVICXUNU-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO C[C@@H]1CC(CC[S@@](=O)Cc2cn3ccccc3[nH+]2)C[C@@H](C)C1 ZINC000176987101 337153999 /nfs/dbraw/zinc/15/39/99/337153999.db2.gz NKKIEWNQFSIPQC-AYSMAOOMSA-N 1 2 318.486 4.045 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1noc(-c2ccccc2)n1)c1ccc(F)cc1 ZINC000178486636 337163083 /nfs/dbraw/zinc/16/30/83/337163083.db2.gz KQCIOQYSHYBUJF-OLZOCXBDSA-N 1 2 311.360 4.288 20 0 DIADLO Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000178666877 337165978 /nfs/dbraw/zinc/16/59/78/337165978.db2.gz PRZBDKADLFJCSA-KGLIPLIRSA-N 1 2 300.427 4.119 20 0 DIADLO Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000178666903 337166029 /nfs/dbraw/zinc/16/60/29/337166029.db2.gz PRZBDKADLFJCSA-ZIAGYGMSSA-N 1 2 300.427 4.119 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@H](C)c1ccoc1)c1ccccn1 ZINC000179482557 337169747 /nfs/dbraw/zinc/16/97/47/337169747.db2.gz MIBGHBFODZWHOD-KUHUBIRLSA-N 1 2 308.381 4.123 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@@H](C)c1ccoc1)c1ccccn1 ZINC000179482551 337169764 /nfs/dbraw/zinc/16/97/64/337169764.db2.gz MIBGHBFODZWHOD-LIRRHRJNSA-N 1 2 308.381 4.123 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1ccoc1)c1ccccn1 ZINC000179482578 337169794 /nfs/dbraw/zinc/16/97/94/337169794.db2.gz MIBGHBFODZWHOD-AUUYWEPGSA-N 1 2 308.381 4.123 20 0 DIADLO C[C@@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1ccccn1 ZINC000179613289 337170775 /nfs/dbraw/zinc/17/07/75/337170775.db2.gz QQVKLHFTPAEIOU-OAHLLOKOSA-N 1 2 318.424 4.455 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cnc(-c3ccccc3)[nH]2)n1 ZINC000179697759 337171209 /nfs/dbraw/zinc/17/12/09/337171209.db2.gz OQWSLNPHCNVFBZ-IBGZPJMESA-N 1 2 318.424 4.117 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cnc(-c3ccccc3)[nH]2)n1 ZINC000179697759 337171210 /nfs/dbraw/zinc/17/12/10/337171210.db2.gz OQWSLNPHCNVFBZ-IBGZPJMESA-N 1 2 318.424 4.117 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1CCC[C@@H]1CCc1ccccc1 ZINC000179856760 337172159 /nfs/dbraw/zinc/17/21/59/337172159.db2.gz FYWRBGYNZOMUJG-QGZVFWFLSA-N 1 2 309.413 4.019 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)s1 ZINC000180408774 337174276 /nfs/dbraw/zinc/17/42/76/337174276.db2.gz PAHCDQFRNNIVNP-NHYWBVRUSA-N 1 2 302.443 4.333 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)s1 ZINC000180408774 337174277 /nfs/dbraw/zinc/17/42/77/337174277.db2.gz PAHCDQFRNNIVNP-NHYWBVRUSA-N 1 2 302.443 4.333 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+](Cc2cccnc2)C2CC2)o1 ZINC000180732799 337177536 /nfs/dbraw/zinc/17/75/36/337177536.db2.gz XFILZJSAWVLXGL-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+](Cc2cccnc2)C2CC2)o1 ZINC000180732799 337177537 /nfs/dbraw/zinc/17/75/37/337177537.db2.gz XFILZJSAWVLXGL-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1cn(-c2ccccc2)nn1)c1ccccc1F ZINC000180945875 337178838 /nfs/dbraw/zinc/17/88/38/337178838.db2.gz PAVFYXXQILFLJY-KBXCAEBGSA-N 1 2 324.403 4.208 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](CC2CCC2)c2ccccc2)n1 ZINC000181353140 337181557 /nfs/dbraw/zinc/18/15/57/337181557.db2.gz NSXWGQUBLFHCTP-QGZVFWFLSA-N 1 2 313.445 4.433 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2noc(-c3ccsc3)n2)cc1F ZINC000181371864 337181717 /nfs/dbraw/zinc/18/17/17/337181717.db2.gz DZAIWJDTNOTQGW-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO Clc1ccc(C[NH2+][C@H](c2ccccc2)c2ccccn2)nc1 ZINC000181153422 337182026 /nfs/dbraw/zinc/18/20/26/337182026.db2.gz XSKIQCNNEPLDPE-GOSISDBHSA-N 1 2 309.800 4.009 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncc(-c2ccccc2)o1)c1cccc(O)c1 ZINC000181579809 337183181 /nfs/dbraw/zinc/18/31/81/337183181.db2.gz QDTOGCRLBKHUDY-KGLIPLIRSA-N 1 2 308.381 4.459 20 0 DIADLO Cc1cncc([C@@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)c1 ZINC000184329648 337197950 /nfs/dbraw/zinc/19/79/50/337197950.db2.gz ZDVAPPGSMDOSPX-RHSMWYFYSA-N 1 2 309.438 4.287 20 0 DIADLO C[C@H](c1cnccn1)[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC000184501268 337199220 /nfs/dbraw/zinc/19/92/20/337199220.db2.gz UTTXKVWGWFESGI-OAHLLOKOSA-N 1 2 301.393 4.220 20 0 DIADLO Cc1ccc(NCc2ccccc2OCc2cccnc2)c(C)[nH+]1 ZINC000184896984 337200669 /nfs/dbraw/zinc/20/06/69/337200669.db2.gz SLCJEBSCNZECIL-UHFFFAOYSA-N 1 2 319.408 4.285 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000185230925 337203622 /nfs/dbraw/zinc/20/36/22/337203622.db2.gz UTTAVKSFTMIKAU-PIGZYNQJSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000185230925 337203623 /nfs/dbraw/zinc/20/36/23/337203623.db2.gz UTTAVKSFTMIKAU-PIGZYNQJSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H](Cc1nc(-c2ccc(C(C)(C)C)cc2)no1)n1cc[nH+]c1 ZINC000583028936 337230841 /nfs/dbraw/zinc/23/08/41/337230841.db2.gz XEPIBBNOBUZGRU-CYBMUJFWSA-N 1 2 310.401 4.034 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000532902074 337252287 /nfs/dbraw/zinc/25/22/87/337252287.db2.gz ONHAJQZNSISJOF-NWDGAFQWSA-N 1 2 305.447 4.327 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@@H]1c1cccs1 ZINC000532902074 337252288 /nfs/dbraw/zinc/25/22/88/337252288.db2.gz ONHAJQZNSISJOF-NWDGAFQWSA-N 1 2 305.447 4.327 20 0 DIADLO CC(C)(C)OCc1cc(C[NH2+]Cc2coc3ccccc23)no1 ZINC000186420341 337256003 /nfs/dbraw/zinc/25/60/03/337256003.db2.gz UXIGHMWNLLSQBT-UHFFFAOYSA-N 1 2 314.385 4.026 20 0 DIADLO Cc1ccc(C(=O)N2CCCC[C@H](C)C2)cc1Oc1cc[nH+]cc1 ZINC000186475451 337256502 /nfs/dbraw/zinc/25/65/02/337256502.db2.gz FTQZMDHGVOPMEI-HNNXBMFYSA-N 1 2 324.424 4.445 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc(-c3ccccc3Cl)cs2)[C@H](C)CO1 ZINC000186502518 337257112 /nfs/dbraw/zinc/25/71/12/337257112.db2.gz SNESNXGFBFZQIL-VXGBXAGGSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc(-c3ccccc3Cl)cs2)[C@H](C)CO1 ZINC000186502518 337257113 /nfs/dbraw/zinc/25/71/13/337257113.db2.gz SNESNXGFBFZQIL-VXGBXAGGSA-N 1 2 322.861 4.073 20 0 DIADLO c1sc(COc2ccccc2)nc1C[N@@H+]1CCCC2(CC2)C1 ZINC000186625180 337258175 /nfs/dbraw/zinc/25/81/75/337258175.db2.gz MDSCPOCJNOZOOH-UHFFFAOYSA-N 1 2 314.454 4.098 20 0 DIADLO c1sc(COc2ccccc2)nc1C[N@H+]1CCCC2(CC2)C1 ZINC000186625180 337258176 /nfs/dbraw/zinc/25/81/76/337258176.db2.gz MDSCPOCJNOZOOH-UHFFFAOYSA-N 1 2 314.454 4.098 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@@H]2c2nccs2)c(C)c1 ZINC000186656113 337258197 /nfs/dbraw/zinc/25/81/97/337258197.db2.gz DBAZQQCRZVJFAL-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@@H]2c2nccs2)c(C)c1 ZINC000186656113 337258198 /nfs/dbraw/zinc/25/81/98/337258198.db2.gz DBAZQQCRZVJFAL-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO CC[C@@H]1COCC[N@@H+]1Cc1nc(-c2ccccc2Cl)cs1 ZINC000187046950 337261466 /nfs/dbraw/zinc/26/14/66/337261466.db2.gz WUNWTBJRIWCFOP-GFCCVEGCSA-N 1 2 322.861 4.074 20 0 DIADLO CC[C@@H]1COCC[N@H+]1Cc1nc(-c2ccccc2Cl)cs1 ZINC000187046950 337261467 /nfs/dbraw/zinc/26/14/67/337261467.db2.gz WUNWTBJRIWCFOP-GFCCVEGCSA-N 1 2 322.861 4.074 20 0 DIADLO Cc1ccc(C[S@@](=O)Cc2ccc(C(C)C)cc2)c(C)[nH+]1 ZINC000187072285 337261631 /nfs/dbraw/zinc/26/16/31/337261631.db2.gz NUXQFFYTNOGQME-NRFANRHFSA-N 1 2 301.455 4.271 20 0 DIADLO COc1ccc(-c2ccncc2)cc1CNc1ccc(C)[nH+]c1 ZINC000187601013 337267496 /nfs/dbraw/zinc/26/74/96/337267496.db2.gz MBSVTOHHQXDGSL-UHFFFAOYSA-N 1 2 305.381 4.073 20 0 DIADLO CC(C)c1nnc2n1CC[N@@H+](Cc1cccc3ccccc31)[C@H]2C ZINC000189576846 337280249 /nfs/dbraw/zinc/28/02/49/337280249.db2.gz AHQCNYDPALCIPM-HNNXBMFYSA-N 1 2 320.440 4.132 20 0 DIADLO CC(C)c1nnc2n1CC[N@H+](Cc1cccc3ccccc31)[C@H]2C ZINC000189576846 337280250 /nfs/dbraw/zinc/28/02/50/337280250.db2.gz AHQCNYDPALCIPM-HNNXBMFYSA-N 1 2 320.440 4.132 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H]1CCOc2ccc(F)cc21 ZINC000189583403 337280387 /nfs/dbraw/zinc/28/03/87/337280387.db2.gz KWYPHRWANPUNCS-HNNXBMFYSA-N 1 2 321.779 4.101 20 0 DIADLO Cc1cnc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)s1 ZINC000191245126 337295167 /nfs/dbraw/zinc/29/51/67/337295167.db2.gz LVWIBUNQWULAJK-UHFFFAOYSA-N 1 2 314.376 4.406 20 0 DIADLO Cc1cnc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)s1 ZINC000191245126 337295168 /nfs/dbraw/zinc/29/51/68/337295168.db2.gz LVWIBUNQWULAJK-UHFFFAOYSA-N 1 2 314.376 4.406 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+][C@@H]2CSC[C@H]2C)C(F)F)c1 ZINC000583273651 337299725 /nfs/dbraw/zinc/29/97/25/337299725.db2.gz XCQOIXCMZKPESI-DFBGVHRSSA-N 1 2 315.429 4.121 20 0 DIADLO CCCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1ncccn1 ZINC000192162026 337303496 /nfs/dbraw/zinc/30/34/96/337303496.db2.gz OEKGUVHOIINYKF-QGZVFWFLSA-N 1 2 313.445 4.142 20 0 DIADLO CC(=O)Nc1cccc(COc2cc(C)[nH+]c3ccccc32)c1 ZINC000192193655 337303938 /nfs/dbraw/zinc/30/39/38/337303938.db2.gz FTVQERSYBVMAHG-UHFFFAOYSA-N 1 2 306.365 4.081 20 0 DIADLO Cc1cc(C)cc(NC(=O)C[N@@H+](C)[C@@H](C)c2ccccc2F)c1 ZINC000532919523 337305671 /nfs/dbraw/zinc/30/56/71/337305671.db2.gz IHGLGQJDDMGJKN-HNNXBMFYSA-N 1 2 314.404 4.074 20 0 DIADLO Cc1cc(C)cc(NC(=O)C[N@H+](C)[C@@H](C)c2ccccc2F)c1 ZINC000532919523 337305672 /nfs/dbraw/zinc/30/56/72/337305672.db2.gz IHGLGQJDDMGJKN-HNNXBMFYSA-N 1 2 314.404 4.074 20 0 DIADLO COc1cccc(C[NH2+][C@H](c2ccco2)c2ccccc2)c1F ZINC000192662736 337306073 /nfs/dbraw/zinc/30/60/73/337306073.db2.gz BFENDXRDVDQAIE-IBGZPJMESA-N 1 2 311.356 4.307 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)C(=O)OC(C)(C)C)c1cc2ccccc2s1 ZINC000525952555 337309080 /nfs/dbraw/zinc/30/90/80/337309080.db2.gz RWPCCBRQXSTBHX-NEPJUHHUSA-N 1 2 305.443 4.282 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)n1 ZINC000193215033 337309490 /nfs/dbraw/zinc/30/94/90/337309490.db2.gz SPSQAQPCGMYLPM-JTQLQIEISA-N 1 2 313.323 4.063 20 0 DIADLO CC[N@@H+](C/C(C)=C\c1ccccc1OC(F)F)CC(F)F ZINC000583725188 337318333 /nfs/dbraw/zinc/31/83/33/337318333.db2.gz XNFCXOMXVKWAGF-FLIBITNWSA-N 1 2 305.315 4.278 20 0 DIADLO CC[N@H+](C/C(C)=C\c1ccccc1OC(F)F)CC(F)F ZINC000583725188 337318334 /nfs/dbraw/zinc/31/83/34/337318334.db2.gz XNFCXOMXVKWAGF-FLIBITNWSA-N 1 2 305.315 4.278 20 0 DIADLO C[C@H]([NH2+]Cc1ncccc1N(C)C)c1ccc(Cl)cc1Cl ZINC000583760258 337330657 /nfs/dbraw/zinc/33/06/57/337330657.db2.gz IZBBZUFVQDVDQV-NSHDSACASA-N 1 2 324.255 4.305 20 0 DIADLO Cc1csc(C[NH2+][C@H](C)c2sccc2Br)n1 ZINC000038091144 337372368 /nfs/dbraw/zinc/37/23/68/337372368.db2.gz OFLGOSUQNQLSQF-MRVPVSSYSA-N 1 2 317.277 4.126 20 0 DIADLO Cc1ccc(CC(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)cc1C ZINC000583906594 337383907 /nfs/dbraw/zinc/38/39/07/337383907.db2.gz IMYVGVLJZAQMPS-UHFFFAOYSA-N 1 2 319.408 4.183 20 0 DIADLO Cc1ccc(C(=O)C2CCN(c3cc[nH+]c(C(C)C)n3)CC2)cc1 ZINC000106464902 337387159 /nfs/dbraw/zinc/38/71/59/337387159.db2.gz SCKVWWFIHBJXRI-UHFFFAOYSA-N 1 2 323.440 4.008 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@]2(C)CCCc3ccccc32)n1 ZINC000520777745 337390284 /nfs/dbraw/zinc/39/02/84/337390284.db2.gz XYHKGHIJUGDYFW-HXUWFJFHSA-N 1 2 319.408 4.006 20 0 DIADLO C[N@H+](Cc1cccc(O)c1)Cc1cc(C(F)(F)F)ccc1F ZINC000532934451 337393958 /nfs/dbraw/zinc/39/39/58/337393958.db2.gz WIEPQWYEDZODSO-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO C[N@@H+](Cc1cccc(O)c1)Cc1cc(C(F)(F)F)ccc1F ZINC000532934451 337393959 /nfs/dbraw/zinc/39/39/59/337393959.db2.gz WIEPQWYEDZODSO-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO COc1cccc(OC)c1OCc1ccc(C(C)C)[nH+]c1C ZINC000418771995 337395981 /nfs/dbraw/zinc/39/59/81/337395981.db2.gz YTRYLNSGPWGJPE-UHFFFAOYSA-N 1 2 301.386 4.110 20 0 DIADLO Cc1ccc(C)c([C@H]2CCCN2C(=O)Nc2cc[nH+]cc2C)c1 ZINC000120797669 337396144 /nfs/dbraw/zinc/39/61/44/337396144.db2.gz XRXAZOVNMICPFS-GOSISDBHSA-N 1 2 309.413 4.376 20 0 DIADLO C[C@@H]1CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)[C@H](C)C1 ZINC000425037369 337401140 /nfs/dbraw/zinc/40/11/40/337401140.db2.gz ROEMRPCQAUYHFK-HUUCEWRRSA-N 1 2 310.397 4.135 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@H](c2nccn2C)c2cccc(F)c2)cc1 ZINC000128538438 337425698 /nfs/dbraw/zinc/42/56/98/337425698.db2.gz ZSWSMYPERREBMC-BEFAXECRSA-N 1 2 323.415 4.308 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Br)o1)c1cccc(F)c1F ZINC000188728262 337426392 /nfs/dbraw/zinc/42/63/92/337426392.db2.gz SSPLRBHMDGVBCQ-MRVPVSSYSA-N 1 2 316.145 4.171 20 0 DIADLO C[C@H](CC(=O)Nc1ccccc1-n1cc[nH+]c1)c1cccc(F)c1 ZINC000261451545 337452183 /nfs/dbraw/zinc/45/21/83/337452183.db2.gz PTPXAUUBOCYRSY-CQSZACIVSA-N 1 2 323.371 4.144 20 0 DIADLO C[C@@H](CC(=O)Nc1ccccc1-n1cc[nH+]c1)c1cccc(F)c1 ZINC000261451544 337452246 /nfs/dbraw/zinc/45/22/46/337452246.db2.gz PTPXAUUBOCYRSY-AWEZNQCLSA-N 1 2 323.371 4.144 20 0 DIADLO FC(F)(F)c1cccc(N[C@H](c2[nH]cc[nH+]2)c2cccnc2)c1 ZINC000195104329 337465123 /nfs/dbraw/zinc/46/51/23/337465123.db2.gz LXUVOAPOMQJARM-AWEZNQCLSA-N 1 2 318.302 4.025 20 0 DIADLO Cc1ccc(NCc2c[nH+]cn2C)cc1OCC1CCCCC1 ZINC000237676127 337469275 /nfs/dbraw/zinc/46/92/75/337469275.db2.gz WRDPNLKMNIEAIH-UHFFFAOYSA-N 1 2 313.445 4.300 20 0 DIADLO Cc1cc(N2CCC(OC3CCC3)CC2)c2cccc(F)c2[nH+]1 ZINC000418975034 337473530 /nfs/dbraw/zinc/47/35/30/337473530.db2.gz RJGBRMYJKMOBQJ-UHFFFAOYSA-N 1 2 314.404 4.220 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@@H](c2ccccc2)C(C)C)n1 ZINC000420509188 337505745 /nfs/dbraw/zinc/50/57/45/337505745.db2.gz CJJAWBDBPKISOZ-GOSISDBHSA-N 1 2 307.397 4.152 20 0 DIADLO Cc1[nH+]cccc1Cc1noc(/C=C/c2ccc([C@@H]3C[C@@H]3C)o2)n1 ZINC000420513907 337506503 /nfs/dbraw/zinc/50/65/03/337506503.db2.gz YLPKDTOPGGQMJM-PRWLWDESSA-N 1 2 321.380 4.251 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc([C@H](C)C(C)(C)C)n1 ZINC000445384330 337516002 /nfs/dbraw/zinc/51/60/02/337516002.db2.gz IJFCTZAYSXTKPY-LBPRGKRZSA-N 1 2 312.417 4.180 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H](C)c2cccc(C3CC3)c2)nn1C ZINC000421386085 337529895 /nfs/dbraw/zinc/52/98/95/337529895.db2.gz RFWRZSIIKIGZEB-LLVKDONJSA-N 1 2 303.837 4.110 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@]2(c3ccc(Cl)cc3)C[C@H]2C)nn1C ZINC000421358801 337531858 /nfs/dbraw/zinc/53/18/58/337531858.db2.gz UWMQEIXYHRUAKZ-HWPZZCPQSA-N 1 2 324.255 4.060 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@]2(c3ccc(Cl)cc3)C[C@@H]2C)nn1C ZINC000421358803 337531926 /nfs/dbraw/zinc/53/19/26/337531926.db2.gz UWMQEIXYHRUAKZ-QFYYESIMSA-N 1 2 324.255 4.060 20 0 DIADLO CN(Cc1cscn1)c1cc(C(C)(C)C)[nH+]c(C(C)(C)C)n1 ZINC000432251742 337540616 /nfs/dbraw/zinc/54/06/16/337540616.db2.gz UYBJEIPQAXDGAH-UHFFFAOYSA-N 1 2 318.490 4.165 20 0 DIADLO C(=C/c1ccc(-n2cc[nH+]c2)cc1)\c1nc(-c2ccsc2)no1 ZINC000074119761 337551447 /nfs/dbraw/zinc/55/14/47/337551447.db2.gz NNWTUCVMIJGIHJ-ZZXKWVIFSA-N 1 2 320.377 4.154 20 0 DIADLO C[C@@H]([NH2+][C@H]1C=CCCCCC1)c1noc(Cc2ccccc2)n1 ZINC000571943394 337583692 /nfs/dbraw/zinc/58/36/92/337583692.db2.gz UVDVXMAONDJZGL-WBVHZDCISA-N 1 2 311.429 4.200 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(-c3ccco3)cc2F)cs1 ZINC000571969813 337584696 /nfs/dbraw/zinc/58/46/96/337584696.db2.gz RYHKWBUUTAOWJS-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO Cn1c2cc(Cl)ccc2nc1-c1cc(-n2cc[nH+]c2)cs1 ZINC000432508170 337595214 /nfs/dbraw/zinc/59/52/14/337595214.db2.gz YSJDUANYENFUFK-UHFFFAOYSA-N 1 2 314.801 4.141 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(Cl)cc1F ZINC000161800252 337597404 /nfs/dbraw/zinc/59/74/04/337597404.db2.gz FEBWXXXWZNJJIT-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO Cc1cc(N2C[C@@H](C)[C@@H]2c2ccccc2)nc(-c2ccncc2)[nH+]1 ZINC000078573379 337601933 /nfs/dbraw/zinc/60/19/33/337601933.db2.gz MWTLOMMKZIUUQD-AUUYWEPGSA-N 1 2 316.408 4.044 20 0 DIADLO CC[C@H](C(=O)N[C@@H](c1[nH]cc[nH+]1)C(C)C)C1CCC(C)CC1 ZINC000572305953 337605747 /nfs/dbraw/zinc/60/57/47/337605747.db2.gz HJQLSBGNUKHMEJ-SSHXOBKSSA-N 1 2 305.466 4.076 20 0 DIADLO CC(=O)Nc1ccccc1CNc1[nH+]cccc1-c1ccccc1 ZINC000162386215 337617271 /nfs/dbraw/zinc/61/72/71/337617271.db2.gz LUJKEBVGKFSQII-UHFFFAOYSA-N 1 2 317.392 4.319 20 0 DIADLO C[C@@H](Oc1ccc[nH+]c1NCc1cscn1)c1ccccc1 ZINC000162408072 337618255 /nfs/dbraw/zinc/61/82/55/337618255.db2.gz HOWPQQHRZLFNNG-CYBMUJFWSA-N 1 2 311.410 4.290 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@@H](C)c1ccncc1Cl)c1ccco1 ZINC000421823914 337646115 /nfs/dbraw/zinc/64/61/15/337646115.db2.gz FYVZWLPHHRNMAV-XJKSGUPXSA-N 1 2 322.836 4.393 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccncc1Cl)c1nc2c(s1)CCC2 ZINC000421851721 337649867 /nfs/dbraw/zinc/64/98/67/337649867.db2.gz GDFYDGAEQPOLDX-NXEZZACHSA-N 1 2 307.850 4.092 20 0 DIADLO COc1cc(Cl)ccc1[C@H](C)[NH2+]Cc1nccn1CC(C)C ZINC000421832026 337651534 /nfs/dbraw/zinc/65/15/34/337651534.db2.gz MBTNJXYXGZJNSG-ZDUSSCGKSA-N 1 2 321.852 4.052 20 0 DIADLO Cc1cc(N2CCC[C@H]2[C@@H]2CCCOC2)c2cccc(F)c2[nH+]1 ZINC000580427047 337673371 /nfs/dbraw/zinc/67/33/71/337673371.db2.gz YDYWVQNLCZUQNC-PBHICJAKSA-N 1 2 314.404 4.078 20 0 DIADLO Fc1ccc(F)c(C[NH2+]Cc2cc(F)c(Cl)cc2F)c1 ZINC000433188772 337710450 /nfs/dbraw/zinc/71/04/50/337710450.db2.gz QXYQOPXJGGKJNT-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO Cn1ccc2c1cccc2NCc1c[nH+]cn1Cc1ccccc1 ZINC000527112371 337731339 /nfs/dbraw/zinc/73/13/39/337731339.db2.gz DIRTZFWLPSBKOB-UHFFFAOYSA-N 1 2 316.408 4.035 20 0 DIADLO CC(C)c1cccc([C@H](C)[NH2+]Cc2nccc(C(F)(F)F)n2)c1 ZINC000527907081 337770316 /nfs/dbraw/zinc/77/03/16/337770316.db2.gz FJWSRKKKWHUKOP-LBPRGKRZSA-N 1 2 323.362 4.470 20 0 DIADLO CC(C)c1cccc([C@H](C)[NH2+]Cc2ncc(C(F)(F)F)cn2)c1 ZINC000527901141 337772934 /nfs/dbraw/zinc/77/29/34/337772934.db2.gz AUYYFCWWDAGKEF-LBPRGKRZSA-N 1 2 323.362 4.470 20 0 DIADLO C[C@@H]1CN(c2[nH+]ccc3ccccc32)C[C@@H](c2ccsc2)O1 ZINC000527931559 337776548 /nfs/dbraw/zinc/77/65/48/337776548.db2.gz SYQMFHLVMXVJQO-DYVFJYSZSA-N 1 2 310.422 4.263 20 0 DIADLO Cn1cc[nH+]c1[C@H](Nc1cc2c(cc1Cl)CCC2)C1CC1 ZINC000528002420 337779733 /nfs/dbraw/zinc/77/97/33/337779733.db2.gz QHHVVOKEBZEQRT-MRXNPFEDSA-N 1 2 301.821 4.125 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccccc1N1CCCCCC1 ZINC000424156328 337783537 /nfs/dbraw/zinc/78/35/37/337783537.db2.gz OVXGTJBHKPNULA-UHFFFAOYSA-N 1 2 312.461 4.457 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@@H]2CC[C@@H]2c2ccc(F)cc2)n1 ZINC000528214730 337795939 /nfs/dbraw/zinc/79/59/39/337795939.db2.gz WYHOODGTLUNVCM-IAGOWNOFSA-N 1 2 323.371 4.164 20 0 DIADLO CCc1c(NCc2c[nH+]cn2C(C)C)cnn1-c1cccc(C)c1 ZINC000424192498 337805377 /nfs/dbraw/zinc/80/53/77/337805377.db2.gz PBDPJUQWFMBMBX-UHFFFAOYSA-N 1 2 323.444 4.133 20 0 DIADLO CCc1c(NCc2c[nH+]cn2C(C)C)cnn1-c1ccccc1C ZINC000424193698 337805822 /nfs/dbraw/zinc/80/58/22/337805822.db2.gz RBROQLSDYIPLAP-UHFFFAOYSA-N 1 2 323.444 4.133 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(-c2cccs2)n1)c1cccc(O)c1 ZINC000105461139 337808373 /nfs/dbraw/zinc/80/83/73/337808373.db2.gz XMRLZBOHLLPXCG-LLVKDONJSA-N 1 2 316.451 4.428 20 0 DIADLO CCc1cnc(C[NH2+]C(C)(C)c2cc(Cl)ccc2OC)s1 ZINC000424200402 337808386 /nfs/dbraw/zinc/80/83/86/337808386.db2.gz MHIHBZDROJUONY-UHFFFAOYSA-N 1 2 324.877 4.392 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)Cc1ccc(-c2ccccc2)cc1 ZINC000107291063 337828364 /nfs/dbraw/zinc/82/83/64/337828364.db2.gz ZUBNHQUVMHKLRK-UHFFFAOYSA-N 1 2 302.377 4.238 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CCc1cccc(OC2CCCC2)c1 ZINC000107292409 337828376 /nfs/dbraw/zinc/82/83/76/337828376.db2.gz DYGHTLLCFGJDSL-UHFFFAOYSA-N 1 2 324.424 4.283 20 0 DIADLO Cc1[nH+]c2ccccc2n1CC(=O)N(c1ccccc1C)C(C)C ZINC000533214376 337836209 /nfs/dbraw/zinc/83/62/09/337836209.db2.gz GTQDFCXINMTKNW-UHFFFAOYSA-N 1 2 321.424 4.095 20 0 DIADLO Cc1ccc(C)c(N(C)Cc2[nH+]ccn2Cc2ccccc2)c1 ZINC000533246320 337837723 /nfs/dbraw/zinc/83/77/23/337837723.db2.gz WSRFPYXSQQOASR-UHFFFAOYSA-N 1 2 305.425 4.185 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1nc(C)c2ccccc2n1)C(C)C ZINC000118840735 337851922 /nfs/dbraw/zinc/85/19/22/337851922.db2.gz GNBSTZLRXQBFCC-LJQANCHMSA-N 1 2 320.440 4.129 20 0 DIADLO Cc1ccc(Cl)c(O[C@H](C)C(=O)Nc2ccc(C)[nH+]c2C)c1 ZINC000119056574 337853764 /nfs/dbraw/zinc/85/37/64/337853764.db2.gz XCPJHGZUBNFJPV-CYBMUJFWSA-N 1 2 318.804 4.066 20 0 DIADLO Cc1ccc(NC(=O)C(C)(C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000119371248 337858473 /nfs/dbraw/zinc/85/84/73/337858473.db2.gz PLQUXRWAYDQYKY-UHFFFAOYSA-N 1 2 302.805 4.268 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@@H]2CCc2ccccc2)cc[nH+]1 ZINC000119421620 337859651 /nfs/dbraw/zinc/85/96/51/337859651.db2.gz GSNWIIXMLJYXAD-GOSISDBHSA-N 1 2 309.413 4.019 20 0 DIADLO C[C@H]1CC(CC[S@@](=O)Cc2cn3ccccc3[nH+]2)C[C@@H](C)C1 ZINC000089104884 337866931 /nfs/dbraw/zinc/86/69/31/337866931.db2.gz NKKIEWNQFSIPQC-AUNCGFEGSA-N 1 2 318.486 4.045 20 0 DIADLO Cc1cscc1NC(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000120653326 337877120 /nfs/dbraw/zinc/87/71/20/337877120.db2.gz YZWDRUMCTLYXON-UHFFFAOYSA-N 1 2 312.398 4.101 20 0 DIADLO Fc1cccc(-c2cnc(C[NH2+]C3(c4ccccc4)CC3)o2)c1 ZINC000537058883 337883160 /nfs/dbraw/zinc/88/31/60/337883160.db2.gz CKZAQWZSXKEMLZ-UHFFFAOYSA-N 1 2 308.356 4.260 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@H](C)c2ccccn2)c2ccccn2)c1 ZINC000090946168 337887243 /nfs/dbraw/zinc/88/72/43/337887243.db2.gz WNVHKVCPSAJYTM-UZLBHIALSA-N 1 2 303.409 4.225 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@H](c1ccc(F)cc1F)C(C)C ZINC000121217637 337888137 /nfs/dbraw/zinc/88/81/37/337888137.db2.gz XVHXTXKIALOTOC-INIZCTEOSA-N 1 2 319.355 4.187 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2OC)c(F)c1 ZINC000122406911 337917656 /nfs/dbraw/zinc/91/76/56/337917656.db2.gz GQXYKEALSJQBKQ-RYUDHWBXSA-N 1 2 321.367 4.394 20 0 DIADLO Cc1cccn2cc(-c3ccc(NCc4cccn4C)cc3)[nH+]c12 ZINC000537728959 337961195 /nfs/dbraw/zinc/96/11/95/337961195.db2.gz ANQXTZZNFBTFIC-UHFFFAOYSA-N 1 2 316.408 4.260 20 0 DIADLO CC[C@@H]1CCC[C@@H]1c1nc(CCn2c(C)[nH+]c3ccccc32)no1 ZINC000514913052 337974039 /nfs/dbraw/zinc/97/40/39/337974039.db2.gz DEAFVTCZJQOURS-CABCVRRESA-N 1 2 324.428 4.264 20 0 DIADLO Cc1cccc(N2CC[NH+]([C@H](C)c3cc(F)ccc3F)CC2)c1 ZINC000515780373 337997430 /nfs/dbraw/zinc/99/74/30/337997430.db2.gz YAIKYRLFGFACHJ-OAHLLOKOSA-N 1 2 316.395 4.156 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](CCC(F)(F)F)CC2CC2)cs1 ZINC000084137559 338000270 /nfs/dbraw/zinc/00/02/70/338000270.db2.gz WFFPMNNCWDEKFV-SNVBAGLBSA-N 1 2 322.396 4.015 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](CCC(F)(F)F)CC2CC2)cs1 ZINC000084137559 338000271 /nfs/dbraw/zinc/00/02/71/338000271.db2.gz WFFPMNNCWDEKFV-SNVBAGLBSA-N 1 2 322.396 4.015 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+](C)[C@H](C)c2cccnc2)o1 ZINC000537900103 338002727 /nfs/dbraw/zinc/00/27/27/338002727.db2.gz PZGHEJDEUMJFHT-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+](C)[C@H](C)c2cccnc2)o1 ZINC000537900103 338002728 /nfs/dbraw/zinc/00/27/28/338002728.db2.gz PZGHEJDEUMJFHT-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@H]2CCC[C@@H]2c2ccccc2)n1 ZINC000516169330 338006997 /nfs/dbraw/zinc/00/69/97/338006997.db2.gz OWZJTXIQEBUVFO-MSOLQXFVSA-N 1 2 319.408 4.415 20 0 DIADLO Cc1ccc([C@H](C)c2noc([C@@H](c3ccccc3)[NH+](C)C)n2)cc1 ZINC000516345962 338010409 /nfs/dbraw/zinc/01/04/09/338010409.db2.gz ZUXJRIOZZIQZEU-MAUKXSAKSA-N 1 2 321.424 4.181 20 0 DIADLO COc1cccc2c1CCC[C@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000516534033 338014744 /nfs/dbraw/zinc/01/47/44/338014744.db2.gz DCZLJDDDFHNCDR-GOSISDBHSA-N 1 2 323.440 4.180 20 0 DIADLO CCCCC[C@H]1CCCN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000426107445 338020507 /nfs/dbraw/zinc/02/05/07/338020507.db2.gz YFFPAFQLLZEWBC-INIZCTEOSA-N 1 2 314.433 4.219 20 0 DIADLO CCC[C@H](C)[C@@H]1CCCN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000426107485 338020531 /nfs/dbraw/zinc/02/05/31/338020531.db2.gz YPMDUANFZIYKKD-BBRMVZONSA-N 1 2 314.433 4.075 20 0 DIADLO COc1c(C)cnc(C[N@H+](C)Cc2cc(Cl)cs2)c1C ZINC000426147003 338021223 /nfs/dbraw/zinc/02/12/23/338021223.db2.gz BSZIXSDFPSCPSU-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COc1c(C)cnc(C[N@@H+](C)Cc2cc(Cl)cs2)c1C ZINC000426147003 338021224 /nfs/dbraw/zinc/02/12/24/338021224.db2.gz BSZIXSDFPSCPSU-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO CCCc1csc(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)n1 ZINC000426359744 338028704 /nfs/dbraw/zinc/02/87/04/338028704.db2.gz JBZLJQQAILDMAC-JQWIXIFHSA-N 1 2 306.397 4.258 20 0 DIADLO CCCc1csc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)n1 ZINC000426359744 338028705 /nfs/dbraw/zinc/02/87/05/338028705.db2.gz JBZLJQQAILDMAC-JQWIXIFHSA-N 1 2 306.397 4.258 20 0 DIADLO Cc1c[nH+]cc(CCc2nc(-c3cc(Cl)ccc3C)no2)c1 ZINC000426411909 338031163 /nfs/dbraw/zinc/03/11/63/338031163.db2.gz RORDNDFFEYLOFB-UHFFFAOYSA-N 1 2 313.788 4.187 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@@H](c2ccccc2)OC[C@@H]1C ZINC000428231178 338043377 /nfs/dbraw/zinc/04/33/77/338043377.db2.gz VDLXSLUTRNTYBO-KSSFIOAISA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@@H](c2ccccc2)OC[C@@H]1C ZINC000428231178 338043378 /nfs/dbraw/zinc/04/33/78/338043378.db2.gz VDLXSLUTRNTYBO-KSSFIOAISA-N 1 2 314.429 4.068 20 0 DIADLO CCCc1nc(C)c(C[N@@H+]2CCc3c(F)cc(F)cc3[C@H]2C)o1 ZINC000428245471 338044022 /nfs/dbraw/zinc/04/40/22/338044022.db2.gz KBAFITDGWDRZBL-GFCCVEGCSA-N 1 2 320.383 4.333 20 0 DIADLO CCCc1nc(C)c(C[N@H+]2CCc3c(F)cc(F)cc3[C@H]2C)o1 ZINC000428245471 338044023 /nfs/dbraw/zinc/04/40/23/338044023.db2.gz KBAFITDGWDRZBL-GFCCVEGCSA-N 1 2 320.383 4.333 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2nnc(C(C)C)[nH]2)o1 ZINC000428244576 338044096 /nfs/dbraw/zinc/04/40/96/338044096.db2.gz IRXUHDSSKWROCU-DZGCQCFKSA-N 1 2 316.449 4.057 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2nnc(C(C)C)[nH]2)o1 ZINC000428244576 338044097 /nfs/dbraw/zinc/04/40/97/338044097.db2.gz IRXUHDSSKWROCU-DZGCQCFKSA-N 1 2 316.449 4.057 20 0 DIADLO CC(C)c1nnc(C[N@H+](C)Cc2ccccc2-c2ccccc2)[nH]1 ZINC000428248877 338044223 /nfs/dbraw/zinc/04/42/23/338044223.db2.gz MHSWKNVFNBACBJ-UHFFFAOYSA-N 1 2 320.440 4.227 20 0 DIADLO CC(C)c1nnc(C[N@@H+](C)Cc2ccccc2-c2ccccc2)[nH]1 ZINC000428248877 338044224 /nfs/dbraw/zinc/04/42/24/338044224.db2.gz MHSWKNVFNBACBJ-UHFFFAOYSA-N 1 2 320.440 4.227 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+]2CCc3cc(-c4ccccc4)oc3C2)cn1 ZINC000428381098 338049543 /nfs/dbraw/zinc/04/95/43/338049543.db2.gz FLQIJIMRMKKQKZ-OAHLLOKOSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+]2CCc3cc(-c4ccccc4)oc3C2)cn1 ZINC000428381098 338049544 /nfs/dbraw/zinc/04/95/44/338049544.db2.gz FLQIJIMRMKKQKZ-OAHLLOKOSA-N 1 2 319.408 4.164 20 0 DIADLO COc1ccccc1C[N@H+](Cc1oc(C(C)C)nc1C)C1CC1 ZINC000428462314 338053365 /nfs/dbraw/zinc/05/33/65/338053365.db2.gz KNLPPWWELCROKN-UHFFFAOYSA-N 1 2 314.429 4.280 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1oc(C(C)C)nc1C)C1CC1 ZINC000428462314 338053366 /nfs/dbraw/zinc/05/33/66/338053366.db2.gz KNLPPWWELCROKN-UHFFFAOYSA-N 1 2 314.429 4.280 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)ncn1 ZINC000428481057 338054595 /nfs/dbraw/zinc/05/45/95/338054595.db2.gz DCDCDDSJISPLKU-INIZCTEOSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)ncn1 ZINC000428481057 338054596 /nfs/dbraw/zinc/05/45/96/338054596.db2.gz DCDCDDSJISPLKU-INIZCTEOSA-N 1 2 322.239 4.429 20 0 DIADLO C[C@@]12CC[N@H+](Cc3csc(C4CCCC4)n3)C[C@@H]1C2(F)F ZINC000428710700 338059151 /nfs/dbraw/zinc/05/91/51/338059151.db2.gz JZVRRWBBBFZFKU-DZGCQCFKSA-N 1 2 312.429 4.278 20 0 DIADLO C[C@@]12CC[N@@H+](Cc3csc(C4CCCC4)n3)C[C@@H]1C2(F)F ZINC000428710700 338059152 /nfs/dbraw/zinc/05/91/52/338059152.db2.gz JZVRRWBBBFZFKU-DZGCQCFKSA-N 1 2 312.429 4.278 20 0 DIADLO CC(C)[N@H+](Cc1noc(C(C)(C)C)n1)[C@@H](C)c1ccccc1 ZINC000428843413 338061802 /nfs/dbraw/zinc/06/18/02/338061802.db2.gz VOARKVRYZAHSDP-AWEZNQCLSA-N 1 2 301.434 4.339 20 0 DIADLO CC(C)[N@@H+](Cc1noc(C(C)(C)C)n1)[C@@H](C)c1ccccc1 ZINC000428843413 338061803 /nfs/dbraw/zinc/06/18/03/338061803.db2.gz VOARKVRYZAHSDP-AWEZNQCLSA-N 1 2 301.434 4.339 20 0 DIADLO CC(C)[N@H+](Cc1noc(C(C)(C)C)n1)[C@H](C)c1ccccc1 ZINC000428843414 338061864 /nfs/dbraw/zinc/06/18/64/338061864.db2.gz VOARKVRYZAHSDP-CQSZACIVSA-N 1 2 301.434 4.339 20 0 DIADLO CC(C)[N@@H+](Cc1noc(C(C)(C)C)n1)[C@H](C)c1ccccc1 ZINC000428843414 338061865 /nfs/dbraw/zinc/06/18/65/338061865.db2.gz VOARKVRYZAHSDP-CQSZACIVSA-N 1 2 301.434 4.339 20 0 DIADLO Fc1ccc2nc(C[NH2+]C3(c4ccccc4F)CC3)sc2c1 ZINC000428845696 338061923 /nfs/dbraw/zinc/06/19/23/338061923.db2.gz MIRVIBRPQIXSBB-UHFFFAOYSA-N 1 2 316.376 4.353 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccc(C(F)(F)F)s2)cs1 ZINC000428873386 338063899 /nfs/dbraw/zinc/06/38/99/338063899.db2.gz UQVOKFNKADKBQO-ZETCQYMHSA-N 1 2 306.378 4.383 20 0 DIADLO Fc1ccc2nc(CNc3ccc(-n4cc[nH+]c4)cc3)sc2c1 ZINC000428877090 338064101 /nfs/dbraw/zinc/06/41/01/338064101.db2.gz RYSJWWXWPSGMIZ-UHFFFAOYSA-N 1 2 324.384 4.233 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1CC[C@@](F)(c2ccccc2F)C1 ZINC000428942640 338066002 /nfs/dbraw/zinc/06/60/02/338066002.db2.gz ZMNUPIFWLNJSDA-SFHVURJKSA-N 1 2 320.383 4.316 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1CC[C@@](F)(c2ccccc2F)C1 ZINC000428942640 338066003 /nfs/dbraw/zinc/06/60/03/338066003.db2.gz ZMNUPIFWLNJSDA-SFHVURJKSA-N 1 2 320.383 4.316 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCCn2c(cc3ccccc32)C1 ZINC000428977551 338067481 /nfs/dbraw/zinc/06/74/81/338067481.db2.gz JHOKGITZZRZPMA-UHFFFAOYSA-N 1 2 323.440 4.467 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1CCCn2c(cc3ccccc32)C1 ZINC000428977551 338067482 /nfs/dbraw/zinc/06/74/82/338067482.db2.gz JHOKGITZZRZPMA-UHFFFAOYSA-N 1 2 323.440 4.467 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(C(C)(C)C)n2)Cc2ccccc2O1 ZINC000429119708 338071104 /nfs/dbraw/zinc/07/11/04/338071104.db2.gz YYYZNKKQLMTQRN-ZDUSSCGKSA-N 1 2 316.470 4.224 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(C(C)(C)C)n2)Cc2ccccc2O1 ZINC000429119708 338071105 /nfs/dbraw/zinc/07/11/05/338071105.db2.gz YYYZNKKQLMTQRN-ZDUSSCGKSA-N 1 2 316.470 4.224 20 0 DIADLO Fc1cccc(C[NH+]2CCC(c3ncccc3Cl)CC2)c1F ZINC000429215719 338073507 /nfs/dbraw/zinc/07/35/07/338073507.db2.gz MPZLEZRCKYCLPU-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO CCO[C@H](C)c1nc(C[NH2+]C(C)(C)c2ccccc2F)cs1 ZINC000429236920 338074171 /nfs/dbraw/zinc/07/41/71/338074171.db2.gz NCTDBKLPRFMRPS-GFCCVEGCSA-N 1 2 322.449 4.405 20 0 DIADLO CC[C@@H]1CC[N@@H+]1Cc1cccc(Br)c1OC(F)F ZINC000429281362 338076148 /nfs/dbraw/zinc/07/61/48/338076148.db2.gz VFFNXXZGCZKFOL-SNVBAGLBSA-N 1 2 320.177 4.035 20 0 DIADLO CC[C@@H]1CC[N@H+]1Cc1cccc(Br)c1OC(F)F ZINC000429281362 338076149 /nfs/dbraw/zinc/07/61/49/338076149.db2.gz VFFNXXZGCZKFOL-SNVBAGLBSA-N 1 2 320.177 4.035 20 0 DIADLO CC(C)([NH2+]Cc1nc2cc(F)ccc2o1)c1ccccc1F ZINC000429268155 338075441 /nfs/dbraw/zinc/07/54/41/338075441.db2.gz ACGTZGAGFDMPGU-UHFFFAOYSA-N 1 2 302.324 4.131 20 0 DIADLO CC(C)n1cnnc1C[N@H+](C)[C@@H](C)c1ccc2ccccc2c1 ZINC000429290044 338076483 /nfs/dbraw/zinc/07/64/83/338076483.db2.gz QSWZPIRXKIFEPB-HNNXBMFYSA-N 1 2 308.429 4.205 20 0 DIADLO CC(C)n1cnnc1C[N@@H+](C)[C@@H](C)c1ccc2ccccc2c1 ZINC000429290044 338076484 /nfs/dbraw/zinc/07/64/84/338076484.db2.gz QSWZPIRXKIFEPB-HNNXBMFYSA-N 1 2 308.429 4.205 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1nc2cc(C(F)(F)F)ccc2o1 ZINC000429380001 338079157 /nfs/dbraw/zinc/07/91/57/338079157.db2.gz KZJUSRWMFTYMIX-UHFFFAOYSA-N 1 2 324.302 4.380 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1nc2cc(C(F)(F)F)ccc2o1 ZINC000429380001 338079158 /nfs/dbraw/zinc/07/91/58/338079158.db2.gz KZJUSRWMFTYMIX-UHFFFAOYSA-N 1 2 324.302 4.380 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)N(C)Cc1cn2c([nH+]1)CCCC2 ZINC000429535271 338083174 /nfs/dbraw/zinc/08/31/74/338083174.db2.gz AYXCSAJBZYWGFD-KRWDZBQOSA-N 1 2 319.399 4.081 20 0 DIADLO CN(C/C=C/c1ccc(Cl)cc1)Cc1cn2c([nH+]1)CCCC2 ZINC000429546727 338083659 /nfs/dbraw/zinc/08/36/59/338083659.db2.gz INHNWWFUVKPYRY-SNAWJCMRSA-N 1 2 315.848 4.018 20 0 DIADLO Fc1cccc2c1CC[C@H]2[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000429778394 338089627 /nfs/dbraw/zinc/08/96/27/338089627.db2.gz BESOXUOASJCVNE-CQSZACIVSA-N 1 2 313.269 4.159 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccccc1F ZINC000429781811 338089756 /nfs/dbraw/zinc/08/97/56/338089756.db2.gz UMWIWUZVXIINTL-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2ccc(Cl)cc2F)c(F)c1F ZINC000430038382 338094132 /nfs/dbraw/zinc/09/41/32/338094132.db2.gz KGLJYJXWYRZVTM-UHFFFAOYSA-N 1 2 321.676 4.325 20 0 DIADLO CCOc1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccnc2)cc1F ZINC000430088616 338095700 /nfs/dbraw/zinc/09/57/00/338095700.db2.gz KWSUGRWCXAXZQM-GOSISDBHSA-N 1 2 314.404 4.203 20 0 DIADLO CCOc1ccc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)cc1F ZINC000430088616 338095701 /nfs/dbraw/zinc/09/57/01/338095701.db2.gz KWSUGRWCXAXZQM-GOSISDBHSA-N 1 2 314.404 4.203 20 0 DIADLO Cc1cc(F)ccc1C1CC[NH+](Cc2ccn(C(F)F)n2)CC1 ZINC000430103499 338096850 /nfs/dbraw/zinc/09/68/50/338096850.db2.gz QBVGDPIWKJIICM-UHFFFAOYSA-N 1 2 323.362 4.105 20 0 DIADLO CC(C)[C@H]1[N@H+](Cc2ncc(C(F)(F)F)s2)CC12CCC2 ZINC000430109545 338097289 /nfs/dbraw/zinc/09/72/89/338097289.db2.gz YPQAIPBCECQYJX-GFCCVEGCSA-N 1 2 304.381 4.172 20 0 DIADLO CC(C)[C@H]1[N@@H+](Cc2ncc(C(F)(F)F)s2)CC12CCC2 ZINC000430109545 338097290 /nfs/dbraw/zinc/09/72/90/338097290.db2.gz YPQAIPBCECQYJX-GFCCVEGCSA-N 1 2 304.381 4.172 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000430120621 338098030 /nfs/dbraw/zinc/09/80/30/338098030.db2.gz HEYSZJUYNBOYGE-UHFFFAOYSA-N 1 2 301.283 4.378 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000430120621 338098031 /nfs/dbraw/zinc/09/80/31/338098031.db2.gz HEYSZJUYNBOYGE-UHFFFAOYSA-N 1 2 301.283 4.378 20 0 DIADLO CC(C)c1cnc(C[N@H+]2Cc3ccccc3O[C@@H](C)C2)s1 ZINC000430148470 338099359 /nfs/dbraw/zinc/09/93/59/338099359.db2.gz SFNDXBYVLDWQSX-ZDUSSCGKSA-N 1 2 302.443 4.050 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2Cc3ccccc3O[C@@H](C)C2)s1 ZINC000430148470 338099360 /nfs/dbraw/zinc/09/93/60/338099360.db2.gz SFNDXBYVLDWQSX-ZDUSSCGKSA-N 1 2 302.443 4.050 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1ccsc1Cl ZINC000430863365 338117311 /nfs/dbraw/zinc/11/73/11/338117311.db2.gz HKBLSBHPMDJXBT-ZDUSSCGKSA-N 1 2 309.866 4.345 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(F)cc1 ZINC000162829538 338136914 /nfs/dbraw/zinc/13/69/14/338136914.db2.gz GFIRDPUAYUXWCH-CYBMUJFWSA-N 1 2 323.371 4.348 20 0 DIADLO CC[C@@H]1CCC[C@@H]1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000162836107 338137616 /nfs/dbraw/zinc/13/76/16/338137616.db2.gz DQLRFDHXHKGEIS-KDOFPFPSSA-N 1 2 310.397 4.182 20 0 DIADLO Cc1nc(N2CC[C@@H](c3cccc(Cl)c3)C2)c(C)c(C)[nH+]1 ZINC000432132763 338146477 /nfs/dbraw/zinc/14/64/77/338146477.db2.gz GSLQYSWNGWDWCC-OAHLLOKOSA-N 1 2 301.821 4.049 20 0 DIADLO Cc1nc(N2CC[C@H](c3cccc(Cl)c3)C2)c(C)c(C)[nH+]1 ZINC000432132762 338146562 /nfs/dbraw/zinc/14/65/62/338146562.db2.gz GSLQYSWNGWDWCC-HNNXBMFYSA-N 1 2 301.821 4.049 20 0 DIADLO CC(C)c1nnc([C@H](C)[NH2+]Cc2csc(Cl)c2Cl)[nH]1 ZINC000432254285 338151316 /nfs/dbraw/zinc/15/13/16/338151316.db2.gz NYVDMLKVVDDGBS-ZETCQYMHSA-N 1 2 319.261 4.147 20 0 DIADLO Fc1ccc(C[NH2+]Cc2ccc(Cl)cn2)c(Cl)c1Cl ZINC000432257277 338151555 /nfs/dbraw/zinc/15/15/55/338151555.db2.gz JEQZIOGWTXAIQD-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1ccc(C(F)(F)F)s1 ZINC000432729287 338164507 /nfs/dbraw/zinc/16/45/07/338164507.db2.gz PRCIBSVVMOOZPY-UHFFFAOYSA-N 1 2 322.783 4.391 20 0 DIADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1ccc(C(F)(F)F)s1 ZINC000432729287 338164508 /nfs/dbraw/zinc/16/45/08/338164508.db2.gz PRCIBSVVMOOZPY-UHFFFAOYSA-N 1 2 322.783 4.391 20 0 DIADLO Cc1n[nH]c(C)c1CNc1ccc(-c2ccc(Cl)s2)c[nH+]1 ZINC000432735920 338164906 /nfs/dbraw/zinc/16/49/06/338164906.db2.gz RCGOAVGXWYTKQF-UHFFFAOYSA-N 1 2 318.833 4.416 20 0 DIADLO Cc1ncsc1C[N@@H+](C)Cc1csc(Cl)c1Cl ZINC000432738029 338165254 /nfs/dbraw/zinc/16/52/54/338165254.db2.gz OLAKPHODDJSRIW-UHFFFAOYSA-N 1 2 307.271 4.452 20 0 DIADLO Cc1ncsc1C[N@H+](C)Cc1csc(Cl)c1Cl ZINC000432738029 338165255 /nfs/dbraw/zinc/16/52/55/338165255.db2.gz OLAKPHODDJSRIW-UHFFFAOYSA-N 1 2 307.271 4.452 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc(C(F)(F)F)s2)on1 ZINC000432744553 338165757 /nfs/dbraw/zinc/16/57/57/338165757.db2.gz KIMLYFFJZVERSH-NSHDSACASA-N 1 2 316.348 4.400 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc(C(F)(F)F)s2)on1 ZINC000432744553 338165758 /nfs/dbraw/zinc/16/57/58/338165758.db2.gz KIMLYFFJZVERSH-NSHDSACASA-N 1 2 316.348 4.400 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCc3sccc3C2)s1 ZINC000432744562 338165912 /nfs/dbraw/zinc/16/59/12/338165912.db2.gz KJYQGDUOUAEOGT-UHFFFAOYSA-N 1 2 303.374 4.387 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCc3sccc3C2)s1 ZINC000432744562 338165913 /nfs/dbraw/zinc/16/59/13/338165913.db2.gz KJYQGDUOUAEOGT-UHFFFAOYSA-N 1 2 303.374 4.387 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2nc3ccc(F)cc3s2)on1 ZINC000432746246 338165945 /nfs/dbraw/zinc/16/59/45/338165945.db2.gz ZCOAHYHNURXMOU-CYBMUJFWSA-N 1 2 317.389 4.069 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2nc3ccc(F)cc3s2)on1 ZINC000432746246 338165946 /nfs/dbraw/zinc/16/59/46/338165946.db2.gz ZCOAHYHNURXMOU-CYBMUJFWSA-N 1 2 317.389 4.069 20 0 DIADLO FC(F)(F)c1ccc(CN2CCCC[C@H]2c2[nH]cc[nH+]2)s1 ZINC000432746815 338166034 /nfs/dbraw/zinc/16/60/34/338166034.db2.gz FVWHCZDQKJSZTK-NSHDSACASA-N 1 2 315.364 4.217 20 0 DIADLO CC(C)C[C@H]1COCC[N@@H+]1Cc1ccc(C(F)(F)F)s1 ZINC000432748152 338166120 /nfs/dbraw/zinc/16/61/20/338166120.db2.gz BFFKWDSQKCLBLS-NSHDSACASA-N 1 2 307.381 4.014 20 0 DIADLO CC(C)C[C@H]1COCC[N@H+]1Cc1ccc(C(F)(F)F)s1 ZINC000432748152 338166121 /nfs/dbraw/zinc/16/61/21/338166121.db2.gz BFFKWDSQKCLBLS-NSHDSACASA-N 1 2 307.381 4.014 20 0 DIADLO CN(Cc1cn2c([nH+]1)CCCC2)Cc1ccc(-c2ccccc2)o1 ZINC000432794010 338168084 /nfs/dbraw/zinc/16/80/84/338168084.db2.gz RKARDJQRTYEBHL-UHFFFAOYSA-N 1 2 321.424 4.111 20 0 DIADLO C[N@@H+](Cc1cn2c(n1)CCCC2)Cc1ccc(-c2ccccc2)o1 ZINC000432794010 338168085 /nfs/dbraw/zinc/16/80/85/338168085.db2.gz RKARDJQRTYEBHL-UHFFFAOYSA-N 1 2 321.424 4.111 20 0 DIADLO C[N@H+](Cc1cn2c(n1)CCCC2)Cc1ccc(-c2ccccc2)o1 ZINC000432794010 338168086 /nfs/dbraw/zinc/16/80/86/338168086.db2.gz RKARDJQRTYEBHL-UHFFFAOYSA-N 1 2 321.424 4.111 20 0 DIADLO CCc1oc2ccccc2c1CN(C)Cc1cn2c([nH+]1)CCCC2 ZINC000432800427 338168406 /nfs/dbraw/zinc/16/84/06/338168406.db2.gz NDFACPWVAPGIQY-UHFFFAOYSA-N 1 2 323.440 4.160 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432915187 338172735 /nfs/dbraw/zinc/17/27/35/338172735.db2.gz DFKDLOHHPCCFDH-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432915187 338172736 /nfs/dbraw/zinc/17/27/36/338172736.db2.gz DFKDLOHHPCCFDH-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO COC(=O)c1cc([C@@H](C)[N@H+](C)Cc2ccccc2Cl)oc1C ZINC000432927833 338173635 /nfs/dbraw/zinc/17/36/35/338173635.db2.gz OPUBLZOAXLSTLB-LLVKDONJSA-N 1 2 321.804 4.221 20 0 DIADLO COC(=O)c1cc([C@@H](C)[N@@H+](C)Cc2ccccc2Cl)oc1C ZINC000432927833 338173636 /nfs/dbraw/zinc/17/36/36/338173636.db2.gz OPUBLZOAXLSTLB-LLVKDONJSA-N 1 2 321.804 4.221 20 0 DIADLO FC(F)[C@H]([NH2+]CCCOCc1ccccc1)c1ccccc1 ZINC000433044949 338178169 /nfs/dbraw/zinc/17/81/69/338178169.db2.gz LCQXCWAOSBDXNM-QGZVFWFLSA-N 1 2 305.368 4.189 20 0 DIADLO C[C@@H]([NH2+][C@@H](CCc1ccccc1)C(F)F)c1cccc(O)c1 ZINC000433049647 338178606 /nfs/dbraw/zinc/17/86/06/338178606.db2.gz WUMPWKZWOSBJKD-DYVFJYSZSA-N 1 2 305.368 4.309 20 0 DIADLO COC(=O)c1cc([C@@H](C)[N@H+](C)Cc2cc(C)ccc2F)oc1C ZINC000433202399 338185799 /nfs/dbraw/zinc/18/57/99/338185799.db2.gz QHNNFZIPKONNIB-GFCCVEGCSA-N 1 2 319.376 4.015 20 0 DIADLO COC(=O)c1cc([C@@H](C)[N@@H+](C)Cc2cc(C)ccc2F)oc1C ZINC000433202399 338185800 /nfs/dbraw/zinc/18/58/00/338185800.db2.gz QHNNFZIPKONNIB-GFCCVEGCSA-N 1 2 319.376 4.015 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)no1 ZINC000433291199 338189605 /nfs/dbraw/zinc/18/96/05/338189605.db2.gz VCPPKGPXPZEYEY-CYBMUJFWSA-N 1 2 319.836 4.010 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)no1 ZINC000433291199 338189606 /nfs/dbraw/zinc/18/96/06/338189606.db2.gz VCPPKGPXPZEYEY-CYBMUJFWSA-N 1 2 319.836 4.010 20 0 DIADLO Cc1nc([C@](C)([NH2+]Cc2ccc(C(C)(C)C)cc2)C2CC2)no1 ZINC000433292185 338189747 /nfs/dbraw/zinc/18/97/47/338189747.db2.gz WMSUWGOQTCMXCD-LJQANCHMSA-N 1 2 313.445 4.091 20 0 DIADLO FC(F)(F)c1cnc(C[NH2+][C@@H]2CSc3ccccc32)s1 ZINC000433324689 338192294 /nfs/dbraw/zinc/19/22/94/338192294.db2.gz FOCKTSKWPMBOMB-SECBINFHSA-N 1 2 316.373 4.099 20 0 DIADLO CC[C@](C)([NH2+]Cc1ncc(C(F)(F)F)s1)c1nccs1 ZINC000433326798 338192732 /nfs/dbraw/zinc/19/27/32/338192732.db2.gz MJUPTOYPQUTGCD-NSHDSACASA-N 1 2 321.393 4.033 20 0 DIADLO CCC(CC)n1ccc(CSc2[nH+]cc3ccccn32)n1 ZINC000433379453 338194304 /nfs/dbraw/zinc/19/43/04/338194304.db2.gz YZOXKVWSCPUIAF-UHFFFAOYSA-N 1 2 300.431 4.184 20 0 DIADLO COC[C@H]1CCCCN(c2cc(C(C)(C)C)[nH+]c(C(C)C)n2)C1 ZINC000433762835 338200959 /nfs/dbraw/zinc/20/09/59/338200959.db2.gz BHIIYOUJUMAHMU-HNNXBMFYSA-N 1 2 319.493 4.150 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@@H]2CCSc3ccc(F)cc32)[nH+]1 ZINC000433763399 338200991 /nfs/dbraw/zinc/20/09/91/338200991.db2.gz ASRDIYUHJOXUGK-CYBMUJFWSA-N 1 2 314.389 4.054 20 0 DIADLO Cc1nc2[nH]ccc2c(N2CCC[C@@H]2c2ccccc2Cl)[nH+]1 ZINC000433773456 338201285 /nfs/dbraw/zinc/20/12/85/338201285.db2.gz IIPVBBVSQGXXLX-OAHLLOKOSA-N 1 2 312.804 4.261 20 0 DIADLO COc1cccc2c(N3CC[C@H](CC(F)(F)F)C3)cc[nH+]c12 ZINC000433807648 338202538 /nfs/dbraw/zinc/20/25/38/338202538.db2.gz JOVGAYXZRVYATB-LLVKDONJSA-N 1 2 310.319 4.022 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CC[C@@H](CC(F)(F)F)C1 ZINC000433813906 338202685 /nfs/dbraw/zinc/20/26/85/338202685.db2.gz FZJUNVJLSHGMSE-LBPRGKRZSA-N 1 2 324.346 4.331 20 0 DIADLO CC(C)[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000434621534 338221259 /nfs/dbraw/zinc/22/12/59/338221259.db2.gz UKGFZMHDWIURTC-INIZCTEOSA-N 1 2 319.424 4.335 20 0 DIADLO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000434621534 338221260 /nfs/dbraw/zinc/22/12/60/338221260.db2.gz UKGFZMHDWIURTC-INIZCTEOSA-N 1 2 319.424 4.335 20 0 DIADLO CCCCc1nc(C[N@H+](C)[C@H](c2ccc(F)cc2)C(C)C)no1 ZINC000434622246 338221464 /nfs/dbraw/zinc/22/14/64/338221464.db2.gz CAFAJWUBMZZJSP-SFHVURJKSA-N 1 2 319.424 4.380 20 0 DIADLO CCCCc1nc(C[N@@H+](C)[C@H](c2ccc(F)cc2)C(C)C)no1 ZINC000434622246 338221465 /nfs/dbraw/zinc/22/14/65/338221465.db2.gz CAFAJWUBMZZJSP-SFHVURJKSA-N 1 2 319.424 4.380 20 0 DIADLO CCCC(CCC)[S@@](=O)Cc1[nH+]ccn1-c1ccccc1 ZINC000434637199 338222271 /nfs/dbraw/zinc/22/22/71/338222271.db2.gz MGEASHKGKDGVDS-NRFANRHFSA-N 1 2 304.459 4.090 20 0 DIADLO Cc1ccc(OC(F)F)c([C@@H](C)[NH2+][C@@H](C)c2nccs2)c1 ZINC000153334932 338222552 /nfs/dbraw/zinc/22/25/52/338222552.db2.gz YTHAHGPILDRBOP-MNOVXSKESA-N 1 2 312.385 4.465 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1ccc(F)cc1OC(F)F ZINC000153416742 338224042 /nfs/dbraw/zinc/22/40/42/338224042.db2.gz QRIZUFNSSYZVOK-BDAKNGLRSA-N 1 2 316.348 4.295 20 0 DIADLO CC(C)C[C@@H]1CCC[N@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC000435128210 338232736 /nfs/dbraw/zinc/23/27/36/338232736.db2.gz GCRAOZOHWDWBOF-NSHDSACASA-N 1 2 306.397 4.420 20 0 DIADLO CC(C)C[C@@H]1CCC[N@@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC000435128210 338232737 /nfs/dbraw/zinc/23/27/37/338232737.db2.gz GCRAOZOHWDWBOF-NSHDSACASA-N 1 2 306.397 4.420 20 0 DIADLO Clc1cccc(-c2ccc(C[NH+]3CCOCC3)o2)c1Cl ZINC000435241971 338235105 /nfs/dbraw/zinc/23/51/05/338235105.db2.gz JAKJXROPOLYEHP-UHFFFAOYSA-N 1 2 312.196 4.086 20 0 DIADLO O=C(Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)[C@H]1CC=CCC1 ZINC000436171001 338260458 /nfs/dbraw/zinc/26/04/58/338260458.db2.gz NDOLLODWDXXJDA-HNNXBMFYSA-N 1 2 321.424 4.181 20 0 DIADLO CC(C)(C)CC(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436184178 338260981 /nfs/dbraw/zinc/26/09/81/338260981.db2.gz TWUPSBSQQQLONQ-UHFFFAOYSA-N 1 2 311.429 4.261 20 0 DIADLO CC[C@@H](C)CC(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436193108 338261399 /nfs/dbraw/zinc/26/13/99/338261399.db2.gz WKQSIXAGHGBLGY-CQSZACIVSA-N 1 2 311.429 4.261 20 0 DIADLO COCCC1(C[NH2+]c2ccc(-n3ccnc3)cc2)CCCCC1 ZINC000436279284 338265285 /nfs/dbraw/zinc/26/52/85/338265285.db2.gz GXYFUBCWJOHWFW-UHFFFAOYSA-N 1 2 313.445 4.271 20 0 DIADLO FCC[NH2+][C@@H](c1ccccc1)c1ccccc1Br ZINC000436305756 338268067 /nfs/dbraw/zinc/26/80/67/338268067.db2.gz HENWQWDWDJXYHR-HNNXBMFYSA-N 1 2 308.194 4.098 20 0 DIADLO Cc1cc(C)c(NC(=O)NCCc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000436494196 338274170 /nfs/dbraw/zinc/27/41/70/338274170.db2.gz MXNYGHXSMOVQOG-UHFFFAOYSA-N 1 2 317.820 4.024 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCc3ccccc3[C@@H]2C)c(C)[nH+]1 ZINC000436493546 338274196 /nfs/dbraw/zinc/27/41/96/338274196.db2.gz LXZDBDCMYCUGHU-HNNXBMFYSA-N 1 2 309.413 4.158 20 0 DIADLO Cc1ccc(CN(C)C(=O)Nc2c(C)cc(C)[nH+]c2C)s1 ZINC000436495844 338274287 /nfs/dbraw/zinc/27/42/87/338274287.db2.gz PGMZUKULIKFNPS-UHFFFAOYSA-N 1 2 303.431 4.041 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H]2c2cccs2)c(C)[nH+]1 ZINC000436494711 338274325 /nfs/dbraw/zinc/27/43/25/338274325.db2.gz NOPAYCIOIYXUOH-CQSZACIVSA-N 1 2 315.442 4.437 20 0 DIADLO CSc1cccc(NC(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000436499577 338274450 /nfs/dbraw/zinc/27/44/50/338274450.db2.gz XPJINPZITPSQTG-UHFFFAOYSA-N 1 2 301.415 4.373 20 0 DIADLO Cc1[nH]ncc1C[N@H+](Cc1ccccc1)[C@@H](C)c1ccccc1 ZINC000436655174 338281691 /nfs/dbraw/zinc/28/16/91/338281691.db2.gz ZFRBBUMCUTZTKO-KRWDZBQOSA-N 1 2 305.425 4.482 20 0 DIADLO Cc1[nH]ncc1C[N@@H+](Cc1ccccc1)[C@@H](C)c1ccccc1 ZINC000436655174 338281692 /nfs/dbraw/zinc/28/16/92/338281692.db2.gz ZFRBBUMCUTZTKO-KRWDZBQOSA-N 1 2 305.425 4.482 20 0 DIADLO COc1cnccc1[C@@H](C)[NH2+][C@@H](CCc1ccccc1)C(F)F ZINC000437087405 338300236 /nfs/dbraw/zinc/30/02/36/338300236.db2.gz IZDLBOFEARGKCL-CJNGLKHVSA-N 1 2 320.383 4.007 20 0 DIADLO COc1cnccc1[C@@H](C)[NH2+][C@H](CCc1ccccc1)C(F)F ZINC000437087408 338300242 /nfs/dbraw/zinc/30/02/42/338300242.db2.gz IZDLBOFEARGKCL-CZUORRHYSA-N 1 2 320.383 4.007 20 0 DIADLO CCc1ccc(CSCc2[nH+]ccn2CC(F)(F)F)cc1 ZINC000437264658 338305173 /nfs/dbraw/zinc/30/51/73/338305173.db2.gz GDDQNCYGIUVLFY-UHFFFAOYSA-N 1 2 314.376 4.441 20 0 DIADLO C[C@@H](SCc1[nH+]ccn1CC(F)(F)F)c1ccccc1 ZINC000437265674 338305181 /nfs/dbraw/zinc/30/51/81/338305181.db2.gz INWJIGBHSCVSGP-LLVKDONJSA-N 1 2 300.349 4.440 20 0 DIADLO Cc1cccc(CSCc2[nH+]ccn2CC(F)(F)F)c1 ZINC000437278356 338305876 /nfs/dbraw/zinc/30/58/76/338305876.db2.gz UDPQBMPJRKTRDH-UHFFFAOYSA-N 1 2 300.349 4.187 20 0 DIADLO CCCC[N@H+](Cc1c(Cl)cnn1C)Cc1ccccc1F ZINC000437587726 338315000 /nfs/dbraw/zinc/31/50/00/338315000.db2.gz HBRCYAVUWVJXTN-UHFFFAOYSA-N 1 2 309.816 4.015 20 0 DIADLO CCCC[N@@H+](Cc1c(Cl)cnn1C)Cc1ccccc1F ZINC000437587726 338315001 /nfs/dbraw/zinc/31/50/01/338315001.db2.gz HBRCYAVUWVJXTN-UHFFFAOYSA-N 1 2 309.816 4.015 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1COc1cccc2ncccc21 ZINC000437639338 338317002 /nfs/dbraw/zinc/31/70/02/338317002.db2.gz YFCHVIQQWMRZGJ-UHFFFAOYSA-N 1 2 315.376 4.059 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3c(cccc3F)[nH]2)C[C@H](c2ccccc2)O1 ZINC000437683929 338318179 /nfs/dbraw/zinc/31/81/79/338318179.db2.gz BONGLHZJOTZHFU-VBKZILBWSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3c(cccc3F)[nH]2)C[C@H](c2ccccc2)O1 ZINC000437683929 338318180 /nfs/dbraw/zinc/31/81/80/338318180.db2.gz BONGLHZJOTZHFU-VBKZILBWSA-N 1 2 324.399 4.269 20 0 DIADLO Fc1ccc(-c2ccc(C[N@@H+]3CCC[C@H]3c3ncc[nH]3)o2)cc1 ZINC000437955478 338326171 /nfs/dbraw/zinc/32/61/71/338326171.db2.gz MXXHJRPZIVQMKH-INIZCTEOSA-N 1 2 311.360 4.146 20 0 DIADLO Fc1ccc(-c2ccc(C[N@H+]3CCC[C@H]3c3ncc[nH]3)o2)cc1 ZINC000437955478 338326172 /nfs/dbraw/zinc/32/61/72/338326172.db2.gz MXXHJRPZIVQMKH-INIZCTEOSA-N 1 2 311.360 4.146 20 0 DIADLO Fc1ccccc1-c1ccc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)o1 ZINC000437995395 338327843 /nfs/dbraw/zinc/32/78/43/338327843.db2.gz RGDFKPQCLWKBDS-INIZCTEOSA-N 1 2 311.360 4.146 20 0 DIADLO Fc1ccccc1-c1ccc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)o1 ZINC000437995395 338327844 /nfs/dbraw/zinc/32/78/44/338327844.db2.gz RGDFKPQCLWKBDS-INIZCTEOSA-N 1 2 311.360 4.146 20 0 DIADLO Fc1cc(Cl)ccc1CNc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000438085758 338330502 /nfs/dbraw/zinc/33/05/02/338330502.db2.gz DRIUMQVMHWCYJB-UHFFFAOYSA-N 1 2 319.742 4.416 20 0 DIADLO CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000438135008 338333914 /nfs/dbraw/zinc/33/39/14/338333914.db2.gz UTSTWYYMDBRQNS-XJKSGUPXSA-N 1 2 314.433 4.075 20 0 DIADLO C[C@@H](c1noc([C@H]2CCC[N@@H+]2Cc2ccc(F)cc2)n1)C1CC1 ZINC000438241119 338337751 /nfs/dbraw/zinc/33/77/51/338337751.db2.gz QNNVUNBYZPUUOG-MLGOLLRUSA-N 1 2 315.392 4.059 20 0 DIADLO C[C@@H](c1noc([C@H]2CCC[N@H+]2Cc2ccc(F)cc2)n1)C1CC1 ZINC000438241119 338337752 /nfs/dbraw/zinc/33/77/52/338337752.db2.gz QNNVUNBYZPUUOG-MLGOLLRUSA-N 1 2 315.392 4.059 20 0 DIADLO Clc1ccc2[nH]c([C@H]3CCC[N@@H+]3Cc3cncs3)nc2c1 ZINC000438259578 338337990 /nfs/dbraw/zinc/33/79/90/338337990.db2.gz MYKFCWHPFGMOBC-CQSZACIVSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1ccc2[nH]c([C@H]3CCC[N@H+]3Cc3cncs3)nc2c1 ZINC000438259578 338337991 /nfs/dbraw/zinc/33/79/91/338337991.db2.gz MYKFCWHPFGMOBC-CQSZACIVSA-N 1 2 318.833 4.010 20 0 DIADLO FC(F)c1cccc(NCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000438289214 338338679 /nfs/dbraw/zinc/33/86/79/338338679.db2.gz CHCAIIJBUQUFTO-UHFFFAOYSA-N 1 2 313.351 4.481 20 0 DIADLO CO[C@H](C)c1cccc(NCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000438298829 338339012 /nfs/dbraw/zinc/33/90/12/338339012.db2.gz KPUNFTCFYXWQFN-MRXNPFEDSA-N 1 2 321.424 4.251 20 0 DIADLO Fc1cc(Cl)ccc1OCc1c[nH+]cn1Cc1ccccc1 ZINC000438314375 338339380 /nfs/dbraw/zinc/33/93/80/338339380.db2.gz OYTLCLBCUWGOAP-UHFFFAOYSA-N 1 2 316.763 4.303 20 0 DIADLO CC(C)Oc1cccc(OCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000438324764 338339796 /nfs/dbraw/zinc/33/97/96/338339796.db2.gz SQXNUGMNFJESOU-UHFFFAOYSA-N 1 2 322.408 4.298 20 0 DIADLO COc1c(C)ccc(NCc2c[nH+]cn2Cc2ccccc2)c1C ZINC000438331885 338339859 /nfs/dbraw/zinc/33/98/59/338339859.db2.gz ZECSICLVNIXIEM-UHFFFAOYSA-N 1 2 321.424 4.169 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H]1CCOc2c(F)cccc21 ZINC000438463605 338344576 /nfs/dbraw/zinc/34/45/76/338344576.db2.gz DFYGJJYSBNJTCF-OAHLLOKOSA-N 1 2 321.779 4.101 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@@H](c3cccc(F)c3)C2)s1 ZINC000438854806 338354030 /nfs/dbraw/zinc/35/40/30/338354030.db2.gz XEGRNMZDTHLMPV-OAHLLOKOSA-N 1 2 323.458 4.183 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@@H](c3cccc(F)c3)C2)s1 ZINC000438854806 338354031 /nfs/dbraw/zinc/35/40/31/338354031.db2.gz XEGRNMZDTHLMPV-OAHLLOKOSA-N 1 2 323.458 4.183 20 0 DIADLO Cc1cc(C[NH+]2CCC(F)(c3cccc(Cl)c3)CC2)no1 ZINC000439323742 338367186 /nfs/dbraw/zinc/36/71/86/338367186.db2.gz GDSCTVUMOMLLDI-UHFFFAOYSA-N 1 2 308.784 4.097 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2csc(C3CCCCC3)n2)CCCO1 ZINC000439480795 338371252 /nfs/dbraw/zinc/37/12/52/338371252.db2.gz FRMPUXOJEYRTPH-MRXNPFEDSA-N 1 2 308.491 4.192 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2csc(C3CCCCC3)n2)CCCO1 ZINC000439480795 338371253 /nfs/dbraw/zinc/37/12/53/338371253.db2.gz FRMPUXOJEYRTPH-MRXNPFEDSA-N 1 2 308.491 4.192 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+]Cc2nc(CCC(C)C)no2)cc1 ZINC000439492999 338371825 /nfs/dbraw/zinc/37/18/25/338371825.db2.gz LOPKAIQYJRTXEV-CYBMUJFWSA-N 1 2 319.474 4.231 20 0 DIADLO c1c(CSCc2cn3ccccc3[nH+]2)onc1-c1ccccc1 ZINC000439536181 338372607 /nfs/dbraw/zinc/37/26/07/338372607.db2.gz LMCFIOBITLWMJX-UHFFFAOYSA-N 1 2 321.405 4.423 20 0 DIADLO CCC[C@@H]([NH2+][C@H](C)c1ccc(C(F)(F)F)cc1)C(=O)OCC ZINC000439545592 338372861 /nfs/dbraw/zinc/37/28/61/338372861.db2.gz HQLOANJXVFPRBP-BXUZGUMPSA-N 1 2 317.351 4.088 20 0 DIADLO CCC(CC)n1ccc(C[NH2+]C(C)(C)c2nc(C)c(C)s2)n1 ZINC000440366675 338386226 /nfs/dbraw/zinc/38/62/26/338386226.db2.gz LJXMFFSHKXUWKD-UHFFFAOYSA-N 1 2 320.506 4.342 20 0 DIADLO CC(C)c1ncc(C[N@H+](C)Cc2cc(F)ccc2Cl)cn1 ZINC000440476365 338388048 /nfs/dbraw/zinc/38/80/48/338388048.db2.gz IDMNNPMUMLHGIU-UHFFFAOYSA-N 1 2 307.800 4.025 20 0 DIADLO CC(C)c1ncc(C[N@@H+](C)Cc2cc(F)ccc2Cl)cn1 ZINC000440476365 338388049 /nfs/dbraw/zinc/38/80/49/338388049.db2.gz IDMNNPMUMLHGIU-UHFFFAOYSA-N 1 2 307.800 4.025 20 0 DIADLO CC[C@H](Nc1ncnc2sc3ccccc3c21)c1[nH]cc[nH+]1 ZINC000440659018 338394638 /nfs/dbraw/zinc/39/46/38/338394638.db2.gz DWPGRINCKSDACW-NSHDSACASA-N 1 2 309.398 4.131 20 0 DIADLO CC[C@@H](F)C[N@@H+]1CCCC[C@H]1c1nc(-c2ccccc2)no1 ZINC000440690703 338395290 /nfs/dbraw/zinc/39/52/90/338395290.db2.gz DEPSYOPTIUYVDQ-CABCVRRESA-N 1 2 303.381 4.012 20 0 DIADLO CC[C@@H](F)C[N@H+]1CCCC[C@H]1c1nc(-c2ccccc2)no1 ZINC000440690703 338395291 /nfs/dbraw/zinc/39/52/91/338395291.db2.gz DEPSYOPTIUYVDQ-CABCVRRESA-N 1 2 303.381 4.012 20 0 DIADLO CC[C@H](F)C[N@@H+]1CCC[C@@H]1c1nc(-c2ccc(F)cc2)c[nH]1 ZINC000440785578 338397415 /nfs/dbraw/zinc/39/74/15/338397415.db2.gz PRPYYNGSPBGWEF-XJKSGUPXSA-N 1 2 305.372 4.101 20 0 DIADLO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1nc(-c2ccc(F)cc2)c[nH]1 ZINC000440785578 338397416 /nfs/dbraw/zinc/39/74/16/338397416.db2.gz PRPYYNGSPBGWEF-XJKSGUPXSA-N 1 2 305.372 4.101 20 0 DIADLO CCCCCC(=O)N(Cc1[nH]cc[nH+]1)c1cc(C)ccc1Cl ZINC000440901049 338399635 /nfs/dbraw/zinc/39/96/35/338399635.db2.gz CIYZNWATNWNHFW-UHFFFAOYSA-N 1 2 319.836 4.485 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](CC(=O)Nc1cccc(Cl)c1)C1CC1 ZINC000440902111 338399684 /nfs/dbraw/zinc/39/96/84/338399684.db2.gz HTLJZIBHQXOUTQ-LBPRGKRZSA-N 1 2 318.804 4.097 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](CC(=O)Nc1cccc(Cl)c1)C1CC1 ZINC000440902111 338399685 /nfs/dbraw/zinc/39/96/85/338399685.db2.gz HTLJZIBHQXOUTQ-LBPRGKRZSA-N 1 2 318.804 4.097 20 0 DIADLO COc1cc(Cl)c(C[NH2+][C@@H](C)c2nccs2)cc1Cl ZINC000157273605 338419199 /nfs/dbraw/zinc/41/91/99/338419199.db2.gz URIFSLALNCZWQQ-QMMMGPOBSA-N 1 2 317.241 4.309 20 0 DIADLO Cc1ccc2c(CCC(=O)Nc3ccc(C)[nH+]c3C)c[nH]c2c1 ZINC000446417700 338527679 /nfs/dbraw/zinc/52/76/79/338527679.db2.gz AYOJRWAGKABEIY-UHFFFAOYSA-N 1 2 307.397 4.059 20 0 DIADLO CCCN(CC)c1ccc(C(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000446424699 338527749 /nfs/dbraw/zinc/52/77/49/338527749.db2.gz MKYKTOZGWAGEFP-UHFFFAOYSA-N 1 2 311.429 4.187 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(OCCC(C)C)cc2)c(C)[nH+]1 ZINC000446422924 338527796 /nfs/dbraw/zinc/52/77/96/338527796.db2.gz AICRSHPJFYUPDC-UHFFFAOYSA-N 1 2 312.413 4.376 20 0 DIADLO Cc1ccc(NC(=O)CCCOc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000446440410 338528082 /nfs/dbraw/zinc/52/80/82/338528082.db2.gz GYKKHUXJKSWISI-UHFFFAOYSA-N 1 2 318.804 4.150 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](Sc2ccccc2)C(C)C)c(C)[nH+]1 ZINC000446439189 338528094 /nfs/dbraw/zinc/52/80/94/338528094.db2.gz VQTLVBRFPALWTG-KRWDZBQOSA-N 1 2 314.454 4.454 20 0 DIADLO Cc1c(C(=O)Nc2ccc(C)[nH+]c2C)sc2nccc(C)c12 ZINC000446437694 338528111 /nfs/dbraw/zinc/52/81/11/338528111.db2.gz BYSNUSQRVIKSLE-UHFFFAOYSA-N 1 2 311.410 4.177 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(C(F)F)n1)c1ccc(Cl)cc1Cl ZINC000446844100 338538072 /nfs/dbraw/zinc/53/80/72/338538072.db2.gz RJYVJDDRLZJCJL-QMMMGPOBSA-N 1 2 320.170 4.436 20 0 DIADLO O=[S@](Cc1cn2ccccc2[nH+]1)Cc1ccc(C2CCC2)cc1 ZINC000447122930 338545981 /nfs/dbraw/zinc/54/59/81/338545981.db2.gz WJJFJJSHKSNHJJ-QHCPKHFHSA-N 1 2 324.449 4.051 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccccc2)c[nH]1)c1c(F)cccc1F ZINC000447829053 338568273 /nfs/dbraw/zinc/56/82/73/338568273.db2.gz GZSKZLFPLBVXOU-LBPRGKRZSA-N 1 2 313.351 4.206 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1nc(-c2ccccc2)c[nH]1 ZINC000447855797 338569389 /nfs/dbraw/zinc/56/93/89/338569389.db2.gz UZUPMXDWTDOBRK-UHFFFAOYSA-N 1 2 315.779 4.159 20 0 DIADLO c1[nH]c(C[NH2+][C@@H]2CSc3ccccc32)nc1-c1ccccc1 ZINC000447855469 338569523 /nfs/dbraw/zinc/56/95/23/338569523.db2.gz RIIZETMHCFOYAM-MRXNPFEDSA-N 1 2 307.422 4.013 20 0 DIADLO COC[C@@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1ccc(F)cc1 ZINC000447939779 338572079 /nfs/dbraw/zinc/57/20/79/338572079.db2.gz GUKKHZJIBRLPAI-CQSZACIVSA-N 1 2 322.449 4.057 20 0 DIADLO C[C@@H]1CSC[C@H]1Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000449047552 338587777 /nfs/dbraw/zinc/58/77/77/338587777.db2.gz BZQYKJSJCPPLML-CXAGYDPISA-N 1 2 313.470 4.050 20 0 DIADLO C[C@@H]1CSC[C@H]1Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000449051387 338588266 /nfs/dbraw/zinc/58/82/66/338588266.db2.gz UQTGNPUACSXJDG-CXAGYDPISA-N 1 2 313.470 4.050 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cnc(-c3ccccc3F)s2)o1 ZINC000449224972 338604178 /nfs/dbraw/zinc/60/41/78/338604178.db2.gz IZUKBYSLANHCGE-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ccc2[nH]c(CN3CC(C)(C)[C@H]3c3[nH+]ccn3C)cc2c1C ZINC000449415872 338622497 /nfs/dbraw/zinc/62/24/97/338622497.db2.gz QWYBPJDQSGPJKX-GOSISDBHSA-N 1 2 322.456 4.101 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H]3C[C@H](C)n4ccnc43)cs2)cc1 ZINC000449572822 338639094 /nfs/dbraw/zinc/63/90/94/338639094.db2.gz OFEWEVXSNFNBBV-BBRMVZONSA-N 1 2 324.453 4.111 20 0 DIADLO COc1ccc([C@@H]([NH2+][C@@H](C)c2cc(C)ccn2)c2ccco2)cc1 ZINC000449783191 338652936 /nfs/dbraw/zinc/65/29/36/338652936.db2.gz ZZROKEPAJCWDIP-MGPUTAFESA-N 1 2 322.408 4.432 20 0 DIADLO CC(C)CC(CC(C)C)C(=O)N1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000450110146 338667560 /nfs/dbraw/zinc/66/75/60/338667560.db2.gz DJESCOHOEJMNSE-SJLPKXTDSA-N 1 2 319.493 4.001 20 0 DIADLO CS[C@H]1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C1 ZINC000450687633 338699181 /nfs/dbraw/zinc/69/91/81/338699181.db2.gz WWYCUOOQWSLESH-LBPRGKRZSA-N 1 2 312.360 4.195 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C)c1csnn1 ZINC000450692572 338699499 /nfs/dbraw/zinc/69/94/99/338699499.db2.gz KWLDSRSHFYVHRJ-UOJCWERNSA-N 1 2 307.850 4.239 20 0 DIADLO CO[C@H]1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C[C@H]1C ZINC000450769568 338704676 /nfs/dbraw/zinc/70/46/76/338704676.db2.gz WLWKWTJHUFZHEI-ABAIWWIYSA-N 1 2 324.346 4.115 20 0 DIADLO Fc1ccc2cc[nH+]c(N[C@@H]3CCO[C@@H](c4cccnc4)C3)c2c1 ZINC000450795421 338705896 /nfs/dbraw/zinc/70/58/96/338705896.db2.gz OBSZAGACRFZQEM-SJLPKXTDSA-N 1 2 323.371 4.101 20 0 DIADLO C[C@H]1C[C@@H](Nc2ncc(C(F)(F)F)cc2Cl)c2[nH+]ccn21 ZINC000450832153 338707527 /nfs/dbraw/zinc/70/75/27/338707527.db2.gz QRUQHWUULHGSHF-OIBJUYFYSA-N 1 2 316.714 4.068 20 0 DIADLO Cc1cc(N2CCC[C@@H]2c2ccc(F)cc2F)nc(C2CC2)[nH+]1 ZINC000450914300 338712192 /nfs/dbraw/zinc/71/21/92/338712192.db2.gz PNIHIGZBXYSWOH-MRXNPFEDSA-N 1 2 315.367 4.282 20 0 DIADLO C[C@H]1C[C@@]1([NH2+]Cc1nnc(C2CC2)s1)c1ccc(Cl)cc1 ZINC000450929643 338712923 /nfs/dbraw/zinc/71/29/23/338712923.db2.gz VBGJJQXDXCLIPI-QFYYESIMSA-N 1 2 319.861 4.094 20 0 DIADLO C[C@H](c1csnn1)[NH+]1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000450974880 338715209 /nfs/dbraw/zinc/71/52/09/338715209.db2.gz NMKZQFWFMQVEJU-BDJLRTHQSA-N 1 2 323.412 4.161 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)ccc1F ZINC000451163157 338723800 /nfs/dbraw/zinc/72/38/00/338723800.db2.gz QQSVXZPZGLLPSZ-VXGBXAGGSA-N 1 2 305.397 4.226 20 0 DIADLO CC/C(C)=C/c1nc(Cn2c3ccccc3[nH+]c2C(C)C)no1 ZINC000453176286 338802875 /nfs/dbraw/zinc/80/28/75/338802875.db2.gz LTFCWYVSZSRTFD-JLHYYAGUSA-N 1 2 310.401 4.404 20 0 DIADLO C[C@@H]1CC[C@@H]([NH2+]Cc2ncn(-c3ccccc3)n2)c2sccc21 ZINC000453214594 338808898 /nfs/dbraw/zinc/80/88/98/338808898.db2.gz BWKVIIAHSHCKPI-CZUORRHYSA-N 1 2 324.453 4.057 20 0 DIADLO Cc1ccc[nH+]c1CCc1noc(CC[C@H](C)c2ccccc2)n1 ZINC000453216366 338809104 /nfs/dbraw/zinc/80/91/04/338809104.db2.gz DOYOKGWNUGTKPO-HNNXBMFYSA-N 1 2 321.424 4.295 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1sc(-c2cccnc2)nc1C)C(F)F ZINC000453233120 338811672 /nfs/dbraw/zinc/81/16/72/338811672.db2.gz HDPUXYYVAIIMDI-JOYOIKCWSA-N 1 2 311.401 4.208 20 0 DIADLO Cc1c([C@@H](C)[NH2+][C@@H](C)C(C)(F)F)cnn1-c1ccc(F)cc1 ZINC000453274888 338817317 /nfs/dbraw/zinc/81/73/17/338817317.db2.gz BHZQFSQXHDERSH-PWSUYJOCSA-N 1 2 311.351 4.014 20 0 DIADLO Cc1cc2c(cc1C)[C@H]([NH2+]Cc1nn(C)cc1Cl)CCS2 ZINC000453309188 338822196 /nfs/dbraw/zinc/82/21/96/338822196.db2.gz DIALOAWHALDDIW-CQSZACIVSA-N 1 2 321.877 4.017 20 0 DIADLO CC(C)[C@@H]1C[C@@H]([NH2+]Cc2nn(C)cc2Cl)c2ccccc21 ZINC000453309900 338822271 /nfs/dbraw/zinc/82/22/71/338822271.db2.gz FARCKCWSCTZDPB-GOEBONIOSA-N 1 2 303.837 4.048 20 0 DIADLO CC(C)Sc1ccc([C@@H](C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000453314647 338823018 /nfs/dbraw/zinc/82/30/18/338823018.db2.gz FVNBAFPOWFPDFM-GFCCVEGCSA-N 1 2 323.893 4.425 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1cc2ccccc2o1 ZINC000453316143 338823521 /nfs/dbraw/zinc/82/35/21/338823521.db2.gz HZSHHAWCRLIUHC-QGZVFWFLSA-N 1 2 317.820 4.307 20 0 DIADLO CC(C)Cc1cccc([C@H](C)[NH2+]Cc2nn(C)cc2Cl)c1 ZINC000453319006 338824051 /nfs/dbraw/zinc/82/40/51/338824051.db2.gz MUZQOWUNFCSGAQ-ZDUSSCGKSA-N 1 2 305.853 4.123 20 0 DIADLO CC[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1cccc(Cl)c1F ZINC000453332480 338826215 /nfs/dbraw/zinc/82/62/15/338826215.db2.gz AQUFIGRBNIUNOL-BPNCWPANSA-N 1 2 307.800 4.422 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncccc1OC)c1cccc(Cl)c1F ZINC000453349504 338829316 /nfs/dbraw/zinc/82/93/16/338829316.db2.gz DBTFEJHGTSZDPW-CYBMUJFWSA-N 1 2 308.784 4.124 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)NC(=O)Nc1ccccc1C(C)(C)C ZINC000454209261 338857415 /nfs/dbraw/zinc/85/74/15/338857415.db2.gz SDBMLZKNQZDULF-ZDUSSCGKSA-N 1 2 314.433 4.083 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@H](c3ccccc3C)C2)c(C)[nH+]1 ZINC000455464515 338895239 /nfs/dbraw/zinc/89/52/39/338895239.db2.gz DQQNRBLNTORYFK-QGZVFWFLSA-N 1 2 323.440 4.337 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@H](C(C)C)CC2)c(C)[nH+]1 ZINC000455468105 338895344 /nfs/dbraw/zinc/89/53/44/338895344.db2.gz GXWHYLKDCICDSS-INIZCTEOSA-N 1 2 303.450 4.297 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC(C)(C)CC(C)(C)C2)c(C)[nH+]1 ZINC000455471004 338895459 /nfs/dbraw/zinc/89/54/59/338895459.db2.gz BGBNMMRXEUDIBC-UHFFFAOYSA-N 1 2 303.450 4.297 20 0 DIADLO CC[C@H]1Cc2ccccc2CN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455472954 338895631 /nfs/dbraw/zinc/89/56/31/338895631.db2.gz BUIWDRNIRXJTSX-SFHVURJKSA-N 1 2 323.440 4.376 20 0 DIADLO Cc1cc(C)c(NC(=O)NCCc2ccccc2Cl)c(C)[nH+]1 ZINC000455476125 338895683 /nfs/dbraw/zinc/89/56/83/338895683.db2.gz LPEXAVUARLROHH-UHFFFAOYSA-N 1 2 317.820 4.024 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@](C)(c3ccccc3)C2)c(C)[nH+]1 ZINC000455476682 338895715 /nfs/dbraw/zinc/89/57/15/338895715.db2.gz FAWUWXVIKWJLRY-FQEVSTJZSA-N 1 2 323.440 4.202 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCCC[C@H]2CC(C)C)c(C)[nH+]1 ZINC000455478490 338895800 /nfs/dbraw/zinc/89/58/00/338895800.db2.gz GBTYMFSIGVSSHJ-INIZCTEOSA-N 1 2 303.450 4.439 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000456355971 338927526 /nfs/dbraw/zinc/92/75/26/338927526.db2.gz ONBIEKWCNNJIRA-GJZGRUSLSA-N 1 2 321.424 4.037 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)NC(=O)[C@H](C)c1ccc2ccccc2c1 ZINC000456355970 338927573 /nfs/dbraw/zinc/92/75/73/338927573.db2.gz ONBIEKWCNNJIRA-CABCVRRESA-N 1 2 321.424 4.037 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@H](C)c1ccc2ccccc2c1 ZINC000456355972 338927586 /nfs/dbraw/zinc/92/75/86/338927586.db2.gz ONBIEKWCNNJIRA-HUUCEWRRSA-N 1 2 321.424 4.037 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)c1ccc(C2CCCC2)cc1 ZINC000456365054 338927738 /nfs/dbraw/zinc/92/77/38/338927738.db2.gz VTFRPSZWIHUBSB-CQSZACIVSA-N 1 2 311.429 4.052 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456408021 338929157 /nfs/dbraw/zinc/92/91/57/338929157.db2.gz YXXJBOBRQBZULE-FVQBIDKESA-N 1 2 303.450 4.002 20 0 DIADLO Cc1cc(C)c(CNC(=O)CCC(C)(C)c2ccccc2)c[nH+]1 ZINC000456834603 338943039 /nfs/dbraw/zinc/94/30/39/338943039.db2.gz HSUCRLBEBTZPRA-UHFFFAOYSA-N 1 2 310.441 4.073 20 0 DIADLO CC[C@@H](CC(F)F)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000457559867 338969273 /nfs/dbraw/zinc/96/92/73/338969273.db2.gz KWLCJLQOMQLGOO-LBPRGKRZSA-N 1 2 320.339 4.494 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc(C)[nH+]c2)cc1Br ZINC000164606196 339008842 /nfs/dbraw/zinc/00/88/42/339008842.db2.gz JRSPCTPBVFZHAC-LLVKDONJSA-N 1 2 321.218 4.334 20 0 DIADLO CCCC[C@@H](C)N(CCCC)C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000459057530 339012372 /nfs/dbraw/zinc/01/23/72/339012372.db2.gz LAMIBCODSVGAFT-CVEARBPZSA-N 1 2 322.497 4.354 20 0 DIADLO CCC[C@H](NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1)C1CCCC1 ZINC000459280685 339018894 /nfs/dbraw/zinc/01/88/94/339018894.db2.gz KVTJYOYCUFHTPX-HOTGVXAUSA-N 1 2 318.465 4.005 20 0 DIADLO CC[N@H+](Cc1cnc(C2CC2)nc1)Cc1ccccc1Cl ZINC000459307868 339020740 /nfs/dbraw/zinc/02/07/40/339020740.db2.gz SURXJFJEEBFYKQ-UHFFFAOYSA-N 1 2 301.821 4.030 20 0 DIADLO CC[N@@H+](Cc1cnc(C2CC2)nc1)Cc1ccccc1Cl ZINC000459307868 339020741 /nfs/dbraw/zinc/02/07/41/339020741.db2.gz SURXJFJEEBFYKQ-UHFFFAOYSA-N 1 2 301.821 4.030 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2cnc(C3CC3)nc2)C2CC2)o1 ZINC000459313157 339020978 /nfs/dbraw/zinc/02/09/78/339020978.db2.gz PCCXFDAJZPWDPP-SCLBCKFNSA-N 1 2 323.440 4.235 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cnc(C3CC3)nc2)C2CC2)o1 ZINC000459313157 339020979 /nfs/dbraw/zinc/02/09/79/339020979.db2.gz PCCXFDAJZPWDPP-SCLBCKFNSA-N 1 2 323.440 4.235 20 0 DIADLO CC(C)[N@H+](Cc1ccco1)Cc1cccc(O)c1Br ZINC000459315671 339021102 /nfs/dbraw/zinc/02/11/02/339021102.db2.gz RUHCJVVMURKPBC-UHFFFAOYSA-N 1 2 324.218 4.158 20 0 DIADLO CC(C)[N@@H+](Cc1ccco1)Cc1cccc(O)c1Br ZINC000459315671 339021103 /nfs/dbraw/zinc/02/11/03/339021103.db2.gz RUHCJVVMURKPBC-UHFFFAOYSA-N 1 2 324.218 4.158 20 0 DIADLO COCc1cc(C[N@H+](Cc2ccc(C(C)C)cc2)C2CC2)no1 ZINC000459316305 339021118 /nfs/dbraw/zinc/02/11/18/339021118.db2.gz YEBAIKNBGSBKGX-UHFFFAOYSA-N 1 2 314.429 4.109 20 0 DIADLO COCc1cc(C[N@@H+](Cc2ccc(C(C)C)cc2)C2CC2)no1 ZINC000459316305 339021119 /nfs/dbraw/zinc/02/11/19/339021119.db2.gz YEBAIKNBGSBKGX-UHFFFAOYSA-N 1 2 314.429 4.109 20 0 DIADLO Cc1cc(C[NH2+]Cc2ccnc(Oc3cccc(C)c3C)c2)no1 ZINC000459428845 339028702 /nfs/dbraw/zinc/02/87/02/339028702.db2.gz PQKMDUMFZKBRQK-UHFFFAOYSA-N 1 2 323.396 4.077 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2c1c(F)ccc2F)c1nc2c(s1)CCC2 ZINC000459630667 339039426 /nfs/dbraw/zinc/03/94/26/339039426.db2.gz IYLZKSORPTVTIK-LKFCYVNXSA-N 1 2 320.408 4.248 20 0 DIADLO Cc1cnc(C[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)nc1 ZINC000459735981 339045234 /nfs/dbraw/zinc/04/52/34/339045234.db2.gz GLEZCMZCZHNEQS-LJQANCHMSA-N 1 2 307.441 4.292 20 0 DIADLO Cc1cnc(C[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)nc1 ZINC000459735981 339045235 /nfs/dbraw/zinc/04/52/35/339045235.db2.gz GLEZCMZCZHNEQS-LJQANCHMSA-N 1 2 307.441 4.292 20 0 DIADLO CCCn1nc(C)c(C[N@@H+]2Cc3ccc(Cl)cc3C2)c1C ZINC000459759760 339046860 /nfs/dbraw/zinc/04/68/60/339046860.db2.gz RFLDNMINUFNCOK-UHFFFAOYSA-N 1 2 303.837 4.079 20 0 DIADLO CCCn1nc(C)c(C[N@H+]2Cc3ccc(Cl)cc3C2)c1C ZINC000459759760 339046861 /nfs/dbraw/zinc/04/68/61/339046861.db2.gz RFLDNMINUFNCOK-UHFFFAOYSA-N 1 2 303.837 4.079 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2ccc(C)c(F)c2)cs1 ZINC000165229991 339052842 /nfs/dbraw/zinc/05/28/42/339052842.db2.gz JPQOCXDTCYDURW-NEPJUHHUSA-N 1 2 308.422 4.149 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1cccc2[nH+]ccn21)c1ccccc1 ZINC000460335956 339055517 /nfs/dbraw/zinc/05/55/17/339055517.db2.gz RGMWUNSMJVVPPQ-MRXNPFEDSA-N 1 2 307.397 4.103 20 0 DIADLO Cc1cccc2c1CC[C@H]2[NH2+]Cc1ncc(-c2ccccc2)cn1 ZINC000461080836 339058819 /nfs/dbraw/zinc/05/88/19/339058819.db2.gz DSOIXIBKCSUMJP-HXUWFJFHSA-N 1 2 315.420 4.229 20 0 DIADLO COC[C@H](C)SCCCCCn1c(C)[nH+]c2ccccc21 ZINC000461253891 339060796 /nfs/dbraw/zinc/06/07/96/339060796.db2.gz YWDBSUDJSCBAFG-AWEZNQCLSA-N 1 2 306.475 4.283 20 0 DIADLO Clc1cccc(C2CC[NH+](Cc3cocn3)CC2)c1Cl ZINC000463005748 339100063 /nfs/dbraw/zinc/10/00/63/339100063.db2.gz DHZJBAKRGAQDNN-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO Cn1ccc(C[NH+]2CCC(c3cccc(Cl)c3Cl)CC2)n1 ZINC000463026171 339101233 /nfs/dbraw/zinc/10/12/33/339101233.db2.gz ZMJQBIUYXZKTCQ-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO CCOC[C@H]1CCC[C@H]1Nc1ccc(-n2c[nH+]c(C)c2C)cc1 ZINC000463028452 339101568 /nfs/dbraw/zinc/10/15/68/339101568.db2.gz ASQAZSVZLQPGDT-VQIMIIECSA-N 1 2 313.445 4.106 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@@H]3CCO[C@H](C(C)C)C3)cc2)c1C ZINC000463035388 339102182 /nfs/dbraw/zinc/10/21/82/339102182.db2.gz HIRMYIVFAFJVCI-MJGOQNOKSA-N 1 2 313.445 4.105 20 0 DIADLO Cc1c[nH]nc1C[NH+]1CCC(c2cccc(Cl)c2Cl)CC1 ZINC000463046104 339102947 /nfs/dbraw/zinc/10/29/47/339102947.db2.gz YHHQXBJUVWHULB-UHFFFAOYSA-N 1 2 324.255 4.405 20 0 DIADLO Cc1cn[nH]c1C[NH+]1CCC(c2cccc(Cl)c2Cl)CC1 ZINC000463046104 339102948 /nfs/dbraw/zinc/10/29/48/339102948.db2.gz YHHQXBJUVWHULB-UHFFFAOYSA-N 1 2 324.255 4.405 20 0 DIADLO FC(F)Oc1ccc[nH+]c1NCc1ccc(C(F)(F)F)cc1 ZINC000463252123 339112193 /nfs/dbraw/zinc/11/21/93/339112193.db2.gz YTMXEFJUNRNJKX-UHFFFAOYSA-N 1 2 318.245 4.314 20 0 DIADLO Cc1cc(F)cc(C(=O)Nc2ccc3[nH+]c(N(C)C)ccc3c2)c1 ZINC000463655661 339123311 /nfs/dbraw/zinc/12/33/11/339123311.db2.gz MYNCEDXCVRPLDA-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2nnc(-c3ccccc3)s2)cc1 ZINC000464112202 339134614 /nfs/dbraw/zinc/13/46/14/339134614.db2.gz DHVLAHDHYZKHFN-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2nnc(-c3ccccc3)s2)cc1 ZINC000464112202 339134615 /nfs/dbraw/zinc/13/46/15/339134615.db2.gz DHVLAHDHYZKHFN-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(Cl)c2)[C@H](c2ccccc2)CO1 ZINC000464826266 339155526 /nfs/dbraw/zinc/15/55/26/339155526.db2.gz ZJKJUTUHDJFGQR-KSSFIOAISA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(Cl)c2)[C@H](c2ccccc2)CO1 ZINC000464826266 339155527 /nfs/dbraw/zinc/15/55/27/339155527.db2.gz ZJKJUTUHDJFGQR-KSSFIOAISA-N 1 2 301.817 4.302 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccn(-c3ccccc3)n2)[C@H](c2ccco2)C1 ZINC000464847454 339157514 /nfs/dbraw/zinc/15/75/14/339157514.db2.gz FKVIBBGIPXOKBN-APWZRJJASA-N 1 2 321.424 4.439 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccn(-c3ccccc3)n2)[C@H](c2ccco2)C1 ZINC000464847454 339157515 /nfs/dbraw/zinc/15/75/15/339157515.db2.gz FKVIBBGIPXOKBN-APWZRJJASA-N 1 2 321.424 4.439 20 0 DIADLO COc1ccc2c(c1)[nH+]ccc2OCc1ccc(F)c(F)c1 ZINC000465005595 339165286 /nfs/dbraw/zinc/16/52/86/339165286.db2.gz YQXPYOBFYHZQQE-UHFFFAOYSA-N 1 2 301.292 4.101 20 0 DIADLO Cc1cc(N2CCC(=Cc3ccccc3F)CC2)nc(C2CC2)[nH+]1 ZINC000465049544 339166830 /nfs/dbraw/zinc/16/68/30/339166830.db2.gz LSKGXPBMZQXNLA-UHFFFAOYSA-N 1 2 323.415 4.485 20 0 DIADLO CC[C@H]1CCC[C@@H]1NC(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000465071404 339167593 /nfs/dbraw/zinc/16/75/93/339167593.db2.gz NNSOCZBOOJCDES-YJBOKZPZSA-N 1 2 324.424 4.491 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+][C@@H](C)c3ccc(F)cc3F)nc2c1 ZINC000465404836 339175364 /nfs/dbraw/zinc/17/53/64/339175364.db2.gz HNXPSVFZAHMXGE-NSHDSACASA-N 1 2 301.340 4.000 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@@H](C)c3ccc(F)cc3F)[nH]c2c1 ZINC000465404836 339175365 /nfs/dbraw/zinc/17/53/65/339175365.db2.gz HNXPSVFZAHMXGE-NSHDSACASA-N 1 2 301.340 4.000 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000465462776 339177548 /nfs/dbraw/zinc/17/75/48/339177548.db2.gz JDPKMLDCFOVMKD-JTQLQIEISA-N 1 2 323.223 4.115 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)[C@H](c1cccc(Cl)c1)C(C)C ZINC000465463478 339177632 /nfs/dbraw/zinc/17/76/32/339177632.db2.gz WZOZFLOYFDOOFL-KRWDZBQOSA-N 1 2 316.832 4.098 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@H](CO)c2cccc(Cl)c2F)o1 ZINC000466381855 339201706 /nfs/dbraw/zinc/20/17/06/339201706.db2.gz DKSUATBIWZDJBP-RIEGTJTDSA-N 1 2 323.795 4.019 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@@H](CO)c2cccc(Cl)c2F)o1 ZINC000466381851 339201755 /nfs/dbraw/zinc/20/17/55/339201755.db2.gz DKSUATBIWZDJBP-DGFSRKRXSA-N 1 2 323.795 4.019 20 0 DIADLO c1ccc(-c2ccc[nH+]c2NCc2cccc3c2OCO3)cc1 ZINC000466633936 339211215 /nfs/dbraw/zinc/21/12/15/339211215.db2.gz HDVXYNFOISLBII-UHFFFAOYSA-N 1 2 304.349 4.089 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1nc2ccc(F)cc2o1 ZINC000466813948 339217852 /nfs/dbraw/zinc/21/78/52/339217852.db2.gz QHSQOJWCTXFISA-JTQLQIEISA-N 1 2 302.374 4.148 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1nc2ccc(F)cc2o1 ZINC000466813948 339217853 /nfs/dbraw/zinc/21/78/53/339217853.db2.gz QHSQOJWCTXFISA-JTQLQIEISA-N 1 2 302.374 4.148 20 0 DIADLO COC(=O)c1ccc(C(C)C)c(NCc2ccc(C)[nH+]c2C)c1 ZINC000466846324 339218979 /nfs/dbraw/zinc/21/89/79/339218979.db2.gz OMMNRHFWTQMXIX-UHFFFAOYSA-N 1 2 312.413 4.221 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH+]2CC(C)(C)CC(C)(C)C2)n1 ZINC000466936525 339222226 /nfs/dbraw/zinc/22/22/26/339222226.db2.gz SREYZBOYIQOKDA-LBPRGKRZSA-N 1 2 311.495 4.142 20 0 DIADLO C[C@@H](C(=O)Nc1c(F)cccc1F)[NH+]1CC(C)(C)CC(C)(C)C1 ZINC000466937660 339222340 /nfs/dbraw/zinc/22/23/40/339222340.db2.gz GYMWKKCONZOEEV-LBPRGKRZSA-N 1 2 324.415 4.050 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCCC[C@H]3c3ccco3)oc2c1 ZINC000466961748 339222931 /nfs/dbraw/zinc/22/29/31/339222931.db2.gz OPGNNMRJZRHDMT-AWEZNQCLSA-N 1 2 300.333 4.287 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCCC[C@H]3c3ccco3)oc2c1 ZINC000466961748 339222932 /nfs/dbraw/zinc/22/29/32/339222932.db2.gz OPGNNMRJZRHDMT-AWEZNQCLSA-N 1 2 300.333 4.287 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@H](Nc2cn(C)nc2C(C)C)C1 ZINC000467365397 339234233 /nfs/dbraw/zinc/23/42/33/339234233.db2.gz PRMGSJOMMGCKBN-HOTGVXAUSA-N 1 2 312.461 4.385 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@@H](CO)c2cccc(Cl)c2F)o1 ZINC000467415499 339237288 /nfs/dbraw/zinc/23/72/88/339237288.db2.gz YPUAUJDVGPOERJ-HZMBPMFUSA-N 1 2 311.784 4.019 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(F)c(Cl)c2Cl)CCCO1 ZINC000467559196 339242718 /nfs/dbraw/zinc/24/27/18/339242718.db2.gz ZHOUWXIFUXJABR-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(F)c(Cl)c2Cl)CCCO1 ZINC000467559196 339242719 /nfs/dbraw/zinc/24/27/19/339242719.db2.gz ZHOUWXIFUXJABR-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO Cn1cc[nH+]c1CNc1ccccc1Oc1ccc(Cl)cc1 ZINC000467776601 339246484 /nfs/dbraw/zinc/24/64/84/339246484.db2.gz IWKLHQPUEQAWSG-UHFFFAOYSA-N 1 2 313.788 4.478 20 0 DIADLO COc1ccc(CC[C@@H](C)[NH2+][C@@H](C(C)C)C(F)(F)F)cc1 ZINC000468983816 339276763 /nfs/dbraw/zinc/27/67/63/339276763.db2.gz MFDZZBWOSVJTRZ-DOMZBBRYSA-N 1 2 303.368 4.193 20 0 DIADLO CCC1(CC)C[N@@H+]([C@H](C)c2ccccc2Cl)CC[S@]1=O ZINC000469440814 339289398 /nfs/dbraw/zinc/28/93/98/339289398.db2.gz NMJHBQGHDUVSEN-ZUOKHONESA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@H+]([C@H](C)c2ccccc2Cl)CC[S@]1=O ZINC000469440814 339289399 /nfs/dbraw/zinc/28/93/99/339289399.db2.gz NMJHBQGHDUVSEN-ZUOKHONESA-N 1 2 313.894 4.024 20 0 DIADLO Fc1ccc(C[NH+]2Cc3ccccc3-c3ccccc3C2)nc1 ZINC000469579410 339293604 /nfs/dbraw/zinc/29/36/04/339293604.db2.gz WOFGSDJGDDHVCZ-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO C[C@H](c1ccccc1Br)[N@H+](C)Cc1ccc(F)cn1 ZINC000469599262 339294115 /nfs/dbraw/zinc/29/41/15/339294115.db2.gz RPLFXSGATNSKMQ-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1ccccc1Br)[N@@H+](C)Cc1ccc(F)cn1 ZINC000469599262 339294116 /nfs/dbraw/zinc/29/41/16/339294116.db2.gz RPLFXSGATNSKMQ-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO CC(C)(C(=O)Nc1cccc(Nc2ccccc2)c1)c1c[nH+]c[nH]1 ZINC000469663236 339295061 /nfs/dbraw/zinc/29/50/61/339295061.db2.gz UWNHKRAASNWHOW-UHFFFAOYSA-N 1 2 320.396 4.070 20 0 DIADLO CC(C)(C(=O)Nc1cccc(Nc2ccccc2)c1)c1c[nH]c[nH+]1 ZINC000469663236 339295062 /nfs/dbraw/zinc/29/50/62/339295062.db2.gz UWNHKRAASNWHOW-UHFFFAOYSA-N 1 2 320.396 4.070 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1csc(C(C)C)n1)c1ccc(F)cc1 ZINC000469773053 339298613 /nfs/dbraw/zinc/29/86/13/339298613.db2.gz UKGLMNOJVJQIFP-SWLSCSKDSA-N 1 2 322.449 4.444 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1csc(C(C)C)n1)c1ccc(F)cc1 ZINC000469773051 339298654 /nfs/dbraw/zinc/29/86/54/339298654.db2.gz UKGLMNOJVJQIFP-DOMZBBRYSA-N 1 2 322.449 4.444 20 0 DIADLO Brc1ccccc1SCc1c[nH+]c2ccccn12 ZINC000469807439 339301478 /nfs/dbraw/zinc/30/14/78/339301478.db2.gz HZFPBANDYUTRMG-UHFFFAOYSA-N 1 2 319.227 4.389 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cs1 ZINC000470012044 339308466 /nfs/dbraw/zinc/30/84/66/339308466.db2.gz OJBUYAUETXWMFM-LLVKDONJSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cs1 ZINC000470012044 339308467 /nfs/dbraw/zinc/30/84/67/339308467.db2.gz OJBUYAUETXWMFM-LLVKDONJSA-N 1 2 306.397 4.429 20 0 DIADLO Cc1cc(C)c(NC(=O)C[N@@H+]2CCCC3(CCC3)C2)c(Cl)c1 ZINC000470872236 339329847 /nfs/dbraw/zinc/32/98/47/339329847.db2.gz QHRHDNJFSQCHNF-UHFFFAOYSA-N 1 2 320.864 4.161 20 0 DIADLO Cc1cc(C)c(NC(=O)C[N@H+]2CCCC3(CCC3)C2)c(Cl)c1 ZINC000470872236 339329848 /nfs/dbraw/zinc/32/98/48/339329848.db2.gz QHRHDNJFSQCHNF-UHFFFAOYSA-N 1 2 320.864 4.161 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1coc(-c2cccs2)n1 ZINC000470942057 339331853 /nfs/dbraw/zinc/33/18/53/339331853.db2.gz AJFPCNIXPIJBBV-ONGXEEELSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1coc(-c2cccs2)n1 ZINC000470942057 339331854 /nfs/dbraw/zinc/33/18/54/339331854.db2.gz AJFPCNIXPIJBBV-ONGXEEELSA-N 1 2 316.348 4.176 20 0 DIADLO CN(Cc1cn2cc(Cl)ccc2[nH+]1)c1ccc2cc[nH]c2c1 ZINC000471003973 339334123 /nfs/dbraw/zinc/33/41/23/339334123.db2.gz GTDBJPJTIPHMHU-UHFFFAOYSA-N 1 2 310.788 4.105 20 0 DIADLO Cc1ccc(-c2nnc(C[N@H+]3C[C@H](C)[C@H]3c3ccccc3)o2)cc1 ZINC000471029524 339334988 /nfs/dbraw/zinc/33/49/88/339334988.db2.gz QJMAHCSCFXLYDC-KXBFYZLASA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccc(-c2nnc(C[N@@H+]3C[C@H](C)[C@H]3c3ccccc3)o2)cc1 ZINC000471029524 339334989 /nfs/dbraw/zinc/33/49/89/339334989.db2.gz QJMAHCSCFXLYDC-KXBFYZLASA-N 1 2 319.408 4.238 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000471038771 339335353 /nfs/dbraw/zinc/33/53/53/339335353.db2.gz RJAMIJVHRPFXTR-XOBRGWDASA-N 1 2 323.415 4.388 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000471038771 339335354 /nfs/dbraw/zinc/33/53/54/339335354.db2.gz RJAMIJVHRPFXTR-XOBRGWDASA-N 1 2 323.415 4.388 20 0 DIADLO Cc1cc(Nc2ccc(-c3cncnc3)cc2)nc(C(C)C)[nH+]1 ZINC000471047895 339335575 /nfs/dbraw/zinc/33/55/75/339335575.db2.gz PWPRPFLEHPEFLJ-UHFFFAOYSA-N 1 2 305.385 4.109 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000471167429 339339334 /nfs/dbraw/zinc/33/93/34/339339334.db2.gz BRBMEDSFILAECN-QGZVFWFLSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000471167429 339339335 /nfs/dbraw/zinc/33/93/35/339339335.db2.gz BRBMEDSFILAECN-QGZVFWFLSA-N 1 2 314.816 4.034 20 0 DIADLO CC(C)(C)c1ccccc1NC(=O)C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000471169582 339339368 /nfs/dbraw/zinc/33/93/68/339339368.db2.gz POUKFWDNBFXANQ-IBGZPJMESA-N 1 2 322.452 4.370 20 0 DIADLO CC(C)(C)c1ccccc1NC(=O)C[N@H+]1CC[C@H]1c1ccccc1 ZINC000471169582 339339369 /nfs/dbraw/zinc/33/93/69/339339369.db2.gz POUKFWDNBFXANQ-IBGZPJMESA-N 1 2 322.452 4.370 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+]2CC[C@H]2c2ccccc2)cc1Cl ZINC000471176440 339339648 /nfs/dbraw/zinc/33/96/48/339339648.db2.gz KLLOTSVIHYGHJW-KRWDZBQOSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+]2CC[C@H]2c2ccccc2)cc1Cl ZINC000471176440 339339649 /nfs/dbraw/zinc/33/96/49/339339649.db2.gz KLLOTSVIHYGHJW-KRWDZBQOSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000471181310 339339729 /nfs/dbraw/zinc/33/97/29/339339729.db2.gz LIONFBCLBSNWGD-KRWDZBQOSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)C[N@H+]1CC[C@H]1c1ccccc1 ZINC000471181310 339339730 /nfs/dbraw/zinc/33/97/30/339339730.db2.gz LIONFBCLBSNWGD-KRWDZBQOSA-N 1 2 314.816 4.034 20 0 DIADLO CCc1cccc(CC)c1NC(=O)C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000471176208 339339732 /nfs/dbraw/zinc/33/97/32/339339732.db2.gz KAKANOQEZWZVPJ-LJQANCHMSA-N 1 2 322.452 4.197 20 0 DIADLO CCc1cccc(CC)c1NC(=O)C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000471176208 339339733 /nfs/dbraw/zinc/33/97/33/339339733.db2.gz KAKANOQEZWZVPJ-LJQANCHMSA-N 1 2 322.452 4.197 20 0 DIADLO Cc1ccc(C(=O)N2C[C@H](C)CC2(C)C)cc1Oc1cc[nH+]cc1 ZINC000471703195 339351631 /nfs/dbraw/zinc/35/16/31/339351631.db2.gz YVTJPSWPDZIRAE-CQSZACIVSA-N 1 2 324.424 4.443 20 0 DIADLO Cc1[nH+]cccc1Cc1nc(-c2c(Cl)cccc2Cl)no1 ZINC000504286189 339353868 /nfs/dbraw/zinc/35/38/68/339353868.db2.gz KXAFIZOMVZTBGX-UHFFFAOYSA-N 1 2 320.179 4.338 20 0 DIADLO CC(C)([NH2+]Cc1ccn(C(F)F)n1)c1cccc(Cl)c1F ZINC000472124252 339363414 /nfs/dbraw/zinc/36/34/14/339363414.db2.gz MROUBAKIIZWWJT-UHFFFAOYSA-N 1 2 317.742 4.096 20 0 DIADLO CCN(Cc1[nH+]cc(C)c(OC)c1C)c1ccc2[nH]ccc2c1 ZINC000472184848 339365557 /nfs/dbraw/zinc/36/55/57/339365557.db2.gz CBOUDHFMMFXKMH-UHFFFAOYSA-N 1 2 309.413 4.215 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cn3ccsc3n2)[C@H]1c1cccc(F)c1 ZINC000472353385 339370696 /nfs/dbraw/zinc/37/06/96/339370696.db2.gz RNGLSWDFNWDFJI-MLGOLLRUSA-N 1 2 315.417 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cn3ccsc3n2)[C@H]1c1cccc(F)c1 ZINC000472353385 339370697 /nfs/dbraw/zinc/37/06/97/339370697.db2.gz RNGLSWDFNWDFJI-MLGOLLRUSA-N 1 2 315.417 4.118 20 0 DIADLO C[C@H](c1cn(-c2ccccc2)nn1)[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000472590466 339374610 /nfs/dbraw/zinc/37/46/10/339374610.db2.gz GASCWHGORWHJOM-JXXFODFXSA-N 1 2 318.424 4.021 20 0 DIADLO C[C@H](c1cn(-c2ccccc2)nn1)[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000472590466 339374611 /nfs/dbraw/zinc/37/46/11/339374611.db2.gz GASCWHGORWHJOM-JXXFODFXSA-N 1 2 318.424 4.021 20 0 DIADLO C[C@H](c1cn(-c2ccccc2)nn1)[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000472590469 339374743 /nfs/dbraw/zinc/37/47/43/339374743.db2.gz GASCWHGORWHJOM-QINHECLXSA-N 1 2 318.424 4.021 20 0 DIADLO C[C@H](c1cn(-c2ccccc2)nn1)[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000472590469 339374744 /nfs/dbraw/zinc/37/47/44/339374744.db2.gz GASCWHGORWHJOM-QINHECLXSA-N 1 2 318.424 4.021 20 0 DIADLO Cc1ccccc1-c1nc(C[NH2+]C(C)(C)c2ccccc2)no1 ZINC000472680136 339376142 /nfs/dbraw/zinc/37/61/42/339376142.db2.gz VERCOZIJCFSSDZ-UHFFFAOYSA-N 1 2 307.397 4.070 20 0 DIADLO CC[N@H+](Cc1noc(-c2ccccc2C)n1)Cc1ccccc1C ZINC000472800144 339377685 /nfs/dbraw/zinc/37/76/85/339377685.db2.gz TXHYDSUMIPWGRF-UHFFFAOYSA-N 1 2 321.424 4.376 20 0 DIADLO CC[N@@H+](Cc1noc(-c2ccccc2C)n1)Cc1ccccc1C ZINC000472800144 339377686 /nfs/dbraw/zinc/37/76/86/339377686.db2.gz TXHYDSUMIPWGRF-UHFFFAOYSA-N 1 2 321.424 4.376 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@@H+](Cc1ccncc1Cl)C2 ZINC000473046541 339380532 /nfs/dbraw/zinc/38/05/32/339380532.db2.gz KVDSKCXJVFNHQK-UHFFFAOYSA-N 1 2 316.832 4.082 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@H+](Cc1ccncc1Cl)C2 ZINC000473046541 339380533 /nfs/dbraw/zinc/38/05/33/339380533.db2.gz KVDSKCXJVFNHQK-UHFFFAOYSA-N 1 2 316.832 4.082 20 0 DIADLO COc1cccc([C@H]2C[C@H](C)C[N@@H+]2Cc2ncc(Cl)s2)c1 ZINC000473125293 339381626 /nfs/dbraw/zinc/38/16/26/339381626.db2.gz HQRNIOXITYUEND-SMDDNHRTSA-N 1 2 322.861 4.388 20 0 DIADLO COc1cccc([C@H]2C[C@H](C)C[N@H+]2Cc2ncc(Cl)s2)c1 ZINC000473125293 339381627 /nfs/dbraw/zinc/38/16/27/339381627.db2.gz HQRNIOXITYUEND-SMDDNHRTSA-N 1 2 322.861 4.388 20 0 DIADLO CCc1[nH+]c(C)ccc1OCc1ncc(-c2cccs2)o1 ZINC000473681413 339390297 /nfs/dbraw/zinc/39/02/97/339390297.db2.gz XTJCCFBKOYEJNS-UHFFFAOYSA-N 1 2 300.383 4.248 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1c(F)cccc1F ZINC000473984725 339396167 /nfs/dbraw/zinc/39/61/67/339396167.db2.gz RYTNCQRBPDOHSC-UHFFFAOYSA-N 1 2 303.308 4.009 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)C1CCSCC1 ZINC000474595385 339419166 /nfs/dbraw/zinc/41/91/66/339419166.db2.gz AWYKDIDFFQHHNX-CQSZACIVSA-N 1 2 305.491 4.016 20 0 DIADLO CC(C)[C@@H]1C[C@@H]1C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000475617085 339457319 /nfs/dbraw/zinc/45/73/19/339457319.db2.gz JHAGIRPMUHOQGG-IRXDYDNUSA-N 1 2 323.440 4.117 20 0 DIADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000476385093 339475771 /nfs/dbraw/zinc/47/57/71/339475771.db2.gz HCXMZDIBCCEQFZ-IEBWSBKVSA-N 1 2 310.397 4.495 20 0 DIADLO Cc1ccc(CNc2cccc(C)c2Br)c(C)[nH+]1 ZINC000478337727 339513751 /nfs/dbraw/zinc/51/37/51/339513751.db2.gz MHAVLDPGDGJSKK-UHFFFAOYSA-N 1 2 305.219 4.381 20 0 DIADLO Cc1ccc(CNc2cccc(Br)c2C)c(C)[nH+]1 ZINC000478387509 339514545 /nfs/dbraw/zinc/51/45/45/339514545.db2.gz KZVRLDSDJHNZAV-UHFFFAOYSA-N 1 2 305.219 4.381 20 0 DIADLO Cc1ccc(C(=O)N(Cc2[nH]cc[nH+]2)c2cccc(F)c2)c(C)c1 ZINC000479369723 339532225 /nfs/dbraw/zinc/53/22/25/339532225.db2.gz CWOMNXLPAMCHQH-UHFFFAOYSA-N 1 2 323.371 4.013 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ccsc1Cl)c1nnc2ccccn21 ZINC000480339588 339569742 /nfs/dbraw/zinc/56/97/42/339569742.db2.gz FISWLRDIEAUKDS-GFCCVEGCSA-N 1 2 320.849 4.075 20 0 DIADLO COc1cccc2c(N3CC[C@@H](C(F)(F)F)[C@@H]3C)cc[nH+]c12 ZINC000480547694 339576865 /nfs/dbraw/zinc/57/68/65/339576865.db2.gz CUHBLDOAVGNREF-CMPLNLGQSA-N 1 2 310.319 4.021 20 0 DIADLO CCCCn1c(S[C@H](C)CCC)nnc1[C@H](CC)[NH+](C)C ZINC000481049854 339594575 /nfs/dbraw/zinc/59/45/75/339594575.db2.gz AJXWLOCTNFCFNU-KGLIPLIRSA-N 1 2 312.527 4.372 20 0 DIADLO O=C(c1ccccc1)C1CC[NH+](Cc2ccsc2Cl)CC1 ZINC000483144070 339653969 /nfs/dbraw/zinc/65/39/69/339653969.db2.gz QVYQOVLWUCDTDP-UHFFFAOYSA-N 1 2 319.857 4.496 20 0 DIADLO CC(C)(C)CCNC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000485255087 339700622 /nfs/dbraw/zinc/70/06/22/339700622.db2.gz AJJOPYUPBIUJTG-UHFFFAOYSA-N 1 2 313.401 4.432 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](CC(C)(C)C)C(F)(F)F ZINC000485452449 339703527 /nfs/dbraw/zinc/70/35/27/339703527.db2.gz PEXSCLKZTBZVLP-LLVKDONJSA-N 1 2 317.355 4.187 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCC[C@@H]1CCC(C)C ZINC000485472338 339703912 /nfs/dbraw/zinc/70/39/12/339703912.db2.gz DWCWCCJVSLUKHX-HZPDHXFCSA-N 1 2 303.450 4.425 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)Oc1ccc(Cl)cc1C ZINC000485482173 339704149 /nfs/dbraw/zinc/70/41/49/339704149.db2.gz WHSKWWGJBQBYFE-ZDUSSCGKSA-N 1 2 318.804 4.066 20 0 DIADLO CCC1(CC)CC[NH+](Cc2noc(Cc3ccccc3)n2)CC1 ZINC000485856557 339714592 /nfs/dbraw/zinc/71/45/92/339714592.db2.gz FEUAIVKMENSTHS-UHFFFAOYSA-N 1 2 313.445 4.063 20 0 DIADLO COC[C@@H](c1ccc(Cl)cc1)N(C)c1cc[nH+]c(C(C)C)n1 ZINC000486502752 339728494 /nfs/dbraw/zinc/72/84/94/339728494.db2.gz AKZMIPBWGJXDFI-HNNXBMFYSA-N 1 2 319.836 4.077 20 0 DIADLO Cc1cc(NCc2cn3ccccc3[nH+]2)c2ccc(F)c(F)c2n1 ZINC000486775409 339733769 /nfs/dbraw/zinc/73/37/69/339733769.db2.gz HEISRBRASWXTJG-UHFFFAOYSA-N 1 2 324.334 4.081 20 0 DIADLO Cc1cc(N2CCC[C@H]2CCC(C)C)nc(-c2ccncc2)[nH+]1 ZINC000486896460 339737496 /nfs/dbraw/zinc/73/74/96/339737496.db2.gz KSWQSXKKSXAECM-KRWDZBQOSA-N 1 2 310.445 4.252 20 0 DIADLO CCOc1ccc(CNc2cccc(-n3cc[nH+]c3)c2)cc1F ZINC000487265776 339747928 /nfs/dbraw/zinc/74/79/28/339747928.db2.gz OGMQVTYOPRJDLC-UHFFFAOYSA-N 1 2 311.360 4.022 20 0 DIADLO CC(C)(C)[C@@H]1C[C@@H](Nc2ccc(-n3cc[nH+]c3)c(F)c2)CS1 ZINC000488314716 339776679 /nfs/dbraw/zinc/77/66/79/339776679.db2.gz CCDFMABAJPLLHH-CJNGLKHVSA-N 1 2 319.449 4.344 20 0 DIADLO CC(C)(C)[C@@H]1C[C@H](Nc2ccc(N3CCCC3)[nH+]c2)CS1 ZINC000488427618 339781522 /nfs/dbraw/zinc/78/15/22/339781522.db2.gz ALHAXTPYLFMQKP-GJZGRUSLSA-N 1 2 305.491 4.014 20 0 DIADLO COc1cc[nH+]cc1NC(=O)c1cc2ccc(C(C)(C)C)cc2[nH]1 ZINC000498540862 339787072 /nfs/dbraw/zinc/78/70/72/339787072.db2.gz PXODVAGLNCBUHP-UHFFFAOYSA-N 1 2 323.396 4.121 20 0 DIADLO C[C@H]1CN(c2cccc[nH+]2)C[C@@H](c2cccc(C(F)(F)F)c2)O1 ZINC000488686734 339790460 /nfs/dbraw/zinc/79/04/60/339790460.db2.gz PHKQPGDYCMKBJJ-WFASDCNBSA-N 1 2 322.330 4.067 20 0 DIADLO Clc1cc2c(s1)CCC[C@H]2Nc1cc[nH+]c2ccncc12 ZINC000488724840 339791541 /nfs/dbraw/zinc/79/15/41/339791541.db2.gz ZPXFLKOJFNEQFC-CYBMUJFWSA-N 1 2 315.829 4.256 20 0 DIADLO CSC[C@H]1CCCN(c2cc(C(C)C)[nH+]c(C(C)C)n2)C1 ZINC000488925388 339797020 /nfs/dbraw/zinc/79/70/20/339797020.db2.gz KDPHUNOFRDZYJV-AWEZNQCLSA-N 1 2 307.507 4.303 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)N(C(=O)Nc3ccc(C)[nH+]c3C)C2)cc1 ZINC000488946573 339797842 /nfs/dbraw/zinc/79/78/42/339797842.db2.gz WUGBZCDNBZCXEW-QAPCUYQASA-N 1 2 323.440 4.417 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)C=CC2CCCCC2)[nH+]1 ZINC000492227337 339894687 /nfs/dbraw/zinc/89/46/87/339894687.db2.gz SYLPBANDIXEQNB-QXMHVHEDSA-N 1 2 309.413 4.460 20 0 DIADLO CC(C)(C)/C=C\C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000492262375 339895787 /nfs/dbraw/zinc/89/57/87/339895787.db2.gz HRGWIOHWCCFQMW-KHPPLWFESA-N 1 2 321.424 4.143 20 0 DIADLO CC(C)Oc1ccc(CN2CCC[C@H]2c2[nH]cc[nH+]2)cc1Cl ZINC000492433113 339900574 /nfs/dbraw/zinc/90/05/74/339900574.db2.gz AHOCMEVPZREBQC-HNNXBMFYSA-N 1 2 319.836 4.187 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C\c2cc(F)c(F)c(F)c2)c(C)[nH+]1 ZINC000492570799 339904284 /nfs/dbraw/zinc/90/42/84/339904284.db2.gz XTBIZTHCASMBJV-PLNGDYQASA-N 1 2 320.314 4.076 20 0 DIADLO Cc1cc(SC(C)(C)C)ccc1NC(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493193413 339919447 /nfs/dbraw/zinc/91/94/47/339919447.db2.gz FOGBTVUFBDBDBX-FPLPWBNLSA-N 1 2 315.442 4.261 20 0 DIADLO CCCc1csc(C[NH2+][C@H](c2ncc(C)s2)C2CC2)n1 ZINC000494099144 339941026 /nfs/dbraw/zinc/94/10/26/339941026.db2.gz QLMHWPGMQRVTIS-AWEZNQCLSA-N 1 2 307.488 4.101 20 0 DIADLO CCCc1csc(C[NH2+][C@@H](COCC(C)C)c2ccco2)n1 ZINC000494331337 339946774 /nfs/dbraw/zinc/94/67/74/339946774.db2.gz QHKCKFLCYDHQMK-HNNXBMFYSA-N 1 2 322.474 4.192 20 0 DIADLO CCN(CC)c1ccc(N[C@@H](c2ccc(F)cn2)C(C)C)c[nH+]1 ZINC000498754498 340022717 /nfs/dbraw/zinc/02/27/17/340022717.db2.gz JFRTZWWIGLYZHE-GOSISDBHSA-N 1 2 316.424 4.271 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C1CCCCC1 ZINC000499042172 340028326 /nfs/dbraw/zinc/02/83/26/340028326.db2.gz DAGHQRDWKWVRJP-UHFFFAOYSA-N 1 2 303.793 4.045 20 0 DIADLO c1ccc(Oc2ccc(C[N@@H+]3CC[C@@H]3c3ccccc3)nn2)cc1 ZINC000499053658 340028797 /nfs/dbraw/zinc/02/87/97/340028797.db2.gz GKRPKAWPEGGNCP-LJQANCHMSA-N 1 2 317.392 4.216 20 0 DIADLO c1ccc(Oc2ccc(C[N@H+]3CC[C@@H]3c3ccccc3)nn2)cc1 ZINC000499053658 340028798 /nfs/dbraw/zinc/02/87/98/340028798.db2.gz GKRPKAWPEGGNCP-LJQANCHMSA-N 1 2 317.392 4.216 20 0 DIADLO C[C@@H]1c2ccccc2C[N@H+]1Cc1ccc(Oc2ccccc2)nn1 ZINC000499069801 340028991 /nfs/dbraw/zinc/02/89/91/340028991.db2.gz NJZBCLAIFMAJOC-OAHLLOKOSA-N 1 2 317.392 4.346 20 0 DIADLO C[C@@H]1c2ccccc2C[N@@H+]1Cc1ccc(Oc2ccccc2)nn1 ZINC000499069801 340028992 /nfs/dbraw/zinc/02/89/92/340028992.db2.gz NJZBCLAIFMAJOC-OAHLLOKOSA-N 1 2 317.392 4.346 20 0 DIADLO OC[C@@H]([NH2+]Cc1cc2ccccc2o1)c1cccc(Cl)c1F ZINC000499956939 340047570 /nfs/dbraw/zinc/04/75/70/340047570.db2.gz RXDXLXHBJOFXCO-OAHLLOKOSA-N 1 2 319.763 4.049 20 0 DIADLO CCC[C@@H](C)CC(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC000500004162 340048542 /nfs/dbraw/zinc/04/85/42/340048542.db2.gz HNAGDGMOYUDQSU-ZIAGYGMSSA-N 1 2 323.506 4.140 20 0 DIADLO CCC[C@@H](C)CC(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000500004162 340048543 /nfs/dbraw/zinc/04/85/43/340048543.db2.gz HNAGDGMOYUDQSU-ZIAGYGMSSA-N 1 2 323.506 4.140 20 0 DIADLO c1cc([C@H]2C[N@H+](CCSC3CCCCC3)CCO2)cs1 ZINC000500115369 340050502 /nfs/dbraw/zinc/05/05/02/340050502.db2.gz LIZODMOWWNSALW-MRXNPFEDSA-N 1 2 311.516 4.187 20 0 DIADLO c1cc([C@H]2C[N@@H+](CCSC3CCCCC3)CCO2)cs1 ZINC000500115369 340050503 /nfs/dbraw/zinc/05/05/03/340050503.db2.gz LIZODMOWWNSALW-MRXNPFEDSA-N 1 2 311.516 4.187 20 0 DIADLO CSc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C(C)C)no2)cc1 ZINC000500237658 340053880 /nfs/dbraw/zinc/05/38/80/340053880.db2.gz LFMBVVOLZZCHJE-NWDGAFQWSA-N 1 2 305.447 4.327 20 0 DIADLO C/C(=C\c1ccccc1)C[NH2+][C@H](C)c1noc(-c2ccccc2)n1 ZINC000500375268 340055955 /nfs/dbraw/zinc/05/59/55/340055955.db2.gz IDPCSGTZBBRAER-QJPKHSJYSA-N 1 2 319.408 4.491 20 0 DIADLO C/C(=C/c1ccccc1)C[NH2+][C@@H](C)c1noc(-c2ccccc2)n1 ZINC000500375266 340056026 /nfs/dbraw/zinc/05/60/26/340056026.db2.gz IDPCSGTZBBRAER-KGAUPUERSA-N 1 2 319.408 4.491 20 0 DIADLO COc1ccc(Oc2ccc(C[NH2+]C3(C(F)F)CC3)cc2)cc1 ZINC000500492934 340060522 /nfs/dbraw/zinc/06/05/22/340060522.db2.gz CQOXTSVQNOVDJL-UHFFFAOYSA-N 1 2 319.351 4.375 20 0 DIADLO FC(F)C1([NH2+]Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC000500496464 340060528 /nfs/dbraw/zinc/06/05/28/340060528.db2.gz HUSBJDYZKDTZJQ-UHFFFAOYSA-N 1 2 303.352 4.153 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2cccc(OCc3ccccc3)c2)no1 ZINC000500544300 340061943 /nfs/dbraw/zinc/06/19/43/340061943.db2.gz IIXOIVHKHUMXDK-INIZCTEOSA-N 1 2 322.408 4.413 20 0 DIADLO CCCC[N@H+](Cc1nccn1C(C)C)Cc1ccccc1F ZINC000501331526 340078750 /nfs/dbraw/zinc/07/87/50/340078750.db2.gz UYVJMGGBBYOMON-UHFFFAOYSA-N 1 2 303.425 4.405 20 0 DIADLO CCCC[N@@H+](Cc1nccn1C(C)C)Cc1ccccc1F ZINC000501331526 340078751 /nfs/dbraw/zinc/07/87/51/340078751.db2.gz UYVJMGGBBYOMON-UHFFFAOYSA-N 1 2 303.425 4.405 20 0 DIADLO CCCCN(Cc1[nH+]ccn1C(C)C)Cc1ccccc1F ZINC000501331526 340078752 /nfs/dbraw/zinc/07/87/52/340078752.db2.gz UYVJMGGBBYOMON-UHFFFAOYSA-N 1 2 303.425 4.405 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)Cc1ccc(F)cc1 ZINC000501348256 340078918 /nfs/dbraw/zinc/07/89/18/340078918.db2.gz PBJINVMVWNBCTP-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)Cc1ccc(F)cc1 ZINC000501348256 340078919 /nfs/dbraw/zinc/07/89/19/340078919.db2.gz PBJINVMVWNBCTP-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO C[C@@H](Nc1cc(Cl)cc(Br)c1)c1[nH+]ccn1C ZINC000308317593 340079157 /nfs/dbraw/zinc/07/91/57/340079157.db2.gz CKORGHMHFCFQNU-MRVPVSSYSA-N 1 2 314.614 4.009 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)C1 ZINC000501419326 340080471 /nfs/dbraw/zinc/08/04/71/340080471.db2.gz OBMCOSJHLIRTAJ-INIZCTEOSA-N 1 2 324.852 4.321 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)C1 ZINC000501419326 340080472 /nfs/dbraw/zinc/08/04/72/340080472.db2.gz OBMCOSJHLIRTAJ-INIZCTEOSA-N 1 2 324.852 4.321 20 0 DIADLO CCOc1ccc(-c2nc(C[N@@H+]3CC[C@](C)(F)C3)cs2)cc1 ZINC000501428727 340080777 /nfs/dbraw/zinc/08/07/77/340080777.db2.gz UKRSNHQTUIHKDD-KRWDZBQOSA-N 1 2 320.433 4.143 20 0 DIADLO CCOc1ccc(-c2nc(C[N@H+]3CC[C@](C)(F)C3)cs2)cc1 ZINC000501428727 340080778 /nfs/dbraw/zinc/08/07/78/340080778.db2.gz UKRSNHQTUIHKDD-KRWDZBQOSA-N 1 2 320.433 4.143 20 0 DIADLO c1cnn(-c2ccc([NH2+][C@H]3CCC[C@@H](c4cccnc4)C3)cc2)c1 ZINC000502238767 340097390 /nfs/dbraw/zinc/09/73/90/340097390.db2.gz CHLNRFWYUMUZFE-APWZRJJASA-N 1 2 318.424 4.406 20 0 DIADLO c1cn(-c2cccc(N[C@H]3CCC[C@@H](c4cccnc4)C3)c2)c[nH+]1 ZINC000502472988 340105161 /nfs/dbraw/zinc/10/51/61/340105161.db2.gz BGUXHIOBHIZUHF-AEFFLSMTSA-N 1 2 318.424 4.406 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1csc2c1CCCC2 ZINC000502496494 340106069 /nfs/dbraw/zinc/10/60/69/340106069.db2.gz VJUKOCFDRICDDY-UHFFFAOYSA-N 1 2 323.421 4.269 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+]3CCc4cccc(F)c4C3)o2)cc1 ZINC000502505074 340106306 /nfs/dbraw/zinc/10/63/06/340106306.db2.gz CEJKTHLGHGTRQR-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+]3CCc4cccc(F)c4C3)o2)cc1 ZINC000502505074 340106307 /nfs/dbraw/zinc/10/63/07/340106307.db2.gz CEJKTHLGHGTRQR-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](c2ccc(F)cc2)C(C)C)n1 ZINC000502525059 340106885 /nfs/dbraw/zinc/10/68/85/340106885.db2.gz UCQDLHDAKPWNBN-KRWDZBQOSA-N 1 2 305.397 4.038 20 0 DIADLO CC[C@H]1C[C@]1([NH2+]Cc1noc(C(C)(C)C)n1)c1cccc(C)c1 ZINC000502529408 340107067 /nfs/dbraw/zinc/10/70/67/340107067.db2.gz NAZJZXFPXRYCBL-IFXJQAMLSA-N 1 2 313.445 4.091 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2cn3cc(Cl)ccc3n2)oc1C ZINC000502685949 340110362 /nfs/dbraw/zinc/11/03/62/340110362.db2.gz LAMWRXNAHHHXSA-NSHDSACASA-N 1 2 303.793 4.048 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](CN2CCCC2)c2ccccc2)oc1C ZINC000502694997 340110996 /nfs/dbraw/zinc/11/09/96/340110996.db2.gz CJGVIPWBRXOQPF-LPHOPBHVSA-N 1 2 312.457 4.384 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+]2CC[C@](F)(c3cc(C)cc(F)c3)C2)o1 ZINC000502887498 340115549 /nfs/dbraw/zinc/11/55/49/340115549.db2.gz MAYHBYZFFGBCNC-SUMWQHHRSA-N 1 2 306.356 4.062 20 0 DIADLO Cc1cnc([C@H](C)[N@H+]2CC[C@](F)(c3cc(C)cc(F)c3)C2)o1 ZINC000502887498 340115550 /nfs/dbraw/zinc/11/55/50/340115550.db2.gz MAYHBYZFFGBCNC-SUMWQHHRSA-N 1 2 306.356 4.062 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+]2CC[C@](F)(c3cc(C)cc(F)c3)C2)o1 ZINC000502887488 340115618 /nfs/dbraw/zinc/11/56/18/340115618.db2.gz MAYHBYZFFGBCNC-CXAGYDPISA-N 1 2 306.356 4.062 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+]2CC[C@](F)(c3cc(C)cc(F)c3)C2)o1 ZINC000502887488 340115619 /nfs/dbraw/zinc/11/56/19/340115619.db2.gz MAYHBYZFFGBCNC-CXAGYDPISA-N 1 2 306.356 4.062 20 0 DIADLO Cc1cc(F)cc2c1C[N@H+]([C@H](C)c1nc3ccccc3o1)CC2 ZINC000502939317 340117066 /nfs/dbraw/zinc/11/70/66/340117066.db2.gz LPAFAOWKYFCKIS-CYBMUJFWSA-N 1 2 310.372 4.395 20 0 DIADLO Cc1cc(F)cc2c1C[N@@H+]([C@H](C)c1nc3ccccc3o1)CC2 ZINC000502939317 340117067 /nfs/dbraw/zinc/11/70/67/340117067.db2.gz LPAFAOWKYFCKIS-CYBMUJFWSA-N 1 2 310.372 4.395 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+]C[C@@H]1C[C@@H]1c1ccccc1 ZINC000503010394 340118725 /nfs/dbraw/zinc/11/87/25/340118725.db2.gz IEIYHNIFBVYQEQ-AZUAARDMSA-N 1 2 322.452 4.047 20 0 DIADLO FC(F)[C@@H]1CCCC[N@@H+]1Cc1cccc(-c2ccncc2)c1 ZINC000503100527 340120995 /nfs/dbraw/zinc/12/09/95/340120995.db2.gz QXXYDOVFGGNFDF-KRWDZBQOSA-N 1 2 302.368 4.368 20 0 DIADLO FC(F)[C@@H]1CCCC[N@H+]1Cc1cccc(-c2ccncc2)c1 ZINC000503100527 340120996 /nfs/dbraw/zinc/12/09/96/340120996.db2.gz QXXYDOVFGGNFDF-KRWDZBQOSA-N 1 2 302.368 4.368 20 0 DIADLO CCCC[C@@H](C)C(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC000503130629 340121598 /nfs/dbraw/zinc/12/15/98/340121598.db2.gz LAYONKMDGXOZHQ-UONOGXRCSA-N 1 2 323.506 4.140 20 0 DIADLO CCCC[C@@H](C)C(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC000503130629 340121599 /nfs/dbraw/zinc/12/15/99/340121599.db2.gz LAYONKMDGXOZHQ-UONOGXRCSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1cc(NC(=O)c2cccs2)c[nH+]c1N1CCCC[C@@H]1C ZINC000503168351 340122415 /nfs/dbraw/zinc/12/24/15/340122415.db2.gz ZYNPASRKEXRCGJ-ZDUSSCGKSA-N 1 2 315.442 4.083 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2)c[nH+]c1N1CCCC[C@@H]1C ZINC000503181285 340122787 /nfs/dbraw/zinc/12/27/87/340122787.db2.gz YHNMSMMSRMRORI-HNNXBMFYSA-N 1 2 309.413 4.021 20 0 DIADLO CCCOc1cccc2c(N[C@@H]3C[C@@H]4OCCC[C@@H]34)cc[nH+]c12 ZINC000503575676 340131379 /nfs/dbraw/zinc/13/13/79/340131379.db2.gz IJCDZKCNYRHYOV-XCRHUMRWSA-N 1 2 312.413 4.003 20 0 DIADLO Fc1cc(-c2ccccc2)ccc1C[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000503580851 340131549 /nfs/dbraw/zinc/13/15/49/340131549.db2.gz GKLFVJWXUMETIJ-IBGZPJMESA-N 1 2 321.399 4.383 20 0 DIADLO Fc1cc(-c2ccccc2)ccc1C[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000503580851 340131550 /nfs/dbraw/zinc/13/15/50/340131550.db2.gz GKLFVJWXUMETIJ-IBGZPJMESA-N 1 2 321.399 4.383 20 0 DIADLO CCCOc1cccc2c(NCc3ncc(CC)o3)cc[nH+]c12 ZINC000503582218 340131608 /nfs/dbraw/zinc/13/16/08/340131608.db2.gz XBJQIMWOAOUFRO-UHFFFAOYSA-N 1 2 311.385 4.186 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]C2(C(F)F)CC2)c2cccc(Br)c21 ZINC000503950076 340138365 /nfs/dbraw/zinc/13/83/65/340138365.db2.gz SMRVRTRZFHYBTK-LDYMZIIASA-N 1 2 316.189 4.385 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1CCC[C@@H]1CCC1CCCCC1 ZINC000504132327 340141408 /nfs/dbraw/zinc/14/14/08/340141408.db2.gz SDMVEJSVKYBKMH-QGZVFWFLSA-N 1 2 315.461 4.169 20 0 DIADLO CCCN(C(=O)Nc1cc[nH+]c(C)c1)[C@H](CC)c1ccccc1 ZINC000504131940 340141410 /nfs/dbraw/zinc/14/14/10/340141410.db2.gz QVUOPTHKLABLMP-GOSISDBHSA-N 1 2 311.429 4.207 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)Nc1ccc(NCC2CCCC2)cc1 ZINC000504156823 340141878 /nfs/dbraw/zinc/14/18/78/340141878.db2.gz NDXSPLXSIJNNRE-UHFFFAOYSA-N 1 2 324.428 4.058 20 0 DIADLO Cc1[nH+]cccc1Cc1nc(-c2cccc(C(F)(F)F)c2)no1 ZINC000504223424 340143294 /nfs/dbraw/zinc/14/32/94/340143294.db2.gz RCRPKFLNEGPYIK-UHFFFAOYSA-N 1 2 319.286 4.050 20 0 DIADLO C(=C\c1ccc(-n2cc[nH+]c2)cc1)\c1nc(-c2ccccc2)no1 ZINC000504373943 340146220 /nfs/dbraw/zinc/14/62/20/340146220.db2.gz IESCUSVIVVVSDX-FLIBITNWSA-N 1 2 314.348 4.093 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1c(F)cccc1F ZINC000504376310 340146371 /nfs/dbraw/zinc/14/63/71/340146371.db2.gz IVTNNOSCKXVFKB-LBPRGKRZSA-N 1 2 320.383 4.388 20 0 DIADLO Cc1ccc(C(=O)Nc2c[nH+]ccc2OC(C)(C)C)cc1Cl ZINC000504646608 340150531 /nfs/dbraw/zinc/15/05/31/340150531.db2.gz IPDIWPQQMZLEMJ-UHFFFAOYSA-N 1 2 318.804 4.473 20 0 DIADLO CC(C)(C)C1CC(NC(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000504785268 340152542 /nfs/dbraw/zinc/15/25/42/340152542.db2.gz LRIBGPCIMZSRGI-UHFFFAOYSA-N 1 2 324.424 4.428 20 0 DIADLO CC(C)CCc1noc(/C=C/c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000505056226 340160272 /nfs/dbraw/zinc/16/02/72/340160272.db2.gz XAPBRODMVFLLPD-UXBLZVDNSA-N 1 2 308.385 4.014 20 0 DIADLO C(=C\c1ccc(-n2cc[nH+]c2)cc1)\c1nc(C2CCCCC2)no1 ZINC000505083381 340160926 /nfs/dbraw/zinc/16/09/26/340160926.db2.gz GMCRJDCKPGPWSY-FLIBITNWSA-N 1 2 320.396 4.473 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H](c2ccc(F)cc2)C(C)C)c(C)[nH+]1 ZINC000505399794 340167696 /nfs/dbraw/zinc/16/76/96/340167696.db2.gz MUICTAKBZPTDRC-QGZVFWFLSA-N 1 2 315.392 4.356 20 0 DIADLO Cc1cnc(C[NH+](Cc2cccs2)Cc2cccs2)cn1 ZINC000505636489 340173805 /nfs/dbraw/zinc/17/38/05/340173805.db2.gz LCRCHDHZOARWTB-UHFFFAOYSA-N 1 2 315.467 4.110 20 0 DIADLO CCCn1c(C[N@H+](C)Cc2cccc(OC)c2)nc2ccccc21 ZINC000505666363 340174717 /nfs/dbraw/zinc/17/47/17/340174717.db2.gz WGSRZQXNURODLE-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO CCCn1c(C[N@@H+](C)Cc2cccc(OC)c2)nc2ccccc21 ZINC000505666363 340174718 /nfs/dbraw/zinc/17/47/18/340174718.db2.gz WGSRZQXNURODLE-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO C(=C/[C@H]1CCC[N@H+]1Cc1nc(C2CCCC2)no1)\c1ccccc1 ZINC000505819234 340178794 /nfs/dbraw/zinc/17/87/94/340178794.db2.gz LXTWPCXSZSSXIJ-QFQMRYFISA-N 1 2 323.440 4.405 20 0 DIADLO C(=C/[C@H]1CCC[N@@H+]1Cc1nc(C2CCCC2)no1)\c1ccccc1 ZINC000505819234 340178795 /nfs/dbraw/zinc/17/87/95/340178795.db2.gz LXTWPCXSZSSXIJ-QFQMRYFISA-N 1 2 323.440 4.405 20 0 DIADLO CCCCc1noc(C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)n1 ZINC000505830310 340179043 /nfs/dbraw/zinc/17/90/43/340179043.db2.gz FTWRCUISYVTXLL-MUSGIIIZSA-N 1 2 311.429 4.090 20 0 DIADLO CCCCc1noc(C[N@H+]2CCC[C@@H]2/C=C\c2ccccc2)n1 ZINC000505830310 340179044 /nfs/dbraw/zinc/17/90/44/340179044.db2.gz FTWRCUISYVTXLL-MUSGIIIZSA-N 1 2 311.429 4.090 20 0 DIADLO Cc1cnc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000505863706 340179918 /nfs/dbraw/zinc/17/99/18/340179918.db2.gz GGTFROXOUDRSFG-MRXNPFEDSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1cnc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000505863706 340179919 /nfs/dbraw/zinc/17/99/19/340179919.db2.gz GGTFROXOUDRSFG-MRXNPFEDSA-N 1 2 322.239 4.429 20 0 DIADLO CCCCC[N@H+](Cc1csnn1)Cc1ccc(Cl)cc1 ZINC000506112616 340185918 /nfs/dbraw/zinc/18/59/18/340185918.db2.gz JDHLKLGKDGKENZ-UHFFFAOYSA-N 1 2 309.866 4.384 20 0 DIADLO CCCCC[N@@H+](Cc1csnn1)Cc1ccc(Cl)cc1 ZINC000506112616 340185919 /nfs/dbraw/zinc/18/59/19/340185919.db2.gz JDHLKLGKDGKENZ-UHFFFAOYSA-N 1 2 309.866 4.384 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1cc(Br)ccc1F ZINC000506232762 340189402 /nfs/dbraw/zinc/18/94/02/340189402.db2.gz CLEDGIDSSOPQLY-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1cc(Br)ccc1F ZINC000506232762 340189403 /nfs/dbraw/zinc/18/94/03/340189403.db2.gz CLEDGIDSSOPQLY-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO COc1ccc(C)cc1C[N@@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000506283000 340191101 /nfs/dbraw/zinc/19/11/01/340191101.db2.gz QDMCOWUPISANSK-UHFFFAOYSA-N 1 2 306.409 4.043 20 0 DIADLO COc1ccc(C)cc1C[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000506283000 340191102 /nfs/dbraw/zinc/19/11/02/340191102.db2.gz QDMCOWUPISANSK-UHFFFAOYSA-N 1 2 306.409 4.043 20 0 DIADLO Clc1ccc(C[N@@H+]2CCc3[nH]c4ccccc4c3C2)s1 ZINC000506293310 340191381 /nfs/dbraw/zinc/19/13/81/340191381.db2.gz CGBBPWIBPRXUBV-UHFFFAOYSA-N 1 2 302.830 4.441 20 0 DIADLO Clc1ccc(C[N@H+]2CCc3[nH]c4ccccc4c3C2)s1 ZINC000506293310 340191382 /nfs/dbraw/zinc/19/13/82/340191382.db2.gz CGBBPWIBPRXUBV-UHFFFAOYSA-N 1 2 302.830 4.441 20 0 DIADLO COc1ccccc1/C=C/C[N@@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000506299258 340191633 /nfs/dbraw/zinc/19/16/33/340191633.db2.gz UMBSCEFGGONLLH-SOFGYWHQSA-N 1 2 318.420 4.248 20 0 DIADLO COc1ccccc1/C=C/C[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000506299258 340191634 /nfs/dbraw/zinc/19/16/34/340191634.db2.gz UMBSCEFGGONLLH-SOFGYWHQSA-N 1 2 318.420 4.248 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2nc3ccccc3[nH]2)C2CC2)o1 ZINC000506553719 340196672 /nfs/dbraw/zinc/19/66/72/340196672.db2.gz CSEFRCVBOYXXKF-BBRMVZONSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2nc3ccccc3[nH]2)C2CC2)o1 ZINC000506553719 340196673 /nfs/dbraw/zinc/19/66/73/340196673.db2.gz CSEFRCVBOYXXKF-BBRMVZONSA-N 1 2 321.424 4.444 20 0 DIADLO c1csc(-c2ncc(C[N@@H+]3CCc4sccc4C3)s2)c1 ZINC000506689999 340199571 /nfs/dbraw/zinc/19/95/71/340199571.db2.gz PFRRGCADDYAOTE-UHFFFAOYSA-N 1 2 318.492 4.491 20 0 DIADLO c1csc(-c2ncc(C[N@H+]3CCc4sccc4C3)s2)c1 ZINC000506689999 340199572 /nfs/dbraw/zinc/19/95/72/340199572.db2.gz PFRRGCADDYAOTE-UHFFFAOYSA-N 1 2 318.492 4.491 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2cc(Cl)ccc2F)c1OC ZINC000506791324 340202044 /nfs/dbraw/zinc/20/20/44/340202044.db2.gz XZJMOYJGXJXBRT-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2cc(Cl)ccc2F)c1OC ZINC000506791324 340202045 /nfs/dbraw/zinc/20/20/45/340202045.db2.gz XZJMOYJGXJXBRT-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO C[C@@H]1CCc2nc(C[N@@H+]3CCC[C@H](C(F)(F)F)C3)sc2C1 ZINC000506803353 340202206 /nfs/dbraw/zinc/20/22/06/340202206.db2.gz GJSISBIGQZBBGZ-MNOVXSKESA-N 1 2 318.408 4.042 20 0 DIADLO C[C@@H]1CCc2nc(C[N@H+]3CCC[C@H](C(F)(F)F)C3)sc2C1 ZINC000506803353 340202207 /nfs/dbraw/zinc/20/22/07/340202207.db2.gz GJSISBIGQZBBGZ-MNOVXSKESA-N 1 2 318.408 4.042 20 0 DIADLO C[C@@H](C(=O)Nc1ccn2cc[nH+]c2c1)c1ccc2ccccc2c1 ZINC000506889013 340203218 /nfs/dbraw/zinc/20/32/18/340203218.db2.gz CXVMWISOLQBDPB-CQSZACIVSA-N 1 2 315.376 4.230 20 0 DIADLO CCCCN(C)C(=O)Nc1c[nH+]c(N2CCCC[C@@H]2C)c(C)c1 ZINC000506981563 340204677 /nfs/dbraw/zinc/20/46/77/340204677.db2.gz CRUHFKCLILZGKD-HNNXBMFYSA-N 1 2 318.465 4.033 20 0 DIADLO CC[C@H](C)N(C)C(=O)Nc1c[nH+]c(N2CCCC[C@@H]2C)c(C)c1 ZINC000506988173 340204787 /nfs/dbraw/zinc/20/47/87/340204787.db2.gz TUMZZGRBSMXSQH-GJZGRUSLSA-N 1 2 318.465 4.031 20 0 DIADLO CCCCc1nc(C[N@H+](Cc2ccccc2)[C@H](C)C2CC2)no1 ZINC000507003832 340205089 /nfs/dbraw/zinc/20/50/89/340205089.db2.gz YSDGTWNQMYUIGF-OAHLLOKOSA-N 1 2 313.445 4.213 20 0 DIADLO CCCCc1nc(C[N@@H+](Cc2ccccc2)[C@H](C)C2CC2)no1 ZINC000507003832 340205090 /nfs/dbraw/zinc/20/50/90/340205090.db2.gz YSDGTWNQMYUIGF-OAHLLOKOSA-N 1 2 313.445 4.213 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)n1 ZINC000507038429 340206019 /nfs/dbraw/zinc/20/60/19/340206019.db2.gz KFJPOSYAZOQFMA-KRWDZBQOSA-N 1 2 319.424 4.284 20 0 DIADLO Cc1ccc(-c2csc(CSCCn3cc[nH+]c3)n2)cc1 ZINC000507081009 340206785 /nfs/dbraw/zinc/20/67/85/340206785.db2.gz GKOIZRCWPODAJG-UHFFFAOYSA-N 1 2 315.467 4.248 20 0 DIADLO COCc1nc(C[N@H+](Cc2cccc(Cl)c2)C(C)C)cs1 ZINC000507143104 340209424 /nfs/dbraw/zinc/20/94/24/340209424.db2.gz LZRDUUMZGCKCQY-UHFFFAOYSA-N 1 2 324.877 4.354 20 0 DIADLO COCc1nc(C[N@@H+](Cc2cccc(Cl)c2)C(C)C)cs1 ZINC000507143104 340209425 /nfs/dbraw/zinc/20/94/25/340209425.db2.gz LZRDUUMZGCKCQY-UHFFFAOYSA-N 1 2 324.877 4.354 20 0 DIADLO COc1ccc(F)c(C[N@H+](Cc2ccccc2OC)C2CC2)c1 ZINC000507171229 340210800 /nfs/dbraw/zinc/21/08/00/340210800.db2.gz TWFKXNYUEYULLZ-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO COc1ccc(F)c(C[N@@H+](Cc2ccccc2OC)C2CC2)c1 ZINC000507171229 340210801 /nfs/dbraw/zinc/21/08/01/340210801.db2.gz TWFKXNYUEYULLZ-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO Cc1cccc2ncc(C[N@@H+](C)[C@@H](C)c3cc(F)ccc3F)n21 ZINC000507201634 340212934 /nfs/dbraw/zinc/21/29/34/340212934.db2.gz GYYGOYOIKBEOCY-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1cccc2ncc(C[N@H+](C)[C@@H](C)c3cc(F)ccc3F)n21 ZINC000507201634 340212935 /nfs/dbraw/zinc/21/29/35/340212935.db2.gz GYYGOYOIKBEOCY-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1[nH+]c2ccccn2c1CN(C)[C@H](C)c1c(F)cccc1F ZINC000507202541 340212954 /nfs/dbraw/zinc/21/29/54/340212954.db2.gz JXKKLOOEXUENFT-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1nc2ccccn2c1C[N@@H+](C)[C@H](C)c1c(F)cccc1F ZINC000507202541 340212955 /nfs/dbraw/zinc/21/29/55/340212955.db2.gz JXKKLOOEXUENFT-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1nc2ccccn2c1C[N@H+](C)[C@H](C)c1c(F)cccc1F ZINC000507202541 340212956 /nfs/dbraw/zinc/21/29/56/340212956.db2.gz JXKKLOOEXUENFT-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO CCn1nccc1C[N@H+](C)[C@@H](C)c1cc(Cl)ccc1Cl ZINC000507222438 340214233 /nfs/dbraw/zinc/21/42/33/340214233.db2.gz URVKKWXMBLQUNF-NSHDSACASA-N 1 2 312.244 4.403 20 0 DIADLO CCn1nccc1C[N@@H+](C)[C@@H](C)c1cc(Cl)ccc1Cl ZINC000507222438 340214234 /nfs/dbraw/zinc/21/42/34/340214234.db2.gz URVKKWXMBLQUNF-NSHDSACASA-N 1 2 312.244 4.403 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1coc(-c2cccs2)n1 ZINC000507463424 340220884 /nfs/dbraw/zinc/22/08/84/340220884.db2.gz SWCUAAHQHOWYQZ-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO C[C@H](Nc1cccc([NH+]2CCCCCC2)c1)[C@H]1CCCOC1 ZINC000507480625 340221725 /nfs/dbraw/zinc/22/17/25/340221725.db2.gz PGYVCBWZNPYXBU-IRXDYDNUSA-N 1 2 302.462 4.294 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+]Cc1nc(C(C)C)c(C)s1 ZINC000507526887 340224348 /nfs/dbraw/zinc/22/43/48/340224348.db2.gz LQBJEJQZRKFWFX-LBPRGKRZSA-N 1 2 303.475 4.383 20 0 DIADLO CC[N@H+](Cc1cccc(O)c1Cl)[C@@H](C)c1cccc(O)c1 ZINC000507561392 340225193 /nfs/dbraw/zinc/22/51/93/340225193.db2.gz ASQKVMXVZHSHGD-LBPRGKRZSA-N 1 2 305.805 4.334 20 0 DIADLO CC[N@@H+](Cc1cccc(O)c1Cl)[C@@H](C)c1cccc(O)c1 ZINC000507561392 340225194 /nfs/dbraw/zinc/22/51/94/340225194.db2.gz ASQKVMXVZHSHGD-LBPRGKRZSA-N 1 2 305.805 4.334 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(O)c2Cl)C[C@H](c2ccccc2)O1 ZINC000507784000 340231423 /nfs/dbraw/zinc/23/14/23/340231423.db2.gz HHTTZIOMMUZNHW-SUMWQHHRSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(O)c2Cl)C[C@H](c2ccccc2)O1 ZINC000507784000 340231424 /nfs/dbraw/zinc/23/14/24/340231424.db2.gz HHTTZIOMMUZNHW-SUMWQHHRSA-N 1 2 317.816 4.008 20 0 DIADLO Fc1cccc(C[N@@H+]2CCO[C@@H](c3ccccc3Cl)C2)c1 ZINC000507804528 340232234 /nfs/dbraw/zinc/23/22/34/340232234.db2.gz PADYQMLJYQRXDJ-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1cccc(C[N@H+]2CCO[C@@H](c3ccccc3Cl)C2)c1 ZINC000507804528 340232235 /nfs/dbraw/zinc/23/22/35/340232235.db2.gz PADYQMLJYQRXDJ-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO CCCc1nc(C[N@H+](Cc2ccccc2)CC(C)(C)C)no1 ZINC000507819786 340233240 /nfs/dbraw/zinc/23/32/40/340233240.db2.gz WOBFSGIVAQVYGM-UHFFFAOYSA-N 1 2 301.434 4.070 20 0 DIADLO CCCc1nc(C[N@@H+](Cc2ccccc2)CC(C)(C)C)no1 ZINC000507819786 340233241 /nfs/dbraw/zinc/23/32/41/340233241.db2.gz WOBFSGIVAQVYGM-UHFFFAOYSA-N 1 2 301.434 4.070 20 0 DIADLO c1cc(Sc2ccccn2)oc1C[NH+]1Cc2ccccc2C1 ZINC000508250813 340241417 /nfs/dbraw/zinc/24/14/17/340241417.db2.gz WNLVKOZOCVYFGL-UHFFFAOYSA-N 1 2 308.406 4.342 20 0 DIADLO COCC[N@H+](Cc1csc(C(C)C)n1)[C@@H](C)c1ccccc1 ZINC000508531071 340245834 /nfs/dbraw/zinc/24/58/34/340245834.db2.gz KRGOGVCLXPXVBL-HNNXBMFYSA-N 1 2 318.486 4.476 20 0 DIADLO COCC[N@@H+](Cc1csc(C(C)C)n1)[C@@H](C)c1ccccc1 ZINC000508531071 340245835 /nfs/dbraw/zinc/24/58/35/340245835.db2.gz KRGOGVCLXPXVBL-HNNXBMFYSA-N 1 2 318.486 4.476 20 0 DIADLO Cc1cc(NC(=O)[C@H](C)C(C)(F)F)ccc1Oc1cc[nH+]cc1 ZINC000508740020 340252047 /nfs/dbraw/zinc/25/20/47/340252047.db2.gz FIGZFSXOQNSODL-LBPRGKRZSA-N 1 2 320.339 4.412 20 0 DIADLO C[N@H+](Cc1cc2ccccc2o1)Cc1cccc(O)c1Cl ZINC000508776849 340252822 /nfs/dbraw/zinc/25/28/22/340252822.db2.gz AMMPVDMLZCYYQP-UHFFFAOYSA-N 1 2 301.773 4.424 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2o1)Cc1cccc(O)c1Cl ZINC000508776849 340252823 /nfs/dbraw/zinc/25/28/23/340252823.db2.gz AMMPVDMLZCYYQP-UHFFFAOYSA-N 1 2 301.773 4.424 20 0 DIADLO C[C@@H](NC(=O)c1ccccc1Oc1cc[nH+]cc1)c1cccs1 ZINC000509027251 340258686 /nfs/dbraw/zinc/25/86/86/340258686.db2.gz VHIOMDMOAFCOAA-CYBMUJFWSA-N 1 2 324.405 4.426 20 0 DIADLO COc1ccc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)cc1 ZINC000509030521 340258796 /nfs/dbraw/zinc/25/87/96/340258796.db2.gz OIMKPCKNJDDAHJ-UHFFFAOYSA-N 1 2 320.348 4.135 20 0 DIADLO Cc1ccc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)cc1 ZINC000509032894 340258865 /nfs/dbraw/zinc/25/88/65/340258865.db2.gz ZZIRLOFRYJPZFG-UHFFFAOYSA-N 1 2 304.349 4.435 20 0 DIADLO Cc1nocc1C[N@@H+]1CCc2c(Cl)cc(Cl)cc2[C@H]1C ZINC000509051290 340259566 /nfs/dbraw/zinc/25/95/66/340259566.db2.gz YUHBLYKNVAFYRK-SNVBAGLBSA-N 1 2 311.212 4.409 20 0 DIADLO Cc1nocc1C[N@H+]1CCc2c(Cl)cc(Cl)cc2[C@H]1C ZINC000509051290 340259567 /nfs/dbraw/zinc/25/95/67/340259567.db2.gz YUHBLYKNVAFYRK-SNVBAGLBSA-N 1 2 311.212 4.409 20 0 DIADLO Cc1ccccc1CNC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509060468 340259976 /nfs/dbraw/zinc/25/99/76/340259976.db2.gz LNWYYCHKDLCTEL-UHFFFAOYSA-N 1 2 318.376 4.112 20 0 DIADLO O=C(N[C@@H]1CC2CCC1CC2)c1ccccc1Oc1cc[nH+]cc1 ZINC000509189509 340263474 /nfs/dbraw/zinc/26/34/74/340263474.db2.gz ZXMPYBYJPXNTLU-JTTJXQCZSA-N 1 2 322.408 4.182 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)C2C[C@@H](C)C[C@H](C)C2)[nH+]1 ZINC000509256154 340264596 /nfs/dbraw/zinc/26/45/96/340264596.db2.gz HTHXOGUUCUOUMI-STQMWFEESA-N 1 2 311.429 4.396 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)C2C[C@H](C)C[C@@H](C)C2)[nH+]1 ZINC000509256144 340264607 /nfs/dbraw/zinc/26/46/07/340264607.db2.gz HTHXOGUUCUOUMI-CHWSQXEVSA-N 1 2 311.429 4.396 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+]3CCOC(C)(C)[C@@H]3C)n2)cc1 ZINC000509357938 340267085 /nfs/dbraw/zinc/26/70/85/340267085.db2.gz MBJNXXUWHBXNLK-AWEZNQCLSA-N 1 2 316.470 4.118 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+]3CCOC(C)(C)[C@@H]3C)n2)cc1 ZINC000509357938 340267086 /nfs/dbraw/zinc/26/70/86/340267086.db2.gz MBJNXXUWHBXNLK-AWEZNQCLSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@@H]1CCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509364641 340267425 /nfs/dbraw/zinc/26/74/25/340267425.db2.gz JXSNCNYCLHSLRI-OAHLLOKOSA-N 1 2 310.397 4.136 20 0 DIADLO O=C(c1ccccc1Oc1cc[nH+]cc1)N1C[C@H]2CCCC[C@@H]2C1 ZINC000509370787 340267602 /nfs/dbraw/zinc/26/76/02/340267602.db2.gz JYJFJOGWCDPQDH-HZPDHXFCSA-N 1 2 322.408 4.136 20 0 DIADLO O=C(c1ccccc1Oc1cc[nH+]cc1)N1C[C@@H]2CCCC[C@H]2C1 ZINC000509370785 340267674 /nfs/dbraw/zinc/26/76/74/340267674.db2.gz JYJFJOGWCDPQDH-HOTGVXAUSA-N 1 2 322.408 4.136 20 0 DIADLO Cc1ccc([C@@H]2OCCC[C@H]2Nc2[nH+]c3ccccc3n2C)cc1 ZINC000509555126 340273321 /nfs/dbraw/zinc/27/33/21/340273321.db2.gz SULUDPLKTBRXJM-MJGOQNOKSA-N 1 2 321.424 4.214 20 0 DIADLO Cn1ncc2c1nc[nH+]c2N[C@@H](CC1CCCC1)c1ccccc1 ZINC000509563797 340273583 /nfs/dbraw/zinc/27/35/83/340273583.db2.gz LLFHZPFRYMFNGG-KRWDZBQOSA-N 1 2 321.428 4.097 20 0 DIADLO C[C@@H](F)CC[N@@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000509673158 340276411 /nfs/dbraw/zinc/27/64/11/340276411.db2.gz NGSNQVGSQXQXFN-QMTHXVAHSA-N 1 2 306.208 4.115 20 0 DIADLO C[C@@H](F)CC[N@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000509673158 340276412 /nfs/dbraw/zinc/27/64/12/340276412.db2.gz NGSNQVGSQXQXFN-QMTHXVAHSA-N 1 2 306.208 4.115 20 0 DIADLO C[C@H](F)CC[N@@H+]1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000509695918 340277283 /nfs/dbraw/zinc/27/72/83/340277283.db2.gz IARIPZPWFYQISR-XPTSAGLGSA-N 1 2 324.198 4.254 20 0 DIADLO C[C@H](F)CC[N@H+]1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000509695918 340277284 /nfs/dbraw/zinc/27/72/84/340277284.db2.gz IARIPZPWFYQISR-XPTSAGLGSA-N 1 2 324.198 4.254 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)c1oc2ccc(Cl)cc2c1C ZINC000509775915 340278889 /nfs/dbraw/zinc/27/88/89/340278889.db2.gz MXFCEVLIXZFOLZ-UHFFFAOYSA-N 1 2 314.772 4.026 20 0 DIADLO Cc1cc(CSc2[nH+]cc3ccccn32)c2ccccc2n1 ZINC000509966686 340284153 /nfs/dbraw/zinc/28/41/53/340284153.db2.gz HMHSDXSQCYBCQK-UHFFFAOYSA-N 1 2 305.406 4.483 20 0 DIADLO Cn1c2ccccc2[nH+]c1CCSc1ccc2ccccc2n1 ZINC000509980449 340284540 /nfs/dbraw/zinc/28/45/40/340284540.db2.gz BGZZZLKIEDBGFH-UHFFFAOYSA-N 1 2 319.433 4.456 20 0 DIADLO CCC(CC)NC(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000510068180 340287128 /nfs/dbraw/zinc/28/71/28/340287128.db2.gz JUNUQJYTLBICRQ-UHFFFAOYSA-N 1 2 318.804 4.446 20 0 DIADLO C[C@H](CC1CCCC1)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000510087315 340288271 /nfs/dbraw/zinc/28/82/71/340288271.db2.gz GPVGTAAZUJDUJT-CYBMUJFWSA-N 1 2 315.392 4.166 20 0 DIADLO FC(F)C1(NCc2cn3cc(Cl)ccc3[nH+]2)CCCCC1 ZINC000510106131 340288993 /nfs/dbraw/zinc/28/89/93/340288993.db2.gz PWYFBMRJFWPATB-UHFFFAOYSA-N 1 2 313.779 4.045 20 0 DIADLO Clc1cccc(CC[N@@H+]2CCCC[C@H]2c2cc[nH]n2)c1Cl ZINC000510146111 340290589 /nfs/dbraw/zinc/29/05/89/340290589.db2.gz WHKOGSALUVIMNB-HNNXBMFYSA-N 1 2 324.255 4.486 20 0 DIADLO Clc1cccc(CC[N@H+]2CCCC[C@H]2c2cc[nH]n2)c1Cl ZINC000510146111 340290590 /nfs/dbraw/zinc/29/05/90/340290590.db2.gz WHKOGSALUVIMNB-HNNXBMFYSA-N 1 2 324.255 4.486 20 0 DIADLO Cn1c2ccccc2nc1[C@H]1CCC[N@@H+]1Cc1ccccc1F ZINC000510445240 340299676 /nfs/dbraw/zinc/29/96/76/340299676.db2.gz DUMHEIIQIBNTRZ-GOSISDBHSA-N 1 2 309.388 4.050 20 0 DIADLO Cn1c2ccccc2nc1[C@H]1CCC[N@H+]1Cc1ccccc1F ZINC000510445240 340299677 /nfs/dbraw/zinc/29/96/77/340299677.db2.gz DUMHEIIQIBNTRZ-GOSISDBHSA-N 1 2 309.388 4.050 20 0 DIADLO O=C(C[C@@H]1C[C@H]1c1ccccc1)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000510860734 340313190 /nfs/dbraw/zinc/31/31/90/340313190.db2.gz UEKUUMDVNAMQQE-WMZOPIPTSA-N 1 2 317.392 4.209 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@H+](C)Cc1nc(-c2cccs2)no1 ZINC000511083362 340320180 /nfs/dbraw/zinc/32/01/80/340320180.db2.gz YLCOWPARGYIGTF-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@@H+](C)Cc1nc(-c2cccs2)no1 ZINC000511083362 340320181 /nfs/dbraw/zinc/32/01/81/340320181.db2.gz YLCOWPARGYIGTF-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@H+](C)Cc1nc(-c2cccs2)no1 ZINC000511083361 340320202 /nfs/dbraw/zinc/32/02/02/340320202.db2.gz YLCOWPARGYIGTF-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@@H+](C)Cc1nc(-c2cccs2)no1 ZINC000511083361 340320203 /nfs/dbraw/zinc/32/02/03/340320203.db2.gz YLCOWPARGYIGTF-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccc(F)cc2Cl)CC2CC2)o1 ZINC000511107043 340320878 /nfs/dbraw/zinc/32/08/78/340320878.db2.gz NFZYAJFEJVEBBT-UHFFFAOYSA-N 1 2 308.784 4.188 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccc(F)cc2Cl)CC2CC2)o1 ZINC000511107043 340320879 /nfs/dbraw/zinc/32/08/79/340320879.db2.gz NFZYAJFEJVEBBT-UHFFFAOYSA-N 1 2 308.784 4.188 20 0 DIADLO C[N@H+](Cc1ccoc1)Cc1ccc(Cl)cc1Br ZINC000511479872 340328070 /nfs/dbraw/zinc/32/80/70/340328070.db2.gz IQPCJNSPUKIRRK-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO C[N@@H+](Cc1ccoc1)Cc1ccc(Cl)cc1Br ZINC000511479872 340328071 /nfs/dbraw/zinc/32/80/71/340328071.db2.gz IQPCJNSPUKIRRK-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000511555566 340330408 /nfs/dbraw/zinc/33/04/08/340330408.db2.gz XZFQCIUYCCDJGY-MRXNPFEDSA-N 1 2 317.477 4.112 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000511555565 340330463 /nfs/dbraw/zinc/33/04/63/340330463.db2.gz XZFQCIUYCCDJGY-INIZCTEOSA-N 1 2 317.477 4.112 20 0 DIADLO Cc1cccc(NC(=O)C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c1 ZINC000511584846 340331247 /nfs/dbraw/zinc/33/12/47/340331247.db2.gz KBXHAIGRTGPDSZ-KRWDZBQOSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1cccc(NC(=O)C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)c1 ZINC000511584846 340331248 /nfs/dbraw/zinc/33/12/48/340331248.db2.gz KBXHAIGRTGPDSZ-KRWDZBQOSA-N 1 2 314.816 4.034 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2ccc3occc3c2)c(F)c1F ZINC000511766921 340337774 /nfs/dbraw/zinc/33/77/74/340337774.db2.gz AUNMHKRMGLCGPX-UHFFFAOYSA-N 1 2 309.262 4.279 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Cl)s2)C[C@H](c2ccccc2)O1 ZINC000511838179 340339760 /nfs/dbraw/zinc/33/97/60/340339760.db2.gz LZEVYYJEPUMQIA-SWLSCSKDSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Cl)s2)C[C@H](c2ccccc2)O1 ZINC000511838179 340339761 /nfs/dbraw/zinc/33/97/61/340339761.db2.gz LZEVYYJEPUMQIA-SWLSCSKDSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1cccn2cc(CNc3ccccc3CC(F)(F)F)[nH+]c12 ZINC000172929819 340348762 /nfs/dbraw/zinc/34/87/62/340348762.db2.gz DRXLPNGOCXATMM-UHFFFAOYSA-N 1 2 319.330 4.360 20 0 DIADLO Cc1cccc2[nH+]c(CSCCCCC3CCOCC3)cn21 ZINC000512338150 340357985 /nfs/dbraw/zinc/35/79/85/340357985.db2.gz WMZVRBROOFTWTK-UHFFFAOYSA-N 1 2 318.486 4.473 20 0 DIADLO Clc1cccc(Cl)c1CN1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000512517622 340365130 /nfs/dbraw/zinc/36/51/30/340365130.db2.gz YUNDRTPQGWAYDM-CQSZACIVSA-N 1 2 310.228 4.444 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000173603999 340368528 /nfs/dbraw/zinc/36/85/28/340368528.db2.gz PAHXYXPDNCSHCD-UONOGXRCSA-N 1 2 321.207 4.439 20 0 DIADLO CCC[N@@H+](Cc1ccc(OC(F)F)c(OCC)c1)CC(F)F ZINC000512619556 340369315 /nfs/dbraw/zinc/36/93/15/340369315.db2.gz ZDEFPNHQJYOKIZ-UHFFFAOYSA-N 1 2 323.330 4.164 20 0 DIADLO CCC[N@H+](Cc1ccc(OC(F)F)c(OCC)c1)CC(F)F ZINC000512619556 340369316 /nfs/dbraw/zinc/36/93/16/340369316.db2.gz ZDEFPNHQJYOKIZ-UHFFFAOYSA-N 1 2 323.330 4.164 20 0 DIADLO C[C@@H]([NH2+]C/C=C/c1ccccc1)c1nc(C2CCCCC2)no1 ZINC000173866605 340376290 /nfs/dbraw/zinc/37/62/90/340376290.db2.gz YJXONKNQJXXOSR-KUCQQTCKSA-N 1 2 311.429 4.481 20 0 DIADLO C[C@@H]1CC[C@H](C)C[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000174008168 340379962 /nfs/dbraw/zinc/37/99/62/340379962.db2.gz PLZBJAPGSOIOHJ-WDEREUQCSA-N 1 2 315.244 4.052 20 0 DIADLO C[C@@H]1CC[C@H](C)C[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000174008168 340379963 /nfs/dbraw/zinc/37/99/63/340379963.db2.gz PLZBJAPGSOIOHJ-WDEREUQCSA-N 1 2 315.244 4.052 20 0 DIADLO Cc1ccc2[nH]cc(CCC(=O)Nc3c(C)cc(C)[nH+]c3C)c2c1 ZINC000174028969 340380575 /nfs/dbraw/zinc/38/05/75/340380575.db2.gz VBOXXOVEBKVQBU-UHFFFAOYSA-N 1 2 321.424 4.368 20 0 DIADLO CCN(CC)c1ncc(C[NH2+]C2(C(F)F)CCCCC2)s1 ZINC000512885231 340382513 /nfs/dbraw/zinc/38/25/13/340382513.db2.gz MPECDLBBNISTCN-UHFFFAOYSA-N 1 2 317.449 4.047 20 0 DIADLO CC(C)Cn1cc[nH+]c1CNC(=O)Nc1cccc2ccccc21 ZINC000174228260 340384488 /nfs/dbraw/zinc/38/44/88/340384488.db2.gz PJHHOOYMORTCMW-UHFFFAOYSA-N 1 2 322.412 4.014 20 0 DIADLO FC(F)(C[NH2+]C/C=C\c1ccncc1)c1ccc(Cl)cc1 ZINC000512983808 340386844 /nfs/dbraw/zinc/38/68/44/340386844.db2.gz XCWQFJPKJFEDKX-UPHRSURJSA-N 1 2 308.759 4.130 20 0 DIADLO FC(F)(C[NH2+]C/C=C/c1ccncc1)c1ccc(Cl)cc1 ZINC000512983807 340386862 /nfs/dbraw/zinc/38/68/62/340386862.db2.gz XCWQFJPKJFEDKX-OWOJBTEDSA-N 1 2 308.759 4.130 20 0 DIADLO CCC[C@H](CNc1ccc(Cn2cc[nH+]c2)cn1)c1ccccc1 ZINC000513047453 340390741 /nfs/dbraw/zinc/39/07/41/340390741.db2.gz RYVWXUYFMXQKHZ-LJQANCHMSA-N 1 2 320.440 4.322 20 0 DIADLO CCC(C)(C)C1CCC(CC(=O)N[C@H](C)Cn2cc[nH+]c2)CC1 ZINC000513053049 340390975 /nfs/dbraw/zinc/39/09/75/340390975.db2.gz ALWCNJLYALBJJZ-KLAILNCOSA-N 1 2 319.493 4.021 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)cc1Cl)c1c(F)cncc1F ZINC000513090629 340392802 /nfs/dbraw/zinc/39/28/02/340392802.db2.gz VIUDCQSEURDLAN-MRVPVSSYSA-N 1 2 300.711 4.003 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)cc1Cl)c1c(F)cncc1F ZINC000513090630 340392897 /nfs/dbraw/zinc/39/28/97/340392897.db2.gz VIUDCQSEURDLAN-QMMMGPOBSA-N 1 2 300.711 4.003 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)c(Cl)c1)c1c(F)cncc1F ZINC000513106750 340393563 /nfs/dbraw/zinc/39/35/63/340393563.db2.gz QVZUOQOUMAFONH-QMMMGPOBSA-N 1 2 300.711 4.003 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1ccncc1Cl)CCC2 ZINC000174858018 340397743 /nfs/dbraw/zinc/39/77/43/340397743.db2.gz NZEWRAHIQBVWGP-CQSZACIVSA-N 1 2 307.850 4.009 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccncc1Cl)CCC2 ZINC000174858018 340397744 /nfs/dbraw/zinc/39/77/44/340397744.db2.gz NZEWRAHIQBVWGP-CQSZACIVSA-N 1 2 307.850 4.009 20 0 DIADLO Cc1nc(CSCc2ccc(-n3cc[nH+]c3)cc2)cs1 ZINC000177844025 340444165 /nfs/dbraw/zinc/44/41/65/340444165.db2.gz LAOQZMWDEGWFQB-UHFFFAOYSA-N 1 2 301.440 4.071 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@]2(C)Cc2ccccc2)cc[nH+]1 ZINC000185554988 340502701 /nfs/dbraw/zinc/50/27/01/340502701.db2.gz QZTDBELUGNNBQY-LJQANCHMSA-N 1 2 309.413 4.019 20 0 DIADLO CCCCCc1[nH+]c2ccccc2n1C[C@H](O)CC(F)(F)F ZINC000189309830 340533604 /nfs/dbraw/zinc/53/36/04/340533604.db2.gz BIQMWQHSIATKJK-GFCCVEGCSA-N 1 2 314.351 4.082 20 0 DIADLO C[C@]1(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)C[C@H]2C[C@H]2C1 ZINC000521918128 340557049 /nfs/dbraw/zinc/55/70/49/340557049.db2.gz XIGBMUUSFDBYKL-BDQBCWGISA-N 1 2 308.381 4.249 20 0 DIADLO CC[C@H](C)OCC(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000191956610 340560609 /nfs/dbraw/zinc/56/06/09/340560609.db2.gz AHGGIIOGJATDPY-ZDUSSCGKSA-N 1 2 314.429 4.420 20 0 DIADLO FC(F)(F)c1cccc(C[NH2+]Cc2ncc(Cl)s2)c1 ZINC000225296916 340566440 /nfs/dbraw/zinc/56/64/40/340566440.db2.gz CGIHPGSKNWYEDA-UHFFFAOYSA-N 1 2 306.740 4.105 20 0 DIADLO Cc1cc(NC(=O)Cc2ccccc2)ccc1Oc1cc[nH+]cc1 ZINC000193184297 340573612 /nfs/dbraw/zinc/57/36/12/340573612.db2.gz AEHTVNPFETYDHQ-UHFFFAOYSA-N 1 2 318.376 4.364 20 0 DIADLO Cc1occc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(C)c1 ZINC000193189279 340573849 /nfs/dbraw/zinc/57/38/49/340573849.db2.gz TXIZALNHLOSWRP-UHFFFAOYSA-N 1 2 308.337 4.336 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc3[nH+]c(N(C)C)ccc3c2)c(C)c1 ZINC000195705094 340586042 /nfs/dbraw/zinc/58/60/42/340586042.db2.gz YBDWRCFMCYHYNE-UHFFFAOYSA-N 1 2 319.408 4.170 20 0 DIADLO Fc1ccc(CNc2ccc(N3CCCC3)[nH+]c2)c(Cl)c1 ZINC000227599243 340601058 /nfs/dbraw/zinc/60/10/58/340601058.db2.gz SGFHDJANCQLKCQ-UHFFFAOYSA-N 1 2 305.784 4.086 20 0 DIADLO Cc1cc(N2C[C@H](c3ccccc3C)C[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000523086801 340614528 /nfs/dbraw/zinc/61/45/28/340614528.db2.gz XOMGALHULHNNNL-DOTOQJQBSA-N 1 2 307.441 4.353 20 0 DIADLO CCSc1ccccc1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000524022309 340645959 /nfs/dbraw/zinc/64/59/59/340645959.db2.gz KPUQHMRHPJKSMV-UHFFFAOYSA-N 1 2 311.410 4.007 20 0 DIADLO CCCCS(=O)(=O)Nc1ccc([NH2+][C@@H](C)C2CCCC2)cc1 ZINC000525981753 340706394 /nfs/dbraw/zinc/70/63/94/340706394.db2.gz FXTUBAUOIGPKMB-AWEZNQCLSA-N 1 2 324.490 4.219 20 0 DIADLO Cc1cccn2cc(CC(=O)Nc3ccc(C(C)(C)C)cc3)[nH+]c12 ZINC000041284132 340709467 /nfs/dbraw/zinc/70/94/67/340709467.db2.gz GUXWNPDVMKIYIH-UHFFFAOYSA-N 1 2 321.424 4.121 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3ncccc3Cl)CCC2)c(F)c1 ZINC000528439520 340719144 /nfs/dbraw/zinc/71/91/44/340719144.db2.gz XSHSXQCWSMMCLY-UHFFFAOYSA-N 1 2 308.759 4.182 20 0 DIADLO c1c(C[NH2+][C@H](c2ccccn2)C2CCC2)noc1-c1ccccc1 ZINC000528652105 340727943 /nfs/dbraw/zinc/72/79/43/340727943.db2.gz UKHXSXNPHUHQCI-FQEVSTJZSA-N 1 2 319.408 4.368 20 0 DIADLO Oc1ccc(F)c(C[NH2+][C@H]2CCc3cc(Cl)ccc32)c1F ZINC000529665875 340767068 /nfs/dbraw/zinc/76/70/68/340767068.db2.gz PFJIDKCXMFNTMG-AWEZNQCLSA-N 1 2 309.743 4.101 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(C(C)(C)C)s1)c1cc2ccccc2o1 ZINC000537956168 340793388 /nfs/dbraw/zinc/79/33/88/340793388.db2.gz CTCPPSHDOWCDMR-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO CC[C@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1cccc(Cl)c1 ZINC000125288102 340803408 /nfs/dbraw/zinc/80/34/08/340803408.db2.gz RRSXNBFPJQHEHW-ZDUSSCGKSA-N 1 2 307.825 4.261 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](CC(F)(F)F)c2ccc(F)cc2)o1 ZINC000538174844 340812286 /nfs/dbraw/zinc/81/22/86/340812286.db2.gz GEGNELGZJNVTPD-ZDUSSCGKSA-N 1 2 316.298 4.159 20 0 DIADLO FC(F)(F)[C@H]1CCC[C@H](Nc2cccc(-n3cc[nH+]c3)c2)C1 ZINC000125967819 340818174 /nfs/dbraw/zinc/81/81/74/340818174.db2.gz GSXJWDWQXXBSSZ-STQMWFEESA-N 1 2 309.335 4.405 20 0 DIADLO COc1ccc2oc(CNc3ccc(N4CCCC4)[nH+]c3)cc2c1 ZINC000127651507 340854550 /nfs/dbraw/zinc/85/45/50/340854550.db2.gz XNJHFUAWVOEDLI-UHFFFAOYSA-N 1 2 323.396 4.049 20 0 DIADLO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1nc2ccccc2n1C ZINC000539163101 340875270 /nfs/dbraw/zinc/87/52/70/340875270.db2.gz BXTMNVIYNQDSJH-IPYPFGDCSA-N 1 2 309.413 4.141 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2ccc(-c3csc(C)n3)cc2)no1 ZINC000539277269 340879177 /nfs/dbraw/zinc/87/91/77/340879177.db2.gz WRTGPUIGYRHNFY-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO CC(C)(C)C[C@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(F)cc1 ZINC000539279869 340879359 /nfs/dbraw/zinc/87/93/59/340879359.db2.gz IAISYGQZOLYSAD-HNNXBMFYSA-N 1 2 317.408 4.353 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2cnc3ccsc3c2)s1 ZINC000540158897 340918711 /nfs/dbraw/zinc/91/87/11/340918711.db2.gz RGQGWSFKWDFJPO-JTQLQIEISA-N 1 2 318.471 4.122 20 0 DIADLO CC(C)(C)CCCC(=O)N1CCC(CCCn2cc[nH+]c2)CC1 ZINC000541236843 340963432 /nfs/dbraw/zinc/96/34/32/340963432.db2.gz AHBWSEMLFGMVKQ-UHFFFAOYSA-N 1 2 319.493 4.118 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2ccccc2)c2cccnc2)c(F)c1 ZINC000541550352 340973856 /nfs/dbraw/zinc/97/38/56/340973856.db2.gz YKANBIYGWPLFOD-IBGZPJMESA-N 1 2 310.347 4.239 20 0 DIADLO CCc1cnccc1[C@H](C)[NH2+][C@H](C)c1ncc(C(C)(C)C)o1 ZINC000542123150 340995907 /nfs/dbraw/zinc/99/59/07/340995907.db2.gz JNOFLEQLHFZIAW-QWHCGFSZSA-N 1 2 301.434 4.341 20 0 DIADLO CC(C)(C)n1cc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)cn1 ZINC000130132425 341001358 /nfs/dbraw/zinc/00/13/58/341001358.db2.gz MNPWCXBJUQPGEU-UHFFFAOYSA-N 1 2 319.399 4.081 20 0 DIADLO CC(C)(C)n1cc(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)cn1 ZINC000130132425 341001359 /nfs/dbraw/zinc/00/13/59/341001359.db2.gz MNPWCXBJUQPGEU-UHFFFAOYSA-N 1 2 319.399 4.081 20 0 DIADLO COc1c(C)c[nH+]c(CSc2ncc(C(C)(C)C)o2)c1C ZINC000130155043 341002933 /nfs/dbraw/zinc/00/29/33/341002933.db2.gz JZSVJYYUWDXTBX-UHFFFAOYSA-N 1 2 306.431 4.285 20 0 DIADLO Brc1ccc([C@H]2CCCN2c2cccc[nH+]2)s1 ZINC000542274290 341003032 /nfs/dbraw/zinc/00/30/32/341003032.db2.gz KOFUIOFOJSDZGA-SNVBAGLBSA-N 1 2 309.232 4.247 20 0 DIADLO CCCCN(Cc1cc(-n2cc[nH+]c2)cs1)CC(F)(F)F ZINC000542467043 341008499 /nfs/dbraw/zinc/00/84/99/341008499.db2.gz SFOFIGSRRPJPTB-UHFFFAOYSA-N 1 2 317.380 4.098 20 0 DIADLO CC[C@H]([NH2+]Cc1nnsc1Cl)c1ccc(Cl)s1 ZINC000542556871 341013386 /nfs/dbraw/zinc/01/33/86/341013386.db2.gz OONPMNWWKGOGAK-LURJTMIESA-N 1 2 308.259 4.147 20 0 DIADLO Cc1cc(N2CCC3(CCOCC3)[C@H]2C)c2cccc(F)c2[nH+]1 ZINC000542520756 341011882 /nfs/dbraw/zinc/01/18/82/341011882.db2.gz IMRYYNLFWOZVDX-CQSZACIVSA-N 1 2 314.404 4.078 20 0 DIADLO CC(C)c1cnc(N[C@@H](c2[nH+]ccn2C)c2ccccc2)s1 ZINC000542520357 341011981 /nfs/dbraw/zinc/01/19/81/341011981.db2.gz DHTSISULYPAGIV-OAHLLOKOSA-N 1 2 312.442 4.202 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2c(C)cc(C(C)(C)C)cc2C)o1 ZINC000542620356 341015162 /nfs/dbraw/zinc/01/51/62/341015162.db2.gz MCEAUHYLJFUDJU-ZDUSSCGKSA-N 1 2 301.434 4.143 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2nc(C)c3ccccc3n2)C2CCC2)o1 ZINC000542667796 341016373 /nfs/dbraw/zinc/01/63/73/341016373.db2.gz ZCSRLHGQEYEIHE-HXUWFJFHSA-N 1 2 321.424 4.471 20 0 DIADLO CCCCOc1ccc(C[NH2+][C@H](C)c2ccon2)cc1OCC ZINC000542708460 341018433 /nfs/dbraw/zinc/01/84/33/341018433.db2.gz YBUTXEWRDSOFJI-CQSZACIVSA-N 1 2 318.417 4.103 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CCC[C@@H]2c2ccccc2)n1 ZINC000130395744 341020696 /nfs/dbraw/zinc/02/06/96/341020696.db2.gz YDKRCZMDVPMWAO-GFCCVEGCSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CCC[C@@H]2c2ccccc2)n1 ZINC000130395744 341020697 /nfs/dbraw/zinc/02/06/97/341020697.db2.gz YDKRCZMDVPMWAO-GFCCVEGCSA-N 1 2 312.360 4.499 20 0 DIADLO CC(C)(C)C[N@@H+]1CCO[C@@H](c2ccccc2C(F)(F)F)C1 ZINC000542853996 341023682 /nfs/dbraw/zinc/02/36/82/341023682.db2.gz LHSHXVKWWDWJHE-CQSZACIVSA-N 1 2 301.352 4.125 20 0 DIADLO CC(C)(C)C[N@H+]1CCO[C@@H](c2ccccc2C(F)(F)F)C1 ZINC000542853996 341023683 /nfs/dbraw/zinc/02/36/83/341023683.db2.gz LHSHXVKWWDWJHE-CQSZACIVSA-N 1 2 301.352 4.125 20 0 DIADLO c1csc(-c2n[nH]cc2CNc2c[nH+]c3c(c2)CCCC3)c1 ZINC000542924763 341026400 /nfs/dbraw/zinc/02/64/00/341026400.db2.gz STRCAYRSTRGGPU-UHFFFAOYSA-N 1 2 310.426 4.024 20 0 DIADLO c1sc(-c2ccccn2)nc1CNc1c[nH+]c2c(c1)CCCC2 ZINC000542925160 341026570 /nfs/dbraw/zinc/02/65/70/341026570.db2.gz YQSDHUPJGDKNJQ-UHFFFAOYSA-N 1 2 322.437 4.091 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@@H+]1CCOCC2(CC2)C1 ZINC000542986847 341027972 /nfs/dbraw/zinc/02/79/72/341027972.db2.gz STWBUJWRLJBWDL-NSHDSACASA-N 1 2 300.229 4.167 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@H+]1CCOCC2(CC2)C1 ZINC000542986847 341027973 /nfs/dbraw/zinc/02/79/73/341027973.db2.gz STWBUJWRLJBWDL-NSHDSACASA-N 1 2 300.229 4.167 20 0 DIADLO Fc1cccc2c1nc(-c1cc(-n3cc[nH+]c3)cs1)n2C1CC1 ZINC000543126904 341033062 /nfs/dbraw/zinc/03/30/62/341033062.db2.gz DFRGONABXWEDSW-UHFFFAOYSA-N 1 2 324.384 4.425 20 0 DIADLO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000130620672 341033783 /nfs/dbraw/zinc/03/37/83/341033783.db2.gz HROUQBWLXLHQAP-ZDUSSCGKSA-N 1 2 318.490 4.118 20 0 DIADLO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000130620672 341033784 /nfs/dbraw/zinc/03/37/84/341033784.db2.gz HROUQBWLXLHQAP-ZDUSSCGKSA-N 1 2 318.490 4.118 20 0 DIADLO CCc1cnc(C[N@@H+]2CC[C@@H](Oc3ccccc3Cl)C2)s1 ZINC000543393306 341041626 /nfs/dbraw/zinc/04/16/26/341041626.db2.gz ASBWLRJQGLNGAY-GFCCVEGCSA-N 1 2 322.861 4.012 20 0 DIADLO CCc1cnc(C[N@H+]2CC[C@@H](Oc3ccccc3Cl)C2)s1 ZINC000543393306 341041627 /nfs/dbraw/zinc/04/16/27/341041627.db2.gz ASBWLRJQGLNGAY-GFCCVEGCSA-N 1 2 322.861 4.012 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2cc(C)c3ncccc3c2)cs1 ZINC000543395046 341041888 /nfs/dbraw/zinc/04/18/88/341041888.db2.gz VCBIFRZFDYWQHC-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2cc(C)c3ncccc3c2)cs1 ZINC000543395046 341041889 /nfs/dbraw/zinc/04/18/89/341041889.db2.gz VCBIFRZFDYWQHC-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@@H](C)[C@H]2CCCO2)c1 ZINC000543426603 341044080 /nfs/dbraw/zinc/04/40/80/341044080.db2.gz WJADRIIBMPRKJW-MAUKXSAKSA-N 1 2 313.445 4.330 20 0 DIADLO Cc1cc(-c2noc([C@@H](C)[NH2+]Cc3ccccc3)n2)ccc1F ZINC000543548353 341048881 /nfs/dbraw/zinc/04/88/81/341048881.db2.gz IIQRYMSHELYALB-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCOC[C@@H]2c2ccccc2)c(F)c1 ZINC000543631351 341052333 /nfs/dbraw/zinc/05/23/33/341052333.db2.gz KAYRZSIWJFRYQT-ZLHKHBAESA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCOC[C@@H]2c2ccccc2)c(F)c1 ZINC000543631351 341052334 /nfs/dbraw/zinc/05/23/34/341052334.db2.gz KAYRZSIWJFRYQT-ZLHKHBAESA-N 1 2 315.363 4.052 20 0 DIADLO FC(F)(F)c1csc(C[N@H+](Cc2ccccc2)C2CC2)n1 ZINC000130889917 341053118 /nfs/dbraw/zinc/05/31/18/341053118.db2.gz OQWXVKMDVWVDHI-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+](Cc2ccccc2)C2CC2)n1 ZINC000130889917 341053119 /nfs/dbraw/zinc/05/31/19/341053119.db2.gz OQWXVKMDVWVDHI-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO CCCOc1cccc2c(NCCCCn3cc[nH+]c3)ccnc12 ZINC000543719384 341055046 /nfs/dbraw/zinc/05/50/46/341055046.db2.gz OXEGCMPIDWNKDO-UHFFFAOYSA-N 1 2 324.428 4.112 20 0 DIADLO CCc1nc(C[N@@H+]2[C@H](C)Cc3cc(OC)ccc3[C@@H]2C)cs1 ZINC000543781089 341058347 /nfs/dbraw/zinc/05/83/47/341058347.db2.gz MVFKXTGUNJAAFE-OLZOCXBDSA-N 1 2 316.470 4.222 20 0 DIADLO CCc1nc(C[N@H+]2[C@H](C)Cc3cc(OC)ccc3[C@@H]2C)cs1 ZINC000543781089 341058348 /nfs/dbraw/zinc/05/83/48/341058348.db2.gz MVFKXTGUNJAAFE-OLZOCXBDSA-N 1 2 316.470 4.222 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1ccc(CO)o1 ZINC000131215713 341065955 /nfs/dbraw/zinc/06/59/55/341065955.db2.gz ZVMLVJKQNUMFBY-SNVBAGLBSA-N 1 2 314.212 4.272 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1ccc(CO)o1 ZINC000131215713 341065956 /nfs/dbraw/zinc/06/59/56/341065956.db2.gz ZVMLVJKQNUMFBY-SNVBAGLBSA-N 1 2 314.212 4.272 20 0 DIADLO Cn1cc(C[N@H+](C)Cc2ccccc2F)c(C2CCCCC2)n1 ZINC000544349819 341077500 /nfs/dbraw/zinc/07/75/00/341077500.db2.gz RPBJNUWJPWDRIW-UHFFFAOYSA-N 1 2 315.436 4.239 20 0 DIADLO Cn1cc(C[N@@H+](C)Cc2ccccc2F)c(C2CCCCC2)n1 ZINC000544349819 341077501 /nfs/dbraw/zinc/07/75/01/341077501.db2.gz RPBJNUWJPWDRIW-UHFFFAOYSA-N 1 2 315.436 4.239 20 0 DIADLO CC(C)([NH2+]Cc1noc(C2CCCCC2)n1)c1cccs1 ZINC000544461464 341083273 /nfs/dbraw/zinc/08/32/73/341083273.db2.gz GBLCABGLAKKJKT-UHFFFAOYSA-N 1 2 305.447 4.204 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2csc(C3CCCC3)n2)cn1 ZINC000544467790 341083343 /nfs/dbraw/zinc/08/33/43/341083343.db2.gz KZMAYXXNVUKHQU-CYBMUJFWSA-N 1 2 318.490 4.429 20 0 DIADLO CCOc1cccc2cc([C@H](C)[NH2+]Cc3ncc(CC)o3)oc21 ZINC000544480692 341084082 /nfs/dbraw/zinc/08/40/82/341084082.db2.gz AGWASHVVRWIFIB-LBPRGKRZSA-N 1 2 314.385 4.233 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Oc2ccccc2)c(F)c1)c1ccon1 ZINC000544549589 341085417 /nfs/dbraw/zinc/08/54/17/341085417.db2.gz LXJLPJCWVXOUPO-CYBMUJFWSA-N 1 2 312.344 4.457 20 0 DIADLO Cc1c([C@@H](C)[NH2+][C@H](C)c2ccon2)cnn1-c1cc(C)ccc1C ZINC000544605018 341088328 /nfs/dbraw/zinc/08/83/28/341088328.db2.gz QGNVLGMECRVKJV-HUUCEWRRSA-N 1 2 324.428 4.197 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCO[C@@H](c3cccs3)C2)c(F)c1 ZINC000544609866 341088777 /nfs/dbraw/zinc/08/87/77/341088777.db2.gz QQWLDMSUEQAOMS-SSCKWRJFSA-N 1 2 321.392 4.113 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCO[C@@H](c3cccs3)C2)c(F)c1 ZINC000544609866 341088778 /nfs/dbraw/zinc/08/87/78/341088778.db2.gz QQWLDMSUEQAOMS-SSCKWRJFSA-N 1 2 321.392 4.113 20 0 DIADLO Cc1c(F)cccc1-c1ccc(C[NH2+][C@@H](C)c2ccon2)o1 ZINC000544614824 341089237 /nfs/dbraw/zinc/08/92/37/341089237.db2.gz MENKCRFBHTUJFO-LBPRGKRZSA-N 1 2 300.333 4.233 20 0 DIADLO CCCc1noc(C[N@@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)n1 ZINC000072629208 341094564 /nfs/dbraw/zinc/09/45/64/341094564.db2.gz FLVKCPMLKQZRQC-QGZVFWFLSA-N 1 2 324.428 4.231 20 0 DIADLO CCCc1noc(C[N@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)n1 ZINC000072629208 341094565 /nfs/dbraw/zinc/09/45/65/341094565.db2.gz FLVKCPMLKQZRQC-QGZVFWFLSA-N 1 2 324.428 4.231 20 0 DIADLO C[C@@H]1CCC[N@H+]1CC(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000072875084 341109705 /nfs/dbraw/zinc/10/97/05/341109705.db2.gz OZSPHJRRUTWQLQ-MRVPVSSYSA-N 1 2 321.635 4.070 20 0 DIADLO C[C@@H](c1nc(-c2ccccc2)no1)[N@H+](C)Cc1ccccc1F ZINC000072863590 341109533 /nfs/dbraw/zinc/10/95/33/341109533.db2.gz DONVYASKQBTJBA-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1nc(-c2ccccc2)no1)[N@@H+](C)Cc1ccccc1F ZINC000072863590 341109534 /nfs/dbraw/zinc/10/95/34/341109534.db2.gz DONVYASKQBTJBA-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H]1CCC[N@@H+]1CC(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000072875084 341109704 /nfs/dbraw/zinc/10/97/04/341109704.db2.gz OZSPHJRRUTWQLQ-MRVPVSSYSA-N 1 2 321.635 4.070 20 0 DIADLO Brc1ccccc1C[N@H+](Cc1cccnc1)C1CC1 ZINC000072979790 341111935 /nfs/dbraw/zinc/11/19/35/341111935.db2.gz ZJWVIMYRMPWBSF-UHFFFAOYSA-N 1 2 317.230 4.009 20 0 DIADLO Brc1ccccc1C[N@@H+](Cc1cccnc1)C1CC1 ZINC000072979790 341111936 /nfs/dbraw/zinc/11/19/36/341111936.db2.gz ZJWVIMYRMPWBSF-UHFFFAOYSA-N 1 2 317.230 4.009 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3n2C)cn1 ZINC000545199314 341113146 /nfs/dbraw/zinc/11/31/46/341113146.db2.gz OOMMXMGCXWLJCK-IBGZPJMESA-N 1 2 320.440 4.004 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3n2C)cn1 ZINC000545199314 341113147 /nfs/dbraw/zinc/11/31/47/341113147.db2.gz OOMMXMGCXWLJCK-IBGZPJMESA-N 1 2 320.440 4.004 20 0 DIADLO FC(F)Oc1ccccc1NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000132059927 341115739 /nfs/dbraw/zinc/11/57/39/341115739.db2.gz MAPHESAKZFNJDT-UHFFFAOYSA-N 1 2 315.323 4.086 20 0 DIADLO CC[C@@H]([NH2+][C@H]1COc2ccc(F)cc21)c1cc(F)ccc1F ZINC000545235834 341116348 /nfs/dbraw/zinc/11/63/48/341116348.db2.gz OSSQAFOIPOGLHK-CVEARBPZSA-N 1 2 307.315 4.278 20 0 DIADLO CC[C@@H](C)c1ccc([C@@H]([NH2+]Cc2nc(C)no2)C(C)C)cc1 ZINC000073644383 341119500 /nfs/dbraw/zinc/11/95/00/341119500.db2.gz ZEZWKEXSMYBUHS-ACJLOTCBSA-N 1 2 301.434 4.378 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)c1cccc2ncccc21 ZINC000132290484 341120207 /nfs/dbraw/zinc/12/02/07/341120207.db2.gz YQPUMZFHLHGCKT-UHFFFAOYSA-N 1 2 321.380 4.059 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)Cc1cccc(Cl)c1 ZINC000132306257 341120309 /nfs/dbraw/zinc/12/03/09/341120309.db2.gz QOGVQOIEARJILE-UHFFFAOYSA-N 1 2 318.804 4.094 20 0 DIADLO Cc1cc(Cl)ccc1C(=O)Nc1c[nH+]ccc1OC(C)(C)C ZINC000132449628 341123535 /nfs/dbraw/zinc/12/35/35/341123535.db2.gz QGZARILHUUFMCK-UHFFFAOYSA-N 1 2 318.804 4.473 20 0 DIADLO Cc1cnc(C[NH2+]C(c2ccccc2C)c2ccccc2C)nc1 ZINC000545517069 341128133 /nfs/dbraw/zinc/12/81/33/341128133.db2.gz FUCPEPOGJPRYBH-UHFFFAOYSA-N 1 2 317.436 4.281 20 0 DIADLO Cc1cccc(C)c1[C@H](C)[NH2+]Cc1noc(-c2ccsc2)n1 ZINC000545518688 341128156 /nfs/dbraw/zinc/12/81/56/341128156.db2.gz RQWPJOMZARCBDU-ZDUSSCGKSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1cccc([C@@H](C)C(=O)Nc2c[nH+]ccc2OC(C)(C)C)c1 ZINC000132612056 341131836 /nfs/dbraw/zinc/13/18/36/341131836.db2.gz IGQRYSCQLALWRG-CQSZACIVSA-N 1 2 312.413 4.310 20 0 DIADLO Cc1ccc(Cc2noc(/C=C\c3ccccc3Cl)n2)c[nH+]1 ZINC000545637689 341134372 /nfs/dbraw/zinc/13/43/72/341134372.db2.gz ASEPKAYGULYYND-HJWRWDBZSA-N 1 2 311.772 4.188 20 0 DIADLO C[C@@H]1CCCC[C@H]1c1noc(CCc2[nH]c3ccccc3[nH+]2)n1 ZINC000545686754 341136348 /nfs/dbraw/zinc/13/63/48/341136348.db2.gz KLAVYIXZYCLEFR-CHWSQXEVSA-N 1 2 310.401 4.025 20 0 DIADLO CCCC1(c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)CCC1 ZINC000545695445 341136747 /nfs/dbraw/zinc/13/67/47/341136747.db2.gz PLFWPCQCLXDHSG-UHFFFAOYSA-N 1 2 308.385 4.144 20 0 DIADLO C[C@H](NC(=O)c1ccccc1Oc1cc[nH+]cc1)C1CCCC1 ZINC000564295591 341145205 /nfs/dbraw/zinc/14/52/05/341145205.db2.gz KNQXOSKKSFZAQR-AWEZNQCLSA-N 1 2 310.397 4.182 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCC[N@@H+]2Cc2ccno2)c1 ZINC000545974588 341149149 /nfs/dbraw/zinc/14/91/49/341149149.db2.gz KOCUCDIDBHOAMH-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCC[N@H+]2Cc2ccno2)c1 ZINC000545974588 341149150 /nfs/dbraw/zinc/14/91/50/341149150.db2.gz KOCUCDIDBHOAMH-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1nc2cc(F)ccc2o1 ZINC000133008080 341151692 /nfs/dbraw/zinc/15/16/92/341151692.db2.gz BNTQHCWQJWDCIC-SNVBAGLBSA-N 1 2 320.314 4.438 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1nc2cc(F)ccc2o1 ZINC000133008080 341151693 /nfs/dbraw/zinc/15/16/93/341151693.db2.gz BNTQHCWQJWDCIC-SNVBAGLBSA-N 1 2 320.314 4.438 20 0 DIADLO CCSc1cccc(C[N@H+](C)Cc2csc(CC)n2)c1 ZINC000546035402 341152293 /nfs/dbraw/zinc/15/22/93/341152293.db2.gz MYDKNDKMDFGPJY-UHFFFAOYSA-N 1 2 306.500 4.450 20 0 DIADLO CCSc1cccc(C[N@@H+](C)Cc2csc(CC)n2)c1 ZINC000546035402 341152294 /nfs/dbraw/zinc/15/22/94/341152294.db2.gz MYDKNDKMDFGPJY-UHFFFAOYSA-N 1 2 306.500 4.450 20 0 DIADLO Cc1cc(N[C@@H](C)c2c(C)cccc2C)nc(-c2ccncc2)[nH+]1 ZINC000546172748 341155883 /nfs/dbraw/zinc/15/58/83/341155883.db2.gz LJKZUALOSLRYPG-INIZCTEOSA-N 1 2 318.424 4.059 20 0 DIADLO COc1cc(Oc2ccccc2)ccc1[NH2+]CC1CCOCC1 ZINC000546180188 341156216 /nfs/dbraw/zinc/15/62/16/341156216.db2.gz OOUXLTASFPNWJC-UHFFFAOYSA-N 1 2 313.397 4.326 20 0 DIADLO Cc1ccc(-c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)cc1F ZINC000546234266 341158757 /nfs/dbraw/zinc/15/87/57/341158757.db2.gz DEAHEBNTCKOOMG-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CC(C)C[C@@H](C)Cc1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000546285531 341161113 /nfs/dbraw/zinc/16/11/13/341161113.db2.gz ZIOYWCBOVXKJCB-OAHLLOKOSA-N 1 2 324.428 4.206 20 0 DIADLO C[C@H]1CC/C(=C\c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)C1 ZINC000546284917 341161157 /nfs/dbraw/zinc/16/11/57/341161157.db2.gz NQVVURCYYZWXPA-AYYGCFCKSA-N 1 2 320.396 4.185 20 0 DIADLO Cc1ccc(Cc2noc(/C=C\c3cccc(Cl)c3)n2)c[nH+]1 ZINC000546344879 341164484 /nfs/dbraw/zinc/16/44/84/341164484.db2.gz LCRBMPGCFOMDRQ-FPLPWBNLSA-N 1 2 311.772 4.188 20 0 DIADLO CCc1ccc(/C=C\c2nc(Cc3ccc(C)[nH+]c3)no2)cc1 ZINC000546347160 341164495 /nfs/dbraw/zinc/16/44/95/341164495.db2.gz RFTXERUKRLLKAK-KHPPLWFESA-N 1 2 305.381 4.097 20 0 DIADLO CC(C)(C)Cc1noc(CCn2c3ccccc3[nH+]c2C2CC2)n1 ZINC000546453197 341168979 /nfs/dbraw/zinc/16/89/79/341168979.db2.gz MHTXHZMFHSHHTH-UHFFFAOYSA-N 1 2 324.428 4.128 20 0 DIADLO CC1(C)C[C@@H](Nc2[nH+]cccc2OCc2ccccc2)CCO1 ZINC000546635848 341176544 /nfs/dbraw/zinc/17/65/44/341176544.db2.gz FBQIUDIGBHAFCF-INIZCTEOSA-N 1 2 312.413 4.030 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](C)Cc1nccn1Cc1ccccc1 ZINC000075608689 341179477 /nfs/dbraw/zinc/17/94/77/341179477.db2.gz OXXBTXJWBJLBHG-QGZVFWFLSA-N 1 2 305.425 4.124 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1nccn1Cc1ccccc1 ZINC000075608689 341179478 /nfs/dbraw/zinc/17/94/78/341179478.db2.gz OXXBTXJWBJLBHG-QGZVFWFLSA-N 1 2 305.425 4.124 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](Cc2ccncc2Cl)[C@H](C)CO1 ZINC000075785276 341182705 /nfs/dbraw/zinc/18/27/05/341182705.db2.gz MDNXYYIZPUUAMI-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2ccncc2Cl)[C@H](C)CO1 ZINC000075785276 341182706 /nfs/dbraw/zinc/18/27/06/341182706.db2.gz MDNXYYIZPUUAMI-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc(Cc2noc(/C=C\c3ccc(Cl)s3)n2)c[nH+]1 ZINC000547051949 341193836 /nfs/dbraw/zinc/19/38/36/341193836.db2.gz ZTRLPTUZOXWGFZ-ALCCZGGFSA-N 1 2 317.801 4.249 20 0 DIADLO Clc1ccc(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)cc1 ZINC000547107481 341196146 /nfs/dbraw/zinc/19/61/46/341196146.db2.gz MNSGDGLNWQPYCO-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO CCOCCC1(CNc2cc(C(F)(F)F)cc[nH+]2)CCC1 ZINC000133980893 341203846 /nfs/dbraw/zinc/20/38/46/341203846.db2.gz WSBNJIGPDNSVHY-UHFFFAOYSA-N 1 2 302.340 4.109 20 0 DIADLO CCC1(CC)C[N@@H+]([C@H](C)c2ccc(Cl)cc2)CC[S@@]1=O ZINC000547398379 341211013 /nfs/dbraw/zinc/21/10/13/341211013.db2.gz VIAJPYZHUVKEGE-XCLFUZPHSA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@H+]([C@H](C)c2ccc(Cl)cc2)CC[S@@]1=O ZINC000547398379 341211014 /nfs/dbraw/zinc/21/10/14/341211014.db2.gz VIAJPYZHUVKEGE-XCLFUZPHSA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@@H+]([C@H](C)c2ccc(Cl)cc2)CC[S@]1=O ZINC000547398378 341211122 /nfs/dbraw/zinc/21/11/22/341211122.db2.gz VIAJPYZHUVKEGE-ZUOKHONESA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@H+]([C@H](C)c2ccc(Cl)cc2)CC[S@]1=O ZINC000547398378 341211123 /nfs/dbraw/zinc/21/11/23/341211123.db2.gz VIAJPYZHUVKEGE-ZUOKHONESA-N 1 2 313.894 4.024 20 0 DIADLO CCN(C(=O)CCn1c(C)[nH+]c2ccccc21)c1ccccc1C ZINC000547470982 341215643 /nfs/dbraw/zinc/21/56/43/341215643.db2.gz MFBGBVVBTYNHOX-UHFFFAOYSA-N 1 2 321.424 4.096 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@H](COCC(C)C)c2ccco2)o1 ZINC000152642010 341215943 /nfs/dbraw/zinc/21/59/43/341215943.db2.gz SXDFYXLVJURABI-GDBMZVCRSA-N 1 2 305.418 4.500 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCCN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000547504377 341218515 /nfs/dbraw/zinc/21/85/15/341218515.db2.gz CUWDHDQSXXYDFZ-PSASIEDQSA-N 1 2 312.257 4.268 20 0 DIADLO Cc1[nH+]cc(CNc2cccc3cc[nH]c32)n1-c1ccccc1 ZINC000547530528 341220938 /nfs/dbraw/zinc/22/09/38/341220938.db2.gz AQBZJFZOXNZMPY-UHFFFAOYSA-N 1 2 302.381 4.274 20 0 DIADLO C[C@@H]1CC[N@H+](CC(=O)Nc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000077319721 341222841 /nfs/dbraw/zinc/22/28/41/341222841.db2.gz CFYLWTBGBSWGRQ-GHMZBOCLSA-N 1 2 315.244 4.052 20 0 DIADLO C[C@@H]1CC[N@@H+](CC(=O)Nc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000077319721 341222842 /nfs/dbraw/zinc/22/28/42/341222842.db2.gz CFYLWTBGBSWGRQ-GHMZBOCLSA-N 1 2 315.244 4.052 20 0 DIADLO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000564327328 341225856 /nfs/dbraw/zinc/22/58/56/341225856.db2.gz YUKLJJVJRFIBDA-CYBMUJFWSA-N 1 2 318.490 4.118 20 0 DIADLO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000564327328 341225857 /nfs/dbraw/zinc/22/58/57/341225857.db2.gz YUKLJJVJRFIBDA-CYBMUJFWSA-N 1 2 318.490 4.118 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1nc2c(s1)CCC2 ZINC000134895703 341226090 /nfs/dbraw/zinc/22/60/90/341226090.db2.gz DNDKSFKLRVPMSQ-SNVBAGLBSA-N 1 2 321.515 4.237 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2nc(-c3ccccc3)cs2)s1 ZINC000134910395 341226477 /nfs/dbraw/zinc/22/64/77/341226477.db2.gz LADZAGBIWXBZJU-LBPRGKRZSA-N 1 2 315.467 4.426 20 0 DIADLO COc1cccc(C2CCN(c3cc(C)[nH+]c(C4CC4)n3)CC2)c1 ZINC000547709568 341228051 /nfs/dbraw/zinc/22/80/51/341228051.db2.gz DGISWAHMNNENGI-UHFFFAOYSA-N 1 2 323.440 4.055 20 0 DIADLO Fc1cccc(C[N@H+](Cc2csc(C3CC3)n2)C2CC2)c1 ZINC000135069202 341230406 /nfs/dbraw/zinc/23/04/06/341230406.db2.gz GYWRTPQSXLTDMN-UHFFFAOYSA-N 1 2 302.418 4.324 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2csc(C3CC3)n2)C2CC2)c1 ZINC000135069202 341230407 /nfs/dbraw/zinc/23/04/07/341230407.db2.gz GYWRTPQSXLTDMN-UHFFFAOYSA-N 1 2 302.418 4.324 20 0 DIADLO C[C@H]1C[C@H](C)[NH+]1Cc1csc(Cc2ccc(Cl)cc2)n1 ZINC000547769068 341231477 /nfs/dbraw/zinc/23/14/77/341231477.db2.gz LHJVENNQZYEXFA-RYUDHWBXSA-N 1 2 306.862 4.370 20 0 DIADLO Fc1ccc([C@@H]2CCCC[N@@H+]2Cc2nc3ccccc3[nH]2)cc1 ZINC000547830297 341236037 /nfs/dbraw/zinc/23/60/37/341236037.db2.gz SMADAEGSYBEXPL-SFHVURJKSA-N 1 2 309.388 4.429 20 0 DIADLO Fc1ccc([C@@H]2CCCC[N@H+]2Cc2nc3ccccc3[nH]2)cc1 ZINC000547830297 341236038 /nfs/dbraw/zinc/23/60/38/341236038.db2.gz SMADAEGSYBEXPL-SFHVURJKSA-N 1 2 309.388 4.429 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000547973589 341241415 /nfs/dbraw/zinc/24/14/15/341241415.db2.gz FPQBFNQMCBZDEL-SGTLLEGYSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000547973589 341241416 /nfs/dbraw/zinc/24/14/16/341241416.db2.gz FPQBFNQMCBZDEL-SGTLLEGYSA-N 1 2 321.342 4.238 20 0 DIADLO Cc1cc(N2CCC3(C2)CCCCC3)nc(-c2ccncc2)[nH+]1 ZINC000078411250 341241813 /nfs/dbraw/zinc/24/18/13/341241813.db2.gz KZKIAHFZYSYGOD-UHFFFAOYSA-N 1 2 308.429 4.008 20 0 DIADLO Cc1cccn2cc(CC(=O)Nc3ccc(C4CC4)c(C)c3)[nH+]c12 ZINC000548143006 341249095 /nfs/dbraw/zinc/24/90/95/341249095.db2.gz LEXZZPYONLNADK-UHFFFAOYSA-N 1 2 319.408 4.010 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c(OC)c1 ZINC000078968828 341250869 /nfs/dbraw/zinc/25/08/69/341250869.db2.gz QRDJXLLLXYLTSS-VXGBXAGGSA-N 1 2 321.367 4.394 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3F)C2)c(C)s1 ZINC000548300855 341255018 /nfs/dbraw/zinc/25/50/18/341255018.db2.gz WLNVUYBDJYAVKS-KRWDZBQOSA-N 1 2 323.408 4.217 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@H](c3ccc(F)cc3F)C2)c(C)s1 ZINC000548300855 341255019 /nfs/dbraw/zinc/25/50/19/341255019.db2.gz WLNVUYBDJYAVKS-KRWDZBQOSA-N 1 2 323.408 4.217 20 0 DIADLO Cc1c(N[C@H](C)c2cn3ccccc3[nH+]2)cnn1-c1ccccc1 ZINC000548384161 341258173 /nfs/dbraw/zinc/25/81/73/341258173.db2.gz KGVWVUNROSKZOT-CQSZACIVSA-N 1 2 317.396 4.002 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1csc(C(C)C)n1 ZINC000079915004 341267501 /nfs/dbraw/zinc/26/75/01/341267501.db2.gz IMEVNOMJTXEIBG-CYBMUJFWSA-N 1 2 304.459 4.434 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1csc(C(C)C)n1 ZINC000079915007 341267574 /nfs/dbraw/zinc/26/75/74/341267574.db2.gz IMEVNOMJTXEIBG-ZDUSSCGKSA-N 1 2 304.459 4.434 20 0 DIADLO C[C@H]1C[C@H](C)[NH+]1CC(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000548752656 341272274 /nfs/dbraw/zinc/27/22/74/341272274.db2.gz QYLHGBLQKFIPTG-YUMQZZPRSA-N 1 2 321.635 4.068 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000548787030 341275561 /nfs/dbraw/zinc/27/55/61/341275561.db2.gz WNUOVRCRCKNODT-PWSUYJOCSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000548787030 341275562 /nfs/dbraw/zinc/27/55/62/341275562.db2.gz WNUOVRCRCKNODT-PWSUYJOCSA-N 1 2 323.305 4.069 20 0 DIADLO CCn1cc[nH+]c1CNc1ccc(-c2ccc(Cl)s2)nc1 ZINC000548847289 341277903 /nfs/dbraw/zinc/27/79/03/341277903.db2.gz JEUZBXFUUVBBEE-UHFFFAOYSA-N 1 2 318.833 4.292 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccccc2OC(C)C)s1 ZINC000548916923 341280798 /nfs/dbraw/zinc/28/07/98/341280798.db2.gz ODDBMTCEOPOGDD-RYUDHWBXSA-N 1 2 305.447 4.046 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@@H+](C[C@H]2CCC3(CCCC3)O2)C1 ZINC000548921384 341281113 /nfs/dbraw/zinc/28/11/13/341281113.db2.gz CLWDXIXKYUTYFB-OAHLLOKOSA-N 1 2 310.441 4.018 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@H+](C[C@H]2CCC3(CCCC3)O2)C1 ZINC000548921384 341281114 /nfs/dbraw/zinc/28/11/14/341281114.db2.gz CLWDXIXKYUTYFB-OAHLLOKOSA-N 1 2 310.441 4.018 20 0 DIADLO CN(C)C[C@@H]([NH2+]Cc1ccc(F)cc1F)c1ccc(Cl)cc1 ZINC000548992022 341283098 /nfs/dbraw/zinc/28/30/98/341283098.db2.gz SGTTZDXXKJMVQX-QGZVFWFLSA-N 1 2 324.802 4.011 20 0 DIADLO COc1cc(C[N@H+](C)Cc2sccc2Cl)cc(OC)c1 ZINC000549041076 341284451 /nfs/dbraw/zinc/28/44/51/341284451.db2.gz VIPRQRTUIHXDHW-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2sccc2Cl)cc(OC)c1 ZINC000549041076 341284452 /nfs/dbraw/zinc/28/44/52/341284452.db2.gz VIPRQRTUIHXDHW-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(-c3ccccn3)n2)[C@H]1c1ccccc1 ZINC000245446421 341294560 /nfs/dbraw/zinc/29/45/60/341294560.db2.gz ZUIIWIHNMCIKQN-RDTXWAMCSA-N 1 2 321.449 4.398 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(-c3ccccn3)n2)[C@H]1c1ccccc1 ZINC000245446421 341294561 /nfs/dbraw/zinc/29/45/61/341294561.db2.gz ZUIIWIHNMCIKQN-RDTXWAMCSA-N 1 2 321.449 4.398 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(-c3ccccn3)n2)[C@H]1c1ccccc1 ZINC000245446420 341294579 /nfs/dbraw/zinc/29/45/79/341294579.db2.gz ZUIIWIHNMCIKQN-KBXCAEBGSA-N 1 2 321.449 4.398 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(-c3ccccn3)n2)[C@H]1c1ccccc1 ZINC000245446420 341294580 /nfs/dbraw/zinc/29/45/80/341294580.db2.gz ZUIIWIHNMCIKQN-KBXCAEBGSA-N 1 2 321.449 4.398 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(-c3ccccn3)n2)[C@@H]1c1ccccc1 ZINC000081574791 341297184 /nfs/dbraw/zinc/29/71/84/341297184.db2.gz ZUIIWIHNMCIKQN-KDOFPFPSSA-N 1 2 321.449 4.398 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(-c3ccccn3)n2)[C@@H]1c1ccccc1 ZINC000081574791 341297185 /nfs/dbraw/zinc/29/71/85/341297185.db2.gz ZUIIWIHNMCIKQN-KDOFPFPSSA-N 1 2 321.449 4.398 20 0 DIADLO COc1c(C)c[nH+]c(CSC[C@@H](OC)c2ccccc2)c1C ZINC000549555699 341297636 /nfs/dbraw/zinc/29/76/36/341297636.db2.gz GMHKWXFXWMBRQC-QGZVFWFLSA-N 1 2 317.454 4.328 20 0 DIADLO Cc1nc([C@H]([NH2+]C[C@@H]2CCC[C@@H](C)C2)c2ccccc2F)no1 ZINC000245515284 341298796 /nfs/dbraw/zinc/29/87/96/341298796.db2.gz HIOFJPJZSOFTPT-SUYBPPKGSA-N 1 2 317.408 4.022 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000245539862 341300853 /nfs/dbraw/zinc/30/08/53/341300853.db2.gz HZSKNZUJLNISNM-SPYBWZPUSA-N 1 2 322.408 4.351 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000245539862 341300854 /nfs/dbraw/zinc/30/08/54/341300854.db2.gz HZSKNZUJLNISNM-SPYBWZPUSA-N 1 2 322.408 4.351 20 0 DIADLO Cc1cccnc1C[N@H+]1C[C@@H](c2ccccc2Cl)OC[C@H]1C ZINC000245546978 341301093 /nfs/dbraw/zinc/30/10/93/341301093.db2.gz WXYUABJLHXNUML-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cccnc1C[N@@H+]1C[C@@H](c2ccccc2Cl)OC[C@H]1C ZINC000245546978 341301094 /nfs/dbraw/zinc/30/10/94/341301094.db2.gz WXYUABJLHXNUML-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@@H](c2ccccc2)c2cccnc2)c1 ZINC000549733973 341301777 /nfs/dbraw/zinc/30/17/77/341301777.db2.gz QHLYSBYFSYMWEB-FQEVSTJZSA-N 1 2 322.383 4.109 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+]2CCO[C@@H](c3cccs3)C2)o1 ZINC000245563192 341302189 /nfs/dbraw/zinc/30/21/89/341302189.db2.gz PMHJZDMXGGZRNA-IVMMDQJWSA-N 1 2 303.427 4.038 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CCO[C@@H](c3cccs3)C2)o1 ZINC000245563192 341302190 /nfs/dbraw/zinc/30/21/90/341302190.db2.gz PMHJZDMXGGZRNA-IVMMDQJWSA-N 1 2 303.427 4.038 20 0 DIADLO CC(C)c1ccc(C(=O)N[C@@H](c2[nH]cc[nH+]2)C(C)C)cc1Cl ZINC000549754118 341302251 /nfs/dbraw/zinc/30/22/51/341302251.db2.gz YKXZYLNZQJERLJ-OAHLLOKOSA-N 1 2 319.836 4.314 20 0 DIADLO CCCCc1noc(C[N@H+](C)Cc2ccc(C(C)C)cc2)n1 ZINC000549797905 341303336 /nfs/dbraw/zinc/30/33/36/341303336.db2.gz CUXZDMZCQQCTHD-UHFFFAOYSA-N 1 2 301.434 4.168 20 0 DIADLO CCCCc1noc(C[N@@H+](C)Cc2ccc(C(C)C)cc2)n1 ZINC000549797905 341303337 /nfs/dbraw/zinc/30/33/37/341303337.db2.gz CUXZDMZCQQCTHD-UHFFFAOYSA-N 1 2 301.434 4.168 20 0 DIADLO CC[C@@H](C)Oc1cccc(NCc2cn3cc(C)ccc3[nH+]2)c1 ZINC000549842347 341304617 /nfs/dbraw/zinc/30/46/17/341304617.db2.gz RANADWIZPBHOGO-OAHLLOKOSA-N 1 2 309.413 4.432 20 0 DIADLO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+]1CCC[C@H]1CF ZINC000550008281 341308686 /nfs/dbraw/zinc/30/86/86/341308686.db2.gz MRVKGDOWLXCQEX-FZMZJTMJSA-N 1 2 308.784 4.490 20 0 DIADLO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1CCC[C@H]1CF ZINC000550008281 341308687 /nfs/dbraw/zinc/30/86/87/341308687.db2.gz MRVKGDOWLXCQEX-FZMZJTMJSA-N 1 2 308.784 4.490 20 0 DIADLO CCc1nocc1CNc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000550212019 341312635 /nfs/dbraw/zinc/31/26/35/341312635.db2.gz NHKBVLTZFKLGDL-UHFFFAOYSA-N 1 2 322.412 4.049 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3ccccc3[C@H]2c2ccccc2)no1 ZINC000550344325 341315397 /nfs/dbraw/zinc/31/53/97/341315397.db2.gz DBACRPINPRBJCX-HXUWFJFHSA-N 1 2 304.393 4.131 20 0 DIADLO Cc1cc(C[N@H+]2CCc3ccccc3[C@H]2c2ccccc2)no1 ZINC000550344325 341315398 /nfs/dbraw/zinc/31/53/98/341315398.db2.gz DBACRPINPRBJCX-HXUWFJFHSA-N 1 2 304.393 4.131 20 0 DIADLO C[C@@H]1c2c(F)cccc2CC[N@H+]1Cc1ccc(C(F)(F)F)cn1 ZINC000551699659 341349203 /nfs/dbraw/zinc/34/92/03/341349203.db2.gz LFOICFJARWLOAS-LLVKDONJSA-N 1 2 324.321 4.359 20 0 DIADLO C[C@@H]1c2c(F)cccc2CC[N@@H+]1Cc1ccc(C(F)(F)F)cn1 ZINC000551699659 341349204 /nfs/dbraw/zinc/34/92/04/341349204.db2.gz LFOICFJARWLOAS-LLVKDONJSA-N 1 2 324.321 4.359 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(N(C)c2ccccc2)nc1)c1cscn1 ZINC000552002242 341359106 /nfs/dbraw/zinc/35/91/06/341359106.db2.gz NPSOAJWNJBGJQU-CQSZACIVSA-N 1 2 324.453 4.157 20 0 DIADLO C[C@H](c1ccc(F)c(Cl)c1)[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000246971055 341359390 /nfs/dbraw/zinc/35/93/90/341359390.db2.gz PDKVYKYSNMVICP-BDJLRTHQSA-N 1 2 309.768 4.207 20 0 DIADLO C[C@H](c1ccc(F)c(Cl)c1)[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000246971055 341359391 /nfs/dbraw/zinc/35/93/91/341359391.db2.gz PDKVYKYSNMVICP-BDJLRTHQSA-N 1 2 309.768 4.207 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000247184158 341361812 /nfs/dbraw/zinc/36/18/12/341361812.db2.gz WABMCHABKZVVJI-YEJXKQKISA-N 1 2 321.873 4.270 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000247184158 341361813 /nfs/dbraw/zinc/36/18/13/341361813.db2.gz WABMCHABKZVVJI-YEJXKQKISA-N 1 2 321.873 4.270 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@@H](c2cccc(O)c2)C1 ZINC000247242393 341362753 /nfs/dbraw/zinc/36/27/53/341362753.db2.gz XRCLBIWTRNAGBI-FZKQIMNGSA-N 1 2 317.816 4.180 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCO[C@@H](c2cccc(O)c2)C1 ZINC000247242393 341362754 /nfs/dbraw/zinc/36/27/54/341362754.db2.gz XRCLBIWTRNAGBI-FZKQIMNGSA-N 1 2 317.816 4.180 20 0 DIADLO Cc1ccc(C)c(Oc2ccc(C[NH2+][C@H](C)c3ncc[nH]3)cn2)c1 ZINC000552033142 341363286 /nfs/dbraw/zinc/36/32/86/341363286.db2.gz OBPVLKIPMQNUCT-OAHLLOKOSA-N 1 2 322.412 4.065 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc3ccccc3n2)[C@@H](c2ccccc2)CO1 ZINC000247503428 341365881 /nfs/dbraw/zinc/36/58/81/341365881.db2.gz LXMIKARNWYLISI-HRAATJIYSA-N 1 2 318.420 4.197 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc3ccccc3n2)[C@@H](c2ccccc2)CO1 ZINC000247503428 341365882 /nfs/dbraw/zinc/36/58/82/341365882.db2.gz LXMIKARNWYLISI-HRAATJIYSA-N 1 2 318.420 4.197 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(F)cc2Cl)[C@@H]1c1ccncc1 ZINC000552064442 341366624 /nfs/dbraw/zinc/36/66/24/341366624.db2.gz OVAOOSXNMZAIKL-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(F)cc2Cl)[C@@H]1c1ccncc1 ZINC000552064442 341366625 /nfs/dbraw/zinc/36/66/25/341366625.db2.gz OVAOOSXNMZAIKL-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO Cc1nc(C[N@H+]2C[C@H](c3cc(C)ccc3C)OC[C@@H]2C)cs1 ZINC000247694405 341369239 /nfs/dbraw/zinc/36/92/39/341369239.db2.gz WKKUIMUPCWSJTF-KBXCAEBGSA-N 1 2 316.470 4.030 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@H](c3cc(C)ccc3C)OC[C@@H]2C)cs1 ZINC000247694405 341369240 /nfs/dbraw/zinc/36/92/40/341369240.db2.gz WKKUIMUPCWSJTF-KBXCAEBGSA-N 1 2 316.470 4.030 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1cc(C)c(C)cc1OC(F)F ZINC000552119578 341370997 /nfs/dbraw/zinc/37/09/97/341370997.db2.gz MOCGPSKJVTXUKL-UHFFFAOYSA-N 1 2 324.371 4.087 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1cc(C)c(C)cc1OC(F)F ZINC000552119578 341370998 /nfs/dbraw/zinc/37/09/98/341370998.db2.gz MOCGPSKJVTXUKL-UHFFFAOYSA-N 1 2 324.371 4.087 20 0 DIADLO Fc1ccc2cc[nH+]c(N3CCC(C4CCOCC4)CC3)c2c1 ZINC000552156802 341374357 /nfs/dbraw/zinc/37/43/57/341374357.db2.gz YUQJKLCYGZHOKH-UHFFFAOYSA-N 1 2 314.404 4.017 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1nc(C)c2ccccc2n1 ZINC000552193908 341377590 /nfs/dbraw/zinc/37/75/90/341377590.db2.gz HLWDTMYXDXBMOW-UHFFFAOYSA-N 1 2 309.388 4.018 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1nc(C)c2ccccc2n1 ZINC000552193908 341377591 /nfs/dbraw/zinc/37/75/91/341377591.db2.gz HLWDTMYXDXBMOW-UHFFFAOYSA-N 1 2 309.388 4.018 20 0 DIADLO Cc1cccc(C([NH2+][C@@H](C)c2ncc[nH]2)c2cccc(C)c2)c1 ZINC000552244144 341380905 /nfs/dbraw/zinc/38/09/05/341380905.db2.gz WDAINXFTMWOHKW-INIZCTEOSA-N 1 2 305.425 4.467 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nnc(-c3ccccc3)s2)[C@H]1c1ccccc1 ZINC000248639918 341382344 /nfs/dbraw/zinc/38/23/44/341382344.db2.gz WWEYFILDEVPHEE-RDTXWAMCSA-N 1 2 321.449 4.398 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccccc3)s2)[C@H]1c1ccccc1 ZINC000248639918 341382345 /nfs/dbraw/zinc/38/23/45/341382345.db2.gz WWEYFILDEVPHEE-RDTXWAMCSA-N 1 2 321.449 4.398 20 0 DIADLO Cc1cncc(C[N@H+]2C[C@@H](c3ccccc3Cl)OC[C@H]2C)c1 ZINC000248937366 341390282 /nfs/dbraw/zinc/39/02/82/341390282.db2.gz NJOCOKQZDCBARP-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cncc(C[N@@H+]2C[C@@H](c3ccccc3Cl)OC[C@H]2C)c1 ZINC000248937366 341390283 /nfs/dbraw/zinc/39/02/83/341390283.db2.gz NJOCOKQZDCBARP-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO C[C@H]1C[N@H+](Cc2nc(-c3ccccc3F)no2)[C@H]1c1ccccc1 ZINC000249295544 341396162 /nfs/dbraw/zinc/39/61/62/341396162.db2.gz BFNYUHVLTNATLC-SCLBCKFNSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nc(-c3ccccc3F)no2)[C@H]1c1ccccc1 ZINC000249295544 341396163 /nfs/dbraw/zinc/39/61/63/341396163.db2.gz BFNYUHVLTNATLC-SCLBCKFNSA-N 1 2 323.371 4.069 20 0 DIADLO Cc1cc(N2CCSCC2)ccc1[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000554087354 341443427 /nfs/dbraw/zinc/44/34/27/341443427.db2.gz BUUFCHBGSLPCKV-WMZOPIPTSA-N 1 2 302.487 4.149 20 0 DIADLO CC(C)N(C)c1ccc(CNc2cncc3ccccc32)c[nH+]1 ZINC000555366638 341481352 /nfs/dbraw/zinc/48/13/52/341481352.db2.gz VKFACOOUQDUFDR-UHFFFAOYSA-N 1 2 306.413 4.087 20 0 DIADLO O=C(C/C=C\c1cccc(F)c1)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000254977455 341495651 /nfs/dbraw/zinc/49/56/51/341495651.db2.gz PELOZDKRZNCNRT-DJWKRKHSSA-N 1 2 321.355 4.258 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3csc(-c4ccco4)n3)CC2)c1 ZINC000152872383 341509527 /nfs/dbraw/zinc/50/95/27/341509527.db2.gz RRZVYWWSFVURRV-UHFFFAOYSA-N 1 2 314.385 4.321 20 0 DIADLO Cc1ccccc1[C@@H](C)c1noc([C@@H](c2ccccc2)[NH+](C)C)n1 ZINC000565330379 341523856 /nfs/dbraw/zinc/52/38/56/341523856.db2.gz GQLLDHFKSPKIRH-CRAIPNDOSA-N 1 2 321.424 4.181 20 0 DIADLO COc1cc2cc[nH+]c(N3CCC[C@H]3c3ccccn3)c2cc1F ZINC000565442106 341527585 /nfs/dbraw/zinc/52/75/85/341527585.db2.gz AGOQFDFYSNXIEU-KRWDZBQOSA-N 1 2 323.371 4.119 20 0 DIADLO CC(C)Oc1cccc([C@@H]([NH2+]CCc2ccccn2)C(F)F)c1 ZINC000567011884 341574157 /nfs/dbraw/zinc/57/41/57/341574157.db2.gz KVJOCGOVYMOEQH-QGZVFWFLSA-N 1 2 320.383 4.007 20 0 DIADLO O=C(Cc1coc2ccccc12)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000567252311 341591427 /nfs/dbraw/zinc/59/14/27/341591427.db2.gz NFEWIFOHIVPEIX-UHFFFAOYSA-N 1 2 317.348 4.004 20 0 DIADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1cc(F)cc(F)c1 ZINC000154804995 341596212 /nfs/dbraw/zinc/59/62/12/341596212.db2.gz HJDZVYXMDUTDKX-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)cc(C(F)(F)F)c1)c1cscn1 ZINC000567628159 341621240 /nfs/dbraw/zinc/62/12/40/341621240.db2.gz LAHRNORDBHCJAB-MRVPVSSYSA-N 1 2 304.312 4.152 20 0 DIADLO COC[C@H]([NH2+][C@@H]1CCOc2c(Cl)cccc21)c1ccc(C)o1 ZINC000156437644 341621426 /nfs/dbraw/zinc/62/14/26/341621426.db2.gz JUCNBPPHVJYSHX-CABCVRRESA-N 1 2 321.804 4.042 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1nc2ccccc2n1C ZINC000271901942 341625160 /nfs/dbraw/zinc/62/51/60/341625160.db2.gz YKEZSRGKXKHMFO-RYUDHWBXSA-N 1 2 315.367 4.263 20 0 DIADLO CCOc1cccc(Cl)c1C[NH2+][C@H](COC)c1ccc(C)o1 ZINC000568650020 341677621 /nfs/dbraw/zinc/67/76/21/341677621.db2.gz QUEGVKTVUIWDBR-OAHLLOKOSA-N 1 2 323.820 4.117 20 0 DIADLO Cc1ccc(-n2cc[nH+]c2)c(-c2nc(-c3ccccc3F)no2)c1 ZINC000572799384 341704591 /nfs/dbraw/zinc/70/45/91/341704591.db2.gz HBIZEDALERCMEM-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CC(C)Cn1ccnc1C[NH2+][C@@H](C)c1ccc(F)cc1Cl ZINC000164780995 341707708 /nfs/dbraw/zinc/70/77/08/341707708.db2.gz DKGLRPPSLBKGHR-LBPRGKRZSA-N 1 2 309.816 4.182 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2noc(Cc3ccccc3)n2)cc1 ZINC000165451071 341712089 /nfs/dbraw/zinc/71/20/89/341712089.db2.gz SFBXMFLYQOKRAK-CVEARBPZSA-N 1 2 321.424 4.381 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)C1(Cc2cccs2)CCCCC1 ZINC000573411469 341727856 /nfs/dbraw/zinc/72/78/56/341727856.db2.gz JVHYZHFNRQCBAC-UHFFFAOYSA-N 1 2 314.454 4.005 20 0 DIADLO CC(C)[C@H]1CN(c2cc[nH+]c3c(Cl)cccc23)CCCO1 ZINC000573546215 341731457 /nfs/dbraw/zinc/73/14/57/341731457.db2.gz URISZONGADKMQK-MRXNPFEDSA-N 1 2 304.821 4.140 20 0 DIADLO C[C@@H]1[C@H](C(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)[C@H]1c1ccccc1 ZINC000573880029 341742084 /nfs/dbraw/zinc/74/20/84/341742084.db2.gz VVFKDPWSLZHEPA-BKTGTZMESA-N 1 2 317.392 4.065 20 0 DIADLO Cc1ccc(Cc2noc(-c3ccc(C)c(Cl)c3F)n2)c[nH+]1 ZINC000573881175 341742091 /nfs/dbraw/zinc/74/20/91/341742091.db2.gz HHVXAKLBXOEIBF-UHFFFAOYSA-N 1 2 317.751 4.132 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[NH+]1CC2(CCC2(F)F)C1 ZINC000576392329 341843851 /nfs/dbraw/zinc/84/38/51/341843851.db2.gz GQAGBRASQQLNCE-UHFFFAOYSA-N 1 2 322.182 4.233 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)s1 ZINC000343624144 341849484 /nfs/dbraw/zinc/84/94/84/341849484.db2.gz YIKFHIQHHVEGNW-QMMMGPOBSA-N 1 2 316.257 4.258 20 0 DIADLO Cc1cc(NC(=O)N2CC(C)(C)C[C@H]2c2ccccc2)c(C)c[nH+]1 ZINC000577505804 341914017 /nfs/dbraw/zinc/91/40/17/341914017.db2.gz MKLZWTKXBUXJLG-SFHVURJKSA-N 1 2 323.440 4.125 20 0 DIADLO CC[C@@H]([NH2+]Cc1cn2cc(C)ccc2n1)c1cc(F)ccc1F ZINC000178725802 341962864 /nfs/dbraw/zinc/96/28/64/341962864.db2.gz VBWHLADZJBTENB-QGZVFWFLSA-N 1 2 315.367 4.162 20 0 DIADLO CC(=O)c1ccc(OCc2cn3cccc(C)c3[nH+]2)c(Cl)c1 ZINC000577997784 341965875 /nfs/dbraw/zinc/96/58/75/341965875.db2.gz GKYHKEMCLNETKN-UHFFFAOYSA-N 1 2 314.772 4.078 20 0 DIADLO CC(C)Oc1ccccc1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000338151088 519784586 /nfs/dbraw/zinc/78/45/86/519784586.db2.gz XRXCWIWNQCFNOT-UHFFFAOYSA-N 1 2 307.397 4.272 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ccc(Cl)cc1F)c1nc(C2CC2)no1 ZINC000189172496 519799187 /nfs/dbraw/zinc/79/91/87/519799187.db2.gz HQVMRPDTTMJYHX-CQSZACIVSA-N 1 2 323.799 4.226 20 0 DIADLO CC(C)c1ccc(NC(=O)CCc2c[nH+]cn2C)c(C(C)C)c1 ZINC000192659472 519836877 /nfs/dbraw/zinc/83/68/77/519836877.db2.gz KJDAYIAXMCKUEX-UHFFFAOYSA-N 1 2 313.445 4.238 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc(F)c(Cl)c2)s1 ZINC000268028408 519887939 /nfs/dbraw/zinc/88/79/39/519887939.db2.gz YLNBAKHYMPLDQF-VIFPVBQESA-N 1 2 313.829 4.305 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](C)c2ccc(-c3cccnc3)cc2)n1 ZINC000181285697 519904548 /nfs/dbraw/zinc/90/45/48/519904548.db2.gz QTZOFZPTKBGSHV-AWEZNQCLSA-N 1 2 322.412 4.106 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)n1 ZINC000180286411 519904984 /nfs/dbraw/zinc/90/49/84/519904984.db2.gz XFEXRKPCJDIPED-QGZVFWFLSA-N 1 2 317.408 4.353 20 0 DIADLO CC(C)n1cc[nH+]c1CNc1ccc(F)cc1OCC1CC1 ZINC000124599490 520034054 /nfs/dbraw/zinc/03/40/54/520034054.db2.gz PWMJJIMDCFFUAQ-UHFFFAOYSA-N 1 2 303.381 4.004 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+]2CC[C@@H]2c2ccccc2)cs1 ZINC000336842308 520480349 /nfs/dbraw/zinc/48/03/49/520480349.db2.gz RTPKLSKHGUMOBB-CZUORRHYSA-N 1 2 302.443 4.188 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+]2CC[C@@H]2c2ccccc2)cs1 ZINC000336842308 520480355 /nfs/dbraw/zinc/48/03/55/520480355.db2.gz RTPKLSKHGUMOBB-CZUORRHYSA-N 1 2 302.443 4.188 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nnc(C)o1)c1cccc(C(F)(F)F)c1 ZINC000181865823 520785966 /nfs/dbraw/zinc/78/59/66/520785966.db2.gz DFDDFGDCTKBSTR-CYBMUJFWSA-N 1 2 313.323 4.028 20 0 DIADLO CCC[C@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1ccc(F)cc1F ZINC000181680531 521165257 /nfs/dbraw/zinc/16/52/57/521165257.db2.gz SNWLTQIJGQJLIB-AWEZNQCLSA-N 1 2 323.387 4.276 20 0 DIADLO CCCC[C@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc(OC)cc1 ZINC000367743217 521243763 /nfs/dbraw/zinc/24/37/63/521243763.db2.gz ZBAUUWLMNCVTKL-ROUUACIJSA-N 1 2 313.445 4.317 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@@H](CC)c2ccc(OC)cc2)n1 ZINC000181823271 521352249 /nfs/dbraw/zinc/35/22/49/521352249.db2.gz WMQIZNQPEPNGGF-BBRMVZONSA-N 1 2 317.433 4.223 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1nnc(-c2cc(C)oc2C)o1 ZINC000336857096 521410095 /nfs/dbraw/zinc/41/00/95/521410095.db2.gz QDUVIJHCYMCOJG-UHFFFAOYSA-N 1 2 317.414 4.030 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1nnc(-c2cc(C)oc2C)o1 ZINC000336857096 521410108 /nfs/dbraw/zinc/41/01/08/521410108.db2.gz QDUVIJHCYMCOJG-UHFFFAOYSA-N 1 2 317.414 4.030 20 0 DIADLO CC[N@H+](Cc1nccc(C)n1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000339589474 521458798 /nfs/dbraw/zinc/45/87/98/521458798.db2.gz HSGKLSJVNWCTGE-CYBMUJFWSA-N 1 2 323.362 4.387 20 0 DIADLO CC[N@@H+](Cc1nccc(C)n1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000339589474 521458802 /nfs/dbraw/zinc/45/88/02/521458802.db2.gz HSGKLSJVNWCTGE-CYBMUJFWSA-N 1 2 323.362 4.387 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)n1 ZINC000180022958 521585970 /nfs/dbraw/zinc/58/59/70/521585970.db2.gz BURCSPMMVGTCNM-KHIZAZIESA-N 1 2 319.836 4.162 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)n1 ZINC000180023012 521586442 /nfs/dbraw/zinc/58/64/42/521586442.db2.gz BURCSPMMVGTCNM-PZSREKOKSA-N 1 2 319.836 4.162 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](c2ccccc2C)C(C)(C)C)n1 ZINC000180083190 521586742 /nfs/dbraw/zinc/58/67/42/521586742.db2.gz KJJMTSQBDGCYEP-KRWDZBQOSA-N 1 2 301.434 4.208 20 0 DIADLO CCc1nc(C[NH2+][C@H](c2cccc(Cl)c2)C2CCCC2)no1 ZINC000181042505 522354181 /nfs/dbraw/zinc/35/41/81/522354181.db2.gz ISDYEBDFXKVUDY-KRWDZBQOSA-N 1 2 319.836 4.307 20 0 DIADLO COC[C@@H]([NH2+][C@@H](CC(C)C)c1ccccn1)c1ccc(C)o1 ZINC000182229184 522374300 /nfs/dbraw/zinc/37/43/00/522374300.db2.gz TZOKPFJOVXVZHE-DLBZAZTESA-N 1 2 302.418 4.048 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cc(C)ccc2OC)cs1 ZINC000162338646 522421218 /nfs/dbraw/zinc/42/12/18/522421218.db2.gz ITTUSBDUEXWSSJ-CHWSQXEVSA-N 1 2 304.459 4.434 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cc(OC)ccc2OC)cs1 ZINC000162285174 522423167 /nfs/dbraw/zinc/42/31/67/522423167.db2.gz JAQNXYZIKUKBGK-VXGBXAGGSA-N 1 2 320.458 4.135 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccc(OC)cc2F)cs1 ZINC000162285814 522453450 /nfs/dbraw/zinc/45/34/50/522453450.db2.gz PAWKDFGYWLLSFT-MNOVXSKESA-N 1 2 308.422 4.265 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nc2ccccc2o1)c1nc(C)cs1 ZINC000182442707 522701535 /nfs/dbraw/zinc/70/15/35/522701535.db2.gz PXSXVNPNZDBAAH-RYUDHWBXSA-N 1 2 301.415 4.395 20 0 DIADLO CC[C@H]([NH2+][C@H](c1nccn1C)c1cccc(F)c1)c1ccccc1 ZINC000128365772 522750752 /nfs/dbraw/zinc/75/07/52/522750752.db2.gz IWMVZTFSBIRIRC-OALUTQOASA-N 1 2 323.415 4.390 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)n1 ZINC000180018328 522908980 /nfs/dbraw/zinc/90/89/80/522908980.db2.gz QRUHQRMCBXRDMU-CIGZNWKYSA-N 1 2 319.836 4.333 20 0 DIADLO CCc1noc([C@H](C)[N@H+](C)Cc2c3ccccc3oc2CC)n1 ZINC000104667704 522910598 /nfs/dbraw/zinc/91/05/98/522910598.db2.gz HLPDRFYSUDKPNQ-LBPRGKRZSA-N 1 2 313.401 4.134 20 0 DIADLO CCc1noc([C@H](C)[N@@H+](C)Cc2c3ccccc3oc2CC)n1 ZINC000104667704 522910602 /nfs/dbraw/zinc/91/06/02/522910602.db2.gz HLPDRFYSUDKPNQ-LBPRGKRZSA-N 1 2 313.401 4.134 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nc2ccccc2o1)c1nc(C)cs1 ZINC000182442726 522917198 /nfs/dbraw/zinc/91/71/98/522917198.db2.gz PXSXVNPNZDBAAH-NWDGAFQWSA-N 1 2 301.415 4.395 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1coc(-c2cccs2)n1 ZINC000130085106 522968506 /nfs/dbraw/zinc/96/85/06/522968506.db2.gz MQGVHOYUAYCIGG-OAHLLOKOSA-N 1 2 313.426 4.381 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1coc(-c2cccs2)n1 ZINC000130085106 522968514 /nfs/dbraw/zinc/96/85/14/522968514.db2.gz MQGVHOYUAYCIGG-OAHLLOKOSA-N 1 2 313.426 4.381 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nc([C@@H](C)OC)no1 ZINC000267019293 523088881 /nfs/dbraw/zinc/08/88/81/523088881.db2.gz JVTCQTYHLKQMLP-RISCZKNCSA-N 1 2 323.824 4.014 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nc([C@@H](C)OC)no1 ZINC000267019293 523088889 /nfs/dbraw/zinc/08/88/89/523088889.db2.gz JVTCQTYHLKQMLP-RISCZKNCSA-N 1 2 323.824 4.014 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000130177504 523120326 /nfs/dbraw/zinc/12/03/26/523120326.db2.gz CHBWWEUOLQZXAZ-AWEZNQCLSA-N 1 2 303.475 4.419 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000130177504 523120335 /nfs/dbraw/zinc/12/03/35/523120335.db2.gz CHBWWEUOLQZXAZ-AWEZNQCLSA-N 1 2 303.475 4.419 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CCC[C@@H]2c2ccccc2)cs1 ZINC000175022363 523470318 /nfs/dbraw/zinc/47/03/18/523470318.db2.gz IFWUKWKAGLSVEM-XJKSGUPXSA-N 1 2 302.443 4.188 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CCC[C@@H]2c2ccccc2)cs1 ZINC000175022363 523470329 /nfs/dbraw/zinc/47/03/29/523470329.db2.gz IFWUKWKAGLSVEM-XJKSGUPXSA-N 1 2 302.443 4.188 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1 ZINC000339152364 523560840 /nfs/dbraw/zinc/56/08/40/523560840.db2.gz LHPYCJIBJMSKTJ-MRXNPFEDSA-N 1 2 303.837 4.284 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1cccc(Cl)c1 ZINC000339152364 523560850 /nfs/dbraw/zinc/56/08/50/523560850.db2.gz LHPYCJIBJMSKTJ-MRXNPFEDSA-N 1 2 303.837 4.284 20 0 DIADLO C[N@H+](Cc1nc2ccccc2o1)Cc1cnc2ccccc2c1 ZINC000337198618 523567380 /nfs/dbraw/zinc/56/73/80/523567380.db2.gz ZTNPJSVWFMBIFS-UHFFFAOYSA-N 1 2 303.365 4.008 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2o1)Cc1cnc2ccccc2c1 ZINC000337198618 523567386 /nfs/dbraw/zinc/56/73/86/523567386.db2.gz ZTNPJSVWFMBIFS-UHFFFAOYSA-N 1 2 303.365 4.008 20 0 DIADLO CCc1cc(OC)ccc1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000337349218 523839449 /nfs/dbraw/zinc/83/94/49/523839449.db2.gz ZZMFHNQDMOQEFZ-UHFFFAOYSA-N 1 2 307.397 4.055 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](C)[C@@H](C)c2ccccc2C)cs1 ZINC000267024804 523911063 /nfs/dbraw/zinc/91/10/63/523911063.db2.gz LAMQTXVFDZIRDJ-UONOGXRCSA-N 1 2 304.459 4.352 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](C)[C@@H](C)c2ccccc2C)cs1 ZINC000267024804 523911067 /nfs/dbraw/zinc/91/10/67/523911067.db2.gz LAMQTXVFDZIRDJ-UONOGXRCSA-N 1 2 304.459 4.352 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cs1 ZINC000267050997 523912459 /nfs/dbraw/zinc/91/24/59/523912459.db2.gz QRRNSVQNHLYGJA-MLGOLLRUSA-N 1 2 320.433 4.327 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cs1 ZINC000267050997 523912467 /nfs/dbraw/zinc/91/24/67/523912467.db2.gz QRRNSVQNHLYGJA-MLGOLLRUSA-N 1 2 320.433 4.327 20 0 DIADLO CO[C@H](C)c1noc(C[N@H+](C)[C@@H](C)c2ccc(C(C)C)cc2)n1 ZINC000267037669 523918771 /nfs/dbraw/zinc/91/87/71/523918771.db2.gz OBAJQKICKXSVKW-UONOGXRCSA-N 1 2 317.433 4.093 20 0 DIADLO CO[C@H](C)c1noc(C[N@@H+](C)[C@@H](C)c2ccc(C(C)C)cc2)n1 ZINC000267037669 523918778 /nfs/dbraw/zinc/91/87/78/523918778.db2.gz OBAJQKICKXSVKW-UONOGXRCSA-N 1 2 317.433 4.093 20 0 DIADLO CC(=O)Nc1ccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)cc1 ZINC000286311609 534745957 /nfs/dbraw/zinc/74/59/57/534745957.db2.gz XLEUKSROZSSBQA-KRWDZBQOSA-N 1 2 312.417 4.102 20 0 DIADLO COc1ccc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)nc1 ZINC000338288098 524023416 /nfs/dbraw/zinc/02/34/16/524023416.db2.gz PNNKTTPKSFIDJF-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1ccc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)nc1 ZINC000338288098 524023419 /nfs/dbraw/zinc/02/34/19/524023419.db2.gz PNNKTTPKSFIDJF-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2csc(-c3ccoc3)n2)s1 ZINC000108366049 524395457 /nfs/dbraw/zinc/39/54/57/524395457.db2.gz GIGYSBOWXSWJRB-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2csc(-c3ccoc3)n2)s1 ZINC000108366049 524395463 /nfs/dbraw/zinc/39/54/63/524395463.db2.gz GIGYSBOWXSWJRB-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO C[C@@H]1CCN(C(=O)c2ccc(Oc3cc[nH+]cc3)c(Cl)c2)C1 ZINC000265095850 524487551 /nfs/dbraw/zinc/48/75/51/524487551.db2.gz FBRRMRQRBXOWEO-GFCCVEGCSA-N 1 2 316.788 4.009 20 0 DIADLO COc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nc(C(C)C)no1 ZINC000181703158 524729979 /nfs/dbraw/zinc/72/99/79/524729979.db2.gz ZQYTVFNNLPDIPS-OAHLLOKOSA-N 1 2 317.433 4.079 20 0 DIADLO COc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000367598720 524790831 /nfs/dbraw/zinc/79/08/31/524790831.db2.gz GCGAKTDOJHCESA-WMZOPIPTSA-N 1 2 313.445 4.173 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000124499170 524828216 /nfs/dbraw/zinc/82/82/16/524828216.db2.gz FDDNHVLAKTWBMR-CABCVRRESA-N 1 2 307.397 4.457 20 0 DIADLO C[C@@H](C[C@H](O)c1cccs1)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000128870920 524855289 /nfs/dbraw/zinc/85/52/89/524855289.db2.gz BKJVGKYPARDSNO-ONGXEEELSA-N 1 2 316.348 4.086 20 0 DIADLO C[C@H]1C[C@@H]1[C@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000180027293 524855987 /nfs/dbraw/zinc/85/59/87/524855987.db2.gz HVAYRIJNDZYEIR-JMPLFQLZSA-N 1 2 317.820 4.087 20 0 DIADLO Cc1cc(N(C)[C@H](C)c2ccccc2)nc(-c2ccncc2)[nH+]1 ZINC000112963660 525028417 /nfs/dbraw/zinc/02/84/17/525028417.db2.gz ZOBLRJSRHXDOLP-OAHLLOKOSA-N 1 2 304.397 4.044 20 0 DIADLO Cc1cc(N[C@H](C)c2ncc(-c3ccccc3)o2)nc(C2CC2)[nH+]1 ZINC000265762978 525301761 /nfs/dbraw/zinc/30/17/61/525301761.db2.gz BLIKACCWYIEZEF-CYBMUJFWSA-N 1 2 320.396 4.491 20 0 DIADLO Cc1ccc(N[C@@H]2CCc3ccc(Br)cc32)c[nH+]1 ZINC000302397220 525314196 /nfs/dbraw/zinc/31/41/96/525314196.db2.gz NXEHQHCMVQFPKT-OAHLLOKOSA-N 1 2 303.203 4.252 20 0 DIADLO Cc1ccccc1[C@@H](C)[NH2+][C@@H](c1nccn1C)c1cccc(F)c1 ZINC000128479494 525361583 /nfs/dbraw/zinc/36/15/83/525361583.db2.gz XJJAYBCIBGWXTA-DNVCBOLYSA-N 1 2 323.415 4.308 20 0 DIADLO Cc1ccccc1[C@H](C)[NH2+][C@@H](c1nccn1C)c1ccc(F)cc1 ZINC000268784636 525417892 /nfs/dbraw/zinc/41/78/92/525417892.db2.gz VDOFGYZUASRERV-HNAYVOBHSA-N 1 2 323.415 4.308 20 0 DIADLO C[C@H]([NH2+]Cc1csc(CCc2ccccc2)n1)c1ccncc1 ZINC000179389694 525483306 /nfs/dbraw/zinc/48/33/06/525483306.db2.gz LGDRQHRVEGKMCJ-HNNXBMFYSA-N 1 2 323.465 4.174 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)C(C)C ZINC000118839397 525549375 /nfs/dbraw/zinc/54/93/75/525549375.db2.gz QAWPKNODNKCOGC-KBPBESRZSA-N 1 2 316.449 4.118 20 0 DIADLO C[C@@H]([NH2+]Cc1cscn1)c1nc(-c2ccccc2)cs1 ZINC000107321900 525556713 /nfs/dbraw/zinc/55/67/13/525556713.db2.gz GJWXHLIMKSIROL-LLVKDONJSA-N 1 2 301.440 4.117 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2ccccc21)c1noc(-c2ccccc2)n1 ZINC000124454114 525563717 /nfs/dbraw/zinc/56/37/17/525563717.db2.gz XQAFSRGTGDHRFS-KBXCAEBGSA-N 1 2 319.408 4.465 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(F)(F)F)cs1)c1ccncc1F ZINC000338012529 525621329 /nfs/dbraw/zinc/62/13/29/525621329.db2.gz ROPLMEJSNNYYCA-SFYZADRCSA-N 1 2 319.327 4.108 20 0 DIADLO C[C@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1ccncc1 ZINC000182884533 525645864 /nfs/dbraw/zinc/64/58/64/525645864.db2.gz LKANDUBGQIHHLT-HNNXBMFYSA-N 1 2 318.424 4.455 20 0 DIADLO C[C@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1cccnc1 ZINC000182883958 525646549 /nfs/dbraw/zinc/64/65/49/525646549.db2.gz LGVQGIXAEMEKQN-HNNXBMFYSA-N 1 2 318.424 4.455 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1noc(-c2ccccc2)n1 ZINC000124254422 525692511 /nfs/dbraw/zinc/69/25/11/525692511.db2.gz CPFBINPCOZNOQH-PXAZEXFGSA-N 1 2 323.371 4.214 20 0 DIADLO Cc1cn2cc(NC(=O)N3CCC[C@@H]3c3ccccc3)ccc2[nH+]1 ZINC000265725042 525951880 /nfs/dbraw/zinc/95/18/80/525951880.db2.gz QJIFOYVGVCUSRV-QGZVFWFLSA-N 1 2 320.396 4.012 20 0 DIADLO Cc1cnc(C[N@@H+](C)Cc2cccc(C(F)(F)F)c2)s1 ZINC000180438992 526007945 /nfs/dbraw/zinc/00/79/45/526007945.db2.gz RWAMAKOKDFRRJQ-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1cnc(C[N@H+](C)Cc2cccc(C(F)(F)F)c2)s1 ZINC000180438992 526007954 /nfs/dbraw/zinc/00/79/54/526007954.db2.gz RWAMAKOKDFRRJQ-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1cnc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3n2C(C)C)o1 ZINC000266876733 526015881 /nfs/dbraw/zinc/01/58/81/526015881.db2.gz UNSOBNXOIMZEQQ-QGZVFWFLSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1cnc(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3n2C(C)C)o1 ZINC000266876733 526015890 /nfs/dbraw/zinc/01/58/90/526015890.db2.gz UNSOBNXOIMZEQQ-QGZVFWFLSA-N 1 2 324.428 4.251 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](Cc1cnc[nH]1)C1CC1 ZINC000180031488 526073527 /nfs/dbraw/zinc/07/35/27/526073527.db2.gz DVZOPCXEAZMMRR-LLVKDONJSA-N 1 2 309.335 4.154 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](Cc1cnc[nH]1)C1CC1 ZINC000180031488 526073538 /nfs/dbraw/zinc/07/35/38/526073538.db2.gz DVZOPCXEAZMMRR-LLVKDONJSA-N 1 2 309.335 4.154 20 0 DIADLO CSc1ccc([C@H](C)[NH2+][C@@H](CO)c2c(F)cccc2F)cc1 ZINC000266797731 526074032 /nfs/dbraw/zinc/07/40/32/526074032.db2.gz RBCHIALYVNUVOU-ZBEGNZNMSA-N 1 2 323.408 4.071 20 0 DIADLO CSc1ccc([C@H](C)[NH2+][C@H](CO)c2c(F)cccc2F)cc1 ZINC000266797729 526076268 /nfs/dbraw/zinc/07/62/68/526076268.db2.gz RBCHIALYVNUVOU-MEDUHNTESA-N 1 2 323.408 4.071 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2cccc(O)c2Cl)C2CC2)s1 ZINC000339281722 526133992 /nfs/dbraw/zinc/13/39/92/526133992.db2.gz JAYMVETZOIQRAO-AWEZNQCLSA-N 1 2 308.834 4.051 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000103227234 526134945 /nfs/dbraw/zinc/13/49/45/526134945.db2.gz FCDRBJGNYJHBBD-NSHDSACASA-N 1 2 318.323 4.406 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000103227234 526134952 /nfs/dbraw/zinc/13/49/52/526134952.db2.gz FCDRBJGNYJHBBD-NSHDSACASA-N 1 2 318.323 4.406 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2sc(C)nc2C(F)(F)F)s1 ZINC000183671462 526161670 /nfs/dbraw/zinc/16/16/70/526161670.db2.gz DIXOUCBCEVOFGZ-ZETCQYMHSA-N 1 2 321.393 4.086 20 0 DIADLO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1noc(-c3ccccc3)n1)CC2 ZINC000124428666 526193519 /nfs/dbraw/zinc/19/35/19/526193519.db2.gz MCZZVMXQNXYSDQ-KSSFIOAISA-N 1 2 319.408 4.383 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CCC(=O)c1ccc(CC(C)C)cc1 ZINC000107291704 526237300 /nfs/dbraw/zinc/23/73/00/526237300.db2.gz BZLXUCPDNQASMP-UHFFFAOYSA-N 1 2 324.424 4.190 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2nc(C(C)(C)C)cs2)n1 ZINC000267971659 526321899 /nfs/dbraw/zinc/32/18/99/526321899.db2.gz BRXRQDHNDRZOEL-UHFFFAOYSA-N 1 2 309.504 4.230 20 0 DIADLO Cc1nnc(C[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)s1 ZINC000365670314 526334471 /nfs/dbraw/zinc/33/44/71/526334471.db2.gz ROYQDUPEOLHLMC-CQSZACIVSA-N 1 2 307.850 4.227 20 0 DIADLO Cc1nnc(C[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)s1 ZINC000365670314 526334476 /nfs/dbraw/zinc/33/44/76/526334476.db2.gz ROYQDUPEOLHLMC-CQSZACIVSA-N 1 2 307.850 4.227 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CC=C(c3cc(C)cc(C)c3)CC2)s1 ZINC000338282588 526392914 /nfs/dbraw/zinc/39/29/14/526392914.db2.gz GUCUZQNLJNSBLA-CQSZACIVSA-N 1 2 313.470 4.314 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CC=C(c3cc(C)cc(C)c3)CC2)s1 ZINC000338282588 526392919 /nfs/dbraw/zinc/39/29/19/526392919.db2.gz GUCUZQNLJNSBLA-CQSZACIVSA-N 1 2 313.470 4.314 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CCc3ccc(C(C)(C)C)cc3C2)s1 ZINC000338303821 526395738 /nfs/dbraw/zinc/39/57/38/526395738.db2.gz NXYVPMLCQWNPTI-GFCCVEGCSA-N 1 2 315.486 4.263 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CCc3ccc(C(C)(C)C)cc3C2)s1 ZINC000338303821 526395743 /nfs/dbraw/zinc/39/57/43/526395743.db2.gz NXYVPMLCQWNPTI-GFCCVEGCSA-N 1 2 315.486 4.263 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)o1 ZINC000159330721 526404573 /nfs/dbraw/zinc/40/45/73/526404573.db2.gz HZOURCYKVUTRLP-MRXNPFEDSA-N 1 2 311.360 4.146 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)o1 ZINC000159330721 526404580 /nfs/dbraw/zinc/40/45/80/526404580.db2.gz HZOURCYKVUTRLP-MRXNPFEDSA-N 1 2 311.360 4.146 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2cc3cccc(F)c3o2)s1 ZINC000338350226 526405281 /nfs/dbraw/zinc/40/52/81/526405281.db2.gz DQTDWBOAONZDQV-IUCAKERBSA-N 1 2 305.378 4.144 20 0 DIADLO Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]Cc1ccn[nH]1 ZINC000237581129 526568242 /nfs/dbraw/zinc/56/82/42/526568242.db2.gz HOVIQWAYWQMJIY-LBPRGKRZSA-N 1 2 312.442 4.001 20 0 DIADLO c1sc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)nc1C1CC1 ZINC000180951768 526631665 /nfs/dbraw/zinc/63/16/65/526631665.db2.gz YEWOCDIVDFYVTM-IBGZPJMESA-N 1 2 321.449 4.295 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000128110816 526740918 /nfs/dbraw/zinc/74/09/18/526740918.db2.gz FHHWSVAGZTXGMK-CQSZACIVSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+](C)[C@H](C)c1ccccn1 ZINC000128110816 526740926 /nfs/dbraw/zinc/74/09/26/526740926.db2.gz FHHWSVAGZTXGMK-CQSZACIVSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)[C@H](C)c1ccco1 ZINC000102655753 526751856 /nfs/dbraw/zinc/75/18/56/526751856.db2.gz OPFCJGXUTNZRIS-LLVKDONJSA-N 1 2 302.399 4.498 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)[C@H](C)c1ccco1 ZINC000102655753 526751864 /nfs/dbraw/zinc/75/18/64/526751864.db2.gz OPFCJGXUTNZRIS-LLVKDONJSA-N 1 2 302.399 4.498 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[NH2+][C@H](C)c1ccncc1F ZINC000338359974 526751881 /nfs/dbraw/zinc/75/18/81/526751881.db2.gz VBUZYUJFCSWJEJ-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccccc2F)C2CCCC2)oc1C ZINC000181498410 526894308 /nfs/dbraw/zinc/89/43/08/526894308.db2.gz KLABECQMXGFLMI-SFHVURJKSA-N 1 2 302.393 4.452 20 0 DIADLO Cc1nc(C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)cs1 ZINC000182521469 526894334 /nfs/dbraw/zinc/89/43/34/526894334.db2.gz SPZQJZJTBUEEQU-AWEZNQCLSA-N 1 2 308.834 4.108 20 0 DIADLO Cc1nc(C[NH2+][C@H](CC(F)(F)F)c2ccc(F)cc2)oc1C ZINC000180574219 526894404 /nfs/dbraw/zinc/89/44/04/526894404.db2.gz KRBDXESYIJRFPM-CYBMUJFWSA-N 1 2 316.298 4.214 20 0 DIADLO Cc1nc(C[NH2+][C@H](CCC(C)C)c2ccc(Cl)cc2)no1 ZINC000180027445 526894503 /nfs/dbraw/zinc/89/45/03/526894503.db2.gz KFHZNEBWBZCUQP-OAHLLOKOSA-N 1 2 307.825 4.299 20 0 DIADLO Clc1ccc(SC2CC[NH+](Cc3cocn3)CC2)cc1 ZINC000191947725 526959503 /nfs/dbraw/zinc/95/95/03/526959503.db2.gz NZCRJWJDCJJLIY-UHFFFAOYSA-N 1 2 308.834 4.085 20 0 DIADLO Cc1ncc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3o2)s1 ZINC000336853315 527255514 /nfs/dbraw/zinc/25/55/14/527255514.db2.gz AIOCWRJUZMKQRG-HNNXBMFYSA-N 1 2 313.426 4.320 20 0 DIADLO Cc1ncc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3o2)s1 ZINC000336853315 527255522 /nfs/dbraw/zinc/25/55/22/527255522.db2.gz AIOCWRJUZMKQRG-HNNXBMFYSA-N 1 2 313.426 4.320 20 0 DIADLO O=C(Nc1ccc2ccccc2c1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000128385362 527295663 /nfs/dbraw/zinc/29/56/63/527295663.db2.gz GGBNQCDUGFYTFK-KRWDZBQOSA-N 1 2 320.396 4.322 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)s1 ZINC000366034152 527688929 /nfs/dbraw/zinc/68/89/29/527688929.db2.gz ZZXAGNQFKPIEJK-NXEZZACHSA-N 1 2 322.421 4.022 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)s1 ZINC000366034152 527688931 /nfs/dbraw/zinc/68/89/31/527688931.db2.gz ZZXAGNQFKPIEJK-NXEZZACHSA-N 1 2 322.421 4.022 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)s1 ZINC000366034181 527688945 /nfs/dbraw/zinc/68/89/45/527688945.db2.gz ZZXAGNQFKPIEJK-ZJUUUORDSA-N 1 2 322.421 4.022 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)s1 ZINC000366034181 527688946 /nfs/dbraw/zinc/68/89/46/527688946.db2.gz ZZXAGNQFKPIEJK-ZJUUUORDSA-N 1 2 322.421 4.022 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)s1 ZINC000366034178 527689060 /nfs/dbraw/zinc/68/90/60/527689060.db2.gz ZZXAGNQFKPIEJK-VHSXEESVSA-N 1 2 322.421 4.022 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)s1 ZINC000366034178 527689062 /nfs/dbraw/zinc/68/90/62/527689062.db2.gz ZZXAGNQFKPIEJK-VHSXEESVSA-N 1 2 322.421 4.022 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2cccc(C3CC3)c2)s1 ZINC000340254657 534987231 /nfs/dbraw/zinc/98/72/31/534987231.db2.gz LPNXMQHIHDZWGF-LBPRGKRZSA-N 1 2 301.459 4.390 20 0 DIADLO CC[C@@H]([NH2+]Cc1nn(CC)c2ccccc12)c1nc(C)cs1 ZINC000274421638 535806559 /nfs/dbraw/zinc/80/65/59/535806559.db2.gz KLFZGGPTTKDZJD-CQSZACIVSA-N 1 2 314.458 4.062 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nnc(C)s1)c1cccc(Cl)c1F ZINC000274029129 535808796 /nfs/dbraw/zinc/80/87/96/535808796.db2.gz GWDBQAYEIRAYLD-PRHODGIISA-N 1 2 313.829 4.441 20 0 DIADLO CC[C@H](Oc1ccccc1C)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000273971259 536051798 /nfs/dbraw/zinc/05/17/98/536051798.db2.gz QIEJXBDRXABTMA-INIZCTEOSA-N 1 2 323.396 4.202 20 0 DIADLO COc1ccc([NH2+]C[C@H]2CC(C)=C[C@@H](C)C2)cc1NC(C)=O ZINC000289428068 536815060 /nfs/dbraw/zinc/81/50/60/536815060.db2.gz DJBNJSNAWRRBID-IUODEOHRSA-N 1 2 302.418 4.058 20 0 DIADLO COc1ccccc1C[NH2+][C@H](C)c1nc(C(F)(F)F)cs1 ZINC000274671163 537049193 /nfs/dbraw/zinc/04/91/93/537049193.db2.gz YFBLMKMIMRAMNW-SECBINFHSA-N 1 2 316.348 4.021 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1cc(Br)cnc1Cl ZINC001138945382 1046333504 /nfs/dbraw/zinc/33/35/04/1046333504.db2.gz CZIFRVZWLOLZSL-LBPRGKRZSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1cc(Br)cnc1Cl ZINC001138945382 1046333514 /nfs/dbraw/zinc/33/35/14/1046333514.db2.gz CZIFRVZWLOLZSL-LBPRGKRZSA-N 1 2 317.658 4.262 20 0 DIADLO OCC[C@H]1CCC[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC001235600935 1054752491 /nfs/dbraw/zinc/75/24/91/1054752491.db2.gz IBHRAMTTWHBNHB-SNVBAGLBSA-N 1 2 322.663 4.241 20 0 DIADLO OCC[C@H]1CCC[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC001235600935 1054752500 /nfs/dbraw/zinc/75/25/00/1054752500.db2.gz IBHRAMTTWHBNHB-SNVBAGLBSA-N 1 2 322.663 4.241 20 0 DIADLO Cc1cc(Br)cc(C[NH+]2CC(CC(F)(F)F)C2)c1 ZINC001308810324 1066285709 /nfs/dbraw/zinc/28/57/09/1066285709.db2.gz TWYHOYRSOPBKJZ-UHFFFAOYSA-N 1 2 322.168 4.142 20 0 DIADLO COC(=O)c1cc(Nc2cc(C3CC3)c[nH+]c2C)ccc1Cl ZINC001213500808 1035548177 /nfs/dbraw/zinc/54/81/77/1035548177.db2.gz AAHVGSJPDXGNEV-UHFFFAOYSA-N 1 2 316.788 4.451 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000607064814 1035584076 /nfs/dbraw/zinc/58/40/76/1035584076.db2.gz SDWQYGQXNBIRPA-KRWDZBQOSA-N 1 2 307.397 4.103 20 0 DIADLO Cc1cnccc1C[N@H+]1C[C@@H](c2ccccc2Cl)OC[C@@H]1C ZINC000579797029 1035621638 /nfs/dbraw/zinc/62/16/38/1035621638.db2.gz WTLJSIQUQZXVOE-KSSFIOAISA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cnccc1C[N@@H+]1C[C@@H](c2ccccc2Cl)OC[C@@H]1C ZINC000579797029 1035621642 /nfs/dbraw/zinc/62/16/42/1035621642.db2.gz WTLJSIQUQZXVOE-KSSFIOAISA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cnccc1C[N@H+]1C[C@@H](c2ccccc2Cl)OC[C@H]1C ZINC000579797028 1035622927 /nfs/dbraw/zinc/62/29/27/1035622927.db2.gz WTLJSIQUQZXVOE-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cnccc1C[N@@H+]1C[C@@H](c2ccccc2Cl)OC[C@H]1C ZINC000579797028 1035622934 /nfs/dbraw/zinc/62/29/34/1035622934.db2.gz WTLJSIQUQZXVOE-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1noc(C)c1C[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000153972339 1035656500 /nfs/dbraw/zinc/65/65/00/1035656500.db2.gz NCHJZCATWYRTHY-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1cc(C)c(Nc2c[nH+]c(C)cc2C)c(Br)n1 ZINC001213505973 1035662904 /nfs/dbraw/zinc/66/29/04/1035662904.db2.gz WNVUOTCQDYREGY-UHFFFAOYSA-N 1 2 306.207 4.216 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2nc3ccc(F)cc3s2)o1 ZINC000683200515 1035721747 /nfs/dbraw/zinc/72/17/47/1035721747.db2.gz APVUIOUCGVNXFB-ZWNOBZJWSA-N 1 2 316.401 4.442 20 0 DIADLO COc1ccc(Br)c(Nc2c[nH+]c(C)cc2C)c1 ZINC001213513348 1035735175 /nfs/dbraw/zinc/73/51/75/1035735175.db2.gz DSAPFQAYTDZRCF-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@H+](C)Cc1cccs1 ZINC000007846673 1035738818 /nfs/dbraw/zinc/73/88/18/1035738818.db2.gz IIZKPDWTTRJVQB-UHFFFAOYSA-N 1 2 316.470 4.250 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+](C)Cc1cccs1 ZINC000007846673 1035738833 /nfs/dbraw/zinc/73/88/33/1035738833.db2.gz IIZKPDWTTRJVQB-UHFFFAOYSA-N 1 2 316.470 4.250 20 0 DIADLO Clc1cnc2oc(C[NH2+]Cc3nc(C4CC4)cs3)cc2c1 ZINC000648483367 1035744148 /nfs/dbraw/zinc/74/41/48/1035744148.db2.gz BAWZPDNYCDAFCM-UHFFFAOYSA-N 1 2 319.817 4.105 20 0 DIADLO Cc1ccc(C[N@H+](Cc2nc(-c3ccco3)no2)C2CC2)cc1C ZINC000097493586 1035775329 /nfs/dbraw/zinc/77/53/29/1035775329.db2.gz UWSXKUZJTHSWJG-UHFFFAOYSA-N 1 2 323.396 4.111 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2nc(-c3ccco3)no2)C2CC2)cc1C ZINC000097493586 1035775348 /nfs/dbraw/zinc/77/53/48/1035775348.db2.gz UWSXKUZJTHSWJG-UHFFFAOYSA-N 1 2 323.396 4.111 20 0 DIADLO CCC[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccccn1 ZINC000179464784 1035877754 /nfs/dbraw/zinc/87/77/54/1035877754.db2.gz LVUNTWOXJDWFJT-CQSZACIVSA-N 1 2 313.426 4.429 20 0 DIADLO CCc1nc(C[NH2+][C@H](c2ccc(C(C)C)cc2)C(C)C)no1 ZINC000154353259 1035880004 /nfs/dbraw/zinc/88/00/04/1035880004.db2.gz VJGDEAOJSHTSTP-SFHVURJKSA-N 1 2 301.434 4.242 20 0 DIADLO CCc1nc(C[NH2+][C@@H](c2ccc(C(C)C)cc2)C(C)C)no1 ZINC000154353156 1035880199 /nfs/dbraw/zinc/88/01/99/1035880199.db2.gz VJGDEAOJSHTSTP-GOSISDBHSA-N 1 2 301.434 4.242 20 0 DIADLO Cc1ccnc(C[N@@H+]2Cc3ccccc3C[C@H]2c2ccccc2)n1 ZINC000339661533 1035905052 /nfs/dbraw/zinc/90/50/52/1035905052.db2.gz OJRYDUAKAJFIMN-FQEVSTJZSA-N 1 2 315.420 4.085 20 0 DIADLO Cc1ccnc(C[N@H+]2Cc3ccccc3C[C@H]2c2ccccc2)n1 ZINC000339661533 1035905066 /nfs/dbraw/zinc/90/50/66/1035905066.db2.gz OJRYDUAKAJFIMN-FQEVSTJZSA-N 1 2 315.420 4.085 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2cccc(Cl)c2)nc2ccccc12 ZINC000024373843 1035950813 /nfs/dbraw/zinc/95/08/13/1035950813.db2.gz WHQMDAJXDKEWPB-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2cccc(Cl)c2)nc2ccccc12 ZINC000024373843 1035950820 /nfs/dbraw/zinc/95/08/20/1035950820.db2.gz WHQMDAJXDKEWPB-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO Cc1ccoc1CNc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000339793586 1035963174 /nfs/dbraw/zinc/96/31/74/1035963174.db2.gz JTTIXNMIFSMJAY-UHFFFAOYSA-N 1 2 305.381 4.115 20 0 DIADLO Cc1nc(C[NH+]2CCC(c3ccccc3Cl)CC2)cs1 ZINC001206805824 1035976634 /nfs/dbraw/zinc/97/66/34/1035976634.db2.gz OPYQLLZNNKPYJY-UHFFFAOYSA-N 1 2 306.862 4.485 20 0 DIADLO CC(C)(C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc(F)c1 ZINC000134733459 1035992988 /nfs/dbraw/zinc/99/29/88/1035992988.db2.gz YDLNNNKXQYBWCX-UHFFFAOYSA-N 1 2 323.371 4.132 20 0 DIADLO Cc1n[nH]cc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000180150667 1036046188 /nfs/dbraw/zinc/04/61/88/1036046188.db2.gz SEHTZSJDRFVGBG-OAHLLOKOSA-N 1 2 310.228 4.362 20 0 DIADLO Cc1n[nH]cc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000180150667 1036046207 /nfs/dbraw/zinc/04/62/07/1036046207.db2.gz SEHTZSJDRFVGBG-OAHLLOKOSA-N 1 2 310.228 4.362 20 0 DIADLO CCOc1ncccc1C[NH2+]Cc1ccc(Oc2ccccc2)o1 ZINC000180790691 1036089930 /nfs/dbraw/zinc/08/99/30/1036089930.db2.gz PYBXEYWTNOTOAO-UHFFFAOYSA-N 1 2 324.380 4.155 20 0 DIADLO CCc1ccc([C@H](C)[NH2+]Cc2coc(-c3cccs3)n2)o1 ZINC000155057813 1036105082 /nfs/dbraw/zinc/10/50/82/1036105082.db2.gz DJZJJLFMRRNRDR-NSHDSACASA-N 1 2 302.399 4.409 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@H+](Cc1ccccc1C)C3 ZINC000039227867 1036120642 /nfs/dbraw/zinc/12/06/42/1036120642.db2.gz JZXPCGIGHYVDRF-UHFFFAOYSA-N 1 2 306.409 4.043 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@@H+](Cc1ccccc1C)C3 ZINC000039227867 1036120651 /nfs/dbraw/zinc/12/06/51/1036120651.db2.gz JZXPCGIGHYVDRF-UHFFFAOYSA-N 1 2 306.409 4.043 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1nc2ccccc2n1C(F)F ZINC000046055443 1036170100 /nfs/dbraw/zinc/17/01/00/1036170100.db2.gz UCTSIEQNPURKQA-UHFFFAOYSA-N 1 2 307.369 4.125 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1nc2ccccc2n1C(F)F ZINC000046055443 1036170110 /nfs/dbraw/zinc/17/01/10/1036170110.db2.gz UCTSIEQNPURKQA-UHFFFAOYSA-N 1 2 307.369 4.125 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2nc(C(C)C)ns2)c1 ZINC001167138216 1036176178 /nfs/dbraw/zinc/17/61/78/1036176178.db2.gz KKXFECBRGUAIJE-OAHLLOKOSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2nc(C(C)C)ns2)c1 ZINC001167138216 1036176184 /nfs/dbraw/zinc/17/61/84/1036176184.db2.gz KKXFECBRGUAIJE-OAHLLOKOSA-N 1 2 301.459 4.307 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1ccnc(Cl)c1 ZINC000090228877 1036188184 /nfs/dbraw/zinc/18/81/84/1036188184.db2.gz PYGDHOVGKDAJTR-ZETCQYMHSA-N 1 2 318.701 4.142 20 0 DIADLO Cn1c2ccccc2[nH+]c1NCc1ccc(Br)s1 ZINC000079044857 1036214753 /nfs/dbraw/zinc/21/47/53/1036214753.db2.gz UFWDCBIQCZPDLL-UHFFFAOYSA-N 1 2 322.231 4.009 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1ncccc1C(F)(F)F ZINC000093845322 1036216127 /nfs/dbraw/zinc/21/61/27/1036216127.db2.gz PJDJOWZWSPMKGY-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1ncccc1C(F)(F)F ZINC000093845322 1036216142 /nfs/dbraw/zinc/21/61/42/1036216142.db2.gz PJDJOWZWSPMKGY-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO C[N@H+](CCOc1ccccc1Cl)Cc1csc(C2CC2)n1 ZINC000340125238 1036221904 /nfs/dbraw/zinc/22/19/04/1036221904.db2.gz UFZGWAXHWNSVHI-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO C[N@@H+](CCOc1ccccc1Cl)Cc1csc(C2CC2)n1 ZINC000340125238 1036221925 /nfs/dbraw/zinc/22/19/25/1036221925.db2.gz UFZGWAXHWNSVHI-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@@H]2COc3ccc(Cl)cc32)o1 ZINC000538426025 1036239612 /nfs/dbraw/zinc/23/96/12/1036239612.db2.gz UJSWTWPVTBTRGF-WDBKCZKBSA-N 1 2 303.789 4.280 20 0 DIADLO c1c2ccccc2oc1C[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000236575388 1036293220 /nfs/dbraw/zinc/29/32/20/1036293220.db2.gz XVJVZNJRVPNNSV-UHFFFAOYSA-N 1 2 304.349 4.378 20 0 DIADLO Cc1cn(C)nc1C[N@@H+](C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC001167234340 1036299080 /nfs/dbraw/zinc/29/90/80/1036299080.db2.gz WQQCKJDFAIKACN-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO Cc1cn(C)nc1C[N@H+](C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC001167234340 1036299099 /nfs/dbraw/zinc/29/90/99/1036299099.db2.gz WQQCKJDFAIKACN-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1C[N@H+]1C[C@H]2CC[C@@H](C1)C2(F)F ZINC001204472403 1036303252 /nfs/dbraw/zinc/30/32/52/1036303252.db2.gz IIQMCZIYOZKXAG-TXEJJXNPSA-N 1 2 323.280 4.322 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1C[N@@H+]1C[C@H]2CC[C@@H](C1)C2(F)F ZINC001204472403 1036303267 /nfs/dbraw/zinc/30/32/67/1036303267.db2.gz IIQMCZIYOZKXAG-TXEJJXNPSA-N 1 2 323.280 4.322 20 0 DIADLO CCOc1ccccc1C[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000236942763 1036326454 /nfs/dbraw/zinc/32/64/54/1036326454.db2.gz DGRKTXDECCHXLH-UHFFFAOYSA-N 1 2 308.381 4.030 20 0 DIADLO Cc1cc(Nc2ccc(N)cc2C(F)(F)F)ccc1[NH+](C)C ZINC001210042186 1036365187 /nfs/dbraw/zinc/36/51/87/1036365187.db2.gz WSENZTGQDLZMMX-UHFFFAOYSA-N 1 2 309.335 4.406 20 0 DIADLO FC(F)(F)c1ccncc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001210094379 1036387518 /nfs/dbraw/zinc/38/75/18/1036387518.db2.gz QYDNVAYGGBZWTA-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO c1ccc(-c2ccc[nH+]c2NCC2(c3ccccc3)COC2)cc1 ZINC001167290314 1036451069 /nfs/dbraw/zinc/45/10/69/1036451069.db2.gz SDZLNAOXNSTOAJ-UHFFFAOYSA-N 1 2 316.404 4.129 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cc(O)ccc1Cl ZINC000625288790 1036456897 /nfs/dbraw/zinc/45/68/97/1036456897.db2.gz PZCGZWLJWSCGPJ-SNVBAGLBSA-N 1 2 309.768 4.044 20 0 DIADLO Fc1ccc([C@H]([NH2+][C@@H]2CCCn3ccnc32)c2ccccc2)cc1 ZINC000655701738 1036494861 /nfs/dbraw/zinc/49/48/61/1036494861.db2.gz YXGPAKSQINULTE-RTBURBONSA-N 1 2 321.399 4.236 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H]3CCCc4occc43)co2)cc1 ZINC000155461023 1036586572 /nfs/dbraw/zinc/58/65/72/1036586572.db2.gz IYXLMRAIFDSVMV-KRWDZBQOSA-N 1 2 308.381 4.410 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(Br)c(C)c2C)cc1N ZINC001210287765 1036589993 /nfs/dbraw/zinc/58/99/93/1036589993.db2.gz DMDKXDCIBPZZHK-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO Cc1[nH+]cc(Nc2cnc3cc(C(F)(F)F)ccc3c2)cc1N ZINC001210288786 1036592149 /nfs/dbraw/zinc/59/21/49/1036592149.db2.gz PWYAVITWPAENGF-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Cc1[nH+]cc(Nc2c(Cl)cccc2OC(F)(F)F)cc1N ZINC001210291292 1036595522 /nfs/dbraw/zinc/59/55/22/1036595522.db2.gz YXYXORMHFLRQPT-UHFFFAOYSA-N 1 2 317.698 4.268 20 0 DIADLO Cc1cc(CNc2cc(F)c(N3CCCC3)c(F)c2)cc(C)[nH+]1 ZINC001648848346 1036629660 /nfs/dbraw/zinc/62/96/60/1036629660.db2.gz FIXGHYVDFKKUPE-UHFFFAOYSA-N 1 2 317.383 4.189 20 0 DIADLO FC(F)(F)n1cc(Nc2ccc([NH+]3CCCCC3)cc2)cn1 ZINC001210363525 1036649590 /nfs/dbraw/zinc/64/95/90/1036649590.db2.gz ZDOPOPDDUVGWMB-UHFFFAOYSA-N 1 2 310.323 4.093 20 0 DIADLO COc1ccc(OC)c([C@@H](C)[NH2+][C@H](C)c2nc(C)sc2C)c1 ZINC000315848011 1036662926 /nfs/dbraw/zinc/66/29/26/1036662926.db2.gz LGQUKZGHCUGNBN-GHMZBOCLSA-N 1 2 320.458 4.189 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2c(F)c(F)cc(F)c2F)c(C)o1 ZINC000683692480 1036718820 /nfs/dbraw/zinc/71/88/20/1036718820.db2.gz SONANLKAZHNERU-MRVPVSSYSA-N 1 2 301.283 4.304 20 0 DIADLO CC(C)C[C@@H](C)CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000340488320 1036734541 /nfs/dbraw/zinc/73/45/41/1036734541.db2.gz NYTSOUQQFHYVRX-CYBMUJFWSA-N 1 2 303.381 4.022 20 0 DIADLO CC[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccccc1OC ZINC000340490933 1036739733 /nfs/dbraw/zinc/73/97/33/1036739733.db2.gz SRBAHZKJZJIRPA-MRXNPFEDSA-N 1 2 309.331 4.353 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H](C)c2csc(C(C)C)n2)ccn1 ZINC000348639132 1036744565 /nfs/dbraw/zinc/74/45/65/1036744565.db2.gz GNRISLCXKKSBDZ-RYUDHWBXSA-N 1 2 305.447 4.082 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]C(C)(C)c2ccc(F)cc2)cs1 ZINC000177672341 1036842324 /nfs/dbraw/zinc/84/23/24/1036842324.db2.gz DDGDFMMTDGBRGL-NSHDSACASA-N 1 2 308.422 4.015 20 0 DIADLO CC(C)(O)c1ccc(Nc2cc[nH+]c3ccc(Cl)cc23)cc1 ZINC001210616514 1036876855 /nfs/dbraw/zinc/87/68/55/1036876855.db2.gz IYQKHLWXQLIVKR-UHFFFAOYSA-N 1 2 312.800 4.281 20 0 DIADLO c1cn(Cc2cccc(Nc3cnc4sccc4c3)c2)c[nH+]1 ZINC001210694114 1036920546 /nfs/dbraw/zinc/92/05/46/1036920546.db2.gz QBWWMOVUBPGAII-UHFFFAOYSA-N 1 2 306.394 4.285 20 0 DIADLO Cc1nsc(C)c1C[NH2+][C@H](C)c1nc(C(F)(F)F)cs1 ZINC000568163378 1036996541 /nfs/dbraw/zinc/99/65/41/1036996541.db2.gz VYHQDPLBIRPPKX-SSDOTTSWSA-N 1 2 321.393 4.086 20 0 DIADLO Cc1ccc(Nc2cc(Br)c(Cl)cc2N)[nH+]c1 ZINC001211012379 1037092197 /nfs/dbraw/zinc/09/21/97/1037092197.db2.gz CRXVCZFBRHPPLD-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO Cc1ccc(Nc2cccc(I)c2C)[nH+]c1 ZINC001211012144 1037094055 /nfs/dbraw/zinc/09/40/55/1037094055.db2.gz XMHGGXIPCXACLX-UHFFFAOYSA-N 1 2 324.165 4.047 20 0 DIADLO c1c2ccccc2[nH]c1CNc1ccc(N2CCCCC2)c[nH+]1 ZINC000683923114 1037101218 /nfs/dbraw/zinc/10/12/18/1037101218.db2.gz WAOXCQAJFXMAOK-UHFFFAOYSA-N 1 2 306.413 4.165 20 0 DIADLO CCC[C@H]([NH2+]Cc1ncc(C(F)(F)F)s1)c1ccccn1 ZINC000683926631 1037111863 /nfs/dbraw/zinc/11/18/63/1037111863.db2.gz CXMXIOYOUOELLE-JTQLQIEISA-N 1 2 315.364 4.188 20 0 DIADLO CCOc1ccc(F)c(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001211053318 1037118447 /nfs/dbraw/zinc/11/84/47/1037118447.db2.gz QVQZCRPTEGHNFE-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO CCCCn1c(SCCC(C)C)nnc1[C@H](CC)[NH+](C)C ZINC000078353739 1037134312 /nfs/dbraw/zinc/13/43/12/1037134312.db2.gz HXFQCROKYMCNCD-AWEZNQCLSA-N 1 2 312.527 4.229 20 0 DIADLO CC(C)c1noc(C[N@H+](Cc2cccc(Cl)c2)C(C)C)n1 ZINC000047958921 1037213747 /nfs/dbraw/zinc/21/37/47/1037213747.db2.gz JIHNKTYHWJJXPH-UHFFFAOYSA-N 1 2 307.825 4.257 20 0 DIADLO CC(C)c1noc(C[N@@H+](Cc2cccc(Cl)c2)C(C)C)n1 ZINC000047958921 1037213761 /nfs/dbraw/zinc/21/37/61/1037213761.db2.gz JIHNKTYHWJJXPH-UHFFFAOYSA-N 1 2 307.825 4.257 20 0 DIADLO FC1(F)CC2(C[NH+](CCc3cccc(Cl)c3Cl)C2)C1 ZINC000683996366 1037213792 /nfs/dbraw/zinc/21/37/92/1037213792.db2.gz QGFDXKJQJCTSNL-UHFFFAOYSA-N 1 2 306.183 4.267 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@@H+]2Cc2cc(C(C)=O)no2)o1 ZINC000580615110 1037224149 /nfs/dbraw/zinc/22/41/49/1037224149.db2.gz CPUDYPNHIGVFOF-QGZVFWFLSA-N 1 2 316.401 4.150 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@H+]2Cc2cc(C(C)=O)no2)o1 ZINC000580615110 1037224165 /nfs/dbraw/zinc/22/41/65/1037224165.db2.gz CPUDYPNHIGVFOF-QGZVFWFLSA-N 1 2 316.401 4.150 20 0 DIADLO Cc1cc([C@H]2C[N@H+](Cc3cc4ccccc4[nH]3)CCO2)ccc1F ZINC000684021705 1037248741 /nfs/dbraw/zinc/24/87/41/1037248741.db2.gz SIJGHAQOBZCBLF-HXUWFJFHSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1cc([C@H]2C[N@@H+](Cc3cc4ccccc4[nH]3)CCO2)ccc1F ZINC000684021705 1037248752 /nfs/dbraw/zinc/24/87/52/1037248752.db2.gz SIJGHAQOBZCBLF-HXUWFJFHSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2F)nn1 ZINC000692301300 1037285280 /nfs/dbraw/zinc/28/52/80/1037285280.db2.gz RGIKMITYLFKCAN-VIFPVBQESA-N 1 2 314.191 4.082 20 0 DIADLO Cc1nocc1C[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F ZINC000692301922 1037285665 /nfs/dbraw/zinc/28/56/65/1037285665.db2.gz GWABBOJBEWBQPJ-QMMMGPOBSA-N 1 2 303.164 4.280 20 0 DIADLO Cc1noc(C)c1C[N@@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000048055538 1037310300 /nfs/dbraw/zinc/31/03/00/1037310300.db2.gz UNNMFCULZQYOLG-ZBEGNZNMSA-N 1 2 300.402 4.172 20 0 DIADLO Cc1noc(C)c1C[N@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000048055538 1037310315 /nfs/dbraw/zinc/31/03/15/1037310315.db2.gz UNNMFCULZQYOLG-ZBEGNZNMSA-N 1 2 300.402 4.172 20 0 DIADLO COc1ccc2[nH+]c(NCc3cc(C(C)C)no3)c(C)cc2c1 ZINC000091619919 1037316777 /nfs/dbraw/zinc/31/67/77/1037316777.db2.gz WVEWXXTUPBCVKD-UHFFFAOYSA-N 1 2 311.385 4.275 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)no1 ZINC000580861640 1037335128 /nfs/dbraw/zinc/33/51/28/1037335128.db2.gz LAFPRRJTODNNGX-GFCCVEGCSA-N 1 2 318.383 4.383 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)no1 ZINC000580861640 1037335143 /nfs/dbraw/zinc/33/51/43/1037335143.db2.gz LAFPRRJTODNNGX-GFCCVEGCSA-N 1 2 318.383 4.383 20 0 DIADLO Cc1c[nH+]cc(Nc2cnc(Br)c(Cl)c2)c1C ZINC001213524933 1037380301 /nfs/dbraw/zinc/38/03/01/1037380301.db2.gz JUMCYQKZXUSIBT-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO COC[C@H]([NH2+]Cc1csc(C(C)C)n1)c1cccc(Cl)c1 ZINC000580975228 1037395671 /nfs/dbraw/zinc/39/56/71/1037395671.db2.gz WWEWRUHUDHKCOZ-HNNXBMFYSA-N 1 2 324.877 4.397 20 0 DIADLO CC(C)CN(C(=O)C[C@@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC000581134222 1037448052 /nfs/dbraw/zinc/44/80/52/1037448052.db2.gz NWAUNTALECQFFR-CQSZACIVSA-N 1 2 319.836 4.177 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2ncccn2)C2CC2)cc1Cl ZINC000581202950 1037468079 /nfs/dbraw/zinc/46/80/79/1037468079.db2.gz ZVSGAOISUDGPDB-OAHLLOKOSA-N 1 2 308.212 4.024 20 0 DIADLO Brc1ccc(C[NH+]2CCC(c3ccco3)CC2)o1 ZINC000668462224 1037573124 /nfs/dbraw/zinc/57/31/24/1037573124.db2.gz DILQPTBZRSPCRE-UHFFFAOYSA-N 1 2 310.191 4.015 20 0 DIADLO F[C@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccc(Br)cc1Cl ZINC001137565388 1037571454 /nfs/dbraw/zinc/57/14/54/1037571454.db2.gz IETXBDZAJQLVER-GAFUQQFSSA-N 1 2 318.617 4.035 20 0 DIADLO F[C@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccc(Br)cc1Cl ZINC001137565388 1037571464 /nfs/dbraw/zinc/57/14/64/1037571464.db2.gz IETXBDZAJQLVER-GAFUQQFSSA-N 1 2 318.617 4.035 20 0 DIADLO Cc1cc2c(s1)N(c1ccccn1)c1ccccc1NC2=[NH2+] ZINC001167457163 1037574362 /nfs/dbraw/zinc/57/43/62/1037574362.db2.gz TYVOTKVIMAXJJV-UHFFFAOYSA-N 1 2 306.394 4.272 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(F)cnc1Cl)c1ccc(F)cc1F ZINC000834839634 1037598407 /nfs/dbraw/zinc/59/84/07/1037598407.db2.gz BZUWFGCHZJUMEI-CQSZACIVSA-N 1 2 314.738 4.393 20 0 DIADLO Cc1n[nH]cc1CNc1[nH+]c2ccccc2n1C1CCCCC1 ZINC000124024706 1037616899 /nfs/dbraw/zinc/61/68/99/1037616899.db2.gz ZDVKAXMLYCQONP-UHFFFAOYSA-N 1 2 309.417 4.185 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001143392602 1037624711 /nfs/dbraw/zinc/62/47/11/1037624711.db2.gz BXPZSFFDTASJAG-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001143392602 1037624718 /nfs/dbraw/zinc/62/47/18/1037624718.db2.gz BXPZSFFDTASJAG-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cc(C[N@@H+]2CCc3c(Cl)cccc3C2)ccc1F ZINC001204559175 1037625230 /nfs/dbraw/zinc/62/52/30/1037625230.db2.gz QQCOBDAWCCYNKB-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(C[N@H+]2CCc3c(Cl)cccc3C2)ccc1F ZINC001204559175 1037625238 /nfs/dbraw/zinc/62/52/38/1037625238.db2.gz QQCOBDAWCCYNKB-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Cc1cc2c(s1)N(c1cccnc1)c1ccccc1NC2=[NH2+] ZINC001167463660 1037642391 /nfs/dbraw/zinc/64/23/91/1037642391.db2.gz XIYSEFBEYIXJCG-UHFFFAOYSA-N 1 2 306.394 4.272 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1cccc(OC(F)F)c1 ZINC000341138705 1037683961 /nfs/dbraw/zinc/68/39/61/1037683961.db2.gz ACNWBLAKWSUDSS-JTQLQIEISA-N 1 2 308.328 4.004 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2csc(Cl)c2)cs1 ZINC000276306172 1037689485 /nfs/dbraw/zinc/68/94/85/1037689485.db2.gz DKMZSZIWQUMVST-RKDXNWHRSA-N 1 2 316.879 4.416 20 0 DIADLO CCO[C@H](C)c1nc(C[NH2+][C@H](C)c2cccc(OC)c2)cs1 ZINC000341218228 1037756390 /nfs/dbraw/zinc/75/63/90/1037756390.db2.gz KYKPQKODBZTXOE-CHWSQXEVSA-N 1 2 320.458 4.100 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1cccc(F)c1 ZINC000090229051 1037759889 /nfs/dbraw/zinc/75/98/89/1037759889.db2.gz WEANAHIWMXLBCI-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO CCOc1c(Cl)cccc1C[NH+]1CC(CC(F)(F)F)C1 ZINC000656688101 1037797437 /nfs/dbraw/zinc/79/74/37/1037797437.db2.gz GGBIOKAZQCGBSV-UHFFFAOYSA-N 1 2 307.743 4.123 20 0 DIADLO C[C@@H]1C[NH+](Cc2csc(C(C)(C)C)n2)C[C@@H](C)C1(F)F ZINC000625644242 1037822633 /nfs/dbraw/zinc/82/26/33/1037822633.db2.gz ADNWJXAGGFGYOV-GHMZBOCLSA-N 1 2 302.434 4.164 20 0 DIADLO COCc1csc(CNc2[nH+]c3cccc(Cl)c3n2C)c1 ZINC000656771978 1037858759 /nfs/dbraw/zinc/85/87/59/1037858759.db2.gz JRXMCJSQCFTMCR-UHFFFAOYSA-N 1 2 321.833 4.047 20 0 DIADLO C[C@]1([NH2+]Cc2cc(-c3ccccc3)on2)CCOc2ccccc21 ZINC000933367709 1037896212 /nfs/dbraw/zinc/89/62/12/1037896212.db2.gz XHGDHMGYRBCMBI-FQEVSTJZSA-N 1 2 320.392 4.129 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ccc(Cl)cn3)CCCC2)n1 ZINC000155200962 1037951459 /nfs/dbraw/zinc/95/14/59/1037951459.db2.gz DIPGARCKXXYVSP-UHFFFAOYSA-N 1 2 307.850 4.059 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1cccc(=O)[nH]1 ZINC000933396619 1037954185 /nfs/dbraw/zinc/95/41/85/1037954185.db2.gz XNNMXADGXYLEHQ-SNVBAGLBSA-N 1 2 311.212 4.287 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1cccc(=O)[nH]1 ZINC000933396619 1037954204 /nfs/dbraw/zinc/95/42/04/1037954204.db2.gz XNNMXADGXYLEHQ-SNVBAGLBSA-N 1 2 311.212 4.287 20 0 DIADLO CC(C)(C)C[C@@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(F)cc1 ZINC000341458856 1038037881 /nfs/dbraw/zinc/03/78/81/1038037881.db2.gz QPBMXHYKORKMAH-OAHLLOKOSA-N 1 2 317.408 4.353 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000602572500 1038039904 /nfs/dbraw/zinc/03/99/04/1038039904.db2.gz MEMCMCXGBHRUST-CMPLNLGQSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000602572500 1038039921 /nfs/dbraw/zinc/03/99/21/1038039921.db2.gz MEMCMCXGBHRUST-CMPLNLGQSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000602572528 1038042011 /nfs/dbraw/zinc/04/20/11/1038042011.db2.gz ORJBNMSTRYMSGF-WDEREUQCSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000602572528 1038042031 /nfs/dbraw/zinc/04/20/31/1038042031.db2.gz ORJBNMSTRYMSGF-WDEREUQCSA-N 1 2 323.305 4.069 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)Cc1ccsc1 ZINC000124263241 1038055204 /nfs/dbraw/zinc/05/52/04/1038055204.db2.gz LONQLMRZXPVWQZ-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)Cc1ccsc1 ZINC000124263241 1038055210 /nfs/dbraw/zinc/05/52/10/1038055210.db2.gz LONQLMRZXPVWQZ-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1ccc(F)c(NC(=O)C[C@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000341507715 1038060414 /nfs/dbraw/zinc/06/04/14/1038060414.db2.gz PPGMQUWCZYMOPH-HNNXBMFYSA-N 1 2 323.371 4.018 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1cnn(C2CCC2)c1 ZINC000891605657 1038072739 /nfs/dbraw/zinc/07/27/39/1038072739.db2.gz AJUUFBXXTOHJFS-LBPRGKRZSA-N 1 2 305.372 4.079 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cnn(C2CCC2)c1 ZINC000891605657 1038072761 /nfs/dbraw/zinc/07/27/61/1038072761.db2.gz AJUUFBXXTOHJFS-LBPRGKRZSA-N 1 2 305.372 4.079 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+]1CCSc2ccccc2C1 ZINC001143402758 1038107828 /nfs/dbraw/zinc/10/78/28/1038107828.db2.gz ODGZCVGNCCXTIC-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+]1CCSc2ccccc2C1 ZINC001143402758 1038107844 /nfs/dbraw/zinc/10/78/44/1038107844.db2.gz ODGZCVGNCCXTIC-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO Cc1cc([C@H]2CCCN2c2[nH+]ccc3c4c([nH]c32)CCCC4)no1 ZINC000891702129 1038150655 /nfs/dbraw/zinc/15/06/55/1038150655.db2.gz GUARMHVUIDIPIL-QGZVFWFLSA-N 1 2 322.412 4.080 20 0 DIADLO CSCCC[NH2+][C@@H](c1ccc(Br)cc1)C(F)F ZINC000598677784 1038151488 /nfs/dbraw/zinc/15/14/88/1038151488.db2.gz JKXIWQKRNTYMLQ-NSHDSACASA-N 1 2 324.234 4.098 20 0 DIADLO c1ccc([C@H]2[N@H+](Cc3nnc(C4CC4)o3)CC23CCCCC3)cc1 ZINC000581929603 1038156020 /nfs/dbraw/zinc/15/60/20/1038156020.db2.gz ZMFYRIILFKLBMI-GOSISDBHSA-N 1 2 323.440 4.454 20 0 DIADLO c1ccc([C@H]2[N@@H+](Cc3nnc(C4CC4)o3)CC23CCCCC3)cc1 ZINC000581929603 1038156029 /nfs/dbraw/zinc/15/60/29/1038156029.db2.gz ZMFYRIILFKLBMI-GOSISDBHSA-N 1 2 323.440 4.454 20 0 DIADLO c1ccc([C@@H]2[N@H+](Cc3nnc(C4CC4)o3)CC23CCCCC3)cc1 ZINC000581929604 1038156853 /nfs/dbraw/zinc/15/68/53/1038156853.db2.gz ZMFYRIILFKLBMI-SFHVURJKSA-N 1 2 323.440 4.454 20 0 DIADLO c1ccc([C@@H]2[N@@H+](Cc3nnc(C4CC4)o3)CC23CCCCC3)cc1 ZINC000581929604 1038156860 /nfs/dbraw/zinc/15/68/60/1038156860.db2.gz ZMFYRIILFKLBMI-SFHVURJKSA-N 1 2 323.440 4.454 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc2cccnc2s1 ZINC000341592717 1038158747 /nfs/dbraw/zinc/15/87/47/1038158747.db2.gz YJVPYLBQFLZQHG-JTQLQIEISA-N 1 2 319.380 4.163 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc2cccnc2s1 ZINC000341592717 1038158751 /nfs/dbraw/zinc/15/87/51/1038158751.db2.gz YJVPYLBQFLZQHG-JTQLQIEISA-N 1 2 319.380 4.163 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1nc2cccnc2s1 ZINC000341614565 1038179292 /nfs/dbraw/zinc/17/92/92/1038179292.db2.gz KHXOYQNJFOJQSN-CYBMUJFWSA-N 1 2 315.467 4.262 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1nc2cccnc2s1 ZINC000341614565 1038179296 /nfs/dbraw/zinc/17/92/96/1038179296.db2.gz KHXOYQNJFOJQSN-CYBMUJFWSA-N 1 2 315.467 4.262 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@H]3C[C@H]3c3ccccc3)cc2[nH+]1 ZINC000341641584 1038198851 /nfs/dbraw/zinc/19/88/51/1038198851.db2.gz UXWVADVXGJWACZ-ZBFHGGJFSA-N 1 2 305.381 4.004 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1ncc(C)o1)c1ccccc1OC(F)F ZINC000341659279 1038211736 /nfs/dbraw/zinc/21/17/36/1038211736.db2.gz NHXVXQSFFWCOMM-WCQYABFASA-N 1 2 310.344 4.386 20 0 DIADLO CC[C@@]1(C)CCC[N@@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001167493549 1038233295 /nfs/dbraw/zinc/23/32/95/1038233295.db2.gz ZODYZKXDIVEPKD-RDJZCZTQSA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@@]1(C)CCC[N@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001167493549 1038233312 /nfs/dbraw/zinc/23/33/12/1038233312.db2.gz ZODYZKXDIVEPKD-RDJZCZTQSA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@@]1(C)CCC[N@@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001167493551 1038234630 /nfs/dbraw/zinc/23/46/30/1038234630.db2.gz ZODYZKXDIVEPKD-WBVHZDCISA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@@]1(C)CCC[N@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001167493551 1038234637 /nfs/dbraw/zinc/23/46/37/1038234637.db2.gz ZODYZKXDIVEPKD-WBVHZDCISA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](CC)c2ccc(F)cc2F)[nH]1 ZINC000276845904 1038252968 /nfs/dbraw/zinc/25/29/68/1038252968.db2.gz CNHNERQOUVPXQB-RWSFTLGLSA-N 1 2 322.403 4.398 20 0 DIADLO CC[N@H+](Cc1ccc(OC)cc1)Cc1c(F)c(F)ccc1OC ZINC001143413585 1038269709 /nfs/dbraw/zinc/26/97/09/1038269709.db2.gz SSMLLAMYZFNTMJ-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)cc1)Cc1c(F)c(F)ccc1OC ZINC001143413585 1038269714 /nfs/dbraw/zinc/26/97/14/1038269714.db2.gz SSMLLAMYZFNTMJ-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[C@@H](C)[C@@H](C(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000603785520 1038280187 /nfs/dbraw/zinc/28/01/87/1038280187.db2.gz SQDBPXKBEAIDMU-RDTXWAMCSA-N 1 2 307.397 4.103 20 0 DIADLO CC(C)Sc1ccccc1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000603808605 1038284949 /nfs/dbraw/zinc/28/49/49/1038284949.db2.gz DZWVKRISGXEXGA-UHFFFAOYSA-N 1 2 311.410 4.087 20 0 DIADLO Cc1cccc(C2(C(=O)Nc3ccc4[nH+]ccn4c3)CCCC2)c1 ZINC000603819515 1038286828 /nfs/dbraw/zinc/28/68/28/1038286828.db2.gz OKXUHJMBYICLBQ-UHFFFAOYSA-N 1 2 319.408 4.093 20 0 DIADLO c1cn(-c2ccccc2)c(CNc2ccc([NH+]3CCCC3)cc2)n1 ZINC000276950026 1038295245 /nfs/dbraw/zinc/29/52/45/1038295245.db2.gz JFCVAKHEBWZNHK-UHFFFAOYSA-N 1 2 318.424 4.085 20 0 DIADLO c1ccc2cc(CNc3cc(N4CCCCC4)nc[nH+]3)ccc2c1 ZINC000599571128 1038310599 /nfs/dbraw/zinc/31/05/99/1038310599.db2.gz XWQXNTRSLPYSBA-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO c1ccc2cc(CNc3cc(N4CCCCC4)[nH+]cn3)ccc2c1 ZINC000599571128 1038310615 /nfs/dbraw/zinc/31/06/15/1038310615.db2.gz XWQXNTRSLPYSBA-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO COc1c(C)cnc(C[N@H+](C)Cc2ccc(Cl)c(F)c2)c1C ZINC000535680338 1038312993 /nfs/dbraw/zinc/31/29/93/1038312993.db2.gz LYDJCMHPLYLWDS-UHFFFAOYSA-N 1 2 322.811 4.132 20 0 DIADLO COc1c(C)cnc(C[N@@H+](C)Cc2ccc(Cl)c(F)c2)c1C ZINC000535680338 1038313003 /nfs/dbraw/zinc/31/30/03/1038313003.db2.gz LYDJCMHPLYLWDS-UHFFFAOYSA-N 1 2 322.811 4.132 20 0 DIADLO CC(C)c1cc(C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)on1 ZINC000603949994 1038327820 /nfs/dbraw/zinc/32/78/20/1038327820.db2.gz MGTPTJBUGGLYGC-UHFFFAOYSA-N 1 2 314.360 4.487 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2csc(C(C)(C)C)n2)cc1 ZINC000535775945 1038334652 /nfs/dbraw/zinc/33/46/52/1038334652.db2.gz DOCHHCJDWUUWNE-UHFFFAOYSA-N 1 2 318.486 4.471 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2csc(C(C)(C)C)n2)cc1 ZINC000535775945 1038334639 /nfs/dbraw/zinc/33/46/39/1038334639.db2.gz DOCHHCJDWUUWNE-UHFFFAOYSA-N 1 2 318.486 4.471 20 0 DIADLO Fc1cccc(Cl)c1C[C@@H]1CCC[N@@H+]1Cc1cscn1 ZINC000535796040 1038341242 /nfs/dbraw/zinc/34/12/42/1038341242.db2.gz QSKXQWLPKMRLSE-LBPRGKRZSA-N 1 2 310.825 4.143 20 0 DIADLO Fc1cccc(Cl)c1C[C@@H]1CCC[N@H+]1Cc1cscn1 ZINC000535796040 1038341256 /nfs/dbraw/zinc/34/12/56/1038341256.db2.gz QSKXQWLPKMRLSE-LBPRGKRZSA-N 1 2 310.825 4.143 20 0 DIADLO CC(C)c1ccc(OC2CC[NH+](Cc3cscn3)CC2)cc1 ZINC000535798122 1038342582 /nfs/dbraw/zinc/34/25/82/1038342582.db2.gz MWDKQZWZKGBPLS-UHFFFAOYSA-N 1 2 316.470 4.310 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)cn1 ZINC000535804908 1038343780 /nfs/dbraw/zinc/34/37/80/1038343780.db2.gz BQNWIQITZOCOQW-GOSISDBHSA-N 1 2 319.399 4.469 20 0 DIADLO CC(C)n1cc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)cn1 ZINC000535804908 1038343796 /nfs/dbraw/zinc/34/37/96/1038343796.db2.gz BQNWIQITZOCOQW-GOSISDBHSA-N 1 2 319.399 4.469 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)c(C)s1 ZINC000341937024 1038354501 /nfs/dbraw/zinc/35/45/01/1038354501.db2.gz AUFQTLMULDYHKO-UHFFFAOYSA-N 1 2 308.397 4.207 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2cc(C)ccc2OC)[nH]1 ZINC000277075746 1038364450 /nfs/dbraw/zinc/36/44/50/1038364450.db2.gz FIMDODTXRUGDOY-MJBXVCDLSA-N 1 2 316.449 4.047 20 0 DIADLO CC(C)C[N@H+](Cc1ncccn1)[C@@H](C)c1ccccc1Cl ZINC000342045556 1038370684 /nfs/dbraw/zinc/37/06/84/1038370684.db2.gz JCCKZVMNZXHNRJ-AWEZNQCLSA-N 1 2 303.837 4.349 20 0 DIADLO CC(C)C[N@@H+](Cc1ncccn1)[C@@H](C)c1ccccc1Cl ZINC000342045556 1038370696 /nfs/dbraw/zinc/37/06/96/1038370696.db2.gz JCCKZVMNZXHNRJ-AWEZNQCLSA-N 1 2 303.837 4.349 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC000342048886 1038381556 /nfs/dbraw/zinc/38/15/56/1038381556.db2.gz NKHHEHMOJLPXMM-KGLIPLIRSA-N 1 2 322.412 4.106 20 0 DIADLO CCc1nnc(C[NH+]2CCC(c3cccc(Cl)c3)CC2)s1 ZINC000684624819 1038406118 /nfs/dbraw/zinc/40/61/18/1038406118.db2.gz XOPLSEUJTVVQFE-UHFFFAOYSA-N 1 2 321.877 4.134 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2nc(Cl)ccc2Cl)cc1 ZINC000061630536 1038418785 /nfs/dbraw/zinc/41/87/85/1038418785.db2.gz VUPDZXUHUMLNSE-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2nc(Cl)ccc2Cl)cc1 ZINC000061630536 1038418792 /nfs/dbraw/zinc/41/87/92/1038418792.db2.gz VUPDZXUHUMLNSE-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1ccc([C@@H](C)NC[C@H](c2cccs2)[NH+]2CCCC2)o1 ZINC000150908608 1038424598 /nfs/dbraw/zinc/42/45/98/1038424598.db2.gz NNJOVTGGXFOOQK-HUUCEWRRSA-N 1 2 304.459 4.137 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CC(C)(C)OCC3(C)C)co2)cc1 ZINC000604608104 1038429443 /nfs/dbraw/zinc/42/94/43/1038429443.db2.gz RBMWHNVHXIUVRK-UHFFFAOYSA-N 1 2 314.429 4.039 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CC(C)(C)OCC3(C)C)co2)cc1 ZINC000604608104 1038429449 /nfs/dbraw/zinc/42/94/49/1038429449.db2.gz RBMWHNVHXIUVRK-UHFFFAOYSA-N 1 2 314.429 4.039 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1ccc(F)cc1)c1ccco1 ZINC000151135036 1038432457 /nfs/dbraw/zinc/43/24/57/1038432457.db2.gz FGFDYUOKKKNHOV-IBGZPJMESA-N 1 2 311.356 4.307 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1ccco1 ZINC000236630577 1038432561 /nfs/dbraw/zinc/43/25/61/1038432561.db2.gz KMZBVUXFOMSWPU-XIRDDKMYSA-N 1 2 317.429 4.500 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1cccc(F)c1)c1ccco1 ZINC000151135571 1038433125 /nfs/dbraw/zinc/43/31/25/1038433125.db2.gz UNXPLRKQTJCEGA-IBGZPJMESA-N 1 2 311.356 4.307 20 0 DIADLO CCc1noc(C[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)n1 ZINC000657203809 1038436776 /nfs/dbraw/zinc/43/67/76/1038436776.db2.gz OMZLCOQLDFBHBJ-SFHVURJKSA-N 1 2 311.429 4.139 20 0 DIADLO CCc1noc(C[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)n1 ZINC000657203809 1038436783 /nfs/dbraw/zinc/43/67/83/1038436783.db2.gz OMZLCOQLDFBHBJ-SFHVURJKSA-N 1 2 311.429 4.139 20 0 DIADLO CCCCn1c(SCC2CC=CC2)nnc1[C@@H](CC)[NH+](C)C ZINC000657225518 1038442510 /nfs/dbraw/zinc/44/25/10/1038442510.db2.gz JZEPVALYQRQPSH-OAHLLOKOSA-N 1 2 322.522 4.149 20 0 DIADLO Cc1cc(N2CCC(=Cc3cccc(F)c3)CC2)nc(C2CC2)[nH+]1 ZINC000604757203 1038448469 /nfs/dbraw/zinc/44/84/69/1038448469.db2.gz ZQONZNVNMVLXMP-UHFFFAOYSA-N 1 2 323.415 4.485 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)c(F)c2)[nH]1 ZINC000277207868 1038451535 /nfs/dbraw/zinc/45/15/35/1038451535.db2.gz KAXGSDSDYFSBNF-GARJFASQSA-N 1 2 308.376 4.008 20 0 DIADLO O=C(Nc1ccc(F)c(C2CC2)c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000342136506 1038452482 /nfs/dbraw/zinc/45/24/82/1038452482.db2.gz RZHOREWJWDJGMV-UHFFFAOYSA-N 1 2 321.355 4.141 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2cc(C)cnc2Cl)s1 ZINC000891992994 1038456261 /nfs/dbraw/zinc/45/62/61/1038456261.db2.gz QDLOWJMJXUGMTB-LLVKDONJSA-N 1 2 309.866 4.310 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cc(C)cnc2Cl)s1 ZINC000891992994 1038456265 /nfs/dbraw/zinc/45/62/65/1038456265.db2.gz QDLOWJMJXUGMTB-LLVKDONJSA-N 1 2 309.866 4.310 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)n1 ZINC000604884305 1038461128 /nfs/dbraw/zinc/46/11/28/1038461128.db2.gz CAWLFCXHGKBJTA-KRWDZBQOSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)n1 ZINC000604884305 1038461135 /nfs/dbraw/zinc/46/11/35/1038461135.db2.gz CAWLFCXHGKBJTA-KRWDZBQOSA-N 1 2 303.837 4.455 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1cc2ccccc2o1 ZINC000342173889 1038464502 /nfs/dbraw/zinc/46/45/02/1038464502.db2.gz SVLAMKPSRGRHAZ-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](C)[C@H](C)c1ccc(Cl)cc1 ZINC000061858342 1038467734 /nfs/dbraw/zinc/46/77/34/1038467734.db2.gz FLWQEIIYQFOIAZ-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](C)[C@H](C)c1ccc(Cl)cc1 ZINC000061858342 1038467743 /nfs/dbraw/zinc/46/77/43/1038467743.db2.gz FLWQEIIYQFOIAZ-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1cccc2ccsc21 ZINC000342189062 1038472621 /nfs/dbraw/zinc/47/26/21/1038472621.db2.gz NVSZUITYLNYLGF-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO CCc1nc(C)c([C@H](C)[NH2+][C@H](C)c2nnc([C@H](C)CC)[nH]2)s1 ZINC000277266028 1038474050 /nfs/dbraw/zinc/47/40/50/1038474050.db2.gz PHGZDONTPHHCQP-JFGNBEQYSA-N 1 2 321.494 4.057 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)o1 ZINC000605155203 1038493359 /nfs/dbraw/zinc/49/33/59/1038493359.db2.gz KYPYJCFXSWDACN-OAHLLOKOSA-N 1 2 316.470 4.262 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)o1 ZINC000605155203 1038493363 /nfs/dbraw/zinc/49/33/63/1038493363.db2.gz KYPYJCFXSWDACN-OAHLLOKOSA-N 1 2 316.470 4.262 20 0 DIADLO CCCCC[N@@H+]1CCO[C@@H](c2cccc(Br)c2)C1 ZINC000605150218 1038493901 /nfs/dbraw/zinc/49/39/01/1038493901.db2.gz LZWITKWWVXHMDI-OAHLLOKOSA-N 1 2 312.251 4.013 20 0 DIADLO CCCCC[N@H+]1CCO[C@@H](c2cccc(Br)c2)C1 ZINC000605150218 1038493904 /nfs/dbraw/zinc/49/39/04/1038493904.db2.gz LZWITKWWVXHMDI-OAHLLOKOSA-N 1 2 312.251 4.013 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2cc(F)cc(F)c2)[nH]1 ZINC000277311763 1038500451 /nfs/dbraw/zinc/50/04/51/1038500451.db2.gz SOSQEOLEBOGIKC-GARJFASQSA-N 1 2 308.376 4.008 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CCCCC2)cs1)c1cncs1 ZINC000934194530 1038507063 /nfs/dbraw/zinc/50/70/63/1038507063.db2.gz XYKKBTMCTMQCAX-LLVKDONJSA-N 1 2 307.488 4.498 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccnn2C2CCC2)s1 ZINC000892104049 1038516191 /nfs/dbraw/zinc/51/61/91/1038516191.db2.gz QAAAPPJRFWYYDZ-CYBMUJFWSA-N 1 2 318.490 4.128 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccnn2C2CCC2)s1 ZINC000892104049 1038516194 /nfs/dbraw/zinc/51/61/94/1038516194.db2.gz QAAAPPJRFWYYDZ-CYBMUJFWSA-N 1 2 318.490 4.128 20 0 DIADLO Cc1ccccc1OCCCOc1ccccc1-n1cc[nH+]c1 ZINC000605434290 1038516360 /nfs/dbraw/zinc/51/63/60/1038516360.db2.gz XZOYTGYPBYZHLI-UHFFFAOYSA-N 1 2 308.381 4.029 20 0 DIADLO CC[C@H]1CCCCN1C(=O)C[N@H+](C)[C@@H](C)c1ccccc1Cl ZINC000071954388 1038539384 /nfs/dbraw/zinc/53/93/84/1038539384.db2.gz GKYLIDMSPUNUGW-GJZGRUSLSA-N 1 2 322.880 4.124 20 0 DIADLO CC[C@H]1CCCCN1C(=O)C[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC000071954388 1038539394 /nfs/dbraw/zinc/53/93/94/1038539394.db2.gz GKYLIDMSPUNUGW-GJZGRUSLSA-N 1 2 322.880 4.124 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2cccc(Br)c2)n1 ZINC000724373221 1038539896 /nfs/dbraw/zinc/53/98/96/1038539896.db2.gz QBJVLQMSUFDWFX-UHFFFAOYSA-N 1 2 323.234 4.024 20 0 DIADLO CC[C@@H]1CCCCN1C(=O)C[N@H+](C)[C@@H](C)c1ccccc1Cl ZINC000071954387 1038539920 /nfs/dbraw/zinc/53/99/20/1038539920.db2.gz GKYLIDMSPUNUGW-LSDHHAIUSA-N 1 2 322.880 4.124 20 0 DIADLO CC[C@@H]1CCCCN1C(=O)C[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC000071954387 1038539925 /nfs/dbraw/zinc/53/99/25/1038539925.db2.gz GKYLIDMSPUNUGW-LSDHHAIUSA-N 1 2 322.880 4.124 20 0 DIADLO Cc1noc(C)c1C[NH+](Cc1c(C)noc1C)[C@@H]1C=CCCC1 ZINC000605735237 1038548147 /nfs/dbraw/zinc/54/81/47/1038548147.db2.gz JZXUNTBNGTYFMF-MRXNPFEDSA-N 1 2 315.417 4.007 20 0 DIADLO Cc1noc(C)c1C[NH+](Cc1c(C)noc1C)[C@H]1C=CCCC1 ZINC000605735236 1038548518 /nfs/dbraw/zinc/54/85/18/1038548518.db2.gz JZXUNTBNGTYFMF-INIZCTEOSA-N 1 2 315.417 4.007 20 0 DIADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccc(Cl)cc1OC(F)(F)F ZINC001143433621 1038559201 /nfs/dbraw/zinc/55/92/01/1038559201.db2.gz ZXPFYCPFYUXELM-ZMLRMANQSA-N 1 2 323.717 4.171 20 0 DIADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccc(Cl)cc1OC(F)(F)F ZINC001143433621 1038559209 /nfs/dbraw/zinc/55/92/09/1038559209.db2.gz ZXPFYCPFYUXELM-ZMLRMANQSA-N 1 2 323.717 4.171 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3o2)o1 ZINC000892162305 1038562328 /nfs/dbraw/zinc/56/23/28/1038562328.db2.gz XFDPWRKSRXXGQY-OAHLLOKOSA-N 1 2 312.369 4.157 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3o2)o1 ZINC000892162305 1038562334 /nfs/dbraw/zinc/56/23/34/1038562334.db2.gz XFDPWRKSRXXGQY-OAHLLOKOSA-N 1 2 312.369 4.157 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1ncccc1Cl)C(C)(C)C ZINC000934285985 1038581272 /nfs/dbraw/zinc/58/12/72/1038581272.db2.gz CDCQSSHIIHILGW-MRXNPFEDSA-N 1 2 303.837 4.315 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1ncccc1Cl)C(C)(C)C ZINC000934285984 1038581405 /nfs/dbraw/zinc/58/14/05/1038581405.db2.gz CDCQSSHIIHILGW-INIZCTEOSA-N 1 2 303.837 4.315 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000606431422 1038601051 /nfs/dbraw/zinc/60/10/51/1038601051.db2.gz PTBJMOHCILLNMV-RBUKOAKNSA-N 1 2 317.379 4.489 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000606431422 1038601055 /nfs/dbraw/zinc/60/10/55/1038601055.db2.gz PTBJMOHCILLNMV-RBUKOAKNSA-N 1 2 317.379 4.489 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cn(C2CCC2)nn1)c1ccccc1Cl ZINC000657361389 1038603867 /nfs/dbraw/zinc/60/38/67/1038603867.db2.gz CJUNLTSQSQBZFY-KRWDZBQOSA-N 1 2 318.852 4.143 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nc(C(C)(C)C)no2)o1 ZINC000606454228 1038604954 /nfs/dbraw/zinc/60/49/54/1038604954.db2.gz ABEJLXPIGWTJRJ-AWEZNQCLSA-N 1 2 317.433 4.386 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2nc(C(C)(C)C)no2)o1 ZINC000606454228 1038604955 /nfs/dbraw/zinc/60/49/55/1038604955.db2.gz ABEJLXPIGWTJRJ-AWEZNQCLSA-N 1 2 317.433 4.386 20 0 DIADLO CCc1ccc(-c2nc(C[N@@H+]3CCSC[C@H]3C)cs2)cc1 ZINC000606451895 1038605081 /nfs/dbraw/zinc/60/50/81/1038605081.db2.gz OAQSZQJPLZDOEH-CYBMUJFWSA-N 1 2 318.511 4.310 20 0 DIADLO CCc1ccc(-c2nc(C[N@H+]3CCSC[C@H]3C)cs2)cc1 ZINC000606451895 1038605084 /nfs/dbraw/zinc/60/50/84/1038605084.db2.gz OAQSZQJPLZDOEH-CYBMUJFWSA-N 1 2 318.511 4.310 20 0 DIADLO CCCC[C@H]1CCC[C@@H]1NC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000606570053 1038615095 /nfs/dbraw/zinc/61/50/95/1038615095.db2.gz OPBITEQZWFGTTJ-HOCLYGCPSA-N 1 2 314.433 4.123 20 0 DIADLO CC[C@H](c1ccccc1)N(CC)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606583570 1038615658 /nfs/dbraw/zinc/61/56/58/1038615658.db2.gz GVSDNFRXFDADMY-QGZVFWFLSA-N 1 2 322.412 4.339 20 0 DIADLO COc1cncc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)c1 ZINC000582264413 1038621241 /nfs/dbraw/zinc/62/12/41/1038621241.db2.gz JUPDNQOOUOYUQM-CYBMUJFWSA-N 1 2 316.832 4.469 20 0 DIADLO COc1cncc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)c1 ZINC000582264413 1038621246 /nfs/dbraw/zinc/62/12/46/1038621246.db2.gz JUPDNQOOUOYUQM-CYBMUJFWSA-N 1 2 316.832 4.469 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2ccc(F)c(F)c2F)C2CC2)n1 ZINC000657380593 1038622236 /nfs/dbraw/zinc/62/22/36/1038622236.db2.gz KYTADSURDKRCIN-AWEZNQCLSA-N 1 2 312.360 4.110 20 0 DIADLO Cc1c[nH]c(C[NH2+]Cc2ccc(C)cc2OCCCC(C)C)n1 ZINC000657393849 1038635497 /nfs/dbraw/zinc/63/54/97/1038635497.db2.gz CMAFYEULCBUFBP-UHFFFAOYSA-N 1 2 315.461 4.131 20 0 DIADLO C[C@H](c1cccc2ccccc21)[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000606902523 1038638249 /nfs/dbraw/zinc/63/82/49/1038638249.db2.gz ZSOBEONHEHNALK-WBMJQRKESA-N 1 2 309.331 4.164 20 0 DIADLO C[C@H](c1cccc2ccccc21)[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000606902523 1038638252 /nfs/dbraw/zinc/63/82/52/1038638252.db2.gz ZSOBEONHEHNALK-WBMJQRKESA-N 1 2 309.331 4.164 20 0 DIADLO C[C@@H](c1cccc2ccccc21)[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000606902513 1038638883 /nfs/dbraw/zinc/63/88/83/1038638883.db2.gz ZSOBEONHEHNALK-BLLLJJGKSA-N 1 2 309.331 4.164 20 0 DIADLO C[C@@H](c1cccc2ccccc21)[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000606902513 1038638886 /nfs/dbraw/zinc/63/88/86/1038638886.db2.gz ZSOBEONHEHNALK-BLLLJJGKSA-N 1 2 309.331 4.164 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@H](c2cccs2)C2CC2)n1 ZINC000342516757 1038646161 /nfs/dbraw/zinc/64/61/61/1038646161.db2.gz XBIVKVCSCMJOLT-YGRLFVJLSA-N 1 2 323.487 4.186 20 0 DIADLO COCc1csc(CNc2c[nH+]ccc2OC(C)(C)C)c1 ZINC000657415942 1038654616 /nfs/dbraw/zinc/65/46/16/1038654616.db2.gz ICUCOOIACTXBCN-UHFFFAOYSA-N 1 2 306.431 4.079 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H](CC(C)C)c3ccccc3)ccc2[nH+]1 ZINC000607062009 1038654952 /nfs/dbraw/zinc/65/49/52/1038654952.db2.gz MABOUFCMMNXVEM-SFHVURJKSA-N 1 2 321.424 4.411 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)c(C)[nH+]1 ZINC000607454911 1038678349 /nfs/dbraw/zinc/67/83/49/1038678349.db2.gz AAGUMXVDVRPREJ-UONOGXRCSA-N 1 2 316.351 4.027 20 0 DIADLO Cc1ccc(Cl)c(NC(=O)c2cccc(-n3cc[nH+]c3)c2)c1 ZINC000152685091 1038696347 /nfs/dbraw/zinc/69/63/47/1038696347.db2.gz PRRIWTLUBUBCJU-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1ncsc1-c1ccc(C[NH2+][C@@H]2CCCC2(F)F)cc1 ZINC000657467451 1038705709 /nfs/dbraw/zinc/70/57/09/1038705709.db2.gz MMYCFPHTMNTQSH-CQSZACIVSA-N 1 2 308.397 4.396 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2ccc(Cl)cc2)CCO1 ZINC000607745928 1038720734 /nfs/dbraw/zinc/72/07/34/1038720734.db2.gz VYQHNAOKOXXZAV-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2)CCO1 ZINC000607745928 1038720742 /nfs/dbraw/zinc/72/07/42/1038720742.db2.gz VYQHNAOKOXXZAV-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO CN(C)c1cccc(C[NH+](Cc2ccco2)Cc2ccco2)c1 ZINC000607723949 1038726043 /nfs/dbraw/zinc/72/60/43/1038726043.db2.gz SVBBTOFRUMCSIV-UHFFFAOYSA-N 1 2 310.397 4.141 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@H]1CCCc2cccnc21)c1ccco1 ZINC000684955910 1038741178 /nfs/dbraw/zinc/74/11/78/1038741178.db2.gz SASOBLQZTLZIKF-DLBZAZTESA-N 1 2 314.429 4.056 20 0 DIADLO Cc1cccc(Nc2nn(C[N@H+]3CCC[C@H]3C)c(=S)s2)c1 ZINC000173526041 1038754753 /nfs/dbraw/zinc/75/47/53/1038754753.db2.gz KQGSFIVGUHDWCT-GFCCVEGCSA-N 1 2 320.487 4.168 20 0 DIADLO Cc1cccc(Nc2nn(C[N@@H+]3CCC[C@H]3C)c(=S)s2)c1 ZINC000173526041 1038754760 /nfs/dbraw/zinc/75/47/60/1038754760.db2.gz KQGSFIVGUHDWCT-GFCCVEGCSA-N 1 2 320.487 4.168 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1nc(C3CC3)cs1)CCC2 ZINC000342744410 1038755551 /nfs/dbraw/zinc/75/55/51/1038755551.db2.gz YCMUSJIISLRGIA-CQSZACIVSA-N 1 2 319.499 4.295 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1nc(C3CC3)cs1)CCC2 ZINC000342744410 1038755554 /nfs/dbraw/zinc/75/55/54/1038755554.db2.gz YCMUSJIISLRGIA-CQSZACIVSA-N 1 2 319.499 4.295 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cnc(-c3ccccc3)s2)c(C)[nH+]1 ZINC000097366536 1038756145 /nfs/dbraw/zinc/75/61/45/1038756145.db2.gz DECKOMHUTRVIOI-UHFFFAOYSA-N 1 2 323.421 4.383 20 0 DIADLO C[N@H+](Cc1nccn1C(F)F)[C@H]1CCc2ccc(Cl)cc21 ZINC000342764255 1038763742 /nfs/dbraw/zinc/76/37/42/1038763742.db2.gz GVGUZIOSBRSFIC-ZDUSSCGKSA-N 1 2 311.763 4.051 20 0 DIADLO C[N@@H+](Cc1nccn1C(F)F)[C@H]1CCc2ccc(Cl)cc21 ZINC000342764255 1038763749 /nfs/dbraw/zinc/76/37/49/1038763749.db2.gz GVGUZIOSBRSFIC-ZDUSSCGKSA-N 1 2 311.763 4.051 20 0 DIADLO C[C@@H]([NH2+]Cc1csc2ccccc12)c1nc(C(C)(C)C)no1 ZINC000237369741 1038763997 /nfs/dbraw/zinc/76/39/97/1038763997.db2.gz KHLYDBBYQFIRAI-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO Fc1ccc(C[N@H+](Cc2nc(C3CC3)cs2)C2CC2)cc1 ZINC000342766312 1038764288 /nfs/dbraw/zinc/76/42/88/1038764288.db2.gz UJPQXEHUBLDKCK-UHFFFAOYSA-N 1 2 302.418 4.324 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2nc(C3CC3)cs2)C2CC2)cc1 ZINC000342766312 1038764292 /nfs/dbraw/zinc/76/42/92/1038764292.db2.gz UJPQXEHUBLDKCK-UHFFFAOYSA-N 1 2 302.418 4.324 20 0 DIADLO Cc1c[nH+]c(CN(Cc2c(Cl)cccc2Cl)C2CC2)n1C ZINC000342774597 1038768902 /nfs/dbraw/zinc/76/89/02/1038768902.db2.gz DKQNBWWCNPIKHJ-UHFFFAOYSA-N 1 2 324.255 4.200 20 0 DIADLO CC[C@@H](N[C@H](C[NH+](C)C)c1ccc(OC)cc1)c1ccccc1 ZINC000342785733 1038775683 /nfs/dbraw/zinc/77/56/83/1038775683.db2.gz SDMMZMIQBVPYAZ-WOJBJXKFSA-N 1 2 312.457 4.039 20 0 DIADLO CC[C@@H](N[C@@H](C[NH+](C)C)c1ccc(OC)cc1)c1ccccc1 ZINC000342785729 1038776925 /nfs/dbraw/zinc/77/69/25/1038776925.db2.gz SDMMZMIQBVPYAZ-UXHICEINSA-N 1 2 312.457 4.039 20 0 DIADLO Cc1c[nH+]c(CN2Cc3ccccc3C[C@@H]2c2ccccc2)n1C ZINC000342797190 1038794199 /nfs/dbraw/zinc/79/41/99/1038794199.db2.gz FDRJSAHHUNMMDS-HXUWFJFHSA-N 1 2 317.436 4.028 20 0 DIADLO Cc1cnc(C[N@@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)n1C ZINC000342797190 1038794217 /nfs/dbraw/zinc/79/42/17/1038794217.db2.gz FDRJSAHHUNMMDS-HXUWFJFHSA-N 1 2 317.436 4.028 20 0 DIADLO Cc1cnc(C[N@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)n1C ZINC000342797190 1038794229 /nfs/dbraw/zinc/79/42/29/1038794229.db2.gz FDRJSAHHUNMMDS-HXUWFJFHSA-N 1 2 317.436 4.028 20 0 DIADLO Cc1c[nH+]c(CN(Cc2cccs2)Cc2cccs2)n1C ZINC000342795665 1038794274 /nfs/dbraw/zinc/79/42/74/1038794274.db2.gz HDFBSFILOFIDNC-UHFFFAOYSA-N 1 2 317.483 4.054 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000075532029 1038797540 /nfs/dbraw/zinc/79/75/40/1038797540.db2.gz AWVAPYNZPNPTCT-CVEARBPZSA-N 1 2 305.466 4.112 20 0 DIADLO Cc1c[nH+]c(CN(C)[C@H](C)c2ccc(Cl)c(Cl)c2)n1C ZINC000342799453 1038798154 /nfs/dbraw/zinc/79/81/54/1038798154.db2.gz OAHULAHQRRBFSU-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ncc(-c3ccc(C)cc3)o2)cc1 ZINC000075618110 1038806805 /nfs/dbraw/zinc/80/68/05/1038806805.db2.gz ZMIUKNCONDVXFA-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ncc(-c3ccc(C)cc3)o2)cc1 ZINC000075618110 1038806826 /nfs/dbraw/zinc/80/68/26/1038806826.db2.gz ZMIUKNCONDVXFA-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO C[C@@H](c1nc(-c2cccs2)no1)[N@H+](C)Cc1cccs1 ZINC000075608259 1038808427 /nfs/dbraw/zinc/80/84/27/1038808427.db2.gz SVSJBIBUOVSHFT-JTQLQIEISA-N 1 2 305.428 4.053 20 0 DIADLO C[C@@H](c1nc(-c2cccs2)no1)[N@@H+](C)Cc1cccs1 ZINC000075608259 1038808444 /nfs/dbraw/zinc/80/84/44/1038808444.db2.gz SVSJBIBUOVSHFT-JTQLQIEISA-N 1 2 305.428 4.053 20 0 DIADLO CCc1cnc(C[NH2+]C(C)(C)c2cccc(C(F)(F)F)c2)o1 ZINC000075712751 1038813295 /nfs/dbraw/zinc/81/32/95/1038813295.db2.gz ZWPUQPZZZYWYLV-UHFFFAOYSA-N 1 2 312.335 4.281 20 0 DIADLO CC[N@H+](Cc1csc(COC)n1)[C@H](C)c1ccc(F)cc1 ZINC000075645795 1038815760 /nfs/dbraw/zinc/81/57/60/1038815760.db2.gz BGWDJRYUOAYDTR-GFCCVEGCSA-N 1 2 308.422 4.012 20 0 DIADLO CC[N@@H+](Cc1csc(COC)n1)[C@H](C)c1ccc(F)cc1 ZINC000075645795 1038815787 /nfs/dbraw/zinc/81/57/87/1038815787.db2.gz BGWDJRYUOAYDTR-GFCCVEGCSA-N 1 2 308.422 4.012 20 0 DIADLO CCCCc1nc(C[N@H+](C)[C@@H](CCO)c2ccccc2)cs1 ZINC000075897906 1038817343 /nfs/dbraw/zinc/81/73/43/1038817343.db2.gz YVPMGEMCDJXENB-KRWDZBQOSA-N 1 2 318.486 4.041 20 0 DIADLO CCCCc1nc(C[N@@H+](C)[C@@H](CCO)c2ccccc2)cs1 ZINC000075897906 1038817364 /nfs/dbraw/zinc/81/73/64/1038817364.db2.gz YVPMGEMCDJXENB-KRWDZBQOSA-N 1 2 318.486 4.041 20 0 DIADLO CCCCc1nc(C[N@H+](C)[C@H](CCO)c2ccccc2)cs1 ZINC000075897909 1038820166 /nfs/dbraw/zinc/82/01/66/1038820166.db2.gz YVPMGEMCDJXENB-QGZVFWFLSA-N 1 2 318.486 4.041 20 0 DIADLO CCCCc1nc(C[N@@H+](C)[C@H](CCO)c2ccccc2)cs1 ZINC000075897909 1038820185 /nfs/dbraw/zinc/82/01/85/1038820185.db2.gz YVPMGEMCDJXENB-QGZVFWFLSA-N 1 2 318.486 4.041 20 0 DIADLO Cc1ccc(-c2cnc(C[NH+]3CCC(C(F)(F)F)CC3)o2)cc1 ZINC000075969210 1038821864 /nfs/dbraw/zinc/82/18/64/1038821864.db2.gz LOKWEIOYHBSPOA-UHFFFAOYSA-N 1 2 324.346 4.424 20 0 DIADLO Cc1ccc(C)c([C@H]2C[N@H+](CCC(F)(F)F)[C@H](C)CO2)c1 ZINC000075837070 1038826199 /nfs/dbraw/zinc/82/61/99/1038826199.db2.gz XKDGPTXYPCSUBJ-UKRRQHHQSA-N 1 2 301.352 4.018 20 0 DIADLO Cc1ccc(C)c([C@H]2C[N@@H+](CCC(F)(F)F)[C@H](C)CO2)c1 ZINC000075837070 1038826220 /nfs/dbraw/zinc/82/62/20/1038826220.db2.gz XKDGPTXYPCSUBJ-UKRRQHHQSA-N 1 2 301.352 4.018 20 0 DIADLO FC(F)(F)c1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cn1 ZINC001213085384 1038838365 /nfs/dbraw/zinc/83/83/65/1038838365.db2.gz FMPCRILZFUENFZ-UHFFFAOYSA-N 1 2 304.275 4.234 20 0 DIADLO CC(C)=C[C@@H]1[C@@H](C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)C1(C)C ZINC000029912774 1038843785 /nfs/dbraw/zinc/84/37/85/1038843785.db2.gz ZEKFOXKKNMHMIK-SJORKVTESA-N 1 2 309.413 4.049 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+]3CC(C)(C)OCC3(C)C)o2)cc1 ZINC000608497423 1038863782 /nfs/dbraw/zinc/86/37/82/1038863782.db2.gz PXIKQRLSOUZSDQ-UHFFFAOYSA-N 1 2 314.429 4.039 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+]3CC(C)(C)OCC3(C)C)o2)cc1 ZINC000608497423 1038863793 /nfs/dbraw/zinc/86/37/93/1038863793.db2.gz PXIKQRLSOUZSDQ-UHFFFAOYSA-N 1 2 314.429 4.039 20 0 DIADLO CC[N@H+](Cc1ccon1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000077283420 1038864310 /nfs/dbraw/zinc/86/43/10/1038864310.db2.gz HUUMEGTYLVDESK-IBGZPJMESA-N 1 2 310.372 4.425 20 0 DIADLO CC[N@@H+](Cc1ccon1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000077283420 1038864332 /nfs/dbraw/zinc/86/43/32/1038864332.db2.gz HUUMEGTYLVDESK-IBGZPJMESA-N 1 2 310.372 4.425 20 0 DIADLO COc1cccc(F)c1CNc1cc[nH+]c2c(OC)cccc12 ZINC001167608714 1038865344 /nfs/dbraw/zinc/86/53/44/1038865344.db2.gz PEGWQYURTPOLAW-UHFFFAOYSA-N 1 2 312.344 4.003 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)cc1 ZINC000608511016 1038870885 /nfs/dbraw/zinc/87/08/85/1038870885.db2.gz LVUDWJCJRPTZRO-HNAYVOBHSA-N 1 2 313.466 4.371 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)cc1 ZINC000608511016 1038870910 /nfs/dbraw/zinc/87/09/10/1038870910.db2.gz LVUDWJCJRPTZRO-HNAYVOBHSA-N 1 2 313.466 4.371 20 0 DIADLO C[N@H+](Cc1cnc(C2CC2)o1)Cc1cc(Cl)cc(Cl)c1 ZINC000628146549 1038876988 /nfs/dbraw/zinc/87/69/88/1038876988.db2.gz QYNUIOSJSCYIPU-UHFFFAOYSA-N 1 2 311.212 4.491 20 0 DIADLO C[N@@H+](Cc1cnc(C2CC2)o1)Cc1cc(Cl)cc(Cl)c1 ZINC000628146549 1038877012 /nfs/dbraw/zinc/87/70/12/1038877012.db2.gz QYNUIOSJSCYIPU-UHFFFAOYSA-N 1 2 311.212 4.491 20 0 DIADLO c1cn(-c2cccc(Oc3ccnc(-c4ccccc4)n3)c2)c[nH+]1 ZINC000077982017 1038878700 /nfs/dbraw/zinc/87/87/00/1038878700.db2.gz SCIKENMGLAGTDD-UHFFFAOYSA-N 1 2 314.348 4.122 20 0 DIADLO Brc1cccc2c3c([nH]c21)CC[N@@H+](CC1CCC1)C3 ZINC000608561909 1038885386 /nfs/dbraw/zinc/88/53/86/1038885386.db2.gz MZSHWELHDSYRLK-UHFFFAOYSA-N 1 2 319.246 4.089 20 0 DIADLO Brc1cccc2c3c([nH]c21)CC[N@H+](CC1CCC1)C3 ZINC000608561909 1038885415 /nfs/dbraw/zinc/88/54/15/1038885415.db2.gz MZSHWELHDSYRLK-UHFFFAOYSA-N 1 2 319.246 4.089 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2csc(-c3ccccc3)n2)cc1 ZINC000048810492 1038906020 /nfs/dbraw/zinc/90/60/20/1038906020.db2.gz PSLLIUQOFUQOGC-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2csc(-c3ccccc3)n2)cc1 ZINC000048810492 1038906025 /nfs/dbraw/zinc/90/60/25/1038906025.db2.gz PSLLIUQOFUQOGC-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO Cc1c[nH+]c(CN2CCCC[C@H]2c2cccc(Cl)c2)n1C ZINC000342844946 1038909108 /nfs/dbraw/zinc/90/91/08/1038909108.db2.gz HUOCKZZOXRHQEG-INIZCTEOSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1ccc(NCc2cc[nH+]c(N)c2)cc1OCc1ccccc1 ZINC001167618263 1038934879 /nfs/dbraw/zinc/93/48/79/1038934879.db2.gz GPDAAEDUOOHMPW-UHFFFAOYSA-N 1 2 319.408 4.163 20 0 DIADLO CCOC(=O)c1ccsc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213085706 1038956003 /nfs/dbraw/zinc/95/60/03/1038956003.db2.gz SNIQBPBKSIQDLF-UHFFFAOYSA-N 1 2 313.382 4.059 20 0 DIADLO COCc1cnc(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccc(C)o2)s1 ZINC000342924500 1039015704 /nfs/dbraw/zinc/01/57/04/1039015704.db2.gz FGLRSLXKZVCDOB-IUODEOHRSA-N 1 2 320.458 4.164 20 0 DIADLO COCc1cnc(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccc(C)o2)s1 ZINC000342924500 1039015717 /nfs/dbraw/zinc/01/57/17/1039015717.db2.gz FGLRSLXKZVCDOB-IUODEOHRSA-N 1 2 320.458 4.164 20 0 DIADLO COCc1cnc(C[N@@H+]2CC[C@H](C)C[C@H]2c2ccc(C)o2)s1 ZINC000342924502 1039015798 /nfs/dbraw/zinc/01/57/98/1039015798.db2.gz FGLRSLXKZVCDOB-WFASDCNBSA-N 1 2 320.458 4.164 20 0 DIADLO COCc1cnc(C[N@H+]2CC[C@H](C)C[C@H]2c2ccc(C)o2)s1 ZINC000342924502 1039015809 /nfs/dbraw/zinc/01/58/09/1039015809.db2.gz FGLRSLXKZVCDOB-WFASDCNBSA-N 1 2 320.458 4.164 20 0 DIADLO COc1ccc2ncc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2c1 ZINC001213086204 1039026359 /nfs/dbraw/zinc/02/63/59/1039026359.db2.gz JPJJCQVFMLGBAD-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO COCc1cnc(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccc(F)c2)s1 ZINC000342935218 1039029109 /nfs/dbraw/zinc/02/91/09/1039029109.db2.gz RZALUXHAWODDAW-LRDDRELGSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1cnc(C[N@H+]2C[C@@H](C)C[C@H]2c2cccc(F)c2)s1 ZINC000342935218 1039029119 /nfs/dbraw/zinc/02/91/19/1039029119.db2.gz RZALUXHAWODDAW-LRDDRELGSA-N 1 2 320.433 4.012 20 0 DIADLO C[C@@H]1CCN(Cc2ccc(-n3cc[nH+]c3)cc2)c2ccccc21 ZINC001167912812 1039031112 /nfs/dbraw/zinc/03/11/12/1039031112.db2.gz QMIVNWMACPORHN-MRXNPFEDSA-N 1 2 303.409 4.386 20 0 DIADLO CCCn1c(C[N@H+](Cc2ccccn2)C(C)C)nc2ccccc21 ZINC000534347340 1039034293 /nfs/dbraw/zinc/03/42/93/1039034293.db2.gz PTRFMQHNSRTMFA-UHFFFAOYSA-N 1 2 322.456 4.252 20 0 DIADLO CCCn1c(C[N@@H+](Cc2ccccn2)C(C)C)nc2ccccc21 ZINC000534347340 1039034310 /nfs/dbraw/zinc/03/43/10/1039034310.db2.gz PTRFMQHNSRTMFA-UHFFFAOYSA-N 1 2 322.456 4.252 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2ccc3c(c2)CC(C)(C)O3)cs1 ZINC000534349631 1039034419 /nfs/dbraw/zinc/03/44/19/1039034419.db2.gz JOYIDAUOGFYANW-UHFFFAOYSA-N 1 2 316.470 4.051 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2ccc3c(c2)CC(C)(C)O3)cs1 ZINC000534349631 1039034441 /nfs/dbraw/zinc/03/44/41/1039034441.db2.gz JOYIDAUOGFYANW-UHFFFAOYSA-N 1 2 316.470 4.051 20 0 DIADLO COCc1cnc(C[N@@H+]2CC[C@@H](C)[C@H]2c2cccc(F)c2)s1 ZINC000342954939 1039050234 /nfs/dbraw/zinc/05/02/34/1039050234.db2.gz ZOPKUERPPNTUKF-PXAZEXFGSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1cnc(C[N@H+]2CC[C@@H](C)[C@H]2c2cccc(F)c2)s1 ZINC000342954939 1039050250 /nfs/dbraw/zinc/05/02/50/1039050250.db2.gz ZOPKUERPPNTUKF-PXAZEXFGSA-N 1 2 320.433 4.012 20 0 DIADLO C[N@H+](Cc1scnc1C1CC1)Cc1cc(F)c(F)c(F)c1 ZINC000426167154 1039075090 /nfs/dbraw/zinc/07/50/90/1039075090.db2.gz SDZUHRKBEPVYRK-UHFFFAOYSA-N 1 2 312.360 4.070 20 0 DIADLO C[N@@H+](Cc1scnc1C1CC1)Cc1cc(F)c(F)c(F)c1 ZINC000426167154 1039075105 /nfs/dbraw/zinc/07/51/05/1039075105.db2.gz SDZUHRKBEPVYRK-UHFFFAOYSA-N 1 2 312.360 4.070 20 0 DIADLO CC(C)n1ccnc1C[NH2+]C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000342995515 1039089661 /nfs/dbraw/zinc/08/96/61/1039089661.db2.gz TWXXICCNFNENEA-UHFFFAOYSA-N 1 2 323.362 4.262 20 0 DIADLO Cc1noc(C[NH2+][C@@H](CCC(C)C)c2ccc(Cl)cc2)n1 ZINC000122252560 1039092429 /nfs/dbraw/zinc/09/24/29/1039092429.db2.gz RGYSVRIOPWKNRK-HNNXBMFYSA-N 1 2 307.825 4.299 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2Br)cn1 ZINC000153739150 1039107762 /nfs/dbraw/zinc/10/77/62/1039107762.db2.gz VTVQUGURRXAUKP-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2Br)cn1 ZINC000153739150 1039107773 /nfs/dbraw/zinc/10/77/73/1039107773.db2.gz VTVQUGURRXAUKP-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO c1[nH+]c(SCCCOCCc2ccccc2)n2ccccc12 ZINC000611744887 1039124394 /nfs/dbraw/zinc/12/43/94/1039124394.db2.gz TYOXDACPOOPVGH-UHFFFAOYSA-N 1 2 312.438 4.076 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc(OCC(F)(F)F)cc1 ZINC000672621859 1039128004 /nfs/dbraw/zinc/12/80/04/1039128004.db2.gz MCVLSIOZQICEJF-ZWNOBZJWSA-N 1 2 323.305 4.466 20 0 DIADLO CSc1ccc(N(C)C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000583092112 1039129708 /nfs/dbraw/zinc/12/97/08/1039129708.db2.gz GCJRQMHJZLWIQH-UHFFFAOYSA-N 1 2 315.442 4.397 20 0 DIADLO COc1cc(C)[nH+]c(CN2C[C@H](C)C[C@@H]2c2ccccc2F)c1 ZINC000535281323 1039167511 /nfs/dbraw/zinc/16/75/11/1039167511.db2.gz RVQZLRDYLPRRCY-BFUOFWGJSA-N 1 2 314.404 4.121 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccc(F)c(F)c1 ZINC000152715504 1039197288 /nfs/dbraw/zinc/19/72/88/1039197288.db2.gz IDUSQLYCQHHGDE-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)s1 ZINC000343106816 1039202084 /nfs/dbraw/zinc/20/20/84/1039202084.db2.gz ZXWXWLUGKPBEEH-ZDUSSCGKSA-N 1 2 307.850 4.092 20 0 DIADLO CCSc1cccc(C(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)c1 ZINC000343124375 1039218320 /nfs/dbraw/zinc/21/83/20/1039218320.db2.gz ZSEMKPUMPTVFGI-UHFFFAOYSA-N 1 2 311.410 4.236 20 0 DIADLO Cc1ccc(F)cc1C[N@H+](C)Cc1nc2c(s1)CCCC2 ZINC000491251307 1039250018 /nfs/dbraw/zinc/25/00/18/1039250018.db2.gz XEMSKFNUCYBARW-UHFFFAOYSA-N 1 2 304.434 4.101 20 0 DIADLO Cc1ccc(F)cc1C[N@@H+](C)Cc1nc2c(s1)CCCC2 ZINC000491251307 1039250032 /nfs/dbraw/zinc/25/00/32/1039250032.db2.gz XEMSKFNUCYBARW-UHFFFAOYSA-N 1 2 304.434 4.101 20 0 DIADLO CC[N@H+](CC(=O)OC(C)(C)C)Cc1csc2ccccc12 ZINC001140639245 1039261018 /nfs/dbraw/zinc/26/10/18/1039261018.db2.gz PCDXLNGQULYFBT-UHFFFAOYSA-N 1 2 305.443 4.065 20 0 DIADLO CC[N@@H+](CC(=O)OC(C)(C)C)Cc1csc2ccccc12 ZINC001140639245 1039261036 /nfs/dbraw/zinc/26/10/36/1039261036.db2.gz PCDXLNGQULYFBT-UHFFFAOYSA-N 1 2 305.443 4.065 20 0 DIADLO Cc1ccc2ncc(C[NH2+][C@@H](c3ccco3)c3ccccc3)n2c1 ZINC000155701158 1039275748 /nfs/dbraw/zinc/27/57/48/1039275748.db2.gz QQYKTYLGRRRVDI-HXUWFJFHSA-N 1 2 317.392 4.115 20 0 DIADLO CSCc1cnc(C[N@H+](C)Cc2cc(C)cc(C)c2)s1 ZINC000353222031 1039285163 /nfs/dbraw/zinc/28/51/63/1039285163.db2.gz SSHUQOTYJYFSJR-UHFFFAOYSA-N 1 2 306.500 4.255 20 0 DIADLO CSCc1cnc(C[N@@H+](C)Cc2cc(C)cc(C)c2)s1 ZINC000353222031 1039285174 /nfs/dbraw/zinc/28/51/74/1039285174.db2.gz SSHUQOTYJYFSJR-UHFFFAOYSA-N 1 2 306.500 4.255 20 0 DIADLO CCCn1c2ccccc2nc1C[N@H+](CC)CCC(F)(F)F ZINC000092737708 1039296330 /nfs/dbraw/zinc/29/63/30/1039296330.db2.gz KHNLEWGGSDVDLH-UHFFFAOYSA-N 1 2 313.367 4.221 20 0 DIADLO CCCn1c2ccccc2nc1C[N@@H+](CC)CCC(F)(F)F ZINC000092737708 1039296338 /nfs/dbraw/zinc/29/63/38/1039296338.db2.gz KHNLEWGGSDVDLH-UHFFFAOYSA-N 1 2 313.367 4.221 20 0 DIADLO COc1cccc2c1CC[C@@H]2Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000539630863 1039302370 /nfs/dbraw/zinc/30/23/70/1039302370.db2.gz WTLXPEOCGSCFON-SFHVURJKSA-N 1 2 323.440 4.180 20 0 DIADLO COc1cc(C)[nH+]c(CSc2nc3cc(Cl)ccc3[nH]2)c1 ZINC000536011631 1039311266 /nfs/dbraw/zinc/31/12/66/1039311266.db2.gz UCYFLRYUYFUUKT-UHFFFAOYSA-N 1 2 319.817 4.221 20 0 DIADLO Cc1ccc2c(c1)[C@@H](Nc1ccc(N3CCCC3)[nH+]c1)CCCO2 ZINC000539657858 1039312681 /nfs/dbraw/zinc/31/26/81/1039312681.db2.gz BYHHQZCPOKBESE-SFHVURJKSA-N 1 2 323.440 4.316 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+](C)CCC(=O)c1ccccc1 ZINC000539723362 1039325620 /nfs/dbraw/zinc/32/56/20/1039325620.db2.gz BHXTTYZAKNAVMJ-CYBMUJFWSA-N 1 2 303.352 4.231 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)CCC(=O)c1ccccc1 ZINC000539723362 1039325644 /nfs/dbraw/zinc/32/56/44/1039325644.db2.gz BHXTTYZAKNAVMJ-CYBMUJFWSA-N 1 2 303.352 4.231 20 0 DIADLO Cc1ccc2c(c1)[C@H](Nc1ccc(-n3cc[nH+]c3)c(F)c1)CC2 ZINC000539734376 1039330084 /nfs/dbraw/zinc/33/00/84/1039330084.db2.gz FNJVZRFSLGELGG-GOSISDBHSA-N 1 2 307.372 4.419 20 0 DIADLO COc1cc(C)[nH+]c(CN2CCCC[C@@H]2c2ccc(F)cc2)c1 ZINC000536037957 1039336617 /nfs/dbraw/zinc/33/66/17/1039336617.db2.gz CFDMPHRYEGMEDA-LJQANCHMSA-N 1 2 314.404 4.265 20 0 DIADLO FC(F)(F)c1ccccc1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000536040583 1039338810 /nfs/dbraw/zinc/33/88/10/1039338810.db2.gz SSVYQKBWESPWTF-UHFFFAOYSA-N 1 2 309.253 4.400 20 0 DIADLO FC(F)(F)c1ccccc1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000536040583 1039338825 /nfs/dbraw/zinc/33/88/25/1039338825.db2.gz SSVYQKBWESPWTF-UHFFFAOYSA-N 1 2 309.253 4.400 20 0 DIADLO CCN(Cc1cccc(Cl)c1)Cc1cc(OC)cc(C)[nH+]1 ZINC000536043188 1039340575 /nfs/dbraw/zinc/34/05/75/1039340575.db2.gz HAESWAVWGFELEZ-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO c1cnn(-c2cccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)c2)c1 ZINC001213088975 1039362764 /nfs/dbraw/zinc/36/27/64/1039362764.db2.gz NKUAQQLGNKKPGR-UHFFFAOYSA-N 1 2 301.353 4.006 20 0 DIADLO Cc1cc(C[N@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)ccc1F ZINC000539850539 1039369319 /nfs/dbraw/zinc/36/93/19/1039369319.db2.gz TZVHAHJRLOYTFI-CXAGYDPISA-N 1 2 305.418 4.158 20 0 DIADLO Cc1cc(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)ccc1F ZINC000539850539 1039369339 /nfs/dbraw/zinc/36/93/39/1039369339.db2.gz TZVHAHJRLOYTFI-CXAGYDPISA-N 1 2 305.418 4.158 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1c(F)cccc1F)CCC2 ZINC000539851046 1039374542 /nfs/dbraw/zinc/37/45/42/1039374542.db2.gz KDZOHKJDWPUABZ-OAHLLOKOSA-N 1 2 322.424 4.493 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1c(F)cccc1F)CCC2 ZINC000539851046 1039374551 /nfs/dbraw/zinc/37/45/51/1039374551.db2.gz KDZOHKJDWPUABZ-OAHLLOKOSA-N 1 2 322.424 4.493 20 0 DIADLO COc1cc(C)ccc1C[NH2+]Cc1coc(-c2ccc(C)cc2)n1 ZINC000151048137 1039375828 /nfs/dbraw/zinc/37/58/28/1039375828.db2.gz LGXDLHJOQHPKKG-UHFFFAOYSA-N 1 2 322.408 4.257 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2cc(C)ncn2)c2cccc(F)c2)c1 ZINC000669848437 1039378336 /nfs/dbraw/zinc/37/83/36/1039378336.db2.gz UYOFQAGKJSWOJE-FQEVSTJZSA-N 1 2 321.399 4.112 20 0 DIADLO Fc1ccc(OCC[N@H+]2CC=C(C(F)(F)F)CC2)c(Cl)c1 ZINC000539887156 1039379873 /nfs/dbraw/zinc/37/98/73/1039379873.db2.gz YVXDXGBYCQERRH-UHFFFAOYSA-N 1 2 323.717 4.052 20 0 DIADLO Fc1ccc(OCC[N@@H+]2CC=C(C(F)(F)F)CC2)c(Cl)c1 ZINC000539887156 1039379884 /nfs/dbraw/zinc/37/98/84/1039379884.db2.gz YVXDXGBYCQERRH-UHFFFAOYSA-N 1 2 323.717 4.052 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@H+](Cc3cn4ccsc4n3)CC2)c1 ZINC000539886899 1039380705 /nfs/dbraw/zinc/38/07/05/1039380705.db2.gz LCBNIQHGRAXGND-UHFFFAOYSA-N 1 2 323.465 4.302 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@@H+](Cc3cn4ccsc4n3)CC2)c1 ZINC000539886899 1039380722 /nfs/dbraw/zinc/38/07/22/1039380722.db2.gz LCBNIQHGRAXGND-UHFFFAOYSA-N 1 2 323.465 4.302 20 0 DIADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1cc(Cl)ccc1F ZINC000539908146 1039388183 /nfs/dbraw/zinc/38/81/83/1039388183.db2.gz WQJVXVPZWHPKOD-UHFFFAOYSA-N 1 2 301.192 4.103 20 0 DIADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1cc(Cl)ccc1F ZINC000539908146 1039388202 /nfs/dbraw/zinc/38/82/02/1039388202.db2.gz WQJVXVPZWHPKOD-UHFFFAOYSA-N 1 2 301.192 4.103 20 0 DIADLO Cc1nc(N[C@H](C)c2ccc(Oc3ccccc3)cc2)cc[nH+]1 ZINC000462809746 1039396887 /nfs/dbraw/zinc/39/68/87/1039396887.db2.gz YFJKNIHBHPBZKQ-CQSZACIVSA-N 1 2 305.381 4.750 20 0 DIADLO Fc1cccc(Br)c1C[NH+]1CCC(C(F)F)CC1 ZINC000540067844 1039409544 /nfs/dbraw/zinc/40/95/44/1039409544.db2.gz ZHLJHRYAHBKIIL-UHFFFAOYSA-N 1 2 322.168 4.065 20 0 DIADLO CC1(C)C[N@H+](Cc2c[nH]c(Br)c2)Cc2ccccc21 ZINC001233438543 1039421214 /nfs/dbraw/zinc/42/12/14/1039421214.db2.gz VOKDBRSDWPACGV-UHFFFAOYSA-N 1 2 319.246 4.071 20 0 DIADLO CC1(C)C[N@@H+](Cc2c[nH]c(Br)c2)Cc2ccccc21 ZINC001233438543 1039421221 /nfs/dbraw/zinc/42/12/21/1039421221.db2.gz VOKDBRSDWPACGV-UHFFFAOYSA-N 1 2 319.246 4.071 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)cn1)c1nc(C(C)(C)C)cs1 ZINC000583686262 1039421982 /nfs/dbraw/zinc/42/19/82/1039421982.db2.gz WWEUPUDEVMWBCA-JTQLQIEISA-N 1 2 309.866 4.340 20 0 DIADLO CCCc1ccc([C@H](C)[NH2+][C@H](CO)c2c(F)cccc2F)cc1 ZINC000540181187 1039445485 /nfs/dbraw/zinc/44/54/85/1039445485.db2.gz FKBDXSOKGBDJKF-SCLBCKFNSA-N 1 2 319.395 4.302 20 0 DIADLO CCc1ccc([C@H](C)[NH2+]Cc2nnc(-c3ccc(F)cc3)[nH]2)cc1 ZINC000540219703 1039459487 /nfs/dbraw/zinc/45/94/87/1039459487.db2.gz HVCXEVGFTKZEMY-ZDUSSCGKSA-N 1 2 324.403 4.024 20 0 DIADLO CCc1ccc([C@H](C)[NH2+]Cc2nc(-c3ccc(F)cc3)n[nH]2)cc1 ZINC000540219703 1039459503 /nfs/dbraw/zinc/45/95/03/1039459503.db2.gz HVCXEVGFTKZEMY-ZDUSSCGKSA-N 1 2 324.403 4.024 20 0 DIADLO COC[C@H]([NH2+]Cc1ncc(-c2ccc(C)cc2)o1)c1ccccc1 ZINC000540407539 1039489094 /nfs/dbraw/zinc/48/90/94/1039489094.db2.gz NKJCLDLMDRPKGV-SFHVURJKSA-N 1 2 322.408 4.127 20 0 DIADLO CC[C@@H](C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1)c1ccc(OC)cc1 ZINC000540490382 1039503652 /nfs/dbraw/zinc/50/36/52/1039503652.db2.gz CLVZJTZEUVDIPV-MRXNPFEDSA-N 1 2 323.396 4.012 20 0 DIADLO COc1cccc([C@H](C)[N@@H+]2CCc3c([nH]c4ccccc43)C2)c1 ZINC000536181059 1039536837 /nfs/dbraw/zinc/53/68/37/1039536837.db2.gz SNVQIRMGERWYLG-AWEZNQCLSA-N 1 2 306.409 4.296 20 0 DIADLO COc1cccc([C@H](C)[N@H+]2CCc3c([nH]c4ccccc43)C2)c1 ZINC000536181059 1039536844 /nfs/dbraw/zinc/53/68/44/1039536844.db2.gz SNVQIRMGERWYLG-AWEZNQCLSA-N 1 2 306.409 4.296 20 0 DIADLO c1cn(-c2cccc(OCc3ncc(-c4ccccc4)o3)c2)c[nH+]1 ZINC000151415890 1039556362 /nfs/dbraw/zinc/55/63/62/1039556362.db2.gz LFUBATBPHRRGKG-UHFFFAOYSA-N 1 2 317.348 4.106 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC2CC(c3ccccc3)C2)c(C)[nH+]1 ZINC000584036675 1039570779 /nfs/dbraw/zinc/57/07/79/1039570779.db2.gz CBYQLEMDTWZVMA-UHFFFAOYSA-N 1 2 323.440 4.322 20 0 DIADLO CC[C@@](C)([NH2+]Cc1ccc(Cl)nc1Cl)c1nccs1 ZINC000278602910 1039584948 /nfs/dbraw/zinc/58/49/48/1039584948.db2.gz LYVCAKNPHKSFMP-CYBMUJFWSA-N 1 2 316.257 4.260 20 0 DIADLO Cc1ccc2oc(N[C@H]3CC[C@H](Nc4cccc[nH+]4)CC3)nc2c1 ZINC000685261648 1039585760 /nfs/dbraw/zinc/58/57/60/1039585760.db2.gz RFPDEELMDXKGOF-SHTZXODSSA-N 1 2 322.412 4.366 20 0 DIADLO Fc1ccc(C[NH2+]Cc2ncc(C(F)(F)F)s2)cc1Cl ZINC000278621566 1039595593 /nfs/dbraw/zinc/59/55/93/1039595593.db2.gz JROUMINLIXNJMD-UHFFFAOYSA-N 1 2 324.730 4.244 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc2cccnc12 ZINC000584137020 1039618880 /nfs/dbraw/zinc/61/88/80/1039618880.db2.gz ZGONZPJOUZDGGE-ZDUSSCGKSA-N 1 2 324.428 4.075 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1nc2ccccc2s1 ZINC000541085713 1039619799 /nfs/dbraw/zinc/61/97/99/1039619799.db2.gz JDFUARPCDLFRNP-CYBMUJFWSA-N 1 2 310.422 4.079 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1nc2ccccc2s1 ZINC000541085713 1039619809 /nfs/dbraw/zinc/61/98/09/1039619809.db2.gz JDFUARPCDLFRNP-CYBMUJFWSA-N 1 2 310.422 4.079 20 0 DIADLO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1ncc(Br)s1 ZINC000541235213 1039641720 /nfs/dbraw/zinc/64/17/20/1039641720.db2.gz ISBKMQGAFQDJTQ-SNVBAGLBSA-N 1 2 317.296 4.306 20 0 DIADLO CCC(C)(C)[C@H]1CCC[N@@H+]1Cc1ncc(Br)s1 ZINC000541235213 1039641713 /nfs/dbraw/zinc/64/17/13/1039641713.db2.gz ISBKMQGAFQDJTQ-SNVBAGLBSA-N 1 2 317.296 4.306 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2cnc(C3CCCCC3)s2)c2nccn21 ZINC000584212725 1039643357 /nfs/dbraw/zinc/64/33/57/1039643357.db2.gz PBZPPHXLZLNEPB-IUODEOHRSA-N 1 2 316.474 4.183 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncc(Br)s1)c1ccsc1 ZINC000381318338 1039670815 /nfs/dbraw/zinc/67/08/15/1039670815.db2.gz NWIXNYSAAKSINO-SFYZADRCSA-N 1 2 317.277 4.379 20 0 DIADLO COc1ccc(Oc2ccc(C[NH2+]Cc3cc(C)on3)cc2)cc1 ZINC000541389898 1039675285 /nfs/dbraw/zinc/67/52/85/1039675285.db2.gz NUWNPLLTSXKDAN-UHFFFAOYSA-N 1 2 324.380 4.074 20 0 DIADLO CC(C)COC1CC[NH+](Cc2ccc(Cl)nc2Cl)CC1 ZINC000278748624 1039716324 /nfs/dbraw/zinc/71/63/24/1039716324.db2.gz WVRZADFROWTXJU-UHFFFAOYSA-N 1 2 317.260 4.025 20 0 DIADLO Cc1ccc(OCc2nc(C[N@@H+]3CCC34CCC4)cs2)cc1 ZINC000081515817 1039722727 /nfs/dbraw/zinc/72/27/27/1039722727.db2.gz BUECLDIAUUEYJV-UHFFFAOYSA-N 1 2 314.454 4.159 20 0 DIADLO Cc1ccc(OCc2nc(C[N@H+]3CCC34CCC4)cs2)cc1 ZINC000081515817 1039722742 /nfs/dbraw/zinc/72/27/42/1039722742.db2.gz BUECLDIAUUEYJV-UHFFFAOYSA-N 1 2 314.454 4.159 20 0 DIADLO Cn1ccc([C@@H]([NH2+]Cc2cccs2)c2ccc(Cl)cc2)n1 ZINC000541748858 1039740968 /nfs/dbraw/zinc/74/09/68/1039740968.db2.gz GLNOFPASWMZDCL-INIZCTEOSA-N 1 2 317.845 4.014 20 0 DIADLO FC(F)(F)c1ccc(CCCSCCn2cc[nH+]c2)cc1 ZINC000090201993 1039756762 /nfs/dbraw/zinc/75/67/62/1039756762.db2.gz ALXLBCOKEWVJPP-UHFFFAOYSA-N 1 2 314.376 4.268 20 0 DIADLO CC[C@@H]1CCCCC[N@H+]1Cc1ncc(Br)s1 ZINC000542167107 1039807334 /nfs/dbraw/zinc/80/73/34/1039807334.db2.gz IWKTXTRSYBZNGD-SNVBAGLBSA-N 1 2 303.269 4.060 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+]Cc1nc(C2CC2)cs1 ZINC000090458295 1039797487 /nfs/dbraw/zinc/79/74/87/1039797487.db2.gz NGKYDODTQBVEGM-LBPRGKRZSA-N 1 2 302.443 4.270 20 0 DIADLO COC[C@@H](Nc1cc(C(C)C)[nH+]c(C(C)C)n1)c1ccco1 ZINC000090107480 1039800661 /nfs/dbraw/zinc/80/06/61/1039800661.db2.gz GRBSRQNCXKIQSI-CQSZACIVSA-N 1 2 303.406 4.116 20 0 DIADLO CC[C@@H]1CCCCC[N@@H+]1Cc1ncc(Br)s1 ZINC000542167107 1039807310 /nfs/dbraw/zinc/80/73/10/1039807310.db2.gz IWKTXTRSYBZNGD-SNVBAGLBSA-N 1 2 303.269 4.060 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000090546956 1039813412 /nfs/dbraw/zinc/81/34/12/1039813412.db2.gz PGXGEFIXCOCRAN-OAHLLOKOSA-N 1 2 313.445 4.248 20 0 DIADLO CCc1ccc(-c2noc(C[NH2+][C@H](C)c3ccsc3)n2)cc1 ZINC000669937583 1039866978 /nfs/dbraw/zinc/86/69/78/1039866978.db2.gz LYCSAMNPEUXYLW-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO Oc1ccc(C[N@H+](Cc2ccco2)Cc2ccc(Cl)o2)cc1 ZINC000093015362 1039892996 /nfs/dbraw/zinc/89/29/96/1039892996.db2.gz JFRKBSKDKLFRGR-UHFFFAOYSA-N 1 2 317.772 4.434 20 0 DIADLO Oc1ccc(C[N@@H+](Cc2ccco2)Cc2ccc(Cl)o2)cc1 ZINC000093015362 1039893018 /nfs/dbraw/zinc/89/30/18/1039893018.db2.gz JFRKBSKDKLFRGR-UHFFFAOYSA-N 1 2 317.772 4.434 20 0 DIADLO c1[nH+]c(-c2cccc(NC[C@H]3CCSC3)c2)n2c1CCCC2 ZINC000278773426 1039896111 /nfs/dbraw/zinc/89/61/11/1039896111.db2.gz OWXUOYXWJVIFEV-CQSZACIVSA-N 1 2 313.470 4.051 20 0 DIADLO CC(C)([NH2+]Cc1cc2ccccc2o1)c1cc(C(F)(F)F)on1 ZINC000492057217 1039911881 /nfs/dbraw/zinc/91/18/81/1039911881.db2.gz ADIGWTBWRKFFPB-UHFFFAOYSA-N 1 2 324.302 4.465 20 0 DIADLO CC[N@H+](C)[C@H](c1nc([C@@H](C)C(C)(C)C)no1)c1ccccc1 ZINC000685315086 1039913821 /nfs/dbraw/zinc/91/38/21/1039913821.db2.gz IVOWRLOXMVLXRJ-HIFRSBDPSA-N 1 2 301.434 4.260 20 0 DIADLO CC[N@@H+](C)[C@H](c1nc([C@@H](C)C(C)(C)C)no1)c1ccccc1 ZINC000685315086 1039913839 /nfs/dbraw/zinc/91/38/39/1039913839.db2.gz IVOWRLOXMVLXRJ-HIFRSBDPSA-N 1 2 301.434 4.260 20 0 DIADLO CC[N@H+](C)[C@H](c1nc([C@H](C)C(C)(C)C)no1)c1ccccc1 ZINC000685315088 1039914707 /nfs/dbraw/zinc/91/47/07/1039914707.db2.gz IVOWRLOXMVLXRJ-ZFWWWQNUSA-N 1 2 301.434 4.260 20 0 DIADLO CC[N@@H+](C)[C@H](c1nc([C@H](C)C(C)(C)C)no1)c1ccccc1 ZINC000685315088 1039914730 /nfs/dbraw/zinc/91/47/30/1039914730.db2.gz IVOWRLOXMVLXRJ-ZFWWWQNUSA-N 1 2 301.434 4.260 20 0 DIADLO CCn1c(=S)n(C[N@H+](C)CC(C)(C)C)nc1-c1ccccc1 ZINC000151936736 1039916415 /nfs/dbraw/zinc/91/64/15/1039916415.db2.gz KCRMPJVKAMQDRI-UHFFFAOYSA-N 1 2 318.490 4.036 20 0 DIADLO CCn1c(=S)n(C[N@@H+](C)CC(C)(C)C)nc1-c1ccccc1 ZINC000151936736 1039916425 /nfs/dbraw/zinc/91/64/25/1039916425.db2.gz KCRMPJVKAMQDRI-UHFFFAOYSA-N 1 2 318.490 4.036 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@H]1CCc2c1ccc(Cl)c2Cl ZINC000925400795 1039953706 /nfs/dbraw/zinc/95/37/06/1039953706.db2.gz WAXWOBAWPMCNQE-MADCSZMMSA-N 1 2 312.200 4.023 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@H]1CCc2c1ccc(Cl)c2Cl ZINC000925400793 1039953822 /nfs/dbraw/zinc/95/38/22/1039953822.db2.gz WAXWOBAWPMCNQE-KRTXAFLBSA-N 1 2 312.200 4.023 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cc3cnccc3o2)cs1 ZINC000657879891 1039986647 /nfs/dbraw/zinc/98/66/47/1039986647.db2.gz VATASLFFFXVRBM-GHMZBOCLSA-N 1 2 301.415 4.259 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccc(C(F)F)nc2)cs1 ZINC000657877874 1039987898 /nfs/dbraw/zinc/98/78/98/1039987898.db2.gz KUGGHOHJTVGBLT-ZJUUUORDSA-N 1 2 311.401 4.450 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](Cc1cn2cc(Cl)ccc2n1)C1CC1 ZINC000175679417 1040043992 /nfs/dbraw/zinc/04/39/92/1040043992.db2.gz JLOAUTZMULYPLP-LBPRGKRZSA-N 1 2 315.804 4.306 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](Cc1cn2cc(Cl)ccc2n1)C1CC1 ZINC000175679417 1040044012 /nfs/dbraw/zinc/04/40/12/1040044012.db2.gz JLOAUTZMULYPLP-LBPRGKRZSA-N 1 2 315.804 4.306 20 0 DIADLO C[N@H+](Cc1c(Cl)ccc(Cl)c1Cl)[C@@H]1CCCOC1 ZINC000685438555 1040053795 /nfs/dbraw/zinc/05/37/95/1040053795.db2.gz FOPPDCBZFAAZCB-SECBINFHSA-N 1 2 308.636 4.258 20 0 DIADLO C[N@@H+](Cc1c(Cl)ccc(Cl)c1Cl)[C@@H]1CCCOC1 ZINC000685438555 1040053812 /nfs/dbraw/zinc/05/38/12/1040053812.db2.gz FOPPDCBZFAAZCB-SECBINFHSA-N 1 2 308.636 4.258 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncoc1-c1ccccc1)c1ccc(F)cn1 ZINC000493034081 1040065022 /nfs/dbraw/zinc/06/50/22/1040065022.db2.gz IRBLLIOKNKANKS-OAHLLOKOSA-N 1 2 311.360 4.117 20 0 DIADLO CC[N@H+](Cc1nc2c(s1)CCCC2)[C@H](C)c1cccnc1 ZINC000685469962 1040066025 /nfs/dbraw/zinc/06/60/25/1040066025.db2.gz YUVVGLPSNCGLSW-CYBMUJFWSA-N 1 2 301.459 4.000 20 0 DIADLO CC[N@@H+](Cc1nc2c(s1)CCCC2)[C@H](C)c1cccnc1 ZINC000685469962 1040066042 /nfs/dbraw/zinc/06/60/42/1040066042.db2.gz YUVVGLPSNCGLSW-CYBMUJFWSA-N 1 2 301.459 4.000 20 0 DIADLO CC1(C)C[N@H+](Cc2nc3c(s2)CCC3)[C@@H]1c1cccs1 ZINC000685473634 1040072586 /nfs/dbraw/zinc/07/25/86/1040072586.db2.gz YQXFGXLGXUXJNS-OAHLLOKOSA-N 1 2 304.484 4.276 20 0 DIADLO CC1(C)C[N@@H+](Cc2nc3c(s2)CCC3)[C@@H]1c1cccs1 ZINC000685473634 1040072602 /nfs/dbraw/zinc/07/26/02/1040072602.db2.gz YQXFGXLGXUXJNS-OAHLLOKOSA-N 1 2 304.484 4.276 20 0 DIADLO Clc1cccc(Cl)c1C1CC[NH+](Cc2cn[nH]c2)CC1 ZINC000685476038 1040075087 /nfs/dbraw/zinc/07/50/87/1040075087.db2.gz OYWRSBDMQDLIFT-UHFFFAOYSA-N 1 2 310.228 4.096 20 0 DIADLO c1ccc(COc2ccc(CCNc3cccc[nH+]3)cc2)cc1 ZINC000309846416 1040098217 /nfs/dbraw/zinc/09/82/17/1040098217.db2.gz YJDIPRKVRCTCPM-UHFFFAOYSA-N 1 2 304.393 4.315 20 0 DIADLO Cc1nocc1C[NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl ZINC000294278132 1040121276 /nfs/dbraw/zinc/12/12/76/1040121276.db2.gz VXFOINZRDCCHOJ-QMMMGPOBSA-N 1 2 303.164 4.280 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cc(C(C)(C)C)on1 ZINC000685571943 1040134851 /nfs/dbraw/zinc/13/48/51/1040134851.db2.gz BZZOQMWBDCZSOZ-MNOVXSKESA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cc(C(C)(C)C)on1 ZINC000685571943 1040134862 /nfs/dbraw/zinc/13/48/62/1040134862.db2.gz BZZOQMWBDCZSOZ-MNOVXSKESA-N 1 2 304.356 4.135 20 0 DIADLO FCC[NH2+]Cc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000280807899 1040136108 /nfs/dbraw/zinc/13/61/08/1040136108.db2.gz UAMDBRTXALCSJX-UHFFFAOYSA-N 1 2 305.205 4.176 20 0 DIADLO c1sc(C2CCCC2)nc1C[N@@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000653813403 1040145276 /nfs/dbraw/zinc/14/52/76/1040145276.db2.gz BDVAHLNZDUXPBG-QGZVFWFLSA-N 1 2 320.502 4.334 20 0 DIADLO c1sc(C2CCCC2)nc1C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000653813403 1040145289 /nfs/dbraw/zinc/14/52/89/1040145289.db2.gz BDVAHLNZDUXPBG-QGZVFWFLSA-N 1 2 320.502 4.334 20 0 DIADLO Cc1c[nH]nc1C[NH2+]C(c1cccc(C)c1)c1cccc(C)c1 ZINC000685618731 1040161813 /nfs/dbraw/zinc/16/18/13/1040161813.db2.gz KUQPHAXXFXJLQA-UHFFFAOYSA-N 1 2 305.425 4.214 20 0 DIADLO CC(C)CCN(C(=O)Nc1ccn2cc[nH+]c2c1)C1CCCC1 ZINC000685651331 1040190152 /nfs/dbraw/zinc/19/01/52/1040190152.db2.gz YGOVYIWNLPDLLY-UHFFFAOYSA-N 1 2 314.433 4.157 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1nccc2ccccc21 ZINC000685654845 1040191926 /nfs/dbraw/zinc/19/19/26/1040191926.db2.gz QYVHDXJWALREKV-RYUDHWBXSA-N 1 2 313.351 4.320 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1nccc2ccccc21 ZINC000685654846 1040192805 /nfs/dbraw/zinc/19/28/05/1040192805.db2.gz QYVHDXJWALREKV-VXGBXAGGSA-N 1 2 313.351 4.320 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1cc2cnccc2o1 ZINC000657942076 1040203959 /nfs/dbraw/zinc/20/39/59/1040203959.db2.gz ABINVYUBTSIMHR-AWEZNQCLSA-N 1 2 322.412 4.386 20 0 DIADLO CCc1cccc(NC(=O)NCc2cc(C)[nH+]c(C)c2)c1CC ZINC000421108980 1040253402 /nfs/dbraw/zinc/25/34/02/1040253402.db2.gz ONFDIXQGFQDSLW-UHFFFAOYSA-N 1 2 311.429 4.145 20 0 DIADLO COc1cc2ccc([C@@H](C)[NH2+]CC(C)(F)F)cc2cc1OC ZINC000658024354 1040274842 /nfs/dbraw/zinc/27/48/42/1040274842.db2.gz WUBIZCKTCCHYEU-LLVKDONJSA-N 1 2 309.356 4.163 20 0 DIADLO C[C@H]([NH2+][C@H]1C[C@H](C)n2ncnc21)c1cc2cc(Cl)ccc2o1 ZINC000658101073 1040310707 /nfs/dbraw/zinc/31/07/07/1040310707.db2.gz KHWWBEUWJFKPPF-KWBADKCTSA-N 1 2 316.792 4.034 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)c1ccc(Cl)o1 ZINC000101665955 1040336161 /nfs/dbraw/zinc/33/61/61/1040336161.db2.gz ODPRNBCOFFBLGM-UHFFFAOYSA-N 1 2 322.151 4.024 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2cc(F)ccc2OC(F)F)cs1 ZINC000658327894 1040425241 /nfs/dbraw/zinc/42/52/41/1040425241.db2.gz FWKWXVPYSHUKDC-MRVPVSSYSA-N 1 2 316.348 4.043 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@@H](C)c2nccn2C)c2cccc(F)c2)c1 ZINC000658337383 1040428379 /nfs/dbraw/zinc/42/83/79/1040428379.db2.gz DEDUCPDYZTVVCM-HNAYVOBHSA-N 1 2 323.415 4.308 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]C1(c2ccccc2F)CCC1 ZINC000926635134 1040523002 /nfs/dbraw/zinc/52/30/02/1040523002.db2.gz UIPKLXZYTNTRSY-OAHLLOKOSA-N 1 2 300.377 4.169 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[NH+]1CCC(c2ccccc2F)CC1 ZINC000605577134 1040555759 /nfs/dbraw/zinc/55/57/59/1040555759.db2.gz MKFVQZNAKLKKNM-LBPRGKRZSA-N 1 2 315.392 4.027 20 0 DIADLO COc1ccsc1C[NH2+][C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000278790400 1040559098 /nfs/dbraw/zinc/55/90/98/1040559098.db2.gz QLDDOFQBGMWKMP-ZETCQYMHSA-N 1 2 322.377 4.083 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(C2CCCCC2)s1)c1cscn1 ZINC000569825202 1040562034 /nfs/dbraw/zinc/56/20/34/1040562034.db2.gz HMKWNVOUVOEIHH-LLVKDONJSA-N 1 2 307.488 4.498 20 0 DIADLO O=C(C[C@H]1C=CCC1)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000569950958 1040588464 /nfs/dbraw/zinc/58/84/64/1040588464.db2.gz QUMSLHKFKBYTEC-HNNXBMFYSA-N 1 2 321.424 4.181 20 0 DIADLO CC(C)(C)c1ccc(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000024049769 1040603845 /nfs/dbraw/zinc/60/38/45/1040603845.db2.gz UPAQFYHHUPRLIU-UHFFFAOYSA-N 1 2 319.408 4.422 20 0 DIADLO CC(C)=C[C@H]1[C@H](C(=O)Nc2cccc(-n3cc[nH+]c3)c2)C1(C)C ZINC000612504013 1040617379 /nfs/dbraw/zinc/61/73/79/1040617379.db2.gz FJSJTWXWSDHTJU-DLBZAZTESA-N 1 2 309.413 4.049 20 0 DIADLO CC(C)[C@H]([NH2+][C@H](C)c1cn(C(C)C)nn1)c1ccccc1F ZINC000926692384 1040685113 /nfs/dbraw/zinc/68/51/13/1040685113.db2.gz IQPHBLUJVXNOJK-DYVFJYSZSA-N 1 2 304.413 4.046 20 0 DIADLO FC(F)Sc1ccc(C[N@@H+]2CCc3ncsc3C2)cc1 ZINC000782634350 1040685365 /nfs/dbraw/zinc/68/53/65/1040685365.db2.gz QBLICYVAVYPIBI-UHFFFAOYSA-N 1 2 312.410 4.016 20 0 DIADLO FC(F)Sc1ccc(C[N@H+]2CCc3ncsc3C2)cc1 ZINC000782634350 1040685379 /nfs/dbraw/zinc/68/53/79/1040685379.db2.gz QBLICYVAVYPIBI-UHFFFAOYSA-N 1 2 312.410 4.016 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H](C)c1cn(C(C)C)nn1)c1ccccc1F ZINC000926692385 1040686145 /nfs/dbraw/zinc/68/61/45/1040686145.db2.gz IQPHBLUJVXNOJK-GUYCJALGSA-N 1 2 304.413 4.046 20 0 DIADLO Cc1c[nH]nc1C[N@H+](Cc1ccccc1)Cc1ccc(F)cc1 ZINC000685834155 1040770855 /nfs/dbraw/zinc/77/08/55/1040770855.db2.gz ZGRHTQMKRPZBAR-UHFFFAOYSA-N 1 2 309.388 4.060 20 0 DIADLO Cc1c[nH]nc1C[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1 ZINC000685834155 1040770862 /nfs/dbraw/zinc/77/08/62/1040770862.db2.gz ZGRHTQMKRPZBAR-UHFFFAOYSA-N 1 2 309.388 4.060 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@@H](C)OC[C@H]2c2ccccc2)s1 ZINC000685838038 1040775038 /nfs/dbraw/zinc/77/50/38/1040775038.db2.gz WTUDDURZUXIEFJ-CJNGLKHVSA-N 1 2 319.495 4.432 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@@H](C)OC[C@H]2c2ccccc2)s1 ZINC000685838038 1040775057 /nfs/dbraw/zinc/77/50/57/1040775057.db2.gz WTUDDURZUXIEFJ-CJNGLKHVSA-N 1 2 319.495 4.432 20 0 DIADLO CC(C)COC1CC[NH+](Cc2cc(Cl)nc(Cl)c2)CC1 ZINC000066422985 1040832617 /nfs/dbraw/zinc/83/26/17/1040832617.db2.gz DBGUPZALPOZBCM-UHFFFAOYSA-N 1 2 317.260 4.025 20 0 DIADLO CCCCCOc1cc(C)ccc1C[NH2+][C@H](C)c1ccn(C)n1 ZINC000414091654 1040843152 /nfs/dbraw/zinc/84/31/52/1040843152.db2.gz DSYSBKQIKXDPQB-MRXNPFEDSA-N 1 2 315.461 4.148 20 0 DIADLO COCOc1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1 ZINC001211639487 1040881472 /nfs/dbraw/zinc/88/14/72/1040881472.db2.gz MIHKDEMAZFPCRM-UHFFFAOYSA-N 1 2 312.413 4.403 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2cc(Cl)cc(Cl)c21)c1ccn(C)n1 ZINC000414188469 1040973493 /nfs/dbraw/zinc/97/34/93/1040973493.db2.gz QSLQZOMVGYSZQL-OTYXRUKQSA-N 1 2 310.228 4.065 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)CC(=O)NC1CCCCCC1 ZINC000613486503 1040997115 /nfs/dbraw/zinc/99/71/15/1040997115.db2.gz RBUVGAXWILZOPB-CQSZACIVSA-N 1 2 322.880 4.172 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)CC(=O)NC1CCCCCC1 ZINC000613486503 1040997148 /nfs/dbraw/zinc/99/71/48/1040997148.db2.gz RBUVGAXWILZOPB-CQSZACIVSA-N 1 2 322.880 4.172 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)CC(=O)NC1CCCCCC1 ZINC000613486502 1040997580 /nfs/dbraw/zinc/99/75/80/1040997580.db2.gz RBUVGAXWILZOPB-AWEZNQCLSA-N 1 2 322.880 4.172 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)CC(=O)NC1CCCCCC1 ZINC000613486502 1040997599 /nfs/dbraw/zinc/99/75/99/1040997599.db2.gz RBUVGAXWILZOPB-AWEZNQCLSA-N 1 2 322.880 4.172 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2csc([C@@H](C)OC)n2)cc1 ZINC000175023807 1041021340 /nfs/dbraw/zinc/02/13/40/1041021340.db2.gz GCHDIZHGKDNNNM-CHWSQXEVSA-N 1 2 320.458 4.052 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2csc([C@@H](C)OC)n2)cc1 ZINC000175023807 1041021354 /nfs/dbraw/zinc/02/13/54/1041021354.db2.gz GCHDIZHGKDNNNM-CHWSQXEVSA-N 1 2 320.458 4.052 20 0 DIADLO Cc1cccc(-c2nnc([C@@H](C)[N@@H+]3CCCc4occc4C3)o2)c1 ZINC000808797381 1041030981 /nfs/dbraw/zinc/03/09/81/1041030981.db2.gz ONJUTEZBLZRFGT-CQSZACIVSA-N 1 2 323.396 4.147 20 0 DIADLO Cc1cccc(-c2nnc([C@@H](C)[N@H+]3CCCc4occc4C3)o2)c1 ZINC000808797381 1041030994 /nfs/dbraw/zinc/03/09/94/1041030994.db2.gz ONJUTEZBLZRFGT-CQSZACIVSA-N 1 2 323.396 4.147 20 0 DIADLO C[C@@H]1CC[C@H]([NH2+]Cc2nccc(C(F)(F)F)n2)c2ccccc21 ZINC000414238218 1041040491 /nfs/dbraw/zinc/04/04/91/1041040491.db2.gz JVPQSFMLIQBTHI-RISCZKNCSA-N 1 2 321.346 4.224 20 0 DIADLO C[C@@H]([NH2+]Cc1nccc(C(F)(F)F)n1)c1cccc(C2CC2)c1 ZINC000414244870 1041045757 /nfs/dbraw/zinc/04/57/57/1041045757.db2.gz LVJMRHCVDXAYQX-LLVKDONJSA-N 1 2 321.346 4.224 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)c1cc(Cl)cc2ccccc21 ZINC001131516256 1041053232 /nfs/dbraw/zinc/05/32/32/1041053232.db2.gz MPQYWAIOUWRZPC-UHFFFAOYSA-N 1 2 321.767 4.393 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC001625885055 1041072980 /nfs/dbraw/zinc/07/29/80/1041072980.db2.gz YTHIRJFRTDCWFJ-MOPGFXCFSA-N 1 2 316.404 4.016 20 0 DIADLO Cc1cc2c(cc1C)[C@H]([NH2+][C@H](C)c1csnn1)CCS2 ZINC000414293544 1041087292 /nfs/dbraw/zinc/08/72/92/1041087292.db2.gz CZYDITYEINNVIS-DGCLKSJQSA-N 1 2 305.472 4.043 20 0 DIADLO Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]Cc1nnc(C(C)C)s1 ZINC000892608190 1041108581 /nfs/dbraw/zinc/10/85/81/1041108581.db2.gz NLPNISWHYJQYTF-ZDUSSCGKSA-N 1 2 319.474 4.366 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2nnc(C3CC3)s2)C2CCCC2)o1 ZINC000414335067 1041142651 /nfs/dbraw/zinc/14/26/51/1041142651.db2.gz XUJWQIBFKQIECB-MRXNPFEDSA-N 1 2 317.458 4.338 20 0 DIADLO O=C1CCCc2cc(Nc3ccc[nH+]c3N3CCCCC3)ccc21 ZINC001213101351 1041146868 /nfs/dbraw/zinc/14/68/68/1041146868.db2.gz VFDIMRCXAQUCGE-UHFFFAOYSA-N 1 2 321.424 4.335 20 0 DIADLO c1cn(-c2ccnc(-c3nc(C4CCCCCCC4)no3)c2)c[nH+]1 ZINC000809440710 1041168813 /nfs/dbraw/zinc/16/88/13/1041168813.db2.gz KJFFRTLWVKNFCP-UHFFFAOYSA-N 1 2 323.400 4.145 20 0 DIADLO CCCOc1cccc2c(N3CC[C@H](C(F)F)C3)cc[nH+]c12 ZINC000685919740 1041172288 /nfs/dbraw/zinc/17/22/88/1041172288.db2.gz VGGGDFRNZMOKQC-LBPRGKRZSA-N 1 2 306.356 4.115 20 0 DIADLO C[N@H+](Cc1c(Cl)nc2cc(Cl)ccn21)Cc1ccccc1 ZINC000809539398 1041184299 /nfs/dbraw/zinc/18/42/99/1041184299.db2.gz RDLBMKKDEMCZNA-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1c(Cl)nc2cc(Cl)ccn21)Cc1ccccc1 ZINC000809539398 1041184308 /nfs/dbraw/zinc/18/43/08/1041184308.db2.gz RDLBMKKDEMCZNA-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC(F)(F)[C@H](C)C1 ZINC000685921708 1041184975 /nfs/dbraw/zinc/18/49/75/1041184975.db2.gz OJVQNEDMYXQOBP-GFCCVEGCSA-N 1 2 306.356 4.033 20 0 DIADLO CCc1ncc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000414375452 1041197510 /nfs/dbraw/zinc/19/75/10/1041197510.db2.gz YWCXUKVYTGILSY-ZDUSSCGKSA-N 1 2 315.848 4.418 20 0 DIADLO CCc1ncc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000414375452 1041197522 /nfs/dbraw/zinc/19/75/22/1041197522.db2.gz YWCXUKVYTGILSY-ZDUSSCGKSA-N 1 2 315.848 4.418 20 0 DIADLO O=C(Nc1cscc1Cl)[C@@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000636439760 1041202055 /nfs/dbraw/zinc/20/20/55/1041202055.db2.gz WTMWQOYWASFRQB-HNNXBMFYSA-N 1 2 320.845 4.005 20 0 DIADLO O=C(Nc1cscc1Cl)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000636439760 1041202074 /nfs/dbraw/zinc/20/20/74/1041202074.db2.gz WTMWQOYWASFRQB-HNNXBMFYSA-N 1 2 320.845 4.005 20 0 DIADLO CC(C)(C)[C@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc(F)cc1 ZINC000375894962 1041226651 /nfs/dbraw/zinc/22/66/51/1041226651.db2.gz IBZHQRXWOMZILJ-NVXWUHKLSA-N 1 2 301.409 4.303 20 0 DIADLO Cc1[nH+]cc(CN2Cc3cccc(Cl)c3C2)n1-c1ccccc1 ZINC000809771168 1041235963 /nfs/dbraw/zinc/23/59/63/1041235963.db2.gz FOFJAEKONGQJBI-UHFFFAOYSA-N 1 2 323.827 4.350 20 0 DIADLO Cc1ccc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)cn1 ZINC000462536341 1041242834 /nfs/dbraw/zinc/24/28/34/1041242834.db2.gz IXZNGUWMCNVCSP-UHFFFAOYSA-N 1 2 307.224 4.476 20 0 DIADLO C[NH+](C)c1ccc(NCc2cscc2C(F)(F)F)cc1 ZINC000810148903 1041324509 /nfs/dbraw/zinc/32/45/09/1041324509.db2.gz QPTXWCMYFNAUSC-UHFFFAOYSA-N 1 2 300.349 4.445 20 0 DIADLO CC[N@H+](Cc1ncsc1Br)C1CCCCC1 ZINC000659840108 1041419620 /nfs/dbraw/zinc/41/96/20/1041419620.db2.gz ANOYFEPWNOEVFQ-UHFFFAOYSA-N 1 2 303.269 4.060 20 0 DIADLO c1cc([NH2+]CC2CCCC2)ccc1Nc1cc2c(nn1)CCC2 ZINC000590054840 1041367290 /nfs/dbraw/zinc/36/72/90/1041367290.db2.gz XFMHEKUPKBQXCE-UHFFFAOYSA-N 1 2 308.429 4.311 20 0 DIADLO CC[N@@H+](Cc1ncsc1Br)C1CCCCC1 ZINC000659840108 1041419627 /nfs/dbraw/zinc/41/96/27/1041419627.db2.gz ANOYFEPWNOEVFQ-UHFFFAOYSA-N 1 2 303.269 4.060 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cc(C3CC3)no2)C2CC2)o1 ZINC000659814938 1041375483 /nfs/dbraw/zinc/37/54/83/1041375483.db2.gz WOCZSDCEHITIEE-PXAZEXFGSA-N 1 2 312.413 4.433 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cc(C3CC3)no2)C2CC2)o1 ZINC000659814938 1041375495 /nfs/dbraw/zinc/37/54/95/1041375495.db2.gz WOCZSDCEHITIEE-PXAZEXFGSA-N 1 2 312.413 4.433 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2nc3ccccc3s2)nc(C)n1 ZINC000659826910 1041379816 /nfs/dbraw/zinc/37/98/16/1041379816.db2.gz LHKAWWMMSVBSSX-INIZCTEOSA-N 1 2 324.453 4.040 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2nc3ccccc3s2)nc(C)n1 ZINC000659826910 1041379821 /nfs/dbraw/zinc/37/98/21/1041379821.db2.gz LHKAWWMMSVBSSX-INIZCTEOSA-N 1 2 324.453 4.040 20 0 DIADLO Cc1nc(C[NH2+]Cc2nc3cc(Cl)ccc3s2)sc1C ZINC000892722579 1041387786 /nfs/dbraw/zinc/38/77/86/1041387786.db2.gz VOGVTXJKKVBOHM-UHFFFAOYSA-N 1 2 323.874 4.313 20 0 DIADLO Fc1cc(F)cc(Oc2ccc(C[NH2+]Cc3ccon3)cc2)c1 ZINC000747621889 1041422254 /nfs/dbraw/zinc/42/22/54/1041422254.db2.gz FGYPLCQYCQKVGQ-UHFFFAOYSA-N 1 2 316.307 4.035 20 0 DIADLO Cc1ccc2cc(NC3CC(C)(C)N(O)C(C)(C)C3)[nH+]cc2c1 ZINC001167719943 1041448851 /nfs/dbraw/zinc/44/88/51/1041448851.db2.gz SGPDODHRBKZXOF-UHFFFAOYSA-N 1 2 313.445 4.366 20 0 DIADLO Cc1cc(C(C)(C)C)c(C)cc1OC(=O)CCCn1cc[nH+]c1 ZINC001132663448 1041490264 /nfs/dbraw/zinc/49/02/64/1041490264.db2.gz AGUSNPCNOCRRCU-UHFFFAOYSA-N 1 2 314.429 4.183 20 0 DIADLO Cn1cnc(C[N@@H+](Cc2ccccc2Cl)C2CCCC2)c1 ZINC000659879578 1041510516 /nfs/dbraw/zinc/51/05/16/1041510516.db2.gz CYJPAPNHALMWSZ-UHFFFAOYSA-N 1 2 303.837 4.018 20 0 DIADLO Cn1cnc(C[N@H+](Cc2ccccc2Cl)C2CCCC2)c1 ZINC000659879578 1041510510 /nfs/dbraw/zinc/51/05/10/1041510510.db2.gz CYJPAPNHALMWSZ-UHFFFAOYSA-N 1 2 303.837 4.018 20 0 DIADLO Cc1ncsc1C[N@H+](C)Cc1cnc(-c2cccs2)s1 ZINC000179428404 1041511605 /nfs/dbraw/zinc/51/16/05/1041511605.db2.gz SUQHBIQZQWJJHE-UHFFFAOYSA-N 1 2 321.496 4.269 20 0 DIADLO Cc1ncsc1C[N@@H+](C)Cc1cnc(-c2cccs2)s1 ZINC000179428404 1041511612 /nfs/dbraw/zinc/51/16/12/1041511612.db2.gz SUQHBIQZQWJJHE-UHFFFAOYSA-N 1 2 321.496 4.269 20 0 DIADLO CCC[N@H+](Cc1nc(Cc2ccccc2)no1)Cc1ccccc1 ZINC000051211790 1041515079 /nfs/dbraw/zinc/51/50/79/1041515079.db2.gz OIXXTAZAEKOQIO-UHFFFAOYSA-N 1 2 321.424 4.073 20 0 DIADLO CCC[N@@H+](Cc1nc(Cc2ccccc2)no1)Cc1ccccc1 ZINC000051211790 1041515081 /nfs/dbraw/zinc/51/50/81/1041515081.db2.gz OIXXTAZAEKOQIO-UHFFFAOYSA-N 1 2 321.424 4.073 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cnc(-c3ccccc3)[nH]2)n1 ZINC000179697772 1041516795 /nfs/dbraw/zinc/51/67/95/1041516795.db2.gz OQWSLNPHCNVFBZ-LJQANCHMSA-N 1 2 318.424 4.117 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2cnc(-c3ccccc3)[nH]2)n1 ZINC000179697772 1041516799 /nfs/dbraw/zinc/51/67/99/1041516799.db2.gz OQWSLNPHCNVFBZ-LJQANCHMSA-N 1 2 318.424 4.117 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2cc(F)c(Cl)cc2Cl)ncn1 ZINC000271489595 1041517926 /nfs/dbraw/zinc/51/79/26/1041517926.db2.gz KTHOUAQMWMTIOA-SECBINFHSA-N 1 2 314.191 4.082 20 0 DIADLO Cc1c[nH]nc1C[N@@H+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000811460995 1041520052 /nfs/dbraw/zinc/52/00/52/1041520052.db2.gz DHNGHGVSUBGBKW-OAHLLOKOSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1c[nH]nc1C[N@H+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000811460995 1041520060 /nfs/dbraw/zinc/52/00/60/1041520060.db2.gz DHNGHGVSUBGBKW-OAHLLOKOSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1ccnc(Cl)c1Cl ZINC000811468220 1041521780 /nfs/dbraw/zinc/52/17/80/1041521780.db2.gz HTRREOHSTGLVIW-UHFFFAOYSA-N 1 2 310.228 4.375 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(C(C)(C)C)s1)c1coc2ccccc21 ZINC000925520453 1041525922 /nfs/dbraw/zinc/52/59/22/1041525922.db2.gz VRHDCRCILSBVMV-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccnc(Cl)c1Cl ZINC000811498567 1041526216 /nfs/dbraw/zinc/52/62/16/1041526216.db2.gz YRIUKDXKQPJLIC-VXNVDRBHSA-N 1 2 313.150 4.161 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccnc(Cl)c1Cl ZINC000811498567 1041526223 /nfs/dbraw/zinc/52/62/23/1041526223.db2.gz YRIUKDXKQPJLIC-VXNVDRBHSA-N 1 2 313.150 4.161 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000180322584 1041529649 /nfs/dbraw/zinc/52/96/49/1041529649.db2.gz WASJJEVKXUFYPW-KPZWWZAWSA-N 1 2 301.409 4.439 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C ZINC000246059654 1041568749 /nfs/dbraw/zinc/56/87/49/1041568749.db2.gz ZAQYQBPFESIUMF-VODVUFLWSA-N 1 2 303.837 4.419 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1nnc(-c2ccccc2)o1 ZINC000027557745 1041570110 /nfs/dbraw/zinc/57/01/10/1041570110.db2.gz RRYCDKSLYYYIGM-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1nnc(-c2ccccc2)o1 ZINC000027557745 1041570119 /nfs/dbraw/zinc/57/01/19/1041570119.db2.gz RRYCDKSLYYYIGM-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@@H+]2CCC[C@H]2c2ccccn2)c1 ZINC000659992195 1041574936 /nfs/dbraw/zinc/57/49/36/1041574936.db2.gz BNOKXRFOJHEDIS-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@H+]2CCC[C@H]2c2ccccn2)c1 ZINC000659992195 1041574944 /nfs/dbraw/zinc/57/49/44/1041574944.db2.gz BNOKXRFOJHEDIS-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO CCSCc1cc[nH+]c(NCc2c(C)nn(C(C)C)c2C)c1 ZINC000893243976 1041575957 /nfs/dbraw/zinc/57/59/57/1041575957.db2.gz LGUWQBHHJIODBV-UHFFFAOYSA-N 1 2 318.490 4.341 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1ccc2c(c1)CCCC2 ZINC000613708093 1041583087 /nfs/dbraw/zinc/58/30/87/1041583087.db2.gz NHFBZOXSURQNQA-UHFFFAOYSA-N 1 2 317.392 4.003 20 0 DIADLO CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]Cc1nnc(C2CC2)[nH]1 ZINC000651390356 1041586672 /nfs/dbraw/zinc/58/66/72/1041586672.db2.gz SAIQVQDETGFJKK-LBPRGKRZSA-N 1 2 324.428 4.150 20 0 DIADLO Cc1nnc(C[NH2+]C2(c3ccc(F)cc3F)CCCCC2)s1 ZINC000893256044 1041587127 /nfs/dbraw/zinc/58/71/27/1041587127.db2.gz PSFNKYKMADGTHV-UHFFFAOYSA-N 1 2 323.412 4.074 20 0 DIADLO Fc1cccc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)c1OC(F)F ZINC000660033174 1041588190 /nfs/dbraw/zinc/58/81/90/1041588190.db2.gz YYKMLOQKSQEJJF-AWEZNQCLSA-N 1 2 310.319 4.092 20 0 DIADLO Fc1cccc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c1OC(F)F ZINC000660033174 1041588197 /nfs/dbraw/zinc/58/81/97/1041588197.db2.gz YYKMLOQKSQEJJF-AWEZNQCLSA-N 1 2 310.319 4.092 20 0 DIADLO c1csc([C@H](Cc2ccccc2)Nc2ccn3cc[nH+]c3c2)n1 ZINC001170659296 1041590975 /nfs/dbraw/zinc/59/09/75/1041590975.db2.gz JNRZWOZJMSAGCY-INIZCTEOSA-N 1 2 320.421 4.187 20 0 DIADLO CC[C@](C)([NH2+]Cc1nsc2ccccc12)c1nc(C)cs1 ZINC000660094382 1041610873 /nfs/dbraw/zinc/61/08/73/1041610873.db2.gz YJFMKBYJRJXRLJ-INIZCTEOSA-N 1 2 317.483 4.476 20 0 DIADLO FC(F)(F)c1cc(Cl)ccc1C[N@@H+]1CCC[C@@]2(CCO2)C1 ZINC001143506101 1041620054 /nfs/dbraw/zinc/62/00/54/1041620054.db2.gz YBGGMMJVURKBDO-CQSZACIVSA-N 1 2 319.754 4.114 20 0 DIADLO FC(F)(F)c1cc(Cl)ccc1C[N@H+]1CCC[C@@]2(CCO2)C1 ZINC001143506101 1041620057 /nfs/dbraw/zinc/62/00/57/1041620057.db2.gz YBGGMMJVURKBDO-CQSZACIVSA-N 1 2 319.754 4.114 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@@H+]2CCC[C@H]2c2cccnc2)c1 ZINC000660137693 1041628866 /nfs/dbraw/zinc/62/88/66/1041628866.db2.gz MLTCAPVLMVJIEU-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@H+]2CCC[C@H]2c2cccnc2)c1 ZINC000660137693 1041628870 /nfs/dbraw/zinc/62/88/70/1041628870.db2.gz MLTCAPVLMVJIEU-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nnc(C(F)(F)F)s1)c1ccccc1 ZINC000660175938 1041649084 /nfs/dbraw/zinc/64/90/84/1041649084.db2.gz VRNHROMWRODMOT-LLVKDONJSA-N 1 2 315.364 4.188 20 0 DIADLO CC[C@H]([NH2+]Cc1ncsc1Br)c1ccccc1 ZINC000660177037 1041649096 /nfs/dbraw/zinc/64/90/96/1041649096.db2.gz BSCQAKRIGIQOQA-NSHDSACASA-N 1 2 311.248 4.147 20 0 DIADLO Cc1nc(C[NH2+]C(C)(c2ccccc2)c2ccccc2)c(C)o1 ZINC000660195274 1041661320 /nfs/dbraw/zinc/66/13/20/1041661320.db2.gz UHSKMSNDYSZOFO-UHFFFAOYSA-N 1 2 306.409 4.345 20 0 DIADLO CC(C)c1nsc(C[NH2+]C2(c3cccc(Cl)c3)CCC2)n1 ZINC000930823805 1041666898 /nfs/dbraw/zinc/66/68/98/1041666898.db2.gz VRXRUANVYHZZME-UHFFFAOYSA-N 1 2 321.877 4.484 20 0 DIADLO CSc1cccc(C[NH2+][C@H](c2nc(C3CC3)no2)C(C)C)c1 ZINC000660207223 1041669181 /nfs/dbraw/zinc/66/91/81/1041669181.db2.gz BGEPZLHIGLLXTJ-HNNXBMFYSA-N 1 2 317.458 4.156 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2nsc3ccccc23)C2CC2)n1 ZINC000660215873 1041672983 /nfs/dbraw/zinc/67/29/83/1041672983.db2.gz XHLGXHVCLZQQQR-HNNXBMFYSA-N 1 2 315.467 4.302 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)CCCc1csc2ccccc12 ZINC001133682370 1041690132 /nfs/dbraw/zinc/69/01/32/1041690132.db2.gz VSLBGQZCABQZMV-UHFFFAOYSA-N 1 2 324.449 4.296 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(F)ccc1OC(F)F)c1nccs1 ZINC000660253782 1041691797 /nfs/dbraw/zinc/69/17/97/1041691797.db2.gz LIOHGGHOLCMMOL-NSHDSACASA-N 1 2 316.348 4.125 20 0 DIADLO COc1cccc(C[NH2+]C(C)(C)c2ncc(C)s2)c1Cl ZINC000660262837 1041695051 /nfs/dbraw/zinc/69/50/51/1041695051.db2.gz KHKNAYGUMNBIPJ-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2cccc(F)c2OC(F)F)n1 ZINC000660266451 1041697774 /nfs/dbraw/zinc/69/77/74/1041697774.db2.gz QVNOQHGSXQKFPP-VIFPVBQESA-N 1 2 316.348 4.043 20 0 DIADLO Clc1scc(C[NH2+][C@@H]2COCc3ccccc32)c1Cl ZINC000418099588 1041725230 /nfs/dbraw/zinc/72/52/30/1041725230.db2.gz CCTOHCFYXGMDOW-GFCCVEGCSA-N 1 2 314.237 4.416 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc(Br)cc1 ZINC000397935064 1041738916 /nfs/dbraw/zinc/73/89/16/1041738916.db2.gz DEPBDPIPGRWTAL-BXKDBHETSA-N 1 2 304.178 4.288 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccccc1)[C@@H](O)c1ccccc1)c1cscn1 ZINC000813874650 1041740382 /nfs/dbraw/zinc/74/03/82/1041740382.db2.gz HLXVHUVKZKIMTC-ZMYBRWDISA-N 1 2 324.449 4.269 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1cccc(Br)c1 ZINC000397955186 1041740726 /nfs/dbraw/zinc/74/07/26/1041740726.db2.gz MPNJWRCTZDZINH-BXKDBHETSA-N 1 2 304.178 4.288 20 0 DIADLO CCc1onc(C)c1C[NH2+]C(C)(C)c1nc2ccccc2s1 ZINC000931165911 1041746033 /nfs/dbraw/zinc/74/60/33/1041746033.db2.gz SOZMRJAHXCZPDC-UHFFFAOYSA-N 1 2 315.442 4.180 20 0 DIADLO Cc1nc2cc(CNc3nc(C(C)(C)C)[nH+]c(C)c3C)ccc2o1 ZINC001167757317 1041761334 /nfs/dbraw/zinc/76/13/34/1041761334.db2.gz ROIPWUJRFSWBQC-UHFFFAOYSA-N 1 2 324.428 4.453 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2ccccc2C(F)(F)F)c1 ZINC000652068875 1041773447 /nfs/dbraw/zinc/77/34/47/1041773447.db2.gz RDRABBSQIUEDFT-LLVKDONJSA-N 1 2 310.319 4.420 20 0 DIADLO COCc1ccccc1/C=C(/C)CNc1ccc([NH+](C)C)cc1 ZINC000814292758 1041804668 /nfs/dbraw/zinc/80/46/68/1041804668.db2.gz LHAAAOMUAKCYEG-SSZFMOIBSA-N 1 2 310.441 4.414 20 0 DIADLO C[N@H+](Cc1cc(-c2ccccc2)no1)Cc1ccc(F)cc1F ZINC000043630308 1041837836 /nfs/dbraw/zinc/83/78/36/1041837836.db2.gz DOUMQLMTKBZSOX-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccccc2)no1)Cc1ccc(F)cc1F ZINC000043630308 1041837846 /nfs/dbraw/zinc/83/78/46/1041837846.db2.gz DOUMQLMTKBZSOX-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO Cc1ccccc1-n1cnn(C[N@@H+](C)[C@@H](C)C(C)(C)C)c1=S ZINC000026630242 1041842049 /nfs/dbraw/zinc/84/20/49/1041842049.db2.gz QUBNZXFPIUXNRI-AWEZNQCLSA-N 1 2 318.490 4.036 20 0 DIADLO Cc1ccccc1-n1cnn(C[N@H+](C)[C@@H](C)C(C)(C)C)c1=S ZINC000026630242 1041842057 /nfs/dbraw/zinc/84/20/57/1041842057.db2.gz QUBNZXFPIUXNRI-AWEZNQCLSA-N 1 2 318.490 4.036 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(C=Cc2ccccc2)[nH]c1=S ZINC000026636475 1041843533 /nfs/dbraw/zinc/84/35/33/1041843533.db2.gz BGMDCRWSJGOWSG-VAWYXSNFSA-N 1 2 316.474 4.191 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(C=Cc2ccccc2)[nH]c1=S ZINC000026636475 1041843537 /nfs/dbraw/zinc/84/35/37/1041843537.db2.gz BGMDCRWSJGOWSG-VAWYXSNFSA-N 1 2 316.474 4.191 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)CC2 ZINC000429808330 1041850731 /nfs/dbraw/zinc/85/07/31/1041850731.db2.gz MBADOUVLXZKVBE-CQSZACIVSA-N 1 2 313.269 4.159 20 0 DIADLO CCc1nocc1C[N@H+](Cc1ccccn1)Cc1ccccc1C ZINC000660679193 1041850765 /nfs/dbraw/zinc/85/07/65/1041850765.db2.gz IMDQQIAONMQCAO-UHFFFAOYSA-N 1 2 321.424 4.143 20 0 DIADLO CCc1nocc1C[N@@H+](Cc1ccccn1)Cc1ccccc1C ZINC000660679193 1041850771 /nfs/dbraw/zinc/85/07/71/1041850771.db2.gz IMDQQIAONMQCAO-UHFFFAOYSA-N 1 2 321.424 4.143 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2nc3cc(Cl)ccc3[nH]2)cn1 ZINC000660708909 1041854515 /nfs/dbraw/zinc/85/45/15/1041854515.db2.gz XGNAWAAHAWHKPF-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)c2nc3cc(Cl)ccc3[nH]2)cn1 ZINC000660708909 1041854519 /nfs/dbraw/zinc/85/45/19/1041854519.db2.gz XGNAWAAHAWHKPF-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO CCCC[C@H](CC)C[N@H+](C)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660764374 1041861007 /nfs/dbraw/zinc/86/10/07/1041861007.db2.gz OBKYMFMVARUXDC-RDJZCZTQSA-N 1 2 300.450 4.042 20 0 DIADLO CCCC[C@H](CC)C[N@@H+](C)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660764374 1041861011 /nfs/dbraw/zinc/86/10/11/1041861011.db2.gz OBKYMFMVARUXDC-RDJZCZTQSA-N 1 2 300.450 4.042 20 0 DIADLO CCO[C@H](C)c1noc(C[N@H+](Cc2ccsc2)C(C)(C)C)n1 ZINC000661136215 1041893417 /nfs/dbraw/zinc/89/34/17/1041893417.db2.gz OUCMEJWBDRDGLI-GFCCVEGCSA-N 1 2 323.462 4.029 20 0 DIADLO CCO[C@H](C)c1noc(C[N@@H+](Cc2ccsc2)C(C)(C)C)n1 ZINC000661136215 1041893425 /nfs/dbraw/zinc/89/34/25/1041893425.db2.gz OUCMEJWBDRDGLI-GFCCVEGCSA-N 1 2 323.462 4.029 20 0 DIADLO C[C@@H](c1noc(-c2ccccc2)n1)[NH+]1CCC(c2ccco2)CC1 ZINC000661161766 1041897309 /nfs/dbraw/zinc/89/73/09/1041897309.db2.gz XWVYZSLXWRFOLL-AWEZNQCLSA-N 1 2 323.396 4.270 20 0 DIADLO O=C(C[N@H+](Cc1cccs1)C1CC1)Nc1cccc(Cl)c1 ZINC000044898023 1041904609 /nfs/dbraw/zinc/90/46/09/1041904609.db2.gz YITIVBUMRTUFDD-UHFFFAOYSA-N 1 2 320.845 4.005 20 0 DIADLO O=C(C[N@@H+](Cc1cccs1)C1CC1)Nc1cccc(Cl)c1 ZINC000044898023 1041904612 /nfs/dbraw/zinc/90/46/12/1041904612.db2.gz YITIVBUMRTUFDD-UHFFFAOYSA-N 1 2 320.845 4.005 20 0 DIADLO O[C@@H](C[N@H+](CC(F)F)CC1CCC1)c1cccc2ccccc21 ZINC000815078145 1041911003 /nfs/dbraw/zinc/91/10/03/1041911003.db2.gz PICZZWROFDLCCH-SFHVURJKSA-N 1 2 319.395 4.240 20 0 DIADLO O[C@@H](C[N@@H+](CC(F)F)CC1CCC1)c1cccc2ccccc21 ZINC000815078145 1041911008 /nfs/dbraw/zinc/91/10/08/1041911008.db2.gz PICZZWROFDLCCH-SFHVURJKSA-N 1 2 319.395 4.240 20 0 DIADLO COc1ccc(F)c(CNc2ccc([NH+]3CCCC3)cc2)c1 ZINC000815117044 1041914580 /nfs/dbraw/zinc/91/45/80/1041914580.db2.gz GZXSJFDOGQZVLH-UHFFFAOYSA-N 1 2 300.377 4.047 20 0 DIADLO CCCOc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1F ZINC001211665652 1041915594 /nfs/dbraw/zinc/91/55/94/1041915594.db2.gz DXCWBZHBUYBRTP-UHFFFAOYSA-N 1 2 315.392 4.353 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@H](C)c2nc3ccccc3s2)c1 ZINC000815124693 1041916584 /nfs/dbraw/zinc/91/65/84/1041916584.db2.gz IDSPHZLGGHTIKQ-LLVKDONJSA-N 1 2 316.401 4.295 20 0 DIADLO CC(C)Oc1ccccc1C[NH2+]Cc1c(F)cc(F)cc1F ZINC000815151475 1041920040 /nfs/dbraw/zinc/92/00/40/1041920040.db2.gz GATJLNHIJDPLOG-UHFFFAOYSA-N 1 2 309.331 4.181 20 0 DIADLO Cc1cc([NH+](C)C)cc(C)c1NCc1cccc(O)c1Cl ZINC000815134373 1041923676 /nfs/dbraw/zinc/92/36/76/1041923676.db2.gz VNSXVVKGROMAEP-UHFFFAOYSA-N 1 2 304.821 4.341 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2)cn1 ZINC000651822515 1041923787 /nfs/dbraw/zinc/92/37/87/1041923787.db2.gz AAOYZPMNMALXIH-JKSUJKDBSA-N 1 2 320.440 4.377 20 0 DIADLO Cc1cc(NCc2conc2Cc2ccccc2)ccc1[NH+](C)C ZINC000815131338 1041924146 /nfs/dbraw/zinc/92/41/46/1041924146.db2.gz XNDDNBFFGITKPS-UHFFFAOYSA-N 1 2 321.424 4.252 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nccn2CCCc2ccccc2)o1 ZINC000164362023 1041935001 /nfs/dbraw/zinc/93/50/01/1041935001.db2.gz YNUGEKREOMDAHL-QGZVFWFLSA-N 1 2 323.440 4.268 20 0 DIADLO C[C@H]([NH2+]Cc1c[nH]cn1)c1ccc(O[C@@H](C)c2ccccc2)cc1 ZINC000661460025 1041940368 /nfs/dbraw/zinc/94/03/68/1041940368.db2.gz XMXNXWUBJZRRJL-HOTGVXAUSA-N 1 2 321.424 4.401 20 0 DIADLO Cc1nnc(C[N@@H+](C)[C@H](C)c2ccc(Oc3ccccc3)cc2)o1 ZINC000661529161 1041949319 /nfs/dbraw/zinc/94/93/19/1041949319.db2.gz PLNIHNHMRUMCEL-CQSZACIVSA-N 1 2 323.396 4.363 20 0 DIADLO Cc1nnc(C[N@H+](C)[C@H](C)c2ccc(Oc3ccccc3)cc2)o1 ZINC000661529161 1041949326 /nfs/dbraw/zinc/94/93/26/1041949326.db2.gz PLNIHNHMRUMCEL-CQSZACIVSA-N 1 2 323.396 4.363 20 0 DIADLO Cc1nc2scc(C3CC3)n2c1CNc1cc(C)c[nH+]c1C ZINC000651924275 1041955291 /nfs/dbraw/zinc/95/52/91/1041955291.db2.gz AJAIDPTYAXFTEN-UHFFFAOYSA-N 1 2 312.442 4.206 20 0 DIADLO CC(C)CCCCCC[NH2+][C@@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000815552963 1041961715 /nfs/dbraw/zinc/96/17/15/1041961715.db2.gz OHHNXYSXJAPATJ-QGZVFWFLSA-N 1 2 318.440 4.229 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CC(C)(C)Oc3ccc(F)cc32)cs1 ZINC000651949614 1041965785 /nfs/dbraw/zinc/96/57/85/1041965785.db2.gz PMOGROBNGKIONO-CQSZACIVSA-N 1 2 320.433 4.237 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2nc(Cc3ccccc3)no2)cc1 ZINC000047965370 1041976231 /nfs/dbraw/zinc/97/62/31/1041976231.db2.gz DIWDADDOTSERSY-INIZCTEOSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2nc(Cc3ccccc3)no2)cc1 ZINC000047965370 1041976238 /nfs/dbraw/zinc/97/62/38/1041976238.db2.gz DIWDADDOTSERSY-INIZCTEOSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N[C@@H](CCC(C)C)C(C)(C)C)ccn12 ZINC001126138627 1041989539 /nfs/dbraw/zinc/98/95/39/1041989539.db2.gz GWVUUFKTVAFDIS-INIZCTEOSA-N 1 2 315.461 4.223 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1cc2ccccc2nc1Cl ZINC000313918185 1041994417 /nfs/dbraw/zinc/99/44/17/1041994417.db2.gz VWJLIGUXSJVHRU-UHFFFAOYSA-N 1 2 300.789 4.422 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1cc2ccccc2nc1Cl ZINC000313918185 1041994419 /nfs/dbraw/zinc/99/44/19/1041994419.db2.gz VWJLIGUXSJVHRU-UHFFFAOYSA-N 1 2 300.789 4.422 20 0 DIADLO Cc1cc([C@H](C)[NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)no1 ZINC000652329161 1042008529 /nfs/dbraw/zinc/00/85/29/1042008529.db2.gz LSMABEJUYSCLIR-NSHDSACASA-N 1 2 310.319 4.342 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CCCOc3c(C)cc(C)cc32)c1 ZINC000652330293 1042009420 /nfs/dbraw/zinc/00/94/20/1042009420.db2.gz BWOQFJPTUDMKAA-KRWDZBQOSA-N 1 2 312.413 4.171 20 0 DIADLO CC[C@H](Nc1cc(COC)cc[nH+]1)c1ccccc1OC(F)F ZINC000652330446 1042009740 /nfs/dbraw/zinc/00/97/40/1042009740.db2.gz GJMARVAPJVFMNI-AWEZNQCLSA-N 1 2 322.355 4.393 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CC(C)(C)c3cc(OC)ccc32)c1 ZINC000652331098 1042010849 /nfs/dbraw/zinc/01/08/49/1042010849.db2.gz YBWNVVQUKVNZQL-KRWDZBQOSA-N 1 2 312.413 4.071 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CC(C)(C)c3cc(OC)ccc32)c1 ZINC000652331099 1042010875 /nfs/dbraw/zinc/01/08/75/1042010875.db2.gz YBWNVVQUKVNZQL-QGZVFWFLSA-N 1 2 312.413 4.071 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CCCOc3cc(C)c(C)cc32)c1 ZINC000652330967 1042011127 /nfs/dbraw/zinc/01/11/27/1042011127.db2.gz UFTLGNQWWCNGDF-QGZVFWFLSA-N 1 2 312.413 4.171 20 0 DIADLO CC[N@H+](Cn1nc(NC(C)C)sc1=S)C1CCCCC1 ZINC000027197605 1042029233 /nfs/dbraw/zinc/02/92/33/1042029233.db2.gz PMQLNRRIEQKWLX-UHFFFAOYSA-N 1 2 314.524 4.106 20 0 DIADLO CC[N@@H+](Cn1nc(NC(C)C)sc1=S)C1CCCCC1 ZINC000027197605 1042029239 /nfs/dbraw/zinc/02/92/39/1042029239.db2.gz PMQLNRRIEQKWLX-UHFFFAOYSA-N 1 2 314.524 4.106 20 0 DIADLO Clc1cnc(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c(Cl)c1 ZINC000662065513 1042054909 /nfs/dbraw/zinc/05/49/09/1042054909.db2.gz QSDWHYKUDHRJTJ-CQSZACIVSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cnc(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c(Cl)c1 ZINC000662065513 1042054912 /nfs/dbraw/zinc/05/49/12/1042054912.db2.gz QSDWHYKUDHRJTJ-CQSZACIVSA-N 1 2 323.223 4.042 20 0 DIADLO Cn1ncc(C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)c1Cl ZINC000816484183 1042056049 /nfs/dbraw/zinc/05/60/49/1042056049.db2.gz RUCQFFYGNLTCDE-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1ncc(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)c1Cl ZINC000816484183 1042056053 /nfs/dbraw/zinc/05/60/53/1042056053.db2.gz RUCQFFYGNLTCDE-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO CC(C)[N@H+](Cc1cnn(C)c1Cl)Cc1cccc(Cl)c1 ZINC000816487686 1042057318 /nfs/dbraw/zinc/05/73/18/1042057318.db2.gz VAMQZAMMXSIGOZ-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO CC(C)[N@@H+](Cc1cnn(C)c1Cl)Cc1cccc(Cl)c1 ZINC000816487686 1042057329 /nfs/dbraw/zinc/05/73/29/1042057329.db2.gz VAMQZAMMXSIGOZ-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+]1CC[C@@H]1c1ccc(Br)cc1 ZINC000662098058 1042064492 /nfs/dbraw/zinc/06/44/92/1042064492.db2.gz DTUHADYBHCPOPE-MLGOLLRUSA-N 1 2 317.230 4.352 20 0 DIADLO C[C@H](c1ccncc1)[N@H+]1CC[C@@H]1c1ccc(Br)cc1 ZINC000662098058 1042064495 /nfs/dbraw/zinc/06/44/95/1042064495.db2.gz DTUHADYBHCPOPE-MLGOLLRUSA-N 1 2 317.230 4.352 20 0 DIADLO Cc1cc([NH2+][C@H]2CC=C(C)CC2)ccc1N1CCSCC1 ZINC000816526025 1042066370 /nfs/dbraw/zinc/06/63/70/1042066370.db2.gz QQLXMZVJNJOJLX-INIZCTEOSA-N 1 2 302.487 4.459 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc(Cl)cc3)CCCCCC2)no1 ZINC000063512352 1042071020 /nfs/dbraw/zinc/07/10/20/1042071020.db2.gz DRXOEWLTSZEZFC-UHFFFAOYSA-N 1 2 319.836 4.371 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@H+](Cc2nc3ccccc3s2)C1 ZINC000058888864 1042071822 /nfs/dbraw/zinc/07/18/22/1042071822.db2.gz VZCGNJKVBTWYBH-SNVBAGLBSA-N 1 2 300.349 4.071 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2nc3ccccc3s2)C1 ZINC000058888864 1042071826 /nfs/dbraw/zinc/07/18/26/1042071826.db2.gz VZCGNJKVBTWYBH-SNVBAGLBSA-N 1 2 300.349 4.071 20 0 DIADLO C[C@H]([NH2+][C@@H](CO)c1ccc(F)cc1F)c1ccccc1Cl ZINC000662163054 1042076418 /nfs/dbraw/zinc/07/64/18/1042076418.db2.gz UMCFZOTYDLMSMY-QFYYESIMSA-N 1 2 311.759 4.002 20 0 DIADLO Clc1cccc(Cl)c1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001245673878 1042078842 /nfs/dbraw/zinc/07/88/42/1042078842.db2.gz RCGMUFKFTFBYQW-UHFFFAOYSA-N 1 2 304.180 4.300 20 0 DIADLO CCCCC[C@@H](C)NC(=O)C[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000816840029 1042084124 /nfs/dbraw/zinc/08/41/24/1042084124.db2.gz XSDYJNXDXNYPCC-NVXWUHKLSA-N 1 2 313.445 4.017 20 0 DIADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccc(Oc2cccc(C)c2)cc1 ZINC001135729560 1042086977 /nfs/dbraw/zinc/08/69/77/1042086977.db2.gz MAACEQMCDTYPHR-UHFFFAOYSA-N 1 2 321.380 4.000 20 0 DIADLO Cc1cc(CNc2ccc(C(F)(F)F)c(Cl)n2)cc(C)[nH+]1 ZINC000817123007 1042096222 /nfs/dbraw/zinc/09/62/22/1042096222.db2.gz BQACEWLXJUXBSD-UHFFFAOYSA-N 1 2 315.726 4.378 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H](C)c2csc3ccccc32)nn1C ZINC000817407534 1042107115 /nfs/dbraw/zinc/10/71/15/1042107115.db2.gz SGACXUJYUYJIAF-JTQLQIEISA-N 1 2 319.861 4.447 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CC[C@H]4C[C@H]4C3)c2)[nH+]c1C ZINC000817522434 1042111870 /nfs/dbraw/zinc/11/18/70/1042111870.db2.gz IDXTUZTWSUQQAI-IMJJTQAJSA-N 1 2 309.413 4.068 20 0 DIADLO CC(C)c1cccc(C[NH2+]Cc2cc(COC(C)(C)C)on2)c1 ZINC000663321540 1042113600 /nfs/dbraw/zinc/11/36/00/1042113600.db2.gz DWIXFUMMIXEVHF-UHFFFAOYSA-N 1 2 316.445 4.403 20 0 DIADLO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cc1ncsc1Br ZINC001167798588 1042117468 /nfs/dbraw/zinc/11/74/68/1042117468.db2.gz NLEDIZIETMHCTI-ZYHUDNBSSA-N 1 2 317.296 4.306 20 0 DIADLO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1ncsc1Br ZINC001167798588 1042117472 /nfs/dbraw/zinc/11/74/72/1042117472.db2.gz NLEDIZIETMHCTI-ZYHUDNBSSA-N 1 2 317.296 4.306 20 0 DIADLO CC(C)Cc1ncc(CNc2ccc(-n3cc[nH+]c3)cc2)s1 ZINC000162121898 1042121878 /nfs/dbraw/zinc/12/18/78/1042121878.db2.gz ORPWVRRNJPDMOV-UHFFFAOYSA-N 1 2 312.442 4.139 20 0 DIADLO Cc1nc(C[NH+](Cc2ccccc2)Cc2ccccc2)oc1C ZINC000064030380 1042123201 /nfs/dbraw/zinc/12/32/01/1042123201.db2.gz QVGSDIPBBSQBRJ-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2cc(F)c(F)c(F)c2)n1 ZINC000162346931 1042125243 /nfs/dbraw/zinc/12/52/43/1042125243.db2.gz UIIAGCZPLHDSQU-DTWKUNHWSA-N 1 2 300.349 4.281 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1nc(Br)cs1 ZINC000817950364 1042130675 /nfs/dbraw/zinc/13/06/75/1042130675.db2.gz URFMTSXVFXUGPB-MRVPVSSYSA-N 1 2 324.247 4.047 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2cc3ccccc3o2)cs1 ZINC000165275644 1042136569 /nfs/dbraw/zinc/13/65/69/1042136569.db2.gz ADFJITZYKXXNBN-RYUDHWBXSA-N 1 2 316.426 4.448 20 0 DIADLO FC(F)(F)c1nn(CC[C@@H]2CC2(Cl)Cl)c2cc[nH+]cc21 ZINC000818079342 1042138030 /nfs/dbraw/zinc/13/80/30/1042138030.db2.gz FPSCPKRRPOJRGD-SSDOTTSWSA-N 1 2 324.133 4.034 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2csc(-c3ccco3)n2)c(C)o1 ZINC000067506481 1042142887 /nfs/dbraw/zinc/14/28/87/1042142887.db2.gz RFWNONGDPVVYAC-LLVKDONJSA-N 1 2 302.399 4.464 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc2c(c1)OC1(CCCC1)O2 ZINC000818194928 1042143115 /nfs/dbraw/zinc/14/31/15/1042143115.db2.gz SIOFPBZAHPBAJS-UHFFFAOYSA-N 1 2 313.401 4.118 20 0 DIADLO CC(=O)c1cc(F)ccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000818320276 1042147733 /nfs/dbraw/zinc/14/77/33/1042147733.db2.gz PWCFIUVHQLEJCT-UHFFFAOYSA-N 1 2 313.376 4.157 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C=Cc3ccc(Cl)cc3)cc2[nH+]1 ZINC000819627943 1042191066 /nfs/dbraw/zinc/19/10/66/1042191066.db2.gz HPWRDTBBBIJBNP-WTKPLQERSA-N 1 2 311.772 4.177 20 0 DIADLO CC[C@H]1C[N@H+](Cc2nc3ccccc3c(C)c2Cl)C[C@H](C)O1 ZINC000303429498 1042203692 /nfs/dbraw/zinc/20/36/92/1042203692.db2.gz BQDGYIVWJFSUJM-JSGCOSHPSA-N 1 2 318.848 4.196 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2nc3ccccc3c(C)c2Cl)C[C@H](C)O1 ZINC000303429498 1042203699 /nfs/dbraw/zinc/20/36/99/1042203699.db2.gz BQDGYIVWJFSUJM-JSGCOSHPSA-N 1 2 318.848 4.196 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2ccc(-c3ccccc3)o2)c(C)[nH+]1 ZINC001136325300 1042210885 /nfs/dbraw/zinc/21/08/85/1042210885.db2.gz PJMJMVXAUXGYSW-UHFFFAOYSA-N 1 2 320.392 4.197 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cc(Cl)nc(Cl)c2)C1 ZINC000805750825 1042220929 /nfs/dbraw/zinc/22/09/29/1042220929.db2.gz VPFLWCASAVWAOU-FZMZJTMJSA-N 1 2 322.239 4.367 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(Cl)nc(Cl)c2)C1 ZINC000805750825 1042220930 /nfs/dbraw/zinc/22/09/30/1042220930.db2.gz VPFLWCASAVWAOU-FZMZJTMJSA-N 1 2 322.239 4.367 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H]2CCc3ccc(Cl)nc32)cs1 ZINC000820810129 1042229580 /nfs/dbraw/zinc/22/95/80/1042229580.db2.gz PMOKIDVMCCNIAY-GXSJLCMTSA-N 1 2 307.850 4.092 20 0 DIADLO COc1cc(C[NH2+][C@@H](CF)c2ccc(F)cc2)ccc1Cl ZINC000631282797 1042247677 /nfs/dbraw/zinc/24/76/77/1042247677.db2.gz DEQYXWSQGSXMSE-HNNXBMFYSA-N 1 2 311.759 4.288 20 0 DIADLO Cc1cccc(C[N@@H+](C)[C@H](C)c2ncc(-c3ccccc3)o2)n1 ZINC000348554230 1042258826 /nfs/dbraw/zinc/25/88/26/1042258826.db2.gz PXVDGLORDDLKBW-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1cccc(C[N@H+](C)[C@H](C)c2ncc(-c3ccccc3)o2)n1 ZINC000348554230 1042258829 /nfs/dbraw/zinc/25/88/29/1042258829.db2.gz PXVDGLORDDLKBW-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC[C@@]3(CCO3)C2)ccc1Cl ZINC001138051751 1042276987 /nfs/dbraw/zinc/27/69/87/1042276987.db2.gz LZHKVGVJDMGRDP-CQSZACIVSA-N 1 2 319.754 4.114 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC[C@@]3(CCO3)C2)ccc1Cl ZINC001138051751 1042276988 /nfs/dbraw/zinc/27/69/88/1042276988.db2.gz LZHKVGVJDMGRDP-CQSZACIVSA-N 1 2 319.754 4.114 20 0 DIADLO CC(C)COC(=O)C[N@@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC001170981435 1042277846 /nfs/dbraw/zinc/27/78/46/1042277846.db2.gz RUDYNDRKRSCHEB-IBGZPJMESA-N 1 2 315.457 4.193 20 0 DIADLO CC(C)COC(=O)C[N@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC001170981435 1042277849 /nfs/dbraw/zinc/27/78/49/1042277849.db2.gz RUDYNDRKRSCHEB-IBGZPJMESA-N 1 2 315.457 4.193 20 0 DIADLO Cn1c(Cl)cnc1C[N@@H+]1CC(C)(C)C[C@@H]1c1ccccc1 ZINC000822525379 1042288765 /nfs/dbraw/zinc/28/87/65/1042288765.db2.gz FUKCHLSMUPOQTL-CQSZACIVSA-N 1 2 303.837 4.047 20 0 DIADLO Cn1c(Cl)cnc1C[N@H+]1CC(C)(C)C[C@@H]1c1ccccc1 ZINC000822525379 1042288769 /nfs/dbraw/zinc/28/87/69/1042288769.db2.gz FUKCHLSMUPOQTL-CQSZACIVSA-N 1 2 303.837 4.047 20 0 DIADLO CSc1ccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000162733814 1042295554 /nfs/dbraw/zinc/29/55/54/1042295554.db2.gz FVXUFETWSVSLRB-UHFFFAOYSA-N 1 2 309.394 4.051 20 0 DIADLO Cc1cc(NC(=O)c2c(C)cc(F)cc2C)ccc1-n1cc[nH+]c1 ZINC001136625774 1042301341 /nfs/dbraw/zinc/30/13/41/1042301341.db2.gz YFBFRXSKXJZBOE-UHFFFAOYSA-N 1 2 323.371 4.189 20 0 DIADLO COc1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c(OC)c1 ZINC000061556099 1042310745 /nfs/dbraw/zinc/31/07/45/1042310745.db2.gz PNFSDNFLJVWSLM-HXUWFJFHSA-N 1 2 323.392 4.176 20 0 DIADLO Cc1cc(SC(C)(C)C)ccc1NC(=O)CCc1[nH]cc[nH+]1 ZINC000279332910 1042311949 /nfs/dbraw/zinc/31/19/49/1042311949.db2.gz CVUQATYBOQYNRO-UHFFFAOYSA-N 1 2 317.458 4.180 20 0 DIADLO Cc1cncc([C@@H](C)[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000279479297 1042318827 /nfs/dbraw/zinc/31/88/27/1042318827.db2.gz KPQPBTQUUQFMMI-NXEZZACHSA-N 1 2 315.364 4.277 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1ccccc1C(F)F ZINC001139795898 1042354676 /nfs/dbraw/zinc/35/46/76/1042354676.db2.gz QPMBLCGAHIRJNN-UHFFFAOYSA-N 1 2 302.777 4.366 20 0 DIADLO CNc1ccc(NCc2cc(-c3cccc(Cl)c3)no2)c[nH+]1 ZINC001171018590 1042328430 /nfs/dbraw/zinc/32/84/30/1042328430.db2.gz ADQCGTCZXLCYTK-UHFFFAOYSA-N 1 2 314.776 4.044 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)o1 ZINC000112543387 1042341561 /nfs/dbraw/zinc/34/15/61/1042341561.db2.gz MQKYMJOSHQYGRD-NWDGAFQWSA-N 1 2 305.447 4.290 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1ccccc1C(F)F ZINC001139795898 1042354673 /nfs/dbraw/zinc/35/46/73/1042354673.db2.gz QPMBLCGAHIRJNN-UHFFFAOYSA-N 1 2 302.777 4.366 20 0 DIADLO FC(F)Oc1cccc(NCc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000124658600 1042357376 /nfs/dbraw/zinc/35/73/76/1042357376.db2.gz JWUKDPJJIHRARK-UHFFFAOYSA-N 1 2 315.323 4.086 20 0 DIADLO CCCC[C@@H](CC)CC[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000437986083 1042359995 /nfs/dbraw/zinc/35/99/95/1042359995.db2.gz KHZBZHSQXDDWKD-WBVHZDCISA-N 1 2 300.450 4.090 20 0 DIADLO FC(F)(F)c1nn(C[C@H]2CCCCC2(F)F)c2cc[nH+]cc21 ZINC000418941022 1042365905 /nfs/dbraw/zinc/36/59/05/1042365905.db2.gz UPJHKMIPSMRTKQ-SECBINFHSA-N 1 2 319.277 4.276 20 0 DIADLO Fc1ccccc1C1([NH2+][C@H]2CCc3c2nccc3Cl)CC1 ZINC000925883275 1042373963 /nfs/dbraw/zinc/37/39/63/1042373963.db2.gz IGSOUFWJRPCVMW-HNNXBMFYSA-N 1 2 302.780 4.140 20 0 DIADLO C[C@@H](CF)[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000644892721 1042374634 /nfs/dbraw/zinc/37/46/34/1042374634.db2.gz IXASRIISJGLUTM-VIFPVBQESA-N 1 2 318.339 4.277 20 0 DIADLO CCc1ccc([C@H](C)Nc2ccc(N3CCCC3)[nH+]c2)s1 ZINC000041203913 1042392763 /nfs/dbraw/zinc/39/27/63/1042392763.db2.gz CCGVTYXLEFRXHG-ZDUSSCGKSA-N 1 2 301.459 4.479 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)n1 ZINC000893940285 1042397073 /nfs/dbraw/zinc/39/70/73/1042397073.db2.gz HFPWSILOWHDWFV-SNVBAGLBSA-N 1 2 304.356 4.135 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)n1 ZINC000893940285 1042397077 /nfs/dbraw/zinc/39/70/77/1042397077.db2.gz HFPWSILOWHDWFV-SNVBAGLBSA-N 1 2 304.356 4.135 20 0 DIADLO Cc1nc(C(C)C)oc1CNc1cc(C)[nH+]c(C2CCC2)n1 ZINC000893944519 1042398010 /nfs/dbraw/zinc/39/80/10/1042398010.db2.gz NQBCXYXOCAOMDM-UHFFFAOYSA-N 1 2 300.406 4.084 20 0 DIADLO COc1c(F)cc(F)cc1C[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC001143551880 1042407554 /nfs/dbraw/zinc/40/75/54/1042407554.db2.gz LZZQBQJPPZGJIG-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(F)cc(F)cc1C[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC001143551880 1042407556 /nfs/dbraw/zinc/40/75/56/1042407556.db2.gz LZZQBQJPPZGJIG-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO CC(C)c1cc(N[C@H](C)c2cncc(F)c2)nc(C(C)C)[nH+]1 ZINC000663998304 1042438747 /nfs/dbraw/zinc/43/87/47/1042438747.db2.gz JXKVPCOSVZDSJQ-GFCCVEGCSA-N 1 2 302.397 4.431 20 0 DIADLO CCCN(CCC)C(=O)c1ccc(Nc2cccc(C)[nH+]2)cc1 ZINC001211760506 1042440303 /nfs/dbraw/zinc/44/03/03/1042440303.db2.gz IRPOMNHVYOUPKK-UHFFFAOYSA-N 1 2 311.429 4.396 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2cc(OC(F)F)ccc21)c1ncco1 ZINC000924872999 1042445665 /nfs/dbraw/zinc/44/56/65/1042445665.db2.gz UDCVEYBECNLZQC-IINYFYTJSA-N 1 2 308.328 4.004 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccccc2Oc2ccccc2)[nH]1 ZINC000411447073 1042447059 /nfs/dbraw/zinc/44/70/59/1042447059.db2.gz BJRXQSFERLJLQQ-UONOGXRCSA-N 1 2 322.412 4.317 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@]1(C)CC=C(C)CC1 ZINC000614280670 1042451087 /nfs/dbraw/zinc/45/10/87/1042451087.db2.gz DULKWZVPMOUHKB-LJQANCHMSA-N 1 2 309.413 4.460 20 0 DIADLO CCOc1cc(F)c(F)cc1Nc1cccc2[nH+]c(C)cn21 ZINC001211796680 1042453597 /nfs/dbraw/zinc/45/35/97/1042453597.db2.gz JWEXUZOTYIWJAK-UHFFFAOYSA-N 1 2 303.312 4.063 20 0 DIADLO CCOc1cc(F)c(F)cc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001211800942 1042453907 /nfs/dbraw/zinc/45/39/07/1042453907.db2.gz LLNOZRRKPPGKDM-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO CC[N@H+](Cc1coc(-c2cccc(F)c2)n1)Cc1occc1C ZINC000412048205 1042465118 /nfs/dbraw/zinc/46/51/18/1042465118.db2.gz VYAJWKXRKBRHGG-UHFFFAOYSA-N 1 2 314.360 4.404 20 0 DIADLO CC[N@@H+](Cc1coc(-c2cccc(F)c2)n1)Cc1occc1C ZINC000412048205 1042465120 /nfs/dbraw/zinc/46/51/20/1042465120.db2.gz VYAJWKXRKBRHGG-UHFFFAOYSA-N 1 2 314.360 4.404 20 0 DIADLO Cc1ncoc1C[NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl ZINC000894141292 1042469574 /nfs/dbraw/zinc/46/95/74/1042469574.db2.gz DUROXLWUOYZYSY-ZETCQYMHSA-N 1 2 303.164 4.280 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(Br)cc2)on1 ZINC000052453341 1042481253 /nfs/dbraw/zinc/48/12/53/1042481253.db2.gz MMCJGBJMPDUPFT-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2ccc(Br)cc2)on1 ZINC000052453341 1042481255 /nfs/dbraw/zinc/48/12/55/1042481255.db2.gz MMCJGBJMPDUPFT-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO CCn1c2ccccc2c2cc(C[NH2+]Cc3cocn3)ccc21 ZINC000397956892 1042488240 /nfs/dbraw/zinc/48/82/40/1042488240.db2.gz ZOKCQNHBRQJJES-UHFFFAOYSA-N 1 2 305.381 4.092 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccc(OC(F)(F)F)cc2)cc1 ZINC000237100339 1042524790 /nfs/dbraw/zinc/52/47/90/1042524790.db2.gz ZRSGGOROBWYHNQ-UHFFFAOYSA-N 1 2 310.319 4.263 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000513386812 1042537430 /nfs/dbraw/zinc/53/74/30/1042537430.db2.gz QQMASDXSJDDQQK-UHFFFAOYSA-N 1 2 309.388 4.060 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000513386812 1042537434 /nfs/dbraw/zinc/53/74/34/1042537434.db2.gz QQMASDXSJDDQQK-UHFFFAOYSA-N 1 2 309.388 4.060 20 0 DIADLO Cc1cccc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)c1C ZINC000513441721 1042542329 /nfs/dbraw/zinc/54/23/29/1042542329.db2.gz ABTCKYYLVXHQQW-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)c1C ZINC000513441721 1042542333 /nfs/dbraw/zinc/54/23/33/1042542333.db2.gz ABTCKYYLVXHQQW-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO Cn1ccc(C[N@H+](Cc2ccccc2Cl)C2CCCC2)n1 ZINC000513492032 1042547234 /nfs/dbraw/zinc/54/72/34/1042547234.db2.gz XFFJMPBNGRXTMA-UHFFFAOYSA-N 1 2 303.837 4.018 20 0 DIADLO Cn1ccc(C[N@@H+](Cc2ccccc2Cl)C2CCCC2)n1 ZINC000513492032 1042547237 /nfs/dbraw/zinc/54/72/37/1042547237.db2.gz XFFJMPBNGRXTMA-UHFFFAOYSA-N 1 2 303.837 4.018 20 0 DIADLO C[C@@H]([NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1)c1ccn(C)n1 ZINC000414098788 1042553075 /nfs/dbraw/zinc/55/30/75/1042553075.db2.gz PFSRKGVJPAJWTO-SNVBAGLBSA-N 1 2 310.228 4.067 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000319622992 1042578157 /nfs/dbraw/zinc/57/81/57/1042578157.db2.gz AXALONQUAHIXML-AWEZNQCLSA-N 1 2 313.401 4.451 20 0 DIADLO CCc1ccc(NC(=O)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC000039339013 1042582686 /nfs/dbraw/zinc/58/26/86/1042582686.db2.gz OHSSVSXUIMXTRC-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO Cc1ccc(C[NH2+][C@H](c2c(Cl)cccc2Cl)C2CC2)nn1 ZINC000414453245 1042599636 /nfs/dbraw/zinc/59/96/36/1042599636.db2.gz MVSDGAPKUCSQFZ-INIZCTEOSA-N 1 2 322.239 4.333 20 0 DIADLO Cc1ccc([C@@H]2CCCN2C(=O)NCc2cc(C)[nH+]c(C)c2)cc1 ZINC000420852804 1042613803 /nfs/dbraw/zinc/61/38/03/1042613803.db2.gz SOBHEBPBQJHYDB-IBGZPJMESA-N 1 2 323.440 4.054 20 0 DIADLO FC(F)(F)C[C@H]1CCC[N@H+](Cc2csc(C3CC3)n2)C1 ZINC000420950712 1042616424 /nfs/dbraw/zinc/61/64/24/1042616424.db2.gz QBVXACAXFXOICL-SNVBAGLBSA-N 1 2 304.381 4.185 20 0 DIADLO FC(F)(F)C[C@H]1CCC[N@@H+](Cc2csc(C3CC3)n2)C1 ZINC000420950712 1042616427 /nfs/dbraw/zinc/61/64/27/1042616427.db2.gz QBVXACAXFXOICL-SNVBAGLBSA-N 1 2 304.381 4.185 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)n1 ZINC000420956422 1042617913 /nfs/dbraw/zinc/61/79/13/1042617913.db2.gz YEQWPJDNDJFURZ-NEPJUHHUSA-N 1 2 319.371 4.138 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+]2CCC[C@@H](CC(F)(F)F)C2)n1 ZINC000420956422 1042617915 /nfs/dbraw/zinc/61/79/15/1042617915.db2.gz YEQWPJDNDJFURZ-NEPJUHHUSA-N 1 2 319.371 4.138 20 0 DIADLO CC(C)[N@H+](Cc1nc(C(C)(C)C)no1)[C@H](C)c1ccsc1 ZINC000421008302 1042621859 /nfs/dbraw/zinc/62/18/59/1042621859.db2.gz LXYMHQKRYSYVMU-GFCCVEGCSA-N 1 2 307.463 4.400 20 0 DIADLO CC(C)[N@@H+](Cc1nc(C(C)(C)C)no1)[C@H](C)c1ccsc1 ZINC000421008302 1042621862 /nfs/dbraw/zinc/62/18/62/1042621862.db2.gz LXYMHQKRYSYVMU-GFCCVEGCSA-N 1 2 307.463 4.400 20 0 DIADLO CSc1cccc(NC(=O)NCc2cc(C)[nH+]c(C)c2)c1C ZINC000421090670 1042624885 /nfs/dbraw/zinc/62/48/85/1042624885.db2.gz ONHJMZASKVFZOB-UHFFFAOYSA-N 1 2 315.442 4.050 20 0 DIADLO Cc1cc(CNC(=O)C[C@@H](c2ccccc2)C(C)C)cc(C)[nH+]1 ZINC000421574883 1042644455 /nfs/dbraw/zinc/64/44/55/1042644455.db2.gz HZVHXSRDBSBFNF-LJQANCHMSA-N 1 2 310.441 4.145 20 0 DIADLO Cc1cc(CNC(=O)c2ccc(SC(C)C)cc2)cc(C)[nH+]1 ZINC000421575087 1042644469 /nfs/dbraw/zinc/64/44/69/1042644469.db2.gz IRNGGSADOZPTTD-UHFFFAOYSA-N 1 2 314.454 4.129 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2ccc(C3CCC3)cc2)c(C)[nH+]1 ZINC001269157133 1042646024 /nfs/dbraw/zinc/64/60/24/1042646024.db2.gz PZPHNMUBYMSNGL-UHFFFAOYSA-N 1 2 308.425 4.204 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@H](C)c2ccncc2Cl)on1 ZINC000421836691 1042656162 /nfs/dbraw/zinc/65/61/62/1042656162.db2.gz REXNBYVSMWAVEH-LLVKDONJSA-N 1 2 307.825 4.477 20 0 DIADLO CCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nnc(C)s1 ZINC000271767910 1042667850 /nfs/dbraw/zinc/66/78/50/1042667850.db2.gz HUQMOCBHATWXDC-OAHLLOKOSA-N 1 2 319.474 4.122 20 0 DIADLO CCC(CC)n1ccc(C[NH2+]C2(c3cccc(F)c3)CC2)n1 ZINC000271841474 1042670156 /nfs/dbraw/zinc/67/01/56/1042670156.db2.gz VXPXAAHWJZTFMP-UHFFFAOYSA-N 1 2 301.409 4.162 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nncn1C)c1cc2c(ccc3ccccc23)o1 ZINC000271863411 1042670838 /nfs/dbraw/zinc/67/08/38/1042670838.db2.gz KUXBKWKEAOPMAN-OLZOCXBDSA-N 1 2 320.396 4.126 20 0 DIADLO ClC1(Cl)C[C@H]1C[NH+](Cc1ccco1)Cc1ccco1 ZINC000838548789 1042670892 /nfs/dbraw/zinc/67/08/92/1042670892.db2.gz VYWRJKGGMWKHMA-NSHDSACASA-N 1 2 300.185 4.069 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2oc3ccccc3c2CC)[nH]1 ZINC000271896542 1042672223 /nfs/dbraw/zinc/67/22/23/1042672223.db2.gz UKTQUNWCIODADU-NWDGAFQWSA-N 1 2 312.417 4.088 20 0 DIADLO COc1c(F)cc(F)cc1C[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001143558500 1042695334 /nfs/dbraw/zinc/69/53/34/1042695334.db2.gz YQIWPCDHMSAGQM-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1c(F)cc(F)cc1C[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001143558500 1042695336 /nfs/dbraw/zinc/69/53/36/1042695336.db2.gz YQIWPCDHMSAGQM-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO c1cc([NH2+]C2CCC(OC3CCCC3)CC2)cc2c1NCC2 ZINC000423206371 1042699539 /nfs/dbraw/zinc/69/95/39/1042699539.db2.gz BWLHVZLRLXQRHY-UHFFFAOYSA-N 1 2 300.446 4.337 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccccc1OC(F)F ZINC000423206268 1042700488 /nfs/dbraw/zinc/70/04/88/1042700488.db2.gz BQIDXLROTSADOH-NSHDSACASA-N 1 2 304.340 4.429 20 0 DIADLO COc1ccc(Cl)cc1[C@H](C)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423218975 1042700998 /nfs/dbraw/zinc/70/09/98/1042700998.db2.gz STAMMMAATYAFGR-NSHDSACASA-N 1 2 302.805 4.490 20 0 DIADLO COCCC[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(F)cc1 ZINC000423219366 1042701452 /nfs/dbraw/zinc/70/14/52/1042701452.db2.gz TXGDXIFSQGPQQX-IBGZPJMESA-N 1 2 314.404 4.374 20 0 DIADLO COC[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(Cl)cc1 ZINC000423217169 1042701625 /nfs/dbraw/zinc/70/16/25/1042701625.db2.gz PKBFTSQNDITUGD-KRWDZBQOSA-N 1 2 302.805 4.108 20 0 DIADLO Cc1coc(-c2cc(NCc3c[nH+]cn3C(C)C)ccc2C)n1 ZINC000424160911 1042728492 /nfs/dbraw/zinc/72/84/92/1042728492.db2.gz XPWNNKVXNMVJBK-UHFFFAOYSA-N 1 2 310.401 4.348 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2cnc(C3CC3)o2)c(Cl)c1 ZINC000424332428 1042734580 /nfs/dbraw/zinc/73/45/80/1042734580.db2.gz KQXJPCIYFALQLT-SNVBAGLBSA-N 1 2 306.793 4.065 20 0 DIADLO Cn1ncc(C2CC2)c1CNc1cc[nH+]c2c(Cl)cccc12 ZINC000664389139 1042739981 /nfs/dbraw/zinc/73/99/81/1042739981.db2.gz PQIAZUUBAKZQTG-UHFFFAOYSA-N 1 2 312.804 4.111 20 0 DIADLO CC(C)(C)c1ncc(CNc2ccc3c(c2)CCC[NH2+]3)s1 ZINC000414849280 1042775665 /nfs/dbraw/zinc/77/56/65/1042775665.db2.gz LLXJBMJMVMNQLK-UHFFFAOYSA-N 1 2 301.459 4.411 20 0 DIADLO COCC[N@H+](Cc1ccccc1)Cc1c(F)cccc1Cl ZINC000058876322 1042776990 /nfs/dbraw/zinc/77/69/90/1042776990.db2.gz WUESCQDKIAYPFP-UHFFFAOYSA-N 1 2 307.796 4.128 20 0 DIADLO COCC[N@@H+](Cc1ccccc1)Cc1c(F)cccc1Cl ZINC000058876322 1042776994 /nfs/dbraw/zinc/77/69/94/1042776994.db2.gz WUESCQDKIAYPFP-UHFFFAOYSA-N 1 2 307.796 4.128 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H](C)c1cccs1 ZINC000366594750 1042779755 /nfs/dbraw/zinc/77/97/55/1042779755.db2.gz ZSGIRQVDLROIDB-GFCCVEGCSA-N 1 2 311.410 4.189 20 0 DIADLO CN(C)C[C@@H]([NH2+]Cc1cccc(Cl)c1F)c1ccc(F)cc1 ZINC000514814921 1042792774 /nfs/dbraw/zinc/79/27/74/1042792774.db2.gz ZUXNFVYFKJGFLB-MRXNPFEDSA-N 1 2 324.802 4.011 20 0 DIADLO CC(C)n1cncc1C[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000425327890 1042793362 /nfs/dbraw/zinc/79/33/62/1042793362.db2.gz SGXRGHYFMPTADJ-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1cncc1C[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000425327890 1042793365 /nfs/dbraw/zinc/79/33/65/1042793365.db2.gz SGXRGHYFMPTADJ-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CS[C@@H]1CC[C@H]1Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000425353616 1042795119 /nfs/dbraw/zinc/79/51/19/1042795119.db2.gz IUBVOJKGDIKRNV-IAGOWNOFSA-N 1 2 313.470 4.192 20 0 DIADLO CC(C)n1cncc1C[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000425357403 1042796714 /nfs/dbraw/zinc/79/67/14/1042796714.db2.gz QBSVMVOKYYWKKF-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO CC(C)n1cncc1C[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000425357403 1042796719 /nfs/dbraw/zinc/79/67/19/1042796719.db2.gz QBSVMVOKYYWKKF-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO Cc1ccc(-c2nc(C[NH+]3CC(CC(F)F)C3)cs2)cc1 ZINC000425366032 1042799004 /nfs/dbraw/zinc/79/90/04/1042799004.db2.gz ODISYODFEDCHGO-UHFFFAOYSA-N 1 2 308.397 4.206 20 0 DIADLO FC(F)c1noc(C[N@@H+]2CCCCC[C@@H]2c2ccccc2)n1 ZINC000425400217 1042812233 /nfs/dbraw/zinc/81/22/33/1042812233.db2.gz CQBVIFMLFDZJFU-CYBMUJFWSA-N 1 2 307.344 4.125 20 0 DIADLO FC(F)c1noc(C[N@H+]2CCCCC[C@@H]2c2ccccc2)n1 ZINC000425400217 1042812236 /nfs/dbraw/zinc/81/22/36/1042812236.db2.gz CQBVIFMLFDZJFU-CYBMUJFWSA-N 1 2 307.344 4.125 20 0 DIADLO Cc1cc(C)c(C(=O)N2C[C@@H](c3ccccc3C)C[C@H]2C)c(C)[nH+]1 ZINC001126443534 1042828385 /nfs/dbraw/zinc/82/83/85/1042828385.db2.gz IKIMNLOETRTUCJ-AEFFLSMTSA-N 1 2 322.452 4.333 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC(C)(C)[C@@H]2c2ccncc2)c(C)[nH+]1 ZINC000515782470 1042834938 /nfs/dbraw/zinc/83/49/38/1042834938.db2.gz GDXIINBFWZDOLC-KRWDZBQOSA-N 1 2 324.428 4.017 20 0 DIADLO CC[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1nc(C)cs1 ZINC000190970321 1042854414 /nfs/dbraw/zinc/85/44/14/1042854414.db2.gz VNJZYTJAMGZGRI-LLVKDONJSA-N 1 2 314.813 4.191 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(-c2ccc(F)cc2)[nH]1)c1cccc(C)c1 ZINC000516883119 1042858443 /nfs/dbraw/zinc/85/84/43/1042858443.db2.gz JRQMSOOPNCOZCB-KRWDZBQOSA-N 1 2 324.403 4.160 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(-c2ccc(F)cc2)n[nH]1)c1cccc(C)c1 ZINC000516883119 1042858449 /nfs/dbraw/zinc/85/84/49/1042858449.db2.gz JRQMSOOPNCOZCB-KRWDZBQOSA-N 1 2 324.403 4.160 20 0 DIADLO CC(C)[N@H+](Cc1csc(-c2ccoc2)n1)Cc1ccccn1 ZINC000517468877 1042882165 /nfs/dbraw/zinc/88/21/65/1042882165.db2.gz VMNAJZJXOPPENS-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)[N@@H+](Cc1csc(-c2ccoc2)n1)Cc1ccccn1 ZINC000517468877 1042882169 /nfs/dbraw/zinc/88/21/69/1042882169.db2.gz VMNAJZJXOPPENS-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@H](c1oc2ccccc2c1C)C(C)C ZINC000925038338 1042907727 /nfs/dbraw/zinc/90/77/27/1042907727.db2.gz TUDFRCYBQHGSFS-LRDDRELGSA-N 1 2 313.401 4.481 20 0 DIADLO COc1cccc(C)c1C[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000638553996 1042909139 /nfs/dbraw/zinc/90/91/39/1042909139.db2.gz CDRFXWCLJSFMNX-UHFFFAOYSA-N 1 2 304.459 4.047 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)c1C ZINC000638599611 1042915720 /nfs/dbraw/zinc/91/57/20/1042915720.db2.gz LQEXSTGOQWKPBT-MAUKXSAKSA-N 1 2 312.461 4.394 20 0 DIADLO CC(C)[C@H](C)NC(=O)C[N@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000519193072 1042937307 /nfs/dbraw/zinc/93/73/07/1042937307.db2.gz YMCFYBGNAOCSGX-UONOGXRCSA-N 1 2 322.880 4.026 20 0 DIADLO CC(C)[C@H](C)NC(=O)C[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000519193072 1042937309 /nfs/dbraw/zinc/93/73/09/1042937309.db2.gz YMCFYBGNAOCSGX-UONOGXRCSA-N 1 2 322.880 4.026 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2cc(C(C)C)no2)c2cccnc2)cc1 ZINC000925067299 1042942917 /nfs/dbraw/zinc/94/29/17/1042942917.db2.gz NNCATCJZWOACAK-FQEVSTJZSA-N 1 2 321.424 4.381 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[NH2+][C@H](C)c1c(F)cncc1F ZINC000894435224 1042957876 /nfs/dbraw/zinc/95/78/76/1042957876.db2.gz MMTSVEYUINMYPG-SNVBAGLBSA-N 1 2 308.372 4.410 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(C(F)F)c(F)c1)c1c(F)cncc1F ZINC000894436059 1042958284 /nfs/dbraw/zinc/95/82/84/1042958284.db2.gz SWUHYZZDEKJACK-QMMMGPOBSA-N 1 2 316.273 4.287 20 0 DIADLO COc1cccc2c(NCc3cc(C)cc(Cl)n3)cc[nH+]c12 ZINC000799965935 1042959931 /nfs/dbraw/zinc/95/99/31/1042959931.db2.gz YEPDPUSSFJILDB-UHFFFAOYSA-N 1 2 313.788 4.212 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(-c3ccccc3)no2)[C@H]1c1ccncc1 ZINC000664831779 1042967780 /nfs/dbraw/zinc/96/77/80/1042967780.db2.gz BHEJJZZAFUTIPB-IBGZPJMESA-N 1 2 319.408 4.320 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(-c3ccccc3)no2)[C@H]1c1ccncc1 ZINC000664831779 1042967786 /nfs/dbraw/zinc/96/77/86/1042967786.db2.gz BHEJJZZAFUTIPB-IBGZPJMESA-N 1 2 319.408 4.320 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@H+](Cc2c[nH]c(-c3ccccc3)n2)C1 ZINC000519556995 1042967873 /nfs/dbraw/zinc/96/78/73/1042967873.db2.gz PEVJZWNTAGLSAB-FQEVSTJZSA-N 1 2 321.399 4.147 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@@H+](Cc2c[nH]c(-c3ccccc3)n2)C1 ZINC000519556995 1042967878 /nfs/dbraw/zinc/96/78/78/1042967878.db2.gz PEVJZWNTAGLSAB-FQEVSTJZSA-N 1 2 321.399 4.147 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(F)c(O)c(F)c1 ZINC000093008507 1042973591 /nfs/dbraw/zinc/97/35/91/1042973591.db2.gz VSJPZWOGXFBNST-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc(F)c(O)c(F)c1 ZINC000093008507 1042973593 /nfs/dbraw/zinc/97/35/93/1042973593.db2.gz VSJPZWOGXFBNST-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000894705678 1042974213 /nfs/dbraw/zinc/97/42/13/1042974213.db2.gz BAVAKUMXAYRQPS-MNOVXSKESA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000894705678 1042974215 /nfs/dbraw/zinc/97/42/15/1042974215.db2.gz BAVAKUMXAYRQPS-MNOVXSKESA-N 1 2 304.356 4.135 20 0 DIADLO Cc1ccc(C(C)(C)[NH2+]Cc2nc(C(C)C)n3ccccc23)cn1 ZINC000519613837 1042989061 /nfs/dbraw/zinc/98/90/61/1042989061.db2.gz ZDUUJVSWCOIKFM-UHFFFAOYSA-N 1 2 322.456 4.186 20 0 DIADLO CCC[N@H+](Cc1nc(C(C)C)no1)[C@@H](C)c1ccccc1OC ZINC000519907296 1043007848 /nfs/dbraw/zinc/00/78/48/1043007848.db2.gz UEAFWJKTHGEKGC-AWEZNQCLSA-N 1 2 317.433 4.175 20 0 DIADLO CCC[N@@H+](Cc1nc(C(C)C)no1)[C@@H](C)c1ccccc1OC ZINC000519907296 1043007853 /nfs/dbraw/zinc/00/78/53/1043007853.db2.gz UEAFWJKTHGEKGC-AWEZNQCLSA-N 1 2 317.433 4.175 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000441031541 1043016492 /nfs/dbraw/zinc/01/64/92/1043016492.db2.gz PDRQIOBKAWPBEU-CQSZACIVSA-N 1 2 309.388 4.409 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000441031541 1043016497 /nfs/dbraw/zinc/01/64/97/1043016497.db2.gz PDRQIOBKAWPBEU-CQSZACIVSA-N 1 2 309.388 4.409 20 0 DIADLO COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1nccn1CC(C)C ZINC000164843765 1043018452 /nfs/dbraw/zinc/01/84/52/1043018452.db2.gz LTDDXQZZFLLZEO-CYBMUJFWSA-N 1 2 321.852 4.052 20 0 DIADLO CCC[N@H+](Cc1nnc(OCC)s1)[C@H](CC)c1ccccc1 ZINC000520171354 1043020401 /nfs/dbraw/zinc/02/04/01/1043020401.db2.gz FFYREGVYTXMZQY-OAHLLOKOSA-N 1 2 319.474 4.300 20 0 DIADLO CCC[N@@H+](Cc1nnc(OCC)s1)[C@H](CC)c1ccccc1 ZINC000520171354 1043020407 /nfs/dbraw/zinc/02/04/07/1043020407.db2.gz FFYREGVYTXMZQY-OAHLLOKOSA-N 1 2 319.474 4.300 20 0 DIADLO CC(C)[N@H+](Cc1ccco1)Cc1ccccc1Br ZINC000520168549 1043022101 /nfs/dbraw/zinc/02/21/01/1043022101.db2.gz FWVMRQSRXUDJTG-UHFFFAOYSA-N 1 2 308.219 4.453 20 0 DIADLO CC(C)[N@@H+](Cc1ccco1)Cc1ccccc1Br ZINC000520168549 1043022106 /nfs/dbraw/zinc/02/21/06/1043022106.db2.gz FWVMRQSRXUDJTG-UHFFFAOYSA-N 1 2 308.219 4.453 20 0 DIADLO COCC[N@H+](Cc1ncc(C(C)(C)C)o1)[C@@H](C)c1ccccc1 ZINC000520183383 1043023606 /nfs/dbraw/zinc/02/36/06/1043023606.db2.gz WLZXUQHNIFFVEY-HNNXBMFYSA-N 1 2 316.445 4.182 20 0 DIADLO COCC[N@@H+](Cc1ncc(C(C)(C)C)o1)[C@@H](C)c1ccccc1 ZINC000520183383 1043023610 /nfs/dbraw/zinc/02/36/10/1043023610.db2.gz WLZXUQHNIFFVEY-HNNXBMFYSA-N 1 2 316.445 4.182 20 0 DIADLO Cc1sc(NC(=O)C[N@H+](Cc2ccco2)C(C)C)c(C)c1C ZINC000441278574 1043033111 /nfs/dbraw/zinc/03/31/11/1043033111.db2.gz AIRJXHFNUFHTRP-UHFFFAOYSA-N 1 2 320.458 4.115 20 0 DIADLO Cc1sc(NC(=O)C[N@@H+](Cc2ccco2)C(C)C)c(C)c1C ZINC000441278574 1043033115 /nfs/dbraw/zinc/03/31/15/1043033115.db2.gz AIRJXHFNUFHTRP-UHFFFAOYSA-N 1 2 320.458 4.115 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1ccc(F)cc1F ZINC000520411551 1043042727 /nfs/dbraw/zinc/04/27/27/1043042727.db2.gz OVHRQONJUOQAHT-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1ccc(F)cc1F ZINC000520411551 1043042736 /nfs/dbraw/zinc/04/27/36/1043042736.db2.gz OVHRQONJUOQAHT-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CC(C)[C@H](c1ccccc1)[N@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000112699430 1043055492 /nfs/dbraw/zinc/05/54/92/1043055492.db2.gz QHHXPRBUDUBYDJ-MRXNPFEDSA-N 1 2 301.434 4.196 20 0 DIADLO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000112699430 1043055504 /nfs/dbraw/zinc/05/55/04/1043055504.db2.gz QHHXPRBUDUBYDJ-MRXNPFEDSA-N 1 2 301.434 4.196 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+](C)Cc1nccs1 ZINC000175083489 1043075013 /nfs/dbraw/zinc/07/50/13/1043075013.db2.gz YUHFMSZXSRDQBR-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+](C)Cc1nccs1 ZINC000175083489 1043075029 /nfs/dbraw/zinc/07/50/29/1043075029.db2.gz YUHFMSZXSRDQBR-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1ccccc1N1CCCC1 ZINC000175404699 1043083896 /nfs/dbraw/zinc/08/38/96/1043083896.db2.gz ZQDJGBIHBBWLBH-UHFFFAOYSA-N 1 2 321.877 4.029 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1ccccc1N1CCCC1 ZINC000175404699 1043083911 /nfs/dbraw/zinc/08/39/11/1043083911.db2.gz ZQDJGBIHBBWLBH-UHFFFAOYSA-N 1 2 321.877 4.029 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2ccc(SC)c(OC)c2)s1 ZINC000175505618 1043086064 /nfs/dbraw/zinc/08/60/64/1043086064.db2.gz HVBFRSATJHNORT-UHFFFAOYSA-N 1 2 322.499 4.068 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2ccc(SC)c(OC)c2)s1 ZINC000175505618 1043086075 /nfs/dbraw/zinc/08/60/75/1043086075.db2.gz HVBFRSATJHNORT-UHFFFAOYSA-N 1 2 322.499 4.068 20 0 DIADLO Cc1oc2ccccc2c1C[NH2+][C@H](c1ncc[nH]1)c1ccccc1 ZINC000188478006 1043086825 /nfs/dbraw/zinc/08/68/25/1043086825.db2.gz MNJMOBBWFLMNQG-IBGZPJMESA-N 1 2 317.392 4.344 20 0 DIADLO C[C@H]([NH2+]Cc1cn(C2CC2)cn1)c1ccc(Cl)cc1Cl ZINC000865400395 1043092086 /nfs/dbraw/zinc/09/20/86/1043092086.db2.gz BQZXATMIRDQBCB-JTQLQIEISA-N 1 2 310.228 4.376 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccc(OC(F)F)cc2F)cs1 ZINC000865456418 1043101473 /nfs/dbraw/zinc/10/14/73/1043101473.db2.gz KKIPPOQIOGOZLH-QMMMGPOBSA-N 1 2 316.348 4.043 20 0 DIADLO C[C@@H]([NH2+]c1ccc(N2CCC(O)CC2)cc1)C1CCCCC1 ZINC000177235938 1043104465 /nfs/dbraw/zinc/10/44/65/1043104465.db2.gz ZGYMFVLNSQSILR-OAHLLOKOSA-N 1 2 302.462 4.028 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000865572268 1043114764 /nfs/dbraw/zinc/11/47/64/1043114764.db2.gz MEJBIHGTXPEURD-ZBEGNZNMSA-N 1 2 302.443 4.052 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1nc(C)c(C)s1)CCC2 ZINC000177895213 1043115891 /nfs/dbraw/zinc/11/58/91/1043115891.db2.gz NPBVQUKAUUTTSK-ZDUSSCGKSA-N 1 2 321.515 4.288 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1nc(C)c(C)s1)CCC2 ZINC000177895213 1043115897 /nfs/dbraw/zinc/11/58/97/1043115897.db2.gz NPBVQUKAUUTTSK-ZDUSSCGKSA-N 1 2 321.515 4.288 20 0 DIADLO CCS[C@H]1CCCC[C@H]1NC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000334105541 1043122521 /nfs/dbraw/zinc/12/25/21/1043122521.db2.gz OXTVILXLHSVIGX-CABCVRRESA-N 1 2 321.490 4.193 20 0 DIADLO CCc1cccc(NC(=O)C[N@@H+]2CCCC[C@H]2c2ccco2)c1 ZINC000520452166 1043125534 /nfs/dbraw/zinc/12/55/34/1043125534.db2.gz OCZUQMQDMSLTKR-KRWDZBQOSA-N 1 2 312.413 4.008 20 0 DIADLO CCc1cccc(NC(=O)C[N@H+]2CCCC[C@H]2c2ccco2)c1 ZINC000520452166 1043125536 /nfs/dbraw/zinc/12/55/36/1043125536.db2.gz OCZUQMQDMSLTKR-KRWDZBQOSA-N 1 2 312.413 4.008 20 0 DIADLO COCc1ccc(C[NH2+]Cc2cc(Cl)cc(Cl)c2F)o1 ZINC000865817644 1043135985 /nfs/dbraw/zinc/13/59/85/1043135985.db2.gz LUXGRMQIPSZFMY-UHFFFAOYSA-N 1 2 318.175 4.162 20 0 DIADLO Cc1ncsc1C[N@@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000179734549 1043151226 /nfs/dbraw/zinc/15/12/26/1043151226.db2.gz PUAASROGPJPDTH-LLVKDONJSA-N 1 2 303.456 4.254 20 0 DIADLO Cc1ncsc1C[N@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000179734549 1043151230 /nfs/dbraw/zinc/15/12/30/1043151230.db2.gz PUAASROGPJPDTH-LLVKDONJSA-N 1 2 303.456 4.254 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2cccc(F)c2F)o1 ZINC000183271539 1043158731 /nfs/dbraw/zinc/15/87/31/1043158731.db2.gz FUTDDSBBJZSITL-NHYWBVRUSA-N 1 2 309.356 4.159 20 0 DIADLO C[C@@H](Nc1[nH+]ccc2cc(C(F)(F)F)ccc21)c1ccnn1C ZINC000866252257 1043165761 /nfs/dbraw/zinc/16/57/61/1043165761.db2.gz HYGZXCLVEMNJQP-SNVBAGLBSA-N 1 2 320.318 4.160 20 0 DIADLO Cc1cccnc1[C@H]([NH2+][C@@H]1c2ccccc2OC[C@H]1F)C(C)C ZINC000866267462 1043169753 /nfs/dbraw/zinc/16/97/53/1043169753.db2.gz IWJSQAZWQZYPOJ-SZVBFZGTSA-N 1 2 314.404 4.149 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+]Cc2noc(-c3ccsc3)n2)c1C ZINC000183736860 1043170789 /nfs/dbraw/zinc/17/07/89/1043170789.db2.gz JFZIYACFVWUKQN-CYBMUJFWSA-N 1 2 313.426 4.266 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)s1 ZINC000866275247 1043171171 /nfs/dbraw/zinc/17/11/71/1043171171.db2.gz ZMHJNMHJVRFERU-SECBINFHSA-N 1 2 321.833 4.351 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000183959279 1043174787 /nfs/dbraw/zinc/17/47/87/1043174787.db2.gz LAFGCSAVKOBPMZ-HNNXBMFYSA-N 1 2 309.381 4.259 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000183959279 1043174792 /nfs/dbraw/zinc/17/47/92/1043174792.db2.gz LAFGCSAVKOBPMZ-HNNXBMFYSA-N 1 2 309.381 4.259 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)s1 ZINC000866335827 1043182661 /nfs/dbraw/zinc/18/26/61/1043182661.db2.gz AXYSVUZWXSEICG-HTQZYQBOSA-N 1 2 322.821 4.053 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2ccccc2s1)c1nc(C)cs1 ZINC000184351771 1043183280 /nfs/dbraw/zinc/18/32/80/1043183280.db2.gz LCTMNASMPCJZNR-NSHDSACASA-N 1 2 303.456 4.302 20 0 DIADLO FC(F)c1ccc(C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)cc1 ZINC000866341848 1043184492 /nfs/dbraw/zinc/18/44/92/1043184492.db2.gz SEBLNRKXEWHEMF-GOEBONIOSA-N 1 2 307.315 4.186 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[NH+]1CCC(C(=O)C(F)(F)F)CC1 ZINC000186059443 1043212322 /nfs/dbraw/zinc/21/23/22/1043212322.db2.gz REOILFAZRVWVIW-JTQLQIEISA-N 1 2 319.754 4.244 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1ccc(F)c(F)c1 ZINC000186057833 1043213281 /nfs/dbraw/zinc/21/32/81/1043213281.db2.gz YJSGZRPVRSIBIA-LLVKDONJSA-N 1 2 324.371 4.119 20 0 DIADLO C[C@H]([NH2+][C@@H](CCO)c1ccco1)c1cccc(Cl)c1Cl ZINC000186541797 1043227494 /nfs/dbraw/zinc/22/74/94/1043227494.db2.gz HNCOBQAGOPAXTR-GWCFXTLKSA-N 1 2 314.212 4.361 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nc2ccccc2[nH]1)C1CCCCC1)c1ncc[nH]1 ZINC000866613523 1043235459 /nfs/dbraw/zinc/23/54/59/1043235459.db2.gz BXQLWZGBZJHFTL-SUMWQHHRSA-N 1 2 323.444 4.258 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccc3c(c2)COC(C)(C)O3)cc1 ZINC000186877498 1043237959 /nfs/dbraw/zinc/23/79/59/1043237959.db2.gz VUGXFLFWLOHOQU-UHFFFAOYSA-N 1 2 312.413 4.010 20 0 DIADLO CC[N@H+](Cc1ccccc1Br)[C@@H](C)c1cccnc1 ZINC000520623241 1043241221 /nfs/dbraw/zinc/24/12/21/1043241221.db2.gz HGMKZLLMJDSDDF-ZDUSSCGKSA-N 1 2 319.246 4.427 20 0 DIADLO CC[N@@H+](Cc1ccccc1Br)[C@@H](C)c1cccnc1 ZINC000520623241 1043241228 /nfs/dbraw/zinc/24/12/28/1043241228.db2.gz HGMKZLLMJDSDDF-ZDUSSCGKSA-N 1 2 319.246 4.427 20 0 DIADLO Fc1ccc([C@H]([NH2+][C@H]2CCCc3ccccc32)c2ncc[nH]2)cc1 ZINC000187677858 1043247313 /nfs/dbraw/zinc/24/73/13/1043247313.db2.gz SXFIJPTYZJCURZ-OALUTQOASA-N 1 2 321.399 4.305 20 0 DIADLO c1coc(-c2nc(C[NH2+]Cc3nccc4ccccc43)cs2)c1 ZINC000067450679 1043269765 /nfs/dbraw/zinc/26/97/65/1043269765.db2.gz HAGAFUZGGSRVDD-UHFFFAOYSA-N 1 2 321.405 4.241 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cc(Cl)cs1)c1nc(C2CC2)no1 ZINC000193103809 1043279791 /nfs/dbraw/zinc/27/97/91/1043279791.db2.gz WZSRXQDLNWKFTD-GFCCVEGCSA-N 1 2 311.838 4.149 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@H](C)n3cccc3)c2)[nH+]c1C ZINC000729525520 1043281829 /nfs/dbraw/zinc/28/18/29/1043281829.db2.gz FDRAGKOCGSGVGB-ZDUSSCGKSA-N 1 2 322.412 4.085 20 0 DIADLO C[C@@H](CCC(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccccc1 ZINC000441810640 1043290614 /nfs/dbraw/zinc/29/06/14/1043290614.db2.gz WWCWZNWAVXEOPX-INIZCTEOSA-N 1 2 319.408 4.395 20 0 DIADLO Clc1ccccc1C1([NH2+]Cc2nccn2C2CC2)CCC1 ZINC000895136237 1043315460 /nfs/dbraw/zinc/31/54/60/1043315460.db2.gz FDUIQTSTBYXGMW-UHFFFAOYSA-N 1 2 301.821 4.040 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@H+](Cc2cc(-c3cccs3)on2)C1 ZINC000268241989 1043315808 /nfs/dbraw/zinc/31/58/08/1043315808.db2.gz NAQXJQSFKCUQRG-JTQLQIEISA-N 1 2 316.348 4.177 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@@H+](Cc2cc(-c3cccs3)on2)C1 ZINC000268241989 1043315811 /nfs/dbraw/zinc/31/58/11/1043315811.db2.gz NAQXJQSFKCUQRG-JTQLQIEISA-N 1 2 316.348 4.177 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000268699529 1043324587 /nfs/dbraw/zinc/32/45/87/1043324587.db2.gz UXBIEKXOKGDQRC-UHFFFAOYSA-N 1 2 313.445 4.032 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@H](c2nccn2C)c2ccc(F)cc2)c1 ZINC000268739200 1043327093 /nfs/dbraw/zinc/32/70/93/1043327093.db2.gz CMTSLSGHHZDRKJ-KXBFYZLASA-N 1 2 323.415 4.308 20 0 DIADLO Cc1cc(C[N@@H+]2Cc3ccccc3C[C@H]2c2ccccc2)nn1C ZINC000487413670 1043338549 /nfs/dbraw/zinc/33/85/49/1043338549.db2.gz LUGBHMSIXMXLQE-NRFANRHFSA-N 1 2 317.436 4.028 20 0 DIADLO Cc1cc(C[N@H+]2Cc3ccccc3C[C@H]2c2ccccc2)nn1C ZINC000487413670 1043338559 /nfs/dbraw/zinc/33/85/59/1043338559.db2.gz LUGBHMSIXMXLQE-NRFANRHFSA-N 1 2 317.436 4.028 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H](C)c2nc(-c3ccccc3)no2)cc1 ZINC000269043466 1043352569 /nfs/dbraw/zinc/35/25/69/1043352569.db2.gz DOEXFDRTHJHRRI-UONOGXRCSA-N 1 2 323.396 4.157 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H]2CCSc3ccccc32)cs1 ZINC000269025899 1043352820 /nfs/dbraw/zinc/35/28/20/1043352820.db2.gz COISBQXRHKHINM-FZMZJTMJSA-N 1 2 320.483 4.177 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](CC(C)C)c2ccccn2)cs1 ZINC000269040171 1043352983 /nfs/dbraw/zinc/35/29/83/1043352983.db2.gz GIACGQLSKQUHAJ-XJKSGUPXSA-N 1 2 319.474 4.123 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+]Cc1csc([C@@H](C)OC)n1 ZINC000269044228 1043353607 /nfs/dbraw/zinc/35/36/07/1043353607.db2.gz HDEZTPPVQQSCRK-CHWSQXEVSA-N 1 2 320.458 4.100 20 0 DIADLO Cc1cc(F)c(C[NH2+]Cc2cnc(Cl)s2)c(Cl)c1 ZINC000895152331 1043354258 /nfs/dbraw/zinc/35/42/58/1043354258.db2.gz RKHUVKYQKPQDGD-UHFFFAOYSA-N 1 2 305.205 4.187 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(F)c(C)c2)cs1 ZINC000269076392 1043356409 /nfs/dbraw/zinc/35/64/09/1043356409.db2.gz NNZWYAFNOSGQPV-RYUDHWBXSA-N 1 2 308.422 4.149 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@H](C)C(=O)Nc1ccc2ccccc2c1 ZINC000795161300 1043365529 /nfs/dbraw/zinc/36/55/29/1043365529.db2.gz MFYZPEIGNMKHIE-OAHLLOKOSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@H](C)C(=O)Nc1ccc2ccccc2c1 ZINC000795161300 1043365542 /nfs/dbraw/zinc/36/55/42/1043365542.db2.gz MFYZPEIGNMKHIE-OAHLLOKOSA-N 1 2 322.408 4.200 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)c(Cl)c1OC ZINC000269502551 1043368093 /nfs/dbraw/zinc/36/80/93/1043368093.db2.gz QWLHVRGBAZSKKJ-AWEZNQCLSA-N 1 2 320.820 4.022 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c(Cl)c1OC ZINC000269502551 1043368098 /nfs/dbraw/zinc/36/80/98/1043368098.db2.gz QWLHVRGBAZSKKJ-AWEZNQCLSA-N 1 2 320.820 4.022 20 0 DIADLO CC(C)c1csc(C[NH2+][C@@H]2CCc3c2c(F)ccc3F)n1 ZINC000269941281 1043377598 /nfs/dbraw/zinc/37/75/98/1043377598.db2.gz RTZKOTMVTBRVBS-CYBMUJFWSA-N 1 2 308.397 4.322 20 0 DIADLO CCn1nccc1C[N@@H+](Cc1ccc(F)cc1Cl)CC1CC1 ZINC000521317507 1043387292 /nfs/dbraw/zinc/38/72/92/1043387292.db2.gz JTXYHQXAPKQFTJ-UHFFFAOYSA-N 1 2 321.827 4.108 20 0 DIADLO CCn1nccc1C[N@H+](Cc1ccc(F)cc1Cl)CC1CC1 ZINC000521317507 1043387300 /nfs/dbraw/zinc/38/73/00/1043387300.db2.gz JTXYHQXAPKQFTJ-UHFFFAOYSA-N 1 2 321.827 4.108 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ncc(C3CC3)o2)[C@@H]1c1cccc(F)c1 ZINC000270648520 1043392292 /nfs/dbraw/zinc/39/22/92/1043392292.db2.gz SXCCSVRPZMGKMX-SGTLLEGYSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ncc(C3CC3)o2)[C@@H]1c1cccc(F)c1 ZINC000270648520 1043392301 /nfs/dbraw/zinc/39/23/01/1043392301.db2.gz SXCCSVRPZMGKMX-SGTLLEGYSA-N 1 2 300.377 4.274 20 0 DIADLO COCc1ccc(C[NH2+][C@H](c2cccc(C)c2)c2ccccn2)o1 ZINC000270782185 1043396810 /nfs/dbraw/zinc/39/68/10/1043396810.db2.gz DCYIPRKSESIUPZ-HXUWFJFHSA-N 1 2 322.408 4.009 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](Cc1cnc([C@@H]2CCCO2)s1)C1CC1 ZINC000271153396 1043403857 /nfs/dbraw/zinc/40/38/57/1043403857.db2.gz UZLCZMRSOCAZFC-LRDDRELGSA-N 1 2 318.442 4.313 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](Cc1cnc([C@@H]2CCCO2)s1)C1CC1 ZINC000271153396 1043403864 /nfs/dbraw/zinc/40/38/64/1043403864.db2.gz UZLCZMRSOCAZFC-LRDDRELGSA-N 1 2 318.442 4.313 20 0 DIADLO Cc1cncc(C[N@@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000442681330 1043404650 /nfs/dbraw/zinc/40/46/50/1043404650.db2.gz IAHHVOKDBWSXAB-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cncc(C[N@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000442681330 1043404655 /nfs/dbraw/zinc/40/46/55/1043404655.db2.gz IAHHVOKDBWSXAB-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO CC(C)CCOc1ccccc1C[NH2+][C@H](C)c1cscn1 ZINC000271117679 1043404704 /nfs/dbraw/zinc/40/47/04/1043404704.db2.gz ITZNYOVMOUGWJT-CQSZACIVSA-N 1 2 304.459 4.419 20 0 DIADLO C[C@H](c1ccco1)[N@H+](Cc1cnc([C@H]2CCCO2)s1)C1CC1 ZINC000271153400 1043405115 /nfs/dbraw/zinc/40/51/15/1043405115.db2.gz UZLCZMRSOCAZFC-MLGOLLRUSA-N 1 2 318.442 4.313 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](Cc1cnc([C@H]2CCCO2)s1)C1CC1 ZINC000271153400 1043405121 /nfs/dbraw/zinc/40/51/21/1043405121.db2.gz UZLCZMRSOCAZFC-MLGOLLRUSA-N 1 2 318.442 4.313 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@@H+]2Cc2nnc(C)s2)o1 ZINC000271428905 1043417728 /nfs/dbraw/zinc/41/77/28/1043417728.db2.gz NQWSFVUWSNDJLY-CQSZACIVSA-N 1 2 305.447 4.119 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@H+]2Cc2nnc(C)s2)o1 ZINC000271428905 1043417732 /nfs/dbraw/zinc/41/77/32/1043417732.db2.gz NQWSFVUWSNDJLY-CQSZACIVSA-N 1 2 305.447 4.119 20 0 DIADLO COc1cc([C@@H](C)[NH2+]C(c2cccs2)c2cccs2)on1 ZINC000925448668 1043419249 /nfs/dbraw/zinc/41/92/49/1043419249.db2.gz BSPXHEYEUNRRTF-SNVBAGLBSA-N 1 2 320.439 4.246 20 0 DIADLO C[C@@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1cccc(Cl)c1 ZINC000271481517 1043423904 /nfs/dbraw/zinc/42/39/04/1043423904.db2.gz NJUDGQSTPYYJHZ-BMIGLBTASA-N 1 2 311.759 4.002 20 0 DIADLO Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCc3c1nccc3Cl)CO2 ZINC000925532081 1043426707 /nfs/dbraw/zinc/42/67/07/1043426707.db2.gz QDRVDTFRBQULQE-ZIAGYGMSSA-N 1 2 321.207 4.099 20 0 DIADLO CSc1ccccc1[C@H](C)[NH2+][C@H](C)c1nnc(C(C)C)[nH]1 ZINC000442872466 1043440577 /nfs/dbraw/zinc/44/05/77/1043440577.db2.gz NMUCMGQTCHOYAN-NWDGAFQWSA-N 1 2 304.463 4.062 20 0 DIADLO c1cc2ccc(NCc3c[nH+]cn3Cc3ccccc3)cc2o1 ZINC000442878044 1043445900 /nfs/dbraw/zinc/44/59/00/1043445900.db2.gz YHBMYISEBOYLRG-UHFFFAOYSA-N 1 2 303.365 4.290 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1cccc(O)c1F)c1ccc(Cl)cc1 ZINC000872066106 1043445790 /nfs/dbraw/zinc/44/57/90/1043445790.db2.gz DYOXBELFESGAFN-XHDPSFHLSA-N 1 2 323.795 4.223 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(Cc2ccccc2C)no1)c1ccccc1 ZINC000271661752 1043445874 /nfs/dbraw/zinc/44/58/74/1043445874.db2.gz LHIUCTQLPSINQZ-GOSISDBHSA-N 1 2 321.424 4.210 20 0 DIADLO COc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1ncc(C2CC2)o1 ZINC000271686429 1043449982 /nfs/dbraw/zinc/44/99/82/1043449982.db2.gz DEHKQGNRFGCENT-MRXNPFEDSA-N 1 2 314.429 4.438 20 0 DIADLO CC1(C)C[NH+](Cc2ncc(-c3ccccc3)s2)CC(C)(C)O1 ZINC000442888912 1043451274 /nfs/dbraw/zinc/45/12/74/1043451274.db2.gz IAKVAKFHJJNOLY-UHFFFAOYSA-N 1 2 316.470 4.200 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1ccncc1Cl ZINC000558183003 1043452071 /nfs/dbraw/zinc/45/20/71/1043452071.db2.gz XYBDMFCVKYWRTR-INIZCTEOSA-N 1 2 304.821 4.327 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1ccncc1Cl ZINC000558183003 1043452083 /nfs/dbraw/zinc/45/20/83/1043452083.db2.gz XYBDMFCVKYWRTR-INIZCTEOSA-N 1 2 304.821 4.327 20 0 DIADLO Fc1ccc(Nc2ccn3cc[nH+]c3c2)cc1OC(F)(F)F ZINC001204982793 1043453724 /nfs/dbraw/zinc/45/37/24/1043453724.db2.gz IXSYVLPRHPQNFP-UHFFFAOYSA-N 1 2 311.238 4.116 20 0 DIADLO CC1(C)CC2(CC(Nc3ccc([NH+]4CCCC4)cc3)C2)CO1 ZINC000925726239 1043457046 /nfs/dbraw/zinc/45/70/46/1043457046.db2.gz HCOBICYHGWQTOV-UHFFFAOYSA-N 1 2 300.446 4.046 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(C(F)(F)F)s2)[C@@H]2CCC[C@H]2O1 ZINC000442956460 1043459887 /nfs/dbraw/zinc/45/98/87/1043459887.db2.gz OXAGPCZVIWMCHJ-VXGBXAGGSA-N 1 2 319.392 4.299 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(C(F)(F)F)s2)[C@@H]2CCC[C@H]2O1 ZINC000442956460 1043459898 /nfs/dbraw/zinc/45/98/98/1043459898.db2.gz OXAGPCZVIWMCHJ-VXGBXAGGSA-N 1 2 319.392 4.299 20 0 DIADLO C[C@H](Nc1cccc(N2CCCCC2)c1)c1cn2c([nH+]1)CCCC2 ZINC000925773401 1043468418 /nfs/dbraw/zinc/46/84/18/1043468418.db2.gz NBAHMPNXHABPNU-INIZCTEOSA-N 1 2 324.472 4.383 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@H](COC)c2ccccc2)on1 ZINC000558243878 1043469879 /nfs/dbraw/zinc/46/98/79/1043469879.db2.gz JRPAOGIYNWTHKO-GOSISDBHSA-N 1 2 302.418 4.056 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)nc2)cs1 ZINC000872130675 1043473388 /nfs/dbraw/zinc/47/33/88/1043473388.db2.gz KQFWLQSFUZKNIY-DTWKUNHWSA-N 1 2 315.364 4.277 20 0 DIADLO CCSc1cccc(C[N@@H+]2CCCC[C@@H]2c2nc(C)no2)c1 ZINC000348834886 1043473609 /nfs/dbraw/zinc/47/36/09/1043473609.db2.gz RJXAAWZIULJEEL-MRXNPFEDSA-N 1 2 317.458 4.217 20 0 DIADLO CCSc1cccc(C[N@H+]2CCCC[C@@H]2c2nc(C)no2)c1 ZINC000348834886 1043473621 /nfs/dbraw/zinc/47/36/21/1043473621.db2.gz RJXAAWZIULJEEL-MRXNPFEDSA-N 1 2 317.458 4.217 20 0 DIADLO CCc1ccc([C@@H](CC)[NH2+]Cc2nnc(-c3ccccc3)[nH]2)cc1 ZINC000777576068 1043477635 /nfs/dbraw/zinc/47/76/35/1043477635.db2.gz UVFCHGSFZBLQGU-GOSISDBHSA-N 1 2 320.440 4.275 20 0 DIADLO CCc1ccc([C@@H](CC)[NH2+]Cc2nc(-c3ccccc3)n[nH]2)cc1 ZINC000777576068 1043477642 /nfs/dbraw/zinc/47/76/42/1043477642.db2.gz UVFCHGSFZBLQGU-GOSISDBHSA-N 1 2 320.440 4.275 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@H]3c3cccnc3)sc2c1 ZINC000348908310 1043481345 /nfs/dbraw/zinc/48/13/45/1043481345.db2.gz ZCONMIPWZFIIIM-HNNXBMFYSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@H]3c3cccnc3)sc2c1 ZINC000348908310 1043481350 /nfs/dbraw/zinc/48/13/50/1043481350.db2.gz ZCONMIPWZFIIIM-HNNXBMFYSA-N 1 2 313.401 4.168 20 0 DIADLO C[C@H]1CC[C@@H]([NH2+]Cc2nnc(-c3ccccc3)[nH]2)c2ccccc21 ZINC000777576613 1043481855 /nfs/dbraw/zinc/48/18/55/1043481855.db2.gz XFTDJAFKKBSSSW-KBXCAEBGSA-N 1 2 318.424 4.200 20 0 DIADLO CC1(Cc2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)CCCC1 ZINC000558299692 1043485449 /nfs/dbraw/zinc/48/54/49/1043485449.db2.gz JOPRXDKKNCGCON-UHFFFAOYSA-N 1 2 322.412 4.104 20 0 DIADLO Cn1ccc2cccc(NCc3c[nH+]cn3Cc3ccccc3)c21 ZINC000349192960 1043496363 /nfs/dbraw/zinc/49/63/63/1043496363.db2.gz SXSCQHAQQWIQJO-UHFFFAOYSA-N 1 2 316.408 4.035 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@@H]1CCCOc2cc(F)ccc21 ZINC000925970561 1043500501 /nfs/dbraw/zinc/50/05/01/1043500501.db2.gz VZCDNJGYVYIMPK-HUUCEWRRSA-N 1 2 316.376 4.003 20 0 DIADLO CC[C@H]1CC[C@H]1Nc1cccc(C[N@H+](C)Cc2cscn2)c1 ZINC000558403900 1043501631 /nfs/dbraw/zinc/50/16/31/1043501631.db2.gz POXUUGYUEAUMBA-MAUKXSAKSA-N 1 2 315.486 4.376 20 0 DIADLO CC[C@H]1CC[C@H]1Nc1cccc(C[N@@H+](C)Cc2cscn2)c1 ZINC000558403900 1043501644 /nfs/dbraw/zinc/50/16/44/1043501644.db2.gz POXUUGYUEAUMBA-MAUKXSAKSA-N 1 2 315.486 4.376 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)CC(=O)N1[C@H](C)CCC[C@@H]1C ZINC000521921940 1043504774 /nfs/dbraw/zinc/50/47/74/1043504774.db2.gz PIHWFXHXQNFYDX-ZNMIVQPWSA-N 1 2 322.880 4.122 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)CC(=O)N1[C@H](C)CCC[C@@H]1C ZINC000521921940 1043504789 /nfs/dbraw/zinc/50/47/89/1043504789.db2.gz PIHWFXHXQNFYDX-ZNMIVQPWSA-N 1 2 322.880 4.122 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)CC(=O)N1[C@@H](C)CCC[C@@H]1C ZINC000521921939 1043504812 /nfs/dbraw/zinc/50/48/12/1043504812.db2.gz PIHWFXHXQNFYDX-SOUVJXGZSA-N 1 2 322.880 4.122 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)CC(=O)N1[C@@H](C)CCC[C@@H]1C ZINC000521921939 1043504829 /nfs/dbraw/zinc/50/48/29/1043504829.db2.gz PIHWFXHXQNFYDX-SOUVJXGZSA-N 1 2 322.880 4.122 20 0 DIADLO C[C@@H](Nc1ccc([NH+]2CCCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000320139416 1043510952 /nfs/dbraw/zinc/51/09/52/1043510952.db2.gz HZAXRQYKYYJZOU-CQSZACIVSA-N 1 2 311.385 4.368 20 0 DIADLO CC(C)OC1CC[NH+](Cc2cc(Cl)sc2Cl)CC1 ZINC000521969879 1043518169 /nfs/dbraw/zinc/51/81/69/1043518169.db2.gz BKCPXGOABKXZJW-UHFFFAOYSA-N 1 2 308.274 4.444 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)s1 ZINC000349727955 1043519824 /nfs/dbraw/zinc/51/98/24/1043519824.db2.gz CAHOAQZYSOXWPP-ZDUSSCGKSA-N 1 2 307.850 4.092 20 0 DIADLO FC(F)(F)c1cscc1C[NH2+]Cc1ncc(Cl)s1 ZINC000873166094 1043521620 /nfs/dbraw/zinc/52/16/20/1043521620.db2.gz UFVISBZCRZMTLS-UHFFFAOYSA-N 1 2 312.769 4.167 20 0 DIADLO Fc1cc(C[N@@H+]2CCc3ccsc3C2)cc(C(F)(F)F)c1 ZINC001137864839 1043535723 /nfs/dbraw/zinc/53/57/23/1043535723.db2.gz OEQPZARPVRAKBG-UHFFFAOYSA-N 1 2 315.335 4.464 20 0 DIADLO Fc1cc(C[N@H+]2CCc3ccsc3C2)cc(C(F)(F)F)c1 ZINC001137864839 1043535728 /nfs/dbraw/zinc/53/57/28/1043535728.db2.gz OEQPZARPVRAKBG-UHFFFAOYSA-N 1 2 315.335 4.464 20 0 DIADLO Cc1nocc1C[N@@H+]1CCc2sccc2[C@H]1c1cccs1 ZINC000350314264 1043541808 /nfs/dbraw/zinc/54/18/08/1043541808.db2.gz KKHQJSKWOJTUAZ-INIZCTEOSA-N 1 2 316.451 4.254 20 0 DIADLO Cc1nocc1C[N@H+]1CCc2sccc2[C@H]1c1cccs1 ZINC000350314264 1043541816 /nfs/dbraw/zinc/54/18/16/1043541816.db2.gz KKHQJSKWOJTUAZ-INIZCTEOSA-N 1 2 316.451 4.254 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2nnc(C(C)(C)C)o2)cc1 ZINC000124580436 1043547243 /nfs/dbraw/zinc/54/72/43/1043547243.db2.gz OYUASVSICGMLLV-INIZCTEOSA-N 1 2 313.445 4.403 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2nnc(C(C)(C)C)o2)cc1 ZINC000124580436 1043547247 /nfs/dbraw/zinc/54/72/47/1043547247.db2.gz OYUASVSICGMLLV-INIZCTEOSA-N 1 2 313.445 4.403 20 0 DIADLO FC1(F)CC([NH2+][C@@H](c2cc3ccccc3o2)c2ccccn2)C1 ZINC000926282725 1043557561 /nfs/dbraw/zinc/55/75/61/1043557561.db2.gz GMOGTXIUWGMYIG-QGZVFWFLSA-N 1 2 314.335 4.305 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)C1CCC(F)(F)CC1 ZINC000474066994 1043564481 /nfs/dbraw/zinc/56/44/81/1043564481.db2.gz NYRVCOONSUPBGG-ZDUSSCGKSA-N 1 2 309.404 4.308 20 0 DIADLO Cc1cccc(C2([NH2+][C@@H](c3nnc[nH]3)C3CCCCC3)CCC2)c1 ZINC000639283017 1043574328 /nfs/dbraw/zinc/57/43/28/1043574328.db2.gz IADFGWUICUPLDP-GOSISDBHSA-N 1 2 324.472 4.404 20 0 DIADLO Fc1ccc2ccnc(NCc3ccccc3-n3cc[nH+]c3)c2c1 ZINC000443503272 1043581933 /nfs/dbraw/zinc/58/19/33/1043581933.db2.gz YFRCWUBXAPQMIH-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO CCc1nc(C)c(C[NH2+][C@@H](c2ccc(C)cc2)c2cccnc2)o1 ZINC000926477025 1043582856 /nfs/dbraw/zinc/58/28/56/1043582856.db2.gz IQMQMKUQTSMXDD-FQEVSTJZSA-N 1 2 321.424 4.128 20 0 DIADLO CSCc1cnc(C[N@H+](C)Cc2cccc3[nH]ccc32)s1 ZINC000353201587 1043591361 /nfs/dbraw/zinc/59/13/61/1043591361.db2.gz MYRAEOAWTYURAN-UHFFFAOYSA-N 1 2 317.483 4.119 20 0 DIADLO CSCc1cnc(C[N@@H+](C)Cc2cccc3[nH]ccc32)s1 ZINC000353201587 1043591368 /nfs/dbraw/zinc/59/13/68/1043591368.db2.gz MYRAEOAWTYURAN-UHFFFAOYSA-N 1 2 317.483 4.119 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(C(F)F)n1)c1cc2cccc(F)c2o1 ZINC000353234686 1043592204 /nfs/dbraw/zinc/59/22/04/1043592204.db2.gz IRNKVHBGBSTYTG-SECBINFHSA-N 1 2 309.291 4.014 20 0 DIADLO FC(F)Oc1c(Cl)cc(Cl)cc1C[NH2+]Cc1ccco1 ZINC000113312293 1043593639 /nfs/dbraw/zinc/59/36/39/1043593639.db2.gz WHXVMHXLMAPIIG-UHFFFAOYSA-N 1 2 322.138 4.478 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@H](c1ccc(C)cc1)c1cccnc1 ZINC000926532940 1043594440 /nfs/dbraw/zinc/59/44/40/1043594440.db2.gz OCDGURVFMUCGFJ-QFBILLFUSA-N 1 2 320.440 4.047 20 0 DIADLO Cc1ccccc1C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1ccco1 ZINC000926532340 1043595626 /nfs/dbraw/zinc/59/56/26/1043595626.db2.gz LJHBVOLXRSRZGH-BPQIPLTHSA-N 1 2 321.424 4.364 20 0 DIADLO C[NH+](C)c1ccc(N[C@H](C[C@@H]2CCOC2)c2ccccc2)cc1 ZINC000777602306 1043602576 /nfs/dbraw/zinc/60/25/76/1043602576.db2.gz KHYLQAIVNVJALG-OXJNMPFZSA-N 1 2 310.441 4.332 20 0 DIADLO C[C@H]([NH2+]Cc1nccc(C(F)(F)F)n1)c1coc2ccccc21 ZINC000926585748 1043604061 /nfs/dbraw/zinc/60/40/61/1043604061.db2.gz NFXZYFLNGYSIEF-JTQLQIEISA-N 1 2 321.302 4.092 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1cnc(C3CCC3)s1)CC2 ZINC000353476070 1043609502 /nfs/dbraw/zinc/60/95/02/1043609502.db2.gz ZTFWGJSPMNUKJX-UHFFFAOYSA-N 1 2 302.418 4.108 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1cnc(C3CCC3)s1)CC2 ZINC000353476070 1043609506 /nfs/dbraw/zinc/60/95/06/1043609506.db2.gz ZTFWGJSPMNUKJX-UHFFFAOYSA-N 1 2 302.418 4.108 20 0 DIADLO C[C@H]1C[N@H+](CCCCC(F)(F)F)C[C@@H](c2ccc(F)cc2)O1 ZINC000443598650 1043612404 /nfs/dbraw/zinc/61/24/04/1043612404.db2.gz AUWQKEBIFCJZMF-WFASDCNBSA-N 1 2 319.342 4.320 20 0 DIADLO C[C@H]1C[N@@H+](CCCCC(F)(F)F)C[C@@H](c2ccc(F)cc2)O1 ZINC000443598650 1043612409 /nfs/dbraw/zinc/61/24/09/1043612409.db2.gz AUWQKEBIFCJZMF-WFASDCNBSA-N 1 2 319.342 4.320 20 0 DIADLO CSc1ccc(/C=C/C(=O)Nc2c(C)cc(C)[nH+]c2C)s1 ZINC000875097441 1043614935 /nfs/dbraw/zinc/61/49/35/1043614935.db2.gz KMQCVVZIGFMSPX-FNORWQNLSA-N 1 2 318.467 4.442 20 0 DIADLO Clc1ccnc2c1CCC[C@@H]2[NH2+]Cc1noc2ccccc12 ZINC000926679908 1043616920 /nfs/dbraw/zinc/61/69/20/1043616920.db2.gz WYJJATQWFLDQPL-AWEZNQCLSA-N 1 2 313.788 4.043 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(SC(C)C)cc2)s1 ZINC000353573199 1043619077 /nfs/dbraw/zinc/61/90/77/1043619077.db2.gz USLHFHJVRHDDCJ-LLVKDONJSA-N 1 2 307.488 4.198 20 0 DIADLO Cc1ccc(C(C)(C)[NH2+]Cc2ncc(-c3cccs3)o2)cn1 ZINC000353582905 1043620384 /nfs/dbraw/zinc/62/03/84/1043620384.db2.gz URJAUCHEWSVFGX-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO CC(C)C[C@H]1CCC[N@H+](Cc2nc(C(F)(F)F)cs2)C1 ZINC000443612694 1043620722 /nfs/dbraw/zinc/62/07/22/1043620722.db2.gz GMNMESRDWNSSNX-LLVKDONJSA-N 1 2 306.397 4.420 20 0 DIADLO CC(C)C[C@H]1CCC[N@@H+](Cc2nc(C(F)(F)F)cs2)C1 ZINC000443612694 1043620727 /nfs/dbraw/zinc/62/07/27/1043620727.db2.gz GMNMESRDWNSSNX-LLVKDONJSA-N 1 2 306.397 4.420 20 0 DIADLO C[N@@H+](Cc1coc2ccccc12)Cc1nc2c(s1)CCCC2 ZINC000353593111 1043621070 /nfs/dbraw/zinc/62/10/70/1043621070.db2.gz WJKQFJNZSHQERL-UHFFFAOYSA-N 1 2 312.438 4.400 20 0 DIADLO C[N@H+](Cc1coc2ccccc12)Cc1nc2c(s1)CCCC2 ZINC000353593111 1043621074 /nfs/dbraw/zinc/62/10/74/1043621074.db2.gz WJKQFJNZSHQERL-UHFFFAOYSA-N 1 2 312.438 4.400 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2nc3c(s2)CCCC3)cc1 ZINC000353589582 1043621473 /nfs/dbraw/zinc/62/14/73/1043621473.db2.gz QPQWWMXFSFOYTO-UHFFFAOYSA-N 1 2 316.470 4.053 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2nc3c(s2)CCCC3)cc1 ZINC000353589582 1043621479 /nfs/dbraw/zinc/62/14/79/1043621479.db2.gz QPQWWMXFSFOYTO-UHFFFAOYSA-N 1 2 316.470 4.053 20 0 DIADLO CC[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccc2c(c1)OCCO2 ZINC000777602556 1043622701 /nfs/dbraw/zinc/62/27/01/1043622701.db2.gz QXLUDWBHRZFVQL-QGZVFWFLSA-N 1 2 312.413 4.087 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+][C@H]2COCc3cccc(Cl)c32)s1 ZINC000926785995 1043633934 /nfs/dbraw/zinc/63/39/34/1043633934.db2.gz KSHLQNMVTCYSFB-RNCFNFMXSA-N 1 2 308.834 4.027 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+](C)Cc3cccc(C)n3)s2)o1 ZINC000353746077 1043638694 /nfs/dbraw/zinc/63/86/94/1043638694.db2.gz KTAIIQDNMUBZOC-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+](C)Cc3cccc(C)n3)s2)o1 ZINC000353746077 1043638699 /nfs/dbraw/zinc/63/86/99/1043638699.db2.gz KTAIIQDNMUBZOC-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ccc(-c3ccncc3)cc2F)n1 ZINC000353750618 1043641015 /nfs/dbraw/zinc/64/10/15/1043641015.db2.gz WBWOTGHQHZCAQG-UHFFFAOYSA-N 1 2 321.399 4.223 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ccc(-c3ccncc3)cc2F)n1 ZINC000353750618 1043641020 /nfs/dbraw/zinc/64/10/20/1043641020.db2.gz WBWOTGHQHZCAQG-UHFFFAOYSA-N 1 2 321.399 4.223 20 0 DIADLO Clc1cscc1C[NH2+][C@@H]1COCc2cccc(Cl)c21 ZINC000926868475 1043646392 /nfs/dbraw/zinc/64/63/92/1043646392.db2.gz OTCPXLNZEYXWCE-CYBMUJFWSA-N 1 2 314.237 4.416 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2ccccc2C(F)(F)F)c(C)s1 ZINC000443673599 1043657085 /nfs/dbraw/zinc/65/70/85/1043657085.db2.gz KGCJHNQVDGMBLY-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2ccccc2C(F)(F)F)c(C)s1 ZINC000443673599 1043657091 /nfs/dbraw/zinc/65/70/91/1043657091.db2.gz KGCJHNQVDGMBLY-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cnn(C2CCCC2)c1)c1c(F)cncc1F ZINC000353927902 1043659023 /nfs/dbraw/zinc/65/90/23/1043659023.db2.gz WYFKWAZMBYNEHG-NWDGAFQWSA-N 1 2 320.387 4.083 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cnc2ccsc2c1 ZINC000353931741 1043659645 /nfs/dbraw/zinc/65/96/45/1043659645.db2.gz JRKCMCHJJRSLKE-UWVGGRQHSA-N 1 2 319.380 4.381 20 0 DIADLO COCc1nc(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccc(C)o2)cs1 ZINC000353934316 1043662214 /nfs/dbraw/zinc/66/22/14/1043662214.db2.gz PQYRZCDSDKEADA-IUODEOHRSA-N 1 2 320.458 4.164 20 0 DIADLO COCc1nc(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccc(C)o2)cs1 ZINC000353934316 1043662222 /nfs/dbraw/zinc/66/22/22/1043662222.db2.gz PQYRZCDSDKEADA-IUODEOHRSA-N 1 2 320.458 4.164 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ncc(C)cc1C)c1ncccc1Cl ZINC000926960856 1043664183 /nfs/dbraw/zinc/66/41/83/1043664183.db2.gz QSAXVXGLXIQPKL-OAHLLOKOSA-N 1 2 303.837 4.378 20 0 DIADLO COc1cc(Cl)c(Cl)cc1Nc1ccn2cc[nH+]c2c1 ZINC001204998364 1043673787 /nfs/dbraw/zinc/67/37/87/1043673787.db2.gz XRQHCVCNXHPCDE-UHFFFAOYSA-N 1 2 308.168 4.393 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1cc(F)c(F)cc1F ZINC000191633240 1043677311 /nfs/dbraw/zinc/67/73/11/1043677311.db2.gz HRWJNZPNTVIGJK-UHFFFAOYSA-N 1 2 315.722 4.056 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1coc2cc(F)ccc12 ZINC000354104578 1043681448 /nfs/dbraw/zinc/68/14/48/1043681448.db2.gz QCDZZFDVQYNNQG-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO CCCC[C@@H](CC)CC(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927092362 1043684357 /nfs/dbraw/zinc/68/43/57/1043684357.db2.gz VWBMHLBICUOESN-MRXNPFEDSA-N 1 2 317.477 4.091 20 0 DIADLO CC(C)Cc1noc(C[N@H+](Cc2ccc(F)cc2)C(C)(C)C)n1 ZINC000474173708 1043687293 /nfs/dbraw/zinc/68/72/93/1043687293.db2.gz JOYAODKYFIOFJE-UHFFFAOYSA-N 1 2 319.424 4.208 20 0 DIADLO CC(C)Cc1noc(C[N@@H+](Cc2ccc(F)cc2)C(C)(C)C)n1 ZINC000474173708 1043687300 /nfs/dbraw/zinc/68/73/00/1043687300.db2.gz JOYAODKYFIOFJE-UHFFFAOYSA-N 1 2 319.424 4.208 20 0 DIADLO Cc1ncsc1C[N@@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000559079511 1043691162 /nfs/dbraw/zinc/69/11/62/1043691162.db2.gz GWLZQJFSEVLREG-OAHLLOKOSA-N 1 2 310.825 4.176 20 0 DIADLO Cc1ncsc1C[N@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000559079511 1043691167 /nfs/dbraw/zinc/69/11/67/1043691167.db2.gz GWLZQJFSEVLREG-OAHLLOKOSA-N 1 2 310.825 4.176 20 0 DIADLO Cc1ncsc1C[N@@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000559079510 1043691696 /nfs/dbraw/zinc/69/16/96/1043691696.db2.gz GWLZQJFSEVLREG-HNNXBMFYSA-N 1 2 310.825 4.176 20 0 DIADLO Cc1ncsc1C[N@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000559079510 1043691699 /nfs/dbraw/zinc/69/16/99/1043691699.db2.gz GWLZQJFSEVLREG-HNNXBMFYSA-N 1 2 310.825 4.176 20 0 DIADLO CCc1onc(C)c1C[NH2+][C@@H](c1cccc(C)c1)c1ccccn1 ZINC000927131290 1043694618 /nfs/dbraw/zinc/69/46/18/1043694618.db2.gz ITENSWUBNDCTAV-FQEVSTJZSA-N 1 2 321.424 4.128 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2ccc(Cl)nn2)C2CC2)o1 ZINC000876570202 1043697009 /nfs/dbraw/zinc/69/70/09/1043697009.db2.gz WMAHIWFAIOFOQR-IAQYHMDHSA-N 1 2 317.820 4.011 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2ccc(Cl)nn2)C2CC2)o1 ZINC000876570202 1043697013 /nfs/dbraw/zinc/69/70/13/1043697013.db2.gz WMAHIWFAIOFOQR-IAQYHMDHSA-N 1 2 317.820 4.011 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1coc2cc(F)ccc12 ZINC000354401315 1043698735 /nfs/dbraw/zinc/69/87/35/1043698735.db2.gz ZSKITFHBQXQTEL-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1cc(Cl)cc2c1OCC2 ZINC000927140792 1043698843 /nfs/dbraw/zinc/69/88/43/1043698843.db2.gz PGAHWGSSDRSHRZ-ZJUUUORDSA-N 1 2 308.834 4.143 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc3c(ccnc3Cl)o2)on1 ZINC000876617046 1043699665 /nfs/dbraw/zinc/69/96/65/1043699665.db2.gz FAROYOAVPRZJJX-CYBMUJFWSA-N 1 2 317.776 4.115 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cc3c(ccnc3Cl)o2)on1 ZINC000876617046 1043699672 /nfs/dbraw/zinc/69/96/72/1043699672.db2.gz FAROYOAVPRZJJX-CYBMUJFWSA-N 1 2 317.776 4.115 20 0 DIADLO C[N@H+](Cc1nc(-c2ccccc2)c[nH]1)Cc1ccc(CF)cc1 ZINC000777621262 1043710802 /nfs/dbraw/zinc/71/08/02/1043710802.db2.gz NIUSWJNSRYZMRL-UHFFFAOYSA-N 1 2 309.388 4.178 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccccc2)c[nH]1)Cc1ccc(CF)cc1 ZINC000777621262 1043710815 /nfs/dbraw/zinc/71/08/15/1043710815.db2.gz NIUSWJNSRYZMRL-UHFFFAOYSA-N 1 2 309.388 4.178 20 0 DIADLO CCO[P@@](C)(=O)CC[C@@H](C)Nc1ccc([NH+](C)C)cc1C ZINC000876817602 1043713326 /nfs/dbraw/zinc/71/33/26/1043713326.db2.gz CGCYRYGKFXETRR-SPLOXXLWSA-N 1 2 312.394 4.196 20 0 DIADLO CCO[P@@](C)(=O)CC[C@@H](C)[NH2+]c1ccc(N(C)C)cc1C ZINC000876817602 1043713337 /nfs/dbraw/zinc/71/33/37/1043713337.db2.gz CGCYRYGKFXETRR-SPLOXXLWSA-N 1 2 312.394 4.196 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)[NH2+]c1ccc(N(C)C)c(C)c1 ZINC000876845307 1043717250 /nfs/dbraw/zinc/71/72/50/1043717250.db2.gz QONSVOJSEMATBO-QKKBWIMNSA-N 1 2 312.394 4.196 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)Nc1ccc([NH+](C)C)c(C)c1 ZINC000876845307 1043717258 /nfs/dbraw/zinc/71/72/58/1043717258.db2.gz QONSVOJSEMATBO-QKKBWIMNSA-N 1 2 312.394 4.196 20 0 DIADLO Cc1cc([NH2+][C@H](C)[C@H]2CC2(F)F)ccc1N1CCSCC1 ZINC000876854448 1043718418 /nfs/dbraw/zinc/71/84/18/1043718418.db2.gz GWZBNOAKCLEUPV-TZMCWYRMSA-N 1 2 312.429 4.004 20 0 DIADLO CC(C)Cc1ncc(C[N@@H+]2CCc3cc(F)ccc3C2)s1 ZINC000354771420 1043719701 /nfs/dbraw/zinc/71/97/01/1043719701.db2.gz UEKRKKXZSAWPKH-UHFFFAOYSA-N 1 2 304.434 4.039 20 0 DIADLO CC(C)Cc1ncc(C[N@H+]2CCc3cc(F)ccc3C2)s1 ZINC000354771420 1043719709 /nfs/dbraw/zinc/71/97/09/1043719709.db2.gz UEKRKKXZSAWPKH-UHFFFAOYSA-N 1 2 304.434 4.039 20 0 DIADLO Cc1cc(N[C@@H]2CCc3c2cc(F)cc3F)ccc1[NH+](C)C ZINC000777643263 1043725433 /nfs/dbraw/zinc/72/54/33/1043725433.db2.gz LZPZEKMEECRLPK-QGZVFWFLSA-N 1 2 302.368 4.439 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc([NH+](C)C)c(C)c2)c(F)c1 ZINC000777643257 1043726252 /nfs/dbraw/zinc/72/62/52/1043726252.db2.gz LQXOCJUMKWWCOB-CYBMUJFWSA-N 1 2 302.393 4.382 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(Cl)cs1)c1ccc(F)cc1F ZINC000877050372 1043737811 /nfs/dbraw/zinc/73/78/11/1043737811.db2.gz MAZYXZBTKAMYAU-NSHDSACASA-N 1 2 302.777 4.316 20 0 DIADLO CC(C)=CCC[C@H](C)[NH2+]c1ccc(N2CCO[C@@H](C)C2)cc1 ZINC000777693858 1043759821 /nfs/dbraw/zinc/75/98/21/1043759821.db2.gz NWKVBUQMBGTGIZ-IRXDYDNUSA-N 1 2 302.462 4.459 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1cccnc1Cl ZINC000777705299 1043766505 /nfs/dbraw/zinc/76/65/05/1043766505.db2.gz PWZWQABXIGJSHW-CYBMUJFWSA-N 1 2 316.836 4.293 20 0 DIADLO Clc1cccc(C2=CC[N@H+](Cc3ccc(Cl)nn3)CC2)c1 ZINC000877491270 1043766626 /nfs/dbraw/zinc/76/66/26/1043766626.db2.gz PWDSPOYLGQKCMG-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1cccc(C2=CC[N@@H+](Cc3ccc(Cl)nn3)CC2)c1 ZINC000877491270 1043766633 /nfs/dbraw/zinc/76/66/33/1043766633.db2.gz PWDSPOYLGQKCMG-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Cc1nc(C[N@H+]2CC=C(c3cccc(Cl)c3)CC2)cs1 ZINC000355421519 1043766755 /nfs/dbraw/zinc/76/67/55/1043766755.db2.gz OVOLFDZUIBOGOB-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO Cc1nc(C[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)cs1 ZINC000355421519 1043766762 /nfs/dbraw/zinc/76/67/62/1043766762.db2.gz OVOLFDZUIBOGOB-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO CC(C)c1ccc(-c2ncc(C[N@@H+]3CCO[C@H](C)C3)s2)cc1 ZINC000096999563 1043773713 /nfs/dbraw/zinc/77/37/13/1043773713.db2.gz XPSGJZJMVVQZPX-CQSZACIVSA-N 1 2 316.470 4.154 20 0 DIADLO CC(C)c1ccc(-c2ncc(C[N@H+]3CCO[C@H](C)C3)s2)cc1 ZINC000096999563 1043773720 /nfs/dbraw/zinc/77/37/20/1043773720.db2.gz XPSGJZJMVVQZPX-CQSZACIVSA-N 1 2 316.470 4.154 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1nc2ccccc2s1 ZINC000096954352 1043775125 /nfs/dbraw/zinc/77/51/25/1043775125.db2.gz OPYCQUBVYICGJL-UHFFFAOYSA-N 1 2 312.438 4.327 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1nc2ccccc2s1 ZINC000096954352 1043775128 /nfs/dbraw/zinc/77/51/28/1043775128.db2.gz OPYCQUBVYICGJL-UHFFFAOYSA-N 1 2 312.438 4.327 20 0 DIADLO COc1ccc(NCc2[nH+]cc(C)c(OC)c2C)cc1SC ZINC000877583972 1043777362 /nfs/dbraw/zinc/77/73/62/1043777362.db2.gz NIYOUFAMHHJJKQ-UHFFFAOYSA-N 1 2 318.442 4.050 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cnccc2C)c(Br)c1 ZINC000355597672 1043779023 /nfs/dbraw/zinc/77/90/23/1043779023.db2.gz KQFWITKACWGJMD-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cnccc2C)c(Br)c1 ZINC000355597672 1043779034 /nfs/dbraw/zinc/77/90/34/1043779034.db2.gz KQFWITKACWGJMD-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO CCC[N@H+](Cc1nnc(CC)o1)[C@@H](C)c1cc2ccccc2o1 ZINC000053728487 1043779493 /nfs/dbraw/zinc/77/94/93/1043779493.db2.gz QMIUATYJRLGJHM-ZDUSSCGKSA-N 1 2 313.401 4.351 20 0 DIADLO CCC[N@@H+](Cc1nnc(CC)o1)[C@@H](C)c1cc2ccccc2o1 ZINC000053728487 1043779504 /nfs/dbraw/zinc/77/95/04/1043779504.db2.gz QMIUATYJRLGJHM-ZDUSSCGKSA-N 1 2 313.401 4.351 20 0 DIADLO Cc1ccncc1C[N@H+](C)Cc1ccc(-c2ccncc2)cc1F ZINC000355612991 1043780870 /nfs/dbraw/zinc/78/08/70/1043780870.db2.gz XTOBANIYRWIPBG-UHFFFAOYSA-N 1 2 321.399 4.223 20 0 DIADLO Cc1ccncc1C[N@@H+](C)Cc1ccc(-c2ccncc2)cc1F ZINC000355612991 1043780882 /nfs/dbraw/zinc/78/08/82/1043780882.db2.gz XTOBANIYRWIPBG-UHFFFAOYSA-N 1 2 321.399 4.223 20 0 DIADLO CCO[P@@](C)(=O)CC[C@@H](C)Nc1c[nH+]cc2c1CCCC2 ZINC000877621501 1043781131 /nfs/dbraw/zinc/78/11/31/1043781131.db2.gz XXLFYBGAQLORHC-LRTDBIEQSA-N 1 2 310.378 4.095 20 0 DIADLO C[C@H]1CCC[C@H](CC(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)C1 ZINC000355808850 1043787388 /nfs/dbraw/zinc/78/73/88/1043787388.db2.gz CQWUVUABWPLCFQ-KBPBESRZSA-N 1 2 315.392 4.166 20 0 DIADLO Cc1ccc(C[NH2+]C(C)(C)c2nc3cc(Cl)ccc3o2)o1 ZINC000877668723 1043788115 /nfs/dbraw/zinc/78/81/15/1043788115.db2.gz MMTBOYZFNKIODA-UHFFFAOYSA-N 1 2 304.777 4.408 20 0 DIADLO COc1ccc(C2CC2)c(NC2CCN(c3cccc[nH+]3)CC2)c1 ZINC000877768637 1043797715 /nfs/dbraw/zinc/79/77/15/1043797715.db2.gz HIGXWCWFWVCEJB-UHFFFAOYSA-N 1 2 323.440 4.049 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2ccnc(Cl)c2Cl)C1 ZINC000877812167 1043799374 /nfs/dbraw/zinc/79/93/74/1043799374.db2.gz IMGZCSDKKDPSPA-NSHDSACASA-N 1 2 313.150 4.163 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccnc(Cl)c2Cl)C1 ZINC000877812167 1043799388 /nfs/dbraw/zinc/79/93/88/1043799388.db2.gz IMGZCSDKKDPSPA-NSHDSACASA-N 1 2 313.150 4.163 20 0 DIADLO CCc1ncc(C[N@@H+]2CCC[C@H]2c2nc3ccccc3s2)o1 ZINC000929209581 1043799384 /nfs/dbraw/zinc/79/93/84/1043799384.db2.gz OFLAVNWXFWOMPZ-AWEZNQCLSA-N 1 2 313.426 4.184 20 0 DIADLO CCc1ncc(C[N@H+]2CCC[C@H]2c2nc3ccccc3s2)o1 ZINC000929209581 1043799393 /nfs/dbraw/zinc/79/93/93/1043799393.db2.gz OFLAVNWXFWOMPZ-AWEZNQCLSA-N 1 2 313.426 4.184 20 0 DIADLO CCc1ncc(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)o1 ZINC000929209582 1043801008 /nfs/dbraw/zinc/80/10/08/1043801008.db2.gz OFLAVNWXFWOMPZ-CQSZACIVSA-N 1 2 313.426 4.184 20 0 DIADLO CCc1ncc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)o1 ZINC000929209582 1043801028 /nfs/dbraw/zinc/80/10/28/1043801028.db2.gz OFLAVNWXFWOMPZ-CQSZACIVSA-N 1 2 313.426 4.184 20 0 DIADLO C[C@H]([NH2+]Cc1nc(Cl)cs1)c1ccc(C(F)(F)F)nc1 ZINC000877827980 1043802378 /nfs/dbraw/zinc/80/23/78/1043802378.db2.gz BPYFKZWXLBGTJV-ZETCQYMHSA-N 1 2 321.755 4.061 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1cc(O)cc(C(F)(F)F)c1 ZINC000356059977 1043803264 /nfs/dbraw/zinc/80/32/64/1043803264.db2.gz IJCOGXFWHADOJS-MRXNPFEDSA-N 1 2 324.346 4.087 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1cc(O)cc(C(F)(F)F)c1 ZINC000356059977 1043803287 /nfs/dbraw/zinc/80/32/87/1043803287.db2.gz IJCOGXFWHADOJS-MRXNPFEDSA-N 1 2 324.346 4.087 20 0 DIADLO COCC[N@H+](Cc1ccco1)Cc1cscc1C(F)(F)F ZINC000356079940 1043806747 /nfs/dbraw/zinc/80/67/47/1043806747.db2.gz CEMOKHRFPBKDTQ-UHFFFAOYSA-N 1 2 319.348 4.009 20 0 DIADLO COCC[N@@H+](Cc1ccco1)Cc1cscc1C(F)(F)F ZINC000356079940 1043806768 /nfs/dbraw/zinc/80/67/68/1043806768.db2.gz CEMOKHRFPBKDTQ-UHFFFAOYSA-N 1 2 319.348 4.009 20 0 DIADLO Cc1[nH]c(CN(C)[C@@H](C)c2cccc(C(F)(F)F)c2)c(C)[nH+]1 ZINC000929371049 1043815555 /nfs/dbraw/zinc/81/55/55/1043815555.db2.gz DGDYOYMMHPJBAL-NSHDSACASA-N 1 2 311.351 4.238 20 0 DIADLO FC(F)(F)c1cscc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000356301966 1043830892 /nfs/dbraw/zinc/83/08/92/1043830892.db2.gz LLZPRINCFNIIIW-AWEZNQCLSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cscc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000356301966 1043830909 /nfs/dbraw/zinc/83/09/09/1043830909.db2.gz LLZPRINCFNIIIW-AWEZNQCLSA-N 1 2 312.360 4.499 20 0 DIADLO c1coc(C[N@H+](Cc2nc3c(o2)CCCC3)C2CCCC2)c1 ZINC000877972979 1043833177 /nfs/dbraw/zinc/83/31/77/1043833177.db2.gz REMQRQQIHIHHSR-UHFFFAOYSA-N 1 2 300.402 4.091 20 0 DIADLO c1coc(C[N@@H+](Cc2nc3c(o2)CCCC3)C2CCCC2)c1 ZINC000877972979 1043833198 /nfs/dbraw/zinc/83/31/98/1043833198.db2.gz REMQRQQIHIHHSR-UHFFFAOYSA-N 1 2 300.402 4.091 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)co1 ZINC000929672335 1043833788 /nfs/dbraw/zinc/83/37/88/1043833788.db2.gz MGHRVGORPFMNJS-INIZCTEOSA-N 1 2 316.470 4.262 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCS[C@H](c3ccccc3)C2)co1 ZINC000929672335 1043833805 /nfs/dbraw/zinc/83/38/05/1043833805.db2.gz MGHRVGORPFMNJS-INIZCTEOSA-N 1 2 316.470 4.262 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CC(C)(C)CC(F)(F)F)cc2[nH+]1 ZINC000878032787 1043841947 /nfs/dbraw/zinc/84/19/47/1043841947.db2.gz JROITAKPVIETDA-UHFFFAOYSA-N 1 2 313.323 4.179 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cc(C(F)(F)F)co1)c1nccs1 ZINC000878254345 1043864176 /nfs/dbraw/zinc/86/41/76/1043864176.db2.gz STRVYIQQPVDBMB-GFCCVEGCSA-N 1 2 304.337 4.170 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2c(F)ccc(C)c2F)sc1C ZINC000930008348 1043864948 /nfs/dbraw/zinc/86/49/48/1043864948.db2.gz CGQULHNGJZYQDJ-UHFFFAOYSA-N 1 2 310.413 4.371 20 0 DIADLO Cc1ccc(CC(=O)Nc2c(C)cc(C)[nH+]c2C)c(Cl)c1 ZINC000474630595 1043865595 /nfs/dbraw/zinc/86/55/95/1043865595.db2.gz CVQHFOSXFPKBQY-UHFFFAOYSA-N 1 2 302.805 4.150 20 0 DIADLO CCc1ncc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3o2)o1 ZINC000930037231 1043869509 /nfs/dbraw/zinc/86/95/09/1043869509.db2.gz HSIZWJYCFMBOBV-OAHLLOKOSA-N 1 2 311.385 4.105 20 0 DIADLO CCc1ncc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3o2)o1 ZINC000930037231 1043869527 /nfs/dbraw/zinc/86/95/27/1043869527.db2.gz HSIZWJYCFMBOBV-OAHLLOKOSA-N 1 2 311.385 4.105 20 0 DIADLO Cc1cc(C)[nH+]c(CN(CCC(F)(F)F)CC(F)(F)F)c1 ZINC000930267266 1043907827 /nfs/dbraw/zinc/90/78/27/1043907827.db2.gz GSYMYODXNCGRCI-UHFFFAOYSA-N 1 2 314.273 4.015 20 0 DIADLO CC(C)([NH2+]Cc1ncccc1Br)c1ccccc1F ZINC000878644014 1043909037 /nfs/dbraw/zinc/90/90/37/1043909037.db2.gz SEKBBCXMLPAQBQ-UHFFFAOYSA-N 1 2 323.209 4.008 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@@H](C)c2cccnc2)sc1C(C)(C)C ZINC000930120189 1043878161 /nfs/dbraw/zinc/87/81/61/1043878161.db2.gz YNNVBLRPEOAKSW-ZDUSSCGKSA-N 1 2 303.475 4.337 20 0 DIADLO Cc1nc(C[N@H+](C)[C@@H](C)c2cccnc2)sc1C(C)(C)C ZINC000930120189 1043878180 /nfs/dbraw/zinc/87/81/80/1043878180.db2.gz YNNVBLRPEOAKSW-ZDUSSCGKSA-N 1 2 303.475 4.337 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1ccc(C)c(Cl)n1 ZINC000878367076 1043878323 /nfs/dbraw/zinc/87/83/23/1043878323.db2.gz JOUUDVXNLBRGIN-NSHDSACASA-N 1 2 308.784 4.042 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C(F)(F)F)co1)c1cccc(F)c1F ZINC000878376230 1043881633 /nfs/dbraw/zinc/88/16/33/1043881633.db2.gz OCASDZUKGLJVRL-MRVPVSSYSA-N 1 2 305.246 4.427 20 0 DIADLO Cc1cc([C@@H]([NH2+]Cc2nc3c(o2)CCCC3)C2CC2)ccc1F ZINC000878377840 1043881683 /nfs/dbraw/zinc/88/16/83/1043881683.db2.gz YTSZRAMALRFVAM-IBGZPJMESA-N 1 2 314.404 4.242 20 0 DIADLO Cc1ccc(C[NH2+][C@H](COCC(C)C)c2ccco2)nc1Cl ZINC000878408071 1043884642 /nfs/dbraw/zinc/88/46/42/1043884642.db2.gz IYQXQDYTFJJRTD-OAHLLOKOSA-N 1 2 322.836 4.140 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(C(F)(F)F)co1)c1nc(C)cs1 ZINC000878407802 1043886793 /nfs/dbraw/zinc/88/67/93/1043886793.db2.gz BFFQMSXIGSHQCH-NSHDSACASA-N 1 2 304.337 4.304 20 0 DIADLO FC1(F)CCC[C@H]1CC[N@@H+]1CCSC[C@@H]1c1nccs1 ZINC000878447298 1043892293 /nfs/dbraw/zinc/89/22/93/1043892293.db2.gz LISFUQCISVFMRM-NWDGAFQWSA-N 1 2 318.458 4.059 20 0 DIADLO FC1(F)CCC[C@H]1CC[N@H+]1CCSC[C@@H]1c1nccs1 ZINC000878447298 1043892307 /nfs/dbraw/zinc/89/23/07/1043892307.db2.gz LISFUQCISVFMRM-NWDGAFQWSA-N 1 2 318.458 4.059 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cc(C(F)(F)F)co2)C1 ZINC000878429076 1043892569 /nfs/dbraw/zinc/89/25/69/1043892569.db2.gz WAPHZKBWVVZJAS-ABAIWWIYSA-N 1 2 310.319 4.277 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(C(F)(F)F)co2)C1 ZINC000878429076 1043892587 /nfs/dbraw/zinc/89/25/87/1043892587.db2.gz WAPHZKBWVVZJAS-ABAIWWIYSA-N 1 2 310.319 4.277 20 0 DIADLO FC1(F)CCC[C@@H]1CC[N@@H+]1CCSC[C@H]1c1nccs1 ZINC000878447297 1043892853 /nfs/dbraw/zinc/89/28/53/1043892853.db2.gz LISFUQCISVFMRM-NEPJUHHUSA-N 1 2 318.458 4.059 20 0 DIADLO FC1(F)CCC[C@@H]1CC[N@H+]1CCSC[C@H]1c1nccs1 ZINC000878447297 1043892871 /nfs/dbraw/zinc/89/28/71/1043892871.db2.gz LISFUQCISVFMRM-NEPJUHHUSA-N 1 2 318.458 4.059 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1nc(C)c(C(C)(C)C)s1 ZINC000930223589 1043899638 /nfs/dbraw/zinc/89/96/38/1043899638.db2.gz VHDNXIJVXNBFOJ-SECBINFHSA-N 1 2 307.463 4.205 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(C(F)(F)F)co1 ZINC000878534219 1043900940 /nfs/dbraw/zinc/90/09/40/1043900940.db2.gz MDYJPQMNXLOODN-OIBJUYFYSA-N 1 2 301.230 4.071 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(C(F)(F)F)co1 ZINC000878534219 1043900954 /nfs/dbraw/zinc/90/09/54/1043900954.db2.gz MDYJPQMNXLOODN-OIBJUYFYSA-N 1 2 301.230 4.071 20 0 DIADLO CCC[C@@H]([NH2+]Cc1c(F)cncc1F)c1ccc(F)cc1F ZINC000930233614 1043901060 /nfs/dbraw/zinc/90/10/60/1043901060.db2.gz RZUWEXRKGIEEQM-MRXNPFEDSA-N 1 2 312.310 4.269 20 0 DIADLO CCC[C@H]([NH2+]Cc1c(F)cncc1F)c1ccc(F)cc1F ZINC000930233613 1043901704 /nfs/dbraw/zinc/90/17/04/1043901704.db2.gz RZUWEXRKGIEEQM-INIZCTEOSA-N 1 2 312.310 4.269 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)nc2ccccc12 ZINC000561157739 1043904300 /nfs/dbraw/zinc/90/43/00/1043904300.db2.gz YBAFOZMUCPDBLS-UHFFFAOYSA-N 1 2 323.827 4.371 20 0 DIADLO CCOc1ccccc1C1=CC[N@@H+]([C@@H](C)c2ncc(C)o2)CC1 ZINC000356985193 1043904224 /nfs/dbraw/zinc/90/42/24/1043904224.db2.gz NMUMAIAAMXYACK-HNNXBMFYSA-N 1 2 312.413 4.232 20 0 DIADLO CCOc1ccccc1C1=CC[N@H+]([C@@H](C)c2ncc(C)o2)CC1 ZINC000356985193 1043904232 /nfs/dbraw/zinc/90/42/32/1043904232.db2.gz NMUMAIAAMXYACK-HNNXBMFYSA-N 1 2 312.413 4.232 20 0 DIADLO Fc1c(Br)ccc(Cl)c1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC001141892713 1043912192 /nfs/dbraw/zinc/91/21/92/1043912192.db2.gz VRIOEBJNDKKEGY-DTWKUNHWSA-N 1 2 318.617 4.226 20 0 DIADLO Fc1c(Br)ccc(Cl)c1C[N@H+]1C[C@H]2CC[C@@H]1C2 ZINC001141892713 1043912202 /nfs/dbraw/zinc/91/22/02/1043912202.db2.gz VRIOEBJNDKKEGY-DTWKUNHWSA-N 1 2 318.617 4.226 20 0 DIADLO CC(C)[N@H+](Cc1nccn1CC(F)F)[C@H](C)c1ccsc1 ZINC000878721905 1043915886 /nfs/dbraw/zinc/91/58/86/1043915886.db2.gz LDFNBNUREHEDDQ-GFCCVEGCSA-N 1 2 313.417 4.181 20 0 DIADLO CC(C)[N@@H+](Cc1nccn1CC(F)F)[C@H](C)c1ccsc1 ZINC000878721905 1043915894 /nfs/dbraw/zinc/91/58/94/1043915894.db2.gz LDFNBNUREHEDDQ-GFCCVEGCSA-N 1 2 313.417 4.181 20 0 DIADLO CC(C)(C)c1nc(C[NH+]2CCC(CC(F)(F)F)CC2)co1 ZINC000930372534 1043916501 /nfs/dbraw/zinc/91/65/01/1043916501.db2.gz BCWLYYBIMDQBOW-UHFFFAOYSA-N 1 2 304.356 4.137 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2ccc(Cl)cc2)n1)c1ccccn1 ZINC000357093733 1043916693 /nfs/dbraw/zinc/91/66/93/1043916693.db2.gz LXXJYTKXUYKTDQ-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO FC(F)(F)c1ccccc1C1CCN(c2cccc[nH+]2)CC1 ZINC000474781502 1043917186 /nfs/dbraw/zinc/91/71/86/1043917186.db2.gz ZHWSRHZAVNCCCP-UHFFFAOYSA-N 1 2 306.331 4.484 20 0 DIADLO CC[C@H]([NH2+]Cc1ncccc1Br)c1ccccc1F ZINC000878805387 1043921143 /nfs/dbraw/zinc/92/11/43/1043921143.db2.gz LDROPJKAFJRIHY-AWEZNQCLSA-N 1 2 323.209 4.224 20 0 DIADLO c1csc(C[N@H+](Cc2ccn(C3CCCC3)n2)C2CC2)c1 ZINC000357155184 1043922388 /nfs/dbraw/zinc/92/23/88/1043922388.db2.gz PBOZBMLYBMFOBT-UHFFFAOYSA-N 1 2 301.459 4.224 20 0 DIADLO c1csc(C[N@@H+](Cc2ccn(C3CCCC3)n2)C2CC2)c1 ZINC000357155184 1043922393 /nfs/dbraw/zinc/92/23/93/1043922393.db2.gz PBOZBMLYBMFOBT-UHFFFAOYSA-N 1 2 301.459 4.224 20 0 DIADLO CCc1cccc(F)c1C[NH2+]Cc1csc(-c2ccco2)n1 ZINC000474812463 1043928703 /nfs/dbraw/zinc/92/87/03/1043928703.db2.gz DNEZDSPHWOTBGB-UHFFFAOYSA-N 1 2 316.401 4.394 20 0 DIADLO CC(C)c1nn(-c2ccccc2)cc1C[N@H+](C)Cc1cccnc1 ZINC000357241067 1043932977 /nfs/dbraw/zinc/93/29/77/1043932977.db2.gz WLKZEJFNRZBOSL-UHFFFAOYSA-N 1 2 320.440 4.023 20 0 DIADLO CC(C)c1nn(-c2ccccc2)cc1C[N@@H+](C)Cc1cccnc1 ZINC000357241067 1043932988 /nfs/dbraw/zinc/93/29/88/1043932988.db2.gz WLKZEJFNRZBOSL-UHFFFAOYSA-N 1 2 320.440 4.023 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2c(Cl)cncc2Cl)s1 ZINC000879253010 1043953427 /nfs/dbraw/zinc/95/34/27/1043953427.db2.gz FQKPOMICWBOQOE-ZETCQYMHSA-N 1 2 302.230 4.004 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccoc2)no1)Cc1ccc(Cl)cc1 ZINC000357274090 1043936236 /nfs/dbraw/zinc/93/62/36/1043936236.db2.gz XZVDPNXFPLKXEK-UHFFFAOYSA-N 1 2 317.776 4.005 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccoc2)no1)Cc1ccc(Cl)cc1 ZINC000357274090 1043936247 /nfs/dbraw/zinc/93/62/47/1043936247.db2.gz XZVDPNXFPLKXEK-UHFFFAOYSA-N 1 2 317.776 4.005 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)Cc1ncc(C)s1 ZINC000357320611 1043937961 /nfs/dbraw/zinc/93/79/61/1043937961.db2.gz YSQGBZMCSFWZMD-UHFFFAOYSA-N 1 2 300.427 4.392 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)Cc1ncc(C)s1 ZINC000357320611 1043937978 /nfs/dbraw/zinc/93/79/78/1043937978.db2.gz YSQGBZMCSFWZMD-UHFFFAOYSA-N 1 2 300.427 4.392 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](Cc3ccncc3)C3CC3)co2)cc1 ZINC000357355983 1043942567 /nfs/dbraw/zinc/94/25/67/1043942567.db2.gz DJNSPWJTIKGIFZ-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](Cc3ccncc3)C3CC3)co2)cc1 ZINC000357355983 1043942572 /nfs/dbraw/zinc/94/25/72/1043942572.db2.gz DJNSPWJTIKGIFZ-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1cnc(C[N@@H+]2CCC[C@@H](Oc3ccccc3Cl)C2)s1 ZINC000357393733 1043947086 /nfs/dbraw/zinc/94/70/86/1043947086.db2.gz VGLFEFKHWFRGNL-CYBMUJFWSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1cnc(C[N@H+]2CCC[C@@H](Oc3ccccc3Cl)C2)s1 ZINC000357393733 1043947091 /nfs/dbraw/zinc/94/70/91/1043947091.db2.gz VGLFEFKHWFRGNL-CYBMUJFWSA-N 1 2 322.861 4.148 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1ccnc(Cl)c1Cl ZINC000290432730 1043952236 /nfs/dbraw/zinc/95/22/36/1043952236.db2.gz NESMZVKJKGTCDF-JTQLQIEISA-N 1 2 311.212 4.287 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ccnc(Cl)c1Cl ZINC000290432730 1043952253 /nfs/dbraw/zinc/95/22/53/1043952253.db2.gz NESMZVKJKGTCDF-JTQLQIEISA-N 1 2 311.212 4.287 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2nc(Cl)ccc2Cl)s1 ZINC000879252153 1043952859 /nfs/dbraw/zinc/95/28/59/1043952859.db2.gz IFPUKUZQVWOHOR-SSDOTTSWSA-N 1 2 302.230 4.004 20 0 DIADLO CC[N@H+](Cc1cnc(-c2ccccc2)[nH]1)[C@H](C)c1cccnc1 ZINC000290496729 1043958553 /nfs/dbraw/zinc/95/85/53/1043958553.db2.gz OWIAOEVVICUEIR-OAHLLOKOSA-N 1 2 306.413 4.055 20 0 DIADLO CC[N@@H+](Cc1cnc(-c2ccccc2)[nH]1)[C@H](C)c1cccnc1 ZINC000290496729 1043958557 /nfs/dbraw/zinc/95/85/57/1043958557.db2.gz OWIAOEVVICUEIR-OAHLLOKOSA-N 1 2 306.413 4.055 20 0 DIADLO Cc1cccc(C2([NH2+]Cc3nc(C(C)C)ns3)CCC2)c1 ZINC000930818104 1043966199 /nfs/dbraw/zinc/96/61/99/1043966199.db2.gz CKZNWLKLAPZFIG-UHFFFAOYSA-N 1 2 301.459 4.139 20 0 DIADLO COc1cccc(C[NH2+][C@H](Cc2ccccc2)c2ncco2)c1C ZINC000930894534 1043973097 /nfs/dbraw/zinc/97/30/97/1043973097.db2.gz LYFXMXVUORBURK-GOSISDBHSA-N 1 2 322.408 4.065 20 0 DIADLO C[C@@H](SCc1cc[nH+]c(N(C)C)c1)c1nc2ccccc2o1 ZINC000127847024 1043974253 /nfs/dbraw/zinc/97/42/53/1043974253.db2.gz XZKQTTOCUSSSAR-GFCCVEGCSA-N 1 2 313.426 4.283 20 0 DIADLO C[C@@H](c1ccc(F)nc1)[N@@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000930967492 1043979705 /nfs/dbraw/zinc/97/97/05/1043979705.db2.gz XVANUUNNVGJHIC-SUMWQHHRSA-N 1 2 300.377 4.492 20 0 DIADLO C[C@@H](c1ccc(F)nc1)[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000930967492 1043979716 /nfs/dbraw/zinc/97/97/16/1043979716.db2.gz XVANUUNNVGJHIC-SUMWQHHRSA-N 1 2 300.377 4.492 20 0 DIADLO Cc1nnsc1[C@H](C)[N@@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000930966521 1043979930 /nfs/dbraw/zinc/97/99/30/1043979930.db2.gz PWWXTYRMDFQUHZ-SWLSCSKDSA-N 1 2 303.431 4.118 20 0 DIADLO Cc1nnsc1[C@H](C)[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000930966521 1043979937 /nfs/dbraw/zinc/97/99/37/1043979937.db2.gz PWWXTYRMDFQUHZ-SWLSCSKDSA-N 1 2 303.431 4.118 20 0 DIADLO Cc1ccc2c(c1C)OC[C@H]2[NH2+]Cc1ccnc(Cl)c1Cl ZINC000290791925 1043988577 /nfs/dbraw/zinc/98/85/77/1043988577.db2.gz DFWNNALUTNMNFJ-CYBMUJFWSA-N 1 2 323.223 4.229 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCC[C@H]2c2cncc(C)c2)n1 ZINC000879750519 1043989415 /nfs/dbraw/zinc/98/94/15/1043989415.db2.gz WFSYCDBACAVQGV-IBGZPJMESA-N 1 2 312.461 4.285 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCC[C@H]2c2cncc(C)c2)n1 ZINC000879750519 1043989425 /nfs/dbraw/zinc/98/94/25/1043989425.db2.gz WFSYCDBACAVQGV-IBGZPJMESA-N 1 2 312.461 4.285 20 0 DIADLO CC[C@](C)([NH2+]Cc1ccnc(Cl)c1Cl)c1nccs1 ZINC000290809068 1043991145 /nfs/dbraw/zinc/99/11/45/1043991145.db2.gz FZAGQKJCEIKCQK-ZDUSSCGKSA-N 1 2 316.257 4.260 20 0 DIADLO Cc1coc(C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)c1 ZINC000879776158 1043991831 /nfs/dbraw/zinc/99/18/31/1043991831.db2.gz IXTCXHPETAYWMI-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(Br)cc1F ZINC001141910813 1044000279 /nfs/dbraw/zinc/00/02/79/1044000279.db2.gz XWLUWCLHCLZPBH-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1cc(F)c(Br)cc1F ZINC001141910813 1044000296 /nfs/dbraw/zinc/00/02/96/1044000296.db2.gz XWLUWCLHCLZPBH-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+](Cn3ncsc3=S)CC2)cc1 ZINC000777969361 1044001385 /nfs/dbraw/zinc/00/13/85/1044001385.db2.gz IPUIPFFHVHONJY-GFCCVEGCSA-N 1 2 323.462 4.040 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+](Cn3ncsc3=S)CC2)cc1 ZINC000777969361 1044001390 /nfs/dbraw/zinc/00/13/90/1044001390.db2.gz IPUIPFFHVHONJY-GFCCVEGCSA-N 1 2 323.462 4.040 20 0 DIADLO Cc1nc(-c2ccc(C[NH2+][C@H](C)c3csc(C)n3)o2)cs1 ZINC000358022357 1044006375 /nfs/dbraw/zinc/00/63/75/1044006375.db2.gz OQAWOMVPJRMHCX-SECBINFHSA-N 1 2 319.455 4.327 20 0 DIADLO Cc1nc(-c2ccc(C[NH2+][C@@H](C)c3csc(C)n3)o2)cs1 ZINC000358022358 1044007135 /nfs/dbraw/zinc/00/71/35/1044007135.db2.gz OQAWOMVPJRMHCX-VIFPVBQESA-N 1 2 319.455 4.327 20 0 DIADLO CC(C)CCOC1CCN(c2[nH+]ccc3cc(F)ccc32)CC1 ZINC000521229898 1044012072 /nfs/dbraw/zinc/01/20/72/1044012072.db2.gz MHTTVBUWUOTLDD-UHFFFAOYSA-N 1 2 316.420 4.405 20 0 DIADLO CC1CCC(c2noc(-c3cccc(Cn4cc[nH+]c4)c3)n2)CC1 ZINC000561881662 1044018274 /nfs/dbraw/zinc/01/82/74/1044018274.db2.gz AIOKPOFXOJNOLR-UHFFFAOYSA-N 1 2 322.412 4.275 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2csc(-c3ccccc3)n2)c(C)n1 ZINC000358122341 1044021396 /nfs/dbraw/zinc/02/13/96/1044021396.db2.gz FPJBVGKOIVIKII-GFCCVEGCSA-N 1 2 324.453 4.068 20 0 DIADLO C[C@@H]1CCC[N@@H+]1Cc1cc(F)c(Br)cc1Cl ZINC001141920127 1044024274 /nfs/dbraw/zinc/02/42/74/1044024274.db2.gz MJUNXMYAAGRNAK-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@@H]1CCC[N@H+]1Cc1cc(F)c(Br)cc1Cl ZINC001141920127 1044024288 /nfs/dbraw/zinc/02/42/88/1044024288.db2.gz MJUNXMYAAGRNAK-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO Clc1cccc(C[N@@H+]2CC[C@H](Oc3ccccc3Cl)C2)n1 ZINC000128311675 1044024606 /nfs/dbraw/zinc/02/46/06/1044024606.db2.gz PTTMETGXLKPGPU-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cccc(C[N@H+]2CC[C@H](Oc3ccccc3Cl)C2)n1 ZINC000128311675 1044024614 /nfs/dbraw/zinc/02/46/14/1044024614.db2.gz PTTMETGXLKPGPU-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Cc1csc(C[NH+](Cc2ccccn2)Cc2ccccn2)c1 ZINC001137152654 1044031025 /nfs/dbraw/zinc/03/10/25/1044031025.db2.gz XHQGHPYCRXSMGY-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO CC[N@H+](Cc1nc([C@H](c2cccc(C)c2)C(C)C)no1)C1CC1 ZINC000561943316 1044032618 /nfs/dbraw/zinc/03/26/18/1044032618.db2.gz PZVXCEDHOIULJC-SFHVURJKSA-N 1 2 313.445 4.150 20 0 DIADLO CC[N@@H+](Cc1nc([C@H](c2cccc(C)c2)C(C)C)no1)C1CC1 ZINC000561943316 1044032635 /nfs/dbraw/zinc/03/26/35/1044032635.db2.gz PZVXCEDHOIULJC-SFHVURJKSA-N 1 2 313.445 4.150 20 0 DIADLO C[N@H+](Cc1cscc1Br)Cc1ccc(F)cc1 ZINC000561946476 1044034131 /nfs/dbraw/zinc/03/41/31/1044034131.db2.gz HVGLVKALZQOPQX-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[N@@H+](Cc1cscc1Br)Cc1ccc(F)cc1 ZINC000561946476 1044034143 /nfs/dbraw/zinc/03/41/43/1044034143.db2.gz HVGLVKALZQOPQX-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO S=c1sc(C2CC2)nn1C[N@@H+]1CCCC2(CCCC2)C1 ZINC000783544319 1044034618 /nfs/dbraw/zinc/03/46/18/1044034618.db2.gz YJNWQWFZGGJMEI-UHFFFAOYSA-N 1 2 309.504 4.165 20 0 DIADLO S=c1sc(C2CC2)nn1C[N@H+]1CCCC2(CCCC2)C1 ZINC000783544319 1044034634 /nfs/dbraw/zinc/03/46/34/1044034634.db2.gz YJNWQWFZGGJMEI-UHFFFAOYSA-N 1 2 309.504 4.165 20 0 DIADLO CCc1cnc(C[NH2+]C(C)(C)c2ccc(C(F)(F)F)cc2)o1 ZINC000880384281 1044035595 /nfs/dbraw/zinc/03/55/95/1044035595.db2.gz WBYJBZABPNDYGA-UHFFFAOYSA-N 1 2 312.335 4.281 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccnc(Cl)c1 ZINC000128435961 1044041361 /nfs/dbraw/zinc/04/13/61/1044041361.db2.gz YOQMHEWPSLHLAP-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO Clc1ccccc1O[C@@H]1CC[N@H+](Cc2cccnc2Cl)C1 ZINC000128470557 1044043589 /nfs/dbraw/zinc/04/35/89/1044043589.db2.gz QDPFHKVNEXPULR-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccccc1O[C@@H]1CC[N@@H+](Cc2cccnc2Cl)C1 ZINC000128470557 1044043600 /nfs/dbraw/zinc/04/36/00/1044043600.db2.gz QDPFHKVNEXPULR-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO Cc1cc(N2CC[C@@H](c3ccc(Cl)cc3)C2)nc(C2CC2)[nH+]1 ZINC000522567504 1044046240 /nfs/dbraw/zinc/04/62/40/1044046240.db2.gz IKTLVGCDKUJYIA-OAHLLOKOSA-N 1 2 313.832 4.310 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nnc(C(C)C)s2)cc(C)c1F ZINC000358294161 1044049744 /nfs/dbraw/zinc/04/97/44/1044049744.db2.gz YOEHYIQHJWZBAX-GFCCVEGCSA-N 1 2 307.438 4.268 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)no1 ZINC000562034267 1044051890 /nfs/dbraw/zinc/05/18/90/1044051890.db2.gz YNPHPDPCKUNCII-MRXNPFEDSA-N 1 2 302.393 4.448 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)no1 ZINC000562034267 1044051903 /nfs/dbraw/zinc/05/19/03/1044051903.db2.gz YNPHPDPCKUNCII-MRXNPFEDSA-N 1 2 302.393 4.448 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2CCSc3ccccc32)c(C)[nH+]1 ZINC000358362705 1044058998 /nfs/dbraw/zinc/05/89/98/1044058998.db2.gz XDIKFZONDDRMJZ-OAHLLOKOSA-N 1 2 312.438 4.225 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)n1 ZINC000522664520 1044062639 /nfs/dbraw/zinc/06/26/39/1044062639.db2.gz UEIGQMXIHJLLMY-QGZVFWFLSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)n1 ZINC000522664520 1044062632 /nfs/dbraw/zinc/06/26/32/1044062632.db2.gz UEIGQMXIHJLLMY-QGZVFWFLSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@@H]2CCc3cccc4cccc2c43)n1 ZINC000931805922 1044075934 /nfs/dbraw/zinc/07/59/34/1044075934.db2.gz IRBQICSVBLSZGZ-QGZVFWFLSA-N 1 2 321.424 4.198 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@@H+]1CCC(F)(F)[C@H](CO)C1 ZINC000291700350 1044098199 /nfs/dbraw/zinc/09/81/99/1044098199.db2.gz IAJZJRLLBAXQQB-ZJUUUORDSA-N 1 2 324.198 4.004 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@H+]1CCC(F)(F)[C@H](CO)C1 ZINC000291700350 1044098210 /nfs/dbraw/zinc/09/82/10/1044098210.db2.gz IAJZJRLLBAXQQB-ZJUUUORDSA-N 1 2 324.198 4.004 20 0 DIADLO Cc1ccc(CSc2nncn2[C@@H](C)c2ccccc2)c(C)[nH+]1 ZINC000358590914 1044086005 /nfs/dbraw/zinc/08/60/05/1044086005.db2.gz LIPKXVGQVMLTFR-HNNXBMFYSA-N 1 2 324.453 4.192 20 0 DIADLO Cc1ccc(CSCc2ccn(C3CCCC3)n2)c(C)[nH+]1 ZINC000358651585 1044089883 /nfs/dbraw/zinc/08/98/83/1044089883.db2.gz BTTJNUQJJRDWOH-UHFFFAOYSA-N 1 2 301.459 4.443 20 0 DIADLO COc1cccc([C@@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)c1 ZINC000281038573 1044090096 /nfs/dbraw/zinc/09/00/96/1044090096.db2.gz GSZMAGUCPYOXLO-SECBINFHSA-N 1 2 313.294 4.102 20 0 DIADLO Cc1nn(C(C)C)cc1C[NH2+]Cc1coc(-c2ccc(C)cc2)n1 ZINC000281148616 1044096512 /nfs/dbraw/zinc/09/65/12/1044096512.db2.gz AXKSSPQPVFXMLI-UHFFFAOYSA-N 1 2 324.428 4.026 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+]Cc2ccc3c(c2)CCCC3)s1 ZINC000291955758 1044119710 /nfs/dbraw/zinc/11/97/10/1044119710.db2.gz OTRQGXJAXPFVFF-UHFFFAOYSA-N 1 2 315.486 4.004 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](c2ccccn2)C2CC2)cs1 ZINC000932379236 1044121960 /nfs/dbraw/zinc/12/19/60/1044121960.db2.gz NHHVECLIIVYLOB-QGZVFWFLSA-N 1 2 301.459 4.122 20 0 DIADLO COCCCCCSCc1ccc(-n2cc[nH+]c2)cc1C ZINC000359028721 1044122782 /nfs/dbraw/zinc/12/27/82/1044122782.db2.gz MNNNYZZBZHIJDA-UHFFFAOYSA-N 1 2 304.459 4.231 20 0 DIADLO c1cn(-c2csc(CNc3nccc4sccc43)c2)c[nH+]1 ZINC000359022775 1044123152 /nfs/dbraw/zinc/12/31/52/1044123152.db2.gz CRPBXPXNHGKWHS-UHFFFAOYSA-N 1 2 312.423 4.156 20 0 DIADLO Clc1cnc(C[NH2+][C@H](c2ccccn2)C2CC2)c(Cl)c1 ZINC000932382211 1044124211 /nfs/dbraw/zinc/12/42/11/1044124211.db2.gz HIVHSPGZZYYSAA-HNNXBMFYSA-N 1 2 308.212 4.024 20 0 DIADLO C[C@@H](CSCc1ccc(-n2cc[nH+]c2)cc1)C(F)(F)F ZINC000359047127 1044125301 /nfs/dbraw/zinc/12/53/01/1044125301.db2.gz MZZYQCYVFAPDMH-NSHDSACASA-N 1 2 300.349 4.304 20 0 DIADLO Fc1cccc(C[N@H+](Cc2coc(C3CC3)n2)C2CCC2)c1 ZINC000932406405 1044126627 /nfs/dbraw/zinc/12/66/27/1044126627.db2.gz SKMJJTHWTHJADH-UHFFFAOYSA-N 1 2 300.377 4.246 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2coc(C3CC3)n2)C2CCC2)c1 ZINC000932406405 1044126635 /nfs/dbraw/zinc/12/66/35/1044126635.db2.gz SKMJJTHWTHJADH-UHFFFAOYSA-N 1 2 300.377 4.246 20 0 DIADLO Cc1cc(C[N@H+](Cc2nc3ccccc3s2)C2CC2)ccn1 ZINC000932395103 1044126857 /nfs/dbraw/zinc/12/68/57/1044126857.db2.gz PSOOUJYFHNAGCY-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO Cc1cc(C[N@@H+](Cc2nc3ccccc3s2)C2CC2)ccn1 ZINC000932395103 1044126860 /nfs/dbraw/zinc/12/68/60/1044126860.db2.gz PSOOUJYFHNAGCY-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO CC(C)C[N@H+](Cc1cc(C(C)(C)C)on1)Cc1ccccn1 ZINC000932448785 1044129924 /nfs/dbraw/zinc/12/99/24/1044129924.db2.gz HQFHBZXCOYXIFU-UHFFFAOYSA-N 1 2 301.434 4.025 20 0 DIADLO CC(C)C[N@@H+](Cc1cc(C(C)(C)C)on1)Cc1ccccn1 ZINC000932448785 1044129927 /nfs/dbraw/zinc/12/99/27/1044129927.db2.gz HQFHBZXCOYXIFU-UHFFFAOYSA-N 1 2 301.434 4.025 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1nc(-c2cccs2)oc1C ZINC000292124808 1044139207 /nfs/dbraw/zinc/13/92/07/1044139207.db2.gz HXBOXSOCSVRGDE-UHFFFAOYSA-N 1 2 302.399 4.245 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1nc(-c2cccs2)oc1C ZINC000292124808 1044139213 /nfs/dbraw/zinc/13/92/13/1044139213.db2.gz HXBOXSOCSVRGDE-UHFFFAOYSA-N 1 2 302.399 4.245 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2ncc(C(C)(C)C)o2)cc1C ZINC000932576533 1044146596 /nfs/dbraw/zinc/14/65/96/1044146596.db2.gz TVRFYANOAHHEJG-ZDUSSCGKSA-N 1 2 302.418 4.140 20 0 DIADLO Cc1c2ccccc2oc1C[NH2+][C@H](c1nnc[nH]1)C1CCCCC1 ZINC000292184987 1044147356 /nfs/dbraw/zinc/14/73/56/1044147356.db2.gz OSWXCFMZKNGCOT-SFHVURJKSA-N 1 2 324.428 4.271 20 0 DIADLO Brc1cccc(C[N@@H+]2CCC[C@H]2c2ccsc2)n1 ZINC000292224312 1044150109 /nfs/dbraw/zinc/15/01/09/1044150109.db2.gz QYOFQKTZDOVAST-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cccc(C[N@H+]2CCC[C@H]2c2ccsc2)n1 ZINC000292224312 1044150117 /nfs/dbraw/zinc/15/01/17/1044150117.db2.gz QYOFQKTZDOVAST-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]C(C)(C)c2ccccc2F)cs1 ZINC000292218447 1044150494 /nfs/dbraw/zinc/15/04/94/1044150494.db2.gz UTLIYYZXDRRMQX-NSHDSACASA-N 1 2 308.422 4.015 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000444015411 1044155297 /nfs/dbraw/zinc/15/52/97/1044155297.db2.gz LMAIAGCJUQRVLA-UHFFFAOYSA-N 1 2 304.796 4.043 20 0 DIADLO FC(F)CC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1csc(Cl)n1 ZINC000932804747 1044161348 /nfs/dbraw/zinc/16/13/48/1044161348.db2.gz GONIXWILFOZHRX-UQPYNNQESA-N 1 2 306.809 4.195 20 0 DIADLO FC(F)CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1csc(Cl)n1 ZINC000932804747 1044161354 /nfs/dbraw/zinc/16/13/54/1044161354.db2.gz GONIXWILFOZHRX-UQPYNNQESA-N 1 2 306.809 4.195 20 0 DIADLO Cc1cc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)ncn1 ZINC000292338473 1044164891 /nfs/dbraw/zinc/16/48/91/1044164891.db2.gz CUHSYIYSVIABEM-ZDUSSCGKSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1cc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)ncn1 ZINC000292338473 1044164898 /nfs/dbraw/zinc/16/48/98/1044164898.db2.gz CUHSYIYSVIABEM-ZDUSSCGKSA-N 1 2 301.821 4.164 20 0 DIADLO Fc1cccc(-c2cnc(C[N@@H+]3CCC[C@@H]3c3cccnc3)o2)c1 ZINC000346965178 1044177180 /nfs/dbraw/zinc/17/71/80/1044177180.db2.gz BEDKYIBMSIQKLU-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1cccc(-c2cnc(C[N@H+]3CCC[C@@H]3c3cccnc3)o2)c1 ZINC000346965178 1044177189 /nfs/dbraw/zinc/17/71/89/1044177189.db2.gz BEDKYIBMSIQKLU-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CCc3cc(Cl)cs3)cc2[nH+]1 ZINC000346968152 1044178360 /nfs/dbraw/zinc/17/83/60/1044178360.db2.gz QZFSYDJNMUCYIU-UHFFFAOYSA-N 1 2 319.817 4.158 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1ncc(C3CC3)o1)[C@H]2C ZINC000359637505 1044184799 /nfs/dbraw/zinc/18/47/99/1044184799.db2.gz QEGVRUWXPFQAGC-STQMWFEESA-N 1 2 312.413 4.068 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1ncc(C3CC3)o1)[C@H]2C ZINC000359637505 1044184804 /nfs/dbraw/zinc/18/48/04/1044184804.db2.gz QEGVRUWXPFQAGC-STQMWFEESA-N 1 2 312.413 4.068 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@H](c3cncc(F)c3)C3CC3)ccc21 ZINC000281759411 1044189050 /nfs/dbraw/zinc/18/90/50/1044189050.db2.gz WGYBXAWIQYNURS-IBGZPJMESA-N 1 2 311.404 4.166 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@H](c3cncc(F)c3)C3CC3)ccc21 ZINC000281759411 1044189056 /nfs/dbraw/zinc/18/90/56/1044189056.db2.gz WGYBXAWIQYNURS-IBGZPJMESA-N 1 2 311.404 4.166 20 0 DIADLO C[C@H]([NH2+]Cc1ncccc1Cl)c1cc(Cl)cc2c1OCC2 ZINC000933269152 1044190937 /nfs/dbraw/zinc/19/09/37/1044190937.db2.gz FHVZBBUKLHWMKS-JTQLQIEISA-N 1 2 323.223 4.174 20 0 DIADLO CCCCc1nc(C[NH2+][C@]2(C)CCOc3ccccc32)cs1 ZINC000933365583 1044195453 /nfs/dbraw/zinc/19/54/53/1044195453.db2.gz CVMPSTPENJZZSC-GOSISDBHSA-N 1 2 316.470 4.273 20 0 DIADLO COc1ccncc1C[N@@H+](Cc1ccccc1Cl)CC1CC1 ZINC000347166932 1044205040 /nfs/dbraw/zinc/20/50/40/1044205040.db2.gz LZZSFCJRERXADV-UHFFFAOYSA-N 1 2 316.832 4.156 20 0 DIADLO COc1ccncc1C[N@H+](Cc1ccccc1Cl)CC1CC1 ZINC000347166932 1044205041 /nfs/dbraw/zinc/20/50/41/1044205041.db2.gz LZZSFCJRERXADV-UHFFFAOYSA-N 1 2 316.832 4.156 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccccc2Br)c(C)n1 ZINC000359852339 1044208438 /nfs/dbraw/zinc/20/84/38/1044208438.db2.gz MIYODGMGWOJMKW-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccccc2Br)c(C)n1 ZINC000359852339 1044208452 /nfs/dbraw/zinc/20/84/52/1044208452.db2.gz MIYODGMGWOJMKW-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Clc1ccc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)cn1 ZINC000026475292 1044212879 /nfs/dbraw/zinc/21/28/79/1044212879.db2.gz QMPRVKWJSMKTDL-SFHVURJKSA-N 1 2 309.800 4.009 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2ccc(C3CC3)cc2F)s1 ZINC000292868280 1044220619 /nfs/dbraw/zinc/22/06/19/1044220619.db2.gz CZVGWDFGCFQEJT-UHFFFAOYSA-N 1 2 322.474 4.312 20 0 DIADLO c1cc(C[N@H+](Cc2ccc(Oc3ccccc3)nn2)C2CC2)co1 ZINC000934002329 1044222351 /nfs/dbraw/zinc/22/23/51/1044222351.db2.gz RTPHPCFSKODBEB-UHFFFAOYSA-N 1 2 321.380 4.027 20 0 DIADLO c1cc(C[N@@H+](Cc2ccc(Oc3ccccc3)nn2)C2CC2)co1 ZINC000934002329 1044222357 /nfs/dbraw/zinc/22/23/57/1044222357.db2.gz RTPHPCFSKODBEB-UHFFFAOYSA-N 1 2 321.380 4.027 20 0 DIADLO CCC[C@@H]([NH2+][C@H](C)c1cc(C)n(C)n1)c1ccc(F)cc1F ZINC000281957372 1044223960 /nfs/dbraw/zinc/22/39/60/1044223960.db2.gz AVFDTDOUMKJQAI-MLGOLLRUSA-N 1 2 307.388 4.199 20 0 DIADLO CC[C@@H]([NH2+]Cc1csc(N(C)C)n1)c1sccc1Cl ZINC000883195265 1044233356 /nfs/dbraw/zinc/23/33/56/1044233356.db2.gz OUGNYTBFHPLWIE-LLVKDONJSA-N 1 2 315.895 4.165 20 0 DIADLO CCc1nc(C[NH2+][C@@H](c2ncccc2C)C(C)(C)C)cs1 ZINC000934292077 1044234953 /nfs/dbraw/zinc/23/49/53/1044234953.db2.gz GQOYNLWLTSFBAL-INIZCTEOSA-N 1 2 303.475 4.286 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccc(Cl)cc2OC(C)C)s1 ZINC000883259380 1044249518 /nfs/dbraw/zinc/24/95/18/1044249518.db2.gz KVLYKJNGHJPBKB-UHFFFAOYSA-N 1 2 310.850 4.182 20 0 DIADLO Cc1cnc(=S)n(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)c1 ZINC000131338698 1044251371 /nfs/dbraw/zinc/25/13/71/1044251371.db2.gz AWVOUWFVRXUWKJ-OAHLLOKOSA-N 1 2 319.861 4.369 20 0 DIADLO Cc1cnc(=S)n(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)c1 ZINC000131338698 1044251379 /nfs/dbraw/zinc/25/13/79/1044251379.db2.gz AWVOUWFVRXUWKJ-OAHLLOKOSA-N 1 2 319.861 4.369 20 0 DIADLO COc1ccc(C2CC2)cc1C[NH2+][C@@H](C)c1csc(C)n1 ZINC000883265526 1044252583 /nfs/dbraw/zinc/25/25/83/1044252583.db2.gz DTIONZKQXCMVAW-NSHDSACASA-N 1 2 302.443 4.188 20 0 DIADLO Cc1ccc(F)c(C[NH2+][C@H](C)c2cnn(CC3CCC3)c2)c1F ZINC000934561961 1044260486 /nfs/dbraw/zinc/26/04/86/1044260486.db2.gz WRVQPPANTMEXEE-CYBMUJFWSA-N 1 2 319.399 4.121 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H](C)c2ncccn2)cc2ccccc21 ZINC000934629629 1044264306 /nfs/dbraw/zinc/26/43/06/1044264306.db2.gz FROLAHSJJDXTLQ-KGLIPLIRSA-N 1 2 307.397 4.050 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H](C)c2ncccn2)cc2ccccc21 ZINC000934629633 1044264365 /nfs/dbraw/zinc/26/43/65/1044264365.db2.gz FROLAHSJJDXTLQ-UONOGXRCSA-N 1 2 307.397 4.050 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]C1(c2ncccn2)CCC1 ZINC000883313964 1044265575 /nfs/dbraw/zinc/26/55/75/1044265575.db2.gz REPRYDALJQDGCX-CQSZACIVSA-N 1 2 307.397 4.261 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C1(c2ncccn2)CCC1 ZINC000883312324 1044266510 /nfs/dbraw/zinc/26/65/10/1044266510.db2.gz AHFIUUZKGMWSRI-ZDUSSCGKSA-N 1 2 316.474 4.095 20 0 DIADLO Cc1nc(C2([NH2+]Cc3csc4ccccc34)CCCC2)no1 ZINC000101550510 1044266920 /nfs/dbraw/zinc/26/69/20/1044266920.db2.gz YYCOSGUAXCJOEM-UHFFFAOYSA-N 1 2 313.426 4.152 20 0 DIADLO Oc1cccc(C[NH2+][C@H]2CCCOc3c(F)cccc32)c1Cl ZINC000293318704 1044271643 /nfs/dbraw/zinc/27/16/43/1044271643.db2.gz QVCSCYFUJVJRMJ-AWEZNQCLSA-N 1 2 321.779 4.188 20 0 DIADLO Cc1cc(N[C@H](C)c2cncc(Br)c2)c[nH+]c1C ZINC000883342701 1044279184 /nfs/dbraw/zinc/27/91/84/1044279184.db2.gz ITIZHZJHLVSUSS-LLVKDONJSA-N 1 2 306.207 4.029 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc(Br)nc2)c[nH+]c1C ZINC000883342710 1044279392 /nfs/dbraw/zinc/27/93/92/1044279392.db2.gz IZUKRCSCZSDYIJ-NSHDSACASA-N 1 2 306.207 4.029 20 0 DIADLO COc1ccc([C@@H](Nc2cc[nH+]c(C)n2)c2ccc(F)cc2)cc1 ZINC000360534926 1044282740 /nfs/dbraw/zinc/28/27/40/1044282740.db2.gz LYCQPWIMOCDXFJ-IBGZPJMESA-N 1 2 323.371 4.134 20 0 DIADLO Cc1[nH]c(CNc2ccc([C@H](F)C(F)(F)F)cc2)[nH+]c1C ZINC000883367955 1044285258 /nfs/dbraw/zinc/28/52/58/1044285258.db2.gz BOROIZDMVWKOAY-ZDUSSCGKSA-N 1 2 301.287 4.212 20 0 DIADLO C[C@H]([NH2+][C@H]1c2ccccc2CC[C@@H]1F)c1cccnc1Cl ZINC000883375952 1044286942 /nfs/dbraw/zinc/28/69/42/1044286942.db2.gz CJCWHRTTXOQQRY-UVBJJODRSA-N 1 2 304.796 4.411 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1ccc(C(F)F)nc1 ZINC000883377324 1044290224 /nfs/dbraw/zinc/29/02/24/1044290224.db2.gz FKBYAXIHTMYEJA-UHFFFAOYSA-N 1 2 309.385 4.279 20 0 DIADLO C[C@H]([NH2+][C@H]1c2ccccc2CC[C@H]1F)c1nc2ccccc2n1C ZINC000883376588 1044291103 /nfs/dbraw/zinc/29/11/03/1044291103.db2.gz OOLDFCQDFNHFND-CRFBAAHOSA-N 1 2 323.415 4.250 20 0 DIADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1nsc2ccccc12 ZINC000883401962 1044305694 /nfs/dbraw/zinc/30/56/94/1044305694.db2.gz DMGXMZHIOGDZQD-SNVBAGLBSA-N 1 2 301.415 4.006 20 0 DIADLO Clc1ccc2c(n1)[C@H]([NH2+]Cc1nsc3ccccc13)CC2 ZINC000883402821 1044305946 /nfs/dbraw/zinc/30/59/46/1044305946.db2.gz BFIPGVOQFGNJJB-GFCCVEGCSA-N 1 2 315.829 4.122 20 0 DIADLO Cc1ccc2c(Nc3cccnc3Br)cccc2[nH+]1 ZINC001212795126 1044317874 /nfs/dbraw/zinc/31/78/74/1044317874.db2.gz POCJDXZXCZOGHG-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO c1cncc([C@@H](Nc2ccc(N3CCCCC3)c[nH+]2)C2CCC2)c1 ZINC000360883694 1044323088 /nfs/dbraw/zinc/32/30/88/1044323088.db2.gz KYOSZUNLYPHUCA-FQEVSTJZSA-N 1 2 322.456 4.420 20 0 DIADLO Cc1ccc2c(Nc3cc(-c4ccccn4)no3)cccc2[nH+]1 ZINC001212795919 1044323809 /nfs/dbraw/zinc/32/38/09/1044323809.db2.gz IZVLKDMJJIMOTF-UHFFFAOYSA-N 1 2 302.337 4.337 20 0 DIADLO Cc1sccc1C[N@@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000293772998 1044327477 /nfs/dbraw/zinc/32/74/77/1044327477.db2.gz BIKFYRNDIHVJRM-OAHLLOKOSA-N 1 2 317.458 4.434 20 0 DIADLO Cc1sccc1C[N@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000293772998 1044327485 /nfs/dbraw/zinc/32/74/85/1044327485.db2.gz BIKFYRNDIHVJRM-OAHLLOKOSA-N 1 2 317.458 4.434 20 0 DIADLO Cc1ccc2c(Nc3cccc(-c4nnco4)c3)cccc2[nH+]1 ZINC001212796767 1044339498 /nfs/dbraw/zinc/33/94/98/1044339498.db2.gz BFVMUKIGYYEUGP-UHFFFAOYSA-N 1 2 302.337 4.337 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1noc(-c2ccccc2)n1)c1ccccc1 ZINC000102184952 1044341602 /nfs/dbraw/zinc/34/16/02/1044341602.db2.gz DHZNQGYLJRBSCR-SFHVURJKSA-N 1 2 307.397 4.224 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1noc(-c2ccccc2)n1)c1ccccc1 ZINC000102184955 1044342650 /nfs/dbraw/zinc/34/26/50/1044342650.db2.gz DHZNQGYLJRBSCR-GOSISDBHSA-N 1 2 307.397 4.224 20 0 DIADLO COc1cc(F)c([C@@H](C)[NH2+][C@@H](C)c2nc(C)cs2)cc1OC ZINC000361012312 1044345835 /nfs/dbraw/zinc/34/58/35/1044345835.db2.gz IQTZIIIQAUFNPF-MNOVXSKESA-N 1 2 324.421 4.020 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1sccc1Cl)C2 ZINC000361008778 1044347334 /nfs/dbraw/zinc/34/73/34/1044347334.db2.gz HHUDVPNTPZOCRP-UHFFFAOYSA-N 1 2 305.830 4.155 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@H+](Cc1sccc1Cl)C2 ZINC000361008778 1044347346 /nfs/dbraw/zinc/34/73/46/1044347346.db2.gz HHUDVPNTPZOCRP-UHFFFAOYSA-N 1 2 305.830 4.155 20 0 DIADLO Cc1nc(N[C@@H](COCc2ccccc2)c2ccccc2)cc[nH+]1 ZINC000361043035 1044351445 /nfs/dbraw/zinc/35/14/45/1044351445.db2.gz DPBITGBEYLTOHD-IBGZPJMESA-N 1 2 319.408 4.155 20 0 DIADLO Cc1ccc2c(Nc3cncnc3C(F)(F)F)cccc2[nH+]1 ZINC001212797081 1044355153 /nfs/dbraw/zinc/35/51/53/1044355153.db2.gz XCWZLKZJMLEUTO-UHFFFAOYSA-N 1 2 304.275 4.096 20 0 DIADLO CC(C)N(Cc1ccccc1)C(=O)C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000361086050 1044357982 /nfs/dbraw/zinc/35/79/82/1044357982.db2.gz HKPIQRVPUDGAGL-KRWDZBQOSA-N 1 2 322.452 4.000 20 0 DIADLO CC(C)N(Cc1ccccc1)C(=O)C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000361086050 1044357993 /nfs/dbraw/zinc/35/79/93/1044357993.db2.gz HKPIQRVPUDGAGL-KRWDZBQOSA-N 1 2 322.452 4.000 20 0 DIADLO CC[C@H]1C[C@@H](CNc2ccc(-n3c[nH+]c(C)c3C)cc2)CCO1 ZINC000361252156 1044380343 /nfs/dbraw/zinc/38/03/43/1044380343.db2.gz PXYLSDZGVYCPHC-LPHOPBHVSA-N 1 2 313.445 4.106 20 0 DIADLO CC[C@H]1C[C@H](CNc2ccc(-n3c[nH+]c(C)c3C)cc2)CCO1 ZINC000361252155 1044380731 /nfs/dbraw/zinc/38/07/31/1044380731.db2.gz PXYLSDZGVYCPHC-APWZRJJASA-N 1 2 313.445 4.106 20 0 DIADLO Cc1ccc2c(Nc3cccc(C4OCCO4)c3)cccc2[nH+]1 ZINC001212797977 1044382444 /nfs/dbraw/zinc/38/24/44/1044382444.db2.gz WHKPNGLFTGSGQH-UHFFFAOYSA-N 1 2 306.365 4.332 20 0 DIADLO Cc1ccc2c(Nc3ccc(-c4nnco4)cc3)cccc2[nH+]1 ZINC001212797966 1044382864 /nfs/dbraw/zinc/38/28/64/1044382864.db2.gz VRWQBLVEIYQSHI-UHFFFAOYSA-N 1 2 302.337 4.337 20 0 DIADLO CC(=O)c1c(C)cccc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000783569392 1044383468 /nfs/dbraw/zinc/38/34/68/1044383468.db2.gz FTKCQEQWKRKNRU-UHFFFAOYSA-N 1 2 319.408 4.055 20 0 DIADLO Cc1nn(C)c2cc(Nc3cccc4[nH+]c(C)ccc34)ccc12 ZINC001212797992 1044384099 /nfs/dbraw/zinc/38/40/99/1044384099.db2.gz XGTXNGHWVCWIFE-UHFFFAOYSA-N 1 2 302.381 4.482 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1cncc(C(F)(F)F)c1)C1CC1 ZINC000361294696 1044386471 /nfs/dbraw/zinc/38/64/71/1044386471.db2.gz GBHDJJXBBAKMNU-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1cncc(C(F)(F)F)c1)C1CC1 ZINC000361294696 1044386487 /nfs/dbraw/zinc/38/64/87/1044386487.db2.gz GBHDJJXBBAKMNU-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]C(c2ccccc2)c2ccccc2)nn1C ZINC000281995374 1044391766 /nfs/dbraw/zinc/39/17/66/1044391766.db2.gz CQSNPDLPHODDPB-MRXNPFEDSA-N 1 2 305.425 4.169 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2cncc(C(F)(F)F)c2)C1 ZINC000361339809 1044394902 /nfs/dbraw/zinc/39/49/02/1044394902.db2.gz UXFZFPOYQSHXKO-MLGOLLRUSA-N 1 2 321.346 4.079 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cncc(C(F)(F)F)c2)C1 ZINC000361339809 1044394918 /nfs/dbraw/zinc/39/49/18/1044394918.db2.gz UXFZFPOYQSHXKO-MLGOLLRUSA-N 1 2 321.346 4.079 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cncc(C(F)(F)F)c2)c1 ZINC000361376181 1044399727 /nfs/dbraw/zinc/39/97/27/1044399727.db2.gz FZWBXCMWGIUETA-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cncc(C(F)(F)F)c2)c1 ZINC000361376181 1044399737 /nfs/dbraw/zinc/39/97/37/1044399737.db2.gz FZWBXCMWGIUETA-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO CC[C@@](C)(NCc1ccc(-n2cc[nH+]c2)cc1C)C(F)(F)F ZINC000564834022 1044406479 /nfs/dbraw/zinc/40/64/79/1044406479.db2.gz LZFRYHCHNLDNIN-OAHLLOKOSA-N 1 2 311.351 4.001 20 0 DIADLO COc1cc(C[NH2+]C2(C(F)F)CCCC2)cc(C(F)(F)F)c1 ZINC001202629226 1044409644 /nfs/dbraw/zinc/40/96/44/1044409644.db2.gz NVZFFYYQSZEDCD-UHFFFAOYSA-N 1 2 323.305 4.382 20 0 DIADLO C[C@@H](CC[NH2+][C@@H](c1cccs1)c1nnc[nH]1)CC(C)(C)C ZINC000294374601 1044412618 /nfs/dbraw/zinc/41/26/18/1044412618.db2.gz RCNFOKFSKYVSLP-JSGCOSHPSA-N 1 2 306.479 4.008 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1nccn1-c1ccccc1 ZINC000361607661 1044424204 /nfs/dbraw/zinc/42/42/04/1044424204.db2.gz DAOAEFGRWMXEFK-HIFRSBDPSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1nccn1-c1ccccc1 ZINC000361607661 1044424209 /nfs/dbraw/zinc/42/42/09/1044424209.db2.gz DAOAEFGRWMXEFK-HIFRSBDPSA-N 1 2 323.362 4.035 20 0 DIADLO C[N@H+](Cc1ccoc1)Cc1nc2cc(C(F)(F)F)ccc2o1 ZINC000361642217 1044426413 /nfs/dbraw/zinc/42/64/13/1044426413.db2.gz ICWHXRTZSCVVGB-UHFFFAOYSA-N 1 2 310.275 4.072 20 0 DIADLO C[N@@H+](Cc1ccoc1)Cc1nc2cc(C(F)(F)F)ccc2o1 ZINC000361642217 1044426423 /nfs/dbraw/zinc/42/64/23/1044426423.db2.gz ICWHXRTZSCVVGB-UHFFFAOYSA-N 1 2 310.275 4.072 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccc1N(C)C)c1cc(Cl)ccc1Cl ZINC000565334313 1044427340 /nfs/dbraw/zinc/42/73/40/1044427340.db2.gz KRIQKLNCHHNKSA-LLVKDONJSA-N 1 2 324.255 4.305 20 0 DIADLO CC(C)(C[NH2+][C@H](c1ncn[nH]1)C1CCCCC1)C1=CCCC1 ZINC000565463484 1044437427 /nfs/dbraw/zinc/43/74/27/1044437427.db2.gz VYHRPNSOFLHHIZ-INIZCTEOSA-N 1 2 302.466 4.152 20 0 DIADLO CC(C)C[C@H]1CCC[C@H](Nc2ccc(Cn3cc[nH+]c3)cn2)C1 ZINC000565565733 1044444018 /nfs/dbraw/zinc/44/40/18/1044444018.db2.gz GTOXVGRGEVHBJN-AEFFLSMTSA-N 1 2 312.461 4.343 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2cc(C)ccc2[nH]1)c1cc(F)ccc1F ZINC000361802743 1044446136 /nfs/dbraw/zinc/44/61/36/1044446136.db2.gz BHZDWJVTPAQYGZ-OAHLLOKOSA-N 1 2 315.367 4.390 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2ccc(C)cc2[nH]1)c1cc(F)ccc1F ZINC000361802743 1044446145 /nfs/dbraw/zinc/44/61/45/1044446145.db2.gz BHZDWJVTPAQYGZ-OAHLLOKOSA-N 1 2 315.367 4.390 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ccc(Cl)cc1)c1nc(C2CC2)no1 ZINC000113357573 1044451353 /nfs/dbraw/zinc/45/13/53/1044451353.db2.gz QPWRPZFTKKEABG-CQSZACIVSA-N 1 2 305.809 4.087 20 0 DIADLO Cc1cc(-n2ccnc2)ccc1C[N@H+](CC(F)F)CC1CCC1 ZINC000361862532 1044454079 /nfs/dbraw/zinc/45/40/79/1044454079.db2.gz OKPIRIWCRAUSPF-UHFFFAOYSA-N 1 2 319.399 4.048 20 0 DIADLO Cc1cc(-n2ccnc2)ccc1C[N@@H+](CC(F)F)CC1CCC1 ZINC000361862532 1044454084 /nfs/dbraw/zinc/45/40/84/1044454084.db2.gz OKPIRIWCRAUSPF-UHFFFAOYSA-N 1 2 319.399 4.048 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)n1 ZINC000114745682 1044458395 /nfs/dbraw/zinc/45/83/95/1044458395.db2.gz AEEIUDSZDGMWTA-ZJUUUORDSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H](C)c1csnn1 ZINC000565821116 1044459860 /nfs/dbraw/zinc/45/98/60/1044459860.db2.gz XEWCXOLGLCDYJA-NHYWBVRUSA-N 1 2 312.442 4.056 20 0 DIADLO CC[N@H+](C)[C@H](c1nc(Cc2ccc(C)cc2)no1)c1ccccc1 ZINC000566034376 1044470782 /nfs/dbraw/zinc/47/07/82/1044470782.db2.gz IQPWXTXBCULYAJ-IBGZPJMESA-N 1 2 321.424 4.010 20 0 DIADLO CC[N@@H+](C)[C@H](c1nc(Cc2ccc(C)cc2)no1)c1ccccc1 ZINC000566034376 1044470788 /nfs/dbraw/zinc/47/07/88/1044470788.db2.gz IQPWXTXBCULYAJ-IBGZPJMESA-N 1 2 321.424 4.010 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]C2(c3nccs3)CCCC2)o1 ZINC000116374388 1044470975 /nfs/dbraw/zinc/47/09/75/1044470975.db2.gz VKJVXRWUXYNYBG-JSGCOSHPSA-N 1 2 302.443 4.419 20 0 DIADLO Cc1cccc(NC(=O)Nc2cccc(Cn3cc[nH+]c3)c2)c1C ZINC001202701135 1044480208 /nfs/dbraw/zinc/48/02/08/1044480208.db2.gz RRFDKAWXANKCLQ-UHFFFAOYSA-N 1 2 320.396 4.192 20 0 DIADLO Cc1csc(C[N@@H+](C)Cc2ccccc2C(F)(F)F)n1 ZINC000118405692 1044484131 /nfs/dbraw/zinc/48/41/31/1044484131.db2.gz ANJYUVQIKFUOLR-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1csc(C[N@H+](C)Cc2ccccc2C(F)(F)F)n1 ZINC000118405692 1044484134 /nfs/dbraw/zinc/48/41/34/1044484134.db2.gz ANJYUVQIKFUOLR-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1cc(N[C@@H]2C[C@H]2c2ccc(F)c(F)c2)ccc1[NH+](C)C ZINC001168069876 1044487539 /nfs/dbraw/zinc/48/75/39/1044487539.db2.gz MIYKLERTSQCSTO-WMLDXEAASA-N 1 2 302.368 4.307 20 0 DIADLO CCn1ccnc1C[NH2+][C@H](C)c1cc2cc(Cl)ccc2o1 ZINC000119326886 1044492983 /nfs/dbraw/zinc/49/29/83/1044492983.db2.gz UEDXNGRPCRJDKI-LLVKDONJSA-N 1 2 303.793 4.153 20 0 DIADLO C[N@@H+](Cc1coc2ccccc12)Cc1nc(-c2ccccc2)c[nH]1 ZINC000362311857 1044498857 /nfs/dbraw/zinc/49/88/57/1044498857.db2.gz FCCQTVALQQFLGI-UHFFFAOYSA-N 1 2 317.392 4.455 20 0 DIADLO C[N@H+](Cc1coc2ccccc12)Cc1nc(-c2ccccc2)c[nH]1 ZINC000362311857 1044498862 /nfs/dbraw/zinc/49/88/62/1044498862.db2.gz FCCQTVALQQFLGI-UHFFFAOYSA-N 1 2 317.392 4.455 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000362431833 1044510717 /nfs/dbraw/zinc/51/07/17/1044510717.db2.gz WCGRCDPPUDLROL-PBHICJAKSA-N 1 2 301.434 4.339 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000362431833 1044510728 /nfs/dbraw/zinc/51/07/28/1044510728.db2.gz WCGRCDPPUDLROL-PBHICJAKSA-N 1 2 301.434 4.339 20 0 DIADLO COc1nc2ccccc2cc1C[N@H+](Cc1ccco1)C1CC1 ZINC001137208118 1044511401 /nfs/dbraw/zinc/51/14/01/1044511401.db2.gz OBUAXGSQXDAZHT-UHFFFAOYSA-N 1 2 308.381 4.001 20 0 DIADLO COc1nc2ccccc2cc1C[N@@H+](Cc1ccco1)C1CC1 ZINC001137208118 1044511412 /nfs/dbraw/zinc/51/14/12/1044511412.db2.gz OBUAXGSQXDAZHT-UHFFFAOYSA-N 1 2 308.381 4.001 20 0 DIADLO C[C@H]([NH2+]Cc1ncnn1C(C)(C)C)c1ccc(-c2ccccc2)o1 ZINC000282915976 1044513786 /nfs/dbraw/zinc/51/37/86/1044513786.db2.gz XQIWPWGTULHGTQ-AWEZNQCLSA-N 1 2 324.428 4.144 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@H](C)c2cccc3ccccc32)n1 ZINC000120866620 1044516069 /nfs/dbraw/zinc/51/60/69/1044516069.db2.gz YEXOYMGTGXVOBA-CQSZACIVSA-N 1 2 309.413 4.272 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSC[C@H]1CCO[C@@H](C)C1 ZINC000362457694 1044516806 /nfs/dbraw/zinc/51/68/06/1044516806.db2.gz QIZPEZGNVQFKEG-HOTGVXAUSA-N 1 2 316.470 4.229 20 0 DIADLO Fc1cc(Cl)cc(CNc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000362525260 1044525434 /nfs/dbraw/zinc/52/54/34/1044525434.db2.gz LSAUUHGGRSJVIR-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO Cc1cnc([C@H](C)[NH+]2CCC(c3c(F)cccc3F)CC2)o1 ZINC000362588968 1044532949 /nfs/dbraw/zinc/53/29/49/1044532949.db2.gz GTEMIFXXQKZWTD-LBPRGKRZSA-N 1 2 306.356 4.202 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1c(C)noc1C ZINC000348326454 1044534707 /nfs/dbraw/zinc/53/47/07/1044534707.db2.gz YOJTZOXJWCMSKE-INIZCTEOSA-N 1 2 311.385 4.187 20 0 DIADLO COC1(CC[N@@H+]2CCn3c(cc4ccc(Cl)cc43)C2)CCC1 ZINC000567064963 1044539809 /nfs/dbraw/zinc/53/98/09/1044539809.db2.gz LBRNQSXJVUWYDO-UHFFFAOYSA-N 1 2 318.848 4.070 20 0 DIADLO COC1(CC[N@H+]2CCn3c(cc4ccc(Cl)cc43)C2)CCC1 ZINC000567064963 1044539823 /nfs/dbraw/zinc/53/98/23/1044539823.db2.gz LBRNQSXJVUWYDO-UHFFFAOYSA-N 1 2 318.848 4.070 20 0 DIADLO Fc1cccc([C@@H]([NH2+][C@H]2CCCn3ccnc32)c2ccccc2)c1 ZINC000655723270 1044554971 /nfs/dbraw/zinc/55/49/71/1044554971.db2.gz MMIRGNZWMPWOBD-OALUTQOASA-N 1 2 321.399 4.236 20 0 DIADLO Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]Cc1ncc(C(F)(F)F)cn1 ZINC000295833120 1044563302 /nfs/dbraw/zinc/56/33/02/1044563302.db2.gz AABNGUWVLUCANM-SMDDNHRTSA-N 1 2 321.346 4.142 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2nncn2-c2ccccc2)c1 ZINC000444590697 1044571835 /nfs/dbraw/zinc/57/18/35/1044571835.db2.gz MGHSKBKFYHLQCK-QGZVFWFLSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@@H+](C)Cc2nncn2-c2ccccc2)c1 ZINC000444590697 1044571853 /nfs/dbraw/zinc/57/18/53/1044571853.db2.gz MGHSKBKFYHLQCK-QGZVFWFLSA-N 1 2 320.440 4.077 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)cc(C(F)(F)F)c1)c1cscn1 ZINC000567628160 1044578546 /nfs/dbraw/zinc/57/85/46/1044578546.db2.gz LAHRNORDBHCJAB-QMMMGPOBSA-N 1 2 304.312 4.152 20 0 DIADLO FC1(F)CC2(C[NH+](Cc3ccc4cccc(Cl)c4n3)C2)C1 ZINC001137219158 1044584529 /nfs/dbraw/zinc/58/45/29/1044584529.db2.gz BJZRTLCMNUVXGN-UHFFFAOYSA-N 1 2 308.759 4.119 20 0 DIADLO CCCCOc1ccccc1C[N@H+](C)Cc1c(C)noc1C ZINC000136161499 1044586358 /nfs/dbraw/zinc/58/63/58/1044586358.db2.gz NJJUNXPMAUNICR-UHFFFAOYSA-N 1 2 302.418 4.102 20 0 DIADLO CCCCOc1ccccc1C[N@@H+](C)Cc1c(C)noc1C ZINC000136161499 1044586372 /nfs/dbraw/zinc/58/63/72/1044586372.db2.gz NJJUNXPMAUNICR-UHFFFAOYSA-N 1 2 302.418 4.102 20 0 DIADLO Cc1coc(C[NH2+][C@@H](C)c2nc3ccccc3n2C(F)F)c1 ZINC000885917649 1044591260 /nfs/dbraw/zinc/59/12/60/1044591260.db2.gz PJKQVIFSWQIMJZ-NSHDSACASA-N 1 2 305.328 4.184 20 0 DIADLO CCn1cc([C@H](C)[NH2+]Cc2nc(C3CCCCC3)cs2)cn1 ZINC000296143263 1044594991 /nfs/dbraw/zinc/59/49/91/1044594991.db2.gz RYWBRYYSAPINRG-ZDUSSCGKSA-N 1 2 318.490 4.258 20 0 DIADLO CC(C)c1nnc(C[N@H+](C)[C@H]2CCCc3ccccc32)s1 ZINC000568025221 1044597019 /nfs/dbraw/zinc/59/70/19/1044597019.db2.gz GRNUGNLXPVKGJJ-HNNXBMFYSA-N 1 2 301.459 4.171 20 0 DIADLO CC(C)c1nnc(C[N@@H+](C)[C@H]2CCCc3ccccc32)s1 ZINC000568025221 1044597033 /nfs/dbraw/zinc/59/70/33/1044597033.db2.gz GRNUGNLXPVKGJJ-HNNXBMFYSA-N 1 2 301.459 4.171 20 0 DIADLO C[C@@H]1CC[C@@H]([NH2+]Cc2ncc(C(F)(F)F)cn2)c2ccccc21 ZINC000296283982 1044605359 /nfs/dbraw/zinc/60/53/59/1044605359.db2.gz FDCYQZZEPMWUHA-IAQYHMDHSA-N 1 2 321.346 4.224 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cc(-c3ccccc3)no2)c1 ZINC000444732818 1044612153 /nfs/dbraw/zinc/61/21/53/1044612153.db2.gz KLEVCTXNKIAEIU-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cc(-c3ccccc3)no2)c1 ZINC000444732818 1044612158 /nfs/dbraw/zinc/61/21/58/1044612158.db2.gz KLEVCTXNKIAEIU-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1cc2cc(C[NH2+][C@@H](c3ncc[nH]3)c3ccccc3)ccc2[nH]1 ZINC000353800958 1044614127 /nfs/dbraw/zinc/61/41/27/1044614127.db2.gz BXMHJUDPJZJZJI-LJQANCHMSA-N 1 2 316.408 4.079 20 0 DIADLO Cc1cc(C[NH+](Cc2cccs2)Cc2cccs2)on1 ZINC000053420128 1044616423 /nfs/dbraw/zinc/61/64/23/1044616423.db2.gz PXWWBNZCYRKNHP-UHFFFAOYSA-N 1 2 304.440 4.308 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2coc(-c3ccccc3)n2)ccc1F ZINC000444742455 1044619026 /nfs/dbraw/zinc/61/90/26/1044619026.db2.gz FRNAMLVPMVUNMJ-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2coc(-c3ccccc3)n2)ccc1F ZINC000444742455 1044619031 /nfs/dbraw/zinc/61/90/31/1044619031.db2.gz FRNAMLVPMVUNMJ-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO CCn1ccnc1C[NH2+][C@H](c1cccc(C)c1)c1cccc(F)c1 ZINC000296479695 1044622870 /nfs/dbraw/zinc/62/28/70/1044622870.db2.gz OEPUNEGMIFNEIH-HXUWFJFHSA-N 1 2 323.415 4.230 20 0 DIADLO CCCCOc1ccccc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000886270805 1044629125 /nfs/dbraw/zinc/62/91/25/1044629125.db2.gz NIGNREOPXXSROK-UHFFFAOYSA-N 1 2 300.402 4.021 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(-c2ccco2)cc1F ZINC000296604355 1044634299 /nfs/dbraw/zinc/63/42/99/1044634299.db2.gz XXNUCZATPURAGK-ZDUSSCGKSA-N 1 2 313.376 4.153 20 0 DIADLO O=C(Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)C1(C2CC2)CC1 ZINC000890266229 1044634613 /nfs/dbraw/zinc/63/46/13/1044634613.db2.gz ZCGNCYDBUZVVJA-UHFFFAOYSA-N 1 2 321.424 4.015 20 0 DIADLO Cc1cc(C)c2cc(NCc3cnc(C4CC4)nc3)ccc2[nH+]1 ZINC000886369781 1044636121 /nfs/dbraw/zinc/63/61/21/1044636121.db2.gz PIRZYGYSPGYSMG-UHFFFAOYSA-N 1 2 304.397 4.131 20 0 DIADLO CC(C)c1ccc([C@@H](C)[NH2+]Cc2ncc(C(F)(F)F)cn2)cc1 ZINC000296643955 1044638619 /nfs/dbraw/zinc/63/86/19/1044638619.db2.gz YHWAKCJAIPOQRC-GFCCVEGCSA-N 1 2 323.362 4.470 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C(F)(F)F)cn1)c1ccc(Cl)s1 ZINC000296653823 1044640570 /nfs/dbraw/zinc/64/05/70/1044640570.db2.gz ZCNJZEUKTABZBU-SSDOTTSWSA-N 1 2 321.755 4.061 20 0 DIADLO C[N@H+](Cc1nnc(-c2ccco2)o1)Cc1ccc2ccccc2c1 ZINC000015306312 1044658947 /nfs/dbraw/zinc/65/89/47/1044658947.db2.gz ZBACYJGJKHIZIY-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO C[N@@H+](Cc1nnc(-c2ccco2)o1)Cc1ccc2ccccc2c1 ZINC000015306312 1044658952 /nfs/dbraw/zinc/65/89/52/1044658952.db2.gz ZBACYJGJKHIZIY-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nccn2CC(F)(F)F)[C@@H]1c1ccccc1 ZINC000886545287 1044659084 /nfs/dbraw/zinc/65/90/84/1044659084.db2.gz KFMGBNYXRXCZIP-CJNGLKHVSA-N 1 2 323.362 4.029 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nccn2CC(F)(F)F)[C@@H]1c1ccccc1 ZINC000886545287 1044659087 /nfs/dbraw/zinc/65/90/87/1044659087.db2.gz KFMGBNYXRXCZIP-CJNGLKHVSA-N 1 2 323.362 4.029 20 0 DIADLO CC(C)(c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1)C1CCC1 ZINC000568959325 1044663402 /nfs/dbraw/zinc/66/34/02/1044663402.db2.gz FUBSDEVFFQZNOO-UHFFFAOYSA-N 1 2 322.412 4.059 20 0 DIADLO COc1ccc([C@@H]([NH2+][C@H]2CCc3cccnc32)c2ccco2)cc1 ZINC000886622439 1044670906 /nfs/dbraw/zinc/67/09/06/1044670906.db2.gz SRCBOHBENUQGDM-FXAWDEMLSA-N 1 2 320.392 4.050 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(F)c(C(F)(F)F)c2)CCC1(F)F ZINC000569057884 1044671732 /nfs/dbraw/zinc/67/17/32/1044671732.db2.gz IQCCKWDXRFORAT-SECBINFHSA-N 1 2 311.269 4.322 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(F)c(C(F)(F)F)c2)CCC1(F)F ZINC000569057884 1044671745 /nfs/dbraw/zinc/67/17/45/1044671745.db2.gz IQCCKWDXRFORAT-SECBINFHSA-N 1 2 311.269 4.322 20 0 DIADLO O=C(Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)C1=CCCCC1 ZINC000569057717 1044671973 /nfs/dbraw/zinc/67/19/73/1044671973.db2.gz DNSWOMHYWBDTSZ-UHFFFAOYSA-N 1 2 321.424 4.325 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000364649576 1044673501 /nfs/dbraw/zinc/67/35/01/1044673501.db2.gz UNYPYSLOMFWFHJ-SFHVURJKSA-N 1 2 305.466 4.043 20 0 DIADLO FC(F)Oc1cccc(Cl)c1C[NH2+][C@H]1CCc2cccnc21 ZINC000886648618 1044674432 /nfs/dbraw/zinc/67/44/32/1044674432.db2.gz ZERSYROTJSDTEO-ZDUSSCGKSA-N 1 2 324.758 4.114 20 0 DIADLO FCCCCC[N@@H+]1CCO[C@@H](c2ccccc2C(F)(F)F)C1 ZINC000569126560 1044675622 /nfs/dbraw/zinc/67/56/22/1044675622.db2.gz GTZKBORPAVMSGN-OAHLLOKOSA-N 1 2 319.342 4.219 20 0 DIADLO FCCCCC[N@H+]1CCO[C@@H](c2ccccc2C(F)(F)F)C1 ZINC000569126560 1044675629 /nfs/dbraw/zinc/67/56/29/1044675629.db2.gz GTZKBORPAVMSGN-OAHLLOKOSA-N 1 2 319.342 4.219 20 0 DIADLO COC[C@H](Nc1[nH+]c2ccccc2n1C)c1cccc(Cl)c1 ZINC000569113423 1044676040 /nfs/dbraw/zinc/67/60/40/1044676040.db2.gz MLQBOZBCOKMZAQ-HNNXBMFYSA-N 1 2 315.804 4.026 20 0 DIADLO Fc1ccc2c(c1Cl)[C@@H]([NH2+]Cc1cc(C3CC3)no1)CC2 ZINC000886684737 1044679141 /nfs/dbraw/zinc/67/91/41/1044679141.db2.gz RDAURXIDVODMLW-ZDUSSCGKSA-N 1 2 306.768 4.122 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2ccc([C@@H]3C[C@@H]3C)o2)c(C)[nH+]1 ZINC000569201040 1044683731 /nfs/dbraw/zinc/68/37/31/1044683731.db2.gz LKSAQSAGPVSOHP-ZUZCIYMTSA-N 1 2 313.401 4.045 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000365343634 1044686202 /nfs/dbraw/zinc/68/62/02/1044686202.db2.gz LMPTWIMTDWMGMR-SJORKVTESA-N 1 2 305.466 4.043 20 0 DIADLO Fc1ccc(C[NH2+][C@H]2CCCc3cn[nH]c32)c(Cl)c1Cl ZINC000365325810 1044686864 /nfs/dbraw/zinc/68/68/64/1044686864.db2.gz KZUQHDCGGDZWGV-NSHDSACASA-N 1 2 314.191 4.023 20 0 DIADLO Fc1ccc(C[NH2+][C@H]2CCCc3c[nH]nc32)c(Cl)c1Cl ZINC000365325810 1044686868 /nfs/dbraw/zinc/68/68/68/1044686868.db2.gz KZUQHDCGGDZWGV-NSHDSACASA-N 1 2 314.191 4.023 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)o1 ZINC000076292821 1044690469 /nfs/dbraw/zinc/69/04/69/1044690469.db2.gz RWGUPZIKBGVTKL-OAHLLOKOSA-N 1 2 305.397 4.209 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000076120378 1044691377 /nfs/dbraw/zinc/69/13/77/1044691377.db2.gz QEEUDJVULKDLJE-OCCSQVGLSA-N 1 2 303.406 4.068 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000076120378 1044691385 /nfs/dbraw/zinc/69/13/85/1044691385.db2.gz QEEUDJVULKDLJE-OCCSQVGLSA-N 1 2 303.406 4.068 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(C2CCCCC2)s1)c1cscn1 ZINC000569825205 1044713654 /nfs/dbraw/zinc/71/36/54/1044713654.db2.gz HMKWNVOUVOEIHH-NSHDSACASA-N 1 2 307.488 4.498 20 0 DIADLO Cc1conc1C[NH2+][C@@H](C)c1cccc(SC(F)(F)F)c1 ZINC000886932456 1044720249 /nfs/dbraw/zinc/72/02/49/1044720249.db2.gz AQXMBZUDUWHTBQ-JTQLQIEISA-N 1 2 316.348 4.446 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2cccc(SC(F)(F)F)c2)o1 ZINC000886929860 1044720841 /nfs/dbraw/zinc/72/08/41/1044720841.db2.gz IZMISRPEUPTXBT-SNVBAGLBSA-N 1 2 316.348 4.446 20 0 DIADLO Cc1cc(C[NH2+]C(c2cccc(C)c2)c2cccc(C)c2)no1 ZINC000084494363 1044724222 /nfs/dbraw/zinc/72/42/22/1044724222.db2.gz RYPKATAVPUSZMG-UHFFFAOYSA-N 1 2 306.409 4.479 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+]([C@@H](C)c2ccco2)C2CC2)c(C)c1 ZINC000086233022 1044730743 /nfs/dbraw/zinc/73/07/43/1044730743.db2.gz BFOXFMNAMLQPFX-HNNXBMFYSA-N 1 2 312.413 4.061 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+]([C@@H](C)c2ccco2)C2CC2)c(C)c1 ZINC000086233022 1044730757 /nfs/dbraw/zinc/73/07/57/1044730757.db2.gz BFOXFMNAMLQPFX-HNNXBMFYSA-N 1 2 312.413 4.061 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CCC(C)=C(c3ccco3)C2)cs1 ZINC000367220375 1044733898 /nfs/dbraw/zinc/73/38/98/1044733898.db2.gz UISNUXFNOQTBNG-CYBMUJFWSA-N 1 2 318.442 4.123 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CCC(C)=C(c3ccco3)C2)cs1 ZINC000367220375 1044733909 /nfs/dbraw/zinc/73/39/09/1044733909.db2.gz UISNUXFNOQTBNG-CYBMUJFWSA-N 1 2 318.442 4.123 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(-c2cnc(C3CC3)o2)cc1 ZINC000570147815 1044735474 /nfs/dbraw/zinc/73/54/74/1044735474.db2.gz UQYXWFVDOJSBIJ-UHFFFAOYSA-N 1 2 308.385 4.048 20 0 DIADLO CSC1(C[N@@H+]2CCn3c(cc4cc(Cl)ccc43)C2)CC1 ZINC000570318173 1044749781 /nfs/dbraw/zinc/74/97/81/1044749781.db2.gz ABGMJKXCJZZDPE-UHFFFAOYSA-N 1 2 306.862 4.006 20 0 DIADLO CSC1(C[N@H+]2CCn3c(cc4cc(Cl)ccc43)C2)CC1 ZINC000570318173 1044749794 /nfs/dbraw/zinc/74/97/94/1044749794.db2.gz ABGMJKXCJZZDPE-UHFFFAOYSA-N 1 2 306.862 4.006 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000368082744 1044766385 /nfs/dbraw/zinc/76/63/85/1044766385.db2.gz ZCEDHTUMHMXADE-MRXNPFEDSA-N 1 2 317.845 4.312 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000368082744 1044766398 /nfs/dbraw/zinc/76/63/98/1044766398.db2.gz ZCEDHTUMHMXADE-MRXNPFEDSA-N 1 2 317.845 4.312 20 0 DIADLO CC(C)n1ccnc1SCc1c[nH+]cn1Cc1ccccc1 ZINC000445601293 1044767874 /nfs/dbraw/zinc/76/78/74/1044767874.db2.gz QSFHPGXRTUMVNI-UHFFFAOYSA-N 1 2 312.442 4.001 20 0 DIADLO Brc1ccc([C@H]2CCC[N@@H+]2Cc2ccccn2)s1 ZINC000368200416 1044771474 /nfs/dbraw/zinc/77/14/74/1044771474.db2.gz PBCLVXGJPYYONQ-GFCCVEGCSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc([C@H]2CCC[N@H+]2Cc2ccccn2)s1 ZINC000368200416 1044771485 /nfs/dbraw/zinc/77/14/85/1044771485.db2.gz PBCLVXGJPYYONQ-GFCCVEGCSA-N 1 2 323.259 4.243 20 0 DIADLO Clc1ccc(C2([NH2+][C@H]3CCCc4[nH]ncc43)CCC2)cc1 ZINC000368609533 1044782436 /nfs/dbraw/zinc/78/24/36/1044782436.db2.gz YYXPJBCRLPCNAH-HNNXBMFYSA-N 1 2 301.821 4.110 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1ncoc1-c1ccccc1 ZINC000368922158 1044792597 /nfs/dbraw/zinc/79/25/97/1044792597.db2.gz WVNRMYCHXOSIEQ-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO Cc1cc(C)c(CNC(=O)N2CCCC[C@@H]2c2ccccc2)c[nH+]1 ZINC000459074313 1044794168 /nfs/dbraw/zinc/79/41/68/1044794168.db2.gz JZTIBKBVMOATQJ-LJQANCHMSA-N 1 2 323.440 4.135 20 0 DIADLO Cc1cccc(C[N@@H+]2CCO[C@H](c3ccc(F)c(Cl)c3)C2)c1 ZINC000524308986 1044794579 /nfs/dbraw/zinc/79/45/79/1044794579.db2.gz GNCSWBBWGMLBLT-SFHVURJKSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1cccc(C[N@H+]2CCO[C@H](c3ccc(F)c(Cl)c3)C2)c1 ZINC000524308986 1044794590 /nfs/dbraw/zinc/79/45/90/1044794590.db2.gz GNCSWBBWGMLBLT-SFHVURJKSA-N 1 2 319.807 4.361 20 0 DIADLO COc1c(C)c[nH+]c(CN(Cc2ccco2)C2CCCC2)c1C ZINC000524310215 1044795200 /nfs/dbraw/zinc/79/52/00/1044795200.db2.gz ZIQZJIPVUCWSDU-UHFFFAOYSA-N 1 2 314.429 4.245 20 0 DIADLO Cc1cccc([C@@H](c2noc(C[C@@H](C)n3cc[nH+]c3)n2)C(C)C)c1 ZINC000571170727 1044800042 /nfs/dbraw/zinc/80/00/42/1044800042.db2.gz IXDUMCOKWCMNNN-QAPCUYQASA-N 1 2 324.428 4.166 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2ccccc2F)c2ccccn2)cc1 ZINC000369289626 1044800502 /nfs/dbraw/zinc/80/05/02/1044800502.db2.gz BXAFAFMHEZIAMU-HXUWFJFHSA-N 1 2 306.384 4.408 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)s1 ZINC000125377719 1044801185 /nfs/dbraw/zinc/80/11/85/1044801185.db2.gz YHZXTBSYLIINHM-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@@H]2c2ccncc2)s1 ZINC000125377719 1044801211 /nfs/dbraw/zinc/80/12/11/1044801211.db2.gz YHZXTBSYLIINHM-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO c1csc(-c2cc(C[N@@H+]3CCC[C@@H]3c3ccncc3)no2)c1 ZINC000125477150 1044801395 /nfs/dbraw/zinc/80/13/95/1044801395.db2.gz JDZMXZDZEMQDCM-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2cc(C[N@H+]3CCC[C@@H]3c3ccncc3)no2)c1 ZINC000125477150 1044801425 /nfs/dbraw/zinc/80/14/25/1044801425.db2.gz JDZMXZDZEMQDCM-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO Brc1cc(C[N@@H+]2CCC[C@H]2c2ccncc2)cs1 ZINC000125600726 1044801477 /nfs/dbraw/zinc/80/14/77/1044801477.db2.gz HXTZEKZTOLHPIP-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cc(C[N@H+]2CCC[C@H]2c2ccncc2)cs1 ZINC000125600726 1044801497 /nfs/dbraw/zinc/80/14/97/1044801497.db2.gz HXTZEKZTOLHPIP-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1nn(C(C)C)cc1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000369749883 1044815855 /nfs/dbraw/zinc/81/58/55/1044815855.db2.gz KFUMDVJXRZLIBJ-HXUWFJFHSA-N 1 2 320.440 4.047 20 0 DIADLO CC(C)(C)[C@H]1CCC[N@H+](Cc2ncc(Br)s2)C1 ZINC000475634802 1044828160 /nfs/dbraw/zinc/82/81/60/1044828160.db2.gz LERMYPGNDDDLEL-JTQLQIEISA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)(C)[C@H]1CCC[N@@H+](Cc2ncc(Br)s2)C1 ZINC000475634802 1044828186 /nfs/dbraw/zinc/82/81/86/1044828186.db2.gz LERMYPGNDDDLEL-JTQLQIEISA-N 1 2 317.296 4.164 20 0 DIADLO C[C@H]([NH2+][C@H]1C=CCCCCC1)c1noc(Cc2ccccc2)n1 ZINC000571943393 1044833550 /nfs/dbraw/zinc/83/35/50/1044833550.db2.gz UVDVXMAONDJZGL-RDJZCZTQSA-N 1 2 311.429 4.200 20 0 DIADLO C[C@H](c1ccccc1Br)[N@@H+]1CCc2ncsc2C1 ZINC000445851551 1044836327 /nfs/dbraw/zinc/83/63/27/1044836327.db2.gz GSEHTLAZZRPTGE-SNVBAGLBSA-N 1 2 323.259 4.025 20 0 DIADLO C[C@H](c1ccccc1Br)[N@H+]1CCc2ncsc2C1 ZINC000445851551 1044836355 /nfs/dbraw/zinc/83/63/55/1044836355.db2.gz GSEHTLAZZRPTGE-SNVBAGLBSA-N 1 2 323.259 4.025 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ccc([C@@H]4C[C@H]4C)o3)CCC2)n1 ZINC000264544962 1044889245 /nfs/dbraw/zinc/88/92/45/1044889245.db2.gz ULBDCDSWKUFIAD-BXUZGUMPSA-N 1 2 302.443 4.337 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@@H+]2Cc2cccnc2)s1 ZINC000371751711 1044889469 /nfs/dbraw/zinc/88/94/69/1044889469.db2.gz AYMVVGVPHBUGSX-LBPRGKRZSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@H+]2Cc2cccnc2)s1 ZINC000371751711 1044889486 /nfs/dbraw/zinc/88/94/86/1044889486.db2.gz AYMVVGVPHBUGSX-LBPRGKRZSA-N 1 2 323.259 4.243 20 0 DIADLO CC(C)c1csc(C[NH2+][C@@H](C)c2cnn(C3CCCC3)c2)n1 ZINC000337495658 1044908735 /nfs/dbraw/zinc/90/87/35/1044908735.db2.gz YFAYVAIBWPRMGY-ZDUSSCGKSA-N 1 2 318.490 4.429 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cnn(C3CCCC3)c2)cs1 ZINC000337505335 1044910923 /nfs/dbraw/zinc/91/09/23/1044910923.db2.gz FEOGSHHRDZLOJD-QWHCGFSZSA-N 1 2 318.490 4.429 20 0 DIADLO CC(C)CC[C@@H]1CCC[C@@H]1Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000573764182 1044922352 /nfs/dbraw/zinc/92/23/52/1044922352.db2.gz UYUXNYJYXOQOQC-ROUUACIJSA-N 1 2 312.461 4.343 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@@H+]2Cc2ccc3ccccc3c2)o1 ZINC000524811687 1044926939 /nfs/dbraw/zinc/92/69/39/1044926939.db2.gz KTIAAEIMETUYRK-IBGZPJMESA-N 1 2 307.393 4.315 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@H+]2Cc2ccc3ccccc3c2)o1 ZINC000524811687 1044926958 /nfs/dbraw/zinc/92/69/58/1044926958.db2.gz KTIAAEIMETUYRK-IBGZPJMESA-N 1 2 307.393 4.315 20 0 DIADLO Cc1ccccc1[C@@H](c1noc(C[C@H](C)n2cc[nH+]c2)n1)C(C)C ZINC000574457937 1044955392 /nfs/dbraw/zinc/95/53/92/1044955392.db2.gz SJZJROAFPSDLCW-YJBOKZPZSA-N 1 2 324.428 4.166 20 0 DIADLO Cc1c(F)nccc1Nc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001212838394 1044966047 /nfs/dbraw/zinc/96/60/47/1044966047.db2.gz TXEUXTMZXYIUHB-UHFFFAOYSA-N 1 2 318.352 4.015 20 0 DIADLO C[C@H]([NH2+]Cc1csc(Cl)c1Cl)c1ccncc1F ZINC000337950322 1044967183 /nfs/dbraw/zinc/96/71/83/1044967183.db2.gz QMNZUZHOMCQSRP-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cccc4ccoc43)CCCCC2)no1 ZINC000574838088 1044974911 /nfs/dbraw/zinc/97/49/11/1044974911.db2.gz FHWUTELWQLLEEE-UHFFFAOYSA-N 1 2 311.385 4.073 20 0 DIADLO CC(C)(C)c1ccc(CCC(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC000525105014 1044984593 /nfs/dbraw/zinc/98/45/93/1044984593.db2.gz VLCHMXANENRACA-UHFFFAOYSA-N 1 2 321.424 4.203 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@H]2CCC[C@H](C)C2)no1)c1ccccc1 ZINC000575834972 1045012505 /nfs/dbraw/zinc/01/25/05/1045012505.db2.gz KOTDUKPPULVBKH-BHYGNILZSA-N 1 2 313.445 4.404 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@H]2CCC[C@H](C)C2)no1)c1ccccc1 ZINC000575834972 1045012521 /nfs/dbraw/zinc/01/25/21/1045012521.db2.gz KOTDUKPPULVBKH-BHYGNILZSA-N 1 2 313.445 4.404 20 0 DIADLO COc1cc(C)nc(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC000411523905 1045013869 /nfs/dbraw/zinc/01/38/69/1045013869.db2.gz AMFRZKZJGFZQDB-GFCCVEGCSA-N 1 2 319.474 4.003 20 0 DIADLO FC(F)OC[C@H]1CC[N@H+](Cc2csc(Cl)c2Cl)C1 ZINC000575956582 1045021699 /nfs/dbraw/zinc/02/16/99/1045021699.db2.gz YYTLYNBIKQFOBQ-ZETCQYMHSA-N 1 2 316.200 4.116 20 0 DIADLO FC(F)OC[C@H]1CC[N@@H+](Cc2csc(Cl)c2Cl)C1 ZINC000575956582 1045021707 /nfs/dbraw/zinc/02/17/07/1045021707.db2.gz YYTLYNBIKQFOBQ-ZETCQYMHSA-N 1 2 316.200 4.116 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)[nH]1 ZINC000411824578 1045029513 /nfs/dbraw/zinc/02/95/13/1045029513.db2.gz QRNPTFGHFCLLQA-WMLDXEAASA-N 1 2 310.445 4.182 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)[nH]1 ZINC000411824578 1045029523 /nfs/dbraw/zinc/02/95/23/1045029523.db2.gz QRNPTFGHFCLLQA-WMLDXEAASA-N 1 2 310.445 4.182 20 0 DIADLO CCc1ccc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3[nH]2)nc1 ZINC000411788643 1045029558 /nfs/dbraw/zinc/02/95/58/1045029558.db2.gz GUKOTUUYFPBCND-IBGZPJMESA-N 1 2 320.440 4.248 20 0 DIADLO CCc1ccc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3[nH]2)nc1 ZINC000411788643 1045029570 /nfs/dbraw/zinc/02/95/70/1045029570.db2.gz GUKOTUUYFPBCND-IBGZPJMESA-N 1 2 320.440 4.248 20 0 DIADLO COC(=O)c1sccc1C[N@@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000446779876 1045041187 /nfs/dbraw/zinc/04/11/87/1045041187.db2.gz DDXACYXTDIZSJI-JSGCOSHPSA-N 1 2 319.426 4.101 20 0 DIADLO COC(=O)c1sccc1C[N@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000446779876 1045041200 /nfs/dbraw/zinc/04/12/00/1045041200.db2.gz DDXACYXTDIZSJI-JSGCOSHPSA-N 1 2 319.426 4.101 20 0 DIADLO CC[N@H+](CC(=O)Nc1ccc(C)cc1Cl)Cc1occc1C ZINC000412030875 1045049170 /nfs/dbraw/zinc/04/91/70/1045049170.db2.gz WYQDIBDFWDBUDA-UHFFFAOYSA-N 1 2 320.820 4.010 20 0 DIADLO CC[N@@H+](CC(=O)Nc1ccc(C)cc1Cl)Cc1occc1C ZINC000412030875 1045049182 /nfs/dbraw/zinc/04/91/82/1045049182.db2.gz WYQDIBDFWDBUDA-UHFFFAOYSA-N 1 2 320.820 4.010 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccncc2Cl)cc1Cl ZINC000412037512 1045049601 /nfs/dbraw/zinc/04/96/01/1045049601.db2.gz IPNBBYGZSXXTJO-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccncc2Cl)cc1Cl ZINC000412037512 1045049612 /nfs/dbraw/zinc/04/96/12/1045049612.db2.gz IPNBBYGZSXXTJO-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO CC[N@H+](Cc1occc1C)[C@H](C)c1nnc(-c2cccs2)o1 ZINC000412042691 1045050472 /nfs/dbraw/zinc/05/04/72/1045050472.db2.gz OJMHAWRBTDQSAG-GFCCVEGCSA-N 1 2 317.414 4.283 20 0 DIADLO CC[N@@H+](Cc1occc1C)[C@H](C)c1nnc(-c2cccs2)o1 ZINC000412042691 1045050483 /nfs/dbraw/zinc/05/04/83/1045050483.db2.gz OJMHAWRBTDQSAG-GFCCVEGCSA-N 1 2 317.414 4.283 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2nnc(C(C)(C)C)o2)o1 ZINC000158660242 1045051994 /nfs/dbraw/zinc/05/19/94/1045051994.db2.gz ZBOXUCIJPSCOSQ-CQSZACIVSA-N 1 2 317.433 4.386 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2cnn(C)c2)c2ccccc2)oc1C ZINC000374346085 1045052034 /nfs/dbraw/zinc/05/20/34/1045052034.db2.gz PRZDEWWDVLXWTJ-AUUYWEPGSA-N 1 2 309.413 4.070 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2nnc(C(C)(C)C)o2)o1 ZINC000158660242 1045052007 /nfs/dbraw/zinc/05/20/07/1045052007.db2.gz ZBOXUCIJPSCOSQ-CQSZACIVSA-N 1 2 317.433 4.386 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+]Cc2cc(C)on2)cc1OC ZINC000153528406 1045057759 /nfs/dbraw/zinc/05/77/59/1045057759.db2.gz HUKDGOANYJYDFQ-CQSZACIVSA-N 1 2 318.417 4.021 20 0 DIADLO CCCCC[N@H+](Cc1ncnn1CCC)Cc1ccc(F)cc1 ZINC000576580292 1045065988 /nfs/dbraw/zinc/06/59/88/1045065988.db2.gz QWMGASXZNZLWTO-UHFFFAOYSA-N 1 2 318.440 4.020 20 0 DIADLO CCCCC[N@@H+](Cc1ncnn1CCC)Cc1ccc(F)cc1 ZINC000576580292 1045065997 /nfs/dbraw/zinc/06/59/97/1045065997.db2.gz QWMGASXZNZLWTO-UHFFFAOYSA-N 1 2 318.440 4.020 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]Cc1cnc(C2CCCCC2)s1 ZINC000576582560 1045067070 /nfs/dbraw/zinc/06/70/70/1045067070.db2.gz XDWXIYUIAQJCTH-ZDUSSCGKSA-N 1 2 318.490 4.258 20 0 DIADLO CCS[C@@H]1CCCC[N@H+](Cc2noc(C3CCCCC3)n2)C1 ZINC000447041665 1045085544 /nfs/dbraw/zinc/08/55/44/1045085544.db2.gz ORIXVALJKALUBO-OAHLLOKOSA-N 1 2 323.506 4.225 20 0 DIADLO CCS[C@@H]1CCCC[N@@H+](Cc2noc(C3CCCCC3)n2)C1 ZINC000447041665 1045085556 /nfs/dbraw/zinc/08/55/56/1045085556.db2.gz ORIXVALJKALUBO-OAHLLOKOSA-N 1 2 323.506 4.225 20 0 DIADLO C[NH+](C)[C@H](c1nc(C2CCC(C)(C)CC2)no1)c1ccccc1 ZINC000576984897 1045092065 /nfs/dbraw/zinc/09/20/65/1045092065.db2.gz XSPHMQOUUNSODQ-INIZCTEOSA-N 1 2 313.445 4.404 20 0 DIADLO CCn1cc(C[NH2+]C2(c3c(Cl)cccc3Cl)CCC2)cn1 ZINC000447071362 1045094118 /nfs/dbraw/zinc/09/41/18/1045094118.db2.gz XPWBMKKWWZOYFF-UHFFFAOYSA-N 1 2 324.255 4.379 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2nc(C(C)(C)C)cs2)cc1 ZINC000447284040 1045114599 /nfs/dbraw/zinc/11/45/99/1045114599.db2.gz BKULELUIOIGBAT-UHFFFAOYSA-N 1 2 318.486 4.471 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2nc(C(C)(C)C)cs2)cc1 ZINC000447284040 1045114606 /nfs/dbraw/zinc/11/46/06/1045114606.db2.gz BKULELUIOIGBAT-UHFFFAOYSA-N 1 2 318.486 4.471 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2nc(C(C)(C)C)cs2)cc1 ZINC000447291685 1045116863 /nfs/dbraw/zinc/11/68/63/1045116863.db2.gz GRPMOVYYEQQUBN-UHFFFAOYSA-N 1 2 304.459 4.081 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2nc(C(C)(C)C)cs2)cc1 ZINC000447291685 1045116870 /nfs/dbraw/zinc/11/68/70/1045116870.db2.gz GRPMOVYYEQQUBN-UHFFFAOYSA-N 1 2 304.459 4.081 20 0 DIADLO CCc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2)nc1 ZINC000577473311 1045126770 /nfs/dbraw/zinc/12/67/70/1045126770.db2.gz YBLJWKYBMHFPIF-UHFFFAOYSA-N 1 2 306.409 4.439 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2)nc1 ZINC000577473311 1045126777 /nfs/dbraw/zinc/12/67/77/1045126777.db2.gz YBLJWKYBMHFPIF-UHFFFAOYSA-N 1 2 306.409 4.439 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1ccns1)c1nc(C(F)(F)F)cs1 ZINC000925196361 1045136004 /nfs/dbraw/zinc/13/60/04/1045136004.db2.gz ZPARSESGNQGMJE-SFYZADRCSA-N 1 2 321.393 4.420 20 0 DIADLO Cc1cc(F)cc(-c2noc([C@@H](CC(C)C)n3cc[nH+]c3)n2)c1 ZINC000923815959 1045144319 /nfs/dbraw/zinc/14/43/19/1045144319.db2.gz XLPUZIXNFFFQIX-OAHLLOKOSA-N 1 2 314.364 4.016 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+]CCN2CCCC(C)(C)C2)cs1 ZINC000447549826 1045145548 /nfs/dbraw/zinc/14/55/48/1045145548.db2.gz GBCAHYSYTGALGP-CQSZACIVSA-N 1 2 309.523 4.039 20 0 DIADLO Cc1ccccc1[C@@H](c1noc([C@@H]2C[C@H]2c2c[nH]c[nH+]2)n1)C(C)C ZINC000924068060 1045145656 /nfs/dbraw/zinc/14/56/56/1045145656.db2.gz GKDPYCCDYJSEQA-INMHGKMJSA-N 1 2 322.412 4.160 20 0 DIADLO Cc1ccccc1[C@H]([C@@H](C)N[C@H]1CCCc2occc21)[NH+](C)C ZINC000447593658 1045155147 /nfs/dbraw/zinc/15/51/47/1045155147.db2.gz UHLXRAXLNGBTBK-BPAFIMBUSA-N 1 2 312.457 4.246 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccno2)ccc1Br ZINC000577696516 1045157955 /nfs/dbraw/zinc/15/79/55/1045157955.db2.gz RANMRHCJOFCIFY-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccno2)ccc1Br ZINC000577696516 1045157956 /nfs/dbraw/zinc/15/79/56/1045157956.db2.gz RANMRHCJOFCIFY-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccno2)ccc1Br ZINC000577696517 1045158918 /nfs/dbraw/zinc/15/89/18/1045158918.db2.gz RANMRHCJOFCIFY-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccno2)ccc1Br ZINC000577696517 1045158921 /nfs/dbraw/zinc/15/89/21/1045158921.db2.gz RANMRHCJOFCIFY-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]C(c2ccccc2)c2ccccc2)nn1 ZINC000924529527 1045173675 /nfs/dbraw/zinc/17/36/75/1045173675.db2.gz VMCGWXGAJFRQJY-MRXNPFEDSA-N 1 2 320.440 4.299 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]C(c2ccccc2)c2ccccc2)nn1 ZINC000924529525 1045174147 /nfs/dbraw/zinc/17/41/47/1045174147.db2.gz VMCGWXGAJFRQJY-INIZCTEOSA-N 1 2 320.440 4.299 20 0 DIADLO FC(F)(F)c1ncc(C[N@@H+]2CCC[C@H]2c2ccccc2)s1 ZINC000447795743 1045176361 /nfs/dbraw/zinc/17/63/61/1045176361.db2.gz PYSDCLLQTBJALA-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1ncc(C[N@H+]2CCC[C@H]2c2ccccc2)s1 ZINC000447795743 1045176367 /nfs/dbraw/zinc/17/63/67/1045176367.db2.gz PYSDCLLQTBJALA-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO Fc1cccc(Cl)c1CCC[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000577901861 1045185645 /nfs/dbraw/zinc/18/56/45/1045185645.db2.gz QJGCPVRLUJAHNS-KRWDZBQOSA-N 1 2 321.827 4.362 20 0 DIADLO Fc1cccc(Cl)c1CCC[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000577901861 1045185654 /nfs/dbraw/zinc/18/56/54/1045185654.db2.gz QJGCPVRLUJAHNS-KRWDZBQOSA-N 1 2 321.827 4.362 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccnn1C1CCC1 ZINC000924721624 1045194371 /nfs/dbraw/zinc/19/43/71/1045194371.db2.gz PDRPIYCGGXHPOT-NEPJUHHUSA-N 1 2 305.372 4.298 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2c1nccc2Cl)c1c(F)cccc1F ZINC000924723193 1045194512 /nfs/dbraw/zinc/19/45/12/1045194512.db2.gz ZIKAODJQFWXGNQ-OTYXRUKQSA-N 1 2 308.759 4.351 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@@H](c1nc2ccccc2[nH]1)C(C)C ZINC000924784095 1045198094 /nfs/dbraw/zinc/19/80/94/1045198094.db2.gz ACIZGHPYIJVFSX-NVXWUHKLSA-N 1 2 324.428 4.224 20 0 DIADLO Cc1noc(C)c1C[NH2+][C@@H](c1cccnc1)c1cc(C)cc(C)c1 ZINC000924780748 1045198651 /nfs/dbraw/zinc/19/86/51/1045198651.db2.gz IAPCBAUJAXSKKD-FQEVSTJZSA-N 1 2 321.424 4.182 20 0 DIADLO Cc1nnsc1C[N@H+](Cc1ccc(F)cc1F)C1CCCC1 ZINC000578017325 1045199302 /nfs/dbraw/zinc/19/93/02/1045199302.db2.gz YQWVAQHJGRRSLS-UHFFFAOYSA-N 1 2 323.412 4.070 20 0 DIADLO Cc1nnsc1C[N@@H+](Cc1ccc(F)cc1F)C1CCCC1 ZINC000578017325 1045199311 /nfs/dbraw/zinc/19/93/11/1045199311.db2.gz YQWVAQHJGRRSLS-UHFFFAOYSA-N 1 2 323.412 4.070 20 0 DIADLO Fc1cc(Br)cc([C@H]2CCC[N@@H+]2CC2(F)CC2)c1 ZINC000527235092 1045205880 /nfs/dbraw/zinc/20/58/80/1045205880.db2.gz LQZQQESFQJWLDV-CYBMUJFWSA-N 1 2 316.189 4.227 20 0 DIADLO Fc1cc(Br)cc([C@H]2CCC[N@H+]2CC2(F)CC2)c1 ZINC000527235092 1045205884 /nfs/dbraw/zinc/20/58/84/1045205884.db2.gz LQZQQESFQJWLDV-CYBMUJFWSA-N 1 2 316.189 4.227 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1cccc(Cl)c1Cl ZINC000924859436 1045206598 /nfs/dbraw/zinc/20/65/98/1045206598.db2.gz VUZJXDOBNNJLDO-LBPRGKRZSA-N 1 2 311.212 4.457 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(OC2CCCCC2)cc1)c1ncco1 ZINC000924882911 1045207739 /nfs/dbraw/zinc/20/77/39/1045207739.db2.gz OBOLLGLLFLEQJF-AWEZNQCLSA-N 1 2 300.402 4.237 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@@H](C)c1ccc(OCCC(C)C)cc1 ZINC000924889708 1045208148 /nfs/dbraw/zinc/20/81/48/1045208148.db2.gz MHDFZWFLFSCIPZ-UONOGXRCSA-N 1 2 317.433 4.215 20 0 DIADLO c1cn(-c2cccc(Oc3nc(C4CCCC4)ns3)c2)c[nH+]1 ZINC000557634828 1045211237 /nfs/dbraw/zinc/21/12/37/1045211237.db2.gz NVWKUJJEQCPKRD-UHFFFAOYSA-N 1 2 312.398 4.174 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cnn(C2CCC2)c1 ZINC000924972011 1045214605 /nfs/dbraw/zinc/21/46/05/1045214605.db2.gz ZHSHFVWKTHMMRW-LBPRGKRZSA-N 1 2 318.490 4.213 20 0 DIADLO Clc1cccc2c(N3CCC[C@H]3[C@@H]3CCCO3)cc[nH+]c12 ZINC000557672115 1045217389 /nfs/dbraw/zinc/21/73/89/1045217389.db2.gz FREFFUOLYGHDKM-HOTGVXAUSA-N 1 2 302.805 4.036 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H]2CCc3c2nccc3Cl)cs1 ZINC000925034759 1045221074 /nfs/dbraw/zinc/22/10/74/1045221074.db2.gz UKZXHRODBPCCEX-BXKDBHETSA-N 1 2 307.850 4.092 20 0 DIADLO C[N@H+](CCOc1ccc(F)cc1)Cc1ncc(C(C)(C)C)s1 ZINC000448220594 1045221543 /nfs/dbraw/zinc/22/15/43/1045221543.db2.gz QOFNGJPWXIPCFQ-UHFFFAOYSA-N 1 2 322.449 4.091 20 0 DIADLO C[N@@H+](CCOc1ccc(F)cc1)Cc1ncc(C(C)(C)C)s1 ZINC000448220594 1045221553 /nfs/dbraw/zinc/22/15/53/1045221553.db2.gz QOFNGJPWXIPCFQ-UHFFFAOYSA-N 1 2 322.449 4.091 20 0 DIADLO CC[C@H]([NH2+][C@H]1CCCc2oc(C)nc21)c1ccc(F)cc1F ZINC000925099857 1045225518 /nfs/dbraw/zinc/22/55/18/1045225518.db2.gz UKKFNJPYIQZBTQ-GJZGRUSLSA-N 1 2 306.356 4.380 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1cn2c(n1)CCCC2)c1ccc(F)cc1F ZINC000925097036 1045225823 /nfs/dbraw/zinc/22/58/23/1045225823.db2.gz JOTXGMRNSWZDLE-LRDDRELGSA-N 1 2 319.399 4.300 20 0 DIADLO c1nnc([C@@H]([NH2+]C2CCC3(CCCCC3)CC2)c2ccccc2)[nH]1 ZINC000527506081 1045229254 /nfs/dbraw/zinc/22/92/54/1045229254.db2.gz YUXXBHSLKVGDOE-SFHVURJKSA-N 1 2 324.472 4.377 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2cc(-c3ccccc3)no2)s1 ZINC000925162518 1045230572 /nfs/dbraw/zinc/23/05/72/1045230572.db2.gz HRHYDJOJMAOONA-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO CC(C)(C)[C@H]1C[N@H+](Cc2cnc(C3CCCC3)s2)CCO1 ZINC000448358678 1045236262 /nfs/dbraw/zinc/23/62/62/1045236262.db2.gz GIHADOAXIYUVKF-OAHLLOKOSA-N 1 2 308.491 4.048 20 0 DIADLO CC(C)(C)[C@H]1C[N@@H+](Cc2cnc(C3CCCC3)s2)CCO1 ZINC000448358678 1045236277 /nfs/dbraw/zinc/23/62/77/1045236277.db2.gz GIHADOAXIYUVKF-OAHLLOKOSA-N 1 2 308.491 4.048 20 0 DIADLO Cc1ncc(C[N@@H+]2CCSC[C@H]2c2ccc(Cl)cc2)s1 ZINC000116327028 1045246315 /nfs/dbraw/zinc/24/63/15/1045246315.db2.gz SMZXREMIQUMDMD-HNNXBMFYSA-N 1 2 324.902 4.395 20 0 DIADLO Cc1ncc(C[N@H+]2CCSC[C@H]2c2ccc(Cl)cc2)s1 ZINC000116327028 1045246325 /nfs/dbraw/zinc/24/63/25/1045246325.db2.gz SMZXREMIQUMDMD-HNNXBMFYSA-N 1 2 324.902 4.395 20 0 DIADLO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccsc1Br)CO2 ZINC000527673354 1045247912 /nfs/dbraw/zinc/24/79/12/1045247912.db2.gz FCEITUXYBKDLTB-LBPRGKRZSA-N 1 2 324.243 4.042 20 0 DIADLO S=c1ncccn1C[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000048621877 1045249609 /nfs/dbraw/zinc/24/96/09/1045249609.db2.gz DJDABUJTXUQIQB-AWEZNQCLSA-N 1 2 305.834 4.061 20 0 DIADLO S=c1ncccn1C[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC000048621877 1045249616 /nfs/dbraw/zinc/24/96/16/1045249616.db2.gz DJDABUJTXUQIQB-AWEZNQCLSA-N 1 2 305.834 4.061 20 0 DIADLO Cc1nn(C[N@@H+]2CCC[C@H]2c2ccccc2C)c(=S)s1 ZINC000048621880 1045249724 /nfs/dbraw/zinc/24/97/24/1045249724.db2.gz ICHXQQSBRJFOSC-AWEZNQCLSA-N 1 2 305.472 4.086 20 0 DIADLO Cc1nn(C[N@H+]2CCC[C@H]2c2ccccc2C)c(=S)s1 ZINC000048621880 1045249736 /nfs/dbraw/zinc/24/97/36/1045249736.db2.gz ICHXQQSBRJFOSC-AWEZNQCLSA-N 1 2 305.472 4.086 20 0 DIADLO Cc1nsc(C)c1C[N@@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000578717550 1045267715 /nfs/dbraw/zinc/26/77/15/1045267715.db2.gz XRWHNCVCUBEFQY-LJQANCHMSA-N 1 2 323.465 4.167 20 0 DIADLO Cc1nsc(C)c1C[N@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000578717550 1045267719 /nfs/dbraw/zinc/26/77/19/1045267719.db2.gz XRWHNCVCUBEFQY-LJQANCHMSA-N 1 2 323.465 4.167 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@@H]1CC12CC2 ZINC000527879719 1045277339 /nfs/dbraw/zinc/27/73/39/1045277339.db2.gz GUAFGLCAONGJRJ-YOEHRIQHSA-N 1 2 305.425 4.202 20 0 DIADLO CC[C@H](C)c1ccc([C@@H](C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000527905949 1045280193 /nfs/dbraw/zinc/28/01/93/1045280193.db2.gz SYPCBEUDZSLBON-QWHCGFSZSA-N 1 2 305.853 4.438 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](Cc2ccc(C)cc2)c2ccccn2)no1 ZINC000578916968 1045280522 /nfs/dbraw/zinc/28/05/22/1045280522.db2.gz IWEWMPDITKTJOJ-UZLBHIALSA-N 1 2 321.424 4.321 20 0 DIADLO Cc1ccc(C2CCN(c3[nH+]ccc4ccccc43)CC2)cn1 ZINC000527959216 1045287884 /nfs/dbraw/zinc/28/78/84/1045287884.db2.gz LBHMBGIFDMPWLD-UHFFFAOYSA-N 1 2 303.409 4.322 20 0 DIADLO COc1cccc2cc([C@H](C)[NH2+][C@@H](C)c3ncccc3F)oc21 ZINC000528035316 1045296286 /nfs/dbraw/zinc/29/62/86/1045296286.db2.gz FYEVBELEHKBNKG-RYUDHWBXSA-N 1 2 314.360 4.387 20 0 DIADLO Cc1noc(C[N@@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)n1 ZINC000117346695 1045301485 /nfs/dbraw/zinc/30/14/85/1045301485.db2.gz REFSDMZFVJBGJY-HNNXBMFYSA-N 1 2 305.809 4.149 20 0 DIADLO Cc1noc(C[N@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)n1 ZINC000117346695 1045301491 /nfs/dbraw/zinc/30/14/91/1045301491.db2.gz REFSDMZFVJBGJY-HNNXBMFYSA-N 1 2 305.809 4.149 20 0 DIADLO Cc1nc(N[C@@H](c2ccccn2)C2CCC2)c2c([nH+]1)CCCC2 ZINC000528141084 1045309310 /nfs/dbraw/zinc/30/93/10/1045309310.db2.gz ULWWMGOHXHZVEF-GOSISDBHSA-N 1 2 308.429 4.012 20 0 DIADLO O=C(c1cccc(-n2cc[nH+]c2)c1)N1CCC[C@@H]1C1CCCCC1 ZINC000117620482 1045310421 /nfs/dbraw/zinc/31/04/21/1045310421.db2.gz VAXZIZZVHGKIPF-LJQANCHMSA-N 1 2 323.440 4.057 20 0 DIADLO CC[N@H+](Cc1cc(C(C)=O)no1)[C@@H](C)c1cc2ccccc2o1 ZINC000579430599 1045315128 /nfs/dbraw/zinc/31/51/28/1045315128.db2.gz KNVVTFCTDBMLQD-LBPRGKRZSA-N 1 2 312.369 4.207 20 0 DIADLO CC[N@@H+](Cc1cc(C(C)=O)no1)[C@@H](C)c1cc2ccccc2o1 ZINC000579430599 1045315133 /nfs/dbraw/zinc/31/51/33/1045315133.db2.gz KNVVTFCTDBMLQD-LBPRGKRZSA-N 1 2 312.369 4.207 20 0 DIADLO CC(C)C[C@H](C)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000579524006 1045319768 /nfs/dbraw/zinc/31/97/68/1045319768.db2.gz DXIFHFREKZCTIV-AWEZNQCLSA-N 1 2 310.401 4.131 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cc1ccnn1C1CCCC1 ZINC000449009916 1045334418 /nfs/dbraw/zinc/33/44/18/1045334418.db2.gz XIQMFWZYFAHYRZ-UHFFFAOYSA-N 1 2 309.866 4.345 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1ccnn1C1CCCC1 ZINC000449009916 1045334421 /nfs/dbraw/zinc/33/44/21/1045334421.db2.gz XIQMFWZYFAHYRZ-UHFFFAOYSA-N 1 2 309.866 4.345 20 0 DIADLO CCC1(CO)CC[NH+](Cc2cc(Cl)sc2Cl)CC1 ZINC000449031292 1045335711 /nfs/dbraw/zinc/33/57/11/1045335711.db2.gz UYIGJFKHIMAZDL-UHFFFAOYSA-N 1 2 308.274 4.039 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cc1cccnc1C(F)(F)F ZINC000528334782 1045341450 /nfs/dbraw/zinc/34/14/50/1045341450.db2.gz AIDGQNSEVBOCRC-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1cccnc1C(F)(F)F ZINC000528334782 1045341457 /nfs/dbraw/zinc/34/14/57/1045341457.db2.gz AIDGQNSEVBOCRC-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccc(F)nc1 ZINC000189286917 1045344464 /nfs/dbraw/zinc/34/44/64/1045344464.db2.gz XGXZAEUGASJXQG-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccc(F)nc1 ZINC000189286917 1045344467 /nfs/dbraw/zinc/34/44/67/1045344467.db2.gz XGXZAEUGASJXQG-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1ccnn1C1CCCC1 ZINC000449106174 1045346900 /nfs/dbraw/zinc/34/69/00/1045346900.db2.gz KSFSRUJNNUANDZ-UHFFFAOYSA-N 1 2 307.800 4.081 20 0 DIADLO Fc1ccc(F)c(C[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000449124579 1045350247 /nfs/dbraw/zinc/35/02/47/1045350247.db2.gz GXBXXCOZKWMCCR-CYBMUJFWSA-N 1 2 313.269 4.159 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1ncccc1Cl)CCC2 ZINC000528415103 1045352502 /nfs/dbraw/zinc/35/25/02/1045352502.db2.gz DSYJTYXAYXUDLL-CQSZACIVSA-N 1 2 307.850 4.009 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ncccc1Cl)CCC2 ZINC000528415103 1045352507 /nfs/dbraw/zinc/35/25/07/1045352507.db2.gz DSYJTYXAYXUDLL-CQSZACIVSA-N 1 2 307.850 4.009 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccc1Cl)c1ccccc1OC(F)F ZINC000528433620 1045355830 /nfs/dbraw/zinc/35/58/30/1045355830.db2.gz RDGJIRMCDCZITN-SNVBAGLBSA-N 1 2 312.747 4.187 20 0 DIADLO CCOC1(C)CC[NH+](Cc2cc(Cl)sc2Cl)CC1 ZINC000449337626 1045382373 /nfs/dbraw/zinc/38/23/73/1045382373.db2.gz RYWJSUKSHIZYEU-UHFFFAOYSA-N 1 2 308.274 4.446 20 0 DIADLO Fc1ccc(C=C2CC[NH+](Cc3ccncc3F)CC2)cc1F ZINC000449247849 1045366247 /nfs/dbraw/zinc/36/62/47/1045366247.db2.gz HCVPMBUKHWDNGF-UHFFFAOYSA-N 1 2 318.342 4.178 20 0 DIADLO Cc1cnccc1C[N@@H+](C)[C@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000528515735 1045370162 /nfs/dbraw/zinc/37/01/62/1045370162.db2.gz CMOCMNMHLBUIOC-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1cnccc1C[N@H+](C)[C@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000528515735 1045370170 /nfs/dbraw/zinc/37/01/70/1045370170.db2.gz CMOCMNMHLBUIOC-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO CC[C@]1(CO)CCC[N@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449260180 1045371906 /nfs/dbraw/zinc/37/19/06/1045371906.db2.gz VACZMPHJLBSNNB-ZDUSSCGKSA-N 1 2 308.274 4.039 20 0 DIADLO CC[C@]1(CO)CCC[N@@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449260180 1045371915 /nfs/dbraw/zinc/37/19/15/1045371915.db2.gz VACZMPHJLBSNNB-ZDUSSCGKSA-N 1 2 308.274 4.039 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1ncccc1Cl ZINC000528507898 1045372614 /nfs/dbraw/zinc/37/26/14/1045372614.db2.gz XVNPYPZAOHYETG-INIZCTEOSA-N 1 2 304.821 4.327 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1ncccc1Cl ZINC000528507898 1045372617 /nfs/dbraw/zinc/37/26/17/1045372617.db2.gz XVNPYPZAOHYETG-INIZCTEOSA-N 1 2 304.821 4.327 20 0 DIADLO Cn1ccnc1[C@H]1[N@H+](Cc2ccc3ccccc3c2)CC1(C)C ZINC000449414305 1045388548 /nfs/dbraw/zinc/38/85/48/1045388548.db2.gz VUQLWKLIHUJPRA-GOSISDBHSA-N 1 2 305.425 4.156 20 0 DIADLO Cn1ccnc1[C@H]1[N@@H+](Cc2ccc3ccccc3c2)CC1(C)C ZINC000449414305 1045388549 /nfs/dbraw/zinc/38/85/49/1045388549.db2.gz VUQLWKLIHUJPRA-GOSISDBHSA-N 1 2 305.425 4.156 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000528722524 1045403333 /nfs/dbraw/zinc/40/33/33/1045403333.db2.gz ZYXQNVNLUMQFNY-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H](c1cccnc1)[N@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000528722524 1045403337 /nfs/dbraw/zinc/40/33/37/1045403337.db2.gz ZYXQNVNLUMQFNY-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000528722421 1045403541 /nfs/dbraw/zinc/40/35/41/1045403541.db2.gz YOPKWKFXNYWIJH-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000528722421 1045403542 /nfs/dbraw/zinc/40/35/42/1045403542.db2.gz YOPKWKFXNYWIJH-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO CCO[C@@H]1CC[N@H+](Cc2cc(Cl)sc2Cl)C[C@H]1C ZINC000449504522 1045404640 /nfs/dbraw/zinc/40/46/40/1045404640.db2.gz QLCACCOMJFOEDY-MWLCHTKSSA-N 1 2 308.274 4.302 20 0 DIADLO CCO[C@@H]1CC[N@@H+](Cc2cc(Cl)sc2Cl)C[C@H]1C ZINC000449504522 1045404642 /nfs/dbraw/zinc/40/46/42/1045404642.db2.gz QLCACCOMJFOEDY-MWLCHTKSSA-N 1 2 308.274 4.302 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2csc(Cl)c2Cl)CC1(C)C ZINC000449504374 1045404671 /nfs/dbraw/zinc/40/46/71/1045404671.db2.gz VXHRAWJOPSVWDO-SNVBAGLBSA-N 1 2 308.274 4.302 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2csc(Cl)c2Cl)CC1(C)C ZINC000449504374 1045404673 /nfs/dbraw/zinc/40/46/73/1045404673.db2.gz VXHRAWJOPSVWDO-SNVBAGLBSA-N 1 2 308.274 4.302 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1ccc(Br)s1 ZINC000528764513 1045408705 /nfs/dbraw/zinc/40/87/05/1045408705.db2.gz FNSWTUBKEFHLGP-MRVPVSSYSA-N 1 2 310.207 4.130 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1ccc(Br)s1 ZINC000528764513 1045408707 /nfs/dbraw/zinc/40/87/07/1045408707.db2.gz FNSWTUBKEFHLGP-MRVPVSSYSA-N 1 2 310.207 4.130 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](c2cccc(C)c2)C(C)C)n1 ZINC000528765850 1045411402 /nfs/dbraw/zinc/41/14/02/1045411402.db2.gz MMUKDACZRUWFIU-GOSISDBHSA-N 1 2 301.434 4.208 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2nc(C(C)(C)C)no2)C(C)C)c1 ZINC000528768842 1045412308 /nfs/dbraw/zinc/41/23/08/1045412308.db2.gz SRMMXVHBCWSVAT-INIZCTEOSA-N 1 2 301.434 4.162 20 0 DIADLO CC(C)(C)c1ncc(C[NH+]2CC(c3cccc(Cl)c3)C2)cn1 ZINC000449556734 1045412394 /nfs/dbraw/zinc/41/23/94/1045412394.db2.gz NVFZWZQWRHAQGG-UHFFFAOYSA-N 1 2 315.848 4.027 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(-c2ccc(C)cc2)o1 ZINC000449562269 1045415080 /nfs/dbraw/zinc/41/50/80/1045415080.db2.gz IPFOZAGQAIMXJO-HNNXBMFYSA-N 1 2 309.413 4.322 20 0 DIADLO CCCc1ncc(C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)o1 ZINC000449612891 1045418321 /nfs/dbraw/zinc/41/83/21/1045418321.db2.gz PFVJDOUJFVMVRK-UHFFFAOYSA-N 1 2 314.360 4.316 20 0 DIADLO Cc1ccc(-c2n[nH]cc2C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)o1 ZINC000449630966 1045422253 /nfs/dbraw/zinc/42/22/53/1045422253.db2.gz JIFYZJSFZJJYSP-GOSISDBHSA-N 1 2 323.396 4.298 20 0 DIADLO Cc1ccc(-c2n[nH]cc2C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)o1 ZINC000449630966 1045422259 /nfs/dbraw/zinc/42/22/59/1045422259.db2.gz JIFYZJSFZJJYSP-GOSISDBHSA-N 1 2 323.396 4.298 20 0 DIADLO CC1(C)C[C@@H](O)CC[N@@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449616395 1045422879 /nfs/dbraw/zinc/42/28/79/1045422879.db2.gz CRANCGKTMYXFQQ-JTQLQIEISA-N 1 2 308.274 4.038 20 0 DIADLO CC1(C)C[C@@H](O)CC[N@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449616395 1045422876 /nfs/dbraw/zinc/42/28/76/1045422876.db2.gz CRANCGKTMYXFQQ-JTQLQIEISA-N 1 2 308.274 4.038 20 0 DIADLO COCc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)o1 ZINC000449731320 1045430695 /nfs/dbraw/zinc/43/06/95/1045430695.db2.gz HYPCQXKQNMSZCP-KRWDZBQOSA-N 1 2 307.340 4.041 20 0 DIADLO COCc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)o1 ZINC000449731320 1045430700 /nfs/dbraw/zinc/43/07/00/1045430700.db2.gz HYPCQXKQNMSZCP-KRWDZBQOSA-N 1 2 307.340 4.041 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](CC)Cc2ccccc2C)n1 ZINC000119586034 1045432567 /nfs/dbraw/zinc/43/25/67/1045432567.db2.gz GSIHINYPVATAKM-CQSZACIVSA-N 1 2 319.474 4.214 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](CC)Cc2ccccc2C)n1 ZINC000119586034 1045432569 /nfs/dbraw/zinc/43/25/69/1045432569.db2.gz GSIHINYPVATAKM-CQSZACIVSA-N 1 2 319.474 4.214 20 0 DIADLO COCc1ccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000193417202 1045434820 /nfs/dbraw/zinc/43/48/20/1045434820.db2.gz KNICCPREWLOXDL-OAHLLOKOSA-N 1 2 307.397 4.192 20 0 DIADLO COc1ccc([C@H]([NH2+][C@@H](C)c2cc(C)ccn2)c2ccco2)cc1 ZINC000449783193 1045437705 /nfs/dbraw/zinc/43/77/05/1045437705.db2.gz ZZROKEPAJCWDIP-YWZLYKJASA-N 1 2 322.408 4.432 20 0 DIADLO Clc1cc(Cl)cc(CC[N@@H+]2CCC[C@@H]2c2ncccn2)c1 ZINC000639873774 1045472058 /nfs/dbraw/zinc/47/20/58/1045472058.db2.gz VEPXTDYKDQYNAJ-OAHLLOKOSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1cc(Cl)cc(CC[N@H+]2CCC[C@@H]2c2ncccn2)c1 ZINC000639873774 1045472066 /nfs/dbraw/zinc/47/20/66/1045472066.db2.gz VEPXTDYKDQYNAJ-OAHLLOKOSA-N 1 2 322.239 4.163 20 0 DIADLO CC[C@@H](C)[N@H+](Cc1nnc(C(C)C)s1)Cc1ccccc1 ZINC000450240443 1045478795 /nfs/dbraw/zinc/47/87/95/1045478795.db2.gz DGSLSJTVGZGHQX-CQSZACIVSA-N 1 2 303.475 4.462 20 0 DIADLO CC[C@@H](C)[N@@H+](Cc1nnc(C(C)C)s1)Cc1ccccc1 ZINC000450240443 1045478801 /nfs/dbraw/zinc/47/88/01/1045478801.db2.gz DGSLSJTVGZGHQX-CQSZACIVSA-N 1 2 303.475 4.462 20 0 DIADLO FC(F)(F)c1sccc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000529518012 1045487378 /nfs/dbraw/zinc/48/73/78/1045487378.db2.gz JIYQPRHJDGQUCD-LBPRGKRZSA-N 1 2 300.349 4.432 20 0 DIADLO FC(F)(F)c1sccc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000529518012 1045487380 /nfs/dbraw/zinc/48/73/80/1045487380.db2.gz JIYQPRHJDGQUCD-LBPRGKRZSA-N 1 2 300.349 4.432 20 0 DIADLO Brc1sccc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000529564023 1045494885 /nfs/dbraw/zinc/49/48/85/1045494885.db2.gz AJHXKDJMDHTXBX-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1sccc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000529564023 1045494888 /nfs/dbraw/zinc/49/48/88/1045494888.db2.gz AJHXKDJMDHTXBX-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO CCOC[C@H]1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C1 ZINC000450367953 1045497785 /nfs/dbraw/zinc/49/77/85/1045497785.db2.gz YHMWILVURNLVFO-LBPRGKRZSA-N 1 2 324.346 4.116 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2nnc(C3CC3)s2)o1 ZINC000450420710 1045502826 /nfs/dbraw/zinc/50/28/26/1045502826.db2.gz CQORDNJCAGKKOM-CQSZACIVSA-N 1 2 317.458 4.434 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2nnc(C3CC3)s2)o1 ZINC000450420710 1045502830 /nfs/dbraw/zinc/50/28/30/1045502830.db2.gz CQORDNJCAGKKOM-CQSZACIVSA-N 1 2 317.458 4.434 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@H](CC(C)C)c2ccccc2)n1 ZINC000121004410 1045507077 /nfs/dbraw/zinc/50/70/77/1045507077.db2.gz WXJXPQUSRPFNQB-MRXNPFEDSA-N 1 2 301.434 4.145 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nnc(C3CC3)s2)[C@@H]1c1cccc(F)c1 ZINC000450458871 1045509518 /nfs/dbraw/zinc/50/95/18/1045509518.db2.gz YYUXPGRFIXCHMH-BZNIZROVSA-N 1 2 317.433 4.138 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nnc(C3CC3)s2)[C@@H]1c1cccc(F)c1 ZINC000450458871 1045509527 /nfs/dbraw/zinc/50/95/27/1045509527.db2.gz YYUXPGRFIXCHMH-BZNIZROVSA-N 1 2 317.433 4.138 20 0 DIADLO CCC[C@@]1(C)CCC[N@@H+]([C@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001307500719 1045511796 /nfs/dbraw/zinc/51/17/96/1045511796.db2.gz VVJGKFUOVXZQRO-WMZOPIPTSA-N 1 2 323.864 4.456 20 0 DIADLO CCC[C@@]1(C)CCC[N@H+]([C@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001307500719 1045511802 /nfs/dbraw/zinc/51/18/02/1045511802.db2.gz VVJGKFUOVXZQRO-WMZOPIPTSA-N 1 2 323.864 4.456 20 0 DIADLO CCC[C@]1(CO)CCN(c2cc[nH+]c3cc(F)c(Cl)cc32)C1 ZINC000450533781 1045514978 /nfs/dbraw/zinc/51/49/78/1045514978.db2.gz XGJRCBRCVDTKCL-KRWDZBQOSA-N 1 2 322.811 4.016 20 0 DIADLO c1ccc2c(c1)CC[C@@H]2[N@H+](Cc1nnc(C2CC2)s1)C1CC1 ZINC000450520088 1045516325 /nfs/dbraw/zinc/51/63/25/1045516325.db2.gz ORIBKMJFNWACHU-INIZCTEOSA-N 1 2 311.454 4.067 20 0 DIADLO c1ccc2c(c1)CC[C@@H]2[N@@H+](Cc1nnc(C2CC2)s1)C1CC1 ZINC000450520088 1045516334 /nfs/dbraw/zinc/51/63/34/1045516334.db2.gz ORIBKMJFNWACHU-INIZCTEOSA-N 1 2 311.454 4.067 20 0 DIADLO Cc1ncc(C[N@@H+]2CCC[C@@H]2c2cccc(Br)c2)o1 ZINC000628137212 1045528514 /nfs/dbraw/zinc/52/85/14/1045528514.db2.gz AYTKWTFMUSMJSA-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ncc(C[N@H+]2CCC[C@@H]2c2cccc(Br)c2)o1 ZINC000628137212 1045528525 /nfs/dbraw/zinc/52/85/25/1045528525.db2.gz AYTKWTFMUSMJSA-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC[C@H]2c2ccccn2)cs1 ZINC000628136740 1045529742 /nfs/dbraw/zinc/52/97/42/1045529742.db2.gz LXRCXGBAAQOMTF-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC[C@H]2c2ccccn2)cs1 ZINC000628136740 1045529748 /nfs/dbraw/zinc/52/97/48/1045529748.db2.gz LXRCXGBAAQOMTF-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2cnc(-c3ccccc3)s2)C[C@H]1F ZINC001138527684 1045531599 /nfs/dbraw/zinc/53/15/99/1045531599.db2.gz RZBQRLGJUGEMME-ZBFHGGJFSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2cnc(-c3ccccc3)s2)C[C@H]1F ZINC001138527684 1045531607 /nfs/dbraw/zinc/53/16/07/1045531607.db2.gz RZBQRLGJUGEMME-ZBFHGGJFSA-N 1 2 308.397 4.082 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)n1 ZINC000628162211 1045533480 /nfs/dbraw/zinc/53/34/80/1045533480.db2.gz HUTGCFLOIAXOGT-OAHLLOKOSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1c[nH]c(C[N@H+]2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)n1 ZINC000628162211 1045533486 /nfs/dbraw/zinc/53/34/86/1045533486.db2.gz HUTGCFLOIAXOGT-OAHLLOKOSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1ncc(C[N@H+]2CCC[C@H]2c2nc3ccccc3n2C(C)C)o1 ZINC000628174024 1045534860 /nfs/dbraw/zinc/53/48/60/1045534860.db2.gz UKKVLUMKVVQYIZ-SFHVURJKSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1ncc(C[N@@H+]2CCC[C@H]2c2nc3ccccc3n2C(C)C)o1 ZINC000628174024 1045534874 /nfs/dbraw/zinc/53/48/74/1045534874.db2.gz UKKVLUMKVVQYIZ-SFHVURJKSA-N 1 2 324.428 4.251 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C(F)(F)F)n(C)n1)c1cc2ccccc2o1 ZINC001120046732 1045535980 /nfs/dbraw/zinc/53/59/80/1045535980.db2.gz MBIOKMAIRCJZPF-SNVBAGLBSA-N 1 2 323.318 4.036 20 0 DIADLO COc1cccc(F)c1C[NH2+][C@@H]1CCCc2c(Cl)ccnc21 ZINC001120366946 1045537584 /nfs/dbraw/zinc/53/75/84/1045537584.db2.gz YZUZHGVWYCVJMX-OAHLLOKOSA-N 1 2 320.795 4.050 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2nnc(C3CC3)s2)c1 ZINC000450668317 1045541654 /nfs/dbraw/zinc/54/16/54/1045541654.db2.gz NBVOYFKTOUQSMB-GFCCVEGCSA-N 1 2 317.458 4.054 20 0 DIADLO CCOc1ccc([C@H]([NH2+]Cc2cnc(C)o2)c2ccccc2)cc1 ZINC000628206907 1045542912 /nfs/dbraw/zinc/54/29/12/1045542912.db2.gz YJIJHIZQJVLDMB-HXUWFJFHSA-N 1 2 322.408 4.261 20 0 DIADLO Clc1ccccc1C1=CC[N@H+](Cc2cnc(C3CC3)o2)CC1 ZINC000628235825 1045552222 /nfs/dbraw/zinc/55/22/22/1045552222.db2.gz CXOXEWIRARVJQZ-UHFFFAOYSA-N 1 2 314.816 4.495 20 0 DIADLO Clc1ccccc1C1=CC[N@@H+](Cc2cnc(C3CC3)o2)CC1 ZINC000628235825 1045552236 /nfs/dbraw/zinc/55/22/36/1045552236.db2.gz CXOXEWIRARVJQZ-UHFFFAOYSA-N 1 2 314.816 4.495 20 0 DIADLO C[C@H]([NH2+][C@H](Cc1ccccc1)c1cccs1)c1csnn1 ZINC000450725581 1045556189 /nfs/dbraw/zinc/55/61/89/1045556189.db2.gz ITNCNQMOKWWRJK-GXTWGEPZSA-N 1 2 315.467 4.234 20 0 DIADLO CCO[C@@H]1CCN(c2cc[nH+]c3c(Cl)cccc23)C[C@H]1C ZINC000450748727 1045556743 /nfs/dbraw/zinc/55/67/43/1045556743.db2.gz XIOITGJZNLTELX-MLGOLLRUSA-N 1 2 304.821 4.140 20 0 DIADLO Cc1ccc(C2=CC[N@H+](Cc3cnc(Cl)s3)CC2)cc1 ZINC000750791064 1045556938 /nfs/dbraw/zinc/55/69/38/1045556938.db2.gz LMGZOXBTKDBBGG-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO Cc1ccc(C2=CC[N@@H+](Cc3cnc(Cl)s3)CC2)cc1 ZINC000750791064 1045556949 /nfs/dbraw/zinc/55/69/49/1045556949.db2.gz LMGZOXBTKDBBGG-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO FC1(F)CC[C@H](C[N@@H+]2CCO[C@H](c3cccc(Cl)c3)C2)C1 ZINC000450752589 1045563054 /nfs/dbraw/zinc/56/30/54/1045563054.db2.gz GCALIIDBKDSKTR-WFASDCNBSA-N 1 2 315.791 4.149 20 0 DIADLO FC1(F)CC[C@H](C[N@H+]2CCO[C@H](c3cccc(Cl)c3)C2)C1 ZINC000450752589 1045563063 /nfs/dbraw/zinc/56/30/63/1045563063.db2.gz GCALIIDBKDSKTR-WFASDCNBSA-N 1 2 315.791 4.149 20 0 DIADLO CO[C@H]1CCN(c2cc[nH+]c3c(Cl)cccc23)CC1(C)C ZINC000450753412 1045563180 /nfs/dbraw/zinc/56/31/80/1045563180.db2.gz HTBFEZCWGMEJFB-HNNXBMFYSA-N 1 2 304.821 4.140 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(C(F)(F)F)c2)[C@@H]1[C@@H]1CCCO1 ZINC000628284146 1045564714 /nfs/dbraw/zinc/56/47/14/1045564714.db2.gz BRNWUGWAVDVJMO-WCQYABFASA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(C(F)(F)F)c2)[C@@H]1[C@@H]1CCCO1 ZINC000628284146 1045564719 /nfs/dbraw/zinc/56/47/19/1045564719.db2.gz BRNWUGWAVDVJMO-WCQYABFASA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[C@@H]([NH2+]Cc2cnc(C3CC3)o2)c2cc(F)ccc2O1 ZINC000628324904 1045567521 /nfs/dbraw/zinc/56/75/21/1045567521.db2.gz PCGCCFUJNQHEGG-OAHLLOKOSA-N 1 2 316.376 4.083 20 0 DIADLO Brc1ccccc1C[N@H+](Cc1ccoc1)C1CC1 ZINC000723772589 1045585147 /nfs/dbraw/zinc/58/51/47/1045585147.db2.gz BUEZQPRJEMLBFJ-UHFFFAOYSA-N 1 2 306.203 4.207 20 0 DIADLO Brc1ccccc1C[N@@H+](Cc1ccoc1)C1CC1 ZINC000723772589 1045585158 /nfs/dbraw/zinc/58/51/58/1045585158.db2.gz BUEZQPRJEMLBFJ-UHFFFAOYSA-N 1 2 306.203 4.207 20 0 DIADLO FC(F)(F)c1ccc2c(c1)CC[N@@H+](Cc1cnc(C3CC3)o1)C2 ZINC000628460115 1045586402 /nfs/dbraw/zinc/58/64/02/1045586402.db2.gz HKBWSZUQSSBVJQ-UHFFFAOYSA-N 1 2 322.330 4.129 20 0 DIADLO FC(F)(F)c1ccc2c(c1)CC[N@H+](Cc1cnc(C3CC3)o1)C2 ZINC000628460115 1045586411 /nfs/dbraw/zinc/58/64/11/1045586411.db2.gz HKBWSZUQSSBVJQ-UHFFFAOYSA-N 1 2 322.330 4.129 20 0 DIADLO CC[C@H]1C[C@]1([NH2+]Cc1nnc(C(C)C)s1)c1cccc(C)c1 ZINC000450921551 1045596379 /nfs/dbraw/zinc/59/63/79/1045596379.db2.gz IQSCJLQCUYZTAR-KBXCAEBGSA-N 1 2 315.486 4.385 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2cccnc2Cl)C1 ZINC000800473061 1045624013 /nfs/dbraw/zinc/62/40/13/1045624013.db2.gz JLTDYMPWZKWIPZ-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2cccnc2Cl)C1 ZINC000800473061 1045624026 /nfs/dbraw/zinc/62/40/26/1045624026.db2.gz JLTDYMPWZKWIPZ-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO CC(C)(C)[C@@H](Cn1cc[nH+]c1)NC(=O)C[C@@H]1CCCCC1(C)C ZINC000751686520 1045625711 /nfs/dbraw/zinc/62/57/11/1045625711.db2.gz FKZPCNGEFOLGLN-JKSUJKDBSA-N 1 2 319.493 4.021 20 0 DIADLO CC(C)(C)[C@H](Cn1cc[nH+]c1)NC(=O)C[C@H]1CCCCC1(C)C ZINC000751686517 1045625902 /nfs/dbraw/zinc/62/59/02/1045625902.db2.gz FKZPCNGEFOLGLN-CVEARBPZSA-N 1 2 319.493 4.021 20 0 DIADLO Cc1cc(Cl)nc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)c1 ZINC000800494070 1045632259 /nfs/dbraw/zinc/63/22/59/1045632259.db2.gz CLOUJDYWJYCYER-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3cc(F)cc(C)c3C2)cc(Cl)n1 ZINC000800535524 1045638741 /nfs/dbraw/zinc/63/87/41/1045638741.db2.gz DLHCCYITIFKDKV-UHFFFAOYSA-N 1 2 304.796 4.049 20 0 DIADLO Cc1cc(C[N@H+]2CCc3cc(F)cc(C)c3C2)cc(Cl)n1 ZINC000800535524 1045638746 /nfs/dbraw/zinc/63/87/46/1045638746.db2.gz DLHCCYITIFKDKV-UHFFFAOYSA-N 1 2 304.796 4.049 20 0 DIADLO CCOc1cc(CNc2ccc([NH2+]C)cc2)ccc1OC(F)F ZINC000629388561 1045664532 /nfs/dbraw/zinc/66/45/32/1045664532.db2.gz FGAZOEIDIAWWMX-UHFFFAOYSA-N 1 2 322.355 4.341 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccc(F)c(Cl)c1)C1CC1)c1csnn1 ZINC000451358360 1045669593 /nfs/dbraw/zinc/66/95/93/1045669593.db2.gz URCTYMLPKXOTSY-CLAHSXSESA-N 1 2 311.813 4.133 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)o1 ZINC000451360478 1045671722 /nfs/dbraw/zinc/67/17/22/1045671722.db2.gz YKKMPISIZLVOLH-RFAUZJTJSA-N 1 2 323.799 4.226 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CC[C@@H]3C3CCC3)cc2)C[C@H](C)O1 ZINC000800983464 1045676465 /nfs/dbraw/zinc/67/64/65/1045676465.db2.gz KBFMNCJEXVXSNM-ITKAJJHTSA-N 1 2 314.473 4.291 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[S@@](=O)C(C)(C)CC1 ZINC000451755439 1045722179 /nfs/dbraw/zinc/72/21/79/1045722179.db2.gz KLWFSSJHQGNRPI-FOIQADDNSA-N 1 2 313.894 4.024 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[S@@](=O)C(C)(C)CC1 ZINC000451755439 1045722194 /nfs/dbraw/zinc/72/21/94/1045722194.db2.gz KLWFSSJHQGNRPI-FOIQADDNSA-N 1 2 313.894 4.024 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[S@](=O)C(C)(C)CC1 ZINC000451755442 1045722237 /nfs/dbraw/zinc/72/22/37/1045722237.db2.gz KLWFSSJHQGNRPI-YWZLYKJASA-N 1 2 313.894 4.024 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[S@](=O)C(C)(C)CC1 ZINC000451755442 1045722253 /nfs/dbraw/zinc/72/22/53/1045722253.db2.gz KLWFSSJHQGNRPI-YWZLYKJASA-N 1 2 313.894 4.024 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000451855901 1045733654 /nfs/dbraw/zinc/73/36/54/1045733654.db2.gz OYLGLTPSQDVNRO-INIZCTEOSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000451855901 1045733665 /nfs/dbraw/zinc/73/36/65/1045733665.db2.gz OYLGLTPSQDVNRO-INIZCTEOSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1cc(C)n(Cc2ccc(-c3c[nH+]c(C(C)C)n3C)cc2)n1 ZINC000630053649 1045733775 /nfs/dbraw/zinc/73/37/75/1045733775.db2.gz SCOLUVLIORWYJI-UHFFFAOYSA-N 1 2 308.429 4.072 20 0 DIADLO Cc1ncsc1C[N@@H+]1CCCC[C@@H]1c1nc2ccccc2[nH]1 ZINC000451880618 1045739939 /nfs/dbraw/zinc/73/99/39/1045739939.db2.gz XCTSVOMQFLTVER-OAHLLOKOSA-N 1 2 312.442 4.055 20 0 DIADLO Cc1ncsc1C[N@H+]1CCCC[C@@H]1c1nc2ccccc2[nH]1 ZINC000451880618 1045739946 /nfs/dbraw/zinc/73/99/46/1045739946.db2.gz XCTSVOMQFLTVER-OAHLLOKOSA-N 1 2 312.442 4.055 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3[nH]2)c(C)n1 ZINC000451878922 1045739986 /nfs/dbraw/zinc/73/99/86/1045739986.db2.gz OQMNKKQONJFVRF-IBGZPJMESA-N 1 2 320.440 4.302 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3[nH]2)c(C)n1 ZINC000451878922 1045739997 /nfs/dbraw/zinc/73/99/97/1045739997.db2.gz OQMNKKQONJFVRF-IBGZPJMESA-N 1 2 320.440 4.302 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)Cc1cccc(O)c1 ZINC000530901502 1045749557 /nfs/dbraw/zinc/74/95/57/1045749557.db2.gz FHPYAIMEXMTLTO-UHFFFAOYSA-N 1 2 314.410 4.049 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)Cc1cccc(O)c1 ZINC000530901502 1045749570 /nfs/dbraw/zinc/74/95/70/1045749570.db2.gz FHPYAIMEXMTLTO-UHFFFAOYSA-N 1 2 314.410 4.049 20 0 DIADLO FC(F)(F)[C@H]1CC[C@@H](c2csc(Cn3cc[nH+]c3)n2)CC1 ZINC000630386028 1045756169 /nfs/dbraw/zinc/75/61/69/1045756169.db2.gz MSASVQDLGWELIR-PHIMTYICSA-N 1 2 315.364 4.224 20 0 DIADLO FC(F)(F)[C@@H]1CCC[C@@H](c2csc(Cn3cc[nH+]c3)n2)C1 ZINC000630386612 1045758092 /nfs/dbraw/zinc/75/80/92/1045758092.db2.gz SGCUUOMXSJPOKP-GHMZBOCLSA-N 1 2 315.364 4.224 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000530963147 1045760933 /nfs/dbraw/zinc/76/09/33/1045760933.db2.gz RSEMVTSDTAIPPG-IBGZPJMESA-N 1 2 324.424 4.020 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000530963147 1045760942 /nfs/dbraw/zinc/76/09/42/1045760942.db2.gz RSEMVTSDTAIPPG-IBGZPJMESA-N 1 2 324.424 4.020 20 0 DIADLO CC1=C(C)C[C@](C)(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001124772622 1045761851 /nfs/dbraw/zinc/76/18/51/1045761851.db2.gz PELKRXQRSLPRBX-LJQANCHMSA-N 1 2 309.413 4.337 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc(-c3ccsc3)no2)cc1C ZINC000452044688 1045767033 /nfs/dbraw/zinc/76/70/33/1045767033.db2.gz RPWKQBGDXVIXKH-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc(-c3ccsc3)no2)cc1C ZINC000452044688 1045767042 /nfs/dbraw/zinc/76/70/42/1045767042.db2.gz RPWKQBGDXVIXKH-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccc(CNc2ccc([NH+](C)C)cc2)c(-c2ccnn2C)c1 ZINC000801725811 1045783280 /nfs/dbraw/zinc/78/32/80/1045783280.db2.gz GSTBEJDFGHHVTL-UHFFFAOYSA-N 1 2 320.440 4.074 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)cc1Cl ZINC000901670686 1045789933 /nfs/dbraw/zinc/78/99/33/1045789933.db2.gz ZQIPZVSWNQPRJB-LLVKDONJSA-N 1 2 322.836 4.485 20 0 DIADLO CCC(=O)CC[N@@H+]1CCc2cc(Cl)c(Cl)cc2[C@@H]1C ZINC000753739409 1045799569 /nfs/dbraw/zinc/79/95/69/1045799569.db2.gz SGVIOHBCEDHVHU-JTQLQIEISA-N 1 2 300.229 4.282 20 0 DIADLO CCC(=O)CC[N@H+]1CCc2cc(Cl)c(Cl)cc2[C@@H]1C ZINC000753739409 1045799579 /nfs/dbraw/zinc/79/95/79/1045799579.db2.gz SGVIOHBCEDHVHU-JTQLQIEISA-N 1 2 300.229 4.282 20 0 DIADLO Cc1cc(C)c(C(=O)N(CCc2ccccc2)CC(C)C)c(C)[nH+]1 ZINC001124917369 1045801352 /nfs/dbraw/zinc/80/13/52/1045801352.db2.gz XGGKIEUFOMVMIF-UHFFFAOYSA-N 1 2 324.468 4.348 20 0 DIADLO CCc1noc(CC)c1C[NH2+]Cc1oc2ccccc2c1Cl ZINC000631087399 1045813894 /nfs/dbraw/zinc/81/38/94/1045813894.db2.gz WDDDNPXUDNFNSK-UHFFFAOYSA-N 1 2 318.804 4.489 20 0 DIADLO Cc1nc(C[NH2+][C@@H](CCc2ccccc2)c2ccccn2)cs1 ZINC000631200976 1045835777 /nfs/dbraw/zinc/83/57/77/1045835777.db2.gz OMBBHOWLRRWTLL-IBGZPJMESA-N 1 2 323.465 4.310 20 0 DIADLO Fc1cccc(-c2nc(C[N@@H+]3CCC[C@@H]3c3ccccn3)co2)c1 ZINC000531440118 1045846096 /nfs/dbraw/zinc/84/60/96/1045846096.db2.gz QNGOYHJUFUXSMD-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1cccc(-c2nc(C[N@H+]3CCC[C@@H]3c3ccccn3)co2)c1 ZINC000531440118 1045846109 /nfs/dbraw/zinc/84/61/09/1045846109.db2.gz QNGOYHJUFUXSMD-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO CC(C)C1CC([NH2+]c2ccc(N3C[C@@H](C)O[C@H](C)C3)cc2)C1 ZINC000754099105 1045846089 /nfs/dbraw/zinc/84/60/89/1045846089.db2.gz BOXNOZOALWWNKK-RSIVFMTNSA-N 1 2 302.462 4.147 20 0 DIADLO CCOc1cc(C[NH2+][C@H](CF)c2ccc(F)cc2)ccc1OC ZINC000631280647 1045846987 /nfs/dbraw/zinc/84/69/87/1045846987.db2.gz UHXDVIXLANPEOV-MRXNPFEDSA-N 1 2 321.367 4.033 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)C1CCC(C2CC2)CC1 ZINC001125151421 1045861444 /nfs/dbraw/zinc/86/14/44/1045861444.db2.gz NUCKZPFOTOZRNJ-UHFFFAOYSA-N 1 2 309.413 4.027 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2cnc(Cl)s2)s1 ZINC000079321053 1045904737 /nfs/dbraw/zinc/90/47/37/1045904737.db2.gz FRBDNZUGDLHQCS-MRVPVSSYSA-N 1 2 301.868 4.063 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cnc(Cl)s2)s1 ZINC000079321053 1045904742 /nfs/dbraw/zinc/90/47/42/1045904742.db2.gz FRBDNZUGDLHQCS-MRVPVSSYSA-N 1 2 301.868 4.063 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccccn1 ZINC000754338922 1045878619 /nfs/dbraw/zinc/87/86/19/1045878619.db2.gz VDLHAKRARYCGDX-GOSISDBHSA-N 1 2 307.397 4.224 20 0 DIADLO Clc1cc(C[NH+]2CCC(c3ccccn3)CC2)cc(Cl)n1 ZINC000754351643 1045879828 /nfs/dbraw/zinc/87/98/28/1045879828.db2.gz JKHNVWFIECOJKY-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO CCC[C@H]([NH2+]Cc1csc([C@H](C)OC)n1)c1cc(C)ccn1 ZINC000631587166 1045881172 /nfs/dbraw/zinc/88/11/72/1045881172.db2.gz PLCBEDJLUCNGKX-ZFWWWQNUSA-N 1 2 319.474 4.185 20 0 DIADLO Fc1cc2[nH+]ccc(N3CCC(F)(F)CC3)c2cc1Cl ZINC000828061845 1045888241 /nfs/dbraw/zinc/88/82/41/1045888241.db2.gz LXMAXVCPSWBNCI-UHFFFAOYSA-N 1 2 300.711 4.263 20 0 DIADLO O=C(OCc1ccc(-n2cc[nH+]c2)cc1)c1cc2occc2s1 ZINC000754500669 1045893668 /nfs/dbraw/zinc/89/36/68/1045893668.db2.gz QXDILOIHAKVEKT-UHFFFAOYSA-N 1 2 324.361 4.037 20 0 DIADLO O=C(Nc1cccc(C(F)F)c1Cl)c1cccc2[nH+]ccn21 ZINC000754558476 1045899436 /nfs/dbraw/zinc/89/94/36/1045899436.db2.gz KUIVZMBHOITDML-UHFFFAOYSA-N 1 2 321.714 4.178 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)cc2OC)cs1 ZINC000531715791 1045906234 /nfs/dbraw/zinc/90/62/34/1045906234.db2.gz FRQJWHCDSAKZOF-QWHCGFSZSA-N 1 2 304.459 4.434 20 0 DIADLO C[C@H]([NH2+]Cc1c(Cl)cccc1OC(F)F)c1ccoc1 ZINC000631773009 1045917114 /nfs/dbraw/zinc/91/71/14/1045917114.db2.gz RWQBXKMJTUOGCU-VIFPVBQESA-N 1 2 301.720 4.385 20 0 DIADLO Fc1cc(C[N@@H+]2CC[C@H]2COCc2ccccc2)ccc1Cl ZINC001137653373 1045917988 /nfs/dbraw/zinc/91/79/88/1045917988.db2.gz LXWPBHFXCHQDAS-INIZCTEOSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1cc(C[N@H+]2CC[C@H]2COCc2ccccc2)ccc1Cl ZINC001137653373 1045918001 /nfs/dbraw/zinc/91/80/01/1045918001.db2.gz LXWPBHFXCHQDAS-INIZCTEOSA-N 1 2 319.807 4.270 20 0 DIADLO COc1ccc(OC)c([C@@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)c1 ZINC000631795142 1045919024 /nfs/dbraw/zinc/91/90/24/1045919024.db2.gz GPIMCTMPYQJCHR-SJKOYZFVSA-N 1 2 321.367 4.204 20 0 DIADLO C[C@@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1cnn(C2CCCC2)c1 ZINC000631798657 1045920165 /nfs/dbraw/zinc/92/01/65/1045920165.db2.gz XBKDGENIDJHFPP-FZKQIMNGSA-N 1 2 319.399 4.499 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)ccc1F ZINC000631798428 1045920766 /nfs/dbraw/zinc/92/07/66/1045920766.db2.gz SLHPHKVNWUIYGB-ZBEGNZNMSA-N 1 2 309.331 4.335 20 0 DIADLO C[C@@H]([NH2+]Cc1cscn1)c1cc(Cl)c(Cl)cc1O ZINC000192785865 1045932454 /nfs/dbraw/zinc/93/24/54/1045932454.db2.gz MWQSUURYHQEVHQ-SSDOTTSWSA-N 1 2 303.214 4.006 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2csc3ccccc23)o1 ZINC000754745193 1045924169 /nfs/dbraw/zinc/92/41/69/1045924169.db2.gz VDRVHYHXAIMFGF-NSHDSACASA-N 1 2 301.415 4.259 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1cc2ccccc2s1 ZINC000754753366 1045925955 /nfs/dbraw/zinc/92/59/55/1045925955.db2.gz VBNLLLPAYZHFIU-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO Cc1cccc(C[N@@H+]2CCO[C@@](C)(c3ccc(F)cc3)C2)c1F ZINC001137678604 1045930287 /nfs/dbraw/zinc/93/02/87/1045930287.db2.gz PGUBGJSAESRMEE-LJQANCHMSA-N 1 2 317.379 4.021 20 0 DIADLO Cc1cccc(C[N@H+]2CCO[C@@](C)(c3ccc(F)cc3)C2)c1F ZINC001137678604 1045930297 /nfs/dbraw/zinc/93/02/97/1045930297.db2.gz PGUBGJSAESRMEE-LJQANCHMSA-N 1 2 317.379 4.021 20 0 DIADLO CC(C)c1ccc([C@@H](C)OC(=O)CCc2ccc(N)[nH+]c2)cc1 ZINC000754856047 1045934971 /nfs/dbraw/zinc/93/49/71/1045934971.db2.gz AKMNWOUPTOHMLO-CQSZACIVSA-N 1 2 312.413 4.024 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2ccncc2Br)cc1 ZINC001137695770 1045937889 /nfs/dbraw/zinc/93/78/89/1045937889.db2.gz LKRUKAMLAHEHCV-UHFFFAOYSA-N 1 2 319.246 4.039 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2ccncc2Br)cc1 ZINC001137695770 1045937906 /nfs/dbraw/zinc/93/79/06/1045937906.db2.gz LKRUKAMLAHEHCV-UHFFFAOYSA-N 1 2 319.246 4.039 20 0 DIADLO O=C1CC[N@@H+](Cc2c[nH]c3ccc(Cl)cc23)[C@@H]2CCCC[C@H]12 ZINC001137708561 1045939899 /nfs/dbraw/zinc/93/98/99/1045939899.db2.gz YKUXQWOQRJLEOB-WMLDXEAASA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c[nH]c3ccc(Cl)cc23)[C@@H]2CCCC[C@H]12 ZINC001137708561 1045939909 /nfs/dbraw/zinc/93/99/09/1045939909.db2.gz YKUXQWOQRJLEOB-WMLDXEAASA-N 1 2 316.832 4.155 20 0 DIADLO F[C@H]1C[N@H+](Cc2c[nH]c3ccc(Cl)cc23)CCCC1(F)F ZINC001137708022 1045940017 /nfs/dbraw/zinc/94/00/17/1045940017.db2.gz DWIZQOSMJVUWSN-AWEZNQCLSA-N 1 2 316.754 4.391 20 0 DIADLO F[C@H]1C[N@@H+](Cc2c[nH]c3ccc(Cl)cc23)CCCC1(F)F ZINC001137708022 1045940033 /nfs/dbraw/zinc/94/00/33/1045940033.db2.gz DWIZQOSMJVUWSN-AWEZNQCLSA-N 1 2 316.754 4.391 20 0 DIADLO CCC[C@@H]([NH2+][C@@H](C)c1nccn1CC)c1ccc(F)cc1F ZINC000453146172 1045948800 /nfs/dbraw/zinc/94/88/00/1045948800.db2.gz SQTILCAMPLDRET-BLLLJJGKSA-N 1 2 307.388 4.373 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000531841935 1045972290 /nfs/dbraw/zinc/97/22/90/1045972290.db2.gz LQWZLRGPRCKDIO-AUUYWEPGSA-N 1 2 317.379 4.273 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000531841935 1045972299 /nfs/dbraw/zinc/97/22/99/1045972299.db2.gz LQWZLRGPRCKDIO-AUUYWEPGSA-N 1 2 317.379 4.273 20 0 DIADLO FC1CC[NH+](Cc2cc(Br)ccc2Cl)CC1 ZINC001137827135 1045975332 /nfs/dbraw/zinc/97/53/32/1045975332.db2.gz CJRQDHSSJGLQSV-UHFFFAOYSA-N 1 2 306.606 4.036 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C/c2ccccc2Cl)c(C)[nH+]1 ZINC000193181721 1045975605 /nfs/dbraw/zinc/97/56/05/1045975605.db2.gz VHPYHYNWEHWHQB-CMDGGOBGSA-N 1 2 300.789 4.312 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2nc(Cl)ccc2Cl)CC1 ZINC000829500482 1045981438 /nfs/dbraw/zinc/98/14/38/1045981438.db2.gz MEDYIKGHGVQMNV-UHFFFAOYSA-N 1 2 307.224 4.476 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(F)ccc(Cl)c2F)CCC1(F)F ZINC001137877997 1045997716 /nfs/dbraw/zinc/99/77/16/1045997716.db2.gz GQZZUCHHYKEMHX-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(F)ccc(Cl)c2F)CCC1(F)F ZINC001137877997 1045997722 /nfs/dbraw/zinc/99/77/22/1045997722.db2.gz GQZZUCHHYKEMHX-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO CC1CCC([N@H+](C)Cn2nc(C3CC3)n(C3CC3)c2=S)CC1 ZINC000193394633 1046004362 /nfs/dbraw/zinc/00/43/62/1046004362.db2.gz SYBRDACLBVSVSY-UHFFFAOYSA-N 1 2 320.506 4.094 20 0 DIADLO CC1CCC([N@@H+](C)Cn2nc(C3CC3)n(C3CC3)c2=S)CC1 ZINC000193394633 1046004369 /nfs/dbraw/zinc/00/43/69/1046004369.db2.gz SYBRDACLBVSVSY-UHFFFAOYSA-N 1 2 320.506 4.094 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@@H](C)c2nc3ccccc3s2)n1 ZINC000080273946 1046015704 /nfs/dbraw/zinc/01/57/04/1046015704.db2.gz ZEWDOKKXRGTQOO-QWRGUYRKSA-N 1 2 303.456 4.473 20 0 DIADLO Cc1ccc2nc(Cl)c(C[N@H+]3CC[C@@H](C)[C@H](F)C3)cc2c1 ZINC001137919060 1046016553 /nfs/dbraw/zinc/01/65/53/1046016553.db2.gz ZPMFAJJLHQISTP-IUODEOHRSA-N 1 2 306.812 4.377 20 0 DIADLO Cc1ccc2nc(Cl)c(C[N@@H+]3CC[C@@H](C)[C@H](F)C3)cc2c1 ZINC001137919060 1046016564 /nfs/dbraw/zinc/01/65/64/1046016564.db2.gz ZPMFAJJLHQISTP-IUODEOHRSA-N 1 2 306.812 4.377 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccc(C)nc2Cl)CC2CC2)cn1 ZINC000829865175 1046020007 /nfs/dbraw/zinc/02/00/07/1046020007.db2.gz HASZEKYGFJAZDR-UHFFFAOYSA-N 1 2 315.848 4.159 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccc(C)nc2Cl)CC2CC2)cn1 ZINC000829865175 1046020021 /nfs/dbraw/zinc/02/00/21/1046020021.db2.gz HASZEKYGFJAZDR-UHFFFAOYSA-N 1 2 315.848 4.159 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(F)c(F)c2F)c1 ZINC001137940315 1046024415 /nfs/dbraw/zinc/02/44/15/1046024415.db2.gz SANDUXLTLZFGPL-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(F)c(F)c2F)c1 ZINC001137940315 1046024431 /nfs/dbraw/zinc/02/44/31/1046024431.db2.gz SANDUXLTLZFGPL-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1csc(Cl)n1 ZINC000829910740 1046024630 /nfs/dbraw/zinc/02/46/30/1046024630.db2.gz LKAYKKNXDBIPHJ-AWEZNQCLSA-N 1 2 310.850 4.388 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1csc(Cl)n1 ZINC000829910740 1046024643 /nfs/dbraw/zinc/02/46/43/1046024643.db2.gz LKAYKKNXDBIPHJ-AWEZNQCLSA-N 1 2 310.850 4.388 20 0 DIADLO FC(F)(F)Sc1ccc(C[N@@H+]2CCCCC23COC3)cc1 ZINC001137955254 1046032729 /nfs/dbraw/zinc/03/27/29/1046032729.db2.gz ORWPORGFCREQJP-UHFFFAOYSA-N 1 2 317.376 4.053 20 0 DIADLO FC(F)(F)Sc1ccc(C[N@H+]2CCCCC23COC3)cc1 ZINC001137955254 1046032743 /nfs/dbraw/zinc/03/27/43/1046032743.db2.gz ORWPORGFCREQJP-UHFFFAOYSA-N 1 2 317.376 4.053 20 0 DIADLO Fc1c(Cl)ccc(C(F)(F)F)c1C[N@@H+]1CCC2(CC2)C1 ZINC001137981905 1046044411 /nfs/dbraw/zinc/04/44/11/1046044411.db2.gz YVXVRWKYOGEMSY-UHFFFAOYSA-N 1 2 307.718 4.484 20 0 DIADLO Fc1c(Cl)ccc(C(F)(F)F)c1C[N@H+]1CCC2(CC2)C1 ZINC001137981905 1046044428 /nfs/dbraw/zinc/04/44/28/1046044428.db2.gz YVXVRWKYOGEMSY-UHFFFAOYSA-N 1 2 307.718 4.484 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c1 ZINC001137997588 1046050974 /nfs/dbraw/zinc/05/09/74/1046050974.db2.gz RJHWTNYCCCJGHX-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)c1 ZINC001137997588 1046050989 /nfs/dbraw/zinc/05/09/89/1046050989.db2.gz RJHWTNYCCCJGHX-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nccn1CC)c1cccc(Cl)c1F ZINC000453353047 1046052095 /nfs/dbraw/zinc/05/20/95/1046052095.db2.gz NGCAANWWMHUEKA-RISCZKNCSA-N 1 2 309.816 4.497 20 0 DIADLO COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1cnc(C2CC2)o1 ZINC000453370514 1046069017 /nfs/dbraw/zinc/06/90/17/1046069017.db2.gz UDZUHTOAOIRDID-JTQLQIEISA-N 1 2 306.793 4.065 20 0 DIADLO C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c32)c2nccn21 ZINC000453370638 1046071087 /nfs/dbraw/zinc/07/10/87/1046071087.db2.gz VPLJPWHYLJZVFR-FZQKWOKYSA-N 1 2 322.239 4.473 20 0 DIADLO COc1ccc([C@@H]([NH2+][C@H](C)c2cnccc2C)c2ccco2)cc1 ZINC000453393675 1046082304 /nfs/dbraw/zinc/08/23/04/1046082304.db2.gz FSVANMZIVYOANG-FOIQADDNSA-N 1 2 322.408 4.432 20 0 DIADLO CSCc1cnc(C[N@@H+]2Cc3sccc3CC2(C)C)s1 ZINC000453612173 1046097593 /nfs/dbraw/zinc/09/75/93/1046097593.db2.gz AFZCKUCPUXOMAS-UHFFFAOYSA-N 1 2 324.540 4.405 20 0 DIADLO CSCc1cnc(C[N@H+]2Cc3sccc3CC2(C)C)s1 ZINC000453612173 1046097606 /nfs/dbraw/zinc/09/76/06/1046097606.db2.gz AFZCKUCPUXOMAS-UHFFFAOYSA-N 1 2 324.540 4.405 20 0 DIADLO CC[N@H+](Cc1ccc(OC)cc1)Cc1c(F)ccc(C)c1F ZINC001138121125 1046103340 /nfs/dbraw/zinc/10/33/40/1046103340.db2.gz XTWXKGWSYFULNM-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)cc1)Cc1c(F)ccc(C)c1F ZINC001138121125 1046103346 /nfs/dbraw/zinc/10/33/46/1046103346.db2.gz XTWXKGWSYFULNM-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO Cn1c(Cl)cnc1C[N@H+](C)C1c2ccccc2-c2ccccc21 ZINC000081596602 1046103672 /nfs/dbraw/zinc/10/36/72/1046103672.db2.gz TZYOKDHBTGIEIY-UHFFFAOYSA-N 1 2 323.827 4.275 20 0 DIADLO Cn1c(Cl)cnc1C[N@@H+](C)C1c2ccccc2-c2ccccc21 ZINC000081596602 1046103681 /nfs/dbraw/zinc/10/36/81/1046103681.db2.gz TZYOKDHBTGIEIY-UHFFFAOYSA-N 1 2 323.827 4.275 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1cc(C)ccc1OC(F)F ZINC000925253170 1046108387 /nfs/dbraw/zinc/10/83/87/1046108387.db2.gz CQLHVNHEUBMHOU-CYBMUJFWSA-N 1 2 322.355 4.060 20 0 DIADLO Cc1ccccc1C[N@@H+](C)Cc1cc(O)ccc1Br ZINC001138145576 1046109075 /nfs/dbraw/zinc/10/90/75/1046109075.db2.gz CZALARKQMFRBFZ-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1ccccc1C[N@H+](C)Cc1cc(O)ccc1Br ZINC001138145576 1046109080 /nfs/dbraw/zinc/10/90/80/1046109080.db2.gz CZALARKQMFRBFZ-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ccnc(Cl)c2)C2CC2)c(F)c1 ZINC000195410028 1046119238 /nfs/dbraw/zinc/11/92/38/1046119238.db2.gz DQIZCVJKSFBWFX-UHFFFAOYSA-N 1 2 308.759 4.178 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ccnc(Cl)c2)C2CC2)c(F)c1 ZINC000195410028 1046119241 /nfs/dbraw/zinc/11/92/41/1046119241.db2.gz DQIZCVJKSFBWFX-UHFFFAOYSA-N 1 2 308.759 4.178 20 0 DIADLO Fc1cc(F)c(F)c(C[N@H+]2CCCC3(CC(F)C3)CC2)c1F ZINC001138236788 1046124579 /nfs/dbraw/zinc/12/45/79/1046124579.db2.gz PSKJSOIKVARKQX-UHFFFAOYSA-N 1 2 319.317 4.347 20 0 DIADLO Fc1cc(F)c(F)c(C[N@@H+]2CCCC3(CC(F)C3)CC2)c1F ZINC001138236788 1046124585 /nfs/dbraw/zinc/12/45/85/1046124585.db2.gz PSKJSOIKVARKQX-UHFFFAOYSA-N 1 2 319.317 4.347 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@H+](C)Cc2ccoc2C)cc1 ZINC000195616862 1046127823 /nfs/dbraw/zinc/12/78/23/1046127823.db2.gz USPANJJOJOGLLM-AWEZNQCLSA-N 1 2 314.429 4.172 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@@H+](C)Cc2ccoc2C)cc1 ZINC000195616862 1046127831 /nfs/dbraw/zinc/12/78/31/1046127831.db2.gz USPANJJOJOGLLM-AWEZNQCLSA-N 1 2 314.429 4.172 20 0 DIADLO CCOc1cc(C)ccc1C[NH2+]Cc1occc1Br ZINC000756899896 1046149994 /nfs/dbraw/zinc/14/99/94/1046149994.db2.gz HXGBVXOGUZZWQA-UHFFFAOYSA-N 1 2 324.218 4.039 20 0 DIADLO CC[C@@H]([NH2+][C@@H](c1nncn1C)C(C)C)c1cccc(Cl)c1F ZINC000903066870 1046153457 /nfs/dbraw/zinc/15/34/57/1046153457.db2.gz XVCASZZRODMGTD-UKRRQHHQSA-N 1 2 324.831 4.046 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)cs1 ZINC000903091965 1046160382 /nfs/dbraw/zinc/16/03/82/1046160382.db2.gz DVBSMMBNYMDROI-QWHCGFSZSA-N 1 2 318.490 4.114 20 0 DIADLO COc1cccc(F)c1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC001138383543 1046161706 /nfs/dbraw/zinc/16/17/06/1046161706.db2.gz GWYNYPKALHDWFJ-KRWDZBQOSA-N 1 2 317.429 4.124 20 0 DIADLO COc1cccc(F)c1C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC001138383543 1046161713 /nfs/dbraw/zinc/16/17/13/1046161713.db2.gz GWYNYPKALHDWFJ-KRWDZBQOSA-N 1 2 317.429 4.124 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)s2)s1 ZINC000717963514 1046162772 /nfs/dbraw/zinc/16/27/72/1046162772.db2.gz UOQGPYMMACIIMB-NKWVEPMBSA-N 1 2 321.393 4.339 20 0 DIADLO CCCCC[C@H]1CCC[N@@H+]1Cc1ncc(Br)s1 ZINC001168152719 1046170820 /nfs/dbraw/zinc/17/08/20/1046170820.db2.gz BOPXINVUZXANCH-NSHDSACASA-N 1 2 317.296 4.450 20 0 DIADLO CCCCC[C@H]1CCC[N@H+]1Cc1ncc(Br)s1 ZINC001168152719 1046170825 /nfs/dbraw/zinc/17/08/25/1046170825.db2.gz BOPXINVUZXANCH-NSHDSACASA-N 1 2 317.296 4.450 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1coc(-c2ccc(F)cc2)n1 ZINC000102407870 1046178222 /nfs/dbraw/zinc/17/82/22/1046178222.db2.gz MYRMRBAPNVZKNE-UHFFFAOYSA-N 1 2 300.333 4.096 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1coc(-c2ccc(F)cc2)n1 ZINC000102407870 1046178230 /nfs/dbraw/zinc/17/82/30/1046178230.db2.gz MYRMRBAPNVZKNE-UHFFFAOYSA-N 1 2 300.333 4.096 20 0 DIADLO Fc1ccccc1[C@@H]([NH2+][C@H]1CCCC1(F)F)C1CCOCC1 ZINC000903171066 1046181879 /nfs/dbraw/zinc/18/18/79/1046181879.db2.gz MIMCLVJEQXVYEC-HOTGVXAUSA-N 1 2 313.363 4.071 20 0 DIADLO Fc1ccccc1[C@@H]([NH2+][C@@H]1CCCC1(F)F)C1CCOCC1 ZINC000903171063 1046182811 /nfs/dbraw/zinc/18/28/11/1046182811.db2.gz MIMCLVJEQXVYEC-CVEARBPZSA-N 1 2 313.363 4.071 20 0 DIADLO COc1cc(Cl)ccc1[C@H](C)[NH2+]Cc1nc2c(s1)CCC2 ZINC000903190968 1046189198 /nfs/dbraw/zinc/18/91/98/1046189198.db2.gz JKXYKRNLRZUWDW-JTQLQIEISA-N 1 2 322.861 4.145 20 0 DIADLO COc1cc(Cl)ccc1[C@@H](C)[NH2+]Cc1nc2c(s1)CCC2 ZINC000903190969 1046189670 /nfs/dbraw/zinc/18/96/70/1046189670.db2.gz JKXYKRNLRZUWDW-SNVBAGLBSA-N 1 2 322.861 4.145 20 0 DIADLO C[C@H](CNc1[nH+]cccc1OCc1ccccc1)C(F)(F)F ZINC000475737473 1046191388 /nfs/dbraw/zinc/19/13/88/1046191388.db2.gz DAVXHIKXDKYQMN-GFCCVEGCSA-N 1 2 310.319 4.271 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1cc(N(C)C)ccn1 ZINC000903201581 1046192436 /nfs/dbraw/zinc/19/24/36/1046192436.db2.gz KCAYSLLALNVRPB-AWEZNQCLSA-N 1 2 309.413 4.053 20 0 DIADLO CC/C(C)=C(\C)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000780012089 1046193933 /nfs/dbraw/zinc/19/39/33/1046193933.db2.gz AQHGJAQRSDEVAI-CCEZHUSRSA-N 1 2 321.424 4.287 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@H](C)c2cnn(CC3CCC3)c2)c(F)c1 ZINC000903225918 1046198586 /nfs/dbraw/zinc/19/85/86/1046198586.db2.gz ILCRCSUCOPVHNW-CYBMUJFWSA-N 1 2 319.399 4.121 20 0 DIADLO COc1ccc2[nH]cc(C[N@@H+]3Cc4cccc(Cl)c4C3)c2c1 ZINC001138509298 1046203748 /nfs/dbraw/zinc/20/37/48/1046203748.db2.gz ALIRAVRZLHEUBH-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccc2[nH]cc(C[N@H+]3Cc4cccc(Cl)c4C3)c2c1 ZINC001138509298 1046203754 /nfs/dbraw/zinc/20/37/54/1046203754.db2.gz ALIRAVRZLHEUBH-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO Cc1cccn2c([C@H](C)NC(=O)Nc3ccc(C)c(C)c3)c[nH+]c12 ZINC001202836234 1046205545 /nfs/dbraw/zinc/20/55/45/1046205545.db2.gz ONXQSOGALNAUPO-HNNXBMFYSA-N 1 2 322.412 4.142 20 0 DIADLO COc1c(Cl)cccc1C[NH2+][C@@H](C)c1cccc(O)c1F ZINC000903245274 1046207878 /nfs/dbraw/zinc/20/78/78/1046207878.db2.gz CYZSBYPGSPIOLW-JTQLQIEISA-N 1 2 309.768 4.044 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2C/C=C/c2ccc(F)cc2F)no1 ZINC000757733436 1046208856 /nfs/dbraw/zinc/20/88/56/1046208856.db2.gz UVERJLQSEFPCCQ-WVMJFEGXSA-N 1 2 304.340 4.112 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2C/C=C/c2ccc(F)cc2F)no1 ZINC000757733436 1046208864 /nfs/dbraw/zinc/20/88/64/1046208864.db2.gz UVERJLQSEFPCCQ-WVMJFEGXSA-N 1 2 304.340 4.112 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc3ccccc3c2)o1 ZINC000007975092 1046219060 /nfs/dbraw/zinc/21/90/60/1046219060.db2.gz UXDYDZOHQSABIJ-OAHLLOKOSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc3ccccc3c2)o1 ZINC000007975092 1046219067 /nfs/dbraw/zinc/21/90/67/1046219067.db2.gz UXDYDZOHQSABIJ-OAHLLOKOSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1cc(C[NH+](Cc2ccccn2)Cc2ccccn2)c(C)s1 ZINC001138567750 1046228304 /nfs/dbraw/zinc/22/83/04/1046228304.db2.gz JLMMRBFSXXNZIB-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccncc1 ZINC000903313592 1046234000 /nfs/dbraw/zinc/23/40/00/1046234000.db2.gz UGFPYCMSKZUCRP-HNNXBMFYSA-N 1 2 301.434 4.244 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccc2c(c1)CCO2 ZINC000903313013 1046234218 /nfs/dbraw/zinc/23/42/18/1046234218.db2.gz FRANSAONVLIZAL-HNNXBMFYSA-N 1 2 314.429 4.148 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@@H]2CC(C)(C)Cc3occc32)n1 ZINC000903312958 1046235203 /nfs/dbraw/zinc/23/52/03/1046235203.db2.gz DQPQPCRXORZLCS-CYBMUJFWSA-N 1 2 302.418 4.368 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H](c1ncccn1)C1CC1 ZINC000903331952 1046243489 /nfs/dbraw/zinc/24/34/89/1046243489.db2.gz LBSSIGFMIZZCGU-GUYCJALGSA-N 1 2 307.397 4.333 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ncccn1)C1CC1)c1ccc(F)c(Cl)c1 ZINC000903331902 1046244229 /nfs/dbraw/zinc/24/42/29/1046244229.db2.gz KPAQQVCDHHNLSP-ZUZCIYMTSA-N 1 2 305.784 4.071 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)Cc1ccsc1 ZINC000102655117 1046252414 /nfs/dbraw/zinc/25/24/14/1046252414.db2.gz MUCABIVFCJPSMT-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)Cc1ccsc1 ZINC000102655117 1046252421 /nfs/dbraw/zinc/25/24/21/1046252421.db2.gz MUCABIVFCJPSMT-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO CC[C@H]([NH2+][C@@H]1CCCc2scnc21)c1cc(F)ccc1OC ZINC000903370368 1046259453 /nfs/dbraw/zinc/25/94/53/1046259453.db2.gz FZDVFCZJLGQPSB-UONOGXRCSA-N 1 2 320.433 4.409 20 0 DIADLO C[N@H+](Cc1cnc2ccccn12)Cc1c(Cl)[nH]c2ccccc21 ZINC001138687216 1046268939 /nfs/dbraw/zinc/26/89/39/1046268939.db2.gz ZIDRJEMWYBDEAF-UHFFFAOYSA-N 1 2 324.815 4.101 20 0 DIADLO C[N@@H+](Cc1cnc2ccccn12)Cc1c(Cl)[nH]c2ccccc21 ZINC001138687216 1046268948 /nfs/dbraw/zinc/26/89/48/1046268948.db2.gz ZIDRJEMWYBDEAF-UHFFFAOYSA-N 1 2 324.815 4.101 20 0 DIADLO Fc1ccc2nc(-c3ccc(-n4cc[nH+]c4)cc3)n(C3CC3)c2c1 ZINC000758471600 1046274653 /nfs/dbraw/zinc/27/46/53/1046274653.db2.gz WCZYUWVPJKLTIA-UHFFFAOYSA-N 1 2 318.355 4.363 20 0 DIADLO CSc1ncc(C[N@@H+]2CCCC[C@H]2c2ccccc2F)cn1 ZINC001138705199 1046274772 /nfs/dbraw/zinc/27/47/72/1046274772.db2.gz KLXLWKCTSGUQIV-INIZCTEOSA-N 1 2 317.433 4.065 20 0 DIADLO CSc1ncc(C[N@H+]2CCCC[C@H]2c2ccccc2F)cn1 ZINC001138705199 1046274784 /nfs/dbraw/zinc/27/47/84/1046274784.db2.gz KLXLWKCTSGUQIV-INIZCTEOSA-N 1 2 317.433 4.065 20 0 DIADLO c1cc(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)sn1 ZINC000637850350 1046280826 /nfs/dbraw/zinc/28/08/26/1046280826.db2.gz AMSWAAGXGDVMFC-CYBMUJFWSA-N 1 2 301.440 4.090 20 0 DIADLO c1cc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)sn1 ZINC000637850350 1046280835 /nfs/dbraw/zinc/28/08/35/1046280835.db2.gz AMSWAAGXGDVMFC-CYBMUJFWSA-N 1 2 301.440 4.090 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1ccc(C(F)F)nc1 ZINC000637903653 1046284569 /nfs/dbraw/zinc/28/45/69/1046284569.db2.gz RFBJTAUAHUZCDF-JTQLQIEISA-N 1 2 312.310 4.490 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1ccc(C(F)F)nc1 ZINC000637903653 1046284579 /nfs/dbraw/zinc/28/45/79/1046284579.db2.gz RFBJTAUAHUZCDF-JTQLQIEISA-N 1 2 312.310 4.490 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@H+](Cc2coc(-c3cccs3)n2)C1 ZINC000170717115 1046285489 /nfs/dbraw/zinc/28/54/89/1046285489.db2.gz RVTWLVIETHTHMM-JTQLQIEISA-N 1 2 316.348 4.177 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@@H+](Cc2coc(-c3cccs3)n2)C1 ZINC000170717115 1046285491 /nfs/dbraw/zinc/28/54/91/1046285491.db2.gz RVTWLVIETHTHMM-JTQLQIEISA-N 1 2 316.348 4.177 20 0 DIADLO C[C@H]1c2c(F)cccc2CC[N@H+]1Cc1ccc(C(F)F)nc1 ZINC000638084738 1046293826 /nfs/dbraw/zinc/29/38/26/1046293826.db2.gz LVHCNMOCSIAJRJ-NSHDSACASA-N 1 2 306.331 4.278 20 0 DIADLO C[C@H]1c2c(F)cccc2CC[N@@H+]1Cc1ccc(C(F)F)nc1 ZINC000638084738 1046293834 /nfs/dbraw/zinc/29/38/34/1046293834.db2.gz LVHCNMOCSIAJRJ-NSHDSACASA-N 1 2 306.331 4.278 20 0 DIADLO Cc1ncc([C@H](C)[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c(C)n1 ZINC000638120957 1046295105 /nfs/dbraw/zinc/29/51/05/1046295105.db2.gz HCRCZQXEDUIYMZ-YVEFUNNKSA-N 1 2 301.821 4.255 20 0 DIADLO Cc1ncc([C@H](C)[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)c(C)n1 ZINC000638120957 1046295114 /nfs/dbraw/zinc/29/51/14/1046295114.db2.gz HCRCZQXEDUIYMZ-YVEFUNNKSA-N 1 2 301.821 4.255 20 0 DIADLO Clc1cc(NCc2cc(C3CC3)no2)ccc1-n1cc[nH+]c1 ZINC000638244020 1046304936 /nfs/dbraw/zinc/30/49/36/1046304936.db2.gz GNTFFZASKCOVRF-UHFFFAOYSA-N 1 2 314.776 4.003 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3Cl)C2)nn1C ZINC001138830784 1046305480 /nfs/dbraw/zinc/30/54/80/1046305480.db2.gz NQGOFFSQKQQUAG-LBPRGKRZSA-N 1 2 324.255 4.025 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@H](c3cccc(Cl)c3Cl)C2)nn1C ZINC001138830784 1046305493 /nfs/dbraw/zinc/30/54/93/1046305493.db2.gz NQGOFFSQKQQUAG-LBPRGKRZSA-N 1 2 324.255 4.025 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)c1cccc(Cl)c1 ZINC000638289917 1046307926 /nfs/dbraw/zinc/30/79/26/1046307926.db2.gz BZMXUQUPHZTGPK-MLGOLLRUSA-N 1 2 318.852 4.430 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)c1ccc(F)c(F)c1 ZINC000638302324 1046312094 /nfs/dbraw/zinc/31/20/94/1046312094.db2.gz SPQOHIJLQVESLB-MEDUHNTESA-N 1 2 320.387 4.055 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1cccc(F)c1)c1ccccn1 ZINC000089796968 1046314298 /nfs/dbraw/zinc/31/42/98/1046314298.db2.gz BGUQYOFQFURLQZ-HXUWFJFHSA-N 1 2 322.383 4.109 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1cnc2ccccc2n1 ZINC001138867022 1046314699 /nfs/dbraw/zinc/31/46/99/1046314699.db2.gz BBPJRBAVKFQAGB-ZDUSSCGKSA-N 1 2 311.816 4.476 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1cnc2ccccc2n1 ZINC001138867022 1046314715 /nfs/dbraw/zinc/31/47/15/1046314715.db2.gz BBPJRBAVKFQAGB-ZDUSSCGKSA-N 1 2 311.816 4.476 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1ccc(C)cc1)c1ccccn1 ZINC000089797341 1046315864 /nfs/dbraw/zinc/31/58/64/1046315864.db2.gz XCIUHZSARLKRCG-OAQYLSRUSA-N 1 2 318.420 4.278 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2csc(C(C)C)n2)cn1 ZINC001138887490 1046318582 /nfs/dbraw/zinc/31/85/82/1046318582.db2.gz APPFJZACZFOHHW-INIZCTEOSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2csc(C(C)C)n2)cn1 ZINC001138887490 1046318597 /nfs/dbraw/zinc/31/85/97/1046318597.db2.gz APPFJZACZFOHHW-INIZCTEOSA-N 1 2 301.459 4.307 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)cnc2Cl)cc1 ZINC001138892758 1046320502 /nfs/dbraw/zinc/32/05/02/1046320502.db2.gz XVCFRJIAMUGVHR-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)cnc2Cl)cc1 ZINC001138892758 1046320512 /nfs/dbraw/zinc/32/05/12/1046320512.db2.gz XVCFRJIAMUGVHR-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2cc(F)cnc2Cl)cc1 ZINC001138896318 1046321199 /nfs/dbraw/zinc/32/11/99/1046321199.db2.gz XZAYKQJIZHAXSI-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2cc(F)cnc2Cl)cc1 ZINC001138896318 1046321215 /nfs/dbraw/zinc/32/12/15/1046321215.db2.gz XZAYKQJIZHAXSI-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO Cc1ccc2c(c1)CC[C@H]2[NH2+][C@@H](c1nnc[nH]1)C1CCCCC1 ZINC000638426748 1046322080 /nfs/dbraw/zinc/32/20/80/1046322080.db2.gz WEEZQSWGDRCSHG-QZTJIDSGSA-N 1 2 310.445 4.012 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@H]3CC[C@@H](C)C3)c2)[nH+]c1C ZINC000759164446 1046327448 /nfs/dbraw/zinc/32/74/48/1046327448.db2.gz YDWLDMKSMVIDMB-DOMZBBRYSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1cccc2c1CC[C@H]2[NH2+][C@H](c1nnc[nH]1)C1CCCCC1 ZINC000638544811 1046328631 /nfs/dbraw/zinc/32/86/31/1046328631.db2.gz LEDSQFVPFWCSGI-MSOLQXFVSA-N 1 2 310.445 4.012 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2cc(Br)cnc2Cl)[C@H]1C ZINC001138945058 1046335887 /nfs/dbraw/zinc/33/58/87/1046335887.db2.gz PSSVXAMQDYPONM-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2cc(Br)cnc2Cl)[C@H]1C ZINC001138945058 1046335895 /nfs/dbraw/zinc/33/58/95/1046335895.db2.gz PSSVXAMQDYPONM-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)ccc1F ZINC000638742165 1046337656 /nfs/dbraw/zinc/33/76/56/1046337656.db2.gz XWOUIHKMYBKNHX-CXAGYDPISA-N 1 2 316.424 4.224 20 0 DIADLO CC(C)Oc1ccc(Br)cc1C[NH+]1CC(C)(C)C1 ZINC001138992712 1046353323 /nfs/dbraw/zinc/35/33/23/1046353323.db2.gz PEVVRMCRUYMEEM-UHFFFAOYSA-N 1 2 312.251 4.078 20 0 DIADLO COc1cccc([C@H]2C[C@H]([N@H+](C)Cc3csc(Cl)n3)C2)c1 ZINC000832579439 1046353137 /nfs/dbraw/zinc/35/31/37/1046353137.db2.gz HPOKQGGJVKKIJT-MQMHXKEQSA-N 1 2 322.861 4.183 20 0 DIADLO COc1cccc([C@H]2C[C@H]([N@@H+](C)Cc3csc(Cl)n3)C2)c1 ZINC000832579439 1046353146 /nfs/dbraw/zinc/35/31/46/1046353146.db2.gz HPOKQGGJVKKIJT-MQMHXKEQSA-N 1 2 322.861 4.183 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@@H+]1CCc2ccsc2C1 ZINC001139009528 1046355626 /nfs/dbraw/zinc/35/56/26/1046355626.db2.gz OVKZNBFQRSKBMO-UHFFFAOYSA-N 1 2 307.846 4.359 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@H+]1CCc2ccsc2C1 ZINC001139009528 1046355640 /nfs/dbraw/zinc/35/56/40/1046355640.db2.gz OVKZNBFQRSKBMO-UHFFFAOYSA-N 1 2 307.846 4.359 20 0 DIADLO Cc1cnc(C[NH2+][C@@H]2CCc3ccc(-c4ccccc4)cc32)o1 ZINC000639095842 1046358194 /nfs/dbraw/zinc/35/81/94/1046358194.db2.gz UIEZIHTVSSRVJY-LJQANCHMSA-N 1 2 304.393 4.427 20 0 DIADLO FC(F)(F)CC[N@H+](Cc1ccns1)Cc1ccccc1 ZINC000639101377 1046360213 /nfs/dbraw/zinc/36/02/13/1046360213.db2.gz ZOADTPNVWCVFPJ-UHFFFAOYSA-N 1 2 300.349 4.098 20 0 DIADLO FC(F)(F)CC[N@@H+](Cc1ccns1)Cc1ccccc1 ZINC000639101377 1046360221 /nfs/dbraw/zinc/36/02/21/1046360221.db2.gz ZOADTPNVWCVFPJ-UHFFFAOYSA-N 1 2 300.349 4.098 20 0 DIADLO C[C@H](Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)[C@H]1CC1(F)F ZINC000639123291 1046362469 /nfs/dbraw/zinc/36/24/69/1046362469.db2.gz IJEBJTTXQMKTCJ-BLLLJJGKSA-N 1 2 317.383 4.342 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccc(Cl)cn1 ZINC000681393825 1046367423 /nfs/dbraw/zinc/36/74/23/1046367423.db2.gz FFXFWKDQTWPXRO-OTYXRUKQSA-N 1 2 309.196 4.173 20 0 DIADLO Fc1cc(Cl)cc(F)c1C[N@@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001139051413 1046369871 /nfs/dbraw/zinc/36/98/71/1046369871.db2.gz NFYZGKOOXRIRLR-CQSZACIVSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1cc(Cl)cc(F)c1C[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001139051413 1046369883 /nfs/dbraw/zinc/36/98/83/1046369883.db2.gz NFYZGKOOXRIRLR-CQSZACIVSA-N 1 2 323.770 4.272 20 0 DIADLO CC(C)(C)OC(=O)[C@H]1CCCC[N@@H+]1Cc1cc2ccccc2o1 ZINC001139066539 1046375893 /nfs/dbraw/zinc/37/58/93/1046375893.db2.gz WLDNQQXZSBIFCT-MRXNPFEDSA-N 1 2 315.413 4.129 20 0 DIADLO CC(C)(C)OC(=O)[C@H]1CCCC[N@H+]1Cc1cc2ccccc2o1 ZINC001139066539 1046375904 /nfs/dbraw/zinc/37/59/04/1046375904.db2.gz WLDNQQXZSBIFCT-MRXNPFEDSA-N 1 2 315.413 4.129 20 0 DIADLO CC[C@@H]([NH2+][C@H](c1nnc[nH]1)C1CCCCC1)c1ccccc1F ZINC000639296689 1046378621 /nfs/dbraw/zinc/37/86/21/1046378621.db2.gz OZVKUTFYDOBDNB-SJORKVTESA-N 1 2 316.424 4.306 20 0 DIADLO Clc1nc(Br)ccc1C[NH+]1CCCCCCC1 ZINC001139112482 1046385730 /nfs/dbraw/zinc/38/57/30/1046385730.db2.gz PBOUIRJCNRSUEB-UHFFFAOYSA-N 1 2 317.658 4.264 20 0 DIADLO Cc1cc(OC(=O)CCCn2cc[nH+]c2)c(C(C)C)cc1Cl ZINC000748605732 1046387342 /nfs/dbraw/zinc/38/73/42/1046387342.db2.gz DUKRNYJSIMEVBH-UHFFFAOYSA-N 1 2 320.820 4.354 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Nc1ccc2c(c1)oc1ccccc12 ZINC000748621504 1046389750 /nfs/dbraw/zinc/38/97/50/1046389750.db2.gz LSJKLHLSHCOOMB-UHFFFAOYSA-N 1 2 319.364 4.201 20 0 DIADLO CCc1nnc(C[N@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)o1 ZINC000170913646 1046392760 /nfs/dbraw/zinc/39/27/60/1046392760.db2.gz BJHIMQGLFWGXHI-LLVKDONJSA-N 1 2 305.809 4.011 20 0 DIADLO CCc1nnc(C[N@@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)o1 ZINC000170913646 1046392775 /nfs/dbraw/zinc/39/27/75/1046392775.db2.gz BJHIMQGLFWGXHI-LLVKDONJSA-N 1 2 305.809 4.011 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000780593723 1046394677 /nfs/dbraw/zinc/39/46/77/1046394677.db2.gz WVEILHVZPMCVAY-SJLPKXTDSA-N 1 2 305.466 4.043 20 0 DIADLO COc1cc(O)ccc1C[N@@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001139145263 1046396535 /nfs/dbraw/zinc/39/65/35/1046396535.db2.gz XDKKONWVXBMRJI-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cc(O)ccc1C[N@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001139145263 1046396550 /nfs/dbraw/zinc/39/65/50/1046396550.db2.gz XDKKONWVXBMRJI-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO CC(=O)C[N@@H+](C)Cc1ccc(-c2cc(Cl)ccc2Cl)o1 ZINC001139163899 1046400149 /nfs/dbraw/zinc/40/01/49/1046400149.db2.gz RSVAUEGVEXQRSE-UHFFFAOYSA-N 1 2 312.196 4.274 20 0 DIADLO CC(=O)C[N@H+](C)Cc1ccc(-c2cc(Cl)ccc2Cl)o1 ZINC001139163899 1046400156 /nfs/dbraw/zinc/40/01/56/1046400156.db2.gz RSVAUEGVEXQRSE-UHFFFAOYSA-N 1 2 312.196 4.274 20 0 DIADLO Cc1c(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)cnn1CC(C)C ZINC000347370369 1046400570 /nfs/dbraw/zinc/40/05/70/1046400570.db2.gz MBOBOFUEEWDPEV-HNNXBMFYSA-N 1 2 323.444 4.206 20 0 DIADLO Cc1nc(-c2ccccc2)oc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000639438881 1046401906 /nfs/dbraw/zinc/40/19/06/1046401906.db2.gz BAMYRWLXWVLFDZ-HNNXBMFYSA-N 1 2 307.397 4.028 20 0 DIADLO Cc1nc(-c2ccccc2)oc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC000639438881 1046401911 /nfs/dbraw/zinc/40/19/11/1046401911.db2.gz BAMYRWLXWVLFDZ-HNNXBMFYSA-N 1 2 307.397 4.028 20 0 DIADLO C[N@H+](Cc1ccn(-c2ccccc2)n1)[C@H]1CCc2ccc(F)cc21 ZINC000748813971 1046405738 /nfs/dbraw/zinc/40/57/38/1046405738.db2.gz RTOROQGERVMAKW-FQEVSTJZSA-N 1 2 321.399 4.131 20 0 DIADLO C[N@@H+](Cc1ccn(-c2ccccc2)n1)[C@H]1CCc2ccc(F)cc21 ZINC000748813971 1046405747 /nfs/dbraw/zinc/40/57/47/1046405747.db2.gz RTOROQGERVMAKW-FQEVSTJZSA-N 1 2 321.399 4.131 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2cscc2Br)C1 ZINC001139348183 1046434204 /nfs/dbraw/zinc/43/42/04/1046434204.db2.gz XDYMAJFKTYSBRA-LBPRGKRZSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CCC2)no1)c1cccc2ccccc21 ZINC000639562087 1046411210 /nfs/dbraw/zinc/41/12/10/1046411210.db2.gz SDHYGUGJFUCAAK-ZDUSSCGKSA-N 1 2 307.397 4.341 20 0 DIADLO CC[C@H]([NH2+]Cc1oc(-c2ccccc2)nc1C)c1nccs1 ZINC000639581196 1046414949 /nfs/dbraw/zinc/41/49/49/1046414949.db2.gz WTTOPQSIAMBKFQ-AWEZNQCLSA-N 1 2 313.426 4.347 20 0 DIADLO C[C@@]1(F)CCC[N@H+](Cc2ccc(Oc3ccccc3)nc2)C1 ZINC001139245245 1046418580 /nfs/dbraw/zinc/41/85/80/1046418580.db2.gz SODOVWMYVQBBAN-GOSISDBHSA-N 1 2 300.377 4.198 20 0 DIADLO C[C@@]1(F)CCC[N@@H+](Cc2ccc(Oc3ccccc3)nc2)C1 ZINC001139245245 1046418589 /nfs/dbraw/zinc/41/85/89/1046418589.db2.gz SODOVWMYVQBBAN-GOSISDBHSA-N 1 2 300.377 4.198 20 0 DIADLO CC(C)[N@H+](Cc1nc(C2CCC2)no1)[C@H](C)c1ccsc1 ZINC000639683399 1046421899 /nfs/dbraw/zinc/42/18/99/1046421899.db2.gz FDZAGUCUTJKPOI-GFCCVEGCSA-N 1 2 305.447 4.370 20 0 DIADLO CC(C)[N@@H+](Cc1nc(C2CCC2)no1)[C@H](C)c1ccsc1 ZINC000639683399 1046421905 /nfs/dbraw/zinc/42/19/05/1046421905.db2.gz FDZAGUCUTJKPOI-GFCCVEGCSA-N 1 2 305.447 4.370 20 0 DIADLO Clc1nc(-c2ccccc2)[nH]c1C[NH+]1CC2(C1)CCCC2 ZINC001139278412 1046422145 /nfs/dbraw/zinc/42/21/45/1046422145.db2.gz AYVXXJIVQXLCAK-UHFFFAOYSA-N 1 2 301.821 4.106 20 0 DIADLO FC[C@H]([NH2+]Cc1ccccc1OC1CC1)c1ccc(F)cc1 ZINC000640155289 1046422775 /nfs/dbraw/zinc/42/27/75/1046422775.db2.gz SLOBFDUYROBRKC-KRWDZBQOSA-N 1 2 303.352 4.167 20 0 DIADLO C[N@H+](Cc1ccncn1)Cc1ccccc1Oc1ccc(F)cc1 ZINC001139303745 1046427668 /nfs/dbraw/zinc/42/76/68/1046427668.db2.gz ZPLMRJSAOWVZAX-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[N@@H+](Cc1ccncn1)Cc1ccccc1Oc1ccc(F)cc1 ZINC001139303745 1046427673 /nfs/dbraw/zinc/42/76/73/1046427673.db2.gz ZPLMRJSAOWVZAX-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cc2ccccc2s1 ZINC000029916549 1046427933 /nfs/dbraw/zinc/42/79/33/1046427933.db2.gz LJOLOUDJXIPLNM-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO Clc1cccc(CC[N@@H+]2CCC[C@H]2c2ncccn2)c1Cl ZINC000639872903 1046432571 /nfs/dbraw/zinc/43/25/71/1046432571.db2.gz SGQRRHFYWCQBQE-AWEZNQCLSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1cccc(CC[N@H+]2CCC[C@H]2c2ncccn2)c1Cl ZINC000639872903 1046432575 /nfs/dbraw/zinc/43/25/75/1046432575.db2.gz SGQRRHFYWCQBQE-AWEZNQCLSA-N 1 2 322.239 4.163 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2cscc2Br)C1 ZINC001139348183 1046434200 /nfs/dbraw/zinc/43/42/00/1046434200.db2.gz XDYMAJFKTYSBRA-LBPRGKRZSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(Cl)cnc2Cl)CCC1(F)F ZINC001139354145 1046437002 /nfs/dbraw/zinc/43/70/02/1046437002.db2.gz LBKLCSFKIMLKTD-VIFPVBQESA-N 1 2 309.187 4.256 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(Cl)cnc2Cl)CCC1(F)F ZINC001139354145 1046437004 /nfs/dbraw/zinc/43/70/04/1046437004.db2.gz LBKLCSFKIMLKTD-VIFPVBQESA-N 1 2 309.187 4.256 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cc(Cl)cnc2Cl)cc1 ZINC001139351542 1046437191 /nfs/dbraw/zinc/43/71/91/1046437191.db2.gz CVAMFJLKQFUXFF-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cc(Cl)cnc2Cl)cc1 ZINC001139351542 1046437198 /nfs/dbraw/zinc/43/71/98/1046437198.db2.gz CVAMFJLKQFUXFF-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H]2CCCOc3ccc(F)cc32)c(C)s1 ZINC000676838964 1046439200 /nfs/dbraw/zinc/43/92/00/1046439200.db2.gz INNSCHJXDXYAPZ-BMIGLBTASA-N 1 2 320.433 4.464 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@@H](c2ccc(CC(C)C)cc2)C2CC2)n1 ZINC000676842792 1046440932 /nfs/dbraw/zinc/44/09/32/1046440932.db2.gz DGRMICLXDBRUGZ-UGSOOPFHSA-N 1 2 313.445 4.378 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2nc(-c3cccs3)oc2C)s1 ZINC000639993571 1046441570 /nfs/dbraw/zinc/44/15/70/1046441570.db2.gz BUAGZPUNKMPUAP-VIFPVBQESA-N 1 2 319.455 4.327 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2ncc(-c3ccccc3F)o2)s1 ZINC000639993682 1046441946 /nfs/dbraw/zinc/44/19/46/1046441946.db2.gz CEGSEXRWUWVEJO-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO C[N@H+](Cc1nc(C2CCCC2)no1)[C@@H]1CCCc2ccccc21 ZINC000676879764 1046442758 /nfs/dbraw/zinc/44/27/58/1046442758.db2.gz AWXOQGOELIAAKO-QGZVFWFLSA-N 1 2 311.429 4.237 20 0 DIADLO C[N@@H+](Cc1nc(C2CCCC2)no1)[C@@H]1CCCc2ccccc21 ZINC000676879764 1046442764 /nfs/dbraw/zinc/44/27/64/1046442764.db2.gz AWXOQGOELIAAKO-QGZVFWFLSA-N 1 2 311.429 4.237 20 0 DIADLO Cc1nc(C[NH2+]Cc2c(Cl)oc3ccccc32)sc1C ZINC000719618130 1046445858 /nfs/dbraw/zinc/44/58/58/1046445858.db2.gz SZOMVXJPTMCURZ-UHFFFAOYSA-N 1 2 306.818 4.449 20 0 DIADLO Clc1ccc(-c2ccc(C[NH+]3CC4(C3)CCCCO4)o2)cc1 ZINC001139414979 1046447491 /nfs/dbraw/zinc/44/74/91/1046447491.db2.gz HAUKGNLYLWYTLF-UHFFFAOYSA-N 1 2 317.816 4.355 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC(C)(C)[C@@H]2c2ccco2)c(C)[nH+]1 ZINC000640141227 1046450564 /nfs/dbraw/zinc/45/05/64/1046450564.db2.gz HVXRHTKGIMWMPK-INIZCTEOSA-N 1 2 313.401 4.215 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC(C)(C)[C@H]2c2ccco2)c(C)[nH+]1 ZINC000640141228 1046451016 /nfs/dbraw/zinc/45/10/16/1046451016.db2.gz HVXRHTKGIMWMPK-MRXNPFEDSA-N 1 2 313.401 4.215 20 0 DIADLO Clc1ccnc(Cl)c1C[NH+]1CCC(c2ccccn2)CC1 ZINC001139478121 1046454823 /nfs/dbraw/zinc/45/48/23/1046454823.db2.gz FEFRLFRKDXDZIF-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO CCC1CCC([N@H+](C)Cn2nc(C3CCC3)n(C)c2=S)CC1 ZINC000781561037 1046455755 /nfs/dbraw/zinc/45/57/55/1046455755.db2.gz IWFLZVFNUOMSJZ-UHFFFAOYSA-N 1 2 322.522 4.077 20 0 DIADLO CCC1CCC([N@@H+](C)Cn2nc(C3CCC3)n(C)c2=S)CC1 ZINC000781561037 1046455760 /nfs/dbraw/zinc/45/57/60/1046455760.db2.gz IWFLZVFNUOMSJZ-UHFFFAOYSA-N 1 2 322.522 4.077 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2nccn2C(F)F)cc1 ZINC000124560296 1046456153 /nfs/dbraw/zinc/45/61/53/1046456153.db2.gz DFCBGJGLAZRUGM-OAHLLOKOSA-N 1 2 305.372 4.314 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2nccn2C(F)F)cc1 ZINC000124560296 1046456158 /nfs/dbraw/zinc/45/61/58/1046456158.db2.gz DFCBGJGLAZRUGM-OAHLLOKOSA-N 1 2 305.372 4.314 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2nccn2C(F)F)cc1 ZINC000124560034 1046457286 /nfs/dbraw/zinc/45/72/86/1046457286.db2.gz DFCBGJGLAZRUGM-HNNXBMFYSA-N 1 2 305.372 4.314 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2nccn2C(F)F)cc1 ZINC000124560034 1046457291 /nfs/dbraw/zinc/45/72/91/1046457291.db2.gz DFCBGJGLAZRUGM-HNNXBMFYSA-N 1 2 305.372 4.314 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cnc(Cl)c(C)c2)cn1 ZINC001139547051 1046469105 /nfs/dbraw/zinc/46/91/05/1046469105.db2.gz VYAOBDKCVYDGPB-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cnc(Cl)c(C)c2)cn1 ZINC001139547051 1046469109 /nfs/dbraw/zinc/46/91/09/1046469109.db2.gz VYAOBDKCVYDGPB-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cn1c2ccccc2nc1[C@H]([NH2+]C/C=C/Cl)c1ccccc1 ZINC000125940875 1046474176 /nfs/dbraw/zinc/47/41/76/1046474176.db2.gz RZKIFQLQQWFCSI-SNQZOLJRSA-N 1 2 311.816 4.005 20 0 DIADLO CCC[C@H](NC(=O)NCc1c[nH+]c(C)cc1C)c1ccccc1 ZINC000454221496 1046478841 /nfs/dbraw/zinc/47/88/41/1046478841.db2.gz MNXCQKSMVWTUBI-SFHVURJKSA-N 1 2 311.429 4.039 20 0 DIADLO Fc1cccn2cc(C[NH2+]Cc3ccc(-c4ccccc4)o3)nc12 ZINC000677318717 1046483352 /nfs/dbraw/zinc/48/33/52/1046483352.db2.gz KNJMWNUOBLSNNW-UHFFFAOYSA-N 1 2 321.355 4.023 20 0 DIADLO CCOc1ccncc1C[N@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC001139631321 1046490640 /nfs/dbraw/zinc/49/06/40/1046490640.db2.gz VPHWRWGEJWGLKF-UHFFFAOYSA-N 1 2 324.346 4.131 20 0 DIADLO CCOc1ccncc1C[N@@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC001139631321 1046490645 /nfs/dbraw/zinc/49/06/45/1046490645.db2.gz VPHWRWGEJWGLKF-UHFFFAOYSA-N 1 2 324.346 4.131 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1cccc(Cl)n1)[C@@H]2C ZINC000782097333 1046494107 /nfs/dbraw/zinc/49/41/07/1046494107.db2.gz JCLJGUOYXCWUIC-CHWSQXEVSA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1cccc(Cl)n1)[C@@H]2C ZINC000782097333 1046494112 /nfs/dbraw/zinc/49/41/12/1046494112.db2.gz JCLJGUOYXCWUIC-CHWSQXEVSA-N 1 2 316.832 4.251 20 0 DIADLO Cc1nc(NC[C@@H](C)c2nc3ccccc3o2)c2c([nH+]1)CCCC2 ZINC000782147909 1046496136 /nfs/dbraw/zinc/49/61/36/1046496136.db2.gz GLAHJBODBDTSNM-GFCCVEGCSA-N 1 2 322.412 4.021 20 0 DIADLO COCOc1cccc(Nc2c[nH+]c(CC(C)C)cc2C)c1 ZINC001212898465 1046498972 /nfs/dbraw/zinc/49/89/72/1046498972.db2.gz PLONLWBLRIMQJP-UHFFFAOYSA-N 1 2 300.402 4.315 20 0 DIADLO C[C@@H](C1CC1)[N@@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000782184449 1046499885 /nfs/dbraw/zinc/49/98/85/1046499885.db2.gz SKHYAUZIGNTIAY-ZUZCIYMTSA-N 1 2 300.229 4.165 20 0 DIADLO C[C@@H](C1CC1)[N@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000782184449 1046499892 /nfs/dbraw/zinc/49/98/92/1046499892.db2.gz SKHYAUZIGNTIAY-ZUZCIYMTSA-N 1 2 300.229 4.165 20 0 DIADLO CSc1ccc(C[NH2+]Cc2cccnc2OC2CCCC2)o1 ZINC000641706883 1046506553 /nfs/dbraw/zinc/50/65/53/1046506553.db2.gz GRZDBDALKUPIEL-UHFFFAOYSA-N 1 2 318.442 4.008 20 0 DIADLO CSc1ccc(C[NH2+]Cc2ccsc2Br)o1 ZINC000641763426 1046510581 /nfs/dbraw/zinc/51/05/81/1046510581.db2.gz IDVQEFQATSIFOP-UHFFFAOYSA-N 1 2 318.261 4.115 20 0 DIADLO c1ccc2c(c1)oc1ccc(C[N@@H+]3Cc4ccncc4C3)cc12 ZINC001139754967 1046513776 /nfs/dbraw/zinc/51/37/76/1046513776.db2.gz QCQRETBIVWUIEY-UHFFFAOYSA-N 1 2 300.361 4.497 20 0 DIADLO c1ccc2c(c1)oc1ccc(C[N@H+]3Cc4ccncc4C3)cc12 ZINC001139754967 1046513788 /nfs/dbraw/zinc/51/37/88/1046513788.db2.gz QCQRETBIVWUIEY-UHFFFAOYSA-N 1 2 300.361 4.497 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1CSC1=Nc2ccccc2C1 ZINC000782281649 1046514381 /nfs/dbraw/zinc/51/43/81/1046514381.db2.gz GUZSEKINPCESFP-UHFFFAOYSA-N 1 2 319.433 4.451 20 0 DIADLO FC(F)[C@H]1CC[N@H+](Cc2ccc(Br)cc2Cl)C1 ZINC000677733982 1046518806 /nfs/dbraw/zinc/51/88/06/1046518806.db2.gz MODGMWIWIKCEOU-VIFPVBQESA-N 1 2 324.596 4.190 20 0 DIADLO FC(F)[C@H]1CC[N@@H+](Cc2ccc(Br)cc2Cl)C1 ZINC000677733982 1046518820 /nfs/dbraw/zinc/51/88/20/1046518820.db2.gz MODGMWIWIKCEOU-VIFPVBQESA-N 1 2 324.596 4.190 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Cl)ncc2Br)[C@H](C)C1 ZINC001139807184 1046520654 /nfs/dbraw/zinc/52/06/54/1046520654.db2.gz SXYQNZXCFJLAOB-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Cl)ncc2Br)[C@H](C)C1 ZINC001139807184 1046520659 /nfs/dbraw/zinc/52/06/59/1046520659.db2.gz SXYQNZXCFJLAOB-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO COc1ncc(C[N@@H+]2CCCC[C@H]2c2ccccc2F)s1 ZINC001139817539 1046523419 /nfs/dbraw/zinc/52/34/19/1046523419.db2.gz WZLJEWUROPWDEO-HNNXBMFYSA-N 1 2 306.406 4.018 20 0 DIADLO COc1ncc(C[N@H+]2CCCC[C@H]2c2ccccc2F)s1 ZINC001139817539 1046523430 /nfs/dbraw/zinc/52/34/30/1046523430.db2.gz WZLJEWUROPWDEO-HNNXBMFYSA-N 1 2 306.406 4.018 20 0 DIADLO Cc1ccc(N(C)Cc2c[nH+]cn2Cc2ccccc2)c(C)c1 ZINC000782483970 1046529539 /nfs/dbraw/zinc/52/95/39/1046529539.db2.gz SJACIWPXXXMVRV-UHFFFAOYSA-N 1 2 305.425 4.185 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@H]2c2cccc(Cl)c2)nc1 ZINC001139840523 1046530367 /nfs/dbraw/zinc/53/03/67/1046530367.db2.gz WYFIAZLIGLCYQG-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@H]2c2cccc(Cl)c2)nc1 ZINC001139840523 1046530381 /nfs/dbraw/zinc/53/03/81/1046530381.db2.gz WYFIAZLIGLCYQG-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@H]2CC2CCCCC2)c(C)c[nH+]1 ZINC000536618116 1046532726 /nfs/dbraw/zinc/53/27/26/1046532726.db2.gz GXWYFYGXZFLTKN-KRWDZBQOSA-N 1 2 315.461 4.087 20 0 DIADLO CC(C)(C)Oc1cccc(C[NH2+]Cc2cscc2Cl)n1 ZINC000678077685 1046552335 /nfs/dbraw/zinc/55/23/35/1046552335.db2.gz AYRDPALBUWXHMB-UHFFFAOYSA-N 1 2 310.850 4.264 20 0 DIADLO CN(C)c1ccc(C[N@H+](C)Cc2cccc(Cl)c2Cl)cn1 ZINC000678123008 1046558396 /nfs/dbraw/zinc/55/83/96/1046558396.db2.gz XBZPTJNQDYCGTQ-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1ccc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)cn1 ZINC000678123008 1046558409 /nfs/dbraw/zinc/55/84/09/1046558409.db2.gz XBZPTJNQDYCGTQ-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO COc1c(Cl)cccc1C[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000897482540 1046558980 /nfs/dbraw/zinc/55/89/80/1046558980.db2.gz UGVPLZPXLBGXTO-UHFFFAOYSA-N 1 2 324.877 4.392 20 0 DIADLO C[N@H+](CCc1ccccc1F)Cc1sc(Cl)nc1Cl ZINC001139960291 1046560039 /nfs/dbraw/zinc/56/00/39/1046560039.db2.gz XCZUFRWJCGGRHE-UHFFFAOYSA-N 1 2 319.232 4.264 20 0 DIADLO C[N@@H+](CCc1ccccc1F)Cc1sc(Cl)nc1Cl ZINC001139960291 1046560054 /nfs/dbraw/zinc/56/00/54/1046560054.db2.gz XCZUFRWJCGGRHE-UHFFFAOYSA-N 1 2 319.232 4.264 20 0 DIADLO CCCc1ccc(CO[NH+]=C(N)Cc2cccc(F)c2)cc1 ZINC000783159573 1046562510 /nfs/dbraw/zinc/56/25/10/1046562510.db2.gz YMJIBNKRMMBSKG-UHFFFAOYSA-N 1 2 300.377 4.019 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ncc(C(C)C)s2)o1 ZINC000137079159 1046563935 /nfs/dbraw/zinc/56/39/35/1046563935.db2.gz PFVJFNIJCWBLPP-AWEZNQCLSA-N 1 2 320.458 4.343 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ncc(C(C)C)s2)o1 ZINC000137079159 1046563949 /nfs/dbraw/zinc/56/39/49/1046563949.db2.gz PFVJFNIJCWBLPP-AWEZNQCLSA-N 1 2 320.458 4.343 20 0 DIADLO CC(C)[N@H+](Cc1nn(C)c2ccccc12)Cc1ccccc1F ZINC000678141884 1046570038 /nfs/dbraw/zinc/57/00/38/1046570038.db2.gz SHKSQYORFKNIBZ-UHFFFAOYSA-N 1 2 311.404 4.123 20 0 DIADLO CC(C)[N@@H+](Cc1nn(C)c2ccccc12)Cc1ccccc1F ZINC000678141884 1046570051 /nfs/dbraw/zinc/57/00/51/1046570051.db2.gz SHKSQYORFKNIBZ-UHFFFAOYSA-N 1 2 311.404 4.123 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(N(C)c3ccccc3)cc2)no1 ZINC000678153080 1046572006 /nfs/dbraw/zinc/57/20/06/1046572006.db2.gz ABNSVFBQNVEUAK-UHFFFAOYSA-N 1 2 321.424 4.383 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(N(C)c3ccccc3)cc2)no1 ZINC000678153080 1046572021 /nfs/dbraw/zinc/57/20/21/1046572021.db2.gz ABNSVFBQNVEUAK-UHFFFAOYSA-N 1 2 321.424 4.383 20 0 DIADLO C[N@H+](Cc1ccc(F)cc1F)Cc1ccccc1OC(F)F ZINC000642187694 1046578607 /nfs/dbraw/zinc/57/86/07/1046578607.db2.gz COQUTTUOMHUYAH-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO C[N@@H+](Cc1ccc(F)cc1F)Cc1ccccc1OC(F)F ZINC000642187694 1046578622 /nfs/dbraw/zinc/57/86/22/1046578622.db2.gz COQUTTUOMHUYAH-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1n[nH]c2ccc(OC)cc21 ZINC001140069372 1046580118 /nfs/dbraw/zinc/58/01/18/1046580118.db2.gz TZCFPNWGPLWNAT-HXUWFJFHSA-N 1 2 321.424 4.081 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1n[nH]c2ccc(OC)cc21 ZINC001140069372 1046580126 /nfs/dbraw/zinc/58/01/26/1046580126.db2.gz TZCFPNWGPLWNAT-HXUWFJFHSA-N 1 2 321.424 4.081 20 0 DIADLO Cc1cccc(C[N@@H+]2CCCC[C@@H]2c2noc(C3CC3)n2)c1C ZINC000678203237 1046582975 /nfs/dbraw/zinc/58/29/75/1046582975.db2.gz PLEMUSCTCIRSNU-QGZVFWFLSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1cccc(C[N@H+]2CCCC[C@@H]2c2noc(C3CC3)n2)c1C ZINC000678203237 1046582984 /nfs/dbraw/zinc/58/29/84/1046582984.db2.gz PLEMUSCTCIRSNU-QGZVFWFLSA-N 1 2 311.429 4.291 20 0 DIADLO CC(C)c1csc(C[NH2+][C@H]2CCCc3c(Cl)ccnc32)n1 ZINC000925283856 1046582971 /nfs/dbraw/zinc/58/29/71/1046582971.db2.gz UZKLPVAJQLCFSC-ZDUSSCGKSA-N 1 2 321.877 4.482 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1c[nH]c(-c2ccccc2)n1 ZINC000678197390 1046583943 /nfs/dbraw/zinc/58/39/43/1046583943.db2.gz XKMCZQWSSLRFCF-OAHLLOKOSA-N 1 2 319.408 4.032 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1c[nH]c(-c2ccccc2)n1 ZINC000678197390 1046583955 /nfs/dbraw/zinc/58/39/55/1046583955.db2.gz XKMCZQWSSLRFCF-OAHLLOKOSA-N 1 2 319.408 4.032 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@@H+]2Cc2cc(C)c(C)cc2C)no1 ZINC000678201056 1046584481 /nfs/dbraw/zinc/58/44/81/1046584481.db2.gz LBWMWWBENJHARM-KRWDZBQOSA-N 1 2 313.445 4.284 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@H+]2Cc2cc(C)c(C)cc2C)no1 ZINC000678201056 1046584492 /nfs/dbraw/zinc/58/44/92/1046584492.db2.gz LBWMWWBENJHARM-KRWDZBQOSA-N 1 2 313.445 4.284 20 0 DIADLO CC[N@H+](Cc1ccc(O)cc1Cl)Cc1cccc(F)c1F ZINC001140087895 1046586917 /nfs/dbraw/zinc/58/69/17/1046586917.db2.gz WIWRMPOITCNDNK-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC[N@@H+](Cc1ccc(O)cc1Cl)Cc1cccc(F)c1F ZINC001140087895 1046586928 /nfs/dbraw/zinc/58/69/28/1046586928.db2.gz WIWRMPOITCNDNK-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO Oc1ccc(C[N@H+](Cc2ccccc2)Cc2cccnc2)c(F)c1 ZINC001140127482 1046595642 /nfs/dbraw/zinc/59/56/42/1046595642.db2.gz VTNGTBRBPCSKTN-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO Oc1ccc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)c(F)c1 ZINC001140127482 1046595651 /nfs/dbraw/zinc/59/56/51/1046595651.db2.gz VTNGTBRBPCSKTN-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO CCCn1c(C)nn(C[NH+]2CCC3(CCCCC3)CC2)c1=S ZINC000760280343 1046595920 /nfs/dbraw/zinc/59/59/20/1046595920.db2.gz ZLLAFSXXCWBFFE-UHFFFAOYSA-N 1 2 322.522 4.136 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2nc(-c3cccc(C)c3)no2)cc1 ZINC000642328599 1046597459 /nfs/dbraw/zinc/59/74/59/1046597459.db2.gz KVXANRXLYZZLOS-UHFFFAOYSA-N 1 2 321.424 4.239 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2nc(-c3cccc(C)c3)no2)cc1 ZINC000642328599 1046597473 /nfs/dbraw/zinc/59/74/73/1046597473.db2.gz KVXANRXLYZZLOS-UHFFFAOYSA-N 1 2 321.424 4.239 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CCC[C@H]2c2cccs2)cs1 ZINC000245470980 1046607317 /nfs/dbraw/zinc/60/73/17/1046607317.db2.gz NKPUWXVLWCUXFI-YPMHNXCESA-N 1 2 308.472 4.249 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CCC[C@H]2c2cccs2)cs1 ZINC000245470980 1046607325 /nfs/dbraw/zinc/60/73/25/1046607325.db2.gz NKPUWXVLWCUXFI-YPMHNXCESA-N 1 2 308.472 4.249 20 0 DIADLO CC(C)Cc1ncc(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)s1 ZINC000678284644 1046612697 /nfs/dbraw/zinc/61/26/97/1046612697.db2.gz ZLFNUUFZQXPBBL-MRXNPFEDSA-N 1 2 304.434 4.428 20 0 DIADLO CC(C)Cc1ncc(C[N@H+]2CC[C@@H]2c2cccc(F)c2)s1 ZINC000678284644 1046612700 /nfs/dbraw/zinc/61/27/00/1046612700.db2.gz ZLFNUUFZQXPBBL-MRXNPFEDSA-N 1 2 304.434 4.428 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@@H+](Cc1nccc3ccccc31)CC2 ZINC000678293408 1046613514 /nfs/dbraw/zinc/61/35/14/1046613514.db2.gz DCVFBAQTWLQTPJ-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@H+](Cc1nccc3ccccc31)CC2 ZINC000678293408 1046613518 /nfs/dbraw/zinc/61/35/18/1046613518.db2.gz DCVFBAQTWLQTPJ-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1cc(C[NH+]2CC(c3ccccc3)C2)ccc1Br ZINC001140212725 1046615365 /nfs/dbraw/zinc/61/53/65/1046615365.db2.gz AGLXNOOVQCAWHV-UHFFFAOYSA-N 1 2 320.205 4.188 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1cn[nH]c1)[C@H](c1ccccc1)C2 ZINC000678335870 1046620929 /nfs/dbraw/zinc/62/09/29/1046620929.db2.gz MXUOREZHRJJQAL-IBGZPJMESA-N 1 2 323.827 4.363 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1cn[nH]c1)[C@H](c1ccccc1)C2 ZINC000678335870 1046620934 /nfs/dbraw/zinc/62/09/34/1046620934.db2.gz MXUOREZHRJJQAL-IBGZPJMESA-N 1 2 323.827 4.363 20 0 DIADLO CCc1nn(C)cc1C[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000678360925 1046625722 /nfs/dbraw/zinc/62/57/22/1046625722.db2.gz UXICFIKDRVLOPP-UHFFFAOYSA-N 1 2 324.255 4.068 20 0 DIADLO CCc1cc(OCc2nc(C3CCCC3)no2)c2ccccc2[nH+]1 ZINC000678356543 1046625945 /nfs/dbraw/zinc/62/59/45/1046625945.db2.gz VKQRADJUROORRG-UHFFFAOYSA-N 1 2 323.396 4.417 20 0 DIADLO C[C@@]1(c2ccccc2)CCC[N@H+](Cn2ncsc2=S)CC1 ZINC000795669629 1046629735 /nfs/dbraw/zinc/62/97/35/1046629735.db2.gz DZUPDPWDXQJHRK-MRXNPFEDSA-N 1 2 319.499 4.075 20 0 DIADLO C[C@@]1(c2ccccc2)CCC[N@@H+](Cn2ncsc2=S)CC1 ZINC000795669629 1046629739 /nfs/dbraw/zinc/62/97/39/1046629739.db2.gz DZUPDPWDXQJHRK-MRXNPFEDSA-N 1 2 319.499 4.075 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@@H]2CCn3ccnc32)c2ccccc2)c(C)c1 ZINC000834548741 1046630189 /nfs/dbraw/zinc/63/01/89/1046630189.db2.gz QSRRVXHRIZGEJS-WOJBJXKFSA-N 1 2 317.436 4.324 20 0 DIADLO CO[C@H]1C[C@@H]([N@H+](C)Cn2c(-c3ccccc3)csc2=S)C1 ZINC000795675598 1046631214 /nfs/dbraw/zinc/63/12/14/1046631214.db2.gz RITOZAIBMFSHSB-OKILXGFUSA-N 1 2 320.483 4.013 20 0 DIADLO CO[C@H]1C[C@@H]([N@@H+](C)Cn2c(-c3ccccc3)csc2=S)C1 ZINC000795675598 1046631219 /nfs/dbraw/zinc/63/12/19/1046631219.db2.gz RITOZAIBMFSHSB-OKILXGFUSA-N 1 2 320.483 4.013 20 0 DIADLO C[C@H]1CSCC[N@@H+]1Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000532967898 1046631524 /nfs/dbraw/zinc/63/15/24/1046631524.db2.gz IWHMLXPEMNSVKC-NSHDSACASA-N 1 2 324.902 4.401 20 0 DIADLO C[C@H]1CSCC[N@H+]1Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000532967898 1046631532 /nfs/dbraw/zinc/63/15/32/1046631532.db2.gz IWHMLXPEMNSVKC-NSHDSACASA-N 1 2 324.902 4.401 20 0 DIADLO COc1c(C)c[nH+]c(CN[C@@H](c2ccccc2)C(F)(F)F)c1C ZINC000533021082 1046640172 /nfs/dbraw/zinc/64/01/72/1046640172.db2.gz VONYSVGRSNVPOC-INIZCTEOSA-N 1 2 324.346 4.100 20 0 DIADLO COc1cc(C[N@@H+]2CCc3ccc(F)cc3C2)ccc1SC ZINC000533078186 1046650779 /nfs/dbraw/zinc/65/07/79/1046650779.db2.gz KAXYIPOSZJFFHQ-UHFFFAOYSA-N 1 2 317.429 4.115 20 0 DIADLO COc1cc(C[N@H+]2CCc3ccc(F)cc3C2)ccc1SC ZINC000533078186 1046650791 /nfs/dbraw/zinc/65/07/91/1046650791.db2.gz KAXYIPOSZJFFHQ-UHFFFAOYSA-N 1 2 317.429 4.115 20 0 DIADLO CCSc1nn(C[N@H+](C)C[C@@H]2CC=CCC2)c(=S)s1 ZINC000784011602 1046651276 /nfs/dbraw/zinc/65/12/76/1046651276.db2.gz BUYRWKLIFWKGCH-LLVKDONJSA-N 1 2 315.533 4.032 20 0 DIADLO CCSc1nn(C[N@@H+](C)C[C@@H]2CC=CCC2)c(=S)s1 ZINC000784011602 1046651278 /nfs/dbraw/zinc/65/12/78/1046651278.db2.gz BUYRWKLIFWKGCH-LLVKDONJSA-N 1 2 315.533 4.032 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccccc2-c2cccnc2)CC1(F)F ZINC001140315250 1046652062 /nfs/dbraw/zinc/65/20/62/1046652062.db2.gz IXSWLXSDCKUCLL-CQSZACIVSA-N 1 2 302.368 4.226 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccccc2-c2cccnc2)CC1(F)F ZINC001140315250 1046652066 /nfs/dbraw/zinc/65/20/66/1046652066.db2.gz IXSWLXSDCKUCLL-CQSZACIVSA-N 1 2 302.368 4.226 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2cc(C)[nH+]c(C)c2)c(Cl)c1 ZINC000643257570 1046653336 /nfs/dbraw/zinc/65/33/36/1046653336.db2.gz BLFMTSIZTCCBMQ-UHFFFAOYSA-N 1 2 317.820 4.290 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccncc1Cl ZINC000643347060 1046661363 /nfs/dbraw/zinc/66/13/63/1046661363.db2.gz SXXXPTJEVTWZQW-YMTOWFKASA-N 1 2 309.196 4.173 20 0 DIADLO Clc1sc(C[NH+]2CC(C3CC3)C2)cc1Br ZINC000643345742 1046661515 /nfs/dbraw/zinc/66/15/15/1046661515.db2.gz JVQFLHYEHHTUGT-UHFFFAOYSA-N 1 2 306.656 4.006 20 0 DIADLO Fc1ccc2c(c1)CC[C@H]2[NH2+]Cc1c(F)c(F)cc(F)c1F ZINC000678595482 1046669226 /nfs/dbraw/zinc/66/92/26/1046669226.db2.gz PLBOEJLGYHWKHR-CQSZACIVSA-N 1 2 313.269 4.159 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@@H+]1Cc1ccncn1 ZINC001140349826 1046670394 /nfs/dbraw/zinc/67/03/94/1046670394.db2.gz UTHBFMZUGQNPJV-MRXNPFEDSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@H+]1Cc1ccncn1 ZINC001140349826 1046670401 /nfs/dbraw/zinc/67/04/01/1046670401.db2.gz UTHBFMZUGQNPJV-MRXNPFEDSA-N 1 2 321.346 4.223 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)c(C)s1 ZINC000678597945 1046670577 /nfs/dbraw/zinc/67/05/77/1046670577.db2.gz NFKNNVYKRRBOIF-ISVAXAHUSA-N 1 2 308.834 4.198 20 0 DIADLO Fc1cccnc1C[NH2+][C@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000678603643 1046676147 /nfs/dbraw/zinc/67/61/47/1046676147.db2.gz AOZMEQQBTBSIED-ZDUSSCGKSA-N 1 2 311.187 4.305 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@H]2CCn3ccnc32)c2cccc(F)c2)c1 ZINC000834830926 1046677905 /nfs/dbraw/zinc/67/79/05/1046677905.db2.gz HJHMHFHPAZZQQE-RBUKOAKNSA-N 1 2 321.399 4.155 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1cccc(F)c1F ZINC000678609981 1046679068 /nfs/dbraw/zinc/67/90/68/1046679068.db2.gz BMPYMWHJBOEZKX-LKFCYVNXSA-N 1 2 309.743 4.403 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)cnc1Cl)c1cnn(C2CCCC2)c1 ZINC000834834816 1046680972 /nfs/dbraw/zinc/68/09/72/1046680972.db2.gz FAUOINXDADOFFX-NSHDSACASA-N 1 2 322.815 4.037 20 0 DIADLO FC1(F)CCC[C@H]1[NH2+][C@@H](Cc1ccncc1)c1cccs1 ZINC000643894508 1046688441 /nfs/dbraw/zinc/68/84/41/1046688441.db2.gz XJVPCMHOGSRNNZ-DZGCQCFKSA-N 1 2 308.397 4.204 20 0 DIADLO C[C@H]1C[N@H+](Cc2c[nH]c3ccc(F)cc23)[C@@H](c2ccccc2)CO1 ZINC001137344139 1046689269 /nfs/dbraw/zinc/68/92/69/1046689269.db2.gz ZEFWWZYEKGSETL-VBKZILBWSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c[nH]c3ccc(F)cc23)[C@@H](c2ccccc2)CO1 ZINC001137344139 1046689273 /nfs/dbraw/zinc/68/92/73/1046689273.db2.gz ZEFWWZYEKGSETL-VBKZILBWSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@H]1CCC[N@H+](Cn2c3ccccc3n(C(F)F)c2=S)C1 ZINC000834874260 1046691673 /nfs/dbraw/zinc/69/16/73/1046691673.db2.gz CNKYENCOIHBJTA-NSHDSACASA-N 1 2 311.401 4.257 20 0 DIADLO C[C@H]1CCC[N@@H+](Cn2c3ccccc3n(C(F)F)c2=S)C1 ZINC000834874260 1046691680 /nfs/dbraw/zinc/69/16/80/1046691680.db2.gz CNKYENCOIHBJTA-NSHDSACASA-N 1 2 311.401 4.257 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1nc2c(s1)CCC2 ZINC000678811598 1046705237 /nfs/dbraw/zinc/70/52/37/1046705237.db2.gz IUSMOTDAUDWSKQ-UHFFFAOYSA-N 1 2 312.891 4.369 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1nc2c(s1)CCC2 ZINC000678811598 1046705248 /nfs/dbraw/zinc/70/52/48/1046705248.db2.gz IUSMOTDAUDWSKQ-UHFFFAOYSA-N 1 2 312.891 4.369 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CCCOc3c(C(C)C)cccc32)co1 ZINC000834896924 1046709136 /nfs/dbraw/zinc/70/91/36/1046709136.db2.gz DMJZHVBJBKPTMG-QGZVFWFLSA-N 1 2 314.429 4.364 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2oc3ccc(OC)cc3c2C)co1 ZINC000834900505 1046711137 /nfs/dbraw/zinc/71/11/37/1046711137.db2.gz PWTXSTKZRXCRDT-GFCCVEGCSA-N 1 2 314.385 4.151 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CCSc3c(Cl)cccc32)co1 ZINC000834901293 1046711339 /nfs/dbraw/zinc/71/13/39/1046711339.db2.gz RZFOIFAHOAXCME-CYBMUJFWSA-N 1 2 308.834 4.217 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2nc3c(s2)CCC3)s1 ZINC000678832957 1046714044 /nfs/dbraw/zinc/71/40/44/1046714044.db2.gz OTPXBMFIZRGAJY-LLVKDONJSA-N 1 2 321.515 4.152 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2nc3c(s2)CCC3)s1 ZINC000678832957 1046714050 /nfs/dbraw/zinc/71/40/50/1046714050.db2.gz OTPXBMFIZRGAJY-LLVKDONJSA-N 1 2 321.515 4.152 20 0 DIADLO C[C@@H](C[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1)C1CCCCC1 ZINC000644536059 1046719218 /nfs/dbraw/zinc/71/92/18/1046719218.db2.gz DWMNPWWELCLSAA-WMLDXEAASA-N 1 2 304.482 4.232 20 0 DIADLO Fc1ccc([C@H](C[C@H]2CCOC2)[NH2+][C@@H]2CCCC2(F)F)cc1 ZINC000644547205 1046721090 /nfs/dbraw/zinc/72/10/90/1046721090.db2.gz GUUFBECBTHXIOT-UHOFOFEASA-N 1 2 313.363 4.071 20 0 DIADLO Cc1ccoc1C[NH2+][C@@H](C)c1nc2ccccc2n1C(F)F ZINC000644557062 1046723225 /nfs/dbraw/zinc/72/32/25/1046723225.db2.gz XLKYDJYIFIAGAW-NSHDSACASA-N 1 2 305.328 4.184 20 0 DIADLO C[C@H]([NH2+]Cc1ncccc1C(F)(F)F)c1ccc(F)cc1F ZINC000678871233 1046723568 /nfs/dbraw/zinc/72/35/68/1046723568.db2.gz AJVIWYGATJLEJT-VIFPVBQESA-N 1 2 316.273 4.229 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC[C@]3(C2)CCCCO3)c1Cl ZINC001137354432 1046725374 /nfs/dbraw/zinc/72/53/74/1046725374.db2.gz CYCOJPZHRQZJIS-HNNXBMFYSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC[C@]3(C2)CCCCO3)c1Cl ZINC001137354432 1046725388 /nfs/dbraw/zinc/72/53/88/1046725388.db2.gz CYCOJPZHRQZJIS-HNNXBMFYSA-N 1 2 318.219 4.278 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc(OCc2ccccc2)nc1 ZINC000644586877 1046726947 /nfs/dbraw/zinc/72/69/47/1046726947.db2.gz GNKHGMJFFBDSNY-UHFFFAOYSA-N 1 2 322.412 4.050 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC[C@H]3CCCO[C@@H]3C2)c1Cl ZINC001137354810 1046731140 /nfs/dbraw/zinc/73/11/40/1046731140.db2.gz RPNXOJGEDCZNDI-QMTHXVAHSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC[C@H]3CCCO[C@@H]3C2)c1Cl ZINC001137354810 1046731161 /nfs/dbraw/zinc/73/11/61/1046731161.db2.gz RPNXOJGEDCZNDI-QMTHXVAHSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2ncccc2C(F)(F)F)CC1 ZINC000678932247 1046738393 /nfs/dbraw/zinc/73/83/93/1046738393.db2.gz MJGGJSLPGSNZCL-UHFFFAOYSA-N 1 2 310.294 4.018 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2nc3c(s2)CCCC3)s1 ZINC000678984718 1046750124 /nfs/dbraw/zinc/75/01/24/1046750124.db2.gz FQCDDSBAHSDQBQ-LLVKDONJSA-N 1 2 321.515 4.288 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2nc3c(s2)CCCC3)s1 ZINC000678984718 1046750134 /nfs/dbraw/zinc/75/01/34/1046750134.db2.gz FQCDDSBAHSDQBQ-LLVKDONJSA-N 1 2 321.515 4.288 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cc1Cl ZINC000533558904 1046753850 /nfs/dbraw/zinc/75/38/50/1046753850.db2.gz ZFIKEDBBALGCBN-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)cc1Cl ZINC000533558904 1046753863 /nfs/dbraw/zinc/75/38/63/1046753863.db2.gz ZFIKEDBBALGCBN-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1ccc([C@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)c(C)n1 ZINC000679007073 1046757557 /nfs/dbraw/zinc/75/75/57/1046757557.db2.gz BFXAZGLIQASECZ-INIZCTEOSA-N 1 2 310.445 4.257 20 0 DIADLO Clc1cccc2c1CC[N@H+](Cc1ccnn1-c1ccccc1)C2 ZINC001140528106 1046765708 /nfs/dbraw/zinc/76/57/08/1046765708.db2.gz NMIRGDDAVMZDRR-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1cccc2c1CC[N@@H+](Cc1ccnn1-c1ccccc1)C2 ZINC001140528106 1046765719 /nfs/dbraw/zinc/76/57/19/1046765719.db2.gz NMIRGDDAVMZDRR-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO CC[C@H]1CCCC[C@@H]1N(C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455472982 1046768392 /nfs/dbraw/zinc/76/83/92/1046768392.db2.gz BWUWAWCUPBHEIF-HOTGVXAUSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1ccccc1O[C@H]1CC[N@@H+](Cc2c(F)cc(F)cc2F)C1 ZINC001140532658 1046768773 /nfs/dbraw/zinc/76/87/73/1046768773.db2.gz LECUKYZEWBNRNC-AWEZNQCLSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1ccccc1O[C@H]1CC[N@H+](Cc2c(F)cc(F)cc2F)C1 ZINC001140532658 1046768757 /nfs/dbraw/zinc/76/87/57/1046768757.db2.gz LECUKYZEWBNRNC-AWEZNQCLSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC(c3ccccc3)CC2)c(C)[nH+]1 ZINC000455479831 1046770542 /nfs/dbraw/zinc/77/05/42/1046770542.db2.gz NYGQHYWVMOMSJI-UHFFFAOYSA-N 1 2 323.440 4.418 20 0 DIADLO Fc1cc2c(c(F)c1)CC[C@@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000679076398 1046770661 /nfs/dbraw/zinc/77/06/61/1046770661.db2.gz OCZAFIGVSKQOGP-KRWDZBQOSA-N 1 2 315.367 4.059 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cc(F)cc(Cl)c1)CC2 ZINC001140535817 1046771414 /nfs/dbraw/zinc/77/14/14/1046771414.db2.gz SJAXGGCXOZPXNT-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cc(F)cc(Cl)c1)CC2 ZINC001140535817 1046771426 /nfs/dbraw/zinc/77/14/26/1046771426.db2.gz SJAXGGCXOZPXNT-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Cc1cccc([C@H]2CCN(C(=O)Nc3c(C)cc(C)[nH+]c3C)C2)c1 ZINC000455478500 1046771611 /nfs/dbraw/zinc/77/16/11/1046771611.db2.gz GCOMKKGCPAHDTR-SFHVURJKSA-N 1 2 323.440 4.337 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2c(F)cccc2Cl)c(C)[nH+]1 ZINC000455485277 1046772448 /nfs/dbraw/zinc/77/24/48/1046772448.db2.gz QWHLTUJMEGVXJN-UHFFFAOYSA-N 1 2 321.783 4.121 20 0 DIADLO CSc1ccc(F)cc1C[NH2+]Cc1cccc(O)c1Cl ZINC000645159764 1046773823 /nfs/dbraw/zinc/77/38/23/1046773823.db2.gz MQYDUWXSAANMPX-UHFFFAOYSA-N 1 2 311.809 4.196 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@@H](C)c2csc(C(C)C)n2)c1 ZINC000645158707 1046774171 /nfs/dbraw/zinc/77/41/71/1046774171.db2.gz PJQWYIYMJHHBCX-NSHDSACASA-N 1 2 308.422 4.265 20 0 DIADLO Cc1cc(Cl)cc(C[NH2+][C@H]2COc3cc(F)cc(F)c32)c1 ZINC000645171711 1046776301 /nfs/dbraw/zinc/77/63/01/1046776301.db2.gz BNNPKSANNBTEBN-AWEZNQCLSA-N 1 2 309.743 4.150 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@H](CC(C)C)C2)c(C)[nH+]1 ZINC000455498105 1046777500 /nfs/dbraw/zinc/77/75/00/1046777500.db2.gz QZSAOWUSAYSLIY-MRXNPFEDSA-N 1 2 303.450 4.297 20 0 DIADLO Cc1cc(C)c(NC(=O)N(CC(C)C)C2CCCC2)c(C)[nH+]1 ZINC000455503052 1046778052 /nfs/dbraw/zinc/77/80/52/1046778052.db2.gz VGKPPFMVYMSGJE-UHFFFAOYSA-N 1 2 303.450 4.439 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC[C@H](C[C@@H]3CCOC3)C2)c1 ZINC000645205263 1046779079 /nfs/dbraw/zinc/77/90/79/1046779079.db2.gz DHOVBVNKVDJGTQ-CABCVRRESA-N 1 2 314.404 4.017 20 0 DIADLO CC(=O)C1CC[NH+](Cc2cc(Cl)ccc2C(F)(F)F)CC1 ZINC001140566832 1046785269 /nfs/dbraw/zinc/78/52/69/1046785269.db2.gz SULFRTJOKPWIFX-UHFFFAOYSA-N 1 2 319.754 4.160 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2ncc[nH]2)c2cccs2)cc1 ZINC000067695719 1046788096 /nfs/dbraw/zinc/78/80/96/1046788096.db2.gz ZUMXTCVGEAXYKJ-OAHLLOKOSA-N 1 2 303.818 4.004 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1nc2ccccc2c(C)c1Cl ZINC000679186264 1046789252 /nfs/dbraw/zinc/78/92/52/1046789252.db2.gz GQXBONPHGSKTEG-TZMCWYRMSA-N 1 2 318.848 4.196 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1nc2ccccc2c(C)c1Cl ZINC000679186264 1046789262 /nfs/dbraw/zinc/78/92/62/1046789262.db2.gz GQXBONPHGSKTEG-TZMCWYRMSA-N 1 2 318.848 4.196 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc(Cl)c2C)o1 ZINC000070785899 1046793782 /nfs/dbraw/zinc/79/37/82/1046793782.db2.gz WRPMZRZKMDMBGF-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc(Cl)c2C)o1 ZINC000070785899 1046793793 /nfs/dbraw/zinc/79/37/93/1046793793.db2.gz WRPMZRZKMDMBGF-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccccc1-c1noc(C[NH2+]C2(c3ccccc3)CCC2)n1 ZINC000064343593 1046799534 /nfs/dbraw/zinc/79/95/34/1046799534.db2.gz MHOWTXMEKNEFMH-UHFFFAOYSA-N 1 2 319.408 4.214 20 0 DIADLO CC(C)COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1c[nH]cn1 ZINC000072756894 1046799746 /nfs/dbraw/zinc/79/97/46/1046799746.db2.gz DDBRBRZEUQYKQP-SFHVURJKSA-N 1 2 315.461 4.322 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncc(C(C)C)o1)c1ccc(OC)c(OC)c1 ZINC000796255895 1046801632 /nfs/dbraw/zinc/80/16/32/1046801632.db2.gz PITINXMJAFAAQN-CQSZACIVSA-N 1 2 318.417 4.056 20 0 DIADLO Fc1cc(Br)ccc1C[NH+]1CCC(C(F)F)CC1 ZINC000307883436 1046809495 /nfs/dbraw/zinc/80/94/95/1046809495.db2.gz WSAYWBHDFZLIFB-UHFFFAOYSA-N 1 2 322.168 4.065 20 0 DIADLO C[N@H+](Cc1noc(-c2c(F)cccc2Cl)n1)C1CC(C)(C)C1 ZINC000645928090 1046830184 /nfs/dbraw/zinc/83/01/84/1046830184.db2.gz VBONRMBTQCHFAT-UHFFFAOYSA-N 1 2 323.799 4.150 20 0 DIADLO C[N@@H+](Cc1noc(-c2c(F)cccc2Cl)n1)C1CC(C)(C)C1 ZINC000645928090 1046830201 /nfs/dbraw/zinc/83/02/01/1046830201.db2.gz VBONRMBTQCHFAT-UHFFFAOYSA-N 1 2 323.799 4.150 20 0 DIADLO FC(F)C(F)(F)C[N@@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000796282214 1046831499 /nfs/dbraw/zinc/83/14/99/1046831499.db2.gz KHMGATQPXUZZNI-BFHYXJOUSA-N 1 2 301.327 4.155 20 0 DIADLO FC(F)C(F)(F)C[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000796282214 1046831519 /nfs/dbraw/zinc/83/15/19/1046831519.db2.gz KHMGATQPXUZZNI-BFHYXJOUSA-N 1 2 301.327 4.155 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+][C@H](CCc1ccccc1)C(F)F ZINC000679387835 1046832591 /nfs/dbraw/zinc/83/25/91/1046832591.db2.gz FVAMBYFTBAAEQZ-RHSMWYFYSA-N 1 2 304.384 4.307 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2Cl)C[N@@H+]1Cc1ccc(O)cc1 ZINC000679391922 1046836306 /nfs/dbraw/zinc/83/63/06/1046836306.db2.gz BYKLUUAFIMJHSI-UGSOOPFHSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2Cl)C[N@H+]1Cc1ccc(O)cc1 ZINC000679391922 1046836328 /nfs/dbraw/zinc/83/63/28/1046836328.db2.gz BYKLUUAFIMJHSI-UGSOOPFHSA-N 1 2 317.816 4.008 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2ncc(-c3cccs3)o2)CC1 ZINC000645979961 1046836329 /nfs/dbraw/zinc/83/63/29/1046836329.db2.gz TUNSQIZGMOUTAH-UHFFFAOYSA-N 1 2 310.422 4.490 20 0 DIADLO Cn1c(C[NH2+]C2(c3ccccc3Cl)CC2)nc2ccccc21 ZINC000645977684 1046836951 /nfs/dbraw/zinc/83/69/51/1046836951.db2.gz ILASPYMMWOCFKH-UHFFFAOYSA-N 1 2 311.816 4.006 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2Cl)C[N@@H+]1Cc1ccc(O)cc1 ZINC000679391915 1046836898 /nfs/dbraw/zinc/83/68/98/1046836898.db2.gz BYKLUUAFIMJHSI-ACJLOTCBSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2Cl)C[N@H+]1Cc1ccc(O)cc1 ZINC000679391915 1046836918 /nfs/dbraw/zinc/83/69/18/1046836918.db2.gz BYKLUUAFIMJHSI-ACJLOTCBSA-N 1 2 317.816 4.008 20 0 DIADLO COc1nc(C)cc(C)c1C[NH2+]C1(c2ccccc2Cl)CC1 ZINC000645978563 1046838803 /nfs/dbraw/zinc/83/88/03/1046838803.db2.gz WNXFBDNEGZYKNI-UHFFFAOYSA-N 1 2 316.832 4.139 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2cnc3ccccc3c2)c(F)c1F ZINC000797469341 1046839084 /nfs/dbraw/zinc/83/90/84/1046839084.db2.gz ZFOFIKCZNLSEDE-UHFFFAOYSA-N 1 2 320.289 4.081 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nnc(-c3ccccc3)o2)[C@H](c2ccco2)C1 ZINC000076184249 1046844498 /nfs/dbraw/zinc/84/44/98/1046844498.db2.gz ZGJBBDCYLIUSMV-ZBFHGGJFSA-N 1 2 323.396 4.303 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccccc3)o2)[C@H](c2ccco2)C1 ZINC000076184249 1046844521 /nfs/dbraw/zinc/84/45/21/1046844521.db2.gz ZGJBBDCYLIUSMV-ZBFHGGJFSA-N 1 2 323.396 4.303 20 0 DIADLO CCCc1nc(C[N@@H+](Cc2ccc(C)nc2)CC2CC2)cs1 ZINC000646018618 1046844752 /nfs/dbraw/zinc/84/47/52/1046844752.db2.gz CWENADRURZIZNP-UHFFFAOYSA-N 1 2 315.486 4.211 20 0 DIADLO CCCc1nc(C[N@H+](Cc2ccc(C)nc2)CC2CC2)cs1 ZINC000646018618 1046844771 /nfs/dbraw/zinc/84/47/71/1046844771.db2.gz CWENADRURZIZNP-UHFFFAOYSA-N 1 2 315.486 4.211 20 0 DIADLO Cc1ccc(C[N@H+](Cc2conc2Cc2ccccc2)C2CC2)o1 ZINC000646052789 1046848429 /nfs/dbraw/zinc/84/84/29/1046848429.db2.gz BHQVMUZCPJHIPO-UHFFFAOYSA-N 1 2 322.408 4.331 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2conc2Cc2ccccc2)C2CC2)o1 ZINC000646052789 1046848436 /nfs/dbraw/zinc/84/84/36/1046848436.db2.gz BHQVMUZCPJHIPO-UHFFFAOYSA-N 1 2 322.408 4.331 20 0 DIADLO CC(C)c1nnc(C[NH2+]C2(c3cccc(Cl)c3)CCC2)o1 ZINC000646095682 1046855839 /nfs/dbraw/zinc/85/58/39/1046855839.db2.gz WGAJZUJFXYAJOT-UHFFFAOYSA-N 1 2 305.809 4.015 20 0 DIADLO CC(C)c1nnc(C[NH2+]C2(c3cccc(Cl)c3)CCC2)s1 ZINC000646094982 1046856478 /nfs/dbraw/zinc/85/64/78/1046856478.db2.gz ASTQAWOMQRXDBW-UHFFFAOYSA-N 1 2 321.877 4.484 20 0 DIADLO Cc1cc(F)c(C[NH+]2CCC(C)(F)CC2)cc1Br ZINC001140697520 1046860493 /nfs/dbraw/zinc/86/04/93/1046860493.db2.gz VFCKSDJLIZNUIK-UHFFFAOYSA-N 1 2 318.205 4.221 20 0 DIADLO Fc1cc(C[NH+]2CCC(OC3CCC3)CC2)c(F)cc1Cl ZINC001140699431 1046862482 /nfs/dbraw/zinc/86/24/82/1046862482.db2.gz PDFHXGCFYGQSMB-UHFFFAOYSA-N 1 2 315.791 4.152 20 0 DIADLO Cc1cc(C[NH2+]Cc2coc(-c3cccs3)n2)cc(Cl)n1 ZINC000797598643 1046865849 /nfs/dbraw/zinc/86/58/49/1046865849.db2.gz TUVFUGJYDPOCDD-UHFFFAOYSA-N 1 2 319.817 4.050 20 0 DIADLO CCCc1nc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)cs1 ZINC000679545028 1046866837 /nfs/dbraw/zinc/86/68/37/1046866837.db2.gz UWVFQEVLQMFVBE-GHMZBOCLSA-N 1 2 306.397 4.258 20 0 DIADLO CCCc1nc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)cs1 ZINC000679545028 1046866851 /nfs/dbraw/zinc/86/68/51/1046866851.db2.gz UWVFQEVLQMFVBE-GHMZBOCLSA-N 1 2 306.397 4.258 20 0 DIADLO CCCc1nc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)cs1 ZINC000679545031 1046866942 /nfs/dbraw/zinc/86/69/42/1046866942.db2.gz UWVFQEVLQMFVBE-WDEREUQCSA-N 1 2 306.397 4.258 20 0 DIADLO CCCc1nc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)cs1 ZINC000679545031 1046866956 /nfs/dbraw/zinc/86/69/56/1046866956.db2.gz UWVFQEVLQMFVBE-WDEREUQCSA-N 1 2 306.397 4.258 20 0 DIADLO Cc1cc(C[NH2+]Cc2csc(-c3ccco3)n2)cc(Cl)n1 ZINC000797603013 1046868486 /nfs/dbraw/zinc/86/84/86/1046868486.db2.gz YTQBGQPNSIXIIR-UHFFFAOYSA-N 1 2 319.817 4.050 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cccc(O)c1Cl ZINC000646156440 1046868956 /nfs/dbraw/zinc/86/89/56/1046868956.db2.gz UQLYVOSSLURSIU-GXSJLCMTSA-N 1 2 307.743 4.208 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cccc(O)c1Cl ZINC000646156440 1046868970 /nfs/dbraw/zinc/86/89/70/1046868970.db2.gz UQLYVOSSLURSIU-GXSJLCMTSA-N 1 2 307.743 4.208 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)n1 ZINC000679546508 1046869054 /nfs/dbraw/zinc/86/90/54/1046869054.db2.gz PMJYSFWGMJACRD-QWHCGFSZSA-N 1 2 317.399 4.407 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)n1 ZINC000679546508 1046869066 /nfs/dbraw/zinc/86/90/66/1046869066.db2.gz PMJYSFWGMJACRD-QWHCGFSZSA-N 1 2 317.399 4.407 20 0 DIADLO CC1=C(Br)C[N@H+](Cc2cc3ccccc3[nH]2)CC1 ZINC000797605022 1046870796 /nfs/dbraw/zinc/87/07/96/1046870796.db2.gz LHBGCQGWHKAFNF-UHFFFAOYSA-N 1 2 305.219 4.043 20 0 DIADLO CC1=C(Br)C[N@@H+](Cc2cc3ccccc3[nH]2)CC1 ZINC000797605022 1046870814 /nfs/dbraw/zinc/87/08/14/1046870814.db2.gz LHBGCQGWHKAFNF-UHFFFAOYSA-N 1 2 305.219 4.043 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000679584116 1046875343 /nfs/dbraw/zinc/87/53/43/1046875343.db2.gz KZQUZGPSDYMMTR-SCZZXKLOSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000679584116 1046875354 /nfs/dbraw/zinc/87/53/54/1046875354.db2.gz KZQUZGPSDYMMTR-SCZZXKLOSA-N 1 2 311.269 4.267 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1cc(C)ccc1Br ZINC001137384430 1046888489 /nfs/dbraw/zinc/88/84/89/1046888489.db2.gz FAHAAHZXMKRVAP-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1cc(C)ccc1Br ZINC001137384430 1046888495 /nfs/dbraw/zinc/88/84/95/1046888495.db2.gz FAHAAHZXMKRVAP-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO COc1cc(-c2ccccc2)ccc1C[NH2+]Cc1csc(C)n1 ZINC000679718438 1046895061 /nfs/dbraw/zinc/89/50/61/1046895061.db2.gz CXSOJYZFCVARBF-UHFFFAOYSA-N 1 2 324.449 4.417 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCCC[C@H]2C2CCC2)c(C)[nH+]1 ZINC000646408377 1046896718 /nfs/dbraw/zinc/89/67/18/1046896718.db2.gz MGNSYCQTSVOIIT-INIZCTEOSA-N 1 2 301.434 4.193 20 0 DIADLO FC(F)O[C@@H]1CCC[N@H+](Cc2cccc(Cl)c2Cl)C1 ZINC000679740446 1046899334 /nfs/dbraw/zinc/89/93/34/1046899334.db2.gz NWQBOKJFBBDPIS-SNVBAGLBSA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2Cl)C1 ZINC000679740446 1046899344 /nfs/dbraw/zinc/89/93/44/1046899344.db2.gz NWQBOKJFBBDPIS-SNVBAGLBSA-N 1 2 310.171 4.197 20 0 DIADLO Cc1ccc(-c2ccc(C(=O)Nc3ccc4[nH+]ccn4c3)s2)o1 ZINC000679753781 1046901166 /nfs/dbraw/zinc/90/11/66/1046901166.db2.gz NNRDKSHAADSVIH-UHFFFAOYSA-N 1 2 323.377 4.217 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccc(C)cc2Cl)c(OC)c1 ZINC001140800603 1046905473 /nfs/dbraw/zinc/90/54/73/1046905473.db2.gz NRUUJXKBHGNFDC-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccc(C)cc2Cl)c(OC)c1 ZINC001140800603 1046905486 /nfs/dbraw/zinc/90/54/86/1046905486.db2.gz NRUUJXKBHGNFDC-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2c[nH]c3ccncc23)c(F)c1 ZINC001140805303 1046908429 /nfs/dbraw/zinc/90/84/29/1046908429.db2.gz AAUJSIYVZAZYAX-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2c[nH]c3ccncc23)c(F)c1 ZINC001140805303 1046908441 /nfs/dbraw/zinc/90/84/41/1046908441.db2.gz AAUJSIYVZAZYAX-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2c[nH]c3ccncc23)c(F)c1 ZINC001140805302 1046908679 /nfs/dbraw/zinc/90/86/79/1046908679.db2.gz AAUJSIYVZAZYAX-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2c[nH]c3ccncc23)c(F)c1 ZINC001140805302 1046908690 /nfs/dbraw/zinc/90/86/90/1046908690.db2.gz AAUJSIYVZAZYAX-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+]Cc1csc(C2CCCC2)n1 ZINC000679942611 1046914763 /nfs/dbraw/zinc/91/47/63/1046914763.db2.gz QEKVCSZVNZSFCP-ZDUSSCGKSA-N 1 2 301.459 4.355 20 0 DIADLO COc1cc(F)c(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c(F)c1 ZINC001140823331 1046915769 /nfs/dbraw/zinc/91/57/69/1046915769.db2.gz CHRMTATVZINNAG-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c(F)c1 ZINC001140823331 1046915780 /nfs/dbraw/zinc/91/57/80/1046915780.db2.gz CHRMTATVZINNAG-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3ccc(F)cc3C2)c(Cl)c1 ZINC001140822362 1046916472 /nfs/dbraw/zinc/91/64/72/1046916472.db2.gz MBAUGJWNUVYMOA-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(C[N@H+]2CCc3ccc(F)cc3C2)c(Cl)c1 ZINC001140822362 1046916487 /nfs/dbraw/zinc/91/64/87/1046916487.db2.gz MBAUGJWNUVYMOA-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Cc1ccccc1SCC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000161810119 1046916835 /nfs/dbraw/zinc/91/68/35/1046916835.db2.gz RSQQOYAKTHZDAH-UHFFFAOYSA-N 1 2 323.421 4.116 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)CC(=O)OCc1ccccc1 ZINC000303411574 1046917183 /nfs/dbraw/zinc/91/71/83/1046917183.db2.gz UWLNRFYIOPLHBA-OAHLLOKOSA-N 1 2 323.392 4.169 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)CC(=O)OCc1ccccc1 ZINC000303411574 1046917191 /nfs/dbraw/zinc/91/71/91/1046917191.db2.gz UWLNRFYIOPLHBA-OAHLLOKOSA-N 1 2 323.392 4.169 20 0 DIADLO C[C@H](Cc1ccsc1)[N@@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000679983980 1046920569 /nfs/dbraw/zinc/92/05/69/1046920569.db2.gz HPVWOUGBFOCOSE-DOMZBBRYSA-N 1 2 317.458 4.167 20 0 DIADLO C[C@H](Cc1ccsc1)[N@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000679983980 1046920585 /nfs/dbraw/zinc/92/05/85/1046920585.db2.gz HPVWOUGBFOCOSE-DOMZBBRYSA-N 1 2 317.458 4.167 20 0 DIADLO COC(C)(C)[C@H]1CCC[N@@H+]1Cc1cc(Cl)c(O)c(Cl)c1 ZINC001140834629 1046923363 /nfs/dbraw/zinc/92/33/63/1046923363.db2.gz SGHFIGFGXJWMBA-CYBMUJFWSA-N 1 2 318.244 4.088 20 0 DIADLO COC(C)(C)[C@H]1CCC[N@H+]1Cc1cc(Cl)c(O)c(Cl)c1 ZINC001140834629 1046923369 /nfs/dbraw/zinc/92/33/69/1046923369.db2.gz SGHFIGFGXJWMBA-CYBMUJFWSA-N 1 2 318.244 4.088 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1CCCCC[C@H]1/C=C\c1cccs1 ZINC000680003021 1046926750 /nfs/dbraw/zinc/92/67/50/1046926750.db2.gz KRSQLMXWSQQNSC-QWGSZXSUSA-N 1 2 301.459 4.238 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1cccc(Cl)c1 ZINC000680041916 1046937162 /nfs/dbraw/zinc/93/71/62/1046937162.db2.gz PGWIWZHRQWCZFJ-XPTSAGLGSA-N 1 2 309.743 4.403 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1ccc(Cl)cc1 ZINC000680042109 1046937327 /nfs/dbraw/zinc/93/73/27/1046937327.db2.gz YLCWXOUDFOZDJZ-XPTSAGLGSA-N 1 2 309.743 4.403 20 0 DIADLO Nc1cccc(F)c1C[N@@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001140876894 1046939174 /nfs/dbraw/zinc/93/91/74/1046939174.db2.gz PUETXGLTXYDXFV-MRXNPFEDSA-N 1 2 306.331 4.023 20 0 DIADLO Nc1cccc(F)c1C[N@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001140876894 1046939185 /nfs/dbraw/zinc/93/91/85/1046939185.db2.gz PUETXGLTXYDXFV-MRXNPFEDSA-N 1 2 306.331 4.023 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(O)c(F)c1F ZINC001140892879 1046942409 /nfs/dbraw/zinc/94/24/09/1046942409.db2.gz CVDOTKRHBCHFPR-HNNXBMFYSA-N 1 2 303.352 4.180 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@@H+]2Cc2nnc(CC)s2)o1 ZINC000680053600 1046943310 /nfs/dbraw/zinc/94/33/10/1046943310.db2.gz SVQVETJBPXIZGI-CQSZACIVSA-N 1 2 319.474 4.373 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@H+]2Cc2nnc(CC)s2)o1 ZINC000680053600 1046943322 /nfs/dbraw/zinc/94/33/22/1046943322.db2.gz SVQVETJBPXIZGI-CQSZACIVSA-N 1 2 319.474 4.373 20 0 DIADLO Oc1ccc(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)c(F)c1F ZINC001140892878 1046943591 /nfs/dbraw/zinc/94/35/91/1046943591.db2.gz CEXXTLAOLUTWND-NSHDSACASA-N 1 2 323.770 4.313 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnccc2C(F)(F)F)Cc2ccccc21 ZINC001140915619 1046948025 /nfs/dbraw/zinc/94/80/25/1046948025.db2.gz ORTROJPWGPMPQU-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnccc2C(F)(F)F)Cc2ccccc21 ZINC001140915619 1046948036 /nfs/dbraw/zinc/94/80/36/1046948036.db2.gz ORTROJPWGPMPQU-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO CC(C)(C)n1cc(C[N@H+](Cc2ccco2)Cc2ccccc2)cn1 ZINC000162217663 1046952888 /nfs/dbraw/zinc/95/28/88/1046952888.db2.gz ZKPBDVSZAMLCTG-UHFFFAOYSA-N 1 2 323.440 4.434 20 0 DIADLO CC(C)(C)n1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2)cn1 ZINC000162217663 1046952895 /nfs/dbraw/zinc/95/28/95/1046952895.db2.gz ZKPBDVSZAMLCTG-UHFFFAOYSA-N 1 2 323.440 4.434 20 0 DIADLO Cc1noc(C)c1CN(C)c1cc[nH+]c2cc(F)c(Cl)cc21 ZINC000827378010 1046954021 /nfs/dbraw/zinc/95/40/21/1046954021.db2.gz KAPWCNZSSSCSBH-UHFFFAOYSA-N 1 2 319.767 4.269 20 0 DIADLO Oc1cccc(C[NH2+]C2(c3ccccc3Cl)CC2)c1Cl ZINC000647224306 1046955738 /nfs/dbraw/zinc/95/57/38/1046955738.db2.gz AOQSCTIWQLKRQV-UHFFFAOYSA-N 1 2 308.208 4.478 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2ncc(C(C)C)s2)CC1 ZINC000647233140 1046958760 /nfs/dbraw/zinc/95/87/60/1046958760.db2.gz VYQWZIFLTSZMPD-UHFFFAOYSA-N 1 2 302.443 4.054 20 0 DIADLO Cc1c(Cl)c(C[NH2+]C2(c3cccc(Cl)c3)CCC2)nn1C ZINC000647252202 1046961449 /nfs/dbraw/zinc/96/14/49/1046961449.db2.gz XQNLTYKAXUUAJP-UHFFFAOYSA-N 1 2 324.255 4.204 20 0 DIADLO Cc1cc(C[N@H+](C)CCC(c2ccccc2)c2ccccc2)n[nH]1 ZINC001203081463 1046962628 /nfs/dbraw/zinc/96/26/28/1046962628.db2.gz UWNCSZDEFSMIAG-UHFFFAOYSA-N 1 2 319.452 4.372 20 0 DIADLO Cc1cc(C[N@@H+](C)CCC(c2ccccc2)c2ccccc2)n[nH]1 ZINC001203081463 1046962635 /nfs/dbraw/zinc/96/26/35/1046962635.db2.gz UWNCSZDEFSMIAG-UHFFFAOYSA-N 1 2 319.452 4.372 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc2n(n1)CCCC2)c1ccccc1Cl ZINC000647279993 1046964139 /nfs/dbraw/zinc/96/41/39/1046964139.db2.gz LSUJDDODQWKNHK-OLZOCXBDSA-N 1 2 303.837 4.285 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)s1 ZINC000680334150 1046966455 /nfs/dbraw/zinc/96/64/55/1046966455.db2.gz IIXRHEWPWFLTJF-WDEREUQCSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1cnc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)s1 ZINC000680334150 1046966466 /nfs/dbraw/zinc/96/64/66/1046966466.db2.gz IIXRHEWPWFLTJF-WDEREUQCSA-N 1 2 306.397 4.429 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc2n(n1)CCCC2)c1ccc(F)cc1Cl ZINC000647289840 1046967806 /nfs/dbraw/zinc/96/78/06/1046967806.db2.gz LIYTYXSPGIBVCQ-NEPJUHHUSA-N 1 2 321.827 4.424 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CCC[C@H]2c2ccccc2F)cc1F ZINC001140990903 1046970283 /nfs/dbraw/zinc/97/02/83/1046970283.db2.gz CHBGAEXEWLDTAS-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO CC[C@@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1ccccc1F ZINC000680355312 1046971165 /nfs/dbraw/zinc/97/11/65/1046971165.db2.gz WMXGKLDZBVIXMB-CABCVRRESA-N 1 2 307.315 4.278 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1cc(F)cc(F)c1 ZINC000680355251 1046971535 /nfs/dbraw/zinc/97/15/35/1046971535.db2.gz NWSAMVATGFCMAY-RMLUDKJBSA-N 1 2 311.278 4.027 20 0 DIADLO Fc1cc2c(c(F)c1)[C@@H]([NH2+][C@H]1CCSc3ccccc31)CO2 ZINC000680354884 1046972152 /nfs/dbraw/zinc/97/21/52/1046972152.db2.gz KCIAXVHCJHWPPE-KBPBESRZSA-N 1 2 319.376 4.225 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+][C@@H]1COc2cc(F)cc(F)c21 ZINC000680354870 1046972372 /nfs/dbraw/zinc/97/23/72/1046972372.db2.gz JNEZORZGWKDHJS-XHDPSFHLSA-N 1 2 319.351 4.066 20 0 DIADLO CCC(CC)(CNC(=O)Nc1c(C)cc(C)[nH+]c1C)SC ZINC000836632100 1046977756 /nfs/dbraw/zinc/97/77/56/1046977756.db2.gz IYSUDCYGKKETKM-UHFFFAOYSA-N 1 2 309.479 4.050 20 0 DIADLO COc1ccccc1C1([NH2+][C@@H](C)c2ccncc2Cl)CC1 ZINC000647328896 1046978482 /nfs/dbraw/zinc/97/84/82/1046978482.db2.gz AGMRLIVRXVECKX-LBPRGKRZSA-N 1 2 302.805 4.084 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(C(C)C)cc2C(C)C)o1 ZINC000680427443 1046982078 /nfs/dbraw/zinc/98/20/78/1046982078.db2.gz MXWHZSYNEQJXFG-ZDUSSCGKSA-N 1 2 301.434 4.476 20 0 DIADLO COc1ccc2nc(Cl)c(C[N@@H+]3CCC[C@](C)(F)C3)cc2c1 ZINC001141062324 1046994714 /nfs/dbraw/zinc/99/47/14/1046994714.db2.gz DUBSWAUHOWAONK-KRWDZBQOSA-N 1 2 322.811 4.221 20 0 DIADLO COc1ccc2nc(Cl)c(C[N@H+]3CCC[C@](C)(F)C3)cc2c1 ZINC001141062324 1046994718 /nfs/dbraw/zinc/99/47/18/1046994718.db2.gz DUBSWAUHOWAONK-KRWDZBQOSA-N 1 2 322.811 4.221 20 0 DIADLO CCCCc1[nH]cc(CN2CCC[C@@H]2c2cc(F)ccc2F)[nH+]1 ZINC001141070321 1046997298 /nfs/dbraw/zinc/99/72/98/1046997298.db2.gz USARMZMRMWVLOB-QGZVFWFLSA-N 1 2 319.399 4.368 20 0 DIADLO CCCCc1[nH]c(CN2CCC[C@@H]2c2cc(F)ccc2F)c[nH+]1 ZINC001141070321 1046997306 /nfs/dbraw/zinc/99/73/06/1046997306.db2.gz USARMZMRMWVLOB-QGZVFWFLSA-N 1 2 319.399 4.368 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124914 1047003824 /nfs/dbraw/zinc/00/38/24/1047003824.db2.gz BFNFYSMMBXTYEU-FZMZJTMJSA-N 1 2 305.809 4.005 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124914 1047003842 /nfs/dbraw/zinc/00/38/42/1047003842.db2.gz BFNFYSMMBXTYEU-FZMZJTMJSA-N 1 2 305.809 4.005 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(Cl)cn1)c1cc(Cl)ccc1Cl ZINC000799153467 1047007168 /nfs/dbraw/zinc/00/71/68/1047007168.db2.gz HECZFTUGLHSFLL-MRVPVSSYSA-N 1 2 316.619 4.288 20 0 DIADLO C/C(=C/c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1)C(C)(C)C ZINC000680695503 1047012816 /nfs/dbraw/zinc/01/28/16/1047012816.db2.gz GHAAIUOMCPSXQL-UVTDQMKNSA-N 1 2 322.412 4.431 20 0 DIADLO FC1(F)COC2(C[NH+](Cc3ccccc3-c3cccs3)C2)C1 ZINC001141096886 1047012703 /nfs/dbraw/zinc/01/27/03/1047012703.db2.gz TUARWBRGALDOSQ-UHFFFAOYSA-N 1 2 321.392 4.025 20 0 DIADLO C/C(=C/c1nc(Cc2cn3cccc(C)c3[nH+]2)no1)C(C)(C)C ZINC000680733910 1047022983 /nfs/dbraw/zinc/02/29/83/1047022983.db2.gz MORSPGDBMUPQBI-LCYFTJDESA-N 1 2 310.401 4.066 20 0 DIADLO Clc1cc(Cl)cc(C2=CC[N@H+](Cc3cocn3)CC2)c1 ZINC001141126596 1047023722 /nfs/dbraw/zinc/02/37/22/1047023722.db2.gz XOFKLLQLYLQMQC-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Clc1cc(Cl)cc(C2=CC[N@@H+](Cc3cocn3)CC2)c1 ZINC001141126596 1047023738 /nfs/dbraw/zinc/02/37/38/1047023738.db2.gz XOFKLLQLYLQMQC-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Cc1cc(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)c(C)s1 ZINC000680749930 1047028503 /nfs/dbraw/zinc/02/85/03/1047028503.db2.gz PFNULKJQLRAFFG-UHFFFAOYSA-N 1 2 322.393 4.268 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc3c(c1)CCC(C)(C)O3)C2 ZINC001141184505 1047038500 /nfs/dbraw/zinc/03/85/00/1047038500.db2.gz BRICEFIIMDQXIV-UHFFFAOYSA-N 1 2 323.436 4.315 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc3c(c1)CCC(C)(C)O3)C2 ZINC001141184505 1047038510 /nfs/dbraw/zinc/03/85/10/1047038510.db2.gz BRICEFIIMDQXIV-UHFFFAOYSA-N 1 2 323.436 4.315 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@](C)(c3ccc(F)cc3)C2)c(F)c1 ZINC001141196640 1047044138 /nfs/dbraw/zinc/04/41/38/1047044138.db2.gz SBKUNDURECRXOJ-LJQANCHMSA-N 1 2 317.379 4.021 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@](C)(c3ccc(F)cc3)C2)c(F)c1 ZINC001141196640 1047044148 /nfs/dbraw/zinc/04/41/48/1047044148.db2.gz SBKUNDURECRXOJ-LJQANCHMSA-N 1 2 317.379 4.021 20 0 DIADLO C[N@H+](CCF)Cc1ccc(-c2ccc(C(F)(F)F)cc2)nc1 ZINC001141218582 1047048762 /nfs/dbraw/zinc/04/87/62/1047048762.db2.gz UCQOPXXSDUTVPU-UHFFFAOYSA-N 1 2 312.310 4.169 20 0 DIADLO C[N@@H+](CCF)Cc1ccc(-c2ccc(C(F)(F)F)cc2)nc1 ZINC001141218582 1047048776 /nfs/dbraw/zinc/04/87/76/1047048776.db2.gz UCQOPXXSDUTVPU-UHFFFAOYSA-N 1 2 312.310 4.169 20 0 DIADLO COc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c1F ZINC001141223851 1047050761 /nfs/dbraw/zinc/05/07/61/1047050761.db2.gz SHYNQLQOILBAFO-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)c1F ZINC001141223851 1047050770 /nfs/dbraw/zinc/05/07/70/1047050770.db2.gz SHYNQLQOILBAFO-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1nc2c(s1)CCCC2 ZINC000680851475 1047055588 /nfs/dbraw/zinc/05/55/88/1047055588.db2.gz GVKCVBFMXIQERB-UHFFFAOYSA-N 1 2 312.442 4.004 20 0 DIADLO c1ccc2c(c1)[nH]c1c2C[C@@H](Nc2ccc([NH+]3CCCC3)cc2)C1 ZINC000799720581 1047055671 /nfs/dbraw/zinc/05/56/71/1047055671.db2.gz JYUDXQCBTCWTCY-MRXNPFEDSA-N 1 2 317.436 4.347 20 0 DIADLO Cc1[nH]ncc1C[N@@H+]1C[C@@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000536663635 1047057173 /nfs/dbraw/zinc/05/71/73/1047057173.db2.gz RHTJSLOLSBKDIQ-MEDUHNTESA-N 1 2 323.362 4.320 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1C[C@@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000536663635 1047057187 /nfs/dbraw/zinc/05/71/87/1047057187.db2.gz RHTJSLOLSBKDIQ-MEDUHNTESA-N 1 2 323.362 4.320 20 0 DIADLO C[N@H+](Cc1ccon1)Cc1ccc(Sc2ccccc2)cc1 ZINC000536662776 1047057531 /nfs/dbraw/zinc/05/75/31/1047057531.db2.gz YSYGIYOFEXHFGO-UHFFFAOYSA-N 1 2 310.422 4.458 20 0 DIADLO C[N@@H+](Cc1ccon1)Cc1ccc(Sc2ccccc2)cc1 ZINC000536662776 1047057543 /nfs/dbraw/zinc/05/75/43/1047057543.db2.gz YSYGIYOFEXHFGO-UHFFFAOYSA-N 1 2 310.422 4.458 20 0 DIADLO Oc1cccc(C[N@@H+]2CCSC[C@H]2c2ccc(Cl)cc2)c1 ZINC000536680892 1047060418 /nfs/dbraw/zinc/06/04/18/1047060418.db2.gz GQCSSLQJHNPMCT-KRWDZBQOSA-N 1 2 319.857 4.336 20 0 DIADLO Oc1cccc(C[N@H+]2CCSC[C@H]2c2ccc(Cl)cc2)c1 ZINC000536680892 1047060426 /nfs/dbraw/zinc/06/04/26/1047060426.db2.gz GQCSSLQJHNPMCT-KRWDZBQOSA-N 1 2 319.857 4.336 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)c1 ZINC000536695587 1047072799 /nfs/dbraw/zinc/07/27/99/1047072799.db2.gz IGAVXBVBQJXMPS-CXAGYDPISA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)c1 ZINC000536695587 1047072811 /nfs/dbraw/zinc/07/28/11/1047072811.db2.gz IGAVXBVBQJXMPS-CXAGYDPISA-N 1 2 305.418 4.158 20 0 DIADLO Cc1nc2c(o1)CC[N@H+](Cc1cccc(-c3ccsc3)c1)C2 ZINC001141386398 1047113095 /nfs/dbraw/zinc/11/30/95/1047113095.db2.gz GTZYEJMDTYHTAY-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1nc2c(o1)CC[N@@H+](Cc1cccc(-c3ccsc3)c1)C2 ZINC001141386398 1047113099 /nfs/dbraw/zinc/11/30/99/1047113099.db2.gz GTZYEJMDTYHTAY-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccc(Cl)cn1 ZINC000681393824 1047121039 /nfs/dbraw/zinc/12/10/39/1047121039.db2.gz FFXFWKDQTWPXRO-LKFCYVNXSA-N 1 2 309.196 4.173 20 0 DIADLO c1ccc2c(c1)C[N@@H+](Cc1nc3c(s1)CCCC3)CC21CC1 ZINC000681498930 1047128674 /nfs/dbraw/zinc/12/86/74/1047128674.db2.gz KRYACNRNKGGEDL-UHFFFAOYSA-N 1 2 310.466 4.069 20 0 DIADLO c1ccc2c(c1)C[N@H+](Cc1nc3c(s1)CCCC3)CC21CC1 ZINC000681498930 1047128682 /nfs/dbraw/zinc/12/86/82/1047128682.db2.gz KRYACNRNKGGEDL-UHFFFAOYSA-N 1 2 310.466 4.069 20 0 DIADLO Cc1cc(N[C@@H]2CCO[C@]3(CCSC3)C2)[nH+]c2ccccc12 ZINC001116309153 1047129772 /nfs/dbraw/zinc/12/97/72/1047129772.db2.gz RKVJGGYKCDDKTD-RDTXWAMCSA-N 1 2 314.454 4.010 20 0 DIADLO CCc1cc(CNc2[nH+]ccc3cc(C(F)(F)F)ccc32)[nH]n1 ZINC000827617763 1047130598 /nfs/dbraw/zinc/13/05/98/1047130598.db2.gz DDMKHEAHLKIKDO-UHFFFAOYSA-N 1 2 320.318 4.151 20 0 DIADLO CC(C)Oc1ccnc(C[N@H+](C)[C@@H](C)c2ccccc2F)c1 ZINC000649490160 1047137809 /nfs/dbraw/zinc/13/78/09/1047137809.db2.gz VQKRWCVVCSIBOP-AWEZNQCLSA-N 1 2 302.393 4.201 20 0 DIADLO CC(C)Oc1ccnc(C[N@@H+](C)[C@@H](C)c2ccccc2F)c1 ZINC000649490160 1047137814 /nfs/dbraw/zinc/13/78/14/1047137814.db2.gz VQKRWCVVCSIBOP-AWEZNQCLSA-N 1 2 302.393 4.201 20 0 DIADLO Clc1ccc(C[N@H+](Cc2cc3n(n2)CCCC3)C2CC2)cc1 ZINC000649490293 1047138070 /nfs/dbraw/zinc/13/80/70/1047138070.db2.gz ZSBNKCSPJPPMLE-UHFFFAOYSA-N 1 2 315.848 4.037 20 0 DIADLO Clc1ccc(C[N@@H+](Cc2cc3n(n2)CCCC3)C2CC2)cc1 ZINC000649490293 1047138075 /nfs/dbraw/zinc/13/80/75/1047138075.db2.gz ZSBNKCSPJPPMLE-UHFFFAOYSA-N 1 2 315.848 4.037 20 0 DIADLO CC(C)Oc1ccnc(C[N@H+](C)[C@H](C)c2ccccc2F)c1 ZINC000649490161 1047138138 /nfs/dbraw/zinc/13/81/38/1047138138.db2.gz VQKRWCVVCSIBOP-CQSZACIVSA-N 1 2 302.393 4.201 20 0 DIADLO CC(C)Oc1ccnc(C[N@@H+](C)[C@H](C)c2ccccc2F)c1 ZINC000649490161 1047138140 /nfs/dbraw/zinc/13/81/40/1047138140.db2.gz VQKRWCVVCSIBOP-CQSZACIVSA-N 1 2 302.393 4.201 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000537123385 1047138764 /nfs/dbraw/zinc/13/87/64/1047138764.db2.gz QLKPNXPFSJZHLN-ZIAGYGMSSA-N 1 2 322.412 4.106 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[N@H+](C)Cc1cc2n(n1)CCC2 ZINC000649501013 1047139103 /nfs/dbraw/zinc/13/91/03/1047139103.db2.gz ZAASQDVSCTUMOE-LLVKDONJSA-N 1 2 324.255 4.329 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)Cc1cc2n(n1)CCC2 ZINC000649501013 1047139108 /nfs/dbraw/zinc/13/91/08/1047139108.db2.gz ZAASQDVSCTUMOE-LLVKDONJSA-N 1 2 324.255 4.329 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@H+]([C@H](C)c1cnc(C)nc1C)CC3 ZINC000681670695 1047140450 /nfs/dbraw/zinc/14/04/50/1047140450.db2.gz FZFAAXUBCKQUMZ-CQSZACIVSA-N 1 2 320.440 4.002 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@@H+]([C@H](C)c1cnc(C)nc1C)CC3 ZINC000681670695 1047140455 /nfs/dbraw/zinc/14/04/55/1047140455.db2.gz FZFAAXUBCKQUMZ-CQSZACIVSA-N 1 2 320.440 4.002 20 0 DIADLO c1ccc([C@@H](CC2CCCC2)[NH2+]Cc2nnc(C3CC3)o2)cc1 ZINC000537132405 1047141628 /nfs/dbraw/zinc/14/16/28/1047141628.db2.gz CYCKYGKGSJKUSC-QGZVFWFLSA-N 1 2 311.429 4.358 20 0 DIADLO Cc1ccc(NC(=O)C[NH2+][C@@H](C)c2c(F)cccc2Cl)cc1 ZINC000537176836 1047145144 /nfs/dbraw/zinc/14/51/44/1047145144.db2.gz AAWPSNAOKUJPGY-LBPRGKRZSA-N 1 2 320.795 4.077 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+][C@H](c2cccc(F)c2)C(C)(C)C)o1 ZINC001116468159 1047145592 /nfs/dbraw/zinc/14/55/92/1047145592.db2.gz DFUHLFMQSRTNDL-OAHLLOKOSA-N 1 2 319.424 4.383 20 0 DIADLO CCc1ccccc1C[NH2+][C@@H](c1ccn(C)n1)c1ccc(F)cc1 ZINC000537191741 1047147024 /nfs/dbraw/zinc/14/70/24/1047147024.db2.gz XYKCNOYOTKVVKC-HXUWFJFHSA-N 1 2 323.415 4.001 20 0 DIADLO COc1cc(C)c([C@H](C)Nc2ccc(C)[nH+]c2C)cc1OC ZINC001116485249 1047147959 /nfs/dbraw/zinc/14/79/59/1047147959.db2.gz TUCZFHKGXSHOPU-ZDUSSCGKSA-N 1 2 300.402 4.197 20 0 DIADLO CCCCN(C(=O)C[C@@H](C)n1cc[nH+]c1)[C@@H](C)c1ccc(C)o1 ZINC000649595026 1047150403 /nfs/dbraw/zinc/15/04/03/1047150403.db2.gz YFYJQWLPENMZNR-ZBFHGGJFSA-N 1 2 317.433 4.126 20 0 DIADLO CC[C@H]1C[N@H+](Cc2nc(-c3ccccc3)oc2C)[C@@H](CC)CO1 ZINC000649722123 1047166674 /nfs/dbraw/zinc/16/66/74/1047166674.db2.gz IQIFUDFRWOUJMW-IRXDYDNUSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2nc(-c3ccccc3)oc2C)[C@@H](CC)CO1 ZINC000649722123 1047166679 /nfs/dbraw/zinc/16/66/79/1047166679.db2.gz IQIFUDFRWOUJMW-IRXDYDNUSA-N 1 2 314.429 4.039 20 0 DIADLO FC1(F)CC12CC[NH+](Cc1csc(C3CCCC3)n1)CC2 ZINC000649776053 1047174501 /nfs/dbraw/zinc/17/45/01/1047174501.db2.gz BMEBJFIKDREYRO-UHFFFAOYSA-N 1 2 312.429 4.422 20 0 DIADLO Fc1ccccc1C[C@@H]1CCCC[N@H+]1Cc1nccn1C(F)F ZINC000649795234 1047176529 /nfs/dbraw/zinc/17/65/29/1047176529.db2.gz HOLBBOYTTNCTEF-AWEZNQCLSA-N 1 2 323.362 4.015 20 0 DIADLO Fc1ccccc1C[C@@H]1CCCC[N@@H+]1Cc1nccn1C(F)F ZINC000649795234 1047176531 /nfs/dbraw/zinc/17/65/31/1047176531.db2.gz HOLBBOYTTNCTEF-AWEZNQCLSA-N 1 2 323.362 4.015 20 0 DIADLO Fc1cc(Br)cc(F)c1C[N@@H+]1CCC2(CCC2)C1 ZINC001141561426 1047189125 /nfs/dbraw/zinc/18/91/25/1047189125.db2.gz GMOAUXIOIYEAKV-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Fc1cc(Br)cc(F)c1C[N@H+]1CCC2(CCC2)C1 ZINC001141561426 1047189129 /nfs/dbraw/zinc/18/91/29/1047189129.db2.gz GMOAUXIOIYEAKV-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Cc1cc(N2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@@H]2O)[nH+]c2ccccc12 ZINC001116913007 1047190070 /nfs/dbraw/zinc/19/00/70/1047190070.db2.gz OSMBLFYPAZXNGE-FPWFTKFVSA-N 1 2 324.468 4.309 20 0 DIADLO CC(C)(C)OCCCC[N@@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000682754606 1047219890 /nfs/dbraw/zinc/21/98/90/1047219890.db2.gz FDBBUFKTVJOEPV-HNNXBMFYSA-N 1 2 321.465 4.069 20 0 DIADLO CC(C)(C)OCCCC[N@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000682754606 1047219897 /nfs/dbraw/zinc/21/98/97/1047219897.db2.gz FDBBUFKTVJOEPV-HNNXBMFYSA-N 1 2 321.465 4.069 20 0 DIADLO COc1cc(C[N@H+](C)Cc2ccccc2Cl)cc(F)c1OC ZINC001137506033 1047221921 /nfs/dbraw/zinc/22/19/21/1047221921.db2.gz FBLDLOGRJBDIHH-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2ccccc2Cl)cc(F)c1OC ZINC001137506033 1047221933 /nfs/dbraw/zinc/22/19/33/1047221933.db2.gz FBLDLOGRJBDIHH-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cnc(-c3cccs3)s2)nc1 ZINC000682788459 1047224757 /nfs/dbraw/zinc/22/47/57/1047224757.db2.gz PLOXLTNESLIWSS-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cnc(-c3cccs3)s2)nc1 ZINC000682788459 1047224765 /nfs/dbraw/zinc/22/47/65/1047224765.db2.gz PLOXLTNESLIWSS-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO COCc1cc[nH+]c(NCc2cc(C)c(OC(F)F)c(C)c2)c1 ZINC000650244554 1047225685 /nfs/dbraw/zinc/22/56/85/1047225685.db2.gz DMMVGANHFCYZGP-UHFFFAOYSA-N 1 2 322.355 4.058 20 0 DIADLO c1cn(-c2ccc(CSc3ncnc4sccc43)cc2)c[nH+]1 ZINC000682854515 1047230781 /nfs/dbraw/zinc/23/07/81/1047230781.db2.gz VQIXIFGSUAAFOM-UHFFFAOYSA-N 1 2 324.434 4.169 20 0 DIADLO CCc1nc([C@H]2CCCC[N@@H+]2Cc2cccc3ccoc32)no1 ZINC001117744096 1047239767 /nfs/dbraw/zinc/23/97/67/1047239767.db2.gz VGGKRUHXPRHANZ-OAHLLOKOSA-N 1 2 311.385 4.105 20 0 DIADLO CCc1nc([C@H]2CCCC[N@H+]2Cc2cccc3ccoc32)no1 ZINC001117744096 1047239772 /nfs/dbraw/zinc/23/97/72/1047239772.db2.gz VGGKRUHXPRHANZ-OAHLLOKOSA-N 1 2 311.385 4.105 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1nccn1-c1ccccc1 ZINC000682997729 1047247375 /nfs/dbraw/zinc/24/73/75/1047247375.db2.gz XQKPAKSJMRVXIL-KGLIPLIRSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1nccn1-c1ccccc1 ZINC000682997729 1047247386 /nfs/dbraw/zinc/24/73/86/1047247386.db2.gz XQKPAKSJMRVXIL-KGLIPLIRSA-N 1 2 323.362 4.035 20 0 DIADLO Brc1ccc(C[N@@H+]2CCCc3sccc3C2)o1 ZINC000682996793 1047248514 /nfs/dbraw/zinc/24/85/14/1047248514.db2.gz PDSDXJLOKJXRSG-UHFFFAOYSA-N 1 2 312.232 4.052 20 0 DIADLO Brc1ccc(C[N@H+]2CCCc3sccc3C2)o1 ZINC000682996793 1047248526 /nfs/dbraw/zinc/24/85/26/1047248526.db2.gz PDSDXJLOKJXRSG-UHFFFAOYSA-N 1 2 312.232 4.052 20 0 DIADLO CCn1ccc(C[N@H+](C)Cc2ncc(-c3ccccc3)s2)c1 ZINC000682999984 1047249333 /nfs/dbraw/zinc/24/93/33/1047249333.db2.gz OZVURIOXYJFESO-UHFFFAOYSA-N 1 2 311.454 4.264 20 0 DIADLO CCn1ccc(C[N@@H+](C)Cc2ncc(-c3ccccc3)s2)c1 ZINC000682999984 1047249346 /nfs/dbraw/zinc/24/93/46/1047249346.db2.gz OZVURIOXYJFESO-UHFFFAOYSA-N 1 2 311.454 4.264 20 0 DIADLO CCn1ccc(C[N@H+](C)Cc2csc(-c3cccs3)n2)c1 ZINC000682999455 1047250677 /nfs/dbraw/zinc/25/06/77/1047250677.db2.gz JWBRMGZYIQBUMB-UHFFFAOYSA-N 1 2 317.483 4.325 20 0 DIADLO CCn1ccc(C[N@@H+](C)Cc2csc(-c3cccs3)n2)c1 ZINC000682999455 1047250703 /nfs/dbraw/zinc/25/07/03/1047250703.db2.gz JWBRMGZYIQBUMB-UHFFFAOYSA-N 1 2 317.483 4.325 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(C)ccn1)c1nc(C(F)(F)F)cs1 ZINC000683021839 1047255651 /nfs/dbraw/zinc/25/56/51/1047255651.db2.gz LWTBGOFGYKNLJK-LLVKDONJSA-N 1 2 315.364 4.106 20 0 DIADLO CCCC[C@@H](CCC)NC(=O)[C@H]1CCc2[nH+]c(C(C)C)[nH]c2C1 ZINC000476250951 1047263247 /nfs/dbraw/zinc/26/32/47/1047263247.db2.gz STMADXRKROQMRL-LSDHHAIUSA-N 1 2 319.493 4.113 20 0 DIADLO CCCC[C@@H](CCC)NC(=O)[C@H]1CCc2[nH]c(C(C)C)[nH+]c2C1 ZINC000476250951 1047263259 /nfs/dbraw/zinc/26/32/59/1047263259.db2.gz STMADXRKROQMRL-LSDHHAIUSA-N 1 2 319.493 4.113 20 0 DIADLO c1cc2ncnc(Nc3ccc([NH+]4CCCCC4)cc3)c2s1 ZINC000796439744 1047284282 /nfs/dbraw/zinc/28/42/82/1047284282.db2.gz VIPRKAKIFZXAJZ-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO CC(C)C[C@@H]1C[C@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000651201664 1047300446 /nfs/dbraw/zinc/30/04/46/1047300446.db2.gz DFVKBRPDFZLKQJ-IAGOWNOFSA-N 1 2 322.412 4.131 20 0 DIADLO FC(F)(F)c1nc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)cs1 ZINC001141869999 1047301636 /nfs/dbraw/zinc/30/16/36/1047301636.db2.gz HHQXVIBPYTVYRC-GFCCVEGCSA-N 1 2 312.360 4.151 20 0 DIADLO FC(F)(F)c1nc(C[N@H+]2CC[C@@H](c3ccccc3)C2)cs1 ZINC001141869999 1047301650 /nfs/dbraw/zinc/30/16/50/1047301650.db2.gz HHQXVIBPYTVYRC-GFCCVEGCSA-N 1 2 312.360 4.151 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]C/C=C\c2ccc(F)cc2F)n1 ZINC000897944001 1047303805 /nfs/dbraw/zinc/30/38/05/1047303805.db2.gz DRBWCXPOVNNDSB-PLNGDYQASA-N 1 2 306.356 4.053 20 0 DIADLO Cc1cc(C[NH2+]Cc2nc(C(C)(C)C)co2)cc2cccnc12 ZINC000897945049 1047305219 /nfs/dbraw/zinc/30/52/19/1047305219.db2.gz XHDKNPRZMPRUCR-UHFFFAOYSA-N 1 2 309.413 4.119 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)n1 ZINC000651719107 1047324079 /nfs/dbraw/zinc/32/40/79/1047324079.db2.gz JMTNNCPJTPPRDW-INIZCTEOSA-N 1 2 320.440 4.377 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1ccc(-c2ccccc2)cn1 ZINC000651738203 1047324111 /nfs/dbraw/zinc/32/41/11/1047324111.db2.gz FBUZSONREKSDBU-IFXJQAMLSA-N 1 2 318.424 4.200 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1ccc(-c2ccccc2)cn1 ZINC000651738203 1047324124 /nfs/dbraw/zinc/32/41/24/1047324124.db2.gz FBUZSONREKSDBU-IFXJQAMLSA-N 1 2 318.424 4.200 20 0 DIADLO CC(C)(C)[C@@H]([NH2+]Cc1nc(C2CCC2)no1)c1cccc(F)c1 ZINC001119253059 1047324514 /nfs/dbraw/zinc/32/45/14/1047324514.db2.gz YDFXCLGUTUIPGT-INIZCTEOSA-N 1 2 317.408 4.353 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CC(C)(C)Oc3ccc(F)cc32)cs1 ZINC000651949613 1047335012 /nfs/dbraw/zinc/33/50/12/1047335012.db2.gz PMOGROBNGKIONO-AWEZNQCLSA-N 1 2 320.433 4.237 20 0 DIADLO C[C@H]1CC[N@H+](Cc2sccc2Oc2ccccc2)CCC1=O ZINC001141994774 1047337211 /nfs/dbraw/zinc/33/72/11/1047337211.db2.gz YZCQEEIOKQRWSV-AWEZNQCLSA-N 1 2 315.438 4.341 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2sccc2Oc2ccccc2)CCC1=O ZINC001141994774 1047337219 /nfs/dbraw/zinc/33/72/19/1047337219.db2.gz YZCQEEIOKQRWSV-AWEZNQCLSA-N 1 2 315.438 4.341 20 0 DIADLO O=C(C=C1CCCCC1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000726146030 1047337203 /nfs/dbraw/zinc/33/72/03/1047337203.db2.gz DZVXBBRBESNWHZ-UHFFFAOYSA-N 1 2 315.804 4.355 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@@H](Cc2ccccc2)c2nccn2C)o1 ZINC000652274426 1047351626 /nfs/dbraw/zinc/35/16/26/1047351626.db2.gz NQDSCBPPPCTZMX-QAPCUYQASA-N 1 2 323.440 4.210 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](Cc2ccccc2)c2nccn2C)oc1C ZINC000652275614 1047352940 /nfs/dbraw/zinc/35/29/40/1047352940.db2.gz SJLZKBKIJIYELU-MAUKXSAKSA-N 1 2 323.440 4.265 20 0 DIADLO CC(C)(C)c1ccncc1C[NH2+]Cc1occc1Br ZINC000840957778 1047362834 /nfs/dbraw/zinc/36/28/34/1047362834.db2.gz GBKAVELOXBIMGS-UHFFFAOYSA-N 1 2 323.234 4.024 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2c3cccc(F)c3CC[C@H]2C)c1 ZINC000652330670 1047356086 /nfs/dbraw/zinc/35/60/86/1047356086.db2.gz MKNFJZJUFNPENZ-KZULUSFZSA-N 1 2 300.377 4.103 20 0 DIADLO CCCCCCOc1cccc(C[NH2+][C@@H](C)c2csnn2)c1 ZINC000840970937 1047364989 /nfs/dbraw/zinc/36/49/89/1047364989.db2.gz YMVQOPXUKLJVFP-AWEZNQCLSA-N 1 2 319.474 4.348 20 0 DIADLO CCCCc1nc(COc2cc(C)[nH+]c3c(C)cccc23)no1 ZINC000537542870 1047368371 /nfs/dbraw/zinc/36/83/71/1047368371.db2.gz DZICWLGTAKAJAQ-UHFFFAOYSA-N 1 2 311.385 4.156 20 0 DIADLO Fc1ccc(Br)c(Cl)c1C[N@@H+]1CCC2(CC2)C1 ZINC001142080744 1047368613 /nfs/dbraw/zinc/36/86/13/1047368613.db2.gz MJFXDKRCQJORLK-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO Fc1ccc(Br)c(Cl)c1C[N@H+]1CCC2(CC2)C1 ZINC001142080744 1047368623 /nfs/dbraw/zinc/36/86/23/1047368623.db2.gz MJFXDKRCQJORLK-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO CCCCc1noc(C[N@H+](CC)[C@@H](C)c2cccc(OC)c2)n1 ZINC000045806263 1047379375 /nfs/dbraw/zinc/37/93/75/1047379375.db2.gz CLJFCVZOHJSKGI-AWEZNQCLSA-N 1 2 317.433 4.004 20 0 DIADLO CCCCc1noc(C[N@@H+](CC)[C@@H](C)c2cccc(OC)c2)n1 ZINC000045806263 1047379388 /nfs/dbraw/zinc/37/93/88/1047379388.db2.gz CLJFCVZOHJSKGI-AWEZNQCLSA-N 1 2 317.433 4.004 20 0 DIADLO CCCCc1noc(C[N@H+](CC)[C@H](C)c2cccc(OC)c2)n1 ZINC000045806267 1047379698 /nfs/dbraw/zinc/37/96/98/1047379698.db2.gz CLJFCVZOHJSKGI-CQSZACIVSA-N 1 2 317.433 4.004 20 0 DIADLO CCCCc1noc(C[N@@H+](CC)[C@H](C)c2cccc(OC)c2)n1 ZINC000045806267 1047379706 /nfs/dbraw/zinc/37/97/06/1047379706.db2.gz CLJFCVZOHJSKGI-CQSZACIVSA-N 1 2 317.433 4.004 20 0 DIADLO Clc1ccccc1-c1ccc(C[N@@H+]2CCn3nccc3C2)cc1 ZINC001142101903 1047380691 /nfs/dbraw/zinc/38/06/91/1047380691.db2.gz KWQNALGTPYZTCX-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Clc1ccccc1-c1ccc(C[N@H+]2CCn3nccc3C2)cc1 ZINC001142101903 1047380699 /nfs/dbraw/zinc/38/06/99/1047380699.db2.gz KWQNALGTPYZTCX-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Oc1cc(Cl)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)c(Cl)c1 ZINC001142114267 1047383953 /nfs/dbraw/zinc/38/39/53/1047383953.db2.gz DKFZCSHZMVGFHP-MRXNPFEDSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1cc(Cl)c(C[N@H+]2CCC[C@@H]2c2ccncc2)c(Cl)c1 ZINC001142114267 1047383958 /nfs/dbraw/zinc/38/39/58/1047383958.db2.gz DKFZCSHZMVGFHP-MRXNPFEDSA-N 1 2 323.223 4.431 20 0 DIADLO C/C(=C\c1ccc(F)cc1)C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000749341482 1047411890 /nfs/dbraw/zinc/41/18/90/1047411890.db2.gz GVBFTFFGBOVAJX-WYMLVPIESA-N 1 2 321.355 4.053 20 0 DIADLO CC(C)(C)c1nc[nH]c1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001142235570 1047412126 /nfs/dbraw/zinc/41/21/26/1047412126.db2.gz ZNPBNZLGSLMJGT-INIZCTEOSA-N 1 2 319.399 4.323 20 0 DIADLO CC(C)(C)c1nc[nH]c1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001142235570 1047412132 /nfs/dbraw/zinc/41/21/32/1047412132.db2.gz ZNPBNZLGSLMJGT-INIZCTEOSA-N 1 2 319.399 4.323 20 0 DIADLO CC(C)(C)c1nc[nH]c1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001142235571 1047412325 /nfs/dbraw/zinc/41/23/25/1047412325.db2.gz ZNPBNZLGSLMJGT-MRXNPFEDSA-N 1 2 319.399 4.323 20 0 DIADLO CC(C)(C)c1nc[nH]c1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001142235571 1047412330 /nfs/dbraw/zinc/41/23/30/1047412330.db2.gz ZNPBNZLGSLMJGT-MRXNPFEDSA-N 1 2 319.399 4.323 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H](C)C3CCCC3)c2)[nH+]c1C ZINC000749355820 1047413965 /nfs/dbraw/zinc/41/39/65/1047413965.db2.gz TZQONCIICNCISS-LBPRGKRZSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1ccc(F)c(C[NH2+][C@@H](COCC(C)C)c2ccco2)c1 ZINC000116915731 1047416070 /nfs/dbraw/zinc/41/60/70/1047416070.db2.gz KTGIIASBKRDLFG-KRWDZBQOSA-N 1 2 305.393 4.231 20 0 DIADLO C[C@@]1([NH2+]Cc2nc(C3CCCC3)no2)CCCc2ccccc21 ZINC000537605943 1047421474 /nfs/dbraw/zinc/42/14/74/1047421474.db2.gz VEDSDEQWSYQYJF-LJQANCHMSA-N 1 2 311.429 4.069 20 0 DIADLO CCO[C@H]1CCC[N@H+](Cc2c(Cl)cc(OC)cc2Cl)C1 ZINC001142292956 1047424124 /nfs/dbraw/zinc/42/41/24/1047424124.db2.gz KKMWQADKDFPXHT-NSHDSACASA-N 1 2 318.244 4.003 20 0 DIADLO CCO[C@H]1CCC[N@@H+](Cc2c(Cl)cc(OC)cc2Cl)C1 ZINC001142292956 1047424129 /nfs/dbraw/zinc/42/41/29/1047424129.db2.gz KKMWQADKDFPXHT-NSHDSACASA-N 1 2 318.244 4.003 20 0 DIADLO COCC[C@@H](c1ccccc1)[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653832092 1047425232 /nfs/dbraw/zinc/42/52/32/1047425232.db2.gz WBVGGYSJGVIHMP-SFHVURJKSA-N 1 2 303.352 4.058 20 0 DIADLO FC(F)COc1ccc(CNc2c[nH+]cc3c2CCCC3)cc1 ZINC001203119642 1047427703 /nfs/dbraw/zinc/42/77/03/1047427703.db2.gz SPFJWRKAHPWMDL-UHFFFAOYSA-N 1 2 318.367 4.216 20 0 DIADLO CC(C)C[C@H](C(=O)N(C1CC1)C1CCC(C)CC1)n1cc[nH+]c1 ZINC001142428539 1047446026 /nfs/dbraw/zinc/44/60/26/1047446026.db2.gz RGGYJBDIVWVWKU-LEOMRAHMSA-N 1 2 317.477 4.040 20 0 DIADLO CC1(C)C(=O)N(C[N@@H+]2CC[C@H]2c2ccccc2)[C@@H]1c1ccccc1 ZINC000749940230 1047450325 /nfs/dbraw/zinc/45/03/25/1047450325.db2.gz YCTMCDTYOUSHLY-RBUKOAKNSA-N 1 2 320.436 4.001 20 0 DIADLO CC1(C)C(=O)N(C[N@H+]2CC[C@H]2c2ccccc2)[C@@H]1c1ccccc1 ZINC000749940230 1047450333 /nfs/dbraw/zinc/45/03/33/1047450333.db2.gz YCTMCDTYOUSHLY-RBUKOAKNSA-N 1 2 320.436 4.001 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(OC2CCCC2)c(Cl)c1 ZINC000841849295 1047459293 /nfs/dbraw/zinc/45/92/93/1047459293.db2.gz HHVTVNMTBZTKCN-UHFFFAOYSA-N 1 2 319.836 4.490 20 0 DIADLO FC1(F)CC[NH+](Cc2cc(-c3ccccc3Cl)on2)CC1 ZINC000842159664 1047470974 /nfs/dbraw/zinc/47/09/74/1047470974.db2.gz SFVNHMQGOLEQJQ-UHFFFAOYSA-N 1 2 312.747 4.226 20 0 DIADLO Cc1cn2cc(NC(=O)c3cccc(-c4ccoc4)c3)ccc2[nH+]1 ZINC000089790792 1047489958 /nfs/dbraw/zinc/48/99/58/1047489958.db2.gz XNUKLDJQOAFAQE-UHFFFAOYSA-N 1 2 317.348 4.155 20 0 DIADLO CCO[C@H](C)c1noc(C[NH2+][C@H](c2ccccc2)C(C)(C)C)n1 ZINC000120510977 1047493591 /nfs/dbraw/zinc/49/35/91/1047493591.db2.gz JWCTYHYHPMYLKN-CZUORRHYSA-N 1 2 317.433 4.044 20 0 DIADLO C[C@@H](SCCn1cc[nH+]c1)c1ccc(OC(F)(F)F)cc1 ZINC000090201242 1047500107 /nfs/dbraw/zinc/50/01/07/1047500107.db2.gz ZFKRJSQDWRKYNF-LLVKDONJSA-N 1 2 316.348 4.276 20 0 DIADLO Clc1cc(Cl)cc(OCCSCCn2cc[nH+]c2)c1 ZINC000090201636 1047500287 /nfs/dbraw/zinc/50/02/87/1047500287.db2.gz LTXOCNBQMOUQCM-UHFFFAOYSA-N 1 2 317.241 4.002 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccccn2)s1 ZINC000090399680 1047501988 /nfs/dbraw/zinc/50/19/88/1047501988.db2.gz YZJFFSVCBOMSOT-FZKQIMNGSA-N 1 2 309.438 4.287 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cc(F)cc(F)c1 ZINC000120821972 1047503686 /nfs/dbraw/zinc/50/36/86/1047503686.db2.gz OLNHAMHIXYGKCP-LBPRGKRZSA-N 1 2 303.356 4.133 20 0 DIADLO C[C@@H]([NH2+][C@H](c1cccc(F)c1)c1ccccn1)c1ccncc1 ZINC000090955970 1047513174 /nfs/dbraw/zinc/51/31/74/1047513174.db2.gz AQHUHEYKCRDHJW-AUUYWEPGSA-N 1 2 307.372 4.056 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@@H](C)c2ccccn2)c2ccccn2)c1 ZINC000090946164 1047513986 /nfs/dbraw/zinc/51/39/86/1047513986.db2.gz WNVHKVCPSAJYTM-JXFKEZNVSA-N 1 2 303.409 4.225 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1cnc(C2CC2)s1 ZINC000121220202 1047514994 /nfs/dbraw/zinc/51/49/94/1047514994.db2.gz RGKQEVHKFUGTNJ-UHFFFAOYSA-N 1 2 322.861 4.315 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1cnc(C2CC2)s1 ZINC000121220202 1047515001 /nfs/dbraw/zinc/51/50/01/1047515001.db2.gz RGKQEVHKFUGTNJ-UHFFFAOYSA-N 1 2 322.861 4.315 20 0 DIADLO CC(C)C[C@H](C)Oc1cc(C[NH2+][C@@H](C)c2nccs2)ccn1 ZINC000091723133 1047521241 /nfs/dbraw/zinc/52/12/41/1047521241.db2.gz KAHPEEAPFOXLGD-KBPBESRZSA-N 1 2 319.474 4.202 20 0 DIADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1cnc(C2CCCC2)s1 ZINC000091930664 1047524239 /nfs/dbraw/zinc/52/42/39/1047524239.db2.gz KJRWSGJXDNHBBR-UHFFFAOYSA-N 1 2 323.893 4.425 20 0 DIADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1cnc(C2CCCC2)s1 ZINC000091930664 1047524246 /nfs/dbraw/zinc/52/42/46/1047524246.db2.gz KJRWSGJXDNHBBR-UHFFFAOYSA-N 1 2 323.893 4.425 20 0 DIADLO CCN(Cc1ccc2[nH+]ccn2c1)Cc1c(F)cccc1Cl ZINC001143033730 1047527392 /nfs/dbraw/zinc/52/73/92/1047527392.db2.gz FUBZIWWKCSCFHZ-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO COCC[N@H+](Cc1ccco1)Cc1cnc(C2CCCC2)s1 ZINC000092561766 1047536202 /nfs/dbraw/zinc/53/62/02/1047536202.db2.gz CQFPLEPQXDNUJO-UHFFFAOYSA-N 1 2 320.458 4.042 20 0 DIADLO COCC[N@@H+](Cc1ccco1)Cc1cnc(C2CCCC2)s1 ZINC000092561766 1047536207 /nfs/dbraw/zinc/53/62/07/1047536207.db2.gz CQFPLEPQXDNUJO-UHFFFAOYSA-N 1 2 320.458 4.042 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c(F)c1F ZINC001143276632 1047546799 /nfs/dbraw/zinc/54/67/99/1047546799.db2.gz RMLDGIIFTAFOPC-LLVKDONJSA-N 1 2 323.305 4.138 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)c(F)c1F ZINC001143276632 1047546805 /nfs/dbraw/zinc/54/68/05/1047546805.db2.gz RMLDGIIFTAFOPC-LLVKDONJSA-N 1 2 323.305 4.138 20 0 DIADLO CC(=O)[C@@H]1CCC[N@H+](Cc2c(Cl)cccc2C(F)(F)F)C1 ZINC001143288372 1047548687 /nfs/dbraw/zinc/54/86/87/1047548687.db2.gz GDHHWEQOFXCNSK-LLVKDONJSA-N 1 2 319.754 4.160 20 0 DIADLO CC(=O)[C@@H]1CCC[N@@H+](Cc2c(Cl)cccc2C(F)(F)F)C1 ZINC001143288372 1047548690 /nfs/dbraw/zinc/54/86/90/1047548690.db2.gz GDHHWEQOFXCNSK-LLVKDONJSA-N 1 2 319.754 4.160 20 0 DIADLO Fc1c(C[NH2+]C2(c3ccccc3Cl)CC2)ccnc1Cl ZINC000843419554 1047548711 /nfs/dbraw/zinc/54/87/11/1047548711.db2.gz XQJPLTDSUMRJFC-UHFFFAOYSA-N 1 2 311.187 4.306 20 0 DIADLO CCC[C@@](C)(CC)C(=O)N1CCC(CCCn2cc[nH+]c2)CC1 ZINC000476633354 1047560270 /nfs/dbraw/zinc/56/02/70/1047560270.db2.gz RFBKJVVDEJTLDU-LJQANCHMSA-N 1 2 319.493 4.118 20 0 DIADLO CCC[C@@](C)(CC)C(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000476688893 1047565672 /nfs/dbraw/zinc/56/56/72/1047565672.db2.gz ACYOYGVAUQXZOJ-CRAIPNDOSA-N 1 2 322.518 4.170 20 0 DIADLO Cc1c[nH+]c2c(c1)N(C(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1)CCN2 ZINC001150485959 1047577605 /nfs/dbraw/zinc/57/76/05/1047577605.db2.gz MIXUMNYZTIEDMD-UKRRQHHQSA-N 1 2 315.461 4.001 20 0 DIADLO COc1c(Br)cccc1Nc1ccc(C)[nH+]c1C ZINC001203376068 1047610706 /nfs/dbraw/zinc/61/07/06/1047610706.db2.gz IYCGXHCUBLNREN-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1ccc(Nc2cc(Br)c(C)cc2O)c(C)[nH+]1 ZINC001203375888 1047610968 /nfs/dbraw/zinc/61/09/68/1047610968.db2.gz FFGXEEKHNNVOCO-UHFFFAOYSA-N 1 2 307.191 4.219 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](c2ccccc2)c2cccc(F)c2)nn1C ZINC000282082628 1047620546 /nfs/dbraw/zinc/62/05/46/1047620546.db2.gz HQQONMYJXVSFQJ-FOIQADDNSA-N 1 2 323.415 4.308 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C(C)(C)C3CCC3)cc2)[nH+]c1C ZINC001153556341 1047627708 /nfs/dbraw/zinc/62/77/08/1047627708.db2.gz OSGPTLCPUCLZES-UHFFFAOYSA-N 1 2 311.429 4.458 20 0 DIADLO CC(C)C[C@@H](C(=O)NCC[C@H](C)CC(C)(C)C)n1cc[nH+]c1 ZINC001154338603 1047645509 /nfs/dbraw/zinc/64/55/09/1047645509.db2.gz BBLVRMTZVUBLFU-HOTGVXAUSA-N 1 2 307.482 4.049 20 0 DIADLO Cc1ccc2ccccc2c1NC(=O)c1cccc2[nH+]ccn21 ZINC001154517315 1047650208 /nfs/dbraw/zinc/65/02/08/1047650208.db2.gz GCDUHZKRUPFATA-UHFFFAOYSA-N 1 2 301.349 4.048 20 0 DIADLO C[C@H](Nc1[nH+]ccc2cc(Cl)ccc21)c1nnc2ccccn21 ZINC001154806663 1047658217 /nfs/dbraw/zinc/65/82/17/1047658217.db2.gz BDYUCIADEOTCOB-NSHDSACASA-N 1 2 323.787 4.104 20 0 DIADLO CC[C@H](C)[C@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000538192993 1047662660 /nfs/dbraw/zinc/66/26/60/1047662660.db2.gz NXFGWKJHTTWHPV-ZBEGNZNMSA-N 1 2 319.836 4.477 20 0 DIADLO CC(=O)c1ccc2c(c1)CN(c1[nH+]ccc3ccccc31)CC2 ZINC001155063139 1047666840 /nfs/dbraw/zinc/66/68/40/1047666840.db2.gz MRBJARXBZBPEFR-UHFFFAOYSA-N 1 2 302.377 4.000 20 0 DIADLO Cc1ccc2c(c1)[C@@H](Nc1[nH+]ccc3cc(Cl)ccc31)C(=O)N2 ZINC001155109113 1047667873 /nfs/dbraw/zinc/66/78/73/1047667873.db2.gz ZXVLSXHIEVXXQP-MRXNPFEDSA-N 1 2 323.783 4.302 20 0 DIADLO Cc1cc(C)c(CNc2[nH+]ccc3cc(Cl)ccc32)c(=O)[nH]1 ZINC001155131512 1047668737 /nfs/dbraw/zinc/66/87/37/1047668737.db2.gz TUYQHBIJMZFPAS-UHFFFAOYSA-N 1 2 313.788 4.218 20 0 DIADLO Cc1cc(C)c(CNc2cc(-c3ccccc3)cc[nH+]2)c(=O)[nH]1 ZINC001155131312 1047668759 /nfs/dbraw/zinc/66/87/59/1047668759.db2.gz NQECADXNFXCJEH-UHFFFAOYSA-N 1 2 305.381 4.078 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)CCCSC(C)(C)C)[nH+]c1C ZINC001155173811 1047670075 /nfs/dbraw/zinc/67/00/75/1047670075.db2.gz HWXNAIQDEXGXEE-CQSZACIVSA-N 1 2 323.506 4.002 20 0 DIADLO COc1ccc(Oc2cc(NC(=[NH2+])C(C)(C)C)nc(C)n2)cc1 ZINC001155181224 1047670957 /nfs/dbraw/zinc/67/09/57/1047670957.db2.gz BQTMVGSGQSTWKY-UHFFFAOYSA-N 1 2 314.389 4.021 20 0 DIADLO CCc1noc(C[NH2+][C@H](c2ccc(CC(C)C)cc2)C2CC2)n1 ZINC000152585954 1047671062 /nfs/dbraw/zinc/67/10/62/1047671062.db2.gz QAMNOYPJFFWCJA-LJQANCHMSA-N 1 2 313.445 4.071 20 0 DIADLO COc1ccc(CCNc2cc(C)c3cccc(C)c3[nH+]2)cc1O ZINC001155881474 1047690725 /nfs/dbraw/zinc/69/07/25/1047690725.db2.gz DXYTUKQTENYWRG-UHFFFAOYSA-N 1 2 322.408 4.220 20 0 DIADLO COC(OC)c1cc(C)c[nH+]c1NCc1ccc(C(C)C)cc1 ZINC001155947831 1047692372 /nfs/dbraw/zinc/69/23/72/1047692372.db2.gz APSABYZQQJTLGK-UHFFFAOYSA-N 1 2 314.429 4.417 20 0 DIADLO C[C@H]1CCc2nnc(NC(=[NH2+])C34CC5CC(CC(C5)C3)C4)cc2C1 ZINC001155962490 1047693498 /nfs/dbraw/zinc/69/34/98/1047693498.db2.gz PRUJKYHOCTWZDH-PGBBXINNSA-N 1 2 324.472 4.207 20 0 DIADLO CC(C)(C)c1ccc(NC(=[NH2+])C23CC4CC(CC(C4)C2)C3)nn1 ZINC001155962446 1047693665 /nfs/dbraw/zinc/69/36/65/1047693665.db2.gz NPZBIKDNKMPYAS-UHFFFAOYSA-N 1 2 312.461 4.380 20 0 DIADLO c1ccc2c(c1)OCCC[C@@H]2Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000538637927 1047693961 /nfs/dbraw/zinc/69/39/61/1047693961.db2.gz OAVAAOPLGRKBKU-SFHVURJKSA-N 1 2 323.440 4.398 20 0 DIADLO CC/C=C(/F)C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC001155970812 1047694346 /nfs/dbraw/zinc/69/43/46/1047694346.db2.gz PIVJKNOXLNPGKF-OMCISZLKSA-N 1 2 313.376 4.088 20 0 DIADLO CCC1(CC)CCCN(C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000667119404 1047695620 /nfs/dbraw/zinc/69/56/20/1047695620.db2.gz RYIVRFGMDKZTJF-UHFFFAOYSA-N 1 2 303.450 4.441 20 0 DIADLO Fc1ccccc1OCCNc1cc(-c2ccccc2)cc[nH+]1 ZINC001156020305 1047696488 /nfs/dbraw/zinc/69/64/88/1047696488.db2.gz WGUJXMLGLKKBPR-UHFFFAOYSA-N 1 2 308.356 4.379 20 0 DIADLO COc1ccc2[nH+]c(N3CCC[C@@H]3c3ccccn3)cc(C)c2c1 ZINC001156027667 1047697333 /nfs/dbraw/zinc/69/73/33/1047697333.db2.gz ZEKMHPOMNQCECP-LJQANCHMSA-N 1 2 319.408 4.288 20 0 DIADLO Cc1cc(N[C@@H](c2ccccc2)c2ccncc2)nc(C2CC2)[nH+]1 ZINC001156094912 1047699762 /nfs/dbraw/zinc/69/97/62/1047699762.db2.gz GUFOIIBLSVTILR-IBGZPJMESA-N 1 2 316.408 4.259 20 0 DIADLO C[C@@H]1c2c(F)cccc2CC[N@H+]1Cc1cnc(C2CC2)s1 ZINC000538728096 1047702138 /nfs/dbraw/zinc/70/21/38/1047702138.db2.gz VDQSKEKWYHAJSR-LLVKDONJSA-N 1 2 302.418 4.279 20 0 DIADLO C[C@@H]1c2c(F)cccc2CC[N@@H+]1Cc1cnc(C2CC2)s1 ZINC000538728096 1047702141 /nfs/dbraw/zinc/70/21/41/1047702141.db2.gz VDQSKEKWYHAJSR-LLVKDONJSA-N 1 2 302.418 4.279 20 0 DIADLO CNc1ccc(CNc2cc(-c3ccnc(Cl)c3)cc[nH+]2)cc1 ZINC001156135272 1047702175 /nfs/dbraw/zinc/70/21/75/1047702175.db2.gz UFDWSALRVWYWHW-UHFFFAOYSA-N 1 2 324.815 4.451 20 0 DIADLO CC(=O)c1c(Br)cccc1Nc1ccc(C)[nH+]c1C ZINC001203376830 1047709102 /nfs/dbraw/zinc/70/91/02/1047709102.db2.gz TWNABENOCDAAMI-UHFFFAOYSA-N 1 2 319.202 4.407 20 0 DIADLO CCOc1ccccc1C[N@@H+]1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC000538752853 1047709253 /nfs/dbraw/zinc/70/92/53/1047709253.db2.gz REJWCOIALWAZQE-KBXCAEBGSA-N 1 2 317.454 4.109 20 0 DIADLO CCOc1ccccc1C[N@H+]1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC000538752853 1047709256 /nfs/dbraw/zinc/70/92/56/1047709256.db2.gz REJWCOIALWAZQE-KBXCAEBGSA-N 1 2 317.454 4.109 20 0 DIADLO Clc1cc(-c2cc[nH+]c(NCCCc3ccncc3)c2)ccn1 ZINC001156406957 1047710001 /nfs/dbraw/zinc/71/00/01/1047710001.db2.gz KJOKZEGINPEXQT-UHFFFAOYSA-N 1 2 324.815 4.237 20 0 DIADLO CSCc1ccc(NC2CCC(C(F)(F)F)CC2)[nH+]c1 ZINC001156413949 1047710733 /nfs/dbraw/zinc/71/07/33/1047710733.db2.gz KGXJAKVAXOALJM-UHFFFAOYSA-N 1 2 304.381 4.478 20 0 DIADLO CC(C)c1ccc(N2CCOC[C@@H]2c2ccc(Cl)cc2)[nH+]c1 ZINC001156728286 1047721156 /nfs/dbraw/zinc/72/11/56/1047721156.db2.gz QXZQXNJQRVIJIB-QGZVFWFLSA-N 1 2 316.832 4.436 20 0 DIADLO Nc1cc(CNc2ccc3c(Cl)ccc(Cl)c3n2)cc[nH+]1 ZINC001156763999 1047722050 /nfs/dbraw/zinc/72/20/50/1047722050.db2.gz NJBLYGNUYUOGIL-UHFFFAOYSA-N 1 2 319.195 4.131 20 0 DIADLO Cc1cc(CNc2cc(SCc3ccccc3)cc[nH+]2)nn1C ZINC001156953382 1047730519 /nfs/dbraw/zinc/73/05/19/1047730519.db2.gz FJBSXTHLUQQYTM-UHFFFAOYSA-N 1 2 324.453 4.028 20 0 DIADLO CC(C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)c(F)c2)[nH]1 ZINC000539047218 1047732105 /nfs/dbraw/zinc/73/21/05/1047732105.db2.gz UFOKYNDLINKIAU-VHSXEESVSA-N 1 2 310.804 4.132 20 0 DIADLO Nc1ccc2c(c1)CN(c1[nH+]ccc3cc(Cl)ccc31)CC2 ZINC001157219021 1047737777 /nfs/dbraw/zinc/73/77/77/1047737777.db2.gz LPDWXHUHYJIHJQ-UHFFFAOYSA-N 1 2 309.800 4.033 20 0 DIADLO FC(F)(F)c1n[nH]c2c1CCN(c1[nH+]ccc3ccccc31)C2 ZINC001157341448 1047739765 /nfs/dbraw/zinc/73/97/65/1047739765.db2.gz FHYAMZJHZCZYAJ-AWEZNQCLSA-N 1 2 318.302 4.096 20 0 DIADLO CC(C)(C)c1ccc(N2CCc3c([nH]nc3C(F)(F)F)C2)[nH+]c1 ZINC001157351314 1047739860 /nfs/dbraw/zinc/73/98/60/1047739860.db2.gz VGGMEGISPZJNCV-CQSZACIVSA-N 1 2 324.350 4.240 20 0 DIADLO FC(F)(F)c1n[nH]c2c1CCN(c1cc3ccccc3c[nH+]1)C2 ZINC001157341402 1047740259 /nfs/dbraw/zinc/74/02/59/1047740259.db2.gz DFCAGXNOUBCBSM-HNNXBMFYSA-N 1 2 318.302 4.096 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@@H](c2ccccn2)C(F)(F)F)[nH+]1 ZINC001157684282 1047748947 /nfs/dbraw/zinc/74/89/47/1047748947.db2.gz MBMFJDCJQYAKLI-LBPRGKRZSA-N 1 2 315.726 4.462 20 0 DIADLO COc1cccc(C(F)(F)F)c1CNc1[nH+]ccc(F)c1C ZINC001157693518 1047749814 /nfs/dbraw/zinc/74/98/14/1047749814.db2.gz QDGQGVGUHXALCX-UHFFFAOYSA-N 1 2 314.282 4.169 20 0 DIADLO CCc1ccc(C(C)(C)[NH2+]Cc2nc(CCC(C)C)no2)cc1 ZINC000539359443 1047749899 /nfs/dbraw/zinc/74/98/99/1047749899.db2.gz CUBRGDFNAQHGLW-UHFFFAOYSA-N 1 2 315.461 4.246 20 0 DIADLO Nc1ccc(C2CCN(c3[nH+]ccc4ccccc43)CC2)cc1 ZINC001157699443 1047749895 /nfs/dbraw/zinc/74/98/95/1047749895.db2.gz UHBLPGYOWFOEHS-UHFFFAOYSA-N 1 2 303.409 4.201 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H]3CCCc4cccnc43)cc(C)c2c1 ZINC001157842894 1047758672 /nfs/dbraw/zinc/75/86/72/1047758672.db2.gz JZMWLVVCRMEQCF-GOSISDBHSA-N 1 2 319.408 4.436 20 0 DIADLO COC(=O)c1c(F)ccc(Nc2ccc(C)[nH+]c2C)c1Cl ZINC001203380066 1047760057 /nfs/dbraw/zinc/76/00/57/1047760057.db2.gz GVDPKDXQHRWDQB-UHFFFAOYSA-N 1 2 308.740 4.021 20 0 DIADLO CC[C@@H](C)c1cc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)on1 ZINC000478000351 1047763176 /nfs/dbraw/zinc/76/31/76/1047763176.db2.gz IMNILXRLWWVVIP-LLVKDONJSA-N 1 2 324.384 4.139 20 0 DIADLO COc1ccc2ccc(NCCCCc3ccccn3)[nH+]c2c1 ZINC001157972704 1047765183 /nfs/dbraw/zinc/76/51/83/1047765183.db2.gz OBOAMMWLZZUTRK-UHFFFAOYSA-N 1 2 307.397 4.073 20 0 DIADLO COc1cc2ccc(N[C@H](C)c3ccc(C)cn3)[nH+]c2cc1OC ZINC001158019651 1047767454 /nfs/dbraw/zinc/76/74/54/1047767454.db2.gz ICGAJEOSAIACIM-CYBMUJFWSA-N 1 2 323.396 4.129 20 0 DIADLO COc1ccc2[nH+]c(NCCCc3ccc(C)nc3)c(C)cc2c1 ZINC001158372509 1047776815 /nfs/dbraw/zinc/77/68/15/1047776815.db2.gz YKXPVPGSBLBFKU-UHFFFAOYSA-N 1 2 321.424 4.300 20 0 DIADLO CCCOc1cccc2c(N[C@@H](CO)c3ccccc3)cc[nH+]c12 ZINC000478301904 1047779949 /nfs/dbraw/zinc/77/99/49/1047779949.db2.gz KINNGULUUSQQSO-SFHVURJKSA-N 1 2 322.408 4.169 20 0 DIADLO Cc1c(F)cc[nH+]c1N[C@@H](CCO)c1cccc2ccccc21 ZINC001158510049 1047788239 /nfs/dbraw/zinc/78/82/39/1047788239.db2.gz TVRPVBCHVCQPHU-SFHVURJKSA-N 1 2 310.372 4.218 20 0 DIADLO COC(=O)c1ccc([C@H]2CCCN2c2ccc(C(C)C)c[nH+]2)cc1 ZINC001158595813 1047789695 /nfs/dbraw/zinc/78/96/95/1047789695.db2.gz XKLLHIXRYXIAGD-GOSISDBHSA-N 1 2 324.424 4.333 20 0 DIADLO Cc1cc(N2CCc3cc(F)c(F)cc3C2)[nH+]c2ccccc12 ZINC001158807673 1047799763 /nfs/dbraw/zinc/79/97/63/1047799763.db2.gz NZUOTGSRPVPALJ-UHFFFAOYSA-N 1 2 310.347 4.384 20 0 DIADLO Cc1c(F)cc[nH+]c1N1CCC[C@]2(CCc3c2cccc3F)C1 ZINC001158841530 1047801913 /nfs/dbraw/zinc/80/19/13/1047801913.db2.gz BOEPYCILZQXGQX-IBGZPJMESA-N 1 2 314.379 4.153 20 0 DIADLO Cc1c(F)cc[nH+]c1N1Cc2nc(-c3ccccc3)sc2C1 ZINC001158984785 1047806399 /nfs/dbraw/zinc/80/63/99/1047806399.db2.gz BSMIHHYPFSLSPM-UHFFFAOYSA-N 1 2 311.385 4.173 20 0 DIADLO COc1ccc(C)[nH+]c1N1Cc2nc(-c3ccccc3)sc2C1 ZINC001158985103 1047806881 /nfs/dbraw/zinc/80/68/81/1047806881.db2.gz HOJNOTWGCDXBDN-UHFFFAOYSA-N 1 2 323.421 4.042 20 0 DIADLO COc1c[nH+]c(NCc2ccccc2-c2cccnc2)c(C)c1 ZINC001159104553 1047811919 /nfs/dbraw/zinc/81/19/19/1047811919.db2.gz DHFHAOLVWJZWQF-UHFFFAOYSA-N 1 2 305.381 4.073 20 0 DIADLO COc1cc(C)c[nH+]c1NCc1ccccc1-c1cccnc1 ZINC001159107778 1047812800 /nfs/dbraw/zinc/81/28/00/1047812800.db2.gz QKWJQTYPFOPRJH-UHFFFAOYSA-N 1 2 305.381 4.073 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2c(Cl)cccc2Cl)c(C)[nH+]1 ZINC000097213708 1047824215 /nfs/dbraw/zinc/82/42/15/1047824215.db2.gz LJNSSXBNOQLTAH-UHFFFAOYSA-N 1 2 323.223 4.495 20 0 DIADLO Cc1nc(N2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)cc[nH+]1 ZINC000553244401 1047832827 /nfs/dbraw/zinc/83/28/27/1047832827.db2.gz VIVDGQHRWNQCSD-AWEZNQCLSA-N 1 2 321.346 4.188 20 0 DIADLO C[N@H+](Cc1nc(-c2ccccc2)c[nH]1)Cc1cccc(Cl)c1 ZINC000479072551 1047835949 /nfs/dbraw/zinc/83/59/49/1047835949.db2.gz BXDYDMNTYWVSKI-UHFFFAOYSA-N 1 2 311.816 4.362 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccccc2)c[nH]1)Cc1cccc(Cl)c1 ZINC000479072551 1047835958 /nfs/dbraw/zinc/83/59/58/1047835958.db2.gz BXDYDMNTYWVSKI-UHFFFAOYSA-N 1 2 311.816 4.362 20 0 DIADLO Cc1ccc([C@@H]2CCCN2c2cc(N3CCCC3)[nH+]cn2)cc1C ZINC000553330862 1047838467 /nfs/dbraw/zinc/83/84/67/1047838467.db2.gz LNCFFZMDUDUEJO-SFHVURJKSA-N 1 2 322.456 4.035 20 0 DIADLO Cc1ccc([C@@H]2CCCN2c2cc(N3CCCC3)nc[nH+]2)cc1C ZINC000553330862 1047838473 /nfs/dbraw/zinc/83/84/73/1047838473.db2.gz LNCFFZMDUDUEJO-SFHVURJKSA-N 1 2 322.456 4.035 20 0 DIADLO Fc1cccc(C(F)(F)C[NH2+]C2CC(c3ccccc3)C2)c1 ZINC001182780998 1047844845 /nfs/dbraw/zinc/84/48/45/1047844845.db2.gz HQVQNFWMZIONKV-UHFFFAOYSA-N 1 2 305.343 4.453 20 0 DIADLO COc1ccc(SCCNc2c[nH+]cc3c2CCCC3)cc1 ZINC001182844919 1047847676 /nfs/dbraw/zinc/84/76/76/1047847676.db2.gz OYYNSMWNAGNSNI-UHFFFAOYSA-N 1 2 314.454 4.173 20 0 DIADLO Nc1ccc2cc(Nc3cccc(-n4cc[nH+]c4)c3)ccc2c1 ZINC001159461124 1047850756 /nfs/dbraw/zinc/85/07/56/1047850756.db2.gz KPTOUSULFFDCLK-UHFFFAOYSA-N 1 2 300.365 4.351 20 0 DIADLO CCc1cc(-c2c[nH+]c(N3CCOCC3)c(C)c2)ccc1Cl ZINC001205808731 1047853522 /nfs/dbraw/zinc/85/35/22/1047853522.db2.gz YAARHNGEDXLMKD-UHFFFAOYSA-N 1 2 316.832 4.109 20 0 DIADLO Cc1cc2c(ccc(N)c2F)n1-c1ccc([NH+]2CCCC2)cc1 ZINC001174527957 1047857220 /nfs/dbraw/zinc/85/72/20/1047857220.db2.gz UTRLYWWGPHEWRH-UHFFFAOYSA-N 1 2 309.388 4.260 20 0 DIADLO O[C@@H]1CCCc2ccc(Nc3ccc([NH+]4CCCC4)cc3)cc21 ZINC001174529315 1047859270 /nfs/dbraw/zinc/85/92/70/1047859270.db2.gz GLKJSVIKSKTBJW-HXUWFJFHSA-N 1 2 308.425 4.400 20 0 DIADLO Cc1nc(CCNc2cc[nH+]c3c(Cl)cccc23)c(C)o1 ZINC000553481775 1047861342 /nfs/dbraw/zinc/86/13/42/1047861342.db2.gz MQZNBBBROJSXQM-UHFFFAOYSA-N 1 2 301.777 4.148 20 0 DIADLO Cc1cccc2c(C)cc(N[C@@H](C)[C@H](O)c3cccc(O)c3)[nH+]c12 ZINC001159581737 1047871709 /nfs/dbraw/zinc/87/17/09/1047871709.db2.gz JSYIRWOPCGHYPB-XOBRGWDASA-N 1 2 322.408 4.091 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1cnn(C2CCC2)c1 ZINC000924720690 1047880870 /nfs/dbraw/zinc/88/08/70/1047880870.db2.gz KFSLTCKIBBTRTC-VXGBXAGGSA-N 1 2 305.372 4.298 20 0 DIADLO CCCC(CCC)C(=O)N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC001183019176 1047881778 /nfs/dbraw/zinc/88/17/78/1047881778.db2.gz VSSQPKCXPZKARJ-OAHLLOKOSA-N 1 2 313.445 4.266 20 0 DIADLO Fc1cnc(Cl)cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523416 1047884174 /nfs/dbraw/zinc/88/41/74/1047884174.db2.gz MQTDVJGDFTXDJD-UHFFFAOYSA-N 1 2 306.772 4.003 20 0 DIADLO CN(c1ccc(N2CCCCC2)[nH+]c1)c1cc(Cl)ccc1N ZINC001174523369 1047885344 /nfs/dbraw/zinc/88/53/44/1047885344.db2.gz KBSCUJYQHIITLJ-UHFFFAOYSA-N 1 2 316.836 4.075 20 0 DIADLO O=c1[nH]cc(Nc2ccc(N3CCCCC3)[nH+]c2)c2ccccc12 ZINC001174523456 1047886018 /nfs/dbraw/zinc/88/60/18/1047886018.db2.gz ONIZICNSRQEFGR-UHFFFAOYSA-N 1 2 320.396 4.069 20 0 DIADLO CCOc1c(F)cccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174524642 1047886526 /nfs/dbraw/zinc/88/65/26/1047886526.db2.gz MDIPONUYWHLCIF-UHFFFAOYSA-N 1 2 315.392 4.353 20 0 DIADLO c1nc2cccc(Nc3ccc(N4CCCCC4)[nH+]c3)c2s1 ZINC001174525056 1047886829 /nfs/dbraw/zinc/88/68/29/1047886829.db2.gz WZEHGRHWKDBIMZ-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO O=C(c1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)cc1)C1CC1 ZINC001174525196 1047887524 /nfs/dbraw/zinc/88/75/24/1047887524.db2.gz RVCYRUJVPBKXDX-UHFFFAOYSA-N 1 2 321.424 4.408 20 0 DIADLO COC(=O)[C@@H]([NH2+]CC12CCC(CC1)C2)c1cccc2ccccc21 ZINC001197827923 1047890992 /nfs/dbraw/zinc/89/09/92/1047890992.db2.gz ZKRJAHJNDRWOBX-RNFHDMOYSA-N 1 2 323.436 4.224 20 0 DIADLO COc1ccc(Cn2cc(Nc3c[nH+]c(C)cc3C)c(C)n2)cc1 ZINC001174576385 1047892903 /nfs/dbraw/zinc/89/29/03/1047892903.db2.gz UCHYFWMOEVCJTH-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1[nH+]c2c(NC(=S)Nc3ccc(C)cc3)cccn2c1C ZINC001197905891 1047905576 /nfs/dbraw/zinc/90/55/76/1047905576.db2.gz IZMUJESXICMZEK-UHFFFAOYSA-N 1 2 310.426 4.068 20 0 DIADLO Cc1ccc(NC(=S)Nc2ccc(-n3cc[nH+]c3)cc2)c(C)c1 ZINC001197960070 1047908412 /nfs/dbraw/zinc/90/84/12/1047908412.db2.gz YXTNCIKIGNYEHB-UHFFFAOYSA-N 1 2 322.437 4.298 20 0 DIADLO Cc1cn2cc(NC(=S)Nc3ccc(C)cc3C)ccc2[nH+]1 ZINC001197966639 1047910019 /nfs/dbraw/zinc/91/00/19/1047910019.db2.gz JLXKTTOWPSAXLT-UHFFFAOYSA-N 1 2 310.426 4.068 20 0 DIADLO CCC[N@H+](Cc1ccccc1F)[C@H](C(=O)OC(C)(C)C)C1CC1 ZINC001174614750 1047926403 /nfs/dbraw/zinc/92/64/03/1047926403.db2.gz KEZNTEUBQDQDOB-KRWDZBQOSA-N 1 2 321.436 4.158 20 0 DIADLO CCC[N@@H+](Cc1ccccc1F)[C@H](C(=O)OC(C)(C)C)C1CC1 ZINC001174614750 1047926423 /nfs/dbraw/zinc/92/64/23/1047926423.db2.gz KEZNTEUBQDQDOB-KRWDZBQOSA-N 1 2 321.436 4.158 20 0 DIADLO Cc1csc2sc(C[N@@H+]3C[C@@H](C)CC[C@H]3C[NH3+])c(C)c12 ZINC001205827246 1047928249 /nfs/dbraw/zinc/92/82/49/1047928249.db2.gz GDPNZMBPDORKPO-GWCFXTLKSA-N 1 2 308.516 4.139 20 0 DIADLO Cc1csc2sc(C[N@H+]3C[C@@H](C)CC[C@H]3C[NH3+])c(C)c12 ZINC001205827246 1047928261 /nfs/dbraw/zinc/92/82/61/1047928261.db2.gz GDPNZMBPDORKPO-GWCFXTLKSA-N 1 2 308.516 4.139 20 0 DIADLO COc1cc(OC)cc([C@H](C)Nc2cc(C)[nH+]c(C(C)C)n2)c1 ZINC001159814726 1047930602 /nfs/dbraw/zinc/93/06/02/1047930602.db2.gz ABZGPGIIKJETJF-ZDUSSCGKSA-N 1 2 315.417 4.099 20 0 DIADLO CC[N@H+](Cc1cn(C2CCC2)nn1)Cc1ccc2ccccc2c1 ZINC000667515626 1047932377 /nfs/dbraw/zinc/93/23/77/1047932377.db2.gz HSNULYMWJMOHMW-UHFFFAOYSA-N 1 2 320.440 4.178 20 0 DIADLO CC[N@@H+](Cc1cn(C2CCC2)nn1)Cc1ccc2ccccc2c1 ZINC000667515626 1047932385 /nfs/dbraw/zinc/93/23/85/1047932385.db2.gz HSNULYMWJMOHMW-UHFFFAOYSA-N 1 2 320.440 4.178 20 0 DIADLO CCOC(=O)[C@H]1CCC[C@@H]1Nc1[nH+]ccc2cc(Cl)ccc21 ZINC001159830491 1047933465 /nfs/dbraw/zinc/93/34/65/1047933465.db2.gz RLOVZEWCLBXVEP-GJZGRUSLSA-N 1 2 318.804 4.032 20 0 DIADLO CN(c1ccc(Nc2ccc(N)cc2F)c[nH+]1)C1CCCCC1 ZINC001159837957 1047934929 /nfs/dbraw/zinc/93/49/29/1047934929.db2.gz WPXDSQKBXSLSJT-UHFFFAOYSA-N 1 2 314.408 4.315 20 0 DIADLO Cc1cc(NCc2sc(N3CCCC3)nc2Cl)c[nH+]c1C ZINC001183526255 1047935073 /nfs/dbraw/zinc/93/50/73/1047935073.db2.gz MGMUXQSGPXAOLP-UHFFFAOYSA-N 1 2 322.865 4.021 20 0 DIADLO Clc1cnn(C[NH+]2CCC(c3ccc(Cl)cc3)CC2)c1 ZINC000774638819 1047935924 /nfs/dbraw/zinc/93/59/24/1047935924.db2.gz XINQUBPWMXPBLB-UHFFFAOYSA-N 1 2 310.228 4.027 20 0 DIADLO Cc1cc(N[C@@H]2CCc3ccc(O)cc3C2)[nH+]c2ccccc12 ZINC001159892091 1047942500 /nfs/dbraw/zinc/94/25/00/1047942500.db2.gz AEVCGYTVODKCLD-MRXNPFEDSA-N 1 2 304.393 4.218 20 0 DIADLO CSCc1cc[nH+]c(N[C@@H](C)c2ccc(C(C)=O)cc2)c1 ZINC001159911586 1047946265 /nfs/dbraw/zinc/94/62/65/1047946265.db2.gz FTZZZQPOBAFXCA-LBPRGKRZSA-N 1 2 300.427 4.320 20 0 DIADLO Cc1[nH+]c2c(NC(=S)Nc3c(C)cccc3C)cccn2c1C ZINC001198333843 1047946874 /nfs/dbraw/zinc/94/68/74/1047946874.db2.gz SGZXSWPVAFISKW-UHFFFAOYSA-N 1 2 324.453 4.377 20 0 DIADLO c1c[nH+]c(Nc2ccc3c(c2)CCCO3)c(N2CCCCC2)c1 ZINC001174720989 1047955352 /nfs/dbraw/zinc/95/53/52/1047955352.db2.gz WYMQHSUVHJWPMJ-UHFFFAOYSA-N 1 2 309.413 4.141 20 0 DIADLO CC(C)(C)c1cccc(NC(=O)[C@@H]2CC[N@@H+]2Cc2ccccc2)c1 ZINC001183749586 1047963165 /nfs/dbraw/zinc/96/31/65/1047963165.db2.gz BSVAZDQLSSIGPI-IBGZPJMESA-N 1 2 322.452 4.197 20 0 DIADLO CC(C)(C)c1cccc(NC(=O)[C@@H]2CC[N@H+]2Cc2ccccc2)c1 ZINC001183749586 1047963172 /nfs/dbraw/zinc/96/31/72/1047963172.db2.gz BSVAZDQLSSIGPI-IBGZPJMESA-N 1 2 322.452 4.197 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@H+]1Cc1cnc2ccccc2c1 ZINC000794432901 1047965142 /nfs/dbraw/zinc/96/51/42/1047965142.db2.gz GOZXSSOUSZYCCQ-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@@H+]1Cc1cnc2ccccc2c1 ZINC000794432901 1047965152 /nfs/dbraw/zinc/96/51/52/1047965152.db2.gz GOZXSSOUSZYCCQ-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCOC[C@@]2(C)C2CC2)cc1Cl ZINC001198497821 1047966075 /nfs/dbraw/zinc/96/60/75/1047966075.db2.gz AIKQUTKDGCYSOZ-SFHVURJKSA-N 1 2 323.864 4.128 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCOC[C@@]2(C)C2CC2)cc1Cl ZINC001198497821 1047966083 /nfs/dbraw/zinc/96/60/83/1047966083.db2.gz AIKQUTKDGCYSOZ-SFHVURJKSA-N 1 2 323.864 4.128 20 0 DIADLO CNc1ccc(Nc2ccc(SC)c(Br)c2)c[nH+]1 ZINC001160006422 1047966327 /nfs/dbraw/zinc/96/63/27/1047966327.db2.gz WZSPAFKMKUMHER-UHFFFAOYSA-N 1 2 324.247 4.351 20 0 DIADLO Cc1cc(C)cc(C2CC[NH+]([C@H](C)c3csnn3)CC2)c1 ZINC001198478826 1047967254 /nfs/dbraw/zinc/96/72/54/1047967254.db2.gz KFLHJQCTXDCVAX-CQSZACIVSA-N 1 2 301.459 4.096 20 0 DIADLO COC(=O)[C@H]([NH2+][C@H](C)C1CCCC1)c1cccc2ccccc21 ZINC001183833466 1047970131 /nfs/dbraw/zinc/97/01/31/1047970131.db2.gz QIRHDCHLDJERNU-AUUYWEPGSA-N 1 2 311.425 4.222 20 0 DIADLO Cc1ccc(C)c(Cc2noc([C@@H](CC(C)C)n3cc[nH+]c3)n2)c1 ZINC000923810473 1047970324 /nfs/dbraw/zinc/97/03/24/1047970324.db2.gz MGRVLUMYBXNTPU-QGZVFWFLSA-N 1 2 324.428 4.109 20 0 DIADLO COC(=O)c1ccc(CNc2ccc3[nH+]c(C)cc(C)c3c2)cc1 ZINC001183823956 1047971754 /nfs/dbraw/zinc/97/17/54/1047971754.db2.gz WJKWQGRSOLLYIZ-UHFFFAOYSA-N 1 2 320.392 4.250 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc(OC(C)(C)C)cc3)cc2[nH+]1 ZINC000479781711 1047972429 /nfs/dbraw/zinc/97/24/29/1047972429.db2.gz UUAGJLWBTFMDLH-UHFFFAOYSA-N 1 2 323.396 4.301 20 0 DIADLO O=C(CC[N@@H+]1CCCn2c(cc3ccccc32)C1)c1ccccc1 ZINC000553983506 1047979945 /nfs/dbraw/zinc/97/99/45/1047979945.db2.gz MADGUJDOEMGIBZ-UHFFFAOYSA-N 1 2 318.420 4.120 20 0 DIADLO O=C(CC[N@H+]1CCCn2c(cc3ccccc32)C1)c1ccccc1 ZINC000553983506 1047979957 /nfs/dbraw/zinc/97/99/57/1047979957.db2.gz MADGUJDOEMGIBZ-UHFFFAOYSA-N 1 2 318.420 4.120 20 0 DIADLO COc1ccc2[nH+]c(N[C@H]3COCc4ccccc43)cc(C)c2c1 ZINC001160117005 1047980990 /nfs/dbraw/zinc/98/09/90/1047980990.db2.gz LPCYZKWJPXGQIX-IBGZPJMESA-N 1 2 320.392 4.235 20 0 DIADLO CN(c1ccc(Nc2ccc(N)c(F)c2)c[nH+]1)C1CCCCC1 ZINC001160208574 1047998192 /nfs/dbraw/zinc/99/81/92/1047998192.db2.gz PQOVQSDSTPLFKE-UHFFFAOYSA-N 1 2 314.408 4.315 20 0 DIADLO c1sc(C2CCCCC2)nc1C[N@@H+]1CCCC[C@]12CCOC2 ZINC001198770611 1048006005 /nfs/dbraw/zinc/00/60/05/1048006005.db2.gz SDNURLFZFFUSDK-GOSISDBHSA-N 1 2 320.502 4.336 20 0 DIADLO c1sc(C2CCCCC2)nc1C[N@H+]1CCCC[C@]12CCOC2 ZINC001198770611 1048006018 /nfs/dbraw/zinc/00/60/18/1048006018.db2.gz SDNURLFZFFUSDK-GOSISDBHSA-N 1 2 320.502 4.336 20 0 DIADLO C[C@H]([NH2+][C@H](CN(C)C)c1ccc(F)cc1)c1ccc(F)cc1F ZINC000554086568 1048006130 /nfs/dbraw/zinc/00/61/30/1048006130.db2.gz OAGNPFXTKVKKGQ-KPZWWZAWSA-N 1 2 322.374 4.057 20 0 DIADLO COc1ccc(Nc2ccc3c(C)cc[nH+]c3c2)c(OC)c1OC ZINC001174901425 1048017613 /nfs/dbraw/zinc/01/76/13/1048017613.db2.gz UJXDTAKEVRJWIO-UHFFFAOYSA-N 1 2 324.380 4.313 20 0 DIADLO COc1ccc(Nc2cccc3cc[nH+]cc32)c(OC)c1OC ZINC001174901912 1048018029 /nfs/dbraw/zinc/01/80/29/1048018029.db2.gz XOKILHBNVHSEGI-UHFFFAOYSA-N 1 2 310.353 4.004 20 0 DIADLO Cc1cc(Nc2cc(Br)ccc2N)ccc1[NH+](C)C ZINC001160278466 1048021092 /nfs/dbraw/zinc/02/10/92/1048021092.db2.gz LXDSJKQEFMADAS-UHFFFAOYSA-N 1 2 320.234 4.149 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1ccccc1C(C)(C)C)n1cc[nH+]c1 ZINC001174932087 1048036764 /nfs/dbraw/zinc/03/67/64/1048036764.db2.gz ZRAPGIWBSJGONC-KRWDZBQOSA-N 1 2 313.445 4.407 20 0 DIADLO CCOC(=O)CC(C)(C)CNc1[nH+]c2ccccc2n1C(C)C ZINC001184463096 1048043512 /nfs/dbraw/zinc/04/35/12/1048043512.db2.gz VXMYJLJULATPFJ-UHFFFAOYSA-N 1 2 317.433 4.009 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc(F)c(F)c2F)s1 ZINC000667615028 1048049189 /nfs/dbraw/zinc/04/91/89/1048049189.db2.gz DZLAJJRTRIQOFQ-SECBINFHSA-N 1 2 314.376 4.370 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccc(F)c(F)c2F)s1 ZINC000667615028 1048049195 /nfs/dbraw/zinc/04/91/95/1048049195.db2.gz DZLAJJRTRIQOFQ-SECBINFHSA-N 1 2 314.376 4.370 20 0 DIADLO CCOc1cc(F)cc(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001175005940 1048066436 /nfs/dbraw/zinc/06/64/36/1048066436.db2.gz GOZZBCFPBQJWAL-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO COc1ccc2[nH+]c(NCc3noc4ccccc34)c(C)cc2c1 ZINC001160582375 1048067852 /nfs/dbraw/zinc/06/78/52/1048067852.db2.gz VRVPNQCASKJWIA-UHFFFAOYSA-N 1 2 319.364 4.305 20 0 DIADLO Cc1cc(NCCOc2ccc(Cl)cc2)nc(C2CCC2)[nH+]1 ZINC001184625749 1048069950 /nfs/dbraw/zinc/06/99/50/1048069950.db2.gz VDNVMFPFYWKUOY-UHFFFAOYSA-N 1 2 317.820 4.197 20 0 DIADLO Cc1cc(N(C)Cc2nc3ccccc3s2)nc(C2CCC2)[nH+]1 ZINC001184644766 1048071807 /nfs/dbraw/zinc/07/18/07/1048071807.db2.gz TUHKTOUNYZLZKU-UHFFFAOYSA-N 1 2 324.453 4.299 20 0 DIADLO Cc1ccc(N(CCCn2cc[nH+]c2)Cc2cccs2)cc1 ZINC000775982298 1048074106 /nfs/dbraw/zinc/07/41/06/1048074106.db2.gz WYUXKXUVKXZIDO-UHFFFAOYSA-N 1 2 311.454 4.350 20 0 DIADLO Cc1csc2ncnc(N[C@@H](C)c3c[nH+]c4c(C)cccn34)c12 ZINC001160682835 1048078849 /nfs/dbraw/zinc/07/88/49/1048078849.db2.gz JQRYGBRGYLCXNG-LBPRGKRZSA-N 1 2 323.425 4.129 20 0 DIADLO CCOc1cc(CNc2[nH+]c3ccccc3cc2C)ccc1O ZINC001160785448 1048086490 /nfs/dbraw/zinc/08/64/90/1048086490.db2.gz SDYKKYKYFOYWLR-UHFFFAOYSA-N 1 2 308.381 4.260 20 0 DIADLO Clc1nc2ccccn2c1C[N@@H+]1Cc2ccccc2C2(CC2)C1 ZINC000776011797 1048087588 /nfs/dbraw/zinc/08/75/88/1048087588.db2.gz BKBPGOWELPOGDF-UHFFFAOYSA-N 1 2 323.827 4.035 20 0 DIADLO Clc1nc2ccccn2c1C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000776011797 1048087602 /nfs/dbraw/zinc/08/76/02/1048087602.db2.gz BKBPGOWELPOGDF-UHFFFAOYSA-N 1 2 323.827 4.035 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1cc(F)cc(C(F)(F)F)c1 ZINC001175060751 1048087835 /nfs/dbraw/zinc/08/78/35/1048087835.db2.gz FQFQPASZBBBELD-UHFFFAOYSA-N 1 2 309.266 4.074 20 0 DIADLO c1[nH]nc2cccc(CNc3ccc(Nc4ccccc4)c[nH+]3)c12 ZINC001203195012 1048091257 /nfs/dbraw/zinc/09/12/57/1048091257.db2.gz UWILCHWDVVGUPM-UHFFFAOYSA-N 1 2 315.380 4.314 20 0 DIADLO CCc1cc(N(CC)Cc2cccc(Cl)c2)nc(CC)[nH+]1 ZINC001184893554 1048097281 /nfs/dbraw/zinc/09/72/81/1048097281.db2.gz SNZHVPOVXGPOJH-UHFFFAOYSA-N 1 2 303.837 4.281 20 0 DIADLO Clc1c(Br)cncc1Nc1cccc2[nH+]c[nH]c21 ZINC001213028593 1048102324 /nfs/dbraw/zinc/10/23/24/1048102324.db2.gz SNUWVLHQXHNCTH-UHFFFAOYSA-N 1 2 323.581 4.117 20 0 DIADLO COC(=O)C[C@H](c1cc[nH+]c(N[C@H]2CCC(C)(C)C2)c1)C1CC1 ZINC001161034016 1048104636 /nfs/dbraw/zinc/10/46/36/1048104636.db2.gz XCCXVJFXIPCEGX-HOTGVXAUSA-N 1 2 316.445 4.129 20 0 DIADLO CNc1ccc(Cl)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001184963857 1048105562 /nfs/dbraw/zinc/10/55/62/1048105562.db2.gz DFZBOGRTRDLXEB-UHFFFAOYSA-N 1 2 302.809 4.121 20 0 DIADLO Clc1cc2ncoc2cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001184964553 1048106021 /nfs/dbraw/zinc/10/60/21/1048106021.db2.gz NNULUCGDAMDLEL-UHFFFAOYSA-N 1 2 314.776 4.220 20 0 DIADLO Fc1ccc(Nc2ccc[nH+]c2N2CCCC2)c2ncccc12 ZINC001184965094 1048106092 /nfs/dbraw/zinc/10/60/92/1048106092.db2.gz RVJPXDMIXFCIPN-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO Cc1nc(N2CCC[C@@H]2CCc2ccccc2)c2c([nH+]1)CCCC2 ZINC001184928530 1048106151 /nfs/dbraw/zinc/10/61/51/1048106151.db2.gz ZLIPZUZHTRZIHU-GOSISDBHSA-N 1 2 321.468 4.265 20 0 DIADLO Cc1ccc(Nc2ccc[nH+]c2N2CCCC2)c(Cl)c1O ZINC001184968542 1048107055 /nfs/dbraw/zinc/10/70/55/1048107055.db2.gz PFPWSEZHEKYXKR-UHFFFAOYSA-N 1 2 303.793 4.093 20 0 DIADLO Fc1c(Cl)ccc(Nc2ccc[nH+]c2N2CCCC2)c1F ZINC001184968001 1048107330 /nfs/dbraw/zinc/10/73/30/1048107330.db2.gz JFNBHZQWWYERBV-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO FC(F)Oc1cccc(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001184969011 1048107459 /nfs/dbraw/zinc/10/74/59/1048107459.db2.gz UWFDVDPCTQQOMZ-UHFFFAOYSA-N 1 2 305.328 4.027 20 0 DIADLO Fc1ccc(Nc2ccc[nH+]c2N2CCCC2)c(F)c1Cl ZINC001184968470 1048107834 /nfs/dbraw/zinc/10/78/34/1048107834.db2.gz MXMMPWQXMLGWHB-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO CCOc1cc(Nc2ccc[nH+]c2N2CCCCC2)ccc1F ZINC001175051310 1048110993 /nfs/dbraw/zinc/11/09/93/1048110993.db2.gz YMXTUBDKSBHJBP-UHFFFAOYSA-N 1 2 315.392 4.353 20 0 DIADLO CCn1nc(-c2ccccc2)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213029696 1048111370 /nfs/dbraw/zinc/11/13/70/1048111370.db2.gz RRVBYGDVVRZUOQ-UHFFFAOYSA-N 1 2 303.369 4.190 20 0 DIADLO Cc1cc(N2CCC[C@H](C(F)(F)F)[C@H]2C)nc(C(C)C)[nH+]1 ZINC000480291202 1048111325 /nfs/dbraw/zinc/11/13/25/1048111325.db2.gz LQEHTGLGVBXBDT-NEPJUHHUSA-N 1 2 301.356 4.076 20 0 DIADLO Fc1cc(Nc2cccc3[nH+]c[nH]c32)cc(F)c1Br ZINC001213030598 1048112862 /nfs/dbraw/zinc/11/28/62/1048112862.db2.gz HRNVLKQEMGUVPX-UHFFFAOYSA-N 1 2 324.128 4.347 20 0 DIADLO CC(C)(C)Oc1cccc(C[NH2+]Cc2ccsc2Cl)n1 ZINC000480279232 1048113176 /nfs/dbraw/zinc/11/31/76/1048113176.db2.gz BVXWDRBLLZTYCJ-UHFFFAOYSA-N 1 2 310.850 4.264 20 0 DIADLO CCOc1cc(F)c(Nc2ccc[nH+]c2N2CCCC2)cc1F ZINC001175054686 1048114272 /nfs/dbraw/zinc/11/42/72/1048114272.db2.gz JAIQZEMOVRCBBS-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2ccc(Cl)cn2)[C@@H]1c1ccccc1 ZINC000554496253 1048115559 /nfs/dbraw/zinc/11/55/59/1048115559.db2.gz HSUUFFXUIQXSEG-GUYCJALGSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2ccc(Cl)cn2)[C@@H]1c1ccccc1 ZINC000554496253 1048115564 /nfs/dbraw/zinc/11/55/64/1048115564.db2.gz HSUUFFXUIQXSEG-GUYCJALGSA-N 1 2 318.873 4.414 20 0 DIADLO COc1ccc(C2(CNc3cc[nH+]c(C)n3)CCCCC2)cc1 ZINC001184999286 1048116605 /nfs/dbraw/zinc/11/66/05/1048116605.db2.gz VVZLQMCCGDBHFJ-UHFFFAOYSA-N 1 2 311.429 4.108 20 0 DIADLO Cc1ccc(F)c(CC(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1 ZINC001161260445 1048117543 /nfs/dbraw/zinc/11/75/43/1048117543.db2.gz CFMBBWOYFCTTOY-UHFFFAOYSA-N 1 2 323.371 4.014 20 0 DIADLO c1coc(-c2ccc(Nc3ccc[nH+]c3N3CCCC3)cc2)n1 ZINC001185042796 1048121976 /nfs/dbraw/zinc/12/19/76/1048121976.db2.gz JMYVSIILHFOAAK-UHFFFAOYSA-N 1 2 306.369 4.080 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1ccccc1 ZINC000774814699 1048123539 /nfs/dbraw/zinc/12/35/39/1048123539.db2.gz KRIAUASTWHXEDZ-HNNXBMFYSA-N 1 2 301.434 4.244 20 0 DIADLO Fc1cccc(Br)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213031907 1048123569 /nfs/dbraw/zinc/12/35/69/1048123569.db2.gz RCIVEFOFOHNQCZ-UHFFFAOYSA-N 1 2 306.138 4.208 20 0 DIADLO CCC[C@H]([NH2+]Cc1ccsc1Cl)c1nnc2ccccn21 ZINC000480339592 1048123890 /nfs/dbraw/zinc/12/38/90/1048123890.db2.gz FISWLRDIEAUKDS-LBPRGKRZSA-N 1 2 320.849 4.075 20 0 DIADLO CC(C)Oc1cc(F)ccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001185044554 1048124326 /nfs/dbraw/zinc/12/43/26/1048124326.db2.gz UAHSYOZCAIXQPC-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO COc1ccccc1Sc1nc2ccccc2n2c[nH+]cc12 ZINC001185081275 1048131011 /nfs/dbraw/zinc/13/10/11/1048131011.db2.gz KSGXVKWRHMTEFE-UHFFFAOYSA-N 1 2 307.378 4.042 20 0 DIADLO Fc1ccc(OCC(F)F)c(Nc2cccc3[nH+]c[nH]c32)c1 ZINC001213032771 1048131285 /nfs/dbraw/zinc/13/12/85/1048131285.db2.gz XBDCSDBZPIADGC-UHFFFAOYSA-N 1 2 307.275 4.090 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(F)c(C(F)(F)F)c3)ccc21 ZINC001175077197 1048131473 /nfs/dbraw/zinc/13/14/73/1048131473.db2.gz FXMFLRZJIVBOHG-UHFFFAOYSA-N 1 2 309.266 4.475 20 0 DIADLO CCOc1ccc(F)cc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001175079614 1048133346 /nfs/dbraw/zinc/13/33/46/1048133346.db2.gz NOUMAHFBMPBERM-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO CC(=O)c1cc(Cl)c(F)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213033399 1048136887 /nfs/dbraw/zinc/13/68/87/1048136887.db2.gz DRKYGUPTCVFLSW-UHFFFAOYSA-N 1 2 303.724 4.302 20 0 DIADLO CC1(c2ccccc2C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)CC1 ZINC001142592389 1048144901 /nfs/dbraw/zinc/14/49/01/1048144901.db2.gz LIOZFRHBVNSSBT-UHFFFAOYSA-N 1 2 317.392 4.381 20 0 DIADLO CCOc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)c(F)c1F ZINC001175152730 1048145631 /nfs/dbraw/zinc/14/56/31/1048145631.db2.gz USXNULBSZFOPPR-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO COc1ccc(C(C)=O)c(Nc2cccc3[nH+]c[nH]c32)c1Cl ZINC001213033743 1048146158 /nfs/dbraw/zinc/14/61/58/1048146158.db2.gz VHVQWWVNVSUABU-UHFFFAOYSA-N 1 2 315.760 4.171 20 0 DIADLO CC(C)Sc1ccc([C@H](C)[NH2+][C@H](C)c2ncccn2)cc1 ZINC000930214328 1048147010 /nfs/dbraw/zinc/14/70/10/1048147010.db2.gz AZCXGEHSUJGQHT-UONOGXRCSA-N 1 2 301.459 4.389 20 0 DIADLO Cc1cccc(C(C)(C)CNc2[nH+]c(C)cc(Cl)c2C)n1 ZINC001161642735 1048149853 /nfs/dbraw/zinc/14/98/53/1048149853.db2.gz IQOYGCIEAFEDOM-UHFFFAOYSA-N 1 2 303.837 4.445 20 0 DIADLO CCOC(=O)c1coc2cc(Nc3cccc4[nH+]c[nH]c43)ccc12 ZINC001213034499 1048152899 /nfs/dbraw/zinc/15/28/99/1048152899.db2.gz NHEJJWVKQWRJMG-UHFFFAOYSA-N 1 2 321.336 4.229 20 0 DIADLO Cc1ccc(C(=O)CC[N@@H+](C)Cc2nc3ccccc3s2)cc1 ZINC000480498123 1048154392 /nfs/dbraw/zinc/15/43/92/1048154392.db2.gz GYKDFSOHELMBGF-UHFFFAOYSA-N 1 2 324.449 4.310 20 0 DIADLO Cc1ccc(C(=O)CC[N@H+](C)Cc2nc3ccccc3s2)cc1 ZINC000480498123 1048154396 /nfs/dbraw/zinc/15/43/96/1048154396.db2.gz GYKDFSOHELMBGF-UHFFFAOYSA-N 1 2 324.449 4.310 20 0 DIADLO CSc1ccc(NCCCn2cc[nH+]c2)c(C(F)(F)F)c1 ZINC001161689343 1048155402 /nfs/dbraw/zinc/15/54/02/1048155402.db2.gz OAPGSDJMVFKOIL-UHFFFAOYSA-N 1 2 315.364 4.126 20 0 DIADLO CCc1cc(N[C@H](c2nccs2)c2ccccc2)nc(CC)[nH+]1 ZINC001185306169 1048161730 /nfs/dbraw/zinc/16/17/30/1048161730.db2.gz OQMUXROSOVDQLG-KRWDZBQOSA-N 1 2 324.453 4.259 20 0 DIADLO COCc1cc[nH+]c(N[C@H](CC2CC2)c2ccccc2F)c1 ZINC001161772143 1048167541 /nfs/dbraw/zinc/16/75/41/1048167541.db2.gz GRCJOKHBNUCQOL-QGZVFWFLSA-N 1 2 300.377 4.320 20 0 DIADLO COc1c[nH+]c(N[C@H](CC2CC2)c2ccccc2F)c(C)c1 ZINC001161773419 1048169200 /nfs/dbraw/zinc/16/92/00/1048169200.db2.gz WZOTWKPNGQOADA-QGZVFWFLSA-N 1 2 300.377 4.491 20 0 DIADLO Cc1cc(N2C[C@@H](c3ccccc3)C[C@H]2C)nc(C2CCC2)[nH+]1 ZINC001185367772 1048173742 /nfs/dbraw/zinc/17/37/42/1048173742.db2.gz ZHKIJPYUCVJZKA-QAPCUYQASA-N 1 2 307.441 4.435 20 0 DIADLO Cc1cc(N[C@H](c2ccnc(F)c2)C2CC2)nc(C(C)C)[nH+]1 ZINC001161844333 1048184421 /nfs/dbraw/zinc/18/44/21/1048184421.db2.gz BHIJSWDVCLHWTH-INIZCTEOSA-N 1 2 300.381 4.006 20 0 DIADLO Cc1cn2cccc(Nc3cccc(O[C@H]4CCCCO4)c3)c2[nH+]1 ZINC001175184823 1048187671 /nfs/dbraw/zinc/18/76/71/1048187671.db2.gz VLAQNXIEHFPCKQ-SFHVURJKSA-N 1 2 323.396 4.292 20 0 DIADLO Cc1cn2c(cccc2NC(=S)Nc2cccc(Cl)c2)[nH+]1 ZINC001201093480 1048188088 /nfs/dbraw/zinc/18/80/88/1048188088.db2.gz MFHWSLMDGRKYFL-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO Cc1nc(NC2(CC3CC3)CCC(F)(F)CC2)c2c([nH+]1)CCC2 ZINC001161898309 1048190431 /nfs/dbraw/zinc/19/04/31/1048190431.db2.gz XKMRQBVMOHLDSQ-UHFFFAOYSA-N 1 2 321.415 4.434 20 0 DIADLO CCc1cc(NCc2ccccc2OC(C)(C)C)nc(CC)[nH+]1 ZINC001185526677 1048192668 /nfs/dbraw/zinc/19/26/68/1048192668.db2.gz DRBYXFTWYKSQMN-UHFFFAOYSA-N 1 2 313.445 4.391 20 0 DIADLO Fc1cc(Nc2cccc(Cn3cc[nH+]c3)c2)ccc1Cl ZINC001175209803 1048195861 /nfs/dbraw/zinc/19/58/61/1048195861.db2.gz XQALCIMKYNCANR-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO CN(C)c1nc(N[C@H](c2ccccc2)C2CC2)[nH+]c2ccccc21 ZINC001161955367 1048197771 /nfs/dbraw/zinc/19/77/71/1048197771.db2.gz PZTOPJAWHBIMSL-GOSISDBHSA-N 1 2 318.424 4.259 20 0 DIADLO CCc1ccccc1NC(=S)Nc1ccc2[nH+]c(C)cn2c1 ZINC001201139806 1048199207 /nfs/dbraw/zinc/19/92/07/1048199207.db2.gz VGTMSLXREWGJEU-UHFFFAOYSA-N 1 2 310.426 4.014 20 0 DIADLO Cc1cc(N(Cc2ccco2)Cc2ccccc2)nc(C2CC2)[nH+]1 ZINC001185631050 1048206055 /nfs/dbraw/zinc/20/60/55/1048206055.db2.gz XGPJPOKFPLGTIF-UHFFFAOYSA-N 1 2 319.408 4.462 20 0 DIADLO Cc1cc(N(Cc2ccccc2)CC(F)F)nc(C2CCC2)[nH+]1 ZINC001185649614 1048207783 /nfs/dbraw/zinc/20/77/83/1048207783.db2.gz MPIZGVNQGAMKIB-UHFFFAOYSA-N 1 2 317.383 4.324 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nc2ccccc2n1CC ZINC000554890461 1048219135 /nfs/dbraw/zinc/21/91/35/1048219135.db2.gz OHYKWTIQNPXQST-KRWDZBQOSA-N 1 2 308.429 4.034 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nc2ccccc2n1CC ZINC000554890461 1048219142 /nfs/dbraw/zinc/21/91/42/1048219142.db2.gz OHYKWTIQNPXQST-KRWDZBQOSA-N 1 2 308.429 4.034 20 0 DIADLO CCCCN1CCc2ccc(NCc3c[nH+]cn3CCC)cc21 ZINC001201226709 1048219413 /nfs/dbraw/zinc/21/94/13/1048219413.db2.gz JMACDPJBDOSFBF-UHFFFAOYSA-N 1 2 312.461 4.068 20 0 DIADLO CCOc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)c(F)c1 ZINC001175247942 1048219592 /nfs/dbraw/zinc/21/95/92/1048219592.db2.gz AQSJPGRPXWIMIQ-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO CCOc1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)c(F)c1 ZINC001175247930 1048220788 /nfs/dbraw/zinc/22/07/88/1048220788.db2.gz UWAMFQJIZBVISH-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO CCOc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(F)c1 ZINC001175249035 1048221370 /nfs/dbraw/zinc/22/13/70/1048221370.db2.gz XSFLRFFKFPLDSE-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO CC(=O)c1ccc(F)c(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001175276737 1048224623 /nfs/dbraw/zinc/22/46/23/1048224623.db2.gz YWRLBZMJOCLLBP-UHFFFAOYSA-N 1 2 309.344 4.017 20 0 DIADLO CC(C)(C)c1ccc(Nc2ccc(N)[nH+]c2)cc1Br ZINC001201284180 1048225243 /nfs/dbraw/zinc/22/52/43/1048225243.db2.gz MJFZBGNDYFDKRQ-UHFFFAOYSA-N 1 2 320.234 4.467 20 0 DIADLO COc1ccccc1Oc1ccc(Nc2ccc(N)[nH+]c2)cc1 ZINC001201286852 1048226094 /nfs/dbraw/zinc/22/60/94/1048226094.db2.gz DKOWYDJVBKAERW-UHFFFAOYSA-N 1 2 307.353 4.208 20 0 DIADLO Nc1ccc(Nc2cccc3c(Br)cccc23)c[nH+]1 ZINC001201284660 1048226780 /nfs/dbraw/zinc/22/67/80/1048226780.db2.gz VHFCKZZLBDSUAV-UHFFFAOYSA-N 1 2 314.186 4.323 20 0 DIADLO CCOc1ccc(F)c(F)c1Nc1ccc[nH+]c1N1CCCC1 ZINC001175281135 1048227868 /nfs/dbraw/zinc/22/78/68/1048227868.db2.gz RPYLEIRRKJJHJR-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO CC(C)(C)c1ccc(Br)c(Nc2ccc(N)[nH+]c2)c1 ZINC001201291951 1048228586 /nfs/dbraw/zinc/22/85/86/1048228586.db2.gz QEMOETIFSOOZFD-UHFFFAOYSA-N 1 2 320.234 4.467 20 0 DIADLO CC(C)Oc1cc(Nc2ccc(N)[nH+]c2)cc(C(F)(F)F)c1 ZINC001201291719 1048228746 /nfs/dbraw/zinc/22/87/46/1048228746.db2.gz OPYIMYSXCDOCGM-UHFFFAOYSA-N 1 2 311.307 4.213 20 0 DIADLO Cc1ccc2cc(CNc3ccc(-n4cc[nH+]c4)c(F)c3)[nH]c2c1 ZINC001201256564 1048228857 /nfs/dbraw/zinc/22/88/57/1048228857.db2.gz DDZNZQJMMWHYJU-UHFFFAOYSA-N 1 2 320.371 4.413 20 0 DIADLO Nc1ccc(Sc2ccc(Nc3ccc(N)[nH+]c3)cc2)cc1 ZINC001201287197 1048228994 /nfs/dbraw/zinc/22/89/94/1048228994.db2.gz YQYJDEBLJSHAPR-UHFFFAOYSA-N 1 2 308.410 4.141 20 0 DIADLO COc1cc[nH+]c(C(C)(C)CNc2ccc3ccccc3n2)c1 ZINC001162128949 1048229396 /nfs/dbraw/zinc/22/93/96/1048229396.db2.gz YBVIICFDTUOKEK-UHFFFAOYSA-N 1 2 307.397 4.028 20 0 DIADLO Cc1c(Br)cc(Cl)cc1Nc1ccc(N)[nH+]c1 ZINC001201291686 1048229387 /nfs/dbraw/zinc/22/93/87/1048229387.db2.gz NAYAFJKFRVWQLV-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO Cc1nc(-c2cccc(NCc3cccc4[nH+]ccn43)c2)oc1C ZINC001201258003 1048229752 /nfs/dbraw/zinc/22/97/52/1048229752.db2.gz XTKMCHOMXQIIQC-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO Nc1ccc(Nc2cc(Br)cc3ccccc32)c[nH+]1 ZINC001201295943 1048233001 /nfs/dbraw/zinc/23/30/01/1048233001.db2.gz YUCVAAHJYSUEAI-UHFFFAOYSA-N 1 2 314.186 4.323 20 0 DIADLO Cn1ccc2cc(CNc3cc(-c4ccncc4)cc[nH+]3)ccc21 ZINC001162165316 1048233722 /nfs/dbraw/zinc/23/37/22/1048233722.db2.gz BMRYPCSDNMCIKN-UHFFFAOYSA-N 1 2 314.392 4.247 20 0 DIADLO Cc1cc(NCC2(c3ncccc3F)CC2)[nH+]c2ccccc12 ZINC001162159296 1048234060 /nfs/dbraw/zinc/23/40/60/1048234060.db2.gz VVMQTHCXWCCYTA-UHFFFAOYSA-N 1 2 307.372 4.221 20 0 DIADLO CCOc1cc(F)ccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001175289628 1048234159 /nfs/dbraw/zinc/23/41/59/1048234159.db2.gz DFHSCCBTXQHVGC-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO Cc1ncc(CNc2ccc3c(c2)[nH+]cn3-c2ccccc2)s1 ZINC001162159892 1048234432 /nfs/dbraw/zinc/23/44/32/1048234432.db2.gz RCMVCZLELXFTLV-UHFFFAOYSA-N 1 2 320.421 4.403 20 0 DIADLO Cc1ccc(O)c(Nc2ccc(NC(=O)c3ccccc3)cc2)[nH+]1 ZINC001201306987 1048235157 /nfs/dbraw/zinc/23/51/57/1048235157.db2.gz DNKWGZDNVQDOCX-UHFFFAOYSA-N 1 2 319.364 4.092 20 0 DIADLO Cn1ccc2cc(CNc3ccc(F)c(-n4cc[nH+]c4)c3)ccc21 ZINC001162173833 1048236852 /nfs/dbraw/zinc/23/68/52/1048236852.db2.gz XVPSWKMSRQSBAD-UHFFFAOYSA-N 1 2 320.371 4.115 20 0 DIADLO COCCCN(c1ccc(CC(C)C)cc1)c1[nH+]cccc1N ZINC001175294728 1048237049 /nfs/dbraw/zinc/23/70/49/1048237049.db2.gz BQBBXIFOCYIRNZ-UHFFFAOYSA-N 1 2 313.445 4.037 20 0 DIADLO Cc1cc(Oc2ccc(NC(=O)NC3CCCC3)cc2)cc[nH+]1 ZINC001185902621 1048239788 /nfs/dbraw/zinc/23/97/88/1048239788.db2.gz HNBGTRQUWZMYEX-UHFFFAOYSA-N 1 2 311.385 4.246 20 0 DIADLO Clc1cscc1C[NH2+][C@@H]1COc2ccc(Cl)cc21 ZINC001201372141 1048241518 /nfs/dbraw/zinc/24/15/18/1048241518.db2.gz BJQXPHPZEPJFHC-GFCCVEGCSA-N 1 2 300.210 4.278 20 0 DIADLO Cc1ccccc1[C@@H]1CCCN1c1nc(C)[nH+]c2c1CCCC2 ZINC001162211248 1048242712 /nfs/dbraw/zinc/24/27/12/1048242712.db2.gz RSRPUAIVFLWVOZ-IBGZPJMESA-N 1 2 307.441 4.314 20 0 DIADLO CN(C)c1ccc(Nc2c(Cl)cc(Cl)nc2Cl)c[nH+]1 ZINC001175341819 1048249676 /nfs/dbraw/zinc/24/96/76/1048249676.db2.gz OVXVXXCZFDWKHW-UHFFFAOYSA-N 1 2 317.607 4.246 20 0 DIADLO CC(=O)c1ccc(F)c(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001175271942 1048249856 /nfs/dbraw/zinc/24/98/56/1048249856.db2.gz LNKBAFJXRUOCSP-UHFFFAOYSA-N 1 2 303.724 4.073 20 0 DIADLO CN(C)c1ccc(Nc2ccc(C3(C(F)(F)F)CC3)cc2)c[nH+]1 ZINC001175342506 1048251000 /nfs/dbraw/zinc/25/10/00/1048251000.db2.gz QVQKBMCIEXSHPO-UHFFFAOYSA-N 1 2 321.346 4.485 20 0 DIADLO Cc1cc(NC[C@@H](O)c2ccco2)[nH+]c2c1cccc2C(C)C ZINC001162253812 1048252490 /nfs/dbraw/zinc/25/24/90/1048252490.db2.gz PEIMISPCVWZSKM-MRXNPFEDSA-N 1 2 310.397 4.405 20 0 DIADLO Cc1cc([C@H](C)Nc2nc3ccccc3n3c[nH+]cc23)c(C)o1 ZINC001162313871 1048261445 /nfs/dbraw/zinc/26/14/45/1048261445.db2.gz OADUAXSQNVTYFN-LBPRGKRZSA-N 1 2 306.369 4.265 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccc(C)cc2O[C@@H](C)CC)s1 ZINC001201425260 1048263444 /nfs/dbraw/zinc/26/34/44/1048263444.db2.gz PBCMUPZQZJBMHQ-AWEZNQCLSA-N 1 2 318.486 4.481 20 0 DIADLO CSc1cc(C)nc(SC)c1Nc1ccc(N(C)C)[nH+]c1 ZINC001175337352 1048268685 /nfs/dbraw/zinc/26/86/85/1048268685.db2.gz FQPQWNPTVMTVLX-UHFFFAOYSA-N 1 2 320.487 4.038 20 0 DIADLO CC(=O)c1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1Cl ZINC001175349798 1048270832 /nfs/dbraw/zinc/27/08/32/1048270832.db2.gz QRKSLDGGMMADEP-UHFFFAOYSA-N 1 2 315.804 4.281 20 0 DIADLO COc1ccc(F)c(Nc2ccc(N3CCCC3)[nH+]c2)c1Cl ZINC001175349716 1048271213 /nfs/dbraw/zinc/27/12/13/1048271213.db2.gz DKNSEOWDLTXOJX-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO c1ccc(-c2ccc(Nc3ccc(N4CCCC4)[nH+]c3)cc2)nc1 ZINC001175352526 1048273562 /nfs/dbraw/zinc/27/35/62/1048273562.db2.gz QTJRVDVIOMQDLY-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO c1cc(C2CCOCC2)ccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175352192 1048273616 /nfs/dbraw/zinc/27/36/16/1048273616.db2.gz LMXKMOSMXQXARY-UHFFFAOYSA-N 1 2 323.440 4.319 20 0 DIADLO Nc1cccc2cccc(Nc3ccc(N4CCCC4)[nH+]c3)c12 ZINC001175352598 1048273648 /nfs/dbraw/zinc/27/36/48/1048273648.db2.gz XKGFODXSGPDHDY-UHFFFAOYSA-N 1 2 304.397 4.161 20 0 DIADLO c1cnc2cc(Nc3ccc([NH+]4CCCCC4)cc3)cnc2c1 ZINC001175359447 1048275610 /nfs/dbraw/zinc/27/56/10/1048275610.db2.gz PMWJPXILLMKKMO-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO CSc1cc[nH+]c(N[C@@H]2CCOc3c(F)cc(F)cc32)c1 ZINC001162408052 1048276975 /nfs/dbraw/zinc/27/69/75/1048276975.db2.gz ZHYRXDCEQDVTPC-CYBMUJFWSA-N 1 2 308.353 4.017 20 0 DIADLO Cc1cc(Nc2ccc([NH2+]C(C)C)cc2)n(-c2cccnc2)n1 ZINC001201490322 1048280782 /nfs/dbraw/zinc/28/07/82/1048280782.db2.gz FFHNNMDCAQUWQS-UHFFFAOYSA-N 1 2 307.401 4.140 20 0 DIADLO Cc1sc(Nc2ccc([NH2+]C(C)C)cc2)c(C(N)=O)c1C ZINC001201487477 1048281122 /nfs/dbraw/zinc/28/11/22/1048281122.db2.gz IRXTWFTYMGXIEC-UHFFFAOYSA-N 1 2 303.431 4.028 20 0 DIADLO Cc1cc(Nc2ccc([NH2+]C(C)C)cc2)n(Cc2ccncc2)n1 ZINC001201488968 1048281376 /nfs/dbraw/zinc/28/13/76/1048281376.db2.gz USVOSRZMPRAOOS-UHFFFAOYSA-N 1 2 321.428 4.199 20 0 DIADLO Cc1cnn(Cc2ccccn2)c1Nc1ccc([NH2+]C(C)C)cc1 ZINC001201491586 1048282165 /nfs/dbraw/zinc/28/21/65/1048282165.db2.gz PZJUCPZEWSXASZ-UHFFFAOYSA-N 1 2 321.428 4.199 20 0 DIADLO Cc1cc(NCc2ccc3ncccc3c2)nc(C2CCC2)[nH+]1 ZINC001186368866 1048287714 /nfs/dbraw/zinc/28/77/14/1048287714.db2.gz ZVCLSELHGYOHKL-UHFFFAOYSA-N 1 2 304.397 4.213 20 0 DIADLO Cn1c[nH+]c2cc(Nc3c(F)c(F)c(F)c(F)c3F)ccc21 ZINC001175385003 1048291177 /nfs/dbraw/zinc/29/11/77/1048291177.db2.gz GQLCQGHVDSDBRR-UHFFFAOYSA-N 1 2 313.229 4.012 20 0 DIADLO Cc1cc(CNc2cnn(-c3ccccc3Cl)c2)cc(C)[nH+]1 ZINC001201473593 1048293051 /nfs/dbraw/zinc/29/30/51/1048293051.db2.gz QFCJFYKHMMYMCD-UHFFFAOYSA-N 1 2 312.804 4.150 20 0 DIADLO Cc1nc(N[C@@H]2CCC[C@@H]2Cc2ccccc2)c2c([nH+]1)CCCC2 ZINC001162584980 1048307461 /nfs/dbraw/zinc/30/74/61/1048307461.db2.gz VSLKABRLJKSZJS-IEBWSBKVSA-N 1 2 321.468 4.487 20 0 DIADLO Cc1nc(N[C@@H]2CCC[C@H]2Cc2ccccc2)c2c([nH+]1)CCCC2 ZINC001162584982 1048308394 /nfs/dbraw/zinc/30/83/94/1048308394.db2.gz VSLKABRLJKSZJS-PKOBYXMFSA-N 1 2 321.468 4.487 20 0 DIADLO O=C1Nc2ccccc2[C@H]1CNc1[nH+]ccc2cc(Cl)ccc21 ZINC001162610829 1048313944 /nfs/dbraw/zinc/31/39/44/1048313944.db2.gz RGBCAATXLSKZAL-OAHLLOKOSA-N 1 2 323.783 4.036 20 0 DIADLO CCc1cc(N2C[C@@H](C)C[C@H]2c2cccc(F)c2)nc(CC)[nH+]1 ZINC001162625831 1048314843 /nfs/dbraw/zinc/31/48/43/1048314843.db2.gz JNUBEIFALMDKKF-GUYCJALGSA-N 1 2 313.420 4.328 20 0 DIADLO C[S@](=O)c1ccc(Nc2cc[nH+]c3cc(Cl)ccc23)cc1 ZINC001175473895 1048316052 /nfs/dbraw/zinc/31/60/52/1048316052.db2.gz CLPOMXVABZTPCX-NRFANRHFSA-N 1 2 316.813 4.369 20 0 DIADLO CSCc1cc[nH+]c(N[C@@H](C)c2cccc(N(C)C)c2)c1 ZINC001162635640 1048321116 /nfs/dbraw/zinc/32/11/16/1048321116.db2.gz UHRMNWXMIIOGQS-ZDUSSCGKSA-N 1 2 301.459 4.184 20 0 DIADLO Cc1cc(O)c[nH+]c1Nc1ccc(NC(=O)OC(C)(C)C)cc1 ZINC001175544874 1048332999 /nfs/dbraw/zinc/33/29/99/1048332999.db2.gz BIEYRFOLPLXDSF-UHFFFAOYSA-N 1 2 315.373 4.186 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cncc(OCc2ccccc2)c1 ZINC001201621545 1048334098 /nfs/dbraw/zinc/33/40/98/1048334098.db2.gz JUSUBKBVHPSIFY-UHFFFAOYSA-N 1 2 321.380 4.198 20 0 DIADLO CC(C)(C)OC(=O)c1cccc(Nc2cccn3cc[nH+]c23)c1 ZINC001175547181 1048334947 /nfs/dbraw/zinc/33/49/47/1048334947.db2.gz XYXWTZDQGMEVBB-UHFFFAOYSA-N 1 2 309.369 4.033 20 0 DIADLO O[C@H](CNc1cc2ccccc2c[nH+]1)c1cc2ccccc2o1 ZINC001162694529 1048336451 /nfs/dbraw/zinc/33/64/51/1048336451.db2.gz FVNRVZGBEPTPRN-MRXNPFEDSA-N 1 2 304.349 4.127 20 0 DIADLO Clc1ccc([C@@H]2COCC[N@@H+]2CCCc2ccccc2)cc1 ZINC001201671284 1048338291 /nfs/dbraw/zinc/33/82/91/1048338291.db2.gz GDPTTWACUQGAED-IBGZPJMESA-N 1 2 315.844 4.346 20 0 DIADLO Clc1ccc([C@@H]2COCC[N@H+]2CCCc2ccccc2)cc1 ZINC001201671284 1048338306 /nfs/dbraw/zinc/33/83/06/1048338306.db2.gz GDPTTWACUQGAED-IBGZPJMESA-N 1 2 315.844 4.346 20 0 DIADLO CC(C)(C)OC(=O)Nc1ccc(Nc2cccn3cc[nH+]c23)cc1 ZINC001175547729 1048338823 /nfs/dbraw/zinc/33/88/23/1048338823.db2.gz CATHYTOQZJNMNI-UHFFFAOYSA-N 1 2 324.384 4.425 20 0 DIADLO CSc1ccccc1NC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001186717363 1048340748 /nfs/dbraw/zinc/34/07/48/1048340748.db2.gz RXACOJVVQYYYDW-UHFFFAOYSA-N 1 2 312.398 4.009 20 0 DIADLO Cc1cc(NCc2ccnc(C(F)(F)F)c2)nc(C(C)(C)C)[nH+]1 ZINC001162740206 1048346462 /nfs/dbraw/zinc/34/64/62/1048346462.db2.gz LNIFOIFEHRYQMY-UHFFFAOYSA-N 1 2 324.350 4.108 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1ccc(F)cc1C ZINC000555462254 1048354603 /nfs/dbraw/zinc/35/46/03/1048354603.db2.gz KTFLQBGRIZVVHS-QGZVFWFLSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1ccc(F)cc1C ZINC000555462254 1048354617 /nfs/dbraw/zinc/35/46/17/1048354617.db2.gz KTFLQBGRIZVVHS-QGZVFWFLSA-N 1 2 301.409 4.078 20 0 DIADLO Fc1ccc2c(c1)[nH]c1nc[nH+]c(N[C@@H]3CCc4sccc43)c21 ZINC001162770192 1048354839 /nfs/dbraw/zinc/35/48/39/1048354839.db2.gz SJPGAKUZUZEAFT-GFCCVEGCSA-N 1 2 324.384 4.411 20 0 DIADLO Cc1[nH+]ccn1Cc1ccc(Nc2c3cn[nH]c3ccc2C)cc1 ZINC001175526733 1048357365 /nfs/dbraw/zinc/35/73/65/1048357365.db2.gz RBTFZWOZKISYRQ-UHFFFAOYSA-N 1 2 317.396 4.168 20 0 DIADLO Cn1cc(CNc2cc3cc(F)ccc3c[nH+]2)c2ccccc21 ZINC001162827379 1048368559 /nfs/dbraw/zinc/36/85/59/1048368559.db2.gz JUUOBYJWJBKSQC-UHFFFAOYSA-N 1 2 305.356 4.478 20 0 DIADLO Cc1ccc2[nH+]cc(CN[C@@H](CC(C)(C)C)C(F)(F)F)n2c1 ZINC001201734967 1048373034 /nfs/dbraw/zinc/37/30/34/1048373034.db2.gz QEXZROQZOPVALM-ZDUSSCGKSA-N 1 2 313.367 4.099 20 0 DIADLO CC(=O)Nc1c(C)cc[nH+]c1N[C@H](C)c1cccc(F)c1Cl ZINC001162891548 1048377739 /nfs/dbraw/zinc/37/77/39/1048377739.db2.gz PQZHOQVVNCNROL-SNVBAGLBSA-N 1 2 321.783 4.314 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)Nc1cc(Cl)cc(Cl)c1 ZINC001187128664 1048378289 /nfs/dbraw/zinc/37/82/89/1048378289.db2.gz MEGWZHGPHCGNHA-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO COc1ccc2c(c1)CC[C@@H](Nc1cc(C)[nH+]c(C3CCC3)n1)C2 ZINC001162907632 1048385432 /nfs/dbraw/zinc/38/54/32/1048385432.db2.gz UGQQRAFAABHENV-QGZVFWFLSA-N 1 2 323.440 4.031 20 0 DIADLO CCC(CC)[C@H]1C[C@H](Nc2cc(C)[nH+]c(C3CCC3)n2)CCO1 ZINC001162942217 1048393836 /nfs/dbraw/zinc/39/38/36/1048393836.db2.gz CKXXCMXKCUHJSC-IAGOWNOFSA-N 1 2 317.477 4.448 20 0 DIADLO Cc1cccc([C@H]2CCN(c3cc(C)[nH+]c(C4CCC4)n3)C2)c1 ZINC001163030418 1048405415 /nfs/dbraw/zinc/40/54/15/1048405415.db2.gz FKVCGFZFFPIJFO-SFHVURJKSA-N 1 2 307.441 4.355 20 0 DIADLO CC(C)c1cc(NCc2nc3c(s2)CCC3)nc(C(C)C)[nH+]1 ZINC001187593239 1048409801 /nfs/dbraw/zinc/40/98/01/1048409801.db2.gz GAVVXIKARNPZCE-UHFFFAOYSA-N 1 2 316.474 4.281 20 0 DIADLO Cc1nc(NC(C)(C)Cc2ccc(C(F)(F)F)cc2)cc[nH+]1 ZINC001163062232 1048411947 /nfs/dbraw/zinc/41/19/47/1048411947.db2.gz QFNMHOMRLKTYPL-UHFFFAOYSA-N 1 2 309.335 4.237 20 0 DIADLO c1ccc([C@@H](Nc2[nH+]ccc3ccccc32)c2cccnn2)cc1 ZINC001163101633 1048415562 /nfs/dbraw/zinc/41/55/62/1048415562.db2.gz CJYNHTZGTQFCCP-LJQANCHMSA-N 1 2 312.376 4.226 20 0 DIADLO CC(C)Oc1ccc(Nc2c[nH+]c(N)cc2C(F)(F)F)cc1 ZINC001175712004 1048418881 /nfs/dbraw/zinc/41/88/81/1048418881.db2.gz FGRINCNNFZAQOV-UHFFFAOYSA-N 1 2 311.307 4.213 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(C(F)(F)F)cc2)c[nH+]1 ZINC001175712499 1048419312 /nfs/dbraw/zinc/41/93/12/1048419312.db2.gz NGCARUYAEALHQJ-UHFFFAOYSA-N 1 2 321.224 4.445 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc(C3CCC3)n2)c[nH+]1 ZINC001175711969 1048419362 /nfs/dbraw/zinc/41/93/62/1048419362.db2.gz CJWNAFMFSFSQNG-UHFFFAOYSA-N 1 2 308.307 4.089 20 0 DIADLO Cc1nc(NC(C)(C)c2cc(Cl)ccn2)cc(C(C)C)[nH+]1 ZINC001163143214 1048420490 /nfs/dbraw/zinc/42/04/90/1048420490.db2.gz YPOQCLUVICZOMZ-UHFFFAOYSA-N 1 2 304.825 4.304 20 0 DIADLO Cc1cn2c(cccc2NC(=O)Nc2ccc(F)c(Cl)c2)[nH+]1 ZINC001187664478 1048420747 /nfs/dbraw/zinc/42/07/47/1048420747.db2.gz IXHKYPAQMUJBNV-UHFFFAOYSA-N 1 2 318.739 4.079 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(F)c(F)c2Cl)c[nH+]1 ZINC001175715075 1048420965 /nfs/dbraw/zinc/42/09/65/1048420965.db2.gz JONWZDHFJLUPQY-UHFFFAOYSA-N 1 2 323.652 4.358 20 0 DIADLO Clc1ccc2nc(NCc3ccc4[nH+]ccn4c3)ccc2c1 ZINC001163136767 1048421225 /nfs/dbraw/zinc/42/12/25/1048421225.db2.gz OTWKNYDQGAOVEV-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO Clc1cccc2ccc(NCc3ccc4[nH+]ccn4c3)nc12 ZINC001163137003 1048421369 /nfs/dbraw/zinc/42/13/69/1048421369.db2.gz UVRWBGMMTYPYLV-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO Cc1ccnc2c(Nc3c[nH+]c(N)cc3C(F)(F)F)cccc12 ZINC001175714554 1048421823 /nfs/dbraw/zinc/42/18/23/1048421823.db2.gz PFCBPUXZEKJCCT-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO CC(=O)Nc1ccc([C@H](C)Nc2[nH+]c(C)cc(Cl)c2C)cc1 ZINC001163149554 1048422929 /nfs/dbraw/zinc/42/29/29/1048422929.db2.gz OXKCPARCAJYZIO-LBPRGKRZSA-N 1 2 317.820 4.483 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2c(F)cc(F)cc2Cl)c[nH+]1 ZINC001175717814 1048423629 /nfs/dbraw/zinc/42/36/29/1048423629.db2.gz RJDVOYDOZTVPFT-UHFFFAOYSA-N 1 2 323.652 4.358 20 0 DIADLO C[C@@H]1CCC[C@@H](CNc2nc3ccccc3n3c[nH+]cc23)[C@H]1C ZINC001163184766 1048429878 /nfs/dbraw/zinc/42/98/78/1048429878.db2.gz IZIRYESMAGVXJN-ILXRZTDVSA-N 1 2 308.429 4.367 20 0 DIADLO CCSc1cc[nH+]c(NCc2cccc(C(F)(F)F)n2)c1 ZINC001163184780 1048429913 /nfs/dbraw/zinc/42/99/13/1048429913.db2.gz ULGVRCBQZCIKNM-UHFFFAOYSA-N 1 2 313.348 4.220 20 0 DIADLO C[C@@H]1CCC[C@@H](CNc2nc3ccccc3n3c[nH+]cc23)[C@@H]1C ZINC001163184768 1048430062 /nfs/dbraw/zinc/43/00/62/1048430062.db2.gz IZIRYESMAGVXJN-KFWWJZLASA-N 1 2 308.429 4.367 20 0 DIADLO c1cn(Cc2ccc(Nc3ccc4ccncc4c3)cc2)c[nH+]1 ZINC001175706010 1048436170 /nfs/dbraw/zinc/43/61/70/1048436170.db2.gz YEJXRSASCIQLTP-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc(Cl)cc(Cl)n2)c[nH+]1 ZINC001175709853 1048438077 /nfs/dbraw/zinc/43/80/77/1048438077.db2.gz MZCNZSXLVUNRTF-UHFFFAOYSA-N 1 2 323.105 4.128 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NCc1ccc(OCC(F)F)cc1 ZINC001202031196 1048440041 /nfs/dbraw/zinc/44/00/41/1048440041.db2.gz DXAJFXRVRXPGEJ-UHFFFAOYSA-N 1 2 322.355 4.125 20 0 DIADLO Cc1ccc(-n2cc(NCc3cc(C)[nH+]c(C)c3)cn2)c(C)c1 ZINC001202031602 1048440528 /nfs/dbraw/zinc/44/05/28/1048440528.db2.gz MOQSPRINEUSLOE-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc3c(c2)CCO3)nc(C2CCC2)[nH+]1 ZINC001187765556 1048441527 /nfs/dbraw/zinc/44/15/27/1048441527.db2.gz IPKDVRMGSMXNFK-CYBMUJFWSA-N 1 2 309.413 4.161 20 0 DIADLO Cc1cccc2c(C)cc(NCc3nccc(OC(C)C)n3)[nH+]c12 ZINC001163258135 1048444937 /nfs/dbraw/zinc/44/49/37/1048444937.db2.gz YIALGTLMIXFYKN-UHFFFAOYSA-N 1 2 322.412 4.041 20 0 DIADLO COc1cc(Nc2ccc[nH+]c2N2CCCC2)ccc1Cl ZINC001175774050 1048449229 /nfs/dbraw/zinc/44/92/29/1048449229.db2.gz NNSAKGVUNSHRDH-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO Cc1ccc2c(Nc3cnn(-c4ccccc4)c3)cccc2[nH+]1 ZINC001175795667 1048456650 /nfs/dbraw/zinc/45/66/50/1048456650.db2.gz OIJXIPZGSDINDR-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCc3ccsc3[C@H]2C)n1 ZINC001175829721 1048457160 /nfs/dbraw/zinc/45/71/60/1048457160.db2.gz HZDQNAVBYCKPJI-CYBMUJFWSA-N 1 2 303.475 4.425 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCc3ccsc3[C@H]2C)n1 ZINC001175829721 1048457162 /nfs/dbraw/zinc/45/71/62/1048457162.db2.gz HZDQNAVBYCKPJI-CYBMUJFWSA-N 1 2 303.475 4.425 20 0 DIADLO COc1cnccc1[C@@H](Nc1cc2ccccc2c[nH+]1)C1CC1 ZINC001163397616 1048466186 /nfs/dbraw/zinc/46/61/86/1048466186.db2.gz QJRKYNHKZSEBBF-IBGZPJMESA-N 1 2 305.381 4.202 20 0 DIADLO CSc1cccc(NC(=O)Nc2ccccc2-n2cc[nH+]c2)c1 ZINC001188016161 1048467461 /nfs/dbraw/zinc/46/74/61/1048467461.db2.gz XGIHEQLZECTMSB-UHFFFAOYSA-N 1 2 324.409 4.238 20 0 DIADLO Cc1cc(N(C)[C@H]2CCC[C@@H]2c2ccccc2)nc(C2CC2)[nH+]1 ZINC001163474062 1048475889 /nfs/dbraw/zinc/47/58/89/1048475889.db2.gz YIDBVMQLQLHOBA-MSOLQXFVSA-N 1 2 307.441 4.435 20 0 DIADLO CCc1noc([C@@H](C)[N@H+]2CC=C(c3cccc(Cl)c3)CC2)n1 ZINC000481756602 1048476117 /nfs/dbraw/zinc/47/61/17/1048476117.db2.gz NBUJSDHAKLCTBK-GFCCVEGCSA-N 1 2 317.820 4.136 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)n1 ZINC000481756602 1048476125 /nfs/dbraw/zinc/47/61/25/1048476125.db2.gz NBUJSDHAKLCTBK-GFCCVEGCSA-N 1 2 317.820 4.136 20 0 DIADLO Cc1cc(N(C)[C@H]2CCC[C@H]2c2ccccc2)nc(C2CC2)[nH+]1 ZINC001163474066 1048476307 /nfs/dbraw/zinc/47/63/07/1048476307.db2.gz YIDBVMQLQLHOBA-ROUUACIJSA-N 1 2 307.441 4.435 20 0 DIADLO COC(=O)c1ccc2cc[nH+]c(N[C@H]3CCCC34CCC4)c2c1 ZINC001163519297 1048482086 /nfs/dbraw/zinc/48/20/86/1048482086.db2.gz YBMGAWPBJYDVSD-INIZCTEOSA-N 1 2 310.397 4.156 20 0 DIADLO CSc1ccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)o1 ZINC001202250389 1048489773 /nfs/dbraw/zinc/48/97/73/1048489773.db2.gz HPIKNRKESTUFSP-UHFFFAOYSA-N 1 2 303.761 4.223 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3cccc(N4CCCCC4)c3)n2c1 ZINC000156107237 1048492580 /nfs/dbraw/zinc/49/25/80/1048492580.db2.gz JYVWPLMLXWQROB-UHFFFAOYSA-N 1 2 320.440 4.245 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)Nc1ccc(Cl)c(Cl)c1 ZINC001202255955 1048492679 /nfs/dbraw/zinc/49/26/79/1048492679.db2.gz IGHZOQGUMRPUDQ-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO COc1c[nH+]c(NCc2c(Cl)ccc(C)c2F)c2[nH]ccc21 ZINC001163656361 1048498082 /nfs/dbraw/zinc/49/80/82/1048498082.db2.gz LOKBTUUEGBHRCQ-UHFFFAOYSA-N 1 2 319.767 4.285 20 0 DIADLO Cc1ccc(Cl)c(CNc2ccc(N3CCCC3)[nH+]c2)c1F ZINC001163655856 1048498151 /nfs/dbraw/zinc/49/81/51/1048498151.db2.gz QKHMFYWOIUWLRY-UHFFFAOYSA-N 1 2 319.811 4.395 20 0 DIADLO Cc1cn2c(cccc2NC(=O)Nc2cccc(Cl)c2F)[nH+]1 ZINC001188376085 1048503015 /nfs/dbraw/zinc/50/30/15/1048503015.db2.gz OVOPCGPVNXUXAH-UHFFFAOYSA-N 1 2 318.739 4.079 20 0 DIADLO COc1ccc(CCNc2[nH+]cccc2-c2ccccc2)cc1O ZINC001163726361 1048511761 /nfs/dbraw/zinc/51/17/61/1048511761.db2.gz NQNYHVQBCRETIE-UHFFFAOYSA-N 1 2 320.392 4.117 20 0 DIADLO COc1cc(C)[nH+]c(CSC[C@H](OC)c2ccc(F)cc2)c1 ZINC000600625783 1048514386 /nfs/dbraw/zinc/51/43/86/1048514386.db2.gz ORGMPMQSWOXNQZ-KRWDZBQOSA-N 1 2 321.417 4.159 20 0 DIADLO Cc1cc(C)cc(CNc2cccc(Cc3ccncc3)[nH+]2)c1 ZINC001163751089 1048517131 /nfs/dbraw/zinc/51/71/31/1048517131.db2.gz HKLLVLCFWRZXSB-UHFFFAOYSA-N 1 2 303.409 4.296 20 0 DIADLO FC(F)Oc1ccccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001176013004 1048533793 /nfs/dbraw/zinc/53/37/93/1048533793.db2.gz VFAXLOICJGOCQK-UHFFFAOYSA-N 1 2 315.323 4.276 20 0 DIADLO C[C@@H]1Cc2cc(Br)ccc2C[N@@H+]1CCC(F)(F)F ZINC001202368320 1048533819 /nfs/dbraw/zinc/53/38/19/1048533819.db2.gz NCUYUQYJMAXVAR-SECBINFHSA-N 1 2 322.168 4.148 20 0 DIADLO C[C@@H]1Cc2cc(Br)ccc2C[N@H+]1CCC(F)(F)F ZINC001202368320 1048533833 /nfs/dbraw/zinc/53/38/33/1048533833.db2.gz NCUYUQYJMAXVAR-SECBINFHSA-N 1 2 322.168 4.148 20 0 DIADLO Cc1nc(N[C@@H]2CCc3cc(Cl)ccc32)c2c([nH+]1)CCCC2 ZINC001163902450 1048548351 /nfs/dbraw/zinc/54/83/51/1048548351.db2.gz VXQSCLGBAPXTRE-QGZVFWFLSA-N 1 2 313.832 4.417 20 0 DIADLO Cn1c(CNc2ccc(Cn3cc[nH+]c3)cc2)cc2ccccc21 ZINC001163946646 1048555115 /nfs/dbraw/zinc/55/51/15/1048555115.db2.gz KNJCJXPBGLOHCL-UHFFFAOYSA-N 1 2 316.408 4.035 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1cccc(OC2CCCC2)c1 ZINC001176099951 1048564952 /nfs/dbraw/zinc/56/49/52/1048564952.db2.gz LGAZMCDWYREVGO-UHFFFAOYSA-N 1 2 307.397 4.238 20 0 DIADLO COc1cc(Nc2ccc[nH+]c2N2CCCCC2)c(F)cc1F ZINC001176106408 1048566936 /nfs/dbraw/zinc/56/69/36/1048566936.db2.gz BDDQVFOMPHIQLT-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO c1cc2cc(N[C@H](c3ccccc3)c3ccncc3)[nH+]cc2[nH]1 ZINC001164065698 1048573397 /nfs/dbraw/zinc/57/33/97/1048573397.db2.gz IQDSRTJIKIWSEW-LJQANCHMSA-N 1 2 300.365 4.159 20 0 DIADLO COc1cc[nH+]cc1Nc1nc(Cl)c(Cl)cc1Cl ZINC001176119615 1048574160 /nfs/dbraw/zinc/57/41/60/1048574160.db2.gz WKAPWWBNKHBGJF-UHFFFAOYSA-N 1 2 304.564 4.189 20 0 DIADLO COc1cc[nH+]cc1Nc1ccnc2cc(C(F)(F)F)ccc21 ZINC001176117156 1048574411 /nfs/dbraw/zinc/57/44/11/1048574411.db2.gz UEZQORTVNINUBX-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(F)c(C(F)(F)F)cc1F ZINC001176122607 1048575554 /nfs/dbraw/zinc/57/55/54/1048575554.db2.gz CWNZIBXAZJOCJA-UHFFFAOYSA-N 1 2 304.218 4.131 20 0 DIADLO COc1cc[nH+]cc1Nc1cc2ncccc2c(C(F)(F)F)c1 ZINC001176124645 1048575672 /nfs/dbraw/zinc/57/56/72/1048575672.db2.gz SUTFNDXMECPDBG-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(Br)c(C)cc1F ZINC001176123948 1048575732 /nfs/dbraw/zinc/57/57/32/1048575732.db2.gz ZKJXDNPDROQOFT-UHFFFAOYSA-N 1 2 311.154 4.044 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(C(F)(F)F)c(F)c1F ZINC001176123143 1048577391 /nfs/dbraw/zinc/57/73/91/1048577391.db2.gz KDQIMIQEZKSOKU-UHFFFAOYSA-N 1 2 304.218 4.131 20 0 DIADLO Cc1cccc2c(C)cc(N3CC[C@H](CF)C(F)(F)C3)[nH+]c12 ZINC001164093065 1048580720 /nfs/dbraw/zinc/58/07/20/1048580720.db2.gz XXVDUTCKGQBSBC-CYBMUJFWSA-N 1 2 308.347 4.283 20 0 DIADLO COc1ccc(Nc2ccc3c(c2)[nH+]cn3C)c(C(F)(F)F)c1 ZINC001213050039 1048580999 /nfs/dbraw/zinc/58/09/99/1048580999.db2.gz XSBYISKIYNVIRJ-UHFFFAOYSA-N 1 2 321.302 4.344 20 0 DIADLO CC(C)C[C@H](C(=O)N1CCC[C@H]1CC1CCCC1)n1cc[nH+]c1 ZINC001164104818 1048582494 /nfs/dbraw/zinc/58/24/94/1048582494.db2.gz KHXCTBWMLWEJMK-ZWKOTPCHSA-N 1 2 317.477 4.042 20 0 DIADLO Cc1c(F)cccc1NC(=O)Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001189052564 1048585989 /nfs/dbraw/zinc/58/59/89/1048585989.db2.gz UZQDFGZPKDVGSO-UHFFFAOYSA-N 1 2 324.359 4.023 20 0 DIADLO COc1cc2cc[nH+]c(N3CC[C@H](C)C(F)(F)CC3)c2cc1F ZINC001164118804 1048587667 /nfs/dbraw/zinc/58/76/67/1048587667.db2.gz ZVZKZVQCLYTTER-NSHDSACASA-N 1 2 324.346 4.254 20 0 DIADLO CNc1ccc(CNc2cc[nH+]c3[nH]cc(C(F)(F)F)c32)cc1 ZINC001164153823 1048595626 /nfs/dbraw/zinc/59/56/26/1048595626.db2.gz BCVQQWGNZIFWRI-UHFFFAOYSA-N 1 2 320.318 4.236 20 0 DIADLO COc1ccc(CCCNc2cc3cc(F)ccc3c[nH+]2)cc1 ZINC001164190324 1048603576 /nfs/dbraw/zinc/60/35/76/1048603576.db2.gz PSMWDMYWPUPWKW-UHFFFAOYSA-N 1 2 310.372 4.427 20 0 DIADLO c1ccn(-c2ccc(NCc3cnc4ccccc4c3)[nH+]c2)c1 ZINC001164197130 1048604840 /nfs/dbraw/zinc/60/48/40/1048604840.db2.gz LTUOSLLYYBXFJB-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO FC(F)(F)c1cc(Cl)c(Cl)cc1CCn1cc[nH+]c1 ZINC001250319445 1048609897 /nfs/dbraw/zinc/60/98/97/1048609897.db2.gz DOIQKGMBZCDNAZ-UHFFFAOYSA-N 1 2 309.118 4.451 20 0 DIADLO COc1cccc2c(NCCSCc3ccco3)cc[nH+]c12 ZINC001164226608 1048610600 /nfs/dbraw/zinc/61/06/00/1048610600.db2.gz BRJDXFIHXYPSDK-UHFFFAOYSA-N 1 2 314.410 4.182 20 0 DIADLO O=C1CCc2cc(Nc3cc[nH+]c4ccc(Cl)cc34)ccc21 ZINC001176232892 1048612719 /nfs/dbraw/zinc/61/27/19/1048612719.db2.gz UEZBCQZEKHQORY-UHFFFAOYSA-N 1 2 308.768 4.183 20 0 DIADLO Fc1ccc(CNc2ccc([NH+]3CCCC3)cc2)c(F)c1F ZINC000850044664 1048613125 /nfs/dbraw/zinc/61/31/25/1048613125.db2.gz TWOLTPSVIJAYIO-UHFFFAOYSA-N 1 2 306.331 4.316 20 0 DIADLO Cc1cc(Cl)c(C)c(N2CC[C@@](CF)(C(F)(F)F)C2)[nH+]1 ZINC001164265937 1048615889 /nfs/dbraw/zinc/61/58/89/1048615889.db2.gz DOXKHRHAGILWDZ-LBPRGKRZSA-N 1 2 310.722 4.080 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000482486353 1048616697 /nfs/dbraw/zinc/61/66/97/1048616697.db2.gz MNGDSJCWVDOOSK-PSASIEDQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000482486353 1048616706 /nfs/dbraw/zinc/61/67/06/1048616706.db2.gz MNGDSJCWVDOOSK-PSASIEDQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@@H]1C[N@H+](CCSc2ccc(Cl)cc2Cl)C[C@H](C)O1 ZINC001189358960 1048623553 /nfs/dbraw/zinc/62/35/53/1048623553.db2.gz UCNHLKGFWIGSEQ-PHIMTYICSA-N 1 2 320.285 4.195 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000482505178 1048620733 /nfs/dbraw/zinc/62/07/33/1048620733.db2.gz HTQLQVCZXDPFBO-WPRPVWTQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)c(F)cc1F ZINC000482505178 1048620737 /nfs/dbraw/zinc/62/07/37/1048620737.db2.gz HTQLQVCZXDPFBO-WPRPVWTQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000482505176 1048621217 /nfs/dbraw/zinc/62/12/17/1048621217.db2.gz HTQLQVCZXDPFBO-SCZZXKLOSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)c(F)cc1F ZINC000482505176 1048621225 /nfs/dbraw/zinc/62/12/25/1048621225.db2.gz HTQLQVCZXDPFBO-SCZZXKLOSA-N 1 2 311.269 4.267 20 0 DIADLO Cc1nnsc1C[N@@H+](C)[C@@H](c1ccccc1Cl)C(C)C ZINC000567989587 1048621733 /nfs/dbraw/zinc/62/17/33/1048621733.db2.gz KRQMERRBVSJQGM-OAHLLOKOSA-N 1 2 309.866 4.329 20 0 DIADLO Cc1nnsc1C[N@H+](C)[C@@H](c1ccccc1Cl)C(C)C ZINC000567989587 1048621737 /nfs/dbraw/zinc/62/17/37/1048621737.db2.gz KRQMERRBVSJQGM-OAHLLOKOSA-N 1 2 309.866 4.329 20 0 DIADLO CCCOc1ccc(C[NH2+]Cc2nnc(C(C)C)s2)c(C)c1 ZINC000850184449 1048622048 /nfs/dbraw/zinc/62/20/48/1048622048.db2.gz XZXQEVRAFUXGBM-UHFFFAOYSA-N 1 2 319.474 4.049 20 0 DIADLO C[C@@H]1C[N@@H+](CCSc2ccc(Cl)cc2Cl)C[C@H](C)O1 ZINC001189358960 1048623544 /nfs/dbraw/zinc/62/35/44/1048623544.db2.gz UCNHLKGFWIGSEQ-PHIMTYICSA-N 1 2 320.285 4.195 20 0 DIADLO C[C@@H](SCc1ccc[nH+]c1N)c1cccc(Br)c1 ZINC001189424120 1048627323 /nfs/dbraw/zinc/62/73/23/1048627323.db2.gz RZEFVCUVSPFZGR-SNVBAGLBSA-N 1 2 323.259 4.421 20 0 DIADLO Fc1cc(F)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c(F)c1F ZINC001176348734 1048628241 /nfs/dbraw/zinc/62/82/41/1048628241.db2.gz DOLRWVWJUIKKCO-UHFFFAOYSA-N 1 2 321.277 4.231 20 0 DIADLO c1[nH+]c(SC2CC(OCc3ccccc3)C2)n2ccccc12 ZINC001164551566 1048641066 /nfs/dbraw/zinc/64/10/66/1048641066.db2.gz MAQGBZKEVVVDIR-UHFFFAOYSA-N 1 2 310.422 4.174 20 0 DIADLO O=C(c1cccc(C2CCCC2)c1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000668089624 1048646040 /nfs/dbraw/zinc/64/60/40/1048646040.db2.gz YHZPUVVVWUBEFO-SFHVURJKSA-N 1 2 323.440 4.087 20 0 DIADLO Oc1ccc2cc(Nc3ccc(-n4cc[nH+]c4)cc3)ccc2c1 ZINC001176387460 1048653587 /nfs/dbraw/zinc/65/35/87/1048653587.db2.gz QSBQRJAQDJGJMY-UHFFFAOYSA-N 1 2 301.349 4.475 20 0 DIADLO Cc1ncc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)cn1 ZINC001176392619 1048656310 /nfs/dbraw/zinc/65/63/10/1048656310.db2.gz KNPVLQPICMRWQS-UHFFFAOYSA-N 1 2 304.275 4.096 20 0 DIADLO Fc1ccc2c(c1)CC[N@@H+](Cc1cnc(-c3ccco3)s1)C2 ZINC000194471710 1048662097 /nfs/dbraw/zinc/66/20/97/1048662097.db2.gz RTNLKGCLILBLRG-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1ccc2c(c1)CC[N@H+](Cc1cnc(-c3ccco3)s1)C2 ZINC000194471710 1048662106 /nfs/dbraw/zinc/66/21/06/1048662106.db2.gz RTNLKGCLILBLRG-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO CCCCC[C@H]([NH2+]Cc1nnc(OCC)s1)c1ccccc1 ZINC000775318992 1048662445 /nfs/dbraw/zinc/66/24/45/1048662445.db2.gz AVCNBCUOOMVQRN-HNNXBMFYSA-N 1 2 319.474 4.348 20 0 DIADLO c1cn2c(cccc2Nc2ccc(Oc3ccccc3)nc2)[nH+]1 ZINC001176375374 1048666495 /nfs/dbraw/zinc/66/64/95/1048666495.db2.gz JCTQCLJSIMULMR-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO COc1ccc2[nH+]c(N3CCC4(CC(F)C4)CC3)cc(C)c2c1 ZINC001165308961 1048679212 /nfs/dbraw/zinc/67/92/12/1048679212.db2.gz JBXUCYHHUNMWBN-UHFFFAOYSA-N 1 2 314.404 4.270 20 0 DIADLO Fc1cc(Nc2ccccc2-n2cc[nH+]c2)cc(N2CCCC2)c1 ZINC001176418789 1048682201 /nfs/dbraw/zinc/68/22/01/1048682201.db2.gz KPNYIXMSCFNNKS-UHFFFAOYSA-N 1 2 322.387 4.355 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccn1)c1ccccc1SC(C)(C)C ZINC000850553428 1048688975 /nfs/dbraw/zinc/68/89/75/1048688975.db2.gz YRQBDFXCOBKWOF-CYBMUJFWSA-N 1 2 301.459 4.218 20 0 DIADLO O=C(c1ccccc1-n1cc[nH+]c1)N1CCC[C@@H]1C1CCCCC1 ZINC001190098523 1048694892 /nfs/dbraw/zinc/69/48/92/1048694892.db2.gz SRPWZHXNSBJDGF-GOSISDBHSA-N 1 2 323.440 4.057 20 0 DIADLO c1ccc(COc2cc(NCCCc3ccncc3)cc[nH+]2)cc1 ZINC001165525203 1048694924 /nfs/dbraw/zinc/69/49/24/1048694924.db2.gz QZJISFKWKLBQBW-UHFFFAOYSA-N 1 2 319.408 4.100 20 0 DIADLO c1cn(Cc2ccc(Nc3cccc(OCC4CC4)c3)cc2)c[nH+]1 ZINC001176492132 1048696482 /nfs/dbraw/zinc/69/64/82/1048696482.db2.gz VLSSAWXCYDTHFT-UHFFFAOYSA-N 1 2 319.408 4.464 20 0 DIADLO c1cn(-c2ccccc2Nc2cccc(OCC3CC3)c2)c[nH+]1 ZINC001176491914 1048697060 /nfs/dbraw/zinc/69/70/60/1048697060.db2.gz PYERLFAOXHFDPI-UHFFFAOYSA-N 1 2 305.381 4.405 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@@H+]1CCO[C@H](c3ccccc3F)C1)CC2 ZINC000482945905 1048709297 /nfs/dbraw/zinc/70/92/97/1048709297.db2.gz KLQPXBVDSQMERV-MOPGFXCFSA-N 1 2 315.363 4.026 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@H+]1CCO[C@H](c3ccccc3F)C1)CC2 ZINC000482945905 1048709309 /nfs/dbraw/zinc/70/93/09/1048709309.db2.gz KLQPXBVDSQMERV-MOPGFXCFSA-N 1 2 315.363 4.026 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncco1)c1ccc(OCC(F)(F)F)cc1 ZINC000924783822 1048743187 /nfs/dbraw/zinc/74/31/87/1048743187.db2.gz ZULSQFWDSQJWHU-MNOVXSKESA-N 1 2 314.307 4.028 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N3CCC[C@H](C)c4ccccc43)ccn12 ZINC000568206352 1048758674 /nfs/dbraw/zinc/75/86/74/1048758674.db2.gz KPKVQGQOJPNMLR-AWEZNQCLSA-N 1 2 319.408 4.187 20 0 DIADLO CCC[C@@]1(C)CCC[N@H+](Cc2nc([C@@H](C)SCC)no2)C1 ZINC000483214330 1048759824 /nfs/dbraw/zinc/75/98/24/1048759824.db2.gz DKINZVWUAQCYIG-CJNGLKHVSA-N 1 2 311.495 4.286 20 0 DIADLO CCC[C@@]1(C)CCC[N@@H+](Cc2nc([C@@H](C)SCC)no2)C1 ZINC000483214330 1048759835 /nfs/dbraw/zinc/75/98/35/1048759835.db2.gz DKINZVWUAQCYIG-CJNGLKHVSA-N 1 2 311.495 4.286 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(-c3ccncc3)cc2)[nH+]1 ZINC001176694095 1048760607 /nfs/dbraw/zinc/76/06/07/1048760607.db2.gz GWINSORFCDUKES-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO Cc1cc(Cl)c(C)c(N2CCCC[C@H]2c2cccnc2)[nH+]1 ZINC001166575646 1048764963 /nfs/dbraw/zinc/76/49/63/1048764963.db2.gz PHKHHCKJYPCRLF-INIZCTEOSA-N 1 2 301.821 4.478 20 0 DIADLO CCCOc1ccc(C(C)(C)[NH2+]Cc2ncc(C3CC3)o2)cc1 ZINC000483265674 1048767454 /nfs/dbraw/zinc/76/74/54/1048767454.db2.gz UOSLPEGQRDHGMF-UHFFFAOYSA-N 1 2 314.429 4.366 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Br)o2)[C@H]1c1ccccc1 ZINC000483282782 1048772896 /nfs/dbraw/zinc/77/28/96/1048772896.db2.gz CCQNMJYIYQUKLN-XHDPSFHLSA-N 1 2 306.203 4.235 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Br)o2)[C@H]1c1ccccc1 ZINC000483282782 1048772910 /nfs/dbraw/zinc/77/29/10/1048772910.db2.gz CCQNMJYIYQUKLN-XHDPSFHLSA-N 1 2 306.203 4.235 20 0 DIADLO Cc1ccc(Br)cc1Cn1c[nH+]c(C(C)(C)C)c1 ZINC001166618816 1048773348 /nfs/dbraw/zinc/77/33/48/1048773348.db2.gz LDWRWYOITXQXPF-UHFFFAOYSA-N 1 2 307.235 4.300 20 0 DIADLO C/C(=C\c1ccccc1)C[NH2+]Cc1noc(-c2ccccc2C)n1 ZINC000483307431 1048775153 /nfs/dbraw/zinc/77/51/53/1048775153.db2.gz KVEAXZQREGYLDY-NTCAYCPXSA-N 1 2 319.408 4.238 20 0 DIADLO Fc1ccc(-c2cc(Nc3ccc[nH+]c3N3CCCC3)on2)cc1 ZINC001176750360 1048777451 /nfs/dbraw/zinc/77/74/51/1048777451.db2.gz QBHFXZAHABWQKA-UHFFFAOYSA-N 1 2 324.359 4.220 20 0 DIADLO Clc1cc(Cl)c(Nc2ccc[nH+]c2N2CCCC2)cn1 ZINC001176749779 1048777537 /nfs/dbraw/zinc/77/75/37/1048777537.db2.gz KFMLIZYFQJWIPH-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO FC(F)(F)Oc1ccccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176748795 1048777862 /nfs/dbraw/zinc/77/78/62/1048777862.db2.gz BSJRNZOWLZYJCX-UHFFFAOYSA-N 1 2 323.318 4.324 20 0 DIADLO COc1ccc(Cl)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176749083 1048777908 /nfs/dbraw/zinc/77/79/08/1048777908.db2.gz SUSIJOLTYYSVBB-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO Fc1cccc2cc(Nc3ccc[nH+]c3N3CCCC3)cnc12 ZINC001176749362 1048778063 /nfs/dbraw/zinc/77/80/63/1048778063.db2.gz DWJIYJGRWJTUBG-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO Brc1cccc(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001176751215 1048778645 /nfs/dbraw/zinc/77/86/45/1048778645.db2.gz ZAOBRDFCDVNKIR-UHFFFAOYSA-N 1 2 318.218 4.188 20 0 DIADLO Cc1nc(Nc2ccc[nH+]c2N2CCCC2)c(Cl)cc1Cl ZINC001176743827 1048778722 /nfs/dbraw/zinc/77/87/22/1048778722.db2.gz OAXLWFSYSAHMQF-UHFFFAOYSA-N 1 2 323.227 4.436 20 0 DIADLO c1ncc(-c2cccc(Nc3ccc[nH+]c3N3CCCC3)c2)o1 ZINC001176751056 1048778783 /nfs/dbraw/zinc/77/87/83/1048778783.db2.gz UUOYLJYRVXFYQI-UHFFFAOYSA-N 1 2 306.369 4.080 20 0 DIADLO Clc1cc(Nc2ccc[nH+]c2N2CCCC2)c(Cl)cn1 ZINC001176749485 1048778955 /nfs/dbraw/zinc/77/89/55/1048778955.db2.gz GCJMSMSMOLPLRE-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO Clc1cc(Nc2ccc[nH+]c2N2CCCC2)cnc1Cl ZINC001176750820 1048779323 /nfs/dbraw/zinc/77/93/23/1048779323.db2.gz XRBYUZSPJKTGSJ-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO c1ccc(COC[C@@H]2CCN2c2[nH+]ccc3ccccc32)cc1 ZINC001166670749 1048779595 /nfs/dbraw/zinc/77/95/95/1048779595.db2.gz YKPDXMNCROYNAE-SFHVURJKSA-N 1 2 304.393 4.030 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccsc2Cl)o1 ZINC000483320166 1048781144 /nfs/dbraw/zinc/78/11/44/1048781144.db2.gz LVNFNQHMIXINDD-ZDUSSCGKSA-N 1 2 311.834 4.478 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccsc2Cl)o1 ZINC000483320166 1048781155 /nfs/dbraw/zinc/78/11/55/1048781155.db2.gz LVNFNQHMIXINDD-ZDUSSCGKSA-N 1 2 311.834 4.478 20 0 DIADLO Cc1cc(N(C)Cc2cccc3cccnc32)nc(C(C)C)[nH+]1 ZINC001166687903 1048783373 /nfs/dbraw/zinc/78/33/73/1048783373.db2.gz HAVRYOHDAUDYGW-UHFFFAOYSA-N 1 2 306.413 4.093 20 0 DIADLO C[C@H](C(=O)Nc1ccc2ccccc2c1)[N@H+](C)Cc1ccsc1 ZINC000007927072 1048788895 /nfs/dbraw/zinc/78/88/95/1048788895.db2.gz FNZYRSCVFSJSBO-CQSZACIVSA-N 1 2 324.449 4.360 20 0 DIADLO C[C@H](C(=O)Nc1ccc2ccccc2c1)[N@@H+](C)Cc1ccsc1 ZINC000007927072 1048788908 /nfs/dbraw/zinc/78/89/08/1048788908.db2.gz FNZYRSCVFSJSBO-CQSZACIVSA-N 1 2 324.449 4.360 20 0 DIADLO COC(C)(C)[C@H]1CCCN1c1[nH+]ccc2cc(Cl)ccc21 ZINC001166791123 1048795132 /nfs/dbraw/zinc/79/51/32/1048795132.db2.gz CUECABLHXSWIAE-OAHLLOKOSA-N 1 2 304.821 4.282 20 0 DIADLO CC(C)c1ccc(N(Cc2ccccc2)C2CCOCC2)[nH+]c1 ZINC001166811408 1048798629 /nfs/dbraw/zinc/79/86/29/1048798629.db2.gz DJZSPSPNEXNEJM-UHFFFAOYSA-N 1 2 310.441 4.391 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1cc(F)ccc1OC(F)F)C2 ZINC001190903899 1048805840 /nfs/dbraw/zinc/80/58/40/1048805840.db2.gz GRVSGWZTDDRNRN-UHFFFAOYSA-N 1 2 321.342 4.294 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1cc(F)ccc1OC(F)F)C2 ZINC001190903899 1048805870 /nfs/dbraw/zinc/80/58/70/1048805870.db2.gz GRVSGWZTDDRNRN-UHFFFAOYSA-N 1 2 321.342 4.294 20 0 DIADLO CCC[C@@H]([NH2+]Cc1cnon1)c1ccc(Cl)c(Cl)c1 ZINC000851898943 1048811890 /nfs/dbraw/zinc/81/18/90/1048811890.db2.gz RJWJLIHVPJJGCA-CYBMUJFWSA-N 1 2 300.189 4.007 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001167016330 1048830423 /nfs/dbraw/zinc/83/04/23/1048830423.db2.gz LETWGAUODWNFAQ-NHYWBVRUSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001167016330 1048830444 /nfs/dbraw/zinc/83/04/44/1048830444.db2.gz LETWGAUODWNFAQ-NHYWBVRUSA-N 1 2 302.245 4.035 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccccc2)[C@@H]2COC(C)(C)C2)s1 ZINC000852342621 1048836484 /nfs/dbraw/zinc/83/64/84/1048836484.db2.gz HIJBLKIUDKNRMW-INIZCTEOSA-N 1 2 316.470 4.021 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccccc2)[C@@H]2COC(C)(C)C2)s1 ZINC000852342621 1048836505 /nfs/dbraw/zinc/83/65/05/1048836505.db2.gz HIJBLKIUDKNRMW-INIZCTEOSA-N 1 2 316.470 4.021 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1csc(-c3ccccn3)n1)C2 ZINC000483652878 1048837690 /nfs/dbraw/zinc/83/76/90/1048837690.db2.gz LJQMWJQSPBPLBQ-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1csc(-c3ccccn3)n1)C2 ZINC000483652878 1048837703 /nfs/dbraw/zinc/83/77/03/1048837703.db2.gz LJQMWJQSPBPLBQ-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@@H+]2CC(=O)OC(C)(C)C)o1 ZINC001191113526 1048854317 /nfs/dbraw/zinc/85/43/17/1048854317.db2.gz YLCVFUDLLAIJPR-HNNXBMFYSA-N 1 2 307.434 4.101 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@H+]2CC(=O)OC(C)(C)C)o1 ZINC001191113526 1048854337 /nfs/dbraw/zinc/85/43/37/1048854337.db2.gz YLCVFUDLLAIJPR-HNNXBMFYSA-N 1 2 307.434 4.101 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccccc2OCC(F)(F)F)cc1 ZINC000157706879 1048861251 /nfs/dbraw/zinc/86/12/51/1048861251.db2.gz USQNDQDWVUWTKE-UHFFFAOYSA-N 1 2 324.346 4.306 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1nc2ccc(C)cc2[nH]1 ZINC000483850805 1048867780 /nfs/dbraw/zinc/86/77/80/1048867780.db2.gz KNSUTAMFCMGGRF-CQSZACIVSA-N 1 2 309.413 4.039 20 0 DIADLO FC(F)(F)c1sccc1C[NH2+]Cc1nc2ccccc2o1 ZINC001203319735 1048869011 /nfs/dbraw/zinc/86/90/11/1048869011.db2.gz ATKROHLCDJSBSS-UHFFFAOYSA-N 1 2 312.316 4.198 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1ncc(C(C)C)s1 ZINC001177315092 1048870464 /nfs/dbraw/zinc/87/04/64/1048870464.db2.gz JNMDEGDGUVBOJY-NSHDSACASA-N 1 2 308.422 4.265 20 0 DIADLO C[C@H](CCCC(F)(F)F)Nc1ccc(N2CCCC2)[nH+]c1 ZINC000163281974 1048874380 /nfs/dbraw/zinc/87/43/80/1048874380.db2.gz AGWLPPJCUGGELZ-GFCCVEGCSA-N 1 2 301.356 4.215 20 0 DIADLO Brc1ccc(CNc2cccc[nH+]2)c2ncccc12 ZINC001177370400 1048874522 /nfs/dbraw/zinc/87/45/22/1048874522.db2.gz DRVQVTGCSHYEHA-UHFFFAOYSA-N 1 2 314.186 4.004 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3cccc(OCC(C)C)c3)n2c1 ZINC001177349426 1048877568 /nfs/dbraw/zinc/87/75/68/1048877568.db2.gz SVTRFYGVOGURRD-UHFFFAOYSA-N 1 2 309.413 4.290 20 0 DIADLO COc1ccc(Nc2ccc(C)[nH+]c2C)c(Br)c1 ZINC001203373282 1048879308 /nfs/dbraw/zinc/87/93/08/1048879308.db2.gz KDIKSBUBHQFRTJ-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Fc1ccc2oc(CNc3ccc(-n4cc[nH+]c4)cc3)cc2c1 ZINC001177387165 1048881705 /nfs/dbraw/zinc/88/17/05/1048881705.db2.gz AKIWYTSADSCIHK-UHFFFAOYSA-N 1 2 307.328 4.370 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1cnc(CC(C)C)s1 ZINC001177363639 1048882138 /nfs/dbraw/zinc/88/21/38/1048882138.db2.gz XMGRJNFDXWOVCJ-UHFFFAOYSA-N 1 2 303.475 4.328 20 0 DIADLO Clc1ccc(OC2CCCC2)c(C[NH2+]Cc2nccs2)c1 ZINC001177408194 1048883388 /nfs/dbraw/zinc/88/33/88/1048883388.db2.gz XYWSVSCVOPMYLT-UHFFFAOYSA-N 1 2 322.861 4.408 20 0 DIADLO Cc1ccc(Nc2cccc(C)c2N2CCCCC2=O)c(C)[nH+]1 ZINC001203380516 1048887697 /nfs/dbraw/zinc/88/76/97/1048887697.db2.gz KFJBFOSOPXLMCV-UHFFFAOYSA-N 1 2 309.413 4.267 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+]([C@@H](C)c1nc(-c3ccccc3)no1)C2 ZINC000483990978 1048889586 /nfs/dbraw/zinc/88/95/86/1048889586.db2.gz GPSURZZBBLVBLK-HNNXBMFYSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+]([C@@H](C)c1nc(-c3ccccc3)no1)C2 ZINC000483990978 1048889606 /nfs/dbraw/zinc/88/96/06/1048889606.db2.gz GPSURZZBBLVBLK-HNNXBMFYSA-N 1 2 319.408 4.164 20 0 DIADLO CCC[C@@]1(C)CCC[N@@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191254724 1048895826 /nfs/dbraw/zinc/89/58/26/1048895826.db2.gz BMVMSINBWHDFIX-AEFFLSMTSA-N 1 2 323.864 4.456 20 0 DIADLO CCC[C@@]1(C)CCC[N@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191254724 1048895829 /nfs/dbraw/zinc/89/58/29/1048895829.db2.gz BMVMSINBWHDFIX-AEFFLSMTSA-N 1 2 323.864 4.456 20 0 DIADLO CCC[C@]1(C)CCC[N@@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191254725 1048897879 /nfs/dbraw/zinc/89/78/79/1048897879.db2.gz BMVMSINBWHDFIX-FUHWJXTLSA-N 1 2 323.864 4.456 20 0 DIADLO CCC[C@]1(C)CCC[N@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191254725 1048897887 /nfs/dbraw/zinc/89/78/87/1048897887.db2.gz BMVMSINBWHDFIX-FUHWJXTLSA-N 1 2 323.864 4.456 20 0 DIADLO CC(C)CCOc1cccc(NCc2cccc3[nH+]ccn32)c1 ZINC001177506879 1048903062 /nfs/dbraw/zinc/90/30/62/1048903062.db2.gz VORKYSDULSJZBO-UHFFFAOYSA-N 1 2 309.413 4.371 20 0 DIADLO CNc1ccc(Nc2cc3ncccc3c(C(F)(F)F)c2)c[nH+]1 ZINC001203462032 1048907345 /nfs/dbraw/zinc/90/73/45/1048907345.db2.gz GAQRFFFEGQBRDA-UHFFFAOYSA-N 1 2 318.302 4.434 20 0 DIADLO CC(C)n1ccn(C[NH+]2CCC(c3ccco3)CC2)c1=S ZINC000853527440 1048908471 /nfs/dbraw/zinc/90/84/71/1048908471.db2.gz UESMHZNZAYKRGN-UHFFFAOYSA-N 1 2 305.447 4.030 20 0 DIADLO Cc1ccc2[nH+]c(NCc3conc3Cc3ccccc3)[nH]c2c1 ZINC001203478569 1048909800 /nfs/dbraw/zinc/90/98/00/1048909800.db2.gz DZURBKXNUFVMIA-UHFFFAOYSA-N 1 2 318.380 4.062 20 0 DIADLO CCCc1nc(C)c(CO[NH+]=C(N)c2cccc3ccccc32)o1 ZINC000853663240 1048912884 /nfs/dbraw/zinc/91/28/84/1048912884.db2.gz WXJQEWLTCZIQPW-UHFFFAOYSA-N 1 2 323.396 4.135 20 0 DIADLO COc1cc(CNc2c[nH+]c(C)c(C)c2)cc(C(F)(F)F)c1 ZINC001203491489 1048915018 /nfs/dbraw/zinc/91/50/18/1048915018.db2.gz LTIANAUDIJSYDH-UHFFFAOYSA-N 1 2 310.319 4.338 20 0 DIADLO Nc1c(Cl)cccc1CNc1[nH+]c2ccccc2n1C1CC1 ZINC001203536204 1048925124 /nfs/dbraw/zinc/92/51/24/1048925124.db2.gz INTTYPSYVCFERP-UHFFFAOYSA-N 1 2 312.804 4.219 20 0 DIADLO c1cn2c(cccc2Nc2cncc(Oc3ccccc3)c2)[nH+]1 ZINC001203555276 1048926711 /nfs/dbraw/zinc/92/67/11/1048926711.db2.gz IKKFAQQOLCRQLO-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO COc1ccc(Nc2cc(C)c[nH+]c2C)c(Br)c1 ZINC001203661686 1048954354 /nfs/dbraw/zinc/95/43/54/1048954354.db2.gz YPORBUUDBHCWMM-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO COc1c(Br)cccc1Nc1cc(C)c[nH+]c1C ZINC001203663234 1048954371 /nfs/dbraw/zinc/95/43/71/1048954371.db2.gz FSHZUMVSFAUWLV-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Fc1ccc2nc(NCc3ccc(-n4cc[nH+]c4)cc3)sc2c1 ZINC000776699368 1048930178 /nfs/dbraw/zinc/93/01/78/1048930178.db2.gz MPJLTRWELYRFHG-UHFFFAOYSA-N 1 2 324.384 4.233 20 0 DIADLO CCN(C)c1ccccc1C[NH2+]Cc1c(F)ccc(F)c1Cl ZINC001177693406 1048935113 /nfs/dbraw/zinc/93/51/13/1048935113.db2.gz QVKVHAHFQRRYBX-UHFFFAOYSA-N 1 2 324.802 4.364 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@@H](C)c1cccc(O)c1)c1ccco1 ZINC000194876499 1048942170 /nfs/dbraw/zinc/94/21/70/1048942170.db2.gz BTQNBHNDQGLBIE-WMLDXEAASA-N 1 2 303.402 4.050 20 0 DIADLO CCCOc1ccc(-c2cccc(Cn3cc[nH+]c3)c2)c(OC)c1 ZINC000854171997 1048947998 /nfs/dbraw/zinc/94/79/98/1048947998.db2.gz MKMBHAAMWCLVCQ-UHFFFAOYSA-N 1 2 322.408 4.396 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cc(C)c(Br)c(C)n2)c1 ZINC001203653091 1048948936 /nfs/dbraw/zinc/94/89/36/1048948936.db2.gz GPYVGHLJDZHEGB-UHFFFAOYSA-N 1 2 306.207 4.216 20 0 DIADLO O[C@H](c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1)C1CCC1 ZINC000854203020 1048950308 /nfs/dbraw/zinc/95/03/08/1048950308.db2.gz NBZDKGDJUZDWKJ-NRFANRHFSA-N 1 2 318.420 4.432 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc3c(cnn3[C@@H]3CCCCO3)c2)c1 ZINC001203663439 1048953202 /nfs/dbraw/zinc/95/32/02/1048953202.db2.gz QUQNTUMXUGUFOL-IBGZPJMESA-N 1 2 322.412 4.491 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2c(N)cc(C)cc2Br)c1 ZINC001203663824 1048954032 /nfs/dbraw/zinc/95/40/32/1048954032.db2.gz TUUMZLYIMRHRNO-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2nc(Cl)c(Cl)nc2Cl)c1 ZINC001203661108 1048954183 /nfs/dbraw/zinc/95/41/83/1048954183.db2.gz QFTKDCLYWXAWRX-UHFFFAOYSA-N 1 2 303.580 4.192 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(N3CCSCC3)c(F)c2)c1 ZINC001203663500 1048954519 /nfs/dbraw/zinc/95/45/19/1048954519.db2.gz MYKJKXMRAPDVII-UHFFFAOYSA-N 1 2 317.433 4.134 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(C(=O)OC(C)(C)C)cc2O)c1 ZINC001203668487 1048957910 /nfs/dbraw/zinc/95/79/10/1048957910.db2.gz VMUZOJYMCAYOJK-UHFFFAOYSA-N 1 2 314.385 4.103 20 0 DIADLO CC(=O)Nc1ccc(CNc2ccc3[nH+]c(C)cc(C)c3c2)cc1 ZINC001203676399 1048958495 /nfs/dbraw/zinc/95/84/95/1048958495.db2.gz LNTFRUAUJMHIQC-UHFFFAOYSA-N 1 2 319.408 4.422 20 0 DIADLO Cc1cc(C)c2cc(NCc3nc4ccccc4n3C)ccc2[nH+]1 ZINC001203676258 1048959664 /nfs/dbraw/zinc/95/96/64/1048959664.db2.gz JXACPDBJUXSQNE-UHFFFAOYSA-N 1 2 316.408 4.350 20 0 DIADLO F[C@@H]1C[N@H+](Cc2ccccc2C(F)(F)F)CCCC1(F)F ZINC001203686317 1048962452 /nfs/dbraw/zinc/96/24/52/1048962452.db2.gz FLXIVRVHWKDUGG-GFCCVEGCSA-N 1 2 311.269 4.275 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2ccccc2C(F)(F)F)CCCC1(F)F ZINC001203686317 1048962464 /nfs/dbraw/zinc/96/24/64/1048962464.db2.gz FLXIVRVHWKDUGG-GFCCVEGCSA-N 1 2 311.269 4.275 20 0 DIADLO O=C1CC[N@@H+](Cc2ccccc2C(F)(F)F)[C@@H]2CCCC[C@H]12 ZINC001203684410 1048963039 /nfs/dbraw/zinc/96/30/39/1048963039.db2.gz VDQPPUADTSRELD-DZGCQCFKSA-N 1 2 311.347 4.039 20 0 DIADLO O=C1CC[N@H+](Cc2ccccc2C(F)(F)F)[C@@H]2CCCC[C@H]12 ZINC001203684410 1048963052 /nfs/dbraw/zinc/96/30/52/1048963052.db2.gz VDQPPUADTSRELD-DZGCQCFKSA-N 1 2 311.347 4.039 20 0 DIADLO FC(F)(F)c1ccccc1C[NH+]1CC2(C1)CC(F)(F)CS2 ZINC001203694006 1048964744 /nfs/dbraw/zinc/96/47/44/1048964744.db2.gz UXMREYVDVGWNJE-UHFFFAOYSA-N 1 2 323.330 4.032 20 0 DIADLO Nc1ccnc(Cl)c1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203712515 1048973477 /nfs/dbraw/zinc/97/34/77/1048973477.db2.gz IJERYYZAGFYZLD-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO Cc1ccc(C)c(C[NH+](Cc2ccccn2)Cc2ccccn2)c1 ZINC001203741449 1048974105 /nfs/dbraw/zinc/97/41/05/1048974105.db2.gz SATLKLPVGBWEBH-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc(C(F)(F)F)cc3)n2c1 ZINC001178012798 1048974493 /nfs/dbraw/zinc/97/44/93/1048974493.db2.gz GVRYZBZGKDLGIA-UHFFFAOYSA-N 1 2 305.303 4.274 20 0 DIADLO CN1Cc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc2C1=O ZINC001203719250 1048976058 /nfs/dbraw/zinc/97/60/58/1048976058.db2.gz LNDIVLLYMTUBKW-UHFFFAOYSA-N 1 2 321.424 4.006 20 0 DIADLO c1sc2nccnc2c1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203717470 1048976485 /nfs/dbraw/zinc/97/64/85/1048976485.db2.gz CQHNUQNICAZZCO-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO Fc1ccc2c(Nc3ccc([NH+]4CCCCC4)cc3)cnn2c1 ZINC001203719067 1048977245 /nfs/dbraw/zinc/97/72/45/1048977245.db2.gz QCOHMNVUKCUGGT-UHFFFAOYSA-N 1 2 310.376 4.207 20 0 DIADLO c1cc(Nc2ccc([NH+]3CCCCC3)cc2)cc(C2OCCO2)c1 ZINC001203718793 1048977316 /nfs/dbraw/zinc/97/73/16/1048977316.db2.gz AKLPOSTXVXGWFN-UHFFFAOYSA-N 1 2 324.424 4.466 20 0 DIADLO c1cnc(Nc2ccc([NH+]3CCCCC3)cc2)c(N2CCCC2)c1 ZINC001203719661 1048979266 /nfs/dbraw/zinc/97/92/66/1048979266.db2.gz ZOZLPNYRAGQQLQ-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO O=c1[nH]c2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc2o1 ZINC001203719543 1048979957 /nfs/dbraw/zinc/97/99/57/1048979957.db2.gz PFHAJEWARKAPEQ-UHFFFAOYSA-N 1 2 309.369 4.267 20 0 DIADLO O[C@H]1CCc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc21 ZINC001203726295 1048982133 /nfs/dbraw/zinc/98/21/33/1048982133.db2.gz VWLGDRWYTBVKMR-FQEVSTJZSA-N 1 2 308.425 4.400 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@@H+]2Cc2cccnc2Cl)cc1 ZINC000112635919 1048989672 /nfs/dbraw/zinc/98/96/72/1048989672.db2.gz FVNGBLJRTAHUTO-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@H+]2Cc2cccnc2Cl)cc1 ZINC000112635919 1048989676 /nfs/dbraw/zinc/98/96/76/1048989676.db2.gz FVNGBLJRTAHUTO-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cccn2c(CNc3cccc4c3OC(C)(C)CC4)c[nH+]c12 ZINC001203759706 1048991944 /nfs/dbraw/zinc/99/19/44/1048991944.db2.gz NIBPPDUTMBGQBP-UHFFFAOYSA-N 1 2 321.424 4.358 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3ccc(Cl)cc3C2)cc1F ZINC001203790655 1048997270 /nfs/dbraw/zinc/99/72/70/1048997270.db2.gz MEQOPHPFLFQMJG-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(C[N@H+]2CCc3ccc(Cl)cc3C2)cc1F ZINC001203790655 1048997286 /nfs/dbraw/zinc/99/72/86/1048997286.db2.gz MEQOPHPFLFQMJG-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ncc(Br)s1 ZINC001191790133 1049001036 /nfs/dbraw/zinc/00/10/36/1049001036.db2.gz UKXONLFOACDQAT-WDEREUQCSA-N 1 2 317.296 4.306 20 0 DIADLO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ncc(Br)s1 ZINC001191790133 1049001045 /nfs/dbraw/zinc/00/10/45/1049001045.db2.gz UKXONLFOACDQAT-WDEREUQCSA-N 1 2 317.296 4.306 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000776767175 1049001882 /nfs/dbraw/zinc/00/18/82/1049001882.db2.gz ZQKQXJFNRZXTFU-AWEZNQCLSA-N 1 2 323.440 4.119 20 0 DIADLO COc1cc(C)ccc1CNc1ccc(N2CCCCC2)[nH+]c1 ZINC001178253714 1049003989 /nfs/dbraw/zinc/00/39/89/1049003989.db2.gz FHHGWTCKJKFGGB-UHFFFAOYSA-N 1 2 311.429 4.001 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1noc([C@@H](F)CC2CCCCC2)n1 ZINC000904261793 1049012802 /nfs/dbraw/zinc/01/28/02/1049012802.db2.gz OCSIKPGUHWRZPP-ZDUSSCGKSA-N 1 2 304.369 4.003 20 0 DIADLO Clc1ccc(C[NH+](Cc2ccccn2)Cc2ccccn2)cc1 ZINC001203918337 1049033097 /nfs/dbraw/zinc/03/30/97/1049033097.db2.gz SWKDVESJYLBEEN-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO COc1ccc(CC[C@@H](C)Nc2c[nH+]c3c(c2)CCCC3)cc1 ZINC001178473013 1049043814 /nfs/dbraw/zinc/04/38/14/1049043814.db2.gz LLGQADYDRCNZMB-OAHLLOKOSA-N 1 2 310.441 4.402 20 0 DIADLO COc1ccnc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2Cl)c1 ZINC000925489115 1049046476 /nfs/dbraw/zinc/04/64/76/1049046476.db2.gz NOMCNUPDGUSWDD-MNOVXSKESA-N 1 2 308.784 4.295 20 0 DIADLO COc1ccc2ccccc2c1C[N@@H+]1Cc2cnc(C)cc2C1 ZINC001203992007 1049053238 /nfs/dbraw/zinc/05/32/38/1049053238.db2.gz ZXRJZAYXHMEAIM-UHFFFAOYSA-N 1 2 304.393 4.068 20 0 DIADLO COc1ccc2ccccc2c1C[N@H+]1Cc2cnc(C)cc2C1 ZINC001203992007 1049053251 /nfs/dbraw/zinc/05/32/51/1049053251.db2.gz ZXRJZAYXHMEAIM-UHFFFAOYSA-N 1 2 304.393 4.068 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@@H](C)c2ccc(C3CC3)cc2)c[nH+]1 ZINC000668396297 1049055211 /nfs/dbraw/zinc/05/52/11/1049055211.db2.gz DCHIACAYILSNSS-HNNXBMFYSA-N 1 2 323.440 4.136 20 0 DIADLO Fc1ccc2c(c1F)C[N@@H+](CCCc1c(F)cccc1F)CC2 ZINC001192235085 1049069665 /nfs/dbraw/zinc/06/96/65/1049069665.db2.gz XYVHBHPFHUAPGO-UHFFFAOYSA-N 1 2 323.333 4.234 20 0 DIADLO Fc1ccc2c(c1F)C[N@H+](CCCc1c(F)cccc1F)CC2 ZINC001192235085 1049069681 /nfs/dbraw/zinc/06/96/81/1049069681.db2.gz XYVHBHPFHUAPGO-UHFFFAOYSA-N 1 2 323.333 4.234 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1cccc2c1CCC2 ZINC001204079874 1049077789 /nfs/dbraw/zinc/07/77/89/1049077789.db2.gz SVSIBYQWLVRVPO-UHFFFAOYSA-N 1 2 311.816 4.328 20 0 DIADLO CCOc1cc(C[N@@H+]2CCc3ccc(Cl)cc3C2)ccc1O ZINC001204127950 1049090747 /nfs/dbraw/zinc/09/07/47/1049090747.db2.gz OZVYBJDJKGPXJX-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1cc(C[N@H+]2CCc3ccc(Cl)cc3C2)ccc1O ZINC001204127950 1049090760 /nfs/dbraw/zinc/09/07/60/1049090760.db2.gz OZVYBJDJKGPXJX-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CSc1ccc(C[N@@H+]2CCCC[C@@H]2C(=O)OC(C)(C)C)cc1 ZINC001204141892 1049095193 /nfs/dbraw/zinc/09/51/93/1049095193.db2.gz HNABGGZFNOLIIC-MRXNPFEDSA-N 1 2 321.486 4.105 20 0 DIADLO CSc1ccc(C[N@H+]2CCCC[C@@H]2C(=O)OC(C)(C)C)cc1 ZINC001204141892 1049095209 /nfs/dbraw/zinc/09/52/09/1049095209.db2.gz HNABGGZFNOLIIC-MRXNPFEDSA-N 1 2 321.486 4.105 20 0 DIADLO Clc1ccccc1-c1ccc(C[NH2+][C@H]2CCn3ccnc32)o1 ZINC001178778621 1049095555 /nfs/dbraw/zinc/09/55/55/1049095555.db2.gz RMQRBIAIWXIORG-HNNXBMFYSA-N 1 2 313.788 4.031 20 0 DIADLO C[C@@H]([NH2+]Cc1cn(C)nc1Cl)c1ccc(Cl)cc1Cl ZINC000856763579 1049101894 /nfs/dbraw/zinc/10/18/94/1049101894.db2.gz DJTFCIHQHFMZDO-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO FC1(F)CCC[C@H]1[NH2+]Cc1cc(Cl)cc(Br)c1 ZINC001178860232 1049106006 /nfs/dbraw/zinc/10/60/06/1049106006.db2.gz WKMHXAPGWAWDCJ-LLVKDONJSA-N 1 2 324.596 4.380 20 0 DIADLO C[C@H](NC(=O)c1cccc2[nH+]ccn21)c1cc2ccccc2s1 ZINC000776902249 1049111159 /nfs/dbraw/zinc/11/11/59/1049111159.db2.gz RKDUCVYUXCBHIN-LBPRGKRZSA-N 1 2 321.405 4.040 20 0 DIADLO Fc1ccc(C[N@@H+]2CC[C@@H]2COCc2ccccc2)cc1Cl ZINC001204284681 1049128409 /nfs/dbraw/zinc/12/84/09/1049128409.db2.gz PKACELIVQJMKST-MRXNPFEDSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1ccc(C[N@H+]2CC[C@@H]2COCc2ccccc2)cc1Cl ZINC001204284681 1049128417 /nfs/dbraw/zinc/12/84/17/1049128417.db2.gz PKACELIVQJMKST-MRXNPFEDSA-N 1 2 319.807 4.270 20 0 DIADLO CC1(C)C[N@H+](Cc2ccccc2OCc2ccccc2)CCC1=O ZINC001204331273 1049143951 /nfs/dbraw/zinc/14/39/51/1049143951.db2.gz DXJIFDDUMODECP-UHFFFAOYSA-N 1 2 323.436 4.067 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccccc2OCc2ccccc2)CCC1=O ZINC001204331273 1049143956 /nfs/dbraw/zinc/14/39/56/1049143956.db2.gz DXJIFDDUMODECP-UHFFFAOYSA-N 1 2 323.436 4.067 20 0 DIADLO Cc1ccc(C[NH+](Cc2ccccn2)Cc2ccccn2)cc1C ZINC001204353774 1049146573 /nfs/dbraw/zinc/14/65/73/1049146573.db2.gz PYBZZEUWLAFSPQ-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO CCCCCCOc1ccc(C[N@@H+]2CCC(=O)[C@H](C)C2)cc1 ZINC001204365312 1049152071 /nfs/dbraw/zinc/15/20/71/1049152071.db2.gz QLFCCMTVZJRXBX-MRXNPFEDSA-N 1 2 303.446 4.057 20 0 DIADLO CCCCCCOc1ccc(C[N@H+]2CCC(=O)[C@H](C)C2)cc1 ZINC001204365312 1049152076 /nfs/dbraw/zinc/15/20/76/1049152076.db2.gz QLFCCMTVZJRXBX-MRXNPFEDSA-N 1 2 303.446 4.057 20 0 DIADLO Cc1coc(C[NH2+]Cc2c(Cl)cccc2OC(F)F)c1 ZINC001179370070 1049161347 /nfs/dbraw/zinc/16/13/47/1049161347.db2.gz QYVUBNJGZRNDHN-UHFFFAOYSA-N 1 2 301.720 4.133 20 0 DIADLO Cc1ccc2[nH+]c(NCc3ccccc3Br)[nH]c2c1 ZINC001179442737 1049163337 /nfs/dbraw/zinc/16/33/37/1049163337.db2.gz GFUGYAMDGUIYEX-UHFFFAOYSA-N 1 2 316.202 4.246 20 0 DIADLO C[N@H+](Cc1cccc(O)c1)Cc1c(F)cccc1C(F)(F)F ZINC001204455626 1049165663 /nfs/dbraw/zinc/16/56/63/1049165663.db2.gz BBBVWDOTTWUFAG-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO C[N@@H+](Cc1cccc(O)c1)Cc1c(F)cccc1C(F)(F)F ZINC001204455626 1049165667 /nfs/dbraw/zinc/16/56/67/1049165667.db2.gz BBBVWDOTTWUFAG-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO Cc1n[nH]c(CNc2[nH+]c3ccccc3n2C2CCCC2)c1C ZINC001179479160 1049170584 /nfs/dbraw/zinc/17/05/84/1049170584.db2.gz KWEJXCMVIVUMSP-UHFFFAOYSA-N 1 2 309.417 4.103 20 0 DIADLO Fc1ccc(C[N@@H+]2CCc3ccsc3C2)c(C(F)(F)F)c1 ZINC001204481770 1049172464 /nfs/dbraw/zinc/17/24/64/1049172464.db2.gz ODCHLHSIHIYEAG-UHFFFAOYSA-N 1 2 315.335 4.464 20 0 DIADLO Fc1ccc(C[N@H+]2CCc3ccsc3C2)c(C(F)(F)F)c1 ZINC001204481770 1049172472 /nfs/dbraw/zinc/17/24/72/1049172472.db2.gz ODCHLHSIHIYEAG-UHFFFAOYSA-N 1 2 315.335 4.464 20 0 DIADLO Cc1[nH+]cc(CNc2ccc3c(c2)C[C@H](C)O3)n1-c1ccccc1 ZINC001179695929 1049193681 /nfs/dbraw/zinc/19/36/81/1049193681.db2.gz MWJULGMLZVINRD-AWEZNQCLSA-N 1 2 319.408 4.116 20 0 DIADLO C[C@@H](c1nccc2ccccc21)[N@H+](C)Cc1nccn1C(F)F ZINC001204584595 1049194017 /nfs/dbraw/zinc/19/40/17/1049194017.db2.gz GTMPJUBOCGKQNA-LBPRGKRZSA-N 1 2 316.355 4.019 20 0 DIADLO C[C@@H](c1nccc2ccccc21)[N@@H+](C)Cc1nccn1C(F)F ZINC001204584595 1049194026 /nfs/dbraw/zinc/19/40/26/1049194026.db2.gz GTMPJUBOCGKQNA-LBPRGKRZSA-N 1 2 316.355 4.019 20 0 DIADLO COc1cc(C[N@@H+]2Cc3ccccc3OC[C@H]2C)ccc1Cl ZINC001193310651 1049195398 /nfs/dbraw/zinc/19/53/98/1049195398.db2.gz OQFGOSURPUKICI-CYBMUJFWSA-N 1 2 317.816 4.132 20 0 DIADLO COc1cc(C[N@H+]2Cc3ccccc3OC[C@H]2C)ccc1Cl ZINC001193310651 1049195408 /nfs/dbraw/zinc/19/54/08/1049195408.db2.gz OQFGOSURPUKICI-CYBMUJFWSA-N 1 2 317.816 4.132 20 0 DIADLO COc1cc(C[N@H+](Cc2c(F)cccc2F)C2CC2)ccc1C ZINC001193354660 1049200996 /nfs/dbraw/zinc/20/09/96/1049200996.db2.gz DIMGCRDMXJZDFI-UHFFFAOYSA-N 1 2 317.379 4.446 20 0 DIADLO COc1cc(C[N@@H+](Cc2c(F)cccc2F)C2CC2)ccc1C ZINC001193354660 1049201007 /nfs/dbraw/zinc/20/10/07/1049201007.db2.gz DIMGCRDMXJZDFI-UHFFFAOYSA-N 1 2 317.379 4.446 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1cc(F)cc(F)c1 ZINC001179810222 1049209620 /nfs/dbraw/zinc/20/96/20/1049209620.db2.gz MQQGEYRGPMEVSX-UHFFFAOYSA-N 1 2 307.731 4.117 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](C/C=C/c2ccc(F)cc2)CCO1 ZINC001204648904 1049210669 /nfs/dbraw/zinc/21/06/69/1049210669.db2.gz XTVLVMGQWHTFHI-PEAOBZDDSA-N 1 2 311.400 4.221 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](C/C=C/c2ccc(F)cc2)CCO1 ZINC001204648904 1049210684 /nfs/dbraw/zinc/21/06/84/1049210684.db2.gz XTVLVMGQWHTFHI-PEAOBZDDSA-N 1 2 311.400 4.221 20 0 DIADLO CC[C@@]1(C)C[N@@H+]([C@H](C)c2cccc(Br)c2)CCO1 ZINC001193474336 1049214322 /nfs/dbraw/zinc/21/43/22/1049214322.db2.gz WMFJKOAIWJSNCM-DOMZBBRYSA-N 1 2 312.251 4.011 20 0 DIADLO CC[C@@]1(C)C[N@H+]([C@H](C)c2cccc(Br)c2)CCO1 ZINC001193474336 1049214334 /nfs/dbraw/zinc/21/43/34/1049214334.db2.gz WMFJKOAIWJSNCM-DOMZBBRYSA-N 1 2 312.251 4.011 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1cccc(C)c1F ZINC001179862753 1049222807 /nfs/dbraw/zinc/22/28/07/1049222807.db2.gz CMVJZMZQNUFAKS-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1cccc(C)c1F ZINC001179862753 1049222818 /nfs/dbraw/zinc/22/28/18/1049222818.db2.gz CMVJZMZQNUFAKS-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO CC(C)c1ccc(CC[N@@H+]2C[C@@H](C)O[C@@H](C(F)(F)F)C2)cc1 ZINC001179879231 1049226330 /nfs/dbraw/zinc/22/63/30/1049226330.db2.gz YTTJZVMGYBLJRL-CZUORRHYSA-N 1 2 315.379 4.004 20 0 DIADLO CC(C)c1ccc(CC[N@H+]2C[C@@H](C)O[C@@H](C(F)(F)F)C2)cc1 ZINC001179879231 1049226341 /nfs/dbraw/zinc/22/63/41/1049226341.db2.gz YTTJZVMGYBLJRL-CZUORRHYSA-N 1 2 315.379 4.004 20 0 DIADLO O=C1CC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CC[C@H]1F ZINC001204693747 1049227485 /nfs/dbraw/zinc/22/74/85/1049227485.db2.gz GEPZODZKIJPYJW-OAHLLOKOSA-N 1 2 321.779 4.103 20 0 DIADLO O=C1CC[N@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CC[C@H]1F ZINC001204693747 1049227497 /nfs/dbraw/zinc/22/74/97/1049227497.db2.gz GEPZODZKIJPYJW-OAHLLOKOSA-N 1 2 321.779 4.103 20 0 DIADLO Cc1cc(C)cc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)c1 ZINC001193605271 1049238722 /nfs/dbraw/zinc/23/87/22/1049238722.db2.gz JDZDJIPFDBXVCM-LJQANCHMSA-N 1 2 317.379 4.155 20 0 DIADLO Cc1cc(C)cc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)c1 ZINC001193605271 1049238732 /nfs/dbraw/zinc/23/87/32/1049238732.db2.gz JDZDJIPFDBXVCM-LJQANCHMSA-N 1 2 317.379 4.155 20 0 DIADLO C[C@H]1c2cc(Cl)cc(Cl)c2CC[N@H+]1Cc1ccn(C)c1 ZINC001179978825 1049242923 /nfs/dbraw/zinc/24/29/23/1049242923.db2.gz AFPHPDIIQLSGNN-NSHDSACASA-N 1 2 309.240 4.451 20 0 DIADLO C[C@H]1c2cc(Cl)cc(Cl)c2CC[N@@H+]1Cc1ccn(C)c1 ZINC001179978825 1049242933 /nfs/dbraw/zinc/24/29/33/1049242933.db2.gz AFPHPDIIQLSGNN-NSHDSACASA-N 1 2 309.240 4.451 20 0 DIADLO CCC[C@@H]([NH2+][C@@H]1CC(C)(C)CCc2ccccc21)C(=O)OCC ZINC001193733445 1049249804 /nfs/dbraw/zinc/24/98/04/1049249804.db2.gz FQKOTSSFAMXOEU-QZTJIDSGSA-N 1 2 317.473 4.412 20 0 DIADLO CC[C@H](C)[C@H]([NH2+][C@H]1CC(C)(C)CCc2ccccc21)C(=O)OC ZINC001193743842 1049251444 /nfs/dbraw/zinc/25/14/44/1049251444.db2.gz VNZYWIIBLOINMY-WBAXXEDZSA-N 1 2 317.473 4.268 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1cc(-c2ccccc2)n(C)n1 ZINC000858397502 1049252986 /nfs/dbraw/zinc/25/29/86/1049252986.db2.gz LUIOUYJQJFNNAM-OAHLLOKOSA-N 1 2 320.440 4.326 20 0 DIADLO COC(=[NH2+])c1cccc(-c2ccc(OCc3ccccc3)nc2)c1 ZINC001204758159 1049255154 /nfs/dbraw/zinc/25/51/54/1049255154.db2.gz QYJSHXAVKPWFQA-UHFFFAOYSA-N 1 2 318.376 4.299 20 0 DIADLO COc1cc(C[N@@H+]2CCc3cc(F)cc(C)c3C2)ccc1Cl ZINC001193774484 1049255825 /nfs/dbraw/zinc/25/58/25/1049255825.db2.gz ZOTHTSIGAAMNKT-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO COc1cc(C[N@H+]2CCc3cc(F)cc(C)c3C2)ccc1Cl ZINC001193774484 1049255832 /nfs/dbraw/zinc/25/58/32/1049255832.db2.gz ZOTHTSIGAAMNKT-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO CCn1ncc(C[NH2+][C@@H](C)c2ccccc2SC(C)(C)C)n1 ZINC000858444365 1049259779 /nfs/dbraw/zinc/25/97/79/1049259779.db2.gz KTYZZVUSDRHQSZ-ZDUSSCGKSA-N 1 2 318.490 4.039 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(F)c(Cl)c2Cl)C[C@H](C)S1 ZINC001180025316 1049261763 /nfs/dbraw/zinc/26/17/63/1049261763.db2.gz ZOKZEJMLSJEXGW-DTORHVGOSA-N 1 2 308.249 4.458 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(F)c(Cl)c2Cl)C[C@H](C)S1 ZINC001180025316 1049261776 /nfs/dbraw/zinc/26/17/76/1049261776.db2.gz ZOKZEJMLSJEXGW-DTORHVGOSA-N 1 2 308.249 4.458 20 0 DIADLO CC1=C(Br)C[N@@H+](CCc2ccccc2Cl)CC1 ZINC001193881954 1049273186 /nfs/dbraw/zinc/27/31/86/1049273186.db2.gz WVGXSWRUNNKPHU-UHFFFAOYSA-N 1 2 314.654 4.257 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCc3c(F)cc(F)cc3C2)cc1 ZINC001204796454 1049266819 /nfs/dbraw/zinc/26/68/19/1049266819.db2.gz PWCIOYXRAPIIAV-UPHRSURJSA-N 1 2 303.327 4.175 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCc3c(F)cc(F)cc3C2)cc1 ZINC001204796454 1049266831 /nfs/dbraw/zinc/26/68/31/1049266831.db2.gz PWCIOYXRAPIIAV-UPHRSURJSA-N 1 2 303.327 4.175 20 0 DIADLO CC1=C(Br)C[N@H+](CCc2ccccc2Cl)CC1 ZINC001193881954 1049273174 /nfs/dbraw/zinc/27/31/74/1049273174.db2.gz WVGXSWRUNNKPHU-UHFFFAOYSA-N 1 2 314.654 4.257 20 0 DIADLO C[C@@H]1C[N@H+](C/C=C/c2cccc(F)c2)C[C@H](c2ccsc2)O1 ZINC001180076301 1049274120 /nfs/dbraw/zinc/27/41/20/1049274120.db2.gz DMUZICPPCWEHEV-BAUPYLAVSA-N 1 2 317.429 4.362 20 0 DIADLO C[C@@H]1C[N@@H+](C/C=C/c2cccc(F)c2)C[C@H](c2ccsc2)O1 ZINC001180076301 1049274131 /nfs/dbraw/zinc/27/41/31/1049274131.db2.gz DMUZICPPCWEHEV-BAUPYLAVSA-N 1 2 317.429 4.362 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1nc2ccccc2n1C(F)F)c1ccns1 ZINC000858575568 1049277373 /nfs/dbraw/zinc/27/73/73/1049277373.db2.gz BDZCRTSEZSAPNO-UWVGGRQHSA-N 1 2 322.384 4.300 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3CCO[C@@H](c4ccc(F)cc4)C3)cc21 ZINC001204834121 1049280156 /nfs/dbraw/zinc/28/01/56/1049280156.db2.gz VEEJASLAZROOPP-HXUWFJFHSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3CCO[C@@H](c4ccc(F)cc4)C3)cc21 ZINC001204834121 1049280163 /nfs/dbraw/zinc/28/01/63/1049280163.db2.gz VEEJASLAZROOPP-HXUWFJFHSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1nn(C)c2ccc(Nc3ccc[nH+]c3N3CCCCC3)cc12 ZINC001204839461 1049283198 /nfs/dbraw/zinc/28/31/98/1049283198.db2.gz GEQLXHREFKISLF-UHFFFAOYSA-N 1 2 321.428 4.011 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCOC[C@H]1c1ccccc1 ZINC000339013377 1049292034 /nfs/dbraw/zinc/29/20/34/1049292034.db2.gz XZWAYNRMZQXOLB-FQEVSTJZSA-N 1 2 310.441 4.087 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCOC[C@H]1c1ccccc1 ZINC000339013377 1049292047 /nfs/dbraw/zinc/29/20/47/1049292047.db2.gz XZWAYNRMZQXOLB-FQEVSTJZSA-N 1 2 310.441 4.087 20 0 DIADLO c1cn2ccc(-c3cccc4c3cnn4[C@H]3CCCCO3)cc2[nH+]1 ZINC001204874180 1049292670 /nfs/dbraw/zinc/29/26/70/1049292670.db2.gz NQAWQDQTKWANEA-LJQANCHMSA-N 1 2 318.380 4.050 20 0 DIADLO CC1(C)C[N@H+](Cc2cnn(Cc3ccccc3)c2Cl)C1(C)C ZINC001180203485 1049307154 /nfs/dbraw/zinc/30/71/54/1049307154.db2.gz SPTBFPXFUDKWGK-UHFFFAOYSA-N 1 2 317.864 4.205 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnn(Cc3ccccc3)c2Cl)C1(C)C ZINC001180203485 1049307164 /nfs/dbraw/zinc/30/71/64/1049307164.db2.gz SPTBFPXFUDKWGK-UHFFFAOYSA-N 1 2 317.864 4.205 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccnc(F)c1 ZINC000859168044 1049318411 /nfs/dbraw/zinc/31/84/11/1049318411.db2.gz HOWMZHRXNUIBEI-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccnc(F)c1 ZINC000859168044 1049318423 /nfs/dbraw/zinc/31/84/23/1049318423.db2.gz HOWMZHRXNUIBEI-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO CCOc1ccc(-c2cc(Nc3ccn4cc[nH+]c4c3)on2)cc1 ZINC001204950922 1049319298 /nfs/dbraw/zinc/31/92/98/1049319298.db2.gz HMGLAQXEJQCSEX-UHFFFAOYSA-N 1 2 320.352 4.132 20 0 DIADLO CC[C@@H]1COCC[N@@H+]1Cc1cnc(-c2ccc(C)c(C)c2)s1 ZINC001180239092 1049319669 /nfs/dbraw/zinc/31/96/69/1049319669.db2.gz FSLGUUJXQTXYMP-MRXNPFEDSA-N 1 2 316.470 4.038 20 0 DIADLO CC[C@@H]1COCC[N@H+]1Cc1cnc(-c2ccc(C)c(C)c2)s1 ZINC001180239092 1049319678 /nfs/dbraw/zinc/31/96/78/1049319678.db2.gz FSLGUUJXQTXYMP-MRXNPFEDSA-N 1 2 316.470 4.038 20 0 DIADLO Fc1ccc(-c2cc(Nc3ccn4cc[nH+]c4c3)on2)cc1F ZINC001204951283 1049319728 /nfs/dbraw/zinc/31/97/28/1049319728.db2.gz QJPAVTOFUCOVQV-UHFFFAOYSA-N 1 2 312.279 4.011 20 0 DIADLO ClC(Cl)=CC[N@@H+]1CCCN(c2ccccc2Cl)CC1 ZINC001194123823 1049323533 /nfs/dbraw/zinc/32/35/33/1049323533.db2.gz JMGNUFWNBYYKFG-UHFFFAOYSA-N 1 2 319.663 4.171 20 0 DIADLO ClC(Cl)=CC[N@H+]1CCCN(c2ccccc2Cl)CC1 ZINC001194123823 1049323542 /nfs/dbraw/zinc/32/35/42/1049323542.db2.gz JMGNUFWNBYYKFG-UHFFFAOYSA-N 1 2 319.663 4.171 20 0 DIADLO Clc1cc(Cl)c(Nc2ccn3cc[nH+]c3c2)c(Cl)n1 ZINC001204972288 1049327994 /nfs/dbraw/zinc/32/79/94/1049327994.db2.gz YHAXPCDRWBCBDQ-UHFFFAOYSA-N 1 2 313.575 4.433 20 0 DIADLO Fc1cc(Nc2ccn3cc[nH+]c3c2)cc(F)c1Br ZINC001204978217 1049328546 /nfs/dbraw/zinc/32/85/46/1049328546.db2.gz QDBTXACYDHSNFE-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO c1cn2ccc(Nc3ccccc3Oc3cccnc3)cc2[nH+]1 ZINC001204977258 1049328969 /nfs/dbraw/zinc/32/89/69/1049328969.db2.gz DLLGHEQHYHBKGG-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO CC(C)[C@H]1CC[N@@H+]1Cc1c(F)c(Cl)ccc1Br ZINC001204975345 1049329168 /nfs/dbraw/zinc/32/91/68/1049329168.db2.gz JGBKJGMBAKUYDD-GFCCVEGCSA-N 1 2 320.633 4.472 20 0 DIADLO CC(C)[C@H]1CC[N@H+]1Cc1c(F)c(Cl)ccc1Br ZINC001204975345 1049329180 /nfs/dbraw/zinc/32/91/80/1049329180.db2.gz JGBKJGMBAKUYDD-GFCCVEGCSA-N 1 2 320.633 4.472 20 0 DIADLO Cc1c(Cl)cc(Nc2ccn3cc[nH+]c3c2)c(O)c1Cl ZINC001204990740 1049332907 /nfs/dbraw/zinc/33/29/07/1049332907.db2.gz FWCZLXOCKOSOFB-UHFFFAOYSA-N 1 2 308.168 4.399 20 0 DIADLO c1cn2ccc(Nc3ccc(Cc4ccccn4)cc3)cc2[nH+]1 ZINC001204991231 1049333224 /nfs/dbraw/zinc/33/32/24/1049333224.db2.gz MHZUDFTVAZHNLS-UHFFFAOYSA-N 1 2 300.365 4.064 20 0 DIADLO CC(=O)c1ccc(C(F)(F)F)cc1Nc1ccn2cc[nH+]c2c1 ZINC001204991247 1049333341 /nfs/dbraw/zinc/33/33/41/1049333341.db2.gz MXHQEEUWHQJCIL-UHFFFAOYSA-N 1 2 319.286 4.299 20 0 DIADLO O=C1c2ccccc2-c2ccc(Nc3ccn4cc[nH+]c4c3)cc21 ZINC001204990837 1049333986 /nfs/dbraw/zinc/33/39/86/1049333986.db2.gz HGBMOLKSQBXVKH-UHFFFAOYSA-N 1 2 311.344 4.289 20 0 DIADLO COC(=O)c1cc2cccc(Nc3ccn4cc[nH+]c4c3)c2s1 ZINC001204997354 1049335296 /nfs/dbraw/zinc/33/52/96/1049335296.db2.gz ISTGFTRQQRLXSI-UHFFFAOYSA-N 1 2 323.377 4.079 20 0 DIADLO Clc1c(Br)cccc1Nc1ccn2cc[nH+]c2c1 ZINC001204997642 1049335753 /nfs/dbraw/zinc/33/57/53/1049335753.db2.gz LNTKBIAQFQKDDN-UHFFFAOYSA-N 1 2 322.593 4.494 20 0 DIADLO C[N@H+](Cc1ccncc1)Cc1cccc(C(F)(F)F)c1Cl ZINC001205037366 1049347926 /nfs/dbraw/zinc/34/79/26/1049347926.db2.gz SHYVTYNAZYZBDY-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccncc1)Cc1cccc(C(F)(F)F)c1Cl ZINC001205037366 1049347938 /nfs/dbraw/zinc/34/79/38/1049347938.db2.gz SHYVTYNAZYZBDY-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO CC[C@@]([NH2+]C[C@H]1CCCCC1(C)C)(C(=O)OC)c1ccccc1 ZINC001194260543 1049352720 /nfs/dbraw/zinc/35/27/20/1049352720.db2.gz DQUDSKIHJJMVNX-XLIONFOSSA-N 1 2 317.473 4.271 20 0 DIADLO CC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C(F)(F)F)c2Cl)C1 ZINC001205055383 1049355966 /nfs/dbraw/zinc/35/59/66/1049355966.db2.gz IVNVNCVEGFLXJQ-LLVKDONJSA-N 1 2 319.754 4.160 20 0 DIADLO CC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(C(F)(F)F)c2Cl)C1 ZINC001205055383 1049355981 /nfs/dbraw/zinc/35/59/81/1049355981.db2.gz IVNVNCVEGFLXJQ-LLVKDONJSA-N 1 2 319.754 4.160 20 0 DIADLO FC(F)(F)c1cccc(C[N@@H+]2CCC[C@@]3(CCO3)C2)c1Cl ZINC001205055767 1049357449 /nfs/dbraw/zinc/35/74/49/1049357449.db2.gz NFLPIOWVQBFTSX-CQSZACIVSA-N 1 2 319.754 4.114 20 0 DIADLO FC(F)(F)c1cccc(C[N@H+]2CCC[C@@]3(CCO3)C2)c1Cl ZINC001205055767 1049357457 /nfs/dbraw/zinc/35/74/57/1049357457.db2.gz NFLPIOWVQBFTSX-CQSZACIVSA-N 1 2 319.754 4.114 20 0 DIADLO FC(F)(F)c1cccc(C[N@@H+]2CCC[C@]3(CCO3)C2)c1Cl ZINC001205055765 1049358449 /nfs/dbraw/zinc/35/84/49/1049358449.db2.gz NFLPIOWVQBFTSX-AWEZNQCLSA-N 1 2 319.754 4.114 20 0 DIADLO FC(F)(F)c1cccc(C[N@H+]2CCC[C@]3(CCO3)C2)c1Cl ZINC001205055765 1049358465 /nfs/dbraw/zinc/35/84/65/1049358465.db2.gz NFLPIOWVQBFTSX-AWEZNQCLSA-N 1 2 319.754 4.114 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@H+]([C@@H](C)c1nc(C(C)(C)C)no1)CC2 ZINC000485876902 1049360013 /nfs/dbraw/zinc/36/00/13/1049360013.db2.gz PSYCCRDKUOZHSV-AWEZNQCLSA-N 1 2 313.445 4.103 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@@H+]([C@@H](C)c1nc(C(C)(C)C)no1)CC2 ZINC000485876902 1049360026 /nfs/dbraw/zinc/36/00/26/1049360026.db2.gz PSYCCRDKUOZHSV-AWEZNQCLSA-N 1 2 313.445 4.103 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1cc(C)ccc1C ZINC000859935833 1049361985 /nfs/dbraw/zinc/36/19/85/1049361985.db2.gz ZNCVSBBIICWLOX-OAHLLOKOSA-N 1 2 301.434 4.225 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cc1ccnn1CC1CCC1 ZINC001180422626 1049362298 /nfs/dbraw/zinc/36/22/98/1049362298.db2.gz LNXJWDNHHXRBMG-UHFFFAOYSA-N 1 2 309.866 4.030 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1ccnn1CC1CCC1 ZINC001180422626 1049362312 /nfs/dbraw/zinc/36/23/12/1049362312.db2.gz LNXJWDNHHXRBMG-UHFFFAOYSA-N 1 2 309.866 4.030 20 0 DIADLO CCCn1cc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)c(C)n1 ZINC001180558222 1049382033 /nfs/dbraw/zinc/38/20/33/1049382033.db2.gz KWOIGDMVBHDDBO-UHFFFAOYSA-N 1 2 319.399 4.044 20 0 DIADLO CCCn1cc(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)c(C)n1 ZINC001180558222 1049382040 /nfs/dbraw/zinc/38/20/40/1049382040.db2.gz KWOIGDMVBHDDBO-UHFFFAOYSA-N 1 2 319.399 4.044 20 0 DIADLO Cc1ccc([C@H](CC(F)(F)F)[NH2+][C@@H]2C[C@H](C)n3ccnc32)cc1 ZINC001180595111 1049388933 /nfs/dbraw/zinc/38/89/33/1049388933.db2.gz YEWJNHDQQFBNDN-CFVMTHIKSA-N 1 2 323.362 4.481 20 0 DIADLO Cc1ccc([C@H](CC(F)(F)F)[NH2+][C@H]2C[C@@H](C)n3ccnc32)cc1 ZINC001180595113 1049389377 /nfs/dbraw/zinc/38/93/77/1049389377.db2.gz YEWJNHDQQFBNDN-SNPRPXQTSA-N 1 2 323.362 4.481 20 0 DIADLO CCn1ncc(C[N@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)n1 ZINC001194627304 1049399939 /nfs/dbraw/zinc/39/99/39/1049399939.db2.gz ZAWZJSIQKCNNFJ-KRWDZBQOSA-N 1 2 320.440 4.061 20 0 DIADLO CCn1ncc(C[N@@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)n1 ZINC001194627304 1049399954 /nfs/dbraw/zinc/39/99/54/1049399954.db2.gz ZAWZJSIQKCNNFJ-KRWDZBQOSA-N 1 2 320.440 4.061 20 0 DIADLO CCCCc1oc2ccccc2c1C[N@H+](C)Cc1nc(C)c[nH]1 ZINC001205170634 1049401878 /nfs/dbraw/zinc/40/18/78/1049401878.db2.gz UFAYSERJRVPKHN-UHFFFAOYSA-N 1 2 311.429 4.439 20 0 DIADLO CCCCc1oc2ccccc2c1C[N@@H+](C)Cc1nc(C)c[nH]1 ZINC001205170634 1049401886 /nfs/dbraw/zinc/40/18/86/1049401886.db2.gz UFAYSERJRVPKHN-UHFFFAOYSA-N 1 2 311.429 4.439 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2c(F)cc(F)c(F)c2F)cc1F ZINC001205192135 1049406951 /nfs/dbraw/zinc/40/69/51/1049406951.db2.gz VLBNCSHZLPKBAE-UHFFFAOYSA-N 1 2 319.248 4.250 20 0 DIADLO CCC1(C[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)CCCCC1 ZINC001205230223 1049413103 /nfs/dbraw/zinc/41/31/03/1049413103.db2.gz LMGRSHUSUFGCHU-MRXNPFEDSA-N 1 2 304.482 4.376 20 0 DIADLO Nc1[nH+]cccc1CNc1cc(Cl)ccc1OC1CCCC1 ZINC001181103203 1049438214 /nfs/dbraw/zinc/43/82/14/1049438214.db2.gz YLMQWIPHLFUQHJ-UHFFFAOYSA-N 1 2 317.820 4.251 20 0 DIADLO CC[C@@H](CC(C)C)c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001205322099 1049438185 /nfs/dbraw/zinc/43/81/85/1049438185.db2.gz UVHONHSDSCRHQL-AWEZNQCLSA-N 1 2 310.401 4.462 20 0 DIADLO COCOc1ccc2[nH]c(CCCCc3ccccc3)[nH+]c2c1 ZINC001250604621 1049441072 /nfs/dbraw/zinc/44/10/72/1049441072.db2.gz LPJNPZZFMDXXLU-UHFFFAOYSA-N 1 2 310.397 4.111 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(C(=O)NC(C)(C)CC(C)(C)C)c1 ZINC001194916566 1049447461 /nfs/dbraw/zinc/44/74/61/1049447461.db2.gz COAGHCWFZJUBQJ-UHFFFAOYSA-N 1 2 313.445 4.032 20 0 DIADLO CCc1cccc(N(C)Cc2ccc(-n3cc[nH+]c3)cc2C)c1 ZINC001194922491 1049449559 /nfs/dbraw/zinc/44/95/59/1049449559.db2.gz VQIJOBAECDFNHC-UHFFFAOYSA-N 1 2 305.425 4.380 20 0 DIADLO CC(C)Oc1ccc[nH+]c1N[C@@H](C)CCc1n[nH]c2ccccc12 ZINC001205431849 1049469469 /nfs/dbraw/zinc/46/94/69/1049469469.db2.gz UMLFWGHSCBNZKY-AWEZNQCLSA-N 1 2 324.428 4.178 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1CCc2c(cccc2C(C)C)C1 ZINC001181410262 1049476909 /nfs/dbraw/zinc/47/69/09/1049476909.db2.gz KPWWDXJOLPFLOS-UHFFFAOYSA-N 1 2 317.864 4.238 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1CCc2c(cccc2C(C)C)C1 ZINC001181410262 1049476914 /nfs/dbraw/zinc/47/69/14/1049476914.db2.gz KPWWDXJOLPFLOS-UHFFFAOYSA-N 1 2 317.864 4.238 20 0 DIADLO CCN(CC)c1ccc(N[C@@H](C)c2cccnc2Cl)c[nH+]1 ZINC000777251146 1049488451 /nfs/dbraw/zinc/48/84/51/1049488451.db2.gz LAALBDKRIKUPJL-LBPRGKRZSA-N 1 2 304.825 4.149 20 0 DIADLO CCn1cc(C[N@H+](CC)Cc2ccc(Cl)cc2Cl)cn1 ZINC001205557023 1049496871 /nfs/dbraw/zinc/49/68/71/1049496871.db2.gz FJPXZTBPBFJRRT-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO CCn1cc(C[N@@H+](CC)Cc2ccc(Cl)cc2Cl)cn1 ZINC001205557023 1049496877 /nfs/dbraw/zinc/49/68/77/1049496877.db2.gz FJPXZTBPBFJRRT-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO CC1=C(C)C[N@H+](Cc2c(F)cccc2OC(F)(F)F)CC1 ZINC001205562413 1049499627 /nfs/dbraw/zinc/49/96/27/1049499627.db2.gz QGXSTPZKWHRCDQ-UHFFFAOYSA-N 1 2 303.299 4.266 20 0 DIADLO CC1=C(C)C[N@@H+](Cc2c(F)cccc2OC(F)(F)F)CC1 ZINC001205562413 1049499631 /nfs/dbraw/zinc/49/96/31/1049499631.db2.gz QGXSTPZKWHRCDQ-UHFFFAOYSA-N 1 2 303.299 4.266 20 0 DIADLO Oc1ccc(F)c(C[NH2+][C@H]2CCc3ccc(Cl)cc32)c1F ZINC000862539391 1049499944 /nfs/dbraw/zinc/49/99/44/1049499944.db2.gz NTVDFYPCKIMCLJ-AWEZNQCLSA-N 1 2 309.743 4.101 20 0 DIADLO CC(C)(C)OC1CC[NH+](Cc2cc(Cl)nc(Cl)c2)CC1 ZINC000118986270 1049506004 /nfs/dbraw/zinc/50/60/04/1049506004.db2.gz GNFJFEDYHYMVOO-UHFFFAOYSA-N 1 2 317.260 4.168 20 0 DIADLO C[C@@H]([NH2+]c1ccc(N2C[C@@H](C)O[C@@H](C)C2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC001205620142 1049514272 /nfs/dbraw/zinc/51/42/72/1049514272.db2.gz CJGVHHLQTOMNDT-MFIFYNPPSA-N 1 2 314.473 4.147 20 0 DIADLO Cc1cc(C[N@H+](Cc2cccnc2)Cc2ccccc2C)sn1 ZINC001205670675 1049527199 /nfs/dbraw/zinc/52/71/99/1049527199.db2.gz GNNGPIKITXPSQS-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO Cc1cc(C[N@@H+](Cc2cccnc2)Cc2ccccc2C)sn1 ZINC001205670675 1049527210 /nfs/dbraw/zinc/52/72/10/1049527210.db2.gz GNNGPIKITXPSQS-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1cc(Cl)cc(Cl)c1 ZINC001203811678 1049544325 /nfs/dbraw/zinc/54/43/25/1049544325.db2.gz DOLCOJSHEZJVQF-UHFFFAOYSA-N 1 2 308.208 4.308 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1cc(Cl)cc(Cl)c1 ZINC001203811678 1049544336 /nfs/dbraw/zinc/54/43/36/1049544336.db2.gz DOLCOJSHEZJVQF-UHFFFAOYSA-N 1 2 308.208 4.308 20 0 DIADLO CCn1cc(C[N@H+](CC(C)C)[C@H](C)c2ccccc2Cl)nn1 ZINC001205772329 1049559304 /nfs/dbraw/zinc/55/93/04/1049559304.db2.gz AHWMRCLVKUKOBD-CQSZACIVSA-N 1 2 320.868 4.171 20 0 DIADLO CCn1cc(C[N@@H+](CC(C)C)[C@H](C)c2ccccc2Cl)nn1 ZINC001205772329 1049559321 /nfs/dbraw/zinc/55/93/21/1049559321.db2.gz AHWMRCLVKUKOBD-CQSZACIVSA-N 1 2 320.868 4.171 20 0 DIADLO COc1ccc(Cn2ncc(C)c2Nc2ccc(C)[nH+]c2C)cc1 ZINC001203369044 1049564302 /nfs/dbraw/zinc/56/43/02/1049564302.db2.gz KIWUKVVYAUHMFX-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO CCCCC[C@@H](CC)C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000775670564 1049569330 /nfs/dbraw/zinc/56/93/30/1049569330.db2.gz MNJWYXFZMCKCQA-HZPDHXFCSA-N 1 2 307.482 4.021 20 0 DIADLO Cc1cccc(-c2noc([C@H]([NH3+])c3cccc(Cl)c3)n2)c1C ZINC001205812206 1049571170 /nfs/dbraw/zinc/57/11/70/1049571170.db2.gz NKNWSTUXAJBROO-OAHLLOKOSA-N 1 2 313.788 4.055 20 0 DIADLO Cc1cc(-c2ccc(F)c(F)c2OC(C)C)cn2cc[nH+]c12 ZINC001205854247 1049582297 /nfs/dbraw/zinc/58/22/97/1049582297.db2.gz DGZZHQQRNKRQSJ-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Cc1cn2cc(-c3ccc(F)c(F)c3OC(C)C)ccc2[nH+]1 ZINC001205854993 1049583527 /nfs/dbraw/zinc/58/35/27/1049583527.db2.gz LBPIZESOSRZIRE-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO COC(=O)[C@H](c1ccsc1)[NH+]1CCC2(CCCCC2)CC1 ZINC001195938640 1049584904 /nfs/dbraw/zinc/58/49/04/1049584904.db2.gz QKICRUSRANFMHV-HNNXBMFYSA-N 1 2 307.459 4.009 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)c3ccccc32)n1 ZINC000488007120 1049591481 /nfs/dbraw/zinc/59/14/81/1049591481.db2.gz ODQWJZXDKJKJGC-NWDGAFQWSA-N 1 2 313.376 4.336 20 0 DIADLO CC[NH+](CC)[C@@H](C(=O)Nc1ccsc1)c1ccccc1Cl ZINC001182218835 1049593726 /nfs/dbraw/zinc/59/37/26/1049593726.db2.gz MCWKTNOHLZHVDY-OAHLLOKOSA-N 1 2 322.861 4.423 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C)c2cc3cnccc3o2)c(C)[nH+]1 ZINC001205900123 1049594530 /nfs/dbraw/zinc/59/45/30/1049594530.db2.gz VDKMXMBIVHFDAA-LBPRGKRZSA-N 1 2 324.384 4.031 20 0 DIADLO CSc1ccc(F)cc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001205956512 1049609390 /nfs/dbraw/zinc/60/93/90/1049609390.db2.gz IXWPCFDWASQGTG-UHFFFAOYSA-N 1 2 302.296 4.211 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@H+](Cc1ccc(C2CC2)cc1)C1CC1 ZINC001182298876 1049610117 /nfs/dbraw/zinc/61/01/17/1049610117.db2.gz SGEOHBRWCBOUDM-CQSZACIVSA-N 1 2 315.457 4.259 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+](Cc1ccc(C2CC2)cc1)C1CC1 ZINC001182298876 1049610123 /nfs/dbraw/zinc/61/01/23/1049610123.db2.gz SGEOHBRWCBOUDM-CQSZACIVSA-N 1 2 315.457 4.259 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1cc(F)ncc1F)C(C)(C)C2 ZINC001205967381 1049613166 /nfs/dbraw/zinc/61/31/66/1049613166.db2.gz LVFJKZAMQMVKIE-UHFFFAOYSA-N 1 2 302.368 4.005 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1cc(F)ncc1F)C(C)(C)C2 ZINC001205967381 1049613172 /nfs/dbraw/zinc/61/31/72/1049613172.db2.gz LVFJKZAMQMVKIE-UHFFFAOYSA-N 1 2 302.368 4.005 20 0 DIADLO CC1(C)CCC(=CC(=O)NCc2ccccc2-n2cc[nH+]c2)CC1 ZINC000774169893 1049616645 /nfs/dbraw/zinc/61/66/45/1049616645.db2.gz XVCMBQCKBBYOJO-UHFFFAOYSA-N 1 2 323.440 4.015 20 0 DIADLO FC[C@]1(C(F)(F)F)CC[N@H+](Cc2cc(Cl)ccc2F)C1 ZINC001205998722 1049624264 /nfs/dbraw/zinc/62/42/64/1049624264.db2.gz GXIRMVRRLYYNFB-GFCCVEGCSA-N 1 2 313.697 4.203 20 0 DIADLO FC[C@]1(C(F)(F)F)CC[N@@H+](Cc2cc(Cl)ccc2F)C1 ZINC001205998722 1049624270 /nfs/dbraw/zinc/62/42/70/1049624270.db2.gz GXIRMVRRLYYNFB-GFCCVEGCSA-N 1 2 313.697 4.203 20 0 DIADLO Cc1ccccc1N1CC[NH+](Cc2ccc(Cl)cc2F)CC1 ZINC001204335366 1049625754 /nfs/dbraw/zinc/62/57/54/1049625754.db2.gz QXPNUMKIFWWYPW-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO COc1ccc2c(c1)CC[N@H+]([C@@H](C)c1c(F)cccc1F)C2 ZINC001196165620 1049626875 /nfs/dbraw/zinc/62/68/75/1049626875.db2.gz DRNGTIVVMLHBLK-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc2c(c1)CC[N@@H+]([C@@H](C)c1c(F)cccc1F)C2 ZINC001196165620 1049626884 /nfs/dbraw/zinc/62/68/84/1049626884.db2.gz DRNGTIVVMLHBLK-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO C[C@@H](Nc1cc(F)cc(N(C)C)c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000864026557 1049629804 /nfs/dbraw/zinc/62/98/04/1049629804.db2.gz QDNUSKMZDACNTO-CQSZACIVSA-N 1 2 324.403 4.251 20 0 DIADLO Cc1c[nH]c2ncc(Nc3ccc(N4CCCCC4)[nH+]c3)cc12 ZINC001206020363 1049630751 /nfs/dbraw/zinc/63/07/51/1049630751.db2.gz GMLXXVKLFPEQHS-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO C[C@@H](Cc1ccccc1)[N@H+](Cc1cnsn1)Cc1ccccc1 ZINC001196311974 1049637606 /nfs/dbraw/zinc/63/76/06/1049637606.db2.gz JNPMFYUMTAKZDW-INIZCTEOSA-N 1 2 323.465 4.172 20 0 DIADLO C[C@@H](Cc1ccccc1)[N@@H+](Cc1cnsn1)Cc1ccccc1 ZINC001196311974 1049637608 /nfs/dbraw/zinc/63/76/08/1049637608.db2.gz JNPMFYUMTAKZDW-INIZCTEOSA-N 1 2 323.465 4.172 20 0 DIADLO Cc1cccc(NC(=S)Nc2ccccc2-n2cc[nH+]c2)c1C ZINC001196385985 1049648382 /nfs/dbraw/zinc/64/83/82/1049648382.db2.gz YVIIRSBMOZSVSV-UHFFFAOYSA-N 1 2 322.437 4.298 20 0 DIADLO CCOC1(C)CCN(c2cc(C(C)C)[nH+]c(C(C)C)n2)CC1 ZINC000488442434 1049651968 /nfs/dbraw/zinc/65/19/68/1049651968.db2.gz MOZVPKKOJSYTBY-UHFFFAOYSA-N 1 2 305.466 4.119 20 0 DIADLO Cc1ccc2[nH+]cc(CN3C[C@@H](C)CSc4ccccc43)n2c1 ZINC001206098461 1049652981 /nfs/dbraw/zinc/65/29/81/1049652981.db2.gz FNTBOYHAXFXHAN-OAHLLOKOSA-N 1 2 323.465 4.391 20 0 DIADLO CC(C)[C@H]1C[C@@H](Nc2ccc(N3CCCCC3)c[nH+]2)CS1 ZINC000488446559 1049656678 /nfs/dbraw/zinc/65/66/78/1049656678.db2.gz UISCIYYTHOQXIN-GDBMZVCRSA-N 1 2 305.491 4.014 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000488471305 1049660997 /nfs/dbraw/zinc/66/09/97/1049660997.db2.gz WUPKPBUMTCMSPV-WMLDXEAASA-N 1 2 318.367 4.033 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](CC)c2ccccc2OC)[nH]1 ZINC000488481783 1049661245 /nfs/dbraw/zinc/66/12/45/1049661245.db2.gz UAJUCVUNRLMHBP-GUTXKFCHSA-N 1 2 316.449 4.129 20 0 DIADLO C[C@H]1CCc2nc(C[N@@H+]3CCc4sccc4[C@@H]3C)sc2C1 ZINC001206128768 1049662374 /nfs/dbraw/zinc/66/23/74/1049662374.db2.gz ZYZBGGYEMUUPLD-RYUDHWBXSA-N 1 2 318.511 4.449 20 0 DIADLO C[C@H]1CCc2nc(C[N@H+]3CCc4sccc4[C@@H]3C)sc2C1 ZINC001206128768 1049662378 /nfs/dbraw/zinc/66/23/78/1049662378.db2.gz ZYZBGGYEMUUPLD-RYUDHWBXSA-N 1 2 318.511 4.449 20 0 DIADLO C[C@H]1CO[C@@H](c2cccc(C(F)(F)F)c2)CN1c1cccc[nH+]1 ZINC000488490593 1049662915 /nfs/dbraw/zinc/66/29/15/1049662915.db2.gz QXZXHSZQOOJUMX-SWLSCSKDSA-N 1 2 322.330 4.067 20 0 DIADLO CC(C)Cn1nccc1C[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC001206137020 1049665488 /nfs/dbraw/zinc/66/54/88/1049665488.db2.gz WWMGEWAESGYNHE-INIZCTEOSA-N 1 2 303.475 4.184 20 0 DIADLO CC(C)Cn1nccc1C[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC001206137020 1049665492 /nfs/dbraw/zinc/66/54/92/1049665492.db2.gz WWMGEWAESGYNHE-INIZCTEOSA-N 1 2 303.475 4.184 20 0 DIADLO C[C@H]1c2ccccc2C[N@H+]1CC(=O)NCCCC1CCCCC1 ZINC001196498751 1049665629 /nfs/dbraw/zinc/66/56/29/1049665629.db2.gz PVUXEZJKALIRMB-INIZCTEOSA-N 1 2 314.473 4.040 20 0 DIADLO C[C@H]1c2ccccc2C[N@@H+]1CC(=O)NCCCC1CCCCC1 ZINC001196498751 1049665632 /nfs/dbraw/zinc/66/56/32/1049665632.db2.gz PVUXEZJKALIRMB-INIZCTEOSA-N 1 2 314.473 4.040 20 0 DIADLO CCc1cccc(C[NH+]2CC(OCCCc3ccccc3)C2)c1 ZINC001206187135 1049678910 /nfs/dbraw/zinc/67/89/10/1049678910.db2.gz REORTODUVBCXTI-UHFFFAOYSA-N 1 2 309.453 4.083 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CN1CC(C)(C)c2ccccc21 ZINC001196675245 1049681961 /nfs/dbraw/zinc/68/19/61/1049681961.db2.gz LYTMGOAWEJEYEH-UHFFFAOYSA-N 1 2 317.436 4.479 20 0 DIADLO Cc1c(Cl)ccc(-c2ccccc2C[NH+]2CCOCC2)c1F ZINC001206283734 1049698665 /nfs/dbraw/zinc/69/86/65/1049698665.db2.gz JDZNTPZNJKHJNJ-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO COCc1cc(C)c(-c2ccccc2Cn2cc[nH+]c2)c(C)c1 ZINC001206330428 1049713282 /nfs/dbraw/zinc/71/32/82/1049713282.db2.gz CGVPZINETUHDKC-UHFFFAOYSA-N 1 2 306.409 4.362 20 0 DIADLO CCCCO[C@@H]1C[C@@H](Nc2ccc(N3CCCC3)c[nH+]2)C1(C)C ZINC001206376399 1049723791 /nfs/dbraw/zinc/72/37/91/1049723791.db2.gz GBWCQIILZBAWIS-IAGOWNOFSA-N 1 2 317.477 4.078 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2csc(C(C)C)n2)cc1C ZINC000489130871 1049730395 /nfs/dbraw/zinc/73/03/95/1049730395.db2.gz ROJZPACWZGLYSO-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2csc(C(C)C)n2)cc1C ZINC000489130871 1049730403 /nfs/dbraw/zinc/73/04/03/1049730403.db2.gz ROJZPACWZGLYSO-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO Cc1cn2cc(NC(=S)Nc3ccc(Cl)cc3)ccc2[nH+]1 ZINC001197306924 1049737278 /nfs/dbraw/zinc/73/72/78/1049737278.db2.gz TVYAQFHSFHWCSO-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO CC(C)(C)Oc1ncccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001206501206 1049745018 /nfs/dbraw/zinc/74/50/18/1049745018.db2.gz KEDZLLSWAJLXSE-UHFFFAOYSA-N 1 2 322.412 4.247 20 0 DIADLO Cc1ncc(CSCc2c[nH+]c(N(C)C)c3ccccc23)o1 ZINC000912432034 1049749002 /nfs/dbraw/zinc/74/90/02/1049749002.db2.gz RDKNIGWGRPYOFG-UHFFFAOYSA-N 1 2 313.426 4.031 20 0 DIADLO CCSc1nn(C[N@@H+]2CCC[C@H]2C2CCC2)c(=S)s1 ZINC000102885887 1049749609 /nfs/dbraw/zinc/74/96/09/1049749609.db2.gz XTTBRPVPVCRPPR-NSHDSACASA-N 1 2 315.533 4.008 20 0 DIADLO CCSc1nn(C[N@H+]2CCC[C@H]2C2CCC2)c(=S)s1 ZINC000102885887 1049749618 /nfs/dbraw/zinc/74/96/18/1049749618.db2.gz XTTBRPVPVCRPPR-NSHDSACASA-N 1 2 315.533 4.008 20 0 DIADLO C[C@@H]1c2sccc2CC[N@H+]1Cc1cncc(C(F)(F)F)c1 ZINC001197432455 1049753189 /nfs/dbraw/zinc/75/31/89/1049753189.db2.gz WKOPPNQCUYJVKU-SNVBAGLBSA-N 1 2 312.360 4.281 20 0 DIADLO C[C@@H]1c2sccc2CC[N@@H+]1Cc1cncc(C(F)(F)F)c1 ZINC001197432455 1049753198 /nfs/dbraw/zinc/75/31/98/1049753198.db2.gz WKOPPNQCUYJVKU-SNVBAGLBSA-N 1 2 312.360 4.281 20 0 DIADLO C[C@H]1c2ccc(F)cc2CC[N@H+]1Cc1cc(O)ccc1Cl ZINC001197496560 1049758176 /nfs/dbraw/zinc/75/81/76/1049758176.db2.gz LIJGQRYLBRGPBU-NSHDSACASA-N 1 2 305.780 4.304 20 0 DIADLO C[C@H]1c2ccc(F)cc2CC[N@@H+]1Cc1cc(O)ccc1Cl ZINC001197496560 1049758182 /nfs/dbraw/zinc/75/81/82/1049758182.db2.gz LIJGQRYLBRGPBU-NSHDSACASA-N 1 2 305.780 4.304 20 0 DIADLO CCCCCOc1ccc(C[N@H+](C)[C@H](C)c2nc(C)no2)cc1 ZINC000570463080 1049758595 /nfs/dbraw/zinc/75/85/95/1049758595.db2.gz QCVQUWACVJUEKJ-CQSZACIVSA-N 1 2 317.433 4.140 20 0 DIADLO CCCCCOc1ccc(C[N@@H+](C)[C@H](C)c2nc(C)no2)cc1 ZINC000570463080 1049758601 /nfs/dbraw/zinc/75/86/01/1049758601.db2.gz QCVQUWACVJUEKJ-CQSZACIVSA-N 1 2 317.433 4.140 20 0 DIADLO C[C@@]1(c2cccc(F)c2)CC[N@H+](Cc2c(Cl)ccnc2F)C1 ZINC001206568693 1049759683 /nfs/dbraw/zinc/75/96/83/1049759683.db2.gz OGFBPXAPUSEHNC-QGZVFWFLSA-N 1 2 322.786 4.177 20 0 DIADLO C[C@@]1(c2cccc(F)c2)CC[N@@H+](Cc2c(Cl)ccnc2F)C1 ZINC001206568693 1049759690 /nfs/dbraw/zinc/75/96/90/1049759690.db2.gz OGFBPXAPUSEHNC-QGZVFWFLSA-N 1 2 322.786 4.177 20 0 DIADLO CC(C)[C@@H]1C[C@H]([NH2+]CC(F)(F)c2cccc(F)c2)CS1 ZINC001206591873 1049763979 /nfs/dbraw/zinc/76/39/79/1049763979.db2.gz WFNGISLVXRHUOH-KBPBESRZSA-N 1 2 303.393 4.037 20 0 DIADLO Cc1ccccc1C[N@@H+]1CCc2sc(Br)cc2C1 ZINC001206680312 1049778485 /nfs/dbraw/zinc/77/84/85/1049778485.db2.gz GNGYBPRCNMREDA-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1ccccc1C[N@H+]1CCc2sc(Br)cc2C1 ZINC001206680312 1049778491 /nfs/dbraw/zinc/77/84/91/1049778491.db2.gz GNGYBPRCNMREDA-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO C=Cc1ccc(F)cc1-c1ccc(C[NH+]2CCOCC2)cc1F ZINC001206712272 1049781665 /nfs/dbraw/zinc/78/16/65/1049781665.db2.gz GRBRCTYQQOOIJR-UHFFFAOYSA-N 1 2 315.363 4.107 20 0 DIADLO FC(F)n1c2ccccc2n(C[NH+]2C3CCC2CC3)c1=S ZINC000912788473 1049793669 /nfs/dbraw/zinc/79/36/69/1049793669.db2.gz DWGLPFXJSKZEEP-UHFFFAOYSA-N 1 2 309.385 4.152 20 0 DIADLO COc1ccc(-c2cc(C[N@H+](C)Cc3cccs3)no2)cc1 ZINC001206826688 1049809450 /nfs/dbraw/zinc/80/94/50/1049809450.db2.gz BPMRPIFYVFDZHF-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1ccc(-c2cc(C[N@@H+](C)Cc3cccs3)no2)cc1 ZINC001206826688 1049809458 /nfs/dbraw/zinc/80/94/58/1049809458.db2.gz BPMRPIFYVFDZHF-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1cc(-c2ccc(F)cc2)on1 ZINC001206836483 1049810070 /nfs/dbraw/zinc/81/00/70/1049810070.db2.gz NZFOAJFXCQTCCO-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1cc(-c2ccc(F)cc2)on1 ZINC001206836483 1049810075 /nfs/dbraw/zinc/81/00/75/1049810075.db2.gz NZFOAJFXCQTCCO-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO Fc1ccc(-c2cc(C[N@@H+]3CCc4ccccc4C3)no2)cc1 ZINC001206835433 1049811004 /nfs/dbraw/zinc/81/10/04/1049811004.db2.gz UISLTBOSUGUSBB-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1ccc(-c2cc(C[N@H+]3CCc4ccccc4C3)no2)cc1 ZINC001206835433 1049811008 /nfs/dbraw/zinc/81/10/08/1049811008.db2.gz UISLTBOSUGUSBB-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cn2sc3ccccc3c2=O)cc1 ZINC000912854414 1049811608 /nfs/dbraw/zinc/81/16/08/1049811608.db2.gz APKZLHIIWQLVIT-KRWDZBQOSA-N 1 2 324.449 4.166 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cn2sc3ccccc3c2=O)cc1 ZINC000912854414 1049811621 /nfs/dbraw/zinc/81/16/21/1049811621.db2.gz APKZLHIIWQLVIT-KRWDZBQOSA-N 1 2 324.449 4.166 20 0 DIADLO Cc1ncsc1C[N@H+](Cc1ccccc1)Cc1cccnc1 ZINC001206989783 1049816321 /nfs/dbraw/zinc/81/63/21/1049816321.db2.gz MPOXDCYHZKAKEQ-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1ncsc1C[N@@H+](Cc1ccccc1)Cc1cccnc1 ZINC001206989783 1049816329 /nfs/dbraw/zinc/81/63/29/1049816329.db2.gz MPOXDCYHZKAKEQ-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO CCc1ccc(C2CC[NH+](Cc3nn(C)cc3Cl)CC2)cc1 ZINC001207017600 1049821793 /nfs/dbraw/zinc/82/17/93/1049821793.db2.gz KZIVHGRFWMKIPC-UHFFFAOYSA-N 1 2 317.864 4.016 20 0 DIADLO Cc1cc(C)cc([C@@H]2CCCN2Cc2[nH+]cc3ccccn32)c1 ZINC001207054390 1049827961 /nfs/dbraw/zinc/82/79/61/1049827961.db2.gz KTWBJCCICVNLDF-IBGZPJMESA-N 1 2 305.425 4.288 20 0 DIADLO Cc1ncc(C[N@H+](Cc2ccccc2)Cc2ccncc2)s1 ZINC001207058139 1049828332 /nfs/dbraw/zinc/82/83/32/1049828332.db2.gz BKLCJQLECXHRTH-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2ccccc2)Cc2ccncc2)s1 ZINC001207058139 1049828340 /nfs/dbraw/zinc/82/83/40/1049828340.db2.gz BKLCJQLECXHRTH-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2csc(C3CC3)n2)CCC1 ZINC000646024722 1049830065 /nfs/dbraw/zinc/83/00/65/1049830065.db2.gz HPTNFARYZMZVOU-UHFFFAOYSA-N 1 2 302.418 4.329 20 0 DIADLO C[N@H+](Cc1sc2ccccc2c1Cl)Cc1cccc(=O)[nH]1 ZINC001207072629 1049830103 /nfs/dbraw/zinc/83/01/03/1049830103.db2.gz FIICGJRWYQUXEW-UHFFFAOYSA-N 1 2 318.829 4.287 20 0 DIADLO C[N@@H+](Cc1sc2ccccc2c1Cl)Cc1cccc(=O)[nH]1 ZINC001207072629 1049830110 /nfs/dbraw/zinc/83/01/10/1049830110.db2.gz FIICGJRWYQUXEW-UHFFFAOYSA-N 1 2 318.829 4.287 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1Cl)c1cnn(C2CCC2)c1 ZINC000924856213 1049861356 /nfs/dbraw/zinc/86/13/56/1049861356.db2.gz AAJVQMCINYBRRN-NSHDSACASA-N 1 2 307.800 4.251 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCOC[C@H]2c2ccc(Cl)cc2)cc1 ZINC001207517453 1049902060 /nfs/dbraw/zinc/90/20/60/1049902060.db2.gz RICVUANSPSXKHN-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc(CC[N@H+]2CCOC[C@H]2c2ccc(Cl)cc2)cc1 ZINC001207517453 1049902066 /nfs/dbraw/zinc/90/20/66/1049902066.db2.gz RICVUANSPSXKHN-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO CCO[C@@H]1C[C@H](Nc2ccc3[nH+]c(C)cc(C)c3c2)[C@@H]1SC ZINC001207554339 1049908732 /nfs/dbraw/zinc/90/87/32/1049908732.db2.gz UDWRWFBHVOYOSA-KSZLIROESA-N 1 2 316.470 4.173 20 0 DIADLO COCC[C@@H](C)C[NH2+][C@@H](c1cccc(OC(C)C)c1)C(F)F ZINC000571536489 1049938397 /nfs/dbraw/zinc/93/83/97/1049938397.db2.gz JUXHVGWPVLJCSR-CJNGLKHVSA-N 1 2 315.404 4.042 20 0 DIADLO CCCC[C@@H](CCC)CNC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001207824976 1049940766 /nfs/dbraw/zinc/94/07/66/1049940766.db2.gz GRNGADSMZWZKCQ-CQSZACIVSA-N 1 2 302.422 4.062 20 0 DIADLO CC[N@H+](Cc1cc(C)co1)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC001207812695 1049941603 /nfs/dbraw/zinc/94/16/03/1049941603.db2.gz FWEXSACFEZGEAY-LBPRGKRZSA-N 1 2 304.459 4.191 20 0 DIADLO CC[N@@H+](Cc1cc(C)co1)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC001207812695 1049941614 /nfs/dbraw/zinc/94/16/14/1049941614.db2.gz FWEXSACFEZGEAY-LBPRGKRZSA-N 1 2 304.459 4.191 20 0 DIADLO FC(F)(F)c1cccc(CCC[NH+]2CC(F)(C3CC3)C2)c1 ZINC001207842232 1049946042 /nfs/dbraw/zinc/94/60/42/1049946042.db2.gz WEWMUKKYNDKKPC-UHFFFAOYSA-N 1 2 301.327 4.072 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@@H+](Cc1ccc3c(c1)CCCC3)C2 ZINC001207858503 1049946591 /nfs/dbraw/zinc/94/65/91/1049946591.db2.gz RURIRDAZTBIFCF-UHFFFAOYSA-N 1 2 313.391 4.402 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@H+](Cc1ccc3c(c1)CCCC3)C2 ZINC001207858503 1049946598 /nfs/dbraw/zinc/94/65/98/1049946598.db2.gz RURIRDAZTBIFCF-UHFFFAOYSA-N 1 2 313.391 4.402 20 0 DIADLO FC(F)n1cccc1CNc1[nH+]c2ccccc2n1CC1CC1 ZINC001207873490 1049948642 /nfs/dbraw/zinc/94/86/42/1049948642.db2.gz WKDHTZFYEGRLMO-UHFFFAOYSA-N 1 2 316.355 4.255 20 0 DIADLO CCNc1ccccc1CNc1[nH+]c2ccccc2n1C1CC1 ZINC001207876369 1049949098 /nfs/dbraw/zinc/94/90/98/1049949098.db2.gz SHOGPDSVLQUOBD-UHFFFAOYSA-N 1 2 306.413 4.415 20 0 DIADLO COCC1(CNc2[nH+]c3ccccc3n2C(C)(C)C)CCC1 ZINC001207872775 1049949272 /nfs/dbraw/zinc/94/92/72/1049949272.db2.gz HLMLWJJFDDVZMU-UHFFFAOYSA-N 1 2 301.434 4.020 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2cccc(F)c2)c2ccco2)cc1 ZINC000571904706 1049970331 /nfs/dbraw/zinc/97/03/31/1049970331.db2.gz WOVCENCYJXMVCP-IBGZPJMESA-N 1 2 311.356 4.307 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2cccc(F)c2)c2ccco2)cc1 ZINC000571904707 1049970661 /nfs/dbraw/zinc/97/06/61/1049970661.db2.gz WOVCENCYJXMVCP-LJQANCHMSA-N 1 2 311.356 4.307 20 0 DIADLO Oc1ccc(F)c(C[NH2+][C@@H]2CCc3sc(Cl)cc32)c1F ZINC000571946559 1049978626 /nfs/dbraw/zinc/97/86/26/1049978626.db2.gz BSRHJGGRLUVEGS-SNVBAGLBSA-N 1 2 315.772 4.162 20 0 DIADLO Cc1ccc([C@@H](C)CC[N@@H+]2Cc3cnn(-c4ccccc4)c3C2)o1 ZINC001208169751 1049980239 /nfs/dbraw/zinc/98/02/39/1049980239.db2.gz VCMRIGXULVYECQ-HNNXBMFYSA-N 1 2 321.424 4.283 20 0 DIADLO Cc1ccc([C@@H](C)CC[N@H+]2Cc3cnn(-c4ccccc4)c3C2)o1 ZINC001208169751 1049980244 /nfs/dbraw/zinc/98/02/44/1049980244.db2.gz VCMRIGXULVYECQ-HNNXBMFYSA-N 1 2 321.424 4.283 20 0 DIADLO C[C@@H](C[N@@H+]1CC(F)(F)C[C@]1(C)CO)c1cccc2ccccc21 ZINC001208704273 1050003225 /nfs/dbraw/zinc/00/32/25/1050003225.db2.gz JLMPTHJYAJFACU-KBXCAEBGSA-N 1 2 319.395 4.035 20 0 DIADLO C[C@@H](C[N@H+]1CC(F)(F)C[C@]1(C)CO)c1cccc2ccccc21 ZINC001208704273 1050003232 /nfs/dbraw/zinc/00/32/32/1050003232.db2.gz JLMPTHJYAJFACU-KBXCAEBGSA-N 1 2 319.395 4.035 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc4sccc4s3)ccc2[nH+]1 ZINC000588857547 1050006374 /nfs/dbraw/zinc/00/63/74/1050006374.db2.gz CERXZOMSYGFKKY-UHFFFAOYSA-N 1 2 313.407 4.171 20 0 DIADLO Cc1cn2cc(NC(=O)CCCCc3ccc(C)cc3)ccc2[nH+]1 ZINC000588857552 1050006477 /nfs/dbraw/zinc/00/64/77/1050006477.db2.gz CGGWRGXIHWVGCD-UHFFFAOYSA-N 1 2 321.424 4.303 20 0 DIADLO Clc1ccc([C@@H]2CCC[N@@H+]2Cc2cn3ccsc3n2)cc1 ZINC000588899877 1050007521 /nfs/dbraw/zinc/00/75/21/1050007521.db2.gz HLJHZDUEFOJVMT-HNNXBMFYSA-N 1 2 317.845 4.386 20 0 DIADLO Clc1ccc([C@@H]2CCC[N@H+]2Cc2cn3ccsc3n2)cc1 ZINC000588899877 1050007525 /nfs/dbraw/zinc/00/75/25/1050007525.db2.gz HLJHZDUEFOJVMT-HNNXBMFYSA-N 1 2 317.845 4.386 20 0 DIADLO CC[N@@H+](Cc1cn2cc(C)ccc2n1)Cc1ccc(Cl)s1 ZINC000588876691 1050008225 /nfs/dbraw/zinc/00/82/25/1050008225.db2.gz IQHOLQRQUWSICX-UHFFFAOYSA-N 1 2 319.861 4.380 20 0 DIADLO CC[N@H+](Cc1cn2cc(C)ccc2n1)Cc1ccc(Cl)s1 ZINC000588876691 1050008231 /nfs/dbraw/zinc/00/82/31/1050008231.db2.gz IQHOLQRQUWSICX-UHFFFAOYSA-N 1 2 319.861 4.380 20 0 DIADLO Cc1ncc(CNc2cc(C)c3cccc(C(C)C)c3[nH+]2)cn1 ZINC001168385222 1050008282 /nfs/dbraw/zinc/00/82/82/1050008282.db2.gz TWTLZJRIFYFZOY-UHFFFAOYSA-N 1 2 306.413 4.377 20 0 DIADLO C[C@@H]1CC[N@H+](CCCCCOCc2ccccc2)CC1(F)F ZINC001208811153 1050011746 /nfs/dbraw/zinc/01/17/46/1050011746.db2.gz JFCKIQNTDQXUQQ-MRXNPFEDSA-N 1 2 311.416 4.351 20 0 DIADLO C[C@@H]1CC[N@@H+](CCCCCOCc2ccccc2)CC1(F)F ZINC001208811153 1050011750 /nfs/dbraw/zinc/01/17/50/1050011750.db2.gz JFCKIQNTDQXUQQ-MRXNPFEDSA-N 1 2 311.416 4.351 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)C[C@@H](C)C(F)(F)F ZINC001208899988 1050021798 /nfs/dbraw/zinc/02/17/98/1050021798.db2.gz INBZDSVDQKEPQD-OCCSQVGLSA-N 1 2 301.352 4.168 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)C[C@@H](C)C(F)(F)F ZINC001208899988 1050021804 /nfs/dbraw/zinc/02/18/04/1050021804.db2.gz INBZDSVDQKEPQD-OCCSQVGLSA-N 1 2 301.352 4.168 20 0 DIADLO CCOC(C)(C)C[N@@H+]1CC[C@@H](Cc2ccccc2)C(F)(F)C1 ZINC001209078526 1050033190 /nfs/dbraw/zinc/03/31/90/1050033190.db2.gz JEZNHBUYLWJFKK-INIZCTEOSA-N 1 2 311.416 4.001 20 0 DIADLO CCOC(C)(C)C[N@H+]1CC[C@@H](Cc2ccccc2)C(F)(F)C1 ZINC001209078526 1050033196 /nfs/dbraw/zinc/03/31/96/1050033196.db2.gz JEZNHBUYLWJFKK-INIZCTEOSA-N 1 2 311.416 4.001 20 0 DIADLO c1csc(C[N@@H+]2CCc3ccccc3[C@H]2c2ccccc2)n1 ZINC000572728588 1050040423 /nfs/dbraw/zinc/04/04/23/1050040423.db2.gz WPFPMJFZOWKSNS-LJQANCHMSA-N 1 2 306.434 4.291 20 0 DIADLO c1csc(C[N@H+]2CCc3ccccc3[C@H]2c2ccccc2)n1 ZINC000572728588 1050040426 /nfs/dbraw/zinc/04/04/26/1050040426.db2.gz WPFPMJFZOWKSNS-LJQANCHMSA-N 1 2 306.434 4.291 20 0 DIADLO CCc1cncc(Nc2cc[nH+]c(NC(=O)OC(C)(C)C)c2)c1 ZINC001209165887 1050040835 /nfs/dbraw/zinc/04/08/35/1050040835.db2.gz TURMITFPTLFUGF-UHFFFAOYSA-N 1 2 314.389 4.130 20 0 DIADLO Fc1ccc2oc(C[N@@H+]3CC[C@@](F)(c4ccccc4)C3)nc2c1 ZINC000572783625 1050043376 /nfs/dbraw/zinc/04/33/76/1050043376.db2.gz ZCUBPRZRSBBTEL-SFHVURJKSA-N 1 2 314.335 4.038 20 0 DIADLO Fc1ccc2oc(C[N@H+]3CC[C@@](F)(c4ccccc4)C3)nc2c1 ZINC000572783625 1050043378 /nfs/dbraw/zinc/04/33/78/1050043378.db2.gz ZCUBPRZRSBBTEL-SFHVURJKSA-N 1 2 314.335 4.038 20 0 DIADLO Cc1noc(C)c1CNc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000572804914 1050043445 /nfs/dbraw/zinc/04/34/45/1050043445.db2.gz OIWSNFABOBTDKB-UHFFFAOYSA-N 1 2 322.412 4.103 20 0 DIADLO FC1(F)C[N@H+](CCCc2ccncc2)CC[C@H]1c1ccccc1 ZINC001209191797 1050043499 /nfs/dbraw/zinc/04/34/99/1050043499.db2.gz PACZCUFASRIVRJ-SFHVURJKSA-N 1 2 316.395 4.139 20 0 DIADLO FC1(F)C[N@@H+](CCCc2ccncc2)CC[C@H]1c1ccccc1 ZINC001209191797 1050043502 /nfs/dbraw/zinc/04/35/02/1050043502.db2.gz PACZCUFASRIVRJ-SFHVURJKSA-N 1 2 316.395 4.139 20 0 DIADLO CCCOc1ccc(NCc2c[nH+]cn2CCC)cc1Cl ZINC000090204762 1050043546 /nfs/dbraw/zinc/04/35/46/1050043546.db2.gz USRIPJQUJYLDNO-UHFFFAOYSA-N 1 2 307.825 4.347 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1ccccc1Cl ZINC000589605168 1050048485 /nfs/dbraw/zinc/04/84/85/1050048485.db2.gz QXFYWKZXGSPMRR-KDOFPFPSSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1ccccc1Cl ZINC000589605168 1050048490 /nfs/dbraw/zinc/04/84/90/1050048490.db2.gz QXFYWKZXGSPMRR-KDOFPFPSSA-N 1 2 301.817 4.302 20 0 DIADLO Cn1nc(C[NH2+]Cc2ccc(Cl)cc2Cl)c2ccccc21 ZINC000589633786 1050050903 /nfs/dbraw/zinc/05/09/03/1050050903.db2.gz KEKQPLWBBGWXMN-UHFFFAOYSA-N 1 2 320.223 4.170 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2n[nH]c3ccccc32)cc1 ZINC000589641776 1050052906 /nfs/dbraw/zinc/05/29/06/1050052906.db2.gz PLHZTUYTHLIWMT-AWEZNQCLSA-N 1 2 309.413 4.201 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+]Cc1[nH]nc2ccccc21 ZINC000589646872 1050053713 /nfs/dbraw/zinc/05/37/13/1050053713.db2.gz DWTFRRHHPAJPPL-UHFFFAOYSA-N 1 2 306.196 4.160 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+]Cc1cnc2ccccc2n1 ZINC000589836164 1050059956 /nfs/dbraw/zinc/05/99/56/1050059956.db2.gz HNXIKSDEPRUREL-UHFFFAOYSA-N 1 2 318.207 4.226 20 0 DIADLO Cc1ccc2[nH]cc(C[N@@H+]3CCOC[C@H]3c3ccc(F)cc3)c2c1 ZINC001209499785 1050063782 /nfs/dbraw/zinc/06/37/82/1050063782.db2.gz LOOSSRXNRRVGIV-FQEVSTJZSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1ccc2[nH]cc(C[N@H+]3CCOC[C@H]3c3ccc(F)cc3)c2c1 ZINC001209499785 1050063787 /nfs/dbraw/zinc/06/37/87/1050063787.db2.gz LOOSSRXNRRVGIV-FQEVSTJZSA-N 1 2 324.399 4.189 20 0 DIADLO CCc1ccc([C@H](C)C(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)cc1 ZINC000589941959 1050069483 /nfs/dbraw/zinc/06/94/83/1050069483.db2.gz SAQJXHQIXZTYMR-LBPRGKRZSA-N 1 2 307.397 4.176 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2c(F)cccc2N2CCCC2)n1 ZINC000590074472 1050073978 /nfs/dbraw/zinc/07/39/78/1050073978.db2.gz KGXFJURPVPLLPZ-CYBMUJFWSA-N 1 2 319.449 4.042 20 0 DIADLO COc1cc(C[N@H+](C)Cc2cccc(F)c2)c(F)cc1Cl ZINC001209662173 1050075067 /nfs/dbraw/zinc/07/50/67/1050075067.db2.gz LLTCBFXWIZARIH-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2cccc(F)c2)c(F)cc1Cl ZINC001209662173 1050075073 /nfs/dbraw/zinc/07/50/73/1050075073.db2.gz LLTCBFXWIZARIH-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccncc2)c(F)cc1Cl ZINC001209665394 1050075128 /nfs/dbraw/zinc/07/51/28/1050075128.db2.gz YBEBBVGYIZQKJD-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccncc2)c(F)cc1Cl ZINC001209665394 1050075130 /nfs/dbraw/zinc/07/51/30/1050075130.db2.gz YBEBBVGYIZQKJD-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(Cl)ccc(C[N@H+](C)Cc2cccc(F)c2)c1F ZINC001209699471 1050077884 /nfs/dbraw/zinc/07/78/84/1050077884.db2.gz RNRJHKOPTWDGCR-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1c(Cl)ccc(C[N@@H+](C)Cc2cccc(F)c2)c1F ZINC001209699471 1050077890 /nfs/dbraw/zinc/07/78/90/1050077890.db2.gz RNRJHKOPTWDGCR-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc3cc(Cl)ccc3[nH]2)no1 ZINC001209718231 1050077943 /nfs/dbraw/zinc/07/79/43/1050077943.db2.gz KSCAVCAVMBDWQQ-QGZVFWFLSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cc3cc(Cl)ccc3[nH]2)no1 ZINC001209718231 1050077948 /nfs/dbraw/zinc/07/79/48/1050077948.db2.gz KSCAVCAVMBDWQQ-QGZVFWFLSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1ccc(NC(=O)Nc2cc[nH+]c(N3CCCCC3)c2)cc1 ZINC001209728350 1050078591 /nfs/dbraw/zinc/07/85/91/1050078591.db2.gz KQQCHRFQJUKXGS-UHFFFAOYSA-N 1 2 310.401 4.024 20 0 DIADLO COc1c(F)ccc(Nc2cccc3[nH+]c(C)cn32)c1Cl ZINC001209800359 1050085726 /nfs/dbraw/zinc/08/57/26/1050085726.db2.gz LXHUIBVZYHWYHZ-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO COc1c(F)ccc(Nc2ccc(N3CCCC3)[nH+]c2)c1Cl ZINC001209802417 1050086632 /nfs/dbraw/zinc/08/66/32/1050086632.db2.gz HVYQVDKYFBZUPX-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO FC(F)(F)c1cnc(Nc2ccc3[nH]c[nH+]c3c2)c(Cl)c1 ZINC001209841081 1050093195 /nfs/dbraw/zinc/09/31/95/1050093195.db2.gz CVTNVKXLQFDGRA-UHFFFAOYSA-N 1 2 312.682 4.374 20 0 DIADLO FC(F)(F)c1cc(Cl)nc(Nc2ccc3[nH]c[nH+]c3c2)c1 ZINC001209843505 1050093302 /nfs/dbraw/zinc/09/33/02/1050093302.db2.gz YUSGDPXKAKUOQH-UHFFFAOYSA-N 1 2 312.682 4.374 20 0 DIADLO Cc1cc(Br)c(Nc2ccc3[nH]c[nH+]c3c2)nc1C ZINC001209844456 1050093872 /nfs/dbraw/zinc/09/38/72/1050093872.db2.gz NQNIYCMIBDCOQX-UHFFFAOYSA-N 1 2 317.190 4.081 20 0 DIADLO FC(F)(F)c1ccc(Cl)c(Nc2ccc3[nH]c[nH+]c3c2)n1 ZINC001209848502 1050095104 /nfs/dbraw/zinc/09/51/04/1050095104.db2.gz MORMWOKTLRGKQL-UHFFFAOYSA-N 1 2 312.682 4.374 20 0 DIADLO COc1cc(C(F)(F)F)ccc1Nc1cccc2[nH+]c(C)cn21 ZINC001209879244 1050099061 /nfs/dbraw/zinc/09/90/61/1050099061.db2.gz CTUWKOMDYRLOLN-UHFFFAOYSA-N 1 2 321.302 4.414 20 0 DIADLO CCOc1cc[nH+]cc1Nc1ccc(C(F)(F)F)cc1OC ZINC001209879925 1050099402 /nfs/dbraw/zinc/09/94/02/1050099402.db2.gz BBKGIAFTOILHIG-UHFFFAOYSA-N 1 2 312.291 4.251 20 0 DIADLO COc1cc(C(F)(F)F)ccc1Nc1cccn2cc(C)[nH+]c12 ZINC001209882323 1050099832 /nfs/dbraw/zinc/09/98/32/1050099832.db2.gz WVOWYAQHPNTFAF-UHFFFAOYSA-N 1 2 321.302 4.414 20 0 DIADLO Fc1cc(Cl)cc(Nc2ccccc2C[NH+]2CCOCC2)c1 ZINC001209927595 1050107951 /nfs/dbraw/zinc/10/79/51/1050107951.db2.gz XMPHNQTZSXPZBT-UHFFFAOYSA-N 1 2 320.795 4.055 20 0 DIADLO Cc1cc2cc(Nc3ccccc3C[NH+]3CCOCC3)ccc2o1 ZINC001209930924 1050108121 /nfs/dbraw/zinc/10/81/21/1050108121.db2.gz VOWZQMBYKVUIMZ-UHFFFAOYSA-N 1 2 322.408 4.317 20 0 DIADLO CCCc1ccccc1Nc1ccccc1C[NH+]1CCOCC1 ZINC001209931098 1050108154 /nfs/dbraw/zinc/10/81/54/1050108154.db2.gz ZMJFVWXKHZPHQB-UHFFFAOYSA-N 1 2 310.441 4.215 20 0 DIADLO Cc1cn2cccc(Nc3cc(C(F)(F)F)ccc3O)c2[nH+]1 ZINC001209979021 1050115079 /nfs/dbraw/zinc/11/50/79/1050115079.db2.gz OTJOYAGIVVVFNJ-UHFFFAOYSA-N 1 2 307.275 4.111 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@H+]1Cc1coc(-c2ccccc2)n1 ZINC000590938424 1050115900 /nfs/dbraw/zinc/11/59/00/1050115900.db2.gz LGRQWEPJSUHYGP-HNNXBMFYSA-N 1 2 320.392 4.297 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1coc(-c2ccccc2)n1 ZINC000590938424 1050115902 /nfs/dbraw/zinc/11/59/02/1050115902.db2.gz LGRQWEPJSUHYGP-HNNXBMFYSA-N 1 2 320.392 4.297 20 0 DIADLO Cc1cc(Nc2ccc(Oc3ncccn3)cc2)ccc1[NH+](C)C ZINC001210041343 1050127629 /nfs/dbraw/zinc/12/76/29/1050127629.db2.gz MITWQEPIMWPIOT-UHFFFAOYSA-N 1 2 320.396 4.387 20 0 DIADLO Cc1cc(Nc2ccc3c(c2)C(C)(C)NC(=O)N3)ccc1[NH+](C)C ZINC001210043300 1050127640 /nfs/dbraw/zinc/12/76/40/1050127640.db2.gz CUCIRZMSJWAUTQ-UHFFFAOYSA-N 1 2 324.428 4.175 20 0 DIADLO Nc1cccc(-c2cccc(Nc3ccc4c[nH+]ccc4c3)n2)n1 ZINC001210046149 1050128730 /nfs/dbraw/zinc/12/87/30/1050128730.db2.gz VNLIHQZVIZJRBZ-UHFFFAOYSA-N 1 2 313.364 4.018 20 0 DIADLO COc1ccc(C(C)=O)cc1Nc1ccc2c(C)cc[nH+]c2c1 ZINC001210080645 1050133708 /nfs/dbraw/zinc/13/37/08/1050133708.db2.gz YKVWMVVBMXNDPF-UHFFFAOYSA-N 1 2 306.365 4.498 20 0 DIADLO Cc1cc2n[nH]cc2cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001210100464 1050136253 /nfs/dbraw/zinc/13/62/53/1050136253.db2.gz OYJSTUCZJBQFHC-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3nc(-c4ccccc4)no3)CCC2)cc1 ZINC000591375936 1050142578 /nfs/dbraw/zinc/14/25/78/1050142578.db2.gz SUYRMZWJPOTWJL-UHFFFAOYSA-N 1 2 323.371 4.045 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+]C[C@H]2C[C@@H]2c2ccccc2)cc1 ZINC000770428015 1050158376 /nfs/dbraw/zinc/15/83/76/1050158376.db2.gz GEFAZZINFMYZGE-HGHGUNKESA-N 1 2 322.452 4.127 20 0 DIADLO COC(=O)c1cc(Nc2cccc3cc[nH+]cc32)c(Cl)s1 ZINC001210223977 1050165114 /nfs/dbraw/zinc/16/51/14/1050165114.db2.gz MJZRUPJHJLWRGW-UHFFFAOYSA-N 1 2 318.785 4.480 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]Cc1nccc(C)n1 ZINC000347994667 1050165958 /nfs/dbraw/zinc/16/59/58/1050165958.db2.gz DJRAFKMCLBEJCT-ZDUSSCGKSA-N 1 2 324.453 4.068 20 0 DIADLO Cc1cccc(-n2nccc2Nc2cccc3cc[nH+]cc32)c1 ZINC001210225020 1050167559 /nfs/dbraw/zinc/16/75/59/1050167559.db2.gz AVCNPELEJZLZHV-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO Oc1ccc(-c2ncc(Nc3cccc4cc[nH+]cc43)cn2)cc1 ZINC001210225585 1050167691 /nfs/dbraw/zinc/16/76/91/1050167691.db2.gz KIGBIRFXNMLMCL-UHFFFAOYSA-N 1 2 314.348 4.141 20 0 DIADLO Oc1ccccc1-c1cc(Nc2cccc3cc[nH+]cc32)on1 ZINC001210226058 1050167729 /nfs/dbraw/zinc/16/77/29/1050167729.db2.gz QNYGQKKJSDPPQY-UHFFFAOYSA-N 1 2 303.321 4.339 20 0 DIADLO c1cnc(Nc2cccc3cc[nH+]cc32)c(N2CCCCC2)c1 ZINC001210225571 1050167910 /nfs/dbraw/zinc/16/79/10/1050167910.db2.gz JSHOKQGZIFDIMI-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO FC(F)(F)Oc1cncc(Nc2cccc3cc[nH+]cc32)c1 ZINC001210225153 1050168116 /nfs/dbraw/zinc/16/81/16/1050168116.db2.gz DOMBMUCBMRQGDW-UHFFFAOYSA-N 1 2 305.259 4.272 20 0 DIADLO Cc1cn(-c2ccc(Nc3cccc4cc[nH+]cc43)cc2)cn1 ZINC001210231233 1050168326 /nfs/dbraw/zinc/16/83/26/1050168326.db2.gz JXNFBFAAPFGKCO-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO COC(=O)c1cc(F)c(F)cc1Nc1cccc2cc[nH+]cc21 ZINC001210230802 1050168527 /nfs/dbraw/zinc/16/85/27/1050168527.db2.gz CVXHNSRIFCALQA-UHFFFAOYSA-N 1 2 314.291 4.043 20 0 DIADLO COC(=O)c1c(F)cc(F)cc1Nc1cccc2cc[nH+]cc21 ZINC001210232398 1050170294 /nfs/dbraw/zinc/17/02/94/1050170294.db2.gz RAHAWPXKXRDWMS-UHFFFAOYSA-N 1 2 314.291 4.043 20 0 DIADLO FC(F)(F)c1ncccc1Nc1ccccc1-n1cc[nH+]c1 ZINC001210234636 1050172382 /nfs/dbraw/zinc/17/23/82/1050172382.db2.gz ZJMZNGDNJPTBBR-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO COC(=[NH2+])c1cccc(NCCc2ccccc2C(F)(F)F)c1 ZINC001171041013 1050175876 /nfs/dbraw/zinc/17/58/76/1050175876.db2.gz LRXYUXJRVRMLHE-UHFFFAOYSA-N 1 2 322.330 4.332 20 0 DIADLO CCCCOc1ccc(C[NH2+][C@H](C)c2cc(C)on2)cc1OC ZINC000282699296 1050178513 /nfs/dbraw/zinc/17/85/13/1050178513.db2.gz OTHBGYKWVRDJBP-CQSZACIVSA-N 1 2 318.417 4.021 20 0 DIADLO CCc1nnc([C@H](C)[N@H+](C)Cc2csc3ccccc23)o1 ZINC000348063285 1050179408 /nfs/dbraw/zinc/17/94/08/1050179408.db2.gz LYECHTFEJXBVCL-NSHDSACASA-N 1 2 301.415 4.040 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+](C)Cc2csc3ccccc23)o1 ZINC000348063285 1050179411 /nfs/dbraw/zinc/17/94/11/1050179411.db2.gz LYECHTFEJXBVCL-NSHDSACASA-N 1 2 301.415 4.040 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nc3cccc(Cl)c3n2C)oc1C ZINC000282699484 1050179667 /nfs/dbraw/zinc/17/96/67/1050179667.db2.gz KUJPVOKGSZJEQW-NSHDSACASA-N 1 2 317.820 4.287 20 0 DIADLO Cc1ccc([C@H](C)OC(=O)c2cccc(Cn3cc[nH+]c3)c2)cc1 ZINC000770653325 1050185661 /nfs/dbraw/zinc/18/56/61/1050185661.db2.gz NSEZRIFTAYPRMR-INIZCTEOSA-N 1 2 320.392 4.158 20 0 DIADLO CCC[N@H+](CC(F)(F)C(F)F)[C@H]1CCc2ccccc2C1 ZINC000733897596 1050185948 /nfs/dbraw/zinc/18/59/48/1050185948.db2.gz JXHZXTAQVRAODB-AWEZNQCLSA-N 1 2 303.343 4.156 20 0 DIADLO CCC[N@@H+](CC(F)(F)C(F)F)[C@H]1CCc2ccccc2C1 ZINC000733897596 1050185951 /nfs/dbraw/zinc/18/59/51/1050185951.db2.gz JXHZXTAQVRAODB-AWEZNQCLSA-N 1 2 303.343 4.156 20 0 DIADLO Cc1[nH+]cc(Nc2cccnc2Oc2ccc(F)cc2)cc1N ZINC001210287238 1050189399 /nfs/dbraw/zinc/18/93/99/1050189399.db2.gz PEHZUGQTCGUBRT-UHFFFAOYSA-N 1 2 310.332 4.042 20 0 DIADLO Cc1[nH+]cc(Nc2cc(C3CCC3)nn2-c2ccccc2)cc1N ZINC001210289249 1050192041 /nfs/dbraw/zinc/19/20/41/1050192041.db2.gz YZBRRVXHLJGOKJ-UHFFFAOYSA-N 1 2 319.412 4.169 20 0 DIADLO Cc1[nH+]cc(Nc2cc3ncccc3c(C(F)(F)F)c2)cc1N ZINC001210291965 1050192604 /nfs/dbraw/zinc/19/26/04/1050192604.db2.gz WGRVBXUGJLSFLS-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO CC(C)CN(C(=O)C[C@H](C)n1cc[nH+]c1)c1cccc(Cl)c1 ZINC000573497581 1050206429 /nfs/dbraw/zinc/20/64/29/1050206429.db2.gz ZLCHPIVJKLAOFY-AWEZNQCLSA-N 1 2 319.836 4.177 20 0 DIADLO FC(F)Oc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001210327250 1050206514 /nfs/dbraw/zinc/20/65/14/1050206514.db2.gz FFXJJJQMUBWFPO-UHFFFAOYSA-N 1 2 315.323 4.276 20 0 DIADLO Cc1ccc(Nc2ccc3c(cnn3[C@H]3CCCCO3)c2)[nH+]c1 ZINC001210331784 1050207878 /nfs/dbraw/zinc/20/78/78/1050207878.db2.gz WIQPFNPITFPXOV-GOSISDBHSA-N 1 2 308.385 4.182 20 0 DIADLO Cc1ccn2c(C[N@@H+](C)[C@H](C)c3ccccc3Cl)cnc2c1 ZINC001136892164 1050221691 /nfs/dbraw/zinc/22/16/91/1050221691.db2.gz AHJGUCIHQAMYLI-CQSZACIVSA-N 1 2 313.832 4.489 20 0 DIADLO Cc1ccn2c(C[N@H+](C)[C@H](C)c3ccccc3Cl)cnc2c1 ZINC001136892164 1050221705 /nfs/dbraw/zinc/22/17/05/1050221705.db2.gz AHJGUCIHQAMYLI-CQSZACIVSA-N 1 2 313.832 4.489 20 0 DIADLO FC(F)(F)CCSCc1c[nH+]cn1Cc1ccccc1 ZINC000478754295 1050222807 /nfs/dbraw/zinc/22/28/07/1050222807.db2.gz NXOYZJXBPMSEPB-UHFFFAOYSA-N 1 2 300.349 4.117 20 0 DIADLO CC(=O)c1ccc([C@H](C)Nc2cc(C)[nH+]c(OC(F)F)c2)cc1 ZINC001171059972 1050225338 /nfs/dbraw/zinc/22/53/38/1050225338.db2.gz RCBQNLJYXNZYOK-NSHDSACASA-N 1 2 320.339 4.367 20 0 DIADLO Clc1ccc(C[N@H+](Cc2ccccc2)Cc2ccncc2)nc1 ZINC001136925487 1050235646 /nfs/dbraw/zinc/23/56/46/1050235646.db2.gz AZZNGFLYTGXCLH-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1ccc(C[N@@H+](Cc2ccccc2)Cc2ccncc2)nc1 ZINC001136925487 1050235659 /nfs/dbraw/zinc/23/56/59/1050235659.db2.gz AZZNGFLYTGXCLH-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(Cl)cn1 ZINC001136932321 1050235744 /nfs/dbraw/zinc/23/57/44/1050235744.db2.gz DDBPAYIDZSAVOD-KRWDZBQOSA-N 1 2 316.832 4.218 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(Cl)cn1 ZINC001136932321 1050235755 /nfs/dbraw/zinc/23/57/55/1050235755.db2.gz DDBPAYIDZSAVOD-KRWDZBQOSA-N 1 2 316.832 4.218 20 0 DIADLO C[N@H+](CCC(=O)c1cccs1)Cc1nc2ccccc2s1 ZINC001136956200 1050253401 /nfs/dbraw/zinc/25/34/01/1050253401.db2.gz JGCWJBBWKOHYQM-UHFFFAOYSA-N 1 2 316.451 4.063 20 0 DIADLO C[N@@H+](CCC(=O)c1cccs1)Cc1nc2ccccc2s1 ZINC001136956200 1050253417 /nfs/dbraw/zinc/25/34/17/1050253417.db2.gz JGCWJBBWKOHYQM-UHFFFAOYSA-N 1 2 316.451 4.063 20 0 DIADLO c1ccc2sc(C[N@@H+]3CCOC[C@@H]3C3CCCCC3)nc2c1 ZINC001136957749 1050255657 /nfs/dbraw/zinc/25/56/57/1050255657.db2.gz NJLDAHLYNPQNEM-MRXNPFEDSA-N 1 2 316.470 4.077 20 0 DIADLO c1ccc2sc(C[N@H+]3CCOC[C@@H]3C3CCCCC3)nc2c1 ZINC001136957749 1050255663 /nfs/dbraw/zinc/25/56/63/1050255663.db2.gz NJLDAHLYNPQNEM-MRXNPFEDSA-N 1 2 316.470 4.077 20 0 DIADLO CCc1ncccc1Nc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001210463412 1050256624 /nfs/dbraw/zinc/25/66/24/1050256624.db2.gz IUMGCRPASOMWQJ-UHFFFAOYSA-N 1 2 314.389 4.130 20 0 DIADLO CCCCCOc1ccc(C[NH2+]Cc2coc(CC)n2)cc1 ZINC000825051015 1050267234 /nfs/dbraw/zinc/26/72/34/1050267234.db2.gz UGZNNLLXKQQWBM-UHFFFAOYSA-N 1 2 302.418 4.096 20 0 DIADLO CC(C)CC1CC[NH+]([C@H](C)C(=O)Nc2c(F)cccc2F)CC1 ZINC000760925607 1050267034 /nfs/dbraw/zinc/26/70/34/1050267034.db2.gz LOHZDWROVZRIPD-CYBMUJFWSA-N 1 2 324.415 4.050 20 0 DIADLO Fc1ccc(Br)c(C[N@H+]2CCC[C@@H](F)CC2)c1F ZINC001143329761 1050282218 /nfs/dbraw/zinc/28/22/18/1050282218.db2.gz VQOAHNIGHSPAHC-SECBINFHSA-N 1 2 322.168 4.051 20 0 DIADLO Fc1ccc(Br)c(C[N@@H+]2CCC[C@@H](F)CC2)c1F ZINC001143329761 1050282228 /nfs/dbraw/zinc/28/22/28/1050282228.db2.gz VQOAHNIGHSPAHC-SECBINFHSA-N 1 2 322.168 4.051 20 0 DIADLO COc1cc(F)c(F)cc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001210546680 1050289675 /nfs/dbraw/zinc/28/96/75/1050289675.db2.gz UBYPJOPLSUQUGT-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(Br)ccc(F)c2F)C2(CC2)C1 ZINC001143338176 1050292249 /nfs/dbraw/zinc/29/22/49/1050292249.db2.gz LQECHSSATBSAJO-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c(Br)ccc(F)c2F)C2(CC2)C1 ZINC001143338176 1050292254 /nfs/dbraw/zinc/29/22/54/1050292254.db2.gz LQECHSSATBSAJO-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO COC(=O)c1coc([C@H](C)[NH2+]C2(c3ccccc3Cl)CC2)c1 ZINC000592391802 1050296675 /nfs/dbraw/zinc/29/66/75/1050296675.db2.gz LEJDUJOZGRJXMV-NSHDSACASA-N 1 2 319.788 4.060 20 0 DIADLO COC(=O)c1coc([C@@H](C)[NH2+]C2(c3ccccc3Cl)CC2)c1 ZINC000592391801 1050296728 /nfs/dbraw/zinc/29/67/28/1050296728.db2.gz LEJDUJOZGRJXMV-LLVKDONJSA-N 1 2 319.788 4.060 20 0 DIADLO c1ccc2c(c1)oc1c2CC[N@@H+](Cc2ccc3c(c2)COC3)C1 ZINC001137029423 1050300486 /nfs/dbraw/zinc/30/04/86/1050300486.db2.gz XPSMXOSUYHAYJY-UHFFFAOYSA-N 1 2 305.377 4.021 20 0 DIADLO c1ccc2c(c1)oc1c2CC[N@H+](Cc2ccc3c(c2)COC3)C1 ZINC001137029423 1050300490 /nfs/dbraw/zinc/30/04/90/1050300490.db2.gz XPSMXOSUYHAYJY-UHFFFAOYSA-N 1 2 305.377 4.021 20 0 DIADLO FC[C@H]1CCC[N@@H+]1Cc1ccc(Cl)c(OC(F)(F)F)c1 ZINC001143365637 1050317571 /nfs/dbraw/zinc/31/75/71/1050317571.db2.gz PPFAGUPUYJRFFD-SNVBAGLBSA-N 1 2 311.706 4.173 20 0 DIADLO FC[C@H]1CCC[N@H+]1Cc1ccc(Cl)c(OC(F)(F)F)c1 ZINC001143365637 1050317580 /nfs/dbraw/zinc/31/75/80/1050317580.db2.gz PPFAGUPUYJRFFD-SNVBAGLBSA-N 1 2 311.706 4.173 20 0 DIADLO CCCCC[N@H+](Cn1nc(OC(C)C)sc1=S)C(C)C ZINC000734829751 1050322018 /nfs/dbraw/zinc/32/20/18/1050322018.db2.gz YBROMAXHZOWKFW-UHFFFAOYSA-N 1 2 317.524 4.319 20 0 DIADLO CCCCC[N@@H+](Cn1nc(OC(C)C)sc1=S)C(C)C ZINC000734829751 1050322032 /nfs/dbraw/zinc/32/20/32/1050322032.db2.gz YBROMAXHZOWKFW-UHFFFAOYSA-N 1 2 317.524 4.319 20 0 DIADLO CC[C@@]12C[C@@H](CO1)[N@H+](Cc1ccc(C(F)(F)F)cc1Cl)C2 ZINC001143715137 1050338107 /nfs/dbraw/zinc/33/81/07/1050338107.db2.gz CMPMPZVJVPRMBS-JSGCOSHPSA-N 1 2 319.754 4.112 20 0 DIADLO CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1ccc(C(F)(F)F)cc1Cl)C2 ZINC001143715137 1050338113 /nfs/dbraw/zinc/33/81/13/1050338113.db2.gz CMPMPZVJVPRMBS-JSGCOSHPSA-N 1 2 319.754 4.112 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)cc1Cl ZINC001143734137 1050342684 /nfs/dbraw/zinc/34/26/84/1050342684.db2.gz CBDSUZWVXZUFQS-SNVBAGLBSA-N 1 2 321.770 4.355 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2CCC(F)(F)[C@H](C)C2)cc1Cl ZINC001143734137 1050342693 /nfs/dbraw/zinc/34/26/93/1050342693.db2.gz CBDSUZWVXZUFQS-SNVBAGLBSA-N 1 2 321.770 4.355 20 0 DIADLO Cc1c(F)cc(F)cc1C[N@@H+](CC(=O)c1ccccc1)C(C)C ZINC001143767740 1050353475 /nfs/dbraw/zinc/35/34/75/1050353475.db2.gz JVKDNYCIAIAITD-UHFFFAOYSA-N 1 2 317.379 4.367 20 0 DIADLO Cc1c(F)cc(F)cc1C[N@H+](CC(=O)c1ccccc1)C(C)C ZINC001143767740 1050353483 /nfs/dbraw/zinc/35/34/83/1050353483.db2.gz JVKDNYCIAIAITD-UHFFFAOYSA-N 1 2 317.379 4.367 20 0 DIADLO Cc1ccc2c(Nc3ccccc3-n3cccn3)cccc2[nH+]1 ZINC001210733472 1050353737 /nfs/dbraw/zinc/35/37/37/1050353737.db2.gz CANPKKIHUSQTAQ-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO FC(F)(F)COc1ccc(Nc2cccc3[nH+]ccn32)cc1 ZINC001210741370 1050356725 /nfs/dbraw/zinc/35/67/25/1050356725.db2.gz OTLRSAQWSDXOKL-UHFFFAOYSA-N 1 2 307.275 4.019 20 0 DIADLO Cc1c2cc(F)ccc2oc1C[NH2+]Cc1nnc(C(C)C)s1 ZINC000826604197 1050368557 /nfs/dbraw/zinc/36/85/57/1050368557.db2.gz MOWHATASXVVYFN-UHFFFAOYSA-N 1 2 319.405 4.145 20 0 DIADLO Brc1ccoc1C[NH2+][C@@H]1CSCc2ccccc21 ZINC000735324185 1050370854 /nfs/dbraw/zinc/37/08/54/1050370854.db2.gz GSHZUGDWKIJDTG-CYBMUJFWSA-N 1 2 324.243 4.120 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCC23CCCC3)c1Br ZINC001143813794 1050372967 /nfs/dbraw/zinc/37/29/67/1050372967.db2.gz YXXYWKUYSHDWEM-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCC23CCCC3)c1Br ZINC001143813794 1050372973 /nfs/dbraw/zinc/37/29/73/1050372973.db2.gz YXXYWKUYSHDWEM-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO CC(C)[C@H]1C[N@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)CCO1 ZINC001143812774 1050373140 /nfs/dbraw/zinc/37/31/40/1050373140.db2.gz ZCDKOWQFAXFQOY-CQSZACIVSA-N 1 2 321.770 4.216 20 0 DIADLO CC(C)[C@H]1C[N@@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)CCO1 ZINC001143812774 1050373151 /nfs/dbraw/zinc/37/31/51/1050373151.db2.gz ZCDKOWQFAXFQOY-CQSZACIVSA-N 1 2 321.770 4.216 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC001143860664 1050377512 /nfs/dbraw/zinc/37/75/12/1050377512.db2.gz RCAFRVXSZMLSMS-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC001143860664 1050377517 /nfs/dbraw/zinc/37/75/17/1050377517.db2.gz RCAFRVXSZMLSMS-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO CSc1cc(Nc2cc(O)cc(C(F)(F)F)c2)cc[nH+]1 ZINC001210824696 1050380364 /nfs/dbraw/zinc/38/03/64/1050380364.db2.gz WIQUXQKMJOVJFC-UHFFFAOYSA-N 1 2 300.305 4.272 20 0 DIADLO Clc1cc([NH2+]C[C@@H]2CCSC2)ccc1N1CCCCC1 ZINC000785491645 1050381174 /nfs/dbraw/zinc/38/11/74/1050381174.db2.gz RTLYLWLJJFUVRB-ZDUSSCGKSA-N 1 2 310.894 4.495 20 0 DIADLO CN(Cc1ccccc1)c1ccc([NH2+]C[C@H]2CCSC2)cc1 ZINC000785491521 1050381708 /nfs/dbraw/zinc/38/17/08/1050381708.db2.gz ONAMTQRTQOFIEW-QGZVFWFLSA-N 1 2 312.482 4.488 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC001143854979 1050386128 /nfs/dbraw/zinc/38/61/28/1050386128.db2.gz PAPVSJYRIQYKRX-OAHLLOKOSA-N 1 2 318.219 4.135 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC001143854979 1050386139 /nfs/dbraw/zinc/38/61/39/1050386139.db2.gz PAPVSJYRIQYKRX-OAHLLOKOSA-N 1 2 318.219 4.135 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2c(F)ccc(Cl)c2Cl)[C@H](C)C1 ZINC001143867376 1050388471 /nfs/dbraw/zinc/38/84/71/1050388471.db2.gz AEPDPVNHUSVBDT-NXEZZACHSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2c(F)ccc(Cl)c2Cl)[C@H](C)C1 ZINC001143867376 1050388484 /nfs/dbraw/zinc/38/84/84/1050388484.db2.gz AEPDPVNHUSVBDT-NXEZZACHSA-N 1 2 306.208 4.132 20 0 DIADLO CCC[C@H]([NH2+]Cc1nnc(-c2ccccc2)[nH]1)c1ccsc1 ZINC000785564731 1050392849 /nfs/dbraw/zinc/39/28/49/1050392849.db2.gz BKMPYEAXYPEPAU-HNNXBMFYSA-N 1 2 312.442 4.164 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c(F)c1F ZINC001143911257 1050403145 /nfs/dbraw/zinc/40/31/45/1050403145.db2.gz XJPGSPBQQYDPPK-OAHLLOKOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c(F)c1F ZINC001143911257 1050403148 /nfs/dbraw/zinc/40/31/48/1050403148.db2.gz XJPGSPBQQYDPPK-OAHLLOKOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c(F)c1F ZINC001143910806 1050404410 /nfs/dbraw/zinc/40/44/10/1050404410.db2.gz MZGDCRGNWRBFBG-OAHLLOKOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2F)c(F)c1F ZINC001143910806 1050404413 /nfs/dbraw/zinc/40/44/13/1050404413.db2.gz MZGDCRGNWRBFBG-OAHLLOKOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+](C)[C@H](C)c2ccccc2OC)c(F)c1F ZINC001143914721 1050404492 /nfs/dbraw/zinc/40/44/92/1050404492.db2.gz DZASSGSJMNSTCG-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2OC)c(F)c1F ZINC001143914721 1050404497 /nfs/dbraw/zinc/40/44/97/1050404497.db2.gz DZASSGSJMNSTCG-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO CCc1[nH]nc2ncc(Nc3ccc4c(C)cc[nH+]c4c3)cc21 ZINC001210885187 1050405547 /nfs/dbraw/zinc/40/55/47/1050405547.db2.gz LKSJILBRLOAIDX-UHFFFAOYSA-N 1 2 303.369 4.121 20 0 DIADLO CC[C@@H]1CCC[C@@]1(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001143939847 1050411083 /nfs/dbraw/zinc/41/10/83/1050411083.db2.gz PDJTZBLKYJEBSU-DNVCBOLYSA-N 1 2 311.429 4.336 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)c(C)s1 ZINC001143933740 1050414080 /nfs/dbraw/zinc/41/40/80/1050414080.db2.gz NYRGQZXCRVRSAQ-UHFFFAOYSA-N 1 2 311.410 4.111 20 0 DIADLO Oc1c(Cl)cc(Nc2cc[nH+]cc2C(F)(F)F)cc1Cl ZINC001210922841 1050414214 /nfs/dbraw/zinc/41/42/14/1050414214.db2.gz FIGZYRLOMKSBNK-UHFFFAOYSA-N 1 2 323.101 4.278 20 0 DIADLO CCOc1ccc(F)c(C[NH+]2CCC(C(F)(F)F)CC2)c1F ZINC001143930646 1050415613 /nfs/dbraw/zinc/41/56/13/1050415613.db2.gz LEDSUQYSDHLRAW-UHFFFAOYSA-N 1 2 323.305 4.138 20 0 DIADLO COc1ccc(F)c(C[N@H+](C)Cc2ccc(C)c(C)c2)c1F ZINC001143984306 1050418437 /nfs/dbraw/zinc/41/84/37/1050418437.db2.gz SKACJQCDRHMLHS-UHFFFAOYSA-N 1 2 305.368 4.222 20 0 DIADLO COc1ccc(F)c(C[N@@H+](C)Cc2ccc(C)c(C)c2)c1F ZINC001143984306 1050418445 /nfs/dbraw/zinc/41/84/45/1050418445.db2.gz SKACJQCDRHMLHS-UHFFFAOYSA-N 1 2 305.368 4.222 20 0 DIADLO O=C1CCCc2ccc(Nc3ccc[nH+]c3N3CCCCC3)cc21 ZINC001210932182 1050420180 /nfs/dbraw/zinc/42/01/80/1050420180.db2.gz RJQWPZBYPCDDLA-UHFFFAOYSA-N 1 2 321.424 4.335 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2cccnc2Cl)[C@@H]1c1ccccc1 ZINC000735674595 1050422069 /nfs/dbraw/zinc/42/20/69/1050422069.db2.gz RROIGRWFRRUKDS-CJNGLKHVSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2cccnc2Cl)[C@@H]1c1ccccc1 ZINC000735674595 1050422078 /nfs/dbraw/zinc/42/20/78/1050422078.db2.gz RROIGRWFRRUKDS-CJNGLKHVSA-N 1 2 318.873 4.414 20 0 DIADLO FC1(F)C[C@]12CCC[N@H+](Cc1nc(Cl)ccc1Cl)C2 ZINC000844438028 1050423693 /nfs/dbraw/zinc/42/36/93/1050423693.db2.gz AVWUQLLVGXTADV-LBPRGKRZSA-N 1 2 307.171 4.010 20 0 DIADLO FC1(F)C[C@]12CCC[N@@H+](Cc1nc(Cl)ccc1Cl)C2 ZINC000844438028 1050423697 /nfs/dbraw/zinc/42/36/97/1050423697.db2.gz AVWUQLLVGXTADV-LBPRGKRZSA-N 1 2 307.171 4.010 20 0 DIADLO O=C1CCCc2ccc(Nc3ccccc3-n3cc[nH+]c3)cc21 ZINC001210933950 1050424172 /nfs/dbraw/zinc/42/41/72/1050424172.db2.gz RWJWGKLJGQXQJP-UHFFFAOYSA-N 1 2 303.365 4.135 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2ccc(Cl)nc2)[C@@H]1c1ccccc1 ZINC000735742815 1050425149 /nfs/dbraw/zinc/42/51/49/1050425149.db2.gz ATXJSZZXRBPAKQ-DYVFJYSZSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2ccc(Cl)nc2)[C@@H]1c1ccccc1 ZINC000735742815 1050425153 /nfs/dbraw/zinc/42/51/53/1050425153.db2.gz ATXJSZZXRBPAKQ-DYVFJYSZSA-N 1 2 318.873 4.414 20 0 DIADLO Cc1cn2cccc(Nc3ccccc3N3CCCCC3)c2[nH+]1 ZINC001210960480 1050433120 /nfs/dbraw/zinc/43/31/20/1050433120.db2.gz BFZBCDKORYILPP-UHFFFAOYSA-N 1 2 306.413 4.377 20 0 DIADLO CC(C)[C@H](OC(=O)C[C@H](C)n1cc[nH+]c1)c1ccc(F)c(F)c1 ZINC000844465399 1050434419 /nfs/dbraw/zinc/43/44/19/1050434419.db2.gz YWPJTUOXKOQVDU-SJCJKPOMSA-N 1 2 322.355 4.053 20 0 DIADLO Nc1ccc(F)c2ccn(-c3ccccc3[NH+]3CCCCC3)c21 ZINC001210963380 1050435190 /nfs/dbraw/zinc/43/51/90/1050435190.db2.gz JKSZRFNXZJREFS-UHFFFAOYSA-N 1 2 309.388 4.342 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccccc3N3CCCCC3)ccc21 ZINC001210964176 1050436357 /nfs/dbraw/zinc/43/63/57/1050436357.db2.gz MULOOAXGKXLJFG-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO C=C(Nc1ccc2[nH+]cc(Br)n2c1)c1ccccc1 ZINC001210981825 1050438166 /nfs/dbraw/zinc/43/81/66/1050438166.db2.gz APFYNXCYJLUTGG-UHFFFAOYSA-N 1 2 314.186 4.180 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2CCC[C@@H]2c2ccncc2)cc1F ZINC001144028307 1050444535 /nfs/dbraw/zinc/44/45/35/1050444535.db2.gz ZNXCNAGKIOYRJS-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2CCC[C@@H]2c2ccncc2)cc1F ZINC001144028307 1050444538 /nfs/dbraw/zinc/44/45/38/1050444538.db2.gz ZNXCNAGKIOYRJS-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1ccc(Nc2ccc(OCC3CCOCC3)c(F)c2)[nH+]c1 ZINC001211013078 1050447259 /nfs/dbraw/zinc/44/72/59/1050447259.db2.gz QGAABCDNUDDULB-UHFFFAOYSA-N 1 2 316.376 4.078 20 0 DIADLO CCN(C)c1ccc(Nc2cncc(-c3ccccc3)c2)c[nH+]1 ZINC001211021902 1050448389 /nfs/dbraw/zinc/44/83/89/1050448389.db2.gz LYADTAPRHRAZED-UHFFFAOYSA-N 1 2 304.397 4.343 20 0 DIADLO CN(c1ccc(Nc2ccnnc2Cl)c[nH+]1)C1CCCCC1 ZINC001212613160 1050448761 /nfs/dbraw/zinc/44/87/61/1050448761.db2.gz GMBCUJKWIAIIJZ-UHFFFAOYSA-N 1 2 317.824 4.038 20 0 DIADLO Cc1ccc(Oc2cccc(C[N@@H+]3C[C@H]4CC[C@@H]3CO4)c2)cc1 ZINC001144090669 1050459220 /nfs/dbraw/zinc/45/92/20/1050459220.db2.gz NNOQKKUHGLUEDI-YLJYHZDGSA-N 1 2 309.409 4.151 20 0 DIADLO Cc1ccc(Oc2cccc(C[N@H+]3C[C@H]4CC[C@@H]3CO4)c2)cc1 ZINC001144090669 1050459231 /nfs/dbraw/zinc/45/92/31/1050459231.db2.gz NNOQKKUHGLUEDI-YLJYHZDGSA-N 1 2 309.409 4.151 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CC[C@@H](F)C(F)(F)CC2)cc1Cl ZINC001144120087 1050470668 /nfs/dbraw/zinc/47/06/68/1050470668.db2.gz CNMIADAGFSJYLS-GFCCVEGCSA-N 1 2 313.697 4.187 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)cc1Cl ZINC001144120087 1050470670 /nfs/dbraw/zinc/47/06/70/1050470670.db2.gz CNMIADAGFSJYLS-GFCCVEGCSA-N 1 2 313.697 4.187 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(Cl)c(F)cc2F)CCC1(F)F ZINC001144125481 1050475038 /nfs/dbraw/zinc/47/50/38/1050475038.db2.gz KHULFWPXMMPVBK-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2F)CCC1(F)F ZINC001144125481 1050475046 /nfs/dbraw/zinc/47/50/46/1050475046.db2.gz KHULFWPXMMPVBK-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)cc1Cl ZINC001144130101 1050479257 /nfs/dbraw/zinc/47/92/57/1050479257.db2.gz XGTSLEXDPIXMOD-AWEZNQCLSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CC[C@H](Oc3ccccc3)C2)cc1Cl ZINC001144130101 1050479264 /nfs/dbraw/zinc/47/92/64/1050479264.db2.gz XGTSLEXDPIXMOD-AWEZNQCLSA-N 1 2 323.770 4.272 20 0 DIADLO CSc1cc(Nc2cc(O)cc(OC(F)(F)F)c2)cc[nH+]1 ZINC001211124608 1050488174 /nfs/dbraw/zinc/48/81/74/1050488174.db2.gz RWZZUYMWQMKGBO-UHFFFAOYSA-N 1 2 316.304 4.151 20 0 DIADLO Fc1ccc2[nH]nc(C[N@@H+]3CCC[C@@H]3c3cccs3)c2c1 ZINC001144197841 1050489713 /nfs/dbraw/zinc/48/97/13/1050489713.db2.gz ZYFOVXWCIVNVJK-OAHLLOKOSA-N 1 2 301.390 4.101 20 0 DIADLO Fc1ccc2[nH]nc(C[N@H+]3CCC[C@@H]3c3cccs3)c2c1 ZINC001144197841 1050489718 /nfs/dbraw/zinc/48/97/18/1050489718.db2.gz ZYFOVXWCIVNVJK-OAHLLOKOSA-N 1 2 301.390 4.101 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1occc1Br ZINC000226628264 1050499219 /nfs/dbraw/zinc/49/92/19/1050499219.db2.gz UKHQSRJXGFRLDZ-UHFFFAOYSA-N 1 2 309.207 4.029 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)o1 ZINC000761057349 1050500525 /nfs/dbraw/zinc/50/05/25/1050500525.db2.gz QBYGQLQSNJLEJO-GFCCVEGCSA-N 1 2 310.319 4.034 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)o1 ZINC000761057349 1050500538 /nfs/dbraw/zinc/50/05/38/1050500538.db2.gz QBYGQLQSNJLEJO-GFCCVEGCSA-N 1 2 310.319 4.034 20 0 DIADLO CC(C)c1cc(NCc2cnc(Cl)s2)nc(C(C)C)[nH+]1 ZINC000786552241 1050501226 /nfs/dbraw/zinc/50/12/26/1050501226.db2.gz UUDUOLCHXHSOIA-UHFFFAOYSA-N 1 2 310.854 4.445 20 0 DIADLO CCc1nocc1COc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000574650942 1050501479 /nfs/dbraw/zinc/50/14/79/1050501479.db2.gz LPDOQTZDWNXORQ-UHFFFAOYSA-N 1 2 323.396 4.016 20 0 DIADLO OCCc1ccc[nH+]c1Nc1ccc(-c2ccc(F)cc2)cc1 ZINC001211197149 1050513245 /nfs/dbraw/zinc/51/32/45/1050513245.db2.gz OLCFAUWEQIQZLD-UHFFFAOYSA-N 1 2 308.356 4.166 20 0 DIADLO CCSc1nn(C[N@@H+]2CCC[C@H](CC)CC2)c(=S)s1 ZINC000738256184 1050528330 /nfs/dbraw/zinc/52/83/30/1050528330.db2.gz QOBWDDNYPXWBMH-NSHDSACASA-N 1 2 317.549 4.256 20 0 DIADLO CCSc1nn(C[N@H+]2CCC[C@H](CC)CC2)c(=S)s1 ZINC000738256184 1050528337 /nfs/dbraw/zinc/52/83/37/1050528337.db2.gz QOBWDDNYPXWBMH-NSHDSACASA-N 1 2 317.549 4.256 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCCc4sccc4C3)cs2)co1 ZINC000594737363 1050548786 /nfs/dbraw/zinc/54/87/86/1050548786.db2.gz PNHOOKZMYQUPCL-UHFFFAOYSA-N 1 2 316.451 4.413 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCCc4sccc4C3)cs2)co1 ZINC000594737363 1050548799 /nfs/dbraw/zinc/54/87/99/1050548799.db2.gz PNHOOKZMYQUPCL-UHFFFAOYSA-N 1 2 316.451 4.413 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC000787059239 1050551998 /nfs/dbraw/zinc/55/19/98/1050551998.db2.gz XUQXDAOSRLCTPA-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1nc(F)ccc1C[N@H+](C)Cc1ccc(Cl)cc1Cl ZINC000787059239 1050552010 /nfs/dbraw/zinc/55/20/10/1050552010.db2.gz XUQXDAOSRLCTPA-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Oc1ccc(C[N@@H+]2CCc3sccc3C2)c(C(F)(F)F)c1 ZINC001144386385 1050556758 /nfs/dbraw/zinc/55/67/58/1050556758.db2.gz CGAOLJMUPUCISH-UHFFFAOYSA-N 1 2 313.344 4.031 20 0 DIADLO Oc1ccc(C[N@H+]2CCc3sccc3C2)c(C(F)(F)F)c1 ZINC001144386385 1050556767 /nfs/dbraw/zinc/55/67/67/1050556767.db2.gz CGAOLJMUPUCISH-UHFFFAOYSA-N 1 2 313.344 4.031 20 0 DIADLO c1cn(-c2ccc(NCc3cncc4ccccc43)cc2)c[nH+]1 ZINC000772920161 1050559234 /nfs/dbraw/zinc/55/92/34/1050559234.db2.gz XYIOGTJLSINULZ-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO COC(=O)Cc1ccccc1Nc1ccc2c(C)cc[nH+]c2c1 ZINC001213061072 1050573721 /nfs/dbraw/zinc/57/37/21/1050573721.db2.gz KYNJFIQDSSUENK-UHFFFAOYSA-N 1 2 306.365 4.002 20 0 DIADLO CN1CCCc2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc21 ZINC001213088846 1050582378 /nfs/dbraw/zinc/58/23/78/1050582378.db2.gz HESIOHTUSMMZNC-UHFFFAOYSA-N 1 2 304.397 4.203 20 0 DIADLO C[C@@H](CC(=O)O[C@@H](c1ccccc1)C1CCCC1)n1cc[nH+]c1 ZINC000845465865 1050584838 /nfs/dbraw/zinc/58/48/38/1050584838.db2.gz PVQGTYBBIYCOSL-KXBFYZLASA-N 1 2 312.413 4.309 20 0 DIADLO COc1cc(O)ccc1Nc1cc[nH+]c2cc(Cl)ccc12 ZINC001213094950 1050586081 /nfs/dbraw/zinc/58/60/81/1050586081.db2.gz QQKZGIUAOBFKDD-UHFFFAOYSA-N 1 2 300.745 4.346 20 0 DIADLO CCC(=O)Nc1cccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213088963 1050586444 /nfs/dbraw/zinc/58/64/44/1050586444.db2.gz MRECHNVKBBNBFS-UHFFFAOYSA-N 1 2 306.369 4.169 20 0 DIADLO COc1c(F)ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1F ZINC001213090187 1050586579 /nfs/dbraw/zinc/58/65/79/1050586579.db2.gz YNEYUJXEMIDLSY-UHFFFAOYSA-N 1 2 301.296 4.107 20 0 DIADLO CC1(C)C(=O)Nc2cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)ccc21 ZINC001213090190 1050586749 /nfs/dbraw/zinc/58/67/49/1050586749.db2.gz YRMYMMSUQULYLO-UHFFFAOYSA-N 1 2 318.380 4.050 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3cccc(-c4cnco4)c3)cc2)[nH]1 ZINC001213088960 1050587021 /nfs/dbraw/zinc/58/70/21/1050587021.db2.gz MQALOGGCHQRGIZ-UHFFFAOYSA-N 1 2 302.337 4.475 20 0 DIADLO c1c[nH]c(-c2ccc(Nc3cccc(Cn4cc[nH+]c4)c3)cc2)n1 ZINC001213088983 1050587066 /nfs/dbraw/zinc/58/70/66/1050587066.db2.gz NQFGTZAAUCVFGO-UHFFFAOYSA-N 1 2 315.380 4.065 20 0 DIADLO Cc1ncnc(C)c1Nc1ccc(N(C)C2CCCCC2)[nH+]c1 ZINC001212614435 1050593428 /nfs/dbraw/zinc/59/34/28/1050593428.db2.gz NICRKOREMJYOJD-UHFFFAOYSA-N 1 2 311.433 4.001 20 0 DIADLO COc1ncc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)cc1F ZINC001144472913 1050596042 /nfs/dbraw/zinc/59/60/42/1050596042.db2.gz HRCOWAAROXIRTG-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1ncc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)cc1F ZINC001144472913 1050596049 /nfs/dbraw/zinc/59/60/49/1050596049.db2.gz HRCOWAAROXIRTG-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO Cc1ncc(Nc2ccc(N(C)C3CCCCC3)[nH+]c2)s1 ZINC001212614677 1050596384 /nfs/dbraw/zinc/59/63/84/1050596384.db2.gz UNKZCCGQBHLNJJ-UHFFFAOYSA-N 1 2 302.447 4.359 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+]2CCc3ccc(F)cc3C2)c1 ZINC001144488946 1050598665 /nfs/dbraw/zinc/59/86/65/1050598665.db2.gz ZZCUVPYFKABEOI-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(Cl)cc(C[N@H+]2CCc3ccc(F)cc3C2)c1 ZINC001144488946 1050598674 /nfs/dbraw/zinc/59/86/74/1050598674.db2.gz ZZCUVPYFKABEOI-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2ncc(CC)o2)o1 ZINC000574855109 1050605795 /nfs/dbraw/zinc/60/57/95/1050605795.db2.gz MVICWTORTACXLU-XJKSGUPXSA-N 1 2 302.418 4.366 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2ncc(CC)o2)o1 ZINC000574855109 1050605799 /nfs/dbraw/zinc/60/57/99/1050605799.db2.gz MVICWTORTACXLU-XJKSGUPXSA-N 1 2 302.418 4.366 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cccnc1C(F)(F)F ZINC001144538574 1050609969 /nfs/dbraw/zinc/60/99/69/1050609969.db2.gz OHTMHEDGYSWWLO-GFCCVEGCSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cccnc1C(F)(F)F ZINC001144538574 1050609974 /nfs/dbraw/zinc/60/99/74/1050609974.db2.gz OHTMHEDGYSWWLO-GFCCVEGCSA-N 1 2 306.331 4.047 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2c(F)cc(O)cc2F)c1 ZINC001144542401 1050610452 /nfs/dbraw/zinc/61/04/52/1050610452.db2.gz WIZNSMJINDPNNG-SFHVURJKSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2c(F)cc(O)cc2F)c1 ZINC001144542401 1050610455 /nfs/dbraw/zinc/61/04/55/1050610455.db2.gz WIZNSMJINDPNNG-SFHVURJKSA-N 1 2 303.352 4.316 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@H+]1Cc1cccc2cccnc21 ZINC000787648291 1050611013 /nfs/dbraw/zinc/61/10/13/1050611013.db2.gz BFDQPMKALLXCPK-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@@H+]1Cc1cccc2cccnc21 ZINC000787648291 1050611033 /nfs/dbraw/zinc/61/10/33/1050611033.db2.gz BFDQPMKALLXCPK-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO Cc1cc(C[NH+]2CCC(C)(F)CC2)c(F)cc1Br ZINC001144583799 1050623504 /nfs/dbraw/zinc/62/35/04/1050623504.db2.gz MSBQGEOBAPVDSZ-UHFFFAOYSA-N 1 2 318.205 4.221 20 0 DIADLO CC(C)N(C(=O)C[C@@H](C)n1cc[nH+]c1)c1ccc(F)cc1Cl ZINC000575050058 1050628900 /nfs/dbraw/zinc/62/89/00/1050628900.db2.gz YSLDGWDIWWXWAX-GFCCVEGCSA-N 1 2 323.799 4.068 20 0 DIADLO CC(C)c1cc(N2CC[C@@H](c3cccnc3)C2)nc(C(C)C)[nH+]1 ZINC000575056180 1050629318 /nfs/dbraw/zinc/62/93/18/1050629318.db2.gz WCVIJUNFHRMGKY-MRXNPFEDSA-N 1 2 310.445 4.112 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cc1F ZINC001144647169 1050639095 /nfs/dbraw/zinc/63/90/95/1050639095.db2.gz BFSSJJXBKYPSDR-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cc1F ZINC001144647169 1050639106 /nfs/dbraw/zinc/63/91/06/1050639106.db2.gz BFSSJJXBKYPSDR-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO CC(C)C[N@H+](Cc1noc2c1CCCC2)Cc1ccccc1F ZINC000595557680 1050641740 /nfs/dbraw/zinc/64/17/40/1050641740.db2.gz IDEOEYCHRIPXCS-UHFFFAOYSA-N 1 2 316.420 4.351 20 0 DIADLO CC(C)C[N@@H+](Cc1noc2c1CCCC2)Cc1ccccc1F ZINC000595557680 1050641746 /nfs/dbraw/zinc/64/17/46/1050641746.db2.gz IDEOEYCHRIPXCS-UHFFFAOYSA-N 1 2 316.420 4.351 20 0 DIADLO CN(C)c1cccc(C[N@H+](C)Cc2ccc(Cl)nc2Cl)c1 ZINC000788022142 1050645249 /nfs/dbraw/zinc/64/52/49/1050645249.db2.gz YLAXOMNQOXHXLI-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1cccc(C[N@@H+](C)Cc2ccc(Cl)nc2Cl)c1 ZINC000788022142 1050645254 /nfs/dbraw/zinc/64/52/54/1050645254.db2.gz YLAXOMNQOXHXLI-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO C[N@H+](Cc1ccc2ccccc2c1)Cc1cc(F)c(O)cc1F ZINC001144659920 1050649014 /nfs/dbraw/zinc/64/90/14/1050649014.db2.gz QYMSBXOVTSADNV-UHFFFAOYSA-N 1 2 313.347 4.456 20 0 DIADLO C[N@@H+](Cc1ccc2ccccc2c1)Cc1cc(F)c(O)cc1F ZINC001144659920 1050649019 /nfs/dbraw/zinc/64/90/19/1050649019.db2.gz QYMSBXOVTSADNV-UHFFFAOYSA-N 1 2 313.347 4.456 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cc(F)c(OC(C)C)c(F)c1 ZINC001213420482 1050651216 /nfs/dbraw/zinc/65/12/16/1050651216.db2.gz ZISGMUYVQMFHTG-UHFFFAOYSA-N 1 2 308.328 4.289 20 0 DIADLO CC(C)Oc1c(F)cc(Nc2ccc3c(c2)[nH+]cn3C)cc1F ZINC001213423642 1050652978 /nfs/dbraw/zinc/65/29/78/1050652978.db2.gz JZFFLARCDIPFKD-UHFFFAOYSA-N 1 2 317.339 4.382 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1occc1Br ZINC000227364759 1050660644 /nfs/dbraw/zinc/66/06/44/1050660644.db2.gz XIVHPSCAIDOPSJ-NSHDSACASA-N 1 2 324.218 4.210 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1NC1CCC2(CCCO2)CC1 ZINC000788250971 1050660917 /nfs/dbraw/zinc/66/09/17/1050660917.db2.gz FEQHYDQUDNHTPN-UHFFFAOYSA-N 1 2 300.446 4.191 20 0 DIADLO c1cc(N2CCCC2)ccc1[NH2+]C1CCC2(CCCO2)CC1 ZINC000788250971 1050660928 /nfs/dbraw/zinc/66/09/28/1050660928.db2.gz FEQHYDQUDNHTPN-UHFFFAOYSA-N 1 2 300.446 4.191 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1noc2c1CCCC2 ZINC000179744570 1050669424 /nfs/dbraw/zinc/66/94/24/1050669424.db2.gz JZFFJXDZRVMGKB-MRXNPFEDSA-N 1 2 314.429 4.193 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ncc(Br)cc1F ZINC001213492174 1050669481 /nfs/dbraw/zinc/66/94/81/1050669481.db2.gz YPEUCEFRVAANAW-UHFFFAOYSA-N 1 2 322.181 4.308 20 0 DIADLO Cc1nc(Br)ccc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213492195 1050670331 /nfs/dbraw/zinc/67/03/31/1050670331.db2.gz ZLMJIGSPRHTBGJ-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnc(Br)s1 ZINC001213497304 1050671594 /nfs/dbraw/zinc/67/15/94/1050671594.db2.gz MZPZIPVVJKTRTL-UHFFFAOYSA-N 1 2 310.220 4.230 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2c(c1)OC(C)(C)C(=O)N2 ZINC001213499458 1050672053 /nfs/dbraw/zinc/67/20/53/1050672053.db2.gz KFXXULZLFUGEBV-UHFFFAOYSA-N 1 2 323.396 4.121 20 0 DIADLO COc1ccc(Br)cc1Nc1c[nH+]c(C)cc1C ZINC001213513542 1050676419 /nfs/dbraw/zinc/67/64/19/1050676419.db2.gz UHTYCAFUAQTECY-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1cc(C)c(Nc2ncc(Br)cc2Cl)c[nH+]1 ZINC001213503486 1050673876 /nfs/dbraw/zinc/67/38/76/1050673876.db2.gz JDLYXQLCYLIHPZ-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO CCN(CC)C(=O)c1ccccc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213503557 1050674539 /nfs/dbraw/zinc/67/45/39/1050674539.db2.gz MIIMWXKSMQUXMS-UHFFFAOYSA-N 1 2 323.440 4.493 20 0 DIADLO Cc1cc(C)c(Nc2cc(-c3ccc(F)c(F)c3)no2)c[nH+]1 ZINC001213503622 1050674921 /nfs/dbraw/zinc/67/49/21/1050674921.db2.gz PCJBABDTXPELMD-UHFFFAOYSA-N 1 2 301.296 4.375 20 0 DIADLO CC(=O)c1c(F)cc(F)cc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213501203 1050675023 /nfs/dbraw/zinc/67/50/23/1050675023.db2.gz MJYJDQLNAYFJQN-UHFFFAOYSA-N 1 2 302.324 4.492 20 0 DIADLO Cc1ccc2c(c1C)[N@@H+](C[Si](C)(C)c1ccccc1)CCC2 ZINC001171216661 1050676025 /nfs/dbraw/zinc/67/60/25/1050676025.db2.gz HXUOBIJFWXXQMZ-UHFFFAOYSA-N 1 2 309.529 4.211 20 0 DIADLO Cc1ccc2c(c1C)[N@H+](C[Si](C)(C)c1ccccc1)CCC2 ZINC001171216661 1050676029 /nfs/dbraw/zinc/67/60/29/1050676029.db2.gz HXUOBIJFWXXQMZ-UHFFFAOYSA-N 1 2 309.529 4.211 20 0 DIADLO Cc1cc(C)c(Nc2nc(F)cc(C(F)(F)F)c2F)c[nH+]1 ZINC001213506004 1050676435 /nfs/dbraw/zinc/67/64/35/1050676435.db2.gz YBLXMODQANRBRJ-UHFFFAOYSA-N 1 2 303.234 4.134 20 0 DIADLO COc1cccc(Cn2ncc(C)c2Nc2c[nH+]c(C)cc2C)c1 ZINC001213511086 1050676629 /nfs/dbraw/zinc/67/66/29/1050676629.db2.gz VPFLZTOTUQVRBI-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO c1cc2cc(NCC[C@@H]3CCc4ccc5c(c43)CCO5)[nH+]cc2[nH]1 ZINC001170084726 1050678689 /nfs/dbraw/zinc/67/86/89/1050678689.db2.gz PVPRFDKSYZTZOJ-AWEZNQCLSA-N 1 2 319.408 4.030 20 0 DIADLO Cc1c[nH+]cc(Nc2ccnc(Cl)c2OC(F)(F)F)c1C ZINC001213527613 1050679281 /nfs/dbraw/zinc/67/92/81/1050679281.db2.gz VTTPDDHRKVXWAH-UHFFFAOYSA-N 1 2 317.698 4.389 20 0 DIADLO Cc1c[nH+]cc(Nc2ncccc2OCc2ccccc2)c1C ZINC001213520722 1050679985 /nfs/dbraw/zinc/67/99/85/1050679985.db2.gz GLUKKDUQNRDKRK-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO Cc1cc(Nc2c[nH+]cc(C)c2C)n(Cc2cccc(F)c2)n1 ZINC001213527603 1050680588 /nfs/dbraw/zinc/68/05/88/1050680588.db2.gz VHHYOQMDOUQYNM-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO CCOC(=O)CCc1ccc(Nc2c[nH+]cc(C)c2C)cc1F ZINC001213537215 1050681875 /nfs/dbraw/zinc/68/18/75/1050681875.db2.gz XFIIUPSVTRCXPH-UHFFFAOYSA-N 1 2 316.376 4.077 20 0 DIADLO Cc1c[nH+]cc(Nc2c(N)ccc(Br)c2C)c1C ZINC001213530687 1050682023 /nfs/dbraw/zinc/68/20/23/1050682023.db2.gz LHHVTHCPFSUEBW-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO Cc1c[nH+]cc(Nc2cc(Br)c(C)cc2O)c1C ZINC001213532548 1050682222 /nfs/dbraw/zinc/68/22/22/1050682222.db2.gz NQLRIZGJFSEJMA-UHFFFAOYSA-N 1 2 307.191 4.219 20 0 DIADLO Cc1c[nH+]cc(Nc2cccc(F)c2OC[C@H]2CCCO2)c1C ZINC001213534222 1050682863 /nfs/dbraw/zinc/68/28/63/1050682863.db2.gz RZSLGXALFIJVIZ-CQSZACIVSA-N 1 2 316.376 4.139 20 0 DIADLO COc1ccc2nc(/C=C\c3c[nH+]c4c(C)cccn34)sc2c1 ZINC000741472174 1050684411 /nfs/dbraw/zinc/68/44/11/1050684411.db2.gz TVXKFXXFJUUJHN-YVMONPNESA-N 1 2 321.405 4.431 20 0 DIADLO C[C@H]([NH2+]CCN1CCC[C@H]1C)c1cc(Cl)sc1Cl ZINC000766271934 1050688150 /nfs/dbraw/zinc/68/81/50/1050688150.db2.gz HIFOQNFPVCGTOE-ZJUUUORDSA-N 1 2 307.290 4.190 20 0 DIADLO c1cn(Cc2ccc(Nc3ccccc3N3CCCC3)cc2)c[nH+]1 ZINC001213608012 1050695265 /nfs/dbraw/zinc/69/52/65/1050695265.db2.gz LFUJHZZSZIKBJS-UHFFFAOYSA-N 1 2 318.424 4.275 20 0 DIADLO c1csc([C@H]2CCC[N@H+]2Cc2ccc3scnc3c2)n1 ZINC001144743285 1050700159 /nfs/dbraw/zinc/70/01/59/1050700159.db2.gz IBOQFWAIDNGKEJ-CYBMUJFWSA-N 1 2 301.440 4.090 20 0 DIADLO c1csc([C@H]2CCC[N@@H+]2Cc2ccc3scnc3c2)n1 ZINC001144743285 1050700170 /nfs/dbraw/zinc/70/01/70/1050700170.db2.gz IBOQFWAIDNGKEJ-CYBMUJFWSA-N 1 2 301.440 4.090 20 0 DIADLO CC/C(=C\C(=O)Nc1ccc2[nH+]ccn2c1)c1ccc(C)cc1 ZINC000741563896 1050703774 /nfs/dbraw/zinc/70/37/74/1050703774.db2.gz WKIMQNPCYTVSFA-NTCAYCPXSA-N 1 2 305.381 4.075 20 0 DIADLO CCC1(O)CC[NH+](Cc2cc(Cl)cc(Cl)c2Cl)CC1 ZINC001231605450 1050704626 /nfs/dbraw/zinc/70/46/26/1050704626.db2.gz ZWLXTJJKBRIHCV-UHFFFAOYSA-N 1 2 322.663 4.384 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H]1COCc2cccc(Cl)c21 ZINC000788687298 1050725802 /nfs/dbraw/zinc/72/58/02/1050725802.db2.gz ANGGKRJBSOJHBX-KRWDZBQOSA-N 1 2 316.832 4.398 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@@H+]1CC[C@@H](CC(C)(C)C)C1 ZINC001171229969 1050727986 /nfs/dbraw/zinc/72/79/86/1050727986.db2.gz LPLKZTXJICOTDK-XJKSGUPXSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@H+]1CC[C@@H](CC(C)(C)C)C1 ZINC001171229969 1050727998 /nfs/dbraw/zinc/72/79/98/1050727998.db2.gz LPLKZTXJICOTDK-XJKSGUPXSA-N 1 2 323.864 4.312 20 0 DIADLO Cc1nn(C)c2cc(Nc3cc[nH+]c4ccc(Cl)cc34)ccc12 ZINC001213753008 1050727948 /nfs/dbraw/zinc/72/79/48/1050727948.db2.gz RKWWZHXUPZHQFC-UHFFFAOYSA-N 1 2 322.799 4.249 20 0 DIADLO Cc1c(CNc2ccc(C)[nH+]c2C)sc2nc(C)nc(C)c12 ZINC000772943465 1050734569 /nfs/dbraw/zinc/73/45/69/1050734569.db2.gz OFNCXNCSBGTTBA-UHFFFAOYSA-N 1 2 312.442 4.241 20 0 DIADLO Cc1c2ccccc2oc1[C@H]([NH2+]Cc1cnsn1)C(C)C ZINC000846844011 1050769447 /nfs/dbraw/zinc/76/94/47/1050769447.db2.gz JZDHBUDJFJCUTN-OAHLLOKOSA-N 1 2 301.415 4.080 20 0 DIADLO Cc1cc(N[C@@H]2CCCC[C@H]2[C@@H]2CCOC2)ccc1[NH+](C)C ZINC000788982903 1050770795 /nfs/dbraw/zinc/77/07/95/1050770795.db2.gz GESIKSXPSKYJNS-BPQIPLTHSA-N 1 2 302.462 4.068 20 0 DIADLO FC(F)(F)Cc1ccc(Nc2ccccc2-n2cc[nH+]c2)cn1 ZINC001213916506 1050779870 /nfs/dbraw/zinc/77/98/70/1050779870.db2.gz UXBHYANRFSVVGZ-UHFFFAOYSA-N 1 2 318.302 4.116 20 0 DIADLO COc1c2ccccc2oc1C[NH2+][C@@H](C)c1cccnc1Cl ZINC000788982674 1050780645 /nfs/dbraw/zinc/78/06/45/1050780645.db2.gz YDYABYYWMHQFKZ-NSHDSACASA-N 1 2 316.788 4.341 20 0 DIADLO CC(C)c1cc(NC[C@@H](O)c2cccc(F)c2)nc(C(C)C)[nH+]1 ZINC000761209693 1050789564 /nfs/dbraw/zinc/78/95/64/1050789564.db2.gz ACAVZRKHINPXNB-MRXNPFEDSA-N 1 2 317.408 4.008 20 0 DIADLO CC/C(=C/C(=O)Nc1cccc2[nH+]ccn21)c1ccc(C)cc1 ZINC000741970296 1050790383 /nfs/dbraw/zinc/79/03/83/1050790383.db2.gz YFQQWCJASRCNEV-SQFISAMPSA-N 1 2 305.381 4.075 20 0 DIADLO CCCCCC[C@@H](C)C(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC000742058185 1050796393 /nfs/dbraw/zinc/79/63/93/1050796393.db2.gz QXLWFBXWEFVQEF-CQSZACIVSA-N 1 2 320.477 4.272 20 0 DIADLO CCCCCC[C@H](C)C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000742056363 1050797639 /nfs/dbraw/zinc/79/76/39/1050797639.db2.gz SYRANTHGIUYJNH-HOTGVXAUSA-N 1 2 307.482 4.021 20 0 DIADLO CCCC1CCC([N@H+](C)Cn2nc(C3CC3)n(C)c2=S)CC1 ZINC000189905993 1050803594 /nfs/dbraw/zinc/80/35/94/1050803594.db2.gz MKLAWAIQYKVUQK-UHFFFAOYSA-N 1 2 322.522 4.077 20 0 DIADLO CCCC1CCC([N@@H+](C)Cn2nc(C3CC3)n(C)c2=S)CC1 ZINC000189905993 1050803607 /nfs/dbraw/zinc/80/36/07/1050803607.db2.gz MKLAWAIQYKVUQK-UHFFFAOYSA-N 1 2 322.522 4.077 20 0 DIADLO CCN(C)c1ccc(Nc2cc(Cl)c(OC)cc2F)c[nH+]1 ZINC001214062832 1050807534 /nfs/dbraw/zinc/80/75/34/1050807534.db2.gz NQIBGAGQBBVXJC-UHFFFAOYSA-N 1 2 309.772 4.082 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3c(F)cc(CO)cc3F)ccc12 ZINC001214098999 1050819309 /nfs/dbraw/zinc/81/93/09/1050819309.db2.gz KBMWJTUPDDKFJV-UHFFFAOYSA-N 1 2 300.308 4.057 20 0 DIADLO Cc1cnc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2)s1 ZINC000180411066 1050820455 /nfs/dbraw/zinc/82/04/55/1050820455.db2.gz VZPCOAQONBBBBU-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1cnc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)s1 ZINC000180411066 1050820465 /nfs/dbraw/zinc/82/04/65/1050820465.db2.gz VZPCOAQONBBBBU-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Fc1ccc2ccc(NCc3ccc(-n4cc[nH+]c4)cc3)nc2c1 ZINC000742397156 1050829654 /nfs/dbraw/zinc/82/96/54/1050829654.db2.gz MGPIDRRZKRHNHD-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO CSc1cc(NCc2ccccc2-c2cccnc2)nc(C)[nH+]1 ZINC001170108068 1050840912 /nfs/dbraw/zinc/84/09/12/1050840912.db2.gz LRYNMLXBFIEWOT-UHFFFAOYSA-N 1 2 322.437 4.181 20 0 DIADLO Cc1ccc(N2CCC[C@H](Nc3cc(C)[nH+]c(C4CC4)n3)C2)cc1 ZINC000742420543 1050843894 /nfs/dbraw/zinc/84/38/94/1050843894.db2.gz JMSJQTQDBBIMQF-KRWDZBQOSA-N 1 2 322.456 4.052 20 0 DIADLO Cc1cc(N[C@H]2COCc3ccccc32)[nH+]cc1C(F)(F)F ZINC001171291475 1050848312 /nfs/dbraw/zinc/84/83/12/1050848312.db2.gz ZWHNEEIHGGKBIT-AWEZNQCLSA-N 1 2 308.303 4.092 20 0 DIADLO FC1(c2ccccc2)CC[NH+](Cc2coc(C3CC3)n2)CC1 ZINC000789757091 1050880002 /nfs/dbraw/zinc/88/00/02/1050880002.db2.gz KYSWVNSMNUCILE-UHFFFAOYSA-N 1 2 300.377 4.013 20 0 DIADLO CCc1ccc(C)[nH+]c1Nc1ccc(OC(F)(F)F)cc1O ZINC001214386859 1050890321 /nfs/dbraw/zinc/89/03/21/1050890321.db2.gz OFGLBJLDEXMRHQ-UHFFFAOYSA-N 1 2 312.291 4.300 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)CCC(C)(F)F)c2)[nH+]c1C ZINC000746881117 1050913424 /nfs/dbraw/zinc/91/34/24/1050913424.db2.gz JPEYCOCOUJYEQA-UHFFFAOYSA-N 1 2 307.344 4.067 20 0 DIADLO Oc1c(F)cc(Nc2cc(Cl)c3[nH+]ccn3c2)cc1Cl ZINC001214485309 1050920013 /nfs/dbraw/zinc/92/00/13/1050920013.db2.gz ZHSVJLJWBWHVNM-UHFFFAOYSA-N 1 2 312.131 4.229 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000790154704 1050920526 /nfs/dbraw/zinc/92/05/26/1050920526.db2.gz JRAOOSZRPWFOQJ-FUHWJXTLSA-N 1 2 318.461 4.058 20 0 DIADLO C[C@H](C(=O)Nc1ccc2ccccc2c1)[NH+]1Cc2ccccc2C1 ZINC000772750676 1050936148 /nfs/dbraw/zinc/93/61/48/1050936148.db2.gz LSDICBPFAOJQMJ-OAHLLOKOSA-N 1 2 316.404 4.183 20 0 DIADLO Oc1ccc(Cl)c(Nc2ccccc2-n2cc[nH+]c2)c1F ZINC001214559059 1050941497 /nfs/dbraw/zinc/94/14/97/1050941497.db2.gz FSADROXSNMNFHO-UHFFFAOYSA-N 1 2 303.724 4.114 20 0 DIADLO Oc1ccc(Cl)c(Nc2cc(Cl)c3[nH+]ccn3c2)c1F ZINC001214558435 1050942419 /nfs/dbraw/zinc/94/24/19/1050942419.db2.gz UVPPFPDIVAKFFF-UHFFFAOYSA-N 1 2 312.131 4.229 20 0 DIADLO COC(=O)c1cccc(Nc2ccc3c(C)cc[nH+]c3c2)c1F ZINC001214583353 1050952094 /nfs/dbraw/zinc/95/20/94/1050952094.db2.gz ZVRZCTKKJIOMPF-UHFFFAOYSA-N 1 2 310.328 4.213 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3ncc(C(C)(C)C)s3)ccc21 ZINC000790471020 1050960297 /nfs/dbraw/zinc/96/02/97/1050960297.db2.gz FDURBELMNRZWFB-UHFFFAOYSA-N 1 2 315.486 4.435 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3ncc(C(C)(C)C)s3)ccc21 ZINC000790471020 1050960307 /nfs/dbraw/zinc/96/03/07/1050960307.db2.gz FDURBELMNRZWFB-UHFFFAOYSA-N 1 2 315.486 4.435 20 0 DIADLO COc1ccc(F)c(Nc2ccc3c(C)cc[nH+]c3c2)c1OC ZINC001214702573 1050983373 /nfs/dbraw/zinc/98/33/73/1050983373.db2.gz TZJYNASRKYMNEL-UHFFFAOYSA-N 1 2 312.344 4.443 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)nn1C ZINC000282782282 1051001734 /nfs/dbraw/zinc/00/17/34/1051001734.db2.gz PPQVXJZCYCXUGR-WDEREUQCSA-N 1 2 312.244 4.447 20 0 DIADLO CCC[C@@H]1CC(=O)N(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC000743348461 1051019210 /nfs/dbraw/zinc/01/92/10/1051019210.db2.gz MTELCSGXXWSWAV-PBHICJAKSA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@@H]1CC(=O)N(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC000743348461 1051019214 /nfs/dbraw/zinc/01/92/14/1051019214.db2.gz MTELCSGXXWSWAV-PBHICJAKSA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@@H]1CC(=O)N(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)C1 ZINC000743349201 1051019841 /nfs/dbraw/zinc/01/98/41/1051019841.db2.gz BZJVPHYOHIMROZ-RHSMWYFYSA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@@H]1CC(=O)N(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)C1 ZINC000743349201 1051019852 /nfs/dbraw/zinc/01/98/52/1051019852.db2.gz BZJVPHYOHIMROZ-RHSMWYFYSA-N 1 2 320.864 4.083 20 0 DIADLO Cc1cccc([C@H]2CCCC[N@@H+]2Cn2ncsc2=S)c1C ZINC000743387082 1051021154 /nfs/dbraw/zinc/02/11/54/1051021154.db2.gz CQKYUJNZUIOWIK-OAHLLOKOSA-N 1 2 319.499 4.476 20 0 DIADLO Cc1cccc([C@H]2CCCC[N@H+]2Cn2ncsc2=S)c1C ZINC000743387082 1051021165 /nfs/dbraw/zinc/02/11/65/1051021165.db2.gz CQKYUJNZUIOWIK-OAHLLOKOSA-N 1 2 319.499 4.476 20 0 DIADLO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1Cn1nnc2ccccc2c1=S ZINC000743379458 1051023914 /nfs/dbraw/zinc/02/39/14/1051023914.db2.gz PAGQMAHIHWPOMY-XJKSGUPXSA-N 1 2 316.474 4.019 20 0 DIADLO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cn1nnc2ccccc2c1=S ZINC000743379458 1051023925 /nfs/dbraw/zinc/02/39/25/1051023925.db2.gz PAGQMAHIHWPOMY-XJKSGUPXSA-N 1 2 316.474 4.019 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1cccnc1Cl ZINC000773061416 1051043381 /nfs/dbraw/zinc/04/33/81/1051043381.db2.gz XOXHLRFWOXOBKY-NOZJJQNGSA-N 1 2 309.196 4.173 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1cccnc1Cl ZINC000773061417 1051043664 /nfs/dbraw/zinc/04/36/64/1051043664.db2.gz XOXHLRFWOXOBKY-RNCFNFMXSA-N 1 2 309.196 4.173 20 0 DIADLO CC(C)(C)c1noc(C[NH2+][C@H](c2cccc(F)c2)C(C)(C)C)n1 ZINC000181072314 1051053180 /nfs/dbraw/zinc/05/31/80/1051053180.db2.gz OYSCWABBLUCHFS-OAHLLOKOSA-N 1 2 319.424 4.383 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@@H+]2Cc2cccc(Cl)n2)cc1 ZINC000743849817 1051075118 /nfs/dbraw/zinc/07/51/18/1051075118.db2.gz HRWPQTAITRWRMH-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@H+]2Cc2cccc(Cl)n2)cc1 ZINC000743849817 1051075126 /nfs/dbraw/zinc/07/51/26/1051075126.db2.gz HRWPQTAITRWRMH-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO Clc1ccccc1-c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001215117056 1051079445 /nfs/dbraw/zinc/07/94/45/1051079445.db2.gz XTUSOMIZDWHEMQ-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO COc1ccc2cc(NCc3cc(F)cc(OC)c3)[nH+]cc2c1 ZINC001171410209 1051096983 /nfs/dbraw/zinc/09/69/83/1051096983.db2.gz BMXBIVZRKHALAP-UHFFFAOYSA-N 1 2 312.344 4.003 20 0 DIADLO Fc1ccc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)cn1 ZINC000792192449 1051126862 /nfs/dbraw/zinc/12/68/62/1051126862.db2.gz KNELWDIDGWENTI-UHFFFAOYSA-N 1 2 312.310 4.175 20 0 DIADLO Fc1ccc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)cn1 ZINC000792192449 1051126864 /nfs/dbraw/zinc/12/68/64/1051126864.db2.gz KNELWDIDGWENTI-UHFFFAOYSA-N 1 2 312.310 4.175 20 0 DIADLO CS[C@H](C)CCC(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC000773284172 1051128479 /nfs/dbraw/zinc/12/84/79/1051128479.db2.gz VDSRPFGTOGIQFQ-LLVKDONJSA-N 1 2 317.458 4.164 20 0 DIADLO c1ccc(COC2CC(Nc3ccc([NH+]4CCCC4)cc3)C2)cc1 ZINC000716301027 1051130394 /nfs/dbraw/zinc/13/03/94/1051130394.db2.gz HFHQDJXXGDPWHQ-UHFFFAOYSA-N 1 2 322.452 4.447 20 0 DIADLO Cc1[nH+]c(C(C)(C)C)nc(NCc2cccc3ncoc32)c1C ZINC001171455796 1051137817 /nfs/dbraw/zinc/13/78/17/1051137817.db2.gz HYWVPCJVHHPRJC-UHFFFAOYSA-N 1 2 310.401 4.144 20 0 DIADLO COCOc1ccc(Nc2cc[nH+]c(SC)c2)cc1Cl ZINC001215257704 1051138163 /nfs/dbraw/zinc/13/81/63/1051138163.db2.gz OZLXBHYOHDXENL-UHFFFAOYSA-N 1 2 310.806 4.183 20 0 DIADLO COc1cccc2c(NCCOC3CCCCC3)cc[nH+]c12 ZINC001171478861 1051151268 /nfs/dbraw/zinc/15/12/68/1051151268.db2.gz DWKQTCQPRFVELU-UHFFFAOYSA-N 1 2 300.402 4.005 20 0 DIADLO c1cc2cc(NCc3nc(-c4ccccc4)cs3)[nH+]cc2[nH]1 ZINC001170241713 1051159282 /nfs/dbraw/zinc/15/92/82/1051159282.db2.gz VJGLADFIABKAGF-UHFFFAOYSA-N 1 2 306.394 4.299 20 0 DIADLO Oc1cccc(-c2ccc([C@H]3C[C@@H]3Nc3cccc[nH+]3)cc2)c1 ZINC001170248387 1051171233 /nfs/dbraw/zinc/17/12/33/1051171233.db2.gz RFPPSAMVPIINFB-MOPGFXCFSA-N 1 2 302.377 4.422 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2[C@@H](C)Cc2ccccc2Cl)no1 ZINC001170286307 1051181765 /nfs/dbraw/zinc/18/17/65/1051181765.db2.gz XNPGFRLYTWXXSY-LRDDRELGSA-N 1 2 319.836 4.190 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2[C@@H](C)Cc2ccccc2Cl)no1 ZINC001170286307 1051181771 /nfs/dbraw/zinc/18/17/71/1051181771.db2.gz XNPGFRLYTWXXSY-LRDDRELGSA-N 1 2 319.836 4.190 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)CCc1ccc(C)cc1)C(=O)OC(C)(C)C ZINC001171664366 1051188073 /nfs/dbraw/zinc/18/80/73/1051188073.db2.gz YGYFKPBSGNAWPV-RDJZCZTQSA-N 1 2 305.462 4.026 20 0 DIADLO Cc1ccc(CC[C@@H](C)[N@@H+]2Cc3cnc(Cl)cc3C2)cc1 ZINC001171679662 1051191442 /nfs/dbraw/zinc/19/14/42/1051191442.db2.gz BXQCTAUDMBPELO-CQSZACIVSA-N 1 2 300.833 4.380 20 0 DIADLO Cc1ccc(CC[C@@H](C)[N@H+]2Cc3cnc(Cl)cc3C2)cc1 ZINC001171679662 1051191453 /nfs/dbraw/zinc/19/14/53/1051191453.db2.gz BXQCTAUDMBPELO-CQSZACIVSA-N 1 2 300.833 4.380 20 0 DIADLO CCOc1c(F)c(F)ccc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001215415262 1051195170 /nfs/dbraw/zinc/19/51/70/1051195170.db2.gz KXHNTNKQTRIPND-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO CC(C)Oc1c(F)c(F)ccc1Nc1ccn2cc[nH+]c2c1 ZINC001215424637 1051199910 /nfs/dbraw/zinc/19/99/10/1051199910.db2.gz GASXLGGDDRIIDK-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO COc1ccc2c(c1)C[C@H](Nc1cc3cc(F)ccc3c[nH+]1)CC2 ZINC001170410885 1051203523 /nfs/dbraw/zinc/20/35/23/1051203523.db2.gz PPZQTKMZNPWWLE-GOSISDBHSA-N 1 2 322.383 4.352 20 0 DIADLO CSc1ccc(F)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001215446202 1051205924 /nfs/dbraw/zinc/20/59/24/1051205924.db2.gz HDPNAVRRHKXCOQ-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000792862168 1051217255 /nfs/dbraw/zinc/21/72/55/1051217255.db2.gz KKERTOZHCPJBFY-LSDHHAIUSA-N 1 2 319.408 4.417 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000792862168 1051217267 /nfs/dbraw/zinc/21/72/67/1051217267.db2.gz KKERTOZHCPJBFY-LSDHHAIUSA-N 1 2 319.408 4.417 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+][C@H](C)c1nc(C)sc1C ZINC000037089648 1051220650 /nfs/dbraw/zinc/22/06/50/1051220650.db2.gz CNKPNBSETLEZNN-NXEZZACHSA-N 1 2 308.422 4.319 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)OC[C@@H](C)c1ccccc1)c1ccccc1 ZINC000745099665 1051221425 /nfs/dbraw/zinc/22/14/25/1051221425.db2.gz KDYYVGQEMDHDCM-VQIMIIECSA-N 1 2 311.425 4.026 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)OC[C@@H](C)c1ccccc1)c1ccccc1 ZINC000745099665 1051221443 /nfs/dbraw/zinc/22/14/43/1051221443.db2.gz KDYYVGQEMDHDCM-VQIMIIECSA-N 1 2 311.425 4.026 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)O[C@@H](C)c1cccc(F)c1)c1ccccc1 ZINC000745097960 1051223230 /nfs/dbraw/zinc/22/32/30/1051223230.db2.gz OKAVJYOHOHTDAL-KBXCAEBGSA-N 1 2 315.388 4.123 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)O[C@@H](C)c1cccc(F)c1)c1ccccc1 ZINC000745097960 1051223242 /nfs/dbraw/zinc/22/32/42/1051223242.db2.gz OKAVJYOHOHTDAL-KBXCAEBGSA-N 1 2 315.388 4.123 20 0 DIADLO Fc1ccc([C@H]2CC[N@@H+]2Cc2cnn(Cc3ccccc3)c2)cc1 ZINC001171846815 1051231167 /nfs/dbraw/zinc/23/11/67/1051231167.db2.gz FMYFUBWWYMYPEZ-HXUWFJFHSA-N 1 2 321.399 4.018 20 0 DIADLO Fc1ccc([C@H]2CC[N@H+]2Cc2cnn(Cc3ccccc3)c2)cc1 ZINC001171846815 1051231182 /nfs/dbraw/zinc/23/11/82/1051231182.db2.gz FMYFUBWWYMYPEZ-HXUWFJFHSA-N 1 2 321.399 4.018 20 0 DIADLO COCc1cc(C)c(Nc2ccccc2-n2cc[nH+]c2)c(C)c1 ZINC001215530146 1051234995 /nfs/dbraw/zinc/23/49/95/1051234995.db2.gz KSDBBNYABQUELN-UHFFFAOYSA-N 1 2 307.397 4.379 20 0 DIADLO CCCOc1ccc(F)c(Nc2ccc3c(c2)[nH+]cn3C)c1F ZINC001215567530 1051247370 /nfs/dbraw/zinc/24/73/70/1051247370.db2.gz CMAYWLDONAGFJF-UHFFFAOYSA-N 1 2 317.339 4.384 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1C(=O)Nc1nc(C[NH+](CC)CC)cs1 ZINC000793154764 1051253519 /nfs/dbraw/zinc/25/35/19/1051253519.db2.gz SPLYDZIZITXGGZ-HIFRSBDPSA-N 1 2 323.506 4.140 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(C(F)(F)F)cc2O)c[nH+]1 ZINC001212632058 1051254119 /nfs/dbraw/zinc/25/41/19/1051254119.db2.gz DUQSIFROKXIOAW-UHFFFAOYSA-N 1 2 311.307 4.006 20 0 DIADLO COCc1ccc(Cl)c(Nc2ccccc2-n2cc[nH+]c2)c1 ZINC001215596134 1051263201 /nfs/dbraw/zinc/26/32/01/1051263201.db2.gz BTDVAVANRJCXID-UHFFFAOYSA-N 1 2 313.788 4.416 20 0 DIADLO OCc1c(Cl)ccc(Nc2cccc3cc[nH+]cc32)c1F ZINC001215608155 1051274416 /nfs/dbraw/zinc/27/44/16/1051274416.db2.gz SJLVNFDKLHPFDI-UHFFFAOYSA-N 1 2 302.736 4.263 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(C(C)(C)C)cc1)[N@H+](C)Cc1ccoc1 ZINC000745983478 1051303581 /nfs/dbraw/zinc/30/35/81/1051303581.db2.gz QXTFIFCIDVVCSW-AWEZNQCLSA-N 1 2 314.429 4.036 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(C(C)(C)C)cc1)[N@@H+](C)Cc1ccoc1 ZINC000745983478 1051303588 /nfs/dbraw/zinc/30/35/88/1051303588.db2.gz QXTFIFCIDVVCSW-AWEZNQCLSA-N 1 2 314.429 4.036 20 0 DIADLO C[C@H](CCC(C)(C)C)[NH2+]c1ccc(N2CCC(O)CC2)cc1 ZINC000793546979 1051314976 /nfs/dbraw/zinc/31/49/76/1051314976.db2.gz PHLIDBFXDQUVQT-OAHLLOKOSA-N 1 2 304.478 4.274 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]C2(c3c(Cl)cccc3Cl)CC2)n(C)n1 ZINC000793547090 1051315824 /nfs/dbraw/zinc/31/58/24/1051315824.db2.gz JZZPSJUSIUVEAC-LLVKDONJSA-N 1 2 324.255 4.375 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@H+](C)[C@H](C)c2ccco2)cc1 ZINC000746124455 1051325084 /nfs/dbraw/zinc/32/50/84/1051325084.db2.gz LWRCDQBQBJUNIW-HUUCEWRRSA-N 1 2 314.429 4.425 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@@H+](C)[C@H](C)c2ccco2)cc1 ZINC000746124455 1051325095 /nfs/dbraw/zinc/32/50/95/1051325095.db2.gz LWRCDQBQBJUNIW-HUUCEWRRSA-N 1 2 314.429 4.425 20 0 DIADLO C[C@@]12CC[N@H+](Cc3cc(F)c(F)c(F)c3)C[C@@H]1C2(Cl)Cl ZINC000793613213 1051327000 /nfs/dbraw/zinc/32/70/00/1051327000.db2.gz LOQRCVDBIZOIJI-WCQYABFASA-N 1 2 324.173 4.120 20 0 DIADLO C[C@@]12CC[N@@H+](Cc3cc(F)c(F)c(F)c3)C[C@@H]1C2(Cl)Cl ZINC000793613213 1051327007 /nfs/dbraw/zinc/32/70/07/1051327007.db2.gz LOQRCVDBIZOIJI-WCQYABFASA-N 1 2 324.173 4.120 20 0 DIADLO CC(C)Oc1c(F)ccc(Nc2ccn3cc[nH+]c3c2)c1F ZINC001215728458 1051328483 /nfs/dbraw/zinc/32/84/83/1051328483.db2.gz OCCNCSUXMDZOJA-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO Cc1ccc(Nc2ccc[nH+]c2N2CCCCC2)c2c[nH]nc21 ZINC001215755669 1051347167 /nfs/dbraw/zinc/34/71/67/1051347167.db2.gz WHMXQTXUOBVTGA-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO Cc1ccc(Oc2ccccc2)c(NC(=O)CCc2c[nH]c[nH+]2)c1 ZINC000189243343 1051356847 /nfs/dbraw/zinc/35/68/47/1051356847.db2.gz IMEXRLNLCYFNDU-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1ccc(Oc2ccccc2)c(NC(=O)CCc2c[nH+]c[nH]2)c1 ZINC000189243343 1051356858 /nfs/dbraw/zinc/35/68/58/1051356858.db2.gz IMEXRLNLCYFNDU-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO CN(C)c1ccc(Nc2ccnc(Oc3ccccc3)c2)c[nH+]1 ZINC001215773006 1051358081 /nfs/dbraw/zinc/35/80/81/1051358081.db2.gz IEQGXZZGHODYFL-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO Cc1ccc([C@@H](C)C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)o1 ZINC000794207527 1051361349 /nfs/dbraw/zinc/36/13/49/1051361349.db2.gz QIYPCVBYTKTVHI-CYBMUJFWSA-N 1 2 309.369 4.029 20 0 DIADLO CC[C@@H](CC(C)C)[N@@H+]1CCCC[C@@H]1c1noc(C(F)(F)F)n1 ZINC001172406165 1051381741 /nfs/dbraw/zinc/38/17/41/1051381741.db2.gz GFGQLMYOXLKPIM-NWDGAFQWSA-N 1 2 319.371 4.440 20 0 DIADLO CC[C@@H](CC(C)C)[N@H+]1CCCC[C@@H]1c1noc(C(F)(F)F)n1 ZINC001172406165 1051381748 /nfs/dbraw/zinc/38/17/48/1051381748.db2.gz GFGQLMYOXLKPIM-NWDGAFQWSA-N 1 2 319.371 4.440 20 0 DIADLO CCOCC[C@@H](C)[N@@H+]1CC[C@H](Cc2ccccc2)C(F)(F)C1 ZINC001172430246 1051385719 /nfs/dbraw/zinc/38/57/19/1051385719.db2.gz FTTJLXJTOGYJHN-NVXWUHKLSA-N 1 2 311.416 4.001 20 0 DIADLO CCOCC[C@@H](C)[N@H+]1CC[C@H](Cc2ccccc2)C(F)(F)C1 ZINC001172430246 1051385730 /nfs/dbraw/zinc/38/57/30/1051385730.db2.gz FTTJLXJTOGYJHN-NVXWUHKLSA-N 1 2 311.416 4.001 20 0 DIADLO CCOc1cc(Nc2ccc[nH+]c2N2CCCC2)ccc1Cl ZINC001212578154 1051389892 /nfs/dbraw/zinc/38/98/92/1051389892.db2.gz OTILALPAFWXRCE-UHFFFAOYSA-N 1 2 317.820 4.478 20 0 DIADLO CC(C)(C)c1ccc(/C=C\C(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001129482676 1051402899 /nfs/dbraw/zinc/40/28/99/1051402899.db2.gz WFWZDSRWUZKTIF-TWGQIWQCSA-N 1 2 319.408 4.284 20 0 DIADLO CSc1cc(F)c(Nc2ccc[nH+]c2N2CCCC2)c(F)c1 ZINC001215841289 1051406145 /nfs/dbraw/zinc/40/61/45/1051406145.db2.gz QUKQMVYVDAREGK-UHFFFAOYSA-N 1 2 321.396 4.426 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)o1 ZINC000391814554 1051407410 /nfs/dbraw/zinc/40/74/10/1051407410.db2.gz DOQJLXDWRKADKO-LJQANCHMSA-N 1 2 310.372 4.310 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)o1 ZINC000391814553 1051408185 /nfs/dbraw/zinc/40/81/85/1051408185.db2.gz DOQJLXDWRKADKO-IBGZPJMESA-N 1 2 310.372 4.310 20 0 DIADLO O[C@@H](CNc1cc[nH+]c2c(Cl)cccc12)c1ccsc1 ZINC000804481006 1051415660 /nfs/dbraw/zinc/41/56/60/1051415660.db2.gz DTDXPYXNRBWKMC-AWEZNQCLSA-N 1 2 304.802 4.095 20 0 DIADLO CCOc1cc(C)ccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001215876127 1051432246 /nfs/dbraw/zinc/43/22/46/1051432246.db2.gz WLNFVYSSESEXBR-UHFFFAOYSA-N 1 2 307.397 4.382 20 0 DIADLO CC[C@@H](C)c1ccccc1Nc1ccc(C[NH+]2CC(O)C2)cc1 ZINC001212668463 1051432883 /nfs/dbraw/zinc/43/28/83/1051432883.db2.gz ZLRYLQAEVXDWEM-OAHLLOKOSA-N 1 2 310.441 4.120 20 0 DIADLO CC(C)Oc1ccc2cc(Nc3[nH+]cccc3CCO)ccc2c1 ZINC001215922115 1051458320 /nfs/dbraw/zinc/45/83/20/1051458320.db2.gz OPMCOITVKMVKLY-UHFFFAOYSA-N 1 2 322.408 4.300 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1ccccc1C(F)(F)F)CC2 ZINC001168894558 1051458969 /nfs/dbraw/zinc/45/89/69/1051458969.db2.gz UAZLYKYLUXOBTK-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1ccccc1C(F)(F)F)CC2 ZINC001168894558 1051458973 /nfs/dbraw/zinc/45/89/73/1051458973.db2.gz UAZLYKYLUXOBTK-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO COc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1SC ZINC001215932027 1051465394 /nfs/dbraw/zinc/46/53/94/1051465394.db2.gz QMXUQAJFZWBKBG-UHFFFAOYSA-N 1 2 315.442 4.156 20 0 DIADLO COc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1SC ZINC001215935739 1051468586 /nfs/dbraw/zinc/46/85/86/1051468586.db2.gz NOOFUEBUPNWSFT-UHFFFAOYSA-N 1 2 311.410 4.346 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[NH2+]Cc2nnc(C(F)(F)F)s2)c1 ZINC001168925245 1051468803 /nfs/dbraw/zinc/46/88/03/1051468803.db2.gz MKJXCIHTYMGYOA-SNVBAGLBSA-N 1 2 315.364 4.025 20 0 DIADLO COc1c(Cl)ccc(Nc2cccn3cc(C)[nH+]c23)c1F ZINC001212582774 1051469791 /nfs/dbraw/zinc/46/97/91/1051469791.db2.gz ZJAMUTFAJAMXBC-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO Clc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)c2c[nH]nc21 ZINC001215942735 1051472198 /nfs/dbraw/zinc/47/21/98/1051472198.db2.gz OTTJCGFTPJYZLS-UHFFFAOYSA-N 1 2 309.760 4.146 20 0 DIADLO Clc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)c2c[nH]nc21 ZINC001215943466 1051473932 /nfs/dbraw/zinc/47/39/32/1051473932.db2.gz PSKXVVIFYFPKFE-UHFFFAOYSA-N 1 2 323.787 4.205 20 0 DIADLO Cc1ccsc1C[NH+](Cc1ccccn1)Cc1ccccn1 ZINC001204019231 1051477551 /nfs/dbraw/zinc/47/75/51/1051477551.db2.gz RUSXFXIOKZAOSY-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1ccc2cc(NCc3ccccc3-n3cccn3)[nH+]cc2c1 ZINC001168960421 1051479276 /nfs/dbraw/zinc/47/92/76/1051479276.db2.gz OZYBGSUBZYNUHW-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Clc1cc2ccccc2c(NCCc2cn3ccccc3[nH+]2)n1 ZINC001169000510 1051485758 /nfs/dbraw/zinc/48/57/58/1051485758.db2.gz NEDWQTRUFIBPCS-UHFFFAOYSA-N 1 2 322.799 4.191 20 0 DIADLO CCOc1c(C)cc(C)cc1NCCc1cn2ccccc2[nH+]1 ZINC001169009567 1051487827 /nfs/dbraw/zinc/48/78/27/1051487827.db2.gz QYLUKMDBRHPFFB-UHFFFAOYSA-N 1 2 309.413 4.004 20 0 DIADLO Cc1ccc2cc(NCc3cn4cccc(C)c4n3)[nH+]cc2c1 ZINC001169014823 1051489262 /nfs/dbraw/zinc/48/92/62/1051489262.db2.gz JTRQKYAKALEDMF-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(Cl)c2ccccc12)c1noc(C)n1 ZINC001169122833 1051522720 /nfs/dbraw/zinc/52/27/20/1051522720.db2.gz DTFIBPHRUNSWKA-INIZCTEOSA-N 1 2 315.804 4.426 20 0 DIADLO CC(C)c1ccc[nH+]c1Nc1cc(OC(F)(F)F)ccc1N ZINC001216015565 1051524551 /nfs/dbraw/zinc/52/45/51/1051524551.db2.gz QVPDEDSOBLGCCP-UHFFFAOYSA-N 1 2 311.307 4.429 20 0 DIADLO COc1c(Cl)ccc(Nc2ccccc2-n2cc[nH+]c2)c1F ZINC001212585044 1051525512 /nfs/dbraw/zinc/52/55/12/1051525512.db2.gz NOSTYCZOWBXTBS-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO CCN(C)c1ccc(Nc2cnc(SC)c(Cl)c2)c[nH+]1 ZINC001216027837 1051533763 /nfs/dbraw/zinc/53/37/63/1051533763.db2.gz KUOZWCFTDWXKPS-UHFFFAOYSA-N 1 2 308.838 4.052 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001172846080 1051534311 /nfs/dbraw/zinc/53/43/11/1051534311.db2.gz BLTOBGKCMNGRJH-ONERCXAPSA-N 1 2 305.771 4.182 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001172846080 1051534321 /nfs/dbraw/zinc/53/43/21/1051534321.db2.gz BLTOBGKCMNGRJH-ONERCXAPSA-N 1 2 305.771 4.182 20 0 DIADLO Nc1ccc(Nc2[nH+]cccc2C2CC2)cc1OC(F)(F)F ZINC001216032549 1051537402 /nfs/dbraw/zinc/53/74/02/1051537402.db2.gz ZHZBFARUUPUCSU-UHFFFAOYSA-N 1 2 309.291 4.183 20 0 DIADLO CCCc1cc[nH+]c(Nc2ccc(N)c(OC(F)(F)F)c2)c1 ZINC001216031746 1051537439 /nfs/dbraw/zinc/53/74/39/1051537439.db2.gz FDUGOIKKBLERRN-UHFFFAOYSA-N 1 2 311.307 4.259 20 0 DIADLO C[C@@H](CSc1ccc(Cl)cc1)[N@H+]1C[C@@H](F)C[C@H]1CF ZINC001172875431 1051559440 /nfs/dbraw/zinc/55/94/40/1051559440.db2.gz LBOUGIWEFHJNTP-DRZSPHRISA-N 1 2 305.821 4.203 20 0 DIADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1cc(F)ccc1Cl ZINC001169188215 1051541668 /nfs/dbraw/zinc/54/16/68/1051541668.db2.gz QAURWMRZLKLHPU-LBPRGKRZSA-N 1 2 305.780 4.262 20 0 DIADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1cc(F)ccc1Cl ZINC001169188215 1051541678 /nfs/dbraw/zinc/54/16/78/1051541678.db2.gz QAURWMRZLKLHPU-LBPRGKRZSA-N 1 2 305.780 4.262 20 0 DIADLO COc1cccc2c1C[N@@H+]([C@H](C)Cc1c(F)cccc1Cl)C2 ZINC001172855510 1051541631 /nfs/dbraw/zinc/54/16/31/1051541631.db2.gz FPGXKNCWDQDLSY-GFCCVEGCSA-N 1 2 319.807 4.435 20 0 DIADLO COc1cccc2c1C[N@H+]([C@H](C)Cc1c(F)cccc1Cl)C2 ZINC001172855510 1051541641 /nfs/dbraw/zinc/54/16/41/1051541641.db2.gz FPGXKNCWDQDLSY-GFCCVEGCSA-N 1 2 319.807 4.435 20 0 DIADLO CC(C)c1cc(Nc2cccc(Cn3cc[nH+]c3)c2)ccc1N ZINC001216046019 1051545820 /nfs/dbraw/zinc/54/58/20/1051545820.db2.gz ZXRBKBCENSMTRJ-UHFFFAOYSA-N 1 2 306.413 4.381 20 0 DIADLO CC(C)c1cc(Nc2cc(OC(F)(F)F)cc[nH+]2)ccc1N ZINC001216045761 1051545929 /nfs/dbraw/zinc/54/59/29/1051545929.db2.gz SGTRYEUXTGUMNN-UHFFFAOYSA-N 1 2 311.307 4.429 20 0 DIADLO Clc1cccc2c(N3CC[C@@H](c4ccccn4)C3)cc[nH+]c12 ZINC000804685418 1051546821 /nfs/dbraw/zinc/54/68/21/1051546821.db2.gz IHUZMLHVSIAEOW-CYBMUJFWSA-N 1 2 309.800 4.277 20 0 DIADLO Clc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)c2n[nH]cc21 ZINC001216057080 1051554325 /nfs/dbraw/zinc/55/43/25/1051554325.db2.gz YPGLECAOHGMROJ-UHFFFAOYSA-N 1 2 309.760 4.146 20 0 DIADLO Clc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c2n[nH]cc21 ZINC001216056737 1051555324 /nfs/dbraw/zinc/55/53/24/1051555324.db2.gz USINSCKVAKUUJE-UHFFFAOYSA-N 1 2 323.787 4.205 20 0 DIADLO CN(C)c1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1Cl ZINC001216060428 1051556645 /nfs/dbraw/zinc/55/66/45/1051556645.db2.gz ZTGKWWSQXZLPPM-UHFFFAOYSA-N 1 2 316.836 4.145 20 0 DIADLO C[C@@H](CSc1ccc(Cl)cc1)[N@@H+]1C[C@@H](F)C[C@H]1CF ZINC001172875431 1051559428 /nfs/dbraw/zinc/55/94/28/1051559428.db2.gz LBOUGIWEFHJNTP-DRZSPHRISA-N 1 2 305.821 4.203 20 0 DIADLO Fc1ncc(-c2ccccc2)cc1Nc1cccn2cc[nH+]c12 ZINC001216070664 1051560162 /nfs/dbraw/zinc/56/01/62/1051560162.db2.gz UIXSTDZHYILAOO-UHFFFAOYSA-N 1 2 304.328 4.279 20 0 DIADLO Fc1ccc(N[C@@H](C2CCC2)C(F)(F)F)cc1-n1cc[nH+]c1 ZINC001169286840 1051572221 /nfs/dbraw/zinc/57/22/21/1051572221.db2.gz BPWRWKXIIXWYMC-AWEZNQCLSA-N 1 2 313.298 4.154 20 0 DIADLO Cc1cc(Cl)c(N)c(Nc2cc(OC(F)(F)F)cc[nH+]2)c1 ZINC001216093167 1051576746 /nfs/dbraw/zinc/57/67/46/1051576746.db2.gz UXEZJMOMQXCRBB-UHFFFAOYSA-N 1 2 317.698 4.268 20 0 DIADLO CCn1ncc2cc(Nc3ccc(Cn4cc[nH+]c4)cc3)ccc21 ZINC001212699116 1051585145 /nfs/dbraw/zinc/58/51/45/1051585145.db2.gz OQFKCHKNHVLPET-UHFFFAOYSA-N 1 2 317.396 4.045 20 0 DIADLO Nc1cc(F)cc(Cl)c1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212699146 1051586147 /nfs/dbraw/zinc/58/61/47/1051586147.db2.gz PVDJFCMBXLRKRN-UHFFFAOYSA-N 1 2 316.767 4.050 20 0 DIADLO Fc1cnc2c(cccc2Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212698947 1051586756 /nfs/dbraw/zinc/58/67/56/1051586756.db2.gz FYYJKIFRMZLYHH-UHFFFAOYSA-N 1 2 318.355 4.362 20 0 DIADLO Fc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(Cl)c1 ZINC001212696927 1051587848 /nfs/dbraw/zinc/58/78/48/1051587848.db2.gz VNZAOVPKKOONOP-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO CNc1ccc(N[C@@H]2CCc3c2cccc3OC(F)(F)F)c[nH+]1 ZINC001169359850 1051588290 /nfs/dbraw/zinc/58/82/90/1051588290.db2.gz SDVSVHNPKLXQKT-CYBMUJFWSA-N 1 2 323.318 4.121 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(N)cc2C(F)(F)F)cc1 ZINC001216134779 1051597380 /nfs/dbraw/zinc/59/73/80/1051597380.db2.gz QTVCCEMCOVXWIJ-UHFFFAOYSA-N 1 2 309.335 4.487 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(N)cc2C(F)(F)F)cc1 ZINC001216134779 1051597393 /nfs/dbraw/zinc/59/73/93/1051597393.db2.gz QTVCCEMCOVXWIJ-UHFFFAOYSA-N 1 2 309.335 4.487 20 0 DIADLO Cc1cc(Oc2ccc(Nc3ccc(O)c(CO)c3)cc2)cc[nH+]1 ZINC001216142905 1051599135 /nfs/dbraw/zinc/59/91/35/1051599135.db2.gz UXYYCQPRENIYBP-UHFFFAOYSA-N 1 2 322.364 4.124 20 0 DIADLO C[C@@H]1C[C@@H](Nc2cc[nH+]c(OC3CCOCC3)c2)c2ccccc21 ZINC001169381438 1051600759 /nfs/dbraw/zinc/60/07/59/1051600759.db2.gz SIECRQGWDQLKAB-AUUYWEPGSA-N 1 2 324.424 4.300 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001130043540 1051600922 /nfs/dbraw/zinc/60/09/22/1051600922.db2.gz SKHWCKFJNCKOGA-SFHVURJKSA-N 1 2 302.462 4.311 20 0 DIADLO C/C(=C/c1cccc(Cl)c1)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001130043621 1051600947 /nfs/dbraw/zinc/60/09/47/1051600947.db2.gz VTGGKRIXWHPNPA-GHXNOFRVSA-N 1 2 314.816 4.072 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cccc(-c4ccncc4)c3)ccc21 ZINC001216147391 1051600968 /nfs/dbraw/zinc/60/09/68/1051600968.db2.gz NKNIBICRKMCOID-UHFFFAOYSA-N 1 2 300.365 4.379 20 0 DIADLO Cc1cc(CNC(=O)c2c(Cl)oc3ccccc32)cc(C)[nH+]1 ZINC001130045078 1051601062 /nfs/dbraw/zinc/60/10/62/1051601062.db2.gz JCHVUIWOXCYHQE-UHFFFAOYSA-N 1 2 314.772 4.028 20 0 DIADLO S=c1ncccn1C[N@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000766667753 1051603056 /nfs/dbraw/zinc/60/30/56/1051603056.db2.gz WBZXVDOVNJLUQF-OAHLLOKOSA-N 1 2 319.861 4.451 20 0 DIADLO S=c1ncccn1C[N@@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000766667753 1051603060 /nfs/dbraw/zinc/60/30/60/1051603060.db2.gz WBZXVDOVNJLUQF-OAHLLOKOSA-N 1 2 319.861 4.451 20 0 DIADLO Cc1c[nH+]cc(N[C@H](CCO)c2cccc3ccccc32)c1C ZINC001169423256 1051609056 /nfs/dbraw/zinc/60/90/56/1051609056.db2.gz BUQYBZHTMRUWSC-LJQANCHMSA-N 1 2 306.409 4.387 20 0 DIADLO Cc1cc(N[C@H](CCO)c2cccc3ccccc32)c[nH+]c1C ZINC001169425822 1051609559 /nfs/dbraw/zinc/60/95/59/1051609559.db2.gz REEJXLAAPQXMPY-HXUWFJFHSA-N 1 2 306.409 4.387 20 0 DIADLO CC(=Cc1ccc(F)cc1)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000749338449 1051620732 /nfs/dbraw/zinc/62/07/32/1051620732.db2.gz PIJJAYKELFHPRD-LUAWRHEFSA-N 1 2 309.344 4.052 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2nc(C)c(C)s2)s1 ZINC000088601589 1051627291 /nfs/dbraw/zinc/62/72/91/1051627291.db2.gz ZZMYXPZZADRZSG-NSHDSACASA-N 1 2 309.504 4.280 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2nc(C)c(C)s2)s1 ZINC000088601589 1051627297 /nfs/dbraw/zinc/62/72/97/1051627297.db2.gz ZZMYXPZZADRZSG-NSHDSACASA-N 1 2 309.504 4.280 20 0 DIADLO C[C@@H](Nc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1)c1cnccn1 ZINC001169539231 1051638846 /nfs/dbraw/zinc/63/88/46/1051638846.db2.gz TWVIXSIMJARDOV-CYBMUJFWSA-N 1 2 315.380 4.193 20 0 DIADLO COc1cccc2c(NC[C@H](C)c3ccc(O)cc3)cc[nH+]c12 ZINC001169548940 1051640614 /nfs/dbraw/zinc/64/06/14/1051640614.db2.gz TYHCOJBQSPODPD-ZDUSSCGKSA-N 1 2 308.381 4.165 20 0 DIADLO CCc1ccc(C[C@@H](C)[N@@H+]2Cc3cnc(Cl)cc3C2)cc1 ZINC001173247370 1051650981 /nfs/dbraw/zinc/65/09/81/1051650981.db2.gz PHEGXNZTROOQPE-CYBMUJFWSA-N 1 2 300.833 4.244 20 0 DIADLO CCc1ccc(C[C@@H](C)[N@H+]2Cc3cnc(Cl)cc3C2)cc1 ZINC001173247370 1051650992 /nfs/dbraw/zinc/65/09/92/1051650992.db2.gz PHEGXNZTROOQPE-CYBMUJFWSA-N 1 2 300.833 4.244 20 0 DIADLO Cc1ccc2cc(N[C@@H]3CCc4ccccc4[C@@H]3O)[nH+]cc2c1 ZINC001169623526 1051657438 /nfs/dbraw/zinc/65/74/38/1051657438.db2.gz SLMKILCKTKYRAL-QUCCMNQESA-N 1 2 304.393 4.004 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(N[C@@H]2CCc3ccccc3[C@H]2O)c1 ZINC001169629206 1051659924 /nfs/dbraw/zinc/65/99/24/1051659924.db2.gz RKAKGJODQYCLIC-TZIWHRDSSA-N 1 2 324.468 4.302 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(N[C@@H]2CCc3ccccc3[C@@H]2O)c1 ZINC001169629201 1051659954 /nfs/dbraw/zinc/65/99/54/1051659954.db2.gz RKAKGJODQYCLIC-CTNGQTDRSA-N 1 2 324.468 4.302 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)n1 ZINC000766795185 1051677280 /nfs/dbraw/zinc/67/72/80/1051677280.db2.gz CAOUQRDZXSZNSC-STQMWFEESA-N 1 2 317.285 4.248 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)n1 ZINC000766795185 1051677284 /nfs/dbraw/zinc/67/72/84/1051677284.db2.gz CAOUQRDZXSZNSC-STQMWFEESA-N 1 2 317.285 4.248 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)n1 ZINC000766795182 1051677316 /nfs/dbraw/zinc/67/73/16/1051677316.db2.gz CAOUQRDZXSZNSC-CHWSQXEVSA-N 1 2 317.285 4.248 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)n1 ZINC000766795182 1051677323 /nfs/dbraw/zinc/67/73/23/1051677323.db2.gz CAOUQRDZXSZNSC-CHWSQXEVSA-N 1 2 317.285 4.248 20 0 DIADLO OC1CCN(c2ccc(Nc3ccc(C4CCC4)cc3)c[nH+]2)CC1 ZINC001216305734 1051686700 /nfs/dbraw/zinc/68/67/00/1051686700.db2.gz YNBWVVYXAPBUJG-UHFFFAOYSA-N 1 2 323.440 4.054 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1ncc(C(C)C)o1 ZINC000805833786 1051686832 /nfs/dbraw/zinc/68/68/32/1051686832.db2.gz AMIARZOIZIWNOY-OAHLLOKOSA-N 1 2 302.418 4.390 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1ncc(C(C)C)o1 ZINC000805833786 1051686843 /nfs/dbraw/zinc/68/68/43/1051686843.db2.gz AMIARZOIZIWNOY-OAHLLOKOSA-N 1 2 302.418 4.390 20 0 DIADLO Cc1c(O)cccc1Nc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001216317192 1051695315 /nfs/dbraw/zinc/69/53/15/1051695315.db2.gz MOVMYEKCVDSUTC-UHFFFAOYSA-N 1 2 315.373 4.186 20 0 DIADLO Nc1cc(-c2cc(Cl)c(F)cc2F)[nH+]cc1C(F)(F)F ZINC001242289768 1051714527 /nfs/dbraw/zinc/71/45/27/1051714527.db2.gz QHMNFMOLOVMMQH-UHFFFAOYSA-N 1 2 308.637 4.281 20 0 DIADLO c1cc2cc(NCc3ccc(-c4ccccn4)cc3)[nH+]cc2[nH]1 ZINC001169888429 1051715897 /nfs/dbraw/zinc/71/58/97/1051715897.db2.gz RMKPKUPVGMNUKU-UHFFFAOYSA-N 1 2 300.365 4.237 20 0 DIADLO OC[C@H](CNc1[nH+]cccc1-c1ccccc1)Cc1ccccc1 ZINC001169895470 1051722821 /nfs/dbraw/zinc/72/28/21/1051722821.db2.gz BEDFYBCKGPPXGH-SFHVURJKSA-N 1 2 318.420 4.012 20 0 DIADLO Fc1cccc([C@H]2C[N@H+](Cc3ccc(C(F)F)cc3)CCO2)c1 ZINC000183935081 1051723118 /nfs/dbraw/zinc/72/31/18/1051723118.db2.gz ORFSDJNUPNHAGW-QGZVFWFLSA-N 1 2 321.342 4.337 20 0 DIADLO Fc1cccc([C@H]2C[N@@H+](Cc3ccc(C(F)F)cc3)CCO2)c1 ZINC000183935081 1051723127 /nfs/dbraw/zinc/72/31/27/1051723127.db2.gz ORFSDJNUPNHAGW-QGZVFWFLSA-N 1 2 321.342 4.337 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(C(F)F)cc1)c1nc(C(C)(C)C)no1 ZINC000184001375 1051725428 /nfs/dbraw/zinc/72/54/28/1051725428.db2.gz YXICQJCWHCOHRJ-SNVBAGLBSA-N 1 2 309.360 4.156 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1nnc(-c2ccccc2)s1 ZINC000184222407 1051729970 /nfs/dbraw/zinc/72/99/70/1051729970.db2.gz UZVLNWHXSISFEM-CQSZACIVSA-N 1 2 321.449 4.152 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1nnc(-c2ccccc2)s1 ZINC000184222407 1051729983 /nfs/dbraw/zinc/72/99/83/1051729983.db2.gz UZVLNWHXSISFEM-CQSZACIVSA-N 1 2 321.449 4.152 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H]2CCc3nc(Cl)ccc32)cs1 ZINC000806139018 1051740254 /nfs/dbraw/zinc/74/02/54/1051740254.db2.gz HDGOCQDBMXTDAV-GXSJLCMTSA-N 1 2 307.850 4.092 20 0 DIADLO C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1Cc2cncnc2C1 ZINC001173548289 1051749523 /nfs/dbraw/zinc/74/95/23/1051749523.db2.gz ZYRFBSIDSQAZOI-NSHDSACASA-N 1 2 322.239 4.120 20 0 DIADLO C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1Cc2cncnc2C1 ZINC001173548289 1051749538 /nfs/dbraw/zinc/74/95/38/1051749538.db2.gz ZYRFBSIDSQAZOI-NSHDSACASA-N 1 2 322.239 4.120 20 0 DIADLO COc1cnc(F)c(Nc2cc[nH+]c3cc(Cl)ccc23)c1 ZINC001216407128 1051751493 /nfs/dbraw/zinc/75/14/93/1051751493.db2.gz DHAGXYIVTXTOKL-UHFFFAOYSA-N 1 2 303.724 4.175 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CC[C@H]3C(C)(C)C)cc2)CCO1 ZINC000806156823 1051758540 /nfs/dbraw/zinc/75/85/40/1051758540.db2.gz KNRCEAPPVLAXEZ-ZTFGCOKTSA-N 1 2 302.462 4.148 20 0 DIADLO Cc1cc([NH2+][C@H]2CC[C@@H]2C2CC2)ccc1N1CCSCC1 ZINC000806156701 1051759649 /nfs/dbraw/zinc/75/96/49/1051759649.db2.gz ILTBCUKDQUEXTR-SJORKVTESA-N 1 2 302.487 4.149 20 0 DIADLO Cc1cc(Cl)ccc1C[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000185289526 1051760402 /nfs/dbraw/zinc/76/04/02/1051760402.db2.gz GUDXLRNPGHXPBC-LLVKDONJSA-N 1 2 307.825 4.180 20 0 DIADLO C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000806289166 1051785641 /nfs/dbraw/zinc/78/56/41/1051785641.db2.gz GLOXNWPSYIGQDI-ZIAGYGMSSA-N 1 2 314.433 4.013 20 0 DIADLO Cc1cc(CNc2[nH+]c3cccc(Cl)c3n2C)cnc1Cl ZINC000767292840 1051785774 /nfs/dbraw/zinc/78/57/74/1051785774.db2.gz XZYVMBBZXUWFNI-UHFFFAOYSA-N 1 2 321.211 4.196 20 0 DIADLO CCOc1cc(C[N@@H+]2CCc3c(Cl)cccc3C2)ccc1O ZINC001204133398 1051787911 /nfs/dbraw/zinc/78/79/11/1051787911.db2.gz SNIADNBLEXPDAH-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1cc(C[N@H+]2CCc3c(Cl)cccc3C2)ccc1O ZINC001204133398 1051787926 /nfs/dbraw/zinc/78/79/26/1051787926.db2.gz SNIADNBLEXPDAH-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO COc1ccsc1[C@H](C)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000186146281 1051798118 /nfs/dbraw/zinc/79/81/18/1051798118.db2.gz JCQPDSQYAIOSDN-LBPRGKRZSA-N 1 2 314.410 4.263 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000186247310 1051802282 /nfs/dbraw/zinc/80/22/82/1051802282.db2.gz MRYMQFLOPYXDDD-ZBEGNZNMSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000186247310 1051802290 /nfs/dbraw/zinc/80/22/90/1051802290.db2.gz MRYMQFLOPYXDDD-ZBEGNZNMSA-N 1 2 306.331 4.082 20 0 DIADLO FC(F)(F)c1ccccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001173842836 1051818670 /nfs/dbraw/zinc/81/86/70/1051818670.db2.gz XGEYBABVXPMZMM-UHFFFAOYSA-N 1 2 307.319 4.444 20 0 DIADLO Cc1ccc2c(c1)CCN2Cc1c[nH+]c(N(C)C)c2ccccc12 ZINC001169970057 1051821216 /nfs/dbraw/zinc/82/12/16/1051821216.db2.gz DIDDYMWRSFXFCR-UHFFFAOYSA-N 1 2 317.436 4.172 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2c(F)cccc2F)cc[nH+]1 ZINC001173858511 1051830754 /nfs/dbraw/zinc/83/07/54/1051830754.db2.gz IUIPBNIJJFUGLL-UHFFFAOYSA-N 1 2 321.327 4.450 20 0 DIADLO FC(F)(F)c1cccc(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001173822979 1051842361 /nfs/dbraw/zinc/84/23/61/1051842361.db2.gz ZITOQCZCWBZILF-UHFFFAOYSA-N 1 2 307.319 4.444 20 0 DIADLO COc1cc(C)c(NCc2cc(-n3cc[nH+]c3)cs2)cc1C ZINC000767737911 1051845727 /nfs/dbraw/zinc/84/57/27/1051845727.db2.gz KEBSQQLECQOVDI-UHFFFAOYSA-N 1 2 313.426 4.171 20 0 DIADLO C[C@H](SCc1cc[nH+]c(N(C)C)c1)c1cc(F)ccc1F ZINC000767872461 1051860019 /nfs/dbraw/zinc/86/00/19/1051860019.db2.gz VKFVJYZGINADBL-NSHDSACASA-N 1 2 308.397 4.420 20 0 DIADLO CN(C)c1cc(CSCc2csc(C(C)(C)C)n2)cc[nH+]1 ZINC000767872684 1051861059 /nfs/dbraw/zinc/86/10/59/1051861059.db2.gz ZSDUEWWYBGGQTH-UHFFFAOYSA-N 1 2 321.515 4.335 20 0 DIADLO Clc1cccc(-c2noc(-c3ccccc3-n3cc[nH+]c3)n2)c1 ZINC001216757296 1051874364 /nfs/dbraw/zinc/87/43/64/1051874364.db2.gz PMMYUYLIYSKHLN-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO CCCc1csc(C[NH2+][C@H]2CCCOc3ccc(F)cc32)n1 ZINC000494314936 1051876807 /nfs/dbraw/zinc/87/68/07/1051876807.db2.gz RMTQNIICHXAORS-HNNXBMFYSA-N 1 2 320.433 4.238 20 0 DIADLO CCCc1csc(C[NH2+][C@@H]2CCCOc3ccc(F)cc32)n1 ZINC000494314937 1051877018 /nfs/dbraw/zinc/87/70/18/1051877018.db2.gz RMTQNIICHXAORS-OAHLLOKOSA-N 1 2 320.433 4.238 20 0 DIADLO CCCc1csc(C[NH2+][C@@H]2CCOc3c(Cl)cccc32)n1 ZINC000494360339 1051878828 /nfs/dbraw/zinc/87/88/28/1051878828.db2.gz WDIUEIDYWIRIJN-CQSZACIVSA-N 1 2 322.861 4.362 20 0 DIADLO CCCc1csc(C[NH2+]Cc2ccccc2OCC(C)C)n1 ZINC000494382884 1051885574 /nfs/dbraw/zinc/88/55/74/1051885574.db2.gz FPGYVAHIWOVKKG-UHFFFAOYSA-N 1 2 318.486 4.420 20 0 DIADLO C[N@H+](Cc1ccc2c(c1)COC2)Cc1c(F)cccc1Cl ZINC000768169110 1051892777 /nfs/dbraw/zinc/89/27/77/1051892777.db2.gz PHDNFYXTOFAPFG-UHFFFAOYSA-N 1 2 305.780 4.141 20 0 DIADLO C[N@@H+](Cc1ccc2c(c1)COC2)Cc1c(F)cccc1Cl ZINC000768169110 1051892785 /nfs/dbraw/zinc/89/27/85/1051892785.db2.gz PHDNFYXTOFAPFG-UHFFFAOYSA-N 1 2 305.780 4.141 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c(C)o1 ZINC000768231696 1051906456 /nfs/dbraw/zinc/90/64/56/1051906456.db2.gz PMISBNNWXNWJAN-QMMMGPOBSA-N 1 2 304.337 4.223 20 0 DIADLO Clc1ccc(C[N@H+](Cc2coc(C3CC3)n2)C2CC2)cc1 ZINC000768257546 1051909873 /nfs/dbraw/zinc/90/98/73/1051909873.db2.gz LWFZCPCDXAYQDC-UHFFFAOYSA-N 1 2 302.805 4.370 20 0 DIADLO Clc1ccc(C[N@@H+](Cc2coc(C3CC3)n2)C2CC2)cc1 ZINC000768257546 1051909876 /nfs/dbraw/zinc/90/98/76/1051909876.db2.gz LWFZCPCDXAYQDC-UHFFFAOYSA-N 1 2 302.805 4.370 20 0 DIADLO Cc1cccc(Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)[nH+]c2)c1C ZINC001173951650 1051916697 /nfs/dbraw/zinc/91/66/97/1051916697.db2.gz DNLAOHYFRHLCLI-GASCZTMLSA-N 1 2 311.429 4.056 20 0 DIADLO Cc1nn(-c2ccc(Cl)cc2)c(Cl)c1C[N@@H+](C)C1CC1 ZINC000768335352 1051918284 /nfs/dbraw/zinc/91/82/84/1051918284.db2.gz MBVJPOZOFXFMEX-UHFFFAOYSA-N 1 2 310.228 4.082 20 0 DIADLO Cc1nn(-c2ccc(Cl)cc2)c(Cl)c1C[N@H+](C)C1CC1 ZINC000768335352 1051918294 /nfs/dbraw/zinc/91/82/94/1051918294.db2.gz MBVJPOZOFXFMEX-UHFFFAOYSA-N 1 2 310.228 4.082 20 0 DIADLO Cc1ccc(-c2noc(-c3ccc(-c4c[nH+]cn4C)cc3)n2)cc1 ZINC001217010000 1051929300 /nfs/dbraw/zinc/92/93/00/1051929300.db2.gz GYBHEMKJWHPZKJ-UHFFFAOYSA-N 1 2 316.364 4.113 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1ccc(C(=O)N(C)C)cc1 ZINC001174006270 1051930216 /nfs/dbraw/zinc/93/02/16/1051930216.db2.gz KNZSWICPPDIWST-UHFFFAOYSA-N 1 2 311.429 4.034 20 0 DIADLO COc1ccc(OC)c(OC)c1Nc1cccc2cc[nH+]cc21 ZINC001174055518 1051942891 /nfs/dbraw/zinc/94/28/91/1051942891.db2.gz WQZJPGNPTZLWGR-UHFFFAOYSA-N 1 2 310.353 4.004 20 0 DIADLO CCCc1cc[nH+]c(Nc2ccc(C(=O)N(CC)CC)cc2)c1 ZINC001174061884 1051946742 /nfs/dbraw/zinc/94/67/42/1051946742.db2.gz JJURJFMQGRZWCF-UHFFFAOYSA-N 1 2 311.429 4.260 20 0 DIADLO Cc1cc(N2CCSCC2)ccc1[NH2+]C1CC(C(F)F)C1 ZINC000768670955 1051952097 /nfs/dbraw/zinc/95/20/97/1051952097.db2.gz NZQGZLSVEYIWKJ-UHFFFAOYSA-N 1 2 312.429 4.004 20 0 DIADLO Clc1cc(C[NH+]2CCC(c3cccnc3)CC2)cc(Cl)n1 ZINC000768754102 1051962468 /nfs/dbraw/zinc/96/24/68/1051962468.db2.gz PJLBVTIVOHFMGE-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Fc1ccccc1COC1CC[NH+](C/C(Cl)=C\Cl)CC1 ZINC000768801956 1051963987 /nfs/dbraw/zinc/96/39/87/1051963987.db2.gz FDEIXICXTRTEBP-UKTHLTGXSA-N 1 2 318.219 4.126 20 0 DIADLO Cn1ccc2cc(Nc3ccc(N4CCCCC4)[nH+]c3)ccc21 ZINC001174096321 1051970128 /nfs/dbraw/zinc/97/01/28/1051970128.db2.gz ANCMWKGIAZZARU-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO CC[C@]1(C)CC(=O)N(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC000808137753 1051980411 /nfs/dbraw/zinc/98/04/11/1051980411.db2.gz ARWVSSQCUSSTSE-SJLPKXTDSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@]1(C)CC(=O)N(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC000808137753 1051980425 /nfs/dbraw/zinc/98/04/25/1051980425.db2.gz ARWVSSQCUSSTSE-SJLPKXTDSA-N 1 2 320.864 4.083 20 0 DIADLO CCCc1cc[nH+]c(Nc2ccc(C(=O)N3CCCC3)cc2)c1 ZINC001174068103 1051990770 /nfs/dbraw/zinc/99/07/70/1051990770.db2.gz GEBBFFFYYGHSJO-UHFFFAOYSA-N 1 2 309.413 4.014 20 0 DIADLO Cc1cc[nH+]c(Nc2ccc(C(=O)NC3CCCCC3)cc2)c1 ZINC001174080754 1051996574 /nfs/dbraw/zinc/99/65/74/1051996574.db2.gz JMMIKJMHZUXKJJ-UHFFFAOYSA-N 1 2 309.413 4.196 20 0 DIADLO COc1ccc(Cl)c(C[NH2+]C2(c3nccs3)CCCC2)c1 ZINC000192112306 1051997407 /nfs/dbraw/zinc/99/74/07/1051997407.db2.gz CBRDJUGTOZMLKZ-UHFFFAOYSA-N 1 2 322.861 4.364 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC[C@H](OCC3CC3)C2)cs1 ZINC000494706539 1052001416 /nfs/dbraw/zinc/00/14/16/1052001416.db2.gz FSCFDIKZQPSWFK-KRWDZBQOSA-N 1 2 322.518 4.123 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC[C@H](OCC3CC3)C2)cs1 ZINC000494706539 1052001425 /nfs/dbraw/zinc/00/14/25/1052001425.db2.gz FSCFDIKZQPSWFK-KRWDZBQOSA-N 1 2 322.518 4.123 20 0 DIADLO COc1ccc(Cl)c(C[NH2+][C@H](C)c2c(F)cccc2OC)c1 ZINC000192159159 1052001677 /nfs/dbraw/zinc/00/16/77/1052001677.db2.gz MVYUCXWBEJWLQC-LLVKDONJSA-N 1 2 323.795 4.347 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)CC1CCCCCC1 ZINC000192261463 1052007014 /nfs/dbraw/zinc/00/70/14/1052007014.db2.gz VEXWCHALWVHBQA-UHFFFAOYSA-N 1 2 319.493 4.045 20 0 DIADLO COc1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)cc1Cl ZINC001174152122 1052021030 /nfs/dbraw/zinc/02/10/30/1052021030.db2.gz CQAFQHASXCAMEA-UHFFFAOYSA-N 1 2 308.168 4.393 20 0 DIADLO CC(C)CC[C@H]1CCC[C@@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001217318135 1052021521 /nfs/dbraw/zinc/02/15/21/1052021521.db2.gz HUBXSQLARUKURH-ZBFHGGJFSA-N 1 2 314.433 4.061 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1coc(C2CC2)n1 ZINC000769333768 1052026132 /nfs/dbraw/zinc/02/61/32/1052026132.db2.gz KYXWKCIYUMCWHU-KRWDZBQOSA-N 1 2 312.413 4.288 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000769333768 1052026140 /nfs/dbraw/zinc/02/61/40/1052026140.db2.gz KYXWKCIYUMCWHU-KRWDZBQOSA-N 1 2 312.413 4.288 20 0 DIADLO Cn1cc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000195091288 1052034309 /nfs/dbraw/zinc/03/43/09/1052034309.db2.gz VBZLSQDDICITCI-OAHLLOKOSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1cc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000195091288 1052034316 /nfs/dbraw/zinc/03/43/16/1052034316.db2.gz VBZLSQDDICITCI-OAHLLOKOSA-N 1 2 310.228 4.064 20 0 DIADLO CCCN(C)c1ccc(C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000195205247 1052041232 /nfs/dbraw/zinc/04/12/32/1052041232.db2.gz GYCNGJGNIHPTQX-UHFFFAOYSA-N 1 2 311.429 4.105 20 0 DIADLO COc1ncccc1C[N@H+](C)[C@H](C)c1sc(C(C)C)nc1C ZINC000193450792 1052044847 /nfs/dbraw/zinc/04/48/47/1052044847.db2.gz VMVUYXUALBBJTK-CYBMUJFWSA-N 1 2 319.474 4.172 20 0 DIADLO COc1ncccc1C[N@@H+](C)[C@H](C)c1sc(C(C)C)nc1C ZINC000193450792 1052044858 /nfs/dbraw/zinc/04/48/58/1052044858.db2.gz VMVUYXUALBBJTK-CYBMUJFWSA-N 1 2 319.474 4.172 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1cccc(C(=O)NC2CCCC2)c1 ZINC001174197650 1052045180 /nfs/dbraw/zinc/04/51/80/1052045180.db2.gz QSMGCMSQTIZKAY-UHFFFAOYSA-N 1 2 323.440 4.368 20 0 DIADLO CC(C)(C)n1cc(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)cn1 ZINC000769427176 1052045377 /nfs/dbraw/zinc/04/53/77/1052045377.db2.gz HTVFNUYQVVMFOK-KRWDZBQOSA-N 1 2 319.399 4.253 20 0 DIADLO CC(C)(C)n1cc(C[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)cn1 ZINC000769427176 1052045389 /nfs/dbraw/zinc/04/53/89/1052045389.db2.gz HTVFNUYQVVMFOK-KRWDZBQOSA-N 1 2 319.399 4.253 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[N@@H+]1CCC(=O)[C@H](C)C1 ZINC000670088178 1052046217 /nfs/dbraw/zinc/04/62/17/1052046217.db2.gz PUQQCAUHNFGMLF-OAHLLOKOSA-N 1 2 311.425 4.038 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[N@H+]1CCC(=O)[C@H](C)C1 ZINC000670088178 1052046226 /nfs/dbraw/zinc/04/62/26/1052046226.db2.gz PUQQCAUHNFGMLF-OAHLLOKOSA-N 1 2 311.425 4.038 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458695 1052059740 /nfs/dbraw/zinc/05/97/40/1052059740.db2.gz YNHISGJGRKFUPH-SJCJKPOMSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458695 1052059752 /nfs/dbraw/zinc/05/97/52/1052059752.db2.gz YNHISGJGRKFUPH-SJCJKPOMSA-N 1 2 300.377 4.274 20 0 DIADLO O=C(CC1CCCC1)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000195623386 1052066744 /nfs/dbraw/zinc/06/67/44/1052066744.db2.gz WOKOCGCMJGFZAE-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@@H+](Cc1cncc3ccccc31)CC2 ZINC000769534680 1052078076 /nfs/dbraw/zinc/07/80/76/1052078076.db2.gz YLOPSHZCMMJRLU-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@H+](Cc1cncc3ccccc31)CC2 ZINC000769534680 1052078087 /nfs/dbraw/zinc/07/80/87/1052078087.db2.gz YLOPSHZCMMJRLU-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO COc1ccc2nc(/C=C/c3cccc4[nH+]ccn43)sc2c1 ZINC000769607460 1052086976 /nfs/dbraw/zinc/08/69/76/1052086976.db2.gz KVPZBABBUJTEAS-VMPITWQZSA-N 1 2 307.378 4.123 20 0 DIADLO c1cc(C[NH2+]Cc2nc3c(s2)C[C@H](c2ccccc2)CC3)co1 ZINC000769689990 1052093388 /nfs/dbraw/zinc/09/33/88/1052093388.db2.gz RKBFRRHFTIJBGS-MRXNPFEDSA-N 1 2 324.449 4.298 20 0 DIADLO Cn1nc(C(F)(F)F)cc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001174325138 1052099746 /nfs/dbraw/zinc/09/97/46/1052099746.db2.gz BLPTXJBKUTYOAY-UHFFFAOYSA-N 1 2 324.350 4.173 20 0 DIADLO Cn1c[nH+]c2ccc(-n3c4ccccc4c4cccc(N)c43)cc21 ZINC001174350724 1052114445 /nfs/dbraw/zinc/11/44/45/1052114445.db2.gz SLTSSLZHRIPWLX-UHFFFAOYSA-N 1 2 312.376 4.253 20 0 DIADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1csc(-c2ccco2)n1 ZINC000769870249 1052122530 /nfs/dbraw/zinc/12/25/30/1052122530.db2.gz FNMNJTKNLPEZJH-SNVBAGLBSA-N 1 2 317.414 4.113 20 0 DIADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1coc(-c2cccs2)n1 ZINC000769873962 1052124041 /nfs/dbraw/zinc/12/40/41/1052124041.db2.gz JEMQEDMKOIRJAK-SNVBAGLBSA-N 1 2 317.414 4.113 20 0 DIADLO CC(C)c1ccc(-c2nnc(C[NH2+]Cc3ccccc3)o2)cc1 ZINC001217719350 1052125183 /nfs/dbraw/zinc/12/51/83/1052125183.db2.gz POKAWALPRQXOBQ-UHFFFAOYSA-N 1 2 307.397 4.150 20 0 DIADLO FC(F)(F)c1cc(Nc2cc(Cl)c3[nH+]ccn3c2)ccn1 ZINC001174363000 1052128865 /nfs/dbraw/zinc/12/88/65/1052128865.db2.gz YWFWLOGYCWYMEW-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO c1ccc([C@H]2CCC[C@@H](c3nnc(CC4CCCC4)o3)[NH2+]2)cc1 ZINC001217750730 1052132715 /nfs/dbraw/zinc/13/27/15/1052132715.db2.gz WGUALULMVPBALD-SJORKVTESA-N 1 2 311.429 4.358 20 0 DIADLO Cn1cc(-c2ccc(Nc3cc(Cl)c4[nH+]ccn4c3)cc2)cn1 ZINC001174377940 1052135807 /nfs/dbraw/zinc/13/58/07/1052135807.db2.gz KFLLHIBLYPWKDK-UHFFFAOYSA-N 1 2 323.787 4.132 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc3c(c2)[nH+]cn3C(C)C)n1 ZINC001174380345 1052138619 /nfs/dbraw/zinc/13/86/19/1052138619.db2.gz BEHBGLQVEBPMQP-UHFFFAOYSA-N 1 2 305.385 4.317 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ncc(Cl)cc3O)ccc21 ZINC001174382054 1052140242 /nfs/dbraw/zinc/14/02/42/1052140242.db2.gz VXBGXEOXZKCZRZ-UHFFFAOYSA-N 1 2 302.765 4.115 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4nsnc4c3)ccc21 ZINC001174381508 1052140364 /nfs/dbraw/zinc/14/03/64/1052140364.db2.gz MDKWPCAIIAJMGQ-UHFFFAOYSA-N 1 2 309.398 4.366 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4nsnc43)ccc21 ZINC001174381799 1052140536 /nfs/dbraw/zinc/14/05/36/1052140536.db2.gz UGCVMRNFHZWAJL-UHFFFAOYSA-N 1 2 309.398 4.366 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4cnn(C)c43)ccc21 ZINC001174381704 1052140589 /nfs/dbraw/zinc/14/05/89/1052140589.db2.gz PEGPHKGLYKSMDW-UHFFFAOYSA-N 1 2 305.385 4.248 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3c(O)cc(F)cc3F)ccc21 ZINC001174381528 1052141040 /nfs/dbraw/zinc/14/10/40/1052141040.db2.gz MODJIXZKMJBIRR-UHFFFAOYSA-N 1 2 303.312 4.345 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccnc(Cl)c3O)ccc21 ZINC001174382174 1052141086 /nfs/dbraw/zinc/14/10/86/1052141086.db2.gz CEYFDVWMPLMEAI-UHFFFAOYSA-N 1 2 302.765 4.115 20 0 DIADLO COc1cc(Cl)ncc1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174382222 1052141143 /nfs/dbraw/zinc/14/11/43/1052141143.db2.gz FJBKBIVGYPULFM-UHFFFAOYSA-N 1 2 316.792 4.418 20 0 DIADLO COC(=O)Cc1ccccc1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174381599 1052141499 /nfs/dbraw/zinc/14/14/99/1052141499.db2.gz OJLZZWSFRGZESB-UHFFFAOYSA-N 1 2 323.396 4.076 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3snc4cccnc43)ccc21 ZINC001174382409 1052142842 /nfs/dbraw/zinc/14/28/42/1052142842.db2.gz ONKQNNBVPQIXFW-UHFFFAOYSA-N 1 2 309.398 4.366 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccnc(OC(F)F)c3)ccc21 ZINC001174382608 1052143659 /nfs/dbraw/zinc/14/36/59/1052143659.db2.gz YNHSDNRLJMKCQT-UHFFFAOYSA-N 1 2 318.327 4.357 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4c3OCC[C@H]4O)ccc21 ZINC001174385726 1052144439 /nfs/dbraw/zinc/14/44/39/1052144439.db2.gz VWFBPTVZLHMCPL-GOSISDBHSA-N 1 2 323.396 4.177 20 0 DIADLO CC(C)c1ccc2c(c1)CCCN2C(=O)c1cccc2[nH+]ccn21 ZINC000770070509 1052148110 /nfs/dbraw/zinc/14/81/10/1052148110.db2.gz OQIGZCJHJHTXOJ-UHFFFAOYSA-N 1 2 319.408 4.051 20 0 DIADLO C[C@@H]1CN(c2ccc(Nc3ccc4occc4c3)c[nH+]2)C[C@H](C)O1 ZINC001174419886 1052150269 /nfs/dbraw/zinc/15/02/69/1052150269.db2.gz VLPXDJIANXGFEM-OKILXGFUSA-N 1 2 323.396 4.185 20 0 DIADLO Cc1ccc(Nc2cc[nH+]c3[nH]ccc32)cc1Br ZINC001174412320 1052165517 /nfs/dbraw/zinc/16/55/17/1052165517.db2.gz QTAVOBRWTXUPJS-UHFFFAOYSA-N 1 2 302.175 4.329 20 0 DIADLO C[C@H]([N@H+](C)Cn1nc(-c2cccs2)oc1=S)C(C)(C)C ZINC000914568448 1052169219 /nfs/dbraw/zinc/16/92/19/1052169219.db2.gz JRNKWIKHPOABQZ-JTQLQIEISA-N 1 2 311.476 4.258 20 0 DIADLO C[C@H]([N@@H+](C)Cn1nc(-c2cccs2)oc1=S)C(C)(C)C ZINC000914568448 1052169227 /nfs/dbraw/zinc/16/92/27/1052169227.db2.gz JRNKWIKHPOABQZ-JTQLQIEISA-N 1 2 311.476 4.258 20 0 DIADLO CCSc1nn(C[N@H+](C)[C@@H](C)C(C)(C)C)c(=S)s1 ZINC000914568998 1052169746 /nfs/dbraw/zinc/16/97/46/1052169746.db2.gz RAXXWNLPDIJMMI-VIFPVBQESA-N 1 2 305.538 4.110 20 0 DIADLO CCSc1nn(C[N@@H+](C)[C@@H](C)C(C)(C)C)c(=S)s1 ZINC000914568998 1052169750 /nfs/dbraw/zinc/16/97/50/1052169750.db2.gz RAXXWNLPDIJMMI-VIFPVBQESA-N 1 2 305.538 4.110 20 0 DIADLO c1c[nH+]c(N2CCCC2)c(Nc2cccc(N3CCCC3)c2)c1 ZINC001174486835 1052173031 /nfs/dbraw/zinc/17/30/31/1052173031.db2.gz UBSYABADPMAUDH-UHFFFAOYSA-N 1 2 308.429 4.026 20 0 DIADLO FC1(F)C[NH2+]CC[C@@H]1Oc1c(Cl)cc(Cl)cc1Cl ZINC001218006594 1052183877 /nfs/dbraw/zinc/18/38/77/1052183877.db2.gz MFSFAAZMFPIRKP-VIFPVBQESA-N 1 2 316.562 4.023 20 0 DIADLO C[C@H]1C[N@H+](Cc2sccc2Cl)C[C@@H](c2ccccc2)O1 ZINC000494948138 1052177191 /nfs/dbraw/zinc/17/71/91/1052177191.db2.gz LAIVIKYAKRALHV-WFASDCNBSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2sccc2Cl)C[C@@H](c2ccccc2)O1 ZINC000494948138 1052177198 /nfs/dbraw/zinc/17/71/98/1052177198.db2.gz LAIVIKYAKRALHV-WFASDCNBSA-N 1 2 307.846 4.364 20 0 DIADLO FC1(F)C[NH2+]CC[C@@H]1Oc1cc(Cl)c(Cl)c(Cl)c1 ZINC001218012439 1052185334 /nfs/dbraw/zinc/18/53/34/1052185334.db2.gz PUMOVFHCTCQQIU-VIFPVBQESA-N 1 2 316.562 4.023 20 0 DIADLO Cc1sccc1Nc1cc(Br)cn2cc[nH+]c12 ZINC001174458906 1052179716 /nfs/dbraw/zinc/17/97/16/1052179716.db2.gz SMGXSCNJOVUVNP-UHFFFAOYSA-N 1 2 308.204 4.210 20 0 DIADLO c1n[nH]c([C@H]([NH2+]CCC2=CCCCCC2)C2CCCCC2)n1 ZINC000494939910 1052180060 /nfs/dbraw/zinc/18/00/60/1052180060.db2.gz LMCZDUTVBIYPTJ-QGZVFWFLSA-N 1 2 302.466 4.296 20 0 DIADLO Cc1ccc(C)c([C@@H]2C[N@H+](C/C=C/c3ccncc3)[C@H](C)CO2)c1 ZINC000494960604 1052183810 /nfs/dbraw/zinc/18/38/10/1052183810.db2.gz YARQDVYVLOPGCG-ATBPXCTNSA-N 1 2 322.452 4.174 20 0 DIADLO Cc1ccc(C)c([C@@H]2C[N@@H+](C/C=C/c3ccncc3)[C@H](C)CO2)c1 ZINC000494960604 1052183818 /nfs/dbraw/zinc/18/38/18/1052183818.db2.gz YARQDVYVLOPGCG-ATBPXCTNSA-N 1 2 322.452 4.174 20 0 DIADLO FC1(F)C[NH2+]CC[C@H]1Oc1c(Cl)ccc(Cl)c1Cl ZINC001218012544 1052185103 /nfs/dbraw/zinc/18/51/03/1052185103.db2.gz RGOVURQHCHJKTN-MRVPVSSYSA-N 1 2 316.562 4.023 20 0 DIADLO C[C@H](c1ccccc1)c1ccccc1O[C@@H]1CC[NH2+]CC1(F)F ZINC001218011436 1052185607 /nfs/dbraw/zinc/18/56/07/1052185607.db2.gz HOQUCNFZEFPTAO-RDTXWAMCSA-N 1 2 317.379 4.214 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+](C)Cc1cccc(C)n1 ZINC000494964413 1052186712 /nfs/dbraw/zinc/18/67/12/1052186712.db2.gz PDFPJSMLYJRRON-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+](C)Cc1cccc(C)n1 ZINC000494964413 1052186721 /nfs/dbraw/zinc/18/67/21/1052186721.db2.gz PDFPJSMLYJRRON-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+][C@@H](Cc1ccccc1)c1ncco1)CC2 ZINC000653911684 1052192573 /nfs/dbraw/zinc/19/25/73/1052192573.db2.gz JHSPHLZJBZYJSP-MOPGFXCFSA-N 1 2 322.383 4.375 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000494992126 1052194476 /nfs/dbraw/zinc/19/44/76/1052194476.db2.gz FZHAILMVEHBRCC-UHFFFAOYSA-N 1 2 319.754 4.433 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000494992126 1052194481 /nfs/dbraw/zinc/19/44/81/1052194481.db2.gz FZHAILMVEHBRCC-UHFFFAOYSA-N 1 2 319.754 4.433 20 0 DIADLO Nc1cc[nH+]c(O[C@@H](c2ccccc2)c2ccc(Cl)cc2)c1 ZINC001218214329 1052209185 /nfs/dbraw/zinc/20/91/85/1052209185.db2.gz NPOVTZDJGGFPSM-SFHVURJKSA-N 1 2 310.784 4.486 20 0 DIADLO C[C@@H](Oc1ccc[nH+]c1N)c1cc2cccc(F)c2nc1Cl ZINC001218222598 1052210726 /nfs/dbraw/zinc/21/07/26/1052210726.db2.gz OKKQAPNHELRMDV-SECBINFHSA-N 1 2 317.751 4.145 20 0 DIADLO Cc1cc(-c2ccccc2)ccc1O[C@@H]1C[NH2+]CC(F)(F)C1 ZINC001218277289 1052216389 /nfs/dbraw/zinc/21/63/89/1052216389.db2.gz FJODMJDMFMDPPQ-INIZCTEOSA-N 1 2 303.352 4.038 20 0 DIADLO Nc1[nH+]cccc1O[C@@H](/C=C/c1ccccc1)c1ccccc1 ZINC001218354766 1052230510 /nfs/dbraw/zinc/23/05/10/1052230510.db2.gz WQSLWABIWZROLQ-JKGDOXCYSA-N 1 2 302.377 4.497 20 0 DIADLO COc1cccc(C[NH2+]C2(c3nccs3)CCCC2)c1Cl ZINC000660089969 1052258853 /nfs/dbraw/zinc/25/88/53/1052258853.db2.gz LESCAXBEXCKDJJ-UHFFFAOYSA-N 1 2 322.861 4.364 20 0 DIADLO CCc1cnc(C[NH2+][C@H](CC(F)(F)F)c2ccccc2)s1 ZINC000230141617 1052263819 /nfs/dbraw/zinc/26/38/19/1052263819.db2.gz JQWBUMKOSTWQTM-CYBMUJFWSA-N 1 2 314.376 4.489 20 0 DIADLO CCc1ccc2c(c1)CCN2C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001219009769 1052268249 /nfs/dbraw/zinc/26/82/49/1052268249.db2.gz MTFKZYILPPVTAX-UHFFFAOYSA-N 1 2 309.413 4.164 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC2CCCCCCC2)c(C)[nH+]1 ZINC001219009489 1052268275 /nfs/dbraw/zinc/26/82/75/1052268275.db2.gz BOEOAPHMVTXDER-UHFFFAOYSA-N 1 2 303.450 4.489 20 0 DIADLO Cc1cc(C)c(NC(=O)NC[C@H]2CCCC(C)(C)C2)c(C)[nH+]1 ZINC001219009580 1052268463 /nfs/dbraw/zinc/26/84/63/1052268463.db2.gz FXXMSPANTKTQNK-HNNXBMFYSA-N 1 2 303.450 4.345 20 0 DIADLO CCCn1c[nH+]cc1CNc1cccc(OCc2ccccc2)c1 ZINC000310449734 1052268543 /nfs/dbraw/zinc/26/85/43/1052268543.db2.gz SAHWHFKKFBYJTB-UHFFFAOYSA-N 1 2 321.424 4.484 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1ccc(Cl)cc1F ZINC000230942623 1052275827 /nfs/dbraw/zinc/27/58/27/1052275827.db2.gz HJEIZHHEXVTCTQ-UHFFFAOYSA-N 1 2 314.187 4.431 20 0 DIADLO Cc1cc(F)ccc1-c1noc(-c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000761963000 1052278882 /nfs/dbraw/zinc/27/88/82/1052278882.db2.gz OSKJJRZDPVCVEU-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CN(C(=O)Nc1ccc2[nH+]ccn2c1)[C@@H]1CCC[C@H]1C(C)(C)C ZINC001219557064 1052293525 /nfs/dbraw/zinc/29/35/25/1052293525.db2.gz PDVHUIFOKQLNBA-HUUCEWRRSA-N 1 2 314.433 4.013 20 0 DIADLO CN(C)c1ccc(NCc2ccc(-c3ccccc3)s2)c[nH+]1 ZINC000315119619 1052331075 /nfs/dbraw/zinc/33/10/75/1052331075.db2.gz ACVZHOSDHHLQAZ-UHFFFAOYSA-N 1 2 309.438 4.488 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+][C@H](C)c1c(F)cccc1F ZINC000495456011 1052356026 /nfs/dbraw/zinc/35/60/26/1052356026.db2.gz VOKUZLYSPUVOTC-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO COc1cccc(C(F)(F)F)c1CNc1cc2cc[nH]c2c[nH+]1 ZINC001168489860 1052377536 /nfs/dbraw/zinc/37/75/36/1052377536.db2.gz HKZGHHFBJMNOSE-UHFFFAOYSA-N 1 2 321.302 4.202 20 0 DIADLO S=c1n2ccccc2nn1C[N@@H+]1CCCC[C@@H]1c1ccccc1 ZINC000762467565 1052387912 /nfs/dbraw/zinc/38/79/12/1052387912.db2.gz ROXVUIGIRCXGIC-MRXNPFEDSA-N 1 2 324.453 4.050 20 0 DIADLO S=c1n2ccccc2nn1C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000762467565 1052387917 /nfs/dbraw/zinc/38/79/17/1052387917.db2.gz ROXVUIGIRCXGIC-MRXNPFEDSA-N 1 2 324.453 4.050 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2ccc(Cl)nc2)c2ccccn2)c1 ZINC000153563995 1052395384 /nfs/dbraw/zinc/39/53/84/1052395384.db2.gz PSNUBGWXIDXMMX-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1cc(Cl)ccc1F ZINC000234917064 1052403558 /nfs/dbraw/zinc/40/35/58/1052403558.db2.gz UBUHWQMGCGVVNX-UHFFFAOYSA-N 1 2 314.187 4.431 20 0 DIADLO CCCc1cc(C(=O)Nc2ccc(C)[nH+]c2N(C)C)sc1C ZINC001127366078 1052413626 /nfs/dbraw/zinc/41/36/26/1052413626.db2.gz VPYWHWVLWQISFN-UHFFFAOYSA-N 1 2 317.458 4.031 20 0 DIADLO CCCOc1ccc(CNc2ccc(N(CC)CC)[nH+]c2)cc1 ZINC000319756140 1052432062 /nfs/dbraw/zinc/43/20/62/1052432062.db2.gz VIXACTGUWMEHTB-UHFFFAOYSA-N 1 2 313.445 4.329 20 0 DIADLO Cc1cccc(Nc2ccc(N(C)Cc3ccccc3)nc2)[nH+]1 ZINC001203513351 1052457817 /nfs/dbraw/zinc/45/78/17/1052457817.db2.gz KAQDVDVRTTWWOV-UHFFFAOYSA-N 1 2 304.397 4.165 20 0 DIADLO CO[C@H]1CCC[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC001235589898 1052486667 /nfs/dbraw/zinc/48/66/67/1052486667.db2.gz FUHSUYJKKIPPTE-JTQLQIEISA-N 1 2 308.636 4.258 20 0 DIADLO CO[C@H]1CCC[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC001235589898 1052486670 /nfs/dbraw/zinc/48/66/70/1052486670.db2.gz FUHSUYJKKIPPTE-JTQLQIEISA-N 1 2 308.636 4.258 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1cc(C)c(C)o1)c1nnc2n1CCCCC2 ZINC000282113740 1052489130 /nfs/dbraw/zinc/48/91/30/1052489130.db2.gz JDTBMPVEWCZEQK-HIFRSBDPSA-N 1 2 316.449 4.016 20 0 DIADLO O=C(c1ccccc1)C1CC[NH+](Cc2cccc(F)c2F)CC1 ZINC000055102416 1052525671 /nfs/dbraw/zinc/52/56/71/1052525671.db2.gz MCZYMDJQMKZMQS-UHFFFAOYSA-N 1 2 315.363 4.060 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1cc(C)n(C)n1 ZINC000282121656 1052527438 /nfs/dbraw/zinc/52/74/38/1052527438.db2.gz JONYAOQYOHZHAW-HOTGVXAUSA-N 1 2 315.461 4.065 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1ccc(-n3cccn3)cc1)C2 ZINC000347455400 1052527519 /nfs/dbraw/zinc/52/75/19/1052527519.db2.gz NSVVSLCWGYNISH-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1ccc(-n3cccn3)cc1)C2 ZINC000347455400 1052527522 /nfs/dbraw/zinc/52/75/22/1052527522.db2.gz NSVVSLCWGYNISH-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO C[C@@H](c1nc2ccccc2c(=O)[nH]1)[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000916152345 1052594164 /nfs/dbraw/zinc/59/41/64/1052594164.db2.gz PQUKVFQMJMKOIT-KBPBESRZSA-N 1 2 319.408 4.016 20 0 DIADLO C[C@@H](c1nc2ccccc2c(=O)[nH]1)[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000916152345 1052594172 /nfs/dbraw/zinc/59/41/72/1052594172.db2.gz PQUKVFQMJMKOIT-KBPBESRZSA-N 1 2 319.408 4.016 20 0 DIADLO Cc1ccc(N2CCC(OCc3cc(C)[nH+]c(C)c3)CC2)cc1 ZINC001223420156 1052599219 /nfs/dbraw/zinc/59/92/19/1052599219.db2.gz ILNVZKNGLUWWLT-UHFFFAOYSA-N 1 2 310.441 4.192 20 0 DIADLO COc1ccc(OC(C)C)c(COCc2cc(C)[nH+]c(C)c2)c1 ZINC001223422171 1052599458 /nfs/dbraw/zinc/59/94/58/1052599458.db2.gz UJPBIMWZGAOWGD-UHFFFAOYSA-N 1 2 315.413 4.211 20 0 DIADLO Cc1cc(CO[C@@H](c2ccccc2)C2CCOCC2)cc(C)[nH+]1 ZINC001223424110 1052600431 /nfs/dbraw/zinc/60/04/31/1052600431.db2.gz HDBGTBQNDRRXRF-FQEVSTJZSA-N 1 2 311.425 4.383 20 0 DIADLO Cc1ccc2[nH+]c(CSc3ccc(N)cc3Cl)cn2c1 ZINC000037204655 1052612346 /nfs/dbraw/zinc/61/23/46/1052612346.db2.gz YSOVERHBBBGVRH-UHFFFAOYSA-N 1 2 303.818 4.171 20 0 DIADLO Cc1nc(SCc2c[nH+]c(N(C)C)c3ccccc23)oc1C ZINC000916552031 1052614564 /nfs/dbraw/zinc/61/45/64/1052614564.db2.gz XJGSRRRIYXNVPC-UHFFFAOYSA-N 1 2 313.426 4.198 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(Cl)c(F)c2)nc2ccccc12 ZINC001649033460 1052623393 /nfs/dbraw/zinc/62/33/93/1052623393.db2.gz NQOXPVFXPMVRPW-UHFFFAOYSA-N 1 2 315.779 4.021 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1cncc2ccccc21 ZINC000763411998 1052625706 /nfs/dbraw/zinc/62/57/06/1052625706.db2.gz MSLNOTLFOYYBNK-UHFFFAOYSA-N 1 2 302.381 4.217 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1cnc(Cl)c(C)c1 ZINC000763412121 1052625715 /nfs/dbraw/zinc/62/57/15/1052625715.db2.gz NXPUFWADOQMQAM-UHFFFAOYSA-N 1 2 300.793 4.025 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H]2CCc3c2cc(F)cc3F)cs1 ZINC000154680987 1052638324 /nfs/dbraw/zinc/63/83/24/1052638324.db2.gz OLIDNKYYLKKEAY-OTYXRUKQSA-N 1 2 308.397 4.322 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1csc(-c2ccccn2)n1 ZINC000124293871 1052638795 /nfs/dbraw/zinc/63/87/95/1052638795.db2.gz XEMSMNYWYSUCAH-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1csc(-c2ccccn2)n1 ZINC000124293871 1052638803 /nfs/dbraw/zinc/63/88/03/1052638803.db2.gz XEMSMNYWYSUCAH-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H]2CCc3c2cc(F)cc3F)cs1 ZINC000154680765 1052639212 /nfs/dbraw/zinc/63/92/12/1052639212.db2.gz OLIDNKYYLKKEAY-YMTOWFKASA-N 1 2 308.397 4.322 20 0 DIADLO CC(C)c1ccc([C@H]2CCC[N@@H+]2Cc2nc(C3CC3)no2)cc1 ZINC000125467557 1052649339 /nfs/dbraw/zinc/64/93/39/1052649339.db2.gz XBZKLNFCDCWLNE-QGZVFWFLSA-N 1 2 311.429 4.408 20 0 DIADLO CC(C)c1ccc([C@H]2CCC[N@H+]2Cc2nc(C3CC3)no2)cc1 ZINC000125467557 1052649345 /nfs/dbraw/zinc/64/93/45/1052649345.db2.gz XBZKLNFCDCWLNE-QGZVFWFLSA-N 1 2 311.429 4.408 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000125586033 1052650535 /nfs/dbraw/zinc/65/05/35/1052650535.db2.gz SVTLAJYPDFOUHP-SFHVURJKSA-N 1 2 317.454 4.109 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000125586033 1052650539 /nfs/dbraw/zinc/65/05/39/1052650539.db2.gz SVTLAJYPDFOUHP-SFHVURJKSA-N 1 2 317.454 4.109 20 0 DIADLO FC(F)(F)[C@@H]1CCC[C@H](Nc2ccc(N3CCCC3)[nH+]c2)C1 ZINC000125978136 1052661901 /nfs/dbraw/zinc/66/19/01/1052661901.db2.gz GUODZZYAFWUADY-OLZOCXBDSA-N 1 2 313.367 4.215 20 0 DIADLO Cl/C=C/C[N@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000917086826 1052697136 /nfs/dbraw/zinc/69/71/36/1052697136.db2.gz LMACNDJWZALAOE-DRQXCOHGSA-N 1 2 300.627 4.339 20 0 DIADLO Cl/C=C/C[N@@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000917086826 1052697128 /nfs/dbraw/zinc/69/71/28/1052697128.db2.gz LMACNDJWZALAOE-DRQXCOHGSA-N 1 2 300.627 4.339 20 0 DIADLO Cl/C=C\C[N@@H+]1CCC[C@H]1c1ccc(Br)cc1 ZINC000917086888 1052697409 /nfs/dbraw/zinc/69/74/09/1052697409.db2.gz LMACNDJWZALAOE-YFBARTHOSA-N 1 2 300.627 4.339 20 0 DIADLO Cl/C=C\C[N@H+]1CCC[C@H]1c1ccc(Br)cc1 ZINC000917086888 1052697412 /nfs/dbraw/zinc/69/74/12/1052697412.db2.gz LMACNDJWZALAOE-YFBARTHOSA-N 1 2 300.627 4.339 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000127630950 1052700837 /nfs/dbraw/zinc/70/08/37/1052700837.db2.gz NITSEMNJXPLZMV-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000127630950 1052700841 /nfs/dbraw/zinc/70/08/41/1052700841.db2.gz NITSEMNJXPLZMV-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO Cc1ccccc1C(N)=[NH+]OCc1ccccc1C(F)(F)F ZINC000917392621 1052723710 /nfs/dbraw/zinc/72/37/10/1052723710.db2.gz FKSZDHJEOHTUTQ-UHFFFAOYSA-N 1 2 308.303 4.061 20 0 DIADLO Cc1nn(C[N@H+](Cc2ccccc2)[C@H](C)C2CC2)c(=S)s1 ZINC000917438533 1052727102 /nfs/dbraw/zinc/72/71/02/1052727102.db2.gz YDFQIQIHKYMIDD-GFCCVEGCSA-N 1 2 319.499 4.241 20 0 DIADLO Cc1nn(C[N@@H+](Cc2ccccc2)[C@H](C)C2CC2)c(=S)s1 ZINC000917438533 1052727104 /nfs/dbraw/zinc/72/71/04/1052727104.db2.gz YDFQIQIHKYMIDD-GFCCVEGCSA-N 1 2 319.499 4.241 20 0 DIADLO CCC1CCC([N@H+](Cn2nc(C)sc2=S)C2CC2)CC1 ZINC000917440313 1052727858 /nfs/dbraw/zinc/72/78/58/1052727858.db2.gz RBQSMPPHLBZLJP-UHFFFAOYSA-N 1 2 311.520 4.373 20 0 DIADLO CCC1CCC([N@@H+](Cn2nc(C)sc2=S)C2CC2)CC1 ZINC000917440313 1052727860 /nfs/dbraw/zinc/72/78/60/1052727860.db2.gz RBQSMPPHLBZLJP-UHFFFAOYSA-N 1 2 311.520 4.373 20 0 DIADLO CCCC[N@H+](CC)Cn1ncn([C@H](C)c2ccccc2)c1=S ZINC000917428969 1052728658 /nfs/dbraw/zinc/72/86/58/1052728658.db2.gz OMQDXRKICIFFHW-OAHLLOKOSA-N 1 2 318.490 4.103 20 0 DIADLO CCCC[N@@H+](CC)Cn1ncn([C@H](C)c2ccccc2)c1=S ZINC000917428969 1052728662 /nfs/dbraw/zinc/72/86/62/1052728662.db2.gz OMQDXRKICIFFHW-OAHLLOKOSA-N 1 2 318.490 4.103 20 0 DIADLO CC[N@H+](Cn1[nH]c(-c2ccc(C)cc2)nc1=S)C1CCCC1 ZINC000917465674 1052730998 /nfs/dbraw/zinc/73/09/98/1052730998.db2.gz NUKJTOZMNCXWFD-UHFFFAOYSA-N 1 2 316.474 4.138 20 0 DIADLO CC[N@@H+](Cn1[nH]c(-c2ccc(C)cc2)nc1=S)C1CCCC1 ZINC000917465674 1052731003 /nfs/dbraw/zinc/73/10/03/1052731003.db2.gz NUKJTOZMNCXWFD-UHFFFAOYSA-N 1 2 316.474 4.138 20 0 DIADLO O=C(C=C1CCCC1)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000917676317 1052752413 /nfs/dbraw/zinc/75/24/13/1052752413.db2.gz PVEXMACKNDTDDT-UHFFFAOYSA-N 1 2 321.424 4.325 20 0 DIADLO O=C(c1ccsc1)[C@H](Oc1cc[nH+]cc1)c1ccsc1 ZINC001225291716 1052769828 /nfs/dbraw/zinc/76/98/28/1052769828.db2.gz WYMQHEVZKIJVGE-OAHLLOKOSA-N 1 2 301.392 4.208 20 0 DIADLO Cc1cc([C@@H]2C[N@H+](CCCCC(F)(F)F)CCO2)ccc1F ZINC000129082223 1052774202 /nfs/dbraw/zinc/77/42/02/1052774202.db2.gz OXFQXJCTLHACCZ-HNNXBMFYSA-N 1 2 319.342 4.240 20 0 DIADLO Cc1cc([C@@H]2C[N@@H+](CCCCC(F)(F)F)CCO2)ccc1F ZINC000129082223 1052774211 /nfs/dbraw/zinc/77/42/11/1052774211.db2.gz OXFQXJCTLHACCZ-HNNXBMFYSA-N 1 2 319.342 4.240 20 0 DIADLO O=C(/C=C\c1ccccc1Cl)Nc1ccccc1-n1cc[nH+]c1 ZINC000918066241 1052777280 /nfs/dbraw/zinc/77/72/80/1052777280.db2.gz QFOJDQUZWKIQCI-KTKRTIGZSA-N 1 2 323.783 4.178 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)CC(=O)Nc1cccc2ccccc21 ZINC000069069839 1052779014 /nfs/dbraw/zinc/77/90/14/1052779014.db2.gz DMPVMHBSBPFXCP-AWEZNQCLSA-N 1 2 308.381 4.064 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)CC(=O)Nc1cccc2ccccc21 ZINC000069069839 1052779017 /nfs/dbraw/zinc/77/90/17/1052779017.db2.gz DMPVMHBSBPFXCP-AWEZNQCLSA-N 1 2 308.381 4.064 20 0 DIADLO CCC(CC)[N@H+](Cn1c(=S)ncn1-c1ccccc1)C1CC1 ZINC000918179058 1052786777 /nfs/dbraw/zinc/78/67/77/1052786777.db2.gz OQRBXBCPNRPEMR-UHFFFAOYSA-N 1 2 316.474 4.014 20 0 DIADLO CCC(CC)[N@@H+](Cn1c(=S)ncn1-c1ccccc1)C1CC1 ZINC000918179058 1052786779 /nfs/dbraw/zinc/78/67/79/1052786779.db2.gz OQRBXBCPNRPEMR-UHFFFAOYSA-N 1 2 316.474 4.014 20 0 DIADLO Clc1cc2cccnc2c(OC2C[NH+](Cc3ccccc3)C2)c1 ZINC001225484915 1052795025 /nfs/dbraw/zinc/79/50/25/1052795025.db2.gz FYVZWUIQYOOGIH-UHFFFAOYSA-N 1 2 324.811 4.151 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)ccc1Cl ZINC000129686894 1052803607 /nfs/dbraw/zinc/80/36/07/1052803607.db2.gz QLSPGLKQIJJMIN-QGZVFWFLSA-N 1 2 311.816 4.251 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@@H](C)c2ccncc2F)c2ccccn2)cc1 ZINC000556245062 1052825928 /nfs/dbraw/zinc/82/59/28/1052825928.db2.gz MAASNHIPWAJJSM-MGPUTAFESA-N 1 2 321.399 4.364 20 0 DIADLO CC[C@H]1CCCC[C@H]1c1noc(-c2cc(-n3cc[nH+]c3)ccn2)n1 ZINC000556386072 1052845142 /nfs/dbraw/zinc/84/51/42/1052845142.db2.gz GTBZBFAOEJPJTG-DZGCQCFKSA-N 1 2 323.400 4.001 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(Oc2ccccc2)cn1)c1ccn(C)n1 ZINC000556890039 1052894498 /nfs/dbraw/zinc/89/44/98/1052894498.db2.gz BRUKXUZZBOYWHP-HUUCEWRRSA-N 1 2 322.412 4.019 20 0 DIADLO CCCOc1c(Cl)cc(C[N@@H+]2CCC[C@H]2CF)cc1OC ZINC000556950782 1052903912 /nfs/dbraw/zinc/90/39/12/1052903912.db2.gz RBNGZWYTOAHYEP-ZDUSSCGKSA-N 1 2 315.816 4.071 20 0 DIADLO CCCOc1c(Cl)cc(C[N@H+]2CCC[C@H]2CF)cc1OC ZINC000556950782 1052903914 /nfs/dbraw/zinc/90/39/14/1052903914.db2.gz RBNGZWYTOAHYEP-ZDUSSCGKSA-N 1 2 315.816 4.071 20 0 DIADLO CC1(C)C[N@H+](Cc2ncc(C(F)(F)F)s2)[C@H]2CCC[C@@H]21 ZINC000556958944 1052905777 /nfs/dbraw/zinc/90/57/77/1052905777.db2.gz LMZDISATLVBDPM-UWVGGRQHSA-N 1 2 304.381 4.172 20 0 DIADLO CC1(C)C[N@@H+](Cc2ncc(C(F)(F)F)s2)[C@H]2CCC[C@@H]21 ZINC000556958944 1052905783 /nfs/dbraw/zinc/90/57/83/1052905783.db2.gz LMZDISATLVBDPM-UWVGGRQHSA-N 1 2 304.381 4.172 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2cc(Cl)ccc21)c1nc(C(C)(C)C)no1 ZINC000920060749 1052913431 /nfs/dbraw/zinc/91/34/31/1052913431.db2.gz TZWPIFTULNSXFR-YGRLFVJLSA-N 1 2 319.836 4.359 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2cc(Cl)ccc21)c1nc(C(C)(C)C)no1 ZINC000920060746 1052913673 /nfs/dbraw/zinc/91/36/73/1052913673.db2.gz TZWPIFTULNSXFR-IINYFYTJSA-N 1 2 319.836 4.359 20 0 DIADLO CCC/C(C)=C/C(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC000920220404 1052929275 /nfs/dbraw/zinc/92/92/75/1052929275.db2.gz PRROEFBKRMENDL-KADHNRKRSA-N 1 2 321.490 4.060 20 0 DIADLO CCC/C(C)=C/C(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000920220404 1052929278 /nfs/dbraw/zinc/92/92/78/1052929278.db2.gz PRROEFBKRMENDL-KADHNRKRSA-N 1 2 321.490 4.060 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)C[C@@H]2CCCC[C@H]2C)n1 ZINC000920459429 1052940074 /nfs/dbraw/zinc/94/00/74/1052940074.db2.gz AILBCGREVXHORT-KGLIPLIRSA-N 1 2 323.506 4.140 20 0 DIADLO CCn1c(-c2ccccc2)nn(C[N@H+](C)CCC(C)C)c1=S ZINC000921050520 1052960933 /nfs/dbraw/zinc/96/09/33/1052960933.db2.gz SXLRTCYZURPSMH-UHFFFAOYSA-N 1 2 318.490 4.036 20 0 DIADLO CCn1c(-c2ccccc2)nn(C[N@@H+](C)CCC(C)C)c1=S ZINC000921050520 1052960938 /nfs/dbraw/zinc/96/09/38/1052960938.db2.gz SXLRTCYZURPSMH-UHFFFAOYSA-N 1 2 318.490 4.036 20 0 DIADLO Cc1ccccc1N1CC[NH+]([C@@H](C)c2cc(F)ccc2F)CC1 ZINC000195546034 1052975706 /nfs/dbraw/zinc/97/57/06/1052975706.db2.gz SKSHVSBUIIKALI-HNNXBMFYSA-N 1 2 316.395 4.156 20 0 DIADLO Cc1nc(N[C@H](C)CCCC(C)C)c(Br)c(C)[nH+]1 ZINC000322957206 1052979752 /nfs/dbraw/zinc/97/97/52/1052979752.db2.gz MUEMGJNXYWRWDG-SNVBAGLBSA-N 1 2 314.271 4.483 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2ncc(C(C)(C)C)o2)c1 ZINC000078387594 1052983797 /nfs/dbraw/zinc/98/37/97/1052983797.db2.gz QDQFDHZTKYECLW-MRXNPFEDSA-N 1 2 314.429 4.318 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2ncc(C(C)(C)C)o2)c1 ZINC000078387594 1052983799 /nfs/dbraw/zinc/98/37/99/1052983799.db2.gz QDQFDHZTKYECLW-MRXNPFEDSA-N 1 2 314.429 4.318 20 0 DIADLO Cc1ccc(OC2CC[NH+](Cc3cnc(Cl)s3)CC2)cc1 ZINC000175447413 1052998372 /nfs/dbraw/zinc/99/83/72/1052998372.db2.gz QEQWCTHWUBVDOY-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO C=CC[N@H+](Cc1cccc(C#N)c1)Cc1cccc(Cl)c1O ZINC000179856483 1053031062 /nfs/dbraw/zinc/03/10/62/1053031062.db2.gz ZDUBFRJTCIWYRS-UHFFFAOYSA-N 1 2 312.800 4.105 20 0 DIADLO C=CC[N@@H+](Cc1cccc(C#N)c1)Cc1cccc(Cl)c1O ZINC000179856483 1053031065 /nfs/dbraw/zinc/03/10/65/1053031065.db2.gz ZDUBFRJTCIWYRS-UHFFFAOYSA-N 1 2 312.800 4.105 20 0 DIADLO COc1cc2c(cc1O[C@H](C)CCc1ccccc1)C=[NH+]CC2 ZINC001228086809 1053042633 /nfs/dbraw/zinc/04/26/33/1053042633.db2.gz BPAPNKCTAHIDBW-OAHLLOKOSA-N 1 2 309.409 4.070 20 0 DIADLO COc1cc2c(cc1O[C@@H]1CCc3ccc(C)cc31)C=[NH+]CC2 ZINC001228088427 1053042806 /nfs/dbraw/zinc/04/28/06/1053042806.db2.gz VGEAUQWBCOSBIF-GOSISDBHSA-N 1 2 307.393 4.045 20 0 DIADLO C[C@@H](Oc1cccc(C(=O)C[N@H+](C)Cc2ccccc2)c1)C1CC1 ZINC001228105504 1053044659 /nfs/dbraw/zinc/04/46/59/1053044659.db2.gz XLVIEFIZGXKTMS-MRXNPFEDSA-N 1 2 323.436 4.179 20 0 DIADLO C[C@@H](Oc1cccc(C(=O)C[N@@H+](C)Cc2ccccc2)c1)C1CC1 ZINC001228105504 1053044661 /nfs/dbraw/zinc/04/46/61/1053044661.db2.gz XLVIEFIZGXKTMS-MRXNPFEDSA-N 1 2 323.436 4.179 20 0 DIADLO Cc1[nH]c2ccc(O[C@H]3CC[C@@H](OCc4ccccc4)C3)cc2[nH+]1 ZINC001228330297 1053076735 /nfs/dbraw/zinc/07/67/35/1053076735.db2.gz XGTPNPRZOIFPPF-SJORKVTESA-N 1 2 322.408 4.388 20 0 DIADLO Cc1nc(C)c(CNc2[nH+]c3ccccc3n2C(C)C)s1 ZINC000849348076 1053089942 /nfs/dbraw/zinc/08/99/42/1053089942.db2.gz ZSFZKNMFMKFFSJ-UHFFFAOYSA-N 1 2 300.431 4.303 20 0 DIADLO CC(C)c1cc(N[C@H]2CCO[C@H](C(C)C)C2)nc(C(C)C)[nH+]1 ZINC000540038847 1053096278 /nfs/dbraw/zinc/09/62/78/1053096278.db2.gz PNXMKTNGZVGZRB-HOCLYGCPSA-N 1 2 305.466 4.339 20 0 DIADLO COc1ccnc([C@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC001350932902 1053118225 /nfs/dbraw/zinc/11/82/25/1053118225.db2.gz RGNZZJKBGKEKJE-NWDGAFQWSA-N 1 2 319.474 4.256 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2ccc(CSC(F)F)o2)n1 ZINC000069168383 1053128907 /nfs/dbraw/zinc/12/89/07/1053128907.db2.gz USYZAAYAJBUABN-SECBINFHSA-N 1 2 318.414 4.351 20 0 DIADLO CCN(CC)c1ccc(CNc2cc(C)c3ccccc3[nH+]2)cn1 ZINC001317881058 1053137319 /nfs/dbraw/zinc/13/73/19/1053137319.db2.gz UQYSFIPKQLJLTE-UHFFFAOYSA-N 1 2 320.440 4.397 20 0 DIADLO CN(c1ccc(CNc2ccccc2)cc1)c1[nH+]cccc1N ZINC001212298503 1053140811 /nfs/dbraw/zinc/14/08/11/1053140811.db2.gz VVNRCTFXDUKOIL-UHFFFAOYSA-N 1 2 304.397 4.044 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc(Cl)cc1 ZINC000353440471 1053141773 /nfs/dbraw/zinc/14/17/73/1053141773.db2.gz KINFXRSPHKDQCV-WBVHZDCISA-N 1 2 303.837 4.427 20 0 DIADLO CCCC[NH+](CCCC)Cn1nc(NC(C)C)sc1=S ZINC001318460603 1053169257 /nfs/dbraw/zinc/16/92/57/1053169257.db2.gz CIIZFMVHGFDBOP-UHFFFAOYSA-N 1 2 316.540 4.354 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@H](C)c1ncccn1 ZINC001351283627 1053161653 /nfs/dbraw/zinc/16/16/53/1053161653.db2.gz NYRVBDMUKSBCJE-TZMCWYRMSA-N 1 2 324.453 4.320 20 0 DIADLO CCOC(=O)c1ccc2[nH+]ccc(Nc3cc(O)ccc3C)c2c1 ZINC000200152603 1053178075 /nfs/dbraw/zinc/17/80/75/1053178075.db2.gz UGALTLOXMJBJDM-UHFFFAOYSA-N 1 2 322.364 4.169 20 0 DIADLO CC(C)C[C@H](NC(=O)[C@@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC001318682315 1053183584 /nfs/dbraw/zinc/18/35/84/1053183584.db2.gz SHQZKLJUWPBWDS-CJNGLKHVSA-N 1 2 319.836 4.001 20 0 DIADLO Cc1cc(N2CCC[C@@H](OCC(F)(F)F)C2)[nH+]c2ccccc12 ZINC001319088423 1053216593 /nfs/dbraw/zinc/21/65/93/1053216593.db2.gz MSWQRRBLORBSLW-CYBMUJFWSA-N 1 2 324.346 4.091 20 0 DIADLO Cc1ccccc1[C@H](CC(C)C)NC(=O)c1cccc2[nH+]ccn21 ZINC001360378688 1053219615 /nfs/dbraw/zinc/21/96/15/1053219615.db2.gz YETQKZASTXTJMZ-KRWDZBQOSA-N 1 2 321.424 4.160 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1cccnc1Cl ZINC000181480032 1053220086 /nfs/dbraw/zinc/22/00/86/1053220086.db2.gz QRSVUYYDFJSVQE-UHFFFAOYSA-N 1 2 300.793 4.107 20 0 DIADLO CC(C)CCc1ccc(NC(=O)c2cccc3[nH+]ccn32)cc1 ZINC001351865036 1053232093 /nfs/dbraw/zinc/23/20/93/1053232093.db2.gz FADAJJHMFRCJRC-UHFFFAOYSA-N 1 2 307.397 4.175 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc2ccccc2n1 ZINC000090547183 1053236823 /nfs/dbraw/zinc/23/68/23/1053236823.db2.gz GZCRMNRRWAXWAU-HNNXBMFYSA-N 1 2 320.440 4.397 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1cnc(CC(F)(F)F)s1 ZINC001351948730 1053248735 /nfs/dbraw/zinc/24/87/35/1053248735.db2.gz OYIGIVOALUWEKL-SECBINFHSA-N 1 2 304.337 4.034 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1cnc(CC(F)(F)F)s1 ZINC001351948730 1053248748 /nfs/dbraw/zinc/24/87/48/1053248748.db2.gz OYIGIVOALUWEKL-SECBINFHSA-N 1 2 304.337 4.034 20 0 DIADLO CCc1ccc(C(C)(C)C(=O)Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC001351974666 1053253267 /nfs/dbraw/zinc/25/32/67/1053253267.db2.gz VKJBXTALJZXISF-UHFFFAOYSA-N 1 2 321.424 4.121 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C3(Sc4ccccc4)CC3)cc2[nH+]1 ZINC001319631789 1053258425 /nfs/dbraw/zinc/25/84/25/1053258425.db2.gz BEIUGPCRLBQGKB-UHFFFAOYSA-N 1 2 323.421 4.135 20 0 DIADLO FC(F)(F)CCC[N@@H+]1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC001352028025 1053261085 /nfs/dbraw/zinc/26/10/85/1053261085.db2.gz AJQHSGBZKXLILT-ZDUSSCGKSA-N 1 2 307.743 4.056 20 0 DIADLO FC(F)(F)CCC[N@H+]1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC001352028025 1053261094 /nfs/dbraw/zinc/26/10/94/1053261094.db2.gz AJQHSGBZKXLILT-ZDUSSCGKSA-N 1 2 307.743 4.056 20 0 DIADLO C[S@@](=O)c1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2ccccc2)cc1 ZINC001319706131 1053264436 /nfs/dbraw/zinc/26/44/36/1053264436.db2.gz VTCAIVKJDQPJHM-XMSQKQJNSA-N 1 2 313.466 4.007 20 0 DIADLO C[S@@](=O)c1ccc(C[N@H+]2CC(C)(C)[C@H]2c2ccccc2)cc1 ZINC001319706131 1053264448 /nfs/dbraw/zinc/26/44/48/1053264448.db2.gz VTCAIVKJDQPJHM-XMSQKQJNSA-N 1 2 313.466 4.007 20 0 DIADLO CC(C)c1noc(C[N@@H+]2C[C@H]3CCCC[C@]32c2ccccc2)n1 ZINC001319808167 1053276636 /nfs/dbraw/zinc/27/66/36/1053276636.db2.gz IYQMCLXLYRKGNS-APWZRJJASA-N 1 2 311.429 4.094 20 0 DIADLO CC(C)c1noc(C[N@H+]2C[C@H]3CCCC[C@]32c2ccccc2)n1 ZINC001319808167 1053276647 /nfs/dbraw/zinc/27/66/47/1053276647.db2.gz IYQMCLXLYRKGNS-APWZRJJASA-N 1 2 311.429 4.094 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2c(Cl)cccc2N(C)C)no1 ZINC001319825826 1053277342 /nfs/dbraw/zinc/27/73/42/1053277342.db2.gz GDASMRDVJDQMLG-QGZVFWFLSA-N 1 2 319.836 4.040 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2c(Cl)cccc2N(C)C)no1 ZINC001319825826 1053277351 /nfs/dbraw/zinc/27/73/51/1053277351.db2.gz GDASMRDVJDQMLG-QGZVFWFLSA-N 1 2 319.836 4.040 20 0 DIADLO Clc1cccc(Cl)c1C1([NH2+][C@H]2CCCc3n[nH]cc32)CC1 ZINC000353644382 1053282507 /nfs/dbraw/zinc/28/25/07/1053282507.db2.gz DVIDVHNWBFVGAC-ZDUSSCGKSA-N 1 2 322.239 4.373 20 0 DIADLO CC(C)[N@H+](Cc1nc2c(s1)C[C@@H](C)CC2)Cc1ccccn1 ZINC001319933540 1053286821 /nfs/dbraw/zinc/28/68/21/1053286821.db2.gz VFPKIKDPQVJBJN-AWEZNQCLSA-N 1 2 315.486 4.074 20 0 DIADLO CC(C)[N@@H+](Cc1nc2c(s1)C[C@@H](C)CC2)Cc1ccccn1 ZINC001319933540 1053286826 /nfs/dbraw/zinc/28/68/26/1053286826.db2.gz VFPKIKDPQVJBJN-AWEZNQCLSA-N 1 2 315.486 4.074 20 0 DIADLO COc1cc([C@@H](C)Nc2ccc(C)[nH+]c2C)ccc1OC(F)F ZINC001320108518 1053305955 /nfs/dbraw/zinc/30/59/55/1053305955.db2.gz ZNJIHMAZPCMSMK-LLVKDONJSA-N 1 2 322.355 4.482 20 0 DIADLO COc1cc([C@H](C)Nc2ccc(C)[nH+]c2C)ccc1OC(F)F ZINC001320108520 1053306776 /nfs/dbraw/zinc/30/67/76/1053306776.db2.gz ZNJIHMAZPCMSMK-NSHDSACASA-N 1 2 322.355 4.482 20 0 DIADLO COc1cccc2c1CCN(c1cc(C)c3ccccc3[nH+]1)C2 ZINC001320109710 1053306927 /nfs/dbraw/zinc/30/69/27/1053306927.db2.gz OMAYVTOHQNRRRT-UHFFFAOYSA-N 1 2 304.393 4.115 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+]([C@H](C)c1nc3ccccc3o1)CC2 ZINC001320128170 1053307391 /nfs/dbraw/zinc/30/73/91/1053307391.db2.gz WOSSLYZTEYMNDW-CQSZACIVSA-N 1 2 322.408 4.346 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+]([C@H](C)c1nc3ccccc3o1)CC2 ZINC001320128170 1053307408 /nfs/dbraw/zinc/30/74/08/1053307408.db2.gz WOSSLYZTEYMNDW-CQSZACIVSA-N 1 2 322.408 4.346 20 0 DIADLO FC1(F)CC[NH+](Cc2cc3sccc3nc2Cl)CC1 ZINC001236861959 1053315868 /nfs/dbraw/zinc/31/58/68/1053315868.db2.gz ZEIJBYXUSTYNNX-UHFFFAOYSA-N 1 2 302.777 4.181 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@H+]([C@H](C)c3nc(C4CC4)no3)CC2)c1 ZINC000092428146 1053320990 /nfs/dbraw/zinc/32/09/90/1053320990.db2.gz KTXXAVIEPAVIIN-OAHLLOKOSA-N 1 2 323.440 4.414 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@@H+]([C@H](C)c3nc(C4CC4)no3)CC2)c1 ZINC000092428146 1053321005 /nfs/dbraw/zinc/32/10/05/1053321005.db2.gz KTXXAVIEPAVIIN-OAHLLOKOSA-N 1 2 323.440 4.414 20 0 DIADLO C[C@@H](C(=O)NCC1(C2CCCCC2)CCCCC1)n1cc[nH+]c1 ZINC001320402981 1053331598 /nfs/dbraw/zinc/33/15/98/1053331598.db2.gz LYONAKFJLFSOPW-INIZCTEOSA-N 1 2 317.477 4.091 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1ccc(F)c2occc21 ZINC001352516278 1053341569 /nfs/dbraw/zinc/34/15/69/1053341569.db2.gz CVFMJNLOGAUMDB-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO CCc1ccc(C2=CC[N@@H+]([C@@H](C)c3nc(C4CC4)no3)CC2)cc1 ZINC000093263559 1053375329 /nfs/dbraw/zinc/37/53/29/1053375329.db2.gz UFOIRBWDEUEFOE-AWEZNQCLSA-N 1 2 323.440 4.360 20 0 DIADLO CCc1ccc(C2=CC[N@H+]([C@@H](C)c3nc(C4CC4)no3)CC2)cc1 ZINC000093263559 1053375336 /nfs/dbraw/zinc/37/53/36/1053375336.db2.gz UFOIRBWDEUEFOE-AWEZNQCLSA-N 1 2 323.440 4.360 20 0 DIADLO C[C@H]1CC[C@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CC1 ZINC001434920797 1053386876 /nfs/dbraw/zinc/38/68/76/1053386876.db2.gz PEKPSLUIRJAVDO-JOCQHMNTSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1csc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)c1 ZINC001434918723 1053387123 /nfs/dbraw/zinc/38/71/23/1053387123.db2.gz FIERHYPMHCAMJZ-UHFFFAOYSA-N 1 2 317.801 4.148 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CC[C@@H]3CCCC[C@@H]3C2)s1 ZINC001321131469 1053393116 /nfs/dbraw/zinc/39/31/16/1053393116.db2.gz SRLIYVKHAZXZRO-WDEREUQCSA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CC[C@@H]3CCCC[C@@H]3C2)s1 ZINC001321131469 1053393124 /nfs/dbraw/zinc/39/31/24/1053393124.db2.gz SRLIYVKHAZXZRO-WDEREUQCSA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CC[C@@H]3CCCC[C@H]3C2)s1 ZINC001321131468 1053393328 /nfs/dbraw/zinc/39/33/28/1053393328.db2.gz SRLIYVKHAZXZRO-QWRGUYRKSA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CC[C@@H]3CCCC[C@H]3C2)s1 ZINC001321131468 1053393346 /nfs/dbraw/zinc/39/33/46/1053393346.db2.gz SRLIYVKHAZXZRO-QWRGUYRKSA-N 1 2 304.381 4.174 20 0 DIADLO Cc1cc(C)c(C(=O)N(Cc2ccccc2)CC(C)C)c(C)[nH+]1 ZINC001352922108 1053435582 /nfs/dbraw/zinc/43/55/82/1053435582.db2.gz KANCVYIZOVSBTE-UHFFFAOYSA-N 1 2 310.441 4.305 20 0 DIADLO COc1ccc([C@H](C)Oc2ccc(-n3cc[nH+]c3)cc2)cc1OC ZINC001229953876 1053438839 /nfs/dbraw/zinc/43/88/39/1053438839.db2.gz FFUHQVSFIRIJFJ-AWEZNQCLSA-N 1 2 324.380 4.030 20 0 DIADLO CC1CCC(OC2CC[NH+](C/C(Cl)=C\Cl)CC2)CC1 ZINC000763545742 1053468377 /nfs/dbraw/zinc/46/83/77/1053468377.db2.gz ZMXCDIPLTPUBQX-JLHYYAGUSA-N 1 2 306.277 4.365 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2C/C(Cl)=C\Cl)cc1OC ZINC000763551242 1053469875 /nfs/dbraw/zinc/46/98/75/1053469875.db2.gz CETLNMMLAIZYPC-CNELAYHGSA-N 1 2 316.228 4.160 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2C/C(Cl)=C\Cl)cc1OC ZINC000763551242 1053469881 /nfs/dbraw/zinc/46/98/81/1053469881.db2.gz CETLNMMLAIZYPC-CNELAYHGSA-N 1 2 316.228 4.160 20 0 DIADLO CC[C@@H](NC(=O)c1c(C)cc(C)[nH+]c1C)c1ccc(F)cc1F ZINC001435212374 1053473477 /nfs/dbraw/zinc/47/34/77/1053473477.db2.gz IDJPTHUAYYBWDM-MRXNPFEDSA-N 1 2 318.367 4.166 20 0 DIADLO FC(F)SCc1ccc(C[NH2+]Cc2ccc(Cl)cn2)o1 ZINC000182686471 1053494656 /nfs/dbraw/zinc/49/46/56/1053494656.db2.gz ARKZKJFTIFIAJY-UHFFFAOYSA-N 1 2 318.776 4.074 20 0 DIADLO Cc1cc(CNC(=O)N2c3ccccc3C(C)(C)[C@@H]2C)cc(C)[nH+]1 ZINC001230229986 1053498164 /nfs/dbraw/zinc/49/81/64/1053498164.db2.gz WPYXRVNNWTYXNV-HNNXBMFYSA-N 1 2 323.440 4.094 20 0 DIADLO CCc1cccc2c1OCC[C@@H]2[NH2+]Cc1csc(C(C)C)n1 ZINC001200280666 1053518487 /nfs/dbraw/zinc/51/84/87/1053518487.db2.gz DCHFNYYFSBTIRW-INIZCTEOSA-N 1 2 316.470 4.442 20 0 DIADLO Cc1cc(N2CCC=C(c3ccncc3)C2)[nH+]c2ccccc12 ZINC001322594856 1053524625 /nfs/dbraw/zinc/52/46/25/1053524625.db2.gz IKMPAELJSNTSGE-UHFFFAOYSA-N 1 2 301.393 4.232 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+](CC)Cc2cccc(F)c2)n1 ZINC000152829944 1053534922 /nfs/dbraw/zinc/53/49/22/1053534922.db2.gz QOUGVGSXLBHXNE-ZDUSSCGKSA-N 1 2 305.397 4.134 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+](CC)Cc2cccc(F)c2)n1 ZINC000152829944 1053534934 /nfs/dbraw/zinc/53/49/34/1053534934.db2.gz QOUGVGSXLBHXNE-ZDUSSCGKSA-N 1 2 305.397 4.134 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1)[C@H](C)c1nc(C(C)(C)C)no1 ZINC000152816143 1053535089 /nfs/dbraw/zinc/53/50/89/1053535089.db2.gz OIKXMCNIQREPMZ-GFCCVEGCSA-N 1 2 305.397 4.089 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1)[C@H](C)c1nc(C(C)(C)C)no1 ZINC000152816143 1053535101 /nfs/dbraw/zinc/53/51/01/1053535101.db2.gz OIKXMCNIQREPMZ-GFCCVEGCSA-N 1 2 305.397 4.089 20 0 DIADLO CCCSc1nc(C[NH+]2CCCC2)nc2sc(C)c(C)c21 ZINC000615338628 1053558140 /nfs/dbraw/zinc/55/81/40/1053558140.db2.gz KCUZWZUKCPNLQI-UHFFFAOYSA-N 1 2 321.515 4.406 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1nc2ccccc2n1C ZINC000182953950 1053560966 /nfs/dbraw/zinc/56/09/66/1053560966.db2.gz NWMUBHLDMKELQO-CQSZACIVSA-N 1 2 320.440 4.129 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1nc2ccccc2n1C ZINC000182953950 1053560975 /nfs/dbraw/zinc/56/09/75/1053560975.db2.gz NWMUBHLDMKELQO-CQSZACIVSA-N 1 2 320.440 4.129 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1nc2ccccc2n1C ZINC000182953929 1053562267 /nfs/dbraw/zinc/56/22/67/1053562267.db2.gz NWMUBHLDMKELQO-AWEZNQCLSA-N 1 2 320.440 4.129 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1nc2ccccc2n1C ZINC000182953929 1053562281 /nfs/dbraw/zinc/56/22/81/1053562281.db2.gz NWMUBHLDMKELQO-AWEZNQCLSA-N 1 2 320.440 4.129 20 0 DIADLO CCCC[C@@H](CC)CNc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC000325972329 1053568053 /nfs/dbraw/zinc/56/80/53/1053568053.db2.gz WKTRBLGFQXMKDD-OAHLLOKOSA-N 1 2 323.444 4.444 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@H](C)c3c(C)cccc3C)ccn12 ZINC001435585554 1053610726 /nfs/dbraw/zinc/61/07/26/1053610726.db2.gz VTJRQHSKYOXDKR-OAHLLOKOSA-N 1 2 308.381 4.178 20 0 DIADLO Cc1cc(NCc2ccc3cnn(C)c3c2)[nH+]c2ccccc12 ZINC001323986284 1053615619 /nfs/dbraw/zinc/61/56/19/1053615619.db2.gz SCKAMUVRVLAZBN-UHFFFAOYSA-N 1 2 302.381 4.042 20 0 DIADLO CC[C@H](Oc1cc2c(cc1O)C=[NH+]CC2)c1cccc(F)c1C ZINC001230920236 1053624630 /nfs/dbraw/zinc/62/46/30/1053624630.db2.gz KGLNDSVBUHTNDO-SFHVURJKSA-N 1 2 313.372 4.345 20 0 DIADLO Oc1cc2c(cc1O[C@@H]1CCc3ccc(Cl)cc31)CC[NH+]=C2 ZINC001230921616 1053625097 /nfs/dbraw/zinc/62/50/97/1053625097.db2.gz PIFZHQUGUKYUEW-QGZVFWFLSA-N 1 2 313.784 4.087 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1ccc(F)cc1F ZINC000163172914 1053632005 /nfs/dbraw/zinc/63/20/05/1053632005.db2.gz FXTXLSLKSMKBPP-CYBMUJFWSA-N 1 2 313.351 4.001 20 0 DIADLO Cc1cc(NC[C@]2(CO)C[C@H]2c2ccccc2)[nH+]c2ccccc12 ZINC001324235307 1053636261 /nfs/dbraw/zinc/63/62/61/1053636261.db2.gz HTPLJYRZHNKQCX-RXVVDRJESA-N 1 2 318.420 4.121 20 0 DIADLO Cc1cc(NCc2ccc(C[S@](C)=O)cc2)[nH+]c2ccccc12 ZINC001324391802 1053649925 /nfs/dbraw/zinc/64/99/25/1053649925.db2.gz RHRHFASMTBOCCN-QHCPKHFHSA-N 1 2 324.449 4.034 20 0 DIADLO C[C@H]([NH2+]Cc1cccnc1Cl)c1nc(C(C)(C)C)cs1 ZINC001324383284 1053650362 /nfs/dbraw/zinc/65/03/62/1053650362.db2.gz FKZCKOWNEQQHLC-JTQLQIEISA-N 1 2 309.866 4.340 20 0 DIADLO Cc1cnc(CNc2[nH+]c3ccccc3n2C(C)(C)C)s1 ZINC001324541358 1053660570 /nfs/dbraw/zinc/66/05/70/1053660570.db2.gz JXJWLBVLAKBWMM-UHFFFAOYSA-N 1 2 300.431 4.168 20 0 DIADLO Cc1ccc(N[C@@H](C)c2nc(Br)cs2)c(C)[nH+]1 ZINC001324601948 1053665077 /nfs/dbraw/zinc/66/50/77/1053665077.db2.gz PKDULGZNFQWBMA-VIFPVBQESA-N 1 2 312.236 4.091 20 0 DIADLO Cc1cccc2c1[C@@H](Oc1ccc(-c3c[nH+]cn3C)cc1)CC2 ZINC001231078677 1053668682 /nfs/dbraw/zinc/66/86/82/1053668682.db2.gz CVUOOKCGFDOPDL-IBGZPJMESA-N 1 2 304.393 4.462 20 0 DIADLO COc1ccc(OC)c([C@H](C)Oc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001231081250 1053669124 /nfs/dbraw/zinc/66/91/24/1053669124.db2.gz KBEJMVVWWPNIQT-ZDUSSCGKSA-N 1 2 324.380 4.234 20 0 DIADLO Cc1cccc2c1CC[C@H]2Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231079239 1053669687 /nfs/dbraw/zinc/66/96/87/1053669687.db2.gz JMKKWCQCUVWNAJ-HXUWFJFHSA-N 1 2 304.393 4.462 20 0 DIADLO COc1ccccc1[C@H](C)Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231082111 1053671010 /nfs/dbraw/zinc/67/10/10/1053671010.db2.gz NOWUAXYSWXLHFY-AWEZNQCLSA-N 1 2 308.381 4.236 20 0 DIADLO Cc1cccc(OC[C@@H](C)Oc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001231082588 1053671503 /nfs/dbraw/zinc/67/15/03/1053671503.db2.gz XHOVFZBLLSDDEI-OAHLLOKOSA-N 1 2 308.381 4.231 20 0 DIADLO COC(=O)c1ccc([C@H](C)Oc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001231083041 1053671742 /nfs/dbraw/zinc/67/17/42/1053671742.db2.gz AYBHCJALUFJRQD-ZDUSSCGKSA-N 1 2 322.364 4.003 20 0 DIADLO Oc1ccc(OC2C[NH+](Cc3ccccc3)C2)c2c1[C@H]1CC[C@@H]2C1 ZINC001231217188 1053702867 /nfs/dbraw/zinc/70/28/67/1053702867.db2.gz YVIKMSIYRGGFLX-JKSUJKDBSA-N 1 2 321.420 4.020 20 0 DIADLO CCCCCC(=O)c1ccc(OC2CC[NH+](CCF)CC2)cc1 ZINC001231256580 1053711938 /nfs/dbraw/zinc/71/19/38/1053711938.db2.gz GYEUZJHHFGVFPM-UHFFFAOYSA-N 1 2 321.436 4.262 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)cs1)c1cncc(F)c1 ZINC000154013723 1053722591 /nfs/dbraw/zinc/72/25/91/1053722591.db2.gz HXLURHDAEAOTIP-MNOVXSKESA-N 1 2 307.438 4.387 20 0 DIADLO CC[N@H+](Cc1cccc(Cl)c1)[C@H](C)c1nc(C(C)C)no1 ZINC000154034619 1053724596 /nfs/dbraw/zinc/72/45/96/1053724596.db2.gz FRWQIIXFHCMLOW-GFCCVEGCSA-N 1 2 307.825 4.430 20 0 DIADLO CC[N@@H+](Cc1cccc(Cl)c1)[C@H](C)c1nc(C(C)C)no1 ZINC000154034619 1053724611 /nfs/dbraw/zinc/72/46/11/1053724611.db2.gz FRWQIIXFHCMLOW-GFCCVEGCSA-N 1 2 307.825 4.430 20 0 DIADLO Cc1cc(N2CC[C@@]3(C2)OCc2ccccc23)[nH+]c2ccccc12 ZINC001325673358 1053726496 /nfs/dbraw/zinc/72/64/96/1053726496.db2.gz OEFQEFLQDXTCIJ-NRFANRHFSA-N 1 2 316.404 4.179 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+](CC)Cc2ccc(OC)cc2)n1 ZINC000154218553 1053730967 /nfs/dbraw/zinc/73/09/67/1053730967.db2.gz ORZWGVBEDFUZGB-CQSZACIVSA-N 1 2 317.433 4.004 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+](CC)Cc2ccc(OC)cc2)n1 ZINC000154218553 1053730977 /nfs/dbraw/zinc/73/09/77/1053730977.db2.gz ORZWGVBEDFUZGB-CQSZACIVSA-N 1 2 317.433 4.004 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccoc2)no1)c1ccc2c(c1)CCCC2 ZINC000154347551 1053736776 /nfs/dbraw/zinc/73/67/76/1053736776.db2.gz KGKJCTFLKPHKFY-CYBMUJFWSA-N 1 2 323.396 4.059 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NCc1ccnc(Cl)c1Cl ZINC001325928670 1053741978 /nfs/dbraw/zinc/74/19/78/1053741978.db2.gz QEVJRFBBHCXUCB-UHFFFAOYSA-N 1 2 312.200 4.183 20 0 DIADLO Cc1ccc([C@H]2CCC[C@H]2OC(=O)c2cccc3[nH+]ccn32)cc1 ZINC001435985489 1053744979 /nfs/dbraw/zinc/74/49/79/1053744979.db2.gz UZURNTKTAMCJAQ-SJLPKXTDSA-N 1 2 320.392 4.136 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+](Cc1ccccc1)C1CC1 ZINC001231414590 1053747451 /nfs/dbraw/zinc/74/74/51/1053747451.db2.gz ZFHOHXXOUQSWDY-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+](Cc1ccccc1)C1CC1 ZINC001231414590 1053747465 /nfs/dbraw/zinc/74/74/65/1053747465.db2.gz ZFHOHXXOUQSWDY-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+](Cc1ccc3cc(N(C)C)ccc3c1)C2 ZINC001231442690 1053756196 /nfs/dbraw/zinc/75/61/96/1053756196.db2.gz UNMASFTYEQILSI-UHFFFAOYSA-N 1 2 317.436 4.125 20 0 DIADLO Cc1cc2c(cn1)C[N@H+](Cc1ccc3cc(N(C)C)ccc3c1)C2 ZINC001231442690 1053756206 /nfs/dbraw/zinc/75/62/06/1053756206.db2.gz UNMASFTYEQILSI-UHFFFAOYSA-N 1 2 317.436 4.125 20 0 DIADLO c1ccc(C[N@@H+](Cc2nnc(-c3ccccc3)s2)C2CC2)cc1 ZINC000155078174 1053762402 /nfs/dbraw/zinc/76/24/02/1053762402.db2.gz ONCLIYHUOYZIDJ-UHFFFAOYSA-N 1 2 321.449 4.370 20 0 DIADLO c1ccc(C[N@H+](Cc2nnc(-c3ccccc3)s2)C2CC2)cc1 ZINC000155078174 1053762412 /nfs/dbraw/zinc/76/24/12/1053762412.db2.gz ONCLIYHUOYZIDJ-UHFFFAOYSA-N 1 2 321.449 4.370 20 0 DIADLO O=C(/C=C\C1CCCCCC1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001354097906 1053763108 /nfs/dbraw/zinc/76/31/08/1053763108.db2.gz UWEQAWZJNXIFDM-KHPPLWFESA-N 1 2 309.413 4.337 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3cncc(F)c3)co2)cc1 ZINC000155313204 1053774766 /nfs/dbraw/zinc/77/47/66/1053774766.db2.gz MVXNGQNFCHETPB-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO Oc1ccc(C[N@H+]2CCc3sccc3C2)cc1C(F)(F)F ZINC001231522735 1053778401 /nfs/dbraw/zinc/77/84/01/1053778401.db2.gz JDUJPKWCMVFGRT-UHFFFAOYSA-N 1 2 313.344 4.031 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)OC3CCC(C(C)(C)C)CC3)ccn12 ZINC001354136555 1053778828 /nfs/dbraw/zinc/77/88/28/1053778828.db2.gz LIIJMQPCSNWEEO-UHFFFAOYSA-N 1 2 314.429 4.404 20 0 DIADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(F)c(Oc2ccccc2)c1 ZINC001231539767 1053782304 /nfs/dbraw/zinc/78/23/04/1053782304.db2.gz VGTPVGIQCNCBNH-SFHVURJKSA-N 1 2 313.372 4.171 20 0 DIADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(F)c(Oc2ccccc2)c1 ZINC001231539767 1053782315 /nfs/dbraw/zinc/78/23/15/1053782315.db2.gz VGTPVGIQCNCBNH-SFHVURJKSA-N 1 2 313.372 4.171 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCc3cccc(Cl)c3C2)cn1 ZINC001231538843 1053782752 /nfs/dbraw/zinc/78/27/52/1053782752.db2.gz RWEVZZFKIDMOFV-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCc3cccc(Cl)c3C2)cn1 ZINC001231538843 1053782760 /nfs/dbraw/zinc/78/27/60/1053782760.db2.gz RWEVZZFKIDMOFV-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO C[N@H+](Cc1ccno1)Cc1ccc(F)c(Oc2ccccc2)c1 ZINC001231539520 1053783152 /nfs/dbraw/zinc/78/31/52/1053783152.db2.gz KKQVVSKAFOBBJS-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO C[N@@H+](Cc1ccno1)Cc1ccc(F)c(Oc2ccccc2)c1 ZINC001231539520 1053783168 /nfs/dbraw/zinc/78/31/68/1053783168.db2.gz KKQVVSKAFOBBJS-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO c1ccc2c(c1)C[N@H+](Cc1nc3c(s1)CCCC3)CCS2 ZINC001231585453 1053790443 /nfs/dbraw/zinc/79/04/43/1053790443.db2.gz OOEPGTFCEWGVTH-UHFFFAOYSA-N 1 2 316.495 4.130 20 0 DIADLO c1ccc2c(c1)C[N@@H+](Cc1nc3c(s1)CCCC3)CCS2 ZINC001231585453 1053790446 /nfs/dbraw/zinc/79/04/46/1053790446.db2.gz OOEPGTFCEWGVTH-UHFFFAOYSA-N 1 2 316.495 4.130 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[N@H+](C)Cc1cc(C)no1 ZINC000649856576 1053790626 /nfs/dbraw/zinc/79/06/26/1053790626.db2.gz LKXOWVSSDGLVBG-OAHLLOKOSA-N 1 2 320.820 4.154 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[N@@H+](C)Cc1cc(C)no1 ZINC000649856576 1053790630 /nfs/dbraw/zinc/79/06/30/1053790630.db2.gz LKXOWVSSDGLVBG-OAHLLOKOSA-N 1 2 320.820 4.154 20 0 DIADLO C[C@@H]1CC[C@@H](CO)C[N@@H+]1Cc1cc(Cl)cc(Cl)c1Cl ZINC001231597611 1053795531 /nfs/dbraw/zinc/79/55/31/1053795531.db2.gz FEWAHDZLGUJJAW-NXEZZACHSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[C@@H](CO)C[N@H+]1Cc1cc(Cl)cc(Cl)c1Cl ZINC001231597611 1053795541 /nfs/dbraw/zinc/79/55/41/1053795541.db2.gz FEWAHDZLGUJJAW-NXEZZACHSA-N 1 2 322.663 4.240 20 0 DIADLO COc1cc(F)ccc1C[N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001231604898 1053801163 /nfs/dbraw/zinc/80/11/63/1053801163.db2.gz HLJQGMVWKGAQAF-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)ccc1C[N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001231604898 1053801179 /nfs/dbraw/zinc/80/11/79/1053801179.db2.gz HLJQGMVWKGAQAF-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO C[N@H+](CCC(=O)c1ccccc1)Cc1coc(-c2ccccc2)n1 ZINC001231631185 1053809800 /nfs/dbraw/zinc/80/98/00/1053809800.db2.gz BMHOHYJBPJTOGO-UHFFFAOYSA-N 1 2 320.392 4.046 20 0 DIADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1coc(-c2ccccc2)n1 ZINC001231631185 1053809819 /nfs/dbraw/zinc/80/98/19/1053809819.db2.gz BMHOHYJBPJTOGO-UHFFFAOYSA-N 1 2 320.392 4.046 20 0 DIADLO CC[C@@H]([NH2+][C@H](COC)c1ccc(C)o1)c1ccc(F)cc1F ZINC000156455446 1053810182 /nfs/dbraw/zinc/81/01/82/1053810182.db2.gz IIYYQECWAHRKEX-HZPDHXFCSA-N 1 2 309.356 4.295 20 0 DIADLO CCc1ccc(C[N@H+](Cc2ccccc2)Cc2cccnc2)nc1 ZINC001231641337 1053811841 /nfs/dbraw/zinc/81/18/41/1053811841.db2.gz WQNSJNCRNQLDCN-UHFFFAOYSA-N 1 2 317.436 4.241 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)nc1 ZINC001231641337 1053811861 /nfs/dbraw/zinc/81/18/61/1053811861.db2.gz WQNSJNCRNQLDCN-UHFFFAOYSA-N 1 2 317.436 4.241 20 0 DIADLO CCc1ccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)nc1 ZINC001231640845 1053812608 /nfs/dbraw/zinc/81/26/08/1053812608.db2.gz OIPUYYVZXSYUBD-SFHVURJKSA-N 1 2 302.368 4.259 20 0 DIADLO CCc1ccc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)nc1 ZINC001231640845 1053812623 /nfs/dbraw/zinc/81/26/23/1053812623.db2.gz OIPUYYVZXSYUBD-SFHVURJKSA-N 1 2 302.368 4.259 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@@H](C)c2ccccc2OC)n1 ZINC000271714015 1053820294 /nfs/dbraw/zinc/82/02/94/1053820294.db2.gz PYESBRJSHONUTQ-AWEZNQCLSA-N 1 2 301.434 4.104 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)cn1 ZINC001231658641 1053821051 /nfs/dbraw/zinc/82/10/51/1053821051.db2.gz FEULJBUHSIVECX-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)cn1 ZINC001231658641 1053821066 /nfs/dbraw/zinc/82/10/66/1053821066.db2.gz FEULJBUHSIVECX-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)cn1 ZINC001231654530 1053821170 /nfs/dbraw/zinc/82/11/70/1053821170.db2.gz PXWPTOCHQWNLFM-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)cn1 ZINC001231654530 1053821185 /nfs/dbraw/zinc/82/11/85/1053821185.db2.gz PXWPTOCHQWNLFM-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)cn1 ZINC001231658653 1053821703 /nfs/dbraw/zinc/82/17/03/1053821703.db2.gz FZNCUMXENQCDSJ-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)cn1 ZINC001231658653 1053821723 /nfs/dbraw/zinc/82/17/23/1053821723.db2.gz FZNCUMXENQCDSJ-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO CC(C)(C)c1ccc2c(c1)CC[N@@H+](Cc1noc3c1CCCC3)C2 ZINC001327151381 1053836234 /nfs/dbraw/zinc/83/62/34/1053836234.db2.gz UJSNZPGTGUTVPN-UHFFFAOYSA-N 1 2 324.468 4.409 20 0 DIADLO CC(C)(C)c1ccc2c(c1)CC[N@H+](Cc1noc3c1CCCC3)C2 ZINC001327151381 1053836254 /nfs/dbraw/zinc/83/62/54/1053836254.db2.gz UJSNZPGTGUTVPN-UHFFFAOYSA-N 1 2 324.468 4.409 20 0 DIADLO C[N@H+](Cc1nc2ccccc2s1)Cc1ccc(Cl)c(O)c1 ZINC001231731482 1053840816 /nfs/dbraw/zinc/84/08/16/1053840816.db2.gz MVEDKJAYIXKPFI-UHFFFAOYSA-N 1 2 318.829 4.287 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2s1)Cc1ccc(Cl)c(O)c1 ZINC001231731482 1053840826 /nfs/dbraw/zinc/84/08/26/1053840826.db2.gz MVEDKJAYIXKPFI-UHFFFAOYSA-N 1 2 318.829 4.287 20 0 DIADLO c1ccc([C@@H]2CC[N@@H+](Cc3noc(C4CCCCC4)n3)C2)cc1 ZINC000157158186 1053841657 /nfs/dbraw/zinc/84/16/57/1053841657.db2.gz AYTLKVINNSFMTA-QGZVFWFLSA-N 1 2 311.429 4.107 20 0 DIADLO c1ccc([C@@H]2CC[N@H+](Cc3noc(C4CCCCC4)n3)C2)cc1 ZINC000157158186 1053841677 /nfs/dbraw/zinc/84/16/77/1053841677.db2.gz AYTLKVINNSFMTA-QGZVFWFLSA-N 1 2 311.429 4.107 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001327240501 1053843010 /nfs/dbraw/zinc/84/30/10/1053843010.db2.gz ZHEVABBPQBZAKE-OAHLLOKOSA-N 1 2 321.380 4.184 20 0 DIADLO CC[C@H]1CCC[N@@H+]1Cc1cc(Cl)c(O)c(Br)c1 ZINC001231748426 1053847786 /nfs/dbraw/zinc/84/77/86/1053847786.db2.gz KFRDIQZFQNYGFX-JTQLQIEISA-N 1 2 318.642 4.183 20 0 DIADLO CC[C@H]1CCC[N@H+]1Cc1cc(Cl)c(O)c(Br)c1 ZINC001231748426 1053847802 /nfs/dbraw/zinc/84/78/02/1053847802.db2.gz KFRDIQZFQNYGFX-JTQLQIEISA-N 1 2 318.642 4.183 20 0 DIADLO COc1ncc(F)cc1C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC001231745500 1053849654 /nfs/dbraw/zinc/84/96/54/1053849654.db2.gz NBWRNHXLNKWERJ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(F)cc1C[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC001231745500 1053849669 /nfs/dbraw/zinc/84/96/69/1053849669.db2.gz NBWRNHXLNKWERJ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1ccc(OCc2nc(CNc3cccc[nH+]3)cs2)cc1 ZINC000157423660 1053854149 /nfs/dbraw/zinc/85/41/49/1053854149.db2.gz LYCXMLOCEUERBR-UHFFFAOYSA-N 1 2 311.410 4.038 20 0 DIADLO CCCOc1ccc([C@H](C)[NH2+][C@H](C)c2nnc(C)s2)cc1 ZINC000274230086 1053860152 /nfs/dbraw/zinc/86/01/52/1053860152.db2.gz PKSJBSRSNYZHDV-NWDGAFQWSA-N 1 2 305.447 4.047 20 0 DIADLO Cc1cc(Cl)ccc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000157796069 1053872520 /nfs/dbraw/zinc/87/25/20/1053872520.db2.gz QSITWNHLZCOQAW-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO Cc1cc(N[C@H](C[C@@H]2CCOC2)c2ccccc2)nc(C2CC2)[nH+]1 ZINC000157959054 1053877198 /nfs/dbraw/zinc/87/71/98/1053877198.db2.gz QROJXBGGBSEPRP-MAUKXSAKSA-N 1 2 323.440 4.242 20 0 DIADLO CCCOc1ncccc1C[N@H+](C)[C@@H](C)c1ccccc1OC ZINC001231864406 1053893673 /nfs/dbraw/zinc/89/36/73/1053893673.db2.gz PBXAJJBBLYKYLU-HNNXBMFYSA-N 1 2 314.429 4.072 20 0 DIADLO CCCOc1ncccc1C[N@@H+](C)[C@@H](C)c1ccccc1OC ZINC001231864406 1053893683 /nfs/dbraw/zinc/89/36/83/1053893683.db2.gz PBXAJJBBLYKYLU-HNNXBMFYSA-N 1 2 314.429 4.072 20 0 DIADLO CCc1cc(NC[C@@H](OC)c2cccc(Cl)c2)nc(CC)[nH+]1 ZINC001472707683 1053909775 /nfs/dbraw/zinc/90/97/75/1053909775.db2.gz WSLIOZYWUCEPJK-OAHLLOKOSA-N 1 2 319.836 4.054 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2cnc(C(F)(F)F)cc2Cl)C1 ZINC001231901862 1053911969 /nfs/dbraw/zinc/91/19/69/1053911969.db2.gz VLUYUMCHFBXICK-CYBMUJFWSA-N 1 2 324.749 4.468 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2cnc(C(F)(F)F)cc2Cl)C1 ZINC001231901862 1053911980 /nfs/dbraw/zinc/91/19/80/1053911980.db2.gz VLUYUMCHFBXICK-CYBMUJFWSA-N 1 2 324.749 4.468 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2cnc(C(F)(F)F)cc2Cl)C1 ZINC001231901863 1053912368 /nfs/dbraw/zinc/91/23/68/1053912368.db2.gz VLUYUMCHFBXICK-ZDUSSCGKSA-N 1 2 324.749 4.468 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2cnc(C(F)(F)F)cc2Cl)C1 ZINC001231901863 1053912376 /nfs/dbraw/zinc/91/23/76/1053912376.db2.gz VLUYUMCHFBXICK-ZDUSSCGKSA-N 1 2 324.749 4.468 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1cnc(C(F)(F)F)cc1Cl ZINC001231901321 1053912493 /nfs/dbraw/zinc/91/24/93/1053912493.db2.gz GIIYZCHPMJPLHZ-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1cnc(C(F)(F)F)cc1Cl ZINC001231901321 1053912506 /nfs/dbraw/zinc/91/25/06/1053912506.db2.gz GIIYZCHPMJPLHZ-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)cnc1F ZINC001231929053 1053920178 /nfs/dbraw/zinc/92/01/78/1053920178.db2.gz WHZDPNQYECFAQH-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)cnc1F ZINC001231929053 1053920191 /nfs/dbraw/zinc/92/01/91/1053920191.db2.gz WHZDPNQYECFAQH-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO CCCCCN(CCCCC)C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC001354599289 1053920821 /nfs/dbraw/zinc/92/08/21/1053920821.db2.gz DAISCYQSOOGKAZ-UHFFFAOYSA-N 1 2 315.461 4.465 20 0 DIADLO Clc1nccc2ccc(C[N@@H+]3CCOc4ccccc4C3)cc21 ZINC001231977862 1053927293 /nfs/dbraw/zinc/92/72/93/1053927293.db2.gz TZVDNHDOWJZGCQ-UHFFFAOYSA-N 1 2 324.811 4.283 20 0 DIADLO Clc1nccc2ccc(C[N@H+]3CCOc4ccccc4C3)cc21 ZINC001231977862 1053927306 /nfs/dbraw/zinc/92/73/06/1053927306.db2.gz TZVDNHDOWJZGCQ-UHFFFAOYSA-N 1 2 324.811 4.283 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cnc(F)cc1C ZINC001231984736 1053928972 /nfs/dbraw/zinc/92/89/72/1053928972.db2.gz AWQLZHJMAPCBRO-QGZVFWFLSA-N 1 2 314.404 4.013 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cnc(F)cc1C ZINC001231984736 1053928982 /nfs/dbraw/zinc/92/89/82/1053928982.db2.gz AWQLZHJMAPCBRO-QGZVFWFLSA-N 1 2 314.404 4.013 20 0 DIADLO Cc1ccc2[nH]c(C(=O)Nc3ccc4[nH+]ccn4c3)c(Cl)c2c1 ZINC001328415483 1053930333 /nfs/dbraw/zinc/93/03/33/1053930333.db2.gz JOZGQCWTGXBVFT-UHFFFAOYSA-N 1 2 324.771 4.030 20 0 DIADLO Cc1cc(C(F)(F)F)ccc1C[N@H+](C)CC(=O)c1ccccc1 ZINC001232005993 1053935095 /nfs/dbraw/zinc/93/50/95/1053935095.db2.gz UHUZZUODVVZBAM-UHFFFAOYSA-N 1 2 321.342 4.329 20 0 DIADLO Cc1cc(C(F)(F)F)ccc1C[N@@H+](C)CC(=O)c1ccccc1 ZINC001232005993 1053935108 /nfs/dbraw/zinc/93/51/08/1053935108.db2.gz UHUZZUODVVZBAM-UHFFFAOYSA-N 1 2 321.342 4.329 20 0 DIADLO F[C@@H]1CCC[N@H+](Cc2cc(C(F)(F)F)cnc2Cl)CC1 ZINC001232005896 1053936983 /nfs/dbraw/zinc/93/69/83/1053936983.db2.gz OZPUVSXKLKTKHH-LLVKDONJSA-N 1 2 310.722 4.078 20 0 DIADLO F[C@@H]1CCC[N@@H+](Cc2cc(C(F)(F)F)cnc2Cl)CC1 ZINC001232005896 1053936994 /nfs/dbraw/zinc/93/69/94/1053936994.db2.gz OZPUVSXKLKTKHH-LLVKDONJSA-N 1 2 310.722 4.078 20 0 DIADLO FC(F)(F)c1cnc(Cl)c(C[N@@H+]2CCC3(CCC3)C2)c1 ZINC001232009452 1053940751 /nfs/dbraw/zinc/94/07/51/1053940751.db2.gz FUVCTRNWUBNCKG-UHFFFAOYSA-N 1 2 304.743 4.130 20 0 DIADLO FC(F)(F)c1cnc(Cl)c(C[N@H+]2CCC3(CCC3)C2)c1 ZINC001232009452 1053940762 /nfs/dbraw/zinc/94/07/62/1053940762.db2.gz FUVCTRNWUBNCKG-UHFFFAOYSA-N 1 2 304.743 4.130 20 0 DIADLO CSC1CC[NH+](Cc2cc(C(F)(F)F)cnc2Cl)CC1 ZINC001232009874 1053940987 /nfs/dbraw/zinc/94/09/87/1053940987.db2.gz UAPSAQWMMFQJJG-UHFFFAOYSA-N 1 2 324.799 4.081 20 0 DIADLO Clc1ccc(Br)c(C[N@@H+]2CCC23CCCC3)n1 ZINC001232056839 1053951777 /nfs/dbraw/zinc/95/17/77/1053951777.db2.gz FJRFZZVBEORWAY-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Clc1ccc(Br)c(C[N@H+]2CCC23CCCC3)n1 ZINC001232056839 1053951787 /nfs/dbraw/zinc/95/17/87/1053951787.db2.gz FJRFZZVBEORWAY-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1cccc(C(F)(F)F)n1 ZINC001232066885 1053952030 /nfs/dbraw/zinc/95/20/30/1053952030.db2.gz MDVHKBBKQPPIIE-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cccc(C(F)(F)F)n1 ZINC001232066885 1053952041 /nfs/dbraw/zinc/95/20/41/1053952041.db2.gz MDVHKBBKQPPIIE-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO CCCc1ccccc1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001354723081 1053953282 /nfs/dbraw/zinc/95/32/82/1053953282.db2.gz YEWZVYUIZSPHCW-UHFFFAOYSA-N 1 2 305.381 4.077 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cccc(C(F)(F)F)n1 ZINC001232073146 1053953585 /nfs/dbraw/zinc/95/35/85/1053953585.db2.gz BYACUIGOICTFTQ-GFCCVEGCSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cccc(C(F)(F)F)n1 ZINC001232073146 1053953597 /nfs/dbraw/zinc/95/35/97/1053953597.db2.gz BYACUIGOICTFTQ-GFCCVEGCSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@@H]([NH2+]Cc1cncc(Cl)c1)c1nc(C(C)(C)C)cs1 ZINC001328757136 1053954449 /nfs/dbraw/zinc/95/44/49/1053954449.db2.gz LULGOWCUDHPBQR-SNVBAGLBSA-N 1 2 309.866 4.340 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)c(C)n1 ZINC001232083640 1053958880 /nfs/dbraw/zinc/95/88/80/1053958880.db2.gz FCDZJHSXTHTTJK-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)c(C)n1 ZINC001232083640 1053958894 /nfs/dbraw/zinc/95/88/94/1053958894.db2.gz FCDZJHSXTHTTJK-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C)c(CNC(=O)C[C@@H]2C[C@H](C)c3c2cccc3C)c[nH+]1 ZINC001436735474 1053959879 /nfs/dbraw/zinc/95/98/79/1053959879.db2.gz FEFAXYZHMVZWEG-RDJZCZTQSA-N 1 2 322.452 4.304 20 0 DIADLO Cc1cc(C)c(CNC(=O)CCc2ccc(CC(C)C)cc2)c[nH+]1 ZINC001436736395 1053961313 /nfs/dbraw/zinc/96/13/13/1053961313.db2.gz JOVGVEXZFMANEA-UHFFFAOYSA-N 1 2 324.468 4.146 20 0 DIADLO CCOc1ccc(Cl)cc1C[NH2+]Cc1nc(C)c(C)s1 ZINC001200774748 1053962742 /nfs/dbraw/zinc/96/27/42/1053962742.db2.gz PUNVYYXUXFVYQE-UHFFFAOYSA-N 1 2 310.850 4.102 20 0 DIADLO FC[C@H]1CCC[N@@H+]1Cc1cc(F)ccc1OCc1ccccc1 ZINC001232118348 1053967713 /nfs/dbraw/zinc/96/77/13/1053967713.db2.gz HDHZAMDGDBJRLB-GOSISDBHSA-N 1 2 317.379 4.339 20 0 DIADLO FC[C@H]1CCC[N@H+]1Cc1cc(F)ccc1OCc1ccccc1 ZINC001232118348 1053967727 /nfs/dbraw/zinc/96/77/27/1053967727.db2.gz HDHZAMDGDBJRLB-GOSISDBHSA-N 1 2 317.379 4.339 20 0 DIADLO c1ccc(NC2CCN(c3[nH+]ccc4ccccc43)CC2)cc1 ZINC001329174987 1053971740 /nfs/dbraw/zinc/97/17/40/1053971740.db2.gz KDDIAJNXEDUXRP-UHFFFAOYSA-N 1 2 303.409 4.316 20 0 DIADLO CC[N@H+](Cc1ccc(C)cc1)Cc1c(Cl)nccc1OC ZINC001232159606 1053974902 /nfs/dbraw/zinc/97/49/02/1053974902.db2.gz KXTKHFINRYQSKE-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CC[N@@H+](Cc1ccc(C)cc1)Cc1c(Cl)nccc1OC ZINC001232159606 1053974915 /nfs/dbraw/zinc/97/49/15/1053974915.db2.gz KXTKHFINRYQSKE-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO C[N@H+](Cc1cccc2cccnc21)Cc1nc(Cl)ccc1F ZINC001232160782 1053975976 /nfs/dbraw/zinc/97/59/76/1053975976.db2.gz YIXVJCDKRXJOLQ-UHFFFAOYSA-N 1 2 315.779 4.054 20 0 DIADLO C[N@@H+](Cc1cccc2cccnc21)Cc1nc(Cl)ccc1F ZINC001232160782 1053975988 /nfs/dbraw/zinc/97/59/88/1053975988.db2.gz YIXVJCDKRXJOLQ-UHFFFAOYSA-N 1 2 315.779 4.054 20 0 DIADLO Cc1ccc(Cl)c(O[C@H]2CCC[N@H+](Cc3ccns3)C2)c1 ZINC001232192928 1053983533 /nfs/dbraw/zinc/98/35/33/1053983533.db2.gz GALBMQARZYLLKJ-ZDUSSCGKSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1ccc(Cl)c(O[C@H]2CCC[N@@H+](Cc3ccns3)C2)c1 ZINC001232192928 1053983545 /nfs/dbraw/zinc/98/35/45/1053983545.db2.gz GALBMQARZYLLKJ-ZDUSSCGKSA-N 1 2 322.861 4.148 20 0 DIADLO CC[N@H+](Cc1ncsc1C)Cc1cccc(C(F)(F)F)c1 ZINC001232205508 1053986115 /nfs/dbraw/zinc/98/61/15/1053986115.db2.gz PSRWLWMRCQNART-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CC[N@@H+](Cc1ncsc1C)Cc1cccc(C(F)(F)F)c1 ZINC001232205508 1053986131 /nfs/dbraw/zinc/98/61/31/1053986131.db2.gz PSRWLWMRCQNART-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO Cc1scnc1C[NH+]1CCC(Oc2ccc(Cl)cc2)CC1 ZINC001232210882 1053988253 /nfs/dbraw/zinc/98/82/53/1053988253.db2.gz VAOBNMHGOCSQSQ-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO Fc1cccc2c(C[N@@H+]3CCC[C@@H]3c3nccs3)ccnc12 ZINC001232211507 1053988695 /nfs/dbraw/zinc/98/86/95/1053988695.db2.gz GLCDZEDLDLGKEL-OAHLLOKOSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1cccc2c(C[N@H+]3CCC[C@@H]3c3nccs3)ccnc12 ZINC001232211507 1053988706 /nfs/dbraw/zinc/98/87/06/1053988706.db2.gz GLCDZEDLDLGKEL-OAHLLOKOSA-N 1 2 313.401 4.168 20 0 DIADLO Cc1scnc1C[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC001232207039 1053990388 /nfs/dbraw/zinc/99/03/88/1053990388.db2.gz UBZQFECKCLTYBQ-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1scnc1C[N@H+](C)Cc1ccccc1C(F)(F)F ZINC001232207039 1053990398 /nfs/dbraw/zinc/99/03/98/1053990398.db2.gz UBZQFECKCLTYBQ-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cccn1Cc1ccccc1)C2 ZINC001232233003 1053999216 /nfs/dbraw/zinc/99/92/16/1053999216.db2.gz BHMDCHDZOUEBKN-UHFFFAOYSA-N 1 2 318.420 4.061 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cccn1Cc1ccccc1)C2 ZINC001232233003 1053999224 /nfs/dbraw/zinc/99/92/24/1053999224.db2.gz BHMDCHDZOUEBKN-UHFFFAOYSA-N 1 2 318.420 4.061 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccnc(C(F)(F)F)c1 ZINC001232240418 1054001817 /nfs/dbraw/zinc/00/18/17/1054001817.db2.gz GZQNWHZXKSBXSP-GFCCVEGCSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccnc(C(F)(F)F)c1 ZINC001232240418 1054001823 /nfs/dbraw/zinc/00/18/23/1054001823.db2.gz GZQNWHZXKSBXSP-GFCCVEGCSA-N 1 2 306.331 4.047 20 0 DIADLO Cc1ccccc1[C@@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001354916249 1054003543 /nfs/dbraw/zinc/00/35/43/1054003543.db2.gz BAFOMXBFUNKRMN-CQSZACIVSA-N 1 2 323.371 4.062 20 0 DIADLO Cc1cccn2cc(C[N@H+](Cc3ccccc3F)C(C)C)nc12 ZINC000621731791 1054004796 /nfs/dbraw/zinc/00/47/96/1054004796.db2.gz VMVXMIOQGBWTEF-UHFFFAOYSA-N 1 2 311.404 4.192 20 0 DIADLO Cc1cccn2cc(C[N@@H+](Cc3ccccc3F)C(C)C)nc12 ZINC000621731791 1054004809 /nfs/dbraw/zinc/00/48/09/1054004809.db2.gz VMVXMIOQGBWTEF-UHFFFAOYSA-N 1 2 311.404 4.192 20 0 DIADLO FCCCC[NH2+][C@@H](c1ccc(Br)cc1)C(F)F ZINC000621761587 1054008570 /nfs/dbraw/zinc/00/85/70/1054008570.db2.gz IUVDYMHYPRMFOE-NSHDSACASA-N 1 2 310.157 4.095 20 0 DIADLO C[N@H+](Cc1cc(Cl)cs1)Cc1ncccc1C(F)(F)F ZINC001232278984 1054010600 /nfs/dbraw/zinc/01/06/00/1054010600.db2.gz YXAHWJQGGJKRER-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1cc(Cl)cs1)Cc1ncccc1C(F)(F)F ZINC001232278984 1054010607 /nfs/dbraw/zinc/01/06/07/1054010607.db2.gz YXAHWJQGGJKRER-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO CCOc1cccc(F)c1C[NH2+]Cc1cccc(Cl)c1F ZINC001200831476 1054019367 /nfs/dbraw/zinc/01/93/67/1054019367.db2.gz WTGFQFLXVZMERB-UHFFFAOYSA-N 1 2 311.759 4.307 20 0 DIADLO CC[N@H+](Cc1ccc(SC)nc1)Cc1cccc(F)c1F ZINC001232330428 1054022082 /nfs/dbraw/zinc/02/20/82/1054022082.db2.gz TYKQULRSGJLCHG-UHFFFAOYSA-N 1 2 308.397 4.104 20 0 DIADLO CC[N@@H+](Cc1ccc(SC)nc1)Cc1cccc(F)c1F ZINC001232330428 1054022096 /nfs/dbraw/zinc/02/20/96/1054022096.db2.gz TYKQULRSGJLCHG-UHFFFAOYSA-N 1 2 308.397 4.104 20 0 DIADLO COc1cc(C)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)cn1 ZINC001232354055 1054026674 /nfs/dbraw/zinc/02/66/74/1054026674.db2.gz KJEAGYLLADMZBM-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C)c(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)cn1 ZINC001232354055 1054026682 /nfs/dbraw/zinc/02/66/82/1054026682.db2.gz KJEAGYLLADMZBM-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C)c(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)cn1 ZINC001232354340 1054027907 /nfs/dbraw/zinc/02/79/07/1054027907.db2.gz MXZXPEAIFRZTTM-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C)c(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)cn1 ZINC001232354340 1054027916 /nfs/dbraw/zinc/02/79/16/1054027916.db2.gz MXZXPEAIFRZTTM-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO CCOc1ccc(OC)cc1C[N@H+](C)Cc1ccc(F)cc1F ZINC001232385902 1054034297 /nfs/dbraw/zinc/03/42/97/1054034297.db2.gz XJAXANRAYIHJMJ-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CCOc1ccc(OC)cc1C[N@@H+](C)Cc1ccc(F)cc1F ZINC001232385902 1054034311 /nfs/dbraw/zinc/03/43/11/1054034311.db2.gz XJAXANRAYIHJMJ-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO Cc1cn2c(cccc2NC(=S)Nc2ccccc2Cl)[nH+]1 ZINC001200847079 1054034859 /nfs/dbraw/zinc/03/48/59/1054034859.db2.gz GWGPEYTYAZFPPR-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1cccc(C)c1OC(C)C)C2 ZINC001232392837 1054037870 /nfs/dbraw/zinc/03/78/70/1054037870.db2.gz DARBKSZEZHJCRG-UHFFFAOYSA-N 1 2 311.425 4.307 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1cccc(C)c1OC(C)C)C2 ZINC001232392837 1054037884 /nfs/dbraw/zinc/03/78/84/1054037884.db2.gz DARBKSZEZHJCRG-UHFFFAOYSA-N 1 2 311.425 4.307 20 0 DIADLO Cc1c(F)cc(C[N@H+](C)Cc2cnc(Cl)s2)cc1F ZINC001232419387 1054043250 /nfs/dbraw/zinc/04/32/50/1054043250.db2.gz DVAULDDBSLXBET-UHFFFAOYSA-N 1 2 302.777 4.015 20 0 DIADLO Cc1c(F)cc(C[N@@H+](C)Cc2cnc(Cl)s2)cc1F ZINC001232419387 1054043266 /nfs/dbraw/zinc/04/32/66/1054043266.db2.gz DVAULDDBSLXBET-UHFFFAOYSA-N 1 2 302.777 4.015 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)nc2ccccc12 ZINC000171102317 1054048902 /nfs/dbraw/zinc/04/89/02/1054048902.db2.gz YFVCBNJKCKUAQP-AWEZNQCLSA-N 1 2 309.388 4.270 20 0 DIADLO Cc1nc(C[N@H+](C)[C@@H](C)c2ccc(F)cc2)nc2ccccc12 ZINC000171102317 1054048909 /nfs/dbraw/zinc/04/89/09/1054048909.db2.gz YFVCBNJKCKUAQP-AWEZNQCLSA-N 1 2 309.388 4.270 20 0 DIADLO Cc1cc(Br)c(C[NH+]2CC3(C2)CCCC3)cc1F ZINC001232466640 1054049572 /nfs/dbraw/zinc/04/95/72/1054049572.db2.gz PWPNMFHMAUYXTG-UHFFFAOYSA-N 1 2 312.226 4.273 20 0 DIADLO Clc1ccnc2[nH]cc(C[N@@H+]3CCC[C@H]3c3nccs3)c21 ZINC001232463408 1054050323 /nfs/dbraw/zinc/05/03/23/1054050323.db2.gz JPANXUYGKXBLIP-LBPRGKRZSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1ccnc2[nH]cc(C[N@H+]3CCC[C@H]3c3nccs3)c21 ZINC001232463408 1054050335 /nfs/dbraw/zinc/05/03/35/1054050335.db2.gz JPANXUYGKXBLIP-LBPRGKRZSA-N 1 2 318.833 4.010 20 0 DIADLO Cc1[nH]c(CN2CCCC[C@@H]2c2ccccc2C(F)(F)F)c[nH+]1 ZINC001232467287 1054052165 /nfs/dbraw/zinc/05/21/65/1054052165.db2.gz FJSDGGMJQFJXLE-MRXNPFEDSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1nc(C[N@@H+]2CCSC[C@H]2c2cccc3ccccc32)c[nH]1 ZINC001232467155 1054054354 /nfs/dbraw/zinc/05/43/54/1054054354.db2.gz CQMBHANTMSTJGO-IBGZPJMESA-N 1 2 323.465 4.161 20 0 DIADLO Cc1nc(C[N@H+]2CCSC[C@H]2c2cccc3ccccc32)c[nH]1 ZINC001232467155 1054054365 /nfs/dbraw/zinc/05/43/65/1054054365.db2.gz CQMBHANTMSTJGO-IBGZPJMESA-N 1 2 323.465 4.161 20 0 DIADLO Cc1ncc(C[N@@H+]2CCSC[C@H]2c2cccc3ccccc32)[nH]1 ZINC001232467155 1054054374 /nfs/dbraw/zinc/05/43/74/1054054374.db2.gz CQMBHANTMSTJGO-IBGZPJMESA-N 1 2 323.465 4.161 20 0 DIADLO Cc1ncc(C[N@H+]2CCSC[C@H]2c2cccc3ccccc32)[nH]1 ZINC001232467155 1054054382 /nfs/dbraw/zinc/05/43/82/1054054382.db2.gz CQMBHANTMSTJGO-IBGZPJMESA-N 1 2 323.465 4.161 20 0 DIADLO FCc1cccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)n1 ZINC001232536809 1054066332 /nfs/dbraw/zinc/06/63/32/1054066332.db2.gz PVVYCHZQRRVEQJ-QGZVFWFLSA-N 1 2 306.331 4.166 20 0 DIADLO FCc1cccc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)n1 ZINC001232536809 1054066343 /nfs/dbraw/zinc/06/63/43/1054066343.db2.gz PVVYCHZQRRVEQJ-QGZVFWFLSA-N 1 2 306.331 4.166 20 0 DIADLO C[N@H+](Cc1cccc(CF)n1)Cc1ccc(Cl)cc1Cl ZINC001232532830 1054067765 /nfs/dbraw/zinc/06/77/65/1054067765.db2.gz ARBCTLPTYXJVHL-UHFFFAOYSA-N 1 2 313.203 4.490 20 0 DIADLO C[N@@H+](Cc1cccc(CF)n1)Cc1ccc(Cl)cc1Cl ZINC001232532830 1054067776 /nfs/dbraw/zinc/06/77/76/1054067776.db2.gz ARBCTLPTYXJVHL-UHFFFAOYSA-N 1 2 313.203 4.490 20 0 DIADLO COCc1ccc(CNc2[nH+]c3ccccc3n2C(C)(C)C)o1 ZINC001331258784 1054067890 /nfs/dbraw/zinc/06/78/90/1054067890.db2.gz SGOIXTFNJXWSPV-UHFFFAOYSA-N 1 2 313.401 4.143 20 0 DIADLO Cc1nc(C)c(CNc2[nH+]c3ccccc3n2C(C)(C)C)s1 ZINC001331258469 1054068772 /nfs/dbraw/zinc/06/87/72/1054068772.db2.gz OVPSXQWXZVCGJC-UHFFFAOYSA-N 1 2 314.458 4.477 20 0 DIADLO CCC(C)(C)CC(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001355162755 1054069331 /nfs/dbraw/zinc/06/93/31/1054069331.db2.gz PTJNPZBQXXASAA-OAHLLOKOSA-N 1 2 319.493 4.170 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1cnc(Cl)cc1Br ZINC001232685334 1054102178 /nfs/dbraw/zinc/10/21/78/1054102178.db2.gz WQYKCZVQTLRMQZ-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1cnc(Cl)cc1Br ZINC001232685334 1054102190 /nfs/dbraw/zinc/10/21/90/1054102190.db2.gz WQYKCZVQTLRMQZ-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO C[C@H]1C[C@H]([NH2+]C(c2ccccc2)c2ccccc2)c2nccn21 ZINC000293876316 1054072231 /nfs/dbraw/zinc/07/22/31/1054072231.db2.gz FHFQFUSSJZOTIA-YJBOKZPZSA-N 1 2 303.409 4.268 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)c(C)[nH+]1 ZINC001355213437 1054083189 /nfs/dbraw/zinc/08/31/89/1054083189.db2.gz YVZBTZIZCZXSBR-FUHWJXTLSA-N 1 2 308.425 4.025 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001331675843 1054085970 /nfs/dbraw/zinc/08/59/70/1054085970.db2.gz LEBWYUNFYFNWSV-TZMCWYRMSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001331675843 1054085985 /nfs/dbraw/zinc/08/59/85/1054085985.db2.gz LEBWYUNFYFNWSV-TZMCWYRMSA-N 1 2 323.362 4.240 20 0 DIADLO FC(F)[C@H](CCc1ccccc1)[NH2+]Cc1cccn1C1CC1 ZINC001331803712 1054091170 /nfs/dbraw/zinc/09/11/70/1054091170.db2.gz PHYCHNNGQHXGIU-KRWDZBQOSA-N 1 2 304.384 4.179 20 0 DIADLO Fc1ccc(Cl)c(Br)c1C[N@@H+]1CCCC12CC2 ZINC001232692127 1054102626 /nfs/dbraw/zinc/10/26/26/1054102626.db2.gz QNPQIAONHNGPEG-UHFFFAOYSA-N 1 2 318.617 4.370 20 0 DIADLO Fc1ccc(Cl)c(Br)c1C[N@H+]1CCCC12CC2 ZINC001232692127 1054102633 /nfs/dbraw/zinc/10/26/33/1054102633.db2.gz QNPQIAONHNGPEG-UHFFFAOYSA-N 1 2 318.617 4.370 20 0 DIADLO CCCO[C@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2Cl)C1 ZINC001232699678 1054104907 /nfs/dbraw/zinc/10/49/07/1054104907.db2.gz BCPKQDPZJKEVTI-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2Cl)C1 ZINC001232699678 1054104915 /nfs/dbraw/zinc/10/49/15/1054104915.db2.gz BCPKQDPZJKEVTI-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO Fc1cc(C[N@@H+]2CC[C@@]3(C2)CCCCO3)c(Cl)cc1Cl ZINC001232703432 1054104961 /nfs/dbraw/zinc/10/49/61/1054104961.db2.gz VDSBWCOIOQVVRE-OAHLLOKOSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1cc(C[N@H+]2CC[C@@]3(C2)CCCCO3)c(Cl)cc1Cl ZINC001232703432 1054104969 /nfs/dbraw/zinc/10/49/69/1054104969.db2.gz VDSBWCOIOQVVRE-OAHLLOKOSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1cc(C[N@@H+]2CC[C@]3(C2)CCCCO3)c(Cl)cc1Cl ZINC001232703431 1054105389 /nfs/dbraw/zinc/10/53/89/1054105389.db2.gz VDSBWCOIOQVVRE-HNNXBMFYSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1cc(C[N@H+]2CC[C@]3(C2)CCCCO3)c(Cl)cc1Cl ZINC001232703431 1054105393 /nfs/dbraw/zinc/10/53/93/1054105393.db2.gz VDSBWCOIOQVVRE-HNNXBMFYSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1cc(C[N@@H+]2CC[C@@H]3CCCO[C@H]3C2)c(Cl)cc1Cl ZINC001232703760 1054105463 /nfs/dbraw/zinc/10/54/63/1054105463.db2.gz ZIHQARDAMDXDJB-BONVTDFDSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1cc(C[N@H+]2CC[C@@H]3CCCO[C@H]3C2)c(Cl)cc1Cl ZINC001232703760 1054105468 /nfs/dbraw/zinc/10/54/68/1054105468.db2.gz ZIHQARDAMDXDJB-BONVTDFDSA-N 1 2 318.219 4.133 20 0 DIADLO F[C@H]1C[N@H+](Cc2cc3ccc(Cl)cc3[nH]2)CCCC1(F)F ZINC001232727587 1054107347 /nfs/dbraw/zinc/10/73/47/1054107347.db2.gz DXRTUAFVRZELOH-AWEZNQCLSA-N 1 2 316.754 4.391 20 0 DIADLO F[C@H]1C[N@@H+](Cc2cc3ccc(Cl)cc3[nH]2)CCCC1(F)F ZINC001232727587 1054107353 /nfs/dbraw/zinc/10/73/53/1054107353.db2.gz DXRTUAFVRZELOH-AWEZNQCLSA-N 1 2 316.754 4.391 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1cccc3ncsc31)C2 ZINC001232735791 1054109478 /nfs/dbraw/zinc/10/94/78/1054109478.db2.gz DHONHSNQPCIHGC-UHFFFAOYSA-N 1 2 300.814 4.466 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1cccc3ncsc31)C2 ZINC001232735791 1054109489 /nfs/dbraw/zinc/10/94/89/1054109489.db2.gz DHONHSNQPCIHGC-UHFFFAOYSA-N 1 2 300.814 4.466 20 0 DIADLO CC(C)[C@@H](CCc1ccccc1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001437909494 1054111081 /nfs/dbraw/zinc/11/10/81/1054111081.db2.gz NTGDFSQIXPECEL-GOSISDBHSA-N 1 2 321.424 4.178 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)c(F)c2)nn1 ZINC001332419968 1054118759 /nfs/dbraw/zinc/11/87/59/1054118759.db2.gz HXPLKUQSGOYRCA-WDEREUQCSA-N 1 2 310.804 4.063 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@@H]2COCc2ccccc2)c(F)cc1F ZINC001232783153 1054119413 /nfs/dbraw/zinc/11/94/13/1054119413.db2.gz SCGNMSFLLKEATE-QGZVFWFLSA-N 1 2 317.379 4.064 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@@H]2COCc2ccccc2)c(F)cc1F ZINC001232783153 1054119422 /nfs/dbraw/zinc/11/94/22/1054119422.db2.gz SCGNMSFLLKEATE-QGZVFWFLSA-N 1 2 317.379 4.064 20 0 DIADLO COc1cc(O)cc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c1 ZINC001232806546 1054125259 /nfs/dbraw/zinc/12/52/59/1054125259.db2.gz FISJWTZYIHQVEP-QGZVFWFLSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cc(O)cc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)c1 ZINC001232806546 1054125263 /nfs/dbraw/zinc/12/52/63/1054125263.db2.gz FISJWTZYIHQVEP-QGZVFWFLSA-N 1 2 319.351 4.016 20 0 DIADLO Clc1cc2[nH]cc(C[N@@H+]3Cc4cccc(Cl)c4C3)c2cn1 ZINC001232824049 1054127844 /nfs/dbraw/zinc/12/78/44/1054127844.db2.gz OWOJBVLFMZYYCW-UHFFFAOYSA-N 1 2 318.207 4.386 20 0 DIADLO Clc1cc2[nH]cc(C[N@H+]3Cc4cccc(Cl)c4C3)c2cn1 ZINC001232824049 1054127850 /nfs/dbraw/zinc/12/78/50/1054127850.db2.gz OWOJBVLFMZYYCW-UHFFFAOYSA-N 1 2 318.207 4.386 20 0 DIADLO CC[C@H](c1ccccc1)N1CC[NH+](Cc2cccs2)CC1 ZINC000622260824 1054131265 /nfs/dbraw/zinc/13/12/65/1054131265.db2.gz XPSBRTQSMLBGJZ-GOSISDBHSA-N 1 2 300.471 4.017 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(Br)co2)cn1 ZINC001232857909 1054131979 /nfs/dbraw/zinc/13/19/79/1054131979.db2.gz XRNABJMAYSLROG-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc(Br)co2)cn1 ZINC001232857909 1054131994 /nfs/dbraw/zinc/13/19/94/1054131994.db2.gz XRNABJMAYSLROG-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO Fc1ccc(C[N@H+]2CC[C@@H](F)C(F)(F)CC2)c(Cl)c1F ZINC001232874652 1054134749 /nfs/dbraw/zinc/13/47/49/1054134749.db2.gz ZAZSQKAOAZFRFF-SNVBAGLBSA-N 1 2 313.697 4.187 20 0 DIADLO Fc1ccc(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c(Cl)c1F ZINC001232874652 1054134756 /nfs/dbraw/zinc/13/47/56/1054134756.db2.gz ZAZSQKAOAZFRFF-SNVBAGLBSA-N 1 2 313.697 4.187 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2ccc(-c3cccc(F)c3)nc2)C[C@@H]1F ZINC001232884376 1054137967 /nfs/dbraw/zinc/13/79/67/1054137967.db2.gz FVLMCUOSKYPRGE-ZWKOTPCHSA-N 1 2 320.358 4.160 20 0 DIADLO CC(C)c1ocnc1C[NH2+][C@@H](C)c1ccc(C(F)(F)F)nc1 ZINC001333072855 1054138009 /nfs/dbraw/zinc/13/80/09/1054138009.db2.gz ZXIPIQOSIAVONZ-JTQLQIEISA-N 1 2 313.323 4.063 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2ccc(-c3cccc(F)c3)nc2)C[C@@H]1F ZINC001232884376 1054137973 /nfs/dbraw/zinc/13/79/73/1054137973.db2.gz FVLMCUOSKYPRGE-ZWKOTPCHSA-N 1 2 320.358 4.160 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2cc(C)cc(O)c2)on1 ZINC001232886256 1054141763 /nfs/dbraw/zinc/14/17/63/1054141763.db2.gz QIVQIIDEWASNAJ-UHFFFAOYSA-N 1 2 322.408 4.199 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2cc(C)cc(O)c2)on1 ZINC001232886256 1054141768 /nfs/dbraw/zinc/14/17/68/1054141768.db2.gz QIVQIIDEWASNAJ-UHFFFAOYSA-N 1 2 322.408 4.199 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncoc1C(C)C)c1cc(F)ccc1OC ZINC001333318589 1054149632 /nfs/dbraw/zinc/14/96/32/1054149632.db2.gz IPTRGQMYAFYUFZ-CQSZACIVSA-N 1 2 306.381 4.187 20 0 DIADLO Clc1cnc(Br)c(C[N@@H+]2CCC23CCCC3)c1 ZINC001232958299 1054158613 /nfs/dbraw/zinc/15/86/13/1054158613.db2.gz JRDVTGJQNWEHBH-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Clc1cnc(Br)c(C[N@H+]2CCC23CCCC3)c1 ZINC001232958299 1054158618 /nfs/dbraw/zinc/15/86/18/1054158618.db2.gz JRDVTGJQNWEHBH-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Oc1cc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)cc(F)c1F ZINC001232970047 1054162014 /nfs/dbraw/zinc/16/20/14/1054162014.db2.gz GWZUSUZGKXZGEI-MRXNPFEDSA-N 1 2 303.352 4.398 20 0 DIADLO Oc1cc(C[N@H+]2CCCC[C@@H]2c2ccccc2)cc(F)c1F ZINC001232970047 1054162020 /nfs/dbraw/zinc/16/20/20/1054162020.db2.gz GWZUSUZGKXZGEI-MRXNPFEDSA-N 1 2 303.352 4.398 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(O)c(F)c(F)c2)cc1 ZINC001232970525 1054162106 /nfs/dbraw/zinc/16/21/06/1054162106.db2.gz FSBJXIBICROZBI-MRXNPFEDSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc(O)c(F)c(F)c2)cc1 ZINC001232970525 1054162125 /nfs/dbraw/zinc/16/21/25/1054162125.db2.gz FSBJXIBICROZBI-MRXNPFEDSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)cn1 ZINC001233012479 1054171458 /nfs/dbraw/zinc/17/14/58/1054171458.db2.gz NKGLDFINFNNJBL-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)cn1 ZINC001233012479 1054171460 /nfs/dbraw/zinc/17/14/60/1054171460.db2.gz NKGLDFINFNNJBL-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1nc(C[N@@H+]2[C@H](C)CO[C@@H](c3ccccc3)[C@@H]2C)c(C)s1 ZINC001333926330 1054177814 /nfs/dbraw/zinc/17/78/14/1054177814.db2.gz LICHJMRIEULIRG-FHSNZYRGSA-N 1 2 316.470 4.110 20 0 DIADLO Cc1nc(C[N@H+]2[C@H](C)CO[C@@H](c3ccccc3)[C@@H]2C)c(C)s1 ZINC001333926330 1054177819 /nfs/dbraw/zinc/17/78/19/1054177819.db2.gz LICHJMRIEULIRG-FHSNZYRGSA-N 1 2 316.470 4.110 20 0 DIADLO Oc1cccc(C[N@@H+]2CCCC[C@H]2c2ccccc2F)c1F ZINC001233052085 1054177692 /nfs/dbraw/zinc/17/76/92/1054177692.db2.gz FVRXVVHGFIOETG-INIZCTEOSA-N 1 2 303.352 4.398 20 0 DIADLO Oc1cccc(C[N@H+]2CCCC[C@H]2c2ccccc2F)c1F ZINC001233052085 1054177697 /nfs/dbraw/zinc/17/76/97/1054177697.db2.gz FVRXVVHGFIOETG-INIZCTEOSA-N 1 2 303.352 4.398 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccccc2Br)cnc1C ZINC001233157079 1054191542 /nfs/dbraw/zinc/19/15/42/1054191542.db2.gz YLHKGSPLJLCUCS-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ccc(Cl)c(Br)n2)[C@@H]1C ZINC001233092529 1054185697 /nfs/dbraw/zinc/18/56/97/1054185697.db2.gz MXXYHPGVRJEDCS-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)c(Br)n2)[C@@H]1C ZINC001233092529 1054185708 /nfs/dbraw/zinc/18/57/08/1054185708.db2.gz MXXYHPGVRJEDCS-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO CCOc1c(Cl)cc(C[N@@H+]2CCC[C@H](OC)C2)cc1Cl ZINC001233109013 1054188527 /nfs/dbraw/zinc/18/85/27/1054188527.db2.gz XSGGWEZUCIACQB-LBPRGKRZSA-N 1 2 318.244 4.003 20 0 DIADLO CCOc1c(Cl)cc(C[N@H+]2CCC[C@H](OC)C2)cc1Cl ZINC001233109013 1054188532 /nfs/dbraw/zinc/18/85/32/1054188532.db2.gz XSGGWEZUCIACQB-LBPRGKRZSA-N 1 2 318.244 4.003 20 0 DIADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)cnc1C ZINC001233155918 1054190281 /nfs/dbraw/zinc/19/02/81/1054190281.db2.gz JEPQTFUHJFRVQD-NRFANRHFSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1cc(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)cnc1C ZINC001233155918 1054190290 /nfs/dbraw/zinc/19/02/90/1054190290.db2.gz JEPQTFUHJFRVQD-NRFANRHFSA-N 1 2 317.436 4.105 20 0 DIADLO CCC[N@H+](Cc1nc(C)sc1Br)[C@@H](C)CC ZINC001233150353 1054191142 /nfs/dbraw/zinc/19/11/42/1054191142.db2.gz GZOIJLOOVBOGOX-VIFPVBQESA-N 1 2 305.285 4.225 20 0 DIADLO CCC[N@@H+](Cc1nc(C)sc1Br)[C@@H](C)CC ZINC001233150353 1054191148 /nfs/dbraw/zinc/19/11/48/1054191148.db2.gz GZOIJLOOVBOGOX-VIFPVBQESA-N 1 2 305.285 4.225 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccccc2Br)cnc1C ZINC001233157079 1054191540 /nfs/dbraw/zinc/19/15/40/1054191540.db2.gz YLHKGSPLJLCUCS-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO CC(C)Oc1ncc(Cl)cc1C[NH+]1CC2(C1)CCCCC2 ZINC001233165363 1054193960 /nfs/dbraw/zinc/19/39/60/1054193960.db2.gz CCIIWAISOHZXNZ-UHFFFAOYSA-N 1 2 308.853 4.288 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)cs1 ZINC001233177086 1054196317 /nfs/dbraw/zinc/19/63/17/1054196317.db2.gz GANFCMLXHRDGDX-MRVPVSSYSA-N 1 2 303.271 4.151 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)cs1 ZINC001233177086 1054196321 /nfs/dbraw/zinc/19/63/21/1054196321.db2.gz GANFCMLXHRDGDX-MRVPVSSYSA-N 1 2 303.271 4.151 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccnc(Cl)c1Br ZINC001233178404 1054197914 /nfs/dbraw/zinc/19/79/14/1054197914.db2.gz SHJOLJLTDGWWTF-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1ccnc(Cl)c1Br ZINC001233181210 1054198612 /nfs/dbraw/zinc/19/86/12/1054198612.db2.gz HDDANEXFTDHAFY-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1ccnc(Cl)c1Br ZINC001233181210 1054198620 /nfs/dbraw/zinc/19/86/20/1054198620.db2.gz HDDANEXFTDHAFY-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO Clc1ccc(-c2ccc(C[N@@H+]3CCn4nccc4C3)cc2)cc1 ZINC001233218572 1054203237 /nfs/dbraw/zinc/20/32/37/1054203237.db2.gz BWMLRAZTXQUIAG-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Clc1ccc(-c2ccc(C[N@H+]3CCn4nccc4C3)cc2)cc1 ZINC001233218572 1054203246 /nfs/dbraw/zinc/20/32/46/1054203246.db2.gz BWMLRAZTXQUIAG-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccccc2Br)cc1O ZINC001233231754 1054208943 /nfs/dbraw/zinc/20/89/43/1054208943.db2.gz ZUHRTARDNSVKBO-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccccc2Br)cc1O ZINC001233231754 1054208952 /nfs/dbraw/zinc/20/89/52/1054208952.db2.gz ZUHRTARDNSVKBO-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ccc(C)c(O)c2)on1 ZINC001233235283 1054212570 /nfs/dbraw/zinc/21/25/70/1054212570.db2.gz OZFXQGBCOOMJKQ-UHFFFAOYSA-N 1 2 322.408 4.199 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2ccc(C)c(O)c2)on1 ZINC001233235283 1054212580 /nfs/dbraw/zinc/21/25/80/1054212580.db2.gz OZFXQGBCOOMJKQ-UHFFFAOYSA-N 1 2 322.408 4.199 20 0 DIADLO CC[C@@H]([NH2+]Cc1cnc(-c2ccccc2)o1)c1nc(C)cs1 ZINC001335765816 1054224278 /nfs/dbraw/zinc/22/42/78/1054224278.db2.gz UROLAEUZFDOKRO-OAHLLOKOSA-N 1 2 313.426 4.347 20 0 DIADLO Cc1cnsc1C[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC001233317917 1054229739 /nfs/dbraw/zinc/22/97/39/1054229739.db2.gz JLQAWYGOGGWCKE-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1cnsc1C[N@H+](C)Cc1ccc(Cl)cc1Cl ZINC001233317917 1054229753 /nfs/dbraw/zinc/22/97/53/1054229753.db2.gz JLQAWYGOGGWCKE-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO CSc1cccc(Cl)c1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC001233350266 1054239299 /nfs/dbraw/zinc/23/92/99/1054239299.db2.gz AXNDZHKFWMSVNF-UHFFFAOYSA-N 1 2 303.805 4.293 20 0 DIADLO CCCOc1cccc2c(NCc3cc(C)c[nH]c3=O)cc[nH+]c12 ZINC001336749987 1054244862 /nfs/dbraw/zinc/24/48/62/1054244862.db2.gz AQOTYIMYICKZBK-UHFFFAOYSA-N 1 2 323.396 4.045 20 0 DIADLO Cc1cc(N2CC3(CCC3)[C@H]2c2cccnc2)nc(C2CCC2)[nH+]1 ZINC001336726402 1054245409 /nfs/dbraw/zinc/24/54/09/1054245409.db2.gz PLDBVKLBWQRPJS-GOSISDBHSA-N 1 2 320.440 4.179 20 0 DIADLO C[N@H+](Cc1cnc2cccc(Cl)n12)Cc1ccccc1Cl ZINC001233358846 1054250291 /nfs/dbraw/zinc/25/02/91/1054250291.db2.gz YECOYAVZESDGCW-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1cnc2cccc(Cl)n12)Cc1ccccc1Cl ZINC001233358846 1054250303 /nfs/dbraw/zinc/25/03/03/1054250303.db2.gz YECOYAVZESDGCW-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@H+](Cc1sc2ccccc2c1Cl)Cc1cccc(N)n1 ZINC001233372069 1054252118 /nfs/dbraw/zinc/25/21/18/1054252118.db2.gz WBKLFJZBIXQPEH-UHFFFAOYSA-N 1 2 317.845 4.164 20 0 DIADLO C[N@@H+](Cc1sc2ccccc2c1Cl)Cc1cccc(N)n1 ZINC001233372069 1054252130 /nfs/dbraw/zinc/25/21/30/1054252130.db2.gz WBKLFJZBIXQPEH-UHFFFAOYSA-N 1 2 317.845 4.164 20 0 DIADLO CN(Cc1sc2ccccc2c1Cl)Cc1cccc(N)[nH+]1 ZINC001233372069 1054252139 /nfs/dbraw/zinc/25/21/39/1054252139.db2.gz WBKLFJZBIXQPEH-UHFFFAOYSA-N 1 2 317.845 4.164 20 0 DIADLO CC[N@H+](Cc1ccc(N)cc1Cl)Cc1cccc(F)c1F ZINC001233377074 1054252191 /nfs/dbraw/zinc/25/21/91/1054252191.db2.gz MWLIWWMUXKPBRW-UHFFFAOYSA-N 1 2 310.775 4.223 20 0 DIADLO CC[N@@H+](Cc1ccc(N)cc1Cl)Cc1cccc(F)c1F ZINC001233377074 1054252205 /nfs/dbraw/zinc/25/22/05/1054252205.db2.gz MWLIWWMUXKPBRW-UHFFFAOYSA-N 1 2 310.775 4.223 20 0 DIADLO Cc1ncc(C[N@@H+]2[C@@H]3Cc4ccccc4[C@@]2(C)c2ccccc23)o1 ZINC001233368122 1054252508 /nfs/dbraw/zinc/25/25/08/1054252508.db2.gz XSFZGBYYZJFGBF-RTWAWAEBSA-N 1 2 316.404 4.360 20 0 DIADLO Cc1ncc(C[N@H+]2[C@@H]3Cc4ccccc4[C@@]2(C)c2ccccc23)o1 ZINC001233368122 1054252514 /nfs/dbraw/zinc/25/25/14/1054252514.db2.gz XSFZGBYYZJFGBF-RTWAWAEBSA-N 1 2 316.404 4.360 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccccc2)C2CC2)c(Cl)c1O ZINC001233400976 1054264384 /nfs/dbraw/zinc/26/43/84/1054264384.db2.gz HGPVJZSPSFEKOA-UHFFFAOYSA-N 1 2 317.816 4.219 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccccc2)C2CC2)c(Cl)c1O ZINC001233400976 1054264393 /nfs/dbraw/zinc/26/43/93/1054264393.db2.gz HGPVJZSPSFEKOA-UHFFFAOYSA-N 1 2 317.816 4.219 20 0 DIADLO Clc1ncnc(Cl)c1C[NH+]1CCC(c2ccccc2)CC1 ZINC001233408306 1054264509 /nfs/dbraw/zinc/26/45/09/1054264509.db2.gz IPNBJSOQUKTTOL-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO C[C@H]1C[N@H+](Cc2cn3cccc(Cl)c3n2)Cc2ccccc21 ZINC001233420475 1054265705 /nfs/dbraw/zinc/26/57/05/1054265705.db2.gz MLONYNHEUUCODZ-ZDUSSCGKSA-N 1 2 311.816 4.107 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cn3cccc(Cl)c3n2)Cc2ccccc21 ZINC001233420475 1054265717 /nfs/dbraw/zinc/26/57/17/1054265717.db2.gz MLONYNHEUUCODZ-ZDUSSCGKSA-N 1 2 311.816 4.107 20 0 DIADLO CC(C)(C)OC(=O)n1ccc(C[N@H+](Cc2ccco2)C2CC2)c1 ZINC001233433306 1054269518 /nfs/dbraw/zinc/26/95/18/1054269518.db2.gz WKPWZPAHFFJVCM-UHFFFAOYSA-N 1 2 316.401 4.029 20 0 DIADLO CC(C)(C)OC(=O)n1ccc(C[N@@H+](Cc2ccco2)C2CC2)c1 ZINC001233433306 1054269525 /nfs/dbraw/zinc/26/95/25/1054269525.db2.gz WKPWZPAHFFJVCM-UHFFFAOYSA-N 1 2 316.401 4.029 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(Br)ncc1Cl ZINC001233425147 1054271100 /nfs/dbraw/zinc/27/11/00/1054271100.db2.gz ORFQRTBJKGPQEJ-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cc(Br)ncc1Cl ZINC001233425147 1054271113 /nfs/dbraw/zinc/27/11/13/1054271113.db2.gz ORFQRTBJKGPQEJ-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO Clc1cnc(Br)cc1C[N@@H+]1CCC12CCCC2 ZINC001233426110 1054271476 /nfs/dbraw/zinc/27/14/76/1054271476.db2.gz YMCSNNUOBTVVHV-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Clc1cnc(Br)cc1C[N@H+]1CCC12CCCC2 ZINC001233426110 1054271491 /nfs/dbraw/zinc/27/14/91/1054271491.db2.gz YMCSNNUOBTVVHV-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1ccn(-c2cccc(F)c2)n1 ZINC000622586162 1054293676 /nfs/dbraw/zinc/29/36/76/1054293676.db2.gz ABLROXZJAAHVEH-CYBMUJFWSA-N 1 2 315.417 4.266 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1ccn(-c2cccc(F)c2)n1 ZINC000622586162 1054293684 /nfs/dbraw/zinc/29/36/84/1054293684.db2.gz ABLROXZJAAHVEH-CYBMUJFWSA-N 1 2 315.417 4.266 20 0 DIADLO Cc1cc(C)c(C(=O)NCC[C@@H]2C[C@H]2Cc2ccccc2)c(C)[nH+]1 ZINC001439882491 1054309892 /nfs/dbraw/zinc/30/98/92/1054309892.db2.gz ZTFMCLRJRFDCTP-RTBURBONSA-N 1 2 322.452 4.006 20 0 DIADLO Cc1cc(C)c(NC(=O)c2nc3ccccc3cc2C)c(C)[nH+]1 ZINC001356376920 1054324850 /nfs/dbraw/zinc/32/48/50/1054324850.db2.gz SFCFALHVTOAXKA-UHFFFAOYSA-N 1 2 305.381 4.116 20 0 DIADLO CCCCC[N@H+](Cn1nc(NC(C)C)sc1=S)C(C)C ZINC001339155219 1054325169 /nfs/dbraw/zinc/32/51/69/1054325169.db2.gz NZBJFQKIELCFTM-UHFFFAOYSA-N 1 2 316.540 4.352 20 0 DIADLO CCCCC[N@@H+](Cn1nc(NC(C)C)sc1=S)C(C)C ZINC001339155219 1054325186 /nfs/dbraw/zinc/32/51/86/1054325186.db2.gz NZBJFQKIELCFTM-UHFFFAOYSA-N 1 2 316.540 4.352 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1coc(-c2cccs2)n1 ZINC000171115317 1054346413 /nfs/dbraw/zinc/34/64/13/1054346413.db2.gz XODIJDBKJDELJI-LBPRGKRZSA-N 1 2 314.410 4.263 20 0 DIADLO Cc1ccc(NC(=O)[C@H](CC(C)C)n2cc[nH+]c2)cc1Cl ZINC001440572515 1054357852 /nfs/dbraw/zinc/35/78/52/1054357852.db2.gz AXARYYGNGLBMTN-HNNXBMFYSA-N 1 2 305.809 4.071 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc(C(F)F)ccc2F)c(C)[nH+]1 ZINC000622776300 1054379406 /nfs/dbraw/zinc/37/94/06/1054379406.db2.gz ACVHSWOKSUKQMF-UHFFFAOYSA-N 1 2 308.303 4.336 20 0 DIADLO Cc1cc(NCc2ccnc(OC(F)F)c2)[nH+]c2ccccc12 ZINC001341851097 1054411039 /nfs/dbraw/zinc/41/10/39/1054411039.db2.gz WRFLQFNVAXUADT-UHFFFAOYSA-N 1 2 315.323 4.152 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@@H](CC)c2ccc(F)cc2)n1 ZINC001342210782 1054419706 /nfs/dbraw/zinc/41/97/06/1054419706.db2.gz SNPSQQNGHLCCIK-WFASDCNBSA-N 1 2 305.397 4.353 20 0 DIADLO O=C(C/C=C\Cc1ccccc1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001442512511 1054423749 /nfs/dbraw/zinc/42/37/49/1054423749.db2.gz CTCAVJWHAXQOSQ-PLNGDYQASA-N 1 2 317.392 4.204 20 0 DIADLO Cc1ccccc1C[N@@H+](C)[C@@H](C)c1noc(-c2ccccc2)n1 ZINC000671239749 1054456672 /nfs/dbraw/zinc/45/66/72/1054456672.db2.gz LNCKSXAUVUBXCE-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccccc1C[N@H+](C)[C@@H](C)c1noc(-c2ccccc2)n1 ZINC000671239749 1054456677 /nfs/dbraw/zinc/45/66/77/1054456677.db2.gz LNCKSXAUVUBXCE-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1cccc2c1C[N@H+]([C@H](C)c1noc(-c3ccccc3)n1)CC2 ZINC000671243748 1054459379 /nfs/dbraw/zinc/45/93/79/1054459379.db2.gz UGKBCFMJIICYPM-OAHLLOKOSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1cccc2c1C[N@@H+]([C@H](C)c1noc(-c3ccccc3)n1)CC2 ZINC000671243748 1054459382 /nfs/dbraw/zinc/45/93/82/1054459382.db2.gz UGKBCFMJIICYPM-OAHLLOKOSA-N 1 2 319.408 4.164 20 0 DIADLO CC(C)CCC[C@@H](C)N(CCC(C)C)C(=O)Cc1c[nH+]c[nH]1 ZINC001444960877 1054493667 /nfs/dbraw/zinc/49/36/67/1054493667.db2.gz VBVFAEBDITVVPH-MRXNPFEDSA-N 1 2 307.482 4.042 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3CCC[C@H](F)C3)c2)[nH+]c1C ZINC001345639453 1054507149 /nfs/dbraw/zinc/50/71/49/1054507149.db2.gz UCCFCBVOVCIRCA-GJZGRUSLSA-N 1 2 315.392 4.160 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000174566770 1054513424 /nfs/dbraw/zinc/51/34/24/1054513424.db2.gz JPTHQVCADJXPPC-SGMGOOAPSA-N 1 2 303.377 4.402 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)s1 ZINC000341070328 1054515884 /nfs/dbraw/zinc/51/58/84/1054515884.db2.gz HPKWJANLDRZEQV-ZDUSSCGKSA-N 1 2 309.438 4.364 20 0 DIADLO Cc1nnc(C[NH2+][C@H](C)c2ccc(-c3ccccc3)cc2)s1 ZINC000341070319 1054517188 /nfs/dbraw/zinc/51/71/88/1054517188.db2.gz HPKWJANLDRZEQV-CYBMUJFWSA-N 1 2 309.438 4.364 20 0 DIADLO CCc1noc(C[NH2+][C@@H](c2ccc(CC(C)C)cc2)C(C)C)n1 ZINC000623048225 1054520702 /nfs/dbraw/zinc/52/07/02/1054520702.db2.gz MZGLVGDJEDDKAF-LJQANCHMSA-N 1 2 315.461 4.317 20 0 DIADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCC[C@@H]1CCC1CCCC1 ZINC001446106296 1054526904 /nfs/dbraw/zinc/52/69/04/1054526904.db2.gz IDGMAYXVMXQUDI-MRXNPFEDSA-N 1 2 311.429 4.138 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[NH2+][C@H](Cc1ccccc1)c1ncco1 ZINC001346438259 1054536729 /nfs/dbraw/zinc/53/67/29/1054536729.db2.gz NKQBPCPVDIKKHL-RBUKOAKNSA-N 1 2 322.383 4.375 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@@H](C)c2cccc(N(C)C)c2)cc1 ZINC001234587883 1054551278 /nfs/dbraw/zinc/55/12/78/1054551278.db2.gz FBJHLBNGSSOVJQ-AWEZNQCLSA-N 1 2 312.413 4.254 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@@H](C)COc2ccccc2C)cc1 ZINC001234589064 1054551308 /nfs/dbraw/zinc/55/13/08/1054551308.db2.gz WLPMCRMIDBPBQR-HNNXBMFYSA-N 1 2 313.397 4.203 20 0 DIADLO CCC(CC)[C@H](NC(=O)CCCn1cc[nH+]c1)c1cccs1 ZINC000623275047 1054554252 /nfs/dbraw/zinc/55/42/52/1054554252.db2.gz NJGFURSCEITWRY-KRWDZBQOSA-N 1 2 319.474 4.019 20 0 DIADLO COc1cccc([C@H]2CCCN2c2[nH+]ccc3c(N)cccc32)c1 ZINC001347182142 1054559110 /nfs/dbraw/zinc/55/91/10/1054559110.db2.gz YOIDBHIOSFXEPW-LJQANCHMSA-N 1 2 319.408 4.167 20 0 DIADLO Cc1nc([C@H]([NH2+]C[C@@H](C)C(C)(C)C)c2ccc(Cl)cc2)no1 ZINC000670267998 1054573916 /nfs/dbraw/zinc/57/39/16/1054573916.db2.gz BBJJYZKNOHFFBC-IAQYHMDHSA-N 1 2 321.852 4.393 20 0 DIADLO Cn1ncc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)c1Cl ZINC001347702263 1054577590 /nfs/dbraw/zinc/57/75/90/1054577590.db2.gz RVPWGASTLBREKY-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1ncc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)c1Cl ZINC001347702263 1054577604 /nfs/dbraw/zinc/57/76/04/1054577604.db2.gz RVPWGASTLBREKY-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO C[C@@H]1CC(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)C[C@@H](C)C1 ZINC001358067627 1054592616 /nfs/dbraw/zinc/59/26/16/1054592616.db2.gz VYVAFFHYQIRKIW-STQMWFEESA-N 1 2 315.392 4.022 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000176976896 1054605377 /nfs/dbraw/zinc/60/53/77/1054605377.db2.gz JZTXAEVMEYIYKE-GOSISDBHSA-N 1 2 317.454 4.109 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000176976896 1054605382 /nfs/dbraw/zinc/60/53/82/1054605382.db2.gz JZTXAEVMEYIYKE-GOSISDBHSA-N 1 2 317.454 4.109 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)C(C)(C)c2ccccc2)c(C)[nH+]1 ZINC001358135249 1054607217 /nfs/dbraw/zinc/60/72/17/1054607217.db2.gz WPAOKCKUXRUHTQ-MRXNPFEDSA-N 1 2 310.441 4.103 20 0 DIADLO CCC[C@@H](C(=O)Nc1cc(C)[nH+]cc1C)c1ccc(Cl)cc1 ZINC001358141930 1054608925 /nfs/dbraw/zinc/60/89/25/1054608925.db2.gz UWWVPFGEBKIKFT-MRXNPFEDSA-N 1 2 316.832 4.296 20 0 DIADLO Fc1ccccc1-c1cc(C[NH+]2CC(Oc3ccccc3)C2)c[nH]1 ZINC001235037569 1054644643 /nfs/dbraw/zinc/64/46/43/1054644643.db2.gz FAGYLOKUBAAJJL-UHFFFAOYSA-N 1 2 322.383 4.084 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1c[nH]c(-c3ccccc3F)c1)C2 ZINC001235042345 1054646445 /nfs/dbraw/zinc/64/64/45/1054646445.db2.gz JKGCSDNIKIBNIY-UHFFFAOYSA-N 1 2 310.347 4.476 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1c[nH]c(-c3ccccc3F)c1)C2 ZINC001235042345 1054646453 /nfs/dbraw/zinc/64/64/53/1054646453.db2.gz JKGCSDNIKIBNIY-UHFFFAOYSA-N 1 2 310.347 4.476 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@@H](C)C(C)(C)C2)sc1Br ZINC001473365932 1054658825 /nfs/dbraw/zinc/65/88/25/1054658825.db2.gz XMSJPKKHOWZDBI-SECBINFHSA-N 1 2 317.296 4.082 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@@H](C)C(C)(C)C2)sc1Br ZINC001473365932 1054658826 /nfs/dbraw/zinc/65/88/26/1054658826.db2.gz XMSJPKKHOWZDBI-SECBINFHSA-N 1 2 317.296 4.082 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCCc1cncs1 ZINC001348586306 1054662834 /nfs/dbraw/zinc/66/28/34/1054662834.db2.gz WCFXEPLILIGIRY-UHFFFAOYSA-N 1 2 315.467 4.113 20 0 DIADLO Cc1cn2cc(NC(=O)Cc3ccc(C(C)(C)C)cc3)ccc2[nH+]1 ZINC001358364464 1054665356 /nfs/dbraw/zinc/66/53/56/1054665356.db2.gz XRMAICFNYNGJQT-UHFFFAOYSA-N 1 2 321.424 4.121 20 0 DIADLO CC/C(C)=C(\C)C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001348644591 1054669572 /nfs/dbraw/zinc/66/95/72/1054669572.db2.gz OFIXJGXKBXQRFT-IYOXOMEYSA-N 1 2 317.477 4.091 20 0 DIADLO CC[N@H+](Cc1ccc(OC)cc1)Cc1c(F)cc(C)cc1F ZINC001235196617 1054681588 /nfs/dbraw/zinc/68/15/88/1054681588.db2.gz FLVZIAKVBLLJLF-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)cc1)Cc1c(F)cc(C)cc1F ZINC001235196617 1054681595 /nfs/dbraw/zinc/68/15/95/1054681595.db2.gz FLVZIAKVBLLJLF-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2c(F)cc(C)cc2F)cc1 ZINC001235203932 1054684250 /nfs/dbraw/zinc/68/42/50/1054684250.db2.gz YOPURLLVNHLXBH-CYBMUJFWSA-N 1 2 305.368 4.475 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2c(F)cc(C)cc2F)cc1 ZINC001235203932 1054684259 /nfs/dbraw/zinc/68/42/59/1054684259.db2.gz YOPURLLVNHLXBH-CYBMUJFWSA-N 1 2 305.368 4.475 20 0 DIADLO Brc1cccc2[nH]c(C[NH+]3CC4(C3)CCCC4)cc21 ZINC001235213220 1054685194 /nfs/dbraw/zinc/68/51/94/1054685194.db2.gz PRNRTLCRFGAOLY-UHFFFAOYSA-N 1 2 319.246 4.306 20 0 DIADLO CC(C)([NH2+]Cc1nc(-c2ccoc2)no1)c1cccc(Cl)c1 ZINC000179601556 1054689524 /nfs/dbraw/zinc/68/95/24/1054689524.db2.gz SWOUPMZQVZJKOG-UHFFFAOYSA-N 1 2 317.776 4.008 20 0 DIADLO Cc1cccc(C(C)(C)[NH2+]Cc2noc(-c3ccccc3)n2)c1 ZINC000179594912 1054690090 /nfs/dbraw/zinc/69/00/90/1054690090.db2.gz DZGNTZQTHHTOJV-UHFFFAOYSA-N 1 2 307.397 4.070 20 0 DIADLO CCCc1csc(CNc2[nH+]c3cc(F)ccc3n2CC)n1 ZINC000492293822 1054694625 /nfs/dbraw/zinc/69/46/25/1054694625.db2.gz LUGDVWOCOMUXHO-UHFFFAOYSA-N 1 2 318.421 4.216 20 0 DIADLO Clc1cnc(COc2cccc(-n3cc[nH+]c3)c2)c(Cl)c1 ZINC000179687893 1054696932 /nfs/dbraw/zinc/69/69/32/1054696932.db2.gz DQEQKVMAJWXBJG-UHFFFAOYSA-N 1 2 320.179 4.153 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3csc(-c4ccoc4)n3)CC2)c1 ZINC000179697290 1054697375 /nfs/dbraw/zinc/69/73/75/1054697375.db2.gz MWSRBFBLPRNWSR-UHFFFAOYSA-N 1 2 314.385 4.321 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000179718821 1054698476 /nfs/dbraw/zinc/69/84/76/1054698476.db2.gz XEVSHZIGQVHECB-OAHLLOKOSA-N 1 2 319.836 4.477 20 0 DIADLO Cc1cnc(F)c(C[N@H+](C)Cc2ccc(Cl)c(Cl)c2)c1 ZINC001235329319 1054701026 /nfs/dbraw/zinc/70/10/26/1054701026.db2.gz RLEFTQBFSFOGSD-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cnc(F)c(C[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)c1 ZINC001235329319 1054701040 /nfs/dbraw/zinc/70/10/40/1054701040.db2.gz RLEFTQBFSFOGSD-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cnc(F)c(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001235342665 1054702113 /nfs/dbraw/zinc/70/21/13/1054702113.db2.gz JYARNSYVQAZQLN-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cnc(F)c(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001235342665 1054702125 /nfs/dbraw/zinc/70/21/25/1054702125.db2.gz JYARNSYVQAZQLN-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Fc1cc(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)c(F)c(F)c1F ZINC001235352142 1054707150 /nfs/dbraw/zinc/70/71/50/1054707150.db2.gz UENKSZOUEWUZJC-LLVKDONJSA-N 1 2 319.317 4.347 20 0 DIADLO Cc1cc(NCc2ccccc2COC(C)C)nc(C2CC2)[nH+]1 ZINC000604757066 1054707015 /nfs/dbraw/zinc/70/70/15/1054707015.db2.gz AEJKHUVXYWIZIA-UHFFFAOYSA-N 1 2 311.429 4.200 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@H](c3ccccn3)C2)c(F)c(F)c1F ZINC001235356007 1054707555 /nfs/dbraw/zinc/70/75/55/1054707555.db2.gz WIFSBLDNXNKTGY-NSHDSACASA-N 1 2 324.321 4.018 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@H](c3ccccn3)C2)c(F)c(F)c1F ZINC001235356007 1054707571 /nfs/dbraw/zinc/70/75/71/1054707571.db2.gz WIFSBLDNXNKTGY-NSHDSACASA-N 1 2 324.321 4.018 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2csc(Nc3ccccc3)n2)[C@@H]1C ZINC000605335698 1054709634 /nfs/dbraw/zinc/70/96/34/1054709634.db2.gz PUVOWCDJEXBKRD-CHWSQXEVSA-N 1 2 319.499 4.213 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2csc(Nc3ccccc3)n2)[C@@H]1C ZINC000605335698 1054709642 /nfs/dbraw/zinc/70/96/42/1054709642.db2.gz PUVOWCDJEXBKRD-CHWSQXEVSA-N 1 2 319.499 4.213 20 0 DIADLO CCOc1cc(O)cc(C[N@@H+]2CCc3ccc(Cl)cc3C2)c1 ZINC001235385353 1054713591 /nfs/dbraw/zinc/71/35/91/1054713591.db2.gz IQXGOMQIRGMZBO-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1cc(O)cc(C[N@H+]2CCc3ccc(Cl)cc3C2)c1 ZINC001235385353 1054713608 /nfs/dbraw/zinc/71/36/08/1054713608.db2.gz IQXGOMQIRGMZBO-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCC[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccccn1 ZINC000179919405 1054715591 /nfs/dbraw/zinc/71/55/91/1054715591.db2.gz SSHJKIHDTVBMNO-GOSISDBHSA-N 1 2 310.445 4.420 20 0 DIADLO Cc1cc(C)cc([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)cn2)c1 ZINC001235422071 1054715703 /nfs/dbraw/zinc/71/57/03/1054715703.db2.gz JWXOFLRGRXFKBY-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C)cc([C@@H]2CCC[N@H+]2Cc2ncc(Cl)cn2)c1 ZINC001235422071 1054715720 /nfs/dbraw/zinc/71/57/20/1054715720.db2.gz JWXOFLRGRXFKBY-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)[C@H](C)[N@@H+]1CCC(C)=C(C)C1 ZINC001473431381 1054719984 /nfs/dbraw/zinc/71/99/84/1054719984.db2.gz CDUGMZDOBDDPTP-AWEZNQCLSA-N 1 2 306.837 4.018 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)[C@H](C)[N@H+]1CCC(C)=C(C)C1 ZINC001473431381 1054720001 /nfs/dbraw/zinc/72/00/01/1054720001.db2.gz CDUGMZDOBDDPTP-AWEZNQCLSA-N 1 2 306.837 4.018 20 0 DIADLO Cc1cnc(C[NH2+][C@H](c2ccccc2)c2cccc(F)c2)s1 ZINC000179968384 1054720665 /nfs/dbraw/zinc/72/06/65/1054720665.db2.gz PWKJFCQWOROLQZ-GOSISDBHSA-N 1 2 312.413 4.470 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)sc1C ZINC000179986063 1054721664 /nfs/dbraw/zinc/72/16/64/1054721664.db2.gz SSFGEVJQYZEGIJ-UHFFFAOYSA-N 1 2 308.397 4.207 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccccc2F)cc(F)c1F ZINC001235449208 1054724840 /nfs/dbraw/zinc/72/48/40/1054724840.db2.gz RZCGDVZHFSPZNU-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccccc2F)cc(F)c1F ZINC001235449208 1054724859 /nfs/dbraw/zinc/72/48/59/1054724859.db2.gz RZCGDVZHFSPZNU-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)n1 ZINC000180030592 1054726835 /nfs/dbraw/zinc/72/68/35/1054726835.db2.gz QTUCKWWJNGLBNG-DIOULYMOSA-N 1 2 319.836 4.333 20 0 DIADLO FC[C@H]1[C@@H]2C[N@H+](Cc3cc(Cl)c(Cl)c(Cl)c3)C[C@H]12 ZINC001235599828 1054750190 /nfs/dbraw/zinc/75/01/90/1054750190.db2.gz XGJFJFVNGGUQPJ-OWUUHHOZSA-N 1 2 308.611 4.294 20 0 DIADLO FC[C@H]1[C@@H]2C[N@@H+](Cc3cc(Cl)c(Cl)c(Cl)c3)C[C@H]12 ZINC001235599828 1054750208 /nfs/dbraw/zinc/75/02/08/1054750208.db2.gz XGJFJFVNGGUQPJ-OWUUHHOZSA-N 1 2 308.611 4.294 20 0 DIADLO COc1cncc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c1C ZINC001235470156 1054730052 /nfs/dbraw/zinc/73/00/52/1054730052.db2.gz KLYHOLYCQAWKHT-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cncc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)c1C ZINC001235470156 1054730069 /nfs/dbraw/zinc/73/00/69/1054730069.db2.gz KLYHOLYCQAWKHT-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO Clc1cc2c(C[N@@H+]3CCC[C@H]3c3nccs3)c[nH]c2cn1 ZINC001235519314 1054735516 /nfs/dbraw/zinc/73/55/16/1054735516.db2.gz DVVBQJMXGBVDPR-ZDUSSCGKSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1cc2c(C[N@H+]3CCC[C@H]3c3nccs3)c[nH]c2cn1 ZINC001235519314 1054735532 /nfs/dbraw/zinc/73/55/32/1054735532.db2.gz DVVBQJMXGBVDPR-ZDUSSCGKSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1c(Br)cccc1C[NH+]1CC2(C1)CCCC2 ZINC001235594720 1054751375 /nfs/dbraw/zinc/75/13/75/1054751375.db2.gz VOALZSIZDWARLR-UHFFFAOYSA-N 1 2 314.654 4.479 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1ncc(Cl)cc1Cl ZINC000180214048 1054743647 /nfs/dbraw/zinc/74/36/47/1054743647.db2.gz KETCYWAJKSPENC-OAHLLOKOSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ncc(Cl)cc1Cl ZINC000180214048 1054743666 /nfs/dbraw/zinc/74/36/66/1054743666.db2.gz KETCYWAJKSPENC-OAHLLOKOSA-N 1 2 310.228 4.367 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)C[C@@]1(C)O ZINC001235587276 1054746189 /nfs/dbraw/zinc/74/61/89/1054746189.db2.gz ALIPDYRGCUMHFM-YMTOWFKASA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)C[C@@]1(C)O ZINC001235587276 1054746205 /nfs/dbraw/zinc/74/62/05/1054746205.db2.gz ALIPDYRGCUMHFM-YMTOWFKASA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[C@@H](CO)C[N@@H+]1Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235587290 1054746278 /nfs/dbraw/zinc/74/62/78/1054746278.db2.gz AQKJUPYUGGAXCV-NXEZZACHSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[C@@H](CO)C[N@H+]1Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235587290 1054746294 /nfs/dbraw/zinc/74/62/94/1054746294.db2.gz AQKJUPYUGGAXCV-NXEZZACHSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)[C@@H]1CO ZINC001235594208 1054751012 /nfs/dbraw/zinc/75/10/12/1054751012.db2.gz XRDUTXABBPRWSA-NOZJJQNGSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)[C@@H]1CO ZINC001235594208 1054751029 /nfs/dbraw/zinc/75/10/29/1054751029.db2.gz XRDUTXABBPRWSA-NOZJJQNGSA-N 1 2 322.663 4.240 20 0 DIADLO Cc1cncc(Br)c1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC001235643599 1054760573 /nfs/dbraw/zinc/76/05/73/1054760573.db2.gz VAJPOJKPKDEXPO-INIZCTEOSA-N 1 2 317.230 4.100 20 0 DIADLO Cc1cncc(Br)c1C[N@H+]1CC[C@H]1c1ccccc1 ZINC001235643599 1054760591 /nfs/dbraw/zinc/76/05/91/1054760591.db2.gz VAJPOJKPKDEXPO-INIZCTEOSA-N 1 2 317.230 4.100 20 0 DIADLO Nc1ccnc(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001235674043 1054766270 /nfs/dbraw/zinc/76/62/70/1054766270.db2.gz LAMDZVXKTXICGD-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccnc(Cl)c1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001235674043 1054766282 /nfs/dbraw/zinc/76/62/82/1054766282.db2.gz LAMDZVXKTXICGD-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nc(Cl)ccc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC001235674854 1054771177 /nfs/dbraw/zinc/77/11/77/1054771177.db2.gz RCJVJDFNEDLDNH-AWEZNQCLSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nc(Cl)ccc1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC001235674854 1054771188 /nfs/dbraw/zinc/77/11/88/1054771188.db2.gz RCJVJDFNEDLDNH-AWEZNQCLSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nc(Cl)ccc1C[N@@H+]1CCCC[C@H]1c1ccccc1F ZINC001235678972 1054773287 /nfs/dbraw/zinc/77/32/87/1054773287.db2.gz MXMYBIHJUYBRIE-HNNXBMFYSA-N 1 2 319.811 4.184 20 0 DIADLO Nc1nc(Cl)ccc1C[N@H+]1CCCC[C@H]1c1ccccc1F ZINC001235678972 1054773300 /nfs/dbraw/zinc/77/33/00/1054773300.db2.gz MXMYBIHJUYBRIE-HNNXBMFYSA-N 1 2 319.811 4.184 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cccc(C2CC2)c1 ZINC001349616878 1054775393 /nfs/dbraw/zinc/77/53/93/1054775393.db2.gz WUXOCLNXSYAEFA-UHFFFAOYSA-N 1 2 303.365 4.002 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@@H](Cc4ccccc4)C3)[nH]c2c1 ZINC001235691875 1054777729 /nfs/dbraw/zinc/77/77/29/1054777729.db2.gz KSWQRRTZDNUYJA-INIZCTEOSA-N 1 2 323.415 4.157 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@@H](Cc4ccccc4)C3)[nH]c2c1 ZINC001235691875 1054777744 /nfs/dbraw/zinc/77/77/44/1054777744.db2.gz KSWQRRTZDNUYJA-INIZCTEOSA-N 1 2 323.415 4.157 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2nc(CC(C)C)no2)C(C)(C)C)c1 ZINC000180796743 1054778462 /nfs/dbraw/zinc/77/84/62/1054778462.db2.gz GGRQIHRCJKSFNR-SFHVURJKSA-N 1 2 315.461 4.454 20 0 DIADLO Nc1ccnc(Cl)c1C[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC001235694172 1054781057 /nfs/dbraw/zinc/78/10/57/1054781057.db2.gz NILYDWCSKOTTMA-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccnc(Cl)c1C[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC001235694172 1054781072 /nfs/dbraw/zinc/78/10/72/1054781072.db2.gz NILYDWCSKOTTMA-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cn2c3ccccc3oc2=S)no1 ZINC000083105050 1054781514 /nfs/dbraw/zinc/78/15/14/1054781514.db2.gz PUBVSGMDKDJAMZ-CYBMUJFWSA-N 1 2 315.398 4.055 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cn2c3ccccc3oc2=S)no1 ZINC000083105050 1054781528 /nfs/dbraw/zinc/78/15/28/1054781528.db2.gz PUBVSGMDKDJAMZ-CYBMUJFWSA-N 1 2 315.398 4.055 20 0 DIADLO C[N@H+](CCc1ccccc1Cl)Cc1nc2ccc(F)cc2[nH]1 ZINC001235697849 1054781638 /nfs/dbraw/zinc/78/16/38/1054781638.db2.gz UTLIIHVERUOWTM-UHFFFAOYSA-N 1 2 317.795 4.030 20 0 DIADLO C[N@@H+](CCc1ccccc1Cl)Cc1nc2ccc(F)cc2[nH]1 ZINC001235697849 1054781652 /nfs/dbraw/zinc/78/16/52/1054781652.db2.gz UTLIIHVERUOWTM-UHFFFAOYSA-N 1 2 317.795 4.030 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)nn1C ZINC000623833231 1054782094 /nfs/dbraw/zinc/78/20/94/1054782094.db2.gz VOCADEHUYJGSQY-CQSZACIVSA-N 1 2 324.255 4.203 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cn2c3ccccc3oc2=S)no1 ZINC000083105045 1054782757 /nfs/dbraw/zinc/78/27/57/1054782757.db2.gz PUBVSGMDKDJAMZ-ZDUSSCGKSA-N 1 2 315.398 4.055 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cn2c3ccccc3oc2=S)no1 ZINC000083105045 1054782774 /nfs/dbraw/zinc/78/27/74/1054782774.db2.gz PUBVSGMDKDJAMZ-ZDUSSCGKSA-N 1 2 315.398 4.055 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+][C@H]1CCCc2scnc21 ZINC000623866868 1054795579 /nfs/dbraw/zinc/79/55/79/1054795579.db2.gz IPWLFDAGSZVAOB-GWCFXTLKSA-N 1 2 306.406 4.019 20 0 DIADLO Clc1cccc2c1OCC[C@@H]2[NH2+][C@@H]1CCCc2scnc21 ZINC000623877298 1054798851 /nfs/dbraw/zinc/79/88/51/1054798851.db2.gz XYCHEIIZVRQWQM-QWHCGFSZSA-N 1 2 320.845 4.287 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@@H](F)C2)ccc1OCc1ccccc1 ZINC001235769104 1054803372 /nfs/dbraw/zinc/80/33/72/1054803372.db2.gz KMJXOXPUIAPNQU-QGZVFWFLSA-N 1 2 317.379 4.339 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@@H](F)C2)ccc1OCc1ccccc1 ZINC001235769104 1054803381 /nfs/dbraw/zinc/80/33/81/1054803381.db2.gz KMJXOXPUIAPNQU-QGZVFWFLSA-N 1 2 317.379 4.339 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1cc(-c2ccccc2)n(C)n1 ZINC000623894241 1054805477 /nfs/dbraw/zinc/80/54/77/1054805477.db2.gz NKBYHOWEYXSZKW-STQMWFEESA-N 1 2 324.428 4.104 20 0 DIADLO CC[C@H]([NH2+]Cc1n[nH]cc1Br)c1cc(C)ccc1C ZINC000623896344 1054805515 /nfs/dbraw/zinc/80/55/15/1054805515.db2.gz OOPYICLBZFEZPI-AWEZNQCLSA-N 1 2 322.250 4.030 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001235820879 1054814901 /nfs/dbraw/zinc/81/49/01/1054814901.db2.gz QEKQWJAEAQCBBK-OAHLLOKOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(F)ccc1C[N@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001235820879 1054814912 /nfs/dbraw/zinc/81/49/12/1054814912.db2.gz QEKQWJAEAQCBBK-OAHLLOKOSA-N 1 2 306.331 4.144 20 0 DIADLO CCOc1cc(C)ccc1C[NH2+][C@H]1CCCc2scnc21 ZINC000623905239 1054815793 /nfs/dbraw/zinc/81/57/93/1054815793.db2.gz VPQAROVSHOWXIV-AWEZNQCLSA-N 1 2 302.443 4.017 20 0 DIADLO CC(C)c1cc(NCCCOCC(F)(F)F)nc(C(C)C)[nH+]1 ZINC000536388619 1054825857 /nfs/dbraw/zinc/82/58/57/1054825857.db2.gz AGKZZNGSFSQKIK-UHFFFAOYSA-N 1 2 319.371 4.104 20 0 DIADLO Fc1ccc(C2([NH2+][C@@H]3CCCc4scnc43)CCC2)c(F)c1 ZINC000623944997 1054830104 /nfs/dbraw/zinc/83/01/04/1054830104.db2.gz ZEDOQWGLRXIGNE-CQSZACIVSA-N 1 2 320.408 4.468 20 0 DIADLO c1nc2c(s1)CCC[C@@H]2Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000623954277 1054834774 /nfs/dbraw/zinc/83/47/74/1054834774.db2.gz IERVLHDUECMYBS-AWEZNQCLSA-N 1 2 314.458 4.018 20 0 DIADLO COc1c2ccccc2oc1C[NH2+][C@H]1CCCc2scnc21 ZINC000623968694 1054839293 /nfs/dbraw/zinc/83/92/93/1054839293.db2.gz KYBKHLDEDXWKHP-LBPRGKRZSA-N 1 2 314.410 4.065 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2cc(F)c(Cl)cc2F)n1 ZINC000623973741 1054841329 /nfs/dbraw/zinc/84/13/29/1054841329.db2.gz YXWUYWCUKSFDCV-QMMMGPOBSA-N 1 2 302.777 4.234 20 0 DIADLO C[C@@H](CC(=O)Nc1cccc(Oc2ccccc2)c1)n1cc[nH+]c1 ZINC001350023224 1054851489 /nfs/dbraw/zinc/85/14/89/1054851489.db2.gz DHSPSJXHYFMQCM-HNNXBMFYSA-N 1 2 321.380 4.265 20 0 DIADLO Clc1ccccc1C1([NH2+][C@H]2CCCc3scnc32)CC1 ZINC000624005253 1054852765 /nfs/dbraw/zinc/85/27/65/1054852765.db2.gz KWLBFAKIELPVOO-ZDUSSCGKSA-N 1 2 304.846 4.453 20 0 DIADLO FC(F)(F)Oc1ccc(-c2cc[nH+]c(N3CCCC3)c2)cc1 ZINC001235931763 1054856355 /nfs/dbraw/zinc/85/63/55/1054856355.db2.gz YPCYABDYKUMYLB-UHFFFAOYSA-N 1 2 308.303 4.247 20 0 DIADLO CC(C)Oc1ccc(Cl)cc1-c1ccn2cc(N)[nH+]c2c1 ZINC001235940747 1054860096 /nfs/dbraw/zinc/86/00/96/1054860096.db2.gz BPDISRSDIFIXQW-UHFFFAOYSA-N 1 2 301.777 4.024 20 0 DIADLO Fc1ccccc1C1([NH2+][C@@H]2CCCc3scnc32)CCC1 ZINC000624006104 1054860356 /nfs/dbraw/zinc/86/03/56/1054860356.db2.gz LYEWWUUABGEPIE-CQSZACIVSA-N 1 2 302.418 4.329 20 0 DIADLO CC[C@H]([NH2+]Cc1c(Cl)oc2ccccc21)c1nccn1C ZINC000624108451 1054879247 /nfs/dbraw/zinc/87/92/47/1054879247.db2.gz VQCOGGARXXKXPC-ZDUSSCGKSA-N 1 2 303.793 4.061 20 0 DIADLO Cc1cncc([C@H](C)[NH2+][C@@H](CCc2ccccc2)C(F)F)c1 ZINC000624125091 1054884622 /nfs/dbraw/zinc/88/46/22/1054884622.db2.gz SHUYJDZEHCADMM-YOEHRIQHSA-N 1 2 304.384 4.307 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](c2cccc(F)c2)C(C)(C)C)n1 ZINC000181055032 1054901241 /nfs/dbraw/zinc/90/12/41/1054901241.db2.gz UCLBJFUKCUABFX-QGZVFWFLSA-N 1 2 319.424 4.428 20 0 DIADLO Fc1ccc(F)c([C@@H]([NH2+][C@@H]2CCOC2)c2ccccc2Cl)c1 ZINC000181165469 1054905051 /nfs/dbraw/zinc/90/50/51/1054905051.db2.gz QXRMLXDGAQPIDE-PXAZEXFGSA-N 1 2 323.770 4.086 20 0 DIADLO Cc1ccccc1Nc1nc(C[NH2+][C@@H](C)c2cccnc2)cs1 ZINC000181299605 1054909544 /nfs/dbraw/zinc/90/95/44/1054909544.db2.gz LDGJYVSDDDDXHO-AWEZNQCLSA-N 1 2 324.453 4.441 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(CCC(C)C)no1)c1ccc(C)cc1 ZINC000181685285 1054929313 /nfs/dbraw/zinc/92/93/13/1054929313.db2.gz PRJJJPSVRQSPLQ-MRXNPFEDSA-N 1 2 301.434 4.208 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(Cc2ccccc2)no1)c1ccc(C)cc1 ZINC000181699093 1054929492 /nfs/dbraw/zinc/92/94/92/1054929492.db2.gz LJDGFHOHNMWNFG-SFHVURJKSA-N 1 2 321.424 4.210 20 0 DIADLO CC[C@@H]([NH2+]Cc1noc(-c2ccccc2)n1)c1ccc(C)cc1 ZINC000181703407 1054932850 /nfs/dbraw/zinc/93/28/50/1054932850.db2.gz PSQWYKPXBKOZRC-QGZVFWFLSA-N 1 2 307.397 4.286 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1ccc(OC)cc1 ZINC000181813697 1054939689 /nfs/dbraw/zinc/93/96/89/1054939689.db2.gz CBAKLFKVGYDLBN-SWLSCSKDSA-N 1 2 317.433 4.178 20 0 DIADLO C[C@H]([NH2+]Cc1cocn1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000182075145 1054958146 /nfs/dbraw/zinc/95/81/46/1054958146.db2.gz HWEMBEBESDEEIL-ZDUSSCGKSA-N 1 2 312.344 4.457 20 0 DIADLO C[C@@H]([NH2+]Cc1cocn1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000182075164 1054958288 /nfs/dbraw/zinc/95/82/88/1054958288.db2.gz HWEMBEBESDEEIL-CYBMUJFWSA-N 1 2 312.344 4.457 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+]Cc2nnc(C(C)C)o2)cc1 ZINC000182129207 1054962633 /nfs/dbraw/zinc/96/26/33/1054962633.db2.gz LFQFXDUSWMDOPU-GFCCVEGCSA-N 1 2 305.447 4.156 20 0 DIADLO Nc1nc(Cl)ccc1C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001236152502 1054970783 /nfs/dbraw/zinc/97/07/83/1054970783.db2.gz RAUAOKYEGXVAHU-AWEZNQCLSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nc(Cl)ccc1C[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001236152502 1054970794 /nfs/dbraw/zinc/97/07/94/1054970794.db2.gz RAUAOKYEGXVAHU-AWEZNQCLSA-N 1 2 322.239 4.308 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](Cc1ccco1)Cc1cccnc1 ZINC000182346018 1054982020 /nfs/dbraw/zinc/98/20/20/1054982020.db2.gz NLCCARYAGGTSQX-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](Cc1ccco1)Cc1cccnc1 ZINC000182346018 1054982030 /nfs/dbraw/zinc/98/20/30/1054982030.db2.gz NLCCARYAGGTSQX-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2noc(-c3ccccc3C)n2)cc1 ZINC000182344102 1054983041 /nfs/dbraw/zinc/98/30/41/1054983041.db2.gz BQFLLAQQXCAOHL-OAHLLOKOSA-N 1 2 307.397 4.204 20 0 DIADLO Cc1cc(NC(=O)c2cccc(-c3c(F)cccc3F)c2)cc[nH+]1 ZINC001535593236 1054983064 /nfs/dbraw/zinc/98/30/64/1054983064.db2.gz JWUVCLFMFMNTJG-UHFFFAOYSA-N 1 2 324.330 4.009 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncc(Cl)cc1Cl)c1c(C)noc1C ZINC000182518928 1054993595 /nfs/dbraw/zinc/99/35/95/1054993595.db2.gz KMNQFYRIXAQIEP-GFCCVEGCSA-N 1 2 314.216 4.234 20 0 DIADLO COc1cccc([C@H](C)Nc2ccc(-n3cc[nH+]c3)c(F)c2)c1 ZINC000182912797 1055015840 /nfs/dbraw/zinc/01/58/40/1055015840.db2.gz QCEMEHNWAZQTSH-ZDUSSCGKSA-N 1 2 311.360 4.193 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc(-n3cc[nH+]c3)c(F)c2)cc1 ZINC000182913313 1055017146 /nfs/dbraw/zinc/01/71/46/1055017146.db2.gz RVYNQPPOOYQATC-ZDUSSCGKSA-N 1 2 311.360 4.193 20 0 DIADLO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2nc(CCC(C)C)no2)c1 ZINC000182894036 1055017200 /nfs/dbraw/zinc/01/72/00/1055017200.db2.gz AHEFBGLNYUXSRE-OAHLLOKOSA-N 1 2 301.434 4.126 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc2ccccc2n1 ZINC000183150851 1055031758 /nfs/dbraw/zinc/03/17/58/1055031758.db2.gz AJYRKQYFGUWMIN-HNNXBMFYSA-N 1 2 318.424 4.403 20 0 DIADLO CC(C)C(=O)Nc1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc1 ZINC001236271665 1055048213 /nfs/dbraw/zinc/04/82/13/1055048213.db2.gz KVJDCZBKICWQCG-UHFFFAOYSA-N 1 2 323.371 4.273 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccc(C)c3ccccc23)c[nH+]1 ZINC001536108996 1055049053 /nfs/dbraw/zinc/04/90/53/1055049053.db2.gz HMNGXZNCOOWRLS-UHFFFAOYSA-N 1 2 304.393 4.090 20 0 DIADLO Cc1cn2cc(-c3ccc(F)c(OC(C)C)c3F)ccc2[nH+]1 ZINC001236343516 1055069091 /nfs/dbraw/zinc/06/90/91/1055069091.db2.gz JEFIFBXOTOGEBS-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1cccc(C(F)(F)F)c1 ZINC000367617456 1055079268 /nfs/dbraw/zinc/07/92/68/1055079268.db2.gz NITDJDBGZBXJOD-QMTHXVAHSA-N 1 2 309.335 4.157 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(-c2ccc(C)cc2)no1)c1nccs1 ZINC000185052860 1055088187 /nfs/dbraw/zinc/08/81/87/1055088187.db2.gz HZIRWZIRHULLDV-HNNXBMFYSA-N 1 2 313.426 4.347 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000185409900 1055091813 /nfs/dbraw/zinc/09/18/13/1055091813.db2.gz HQNODFACQCBFBC-HZPDHXFCSA-N 1 2 321.424 4.381 20 0 DIADLO c1ccc2c(c1)NCCC[C@@H]2Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000193084186 1055099773 /nfs/dbraw/zinc/09/97/73/1055099773.db2.gz MPXCXVBMDQLVQI-IBGZPJMESA-N 1 2 322.456 4.431 20 0 DIADLO CC(C)Oc1cc(-c2c[nH+]c3c(c2)CCCN3)ccc1Cl ZINC001236415204 1055103954 /nfs/dbraw/zinc/10/39/54/1055103954.db2.gz QYEVKLLCITVOFX-UHFFFAOYSA-N 1 2 302.805 4.190 20 0 DIADLO CCCOc1ccc(Cl)cc1-c1cc(-n2ccnc2)cc[nH+]1 ZINC001236451735 1055121227 /nfs/dbraw/zinc/12/12/27/1055121227.db2.gz WKVLQRMBDKLMNA-UHFFFAOYSA-N 1 2 313.788 4.377 20 0 DIADLO CC/C(=C/C(=O)Nc1ccc(C)[nH+]c1N(C)C)c1ccc(C)cc1 ZINC001536522630 1055121760 /nfs/dbraw/zinc/12/17/60/1055121760.db2.gz DSAUVPJGLDBUQJ-SSZFMOIBSA-N 1 2 323.440 4.197 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccccc2)c[nH]1)c1cccc(F)c1F ZINC000194404617 1055124299 /nfs/dbraw/zinc/12/42/99/1055124299.db2.gz GBTQOVUZFKTVPK-GFCCVEGCSA-N 1 2 313.351 4.206 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1ccc(F)cc1 ZINC000195032418 1055143584 /nfs/dbraw/zinc/14/35/84/1055143584.db2.gz SNEHPGJGHLJMOF-FZMZJTMJSA-N 1 2 305.397 4.308 20 0 DIADLO Cc1cc(CNC(=O)[C@](C)(Cc2ccccc2)C(C)C)cc(C)[nH+]1 ZINC001536666043 1055150683 /nfs/dbraw/zinc/15/06/83/1055150683.db2.gz IWMUJXYJBLGMEB-OAQYLSRUSA-N 1 2 324.468 4.220 20 0 DIADLO Cc1cc(F)cc(Cl)c1C[NH+]1CC2(C1)CC(F)(F)CS2 ZINC001238788457 1055155686 /nfs/dbraw/zinc/15/56/86/1055155686.db2.gz PPDDSSBJOOGMAZ-UHFFFAOYSA-N 1 2 321.795 4.114 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@@H+]1CCC[C@H](C(F)F)C1 ZINC001236608524 1055203650 /nfs/dbraw/zinc/20/36/50/1055203650.db2.gz RDBSSKYPDKDYPM-VIFPVBQESA-N 1 2 309.187 4.174 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@H+]1CCC[C@H](C(F)F)C1 ZINC001236608524 1055203657 /nfs/dbraw/zinc/20/36/57/1055203657.db2.gz RDBSSKYPDKDYPM-VIFPVBQESA-N 1 2 309.187 4.174 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2occc2Br)CCC1 ZINC000842747876 1055163509 /nfs/dbraw/zinc/16/35/09/1055163509.db2.gz LIJPQPHEGBEROS-UHFFFAOYSA-N 1 2 324.193 4.350 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(Br)ccnc2Cl)[C@@H](C)C1 ZINC001236598387 1055201970 /nfs/dbraw/zinc/20/19/70/1055201970.db2.gz QHCDUIQJTUNOLW-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(Br)ccnc2Cl)[C@@H](C)C1 ZINC001236598387 1055201975 /nfs/dbraw/zinc/20/19/75/1055201975.db2.gz QHCDUIQJTUNOLW-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO CCC1CC[NH+](Cc2cnc(Cl)c(C(F)(F)F)c2)CC1 ZINC001236627967 1055205940 /nfs/dbraw/zinc/20/59/40/1055205940.db2.gz DWHFZRLAALSJJE-UHFFFAOYSA-N 1 2 306.759 4.376 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+](CC(=O)c2ccccc2)C(C)C)n1 ZINC001236647394 1055212534 /nfs/dbraw/zinc/21/25/34/1055212534.db2.gz MQOUTMSXMQVHGT-UHFFFAOYSA-N 1 2 316.832 4.137 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+](CC(=O)c2ccccc2)C(C)C)n1 ZINC001236647394 1055212539 /nfs/dbraw/zinc/21/25/39/1055212539.db2.gz MQOUTMSXMQVHGT-UHFFFAOYSA-N 1 2 316.832 4.137 20 0 DIADLO CC(C)O[C@@H]1CC[N@H+](Cc2cc(Cl)c(F)c(Cl)c2)C1 ZINC001236659740 1055214958 /nfs/dbraw/zinc/21/49/58/1055214958.db2.gz QZOSFOZQOCFJLH-LLVKDONJSA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@@H]1CC[N@@H+](Cc2cc(Cl)c(F)c(Cl)c2)C1 ZINC001236659740 1055214970 /nfs/dbraw/zinc/21/49/70/1055214970.db2.gz QZOSFOZQOCFJLH-LLVKDONJSA-N 1 2 306.208 4.132 20 0 DIADLO C[N@H+](Cc1ccc(F)c(O)c1)Cc1ccc(Cl)cc1Cl ZINC001236703531 1055234154 /nfs/dbraw/zinc/23/41/54/1055234154.db2.gz OSCCGIZFYULIIH-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO C[N@@H+](Cc1ccc(F)c(O)c1)Cc1ccc(Cl)cc1Cl ZINC001236703531 1055234170 /nfs/dbraw/zinc/23/41/70/1055234170.db2.gz OSCCGIZFYULIIH-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO CC[C@H](C)N1CC[C@]2(CCC[N@@H+](c3ccc(C)cc3)CC2)C1=O ZINC001278000399 1055236668 /nfs/dbraw/zinc/23/66/68/1055236668.db2.gz HHUCEWWWKLPTCM-FXAWDEMLSA-N 1 2 314.473 4.003 20 0 DIADLO CC[C@H](C)N1CC[C@]2(CCC[N@H+](c3ccc(C)cc3)CC2)C1=O ZINC001278000399 1055236684 /nfs/dbraw/zinc/23/66/84/1055236684.db2.gz HHUCEWWWKLPTCM-FXAWDEMLSA-N 1 2 314.473 4.003 20 0 DIADLO CCC(CC)CCCN(C)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001562530649 1055243921 /nfs/dbraw/zinc/24/39/21/1055243921.db2.gz MDLXGKAJUJRSEE-UHFFFAOYSA-N 1 2 320.481 4.136 20 0 DIADLO O=C(C[C@@H]1C=CCC1)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001587253041 1055252300 /nfs/dbraw/zinc/25/23/00/1055252300.db2.gz PAIASOCLYZJQQX-OAHLLOKOSA-N 1 2 322.408 4.148 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2F)cn1 ZINC000692319991 1055278640 /nfs/dbraw/zinc/27/86/40/1055278640.db2.gz LAKQEVLDOQJGLK-SECBINFHSA-N 1 2 314.191 4.082 20 0 DIADLO C[C@H]1CC(C)(C)N(C(=O)c2cccc3[nH+]ccn32)c2ccccc21 ZINC001537355739 1055289015 /nfs/dbraw/zinc/28/90/15/1055289015.db2.gz NHUUXNVRWUWUIR-AWEZNQCLSA-N 1 2 319.408 4.267 20 0 DIADLO CCCN(CCc1cccs1)C(=O)c1c(C)cc(C)[nH+]c1C ZINC001127808093 1055290047 /nfs/dbraw/zinc/29/00/47/1055290047.db2.gz CYVAQDUUXWVAFQ-UHFFFAOYSA-N 1 2 316.470 4.163 20 0 DIADLO CC1(F)CC[NH+](Cc2cc(F)c(F)c(Br)c2)CC1 ZINC001236849348 1055290964 /nfs/dbraw/zinc/29/09/64/1055290964.db2.gz YEWJIUORKVXRGN-UHFFFAOYSA-N 1 2 322.168 4.051 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1cccc(C)c1Cl)CC2 ZINC001236855438 1055291368 /nfs/dbraw/zinc/29/13/68/1055291368.db2.gz GBIRQTHVFGZLQB-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1cccc(C)c1Cl)CC2 ZINC001236855438 1055291377 /nfs/dbraw/zinc/29/13/77/1055291377.db2.gz GBIRQTHVFGZLQB-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO C[C@@H]1CN(c2ccc(Nc3coc4ccccc34)c[nH+]2)C[C@H](C)O1 ZINC001203146196 1055334432 /nfs/dbraw/zinc/33/44/32/1055334432.db2.gz GJHPDQJBGSFNPA-OKILXGFUSA-N 1 2 323.396 4.185 20 0 DIADLO Clc1ccc2c(c1Cl)OCC[C@H]2[NH2+]Cc1nccs1 ZINC000765242617 1055344417 /nfs/dbraw/zinc/34/44/17/1055344417.db2.gz GZZPEEHLXJZAOU-SNVBAGLBSA-N 1 2 315.225 4.063 20 0 DIADLO CCC[C@@H](C(=O)Nc1c(C)c[nH+]cc1C)c1cccc(Cl)c1 ZINC001537609714 1055380534 /nfs/dbraw/zinc/38/05/34/1055380534.db2.gz NPCZMCUJOKBCED-MRXNPFEDSA-N 1 2 316.832 4.296 20 0 DIADLO Cc1c(F)c(F)ccc1C[N@H+](C)Cc1cnc(Cl)s1 ZINC001237153578 1055385963 /nfs/dbraw/zinc/38/59/63/1055385963.db2.gz IVVATDCYDPOOJW-UHFFFAOYSA-N 1 2 302.777 4.015 20 0 DIADLO Cc1c(F)c(F)ccc1C[N@@H+](C)Cc1cnc(Cl)s1 ZINC001237153578 1055385972 /nfs/dbraw/zinc/38/59/72/1055385972.db2.gz IVVATDCYDPOOJW-UHFFFAOYSA-N 1 2 302.777 4.015 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)cc1 ZINC000921514196 1055401294 /nfs/dbraw/zinc/40/12/94/1055401294.db2.gz TXNXNDGJPWHGSQ-CYBMUJFWSA-N 1 2 302.418 4.222 20 0 DIADLO c1coc([C@@H]([NH2+]Cc2cnn(CC3CCC3)c2)c2ccccc2)c1 ZINC000921513629 1055401837 /nfs/dbraw/zinc/40/18/37/1055401837.db2.gz SCTXHWOIGPQQNH-FQEVSTJZSA-N 1 2 321.424 4.155 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2ncc(Cl)s2)C2CC2)c(F)c1 ZINC001168541748 1055408766 /nfs/dbraw/zinc/40/87/66/1055408766.db2.gz KGYLOIKZIQGTPH-CQSZACIVSA-N 1 2 314.788 4.316 20 0 DIADLO Oc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1 ZINC001237276343 1055415782 /nfs/dbraw/zinc/41/57/82/1055415782.db2.gz BMZVVGYCEWSVEG-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)cc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1 ZINC001237276343 1055415788 /nfs/dbraw/zinc/41/57/88/1055415788.db2.gz BMZVVGYCEWSVEG-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO CC1(C)C[N@H+](Cc2ccncc2C(F)(F)F)Cc2ccccc21 ZINC001237296188 1055421251 /nfs/dbraw/zinc/42/12/51/1055421251.db2.gz XDBPPDBRBVDNSU-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccncc2C(F)(F)F)Cc2ccccc21 ZINC001237296188 1055421260 /nfs/dbraw/zinc/42/12/60/1055421260.db2.gz XDBPPDBRBVDNSU-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO COc1ccc(-c2ccccc2)c(C[N@@H+]2C[C@@H](F)C[C@H]2CF)c1 ZINC001237302256 1055423198 /nfs/dbraw/zinc/42/31/98/1055423198.db2.gz AXKYCDOFHIYVJO-IRXDYDNUSA-N 1 2 317.379 4.244 20 0 DIADLO COc1ccc(-c2ccccc2)c(C[N@H+]2C[C@@H](F)C[C@H]2CF)c1 ZINC001237302256 1055423204 /nfs/dbraw/zinc/42/32/04/1055423204.db2.gz AXKYCDOFHIYVJO-IRXDYDNUSA-N 1 2 317.379 4.244 20 0 DIADLO c1ccc(CCc2ccccc2C[N@@H+]2Cc3ccncc3C2)cc1 ZINC001237302356 1055423796 /nfs/dbraw/zinc/42/37/96/1055423796.db2.gz RHZVYXKXNYZOLU-UHFFFAOYSA-N 1 2 314.432 4.383 20 0 DIADLO c1ccc(CCc2ccccc2C[N@H+]2Cc3ccncc3C2)cc1 ZINC001237302356 1055423802 /nfs/dbraw/zinc/42/38/02/1055423802.db2.gz RHZVYXKXNYZOLU-UHFFFAOYSA-N 1 2 314.432 4.383 20 0 DIADLO CCc1cccc(C)c1C[N@@H+]1CCc2c([nH]nc2C(F)(F)F)C1 ZINC001237330301 1055429451 /nfs/dbraw/zinc/42/94/51/1055429451.db2.gz PENSMNPCHYCICN-INIZCTEOSA-N 1 2 323.362 4.414 20 0 DIADLO CCc1cccc(C)c1C[N@H+]1CCc2c([nH]nc2C(F)(F)F)C1 ZINC001237330301 1055429456 /nfs/dbraw/zinc/42/94/56/1055429456.db2.gz PENSMNPCHYCICN-INIZCTEOSA-N 1 2 323.362 4.414 20 0 DIADLO COc1ccc(-c2nc(C[N@@H+]3CCCC[C@H](F)C3)cs2)cc1 ZINC001237336511 1055431838 /nfs/dbraw/zinc/43/18/38/1055431838.db2.gz RGVIXCSOHDDYQX-AWEZNQCLSA-N 1 2 320.433 4.143 20 0 DIADLO COc1ccc(-c2nc(C[N@H+]3CCCC[C@H](F)C3)cs2)cc1 ZINC001237336511 1055431849 /nfs/dbraw/zinc/43/18/49/1055431849.db2.gz RGVIXCSOHDDYQX-AWEZNQCLSA-N 1 2 320.433 4.143 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1ccc(OC(F)F)c(F)c1)C2 ZINC001237353753 1055435984 /nfs/dbraw/zinc/43/59/84/1055435984.db2.gz XLXSPTTZUVMEEQ-UHFFFAOYSA-N 1 2 307.315 4.251 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1ccc(OC(F)F)c(F)c1)C2 ZINC001237353753 1055435993 /nfs/dbraw/zinc/43/59/93/1055435993.db2.gz XLXSPTTZUVMEEQ-UHFFFAOYSA-N 1 2 307.315 4.251 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1nnc(-c2ccccc2Cl)o1 ZINC000015299341 1055439941 /nfs/dbraw/zinc/43/99/41/1055439941.db2.gz IEZMDFHKWOCKJO-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1nnc(-c2ccccc2Cl)o1 ZINC000015299341 1055439953 /nfs/dbraw/zinc/43/99/53/1055439953.db2.gz IEZMDFHKWOCKJO-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO Clc1[nH]c2cnccc2c1C[N@@H+]1CCC[C@H]1c1nccs1 ZINC001237460562 1055455126 /nfs/dbraw/zinc/45/51/26/1055455126.db2.gz JAEBELGODAQWLM-ZDUSSCGKSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1[nH]c2cnccc2c1C[N@H+]1CCC[C@H]1c1nccs1 ZINC001237460562 1055455134 /nfs/dbraw/zinc/45/51/34/1055455134.db2.gz JAEBELGODAQWLM-ZDUSSCGKSA-N 1 2 318.833 4.010 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1nc(-c2ccsc2)no1 ZINC000016434998 1055455741 /nfs/dbraw/zinc/45/57/41/1055455741.db2.gz GGTHUXJQPYCUEW-SNVBAGLBSA-N 1 2 305.428 4.053 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1nc(-c2ccsc2)no1 ZINC000016434998 1055455747 /nfs/dbraw/zinc/45/57/47/1055455747.db2.gz GGTHUXJQPYCUEW-SNVBAGLBSA-N 1 2 305.428 4.053 20 0 DIADLO COc1c(C)cccc1C[N@H+](C)Cc1ncccc1C(F)(F)F ZINC001237500189 1055461286 /nfs/dbraw/zinc/46/12/86/1055461286.db2.gz HQVWWGWEOVBFNR-UHFFFAOYSA-N 1 2 324.346 4.049 20 0 DIADLO COc1c(C)cccc1C[N@@H+](C)Cc1ncccc1C(F)(F)F ZINC001237500189 1055461290 /nfs/dbraw/zinc/46/12/90/1055461290.db2.gz HQVWWGWEOVBFNR-UHFFFAOYSA-N 1 2 324.346 4.049 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC23CCCC3)cc(Cl)n1 ZINC001237496649 1055461339 /nfs/dbraw/zinc/46/13/39/1055461339.db2.gz SJFRVUVQUKNYBU-UHFFFAOYSA-N 1 2 304.743 4.272 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC23CCCC3)cc(Cl)n1 ZINC001237496649 1055461345 /nfs/dbraw/zinc/46/13/45/1055461345.db2.gz SJFRVUVQUKNYBU-UHFFFAOYSA-N 1 2 304.743 4.272 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)CCCCCc1ccc(F)cc1 ZINC001537892090 1055468518 /nfs/dbraw/zinc/46/85/18/1055468518.db2.gz SLEVQELXLARYJL-UHFFFAOYSA-N 1 2 314.404 4.001 20 0 DIADLO Fc1cc(NCc2ccc3cc[nH]c3c2)ccc1-n1cc[nH+]c1 ZINC001620848888 1055476734 /nfs/dbraw/zinc/47/67/34/1055476734.db2.gz BQIHHEVVMLWCPD-UHFFFAOYSA-N 1 2 306.344 4.105 20 0 DIADLO Cn1c(CNc2ccc(-n3cc[nH+]c3)c(F)c2)cc2ccccc21 ZINC001620848865 1055476836 /nfs/dbraw/zinc/47/68/36/1055476836.db2.gz AHJADTNFHWUCAK-UHFFFAOYSA-N 1 2 320.371 4.115 20 0 DIADLO Cc1cc(F)c(CNc2ccc3c(c2)CCC[N@H+]3C)c(F)c1 ZINC001620851886 1055478376 /nfs/dbraw/zinc/47/83/76/1055478376.db2.gz PJZDSBRVIJWUJF-UHFFFAOYSA-N 1 2 302.368 4.268 20 0 DIADLO Cc1cc(F)c(CNc2ccc3c(c2)CCC[N@@H+]3C)c(F)c1 ZINC001620851886 1055478383 /nfs/dbraw/zinc/47/83/83/1055478383.db2.gz PJZDSBRVIJWUJF-UHFFFAOYSA-N 1 2 302.368 4.268 20 0 DIADLO CCOc1c(Cl)cccc1NCc1c[nH+]c2ccc(C)cn12 ZINC001620851221 1055478487 /nfs/dbraw/zinc/47/84/87/1055478487.db2.gz GZBGEVNEKVCVKP-UHFFFAOYSA-N 1 2 315.804 4.307 20 0 DIADLO Fc1cc(Cl)c(C[N@@H+]2CC[C@H]3CCCO[C@@H]3C2)c(Cl)c1 ZINC001237594782 1055483109 /nfs/dbraw/zinc/48/31/09/1055483109.db2.gz WWIUMWKOQQGRED-MEBBXXQBSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1cc(Cl)c(C[N@H+]2CC[C@H]3CCCO[C@@H]3C2)c(Cl)c1 ZINC001237594782 1055483115 /nfs/dbraw/zinc/48/31/15/1055483115.db2.gz WWIUMWKOQQGRED-MEBBXXQBSA-N 1 2 318.219 4.133 20 0 DIADLO CCO[C@H]1CCC[N@H+](Cc2c(Cl)cc(F)cc2Cl)C1 ZINC001237596281 1055483145 /nfs/dbraw/zinc/48/31/45/1055483145.db2.gz JRCTUDKAELEQQX-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@H]1CCC[N@@H+](Cc2c(Cl)cc(F)cc2Cl)C1 ZINC001237596281 1055483153 /nfs/dbraw/zinc/48/31/53/1055483153.db2.gz JRCTUDKAELEQQX-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO CCCOc1ccc(NCc2cc(-n3cc[nH+]c3)cs2)cc1 ZINC001620862250 1055489654 /nfs/dbraw/zinc/48/96/54/1055489654.db2.gz KKROGNZYZGCZAD-UHFFFAOYSA-N 1 2 313.426 4.335 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(-c2ccccc2)[nH]1)c1cccc(F)c1F ZINC001620867638 1055493372 /nfs/dbraw/zinc/49/33/72/1055493372.db2.gz VDABHZAQTVRNPN-LBPRGKRZSA-N 1 2 313.351 4.206 20 0 DIADLO C[C@H]([NH2+]Cc1c[nH]c(-c2ccccc2)n1)c1cccc(F)c1F ZINC001620867638 1055493380 /nfs/dbraw/zinc/49/33/80/1055493380.db2.gz VDABHZAQTVRNPN-LBPRGKRZSA-N 1 2 313.351 4.206 20 0 DIADLO CCc1[nH]ncc1C[N@@H+](CC)Cc1ccc(C(F)(F)F)cc1 ZINC001237652025 1055493323 /nfs/dbraw/zinc/49/33/23/1055493323.db2.gz DRZIVCGPPCBRER-UHFFFAOYSA-N 1 2 311.351 4.013 20 0 DIADLO CCc1[nH]ncc1C[N@H+](CC)Cc1ccc(C(F)(F)F)cc1 ZINC001237652025 1055493331 /nfs/dbraw/zinc/49/33/31/1055493331.db2.gz DRZIVCGPPCBRER-UHFFFAOYSA-N 1 2 311.351 4.013 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(-c2ccccc2)[nH]1)c1cccc(F)c1F ZINC001620867637 1055494123 /nfs/dbraw/zinc/49/41/23/1055494123.db2.gz VDABHZAQTVRNPN-GFCCVEGCSA-N 1 2 313.351 4.206 20 0 DIADLO C[C@@H]([NH2+]Cc1c[nH]c(-c2ccccc2)n1)c1cccc(F)c1F ZINC001620867637 1055494132 /nfs/dbraw/zinc/49/41/32/1055494132.db2.gz VDABHZAQTVRNPN-GFCCVEGCSA-N 1 2 313.351 4.206 20 0 DIADLO CC[C@@H](C)Oc1cc(CNc2ccc(C)[nH+]c2C)ccc1OC ZINC001620869621 1055496427 /nfs/dbraw/zinc/49/64/27/1055496427.db2.gz KJDIPVYLRUKTMA-CQSZACIVSA-N 1 2 314.429 4.496 20 0 DIADLO CC[C@@H](NC(=O)c1ccc(-n2cc[nH+]c2)cc1)c1ccc(C)cc1 ZINC000024049415 1055509334 /nfs/dbraw/zinc/50/93/34/1055509334.db2.gz KMEIBQFNCPKTGT-LJQANCHMSA-N 1 2 319.408 4.062 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1cccc(Cl)c1C)CC2 ZINC001237736834 1055518996 /nfs/dbraw/zinc/51/89/96/1055518996.db2.gz YPAXCMGSKGUICN-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1cccc(Cl)c1C)CC2 ZINC001237736834 1055519007 /nfs/dbraw/zinc/51/90/07/1055519007.db2.gz YPAXCMGSKGUICN-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2)Cc2ccccn2)ccc1F ZINC001237813371 1055538338 /nfs/dbraw/zinc/53/83/38/1055538338.db2.gz IYZIDXDMIZSBOA-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)ccc1F ZINC001237813371 1055538351 /nfs/dbraw/zinc/53/83/51/1055538351.db2.gz IYZIDXDMIZSBOA-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO CCc1ncc(C[N@H+](Cc2ccccc2)Cc2cccnc2)s1 ZINC001237826076 1055540617 /nfs/dbraw/zinc/54/06/17/1055540617.db2.gz OPTCPUIWERQZIT-UHFFFAOYSA-N 1 2 323.465 4.303 20 0 DIADLO CCc1ncc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)s1 ZINC001237826076 1055540625 /nfs/dbraw/zinc/54/06/25/1055540625.db2.gz OPTCPUIWERQZIT-UHFFFAOYSA-N 1 2 323.465 4.303 20 0 DIADLO C[C@@H]1CCC[N@@H+]1Cc1ccc(Br)c(Cl)c1F ZINC001237890277 1055552272 /nfs/dbraw/zinc/55/22/72/1055552272.db2.gz WAIFJVCRWAZODJ-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@@H]1CCC[N@H+]1Cc1ccc(Br)c(Cl)c1F ZINC001237890277 1055552281 /nfs/dbraw/zinc/55/22/81/1055552281.db2.gz WAIFJVCRWAZODJ-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO CCCOc1cc(F)ccc1C[N@@H+]1CCc2sccc2C1 ZINC001237906006 1055554585 /nfs/dbraw/zinc/55/45/85/1055554585.db2.gz KJLZCBOFVLKUDB-UHFFFAOYSA-N 1 2 305.418 4.234 20 0 DIADLO CCCOc1cc(F)ccc1C[N@H+]1CCc2sccc2C1 ZINC001237906006 1055554600 /nfs/dbraw/zinc/55/46/00/1055554600.db2.gz KJLZCBOFVLKUDB-UHFFFAOYSA-N 1 2 305.418 4.234 20 0 DIADLO CCn1c2ccccc2c2cc(C[NH2+]C(CF)CF)ccc21 ZINC001620948585 1055562762 /nfs/dbraw/zinc/56/27/62/1055562762.db2.gz KHWWTVGMZGPQSY-UHFFFAOYSA-N 1 2 302.368 4.212 20 0 DIADLO CCCCCC[C@@H](C)C(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000741913054 1055563899 /nfs/dbraw/zinc/56/38/99/1055563899.db2.gz TYQKDVPPNFPNPO-MRXNPFEDSA-N 1 2 313.445 4.095 20 0 DIADLO Fc1cccc(-c2nc(C[N@H+]3CCCC[C@@H](F)C3)cs2)c1 ZINC001237968101 1055566180 /nfs/dbraw/zinc/56/61/80/1055566180.db2.gz JXZLTPLZKVWMKP-CQSZACIVSA-N 1 2 308.397 4.273 20 0 DIADLO Fc1cccc(-c2nc(C[N@@H+]3CCCC[C@@H](F)C3)cs2)c1 ZINC001237968101 1055566191 /nfs/dbraw/zinc/56/61/91/1055566191.db2.gz JXZLTPLZKVWMKP-CQSZACIVSA-N 1 2 308.397 4.273 20 0 DIADLO Cc1sccc1CN1CC[NH+]([C@H](C)c2ccc(F)cc2)CC1 ZINC001237976818 1055569960 /nfs/dbraw/zinc/56/99/60/1055569960.db2.gz UNXCANTYFFCJLG-CQSZACIVSA-N 1 2 318.461 4.074 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2cc(F)c(O)c(Cl)c2)cc1 ZINC001237994082 1055575664 /nfs/dbraw/zinc/57/56/64/1055575664.db2.gz BSOYFJTZYXRKIS-LLVKDONJSA-N 1 2 323.795 4.386 20 0 DIADLO Oc1c(F)cc(C[N@@H+]2CC[C@@H](c3ccccc3F)C2)cc1Cl ZINC001237989951 1055577945 /nfs/dbraw/zinc/57/79/45/1055577945.db2.gz PMWYFMNGYYIZHS-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)cc1Cl ZINC001237989951 1055577953 /nfs/dbraw/zinc/57/79/53/1055577953.db2.gz PMWYFMNGYYIZHS-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cc(F)c(O)c(Cl)c1 ZINC001237998770 1055580570 /nfs/dbraw/zinc/58/05/70/1055580570.db2.gz WSAGLLQFFRTTBB-LLVKDONJSA-N 1 2 323.795 4.386 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1cc(F)c(O)c(Cl)c1 ZINC001237998770 1055580580 /nfs/dbraw/zinc/58/05/80/1055580580.db2.gz WSAGLLQFFRTTBB-LLVKDONJSA-N 1 2 323.795 4.386 20 0 DIADLO CC(C)CCN(CCC(C)C)C(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001595308602 1055582751 /nfs/dbraw/zinc/58/27/51/1055582751.db2.gz QGCITJJGZSDNES-GOSISDBHSA-N 1 2 321.509 4.391 20 0 DIADLO Clc1cncc(C[N@@H+]2CCCc3ccccc3C2)c1Cl ZINC001238012069 1055584989 /nfs/dbraw/zinc/58/49/89/1055584989.db2.gz PYLYTZDABFHZLC-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO Clc1cncc(C[N@H+]2CCCc3ccccc3C2)c1Cl ZINC001238012069 1055585005 /nfs/dbraw/zinc/58/50/05/1055585005.db2.gz PYLYTZDABFHZLC-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO COc1cnc(F)c(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2)c1 ZINC001238123409 1055609481 /nfs/dbraw/zinc/60/94/81/1055609481.db2.gz MRIGVNJNKWWFII-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1cnc(F)c(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2)c1 ZINC001238123409 1055609488 /nfs/dbraw/zinc/60/94/88/1055609488.db2.gz MRIGVNJNKWWFII-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO CC[N@H+](Cc1ccc(F)cc1)Cc1cc(Cl)c(O)cc1F ZINC001238149591 1055611316 /nfs/dbraw/zinc/61/13/16/1055611316.db2.gz ITCXXNXVAUQVEK-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC[N@@H+](Cc1ccc(F)cc1)Cc1cc(Cl)c(O)cc1F ZINC001238149591 1055611326 /nfs/dbraw/zinc/61/13/26/1055611326.db2.gz ITCXXNXVAUQVEK-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCCC3(CC(F)C3)CC2)cc1Cl ZINC001238150476 1055614398 /nfs/dbraw/zinc/61/43/98/1055614398.db2.gz VVTNRZJCURZBQN-UHFFFAOYSA-N 1 2 315.791 4.289 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCCC3(CC(F)C3)CC2)cc1Cl ZINC001238150476 1055614404 /nfs/dbraw/zinc/61/44/04/1055614404.db2.gz VVTNRZJCURZBQN-UHFFFAOYSA-N 1 2 315.791 4.289 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cccc(-c2cccs2)n1 ZINC001238213796 1055621959 /nfs/dbraw/zinc/62/19/59/1055621959.db2.gz PORBIHKKQGREGZ-CQSZACIVSA-N 1 2 309.438 4.188 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cccc(-c2cccs2)n1 ZINC001238213796 1055621966 /nfs/dbraw/zinc/62/19/66/1055621966.db2.gz PORBIHKKQGREGZ-CQSZACIVSA-N 1 2 309.438 4.188 20 0 DIADLO CC(C)c1cc(C[N@@H+]2CCc3cnccc3C2)ccc1Cl ZINC001238216926 1055622657 /nfs/dbraw/zinc/62/26/57/1055622657.db2.gz GVUPCANUNISOEX-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1cc(C[N@H+]2CCc3cnccc3C2)ccc1Cl ZINC001238216926 1055622662 /nfs/dbraw/zinc/62/26/62/1055622662.db2.gz GVUPCANUNISOEX-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)ccnc2Cl)cc1 ZINC001238231436 1055626863 /nfs/dbraw/zinc/62/68/63/1055626863.db2.gz LLXJVHGKQGVQLM-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)ccnc2Cl)cc1 ZINC001238231436 1055626866 /nfs/dbraw/zinc/62/68/66/1055626866.db2.gz LLXJVHGKQGVQLM-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2c(F)ccnc2Cl)c1 ZINC001238233344 1055627445 /nfs/dbraw/zinc/62/74/45/1055627445.db2.gz HFFGHPYEBMWNEH-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2c(F)ccnc2Cl)c1 ZINC001238233344 1055627450 /nfs/dbraw/zinc/62/74/50/1055627450.db2.gz HFFGHPYEBMWNEH-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO C[N@H+](CCc1ccc(Cl)cc1)Cc1c(F)ccnc1Cl ZINC001238229280 1055627882 /nfs/dbraw/zinc/62/78/82/1055627882.db2.gz GTGBLFJIBFXVKN-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1ccc(Cl)cc1)Cc1c(F)ccnc1Cl ZINC001238229280 1055627884 /nfs/dbraw/zinc/62/78/84/1055627884.db2.gz GTGBLFJIBFXVKN-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@H+](Cc1ccncc1)Cc1ccc(F)c(C(F)(F)F)c1F ZINC001238244319 1055629742 /nfs/dbraw/zinc/62/97/42/1055629742.db2.gz VWBMLDSTJXLZCP-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO C[N@@H+](Cc1ccncc1)Cc1ccc(F)c(C(F)(F)F)c1F ZINC001238244319 1055629752 /nfs/dbraw/zinc/62/97/52/1055629752.db2.gz VWBMLDSTJXLZCP-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO Cc1cc(Cl)c(Cl)cc1C[N@@H+]1CCC[C@H]1c1cnccn1 ZINC001238258132 1055631614 /nfs/dbraw/zinc/63/16/14/1055631614.db2.gz GIVHFQRQJGEBLO-INIZCTEOSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1cc(Cl)c(Cl)cc1C[N@H+]1CCC[C@H]1c1cnccn1 ZINC001238258132 1055631618 /nfs/dbraw/zinc/63/16/18/1055631618.db2.gz GIVHFQRQJGEBLO-INIZCTEOSA-N 1 2 322.239 4.429 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@H+](C)Cc1ccc(F)cc1 ZINC001238334009 1055641055 /nfs/dbraw/zinc/64/10/55/1055641055.db2.gz DWRKYWJYMWLUCE-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@@H+](C)Cc1ccc(F)cc1 ZINC001238334009 1055641060 /nfs/dbraw/zinc/64/10/60/1055641060.db2.gz DWRKYWJYMWLUCE-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ccnc(Br)c2Cl)[C@@H]1C ZINC001238377698 1055648832 /nfs/dbraw/zinc/64/88/32/1055648832.db2.gz QSDTWHITLDGSSM-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ccnc(Br)c2Cl)[C@@H]1C ZINC001238377698 1055648838 /nfs/dbraw/zinc/64/88/38/1055648838.db2.gz QSDTWHITLDGSSM-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c(Cl)cn1 ZINC001238359931 1055645506 /nfs/dbraw/zinc/64/55/06/1055645506.db2.gz MVDVJJVTCRWXSW-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2F)c(Cl)cn1 ZINC001238359931 1055645514 /nfs/dbraw/zinc/64/55/14/1055645514.db2.gz MVDVJJVTCRWXSW-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CCC1CC[NH+](Cc2ccnc(Br)c2Cl)CC1 ZINC001238370120 1055645774 /nfs/dbraw/zinc/64/57/74/1055645774.db2.gz HZCQJJYQULHMKX-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1ccnc(Br)c1Cl ZINC001238386264 1055648401 /nfs/dbraw/zinc/64/84/01/1055648401.db2.gz YFXLJNUZSXICJW-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1ccnc(Br)c1Cl ZINC001238386264 1055648404 /nfs/dbraw/zinc/64/84/04/1055648404.db2.gz YFXLJNUZSXICJW-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2cccc(O)c2)c(Cl)c1 ZINC001238393595 1055651506 /nfs/dbraw/zinc/65/15/06/1055651506.db2.gz ATIGLEKBWQHGOK-UHFFFAOYSA-N 1 2 305.805 4.076 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2cccc(O)c2)c(Cl)c1 ZINC001238393595 1055651508 /nfs/dbraw/zinc/65/15/08/1055651508.db2.gz ATIGLEKBWQHGOK-UHFFFAOYSA-N 1 2 305.805 4.076 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(F)c(Cl)c(F)cc2Br)C1 ZINC001238402665 1055653158 /nfs/dbraw/zinc/65/31/58/1055653158.db2.gz FOKKWHFAKHVYKK-ZETCQYMHSA-N 1 2 324.596 4.223 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(F)c(Cl)c(F)cc2Br)C1 ZINC001238402665 1055653165 /nfs/dbraw/zinc/65/31/65/1055653165.db2.gz FOKKWHFAKHVYKK-ZETCQYMHSA-N 1 2 324.596 4.223 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ccc(C)nc2)c(Cl)c1 ZINC001238404994 1055653488 /nfs/dbraw/zinc/65/34/88/1055653488.db2.gz KSYQOYUKDRWNMX-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ccc(C)nc2)c(Cl)c1 ZINC001238404994 1055653492 /nfs/dbraw/zinc/65/34/92/1055653492.db2.gz KSYQOYUKDRWNMX-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO Cc1cc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)ncc1Cl ZINC001238418117 1055653506 /nfs/dbraw/zinc/65/35/06/1055653506.db2.gz LOBLHNQINIRRQN-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(C[N@H+]2CCSC[C@@H]2c2ccccc2)ncc1Cl ZINC001238418117 1055653510 /nfs/dbraw/zinc/65/35/10/1055653510.db2.gz LOBLHNQINIRRQN-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)cnc1F ZINC001238454891 1055662634 /nfs/dbraw/zinc/66/26/34/1055662634.db2.gz VCSGJECDTKRZMV-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)cnc1F ZINC001238454891 1055662640 /nfs/dbraw/zinc/66/26/40/1055662640.db2.gz VCSGJECDTKRZMV-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)cnc1F ZINC001238462205 1055666765 /nfs/dbraw/zinc/66/67/65/1055666765.db2.gz IWJZOBLNSHYUOE-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)cnc1F ZINC001238462205 1055666772 /nfs/dbraw/zinc/66/67/72/1055666772.db2.gz IWJZOBLNSHYUOE-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(C[N@@H+]2CCC[C@@H]2c2ccccc2F)ccc(F)c1F ZINC001238477520 1055667955 /nfs/dbraw/zinc/66/79/55/1055667955.db2.gz PGVBUKOSOBQVLF-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(C[N@H+]2CCC[C@@H]2c2ccccc2F)ccc(F)c1F ZINC001238477520 1055667960 /nfs/dbraw/zinc/66/79/60/1055667960.db2.gz PGVBUKOSOBQVLF-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cnc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c(Cl)c1 ZINC001238489913 1055671251 /nfs/dbraw/zinc/67/12/51/1055671251.db2.gz VJQJLFLICSISOA-QGZVFWFLSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cnc(C[N@H+]2CCC[C@@H]2c2ccccc2F)c(Cl)c1 ZINC001238489913 1055671260 /nfs/dbraw/zinc/67/12/60/1055671260.db2.gz VJQJLFLICSISOA-QGZVFWFLSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cnc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c(Cl)c1 ZINC001238485918 1055672141 /nfs/dbraw/zinc/67/21/41/1055672141.db2.gz XWOONJUJLMBLLG-QGZVFWFLSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cnc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c(Cl)c1 ZINC001238485918 1055672146 /nfs/dbraw/zinc/67/21/46/1055672146.db2.gz XWOONJUJLMBLLG-QGZVFWFLSA-N 1 2 320.795 4.220 20 0 DIADLO O=C1CC[N@@H+](Cc2ccc(F)c(C3CC3)c2)[C@H]2CCCC[C@@H]12 ZINC001238496979 1055673217 /nfs/dbraw/zinc/67/32/17/1055673217.db2.gz AXSKIRZBRBGVHW-QAPCUYQASA-N 1 2 301.405 4.037 20 0 DIADLO O=C1CC[N@H+](Cc2ccc(F)c(C3CC3)c2)[C@H]2CCCC[C@@H]12 ZINC001238496979 1055673221 /nfs/dbraw/zinc/67/32/21/1055673221.db2.gz AXSKIRZBRBGVHW-QAPCUYQASA-N 1 2 301.405 4.037 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@H+](C)Cc2cccc(O)c2)c1F ZINC001238527611 1055679917 /nfs/dbraw/zinc/67/99/17/1055679917.db2.gz KWFKAYMQVVBTBO-UHFFFAOYSA-N 1 2 321.367 4.090 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@@H+](C)Cc2cccc(O)c2)c1F ZINC001238527611 1055679925 /nfs/dbraw/zinc/67/99/25/1055679925.db2.gz KWFKAYMQVVBTBO-UHFFFAOYSA-N 1 2 321.367 4.090 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@@H](C)c3nc4ccccc4s3)cn2c1 ZINC000765759451 1055684442 /nfs/dbraw/zinc/68/44/42/1055684442.db2.gz RBXWBDKMTYAFPK-ZDUSSCGKSA-N 1 2 322.437 4.103 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccccc2-c2ccc(F)cc2F)CCC1=O ZINC001238581974 1055691329 /nfs/dbraw/zinc/69/13/29/1055691329.db2.gz HLKHWJBPZAZPJR-CYBMUJFWSA-N 1 2 315.363 4.043 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccccc2-c2ccc(F)cc2F)CCC1=O ZINC001238581974 1055691333 /nfs/dbraw/zinc/69/13/33/1055691333.db2.gz HLKHWJBPZAZPJR-CYBMUJFWSA-N 1 2 315.363 4.043 20 0 DIADLO CCCCOC1C[NH+](Cc2cc(C)cnc2-c2ccccc2)C1 ZINC001238615524 1055698113 /nfs/dbraw/zinc/69/81/13/1055698113.db2.gz WNLMUFZPNDVDQT-UHFFFAOYSA-N 1 2 310.441 4.058 20 0 DIADLO Cc1cc(C[N@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)cnc1C1CC1 ZINC001238631226 1055702954 /nfs/dbraw/zinc/70/29/54/1055702954.db2.gz ISSVHYBDTCLMSB-OXJNMPFZSA-N 1 2 322.452 4.229 20 0 DIADLO Cc1cc(C[N@@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)cnc1C1CC1 ZINC001238631226 1055702966 /nfs/dbraw/zinc/70/29/66/1055702966.db2.gz ISSVHYBDTCLMSB-OXJNMPFZSA-N 1 2 322.452 4.229 20 0 DIADLO C[C@@H]1CC[C@](C)(/C=C/C(=O)Nc2ccn3cc[nH+]c3c2)C1(C)C ZINC001596391615 1055703663 /nfs/dbraw/zinc/70/36/63/1055703663.db2.gz MAJPKGRZVLFSET-FIBDNTHZSA-N 1 2 311.429 4.291 20 0 DIADLO CCOc1cc(F)c(F)cc1C[NH+]1CCC(C(F)(F)F)CC1 ZINC001238653230 1055709572 /nfs/dbraw/zinc/70/95/72/1055709572.db2.gz WKTDTQKFHFQBBK-UHFFFAOYSA-N 1 2 323.305 4.138 20 0 DIADLO C=Cc1ccc(CNc2cccc(Cc3ccncc3)[nH+]2)cc1 ZINC001168576530 1055715975 /nfs/dbraw/zinc/71/59/75/1055715975.db2.gz ZKPCEHQAOLFVPI-UHFFFAOYSA-N 1 2 301.393 4.323 20 0 DIADLO CC(C)C[C@@H](C(=O)N1CC[C@@H](C)c2ccccc21)n1cc[nH+]c1 ZINC001596529488 1055721020 /nfs/dbraw/zinc/72/10/20/1055721020.db2.gz ZOMIWDOIMKUIHA-QAPCUYQASA-N 1 2 311.429 4.011 20 0 DIADLO CCCOC1C[NH+](Cc2ccc(-c3ccc(Cl)cn3)cc2)C1 ZINC001238683690 1055721215 /nfs/dbraw/zinc/72/12/15/1055721215.db2.gz SPMYJIOHEBRRSF-UHFFFAOYSA-N 1 2 316.832 4.013 20 0 DIADLO CC1(C)CCC[C@@H](OC(=O)c2cccc(Cn3cc[nH+]c3)c2)C1 ZINC001596571848 1055724569 /nfs/dbraw/zinc/72/45/69/1055724569.db2.gz GCIJWELQPDILNJ-QGZVFWFLSA-N 1 2 312.413 4.057 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1ccc(F)c(F)c1Br ZINC001238752706 1055741982 /nfs/dbraw/zinc/74/19/82/1055741982.db2.gz CALICGRCSKSOKB-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1ccc(F)c(F)c1Br ZINC001238752706 1055741995 /nfs/dbraw/zinc/74/19/95/1055741995.db2.gz CALICGRCSKSOKB-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO CC[C@H](C)c1ccc(Nc2ccc[nH+]c2N2CCOCC2)cc1 ZINC001212358502 1055731681 /nfs/dbraw/zinc/73/16/81/1055731681.db2.gz MRDKRFHESWMVKN-HNNXBMFYSA-N 1 2 311.429 4.175 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c(F)cn1 ZINC001238727485 1055734716 /nfs/dbraw/zinc/73/47/16/1055734716.db2.gz JHZBOQVIUFVFLB-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2F)c(F)cn1 ZINC001238727485 1055734723 /nfs/dbraw/zinc/73/47/23/1055734723.db2.gz JHZBOQVIUFVFLB-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@H]2c2ccccc2F)c(F)cn1 ZINC001238727475 1055734787 /nfs/dbraw/zinc/73/47/87/1055734787.db2.gz JHZBOQVIUFVFLB-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@H]2c2ccccc2F)c(F)cn1 ZINC001238727475 1055734798 /nfs/dbraw/zinc/73/47/98/1055734798.db2.gz JHZBOQVIUFVFLB-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1cccc([C@@H]2CCCN2C(=O)c2cc3c[nH+]ccc3[nH]2)c1C ZINC001565889178 1055735541 /nfs/dbraw/zinc/73/55/41/1055735541.db2.gz DROFGGXMSKZRJP-IBGZPJMESA-N 1 2 319.408 4.157 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cc(Cl)cc2cccnc21 ZINC000046503335 1055740103 /nfs/dbraw/zinc/74/01/03/1055740103.db2.gz MJNXNAVUPAXRAH-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cc(Cl)cc2cccnc21 ZINC000046503335 1055740115 /nfs/dbraw/zinc/74/01/15/1055740115.db2.gz MJNXNAVUPAXRAH-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO Cc1cc(Nc2ccc[nH+]c2N2CCOCC2)ccc1C(C)C ZINC001212359958 1055740252 /nfs/dbraw/zinc/74/02/52/1055740252.db2.gz GCOZMGMMLKEKDR-UHFFFAOYSA-N 1 2 311.429 4.094 20 0 DIADLO CC(C)Oc1c(C[N@@H+]2CC[C@H](C(F)(F)F)C2)ccc(F)c1F ZINC001238751472 1055740637 /nfs/dbraw/zinc/74/06/37/1055740637.db2.gz XFPBDXLVEYGUTK-NSHDSACASA-N 1 2 323.305 4.136 20 0 DIADLO CC(C)Oc1c(C[N@H+]2CC[C@H](C(F)(F)F)C2)ccc(F)c1F ZINC001238751472 1055740650 /nfs/dbraw/zinc/74/06/50/1055740650.db2.gz XFPBDXLVEYGUTK-NSHDSACASA-N 1 2 323.305 4.136 20 0 DIADLO CC1(F)CC[NH+](Cc2ccc(F)c(F)c2Br)CC1 ZINC001238762823 1055742411 /nfs/dbraw/zinc/74/24/11/1055742411.db2.gz HXHGTDPUKZWLGH-UHFFFAOYSA-N 1 2 322.168 4.051 20 0 DIADLO Cc1cc(C[N@@H+]2CCC(F)(F)[C@@H](F)C2)cc(C)c1OC(C)C ZINC001238753627 1055742605 /nfs/dbraw/zinc/74/26/05/1055742605.db2.gz OKEOYXNNRGRWQI-HNNXBMFYSA-N 1 2 315.379 4.270 20 0 DIADLO Cc1cc(C[N@H+]2CCC(F)(F)[C@@H](F)C2)cc(C)c1OC(C)C ZINC001238753627 1055742617 /nfs/dbraw/zinc/74/26/17/1055742617.db2.gz OKEOYXNNRGRWQI-HNNXBMFYSA-N 1 2 315.379 4.270 20 0 DIADLO CC(C)Oc1cc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c(F)cn1 ZINC001238795059 1055751896 /nfs/dbraw/zinc/75/18/96/1055751896.db2.gz ULMHSCWSOVNQDB-AWEZNQCLSA-N 1 2 314.404 4.127 20 0 DIADLO CC(C)Oc1cc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c(F)cn1 ZINC001238795059 1055751907 /nfs/dbraw/zinc/75/19/07/1055751907.db2.gz ULMHSCWSOVNQDB-AWEZNQCLSA-N 1 2 314.404 4.127 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC(F)(F)C(C)(C)C2)cc1Cl ZINC001238787965 1055752645 /nfs/dbraw/zinc/75/26/45/1055752645.db2.gz KBUXTZDYJRXACN-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC(F)(F)C(C)(C)C2)cc1Cl ZINC001238787965 1055752653 /nfs/dbraw/zinc/75/26/53/1055752653.db2.gz KBUXTZDYJRXACN-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO CCCCN(C(=O)[C@@H](CC(C)C)n1cc[nH+]c1)c1ccccc1 ZINC001566224996 1055753767 /nfs/dbraw/zinc/75/37/67/1055753767.db2.gz GGIAVAJQWHOQCO-GOSISDBHSA-N 1 2 313.445 4.304 20 0 DIADLO COc1cc(F)c(C[N@H+](Cc2ccco2)C2CC2)cc1Cl ZINC001238800192 1055755088 /nfs/dbraw/zinc/75/50/88/1055755088.db2.gz ZSFPMAIXLVOXFE-UHFFFAOYSA-N 1 2 309.768 4.245 20 0 DIADLO COc1cc(F)c(C[N@@H+](Cc2ccco2)C2CC2)cc1Cl ZINC001238800192 1055755095 /nfs/dbraw/zinc/75/50/95/1055755095.db2.gz ZSFPMAIXLVOXFE-UHFFFAOYSA-N 1 2 309.768 4.245 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(C)c(C)c3)cc2[nH+]1 ZINC001566329931 1055762286 /nfs/dbraw/zinc/76/22/86/1055762286.db2.gz PMBKDYYDGLHTIU-DLBZAZTESA-N 1 2 319.408 4.230 20 0 DIADLO CC(C)Oc1cnc(F)c(-c2cc(N3CCCCC3)cc[nH+]2)c1 ZINC001238886657 1055780519 /nfs/dbraw/zinc/78/05/19/1055780519.db2.gz GJACLBATLMPAQT-UHFFFAOYSA-N 1 2 315.392 4.060 20 0 DIADLO C[C@H](CC(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccc(F)cc1 ZINC000057496942 1055782683 /nfs/dbraw/zinc/78/26/83/1055782683.db2.gz FJOBWXDACBJPOY-CQSZACIVSA-N 1 2 323.371 4.144 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccc(F)cc1 ZINC000057449722 1055783032 /nfs/dbraw/zinc/78/30/32/1055783032.db2.gz NDGQMQMGVHVZCQ-CQSZACIVSA-N 1 2 323.371 4.144 20 0 DIADLO Cc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)cnc1OCC(C)C ZINC001238924277 1055789790 /nfs/dbraw/zinc/78/97/90/1055789790.db2.gz WPQKFQWVWLLUFN-UHFFFAOYSA-N 1 2 321.424 4.337 20 0 DIADLO Cc1cc(-c2ccccc2Cn2cc[nH+]c2)cnc1OCC(C)C ZINC001238923363 1055790712 /nfs/dbraw/zinc/79/07/12/1055790712.db2.gz GUGUDYHBKDSOAE-UHFFFAOYSA-N 1 2 321.424 4.337 20 0 DIADLO Cc1cccc([C@@H](NC(=O)c2cc3c[nH+]ccc3[nH]2)C(C)(C)C)c1 ZINC001597149836 1055798134 /nfs/dbraw/zinc/79/81/34/1055798134.db2.gz DGTPNXOSNOQQSS-GOSISDBHSA-N 1 2 321.424 4.389 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000060467340 1055838211 /nfs/dbraw/zinc/83/82/11/1055838211.db2.gz LZCGSXAZPKATDI-KBXCAEBGSA-N 1 2 301.817 4.475 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000060467340 1055838221 /nfs/dbraw/zinc/83/82/21/1055838221.db2.gz LZCGSXAZPKATDI-KBXCAEBGSA-N 1 2 301.817 4.475 20 0 DIADLO CCCc1cc(C(=O)Nc2cc(N(C)C)cc[nH+]2)ccc1Cl ZINC001597486679 1055838505 /nfs/dbraw/zinc/83/85/05/1055838505.db2.gz MLBUCEMNDHUUEK-UHFFFAOYSA-N 1 2 317.820 4.006 20 0 DIADLO CC(C)n1ccc(-c2ncnc3c2C[N@H+](Cc2ccccc2)C3)c1 ZINC001239067359 1055838828 /nfs/dbraw/zinc/83/88/28/1055838828.db2.gz JADNXFCGFITPGD-UHFFFAOYSA-N 1 2 318.424 4.042 20 0 DIADLO CC(C)n1ccc(-c2ncnc3c2C[N@@H+](Cc2ccccc2)C3)c1 ZINC001239067359 1055838834 /nfs/dbraw/zinc/83/88/34/1055838834.db2.gz JADNXFCGFITPGD-UHFFFAOYSA-N 1 2 318.424 4.042 20 0 DIADLO CC(C)n1ccc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c1 ZINC001239079017 1055839368 /nfs/dbraw/zinc/83/93/68/1055839368.db2.gz OEPXQOQGAQGPKT-UHFFFAOYSA-N 1 2 321.424 4.379 20 0 DIADLO CC(C)n1ccc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c1 ZINC001239079017 1055839374 /nfs/dbraw/zinc/83/93/74/1055839374.db2.gz OEPXQOQGAQGPKT-UHFFFAOYSA-N 1 2 321.424 4.379 20 0 DIADLO Cc1cc(C(=O)Nc2c(C)c[nH+]cc2C)sc1-c1ccccc1 ZINC001597684039 1055864215 /nfs/dbraw/zinc/86/42/15/1055864215.db2.gz PFBNSRNIEZYQFE-UHFFFAOYSA-N 1 2 322.433 4.410 20 0 DIADLO CC(C)C[C@H](C(=O)N1CC[C@H](C(C)(C)C)C[C@@H]1C)n1cc[nH+]c1 ZINC001569936055 1055878293 /nfs/dbraw/zinc/87/82/93/1055878293.db2.gz GFWMBCZFWGNMLV-YESZJQIVSA-N 1 2 319.493 4.144 20 0 DIADLO CC(C)C[C@H](C(=O)N1CC[C@@H](C(C)(C)C)C[C@@H]1C)n1cc[nH+]c1 ZINC001569936053 1055878600 /nfs/dbraw/zinc/87/86/00/1055878600.db2.gz GFWMBCZFWGNMLV-GVDBMIGSSA-N 1 2 319.493 4.144 20 0 DIADLO O=C(c1cccc(-c2ccc(-n3cc[nH+]c3)cc2)c1)C(F)(F)F ZINC001239385402 1055884042 /nfs/dbraw/zinc/88/40/42/1055884042.db2.gz CGEFPNFYEYXICE-UHFFFAOYSA-N 1 2 316.282 4.284 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]C2(c3c(F)cccc3F)CCC2)cn1 ZINC000624344108 1055906704 /nfs/dbraw/zinc/90/67/04/1055906704.db2.gz GGCBLXDBPCLXGG-CYBMUJFWSA-N 1 2 319.399 4.472 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@H]1CCCC[C@H]1C1CC1 ZINC001598071072 1055909695 /nfs/dbraw/zinc/90/96/95/1055909695.db2.gz AXBHEBZTIPYZTI-IRXDYDNUSA-N 1 2 309.413 4.232 20 0 DIADLO O=C(CCCc1ccc(F)cc1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001598071057 1055910807 /nfs/dbraw/zinc/91/08/07/1055910807.db2.gz AFFMAIIUVKOORH-UHFFFAOYSA-N 1 2 323.371 4.177 20 0 DIADLO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2ncc(Br)cc2Cl)C1 ZINC001615640238 1055926760 /nfs/dbraw/zinc/92/67/60/1055926760.db2.gz UEKIMBKPRZYKKO-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO c1cn(-c2ccc(-c3ccc(-c4ccsc4)nn3)cc2)c[nH+]1 ZINC001239508417 1055920627 /nfs/dbraw/zinc/92/06/27/1055920627.db2.gz HSOQQAUZEGOKHB-UHFFFAOYSA-N 1 2 304.378 4.058 20 0 DIADLO C[C@@H]1CC[C@@H](C)[N@H+](Cc2ncc(Br)cc2Cl)C1 ZINC001615640238 1055926752 /nfs/dbraw/zinc/92/67/52/1055926752.db2.gz UEKIMBKPRZYKKO-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc3[nH+]ccn3c2)c(Cl)c1Cl ZINC001539935483 1055935960 /nfs/dbraw/zinc/93/59/60/1055935960.db2.gz NPNZKXOREJRMOS-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO CC(C)c1cc(N2CC[C@@H](c3ccncc3)C2)nc(C(C)C)[nH+]1 ZINC000624358641 1055946450 /nfs/dbraw/zinc/94/64/50/1055946450.db2.gz PPQCCOYMZVWBNR-MRXNPFEDSA-N 1 2 310.445 4.112 20 0 DIADLO Cc1cc(C)c(-c2ccc(C[NH+]3CCOCC3)cc2F)c(C)c1 ZINC001239550222 1055949251 /nfs/dbraw/zinc/94/92/51/1055949251.db2.gz MEFPFYZDCYSTBX-UHFFFAOYSA-N 1 2 313.416 4.250 20 0 DIADLO C[N@@H+]1CCc2oc(-c3ccc(-c4ccccc4F)cc3)nc2C1 ZINC001239554399 1055950512 /nfs/dbraw/zinc/95/05/12/1055950512.db2.gz OHHLTZULVHEAEZ-UHFFFAOYSA-N 1 2 308.356 4.136 20 0 DIADLO C[N@H+]1CCc2oc(-c3ccc(-c4ccccc4F)cc3)nc2C1 ZINC001239554399 1055950523 /nfs/dbraw/zinc/95/05/23/1055950523.db2.gz OHHLTZULVHEAEZ-UHFFFAOYSA-N 1 2 308.356 4.136 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+]1CCOc2cc(F)ccc2C1 ZINC001620467922 1055953378 /nfs/dbraw/zinc/95/33/78/1055953378.db2.gz PCSLFXDCKZXRNK-UHFFFAOYSA-N 1 2 305.780 4.182 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+]1CCOc2cc(F)ccc2C1 ZINC001620467922 1055953387 /nfs/dbraw/zinc/95/33/87/1055953387.db2.gz PCSLFXDCKZXRNK-UHFFFAOYSA-N 1 2 305.780 4.182 20 0 DIADLO CC[N@H+](CC(=O)N[C@H](C)CCC(C)C)Cc1ccccc1Cl ZINC001540040769 1055957985 /nfs/dbraw/zinc/95/79/85/1055957985.db2.gz ALGAAXGTVJXEQN-OAHLLOKOSA-N 1 2 324.896 4.103 20 0 DIADLO CC[N@@H+](CC(=O)N[C@H](C)CCC(C)C)Cc1ccccc1Cl ZINC001540040769 1055957998 /nfs/dbraw/zinc/95/79/98/1055957998.db2.gz ALGAAXGTVJXEQN-OAHLLOKOSA-N 1 2 324.896 4.103 20 0 DIADLO Cc1c(C)c(C)c(-c2ccc(C[NH+]3CCOCC3)nc2)c(C)c1C ZINC001239582875 1055964243 /nfs/dbraw/zinc/96/42/43/1055964243.db2.gz HBDBLBXROIMRMR-UHFFFAOYSA-N 1 2 324.468 4.123 20 0 DIADLO CCc1ccc(-c2ncnc3c2C[N@H+](Cc2ccccc2)C3)cc1 ZINC001239588471 1055968444 /nfs/dbraw/zinc/96/84/44/1055968444.db2.gz SVUJNGHKGCJETK-UHFFFAOYSA-N 1 2 315.420 4.222 20 0 DIADLO CCc1ccc(-c2ncnc3c2C[N@@H+](Cc2ccccc2)C3)cc1 ZINC001239588471 1055968457 /nfs/dbraw/zinc/96/84/57/1055968457.db2.gz SVUJNGHKGCJETK-UHFFFAOYSA-N 1 2 315.420 4.222 20 0 DIADLO Cc1cc(-c2ccc(C[NH+]3CCOCC3)nc2)cc(C(C)(C)C)c1 ZINC001239593246 1055969346 /nfs/dbraw/zinc/96/93/46/1055969346.db2.gz HOEHTPZWHXCQHU-UHFFFAOYSA-N 1 2 324.468 4.187 20 0 DIADLO Fc1c(CNc2c[nH+]cc3c2CCCC3)cccc1OC1CC1 ZINC001621004175 1055970457 /nfs/dbraw/zinc/97/04/57/1055970457.db2.gz MERBMDSIJMMCNH-UHFFFAOYSA-N 1 2 312.388 4.253 20 0 DIADLO CCOC(=O)c1c[nH]c2nc[nH+]c(-c3ccc(C(C)(C)C)cc3)c12 ZINC001239605328 1055973945 /nfs/dbraw/zinc/97/39/45/1055973945.db2.gz AMNOXPMQHAWAGB-UHFFFAOYSA-N 1 2 323.396 4.099 20 0 DIADLO CC(C)(F)C[NH2+]Cc1c(F)c(Cl)ccc1Br ZINC001621027830 1055993445 /nfs/dbraw/zinc/99/34/45/1055993445.db2.gz ZMIGQKBHSVOIND-UHFFFAOYSA-N 1 2 312.585 4.079 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1nccc2c1CCCC2 ZINC001621043505 1056004254 /nfs/dbraw/zinc/00/42/54/1056004254.db2.gz IXCMEKCZWWPOIA-QUCCMNQESA-N 1 2 310.416 4.076 20 0 DIADLO Cc1ccc2[nH+]c(NCc3cccc(OC(F)(F)F)c3)[nH]c2c1 ZINC001621045663 1056004383 /nfs/dbraw/zinc/00/43/83/1056004383.db2.gz CPMOSHMHCXLPCV-UHFFFAOYSA-N 1 2 321.302 4.382 20 0 DIADLO CC[C@@H]([NH2+]Cc1cccc(O)c1)c1nc(C(F)(F)F)cs1 ZINC001620814104 1056006700 /nfs/dbraw/zinc/00/67/00/1056006700.db2.gz DTIMIYGEHMMVDZ-LLVKDONJSA-N 1 2 316.348 4.108 20 0 DIADLO CN(Cc1ccccc1)c1ccc(-c2cccc3[nH+]ccn32)cn1 ZINC001239660182 1056008269 /nfs/dbraw/zinc/00/82/69/1056008269.db2.gz HCCXSPHSWJOQEP-UHFFFAOYSA-N 1 2 314.392 4.033 20 0 DIADLO Cc1ccc(C[NH2+]Cc2nc3ccc(F)cc3s2)c(Cl)n1 ZINC001621048282 1056009003 /nfs/dbraw/zinc/00/90/03/1056009003.db2.gz BQQIXDDCQLPOTD-UHFFFAOYSA-N 1 2 321.808 4.082 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1ccncc1Cl ZINC001621051155 1056010905 /nfs/dbraw/zinc/01/09/05/1056010905.db2.gz RKKKMYYPVKTZNB-UHFFFAOYSA-N 1 2 314.820 4.452 20 0 DIADLO CCc1ccc(NC(=O)[C@H]2CC[C@@H](Nc3cccc[nH+]3)CC2)cc1 ZINC001540385657 1056024678 /nfs/dbraw/zinc/02/46/78/1056024678.db2.gz IVEWNVVCNKGORD-CALCHBBNSA-N 1 2 323.440 4.253 20 0 DIADLO Cc1cn2cc(NC(=O)NCc3cccc(C(C)C)c3)ccc2[nH+]1 ZINC001623032352 1056030155 /nfs/dbraw/zinc/03/01/55/1056030155.db2.gz OYEVQPFECUBGDZ-UHFFFAOYSA-N 1 2 322.412 4.088 20 0 DIADLO Cc1ccc(Oc2ccc(NC(=O)CCn3cc[nH+]c3)cc2)cc1 ZINC000072622106 1056031480 /nfs/dbraw/zinc/03/14/80/1056031480.db2.gz JUGHTNDGBSVPIY-UHFFFAOYSA-N 1 2 321.380 4.013 20 0 DIADLO Cc1cc(F)ccc1-c1ncnc2c1C[N@H+](Cc1ccccc1)C2 ZINC001239736973 1056047891 /nfs/dbraw/zinc/04/78/91/1056047891.db2.gz OAZCTFGGTMTORT-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO Cc1cc(F)ccc1-c1ncnc2c1C[N@@H+](Cc1ccccc1)C2 ZINC001239736973 1056047906 /nfs/dbraw/zinc/04/79/06/1056047906.db2.gz OAZCTFGGTMTORT-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO CC(C)C[C@@H](C(=O)N(C)c1ccc2ccccc2c1)n1cc[nH+]c1 ZINC001540590288 1056047983 /nfs/dbraw/zinc/04/79/83/1056047983.db2.gz FYVIETRNQDRFNR-IBGZPJMESA-N 1 2 321.424 4.287 20 0 DIADLO Cc1cccc(NC(=O)C[C@H](c2[nH]cc[nH+]2)c2ccccc2)c1C ZINC001540600744 1056050377 /nfs/dbraw/zinc/05/03/77/1056050377.db2.gz ZSHDKEFHBGHICM-KRWDZBQOSA-N 1 2 319.408 4.187 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)[C@@H]1CCC[C@@H]2CCCC[C@H]12 ZINC001540719895 1056067782 /nfs/dbraw/zinc/06/77/82/1056067782.db2.gz ZETNSYYZAMWYLE-YESZJQIVSA-N 1 2 323.440 4.417 20 0 DIADLO CCc1nc(OC)ccc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001239772985 1056068507 /nfs/dbraw/zinc/06/85/07/1056068507.db2.gz PYXAMHVJTLNFDV-UHFFFAOYSA-N 1 2 311.429 4.013 20 0 DIADLO COc1ccsc1[C@H](C)Nc1ccc2c(c1)CCC[N@H+]2C ZINC000186271490 1056082576 /nfs/dbraw/zinc/08/25/76/1056082576.db2.gz BEMTYEHHFVXRAI-LBPRGKRZSA-N 1 2 302.443 4.312 20 0 DIADLO COc1ccsc1[C@H](C)Nc1ccc2c(c1)CCC[N@@H+]2C ZINC000186271490 1056082589 /nfs/dbraw/zinc/08/25/89/1056082589.db2.gz BEMTYEHHFVXRAI-LBPRGKRZSA-N 1 2 302.443 4.312 20 0 DIADLO Cc1ccc(N(C)C(=O)[C@H]2CC[C@@H](Nc3cccc[nH+]3)CC2)cc1 ZINC001610951033 1056083718 /nfs/dbraw/zinc/08/37/18/1056083718.db2.gz WXUAKXUGZVLWTL-CALCHBBNSA-N 1 2 323.440 4.024 20 0 DIADLO Nc1cn2ccc(-c3ccccc3OCc3ccccc3)cc2[nH+]1 ZINC001239832264 1056099243 /nfs/dbraw/zinc/09/92/43/1056099243.db2.gz UHWNHLPBDVWAET-UHFFFAOYSA-N 1 2 315.376 4.163 20 0 DIADLO CC[C@@H](CC(C)C)C(=O)N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC001611051912 1056101314 /nfs/dbraw/zinc/10/13/14/1056101314.db2.gz FNVBSBRPNDNLLY-HOTGVXAUSA-N 1 2 313.445 4.122 20 0 DIADLO Cc1csc(C[NH2+][C@@H](c2ccccc2)c2cccc(F)c2)n1 ZINC000088536707 1056106109 /nfs/dbraw/zinc/10/61/09/1056106109.db2.gz XOOJNRZCCPPUGB-SFHVURJKSA-N 1 2 312.413 4.470 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@@H]2CCOc3ccc(F)cc32)n1 ZINC000765803682 1056120986 /nfs/dbraw/zinc/12/09/86/1056120986.db2.gz OZWKBCHGNMFIBE-CYBMUJFWSA-N 1 2 320.433 4.193 20 0 DIADLO CCN(CC)C(=O)c1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001239888754 1056132486 /nfs/dbraw/zinc/13/24/86/1056132486.db2.gz KLMHTUGRPPBQNW-UHFFFAOYSA-N 1 2 319.408 4.021 20 0 DIADLO CC(C)O[C@@H]1C[C@H](Nc2ccc([NH+]3CCCC3)cc2)C1(C)C ZINC000765811336 1056152023 /nfs/dbraw/zinc/15/20/23/1056152023.db2.gz QAPCBEHOFDUFSE-ZWKOTPCHSA-N 1 2 302.462 4.291 20 0 DIADLO CC(C)O[C@H]1C[C@@H](Nc2ccc([NH+]3CCCC3)cc2)C1(C)C ZINC000765811329 1056153430 /nfs/dbraw/zinc/15/34/30/1056153430.db2.gz QAPCBEHOFDUFSE-MSOLQXFVSA-N 1 2 302.462 4.291 20 0 DIADLO Cc1cc(NC(=O)C(C)(C)c2ccccc2)ccc1-n1cc[nH+]c1 ZINC001542875315 1056160684 /nfs/dbraw/zinc/16/06/84/1056160684.db2.gz BHTANOLBNSTJTK-UHFFFAOYSA-N 1 2 319.408 4.097 20 0 DIADLO Cc1c(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)ccn1C(C)C ZINC001542877303 1056162220 /nfs/dbraw/zinc/16/22/20/1056162220.db2.gz QWAKXCATGSYMEI-UHFFFAOYSA-N 1 2 322.412 4.124 20 0 DIADLO CC(C)n1ccnc1C[NH2+]Cc1c(Cl)oc2ccccc21 ZINC000623645053 1056167368 /nfs/dbraw/zinc/16/73/68/1056167368.db2.gz MDENGFOCFYVGJZ-UHFFFAOYSA-N 1 2 303.793 4.153 20 0 DIADLO CS[C@H](C)CCC(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1 ZINC000921662456 1056170398 /nfs/dbraw/zinc/17/03/98/1056170398.db2.gz MVJAOVBLDWNFOQ-LLVKDONJSA-N 1 2 317.458 4.164 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(OCC(F)(F)F)nc2)c1 ZINC001239955392 1056192469 /nfs/dbraw/zinc/19/24/69/1056192469.db2.gz HAURDGCEEBNZOM-UHFFFAOYSA-N 1 2 324.302 4.052 20 0 DIADLO CCc1cc(NCCc2csc3ccccc23)nc(CC)[nH+]1 ZINC001611817908 1056195573 /nfs/dbraw/zinc/19/55/73/1056195573.db2.gz HHYQCIHYJKIIFE-UHFFFAOYSA-N 1 2 311.454 4.471 20 0 DIADLO CC(C)c1ccc(CCCNC(=O)c2cc3c[nH+]ccc3[nH]2)cc1 ZINC001543351150 1056206119 /nfs/dbraw/zinc/20/61/19/1056206119.db2.gz LESQLLYHBUERLA-UHFFFAOYSA-N 1 2 321.424 4.049 20 0 DIADLO CCCOc1ccc(-c2cccc3[nH+]c(C)cn32)c(F)c1F ZINC001239969959 1056209912 /nfs/dbraw/zinc/20/99/12/1056209912.db2.gz FAALCDDBCDIQJE-UHFFFAOYSA-N 1 2 302.324 4.377 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)o1 ZINC000765820144 1056211628 /nfs/dbraw/zinc/21/16/28/1056211628.db2.gz SVAGZIUPLHWKMH-CZUORRHYSA-N 1 2 301.434 4.348 20 0 DIADLO CCCC[N@H+](C)c1ccc(Nc2ncnc3c2CCCC3)cc1 ZINC001611953371 1056215574 /nfs/dbraw/zinc/21/55/74/1056215574.db2.gz XCWQBHLPYRIGQL-UHFFFAOYSA-N 1 2 310.445 4.335 20 0 DIADLO CCCC[N@@H+](C)c1ccc(Nc2ncnc3c2CCCC3)cc1 ZINC001611953371 1056215585 /nfs/dbraw/zinc/21/55/85/1056215585.db2.gz XCWQBHLPYRIGQL-UHFFFAOYSA-N 1 2 310.445 4.335 20 0 DIADLO CC(C)(C)NC(=O)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001239993292 1056232768 /nfs/dbraw/zinc/23/27/68/1056232768.db2.gz MCMSQMUSQXFXMU-UHFFFAOYSA-N 1 2 319.408 4.272 20 0 DIADLO Cc1cccc(C2(C(=O)Nc3cc(C)[nH+]cc3C)CCCCC2)c1 ZINC001584008890 1056234569 /nfs/dbraw/zinc/23/45/69/1056234569.db2.gz BWUXXKFOALLQRG-UHFFFAOYSA-N 1 2 322.452 4.269 20 0 DIADLO COc1cc(F)ccc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001239996209 1056234772 /nfs/dbraw/zinc/23/47/72/1056234772.db2.gz FPRCWJFJUALBGX-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO Cc1cc(N2CC[C@@H](c3ccccc3)[C@H]2C)nc(C2CCC2)[nH+]1 ZINC001612074102 1056234705 /nfs/dbraw/zinc/23/47/05/1056234705.db2.gz VBKWHQRVBDBBOU-CRAIPNDOSA-N 1 2 307.441 4.435 20 0 DIADLO Cc1nc(N2CCCC[C@H]2CCC(C)C)c2c([nH+]1)CCCC2 ZINC001612132441 1056243497 /nfs/dbraw/zinc/24/34/97/1056243497.db2.gz YVLYBLZNINIYCG-INIZCTEOSA-N 1 2 301.478 4.459 20 0 DIADLO Cc1nc(N2CCCC[C@@H]2CCC(C)C)c2c([nH+]1)CCCC2 ZINC001612132442 1056243833 /nfs/dbraw/zinc/24/38/33/1056243833.db2.gz YVLYBLZNINIYCG-MRXNPFEDSA-N 1 2 301.478 4.459 20 0 DIADLO CC(=O)n1ncc2ccc(Nc3ccc4c(C)cc[nH+]c4c3)cc21 ZINC001212422505 1056246578 /nfs/dbraw/zinc/24/65/78/1056246578.db2.gz CQNIZZGJGMLFIP-UHFFFAOYSA-N 1 2 316.364 4.297 20 0 DIADLO c1cc(-c2ccc(N3CCCCC3)cc2)cc(N2CCCC2)[nH+]1 ZINC001240012705 1056251917 /nfs/dbraw/zinc/25/19/17/1056251917.db2.gz POAGDAPDNWOBOJ-UHFFFAOYSA-N 1 2 307.441 4.339 20 0 DIADLO COc1ccc(-c2c[nH+]c(N3CCCCC3)cc2C)c(F)c1 ZINC001240020742 1056259159 /nfs/dbraw/zinc/25/91/59/1056259159.db2.gz QZYXBNMQYKDBNJ-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO COc1ccc(-c2cc[nH+]c(N3CCCCC3)c2)cc1Cl ZINC001240031976 1056268868 /nfs/dbraw/zinc/26/88/68/1056268868.db2.gz RBABEWQFFFHWOS-UHFFFAOYSA-N 1 2 302.805 4.401 20 0 DIADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccc(-c2ccccc2)cc1F ZINC001543643724 1056270285 /nfs/dbraw/zinc/27/02/85/1056270285.db2.gz HYEBUHTYIDIWEB-ZDUSSCGKSA-N 1 2 323.371 4.033 20 0 DIADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccc(-c2ccccc2)cc1F ZINC001543643724 1056270304 /nfs/dbraw/zinc/27/03/04/1056270304.db2.gz HYEBUHTYIDIWEB-ZDUSSCGKSA-N 1 2 323.371 4.033 20 0 DIADLO Cc1cc(CNC(=O)CC(C)(C)C2CCCCC2)cc(C)[nH+]1 ZINC001584184928 1056278929 /nfs/dbraw/zinc/27/89/29/1056278929.db2.gz YVEQUOJYVBWESP-UHFFFAOYSA-N 1 2 302.462 4.311 20 0 DIADLO CC(C)(C)[C@H]1CCC[C@H]1Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001612471899 1056295642 /nfs/dbraw/zinc/29/56/42/1056295642.db2.gz ZXKDOCXYZVJTFL-UONOGXRCSA-N 1 2 315.465 4.208 20 0 DIADLO Cc1cc(N2CCC[C@H]2c2ccc(F)cc2C)nc(C2CC2)[nH+]1 ZINC001612484457 1056295890 /nfs/dbraw/zinc/29/58/90/1056295890.db2.gz SBSVSAHGNVOIGC-KRWDZBQOSA-N 1 2 311.404 4.451 20 0 DIADLO CC[C@@H](CNc1nc(C)[nH+]c2c1CCCC2)CC(F)(F)F ZINC001612497648 1056296597 /nfs/dbraw/zinc/29/65/97/1056296597.db2.gz TZIGPPVYMSXGPN-LLVKDONJSA-N 1 2 301.356 4.054 20 0 DIADLO Cc1cc[nH+]c(C)c1-c1cccc(C(=O)NCc2ccccc2)c1 ZINC001240077737 1056304128 /nfs/dbraw/zinc/30/41/28/1056304128.db2.gz YKDDWMFPUMOMDB-UHFFFAOYSA-N 1 2 316.404 4.295 20 0 DIADLO CCCCNC(=O)c1cccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001240088266 1056316316 /nfs/dbraw/zinc/31/63/16/1056316316.db2.gz ZTDBDHJVVHSWSL-UHFFFAOYSA-N 1 2 319.408 4.274 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccc(F)cc2)C2CC2)nc2ccccc12 ZINC000107896029 1056320541 /nfs/dbraw/zinc/32/05/41/1056320541.db2.gz BONXCWRIZZIIJA-UHFFFAOYSA-N 1 2 321.399 4.242 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccc(F)cc2)C2CC2)nc2ccccc12 ZINC000107896029 1056320555 /nfs/dbraw/zinc/32/05/55/1056320555.db2.gz BONXCWRIZZIIJA-UHFFFAOYSA-N 1 2 321.399 4.242 20 0 DIADLO Cc1nc(N(C)C[C@H](C)C2CCCCC2)c2c([nH+]1)CCCC2 ZINC001612728283 1056324456 /nfs/dbraw/zinc/32/44/56/1056324456.db2.gz YTMWSGCDPDQXHI-AWEZNQCLSA-N 1 2 301.478 4.316 20 0 DIADLO O=C(Nc1ccccc1)c1cccc(-c2cccn3cc[nH+]c23)c1 ZINC001240112716 1056335711 /nfs/dbraw/zinc/33/57/11/1056335711.db2.gz MLCDXEFGTLWDRT-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO CCc1cc(NCC2(c3cccc(F)c3)CCC2)nc(CC)[nH+]1 ZINC001612874451 1056335550 /nfs/dbraw/zinc/33/55/50/1056335550.db2.gz ARIFTBUEMYKNDD-UHFFFAOYSA-N 1 2 313.420 4.274 20 0 DIADLO Clc1cscc1CNc1nc2ccccc2n2c[nH+]cc12 ZINC001612920145 1056338261 /nfs/dbraw/zinc/33/82/61/1056338261.db2.gz NPWWIFGULHNENG-UHFFFAOYSA-N 1 2 314.801 4.210 20 0 DIADLO COc1ccc(F)c(-c2c[nH+]c(N3CCCCC3)cc2C)c1 ZINC001240117588 1056338258 /nfs/dbraw/zinc/33/82/58/1056338258.db2.gz YLILBOOZDJZADG-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO CC(C)(C)C[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1ccccc1 ZINC001544014281 1056343465 /nfs/dbraw/zinc/34/34/65/1056343465.db2.gz UMVLOZQUBSPWRJ-SFHVURJKSA-N 1 2 321.424 4.470 20 0 DIADLO Cc1cccc2nc(C[NH2+][C@@H](C)c3nc4ccccc4s3)cn21 ZINC000765897750 1056357005 /nfs/dbraw/zinc/35/70/05/1056357005.db2.gz FLFFSGXDARKWET-ZDUSSCGKSA-N 1 2 322.437 4.103 20 0 DIADLO Cc1cc(N[C@H]2CCCc3cccnc32)[nH+]cc1C(F)(F)F ZINC001168649129 1056357825 /nfs/dbraw/zinc/35/78/25/1056357825.db2.gz CXIRGQHDQZTLBA-ZDUSSCGKSA-N 1 2 307.319 4.293 20 0 DIADLO CCn1c(C[NH2+]Cc2sccc2Cl)nc2ccccc21 ZINC000785450658 1056362827 /nfs/dbraw/zinc/36/28/27/1056362827.db2.gz DFSCTFQIAHVVCG-UHFFFAOYSA-N 1 2 305.834 4.061 20 0 DIADLO COC(=O)c1cc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)oc1C ZINC000302875724 1056363545 /nfs/dbraw/zinc/36/35/45/1056363545.db2.gz KXPPDQNDFCQRQP-NSHDSACASA-N 1 2 321.804 4.221 20 0 DIADLO COC(=O)c1cc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)oc1C ZINC000302875724 1056363555 /nfs/dbraw/zinc/36/35/55/1056363555.db2.gz KXPPDQNDFCQRQP-NSHDSACASA-N 1 2 321.804 4.221 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2cccs2)n1)c1ccccn1 ZINC000057570476 1056365051 /nfs/dbraw/zinc/36/50/51/1056365051.db2.gz RMGKOXIOFNNFOZ-NSHDSACASA-N 1 2 301.440 4.117 20 0 DIADLO Cc1cccc(Sc2cncc(-c3ccc4[nH+]ccn4c3)n2)c1 ZINC001240216390 1056373236 /nfs/dbraw/zinc/37/32/36/1056373236.db2.gz GNSXZHGRTBNEBT-UHFFFAOYSA-N 1 2 318.405 4.251 20 0 DIADLO CC(C)(C)c1cc2c(ncnc2-c2ccc3[nH+]ccn3c2)s1 ZINC001240214315 1056374407 /nfs/dbraw/zinc/37/44/07/1056374407.db2.gz NUYQHOGTPHAEGJ-UHFFFAOYSA-N 1 2 308.410 4.304 20 0 DIADLO CC(C)(c1cc(-c2ccc3[nH+]ccn3c2)ccn1)C(F)(F)F ZINC001240219047 1056376679 /nfs/dbraw/zinc/37/66/79/1056376679.db2.gz WKLLXVMPSLRUSN-UHFFFAOYSA-N 1 2 305.303 4.236 20 0 DIADLO COC(=O)c1cc2cc(-c3ccc4[nH+]ccn4c3)ccc2s1 ZINC001240218028 1056377044 /nfs/dbraw/zinc/37/70/44/1056377044.db2.gz WXRNLHHTJGJBAM-UHFFFAOYSA-N 1 2 308.362 4.003 20 0 DIADLO CCc1cc(-c2ccc3[nH+]ccn3c2)nnc1-c1ccccc1 ZINC001240217064 1056377289 /nfs/dbraw/zinc/37/72/89/1056377289.db2.gz ZWLKBXAJYKDURD-UHFFFAOYSA-N 1 2 300.365 4.021 20 0 DIADLO COc1cc(C)[nH+]c(CS[C@@H]2CCOc3ccccc32)c1 ZINC001613618536 1056392490 /nfs/dbraw/zinc/39/24/90/1056392490.db2.gz VNBWSNIRKHCKPJ-QGZVFWFLSA-N 1 2 301.411 4.156 20 0 DIADLO Cc1cc(-c2cccc(OCc3ccccc3F)c2)c[nH+]c1N ZINC001240265053 1056400346 /nfs/dbraw/zinc/40/03/46/1056400346.db2.gz PINYYNWQWXXTQR-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(C(F)(F)F)nc1 ZINC001240268293 1056401994 /nfs/dbraw/zinc/40/19/94/1056401994.db2.gz BKGNRAFEMULLOK-UHFFFAOYSA-N 1 2 321.346 4.461 20 0 DIADLO C/C(=C/c1ccc(C)cc1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001544349938 1056410945 /nfs/dbraw/zinc/41/09/45/1056410945.db2.gz GUJCWDMUTWPQJK-SQFISAMPSA-N 1 2 317.392 4.427 20 0 DIADLO C/C(=C(\F)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C1CC1 ZINC001544368768 1056414738 /nfs/dbraw/zinc/41/47/38/1056414738.db2.gz JAFZJMZZIWGCTF-XNTDXEJSSA-N 1 2 319.767 4.118 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccnc(C(F)(F)F)c2)cc1 ZINC001240339748 1056434237 /nfs/dbraw/zinc/43/42/37/1056434237.db2.gz LNCYUGGTDSWHCJ-UHFFFAOYSA-N 1 2 303.287 4.168 20 0 DIADLO CCOC(=O)c1ccc(SCc2ccc(C)[nH+]c2C)c(F)c1 ZINC001614558837 1056440829 /nfs/dbraw/zinc/44/08/29/1056440829.db2.gz NVERWZVXKQPZOJ-UHFFFAOYSA-N 1 2 319.401 4.307 20 0 DIADLO Cc1cc(NC(=O)[C@]2(C)CC=C(C)CC2)ccc1-n1cc[nH+]c1 ZINC001584953068 1056449659 /nfs/dbraw/zinc/44/96/59/1056449659.db2.gz MVLLRXLEIOJKIE-LJQANCHMSA-N 1 2 309.413 4.256 20 0 DIADLO CC(C)(C)c1cn(Cc2ccc(OCC(F)(F)F)cc2)c[nH+]1 ZINC001614787052 1056452976 /nfs/dbraw/zinc/45/29/76/1056452976.db2.gz FOQJTWLSIXDNLA-UHFFFAOYSA-N 1 2 312.335 4.170 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1nc2ccccc2n1C(F)F ZINC000072585066 1056460264 /nfs/dbraw/zinc/46/02/64/1056460264.db2.gz WQEQZWPHUCLAQX-UHFFFAOYSA-N 1 2 321.293 4.206 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1nc2ccccc2n1C(F)F ZINC000072585066 1056460272 /nfs/dbraw/zinc/46/02/72/1056460272.db2.gz WQEQZWPHUCLAQX-UHFFFAOYSA-N 1 2 321.293 4.206 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+]C2(c3ccc(F)cc3)CCC2)o1 ZINC000624773482 1056472288 /nfs/dbraw/zinc/47/22/88/1056472288.db2.gz VPALGUQQVCWEPE-UHFFFAOYSA-N 1 2 302.393 4.280 20 0 DIADLO Cc1ccc(C)c(OC2CC[NH+](C/C(Cl)=C\Cl)CC2)c1 ZINC001615264889 1056484272 /nfs/dbraw/zinc/48/42/72/1056484272.db2.gz HENHQXBMLZFAHG-GXDHUFHOSA-N 1 2 314.256 4.466 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1ncccc1Br ZINC000382424921 1056490549 /nfs/dbraw/zinc/49/05/49/1056490549.db2.gz WCUZXSDLEURWGM-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1ncccc1Br ZINC000382424921 1056490554 /nfs/dbraw/zinc/49/05/54/1056490554.db2.gz WCUZXSDLEURWGM-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO COc1ccc(F)c(F)c1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001240436919 1056508055 /nfs/dbraw/zinc/50/80/55/1056508055.db2.gz NMYCDZMOQOYZEF-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO COC(=O)c1cc2c(cccc2-c2ccn3cc[nH+]c3c2)s1 ZINC001240503372 1056540305 /nfs/dbraw/zinc/54/03/05/1056540305.db2.gz NCKDNIUXKVDEBB-UHFFFAOYSA-N 1 2 308.362 4.003 20 0 DIADLO CCc1ccc([C@H]2COCC[N@@H+]2CC/C=C/c2ccccc2)o1 ZINC001615583692 1056540554 /nfs/dbraw/zinc/54/05/54/1056540554.db2.gz NJUBWQWEBUBSPG-ZAOIQFLMSA-N 1 2 311.425 4.319 20 0 DIADLO CCc1ccc([C@H]2COCC[N@H+]2CC/C=C/c2ccccc2)o1 ZINC001615583692 1056540570 /nfs/dbraw/zinc/54/05/70/1056540570.db2.gz NJUBWQWEBUBSPG-ZAOIQFLMSA-N 1 2 311.425 4.319 20 0 DIADLO Cc1cnc(-c2ccn3cc[nH+]c3c2)nc1-c1c(F)cccc1F ZINC001240503361 1056541391 /nfs/dbraw/zinc/54/13/91/1056541391.db2.gz MRMQGEVTSKNHAY-UHFFFAOYSA-N 1 2 322.318 4.045 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccc4oc(C)c(C)c4c3)ccn12 ZINC001128156610 1056541797 /nfs/dbraw/zinc/54/17/97/1056541797.db2.gz SNHBFMLGSZHOBS-UHFFFAOYSA-N 1 2 319.364 4.258 20 0 DIADLO c1coc(-c2csc3ncnc(-c4ccn5cc[nH+]c5c4)c23)c1 ZINC001240504512 1056542780 /nfs/dbraw/zinc/54/27/80/1056542780.db2.gz QJQDHOUONNUPAC-UHFFFAOYSA-N 1 2 318.361 4.266 20 0 DIADLO c1cn2ccc(-c3ccc(-c4cn5ccsc5n4)cc3)cc2[nH+]1 ZINC001240510524 1056543489 /nfs/dbraw/zinc/54/34/89/1056543489.db2.gz MWSRRSCNDHSQKA-UHFFFAOYSA-N 1 2 316.389 4.378 20 0 DIADLO CC(C)(C)C(=O)Nc1cc(F)ccc1-c1ccn2cc[nH+]c2c1 ZINC001240511943 1056544176 /nfs/dbraw/zinc/54/41/76/1056544176.db2.gz NADFXONHKSJOFD-UHFFFAOYSA-N 1 2 311.360 4.125 20 0 DIADLO CC(C)(c1cc(-c2ccn3cc[nH+]c3c2)ccn1)C(F)(F)F ZINC001240511957 1056544203 /nfs/dbraw/zinc/54/42/03/1056544203.db2.gz NKUOETBWOSQCGJ-UHFFFAOYSA-N 1 2 305.303 4.236 20 0 DIADLO C/C(=C\C1CCC(C)CC1)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001585398812 1056544827 /nfs/dbraw/zinc/54/48/27/1056544827.db2.gz LUGKNCJXMQSLEL-NTEUORMPSA-N 1 2 300.446 4.087 20 0 DIADLO Cc1cc(OCc2ccccc2)ncc1-c1ccn2cc[nH+]c2c1 ZINC001240513340 1056546921 /nfs/dbraw/zinc/54/69/21/1056546921.db2.gz MSXNVZCCTODGAM-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO Fc1ccccc1COc1cc(-c2ccn3cc[nH+]c3c2)ccn1 ZINC001240512955 1056547093 /nfs/dbraw/zinc/54/70/93/1056547093.db2.gz DNUKOENTYWDHQZ-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO CC(C)COc1c(F)cc(-c2ccn3cc[nH+]c3c2)cc1F ZINC001240513422 1056547564 /nfs/dbraw/zinc/54/75/64/1056547564.db2.gz RGLHTWSFSKCXPV-UHFFFAOYSA-N 1 2 302.324 4.314 20 0 DIADLO CCCOc1cccc(C[N@@H+]2CCOC[C@H]2c2ccccc2)c1 ZINC001615665052 1056557750 /nfs/dbraw/zinc/55/77/50/1056557750.db2.gz IWJCORUGXLXAMD-FQEVSTJZSA-N 1 2 311.425 4.049 20 0 DIADLO CCCOc1cccc(C[N@H+]2CCOC[C@H]2c2ccccc2)c1 ZINC001615665052 1056557767 /nfs/dbraw/zinc/55/77/67/1056557767.db2.gz IWJCORUGXLXAMD-FQEVSTJZSA-N 1 2 311.425 4.049 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cccc(N3CCCC3)c2)cc1F ZINC001240537971 1056561922 /nfs/dbraw/zinc/56/19/22/1056561922.db2.gz RKBMPGHPSZSWJU-UHFFFAOYSA-N 1 2 316.395 4.294 20 0 DIADLO Fc1cc(CNc2cc3cc[nH]c3c[nH+]2)ccc1Br ZINC000672197502 1056564183 /nfs/dbraw/zinc/56/41/83/1056564183.db2.gz ADNDDSMNLARUFY-UHFFFAOYSA-N 1 2 320.165 4.077 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(Br)s1 ZINC001615726322 1056570955 /nfs/dbraw/zinc/57/09/55/1056570955.db2.gz SWNSZPBOSDMAFV-LLVKDONJSA-N 1 2 322.271 4.457 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccc(Br)s1 ZINC001615726322 1056570963 /nfs/dbraw/zinc/57/09/63/1056570963.db2.gz SWNSZPBOSDMAFV-LLVKDONJSA-N 1 2 322.271 4.457 20 0 DIADLO Clc1cccc(CC[N@@H+]2CCOC3(CCCC3)C2)c1Cl ZINC001615878250 1056590532 /nfs/dbraw/zinc/59/05/32/1056590532.db2.gz XMFBQMXCOJIUCQ-UHFFFAOYSA-N 1 2 314.256 4.181 20 0 DIADLO Clc1cccc(CC[N@H+]2CCOC3(CCCC3)C2)c1Cl ZINC001615878250 1056590548 /nfs/dbraw/zinc/59/05/48/1056590548.db2.gz XMFBQMXCOJIUCQ-UHFFFAOYSA-N 1 2 314.256 4.181 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2ccn(-c3ccccc3)n2)cc1 ZINC000063517858 1056591142 /nfs/dbraw/zinc/59/11/42/1056591142.db2.gz KBMBXRYEEIZWOP-FQEVSTJZSA-N 1 2 321.399 4.349 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2ccn(-c3ccccc3)n2)cc1 ZINC000063517858 1056591146 /nfs/dbraw/zinc/59/11/46/1056591146.db2.gz KBMBXRYEEIZWOP-FQEVSTJZSA-N 1 2 321.399 4.349 20 0 DIADLO Clc1cccc2c(N3CCC([C@@H]4CCOC4)CC3)cc[nH+]c12 ZINC000672250400 1056591221 /nfs/dbraw/zinc/59/12/21/1056591221.db2.gz UWEYVUGPRWVMMY-CQSZACIVSA-N 1 2 316.832 4.141 20 0 DIADLO Clc1cccc2c(N[C@@H]3CCO[C@H](C4CC4)C3)cc[nH+]c12 ZINC000672251217 1056592987 /nfs/dbraw/zinc/59/29/87/1056592987.db2.gz LWZJRSCHFNTPEI-WBMJQRKESA-N 1 2 302.805 4.258 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CN(C)c1c(F)cccc1F ZINC001615924879 1056598185 /nfs/dbraw/zinc/59/81/85/1056598185.db2.gz XCDFAKVVUSKALY-UHFFFAOYSA-N 1 2 313.351 4.095 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(N3CCCC3)cc2)cc1 ZINC001240591635 1056599475 /nfs/dbraw/zinc/59/94/75/1056599475.db2.gz VPYCYIIBSKMREH-UHFFFAOYSA-N 1 2 303.409 4.354 20 0 DIADLO C[N@H+](CC(=O)Nc1ccccc1Cl)Cc1cccc(Cl)c1 ZINC000007913102 1056601567 /nfs/dbraw/zinc/60/15/67/1056601567.db2.gz QYBUFMAUMUUASG-UHFFFAOYSA-N 1 2 323.223 4.064 20 0 DIADLO C[N@@H+](CC(=O)Nc1ccccc1Cl)Cc1cccc(Cl)c1 ZINC000007913102 1056601574 /nfs/dbraw/zinc/60/15/74/1056601574.db2.gz QYBUFMAUMUUASG-UHFFFAOYSA-N 1 2 323.223 4.064 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2F)C2CCC2)c(C)s1 ZINC001616338323 1056636957 /nfs/dbraw/zinc/63/69/57/1056636957.db2.gz HXWUBTXELWMISZ-UHFFFAOYSA-N 1 2 304.434 4.454 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2F)C2CCC2)c(C)s1 ZINC001616338323 1056636963 /nfs/dbraw/zinc/63/69/63/1056636963.db2.gz HXWUBTXELWMISZ-UHFFFAOYSA-N 1 2 304.434 4.454 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1csc(N(C)C)n1 ZINC000157056444 1056665412 /nfs/dbraw/zinc/66/54/12/1056665412.db2.gz MVHXJKCHEJTVKD-GFCCVEGCSA-N 1 2 315.442 4.115 20 0 DIADLO Cc1cc2c[nH+]c(-c3ccc(OCc4ccccc4)cc3)nc2[nH]1 ZINC001240748038 1056676848 /nfs/dbraw/zinc/67/68/48/1056676848.db2.gz XBFPMPARDMNPDX-UHFFFAOYSA-N 1 2 315.376 4.464 20 0 DIADLO Fc1ccc(-c2cncc(C(F)(F)F)c2)cc1-n1cc[nH+]c1 ZINC001240794264 1056705542 /nfs/dbraw/zinc/70/55/42/1056705542.db2.gz LQCJHERKOAKGEV-UHFFFAOYSA-N 1 2 307.250 4.092 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](Cc1nccn1C)Cc1ccccc1 ZINC000338785683 1056717367 /nfs/dbraw/zinc/71/73/67/1056717367.db2.gz ZYNSAXSJAWPURU-QGZVFWFLSA-N 1 2 305.425 4.184 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](Cc1nccn1C)Cc1ccccc1 ZINC000338785683 1056717381 /nfs/dbraw/zinc/71/73/81/1056717381.db2.gz ZYNSAXSJAWPURU-QGZVFWFLSA-N 1 2 305.425 4.184 20 0 DIADLO COc1ccc(C(F)(F)F)cc1-c1cn2cc[nH+]c2cc1C ZINC001240826650 1056721121 /nfs/dbraw/zinc/72/11/21/1056721121.db2.gz REMFEXNZTXQCSN-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2cccc(-c3cccnc3)c2)n1 ZINC000922002368 1056723485 /nfs/dbraw/zinc/72/34/85/1056723485.db2.gz HMNKYSOEQPURBR-UHFFFAOYSA-N 1 2 321.424 4.324 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccc(C4CC4)c(C)c3)ccn12 ZINC001128272545 1056723907 /nfs/dbraw/zinc/72/39/07/1056723907.db2.gz PXABVRCDLKJDHC-UHFFFAOYSA-N 1 2 305.381 4.081 20 0 DIADLO COc1ccc(-c2cnc(C[N@H+](C)Cc3ccsc3)o2)cc1 ZINC000065280949 1056741008 /nfs/dbraw/zinc/74/10/08/1056741008.db2.gz BLGNPOHKQVLQND-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1ccc(-c2cnc(C[N@@H+](C)Cc3ccsc3)o2)cc1 ZINC000065280949 1056741021 /nfs/dbraw/zinc/74/10/21/1056741021.db2.gz BLGNPOHKQVLQND-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(Oc2cccnc2)cc1 ZINC001240883864 1056741514 /nfs/dbraw/zinc/74/15/14/1056741514.db2.gz MDQLOTDKDIQHIL-UHFFFAOYSA-N 1 2 317.348 4.197 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccc2ncsc2c1 ZINC000922017963 1056745152 /nfs/dbraw/zinc/74/51/52/1056745152.db2.gz DIRQIBKGHOQJOW-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO Cc1[nH]c(CN[C@@H](CC(F)(F)F)c2ccc(C)cc2)[nH+]c1C ZINC001616981290 1056751863 /nfs/dbraw/zinc/75/18/63/1056751863.db2.gz KGXWXPRPJUKWTP-AWEZNQCLSA-N 1 2 311.351 4.118 20 0 DIADLO Cc1nc(C[NH2+][C@@H](CC(F)(F)F)c2ccc(C)cc2)[nH]c1C ZINC001616981290 1056751877 /nfs/dbraw/zinc/75/18/77/1056751877.db2.gz KGXWXPRPJUKWTP-AWEZNQCLSA-N 1 2 311.351 4.118 20 0 DIADLO Clc1cccc(Cl)c1N1CC[NH+]([C@@H]2C=CCCC2)CC1 ZINC001617024011 1056761085 /nfs/dbraw/zinc/76/10/85/1056761085.db2.gz PPARGAMEIQFHCM-CYBMUJFWSA-N 1 2 311.256 4.224 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(COC(C)(C)C)cc1 ZINC001240943929 1056772026 /nfs/dbraw/zinc/77/20/26/1056772026.db2.gz GFPGOWAJSOKGCB-UHFFFAOYSA-N 1 2 310.397 4.325 20 0 DIADLO CCC[N@H+](CC(=O)OC(C)(C)C)[C@H](C)c1ccc(F)c(F)c1 ZINC001617082260 1056773191 /nfs/dbraw/zinc/77/31/91/1056773191.db2.gz WUCJBHKEIYONDQ-GFCCVEGCSA-N 1 2 313.388 4.080 20 0 DIADLO CCC[N@@H+](CC(=O)OC(C)(C)C)[C@H](C)c1ccc(F)c(F)c1 ZINC001617082260 1056773193 /nfs/dbraw/zinc/77/31/93/1056773193.db2.gz WUCJBHKEIYONDQ-GFCCVEGCSA-N 1 2 313.388 4.080 20 0 DIADLO CC(C)CCCCC(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC001128330315 1056795279 /nfs/dbraw/zinc/79/52/79/1056795279.db2.gz ZRJJIYCIUXQUJR-MRXNPFEDSA-N 1 2 322.518 4.170 20 0 DIADLO C[C@@H]1CCCCC[N@@H+]1Cc1ncc(Br)cc1Cl ZINC001617337985 1056817018 /nfs/dbraw/zinc/81/70/18/1056817018.db2.gz CKJUYTLUYORDSA-SNVBAGLBSA-N 1 2 317.658 4.262 20 0 DIADLO C[C@@H]1CCCCC[N@H+]1Cc1ncc(Br)cc1Cl ZINC001617337985 1056817031 /nfs/dbraw/zinc/81/70/31/1056817031.db2.gz CKJUYTLUYORDSA-SNVBAGLBSA-N 1 2 317.658 4.262 20 0 DIADLO CC(C)C1(C)CC[NH+](Cc2noc(C3CCCCC3)n2)CC1 ZINC001617366857 1056821810 /nfs/dbraw/zinc/82/18/10/1056821810.db2.gz MYMNXUKJOYKKKG-UHFFFAOYSA-N 1 2 305.466 4.375 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@H](OCC3CC3)C2)c(Cl)s1 ZINC001617413263 1056829415 /nfs/dbraw/zinc/82/94/15/1056829415.db2.gz OBBVXFZYCBFFGK-LBPRGKRZSA-N 1 2 320.285 4.446 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@H](OCC3CC3)C2)c(Cl)s1 ZINC001617413263 1056829420 /nfs/dbraw/zinc/82/94/20/1056829420.db2.gz OBBVXFZYCBFFGK-LBPRGKRZSA-N 1 2 320.285 4.446 20 0 DIADLO COc1ccc(-c2c[nH+]c(N3CCCCC3)cc2C)c(F)c1F ZINC001241041826 1056839170 /nfs/dbraw/zinc/83/91/70/1056839170.db2.gz JAYAXCQDZCABND-UHFFFAOYSA-N 1 2 318.367 4.334 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2ccc(C(C)(F)F)cc2)n1 ZINC000922144855 1056845008 /nfs/dbraw/zinc/84/50/08/1056845008.db2.gz IKGGZTINLCABHY-UHFFFAOYSA-N 1 2 308.372 4.374 20 0 DIADLO Cc1ccc(C)c(NC(=O)[C@H]2CC[C@@H](Nc3cccc[nH+]3)CC2)c1 ZINC001587037122 1056852166 /nfs/dbraw/zinc/85/21/66/1056852166.db2.gz XKNILFQTUAPYQY-CALCHBBNSA-N 1 2 323.440 4.308 20 0 DIADLO Clc1cccc([C@@H]2CCCC[N@@H+]2Cc2cc3n(n2)CCC3)c1 ZINC001617590425 1056853070 /nfs/dbraw/zinc/85/30/70/1056853070.db2.gz JJYPEWLYWQQIFQ-SFHVURJKSA-N 1 2 315.848 4.210 20 0 DIADLO Clc1cccc([C@@H]2CCCC[N@H+]2Cc2cc3n(n2)CCC3)c1 ZINC001617590425 1056853081 /nfs/dbraw/zinc/85/30/81/1056853081.db2.gz JJYPEWLYWQQIFQ-SFHVURJKSA-N 1 2 315.848 4.210 20 0 DIADLO CCOc1ccc(F)c(-c2ccccc2Cn2cc[nH+]c2)c1F ZINC001241057973 1056854567 /nfs/dbraw/zinc/85/45/67/1056854567.db2.gz DCBXRQUDNDNYDR-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO C[C@@H]1CCSCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1F ZINC001617719476 1056872896 /nfs/dbraw/zinc/87/28/96/1056872896.db2.gz GEZHCZSPYACXPM-SECBINFHSA-N 1 2 308.249 4.460 20 0 DIADLO C[C@@H]1CCSCC[N@H+]1Cc1cc(Cl)cc(Cl)c1F ZINC001617719476 1056872903 /nfs/dbraw/zinc/87/29/03/1056872903.db2.gz GEZHCZSPYACXPM-SECBINFHSA-N 1 2 308.249 4.460 20 0 DIADLO Cc1cc(CNC(=O)N2CCCC[C@H]2c2ccccc2)cc(C)[nH+]1 ZINC000422204682 1056874236 /nfs/dbraw/zinc/87/42/36/1056874236.db2.gz JHAAYHOWKLGKFZ-IBGZPJMESA-N 1 2 323.440 4.135 20 0 DIADLO CCOc1ccc(-c2ccc(-n3cc[nH+]c3)cc2OC)cc1F ZINC001241088658 1056880425 /nfs/dbraw/zinc/88/04/25/1056880425.db2.gz DDNYSQYGHCQCAY-UHFFFAOYSA-N 1 2 312.344 4.086 20 0 DIADLO COc1ccc(-c2nc(NC3CC3)cc(C)[nH+]2)cc1C(F)(F)F ZINC001241088902 1056880517 /nfs/dbraw/zinc/88/05/17/1056880517.db2.gz FYQGGQAZNYOPNZ-UHFFFAOYSA-N 1 2 323.318 4.054 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc(F)cc(F)c1F ZINC001241095580 1056888092 /nfs/dbraw/zinc/88/80/92/1056888092.db2.gz ZDLCXDFLRSWXLI-UHFFFAOYSA-N 1 2 306.331 4.465 20 0 DIADLO CC[N@H+](Cc1occc1Br)Cc1cccc(OC)c1 ZINC001143129181 1056891126 /nfs/dbraw/zinc/89/11/26/1056891126.db2.gz YQIKRDCNMYBPIE-UHFFFAOYSA-N 1 2 324.218 4.073 20 0 DIADLO CC[N@@H+](Cc1occc1Br)Cc1cccc(OC)c1 ZINC001143129181 1056891134 /nfs/dbraw/zinc/89/11/34/1056891134.db2.gz YQIKRDCNMYBPIE-UHFFFAOYSA-N 1 2 324.218 4.073 20 0 DIADLO CC(C)CN(Cc1cc[nH+]c(N(C)C)c1)c1cccc(Cl)c1 ZINC001617925631 1056903741 /nfs/dbraw/zinc/90/37/41/1056903741.db2.gz KXRTWWKTOLNHGN-UHFFFAOYSA-N 1 2 317.864 4.464 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1nnc(C(C)C)s1)C(C)(C)C2 ZINC001618138875 1056926593 /nfs/dbraw/zinc/92/65/93/1056926593.db2.gz LGYBRQQDZIQHQM-UHFFFAOYSA-N 1 2 315.486 4.307 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1nnc(C(C)C)s1)C(C)(C)C2 ZINC001618138875 1056926604 /nfs/dbraw/zinc/92/66/04/1056926604.db2.gz LGYBRQQDZIQHQM-UHFFFAOYSA-N 1 2 315.486 4.307 20 0 DIADLO CC(C)(C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccs1 ZINC000115353005 1056931440 /nfs/dbraw/zinc/93/14/40/1056931440.db2.gz SSCIUMZVVCAQAH-UHFFFAOYSA-N 1 2 311.410 4.055 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(F)c(Cl)c2F)CCC1(F)F ZINC001143616365 1056964210 /nfs/dbraw/zinc/96/42/10/1056964210.db2.gz PQYZJJPPVGVKJK-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(F)c(Cl)c2F)CCC1(F)F ZINC001143616365 1056964218 /nfs/dbraw/zinc/96/42/18/1056964218.db2.gz PQYZJJPPVGVKJK-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO COc1ccc(C[NH2+]C2(c3nccs3)CCCC2)c(Cl)c1 ZINC000116374495 1056972850 /nfs/dbraw/zinc/97/28/50/1056972850.db2.gz RVFOIFQUAHYJSZ-UHFFFAOYSA-N 1 2 322.861 4.364 20 0 DIADLO Cc1noc([C@@H](C)[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)n1 ZINC000080471991 1056973277 /nfs/dbraw/zinc/97/32/77/1056973277.db2.gz CNTCVIQXOMCPCW-IAQYHMDHSA-N 1 2 305.397 4.345 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cc(F)c(F)cc1OC(C)C ZINC001241251832 1056980570 /nfs/dbraw/zinc/98/05/70/1056980570.db2.gz LVGHHDDGGMSWIB-UHFFFAOYSA-N 1 2 306.356 4.188 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cc(F)ccc1OC(F)(F)F ZINC001241251650 1056980680 /nfs/dbraw/zinc/98/06/80/1056980680.db2.gz XZEOOTHNJFPXOZ-UHFFFAOYSA-N 1 2 314.282 4.161 20 0 DIADLO CCOc1ccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)c(F)c1 ZINC001241277314 1056993608 /nfs/dbraw/zinc/99/36/08/1056993608.db2.gz NWWOBAKSNBUTAH-UHFFFAOYSA-N 1 2 309.331 4.231 20 0 DIADLO FC(F)(F)c1ccc(-c2c[nH+]c3c(c2)CCCN3)cc1Cl ZINC001241290989 1056999638 /nfs/dbraw/zinc/99/96/38/1056999638.db2.gz SQSLEWXPYLVVLC-UHFFFAOYSA-N 1 2 312.722 4.422 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1cc2cc(F)ccc2o1 ZINC000117614446 1057003146 /nfs/dbraw/zinc/00/31/46/1057003146.db2.gz FWIXIQZSAYAWTM-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO CCOc1ccc(F)c(F)c1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001241311232 1057009426 /nfs/dbraw/zinc/00/94/26/1057009426.db2.gz SVWIASGTKWYCLA-UHFFFAOYSA-N 1 2 314.335 4.431 20 0 DIADLO CCOc1cc(F)ccc1-c1ccc(-n2cc[nH+]c2)cc1OC ZINC001241321573 1057013467 /nfs/dbraw/zinc/01/34/67/1057013467.db2.gz YWMPSDGVYZAVKG-UHFFFAOYSA-N 1 2 312.344 4.086 20 0 DIADLO Clc1ccc(C[NH+]2CCC(c3ccncc3)CC2)c(Cl)n1 ZINC000282357838 1057017895 /nfs/dbraw/zinc/01/78/95/1057017895.db2.gz BCKNEGMEOQWXJO-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Cc1csc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2)n1 ZINC000118402099 1057018260 /nfs/dbraw/zinc/01/82/60/1057018260.db2.gz ANSIEEOJKBLVBD-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1csc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)n1 ZINC000118402099 1057018265 /nfs/dbraw/zinc/01/82/65/1057018265.db2.gz ANSIEEOJKBLVBD-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2csc(-c3cccs3)n2)[C@H]1C ZINC000118414608 1057018407 /nfs/dbraw/zinc/01/84/07/1057018407.db2.gz QJAYFTFCFDSPPB-QWRGUYRKSA-N 1 2 310.513 4.197 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2csc(-c3cccs3)n2)[C@H]1C ZINC000118414608 1057018411 /nfs/dbraw/zinc/01/84/11/1057018411.db2.gz QJAYFTFCFDSPPB-QWRGUYRKSA-N 1 2 310.513 4.197 20 0 DIADLO Cc1ccc(-c2cc(Cl)ccc2F)c(C[NH+]2CCOCC2)c1 ZINC001241333305 1057018440 /nfs/dbraw/zinc/01/84/40/1057018440.db2.gz PACMUXPGWVMKTK-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO c1cn(Cc2ccccc2C2=CCN(c3ccccc3)CC2)c[nH+]1 ZINC001241355315 1057025827 /nfs/dbraw/zinc/02/58/27/1057025827.db2.gz LEXIPWHCZYKAJU-UHFFFAOYSA-N 1 2 315.420 4.225 20 0 DIADLO Cc1ccc2cc(C[NH2+][C@H]3c4ccccc4OC[C@@H]3F)ccc2n1 ZINC000922520084 1057029326 /nfs/dbraw/zinc/02/93/26/1057029326.db2.gz KCXNHTVVUFVRAO-PXNSSMCTSA-N 1 2 322.383 4.105 20 0 DIADLO Cc1ccc2cc(C[NH2+][C@H]3c4ccccc4OC[C@@H]3F)[nH]c2c1 ZINC000922521982 1057030292 /nfs/dbraw/zinc/03/02/92/1057030292.db2.gz OXELBRZJQPIPQO-LPHOPBHVSA-N 1 2 310.372 4.038 20 0 DIADLO Cc1cccc2[nH]c(C[NH2+][C@@H]3c4ccccc4OC[C@@H]3F)cc21 ZINC000922522901 1057030561 /nfs/dbraw/zinc/03/05/61/1057030561.db2.gz XBEVCIAUKVLGER-QFBILLFUSA-N 1 2 310.372 4.038 20 0 DIADLO CC[C@H]([NH2+]Cc1csc(C2CC2)n1)c1cc(F)ccc1OC ZINC000922621490 1057040627 /nfs/dbraw/zinc/04/06/27/1057040627.db2.gz LURDDTXAGXLQKY-HNNXBMFYSA-N 1 2 320.433 4.409 20 0 DIADLO CCc1nc(C[NH2+][C@H](CC)c2cc(F)ccc2OC)cs1 ZINC000922619188 1057041149 /nfs/dbraw/zinc/04/11/49/1057041149.db2.gz DHYLOTXLRXHIMH-CQSZACIVSA-N 1 2 308.422 4.094 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1cccc2ccsc21 ZINC001241403270 1057041408 /nfs/dbraw/zinc/04/14/08/1057041408.db2.gz FKLIAYMEOUXIOJ-UHFFFAOYSA-N 1 2 310.422 4.108 20 0 DIADLO CC[C@@H](C)Oc1cc(C[NH2+][C@@H]2CCCC2(F)F)ccc1OC ZINC000673618599 1057062506 /nfs/dbraw/zinc/06/25/06/1057062506.db2.gz UQTFULYAXYZCMK-MLGOLLRUSA-N 1 2 313.388 4.150 20 0 DIADLO CC[C@H](C)Oc1cc(C[NH2+][C@@H]2CCCC2(F)F)ccc1OC ZINC000673618597 1057062587 /nfs/dbraw/zinc/06/25/87/1057062587.db2.gz UQTFULYAXYZCMK-BLLLJJGKSA-N 1 2 313.388 4.150 20 0 DIADLO CCOc1ccc(Oc2ccc(NCc3c[nH+]cn3C)cc2)cc1 ZINC000347755864 1057070202 /nfs/dbraw/zinc/07/02/02/1057070202.db2.gz NNXYZEILZCYWRV-UHFFFAOYSA-N 1 2 323.396 4.223 20 0 DIADLO C[N@H+](Cc1cccc2nsnc21)Cc1c(F)cccc1Cl ZINC000766004203 1057075147 /nfs/dbraw/zinc/07/51/47/1057075147.db2.gz ZHGCNRQGZZKSLP-UHFFFAOYSA-N 1 2 321.808 4.116 20 0 DIADLO C[N@@H+](Cc1cccc2nsnc21)Cc1c(F)cccc1Cl ZINC000766004203 1057075151 /nfs/dbraw/zinc/07/51/51/1057075151.db2.gz ZHGCNRQGZZKSLP-UHFFFAOYSA-N 1 2 321.808 4.116 20 0 DIADLO COC(=[NH2+])c1cccc(-c2cccc(C(=O)OC(C)(C)C)c2)c1 ZINC001241538337 1057088476 /nfs/dbraw/zinc/08/84/76/1057088476.db2.gz ROJHGSOJKFNGDZ-UHFFFAOYSA-N 1 2 311.381 4.281 20 0 DIADLO CC(C)(C)/C=C/c1ccc(-c2ccc(-n3cc[nH+]c3)cc2)nn1 ZINC001241563401 1057092438 /nfs/dbraw/zinc/09/24/38/1057092438.db2.gz ZYUIKOPPQVWLPW-ZHACJKMWSA-N 1 2 304.397 4.389 20 0 DIADLO Clc1cccnc1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC000625182626 1057097739 /nfs/dbraw/zinc/09/77/39/1057097739.db2.gz UINFARJYTLDTGK-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cccnc1C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC000625182626 1057097746 /nfs/dbraw/zinc/09/77/46/1057097746.db2.gz UINFARJYTLDTGK-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2noc(C3CCC3)n2)c1C ZINC000625185605 1057098585 /nfs/dbraw/zinc/09/85/85/1057098585.db2.gz SJVWLCHDUVKMTF-KRWDZBQOSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2noc(C3CCC3)n2)c1C ZINC000625185605 1057098591 /nfs/dbraw/zinc/09/85/91/1057098591.db2.gz SJVWLCHDUVKMTF-KRWDZBQOSA-N 1 2 311.429 4.291 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccncc2Br)[C@@H]1c1ccccc1 ZINC000625210056 1057099552 /nfs/dbraw/zinc/09/95/52/1057099552.db2.gz AVBVQPAQZLAPNS-WBMJQRKESA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccncc2Br)[C@@H]1c1ccccc1 ZINC000625210056 1057099556 /nfs/dbraw/zinc/09/95/56/1057099556.db2.gz AVBVQPAQZLAPNS-WBMJQRKESA-N 1 2 317.230 4.037 20 0 DIADLO Fc1ccccc1-c1nc(C[N@@H+]2CCC[C@@H]2c2ccccn2)co1 ZINC000625220305 1057103031 /nfs/dbraw/zinc/10/30/31/1057103031.db2.gz GEYLRBXZNAWBQX-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccccc1-c1nc(C[N@H+]2CCC[C@@H]2c2ccccn2)co1 ZINC000625220305 1057103035 /nfs/dbraw/zinc/10/30/35/1057103035.db2.gz GEYLRBXZNAWBQX-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO CC(C)Sc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)cc1 ZINC001241610100 1057108598 /nfs/dbraw/zinc/10/85/98/1057108598.db2.gz DIORQQWKVFYRRE-UHFFFAOYSA-N 1 2 309.438 4.494 20 0 DIADLO CC(C)Oc1ccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c(F)c1 ZINC001241642021 1057121377 /nfs/dbraw/zinc/12/13/77/1057121377.db2.gz GGKOYUMXKLLTRE-UHFFFAOYSA-N 1 2 314.282 4.276 20 0 DIADLO Cc1cc(C)c(C(=O)NCCCc2cccc(Cl)c2)c(C)[nH+]1 ZINC001128543149 1057134165 /nfs/dbraw/zinc/13/41/65/1057134165.db2.gz OFAVGCPZLGMRRK-UHFFFAOYSA-N 1 2 316.832 4.023 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1csc([C@@H](C)OC)n1 ZINC000673856152 1057143064 /nfs/dbraw/zinc/14/30/64/1057143064.db2.gz KMPRSGSGEYIGBX-DYVFJYSZSA-N 1 2 316.470 4.360 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1csc([C@@H](C)OC)n1 ZINC000673856152 1057143067 /nfs/dbraw/zinc/14/30/67/1057143067.db2.gz KMPRSGSGEYIGBX-DYVFJYSZSA-N 1 2 316.470 4.360 20 0 DIADLO COc1cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)ccc1Cl ZINC001241739524 1057152262 /nfs/dbraw/zinc/15/22/62/1057152262.db2.gz VTWUARGSNVEEIG-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cc2ccncc2s1 ZINC000657954465 1057156425 /nfs/dbraw/zinc/15/64/25/1057156425.db2.gz UZSUREPWMNLGOQ-CYBMUJFWSA-N 1 2 324.453 4.465 20 0 DIADLO CCc1ccc(C[N@@H+]2CCCC[C@H]2c2nc(C)cs2)cn1 ZINC000347848011 1057159448 /nfs/dbraw/zinc/15/94/48/1057159448.db2.gz LVGKCCSLRPRHIR-INIZCTEOSA-N 1 2 301.459 4.136 20 0 DIADLO CCc1ccc(C[N@H+]2CCCC[C@H]2c2nc(C)cs2)cn1 ZINC000347848011 1057159451 /nfs/dbraw/zinc/15/94/51/1057159451.db2.gz LVGKCCSLRPRHIR-INIZCTEOSA-N 1 2 301.459 4.136 20 0 DIADLO Cc1cc(C)c(NC(=O)CCc2c[nH]c3c2cccc3C)c(C)[nH+]1 ZINC000132899755 1057160770 /nfs/dbraw/zinc/16/07/70/1057160770.db2.gz DGYZYSMAJDVOTP-UHFFFAOYSA-N 1 2 321.424 4.368 20 0 DIADLO Cc1cc(N2CCSCC2)ccc1[NH2+][C@H]1CCCSCC1 ZINC000657961273 1057160960 /nfs/dbraw/zinc/16/09/60/1057160960.db2.gz BMSRJOCOYLSGQO-HNNXBMFYSA-N 1 2 322.543 4.246 20 0 DIADLO COc1cc(C(F)(F)F)ccc1-c1cc(C)c2[nH+]ccn2c1 ZINC001241805100 1057171042 /nfs/dbraw/zinc/17/10/42/1057171042.db2.gz TZHIIDZULIOOFF-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO CC(C)[N@H+](C/C=C/c1ccc(Cl)cc1)CC(=O)OC(C)(C)C ZINC001307587779 1057172163 /nfs/dbraw/zinc/17/21/63/1057172163.db2.gz AAKYJRNGHWZENO-VOTSOKGWSA-N 1 2 323.864 4.405 20 0 DIADLO CC(C)[N@@H+](C/C=C/c1ccc(Cl)cc1)CC(=O)OC(C)(C)C ZINC001307587779 1057172170 /nfs/dbraw/zinc/17/21/70/1057172170.db2.gz AAKYJRNGHWZENO-VOTSOKGWSA-N 1 2 323.864 4.405 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc2c1ccn2C ZINC001241823251 1057176334 /nfs/dbraw/zinc/17/63/34/1057176334.db2.gz LGJPXTQHDCXXGJ-UHFFFAOYSA-N 1 2 303.365 4.040 20 0 DIADLO Cc1cn2cc(-c3cccnc3OCc3ccccc3)ccc2[nH+]1 ZINC001241829954 1057180064 /nfs/dbraw/zinc/18/00/64/1057180064.db2.gz ISLSBCYDFRFITP-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO Nc1cc(-c2cnn(C3CCCCC3)c2)[nH+]cc1C(F)(F)F ZINC001241838005 1057184016 /nfs/dbraw/zinc/18/40/16/1057184016.db2.gz DBZMNOJHSISGRL-UHFFFAOYSA-N 1 2 310.323 4.051 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cnn(C3CCCCC3)c2)c1 ZINC001241841302 1057185722 /nfs/dbraw/zinc/18/57/22/1057185722.db2.gz DEGQMQYCNHQTKF-UHFFFAOYSA-N 1 2 306.413 4.456 20 0 DIADLO c1cncc(-c2ccc(-c3cc[nH+]c(N4CCCC4)c3)cc2)c1 ZINC001241845639 1057187997 /nfs/dbraw/zinc/18/79/97/1057187997.db2.gz RINXDJZLQSMNHT-UHFFFAOYSA-N 1 2 301.393 4.411 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(-c2cccnc2)cc1 ZINC001241846446 1057188805 /nfs/dbraw/zinc/18/88/05/1057188805.db2.gz BFJMLNHYZLAYPH-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO Fc1cc(-c2ccc(Cn3cc[nH+]c3)cn2)ccc1C(F)(F)F ZINC001241914058 1057208878 /nfs/dbraw/zinc/20/88/78/1057208878.db2.gz BANYZMWXMZCVIG-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO FC(F)C1([NH2+]Cc2cccc(Br)c2)CCCC1 ZINC000674144033 1057211061 /nfs/dbraw/zinc/21/10/61/1057211061.db2.gz NAIDNGHAEMCSOF-UHFFFAOYSA-N 1 2 304.178 4.117 20 0 DIADLO FC(F)C1([NH2+]Cc2cccc(-c3cccnc3)c2)CCCC1 ZINC000674135396 1057211592 /nfs/dbraw/zinc/21/15/92/1057211592.db2.gz PPPBQLZTYMOAMU-UHFFFAOYSA-N 1 2 302.368 4.416 20 0 DIADLO CCOc1ccc2ccccc2c1-c1c[nH+]c2c(c1)CCCN2 ZINC001241925680 1057214238 /nfs/dbraw/zinc/21/42/38/1057214238.db2.gz HOHAABLPLIVHGU-UHFFFAOYSA-N 1 2 304.393 4.301 20 0 DIADLO CCCCOC(=O)Nc1ccc(-c2cccn3cc[nH+]c23)cc1 ZINC001241929174 1057214883 /nfs/dbraw/zinc/21/48/83/1057214883.db2.gz MZBZYMJHHNHLAI-UHFFFAOYSA-N 1 2 309.369 4.350 20 0 DIADLO FC(F)SCc1ccc(C[NH2+]Cc2ccc(Cl)o2)o1 ZINC000700429143 1057218013 /nfs/dbraw/zinc/21/80/13/1057218013.db2.gz QXRHLQIFEVUHFF-UHFFFAOYSA-N 1 2 307.749 4.272 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccccc2OC(F)F)cc1 ZINC001241952495 1057222082 /nfs/dbraw/zinc/22/20/82/1057222082.db2.gz AZOUELKVBZYQQU-UHFFFAOYSA-N 1 2 300.308 4.356 20 0 DIADLO FC(F)Oc1ccccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001241953724 1057223364 /nfs/dbraw/zinc/22/33/64/1057223364.db2.gz WGWJMIIWFIYPSE-UHFFFAOYSA-N 1 2 300.308 4.200 20 0 DIADLO CCOC(=O)c1ccnc2ccc(-c3cc(C)[nH+]c(C)c3)cc21 ZINC001241992949 1057232576 /nfs/dbraw/zinc/23/25/76/1057232576.db2.gz ZOHSAEMDTUQETK-UHFFFAOYSA-N 1 2 306.365 4.090 20 0 DIADLO FC(F)(F)c1ccc(Oc2ccc(-c3[nH]cc[nH+]3)cc2)nc1 ZINC001242018067 1057240607 /nfs/dbraw/zinc/24/06/07/1057240607.db2.gz CUCIBTVMCYFVLQ-UHFFFAOYSA-N 1 2 305.259 4.283 20 0 DIADLO CC(C)n1ccc(C[N@H+](Cc2ccc(Cl)cc2)C2CC2)n1 ZINC000172012312 1057245883 /nfs/dbraw/zinc/24/58/83/1057245883.db2.gz KCFFVPJUNNQBKL-UHFFFAOYSA-N 1 2 303.837 4.282 20 0 DIADLO CC(C)n1ccc(C[N@@H+](Cc2ccc(Cl)cc2)C2CC2)n1 ZINC000172012312 1057245888 /nfs/dbraw/zinc/24/58/88/1057245888.db2.gz KCFFVPJUNNQBKL-UHFFFAOYSA-N 1 2 303.837 4.282 20 0 DIADLO C[N@H+](Cc1cc2ccccc2[nH]1)Cc1nc2ccccc2s1 ZINC000674506051 1057248778 /nfs/dbraw/zinc/24/87/78/1057248778.db2.gz YRRRKXHIWNDJCA-UHFFFAOYSA-N 1 2 307.422 4.410 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2[nH]1)Cc1nc2ccccc2s1 ZINC000674506051 1057248784 /nfs/dbraw/zinc/24/87/84/1057248784.db2.gz YRRRKXHIWNDJCA-UHFFFAOYSA-N 1 2 307.422 4.410 20 0 DIADLO Nc1cc(-c2cc(C(F)(F)F)ccc2O)[nH+]cc1C(F)(F)F ZINC001242131301 1057273862 /nfs/dbraw/zinc/27/38/62/1057273862.db2.gz GXEJUFXLAGSOCW-UHFFFAOYSA-N 1 2 322.208 4.074 20 0 DIADLO Oc1ccc(C(F)(F)F)cc1-c1cc(N2CCCC2)cc[nH+]1 ZINC001242132621 1057274400 /nfs/dbraw/zinc/27/44/00/1057274400.db2.gz WKBPTNUUQJASJE-UHFFFAOYSA-N 1 2 308.303 4.073 20 0 DIADLO Oc1ccc(-c2cc[nH+]c(N3CCCCC3)c2)cc1C(F)(F)F ZINC001242158151 1057283837 /nfs/dbraw/zinc/28/38/37/1057283837.db2.gz UAUGNXIIOQYULK-UHFFFAOYSA-N 1 2 322.330 4.463 20 0 DIADLO Oc1ccc(-c2ccccc2Cn2cc[nH+]c2)cc1C(F)(F)F ZINC001242161803 1057284469 /nfs/dbraw/zinc/28/44/69/1057284469.db2.gz DYMJNWPVVKAZIJ-UHFFFAOYSA-N 1 2 318.298 4.323 20 0 DIADLO Cc1ccc(C(=O)Oc2ccc(-c3[nH+]cc4n3CCCC4)cc2)o1 ZINC001128840732 1057289105 /nfs/dbraw/zinc/28/91/05/1057289105.db2.gz HHZRHNQGFRVSGY-UHFFFAOYSA-N 1 2 322.364 4.007 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(OCC2CC2)nc1 ZINC001242213401 1057295658 /nfs/dbraw/zinc/29/56/58/1057295658.db2.gz KNMIXVQYSWZWDB-UHFFFAOYSA-N 1 2 323.440 4.231 20 0 DIADLO c1cn(-c2ccnc(-c3cccnc3OC3CCCCC3)c2)c[nH+]1 ZINC001242229146 1057303631 /nfs/dbraw/zinc/30/36/31/1057303631.db2.gz YVBZBWKEMPOSOC-UHFFFAOYSA-N 1 2 320.396 4.041 20 0 DIADLO Cc1cocc1C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001128940667 1057311223 /nfs/dbraw/zinc/31/12/23/1057311223.db2.gz MMXBKKRKHALUSB-UHFFFAOYSA-N 1 2 322.364 4.007 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2c1cccc2Cl)c1cc(F)ccc1F ZINC000675089107 1057315080 /nfs/dbraw/zinc/31/50/80/1057315080.db2.gz NLBTVDKTRZTDKT-PSLIRLAXSA-N 1 2 309.743 4.403 20 0 DIADLO CCOc1cc(Nc2ccccc2-n2cc[nH+]c2)c(F)cc1F ZINC001212530672 1057321835 /nfs/dbraw/zinc/32/18/35/1057321835.db2.gz MMZUQRSGGYRFKE-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO CCS[C@H](C)c1noc(C[NH+]2CCC(CC(C)C)CC2)n1 ZINC000766094131 1057324201 /nfs/dbraw/zinc/32/42/01/1057324201.db2.gz YKZRLAUZQQNWDX-CYBMUJFWSA-N 1 2 311.495 4.142 20 0 DIADLO COc1ccc(OC(F)(F)F)cc1-c1cn2cc[nH+]c2cc1C ZINC001242320824 1057334853 /nfs/dbraw/zinc/33/48/53/1057334853.db2.gz YBHIVJKGGNCBAK-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO C[N@@H+]1CCCC[C@H]1c1ccc(-c2cccc(Cl)c2O)nc1 ZINC001242365902 1057347210 /nfs/dbraw/zinc/34/72/10/1057347210.db2.gz VNRRGRPDVVZHRO-INIZCTEOSA-N 1 2 302.805 4.264 20 0 DIADLO C[N@H+]1CCCC[C@H]1c1ccc(-c2cccc(Cl)c2O)nc1 ZINC001242365902 1057347213 /nfs/dbraw/zinc/34/72/13/1057347213.db2.gz VNRRGRPDVVZHRO-INIZCTEOSA-N 1 2 302.805 4.264 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2c(C3CCC3)cnn2C)cs1 ZINC000658268653 1057347487 /nfs/dbraw/zinc/34/74/87/1057347487.db2.gz QOAUZKMWEONVNN-GFCCVEGCSA-N 1 2 318.490 4.118 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc2ccncc21 ZINC001242371541 1057350584 /nfs/dbraw/zinc/35/05/84/1057350584.db2.gz ZHAMBUAQABOVCL-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO CCOc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)ccc1OC ZINC001212542601 1057351442 /nfs/dbraw/zinc/35/14/42/1057351442.db2.gz SUZMTGKSTTZLNE-UHFFFAOYSA-N 1 2 323.396 4.082 20 0 DIADLO Cc1scc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)c1C ZINC001212550738 1057361918 /nfs/dbraw/zinc/36/19/18/1057361918.db2.gz CKWOZQMZIJFKFA-UHFFFAOYSA-N 1 2 322.393 4.268 20 0 DIADLO Cc1cc(-c2ccc(Cn3cc[nH+]c3)cn2)ccc1C(F)(F)F ZINC001242423508 1057363461 /nfs/dbraw/zinc/36/34/61/1057363461.db2.gz TZJVZGRJDPDSDE-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO Fc1ccc(-c2ccc(OC(F)F)cc2)cc1-n1cc[nH+]c1 ZINC001242442403 1057369756 /nfs/dbraw/zinc/36/97/56/1057369756.db2.gz KEKGYHIDSUQTBI-UHFFFAOYSA-N 1 2 304.271 4.280 20 0 DIADLO Cc1cc[nH+]c(C)c1-c1ccc2c(cnn2[C@@H]2CCCCO2)c1 ZINC001242449364 1057371998 /nfs/dbraw/zinc/37/19/98/1057371998.db2.gz OVZIIZURLSWNBX-SFHVURJKSA-N 1 2 307.397 4.414 20 0 DIADLO CCc1ccc(C)[nH+]c1Nc1ccc(Br)nc1C ZINC001212561143 1057375204 /nfs/dbraw/zinc/37/52/04/1057375204.db2.gz AYZJEGLXMDRWRP-UHFFFAOYSA-N 1 2 306.207 4.162 20 0 DIADLO CSc1cc(Nc2ccc(Br)nc2C)cc[nH+]1 ZINC001212564304 1057378949 /nfs/dbraw/zinc/37/89/49/1057378949.db2.gz PDLXNFMCHLHBLP-UHFFFAOYSA-N 1 2 310.220 4.013 20 0 DIADLO COc1c(F)cccc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001242483903 1057380409 /nfs/dbraw/zinc/38/04/09/1057380409.db2.gz SVRLWLMWENPFDH-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccccc3C(C)(F)F)ccn12 ZINC001129010322 1057380995 /nfs/dbraw/zinc/38/09/95/1057380995.db2.gz OFAHGPKOAUUBCC-UHFFFAOYSA-N 1 2 315.323 4.007 20 0 DIADLO Cc1nc(N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)c(C)c(C)[nH+]1 ZINC000675548336 1057387069 /nfs/dbraw/zinc/38/70/69/1057387069.db2.gz MGQYEFLRANTRQI-QGZVFWFLSA-N 1 2 320.440 4.267 20 0 DIADLO CCC[C@H](C)C[N@@H+]1CCOC[C@H]1c1nc2ccccc2s1 ZINC000503064746 1057399453 /nfs/dbraw/zinc/39/94/53/1057399453.db2.gz UVITYEYDBVILHO-ZFWWWQNUSA-N 1 2 304.459 4.106 20 0 DIADLO CCC[C@H](C)C[N@H+]1CCOC[C@H]1c1nc2ccccc2s1 ZINC000503064746 1057399459 /nfs/dbraw/zinc/39/94/59/1057399459.db2.gz UVITYEYDBVILHO-ZFWWWQNUSA-N 1 2 304.459 4.106 20 0 DIADLO C[N@H+](CCOC(C)(C)C)Cc1csc(-c2ccsc2)n1 ZINC000676042750 1057446296 /nfs/dbraw/zinc/44/62/96/1057446296.db2.gz MUXFVPCYCHXYDU-UHFFFAOYSA-N 1 2 310.488 4.119 20 0 DIADLO C[N@@H+](CCOC(C)(C)C)Cc1csc(-c2ccsc2)n1 ZINC000676042750 1057446299 /nfs/dbraw/zinc/44/62/99/1057446299.db2.gz MUXFVPCYCHXYDU-UHFFFAOYSA-N 1 2 310.488 4.119 20 0 DIADLO CCc1cc(OC)ccc1-c1ccc(-n2cc[nH+]c2)cc1OC ZINC001242699799 1057452963 /nfs/dbraw/zinc/45/29/63/1057452963.db2.gz ILCAOAIJJHAORW-UHFFFAOYSA-N 1 2 308.381 4.119 20 0 DIADLO CC(C)(C)c1nn(-c2ccccc2)cc1CNc1cccc[nH+]1 ZINC000676198455 1057455751 /nfs/dbraw/zinc/45/57/51/1057455751.db2.gz CIKQPSFIBDOYOA-UHFFFAOYSA-N 1 2 306.413 4.177 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1nc(C)sc1C)c1cccc(Cl)c1 ZINC000676196926 1057456202 /nfs/dbraw/zinc/45/62/02/1057456202.db2.gz FVFBXEMHCZYMEO-ZUZCIYMTSA-N 1 2 324.877 4.452 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1cscc1Cl)c1ccco1 ZINC000676416816 1057472282 /nfs/dbraw/zinc/47/22/82/1057472282.db2.gz VEZORXHHGGBKBT-AWEZNQCLSA-N 1 2 313.850 4.498 20 0 DIADLO CSc1ccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c(F)c1 ZINC001242812286 1057488044 /nfs/dbraw/zinc/48/80/44/1057488044.db2.gz SUKZTDHVVNGEEY-UHFFFAOYSA-N 1 2 302.296 4.211 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)c1cn(C)cn1 ZINC000710178939 1057502214 /nfs/dbraw/zinc/50/22/14/1057502214.db2.gz UNAINHIMBBNQOZ-IUCAKERBSA-N 1 2 316.207 4.278 20 0 DIADLO [NH3+][C@@H]1CCCC[C@H]1OCc1ccc(-c2cccc(S)c2)cc1 ZINC001242868412 1057505822 /nfs/dbraw/zinc/50/58/22/1057505822.db2.gz SJCBDISPQHBTBN-RTBURBONSA-N 1 2 313.466 4.429 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000073637379 1057509301 /nfs/dbraw/zinc/50/93/01/1057509301.db2.gz PMNBVBLNEAGLBI-STQMWFEESA-N 1 2 317.433 4.178 20 0 DIADLO CCc1onc(C)c1C[NH2+]Cc1csc(Cl)c1Cl ZINC000922985235 1057518646 /nfs/dbraw/zinc/51/86/46/1057518646.db2.gz YQOSHLDFWPBXRI-UHFFFAOYSA-N 1 2 305.230 4.204 20 0 DIADLO Cc1cc(NCc2ccc(-c3ccncc3)cc2)nc(C(C)C)[nH+]1 ZINC000352373293 1057536429 /nfs/dbraw/zinc/53/64/29/1057536429.db2.gz GJRCWDFWAAWXML-UHFFFAOYSA-N 1 2 318.424 4.583 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000625947387 1057540138 /nfs/dbraw/zinc/54/01/38/1057540138.db2.gz JLUWSGPLPHMLBX-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H](c1ccncc1)[N@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000625947387 1057540145 /nfs/dbraw/zinc/54/01/45/1057540145.db2.gz JLUWSGPLPHMLBX-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cc(C(F)(F)F)ccc2N)cc1 ZINC001243004815 1057544378 /nfs/dbraw/zinc/54/43/78/1057544378.db2.gz IDCSNINQYYWOGA-UHFFFAOYSA-N 1 2 317.314 4.355 20 0 DIADLO Nc1ccc(C(F)(F)F)cc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001243007902 1057546296 /nfs/dbraw/zinc/54/62/96/1057546296.db2.gz PKSPMEIDRFNWNU-UHFFFAOYSA-N 1 2 321.277 4.279 20 0 DIADLO C[C@H](Nc1[nH+]cnc2c1cnn2-c1ccccc1)c1ccsc1 ZINC000320153545 1057546808 /nfs/dbraw/zinc/54/68/08/1057546808.db2.gz NUENWAVOXUREJS-LBPRGKRZSA-N 1 2 321.409 4.050 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(C(F)(F)F)nc1Cl ZINC001243036287 1057553693 /nfs/dbraw/zinc/55/36/93/1057553693.db2.gz FKEICCAMOFJKJC-UHFFFAOYSA-N 1 2 315.726 4.190 20 0 DIADLO Cc1cc(N)nc(S[C@H](Cc2ccccc2)c2ccccc2)[nH+]1 ZINC000496518713 1057555708 /nfs/dbraw/zinc/55/57/08/1057555708.db2.gz QNUBTRKJODGLFB-QGZVFWFLSA-N 1 2 321.449 4.443 20 0 DIADLO Cc1ccc2[nH]ccc2c1-c1cc(F)ccc1C[NH+]1CCOCC1 ZINC001243083798 1057565523 /nfs/dbraw/zinc/56/55/23/1057565523.db2.gz FVWBMNHELAYDJE-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Cc1nc(N[C@@H](C)c2ccsc2)c(Br)c(C)[nH+]1 ZINC000322850436 1057567828 /nfs/dbraw/zinc/56/78/28/1057567828.db2.gz VSRXWMLVOFXSKU-ZETCQYMHSA-N 1 2 312.236 4.091 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1nc(-c2ccccc2)no1 ZINC000016431205 1057570054 /nfs/dbraw/zinc/57/00/54/1057570054.db2.gz PTBFYUMXTIOCCH-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc(-c2ccccc2)no1 ZINC000016431205 1057570061 /nfs/dbraw/zinc/57/00/61/1057570061.db2.gz PTBFYUMXTIOCCH-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO CCc1cccc(C)c1-c1cc(F)ccc1C[NH+]1CCOCC1 ZINC001243101085 1057573027 /nfs/dbraw/zinc/57/30/27/1057573027.db2.gz MTQKLODHWPOTGD-UHFFFAOYSA-N 1 2 313.416 4.196 20 0 DIADLO COC(=[NH2+])c1cccc(-c2ccccc2NC(=O)C(C)(C)C)c1 ZINC001243190957 1057598603 /nfs/dbraw/zinc/59/86/03/1057598603.db2.gz YTIGZHBXHWUYTR-UHFFFAOYSA-N 1 2 310.397 4.310 20 0 DIADLO Cc1cc(NC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)cc[nH+]1 ZINC000017820666 1057601416 /nfs/dbraw/zinc/60/14/16/1057601416.db2.gz LIEDRODHOWONKI-LBPRGKRZSA-N 1 2 319.408 4.248 20 0 DIADLO C[C@H]1C[N@H+](Cc2scnc2C2CC2)C[C@H](c2ccsc2)O1 ZINC000494929990 1057619090 /nfs/dbraw/zinc/61/90/90/1057619090.db2.gz MRXPWLINQXWNDC-SMDDNHRTSA-N 1 2 320.483 4.044 20 0 DIADLO C[C@H]1C[N@@H+](Cc2scnc2C2CC2)C[C@H](c2ccsc2)O1 ZINC000494929990 1057619097 /nfs/dbraw/zinc/61/90/97/1057619097.db2.gz MRXPWLINQXWNDC-SMDDNHRTSA-N 1 2 320.483 4.044 20 0 DIADLO COc1ccccc1-c1ccc(C[NH2+]C(C)(C)C(F)F)cc1 ZINC000684413753 1057640106 /nfs/dbraw/zinc/64/01/06/1057640106.db2.gz ZQPWRECMGHMTPY-UHFFFAOYSA-N 1 2 305.368 4.496 20 0 DIADLO CCCC[N@H+](Cc1c(C)nn(C)c1Cl)Cc1ccccc1F ZINC000727222387 1057643134 /nfs/dbraw/zinc/64/31/34/1057643134.db2.gz MZPGBTGNQHEZHI-UHFFFAOYSA-N 1 2 323.843 4.323 20 0 DIADLO CCCC[N@@H+](Cc1c(C)nn(C)c1Cl)Cc1ccccc1F ZINC000727222387 1057643141 /nfs/dbraw/zinc/64/31/41/1057643141.db2.gz MZPGBTGNQHEZHI-UHFFFAOYSA-N 1 2 323.843 4.323 20 0 DIADLO Cc1cccc(-c2nnc([C@H](C)[N@H+](C)Cc3cccs3)o2)c1 ZINC000727238588 1057644084 /nfs/dbraw/zinc/64/40/84/1057644084.db2.gz HNGNVCQYJRAAFG-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1cccc(-c2nnc([C@H](C)[N@@H+](C)Cc3cccs3)o2)c1 ZINC000727238588 1057644087 /nfs/dbraw/zinc/64/40/87/1057644087.db2.gz HNGNVCQYJRAAFG-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Clc1cc2n[nH]cc2c(-c2ccccc2Cn2cc[nH+]c2)c1 ZINC001243317233 1057644184 /nfs/dbraw/zinc/64/41/84/1057644184.db2.gz VHADMXVYTWIOFC-UHFFFAOYSA-N 1 2 308.772 4.128 20 0 DIADLO CCCC[N@H+](Cn1nc(Cc2cccs2)oc1=S)C1CC1 ZINC000727421751 1057653630 /nfs/dbraw/zinc/65/36/30/1057653630.db2.gz STMZYOFAVIRVAV-UHFFFAOYSA-N 1 2 323.487 4.080 20 0 DIADLO CCCC[N@@H+](Cn1nc(Cc2cccs2)oc1=S)C1CC1 ZINC000727421751 1057653634 /nfs/dbraw/zinc/65/36/34/1057653634.db2.gz STMZYOFAVIRVAV-UHFFFAOYSA-N 1 2 323.487 4.080 20 0 DIADLO CSc1cccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c1F ZINC001243358723 1057658535 /nfs/dbraw/zinc/65/85/35/1057658535.db2.gz HSUFMIJICMMYRD-UHFFFAOYSA-N 1 2 302.296 4.211 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cc(Cl)nc(Cl)c2)c1 ZINC001243369714 1057661854 /nfs/dbraw/zinc/66/18/54/1057661854.db2.gz YUFLNNKGRVOZFF-UHFFFAOYSA-N 1 2 304.180 4.456 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1cccc(OCC(F)(F)F)c1 ZINC001243389928 1057667995 /nfs/dbraw/zinc/66/79/95/1057667995.db2.gz LNSHUWSDPNUWBH-UHFFFAOYSA-N 1 2 322.286 4.180 20 0 DIADLO C[N@H+]1Cc2ccccc2[C@@H](NCc2cc(Cl)ccc2Cl)C1 ZINC000536021625 1057673908 /nfs/dbraw/zinc/67/39/08/1057673908.db2.gz DDBBVBJURKRVPW-KRWDZBQOSA-N 1 2 321.251 4.270 20 0 DIADLO C[N@@H+]1Cc2ccccc2[C@@H](NCc2cc(Cl)ccc2Cl)C1 ZINC000536021625 1057673910 /nfs/dbraw/zinc/67/39/10/1057673910.db2.gz DDBBVBJURKRVPW-KRWDZBQOSA-N 1 2 321.251 4.270 20 0 DIADLO Cc1cc(-c2cc(F)c(F)cc2OC(C)C)c2[nH+]ccn2c1 ZINC001243414176 1057675761 /nfs/dbraw/zinc/67/57/61/1057675761.db2.gz ZLTLJXYKOVTNGK-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO CC(C)[N@H+](Cn1c(=S)snc1-c1ccccc1)C1CC1 ZINC000727816167 1057675885 /nfs/dbraw/zinc/67/58/85/1057675885.db2.gz AGTJWESXWQCSEX-UHFFFAOYSA-N 1 2 305.472 4.171 20 0 DIADLO CC(C)[N@@H+](Cn1c(=S)snc1-c1ccccc1)C1CC1 ZINC000727816167 1057675887 /nfs/dbraw/zinc/67/58/87/1057675887.db2.gz AGTJWESXWQCSEX-UHFFFAOYSA-N 1 2 305.472 4.171 20 0 DIADLO CCC[N@H+](CC)Cn1nc([C@@H](CC)c2ccccc2)oc1=S ZINC000727820590 1057676211 /nfs/dbraw/zinc/67/62/11/1057676211.db2.gz KXCCYINLGCTMGK-HNNXBMFYSA-N 1 2 319.474 4.437 20 0 DIADLO CCC[N@@H+](CC)Cn1nc([C@@H](CC)c2ccccc2)oc1=S ZINC000727820590 1057676213 /nfs/dbraw/zinc/67/62/13/1057676213.db2.gz KXCCYINLGCTMGK-HNNXBMFYSA-N 1 2 319.474 4.437 20 0 DIADLO CCOc1ccc([C@H]([NH2+][C@H](C)c2ncc[nH]2)c2ccccc2)cc1 ZINC000286263238 1057687283 /nfs/dbraw/zinc/68/72/83/1057687283.db2.gz VAZFEOWMNIHPLA-DNVCBOLYSA-N 1 2 321.424 4.249 20 0 DIADLO CCOc1ccc([C@H]([NH2+][C@@H](C)c2ncc[nH]2)c2ccccc2)cc1 ZINC000286263239 1057687330 /nfs/dbraw/zinc/68/73/30/1057687330.db2.gz VAZFEOWMNIHPLA-HNAYVOBHSA-N 1 2 321.424 4.249 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1ccc(C)nc1 ZINC000167825331 1057688159 /nfs/dbraw/zinc/68/81/59/1057688159.db2.gz VDDKRBSRBNYBFU-UHFFFAOYSA-N 1 2 300.793 4.025 20 0 DIADLO C[C@H]1CCC[N@H+](Cn2nc(-c3ccccc3)sc2=S)CC1 ZINC000729981249 1057700075 /nfs/dbraw/zinc/70/00/75/1057700075.db2.gz KNGPKESXLQNXMU-ZDUSSCGKSA-N 1 2 319.499 4.421 20 0 DIADLO C[C@H]1CCC[N@@H+](Cn2nc(-c3ccccc3)sc2=S)CC1 ZINC000729981249 1057700081 /nfs/dbraw/zinc/70/00/81/1057700081.db2.gz KNGPKESXLQNXMU-ZDUSSCGKSA-N 1 2 319.499 4.421 20 0 DIADLO NC(Cc1ccc(Cl)cc1)=[NH+]OCc1ccc(Cl)s1 ZINC000729985689 1057701048 /nfs/dbraw/zinc/70/10/48/1057701048.db2.gz QGLLOIMBNRYDCC-UHFFFAOYSA-N 1 2 315.225 4.296 20 0 DIADLO Cc1cc(NC(=O)c2ccc(-c3ccc(F)cc3)cc2F)cc[nH+]1 ZINC000730031844 1057701448 /nfs/dbraw/zinc/70/14/48/1057701448.db2.gz LCGZKTRJFXDGCJ-UHFFFAOYSA-N 1 2 324.330 4.009 20 0 DIADLO CCOc1cc(-c2ccccc2Cn2cc[nH+]c2)c(F)cc1F ZINC001243530180 1057704315 /nfs/dbraw/zinc/70/43/15/1057704315.db2.gz DJHCBXWZYLSJGZ-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO Cc1ccsc1-c1nn(C[N@@H+](C)CCC(C)C)c(=S)o1 ZINC000730252462 1057709376 /nfs/dbraw/zinc/70/93/76/1057709376.db2.gz MMIKZIAOTDXHJZ-UHFFFAOYSA-N 1 2 311.476 4.178 20 0 DIADLO Cc1ccsc1-c1nn(C[N@H+](C)CCC(C)C)c(=S)o1 ZINC000730252462 1057709380 /nfs/dbraw/zinc/70/93/80/1057709380.db2.gz MMIKZIAOTDXHJZ-UHFFFAOYSA-N 1 2 311.476 4.178 20 0 DIADLO CCC[NH+](CCC)Cn1nc(-c2sccc2C)oc1=S ZINC000730252660 1057709661 /nfs/dbraw/zinc/70/96/61/1057709661.db2.gz OFYVLFCCBPZKHR-UHFFFAOYSA-N 1 2 311.476 4.322 20 0 DIADLO Cc1ccsc1-c1nn(C[N@@H+](CC(C)C)C2CC2)c(=S)o1 ZINC000730253998 1057709692 /nfs/dbraw/zinc/70/96/92/1057709692.db2.gz ZVHQCFNWELZRLG-UHFFFAOYSA-N 1 2 323.487 4.320 20 0 DIADLO Cc1ccsc1-c1nn(C[N@H+](CC(C)C)C2CC2)c(=S)o1 ZINC000730253998 1057709697 /nfs/dbraw/zinc/70/96/97/1057709697.db2.gz ZVHQCFNWELZRLG-UHFFFAOYSA-N 1 2 323.487 4.320 20 0 DIADLO CCCC[N@H+](C)c1ccc(Nc2nn3cc(C)nc3s2)cc1 ZINC000730567306 1057718407 /nfs/dbraw/zinc/71/84/07/1057718407.db2.gz UAOONKYXJXBPQC-UHFFFAOYSA-N 1 2 315.446 4.079 20 0 DIADLO CCCC[N@@H+](C)c1ccc(Nc2nn3cc(C)nc3s2)cc1 ZINC000730567306 1057718408 /nfs/dbraw/zinc/71/84/08/1057718408.db2.gz UAOONKYXJXBPQC-UHFFFAOYSA-N 1 2 315.446 4.079 20 0 DIADLO CSc1ccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)c(C)n1 ZINC001243593021 1057726722 /nfs/dbraw/zinc/72/67/22/1057726722.db2.gz DQFAUPWOYVVNMU-UHFFFAOYSA-N 1 2 308.397 4.119 20 0 DIADLO Cc1cn2cc(-c3ccc(N(C)C4CCCCC4)nc3)ccc2[nH+]1 ZINC001243596333 1057728661 /nfs/dbraw/zinc/72/86/61/1057728661.db2.gz KABMUQLSXNWECJ-UHFFFAOYSA-N 1 2 320.440 4.474 20 0 DIADLO NC(Cc1cccs1)=[NH+]OCc1cccc(C(F)(F)F)c1 ZINC000731028998 1057732320 /nfs/dbraw/zinc/73/23/20/1057732320.db2.gz MFOBWQRKKUSKHR-UHFFFAOYSA-N 1 2 314.332 4.008 20 0 DIADLO C[N@H+](CC(=O)OCc1ccccc1)Cc1ccc2ccccc2c1 ZINC000731031217 1057733337 /nfs/dbraw/zinc/73/33/37/1057733337.db2.gz PLQRUNFNGKRVEA-UHFFFAOYSA-N 1 2 319.404 4.015 20 0 DIADLO C[N@@H+](CC(=O)OCc1ccccc1)Cc1ccc2ccccc2c1 ZINC000731031217 1057733341 /nfs/dbraw/zinc/73/33/41/1057733341.db2.gz PLQRUNFNGKRVEA-UHFFFAOYSA-N 1 2 319.404 4.015 20 0 DIADLO CSc1ncc(Cl)cc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243635776 1057740500 /nfs/dbraw/zinc/74/05/00/1057740500.db2.gz XRUCJROUGJQUOH-UHFFFAOYSA-N 1 2 315.829 4.369 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(C(C)(F)F)cc3)nn2)c1C ZINC001243644853 1057742633 /nfs/dbraw/zinc/74/26/33/1057742633.db2.gz LFBYQPOCFSHUHZ-UHFFFAOYSA-N 1 2 314.339 4.058 20 0 DIADLO c1coc(-c2ccccc2-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC001243659013 1057746084 /nfs/dbraw/zinc/74/60/84/1057746084.db2.gz XYQRGBVSTWBFFC-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO CC(C)COc1cccc(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC001243657711 1057746408 /nfs/dbraw/zinc/74/64/08/1057746408.db2.gz QOFIJDNIOLYIGO-UHFFFAOYSA-N 1 2 307.397 4.028 20 0 DIADLO COc1ccc2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)nc2c1 ZINC001243658311 1057746447 /nfs/dbraw/zinc/74/64/47/1057746447.db2.gz VYDIBVDMDNVLBE-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO c1cn(Cc2ccc(-c3cccc(-c4cnco4)c3)cc2)c[nH+]1 ZINC001243658999 1057746543 /nfs/dbraw/zinc/74/65/43/1057746543.db2.gz XLTACLKJUPXATI-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO Cc1cc(C)c2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)nc2n1 ZINC001243658797 1057746605 /nfs/dbraw/zinc/74/66/05/1057746605.db2.gz ZRLWDPLVMRYHJB-UHFFFAOYSA-N 1 2 314.392 4.158 20 0 DIADLO COc1cc2cc[nH]c2cc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243657657 1057746693 /nfs/dbraw/zinc/74/66/93/1057746693.db2.gz OAEHQVVGIXQZEU-UHFFFAOYSA-N 1 2 303.365 4.088 20 0 DIADLO CCc1nc2cc(-c3ccc(Cn4cc[nH+]c4)cc3)ccc2o1 ZINC001243659397 1057747026 /nfs/dbraw/zinc/74/70/26/1057747026.db2.gz RDGBBVPFLBELJX-UHFFFAOYSA-N 1 2 303.365 4.302 20 0 DIADLO COc1nccc2cc(-c3ccc(Cn4cc[nH+]c4)cc3)ccc21 ZINC001243659435 1057747085 /nfs/dbraw/zinc/74/70/85/1057747085.db2.gz TUWUHXZDEKOXJR-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO COc1cccc2ncc(-c3ccc(Cn4cc[nH+]c4)cc3)cc21 ZINC001243659354 1057747249 /nfs/dbraw/zinc/74/72/49/1057747249.db2.gz UOJVMMDHLCDIEU-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Cc1cc(OC(C)C)ncc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243660712 1057747302 /nfs/dbraw/zinc/74/73/02/1057747302.db2.gz UYPTUIGFDGYMJO-UHFFFAOYSA-N 1 2 307.397 4.089 20 0 DIADLO COc1ccc2cc(-c3ccc(Cn4cc[nH+]c4)cc3)ccc2n1 ZINC001243659450 1057747431 /nfs/dbraw/zinc/74/74/31/1057747431.db2.gz UICYUOTXWSYLOG-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO COc1cc2ncccc2c(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243659568 1057747455 /nfs/dbraw/zinc/74/74/55/1057747455.db2.gz YTWDATGXCRAIBL-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO COc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c2[nH]ccc21 ZINC001243659180 1057747502 /nfs/dbraw/zinc/74/75/02/1057747502.db2.gz NWYQPVDFLMSMSL-UHFFFAOYSA-N 1 2 303.365 4.088 20 0 DIADLO CCOc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1OC ZINC001243663658 1057748580 /nfs/dbraw/zinc/74/85/80/1057748580.db2.gz ZCHFXWVYJZONNT-UHFFFAOYSA-N 1 2 308.381 4.006 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cn1ccc(-c2cccs2)n1 ZINC000731657250 1057749642 /nfs/dbraw/zinc/74/96/42/1057749642.db2.gz GDCPZMMZCULCHE-GFCCVEGCSA-N 1 2 315.467 4.250 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cn1ccc(-c2cccs2)n1 ZINC000731657250 1057749648 /nfs/dbraw/zinc/74/96/48/1057749648.db2.gz GDCPZMMZCULCHE-GFCCVEGCSA-N 1 2 315.467 4.250 20 0 DIADLO CCC[C@H]([NH2+]Cc1nncs1)c1cccc(C(F)(F)F)c1 ZINC001119770718 1057752298 /nfs/dbraw/zinc/75/22/98/1057752298.db2.gz VPHVMFKPEGHYPT-LBPRGKRZSA-N 1 2 315.364 4.188 20 0 DIADLO C/C(=C\C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1cccc(F)c1 ZINC000731973778 1057762831 /nfs/dbraw/zinc/76/28/31/1057762831.db2.gz HXCPDEREDNXHOG-GXDHUFHOSA-N 1 2 321.355 4.053 20 0 DIADLO CCCNc1cc(C)[nH+]c(-c2ccc(OC)c(SC)c2)n1 ZINC001243735139 1057765759 /nfs/dbraw/zinc/76/57/59/1057765759.db2.gz AHOZQOAWKAPHOT-UHFFFAOYSA-N 1 2 303.431 4.004 20 0 DIADLO CC[C@H](C)C[N@H+](C)Cn1nc(-c2ccccc2)n(CC)c1=S ZINC000732184913 1057769084 /nfs/dbraw/zinc/76/90/84/1057769084.db2.gz YLYYOTMEPQHHOA-AWEZNQCLSA-N 1 2 318.490 4.036 20 0 DIADLO CC[C@H](C)C[N@@H+](C)Cn1nc(-c2ccccc2)n(CC)c1=S ZINC000732184913 1057769089 /nfs/dbraw/zinc/76/90/89/1057769089.db2.gz YLYYOTMEPQHHOA-AWEZNQCLSA-N 1 2 318.490 4.036 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1ccc(F)c(F)c1 ZINC000732209996 1057769538 /nfs/dbraw/zinc/76/95/38/1057769538.db2.gz YTCWYCDIVVBFCA-LPMFXHHGSA-N 1 2 317.379 4.315 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1ccc(F)c(F)c1 ZINC000732209996 1057769540 /nfs/dbraw/zinc/76/95/40/1057769540.db2.gz YTCWYCDIVVBFCA-LPMFXHHGSA-N 1 2 317.379 4.315 20 0 DIADLO Fc1ccc(-c2nnc(C3=C[NH2+]CCC3)c3ccccc32)cc1F ZINC001243948689 1057817718 /nfs/dbraw/zinc/81/77/18/1057817718.db2.gz JZWMYYVFNPKQKY-UHFFFAOYSA-N 1 2 323.346 4.299 20 0 DIADLO CCOC(=O)CCc1ccccc1-c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001243976291 1057826284 /nfs/dbraw/zinc/82/62/84/1057826284.db2.gz KRWQAQUUDFNOJS-UHFFFAOYSA-N 1 2 320.392 4.239 20 0 DIADLO CC[C@H](C(=O)OC)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001243975881 1057826601 /nfs/dbraw/zinc/82/66/01/1057826601.db2.gz FCRDNPFIBOKVRZ-SFHVURJKSA-N 1 2 320.392 4.410 20 0 DIADLO CC1(C)CC(=O)Nc2cccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)c21 ZINC001243978649 1057827053 /nfs/dbraw/zinc/82/70/53/1057827053.db2.gz CPMSQQMUQXTUDP-UHFFFAOYSA-N 1 2 317.392 4.364 20 0 DIADLO CCOC(=O)c1cccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1C ZINC001243978793 1057827298 /nfs/dbraw/zinc/82/72/98/1057827298.db2.gz MZXKHSGQAAVOEX-UHFFFAOYSA-N 1 2 306.365 4.229 20 0 DIADLO COCOc1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c(C)c1C ZINC001243979694 1057827979 /nfs/dbraw/zinc/82/79/79/1057827979.db2.gz UKHBNAIHLWGOCL-UHFFFAOYSA-N 1 2 308.381 4.343 20 0 DIADLO COC(=O)[C@H](C)c1cccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001243981759 1057828655 /nfs/dbraw/zinc/82/86/55/1057828655.db2.gz UCNVJRAJLCMQJY-CYBMUJFWSA-N 1 2 306.365 4.020 20 0 DIADLO CCOc1ccc(-c2cccc(-c3c[nH+]cn3C)c2)c(OC)c1 ZINC001244003151 1057835240 /nfs/dbraw/zinc/83/52/40/1057835240.db2.gz XHSQVOQCCSVSGL-UHFFFAOYSA-N 1 2 308.381 4.161 20 0 DIADLO CC(C)C1=[NH+]CCc2ccc(-c3cc(F)c(O)c(F)c3)cc21 ZINC001244097753 1057868627 /nfs/dbraw/zinc/86/86/27/1057868627.db2.gz XOGFQCYYWZRDTP-UHFFFAOYSA-N 1 2 301.336 4.339 20 0 DIADLO CN(C)c1cc(-c2ccc(COc3ccccc3)cc2)cc[nH+]1 ZINC001244188549 1057896003 /nfs/dbraw/zinc/89/60/03/1057896003.db2.gz XDNISMGJSZXJOS-UHFFFAOYSA-N 1 2 304.393 4.394 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(Cl)cc1N ZINC001244199892 1057899336 /nfs/dbraw/zinc/89/93/36/1057899336.db2.gz LRUUBSFPTXLFJF-UHFFFAOYSA-N 1 2 301.821 4.283 20 0 DIADLO CSc1ncc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc1Cl ZINC001244246508 1057909149 /nfs/dbraw/zinc/90/91/49/1057909149.db2.gz JTXQFQKGJGIFHQ-UHFFFAOYSA-N 1 2 319.792 4.449 20 0 DIADLO CSc1ncc(-c2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC001244248834 1057910292 /nfs/dbraw/zinc/91/02/92/1057910292.db2.gz YEJOHZGVOPQNQN-UHFFFAOYSA-N 1 2 301.802 4.310 20 0 DIADLO CSc1ncc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1Cl ZINC001244248922 1057910302 /nfs/dbraw/zinc/91/03/02/1057910302.db2.gz SNDIKNUYPXAISV-UHFFFAOYSA-N 1 2 315.829 4.369 20 0 DIADLO COc1cccc(-c2ccc(-n3cc[nH+]c3)cc2OC)c1C1CC1 ZINC001244251685 1057911146 /nfs/dbraw/zinc/91/11/46/1057911146.db2.gz FWUHCCMREWZWQJ-UHFFFAOYSA-N 1 2 320.392 4.434 20 0 DIADLO Cc1ncc(C(F)(F)F)cc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001244262476 1057915350 /nfs/dbraw/zinc/91/53/50/1057915350.db2.gz SUYQXMDNYWUZIC-UHFFFAOYSA-N 1 2 321.277 4.401 20 0 DIADLO Cc1cc(C2CC2)ccc1-c1c[nH+]c(N2CCOCC2)cc1C ZINC001244275882 1057921022 /nfs/dbraw/zinc/92/10/22/1057921022.db2.gz NIGHLXASRZNQHV-UHFFFAOYSA-N 1 2 308.425 4.079 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cccc3[nH]c(=O)ccc32)c1 ZINC001244316693 1057932653 /nfs/dbraw/zinc/93/26/53/1057932653.db2.gz CIVXGIIQALUGGF-UHFFFAOYSA-N 1 2 301.349 4.008 20 0 DIADLO Nc1ccc(-c2ccccc2Cn2cc[nH+]c2)cc1C(F)(F)F ZINC001244364222 1057944895 /nfs/dbraw/zinc/94/48/95/1057944895.db2.gz LOXBTTMDDKGQEZ-UHFFFAOYSA-N 1 2 317.314 4.199 20 0 DIADLO Cc1cccc(NC(=O)c2ccc(-c3ccc(N)[nH+]c3)cc2)c1C ZINC001244384486 1057948299 /nfs/dbraw/zinc/94/82/99/1057948299.db2.gz YPRRQCPWRXBENI-UHFFFAOYSA-N 1 2 317.392 4.200 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(Cl)c3c[nH]nc32)c1 ZINC001244400552 1057950779 /nfs/dbraw/zinc/95/07/79/1057950779.db2.gz WCZFSGQHJBUPMS-UHFFFAOYSA-N 1 2 308.772 4.284 20 0 DIADLO Fc1ccc(-c2ccc(Cl)c3c[nH]nc32)cc1-n1cc[nH+]c1 ZINC001244401653 1057951469 /nfs/dbraw/zinc/95/14/69/1057951469.db2.gz UMRUDUJODVZBHZ-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO COCOc1ccc(C)cc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001244408838 1057953004 /nfs/dbraw/zinc/95/30/04/1057953004.db2.gz FCKXZEFFGJCXIG-UHFFFAOYSA-N 1 2 308.381 4.045 20 0 DIADLO Oc1ccc(OC(F)(F)F)cc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001244462040 1057965464 /nfs/dbraw/zinc/96/54/64/1057965464.db2.gz RYFFQPGXQJTANR-UHFFFAOYSA-N 1 2 320.270 4.144 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1-c1cc(-n2cc[nH+]c2)ccn1 ZINC001244511499 1057982295 /nfs/dbraw/zinc/98/22/95/1057982295.db2.gz YMDFHPGPVSHHNT-UHFFFAOYSA-N 1 2 308.143 4.380 20 0 DIADLO Oc1ccc(Cl)c(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1F ZINC001244543117 1057992280 /nfs/dbraw/zinc/99/22/80/1057992280.db2.gz RCEVDKOZBHNZFH-UHFFFAOYSA-N 1 2 306.699 4.177 20 0 DIADLO COc1ccc(C)c(F)c1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001244569232 1057997818 /nfs/dbraw/zinc/99/78/18/1057997818.db2.gz QUUUEWHICABWPS-UHFFFAOYSA-N 1 2 300.308 4.135 20 0 DIADLO COc1c(F)cc(-c2cccc3[nH+]ccn32)cc1C(F)(F)F ZINC001244571359 1057998814 /nfs/dbraw/zinc/99/88/14/1057998814.db2.gz GHMKJUIIRCUTDJ-UHFFFAOYSA-N 1 2 310.250 4.168 20 0 DIADLO COc1c(F)cc(-c2cc(C)cn3cc[nH+]c23)cc1C(F)(F)F ZINC001244572084 1057999015 /nfs/dbraw/zinc/99/90/15/1057999015.db2.gz IAXBWIPPZSIZSF-UHFFFAOYSA-N 1 2 324.277 4.476 20 0 DIADLO Cc1cc2c[nH+]c(-c3ccc(NCc4ccccc4)cc3)nc2[nH]1 ZINC001244643029 1058018556 /nfs/dbraw/zinc/01/85/56/1058018556.db2.gz PHPJRMSVJQQKJZ-UHFFFAOYSA-N 1 2 314.392 4.497 20 0 DIADLO Cc1cc(-c2ccc(Cl)c(OC(F)(F)F)c2)c[nH+]c1N ZINC001244675254 1058024361 /nfs/dbraw/zinc/02/43/61/1058024361.db2.gz YYOKIZRDXHUIAI-UHFFFAOYSA-N 1 2 302.683 4.191 20 0 DIADLO Cc1cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cnc1OC(C)C ZINC001244688265 1058026718 /nfs/dbraw/zinc/02/67/18/1058026718.db2.gz OFSNFFGAVLKJRJ-UHFFFAOYSA-N 1 2 311.360 4.169 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1cc(F)c(OC)c(Cl)c1 ZINC001244698407 1058029333 /nfs/dbraw/zinc/02/93/33/1058029333.db2.gz DJIMKXKUIMCZOO-UHFFFAOYSA-N 1 2 306.724 4.040 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(N)cc2C(F)(F)F)c1 ZINC001244760577 1058043061 /nfs/dbraw/zinc/04/30/61/1058043061.db2.gz ZUMLKLGGOZWMKR-UHFFFAOYSA-N 1 2 317.314 4.355 20 0 DIADLO O=C(O[C@H]1CC=C(c2ccn3cc[nH+]c3c2)CC1)c1ccccc1 ZINC001244806830 1058050738 /nfs/dbraw/zinc/05/07/38/1058050738.db2.gz RSXDNYKDQOBNSB-SFHVURJKSA-N 1 2 318.376 4.127 20 0 DIADLO Cc1cc(C)c(C2=CC[C@@H](OC(=O)c3ccccc3)CC2)c[nH+]1 ZINC001244808242 1058051172 /nfs/dbraw/zinc/05/11/72/1058051172.db2.gz WVGXNUNTBBUTIU-GOSISDBHSA-N 1 2 307.393 4.491 20 0 DIADLO Cc1cn2c(cccc2-c2cc(F)cc(N3CCCCC3)c2)[nH+]1 ZINC001244823008 1058053928 /nfs/dbraw/zinc/05/39/28/1058053928.db2.gz VGZSKTBUACNYQZ-UHFFFAOYSA-N 1 2 309.388 4.439 20 0 DIADLO CNc1cc(-c2ccnc3c2cccc3C(F)(F)F)cc[nH+]1 ZINC001244972968 1058083968 /nfs/dbraw/zinc/08/39/68/1058083968.db2.gz RESDFPQKTHXFBT-UHFFFAOYSA-N 1 2 303.287 4.357 20 0 DIADLO CNc1cc(-c2ccc3nc(C(F)(F)F)ccc3c2)cc[nH+]1 ZINC001244972454 1058084339 /nfs/dbraw/zinc/08/43/39/1058084339.db2.gz GKFDHWUOSVKWND-UHFFFAOYSA-N 1 2 303.287 4.357 20 0 DIADLO CNc1cc(-c2ccnc3c(OC(F)(F)F)cccc23)cc[nH+]1 ZINC001244977922 1058084993 /nfs/dbraw/zinc/08/49/93/1058084993.db2.gz NFCDCNAMGVCOND-UHFFFAOYSA-N 1 2 319.286 4.237 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1c(F)ccc(F)c1C ZINC001244986841 1058086927 /nfs/dbraw/zinc/08/69/27/1058086927.db2.gz IWICACBCUUSZRA-UHFFFAOYSA-N 1 2 300.308 4.135 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(F)ccc1Cl ZINC001245135614 1058119245 /nfs/dbraw/zinc/11/92/45/1058119245.db2.gz BQCZRSRRBZBEFI-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO CC(=O)c1cccc(-c2c[nH+]c(N3CCCCC3)cc2C)c1F ZINC001245153342 1058122286 /nfs/dbraw/zinc/12/22/86/1058122286.db2.gz JFWCPTVYWSXQSU-UHFFFAOYSA-N 1 2 312.388 4.389 20 0 DIADLO COc1nccc2cc(-c3c[nH+]cn3Cc3ccccc3)ccc21 ZINC001245197789 1058126166 /nfs/dbraw/zinc/12/61/66/1058126166.db2.gz APQAFNRZZGDASM-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO COc1cc(-c2c[nH+]cn2Cc2ccccc2)cc2[nH]ccc21 ZINC001245197448 1058126367 /nfs/dbraw/zinc/12/63/67/1058126367.db2.gz UAJIIMLCWMXHFS-UHFFFAOYSA-N 1 2 303.365 4.088 20 0 DIADLO FC(F)Oc1ccc(-c2c[nH+]cn2Cc2ccccc2)cc1 ZINC001245197994 1058126482 /nfs/dbraw/zinc/12/64/82/1058126482.db2.gz KCTJNRCUOUOHQV-UHFFFAOYSA-N 1 2 300.308 4.200 20 0 DIADLO COc1c(F)cc(SC)cc1-c1cccc2[nH+]c(C)cn21 ZINC001245224418 1058128986 /nfs/dbraw/zinc/12/89/86/1058128986.db2.gz LULISTQERPUFHJ-UHFFFAOYSA-N 1 2 302.374 4.179 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc3cc(N)ccc3c2)cc1F ZINC001245367937 1058154356 /nfs/dbraw/zinc/15/43/56/1058154356.db2.gz DSCUTDPSZQQAIR-UHFFFAOYSA-N 1 2 312.363 4.429 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccncc2C(F)(F)F)c1 ZINC001245446396 1058168126 /nfs/dbraw/zinc/16/81/26/1058168126.db2.gz OOUFKCBTWAELTA-UHFFFAOYSA-N 1 2 303.287 4.168 20 0 DIADLO CCc1ccc(N(C(=O)c2ccn3c(C)c[nH+]c3c2)C(C)C)cc1 ZINC001527556028 1058177588 /nfs/dbraw/zinc/17/75/88/1058177588.db2.gz KHTZRRSYHBCNIK-UHFFFAOYSA-N 1 2 321.424 4.260 20 0 DIADLO Cc1cc(NC(=O)[C@H](CC(C)C)c2ccc(Cl)cc2)cc[nH+]1 ZINC001527656153 1058197147 /nfs/dbraw/zinc/19/71/47/1058197147.db2.gz QIMZKPARUJDBHA-QGZVFWFLSA-N 1 2 316.832 4.234 20 0 DIADLO CC(C)C[C@H](C(=O)N(C)c1ccc(C(C)C)cc1)n1cc[nH+]c1 ZINC001545474370 1058204571 /nfs/dbraw/zinc/20/45/71/1058204571.db2.gz IHKZQXDJTDUIPY-GOSISDBHSA-N 1 2 313.445 4.257 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1c(F)cc(OC(C)C)cc1F ZINC001245527521 1058204585 /nfs/dbraw/zinc/20/45/85/1058204585.db2.gz RQCBIPYBCARGKL-UHFFFAOYSA-N 1 2 306.356 4.188 20 0 DIADLO Cc1cc(-c2ccc3[nH]cc(C(=O)OC(C)(C)C)c3c2)c[nH+]c1N ZINC001245537975 1058215737 /nfs/dbraw/zinc/21/57/37/1058215737.db2.gz IHFCVPOILWXMJS-UHFFFAOYSA-N 1 2 323.396 4.076 20 0 DIADLO Cc1cc(-c2c3ccccc3ncc2C(F)(F)F)c[nH+]c1N ZINC001245537884 1058216773 /nfs/dbraw/zinc/21/67/73/1058216773.db2.gz GOGLFWHZSCVFHR-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1cc(-c2ccnc3cc(C(F)(F)F)ccc32)c[nH+]c1N ZINC001245539602 1058218949 /nfs/dbraw/zinc/21/89/49/1058218949.db2.gz WRRODGPKOKTUKH-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1cc(-c2ccc3c(c2)Cc2cc(N(C)C)ccc2-3)c[nH+]c1N ZINC001245538781 1058220059 /nfs/dbraw/zinc/22/00/59/1058220059.db2.gz GURAHPPKSZCBQI-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO COC(=O)c1cc(-c2ccc(-c3c[nH+]cn3C)cc2)c(C)cc1C ZINC001245554733 1058228763 /nfs/dbraw/zinc/22/87/63/1058228763.db2.gz POTPHBDLPUDHBR-UHFFFAOYSA-N 1 2 320.392 4.158 20 0 DIADLO COC(=O)c1cc(-c2cc[nH+]c(N3CCCCC3)c2)c(C)cc1C ZINC001245555138 1058229968 /nfs/dbraw/zinc/22/99/68/1058229968.db2.gz RUNWBRQPFGJEPG-UHFFFAOYSA-N 1 2 324.424 4.142 20 0 DIADLO CCCC(=CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)CCC ZINC001517193592 1058236569 /nfs/dbraw/zinc/23/65/69/1058236569.db2.gz QZUUAKYLKKPOEZ-UHFFFAOYSA-N 1 2 315.392 4.477 20 0 DIADLO Cc1ccc2[nH]c(-c3ccc(C[NH+]4CCOCC4)cc3F)cc2c1 ZINC001245572369 1058239595 /nfs/dbraw/zinc/23/95/95/1058239595.db2.gz QTBPTBQWQAKSKY-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO CCc1nocc1C[N@@H+]1CCCC[C@H]1c1nc(C)c(C)s1 ZINC001548842427 1058263142 /nfs/dbraw/zinc/26/31/42/1058263142.db2.gz FRPATHOAWOADNL-HNNXBMFYSA-N 1 2 305.447 4.038 20 0 DIADLO CCc1nocc1C[N@H+]1CCCC[C@H]1c1nc(C)c(C)s1 ZINC001548842427 1058263158 /nfs/dbraw/zinc/26/31/58/1058263158.db2.gz FRPATHOAWOADNL-HNNXBMFYSA-N 1 2 305.447 4.038 20 0 DIADLO Cc1nc(C)c(C[N@@H+]2CCCC[C@@H]2c2nc(C)c(C)s2)o1 ZINC001548829790 1058264329 /nfs/dbraw/zinc/26/43/29/1058264329.db2.gz YIQKFUBUUZLPHY-CQSZACIVSA-N 1 2 305.447 4.092 20 0 DIADLO Cc1nc(C)c(C[N@H+]2CCCC[C@@H]2c2nc(C)c(C)s2)o1 ZINC001548829790 1058264344 /nfs/dbraw/zinc/26/43/44/1058264344.db2.gz YIQKFUBUUZLPHY-CQSZACIVSA-N 1 2 305.447 4.092 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1ccn2cc[nH+]c2c1)c1ccccc1 ZINC001527995429 1058292736 /nfs/dbraw/zinc/29/27/36/1058292736.db2.gz FPGYVPPOINDDJR-QGZVFWFLSA-N 1 2 307.397 4.103 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2Cc2conc2C2CC2)sc1C ZINC001550530675 1058345521 /nfs/dbraw/zinc/34/55/21/1058345521.db2.gz MQVIHBHNJDRJKI-OAHLLOKOSA-N 1 2 317.458 4.353 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2Cc2conc2C2CC2)sc1C ZINC001550530675 1058345538 /nfs/dbraw/zinc/34/55/38/1058345538.db2.gz MQVIHBHNJDRJKI-OAHLLOKOSA-N 1 2 317.458 4.353 20 0 DIADLO COc1c(Br)cccc1-c1cn2cc[nH+]c2cc1C ZINC001245684931 1058348828 /nfs/dbraw/zinc/34/88/28/1058348828.db2.gz ZCCDBOFFRWVWRQ-UHFFFAOYSA-N 1 2 317.186 4.081 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(Cl)c(C)c3C)nn2)c1C ZINC001245686029 1058349637 /nfs/dbraw/zinc/34/96/37/1058349637.db2.gz FJFQTNMQOUNSAZ-UHFFFAOYSA-N 1 2 312.804 4.216 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@H]3CCCC[C@@H]3C2)c(C)[nH+]1 ZINC001562900630 1058357790 /nfs/dbraw/zinc/35/77/90/1058357790.db2.gz MAPYJXIRRKCYJU-JKSUJKDBSA-N 1 2 301.434 4.051 20 0 DIADLO CC(C)Oc1cc(F)c(-c2ccn3cc(N)[nH+]c3c2)cc1Cl ZINC001245707687 1058380766 /nfs/dbraw/zinc/38/07/66/1058380766.db2.gz LXJGEJJNASYGKZ-UHFFFAOYSA-N 1 2 319.767 4.163 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(C(=O)OCC)c(C)c2)c1 ZINC001245720415 1058395434 /nfs/dbraw/zinc/39/54/34/1058395434.db2.gz XCONDNBWOMVDNX-UHFFFAOYSA-N 1 2 311.381 4.201 20 0 DIADLO COc1cc(OC)c(-c2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC001245725579 1058402236 /nfs/dbraw/zinc/40/22/36/1058402236.db2.gz MPLSNEWUTNNCEC-UHFFFAOYSA-N 1 2 314.772 4.210 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2CCCC[C@H]2C)[nH+]c1C ZINC001551737384 1058408796 /nfs/dbraw/zinc/40/87/96/1058408796.db2.gz DEUQRMAOEUOBGS-IUODEOHRSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@@H]2C(C)(C)C)[nH+]c1C ZINC001551738160 1058409595 /nfs/dbraw/zinc/40/95/95/1058409595.db2.gz HMANDAFEZVIEET-GJZGRUSLSA-N 1 2 311.429 4.314 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C[C@@H]2CC[C@@H](C)C2)[nH+]c1C ZINC001551743539 1058411596 /nfs/dbraw/zinc/41/15/96/1058411596.db2.gz WMYYSRIZXPNUGX-IUODEOHRSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@]2(C)C(C)C)[nH+]c1C ZINC001551743574 1058412027 /nfs/dbraw/zinc/41/20/27/1058412027.db2.gz XBWVPZFPKKLMQE-DNVCBOLYSA-N 1 2 311.429 4.314 20 0 DIADLO C[C@@H]1CCC[C@@]1(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001519381979 1058424178 /nfs/dbraw/zinc/42/41/78/1058424178.db2.gz RPCBOORSJFNYDP-SJKOYZFVSA-N 1 2 317.820 4.291 20 0 DIADLO CSc1ccc(F)c(-c2ccccc2C[NH+]2CCOCC2)c1 ZINC001245747230 1058429619 /nfs/dbraw/zinc/42/96/19/1058429619.db2.gz CPFOYAWHDPDZFN-UHFFFAOYSA-N 1 2 317.429 4.047 20 0 DIADLO FC(F)(F)c1ccc([C@H]2OCCC[C@@H]2Cn2cc[nH+]c2)cc1 ZINC001552678136 1058447500 /nfs/dbraw/zinc/44/75/00/1058447500.db2.gz OHZQVLLCNCVWHN-UKRRQHHQSA-N 1 2 310.319 4.070 20 0 DIADLO CCc1cc(-c2ccc(-n3cc[nH+]c3)cc2OC)ccc1OC ZINC001245792930 1058476180 /nfs/dbraw/zinc/47/61/80/1058476180.db2.gz VQOOMNGGMXQDOW-UHFFFAOYSA-N 1 2 308.381 4.119 20 0 DIADLO COc1c(F)c(Cl)ccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001245801410 1058483312 /nfs/dbraw/zinc/48/33/12/1058483312.db2.gz CSLLICJKIFBMFK-UHFFFAOYSA-N 1 2 316.763 4.400 20 0 DIADLO CCOc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)c(Cl)cn1 ZINC001245817460 1058506143 /nfs/dbraw/zinc/50/61/43/1058506143.db2.gz QZSSHLKRQZBWPB-UHFFFAOYSA-N 1 2 313.788 4.046 20 0 DIADLO CCOc1cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c(Cl)cn1 ZINC001245818646 1058509213 /nfs/dbraw/zinc/50/92/13/1058509213.db2.gz RBUQGRYMJWFXEP-UHFFFAOYSA-N 1 2 317.751 4.126 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@@H]2c2ccco2)[nH+]c1C ZINC001553986749 1058511089 /nfs/dbraw/zinc/51/10/89/1058511089.db2.gz GGPYUPZLKFWUTR-LSDHHAIUSA-N 1 2 321.380 4.029 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)c2cccn2C(C)C)[nH+]c1C ZINC001553990253 1058512552 /nfs/dbraw/zinc/51/25/52/1058512552.db2.gz XUTGERDMDSRIJI-UHFFFAOYSA-N 1 2 322.412 4.328 20 0 DIADLO Cc1ccc([C@@H](C)C(=O)Nc2ccccc2-c2[nH]c(C)c(C)[nH+]2)o1 ZINC001553986716 1058513710 /nfs/dbraw/zinc/51/37/10/1058513710.db2.gz GDYYEJGFKHCSRO-GFCCVEGCSA-N 1 2 323.396 4.337 20 0 DIADLO CCOc1nccc(-c2ccc(Cn3cc[nH+]c3)cc2)c1Cl ZINC001245844531 1058549145 /nfs/dbraw/zinc/54/91/45/1058549145.db2.gz IFZGCWKATFIZJC-UHFFFAOYSA-N 1 2 313.788 4.046 20 0 DIADLO CCOc1nccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1Cl ZINC001245850299 1058555413 /nfs/dbraw/zinc/55/54/13/1058555413.db2.gz SJFYNRBODAHPDJ-UHFFFAOYSA-N 1 2 317.751 4.126 20 0 DIADLO Cc1cc(CNC(=O)C=C2CCC(C(C)(C)C)CC2)cc(C)[nH+]1 ZINC001529061509 1058593891 /nfs/dbraw/zinc/59/38/91/1058593891.db2.gz ZYTAYYYRNDGNEL-UHFFFAOYSA-N 1 2 314.473 4.477 20 0 DIADLO COc1ccc(F)c(-c2cc(N3CCCC3)cc[nH+]2)c1Cl ZINC001245883102 1058594199 /nfs/dbraw/zinc/59/41/99/1058594199.db2.gz DOFXMSTYNPDXBT-UHFFFAOYSA-N 1 2 306.768 4.150 20 0 DIADLO COc1ccc(F)c(-c2ccccc2Cn2cc[nH+]c2)c1Cl ZINC001245891238 1058601401 /nfs/dbraw/zinc/60/14/01/1058601401.db2.gz NUINWSHZVGDUHJ-UHFFFAOYSA-N 1 2 316.763 4.400 20 0 DIADLO C[C@@](O)(CNc1ccc2c(c1)C(C)(C)CC[NH2+]2)c1ccccc1 ZINC001245977127 1058652161 /nfs/dbraw/zinc/65/21/61/1058652161.db2.gz XOEWZSJJZXKZII-HXUWFJFHSA-N 1 2 310.441 4.099 20 0 DIADLO C[C@](O)(CNc1ccc2c(c1)C(C)(C)CC[NH2+]2)c1ccccc1 ZINC001245977123 1058653369 /nfs/dbraw/zinc/65/33/69/1058653369.db2.gz XOEWZSJJZXKZII-FQEVSTJZSA-N 1 2 310.441 4.099 20 0 DIADLO CSc1cc(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)ccc1C ZINC001557325101 1058733362 /nfs/dbraw/zinc/73/33/62/1058733362.db2.gz NFZVQASZRJIELV-UHFFFAOYSA-N 1 2 323.421 4.155 20 0 DIADLO CC(C)[C@@H]1C[C@H](NC(=O)c2cc3c[nH+]ccc3[nH]2)c2ccccc21 ZINC001557905266 1058810330 /nfs/dbraw/zinc/81/03/30/1058810330.db2.gz LDBXGOOKDQLTRO-WMZOPIPTSA-N 1 2 319.408 4.177 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001558560265 1058886325 /nfs/dbraw/zinc/88/63/25/1058886325.db2.gz GQZOPUYHNKOVCZ-OAHLLOKOSA-N 1 2 305.466 4.146 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001558560265 1058886345 /nfs/dbraw/zinc/88/63/45/1058886345.db2.gz GQZOPUYHNKOVCZ-OAHLLOKOSA-N 1 2 305.466 4.146 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H](C)c1ccccc1C ZINC001558975826 1058932042 /nfs/dbraw/zinc/93/20/42/1058932042.db2.gz PDFWIOPYRJNRMG-HNNXBMFYSA-N 1 2 319.408 4.436 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccccc3C(C)(C)C)ccn12 ZINC001521685710 1058940519 /nfs/dbraw/zinc/94/05/19/1058940519.db2.gz MOWYPORLWWYZBL-UHFFFAOYSA-N 1 2 307.397 4.193 20 0 DIADLO Cc1cc(NCc2nc3ccccc3s2)nc(C2CCC2)[nH+]1 ZINC001559048022 1058944842 /nfs/dbraw/zinc/94/48/42/1058944842.db2.gz OJVOJVINVSPJJW-UHFFFAOYSA-N 1 2 310.426 4.274 20 0 DIADLO Cc1cc(N2CC=C(c3ccc(O)cc3)CC2)nc(C2CCC2)[nH+]1 ZINC001559054405 1058954339 /nfs/dbraw/zinc/95/43/39/1058954339.db2.gz PQRQVSBIHDPYHG-UHFFFAOYSA-N 1 2 321.424 4.052 20 0 DIADLO Cc1cc(N[C@@H](C)COc2c(C)cccc2C)nc(C2CC2)[nH+]1 ZINC001559084240 1058974859 /nfs/dbraw/zinc/97/48/59/1058974859.db2.gz NBRCHXYYJYCABM-HNNXBMFYSA-N 1 2 311.429 4.159 20 0 DIADLO Cc1cnc([C@H](Nc2cc(C)[nH+]c(C3CCC3)n2)C2CC2)s1 ZINC001559119932 1059009929 /nfs/dbraw/zinc/00/99/29/1059009929.db2.gz YQUSMIQXMKZSJN-OAHLLOKOSA-N 1 2 314.458 4.381 20 0 DIADLO CC(C)c1cc(N(C)CCc2cccs2)nc(C(C)C)[nH+]1 ZINC001559123122 1059010325 /nfs/dbraw/zinc/01/03/25/1059010325.db2.gz YVDZTPYTQYBRNC-UHFFFAOYSA-N 1 2 303.475 4.464 20 0 DIADLO Cc1nc(N2CCC(C)(CC(C)C)CC2)c2c([nH+]1)CCCC2 ZINC001559205502 1059086847 /nfs/dbraw/zinc/08/68/47/1059086847.db2.gz UTGFOJVYFGHFIG-UHFFFAOYSA-N 1 2 301.478 4.316 20 0 DIADLO Cc1cc(C)cc(C(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)c1 ZINC001522577347 1059114770 /nfs/dbraw/zinc/11/47/70/1059114770.db2.gz FWHPNIJQXSBEJU-UHFFFAOYSA-N 1 2 319.408 4.170 20 0 DIADLO CC(C)c1cc(N[C@@H]2CCC[C@]23CCCO3)nc(C(C)C)[nH+]1 ZINC001559266184 1059132459 /nfs/dbraw/zinc/13/24/59/1059132459.db2.gz ROVDEWLBZBDVMI-QAPCUYQASA-N 1 2 303.450 4.237 20 0 DIADLO Cc1nc(NCCC2(c3ccccc3)CC2)c2c([nH+]1)CCCC2 ZINC001559282997 1059139134 /nfs/dbraw/zinc/13/91/34/1059139134.db2.gz PRHLURAEOUPLRU-UHFFFAOYSA-N 1 2 307.441 4.198 20 0 DIADLO Cc1cc(NCC[C@H]2OCCc3ccccc32)nc(C2CCC2)[nH+]1 ZINC001559288739 1059144402 /nfs/dbraw/zinc/14/44/02/1059144402.db2.gz QHOZRKNUKGINTE-GOSISDBHSA-N 1 2 323.440 4.169 20 0 DIADLO Cc1ccc2[nH+]c(CSc3cc(C(F)(F)F)ccn3)cn2c1 ZINC001559440534 1059231866 /nfs/dbraw/zinc/23/18/66/1059231866.db2.gz LHDQRBOLNUXBHW-UHFFFAOYSA-N 1 2 323.343 4.349 20 0 DIADLO Cc1cc(C)n(-c2ccc(Cn3c[nH+]c(C(C)(C)C)c3)cc2)n1 ZINC001559449473 1059239806 /nfs/dbraw/zinc/23/98/06/1059239806.db2.gz VWPXKGVWVNOUCV-UHFFFAOYSA-N 1 2 308.429 4.031 20 0 DIADLO CCc1cn(CC/C=C\c2ccc(Br)cc2)c[nH+]1 ZINC001559466436 1059246670 /nfs/dbraw/zinc/24/66/70/1059246670.db2.gz UWPJYTNXYIKGDJ-HYXAFXHYSA-N 1 2 305.219 4.312 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2nsc3ccccc23)cc1F ZINC001559481583 1059255597 /nfs/dbraw/zinc/25/55/97/1059255597.db2.gz XLWOGHHBOMQTAS-UHFFFAOYSA-N 1 2 316.401 4.076 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2nsc3ccccc23)cc1F ZINC001559481583 1059255614 /nfs/dbraw/zinc/25/56/14/1059255614.db2.gz XLWOGHHBOMQTAS-UHFFFAOYSA-N 1 2 316.401 4.076 20 0 DIADLO C(=C/c1nc(-c2ccccc2-n2cc[nH+]c2)no1)\c1cccs1 ZINC001247046003 1059270101 /nfs/dbraw/zinc/27/01/01/1059270101.db2.gz DXTUQQZOLLKSLL-BQYQJAHWSA-N 1 2 320.377 4.154 20 0 DIADLO CCCC[N@H+](Cc1cc(Cl)n(C)n1)[C@H](C)c1ccc(C)o1 ZINC001559503794 1059285888 /nfs/dbraw/zinc/28/58/88/1059285888.db2.gz CXMWQCGHBTYOLA-CYBMUJFWSA-N 1 2 309.841 4.338 20 0 DIADLO CCCC[N@@H+](Cc1cc(Cl)n(C)n1)[C@H](C)c1ccc(C)o1 ZINC001559503794 1059285909 /nfs/dbraw/zinc/28/59/09/1059285909.db2.gz CXMWQCGHBTYOLA-CYBMUJFWSA-N 1 2 309.841 4.338 20 0 DIADLO CCOC(=O)C[N@H+](C)[C@@H](C)c1ccc(Oc2ccccc2)cc1 ZINC001559519058 1059316861 /nfs/dbraw/zinc/31/68/61/1059316861.db2.gz QQRHYTJZLFRUTH-HNNXBMFYSA-N 1 2 313.397 4.035 20 0 DIADLO CCOC(=O)C[N@@H+](C)[C@@H](C)c1ccc(Oc2ccccc2)cc1 ZINC001559519058 1059316882 /nfs/dbraw/zinc/31/68/82/1059316882.db2.gz QQRHYTJZLFRUTH-HNNXBMFYSA-N 1 2 313.397 4.035 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2ncccc2Cl)[C@H]1c1ccccc1 ZINC001559543531 1059345977 /nfs/dbraw/zinc/34/59/77/1059345977.db2.gz XJVAMUROZJEPIC-SUMWQHHRSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2ncccc2Cl)[C@H]1c1ccccc1 ZINC001559543531 1059345997 /nfs/dbraw/zinc/34/59/97/1059345997.db2.gz XJVAMUROZJEPIC-SUMWQHHRSA-N 1 2 318.873 4.414 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3CCC[N@@H+]3Cc3ccco3)n2)c(C)c1 ZINC001247223425 1059349401 /nfs/dbraw/zinc/34/94/01/1059349401.db2.gz FTFQOBULOJVUMY-KRWDZBQOSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3CCC[N@H+]3Cc3ccco3)n2)c(C)c1 ZINC001247223425 1059349424 /nfs/dbraw/zinc/34/94/24/1059349424.db2.gz FTFQOBULOJVUMY-KRWDZBQOSA-N 1 2 323.396 4.284 20 0 DIADLO CCc1ccc(-c2noc([C@H]3CCC[N@@H+]3Cc3ccco3)n2)cc1 ZINC001247224712 1059350325 /nfs/dbraw/zinc/35/03/25/1059350325.db2.gz JFGOWKIEAYTWSJ-QGZVFWFLSA-N 1 2 323.396 4.229 20 0 DIADLO CCc1ccc(-c2noc([C@H]3CCC[N@H+]3Cc3ccco3)n2)cc1 ZINC001247224712 1059350353 /nfs/dbraw/zinc/35/03/53/1059350353.db2.gz JFGOWKIEAYTWSJ-QGZVFWFLSA-N 1 2 323.396 4.229 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@@H](C(C)C)CC1 ZINC001559546335 1059350941 /nfs/dbraw/zinc/35/09/41/1059350941.db2.gz TTZKNZRPHACBOX-PBHICJAKSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H](C(C)C)CC1 ZINC001559546335 1059350959 /nfs/dbraw/zinc/35/09/59/1059350959.db2.gz TTZKNZRPHACBOX-PBHICJAKSA-N 1 2 323.864 4.312 20 0 DIADLO Cc1cccc(-c2noc([C@@H]3CCC[N@@H+]3Cc3ccco3)n2)c1C ZINC001247226876 1059353348 /nfs/dbraw/zinc/35/33/48/1059353348.db2.gz YCBASIJJZJFHDL-KRWDZBQOSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cccc(-c2noc([C@@H]3CCC[N@H+]3Cc3ccco3)n2)c1C ZINC001247226876 1059353367 /nfs/dbraw/zinc/35/33/67/1059353367.db2.gz YCBASIJJZJFHDL-KRWDZBQOSA-N 1 2 323.396 4.284 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ncc(Br)cc2Cl)[C@@H]1C ZINC001559559322 1059378254 /nfs/dbraw/zinc/37/82/54/1059378254.db2.gz ONOFHEICVMSHGQ-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ncc(Br)cc2Cl)[C@@H]1C ZINC001559559322 1059378266 /nfs/dbraw/zinc/37/82/66/1059378266.db2.gz ONOFHEICVMSHGQ-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO Fc1ccc(F)c(C[N@H+](Cc2ccns2)C2CCCC2)c1 ZINC001559586966 1059421390 /nfs/dbraw/zinc/42/13/90/1059421390.db2.gz PDGJEFXSRFXMPK-UHFFFAOYSA-N 1 2 308.397 4.366 20 0 DIADLO Fc1ccc(F)c(C[N@@H+](Cc2ccns2)C2CCCC2)c1 ZINC001559586966 1059421400 /nfs/dbraw/zinc/42/14/00/1059421400.db2.gz PDGJEFXSRFXMPK-UHFFFAOYSA-N 1 2 308.397 4.366 20 0 DIADLO CCC1(CC)CC[N@@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001559595332 1059428868 /nfs/dbraw/zinc/42/88/68/1059428868.db2.gz BUTVJWIQMFVRRD-HNNXBMFYSA-N 1 2 309.837 4.066 20 0 DIADLO CCC1(CC)CC[N@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001559595332 1059428875 /nfs/dbraw/zinc/42/88/75/1059428875.db2.gz BUTVJWIQMFVRRD-HNNXBMFYSA-N 1 2 309.837 4.066 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1ccccc1OC(F)F ZINC001559623456 1059452955 /nfs/dbraw/zinc/45/29/55/1059452955.db2.gz WKFSCGCGADJWFH-CYBMUJFWSA-N 1 2 319.351 4.244 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1ccccc1OC(F)F ZINC001559623456 1059452962 /nfs/dbraw/zinc/45/29/62/1059452962.db2.gz WKFSCGCGADJWFH-CYBMUJFWSA-N 1 2 319.351 4.244 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1cc(F)ccc1Cl ZINC001559623089 1059453319 /nfs/dbraw/zinc/45/33/19/1059453319.db2.gz HROAPAMLYADNPJ-GFCCVEGCSA-N 1 2 305.780 4.435 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1cc(F)ccc1Cl ZINC001559623089 1059453326 /nfs/dbraw/zinc/45/33/26/1059453326.db2.gz HROAPAMLYADNPJ-GFCCVEGCSA-N 1 2 305.780 4.435 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H](C)C2(CCC2)C1 ZINC001559682858 1059509948 /nfs/dbraw/zinc/50/99/48/1059509948.db2.gz RVGDZWKPTSQFIK-BBRMVZONSA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](C)C2(CCC2)C1 ZINC001559682858 1059509970 /nfs/dbraw/zinc/50/99/70/1059509970.db2.gz RVGDZWKPTSQFIK-BBRMVZONSA-N 1 2 321.848 4.066 20 0 DIADLO CCCC/C=C/Cc1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001247540852 1059525619 /nfs/dbraw/zinc/52/56/19/1059525619.db2.gz ZLDYNTMZPXSRSA-AATRIKPKSA-N 1 2 308.385 4.211 20 0 DIADLO CC(C)[C@H]([NH2+]CCSC1CCCCC1)C(=O)OC(C)(C)C ZINC001559725222 1059559536 /nfs/dbraw/zinc/55/95/36/1059559536.db2.gz QRIZMKYTGIHSMC-HNNXBMFYSA-N 1 2 315.523 4.008 20 0 DIADLO C[C@H]([NH2+]CCOC1CCCCC1)c1nc(C2CCCCC2)no1 ZINC001559730698 1059563554 /nfs/dbraw/zinc/56/35/54/1059563554.db2.gz NLIKIXYDSPYGAS-AWEZNQCLSA-N 1 2 321.465 4.117 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@@H+](Cc1cncc(C(F)(F)F)c1)CC2 ZINC001559762245 1059598542 /nfs/dbraw/zinc/59/85/42/1059598542.db2.gz JDPKTQDTWJLZDT-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@H+](Cc1cncc(C(F)(F)F)c1)CC2 ZINC001559762245 1059598558 /nfs/dbraw/zinc/59/85/58/1059598558.db2.gz JDPKTQDTWJLZDT-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO C[C@@H]1CCCC[C@@H]1c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001247733940 1059605185 /nfs/dbraw/zinc/60/51/85/1059605185.db2.gz HJMLQYSSWNJAON-CJNGLKHVSA-N 1 2 308.385 4.216 20 0 DIADLO CC1=CC[C@@H](c2nc(-c3ccccc3-n3cc[nH+]c3)no2)CC1 ZINC001247763433 1059617027 /nfs/dbraw/zinc/61/70/27/1059617027.db2.gz KXPHXSFTQHHRBN-CQSZACIVSA-N 1 2 306.369 4.136 20 0 DIADLO CC1=C(Br)C[N@@H+]([C@H]2C[C@@H]2c2cccc(F)c2)CC1 ZINC001559793693 1059630028 /nfs/dbraw/zinc/63/00/28/1059630028.db2.gz XXSBVULBBDKBNP-HIFRSBDPSA-N 1 2 310.210 4.056 20 0 DIADLO CC1=C(Br)C[N@H+]([C@H]2C[C@@H]2c2cccc(F)c2)CC1 ZINC001559793693 1059630039 /nfs/dbraw/zinc/63/00/39/1059630039.db2.gz XXSBVULBBDKBNP-HIFRSBDPSA-N 1 2 310.210 4.056 20 0 DIADLO FC(F)(F)CC1CC[NH+](Cc2cc(C(F)(F)F)co2)CC1 ZINC001559828157 1059661351 /nfs/dbraw/zinc/66/13/51/1059661351.db2.gz HIJBWMYVAJLIBI-UHFFFAOYSA-N 1 2 315.257 4.463 20 0 DIADLO CC[C@@]([NH2+]C[C@@H](C)CC(C)(C)C)(C(=O)OC)c1ccccc1 ZINC001559829819 1059664402 /nfs/dbraw/zinc/66/44/02/1059664402.db2.gz CVAQBJOAFHDJFJ-KXBFYZLASA-N 1 2 305.462 4.127 20 0 DIADLO CC[C@]([NH2+]C[C@H](C)CC(C)(C)C)(C(=O)OC)c1ccccc1 ZINC001559829817 1059664803 /nfs/dbraw/zinc/66/48/03/1059664803.db2.gz CVAQBJOAFHDJFJ-DNVCBOLYSA-N 1 2 305.462 4.127 20 0 DIADLO CC1(C)C(c2nc(-c3ccccc3-n3cc[nH+]c3)no2)C1(C)C ZINC001247983941 1059666359 /nfs/dbraw/zinc/66/63/59/1059666359.db2.gz GWVMWHJEOMBBHI-UHFFFAOYSA-N 1 2 308.385 4.072 20 0 DIADLO Cc1ccccc1C[N@H+](Cc1ccccn1)Cc1ccc(F)cn1 ZINC001559864890 1059686418 /nfs/dbraw/zinc/68/64/18/1059686418.db2.gz YDFNPWBFIGQDJS-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ccccc1C[N@@H+](Cc1ccccn1)Cc1ccc(F)cn1 ZINC001559864890 1059686429 /nfs/dbraw/zinc/68/64/29/1059686429.db2.gz YDFNPWBFIGQDJS-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO C[C@H]1CC(C)(C)C[N@@H+]1Cc1ncc(Br)cc1Cl ZINC001559913640 1059728392 /nfs/dbraw/zinc/72/83/92/1059728392.db2.gz QNPWBCMQBVUBJB-VIFPVBQESA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC(C)(C)C[N@H+]1Cc1ncc(Br)cc1Cl ZINC001559913640 1059728408 /nfs/dbraw/zinc/72/84/08/1059728408.db2.gz QNPWBCMQBVUBJB-VIFPVBQESA-N 1 2 317.658 4.118 20 0 DIADLO CCc1cccc(-c2noc([C@H]3Cc4ccccc4C[N@@H+]3C)n2)c1 ZINC001248121404 1059736110 /nfs/dbraw/zinc/73/61/10/1059736110.db2.gz XBFDPUDVVHSQBB-GOSISDBHSA-N 1 2 319.408 4.028 20 0 DIADLO CCc1cccc(-c2noc([C@H]3Cc4ccccc4C[N@H+]3C)n2)c1 ZINC001248121404 1059736131 /nfs/dbraw/zinc/73/61/31/1059736131.db2.gz XBFDPUDVVHSQBB-GOSISDBHSA-N 1 2 319.408 4.028 20 0 DIADLO Cc1ccc(-c2noc([C@H]3Cc4ccccc4C[N@H+]3C)n2)cc1C ZINC001248121257 1059736570 /nfs/dbraw/zinc/73/65/70/1059736570.db2.gz SGLFTGHOZXTKEO-GOSISDBHSA-N 1 2 319.408 4.083 20 0 DIADLO Cc1ccc(-c2noc([C@H]3Cc4ccccc4C[N@@H+]3C)n2)cc1C ZINC001248121257 1059736585 /nfs/dbraw/zinc/73/65/85/1059736585.db2.gz SGLFTGHOZXTKEO-GOSISDBHSA-N 1 2 319.408 4.083 20 0 DIADLO FCc1ccc(C[NH2+][C@@H](Cc2ccccc2)c2ncco2)cc1 ZINC001559945579 1059761661 /nfs/dbraw/zinc/76/16/61/1059761661.db2.gz YAHGHVZXJRTSAU-SFHVURJKSA-N 1 2 310.372 4.218 20 0 DIADLO CC[C@@H]1C[N@H+](CCc2cc(Cl)cc(Cl)c2)[C@@H](C)CO1 ZINC001559963458 1059768940 /nfs/dbraw/zinc/76/89/40/1059768940.db2.gz STPQKYZWWTUPEE-XHDPSFHLSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1C[N@@H+](CCc2cc(Cl)cc(Cl)c2)[C@@H](C)CO1 ZINC001559963458 1059768959 /nfs/dbraw/zinc/76/89/59/1059768959.db2.gz STPQKYZWWTUPEE-XHDPSFHLSA-N 1 2 302.245 4.035 20 0 DIADLO CCn1cc(C[N@H+](Cc2cccc(F)c2Cl)C(C)C)cn1 ZINC001559962144 1059769319 /nfs/dbraw/zinc/76/93/19/1059769319.db2.gz KRLOENZEFRGMIL-UHFFFAOYSA-N 1 2 309.816 4.106 20 0 DIADLO CCn1cc(C[N@@H+](Cc2cccc(F)c2Cl)C(C)C)cn1 ZINC001559962144 1059769334 /nfs/dbraw/zinc/76/93/34/1059769334.db2.gz KRLOENZEFRGMIL-UHFFFAOYSA-N 1 2 309.816 4.106 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@@H+]1CCc2ccc(Cl)cc2[C@H](C)C1 ZINC001559966406 1059771028 /nfs/dbraw/zinc/77/10/28/1059771028.db2.gz ZFQLKMGFABOEOT-ZIAGYGMSSA-N 1 2 323.864 4.033 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@H+]1CCc2ccc(Cl)cc2[C@H](C)C1 ZINC001559966406 1059771052 /nfs/dbraw/zinc/77/10/52/1059771052.db2.gz ZFQLKMGFABOEOT-ZIAGYGMSSA-N 1 2 323.864 4.033 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CCc2ccc(Cl)cc2[C@@H](C)C1 ZINC001559966403 1059773079 /nfs/dbraw/zinc/77/30/79/1059773079.db2.gz ZFQLKMGFABOEOT-KBPBESRZSA-N 1 2 323.864 4.033 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CCc2ccc(Cl)cc2[C@@H](C)C1 ZINC001559966403 1059773092 /nfs/dbraw/zinc/77/30/92/1059773092.db2.gz ZFQLKMGFABOEOT-KBPBESRZSA-N 1 2 323.864 4.033 20 0 DIADLO C[C@H](CSc1ccccc1)[N@H+](C)Cc1scnc1Cl ZINC001559973108 1059779469 /nfs/dbraw/zinc/77/94/69/1059779469.db2.gz DXPDZDUPCRTDGL-LLVKDONJSA-N 1 2 312.891 4.409 20 0 DIADLO C[C@H](CSc1ccccc1)[N@@H+](C)Cc1scnc1Cl ZINC001559973108 1059779488 /nfs/dbraw/zinc/77/94/88/1059779488.db2.gz DXPDZDUPCRTDGL-LLVKDONJSA-N 1 2 312.891 4.409 20 0 DIADLO Fc1cc(F)cc([C@H]2COCC[N@@H+]2CC2CCC3(CC3)CC2)c1 ZINC001560002565 1059804772 /nfs/dbraw/zinc/80/47/72/1059804772.db2.gz SMFUEBQATHGIMU-GOSISDBHSA-N 1 2 321.411 4.309 20 0 DIADLO Fc1cc(F)cc([C@H]2COCC[N@H+]2CC2CCC3(CC3)CC2)c1 ZINC001560002565 1059804799 /nfs/dbraw/zinc/80/47/99/1059804799.db2.gz SMFUEBQATHGIMU-GOSISDBHSA-N 1 2 321.411 4.309 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC001560012573 1059817137 /nfs/dbraw/zinc/81/71/37/1059817137.db2.gz YQKRJXQLSNJSQT-YOEHRIQHSA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@H+]1CCC[C@H](C2CCC2)C1 ZINC001560012573 1059817163 /nfs/dbraw/zinc/81/71/63/1059817163.db2.gz YQKRJXQLSNJSQT-YOEHRIQHSA-N 1 2 321.848 4.066 20 0 DIADLO Fc1ccc2c(c1)OCC[N@@H+](C/C=C\c1ccc(Cl)cc1)C2 ZINC001560041860 1059854605 /nfs/dbraw/zinc/85/46/05/1059854605.db2.gz YEACVQCSLLCACU-UPHRSURJSA-N 1 2 317.791 4.387 20 0 DIADLO Fc1ccc2c(c1)OCC[N@H+](C/C=C\c1ccc(Cl)cc1)C2 ZINC001560041860 1059854622 /nfs/dbraw/zinc/85/46/22/1059854622.db2.gz YEACVQCSLLCACU-UPHRSURJSA-N 1 2 317.791 4.387 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccccc2-c2ccccc2)c[nH+]1 ZINC001525399598 1059865906 /nfs/dbraw/zinc/86/59/06/1059865906.db2.gz JQQCGFCYBYWRCU-UHFFFAOYSA-N 1 2 316.404 4.295 20 0 DIADLO CCCOC(=O)[C@H](C)[NH2+][C@H]1CCC(C)(C)C[C@H]1c1ccccc1 ZINC001560092856 1059903136 /nfs/dbraw/zinc/90/31/36/1059903136.db2.gz QTQNRWPTXSMUIB-SZMVWBNQSA-N 1 2 317.473 4.280 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1c(C)cccc1Br ZINC001248619144 1059917583 /nfs/dbraw/zinc/91/75/83/1059917583.db2.gz VHQOSWMJZZVLJB-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1c(C)cccc1Br ZINC001248619144 1059917601 /nfs/dbraw/zinc/91/76/01/1059917601.db2.gz VHQOSWMJZZVLJB-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CCc1cccc(CC)c1NC(=S)Nc1ccn2cc[nH+]c2c1 ZINC001248653456 1059926468 /nfs/dbraw/zinc/92/64/68/1059926468.db2.gz GRYMOGAFBYMYNA-UHFFFAOYSA-N 1 2 324.453 4.268 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2Cc2ccc(C)cc2Cl)[nH+]c1C ZINC001560138194 1059939725 /nfs/dbraw/zinc/93/97/25/1059939725.db2.gz OVWZJQNEHDTYJI-INIZCTEOSA-N 1 2 303.837 4.325 20 0 DIADLO Cc1cccc(C)c1C[N@H+](C)Cc1ncccc1Br ZINC001560180729 1059965147 /nfs/dbraw/zinc/96/51/47/1059965147.db2.gz GOUQROVMHHKCGV-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cccc(C)c1C[N@@H+](C)Cc1ncccc1Br ZINC001560180729 1059965168 /nfs/dbraw/zinc/96/51/68/1059965168.db2.gz GOUQROVMHHKCGV-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Fc1cccc(C[N@H+](Cc2ccoc2)C2CC2)c1OC(F)F ZINC001560174947 1059966188 /nfs/dbraw/zinc/96/61/88/1059966188.db2.gz BLSQBTXDDXPWEH-UHFFFAOYSA-N 1 2 311.303 4.185 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2ccoc2)C2CC2)c1OC(F)F ZINC001560174947 1059966210 /nfs/dbraw/zinc/96/62/10/1059966210.db2.gz BLSQBTXDDXPWEH-UHFFFAOYSA-N 1 2 311.303 4.185 20 0 DIADLO CC(C)(C)OC(=O)C1([NH2+]CCSC(C)(C)C)CCCCC1 ZINC001560206850 1059983646 /nfs/dbraw/zinc/98/36/46/1059983646.db2.gz FVJZPUSRQZRCHH-UHFFFAOYSA-N 1 2 315.523 4.152 20 0 DIADLO CC[N@H+](Cc1ccccc1)Cc1ncc(C(F)(F)F)cc1F ZINC001248787208 1059973210 /nfs/dbraw/zinc/97/32/10/1059973210.db2.gz SUNQYCYYPUQIJI-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1ccccc1)Cc1ncc(C(F)(F)F)cc1F ZINC001248787208 1059973233 /nfs/dbraw/zinc/97/32/33/1059973233.db2.gz SUNQYCYYPUQIJI-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO Cn1ccc(-c2ccc(C[N@@H+]3Cc4ccc(Cl)cc4C3)cc2)n1 ZINC001248767233 1059975975 /nfs/dbraw/zinc/97/59/75/1059975975.db2.gz ZICRJNCDXMGOIC-UHFFFAOYSA-N 1 2 323.827 4.256 20 0 DIADLO Cn1ccc(-c2ccc(C[N@H+]3Cc4ccc(Cl)cc4C3)cc2)n1 ZINC001248767233 1059976001 /nfs/dbraw/zinc/97/60/01/1059976001.db2.gz ZICRJNCDXMGOIC-UHFFFAOYSA-N 1 2 323.827 4.256 20 0 DIADLO Cc1ncc(Br)cc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC001248781415 1059977311 /nfs/dbraw/zinc/97/73/11/1059977311.db2.gz JTBLFGAXEVXCJK-INIZCTEOSA-N 1 2 317.230 4.100 20 0 DIADLO Cc1ncc(Br)cc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC001248781415 1059977330 /nfs/dbraw/zinc/97/73/30/1059977330.db2.gz JTBLFGAXEVXCJK-INIZCTEOSA-N 1 2 317.230 4.100 20 0 DIADLO Clc1c(C[N@@H+]2CCOc3ccccc3C2)cnc2ccccc21 ZINC001248812563 1059991429 /nfs/dbraw/zinc/99/14/29/1059991429.db2.gz NCRPYQXBKSUOMX-UHFFFAOYSA-N 1 2 324.811 4.283 20 0 DIADLO Clc1c(C[N@H+]2CCOc3ccccc3C2)cnc2ccccc21 ZINC001248812563 1059991451 /nfs/dbraw/zinc/99/14/51/1059991451.db2.gz NCRPYQXBKSUOMX-UHFFFAOYSA-N 1 2 324.811 4.283 20 0 DIADLO Clc1cc(-c2ccccc2)ccc1C[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC001248818985 1059997491 /nfs/dbraw/zinc/99/74/91/1059997491.db2.gz IPVBMQADELXQFV-HDICACEKSA-N 1 2 313.828 4.370 20 0 DIADLO Clc1cc(-c2ccccc2)ccc1C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC001248818985 1059997508 /nfs/dbraw/zinc/99/75/08/1059997508.db2.gz IPVBMQADELXQFV-HDICACEKSA-N 1 2 313.828 4.370 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CCC[C@H]3c3cccc(F)c3)nc2c1 ZINC001248842211 1060011778 /nfs/dbraw/zinc/01/17/78/1060011778.db2.gz KXNCKPMJBUJGFI-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CCC[C@H]3c3cccc(F)c3)nc2c1 ZINC001248842211 1060011802 /nfs/dbraw/zinc/01/18/02/1060011802.db2.gz KXNCKPMJBUJGFI-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CCC[C@H]3c3cccc(F)c3)[nH]c2c1 ZINC001248842211 1060011824 /nfs/dbraw/zinc/01/18/24/1060011824.db2.gz KXNCKPMJBUJGFI-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CCC[C@H]3c3cccc(F)c3)[nH]c2c1 ZINC001248842211 1060011847 /nfs/dbraw/zinc/01/18/47/1060011847.db2.gz KXNCKPMJBUJGFI-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CCC[C@@H]3c3cccc(F)c3)nc2c1 ZINC001248842210 1060011908 /nfs/dbraw/zinc/01/19/08/1060011908.db2.gz KXNCKPMJBUJGFI-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CCC[C@@H]3c3cccc(F)c3)nc2c1 ZINC001248842210 1060011929 /nfs/dbraw/zinc/01/19/29/1060011929.db2.gz KXNCKPMJBUJGFI-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CCC[C@@H]3c3cccc(F)c3)[nH]c2c1 ZINC001248842210 1060011950 /nfs/dbraw/zinc/01/19/50/1060011950.db2.gz KXNCKPMJBUJGFI-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CCC[C@@H]3c3cccc(F)c3)[nH]c2c1 ZINC001248842210 1060011974 /nfs/dbraw/zinc/01/19/74/1060011974.db2.gz KXNCKPMJBUJGFI-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO CN(C)c1[nH+]ccc2cc(NC(=O)/C=C\c3ccsc3)ccc21 ZINC001533841411 1060039125 /nfs/dbraw/zinc/03/91/25/1060039125.db2.gz RELNDBNCEXPTDZ-UTCJRWHESA-N 1 2 323.421 4.014 20 0 DIADLO Fc1cccc2cc(CNc3ccc(-n4cc[nH+]c4)cc3)cnc12 ZINC001560279940 1060054363 /nfs/dbraw/zinc/05/43/63/1060054363.db2.gz FAXXRHQJMHDOMY-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO Fc1ccc(CNc2ccc(N3CCCCC3)c[nH+]2)cc1Cl ZINC001560281335 1060057125 /nfs/dbraw/zinc/05/71/25/1060057125.db2.gz BLIYDQZJAHBRTQ-UHFFFAOYSA-N 1 2 319.811 4.477 20 0 DIADLO CC[C@H](C(=O)NCc1cc(C)[nH+]c(C)c1)C1CCC(C)CC1 ZINC001525865245 1060058073 /nfs/dbraw/zinc/05/80/73/1060058073.db2.gz PPMPRCKFODEBOS-SYGMWZTRSA-N 1 2 302.462 4.167 20 0 DIADLO Brc1c2ccccc2oc1C[NH2+]Cc1ccoc1 ZINC001560285386 1060064258 /nfs/dbraw/zinc/06/42/58/1060064258.db2.gz QESWFTBCTFEBHK-UHFFFAOYSA-N 1 2 306.159 4.078 20 0 DIADLO Cc1ccc(F)cc1C[NH2+][C@H](c1nccs1)c1ccccc1 ZINC001560302646 1060089905 /nfs/dbraw/zinc/08/99/05/1060089905.db2.gz FZLFEPQBLJIHNC-KRWDZBQOSA-N 1 2 312.413 4.470 20 0 DIADLO Cc1ccc(-c2noc([C@@H]([NH3+])c3ccc(Cl)cc3)n2)c(C)c1 ZINC001248997431 1060103132 /nfs/dbraw/zinc/10/31/32/1060103132.db2.gz IGBCYHNXYXCWMY-HNNXBMFYSA-N 1 2 313.788 4.055 20 0 DIADLO [NH3+][C@@H](c1nc(-c2ccccc2Cl)no1)c1ccc(Cl)cc1 ZINC001248997135 1060103395 /nfs/dbraw/zinc/10/33/95/1060103395.db2.gz DFITZLLRVGUZRL-CYBMUJFWSA-N 1 2 320.179 4.092 20 0 DIADLO COc1cc(Cl)c(C)cc1NCc1c[nH+]c2ccc(C)cn12 ZINC001560338822 1060124824 /nfs/dbraw/zinc/12/48/24/1060124824.db2.gz OBPHEGNJDFAOQI-UHFFFAOYSA-N 1 2 315.804 4.225 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H]2CCc3ccc(Cl)cc32)c(C)[nH+]1 ZINC001534146867 1060154908 /nfs/dbraw/zinc/15/49/08/1060154908.db2.gz UIXABVQJGSXEDX-INIZCTEOSA-N 1 2 314.816 4.078 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3ccc(F)cc3Cl)ccc21 ZINC001560389163 1060175156 /nfs/dbraw/zinc/17/51/56/1060175156.db2.gz DFBRFWFOUGIXEG-UHFFFAOYSA-N 1 2 304.796 4.474 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3ccc(F)cc3Cl)ccc21 ZINC001560389163 1060175160 /nfs/dbraw/zinc/17/51/60/1060175160.db2.gz DFBRFWFOUGIXEG-UHFFFAOYSA-N 1 2 304.796 4.474 20 0 DIADLO CCn1ccc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)n1 ZINC001560397048 1060183932 /nfs/dbraw/zinc/18/39/32/1060183932.db2.gz GYKKJGXYCTUERR-INIZCTEOSA-N 1 2 307.388 4.058 20 0 DIADLO Cc1ccc(NCc2ccc(OCC(F)(F)F)cc2)c(C)[nH+]1 ZINC001560407985 1060192317 /nfs/dbraw/zinc/19/23/17/1060192317.db2.gz RBNREEKTBARULN-UHFFFAOYSA-N 1 2 310.319 4.252 20 0 DIADLO Cc1cc(F)cc(-c2noc([C@@H]3CC[N@@H+]3Cc3ccccc3)n2)c1 ZINC001249256845 1060202676 /nfs/dbraw/zinc/20/26/76/1060202676.db2.gz XWKQGESALGYTBU-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cc(F)cc(-c2noc([C@@H]3CC[N@H+]3Cc3ccccc3)n2)c1 ZINC001249256845 1060202694 /nfs/dbraw/zinc/20/26/94/1060202694.db2.gz XWKQGESALGYTBU-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc(-c2noc([C@H]3CC[N@@H+]3Cc3ccccc3)n2)cc1C ZINC001249254619 1060202747 /nfs/dbraw/zinc/20/27/47/1060202747.db2.gz BQSWGTJJQHDZAY-GOSISDBHSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1ccc(-c2noc([C@H]3CC[N@H+]3Cc3ccccc3)n2)cc1C ZINC001249254619 1060202771 /nfs/dbraw/zinc/20/27/71/1060202771.db2.gz BQSWGTJJQHDZAY-GOSISDBHSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1cc(C)cc(-c2noc([C@@H]3CC[N@@H+]3Cc3ccccc3)n2)c1 ZINC001249254551 1060203746 /nfs/dbraw/zinc/20/37/46/1060203746.db2.gz AZIOWTQBBMAHLX-SFHVURJKSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1cc(C)cc(-c2noc([C@@H]3CC[N@H+]3Cc3ccccc3)n2)c1 ZINC001249254551 1060203762 /nfs/dbraw/zinc/20/37/62/1060203762.db2.gz AZIOWTQBBMAHLX-SFHVURJKSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1ccc(F)cc1-c1noc([C@H]2CC[N@@H+]2Cc2ccccc2)n1 ZINC001249256197 1060204133 /nfs/dbraw/zinc/20/41/33/1060204133.db2.gz PMCQTXBYVWCDCC-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc(F)cc1-c1noc([C@H]2CC[N@H+]2Cc2ccccc2)n1 ZINC001249256197 1060204147 /nfs/dbraw/zinc/20/41/47/1060204147.db2.gz PMCQTXBYVWCDCC-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cccc(-c2noc([C@@H]3CC[N@@H+]3Cc3ccccc3)n2)c1F ZINC001249253079 1060204869 /nfs/dbraw/zinc/20/48/69/1060204869.db2.gz JGALDCCVECOXMS-INIZCTEOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cccc(-c2noc([C@@H]3CC[N@H+]3Cc3ccccc3)n2)c1F ZINC001249253079 1060204893 /nfs/dbraw/zinc/20/48/93/1060204893.db2.gz JGALDCCVECOXMS-INIZCTEOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2cccc(F)c2)c2ccccn2)cc(C)n1 ZINC001560423411 1060211092 /nfs/dbraw/zinc/21/10/92/1060211092.db2.gz HTZQMJYYSFYAQS-HXUWFJFHSA-N 1 2 321.399 4.112 20 0 DIADLO CCc1nnc([C@H](C)[NH2+]Cc2cccc(Oc3ccccc3)c2)[nH]1 ZINC001560426046 1060212644 /nfs/dbraw/zinc/21/26/44/1060212644.db2.gz NUMALPYJIVKNFP-AWEZNQCLSA-N 1 2 322.412 4.010 20 0 DIADLO C=Cc1ccc(C(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)cc1 ZINC001526417287 1060212759 /nfs/dbraw/zinc/21/27/59/1060212759.db2.gz CVEYOYHOSZDVKX-UHFFFAOYSA-N 1 2 317.392 4.196 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2cccc(C)c2)c2ccccn2)sn1 ZINC001560427602 1060214300 /nfs/dbraw/zinc/21/43/00/1060214300.db2.gz IACVTYGUPPDLLJ-GOSISDBHSA-N 1 2 309.438 4.034 20 0 DIADLO CC1(C)[C@@H]2C[N@H+](Cc3cc(Br)sc3Cl)C[C@@H]21 ZINC001249380965 1060233486 /nfs/dbraw/zinc/23/34/86/1060233486.db2.gz GELNKESXOCDQIF-DTORHVGOSA-N 1 2 320.683 4.252 20 0 DIADLO CC1(C)[C@@H]2C[N@@H+](Cc3cc(Br)sc3Cl)C[C@@H]21 ZINC001249380965 1060233471 /nfs/dbraw/zinc/23/34/71/1060233471.db2.gz GELNKESXOCDQIF-DTORHVGOSA-N 1 2 320.683 4.252 20 0 DIADLO CC[C@@H](C)c1nn(C)cc1C[N@@H+]1CCc2cc(Cl)ccc2C1 ZINC001249409032 1060241026 /nfs/dbraw/zinc/24/10/26/1060241026.db2.gz QWGIBHAEEPQASL-CYBMUJFWSA-N 1 2 317.864 4.145 20 0 DIADLO CC[C@@H](C)c1nn(C)cc1C[N@H+]1CCc2cc(Cl)ccc2C1 ZINC001249409032 1060241045 /nfs/dbraw/zinc/24/10/45/1060241045.db2.gz QWGIBHAEEPQASL-CYBMUJFWSA-N 1 2 317.864 4.145 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(C(C)(C)C)c[nH]2)[C@@H](c2ccccc2)CO1 ZINC001249480153 1060263611 /nfs/dbraw/zinc/26/36/11/1060263611.db2.gz HZOKRUKJAYYWLX-HNAYVOBHSA-N 1 2 312.457 4.274 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(C(C)(C)C)c[nH]2)[C@@H](c2ccccc2)CO1 ZINC001249480153 1060263629 /nfs/dbraw/zinc/26/36/29/1060263629.db2.gz HZOKRUKJAYYWLX-HNAYVOBHSA-N 1 2 312.457 4.274 20 0 DIADLO CSc1ccc(CNc2ccc(-c3cnn(C)c3)c(C)[nH+]2)cc1 ZINC001560482624 1060271432 /nfs/dbraw/zinc/27/14/32/1060271432.db2.gz XHJOCMNUSMTGGY-UHFFFAOYSA-N 1 2 324.453 4.125 20 0 DIADLO Fc1cc2cc[nH]c2c(C[N@@H+]2Cc3ccc(Cl)cc3C2)c1 ZINC001249525349 1060276870 /nfs/dbraw/zinc/27/68/70/1060276870.db2.gz KCSHTTPCTFLBKH-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO Fc1cc2cc[nH]c2c(C[N@H+]2Cc3ccc(Cl)cc3C2)c1 ZINC001249525349 1060276889 /nfs/dbraw/zinc/27/68/89/1060276889.db2.gz KCSHTTPCTFLBKH-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO CC[N@H+](Cc1nc(C2CC2)cs1)Cc1cccc(OC)c1 ZINC001249529356 1060277781 /nfs/dbraw/zinc/27/77/81/1060277781.db2.gz HRTJHABOFMZSTM-UHFFFAOYSA-N 1 2 302.443 4.051 20 0 DIADLO CC[N@@H+](Cc1nc(C2CC2)cs1)Cc1cccc(OC)c1 ZINC001249529356 1060277806 /nfs/dbraw/zinc/27/78/06/1060277806.db2.gz HRTJHABOFMZSTM-UHFFFAOYSA-N 1 2 302.443 4.051 20 0 DIADLO CCCCCC[C@H](CC)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001534563873 1060302648 /nfs/dbraw/zinc/30/26/48/1060302648.db2.gz CMAADKSCRBHNCP-HNNXBMFYSA-N 1 2 305.466 4.391 20 0 DIADLO C/C(=C\C1CCC(C)CC1)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001534566192 1060303913 /nfs/dbraw/zinc/30/39/13/1060303913.db2.gz UTYONNVVRMLYFX-WYMLVPIESA-N 1 2 315.461 4.167 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccn2)C2CCCCC2)ns1 ZINC001249588402 1060304647 /nfs/dbraw/zinc/30/46/47/1060304647.db2.gz FFOCSLVSZYIGSZ-UHFFFAOYSA-N 1 2 301.459 4.181 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccn2)C2CCCCC2)ns1 ZINC001249588402 1060304661 /nfs/dbraw/zinc/30/46/61/1060304661.db2.gz FFOCSLVSZYIGSZ-UHFFFAOYSA-N 1 2 301.459 4.181 20 0 DIADLO CN(C)c1[nH+]ccc2cc(NC(=O)/C=C/C3CCCCC3)ccc21 ZINC001526698422 1060305068 /nfs/dbraw/zinc/30/50/68/1060305068.db2.gz CKZOVWUAYTZJCU-DHZHZOJOSA-N 1 2 323.440 4.376 20 0 DIADLO F[C@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1ccccc1Br ZINC001560511977 1060310749 /nfs/dbraw/zinc/31/07/49/1060310749.db2.gz WVLHCEJDJKISMM-HOTGVXAUSA-N 1 2 320.205 4.176 20 0 DIADLO Cc1ccc2[nH+]c(NCc3ccc4c(c3)CC(C)(C)O4)[nH]c2c1 ZINC001560569984 1060381174 /nfs/dbraw/zinc/38/11/74/1060381174.db2.gz RALCROFXMWGDOA-UHFFFAOYSA-N 1 2 307.397 4.197 20 0 DIADLO Cn1c2ccccc2[nH+]c1NCc1ccc2ccc(F)c(F)c2n1 ZINC001560569963 1060382447 /nfs/dbraw/zinc/38/24/47/1060382447.db2.gz QLXJDMJTEOHGOJ-UHFFFAOYSA-N 1 2 324.334 4.012 20 0 DIADLO COc1ccc(CNc2[nH+]c3ccccc3n2CCC(C)C)cn1 ZINC001560575706 1060387399 /nfs/dbraw/zinc/38/73/99/1060387399.db2.gz NMRKSDDRIMWEAC-UHFFFAOYSA-N 1 2 324.428 4.098 20 0 DIADLO Cn1c(CNc2[nH]c3ccc(Cl)cc3[nH+]2)cc2ccccc21 ZINC001560578914 1060394580 /nfs/dbraw/zinc/39/45/80/1060394580.db2.gz OBHPNQLRDUVLEM-UHFFFAOYSA-N 1 2 310.788 4.320 20 0 DIADLO Cn1c(CNc2[nH]c3cc(Cl)ccc3[nH+]2)cc2ccccc21 ZINC001560578914 1060394599 /nfs/dbraw/zinc/39/45/99/1060394599.db2.gz OBHPNQLRDUVLEM-UHFFFAOYSA-N 1 2 310.788 4.320 20 0 DIADLO FC(F)Oc1cccc(CNc2[nH]c3ccc(Cl)cc3[nH+]2)c1 ZINC001560579018 1060395725 /nfs/dbraw/zinc/39/57/25/1060395725.db2.gz SPJBSCNIJKBYHW-UHFFFAOYSA-N 1 2 323.730 4.430 20 0 DIADLO COc1cnc(F)c(CNc2ccc3[nH+]c(C)cc(C)c3c2)c1 ZINC001560590122 1060402399 /nfs/dbraw/zinc/40/23/99/1060402399.db2.gz MYKJIASWLKNLAD-UHFFFAOYSA-N 1 2 311.360 4.006 20 0 DIADLO Cc1c(F)cc(Br)c(C[N@@H+]2CCCC23CC3)c1F ZINC001249864144 1060432779 /nfs/dbraw/zinc/43/27/79/1060432779.db2.gz MJMCJHUIGWABMO-UHFFFAOYSA-N 1 2 316.189 4.164 20 0 DIADLO Cc1c(F)cc(Br)c(C[N@H+]2CCCC23CC3)c1F ZINC001249864144 1060432785 /nfs/dbraw/zinc/43/27/85/1060432785.db2.gz MJMCJHUIGWABMO-UHFFFAOYSA-N 1 2 316.189 4.164 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1ccc(C)cc1OC ZINC001560622925 1060435422 /nfs/dbraw/zinc/43/54/22/1060435422.db2.gz OUZSNFAWOWUZLY-UHFFFAOYSA-N 1 2 313.376 4.124 20 0 DIADLO Cc1c(F)cc(Br)c(C[N@@H+]2CCC[C@H]3C[C@H]32)c1F ZINC001249877279 1060440119 /nfs/dbraw/zinc/44/01/19/1060440119.db2.gz BLONELNMETVPHT-TVQRCGJNSA-N 1 2 316.189 4.020 20 0 DIADLO Cc1c(F)cc(Br)c(C[N@H+]2CCC[C@H]3C[C@H]32)c1F ZINC001249877279 1060440138 /nfs/dbraw/zinc/44/01/38/1060440138.db2.gz BLONELNMETVPHT-TVQRCGJNSA-N 1 2 316.189 4.020 20 0 DIADLO COc1ccc2[nH]c(Nc3ccc(-n4cc[nH+]c4)cc3)cc2c1 ZINC001249884112 1060445665 /nfs/dbraw/zinc/44/56/65/1060445665.db2.gz PEVIAMKHFJASPO-UHFFFAOYSA-N 1 2 304.353 4.106 20 0 DIADLO CC(C)c1ccc(C[N@H+](C)Cc2ccc(O)c(F)c2F)cc1 ZINC001560634911 1060448821 /nfs/dbraw/zinc/44/88/21/1060448821.db2.gz MGDCFQWYVNBTOD-UHFFFAOYSA-N 1 2 305.368 4.426 20 0 DIADLO CC(C)c1ccc(C[N@@H+](C)Cc2ccc(O)c(F)c2F)cc1 ZINC001560634911 1060448827 /nfs/dbraw/zinc/44/88/27/1060448827.db2.gz MGDCFQWYVNBTOD-UHFFFAOYSA-N 1 2 305.368 4.426 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1cc(OC)c(O)cc1Cl ZINC001560638504 1060454413 /nfs/dbraw/zinc/45/44/13/1060454413.db2.gz FILLSIBXCVDMDY-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1cc(OC)c(O)cc1Cl ZINC001560638504 1060454443 /nfs/dbraw/zinc/45/44/43/1060454443.db2.gz FILLSIBXCVDMDY-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO CC(C)n1c[nH+]cc1CN1CCc2c(Cl)cc(Cl)cc2C1 ZINC001560643260 1060462074 /nfs/dbraw/zinc/46/20/74/1060462074.db2.gz GHJZHTASNLPMLM-UHFFFAOYSA-N 1 2 324.255 4.329 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ccc(Cl)c(F)c2)c1F ZINC001560643792 1060462392 /nfs/dbraw/zinc/46/23/92/1060462392.db2.gz XRUNARGZSPMIBG-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ccc(Cl)c(F)c2)c1F ZINC001560643792 1060462403 /nfs/dbraw/zinc/46/24/03/1060462403.db2.gz XRUNARGZSPMIBG-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CC(C)[C@](C)(Cc1ccccc1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001535115887 1060464160 /nfs/dbraw/zinc/46/41/60/1060464160.db2.gz ODSVKCFKSBCVKY-FQEVSTJZSA-N 1 2 321.424 4.178 20 0 DIADLO COc1cc[nH+]cc1CC(=O)c1ccc(-c2ccccc2)cc1 ZINC001249905439 1060471806 /nfs/dbraw/zinc/47/18/06/1060471806.db2.gz UJICJEJDGZPPGF-UHFFFAOYSA-N 1 2 303.361 4.183 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)nc1C ZINC001249909660 1060474849 /nfs/dbraw/zinc/47/48/49/1060474849.db2.gz UDCABQLEAPZKBE-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)nc1C ZINC001249909660 1060474862 /nfs/dbraw/zinc/47/48/62/1060474862.db2.gz UDCABQLEAPZKBE-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)nc1C ZINC001249912492 1060476626 /nfs/dbraw/zinc/47/66/26/1060476626.db2.gz KLFXAOZVIPBGAW-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)nc1C ZINC001249912492 1060476637 /nfs/dbraw/zinc/47/66/37/1060476637.db2.gz KLFXAOZVIPBGAW-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC001249933023 1060489533 /nfs/dbraw/zinc/48/95/33/1060489533.db2.gz FCTRIOLHMVJCMF-OAHLLOKOSA-N 1 2 318.219 4.135 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC001249933023 1060489544 /nfs/dbraw/zinc/48/95/44/1060489544.db2.gz FCTRIOLHMVJCMF-OAHLLOKOSA-N 1 2 318.219 4.135 20 0 DIADLO COc1nccc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)c1F ZINC001560675879 1060510966 /nfs/dbraw/zinc/51/09/66/1060510966.db2.gz XRGPZZDDDVNHNN-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)c1F ZINC001560675879 1060510986 /nfs/dbraw/zinc/51/09/86/1060510986.db2.gz XRGPZZDDDVNHNN-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO C[N@H+](C/C=C/c1cccc(F)c1)Cc1ccn(-c2ccccc2)n1 ZINC001560681815 1060523579 /nfs/dbraw/zinc/52/35/79/1060523579.db2.gz VTDHLLZQCXGKEU-SOFGYWHQSA-N 1 2 321.399 4.157 20 0 DIADLO C[N@@H+](C/C=C/c1cccc(F)c1)Cc1ccn(-c2ccccc2)n1 ZINC001560681815 1060523597 /nfs/dbraw/zinc/52/35/97/1060523597.db2.gz VTDHLLZQCXGKEU-SOFGYWHQSA-N 1 2 321.399 4.157 20 0 DIADLO FC(F)(F)c1cccc(Cc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001249994207 1060523762 /nfs/dbraw/zinc/52/37/62/1060523762.db2.gz NKLCINLQJLBTKR-UHFFFAOYSA-N 1 2 306.331 4.291 20 0 DIADLO Nc1cc(C(F)(F)F)c(Cc2ccc(C(F)(F)F)cc2)c[nH+]1 ZINC001249996340 1060529414 /nfs/dbraw/zinc/52/94/14/1060529414.db2.gz YSSMETSGMRHQEI-UHFFFAOYSA-N 1 2 320.236 4.292 20 0 DIADLO Fc1cccc(/C=C\C[N@@H+]2CCc3c(F)cc(F)cc3C2)c1 ZINC001560689007 1060535592 /nfs/dbraw/zinc/53/55/92/1060535592.db2.gz AJTTVPYVHKIDSV-RQOWECAXSA-N 1 2 303.327 4.175 20 0 DIADLO Fc1cccc(/C=C\C[N@H+]2CCc3c(F)cc(F)cc3C2)c1 ZINC001560689007 1060535607 /nfs/dbraw/zinc/53/56/07/1060535607.db2.gz AJTTVPYVHKIDSV-RQOWECAXSA-N 1 2 303.327 4.175 20 0 DIADLO CC1(C)C[N@H+](Cc2c(Cl)nc3cc(Cl)ccn32)C1(C)C ZINC001560687798 1060536625 /nfs/dbraw/zinc/53/66/25/1060536625.db2.gz PWEACVLBNHZQHT-UHFFFAOYSA-N 1 2 312.244 4.262 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(Cl)nc3cc(Cl)ccn32)C1(C)C ZINC001560687798 1060536646 /nfs/dbraw/zinc/53/66/46/1060536646.db2.gz PWEACVLBNHZQHT-UHFFFAOYSA-N 1 2 312.244 4.262 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)ccn1 ZINC001250018736 1060544188 /nfs/dbraw/zinc/54/41/88/1060544188.db2.gz HKIFJNGFSUEMJN-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)ccn1 ZINC001250018736 1060544205 /nfs/dbraw/zinc/54/42/05/1060544205.db2.gz HKIFJNGFSUEMJN-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO Oc1cc(F)c(Nc2cccc(-n3cc[nH+]c3)c2)cc1Cl ZINC001250022668 1060545808 /nfs/dbraw/zinc/54/58/08/1060545808.db2.gz RKWOEERQYVDSLH-UHFFFAOYSA-N 1 2 303.724 4.114 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)c(Cl)c1Cl)C[C@@H]1CCCCO1 ZINC001250031462 1060560194 /nfs/dbraw/zinc/56/01/94/1060560194.db2.gz MQNCLKJBRNXIAW-JTQLQIEISA-N 1 2 323.651 4.043 20 0 DIADLO C[N@H+](Cc1cnc(Cl)c(Cl)c1Cl)C[C@@H]1CCCCO1 ZINC001250031462 1060560206 /nfs/dbraw/zinc/56/02/06/1060560206.db2.gz MQNCLKJBRNXIAW-JTQLQIEISA-N 1 2 323.651 4.043 20 0 DIADLO CC(C)COC1C[NH+](Cc2ccc3oc4ccccc4c3c2)C1 ZINC001560710354 1060567354 /nfs/dbraw/zinc/56/73/54/1060567354.db2.gz HRPLOTKSVJOCKM-UHFFFAOYSA-N 1 2 309.409 4.443 20 0 DIADLO CCOc1cc(OC)ccc1C[N@H+](C)Cc1cccc(F)c1F ZINC001250065170 1060577834 /nfs/dbraw/zinc/57/78/34/1060577834.db2.gz TVRDNJVZSOSBHK-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CCOc1cc(OC)ccc1C[N@@H+](C)Cc1cccc(F)c1F ZINC001250065170 1060577853 /nfs/dbraw/zinc/57/78/53/1060577853.db2.gz TVRDNJVZSOSBHK-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2nc(C(C)(C)C)co2)c1 ZINC001560726636 1060589282 /nfs/dbraw/zinc/58/92/82/1060589282.db2.gz YQPVNSJMRIZIOW-INIZCTEOSA-N 1 2 314.429 4.318 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2nc(C(C)(C)C)co2)c1 ZINC001560726636 1060589301 /nfs/dbraw/zinc/58/93/01/1060589301.db2.gz YQPVNSJMRIZIOW-INIZCTEOSA-N 1 2 314.429 4.318 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1CCCc1c(Cl)cccc1Cl ZINC001560726718 1060592971 /nfs/dbraw/zinc/59/29/71/1060592971.db2.gz BIFQQYJUIDJRMR-STQMWFEESA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@H+]1CCCc1c(Cl)cccc1Cl ZINC001560726718 1060592990 /nfs/dbraw/zinc/59/29/90/1060592990.db2.gz BIFQQYJUIDJRMR-STQMWFEESA-N 1 2 316.272 4.425 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccco2)Cc2cccs2)cnc1F ZINC001560728338 1060593671 /nfs/dbraw/zinc/59/36/71/1060593671.db2.gz OUYPBTSVJJJUKI-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccco2)Cc2cccs2)cnc1F ZINC001560728338 1060593684 /nfs/dbraw/zinc/59/36/84/1060593684.db2.gz OUYPBTSVJJJUKI-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO COc1c(Cl)ccc(F)c1Nc1cccc2[nH+]c(C)cn21 ZINC001250098711 1060606476 /nfs/dbraw/zinc/60/64/76/1060606476.db2.gz YKIDTCDIZFYEBG-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO COc1c(Cl)ccc(F)c1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001250103323 1060611352 /nfs/dbraw/zinc/61/13/52/1060611352.db2.gz XNPOXCTXYBOEHN-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO COc1cc(F)c(C)cc1C[N@H+](C)Cc1ccc(F)cc1F ZINC001250113465 1060618397 /nfs/dbraw/zinc/61/83/97/1060618397.db2.gz OEXTVWYXKJGZCG-UHFFFAOYSA-N 1 2 309.331 4.053 20 0 DIADLO COc1cc(F)c(C)cc1C[N@@H+](C)Cc1ccc(F)cc1F ZINC001250113465 1060618406 /nfs/dbraw/zinc/61/84/06/1060618406.db2.gz OEXTVWYXKJGZCG-UHFFFAOYSA-N 1 2 309.331 4.053 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1cc(Cl)cc(Cl)c1F ZINC001250115230 1060621446 /nfs/dbraw/zinc/62/14/46/1060621446.db2.gz LYVBHHRIUKYRRI-UHFFFAOYSA-N 1 2 310.159 4.362 20 0 DIADLO C[C@H]([NH2+][C@@H](C)C1(c2ccccc2)CCCC1)C(=O)OC(C)(C)C ZINC001560763864 1060629297 /nfs/dbraw/zinc/62/92/97/1060629297.db2.gz PMFDQVSHFSIURW-HOTGVXAUSA-N 1 2 317.473 4.207 20 0 DIADLO Cc1ccccc1C[N@@H+]1CCO[C@H](c2ccc(F)cc2Cl)C1 ZINC001560766675 1060632551 /nfs/dbraw/zinc/63/25/51/1060632551.db2.gz WMIQNHSGVUYMKA-SFHVURJKSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1ccccc1C[N@H+]1CCO[C@H](c2ccc(F)cc2Cl)C1 ZINC001560766675 1060632556 /nfs/dbraw/zinc/63/25/56/1060632556.db2.gz WMIQNHSGVUYMKA-SFHVURJKSA-N 1 2 319.807 4.361 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@H+](C)Cc2ccccc2)c(F)c1 ZINC001250135912 1060639361 /nfs/dbraw/zinc/63/93/61/1060639361.db2.gz JYIYCMLEUUENJW-UHFFFAOYSA-N 1 2 305.368 4.384 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@@H+](C)Cc2ccccc2)c(F)c1 ZINC001250135912 1060639369 /nfs/dbraw/zinc/63/93/69/1060639369.db2.gz JYIYCMLEUUENJW-UHFFFAOYSA-N 1 2 305.368 4.384 20 0 DIADLO Oc1cc(Cl)cc(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)c1 ZINC001560785404 1060646099 /nfs/dbraw/zinc/64/60/99/1060646099.db2.gz HOTUQFUJQKUCJS-KRWDZBQOSA-N 1 2 305.780 4.116 20 0 DIADLO Oc1cc(Cl)cc(C[N@H+]2CC[C@@](F)(c3ccccc3)C2)c1 ZINC001560785404 1060646107 /nfs/dbraw/zinc/64/61/07/1060646107.db2.gz HOTUQFUJQKUCJS-KRWDZBQOSA-N 1 2 305.780 4.116 20 0 DIADLO Cc1nc(Cl)ccc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001250151001 1060647562 /nfs/dbraw/zinc/64/75/62/1060647562.db2.gz WZDCGZOGKKQVNO-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccc(C)c(OC(C)C)c2)c1C ZINC001560795635 1060656243 /nfs/dbraw/zinc/65/62/43/1060656243.db2.gz AFGJJKSDCLBGEF-UHFFFAOYSA-N 1 2 314.429 4.415 20 0 DIADLO COc1cc[nH+]cc1Nc1cnc(Cl)c(Cl)c1Cl ZINC001250197600 1060675491 /nfs/dbraw/zinc/67/54/91/1060675491.db2.gz JJCIGFNHFTXYFK-UHFFFAOYSA-N 1 2 304.564 4.189 20 0 DIADLO CC(C)(C)[C@@H]1C[N@H+](Cc2cc3ccnc(Cl)c3s2)CCO1 ZINC001560801166 1060660486 /nfs/dbraw/zinc/66/04/86/1060660486.db2.gz HELOFQCTIYTTMC-ZDUSSCGKSA-N 1 2 324.877 4.197 20 0 DIADLO CC(C)(C)[C@@H]1C[N@@H+](Cc2cc3ccnc(Cl)c3s2)CCO1 ZINC001560801166 1060660495 /nfs/dbraw/zinc/66/04/95/1060660495.db2.gz HELOFQCTIYTTMC-ZDUSSCGKSA-N 1 2 324.877 4.197 20 0 DIADLO CO[C@H](C[NH2+]CC(F)(F)c1ccc(Cl)cc1)CC(C)C ZINC001560820606 1060678593 /nfs/dbraw/zinc/67/85/93/1060678593.db2.gz DQKIEWYZEHFWLS-AWEZNQCLSA-N 1 2 305.796 4.083 20 0 DIADLO FC(F)C[C@H]1COCC[N@@H+]1Cc1ccc(C2CC2)c(C2CC2)c1 ZINC001560820527 1060679185 /nfs/dbraw/zinc/67/91/85/1060679185.db2.gz ULNLIZOOHXOYFE-INIZCTEOSA-N 1 2 321.411 4.297 20 0 DIADLO FC(F)C[C@H]1COCC[N@H+]1Cc1ccc(C2CC2)c(C2CC2)c1 ZINC001560820527 1060679191 /nfs/dbraw/zinc/67/91/91/1060679191.db2.gz ULNLIZOOHXOYFE-INIZCTEOSA-N 1 2 321.411 4.297 20 0 DIADLO Cc1cc(C)c(CC(=O)c2ccc(OC(F)(F)F)cc2)c[nH+]1 ZINC001250202029 1060682417 /nfs/dbraw/zinc/68/24/17/1060682417.db2.gz RFPPSOKXTPHJBJ-UHFFFAOYSA-N 1 2 309.287 4.022 20 0 DIADLO Fc1ccc(Cc2ccc(N3CCCCC3)[nH+]c2)c(F)c1F ZINC001250217908 1060696332 /nfs/dbraw/zinc/69/63/32/1060696332.db2.gz SICKWGVBKHJWAI-UHFFFAOYSA-N 1 2 306.331 4.080 20 0 DIADLO CCOc1c(F)cc(-n2c(C)[nH+]c3ccc(N)cc32)cc1Cl ZINC001250221348 1060701128 /nfs/dbraw/zinc/70/11/28/1060701128.db2.gz UOCZGBCCYGRAMC-UHFFFAOYSA-N 1 2 319.767 4.107 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccnc2)cn1 ZINC001560847150 1060701603 /nfs/dbraw/zinc/70/16/03/1060701603.db2.gz RUXCBPBIKPWOPS-LJQANCHMSA-N 1 2 309.457 4.258 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)cn1 ZINC001560847150 1060701620 /nfs/dbraw/zinc/70/16/20/1060701620.db2.gz RUXCBPBIKPWOPS-LJQANCHMSA-N 1 2 309.457 4.258 20 0 DIADLO CCOc1cccc(C[N@@H+]2CCc3c(Cl)cc(F)cc3C2)c1 ZINC001560860776 1060718124 /nfs/dbraw/zinc/71/81/24/1060718124.db2.gz WVQNEHJINWISDB-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CCOc1cccc(C[N@H+]2CCc3c(Cl)cc(F)cc3C2)c1 ZINC001560860776 1060718137 /nfs/dbraw/zinc/71/81/37/1060718137.db2.gz WVQNEHJINWISDB-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CCCCO[C@H]1C[C@H]([NH2+]CC(F)(F)c2ccccc2)C1(C)C ZINC001560871039 1060733389 /nfs/dbraw/zinc/73/33/89/1060733389.db2.gz WXEVNSCCZPIXHL-HOTGVXAUSA-N 1 2 311.416 4.352 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1c(Cl)n[nH]c1C1CC1 ZINC001560871128 1060733681 /nfs/dbraw/zinc/73/36/81/1060733681.db2.gz YXNKDAWPHKDCFY-VIFPVBQESA-N 1 2 307.850 4.121 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1c(Cl)n[nH]c1C1CC1 ZINC001560871128 1060733695 /nfs/dbraw/zinc/73/36/95/1060733695.db2.gz YXNKDAWPHKDCFY-VIFPVBQESA-N 1 2 307.850 4.121 20 0 DIADLO FC(F)Oc1cccc(Cc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001250268847 1060745270 /nfs/dbraw/zinc/74/52/70/1060745270.db2.gz ICPZKHBZIPWPSN-UHFFFAOYSA-N 1 2 314.335 4.124 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2c(Cl)n[nH]c2C2CC2)cc1C ZINC001560886243 1060749307 /nfs/dbraw/zinc/74/93/07/1060749307.db2.gz YALPPXBFUBNXFQ-UHFFFAOYSA-N 1 2 303.837 4.189 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2c(Cl)n[nH]c2C2CC2)cc1C ZINC001560886243 1060749322 /nfs/dbraw/zinc/74/93/22/1060749322.db2.gz YALPPXBFUBNXFQ-UHFFFAOYSA-N 1 2 303.837 4.189 20 0 DIADLO Cc1ccc(C2CC(Nc3ccc(N4CCCC4)c[nH+]3)C2)cc1 ZINC001560897750 1060758784 /nfs/dbraw/zinc/75/87/84/1060758784.db2.gz LYYDQKYRXIAGQG-UHFFFAOYSA-N 1 2 307.441 4.348 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccc(C)c(SC)c2)c1C ZINC001560911527 1060771029 /nfs/dbraw/zinc/77/10/29/1060771029.db2.gz FYPDLINHBTUXJJ-UHFFFAOYSA-N 1 2 302.443 4.349 20 0 DIADLO Cc1ccc2[nH+]cc(CN3CC(C)(C)c4ccc(F)cc43)n2c1 ZINC001560914093 1060773766 /nfs/dbraw/zinc/77/37/66/1060773766.db2.gz ZAQHRTURARSSMP-UHFFFAOYSA-N 1 2 309.388 4.080 20 0 DIADLO C[C@@H](CSc1ccccc1)[N@H+](C)Cc1nc(Cl)cs1 ZINC001560920095 1060782020 /nfs/dbraw/zinc/78/20/20/1060782020.db2.gz WBDHXHPFEHHUID-NSHDSACASA-N 1 2 312.891 4.409 20 0 DIADLO C[C@@H](CSc1ccccc1)[N@@H+](C)Cc1nc(Cl)cs1 ZINC001560920095 1060782035 /nfs/dbraw/zinc/78/20/35/1060782035.db2.gz WBDHXHPFEHHUID-NSHDSACASA-N 1 2 312.891 4.409 20 0 DIADLO C[C@H]1C[C@H](C[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)C[C@@H](C)C1 ZINC001560924569 1060789216 /nfs/dbraw/zinc/78/92/16/1060789216.db2.gz LUQHUVBNMHFCFT-WBTNSWJXSA-N 1 2 304.482 4.088 20 0 DIADLO C[C@@H]([NH2+][C@H]1CC[C@@H](c2ccc(Cl)cc2)C1)C(=O)OC(C)(C)C ZINC001560926817 1060790040 /nfs/dbraw/zinc/79/00/40/1060790040.db2.gz ZAZOYCGNIBGQAB-XPKDYRNWSA-N 1 2 323.864 4.296 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)[C@H](C)c1ccc(Cl)cc1)C(=O)OC(C)(C)C ZINC001560926182 1060790116 /nfs/dbraw/zinc/79/01/16/1060790116.db2.gz GTNZINUPFKQWNY-RWMBFGLXSA-N 1 2 311.853 4.152 20 0 DIADLO CCOc1nccc(C[N@@H+]2CCc3cc(C)ccc3C2)c1Cl ZINC001250386906 1060790943 /nfs/dbraw/zinc/79/09/43/1060790943.db2.gz DDEJOPCCVOYBGM-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1nccc(C[N@H+]2CCc3cc(C)ccc3C2)c1Cl ZINC001250386906 1060790958 /nfs/dbraw/zinc/79/09/58/1060790958.db2.gz DDEJOPCCVOYBGM-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1nccc(C[N@H+](CC)Cc2ccc(F)cc2)c1Cl ZINC001250385006 1060791258 /nfs/dbraw/zinc/79/12/58/1060791258.db2.gz FSFZODUVOKEFFJ-UHFFFAOYSA-N 1 2 322.811 4.295 20 0 DIADLO CCOc1nccc(C[N@@H+](CC)Cc2ccc(F)cc2)c1Cl ZINC001250385006 1060791274 /nfs/dbraw/zinc/79/12/74/1060791274.db2.gz FSFZODUVOKEFFJ-UHFFFAOYSA-N 1 2 322.811 4.295 20 0 DIADLO CCO[C@@H]1C[C@H]([NH2+]CC(F)(F)c2ccccc2C)C12CCC2 ZINC001560948788 1060812671 /nfs/dbraw/zinc/81/26/71/1060812671.db2.gz HWLHOPNWMNQOAZ-JKSUJKDBSA-N 1 2 309.400 4.024 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1cncc(Br)c1Cl ZINC001250457693 1060815087 /nfs/dbraw/zinc/81/50/87/1060815087.db2.gz DXAUTUNSFCTTJZ-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cncc(Br)c1Cl ZINC001250457692 1060817306 /nfs/dbraw/zinc/81/73/06/1060817306.db2.gz DXAUTUNSFCTTJZ-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO Oc1ccc(C[NH2+]Cc2ccsc2C(F)(F)F)c(F)c1F ZINC001560959857 1060823993 /nfs/dbraw/zinc/82/39/93/1060823993.db2.gz QCGMYYYQNWBHCM-UHFFFAOYSA-N 1 2 323.286 4.041 20 0 DIADLO Fc1cc2[nH]c(-c3c[nH]c4ccccc34)nc2cc1-n1cc[nH+]c1 ZINC001250473611 1060829314 /nfs/dbraw/zinc/82/93/14/1060829314.db2.gz CHKHTTLSXPRIPU-UHFFFAOYSA-N 1 2 317.327 4.036 20 0 DIADLO CCOc1cncc(C[N@@H+]2CCc3ccc(Cl)c(C)c3C2)c1 ZINC001560977575 1060841766 /nfs/dbraw/zinc/84/17/66/1060841766.db2.gz FGYWYGJMLWGCEX-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1cncc(C[N@H+]2CCc3ccc(Cl)c(C)c3C2)c1 ZINC001560977575 1060841780 /nfs/dbraw/zinc/84/17/80/1060841780.db2.gz FGYWYGJMLWGCEX-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO Fc1cc2[nH]c(-c3ccc(Cl)s3)nc2cc1-n1cc[nH+]c1 ZINC001250491293 1060846345 /nfs/dbraw/zinc/84/63/45/1060846345.db2.gz ZDROTNPVURZBOT-UHFFFAOYSA-N 1 2 318.764 4.270 20 0 DIADLO Cn1cc(Cl)c(C[NH+]2CCC(CC3CCCCC3)CC2)n1 ZINC001561026463 1060881893 /nfs/dbraw/zinc/88/18/93/1060881893.db2.gz FLHIZOGACDZSBX-UHFFFAOYSA-N 1 2 309.885 4.256 20 0 DIADLO Cc1cc(F)cc2[nH+]c(Cc3ccc(Br)cc3)[nH]c21 ZINC001250546871 1060885545 /nfs/dbraw/zinc/88/55/45/1060885545.db2.gz DNWYEELQTPDDOS-UHFFFAOYSA-N 1 2 319.177 4.364 20 0 DIADLO CCOc1cc2[nH]c([C@H]3CCOC(C)(C)C3)[nH+]c2cc1OCC ZINC001250544650 1060885618 /nfs/dbraw/zinc/88/56/18/1060885618.db2.gz IXONGGRGYYFFKP-LBPRGKRZSA-N 1 2 318.417 4.033 20 0 DIADLO FC1(C2CC2)CC[NH+](Cc2cncc(Cl)c2Cl)CC1 ZINC001561033838 1060887039 /nfs/dbraw/zinc/88/70/39/1060887039.db2.gz YCNGZRJXFUSLMH-UHFFFAOYSA-N 1 2 303.208 4.103 20 0 DIADLO COc1ccc2[nH+]c(CCc3cccc(Cl)c3)n(C)c2c1 ZINC001250553482 1060889922 /nfs/dbraw/zinc/88/99/22/1060889922.db2.gz DQGKGTHCHDPEKC-UHFFFAOYSA-N 1 2 300.789 4.021 20 0 DIADLO COc1cccc(CCc2[nH+]c3cccc(C)c3n2C2CC2)c1 ZINC001250554214 1060892270 /nfs/dbraw/zinc/89/22/70/1060892270.db2.gz XJHPVFHIFFBZRV-UHFFFAOYSA-N 1 2 306.409 4.473 20 0 DIADLO COc1ccc2c(c1)[nH+]c(CCc1ccc(Cl)cc1)n2C ZINC001250554049 1060893877 /nfs/dbraw/zinc/89/38/77/1060893877.db2.gz VRLSGZCNLZAGOV-UHFFFAOYSA-N 1 2 300.789 4.021 20 0 DIADLO CCn1c(C[C@H](C)CCCC(C)(C)O)[nH+]c2ccc(F)c(F)c21 ZINC001250557008 1060896144 /nfs/dbraw/zinc/89/61/44/1060896144.db2.gz WWTZJMLWYOJHMA-GFCCVEGCSA-N 1 2 324.415 4.454 20 0 DIADLO Cc1cc2[nH]c([C@H](C)Cc3ccc4c(c3)OCO4)[nH+]c2cc1F ZINC001250567458 1060904083 /nfs/dbraw/zinc/90/40/83/1060904083.db2.gz JXRLZIMAVCKJJJ-LLVKDONJSA-N 1 2 312.344 4.085 20 0 DIADLO COc1cccc(OC)c1CNc1[nH+]c2ccccc2n1C1CC1 ZINC001561058741 1060904885 /nfs/dbraw/zinc/90/48/85/1060904885.db2.gz ARUTYDMUXGHICO-UHFFFAOYSA-N 1 2 323.396 4.001 20 0 DIADLO CCOC(=O)[C@H]1CC[C@H](c2[nH]c3cc(C)c(C)cc3[nH+]2)CC1 ZINC001250590042 1060925063 /nfs/dbraw/zinc/92/50/63/1060925063.db2.gz PUANKQKPNKMYAD-HDJSIYSDSA-N 1 2 300.402 4.017 20 0 DIADLO COc1ccc2[nH]c(Cc3cccc(C(F)(F)F)c3)[nH+]c2c1 ZINC001250594796 1060927991 /nfs/dbraw/zinc/92/79/91/1060927991.db2.gz VIHLMRUEHVURQT-UHFFFAOYSA-N 1 2 306.287 4.181 20 0 DIADLO Cc1cccc2[nH+]c(CCCCCNC(=O)OC(C)(C)C)[nH]c21 ZINC001250611160 1060939754 /nfs/dbraw/zinc/93/97/54/1060939754.db2.gz AQECRJJPJXJZON-UHFFFAOYSA-N 1 2 317.433 4.109 20 0 DIADLO Cc1cccc2[nH]c(CCCCCNC(=O)OC(C)(C)C)[nH+]c21 ZINC001250611160 1060939775 /nfs/dbraw/zinc/93/97/75/1060939775.db2.gz AQECRJJPJXJZON-UHFFFAOYSA-N 1 2 317.433 4.109 20 0 DIADLO CC(=O)C[N@@H+](C)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC001473212285 1060982503 /nfs/dbraw/zinc/98/25/03/1060982503.db2.gz HPIZJCARRQNWBU-KRWDZBQOSA-N 1 2 305.780 4.089 20 0 DIADLO CC(=O)C[N@H+](C)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC001473212285 1060982520 /nfs/dbraw/zinc/98/25/20/1060982520.db2.gz HPIZJCARRQNWBU-KRWDZBQOSA-N 1 2 305.780 4.089 20 0 DIADLO CCCC[C@H](C)[C@H](C)Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001462172481 1060990341 /nfs/dbraw/zinc/99/03/41/1060990341.db2.gz BOVHPGOULBRAHN-NXOAAHMSSA-N 1 2 319.493 4.322 20 0 DIADLO CC[N@H+](CCCN(C)C(=O)OC(C)(C)C)c1ccc(C)cc1C ZINC001473230791 1061009939 /nfs/dbraw/zinc/00/99/39/1061009939.db2.gz BHDIDUPRINLNBD-UHFFFAOYSA-N 1 2 320.477 4.387 20 0 DIADLO CC[N@@H+](CCCN(C)C(=O)OC(C)(C)C)c1ccc(C)cc1C ZINC001473230791 1061009953 /nfs/dbraw/zinc/00/99/53/1061009953.db2.gz BHDIDUPRINLNBD-UHFFFAOYSA-N 1 2 320.477 4.387 20 0 DIADLO C/C=C\C[C@H]([NH2+][C@H](C)[C@H](C)c1ccc(Cl)cc1)C(=O)OCC ZINC001462194085 1061015221 /nfs/dbraw/zinc/01/52/21/1061015221.db2.gz WRNNYXPCVPTAOA-REWJEBOXSA-N 1 2 323.864 4.320 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+]1CCOc2ccccc2[C@H]1C ZINC001473249589 1061028443 /nfs/dbraw/zinc/02/84/43/1061028443.db2.gz KYWXXXZSBSXKQO-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+]1CCOc2ccccc2[C@H]1C ZINC001473249589 1061028454 /nfs/dbraw/zinc/02/84/54/1061028454.db2.gz KYWXXXZSBSXKQO-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(C[N@@H+]2CCOc3ccccc3[C@@H]2C)cc1Cl ZINC001473249904 1061029341 /nfs/dbraw/zinc/02/93/41/1061029341.db2.gz XQLLEWQUSBQXRZ-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(C[N@H+]2CCOc3ccccc3[C@@H]2C)cc1Cl ZINC001473249904 1061029355 /nfs/dbraw/zinc/02/93/55/1061029355.db2.gz XQLLEWQUSBQXRZ-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO Cc1[nH+]ccn1-c1ccc(-c2nc3ccc(Cl)cc3[nH]2)cc1 ZINC001250705124 1061030018 /nfs/dbraw/zinc/03/00/18/1061030018.db2.gz NXMFHIMHAXMAFW-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO CN(C)c1cccc(C[N@H+](C)Cc2c(F)cccc2Cl)c1 ZINC001473293065 1061061667 /nfs/dbraw/zinc/06/16/67/1061061667.db2.gz WHAUDCJBYZJVHC-UHFFFAOYSA-N 1 2 306.812 4.177 20 0 DIADLO CN(C)c1cccc(C[N@@H+](C)Cc2c(F)cccc2Cl)c1 ZINC001473293065 1061061684 /nfs/dbraw/zinc/06/16/84/1061061684.db2.gz WHAUDCJBYZJVHC-UHFFFAOYSA-N 1 2 306.812 4.177 20 0 DIADLO CCCc1cccc(C[N@@H+]2C[C@H](C(F)(F)F)OC(C)(C)C2)c1 ZINC001462274083 1061068597 /nfs/dbraw/zinc/06/85/97/1061068597.db2.gz STBIFDMENAPDBL-OAHLLOKOSA-N 1 2 315.379 4.181 20 0 DIADLO CCCc1cccc(C[N@H+]2C[C@H](C(F)(F)F)OC(C)(C)C2)c1 ZINC001462274083 1061068603 /nfs/dbraw/zinc/06/86/03/1061068603.db2.gz STBIFDMENAPDBL-OAHLLOKOSA-N 1 2 315.379 4.181 20 0 DIADLO CCOC(=O)[C@@H](CC(C)C)[NH2+][C@H](c1ccccc1C)C1CC1 ZINC001473314726 1061079618 /nfs/dbraw/zinc/07/96/18/1061079618.db2.gz ZVMIMZWTBCJIQI-MSOLQXFVSA-N 1 2 303.446 4.014 20 0 DIADLO Cc1[nH+]ccn1-c1ccccc1-c1nc2ccc(C)c(C)c2[nH]1 ZINC001250836043 1061085938 /nfs/dbraw/zinc/08/59/38/1061085938.db2.gz FAXVVFNFKRGZQM-UHFFFAOYSA-N 1 2 302.381 4.341 20 0 DIADLO C[C@@H]1CN(c2cccc(F)c2)CC[N@@H+]1Cc1cscc1Cl ZINC001462298382 1061089803 /nfs/dbraw/zinc/08/98/03/1061089803.db2.gz RYHLYRDDDQUEFH-GFCCVEGCSA-N 1 2 324.852 4.251 20 0 DIADLO C[C@@H]1CN(c2cccc(F)c2)CC[N@H+]1Cc1cscc1Cl ZINC001462298382 1061089819 /nfs/dbraw/zinc/08/98/19/1061089819.db2.gz RYHLYRDDDQUEFH-GFCCVEGCSA-N 1 2 324.852 4.251 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccc(C)c(F)c1 ZINC001473343094 1061102671 /nfs/dbraw/zinc/10/26/71/1061102671.db2.gz VNXQOTHSMQHPRB-AWEZNQCLSA-N 1 2 305.422 4.104 20 0 DIADLO CO[C@H](C[N@@H+]1CCc2c3ccccc3[nH]c2C1)c1ccc(F)cc1 ZINC001473349329 1061106266 /nfs/dbraw/zinc/10/62/66/1061106266.db2.gz XUHPSUAZVYKFTN-HXUWFJFHSA-N 1 2 324.399 4.053 20 0 DIADLO CO[C@H](C[N@H+]1CCc2c3ccccc3[nH]c2C1)c1ccc(F)cc1 ZINC001473349329 1061106279 /nfs/dbraw/zinc/10/62/79/1061106279.db2.gz XUHPSUAZVYKFTN-HXUWFJFHSA-N 1 2 324.399 4.053 20 0 DIADLO CCc1ccc2ccccc2c1C[NH2+][C@H](C(=O)OC)[C@@H](C)CC ZINC001473353583 1061109395 /nfs/dbraw/zinc/10/93/95/1061109395.db2.gz AWMKAKKXHXRKCS-LIRRHRJNSA-N 1 2 313.441 4.080 20 0 DIADLO Cc1ccc(C[N@@H+]([C@H](C)C(=O)OC(C)(C)C)C2CC2)cc1Cl ZINC001462334335 1061109948 /nfs/dbraw/zinc/10/99/48/1061109948.db2.gz LYIGCBCLPOYPRH-CYBMUJFWSA-N 1 2 323.864 4.343 20 0 DIADLO Cc1ccc(C[N@H+]([C@H](C)C(=O)OC(C)(C)C)C2CC2)cc1Cl ZINC001462334335 1061109961 /nfs/dbraw/zinc/10/99/61/1061109961.db2.gz LYIGCBCLPOYPRH-CYBMUJFWSA-N 1 2 323.864 4.343 20 0 DIADLO CCC1(c2ccccc2)C[NH+](Cc2nc(-c3ccccc3)c[nH]2)C1 ZINC001462334863 1061110717 /nfs/dbraw/zinc/11/07/17/1061110717.db2.gz QSKFUKHHFIBEJS-UHFFFAOYSA-N 1 2 317.436 4.240 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1cccc(F)c1Cl ZINC001473372665 1061120177 /nfs/dbraw/zinc/12/01/77/1061120177.db2.gz BZXQZKQIJKUEJV-GFCCVEGCSA-N 1 2 305.780 4.262 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1cccc(F)c1Cl ZINC001473372665 1061120188 /nfs/dbraw/zinc/12/01/88/1061120188.db2.gz BZXQZKQIJKUEJV-GFCCVEGCSA-N 1 2 305.780 4.262 20 0 DIADLO CCN(Cc1ccc(-n2cc[nH+]c2)cc1)c1ccc2[nH]ccc2c1 ZINC001473392930 1061132167 /nfs/dbraw/zinc/13/21/67/1061132167.db2.gz NIKUNGZWEXTLIP-UHFFFAOYSA-N 1 2 316.408 4.380 20 0 DIADLO Cn1c(-c2cccc(-n3cc[nH+]c3)c2)nc2cccc(Cl)c21 ZINC001250940071 1061135675 /nfs/dbraw/zinc/13/56/75/1061135675.db2.gz DFEMWTGAAPDBEC-UHFFFAOYSA-N 1 2 308.772 4.079 20 0 DIADLO Fc1cc(Cl)cc2[nH]c(-c3cccc(-n4cc[nH+]c4)c3)nc21 ZINC001250939966 1061135726 /nfs/dbraw/zinc/13/57/26/1061135726.db2.gz BMOYSUQHOAZMSS-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[NH+]1CCC(C)(C(C)C)CC1 ZINC001473402724 1061138926 /nfs/dbraw/zinc/13/89/26/1061138926.db2.gz UVAQCUVXVBRKNE-INIZCTEOSA-N 1 2 323.864 4.312 20 0 DIADLO Fc1cccc(Cl)c1[C@@H]1C[N@H+](C[C@@H]2CC=CCC2)CCO1 ZINC001462407005 1061154391 /nfs/dbraw/zinc/15/43/91/1061154391.db2.gz GKXCBJVZJMNHIW-CJNGLKHVSA-N 1 2 309.812 4.209 20 0 DIADLO Fc1cccc(Cl)c1[C@@H]1C[N@@H+](C[C@@H]2CC=CCC2)CCO1 ZINC001462407005 1061154397 /nfs/dbraw/zinc/15/43/97/1061154397.db2.gz GKXCBJVZJMNHIW-CJNGLKHVSA-N 1 2 309.812 4.209 20 0 DIADLO Clc1cc2[nH]c(-c3ccc4[nH+]ccn4c3)nc2c(Cl)c1 ZINC001250978601 1061158684 /nfs/dbraw/zinc/15/86/84/1061158684.db2.gz NFKKSIWWWNLENM-UHFFFAOYSA-N 1 2 303.152 4.184 20 0 DIADLO Cc1ccc(-c2nc3ccc(F)c(F)c3n2C(C)(C)C)c(N)[nH+]1 ZINC001250982021 1061159781 /nfs/dbraw/zinc/15/97/81/1061159781.db2.gz NDUSDVICCWPYEN-UHFFFAOYSA-N 1 2 316.355 4.022 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+]1CCc2c(cccc2C(C)C)C1 ZINC001473442652 1061161368 /nfs/dbraw/zinc/16/13/68/1061161368.db2.gz DOEMXIRFPNHRQT-SFHVURJKSA-N 1 2 317.473 4.288 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@H+]1CCc2c(cccc2C(C)C)C1 ZINC001473442652 1061161372 /nfs/dbraw/zinc/16/13/72/1061161372.db2.gz DOEMXIRFPNHRQT-SFHVURJKSA-N 1 2 317.473 4.288 20 0 DIADLO COc1c(F)cc(-c2[nH]c3ccc(N(C)C)cc3[nH+]2)cc1Cl ZINC001250994674 1061171314 /nfs/dbraw/zinc/17/13/14/1061171314.db2.gz IBBSMLMZDFLTMK-UHFFFAOYSA-N 1 2 319.767 4.097 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC001462449765 1061181928 /nfs/dbraw/zinc/18/19/28/1061181928.db2.gz GULGRQMEDZHPJT-MLGOLLRUSA-N 1 2 317.807 4.201 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC001462449765 1061181934 /nfs/dbraw/zinc/18/19/34/1061181934.db2.gz GULGRQMEDZHPJT-MLGOLLRUSA-N 1 2 317.807 4.201 20 0 DIADLO CCCc1cccc(C[N@@H+]2C[C@@H](C)O[C@H](CC(F)(F)F)C2)c1 ZINC001462458878 1061185921 /nfs/dbraw/zinc/18/59/21/1061185921.db2.gz WLEQPVYMLXUDKA-CZUORRHYSA-N 1 2 315.379 4.181 20 0 DIADLO CCCc1cccc(C[N@H+]2C[C@@H](C)O[C@H](CC(F)(F)F)C2)c1 ZINC001462458878 1061185934 /nfs/dbraw/zinc/18/59/34/1061185934.db2.gz WLEQPVYMLXUDKA-CZUORRHYSA-N 1 2 315.379 4.181 20 0 DIADLO CC1(c2ccccc2)C[NH+](Cc2cc(O)cc(C(F)(F)F)c2)C1 ZINC001462455888 1061186773 /nfs/dbraw/zinc/18/67/73/1061186773.db2.gz LNJNHCSPCDLZQD-UHFFFAOYSA-N 1 2 321.342 4.185 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@@H+]1C[C@H](C(F)(F)F)OC(C)(C)C1 ZINC001473496322 1061190740 /nfs/dbraw/zinc/19/07/40/1061190740.db2.gz BUJGXWKRQKGCJZ-ZIAGYGMSSA-N 1 2 319.342 4.319 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@H+]1C[C@H](C(F)(F)F)OC(C)(C)C1 ZINC001473496322 1061190743 /nfs/dbraw/zinc/19/07/43/1061190743.db2.gz BUJGXWKRQKGCJZ-ZIAGYGMSSA-N 1 2 319.342 4.319 20 0 DIADLO FC1(F)CCC[C@H]1CC[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC001473516510 1061209229 /nfs/dbraw/zinc/20/92/29/1061209229.db2.gz VZVPVVBLIPSJCF-HNNXBMFYSA-N 1 2 317.383 4.013 20 0 DIADLO FC1(F)CCC[C@H]1CC[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC001473516510 1061209248 /nfs/dbraw/zinc/20/92/48/1061209248.db2.gz VZVPVVBLIPSJCF-HNNXBMFYSA-N 1 2 317.383 4.013 20 0 DIADLO Cc1ccc(NC(=O)CCc2c[nH]c[nH+]2)cc1-c1ccsc1 ZINC001455462018 1061221652 /nfs/dbraw/zinc/22/16/52/1061221652.db2.gz FBPDJLQZZDXCQC-UHFFFAOYSA-N 1 2 311.410 4.018 20 0 DIADLO Cc1ccc(NC(=O)CCc2c[nH+]c[nH]2)cc1-c1ccsc1 ZINC001455462018 1061221672 /nfs/dbraw/zinc/22/16/72/1061221672.db2.gz FBPDJLQZZDXCQC-UHFFFAOYSA-N 1 2 311.410 4.018 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)CCC2CCCCC2)[nH+]c1C ZINC001455762164 1061234603 /nfs/dbraw/zinc/23/46/03/1061234603.db2.gz LJQLVWVMVILJRA-INIZCTEOSA-N 1 2 303.450 4.051 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(Br)o1 ZINC001462524847 1061234471 /nfs/dbraw/zinc/23/44/71/1061234471.db2.gz BVRNCQYUPXBNLO-UKRRQHHQSA-N 1 2 324.193 4.157 20 0 DIADLO F[C@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(Br)o1 ZINC001462524848 1061235913 /nfs/dbraw/zinc/23/59/13/1061235913.db2.gz BVRNCQYUPXBNLO-ZFWWWQNUSA-N 1 2 324.193 4.157 20 0 DIADLO Cc1cc(N[C@H](C)CC(=O)Nc2cccc(Cl)c2)c[nH+]c1C ZINC001462535010 1061244264 /nfs/dbraw/zinc/24/42/64/1061244264.db2.gz HHRLWHQAPKHWKU-GFCCVEGCSA-N 1 2 317.820 4.181 20 0 DIADLO CN(C)c1ccccc1C[N@@H+]1CCc2sc(Cl)cc2C1 ZINC001473584704 1061270732 /nfs/dbraw/zinc/27/07/32/1061270732.db2.gz ZTPPPMREZRDYDM-UHFFFAOYSA-N 1 2 306.862 4.026 20 0 DIADLO CN(C)c1ccccc1C[N@H+]1CCc2sc(Cl)cc2C1 ZINC001473584704 1061270753 /nfs/dbraw/zinc/27/07/53/1061270753.db2.gz ZTPPPMREZRDYDM-UHFFFAOYSA-N 1 2 306.862 4.026 20 0 DIADLO CCC(C)(C)N1CC[NH+]([C@@H](C)CCSc2ccccc2)CC1 ZINC001473594416 1061274815 /nfs/dbraw/zinc/27/48/15/1061274815.db2.gz GGHPDWWTALBZPU-KRWDZBQOSA-N 1 2 320.546 4.364 20 0 DIADLO Fc1cccc(Cl)c1[C@H]1C[N@H+](CC23CCC(CC2)C3)CCO1 ZINC001473615761 1061289915 /nfs/dbraw/zinc/28/99/15/1061289915.db2.gz ABJOXZQQWMBIHW-CRPOECCBSA-N 1 2 323.839 4.433 20 0 DIADLO Fc1cccc(Cl)c1[C@H]1C[N@@H+](CC23CCC(CC2)C3)CCO1 ZINC001473615761 1061289932 /nfs/dbraw/zinc/28/99/32/1061289932.db2.gz ABJOXZQQWMBIHW-CRPOECCBSA-N 1 2 323.839 4.433 20 0 DIADLO COc1nscc1C[N@H+](C)C/C=C/c1c(C)cc(C)cc1C ZINC001462608339 1061295833 /nfs/dbraw/zinc/29/58/33/1061295833.db2.gz JPIZOZCYJREPMQ-VOTSOKGWSA-N 1 2 316.470 4.222 20 0 DIADLO COc1nscc1C[N@@H+](C)C/C=C/c1c(C)cc(C)cc1C ZINC001462608339 1061295852 /nfs/dbraw/zinc/29/58/52/1061295852.db2.gz JPIZOZCYJREPMQ-VOTSOKGWSA-N 1 2 316.470 4.222 20 0 DIADLO Clc1ccc2c(c1)nc(-c1cccc3[nH+]ccn31)n2C1CC1 ZINC001251326365 1061315736 /nfs/dbraw/zinc/31/57/36/1061315736.db2.gz FKILVIXLIZYOBV-UHFFFAOYSA-N 1 2 308.772 4.339 20 0 DIADLO Clc1ccc2c(c1)nc(-c1cccc3[nH+]ccn31)n2CC1CC1 ZINC001251326768 1061316847 /nfs/dbraw/zinc/31/68/47/1061316847.db2.gz WYODSOSUVQIKQW-UHFFFAOYSA-N 1 2 322.799 4.414 20 0 DIADLO CCc1ccc2c(c1)CC[N@@H+](Cc1nc3c(s1)CCCC3)C2 ZINC001462665539 1061324825 /nfs/dbraw/zinc/32/48/25/1061324825.db2.gz IKWUZIPMYMJQJG-UHFFFAOYSA-N 1 2 312.482 4.143 20 0 DIADLO CCc1ccc2c(c1)CC[N@H+](Cc1nc3c(s1)CCCC3)C2 ZINC001462665539 1061324839 /nfs/dbraw/zinc/32/48/39/1061324839.db2.gz IKWUZIPMYMJQJG-UHFFFAOYSA-N 1 2 312.482 4.143 20 0 DIADLO COc1cc(-c2nc3cc(C)c(C)cc3[nH]2)ccc1-n1cc[nH+]c1 ZINC001251363854 1061334196 /nfs/dbraw/zinc/33/41/96/1061334196.db2.gz IECDWJRKKQMCDH-UHFFFAOYSA-N 1 2 318.380 4.041 20 0 DIADLO FC(F)[C@@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1ccccc1 ZINC001462680265 1061335486 /nfs/dbraw/zinc/33/54/86/1061335486.db2.gz DWJZHNINRRWCEO-CVEARBPZSA-N 1 2 309.400 4.464 20 0 DIADLO COc1cc(C[NH+]2CC(Oc3ccccc3)C2)cc2ccccc21 ZINC001462683605 1061335906 /nfs/dbraw/zinc/33/59/06/1061335906.db2.gz MMZUJLPPNWREJD-UHFFFAOYSA-N 1 2 319.404 4.112 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC001462734477 1061345993 /nfs/dbraw/zinc/34/59/93/1061345993.db2.gz XBPWKRZPCJFGHR-HNNXBMFYSA-N 1 2 304.393 4.016 20 0 DIADLO Cc1cc(C)[nH+]c(CN(C)[C@@H](CCc2ccccc2)C(F)F)c1 ZINC001473692251 1061352111 /nfs/dbraw/zinc/35/21/11/1061352111.db2.gz YYWVFLHDUYKMFE-SFHVURJKSA-N 1 2 318.411 4.397 20 0 DIADLO C=C/C=C\CC[NH2+][C@@H](Cc1cccc2ccccc21)C(=O)OCC ZINC001473699122 1061352956 /nfs/dbraw/zinc/35/29/56/1061352956.db2.gz BRHUHYYIQQRGNQ-PRPIBZDOSA-N 1 2 323.436 4.036 20 0 DIADLO C=C/C=C/CC[NH2+][C@H](Cc1cccc2ccccc21)C(=O)OCC ZINC001473699123 1061354647 /nfs/dbraw/zinc/35/46/47/1061354647.db2.gz BRHUHYYIQQRGNQ-RRFGBZISSA-N 1 2 323.436 4.036 20 0 DIADLO Cc1cc(Cl)ccc1C1=CC[N@H+](Cc2nccs2)CC1 ZINC001473696217 1061355814 /nfs/dbraw/zinc/35/58/14/1061355814.db2.gz GCXVNZNIVLYMRC-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO Cc1cc(Cl)ccc1C1=CC[N@@H+](Cc2nccs2)CC1 ZINC001473696217 1061355831 /nfs/dbraw/zinc/35/58/31/1061355831.db2.gz GCXVNZNIVLYMRC-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO CN(C)c1cc[nH+]c(NC(=O)c2cccc(C3CCCC3)c2)c1 ZINC001546133782 1061356309 /nfs/dbraw/zinc/35/63/09/1061356309.db2.gz ZMTMQGKMNNLTSJ-UHFFFAOYSA-N 1 2 309.413 4.058 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@H+](Cc2cncc(Cl)c2)C1 ZINC001473730235 1061376243 /nfs/dbraw/zinc/37/62/43/1061376243.db2.gz ONHCZRGUSOQZCN-KRWDZBQOSA-N 1 2 304.796 4.196 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@@H+](Cc2cncc(Cl)c2)C1 ZINC001473730235 1061376259 /nfs/dbraw/zinc/37/62/59/1061376259.db2.gz ONHCZRGUSOQZCN-KRWDZBQOSA-N 1 2 304.796 4.196 20 0 DIADLO Cc1cccc2c1nc(-c1ccc(-n3cc[nH+]c3)c(Cl)c1)n2C ZINC001251507863 1061385333 /nfs/dbraw/zinc/38/53/33/1061385333.db2.gz WRKLPNQDANUOCR-UHFFFAOYSA-N 1 2 322.799 4.388 20 0 DIADLO COC(=O)[C@]1([NH2+]C[C@@H](C)C(C)(C)C)CC[C@@H](C)c2ccccc21 ZINC001473887754 1061450021 /nfs/dbraw/zinc/45/00/21/1061450021.db2.gz IFHPAFINTNRKTK-SXGZJXTBSA-N 1 2 317.473 4.224 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCc3cc(F)cc(F)c3C2)cc1 ZINC001473904193 1061455283 /nfs/dbraw/zinc/45/52/83/1061455283.db2.gz QCSRVQCKMPXNKI-UHFFFAOYSA-N 1 2 301.380 4.476 20 0 DIADLO CCCc1ccc(C[N@H+]2CCc3cc(F)cc(F)c3C2)cc1 ZINC001473904193 1061455291 /nfs/dbraw/zinc/45/52/91/1061455291.db2.gz QCSRVQCKMPXNKI-UHFFFAOYSA-N 1 2 301.380 4.476 20 0 DIADLO c1ccc([C@@H]2C[C@H]2CNc2ccc(N3CCCCC3)c[nH+]2)cc1 ZINC001473947731 1061490554 /nfs/dbraw/zinc/49/05/54/1061490554.db2.gz OTYGGGUXSGSLSP-HKUYNNGSSA-N 1 2 307.441 4.288 20 0 DIADLO Fc1cccc(Oc2ccccc2C[NH2+]Cc2cscn2)c1 ZINC001473990036 1061530512 /nfs/dbraw/zinc/53/05/12/1061530512.db2.gz IBKYMCITQDNUSA-UHFFFAOYSA-N 1 2 314.385 4.364 20 0 DIADLO Cc1cc(CNC(=O)N[C@@H]2CCCC[C@@H]2C(C)(C)C)cc(C)[nH+]1 ZINC001252017684 1061557431 /nfs/dbraw/zinc/55/74/31/1061557431.db2.gz KENVJOCYAYWPSA-DLBZAZTESA-N 1 2 317.477 4.103 20 0 DIADLO CCc1cccc2cc(C[NH2+]Cc3nc4ccc(C)cc4[nH]3)oc21 ZINC001474032766 1061575905 /nfs/dbraw/zinc/57/59/05/1061575905.db2.gz SGZHPAVPEKJGCV-UHFFFAOYSA-N 1 2 319.408 4.470 20 0 DIADLO CC(C)(C)c1nccc(Nc2ccc(NC3CCCC3)[nH+]c2)n1 ZINC001458144602 1061597423 /nfs/dbraw/zinc/59/74/23/1061597423.db2.gz GNFWYDISMQHTRO-UHFFFAOYSA-N 1 2 311.433 4.267 20 0 DIADLO Cc1ccc(C[C@@H]2CCCN(c3cc(C)[nH+]c(C4CC4)n3)C2)cc1 ZINC001458146766 1061598274 /nfs/dbraw/zinc/59/82/74/1061598274.db2.gz ZIPMSBJBRRFGDR-SFHVURJKSA-N 1 2 321.468 4.430 20 0 DIADLO Clc1ccc2nc(Oc3cccc(-n4cc[nH+]c4)c3)cnc2c1 ZINC001458190581 1061622828 /nfs/dbraw/zinc/62/28/28/1061622828.db2.gz QQVLKWQUNRIUHS-UHFFFAOYSA-N 1 2 322.755 4.261 20 0 DIADLO Cc1cc(NCC2(c3cccc(F)c3)CC2)nc(C2CCC2)[nH+]1 ZINC001458194718 1061626321 /nfs/dbraw/zinc/62/63/21/1061626321.db2.gz PHVSTHZPXVYEQU-UHFFFAOYSA-N 1 2 311.404 4.335 20 0 DIADLO CCS[C@@H]1CC[C@@H](N(C)c2cc(C)[nH+]c(C3CCC3)n2)C1 ZINC001458202222 1061628040 /nfs/dbraw/zinc/62/80/40/1061628040.db2.gz ANZLLBXPVORADK-HUUCEWRRSA-N 1 2 305.491 4.163 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(C3CCCC3)cc2)c(N(C)C)[nH+]1 ZINC001458214722 1061636995 /nfs/dbraw/zinc/63/69/95/1061636995.db2.gz ISSIRHMFAIWXSS-UHFFFAOYSA-N 1 2 323.440 4.366 20 0 DIADLO Cc1ccc(C)c(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)c1 ZINC001464824662 1061637665 /nfs/dbraw/zinc/63/76/65/1061637665.db2.gz HSCREYSNOMPDTN-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO Cc1cc(NCc2c(Cl)cccc2N(C)C)ccc1[NH+](C)C ZINC001474094257 1061640570 /nfs/dbraw/zinc/64/05/70/1061640570.db2.gz XNLCISJVKJAWML-UHFFFAOYSA-N 1 2 317.864 4.393 20 0 DIADLO Cc1cc(NCc2ccccc2OCC2CC2)ccc1[NH+](C)C ZINC001474094831 1061641781 /nfs/dbraw/zinc/64/17/81/1061641781.db2.gz XUMYLCQWXLEBNS-UHFFFAOYSA-N 1 2 310.441 4.462 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2ccc3sccc3c2)c[nH+]1 ZINC001464930957 1061654980 /nfs/dbraw/zinc/65/49/80/1061654980.db2.gz QDHCVPYRGBHOCO-UHFFFAOYSA-N 1 2 311.410 4.235 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NC/C=C\c1ccc(F)cc1F ZINC001474115522 1061664462 /nfs/dbraw/zinc/66/44/62/1061664462.db2.gz MGTCAWUJBZVNQP-HYXAFXHYSA-N 1 2 304.340 4.272 20 0 DIADLO CCC1(CC)[C@H](Nc2cc(C)[nH+]c(C3CCC3)n2)[C@H](C)[C@@H]1OC ZINC001458294172 1061681845 /nfs/dbraw/zinc/68/18/45/1061681845.db2.gz BSAJMVQNEZJLRE-XKQJLSEDSA-N 1 2 317.477 4.304 20 0 DIADLO Cc1ccc(Nc2ccccc2C(=O)Nc2cc[nH+]c(C)c2)cc1 ZINC001465144726 1061689065 /nfs/dbraw/zinc/68/90/65/1061689065.db2.gz HDVKJGGKANRNRY-UHFFFAOYSA-N 1 2 317.392 4.116 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(Cl)cc1)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000542133698 1061699272 /nfs/dbraw/zinc/69/92/72/1061699272.db2.gz ZFUPEGWBVGDPCJ-STQMWFEESA-N 1 2 314.816 4.244 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(Cl)cc1)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000542133698 1061699282 /nfs/dbraw/zinc/69/92/82/1061699282.db2.gz ZFUPEGWBVGDPCJ-STQMWFEESA-N 1 2 314.816 4.244 20 0 DIADLO Cc1cc(N2CCc3cc(F)cc(C)c3C2)nc(C2CCC2)[nH+]1 ZINC001458338084 1061704820 /nfs/dbraw/zinc/70/48/20/1061704820.db2.gz MMHKVMMNQVPCNS-UHFFFAOYSA-N 1 2 311.404 4.063 20 0 DIADLO CSCc1ccc(CNc2nc(C)[nH+]c3c2CCCC3)cc1 ZINC001458365137 1061723111 /nfs/dbraw/zinc/72/31/11/1061723111.db2.gz BMAOBCLGASGZIC-UHFFFAOYSA-N 1 2 313.470 4.139 20 0 DIADLO CN(Cc1nnc(-c2ccc(C(C)(C)C)cc2)o1)c1cccc[nH+]1 ZINC001252812501 1061728511 /nfs/dbraw/zinc/72/85/11/1061728511.db2.gz HNINKWLENSNKNZ-UHFFFAOYSA-N 1 2 322.412 4.066 20 0 DIADLO CC(C)=CCC[C@H](C)Nc1nc(C)[nH+]c(C)c1Br ZINC001458388479 1061735914 /nfs/dbraw/zinc/73/59/14/1061735914.db2.gz QCRMFWNGKJZQCT-JTQLQIEISA-N 1 2 312.255 4.403 20 0 DIADLO Cc1nc(N[C@@H](C)c2ccc(Cl)cc2)c2c([nH+]1)CCCC2 ZINC001458419642 1061751515 /nfs/dbraw/zinc/75/15/15/1061751515.db2.gz PGQHXAHMKXQMTG-NSHDSACASA-N 1 2 301.821 4.490 20 0 DIADLO Brc1ccc(CNc2c[nH+]cc3c2CCCC3)s1 ZINC001474208695 1061763542 /nfs/dbraw/zinc/76/35/42/1061763542.db2.gz NGAPQJZGPCSTCD-UHFFFAOYSA-N 1 2 323.259 4.397 20 0 DIADLO COc1c(C)cc(Cl)cc1NCc1c[nH+]c2ccc(C)cn12 ZINC001474213995 1061771272 /nfs/dbraw/zinc/77/12/72/1061771272.db2.gz KWSUWERQHBTZQX-UHFFFAOYSA-N 1 2 315.804 4.225 20 0 DIADLO Cc1nc(N2CCc3ccc(C(C)C)cc3C2)c2c([nH+]1)CCCC2 ZINC001458473127 1061785490 /nfs/dbraw/zinc/78/54/90/1061785490.db2.gz HDFQAYKYTWZNQX-UHFFFAOYSA-N 1 2 321.468 4.350 20 0 DIADLO C[C@](O)(CNc1cc(-c2cccc(F)c2)cc[nH+]1)c1ccccc1 ZINC001253090907 1061798320 /nfs/dbraw/zinc/79/83/20/1061798320.db2.gz KRTMSCLSPMGTHD-FQEVSTJZSA-N 1 2 322.383 4.207 20 0 DIADLO CCc1cc(N[C@H]2CC[C@H](OCCC(C)C)CC2)nc(CC)[nH+]1 ZINC001458496348 1061800446 /nfs/dbraw/zinc/80/04/46/1061800446.db2.gz VPQLVRNAZCISOY-QAQDUYKDSA-N 1 2 319.493 4.387 20 0 DIADLO Cc1cc(NCc2c(F)cccc2Br)c[nH+]c1C ZINC001474247985 1061815111 /nfs/dbraw/zinc/81/51/11/1061815111.db2.gz MACBKOIFNDIFAP-UHFFFAOYSA-N 1 2 309.182 4.212 20 0 DIADLO CCc1cc(N2CC[C@H](c3ccccc3F)C2(C)C)nc(C)[nH+]1 ZINC001458547926 1061832315 /nfs/dbraw/zinc/83/23/15/1061832315.db2.gz PMIKUKFHEFRUMM-MRXNPFEDSA-N 1 2 313.420 4.259 20 0 DIADLO Fc1cccc2oc(N[C@H](Cn3cc[nH+]c3)c3ccccc3)nc21 ZINC001458553447 1061834801 /nfs/dbraw/zinc/83/48/01/1061834801.db2.gz AEPMZEBAJZNSHS-OAHLLOKOSA-N 1 2 322.343 4.017 20 0 DIADLO COc1ccc(CNc2ccc3[nH+]c(C)cc(C)c3c2)cc1OC ZINC001474267657 1061835972 /nfs/dbraw/zinc/83/59/72/1061835972.db2.gz HYKFCDAQNKEFOL-UHFFFAOYSA-N 1 2 322.408 4.481 20 0 DIADLO CCCn1ccc2cc(NC(=O)Nc3cc(C)[nH+]cc3C)ccc21 ZINC001465949066 1061846715 /nfs/dbraw/zinc/84/67/15/1061846715.db2.gz ZVSGJGKBUDPHCL-UHFFFAOYSA-N 1 2 322.412 4.129 20 0 DIADLO CCc1cc(N[C@@H](C)c2ccc(C(F)(F)F)nc2)nc(CC)[nH+]1 ZINC001458636384 1061861918 /nfs/dbraw/zinc/86/19/18/1061861918.db2.gz AENCLSSSRUQHBV-JTQLQIEISA-N 1 2 324.350 4.188 20 0 DIADLO Fc1cc(C[N@@H+]2CCc3ccccc3C2)cc(C(F)(F)F)c1 ZINC001474308745 1061877860 /nfs/dbraw/zinc/87/78/60/1061877860.db2.gz ZACLUMXDXJRMHN-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Fc1cc(C[N@H+]2CCc3ccccc3C2)cc(C(F)(F)F)c1 ZINC001474308745 1061877876 /nfs/dbraw/zinc/87/78/76/1061877876.db2.gz ZACLUMXDXJRMHN-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO CCNc1ccc(Nc2nc(C(F)F)nc3ccccc32)c[nH+]1 ZINC001458733365 1061887441 /nfs/dbraw/zinc/88/74/41/1061887441.db2.gz SPRVKVHCXOXFFH-UHFFFAOYSA-N 1 2 315.327 4.138 20 0 DIADLO CC[N@H+](Cc1cc(C(=O)OC)cs1)Cc1ccccc1Cl ZINC001474318959 1061890468 /nfs/dbraw/zinc/89/04/68/1061890468.db2.gz KUEUSVGKVGLHLP-UHFFFAOYSA-N 1 2 323.845 4.210 20 0 DIADLO CC[N@@H+](Cc1cc(C(=O)OC)cs1)Cc1ccccc1Cl ZINC001474318959 1061890491 /nfs/dbraw/zinc/89/04/91/1061890491.db2.gz KUEUSVGKVGLHLP-UHFFFAOYSA-N 1 2 323.845 4.210 20 0 DIADLO CC(C)[C@@H]1CCC[N@H+](Cc2nc(Br)cs2)CC1 ZINC001474321568 1061900378 /nfs/dbraw/zinc/90/03/78/1061900378.db2.gz NAYGRMZHJMNNEN-LLVKDONJSA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)[C@@H]1CCC[N@@H+](Cc2nc(Br)cs2)CC1 ZINC001474321568 1061900397 /nfs/dbraw/zinc/90/03/97/1061900397.db2.gz NAYGRMZHJMNNEN-LLVKDONJSA-N 1 2 317.296 4.164 20 0 DIADLO Cc1coc2ccc(NC(=O)NCc3cc(C)[nH+]c(C)c3)cc12 ZINC001466224889 1061901523 /nfs/dbraw/zinc/90/15/23/1061901523.db2.gz VMFVYDSPSXIUOT-UHFFFAOYSA-N 1 2 309.369 4.075 20 0 DIADLO CCCn1cc(C[N@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)nn1 ZINC001474363282 1061992928 /nfs/dbraw/zinc/99/29/28/1061992928.db2.gz HWILTNHVDRAMDN-CYBMUJFWSA-N 1 2 318.852 4.067 20 0 DIADLO CCCn1cc(C[N@@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)nn1 ZINC001474363282 1061992955 /nfs/dbraw/zinc/99/29/55/1061992955.db2.gz HWILTNHVDRAMDN-CYBMUJFWSA-N 1 2 318.852 4.067 20 0 DIADLO Cc1cc(C)c(NC(=O)NC(C)(C)C2CCCCC2)c(C)[nH+]1 ZINC001466756139 1061999606 /nfs/dbraw/zinc/99/96/06/1061999606.db2.gz ZXLFTZHYABSDNN-UHFFFAOYSA-N 1 2 303.450 4.487 20 0 DIADLO CC(C)(C)OC(=O)c1ccc(Cn2c[nH+]c(C(C)(C)C)c2)cc1 ZINC001459211396 1062041727 /nfs/dbraw/zinc/04/17/27/1062041727.db2.gz UGXXPPQHEYUANY-UHFFFAOYSA-N 1 2 314.429 4.184 20 0 DIADLO CCCC[C@@H](C)[NH2+][C@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001474389435 1062042110 /nfs/dbraw/zinc/04/21/10/1062042110.db2.gz BDBRMKQZKRRDAH-NVXWUHKLSA-N 1 2 305.462 4.108 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccc(Oc3ccc(F)cc3)nc2)C[C@H]1F ZINC001474393289 1062045646 /nfs/dbraw/zinc/04/56/46/1062045646.db2.gz NCJWDRKTGPOTBS-SUMWQHHRSA-N 1 2 318.367 4.193 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)nc2)C[C@H]1F ZINC001474393289 1062045670 /nfs/dbraw/zinc/04/56/70/1062045670.db2.gz NCJWDRKTGPOTBS-SUMWQHHRSA-N 1 2 318.367 4.193 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](F)C2)c(C)c1Br ZINC001474393430 1062049330 /nfs/dbraw/zinc/04/93/30/1062049330.db2.gz QIZFEZBKWAKAMR-YGRLFVJLSA-N 1 2 314.242 4.246 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)c(C)c1Br ZINC001474393430 1062049351 /nfs/dbraw/zinc/04/93/51/1062049351.db2.gz QIZFEZBKWAKAMR-YGRLFVJLSA-N 1 2 314.242 4.246 20 0 DIADLO CCC(CC)CCCN(C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001467064157 1062060575 /nfs/dbraw/zinc/06/05/75/1062060575.db2.gz FFSVTDOPTSDBGI-UHFFFAOYSA-N 1 2 302.422 4.014 20 0 DIADLO Cc1ccc2[nH+]c(CSc3nccc(C(C)(C)C)n3)cn2c1 ZINC001459292132 1062069862 /nfs/dbraw/zinc/06/98/62/1062069862.db2.gz NXTLDYJTFPAAFF-UHFFFAOYSA-N 1 2 312.442 4.023 20 0 DIADLO CC(C)N(C)c1ccc(C[N@H+](C)Cc2ccccc2Cl)cn1 ZINC001474413125 1062078577 /nfs/dbraw/zinc/07/85/77/1062078577.db2.gz VRNWXOIFVWMSKT-UHFFFAOYSA-N 1 2 317.864 4.212 20 0 DIADLO CC(C)N(C)c1ccc(C[N@@H+](C)Cc2ccccc2Cl)cn1 ZINC001474413125 1062078600 /nfs/dbraw/zinc/07/86/00/1062078600.db2.gz VRNWXOIFVWMSKT-UHFFFAOYSA-N 1 2 317.864 4.212 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1cc(F)ncc1F ZINC001474413545 1062084272 /nfs/dbraw/zinc/08/42/72/1062084272.db2.gz OGWNLHQYXWZZQC-NSHDSACASA-N 1 2 302.324 4.299 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1cc(F)ncc1F ZINC001474413545 1062084300 /nfs/dbraw/zinc/08/43/00/1062084300.db2.gz OGWNLHQYXWZZQC-NSHDSACASA-N 1 2 302.324 4.299 20 0 DIADLO Cc1ccc([C@@H](CC(F)(F)F)[NH2+]Cc2ncccc2F)cc1 ZINC001474419526 1062090497 /nfs/dbraw/zinc/09/04/97/1062090497.db2.gz JTPNHWGYXUKHRQ-CQSZACIVSA-N 1 2 312.310 4.312 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)n1 ZINC001459328518 1062094358 /nfs/dbraw/zinc/09/43/58/1062094358.db2.gz DYKLYKXPAZEKLC-OAHLLOKOSA-N 1 2 302.393 4.448 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)n1 ZINC001459328518 1062094374 /nfs/dbraw/zinc/09/43/74/1062094374.db2.gz DYKLYKXPAZEKLC-OAHLLOKOSA-N 1 2 302.393 4.448 20 0 DIADLO CCC[N@H+](CC(=O)OC(C)(C)C)Cc1cc(C)cc(Cl)c1 ZINC001474425997 1062097704 /nfs/dbraw/zinc/09/77/04/1062097704.db2.gz OOCIKZAAHWDCFG-UHFFFAOYSA-N 1 2 311.853 4.202 20 0 DIADLO CCC[N@@H+](CC(=O)OC(C)(C)C)Cc1cc(C)cc(Cl)c1 ZINC001474425997 1062097722 /nfs/dbraw/zinc/09/77/22/1062097722.db2.gz OOCIKZAAHWDCFG-UHFFFAOYSA-N 1 2 311.853 4.202 20 0 DIADLO Fc1cccnc1CNc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC001474479896 1062156814 /nfs/dbraw/zinc/15/68/14/1062156814.db2.gz TUPXRILOJWYVAA-UHFFFAOYSA-N 1 2 322.387 4.033 20 0 DIADLO Cc1nn(C(C)C)c(C)c1C[N@H+](C)Cc1cc(C)ccc1F ZINC001474479711 1062156904 /nfs/dbraw/zinc/15/69/04/1062156904.db2.gz AIYBQKZITQQBQV-UHFFFAOYSA-N 1 2 303.425 4.160 20 0 DIADLO Cc1nn(C(C)C)c(C)c1C[N@@H+](C)Cc1cc(C)ccc1F ZINC001474479711 1062156911 /nfs/dbraw/zinc/15/69/11/1062156911.db2.gz AIYBQKZITQQBQV-UHFFFAOYSA-N 1 2 303.425 4.160 20 0 DIADLO COC1(c2ccccc2)C[NH+](Cc2cc(C(C)(C)C)oc2C)C1 ZINC001474504393 1062189119 /nfs/dbraw/zinc/18/91/19/1062189119.db2.gz BOTXDAHILUQZNC-UHFFFAOYSA-N 1 2 313.441 4.243 20 0 DIADLO C[C@@H]1CC[C@@H](c2ccccc2)[N@H+](Cc2cc(C(F)(F)F)n[nH]2)C1 ZINC001474518537 1062201730 /nfs/dbraw/zinc/20/17/30/1062201730.db2.gz ZIVLZUWOBMKXQG-DOMZBBRYSA-N 1 2 323.362 4.402 20 0 DIADLO C[C@@H]1CC[C@@H](c2ccccc2)[N@@H+](Cc2cc(C(F)(F)F)n[nH]2)C1 ZINC001474518537 1062201751 /nfs/dbraw/zinc/20/17/51/1062201751.db2.gz ZIVLZUWOBMKXQG-DOMZBBRYSA-N 1 2 323.362 4.402 20 0 DIADLO Clc1sc(C[N@@H+]2CC[C@@H]2C2CC2)cc1Br ZINC001474536356 1062221801 /nfs/dbraw/zinc/22/18/01/1062221801.db2.gz GKSKXLLBJCUUML-SNVBAGLBSA-N 1 2 306.656 4.148 20 0 DIADLO Clc1sc(C[N@H+]2CC[C@@H]2C2CC2)cc1Br ZINC001474536356 1062221822 /nfs/dbraw/zinc/22/18/22/1062221822.db2.gz GKSKXLLBJCUUML-SNVBAGLBSA-N 1 2 306.656 4.148 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2c(Cl)ccnc2Cl)c2ccccc2O1 ZINC001474535388 1062221856 /nfs/dbraw/zinc/22/18/56/1062221856.db2.gz DBPAVPFHAWPZAR-QMTHXVAHSA-N 1 2 323.223 4.390 20 0 DIADLO CC(C)C[C@@H]1COCC[N@@H+]1CCc1c(Cl)cccc1Cl ZINC001459602746 1062234720 /nfs/dbraw/zinc/23/47/20/1062234720.db2.gz ULNKSDUGXMTBTE-CYBMUJFWSA-N 1 2 316.272 4.283 20 0 DIADLO CC(C)C[C@@H]1COCC[N@H+]1CCc1c(Cl)cccc1Cl ZINC001459602746 1062234731 /nfs/dbraw/zinc/23/47/31/1062234731.db2.gz ULNKSDUGXMTBTE-CYBMUJFWSA-N 1 2 316.272 4.283 20 0 DIADLO CCO[C@@H]1C[C@H]([N@H+](C)Cc2c(Cl)cncc2Cl)C1(C)C ZINC001459633103 1062268030 /nfs/dbraw/zinc/26/80/30/1062268030.db2.gz ZMLSLPBVLWHEQT-UONOGXRCSA-N 1 2 317.260 4.024 20 0 DIADLO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2c(Cl)cncc2Cl)C1(C)C ZINC001459633103 1062268053 /nfs/dbraw/zinc/26/80/53/1062268053.db2.gz ZMLSLPBVLWHEQT-UONOGXRCSA-N 1 2 317.260 4.024 20 0 DIADLO Cn1ncc(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)c1Cl ZINC001474566594 1062273515 /nfs/dbraw/zinc/27/35/15/1062273515.db2.gz NNYNMJFXWAHSHM-INIZCTEOSA-N 1 2 315.848 4.191 20 0 DIADLO Cn1ncc(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)c1Cl ZINC001474566594 1062273530 /nfs/dbraw/zinc/27/35/30/1062273530.db2.gz NNYNMJFXWAHSHM-INIZCTEOSA-N 1 2 315.848 4.191 20 0 DIADLO Fc1cncc(F)c1C[N@@H+]1C[C@@H]2CCCC[C@@]21c1ccccc1 ZINC001459677111 1062299641 /nfs/dbraw/zinc/29/96/41/1062299641.db2.gz OBNIWBUQEJACES-HNAYVOBHSA-N 1 2 314.379 4.261 20 0 DIADLO Fc1cncc(F)c1C[N@H+]1C[C@@H]2CCCC[C@@]21c1ccccc1 ZINC001459677111 1062299663 /nfs/dbraw/zinc/29/96/63/1062299663.db2.gz OBNIWBUQEJACES-HNAYVOBHSA-N 1 2 314.379 4.261 20 0 DIADLO Clc1cc2c(s1)CC[N@H+](Cc1ccc3c(c1)CCCO3)C2 ZINC001474598387 1062312510 /nfs/dbraw/zinc/31/25/10/1062312510.db2.gz BVTTWWHRIOFMRG-UHFFFAOYSA-N 1 2 319.857 4.285 20 0 DIADLO Clc1cc2c(s1)CC[N@@H+](Cc1ccc3c(c1)CCCO3)C2 ZINC001474598387 1062312529 /nfs/dbraw/zinc/31/25/29/1062312529.db2.gz BVTTWWHRIOFMRG-UHFFFAOYSA-N 1 2 319.857 4.285 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@@H+]2CCc3nc[nH]c3C23CCC3)cc1C ZINC001474599570 1062312613 /nfs/dbraw/zinc/31/26/13/1062312613.db2.gz XGLALGFYHXWSMU-XQRVVYSFSA-N 1 2 321.468 4.286 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@H+]2CCc3nc[nH]c3C23CCC3)cc1C ZINC001474599570 1062312621 /nfs/dbraw/zinc/31/26/21/1062312621.db2.gz XGLALGFYHXWSMU-XQRVVYSFSA-N 1 2 321.468 4.286 20 0 DIADLO CCCc1ccc(C[N@H+](C)[C@H](CC)C(=O)OC(C)(C)C)s1 ZINC001474607792 1062321681 /nfs/dbraw/zinc/32/16/81/1062321681.db2.gz FTLXBOQZXYWEDS-OAHLLOKOSA-N 1 2 311.491 4.253 20 0 DIADLO CCCc1ccc(C[N@@H+](C)[C@H](CC)C(=O)OC(C)(C)C)s1 ZINC001474607792 1062321694 /nfs/dbraw/zinc/32/16/94/1062321694.db2.gz FTLXBOQZXYWEDS-OAHLLOKOSA-N 1 2 311.491 4.253 20 0 DIADLO CO[C@H](c1ccccc1)[C@@H](C)[NH2+]CC(F)(F)c1cccc(F)c1 ZINC001474618355 1062337847 /nfs/dbraw/zinc/33/78/47/1062337847.db2.gz SLOGJEXETUXLDU-DYVFJYSZSA-N 1 2 323.358 4.283 20 0 DIADLO CO[C@@H](c1ccccc1)[C@H](C)[NH2+]CC(F)(F)c1cccc(F)c1 ZINC001474618408 1062338886 /nfs/dbraw/zinc/33/88/86/1062338886.db2.gz SLOGJEXETUXLDU-SUMWQHHRSA-N 1 2 323.358 4.283 20 0 DIADLO C[N@H+](Cc1cnc[nH]1)Cc1ccc(Sc2ccccc2)cc1 ZINC001474621916 1062341746 /nfs/dbraw/zinc/34/17/46/1062341746.db2.gz XLMJYBJAQYIRJW-UHFFFAOYSA-N 1 2 309.438 4.193 20 0 DIADLO C[N@@H+](Cc1cnc[nH]1)Cc1ccc(Sc2ccccc2)cc1 ZINC001474621916 1062341765 /nfs/dbraw/zinc/34/17/65/1062341765.db2.gz XLMJYBJAQYIRJW-UHFFFAOYSA-N 1 2 309.438 4.193 20 0 DIADLO C[N@H+](Cc1c[nH]cn1)Cc1ccc(Sc2ccccc2)cc1 ZINC001474621916 1062341785 /nfs/dbraw/zinc/34/17/85/1062341785.db2.gz XLMJYBJAQYIRJW-UHFFFAOYSA-N 1 2 309.438 4.193 20 0 DIADLO C[N@@H+](Cc1c[nH]cn1)Cc1ccc(Sc2ccccc2)cc1 ZINC001474621916 1062341803 /nfs/dbraw/zinc/34/18/03/1062341803.db2.gz XLMJYBJAQYIRJW-UHFFFAOYSA-N 1 2 309.438 4.193 20 0 DIADLO Fc1ccc(CCNc2c[nH+]cc3c2CCCC3)c(Cl)c1 ZINC001474624276 1062347141 /nfs/dbraw/zinc/34/71/41/1062347141.db2.gz PCVPDTDSNQGYHV-UHFFFAOYSA-N 1 2 304.796 4.408 20 0 DIADLO CCC[C@@H]1CCC[N@@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001459738494 1062352143 /nfs/dbraw/zinc/35/21/43/1062352143.db2.gz DOJGNVWLAYRVMC-CZUORRHYSA-N 1 2 309.837 4.066 20 0 DIADLO CCC[C@@H]1CCC[N@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001459738494 1062352160 /nfs/dbraw/zinc/35/21/60/1062352160.db2.gz DOJGNVWLAYRVMC-CZUORRHYSA-N 1 2 309.837 4.066 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC001474635756 1062361281 /nfs/dbraw/zinc/36/12/81/1062361281.db2.gz DSUAJSTZEFDUFX-DIFFPNOSSA-N 1 2 315.404 4.130 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC001474635756 1062361303 /nfs/dbraw/zinc/36/13/03/1062361303.db2.gz DSUAJSTZEFDUFX-DIFFPNOSSA-N 1 2 315.404 4.130 20 0 DIADLO CCCC[C@H](C)N(C)C(=O)[C@H]1CC[C@@H](Nc2cccc[nH+]2)CC1 ZINC001468691873 1062382080 /nfs/dbraw/zinc/38/20/80/1062382080.db2.gz HXPLFAPRUGRWQC-YESZJQIVSA-N 1 2 317.477 4.089 20 0 DIADLO Cc1nc(C[N@@H+]2[C@@H](C)Cc3cc(F)ccc3[C@@H]2C)sc1C ZINC001459772980 1062389836 /nfs/dbraw/zinc/38/98/36/1062389836.db2.gz FEHOESZYZSDWME-JQWIXIFHSA-N 1 2 304.434 4.407 20 0 DIADLO Cc1nc(C[N@H+]2[C@@H](C)Cc3cc(F)ccc3[C@@H]2C)sc1C ZINC001459772980 1062389852 /nfs/dbraw/zinc/38/98/52/1062389852.db2.gz FEHOESZYZSDWME-JQWIXIFHSA-N 1 2 304.434 4.407 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+](Cc1ccccc1F)C1CCCCC1 ZINC001459786125 1062398342 /nfs/dbraw/zinc/39/83/42/1062398342.db2.gz JZIXPPIGGACJHL-OAHLLOKOSA-N 1 2 321.436 4.302 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+](Cc1ccccc1F)C1CCCCC1 ZINC001459786125 1062398363 /nfs/dbraw/zinc/39/83/63/1062398363.db2.gz JZIXPPIGGACJHL-OAHLLOKOSA-N 1 2 321.436 4.302 20 0 DIADLO CCSCc1ccc[nH+]c1NC[C@@H](OC)C1CCCCC1 ZINC001474680610 1062414231 /nfs/dbraw/zinc/41/42/31/1062414231.db2.gz ZEWXALUXVGLDDQ-MRXNPFEDSA-N 1 2 308.491 4.342 20 0 DIADLO CCC[C@H]([NH2+]CC(=O)c1ccccc1F)c1ccc(F)cc1F ZINC001459819780 1062426319 /nfs/dbraw/zinc/42/63/19/1062426319.db2.gz VEVWFPRKONECCT-KRWDZBQOSA-N 1 2 321.342 4.418 20 0 DIADLO Fc1cccc(Oc2ccc(C[N@@H+]3CCn4cccc4C3)cc2)c1 ZINC001474701630 1062429466 /nfs/dbraw/zinc/42/94/66/1062429466.db2.gz IGMYJIMLPDBUBY-UHFFFAOYSA-N 1 2 322.383 4.435 20 0 DIADLO Fc1cccc(Oc2ccc(C[N@H+]3CCn4cccc4C3)cc2)c1 ZINC001474701630 1062429477 /nfs/dbraw/zinc/42/94/77/1062429477.db2.gz IGMYJIMLPDBUBY-UHFFFAOYSA-N 1 2 322.383 4.435 20 0 DIADLO Cc1cccc(C2=CC[N@H+](Cc3nccn3C3CC3)CC2)c1C ZINC001474745150 1062460333 /nfs/dbraw/zinc/46/03/33/1062460333.db2.gz CVPDXDQXZOAHNL-UHFFFAOYSA-N 1 2 307.441 4.124 20 0 DIADLO Cc1cccc(C2=CC[N@@H+](Cc3nccn3C3CC3)CC2)c1C ZINC001474745150 1062460342 /nfs/dbraw/zinc/46/03/42/1062460342.db2.gz CVPDXDQXZOAHNL-UHFFFAOYSA-N 1 2 307.441 4.124 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@H+]1Cc1ccc2cnccc2c1 ZINC001459883078 1062470215 /nfs/dbraw/zinc/47/02/15/1062470215.db2.gz PLFPNDFQTAJGFF-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@@H+]1Cc1ccc2cnccc2c1 ZINC001459883078 1062470225 /nfs/dbraw/zinc/47/02/25/1062470225.db2.gz PLFPNDFQTAJGFF-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2Cc3ccccc3OC[C@@H]2C)c1 ZINC001459931946 1062504680 /nfs/dbraw/zinc/50/46/80/1062504680.db2.gz HSBADNMPNURSPC-ZDUSSCGKSA-N 1 2 317.816 4.132 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2Cc3ccccc3OC[C@@H]2C)c1 ZINC001459931946 1062504701 /nfs/dbraw/zinc/50/47/01/1062504701.db2.gz HSBADNMPNURSPC-ZDUSSCGKSA-N 1 2 317.816 4.132 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1c(F)cncc1F ZINC001459940106 1062511480 /nfs/dbraw/zinc/51/14/80/1062511480.db2.gz TZOCWEXHFFXWLZ-LLVKDONJSA-N 1 2 302.324 4.265 20 0 DIADLO Fc1ccccc1OC1C[NH+]([C@@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC001255717420 1062536625 /nfs/dbraw/zinc/53/66/25/1062536625.db2.gz MEYFFMARYCCMAH-VXGBXAGGSA-N 1 2 317.326 4.010 20 0 DIADLO CC(C)=CC[N@@H+](Cc1nn(C)cc1C)Cc1ccc(Cl)cc1 ZINC001460007099 1062564224 /nfs/dbraw/zinc/56/42/24/1062564224.db2.gz HAWJZIRUWPOSTM-UHFFFAOYSA-N 1 2 317.864 4.350 20 0 DIADLO CC(C)=CC[N@H+](Cc1nn(C)cc1C)Cc1ccc(Cl)cc1 ZINC001460007099 1062564247 /nfs/dbraw/zinc/56/42/47/1062564247.db2.gz HAWJZIRUWPOSTM-UHFFFAOYSA-N 1 2 317.864 4.350 20 0 DIADLO CCOC(=O)[C@@H](CC)[NH2+][C@H]1CC(C)(C)CCc2ccccc21 ZINC001460009221 1062566658 /nfs/dbraw/zinc/56/66/58/1062566658.db2.gz WWVUDXXFOGWBQO-SJORKVTESA-N 1 2 303.446 4.022 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+]([C@@H](C)CSc1ccc(F)cc1)C2 ZINC001255746222 1062567703 /nfs/dbraw/zinc/56/77/03/1062567703.db2.gz FPQSZHVUSGQJRN-ZDUSSCGKSA-N 1 2 302.418 4.026 20 0 DIADLO Cc1cc2c(cn1)C[N@H+]([C@@H](C)CSc1ccc(F)cc1)C2 ZINC001255746222 1062567721 /nfs/dbraw/zinc/56/77/21/1062567721.db2.gz FPQSZHVUSGQJRN-ZDUSSCGKSA-N 1 2 302.418 4.026 20 0 DIADLO Cc1ccc(SC[C@H](C)[N@@H+]2CCC(F)(F)[C@H](F)C2)cc1 ZINC001255765175 1062584959 /nfs/dbraw/zinc/58/49/59/1062584959.db2.gz KCQPYDQRAQNWMJ-GXTWGEPZSA-N 1 2 303.393 4.155 20 0 DIADLO Cc1ccc(SC[C@H](C)[N@H+]2CCC(F)(F)[C@H](F)C2)cc1 ZINC001255765175 1062584974 /nfs/dbraw/zinc/58/49/74/1062584974.db2.gz KCQPYDQRAQNWMJ-GXTWGEPZSA-N 1 2 303.393 4.155 20 0 DIADLO Cc1ccc(SC[C@@H](C)[N@@H+]2CCC(F)(F)[C@@H](F)C2)cc1 ZINC001255765179 1062585529 /nfs/dbraw/zinc/58/55/29/1062585529.db2.gz KCQPYDQRAQNWMJ-OCCSQVGLSA-N 1 2 303.393 4.155 20 0 DIADLO Cc1ccc(SC[C@@H](C)[N@H+]2CCC(F)(F)[C@@H](F)C2)cc1 ZINC001255765179 1062585545 /nfs/dbraw/zinc/58/55/45/1062585545.db2.gz KCQPYDQRAQNWMJ-OCCSQVGLSA-N 1 2 303.393 4.155 20 0 DIADLO Cc1cn(C)nc1C[N@@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC001460033170 1062587345 /nfs/dbraw/zinc/58/73/45/1062587345.db2.gz WTMDZSHLXQUDAQ-KRWDZBQOSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1cn(C)nc1C[N@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC001460033170 1062587361 /nfs/dbraw/zinc/58/73/61/1062587361.db2.gz WTMDZSHLXQUDAQ-KRWDZBQOSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1cn2cc(NC(=O)NCCCC3CCCCC3)ccc2[nH+]1 ZINC001476102970 1062588301 /nfs/dbraw/zinc/58/83/01/1062588301.db2.gz YIGOMVUSGWZSRS-UHFFFAOYSA-N 1 2 314.433 4.125 20 0 DIADLO CCC1(CC)[C@H]([NH2+]CC(F)(F)c2ccc(F)cc2)C[C@H]1OC ZINC001460063761 1062609219 /nfs/dbraw/zinc/60/92/19/1062609219.db2.gz IPGDPYMSJPCWCR-HUUCEWRRSA-N 1 2 315.379 4.101 20 0 DIADLO CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1scnc1Cl ZINC001460066252 1062611919 /nfs/dbraw/zinc/61/19/19/1062611919.db2.gz FZEOUSAAXISENK-CYBMUJFWSA-N 1 2 310.850 4.388 20 0 DIADLO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1scnc1Cl ZINC001460066252 1062611935 /nfs/dbraw/zinc/61/19/35/1062611935.db2.gz FZEOUSAAXISENK-CYBMUJFWSA-N 1 2 310.850 4.388 20 0 DIADLO CC(C)(C)c1cccc(OCCC[N@@H+]2Cc3ccncc3C2)c1 ZINC001460074479 1062618808 /nfs/dbraw/zinc/61/88/08/1062618808.db2.gz GTTXFJSEJBOJTH-UHFFFAOYSA-N 1 2 310.441 4.164 20 0 DIADLO CC(C)(C)c1cccc(OCCC[N@H+]2Cc3ccncc3C2)c1 ZINC001460074479 1062618816 /nfs/dbraw/zinc/61/88/16/1062618816.db2.gz GTTXFJSEJBOJTH-UHFFFAOYSA-N 1 2 310.441 4.164 20 0 DIADLO Cc1cc(NC(=O)N[C@@H]2CCC[C@H](C(C)(C)C)CC2)c(C)c[nH+]1 ZINC001476303928 1062627685 /nfs/dbraw/zinc/62/76/85/1062627685.db2.gz VMYXSXANXRRCET-JKSUJKDBSA-N 1 2 317.477 4.237 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)c(Cl)s1 ZINC001460096916 1062633544 /nfs/dbraw/zinc/63/35/44/1062633544.db2.gz ZWAORZXUPXRQHL-GHMZBOCLSA-N 1 2 306.258 4.198 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c(Cl)s1 ZINC001460096916 1062633558 /nfs/dbraw/zinc/63/35/58/1062633558.db2.gz ZWAORZXUPXRQHL-GHMZBOCLSA-N 1 2 306.258 4.198 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(Cl)c2Cl)[C@H]1[C@@H]1CCCO1 ZINC001460193830 1062693630 /nfs/dbraw/zinc/69/36/30/1062693630.db2.gz FCHFJOPGRGBAIJ-ZFWWWQNUSA-N 1 2 314.256 4.383 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(Cl)c2Cl)[C@H]1[C@@H]1CCCO1 ZINC001460193830 1062693637 /nfs/dbraw/zinc/69/36/37/1062693637.db2.gz FCHFJOPGRGBAIJ-ZFWWWQNUSA-N 1 2 314.256 4.383 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H](C3CCC3)CC2)c(C)[nH+]1 ZINC001476698829 1062703307 /nfs/dbraw/zinc/70/33/07/1062703307.db2.gz MHHMAYGGKWFPPP-QGZVFWFLSA-N 1 2 315.461 4.441 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCCCC[C@H]2C(C)C)c(C)[nH+]1 ZINC001476697615 1062703406 /nfs/dbraw/zinc/70/34/06/1062703406.db2.gz CNPMRETZRZYNPT-INIZCTEOSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1cc(F)cc(C(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)c1 ZINC001460270732 1062744672 /nfs/dbraw/zinc/74/46/72/1062744672.db2.gz FHCSOZWFLXZGJQ-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO CCCCC[C@H]1CCCCN1C(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001470393931 1062770971 /nfs/dbraw/zinc/77/09/71/1062770971.db2.gz JFRLDYUEPUNKNJ-ROUUACIJSA-N 1 2 319.493 4.432 20 0 DIADLO CCCCCCc1nnc(-c2cccc(-c3c[nH+]cn3C)c2)o1 ZINC001256395311 1062802918 /nfs/dbraw/zinc/80/29/18/1062802918.db2.gz GMKSGHCHDSUFHM-UHFFFAOYSA-N 1 2 310.401 4.260 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+]1CCc2ccc(C(C)C)cc2C1 ZINC001460368728 1062818041 /nfs/dbraw/zinc/81/80/41/1062818041.db2.gz ZIVHXIWFWNTBKZ-SFHVURJKSA-N 1 2 317.473 4.288 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@H+]1CCc2ccc(C(C)C)cc2C1 ZINC001460368728 1062818070 /nfs/dbraw/zinc/81/80/70/1062818070.db2.gz ZIVHXIWFWNTBKZ-SFHVURJKSA-N 1 2 317.473 4.288 20 0 DIADLO CCC1(CC)CCC[N@@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001460414447 1062844276 /nfs/dbraw/zinc/84/42/76/1062844276.db2.gz HGLMKPYLNZAPEM-INIZCTEOSA-N 1 2 323.864 4.456 20 0 DIADLO CCC1(CC)CCC[N@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001460414447 1062844305 /nfs/dbraw/zinc/84/43/05/1062844305.db2.gz HGLMKPYLNZAPEM-INIZCTEOSA-N 1 2 323.864 4.456 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC001460470299 1062869169 /nfs/dbraw/zinc/86/91/69/1062869169.db2.gz VKUCBLZIDBTRJQ-UEKVPHQBSA-N 1 2 303.780 4.146 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC001460470299 1062869189 /nfs/dbraw/zinc/86/91/89/1062869189.db2.gz VKUCBLZIDBTRJQ-UEKVPHQBSA-N 1 2 303.780 4.146 20 0 DIADLO CC1(C)CC[C@H](CO)[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001460490843 1062881244 /nfs/dbraw/zinc/88/12/44/1062881244.db2.gz OSCXLAZNKZHWTC-GFCCVEGCSA-N 1 2 320.235 4.115 20 0 DIADLO CC1(C)CC[C@H](CO)[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001460490843 1062881261 /nfs/dbraw/zinc/88/12/61/1062881261.db2.gz OSCXLAZNKZHWTC-GFCCVEGCSA-N 1 2 320.235 4.115 20 0 DIADLO C[C@@H]1c2ccccc2C[N@H+]1CC(=O)NCCCC1CCCCC1 ZINC001460510649 1062889799 /nfs/dbraw/zinc/88/97/99/1062889799.db2.gz PVUXEZJKALIRMB-MRXNPFEDSA-N 1 2 314.473 4.040 20 0 DIADLO C[C@@H]1c2ccccc2C[N@@H+]1CC(=O)NCCCC1CCCCC1 ZINC001460510649 1062889821 /nfs/dbraw/zinc/88/98/21/1062889821.db2.gz PVUXEZJKALIRMB-MRXNPFEDSA-N 1 2 314.473 4.040 20 0 DIADLO CN(C)c1cc(CN2C[C@H](C(C)(C)C)Cc3ccccc32)cc[nH+]1 ZINC001460617485 1062935717 /nfs/dbraw/zinc/93/57/17/1062935717.db2.gz RFHMLZZSVZHVAP-GOSISDBHSA-N 1 2 323.484 4.373 20 0 DIADLO C[C@@H]1C[C@H]1c1nnc([C@@H](c2ccc(Cl)cc2)[NH+]2CCCC2)o1 ZINC001256681772 1062943721 /nfs/dbraw/zinc/94/37/21/1062943721.db2.gz DJVGLJRZRIKWIX-KCPJHIHWSA-N 1 2 317.820 4.032 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3C[C@@H]3C3CCCC3)cc2)[nH+]c1C ZINC001471593757 1063006427 /nfs/dbraw/zinc/00/64/27/1063006427.db2.gz RCCHONBFILCWSJ-QZTJIDSGSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C(C)(C)C(C)(F)F)cc2)[nH+]c1C ZINC001471593769 1063006976 /nfs/dbraw/zinc/00/69/76/1063006976.db2.gz REIDOILAACIUPI-UHFFFAOYSA-N 1 2 321.371 4.313 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3C[C@@H]3C3CCCC3)cc2)[nH+]c1C ZINC001471593752 1063007790 /nfs/dbraw/zinc/00/77/90/1063007790.db2.gz RCCHONBFILCWSJ-MSOLQXFVSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@H](CCC(C)C)C(C)(C)C)c[nH+]1 ZINC001477913156 1063017094 /nfs/dbraw/zinc/01/70/94/1063017094.db2.gz KXDAZRIDDSDDHT-QGZVFWFLSA-N 1 2 319.493 4.349 20 0 DIADLO CSCCCCCCC(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001471860641 1063026500 /nfs/dbraw/zinc/02/65/00/1063026500.db2.gz PPNREPGGUYUTOD-OAHLLOKOSA-N 1 2 323.506 4.004 20 0 DIADLO CSCCCCCCC(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001471860638 1063026930 /nfs/dbraw/zinc/02/69/30/1063026930.db2.gz PPNREPGGUYUTOD-HNNXBMFYSA-N 1 2 323.506 4.004 20 0 DIADLO CCN(Cc1ccc(-n2cc[nH+]c2)cc1)c1ccc(F)c(C)c1 ZINC001460732676 1063029178 /nfs/dbraw/zinc/02/91/78/1063029178.db2.gz IVLGGBQHGKOSOL-UHFFFAOYSA-N 1 2 309.388 4.346 20 0 DIADLO CC[N@@H+]1CCCC[C@@H]1C(=O)Nc1ncc(C2CCCCC2)s1 ZINC001472543512 1063101221 /nfs/dbraw/zinc/10/12/21/1063101221.db2.gz XCYOKCOLCRJMCD-CQSZACIVSA-N 1 2 321.490 4.004 20 0 DIADLO CC[N@H+]1CCCC[C@@H]1C(=O)Nc1ncc(C2CCCCC2)s1 ZINC001472543512 1063101231 /nfs/dbraw/zinc/10/12/31/1063101231.db2.gz XCYOKCOLCRJMCD-CQSZACIVSA-N 1 2 321.490 4.004 20 0 DIADLO Cc1ccc2c(ccc(C)c2C(=O)NCc2c[nH+]c(C)cc2C)c1 ZINC001460890335 1063117026 /nfs/dbraw/zinc/11/70/26/1063117026.db2.gz IYTBEOMDBGYIEI-UHFFFAOYSA-N 1 2 318.420 4.398 20 0 DIADLO Cc1cc(NCCc2ccc(Cl)s2)nc(C2CCC2)[nH+]1 ZINC001472661275 1063129652 /nfs/dbraw/zinc/12/96/52/1063129652.db2.gz PSXUETAIHWIZRY-UHFFFAOYSA-N 1 2 307.850 4.422 20 0 DIADLO CCc1cc(NCCc2nc(C(C)(C)C)cs2)nc(CC)[nH+]1 ZINC001472689657 1063152440 /nfs/dbraw/zinc/15/24/40/1063152440.db2.gz UIXLIHKEBUKTBO-UHFFFAOYSA-N 1 2 318.490 4.010 20 0 DIADLO CCC[C@H](CC)[NH2+][C@@H](Cc1ccc2ccccc2c1)C(=O)OC ZINC001257253001 1063159859 /nfs/dbraw/zinc/15/98/59/1063159859.db2.gz JCESFYGVQKFFNG-OALUTQOASA-N 1 2 313.441 4.092 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(Nc3ccc(C)c(OC(F)F)c3)c12 ZINC001472704425 1063165633 /nfs/dbraw/zinc/16/56/33/1063165633.db2.gz YQIANOCGBIJXSA-UHFFFAOYSA-N 1 2 318.327 4.174 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@@H+]1CCc3cc(F)cc(F)c3C1)CC2 ZINC001460974266 1063166541 /nfs/dbraw/zinc/16/65/41/1063166541.db2.gz POVYDDMEFWLIKA-SFHVURJKSA-N 1 2 303.327 4.150 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@H+]1CCc3cc(F)cc(F)c3C1)CC2 ZINC001460974266 1063166555 /nfs/dbraw/zinc/16/65/55/1063166555.db2.gz POVYDDMEFWLIKA-SFHVURJKSA-N 1 2 303.327 4.150 20 0 DIADLO CCc1cc(NC[C@H](C)Oc2ccc(Cl)cc2)nc(CC)[nH+]1 ZINC001472706571 1063167215 /nfs/dbraw/zinc/16/72/15/1063167215.db2.gz MOXUIYVEHCKVKW-LBPRGKRZSA-N 1 2 319.836 4.134 20 0 DIADLO Fc1cc(C[NH2+][C@H](c2ccco2)c2ccccc2)cnc1Cl ZINC001461015077 1063189480 /nfs/dbraw/zinc/18/94/80/1063189480.db2.gz GAWQCYCLCXQDSE-INIZCTEOSA-N 1 2 316.763 4.346 20 0 DIADLO Cc1cc(CNC(=O)C2(c3ccccc3C)CCCC2)cc(C)[nH+]1 ZINC001461012649 1063189610 /nfs/dbraw/zinc/18/96/10/1063189610.db2.gz YNQQSPPFPCULRK-UHFFFAOYSA-N 1 2 322.452 4.135 20 0 DIADLO CC[C@H](C)n1nc(Nc2nc3ccccc3n3c[nH+]cc23)cc1C ZINC001472741687 1063200290 /nfs/dbraw/zinc/20/02/90/1063200290.db2.gz JDUUFAZCMADHQX-LBPRGKRZSA-N 1 2 320.400 4.102 20 0 DIADLO Cc1nc(N[C@H](C)c2cc(Cl)ccc2OC(F)F)cc[nH+]1 ZINC001472745154 1063202043 /nfs/dbraw/zinc/20/20/43/1063202043.db2.gz OLILTKXAKNUUIW-MRVPVSSYSA-N 1 2 313.735 4.213 20 0 DIADLO CCC[C@@H](C)[N@@H+]1CCn2cc(-c3ccc(F)cc3)nc2C1(C)C ZINC001257323497 1063206443 /nfs/dbraw/zinc/20/64/43/1063206443.db2.gz CJEVVKDJIAQWRJ-CQSZACIVSA-N 1 2 315.436 4.429 20 0 DIADLO CCC[C@@H](C)[N@H+]1CCn2cc(-c3ccc(F)cc3)nc2C1(C)C ZINC001257323497 1063206464 /nfs/dbraw/zinc/20/64/64/1063206464.db2.gz CJEVVKDJIAQWRJ-CQSZACIVSA-N 1 2 315.436 4.429 20 0 DIADLO CCc1cc(N2CC[C@H]2c2ccc(Cl)cc2)nc(CC)[nH+]1 ZINC001472778357 1063227548 /nfs/dbraw/zinc/22/75/48/1063227548.db2.gz FSLCVGAPELVONR-HNNXBMFYSA-N 1 2 301.821 4.206 20 0 DIADLO CC(C)Oc1ccc(NCc2cc(-n3cc[nH+]c3)cs2)cc1 ZINC001461076523 1063237468 /nfs/dbraw/zinc/23/74/68/1063237468.db2.gz XRTMMPVXNOFWRI-UHFFFAOYSA-N 1 2 313.426 4.333 20 0 DIADLO c1c2ccccc2oc1CNc1ccc(N2CCCCC2)c[nH+]1 ZINC001461080205 1063240036 /nfs/dbraw/zinc/24/00/36/1063240036.db2.gz ZYWIZZFJLPYBOP-UHFFFAOYSA-N 1 2 307.397 4.430 20 0 DIADLO CC[C@H]1CCCC[C@H]1CNc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001472793094 1063241278 /nfs/dbraw/zinc/24/12/78/1063241278.db2.gz IVNLFKHHPXVOQD-KBPBESRZSA-N 1 2 315.465 4.210 20 0 DIADLO CC[C@H]1CCCC[C@@H]1CNc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001472793096 1063242416 /nfs/dbraw/zinc/24/24/16/1063242416.db2.gz IVNLFKHHPXVOQD-UONOGXRCSA-N 1 2 315.465 4.210 20 0 DIADLO Cc1ccc2ncc(CNc3ccc([NH+]4CCCC4)cc3C)n2c1 ZINC001461086042 1063244909 /nfs/dbraw/zinc/24/49/09/1063244909.db2.gz YQKLWTXBGQTLPM-UHFFFAOYSA-N 1 2 320.440 4.163 20 0 DIADLO CC(C)c1cc(NC[C@@H]2CCc3cccnc32)nc(C(C)C)[nH+]1 ZINC001472818451 1063262504 /nfs/dbraw/zinc/26/25/04/1063262504.db2.gz KWRMYWMUMVMKKU-HNNXBMFYSA-N 1 2 310.445 4.260 20 0 DIADLO C[C@H]1C[C@H](CNc2[nH+]cnc3c2cnn3C(C)(C)C)C[C@@H](C)C1 ZINC001472826741 1063269865 /nfs/dbraw/zinc/26/98/65/1063269865.db2.gz HFPXNSVUVSBKCR-WDNDVIMCSA-N 1 2 315.465 4.066 20 0 DIADLO Cc1cc(NC[C@@H]2C[C@H](c3ccccc3)CO2)nc(C2CCC2)[nH+]1 ZINC001472833530 1063272586 /nfs/dbraw/zinc/27/25/86/1063272586.db2.gz POCYPTGOBQLUOC-ROUUACIJSA-N 1 2 323.440 4.037 20 0 DIADLO CC[C@H](Nc1nc(C)[nH+]c2c1CCCC2)c1ccccc1OC ZINC001472860011 1063287491 /nfs/dbraw/zinc/28/74/91/1063287491.db2.gz TXMSSQGERMRFAN-INIZCTEOSA-N 1 2 311.429 4.236 20 0 DIADLO CC(C)c1cc(NCC2(C3(O)CCC3)CCC2)nc(C(C)C)[nH+]1 ZINC001472876451 1063295416 /nfs/dbraw/zinc/29/54/16/1063295416.db2.gz QZZOMPGGCOMTEL-UHFFFAOYSA-N 1 2 317.477 4.221 20 0 DIADLO CCC[C@@H]1CCCC[C@@H]1CNC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001478818333 1063297955 /nfs/dbraw/zinc/29/79/55/1063297955.db2.gz FRKFFYXLUXXXCW-QZTJIDSGSA-N 1 2 317.477 4.104 20 0 DIADLO CCC[C@H](C)CC[C@@H](C)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001257484014 1063304543 /nfs/dbraw/zinc/30/45/43/1063304543.db2.gz YOCRQLSOTABRTB-QWHCGFSZSA-N 1 2 317.399 4.322 20 0 DIADLO CCC[C@H](C)CC[C@@H](C)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001257484014 1063304564 /nfs/dbraw/zinc/30/45/64/1063304564.db2.gz YOCRQLSOTABRTB-QWHCGFSZSA-N 1 2 317.399 4.322 20 0 DIADLO CCC[C@@H](C)CC[C@H](C)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001257484012 1063304777 /nfs/dbraw/zinc/30/47/77/1063304777.db2.gz YOCRQLSOTABRTB-OLZOCXBDSA-N 1 2 317.399 4.322 20 0 DIADLO CCC[C@@H](C)CC[C@H](C)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001257484012 1063304797 /nfs/dbraw/zinc/30/47/97/1063304797.db2.gz YOCRQLSOTABRTB-OLZOCXBDSA-N 1 2 317.399 4.322 20 0 DIADLO CCC[C@@H](C)CC[C@@H](C)[N@@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001257484872 1063305765 /nfs/dbraw/zinc/30/57/65/1063305765.db2.gz FXJGNQDMCXIRQY-HZPDHXFCSA-N 1 2 319.493 4.155 20 0 DIADLO CCC[C@@H](C)CC[C@@H](C)[N@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001257484872 1063305781 /nfs/dbraw/zinc/30/57/81/1063305781.db2.gz FXJGNQDMCXIRQY-HZPDHXFCSA-N 1 2 319.493 4.155 20 0 DIADLO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OC(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC001473070107 1063384219 /nfs/dbraw/zinc/38/42/19/1063384219.db2.gz QBCVECHFDCJBHP-OAGGEKHMSA-N 1 2 320.477 4.185 20 0 DIADLO CCc1cnc(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)s1 ZINC001461316910 1063414642 /nfs/dbraw/zinc/41/46/42/1063414642.db2.gz VFZOCWQQHXQMBJ-UHFFFAOYSA-N 1 2 318.833 4.157 20 0 DIADLO Brc1cccc([C@@H]2C[N@H+](CCCC3CC3)CCO2)c1 ZINC001473144697 1063450117 /nfs/dbraw/zinc/45/01/17/1063450117.db2.gz OXZROHUPASUAAF-INIZCTEOSA-N 1 2 324.262 4.013 20 0 DIADLO Brc1cccc([C@@H]2C[N@@H+](CCCC3CC3)CCO2)c1 ZINC001473144697 1063450139 /nfs/dbraw/zinc/45/01/39/1063450139.db2.gz OXZROHUPASUAAF-INIZCTEOSA-N 1 2 324.262 4.013 20 0 DIADLO Brc1cccc([C@H]2C[N@H+](CCCC3CC3)CCO2)c1 ZINC001473144698 1063450376 /nfs/dbraw/zinc/45/03/76/1063450376.db2.gz OXZROHUPASUAAF-MRXNPFEDSA-N 1 2 324.262 4.013 20 0 DIADLO Brc1cccc([C@H]2C[N@@H+](CCCC3CC3)CCO2)c1 ZINC001473144698 1063450384 /nfs/dbraw/zinc/45/03/84/1063450384.db2.gz OXZROHUPASUAAF-MRXNPFEDSA-N 1 2 324.262 4.013 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cc(Br)cc(F)c2F)[C@H]1C ZINC001473185506 1063492160 /nfs/dbraw/zinc/49/21/60/1063492160.db2.gz JFRBXOTVJIEJJZ-ZJUUUORDSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cc(Br)cc(F)c2F)[C@H]1C ZINC001473185506 1063492165 /nfs/dbraw/zinc/49/21/65/1063492165.db2.gz JFRBXOTVJIEJJZ-ZJUUUORDSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@@H](Cc1ccco1)[N@H+]1Cc2nc(-c3ccccc3)sc2C1 ZINC001258197519 1063558059 /nfs/dbraw/zinc/55/80/59/1063558059.db2.gz MGPFUJGCNQPCLP-ZDUSSCGKSA-N 1 2 310.422 4.350 20 0 DIADLO C[C@@H](Cc1ccco1)[N@@H+]1Cc2nc(-c3ccccc3)sc2C1 ZINC001258197519 1063558073 /nfs/dbraw/zinc/55/80/73/1063558073.db2.gz MGPFUJGCNQPCLP-ZDUSSCGKSA-N 1 2 310.422 4.350 20 0 DIADLO Cc1ncc(CNc2ccc3[nH]c(-c4ccc(F)cc4)[nH+]c3c2)o1 ZINC001461561101 1063582835 /nfs/dbraw/zinc/58/28/35/1063582835.db2.gz YYOMCARURUVVFC-UHFFFAOYSA-N 1 2 322.343 4.278 20 0 DIADLO CSc1cc(F)ccc1NCc1c[nH+]c2c(C)cccn12 ZINC001461589067 1063596875 /nfs/dbraw/zinc/59/68/75/1063596875.db2.gz BAEJRTXLMGTTKP-UHFFFAOYSA-N 1 2 301.390 4.116 20 0 DIADLO CCCCC(CCCC)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258387165 1063630579 /nfs/dbraw/zinc/63/05/79/1063630579.db2.gz GEVBNVGNVOINFN-UHFFFAOYSA-N 1 2 317.399 4.467 20 0 DIADLO CCCCC(CCCC)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258387165 1063630590 /nfs/dbraw/zinc/63/05/90/1063630590.db2.gz GEVBNVGNVOINFN-UHFFFAOYSA-N 1 2 317.399 4.467 20 0 DIADLO CCCCC[C@H](CC)[N@@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001258441302 1063656445 /nfs/dbraw/zinc/65/64/45/1063656445.db2.gz HYBWSUPOQQBDAR-CVEARBPZSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCC[C@H](CC)[N@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001258441302 1063656450 /nfs/dbraw/zinc/65/64/50/1063656450.db2.gz HYBWSUPOQQBDAR-CVEARBPZSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCC[C@H](CC)[N@H+]1Cc2nnc(C(F)(F)F)n2[C@H](C)C1 ZINC001258443868 1063656865 /nfs/dbraw/zinc/65/68/65/1063656865.db2.gz PCWUTNZSMOSNEN-NEPJUHHUSA-N 1 2 318.387 4.032 20 0 DIADLO CCCCC[C@H](CC)[N@@H+]1Cc2nnc(C(F)(F)F)n2[C@H](C)C1 ZINC001258443868 1063656874 /nfs/dbraw/zinc/65/68/74/1063656874.db2.gz PCWUTNZSMOSNEN-NEPJUHHUSA-N 1 2 318.387 4.032 20 0 DIADLO CCCn1cc(CNc2[nH+]c3ccccc3n2C(C)C)c(C)n1 ZINC001461725154 1063679406 /nfs/dbraw/zinc/67/94/06/1063679406.db2.gz UZFRCKRDCOBUPG-UHFFFAOYSA-N 1 2 311.433 4.144 20 0 DIADLO Fc1ccc(NCc2cccc3[nH+]ccn32)cc1C(F)(F)F ZINC001461728366 1063681895 /nfs/dbraw/zinc/68/18/95/1063681895.db2.gz JASPUKFUIPMPBR-UHFFFAOYSA-N 1 2 309.266 4.104 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1nccn1C(C)C ZINC001461727031 1063682257 /nfs/dbraw/zinc/68/22/57/1063682257.db2.gz GAOFHHGCAWEYTA-UHFFFAOYSA-N 1 2 317.824 4.099 20 0 DIADLO CC(C)(O)c1ccc(CNc2[nH]c3ccc(Cl)cc3[nH+]2)cc1 ZINC001461733085 1063686043 /nfs/dbraw/zinc/68/60/43/1063686043.db2.gz XTSYFAZOTDYTMQ-UHFFFAOYSA-N 1 2 315.804 4.056 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1ccc(F)cc1 ZINC001461733000 1063686709 /nfs/dbraw/zinc/68/67/09/1063686709.db2.gz ZZBXYJWDLNCWAV-UHFFFAOYSA-N 1 2 303.768 4.461 20 0 DIADLO C/C(=C/c1ccc(Cl)cc1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001461750209 1063693349 /nfs/dbraw/zinc/69/33/49/1063693349.db2.gz ZVYIIZMXXAAASE-BENRWUELSA-N 1 2 311.772 4.030 20 0 DIADLO Cc1cc(C)c2cc(NCc3nn(C)c4ccccc34)ccc2[nH+]1 ZINC001461750479 1063693552 /nfs/dbraw/zinc/69/35/52/1063693552.db2.gz JRDRAHVAWVZBJI-UHFFFAOYSA-N 1 2 316.408 4.350 20 0 DIADLO CC[C@@H](C)CNc1[nH+]c2cc(Br)ccc2n1CC ZINC001461834374 1063741522 /nfs/dbraw/zinc/74/15/22/1063741522.db2.gz ZGQGASHVOQPMBZ-SNVBAGLBSA-N 1 2 310.239 4.277 20 0 DIADLO CC[C@H](C)CNc1[nH+]c2cc(Br)ccc2n1CC ZINC001461834373 1063741834 /nfs/dbraw/zinc/74/18/34/1063741834.db2.gz ZGQGASHVOQPMBZ-JTQLQIEISA-N 1 2 310.239 4.277 20 0 DIADLO CSCc1ccc(C[N@@H+]2CCc3ccc(F)c(F)c3C2)cc1 ZINC001461861109 1063753815 /nfs/dbraw/zinc/75/38/15/1063753815.db2.gz JXAYODVKXLXTOA-UHFFFAOYSA-N 1 2 319.420 4.386 20 0 DIADLO CSCc1ccc(C[N@H+]2CCc3ccc(F)c(F)c3C2)cc1 ZINC001461861109 1063753821 /nfs/dbraw/zinc/75/38/21/1063753821.db2.gz JXAYODVKXLXTOA-UHFFFAOYSA-N 1 2 319.420 4.386 20 0 DIADLO Cc1c[nH]c(C[N@H+](Cc2ccccc2F)C2CCCCC2)n1 ZINC001461860739 1063754483 /nfs/dbraw/zinc/75/44/83/1063754483.db2.gz GONMVPMEOQOXFA-UHFFFAOYSA-N 1 2 301.409 4.192 20 0 DIADLO Cc1c[nH]c(C[N@@H+](Cc2ccccc2F)C2CCCCC2)n1 ZINC001461860739 1063754494 /nfs/dbraw/zinc/75/44/94/1063754494.db2.gz GONMVPMEOQOXFA-UHFFFAOYSA-N 1 2 301.409 4.192 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC001461876435 1063767664 /nfs/dbraw/zinc/76/76/64/1063767664.db2.gz UVCDHUYSLHNGRY-STQMWFEESA-N 1 2 307.825 4.123 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC001461876435 1063767681 /nfs/dbraw/zinc/76/76/81/1063767681.db2.gz UVCDHUYSLHNGRY-STQMWFEESA-N 1 2 307.825 4.123 20 0 DIADLO COc1cc(Cl)c(C[NH+]2C[C@@H](C)S[C@H](C)C2)cc1Cl ZINC001461893819 1063782826 /nfs/dbraw/zinc/78/28/26/1063782826.db2.gz BELUUTVONVPLFY-NXEZZACHSA-N 1 2 320.285 4.328 20 0 DIADLO CC(C)C[C@H]1CCC[N@H+](Cc2nc(Br)cs2)C1 ZINC001461915116 1063797862 /nfs/dbraw/zinc/79/78/62/1063797862.db2.gz PFUVYCUVQWEDBK-LLVKDONJSA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)C[C@H]1CCC[N@@H+](Cc2nc(Br)cs2)C1 ZINC001461915116 1063797874 /nfs/dbraw/zinc/79/78/74/1063797874.db2.gz PFUVYCUVQWEDBK-LLVKDONJSA-N 1 2 317.296 4.164 20 0 DIADLO CCCC[C@@H](CCC)[N@@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001258761476 1063807451 /nfs/dbraw/zinc/80/74/51/1063807451.db2.gz MDDWOWLMALMGFU-HZPDHXFCSA-N 1 2 307.482 4.155 20 0 DIADLO CCCC[C@@H](CCC)[N@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001258761476 1063807462 /nfs/dbraw/zinc/80/74/62/1063807462.db2.gz MDDWOWLMALMGFU-HZPDHXFCSA-N 1 2 307.482 4.155 20 0 DIADLO COc1ccc(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)c(F)c1 ZINC001461943495 1063826754 /nfs/dbraw/zinc/82/67/54/1063826754.db2.gz ZPTXFIPMUQFNMJ-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)c(F)c1 ZINC001461943495 1063826770 /nfs/dbraw/zinc/82/67/70/1063826770.db2.gz ZPTXFIPMUQFNMJ-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@H](CC)C[C@H](C)CC)[C@@H]2C ZINC001258792147 1063827697 /nfs/dbraw/zinc/82/76/97/1063827697.db2.gz DXHNHLIWFREIHC-BZUAXINKSA-N 1 2 307.482 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@H](CC)C[C@H](C)CC)[C@@H]2C ZINC001258792147 1063827706 /nfs/dbraw/zinc/82/77/06/1063827706.db2.gz DXHNHLIWFREIHC-BZUAXINKSA-N 1 2 307.482 4.011 20 0 DIADLO CCn1nc(C[N@@H+]2CCc3cccc(F)c3[C@H]2C)c2ccccc21 ZINC001461958941 1063838889 /nfs/dbraw/zinc/83/88/89/1063838889.db2.gz CSVYCMSNUCDEID-CQSZACIVSA-N 1 2 323.415 4.315 20 0 DIADLO CCn1nc(C[N@H+]2CCc3cccc(F)c3[C@H]2C)c2ccccc21 ZINC001461958941 1063838897 /nfs/dbraw/zinc/83/88/97/1063838897.db2.gz CSVYCMSNUCDEID-CQSZACIVSA-N 1 2 323.415 4.315 20 0 DIADLO COc1cccc(C[N@@H+]2CCc3cccc(F)c3[C@@H]2C)c1F ZINC001461959813 1063842119 /nfs/dbraw/zinc/84/21/19/1063842119.db2.gz JCSGBPUHGXSLII-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cccc(C[N@H+]2CCc3cccc(F)c3[C@@H]2C)c1F ZINC001461959813 1063842128 /nfs/dbraw/zinc/84/21/28/1063842128.db2.gz JCSGBPUHGXSLII-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO C[C@H]1C[C@H]([N@@H+]2CCC[C@H]2c2ncc[nH]2)c2ccsc2S1 ZINC001462061659 1063909257 /nfs/dbraw/zinc/90/92/57/1063909257.db2.gz QTFCFCBAPKCASM-DRZSPHRISA-N 1 2 305.472 4.234 20 0 DIADLO C[C@H]1C[C@H]([N@H+]2CCC[C@H]2c2ncc[nH]2)c2ccsc2S1 ZINC001462061659 1063909270 /nfs/dbraw/zinc/90/92/70/1063909270.db2.gz QTFCFCBAPKCASM-DRZSPHRISA-N 1 2 305.472 4.234 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](C)c2cc3cnccc3o2)cs1 ZINC001261849968 1063948933 /nfs/dbraw/zinc/94/89/33/1063948933.db2.gz UZSUPCVUTBLCSR-LLVKDONJSA-N 1 2 301.415 4.259 20 0 DIADLO C[C@H](CC(=O)Nc1ccccc1-c1cccs1)n1cc[nH+]c1 ZINC001264319198 1064074269 /nfs/dbraw/zinc/07/42/69/1064074269.db2.gz CBZBNYKVYBIWOA-CYBMUJFWSA-N 1 2 311.410 4.201 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(C)c(-n3cccc3)c2)c(C)[nH+]1 ZINC001264804181 1064138337 /nfs/dbraw/zinc/13/83/37/1064138337.db2.gz VVLOLLPJPGDIIF-UHFFFAOYSA-N 1 2 319.408 4.358 20 0 DIADLO CC(C)CCOc1cccc(NC(=O)c2cccc3[nH+]ccn32)c1 ZINC001264807896 1064138559 /nfs/dbraw/zinc/13/85/59/1064138559.db2.gz SRRUJNADGQRHSL-UHFFFAOYSA-N 1 2 323.396 4.012 20 0 DIADLO Cc1cc(C)c(NC(=O)CCc2ccc(Cl)c(F)c2)c(C)[nH+]1 ZINC001264803963 1064138726 /nfs/dbraw/zinc/13/87/26/1064138726.db2.gz KXXRPNCIMJEVLM-UHFFFAOYSA-N 1 2 320.795 4.371 20 0 DIADLO CC1(CCC(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CC1 ZINC001264831596 1064144412 /nfs/dbraw/zinc/14/44/12/1064144412.db2.gz FPZCLRCYHVYYQY-UHFFFAOYSA-N 1 2 303.793 4.045 20 0 DIADLO C[C@@H]1CCCN(c2cc(NCc3ccc(Cl)s3)[nH+]cn2)C1 ZINC000599456949 1064180723 /nfs/dbraw/zinc/18/07/23/1064180723.db2.gz DPOVVSUVPDEGIX-LLVKDONJSA-N 1 2 322.865 4.040 20 0 DIADLO C[C@@H]1CCCN(c2cc(NCc3ccc(Cl)s3)nc[nH+]2)C1 ZINC000599456949 1064180727 /nfs/dbraw/zinc/18/07/27/1064180727.db2.gz DPOVVSUVPDEGIX-LLVKDONJSA-N 1 2 322.865 4.040 20 0 DIADLO Cc1cc(C)c(C(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)c(C)[nH+]1 ZINC001265153371 1064197009 /nfs/dbraw/zinc/19/70/09/1064197009.db2.gz VUNSIQKFHYNMSP-QAPCUYQASA-N 1 2 308.425 4.025 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ccc(Br)c(F)c2F)[C@H]1C ZINC000701299018 1064246178 /nfs/dbraw/zinc/24/61/78/1064246178.db2.gz IZZVTNRIOAQABQ-ZJUUUORDSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ccc(Br)c(F)c2F)[C@H]1C ZINC000701299018 1064246189 /nfs/dbraw/zinc/24/61/89/1064246189.db2.gz IZZVTNRIOAQABQ-ZJUUUORDSA-N 1 2 318.205 4.348 20 0 DIADLO Fc1c(Br)ccc(C[N@@H+]2CCC23CCCC3)c1F ZINC000701325174 1064247457 /nfs/dbraw/zinc/24/74/57/1064247457.db2.gz CIHVKTGIVFLNIC-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1c(Br)ccc(C[N@H+]2CCC23CCCC3)c1F ZINC000701325174 1064247462 /nfs/dbraw/zinc/24/74/62/1064247462.db2.gz CIHVKTGIVFLNIC-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C)c2c(F)cccc2Cl)c(C)[nH+]1 ZINC001265762603 1064271065 /nfs/dbraw/zinc/27/10/65/1064271065.db2.gz YLCCDQNMWKRPQS-LBPRGKRZSA-N 1 2 320.795 4.290 20 0 DIADLO CC(C)c1ccc2occ(C(=O)Nc3ccc4[nH+]ccn4c3)c2c1 ZINC001280275919 1064392017 /nfs/dbraw/zinc/39/20/17/1064392017.db2.gz UBQIVCIMVJTTMU-UHFFFAOYSA-N 1 2 319.364 4.456 20 0 DIADLO O=C(Cc1[nH]cc[nH+]1)Nc1ccc(-c2cc3ccccc3o2)cc1 ZINC001290514131 1064698515 /nfs/dbraw/zinc/69/85/15/1064698515.db2.gz ZWQCKBJYEHYONI-UHFFFAOYSA-N 1 2 317.348 4.004 20 0 DIADLO Cc1cc(C(F)F)oc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001292297253 1064767309 /nfs/dbraw/zinc/76/73/09/1064767309.db2.gz FJTLLFMRCJRAHY-UHFFFAOYSA-N 1 2 317.295 4.168 20 0 DIADLO CC(C)C[C@@H](C(=O)N[C@@H]1CCCCC12CCCC2)n1cc[nH+]c1 ZINC001298651861 1065014266 /nfs/dbraw/zinc/01/42/66/1065014266.db2.gz NLAOBTRTQLGBIK-DLBZAZTESA-N 1 2 317.477 4.090 20 0 DIADLO CCC[C@](C)(CC)C(=O)N1CC[NH2+][C@H](c2ccc(Cl)cc2)C1 ZINC001301662171 1065070613 /nfs/dbraw/zinc/07/06/13/1065070613.db2.gz NXVXNFGHMXAHPI-WMZOPIPTSA-N 1 2 322.880 4.029 20 0 DIADLO Cc1ccc(-c2ccccc2NC(=O)CCc2c[nH]c[nH+]2)s1 ZINC001302400480 1065086617 /nfs/dbraw/zinc/08/66/17/1065086617.db2.gz GUKFMJIDGCKZEX-UHFFFAOYSA-N 1 2 311.410 4.018 20 0 DIADLO Cc1ccc(-c2ccccc2NC(=O)CCc2c[nH+]c[nH]2)s1 ZINC001302400480 1065086628 /nfs/dbraw/zinc/08/66/28/1065086628.db2.gz GUKFMJIDGCKZEX-UHFFFAOYSA-N 1 2 311.410 4.018 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C[C@@H]3CCC[C@H]3C)cc2)[nH+]c1C ZINC001303121486 1065107461 /nfs/dbraw/zinc/10/74/61/1065107461.db2.gz ADXZPVRPUVRFET-WBMJQRKESA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)/C=C/c3ccsc3)cc2)[nH+]c1C ZINC001303121515 1065107699 /nfs/dbraw/zinc/10/76/99/1065107699.db2.gz ASTZCLLXDHLIPE-FPYGCLRLSA-N 1 2 323.421 4.407 20 0 DIADLO CCC[C@H](C)CCNC(=O)C[N@H+](CC)Cc1ccccc1Cl ZINC001303150778 1065110199 /nfs/dbraw/zinc/11/01/99/1065110199.db2.gz PLGZAYJYFANRKS-HNNXBMFYSA-N 1 2 324.896 4.104 20 0 DIADLO CCC[C@H](C)CCNC(=O)C[N@@H+](CC)Cc1ccccc1Cl ZINC001303150778 1065110204 /nfs/dbraw/zinc/11/02/04/1065110204.db2.gz PLGZAYJYFANRKS-HNNXBMFYSA-N 1 2 324.896 4.104 20 0 DIADLO CCC(C)(C)c1ccccc1C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001304107193 1065130747 /nfs/dbraw/zinc/13/07/47/1065130747.db2.gz GBDDRPKVBBKEDS-UHFFFAOYSA-N 1 2 313.445 4.151 20 0 DIADLO CCC(C)(C)c1ccccc1C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001304107193 1065130763 /nfs/dbraw/zinc/13/07/63/1065130763.db2.gz GBDDRPKVBBKEDS-UHFFFAOYSA-N 1 2 313.445 4.151 20 0 DIADLO C[C@H](NC(=O)[C@@H]1CCCC2(CC2)C1)c1ccc(-n2cc[nH+]c2)cc1 ZINC001306753938 1065192806 /nfs/dbraw/zinc/19/28/06/1065192806.db2.gz GTAHWQXUHWNWBD-DOTOQJQBSA-N 1 2 323.440 4.020 20 0 DIADLO Fc1cc(Cl)cc2sc(NCCNc3cccc[nH+]3)nc21 ZINC001306917306 1065204149 /nfs/dbraw/zinc/20/41/49/1065204149.db2.gz OXEADDSZAUQNRG-UHFFFAOYSA-N 1 2 322.796 4.008 20 0 DIADLO CC(C)[C@H]1CCCN(c2nc3ccccc3n3c[nH+]cc23)CC1 ZINC001306968528 1065226685 /nfs/dbraw/zinc/22/66/85/1065226685.db2.gz KJBFVACPJBBJLN-HNNXBMFYSA-N 1 2 308.429 4.145 20 0 DIADLO CCc1cc(NCC[C@@H](C)c2ccc(OC)cc2)nc(CC)[nH+]1 ZINC001306967010 1065227127 /nfs/dbraw/zinc/22/71/27/1065227127.db2.gz YPKIWVGATNEECY-CQSZACIVSA-N 1 2 313.445 4.216 20 0 DIADLO C[C@H](Nc1nc2ccccc2n2c[nH+]cc12)c1cccc(F)c1F ZINC001307074952 1065250453 /nfs/dbraw/zinc/25/04/53/1065250453.db2.gz LRCQFHCRRUACOK-NSHDSACASA-N 1 2 324.334 4.334 20 0 DIADLO C[C@@H](CNc1nc2ccccc2n2c[nH+]cc12)c1ccccc1 ZINC001307089785 1065256812 /nfs/dbraw/zinc/25/68/12/1065256812.db2.gz DBHCOFLOGSHMDL-AWEZNQCLSA-N 1 2 302.381 4.098 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2NCCC1=CCCCCC1 ZINC001307089678 1065256959 /nfs/dbraw/zinc/25/69/59/1065256959.db2.gz BPCCTIVTJLOOGZ-UHFFFAOYSA-N 1 2 313.449 4.274 20 0 DIADLO Cc1cc(N[C@@H]2C[C@H]2c2c(F)cccc2F)nc(C2CCC2)[nH+]1 ZINC001307111837 1065267624 /nfs/dbraw/zinc/26/76/24/1065267624.db2.gz QAUPNSDLZSBEGV-IUODEOHRSA-N 1 2 315.367 4.299 20 0 DIADLO CCOC1(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)CCCC1 ZINC001307126676 1065273631 /nfs/dbraw/zinc/27/36/31/1065273631.db2.gz IDGBPIDLZDYXGT-UHFFFAOYSA-N 1 2 305.466 4.485 20 0 DIADLO Cc1cc(N2[C@H](C)C[C@H](c3ccccc3)[C@@H]2C)nc(C2CC2)[nH+]1 ZINC001307129330 1065275875 /nfs/dbraw/zinc/27/58/75/1065275875.db2.gz ZBCZKECZNSQXSM-VKJFTORMSA-N 1 2 307.441 4.433 20 0 DIADLO CO[C@](C)([C@@H](C)Nc1cc(C(C)C)[nH+]c(C(C)C)n1)C1CC1 ZINC001307143034 1065283345 /nfs/dbraw/zinc/28/33/45/1065283345.db2.gz WJWFIYBXEZXSHP-FZKQIMNGSA-N 1 2 305.466 4.339 20 0 DIADLO Cc1nc(NCCC[C@H]2CC2(Cl)Cl)c2c([nH+]1)CCCC2 ZINC001307155447 1065287219 /nfs/dbraw/zinc/28/72/19/1065287219.db2.gz SBJXCIHSSZOCPT-NSHDSACASA-N 1 2 314.260 4.050 20 0 DIADLO CC(C)c1cc(NCC[C@@H]2CCCC[C@@H]2O)nc(C(C)C)[nH+]1 ZINC001307221363 1065306644 /nfs/dbraw/zinc/30/66/44/1065306644.db2.gz CVPRONXKYIWGDP-HOCLYGCPSA-N 1 2 305.466 4.077 20 0 DIADLO CN(C)c1[nH+]cc(CSc2ccccc2O)c2ccccc21 ZINC001307298506 1065332062 /nfs/dbraw/zinc/33/20/62/1065332062.db2.gz FXOZIASZJZYLLE-UHFFFAOYSA-N 1 2 310.422 4.299 20 0 DIADLO CC(C)CCN(CCC(C)C)C(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC001307381315 1065363384 /nfs/dbraw/zinc/36/33/84/1065363384.db2.gz KGECMKBLULXPOY-UHFFFAOYSA-N 1 2 321.509 4.101 20 0 DIADLO COC[C@H](SCc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC001307404723 1065371314 /nfs/dbraw/zinc/37/13/14/1065371314.db2.gz HUNIQXOZJNVWLY-IBGZPJMESA-N 1 2 324.449 4.493 20 0 DIADLO CC(C)COCC[N@@H+]1CCc2c(Cl)c(Cl)ccc2C1 ZINC001307445596 1065403671 /nfs/dbraw/zinc/40/36/71/1065403671.db2.gz IIDRLVPYFUFODU-UHFFFAOYSA-N 1 2 302.245 4.024 20 0 DIADLO CC(C)COCC[N@H+]1CCc2c(Cl)c(Cl)ccc2C1 ZINC001307445596 1065403678 /nfs/dbraw/zinc/40/36/78/1065403678.db2.gz IIDRLVPYFUFODU-UHFFFAOYSA-N 1 2 302.245 4.024 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](CC3CC4(CCC4)C3)CCO2)cc1Cl ZINC001307452699 1065408716 /nfs/dbraw/zinc/40/87/16/1065408716.db2.gz HBJBZKGDGOTOOJ-KRWDZBQOSA-N 1 2 323.839 4.433 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](CC3CC4(CCC4)C3)CCO2)cc1Cl ZINC001307452699 1065408721 /nfs/dbraw/zinc/40/87/21/1065408721.db2.gz HBJBZKGDGOTOOJ-KRWDZBQOSA-N 1 2 323.839 4.433 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](CC3CC4(CCC4)C3)CCO2)cc1Cl ZINC001307452700 1065409409 /nfs/dbraw/zinc/40/94/09/1065409409.db2.gz HBJBZKGDGOTOOJ-QGZVFWFLSA-N 1 2 323.839 4.433 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](CC3CC4(CCC4)C3)CCO2)cc1Cl ZINC001307452700 1065409416 /nfs/dbraw/zinc/40/94/16/1065409416.db2.gz HBJBZKGDGOTOOJ-QGZVFWFLSA-N 1 2 323.839 4.433 20 0 DIADLO Cc1ccc(C(C)(C)C[N@@H+](C)Cc2nc(C(C)C)ns2)cc1 ZINC001307495716 1065439538 /nfs/dbraw/zinc/43/95/38/1065439538.db2.gz FDGZVIBQIAEGNZ-UHFFFAOYSA-N 1 2 317.502 4.380 20 0 DIADLO Cc1ccc(C(C)(C)C[N@H+](C)Cc2nc(C(C)C)ns2)cc1 ZINC001307495716 1065439550 /nfs/dbraw/zinc/43/95/50/1065439550.db2.gz FDGZVIBQIAEGNZ-UHFFFAOYSA-N 1 2 317.502 4.380 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2F)[N@H+](Cc2nc3c(o2)CCCC3)C1 ZINC001307502975 1065445595 /nfs/dbraw/zinc/44/55/95/1065445595.db2.gz ASCLCBZCPVIAOK-SUMWQHHRSA-N 1 2 314.404 4.276 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2nc3c(o2)CCCC3)C1 ZINC001307502975 1065445603 /nfs/dbraw/zinc/44/56/03/1065445603.db2.gz ASCLCBZCPVIAOK-SUMWQHHRSA-N 1 2 314.404 4.276 20 0 DIADLO CC(C)(C)Oc1cccc(C[N@@H+]2CCO[C@@H](c3ccco3)C2)c1 ZINC001307523530 1065462922 /nfs/dbraw/zinc/46/29/22/1065462922.db2.gz NHPFEYYFUUHSQH-GOSISDBHSA-N 1 2 315.413 4.030 20 0 DIADLO CC(C)(C)Oc1cccc(C[N@H+]2CCO[C@@H](c3ccco3)C2)c1 ZINC001307523530 1065462925 /nfs/dbraw/zinc/46/29/25/1065462925.db2.gz NHPFEYYFUUHSQH-GOSISDBHSA-N 1 2 315.413 4.030 20 0 DIADLO Clc1cccc(Cl)c1CC[N@@H+]1CCOC2(CCCC2)C1 ZINC001307527300 1065464103 /nfs/dbraw/zinc/46/41/03/1065464103.db2.gz GSHMVPKXIXPWQO-UHFFFAOYSA-N 1 2 314.256 4.181 20 0 DIADLO Clc1cccc(Cl)c1CC[N@H+]1CCOC2(CCCC2)C1 ZINC001307527300 1065464105 /nfs/dbraw/zinc/46/41/05/1065464105.db2.gz GSHMVPKXIXPWQO-UHFFFAOYSA-N 1 2 314.256 4.181 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H]2c2cccn2C)nc1Cl ZINC001307524929 1065464872 /nfs/dbraw/zinc/46/48/72/1065464872.db2.gz YVJCPTWDUSAQTP-INIZCTEOSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2cccn2C)nc1Cl ZINC001307524929 1065464875 /nfs/dbraw/zinc/46/48/75/1065464875.db2.gz YVJCPTWDUSAQTP-INIZCTEOSA-N 1 2 303.837 4.109 20 0 DIADLO CC1=CC[N@H+](Cc2ccc(Br)cc2Cl)CC1 ZINC001307652250 1065542230 /nfs/dbraw/zinc/54/22/30/1065542230.db2.gz RPRRPYNAGFNODJ-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO CC1=CC[N@@H+](Cc2ccc(Br)cc2Cl)CC1 ZINC001307652250 1065542242 /nfs/dbraw/zinc/54/22/42/1065542242.db2.gz RPRRPYNAGFNODJ-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO CC(C)[C@H]1CCc2ccccc2N1Cc1cc[nH+]c(N(C)C)c1 ZINC001307654973 1065544940 /nfs/dbraw/zinc/54/49/40/1065544940.db2.gz IRESJUPWXQIQJD-GOSISDBHSA-N 1 2 309.457 4.125 20 0 DIADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1ccc(F)cc1Cl ZINC001307672321 1065554692 /nfs/dbraw/zinc/55/46/92/1065554692.db2.gz LZCHUPNFKSMOBP-LBPRGKRZSA-N 1 2 305.780 4.262 20 0 DIADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1ccc(F)cc1Cl ZINC001307672321 1065554703 /nfs/dbraw/zinc/55/47/03/1065554703.db2.gz LZCHUPNFKSMOBP-LBPRGKRZSA-N 1 2 305.780 4.262 20 0 DIADLO CCOC(=O)[C@@H](C)[N@H+](Cc1ccc(C(C)(C)CC)cc1)C1CC1 ZINC001307688152 1065563927 /nfs/dbraw/zinc/56/39/27/1065563927.db2.gz FPEWUYATNODMMZ-OAHLLOKOSA-N 1 2 317.473 4.290 20 0 DIADLO CCOC(=O)[C@@H](C)[N@@H+](Cc1ccc(C(C)(C)CC)cc1)C1CC1 ZINC001307688152 1065563937 /nfs/dbraw/zinc/56/39/37/1065563937.db2.gz FPEWUYATNODMMZ-OAHLLOKOSA-N 1 2 317.473 4.290 20 0 DIADLO C[C@@H]1CC(C)(C)C[N@H+]1Cc1ccc(Br)c(F)c1F ZINC001307845621 1065649434 /nfs/dbraw/zinc/64/94/34/1065649434.db2.gz OGENHCPCAHGFJL-SECBINFHSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1ccc(Br)c(F)c1F ZINC001307845621 1065649429 /nfs/dbraw/zinc/64/94/29/1065649429.db2.gz OGENHCPCAHGFJL-SECBINFHSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ncc(Br)cc2Cl)[C@H](C)C1 ZINC001307860705 1065658696 /nfs/dbraw/zinc/65/86/96/1065658696.db2.gz QZUJKWAMBSGPJN-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO CC[N@H+](CCOc1ccccc1C)Cc1nc(C(C)(C)C)co1 ZINC001307864541 1065658459 /nfs/dbraw/zinc/65/84/59/1065658459.db2.gz ZVCFRQSMFAKSHQ-UHFFFAOYSA-N 1 2 316.445 4.181 20 0 DIADLO CC[N@@H+](CCOc1ccccc1C)Cc1nc(C(C)(C)C)co1 ZINC001307864541 1065658464 /nfs/dbraw/zinc/65/84/64/1065658464.db2.gz ZVCFRQSMFAKSHQ-UHFFFAOYSA-N 1 2 316.445 4.181 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC(C)(C)C[C@@H]2c2ccccc2)no1 ZINC001307862510 1065658563 /nfs/dbraw/zinc/65/85/63/1065658563.db2.gz BIECAXGPVLDKTC-MRXNPFEDSA-N 1 2 313.445 4.385 20 0 DIADLO CCCCc1nc(C[N@H+]2CC(C)(C)C[C@@H]2c2ccccc2)no1 ZINC001307862510 1065658567 /nfs/dbraw/zinc/65/85/67/1065658567.db2.gz BIECAXGPVLDKTC-MRXNPFEDSA-N 1 2 313.445 4.385 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ncc(Br)cc2Cl)[C@H](C)C1 ZINC001307860705 1065658692 /nfs/dbraw/zinc/65/86/92/1065658692.db2.gz QZUJKWAMBSGPJN-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2noc(C(C)C)n2)CC(C)C)cc1 ZINC001307869468 1065662951 /nfs/dbraw/zinc/66/29/51/1065662951.db2.gz GYZWWJAYXNBOHM-UHFFFAOYSA-N 1 2 315.461 4.414 20 0 DIADLO CCc1ccc(C[N@H+](Cc2noc(C(C)C)n2)CC(C)C)cc1 ZINC001307869468 1065662962 /nfs/dbraw/zinc/66/29/62/1065662962.db2.gz GYZWWJAYXNBOHM-UHFFFAOYSA-N 1 2 315.461 4.414 20 0 DIADLO Cc1c(C[N@@H+](C)[C@@H](C)C(=O)OC(C)(C)C)oc2c1cccc2C ZINC001307902021 1065673388 /nfs/dbraw/zinc/67/33/88/1065673388.db2.gz PKWRHVPJITVWOZ-AWEZNQCLSA-N 1 2 317.429 4.212 20 0 DIADLO Cc1c(C[N@H+](C)[C@@H](C)C(=O)OC(C)(C)C)oc2c1cccc2C ZINC001307902021 1065673394 /nfs/dbraw/zinc/67/33/94/1065673394.db2.gz PKWRHVPJITVWOZ-AWEZNQCLSA-N 1 2 317.429 4.212 20 0 DIADLO CCC(CC)CCC[N@H+](C)Cc1noc(-c2cncc(C)c2)n1 ZINC001307969496 1065703557 /nfs/dbraw/zinc/70/35/57/1065703557.db2.gz SASYABDDLRWXGV-UHFFFAOYSA-N 1 2 316.449 4.088 20 0 DIADLO CCC(CC)CCC[N@@H+](C)Cc1noc(-c2cncc(C)c2)n1 ZINC001307969496 1065703568 /nfs/dbraw/zinc/70/35/68/1065703568.db2.gz SASYABDDLRWXGV-UHFFFAOYSA-N 1 2 316.449 4.088 20 0 DIADLO Fc1ccc(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)cc1 ZINC001307984460 1065712497 /nfs/dbraw/zinc/71/24/97/1065712497.db2.gz SNQMZMXJDZVHJW-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Fc1ccc(C[N@H+]2CCc3cccc(C(F)(F)F)c3C2)cc1 ZINC001307984460 1065712506 /nfs/dbraw/zinc/71/25/06/1065712506.db2.gz SNQMZMXJDZVHJW-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001307993078 1065716109 /nfs/dbraw/zinc/71/61/09/1065716109.db2.gz PSYCPJNEDJAUNP-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H](c1cccnc1)[N@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001307993078 1065716126 /nfs/dbraw/zinc/71/61/26/1065716126.db2.gz PSYCPJNEDJAUNP-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1CCC[C@H](CCN2CC[NH+](CCCOC(C)(C)C)CC2)C1 ZINC001308032825 1065732579 /nfs/dbraw/zinc/73/25/79/1065732579.db2.gz JNXFUNSBNVHSEJ-RBUKOAKNSA-N 1 2 324.553 4.026 20 0 DIADLO C[C@@H]1CCC[C@H](CCN2CC[NH+](CCCOC(C)(C)C)CC2)C1 ZINC001308032826 1065734028 /nfs/dbraw/zinc/73/40/28/1065734028.db2.gz JNXFUNSBNVHSEJ-RTBURBONSA-N 1 2 324.553 4.026 20 0 DIADLO CCOC(=O)[C@@H](CCCC(C)C)[NH2+]C[C@@H]1CCCCC1(F)F ZINC001308063160 1065747129 /nfs/dbraw/zinc/74/71/29/1065747129.db2.gz DRODJJYENMVVKD-LSDHHAIUSA-N 1 2 319.436 4.160 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2Cc2cc(-c3ccccc3)no2)[nH+]c1C ZINC001308070590 1065749945 /nfs/dbraw/zinc/74/99/45/1065749945.db2.gz JWCSMAOQIJEFKO-SFHVURJKSA-N 1 2 322.412 4.019 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001308079742 1065753045 /nfs/dbraw/zinc/75/30/45/1065753045.db2.gz BIRSPEVRSABUJY-SKDRFNHKSA-N 1 2 309.784 4.381 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001308079742 1065753061 /nfs/dbraw/zinc/75/30/61/1065753061.db2.gz BIRSPEVRSABUJY-SKDRFNHKSA-N 1 2 309.784 4.381 20 0 DIADLO Fc1cncc(F)c1C[N@@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC001308123124 1065772546 /nfs/dbraw/zinc/77/25/46/1065772546.db2.gz ULHGEZLPTCMFOL-HVHJFMEUSA-N 1 2 300.352 4.038 20 0 DIADLO Fc1cncc(F)c1C[N@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC001308123124 1065772556 /nfs/dbraw/zinc/77/25/56/1065772556.db2.gz ULHGEZLPTCMFOL-HVHJFMEUSA-N 1 2 300.352 4.038 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@@H+](Cc1cccc(Cl)n1)C2 ZINC001308173664 1065789166 /nfs/dbraw/zinc/78/91/66/1065789166.db2.gz DDSUWPORIYSVPL-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@H+](Cc1cccc(Cl)n1)C2 ZINC001308173664 1065789175 /nfs/dbraw/zinc/78/91/75/1065789175.db2.gz DDSUWPORIYSVPL-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CCc1ccc([C@@H](CNCc2cccc(C)c2F)[NH+](C)C)cc1 ZINC001308182847 1065793013 /nfs/dbraw/zinc/79/30/13/1065793013.db2.gz XFWDVYIZVCBFCK-LJQANCHMSA-N 1 2 314.448 4.089 20 0 DIADLO CCCCOc1ncccc1C[NH2+]Cc1ncc(C(C)C)s1 ZINC001308226210 1065834636 /nfs/dbraw/zinc/83/46/36/1065834636.db2.gz NAEVKJYJSMXOIP-UHFFFAOYSA-N 1 2 319.474 4.130 20 0 DIADLO CCNc1ccccc1C[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC001308235581 1065843513 /nfs/dbraw/zinc/84/35/13/1065843513.db2.gz DIXZDOIAOJLVGH-GOSISDBHSA-N 1 2 323.465 4.454 20 0 DIADLO COc1cccc(C[NH2+][C@H](C)c2c(F)cccc2Cl)c1OC ZINC001308303680 1065898940 /nfs/dbraw/zinc/89/89/40/1065898940.db2.gz RMEHFYVSKSDGDW-LLVKDONJSA-N 1 2 323.795 4.347 20 0 DIADLO CSc1ccc(Cl)cc1NCc1cccc2[nH+]ccn21 ZINC001308310707 1065905118 /nfs/dbraw/zinc/90/51/18/1065905118.db2.gz KAMWNHUPBWENAH-UHFFFAOYSA-N 1 2 303.818 4.322 20 0 DIADLO CC[C@H]1CCC[C@H](CNc2ccccc2C[NH+]2CCOCC2)C1 ZINC001308318228 1065909772 /nfs/dbraw/zinc/90/97/72/1065909772.db2.gz RMILRYFBOOFUPT-ROUUACIJSA-N 1 2 316.489 4.147 20 0 DIADLO CC[C@H]1CCC[C@@H](CNc2ccccc2C[NH+]2CCOCC2)C1 ZINC001308318229 1065909985 /nfs/dbraw/zinc/90/99/85/1065909985.db2.gz RMILRYFBOOFUPT-ZWKOTPCHSA-N 1 2 316.489 4.147 20 0 DIADLO COCC(C)(C)C[NH2+]c1ccc(N(C)Cc2ccccc2)cc1 ZINC001308320509 1065910698 /nfs/dbraw/zinc/91/06/98/1065910698.db2.gz SGGXFYIJHGPNGF-UHFFFAOYSA-N 1 2 312.457 4.408 20 0 DIADLO C(=C\c1ccccc1)\CNc1ccccc1OCCn1cc[nH+]c1 ZINC001308322833 1065912470 /nfs/dbraw/zinc/91/24/70/1065912470.db2.gz VSROUUKSPDYKHU-TWGQIWQCSA-N 1 2 319.408 4.087 20 0 DIADLO CCSCc1cc[nH+]c(NCc2c[nH]c(-c3ccccc3)n2)c1 ZINC001308332162 1065919912 /nfs/dbraw/zinc/91/99/12/1065919912.db2.gz LYDCJMZPTRXNNU-UHFFFAOYSA-N 1 2 324.453 4.337 20 0 DIADLO CCOc1ccc(CNc2ccc(C)[nH+]c2C)cc1OCC ZINC001308339976 1065924492 /nfs/dbraw/zinc/92/44/92/1065924492.db2.gz DIZRPZNCWHKCKS-UHFFFAOYSA-N 1 2 300.402 4.108 20 0 DIADLO Cc1cccn2c(CN[C@H](CC(C)(C)C)C(F)(F)F)c[nH+]c12 ZINC001308353720 1065934464 /nfs/dbraw/zinc/93/44/64/1065934464.db2.gz TWUBXDXGARNJJW-CYBMUJFWSA-N 1 2 313.367 4.099 20 0 DIADLO COc1cc(F)cc(CNc2c[nH+]ccc2OC(C)(C)C)c1 ZINC001308356591 1065935381 /nfs/dbraw/zinc/93/53/81/1065935381.db2.gz IDYQZXGMZRHWJF-UHFFFAOYSA-N 1 2 304.365 4.019 20 0 DIADLO C[C@H]1Cc2cc(CNc3c[nH+]ccc3OC(C)(C)C)ccc2O1 ZINC001308356876 1065935727 /nfs/dbraw/zinc/93/57/27/1065935727.db2.gz MTIZYHLZGKGIHB-ZDUSSCGKSA-N 1 2 312.413 4.194 20 0 DIADLO Cc1[nH]c(CNc2ccc(SCc3ccccc3)cn2)[nH+]c1C ZINC001308355586 1065936556 /nfs/dbraw/zinc/93/65/56/1065936556.db2.gz YJPDTDCWHKEACD-UHFFFAOYSA-N 1 2 324.453 4.326 20 0 DIADLO COc1ccc(CNc2ccc([NH+](C)C)c(C)c2)c(Cl)c1 ZINC001308354725 1065936830 /nfs/dbraw/zinc/93/68/30/1065936830.db2.gz QYTLDDUKNGEXFG-UHFFFAOYSA-N 1 2 304.821 4.335 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc4ccnc(Cl)c4c3)n2c1 ZINC001308441890 1065990911 /nfs/dbraw/zinc/99/09/11/1065990911.db2.gz SBZQWMSRGYNPTQ-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO CCn1nc(C[NH2+][C@H]2c3ccccc3CC[C@@H]2F)c2ccccc21 ZINC001308498989 1066029092 /nfs/dbraw/zinc/02/90/92/1066029092.db2.gz CEAOBGIYNQQAMH-PXNSSMCTSA-N 1 2 323.415 4.171 20 0 DIADLO FC(F)Oc1ccccc1C[NH2+][C@H]1c2ccccc2CC[C@@H]1F ZINC001308500219 1066030413 /nfs/dbraw/zinc/03/04/13/1066030413.db2.gz NXOAGOOJZNPTSN-RDJZCZTQSA-N 1 2 321.342 4.403 20 0 DIADLO FC(F)c1ccc(CNc2[nH]c3ccc(Cl)cc3[nH+]2)cn1 ZINC001308509630 1066035178 /nfs/dbraw/zinc/03/51/78/1066035178.db2.gz DLUMJAPEXVEYND-UHFFFAOYSA-N 1 2 308.719 4.161 20 0 DIADLO Fc1ccc(C[N@H+](Cc2c(Cl)n[nH]c2C2CC2)C2CC2)cc1 ZINC001308558251 1066066855 /nfs/dbraw/zinc/06/68/55/1066066855.db2.gz MGUDRCPVASIHFZ-UHFFFAOYSA-N 1 2 319.811 4.244 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2c(Cl)n[nH]c2C2CC2)C2CC2)cc1 ZINC001308558251 1066066868 /nfs/dbraw/zinc/06/68/68/1066066868.db2.gz MGUDRCPVASIHFZ-UHFFFAOYSA-N 1 2 319.811 4.244 20 0 DIADLO COc1cccc(OC)c1C[N@H+](Cc1ccccc1F)C(C)C ZINC001308571610 1066081208 /nfs/dbraw/zinc/08/12/08/1066081208.db2.gz VYQQHYFZGWWCKO-UHFFFAOYSA-N 1 2 317.404 4.254 20 0 DIADLO COc1cccc(OC)c1C[N@@H+](Cc1ccccc1F)C(C)C ZINC001308571610 1066081218 /nfs/dbraw/zinc/08/12/18/1066081218.db2.gz VYQQHYFZGWWCKO-UHFFFAOYSA-N 1 2 317.404 4.254 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2nccn2C2CC2)o1 ZINC001308578830 1066094109 /nfs/dbraw/zinc/09/41/09/1066094109.db2.gz QTQPRHZSGSPXNI-WMLDXEAASA-N 1 2 313.445 4.347 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2nccn2C2CC2)o1 ZINC001308578830 1066094094 /nfs/dbraw/zinc/09/40/94/1066094094.db2.gz QTQPRHZSGSPXNI-WMLDXEAASA-N 1 2 313.445 4.347 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1cnc2ccccc2n1 ZINC001308614251 1066119242 /nfs/dbraw/zinc/11/92/42/1066119242.db2.gz QIHIYHLDQXQXBQ-GFCCVEGCSA-N 1 2 313.351 4.101 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cnc2ccccc2n1 ZINC001308614251 1066119245 /nfs/dbraw/zinc/11/92/45/1066119245.db2.gz QIHIYHLDQXQXBQ-GFCCVEGCSA-N 1 2 313.351 4.101 20 0 DIADLO CC[C@H]1C[N@H+](Cc2cc(Cl)c(OC)cc2Cl)CCS1 ZINC001308619791 1066121561 /nfs/dbraw/zinc/12/15/61/1066121561.db2.gz PIYRIRAWXVUHAU-NSHDSACASA-N 1 2 320.285 4.329 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2cc(Cl)c(OC)cc2Cl)CCS1 ZINC001308619791 1066121565 /nfs/dbraw/zinc/12/15/65/1066121565.db2.gz PIYRIRAWXVUHAU-NSHDSACASA-N 1 2 320.285 4.329 20 0 DIADLO CCCn1c[nH+]cc1CN(C)[C@H](c1ccccc1)C(F)(F)F ZINC001308619142 1066122291 /nfs/dbraw/zinc/12/22/91/1066122291.db2.gz KCBHKOPOKZKPBZ-OAHLLOKOSA-N 1 2 311.351 4.029 20 0 DIADLO Cc1ccc([C@H](C)C[NH2+]c2ccc(N3CCOCC3)c(C)c2)cc1 ZINC001308635074 1066130512 /nfs/dbraw/zinc/13/05/12/1066130512.db2.gz KLXYMWSBIGQVDA-GOSISDBHSA-N 1 2 324.468 4.356 20 0 DIADLO Clc1cc(Br)cnc1C[NH+]1CCCCCCC1 ZINC001308652747 1066138315 /nfs/dbraw/zinc/13/83/15/1066138315.db2.gz DFSGARPPKRCMKC-UHFFFAOYSA-N 1 2 317.658 4.264 20 0 DIADLO C[N@@H+](Cc1cnn(CC2CCC2)c1)Cc1ccc(Cl)s1 ZINC001308651083 1066138466 /nfs/dbraw/zinc/13/84/66/1066138466.db2.gz PDYXNDADDBBZEE-UHFFFAOYSA-N 1 2 309.866 4.030 20 0 DIADLO C[N@H+](Cc1cnn(CC2CCC2)c1)Cc1ccc(Cl)s1 ZINC001308651083 1066138470 /nfs/dbraw/zinc/13/84/70/1066138470.db2.gz PDYXNDADDBBZEE-UHFFFAOYSA-N 1 2 309.866 4.030 20 0 DIADLO C[N@H+](CCOc1cccc(Cl)c1)Cc1nc(C(C)(C)C)co1 ZINC001308653610 1066139032 /nfs/dbraw/zinc/13/90/32/1066139032.db2.gz HUIYWLAUJSMZEX-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO C[N@@H+](CCOc1cccc(Cl)c1)Cc1nc(C(C)(C)C)co1 ZINC001308653610 1066139036 /nfs/dbraw/zinc/13/90/36/1066139036.db2.gz HUIYWLAUJSMZEX-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO C[N@H+](CCOc1ccccc1Cl)Cc1nc(C(C)(C)C)co1 ZINC001308654165 1066139631 /nfs/dbraw/zinc/13/96/31/1066139631.db2.gz YETHLVPCRCATJS-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO C[N@@H+](CCOc1ccccc1Cl)Cc1nc(C(C)(C)C)co1 ZINC001308654165 1066139634 /nfs/dbraw/zinc/13/96/34/1066139634.db2.gz YETHLVPCRCATJS-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(Br)o1 ZINC001308666662 1066145443 /nfs/dbraw/zinc/14/54/43/1066145443.db2.gz VVHCSLABWYEYSO-CQSZACIVSA-N 1 2 320.230 4.379 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccc(Br)o1 ZINC001308666662 1066145447 /nfs/dbraw/zinc/14/54/47/1066145447.db2.gz VVHCSLABWYEYSO-CQSZACIVSA-N 1 2 320.230 4.379 20 0 DIADLO Cc1cc(CNc2cccc(C)c2Br)cc(C)[nH+]1 ZINC001308708405 1066191542 /nfs/dbraw/zinc/19/15/42/1066191542.db2.gz AQYGBTISYXZASQ-UHFFFAOYSA-N 1 2 305.219 4.381 20 0 DIADLO Cc1[nH+]cn(-c2ccc(NC3C[C@H]4CC[C@@H](C3)S4)cc2)c1C ZINC001308794103 1066270830 /nfs/dbraw/zinc/27/08/30/1066270830.db2.gz ULZKSEJSJDVJAC-ZNXRZULTSA-N 1 2 313.470 4.328 20 0 DIADLO CCCCCOC1C[NH+](Cc2ccc(OCCC)c(C)c2)C1 ZINC001308807525 1066283944 /nfs/dbraw/zinc/28/39/44/1066283944.db2.gz QQLLRCDPGXDHLW-UHFFFAOYSA-N 1 2 305.462 4.175 20 0 DIADLO CC[C@H]([NH2+]C[C@@H](C)c1cccc(Cl)c1)C(=O)OC(C)(C)C ZINC001308835225 1066311740 /nfs/dbraw/zinc/31/17/40/1066311740.db2.gz WPJNKNKOBRJOJX-DOMZBBRYSA-N 1 2 311.853 4.153 20 0 DIADLO Cc1cccc(CC2C[NH+](Cc3c(Cl)cncc3Cl)C2)c1 ZINC001308877356 1066357832 /nfs/dbraw/zinc/35/78/32/1066357832.db2.gz QIXFYUBJEDKENU-UHFFFAOYSA-N 1 2 321.251 4.371 20 0 DIADLO CC(C)C1(C[NH2+]c2ccc(N3CCOC[C@@H]3C)c(Cl)c2)CC1 ZINC001308887041 1066369708 /nfs/dbraw/zinc/36/97/08/1066369708.db2.gz DLSDVYCPEYUCFW-AWEZNQCLSA-N 1 2 322.880 4.413 20 0 DIADLO Cc1cc(NCCN(C(=O)OC(C)(C)C)C(C)(C)C)c[nH+]c1C ZINC001308917571 1066397056 /nfs/dbraw/zinc/39/70/56/1066397056.db2.gz DLQFQBKJOFQLNM-UHFFFAOYSA-N 1 2 321.465 4.146 20 0 DIADLO Cc1cc(C)cc(C2CC[NH+](Cc3ncc(Cl)n3C)CC2)c1 ZINC001308968707 1066425282 /nfs/dbraw/zinc/42/52/82/1066425282.db2.gz JOJUNFRPBPZZAR-UHFFFAOYSA-N 1 2 317.864 4.070 20 0 DIADLO c1n[nH]c([C@H]([NH2+]C[C@H]2CCC=CCCC2)C2CCCCC2)n1 ZINC001308975475 1066427490 /nfs/dbraw/zinc/42/74/90/1066427490.db2.gz UQIUFGHKOYUYLX-DOTOQJQBSA-N 1 2 302.466 4.152 20 0 DIADLO Cc1cn2cc(NC(=O)NCC[C@H](C)CC(C)(C)C)ccc2[nH+]1 ZINC001310256832 1066505219 /nfs/dbraw/zinc/50/52/19/1066505219.db2.gz XDXYEADKVXIXQD-ZDUSSCGKSA-N 1 2 316.449 4.227 20 0 DIADLO CC(C)(C)[C@H]1CCCC[C@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001310674628 1066550734 /nfs/dbraw/zinc/55/07/34/1066550734.db2.gz HRWWSUPVZLKMPR-LSDHHAIUSA-N 1 2 314.433 4.061 20 0 DIADLO CCCC(C)(C)NC(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC001310794774 1066562100 /nfs/dbraw/zinc/56/21/00/1066562100.db2.gz XLUOVVHBLNPHOT-UHFFFAOYSA-N 1 2 314.433 4.001 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1cc(F)c(F)c(F)c1 ZINC000090460183 185297551 /nfs/dbraw/zinc/29/75/51/185297551.db2.gz GYQGQNRZEDPMLU-MRVPVSSYSA-N 1 2 312.360 4.289 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CCO[C@@H](c3cccs3)C2)s1 ZINC000092594546 185328376 /nfs/dbraw/zinc/32/83/76/185328376.db2.gz MGMMPNMGMHOORL-CYBMUJFWSA-N 1 2 322.499 4.076 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CCO[C@@H](c3cccs3)C2)s1 ZINC000092594546 185328377 /nfs/dbraw/zinc/32/83/77/185328377.db2.gz MGMMPNMGMHOORL-CYBMUJFWSA-N 1 2 322.499 4.076 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)s1 ZINC000343835253 335200667 /nfs/dbraw/zinc/20/06/67/335200667.db2.gz AEMGDNMWKHWLGU-ZETCQYMHSA-N 1 2 321.393 4.032 20 0 DIADLO CC(C)(C)[C@@H]([NH2+]Cc1ncn(-c2ccccc2)n1)c1ccccc1 ZINC000092802994 185342643 /nfs/dbraw/zinc/34/26/43/185342643.db2.gz GGQHAMCNSHPEAW-IBGZPJMESA-N 1 2 320.440 4.144 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](CC)c2ccc(Cl)s2)no1 ZINC000273478883 535104535 /nfs/dbraw/zinc/10/45/35/535104535.db2.gz HNTKOONGPRWQSK-JTQLQIEISA-N 1 2 313.854 4.368 20 0 DIADLO Cc1cc(NCC(C)C)nc(-c2ccc(Br)cc2)[nH+]1 ZINC000073296424 191301429 /nfs/dbraw/zinc/30/14/29/191301429.db2.gz OOBJPFBOLNRCAU-UHFFFAOYSA-N 1 2 320.234 4.282 20 0 DIADLO CSc1ccc(C)c(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000343300993 334987123 /nfs/dbraw/zinc/98/71/23/334987123.db2.gz KPNXBIKKJDVSFD-UHFFFAOYSA-N 1 2 323.421 4.155 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nccs1)c1nc(C(F)(F)F)cs1 ZINC000091731814 193099359 /nfs/dbraw/zinc/09/93/59/193099359.db2.gz NFSWSLALKLTOPP-SFYZADRCSA-N 1 2 321.393 4.420 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000092223907 193176463 /nfs/dbraw/zinc/17/64/63/193176463.db2.gz MPXFMZSDBRCRME-LLVKDONJSA-N 1 2 315.364 4.140 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000092223907 193176466 /nfs/dbraw/zinc/17/64/66/193176466.db2.gz MPXFMZSDBRCRME-LLVKDONJSA-N 1 2 315.364 4.140 20 0 DIADLO C[N@H+](Cc1csc(-c2ccoc2)n1)Cc1ccc(F)cc1 ZINC000170983415 335011953 /nfs/dbraw/zinc/01/19/53/335011953.db2.gz XATSXWNCCYOGKI-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1csc(-c2ccoc2)n1)Cc1ccc(F)cc1 ZINC000170983415 335011955 /nfs/dbraw/zinc/01/19/55/335011955.db2.gz XATSXWNCCYOGKI-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO CCc1cnc(C[NH2+]Cc2cccc(Cl)c2Cl)s1 ZINC000230706583 335015885 /nfs/dbraw/zinc/01/58/85/335015885.db2.gz UQMKTZGLIMJVJC-UHFFFAOYSA-N 1 2 301.242 4.302 20 0 DIADLO Cc1cc(Br)ccc1NCc1cn2ccccc2[nH+]1 ZINC000020042994 182183158 /nfs/dbraw/zinc/18/31/58/182183158.db2.gz JQQDWJBBLNLERU-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccc(Br)cc2)c1C ZINC000020051782 182183942 /nfs/dbraw/zinc/18/39/42/182183942.db2.gz VQFREHYVGJZYSL-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO Fc1ccc(-c2nc(C[N@@H+]3CCc4ccccc4C3)co2)cc1 ZINC000024229381 182377368 /nfs/dbraw/zinc/37/73/68/182377368.db2.gz HQJDEMVLGTWIRX-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1ccc(-c2nc(C[N@H+]3CCc4ccccc4C3)co2)cc1 ZINC000024229381 182377369 /nfs/dbraw/zinc/37/73/69/182377369.db2.gz HQJDEMVLGTWIRX-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cccc2ccccc21 ZINC000023889694 182369617 /nfs/dbraw/zinc/36/96/17/182369617.db2.gz ZAOJFGXKFUHOSI-UHFFFAOYSA-N 1 2 313.360 4.278 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2ccccc2OC(F)F)cs1 ZINC000037084627 182866511 /nfs/dbraw/zinc/86/65/11/182866511.db2.gz OTMOITDZBAOVHM-NXEZZACHSA-N 1 2 312.385 4.465 20 0 DIADLO Cc1cc2[nH+]cn(Cc3ccc(Br)cc3)c2cc1C ZINC000040224020 183047162 /nfs/dbraw/zinc/04/71/62/183047162.db2.gz PLBVMGCYUIBUJQ-UHFFFAOYSA-N 1 2 315.214 4.464 20 0 DIADLO CC(C)(C)c1noc(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)n1 ZINC000104707353 194028793 /nfs/dbraw/zinc/02/87/93/194028793.db2.gz KYAOTODUXQICHO-UHFFFAOYSA-N 1 2 319.836 4.190 20 0 DIADLO Fc1ccc(F)c(C[NH2+]Cc2ccc(CSC(F)F)o2)c1 ZINC000105496268 194107186 /nfs/dbraw/zinc/10/71/86/194107186.db2.gz DGPSQALSXWWIHA-UHFFFAOYSA-N 1 2 319.323 4.303 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2nc(C(C)(C)C)cs2)o1 ZINC000105498627 194107656 /nfs/dbraw/zinc/10/76/56/194107656.db2.gz FIZLJEBMUKKFBA-DGCLKSJQSA-N 1 2 304.459 4.447 20 0 DIADLO CC(=O)c1c(C)cc(C)c(C[N@H+](C)Cc2csc(C)n2)c1C ZINC000063515892 184283996 /nfs/dbraw/zinc/28/39/96/184283996.db2.gz JEFMIGMPWAEENA-UHFFFAOYSA-N 1 2 316.470 4.211 20 0 DIADLO CC(=O)c1c(C)cc(C)c(C[N@@H+](C)Cc2csc(C)n2)c1C ZINC000063515892 184283999 /nfs/dbraw/zinc/28/39/99/184283999.db2.gz JEFMIGMPWAEENA-UHFFFAOYSA-N 1 2 316.470 4.211 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccccc2)c2ccc(C)cc2)oc1C ZINC000064138189 184292878 /nfs/dbraw/zinc/29/28/78/184292878.db2.gz QOMWXWHJDBCCTI-FQEVSTJZSA-N 1 2 306.409 4.479 20 0 DIADLO c1csc([C@@H]([NH2+]Cc2cc[nH]n2)c2ccc3c(c2)CCCC3)c1 ZINC000066970695 184442926 /nfs/dbraw/zinc/44/29/26/184442926.db2.gz QGTSVYIWZNWQIY-IBGZPJMESA-N 1 2 323.465 4.229 20 0 DIADLO Brc1ccc(C[N@H+]2CCCc3occc3C2)s1 ZINC000344296788 335237880 /nfs/dbraw/zinc/23/78/80/335237880.db2.gz UXVAGIAVIGEWAV-UHFFFAOYSA-N 1 2 312.232 4.052 20 0 DIADLO C[C@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1cnn(C)c1 ZINC000272182791 130004661 /nfs/dbraw/zinc/00/46/61/130004661.db2.gz GDHFBONDOMRSCE-JTQLQIEISA-N 1 2 310.228 4.067 20 0 DIADLO C[C@@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1cnccn1 ZINC000272302988 130019270 /nfs/dbraw/zinc/01/92/70/130019270.db2.gz RSAAXPHVIFMKPR-SNVBAGLBSA-N 1 2 308.212 4.123 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H]2CCCOc3c(F)cccc32)cs1 ZINC000272672238 130051595 /nfs/dbraw/zinc/05/15/95/130051595.db2.gz TZJMVVMAYQSGIL-QMTHXVAHSA-N 1 2 306.406 4.155 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2nnc(C3CC3)n2C2CC2)c(C)c1 ZINC000272880237 130071276 /nfs/dbraw/zinc/07/12/76/130071276.db2.gz XSFWKXAZRSHDJY-OAHLLOKOSA-N 1 2 324.472 4.300 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nnc(C3CC3)n2C2CC2)c(C)c1 ZINC000272880237 130071279 /nfs/dbraw/zinc/07/12/79/130071279.db2.gz XSFWKXAZRSHDJY-OAHLLOKOSA-N 1 2 324.472 4.300 20 0 DIADLO CCCOc1ccc([NH2+]C2CCN(c3nccs3)CC2)cc1 ZINC000272919289 130074906 /nfs/dbraw/zinc/07/49/06/130074906.db2.gz RLZOGCAIXKKCQY-UHFFFAOYSA-N 1 2 317.458 4.013 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)[C@H]1CCCCS1 ZINC000272923770 130075523 /nfs/dbraw/zinc/07/55/23/130075523.db2.gz GGZUPGUDYVKRQT-MRXNPFEDSA-N 1 2 314.410 4.098 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@@H](c2nc(C)cs2)C2CC2)n1 ZINC000273259388 130101005 /nfs/dbraw/zinc/10/10/05/130101005.db2.gz ICNCCJQKGDMPQR-MRXNPFEDSA-N 1 2 318.490 4.250 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2nc(-c3ccccc3)oc2C)s1 ZINC000273253619 130101435 /nfs/dbraw/zinc/10/14/35/130101435.db2.gz COVVOSIGSKPGMB-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@H](c2nc(C)cs2)C2CC2)n1 ZINC000273257750 130101793 /nfs/dbraw/zinc/10/17/93/130101793.db2.gz ICNCCJQKGDMPQR-INIZCTEOSA-N 1 2 318.490 4.250 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@H](C)c2ncc(-c3ccccc3)o2)s1 ZINC000273283754 130102902 /nfs/dbraw/zinc/10/29/02/130102902.db2.gz JBQPCIIIIFYWHO-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO CCOc1nnc(C[NH2+][C@@H](C)c2cc3ccccc3s2)s1 ZINC000273308909 130105077 /nfs/dbraw/zinc/10/50/77/130105077.db2.gz OPVNVZBKPHYCFB-JTQLQIEISA-N 1 2 319.455 4.002 20 0 DIADLO Cc1ccsc1[C@H]1C[C@@H]1c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000273977423 130194358 /nfs/dbraw/zinc/19/43/58/130194358.db2.gz QZWWTZCBEZYHIR-KBPBESRZSA-N 1 2 311.410 4.005 20 0 DIADLO Cc1noc(C[NH2+][C@H](C)c2ccc(Cl)c3ccccc32)n1 ZINC000274069667 130202580 /nfs/dbraw/zinc/20/25/80/130202580.db2.gz BWMASMWUXLVYTD-SNVBAGLBSA-N 1 2 301.777 4.035 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2sc(C(C)C)nc2C)s1 ZINC000274146776 130210997 /nfs/dbraw/zinc/21/09/97/130210997.db2.gz DVPBUJHFPKAFEW-SCZZXKLOSA-N 1 2 310.492 4.147 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc(C(F)F)cc3)CCCCC2)no1 ZINC000274223176 130220099 /nfs/dbraw/zinc/22/00/99/130220099.db2.gz VOHZUJLIKGITRB-UHFFFAOYSA-N 1 2 321.371 4.265 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(OC(C)(C)C)cc2)s1 ZINC000274280280 130223706 /nfs/dbraw/zinc/22/37/06/130223706.db2.gz JPUPIDQTGHHZKN-VXGBXAGGSA-N 1 2 319.474 4.436 20 0 DIADLO Fc1cncc(C[N@@H+]2CCC[C@H]2c2nc3ccccc3s2)c1 ZINC000274332031 130227267 /nfs/dbraw/zinc/22/72/67/130227267.db2.gz GALLWTMQQQPXLR-HNNXBMFYSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1cncc(C[N@H+]2CCC[C@H]2c2nc3ccccc3s2)c1 ZINC000274332031 130227270 /nfs/dbraw/zinc/22/72/70/130227270.db2.gz GALLWTMQQQPXLR-HNNXBMFYSA-N 1 2 313.401 4.168 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1nc(Cl)ccc1Cl ZINC000274357903 130228908 /nfs/dbraw/zinc/22/89/08/130228908.db2.gz YRYMOIIGYBMJSS-SNVBAGLBSA-N 1 2 311.212 4.248 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(F)(F)F)cs1)c1cncc(F)c1 ZINC000274409667 130232295 /nfs/dbraw/zinc/23/22/95/130232295.db2.gz RPYJLCAOQAYJFV-SFYZADRCSA-N 1 2 319.327 4.108 20 0 DIADLO CCn1nc(C[NH2+][C@@H](C)c2cccc(F)c2F)c2ccccc21 ZINC000274462448 130237959 /nfs/dbraw/zinc/23/79/59/130237959.db2.gz SZGDUWBJQRPKAM-LBPRGKRZSA-N 1 2 315.367 4.185 20 0 DIADLO Cc1ccn2cc(C[NH2+][C@@H](C)c3csc(C(C)C)n3)nc2c1 ZINC000274476446 130239240 /nfs/dbraw/zinc/23/92/40/130239240.db2.gz QMVDDYYCUDCMPS-ZDUSSCGKSA-N 1 2 314.458 4.073 20 0 DIADLO Cc1ccn2cc(CN[C@@H](C)c3csc(C(C)C)n3)[nH+]c2c1 ZINC000274476446 130239242 /nfs/dbraw/zinc/23/92/42/130239242.db2.gz QMVDDYYCUDCMPS-ZDUSSCGKSA-N 1 2 314.458 4.073 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)c(F)c1)c1nc(C(F)(F)F)cs1 ZINC000274634504 130250557 /nfs/dbraw/zinc/25/05/57/130250557.db2.gz SBOYHSRCVSVGIL-ZETCQYMHSA-N 1 2 322.302 4.291 20 0 DIADLO CCCc1cccc(C[NH2+]Cc2cc(COC(C)(C)C)on2)c1 ZINC000275036529 130285475 /nfs/dbraw/zinc/28/54/75/130285475.db2.gz XBWZSDSWODSGNF-UHFFFAOYSA-N 1 2 316.445 4.232 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(Oc2ccccc2)cc1)c1ncn(C)n1 ZINC000275709904 130367692 /nfs/dbraw/zinc/36/76/92/130367692.db2.gz LXQTZGVFRHNYJJ-GJZGRUSLSA-N 1 2 322.412 4.019 20 0 DIADLO C[C@H](Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)c1ccccn1 ZINC000278450950 130693266 /nfs/dbraw/zinc/69/32/66/130693266.db2.gz LMZRQYVQUZMFMR-HNNXBMFYSA-N 1 2 318.424 4.455 20 0 DIADLO O=C(c1ccc(F)c2ccccc12)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000280944619 130828352 /nfs/dbraw/zinc/82/83/52/130828352.db2.gz ZLCKWVQQZZLCBC-QGZVFWFLSA-N 1 2 323.371 4.069 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nc3cc(Cl)ccc3n2C)oc1C ZINC000282874202 130944334 /nfs/dbraw/zinc/94/43/34/130944334.db2.gz VHZSZJCZMPKUMP-NSHDSACASA-N 1 2 317.820 4.287 20 0 DIADLO Cc1noc(C)c1COc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000284072679 131045687 /nfs/dbraw/zinc/04/56/87/131045687.db2.gz KDMZTZRCWXTWDZ-UHFFFAOYSA-N 1 2 323.396 4.070 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](COc2ccccc2)c2ccccc2)no1 ZINC000284963126 131126866 /nfs/dbraw/zinc/12/68/66/131126866.db2.gz FMPGLABKYFEMDR-JXFKEZNVSA-N 1 2 322.408 4.454 20 0 DIADLO Cc1cc([C@@H](C)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)no1 ZINC000285165694 131144484 /nfs/dbraw/zinc/14/44/84/131144484.db2.gz MRQVLCVYVJQOEP-CQSZACIVSA-N 1 2 322.412 4.356 20 0 DIADLO OC1CC[NH+](c2ccc(NCc3ccc4occc4c3)cc2)CC1 ZINC000285364948 131161322 /nfs/dbraw/zinc/16/13/22/131161322.db2.gz FJXWNVZAFZTQFX-UHFFFAOYSA-N 1 2 322.408 4.006 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1csc(C(C)(C)C)n1 ZINC000285528692 131177292 /nfs/dbraw/zinc/17/72/92/131177292.db2.gz PRLAECXASZXUSH-UHFFFAOYSA-N 1 2 307.463 4.070 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(F)cc1F ZINC000285786269 131202256 /nfs/dbraw/zinc/20/22/56/131202256.db2.gz SUEAYXCCTHZZHH-VFZGTOFNSA-N 1 2 312.310 4.440 20 0 DIADLO CC(C)c1csc(C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)n1 ZINC000286124169 131220098 /nfs/dbraw/zinc/22/00/98/131220098.db2.gz OGUMIJYZXMRJQZ-INIZCTEOSA-N 1 2 318.490 4.401 20 0 DIADLO CC(C)c1nn(C)cc1N[C@H](c1[nH]cc[nH+]1)C1CCCCC1 ZINC000286366615 131232923 /nfs/dbraw/zinc/23/29/23/131232923.db2.gz AAXAZSUQGFQFIY-INIZCTEOSA-N 1 2 301.438 4.000 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cscc2Br)s1 ZINC000286415659 131235725 /nfs/dbraw/zinc/23/57/25/131235725.db2.gz ICYQXPVZCNMNIT-MRVPVSSYSA-N 1 2 317.277 4.126 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ccc2occc2c1)c1nc(C2CC2)no1 ZINC000286617002 131243011 /nfs/dbraw/zinc/24/30/11/131243011.db2.gz RVYCTEPJATYPKV-INIZCTEOSA-N 1 2 311.385 4.180 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)cc1 ZINC000287437573 131280515 /nfs/dbraw/zinc/28/05/15/131280515.db2.gz PXHGJLUKKUYWGN-QGZVFWFLSA-N 1 2 311.429 4.373 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)cc1 ZINC000287437573 131280517 /nfs/dbraw/zinc/28/05/17/131280517.db2.gz PXHGJLUKKUYWGN-QGZVFWFLSA-N 1 2 311.429 4.373 20 0 DIADLO Cc1ccc(NC(=O)Nc2c(C)cc[nH+]c2C)cc1OC(F)F ZINC000287438100 131280942 /nfs/dbraw/zinc/28/09/42/131280942.db2.gz HCJSXVIYGQMAMN-UHFFFAOYSA-N 1 2 321.327 4.252 20 0 DIADLO c1csc(C[N@@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)c1 ZINC000287435426 131280958 /nfs/dbraw/zinc/28/09/58/131280958.db2.gz PUBNRVWSOPFMNQ-AWEZNQCLSA-N 1 2 303.431 4.126 20 0 DIADLO c1csc(C[N@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)c1 ZINC000287435426 131280960 /nfs/dbraw/zinc/28/09/60/131280960.db2.gz PUBNRVWSOPFMNQ-AWEZNQCLSA-N 1 2 303.431 4.126 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)Cc1ccccc1Cl ZINC000287482347 131282835 /nfs/dbraw/zinc/28/28/35/131282835.db2.gz KGGBDJBASVGSLE-UHFFFAOYSA-N 1 2 303.793 4.016 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NC[C@@H](C)Sc1ccccc1 ZINC000287492771 131283289 /nfs/dbraw/zinc/28/32/89/131283289.db2.gz KYGGDPKUZIMGHN-CYBMUJFWSA-N 1 2 315.442 4.001 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@H](C)c1ccc(F)cc1 ZINC000287593600 131289087 /nfs/dbraw/zinc/28/90/87/131289087.db2.gz ROOMRDPYIAWWRG-CYBMUJFWSA-N 1 2 301.365 4.062 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@H](c2ccccc2)[C@H]1C ZINC000287621411 131291660 /nfs/dbraw/zinc/29/16/60/131291660.db2.gz UFOCRFPQRKZNFM-WBVHZDCISA-N 1 2 309.413 4.108 20 0 DIADLO CC[C@@H](c1ccncc1)N(CC)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287640040 131292621 /nfs/dbraw/zinc/29/26/21/131292621.db2.gz VPLYZRRYWQXAIV-INIZCTEOSA-N 1 2 312.417 4.099 20 0 DIADLO COc1ccncc1C[N@H+](C)[C@H](C)c1sc(C(C)C)nc1C ZINC000287750428 131298407 /nfs/dbraw/zinc/29/84/07/131298407.db2.gz LOWNCPBWRUVFRJ-CYBMUJFWSA-N 1 2 319.474 4.172 20 0 DIADLO COc1ccncc1C[N@@H+](C)[C@H](C)c1sc(C(C)C)nc1C ZINC000287750428 131298410 /nfs/dbraw/zinc/29/84/10/131298410.db2.gz LOWNCPBWRUVFRJ-CYBMUJFWSA-N 1 2 319.474 4.172 20 0 DIADLO C[C@@H](O)c1ncc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)s1 ZINC000288952741 131347796 /nfs/dbraw/zinc/34/77/96/131347796.db2.gz AGOYBOIHJSWVSC-WDEREUQCSA-N 1 2 310.850 4.043 20 0 DIADLO C[C@@H](O)c1ncc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)s1 ZINC000288952741 131347797 /nfs/dbraw/zinc/34/77/97/131347797.db2.gz AGOYBOIHJSWVSC-WDEREUQCSA-N 1 2 310.850 4.043 20 0 DIADLO CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1nccn1C(C)C ZINC000289351421 131376738 /nfs/dbraw/zinc/37/67/38/131376738.db2.gz GFIWMVYADGPFNH-QGZVFWFLSA-N 1 2 301.434 4.056 20 0 DIADLO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1nccn1C(C)C ZINC000289351421 131376739 /nfs/dbraw/zinc/37/67/39/131376739.db2.gz GFIWMVYADGPFNH-QGZVFWFLSA-N 1 2 301.434 4.056 20 0 DIADLO Cc1nc(C[N@H+](CCc2ccccc2)Cc2ccncc2)cs1 ZINC000289574101 131396943 /nfs/dbraw/zinc/39/69/43/131396943.db2.gz ZYYHOJFSZBOXDZ-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO Cc1nc(C[N@@H+](CCc2ccccc2)Cc2ccncc2)cs1 ZINC000289574101 131396945 /nfs/dbraw/zinc/39/69/45/131396945.db2.gz ZYYHOJFSZBOXDZ-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2sc(C(C)(C)C)nc2C)s1 ZINC000289576520 131397083 /nfs/dbraw/zinc/39/70/83/131397083.db2.gz AFYAMXKXTCICND-VIFPVBQESA-N 1 2 324.519 4.014 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2ccc(OC(C)(C)C)cc2)s1 ZINC000289597713 131399540 /nfs/dbraw/zinc/39/95/40/131399540.db2.gz BKGHVQBRLUCOIF-LBPRGKRZSA-N 1 2 319.474 4.129 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+]Cc2nnc(CC)s2)cc1 ZINC000290142290 131457796 /nfs/dbraw/zinc/45/77/96/131457796.db2.gz KRTBMGBDCQYFJV-CYBMUJFWSA-N 1 2 319.474 4.130 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)CCCC1CCCC1 ZINC000366688400 131630104 /nfs/dbraw/zinc/63/01/04/131630104.db2.gz ZFUZLIZNMDDRDX-QGZVFWFLSA-N 1 2 317.477 4.317 20 0 DIADLO C[C@@H]1C[C@@H](Nc2cccc([NH+]3CCCCCC3)c2)c2nccn21 ZINC000296265137 131952367 /nfs/dbraw/zinc/95/23/67/131952367.db2.gz BURKSPTUEMGMSG-CRAIPNDOSA-N 1 2 310.445 4.381 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1[C@H](C)C[C@@H](c2ccccc2)[C@@H]1C ZINC000297197436 132003598 /nfs/dbraw/zinc/00/35/98/132003598.db2.gz XQIIWAGUPPAZID-UWWQBHOKSA-N 1 2 323.440 4.497 20 0 DIADLO COCc1cc(C[NH2+]Cc2ccc(-c3cccc(C)c3)cc2)no1 ZINC000297287713 132007599 /nfs/dbraw/zinc/00/75/99/132007599.db2.gz AHRRVIZKRZUZFZ-UHFFFAOYSA-N 1 2 322.408 4.086 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1[C@H](C)C[C@H](c2ccccc2)[C@H]1C ZINC000297831647 132035910 /nfs/dbraw/zinc/03/59/10/132035910.db2.gz RIDVJZHSCXBNPV-INMHGKMJSA-N 1 2 309.413 4.188 20 0 DIADLO Cc1noc(C)c1C[N@@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000298448977 132063806 /nfs/dbraw/zinc/06/38/06/132063806.db2.gz UNNMFCULZQYOLG-BZNIZROVSA-N 1 2 300.402 4.172 20 0 DIADLO Cc1noc(C)c1C[N@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000298448977 132063810 /nfs/dbraw/zinc/06/38/10/132063810.db2.gz UNNMFCULZQYOLG-BZNIZROVSA-N 1 2 300.402 4.172 20 0 DIADLO Cc1[nH+]c2cc(CNC(=O)C[C@H]3C=CCCC3)ccc2n1C1CC1 ZINC000298554956 132067424 /nfs/dbraw/zinc/06/74/24/132067424.db2.gz YKTUPZNTSMVBCU-HNNXBMFYSA-N 1 2 323.440 4.042 20 0 DIADLO CCC[N@H+](Cc1nccn1C(F)F)[C@H](C)c1ccccc1OC ZINC000299408161 132103818 /nfs/dbraw/zinc/10/38/18/132103818.db2.gz OCBCMOGRFKUACX-CYBMUJFWSA-N 1 2 323.387 4.260 20 0 DIADLO CCC[N@@H+](Cc1nccn1C(F)F)[C@H](C)c1ccccc1OC ZINC000299408161 132103819 /nfs/dbraw/zinc/10/38/19/132103819.db2.gz OCBCMOGRFKUACX-CYBMUJFWSA-N 1 2 323.387 4.260 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000121656077 132157166 /nfs/dbraw/zinc/15/71/66/132157166.db2.gz GMZWKHBPMCDOQH-NSHDSACASA-N 1 2 318.446 4.027 20 0 DIADLO c1nc(C[N@@H+]2CCc3cc(-c4ccccc4)oc3C2)oc1C1CC1 ZINC000340695142 132160818 /nfs/dbraw/zinc/16/08/18/132160818.db2.gz IDUYWIOKPFXSBC-UHFFFAOYSA-N 1 2 320.392 4.370 20 0 DIADLO c1nc(C[N@H+]2CCc3cc(-c4ccccc4)oc3C2)oc1C1CC1 ZINC000340695142 132160820 /nfs/dbraw/zinc/16/08/20/132160820.db2.gz IDUYWIOKPFXSBC-UHFFFAOYSA-N 1 2 320.392 4.370 20 0 DIADLO Cc1nc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)cs1 ZINC000340704731 132163278 /nfs/dbraw/zinc/16/32/78/132163278.db2.gz CIRQMGNEISZVPH-UHFFFAOYSA-N 1 2 312.360 4.249 20 0 DIADLO Cc1cc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)n(C)n1 ZINC000417706442 335065461 /nfs/dbraw/zinc/06/54/61/335065461.db2.gz UEXQKHNNUUVTOJ-CYBMUJFWSA-N 1 2 303.837 4.108 20 0 DIADLO Cc1cc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)n(C)n1 ZINC000417706442 335065462 /nfs/dbraw/zinc/06/54/62/335065462.db2.gz UEXQKHNNUUVTOJ-CYBMUJFWSA-N 1 2 303.837 4.108 20 0 DIADLO Cc1nc([C@@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)cs1 ZINC000036988693 134698685 /nfs/dbraw/zinc/69/86/85/134698685.db2.gz LYXWLHNSHBEAHY-GFCCVEGCSA-N 1 2 302.447 4.010 20 0 DIADLO Brc1sccc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000529517141 335087195 /nfs/dbraw/zinc/08/71/95/335087195.db2.gz HPDNLHWXQYRXCA-LBPRGKRZSA-N 1 2 311.248 4.176 20 0 DIADLO Brc1sccc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000529517141 335087197 /nfs/dbraw/zinc/08/71/97/335087197.db2.gz HPDNLHWXQYRXCA-LBPRGKRZSA-N 1 2 311.248 4.176 20 0 DIADLO Cn1c2ccccc2[nH+]c1N[C@@H]1CCCOc2ccc(F)cc21 ZINC000534244159 435273902 /nfs/dbraw/zinc/27/39/02/435273902.db2.gz PSQNEVNBFFEWBQ-CQSZACIVSA-N 1 2 311.360 4.038 20 0 DIADLO CCc1csc([C@H](C)Nc2[nH+]c(C3CC3)nc3[nH]ccc32)n1 ZINC000631318465 435402030 /nfs/dbraw/zinc/40/20/30/435402030.db2.gz GSQADEWFWIOFLD-VIFPVBQESA-N 1 2 313.430 4.027 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H]1CCC(C)=C(C)C1 ZINC000570635110 332787848 /nfs/dbraw/zinc/78/78/48/332787848.db2.gz WGSXRIWHEHNQBL-INIZCTEOSA-N 1 2 309.413 4.460 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)N[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000575014777 332854232 /nfs/dbraw/zinc/85/42/32/332854232.db2.gz XBODVQDCYCDDGS-JEBQAFNWSA-N 1 2 323.396 4.184 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)c2ccc(Cl)s2)c(C)[nH+]1 ZINC000175727024 332905107 /nfs/dbraw/zinc/90/51/07/332905107.db2.gz DABIGYRPRIOSPR-SNVBAGLBSA-N 1 2 308.834 4.464 20 0 DIADLO CC[C@@H](Oc1ccccc1C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000175727066 332905092 /nfs/dbraw/zinc/90/50/92/332905092.db2.gz JVDNWMBSCWZEJN-MRXNPFEDSA-N 1 2 312.413 4.111 20 0 DIADLO COc1cc[nH+]cc1NCc1ccc(-c2ccccc2OC)cc1 ZINC000533452561 331535293 /nfs/dbraw/zinc/53/52/93/331535293.db2.gz REEKKJIQMBMDKC-UHFFFAOYSA-N 1 2 320.392 4.378 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H]2COc3c2ccc(Cl)c3Cl)no1 ZINC000370543555 331550950 /nfs/dbraw/zinc/55/09/50/331550950.db2.gz IEJRBHZMRQOXJR-QPUJVOFHSA-N 1 2 313.184 4.074 20 0 DIADLO Fc1cc(NCc2ccc(-n3cc[nH+]c3)cc2)ccc1Cl ZINC000037300881 331552198 /nfs/dbraw/zinc/55/21/98/331552198.db2.gz YLQMVZMTECSJQC-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO CCc1sc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1C ZINC000047514998 331582289 /nfs/dbraw/zinc/58/22/89/331582289.db2.gz IQYWJYJJTMOLAN-UHFFFAOYSA-N 1 2 311.410 4.057 20 0 DIADLO Cc1csc(C[NH2+][C@H](CC(F)(F)F)c2ccccc2)n1 ZINC000038091150 331596368 /nfs/dbraw/zinc/59/63/68/331596368.db2.gz NPIMXKAJHLQPHK-GFCCVEGCSA-N 1 2 300.349 4.235 20 0 DIADLO CC[C@@H]([NH2+]Cc1c(C)noc1C)c1nc(C(F)(F)F)cs1 ZINC000185920830 331702329 /nfs/dbraw/zinc/70/23/29/331702329.db2.gz QTPLGHZTXLICND-SNVBAGLBSA-N 1 2 319.352 4.008 20 0 DIADLO Cc1ccc(NC(=O)c2csc(C3CCCCC3)n2)c(C)[nH+]1 ZINC000556854629 331741863 /nfs/dbraw/zinc/74/18/63/331741863.db2.gz YWCOFZGNGSFWFU-UHFFFAOYSA-N 1 2 315.442 4.455 20 0 DIADLO CC[C@H](C)CC(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000558393776 331901708 /nfs/dbraw/zinc/90/17/08/331901708.db2.gz UQYPTZAETOKCNA-AWEZNQCLSA-N 1 2 311.429 4.261 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)cs1 ZINC000517863141 331974979 /nfs/dbraw/zinc/97/49/79/331974979.db2.gz VMIRQHWSLBPBGB-YOEHRIQHSA-N 1 2 311.454 4.230 20 0 DIADLO OC[C@@H]([NH2+]Cc1ccc(C2CCC2)cc1)c1c(F)cccc1F ZINC000559268033 332010372 /nfs/dbraw/zinc/01/03/72/332010372.db2.gz VNSFHHIFBXCYDE-GOSISDBHSA-N 1 2 317.379 4.056 20 0 DIADLO Cc1nnsc1C[N@@H+](C)[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000518381148 332022555 /nfs/dbraw/zinc/02/25/55/332022555.db2.gz INBCTHCNDFRVJP-SNVBAGLBSA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nnsc1C[N@H+](C)[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000518381148 332022557 /nfs/dbraw/zinc/02/25/57/332022557.db2.gz INBCTHCNDFRVJP-SNVBAGLBSA-N 1 2 315.364 4.058 20 0 DIADLO COc1ccccc1C[N@H+](Cc1ncc(C(C)(C)C)o1)C1CC1 ZINC000409447525 332033051 /nfs/dbraw/zinc/03/30/51/332033051.db2.gz JOPFHWJJTQICFY-UHFFFAOYSA-N 1 2 314.429 4.145 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1ncc(C(C)(C)C)o1)C1CC1 ZINC000409447525 332033052 /nfs/dbraw/zinc/03/30/52/332033052.db2.gz JOPFHWJJTQICFY-UHFFFAOYSA-N 1 2 314.429 4.145 20 0 DIADLO COc1cccc2c(N[C@@H]3CCCC34CCOCC4)cc[nH+]c12 ZINC000409675427 332046735 /nfs/dbraw/zinc/04/67/35/332046735.db2.gz KIPWNKBWWBGXRJ-QGZVFWFLSA-N 1 2 312.413 4.005 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(COc3ccc(Cl)cc3)n2)[C@H]1C ZINC000559351130 332060061 /nfs/dbraw/zinc/06/00/61/332060061.db2.gz ZBSBBIPQXYJOFO-NEPJUHHUSA-N 1 2 322.861 4.216 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(COc3ccc(Cl)cc3)n2)[C@H]1C ZINC000559351130 332060062 /nfs/dbraw/zinc/06/00/62/332060062.db2.gz ZBSBBIPQXYJOFO-NEPJUHHUSA-N 1 2 322.861 4.216 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)s1 ZINC000569438170 332082865 /nfs/dbraw/zinc/08/28/65/332082865.db2.gz QPERHBSGQVNBKP-QGZVFWFLSA-N 1 2 304.434 4.337 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC[C@](F)(c3ccccc3)C2)s1 ZINC000569438170 332082866 /nfs/dbraw/zinc/08/28/66/332082866.db2.gz QPERHBSGQVNBKP-QGZVFWFLSA-N 1 2 304.434 4.337 20 0 DIADLO Fc1ccc2c(c1)CC[N@@H+](Cc1ncc(-c3ccccc3)o1)C2 ZINC000091892319 332113760 /nfs/dbraw/zinc/11/37/60/332113760.db2.gz VTFZZSUFHNXXMB-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1ccc2c(c1)CC[N@H+](Cc1ncc(-c3ccccc3)o1)C2 ZINC000091892319 332113761 /nfs/dbraw/zinc/11/37/61/332113761.db2.gz VTFZZSUFHNXXMB-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO CC[C@H](C)Sc1ccc(NC(=O)Cc2[nH]c[nH+]c2C)c(C)c1 ZINC000569578005 332143209 /nfs/dbraw/zinc/14/32/09/332143209.db2.gz GLHOBMJSCMVRRR-LBPRGKRZSA-N 1 2 317.458 4.098 20 0 DIADLO CCc1nc(C[N@H+](Cc2ccccc2)[C@H]2CCCC2(C)C)no1 ZINC000426804095 332155394 /nfs/dbraw/zinc/15/53/94/332155394.db2.gz RUTSUCSIKBXXJH-INIZCTEOSA-N 1 2 313.445 4.213 20 0 DIADLO CCc1nc(C[N@@H+](Cc2ccccc2)[C@H]2CCCC2(C)C)no1 ZINC000426804095 332155395 /nfs/dbraw/zinc/15/53/95/332155395.db2.gz RUTSUCSIKBXXJH-INIZCTEOSA-N 1 2 313.445 4.213 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(F)c(Br)c2)CCC1(F)F ZINC000584260570 332174998 /nfs/dbraw/zinc/17/49/98/332174998.db2.gz KOXWUJACKMAICS-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(F)c(Br)c2)CCC1(F)F ZINC000584260570 332175000 /nfs/dbraw/zinc/17/50/00/332175000.db2.gz KOXWUJACKMAICS-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO Fc1cccc([C@@H]([NH2+]Cc2cocn2)c2cccc(Cl)c2)c1 ZINC000181109677 332175732 /nfs/dbraw/zinc/17/57/32/332175732.db2.gz VUCOIFYNKYYVMR-KRWDZBQOSA-N 1 2 316.763 4.346 20 0 DIADLO COc1cc(C)[nH+]c(CNc2ccc(F)cc2OC(C)(C)C)c1 ZINC000539856077 332947654 /nfs/dbraw/zinc/94/76/54/332947654.db2.gz HJIKCYBYMBLPIT-UHFFFAOYSA-N 1 2 318.392 4.327 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000181169493 332186895 /nfs/dbraw/zinc/18/68/95/332186895.db2.gz RKISTYDNGQFBEX-ZDUSSCGKSA-N 1 2 317.392 4.428 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000181169493 332186896 /nfs/dbraw/zinc/18/68/96/332186896.db2.gz RKISTYDNGQFBEX-ZDUSSCGKSA-N 1 2 317.392 4.428 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccn1C1CCCC1 ZINC000181220686 332187077 /nfs/dbraw/zinc/18/70/77/332187077.db2.gz UZTXUADISQDHOT-UHFFFAOYSA-N 1 2 320.396 4.246 20 0 DIADLO CC1(C)CN(C(=O)c2ccccc2Oc2cc[nH+]cc2)[C@@H]1C1CC1 ZINC000427244933 332187559 /nfs/dbraw/zinc/18/75/59/332187559.db2.gz XONRRXFBFFKNFP-GOSISDBHSA-N 1 2 322.408 4.135 20 0 DIADLO CC[C@@H](Nc1cnn(-c2cc(C)ccc2C)c1C)c1[nH+]ccn1C ZINC000181238781 332187648 /nfs/dbraw/zinc/18/76/48/332187648.db2.gz RZDKBPNKAKYIRV-MRXNPFEDSA-N 1 2 323.444 4.094 20 0 DIADLO CC[C@H](Nc1cnn(-c2cc(C)ccc2C)c1C)c1[nH+]ccn1C ZINC000181238760 332187789 /nfs/dbraw/zinc/18/77/89/332187789.db2.gz RZDKBPNKAKYIRV-INIZCTEOSA-N 1 2 323.444 4.094 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(-c2ccco2)cc1F)c1nccn1C ZINC000448022537 332188488 /nfs/dbraw/zinc/18/84/88/332188488.db2.gz OIVSSKLDQFPBAU-MRXNPFEDSA-N 1 2 313.376 4.060 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ncc(-c3ccccc3C)o2)C[C@H](CC)O1 ZINC000584285056 332212017 /nfs/dbraw/zinc/21/20/17/332212017.db2.gz SEWWABBOKFYFCI-IYBDPMFKSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ncc(-c3ccccc3C)o2)C[C@H](CC)O1 ZINC000584285056 332212019 /nfs/dbraw/zinc/21/20/19/332212019.db2.gz SEWWABBOKFYFCI-IYBDPMFKSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@H]1C[NH+](Cc2ncc(-c3ccccc3C)o2)C[C@H](CC)O1 ZINC000584285054 332212037 /nfs/dbraw/zinc/21/20/37/332212037.db2.gz SEWWABBOKFYFCI-HOTGVXAUSA-N 1 2 314.429 4.039 20 0 DIADLO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000537959254 332218006 /nfs/dbraw/zinc/21/80/06/332218006.db2.gz ZBUDMSAYOVSSEO-HNNXBMFYSA-N 1 2 313.445 4.166 20 0 DIADLO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000537959255 332218059 /nfs/dbraw/zinc/21/80/59/332218059.db2.gz ZBUDMSAYOVSSEO-OAHLLOKOSA-N 1 2 313.445 4.166 20 0 DIADLO COC[C@H]([NH2+]Cc1c(Cl)oc2ccccc21)c1ccc(C)o1 ZINC000536373294 332234684 /nfs/dbraw/zinc/23/46/84/332234684.db2.gz CRWMOZXNQFLAQU-AWEZNQCLSA-N 1 2 319.788 4.465 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1sccc1Br ZINC000043511809 332278777 /nfs/dbraw/zinc/27/87/77/332278777.db2.gz PYQSDHMFPUGIAC-UHFFFAOYSA-N 1 2 300.221 4.044 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1sccc1Br ZINC000043511809 332278776 /nfs/dbraw/zinc/27/87/76/332278776.db2.gz PYQSDHMFPUGIAC-UHFFFAOYSA-N 1 2 300.221 4.044 20 0 DIADLO CC[C@@]1(C)C[C@H]1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000425566749 335103423 /nfs/dbraw/zinc/10/34/23/335103423.db2.gz IFLOLWNYEGQTIU-JXFKEZNVSA-N 1 2 323.440 4.261 20 0 DIADLO CC(F)(F)C[NH2+][C@@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000559890893 332290006 /nfs/dbraw/zinc/29/00/06/332290006.db2.gz KLJXYPGEZPTREJ-HNNXBMFYSA-N 1 2 310.775 4.264 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(Br)s2)no1 ZINC000559906740 332291282 /nfs/dbraw/zinc/29/12/82/332291282.db2.gz ABCVSQUUVQITHT-BDAKNGLRSA-N 1 2 315.236 4.219 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(Br)s2)no1 ZINC000559906741 332291383 /nfs/dbraw/zinc/29/13/83/332291383.db2.gz ABCVSQUUVQITHT-IUCAKERBSA-N 1 2 315.236 4.219 20 0 DIADLO CCOc1cc(NCc2c[nH+]c3ccc(Cl)cn23)ccc1C ZINC000560065930 332308287 /nfs/dbraw/zinc/30/82/87/332308287.db2.gz XILYWXJIBOGCGV-UHFFFAOYSA-N 1 2 315.804 4.307 20 0 DIADLO CC[C@H]1COCC[N@@H+]1Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000560260869 332324692 /nfs/dbraw/zinc/32/46/92/332324692.db2.gz AOBFHZIHRXUMIE-AWEZNQCLSA-N 1 2 322.861 4.074 20 0 DIADLO CC[C@H]1COCC[N@H+]1Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000560260869 332324694 /nfs/dbraw/zinc/32/46/94/332324694.db2.gz AOBFHZIHRXUMIE-AWEZNQCLSA-N 1 2 322.861 4.074 20 0 DIADLO Cc1ccc2[nH+]c(CNc3ccc(-c4nccs4)cc3)cn2c1 ZINC000560263320 332325380 /nfs/dbraw/zinc/32/53/80/332325380.db2.gz YVFOVPXVHITLSJ-UHFFFAOYSA-N 1 2 320.421 4.378 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@@H](C)c2cccc(C)c2C)n1 ZINC000115602855 332333908 /nfs/dbraw/zinc/33/39/08/332333908.db2.gz VVPUOIHIALJYTJ-GJZGRUSLSA-N 1 2 301.434 4.441 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)ccc1OCC1CC1)c1cscn1 ZINC000574340018 332347853 /nfs/dbraw/zinc/34/78/53/332347853.db2.gz RBJHGBCHTNSKOW-NSHDSACASA-N 1 2 322.861 4.436 20 0 DIADLO C[C@H]([NH2+][C@H](Cc1ccccc1)c1ccccc1F)c1ncc[nH]1 ZINC000560530057 332352240 /nfs/dbraw/zinc/35/22/40/332352240.db2.gz YRLBNYZOHGUHIC-KBXCAEBGSA-N 1 2 309.388 4.183 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(F)c(Cl)c2)[C@H]1c1ccncc1 ZINC000560546219 332356974 /nfs/dbraw/zinc/35/69/74/332356974.db2.gz UXIZJYHLESXZGW-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(F)c(Cl)c2)[C@H]1c1ccncc1 ZINC000560546219 332356975 /nfs/dbraw/zinc/35/69/75/332356975.db2.gz UXIZJYHLESXZGW-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO CC(C)[C@@H]1CC[C@@H]1Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000560553250 332358875 /nfs/dbraw/zinc/35/88/75/332358875.db2.gz PNPHMTQAXATHFH-LPHOPBHVSA-N 1 2 307.441 4.448 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](Cc2ccccc2)C2CC2)n1 ZINC000119214157 332367056 /nfs/dbraw/zinc/36/70/56/332367056.db2.gz BRTHRBMNEMYAOW-ZDUSSCGKSA-N 1 2 317.458 4.048 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](Cc2ccccc2)C2CC2)n1 ZINC000119214157 332367057 /nfs/dbraw/zinc/36/70/57/332367057.db2.gz BRTHRBMNEMYAOW-ZDUSSCGKSA-N 1 2 317.458 4.048 20 0 DIADLO C[N@H+](Cc1cc2ccc(F)cc2[nH]1)Cc1c(F)cccc1F ZINC000560602458 332368102 /nfs/dbraw/zinc/36/81/02/332368102.db2.gz MOACHYIQKRFWMX-UHFFFAOYSA-N 1 2 304.315 4.217 20 0 DIADLO C[N@@H+](Cc1cc2ccc(F)cc2[nH]1)Cc1c(F)cccc1F ZINC000560602458 332368104 /nfs/dbraw/zinc/36/81/04/332368104.db2.gz MOACHYIQKRFWMX-UHFFFAOYSA-N 1 2 304.315 4.217 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1ccccc1OC1CCCC1 ZINC000560607964 332368998 /nfs/dbraw/zinc/36/89/98/332368998.db2.gz ACTVTQODPXQXHC-UHFFFAOYSA-N 1 2 314.429 4.190 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1ccccc1OC1CCCC1 ZINC000560607964 332368999 /nfs/dbraw/zinc/36/89/99/332368999.db2.gz ACTVTQODPXQXHC-UHFFFAOYSA-N 1 2 314.429 4.190 20 0 DIADLO Cc1ccc(OCCCC(=O)Nc2c(C)cc[nH+]c2C)cc1C ZINC000425585775 335107065 /nfs/dbraw/zinc/10/70/65/335107065.db2.gz IOQZJYCUCHTRAX-UHFFFAOYSA-N 1 2 312.413 4.113 20 0 DIADLO CCc1ccc(NC(=O)c2cccc(Cn3cc[nH+]c3)c2)cc1C ZINC000560653539 332373981 /nfs/dbraw/zinc/37/39/81/332373981.db2.gz FBWAVLXNAWXKGM-UHFFFAOYSA-N 1 2 319.408 4.055 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+](C)[C@H](C)c1cccnc1 ZINC000583388864 332380687 /nfs/dbraw/zinc/38/06/87/332380687.db2.gz IFMPIXGNWNRECV-CYBMUJFWSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000583388864 332380688 /nfs/dbraw/zinc/38/06/88/332380688.db2.gz IFMPIXGNWNRECV-CYBMUJFWSA-N 1 2 304.821 4.327 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)COc1ccccc1C(C)(C)C ZINC000425587914 335107584 /nfs/dbraw/zinc/10/75/84/335107584.db2.gz OZQBIJBNCLMRHE-UHFFFAOYSA-N 1 2 312.413 4.013 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2ccc(-c3ccc(C)cc3)s2)n1 ZINC000560817118 332388175 /nfs/dbraw/zinc/38/81/75/332388175.db2.gz STENPCIQHCIUSY-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)CCc1ccccc1F ZINC000425589578 335108231 /nfs/dbraw/zinc/10/82/31/335108231.db2.gz UEXGXIKXDOTPGL-ZDUSSCGKSA-N 1 2 300.377 4.045 20 0 DIADLO COc1ccc(CCCCC(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000425590107 335108318 /nfs/dbraw/zinc/10/83/18/335108318.db2.gz VMUYWDZHUNRRAU-UHFFFAOYSA-N 1 2 312.413 4.059 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000425590799 335108542 /nfs/dbraw/zinc/10/85/42/335108542.db2.gz XVOUHPYYRMFODP-VXGBXAGGSA-N 1 2 300.324 4.006 20 0 DIADLO CCSCc1ccc(C(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000425590765 335108571 /nfs/dbraw/zinc/10/85/71/335108571.db2.gz XTHACBNXKJCFSV-UHFFFAOYSA-N 1 2 300.427 4.204 20 0 DIADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)[C@@]12C[C@@H]1CCC2 ZINC000425570743 335104545 /nfs/dbraw/zinc/10/45/45/335104545.db2.gz MFSJJZWMUHDEPI-XOBRGWDASA-N 1 2 321.424 4.015 20 0 DIADLO Cc1cc[nH+]c(NCc2cc3ccccc3[nH]2)c1Br ZINC000561160262 332418505 /nfs/dbraw/zinc/41/85/05/332418505.db2.gz BWUWSGPPOFMPHT-UHFFFAOYSA-N 1 2 316.202 4.246 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]Cc2ccc(F)c(Cl)c2Cl)c2nccn21 ZINC000449569940 332424301 /nfs/dbraw/zinc/42/43/01/332424301.db2.gz IMWXRSQCNYKYGM-KCJUWKMLSA-N 1 2 314.191 4.125 20 0 DIADLO C[C@H](O)C[C@H](CNc1cc(C(F)(F)F)cc[nH+]1)c1ccccc1 ZINC000561259035 332431194 /nfs/dbraw/zinc/43/11/94/332431194.db2.gz INWKJOPMMRBOQI-GXTWGEPZSA-N 1 2 324.346 4.067 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)Cc1cccc(Cl)c1 ZINC000425578567 335105742 /nfs/dbraw/zinc/10/57/42/335105742.db2.gz BYWZMIADXBSSAK-LBPRGKRZSA-N 1 2 302.805 4.169 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000425583457 335106629 /nfs/dbraw/zinc/10/66/29/335106629.db2.gz ABBVYROISFXOHU-VXGBXAGGSA-N 1 2 318.779 4.233 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)COc1ccc(C(C)C)c(C)c1 ZINC000425583476 335106671 /nfs/dbraw/zinc/10/66/71/335106671.db2.gz AKOOXHAXWANMNE-UHFFFAOYSA-N 1 2 312.413 4.148 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)COc1ccc(C(C)(C)C)cc1 ZINC000425584602 335106895 /nfs/dbraw/zinc/10/68/95/335106895.db2.gz DUXHGYWCOOSEOK-UHFFFAOYSA-N 1 2 312.413 4.013 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)c2ccc(F)c(F)c2)c(C)[nH+]1 ZINC000525657756 332532593 /nfs/dbraw/zinc/53/25/93/332532593.db2.gz PLZPZMGCILKFAT-LLVKDONJSA-N 1 2 304.340 4.027 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2cccc(C(F)F)c2)c(C)[nH+]1 ZINC000448126081 332533706 /nfs/dbraw/zinc/53/37/06/332533706.db2.gz PWLNZJKSGKKRKC-UHFFFAOYSA-N 1 2 304.340 4.126 20 0 DIADLO C[C@@H]([NH2+]C/C=C/c1ccc(F)cc1F)c1nc(C(C)(C)C)no1 ZINC000562034006 332534790 /nfs/dbraw/zinc/53/47/90/332534790.db2.gz NULPTUXMSQPMJL-MVIFTORASA-N 1 2 321.371 4.009 20 0 DIADLO Cc1ccc[nH+]c1CCc1noc(CC(C)(C)c2ccccc2)n1 ZINC000562570532 332605963 /nfs/dbraw/zinc/60/59/63/332605963.db2.gz OVYYWGFWTKGJKP-UHFFFAOYSA-N 1 2 321.424 4.079 20 0 DIADLO C[C@@H](Nc1cc(Cl)cc(C(F)(F)F)c1)c1[nH+]ccn1C ZINC000168985069 332607652 /nfs/dbraw/zinc/60/76/52/332607652.db2.gz YZIVBWLRSCKBLR-MRVPVSSYSA-N 1 2 303.715 4.265 20 0 DIADLO FC(F)C1CCN(c2[nH+]cccc2OCc2ccccc2)CC1 ZINC000562912075 332640146 /nfs/dbraw/zinc/64/01/46/332640146.db2.gz QDAIVGYDQLIAKA-UHFFFAOYSA-N 1 2 318.367 4.142 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2ncc(Cl)s2)c1 ZINC000225314402 332671536 /nfs/dbraw/zinc/67/15/36/332671536.db2.gz XXYSYVOFZNFTHS-NSHDSACASA-N 1 2 310.850 4.435 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2cc3cc(C)ccc3o2)s1 ZINC000565243385 332673322 /nfs/dbraw/zinc/67/33/22/332673322.db2.gz MHUVYCKNAGKVLO-UHFFFAOYSA-N 1 2 318.467 4.351 20 0 DIADLO CCCCn1ccnc1-c1cccc(NCc2[nH]c(C)c(C)[nH+]2)c1 ZINC000569940752 332695547 /nfs/dbraw/zinc/69/55/47/332695547.db2.gz DJCLMYNZDLNKBW-UHFFFAOYSA-N 1 2 323.444 4.302 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)oc1C ZINC000570412478 332752323 /nfs/dbraw/zinc/75/23/23/332752323.db2.gz LTWNUAHHPZIBKL-KSSFIOAISA-N 1 2 309.413 4.070 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(Cl)c3ccccc23)o1 ZINC000570437742 332755061 /nfs/dbraw/zinc/75/50/61/332755061.db2.gz ZZJXBIDRGDNELN-JTQLQIEISA-N 1 2 301.777 4.035 20 0 DIADLO CC[C@@H](CC(=O)N[C@H](c1[nH]cc[nH+]1)C(C)C)c1ccc(C)cc1 ZINC000570465513 332759962 /nfs/dbraw/zinc/75/99/62/332759962.db2.gz LHVXKGZIMVNDBT-YJBOKZPZSA-N 1 2 313.445 4.115 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H]2CCc3c2cccc3Cl)c(C)[nH+]1 ZINC000176759458 332955553 /nfs/dbraw/zinc/95/55/53/332955553.db2.gz TYCBDXWIULZZOO-MRXNPFEDSA-N 1 2 315.804 4.161 20 0 DIADLO Cc1ccc(NC(=O)N[C@H]2CCc3c2cccc3Cl)c(C)[nH+]1 ZINC000176759475 332955766 /nfs/dbraw/zinc/95/57/66/332955766.db2.gz TYCBDXWIULZZOO-INIZCTEOSA-N 1 2 315.804 4.161 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1nc2ccc(Cl)cc2n1C ZINC000180101035 333027295 /nfs/dbraw/zinc/02/72/95/333027295.db2.gz BDKPVRJCCZFLOU-ZJUUUORDSA-N 1 2 320.849 4.095 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000181716010 333031277 /nfs/dbraw/zinc/03/12/77/333031277.db2.gz NRMFJOHYKGUGTL-IBGZPJMESA-N 1 2 311.356 4.307 20 0 DIADLO COC(=O)c1sccc1C[N@H+](C)[C@H](C)c1ccccc1Cl ZINC000378665499 333042816 /nfs/dbraw/zinc/04/28/16/333042816.db2.gz JHGXEIFSLNLJMU-LLVKDONJSA-N 1 2 323.845 4.381 20 0 DIADLO COC(=O)c1sccc1C[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC000378665499 333042817 /nfs/dbraw/zinc/04/28/17/333042817.db2.gz JHGXEIFSLNLJMU-LLVKDONJSA-N 1 2 323.845 4.381 20 0 DIADLO CC(C)n1ccc(C[NH+]2CCC(c3cccc(F)c3F)CC2)n1 ZINC000580262433 333044605 /nfs/dbraw/zinc/04/46/05/333044605.db2.gz BABBYCNRXCOHRC-UHFFFAOYSA-N 1 2 319.399 4.122 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1ccn(-c2ccccc2F)n1 ZINC000188843731 333056047 /nfs/dbraw/zinc/05/60/47/333056047.db2.gz AJRVYIMVHQXAEY-ZDUSSCGKSA-N 1 2 315.417 4.266 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccn(-c2ccccc2F)n1 ZINC000188843731 333056048 /nfs/dbraw/zinc/05/60/48/333056048.db2.gz AJRVYIMVHQXAEY-ZDUSSCGKSA-N 1 2 315.417 4.266 20 0 DIADLO CC(F)(F)C[NH2+][C@H](c1ccc(Br)s1)C1CC1 ZINC000378855169 333056262 /nfs/dbraw/zinc/05/62/62/333056262.db2.gz JNXCGZMUTOEMRO-JTQLQIEISA-N 1 2 310.207 4.207 20 0 DIADLO CC[C@@H](C)Oc1cccc(NCc2cc(OC)cc(C)[nH+]2)c1 ZINC000378925529 333064497 /nfs/dbraw/zinc/06/44/97/333064497.db2.gz HDYPCTOXRUFESH-CQSZACIVSA-N 1 2 300.402 4.188 20 0 DIADLO CC[C@H](C)[C@@H]1CCCCN1c1cc(C)[nH+]c(-c2ccncc2)n1 ZINC000462695693 333082393 /nfs/dbraw/zinc/08/23/93/333082393.db2.gz IFXAVPXDJKAJSU-YOEHRIQHSA-N 1 2 310.445 4.252 20 0 DIADLO Cc1cc[nH+]c(NC[C@@H]2CCN(c3ccc(F)cc3)C2)c1Cl ZINC000460428887 333084971 /nfs/dbraw/zinc/08/49/71/333084971.db2.gz SUBMCVKOLGUQBL-ZDUSSCGKSA-N 1 2 319.811 4.121 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)Cc2ccccc2CC)cs1 ZINC000445822337 333088334 /nfs/dbraw/zinc/08/83/34/333088334.db2.gz QXKGBTVAMJDJJH-CQSZACIVSA-N 1 2 318.486 4.435 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)Cc2ccccc2CC)cs1 ZINC000445822337 333088337 /nfs/dbraw/zinc/08/83/37/333088337.db2.gz QXKGBTVAMJDJJH-CQSZACIVSA-N 1 2 318.486 4.435 20 0 DIADLO COC(=O)[C@H](c1ccccc1C)[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000466829579 333089191 /nfs/dbraw/zinc/08/91/91/333089191.db2.gz WGPQWSMFEBFDDQ-SJORKVTESA-N 1 2 315.438 4.108 20 0 DIADLO COC(=O)[C@H](c1ccccc1C)[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000466829579 333089193 /nfs/dbraw/zinc/08/91/93/333089193.db2.gz WGPQWSMFEBFDDQ-SJORKVTESA-N 1 2 315.438 4.108 20 0 DIADLO CC(C)(C)c1[nH]c2ccc(NC(=O)[C@H]3Cc4ccccc43)cc2[nH+]1 ZINC000460695564 333125806 /nfs/dbraw/zinc/12/58/06/333125806.db2.gz HUALHLKBRXBCKM-HNNXBMFYSA-N 1 2 319.408 4.139 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(/C=C\C(C)(C)C)n1 ZINC000460737668 333131207 /nfs/dbraw/zinc/13/12/07/333131207.db2.gz FZEMRTHNABOQCF-KHPPLWFESA-N 1 2 310.401 4.089 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(C2(CC)CCCC2)n1 ZINC000460749268 333133560 /nfs/dbraw/zinc/13/35/60/333133560.db2.gz QSKMBOCRYMRYAT-UHFFFAOYSA-N 1 2 324.428 4.252 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](C)c2ccc(OC(C)C)cc2)no1 ZINC000179528291 333152086 /nfs/dbraw/zinc/15/20/86/333152086.db2.gz XYIUJOXSWZQJDT-CQSZACIVSA-N 1 2 317.433 4.050 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](Cc3ccsc3)CCO2)cc1Cl ZINC000092972940 333157777 /nfs/dbraw/zinc/15/77/77/333157777.db2.gz WTLGVKBOOWWHLC-OAHLLOKOSA-N 1 2 311.809 4.114 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](Cc3ccsc3)CCO2)cc1Cl ZINC000092972940 333157778 /nfs/dbraw/zinc/15/77/78/333157778.db2.gz WTLGVKBOOWWHLC-OAHLLOKOSA-N 1 2 311.809 4.114 20 0 DIADLO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2noc(-c3ccccc3)n2)c1 ZINC000182930598 333181601 /nfs/dbraw/zinc/18/16/01/333181601.db2.gz GGIFEYSPQKRHLX-OAHLLOKOSA-N 1 2 307.397 4.204 20 0 DIADLO Cc1nnsc1C[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC000582040967 333181901 /nfs/dbraw/zinc/18/19/01/333181901.db2.gz JLACWWJRSWIZQC-UHFFFAOYSA-N 1 2 307.422 4.029 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCSC[C@H]1CCCO1 ZINC000460874430 333189425 /nfs/dbraw/zinc/18/94/25/333189425.db2.gz IKSAWBQTXDVJRM-MRXNPFEDSA-N 1 2 318.486 4.427 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3cc4ccccc4s3)ccc2n1C ZINC000525725328 333192250 /nfs/dbraw/zinc/19/22/50/333192250.db2.gz FOSMWYGJDPEARV-UHFFFAOYSA-N 1 2 321.405 4.349 20 0 DIADLO CC[C@H]1Cc2ccccc2CN1C(=O)Nc1ccc(C)[nH+]c1C ZINC000185398574 333208174 /nfs/dbraw/zinc/20/81/74/333208174.db2.gz PHTQYBZOAXLPEX-KRWDZBQOSA-N 1 2 309.413 4.067 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000497590684 333266247 /nfs/dbraw/zinc/26/62/47/333266247.db2.gz LZJVQJBVUADJEQ-KPZWWZAWSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000497590684 333266249 /nfs/dbraw/zinc/26/62/49/333266249.db2.gz LZJVQJBVUADJEQ-KPZWWZAWSA-N 1 2 321.342 4.238 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@](C)(F)C2)oc1-c1ccc(Cl)cc1 ZINC000501425736 333273074 /nfs/dbraw/zinc/27/30/74/333273074.db2.gz RRINRONYYJIGDI-INIZCTEOSA-N 1 2 308.784 4.237 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@](C)(F)C2)oc1-c1ccc(Cl)cc1 ZINC000501425736 333273076 /nfs/dbraw/zinc/27/30/76/333273076.db2.gz RRINRONYYJIGDI-INIZCTEOSA-N 1 2 308.784 4.237 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)Nc2cc[nH+]c(C)c2)o1 ZINC000120472401 333284270 /nfs/dbraw/zinc/28/42/70/333284270.db2.gz ROEWNDTZAPRUKU-BLLLJJGKSA-N 1 2 313.401 4.297 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1)C(F)(F)F ZINC000502433432 333295023 /nfs/dbraw/zinc/29/50/23/333295023.db2.gz HYNHUXNWLGNKCE-YUELXQCFSA-N 1 2 300.368 4.284 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)o1 ZINC000111193399 333328758 /nfs/dbraw/zinc/32/87/58/333328758.db2.gz NSYULEJJHPMTKO-IUCAKERBSA-N 1 2 314.216 4.351 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2Cl)o1 ZINC000111193400 333328797 /nfs/dbraw/zinc/32/87/97/333328797.db2.gz NSYULEJJHPMTKO-RKDXNWHRSA-N 1 2 314.216 4.351 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+](C)Cc2ccc(Cl)c(Cl)c2)o1 ZINC000111193323 333328855 /nfs/dbraw/zinc/32/88/55/333328855.db2.gz VHXBTUHRIMUVOG-SECBINFHSA-N 1 2 314.216 4.132 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)o1 ZINC000111193323 333328856 /nfs/dbraw/zinc/32/88/56/333328856.db2.gz VHXBTUHRIMUVOG-SECBINFHSA-N 1 2 314.216 4.132 20 0 DIADLO CC(C)n1cccc1C(=O)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1 ZINC000343340326 335134666 /nfs/dbraw/zinc/13/46/66/335134666.db2.gz NSNCHVRUDHQQQS-UHFFFAOYSA-N 1 2 322.412 4.465 20 0 DIADLO C[N@H+](Cc1csc(-c2cccs2)n1)Cc1cccc(O)c1 ZINC000531382467 333347948 /nfs/dbraw/zinc/34/79/48/333347948.db2.gz OMCPTNDXRDEKMD-UHFFFAOYSA-N 1 2 316.451 4.209 20 0 DIADLO C[N@@H+](Cc1csc(-c2cccs2)n1)Cc1cccc(O)c1 ZINC000531382467 333347950 /nfs/dbraw/zinc/34/79/50/333347950.db2.gz OMCPTNDXRDEKMD-UHFFFAOYSA-N 1 2 316.451 4.209 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)C/C=C/c3cccc(F)c3)ccc2n1C ZINC000531391411 333349028 /nfs/dbraw/zinc/34/90/28/333349028.db2.gz WUWXBKQQDPIGFF-GQCTYLIASA-N 1 2 323.371 4.063 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)C/C=C\c3cccc(F)c3)ccc2n1C ZINC000531391412 333349080 /nfs/dbraw/zinc/34/90/80/333349080.db2.gz WUWXBKQQDPIGFF-XQRVVYSFSA-N 1 2 323.371 4.063 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+](C)Cc1ncc(CC)s1 ZINC000494973433 333352064 /nfs/dbraw/zinc/35/20/64/333352064.db2.gz MFQNGCHPQHYXKL-UHFFFAOYSA-N 1 2 324.877 4.390 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+](C)Cc1ncc(CC)s1 ZINC000494973433 333352065 /nfs/dbraw/zinc/35/20/65/333352065.db2.gz MFQNGCHPQHYXKL-UHFFFAOYSA-N 1 2 324.877 4.390 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(Cl)n1C)c1cc(Cl)ccc1Cl ZINC000186180017 333372394 /nfs/dbraw/zinc/37/23/94/333372394.db2.gz YSBCGMVVROQQRE-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO C[C@H]([NH2+]Cc1nc2ccccc2s1)c1c(F)cccc1F ZINC000021499629 333422999 /nfs/dbraw/zinc/42/29/99/333422999.db2.gz CJXPJRJDHPDQJM-JTQLQIEISA-N 1 2 304.365 4.425 20 0 DIADLO c1cc2c(cccc2CNc2ccc(N3CCCCC3)[nH+]c2)[nH]1 ZINC000391285854 333431725 /nfs/dbraw/zinc/43/17/25/333431725.db2.gz PKTMIZYSQNUEFM-UHFFFAOYSA-N 1 2 306.413 4.165 20 0 DIADLO COc1ccc(CNc2ccc(C)[nH+]c2C)cc1Br ZINC000094664672 333455527 /nfs/dbraw/zinc/45/55/27/333455527.db2.gz NCZCSBITUQCPPW-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(OC(C)C)cc2)s1 ZINC000274275192 333487252 /nfs/dbraw/zinc/48/72/52/333487252.db2.gz XLPSDFAAGXZTJG-NEPJUHHUSA-N 1 2 305.447 4.046 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)C=Cc2ccccc2)[nH+]1 ZINC000366357469 333522537 /nfs/dbraw/zinc/52/25/37/333522537.db2.gz VOGJSCCNFAFGTK-VAWYXSNFSA-N 1 2 303.365 4.037 20 0 DIADLO Cc1c2cc(Cl)ccc2oc1C(=O)Nc1cc(C)[nH+]cc1C ZINC000534299287 333573402 /nfs/dbraw/zinc/57/34/02/333573402.db2.gz ORYDABAKXMJZEG-UHFFFAOYSA-N 1 2 314.772 4.081 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)c(C(F)(F)F)c1)c1cscn1 ZINC000563443216 333607652 /nfs/dbraw/zinc/60/76/52/333607652.db2.gz DXESKIVNMASHJA-MRVPVSSYSA-N 1 2 304.312 4.152 20 0 DIADLO CC(C)n1ccc(CNc2[nH+]cccc2OCc2ccccc2)n1 ZINC000563576015 333628803 /nfs/dbraw/zinc/62/88/03/333628803.db2.gz VVRZVIVVZKMINZ-UHFFFAOYSA-N 1 2 322.412 4.050 20 0 DIADLO Cc1cc(C(C)(C)C)cc(C)c1C[NH2+][C@@H](C)c1csnn1 ZINC000412027169 333721399 /nfs/dbraw/zinc/72/13/99/333721399.db2.gz ONXRKRGZXJNUEX-ZDUSSCGKSA-N 1 2 303.475 4.303 20 0 DIADLO C[C@H](c1ccc(C[NH2+][C@@H](C)c2csnn2)cc1)C(F)(F)F ZINC000412035905 333725195 /nfs/dbraw/zinc/72/51/95/333725195.db2.gz HPMPADIVZHAEIH-ZJUUUORDSA-N 1 2 315.364 4.055 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1 ZINC000413667111 333862796 /nfs/dbraw/zinc/86/27/96/333862796.db2.gz LCEZUVYTIXOPOZ-JKSUJKDBSA-N 1 2 303.450 4.070 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2cc(Cl)cc(Cl)c21)c1ccn(C)n1 ZINC000414188472 333911088 /nfs/dbraw/zinc/91/10/88/333911088.db2.gz QSLQZOMVGYSZQL-XPTSAGLGSA-N 1 2 310.228 4.065 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)nc1C ZINC000414162158 333915386 /nfs/dbraw/zinc/91/53/86/333915386.db2.gz GNZYPKLZLIINHJ-SNVBAGLBSA-N 1 2 315.364 4.025 20 0 DIADLO C[C@H]1CC[C@H]([NH2+]Cc2nccc(C(F)(F)F)n2)c2ccccc21 ZINC000414238216 333917933 /nfs/dbraw/zinc/91/79/33/333917933.db2.gz JVPQSFMLIQBTHI-FZMZJTMJSA-N 1 2 321.346 4.224 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000343413094 335163220 /nfs/dbraw/zinc/16/32/20/335163220.db2.gz HNBCEAOKDYXVKM-UHFFFAOYSA-N 1 2 309.388 4.156 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000343413094 335163221 /nfs/dbraw/zinc/16/32/21/335163221.db2.gz HNBCEAOKDYXVKM-UHFFFAOYSA-N 1 2 309.388 4.156 20 0 DIADLO Cc1cc2c(cc1C)[C@@H]([NH2+][C@@H](C)c1csnn1)CCS2 ZINC000414293542 333934933 /nfs/dbraw/zinc/93/49/33/333934933.db2.gz CZYDITYEINNVIS-AAEUAGOBSA-N 1 2 305.472 4.043 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1Cl)c1csnn1 ZINC000414546448 334015084 /nfs/dbraw/zinc/01/50/84/334015084.db2.gz GIIZVBVQYJJZEN-SSDOTTSWSA-N 1 2 321.755 4.061 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)c1csnn1 ZINC000414549828 334015515 /nfs/dbraw/zinc/01/55/15/334015515.db2.gz MGOGYEHHXCHVNU-ZETCQYMHSA-N 1 2 321.755 4.061 20 0 DIADLO Cc1cc(F)ccc1-c1ccc(C[NH2+][C@@H](C)c2csnn2)o1 ZINC000414550281 334015612 /nfs/dbraw/zinc/01/56/12/334015612.db2.gz NJOSXWWLUHPNFA-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO Clc1cc(Cl)cc(C[NH2+]Cc2nnc(C3CC3)s2)c1 ZINC000414553216 334016167 /nfs/dbraw/zinc/01/61/67/334016167.db2.gz IQAORRNCKBGIDB-UHFFFAOYSA-N 1 2 314.241 4.012 20 0 DIADLO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@H](C)c1cccnc1Cl ZINC000271418599 334023081 /nfs/dbraw/zinc/02/30/81/334023081.db2.gz BJRJOIKGWHTIBU-IUODEOHRSA-N 1 2 302.805 4.136 20 0 DIADLO C[C@H](CC1CCCC1)c1nc(-c2ccnc(-n3cc[nH+]c3)c2)no1 ZINC000273734419 334050209 /nfs/dbraw/zinc/05/02/09/334050209.db2.gz APZUPNIMAIMOHA-CYBMUJFWSA-N 1 2 323.400 4.001 20 0 DIADLO Cn1ncc(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000437584772 334054323 /nfs/dbraw/zinc/05/43/23/334054323.db2.gz YAWPWJSVOXLCQI-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1ncc(Cl)c1C[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000437584772 334054324 /nfs/dbraw/zinc/05/43/24/334054324.db2.gz YAWPWJSVOXLCQI-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO CSc1ccc([C@H](C)[NH2+][C@H](C)c2nnc(C)s2)cc1F ZINC000274255934 334058147 /nfs/dbraw/zinc/05/81/47/334058147.db2.gz TURKOIJGARUHKY-DTWKUNHWSA-N 1 2 311.451 4.119 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cc(F)cc(Cl)c3)CCCCC2)no1 ZINC000274949041 334068289 /nfs/dbraw/zinc/06/82/89/334068289.db2.gz DDGZREIDIOMBIG-UHFFFAOYSA-N 1 2 323.799 4.120 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ncn(C)n1)c1cc2c(ccc3ccccc23)o1 ZINC000275629013 334072296 /nfs/dbraw/zinc/07/22/96/334072296.db2.gz BASHIUPTYFLDLF-STQMWFEESA-N 1 2 320.396 4.126 20 0 DIADLO c1[nH]c([C@H]2CCCC[N@H+]2Cc2ccncc2)nc1-c1ccccc1 ZINC000276407285 334077509 /nfs/dbraw/zinc/07/75/09/334077509.db2.gz GLELRWBUWVXSAJ-LJQANCHMSA-N 1 2 318.424 4.199 20 0 DIADLO c1[nH]c([C@H]2CCCC[N@@H+]2Cc2ccncc2)nc1-c1ccccc1 ZINC000276407285 334077510 /nfs/dbraw/zinc/07/75/10/334077510.db2.gz GLELRWBUWVXSAJ-LJQANCHMSA-N 1 2 318.424 4.199 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)[nH]1 ZINC000277071346 334086449 /nfs/dbraw/zinc/08/64/49/334086449.db2.gz DZCPQWKXLWKGCC-DCAQKATOSA-N 1 2 308.376 4.008 20 0 DIADLO C[C@H]([NH2+]C1(c2c(Cl)cccc2Cl)CCC1)c1ccnn1C ZINC000278514737 334097252 /nfs/dbraw/zinc/09/72/52/334097252.db2.gz RTTOOQJSMNIHLT-NSHDSACASA-N 1 2 324.255 4.457 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2CC(C)(C)Oc3ccccc32)c(C)[nH+]1 ZINC000414789531 334097462 /nfs/dbraw/zinc/09/74/62/334097462.db2.gz OUQKTONDWXQHSS-MRXNPFEDSA-N 1 2 324.424 4.290 20 0 DIADLO Cc1ccoc1CNC(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000343604467 335176643 /nfs/dbraw/zinc/17/66/43/335176643.db2.gz ZOMRPASFHIGGTA-UHFFFAOYSA-N 1 2 322.364 4.014 20 0 DIADLO FC(F)Oc1ccccc1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000414845261 334115765 /nfs/dbraw/zinc/11/57/65/334115765.db2.gz FUJYBWBWMSAZRX-UHFFFAOYSA-N 1 2 304.340 4.258 20 0 DIADLO Brc1ccc(CNc2ccc3c(c2)CCC[NH2+]3)s1 ZINC000414846393 334117594 /nfs/dbraw/zinc/11/75/94/334117594.db2.gz HBJGHXSWPCQNSW-UHFFFAOYSA-N 1 2 323.259 4.481 20 0 DIADLO CC(C)(C)c1nc(CNc2ccc3c(c2)CCC[NH2+]3)cs1 ZINC000414851230 334124331 /nfs/dbraw/zinc/12/43/31/334124331.db2.gz NWPIDYYTDWGTBI-UHFFFAOYSA-N 1 2 301.459 4.411 20 0 DIADLO FC(F)COc1ccc(CNc2ccc3c(c2)CCC[NH2+]3)cc1 ZINC000414854073 334127657 /nfs/dbraw/zinc/12/76/57/334127657.db2.gz TUQJASOBLZYVNM-UHFFFAOYSA-N 1 2 318.367 4.301 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(Cl)c2)C[N@@H+]1Cc1ccsc1 ZINC000438547060 334128258 /nfs/dbraw/zinc/12/82/58/334128258.db2.gz OLGRRWJWQSHGRQ-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(Cl)c2)C[N@H+]1Cc1ccsc1 ZINC000438547060 334128259 /nfs/dbraw/zinc/12/82/59/334128259.db2.gz OLGRRWJWQSHGRQ-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)C)no2)cc1 ZINC000281835972 334128909 /nfs/dbraw/zinc/12/89/09/334128909.db2.gz LFMBVVOLZZCHJE-VXGBXAGGSA-N 1 2 305.447 4.327 20 0 DIADLO CC(C)C(C)(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000439125826 334158175 /nfs/dbraw/zinc/15/81/75/334158175.db2.gz XYHBDQRKTXGXJQ-UHFFFAOYSA-N 1 2 305.809 4.146 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc([C@@H](C)C(F)(F)F)cc2)no1 ZINC000295628041 334225968 /nfs/dbraw/zinc/22/59/68/334225968.db2.gz XBZRFTYXOMOZIS-GFCCVEGCSA-N 1 2 312.335 4.281 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc([C@@H](C)C(F)(F)F)cc2)no1 ZINC000295628041 334225970 /nfs/dbraw/zinc/22/59/70/334225970.db2.gz XBZRFTYXOMOZIS-GFCCVEGCSA-N 1 2 312.335 4.281 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccncn1 ZINC000453052883 334228606 /nfs/dbraw/zinc/22/86/06/334228606.db2.gz DVMVEIDCPKKPPZ-RKDXNWHRSA-N 1 2 314.191 4.334 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(Cl)ccc(F)c1Cl)c1ccncn1 ZINC000453067491 334229737 /nfs/dbraw/zinc/22/97/37/334229737.db2.gz WPTGFFAOEOKFDZ-RKDXNWHRSA-N 1 2 314.191 4.334 20 0 DIADLO CCCOc1ccc(N[C@H]2CCn3cc[nH+]c32)cc1OCCC ZINC000296923312 334237873 /nfs/dbraw/zinc/23/78/73/334237873.db2.gz PTOXAVYXRYFSDU-HNNXBMFYSA-N 1 2 315.417 4.018 20 0 DIADLO Clc1ccc(C[N@H+](Cc2ncc(C3CC3)o2)C2CC2)cc1 ZINC000340658543 334258802 /nfs/dbraw/zinc/25/88/02/334258802.db2.gz AUVKQHHVWOUQBM-UHFFFAOYSA-N 1 2 302.805 4.370 20 0 DIADLO Clc1ccc(C[N@@H+](Cc2ncc(C3CC3)o2)C2CC2)cc1 ZINC000340658543 334258804 /nfs/dbraw/zinc/25/88/04/334258804.db2.gz AUVKQHHVWOUQBM-UHFFFAOYSA-N 1 2 302.805 4.370 20 0 DIADLO CCC[C@H](C)CC(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000534552487 334281842 /nfs/dbraw/zinc/28/18/42/334281842.db2.gz WDUNSBYIVDTFGG-HNNXBMFYSA-N 1 2 323.440 4.367 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000111239194 334312270 /nfs/dbraw/zinc/31/22/70/334312270.db2.gz JQMSHMBGUHQAGW-GFCCVEGCSA-N 1 2 304.459 4.339 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000111239194 334312271 /nfs/dbraw/zinc/31/22/71/334312271.db2.gz JQMSHMBGUHQAGW-GFCCVEGCSA-N 1 2 304.459 4.339 20 0 DIADLO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1nc(C)c2ccccc2n1 ZINC000531962355 334320252 /nfs/dbraw/zinc/32/02/52/334320252.db2.gz IKLZIEBMFABWSO-CQSZACIVSA-N 1 2 321.424 4.106 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc(CC(C)C)cc3)CCCC2)no1 ZINC000101550468 334329052 /nfs/dbraw/zinc/32/90/52/334329052.db2.gz PNJWQTOBQYEXDG-UHFFFAOYSA-N 1 2 313.445 4.136 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(F)c(F)c2)C[C@@H](c2ccc(F)cc2)O1 ZINC000303841686 334334632 /nfs/dbraw/zinc/33/46/32/334334632.db2.gz BRQAKIRGZLHUFC-XIKOKIGWSA-N 1 2 321.342 4.066 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(F)c(F)c2)C[C@@H](c2ccc(F)cc2)O1 ZINC000303841686 334334633 /nfs/dbraw/zinc/33/46/33/334334633.db2.gz BRQAKIRGZLHUFC-XIKOKIGWSA-N 1 2 321.342 4.066 20 0 DIADLO CCc1ccc(C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)cc1 ZINC000534812256 334338270 /nfs/dbraw/zinc/33/82/70/334338270.db2.gz IGBRWOMRCBZGJS-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccccc2Cl)C2CCCC2)nc1 ZINC000534855758 334341738 /nfs/dbraw/zinc/34/17/38/334341738.db2.gz VNCXVKRPSITUDH-UHFFFAOYSA-N 1 2 315.848 4.383 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccccc2Cl)C2CCCC2)nc1 ZINC000534855758 334341740 /nfs/dbraw/zinc/34/17/40/334341740.db2.gz VNCXVKRPSITUDH-UHFFFAOYSA-N 1 2 315.848 4.383 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@H]2c2cccc(C)c2C)no1 ZINC000303910239 334342357 /nfs/dbraw/zinc/34/23/57/334342357.db2.gz MQODNRZYCZZUJJ-KRWDZBQOSA-N 1 2 313.445 4.366 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@H]2c2cccc(C)c2C)no1 ZINC000303910239 334342358 /nfs/dbraw/zinc/34/23/58/334342358.db2.gz MQODNRZYCZZUJJ-KRWDZBQOSA-N 1 2 313.445 4.366 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(Cl)c2)C[C@H](c2ccc(F)cc2)O1 ZINC000303957574 334349118 /nfs/dbraw/zinc/34/91/18/334349118.db2.gz XZHHNKTYHXVOMD-SCLBCKFNSA-N 1 2 319.807 4.441 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(Cl)c2)C[C@H](c2ccc(F)cc2)O1 ZINC000303957574 334349120 /nfs/dbraw/zinc/34/91/20/334349120.db2.gz XZHHNKTYHXVOMD-SCLBCKFNSA-N 1 2 319.807 4.441 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2ccc(C)cc2OC)o1 ZINC000531980921 334352969 /nfs/dbraw/zinc/35/29/69/334352969.db2.gz IVSWHFIFGBBMJE-YOEHRIQHSA-N 1 2 317.429 4.197 20 0 DIADLO Cc1c2cc(F)ccc2sc1C(=O)Nc1cc(C)[nH+]cc1C ZINC000535035166 334359123 /nfs/dbraw/zinc/35/91/23/334359123.db2.gz PILKFCLPOXMKJI-UHFFFAOYSA-N 1 2 314.385 4.035 20 0 DIADLO Cc1ccc(C)c([C@H]2CCCN2C(=O)Nc2cc(C)[nH+]cc2C)c1 ZINC000535061923 334361867 /nfs/dbraw/zinc/36/18/67/334361867.db2.gz MYSOUULSDYQHDZ-LJQANCHMSA-N 1 2 323.440 4.106 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)NC(=O)Nc1cc(C)[nH+]cc1C ZINC000535060782 334361878 /nfs/dbraw/zinc/36/18/78/334361878.db2.gz NGYHSAGGFXOSHZ-AWEZNQCLSA-N 1 2 323.396 4.058 20 0 DIADLO CC(C)C[C@H](C)Oc1cc(C[NH2+][C@@H](C)c2cscn2)ccn1 ZINC000535064643 334362471 /nfs/dbraw/zinc/36/24/71/334362471.db2.gz TXCSXSOPQKLSEG-KBPBESRZSA-N 1 2 319.474 4.202 20 0 DIADLO FC(F)(F)Oc1ccccc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000535067497 334362998 /nfs/dbraw/zinc/36/29/98/334362998.db2.gz WRLUFPOTQNIZOJ-HNNXBMFYSA-N 1 2 322.330 4.317 20 0 DIADLO FC(F)(F)Oc1ccccc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000535067497 334362999 /nfs/dbraw/zinc/36/29/99/334362999.db2.gz WRLUFPOTQNIZOJ-HNNXBMFYSA-N 1 2 322.330 4.317 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(-c3cccs3)n2)C[C@H](C)S1 ZINC000535085463 334367000 /nfs/dbraw/zinc/36/70/00/334367000.db2.gz UPAFZBUJQOSRHL-PHIMTYICSA-N 1 2 310.513 4.197 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(-c3cccs3)n2)C[C@H](C)S1 ZINC000535085463 334367001 /nfs/dbraw/zinc/36/70/01/334367001.db2.gz UPAFZBUJQOSRHL-PHIMTYICSA-N 1 2 310.513 4.197 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@H](c3ccccc3)[C@H](C)C2)c(C)[nH+]1 ZINC000152281733 334367419 /nfs/dbraw/zinc/36/74/19/334367419.db2.gz YXYFHKMIXZUZHI-KDOFPFPSSA-N 1 2 323.440 4.356 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@@H](c3ccccc3)[C@H](C)C2)c(C)[nH+]1 ZINC000152281810 334367527 /nfs/dbraw/zinc/36/75/27/334367527.db2.gz YXYFHKMIXZUZHI-RDTXWAMCSA-N 1 2 323.440 4.356 20 0 DIADLO C[C@@H]1CCC[C@H]1NC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000112211350 334373874 /nfs/dbraw/zinc/37/38/74/334373874.db2.gz QYQIZCJCFDCBKT-CXAGYDPISA-N 1 2 311.385 4.184 20 0 DIADLO Cc1ccnc(C[N@H+](Cc2ccccc2F)C2CCCCC2)n1 ZINC000535207692 334380293 /nfs/dbraw/zinc/38/02/93/334380293.db2.gz UEYVKSQUFPPICT-UHFFFAOYSA-N 1 2 313.420 4.259 20 0 DIADLO Cc1ccnc(C[N@@H+](Cc2ccccc2F)C2CCCCC2)n1 ZINC000535207692 334380294 /nfs/dbraw/zinc/38/02/94/334380294.db2.gz UEYVKSQUFPPICT-UHFFFAOYSA-N 1 2 313.420 4.259 20 0 DIADLO Cc1ccc(NC(=O)C[C@H](c2[nH]cc[nH+]2)c2ccccc2)cc1C ZINC000340784509 334385459 /nfs/dbraw/zinc/38/54/59/334385459.db2.gz AWXXUJJQIJKDGO-SFHVURJKSA-N 1 2 319.408 4.187 20 0 DIADLO Cc1cc(NCc2nccc(C(F)F)n2)c2cccc(F)c2[nH+]1 ZINC000340996614 334398555 /nfs/dbraw/zinc/39/85/55/334398555.db2.gz PDUHMOSOTOTLRG-UHFFFAOYSA-N 1 2 318.302 4.022 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccccc2Oc2ccccc2C)n1C ZINC000341011952 334399748 /nfs/dbraw/zinc/39/97/48/334399748.db2.gz NXWBRUPSNKXHOT-UHFFFAOYSA-N 1 2 321.424 4.119 20 0 DIADLO Cc1c[nH+]c(CNCc2ccccc2Oc2ccccc2C)n1C ZINC000341011952 334399749 /nfs/dbraw/zinc/39/97/49/334399749.db2.gz NXWBRUPSNKXHOT-UHFFFAOYSA-N 1 2 321.424 4.119 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)o1 ZINC000341220649 334419178 /nfs/dbraw/zinc/41/91/78/334419178.db2.gz NXZSUPMWZVHWGB-VHSXEESVSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1cn2cc(NC(=O)C[C@@H](C)c3ccccc3C)ccc2[nH+]1 ZINC000341201232 334423305 /nfs/dbraw/zinc/42/33/05/334423305.db2.gz FUDQJBLUCWCKMC-CQSZACIVSA-N 1 2 307.397 4.083 20 0 DIADLO Cc1cc(C)n(CCCNc2cc[nH+]c3c(Cl)cccc23)n1 ZINC000341306899 334433755 /nfs/dbraw/zinc/43/37/55/334433755.db2.gz WJSPEZATQWRMCN-UHFFFAOYSA-N 1 2 314.820 4.204 20 0 DIADLO CCCc1noc(C[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)n1 ZINC000341460139 334442513 /nfs/dbraw/zinc/44/25/13/334442513.db2.gz QTUDIAULZGTTBF-OAHLLOKOSA-N 1 2 319.424 4.428 20 0 DIADLO COc1ccc([C@H]2CCCN2c2cc(C)[nH+]c(C3CC3)n2)cc1 ZINC000341468407 334451295 /nfs/dbraw/zinc/45/12/95/334451295.db2.gz FHUYPJTUPBCTKP-QGZVFWFLSA-N 1 2 309.413 4.013 20 0 DIADLO Cc1cc(N(Cc2ccco2)Cc2ccco2)nc(C2CC2)[nH+]1 ZINC000341471262 334451581 /nfs/dbraw/zinc/45/15/81/334451581.db2.gz CHIURLCVGAABAX-UHFFFAOYSA-N 1 2 309.369 4.055 20 0 DIADLO CCC[C@H]([NH2+]Cc1noc(C)n1)c1ccc(Cl)c(Cl)c1 ZINC000341632101 334467029 /nfs/dbraw/zinc/46/70/29/334467029.db2.gz CNIFSNIOZOAKLD-ZDUSSCGKSA-N 1 2 314.216 4.316 20 0 DIADLO C[C@H]([NH2+]Cc1nc2cccnc2s1)c1ccc(F)cc1Cl ZINC000341840038 334486491 /nfs/dbraw/zinc/48/64/91/334486491.db2.gz LMBYSBCEIAZINB-VIFPVBQESA-N 1 2 321.808 4.335 20 0 DIADLO CCc1cnccc1[C@H](C)[NH2+][C@H](C)c1noc(-c2ccccc2)n1 ZINC000341908145 334490777 /nfs/dbraw/zinc/49/07/77/334490777.db2.gz JHUDFYBMEUDDGH-UONOGXRCSA-N 1 2 322.412 4.106 20 0 DIADLO COc1cc[nH+]cc1CSCc1cc(Cl)ccc1OC ZINC000341934674 334493977 /nfs/dbraw/zinc/49/39/77/334493977.db2.gz YQJQENQCCLVIFT-UHFFFAOYSA-N 1 2 309.818 4.186 20 0 DIADLO COCC[C@H]1CCCCN(c2[nH+]ccc3ccc(F)cc32)C1 ZINC000341967969 334498107 /nfs/dbraw/zinc/49/81/07/334498107.db2.gz XQXRXYMQQYDBJE-CQSZACIVSA-N 1 2 302.393 4.017 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccccc1C(F)(F)F ZINC000341996610 334499272 /nfs/dbraw/zinc/49/92/72/334499272.db2.gz HMPQXJGXAIJEKG-JTQLQIEISA-N 1 2 310.319 4.422 20 0 DIADLO O=C(Nc1ccc2c(c1)[nH+]c1n2CCCCC1)C12CCC(CC1)C2 ZINC000342180850 334515145 /nfs/dbraw/zinc/51/51/45/334515145.db2.gz GGWRYDJLKVATFH-UHFFFAOYSA-N 1 2 323.440 4.282 20 0 DIADLO CC(C)c1ccccc1NC(=O)N[C@@H](c1[nH]cc[nH+]1)C(C)C ZINC000342365843 334530964 /nfs/dbraw/zinc/53/09/64/334530964.db2.gz UQAQWHJHTRUSJI-OAHLLOKOSA-N 1 2 300.406 4.052 20 0 DIADLO Cn1c2c(cccc2F)[nH+]c1N1CCC[C@@H]1c1cccc(F)c1 ZINC000443514548 338453308 /nfs/dbraw/zinc/45/33/08/338453308.db2.gz YGSGSDZOZVEIJY-MRXNPFEDSA-N 1 2 313.351 4.193 20 0 DIADLO C[C@@H]([NH2+]Cc1noc(-c2ccccc2)n1)c1cccc(Cl)c1 ZINC000102184836 334562706 /nfs/dbraw/zinc/56/27/06/334562706.db2.gz XOACQUCTYXZXFE-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1ccc(C2CCN(c3cc(C(F)(F)F)cc[nH+]3)CC2)cn1 ZINC000342841055 334581760 /nfs/dbraw/zinc/58/17/60/334581760.db2.gz NIWVRYGSCOYIRH-UHFFFAOYSA-N 1 2 321.346 4.188 20 0 DIADLO CC[C@H]([NH2+]Cc1nccn1CC(C)C)c1cc(F)ccc1F ZINC000164781857 334666801 /nfs/dbraw/zinc/66/68/01/334666801.db2.gz PVUNZKXMBDXJEE-INIZCTEOSA-N 1 2 307.388 4.058 20 0 DIADLO CC[C@@H]([NH2+]Cc1cnc(C(F)(F)F)s1)c1nc(C)cs1 ZINC000443964381 338464495 /nfs/dbraw/zinc/46/44/95/338464495.db2.gz LLRZGJZBXSAWME-SECBINFHSA-N 1 2 321.393 4.168 20 0 DIADLO C[C@@H](Nc1cc[nH+]c2ccncc12)c1ccc(C(F)(F)F)cc1 ZINC000444118751 338468678 /nfs/dbraw/zinc/46/86/78/338468678.db2.gz ZYYIUHGVDHTEBH-LLVKDONJSA-N 1 2 317.314 4.244 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1F ZINC000126625436 334861295 /nfs/dbraw/zinc/86/12/95/334861295.db2.gz YIRFFOCCXPFFEK-RYUDHWBXSA-N 1 2 305.397 4.226 20 0 DIADLO CCS[C@H]1CCC[C@@H](NC(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000334087118 334866906 /nfs/dbraw/zinc/86/69/06/334866906.db2.gz KSHYKEVLDADAMD-CABCVRRESA-N 1 2 321.490 4.193 20 0 DIADLO COc1cnccc1[C@H](C)[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000188774504 334871811 /nfs/dbraw/zinc/87/18/11/334871811.db2.gz YWECIZPMRKAMNS-NWDGAFQWSA-N 1 2 305.447 4.082 20 0 DIADLO COc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000188774568 334872244 /nfs/dbraw/zinc/87/22/44/334872244.db2.gz YWECIZPMRKAMNS-NEPJUHHUSA-N 1 2 305.447 4.082 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccn(-c3ccccc3F)n2)c(C)o1 ZINC000189441635 334895204 /nfs/dbraw/zinc/89/52/04/334895204.db2.gz UVTJTYRWUYLCTN-ZDUSSCGKSA-N 1 2 313.376 4.072 20 0 DIADLO COc1cnccc1[C@H](C)[NH2+]Cc1ccc(Oc2ccccc2)o1 ZINC000189549838 334900204 /nfs/dbraw/zinc/90/02/04/334900204.db2.gz MYFJNQCJVXFJRJ-AWEZNQCLSA-N 1 2 324.380 4.326 20 0 DIADLO C[C@H](CN(C)c1[nH+]ccc2ccc(F)cc21)c1nccs1 ZINC000343713041 335186147 /nfs/dbraw/zinc/18/61/47/335186147.db2.gz OHFFZNXZSAOZLB-LLVKDONJSA-N 1 2 301.390 4.070 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)n1 ZINC000343845645 335196787 /nfs/dbraw/zinc/19/67/87/335196787.db2.gz YFCSFICQMXACHE-HTQZYQBOSA-N 1 2 321.393 4.339 20 0 DIADLO C[C@H](Nc1[nH+]ccc2ccc(F)cc21)c1ccc2n[nH]cc2c1 ZINC000343950608 335207420 /nfs/dbraw/zinc/20/74/20/335207420.db2.gz BLZHMPSJTGYUBV-NSHDSACASA-N 1 2 306.344 4.423 20 0 DIADLO Cn1cc[nH+]c1CN1CCC(c2c(Cl)cccc2Cl)CC1 ZINC000344034514 335211078 /nfs/dbraw/zinc/21/10/78/335211078.db2.gz ROPKYDAJSLLFCK-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(F)c2ccccc21 ZINC000344105439 335223702 /nfs/dbraw/zinc/22/37/02/335223702.db2.gz PNLYVHNRYJGEEE-NSHDSACASA-N 1 2 311.360 4.090 20 0 DIADLO Brc1ccc(C[N@@H+]2CCCc3occc3C2)s1 ZINC000344296788 335237879 /nfs/dbraw/zinc/23/78/79/335237879.db2.gz UXVAGIAVIGEWAV-UHFFFAOYSA-N 1 2 312.232 4.052 20 0 DIADLO CCC[C@@H](NC(=O)c1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000344298821 335238164 /nfs/dbraw/zinc/23/81/64/335238164.db2.gz SNHKWDQTHRBQAP-LJQANCHMSA-N 1 2 319.408 4.144 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[N@H+](C)Cc3ccoc3)o2)cc1C ZINC000344368302 335245107 /nfs/dbraw/zinc/24/51/07/335245107.db2.gz OKHOWUCUFOQWIV-AWEZNQCLSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[N@@H+](C)Cc3ccoc3)o2)cc1C ZINC000344368302 335245108 /nfs/dbraw/zinc/24/51/08/335245108.db2.gz OKHOWUCUFOQWIV-AWEZNQCLSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1[nH]c(C(=O)N[C@@H](c2ccc(Cl)cc2)C2CCCC2)c[nH+]1 ZINC000344732547 335272064 /nfs/dbraw/zinc/27/20/64/335272064.db2.gz QZMWTQHMJFDJFY-MRXNPFEDSA-N 1 2 317.820 4.033 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]Cc2cc3cc(F)ccc3o2)cs1 ZINC000344710258 335274632 /nfs/dbraw/zinc/27/46/32/335274632.db2.gz MSCVXFJTAUJNQF-SNVBAGLBSA-N 1 2 320.389 4.026 20 0 DIADLO CCN(Cc1cccc(F)c1)c1cc(C)[nH+]c(-c2ccncc2)n1 ZINC000344905124 335284468 /nfs/dbraw/zinc/28/44/68/335284468.db2.gz NBKCQSBXCNFPLP-UHFFFAOYSA-N 1 2 322.387 4.013 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@H]2C)sc1C ZINC000345013763 335291255 /nfs/dbraw/zinc/29/12/55/335291255.db2.gz HLIROXLCAWOVPA-SNVBAGLBSA-N 1 2 308.397 4.157 20 0 DIADLO Cc1nc(C[N@H+]2CCc3c(F)cc(F)cc3[C@H]2C)sc1C ZINC000345013763 335291258 /nfs/dbraw/zinc/29/12/58/335291258.db2.gz HLIROXLCAWOVPA-SNVBAGLBSA-N 1 2 308.397 4.157 20 0 DIADLO C[N@H+](Cc1ccoc1)Cc1cc(Cl)ccc1OC(F)F ZINC000345088494 335297525 /nfs/dbraw/zinc/29/75/25/335297525.db2.gz CRZKVKKSLRPLDG-UHFFFAOYSA-N 1 2 301.720 4.166 20 0 DIADLO C[N@@H+](Cc1ccoc1)Cc1cc(Cl)ccc1OC(F)F ZINC000345088494 335297526 /nfs/dbraw/zinc/29/75/26/335297526.db2.gz CRZKVKKSLRPLDG-UHFFFAOYSA-N 1 2 301.720 4.166 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCS[C@H](C)[C@H]3C)cs2)o1 ZINC000345111801 335299165 /nfs/dbraw/zinc/29/91/65/335299165.db2.gz OMYDWMGQFHACDD-VXGBXAGGSA-N 1 2 308.472 4.037 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCS[C@H](C)[C@H]3C)cs2)o1 ZINC000345111801 335299166 /nfs/dbraw/zinc/29/91/66/335299166.db2.gz OMYDWMGQFHACDD-VXGBXAGGSA-N 1 2 308.472 4.037 20 0 DIADLO CC1CCC(OC2CC[NH+](Cc3ncc(C4CC4)o3)CC2)CC1 ZINC000366900905 335329408 /nfs/dbraw/zinc/32/94/08/335329408.db2.gz GLTFNCZMZOFGMH-UHFFFAOYSA-N 1 2 318.461 4.112 20 0 DIADLO C[C@@H]1CN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC(C)(C)C1 ZINC000345435310 335329661 /nfs/dbraw/zinc/32/96/61/335329661.db2.gz XOBBLPPRTFRUAS-HNNXBMFYSA-N 1 2 324.424 4.382 20 0 DIADLO CCCC1(C(=O)Nc2nc(C[NH+]3CCCCC3)cs2)CCC1 ZINC000345583780 335336259 /nfs/dbraw/zinc/33/62/59/335336259.db2.gz CTIOCGSKSJOWTM-UHFFFAOYSA-N 1 2 321.490 4.038 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc(Cl)s2)s1 ZINC000345881892 335357849 /nfs/dbraw/zinc/35/78/49/335357849.db2.gz USUNIZQVOARAJK-QMMMGPOBSA-N 1 2 301.868 4.227 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cc(C)c3ncccc3c2)s1 ZINC000346199085 335389377 /nfs/dbraw/zinc/38/93/77/335389377.db2.gz KTOIAQLAOHSKRU-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cc(C)c3ncccc3c2)s1 ZINC000346199085 335389378 /nfs/dbraw/zinc/38/93/78/335389378.db2.gz KTOIAQLAOHSKRU-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO CC(C)[C@@]1(C)C[C@@H]1c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000346378450 335402598 /nfs/dbraw/zinc/40/25/98/335402598.db2.gz BMMDVRMSCREOBQ-CRAIPNDOSA-N 1 2 308.385 4.072 20 0 DIADLO Cc1nc(-c2ccc([C@H](C)Nc3cc(C)[nH+]cn3)cc2)cs1 ZINC000346594259 335421960 /nfs/dbraw/zinc/42/19/60/335421960.db2.gz PXVAKDHJTZEYOT-LBPRGKRZSA-N 1 2 310.426 4.390 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)c(C(F)(F)F)cc1F)c1ccccn1 ZINC000346939317 335451727 /nfs/dbraw/zinc/45/17/27/335451727.db2.gz HUMLYEJKYYSJFX-VIFPVBQESA-N 1 2 316.273 4.229 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)c(C)s1 ZINC000348187960 335563692 /nfs/dbraw/zinc/56/36/92/335563692.db2.gz QRUGROOXHBIPJM-SECBINFHSA-N 1 2 309.504 4.365 20 0 DIADLO CCc1cccc(CSCc2[nH+]ccn2CC(F)(F)F)c1 ZINC000468650894 335568740 /nfs/dbraw/zinc/56/87/40/335568740.db2.gz WRFWSNLUVOVORO-UHFFFAOYSA-N 1 2 314.376 4.441 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2cccc(OC(C)(C)C)n2)cs1 ZINC000348329463 335578170 /nfs/dbraw/zinc/57/81/70/335578170.db2.gz YQQLUKUNKMEWOA-LBPRGKRZSA-N 1 2 319.474 4.129 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3ncc(C)s3)cs2)o1 ZINC000348488484 335590589 /nfs/dbraw/zinc/59/05/89/335590589.db2.gz FBHCUTBIKXAZNN-LLVKDONJSA-N 1 2 319.455 4.327 20 0 DIADLO Cc1nc(C[NH2+][C@@H](CC(F)(F)F)c2ccccc2C)oc1C ZINC000444792818 338489031 /nfs/dbraw/zinc/48/90/31/338489031.db2.gz QDFPTIPBUAQNMG-AWEZNQCLSA-N 1 2 312.335 4.383 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NCc2cc(C)nn2C)c1 ZINC000417843824 335643717 /nfs/dbraw/zinc/64/37/17/335643717.db2.gz VSKFTGPBSMYPDK-UHFFFAOYSA-N 1 2 323.444 4.004 20 0 DIADLO Clc1cnc(C[NH2+][C@@H](c2ccccc2)c2ccncc2)s1 ZINC000349642451 335687407 /nfs/dbraw/zinc/68/74/07/335687407.db2.gz BCYRGTMLAHTQKN-INIZCTEOSA-N 1 2 315.829 4.071 20 0 DIADLO Clc1cnc(C[NH2+]Cc2ccccc2N2CCCCC2)s1 ZINC000349645442 335687960 /nfs/dbraw/zinc/68/79/60/335687960.db2.gz LIDRVOUFZUQYNM-UHFFFAOYSA-N 1 2 321.877 4.077 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1csc(C2CC2)n1 ZINC000113315405 335691440 /nfs/dbraw/zinc/69/14/40/335691440.db2.gz LIQCVQBCMFQXDD-LBPRGKRZSA-N 1 2 302.443 4.188 20 0 DIADLO CCCC(CCC)[S@](=O)Cc1c[nH+]cn1Cc1ccccc1 ZINC000445482892 338496530 /nfs/dbraw/zinc/49/65/30/338496530.db2.gz RJNCIJYVYANXBZ-JOCHJYFZSA-N 1 2 318.486 4.149 20 0 DIADLO CCOc1ccccc1C[NH2+][C@@H](Cc1ccccc1)C(F)F ZINC000536706656 335866471 /nfs/dbraw/zinc/86/64/71/335866471.db2.gz PIVUGHXZMJTRTO-INIZCTEOSA-N 1 2 305.368 4.051 20 0 DIADLO Fc1ccc2cc[nH+]c(N3CC[C@]4(C3)OCc3ccccc34)c2c1 ZINC000350897313 335892619 /nfs/dbraw/zinc/89/26/19/335892619.db2.gz KRNVAPDGKFMVNU-HXUWFJFHSA-N 1 2 320.367 4.010 20 0 DIADLO CCC1(c2nc(Cn3c4ccccc4[nH+]c3C(C)C)no2)CC1 ZINC000445666339 338505093 /nfs/dbraw/zinc/50/50/93/338505093.db2.gz VBFZIRMWEXLLNA-UHFFFAOYSA-N 1 2 310.401 4.033 20 0 DIADLO CCN(Cc1c[nH+]cn1Cc1ccccc1)c1ccccc1C ZINC000445813205 338511088 /nfs/dbraw/zinc/51/10/88/338511088.db2.gz FGGXEXYROKGCSH-UHFFFAOYSA-N 1 2 305.425 4.266 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1cccc(O)c1Cl)CCC2 ZINC000351605285 336049427 /nfs/dbraw/zinc/04/94/27/336049427.db2.gz YQGUDPQCGSFOEE-CYBMUJFWSA-N 1 2 322.861 4.320 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1cccc(O)c1Cl)CCC2 ZINC000351605285 336049428 /nfs/dbraw/zinc/04/94/28/336049428.db2.gz YQGUDPQCGSFOEE-CYBMUJFWSA-N 1 2 322.861 4.320 20 0 DIADLO Fc1ccc2cc[nH+]c(N3CCC[C@H](c4nccs4)C3)c2c1 ZINC000351768649 336066265 /nfs/dbraw/zinc/06/62/65/336066265.db2.gz IWOQOZGHUSZNGY-ZDUSSCGKSA-N 1 2 313.401 4.214 20 0 DIADLO Cc1nccc(C[N@@H+]2CCc3c(Cl)cc(Cl)cc3[C@H]2C)n1 ZINC000351773694 336068173 /nfs/dbraw/zinc/06/81/73/336068173.db2.gz HQFHTDDOQCXRKI-SNVBAGLBSA-N 1 2 322.239 4.211 20 0 DIADLO Cc1nccc(C[N@H+]2CCc3c(Cl)cc(Cl)cc3[C@H]2C)n1 ZINC000351773694 336068175 /nfs/dbraw/zinc/06/81/75/336068175.db2.gz HQFHTDDOQCXRKI-SNVBAGLBSA-N 1 2 322.239 4.211 20 0 DIADLO Cc1nccc(C[N@@H+]2CCc3cc(Cl)c(Cl)cc3[C@@H]2C)n1 ZINC000351776091 336068588 /nfs/dbraw/zinc/06/85/88/336068588.db2.gz YDGIHWDITBXBAI-JTQLQIEISA-N 1 2 322.239 4.211 20 0 DIADLO Cc1nccc(C[N@H+]2CCc3cc(Cl)c(Cl)cc3[C@@H]2C)n1 ZINC000351776091 336068589 /nfs/dbraw/zinc/06/85/89/336068589.db2.gz YDGIHWDITBXBAI-JTQLQIEISA-N 1 2 322.239 4.211 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nnc2n1CCCCC2)c1cc2ccccc2o1 ZINC000324181625 336103128 /nfs/dbraw/zinc/10/31/28/336103128.db2.gz HWKWTQIWOJMECS-KGLIPLIRSA-N 1 2 324.428 4.163 20 0 DIADLO Cc1ccc(NC(=O)NC[C@@H]2CCCCC(F)(F)C2)c(C)[nH+]1 ZINC000331948177 336153982 /nfs/dbraw/zinc/15/39/82/336153982.db2.gz HAUQUUBBKHBSPW-CYBMUJFWSA-N 1 2 311.376 4.036 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(=O)c2sccc2[nH]1)[C@@H](C)C1CCCCC1 ZINC000332120627 336159403 /nfs/dbraw/zinc/15/94/03/336159403.db2.gz YVBIBWDWPHXNNA-VXGBXAGGSA-N 1 2 319.474 4.091 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC000332484331 336172763 /nfs/dbraw/zinc/17/27/63/336172763.db2.gz NIOBKLSGNDRWPV-HRCADAONSA-N 1 2 301.434 4.179 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](C)c1cc2ccccc2o1 ZINC000351922939 336178879 /nfs/dbraw/zinc/17/88/79/336178879.db2.gz MYTULZAOOVYYRA-GFCCVEGCSA-N 1 2 309.369 4.327 20 0 DIADLO Cn1ncc(Cl)c1C[N@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000526114394 336179346 /nfs/dbraw/zinc/17/93/46/336179346.db2.gz LJEORJHYNRCMKK-UHFFFAOYSA-N 1 2 305.853 4.003 20 0 DIADLO Cn1ncc(Cl)c1C[N@@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000526114394 336179348 /nfs/dbraw/zinc/17/93/48/336179348.db2.gz LJEORJHYNRCMKK-UHFFFAOYSA-N 1 2 305.853 4.003 20 0 DIADLO Cc1ccccc1CN(C(=O)Nc1c(C)cc[nH+]c1C)C1CC1 ZINC000351954779 336182726 /nfs/dbraw/zinc/18/27/26/336182726.db2.gz BFJOXHIOHYYIRO-UHFFFAOYSA-N 1 2 309.413 4.203 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)cc1 ZINC000351998102 336187181 /nfs/dbraw/zinc/18/71/81/336187181.db2.gz XGKZUOSRPZIQAK-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ncc(Cl)s2)cc1 ZINC000351998102 336187182 /nfs/dbraw/zinc/18/71/82/336187182.db2.gz XGKZUOSRPZIQAK-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO COCC[N@H+](Cc1ncc(Cl)s1)[C@@H](C)c1ccccc1 ZINC000352010594 336188521 /nfs/dbraw/zinc/18/85/21/336188521.db2.gz GUPBKJUDUZHDGQ-LBPRGKRZSA-N 1 2 310.850 4.006 20 0 DIADLO COCC[N@@H+](Cc1ncc(Cl)s1)[C@@H](C)c1ccccc1 ZINC000352010594 336188523 /nfs/dbraw/zinc/18/85/23/336188523.db2.gz GUPBKJUDUZHDGQ-LBPRGKRZSA-N 1 2 310.850 4.006 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)c1 ZINC000352011968 336188908 /nfs/dbraw/zinc/18/89/08/336188908.db2.gz WWNALKHBIXKZGO-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2ncc(Cl)s2)c1 ZINC000352011968 336188909 /nfs/dbraw/zinc/18/89/09/336188909.db2.gz WWNALKHBIXKZGO-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO Cn1c[nH+]cc1CNc1ccccc1Nc1ccc(F)cc1F ZINC000352022364 336189693 /nfs/dbraw/zinc/18/96/93/336189693.db2.gz XQISCZXWZXZKIG-UHFFFAOYSA-N 1 2 314.339 4.054 20 0 DIADLO OC[C@@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1ccsc1 ZINC000352030948 336190815 /nfs/dbraw/zinc/19/08/15/336190815.db2.gz BSMLGEIVKLHREV-OAHLLOKOSA-N 1 2 322.499 4.076 20 0 DIADLO CC(C)Sc1ccc(C(=O)N[C@H](c2[nH]cc[nH+]2)C(C)C)cc1 ZINC000352142336 336196530 /nfs/dbraw/zinc/19/65/30/336196530.db2.gz UXAXBTBYIWLWGE-HNNXBMFYSA-N 1 2 317.458 4.037 20 0 DIADLO CCCC[C@H](C)C(=O)NCc1ccc2c(c1)[nH+]c(C)n2C1CC1 ZINC000352409433 336216323 /nfs/dbraw/zinc/21/63/23/336216323.db2.gz ZRPXOXWUHAZPJB-ZDUSSCGKSA-N 1 2 313.445 4.122 20 0 DIADLO Fc1cc(C[N@@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)ccc1Cl ZINC000352429232 336218099 /nfs/dbraw/zinc/21/80/99/336218099.db2.gz ATLUFVKMIVLWOT-HZPDHXFCSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cc(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)ccc1Cl ZINC000352429232 336218100 /nfs/dbraw/zinc/21/81/00/336218100.db2.gz ATLUFVKMIVLWOT-HZPDHXFCSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c(Cl)c1 ZINC000352437893 336218647 /nfs/dbraw/zinc/21/86/47/336218647.db2.gz DWGVFMMXZPNLLS-CVEARBPZSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c(Cl)c1 ZINC000352437893 336218648 /nfs/dbraw/zinc/21/86/48/336218648.db2.gz DWGVFMMXZPNLLS-CVEARBPZSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cccc(Cl)c1C[N@@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000352439169 336218782 /nfs/dbraw/zinc/21/87/82/336218782.db2.gz KHJMZRDTIVOYQB-JKSUJKDBSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cccc(Cl)c1C[N@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000352439169 336218783 /nfs/dbraw/zinc/21/87/83/336218783.db2.gz KHJMZRDTIVOYQB-JKSUJKDBSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)cc1C[N@@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000352440302 336218881 /nfs/dbraw/zinc/21/88/81/336218881.db2.gz NECIVLUGUBJEGM-HZPDHXFCSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)cc1C[N@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000352440302 336218882 /nfs/dbraw/zinc/21/88/82/336218882.db2.gz NECIVLUGUBJEGM-HZPDHXFCSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1c(Cl)cccc1C[N@@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000352441200 336218954 /nfs/dbraw/zinc/21/89/54/336218954.db2.gz UBJNWSNFBDYTCH-GDBMZVCRSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1c(Cl)cccc1C[N@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000352441200 336218955 /nfs/dbraw/zinc/21/89/55/336218955.db2.gz UBJNWSNFBDYTCH-GDBMZVCRSA-N 1 2 309.812 4.013 20 0 DIADLO Cc1ccc(NCc2ccc(Sc3ccccn3)o2)c(C)[nH+]1 ZINC000352692267 336230660 /nfs/dbraw/zinc/23/06/60/336230660.db2.gz GLSXCFYGTLBGEQ-UHFFFAOYSA-N 1 2 311.410 4.450 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc(Br)cc2F)o1 ZINC000042206124 336237253 /nfs/dbraw/zinc/23/72/53/336237253.db2.gz XSUPNSLUELUOKD-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc(Br)cc2F)o1 ZINC000042206124 336237254 /nfs/dbraw/zinc/23/72/54/336237254.db2.gz XSUPNSLUELUOKD-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1cc(Cl)cc(C(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)c1 ZINC000532418932 336245931 /nfs/dbraw/zinc/24/59/31/336245931.db2.gz UCEMVIVLAMAQON-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO CC[C@H]([NH2+][C@H](c1nccn1C)c1ccccc1)c1ccc(F)cc1 ZINC000532453200 336247926 /nfs/dbraw/zinc/24/79/26/336247926.db2.gz GTRZAOJOPZFKOO-OALUTQOASA-N 1 2 323.415 4.390 20 0 DIADLO CCCC[N@H+](Cc1cn2ccsc2n1)Cc1ccccc1F ZINC000532549955 336256009 /nfs/dbraw/zinc/25/60/09/336256009.db2.gz FYUZPQLVCFWICT-UHFFFAOYSA-N 1 2 317.433 4.337 20 0 DIADLO CCCC[N@@H+](Cc1cn2ccsc2n1)Cc1ccccc1F ZINC000532549955 336256010 /nfs/dbraw/zinc/25/60/10/336256010.db2.gz FYUZPQLVCFWICT-UHFFFAOYSA-N 1 2 317.433 4.337 20 0 DIADLO CCC(CC)n1ccc(C[N@H+](Cc2ccccn2)C(C)C)n1 ZINC000532604817 336257334 /nfs/dbraw/zinc/25/73/34/336257334.db2.gz QVSCSZDLTBMZSA-UHFFFAOYSA-N 1 2 300.450 4.050 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+](Cc2ccccn2)C(C)C)n1 ZINC000532604817 336257335 /nfs/dbraw/zinc/25/73/35/336257335.db2.gz QVSCSZDLTBMZSA-UHFFFAOYSA-N 1 2 300.450 4.050 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc(F)cc1F ZINC000192751577 336260605 /nfs/dbraw/zinc/26/06/05/336260605.db2.gz LYMFGSIRWXQOCS-LBPRGKRZSA-N 1 2 303.356 4.133 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc(N3CCCC3)[nH+]c2)cc1F ZINC000192751780 336260636 /nfs/dbraw/zinc/26/06/36/336260636.db2.gz VIANHWMKIFNXMR-ZDUSSCGKSA-N 1 2 315.392 4.003 20 0 DIADLO Cc1ccccc1C[N@@H+](C)[C@H](C)c1nc(Cc2ccccc2)no1 ZINC000532749341 336269671 /nfs/dbraw/zinc/26/96/71/336269671.db2.gz FXOZOXGDDITNJD-MRXNPFEDSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1ccccc1C[N@H+](C)[C@H](C)c1nc(Cc2ccccc2)no1 ZINC000532749341 336269672 /nfs/dbraw/zinc/26/96/72/336269672.db2.gz FXOZOXGDDITNJD-MRXNPFEDSA-N 1 2 321.424 4.162 20 0 DIADLO CCc1nc(C[N@H+](C)[C@@H]2CCc3c2cccc3Cl)cs1 ZINC000532779393 336270939 /nfs/dbraw/zinc/27/09/39/336270939.db2.gz QNBYUKCKJWACQD-OAHLLOKOSA-N 1 2 306.862 4.478 20 0 DIADLO CCc1nc(C[N@@H+](C)[C@@H]2CCc3c2cccc3Cl)cs1 ZINC000532779393 336270940 /nfs/dbraw/zinc/27/09/40/336270940.db2.gz QNBYUKCKJWACQD-OAHLLOKOSA-N 1 2 306.862 4.478 20 0 DIADLO Cc1ccc([C@@H](C)Nc2cc(C)[nH+]c(-c3cccnc3)n2)s1 ZINC000301076259 336288707 /nfs/dbraw/zinc/28/87/07/336288707.db2.gz IRHJTNZQPKLIES-CYBMUJFWSA-N 1 2 310.426 4.390 20 0 DIADLO Cc1cc(N[C@H]2CCc3cc(F)ccc32)nc(-c2cccnc2)[nH+]1 ZINC000301084114 336289165 /nfs/dbraw/zinc/28/91/65/336289165.db2.gz JCJPAQQTFXMJOH-KRWDZBQOSA-N 1 2 320.371 4.086 20 0 DIADLO COc1ccc(OC)c([C@@H](C)Nc2ccc3ccccc3[nH+]2)c1 ZINC000301087818 336289316 /nfs/dbraw/zinc/28/93/16/336289316.db2.gz YKFRSPFRNPLQTG-CYBMUJFWSA-N 1 2 308.381 4.425 20 0 DIADLO Cc1cc([C@H](C)Nc2cc(C)[nH+]c(-c3cccnc3)n2)c(C)o1 ZINC000301108601 336290369 /nfs/dbraw/zinc/29/03/69/336290369.db2.gz QMYMSWKFCACATI-ZDUSSCGKSA-N 1 2 308.385 4.230 20 0 DIADLO Cc1cc(N2CCc3[nH]c4ccc(F)cc4c3C2)nc(C(C)C)[nH+]1 ZINC000301114358 336290674 /nfs/dbraw/zinc/29/06/74/336290674.db2.gz WVPDIRGHOZKFCO-UHFFFAOYSA-N 1 2 324.403 4.092 20 0 DIADLO Cc1cc(NCc2cccc(OCC(F)F)c2)nc(C(C)C)[nH+]1 ZINC000301173495 336293239 /nfs/dbraw/zinc/29/32/39/336293239.db2.gz KTMRPYNAXGRMTE-UHFFFAOYSA-N 1 2 321.371 4.164 20 0 DIADLO CCc1cc(N[C@@H](C)c2cc(C)oc2C)nc(-c2ccncc2)[nH+]1 ZINC000301178727 336293566 /nfs/dbraw/zinc/29/35/66/336293566.db2.gz OFFMKXBWJXXMCX-ZDUSSCGKSA-N 1 2 322.412 4.484 20 0 DIADLO CCc1cc(N(CC)Cc2cccs2)nc(-c2ccncc2)[nH+]1 ZINC000301187284 336293955 /nfs/dbraw/zinc/29/39/55/336293955.db2.gz VSZUFYLGSYCQBF-UHFFFAOYSA-N 1 2 324.453 4.189 20 0 DIADLO CCc1cc(NCc2cccc(C)c2)nc(-c2ccncc2)[nH+]1 ZINC000301191492 336294113 /nfs/dbraw/zinc/29/41/13/336294113.db2.gz ZKLKBWVUYKHDQR-UHFFFAOYSA-N 1 2 304.397 4.022 20 0 DIADLO C[C@@H](Nc1cc(N2CCCCC2)nc[nH+]1)c1cc2ccccc2o1 ZINC000301225587 336295662 /nfs/dbraw/zinc/29/56/62/336295662.db2.gz DJGYCXRDXSKKOY-CQSZACIVSA-N 1 2 322.412 4.386 20 0 DIADLO C[C@@H](Nc1cc(N2CCCCC2)[nH+]cn1)c1cc2ccccc2o1 ZINC000301225587 336295663 /nfs/dbraw/zinc/29/56/63/336295663.db2.gz DJGYCXRDXSKKOY-CQSZACIVSA-N 1 2 322.412 4.386 20 0 DIADLO Cc1cc(N[C@@H](c2ccccc2)C2CC2)nc(-c2ccncc2)[nH+]1 ZINC000301230395 336295802 /nfs/dbraw/zinc/29/58/02/336295802.db2.gz FFBUOIDZICZAPO-IBGZPJMESA-N 1 2 316.408 4.410 20 0 DIADLO CC(C)c1nc(N[C@H]2CCOc3c(Cl)cccc32)cc[nH+]1 ZINC000301234869 336296124 /nfs/dbraw/zinc/29/61/24/336296124.db2.gz JUNYPAYHTNDJKP-ZDUSSCGKSA-N 1 2 303.793 4.189 20 0 DIADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1ccc(Br)cc1 ZINC000301257353 336297178 /nfs/dbraw/zinc/29/71/78/336297178.db2.gz RIEXIPMYECGLFJ-SNVBAGLBSA-N 1 2 318.218 4.290 20 0 DIADLO Cc1cc([C@H](C)Nc2cc(N3CCC[C@H](C)C3)nc[nH+]2)c(C)o1 ZINC000301265563 336297536 /nfs/dbraw/zinc/29/75/36/336297536.db2.gz UBIHPYXJXDEZHI-JSGCOSHPSA-N 1 2 314.433 4.096 20 0 DIADLO Cc1cc([C@H](C)Nc2cc(N3CCC[C@H](C)C3)[nH+]cn2)c(C)o1 ZINC000301265563 336297537 /nfs/dbraw/zinc/29/75/37/336297537.db2.gz UBIHPYXJXDEZHI-JSGCOSHPSA-N 1 2 314.433 4.096 20 0 DIADLO CCc1cc(N(C)[C@@H](C)c2ccccc2)nc(-c2ccncc2)[nH+]1 ZINC000301304766 336300006 /nfs/dbraw/zinc/30/00/06/336300006.db2.gz ZLOAWWVHTJOBED-HNNXBMFYSA-N 1 2 318.424 4.298 20 0 DIADLO Cc1cccc(NC2CCN(c3cc(C)[nH+]c(C(C)C)n3)CC2)c1 ZINC000301342950 336301636 /nfs/dbraw/zinc/30/16/36/336301636.db2.gz ITPXJPOCIHVUEE-UHFFFAOYSA-N 1 2 324.472 4.298 20 0 DIADLO CCc1cc(N2[C@H](C)C[C@H]3CCCC[C@H]32)nc(-c2ccncc2)[nH+]1 ZINC000301350000 336301999 /nfs/dbraw/zinc/30/19/99/336301999.db2.gz JMXOMOGNTYPROB-QGPMSJSTSA-N 1 2 322.456 4.258 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NCCc2c[nH]c3ccccc23)c1 ZINC000301437941 336306678 /nfs/dbraw/zinc/30/66/78/336306678.db2.gz NFQQUBCNYWZZFW-UHFFFAOYSA-N 1 2 305.303 4.236 20 0 DIADLO Cc1cc(N(Cc2ccco2)Cc2ccco2)nc(C(C)C)[nH+]1 ZINC000301519492 336312006 /nfs/dbraw/zinc/31/20/06/336312006.db2.gz KUKBYRAMUSQGKZ-UHFFFAOYSA-N 1 2 311.385 4.301 20 0 DIADLO Cc1ccccc1[C@@H]1CCCN1c1cc(N2CCCCC2)[nH+]cn1 ZINC000301529093 336312708 /nfs/dbraw/zinc/31/27/08/336312708.db2.gz OOBNOAWKBZMNBY-SFHVURJKSA-N 1 2 322.456 4.117 20 0 DIADLO Cc1ccccc1[C@@H]1CCCN1c1cc(N2CCCCC2)nc[nH+]1 ZINC000301529093 336312709 /nfs/dbraw/zinc/31/27/09/336312709.db2.gz OOBNOAWKBZMNBY-SFHVURJKSA-N 1 2 322.456 4.117 20 0 DIADLO CO[C@@H](CNc1cc(C(F)(F)F)cc[nH+]1)c1ccc(F)cc1 ZINC000301529119 336312744 /nfs/dbraw/zinc/31/27/44/336312744.db2.gz HAXGGOMQPBFEOL-ZDUSSCGKSA-N 1 2 314.282 4.039 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCc1cn2c(cccc2C)n1 ZINC000301537937 336313175 /nfs/dbraw/zinc/31/31/75/336313175.db2.gz BCCNUHYESZAZFX-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO CC(C)(C)c1csc(CNc2cc[nH+]c(C(C)(C)C)n2)n1 ZINC000301539991 336313424 /nfs/dbraw/zinc/31/34/24/336313424.db2.gz RTCLGIJEPVWHHU-UHFFFAOYSA-N 1 2 304.463 4.140 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCc1ccc(N2CCCC2)nc1 ZINC000301558407 336314804 /nfs/dbraw/zinc/31/48/04/336314804.db2.gz JJDMYQCTBICCSM-UHFFFAOYSA-N 1 2 318.424 4.151 20 0 DIADLO Cc1cnc([C@@H](Nc2cc(C(F)(F)F)cc[nH+]2)C2CC2)s1 ZINC000301557427 336314855 /nfs/dbraw/zinc/31/48/55/336314855.db2.gz NSXRUODYAQWERU-LBPRGKRZSA-N 1 2 313.348 4.429 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCCCc1nc(C(C)C)no1 ZINC000301578738 336316155 /nfs/dbraw/zinc/31/61/55/336316155.db2.gz RIYRPONJTFCUKH-UHFFFAOYSA-N 1 2 310.401 4.094 20 0 DIADLO Cc1cc(N[C@H](COc2ccccc2F)c2ccccc2)nc[nH+]1 ZINC000301595051 336317053 /nfs/dbraw/zinc/31/70/53/336317053.db2.gz YVWJMSVHRSLXOE-QGZVFWFLSA-N 1 2 323.371 4.156 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCc1cn2cc(Cl)ccc2n1 ZINC000301593845 336317121 /nfs/dbraw/zinc/31/71/21/336317121.db2.gz ZFFLHGZFZWRHFV-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO COc1cccc2c1CC[C@H]2Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000301614868 336318440 /nfs/dbraw/zinc/31/84/40/336318440.db2.gz AZJNVBAHYRVXGY-CYBMUJFWSA-N 1 2 308.303 4.208 20 0 DIADLO C[C@@H]1CCN(c2nc(-c3ccccc3)cs2)C[C@H]1n1cc[nH+]c1 ZINC000301624033 336318979 /nfs/dbraw/zinc/31/89/79/336318979.db2.gz FSTSETZBBINHQL-RHSMWYFYSA-N 1 2 324.453 4.094 20 0 DIADLO Cc1cc(C)c(CNc2cc(C)[nH+]c3c(F)cccc23)c(=O)[nH]1 ZINC000301643695 336320200 /nfs/dbraw/zinc/32/02/00/336320200.db2.gz CAQSFOIEGVBVLA-UHFFFAOYSA-N 1 2 311.360 4.012 20 0 DIADLO C[C@@H]1CCN(c2ncc(-c3ccccc3)s2)C[C@H]1n1cc[nH+]c1 ZINC000301649691 336320815 /nfs/dbraw/zinc/32/08/15/336320815.db2.gz RKRXTNZDCDCCOA-GDBMZVCRSA-N 1 2 324.453 4.094 20 0 DIADLO Cc1cc(N[C@@H](C)C(=O)Nc2ccccc2)c2cccc(F)c2[nH+]1 ZINC000301654334 336321122 /nfs/dbraw/zinc/32/11/22/336321122.db2.gz HIJVNUMRLKOHFV-ZDUSSCGKSA-N 1 2 323.371 4.121 20 0 DIADLO Clc1ccc(O[C@@H]2CCN(c3cccc[nH+]3)C2)cc1Cl ZINC000301657737 336321157 /nfs/dbraw/zinc/32/11/57/336321157.db2.gz SMJHHZATYYGPDH-GFCCVEGCSA-N 1 2 309.196 4.046 20 0 DIADLO COCc1cccc(CNc2cc(C)[nH+]c3c(F)cccc23)c1 ZINC000301657224 336321186 /nfs/dbraw/zinc/32/11/86/336321186.db2.gz IEHOKTZIRJKXCW-UHFFFAOYSA-N 1 2 310.372 4.441 20 0 DIADLO Cc1nc(N2CC[C@H](CSc3ccccc3)C2)c(C)c(C)[nH+]1 ZINC000301692417 336323755 /nfs/dbraw/zinc/32/37/55/336323755.db2.gz OGAGSFVVWWYZHM-INIZCTEOSA-N 1 2 313.470 4.020 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCO[C@H](c2ccccc2F)C1 ZINC000301694662 336323846 /nfs/dbraw/zinc/32/38/46/336323846.db2.gz ANHZYOQEGTXEEG-IBGZPJMESA-N 1 2 322.383 4.260 20 0 DIADLO CC(=O)Nc1cccc(CNc2[nH+]c3ccccc3cc2C)c1 ZINC000301697553 336324196 /nfs/dbraw/zinc/32/41/96/336324196.db2.gz NVLAPVRTHBWUMW-UHFFFAOYSA-N 1 2 305.381 4.114 20 0 DIADLO Cc1cc([C@@](C)(O)CNc2[nH+]c3ccccc3cc2C)c(C)o1 ZINC000301739099 336326725 /nfs/dbraw/zinc/32/67/25/336326725.db2.gz WRDHXPPPJXSMFQ-IBGZPJMESA-N 1 2 310.397 4.073 20 0 DIADLO CCOCCC1(CNc2cc(C)[nH+]c3c(F)cccc23)CC1 ZINC000301773369 336328880 /nfs/dbraw/zinc/32/88/80/336328880.db2.gz FJPPKCHWYRECTN-UHFFFAOYSA-N 1 2 302.393 4.301 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCC(C2CCOCC2)CC1 ZINC000301778688 336329259 /nfs/dbraw/zinc/32/92/59/336329259.db2.gz QHUFNBLVQIOKNN-UHFFFAOYSA-N 1 2 310.441 4.186 20 0 DIADLO CC(C)c1cc(NC[C@H](O)c2ccccc2F)nc(C(C)C)[nH+]1 ZINC000301803205 336331153 /nfs/dbraw/zinc/33/11/53/336331153.db2.gz CZJCPFMSRNIYSK-INIZCTEOSA-N 1 2 317.408 4.008 20 0 DIADLO CC(C)c1cc(NC[C@@H](O)c2ccc(F)cc2)nc(C(C)C)[nH+]1 ZINC000301810798 336331625 /nfs/dbraw/zinc/33/16/25/336331625.db2.gz GWBCIDKERHMBNY-MRXNPFEDSA-N 1 2 317.408 4.008 20 0 DIADLO CC(C)c1cc(N[C@@H](CCO)c2cccs2)nc(C(C)C)[nH+]1 ZINC000301816164 336331941 /nfs/dbraw/zinc/33/19/41/336331941.db2.gz JBZDLDMDQKMNMG-ZDUSSCGKSA-N 1 2 319.474 4.321 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CCc3c([nH]c4ccccc43)C2)c1 ZINC000301824994 336332540 /nfs/dbraw/zinc/33/25/40/336332540.db2.gz DJUMCLDUUSSVMB-UHFFFAOYSA-N 1 2 317.314 4.144 20 0 DIADLO CCc1cnc(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)s1 ZINC000301854678 336334381 /nfs/dbraw/zinc/33/43/81/336334381.db2.gz HOFQRISGKNFKTK-UHFFFAOYSA-N 1 2 304.463 4.354 20 0 DIADLO Nc1nc(N2CCC[C@H]2c2cccc(Cl)c2)[nH+]c2ccccc12 ZINC000301873033 336335590 /nfs/dbraw/zinc/33/55/90/336335590.db2.gz JFZQWCHJPIOXRB-INIZCTEOSA-N 1 2 324.815 4.207 20 0 DIADLO C[C@H](Nc1[nH+]cnc2c1cnn2C(C)(C)C)[C@@H](C)c1ccccc1 ZINC000301891149 336336510 /nfs/dbraw/zinc/33/65/10/336336510.db2.gz OBTSYFMNAWJFPQ-KGLIPLIRSA-N 1 2 323.444 4.185 20 0 DIADLO Cc1cccc([C@H](C)Nc2[nH+]cnc3c2cnn3C(C)(C)C)c1C ZINC000301902255 336337334 /nfs/dbraw/zinc/33/73/34/336337334.db2.gz WHGZIVMTCMPGHH-AWEZNQCLSA-N 1 2 323.444 4.371 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2N[C@H](c1ccccc1)C1CC1 ZINC000301906710 336337559 /nfs/dbraw/zinc/33/75/59/336337559.db2.gz ZGRYNCQKERIPBV-MRXNPFEDSA-N 1 2 321.428 4.145 20 0 DIADLO CC[C@@H](Nc1nc(N)c2ccccc2[nH+]1)c1ccc(F)cc1F ZINC000301914649 336337872 /nfs/dbraw/zinc/33/78/72/336337872.db2.gz UZFRECQIFJSDMY-CQSZACIVSA-N 1 2 314.339 4.053 20 0 DIADLO COc1ccc2[nH+]c(C)nc(NCc3cc4ccccc4[nH]3)c2c1 ZINC000301953642 336339723 /nfs/dbraw/zinc/33/97/23/336339723.db2.gz JYXQVSITDLKVIA-UHFFFAOYSA-N 1 2 318.380 4.040 20 0 DIADLO c1[nH]c(CNc2ccc3ccccc3[nH+]2)nc1-c1ccccc1 ZINC000301985344 336341461 /nfs/dbraw/zinc/34/14/61/336341461.db2.gz LGRRTXFEJBVXIP-UHFFFAOYSA-N 1 2 300.365 4.237 20 0 DIADLO Cc1cc(NCc2ccc(OC(C)(C)C)nc2)nc(C(C)C)[nH+]1 ZINC000302016611 336343279 /nfs/dbraw/zinc/34/32/79/336343279.db2.gz CFYHQURTDUBHHP-UHFFFAOYSA-N 1 2 314.433 4.093 20 0 DIADLO CC(C)c1cc(NCc2ccc(Cl)cn2)nc(C(C)C)[nH+]1 ZINC000302039783 336344787 /nfs/dbraw/zinc/34/47/87/336344787.db2.gz VZLVHVJPJUJSQN-UHFFFAOYSA-N 1 2 304.825 4.384 20 0 DIADLO CC[C@H](Nc1nc(C)[nH+]c2c1CCCC2)c1nc2ccccc2[nH]1 ZINC000302063163 336346306 /nfs/dbraw/zinc/34/63/06/336346306.db2.gz UQHUYJHLWODSKT-AWEZNQCLSA-N 1 2 321.428 4.103 20 0 DIADLO Cc1cc(NCc2ccc(Cl)c(C)c2)nc(-c2cccnc2)[nH+]1 ZINC000302114241 336349161 /nfs/dbraw/zinc/34/91/61/336349161.db2.gz BXYVBZRPTOIMRW-UHFFFAOYSA-N 1 2 324.815 4.421 20 0 DIADLO C[C@](O)(CNc1ccc2ccccc2[nH+]1)c1cccc(Cl)c1 ZINC000302181054 336352752 /nfs/dbraw/zinc/35/27/52/336352752.db2.gz QQIPZMLCKFPTRV-SFHVURJKSA-N 1 2 312.800 4.208 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CC[C@]2(C1)OCc1ccccc12 ZINC000302251903 336356285 /nfs/dbraw/zinc/35/62/85/336356285.db2.gz NFYDIAOBPGPHCN-OAQYLSRUSA-N 1 2 316.404 4.179 20 0 DIADLO COc1cccc2c(NC[C@H](C)c3ncc(C)s3)cc[nH+]c12 ZINC000302494076 336359988 /nfs/dbraw/zinc/35/99/88/336359988.db2.gz AUZYQCIWCOFWFC-NSHDSACASA-N 1 2 313.426 4.224 20 0 DIADLO COc1cccc2c(N[C@H](C)C[C@H](O)c3ccccc3)cc[nH+]c12 ZINC000302516063 336360634 /nfs/dbraw/zinc/36/06/34/336360634.db2.gz HHEAFIBPSYJZMF-KDOFPFPSSA-N 1 2 322.408 4.168 20 0 DIADLO COc1cccc2c(N3C[C@@H](C)C[C@H]3c3cccnc3)cc[nH+]c12 ZINC000302523733 336360810 /nfs/dbraw/zinc/36/08/10/336360810.db2.gz JJXHLECGOACUMA-KSSFIOAISA-N 1 2 319.408 4.226 20 0 DIADLO COc1cccc2c(N3CCC(C(F)(F)F)CC3)cc[nH+]c12 ZINC000302542968 336361164 /nfs/dbraw/zinc/36/11/64/336361164.db2.gz OHELDPCZMMTURS-UHFFFAOYSA-N 1 2 310.319 4.022 20 0 DIADLO COc1cccc2c(NCc3ccc(C(C)(C)O)cc3)cc[nH+]c12 ZINC000302545803 336361320 /nfs/dbraw/zinc/36/13/20/336361320.db2.gz OZBWFPPUFCYPCG-UHFFFAOYSA-N 1 2 322.408 4.083 20 0 DIADLO CC1(C)CN(c2cc(C(F)(F)F)cc[nH+]2)CC2(CCCC2)O1 ZINC000302680632 336364755 /nfs/dbraw/zinc/36/47/55/336364755.db2.gz RRRFWQPYXRBJJA-UHFFFAOYSA-N 1 2 314.351 4.028 20 0 DIADLO Fc1cccc2c(NCCCCNc3cccc[nH+]3)ccnc12 ZINC000302709715 336365900 /nfs/dbraw/zinc/36/59/00/336365900.db2.gz WULGSUZAIKMDFQ-UHFFFAOYSA-N 1 2 310.376 4.073 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NC[C@H](c1ccnn1C)C(C)C ZINC000302782455 336368910 /nfs/dbraw/zinc/36/89/10/336368910.db2.gz SQDSSQHXDUJHCC-INIZCTEOSA-N 1 2 308.429 4.128 20 0 DIADLO CC1=CC[N@H+]([C@@H](C)c2nnc(-c3ccccc3F)s2)CC1 ZINC000514118943 336370065 /nfs/dbraw/zinc/37/00/65/336370065.db2.gz OVXSAZKVHFMGLR-LBPRGKRZSA-N 1 2 303.406 4.057 20 0 DIADLO CC1=CC[N@@H+]([C@@H](C)c2nnc(-c3ccccc3F)s2)CC1 ZINC000514118943 336370066 /nfs/dbraw/zinc/37/00/66/336370066.db2.gz OVXSAZKVHFMGLR-LBPRGKRZSA-N 1 2 303.406 4.057 20 0 DIADLO CC(C)c1nc(N[C@H](CCO)c2ccco2)cc(C(C)(C)C)[nH+]1 ZINC000302823983 336370627 /nfs/dbraw/zinc/37/06/27/336370627.db2.gz FYYYYLXRWWLJJQ-CYBMUJFWSA-N 1 2 317.433 4.026 20 0 DIADLO CC(C)c1nc(N[C@@H]2CCO[C@H](C3CC3)C2)cc(C(C)(C)C)[nH+]1 ZINC000302840290 336371677 /nfs/dbraw/zinc/37/16/77/336371677.db2.gz LKTYEVLKAPHISH-CABCVRRESA-N 1 2 317.477 4.267 20 0 DIADLO Cc1cnc(CNc2cc(C(C)(C)C)[nH+]c(C(C)C)n2)s1 ZINC000302872640 336372702 /nfs/dbraw/zinc/37/27/02/336372702.db2.gz CAQKXTWPFVDTJV-UHFFFAOYSA-N 1 2 304.463 4.275 20 0 DIADLO Cc1ccc(CN(C)C(=O)c2cccc(Oc3cc[nH+]cc3)c2)o1 ZINC000352896340 336372812 /nfs/dbraw/zinc/37/28/12/336372812.db2.gz BDELERRHUBIVAZ-UHFFFAOYSA-N 1 2 322.364 4.048 20 0 DIADLO COc1ccc(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)cc1 ZINC000352907145 336375888 /nfs/dbraw/zinc/37/58/88/336375888.db2.gz YVCDHBVYWIYHIC-UHFFFAOYSA-N 1 2 320.348 4.135 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)CN(c1[nH+]ccc3cc(F)ccc31)C2 ZINC000514598407 336385520 /nfs/dbraw/zinc/38/55/20/336385520.db2.gz BGWZVKKOHHWNDG-UHFFFAOYSA-N 1 2 320.367 4.131 20 0 DIADLO FC(F)C1([NH2+]Cc2cnc([C@H]3CCCO3)s2)CCCCC1 ZINC000353038380 336386730 /nfs/dbraw/zinc/38/67/30/336386730.db2.gz MQTOQKYRHILCMA-GFCCVEGCSA-N 1 2 316.417 4.052 20 0 DIADLO C[C@H]([NH2+]Cc1nnsc1Cl)c1ccc(F)c2ccccc21 ZINC000514631515 336386868 /nfs/dbraw/zinc/38/68/68/336386868.db2.gz WKDNPKDUXSETSQ-VIFPVBQESA-N 1 2 321.808 4.335 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2sc(Br)cc21)C(C)(F)F ZINC000389437719 336390897 /nfs/dbraw/zinc/39/08/97/336390897.db2.gz FFSGWZYVVPGSSG-HTRCEHHLSA-N 1 2 310.207 4.131 20 0 DIADLO Fc1cccc(Cl)c1NCc1[nH+]ccn1Cc1ccccc1 ZINC000193106679 336398901 /nfs/dbraw/zinc/39/89/01/336398901.db2.gz UATUESVEMSJGMT-UHFFFAOYSA-N 1 2 315.779 4.336 20 0 DIADLO Cc1ccc(NCc2c[nH]nc2-c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000353180479 336405723 /nfs/dbraw/zinc/40/57/23/336405723.db2.gz DDKSOLJWBLEQBU-UHFFFAOYSA-N 1 2 312.804 4.354 20 0 DIADLO C/C=C\c1ccc(NC(=O)N2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)cc1 ZINC000353243931 336407955 /nfs/dbraw/zinc/40/79/55/336407955.db2.gz NNZVSTMMZLKFTL-AZQYIBIBSA-N 1 2 324.428 4.031 20 0 DIADLO Cc1[nH+]c2ccc(C(=O)N(C)[C@H](C)c3ccccc3C)cc2n1C ZINC000354302484 336466154 /nfs/dbraw/zinc/46/61/54/336466154.db2.gz RAVGISDMHSBOEW-CQSZACIVSA-N 1 2 321.424 4.023 20 0 DIADLO CCCCOC1CCN(c2[nH+]ccc3ccc(F)cc32)CC1 ZINC000354547821 336474301 /nfs/dbraw/zinc/47/43/01/336474301.db2.gz WOQMOAAWQYYJSF-UHFFFAOYSA-N 1 2 302.393 4.159 20 0 DIADLO Fc1ccc2cc[nH+]c(N3CCO[C@H](c4cccs4)C3)c2c1 ZINC000354855825 336485098 /nfs/dbraw/zinc/48/50/98/336485098.db2.gz VKBPOTCJSWYPGH-HNNXBMFYSA-N 1 2 314.385 4.013 20 0 DIADLO COc1cccc2c1CC[C@H]2Nc1[nH+]ccc2ccc(F)cc21 ZINC000354874915 336485971 /nfs/dbraw/zinc/48/59/71/336485971.db2.gz IEHIXSUAWNDJHO-QGZVFWFLSA-N 1 2 308.356 4.482 20 0 DIADLO CC(C)(C)[C@H]1C[C@@H](Nc2[nH+]ccc3ccc(F)cc32)CCO1 ZINC000354881061 336486175 /nfs/dbraw/zinc/48/61/75/336486175.db2.gz DOYANSRWCINSTD-GOEBONIOSA-N 1 2 302.393 4.380 20 0 DIADLO CC(C)(C)OC1CCN(c2[nH+]ccc3ccc(F)cc32)CC1 ZINC000354891570 336486814 /nfs/dbraw/zinc/48/68/14/336486814.db2.gz VBWYYNXTGUTOSN-UHFFFAOYSA-N 1 2 302.393 4.158 20 0 DIADLO CCSc1ccccc1[C@H](C)[NH2+][C@H](C)c1nnc(C)s1 ZINC000354973036 336489633 /nfs/dbraw/zinc/48/96/33/336489633.db2.gz VXYHORJSLGEVMW-WDEREUQCSA-N 1 2 307.488 4.370 20 0 DIADLO CC(C)Sc1ccccc1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000355296605 336503245 /nfs/dbraw/zinc/50/32/45/336503245.db2.gz HTZCLUBTIGXVEP-UHFFFAOYSA-N 1 2 311.410 4.087 20 0 DIADLO Cc1cc(NC(=O)c2ccsc2)c[nH+]c1N1CCCC[C@@H]1C ZINC000355547246 336513821 /nfs/dbraw/zinc/51/38/21/336513821.db2.gz ZWWPVWXWODAQQZ-ZDUSSCGKSA-N 1 2 315.442 4.083 20 0 DIADLO C[C@@H]1CCC[C@H](CC(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)C1 ZINC000355808859 336523012 /nfs/dbraw/zinc/52/30/12/336523012.db2.gz CQWUVUABWPLCFQ-KGLIPLIRSA-N 1 2 315.392 4.166 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@H]2COCc3ccccc32)c(Cl)c1 ZINC000418107703 336523785 /nfs/dbraw/zinc/52/37/85/336523785.db2.gz PRFRNGUTYNDVNB-KRWDZBQOSA-N 1 2 305.780 4.149 20 0 DIADLO Cc1[nH+]c2ccccc2n1CC(=O)Nc1ccc(C2CC2)c(C)c1 ZINC000355926479 336528457 /nfs/dbraw/zinc/52/84/57/336528457.db2.gz DXEVROWWIZKVOP-UHFFFAOYSA-N 1 2 319.408 4.169 20 0 DIADLO C[C@@H]1C[C@@H](C)[C@H](C)N(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000355935165 336528880 /nfs/dbraw/zinc/52/88/80/336528880.db2.gz QQLQZLMQBVXPFT-OAGGEKHMSA-N 1 2 324.424 4.381 20 0 DIADLO Cc1ccc(Cc2noc(-c3cccc(-c4ccoc4)c3)n2)c[nH+]1 ZINC000356122855 336536879 /nfs/dbraw/zinc/53/68/79/336536879.db2.gz HEGGBLJPGAYDSP-UHFFFAOYSA-N 1 2 317.348 4.291 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncc(C)o2)cc1OCC ZINC000356267904 336543313 /nfs/dbraw/zinc/54/33/13/336543313.db2.gz MRYBFKWNHADKMH-KGLIPLIRSA-N 1 2 318.417 4.192 20 0 DIADLO CCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncc(C)o2)cc1OC ZINC000356265962 336543324 /nfs/dbraw/zinc/54/33/24/336543324.db2.gz BLDZDQUXQPOVEQ-KGLIPLIRSA-N 1 2 318.417 4.192 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCC(=O)Nc1ccc2ccoc2c1 ZINC000356892162 336565259 /nfs/dbraw/zinc/56/52/59/336565259.db2.gz MAGACRLHQNGZRC-UHFFFAOYSA-N 1 2 319.364 4.120 20 0 DIADLO COCc1cc(N2CCc3ccccc3C2)c2cc(F)ccc2[nH+]1 ZINC000357089894 336573457 /nfs/dbraw/zinc/57/34/57/336573457.db2.gz ZRILGEOEKGXIBG-UHFFFAOYSA-N 1 2 322.383 4.083 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](c2ccc(F)cc2)[C@H]2CCCO2)cs1 ZINC000358014049 336606064 /nfs/dbraw/zinc/60/60/64/336606064.db2.gz BJWLQFLJRUHATO-JECHBYEQSA-N 1 2 320.433 4.162 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C(C)(C)C)s1)c1ccccc1OC ZINC000358292553 336622023 /nfs/dbraw/zinc/62/20/23/336622023.db2.gz WCWZKLGKCSSUPA-CYBMUJFWSA-N 1 2 319.474 4.085 20 0 DIADLO COc1ccc(-c2ccncc2)cc1CNc1ccc[nH+]c1C ZINC000358446817 336630404 /nfs/dbraw/zinc/63/04/04/336630404.db2.gz PFGPLEDTCUTZNT-UHFFFAOYSA-N 1 2 305.381 4.073 20 0 DIADLO CCCCn1cc(CNc2cc(C(F)(F)F)cc[nH+]2)c(C)n1 ZINC000358470832 336631210 /nfs/dbraw/zinc/63/12/10/336631210.db2.gz POCZTNQQIAPLAM-UHFFFAOYSA-N 1 2 312.339 4.018 20 0 DIADLO COc1cc[nH+]cc1NC(=O)c1sc2cc(F)ccc2c1C ZINC000358521749 336633462 /nfs/dbraw/zinc/63/34/62/336633462.db2.gz JJUPCCSYWCQUSD-UHFFFAOYSA-N 1 2 316.357 4.005 20 0 DIADLO COc1cccc(OCCSCc2ccc(C)[nH+]c2C)c1 ZINC000358665242 336638755 /nfs/dbraw/zinc/63/87/55/336638755.db2.gz WDZSRBPJYMZPEB-UHFFFAOYSA-N 1 2 303.427 4.019 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(COC(C)C)cc2)c(C)[nH+]1 ZINC000359426240 336672454 /nfs/dbraw/zinc/67/24/54/336672454.db2.gz ZABIPPSSURTWBU-UHFFFAOYSA-N 1 2 312.413 4.184 20 0 DIADLO CCc1c(NCc2cccc3[nH+]ccn32)cnn1C(CC)CC ZINC000359809888 336688266 /nfs/dbraw/zinc/68/82/66/336688266.db2.gz UDBXXURMRGWVHE-UHFFFAOYSA-N 1 2 311.433 4.066 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCC[S@](=O)[C@@H](C)C(C)C ZINC000359916410 336692849 /nfs/dbraw/zinc/69/28/49/336692849.db2.gz GWXTXJFRZBSHJD-NYHFZMIOSA-N 1 2 320.502 4.308 20 0 DIADLO CC[C@H](C)C[S@](=O)CCCCCn1c(C)[nH+]c2ccccc21 ZINC000359917963 336692953 /nfs/dbraw/zinc/69/29/53/336692953.db2.gz PQCDLBMRNSYUEB-OYHNWAKOSA-N 1 2 320.502 4.310 20 0 DIADLO CC[C@@H](C)C[S@@](=O)CCCCCn1c(C)[nH+]c2ccccc21 ZINC000359917964 336692988 /nfs/dbraw/zinc/69/29/88/336692988.db2.gz PQCDLBMRNSYUEB-QRQCRPRQSA-N 1 2 320.502 4.310 20 0 DIADLO Cc1cc(C)cc(C[NH2+][C@H](c2ccn(C)n2)c2ccc(F)cc2)c1 ZINC000367372049 336726741 /nfs/dbraw/zinc/72/67/41/336726741.db2.gz OYETWKWUMXGDIF-FQEVSTJZSA-N 1 2 323.415 4.055 20 0 DIADLO Cc1[nH]c(C(=O)N[C@@H](C)c2ccc(Cl)c3ccccc32)c[nH+]1 ZINC000361033190 336734364 /nfs/dbraw/zinc/73/43/64/336734364.db2.gz SIRNQPYKPDBRLC-JTQLQIEISA-N 1 2 313.788 4.016 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H]2CCOc3c(F)ccc(F)c32)c(C)o1 ZINC000361177125 336742313 /nfs/dbraw/zinc/74/23/13/336742313.db2.gz GUDHIZTYJATLHL-BMIGLBTASA-N 1 2 307.340 4.349 20 0 DIADLO C[C@H]([NH2+][C@H]1CCOc2c(F)ccc(F)c21)c1ccccc1F ZINC000361177770 336742513 /nfs/dbraw/zinc/74/25/13/336742513.db2.gz JTDJFFDVSOZNIQ-BONVTDFDSA-N 1 2 307.315 4.278 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H]2CCCOc3c(Cl)cccc32)no1 ZINC000367381718 336763919 /nfs/dbraw/zinc/76/39/19/336763919.db2.gz LSSQODVVFYCUIN-RISCZKNCSA-N 1 2 306.793 4.201 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cc[nH]c2C2CCC2)[nH+]1 ZINC000362938006 336815591 /nfs/dbraw/zinc/81/55/91/336815591.db2.gz HGPZTNYQYMOWCT-UHFFFAOYSA-N 1 2 320.396 4.233 20 0 DIADLO CC(C)c1ccc2occ(C(=O)N3CCC[C@H]3c3[nH]cc[nH+]3)c2c1 ZINC000367843686 336830800 /nfs/dbraw/zinc/83/08/00/336830800.db2.gz SOSVQCMHZXKMFD-INIZCTEOSA-N 1 2 323.396 4.257 20 0 DIADLO CCc1ccsc1C(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000370271833 336881431 /nfs/dbraw/zinc/88/14/31/336881431.db2.gz YCOHSENVDQOMRS-UHFFFAOYSA-N 1 2 311.410 4.261 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc(Cl)cc2)[nH+]1 ZINC000371246195 336898262 /nfs/dbraw/zinc/89/82/62/336898262.db2.gz BNNIMUROERMJAJ-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)C=Cc2ccccc2C)[nH+]1 ZINC000371246910 336898487 /nfs/dbraw/zinc/89/84/87/336898487.db2.gz ILGCDEUQSGRZAA-VAWYXSNFSA-N 1 2 317.392 4.345 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H](C)c2cccs2)[nH+]1 ZINC000371247854 336898522 /nfs/dbraw/zinc/89/85/22/336898522.db2.gz RENJBZRTTKZZPV-LBPRGKRZSA-N 1 2 311.410 4.189 20 0 DIADLO Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000120194703 336900808 /nfs/dbraw/zinc/90/08/08/336900808.db2.gz SCOJFJIYHSPZCA-HUUCEWRRSA-N 1 2 323.421 4.189 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccccn2)cs1 ZINC000372075151 336921406 /nfs/dbraw/zinc/92/14/06/336921406.db2.gz GCSIGKJPZXUJHG-SCLBCKFNSA-N 1 2 309.438 4.287 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000373056612 336946674 /nfs/dbraw/zinc/94/66/74/336946674.db2.gz KUWNUXURWJJKKY-IRXDYDNUSA-N 1 2 319.493 4.123 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H](C)c1ccccc1 ZINC000373661200 336968178 /nfs/dbraw/zinc/96/81/78/336968178.db2.gz SRQKZKCHFSDHBU-CQSZACIVSA-N 1 2 305.381 4.127 20 0 DIADLO CCc1ccccc1CC(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000373676066 336968409 /nfs/dbraw/zinc/96/84/09/336968409.db2.gz UKUQAUKMXUJSKI-UHFFFAOYSA-N 1 2 319.408 4.129 20 0 DIADLO c1cn(-c2ccc(NCc3cccc4cccnc43)cc2)c[nH+]1 ZINC000121843433 336981546 /nfs/dbraw/zinc/98/15/46/336981546.db2.gz OLTOOFOMVNYQNN-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]Cc1cscn1 ZINC000122154195 336996235 /nfs/dbraw/zinc/99/62/35/336996235.db2.gz BGYXGQRQJUVVBL-CQSZACIVSA-N 1 2 308.834 4.108 20 0 DIADLO Clc1ccc(C[N@H+]2CC=C(c3ccc(Cl)nc3)CC2)cn1 ZINC000374999998 337001160 /nfs/dbraw/zinc/00/11/60/337001160.db2.gz UJHKOESFQRHUMC-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1ccc(C[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)cn1 ZINC000374999998 337001161 /nfs/dbraw/zinc/00/11/61/337001161.db2.gz UJHKOESFQRHUMC-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccccn2)c1 ZINC000375783398 337019559 /nfs/dbraw/zinc/01/95/59/337019559.db2.gz RKVUQELXXACDEE-OXJNMPFZSA-N 1 2 303.409 4.225 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+][C@@H]2COc3c2ccc(Cl)c3Cl)c1 ZINC000375800644 337019845 /nfs/dbraw/zinc/01/98/45/337019845.db2.gz CITHVXSOHVIQIX-QMTHXVAHSA-N 1 2 323.223 4.481 20 0 DIADLO CCC[C@@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc(F)cc1F ZINC000375812045 337020136 /nfs/dbraw/zinc/02/01/36/337020136.db2.gz XMMLGSFHSLEAHG-CVEARBPZSA-N 1 2 305.372 4.196 20 0 DIADLO CCC[C@@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc(F)cc1F ZINC000375812075 337020197 /nfs/dbraw/zinc/02/01/97/337020197.db2.gz XMMLGSFHSLEAHG-HZPDHXFCSA-N 1 2 305.372 4.196 20 0 DIADLO C[C@@H](Nc1cccc(-c2cn3c([nH+]2)CCCC3)c1)c1cccnc1 ZINC000376168807 337028878 /nfs/dbraw/zinc/02/88/78/337028878.db2.gz YICRJPDEWXJDKW-OAHLLOKOSA-N 1 2 318.424 4.455 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1cncs1 ZINC000123172569 337038637 /nfs/dbraw/zinc/03/86/37/337038637.db2.gz KDZMFMZYTKDIBM-BXUZGUMPSA-N 1 2 301.440 4.040 20 0 DIADLO Cc1ccc([C@H]2CCCN2C(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000376647260 337039089 /nfs/dbraw/zinc/03/90/89/337039089.db2.gz VMGGMQHFYKYWGB-QGZVFWFLSA-N 1 2 309.413 4.376 20 0 DIADLO Cc1nnc([C@@H](C)[NH+]2CCC(F)(c3cccc(Cl)c3)CC2)o1 ZINC000377149922 337047689 /nfs/dbraw/zinc/04/76/89/337047689.db2.gz CHXVYEQQSJKLRC-LLVKDONJSA-N 1 2 323.799 4.053 20 0 DIADLO O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]12)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000377155233 337047751 /nfs/dbraw/zinc/04/77/51/337047751.db2.gz PZHKQJZUYORHDC-HZMVEIRTSA-N 1 2 315.461 4.070 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](c2ccccc2)c2ccncc2)cs1 ZINC000378202878 337068199 /nfs/dbraw/zinc/06/81/99/337068199.db2.gz PMQSOYOQXRDLDP-UGSOOPFHSA-N 1 2 309.438 4.287 20 0 DIADLO CCCCCC[C@@](C)(CC)C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000378269677 337069176 /nfs/dbraw/zinc/06/91/76/337069176.db2.gz YZCJRGSGUHQGOA-QFBILLFUSA-N 1 2 319.493 4.123 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)cn1)c1ncc(-c2ccccc2)o1 ZINC000378455771 337073209 /nfs/dbraw/zinc/07/32/09/337073209.db2.gz NJFWLXKSFRXENB-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)cn1)c1ncc(-c2ccccc2)o1 ZINC000378455750 337073265 /nfs/dbraw/zinc/07/32/65/337073265.db2.gz NJFWLXKSFRXENB-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO CC(C)(C)C1CCC(CC(=O)N2CCC[C@H]2c2[nH]cc[nH+]2)CC1 ZINC000378523353 337075072 /nfs/dbraw/zinc/07/50/72/337075072.db2.gz ZSWDRWLODVORPP-GPANFISMSA-N 1 2 317.477 4.316 20 0 DIADLO CCOc1cccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000193913629 337080459 /nfs/dbraw/zinc/08/04/59/337080459.db2.gz NTJNJXXHCQWEER-HNNXBMFYSA-N 1 2 307.397 4.444 20 0 DIADLO Cc1ccc(C(=O)N2CCC[C@@H](C)CC2)cc1Oc1cc[nH+]cc1 ZINC000172067574 337089618 /nfs/dbraw/zinc/08/96/18/337089618.db2.gz DZDPMFKWSNFANI-OAHLLOKOSA-N 1 2 324.424 4.445 20 0 DIADLO Clc1cnc(C[N@@H+]2CCC=C(c3ccccn3)C2)c(Cl)c1 ZINC000584359240 337102433 /nfs/dbraw/zinc/10/24/33/337102433.db2.gz VUBPYEQAYJKFDS-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1cnc(C[N@H+]2CCC=C(c3ccccn3)C2)c(Cl)c1 ZINC000584359240 337102434 /nfs/dbraw/zinc/10/24/34/337102434.db2.gz VUBPYEQAYJKFDS-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cccc(OC(C)C)c2)s1 ZINC000175521795 337147844 /nfs/dbraw/zinc/14/78/44/337147844.db2.gz SDLDJAUCFVLWEI-UHFFFAOYSA-N 1 2 304.459 4.125 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cccc(OC(C)C)c2)s1 ZINC000175521795 337147845 /nfs/dbraw/zinc/14/78/45/337147845.db2.gz SDLDJAUCFVLWEI-UHFFFAOYSA-N 1 2 304.459 4.125 20 0 DIADLO Cc1nc2ccccc2c(SCc2cn3c(cccc3C)[nH+]2)n1 ZINC000219737340 337150773 /nfs/dbraw/zinc/15/07/73/337150773.db2.gz UHFVZBBVEXSBQT-UHFFFAOYSA-N 1 2 320.421 4.187 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1cc(Br)ccc1F ZINC000177273011 337155380 /nfs/dbraw/zinc/15/53/80/337155380.db2.gz KXGIACZYPVGNOJ-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1cc(Br)ccc1F ZINC000177273011 337155381 /nfs/dbraw/zinc/15/53/81/337155381.db2.gz KXGIACZYPVGNOJ-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nccn1C)c1cccc(F)c1)c1ccsc1 ZINC000177805780 337157560 /nfs/dbraw/zinc/15/75/60/337157560.db2.gz FKMMFMTYCCFPCE-WBMJQRKESA-N 1 2 315.417 4.061 20 0 DIADLO Cc1cccc(C[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)n1 ZINC000178417072 337164615 /nfs/dbraw/zinc/16/46/15/337164615.db2.gz HZBBQBPJCFSDKF-CQSZACIVSA-N 1 2 309.438 4.364 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@@H]2c2c(C)n[nH]c2C)cs1 ZINC000180519371 337176219 /nfs/dbraw/zinc/17/62/19/337176219.db2.gz MSIYHUZBWWNSEB-OAHLLOKOSA-N 1 2 318.490 4.163 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@@H]2c2c(C)n[nH]c2C)cs1 ZINC000180519371 337176220 /nfs/dbraw/zinc/17/62/20/337176220.db2.gz MSIYHUZBWWNSEB-OAHLLOKOSA-N 1 2 318.490 4.163 20 0 DIADLO CC[C@H]([NH2+][C@H]1CCCn2nc(C(C)C)nc21)c1ccccc1F ZINC000180745177 337177607 /nfs/dbraw/zinc/17/76/07/337177607.db2.gz ATBWXTULGOGYDC-HOTGVXAUSA-N 1 2 316.424 4.116 20 0 DIADLO Fc1cccc(-c2cnc(C[N@H+](Cc3cccnc3)C3CC3)o2)c1 ZINC000180742064 337177676 /nfs/dbraw/zinc/17/76/76/337177676.db2.gz GURAHJVMZVLVMH-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1cccc(-c2cnc(C[N@@H+](Cc3cccnc3)C3CC3)o2)c1 ZINC000180742064 337177677 /nfs/dbraw/zinc/17/76/77/337177677.db2.gz GURAHJVMZVLVMH-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)n1 ZINC000180919004 337178732 /nfs/dbraw/zinc/17/87/32/337178732.db2.gz WLMVYOPHQQIMEX-UONOGXRCSA-N 1 2 322.412 4.106 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](C)c2ccc(-c3cccnc3)cc2)no1 ZINC000181309319 337181176 /nfs/dbraw/zinc/18/11/76/337181176.db2.gz SPQOEPDNEYYQOQ-CQSZACIVSA-N 1 2 322.412 4.106 20 0 DIADLO CC(C)Cn1cc(C[NH2+][C@@H](c2ccco2)c2ccccc2)cn1 ZINC000181758525 337184378 /nfs/dbraw/zinc/18/43/78/337184378.db2.gz OYTZDAXGGNHBFS-LJQANCHMSA-N 1 2 309.413 4.011 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nc(-c3cccc(C)c3)no2)cc1 ZINC000182347638 337187989 /nfs/dbraw/zinc/18/79/89/337187989.db2.gz DRRKAAYNGFZQJD-OAHLLOKOSA-N 1 2 307.397 4.204 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1ncc(Cl)cc1Cl ZINC000182498772 337188742 /nfs/dbraw/zinc/18/87/42/337188742.db2.gz OAWHWHODJFJAJK-HNNXBMFYSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1ncc(Cl)cc1Cl ZINC000182498772 337188743 /nfs/dbraw/zinc/18/87/43/337188743.db2.gz OAWHWHODJFJAJK-HNNXBMFYSA-N 1 2 310.228 4.064 20 0 DIADLO Cc1cc(-c2noc(C[NH2+][C@@H](C)c3cccs3)n2)ccc1F ZINC000182541647 337188941 /nfs/dbraw/zinc/18/89/41/337188941.db2.gz HFMOUGQADBALLJ-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2noc(-c3ccsc3)n2)c(C)s1 ZINC000182745764 337189636 /nfs/dbraw/zinc/18/96/36/337189636.db2.gz AUHWUQUTAWMBAO-SNVBAGLBSA-N 1 2 319.455 4.327 20 0 DIADLO COc1cc(-c2ccccc2)ccc1C[NH2+]Cc1nccs1 ZINC000183048004 337191145 /nfs/dbraw/zinc/19/11/45/337191145.db2.gz AILYQYPAYKZQHB-UHFFFAOYSA-N 1 2 310.422 4.109 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1nc(-c2ccoc2)no1 ZINC000183549371 337192143 /nfs/dbraw/zinc/19/21/43/337192143.db2.gz KAQZSYLRFUQVAA-GFCCVEGCSA-N 1 2 323.352 4.235 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+]2CCc3ccccc3C2)s1 ZINC000183562494 337192339 /nfs/dbraw/zinc/19/23/39/337192339.db2.gz AAZJFYLODATCIV-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+]2CCc3ccccc3C2)s1 ZINC000183562494 337192340 /nfs/dbraw/zinc/19/23/40/337192340.db2.gz AAZJFYLODATCIV-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO COc1cc(C[NH2+][C@@H](c2nccs2)c2ccccc2)ccc1C ZINC000183259815 337192631 /nfs/dbraw/zinc/19/26/31/337192631.db2.gz PHRJAZGSCLFPEL-GOSISDBHSA-N 1 2 324.449 4.339 20 0 DIADLO COc1ccccc1OCCSCc1ccc(C)[nH+]c1C ZINC000184817321 337200303 /nfs/dbraw/zinc/20/03/03/337200303.db2.gz ORAVKUYJILSYLF-UHFFFAOYSA-N 1 2 303.427 4.019 20 0 DIADLO CC(=O)Nc1cccc(CSCc2ccc(C)[nH+]c2C)c1 ZINC000184821218 337200409 /nfs/dbraw/zinc/20/04/09/337200409.db2.gz PSRSSCYEZKYJOD-UHFFFAOYSA-N 1 2 300.427 4.090 20 0 DIADLO CCS[C@H](C)c1noc(CSCc2ccc(C)[nH+]c2C)n1 ZINC000184830851 337200417 /nfs/dbraw/zinc/20/04/17/337200417.db2.gz KDZBCDBOEARGJU-GFCCVEGCSA-N 1 2 323.487 4.329 20 0 DIADLO CCS[C@@H](C)c1noc(CSCc2ccc(C)[nH+]c2C)n1 ZINC000184830833 337200443 /nfs/dbraw/zinc/20/04/43/337200443.db2.gz KDZBCDBOEARGJU-LBPRGKRZSA-N 1 2 323.487 4.329 20 0 DIADLO CC(C)c1noc([C@H](C)[N@@H+]2CC[C@H](c3c(F)cccc3F)C2)n1 ZINC000185317434 337204942 /nfs/dbraw/zinc/20/49/42/337204942.db2.gz BEZPENYCPQIDCP-RYUDHWBXSA-N 1 2 321.371 4.022 20 0 DIADLO CC(C)c1noc([C@H](C)[N@H+]2CC[C@H](c3c(F)cccc3F)C2)n1 ZINC000185317434 337204943 /nfs/dbraw/zinc/20/49/43/337204943.db2.gz BEZPENYCPQIDCP-RYUDHWBXSA-N 1 2 321.371 4.022 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@@H+]2CC[C@H](c3c(F)cccc3F)C2)n1 ZINC000185317418 337205034 /nfs/dbraw/zinc/20/50/34/337205034.db2.gz BEZPENYCPQIDCP-NEPJUHHUSA-N 1 2 321.371 4.022 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@H+]2CC[C@H](c3c(F)cccc3F)C2)n1 ZINC000185317418 337205035 /nfs/dbraw/zinc/20/50/35/337205035.db2.gz BEZPENYCPQIDCP-NEPJUHHUSA-N 1 2 321.371 4.022 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2nccc(C(F)F)n2)s1 ZINC000583106991 337238168 /nfs/dbraw/zinc/23/81/68/337238168.db2.gz SEWVJJNVHPHCPC-UHFFFAOYSA-N 1 2 311.401 4.063 20 0 DIADLO Cc1cc(Cl)cc2nc(SCCCn3cc[nH+]c3)oc21 ZINC000185554807 337249036 /nfs/dbraw/zinc/24/90/36/337249036.db2.gz RSPWGOPSNUQTJG-UHFFFAOYSA-N 1 2 307.806 4.169 20 0 DIADLO CCc1nnc([C@H](C)[N@H+](C)Cc2ccc(C(C)(C)C)cc2)o1 ZINC000532904202 337254962 /nfs/dbraw/zinc/25/49/62/337254962.db2.gz UZCKVMWSGPPYEN-ZDUSSCGKSA-N 1 2 301.434 4.123 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+](C)Cc2ccc(C(C)(C)C)cc2)o1 ZINC000532904202 337254963 /nfs/dbraw/zinc/25/49/63/337254963.db2.gz UZCKVMWSGPPYEN-ZDUSSCGKSA-N 1 2 301.434 4.123 20 0 DIADLO Cc1nn(-c2ccccc2)c(C)c1CNc1ccc(C)[nH+]c1C ZINC000321298298 337255699 /nfs/dbraw/zinc/25/56/99/337255699.db2.gz BLOUBIDRNPXMQI-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO Cc1ccc(C)c(C[N@@H+]2CCSC[C@@H]2c2nccs2)c1 ZINC000186631000 337258127 /nfs/dbraw/zinc/25/81/27/337258127.db2.gz DRNGIPANGDVOJV-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1ccc(C)c(C[N@H+]2CCSC[C@@H]2c2nccs2)c1 ZINC000186631000 337258128 /nfs/dbraw/zinc/25/81/28/337258128.db2.gz DRNGIPANGDVOJV-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO c1csc([C@@H]2CSCC[N@H+]2Cc2coc3ccccc23)n1 ZINC000186639481 337258152 /nfs/dbraw/zinc/25/81/52/337258152.db2.gz IVBWHBZCSDASKX-AWEZNQCLSA-N 1 2 316.451 4.179 20 0 DIADLO c1csc([C@@H]2CSCC[N@@H+]2Cc2coc3ccccc23)n1 ZINC000186639481 337258153 /nfs/dbraw/zinc/25/81/53/337258153.db2.gz IVBWHBZCSDASKX-AWEZNQCLSA-N 1 2 316.451 4.179 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)c2cn(C)c3ccccc23)c(C)[nH+]1 ZINC000186653129 337258306 /nfs/dbraw/zinc/25/83/06/337258306.db2.gz GKPVBUQWPWFCBT-AWEZNQCLSA-N 1 2 321.424 4.241 20 0 DIADLO Cc1cc(C)c(C[S@](=O)Cc2ccc(C)[nH+]c2C)c(C)c1 ZINC000187150584 337263021 /nfs/dbraw/zinc/26/30/21/337263021.db2.gz VSKOFCSNVNIPGO-OAQYLSRUSA-N 1 2 301.455 4.073 20 0 DIADLO Cc1ccc(C[S@](=O)Cc2ccc(C(F)F)cc2)c(C)[nH+]1 ZINC000187179835 337263472 /nfs/dbraw/zinc/26/34/72/337263472.db2.gz LQEIYNAOSIUCIZ-OAQYLSRUSA-N 1 2 309.381 4.085 20 0 DIADLO Cc1ccc(C[S@@](=O)Cc2ccc(C(F)F)cc2)c(C)[nH+]1 ZINC000187179815 337263500 /nfs/dbraw/zinc/26/35/00/337263500.db2.gz LQEIYNAOSIUCIZ-NRFANRHFSA-N 1 2 309.381 4.085 20 0 DIADLO Cc1ccc(CNc2cc(NC(=O)C(C)C)ccc2C)c(C)[nH+]1 ZINC000187718156 337269550 /nfs/dbraw/zinc/26/95/50/337269550.db2.gz PSPOPZHUXLCZEI-UHFFFAOYSA-N 1 2 311.429 4.213 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2ccc(C3CC3)cc2)c2ncc[nH]2)cc1 ZINC000188733362 337274584 /nfs/dbraw/zinc/27/45/84/337274584.db2.gz CIELKLNDFCVIEC-IBGZPJMESA-N 1 2 321.399 4.305 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1CCC[C@H]1c1csc(C)n1 ZINC000189825574 337283326 /nfs/dbraw/zinc/28/33/26/337283326.db2.gz CIZVRCWXTMNPCQ-HNNXBMFYSA-N 1 2 322.861 4.451 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1CCC[C@H]1c1csc(C)n1 ZINC000189825574 337283327 /nfs/dbraw/zinc/28/33/27/337283327.db2.gz CIZVRCWXTMNPCQ-HNNXBMFYSA-N 1 2 322.861 4.451 20 0 DIADLO Cc1cncc(C[NH2+][C@H](c2cccc(Cl)c2)c2ccccn2)c1 ZINC000189963427 337284098 /nfs/dbraw/zinc/28/40/98/337284098.db2.gz ZBJWKIMADWRUOX-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO C[C@H]([NH2+]Cc1nccn1-c1ccccc1)c1ccc(F)cc1F ZINC000190679036 337289671 /nfs/dbraw/zinc/28/96/71/337289671.db2.gz YGCZVPRLEBFLDI-ZDUSSCGKSA-N 1 2 313.351 4.001 20 0 DIADLO Clc1ccc([C@H]2CCCCC[N@@H+]2Cc2ncccn2)cc1 ZINC000192030304 337302092 /nfs/dbraw/zinc/30/20/92/337302092.db2.gz YKIXJQNFYTYKTG-MRXNPFEDSA-N 1 2 301.821 4.247 20 0 DIADLO Clc1ccc([C@H]2CCCCC[N@H+]2Cc2ncccn2)cc1 ZINC000192030304 337302093 /nfs/dbraw/zinc/30/20/93/337302093.db2.gz YKIXJQNFYTYKTG-MRXNPFEDSA-N 1 2 301.821 4.247 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000532917460 337302857 /nfs/dbraw/zinc/30/28/57/337302857.db2.gz IWVJKFYDIJTOCM-AAEUAGOBSA-N 1 2 305.447 4.327 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@H]1c1ccsc1 ZINC000532917460 337302858 /nfs/dbraw/zinc/30/28/58/337302858.db2.gz IWVJKFYDIJTOCM-AAEUAGOBSA-N 1 2 305.447 4.327 20 0 DIADLO Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]Cc1ncccn1 ZINC000192182544 337303750 /nfs/dbraw/zinc/30/37/50/337303750.db2.gz QTHJRMBAULOJPF-ZDUSSCGKSA-N 1 2 324.453 4.068 20 0 DIADLO C[C@H]([NH2+]Cc1nnsc1Cl)c1cc2ccccc2s1 ZINC000525952244 337307627 /nfs/dbraw/zinc/30/76/27/337307627.db2.gz AKTTYGBBFPICRI-QMMMGPOBSA-N 1 2 309.847 4.257 20 0 DIADLO Brc1cncc(C[N@@H+]2CCC[C@H]2c2cccs2)c1 ZINC000192836004 337307864 /nfs/dbraw/zinc/30/78/64/337307864.db2.gz LTFJQWLRHQQQCA-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cncc(C[N@H+]2CCC[C@H]2c2cccs2)c1 ZINC000192836004 337307865 /nfs/dbraw/zinc/30/78/65/337307865.db2.gz LTFJQWLRHQQQCA-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO c1coc(-c2nc(C[N@@H+]3CCc4sccc4C3)cs2)c1 ZINC000025354417 337309655 /nfs/dbraw/zinc/30/96/55/337309655.db2.gz STIFHSRQLMZIHF-UHFFFAOYSA-N 1 2 302.424 4.023 20 0 DIADLO c1coc(-c2nc(C[N@H+]3CCc4sccc4C3)cs2)c1 ZINC000025354417 337309656 /nfs/dbraw/zinc/30/96/56/337309656.db2.gz STIFHSRQLMZIHF-UHFFFAOYSA-N 1 2 302.424 4.023 20 0 DIADLO C[N@H+](Cc1csc(Cl)c1Cl)Cc1ccc(O)cc1 ZINC000583720423 337317783 /nfs/dbraw/zinc/31/77/83/337317783.db2.gz IIAIOGULBGGVCY-UHFFFAOYSA-N 1 2 302.226 4.393 20 0 DIADLO C[N@@H+](Cc1csc(Cl)c1Cl)Cc1ccc(O)cc1 ZINC000583720423 337317784 /nfs/dbraw/zinc/31/77/84/337317784.db2.gz IIAIOGULBGGVCY-UHFFFAOYSA-N 1 2 302.226 4.393 20 0 DIADLO Clc1cccc(Cl)c1C1CC[NH+](Cc2cc[nH]n2)CC1 ZINC000584437625 337325267 /nfs/dbraw/zinc/32/52/67/337325267.db2.gz PYOOCGGVKACYBI-UHFFFAOYSA-N 1 2 310.228 4.096 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)[C@@H]1CCC(C)=C(C)C1 ZINC000583755504 337330094 /nfs/dbraw/zinc/33/00/94/337330094.db2.gz SEPGAEOTZGRJEJ-SJORKVTESA-N 1 2 315.461 4.093 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)[C@H]1CCC(C)=C(C)C1 ZINC000583755501 337330165 /nfs/dbraw/zinc/33/01/65/337330165.db2.gz SEPGAEOTZGRJEJ-DLBZAZTESA-N 1 2 315.461 4.093 20 0 DIADLO C[C@@H]1CN(c2[nH+]cccc2OCc2ccccc2)CCC1(F)F ZINC000583785140 337332940 /nfs/dbraw/zinc/33/29/40/337332940.db2.gz OBWQGBUJNPDYCW-CQSZACIVSA-N 1 2 318.367 4.142 20 0 DIADLO CSc1ccc2ncnc(Sc3[nH+]cc4ccccn43)c2c1 ZINC000584551096 337360502 /nfs/dbraw/zinc/36/05/02/337360502.db2.gz SWSUIJDNPJOEIY-UHFFFAOYSA-N 1 2 324.434 4.151 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccc(-c2ccsc2)nc1C ZINC000107293898 337387440 /nfs/dbraw/zinc/38/74/40/337387440.db2.gz ZBNWSXGZZNEYAW-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO Cc1nc(C[N@@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)oc1C ZINC000108385347 337387886 /nfs/dbraw/zinc/38/78/86/337387886.db2.gz LNTZCBPDGNDOQK-SFHVURJKSA-N 1 2 309.413 4.500 20 0 DIADLO Cc1nc(C[N@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)oc1C ZINC000108385347 337387887 /nfs/dbraw/zinc/38/78/87/337387887.db2.gz LNTZCBPDGNDOQK-SFHVURJKSA-N 1 2 309.413 4.500 20 0 DIADLO Cc1cc(N2CCC[C@@H]2c2ccsc2)nc(-c2ccncc2)[nH+]1 ZINC000112074388 337390164 /nfs/dbraw/zinc/39/01/64/337390164.db2.gz WOTCYEPIBHITQI-MRXNPFEDSA-N 1 2 322.437 4.250 20 0 DIADLO COc1ccc2c(c1)C[N@H+]([C@@H](C)c1c(F)cccc1F)CC2 ZINC000520788512 337390836 /nfs/dbraw/zinc/39/08/36/337390836.db2.gz CCJXAEQOPLGZLQ-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc2c(c1)C[N@@H+]([C@@H](C)c1c(F)cccc1F)CC2 ZINC000520788512 337390837 /nfs/dbraw/zinc/39/08/37/337390837.db2.gz CCJXAEQOPLGZLQ-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO CC(C)C(=O)Nc1ccc(N[C@@H]2CCc3ccc[nH+]c3CC2)cc1 ZINC000520792328 337390960 /nfs/dbraw/zinc/39/09/60/337390960.db2.gz VEJFBMMLDWNUOR-MRXNPFEDSA-N 1 2 323.440 4.036 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2cc(F)cc3cccnc32)cs1 ZINC000532926513 337393126 /nfs/dbraw/zinc/39/31/26/337393126.db2.gz JJNVZHCFOABOTK-UHFFFAOYSA-N 1 2 315.417 4.025 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2cc(F)cc3cccnc32)cs1 ZINC000532926513 337393127 /nfs/dbraw/zinc/39/31/27/337393127.db2.gz JJNVZHCFOABOTK-UHFFFAOYSA-N 1 2 315.417 4.025 20 0 DIADLO O=C(C[N@@H+](Cc1ccccc1F)C1CC1)c1c[nH]c2ccccc12 ZINC000105139652 337393425 /nfs/dbraw/zinc/39/34/25/337393425.db2.gz UWAQVXYPLXPZEO-UHFFFAOYSA-N 1 2 322.383 4.154 20 0 DIADLO O=C(C[N@H+](Cc1ccccc1F)C1CC1)c1c[nH]c2ccccc12 ZINC000105139652 337393426 /nfs/dbraw/zinc/39/34/26/337393426.db2.gz UWAQVXYPLXPZEO-UHFFFAOYSA-N 1 2 322.383 4.154 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2F)C(C)C)nc2ccccc12 ZINC000532929550 337393444 /nfs/dbraw/zinc/39/34/44/337393444.db2.gz HFSBXQHURARYDL-UHFFFAOYSA-N 1 2 323.415 4.488 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2F)C(C)C)nc2ccccc12 ZINC000532929550 337393445 /nfs/dbraw/zinc/39/34/45/337393445.db2.gz HFSBXQHURARYDL-UHFFFAOYSA-N 1 2 323.415 4.488 20 0 DIADLO C[C@H]1c2c(F)cccc2CC[N@H+]1Cc1cnc(C(C)(C)C)nc1 ZINC000580414759 337399537 /nfs/dbraw/zinc/39/95/37/337399537.db2.gz LGGUZXVAKPCSDT-ZDUSSCGKSA-N 1 2 313.420 4.033 20 0 DIADLO C[C@H]1c2c(F)cccc2CC[N@@H+]1Cc1cnc(C(C)(C)C)nc1 ZINC000580414759 337399538 /nfs/dbraw/zinc/39/95/38/337399538.db2.gz LGGUZXVAKPCSDT-ZDUSSCGKSA-N 1 2 313.420 4.033 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](CC)c2cccc(Cl)c2)n1 ZINC000125286755 337410444 /nfs/dbraw/zinc/41/04/44/337410444.db2.gz GIWJKPSCVPUUGM-AWEZNQCLSA-N 1 2 307.825 4.307 20 0 DIADLO CC(C)c1ccc2c(c1)[C@H]([NH2+]Cc1cscn1)CCCO2 ZINC000126620765 337417322 /nfs/dbraw/zinc/41/73/22/337417322.db2.gz WRGIGWXREMTCCO-MRXNPFEDSA-N 1 2 302.443 4.270 20 0 DIADLO Cc1cc(Cl)ccc1C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000127560097 337421353 /nfs/dbraw/zinc/42/13/53/337421353.db2.gz BOORUUYFPOMCTB-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO O=C(Nc1ccccc1C(F)F)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000425693672 337435650 /nfs/dbraw/zinc/43/56/50/337435650.db2.gz SFRKCQGQHGDRHU-CYBMUJFWSA-N 1 2 320.343 4.106 20 0 DIADLO CCc1[nH+]c(C(C)C)ccc1Cn1nccc1-c1ccncc1 ZINC000418863971 337443570 /nfs/dbraw/zinc/44/35/70/337443570.db2.gz HRNSONSHMADSEM-UHFFFAOYSA-N 1 2 306.413 4.074 20 0 DIADLO CSc1ccccc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000195174642 337465573 /nfs/dbraw/zinc/46/55/73/337465573.db2.gz XDKPEMNKHIOSFW-UHFFFAOYSA-N 1 2 309.394 4.051 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CSCc1noc(C2CC2)n1 ZINC000419413395 337482755 /nfs/dbraw/zinc/48/27/55/337482755.db2.gz FNBWQQQHIFQOIZ-UHFFFAOYSA-N 1 2 303.431 4.207 20 0 DIADLO CCCC1(c2noc(-c3ccc(Cn4cc[nH+]c4)cc3)n2)CCC1 ZINC000420518599 337506910 /nfs/dbraw/zinc/50/69/10/337506910.db2.gz RWYZCRJMQXZKGN-UHFFFAOYSA-N 1 2 322.412 4.203 20 0 DIADLO Cn1cc(Cl)c(C[NH2+]C2(c3cccc(Cl)c3)CCCC2)n1 ZINC000420951676 337514875 /nfs/dbraw/zinc/51/48/75/337514875.db2.gz SOPITZQNOHOEOY-UHFFFAOYSA-N 1 2 324.255 4.286 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1cccc(Cl)c1Cl ZINC000393329272 337587726 /nfs/dbraw/zinc/58/77/26/337587726.db2.gz ZNCBMIQCZVFXKI-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO CCOc1cccc(Cl)c1C[NH2+][C@@H](C)c1ncc(C)s1 ZINC000572254518 337600184 /nfs/dbraw/zinc/60/01/84/337600184.db2.gz QTXDGKVFMLIZAT-NSHDSACASA-N 1 2 310.850 4.354 20 0 DIADLO CCSCc1cc[nH+]c(NC2CCC3(CCCO3)CC2)c1 ZINC000572305183 337605631 /nfs/dbraw/zinc/60/56/31/337605631.db2.gz ADJSSNWUUJCONJ-UHFFFAOYSA-N 1 2 306.475 4.238 20 0 DIADLO CCCCOc1ncccc1C[NH2+][C@@H](C)c1ccncc1Cl ZINC000421824951 337646404 /nfs/dbraw/zinc/64/64/04/337646404.db2.gz LATYLNLQECFJRL-ZDUSSCGKSA-N 1 2 319.836 4.160 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCOc2c(F)ccc(F)c21)c1ccncc1Cl ZINC000421852820 337649945 /nfs/dbraw/zinc/64/99/45/337649945.db2.gz HXVKQAHPMIRJCS-YMTOWFKASA-N 1 2 324.758 4.188 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1OC)c1ccc(C)o1 ZINC000421833281 337651675 /nfs/dbraw/zinc/65/16/75/337651675.db2.gz NPIJUFORUUXLAT-SWLSCSKDSA-N 1 2 323.820 4.288 20 0 DIADLO COc1cc(Cl)ccc1[C@H](C)[NH2+]Cc1cnc(C2CC2)o1 ZINC000421850549 337655002 /nfs/dbraw/zinc/65/50/02/337655002.db2.gz DIHWIORQWBZGOV-JTQLQIEISA-N 1 2 306.793 4.065 20 0 DIADLO C[C@H]([NH2+][C@H]1c2ccc(F)cc2O[C@@H]1C)c1ccncc1Cl ZINC000421861759 337655964 /nfs/dbraw/zinc/65/59/64/337655964.db2.gz WHBUZIWMJCWVMW-YNHOBRIKSA-N 1 2 306.768 4.047 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc2ccccc2c1 ZINC000162697288 337660831 /nfs/dbraw/zinc/66/08/31/337660831.db2.gz NAZLJFLWJOZRPM-UHFFFAOYSA-N 1 2 313.360 4.482 20 0 DIADLO Cc1cc(N2CCC[C@H]2[C@H]2CCCOC2)c2cccc(F)c2[nH+]1 ZINC000580427053 337673254 /nfs/dbraw/zinc/67/32/54/337673254.db2.gz YDYWVQNLCZUQNC-YOEHRIQHSA-N 1 2 314.404 4.078 20 0 DIADLO CCOc1ccc(OCC[NH2+][C@H](c2ccccc2)C(F)F)cc1 ZINC000433049470 337675574 /nfs/dbraw/zinc/67/55/74/337675574.db2.gz VCLPDBMZDBKPML-QGZVFWFLSA-N 1 2 321.367 4.060 20 0 DIADLO COCCC[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(F)cc1 ZINC000423219367 337705014 /nfs/dbraw/zinc/70/50/14/337705014.db2.gz TXGDXIFSQGPQQX-LJQANCHMSA-N 1 2 314.404 4.374 20 0 DIADLO Fc1cccc2c1SCC[C@H]2Nc1ccc2c(c1)CC[NH2+]2 ZINC000423220561 337705191 /nfs/dbraw/zinc/70/51/91/337705191.db2.gz VPWTUUZJDPYDFM-MRXNPFEDSA-N 1 2 300.402 4.443 20 0 DIADLO C[C@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1cc2ccccc2o1 ZINC000536870866 337751579 /nfs/dbraw/zinc/75/15/79/337751579.db2.gz QOBZBKZUIBLUJG-XHDPSFHLSA-N 1 2 317.335 4.095 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCc2nc(C(C)C)ncc2C1 ZINC000527617232 337752381 /nfs/dbraw/zinc/75/23/81/337752381.db2.gz ZLTXVWJSCUVQJY-UHFFFAOYSA-N 1 2 318.424 4.019 20 0 DIADLO Cc1nc(C[NH2+]C(C)(C)c2nc3ccccc3s2)cs1 ZINC000527744822 337760755 /nfs/dbraw/zinc/76/07/55/337760755.db2.gz NWQSRYZJCDEPNW-UHFFFAOYSA-N 1 2 303.456 4.086 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@H](c2ccccn2)C2CCC2)cs1 ZINC000527773063 337762732 /nfs/dbraw/zinc/76/27/32/337762732.db2.gz OMTDMIRWYZJZGL-INIZCTEOSA-N 1 2 315.486 4.467 20 0 DIADLO Cc1sc(C[NH2+]Cc2c(F)cc(C)cc2F)nc1C(C)C ZINC000424150435 337776170 /nfs/dbraw/zinc/77/61/70/337776170.db2.gz YSNMLXTWZNKVAL-UHFFFAOYSA-N 1 2 310.413 4.451 20 0 DIADLO Cn1cc[nH+]c1[C@H](Nc1cccc2c1OC(C)(C)CC2)C1CC1 ZINC000528012237 337783561 /nfs/dbraw/zinc/78/35/61/337783561.db2.gz RUEPTYMNQZNZIF-MRXNPFEDSA-N 1 2 311.429 4.087 20 0 DIADLO C[C@@H]1[C@@H](C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)[C@@H]1C1CC1 ZINC000528317376 337801679 /nfs/dbraw/zinc/80/16/79/337801679.db2.gz VGCRVAULNCWSPE-UYHISHBKSA-N 1 2 308.381 4.105 20 0 DIADLO C[C@H]1[C@@H](C2CC2)[C@H]1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000528317369 337801686 /nfs/dbraw/zinc/80/16/86/337801686.db2.gz VGCRVAULNCWSPE-IGNZVWTISA-N 1 2 308.381 4.105 20 0 DIADLO O=C(Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CCCC1 ZINC000044567562 337811424 /nfs/dbraw/zinc/81/14/24/337811424.db2.gz GOZPSKDTKBSTGW-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1ccc(OC)cc1Cl)c1ccc(C)o1 ZINC000424289169 337815583 /nfs/dbraw/zinc/81/55/83/337815583.db2.gz AFKRGAKDBVYIOV-BLLLJJGKSA-N 1 2 323.820 4.288 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1[nH]c2ccc(Cl)cc2c1Cl ZINC000107290459 337828437 /nfs/dbraw/zinc/82/84/37/337828437.db2.gz GGVHPTCSSJSNON-UHFFFAOYSA-N 1 2 320.179 4.430 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CCc1ccc(-c2ccccc2)o1 ZINC000107291859 337828481 /nfs/dbraw/zinc/82/84/81/337828481.db2.gz STQSHMWDKZMRDP-UHFFFAOYSA-N 1 2 306.365 4.221 20 0 DIADLO Fc1ccccc1C=C1CC[NH+](Cc2cn3ccccc3n2)CC1 ZINC000533345638 337842241 /nfs/dbraw/zinc/84/22/41/337842241.db2.gz FTGMSGNWFXEMQB-UHFFFAOYSA-N 1 2 321.399 4.153 20 0 DIADLO Cc1ccc(NC(=O)c2csc(-c3cccs3)n2)c(C)[nH+]1 ZINC000119161005 337854727 /nfs/dbraw/zinc/85/47/27/337854727.db2.gz KCKLAQPLFWISNS-UHFFFAOYSA-N 1 2 315.423 4.136 20 0 DIADLO Cc1ccc(NC(=O)[C@H]2C[C@@H]2c2ccccc2Cl)c(C)[nH+]1 ZINC000119150159 337855588 /nfs/dbraw/zinc/85/55/88/337855588.db2.gz BDDBXPJECSLCBM-KGLIPLIRSA-N 1 2 300.789 4.094 20 0 DIADLO Cc1ccc2[nH]cc(CCC(=O)Nc3ccc(C)[nH+]c3C)c2c1 ZINC000119307861 337857297 /nfs/dbraw/zinc/85/72/97/337857297.db2.gz PGNJDPDTCLVICG-UHFFFAOYSA-N 1 2 307.397 4.059 20 0 DIADLO CC[C@@H](CSc1ccccc1)NC(=O)Nc1cc[nH+]cc1C ZINC000120383184 337874857 /nfs/dbraw/zinc/87/48/57/337874857.db2.gz KOYMRBLXVHDHBQ-AWEZNQCLSA-N 1 2 315.442 4.082 20 0 DIADLO CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1cc[nH+]cc1C ZINC000120495403 337875673 /nfs/dbraw/zinc/87/56/73/337875673.db2.gz SBCOGKAEYOTXJA-QGZVFWFLSA-N 1 2 311.429 4.183 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2ccccc2OCc2ccccc2)no1 ZINC000537124306 337893539 /nfs/dbraw/zinc/89/35/39/337893539.db2.gz LCNYEYSMSXTDRW-MRXNPFEDSA-N 1 2 322.408 4.413 20 0 DIADLO Cc1ccc(NC(=O)c2cccc(Br)c2C)c(C)[nH+]1 ZINC000094666392 337925956 /nfs/dbraw/zinc/92/59/56/337925956.db2.gz ZSNUZAIZNZHXTI-UHFFFAOYSA-N 1 2 319.202 4.022 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(C)c(Br)c2)c(C)[nH+]1 ZINC000094820565 337926626 /nfs/dbraw/zinc/92/66/26/337926626.db2.gz XTLDRYLTBPHGRX-UHFFFAOYSA-N 1 2 319.202 4.022 20 0 DIADLO CC(C)C[C@@H]1C[C@@H](Nc2cc(C(F)(F)F)cc[nH+]2)CCO1 ZINC000537388534 337934717 /nfs/dbraw/zinc/93/47/17/337934717.db2.gz ASOVOIZYISADKZ-QWHCGFSZSA-N 1 2 302.340 4.106 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc(C)ccc3C3CC3)ccc2[nH+]1 ZINC000424637279 337935523 /nfs/dbraw/zinc/93/55/23/337935523.db2.gz JMPXVWLXPUXJDJ-UHFFFAOYSA-N 1 2 305.381 4.081 20 0 DIADLO CCCC[C@@H](COC)[NH2+]c1ccc(N2CCSCC2)cc1C ZINC000537527143 337939999 /nfs/dbraw/zinc/93/99/99/337939999.db2.gz CJJDIJDJSVOAGN-INIZCTEOSA-N 1 2 322.518 4.165 20 0 DIADLO C[C@]1([NH2+]Cc2nc(C3CCCC3)no2)CCCc2ccccc21 ZINC000537605942 337947472 /nfs/dbraw/zinc/94/74/72/337947472.db2.gz VEDSDEQWSYQYJF-IBGZPJMESA-N 1 2 311.429 4.069 20 0 DIADLO Cc1ccc[nH+]c1CCc1noc(C(C2CCC2)C2CCC2)n1 ZINC000572475042 337984838 /nfs/dbraw/zinc/98/48/38/337984838.db2.gz BTEWAXCKURBHQJ-UHFFFAOYSA-N 1 2 311.429 4.242 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@@H](C)c2ccc(Cl)s2)n1 ZINC000515623282 337994064 /nfs/dbraw/zinc/99/40/64/337994064.db2.gz CGDKOIWGUCRMQD-VIFPVBQESA-N 1 2 319.817 4.231 20 0 DIADLO Cc1cc[nH+]c(NCCc2nc3ccccc3s2)c1Cl ZINC000515720567 337996619 /nfs/dbraw/zinc/99/66/19/337996619.db2.gz OWKCYZKTHBAEMV-UHFFFAOYSA-N 1 2 303.818 4.308 20 0 DIADLO Cc1cccc(N2CC[NH+]([C@@H](C)c3cc(F)ccc3F)CC2)c1 ZINC000515780372 337997401 /nfs/dbraw/zinc/99/74/01/337997401.db2.gz YAIKYRLFGFACHJ-HNNXBMFYSA-N 1 2 316.395 4.156 20 0 DIADLO C[C@@H](CC(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccc(F)cc1 ZINC000516101449 338003574 /nfs/dbraw/zinc/00/35/74/338003574.db2.gz UGEBLRYJMDRBDP-AWEZNQCLSA-N 1 2 323.371 4.144 20 0 DIADLO c1cc(-c2noc(-c3cccc(Oc4cc[nH+]cc4)c3)n2)co1 ZINC000445460399 338019923 /nfs/dbraw/zinc/01/99/23/338019923.db2.gz AHTFOXAWYPJYLK-UHFFFAOYSA-N 1 2 305.293 4.184 20 0 DIADLO Cc1cn2cc(NC(=O)N3CCC[C@H]3CCC(C)C)ccc2[nH+]1 ZINC000426101787 338020448 /nfs/dbraw/zinc/02/04/48/338020448.db2.gz CJXULWZAYOMAFJ-INIZCTEOSA-N 1 2 314.433 4.075 20 0 DIADLO COc1cc2c(cc1F)C[N@H+](Cc1cc(Cl)cs1)CC2 ZINC000426169182 338021952 /nfs/dbraw/zinc/02/19/52/338021952.db2.gz ZYDOESZHAQEKAV-UHFFFAOYSA-N 1 2 311.809 4.108 20 0 DIADLO COc1cc2c(cc1F)C[N@@H+](Cc1cc(Cl)cs1)CC2 ZINC000426169182 338021953 /nfs/dbraw/zinc/02/19/53/338021953.db2.gz ZYDOESZHAQEKAV-UHFFFAOYSA-N 1 2 311.809 4.108 20 0 DIADLO CCCc1csc(C[N@H+](C)Cc2ccc(OC)c(C)c2)n1 ZINC000426394889 338030431 /nfs/dbraw/zinc/03/04/31/338030431.db2.gz KSHIBQDTRZSIKT-UHFFFAOYSA-N 1 2 304.459 4.045 20 0 DIADLO CCCc1csc(C[N@@H+](C)Cc2ccc(OC)c(C)c2)n1 ZINC000426394889 338030432 /nfs/dbraw/zinc/03/04/32/338030432.db2.gz KSHIBQDTRZSIKT-UHFFFAOYSA-N 1 2 304.459 4.045 20 0 DIADLO CCCc1csc(C[N@@H+]2C[C@@H](c3ccccc3)OC[C@H]2C)n1 ZINC000426415098 338031382 /nfs/dbraw/zinc/03/13/82/338031382.db2.gz CUDUGEBHRWJDHE-PBHICJAKSA-N 1 2 316.470 4.058 20 0 DIADLO CCCc1csc(C[N@H+]2C[C@@H](c3ccccc3)OC[C@H]2C)n1 ZINC000426415098 338031383 /nfs/dbraw/zinc/03/13/83/338031383.db2.gz CUDUGEBHRWJDHE-PBHICJAKSA-N 1 2 316.470 4.058 20 0 DIADLO CCCc1csc(C[N@@H+]2CCOC3(C2)CCCCCC3)n1 ZINC000426418438 338031569 /nfs/dbraw/zinc/03/15/69/338031569.db2.gz WYDYMIJNFLHNLU-UHFFFAOYSA-N 1 2 308.491 4.021 20 0 DIADLO CCCc1csc(C[N@H+]2CCOC3(C2)CCCCCC3)n1 ZINC000426418438 338031570 /nfs/dbraw/zinc/03/15/70/338031570.db2.gz WYDYMIJNFLHNLU-UHFFFAOYSA-N 1 2 308.491 4.021 20 0 DIADLO Cc1c[nH+]cc(CCc2nc(-c3cccc(OC(C)C)c3)no2)c1 ZINC000426421216 338031740 /nfs/dbraw/zinc/03/17/40/338031740.db2.gz OYRGHWVLRPNCEV-UHFFFAOYSA-N 1 2 323.396 4.012 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(CC2CC(C)(C)C2)n1 ZINC000426427973 338032057 /nfs/dbraw/zinc/03/20/57/338032057.db2.gz QKRPISUBKWKMFI-UHFFFAOYSA-N 1 2 324.428 4.009 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(Cl)cc(Cl)cc3[C@H]2C)ncn1 ZINC000428237997 338043820 /nfs/dbraw/zinc/04/38/20/338043820.db2.gz MERAEZPQLGGSQM-LLVKDONJSA-N 1 2 322.239 4.211 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(Cl)cc(Cl)cc3[C@H]2C)ncn1 ZINC000428237997 338043821 /nfs/dbraw/zinc/04/38/21/338043821.db2.gz MERAEZPQLGGSQM-LLVKDONJSA-N 1 2 322.239 4.211 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2nnc(C(C)C)[nH]2)o1 ZINC000428244583 338044005 /nfs/dbraw/zinc/04/40/05/338044005.db2.gz IRXUHDSSKWROCU-ZFWWWQNUSA-N 1 2 316.449 4.057 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2nnc(C(C)C)[nH]2)o1 ZINC000428244583 338044006 /nfs/dbraw/zinc/04/40/06/338044006.db2.gz IRXUHDSSKWROCU-ZFWWWQNUSA-N 1 2 316.449 4.057 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+](C)Cc1nc2ccccc2s1 ZINC000428453926 338052541 /nfs/dbraw/zinc/05/25/41/338052541.db2.gz PUIUVFCCOSNFRW-UHFFFAOYSA-N 1 2 315.442 4.348 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+](C)Cc1nc2ccccc2s1 ZINC000428453926 338052542 /nfs/dbraw/zinc/05/25/42/338052542.db2.gz PUIUVFCCOSNFRW-UHFFFAOYSA-N 1 2 315.442 4.348 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2noc(-c3ccsc3)n2)c1C ZINC000428710749 338059049 /nfs/dbraw/zinc/05/90/49/338059049.db2.gz KJJGOZRHBPDUCJ-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2noc(-c3ccsc3)n2)c1C ZINC000428710749 338059050 /nfs/dbraw/zinc/05/90/50/338059050.db2.gz KJJGOZRHBPDUCJ-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO C[C@]12CC[N@H+](Cc3csc(C4CCCC4)n3)C[C@H]1C2(F)F ZINC000428710701 338059103 /nfs/dbraw/zinc/05/91/03/338059103.db2.gz JZVRRWBBBFZFKU-HIFRSBDPSA-N 1 2 312.429 4.278 20 0 DIADLO C[C@]12CC[N@@H+](Cc3csc(C4CCCC4)n3)C[C@H]1C2(F)F ZINC000428710701 338059104 /nfs/dbraw/zinc/05/91/04/338059104.db2.gz JZVRRWBBBFZFKU-HIFRSBDPSA-N 1 2 312.429 4.278 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+](C)Cc2cccc(C)c2C)n1 ZINC000428708975 338059136 /nfs/dbraw/zinc/05/91/36/338059136.db2.gz GNTKBPOOBCIEMZ-OAHLLOKOSA-N 1 2 301.434 4.222 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+](C)Cc2cccc(C)c2C)n1 ZINC000428708975 338059137 /nfs/dbraw/zinc/05/91/37/338059137.db2.gz GNTKBPOOBCIEMZ-OAHLLOKOSA-N 1 2 301.434 4.222 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)[C@@H](C)c1ccc(CC(C)C)cc1 ZINC000428734023 338060019 /nfs/dbraw/zinc/06/00/19/338060019.db2.gz YAOGLJUZNNGJEC-HNNXBMFYSA-N 1 2 310.441 4.007 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2nc3ccc(F)cc3s2)cs1 ZINC000428841406 338061885 /nfs/dbraw/zinc/06/18/85/338061885.db2.gz CHCRGOGFAQFOCY-SECBINFHSA-N 1 2 321.446 4.305 20 0 DIADLO Fc1ccc2nc(C[NH2+]Cc3ccc(F)cc3F)sc2c1 ZINC000428867697 338063447 /nfs/dbraw/zinc/06/34/47/338063447.db2.gz MQQOGOVFQSKQIT-UHFFFAOYSA-N 1 2 308.328 4.003 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2nc3ccc(F)cc3s2)n1 ZINC000428881016 338064299 /nfs/dbraw/zinc/06/42/99/338064299.db2.gz LGJZUVFBJYHSOE-VIFPVBQESA-N 1 2 307.419 4.051 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2nc3ccc(F)cc3s2)n1 ZINC000428879332 338064338 /nfs/dbraw/zinc/06/43/38/338064338.db2.gz BYEMWIUDLUVZBS-UHFFFAOYSA-N 1 2 321.446 4.225 20 0 DIADLO CCc1nc(C)c(C[N@@H+]2CC[C@](F)(c3cc(C)cc(F)c3)C2)o1 ZINC000428941522 338065722 /nfs/dbraw/zinc/06/57/22/338065722.db2.gz VUFRGSVKLDFIKE-GOSISDBHSA-N 1 2 320.383 4.064 20 0 DIADLO CCc1nc(C)c(C[N@H+]2CC[C@](F)(c3cc(C)cc(F)c3)C2)o1 ZINC000428941522 338065723 /nfs/dbraw/zinc/06/57/23/338065723.db2.gz VUFRGSVKLDFIKE-GOSISDBHSA-N 1 2 320.383 4.064 20 0 DIADLO CCc1nc(C)c(C[NH2+][C@@H](c2ccc(C)cc2)c2ccccn2)o1 ZINC000428974454 338067374 /nfs/dbraw/zinc/06/73/74/338067374.db2.gz FMRQMMPUOQKBKY-FQEVSTJZSA-N 1 2 321.424 4.128 20 0 DIADLO Clc1cccnc1C1CC[NH+](Cc2ccncc2Cl)CC1 ZINC000429204729 338073087 /nfs/dbraw/zinc/07/30/87/338073087.db2.gz APLHKJUPFANYML-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Fc1ccc(F)c(C[NH+]2CCC(c3ncccc3Cl)CC2)c1 ZINC000429208734 338073182 /nfs/dbraw/zinc/07/31/82/338073182.db2.gz SDAWLKYLCWGTOB-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Fc1cccc(F)c1C[NH+]1CCC(c2ncccc2Cl)CC1 ZINC000429211600 338073332 /nfs/dbraw/zinc/07/33/32/338073332.db2.gz DPFIDMDPKHUUDI-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO CCC(CC)n1ccc(C[NH2+]C(C)(C)c2ccccc2F)n1 ZINC000429236552 338074158 /nfs/dbraw/zinc/07/41/58/338074158.db2.gz MKIZVASQEMVEOS-UHFFFAOYSA-N 1 2 303.425 4.408 20 0 DIADLO Cc1ccc(C)c(C[N@@H+](C)[C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000429287364 338076594 /nfs/dbraw/zinc/07/65/94/338076594.db2.gz TZOGDNWGSDUJGM-AWEZNQCLSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1ccc(C)c(C[N@H+](C)[C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000429287364 338076595 /nfs/dbraw/zinc/07/65/95/338076595.db2.gz TZOGDNWGSDUJGM-AWEZNQCLSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[NH2+][C@H](C)c1cccc(O)c1 ZINC000429296820 338077147 /nfs/dbraw/zinc/07/71/47/338077147.db2.gz BAANIDYWZDAFDL-CYBMUJFWSA-N 1 2 308.381 4.206 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@H](C)C(=O)Nc1cccc2ccccc21 ZINC000429374724 338079016 /nfs/dbraw/zinc/07/90/16/338079016.db2.gz DNNHIUCDWPUHMU-OAHLLOKOSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@H](C)C(=O)Nc1cccc2ccccc21 ZINC000429374724 338079017 /nfs/dbraw/zinc/07/90/17/338079017.db2.gz DNNHIUCDWPUHMU-OAHLLOKOSA-N 1 2 322.408 4.200 20 0 DIADLO C=Cc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)cc1 ZINC000429661746 338086909 /nfs/dbraw/zinc/08/69/09/338086909.db2.gz QLBZILLMHXVIGO-UHFFFAOYSA-N 1 2 323.783 4.421 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]C(C)(C)c1ncc(C)s1 ZINC000429687816 338087491 /nfs/dbraw/zinc/08/74/91/338087491.db2.gz ATLIVPDVEGMDQX-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]C(C)(C)c1nc(C)c(C)s1 ZINC000429695098 338087728 /nfs/dbraw/zinc/08/77/28/338087728.db2.gz GQQBQLUXBDJIOQ-UHFFFAOYSA-N 1 2 324.877 4.447 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2c(Cl)cccc2OC)cs1 ZINC000429703072 338087831 /nfs/dbraw/zinc/08/78/31/338087831.db2.gz YZLUPSAERYOMQL-JTQLQIEISA-N 1 2 310.850 4.218 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccccc1F ZINC000429781812 338089834 /nfs/dbraw/zinc/08/98/34/338089834.db2.gz UMWIWUZVXIINTL-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO Fc1cc(Cl)cnc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000429995778 338093176 /nfs/dbraw/zinc/09/31/76/338093176.db2.gz ZOMIONCKIQALLJ-UHFFFAOYSA-N 1 2 306.772 4.003 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2ccsc2Cl)c(F)c1F ZINC000430038632 338094246 /nfs/dbraw/zinc/09/42/46/338094246.db2.gz KOVWGDZKXCZEDE-UHFFFAOYSA-N 1 2 309.715 4.248 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(-c3ccccc3)n[nH]2)[C@@H]1c1cccnc1 ZINC000430095431 338096125 /nfs/dbraw/zinc/09/61/25/338096125.db2.gz AWRPTAJDANIXKP-LJQANCHMSA-N 1 2 318.424 4.055 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(-c3ccccc3)n[nH]2)[C@@H]1c1cccnc1 ZINC000430095431 338096126 /nfs/dbraw/zinc/09/61/26/338096126.db2.gz AWRPTAJDANIXKP-LJQANCHMSA-N 1 2 318.424 4.055 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(F)cc(Cl)c2)[C@@H]1c1cccnc1 ZINC000430108698 338097155 /nfs/dbraw/zinc/09/71/55/338097155.db2.gz UPRSOSHRRWQQBR-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(F)cc(Cl)c2)[C@@H]1c1cccnc1 ZINC000430108698 338097156 /nfs/dbraw/zinc/09/71/56/338097156.db2.gz UPRSOSHRRWQQBR-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1cscc1Br ZINC000430133904 338098467 /nfs/dbraw/zinc/09/84/67/338098467.db2.gz OGXAPRWOOWGLMA-UHFFFAOYSA-N 1 2 300.221 4.044 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1cscc1Br ZINC000430133904 338098468 /nfs/dbraw/zinc/09/84/68/338098468.db2.gz OGXAPRWOOWGLMA-UHFFFAOYSA-N 1 2 300.221 4.044 20 0 DIADLO CCc1occc1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000430556039 338108624 /nfs/dbraw/zinc/10/86/24/338108624.db2.gz SZLSWWSCPBUUKK-UHFFFAOYSA-N 1 2 308.337 4.282 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000430726764 338112583 /nfs/dbraw/zinc/11/25/83/338112583.db2.gz FLUBFSWJMOGTCP-VIFPVBQESA-N 1 2 312.310 4.051 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)c(C)o1 ZINC000430747669 338113282 /nfs/dbraw/zinc/11/32/82/338113282.db2.gz NHIMQIAAVAWSRA-MRVPVSSYSA-N 1 2 301.283 4.304 20 0 DIADLO C[C@@H]1[C@@H](C(=O)Nc2c[nH+]ccc2OC(C)(C)C)[C@H]1c1ccccc1 ZINC000430800038 338115384 /nfs/dbraw/zinc/11/53/84/338115384.db2.gz OBFWKUXOIORSRY-MORSLUCNSA-N 1 2 324.424 4.247 20 0 DIADLO C[C@@H]1[C@@H](C(=O)Nc2c[nH+]ccc2OC(C)(C)C)[C@@H]1c1ccccc1 ZINC000430800036 338115391 /nfs/dbraw/zinc/11/53/91/338115391.db2.gz OBFWKUXOIORSRY-DOPJRALCSA-N 1 2 324.424 4.247 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1cc(Cl)ccc1F ZINC000430868280 338117431 /nfs/dbraw/zinc/11/74/31/338117431.db2.gz VHMOCVQFWUBCIX-INIZCTEOSA-N 1 2 321.827 4.423 20 0 DIADLO Cn1c2cc(F)ccc2[nH+]c1N1CCC[C@H]1c1cccs1 ZINC000431037053 338121005 /nfs/dbraw/zinc/12/10/05/338121005.db2.gz LCTVAWVNAWAODB-ZDUSSCGKSA-N 1 2 301.390 4.115 20 0 DIADLO OC[C@H]([NH2+]Cc1csc(Cl)c1Cl)c1ccc(F)cc1 ZINC000432249537 338150722 /nfs/dbraw/zinc/15/07/22/338150722.db2.gz FUIDORPNFJUOFM-NSHDSACASA-N 1 2 320.216 4.017 20 0 DIADLO Cc1nc(C[NH2+]Cc2csc(Cl)c2Cl)sc1C ZINC000432250763 338150951 /nfs/dbraw/zinc/15/09/51/338150951.db2.gz MQNDMCCHFZPYSM-UHFFFAOYSA-N 1 2 307.271 4.418 20 0 DIADLO COC[C@H]([NH2+]Cc1csc(Cl)c1Cl)c1ccc(C)o1 ZINC000432252155 338151010 /nfs/dbraw/zinc/15/10/10/338151010.db2.gz XENRSEOWERLVJE-JTQLQIEISA-N 1 2 320.241 4.434 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(F)c(Cl)c2Cl)s1 ZINC000432260889 338151748 /nfs/dbraw/zinc/15/17/48/338151748.db2.gz ZHWMLXQHFSBNOY-LURJTMIESA-N 1 2 320.220 4.143 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2ccc(C(F)(F)F)s2)s1 ZINC000432731057 338164573 /nfs/dbraw/zinc/16/45/73/338164573.db2.gz WNGKWVWTBKTAFM-UHFFFAOYSA-N 1 2 320.405 4.418 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2ccc(C(F)(F)F)s2)s1 ZINC000432731057 338164574 /nfs/dbraw/zinc/16/45/74/338164574.db2.gz WNGKWVWTBKTAFM-UHFFFAOYSA-N 1 2 320.405 4.418 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2nc3ccc(F)cc3s2)on1 ZINC000432746247 338165815 /nfs/dbraw/zinc/16/58/15/338165815.db2.gz ZCOAHYHNURXMOU-ZDUSSCGKSA-N 1 2 317.389 4.069 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2nc3ccc(F)cc3s2)on1 ZINC000432746247 338165816 /nfs/dbraw/zinc/16/58/16/338165816.db2.gz ZCOAHYHNURXMOU-ZDUSSCGKSA-N 1 2 317.389 4.069 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc(C(F)(F)F)s2)on1 ZINC000432744552 338165863 /nfs/dbraw/zinc/16/58/63/338165863.db2.gz KIMLYFFJZVERSH-LLVKDONJSA-N 1 2 316.348 4.400 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc(C(F)(F)F)s2)on1 ZINC000432744552 338165864 /nfs/dbraw/zinc/16/58/64/338165864.db2.gz KIMLYFFJZVERSH-LLVKDONJSA-N 1 2 316.348 4.400 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@@H]3c3ccc[nH]3)sc2c1 ZINC000432754351 338166717 /nfs/dbraw/zinc/16/67/17/338166717.db2.gz YVUIWCXOYRVULF-CQSZACIVSA-N 1 2 301.390 4.101 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@@H]3c3ccc[nH]3)sc2c1 ZINC000432754351 338166718 /nfs/dbraw/zinc/16/67/18/338166718.db2.gz YVUIWCXOYRVULF-CQSZACIVSA-N 1 2 301.390 4.101 20 0 DIADLO CC(C)(C)OC(=O)CCCC[NH2+][C@@H](c1ccccc1)C(F)F ZINC000433048826 338178462 /nfs/dbraw/zinc/17/84/62/338178462.db2.gz YSPHTRJVTANNFU-HNNXBMFYSA-N 1 2 313.388 4.094 20 0 DIADLO FC(F)[C@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1ccccc1 ZINC000433059924 338179372 /nfs/dbraw/zinc/17/93/72/338179372.db2.gz FKTAMFNQOLFDKC-HZPDHXFCSA-N 1 2 309.400 4.464 20 0 DIADLO Fc1cccc(F)c1C[NH2+]Cc1cc(F)c(Cl)cc1F ZINC000433196446 338185294 /nfs/dbraw/zinc/18/52/94/338185294.db2.gz JQFKIPPCQMPZKY-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO CC(C)c1noc([C@H](C)[N@H+](C)Cc2ccc(F)c(Cl)c2)n1 ZINC000433263480 338188552 /nfs/dbraw/zinc/18/85/52/338188552.db2.gz VVVPAHJZNGZOAH-JTQLQIEISA-N 1 2 311.788 4.179 20 0 DIADLO CC(C)c1noc([C@H](C)[N@@H+](C)Cc2ccc(F)c(Cl)c2)n1 ZINC000433263480 338188553 /nfs/dbraw/zinc/18/85/53/338188553.db2.gz VVVPAHJZNGZOAH-JTQLQIEISA-N 1 2 311.788 4.179 20 0 DIADLO CC(C)(C)c1noc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)n1 ZINC000433290667 338189498 /nfs/dbraw/zinc/18/94/98/338189498.db2.gz UBLDYRSOQBSFEH-CYBMUJFWSA-N 1 2 319.836 4.010 20 0 DIADLO CC(C)(C)c1noc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)n1 ZINC000433290667 338189499 /nfs/dbraw/zinc/18/94/99/338189499.db2.gz UBLDYRSOQBSFEH-CYBMUJFWSA-N 1 2 319.836 4.010 20 0 DIADLO CCC1(C(=O)Nc2ccc(-c3cn4c([nH+]3)CCCC4)cc2)CCC1 ZINC000433400913 338194663 /nfs/dbraw/zinc/19/46/63/338194663.db2.gz VIDZDHHUHROISW-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccccc3C(C)(C)C)cc2[nH+]1 ZINC000433691526 338199599 /nfs/dbraw/zinc/19/95/99/338199599.db2.gz TZTISLRUGKBNQG-UHFFFAOYSA-N 1 2 307.397 4.421 20 0 DIADLO Cc1[nH]c2cc(NC(=O)c3ccccc3C(C)(C)C)ccc2[nH+]1 ZINC000433691526 338199600 /nfs/dbraw/zinc/19/96/00/338199600.db2.gz TZTISLRUGKBNQG-UHFFFAOYSA-N 1 2 307.397 4.421 20 0 DIADLO COCC1(C)CCN(c2cc(C(C)(C)C)[nH+]c(C(C)C)n2)CC1 ZINC000433750473 338200788 /nfs/dbraw/zinc/20/07/88/338200788.db2.gz USFZBYUELONELZ-UHFFFAOYSA-N 1 2 319.493 4.150 20 0 DIADLO CC[C@@H](Nc1[nH+]c(C)nc2[nH]ccc21)c1cc(F)ccc1F ZINC000433766375 338201150 /nfs/dbraw/zinc/20/11/50/338201150.db2.gz MTQLYFQFKQTOLD-CQSZACIVSA-N 1 2 302.328 4.108 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)o1 ZINC000433788865 338201820 /nfs/dbraw/zinc/20/18/20/338201820.db2.gz JPKNNCJNANWVGB-IAQYHMDHSA-N 1 2 307.825 4.333 20 0 DIADLO Cc1nc2[nH]ccc2c(NCCCCCOC2CCCCC2)[nH+]1 ZINC000433788091 338201902 /nfs/dbraw/zinc/20/19/02/338201902.db2.gz BLEVBDNZECVJEO-UHFFFAOYSA-N 1 2 316.449 4.149 20 0 DIADLO CC[C@@H](Nc1[nH+]c(C)nc2[nH]ccc21)c1ccc(F)cc1F ZINC000433789593 338201984 /nfs/dbraw/zinc/20/19/84/338201984.db2.gz NZLYUNWZGGVWOQ-CQSZACIVSA-N 1 2 302.328 4.108 20 0 DIADLO CC(C)c1ccc(C[N@@H+](Cc2ncnn2C(C)C)C2CC2)cc1 ZINC000434544162 338219874 /nfs/dbraw/zinc/21/98/74/338219874.db2.gz LDGIQIOJADWMJL-UHFFFAOYSA-N 1 2 312.461 4.147 20 0 DIADLO CC(C)c1ccc(C[N@H+](Cc2ncnn2C(C)C)C2CC2)cc1 ZINC000434544162 338219875 /nfs/dbraw/zinc/21/98/75/338219875.db2.gz LDGIQIOJADWMJL-UHFFFAOYSA-N 1 2 312.461 4.147 20 0 DIADLO CC(C)[C@H](c1ccccc1Cl)[N@H+](C)Cc1ncnn1C(C)C ZINC000434543295 338219888 /nfs/dbraw/zinc/21/98/88/338219888.db2.gz QBDIPMOAMOPRQL-QGZVFWFLSA-N 1 2 320.868 4.342 20 0 DIADLO CC(C)[C@H](c1ccccc1Cl)[N@@H+](C)Cc1ncnn1C(C)C ZINC000434543295 338219889 /nfs/dbraw/zinc/21/98/89/338219889.db2.gz QBDIPMOAMOPRQL-QGZVFWFLSA-N 1 2 320.868 4.342 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc2ccccc21 ZINC000434717040 338224027 /nfs/dbraw/zinc/22/40/27/338224027.db2.gz IOLYSAPFHPCZNB-AWEZNQCLSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1occc1C[N@H+](C)[C@@H](C)C(=O)Nc1cccc2ccccc21 ZINC000434717040 338224028 /nfs/dbraw/zinc/22/40/28/338224028.db2.gz IOLYSAPFHPCZNB-AWEZNQCLSA-N 1 2 322.408 4.200 20 0 DIADLO COc1ccc(OC(F)F)c(C[N@@H+]2CC[C@H]2c2ccccc2)c1 ZINC000434976596 338228304 /nfs/dbraw/zinc/22/83/04/338228304.db2.gz CXBZAKZKCNCHAS-INIZCTEOSA-N 1 2 319.351 4.244 20 0 DIADLO COc1ccc(OC(F)F)c(C[N@H+]2CC[C@H]2c2ccccc2)c1 ZINC000434976596 338228305 /nfs/dbraw/zinc/22/83/05/338228305.db2.gz CXBZAKZKCNCHAS-INIZCTEOSA-N 1 2 319.351 4.244 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCC3(C2)CCCCC3)s1 ZINC000435129487 338232612 /nfs/dbraw/zinc/23/26/12/338232612.db2.gz MQAGUYLPIUMOTH-UHFFFAOYSA-N 1 2 304.381 4.318 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCC3(C2)CCCCC3)s1 ZINC000435129487 338232613 /nfs/dbraw/zinc/23/26/13/338232613.db2.gz MQAGUYLPIUMOTH-UHFFFAOYSA-N 1 2 304.381 4.318 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)Cc1ccc(-c2cc[nH]n2)o1 ZINC000435134423 338232934 /nfs/dbraw/zinc/23/29/34/338232934.db2.gz HPNCZUBHPIIDMF-NSHDSACASA-N 1 2 317.339 4.141 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccc(-c2cc[nH]n2)o1 ZINC000435134423 338232935 /nfs/dbraw/zinc/23/29/35/338232935.db2.gz HPNCZUBHPIIDMF-NSHDSACASA-N 1 2 317.339 4.141 20 0 DIADLO Cc1cc(N[C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)nc[nH+]1 ZINC000435597700 338243247 /nfs/dbraw/zinc/24/32/47/338243247.db2.gz NHVJPJYZYDSBJP-MQMHXKEQSA-N 1 2 307.319 4.162 20 0 DIADLO C[C@@H]1[C@@H](C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)[C@H]1c1ccccc1 ZINC000435618234 338243725 /nfs/dbraw/zinc/24/37/25/338243725.db2.gz SBKXRQXMGJOJDC-MORSLUCNSA-N 1 2 317.392 4.065 20 0 DIADLO Cc1c[nH+]cc(NCc2ccc(N(C)c3ccccc3)nc2)c1 ZINC000435714013 338246015 /nfs/dbraw/zinc/24/60/15/338246015.db2.gz OLGCPMJCWFLIIW-UHFFFAOYSA-N 1 2 304.397 4.165 20 0 DIADLO FC(F)(F)Oc1ccccc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000435769311 338248480 /nfs/dbraw/zinc/24/84/80/338248480.db2.gz VNXRITPROXVDSP-AWEZNQCLSA-N 1 2 310.319 4.250 20 0 DIADLO FC(F)(F)Oc1ccccc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000435769311 338248481 /nfs/dbraw/zinc/24/84/81/338248481.db2.gz VNXRITPROXVDSP-AWEZNQCLSA-N 1 2 310.319 4.250 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)[C@H](C)CC(C)(C)C ZINC000435981151 338254957 /nfs/dbraw/zinc/25/49/57/338254957.db2.gz IFWOGRMRVHCRHL-HUUCEWRRSA-N 1 2 305.466 4.029 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)C[C@@H](C)C(C)(C)C ZINC000435991971 338255278 /nfs/dbraw/zinc/25/52/78/338255278.db2.gz JNGFNLRVNQARJR-HUUCEWRRSA-N 1 2 305.466 4.029 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)[C@H](C)CCC(C)(C)C ZINC000435996576 338255407 /nfs/dbraw/zinc/25/54/07/338255407.db2.gz UJBZNKPLAXZJGK-HZPDHXFCSA-N 1 2 319.493 4.419 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)[C@@H](C)CCC(C)(C)C ZINC000435996575 338255427 /nfs/dbraw/zinc/25/54/27/338255427.db2.gz UJBZNKPLAXZJGK-HOTGVXAUSA-N 1 2 319.493 4.419 20 0 DIADLO C[C@@H]1CC[C@@H](C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)C1 ZINC000436173079 338260597 /nfs/dbraw/zinc/26/05/97/338260597.db2.gz AJMGKRBMSZARMX-GDBMZVCRSA-N 1 2 323.440 4.261 20 0 DIADLO CC(C)CC(C)(C)C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000436443252 338272513 /nfs/dbraw/zinc/27/25/13/338272513.db2.gz UBJURNXACZZJNN-UHFFFAOYSA-N 1 2 323.506 4.140 20 0 DIADLO COc1cccc2c(N[C@@H]3CCO[C@@H](CC(C)C)C3)cc[nH+]c12 ZINC000436463450 338272951 /nfs/dbraw/zinc/27/29/51/338272951.db2.gz YPMFODFPKSYNSV-CABCVRRESA-N 1 2 314.429 4.249 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C)CCc2ccccc2)c(C)[nH+]1 ZINC000436494764 338274341 /nfs/dbraw/zinc/27/43/41/338274341.db2.gz NZEFIZUNQGSOKZ-AWEZNQCLSA-N 1 2 311.429 4.150 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@H](C)[C@H]2c2ccccc2)c(C)[nH+]1 ZINC000436500321 338274493 /nfs/dbraw/zinc/27/44/93/338274493.db2.gz ZLGBQBRKLKWIFM-UGSOOPFHSA-N 1 2 309.413 4.232 20 0 DIADLO Cc1cc(-c2noc([C@@H](C)[NH+]3Cc4ccccc4C3)n2)ccc1F ZINC000155545864 338289414 /nfs/dbraw/zinc/28/94/14/338289414.db2.gz JVVSVJNGTDMSFK-CYBMUJFWSA-N 1 2 323.371 4.261 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1cccc(F)c1 ZINC000437008882 338297598 /nfs/dbraw/zinc/29/75/98/338297598.db2.gz XFHPUWRVZLGWRH-QGZVFWFLSA-N 1 2 320.408 4.370 20 0 DIADLO Fc1ccc(CSCc2[nH+]ccn2CC(F)(F)F)cc1F ZINC000437261565 338305143 /nfs/dbraw/zinc/30/51/43/338305143.db2.gz HEKSBDFFSJDHBB-UHFFFAOYSA-N 1 2 322.302 4.157 20 0 DIADLO CCc1ccc(CC)c(NC(=O)c2cccc(-n3cc[nH+]c3)c2)c1 ZINC000437387504 338308560 /nfs/dbraw/zinc/30/85/60/338308560.db2.gz FICBVULUZYBUOC-UHFFFAOYSA-N 1 2 319.408 4.249 20 0 DIADLO CCC(CC)n1ccc(C[NH+]2CCC(C(F)(F)F)CC2)n1 ZINC000437574470 338313888 /nfs/dbraw/zinc/31/38/88/338313888.db2.gz CNJJJGGOLWQBNG-UHFFFAOYSA-N 1 2 303.372 4.019 20 0 DIADLO Cn1ncc(Cl)c1C[N@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000437595425 338315643 /nfs/dbraw/zinc/31/56/43/338315643.db2.gz SQHJZDGEQPXKML-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1ncc(Cl)c1C[N@@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000437595425 338315644 /nfs/dbraw/zinc/31/56/44/338315644.db2.gz SQHJZDGEQPXKML-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO CC(=O)c1ccc(OCc2c[nH+]cn2Cc2ccccc2)c(C)c1 ZINC000437612165 338316136 /nfs/dbraw/zinc/31/61/36/338316136.db2.gz IHZQEZQVVSWRSZ-UHFFFAOYSA-N 1 2 320.392 4.021 20 0 DIADLO CC(C)Oc1ccc(OCc2c[nH+]cn2Cc2ccccc2)cc1 ZINC000437616641 338316215 /nfs/dbraw/zinc/31/62/15/338316215.db2.gz LSGUVLHHMIVFRT-UHFFFAOYSA-N 1 2 322.408 4.298 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3c(cccc3F)[nH]2)C[C@@H](c2ccccc2)O1 ZINC000437683932 338318243 /nfs/dbraw/zinc/31/82/43/338318243.db2.gz BONGLHZJOTZHFU-XOBRGWDASA-N 1 2 324.399 4.269 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3c(cccc3F)[nH]2)C[C@@H](c2ccccc2)O1 ZINC000437683932 338318244 /nfs/dbraw/zinc/31/82/44/338318244.db2.gz BONGLHZJOTZHFU-XOBRGWDASA-N 1 2 324.399 4.269 20 0 DIADLO CCC(CC)(CC)NC(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000437954303 338326163 /nfs/dbraw/zinc/32/61/63/338326163.db2.gz MUXPCMYNXPLUKM-UHFFFAOYSA-N 1 2 314.433 4.177 20 0 DIADLO CCCCCOc1ccc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)cc1 ZINC000437960918 338326508 /nfs/dbraw/zinc/32/65/08/338326508.db2.gz GSHMCJCHMFHMHU-GOSISDBHSA-N 1 2 313.445 4.316 20 0 DIADLO CCCCCOc1ccc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)cc1 ZINC000437960918 338326509 /nfs/dbraw/zinc/32/65/09/338326509.db2.gz GSHMCJCHMFHMHU-GOSISDBHSA-N 1 2 313.445 4.316 20 0 DIADLO CC[C@@H]1C[C@H]1NC(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000438104500 338331949 /nfs/dbraw/zinc/33/19/49/338331949.db2.gz LLAYNBSGEGSPJY-IAQYHMDHSA-N 1 2 316.788 4.056 20 0 DIADLO CCC(CC)c1noc([C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2)n1 ZINC000438235571 338337532 /nfs/dbraw/zinc/33/75/32/338337532.db2.gz KRPARMBGAWHXON-INIZCTEOSA-N 1 2 317.408 4.449 20 0 DIADLO CCC(CC)c1noc([C@@H]2CCC[N@H+]2Cc2ccc(F)cc2)n1 ZINC000438235571 338337533 /nfs/dbraw/zinc/33/75/33/338337533.db2.gz KRPARMBGAWHXON-INIZCTEOSA-N 1 2 317.408 4.449 20 0 DIADLO C[C@H](c1noc([C@H]2CCC[N@@H+]2Cc2ccc(F)cc2)n1)C1CC1 ZINC000438241117 338337701 /nfs/dbraw/zinc/33/77/01/338337701.db2.gz QNNVUNBYZPUUOG-BLLLJJGKSA-N 1 2 315.392 4.059 20 0 DIADLO C[C@H](c1noc([C@H]2CCC[N@H+]2Cc2ccc(F)cc2)n1)C1CC1 ZINC000438241117 338337702 /nfs/dbraw/zinc/33/77/02/338337702.db2.gz QNNVUNBYZPUUOG-BLLLJJGKSA-N 1 2 315.392 4.059 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3C[C@H](C)O[C@@H](C)[C@@H]3C)cs2)cc1 ZINC000438366078 338341480 /nfs/dbraw/zinc/34/14/80/338341480.db2.gz UNKXVJWWARSZEY-KKUMJFAQSA-N 1 2 316.470 4.116 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3C[C@H](C)O[C@@H](C)[C@@H]3C)cs2)cc1 ZINC000438366078 338341481 /nfs/dbraw/zinc/34/14/81/338341481.db2.gz UNKXVJWWARSZEY-KKUMJFAQSA-N 1 2 316.470 4.116 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@H](c3cccc(Cl)c3)OC[C@@H]2C)nc1 ZINC000438546715 338347589 /nfs/dbraw/zinc/34/75/89/338347589.db2.gz MWZXIZWLGGYTBA-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@H](c3cccc(Cl)c3)OC[C@@H]2C)nc1 ZINC000438546715 338347590 /nfs/dbraw/zinc/34/75/90/338347590.db2.gz MWZXIZWLGGYTBA-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccoc1C[N@H+]1C[C@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000438553586 338347826 /nfs/dbraw/zinc/34/78/26/338347826.db2.gz LNHYMFMATWGCBC-SUMWQHHRSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccoc1C[N@@H+]1C[C@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000438553586 338347827 /nfs/dbraw/zinc/34/78/27/338347827.db2.gz LNHYMFMATWGCBC-SUMWQHHRSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccoc1C[N@H+]1C[C@@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000438553584 338347856 /nfs/dbraw/zinc/34/78/56/338347856.db2.gz LNHYMFMATWGCBC-GUYCJALGSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccoc1C[N@@H+]1C[C@@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000438553584 338347857 /nfs/dbraw/zinc/34/78/57/338347857.db2.gz LNHYMFMATWGCBC-GUYCJALGSA-N 1 2 305.805 4.203 20 0 DIADLO CC[N@H+](CCCNC(=O)Nc1cscc1C)c1ccccc1 ZINC000439474071 338370782 /nfs/dbraw/zinc/37/07/82/338370782.db2.gz BGGZSUPXILLLGY-UHFFFAOYSA-N 1 2 317.458 4.095 20 0 DIADLO CC[N@@H+](CCCNC(=O)Nc1cscc1C)c1ccccc1 ZINC000439474071 338370783 /nfs/dbraw/zinc/37/07/83/338370783.db2.gz BGGZSUPXILLLGY-UHFFFAOYSA-N 1 2 317.458 4.095 20 0 DIADLO C[C@@H](SCc1c[nH+]cn1C)c1ccc(OC(F)(F)F)cc1 ZINC000439546595 338372853 /nfs/dbraw/zinc/37/28/53/338372853.db2.gz WICYLJVBNADTBD-SNVBAGLBSA-N 1 2 316.348 4.313 20 0 DIADLO Cn1c[nH+]cc1COc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000439553092 338372952 /nfs/dbraw/zinc/37/29/52/338372952.db2.gz XEXVCNUORQHRBF-UHFFFAOYSA-N 1 2 324.224 4.037 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ncnc4c5ccccc5oc43)ccc21 ZINC000439706323 338376285 /nfs/dbraw/zinc/37/62/85/338376285.db2.gz NSALTGSBXIWJSV-UHFFFAOYSA-N 1 2 315.336 4.006 20 0 DIADLO CC(C)c1ncc(C[N@H+](C)[C@H](C)c2ccccc2Cl)cn1 ZINC000440475523 338388173 /nfs/dbraw/zinc/38/81/73/338388173.db2.gz DSGGJPRZYSDNLV-CYBMUJFWSA-N 1 2 303.837 4.446 20 0 DIADLO CC(C)c1ncc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)cn1 ZINC000440475523 338388174 /nfs/dbraw/zinc/38/81/74/338388174.db2.gz DSGGJPRZYSDNLV-CYBMUJFWSA-N 1 2 303.837 4.446 20 0 DIADLO Cc1cccc(Oc2ccccc2C(=O)Nc2cc[nH+]cc2C)c1 ZINC000440480800 338388280 /nfs/dbraw/zinc/38/82/80/338388280.db2.gz SKMORVMRYNUSNT-UHFFFAOYSA-N 1 2 318.376 4.165 20 0 DIADLO CC[C@H](F)C[N@@H+]1CCCC[C@H]1c1nc(-c2cccc(F)c2)c[nH]1 ZINC000440500171 338388636 /nfs/dbraw/zinc/38/86/36/338388636.db2.gz YJMIUGNMEUQFPD-YOEHRIQHSA-N 1 2 319.399 4.491 20 0 DIADLO CC[C@H](F)C[N@H+]1CCCC[C@H]1c1nc(-c2cccc(F)c2)c[nH]1 ZINC000440500171 338388637 /nfs/dbraw/zinc/38/86/37/338388637.db2.gz YJMIUGNMEUQFPD-YOEHRIQHSA-N 1 2 319.399 4.491 20 0 DIADLO Cc1ccc(/C=C\CC(=O)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC000440526445 338389207 /nfs/dbraw/zinc/38/92/07/338389207.db2.gz MIUMQWQYICPBRK-PLNGDYQASA-N 1 2 317.392 4.223 20 0 DIADLO Cc1cn2cc(NC(=O)CC[C@H](C)c3ccccc3)ccc2[nH+]1 ZINC000440784678 338397330 /nfs/dbraw/zinc/39/73/30/338397330.db2.gz NMLQFDZGUKCVET-AWEZNQCLSA-N 1 2 307.397 4.165 20 0 DIADLO CC[C@@H](C)CC(=O)N(Cc1[nH]cc[nH+]1)c1cc(C)ccc1Cl ZINC000440870373 338398916 /nfs/dbraw/zinc/39/89/16/338398916.db2.gz CQJNHJPGMAVGRQ-GFCCVEGCSA-N 1 2 319.836 4.341 20 0 DIADLO Cc1ccc(Cl)c(N(Cc2[nH]cc[nH+]2)C(=O)CC2(C)CC2)c1 ZINC000440907736 338399735 /nfs/dbraw/zinc/39/97/35/338399735.db2.gz XZJYWWSUOAAAPW-UHFFFAOYSA-N 1 2 317.820 4.095 20 0 DIADLO CCn1c(C)cc(C(=O)C[N@H+]([C@H](C)c2ccco2)C2CC2)c1C ZINC000440910153 338399771 /nfs/dbraw/zinc/39/97/71/338399771.db2.gz QBLRFWMBECSZJM-OAHLLOKOSA-N 1 2 314.429 4.126 20 0 DIADLO CCn1c(C)cc(C(=O)C[N@@H+]([C@H](C)c2ccco2)C2CC2)c1C ZINC000440910153 338399772 /nfs/dbraw/zinc/39/97/72/338399772.db2.gz QBLRFWMBECSZJM-OAHLLOKOSA-N 1 2 314.429 4.126 20 0 DIADLO COc1ccc(CNc2ccc(C)[nH+]c2C)c(Br)c1 ZINC000336811357 338401494 /nfs/dbraw/zinc/40/14/94/338401494.db2.gz MNTMMECMZRKTQC-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)[C@@H]2CC=CCC2)c1C(C)C ZINC000441572697 338416931 /nfs/dbraw/zinc/41/69/31/338416931.db2.gz YDMUXHOKEORNAM-OAHLLOKOSA-N 1 2 308.425 4.383 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+]C1CCC(C(F)F)CC1 ZINC000442862496 338435704 /nfs/dbraw/zinc/43/57/04/338435704.db2.gz AORLSGSZNKNLJD-UHFFFAOYSA-N 1 2 324.415 4.067 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@H](C(C)C)C2)cc1Oc1cc[nH+]cc1 ZINC000446340708 338526092 /nfs/dbraw/zinc/52/60/92/338526092.db2.gz HTJXNOMBBGDFBY-KRWDZBQOSA-N 1 2 324.424 4.300 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)c(C)c2)c(C)[nH+]1 ZINC000446432946 338527969 /nfs/dbraw/zinc/52/79/69/338527969.db2.gz MMXOFJWFXDOHQF-CYBMUJFWSA-N 1 2 318.804 4.066 20 0 DIADLO Clc1cc(Cl)cc(CCSCCn2cc[nH+]c2)c1 ZINC000446695509 338532485 /nfs/dbraw/zinc/53/24/85/338532485.db2.gz FDQOBYQSIWJXQJ-UHFFFAOYSA-N 1 2 301.242 4.166 20 0 DIADLO Cc1cnc(C[NH2+]C2(c3c(Cl)cccc3Cl)CCC2)cn1 ZINC000447057102 338543849 /nfs/dbraw/zinc/54/38/49/338543849.db2.gz BWECVLVODDCZNK-UHFFFAOYSA-N 1 2 322.239 4.261 20 0 DIADLO Cc1ccc(NC(=O)N[C@H](c2ccccc2C)C2CC2)c(C)[nH+]1 ZINC000447166621 338546702 /nfs/dbraw/zinc/54/67/02/338546702.db2.gz LOUXIVUESZOJKF-SFHVURJKSA-N 1 2 309.413 4.280 20 0 DIADLO Cc1cc(C)cc(C[C@@H](C)NC(=O)Nc2ccc(C)[nH+]c2C)c1 ZINC000447179962 338547081 /nfs/dbraw/zinc/54/70/81/338547081.db2.gz CEWFOJOCWZNHCL-OAHLLOKOSA-N 1 2 311.429 4.068 20 0 DIADLO COc1cc(NCc2[nH+]ccn2C(C)C)ccc1C(F)(F)F ZINC000447888162 338570301 /nfs/dbraw/zinc/57/03/01/338570301.db2.gz IYZGYWSPCYTBOB-UHFFFAOYSA-N 1 2 313.323 4.104 20 0 DIADLO COc1cc(C)ccc1C[NH2+][C@@H](COCC(C)C)c1ccco1 ZINC000449109397 338594365 /nfs/dbraw/zinc/59/43/65/338594365.db2.gz WIGXPSBZLHLIEY-KRWDZBQOSA-N 1 2 317.429 4.100 20 0 DIADLO c1cc(N2CCCC2)[nH+]cc1CNc1ccc2c(c1)CCCC2 ZINC000449413189 338622243 /nfs/dbraw/zinc/62/22/43/338622243.db2.gz QPUORPPXDRCLEU-UHFFFAOYSA-N 1 2 307.441 4.173 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)o2)c2nccn21 ZINC000449575410 338639482 /nfs/dbraw/zinc/63/94/82/338639482.db2.gz XUYKUADSUGVMNV-BLLLJJGKSA-N 1 2 311.360 4.078 20 0 DIADLO CCCc1ncc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)o1 ZINC000449610525 338640896 /nfs/dbraw/zinc/64/08/96/338640896.db2.gz HAAKZEWRGJFKRR-UHFFFAOYSA-N 1 2 312.369 4.302 20 0 DIADLO CCCc1ncc(C[NH2+]Cc2csc(Cl)c2Cl)o1 ZINC000449613486 338641080 /nfs/dbraw/zinc/64/10/80/338641080.db2.gz SAQLFZOSYZPTTP-UHFFFAOYSA-N 1 2 305.230 4.285 20 0 DIADLO Cc1nn(C)cc1[C@H](C)Nc1cc[nH+]c2cc(F)c(Cl)cc12 ZINC000450309135 338676797 /nfs/dbraw/zinc/67/67/97/338676797.db2.gz QYZHRANIWNTKST-VIFPVBQESA-N 1 2 318.783 4.242 20 0 DIADLO COc1cccc2c1cc[nH+]c2N[C@@H]1CCCC12CCOCC2 ZINC000450507292 338688617 /nfs/dbraw/zinc/68/86/17/338688617.db2.gz QNDUBHTVSGEUEB-QGZVFWFLSA-N 1 2 312.413 4.005 20 0 DIADLO C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)N1c1cc[nH+]c2ccncc21 ZINC000450559461 338690954 /nfs/dbraw/zinc/69/09/54/338690954.db2.gz DOWUERNPYHNMKS-QJPTWQEYSA-N 1 2 309.335 4.186 20 0 DIADLO Cc1cc(N2CC[C@@H](C(F)(F)F)C[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000450714920 338700690 /nfs/dbraw/zinc/70/06/90/338700690.db2.gz YNHNPSVJQGARNN-NWDGAFQWSA-N 1 2 301.356 4.076 20 0 DIADLO COc1ccc2oc([C@H](C)[NH2+][C@@H](C)c3csnn3)c(C)c2c1 ZINC000450729066 338701905 /nfs/dbraw/zinc/70/19/05/338701905.db2.gz NQAONRVFQZSEKW-QWRGUYRKSA-N 1 2 317.414 4.013 20 0 DIADLO CC[C@@H]1C[C@]1([NH2+]Cc1nnc(C2CC2)s1)c1cccc(C)c1 ZINC000450924322 338712676 /nfs/dbraw/zinc/71/26/76/338712676.db2.gz UFEWFNLDDCGJPG-RDTXWAMCSA-N 1 2 313.470 4.139 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@]2(c3ccc(Cl)cc3)C[C@H]2C)s1 ZINC000450931936 338713026 /nfs/dbraw/zinc/71/30/26/338713026.db2.gz YYLQAJIZAZNZJG-BZNIZROVSA-N 1 2 321.877 4.340 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@@H](C)c2cccc(C)c2)n1 ZINC000452088422 338753308 /nfs/dbraw/zinc/75/33/08/338753308.db2.gz OXDMNHSJHUNGIT-QWHCGFSZSA-N 1 2 305.447 4.043 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@H]2CCn3ccnc32)c2ccccc2)cc1 ZINC000453054610 338788108 /nfs/dbraw/zinc/78/81/08/338788108.db2.gz HTISBGQFVHAMAP-RBUKOAKNSA-N 1 2 303.409 4.016 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](CC(F)(F)F)c1ccccc1 ZINC000453059479 338788580 /nfs/dbraw/zinc/78/85/80/338788580.db2.gz KZKLSZPRQVMPOC-OCCSQVGLSA-N 1 2 311.351 4.247 20 0 DIADLO C[C@H]1C[C@H]([NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)c2nccn21 ZINC000453160307 338801034 /nfs/dbraw/zinc/80/10/34/338801034.db2.gz FKQUNSKELVBFGQ-HZMBPMFUSA-N 1 2 322.239 4.475 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)c2nccn21 ZINC000453160309 338801036 /nfs/dbraw/zinc/80/10/36/338801036.db2.gz FKQUNSKELVBFGQ-QMTHXVAHSA-N 1 2 322.239 4.475 20 0 DIADLO CCC(C)(C)OCc1cccc(N[C@@H]2CCn3cc[nH+]c32)c1C ZINC000453160958 338801107 /nfs/dbraw/zinc/80/11/07/338801107.db2.gz HMBXHMUNCVMLBB-QGZVFWFLSA-N 1 2 313.445 4.454 20 0 DIADLO CC[C@@H]1C[C@H]1c1nc(Cn2c3ccccc3[nH+]c2C(C)C)no1 ZINC000453172985 338802557 /nfs/dbraw/zinc/80/25/57/338802557.db2.gz HUXAUTBYFLYPMN-CHWSQXEVSA-N 1 2 310.401 4.105 20 0 DIADLO CC[C@@H](C)n1ncc(N[C@@H](C)c2[nH+]ccn2CC)c1C1CC1 ZINC000453183854 338804068 /nfs/dbraw/zinc/80/40/68/338804068.db2.gz OUQFFBIDYMVXHV-OLZOCXBDSA-N 1 2 301.438 4.121 20 0 DIADLO Cc1csc(-c2cccc(N[C@@H]3C[C@@H](C)n4cc[nH+]c43)c2)n1 ZINC000453186215 338804485 /nfs/dbraw/zinc/80/44/85/338804485.db2.gz MGTGITWOFZKASB-IUODEOHRSA-N 1 2 310.426 4.433 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)Nc1cc(Cc2ccccn2)ccc1C ZINC000453208408 338808185 /nfs/dbraw/zinc/80/81/85/338808185.db2.gz HCJOHXRDCSONOR-MRXNPFEDSA-N 1 2 320.440 4.370 20 0 DIADLO Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+][C@@H](C)C(C)(F)F ZINC000453283843 338818385 /nfs/dbraw/zinc/81/83/85/338818385.db2.gz IQFGRQLCPGICJC-KOLCDFICSA-N 1 2 311.401 4.208 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nn(C)cc1Cl)c1cc2ccccc2o1 ZINC000453316142 338823456 /nfs/dbraw/zinc/82/34/56/338823456.db2.gz HZSHHAWCRLIUHC-KRWDZBQOSA-N 1 2 317.820 4.307 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000453327613 338825424 /nfs/dbraw/zinc/82/54/24/338825424.db2.gz WGZBCHWBXDQMHU-ZDUSSCGKSA-N 1 2 321.852 4.103 20 0 DIADLO CC[C@H]([NH2+]Cc1ncccc1OC)c1cccc(Cl)c1F ZINC000453349505 338829320 /nfs/dbraw/zinc/82/93/20/338829320.db2.gz DBTFEJHGTSZDPW-ZDUSSCGKSA-N 1 2 308.784 4.124 20 0 DIADLO COc1ccc([C@@H]([NH2+][C@@H](C)c2cncc(C)c2)c2ccco2)cc1 ZINC000453391838 338836964 /nfs/dbraw/zinc/83/69/64/338836964.db2.gz DONFBRJFOIMNMQ-MGPUTAFESA-N 1 2 322.408 4.432 20 0 DIADLO COc1ccc([C@@H]([NH2+][C@H](C)c2cncc(C)c2)c2ccco2)cc1 ZINC000453391836 338837024 /nfs/dbraw/zinc/83/70/24/338837024.db2.gz DONFBRJFOIMNMQ-FOIQADDNSA-N 1 2 322.408 4.432 20 0 DIADLO COc1ccc([C@@H]([NH2+][C@@H](C)c2cnccc2C)c2ccco2)cc1 ZINC000453393676 338837317 /nfs/dbraw/zinc/83/73/17/338837317.db2.gz FSVANMZIVYOANG-MGPUTAFESA-N 1 2 322.408 4.432 20 0 DIADLO c1oc(SCc2cn3ccccc3[nH+]2)nc1-c1ccccc1 ZINC000195102147 338852117 /nfs/dbraw/zinc/85/21/17/338852117.db2.gz KLRKOWVTJQUMGA-UHFFFAOYSA-N 1 2 307.378 4.282 20 0 DIADLO Cc1cc(C)c(NC(=O)NC2CC(C)(c3ccccc3)C2)c(C)[nH+]1 ZINC000455465890 338895269 /nfs/dbraw/zinc/89/52/69/338895269.db2.gz FKPANAQIQBDHDM-UHFFFAOYSA-N 1 2 323.440 4.249 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@@H](C)c2ccccc2F)c(C)[nH+]1 ZINC000455478846 338895802 /nfs/dbraw/zinc/89/58/02/338895802.db2.gz MYWXRPGGLDEXNN-AWEZNQCLSA-N 1 2 315.392 4.371 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2c3ccccc3C[C@@H]2C)c(C)[nH+]1 ZINC000455487565 338896293 /nfs/dbraw/zinc/89/62/93/338896293.db2.gz SUVWCLQNPGOXNN-KPZWWZAWSA-N 1 2 309.413 4.062 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](C)Cc2ccccc2C)c(C)[nH+]1 ZINC000455491195 338896489 /nfs/dbraw/zinc/89/64/89/338896489.db2.gz YAYBVUZXIZSXLS-OAHLLOKOSA-N 1 2 311.429 4.068 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@]3(CC[C@H](C)C3)C2)c(C)[nH+]1 ZINC000455508396 338897120 /nfs/dbraw/zinc/89/71/20/338897120.db2.gz ZSUGGNWECREOMB-SGTLLEGYSA-N 1 2 301.434 4.051 20 0 DIADLO CCC[C@@]1(C)CCCN(C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000455507183 338897146 /nfs/dbraw/zinc/89/71/46/338897146.db2.gz YQNGOVVATLMLGM-SFHVURJKSA-N 1 2 303.450 4.441 20 0 DIADLO CCc1ccc(NC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1OC ZINC000455525572 338897805 /nfs/dbraw/zinc/89/78/05/338897805.db2.gz POJVPHCJTTXVHQ-UHFFFAOYSA-N 1 2 313.401 4.222 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccc(SC(C)C)cc2)c[nH+]1 ZINC000456864173 338944785 /nfs/dbraw/zinc/94/47/85/338944785.db2.gz RTNROOHJSSAXNJ-UHFFFAOYSA-N 1 2 314.454 4.129 20 0 DIADLO CC[C@@H](CC(F)F)C(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000457679770 338974757 /nfs/dbraw/zinc/97/47/57/338974757.db2.gz HFWQMZDARKOKDS-JTQLQIEISA-N 1 2 321.371 4.071 20 0 DIADLO CC(C)CCCCC(=O)N(C)[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000457833318 338980738 /nfs/dbraw/zinc/98/07/38/338980738.db2.gz YEXYJTYHLNNNJV-SFHVURJKSA-N 1 2 313.445 4.174 20 0 DIADLO CC(C)OC1CC([N@@H+]2CCn3c(cc4cc(Cl)ccc43)C2)C1 ZINC000459426939 339028535 /nfs/dbraw/zinc/02/85/35/339028535.db2.gz UJYCGZJJQPNCCG-UHFFFAOYSA-N 1 2 318.848 4.066 20 0 DIADLO CC(C)OC1CC([N@H+]2CCn3c(cc4cc(Cl)ccc43)C2)C1 ZINC000459426939 339028536 /nfs/dbraw/zinc/02/85/36/339028536.db2.gz UJYCGZJJQPNCCG-UHFFFAOYSA-N 1 2 318.848 4.066 20 0 DIADLO COCc1cc(C[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)no1 ZINC000459518660 339033850 /nfs/dbraw/zinc/03/38/50/339033850.db2.gz OUDQKZNYHBTLST-QGZVFWFLSA-N 1 2 320.820 4.202 20 0 DIADLO COCc1cc(C[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)no1 ZINC000459518660 339033851 /nfs/dbraw/zinc/03/38/51/339033851.db2.gz OUDQKZNYHBTLST-QGZVFWFLSA-N 1 2 320.820 4.202 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)o1 ZINC000459567716 339036377 /nfs/dbraw/zinc/03/63/77/339036377.db2.gz AECNHWIYEGIPCR-YOEHRIQHSA-N 1 2 311.429 4.310 20 0 DIADLO CCc1nnc([C@H](C)[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)o1 ZINC000459567716 339036378 /nfs/dbraw/zinc/03/63/78/339036378.db2.gz AECNHWIYEGIPCR-YOEHRIQHSA-N 1 2 311.429 4.310 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2Cc3sccc3CC2(C)C)cs1 ZINC000459572413 339036538 /nfs/dbraw/zinc/03/65/38/339036538.db2.gz AKHFKAWBIWTYFL-LLVKDONJSA-N 1 2 322.499 4.249 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2Cc3sccc3CC2(C)C)cs1 ZINC000459572413 339036539 /nfs/dbraw/zinc/03/65/39/339036539.db2.gz AKHFKAWBIWTYFL-LLVKDONJSA-N 1 2 322.499 4.249 20 0 DIADLO FC(F)(F)c1ncc(C[NH+]2CC(C3CCCCC3)C2)s1 ZINC000459584866 339037254 /nfs/dbraw/zinc/03/72/54/339037254.db2.gz AMJSTOMONRRGNJ-UHFFFAOYSA-N 1 2 304.381 4.174 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(F)c1Cl)c1nc2c(s1)CCC2 ZINC000459628912 339039135 /nfs/dbraw/zinc/03/91/35/339039135.db2.gz FZBMRVKGZWTONJ-SECBINFHSA-N 1 2 310.825 4.275 20 0 DIADLO CC1(CC(F)(F)F)C[NH+](Cc2cnc(C3CCC3)s2)C1 ZINC000459638095 339039728 /nfs/dbraw/zinc/03/97/28/339039728.db2.gz MWMOJFZGEOACDH-UHFFFAOYSA-N 1 2 304.381 4.185 20 0 DIADLO c1ccc([C@@H]2[N@H+](Cc3nc(C4CC4)no3)CC23CCCCC3)cc1 ZINC000459740380 339045536 /nfs/dbraw/zinc/04/55/36/339045536.db2.gz JMTDBPJTKOEMHK-SFHVURJKSA-N 1 2 323.440 4.454 20 0 DIADLO c1ccc([C@@H]2[N@@H+](Cc3nc(C4CC4)no3)CC23CCCCC3)cc1 ZINC000459740380 339045537 /nfs/dbraw/zinc/04/55/37/339045537.db2.gz JMTDBPJTKOEMHK-SFHVURJKSA-N 1 2 323.440 4.454 20 0 DIADLO CC[C@H](CC(=O)Nc1cccc2[nH+]ccn21)c1ccc(C)cc1 ZINC000460338457 339055629 /nfs/dbraw/zinc/05/56/29/339055629.db2.gz IPBUFGBWUBVNHS-OAHLLOKOSA-N 1 2 307.397 4.165 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ccc(C(F)F)cc1)C(=O)OC(C)(C)C ZINC000461371331 339062449 /nfs/dbraw/zinc/06/24/49/339062449.db2.gz LVRGJGXLLKPTHS-CQSZACIVSA-N 1 2 313.388 4.080 20 0 DIADLO CC(C)[N@H+](CC(=O)OC(C)(C)C)Cc1ccc(C(F)F)cc1 ZINC000461369075 339062460 /nfs/dbraw/zinc/06/24/60/339062460.db2.gz YZUBLENVQUNAEX-UHFFFAOYSA-N 1 2 313.388 4.176 20 0 DIADLO CC(C)[N@@H+](CC(=O)OC(C)(C)C)Cc1ccc(C(F)F)cc1 ZINC000461369075 339062461 /nfs/dbraw/zinc/06/24/61/339062461.db2.gz YZUBLENVQUNAEX-UHFFFAOYSA-N 1 2 313.388 4.176 20 0 DIADLO COc1ccc([C@H](Nc2cc[nH+]c(C)n2)c2ccc(C)cc2)cc1 ZINC000462378978 339077413 /nfs/dbraw/zinc/07/74/13/339077413.db2.gz GCEXBMMORFGNCW-HXUWFJFHSA-N 1 2 319.408 4.304 20 0 DIADLO CC(C)c1nc(N2CC[C@@H](CSc3ccccc3)C2)cc[nH+]1 ZINC000462936072 339098388 /nfs/dbraw/zinc/09/83/88/339098388.db2.gz NKJMGBKDKJRPNI-OAHLLOKOSA-N 1 2 313.470 4.219 20 0 DIADLO CCCC[C@@H](CC)C(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000463033914 339101999 /nfs/dbraw/zinc/10/19/99/339101999.db2.gz CUJZQWGZUKHOSH-HZPDHXFCSA-N 1 2 322.518 4.170 20 0 DIADLO CC[C@@H](CC(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1)C(C)C ZINC000463040383 339102746 /nfs/dbraw/zinc/10/27/46/339102746.db2.gz VGRWTNUDDNMRJY-HOTGVXAUSA-N 1 2 322.518 4.026 20 0 DIADLO CC(C)Oc1ccc(CNc2[nH+]cccc2OC(F)F)cc1 ZINC000463260038 339112486 /nfs/dbraw/zinc/11/24/86/339112486.db2.gz UJQZWBJBBTXQNB-UHFFFAOYSA-N 1 2 308.328 4.082 20 0 DIADLO FC1(F)CCC[C@@H](C[N@@H+]2CCn3c(cc4ccccc43)C2)C1 ZINC000463416483 339117084 /nfs/dbraw/zinc/11/70/84/339117084.db2.gz AFUQZFBDXFZIHI-CQSZACIVSA-N 1 2 304.384 4.282 20 0 DIADLO FC1(F)CCC[C@@H](C[N@H+]2CCn3c(cc4ccccc43)C2)C1 ZINC000463416483 339117085 /nfs/dbraw/zinc/11/70/85/339117085.db2.gz AFUQZFBDXFZIHI-CQSZACIVSA-N 1 2 304.384 4.282 20 0 DIADLO FC1(F)CCC[C@H](C[N@@H+]2CCn3c(cc4ccccc43)C2)C1 ZINC000463416482 339117103 /nfs/dbraw/zinc/11/71/03/339117103.db2.gz AFUQZFBDXFZIHI-AWEZNQCLSA-N 1 2 304.384 4.282 20 0 DIADLO FC1(F)CCC[C@H](C[N@H+]2CCn3c(cc4ccccc43)C2)C1 ZINC000463416482 339117104 /nfs/dbraw/zinc/11/71/04/339117104.db2.gz AFUQZFBDXFZIHI-AWEZNQCLSA-N 1 2 304.384 4.282 20 0 DIADLO CC(C)(C)OC(=O)C[N@@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000464723681 339149918 /nfs/dbraw/zinc/14/99/18/339149918.db2.gz CANDEPQPPNPLQS-LJQANCHMSA-N 1 2 323.436 4.128 20 0 DIADLO CC(C)(C)OC(=O)C[N@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000464723681 339149919 /nfs/dbraw/zinc/14/99/19/339149919.db2.gz CANDEPQPPNPLQS-LJQANCHMSA-N 1 2 323.436 4.128 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2nc(C(C)C)no2)o1 ZINC000464831956 339155999 /nfs/dbraw/zinc/15/59/99/339155999.db2.gz KZNFEMXYGBYGPR-HIFRSBDPSA-N 1 2 317.433 4.322 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2nc(C(C)C)no2)o1 ZINC000464831956 339156000 /nfs/dbraw/zinc/15/60/00/339156000.db2.gz KZNFEMXYGBYGPR-HIFRSBDPSA-N 1 2 317.433 4.322 20 0 DIADLO CSCCC[N@@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000464865428 339158970 /nfs/dbraw/zinc/15/89/70/339158970.db2.gz GGZQFRLJNDQUBZ-AWEZNQCLSA-N 1 2 320.285 4.120 20 0 DIADLO CSCCC[N@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000464865428 339158971 /nfs/dbraw/zinc/15/89/71/339158971.db2.gz GGZQFRLJNDQUBZ-AWEZNQCLSA-N 1 2 320.285 4.120 20 0 DIADLO CC(C)n1ccc(C[NH+]2CCC(=Cc3ccccc3F)CC2)n1 ZINC000464895029 339160787 /nfs/dbraw/zinc/16/07/87/339160787.db2.gz LZCQASMXQQMLSU-UHFFFAOYSA-N 1 2 313.420 4.283 20 0 DIADLO CCCc1nc(COc2cc[nH+]c3cc(OC)ccc32)cs1 ZINC000465012156 339165505 /nfs/dbraw/zinc/16/55/05/339165505.db2.gz DVOOMRPRFFOEAZ-UHFFFAOYSA-N 1 2 314.410 4.231 20 0 DIADLO CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000466444598 339205265 /nfs/dbraw/zinc/20/52/65/339205265.db2.gz AXXDWEPWLYIBSF-XLIONFOSSA-N 1 2 323.440 4.261 20 0 DIADLO CC(C)Cn1cc(CNc2[nH+]cccc2-c2ccccc2)cn1 ZINC000466620282 339210696 /nfs/dbraw/zinc/21/06/96/339210696.db2.gz SETWBCAZCRHIHV-UHFFFAOYSA-N 1 2 306.413 4.213 20 0 DIADLO Cn1cc(CNc2ccc(-c3ccccc3)c[nH+]2)c(C(C)(C)C)n1 ZINC000466619673 339210698 /nfs/dbraw/zinc/21/06/98/339210698.db2.gz KJYLZFTXXWKALT-UHFFFAOYSA-N 1 2 320.440 4.392 20 0 DIADLO COC(=O)[C@@H](c1ccccc1C)[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000466829576 339218477 /nfs/dbraw/zinc/21/84/77/339218477.db2.gz WGPQWSMFEBFDDQ-DLBZAZTESA-N 1 2 315.438 4.108 20 0 DIADLO COC(=O)[C@@H](c1ccccc1C)[N@H+]1CCC[C@H]1c1ccsc1 ZINC000466829576 339218478 /nfs/dbraw/zinc/21/84/78/339218478.db2.gz WGPQWSMFEBFDDQ-DLBZAZTESA-N 1 2 315.438 4.108 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCCC[C@@H]3c3ccco3)oc2c1 ZINC000466961749 339222897 /nfs/dbraw/zinc/22/28/97/339222897.db2.gz OPGNNMRJZRHDMT-CQSZACIVSA-N 1 2 300.333 4.287 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCCC[C@@H]3c3ccco3)oc2c1 ZINC000466961749 339222898 /nfs/dbraw/zinc/22/28/98/339222898.db2.gz OPGNNMRJZRHDMT-CQSZACIVSA-N 1 2 300.333 4.287 20 0 DIADLO CCC(=O)c1ccc(OCc2ccc3[nH]c(C)[nH+]c3c2)c(F)c1 ZINC000467207242 339228349 /nfs/dbraw/zinc/22/83/49/339228349.db2.gz MXIDGDWHFCUSLV-UHFFFAOYSA-N 1 2 312.344 4.182 20 0 DIADLO CCC(=O)c1ccc(OCc2ccc3[nH+]c(C)[nH]c3c2)c(F)c1 ZINC000467207242 339228350 /nfs/dbraw/zinc/22/83/50/339228350.db2.gz MXIDGDWHFCUSLV-UHFFFAOYSA-N 1 2 312.344 4.182 20 0 DIADLO c1cn(Cc2ccccc2)c(CN2CCC=Cc3ccccc32)[nH+]1 ZINC000467294227 339230215 /nfs/dbraw/zinc/23/02/15/339230215.db2.gz VTUPXMOWWACKMI-UHFFFAOYSA-N 1 2 315.420 4.355 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@H](Nc2cnn(CC(C)C)c2)C1 ZINC000467344121 339232745 /nfs/dbraw/zinc/23/27/45/339232745.db2.gz GLKOJPQXMCMFCV-IRXDYDNUSA-N 1 2 312.461 4.381 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@H](Nc2cccc3c2OCCO3)C1 ZINC000467354996 339233613 /nfs/dbraw/zinc/23/36/13/339233613.db2.gz NKVFLISQEDNYTM-HOTGVXAUSA-N 1 2 324.424 4.300 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@H](Nc2cccc3c2OCO3)C1 ZINC000467355016 339233640 /nfs/dbraw/zinc/23/36/40/339233640.db2.gz ORBHQSIROVFPQR-GJZGRUSLSA-N 1 2 310.397 4.257 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@@H](Nc2cccc3c2OCO3)C1 ZINC000467355019 339233704 /nfs/dbraw/zinc/23/37/04/339233704.db2.gz ORBHQSIROVFPQR-LSDHHAIUSA-N 1 2 310.397 4.257 20 0 DIADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@H](Nc2cn(C)nc2C(C)C)C1 ZINC000467365396 339234317 /nfs/dbraw/zinc/23/43/17/339234317.db2.gz PRMGSJOMMGCKBN-CVEARBPZSA-N 1 2 312.461 4.385 20 0 DIADLO CC[C@H]1CCCC[C@@H]1N(C)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000467469955 339239994 /nfs/dbraw/zinc/23/99/94/339239994.db2.gz ZYDKJYWWTWVKEZ-HOCLYGCPSA-N 1 2 314.433 4.075 20 0 DIADLO CCCCOc1ccccc1C[N@@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000468398533 339261990 /nfs/dbraw/zinc/26/19/90/339261990.db2.gz XJMBOGLUXYBMHR-KRWDZBQOSA-N 1 2 313.445 4.316 20 0 DIADLO CCCCOc1ccccc1C[N@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000468398533 339261991 /nfs/dbraw/zinc/26/19/91/339261991.db2.gz XJMBOGLUXYBMHR-KRWDZBQOSA-N 1 2 313.445 4.316 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)s1 ZINC000468689615 339268625 /nfs/dbraw/zinc/26/86/25/339268625.db2.gz LFXQTUSYBNCIQM-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)s1 ZINC000468689615 339268626 /nfs/dbraw/zinc/26/86/26/339268626.db2.gz LFXQTUSYBNCIQM-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO COc1ccc([C@H](C)[C@@H](C)[NH2+][C@@H](C(C)C)C(F)(F)F)cc1 ZINC000468797009 339271010 /nfs/dbraw/zinc/27/10/10/339271010.db2.gz CBHVRWHAJWIICI-JMSVASOKSA-N 1 2 303.368 4.364 20 0 DIADLO CC(C)(C(=O)Nc1ccc(Oc2ccccc2)cc1)c1c[nH+]c[nH]1 ZINC000468883288 339273557 /nfs/dbraw/zinc/27/35/57/339273557.db2.gz JCWLHAYWPBJNOQ-UHFFFAOYSA-N 1 2 321.380 4.118 20 0 DIADLO CC(C)(C(=O)Nc1ccc(Oc2ccccc2)cc1)c1c[nH]c[nH+]1 ZINC000468883288 339273558 /nfs/dbraw/zinc/27/35/58/339273558.db2.gz JCWLHAYWPBJNOQ-UHFFFAOYSA-N 1 2 321.380 4.118 20 0 DIADLO CCC1(CC)C[N@@H+]([C@H](C)c2cccc(Cl)c2)CC[S@]1=O ZINC000469443242 339289378 /nfs/dbraw/zinc/28/93/78/339289378.db2.gz UHIIMNJRBVHWEP-ZUOKHONESA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@H+]([C@H](C)c2cccc(Cl)c2)CC[S@]1=O ZINC000469443242 339289379 /nfs/dbraw/zinc/28/93/79/339289379.db2.gz UHIIMNJRBVHWEP-ZUOKHONESA-N 1 2 313.894 4.024 20 0 DIADLO Clc1ccc2oc(SCc3c[nH+]c4ccccn34)nc2c1 ZINC000469800592 339300994 /nfs/dbraw/zinc/30/09/94/339300994.db2.gz MCAWNRPOOMGUQO-UHFFFAOYSA-N 1 2 315.785 4.421 20 0 DIADLO CCCCn1c(C)c(C)nc1SCc1c[nH+]c2ccccn12 ZINC000469801783 339301110 /nfs/dbraw/zinc/30/11/10/339301110.db2.gz QJBJKADKDBEIHO-UHFFFAOYSA-N 1 2 314.458 4.240 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)[C@H](C)CCC(C)(C)C ZINC000469971898 339306173 /nfs/dbraw/zinc/30/61/73/339306173.db2.gz HDJLGMSVTGSWER-MRXNPFEDSA-N 1 2 321.509 4.147 20 0 DIADLO C[C@@H]1C[N@H+](CCO[C@@H]2CCCC[C@@H]2C)C[C@H](c2ccsc2)O1 ZINC000470200036 339313974 /nfs/dbraw/zinc/31/39/74/339313974.db2.gz IVZLLPWFLIHYEW-BURFUSLBSA-N 1 2 323.502 4.105 20 0 DIADLO C[C@@H]1C[N@@H+](CCO[C@@H]2CCCC[C@@H]2C)C[C@H](c2ccsc2)O1 ZINC000470200036 339313975 /nfs/dbraw/zinc/31/39/75/339313975.db2.gz IVZLLPWFLIHYEW-BURFUSLBSA-N 1 2 323.502 4.105 20 0 DIADLO FC(F)c1cccc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c1 ZINC000470718376 339326053 /nfs/dbraw/zinc/32/60/53/339326053.db2.gz RFJQNYWUZKLOFG-QGZVFWFLSA-N 1 2 303.352 4.198 20 0 DIADLO FC(F)c1cccc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)c1 ZINC000470718376 339326054 /nfs/dbraw/zinc/32/60/54/339326054.db2.gz RFJQNYWUZKLOFG-QGZVFWFLSA-N 1 2 303.352 4.198 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@@H+]1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000470910541 339330962 /nfs/dbraw/zinc/33/09/62/339330962.db2.gz ILBUEQUHIXZHQM-XHBSWPGZSA-N 1 2 324.262 4.009 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@H+]1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000470910541 339330963 /nfs/dbraw/zinc/33/09/63/339330963.db2.gz ILBUEQUHIXZHQM-XHBSWPGZSA-N 1 2 324.262 4.009 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)n1 ZINC000470937937 339331564 /nfs/dbraw/zinc/33/15/64/339331564.db2.gz QSHQTMPPBUDVIC-BXUZGUMPSA-N 1 2 303.372 4.017 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)n1 ZINC000470937937 339331565 /nfs/dbraw/zinc/33/15/65/339331565.db2.gz QSHQTMPPBUDVIC-BXUZGUMPSA-N 1 2 303.372 4.017 20 0 DIADLO Cc1cc(N(CCC(F)(F)F)CC2CC2)nc(C(C)C)[nH+]1 ZINC000471061621 339336099 /nfs/dbraw/zinc/33/60/99/339336099.db2.gz KJQLPAGQHJLAFR-UHFFFAOYSA-N 1 2 301.356 4.077 20 0 DIADLO Cc1cc(NC(=O)C(C)(C)C(F)F)ccc1Oc1cc[nH+]cc1 ZINC000471156439 339338929 /nfs/dbraw/zinc/33/89/29/339338929.db2.gz KNSPYUQHFPYDRQ-UHFFFAOYSA-N 1 2 320.339 4.412 20 0 DIADLO CC(C)(C)c1ccccc1NC(=O)C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000471169583 339339399 /nfs/dbraw/zinc/33/93/99/339339399.db2.gz POUKFWDNBFXANQ-LJQANCHMSA-N 1 2 322.452 4.370 20 0 DIADLO CC(C)(C)c1ccccc1NC(=O)C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000471169583 339339400 /nfs/dbraw/zinc/33/94/00/339339400.db2.gz POUKFWDNBFXANQ-LJQANCHMSA-N 1 2 322.452 4.370 20 0 DIADLO CCc1ccc(-c2noc(C[N@@H+]3CC[C@H]3c3ccccc3)n2)cc1 ZINC000471183243 339339922 /nfs/dbraw/zinc/33/99/22/339339922.db2.gz QSAUVYORYDNETL-SFHVURJKSA-N 1 2 319.408 4.246 20 0 DIADLO CCc1ccc(-c2noc(C[N@H+]3CC[C@H]3c3ccccc3)n2)cc1 ZINC000471183243 339339923 /nfs/dbraw/zinc/33/99/23/339339923.db2.gz QSAUVYORYDNETL-SFHVURJKSA-N 1 2 319.408 4.246 20 0 DIADLO C[NH+](C)[C@H](c1nc(C2CCCC2)no1)c1cccc(Cl)c1 ZINC000504286768 339358446 /nfs/dbraw/zinc/35/84/46/339358446.db2.gz UOQAUSSPXMYFIZ-AWEZNQCLSA-N 1 2 305.809 4.032 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(F)c(Cl)c1 ZINC000472070016 339362325 /nfs/dbraw/zinc/36/23/25/339362325.db2.gz MRDGVEAEXKSTLM-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO OCc1cccc(NCc2ccc(Sc3ccccc3)cc2)[nH+]1 ZINC000472577655 339374264 /nfs/dbraw/zinc/37/42/64/339374264.db2.gz BTDAPNAGVNQECS-UHFFFAOYSA-N 1 2 322.433 4.337 20 0 DIADLO Fc1cccc(Cl)c1CCC[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000472589775 339374617 /nfs/dbraw/zinc/37/46/17/339374617.db2.gz OQHVIJYMFVAETG-KRWDZBQOSA-N 1 2 323.795 4.078 20 0 DIADLO Fc1cccc(Cl)c1CCC[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000472589775 339374618 /nfs/dbraw/zinc/37/46/18/339374618.db2.gz OQHVIJYMFVAETG-KRWDZBQOSA-N 1 2 323.795 4.078 20 0 DIADLO Clc1cnc(C[N@@H+]2CCC[C@H](Cc3ccccc3)C2)s1 ZINC000473137367 339382004 /nfs/dbraw/zinc/38/20/04/339382004.db2.gz HNSRHIBUSAPZTE-CQSZACIVSA-N 1 2 306.862 4.251 20 0 DIADLO Clc1cnc(C[N@H+]2CCC[C@H](Cc3ccccc3)C2)s1 ZINC000473137367 339382005 /nfs/dbraw/zinc/38/20/05/339382005.db2.gz HNSRHIBUSAPZTE-CQSZACIVSA-N 1 2 306.862 4.251 20 0 DIADLO CC(C)[C@@H](NC(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1)c1[nH]cc[nH+]1 ZINC000473295975 339384214 /nfs/dbraw/zinc/38/42/14/339384214.db2.gz MKQPDCIBNNOULM-IIAWOOMASA-N 1 2 305.466 4.076 20 0 DIADLO C[C@H](CCn1c[nH+]c2cc(F)c(F)cc21)OCc1ccccc1 ZINC000473681353 339390293 /nfs/dbraw/zinc/39/02/93/339390293.db2.gz XMSXRALJAHKTFL-CYBMUJFWSA-N 1 2 316.351 4.310 20 0 DIADLO C[C@@H](Nc1cccc(-n2cc[nH+]c2)c1)C1CCC(F)(F)CC1 ZINC000474054983 339399500 /nfs/dbraw/zinc/39/95/00/339399500.db2.gz GCOWKYSBMHEIBN-CYBMUJFWSA-N 1 2 305.372 4.498 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1nccn1CC(C)C ZINC000474352910 339410573 /nfs/dbraw/zinc/41/05/73/339410573.db2.gz JDNYFHFRFDBWBM-UHFFFAOYSA-N 1 2 305.853 4.045 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1cn2cccc(C)c2n1 ZINC000474361488 339410936 /nfs/dbraw/zinc/41/09/36/339410936.db2.gz DLYOJQPDQUVYRH-UHFFFAOYSA-N 1 2 313.832 4.148 20 0 DIADLO CCCS(=O)(=O)Nc1ccc([NH2+][C@@H](C)C2CCCCC2)cc1 ZINC000474374902 339411491 /nfs/dbraw/zinc/41/14/91/339411491.db2.gz JYLQHKGJQHEMJV-AWEZNQCLSA-N 1 2 324.490 4.219 20 0 DIADLO Cc1nc(N2CCC(=Cc3cccc(F)c3)CC2)c(C)c(C)[nH+]1 ZINC000474779323 339425709 /nfs/dbraw/zinc/42/57/09/339425709.db2.gz HWCXDMVTRKQYCL-UHFFFAOYSA-N 1 2 311.404 4.225 20 0 DIADLO Cc1ccc(CCCNc2ccc(F)cc2OC(C)C)c[nH+]1 ZINC000474925166 339431329 /nfs/dbraw/zinc/43/13/29/339431329.db2.gz JRBSGMDVEZGTOX-UHFFFAOYSA-N 1 2 302.393 4.361 20 0 DIADLO CCn1c(C(=O)Nc2c(C)cc(C)[nH+]c2C)cc2ccccc21 ZINC000477266607 339490797 /nfs/dbraw/zinc/49/07/97/339490797.db2.gz FIXYQNJOVMDVPS-UHFFFAOYSA-N 1 2 307.397 4.234 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H](C)c1ccccc1F ZINC000478001799 339506930 /nfs/dbraw/zinc/50/69/30/339506930.db2.gz WXKYGKALLFTPNY-CYBMUJFWSA-N 1 2 323.371 4.266 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)[C@H]2[C@@H]3CCC[C@@H]32)c1 ZINC000478621789 339519478 /nfs/dbraw/zinc/51/94/78/339519478.db2.gz LBZIVSGEOZHNNL-PIIMJCKOSA-N 1 2 323.440 4.335 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H](C)c1nc2c(s1)CCC2 ZINC000479295740 339530668 /nfs/dbraw/zinc/53/06/68/339530668.db2.gz LWDFRQVILVMGMP-SNVBAGLBSA-N 1 2 322.861 4.145 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@@H](C)c2ccc(F)cn2)c2ccccn2)cc1 ZINC000479463787 339536327 /nfs/dbraw/zinc/53/63/27/339536327.db2.gz GJCMOHJLLOGFHQ-YWZLYKJASA-N 1 2 321.399 4.364 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCCOC(C)(C)C ZINC000479518181 339539048 /nfs/dbraw/zinc/53/90/48/339539048.db2.gz QFGJFEJMQPQKKI-UHFFFAOYSA-N 1 2 304.459 4.229 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccc(Cl)cn1 ZINC000480194500 339562884 /nfs/dbraw/zinc/56/28/84/339562884.db2.gz HXAZSFMMGYWNAH-LKFCYVNXSA-N 1 2 309.196 4.173 20 0 DIADLO CCCOc1cc(C)ccc1NCc1ccc(N(C)CC)[nH+]c1 ZINC000480275321 339566784 /nfs/dbraw/zinc/56/67/84/339566784.db2.gz PXJBHERYWUGDHQ-UHFFFAOYSA-N 1 2 313.445 4.247 20 0 DIADLO c1cn(-c2cccc(NCc3ccc(OCC4CC4)cc3)c2)c[nH+]1 ZINC000480301074 339567948 /nfs/dbraw/zinc/56/79/48/339567948.db2.gz NALZKYVAADQUMU-UHFFFAOYSA-N 1 2 319.408 4.273 20 0 DIADLO Clc1sccc1C[NH2+]Cc1nnc(-c2ccccc2)s1 ZINC000480354361 339570155 /nfs/dbraw/zinc/57/01/55/339570155.db2.gz JJXOKKSPGOZSSA-UHFFFAOYSA-N 1 2 321.858 4.210 20 0 DIADLO CC(C)Oc1ccccc1NCc1ccc(N(C)C(C)C)[nH+]c1 ZINC000480363076 339570581 /nfs/dbraw/zinc/57/05/81/339570581.db2.gz LBTGIYIBJBVBJK-UHFFFAOYSA-N 1 2 313.445 4.326 20 0 DIADLO Cc1cc(NC2CCN(c3cccc[nH+]3)CC2)ccc1C1CC1 ZINC000482317867 339629338 /nfs/dbraw/zinc/62/93/38/339629338.db2.gz XYGQTIMTGCMKDZ-UHFFFAOYSA-N 1 2 307.441 4.348 20 0 DIADLO Cc1ccn2cc(C[NH2+][C@@H](C)c3ccc(F)cc3Cl)nc2c1 ZINC000482513773 339634316 /nfs/dbraw/zinc/63/43/16/339634316.db2.gz SUENREKETUORBU-LBPRGKRZSA-N 1 2 317.795 4.286 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000483646650 339670596 /nfs/dbraw/zinc/67/05/96/339670596.db2.gz AGAQBSBVNQILCW-LLVKDONJSA-N 1 2 321.852 4.434 20 0 DIADLO COc1ccc(Cl)c(C[NH2+][C@H](C)c2c(F)cccc2F)c1 ZINC000484101713 339680896 /nfs/dbraw/zinc/68/08/96/339680896.db2.gz QOFZSCBZAAPXQC-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F ZINC000485452452 339703515 /nfs/dbraw/zinc/70/35/15/339703515.db2.gz PEXSCLKZTBZVLP-NSHDSACASA-N 1 2 317.355 4.187 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@@H](C(C)(C)C)C[C@@H]1C ZINC000485458820 339703666 /nfs/dbraw/zinc/70/36/66/339703666.db2.gz RSBLGLSLJBBHGK-DZGCQCFKSA-N 1 2 303.450 4.377 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCc1cc2ccccc2s1 ZINC000485554916 339705562 /nfs/dbraw/zinc/70/55/62/339705562.db2.gz VVHHCMIGPGSAMO-UHFFFAOYSA-N 1 2 311.410 4.235 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1cccc2[nH]ccc21)C(=O)OC(C)(C)C ZINC000486406339 339726711 /nfs/dbraw/zinc/72/67/11/339726711.db2.gz NEMWYYJXKKDSJC-QGZVFWFLSA-N 1 2 316.445 4.014 20 0 DIADLO Clc1cc2c(s1)CCC[C@@H]2Nc1cc[nH+]c2ccncc12 ZINC000488724847 339791439 /nfs/dbraw/zinc/79/14/39/339791439.db2.gz ZPXFLKOJFNEQFC-ZDUSSCGKSA-N 1 2 315.829 4.256 20 0 DIADLO Cn1c2ccc(NC(=O)C[C@H]3C=CCCC3)cc2[nH+]c1C1CC1 ZINC000489645332 339815034 /nfs/dbraw/zinc/81/50/34/339815034.db2.gz NKDXDGSNLSEOKS-ZDUSSCGKSA-N 1 2 309.413 4.136 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)C=CCc1ccc(C(C)C)cc1 ZINC000489983221 339822952 /nfs/dbraw/zinc/82/29/52/339822952.db2.gz RGXMUYQUJXHUIY-WAYWQWQTSA-N 1 2 308.425 4.231 20 0 DIADLO CCCc1csc(C[NH2+]Cc2nc(C(C)(C)C)cs2)n1 ZINC000494041164 339939543 /nfs/dbraw/zinc/93/95/43/339939543.db2.gz ZSENOXOAPATWRV-UHFFFAOYSA-N 1 2 309.504 4.139 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(C(F)F)n1)c1cc(Cl)ccc1Cl ZINC000494230600 339944196 /nfs/dbraw/zinc/94/41/96/339944196.db2.gz LJZGCPXFCDCHSY-QMMMGPOBSA-N 1 2 320.170 4.436 20 0 DIADLO CC[C@@H](C)Oc1ccc(C(=O)Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC000495094510 339973950 /nfs/dbraw/zinc/97/39/50/339973950.db2.gz QLNOLEQRCDUSMA-CQSZACIVSA-N 1 2 323.396 4.072 20 0 DIADLO CC1(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)CCCCC1 ZINC000496411963 340004964 /nfs/dbraw/zinc/00/49/64/340004964.db2.gz PCZVZBSSMOWMKC-UHFFFAOYSA-N 1 2 310.397 4.327 20 0 DIADLO CCc1cc(N2CC[C@H]2c2ccccc2)nc(-c2ccncc2)[nH+]1 ZINC000498841418 340024195 /nfs/dbraw/zinc/02/41/95/340024195.db2.gz WHOBMKRXHWUQAI-SFHVURJKSA-N 1 2 316.408 4.052 20 0 DIADLO C[N@H+](Cc1ccc(Oc2ccccc2)nn1)Cc1ccccc1F ZINC000498953540 340026919 /nfs/dbraw/zinc/02/69/19/340026919.db2.gz BSZXEYDKXQCTDE-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[N@@H+](Cc1ccc(Oc2ccccc2)nn1)Cc1ccccc1F ZINC000498953540 340026920 /nfs/dbraw/zinc/02/69/20/340026920.db2.gz BSZXEYDKXQCTDE-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000499552970 340039292 /nfs/dbraw/zinc/03/92/92/340039292.db2.gz OJAWLIMZIGBCPK-KRWDZBQOSA-N 1 2 324.428 4.332 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000499552970 340039293 /nfs/dbraw/zinc/03/92/93/340039293.db2.gz OJAWLIMZIGBCPK-KRWDZBQOSA-N 1 2 324.428 4.332 20 0 DIADLO Cc1cccc2oc(CCNc3cc(C(F)(F)F)cc[nH+]3)nc21 ZINC000499902060 340046773 /nfs/dbraw/zinc/04/67/73/340046773.db2.gz DAJGVONZVXTPSA-UHFFFAOYSA-N 1 2 321.302 4.205 20 0 DIADLO CCC[C@@H](C)CC(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC000500004160 340048488 /nfs/dbraw/zinc/04/84/88/340048488.db2.gz HNAGDGMOYUDQSU-KGLIPLIRSA-N 1 2 323.506 4.140 20 0 DIADLO CCC[C@@H](C)CC(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC000500004160 340048489 /nfs/dbraw/zinc/04/84/89/340048489.db2.gz HNAGDGMOYUDQSU-KGLIPLIRSA-N 1 2 323.506 4.140 20 0 DIADLO FC1(c2ccc(Cl)cc2)CC[NH+](Cc2cscn2)CC1 ZINC000500149098 340051265 /nfs/dbraw/zinc/05/12/65/340051265.db2.gz BCZVVNFLJCMBMP-UHFFFAOYSA-N 1 2 310.825 4.257 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2Sc2ccccc2)cc[nH+]1 ZINC000500315743 340055034 /nfs/dbraw/zinc/05/50/34/340055034.db2.gz IISJHRZTKXWACY-UHFFFAOYSA-N 1 2 320.417 4.215 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1Cl ZINC000500398566 340056864 /nfs/dbraw/zinc/05/68/64/340056864.db2.gz RNGVKVYLJJONKQ-HNNXBMFYSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@H+]1Cc1cccc(Cl)c1Cl ZINC000500398566 340056865 /nfs/dbraw/zinc/05/68/65/340056865.db2.gz RNGVKVYLJJONKQ-HNNXBMFYSA-N 1 2 324.255 4.454 20 0 DIADLO CC(C)OC[C@H](C)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000500443530 340059004 /nfs/dbraw/zinc/05/90/04/340059004.db2.gz ZCWOXWKICIIQPC-HNNXBMFYSA-N 1 2 313.445 4.112 20 0 DIADLO Cc1ccc(CCCC(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000500735949 340066173 /nfs/dbraw/zinc/06/61/73/340066173.db2.gz CJCWPBAQKSLWPW-UHFFFAOYSA-N 1 2 319.408 4.142 20 0 DIADLO CCC[C@@H](C)[N@@H+]1CCO[C@H](c2cccc(Br)c2)C1 ZINC000501143340 340075061 /nfs/dbraw/zinc/07/50/61/340075061.db2.gz RCRCLTMYXJPZOF-DOMZBBRYSA-N 1 2 312.251 4.011 20 0 DIADLO CCC[C@@H](C)[N@H+]1CCO[C@H](c2cccc(Br)c2)C1 ZINC000501143340 340075062 /nfs/dbraw/zinc/07/50/62/340075062.db2.gz RCRCLTMYXJPZOF-DOMZBBRYSA-N 1 2 312.251 4.011 20 0 DIADLO Cc1ccc(Nc2nc(C[N@@H+]3CC[C@@](C)(F)C3)cs2)cc1 ZINC000501389188 340079849 /nfs/dbraw/zinc/07/98/49/340079849.db2.gz BHEFVGMCXARUOM-MRXNPFEDSA-N 1 2 305.422 4.129 20 0 DIADLO Cc1ccc(Nc2nc(C[N@H+]3CC[C@@](C)(F)C3)cs2)cc1 ZINC000501389188 340079850 /nfs/dbraw/zinc/07/98/50/340079850.db2.gz BHEFVGMCXARUOM-MRXNPFEDSA-N 1 2 305.422 4.129 20 0 DIADLO Fc1ccc(C2=CC[N@H+](Cc3cc(-c4ccco4)on3)CC2)cc1 ZINC000501575455 340084102 /nfs/dbraw/zinc/08/41/02/340084102.db2.gz ONURTOOOMBSCEN-UHFFFAOYSA-N 1 2 324.355 4.363 20 0 DIADLO Fc1ccc(C2=CC[N@@H+](Cc3cc(-c4ccco4)on3)CC2)cc1 ZINC000501575455 340084103 /nfs/dbraw/zinc/08/41/03/340084103.db2.gz ONURTOOOMBSCEN-UHFFFAOYSA-N 1 2 324.355 4.363 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1F)c1nc2c(s1)CCC2 ZINC000502017755 340092995 /nfs/dbraw/zinc/09/29/95/340092995.db2.gz ODMREHKHXGGUCV-NXEZZACHSA-N 1 2 308.397 4.322 20 0 DIADLO C/C(=C\c1ccccc1)C[NH2+]C1(c2noc(C)n2)CCCCC1 ZINC000502249128 340097684 /nfs/dbraw/zinc/09/76/84/340097684.db2.gz MROFGFXRNFOCMY-FYWRMAATSA-N 1 2 311.429 4.231 20 0 DIADLO c1cn(-c2cccc(N[C@@H]3CCC[C@H](c4cccnc4)C3)c2)c[nH+]1 ZINC000502472989 340105202 /nfs/dbraw/zinc/10/52/02/340105202.db2.gz BGUXHIOBHIZUHF-FUHWJXTLSA-N 1 2 318.424 4.406 20 0 DIADLO Cc1ccc(CCC(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(C)c1 ZINC000502539931 340107203 /nfs/dbraw/zinc/10/72/03/340107203.db2.gz UTDKIRHRZJGMTC-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO CCCc1ccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000502577200 340108209 /nfs/dbraw/zinc/10/82/09/340108209.db2.gz QJIFNTRDGUXQKK-UHFFFAOYSA-N 1 2 305.381 4.282 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](CN2CCCC2)c2ccccc2)oc1C ZINC000502694998 340110862 /nfs/dbraw/zinc/11/08/62/340110862.db2.gz CJGVIPWBRXOQPF-QFBILLFUSA-N 1 2 312.457 4.384 20 0 DIADLO Cc1cc(F)cc2c1C[N@H+](Cc1csc(C(C)C)n1)CC2 ZINC000502905869 340115919 /nfs/dbraw/zinc/11/59/19/340115919.db2.gz WXPGBWMFLPHFCU-UHFFFAOYSA-N 1 2 304.434 4.272 20 0 DIADLO Cc1cc(F)cc2c1C[N@@H+](Cc1csc(C(C)C)n1)CC2 ZINC000502905869 340115920 /nfs/dbraw/zinc/11/59/20/340115920.db2.gz WXPGBWMFLPHFCU-UHFFFAOYSA-N 1 2 304.434 4.272 20 0 DIADLO Cc1cc(F)cc2c1C[N@H+](Cc1ncccc1C(F)(F)F)CC2 ZINC000502944209 340117147 /nfs/dbraw/zinc/11/71/47/340117147.db2.gz OJNPJYLRIDENKT-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1cc(F)cc2c1C[N@@H+](Cc1ncccc1C(F)(F)F)CC2 ZINC000502944209 340117148 /nfs/dbraw/zinc/11/71/48/340117148.db2.gz OJNPJYLRIDENKT-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1cc(F)cc2c1C[N@H+](Cc1ncc(-c3ccccc3)o1)CC2 ZINC000502945611 340117295 /nfs/dbraw/zinc/11/72/95/340117295.db2.gz YMMQNEHODHAYGR-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1cc(F)cc2c1C[N@@H+](Cc1ncc(-c3ccccc3)o1)CC2 ZINC000502945611 340117296 /nfs/dbraw/zinc/11/72/96/340117296.db2.gz YMMQNEHODHAYGR-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO C[C@@H]1C[C@@]1([NH2+]Cc1nc(C(C)(C)C)no1)c1ccc(Cl)cc1 ZINC000503379255 340126825 /nfs/dbraw/zinc/12/68/25/340126825.db2.gz UVUSKQMDFLQHLI-DIFFPNOSSA-N 1 2 319.836 4.045 20 0 DIADLO CCCOc1cccc2c(N[C@@H]3C[C@@H]4OCCC[C@H]34)cc[nH+]c12 ZINC000503575675 340131377 /nfs/dbraw/zinc/13/13/77/340131377.db2.gz IJCDZKCNYRHYOV-QBIMZIAESA-N 1 2 312.413 4.003 20 0 DIADLO Fc1cc(-c2ccccc2)ccc1C[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000503580852 340131554 /nfs/dbraw/zinc/13/15/54/340131554.db2.gz GKLFVJWXUMETIJ-LJQANCHMSA-N 1 2 321.399 4.383 20 0 DIADLO Fc1cc(-c2ccccc2)ccc1C[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000503580852 340131555 /nfs/dbraw/zinc/13/15/55/340131555.db2.gz GKLFVJWXUMETIJ-LJQANCHMSA-N 1 2 321.399 4.383 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+]C2(C(F)F)CC2)cc1OC ZINC000503895427 340136062 /nfs/dbraw/zinc/13/60/62/340136062.db2.gz VNVAGUGEDRBPRN-LBPRGKRZSA-N 1 2 313.388 4.322 20 0 DIADLO Cc1[nH]ncc1C[NH2+]C1(c2ccc(C(F)(F)F)cc2)CCCC1 ZINC000503954229 340138677 /nfs/dbraw/zinc/13/86/77/340138677.db2.gz XHUXBXVIQNOJBF-UHFFFAOYSA-N 1 2 323.362 4.296 20 0 DIADLO Cc1cc(NC(=O)N(CC2CCC2)[C@H](C)c2ccccc2)cc[nH+]1 ZINC000504151802 340141762 /nfs/dbraw/zinc/14/17/62/340141762.db2.gz RZGOBEKCIIJIAV-MRXNPFEDSA-N 1 2 323.440 4.207 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc(Cc2ccccc2C)no1)c1ccccc1 ZINC000504223056 340143312 /nfs/dbraw/zinc/14/33/12/340143312.db2.gz MBKIOQHVAWEJHF-LJQANCHMSA-N 1 2 321.424 4.010 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc(Cc2ccccc2C)no1)c1ccccc1 ZINC000504223056 340143313 /nfs/dbraw/zinc/14/33/13/340143313.db2.gz MBKIOQHVAWEJHF-LJQANCHMSA-N 1 2 321.424 4.010 20 0 DIADLO C[NH+](C)[C@@H](c1nc(-c2ccccc2)no1)c1cccc(Cl)c1 ZINC000504281079 340144275 /nfs/dbraw/zinc/14/42/75/340144275.db2.gz WGRAASSMFBXBDL-OAHLLOKOSA-N 1 2 313.788 4.041 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1cc(F)ccc1F ZINC000504376945 340146363 /nfs/dbraw/zinc/14/63/63/340146363.db2.gz RQGRCQGLHCKPPH-GFCCVEGCSA-N 1 2 320.383 4.388 20 0 DIADLO Cc1ccc(CCC(=O)Nc2c[nH+]ccc2OC(C)(C)C)cc1 ZINC000504630437 340150330 /nfs/dbraw/zinc/15/03/30/340150330.db2.gz RFACXJLPYWIZCZ-UHFFFAOYSA-N 1 2 312.413 4.139 20 0 DIADLO C[C@@H](CC(=O)Nc1c[nH+]ccc1OC(C)(C)C)c1ccccc1 ZINC000504634327 340150367 /nfs/dbraw/zinc/15/03/67/340150367.db2.gz FZIWAZMSWBSFNQ-AWEZNQCLSA-N 1 2 312.413 4.391 20 0 DIADLO CCc1cccc(CC(=O)Nc2c[nH+]ccc2OC(C)(C)C)c1 ZINC000504655370 340150682 /nfs/dbraw/zinc/15/06/82/340150682.db2.gz QZZSHQXAAXUPOS-UHFFFAOYSA-N 1 2 312.413 4.003 20 0 DIADLO CC[C@@H](CC(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000504688159 340151242 /nfs/dbraw/zinc/15/12/42/340151242.db2.gz WXCZKNDCOHBDNE-HNNXBMFYSA-N 1 2 307.397 4.165 20 0 DIADLO Cn1c2cc(Cl)ccc2nc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000505291732 340165757 /nfs/dbraw/zinc/16/57/57/340165757.db2.gz YESXJISZXJDNIX-INIZCTEOSA-N 1 2 311.816 4.174 20 0 DIADLO Cn1c2cc(Cl)ccc2nc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000505291732 340165758 /nfs/dbraw/zinc/16/57/58/340165758.db2.gz YESXJISZXJDNIX-INIZCTEOSA-N 1 2 311.816 4.174 20 0 DIADLO C[C@H]1CCc2nc(C[N@H+](C)Cc3ccccc3F)sc2C1 ZINC000505606752 340172720 /nfs/dbraw/zinc/17/27/20/340172720.db2.gz IPMGOCPXVWZRNP-LBPRGKRZSA-N 1 2 304.434 4.039 20 0 DIADLO C[C@H]1CCc2nc(C[N@@H+](C)Cc3ccccc3F)sc2C1 ZINC000505606752 340172721 /nfs/dbraw/zinc/17/27/21/340172721.db2.gz IPMGOCPXVWZRNP-LBPRGKRZSA-N 1 2 304.434 4.039 20 0 DIADLO Cc1oc(C(C)C)cc1C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000505643444 340174261 /nfs/dbraw/zinc/17/42/61/340174261.db2.gz ZKWUDSGXUHUIPD-UHFFFAOYSA-N 1 2 309.369 4.149 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2c(F)cccc2F)cc1OC ZINC000505663585 340174642 /nfs/dbraw/zinc/17/46/42/340174642.db2.gz RJRDJCRMSKTTIY-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2c(F)cccc2F)cc1OC ZINC000505663585 340174643 /nfs/dbraw/zinc/17/46/43/340174643.db2.gz RJRDJCRMSKTTIY-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO Cc1cnc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000505863705 340180012 /nfs/dbraw/zinc/18/00/12/340180012.db2.gz GGTFROXOUDRSFG-INIZCTEOSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1cnc(C[N@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000505863705 340180013 /nfs/dbraw/zinc/18/00/13/340180013.db2.gz GGTFROXOUDRSFG-INIZCTEOSA-N 1 2 322.239 4.429 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)cs1 ZINC000506777277 340201602 /nfs/dbraw/zinc/20/16/02/340201602.db2.gz NOKDUVMEKZTIQU-SNVBAGLBSA-N 1 2 306.397 4.215 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)cs1 ZINC000506777277 340201603 /nfs/dbraw/zinc/20/16/03/340201603.db2.gz NOKDUVMEKZTIQU-SNVBAGLBSA-N 1 2 306.397 4.215 20 0 DIADLO C[N@H+](Cc1ccccc1N1CCCC1)Cc1c(F)cccc1F ZINC000506179259 340187698 /nfs/dbraw/zinc/18/76/98/340187698.db2.gz OXYAGLYJOGEBJB-UHFFFAOYSA-N 1 2 316.395 4.197 20 0 DIADLO C[N@@H+](Cc1ccccc1N1CCCC1)Cc1c(F)cccc1F ZINC000506179259 340187699 /nfs/dbraw/zinc/18/76/99/340187699.db2.gz OXYAGLYJOGEBJB-UHFFFAOYSA-N 1 2 316.395 4.197 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](C)Cc2ccc(Br)o2)o1 ZINC000506187007 340187994 /nfs/dbraw/zinc/18/79/94/340187994.db2.gz CRAWDZRLZDORRY-GXFFZTMASA-N 1 2 324.218 4.391 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2ccc(Br)o2)o1 ZINC000506187007 340187995 /nfs/dbraw/zinc/18/79/95/340187995.db2.gz CRAWDZRLZDORRY-GXFFZTMASA-N 1 2 324.218 4.391 20 0 DIADLO C[C@H]1CCc2nc(C[N@H+](C)Cc3ccc(F)c(F)c3)sc2C1 ZINC000506203760 340188719 /nfs/dbraw/zinc/18/87/19/340188719.db2.gz HCCLFNGLWUTMBT-NSHDSACASA-N 1 2 322.424 4.178 20 0 DIADLO C[C@H]1CCc2nc(C[N@@H+](C)Cc3ccc(F)c(F)c3)sc2C1 ZINC000506203760 340188720 /nfs/dbraw/zinc/18/87/20/340188720.db2.gz HCCLFNGLWUTMBT-NSHDSACASA-N 1 2 322.424 4.178 20 0 DIADLO CC[C@H](CN1CC[NH+](CCc2ccccc2)CC1)c1ccccc1 ZINC000506270301 340190707 /nfs/dbraw/zinc/19/07/07/340190707.db2.gz UTRWFROMZNATAC-OAQYLSRUSA-N 1 2 322.496 4.041 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2nc3ccccc3[nH]2)C2CC2)o1 ZINC000506553721 340196603 /nfs/dbraw/zinc/19/66/03/340196603.db2.gz CSEFRCVBOYXXKF-CZUORRHYSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2nc3ccccc3[nH]2)C2CC2)o1 ZINC000506553721 340196604 /nfs/dbraw/zinc/19/66/04/340196604.db2.gz CSEFRCVBOYXXKF-CZUORRHYSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2nc3ccccc3[nH]2)C2CC2)o1 ZINC000506553720 340196665 /nfs/dbraw/zinc/19/66/65/340196665.db2.gz CSEFRCVBOYXXKF-CJNGLKHVSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2nc3ccccc3[nH]2)C2CC2)o1 ZINC000506553720 340196666 /nfs/dbraw/zinc/19/66/66/340196666.db2.gz CSEFRCVBOYXXKF-CJNGLKHVSA-N 1 2 321.424 4.444 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)o2)c(OC)c1 ZINC000506704120 340199915 /nfs/dbraw/zinc/19/99/15/340199915.db2.gz BDTRRJAKUXRNJP-HNNXBMFYSA-N 1 2 321.804 4.287 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)o2)c(OC)c1 ZINC000506704120 340199916 /nfs/dbraw/zinc/19/99/16/340199916.db2.gz BDTRRJAKUXRNJP-HNNXBMFYSA-N 1 2 321.804 4.287 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1ncccc1C(F)(F)F ZINC000506724620 340200243 /nfs/dbraw/zinc/20/02/43/340200243.db2.gz BLZVJIPORKWWNM-JTQLQIEISA-N 1 2 312.360 4.281 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1ncccc1C(F)(F)F ZINC000506724620 340200244 /nfs/dbraw/zinc/20/02/44/340200244.db2.gz BLZVJIPORKWWNM-JTQLQIEISA-N 1 2 312.360 4.281 20 0 DIADLO CC(C)(C)c1n[nH]cc1C[N@H+](Cc1ccccc1F)C1CC1 ZINC000506741926 340200526 /nfs/dbraw/zinc/20/05/26/340200526.db2.gz CSOMJSRTFFRRHT-UHFFFAOYSA-N 1 2 301.409 4.011 20 0 DIADLO CC(C)(C)c1n[nH]cc1C[N@@H+](Cc1ccccc1F)C1CC1 ZINC000506741926 340200527 /nfs/dbraw/zinc/20/05/27/340200527.db2.gz CSOMJSRTFFRRHT-UHFFFAOYSA-N 1 2 301.409 4.011 20 0 DIADLO CC(C)n1cc(C[N@H+](C)Cc2cccc(Cl)c2Cl)cn1 ZINC000506754221 340200899 /nfs/dbraw/zinc/20/08/99/340200899.db2.gz YPDKKVIXIKEJRG-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1cc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)cn1 ZINC000506754221 340200900 /nfs/dbraw/zinc/20/09/00/340200900.db2.gz YPDKKVIXIKEJRG-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO Cc1ccn2c(CN(C)Cc3c(F)cccc3Cl)c[nH+]c2c1 ZINC000506773471 340201533 /nfs/dbraw/zinc/20/15/33/340201533.db2.gz DHSIUDADKVTLTH-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO CC(C)(CCC(=O)Nc1ccn2cc[nH+]c2c1)c1ccccc1 ZINC000506864818 340203030 /nfs/dbraw/zinc/20/30/30/340203030.db2.gz KSOBBYDINGBFAI-UHFFFAOYSA-N 1 2 307.397 4.031 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](CC(=O)c1cccn1C)C1CC1 ZINC000506955719 340204403 /nfs/dbraw/zinc/20/44/03/340204403.db2.gz UPPHCYRHFNZJKI-CYBMUJFWSA-N 1 2 316.832 4.087 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](CC(=O)c1cccn1C)C1CC1 ZINC000506955719 340204404 /nfs/dbraw/zinc/20/44/04/340204404.db2.gz UPPHCYRHFNZJKI-CYBMUJFWSA-N 1 2 316.832 4.087 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@H+](C)Cc1nccn1Cc1ccccc1 ZINC000507134066 340208994 /nfs/dbraw/zinc/20/89/94/340208994.db2.gz IKAGWIMMERHXAN-INIZCTEOSA-N 1 2 323.415 4.264 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@@H+](C)Cc1nccn1Cc1ccccc1 ZINC000507134066 340208995 /nfs/dbraw/zinc/20/89/95/340208995.db2.gz IKAGWIMMERHXAN-INIZCTEOSA-N 1 2 323.415 4.264 20 0 DIADLO Cc1nn(C)cc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000507133520 340209003 /nfs/dbraw/zinc/20/90/03/340209003.db2.gz ZVXCTOVTSBLPNK-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000507133520 340209004 /nfs/dbraw/zinc/20/90/04/340209004.db2.gz ZVXCTOVTSBLPNK-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO CCc1nocc1C[N@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000507159620 340210022 /nfs/dbraw/zinc/21/00/22/340210022.db2.gz JBFGNZQKUKGDKE-MLGOLLRUSA-N 1 2 300.402 4.118 20 0 DIADLO CCc1nocc1C[N@@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000507159620 340210023 /nfs/dbraw/zinc/21/00/23/340210023.db2.gz JBFGNZQKUKGDKE-MLGOLLRUSA-N 1 2 300.402 4.118 20 0 DIADLO Cc1nccc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000507191811 340212354 /nfs/dbraw/zinc/21/23/54/340212354.db2.gz PHXBNFMBRLIJBY-JTQLQIEISA-N 1 2 310.228 4.285 20 0 DIADLO Cc1nccc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000507191811 340212355 /nfs/dbraw/zinc/21/23/55/340212355.db2.gz PHXBNFMBRLIJBY-JTQLQIEISA-N 1 2 310.228 4.285 20 0 DIADLO CCc1nn(C)c(CC)c1C[N@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000507212829 340213729 /nfs/dbraw/zinc/21/37/29/340213729.db2.gz PANRLJCUQVNQKL-LBPRGKRZSA-N 1 2 321.415 4.016 20 0 DIADLO CCc1nn(C)c(CC)c1C[N@@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000507212829 340213730 /nfs/dbraw/zinc/21/37/30/340213730.db2.gz PANRLJCUQVNQKL-LBPRGKRZSA-N 1 2 321.415 4.016 20 0 DIADLO C[N@@H+](Cc1c(F)cccc1Cl)C[C@H]1OCCc2ccccc21 ZINC000507218348 340214236 /nfs/dbraw/zinc/21/42/36/340214236.db2.gz KGEWTZGUWNTGCN-GOSISDBHSA-N 1 2 319.807 4.225 20 0 DIADLO C[N@H+](Cc1c(F)cccc1Cl)C[C@H]1OCCc2ccccc21 ZINC000507218348 340214237 /nfs/dbraw/zinc/21/42/37/340214237.db2.gz KGEWTZGUWNTGCN-GOSISDBHSA-N 1 2 319.807 4.225 20 0 DIADLO C[C@H](c1ccccc1Br)[N@H+](C)Cc1cccc(O)c1 ZINC000507229525 340214701 /nfs/dbraw/zinc/21/47/01/340214701.db2.gz MNWKNMOKCAJUKF-GFCCVEGCSA-N 1 2 320.230 4.348 20 0 DIADLO C[C@H](c1ccccc1Br)[N@@H+](C)Cc1cccc(O)c1 ZINC000507229525 340214702 /nfs/dbraw/zinc/21/47/02/340214702.db2.gz MNWKNMOKCAJUKF-GFCCVEGCSA-N 1 2 320.230 4.348 20 0 DIADLO CC[N@H+](Cc1ncc(CSC)s1)Cc1ccccc1C ZINC000507232564 340214794 /nfs/dbraw/zinc/21/47/94/340214794.db2.gz NYKHJKQIPIVYON-UHFFFAOYSA-N 1 2 306.500 4.337 20 0 DIADLO CC[N@@H+](Cc1ncc(CSC)s1)Cc1ccccc1C ZINC000507232564 340214795 /nfs/dbraw/zinc/21/47/95/340214795.db2.gz NYKHJKQIPIVYON-UHFFFAOYSA-N 1 2 306.500 4.337 20 0 DIADLO CC[N@H+](CCOc1ccccc1F)Cc1c(F)cccc1F ZINC000507244753 340215367 /nfs/dbraw/zinc/21/53/67/340215367.db2.gz YHRIJPYKPHXXII-UHFFFAOYSA-N 1 2 309.331 4.005 20 0 DIADLO CC[N@@H+](CCOc1ccccc1F)Cc1c(F)cccc1F ZINC000507244753 340215368 /nfs/dbraw/zinc/21/53/68/340215368.db2.gz YHRIJPYKPHXXII-UHFFFAOYSA-N 1 2 309.331 4.005 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000507258436 340215981 /nfs/dbraw/zinc/21/59/81/340215981.db2.gz CAAPJKPUYRWVOT-ACJLOTCBSA-N 1 2 317.379 4.272 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000507258436 340215982 /nfs/dbraw/zinc/21/59/82/340215982.db2.gz CAAPJKPUYRWVOT-ACJLOTCBSA-N 1 2 317.379 4.272 20 0 DIADLO Cc1nocc1C[N@H+](Cc1ccccc1)Cc1ccccc1F ZINC000507417997 340218833 /nfs/dbraw/zinc/21/88/33/340218833.db2.gz PCEZKHZXCHYZKY-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1nocc1C[N@@H+](Cc1ccccc1)Cc1ccccc1F ZINC000507417997 340218834 /nfs/dbraw/zinc/21/88/34/340218834.db2.gz PCEZKHZXCHYZKY-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO CC[C@@H](C)CCC(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC000507433821 340219484 /nfs/dbraw/zinc/21/94/84/340219484.db2.gz NQXWBCYOGOWULT-KGLIPLIRSA-N 1 2 323.506 4.140 20 0 DIADLO CC[C@@H](C)CCC(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC000507433821 340219485 /nfs/dbraw/zinc/21/94/85/340219485.db2.gz NQXWBCYOGOWULT-KGLIPLIRSA-N 1 2 323.506 4.140 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+][C@@H](COCC(C)C)c1ccco1 ZINC000507469180 340221155 /nfs/dbraw/zinc/22/11/55/340221155.db2.gz JSAHYTXQSADDEP-WBVHZDCISA-N 1 2 316.445 4.302 20 0 DIADLO CCc1cccnc1[C@H](C)Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000507481138 340221902 /nfs/dbraw/zinc/22/19/02/340221902.db2.gz CIPKAQLXJXASHM-HNNXBMFYSA-N 1 2 310.445 4.202 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000507509072 340223400 /nfs/dbraw/zinc/22/34/00/340223400.db2.gz KEKRILDAINGCKQ-CQSZACIVSA-N 1 2 307.397 4.150 20 0 DIADLO Cc1ccc2ncnc(Nc3ccc(N4CCCCC4)[nH+]c3)c2c1 ZINC000507601810 340225928 /nfs/dbraw/zinc/22/59/28/340225928.db2.gz AKIRSRSNJCNPFY-UHFFFAOYSA-N 1 2 319.412 4.067 20 0 DIADLO CCCCc1nc(C[N@H+](Cc2ccccc2)[C@@H](C)CC)no1 ZINC000507657621 340227520 /nfs/dbraw/zinc/22/75/20/340227520.db2.gz ITDREOVXTWZGCR-HNNXBMFYSA-N 1 2 301.434 4.213 20 0 DIADLO CCCCc1nc(C[N@@H+](Cc2ccccc2)[C@@H](C)CC)no1 ZINC000507657621 340227521 /nfs/dbraw/zinc/22/75/21/340227521.db2.gz ITDREOVXTWZGCR-HNNXBMFYSA-N 1 2 301.434 4.213 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)o1 ZINC000507670465 340227924 /nfs/dbraw/zinc/22/79/24/340227924.db2.gz VJQTXSQWNLQBCS-KRWDZBQOSA-N 1 2 305.805 4.069 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)o1 ZINC000507670465 340227925 /nfs/dbraw/zinc/22/79/25/340227925.db2.gz VJQTXSQWNLQBCS-KRWDZBQOSA-N 1 2 305.805 4.069 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(-c3ccccc3F)s2)no1 ZINC000508517487 340245618 /nfs/dbraw/zinc/24/56/18/340245618.db2.gz HSNHKLKJHNZHDF-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(-c3ccccc3F)s2)no1 ZINC000508517487 340245619 /nfs/dbraw/zinc/24/56/19/340245619.db2.gz HSNHKLKJHNZHDF-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO CC[C@H]([NH2+][C@H](CC(C)C)C(=O)OC)c1ccc(Cl)s1 ZINC000509032196 340258872 /nfs/dbraw/zinc/25/88/72/340258872.db2.gz MRSMTVZHAJTIAG-WDEREUQCSA-N 1 2 303.855 4.030 20 0 DIADLO CC[C@@H]([NH2+][C@@H](CC(C)C)C(=O)OC)c1ccc(Cl)s1 ZINC000509032194 340258882 /nfs/dbraw/zinc/25/88/82/340258882.db2.gz MRSMTVZHAJTIAG-MNOVXSKESA-N 1 2 303.855 4.030 20 0 DIADLO Cc1nocc1C[N@@H+]1CCc2c(Cl)cc(Cl)cc2[C@@H]1C ZINC000509051289 340259624 /nfs/dbraw/zinc/25/96/24/340259624.db2.gz YUHBLYKNVAFYRK-JTQLQIEISA-N 1 2 311.212 4.409 20 0 DIADLO Cc1nocc1C[N@H+]1CCc2c(Cl)cc(Cl)cc2[C@@H]1C ZINC000509051289 340259625 /nfs/dbraw/zinc/25/96/25/340259625.db2.gz YUHBLYKNVAFYRK-JTQLQIEISA-N 1 2 311.212 4.409 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@H](C)C[C@H](C)C2)[nH+]1 ZINC000509256151 340264594 /nfs/dbraw/zinc/26/45/94/340264594.db2.gz HTHXOGUUCUOUMI-NHAGDIPZSA-N 1 2 311.429 4.396 20 0 DIADLO CC[C@H](C)CN(CC)C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509346779 340266795 /nfs/dbraw/zinc/26/67/95/340266795.db2.gz UZBGQQZRWFPUBL-HNNXBMFYSA-N 1 2 312.413 4.382 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1nc2ccccc2n1C ZINC000509408732 340268539 /nfs/dbraw/zinc/26/85/39/340268539.db2.gz TXDYNBFYOKCBAP-OAHLLOKOSA-N 1 2 311.454 4.144 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1nc2ccccc2n1C ZINC000509408732 340268540 /nfs/dbraw/zinc/26/85/40/340268540.db2.gz TXDYNBFYOKCBAP-OAHLLOKOSA-N 1 2 311.454 4.144 20 0 DIADLO Fc1ccc2c(c1)CC[N@@H+](Cc1cc(-c3cccs3)on1)C2 ZINC000509415479 340268769 /nfs/dbraw/zinc/26/87/69/340268769.db2.gz IYMFOILNZJJOQM-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1ccc2c(c1)CC[N@H+](Cc1cc(-c3cccs3)on1)C2 ZINC000509415479 340268770 /nfs/dbraw/zinc/26/87/70/340268770.db2.gz IYMFOILNZJJOQM-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO COc1ccnc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)c1 ZINC000509468196 340270651 /nfs/dbraw/zinc/27/06/51/340270651.db2.gz ZTARMNFZVSIICO-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1ccnc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)c1 ZINC000509468196 340270652 /nfs/dbraw/zinc/27/06/52/340270652.db2.gz ZTARMNFZVSIICO-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1cc[nH+]c(CN2CC=C(c3ccccc3Cl)CC2)c1 ZINC000509468196 340270653 /nfs/dbraw/zinc/27/06/53/340270653.db2.gz ZTARMNFZVSIICO-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1cc2c(cc1F)CC[C@H]2Nc1ccc2ccccc2[nH+]1 ZINC000509480270 340270999 /nfs/dbraw/zinc/27/09/99/340270999.db2.gz QAIDHJVUQCNWGO-QGZVFWFLSA-N 1 2 308.356 4.482 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+]3CCc4cc(F)ccc4C3)o2)cc1 ZINC000509509432 340271784 /nfs/dbraw/zinc/27/17/84/340271784.db2.gz QBVHPXFSQRRZSP-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+]3CCc4cc(F)ccc4C3)o2)cc1 ZINC000509509432 340271785 /nfs/dbraw/zinc/27/17/85/340271785.db2.gz QBVHPXFSQRRZSP-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO FC(F)(F)c1cccc([C@]2(F)CCN(c3cccc[nH+]3)C2)c1 ZINC000509542388 340272915 /nfs/dbraw/zinc/27/29/15/340272915.db2.gz QZGOKVUQMMASSH-HNNXBMFYSA-N 1 2 310.294 4.176 20 0 DIADLO C[C@H](F)CC[N@@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000509673152 340276394 /nfs/dbraw/zinc/27/63/94/340276394.db2.gz NGSNQVGSQXQXFN-HZMBPMFUSA-N 1 2 306.208 4.115 20 0 DIADLO C[C@H](F)CC[N@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000509673152 340276395 /nfs/dbraw/zinc/27/63/95/340276395.db2.gz NGSNQVGSQXQXFN-HZMBPMFUSA-N 1 2 306.208 4.115 20 0 DIADLO C[C@@H](F)CC[N@@H+]1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000509695921 340277315 /nfs/dbraw/zinc/27/73/15/340277315.db2.gz IARIPZPWFYQISR-YMTOWFKASA-N 1 2 324.198 4.254 20 0 DIADLO C[C@@H](F)CC[N@H+]1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000509695921 340277316 /nfs/dbraw/zinc/27/73/16/340277316.db2.gz IARIPZPWFYQISR-YMTOWFKASA-N 1 2 324.198 4.254 20 0 DIADLO CC[C@H]1COCC[N@@H+]1Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000509825747 340280538 /nfs/dbraw/zinc/28/05/38/340280538.db2.gz DIAZVMAJHFSKOI-HNNXBMFYSA-N 1 2 322.861 4.074 20 0 DIADLO CC[C@H]1COCC[N@H+]1Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000509825747 340280539 /nfs/dbraw/zinc/28/05/39/340280539.db2.gz DIAZVMAJHFSKOI-HNNXBMFYSA-N 1 2 322.861 4.074 20 0 DIADLO Cn1c(CCSc2ccc(F)cc2F)[nH+]c2ccccc21 ZINC000509971785 340284350 /nfs/dbraw/zinc/28/43/50/340284350.db2.gz UAXYMLSIQKMWDR-UHFFFAOYSA-N 1 2 304.365 4.186 20 0 DIADLO CC[C@H](CC1CCCC1)C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000510041568 340286164 /nfs/dbraw/zinc/28/61/64/340286164.db2.gz NPCDATCCNKXOMI-MRXNPFEDSA-N 1 2 311.429 4.417 20 0 DIADLO C[C@H](CC1CCCC1)C(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000510069283 340287197 /nfs/dbraw/zinc/28/71/97/340287197.db2.gz GUCIALHKTIPKBQ-CQSZACIVSA-N 1 2 311.429 4.242 20 0 DIADLO CC(C)n1ncc2cc(C[NH2+]C3(C(F)F)CCCCC3)cnc21 ZINC000510080092 340287759 /nfs/dbraw/zinc/28/77/59/340287759.db2.gz SDRQBIWBQLTJQK-UHFFFAOYSA-N 1 2 322.403 4.070 20 0 DIADLO CC(C)CCC[C@H](C)NC(=O)C[N@H+](C)[C@H](C)c1ccccc1F ZINC000510080828 340287980 /nfs/dbraw/zinc/28/79/80/340287980.db2.gz BFVAARSENBIZEE-JKSUJKDBSA-N 1 2 322.468 4.150 20 0 DIADLO CC(C)CCC[C@H](C)NC(=O)C[N@@H+](C)[C@H](C)c1ccccc1F ZINC000510080828 340287981 /nfs/dbraw/zinc/28/79/81/340287981.db2.gz BFVAARSENBIZEE-JKSUJKDBSA-N 1 2 322.468 4.150 20 0 DIADLO FC(F)Oc1ccccc1C[NH2+]C1(C(F)F)CCCCC1 ZINC000510125210 340289770 /nfs/dbraw/zinc/28/97/70/340289770.db2.gz WPXDTJMFOYWJKT-UHFFFAOYSA-N 1 2 305.315 4.346 20 0 DIADLO FC(F)(F)c1ccccc1C[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000510128321 340289825 /nfs/dbraw/zinc/28/98/25/340289825.db2.gz RAVFDRWZWIRIBQ-OAHLLOKOSA-N 1 2 309.335 4.156 20 0 DIADLO FC(F)(F)c1ccccc1C[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000510128321 340289826 /nfs/dbraw/zinc/28/98/26/340289826.db2.gz RAVFDRWZWIRIBQ-OAHLLOKOSA-N 1 2 309.335 4.156 20 0 DIADLO CC[N@H+](Cc1cn2cc(C)ccc2n1)Cc1ccccc1Cl ZINC000510139746 340290231 /nfs/dbraw/zinc/29/02/31/340290231.db2.gz MLHXNNXVANGKNP-UHFFFAOYSA-N 1 2 313.832 4.318 20 0 DIADLO CC[N@@H+](Cc1cn2cc(C)ccc2n1)Cc1ccccc1Cl ZINC000510139746 340290232 /nfs/dbraw/zinc/29/02/32/340290232.db2.gz MLHXNNXVANGKNP-UHFFFAOYSA-N 1 2 313.832 4.318 20 0 DIADLO CCN(Cc1cn2cc(C)ccc2[nH+]1)Cc1ccccc1Cl ZINC000510139746 340290233 /nfs/dbraw/zinc/29/02/33/340290233.db2.gz MLHXNNXVANGKNP-UHFFFAOYSA-N 1 2 313.832 4.318 20 0 DIADLO CC(C)CCNC(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000510136879 340290286 /nfs/dbraw/zinc/29/02/86/340290286.db2.gz TZRMPQKVMMMRGW-UHFFFAOYSA-N 1 2 318.804 4.303 20 0 DIADLO Cc1cccc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)c1O ZINC000303013744 340295387 /nfs/dbraw/zinc/29/53/87/340295387.db2.gz KDDUUEFSKNJCRV-UHFFFAOYSA-N 1 2 320.348 4.140 20 0 DIADLO CN(C)c1ccc2cc(NC(=O)C3CCCCCC3)ccc2[nH+]1 ZINC000510428944 340299194 /nfs/dbraw/zinc/29/91/94/340299194.db2.gz NGEDRHAHHQTVHN-UHFFFAOYSA-N 1 2 311.429 4.210 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2nc(-c3cccs3)no2)c1 ZINC000510571140 340302950 /nfs/dbraw/zinc/30/29/50/340302950.db2.gz OAKLYAMITBVBMW-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2nc(-c3cccs3)no2)c1 ZINC000510571140 340302951 /nfs/dbraw/zinc/30/29/51/340302951.db2.gz OAKLYAMITBVBMW-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO C[N@@H+](Cc1csc(Br)c1)Cc1ccc(Cl)o1 ZINC000510668348 340305798 /nfs/dbraw/zinc/30/57/98/340305798.db2.gz YPYSZZGYADQDRQ-UHFFFAOYSA-N 1 2 320.639 4.389 20 0 DIADLO C[N@H+](Cc1csc(Br)c1)Cc1ccc(Cl)o1 ZINC000510668348 340305799 /nfs/dbraw/zinc/30/57/99/340305799.db2.gz YPYSZZGYADQDRQ-UHFFFAOYSA-N 1 2 320.639 4.389 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2cscn2)c2cccc(F)c2)c1 ZINC000510736358 340308775 /nfs/dbraw/zinc/30/87/75/340308775.db2.gz NBFOJDBNQFZUQK-GOSISDBHSA-N 1 2 312.413 4.470 20 0 DIADLO Clc1ccc(C[N@@H+]2CCO[C@@]3(CCc4ccccc43)C2)s1 ZINC000510805938 340311542 /nfs/dbraw/zinc/31/15/42/340311542.db2.gz DGATXNLBXLAMEB-KRWDZBQOSA-N 1 2 319.857 4.075 20 0 DIADLO Clc1ccc(C[N@H+]2CCO[C@@]3(CCc4ccccc43)C2)s1 ZINC000510805938 340311543 /nfs/dbraw/zinc/31/15/43/340311543.db2.gz DGATXNLBXLAMEB-KRWDZBQOSA-N 1 2 319.857 4.075 20 0 DIADLO C[C@H](CC(=O)Nc1ccccc1-n1cc[nH+]c1)C1CCCCC1 ZINC000510902385 340314369 /nfs/dbraw/zinc/31/43/69/340314369.db2.gz XVXARNFXLSIUIL-OAHLLOKOSA-N 1 2 311.429 4.417 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2cscn2)CC2CC2)c(Cl)c1 ZINC000511066532 340319895 /nfs/dbraw/zinc/31/98/95/340319895.db2.gz RTGLOBDLSAQDJP-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO Fc1ccc(C[N@H+](Cc2cscn2)CC2CC2)c(Cl)c1 ZINC000511066532 340319896 /nfs/dbraw/zinc/31/98/96/340319896.db2.gz RTGLOBDLSAQDJP-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO Cc1c2ccccc2oc1C[NH2+]Cc1c(F)ccc(O)c1F ZINC000511123158 340321502 /nfs/dbraw/zinc/32/15/02/340321502.db2.gz PVHVJUDNTMFLCM-UHFFFAOYSA-N 1 2 303.308 4.015 20 0 DIADLO CC(C)Sc1ccc(C[N@@H+]2CCO[C@@H](c3ccco3)C2)cc1 ZINC000511133000 340321994 /nfs/dbraw/zinc/32/19/94/340321994.db2.gz ZWRBLZWKYGDGQU-GOSISDBHSA-N 1 2 317.454 4.354 20 0 DIADLO CC(C)Sc1ccc(C[N@H+]2CCO[C@@H](c3ccco3)C2)cc1 ZINC000511133000 340321995 /nfs/dbraw/zinc/32/19/95/340321995.db2.gz ZWRBLZWKYGDGQU-GOSISDBHSA-N 1 2 317.454 4.354 20 0 DIADLO COC(=O)c1ccc([C@@H](C)[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)o1 ZINC000511543021 340329948 /nfs/dbraw/zinc/32/99/48/340329948.db2.gz RCZDFRMVIWGRFJ-RISCZKNCSA-N 1 2 319.788 4.228 20 0 DIADLO COC(=O)c1ccc([C@@H](C)[N@H+]2CC[C@H]2c2ccc(Cl)cc2)o1 ZINC000511543021 340329949 /nfs/dbraw/zinc/32/99/49/340329949.db2.gz RCZDFRMVIWGRFJ-RISCZKNCSA-N 1 2 319.788 4.228 20 0 DIADLO COC(=O)c1ccc([C@H](C)[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)o1 ZINC000511543020 340330100 /nfs/dbraw/zinc/33/01/00/340330100.db2.gz RCZDFRMVIWGRFJ-FZMZJTMJSA-N 1 2 319.788 4.228 20 0 DIADLO COC(=O)c1ccc([C@H](C)[N@H+]2CC[C@H]2c2ccc(Cl)cc2)o1 ZINC000511543020 340330101 /nfs/dbraw/zinc/33/01/01/340330101.db2.gz RCZDFRMVIWGRFJ-FZMZJTMJSA-N 1 2 319.788 4.228 20 0 DIADLO Clc1ccc([C@@H]2CC[N@@H+]2Cc2ccc3c(c2)OCCO3)cc1 ZINC000511540497 340330118 /nfs/dbraw/zinc/33/01/18/340330118.db2.gz HUXLGHSSIBQFJT-INIZCTEOSA-N 1 2 315.800 4.058 20 0 DIADLO Clc1ccc([C@@H]2CC[N@H+]2Cc2ccc3c(c2)OCCO3)cc1 ZINC000511540497 340330119 /nfs/dbraw/zinc/33/01/19/340330119.db2.gz HUXLGHSSIBQFJT-INIZCTEOSA-N 1 2 315.800 4.058 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1)[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511603959 340332010 /nfs/dbraw/zinc/33/20/10/340332010.db2.gz DAQHLIVYHSWNAK-GUYCJALGSA-N 1 2 314.816 4.114 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1)[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511603959 340332011 /nfs/dbraw/zinc/33/20/11/340332011.db2.gz DAQHLIVYHSWNAK-GUYCJALGSA-N 1 2 314.816 4.114 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1)[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511603957 340332066 /nfs/dbraw/zinc/33/20/66/340332066.db2.gz DAQHLIVYHSWNAK-CXAGYDPISA-N 1 2 314.816 4.114 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1)[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511603957 340332067 /nfs/dbraw/zinc/33/20/67/340332067.db2.gz DAQHLIVYHSWNAK-CXAGYDPISA-N 1 2 314.816 4.114 20 0 DIADLO Fc1ccc(Cl)cc1C[N@@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000511648937 340333811 /nfs/dbraw/zinc/33/38/11/340333811.db2.gz QKKRKXNYSXCKOY-INIZCTEOSA-N 1 2 323.795 4.253 20 0 DIADLO Fc1ccc(Cl)cc1C[N@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000511648937 340333812 /nfs/dbraw/zinc/33/38/12/340333812.db2.gz QKKRKXNYSXCKOY-INIZCTEOSA-N 1 2 323.795 4.253 20 0 DIADLO CCc1cc(N(C)C2CCCCCC2)nc(-c2ccncc2)[nH+]1 ZINC000303592698 340336557 /nfs/dbraw/zinc/33/65/57/340336557.db2.gz PAHOWWIJGJWMEQ-UHFFFAOYSA-N 1 2 310.445 4.260 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccon2)sc1Br ZINC000511969132 340344021 /nfs/dbraw/zinc/34/40/21/340344021.db2.gz BHXKJMKLPQQPJW-IUCAKERBSA-N 1 2 315.236 4.219 20 0 DIADLO C[N@@H+](Cc1cscn1)Cc1ccc(-c2ccccc2F)o1 ZINC000512068504 340347535 /nfs/dbraw/zinc/34/75/35/340347535.db2.gz RZCZKDSOAVRAIR-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@H+](Cc1cscn1)Cc1ccc(-c2ccccc2F)o1 ZINC000512068504 340347536 /nfs/dbraw/zinc/34/75/36/340347536.db2.gz RZCZKDSOAVRAIR-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO Fc1ccc(/C=C\CNc2ccc(-n3cc[nH+]c3)cc2)cc1F ZINC000512083709 340348043 /nfs/dbraw/zinc/34/80/43/340348043.db2.gz LLOYHUSUXDDUQN-UPHRSURJSA-N 1 2 311.335 4.276 20 0 DIADLO C[C@@H]1CC[C@@H](c2ccccc2)[N@H+](Cc2noc(C(C)(C)C)n2)C1 ZINC000512188552 340351551 /nfs/dbraw/zinc/35/15/51/340351551.db2.gz ZYKWXLWWOHWDMY-ZBFHGGJFSA-N 1 2 313.445 4.340 20 0 DIADLO C[C@@H]1CC[C@@H](c2ccccc2)[N@@H+](Cc2noc(C(C)(C)C)n2)C1 ZINC000512188552 340351552 /nfs/dbraw/zinc/35/15/52/340351552.db2.gz ZYKWXLWWOHWDMY-ZBFHGGJFSA-N 1 2 313.445 4.340 20 0 DIADLO Clc1ccc(/C=C\C[N@@H+]2CCO[C@H](c3cccs3)C2)cc1 ZINC000512240563 340353572 /nfs/dbraw/zinc/35/35/72/340353572.db2.gz DUHCNGUORQNBBR-SWQCVOCJSA-N 1 2 319.857 4.488 20 0 DIADLO Clc1ccc(/C=C\C[N@H+]2CCO[C@H](c3cccs3)C2)cc1 ZINC000512240563 340353573 /nfs/dbraw/zinc/35/35/73/340353573.db2.gz DUHCNGUORQNBBR-SWQCVOCJSA-N 1 2 319.857 4.488 20 0 DIADLO CC(C)CCn1cccc1C[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000512237138 340353601 /nfs/dbraw/zinc/35/36/01/340353601.db2.gz NCDNHPUJVDDRIL-KRWDZBQOSA-N 1 2 318.486 4.169 20 0 DIADLO CC(C)CCn1cccc1C[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000512237138 340353602 /nfs/dbraw/zinc/35/36/02/340353602.db2.gz NCDNHPUJVDDRIL-KRWDZBQOSA-N 1 2 318.486 4.169 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1cc(-c3ccccc3)on1)CCO2 ZINC000512246057 340353809 /nfs/dbraw/zinc/35/38/09/340353809.db2.gz SVYOXRPEPUXGBM-UHFFFAOYSA-N 1 2 320.392 4.045 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1cc(-c3ccccc3)on1)CCO2 ZINC000512246057 340353810 /nfs/dbraw/zinc/35/38/10/340353810.db2.gz SVYOXRPEPUXGBM-UHFFFAOYSA-N 1 2 320.392 4.045 20 0 DIADLO CC(C)CCc1noc(C[N@H+]([C@@H](C)c2ccccc2)C2CC2)n1 ZINC000512277916 340355175 /nfs/dbraw/zinc/35/51/75/340355175.db2.gz NIMKUSFDQRMTAF-HNNXBMFYSA-N 1 2 313.445 4.384 20 0 DIADLO CC(C)CCc1noc(C[N@@H+]([C@@H](C)c2ccccc2)C2CC2)n1 ZINC000512277916 340355176 /nfs/dbraw/zinc/35/51/76/340355176.db2.gz NIMKUSFDQRMTAF-HNNXBMFYSA-N 1 2 313.445 4.384 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+]1C[C@@H](CC)[S@](=O)[C@@H](C)C1 ZINC000512426063 340361523 /nfs/dbraw/zinc/36/15/23/340361523.db2.gz DSPCLOLBPYVMKA-SGJCYKPQSA-N 1 2 313.894 4.023 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+]1C[C@@H](CC)[S@](=O)[C@@H](C)C1 ZINC000512426063 340361524 /nfs/dbraw/zinc/36/15/24/340361524.db2.gz DSPCLOLBPYVMKA-SGJCYKPQSA-N 1 2 313.894 4.023 20 0 DIADLO C[C@@H]1CCC[N@@H+]1CC(=O)Nc1c(Cl)cc(Cl)cc1Cl ZINC000173984782 340379400 /nfs/dbraw/zinc/37/94/00/340379400.db2.gz BRFOAMCTPCPLOC-MRVPVSSYSA-N 1 2 321.635 4.070 20 0 DIADLO C[C@@H]1CCC[N@H+]1CC(=O)Nc1c(Cl)cc(Cl)cc1Cl ZINC000173984782 340379401 /nfs/dbraw/zinc/37/94/01/340379401.db2.gz BRFOAMCTPCPLOC-MRVPVSSYSA-N 1 2 321.635 4.070 20 0 DIADLO C[C@@H]1CC[C@H](C)[N@H+](CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000174008126 340379973 /nfs/dbraw/zinc/37/99/73/340379973.db2.gz PLZBJAPGSOIOHJ-MNOVXSKESA-N 1 2 315.244 4.052 20 0 DIADLO C[C@@H]1CC[C@H](C)[N@@H+](CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000174008126 340379974 /nfs/dbraw/zinc/37/99/74/340379974.db2.gz PLZBJAPGSOIOHJ-MNOVXSKESA-N 1 2 315.244 4.052 20 0 DIADLO Cc1nc(C)c(C[NH2+]CC(F)(F)c2ccc(Cl)cc2)s1 ZINC000512989051 340387111 /nfs/dbraw/zinc/38/71/11/340387111.db2.gz NYEZXMPTEKUNLX-UHFFFAOYSA-N 1 2 316.804 4.295 20 0 DIADLO OC[C@H](Nc1ccc2ccccc2[nH+]1)c1cccc(Cl)c1F ZINC000513045159 340390592 /nfs/dbraw/zinc/39/05/92/340390592.db2.gz BSLRHJLQZKAPFL-HNNXBMFYSA-N 1 2 316.763 4.173 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)ccc1F)c1c(F)cncc1F ZINC000513067319 340391798 /nfs/dbraw/zinc/39/17/98/340391798.db2.gz DJQYBSDLBIQGTD-QMMMGPOBSA-N 1 2 300.711 4.003 20 0 DIADLO CC[N@H+](Cc1c[nH]nc1C(C)(C)C)Cc1c(F)cccc1F ZINC000513122477 340394176 /nfs/dbraw/zinc/39/41/76/340394176.db2.gz ODHPOSDCGITOHT-UHFFFAOYSA-N 1 2 307.388 4.008 20 0 DIADLO CC[N@@H+](Cc1c[nH]nc1C(C)(C)C)Cc1c(F)cccc1F ZINC000513122477 340394177 /nfs/dbraw/zinc/39/41/77/340394177.db2.gz ODHPOSDCGITOHT-UHFFFAOYSA-N 1 2 307.388 4.008 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)CCC2)c1nc(C(C)(C)C)no1 ZINC000513195412 340396470 /nfs/dbraw/zinc/39/64/70/340396470.db2.gz BHVSCQFMWICVOL-CHWSQXEVSA-N 1 2 313.445 4.268 20 0 DIADLO COc1ccc2cccc(CC(=O)Nc3ccc(C)[nH+]c3C)c2c1 ZINC000178768530 340451928 /nfs/dbraw/zinc/45/19/28/340451928.db2.gz CIYCCEOWTBBIQD-UHFFFAOYSA-N 1 2 320.392 4.041 20 0 DIADLO CC(C)OC1CC[NH+](Cc2csc(Cl)c2Cl)CC1 ZINC000517229115 340466056 /nfs/dbraw/zinc/46/60/56/340466056.db2.gz ZBNTWRYEUSLOGW-UHFFFAOYSA-N 1 2 308.274 4.444 20 0 DIADLO COc1ccc([C@@H](Nc2cc(C)[nH+]cn2)c2ccc(C)cc2)cc1 ZINC000517648364 340474559 /nfs/dbraw/zinc/47/45/59/340474559.db2.gz BFMRJGIFAVKIAN-FQEVSTJZSA-N 1 2 319.408 4.304 20 0 DIADLO C[C@@H]([NH2+]Cc1nccn1-c1ccccc1)c1ccccc1Cl ZINC000190675039 340546405 /nfs/dbraw/zinc/54/64/05/340546405.db2.gz BYWKMUULSFGJIY-CQSZACIVSA-N 1 2 311.816 4.377 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000191574870 340555980 /nfs/dbraw/zinc/55/59/80/340555980.db2.gz PJUMDGVJSSSFFP-GFCCVEGCSA-N 1 2 321.852 4.488 20 0 DIADLO Cc1c[nH+]cc(NCc2ccc(Cl)c(Br)c2)c1 ZINC000224917215 340560355 /nfs/dbraw/zinc/56/03/55/340560355.db2.gz ZFAXKOMQKRAVOE-UHFFFAOYSA-N 1 2 311.610 4.418 20 0 DIADLO C[C@H](Nc1cccc(-c2[nH+]ccn2C)c1)C1CCSCC1 ZINC000195083018 340573873 /nfs/dbraw/zinc/57/38/73/340573873.db2.gz ZIQSBCAHUALDHD-ZDUSSCGKSA-N 1 2 301.459 4.031 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](Cc2ccccc2)c2ccccc2)no1 ZINC000193528648 340579221 /nfs/dbraw/zinc/57/92/21/340579221.db2.gz JXWPRHVXUSJSOM-GOSISDBHSA-N 1 2 321.424 4.267 20 0 DIADLO Cc1cc(NC(=O)c2cc(Cl)ccc2OC(C)C)cc[nH+]1 ZINC000195618258 340583009 /nfs/dbraw/zinc/58/30/09/340583009.db2.gz XWTDKMGSVABNKK-UHFFFAOYSA-N 1 2 304.777 4.083 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)Cc1ccc(Cl)s1 ZINC000193802989 340583337 /nfs/dbraw/zinc/58/33/37/340583337.db2.gz ZAORFRPYTHVDMR-UHFFFAOYSA-N 1 2 324.833 4.155 20 0 DIADLO Cc1cccc2cc(C(=O)Nc3cccc(-c4[nH]cc[nH+]4)c3)oc21 ZINC000522880618 340609022 /nfs/dbraw/zinc/60/90/22/340609022.db2.gz KUAJXAYRRTXGHZ-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO FC(F)(F)c1ccc(COc2ccccc2-n2cc[nH+]c2)cc1 ZINC000522890302 340609332 /nfs/dbraw/zinc/60/93/32/340609332.db2.gz BMXLHJVMJOMAQH-UHFFFAOYSA-N 1 2 318.298 4.470 20 0 DIADLO c1ccc2sc(NCCCc3[nH]c4ccccc4[nH+]3)nc2c1 ZINC000302916420 340631556 /nfs/dbraw/zinc/63/15/56/340631556.db2.gz YPUFTLMYMVHEDP-UHFFFAOYSA-N 1 2 308.410 4.217 20 0 DIADLO C[C@H]1CCC[C@@H](CC(=O)Nc2cccc(-c3[nH+]ccn3C)c2)C1 ZINC000523681011 340632946 /nfs/dbraw/zinc/63/29/46/340632946.db2.gz KGAKGZRIRANCJQ-LSDHHAIUSA-N 1 2 311.429 4.242 20 0 DIADLO C[C@@H]1C[NH+](Cc2csc(Cc3ccccc3)n2)C[C@@H](C)S1 ZINC000524756490 340679456 /nfs/dbraw/zinc/67/94/56/340679456.db2.gz OOGCYTNBCYGCDX-ZIAGYGMSSA-N 1 2 318.511 4.060 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1occc1C)c1ccccc1 ZINC000525182775 340693952 /nfs/dbraw/zinc/69/39/52/340693952.db2.gz DICAMYBFCJVGPO-HXUWFJFHSA-N 1 2 307.393 4.476 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)C(C)(C)Cc3ccccc3)ccc2n1C ZINC000525217738 340695616 /nfs/dbraw/zinc/69/56/16/340695616.db2.gz FIUFYXALEVGIHB-UHFFFAOYSA-N 1 2 321.424 4.089 20 0 DIADLO CCc1noc(C)c1C[NH2+]C(C)(C)c1nc2ccccc2s1 ZINC000528605921 340726023 /nfs/dbraw/zinc/72/60/23/340726023.db2.gz XYNRFSFCADNVJW-UHFFFAOYSA-N 1 2 315.442 4.180 20 0 DIADLO CCO[C@H](C)c1noc(C[NH2+][C@H](CC)c2cc(C)ccc2C)n1 ZINC000528802429 340735082 /nfs/dbraw/zinc/73/50/82/340735082.db2.gz SKOUTOGQJZJWFB-GDBMZVCRSA-N 1 2 317.433 4.025 20 0 DIADLO CCO[C@@H](C)c1noc(C[NH2+][C@@H](CC)c2cc(C)ccc2C)n1 ZINC000528802431 340735166 /nfs/dbraw/zinc/73/51/66/340735166.db2.gz SKOUTOGQJZJWFB-HOCLYGCPSA-N 1 2 317.433 4.025 20 0 DIADLO CC(C)(C)OC1CC[NH+](Cc2c(F)ccc(F)c2Cl)CC1 ZINC000529528196 340759488 /nfs/dbraw/zinc/75/94/88/340759488.db2.gz WHOOYNUTKDIHHR-UHFFFAOYSA-N 1 2 317.807 4.398 20 0 DIADLO Cc1ccc(NC2CCN(c3cccc[nH+]3)CC2)cc1Cl ZINC000037188432 340770753 /nfs/dbraw/zinc/77/07/53/340770753.db2.gz OPRPCVLNPBDHCD-UHFFFAOYSA-N 1 2 301.821 4.124 20 0 DIADLO CC[C@H]([NH2+]Cc1ncccc1F)c1cc(Cl)ccc1OC ZINC000530418494 340791069 /nfs/dbraw/zinc/79/10/69/340791069.db2.gz UPFJFFOVXSUNAA-AWEZNQCLSA-N 1 2 308.784 4.124 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2ccc(Cl)c(F)c2)s1 ZINC000537960238 340793629 /nfs/dbraw/zinc/79/36/29/340793629.db2.gz NPFKBKCHBWIWHX-SECBINFHSA-N 1 2 313.829 4.305 20 0 DIADLO CC[C@@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1cccc(Cl)c1 ZINC000125288398 340803458 /nfs/dbraw/zinc/80/34/58/340803458.db2.gz RRSXNBFPJQHEHW-CYBMUJFWSA-N 1 2 307.825 4.261 20 0 DIADLO CC(C)c1ccc([C@H](C)[NH2+][C@@H](CO)c2c(F)cccc2F)cc1 ZINC000537986683 340805579 /nfs/dbraw/zinc/80/55/79/340805579.db2.gz JNXHMXUULITLRC-UGSOOPFHSA-N 1 2 319.395 4.472 20 0 DIADLO FC(F)(F)C1CCC(Nc2cccc(-n3cc[nH+]c3)c2)CC1 ZINC000125899148 340814443 /nfs/dbraw/zinc/81/44/43/340814443.db2.gz GBZPUIXXGMDLQH-UHFFFAOYSA-N 1 2 309.335 4.405 20 0 DIADLO Cc1c2ccccc2oc1C[NH2+][C@H](c1ncc[nH]1)c1ccccc1 ZINC000126917023 340839722 /nfs/dbraw/zinc/83/97/22/340839722.db2.gz DECGWBGGSRYMDB-IBGZPJMESA-N 1 2 317.392 4.344 20 0 DIADLO C[C@@H]([NH2+][C@H](c1cccs1)c1ccc(F)cc1)c1cnccn1 ZINC000539073047 340870595 /nfs/dbraw/zinc/87/05/95/340870595.db2.gz NFDUXBJKIIPSAD-PXAZEXFGSA-N 1 2 313.401 4.117 20 0 DIADLO C[C@H]([NH2+][C@H](c1cccs1)c1ccc(F)cc1)c1cnccn1 ZINC000539073048 340870710 /nfs/dbraw/zinc/87/07/10/340870710.db2.gz NFDUXBJKIIPSAD-SJCJKPOMSA-N 1 2 313.401 4.117 20 0 DIADLO Cc1nc(-c2ccc([C@H](C)[NH2+]Cc3nccc(C)n3)cc2)cs1 ZINC000539279459 340879189 /nfs/dbraw/zinc/87/91/89/340879189.db2.gz DKICYTULSMABBI-ZDUSSCGKSA-N 1 2 324.453 4.068 20 0 DIADLO Cc1cccc(CCCn2nc(C(F)(F)F)c3c[nH+]ccc32)c1 ZINC000539761924 340898981 /nfs/dbraw/zinc/89/89/81/340898981.db2.gz SFSBYHRMNHWLEE-UHFFFAOYSA-N 1 2 319.330 4.391 20 0 DIADLO Cc1c2ccccc2oc1[C@@H]([NH2+]Cc1ncc(C)cn1)C(C)C ZINC000540359104 340928404 /nfs/dbraw/zinc/92/84/04/340928404.db2.gz GMLQDUFQHNPKOC-SFHVURJKSA-N 1 2 309.413 4.327 20 0 DIADLO Cc1c2ccccc2oc1[C@H]([NH2+]Cc1ncc(C)cn1)C(C)C ZINC000540359099 340928468 /nfs/dbraw/zinc/92/84/68/340928468.db2.gz GMLQDUFQHNPKOC-GOSISDBHSA-N 1 2 309.413 4.327 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1ccc(F)cc1F ZINC000540386546 340929016 /nfs/dbraw/zinc/92/90/16/340929016.db2.gz VZTUMPIUKCMIJB-SECBINFHSA-N 1 2 306.287 4.096 20 0 DIADLO CC(C)(C)[C@@H]([NH2+]Cc1nnsc1Cl)c1cccc(F)c1 ZINC000540427043 340930993 /nfs/dbraw/zinc/93/09/93/340930993.db2.gz LIZBIOFSMVQRCP-LBPRGKRZSA-N 1 2 313.829 4.208 20 0 DIADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1ncc(-c2ccccc2C)o1 ZINC000541193944 340961167 /nfs/dbraw/zinc/96/11/67/340961167.db2.gz ARSJLTWRFUBHTP-OAHLLOKOSA-N 1 2 321.424 4.458 20 0 DIADLO CCCC(CCC)C(=O)N1CCC(CCCn2cc[nH+]c2)CC1 ZINC000541237304 340963421 /nfs/dbraw/zinc/96/34/21/340963421.db2.gz FQUIUNZWVMMHAD-UHFFFAOYSA-N 1 2 319.493 4.118 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](CC(C)C)c2cccs2)n1 ZINC000541626064 340978357 /nfs/dbraw/zinc/97/83/57/340978357.db2.gz RGVIOUQOBSEXFN-CYBMUJFWSA-N 1 2 307.463 4.351 20 0 DIADLO COc1cccc([C@H]2C[C@@H](C)CN2c2[nH+]c3ccccc3n2C)c1 ZINC000542203416 340999744 /nfs/dbraw/zinc/99/97/44/340999744.db2.gz AJUMYVGTJVLKER-AUUYWEPGSA-N 1 2 321.424 4.169 20 0 DIADLO COc1cccc([C@@H]2C[C@@H](C)CN2c2[nH]c3ccccc3[nH+]2)c1 ZINC000542205341 340999853 /nfs/dbraw/zinc/99/98/53/340999853.db2.gz NOEHLGXPUQZANQ-ACJLOTCBSA-N 1 2 307.397 4.159 20 0 DIADLO Cc1ccc([C@H]2CCN(C(=O)Nc3ccc(C)[nH+]c3C)C2)cc1 ZINC000542396991 341006653 /nfs/dbraw/zinc/00/66/53/341006653.db2.gz FSDLMBBJXZIRON-KRWDZBQOSA-N 1 2 309.413 4.028 20 0 DIADLO COc1c(C)cnc(C[N@H+](C)Cc2ccc([C@H]3C[C@H]3C)o2)c1C ZINC000542693509 341017578 /nfs/dbraw/zinc/01/75/78/341017578.db2.gz FHYBLPVEWZWFIW-WBMJQRKESA-N 1 2 314.429 4.055 20 0 DIADLO COc1c(C)cnc(C[N@@H+](C)Cc2ccc([C@H]3C[C@H]3C)o2)c1C ZINC000542693509 341017579 /nfs/dbraw/zinc/01/75/79/341017579.db2.gz FHYBLPVEWZWFIW-WBMJQRKESA-N 1 2 314.429 4.055 20 0 DIADLO CCOc1cccc2cc([C@H](C)[NH2+][C@@H](C)c3ccon3)oc21 ZINC000542698548 341017634 /nfs/dbraw/zinc/01/76/34/341017634.db2.gz WFHJWJQVHFWPAP-RYUDHWBXSA-N 1 2 300.358 4.231 20 0 DIADLO Cc1nnc(C[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)s1 ZINC000542811520 341021565 /nfs/dbraw/zinc/02/15/65/341021565.db2.gz MQPOJMLEUDJRTP-MRXNPFEDSA-N 1 2 315.442 4.470 20 0 DIADLO C[N@H+](Cc1ccc(F)c(F)c1)Cc1ncccc1C(F)(F)F ZINC000130449388 341022235 /nfs/dbraw/zinc/02/22/35/341022235.db2.gz NVFNIPJXBHRZMO-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO C[N@@H+](Cc1ccc(F)c(F)c1)Cc1ncccc1C(F)(F)F ZINC000130449388 341022236 /nfs/dbraw/zinc/02/22/36/341022236.db2.gz NVFNIPJXBHRZMO-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000542852681 341023633 /nfs/dbraw/zinc/02/36/33/341023633.db2.gz ABLXJSYFLVLJBW-QGZVFWFLSA-N 1 2 321.342 4.279 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000542852681 341023634 /nfs/dbraw/zinc/02/36/34/341023634.db2.gz ABLXJSYFLVLJBW-QGZVFWFLSA-N 1 2 321.342 4.279 20 0 DIADLO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000130514689 341025386 /nfs/dbraw/zinc/02/53/86/341025386.db2.gz UXXCJLQWWJLNQH-XQQFMLRXSA-N 1 2 320.820 4.165 20 0 DIADLO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000130514689 341025387 /nfs/dbraw/zinc/02/53/87/341025387.db2.gz UXXCJLQWWJLNQH-XQQFMLRXSA-N 1 2 320.820 4.165 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@@H+]2Cc3ccccc3[C@H]2C)cc1F ZINC000543060559 341029825 /nfs/dbraw/zinc/02/98/25/341029825.db2.gz KHDQPSZTBBBRIM-KGLIPLIRSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@H+]2Cc3ccccc3[C@H]2C)cc1F ZINC000543060559 341029826 /nfs/dbraw/zinc/02/98/26/341029826.db2.gz KHDQPSZTBBBRIM-KGLIPLIRSA-N 1 2 312.388 4.038 20 0 DIADLO CC(C)c1ccc([C@@H](C)Sc2[nH+]cnc3c2cnn3C)cc1 ZINC000543149952 341034371 /nfs/dbraw/zinc/03/43/71/341034371.db2.gz KVVLLDHBFJEGBS-GFCCVEGCSA-N 1 2 312.442 4.340 20 0 DIADLO C[C@H]1c2c(F)cccc2CC[N@H+]1Cc1nc(C2CC2)cs1 ZINC000543207865 341036831 /nfs/dbraw/zinc/03/68/31/341036831.db2.gz VCPFBUWAHTYHTF-NSHDSACASA-N 1 2 302.418 4.279 20 0 DIADLO C[C@H]1c2c(F)cccc2CC[N@@H+]1Cc1nc(C2CC2)cs1 ZINC000543207865 341036832 /nfs/dbraw/zinc/03/68/32/341036832.db2.gz VCPFBUWAHTYHTF-NSHDSACASA-N 1 2 302.418 4.279 20 0 DIADLO C[C@@H]1c2c(F)cccc2CC[N@H+]1Cc1nc(C2CC2)cs1 ZINC000543207862 341036913 /nfs/dbraw/zinc/03/69/13/341036913.db2.gz VCPFBUWAHTYHTF-LLVKDONJSA-N 1 2 302.418 4.279 20 0 DIADLO C[C@@H]1c2c(F)cccc2CC[N@@H+]1Cc1nc(C2CC2)cs1 ZINC000543207862 341036914 /nfs/dbraw/zinc/03/69/14/341036914.db2.gz VCPFBUWAHTYHTF-LLVKDONJSA-N 1 2 302.418 4.279 20 0 DIADLO CCc1cnc(C[N@@H+]2CCSC[C@@H]2c2ccc(C)cc2)s1 ZINC000543394590 341041827 /nfs/dbraw/zinc/04/18/27/341041827.db2.gz UFLOSRXIQQSPEO-MRXNPFEDSA-N 1 2 318.511 4.304 20 0 DIADLO CCc1cnc(C[N@H+]2CCSC[C@@H]2c2ccc(C)cc2)s1 ZINC000543394590 341041828 /nfs/dbraw/zinc/04/18/28/341041828.db2.gz UFLOSRXIQQSPEO-MRXNPFEDSA-N 1 2 318.511 4.304 20 0 DIADLO CCc1ccccc1C[NH2+][C@H](c1ccc(F)cc1)c1cnccn1 ZINC000543403619 341042478 /nfs/dbraw/zinc/04/24/78/341042478.db2.gz VYSYUAZYRBOWCQ-HXUWFJFHSA-N 1 2 321.399 4.057 20 0 DIADLO Cc1cccc(C[NH2+][C@@H](c2cccnc2)c2ccc(F)c(C)c2)n1 ZINC000543408327 341042694 /nfs/dbraw/zinc/04/26/94/341042694.db2.gz FXDGZHLVKCSIPU-HXUWFJFHSA-N 1 2 321.399 4.112 20 0 DIADLO Fc1cccc(-c2cnc(C[NH2+][C@@H](c3cccnc3)C3CC3)o2)c1 ZINC000543448134 341045232 /nfs/dbraw/zinc/04/52/32/341045232.db2.gz UVMACMRPJAIXFP-LJQANCHMSA-N 1 2 323.371 4.117 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+][C@H](C)c2ncc(C(C)(C)C)o2)cn1 ZINC000543504465 341047758 /nfs/dbraw/zinc/04/77/58/341047758.db2.gz UPMJQZPWMIIFRC-QWHCGFSZSA-N 1 2 304.438 4.161 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@H](c2ccccc2)c2cncnc2)o1 ZINC000543600161 341050530 /nfs/dbraw/zinc/05/05/30/341050530.db2.gz CDCUMKLXDDXVNE-HEFCMCLBSA-N 1 2 319.408 4.072 20 0 DIADLO CCCCCOc1ccc([C@@H](C)[NH2+]Cc2nnc(C)s2)cc1 ZINC000543739735 341056116 /nfs/dbraw/zinc/05/61/16/341056116.db2.gz HSMLFUHXBMEUNC-CYBMUJFWSA-N 1 2 319.474 4.266 20 0 DIADLO Fc1cccc(Cl)c1C[N@@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000072031782 341057392 /nfs/dbraw/zinc/05/73/92/341057392.db2.gz LIRQIDTVVISIAZ-CQSZACIVSA-N 1 2 323.795 4.253 20 0 DIADLO Fc1cccc(Cl)c1C[N@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000072031782 341057393 /nfs/dbraw/zinc/05/73/93/341057393.db2.gz LIRQIDTVVISIAZ-CQSZACIVSA-N 1 2 323.795 4.253 20 0 DIADLO Cc1cc(-c2noc(C[N@@H+]3Cc4ccccc4[C@@H]3C)n2)ccc1F ZINC000543988827 341065392 /nfs/dbraw/zinc/06/53/92/341065392.db2.gz JHCGWUQXVRXBAT-ZDUSSCGKSA-N 1 2 323.371 4.261 20 0 DIADLO Cc1cc(-c2noc(C[N@H+]3Cc4ccccc4[C@@H]3C)n2)ccc1F ZINC000543988827 341065393 /nfs/dbraw/zinc/06/53/93/341065393.db2.gz JHCGWUQXVRXBAT-ZDUSSCGKSA-N 1 2 323.371 4.261 20 0 DIADLO Cn1c(-c2cc(-n3cc[nH+]c3)cs2)nc2cccc(Cl)c21 ZINC000544055550 341068425 /nfs/dbraw/zinc/06/84/25/341068425.db2.gz WUOOIAMXDTWVFP-UHFFFAOYSA-N 1 2 314.801 4.141 20 0 DIADLO COc1cccc([C@@H]2C[C@@H](C)CN2c2cc(C)[nH+]c(C3CC3)n2)c1 ZINC000544068917 341069000 /nfs/dbraw/zinc/06/90/00/341069000.db2.gz FTQCKBPNRGWCRS-ACJLOTCBSA-N 1 2 323.440 4.259 20 0 DIADLO CC[C@@H](C)Oc1ccc(-c2nc(Cc3ccc(C)[nH+]c3)no2)cc1 ZINC000544188505 341073766 /nfs/dbraw/zinc/07/37/66/341073766.db2.gz AKNPVHLBZLMJKB-CQSZACIVSA-N 1 2 323.396 4.208 20 0 DIADLO CCCCn1cc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c(C)n1 ZINC000544381707 341079362 /nfs/dbraw/zinc/07/93/62/341079362.db2.gz GCZKAWVDTFMEGB-HXUWFJFHSA-N 1 2 323.440 4.464 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@@H](CC(C)C)c2cccs2)n1 ZINC000544449537 341082643 /nfs/dbraw/zinc/08/26/43/341082643.db2.gz PFEKANZLHYFYIU-ZDUSSCGKSA-N 1 2 307.463 4.207 20 0 DIADLO CC(C)C[C@@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1cccs1 ZINC000544448153 341082664 /nfs/dbraw/zinc/08/26/64/341082664.db2.gz BCEBKSNWRLVCQM-DGCLKSJQSA-N 1 2 305.447 4.447 20 0 DIADLO Cc1cccc(C)c1C[NH2+][C@H](C)c1noc(Cc2ccccc2)n1 ZINC000544514416 341084701 /nfs/dbraw/zinc/08/47/01/341084701.db2.gz KLTOSDMLYQYODP-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000544562717 341085694 /nfs/dbraw/zinc/08/56/94/341085694.db2.gz MPOMMJGFMRAFGJ-KDOFPFPSSA-N 1 2 314.429 4.170 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000544562717 341085695 /nfs/dbraw/zinc/08/56/95/341085695.db2.gz MPOMMJGFMRAFGJ-KDOFPFPSSA-N 1 2 314.429 4.170 20 0 DIADLO CC[C@@H]([NH2+][C@H](c1ccccc1)c1cccc(F)c1)c1ccn(C)n1 ZINC000544566415 341085872 /nfs/dbraw/zinc/08/58/72/341085872.db2.gz GLYXTMFXYKLEPX-UYAOXDASSA-N 1 2 323.415 4.390 20 0 DIADLO COc1cc(-c2ccccc2)ccc1C[NH2+][C@@H](C)c1ccon1 ZINC000544617074 341089435 /nfs/dbraw/zinc/08/94/35/341089435.db2.gz KZHUBFGWQWXWNS-AWEZNQCLSA-N 1 2 308.381 4.201 20 0 DIADLO COc1ccccc1-c1ccc(C[NH2+][C@H](C)c2ccon2)cc1 ZINC000544617572 341089544 /nfs/dbraw/zinc/08/95/44/341089544.db2.gz SOUWPBRLOJMWKY-CQSZACIVSA-N 1 2 308.381 4.201 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2CCO[C@@H](C3CCCCC3)C2)s1 ZINC000544625702 341089756 /nfs/dbraw/zinc/08/97/56/341089756.db2.gz HWBSHEYHVJEMGI-MRXNPFEDSA-N 1 2 308.491 4.048 20 0 DIADLO CC(C)c1ncc(C[N@H+]2CCO[C@@H](C3CCCCC3)C2)s1 ZINC000544625702 341089757 /nfs/dbraw/zinc/08/97/57/341089757.db2.gz HWBSHEYHVJEMGI-MRXNPFEDSA-N 1 2 308.491 4.048 20 0 DIADLO C[C@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1ccccc1Cl ZINC000131566962 341096876 /nfs/dbraw/zinc/09/68/76/341096876.db2.gz KVJLIGYWVIGXCT-JTQLQIEISA-N 1 2 304.752 4.471 20 0 DIADLO C[C@H]1CCC[N@@H+]1CC(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000072875086 341109726 /nfs/dbraw/zinc/10/97/26/341109726.db2.gz OZSPHJRRUTWQLQ-QMMMGPOBSA-N 1 2 321.635 4.070 20 0 DIADLO C[C@H](c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1)C(C)(C)C ZINC000544953895 341101054 /nfs/dbraw/zinc/10/10/54/341101054.db2.gz LSRVOEWPDJUVGS-CYBMUJFWSA-N 1 2 310.401 4.131 20 0 DIADLO C[C@H]1CCC[N@H+]1CC(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000072875086 341109727 /nfs/dbraw/zinc/10/97/27/341109727.db2.gz OZSPHJRRUTWQLQ-QMMMGPOBSA-N 1 2 321.635 4.070 20 0 DIADLO Cn1c[nH+]cc1Cc1noc(C=C2CCC(C(C)(C)C)CC2)n1 ZINC000545138960 341110189 /nfs/dbraw/zinc/11/01/89/341110189.db2.gz KKCRVZUAHODFJI-UHFFFAOYSA-N 1 2 314.433 4.014 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)CCCc1cccs1 ZINC000131868365 341112940 /nfs/dbraw/zinc/11/29/40/341112940.db2.gz SDZQBOAIYITGNH-UHFFFAOYSA-N 1 2 318.442 4.282 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@@H]2CCc3c2cc(Cl)cc3Cl)no1 ZINC000132083250 341115963 /nfs/dbraw/zinc/11/59/63/341115963.db2.gz BZXSDDZLXVNDEL-OAHLLOKOSA-N 1 2 311.212 4.409 20 0 DIADLO Cc1cc(C[N@H+](C)[C@@H]2CCc3c2cc(Cl)cc3Cl)no1 ZINC000132083250 341115964 /nfs/dbraw/zinc/11/59/64/341115964.db2.gz BZXSDDZLXVNDEL-OAHLLOKOSA-N 1 2 311.212 4.409 20 0 DIADLO C[C@@H](C(=O)Nc1c[nH+]ccc1OC(C)(C)C)c1cccc(F)c1 ZINC000132116653 341116673 /nfs/dbraw/zinc/11/66/73/341116673.db2.gz TUEWCNHONHCKBW-GFCCVEGCSA-N 1 2 316.376 4.140 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)c(F)c1)c1nc(C(C)(C)C)no1 ZINC000073637237 341119366 /nfs/dbraw/zinc/11/93/66/341119366.db2.gz VURMNGQJILHWKL-NXEZZACHSA-N 1 2 309.360 4.057 20 0 DIADLO Cc1noc(C[NH2+][C@@H](CCCc2ccccc2)c2ccccc2)n1 ZINC000073646189 341119569 /nfs/dbraw/zinc/11/95/69/341119569.db2.gz WSWYYDKBSYDOJL-IBGZPJMESA-N 1 2 321.424 4.232 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](Cc2ccccc2)c2ccccc2)n1 ZINC000073688447 341120059 /nfs/dbraw/zinc/12/00/59/341120059.db2.gz ZJRKREDJSJQSTG-SFHVURJKSA-N 1 2 321.424 4.096 20 0 DIADLO CCCc1noc(C[NH2+][C@H](Cc2ccccc2)c2ccccc2)n1 ZINC000073688449 341120151 /nfs/dbraw/zinc/12/01/51/341120151.db2.gz ZJRKREDJSJQSTG-GOSISDBHSA-N 1 2 321.424 4.096 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCc4ccsc4C3)co2)cc1 ZINC000132466878 341123806 /nfs/dbraw/zinc/12/38/06/341123806.db2.gz BXMBJZMGGPIOHU-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCc4ccsc4C3)co2)cc1 ZINC000132466878 341123807 /nfs/dbraw/zinc/12/38/07/341123807.db2.gz BXMBJZMGGPIOHU-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@H]2c2cccc(Cl)c2)c(C)[nH+]1 ZINC000132534541 341126402 /nfs/dbraw/zinc/12/64/02/341126402.db2.gz QTYWPILMIOVSRI-HOTGVXAUSA-N 1 2 314.816 4.402 20 0 DIADLO c1cn(Cc2cccc(-c3noc(CCC4CCCC4)n3)c2)c[nH+]1 ZINC000545578171 341131284 /nfs/dbraw/zinc/13/12/84/341131284.db2.gz LTPCEAKRRLHBJQ-UHFFFAOYSA-N 1 2 322.412 4.104 20 0 DIADLO C[C@@H](CC1CCCCC1)c1nc(Cc2cn3ccccc3[nH+]2)no1 ZINC000545622567 341133760 /nfs/dbraw/zinc/13/37/60/341133760.db2.gz MIDXKJACHBJQBZ-AWEZNQCLSA-N 1 2 324.428 4.382 20 0 DIADLO CCCc1nc(C[N@H+](C)[C@H](C)c2ccc(OC)cc2)cs1 ZINC000074255252 341139438 /nfs/dbraw/zinc/13/94/38/341139438.db2.gz ZMONVVHTOSAFCV-CYBMUJFWSA-N 1 2 304.459 4.297 20 0 DIADLO CCCc1nc(C[N@@H+](C)[C@H](C)c2ccc(OC)cc2)cs1 ZINC000074255252 341139439 /nfs/dbraw/zinc/13/94/39/341139439.db2.gz ZMONVVHTOSAFCV-CYBMUJFWSA-N 1 2 304.459 4.297 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc(CC2CCCCC2)n1 ZINC000545889716 341144400 /nfs/dbraw/zinc/14/44/00/341144400.db2.gz NNTYZYFBAVEFAV-UHFFFAOYSA-N 1 2 324.428 4.093 20 0 DIADLO Cc1cc(C[NH2+]Cc2ncc(-c3ccccc3)cn2)c(C)s1 ZINC000545895008 341144797 /nfs/dbraw/zinc/14/47/97/341144797.db2.gz HEMQGWDZJVIBQU-UHFFFAOYSA-N 1 2 309.438 4.112 20 0 DIADLO COCC[C@@H](C)Nc1ccc(SCc2ccccc2)c[nH+]1 ZINC000545954662 341148382 /nfs/dbraw/zinc/14/83/82/341148382.db2.gz OXBZDXRAQDZBIV-CQSZACIVSA-N 1 2 302.443 4.211 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@@H](Oc3ccccc3Cl)C2)cs1 ZINC000132963012 341150788 /nfs/dbraw/zinc/15/07/88/341150788.db2.gz OPCQVJJOSDHOGU-CQSZACIVSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@@H](Oc3ccccc3Cl)C2)cs1 ZINC000132963012 341150789 /nfs/dbraw/zinc/15/07/89/341150789.db2.gz OPCQVJJOSDHOGU-CQSZACIVSA-N 1 2 322.861 4.148 20 0 DIADLO C[C@@H]1CC/C(=C\c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)C1 ZINC000546284918 341161105 /nfs/dbraw/zinc/16/11/05/341161105.db2.gz NQVVURCYYZWXPA-XDPMZMSMSA-N 1 2 320.396 4.185 20 0 DIADLO CC1(C)CC[C@@H](c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)C1 ZINC000546285846 341161182 /nfs/dbraw/zinc/16/11/82/341161182.db2.gz VTTVBWGEPUPXFR-MRXNPFEDSA-N 1 2 322.412 4.275 20 0 DIADLO Cc1cc(C)cc(C2(c3nc(Cc4ccc(C)[nH+]c4)no3)CC2)c1 ZINC000546344138 341164269 /nfs/dbraw/zinc/16/42/69/341164269.db2.gz QDANVQNDSMOVJD-UHFFFAOYSA-N 1 2 319.408 4.061 20 0 DIADLO C/C(=C\c1ccc(C)cc1)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000546345960 341164468 /nfs/dbraw/zinc/16/44/68/341164468.db2.gz INJYYXRKAQZSPE-GXDHUFHOSA-N 1 2 305.381 4.233 20 0 DIADLO Cc1ccc(Cc2noc(-c3ccc(OC(C)(C)C)cc3)n2)c[nH+]1 ZINC000546351375 341164759 /nfs/dbraw/zinc/16/47/59/341164759.db2.gz KLDPNTZXWQLFIC-UHFFFAOYSA-N 1 2 323.396 4.208 20 0 DIADLO C[C@@H]1CCCC[C@H]1c1noc(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC000546396894 341166528 /nfs/dbraw/zinc/16/65/28/341166528.db2.gz ITLPTLVZTKZJBG-RHSMWYFYSA-N 1 2 322.412 4.275 20 0 DIADLO CCC1(c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)CCCC1 ZINC000546403698 341166861 /nfs/dbraw/zinc/16/68/61/341166861.db2.gz SFDRTPBNTHOHLN-UHFFFAOYSA-N 1 2 308.385 4.144 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cc(C)c(O)c(C)c2)c1 ZINC000564304304 341173481 /nfs/dbraw/zinc/17/34/81/341173481.db2.gz SDFMWPYEWMFBRA-UHFFFAOYSA-N 1 2 302.443 4.269 20 0 DIADLO Cc1ccc(Cc2noc(Cc3ccc4ccccc4c3)n2)c[nH+]1 ZINC000547051918 341193823 /nfs/dbraw/zinc/19/38/23/341193823.db2.gz YPJQNYZSUMTQKW-UHFFFAOYSA-N 1 2 315.376 4.108 20 0 DIADLO Cc1ccc(-c2noc([C@H]3CC34CCCC4)n2)c(N2CCCC2)[nH+]1 ZINC000547079188 341194875 /nfs/dbraw/zinc/19/48/75/341194875.db2.gz RHHQLLSIWPYOPQ-OAHLLOKOSA-N 1 2 324.428 4.088 20 0 DIADLO Cc1cccn2cc(Cc3noc(C(C)(C)C4CCCC4)n3)[nH+]c12 ZINC000547091192 341195493 /nfs/dbraw/zinc/19/54/93/341195493.db2.gz NNOFKUJKLUDZNF-UHFFFAOYSA-N 1 2 324.428 4.084 20 0 DIADLO CC[C@H](C)Oc1ccc(-c2noc(Cc3ccc(C)[nH+]c3)n2)cc1 ZINC000547164264 341199276 /nfs/dbraw/zinc/19/92/76/341199276.db2.gz LOHQCFZCMUQVDT-AWEZNQCLSA-N 1 2 323.396 4.208 20 0 DIADLO Cc1ccc2[nH+]c(CNc3ccccc3CC(F)(F)F)cn2c1 ZINC000134006972 341204482 /nfs/dbraw/zinc/20/44/82/341204482.db2.gz LJUMGODMSTVHBG-UHFFFAOYSA-N 1 2 319.330 4.360 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cccc(CC(F)(F)F)c3)cn2c1 ZINC000134020905 341204752 /nfs/dbraw/zinc/20/47/52/341204752.db2.gz LLRCOLQOXYZPAF-UHFFFAOYSA-N 1 2 319.330 4.360 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)[C@@H]2CCc3ccccc32)cs1 ZINC000076718097 341212938 /nfs/dbraw/zinc/21/29/38/341212938.db2.gz WPDULEBFYKJVGJ-SUMWQHHRSA-N 1 2 316.470 4.360 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)[C@@H]2CCc3ccccc32)cs1 ZINC000076718097 341212939 /nfs/dbraw/zinc/21/29/39/341212939.db2.gz WPDULEBFYKJVGJ-SUMWQHHRSA-N 1 2 316.470 4.360 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+]1Cc2ccccc2C2(CC2)C1 ZINC000547524985 341220473 /nfs/dbraw/zinc/22/04/73/341220473.db2.gz IFFCUWPGWPJQRL-UHFFFAOYSA-N 1 2 317.436 4.104 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000547524985 341220474 /nfs/dbraw/zinc/22/04/74/341220474.db2.gz IFFCUWPGWPJQRL-UHFFFAOYSA-N 1 2 317.436 4.104 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+][C@@H](C)c1nc2c(s1)CCC2 ZINC000134829614 341224836 /nfs/dbraw/zinc/22/48/36/341224836.db2.gz LOMHGAJTONWBKE-JTQLQIEISA-N 1 2 322.861 4.145 20 0 DIADLO COc1ccc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)nc1 ZINC000547671890 341226469 /nfs/dbraw/zinc/22/64/69/341226469.db2.gz GVURFTPFUYCGIB-CYBMUJFWSA-N 1 2 316.832 4.469 20 0 DIADLO COc1ccc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)nc1 ZINC000547671890 341226470 /nfs/dbraw/zinc/22/64/70/341226470.db2.gz GVURFTPFUYCGIB-CYBMUJFWSA-N 1 2 316.832 4.469 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cccc3c2OC(C)(C)C3)s1 ZINC000134910930 341226641 /nfs/dbraw/zinc/22/66/41/341226641.db2.gz NGDDFBXNEIPZNT-LBPRGKRZSA-N 1 2 302.443 4.016 20 0 DIADLO Brc1cccc(C[N@H+](Cc2nccs2)C2CC2)c1 ZINC000134960549 341227416 /nfs/dbraw/zinc/22/74/16/341227416.db2.gz IGNVLFUMUCBANW-UHFFFAOYSA-N 1 2 323.259 4.070 20 0 DIADLO Brc1cccc(C[N@@H+](Cc2nccs2)C2CC2)c1 ZINC000134960549 341227417 /nfs/dbraw/zinc/22/74/17/341227417.db2.gz IGNVLFUMUCBANW-UHFFFAOYSA-N 1 2 323.259 4.070 20 0 DIADLO CCc1cc(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)oc1CC ZINC000135061607 341230290 /nfs/dbraw/zinc/23/02/90/341230290.db2.gz PXWLHQNIWSWXKH-UHFFFAOYSA-N 1 2 323.396 4.057 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000547973587 341241367 /nfs/dbraw/zinc/24/13/67/341241367.db2.gz FPQBFNQMCBZDEL-KPZWWZAWSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000547973587 341241368 /nfs/dbraw/zinc/24/13/68/341241368.db2.gz FPQBFNQMCBZDEL-KPZWWZAWSA-N 1 2 321.342 4.238 20 0 DIADLO Fc1ccc(C[NH2+]Cc2ccc(Cl)o2)c(Br)c1 ZINC000547972261 341241443 /nfs/dbraw/zinc/24/14/43/341241443.db2.gz PDWQBBUIIFOKNK-UHFFFAOYSA-N 1 2 318.573 4.124 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000547973590 341241460 /nfs/dbraw/zinc/24/14/60/341241460.db2.gz FPQBFNQMCBZDEL-XIKOKIGWSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000547973590 341241461 /nfs/dbraw/zinc/24/14/61/341241461.db2.gz FPQBFNQMCBZDEL-XIKOKIGWSA-N 1 2 321.342 4.238 20 0 DIADLO O=C(C[C@@H]1CCC[N@H+]1Cc1c(F)cccc1F)c1cccs1 ZINC000548065583 341245417 /nfs/dbraw/zinc/24/54/17/341245417.db2.gz UVZFNHKXAOYRMI-LBPRGKRZSA-N 1 2 321.392 4.264 20 0 DIADLO O=C(C[C@@H]1CCC[N@@H+]1Cc1c(F)cccc1F)c1cccs1 ZINC000548065583 341245418 /nfs/dbraw/zinc/24/54/18/341245418.db2.gz UVZFNHKXAOYRMI-LBPRGKRZSA-N 1 2 321.392 4.264 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)c(F)cc1F)c1ccc(F)cc1F ZINC000135810725 341246480 /nfs/dbraw/zinc/24/64/80/341246480.db2.gz DQLXGRXFFOHNEI-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c(OC)c1 ZINC000078968822 341250821 /nfs/dbraw/zinc/25/08/21/341250821.db2.gz QRDJXLLLXYLTSS-NWDGAFQWSA-N 1 2 321.367 4.394 20 0 DIADLO CC(C)([NH2+]Cc1cnc(C2CCCC2)s1)c1nccs1 ZINC000136159962 341254029 /nfs/dbraw/zinc/25/40/29/341254029.db2.gz MJUILFSTJSFMEK-UHFFFAOYSA-N 1 2 307.488 4.282 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)Nc3cccc(C)c3C)ccc2n1C ZINC000548301775 341254989 /nfs/dbraw/zinc/25/49/89/341254989.db2.gz NQRRDGVJUYRMGX-UHFFFAOYSA-N 1 2 308.385 4.143 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000548300357 341255068 /nfs/dbraw/zinc/25/50/68/341255068.db2.gz DLYNHDXWDITAGY-KPZWWZAWSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000548300357 341255069 /nfs/dbraw/zinc/25/50/69/341255069.db2.gz DLYNHDXWDITAGY-KPZWWZAWSA-N 1 2 321.342 4.238 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2ccc(F)cc2Cl)o1 ZINC000136215976 341255092 /nfs/dbraw/zinc/25/50/92/341255092.db2.gz MSJLVDNSCRJODH-HNNXBMFYSA-N 1 2 311.784 4.112 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)C[NH+]2[C@@H](C)C[C@@H]2C)cc1 ZINC000548425504 341259989 /nfs/dbraw/zinc/25/99/89/341259989.db2.gz NMPSKVFJOFSAEU-HOTGVXAUSA-N 1 2 324.424 4.209 20 0 DIADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1cc(Br)ccc1OC(F)F ZINC000548425908 341259995 /nfs/dbraw/zinc/25/99/95/341259995.db2.gz OYQRGFZDEJWWGR-RKDXNWHRSA-N 1 2 320.177 4.033 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+]1C[C@@H](C)O[C@H](C2CC2)C1 ZINC000548425632 341260122 /nfs/dbraw/zinc/26/01/22/341260122.db2.gz WDBOLFJIYWOMHD-WQGACYEGSA-N 1 2 324.262 4.009 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+]1C[C@@H](C)O[C@H](C2CC2)C1 ZINC000548425632 341260123 /nfs/dbraw/zinc/26/01/23/341260123.db2.gz WDBOLFJIYWOMHD-WQGACYEGSA-N 1 2 324.262 4.009 20 0 DIADLO COC(=O)c1ccc(Cl)c(NCc2ccc(C)[nH+]c2C)c1C ZINC000548467486 341262152 /nfs/dbraw/zinc/26/21/52/341262152.db2.gz YNQFXMFTSZUUDI-UHFFFAOYSA-N 1 2 318.804 4.059 20 0 DIADLO CCc1ccc(CC)c(NC(=O)c2ccn3c(C)c[nH+]c3c2)c1 ZINC000564352879 341263859 /nfs/dbraw/zinc/26/38/59/341263859.db2.gz XOTNKGCBJKKWFE-UHFFFAOYSA-N 1 2 307.397 4.020 20 0 DIADLO CC[C@@]1(C)COCC[N@@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000548504964 341264725 /nfs/dbraw/zinc/26/47/25/341264725.db2.gz OCRLGFGDGJXNGA-KRWDZBQOSA-N 1 2 308.491 4.192 20 0 DIADLO CC[C@@]1(C)COCC[N@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000548504964 341264726 /nfs/dbraw/zinc/26/47/26/341264726.db2.gz OCRLGFGDGJXNGA-KRWDZBQOSA-N 1 2 308.491 4.192 20 0 DIADLO CCc1cnccc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000136746666 341266402 /nfs/dbraw/zinc/26/64/02/341266402.db2.gz ABNOFUKSHQDASE-UHFFFAOYSA-N 1 2 319.364 4.084 20 0 DIADLO COC[C@@H]([NH2+]Cc1cccc(Cl)c1Cl)c1ccc(C)o1 ZINC000080238531 341271332 /nfs/dbraw/zinc/27/13/32/341271332.db2.gz ZYJCLRJFCCABHV-CYBMUJFWSA-N 1 2 314.212 4.372 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](C)Cc2csc(C3CC3)n2)c1 ZINC000137175187 341273241 /nfs/dbraw/zinc/27/32/41/341273241.db2.gz DUNADGMWHOLNJC-UHFFFAOYSA-N 1 2 316.470 4.440 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2csc(C3CC3)n2)c1 ZINC000137175187 341273242 /nfs/dbraw/zinc/27/32/42/341273242.db2.gz DUNADGMWHOLNJC-UHFFFAOYSA-N 1 2 316.470 4.440 20 0 DIADLO O=C(C/C=C/c1ccc(F)cc1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000080611365 341274155 /nfs/dbraw/zinc/27/41/55/341274155.db2.gz NDSXCYQHVRJVJI-OWOJBTEDSA-N 1 2 321.355 4.258 20 0 DIADLO CCn1cc[nH+]c1CNc1cccc(OCCc2ccccc2)c1 ZINC000548780156 341275375 /nfs/dbraw/zinc/27/53/75/341275375.db2.gz CNSNIPRNBDPCOW-UHFFFAOYSA-N 1 2 321.424 4.137 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@@H](C)c3cnn(C4CCCC4)c3)[nH]c2c1 ZINC000548858071 341278339 /nfs/dbraw/zinc/27/83/39/341278339.db2.gz AKOJLFRIBIPQQG-AWEZNQCLSA-N 1 2 323.444 4.034 20 0 DIADLO O=C(NC1CCCCCC1)c1ccccc1Oc1cc[nH+]cc1 ZINC000548935590 341281458 /nfs/dbraw/zinc/28/14/58/341281458.db2.gz QJMSMTCOIYBNGO-UHFFFAOYSA-N 1 2 310.397 4.327 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000548941552 341281931 /nfs/dbraw/zinc/28/19/31/341281931.db2.gz XUTRGTWLQCIBKA-DYVFJYSZSA-N 1 2 304.796 4.367 20 0 DIADLO C[C@H](c1cccnc1)[N@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000548941552 341281932 /nfs/dbraw/zinc/28/19/32/341281932.db2.gz XUTRGTWLQCIBKA-DYVFJYSZSA-N 1 2 304.796 4.367 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@@H](C)Cn2cccn2)c1 ZINC000137885769 341282624 /nfs/dbraw/zinc/28/26/24/341282624.db2.gz JWNFJTNBTJVLOJ-INIZCTEOSA-N 1 2 323.444 4.047 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@@H+]1CC[C@H](OC(F)F)C1 ZINC000549080765 341285607 /nfs/dbraw/zinc/28/56/07/341285607.db2.gz FUNOIGGWBZTDEW-SCZZXKLOSA-N 1 2 310.171 4.368 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@H+]1CC[C@H](OC(F)F)C1 ZINC000549080765 341285608 /nfs/dbraw/zinc/28/56/08/341285608.db2.gz FUNOIGGWBZTDEW-SCZZXKLOSA-N 1 2 310.171 4.368 20 0 DIADLO CC(C)(C)c1[nH]c2ccc(NC(=O)c3sccc3F)cc2[nH+]1 ZINC000549119413 341286365 /nfs/dbraw/zinc/28/63/65/341286365.db2.gz UOOOBYYLBWOMEA-UHFFFAOYSA-N 1 2 317.389 4.313 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000549180375 341288075 /nfs/dbraw/zinc/28/80/75/341288075.db2.gz LRMMPEBDASQSSF-DYVFJYSZSA-N 1 2 304.796 4.367 20 0 DIADLO C[C@H](c1ccccn1)[N@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000549180375 341288076 /nfs/dbraw/zinc/28/80/76/341288076.db2.gz LRMMPEBDASQSSF-DYVFJYSZSA-N 1 2 304.796 4.367 20 0 DIADLO Cc1csc(C[N@@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)n1 ZINC000245410472 341291883 /nfs/dbraw/zinc/29/18/83/341291883.db2.gz REFLUKVBVAZVCS-ABAIWWIYSA-N 1 2 302.443 4.333 20 0 DIADLO Cc1csc(C[N@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)n1 ZINC000245410472 341291884 /nfs/dbraw/zinc/29/18/84/341291884.db2.gz REFLUKVBVAZVCS-ABAIWWIYSA-N 1 2 302.443 4.333 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](Cc2sccc2Cl)CCO1 ZINC000549352191 341292233 /nfs/dbraw/zinc/29/22/33/341292233.db2.gz YFKXHWPPLIDOQJ-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2sccc2Cl)CCO1 ZINC000549352191 341292234 /nfs/dbraw/zinc/29/22/34/341292234.db2.gz YFKXHWPPLIDOQJ-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc(-c3ccc(F)cc3)no2)[C@H]1c1ccccc1 ZINC000245422474 341292724 /nfs/dbraw/zinc/29/27/24/341292724.db2.gz IWCBXPZQXRUIQG-FZKQIMNGSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc(-c3ccc(F)cc3)no2)[C@H]1c1ccccc1 ZINC000245422474 341292725 /nfs/dbraw/zinc/29/27/25/341292725.db2.gz IWCBXPZQXRUIQG-FZKQIMNGSA-N 1 2 323.371 4.069 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2csc([C@H](C)OC)n2)cc1 ZINC000245461785 341295480 /nfs/dbraw/zinc/29/54/80/341295480.db2.gz GCHDIZHGKDNNNM-OLZOCXBDSA-N 1 2 320.458 4.052 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2csc([C@H](C)OC)n2)cc1 ZINC000245461785 341295481 /nfs/dbraw/zinc/29/54/81/341295481.db2.gz GCHDIZHGKDNNNM-OLZOCXBDSA-N 1 2 320.458 4.052 20 0 DIADLO C[C@H]1C[N@H+](Cc2nccn2Cc2ccccc2)[C@@H]1c1ccccc1 ZINC000081574820 341297203 /nfs/dbraw/zinc/29/72/03/341297203.db2.gz QQYRLQXCUXUZPU-UWJYYQICSA-N 1 2 317.436 4.124 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nccn2Cc2ccccc2)[C@@H]1c1ccccc1 ZINC000081574820 341297204 /nfs/dbraw/zinc/29/72/04/341297204.db2.gz QQYRLQXCUXUZPU-UWJYYQICSA-N 1 2 317.436 4.124 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(-c3ccccn3)n2)[C@@H]1c1ccccc1 ZINC000081574792 341297211 /nfs/dbraw/zinc/29/72/11/341297211.db2.gz ZUIIWIHNMCIKQN-KSSFIOAISA-N 1 2 321.449 4.398 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(-c3ccccn3)n2)[C@@H]1c1ccccc1 ZINC000081574792 341297212 /nfs/dbraw/zinc/29/72/12/341297212.db2.gz ZUIIWIHNMCIKQN-KSSFIOAISA-N 1 2 321.449 4.398 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1nc(C)c(C)s1 ZINC000081645496 341300533 /nfs/dbraw/zinc/30/05/33/341300533.db2.gz OQXISAONWJYIBR-UHFFFAOYSA-N 1 2 300.880 4.497 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1nc(C)c(C)s1 ZINC000081645496 341300534 /nfs/dbraw/zinc/30/05/34/341300534.db2.gz OQXISAONWJYIBR-UHFFFAOYSA-N 1 2 300.880 4.497 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000245540100 341300748 /nfs/dbraw/zinc/30/07/48/341300748.db2.gz HZSKNZUJLNISNM-VCBZYWHSSA-N 1 2 322.408 4.351 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000245540100 341300749 /nfs/dbraw/zinc/30/07/49/341300749.db2.gz HZSKNZUJLNISNM-VCBZYWHSSA-N 1 2 322.408 4.351 20 0 DIADLO CCCOc1c(Cl)cc(C[NH2+]CC(C)(F)F)cc1OCC ZINC000549863011 341305357 /nfs/dbraw/zinc/30/53/57/341305357.db2.gz MXKHXUYLLDTLGG-UHFFFAOYSA-N 1 2 321.795 4.272 20 0 DIADLO Cc1ncsc1C[N@H+]1C[C@@H](c2ccccc2Cl)OC[C@H]1C ZINC000245708528 341311057 /nfs/dbraw/zinc/31/10/57/341311057.db2.gz FMELWGUAPQGXNP-ABAIWWIYSA-N 1 2 322.861 4.067 20 0 DIADLO Cc1ncsc1C[N@@H+]1C[C@@H](c2ccccc2Cl)OC[C@H]1C ZINC000245708528 341311058 /nfs/dbraw/zinc/31/10/58/341311058.db2.gz FMELWGUAPQGXNP-ABAIWWIYSA-N 1 2 322.861 4.067 20 0 DIADLO COc1ccc(F)c(C[NH2+]Cc2cc(F)c(Cl)cc2F)c1 ZINC000550212879 341312588 /nfs/dbraw/zinc/31/25/88/341312588.db2.gz AYQPEXYNBKOUQP-UHFFFAOYSA-N 1 2 315.722 4.056 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3c(C)coc3C)cc2[nH+]1 ZINC000550212610 341312670 /nfs/dbraw/zinc/31/26/70/341312670.db2.gz VPBCIOLKPLXVOP-UHFFFAOYSA-N 1 2 311.385 4.368 20 0 DIADLO C[C@@H]1C[C@@H]1[C@@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000245860390 341316476 /nfs/dbraw/zinc/31/64/76/341316476.db2.gz HVAYRIJNDZYEIR-OOVXXXAESA-N 1 2 317.820 4.087 20 0 DIADLO Cc1cccc([C@H](C)[N@@H+]2Cc3cnn(-c4ccccc4)c3C2)c1 ZINC000550525111 341318047 /nfs/dbraw/zinc/31/80/47/341318047.db2.gz WMXVGZBHKQBAPC-INIZCTEOSA-N 1 2 303.409 4.258 20 0 DIADLO Cc1cccc([C@H](C)[N@H+]2Cc3cnn(-c4ccccc4)c3C2)c1 ZINC000550525111 341318048 /nfs/dbraw/zinc/31/80/48/341318048.db2.gz WMXVGZBHKQBAPC-INIZCTEOSA-N 1 2 303.409 4.258 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)n1 ZINC000245920929 341318293 /nfs/dbraw/zinc/31/82/93/341318293.db2.gz QRUHQRMCBXRDMU-YHYOWMERSA-N 1 2 319.836 4.333 20 0 DIADLO C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1Cc2cccnc2C1 ZINC000551045379 341330033 /nfs/dbraw/zinc/33/00/33/341330033.db2.gz NRLRJDBWAXTQKU-NSHDSACASA-N 1 2 308.303 4.057 20 0 DIADLO C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1Cc2cccnc2C1 ZINC000551045379 341330034 /nfs/dbraw/zinc/33/00/34/341330034.db2.gz NRLRJDBWAXTQKU-NSHDSACASA-N 1 2 308.303 4.057 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc([C@H]2C[C@@H]2C2CC2)n1 ZINC000551052898 341330361 /nfs/dbraw/zinc/33/03/61/341330361.db2.gz QAOPCXXSEVGJGR-KGLIPLIRSA-N 1 2 322.412 4.105 20 0 DIADLO COC(C)(C)CCOc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000551360807 341339438 /nfs/dbraw/zinc/33/94/38/341339438.db2.gz OQOGONNCCFNYLG-UHFFFAOYSA-N 1 2 314.429 4.080 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1ccc(C(F)(F)F)cn1 ZINC000551382425 341340018 /nfs/dbraw/zinc/34/00/18/341340018.db2.gz ZCKCENYTIHOBOA-NSHDSACASA-N 1 2 312.310 4.433 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccc(C(F)(F)F)cn1 ZINC000551382425 341340019 /nfs/dbraw/zinc/34/00/19/341340019.db2.gz ZCKCENYTIHOBOA-NSHDSACASA-N 1 2 312.310 4.433 20 0 DIADLO CC[C@@H]1CCCC[C@H]1c1noc(Cn2c(C)[nH+]c3ccccc32)n1 ZINC000551536070 341344666 /nfs/dbraw/zinc/34/46/66/341344666.db2.gz PCTQYZVVROLLEC-HUUCEWRRSA-N 1 2 324.428 4.460 20 0 DIADLO Cc1ccc2nc(C[NH2+]Cc3cccc(Cl)c3Cl)cn2c1 ZINC000551537007 341344679 /nfs/dbraw/zinc/34/46/79/341344679.db2.gz YACOUNVZJADUJJ-UHFFFAOYSA-N 1 2 320.223 4.239 20 0 DIADLO Cc1ccc2[nH+]c(CNCc3cccc(Cl)c3Cl)cn2c1 ZINC000551537007 341344680 /nfs/dbraw/zinc/34/46/80/341344680.db2.gz YACOUNVZJADUJJ-UHFFFAOYSA-N 1 2 320.223 4.239 20 0 DIADLO Fc1ccc(F)c(C[N@H+](Cc2cscn2)C2CCCC2)c1 ZINC000083691223 341354614 /nfs/dbraw/zinc/35/46/14/341354614.db2.gz NBOBEQBZGHDBBC-UHFFFAOYSA-N 1 2 308.397 4.366 20 0 DIADLO Fc1ccc(F)c(C[N@@H+](Cc2cscn2)C2CCCC2)c1 ZINC000083691223 341354615 /nfs/dbraw/zinc/35/46/15/341354615.db2.gz NBOBEQBZGHDBBC-UHFFFAOYSA-N 1 2 308.397 4.366 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@@H]2CCC2CCCC2)c(C)c[nH+]1 ZINC000551991936 341358073 /nfs/dbraw/zinc/35/80/73/341358073.db2.gz UALHUGIFRURWFJ-QGZVFWFLSA-N 1 2 315.461 4.087 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)[C@H]2CCc3ccccc32)cs1 ZINC000247051300 341360389 /nfs/dbraw/zinc/36/03/89/341360389.db2.gz WPDULEBFYKJVGJ-DYVFJYSZSA-N 1 2 316.470 4.360 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)[C@H]2CCc3ccccc32)cs1 ZINC000247051300 341360390 /nfs/dbraw/zinc/36/03/90/341360390.db2.gz WPDULEBFYKJVGJ-DYVFJYSZSA-N 1 2 316.470 4.360 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+]1CCO[C@@H](c2cccc(O)c2)C1 ZINC000247197051 341362083 /nfs/dbraw/zinc/36/20/83/341362083.db2.gz UTUNFFZFUNXTDJ-FZKQIMNGSA-N 1 2 317.816 4.180 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+]1CCO[C@@H](c2cccc(O)c2)C1 ZINC000247197051 341362084 /nfs/dbraw/zinc/36/20/84/341362084.db2.gz UTUNFFZFUNXTDJ-FZKQIMNGSA-N 1 2 317.816 4.180 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@@H](c2cccc(O)c2)C1 ZINC000247242400 341362638 /nfs/dbraw/zinc/36/26/38/341362638.db2.gz XRCLBIWTRNAGBI-SCLBCKFNSA-N 1 2 317.816 4.180 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCO[C@@H](c2cccc(O)c2)C1 ZINC000247242400 341362639 /nfs/dbraw/zinc/36/26/39/341362639.db2.gz XRCLBIWTRNAGBI-SCLBCKFNSA-N 1 2 317.816 4.180 20 0 DIADLO CC[C@H]([NH2+]C1(C(F)F)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000552053714 341365339 /nfs/dbraw/zinc/36/53/39/341365339.db2.gz SZBMXJMRLSUVKR-NSHDSACASA-N 1 2 309.278 4.424 20 0 DIADLO C[C@@H](Nc1ccc2nc(C(C)(C)C)sc2c1)c1[nH]cc[nH+]1 ZINC000552065827 341366785 /nfs/dbraw/zinc/36/67/85/341366785.db2.gz PABKELUWFKAUQE-SNVBAGLBSA-N 1 2 300.431 4.490 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247659742 341368376 /nfs/dbraw/zinc/36/83/76/341368376.db2.gz XJZAYPOVBWDYQU-XHDPSFHLSA-N 1 2 309.381 4.161 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247659742 341368377 /nfs/dbraw/zinc/36/83/77/341368377.db2.gz XJZAYPOVBWDYQU-XHDPSFHLSA-N 1 2 309.381 4.161 20 0 DIADLO Cc1nc(C[N@H+]2C[C@@H](c3cc(C)ccc3C)OC[C@@H]2C)cs1 ZINC000247694408 341369256 /nfs/dbraw/zinc/36/92/56/341369256.db2.gz WKKUIMUPCWSJTF-KSSFIOAISA-N 1 2 316.470 4.030 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@@H](c3cc(C)ccc3C)OC[C@@H]2C)cs1 ZINC000247694408 341369257 /nfs/dbraw/zinc/36/92/57/341369257.db2.gz WKKUIMUPCWSJTF-KSSFIOAISA-N 1 2 316.470 4.030 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1CC2CCC1CC2 ZINC000552111218 341370409 /nfs/dbraw/zinc/37/04/09/341370409.db2.gz GVGUJZHSDMYGNQ-ZBCRRDGASA-N 1 2 309.413 4.150 20 0 DIADLO CC1(C)CC(C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)C1 ZINC000552198443 341377800 /nfs/dbraw/zinc/37/78/00/341377800.db2.gz WBFGYOSHBBHNLC-UHFFFAOYSA-N 1 2 323.440 4.261 20 0 DIADLO C[NH+](C)[C@@H](C(=O)Nc1ccccc1Cl)c1cccc(Cl)c1 ZINC000552250753 341381320 /nfs/dbraw/zinc/38/13/20/341381320.db2.gz ZQCSAJDKPJWQLF-OAHLLOKOSA-N 1 2 323.223 4.235 20 0 DIADLO Cc1ccnc([C@H](C)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)c1 ZINC000552289699 341384492 /nfs/dbraw/zinc/38/44/92/341384492.db2.gz HNUDJWIQWPWXIF-ZDUSSCGKSA-N 1 2 312.804 4.402 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)c(F)cc1Br)c1ccoc1 ZINC000552338980 341387657 /nfs/dbraw/zinc/38/76/57/341387657.db2.gz VCIQVBVMAGNOPL-QMMMGPOBSA-N 1 2 316.145 4.171 20 0 DIADLO Cc1ccc(CCC(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)c(C)c1 ZINC000552344153 341388234 /nfs/dbraw/zinc/38/82/34/341388234.db2.gz ZPSKVLTVKAOGGJ-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1cnc(C2CCCCC2)s1 ZINC000552373011 341389670 /nfs/dbraw/zinc/38/96/70/341389670.db2.gz BXGYCFYMQFTLBH-UHFFFAOYSA-N 1 2 319.474 4.373 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1cnc(C2CCCCC2)s1 ZINC000552373011 341389671 /nfs/dbraw/zinc/38/96/71/341389671.db2.gz BXGYCFYMQFTLBH-UHFFFAOYSA-N 1 2 319.474 4.373 20 0 DIADLO CCC[C@@H](C)C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000552529523 341397573 /nfs/dbraw/zinc/39/75/73/341397573.db2.gz QLXDGZNMMLLJSH-CQSZACIVSA-N 1 2 311.429 4.261 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccccc2[nH]1)c1nc(C(C)(C)C)cs1 ZINC000552641261 341401091 /nfs/dbraw/zinc/40/10/91/341401091.db2.gz PAUJNFNEWZUELV-LLVKDONJSA-N 1 2 314.458 4.168 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)C(=O)CCCCC(C)(C)C)c1C ZINC000552893859 341408029 /nfs/dbraw/zinc/40/80/29/341408029.db2.gz WVLVJHNJPXOUBM-UHFFFAOYSA-N 1 2 320.477 4.272 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)s1 ZINC000089870413 341410259 /nfs/dbraw/zinc/41/02/59/341410259.db2.gz RLUMSEBDHAQWGZ-UHFFFAOYSA-N 1 2 311.410 4.073 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccccn1 ZINC000090572258 341417176 /nfs/dbraw/zinc/41/71/76/341417176.db2.gz ZTEMVILJONKONX-IBGZPJMESA-N 1 2 312.461 4.270 20 0 DIADLO Clc1cccc2c(N[C@@H]3CCC[C@@H]4OCC[C@H]43)cc[nH+]c12 ZINC000553148909 341417820 /nfs/dbraw/zinc/41/78/20/341417820.db2.gz KBDOWVJDKXBQJD-PEYYIBSZSA-N 1 2 302.805 4.258 20 0 DIADLO C[C@H]([NH2+]C/C=C/c1ccccc1)c1noc(Cc2ccccc2)n1 ZINC000553496252 341430488 /nfs/dbraw/zinc/43/04/88/341430488.db2.gz VETYEGTVQVWGMF-OIQJVACTSA-N 1 2 319.408 4.024 20 0 DIADLO CCCCn1c(S[C@@H]2CC[C@@H](C)C2)nnc1[C@H](CC)[NH+](C)C ZINC000554969171 341470742 /nfs/dbraw/zinc/47/07/42/341470742.db2.gz FVMSHFFUYWTUJX-KFWWJZLASA-N 1 2 324.538 4.372 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2conc2Cc2ccccc2)o1 ZINC000555524691 341484060 /nfs/dbraw/zinc/48/40/60/341484060.db2.gz WUCAMNIIVMDAEB-KSSFIOAISA-N 1 2 322.408 4.272 20 0 DIADLO COc1cccc2c1cc[nH+]c2NC[C@H](C)c1c(C)noc1C ZINC000556211570 341497463 /nfs/dbraw/zinc/49/74/63/341497463.db2.gz CTBOZIPMXXBFLG-NSHDSACASA-N 1 2 311.385 4.064 20 0 DIADLO Cc1c([C@H](C)[NH2+]CC(C)(F)F)cnn1-c1cc(C)ccc1C ZINC000556228547 341498202 /nfs/dbraw/zinc/49/82/02/341498202.db2.gz HYBDGVVXDWLSNH-ZDUSSCGKSA-N 1 2 307.388 4.103 20 0 DIADLO COc1ccc(C[NH2+]Cc2c(Cl)cccc2Cl)c(F)c1 ZINC000564480729 341502436 /nfs/dbraw/zinc/50/24/36/341502436.db2.gz GMISALLNBPNDKF-UHFFFAOYSA-N 1 2 314.187 4.431 20 0 DIADLO COCc1cc(N2C[C@@H]3CCCC[C@H]3C2)c2cc(F)ccc2[nH+]1 ZINC000564567338 341504221 /nfs/dbraw/zinc/50/42/21/341504221.db2.gz JKXJTEIYFKVYFJ-KBPBESRZSA-N 1 2 314.404 4.147 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc(C2CC(C)(C)C2)n1 ZINC000565506821 341529475 /nfs/dbraw/zinc/52/94/75/341529475.db2.gz RGOZVQKLFBHODA-UHFFFAOYSA-N 1 2 324.428 4.495 20 0 DIADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1ccc2c(c1)CCC=C2 ZINC000565672933 341534592 /nfs/dbraw/zinc/53/45/92/341534592.db2.gz ZLHVCHDKVDZMGI-UHFFFAOYSA-N 1 2 315.376 4.288 20 0 DIADLO CCOc1cccc(Cl)c1C[NH2+][C@@H](CCOC)c1ccco1 ZINC000565841358 341539908 /nfs/dbraw/zinc/53/99/08/341539908.db2.gz VOSJUJWQOGWLRG-HNNXBMFYSA-N 1 2 323.820 4.199 20 0 DIADLO CCC(=O)Nc1ccc(C)c(N[C@H]2CCc3ccc[nH+]c3CC2)c1 ZINC000566084638 341547262 /nfs/dbraw/zinc/54/72/62/341547262.db2.gz AXZIATOQEGXLKH-INIZCTEOSA-N 1 2 323.440 4.098 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCSc1cnccn1 ZINC000567005931 341574034 /nfs/dbraw/zinc/57/40/34/341574034.db2.gz YICGAJJTNHZITJ-UHFFFAOYSA-N 1 2 312.442 4.097 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+]CCc2ccccn2)C(F)F)c1 ZINC000567011883 341574121 /nfs/dbraw/zinc/57/41/21/341574121.db2.gz KVJOCGOVYMOEQH-KRWDZBQOSA-N 1 2 320.383 4.007 20 0 DIADLO Cc1cccc2[nH+]c(C[S@@](=O)c3ccc4ccccc4c3)cn21 ZINC000155562238 341609394 /nfs/dbraw/zinc/60/93/94/341609394.db2.gz YYFRQAGOCIUKLJ-QHCPKHFHSA-N 1 2 320.417 4.104 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2n1C)c1c(F)cccc1F ZINC000271901930 341625207 /nfs/dbraw/zinc/62/52/07/341625207.db2.gz YKEZSRGKXKHMFO-NEPJUHHUSA-N 1 2 315.367 4.263 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1nc2ccccc2n1C ZINC000271901935 341625209 /nfs/dbraw/zinc/62/52/09/341625209.db2.gz YKEZSRGKXKHMFO-NWDGAFQWSA-N 1 2 315.367 4.263 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](CC(F)(F)F)c2ccccc2C)o1 ZINC000567675431 341626701 /nfs/dbraw/zinc/62/67/01/341626701.db2.gz LHJQZHCLWLMVKF-AWEZNQCLSA-N 1 2 312.335 4.329 20 0 DIADLO CN(c1[nH+]c2ccccc2n1C)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000567784626 341633183 /nfs/dbraw/zinc/63/31/83/341633183.db2.gz PTERHLFZULJWTC-TXEJJXNPSA-N 1 2 311.351 4.131 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2sc(C(C)(C)C)nc2C)s1 ZINC000274263700 341642152 /nfs/dbraw/zinc/64/21/52/341642152.db2.gz VIFVHOMLIGYRMU-WPRPVWTQSA-N 1 2 324.519 4.321 20 0 DIADLO C[C@@H](Cc1ccccc1F)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000157858466 341646832 /nfs/dbraw/zinc/64/68/32/341646832.db2.gz QPRMPFNROFJFTB-ZDUSSCGKSA-N 1 2 323.371 4.033 20 0 DIADLO CCc1nc(C)c([C@@H](C)[NH2+]CC(F)(F)c2ccccc2)s1 ZINC000568333773 341665760 /nfs/dbraw/zinc/66/57/60/341665760.db2.gz IXWGJIIDORAXIJ-LLVKDONJSA-N 1 2 310.413 4.457 20 0 DIADLO C[C@@H]1C[C@H](C)CCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000163525317 341699296 /nfs/dbraw/zinc/69/92/96/341699296.db2.gz MOSWDRDAJUGIEK-HZPDHXFCSA-N 1 2 324.424 4.382 20 0 DIADLO Cc1c[nH+]cc(CCc2nc([C@@H]3CCCc4ccccc43)no2)c1 ZINC000572697860 341700954 /nfs/dbraw/zinc/70/09/54/341700954.db2.gz YVVBCTSZKZVILQ-GOSISDBHSA-N 1 2 319.408 4.026 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccccc3NC(C)(C)C)ccn12 ZINC000574412896 341758038 /nfs/dbraw/zinc/75/80/38/341758038.db2.gz DVOGJRQWBYYPOA-UHFFFAOYSA-N 1 2 322.412 4.105 20 0 DIADLO Cc1nc2cc(Cl)c(NCc3[nH]c(C)c(C)[nH+]3)cc2s1 ZINC000575072596 341775433 /nfs/dbraw/zinc/77/54/33/341775433.db2.gz FDYNYZWCFGTYKV-UHFFFAOYSA-N 1 2 306.822 4.210 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)[C@@]3(C)C[C@@H]3c3ccccc3)ccc2n1C ZINC000576247539 341836164 /nfs/dbraw/zinc/83/61/64/341836164.db2.gz KLFMQWURAQLHHT-UZLBHIALSA-N 1 2 319.408 4.014 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc([C@@H]2CCCC2(C)C)n1 ZINC000576741476 341860854 /nfs/dbraw/zinc/86/08/54/341860854.db2.gz VDZAHZWHYAGWGB-AWEZNQCLSA-N 1 2 324.428 4.264 20 0 DIADLO CCCOc1cccc2c(NCc3ccn(C(C)C)n3)cc[nH+]c12 ZINC000580602842 341884648 /nfs/dbraw/zinc/88/46/48/341884648.db2.gz CZTKNTMCEQUBRS-UHFFFAOYSA-N 1 2 324.428 4.413 20 0 DIADLO CCCCN(C(=O)c1ccn2c(C)c[nH+]c2c1)c1ccccc1 ZINC000577409358 341908674 /nfs/dbraw/zinc/90/86/74/341908674.db2.gz VRLARMGIAWYQRU-UHFFFAOYSA-N 1 2 307.397 4.090 20 0 DIADLO c1ccc(N2Cc3cccc(N[C@@H]4CC[C@H]4C4CC4)c3C2)[nH+]c1 ZINC000577525937 341915634 /nfs/dbraw/zinc/91/56/34/341915634.db2.gz WZVHKHMAYLRHFT-QFBILLFUSA-N 1 2 305.425 4.202 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccccc2C(F)(F)F)s1 ZINC000348263699 341948990 /nfs/dbraw/zinc/94/89/90/341948990.db2.gz UHBWUUSZPCXXKM-DTWKUNHWSA-N 1 2 315.364 4.277 20 0 DIADLO CC(=O)Nc1ccc(CNc2[nH+]c3ccccc3cc2C)cc1 ZINC000178414350 341953898 /nfs/dbraw/zinc/95/38/98/341953898.db2.gz OWLCLCBPXCYTSF-UHFFFAOYSA-N 1 2 305.381 4.114 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@H](C)c2ccc(Cl)cc2)n1 ZINC000067961046 517415137 /nfs/dbraw/zinc/41/51/37/517415137.db2.gz RXCWCNDVQSIRLM-GFCCVEGCSA-N 1 2 307.825 4.162 20 0 DIADLO Cc1ccc(OCCCC(=O)Nc2cc[nH+]cc2C)c(Cl)c1 ZINC000119158731 518189431 /nfs/dbraw/zinc/18/94/31/518189431.db2.gz IFGKTMFUWUHPOE-UHFFFAOYSA-N 1 2 318.804 4.150 20 0 DIADLO c1csc(C[NH2+][C@@H](COc2ccccc2)c2ccccc2)n1 ZINC000341215028 518203948 /nfs/dbraw/zinc/20/39/48/518203948.db2.gz CFQMRBYUVXVZQO-KRWDZBQOSA-N 1 2 310.422 4.053 20 0 DIADLO CC(C)N(C)c1ccc(CNc2ccc(-c3cnco3)cc2)c[nH+]1 ZINC000191393983 519633521 /nfs/dbraw/zinc/63/35/21/519633521.db2.gz LYHSGBGIEVTSII-UHFFFAOYSA-N 1 2 322.412 4.193 20 0 DIADLO CC(=O)Nc1cccc([C@H](C)Nc2ccc([NH+](C)C)c(C)c2)c1 ZINC000182849827 519749073 /nfs/dbraw/zinc/74/90/73/519749073.db2.gz VUPGLZNGPMFFKN-AWEZNQCLSA-N 1 2 311.429 4.193 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1F ZINC000180264008 519821159 /nfs/dbraw/zinc/82/11/59/519821159.db2.gz FOYQSAVCYOFJOD-HNNXBMFYSA-N 1 2 323.799 4.226 20 0 DIADLO CC(C)[C@H](c1ccc(F)cc1)[N@H+](C)Cc1ncnn1C(C)(C)C ZINC000338362566 519824130 /nfs/dbraw/zinc/82/41/30/519824130.db2.gz QDIOYNVCVSQGND-QGZVFWFLSA-N 1 2 318.440 4.001 20 0 DIADLO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ncnn1C(C)(C)C ZINC000338362566 519824131 /nfs/dbraw/zinc/82/41/31/519824131.db2.gz QDIOYNVCVSQGND-QGZVFWFLSA-N 1 2 318.440 4.001 20 0 DIADLO CCC1CCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000264921671 519858882 /nfs/dbraw/zinc/85/88/82/519858882.db2.gz SCMVCSYICKEKLO-UHFFFAOYSA-N 1 2 310.397 4.136 20 0 DIADLO CCCC(=O)Nc1ccc(CNc2cc(C)[nH+]c(C3CC3)n2)cc1 ZINC000265357326 519878459 /nfs/dbraw/zinc/87/84/59/519878459.db2.gz LMIIOZJPGSPJME-UHFFFAOYSA-N 1 2 324.428 4.013 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2ccccc2F)C2CCCC2)o1 ZINC000181491686 519887738 /nfs/dbraw/zinc/88/77/38/519887738.db2.gz UZTSTYASCYSLPB-QGZVFWFLSA-N 1 2 317.408 4.353 20 0 DIADLO CC(C)n1ccnc1C[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000337320384 520027447 /nfs/dbraw/zinc/02/74/47/520027447.db2.gz IFCAQQRLADYNBX-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1ccnc1C[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000337320384 520027458 /nfs/dbraw/zinc/02/74/58/520027458.db2.gz IFCAQQRLADYNBX-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1cc[nH+]c1CN(C)Cc1ccc(Cl)c(Cl)c1 ZINC000337320384 520027467 /nfs/dbraw/zinc/02/74/67/520027467.db2.gz IFCAQQRLADYNBX-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1nccc1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC000337138630 520100413 /nfs/dbraw/zinc/10/04/13/520100413.db2.gz RBSGSDCMHCNZTI-UHFFFAOYSA-N 1 2 309.413 4.259 20 0 DIADLO CC(C)n1nccc1C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000337138630 520100422 /nfs/dbraw/zinc/10/04/22/520100422.db2.gz RBSGSDCMHCNZTI-UHFFFAOYSA-N 1 2 309.413 4.259 20 0 DIADLO CC(C)n1nccc1C[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000337208991 520110928 /nfs/dbraw/zinc/11/09/28/520110928.db2.gz RTRIVFLKVYGCMJ-LBPRGKRZSA-N 1 2 306.479 4.069 20 0 DIADLO CCCCCC[C@H](C)NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000106515788 520128616 /nfs/dbraw/zinc/12/86/16/520128616.db2.gz URPVSTDBRCUWHP-GJZGRUSLSA-N 1 2 306.454 4.005 20 0 DIADLO CC1(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CCCC1 ZINC000338368486 520231370 /nfs/dbraw/zinc/23/13/70/520231370.db2.gz CVTLKZSOKWEMIX-UHFFFAOYSA-N 1 2 303.793 4.045 20 0 DIADLO CC1(C)Cc2cccc(C[NH2+]Cc3nc(C4CC4)cs3)c2O1 ZINC000131146882 520583114 /nfs/dbraw/zinc/58/31/14/520583114.db2.gz BCOKMAIFEOQYMS-UHFFFAOYSA-N 1 2 314.454 4.024 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ncc(-c2ccccc2)cn1)c1cccnc1 ZINC000186048827 520786397 /nfs/dbraw/zinc/78/63/97/520786397.db2.gz HXKJYNAJJJHZRV-LJQANCHMSA-N 1 2 318.424 4.170 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](CC)c2cccc(Cl)c2)no1 ZINC000182595399 521304788 /nfs/dbraw/zinc/30/47/88/521304788.db2.gz ZFRPJVKAAQKQQR-AWEZNQCLSA-N 1 2 307.825 4.307 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3ncoc3C3CC3)cc2[nH+]1 ZINC000339346598 521314053 /nfs/dbraw/zinc/31/40/53/521314053.db2.gz UUGGQJOBGYSDCS-UHFFFAOYSA-N 1 2 324.384 4.023 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)c2ccoc2)c1 ZINC000157917289 521390432 /nfs/dbraw/zinc/39/04/32/521390432.db2.gz KTPVJILFLYMUQB-UHFFFAOYSA-N 1 2 309.369 4.196 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)no1 ZINC000180287891 521517027 /nfs/dbraw/zinc/51/70/27/521517027.db2.gz NKKQIUJAULRRGJ-SFHVURJKSA-N 1 2 317.408 4.182 20 0 DIADLO CCCc1nc(C[NH2+][C@H](C)c2cn(C(C)(C)C)nc2C)cs1 ZINC000157588932 521517156 /nfs/dbraw/zinc/51/71/56/521517156.db2.gz FAMPSGVMNGEZOE-GFCCVEGCSA-N 1 2 320.506 4.206 20 0 DIADLO CCC[N@H+](Cc1nccn1C(C)C)[C@@H](C)c1ccccc1OC ZINC000337347507 521694976 /nfs/dbraw/zinc/69/49/76/521694976.db2.gz NNCRJENZWKMWAY-INIZCTEOSA-N 1 2 315.461 4.446 20 0 DIADLO CCC[N@@H+](Cc1nccn1C(C)C)[C@@H](C)c1ccccc1OC ZINC000337347507 521694978 /nfs/dbraw/zinc/69/49/78/521694978.db2.gz NNCRJENZWKMWAY-INIZCTEOSA-N 1 2 315.461 4.446 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@@H](C)c2cc(C)cc(C)c2)n1 ZINC000182876847 521729305 /nfs/dbraw/zinc/72/93/05/521729305.db2.gz NFZORZDFXPKLRH-UONOGXRCSA-N 1 2 319.474 4.351 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+]2CCc3ccccc3[C@@H]2C)n1 ZINC000130569630 521729335 /nfs/dbraw/zinc/72/93/35/521729335.db2.gz JTUNYGWQRSCETA-QWHCGFSZSA-N 1 2 317.458 4.003 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+]2CCc3ccccc3[C@@H]2C)n1 ZINC000130569630 521729337 /nfs/dbraw/zinc/72/93/37/521729337.db2.gz JTUNYGWQRSCETA-QWHCGFSZSA-N 1 2 317.458 4.003 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2cc(Cl)ccc2OC)s1 ZINC000130625913 522038015 /nfs/dbraw/zinc/03/80/15/522038015.db2.gz STYCVBUQHULZPX-JTQLQIEISA-N 1 2 310.850 4.218 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)/C=C/c1cnc(C(C)(C)C)s1 ZINC000266288403 522079183 /nfs/dbraw/zinc/07/91/83/522079183.db2.gz HUNPRAAAXZBQCN-VOTSOKGWSA-N 1 2 315.442 4.050 20 0 DIADLO CCc1nc(C[NH2+][C@H](CCc2ccccc2)c2ccccc2)no1 ZINC000180379362 522354996 /nfs/dbraw/zinc/35/49/96/522354996.db2.gz BRLLIHDHUZHHHD-GOSISDBHSA-N 1 2 321.424 4.096 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cc(OC)ccc2OC)cs1 ZINC000162284941 522422453 /nfs/dbraw/zinc/42/24/53/522422453.db2.gz JAQNXYZIKUKBGK-NWDGAFQWSA-N 1 2 320.458 4.135 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2cc(OC)ccc2OC)cs1 ZINC000162285073 522454771 /nfs/dbraw/zinc/45/47/71/522454771.db2.gz JAQNXYZIKUKBGK-RYUDHWBXSA-N 1 2 320.458 4.135 20 0 DIADLO CCc1nn(C)c(CC)c1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000181029764 522660112 /nfs/dbraw/zinc/66/01/12/522660112.db2.gz AIKKMGSNAGCFMA-HXUWFJFHSA-N 1 2 323.440 4.017 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1cccc(Cl)c1 ZINC000182599700 522665850 /nfs/dbraw/zinc/66/58/50/522665850.db2.gz QHLMVQHBJNIINE-ZDUSSCGKSA-N 1 2 307.825 4.261 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1nc(C)cs1 ZINC000184344138 522666945 /nfs/dbraw/zinc/66/69/45/522666945.db2.gz QHUFFQKBCWEOIX-NSHDSACASA-N 1 2 309.504 4.446 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nc(C(C)C)no1)c1ccc(OC)cc1 ZINC000181828128 522703885 /nfs/dbraw/zinc/70/38/85/522703885.db2.gz JFCFIUATQXQFCB-WFASDCNBSA-N 1 2 303.406 4.004 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1cc(F)c(F)c(F)c1)c1ccc(C)o1 ZINC000156436419 522759794 /nfs/dbraw/zinc/75/97/94/522759794.db2.gz PWWCNXDYJPXVIQ-HZMBPMFUSA-N 1 2 313.319 4.044 20 0 DIADLO CC[C@H](Nc1ccc(Cl)c(OC(F)F)c1)c1[nH+]ccn1C ZINC000180232908 522766955 /nfs/dbraw/zinc/76/69/55/522766955.db2.gz RAHQLIAKVMKVRA-NSHDSACASA-N 1 2 315.751 4.238 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(Br)o1)c1nc(C)cs1 ZINC000190970604 522872078 /nfs/dbraw/zinc/87/20/78/522872078.db2.gz VLGOXIYRTGDOMR-SNVBAGLBSA-N 1 2 315.236 4.048 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nc([C@H](C)OC)no1 ZINC000267019295 522928520 /nfs/dbraw/zinc/92/85/20/522928520.db2.gz JVTCQTYHLKQMLP-SMDDNHRTSA-N 1 2 323.824 4.014 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nc([C@H](C)OC)no1 ZINC000267019295 522928535 /nfs/dbraw/zinc/92/85/35/522928535.db2.gz JVTCQTYHLKQMLP-SMDDNHRTSA-N 1 2 323.824 4.014 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000182307326 522941544 /nfs/dbraw/zinc/94/15/44/522941544.db2.gz UMIFKULKZKDBIH-QMTHXVAHSA-N 1 2 305.809 4.402 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cc1cncc(C(F)(F)F)c1 ZINC000361288236 523238658 /nfs/dbraw/zinc/23/86/58/523238658.db2.gz LQWMGOYUPDCGOO-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1cncc(C(F)(F)F)c1 ZINC000361288236 523238663 /nfs/dbraw/zinc/23/86/63/523238663.db2.gz LQWMGOYUPDCGOO-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO CCn1c2ccccc2nc1[C@@H]1CCC[N@@H+]1Cc1ccc(C)cn1 ZINC000156712133 523291872 /nfs/dbraw/zinc/29/18/72/523291872.db2.gz OOASIJNLOQMBNB-IBGZPJMESA-N 1 2 320.440 4.097 20 0 DIADLO CCn1c2ccccc2nc1[C@@H]1CCC[N@H+]1Cc1ccc(C)cn1 ZINC000156712133 523291878 /nfs/dbraw/zinc/29/18/78/523291878.db2.gz OOASIJNLOQMBNB-IBGZPJMESA-N 1 2 320.440 4.097 20 0 DIADLO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@H](C)c1ccncc1F ZINC000338012404 523292375 /nfs/dbraw/zinc/29/23/75/523292375.db2.gz MKLJINFXNCCJEA-CHWSQXEVSA-N 1 2 312.392 4.002 20 0 DIADLO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@@H](C)c1ccncc1F ZINC000338012424 523294634 /nfs/dbraw/zinc/29/46/34/523294634.db2.gz MKLJINFXNCCJEA-STQMWFEESA-N 1 2 312.392 4.002 20 0 DIADLO CCn1c2ccccc2nc1[C@H]1CCC[N@@H+]1Cc1ccc(C)cn1 ZINC000156712255 523295418 /nfs/dbraw/zinc/29/54/18/523295418.db2.gz OOASIJNLOQMBNB-LJQANCHMSA-N 1 2 320.440 4.097 20 0 DIADLO CCn1c2ccccc2nc1[C@H]1CCC[N@H+]1Cc1ccc(C)cn1 ZINC000156712255 523295425 /nfs/dbraw/zinc/29/54/25/523295425.db2.gz OOASIJNLOQMBNB-LJQANCHMSA-N 1 2 320.440 4.097 20 0 DIADLO CCn1ccnc1C[N@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000102768121 523525483 /nfs/dbraw/zinc/52/54/83/523525483.db2.gz XLZYAXCSGNFDJS-ZDUSSCGKSA-N 1 2 303.837 4.282 20 0 DIADLO CCn1ccnc1C[N@@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000102768121 523525488 /nfs/dbraw/zinc/52/54/88/523525488.db2.gz XLZYAXCSGNFDJS-ZDUSSCGKSA-N 1 2 303.837 4.282 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1ccc(Cl)s1 ZINC000339148832 523554259 /nfs/dbraw/zinc/55/42/59/523554259.db2.gz DLMKOPGWDFMXCY-ZDUSSCGKSA-N 1 2 309.866 4.345 20 0 DIADLO COC(=O)[C@H](c1ccsc1)[N@@H+]1CCC[C@@H]1c1ccc(C)s1 ZINC000337190420 523941953 /nfs/dbraw/zinc/94/19/53/523941953.db2.gz RVPTXKIHGFRLKO-HIFRSBDPSA-N 1 2 321.467 4.169 20 0 DIADLO COC(=O)[C@H](c1ccsc1)[N@H+]1CCC[C@@H]1c1ccc(C)s1 ZINC000337190420 523941955 /nfs/dbraw/zinc/94/19/55/523941955.db2.gz RVPTXKIHGFRLKO-HIFRSBDPSA-N 1 2 321.467 4.169 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-c3cn4c([nH+]3)CCCC4)cc2)co1 ZINC000188601559 524163979 /nfs/dbraw/zinc/16/39/79/524163979.db2.gz CGLNCTQTFHZDOT-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2ncnn2-c2ccccc2)c1 ZINC000337142097 524202276 /nfs/dbraw/zinc/20/22/76/524202276.db2.gz SWGMWPJHKFZKKC-QGZVFWFLSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@@H+](C)Cc2ncnn2-c2ccccc2)c1 ZINC000337142097 524202285 /nfs/dbraw/zinc/20/22/85/524202285.db2.gz SWGMWPJHKFZKKC-QGZVFWFLSA-N 1 2 320.440 4.077 20 0 DIADLO C[C@@H]1CCCN1C(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000267818959 524255985 /nfs/dbraw/zinc/25/59/85/524255985.db2.gz XKQNPQBMMCOYSY-GFCCVEGCSA-N 1 2 316.788 4.152 20 0 DIADLO C[C@@H](C(=O)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1)C(C)(F)F ZINC000339603103 524265074 /nfs/dbraw/zinc/26/50/74/524265074.db2.gz JTWOOLDABCATQC-VIFPVBQESA-N 1 2 307.344 4.060 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000132347913 524484993 /nfs/dbraw/zinc/48/49/93/524484993.db2.gz TUZZTRSXJVSMKP-CYBMUJFWSA-N 1 2 318.808 4.131 20 0 DIADLO C[C@@H]1CC[C@H](C)CN1C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000175116825 524648907 /nfs/dbraw/zinc/64/89/07/524648907.db2.gz ZROOALXFKZRVCI-LSDHHAIUSA-N 1 2 310.397 4.135 20 0 DIADLO Cc1ccccc1-c1noc([C@@H](C)[NH2+][C@@H](C)c2cccc(O)c2)n1 ZINC000181531834 525021081 /nfs/dbraw/zinc/02/10/81/525021081.db2.gz QTUOJWSRXCUDJR-UONOGXRCSA-N 1 2 323.396 4.162 20 0 DIADLO Cc1cc(N(C)[C@@H](C)c2cccs2)nc(-c2ccncc2)[nH+]1 ZINC000112964809 525028201 /nfs/dbraw/zinc/02/82/01/525028201.db2.gz LBVGWXYMPUENCR-ZDUSSCGKSA-N 1 2 310.426 4.106 20 0 DIADLO Cc1cc(N(C)[C@@H](C)c2ccccc2)nc(-c2ccncc2)[nH+]1 ZINC000112963658 525028232 /nfs/dbraw/zinc/02/82/32/525028232.db2.gz ZOBLRJSRHXDOLP-HNNXBMFYSA-N 1 2 304.397 4.044 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)C)cs2)c(F)c1 ZINC000128542246 525157478 /nfs/dbraw/zinc/15/74/78/525157478.db2.gz FOIDEBQJPPOYKK-LLVKDONJSA-N 1 2 308.422 4.265 20 0 DIADLO C[C@H](NC(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1)C1CC1 ZINC000265012837 525220260 /nfs/dbraw/zinc/22/02/60/525220260.db2.gz AVJISSBGNXMFMX-NSHDSACASA-N 1 2 316.788 4.056 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H](C)c2ncc(C(C)(C)C)o2)cc1 ZINC000267093632 525336081 /nfs/dbraw/zinc/33/60/81/525336081.db2.gz XQDVVJBLXRPRGU-QWHCGFSZSA-N 1 2 302.418 4.393 20 0 DIADLO C[C@H]([NH2+]Cc1nccs1)c1nc(-c2ccccc2)cs1 ZINC000107322041 525492485 /nfs/dbraw/zinc/49/24/85/525492485.db2.gz FHMRAUFVBIJJSQ-NSHDSACASA-N 1 2 301.440 4.117 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nnc(-c3ccccc3)s2)c(C)o1 ZINC000156480001 525523030 /nfs/dbraw/zinc/52/30/30/525523030.db2.gz KJJWHNZYWNSFRJ-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc2cc[nH]c21)c1nc(C2CCCCC2)no1 ZINC000266309613 525538643 /nfs/dbraw/zinc/53/86/43/525538643.db2.gz PITUTUQQSAEURX-CYBMUJFWSA-N 1 2 324.428 4.449 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)C(C)C ZINC000118839400 525548609 /nfs/dbraw/zinc/54/86/09/525548609.db2.gz QAWPKNODNKCOGC-KGLIPLIRSA-N 1 2 316.449 4.118 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1cccnc1 ZINC000181663508 525556828 /nfs/dbraw/zinc/55/68/28/525556828.db2.gz GNYBTJACHRVISP-CYBMUJFWSA-N 1 2 301.459 4.437 20 0 DIADLO Cc1c(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)ccn1C(C)C ZINC000339595745 525654023 /nfs/dbraw/zinc/65/40/23/525654023.db2.gz VFTCWVIYDUOIHN-UHFFFAOYSA-N 1 2 308.385 4.020 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccccc1Br)c1cscn1 ZINC000162295585 525662675 /nfs/dbraw/zinc/66/26/75/525662675.db2.gz CDNLQSAWOMDDHE-NXEZZACHSA-N 1 2 311.248 4.317 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2ncnn2C(C)(C)C)cc1 ZINC000338302031 525804298 /nfs/dbraw/zinc/80/42/98/525804298.db2.gz CFOOMKATRUXBRU-KRWDZBQOSA-N 1 2 312.461 4.069 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2ncnn2C(C)(C)C)cc1 ZINC000338302031 525804308 /nfs/dbraw/zinc/80/43/08/525804308.db2.gz CFOOMKATRUXBRU-KRWDZBQOSA-N 1 2 312.461 4.069 20 0 DIADLO Cc1c([C@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)cnn1C(C)C ZINC000191474082 525926111 /nfs/dbraw/zinc/92/61/11/525926111.db2.gz GYDYPEKOEWKUMR-AWEZNQCLSA-N 1 2 312.461 4.328 20 0 DIADLO Cc1c([C@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)cnn1C(C)C ZINC000191474082 525926121 /nfs/dbraw/zinc/92/61/21/525926121.db2.gz GYDYPEKOEWKUMR-AWEZNQCLSA-N 1 2 312.461 4.328 20 0 DIADLO Cc1cn2cc(NC(=O)c3oc4ccc(F)cc4c3C)ccc2[nH+]1 ZINC000339261819 525953599 /nfs/dbraw/zinc/95/35/99/525953599.db2.gz NXQNBAAUQDZSJM-UHFFFAOYSA-N 1 2 323.327 4.089 20 0 DIADLO Cc1c2cc(F)ccc2sc1C(=O)Nc1cc[nH+]cc1C ZINC000107287980 525960916 /nfs/dbraw/zinc/96/09/16/525960916.db2.gz ZGWZSGGLUIJSNU-UHFFFAOYSA-N 1 2 300.358 4.305 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc(C(C)C)cn2)[nH+]1 ZINC000365992134 525962178 /nfs/dbraw/zinc/96/21/78/525962178.db2.gz CABJGWBAAJYUSX-UHFFFAOYSA-N 1 2 320.396 4.156 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H](C)Cc2ccccc2)[nH+]1 ZINC000366027568 525962406 /nfs/dbraw/zinc/96/24/06/525962406.db2.gz ZWOWSTXBYWKJDE-CQSZACIVSA-N 1 2 319.408 4.202 20 0 DIADLO Cc1cnc(C[N@H+](CCc2ccc(C)cc2)Cc2ccco2)o1 ZINC000174042066 526011442 /nfs/dbraw/zinc/01/14/42/526011442.db2.gz DCJDRDGKPULWLG-UHFFFAOYSA-N 1 2 310.397 4.129 20 0 DIADLO Cc1cnc(C[N@@H+](CCc2ccc(C)cc2)Cc2ccco2)o1 ZINC000174042066 526011451 /nfs/dbraw/zinc/01/14/51/526011451.db2.gz DCJDRDGKPULWLG-UHFFFAOYSA-N 1 2 310.397 4.129 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2[C@H](C)c2nc3ccccc3c(=O)[nH]2)o1 ZINC000265354095 526012038 /nfs/dbraw/zinc/01/20/38/526012038.db2.gz KTRFSMDZVZZTKR-CZUORRHYSA-N 1 2 323.396 4.135 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2[C@H](C)c2nc3ccccc3c(=O)[nH]2)o1 ZINC000265354095 526012043 /nfs/dbraw/zinc/01/20/43/526012043.db2.gz KTRFSMDZVZZTKR-CZUORRHYSA-N 1 2 323.396 4.135 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H](C)c1cccnc1Cl ZINC000188461344 526104623 /nfs/dbraw/zinc/10/46/23/526104623.db2.gz KYAIKLMFZDESIK-SNVBAGLBSA-N 1 2 311.212 4.248 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000128066475 526112980 /nfs/dbraw/zinc/11/29/80/526112980.db2.gz VLSYXRZWAWROKP-LBPRGKRZSA-N 1 2 316.355 4.019 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000128066475 526112990 /nfs/dbraw/zinc/11/29/90/526112990.db2.gz VLSYXRZWAWROKP-LBPRGKRZSA-N 1 2 316.355 4.019 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2csc(-c3ccoc3)n2)s1 ZINC000185027996 526157868 /nfs/dbraw/zinc/15/78/68/526157868.db2.gz SJPXGXWQPFSSNT-JTQLQIEISA-N 1 2 305.428 4.019 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000181146403 526176985 /nfs/dbraw/zinc/17/69/85/526176985.db2.gz SMACOMYYALSXSH-LRDDRELGSA-N 1 2 314.410 4.024 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000181146403 526176991 /nfs/dbraw/zinc/17/69/91/526176991.db2.gz SMACOMYYALSXSH-LRDDRELGSA-N 1 2 314.410 4.024 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+](C)Cc1cc(Cl)cn1C ZINC000181145909 526178663 /nfs/dbraw/zinc/17/86/63/526178663.db2.gz YMFOVCOMJNVYNU-LLVKDONJSA-N 1 2 303.793 4.013 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+](C)Cc1cc(Cl)cn1C ZINC000181145909 526178667 /nfs/dbraw/zinc/17/86/67/526178667.db2.gz YMFOVCOMJNVYNU-LLVKDONJSA-N 1 2 303.793 4.013 20 0 DIADLO COc1cccc(OC)c1SCc1[nH+]cc(C)c(OC)c1C ZINC000191254619 526224702 /nfs/dbraw/zinc/22/47/02/526224702.db2.gz RLDCETJODLZXJY-UHFFFAOYSA-N 1 2 319.426 4.017 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@H](Sc1ccccc1)C(C)C ZINC000107293648 526239719 /nfs/dbraw/zinc/23/97/19/526239719.db2.gz WJYYKLICXCWYQN-MRXNPFEDSA-N 1 2 300.427 4.145 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1cn(CC(C)C)c2ccccc12 ZINC000107292691 526241986 /nfs/dbraw/zinc/24/19/86/526241986.db2.gz ZIIJSSLMVXPESK-UHFFFAOYSA-N 1 2 307.397 4.253 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2cc(-c3cccs3)on2)n1 ZINC000266763410 526322167 /nfs/dbraw/zinc/32/21/67/526322167.db2.gz UIURAINRSVGOLQ-UHFFFAOYSA-N 1 2 319.455 4.193 20 0 DIADLO Fc1ccc(Cl)cc1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000338140695 526346274 /nfs/dbraw/zinc/34/62/74/526346274.db2.gz PYMHPXPVCJFQCH-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2nc(C3CC3)no2)C2CCCC2)cc1 ZINC000180287220 526361518 /nfs/dbraw/zinc/36/15/18/526361518.db2.gz HPPVLGQCLLJIBG-KRWDZBQOSA-N 1 2 315.392 4.107 20 0 DIADLO Fc1cccc(C[N@@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)c1Cl ZINC000339202748 526384361 /nfs/dbraw/zinc/38/43/61/526384361.db2.gz QFHRARSGUNIXAY-HOCLYGCPSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cccc(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)c1Cl ZINC000339202748 526384366 /nfs/dbraw/zinc/38/43/66/526384366.db2.gz QFHRARSGUNIXAY-HOCLYGCPSA-N 1 2 309.812 4.013 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)o1 ZINC000180020975 526397826 /nfs/dbraw/zinc/39/78/26/526397826.db2.gz CSXABLUCWCKPEQ-RZCHIYRCSA-N 1 2 305.809 4.079 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CCc3ccc(C(C)(C)C)cc3C2)s1 ZINC000338303822 526403474 /nfs/dbraw/zinc/40/34/74/526403474.db2.gz NXYVPMLCQWNPTI-LBPRGKRZSA-N 1 2 315.486 4.263 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CCc3ccc(C(C)(C)C)cc3C2)s1 ZINC000338303822 526403477 /nfs/dbraw/zinc/40/34/77/526403477.db2.gz NXYVPMLCQWNPTI-LBPRGKRZSA-N 1 2 315.486 4.263 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)o1 ZINC000159330865 526405369 /nfs/dbraw/zinc/40/53/69/526405369.db2.gz HZOURCYKVUTRLP-INIZCTEOSA-N 1 2 311.360 4.146 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)o1 ZINC000159330865 526405375 /nfs/dbraw/zinc/40/53/75/526405375.db2.gz HZOURCYKVUTRLP-INIZCTEOSA-N 1 2 311.360 4.146 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2cc3cccc(F)c3o2)s1 ZINC000338350222 526406260 /nfs/dbraw/zinc/40/62/60/526406260.db2.gz DQTDWBOAONZDQV-BDAKNGLRSA-N 1 2 305.378 4.144 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2nc(C(C)(C)C)cs2)C2CC2)n1 ZINC000181624995 526440127 /nfs/dbraw/zinc/44/01/27/526440127.db2.gz QQMQRIJNAUZWQL-CQSZACIVSA-N 1 2 321.515 4.446 20 0 DIADLO Cc1noc(C)c1C[N@@H+]1CCc2c(ccc(Cl)c2Cl)C1 ZINC000338420702 526506174 /nfs/dbraw/zinc/50/61/74/526506174.db2.gz HDVUUQTWRZEHPR-UHFFFAOYSA-N 1 2 311.212 4.157 20 0 DIADLO Cc1noc(C)c1C[N@H+]1CCc2c(ccc(Cl)c2Cl)C1 ZINC000338420702 526506183 /nfs/dbraw/zinc/50/61/83/526506183.db2.gz HDVUUQTWRZEHPR-UHFFFAOYSA-N 1 2 311.212 4.157 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@@H](c1ccc(C(F)(F)F)cc1)C(C)C ZINC000130371721 526554136 /nfs/dbraw/zinc/55/41/36/526554136.db2.gz PXRHPOTZSMNVCN-OAHLLOKOSA-N 1 2 311.351 4.224 20 0 DIADLO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]Cc1cocn1 ZINC000182065175 526567886 /nfs/dbraw/zinc/56/78/86/526567886.db2.gz OSFVCVQWMLKNJP-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO c1csc(-c2nc(COc3cccc(-n4cc[nH+]c4)c3)co2)c1 ZINC000156920551 526574391 /nfs/dbraw/zinc/57/43/91/526574391.db2.gz DWAFCYVLEYYZEJ-UHFFFAOYSA-N 1 2 323.377 4.168 20 0 DIADLO Cc1nc(-c2cccc(N[C@@H](c3[nH+]ccn3C)C3CC3)c2)oc1C ZINC000128745964 526593596 /nfs/dbraw/zinc/59/35/96/526593596.db2.gz QLSSUYWIHBOXBU-QGZVFWFLSA-N 1 2 322.412 4.255 20 0 DIADLO c1snnc1C[NH2+][C@H](CCCc1ccccc1)c1ccccc1 ZINC000182123970 526635341 /nfs/dbraw/zinc/63/53/41/526635341.db2.gz XDMNQQZUMCLNCJ-LJQANCHMSA-N 1 2 323.465 4.392 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+][C@H](C)c1ccncc1F ZINC000338365809 526748633 /nfs/dbraw/zinc/74/86/33/526748633.db2.gz GURPOVJEUWZGQP-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1nc(C[N@@H+](Cc2cccs2)C[C@@H]2CCCO2)c(C)s1 ZINC000336840367 526849254 /nfs/dbraw/zinc/84/92/54/526849254.db2.gz WURKBDXJRQYAPC-AWEZNQCLSA-N 1 2 322.499 4.003 20 0 DIADLO Cc1nc(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)c(C)s1 ZINC000336840367 526849260 /nfs/dbraw/zinc/84/92/60/526849260.db2.gz WURKBDXJRQYAPC-AWEZNQCLSA-N 1 2 322.499 4.003 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)c(C)s1 ZINC000155945588 526891507 /nfs/dbraw/zinc/89/15/07/526891507.db2.gz UOKFRRJEINGSTN-SFHVURJKSA-N 1 2 309.438 4.034 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2nc(C3CC3)no2)C2CCC2)cc1 ZINC000182573439 526961365 /nfs/dbraw/zinc/96/13/65/526961365.db2.gz LNHUBURUWKDRIW-INIZCTEOSA-N 1 2 317.820 4.231 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2nc(C3CC3)no2)C2CCC2)cc1 ZINC000182573422 526962673 /nfs/dbraw/zinc/96/26/73/526962673.db2.gz LNHUBURUWKDRIW-MRXNPFEDSA-N 1 2 317.820 4.231 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2noc(C3CC3)n2)C2CCC2)cc1 ZINC000182566234 526963072 /nfs/dbraw/zinc/96/30/72/526963072.db2.gz NKCSXFOVOVFDOU-MRXNPFEDSA-N 1 2 317.820 4.231 20 0 DIADLO Clc1cccc(C2([NH2+]Cc3nc(C4CC4)no3)CCCC2)c1 ZINC000181459727 526974287 /nfs/dbraw/zinc/97/42/87/526974287.db2.gz WXSFKFMHJOLHGL-UHFFFAOYSA-N 1 2 317.820 4.160 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@H](C)CC(C)C)c2ccc(Cl)cc2)no1 ZINC000179897805 527039292 /nfs/dbraw/zinc/03/92/92/527039292.db2.gz PLQSVCZNWFJSKD-ABAIWWIYSA-N 1 2 307.825 4.145 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](c2nc3ccccc3[nH]2)C(C)C)cs1 ZINC000269399088 527066134 /nfs/dbraw/zinc/06/61/34/527066134.db2.gz FUIRITJTGFDMNP-MEDUHNTESA-N 1 2 314.458 4.376 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cccc(C4CCC4)c3)cc2[nH+]1 ZINC000337035549 527146571 /nfs/dbraw/zinc/14/65/71/527146571.db2.gz GBYNKNOJHFEITN-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO Cc1[nH]c2cc(NC(=O)c3cccc(C4CCC4)c3)ccc2[nH+]1 ZINC000337035549 527146576 /nfs/dbraw/zinc/14/65/76/527146576.db2.gz GBYNKNOJHFEITN-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1cc(-c2cccs2)on1 ZINC000181087731 527405724 /nfs/dbraw/zinc/40/57/24/527405724.db2.gz UESWXZCDHQWPAZ-HNNXBMFYSA-N 1 2 313.426 4.079 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1cc(-c2cccs2)on1 ZINC000181087731 527405728 /nfs/dbraw/zinc/40/57/28/527405728.db2.gz UESWXZCDHQWPAZ-HNNXBMFYSA-N 1 2 313.426 4.079 20 0 DIADLO Cc1nccnc1[C@H](C)[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000188185738 527458510 /nfs/dbraw/zinc/45/85/10/527458510.db2.gz PSRBQPQCRLOTLY-KBPBESRZSA-N 1 2 324.453 4.320 20 0 DIADLO OCCC[C@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1ccccc1 ZINC000267402229 527544582 /nfs/dbraw/zinc/54/45/82/527544582.db2.gz PQDIHZUMINUOLX-AWEZNQCLSA-N 1 2 310.319 4.026 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@H+](Cc2ncc(Cl)s2)CC12CCC2 ZINC000338388130 527677384 /nfs/dbraw/zinc/67/73/84/527677384.db2.gz VEWUMVRBTQYSHJ-SECBINFHSA-N 1 2 324.799 4.351 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@@H+](Cc2ncc(Cl)s2)CC12CCC2 ZINC000338388130 527677387 /nfs/dbraw/zinc/67/73/87/527677387.db2.gz VEWUMVRBTQYSHJ-SECBINFHSA-N 1 2 324.799 4.351 20 0 DIADLO CC(C)(C)OC(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000284725050 534919650 /nfs/dbraw/zinc/91/96/50/534919650.db2.gz RSZQHKHDTQDKIT-UHFFFAOYSA-N 1 2 314.385 4.200 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](COC)c2cccc(Cl)c2)cs1 ZINC000288642078 535530131 /nfs/dbraw/zinc/53/01/31/535530131.db2.gz AQVFZSQWHWLDNV-HNNXBMFYSA-N 1 2 324.877 4.226 20 0 DIADLO CCN(Cc1c(F)cccc1F)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287455863 535780247 /nfs/dbraw/zinc/78/02/47/535780247.db2.gz IKRMOINQKGJZNN-UHFFFAOYSA-N 1 2 319.355 4.031 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(-c2ccco2)no1)c1ccc(Cl)s1 ZINC000273534216 535806368 /nfs/dbraw/zinc/80/63/68/535806368.db2.gz UIGWJIGMVQFRPD-SECBINFHSA-N 1 2 323.805 4.285 20 0 DIADLO CC[C@@H](Oc1cccc(C)c1)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000273940689 535818159 /nfs/dbraw/zinc/81/81/59/535818159.db2.gz MYACGWYQNSEIOU-QGZVFWFLSA-N 1 2 323.396 4.202 20 0 DIADLO COCC[C@@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1ccc(C)o1 ZINC000279235327 536805317 /nfs/dbraw/zinc/80/53/17/536805317.db2.gz ZFVVRTPWFQAQQY-CYBMUJFWSA-N 1 2 322.474 4.209 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1ncc(CSC)s1 ZINC000293631715 537005794 /nfs/dbraw/zinc/00/57/94/537005794.db2.gz RBMODCZVEUDQDH-UHFFFAOYSA-N 1 2 322.499 4.040 20 0 DIADLO C[N@H+](CCC1CCCCC1)Cc1sncc1Br ZINC001167273351 1036351903 /nfs/dbraw/zinc/35/19/03/1036351903.db2.gz CVWXMBVIAFRTCZ-UHFFFAOYSA-N 1 2 317.296 4.308 20 0 DIADLO C[N@@H+](CCC1CCCCC1)Cc1sncc1Br ZINC001167273351 1036351917 /nfs/dbraw/zinc/35/19/17/1036351917.db2.gz CVWXMBVIAFRTCZ-UHFFFAOYSA-N 1 2 317.296 4.308 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nnc(C(F)(F)F)s2)c(C)s1 ZINC000660178523 1041649872 /nfs/dbraw/zinc/64/98/72/1041649872.db2.gz LYZXDRUIKDGXEM-SSDOTTSWSA-N 1 2 321.393 4.086 20 0 DIADLO Brc1cccc([C@@H]2CCC[N@@H+]2Cc2ccns2)c1 ZINC001190407833 1048732998 /nfs/dbraw/zinc/73/29/98/1048732998.db2.gz QTUFGJBKWUIUDA-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cccc([C@@H]2CCC[N@H+]2Cc2ccns2)c1 ZINC001190407833 1048733004 /nfs/dbraw/zinc/73/30/04/1048733004.db2.gz QTUFGJBKWUIUDA-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1ccc(F)c(C[NH+]2CCC(F)(F)CC2)c1Br ZINC001235763445 1054801266 /nfs/dbraw/zinc/80/12/66/1054801266.db2.gz VGYCFPBAJNOLDW-UHFFFAOYSA-N 1 2 322.168 4.128 20 0 DIADLO Cc1cc(NCc2cccc3[nH+]ccn32)cc(C(F)(F)F)c1 ZINC000683079345 1035512693 /nfs/dbraw/zinc/51/26/93/1035512693.db2.gz VDQWQAQIYCSRDE-UHFFFAOYSA-N 1 2 305.303 4.274 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@H]2c2ccncc2)cs1 ZINC000153895446 1035597755 /nfs/dbraw/zinc/59/77/55/1035597755.db2.gz VVKVUSFMLSFEGR-HNNXBMFYSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@H]2c2ccncc2)cs1 ZINC000153895446 1035597764 /nfs/dbraw/zinc/59/77/64/1035597764.db2.gz VVKVUSFMLSFEGR-HNNXBMFYSA-N 1 2 301.459 4.173 20 0 DIADLO Cc1cc(C)c(Nc2cc(C)c(Br)c(C)n2)c[nH+]1 ZINC001213503342 1035609540 /nfs/dbraw/zinc/60/95/40/1035609540.db2.gz ACCYHIYXKOAQIB-UHFFFAOYSA-N 1 2 306.207 4.216 20 0 DIADLO Cc1cnccc1C[N@H+]1C[C@H](c2ccccc2Cl)OC[C@H]1C ZINC000579797030 1035622205 /nfs/dbraw/zinc/62/22/05/1035622205.db2.gz WTLJSIQUQZXVOE-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cnccc1C[N@@H+]1C[C@H](c2ccccc2Cl)OC[C@H]1C ZINC000579797030 1035622217 /nfs/dbraw/zinc/62/22/17/1035622217.db2.gz WTLJSIQUQZXVOE-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO COc1cccc(C(F)(F)F)c1Nc1cccn2cc(C)[nH+]c12 ZINC001213341370 1035637962 /nfs/dbraw/zinc/63/79/62/1035637962.db2.gz TUOUKTXLBNLEID-UHFFFAOYSA-N 1 2 321.302 4.414 20 0 DIADLO S=c1oc(-c2cccs2)nn1C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000728199946 1035725762 /nfs/dbraw/zinc/72/57/62/1035725762.db2.gz OKMMNJHFAZSHES-GFCCVEGCSA-N 1 2 321.471 4.156 20 0 DIADLO S=c1oc(-c2cccs2)nn1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000728199946 1035725774 /nfs/dbraw/zinc/72/57/74/1035725774.db2.gz OKMMNJHFAZSHES-GFCCVEGCSA-N 1 2 321.471 4.156 20 0 DIADLO CC[C@H]1CCC[C@@]1(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001125301515 1035844183 /nfs/dbraw/zinc/84/41/83/1035844183.db2.gz UJYPEYSXRBUVQO-SCLBCKFNSA-N 1 2 315.392 4.166 20 0 DIADLO Clc1ccc(Cl)c(C[NH2+][C@H](c2ccccn2)C2CC2)n1 ZINC000932384135 1035844490 /nfs/dbraw/zinc/84/44/90/1035844490.db2.gz PPTWIKAEYBCXCL-HNNXBMFYSA-N 1 2 308.212 4.024 20 0 DIADLO CC(C)c1cccc(NC(=O)c2cccc(Cn3cc[nH+]c3)c2)c1 ZINC000047248067 1035845067 /nfs/dbraw/zinc/84/50/67/1035845067.db2.gz MTUCTDULDFQYAF-UHFFFAOYSA-N 1 2 319.408 4.307 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1ccc2c(c1)CCCC2 ZINC000154325837 1035866705 /nfs/dbraw/zinc/86/67/05/1035866705.db2.gz NCWHVRADWDMDAV-ZDUSSCGKSA-N 1 2 313.445 4.097 20 0 DIADLO c1coc(C[N@H+](Cc2cccs2)Cc2cnn3ccccc23)c1 ZINC000179604123 1035899097 /nfs/dbraw/zinc/89/90/97/1035899097.db2.gz RLHGAHMHXLMONL-UHFFFAOYSA-N 1 2 323.421 4.191 20 0 DIADLO c1coc(C[N@@H+](Cc2cccs2)Cc2cnn3ccccc23)c1 ZINC000179604123 1035899126 /nfs/dbraw/zinc/89/91/26/1035899126.db2.gz RLHGAHMHXLMONL-UHFFFAOYSA-N 1 2 323.421 4.191 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](Cc1c[nH]c(-c2ccccc2)n1)C1CC1 ZINC000179610371 1035905430 /nfs/dbraw/zinc/90/54/30/1035905430.db2.gz BMUYNDCAOIIELO-AWEZNQCLSA-N 1 2 307.397 4.395 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](Cc1c[nH]c(-c2ccccc2)n1)C1CC1 ZINC000179610371 1035905450 /nfs/dbraw/zinc/90/54/50/1035905450.db2.gz BMUYNDCAOIIELO-AWEZNQCLSA-N 1 2 307.397 4.395 20 0 DIADLO Cc1ccnc(C[N@@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)n1 ZINC000339661534 1035906672 /nfs/dbraw/zinc/90/66/72/1035906672.db2.gz OJRYDUAKAJFIMN-HXUWFJFHSA-N 1 2 315.420 4.085 20 0 DIADLO Cc1ccnc(C[N@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)n1 ZINC000339661534 1035906684 /nfs/dbraw/zinc/90/66/84/1035906684.db2.gz OJRYDUAKAJFIMN-HXUWFJFHSA-N 1 2 315.420 4.085 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nccn1C)c1ccc(Cl)cc1Cl ZINC000339674861 1035911594 /nfs/dbraw/zinc/91/15/94/1035911594.db2.gz CLLDDWGFNIYPGE-CQSZACIVSA-N 1 2 312.244 4.358 20 0 DIADLO Fc1ccc(C[C@@H]2CCC[N@H+](Cc3csc(Cl)n3)C2)cc1 ZINC001139978319 1035941668 /nfs/dbraw/zinc/94/16/68/1035941668.db2.gz QQKOFSILEVKGSC-ZDUSSCGKSA-N 1 2 324.852 4.390 20 0 DIADLO Fc1ccc(C[C@@H]2CCC[N@@H+](Cc3csc(Cl)n3)C2)cc1 ZINC001139978319 1035941677 /nfs/dbraw/zinc/94/16/77/1035941677.db2.gz QQKOFSILEVKGSC-ZDUSSCGKSA-N 1 2 324.852 4.390 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2ccccc2OC(F)F)cs1 ZINC000037084626 1035942458 /nfs/dbraw/zinc/94/24/58/1035942458.db2.gz OTMOITDZBAOVHM-UWVGGRQHSA-N 1 2 312.385 4.465 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@@H+]1Cc3cnn(-c4ccccc4)c3C1)CC2 ZINC000339804356 1035965495 /nfs/dbraw/zinc/96/54/95/1035965495.db2.gz QIGMQGZWEATUSL-IBGZPJMESA-N 1 2 319.383 4.015 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@H+]1Cc3cnn(-c4ccccc4)c3C1)CC2 ZINC000339804356 1035965510 /nfs/dbraw/zinc/96/55/10/1035965510.db2.gz QIGMQGZWEATUSL-IBGZPJMESA-N 1 2 319.383 4.015 20 0 DIADLO C[C@]1(F)CC[N@H+](CCc2ccc(Cl)cc2Cl)C[C@H]1F ZINC001209081248 1036008870 /nfs/dbraw/zinc/00/88/70/1036008870.db2.gz NBLVQTBLXUFPSB-KGLIPLIRSA-N 1 2 308.199 4.308 20 0 DIADLO C[C@]1(F)CC[N@@H+](CCc2ccc(Cl)cc2Cl)C[C@H]1F ZINC001209081248 1036008892 /nfs/dbraw/zinc/00/88/92/1036008892.db2.gz NBLVQTBLXUFPSB-KGLIPLIRSA-N 1 2 308.199 4.308 20 0 DIADLO COc1cc(C)ccc1C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000180760473 1036086305 /nfs/dbraw/zinc/08/63/05/1036086305.db2.gz JXRWQCHRGWWMMY-NRFANRHFSA-N 1 2 318.420 4.278 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+](CC)Cc1ccc(Cl)c(Cl)c1 ZINC001167115727 1036108175 /nfs/dbraw/zinc/10/81/75/1036108175.db2.gz IQGMUCQLPBHIAL-NSHDSACASA-N 1 2 318.244 4.157 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+](CC)Cc1ccc(Cl)c(Cl)c1 ZINC001167115727 1036108188 /nfs/dbraw/zinc/10/81/88/1036108188.db2.gz IQGMUCQLPBHIAL-NSHDSACASA-N 1 2 318.244 4.157 20 0 DIADLO CCc1nc(N(Cc2ccco2)Cc2cccs2)cc(C)[nH+]1 ZINC000339974500 1036108655 /nfs/dbraw/zinc/10/86/55/1036108655.db2.gz JJDAQKKIHNICMJ-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1c(F)cccc1N1CCCC1 ZINC000120490709 1036171094 /nfs/dbraw/zinc/17/10/94/1036171094.db2.gz PCMOXXZIULERAE-UHFFFAOYSA-N 1 2 304.434 4.119 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1c(F)cccc1N1CCCC1 ZINC000120490709 1036171100 /nfs/dbraw/zinc/17/11/00/1036171100.db2.gz PCMOXXZIULERAE-UHFFFAOYSA-N 1 2 304.434 4.119 20 0 DIADLO Cc1csc(C[NH2+]C(c2cccs2)c2cccs2)n1 ZINC000038091092 1036225547 /nfs/dbraw/zinc/22/55/47/1036225547.db2.gz UBPFVGOSNHDXJO-UHFFFAOYSA-N 1 2 306.481 4.454 20 0 DIADLO Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@H](C)c1csnn1 ZINC000398265298 1036300714 /nfs/dbraw/zinc/30/07/14/1036300714.db2.gz CATFKTDAJJAQCB-BDAKNGLRSA-N 1 2 310.492 4.012 20 0 DIADLO CC(C)Oc1ccccc1C[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000236680148 1036302068 /nfs/dbraw/zinc/30/20/68/1036302068.db2.gz YOGRVNMLVXHPNV-UHFFFAOYSA-N 1 2 322.408 4.419 20 0 DIADLO CC[N@H+](Cc1cc(OC(C)C)ccn1)Cc1ccccc1F ZINC001167243919 1036310039 /nfs/dbraw/zinc/31/00/39/1036310039.db2.gz AOUUHJVGCUMUPM-UHFFFAOYSA-N 1 2 302.393 4.030 20 0 DIADLO CC[N@@H+](Cc1cc(OC(C)C)ccn1)Cc1ccccc1F ZINC001167243919 1036310049 /nfs/dbraw/zinc/31/00/49/1036310049.db2.gz AOUUHJVGCUMUPM-UHFFFAOYSA-N 1 2 302.393 4.030 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1cc(F)ccc1F ZINC000120901431 1036372101 /nfs/dbraw/zinc/37/21/01/1036372101.db2.gz GHIJJOUCWQZXID-GFCCVEGCSA-N 1 2 305.372 4.127 20 0 DIADLO C[C@@H]([NH2+]Cc1ccon1)c1cccc(OCc2ccccc2)c1 ZINC000683524239 1036438725 /nfs/dbraw/zinc/43/87/25/1036438725.db2.gz FRJHNBFSMIYRNV-OAHLLOKOSA-N 1 2 308.381 4.104 20 0 DIADLO CCCC[N@H+](Cc1cc2n(n1)CCCC2)Cc1ccccc1F ZINC001167294398 1036485726 /nfs/dbraw/zinc/48/57/26/1036485726.db2.gz PKIHKSQBQDWQAJ-UHFFFAOYSA-N 1 2 315.436 4.161 20 0 DIADLO CCCC[N@@H+](Cc1cc2n(n1)CCCC2)Cc1ccccc1F ZINC001167294398 1036485742 /nfs/dbraw/zinc/48/57/42/1036485742.db2.gz PKIHKSQBQDWQAJ-UHFFFAOYSA-N 1 2 315.436 4.161 20 0 DIADLO CCCCOc1ccccc1CNc1cc(COC)cc[nH+]1 ZINC000650243554 1036500499 /nfs/dbraw/zinc/50/04/99/1036500499.db2.gz DUNOEMUDXQEXQP-UHFFFAOYSA-N 1 2 300.402 4.019 20 0 DIADLO Fc1cccc([C@H]([NH2+][C@H]2CCCn3ccnc32)c2ccccc2)c1 ZINC000655723271 1036505799 /nfs/dbraw/zinc/50/57/99/1036505799.db2.gz MMIRGNZWMPWOBD-RBUKOAKNSA-N 1 2 321.399 4.236 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCn2ccnc21)c1cccc(Cl)c1Cl ZINC000655726734 1036508260 /nfs/dbraw/zinc/50/82/60/1036508260.db2.gz PCUJDQXEUSTKDT-GXFFZTMASA-N 1 2 310.228 4.376 20 0 DIADLO COc1c(C)cccc1C[NH2+]Cc1csc(C(C)(C)C)n1 ZINC000655832597 1036574679 /nfs/dbraw/zinc/57/46/79/1036574679.db2.gz XNMASXOLWSGJDZ-UHFFFAOYSA-N 1 2 304.459 4.047 20 0 DIADLO Cc1ccc(NC(=O)c2cc3cc(C)c(C)cc3o2)c(N(C)C)[nH+]1 ZINC001266515990 1036586869 /nfs/dbraw/zinc/58/68/69/1036586869.db2.gz OKPVHQJPXRKPCS-UHFFFAOYSA-N 1 2 323.396 4.071 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)c(N(C)C)[nH+]1 ZINC001266516177 1036590420 /nfs/dbraw/zinc/59/04/20/1036590420.db2.gz UALTXHYNQJCBKR-HRCADAONSA-N 1 2 315.461 4.001 20 0 DIADLO C=C(C)[C@@H]([NH2+]Cc1cccnc1Cl)c1ccc(F)c(F)c1 ZINC000187371922 1036610627 /nfs/dbraw/zinc/61/06/27/1036610627.db2.gz YWDUEBNRKAMYNE-OAHLLOKOSA-N 1 2 308.759 4.420 20 0 DIADLO COc1ccc(Cl)cc1C[C@@H]1CCCN(c2cccc[nH+]2)C1 ZINC000525463153 1036655891 /nfs/dbraw/zinc/65/58/91/1036655891.db2.gz YZZOXRXHGYGHOB-AWEZNQCLSA-N 1 2 316.832 4.203 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H](C)c2csc(C(C)C)n2)ccn1 ZINC000348639130 1036744458 /nfs/dbraw/zinc/74/44/58/1036744458.db2.gz GNRISLCXKKSBDZ-NEPJUHHUSA-N 1 2 305.447 4.082 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)C12CC3CC(CC(C3)C1)C2 ZINC000047514904 1036782492 /nfs/dbraw/zinc/78/24/92/1036782492.db2.gz YQFROOUUIJAKEK-UHFFFAOYSA-N 1 2 321.424 4.027 20 0 DIADLO C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@H+](C)Cc1cscn1 ZINC000063592753 1036904826 /nfs/dbraw/zinc/90/48/26/1036904826.db2.gz VHEQHCYQXPEPHE-JTQLQIEISA-N 1 2 316.348 4.235 20 0 DIADLO C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@@H+](C)Cc1cscn1 ZINC000063592753 1036904846 /nfs/dbraw/zinc/90/48/46/1036904846.db2.gz VHEQHCYQXPEPHE-JTQLQIEISA-N 1 2 316.348 4.235 20 0 DIADLO c1cn(Cc2ccc(Nc3cnc4sccc4c3)cc2)c[nH+]1 ZINC001210693462 1036922004 /nfs/dbraw/zinc/92/20/04/1036922004.db2.gz HHOWKSQOJSEKTM-UHFFFAOYSA-N 1 2 306.394 4.285 20 0 DIADLO Cc1noc([C@@H](C)[N@H+](C)Cc2ccc(-c3ccccc3)s2)n1 ZINC000580095261 1036945251 /nfs/dbraw/zinc/94/52/51/1036945251.db2.gz NRPYMEBLJZJFNT-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2ccc(-c3ccccc3)s2)n1 ZINC000580095261 1036945266 /nfs/dbraw/zinc/94/52/66/1036945266.db2.gz NRPYMEBLJZJFNT-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO COc1cc(Nc2cc(Cl)ncc2C(F)(F)F)cc(C)[nH+]1 ZINC001210776061 1036957059 /nfs/dbraw/zinc/95/70/59/1036957059.db2.gz LJBRFWZLNAOFSX-UHFFFAOYSA-N 1 2 317.698 4.209 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1nc(C)sc1C)c1ccc(Cl)cc1 ZINC000683822482 1036973533 /nfs/dbraw/zinc/97/35/33/1036973533.db2.gz UWDLIWBSLDCAIJ-ZUZCIYMTSA-N 1 2 324.877 4.452 20 0 DIADLO Fc1ccc2c(c1F)C[N@@H+](Cc1ccc3cnccc3c1)CC2 ZINC000683831538 1036991175 /nfs/dbraw/zinc/99/11/75/1036991175.db2.gz CBPXIFWZMDONAI-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1ccc2c(c1F)C[N@H+](Cc1ccc3cnccc3c1)CC2 ZINC000683831538 1036991186 /nfs/dbraw/zinc/99/11/86/1036991186.db2.gz CBPXIFWZMDONAI-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO CCOc1ccc(C[N@@H+]2CC[C@H]2c2cccc(F)c2)cc1F ZINC000683833054 1036993076 /nfs/dbraw/zinc/99/30/76/1036993076.db2.gz QWRXCJGKWITHKL-KRWDZBQOSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1ccc(C[N@H+]2CC[C@H]2c2cccc(F)c2)cc1F ZINC000683833054 1036993089 /nfs/dbraw/zinc/99/30/89/1036993089.db2.gz QWRXCJGKWITHKL-KRWDZBQOSA-N 1 2 303.352 4.311 20 0 DIADLO Fc1c(F)c(F)c(C[N@@H+]2CCC[C@H]2C2CCC2)c(F)c1F ZINC000728289985 1037031208 /nfs/dbraw/zinc/03/12/08/1037031208.db2.gz VCTLITFAHPWKOL-JTQLQIEISA-N 1 2 305.290 4.147 20 0 DIADLO Fc1c(F)c(F)c(C[N@H+]2CCC[C@H]2C2CCC2)c(F)c1F ZINC000728289985 1037031215 /nfs/dbraw/zinc/03/12/15/1037031215.db2.gz VCTLITFAHPWKOL-JTQLQIEISA-N 1 2 305.290 4.147 20 0 DIADLO Cc1[nH+]c2ccccn2c1Nc1cc(Cl)c(O)c(Cl)c1 ZINC001210924576 1037053710 /nfs/dbraw/zinc/05/37/10/1037053710.db2.gz NDJHZQAKDLVNQI-UHFFFAOYSA-N 1 2 308.168 4.399 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1cc2ccccc2[nH]1 ZINC000683923139 1037101526 /nfs/dbraw/zinc/10/15/26/1037101526.db2.gz WZGJOBKGYCXZFR-UHFFFAOYSA-N 1 2 310.788 4.320 20 0 DIADLO Cc1oc(C(C)C)cc1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000349329422 1037178847 /nfs/dbraw/zinc/17/88/47/1037178847.db2.gz YLZRHDISKZQOGI-UHFFFAOYSA-N 1 2 309.369 4.149 20 0 DIADLO O=C(c1ccc(-n2cc[nH+]c2)cc1)N1CCC[C@H]1CC1CCCC1 ZINC000655365836 1037189781 /nfs/dbraw/zinc/18/97/81/1037189781.db2.gz AXQDRHLMWJSFPF-IBGZPJMESA-N 1 2 323.440 4.057 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc(-c3cccs3)s2)C2(CCC2)CO1 ZINC000651974809 1037226481 /nfs/dbraw/zinc/22/64/81/1037226481.db2.gz QCJOZBKFNMHRMW-LBPRGKRZSA-N 1 2 320.483 4.015 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnc(-c3cccs3)s2)C2(CCC2)CO1 ZINC000651974809 1037226495 /nfs/dbraw/zinc/22/64/95/1037226495.db2.gz QCJOZBKFNMHRMW-LBPRGKRZSA-N 1 2 320.483 4.015 20 0 DIADLO FC1CC2(C1)C[NH+](Cc1oc3ccccc3c1Br)C2 ZINC000656263268 1037229446 /nfs/dbraw/zinc/22/94/46/1037229446.db2.gz GHDVHYWKJBXUEZ-UHFFFAOYSA-N 1 2 324.193 4.129 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1c(Cl)ccc(F)c1Cl ZINC000222506569 1037230220 /nfs/dbraw/zinc/23/02/20/1037230220.db2.gz BTKQTFBXSZZVHC-JGVFFNPUSA-N 1 2 302.180 4.267 20 0 DIADLO CC(C)[C@H]1CCC[N@H+](Cc2ncsc2Br)CC1 ZINC001167426120 1037230929 /nfs/dbraw/zinc/23/09/29/1037230929.db2.gz USQKZLUWZWCFFY-NSHDSACASA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)[C@H]1CCC[N@@H+](Cc2ncsc2Br)CC1 ZINC001167426120 1037230942 /nfs/dbraw/zinc/23/09/42/1037230942.db2.gz USQKZLUWZWCFFY-NSHDSACASA-N 1 2 317.296 4.164 20 0 DIADLO Cc1noc([C@H]2CCCC[N@@H+]2Cc2c(C)cc(Cl)cc2C)n1 ZINC000580677176 1037245544 /nfs/dbraw/zinc/24/55/44/1037245544.db2.gz NASFFCDXHOYWRH-MRXNPFEDSA-N 1 2 319.836 4.375 20 0 DIADLO Cc1noc([C@H]2CCCC[N@H+]2Cc2c(C)cc(Cl)cc2C)n1 ZINC000580677176 1037245558 /nfs/dbraw/zinc/24/55/58/1037245558.db2.gz NASFFCDXHOYWRH-MRXNPFEDSA-N 1 2 319.836 4.375 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3ccccc3[nH]2)[C@H](c2ccccc2)CO1 ZINC000684021327 1037245666 /nfs/dbraw/zinc/24/56/66/1037245666.db2.gz OARFMFSEBHWZNJ-QRWLVFNGSA-N 1 2 306.409 4.130 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)[C@H](c2ccccc2)CO1 ZINC000684021327 1037245685 /nfs/dbraw/zinc/24/56/85/1037245685.db2.gz OARFMFSEBHWZNJ-QRWLVFNGSA-N 1 2 306.409 4.130 20 0 DIADLO CC(C)C[C@H]1COCC[N@@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001167429688 1037248195 /nfs/dbraw/zinc/24/81/95/1037248195.db2.gz MILHSQBKFITFKF-INIZCTEOSA-N 1 2 316.272 4.283 20 0 DIADLO CC(C)C[C@H]1COCC[N@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001167429688 1037248210 /nfs/dbraw/zinc/24/82/10/1037248210.db2.gz MILHSQBKFITFKF-INIZCTEOSA-N 1 2 316.272 4.283 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cc(Br)cnc2F)cc1 ZINC001211272199 1037264625 /nfs/dbraw/zinc/26/46/25/1037264625.db2.gz WTOCBXJVOBTFBW-UHFFFAOYSA-N 1 2 324.197 4.183 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cc(Br)cnc2F)cc1 ZINC001211272199 1037264637 /nfs/dbraw/zinc/26/46/37/1037264637.db2.gz WTOCBXJVOBTFBW-UHFFFAOYSA-N 1 2 324.197 4.183 20 0 DIADLO CCOc1cccc(/C=C/C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC001125473970 1037303511 /nfs/dbraw/zinc/30/35/11/1037303511.db2.gz QPMNAZJHXJDGLK-MDZDMXLPSA-N 1 2 310.397 4.057 20 0 DIADLO Cc1noc(C)c1C[N@@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000048055536 1037309764 /nfs/dbraw/zinc/30/97/64/1037309764.db2.gz UNNMFCULZQYOLG-MEDUHNTESA-N 1 2 300.402 4.172 20 0 DIADLO Cc1noc(C)c1C[N@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000048055536 1037309776 /nfs/dbraw/zinc/30/97/76/1037309776.db2.gz UNNMFCULZQYOLG-MEDUHNTESA-N 1 2 300.402 4.172 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+]Cc2cc3ccccc3o2)s1 ZINC000684111441 1037357986 /nfs/dbraw/zinc/35/79/86/1037357986.db2.gz IRFLKTZWCGJGTJ-UHFFFAOYSA-N 1 2 300.427 4.477 20 0 DIADLO CCC(CC)CC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001125480300 1037379968 /nfs/dbraw/zinc/37/99/68/1037379968.db2.gz GXIKVISTOHJKDV-UHFFFAOYSA-N 1 2 305.809 4.291 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)[C@]12C[C@H]1CCCC2 ZINC001125480471 1037381066 /nfs/dbraw/zinc/38/10/66/1037381066.db2.gz MSEYLOANOZMDAL-SJKOYZFVSA-N 1 2 315.804 4.045 20 0 DIADLO Cc1nnc(C[N@@H+]([C@@H](C)c2ccc3ccccc3c2)C2CC2)o1 ZINC000063577279 1037403305 /nfs/dbraw/zinc/40/33/05/1037403305.db2.gz MRLGGMZVYPMDTH-ZDUSSCGKSA-N 1 2 307.397 4.257 20 0 DIADLO Cc1nnc(C[N@H+]([C@@H](C)c2ccc3ccccc3c2)C2CC2)o1 ZINC000063577279 1037403321 /nfs/dbraw/zinc/40/33/21/1037403321.db2.gz MRLGGMZVYPMDTH-ZDUSSCGKSA-N 1 2 307.397 4.257 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+]1CCc2ccccc2[C@H]1C ZINC001143387848 1037417296 /nfs/dbraw/zinc/41/72/96/1037417296.db2.gz WEDUHKQXKDCVJC-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+]1CCc2ccccc2[C@H]1C ZINC001143387848 1037417297 /nfs/dbraw/zinc/41/72/97/1037417297.db2.gz WEDUHKQXKDCVJC-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CCC(F)(F)[C@H](C)C2)cc1Cl ZINC000581162989 1037458951 /nfs/dbraw/zinc/45/89/51/1037458951.db2.gz IMJIMTISLFZQKG-SECBINFHSA-N 1 2 324.198 4.479 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CCC(F)(F)[C@H](C)C2)cc1Cl ZINC000581162989 1037458959 /nfs/dbraw/zinc/45/89/59/1037458959.db2.gz IMJIMTISLFZQKG-SECBINFHSA-N 1 2 324.198 4.479 20 0 DIADLO Fc1cc(Br)ccc1C[N@H+]1CCC[C@H](C(F)F)C1 ZINC001204553707 1037486683 /nfs/dbraw/zinc/48/66/83/1037486683.db2.gz BPAKEFHNBLGKBZ-JTQLQIEISA-N 1 2 322.168 4.065 20 0 DIADLO Fc1cc(Br)ccc1C[N@@H+]1CCC[C@H](C(F)F)C1 ZINC001204553707 1037486684 /nfs/dbraw/zinc/48/66/84/1037486684.db2.gz BPAKEFHNBLGKBZ-JTQLQIEISA-N 1 2 322.168 4.065 20 0 DIADLO CCCc1ccc([C@@H]([NH2+]Cc2ncc[nH]2)c2cccs2)cc1 ZINC000067667153 1037519499 /nfs/dbraw/zinc/51/94/99/1037519499.db2.gz WCPKNFJFWQOHRX-GOSISDBHSA-N 1 2 311.454 4.303 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1ccccc1Br ZINC000067960924 1037527799 /nfs/dbraw/zinc/52/77/99/1037527799.db2.gz NHXIEIVGYNDMKI-LBPRGKRZSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccccc1Br ZINC000067960924 1037527805 /nfs/dbraw/zinc/52/78/05/1037527805.db2.gz NHXIEIVGYNDMKI-LBPRGKRZSA-N 1 2 305.219 4.037 20 0 DIADLO COC(=O)c1c(F)ccc(Nc2c[nH+]cc(C)c2C)c1Cl ZINC001213534392 1037530504 /nfs/dbraw/zinc/53/05/04/1037530504.db2.gz ZWFQQJAPPYDFDP-UHFFFAOYSA-N 1 2 308.740 4.021 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CCc3cc4ccccc4o3)cc2[nH+]1 ZINC000340971806 1037541738 /nfs/dbraw/zinc/54/17/38/1037541738.db2.gz LBENRUITKKPLNE-UHFFFAOYSA-N 1 2 319.364 4.189 20 0 DIADLO Cc1cccc(C2([NH2+]Cc3nnc(C(C)(C)C)o3)CCCC2)c1 ZINC000072962867 1037701910 /nfs/dbraw/zinc/70/19/10/1037701910.db2.gz XRCVYJFOAHOOGL-UHFFFAOYSA-N 1 2 313.445 4.235 20 0 DIADLO COc1cc(C)c(C)cc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000656659773 1037755755 /nfs/dbraw/zinc/75/57/55/1037755755.db2.gz KQPHXTJUMAZGOD-UHFFFAOYSA-N 1 2 321.424 4.169 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2c(F)c(F)cc(F)c2F)cc1 ZINC000090229012 1037761762 /nfs/dbraw/zinc/76/17/62/1037761762.db2.gz CINLMMDNLAKXDG-SECBINFHSA-N 1 2 313.294 4.102 20 0 DIADLO CC(C)c1cnc(C[NH+]2CC(Cc3ccc(F)cc3)C2)s1 ZINC000656668668 1037773721 /nfs/dbraw/zinc/77/37/21/1037773721.db2.gz LDUWMVSNBGQJGI-UHFFFAOYSA-N 1 2 304.434 4.080 20 0 DIADLO FC(F)(F)CC1C[NH+](Cc2ncc(-c3ccccc3)s2)C1 ZINC000656688040 1037795225 /nfs/dbraw/zinc/79/52/25/1037795225.db2.gz DEYPZMSGYSALDU-UHFFFAOYSA-N 1 2 312.360 4.194 20 0 DIADLO CC(C)Cn1nccc1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000647168905 1037801900 /nfs/dbraw/zinc/80/19/00/1037801900.db2.gz QFXWGFGTAYGOAI-LJQANCHMSA-N 1 2 309.413 4.011 20 0 DIADLO FC(F)C1C[NH+](Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000656690673 1037802595 /nfs/dbraw/zinc/80/25/95/1037802595.db2.gz NUUDZIYCYIFURD-UHFFFAOYSA-N 1 2 320.364 4.253 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1c(C2CCC2)cnn1C ZINC000656769541 1037854043 /nfs/dbraw/zinc/85/40/43/1037854043.db2.gz QZMNWSHEQHUOSV-UHFFFAOYSA-N 1 2 323.444 4.059 20 0 DIADLO c1cc(-c2n[nH]cc2CNc2c[nH+]cc3c2CCCC3)cs1 ZINC000656776810 1037864781 /nfs/dbraw/zinc/86/47/81/1037864781.db2.gz SRNZDTZKPGSERQ-UHFFFAOYSA-N 1 2 310.426 4.024 20 0 DIADLO c1nc(-c2ccccn2)sc1CNc1c[nH+]cc2c1CCCC2 ZINC000656777036 1037865782 /nfs/dbraw/zinc/86/57/82/1037865782.db2.gz YICYKHFKOKUOSO-UHFFFAOYSA-N 1 2 322.437 4.091 20 0 DIADLO Fc1cccc(Br)c1C[NH2+]Cc1ccc(Cl)o1 ZINC000684368062 1037871949 /nfs/dbraw/zinc/87/19/49/1037871949.db2.gz BFHCYAPMFYQQEQ-UHFFFAOYSA-N 1 2 318.573 4.124 20 0 DIADLO CC(C)c1cc(N[C@@H](C)c2ccc(F)cn2)nc(C(C)C)[nH+]1 ZINC001167479002 1037921232 /nfs/dbraw/zinc/92/12/32/1037921232.db2.gz FYEHMXXNFCBSQX-LBPRGKRZSA-N 1 2 302.397 4.431 20 0 DIADLO C[C@@]1(F)CCC[N@H+](Cc2cc(C(F)(F)F)cnc2Cl)CC1 ZINC001232006427 1037994385 /nfs/dbraw/zinc/99/43/85/1037994385.db2.gz XCIMNIMTYOEWIV-CYBMUJFWSA-N 1 2 324.749 4.468 20 0 DIADLO C[C@@]1(F)CCC[N@@H+](Cc2cc(C(F)(F)F)cnc2Cl)CC1 ZINC001232006427 1037994394 /nfs/dbraw/zinc/99/43/94/1037994394.db2.gz XCIMNIMTYOEWIV-CYBMUJFWSA-N 1 2 324.749 4.468 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)cnc1F ZINC000891516342 1038005177 /nfs/dbraw/zinc/00/51/77/1038005177.db2.gz MZAPGYVGOBDHMD-GFCCVEGCSA-N 1 2 315.417 4.332 20 0 DIADLO Cc1cc(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)cnc1F ZINC000891516342 1038005197 /nfs/dbraw/zinc/00/51/97/1038005197.db2.gz MZAPGYVGOBDHMD-GFCCVEGCSA-N 1 2 315.417 4.332 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2ccc3c(c2)CCCC3)c(C)[nH+]1 ZINC000097040264 1038017285 /nfs/dbraw/zinc/01/72/85/1038017285.db2.gz CDDUJTFPCKXJDK-UHFFFAOYSA-N 1 2 308.425 4.067 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000602572522 1038040244 /nfs/dbraw/zinc/04/02/44/1038040244.db2.gz ORJBNMSTRYMSGF-GHMZBOCLSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000602572522 1038040264 /nfs/dbraw/zinc/04/02/64/1038040264.db2.gz ORJBNMSTRYMSGF-GHMZBOCLSA-N 1 2 323.305 4.069 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+]1CCC[C@H]1c1ccc(C)nc1 ZINC001143399639 1038045469 /nfs/dbraw/zinc/04/54/69/1038045469.db2.gz ASBWIUSECCUFAA-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+]1CCC[C@H]1c1ccc(C)nc1 ZINC001143399639 1038045480 /nfs/dbraw/zinc/04/54/80/1038045480.db2.gz ASBWIUSECCUFAA-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO Cc1cc(F)ccc1NC(=O)C[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000341463112 1038046053 /nfs/dbraw/zinc/04/60/53/1038046053.db2.gz VSRZJNSZOKQHST-INIZCTEOSA-N 1 2 323.371 4.018 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H]1c1ccc(C)nc1 ZINC001143399640 1038047284 /nfs/dbraw/zinc/04/72/84/1038047284.db2.gz ASBWIUSECCUFAA-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+]1CCC[C@@H]1c1ccc(C)nc1 ZINC001143399640 1038047307 /nfs/dbraw/zinc/04/73/07/1038047307.db2.gz ASBWIUSECCUFAA-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO Cc1cc(N(C)Cc2ccccc2C(F)(F)F)nc(C2CC2)[nH+]1 ZINC000341481567 1038059009 /nfs/dbraw/zinc/05/90/09/1038059009.db2.gz HVLJUWILJDCWQS-UHFFFAOYSA-N 1 2 321.346 4.318 20 0 DIADLO C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)Cc1nccn1C1CC1 ZINC000891647277 1038100157 /nfs/dbraw/zinc/10/01/57/1038100157.db2.gz DUFYKQOFZMFCGG-GFCCVEGCSA-N 1 2 323.362 4.430 20 0 DIADLO C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)Cc1nccn1C1CC1 ZINC000891647277 1038100164 /nfs/dbraw/zinc/10/01/64/1038100164.db2.gz DUFYKQOFZMFCGG-GFCCVEGCSA-N 1 2 323.362 4.430 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2csc(-c3ccco3)n2)s1 ZINC000090419557 1038120528 /nfs/dbraw/zinc/12/05/28/1038120528.db2.gz LINFCDXYNQPRMW-VIFPVBQESA-N 1 2 305.428 4.019 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccccc1OC(F)(F)F)c1cscn1 ZINC000581955157 1038171948 /nfs/dbraw/zinc/17/19/48/1038171948.db2.gz WMEIKXCNCHTARP-NXEZZACHSA-N 1 2 316.348 4.454 20 0 DIADLO CC[C@H]1c2ccsc2CC[N@H+]1Cc1nc2cccnc2s1 ZINC000341614569 1038180015 /nfs/dbraw/zinc/18/00/15/1038180015.db2.gz KHXOYQNJFOJQSN-ZDUSSCGKSA-N 1 2 315.467 4.262 20 0 DIADLO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1nc2cccnc2s1 ZINC000341614569 1038180019 /nfs/dbraw/zinc/18/00/19/1038180019.db2.gz KHXOYQNJFOJQSN-ZDUSSCGKSA-N 1 2 315.467 4.262 20 0 DIADLO CC(C)[N@H+](Cc1nc2cccnc2s1)Cc1ccccc1F ZINC000341629122 1038187027 /nfs/dbraw/zinc/18/70/27/1038187027.db2.gz JZDWRYHMSNJVMQ-UHFFFAOYSA-N 1 2 315.417 4.241 20 0 DIADLO CC(C)[N@@H+](Cc1nc2cccnc2s1)Cc1ccccc1F ZINC000341629122 1038187031 /nfs/dbraw/zinc/18/70/31/1038187031.db2.gz JZDWRYHMSNJVMQ-UHFFFAOYSA-N 1 2 315.417 4.241 20 0 DIADLO Cc1noc(C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)n1 ZINC000341633426 1038193131 /nfs/dbraw/zinc/19/31/31/1038193131.db2.gz FKHJANSZVVDDMC-CYBMUJFWSA-N 1 2 309.369 4.021 20 0 DIADLO CC[C@@H]([NH2+]Cc1csc([C@@H](C)OC)n1)c1ccccc1OC ZINC000341661964 1038212940 /nfs/dbraw/zinc/21/29/40/1038212940.db2.gz SFANFVZXRGZBBI-IUODEOHRSA-N 1 2 320.458 4.100 20 0 DIADLO CCc1ccc(-c2noc([C@H](C)[NH2+]Cc3cccs3)n2)cc1 ZINC000276786365 1038212823 /nfs/dbraw/zinc/21/28/23/1038212823.db2.gz RRVLNYFCHWCQQU-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO COc1cc(F)cc(C[N@@H+]2CCc3ccc(Cl)cc3C2)c1 ZINC001140478513 1038225763 /nfs/dbraw/zinc/22/57/63/1038225763.db2.gz USVZGHKBRWQULC-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(F)cc(C[N@H+]2CCc3ccc(Cl)cc3C2)c1 ZINC001140478513 1038225775 /nfs/dbraw/zinc/22/57/75/1038225775.db2.gz USVZGHKBRWQULC-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ccn(C(C)C)n1)c1cc(F)ccc1F ZINC000684552608 1038256775 /nfs/dbraw/zinc/25/67/75/1038256775.db2.gz FZLLNNJGYPJNCX-QGZVFWFLSA-N 1 2 307.388 4.229 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+]1CCC[C@H]1c1ccc(C)nc1 ZINC001143412835 1038258854 /nfs/dbraw/zinc/25/88/54/1038258854.db2.gz HNYVTKPTJMIGSG-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+]1CCC[C@H]1c1ccc(C)nc1 ZINC001143412835 1038258875 /nfs/dbraw/zinc/25/88/75/1038258875.db2.gz HNYVTKPTJMIGSG-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[NH2+][C@H](C)c1cccc(O)c1 ZINC000341805637 1038274516 /nfs/dbraw/zinc/27/45/16/1038274516.db2.gz HPARUBZCWPGTKO-LLVKDONJSA-N 1 2 314.410 4.268 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1ccc(Cl)cn1 ZINC000276935592 1038286644 /nfs/dbraw/zinc/28/66/44/1038286644.db2.gz SWXQVKSASCHBJB-JTQLQIEISA-N 1 2 311.212 4.248 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1ccc(C(F)(F)F)cn1)C1CC1 ZINC000341833753 1038288149 /nfs/dbraw/zinc/28/81/49/1038288149.db2.gz QIKRPBDQPFQPAO-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1ccc(C(F)(F)F)cn1)C1CC1 ZINC000341833753 1038288159 /nfs/dbraw/zinc/28/81/59/1038288159.db2.gz QIKRPBDQPFQPAO-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000603865359 1038306838 /nfs/dbraw/zinc/30/68/38/1038306838.db2.gz BUTYNLZHUDSMES-MSOLQXFVSA-N 1 2 317.477 4.043 20 0 DIADLO O=C(CCCCCc1cccs1)Nc1ccc2[nH+]ccn2c1 ZINC000603883856 1038311643 /nfs/dbraw/zinc/31/16/43/1038311643.db2.gz LFCHKEFBGYWVHM-UHFFFAOYSA-N 1 2 313.426 4.137 20 0 DIADLO CCc1cc(C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)on1 ZINC000535717059 1038320125 /nfs/dbraw/zinc/32/01/25/1038320125.db2.gz DQXKXNRMOHSPKU-LJQANCHMSA-N 1 2 310.372 4.255 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+](C)Cc2c3ccccc3oc2CC)o1 ZINC000535720151 1038322640 /nfs/dbraw/zinc/32/26/40/1038322640.db2.gz CRKMDDQOTAMHMM-GFCCVEGCSA-N 1 2 313.401 4.134 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+](C)Cc2c3ccccc3oc2CC)o1 ZINC000535720151 1038322651 /nfs/dbraw/zinc/32/26/51/1038322651.db2.gz CRKMDDQOTAMHMM-GFCCVEGCSA-N 1 2 313.401 4.134 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1noc(-c2ccccc2)n1 ZINC000603968526 1038333365 /nfs/dbraw/zinc/33/33/65/1038333365.db2.gz ZDMWAYXHXMPXGV-SFHVURJKSA-N 1 2 319.408 4.246 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1noc(-c2ccccc2)n1 ZINC000603968526 1038333377 /nfs/dbraw/zinc/33/33/77/1038333377.db2.gz ZDMWAYXHXMPXGV-SFHVURJKSA-N 1 2 319.408 4.246 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2ccccc2Cl)[nH]1 ZINC000277066150 1038362339 /nfs/dbraw/zinc/36/23/39/1038362339.db2.gz DNGRFPXNXOCCHV-TUAOUCFPSA-N 1 2 306.841 4.383 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2cc(C)ccc2OC)[nH]1 ZINC000277075726 1038362967 /nfs/dbraw/zinc/36/29/67/1038362967.db2.gz FIMDODTXRUGDOY-IHRRRGAJSA-N 1 2 316.449 4.047 20 0 DIADLO O=C(c1ccc(-n2cc[nH+]c2)cc1)N(CC1CCCCC1)C1CC1 ZINC000342054511 1038380812 /nfs/dbraw/zinc/38/08/12/1038380812.db2.gz HKBWGQKZEWADOL-UHFFFAOYSA-N 1 2 323.440 4.057 20 0 DIADLO O=C(C[C@@H]1CCc2ccccc21)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000604321104 1038400848 /nfs/dbraw/zinc/40/08/48/1038400848.db2.gz FKONRZQEQOMEIH-INIZCTEOSA-N 1 2 317.392 4.135 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)n1 ZINC000097079402 1038410048 /nfs/dbraw/zinc/41/00/48/1038410048.db2.gz MJVBUJGNSVYUSY-INIZCTEOSA-N 1 2 305.397 4.038 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)n1 ZINC000097120360 1038411800 /nfs/dbraw/zinc/41/18/00/1038411800.db2.gz JNTCGABUXKSFTC-NWDGAFQWSA-N 1 2 307.825 4.477 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)n1 ZINC000657199466 1038433098 /nfs/dbraw/zinc/43/30/98/1038433098.db2.gz ZKYRCAMGNNCSDZ-RHSMWYFYSA-N 1 2 311.429 4.446 20 0 DIADLO Cc1noc([C@@H](C)[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)n1 ZINC000657199466 1038433102 /nfs/dbraw/zinc/43/31/02/1038433102.db2.gz ZKYRCAMGNNCSDZ-RHSMWYFYSA-N 1 2 311.429 4.446 20 0 DIADLO Cc1cc(N2CCC[C@H]2Cc2ccccc2C)nc(C2CC2)[nH+]1 ZINC000604756585 1038448886 /nfs/dbraw/zinc/44/88/86/1038448886.db2.gz NEWUFEOOGZGHQN-SFHVURJKSA-N 1 2 307.441 4.182 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2c(Cl)n[nH]c2C2CC2)s1 ZINC000891991603 1038455517 /nfs/dbraw/zinc/45/55/17/1038455517.db2.gz DLSYGGLZQWRGHN-VIFPVBQESA-N 1 2 324.881 4.207 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2c(Cl)n[nH]c2C2CC2)s1 ZINC000891991603 1038455520 /nfs/dbraw/zinc/45/55/20/1038455520.db2.gz DLSYGGLZQWRGHN-VIFPVBQESA-N 1 2 324.881 4.207 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1 ZINC000604997709 1038474864 /nfs/dbraw/zinc/47/48/64/1038474864.db2.gz CXEUHYYVBBEJBA-LJQANCHMSA-N 1 2 317.379 4.101 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1 ZINC000604997709 1038474868 /nfs/dbraw/zinc/47/48/68/1038474868.db2.gz CXEUHYYVBBEJBA-LJQANCHMSA-N 1 2 317.379 4.101 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nnc([C@@H](C)CC)[nH]1)c1ccccc1F ZINC000277275461 1038477787 /nfs/dbraw/zinc/47/77/87/1038477787.db2.gz QCWSVYKOYHVLMA-SLEUVZQESA-N 1 2 304.413 4.259 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1cc(C)cnc1Cl)CCC2 ZINC000892036602 1038481699 /nfs/dbraw/zinc/48/16/99/1038481699.db2.gz WNJLIPYLVSMXMW-AWEZNQCLSA-N 1 2 321.877 4.318 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cc(C)cnc1Cl)CCC2 ZINC000892036602 1038481704 /nfs/dbraw/zinc/48/17/04/1038481704.db2.gz WNJLIPYLVSMXMW-AWEZNQCLSA-N 1 2 321.877 4.318 20 0 DIADLO Clc1ccccc1-c1noc(-c2cccc(-n3cc[nH+]c3)c2)n1 ZINC000605258020 1038496977 /nfs/dbraw/zinc/49/69/77/1038496977.db2.gz LRPRZXNRZLXYNN-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO CCC[C@@](C)([NH2+]Cc1nnc(C(C)(C)C)o1)c1ccccc1 ZINC000934182531 1038501801 /nfs/dbraw/zinc/50/18/01/1038501801.db2.gz IJSIMQFQAXPIOZ-GOSISDBHSA-N 1 2 301.434 4.172 20 0 DIADLO CCC[C@](C)([NH2+]Cc1nnc(C(C)(C)C)o1)c1ccccc1 ZINC000934182533 1038502250 /nfs/dbraw/zinc/50/22/50/1038502250.db2.gz IJSIMQFQAXPIOZ-SFHVURJKSA-N 1 2 301.434 4.172 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2ccnn2C2CCC2)s1 ZINC000892104050 1038516862 /nfs/dbraw/zinc/51/68/62/1038516862.db2.gz QAAAPPJRFWYYDZ-ZDUSSCGKSA-N 1 2 318.490 4.128 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccnn2C2CCC2)s1 ZINC000892104050 1038516869 /nfs/dbraw/zinc/51/68/69/1038516869.db2.gz QAAAPPJRFWYYDZ-ZDUSSCGKSA-N 1 2 318.490 4.128 20 0 DIADLO Fc1cccc(Cl)c1COc1ccccc1-n1cc[nH+]c1 ZINC000605434238 1038517073 /nfs/dbraw/zinc/51/70/73/1038517073.db2.gz QKBIPFVPOWVCRF-UHFFFAOYSA-N 1 2 302.736 4.244 20 0 DIADLO CC1(C)CCC2(CC[NH+](Cc3c(F)cc(F)cc3F)CC2)O1 ZINC001140536135 1038524149 /nfs/dbraw/zinc/52/41/49/1038524149.db2.gz MZMJFXNNTJLCOW-UHFFFAOYSA-N 1 2 313.363 4.028 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2cc(C)nc3ccccc23)cs1 ZINC000605575458 1038537125 /nfs/dbraw/zinc/53/71/25/1038537125.db2.gz BYRBRYWJOFHBJF-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2cc(C)nc3ccccc23)cs1 ZINC000605575458 1038537130 /nfs/dbraw/zinc/53/71/30/1038537130.db2.gz BYRBRYWJOFHBJF-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@H]2c2cccn2C)c2ccccn21 ZINC000563252732 1038585187 /nfs/dbraw/zinc/58/51/87/1038585187.db2.gz KKBNZHFKBQOOCT-IBGZPJMESA-N 1 2 322.456 4.133 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@H]2c2cccn2C)c2ccccn21 ZINC000563252732 1038585190 /nfs/dbraw/zinc/58/51/90/1038585190.db2.gz KKBNZHFKBQOOCT-IBGZPJMESA-N 1 2 322.456 4.133 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000892194648 1038590361 /nfs/dbraw/zinc/59/03/61/1038590361.db2.gz WZSRNGFOGPTXRS-OAHLLOKOSA-N 1 2 301.434 4.038 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000892194648 1038590368 /nfs/dbraw/zinc/59/03/68/1038590368.db2.gz WZSRNGFOGPTXRS-OAHLLOKOSA-N 1 2 301.434 4.038 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2cccc(OC3CC3)c2F)cs1 ZINC000657356940 1038598808 /nfs/dbraw/zinc/59/88/08/1038598808.db2.gz QFNXTAXQVGMBFL-LLVKDONJSA-N 1 2 320.433 4.237 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2cccc(OC3CC3)c2F)cs1 ZINC000657356941 1038599035 /nfs/dbraw/zinc/59/90/35/1038599035.db2.gz QFNXTAXQVGMBFL-NSHDSACASA-N 1 2 320.433 4.237 20 0 DIADLO CCO[C@@H]1CCC[N@@H+](Cc2csc(C3CCCCC3)n2)C1 ZINC000606438612 1038603163 /nfs/dbraw/zinc/60/31/63/1038603163.db2.gz CCLCSELFFXDVBD-MRXNPFEDSA-N 1 2 308.491 4.192 20 0 DIADLO CCO[C@@H]1CCC[N@H+](Cc2csc(C3CCCCC3)n2)C1 ZINC000606438612 1038603161 /nfs/dbraw/zinc/60/31/61/1038603161.db2.gz CCLCSELFFXDVBD-MRXNPFEDSA-N 1 2 308.491 4.192 20 0 DIADLO Cc1ccc2cc(C[NH2+][C@H](c3nc(C4CC4)no3)C(C)C)[nH]c2c1 ZINC000657365324 1038609058 /nfs/dbraw/zinc/60/90/58/1038609058.db2.gz BVENFXWCNYOMNJ-KRWDZBQOSA-N 1 2 324.428 4.224 20 0 DIADLO Cc1ccc2cc(C[NH2+][C@@H](c3nc(C4CC4)no3)C(C)C)[nH]c2c1 ZINC000657365325 1038609138 /nfs/dbraw/zinc/60/91/38/1038609138.db2.gz BVENFXWCNYOMNJ-QGZVFWFLSA-N 1 2 324.428 4.224 20 0 DIADLO CCCOc1ccccc1NC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000606570491 1038614087 /nfs/dbraw/zinc/61/40/87/1038614087.db2.gz YQBLNILKZPUTJT-UHFFFAOYSA-N 1 2 324.384 4.076 20 0 DIADLO CC[C@@H](NC(=O)Nc1ccc2[nH+]c(C)cn2c1)C1CCCCC1 ZINC000606569710 1038614622 /nfs/dbraw/zinc/61/46/22/1038614622.db2.gz QOALRUAXDKLRNZ-MRXNPFEDSA-N 1 2 314.433 4.123 20 0 DIADLO CC(C)(C)[C@H](NC(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000606582951 1038615995 /nfs/dbraw/zinc/61/59/95/1038615995.db2.gz JYKXQDQLNJZMBG-QGZVFWFLSA-N 1 2 322.412 4.243 20 0 DIADLO CCSc1cccc(NC(=O)Nc2ccc3[nH+]ccn3c2)c1 ZINC000606580458 1038616007 /nfs/dbraw/zinc/61/60/07/1038616007.db2.gz PIYNIRKKPOQSNT-UHFFFAOYSA-N 1 2 312.398 4.090 20 0 DIADLO Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC000606582938 1038616135 /nfs/dbraw/zinc/61/61/35/1038616135.db2.gz JQPGQFJTIPFXJE-KRWDZBQOSA-N 1 2 320.396 4.012 20 0 DIADLO Cc1ccc2cc(C[NH2+][C@@H](C)c3nc(C(C)(C)C)no3)[nH]c2c1 ZINC000657383072 1038624058 /nfs/dbraw/zinc/62/40/58/1038624058.db2.gz MBCKDWMVBXBKKA-LBPRGKRZSA-N 1 2 312.417 4.008 20 0 DIADLO Cc1cccc2[nH]c(C[NH2+][C@H](C)c3nc(C(C)(C)C)no3)cc21 ZINC000657384687 1038627719 /nfs/dbraw/zinc/62/77/19/1038627719.db2.gz RWNBDQSMCZRDFN-GFCCVEGCSA-N 1 2 312.417 4.008 20 0 DIADLO Cn1c2ccccc2nc1[C@@H]([NH2+]C/C=C\Cl)c1ccccc1 ZINC000588513390 1038635400 /nfs/dbraw/zinc/63/54/00/1038635400.db2.gz RZKIFQLQQWFCSI-PJCWUCBCSA-N 1 2 311.816 4.005 20 0 DIADLO CC(C)c1csc(C[NH2+]Cc2cccc(OC3CC3)c2F)n1 ZINC000657397909 1038637772 /nfs/dbraw/zinc/63/77/72/1038637772.db2.gz GMYGUKYKARQROA-UHFFFAOYSA-N 1 2 320.433 4.237 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)C(=O)C2CCCCCCC2)c1C ZINC000172881289 1038652341 /nfs/dbraw/zinc/65/23/41/1038652341.db2.gz SNWYKJFWRALLTE-UHFFFAOYSA-N 1 2 318.461 4.026 20 0 DIADLO c1cc2c(nc[nH+]c2Nc2cccc(N3CCCCCC3)c2)[nH]1 ZINC000607147737 1038658962 /nfs/dbraw/zinc/65/89/62/1038658962.db2.gz QOXAEBVJLZYZBT-UHFFFAOYSA-N 1 2 307.401 4.082 20 0 DIADLO FC(F)(F)CC[N@@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000607153023 1038660000 /nfs/dbraw/zinc/66/00/00/1038660000.db2.gz MARFIZBAEODMPW-GFCCVEGCSA-N 1 2 309.784 4.382 20 0 DIADLO FC(F)(F)CC[N@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000607153023 1038660004 /nfs/dbraw/zinc/66/00/04/1038660004.db2.gz MARFIZBAEODMPW-GFCCVEGCSA-N 1 2 309.784 4.382 20 0 DIADLO CCCc1nc(C[N@H+](CC2CCC2)[C@H](C)c2ccccc2)no1 ZINC000607158888 1038661053 /nfs/dbraw/zinc/66/10/53/1038661053.db2.gz ZHALNYUOXVIEJQ-OAHLLOKOSA-N 1 2 313.445 4.385 20 0 DIADLO CCCc1nc(C[N@@H+](CC2CCC2)[C@H](C)c2ccccc2)no1 ZINC000607158888 1038661060 /nfs/dbraw/zinc/66/10/60/1038661060.db2.gz ZHALNYUOXVIEJQ-OAHLLOKOSA-N 1 2 313.445 4.385 20 0 DIADLO Cc1ccc(C[N@H+](Cc2noc3c2CCCC3)C2CC2)cc1C ZINC000607156364 1038664357 /nfs/dbraw/zinc/66/43/57/1038664357.db2.gz TYHDGUBUOCIDQC-UHFFFAOYSA-N 1 2 310.441 4.335 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2noc3c2CCCC3)C2CC2)cc1C ZINC000607156364 1038664361 /nfs/dbraw/zinc/66/43/61/1038664361.db2.gz TYHDGUBUOCIDQC-UHFFFAOYSA-N 1 2 310.441 4.335 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1ccncc1Cl)CCC2 ZINC000152501948 1038666736 /nfs/dbraw/zinc/66/67/36/1038666736.db2.gz GTJXLILMVLFEMX-CQSZACIVSA-N 1 2 321.877 4.263 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccncc1Cl)CCC2 ZINC000152501948 1038666741 /nfs/dbraw/zinc/66/67/41/1038666741.db2.gz GTJXLILMVLFEMX-CQSZACIVSA-N 1 2 321.877 4.263 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1cc2ccccc2nc1Cl ZINC000048755890 1038667875 /nfs/dbraw/zinc/66/78/75/1038667875.db2.gz BFRVFWLDKANXKE-UHFFFAOYSA-N 1 2 300.789 4.422 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1cc2ccccc2nc1Cl ZINC000048755890 1038667880 /nfs/dbraw/zinc/66/78/80/1038667880.db2.gz BFRVFWLDKANXKE-UHFFFAOYSA-N 1 2 300.789 4.422 20 0 DIADLO Cc1cc(N(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)nc(C(C)C)[nH+]1 ZINC000582442154 1038669977 /nfs/dbraw/zinc/66/99/77/1038669977.db2.gz IOLZZPFOADGKIM-BETUJISGSA-N 1 2 315.383 4.466 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccn(-c3cccc(F)c3)n2)[C@@H]1c1ccccc1 ZINC001167577686 1038678927 /nfs/dbraw/zinc/67/89/27/1038678927.db2.gz VCYQXDRIHUYZPA-YWZLYKJASA-N 1 2 321.399 4.204 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccn(-c3cccc(F)c3)n2)[C@@H]1c1ccccc1 ZINC001167577686 1038678930 /nfs/dbraw/zinc/67/89/30/1038678930.db2.gz VCYQXDRIHUYZPA-YWZLYKJASA-N 1 2 321.399 4.204 20 0 DIADLO CCCOc1cccc2c(N3CCC[C@H](OC)CC3)cc[nH+]c12 ZINC000684891613 1038683304 /nfs/dbraw/zinc/68/33/04/1038683304.db2.gz YGCVBPBEMGSKDM-HNNXBMFYSA-N 1 2 314.429 4.029 20 0 DIADLO CC(C)COc1cccc(C[N@@H+]2CCCC[C@@H]2c2ncc[nH]2)c1 ZINC000342625879 1038693414 /nfs/dbraw/zinc/69/34/14/1038693414.db2.gz UIQTXMWBPRKKRK-GOSISDBHSA-N 1 2 313.445 4.172 20 0 DIADLO CC(C)COc1cccc(C[N@H+]2CCCC[C@@H]2c2ncc[nH]2)c1 ZINC000342625879 1038693417 /nfs/dbraw/zinc/69/34/17/1038693417.db2.gz UIQTXMWBPRKKRK-GOSISDBHSA-N 1 2 313.445 4.172 20 0 DIADLO COCc1cnc(C[N@H+](C)[C@H](C)c2cccc(Cl)c2)s1 ZINC000342679044 1038717161 /nfs/dbraw/zinc/71/71/61/1038717161.db2.gz COWMGNLDEXYCET-LLVKDONJSA-N 1 2 310.850 4.136 20 0 DIADLO COCc1cnc(C[N@@H+](C)[C@H](C)c2cccc(Cl)c2)s1 ZINC000342679044 1038717168 /nfs/dbraw/zinc/71/71/68/1038717168.db2.gz COWMGNLDEXYCET-LLVKDONJSA-N 1 2 310.850 4.136 20 0 DIADLO c1csc(C[N@H+](Cc2ccn(-c3ccccc3)n2)C2CC2)c1 ZINC000342688741 1038723001 /nfs/dbraw/zinc/72/30/01/1038723001.db2.gz HJGFDRMKQJXBNM-UHFFFAOYSA-N 1 2 309.438 4.098 20 0 DIADLO c1csc(C[N@@H+](Cc2ccn(-c3ccccc3)n2)C2CC2)c1 ZINC000342688741 1038723006 /nfs/dbraw/zinc/72/30/06/1038723006.db2.gz HJGFDRMKQJXBNM-UHFFFAOYSA-N 1 2 309.438 4.098 20 0 DIADLO COc1ccc(C[NH2+]C(C)(C)c2nc(C)cs2)c(Cl)c1 ZINC000116382738 1038738438 /nfs/dbraw/zinc/73/84/38/1038738438.db2.gz AWWVHYRWVGVEPA-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](C)Cc2nc(C3CC3)cs2)c1 ZINC000342734664 1038750146 /nfs/dbraw/zinc/75/01/46/1038750146.db2.gz PDWZIXZAFYOWPG-UHFFFAOYSA-N 1 2 316.470 4.440 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2nc(C3CC3)cs2)c1 ZINC000342734664 1038750153 /nfs/dbraw/zinc/75/01/53/1038750153.db2.gz PDWZIXZAFYOWPG-UHFFFAOYSA-N 1 2 316.470 4.440 20 0 DIADLO Cc1cccc(Nc2nn(C[N@H+]3CCC[C@@H]3C)c(=S)s2)c1 ZINC000173526029 1038754825 /nfs/dbraw/zinc/75/48/25/1038754825.db2.gz KQGSFIVGUHDWCT-LBPRGKRZSA-N 1 2 320.487 4.168 20 0 DIADLO Cc1cccc(Nc2nn(C[N@@H+]3CCC[C@@H]3C)c(=S)s2)c1 ZINC000173526029 1038754831 /nfs/dbraw/zinc/75/48/31/1038754831.db2.gz KQGSFIVGUHDWCT-LBPRGKRZSA-N 1 2 320.487 4.168 20 0 DIADLO CC(C)(C)c1coc(C[NH+]2CCC(OCC3CCCC3)CC2)n1 ZINC001167598757 1038757117 /nfs/dbraw/zinc/75/71/17/1038757117.db2.gz JZIJLJOJNBTWKG-UHFFFAOYSA-N 1 2 320.477 4.143 20 0 DIADLO COc1ccc(C[N@H+](Cc2nc(C3CC3)cs2)C2CC2)cc1 ZINC000342763171 1038761871 /nfs/dbraw/zinc/76/18/71/1038761871.db2.gz CFVOXSLYVRJAQK-UHFFFAOYSA-N 1 2 314.454 4.194 20 0 DIADLO COc1ccc(C[N@@H+](Cc2nc(C3CC3)cs2)C2CC2)cc1 ZINC000342763171 1038761875 /nfs/dbraw/zinc/76/18/75/1038761875.db2.gz CFVOXSLYVRJAQK-UHFFFAOYSA-N 1 2 314.454 4.194 20 0 DIADLO Nc1cc(Cl)ccc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001213645717 1038774660 /nfs/dbraw/zinc/77/46/60/1038774660.db2.gz ADPQSPDWNXWZCP-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO Cc1c[nH+]c(CN2CCC[C@H]2c2ccc(Cl)c(Cl)c2)n1C ZINC000342796803 1038791246 /nfs/dbraw/zinc/79/12/46/1038791246.db2.gz ZOGZUQAIHSFOFS-HNNXBMFYSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1c[nH+]c(CN(C)[C@@H](C)c2ccc(Cl)c(Cl)c2)n1C ZINC000342799454 1038798282 /nfs/dbraw/zinc/79/82/82/1038798282.db2.gz OAHULAHQRRBFSU-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO CCCCC1CCC(C(=O)N2CCC[C@@H](c3[nH]cc[nH+]3)C2)CC1 ZINC000075552458 1038805806 /nfs/dbraw/zinc/80/58/06/1038805806.db2.gz FLCWGDXZJLFCMK-OFLPRAFFSA-N 1 2 317.477 4.112 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ncc(-c3ccccc3C)o2)on1 ZINC000075640530 1038808114 /nfs/dbraw/zinc/80/81/14/1038808114.db2.gz NCBRFJCNALCHPY-MRXNPFEDSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ncc(-c3ccccc3C)o2)on1 ZINC000075640530 1038808142 /nfs/dbraw/zinc/80/81/42/1038808142.db2.gz NCBRFJCNALCHPY-MRXNPFEDSA-N 1 2 323.396 4.284 20 0 DIADLO COCc1nc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000075900326 1038816468 /nfs/dbraw/zinc/81/64/68/1038816468.db2.gz SMPRXOKJBHPWIJ-BLLLJJGKSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000075900326 1038816491 /nfs/dbraw/zinc/81/64/91/1038816491.db2.gz SMPRXOKJBHPWIJ-BLLLJJGKSA-N 1 2 320.433 4.012 20 0 DIADLO COc1cccc(F)c1CNc1cc(C)c(C(F)(F)F)c[nH+]1 ZINC001167606820 1038819523 /nfs/dbraw/zinc/81/95/23/1038819523.db2.gz RTTGNHZHIVVTAU-UHFFFAOYSA-N 1 2 314.282 4.169 20 0 DIADLO COc1cccc(F)c1CNc1nc(C(C)(C)C)[nH+]c(C)c1C ZINC001167606915 1038819715 /nfs/dbraw/zinc/81/97/15/1038819715.db2.gz KMUWWAZOZTZJCZ-UHFFFAOYSA-N 1 2 317.408 4.151 20 0 DIADLO CC[C@H]1C[N@H+](Cc2csc(-c3ccc(C)o3)n2)CCS1 ZINC000076072048 1038829342 /nfs/dbraw/zinc/82/93/42/1038829342.db2.gz VQWXOUWGLFOLDM-ZDUSSCGKSA-N 1 2 308.472 4.039 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2csc(-c3ccc(C)o3)n2)CCS1 ZINC000076072048 1038829367 /nfs/dbraw/zinc/82/93/67/1038829367.db2.gz VQWXOUWGLFOLDM-ZDUSSCGKSA-N 1 2 308.472 4.039 20 0 DIADLO Cc1c[nH+]c(CN(Cc2ccccc2)Cc2ccc(F)cc2)n1C ZINC000342807551 1038837133 /nfs/dbraw/zinc/83/71/33/1038837133.db2.gz NMSCUTQIMURNIL-UHFFFAOYSA-N 1 2 323.415 4.070 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[N@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000076496602 1038838163 /nfs/dbraw/zinc/83/81/63/1038838163.db2.gz USFVMYFTIXDLHS-ZDUSSCGKSA-N 1 2 313.445 4.438 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[N@@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000076496602 1038838188 /nfs/dbraw/zinc/83/81/88/1038838188.db2.gz USFVMYFTIXDLHS-ZDUSSCGKSA-N 1 2 313.445 4.438 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@@H](C)OC[C@@H]2c2ccccc2)cc1 ZINC000608511015 1038871470 /nfs/dbraw/zinc/87/14/70/1038871470.db2.gz LVUDWJCJRPTZRO-DNVCBOLYSA-N 1 2 313.466 4.371 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@@H](C)OC[C@@H]2c2ccccc2)cc1 ZINC000608511015 1038871497 /nfs/dbraw/zinc/87/14/97/1038871497.db2.gz LVUDWJCJRPTZRO-DNVCBOLYSA-N 1 2 313.466 4.371 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2csc(-c3cccs3)n2)CCS1 ZINC000608510555 1038873981 /nfs/dbraw/zinc/87/39/81/1038873981.db2.gz LEENFQMQZDJNLJ-GFCCVEGCSA-N 1 2 310.513 4.199 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2csc(-c3cccs3)n2)CCS1 ZINC000608510555 1038874007 /nfs/dbraw/zinc/87/40/07/1038874007.db2.gz LEENFQMQZDJNLJ-GFCCVEGCSA-N 1 2 310.513 4.199 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3cc(-c4ccccc4)no3)cc2)[nH]1 ZINC001213085518 1038891494 /nfs/dbraw/zinc/89/14/94/1038891494.db2.gz JOROMFWXAGVSEC-UHFFFAOYSA-N 1 2 302.337 4.475 20 0 DIADLO CC[C@H](C)Oc1cc(C[NH2+][C@H](C)c2cscn2)ccc1OC ZINC000657599695 1038899248 /nfs/dbraw/zinc/89/92/48/1038899248.db2.gz QIOHIHPNUYFHOI-QWHCGFSZSA-N 1 2 320.458 4.180 20 0 DIADLO CSc1ccc(NCc2cc[nH+]c(N)c2)c(C(F)(F)F)c1 ZINC001167618416 1038935130 /nfs/dbraw/zinc/93/51/30/1038935130.db2.gz JAPCCVOWIRYXII-UHFFFAOYSA-N 1 2 313.348 4.017 20 0 DIADLO C[C@@H]([NH2+][C@H]1CC(C)(C)Oc2cc(F)ccc21)c1nccs1 ZINC000153364185 1038938868 /nfs/dbraw/zinc/93/88/68/1038938868.db2.gz VPWSUCIUVZXBOP-MFKMUULPSA-N 1 2 306.406 4.235 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H]2CC(C)(C)CCc3ccccc32)no1 ZINC000685041748 1038993792 /nfs/dbraw/zinc/99/37/92/1038993792.db2.gz MJLACOZNBLSPSV-INIZCTEOSA-N 1 2 313.445 4.386 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2C[C@@H]2c2ccc3ccccc3c2)c(C)c[nH+]1 ZINC000534299882 1039023160 /nfs/dbraw/zinc/02/31/60/1039023160.db2.gz JEHAQUSRSQLXMI-RTBURBONSA-N 1 2 316.404 4.016 20 0 DIADLO Nc1cc(Cl)nc(Cl)c1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213086156 1039024951 /nfs/dbraw/zinc/02/49/51/1039024951.db2.gz IGGKEHVUFXPVDS-UHFFFAOYSA-N 1 2 320.183 4.104 20 0 DIADLO c1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)n(-c2ccccc2)n1 ZINC001213086271 1039030521 /nfs/dbraw/zinc/03/05/21/1039030521.db2.gz LOZFOPXPEOPUBX-UHFFFAOYSA-N 1 2 301.353 4.006 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)c(C)n1 ZINC000153971796 1039154531 /nfs/dbraw/zinc/15/45/31/1039154531.db2.gz GRUHTQVGPDRHKH-PWSUYJOCSA-N 1 2 318.490 4.259 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)cs1 ZINC000343105943 1039197865 /nfs/dbraw/zinc/19/78/65/1039197865.db2.gz XEGUWTUYCNITKS-BMIGLBTASA-N 1 2 322.861 4.281 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@H](c3ccccc3)[C@H](C)C2)no1 ZINC000525638876 1039204964 /nfs/dbraw/zinc/20/49/64/1039204964.db2.gz HAVLIIYOQGUPRE-WBVHZDCISA-N 1 2 313.445 4.038 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@H](c3ccccc3)[C@H](C)C2)no1 ZINC000525638876 1039204976 /nfs/dbraw/zinc/20/49/76/1039204976.db2.gz HAVLIIYOQGUPRE-WBVHZDCISA-N 1 2 313.445 4.038 20 0 DIADLO CCCc1ncc(C[NH2+]Cc2c(Cl)oc3ccccc32)o1 ZINC000449614848 1039256666 /nfs/dbraw/zinc/25/66/66/1039256666.db2.gz XHLOMZRMFIICRW-UHFFFAOYSA-N 1 2 304.777 4.317 20 0 DIADLO CC(C)Cc1ncc(C[N@H+](C)Cc2ccc(Cl)nc2)s1 ZINC000125772508 1039268554 /nfs/dbraw/zinc/26/85/54/1039268554.db2.gz SQAOKLHANDCINL-UHFFFAOYSA-N 1 2 309.866 4.022 20 0 DIADLO CC(C)Cc1ncc(C[N@@H+](C)Cc2ccc(Cl)nc2)s1 ZINC000125772508 1039268567 /nfs/dbraw/zinc/26/85/67/1039268567.db2.gz SQAOKLHANDCINL-UHFFFAOYSA-N 1 2 309.866 4.022 20 0 DIADLO Cc1cc(C)c(-c2nn(C[N@H+](C)CC3CC3)c(=S)o2)c(C)c1 ZINC000728561631 1039277634 /nfs/dbraw/zinc/27/76/34/1039277634.db2.gz SDAVMALNSFVFAU-UHFFFAOYSA-N 1 2 317.458 4.097 20 0 DIADLO Cc1cc(C)c(-c2nn(C[N@@H+](C)CC3CC3)c(=S)o2)c(C)c1 ZINC000728561631 1039277648 /nfs/dbraw/zinc/27/76/48/1039277648.db2.gz SDAVMALNSFVFAU-UHFFFAOYSA-N 1 2 317.458 4.097 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](CCO)c2ccc(Cl)cc2)cs1 ZINC000347424590 1039283452 /nfs/dbraw/zinc/28/34/52/1039283452.db2.gz DAFZEAXCBOKNKK-OAHLLOKOSA-N 1 2 324.877 4.133 20 0 DIADLO Cc1ccc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1Cl ZINC000343196025 1039295903 /nfs/dbraw/zinc/29/59/03/1039295903.db2.gz OYCUWSGSCBVACA-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1ccc2c(c1)OCCC[C@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000539659489 1039313102 /nfs/dbraw/zinc/31/31/02/1039313102.db2.gz PCSQPNIRWMDJRP-GOSISDBHSA-N 1 2 323.440 4.316 20 0 DIADLO Cc1cc(NCc2csc(C(F)(F)F)n2)ccc1[NH+](C)C ZINC000892338154 1039339564 /nfs/dbraw/zinc/33/95/64/1039339564.db2.gz POFBRDKGMJKMSZ-UHFFFAOYSA-N 1 2 315.364 4.148 20 0 DIADLO COc1cc(C)[nH+]c(CN(Cc2ccc(Cl)cc2)C2CC2)c1 ZINC000536043738 1039340812 /nfs/dbraw/zinc/34/08/12/1039340812.db2.gz NTHXIGZXHHJHSJ-UHFFFAOYSA-N 1 2 316.832 4.217 20 0 DIADLO c1nc([C@H]2CCC[N@H+]2Cc2cccc(-c3ccccc3)c2)no1 ZINC000539816603 1039345741 /nfs/dbraw/zinc/34/57/41/1039345741.db2.gz USLHLRWSBKORML-GOSISDBHSA-N 1 2 305.381 4.074 20 0 DIADLO c1nc([C@H]2CCC[N@@H+]2Cc2cccc(-c3ccccc3)c2)no1 ZINC000539816603 1039345753 /nfs/dbraw/zinc/34/57/53/1039345753.db2.gz USLHLRWSBKORML-GOSISDBHSA-N 1 2 305.381 4.074 20 0 DIADLO c1c[nH]c(-c2ccc(Nc3ccc(Cn4cc[nH+]c4)cc3)cc2)n1 ZINC001213088735 1039346637 /nfs/dbraw/zinc/34/66/37/1039346637.db2.gz ASEKSXPAKZBHLB-UHFFFAOYSA-N 1 2 315.380 4.065 20 0 DIADLO COc1ccc(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)o1 ZINC000892340340 1039352936 /nfs/dbraw/zinc/35/29/36/1039352936.db2.gz ROHGBWLUBGTRLQ-UHFFFAOYSA-N 1 2 323.396 4.100 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)s1 ZINC000539838711 1039355026 /nfs/dbraw/zinc/35/50/26/1039355026.db2.gz OOJWYRBNLLMOEQ-KRWDZBQOSA-N 1 2 323.408 4.162 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)s1 ZINC000539838711 1039355032 /nfs/dbraw/zinc/35/50/32/1039355032.db2.gz OOJWYRBNLLMOEQ-KRWDZBQOSA-N 1 2 323.408 4.162 20 0 DIADLO C[N@@H+](Cc1cc[nH]n1)Cc1ccc(-c2cccc(Cl)c2)s1 ZINC000539833459 1039360294 /nfs/dbraw/zinc/36/02/94/1039360294.db2.gz XYUWUGIAOOARFM-UHFFFAOYSA-N 1 2 317.845 4.424 20 0 DIADLO C[N@H+](Cc1cc[nH]n1)Cc1ccc(-c2cccc(Cl)c2)s1 ZINC000539833459 1039360311 /nfs/dbraw/zinc/36/03/11/1039360311.db2.gz XYUWUGIAOOARFM-UHFFFAOYSA-N 1 2 317.845 4.424 20 0 DIADLO C[C@@]1(c2ccccc2)C[N@H+](Cc2ccc(Cl)s2)CCO1 ZINC000539830154 1039362064 /nfs/dbraw/zinc/36/20/64/1039362064.db2.gz FQEYMTRKYODGCI-INIZCTEOSA-N 1 2 307.846 4.149 20 0 DIADLO C[C@@]1(c2ccccc2)C[N@@H+](Cc2ccc(Cl)s2)CCO1 ZINC000539830154 1039362073 /nfs/dbraw/zinc/36/20/73/1039362073.db2.gz FQEYMTRKYODGCI-INIZCTEOSA-N 1 2 307.846 4.149 20 0 DIADLO CCCOc1cccc(C[N@@H+]2CCO[C@@H](c3ccsc3)C2)c1 ZINC000539851008 1039375315 /nfs/dbraw/zinc/37/53/15/1039375315.db2.gz JVZFHTKNZMNVOM-GOSISDBHSA-N 1 2 317.454 4.110 20 0 DIADLO CCCOc1cccc(C[N@H+]2CCO[C@@H](c3ccsc3)C2)c1 ZINC000539851008 1039375324 /nfs/dbraw/zinc/37/53/24/1039375324.db2.gz JVZFHTKNZMNVOM-GOSISDBHSA-N 1 2 317.454 4.110 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@H+](Cc3ccn(C(C)C)n3)CC2)c1 ZINC000539885637 1039381052 /nfs/dbraw/zinc/38/10/52/1039381052.db2.gz IUZQUQUNRYETDW-UHFFFAOYSA-N 1 2 309.457 4.370 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@@H+](Cc3ccn(C(C)C)n3)CC2)c1 ZINC000539885637 1039381067 /nfs/dbraw/zinc/38/10/67/1039381067.db2.gz IUZQUQUNRYETDW-UHFFFAOYSA-N 1 2 309.457 4.370 20 0 DIADLO Cc1cc([NH+]2CCCC2)ccc1NCc1ccc2[nH]cnc2c1 ZINC000539923815 1039391884 /nfs/dbraw/zinc/39/18/84/1039391884.db2.gz GXHCHOIENIUWBV-UHFFFAOYSA-N 1 2 306.413 4.084 20 0 DIADLO CC(=O)c1cc(C[N@@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)on1 ZINC000563722829 1039392129 /nfs/dbraw/zinc/39/21/29/1039392129.db2.gz LLMPSLYAZDLLQC-NSHDSACASA-N 1 2 318.804 4.256 20 0 DIADLO CC(=O)c1cc(C[N@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)on1 ZINC000563722829 1039392147 /nfs/dbraw/zinc/39/21/47/1039392147.db2.gz LLMPSLYAZDLLQC-NSHDSACASA-N 1 2 318.804 4.256 20 0 DIADLO COc1ccccc1-c1ccc([C@@H](C)Nc2cc[nH+]c(C)n2)cc1 ZINC000462892200 1039409402 /nfs/dbraw/zinc/40/94/02/1039409402.db2.gz IPKGOCWJZXCYIJ-CQSZACIVSA-N 1 2 319.408 4.634 20 0 DIADLO CCOCC[N@H+](C)Cc1csc(-c2ccc(C(C)C)cc2)n1 ZINC000540055923 1039409440 /nfs/dbraw/zinc/40/94/40/1039409440.db2.gz NDBIOPPPTJCQGJ-UHFFFAOYSA-N 1 2 318.486 4.402 20 0 DIADLO CCOCC[N@@H+](C)Cc1csc(-c2ccc(C(C)C)cc2)n1 ZINC000540055923 1039409450 /nfs/dbraw/zinc/40/94/50/1039409450.db2.gz NDBIOPPPTJCQGJ-UHFFFAOYSA-N 1 2 318.486 4.402 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1cc(F)ccc1F ZINC000540165137 1039443135 /nfs/dbraw/zinc/44/31/35/1039443135.db2.gz WXJCKFVTGFMAMM-VFZGTOFNSA-N 1 2 309.743 4.403 20 0 DIADLO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2nnc(-c3ccc(F)cc3)[nH]2)c1 ZINC000540219966 1039459688 /nfs/dbraw/zinc/45/96/88/1039459688.db2.gz OBMKXPZBGXSSED-CQSZACIVSA-N 1 2 324.403 4.078 20 0 DIADLO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2nc(-c3ccc(F)cc3)n[nH]2)c1 ZINC000540219966 1039459699 /nfs/dbraw/zinc/45/96/99/1039459699.db2.gz OBMKXPZBGXSSED-CQSZACIVSA-N 1 2 324.403 4.078 20 0 DIADLO Cc1[nH]c(CN([C@@H](C)c2ccccc2Cl)C2CC2)[nH+]c1C ZINC000628130579 1039468896 /nfs/dbraw/zinc/46/88/96/1039468896.db2.gz DUKPEDYTNUHSIE-ZDUSSCGKSA-N 1 2 303.837 4.406 20 0 DIADLO Cc1cc(C[NH2+][C@H](COCc2ccccc2)c2ccccc2)no1 ZINC000540457798 1039498441 /nfs/dbraw/zinc/49/84/41/1039498441.db2.gz BSFQFNXGJRWURK-HXUWFJFHSA-N 1 2 322.408 4.031 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1ccc(Cl)nc1Cl ZINC000278506583 1039513773 /nfs/dbraw/zinc/51/37/73/1039513773.db2.gz AWVKIGUVWJFNNY-SNVBAGLBSA-N 1 2 311.212 4.287 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc(Cl)nc1Cl ZINC000278506583 1039513787 /nfs/dbraw/zinc/51/37/87/1039513787.db2.gz AWVKIGUVWJFNNY-SNVBAGLBSA-N 1 2 311.212 4.287 20 0 DIADLO c1cn(CCCN2CCc3cc(-c4ccccc4)ccc32)c[nH+]1 ZINC000540550605 1039515970 /nfs/dbraw/zinc/51/59/70/1039515970.db2.gz ZYBFKJPOIPAWDW-UHFFFAOYSA-N 1 2 303.409 4.003 20 0 DIADLO C[C@@H]([NH2+]C1(c2ccccc2Cl)CC1)c1cc2n(n1)CCCC2 ZINC000647315597 1039518717 /nfs/dbraw/zinc/51/87/17/1039518717.db2.gz UVLMBQMFODCDEE-CYBMUJFWSA-N 1 2 315.848 4.213 20 0 DIADLO COc1ccc(-c2ccccc2)cc1C[NH2+]Cc1ncc(C)s1 ZINC000540600604 1039522818 /nfs/dbraw/zinc/52/28/18/1039522818.db2.gz NAXRAYNSQLHIJQ-UHFFFAOYSA-N 1 2 324.449 4.417 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2ccc(Cl)nc2Cl)n1 ZINC000278556929 1039541650 /nfs/dbraw/zinc/54/16/50/1039541650.db2.gz HZMFOUBZXZKSFA-UHFFFAOYSA-N 1 2 316.257 4.178 20 0 DIADLO COc1cccc([C@@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)c1 ZINC000540727619 1039554971 /nfs/dbraw/zinc/55/49/71/1039554971.db2.gz JLTXRXCSGCQYMZ-OAHLLOKOSA-N 1 2 311.429 4.254 20 0 DIADLO CC[C@](C)([NH2+]Cc1ccc(Cl)nc1Cl)c1nccs1 ZINC000278602917 1039588540 /nfs/dbraw/zinc/58/85/40/1039588540.db2.gz LYVCAKNPHKSFMP-ZDUSSCGKSA-N 1 2 316.257 4.260 20 0 DIADLO Fc1cccc2c1CC[C@H]2[NH2+]Cc1ncc(C(F)(F)F)s1 ZINC000278604554 1039585726 /nfs/dbraw/zinc/58/57/26/1039585726.db2.gz ICUBANZCTCSQJM-LLVKDONJSA-N 1 2 316.323 4.078 20 0 DIADLO Cc1cc(C[NH2+]Cc2ncc(C(F)(F)F)s2)ccc1Cl ZINC000278737913 1039691220 /nfs/dbraw/zinc/69/12/20/1039691220.db2.gz VAKDXWZZEFQXTQ-UHFFFAOYSA-N 1 2 320.767 4.414 20 0 DIADLO CCOC(=O)c1ccc(C[N@H+](C)[C@H](C)c2ccccc2Cl)[nH]1 ZINC001140689522 1039700933 /nfs/dbraw/zinc/70/09/33/1039700933.db2.gz CLWWEROJTLSTID-GFCCVEGCSA-N 1 2 320.820 4.038 20 0 DIADLO CCOC(=O)c1ccc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)[nH]1 ZINC001140689522 1039700951 /nfs/dbraw/zinc/70/09/51/1039700951.db2.gz CLWWEROJTLSTID-GFCCVEGCSA-N 1 2 320.820 4.038 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2ccccc2)c2cccnc2)c(F)c1 ZINC000541550353 1039703038 /nfs/dbraw/zinc/70/30/38/1039703038.db2.gz YKANBIYGWPLFOD-LJQANCHMSA-N 1 2 310.347 4.239 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1cccs1 ZINC000541627653 1039720302 /nfs/dbraw/zinc/72/03/02/1039720302.db2.gz UPXAPBVSUWJQNJ-LBPRGKRZSA-N 1 2 307.463 4.306 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@@H](c2ccccc2)C(C)C)n1 ZINC000136294891 1039731852 /nfs/dbraw/zinc/73/18/52/1039731852.db2.gz XLAUJLQAFVRMQM-XJKSGUPXSA-N 1 2 319.474 4.371 20 0 DIADLO Clc1ccccc1C[NH2+][C@@H](c1ccccc1)c1cncnc1 ZINC000541746282 1039734072 /nfs/dbraw/zinc/73/40/72/1039734072.db2.gz HZQHCWQPMICOPY-SFHVURJKSA-N 1 2 309.800 4.009 20 0 DIADLO CCc1noc([C@H](C)[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)n1 ZINC000083423022 1039734680 /nfs/dbraw/zinc/73/46/80/1039734680.db2.gz JLCPZDQWRYTFJV-LBPRGKRZSA-N 1 2 317.820 4.136 20 0 DIADLO CCc1noc([C@H](C)[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)n1 ZINC000083423022 1039734701 /nfs/dbraw/zinc/73/47/01/1039734701.db2.gz JLCPZDQWRYTFJV-LBPRGKRZSA-N 1 2 317.820 4.136 20 0 DIADLO CC[N@H+](CC(=O)NC(C)(C)C(C)(C)C)Cc1ccccc1Cl ZINC000622616813 1039771465 /nfs/dbraw/zinc/77/14/65/1039771465.db2.gz NKTQZDDFBUPSKD-UHFFFAOYSA-N 1 2 324.896 4.103 20 0 DIADLO CC[N@@H+](CC(=O)NC(C)(C)C(C)(C)C)Cc1ccccc1Cl ZINC000622616813 1039771483 /nfs/dbraw/zinc/77/14/83/1039771483.db2.gz NKTQZDDFBUPSKD-UHFFFAOYSA-N 1 2 324.896 4.103 20 0 DIADLO CCc1cnccc1[C@H](C)[NH2+][C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000542123151 1039793662 /nfs/dbraw/zinc/79/36/62/1039793662.db2.gz JNOFLEQLHFZIAW-STQMWFEESA-N 1 2 301.434 4.341 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2Cl)c(C)n1 ZINC000090180298 1039795232 /nfs/dbraw/zinc/79/52/32/1039795232.db2.gz RMHZJJLCOMZEJG-KOLCDFICSA-N 1 2 307.800 4.298 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@@H](C)c2ccc(F)cn2)c2ccccn2)c1 ZINC000090946507 1039808940 /nfs/dbraw/zinc/80/89/40/1039808940.db2.gz NWWYEJUAGKXCSC-YWZLYKJASA-N 1 2 321.399 4.364 20 0 DIADLO Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]Cc1ncccc1F ZINC000090720589 1039815037 /nfs/dbraw/zinc/81/50/37/1039815037.db2.gz YSMQTPJSBSVLOF-OAHLLOKOSA-N 1 2 320.795 4.186 20 0 DIADLO Cc1cc(Cl)c2c(c1)[C@H]([NH2+]Cc1ncccc1F)CCCO2 ZINC000090722005 1039816786 /nfs/dbraw/zinc/81/67/86/1039816786.db2.gz FCQYLWQTGZVQIO-OAHLLOKOSA-N 1 2 320.795 4.186 20 0 DIADLO COC(=O)c1ccc([C@@H](C)[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000091589376 1039853535 /nfs/dbraw/zinc/85/35/35/1039853535.db2.gz RCZDFRMVIWGRFJ-BXUZGUMPSA-N 1 2 319.788 4.228 20 0 DIADLO COC(=O)c1ccc([C@@H](C)[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000091589376 1039853562 /nfs/dbraw/zinc/85/35/62/1039853562.db2.gz RCZDFRMVIWGRFJ-BXUZGUMPSA-N 1 2 319.788 4.228 20 0 DIADLO Cc1cccn2c(CNc3cccc(-c4ncco4)c3C)c[nH+]c12 ZINC000491577989 1039857406 /nfs/dbraw/zinc/85/74/06/1039857406.db2.gz BUKUYUXQOQZTMT-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(-c2ccc(Cl)cc2)o1)c1ccsc1 ZINC000669937504 1039868676 /nfs/dbraw/zinc/86/86/76/1039868676.db2.gz JGDHNVJXBLXVGR-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(-c2cccc(F)c2)o1)c1ccsc1 ZINC000669937366 1039869295 /nfs/dbraw/zinc/86/92/95/1039869295.db2.gz CZELHVYKRJYMJS-LLVKDONJSA-N 1 2 302.374 4.393 20 0 DIADLO c1[nH+]c(-c2cccc(NC[C@@H]3CCSC3)c2)n2c1CCCC2 ZINC000278773423 1039897136 /nfs/dbraw/zinc/89/71/36/1039897136.db2.gz OWXUOYXWJVIFEV-AWEZNQCLSA-N 1 2 313.470 4.051 20 0 DIADLO Fc1ccc2oc(C[N@@H+]3CCO[C@@H](c4ccsc4)C3)cc2c1 ZINC000093768163 1039903983 /nfs/dbraw/zinc/90/39/83/1039903983.db2.gz DDPITHSUTOMRBM-QGZVFWFLSA-N 1 2 317.385 4.207 20 0 DIADLO Fc1ccc2oc(C[N@H+]3CCO[C@@H](c4ccsc4)C3)cc2c1 ZINC000093768163 1039903999 /nfs/dbraw/zinc/90/39/99/1039903999.db2.gz DDPITHSUTOMRBM-QGZVFWFLSA-N 1 2 317.385 4.207 20 0 DIADLO CC(C)([NH2+]Cc1cccc(Cl)c1)c1cc(C(F)(F)F)on1 ZINC000492103426 1039918555 /nfs/dbraw/zinc/91/85/55/1039918555.db2.gz IJEAJFQYMUNNNM-UHFFFAOYSA-N 1 2 318.726 4.372 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000925400791 1039955269 /nfs/dbraw/zinc/95/52/69/1039955269.db2.gz WAXWOBAWPMCNQE-JMCQJSRRSA-N 1 2 312.200 4.023 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2cc3cnccc3o2)cs1 ZINC000657879896 1039988732 /nfs/dbraw/zinc/98/87/32/1039988732.db2.gz VATASLFFFXVRBM-QWRGUYRKSA-N 1 2 301.415 4.259 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2ccccc2Br)n1 ZINC000069168364 1039993276 /nfs/dbraw/zinc/99/32/76/1039993276.db2.gz UEHQCMCXWJEDPA-JTQLQIEISA-N 1 2 311.248 4.065 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000175028047 1040002175 /nfs/dbraw/zinc/00/21/75/1040002175.db2.gz ITAOGFYQBHZTPA-QWRGUYRKSA-N 1 2 304.356 4.307 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000175028047 1040002192 /nfs/dbraw/zinc/00/21/92/1040002192.db2.gz ITAOGFYQBHZTPA-QWRGUYRKSA-N 1 2 304.356 4.307 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ncc(-c3cccc(F)c3)o2)s1 ZINC000175170297 1040012328 /nfs/dbraw/zinc/01/23/28/1040012328.db2.gz ODNLGGCPZHNLHB-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ncc(-c3cccc(F)c3)o2)s1 ZINC000175170297 1040012342 /nfs/dbraw/zinc/01/23/42/1040012342.db2.gz ODNLGGCPZHNLHB-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO CC(C)C[C@H](C)C[C@@H](C)Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000685447457 1040055571 /nfs/dbraw/zinc/05/55/71/1040055571.db2.gz WXPYWVCIMONZQN-JKSUJKDBSA-N 1 2 300.450 4.199 20 0 DIADLO CC(C)C[C@@H](C)C[C@@H](C)Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000685447456 1040056980 /nfs/dbraw/zinc/05/69/80/1040056980.db2.gz WXPYWVCIMONZQN-HZPDHXFCSA-N 1 2 300.450 4.199 20 0 DIADLO COc1cccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)c1F ZINC000685473630 1040071509 /nfs/dbraw/zinc/07/15/09/1040071509.db2.gz YFVUJWYRHXRMHI-MRXNPFEDSA-N 1 2 305.418 4.479 20 0 DIADLO COc1cccc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)c1F ZINC000685473630 1040071522 /nfs/dbraw/zinc/07/15/22/1040071522.db2.gz YFVUJWYRHXRMHI-MRXNPFEDSA-N 1 2 305.418 4.479 20 0 DIADLO CCCC[C@@H](CC)C(=O)N1CC[NH2+][C@H](c2cccc(Cl)c2)C1 ZINC000513997323 1040120213 /nfs/dbraw/zinc/12/02/13/1040120213.db2.gz QUVINZNFPGHQTR-PBHICJAKSA-N 1 2 322.880 4.029 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2ccc(C(F)(F)F)cn2)CC1 ZINC000278769019 1040126769 /nfs/dbraw/zinc/12/67/69/1040126769.db2.gz NBHYZNVOLYDQOY-UHFFFAOYSA-N 1 2 310.294 4.018 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+](C)CCOc1ccccc1F ZINC000177642347 1040129601 /nfs/dbraw/zinc/12/96/01/1040129601.db2.gz YFOGKEFFJGLVCT-CYBMUJFWSA-N 1 2 320.408 4.183 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)CCOc1ccccc1F ZINC000177642347 1040129614 /nfs/dbraw/zinc/12/96/14/1040129614.db2.gz YFOGKEFFJGLVCT-CYBMUJFWSA-N 1 2 320.408 4.183 20 0 DIADLO CC(C)(C)c1cc(C[NH2+]C2(c3ccc(F)cc3)CCC2)no1 ZINC000685568118 1040132779 /nfs/dbraw/zinc/13/27/79/1040132779.db2.gz UEVHZRJLEUYEMV-UHFFFAOYSA-N 1 2 302.393 4.280 20 0 DIADLO Cc1nc(C)c(C[N@H+](Cc2cccc(C)c2)Cc2ccccn2)o1 ZINC000685568459 1040136376 /nfs/dbraw/zinc/13/63/76/1040136376.db2.gz GKWSTQUWVXJBKA-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1nc(C)c(C[N@@H+](Cc2cccc(C)c2)Cc2ccccn2)o1 ZINC000685568459 1040136387 /nfs/dbraw/zinc/13/63/87/1040136387.db2.gz GKWSTQUWVXJBKA-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1cn[nH]c1C[NH2+]Cc1ccc(C)cc1OCCCC(C)C ZINC000685618517 1040161173 /nfs/dbraw/zinc/16/11/73/1040161173.db2.gz IYEIXQJJPABDTI-UHFFFAOYSA-N 1 2 315.461 4.131 20 0 DIADLO Cc1c[nH]nc1C[NH2+]Cc1ccc(C)cc1OCCCC(C)C ZINC000685618517 1040161187 /nfs/dbraw/zinc/16/11/87/1040161187.db2.gz IYEIXQJJPABDTI-UHFFFAOYSA-N 1 2 315.461 4.131 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccnc(Oc3ccccc3)c2)no1 ZINC000685644695 1040178365 /nfs/dbraw/zinc/17/83/65/1040178365.db2.gz UWOYQJPTLLTULD-AWEZNQCLSA-N 1 2 309.369 4.021 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nccc2ccccc21)c1c(F)cncc1F ZINC000685654843 1040191269 /nfs/dbraw/zinc/19/12/69/1040191269.db2.gz QYVHDXJWALREKV-NEPJUHHUSA-N 1 2 313.351 4.320 20 0 DIADLO COc1ccc2oc([C@H](C)[NH2+]Cc3nc(C)c(C)o3)c(C)c2c1 ZINC000184333591 1040210711 /nfs/dbraw/zinc/21/07/11/1040210711.db2.gz DFZINWHHVDDOHY-LBPRGKRZSA-N 1 2 314.385 4.205 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2)sc1C ZINC000081644753 1040238812 /nfs/dbraw/zinc/23/88/12/1040238812.db2.gz UJOONSFCVQXLIN-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)sc1C ZINC000081644753 1040238831 /nfs/dbraw/zinc/23/88/31/1040238831.db2.gz UJOONSFCVQXLIN-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H](c2cccc(F)c2)C(C)(C)C)nn1C ZINC000421329286 1040254547 /nfs/dbraw/zinc/25/45/47/1040254547.db2.gz VDJWEQSIGCJZIW-INIZCTEOSA-N 1 2 323.843 4.398 20 0 DIADLO C[C@H]1CC[C@@](C)(C[NH2+][C@@H](c2cccs2)c2nnc[nH]2)C1(C)C ZINC000658128410 1040325934 /nfs/dbraw/zinc/32/59/34/1040325934.db2.gz UXDCQTBJKCUMSP-JDFRZJQESA-N 1 2 318.490 4.008 20 0 DIADLO COc1ccnc(C[NH2+][C@@H]2C[C@H](C)Sc3sccc32)c1F ZINC000658228082 1040369097 /nfs/dbraw/zinc/36/90/97/1040369097.db2.gz NZYQXJZZGDCDIX-GXSJLCMTSA-N 1 2 324.446 4.006 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2cc(F)ccc2OC(F)F)cs1 ZINC000658327895 1040425504 /nfs/dbraw/zinc/42/55/04/1040425504.db2.gz FWKWXVPYSHUKDC-QMMMGPOBSA-N 1 2 316.348 4.043 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2cc(Cl)cc(Cl)c21)c1nccn1C ZINC000658336185 1040427450 /nfs/dbraw/zinc/42/74/50/1040427450.db2.gz OTUHXQIJFOZCGU-ZANVPECISA-N 1 2 310.228 4.065 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@@H](C)c2nccn2C)c2cccc(F)c2)c1 ZINC000658337384 1040428899 /nfs/dbraw/zinc/42/88/99/1040428899.db2.gz DEDUCPDYZTVVCM-KXBFYZLASA-N 1 2 323.415 4.308 20 0 DIADLO CC(C)([NH2+]Cc1cnc(C2CC2)o1)c1cccc(Cl)c1F ZINC000628240324 1040458942 /nfs/dbraw/zinc/45/89/42/1040458942.db2.gz ZUAAVAAQWYVHJO-UHFFFAOYSA-N 1 2 308.784 4.369 20 0 DIADLO CC(C)(C)c1cnc(C[NH+]2CCC(c3ccccc3F)CC2)o1 ZINC000605576372 1040484819 /nfs/dbraw/zinc/48/48/19/1040484819.db2.gz NCLJSCARDGUMAG-UHFFFAOYSA-N 1 2 316.420 4.491 20 0 DIADLO FC(F)(F)c1cccc(C2([NH2+]Cc3nccn3C3CC3)CC2)c1 ZINC000892478094 1040526237 /nfs/dbraw/zinc/52/62/37/1040526237.db2.gz CXDRGUASDCOQOM-UHFFFAOYSA-N 1 2 321.346 4.016 20 0 DIADLO C[N@H+](C[C@@H]1CCCO1)Cn1c(-c2ccccc2)csc1=S ZINC000177146617 1040545259 /nfs/dbraw/zinc/54/52/59/1040545259.db2.gz ISUVVQLIZOVNCR-AWEZNQCLSA-N 1 2 320.483 4.014 20 0 DIADLO C[N@@H+](C[C@@H]1CCCO1)Cn1c(-c2ccccc2)csc1=S ZINC000177146617 1040545274 /nfs/dbraw/zinc/54/52/74/1040545274.db2.gz ISUVVQLIZOVNCR-AWEZNQCLSA-N 1 2 320.483 4.014 20 0 DIADLO Fc1cc(-c2ccco2)ccc1C[NH2+]Cc1cnc(C2CC2)o1 ZINC000628254786 1040568967 /nfs/dbraw/zinc/56/89/67/1040568967.db2.gz PCRZEPJJJJCJDS-UHFFFAOYSA-N 1 2 312.344 4.241 20 0 DIADLO CC(C)=C[C@@H]1[C@H](C(=O)Nc2cccc(-n3cc[nH+]c3)c2)C1(C)C ZINC000612504014 1040615699 /nfs/dbraw/zinc/61/56/99/1040615699.db2.gz FJSJTWXWSDHTJU-IAGOWNOFSA-N 1 2 309.413 4.049 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2ccc(Cl)c(Cl)c2)nn1 ZINC000926701875 1040710806 /nfs/dbraw/zinc/71/08/06/1040710806.db2.gz CFDREDZWHLCVKI-SNVBAGLBSA-N 1 2 313.232 4.017 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3)C2)s1 ZINC000685833962 1040765952 /nfs/dbraw/zinc/76/59/52/1040765952.db2.gz XDSPONIGOULICQ-HNNXBMFYSA-N 1 2 323.458 4.183 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@H](c3ccc(F)cc3)C2)s1 ZINC000685833962 1040765969 /nfs/dbraw/zinc/76/59/69/1040765969.db2.gz XDSPONIGOULICQ-HNNXBMFYSA-N 1 2 323.458 4.183 20 0 DIADLO C[C@@H]([NH2+][C@@H](CC(F)(F)F)c1ccccc1)c1cc2n(n1)CCC2 ZINC000414083402 1040836790 /nfs/dbraw/zinc/83/67/90/1040836790.db2.gz WPSVUCUVDSOFIA-WBMJQRKESA-N 1 2 323.362 4.174 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000613409578 1040925603 /nfs/dbraw/zinc/92/56/03/1040925603.db2.gz URMVHSULDPAKCH-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000613409578 1040925617 /nfs/dbraw/zinc/92/56/17/1040925617.db2.gz URMVHSULDPAKCH-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)s1 ZINC000174572833 1040986483 /nfs/dbraw/zinc/98/64/83/1040986483.db2.gz AIBBVIKQLICGTA-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)CC(=O)N(C)C1CCCCC1 ZINC000613485258 1040998264 /nfs/dbraw/zinc/99/82/64/1040998264.db2.gz AYISSGXANUWBDN-CQSZACIVSA-N 1 2 322.880 4.124 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)CC(=O)N(C)C1CCCCC1 ZINC000613485258 1040998287 /nfs/dbraw/zinc/99/82/87/1040998287.db2.gz AYISSGXANUWBDN-CQSZACIVSA-N 1 2 322.880 4.124 20 0 DIADLO C[C@H]([NH2+]Cc1nccc(C(F)(F)F)n1)c1cccc(C2CC2)c1 ZINC000414244871 1041046713 /nfs/dbraw/zinc/04/67/13/1041046713.db2.gz LVJMRHCVDXAYQX-NSHDSACASA-N 1 2 321.346 4.224 20 0 DIADLO C[C@H]([NH2+]Cc1nccc(C(F)(F)F)n1)c1ccc(Cl)s1 ZINC000414270088 1041064301 /nfs/dbraw/zinc/06/43/01/1041064301.db2.gz YNZRYTUSHWVRMA-ZETCQYMHSA-N 1 2 321.755 4.061 20 0 DIADLO Cc1ccccc1Cc1noc(C[N@@H+](C)[C@@H](C)c2ccccc2)n1 ZINC000175561965 1041075435 /nfs/dbraw/zinc/07/54/35/1041075435.db2.gz FIPFNTDNJJZDJS-INIZCTEOSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1ccccc1Cc1noc(C[N@H+](C)[C@@H](C)c2ccccc2)n1 ZINC000175561965 1041075450 /nfs/dbraw/zinc/07/54/50/1041075450.db2.gz FIPFNTDNJJZDJS-INIZCTEOSA-N 1 2 321.424 4.162 20 0 DIADLO CCCCOc1cccc(C[NH2+]Cc2nnc(C(C)C)s2)c1 ZINC000892603453 1041097627 /nfs/dbraw/zinc/09/76/27/1041097627.db2.gz MNBOGMASTBBCSU-UHFFFAOYSA-N 1 2 319.474 4.130 20 0 DIADLO CCCOc1ccc([C@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc1 ZINC000414324576 1041130058 /nfs/dbraw/zinc/13/00/58/1041130058.db2.gz KQRSNOGNAUSOCU-LBPRGKRZSA-N 1 2 317.458 4.055 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2nnc(C3CC3)s2)C2CCCC2)o1 ZINC000414335064 1041141710 /nfs/dbraw/zinc/14/17/10/1041141710.db2.gz XUJWQIBFKQIECB-INIZCTEOSA-N 1 2 317.458 4.338 20 0 DIADLO Cc1occc1CNc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000414359290 1041169101 /nfs/dbraw/zinc/16/91/01/1041169101.db2.gz JSTDYBOKLXWXGW-UHFFFAOYSA-N 1 2 307.397 4.400 20 0 DIADLO CC(C)[C@H](c1noc([C@H](C)[NH+](C)C)n1)c1ccc(Cl)cc1 ZINC000809500981 1041179302 /nfs/dbraw/zinc/17/93/02/1041179302.db2.gz ZCGWIZOIWQUYPC-FZMZJTMJSA-N 1 2 307.825 4.134 20 0 DIADLO Cc1ccccc1OCCC[N@@H+](C)Cc1csc(Cl)n1 ZINC000809572023 1041186889 /nfs/dbraw/zinc/18/68/89/1041186889.db2.gz GWCCUTPROJVFTJ-UHFFFAOYSA-N 1 2 310.850 4.006 20 0 DIADLO Cc1ccccc1OCCC[N@H+](C)Cc1csc(Cl)n1 ZINC000809572023 1041186899 /nfs/dbraw/zinc/18/68/99/1041186899.db2.gz GWCCUTPROJVFTJ-UHFFFAOYSA-N 1 2 310.850 4.006 20 0 DIADLO CC[N@H+](CC1CCC2(CC1)OCCO2)c1ccc(C)cc1C ZINC001167707657 1041283145 /nfs/dbraw/zinc/28/31/45/1041283145.db2.gz BMIOPISWHLYAPF-UHFFFAOYSA-N 1 2 303.446 4.063 20 0 DIADLO CC[N@@H+](CC1CCC2(CC1)OCCO2)c1ccc(C)cc1C ZINC001167707657 1041283155 /nfs/dbraw/zinc/28/31/55/1041283155.db2.gz BMIOPISWHLYAPF-UHFFFAOYSA-N 1 2 303.446 4.063 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@@H+]2CCC(F)(F)[C@@H](C)C2)cc1 ZINC000810044516 1041300837 /nfs/dbraw/zinc/30/08/37/1041300837.db2.gz CALOQXISVZTISG-KBPBESRZSA-N 1 2 324.415 4.116 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@H+]2CCC(F)(F)[C@@H](C)C2)cc1 ZINC000810044516 1041300845 /nfs/dbraw/zinc/30/08/45/1041300845.db2.gz CALOQXISVZTISG-KBPBESRZSA-N 1 2 324.415 4.116 20 0 DIADLO Brc1cccc2c1CC[N@H+](Cc1ccsc1)C2 ZINC001204040325 1041321829 /nfs/dbraw/zinc/32/18/29/1041321829.db2.gz SQUWAEVXFWHQJP-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1cccc2c1CC[N@@H+](Cc1ccsc1)C2 ZINC001204040325 1041321836 /nfs/dbraw/zinc/32/18/36/1041321836.db2.gz SQUWAEVXFWHQJP-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO C[C@@H]([NH2+]Cc1ccon1)c1ccc(-c2c(F)cccc2F)cc1 ZINC000810221310 1041339048 /nfs/dbraw/zinc/33/90/48/1041339048.db2.gz NPRFSZKSSRTETJ-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCCO2)c1ccc(-n2cc[nH+]c2)cc1 ZINC000183071456 1041389808 /nfs/dbraw/zinc/38/98/08/1041389808.db2.gz PLGAKFNGRMTCAN-HNNXBMFYSA-N 1 2 319.408 4.370 20 0 DIADLO FC(F)(F)c1nnc(C[N@@H+]2CCC[C@H]2C2CCCCC2)s1 ZINC000659846025 1041439416 /nfs/dbraw/zinc/43/94/16/1041439416.db2.gz NTXCGTNKPVOUGW-NSHDSACASA-N 1 2 319.396 4.102 20 0 DIADLO FC(F)(F)c1nnc(C[N@H+]2CCC[C@H]2C2CCCCC2)s1 ZINC000659846025 1041439423 /nfs/dbraw/zinc/43/94/23/1041439423.db2.gz NTXCGTNKPVOUGW-NSHDSACASA-N 1 2 319.396 4.102 20 0 DIADLO Cc1nc(C[NH+]2CCC(Oc3ccc(C(C)C)cc3)CC2)co1 ZINC000659847259 1041441395 /nfs/dbraw/zinc/44/13/95/1041441395.db2.gz ZSRGCGRLQBKQLO-UHFFFAOYSA-N 1 2 314.429 4.150 20 0 DIADLO CC(C)CCN(C(=O)[C@H](CC(C)C)n1cc[nH+]c1)C1CCCC1 ZINC001625890748 1041458760 /nfs/dbraw/zinc/45/87/60/1041458760.db2.gz PYVIEESOKIBBPH-SFHVURJKSA-N 1 2 319.493 4.288 20 0 DIADLO Cc1nc(C[N@H+](Cc2cccc(C(F)(F)F)c2)C(C)C)co1 ZINC000659858567 1041460961 /nfs/dbraw/zinc/46/09/61/1041460961.db2.gz FOQGTDDKTCJFBD-UHFFFAOYSA-N 1 2 312.335 4.412 20 0 DIADLO Cc1nc(C[N@@H+](Cc2cccc(C(F)(F)F)c2)C(C)C)co1 ZINC000659858567 1041460967 /nfs/dbraw/zinc/46/09/67/1041460967.db2.gz FOQGTDDKTCJFBD-UHFFFAOYSA-N 1 2 312.335 4.412 20 0 DIADLO ClC1(Cl)C[C@H]1C[N@@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000747668209 1041473647 /nfs/dbraw/zinc/47/36/47/1041473647.db2.gz AHBOHGVUHJTWOX-GOEBONIOSA-N 1 2 321.251 4.087 20 0 DIADLO ClC1(Cl)C[C@H]1C[N@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC000747668209 1041473654 /nfs/dbraw/zinc/47/36/54/1041473654.db2.gz AHBOHGVUHJTWOX-GOEBONIOSA-N 1 2 321.251 4.087 20 0 DIADLO O=C(Nc1ccc(C2CCC2)cc1)N1CCC(n2cc[nH+]c2)CC1 ZINC000278819473 1041476831 /nfs/dbraw/zinc/47/68/31/1041476831.db2.gz CBQJFBJEAZKJKV-UHFFFAOYSA-N 1 2 324.428 4.020 20 0 DIADLO CCC[C@H]([NH2+]Cc1nccn1C1CC1)c1ccc(F)cc1F ZINC000893108015 1041490047 /nfs/dbraw/zinc/49/00/47/1041490047.db2.gz KCOQUSJOPLQNCC-INIZCTEOSA-N 1 2 305.372 4.127 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1ncc(-c2ccccc2)n1C ZINC000651229813 1041507338 /nfs/dbraw/zinc/50/73/38/1041507338.db2.gz OQKAUDSGQCMPEL-GXTWGEPZSA-N 1 2 324.428 4.104 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1ccnc(Cl)c1Cl ZINC000811495923 1041525857 /nfs/dbraw/zinc/52/58/57/1041525857.db2.gz SYVXNFORHCINFV-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1ccnc(Cl)c1Cl ZINC000811495923 1041525864 /nfs/dbraw/zinc/52/58/64/1041525864.db2.gz SYVXNFORHCINFV-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccnc(Cl)c2Cl)o1 ZINC000811475209 1041527499 /nfs/dbraw/zinc/52/74/99/1041527499.db2.gz XZEYCFCRGOKNIT-JOYOIKCWSA-N 1 2 311.212 4.395 20 0 DIADLO CCCCCC(CCCCC)NC(=O)[C@H]1CCn2cc[nH+]c2C1 ZINC000180513927 1041533938 /nfs/dbraw/zinc/53/39/38/1041533938.db2.gz SBPTXZJKMUOMAR-INIZCTEOSA-N 1 2 319.493 4.091 20 0 DIADLO Clc1nc(NCc2ccn3cc[nH+]c3c2)cc2ccccc12 ZINC000811817687 1041574220 /nfs/dbraw/zinc/57/42/20/1041574220.db2.gz ZGPCSQPCQIWUDS-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO COc1cccc(C[NH2+]C(C)(C)c2nc(C)c(C)s2)c1Cl ZINC000660089483 1041609496 /nfs/dbraw/zinc/60/94/96/1041609496.db2.gz IIXKJFFYIVDPNN-UHFFFAOYSA-N 1 2 324.877 4.447 20 0 DIADLO CCc1nocc1C[N@@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000660101573 1041613762 /nfs/dbraw/zinc/61/37/62/1041613762.db2.gz NLIRXYZVDADVDR-INIZCTEOSA-N 1 2 311.385 4.105 20 0 DIADLO CCc1nocc1C[N@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000660101573 1041613765 /nfs/dbraw/zinc/61/37/65/1041613765.db2.gz NLIRXYZVDADVDR-INIZCTEOSA-N 1 2 311.385 4.105 20 0 DIADLO Clc1ccccc1C1=CC[N@H+](Cc2cc(C3CC3)no2)CC1 ZINC000660166608 1041642564 /nfs/dbraw/zinc/64/25/64/1041642564.db2.gz VQJXDJVRAPUVQX-UHFFFAOYSA-N 1 2 314.816 4.495 20 0 DIADLO Clc1ccccc1C1=CC[N@@H+](Cc2cc(C3CC3)no2)CC1 ZINC000660166608 1041642569 /nfs/dbraw/zinc/64/25/69/1041642569.db2.gz VQJXDJVRAPUVQX-UHFFFAOYSA-N 1 2 314.816 4.495 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@H]1CCOC2(CCCC2)C1 ZINC000388220025 1041644232 /nfs/dbraw/zinc/64/42/32/1041644232.db2.gz WTMHITNNHPXHFV-KRWDZBQOSA-N 1 2 300.446 4.191 20 0 DIADLO c1cc(N2CCCC2)ccc1[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000388220025 1041644236 /nfs/dbraw/zinc/64/42/36/1041644236.db2.gz WTMHITNNHPXHFV-KRWDZBQOSA-N 1 2 300.446 4.191 20 0 DIADLO CC(C)CCc1nc(CO[NH+]=C(N)Cc2cccs2)cs1 ZINC000747835395 1041669537 /nfs/dbraw/zinc/66/95/37/1041669537.db2.gz CVOMDLABVJANGH-UHFFFAOYSA-N 1 2 323.487 4.034 20 0 DIADLO CC[C@H]([NH2+]Cc1cccc(F)c1OC(F)F)c1nccs1 ZINC000660253240 1041692229 /nfs/dbraw/zinc/69/22/29/1041692229.db2.gz GFHKPYIOOQUHHZ-NSHDSACASA-N 1 2 316.348 4.125 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(c3ccc(C)cc3)C3CCC3)ccn12 ZINC001133734850 1041700243 /nfs/dbraw/zinc/70/02/43/1041700243.db2.gz ZNILICYLDRWEFK-UHFFFAOYSA-N 1 2 319.408 4.150 20 0 DIADLO CCn1c[nH+]cc1CNc1ccccc1COCc1ccccc1 ZINC000417812763 1041702971 /nfs/dbraw/zinc/70/29/71/1041702971.db2.gz LSKQSGIDBFGEKJ-UHFFFAOYSA-N 1 2 321.424 4.232 20 0 DIADLO CC(C)c1cc(NC2(C3CCOCC3)CC2)nc(C(C)C)[nH+]1 ZINC001167745057 1041706744 /nfs/dbraw/zinc/70/67/44/1041706744.db2.gz AVEQUMVWLIXYML-UHFFFAOYSA-N 1 2 303.450 4.095 20 0 DIADLO Cc1nc(C[NH+]2CCC(=Cc3ccc(F)c(F)c3)CC2)c(C)o1 ZINC000660297708 1041707408 /nfs/dbraw/zinc/70/74/08/1041707408.db2.gz OKZSOILUYDGRSR-UHFFFAOYSA-N 1 2 318.367 4.249 20 0 DIADLO CC(C)([NH2+]Cc1cc(C2CC2)no1)c1cccc(Cl)c1F ZINC000660302514 1041707561 /nfs/dbraw/zinc/70/75/61/1041707561.db2.gz IBHHXXIRQGDOGI-UHFFFAOYSA-N 1 2 308.784 4.369 20 0 DIADLO CC(C)([NH2+]Cc1occc1Br)c1ccccc1F ZINC000813792264 1041732244 /nfs/dbraw/zinc/73/22/44/1041732244.db2.gz MMJWFZKNZJLFLI-UHFFFAOYSA-N 1 2 312.182 4.206 20 0 DIADLO Fc1ccc(Br)c2c1CC[N@H+](CC1=CCCC1)C2 ZINC001170712330 1041730936 /nfs/dbraw/zinc/73/09/36/1041730936.db2.gz RKICJNRJNZNLII-UHFFFAOYSA-N 1 2 310.210 4.057 20 0 DIADLO Fc1ccc(Br)c2c1CC[N@@H+](CC1=CCCC1)C2 ZINC001170712330 1041730944 /nfs/dbraw/zinc/73/09/44/1041730944.db2.gz RKICJNRJNZNLII-UHFFFAOYSA-N 1 2 310.210 4.057 20 0 DIADLO Brc1cc(C[NH+]2CC3(C2)CCCCC3)cs1 ZINC000397977347 1041743379 /nfs/dbraw/zinc/74/33/79/1041743379.db2.gz KYWSBVFCXLKLRK-UHFFFAOYSA-N 1 2 300.265 4.277 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1ccc(Cl)nc1)[C@H]2C ZINC000781928229 1041773074 /nfs/dbraw/zinc/77/30/74/1041773074.db2.gz VFXWFFDSHUEHAJ-STQMWFEESA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1ccc(Cl)nc1)[C@H]2C ZINC000781928229 1041773076 /nfs/dbraw/zinc/77/30/76/1041773076.db2.gz VFXWFFDSHUEHAJ-STQMWFEESA-N 1 2 316.832 4.251 20 0 DIADLO Cc1cc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)nc(C)n1 ZINC000660401429 1041776387 /nfs/dbraw/zinc/77/63/87/1041776387.db2.gz UTRXHVSZBPYNPC-UHFFFAOYSA-N 1 2 323.362 4.048 20 0 DIADLO Cc1cc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)nc(C)n1 ZINC000660401429 1041776394 /nfs/dbraw/zinc/77/63/94/1041776394.db2.gz UTRXHVSZBPYNPC-UHFFFAOYSA-N 1 2 323.362 4.048 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2cccc(OCc3ccccc3)c2)co1 ZINC000660421174 1041783673 /nfs/dbraw/zinc/78/36/73/1041783673.db2.gz MZCJNQXGSKBJAO-HNNXBMFYSA-N 1 2 322.408 4.413 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)C(=O)CCCCCC(C)C)c1C ZINC000747908878 1041786201 /nfs/dbraw/zinc/78/62/01/1041786201.db2.gz QWCODWSWTKCLOO-UHFFFAOYSA-N 1 2 320.477 4.272 20 0 DIADLO Cc1cc(NCc2ccccc2-c2ccnn2C)ccc1[NH+](C)C ZINC000814293394 1041801463 /nfs/dbraw/zinc/80/14/63/1041801463.db2.gz WHUMMBLRRSVDBJ-UHFFFAOYSA-N 1 2 320.440 4.074 20 0 DIADLO C[C@H](Nc1ccc(N(C)C)c[nH+]1)c1ccccc1C(F)(F)F ZINC001170743421 1041813359 /nfs/dbraw/zinc/81/33/59/1041813359.db2.gz SUEAVHGWIOFLPZ-NSHDSACASA-N 1 2 309.335 4.340 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1ncccc1C(F)(F)F ZINC000093845323 1041828690 /nfs/dbraw/zinc/82/86/90/1041828690.db2.gz PJDJOWZWSPMKGY-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1ncccc1C(F)(F)F ZINC000093845323 1041828692 /nfs/dbraw/zinc/82/86/92/1041828692.db2.gz PJDJOWZWSPMKGY-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO C[C@@H]([N@H+](C)Cn1nc(-c2ccccc2F)oc1=S)C(C)(C)C ZINC000026630033 1041842573 /nfs/dbraw/zinc/84/25/73/1041842573.db2.gz CJGGWWJDSFXDKB-LLVKDONJSA-N 1 2 323.437 4.336 20 0 DIADLO C[C@@H]([N@@H+](C)Cn1nc(-c2ccccc2F)oc1=S)C(C)(C)C ZINC000026630033 1041842580 /nfs/dbraw/zinc/84/25/80/1041842580.db2.gz CJGGWWJDSFXDKB-LLVKDONJSA-N 1 2 323.437 4.336 20 0 DIADLO C[C@H](c1nc2cc(Cl)ccc2[nH]1)[N@H+](C)CCC(F)(F)F ZINC000660707160 1041855930 /nfs/dbraw/zinc/85/59/30/1041855930.db2.gz DFMPFYDEQXHTDU-MRVPVSSYSA-N 1 2 305.731 4.162 20 0 DIADLO C[C@H](c1nc2cc(Cl)ccc2[nH]1)[N@@H+](C)CCC(F)(F)F ZINC000660707160 1041855933 /nfs/dbraw/zinc/85/59/33/1041855933.db2.gz DFMPFYDEQXHTDU-MRVPVSSYSA-N 1 2 305.731 4.162 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)[nH]1 ZINC000660767388 1041859307 /nfs/dbraw/zinc/85/93/07/1041859307.db2.gz QVZOXORYCPQSKK-PBHICJAKSA-N 1 2 310.445 4.045 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)[nH]1 ZINC000660767388 1041859314 /nfs/dbraw/zinc/85/93/14/1041859314.db2.gz QVZOXORYCPQSKK-PBHICJAKSA-N 1 2 310.445 4.045 20 0 DIADLO CC(C)c1ccc(C[N@H+](C)Cc2nc(-c3ccco3)no2)cc1 ZINC000044070594 1041860160 /nfs/dbraw/zinc/86/01/60/1041860160.db2.gz CKVDATZQAJBISG-UHFFFAOYSA-N 1 2 311.385 4.085 20 0 DIADLO CC(C)c1ccc(C[N@@H+](C)Cc2nc(-c3ccco3)no2)cc1 ZINC000044070594 1041860168 /nfs/dbraw/zinc/86/01/68/1041860168.db2.gz CKVDATZQAJBISG-UHFFFAOYSA-N 1 2 311.385 4.085 20 0 DIADLO CC(C)c1cc(C[NH2+][C@@H]2CCc3ccc(F)c(Cl)c32)on1 ZINC000651709918 1041888345 /nfs/dbraw/zinc/88/83/45/1041888345.db2.gz MLVUTVSSDGTKIG-CYBMUJFWSA-N 1 2 308.784 4.368 20 0 DIADLO COC[C@@H]([NH2+][C@H]1CCc2ccc(F)c(Cl)c21)c1ccc(C)o1 ZINC000651728647 1041897195 /nfs/dbraw/zinc/89/71/95/1041897195.db2.gz FVEUEIAEWNHBRB-UONOGXRCSA-N 1 2 323.795 4.345 20 0 DIADLO C[C@H]([NH2+]Cc1cccc2c1CCC2)c1noc(-c2ccccc2)n1 ZINC000651732257 1041898560 /nfs/dbraw/zinc/89/85/60/1041898560.db2.gz OEABTFKJDBCEAE-AWEZNQCLSA-N 1 2 319.408 4.076 20 0 DIADLO CC(C)(C)c1nc(C[NH+]2CCC(c3ccco3)CC2)cs1 ZINC000661164388 1041899740 /nfs/dbraw/zinc/89/97/40/1041899740.db2.gz FDRBQBOJIPGGHA-UHFFFAOYSA-N 1 2 304.459 4.413 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2)[C@H]2COC(C)(C)C2)cs1 ZINC000661192941 1041901712 /nfs/dbraw/zinc/90/17/12/1041901712.db2.gz BWFFTEAXNAPGIY-QGZVFWFLSA-N 1 2 316.470 4.021 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2)[C@H]2COC(C)(C)C2)cs1 ZINC000661192941 1041901722 /nfs/dbraw/zinc/90/17/22/1041901722.db2.gz BWFFTEAXNAPGIY-QGZVFWFLSA-N 1 2 316.470 4.021 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccnc(Br)c2)[C@H]1c1ccccc1 ZINC000815058064 1041907600 /nfs/dbraw/zinc/90/76/00/1041907600.db2.gz MESJDZQHFROTTQ-BLLLJJGKSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccnc(Br)c2)[C@H]1c1ccccc1 ZINC000815058064 1041907603 /nfs/dbraw/zinc/90/76/03/1041907603.db2.gz MESJDZQHFROTTQ-BLLLJJGKSA-N 1 2 317.230 4.037 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@]3(C)C[C@H]4C[C@H]4C3)c2)[nH+]c1C ZINC000815098361 1041918266 /nfs/dbraw/zinc/91/82/66/1041918266.db2.gz FRCUEVMRMGKUFP-CCWDJLKJSA-N 1 2 309.413 4.068 20 0 DIADLO CCc1ncc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)o1 ZINC000651823393 1041922744 /nfs/dbraw/zinc/92/27/44/1041922744.db2.gz GUQNALQGYUZSFM-AWEZNQCLSA-N 1 2 307.397 4.150 20 0 DIADLO Cc1cn2c(cccc2-c2cccc(Br)c2F)[nH+]1 ZINC001245485562 1041955226 /nfs/dbraw/zinc/95/52/26/1041955226.db2.gz SHASLELQNHQTAW-UHFFFAOYSA-N 1 2 305.150 4.211 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1coc(-c2cccc(F)c2)n1 ZINC000046054363 1041960610 /nfs/dbraw/zinc/96/06/10/1041960610.db2.gz LBDPGARSWQPWPM-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1coc(-c2cccc(F)c2)n1 ZINC000046054363 1041960616 /nfs/dbraw/zinc/96/06/16/1041960616.db2.gz LBDPGARSWQPWPM-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO CC1(C)C[N@H+](Cc2c(F)cccc2F)Cc2ccccc2O1 ZINC001170795052 1041973984 /nfs/dbraw/zinc/97/39/84/1041973984.db2.gz QDUSQZOYZMEIJI-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(F)cccc2F)Cc2ccccc2O1 ZINC001170795052 1041973987 /nfs/dbraw/zinc/97/39/87/1041973987.db2.gz QDUSQZOYZMEIJI-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2nc(Cc3ccccc3)no2)cc1 ZINC000047965368 1041976089 /nfs/dbraw/zinc/97/60/89/1041976089.db2.gz DIWDADDOTSERSY-MRXNPFEDSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nc(Cc3ccccc3)no2)cc1 ZINC000047965368 1041976097 /nfs/dbraw/zinc/97/60/97/1041976097.db2.gz DIWDADDOTSERSY-MRXNPFEDSA-N 1 2 321.424 4.162 20 0 DIADLO Fc1cc2c(c(F)c1)CC[C@H]2[NH2+]Cc1c(F)cc(F)cc1F ZINC000815648927 1041984352 /nfs/dbraw/zinc/98/43/52/1041984352.db2.gz BWQGPEFUAGBIFZ-MRXNPFEDSA-N 1 2 313.269 4.159 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2c(F)cc(F)cc2F)c(F)c1 ZINC000815650190 1041985491 /nfs/dbraw/zinc/98/54/91/1041985491.db2.gz LEWSAMANGCPCDC-SECBINFHSA-N 1 2 313.294 4.102 20 0 DIADLO CC(C)[N@H+](Cc1ncc(-c2ccccc2)o1)Cc1ccccn1 ZINC000048273071 1041985928 /nfs/dbraw/zinc/98/59/28/1041985928.db2.gz AHCPJBMSMYCZRW-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO CC(C)[N@@H+](Cc1ncc(-c2ccccc2)o1)Cc1ccccn1 ZINC000048273071 1041985936 /nfs/dbraw/zinc/98/59/36/1041985936.db2.gz AHCPJBMSMYCZRW-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+]Cc1c(F)cc(F)cc1F ZINC000815650553 1041986092 /nfs/dbraw/zinc/98/60/92/1041986092.db2.gz UTMBAMJFRZKMJM-LLVKDONJSA-N 1 2 309.331 4.353 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1noc2c1CCCC2)CC1CC1 ZINC000661795264 1041995941 /nfs/dbraw/zinc/99/59/41/1041995941.db2.gz ZNBYIMVGIQXUDS-UHFFFAOYSA-N 1 2 314.404 4.105 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1noc2c1CCCC2)CC1CC1 ZINC000661795264 1041995948 /nfs/dbraw/zinc/99/59/48/1041995948.db2.gz ZNBYIMVGIQXUDS-UHFFFAOYSA-N 1 2 314.404 4.105 20 0 DIADLO Clc1ccc(C2([NH2+]Cc3ccn(-c4ccccc4)n3)CC2)cc1 ZINC000091060372 1041997105 /nfs/dbraw/zinc/99/71/05/1041997105.db2.gz IXTVXEFEWNQEKV-UHFFFAOYSA-N 1 2 323.827 4.305 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ccccc2C)nn1C ZINC000487365739 1042003847 /nfs/dbraw/zinc/00/38/47/1042003847.db2.gz MXEAZQAHHRUVGG-UHFFFAOYSA-N 1 2 319.452 4.239 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2ccccc2C)nn1C ZINC000487365739 1042003856 /nfs/dbraw/zinc/00/38/56/1042003856.db2.gz MXEAZQAHHRUVGG-UHFFFAOYSA-N 1 2 319.452 4.239 20 0 DIADLO FC(F)(F)CC[N@@H+]1CC[C@H]1c1ccc(Br)cc1 ZINC000662090604 1042060459 /nfs/dbraw/zinc/06/04/59/1042060459.db2.gz AGULYFYLLDENQM-NSHDSACASA-N 1 2 308.141 4.148 20 0 DIADLO FC(F)(F)CC[N@H+]1CC[C@H]1c1ccc(Br)cc1 ZINC000662090604 1042060465 /nfs/dbraw/zinc/06/04/65/1042060465.db2.gz AGULYFYLLDENQM-NSHDSACASA-N 1 2 308.141 4.148 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2ccc(OC(F)F)cc2)c1 ZINC000652329911 1042009397 /nfs/dbraw/zinc/00/93/97/1042009397.db2.gz NUGCJOOJNICOTA-LLVKDONJSA-N 1 2 308.328 4.003 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2cc(C)c(OC)cc2C)c1 ZINC000652330473 1042009549 /nfs/dbraw/zinc/00/95/49/1042009549.db2.gz HLFVRBAHEJHRRY-AWEZNQCLSA-N 1 2 300.402 4.027 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2ccccc2OC(F)F)c1 ZINC000652329695 1042010045 /nfs/dbraw/zinc/01/00/45/1042010045.db2.gz FBDJBNZUZUWNCA-LLVKDONJSA-N 1 2 308.328 4.003 20 0 DIADLO COCc1cc[nH+]c(N[C@H](c2ccc(C)o2)C2CCCC2)c1 ZINC000652330995 1042011566 /nfs/dbraw/zinc/01/15/66/1042011566.db2.gz UYBSDJWKKXPTER-SFHVURJKSA-N 1 2 300.402 4.473 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CC3(CCC3)Oc3ccccc32)c1 ZINC000652330921 1042011617 /nfs/dbraw/zinc/01/16/17/1042011617.db2.gz SROGDXIMHCGKAN-MRXNPFEDSA-N 1 2 310.397 4.086 20 0 DIADLO FC(F)(F)c1c[nH]c2[nH+]ccc(NCOc3ccccc3)c12 ZINC001170809820 1042020330 /nfs/dbraw/zinc/02/03/30/1042020330.db2.gz USQJTELCIOIRBQ-UHFFFAOYSA-N 1 2 307.275 4.030 20 0 DIADLO Cc1cc(C)cc(NC(=O)c2c[nH+]ccc2Nc2ccccc2)c1 ZINC001135370413 1042021009 /nfs/dbraw/zinc/02/10/09/1042021009.db2.gz PHRSFBKKMNEXGP-UHFFFAOYSA-N 1 2 317.392 4.116 20 0 DIADLO COc1c(F)cc(Nc2cc(Cl)c3[nH+]ccn3c2)cc1F ZINC001211678779 1042032116 /nfs/dbraw/zinc/03/21/16/1042032116.db2.gz PCWDNRBSUASJOJ-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO FC(F)(F)c1ccccc1C[N@@H+]1CCOc2ccccc2C1 ZINC000108094560 1042040878 /nfs/dbraw/zinc/04/08/78/1042040878.db2.gz JVFANYCRAXEMCP-UHFFFAOYSA-N 1 2 307.315 4.100 20 0 DIADLO FC(F)(F)c1ccccc1C[N@H+]1CCOc2ccccc2C1 ZINC000108094560 1042040884 /nfs/dbraw/zinc/04/08/84/1042040884.db2.gz JVFANYCRAXEMCP-UHFFFAOYSA-N 1 2 307.315 4.100 20 0 DIADLO c1cc(C2CC[NH+](Cc3csc(C4CCCC4)n3)CC2)no1 ZINC000662046712 1042048753 /nfs/dbraw/zinc/04/87/53/1042048753.db2.gz LUQYTFIJADTZPG-UHFFFAOYSA-N 1 2 317.458 4.168 20 0 DIADLO C[C@H]1COCC[C@H]1Nc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1 ZINC001170823737 1042051180 /nfs/dbraw/zinc/05/11/80/1042051180.db2.gz GNZDTTYBPIQQNN-XJKSGUPXSA-N 1 2 307.397 4.067 20 0 DIADLO Cn1ncc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1Cl ZINC000816486420 1042056273 /nfs/dbraw/zinc/05/62/73/1042056273.db2.gz CWHUOBULJRYQSW-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1ncc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1Cl ZINC000816486420 1042056278 /nfs/dbraw/zinc/05/62/78/1042056278.db2.gz CWHUOBULJRYQSW-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+](Cc1cnn(C)c1Cl)C1CC1 ZINC000816484449 1042056347 /nfs/dbraw/zinc/05/63/47/1042056347.db2.gz CMYCIEPMHKJYJN-LLVKDONJSA-N 1 2 324.255 4.453 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](Cc1cnn(C)c1Cl)C1CC1 ZINC000816484449 1042056354 /nfs/dbraw/zinc/05/63/54/1042056354.db2.gz CMYCIEPMHKJYJN-LLVKDONJSA-N 1 2 324.255 4.453 20 0 DIADLO CC(C)CN(C(=O)CCCn1cc[nH+]c1)c1ccccc1Cl ZINC000662075692 1042056423 /nfs/dbraw/zinc/05/64/23/1042056423.db2.gz NWTPAGIKQATLSV-UHFFFAOYSA-N 1 2 319.836 4.006 20 0 DIADLO c1ccc(N2Cc3cccc(NC[C@@H]4C[C@H]5C[C@H]5C4)c3C2)[nH+]c1 ZINC000663278980 1042095809 /nfs/dbraw/zinc/09/58/09/1042095809.db2.gz AMELVGCPICDXEY-ACHSLPGTSA-N 1 2 305.425 4.060 20 0 DIADLO Cc1cc(C)n(-c2ccc(CNc3c[nH+]cc(C)c3C)cc2)n1 ZINC001167794652 1042098784 /nfs/dbraw/zinc/09/87/84/1042098784.db2.gz PAGOMMCVWCKKBQ-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO O=C1CCCc2cc(Nc3ccc(-n4cc[nH+]c4)cc3)ccc21 ZINC001213103980 1042103930 /nfs/dbraw/zinc/10/39/30/1042103930.db2.gz INTHRCVCYYJQSA-UHFFFAOYSA-N 1 2 303.365 4.135 20 0 DIADLO OC1CCN(c2ccc([NH2+]C3CC4(C3)CCCCC4)cc2)CC1 ZINC000817407003 1042107440 /nfs/dbraw/zinc/10/74/40/1042107440.db2.gz VSCSTUITPYKERF-UHFFFAOYSA-N 1 2 314.473 4.173 20 0 DIADLO OC1CC[NH+](c2ccc(NC3CC4(C3)CCCCC4)cc2)CC1 ZINC000817407003 1042107447 /nfs/dbraw/zinc/10/74/47/1042107447.db2.gz VSCSTUITPYKERF-UHFFFAOYSA-N 1 2 314.473 4.173 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@]2(c3ccccc3)CC2(C)C)s1 ZINC000662340515 1042115400 /nfs/dbraw/zinc/11/54/00/1042115400.db2.gz LMVPOMKAARRYHF-KRWDZBQOSA-N 1 2 301.459 4.077 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@]2(c3ccccc3)CC2(C)C)s1 ZINC000662340517 1042115570 /nfs/dbraw/zinc/11/55/70/1042115570.db2.gz LMVPOMKAARRYHF-QGZVFWFLSA-N 1 2 301.459 4.077 20 0 DIADLO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ncsc1Br ZINC001167798585 1042117097 /nfs/dbraw/zinc/11/70/97/1042117097.db2.gz NLEDIZIETMHCTI-CMPLNLGQSA-N 1 2 317.296 4.306 20 0 DIADLO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ncsc1Br ZINC001167798585 1042117099 /nfs/dbraw/zinc/11/70/99/1042117099.db2.gz NLEDIZIETMHCTI-CMPLNLGQSA-N 1 2 317.296 4.306 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@@H](C)c1ccncc1Cl)CCC2 ZINC000817584798 1042117192 /nfs/dbraw/zinc/11/71/92/1042117192.db2.gz FXONCPZPYBANHG-BLLLJJGKSA-N 1 2 318.852 4.241 20 0 DIADLO CCOc1cccc([C@H](C)[NH2+]Cc2csc([C@@H](C)OC)n2)c1 ZINC000165243292 1042123164 /nfs/dbraw/zinc/12/31/64/1042123164.db2.gz XAYPCANSZOVIJV-QWHCGFSZSA-N 1 2 320.458 4.100 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)CCCC(C)(C)C)n1 ZINC000728862192 1042125066 /nfs/dbraw/zinc/12/50/66/1042125066.db2.gz VTBDDNGGBVYDHT-UHFFFAOYSA-N 1 2 311.495 4.140 20 0 DIADLO F[C@@]1(c2ccccc2)C[C@H]1[NH2+]Cc1ccnc(Cl)c1Cl ZINC000818229675 1042145062 /nfs/dbraw/zinc/14/50/62/1042145062.db2.gz ADXUHLIOFUVWTP-IUODEOHRSA-N 1 2 311.187 4.115 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000069519547 1042148819 /nfs/dbraw/zinc/14/88/19/1042148819.db2.gz CNJHKMPLDLOEMO-GFCCVEGCSA-N 1 2 300.333 4.267 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000069519547 1042148822 /nfs/dbraw/zinc/14/88/22/1042148822.db2.gz CNJHKMPLDLOEMO-GFCCVEGCSA-N 1 2 300.333 4.267 20 0 DIADLO CC(C)[N@H+](Cc1noc(-c2ccccc2)n1)Cc1ccccc1 ZINC000051649174 1042156227 /nfs/dbraw/zinc/15/62/27/1042156227.db2.gz HLPPZSXNJFYVAK-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO CC(C)[N@@H+](Cc1noc(-c2ccccc2)n1)Cc1ccccc1 ZINC000051649174 1042156230 /nfs/dbraw/zinc/15/62/30/1042156230.db2.gz HLPPZSXNJFYVAK-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000071090523 1042175371 /nfs/dbraw/zinc/17/53/71/1042175371.db2.gz LMRSDKGYINNQBP-FQEVSTJZSA-N 1 2 322.383 4.109 20 0 DIADLO Cc1ccc(C)n1C1CCN(c2[nH+]ccc3c(N)cccc32)CC1 ZINC000663480842 1042198800 /nfs/dbraw/zinc/19/88/00/1042198800.db2.gz DRGIFXOGBMYJJT-UHFFFAOYSA-N 1 2 320.440 4.077 20 0 DIADLO C[C@@H](N[C@@H](c1ccco1)c1ccccc1)c1cn2c([nH+]1)CCCC2 ZINC000820805972 1042227672 /nfs/dbraw/zinc/22/76/72/1042227672.db2.gz WFDGQRAYLYEKTC-FOIQADDNSA-N 1 2 321.424 4.253 20 0 DIADLO Cc1cnc(C[NH2+][C@H](Cc2ccccc2C)c2ccco2)s1 ZINC000820812260 1042229130 /nfs/dbraw/zinc/22/91/30/1042229130.db2.gz GYRMTRTXIVFSBT-MRXNPFEDSA-N 1 2 312.438 4.427 20 0 DIADLO CCN(CC)[C@@H](C[NH2+]Cc1c(F)cccc1F)c1ccccc1 ZINC000319775983 1042252472 /nfs/dbraw/zinc/25/24/72/1042252472.db2.gz ARGPJPRCLFWGLM-IBGZPJMESA-N 1 2 318.411 4.138 20 0 DIADLO COc1ccc2cc(C[N@H+](C)Cc3nc(C)c(C)o3)ccc2c1 ZINC000049982951 1042259595 /nfs/dbraw/zinc/25/95/95/1042259595.db2.gz FGIUYIRWSNHGKV-UHFFFAOYSA-N 1 2 310.397 4.085 20 0 DIADLO COc1ccc2cc(C[N@@H+](C)Cc3nc(C)c(C)o3)ccc2c1 ZINC000049982951 1042259598 /nfs/dbraw/zinc/25/95/98/1042259598.db2.gz FGIUYIRWSNHGKV-UHFFFAOYSA-N 1 2 310.397 4.085 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cc(N)ccc1Br ZINC001159927805 1042261100 /nfs/dbraw/zinc/26/11/00/1042261100.db2.gz PBDLHOWLDBUKFP-UHFFFAOYSA-N 1 2 318.218 4.356 20 0 DIADLO CC[N@H+](Cc1cc(-c2ccco2)on1)Cc1cccc(F)c1 ZINC000050274859 1042272189 /nfs/dbraw/zinc/27/21/89/1042272189.db2.gz RZBGVRNFEFPUMD-UHFFFAOYSA-N 1 2 300.333 4.096 20 0 DIADLO CC[N@@H+](Cc1cc(-c2ccco2)on1)Cc1cccc(F)c1 ZINC000050274859 1042272191 /nfs/dbraw/zinc/27/21/91/1042272191.db2.gz RZBGVRNFEFPUMD-UHFFFAOYSA-N 1 2 300.333 4.096 20 0 DIADLO COc1cccc(C2([NH2+]Cc3ncc(C(C)(C)C)s3)CC2)c1 ZINC000279112787 1042273145 /nfs/dbraw/zinc/27/31/45/1042273145.db2.gz KODZAMDMZIURLU-UHFFFAOYSA-N 1 2 316.470 4.228 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(C)cnc2Cl)o1 ZINC000893644436 1042277718 /nfs/dbraw/zinc/27/77/18/1042277718.db2.gz ZHEKONRYAGDKSG-HNNXBMFYSA-N 1 2 320.820 4.120 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cc(C)cnc2Cl)o1 ZINC000893644436 1042277720 /nfs/dbraw/zinc/27/77/20/1042277720.db2.gz ZHEKONRYAGDKSG-HNNXBMFYSA-N 1 2 320.820 4.120 20 0 DIADLO CCN(C(=O)[C@H](CC(C)C)n1cc[nH+]c1)c1ccc2[nH]ccc2c1 ZINC000822348564 1042283647 /nfs/dbraw/zinc/28/36/47/1042283647.db2.gz MRDYGXJVVWPXMJ-SFHVURJKSA-N 1 2 324.428 4.005 20 0 DIADLO CC(C)n1cncc1C[N@@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000822443463 1042283963 /nfs/dbraw/zinc/28/39/63/1042283963.db2.gz ULTKSDYBVPMZDC-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1cncc1C[N@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000822443463 1042283968 /nfs/dbraw/zinc/28/39/68/1042283968.db2.gz ULTKSDYBVPMZDC-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ccc(Cl)cc2F)c1OC ZINC001137661431 1042286620 /nfs/dbraw/zinc/28/66/20/1042286620.db2.gz SAHQHDPKIJHGLB-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ccc(Cl)cc2F)c1OC ZINC001137661431 1042286623 /nfs/dbraw/zinc/28/66/23/1042286623.db2.gz SAHQHDPKIJHGLB-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO Cc1c(-c2c(F)ccc(OC(C)C)c2F)ccc2[nH+]ccn21 ZINC001204673305 1042293712 /nfs/dbraw/zinc/29/37/12/1042293712.db2.gz AFXYVHZJXHPENO-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO C[C@@H]1C[N@H+](CC[C@@H]2CC2(Cl)Cl)C[C@H](c2ccsc2)O1 ZINC000822686092 1042297866 /nfs/dbraw/zinc/29/78/66/1042297866.db2.gz OCNCMXAOYLRVHS-RAIGVLPGSA-N 1 2 320.285 4.094 20 0 DIADLO C[C@@H]1C[N@@H+](CC[C@@H]2CC2(Cl)Cl)C[C@H](c2ccsc2)O1 ZINC000822686092 1042297873 /nfs/dbraw/zinc/29/78/73/1042297873.db2.gz OCNCMXAOYLRVHS-RAIGVLPGSA-N 1 2 320.285 4.094 20 0 DIADLO COc1ccc(C)cc1C[N@H+](C)Cc1nc2ccccc2s1 ZINC000007691751 1042300546 /nfs/dbraw/zinc/30/05/46/1042300546.db2.gz JFNOEPALMYFTRQ-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO COc1ccc(C)cc1C[N@@H+](C)Cc1nc2ccccc2s1 ZINC000007691751 1042300549 /nfs/dbraw/zinc/30/05/49/1042300549.db2.gz JFNOEPALMYFTRQ-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO Fc1ccc([C@H](Nc2ccc(N3CCCC3)[nH+]c2)C2CC2)cc1 ZINC000320046555 1042303153 /nfs/dbraw/zinc/30/31/53/1042303153.db2.gz PMKUNSLAHVGHRL-LJQANCHMSA-N 1 2 311.404 4.384 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)c(C)n1 ZINC000163190281 1042309947 /nfs/dbraw/zinc/30/99/47/1042309947.db2.gz WMZYNLVTLYODPC-AUUYWEPGSA-N 1 2 307.397 4.127 20 0 DIADLO C[C@H](c1nc(-c2ccccc2)no1)[N@H+](C)Cc1cccc(F)c1 ZINC000096966315 1042314391 /nfs/dbraw/zinc/31/43/91/1042314391.db2.gz JHISRCWMRLLNGE-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1nc(-c2ccccc2)no1)[N@@H+](C)Cc1cccc(F)c1 ZINC000096966315 1042314400 /nfs/dbraw/zinc/31/44/00/1042314400.db2.gz JHISRCWMRLLNGE-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2ccnc(Cl)c2F)c1 ZINC000823394911 1042323672 /nfs/dbraw/zinc/32/36/72/1042323672.db2.gz FKLHELYFMFIHFF-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2ccnc(Cl)c2F)c1 ZINC000823394911 1042323677 /nfs/dbraw/zinc/32/36/77/1042323677.db2.gz FKLHELYFMFIHFF-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO CCC[N@H+](Cc1cc(F)ncc1F)[C@@H](C)c1ccccc1OC ZINC000823404127 1042323857 /nfs/dbraw/zinc/32/38/57/1042323857.db2.gz MGIKAUXJTDDBPI-ZDUSSCGKSA-N 1 2 320.383 4.342 20 0 DIADLO CCC[N@@H+](Cc1cc(F)ncc1F)[C@@H](C)c1ccccc1OC ZINC000823404127 1042323862 /nfs/dbraw/zinc/32/38/62/1042323862.db2.gz MGIKAUXJTDDBPI-ZDUSSCGKSA-N 1 2 320.383 4.342 20 0 DIADLO COCC[N@H+](Cc1ccnc(Cl)c1F)[C@@H](C)c1ccccc1 ZINC000823408638 1042325179 /nfs/dbraw/zinc/32/51/79/1042325179.db2.gz OUJSDKQUAWANTJ-ZDUSSCGKSA-N 1 2 322.811 4.084 20 0 DIADLO COCC[N@@H+](Cc1ccnc(Cl)c1F)[C@@H](C)c1ccccc1 ZINC000823408638 1042325186 /nfs/dbraw/zinc/32/51/86/1042325186.db2.gz OUJSDKQUAWANTJ-ZDUSSCGKSA-N 1 2 322.811 4.084 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2F)[N@H+](Cc2cc(F)ncc2F)C1 ZINC000823459441 1042327066 /nfs/dbraw/zinc/32/70/66/1042327066.db2.gz UGPVYCZUNACQQE-BDJLRTHQSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2cc(F)ncc2F)C1 ZINC000823459441 1042327073 /nfs/dbraw/zinc/32/70/73/1042327073.db2.gz UGPVYCZUNACQQE-BDJLRTHQSA-N 1 2 306.331 4.082 20 0 DIADLO Cc1cc(NC(=O)c2ccc(-c3cccs3)nc2C)cc[nH+]1 ZINC000112298314 1042340191 /nfs/dbraw/zinc/34/01/91/1042340191.db2.gz PGUMCFKWYVTLBR-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1csc(-c2ccccn2)n1 ZINC000124368210 1042353671 /nfs/dbraw/zinc/35/36/71/1042353671.db2.gz KJOHXDIQVXCQGE-UHFFFAOYSA-N 1 2 324.453 4.192 20 0 DIADLO Clc1cccc2c(N3CCC(OC4CCC4)CC3)cc[nH+]c12 ZINC000418968304 1042367696 /nfs/dbraw/zinc/36/76/96/1042367696.db2.gz BMBHDOOSWMWBRE-UHFFFAOYSA-N 1 2 316.832 4.426 20 0 DIADLO CC(C)c1cc(N2CCC(OC3CCC3)CC2)nc(C(C)C)[nH+]1 ZINC000418969077 1042367794 /nfs/dbraw/zinc/36/77/94/1042367794.db2.gz DODCZPONOYTCHI-UHFFFAOYSA-N 1 2 317.477 4.261 20 0 DIADLO C[C@H]([NH2+]Cc1csc(Nc2ccccc2)n1)c1ccccn1 ZINC000182193956 1042370981 /nfs/dbraw/zinc/37/09/81/1042370981.db2.gz YZVILAGSUOYRFD-ZDUSSCGKSA-N 1 2 310.426 4.133 20 0 DIADLO Cc1cccc(C)c1NC(=O)C[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000051500155 1042374699 /nfs/dbraw/zinc/37/46/99/1042374699.db2.gz IHQGDILBMMZXKR-HNNXBMFYSA-N 1 2 314.404 4.074 20 0 DIADLO Cc1cccc(C)c1NC(=O)C[N@H+](C)[C@@H](C)c1ccccc1F ZINC000051500155 1042374704 /nfs/dbraw/zinc/37/47/04/1042374704.db2.gz IHQGDILBMMZXKR-HNNXBMFYSA-N 1 2 314.404 4.074 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]C1(c2cccc(Cl)c2)CC1 ZINC000925884451 1042375455 /nfs/dbraw/zinc/37/54/55/1042375455.db2.gz WUDQMWVVCSLLIF-AWEZNQCLSA-N 1 2 302.805 4.293 20 0 DIADLO C[N@H+](CCOC(C)(C)C)Cc1csc(C2CCCCC2)n1 ZINC000676042862 1042380033 /nfs/dbraw/zinc/38/00/33/1042380033.db2.gz FODCKSHJXFZXDU-UHFFFAOYSA-N 1 2 310.507 4.438 20 0 DIADLO C[N@@H+](CCOC(C)(C)C)Cc1csc(C2CCCCC2)n1 ZINC000676042862 1042380038 /nfs/dbraw/zinc/38/00/38/1042380038.db2.gz FODCKSHJXFZXDU-UHFFFAOYSA-N 1 2 310.507 4.438 20 0 DIADLO COc1c(F)cccc1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001143533419 1042390917 /nfs/dbraw/zinc/39/09/17/1042390917.db2.gz ZWHZGGQJQUSAIC-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cccc1C[N@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001143533419 1042390919 /nfs/dbraw/zinc/39/09/19/1042390919.db2.gz ZWHZGGQJQUSAIC-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@]1(F)CCC[N@H+](Cc2cc(OC(F)(F)F)ccc2F)C1 ZINC001143538926 1042392474 /nfs/dbraw/zinc/39/24/74/1042392474.db2.gz WCAHZJIPZLONAO-ZDUSSCGKSA-N 1 2 309.278 4.048 20 0 DIADLO C[C@]1(F)CCC[N@@H+](Cc2cc(OC(F)(F)F)ccc2F)C1 ZINC001143538926 1042392477 /nfs/dbraw/zinc/39/24/77/1042392477.db2.gz WCAHZJIPZLONAO-ZDUSSCGKSA-N 1 2 309.278 4.048 20 0 DIADLO Cc1ncoc1C[NH+](Cc1cccs1)Cc1cccs1 ZINC000893911594 1042395339 /nfs/dbraw/zinc/39/53/39/1042395339.db2.gz PJZXJYUAHKKVPM-UHFFFAOYSA-N 1 2 304.440 4.308 20 0 DIADLO COc1ccnc([C@H](C)[NH2+]Cc2c(Cl)cccc2Cl)c1 ZINC000924860376 1042409061 /nfs/dbraw/zinc/40/90/61/1042409061.db2.gz IQWVQKSFZSEZNV-JTQLQIEISA-N 1 2 311.212 4.248 20 0 DIADLO Cc1noc(C)c1C[N@H+](Cc1ccco1)Cc1cccs1 ZINC000252014964 1042466987 /nfs/dbraw/zinc/46/69/87/1042466987.db2.gz VDHRKLUDHXZHNT-UHFFFAOYSA-N 1 2 302.399 4.148 20 0 DIADLO Cc1noc(C)c1C[N@@H+](Cc1ccco1)Cc1cccs1 ZINC000252014964 1042466990 /nfs/dbraw/zinc/46/69/90/1042466990.db2.gz VDHRKLUDHXZHNT-UHFFFAOYSA-N 1 2 302.399 4.148 20 0 DIADLO O=C(CCC1CCCCC1)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000614343835 1042472525 /nfs/dbraw/zinc/47/25/25/1042472525.db2.gz JPCYRLCMSQVVNB-UHFFFAOYSA-N 1 2 315.392 4.310 20 0 DIADLO CC(C)[N@H+](Cc1cc(-c2cccs2)on1)Cc1ccccn1 ZINC000052218088 1042484861 /nfs/dbraw/zinc/48/48/61/1042484861.db2.gz WDFIBSMIHVTEPS-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)[N@@H+](Cc1cc(-c2cccs2)on1)Cc1ccccn1 ZINC000052218088 1042484862 /nfs/dbraw/zinc/48/48/62/1042484862.db2.gz WDFIBSMIHVTEPS-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CCCCc1ccc([C@@H]([NH2+]Cc2noc(C)n2)C(C)C)cc1 ZINC000120647026 1042501054 /nfs/dbraw/zinc/50/10/54/1042501054.db2.gz PELVZWMWIJFJGU-SFHVURJKSA-N 1 2 301.434 4.208 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2cc(-c3cccs3)on2)c1 ZINC000052893081 1042521141 /nfs/dbraw/zinc/52/11/41/1042521141.db2.gz DOBIVZPLDXXJDQ-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2cc(-c3cccs3)on2)c1 ZINC000052893081 1042521146 /nfs/dbraw/zinc/52/11/46/1042521146.db2.gz DOBIVZPLDXXJDQ-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO CCc1ccc([C@H]2CCC[N@H+](Cc3noc(C(C)C)n3)C2)cc1 ZINC000513371988 1042537333 /nfs/dbraw/zinc/53/73/33/1042537333.db2.gz RPBQAUDLSBLBPB-KRWDZBQOSA-N 1 2 313.445 4.135 20 0 DIADLO CCc1ccc([C@H]2CCC[N@@H+](Cc3noc(C(C)C)n3)C2)cc1 ZINC000513371988 1042537338 /nfs/dbraw/zinc/53/73/38/1042537338.db2.gz RPBQAUDLSBLBPB-KRWDZBQOSA-N 1 2 313.445 4.135 20 0 DIADLO CCC(C)(C)c1ccc(C[N@@H+]2CCOC[C@H]2CC(F)F)cc1 ZINC000513401363 1042539136 /nfs/dbraw/zinc/53/91/36/1042539136.db2.gz LWOHBMLJUKTHAQ-MRXNPFEDSA-N 1 2 311.416 4.230 20 0 DIADLO CCC(C)(C)c1ccc(C[N@H+]2CCOC[C@H]2CC(F)F)cc1 ZINC000513401363 1042539138 /nfs/dbraw/zinc/53/91/38/1042539138.db2.gz LWOHBMLJUKTHAQ-MRXNPFEDSA-N 1 2 311.416 4.230 20 0 DIADLO CC[C@@H](CC1CCCC1)C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000513450512 1042542898 /nfs/dbraw/zinc/54/28/98/1042542898.db2.gz BDMFKIGCIYIUSZ-INIZCTEOSA-N 1 2 311.429 4.417 20 0 DIADLO CCn1ccnc1C[N@H+](Cc1ccccc1F)C1CCCCC1 ZINC000513491484 1042546848 /nfs/dbraw/zinc/54/68/48/1042546848.db2.gz UEMTYIJKUYBZID-UHFFFAOYSA-N 1 2 315.436 4.377 20 0 DIADLO CCn1ccnc1C[N@@H+](Cc1ccccc1F)C1CCCCC1 ZINC000513491484 1042546852 /nfs/dbraw/zinc/54/68/52/1042546852.db2.gz UEMTYIJKUYBZID-UHFFFAOYSA-N 1 2 315.436 4.377 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2csnn2)cc1 ZINC000414310912 1042557219 /nfs/dbraw/zinc/55/72/19/1042557219.db2.gz XKWOERRVAJZCPI-CHWSQXEVSA-N 1 2 305.447 4.129 20 0 DIADLO COc1cccc([C@@H]2C[N@H+](C/C(C)=C\c3ccccc3)CCO2)c1 ZINC000513713152 1042594094 /nfs/dbraw/zinc/59/40/94/1042594094.db2.gz LFEGUBOKOZLKHH-YULVEUEDSA-N 1 2 323.436 4.172 20 0 DIADLO COc1cccc([C@@H]2C[N@@H+](C/C(C)=C\c3ccccc3)CCO2)c1 ZINC000513713152 1042594096 /nfs/dbraw/zinc/59/40/96/1042594096.db2.gz LFEGUBOKOZLKHH-YULVEUEDSA-N 1 2 323.436 4.172 20 0 DIADLO COc1cccc([C@@H]2C[N@H+](C/C(C)=C/c3ccccc3)CCO2)c1 ZINC000513713153 1042594184 /nfs/dbraw/zinc/59/41/84/1042594184.db2.gz LFEGUBOKOZLKHH-ZDJZVTAXSA-N 1 2 323.436 4.172 20 0 DIADLO COc1cccc([C@@H]2C[N@@H+](C/C(C)=C/c3ccccc3)CCO2)c1 ZINC000513713153 1042594186 /nfs/dbraw/zinc/59/41/86/1042594186.db2.gz LFEGUBOKOZLKHH-ZDJZVTAXSA-N 1 2 323.436 4.172 20 0 DIADLO Cc1cc(CNC(=O)N[C@H](c2ccccc2)C2CCC2)cc(C)[nH+]1 ZINC000420788591 1042612909 /nfs/dbraw/zinc/61/29/09/1042612909.db2.gz GIKNCWQVIYGKEB-LJQANCHMSA-N 1 2 323.440 4.039 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+]2CCC[C@H](CC(F)(F)F)C2)n1 ZINC000420956423 1042617512 /nfs/dbraw/zinc/61/75/12/1042617512.db2.gz YEQWPJDNDJFURZ-NWDGAFQWSA-N 1 2 319.371 4.138 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+]2CCC[C@H](CC(F)(F)F)C2)n1 ZINC000420956423 1042617517 /nfs/dbraw/zinc/61/75/17/1042617517.db2.gz YEQWPJDNDJFURZ-NWDGAFQWSA-N 1 2 319.371 4.138 20 0 DIADLO CSc1cccc(C)c1NC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000421086325 1042624919 /nfs/dbraw/zinc/62/49/19/1042624919.db2.gz ASPJFARLBOLDKX-UHFFFAOYSA-N 1 2 315.442 4.050 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3Cl)C2)s1 ZINC000513746132 1042629092 /nfs/dbraw/zinc/62/90/92/1042629092.db2.gz OXGVNVDUUYRYQG-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@H](c3ccccc3Cl)C2)s1 ZINC000513746132 1042629094 /nfs/dbraw/zinc/62/90/94/1042629094.db2.gz OXGVNVDUUYRYQG-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO O=C(Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)[C@@]12C[C@@H]1CCC2 ZINC000421437407 1042638541 /nfs/dbraw/zinc/63/85/41/1042638541.db2.gz SDVPIKCDJGQZNA-YWZLYKJASA-N 1 2 321.424 4.015 20 0 DIADLO Cc1cc(CNC(=O)C2CCC(c3ccccc3)CC2)cc(C)[nH+]1 ZINC000421576055 1042644413 /nfs/dbraw/zinc/64/44/13/1042644413.db2.gz LOORAFQKQPYYOF-UHFFFAOYSA-N 1 2 322.452 4.289 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1ccncc1Cl ZINC000421829944 1042654355 /nfs/dbraw/zinc/65/43/55/1042654355.db2.gz ARQVECPKRWUSPW-GFCCVEGCSA-N 1 2 319.836 4.158 20 0 DIADLO CCc1nc(C[NH2+][C@H](c2ccc(OC)cc2F)C2CC2)cs1 ZINC000421828097 1042654436 /nfs/dbraw/zinc/65/44/36/1042654436.db2.gz BAPKAIJGFGRFQL-KRWDZBQOSA-N 1 2 320.433 4.094 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1OC)c1ccc(C)o1 ZINC000421833282 1042655208 /nfs/dbraw/zinc/65/52/08/1042655208.db2.gz NPIJUFORUUXLAT-WFASDCNBSA-N 1 2 323.820 4.288 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccncc1Cl ZINC000421836450 1042656082 /nfs/dbraw/zinc/65/60/82/1042656082.db2.gz QZAVJXFVAIQGAT-JTQLQIEISA-N 1 2 309.866 4.340 20 0 DIADLO CC[N@H+](Cc1nc(C(C)C)no1)Cc1ccc2ccccc2c1 ZINC000513761508 1042657530 /nfs/dbraw/zinc/65/75/30/1042657530.db2.gz NNKLPOLKUSZCFT-UHFFFAOYSA-N 1 2 309.413 4.368 20 0 DIADLO CC[N@@H+](Cc1nc(C(C)C)no1)Cc1ccc2ccccc2c1 ZINC000513761508 1042657532 /nfs/dbraw/zinc/65/75/32/1042657532.db2.gz NNKLPOLKUSZCFT-UHFFFAOYSA-N 1 2 309.413 4.368 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@@H](C)c2cc(C)ccc2OC)n1 ZINC000271701248 1042666179 /nfs/dbraw/zinc/66/61/79/1042666179.db2.gz STPGXSHOHFJVKF-HNNXBMFYSA-N 1 2 315.461 4.412 20 0 DIADLO Cc1noc(C[NH2+][C@H](CC(C)(C)C)c2ccc(Cl)cc2)n1 ZINC000271751807 1042667040 /nfs/dbraw/zinc/66/70/40/1042667040.db2.gz FWAAKTXCYLJQKT-CQSZACIVSA-N 1 2 307.825 4.299 20 0 DIADLO Cc1noc(C[NH2+][C@@H](c2cccc(Cl)c2)C2CCCC2)n1 ZINC000271841312 1042670015 /nfs/dbraw/zinc/67/00/15/1042670015.db2.gz ZCWSUDVLLZNQFA-MRXNPFEDSA-N 1 2 305.809 4.053 20 0 DIADLO Cc1cc(N2CC3(CCCC3)[C@@H]2c2ccco2)nc(C2CC2)[nH+]1 ZINC000664277427 1042671194 /nfs/dbraw/zinc/67/11/94/1042671194.db2.gz WYEIWNJOOLOQLZ-KRWDZBQOSA-N 1 2 309.413 4.377 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]C2(c3nc(C)cs3)CCC2)c(F)c1 ZINC000271929526 1042672768 /nfs/dbraw/zinc/67/27/68/1042672768.db2.gz DFVFOUZDIXLHCX-GFCCVEGCSA-N 1 2 320.433 4.329 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](c2ccc(F)c(C)c2)C2CC2)n1 ZINC000272041707 1042675667 /nfs/dbraw/zinc/67/56/67/1042675667.db2.gz DMRUUHAHVVPSNO-GOSISDBHSA-N 1 2 317.408 4.101 20 0 DIADLO Cc1ccccc1[C@H]([NH2+]Cc1noc(-c2ccccc2)n1)C1CC1 ZINC000272077480 1042676089 /nfs/dbraw/zinc/67/60/89/1042676089.db2.gz VRLYWOJFHCCQRS-LJQANCHMSA-N 1 2 319.408 4.286 20 0 DIADLO c1sc(Nc2ccccc2)nc1C[N@@H+]1CCc2ccccc2C1 ZINC000058746800 1042677591 /nfs/dbraw/zinc/67/75/91/1042677591.db2.gz ZHMIRYOLGMSNCM-UHFFFAOYSA-N 1 2 321.449 4.445 20 0 DIADLO c1sc(Nc2ccccc2)nc1C[N@H+]1CCc2ccccc2C1 ZINC000058746800 1042677595 /nfs/dbraw/zinc/67/75/95/1042677595.db2.gz ZHMIRYOLGMSNCM-UHFFFAOYSA-N 1 2 321.449 4.445 20 0 DIADLO Cc1cc(CNC(=O)N(C)[C@H]2CCC[C@@H]2C(C)(C)C)cc(C)[nH+]1 ZINC000422215294 1042682232 /nfs/dbraw/zinc/68/22/32/1042682232.db2.gz UEXJDCKUPLAIFF-IRXDYDNUSA-N 1 2 317.477 4.055 20 0 DIADLO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]c2ccc3c(c2)CCN3)cc1 ZINC000423212596 1042699382 /nfs/dbraw/zinc/69/93/82/1042699382.db2.gz IMLZLVFNFPOECS-MJXNMMHHSA-N 1 2 308.425 4.267 20 0 DIADLO CC[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(C(=O)OC)cc1 ZINC000423213307 1042700436 /nfs/dbraw/zinc/70/04/36/1042700436.db2.gz JPYSOYICKDHDPR-KRWDZBQOSA-N 1 2 310.397 4.004 20 0 DIADLO COc1ccc2c(c1)[C@H](Nc1ccc3c(c1)CC[NH2+]3)CCS2 ZINC000423220522 1042701387 /nfs/dbraw/zinc/70/13/87/1042701387.db2.gz VLBQVASMTGAERP-QGZVFWFLSA-N 1 2 312.438 4.312 20 0 DIADLO Cc1cc(F)c(C[NH2+]Cc2ccccc2OC(F)F)c(F)c1 ZINC000424131257 1042727848 /nfs/dbraw/zinc/72/78/48/1042727848.db2.gz IWAPZRPPJOSEIN-UHFFFAOYSA-N 1 2 313.294 4.164 20 0 DIADLO CC[C@@H](C)n1ncc(NCc2c[nH+]cn2C(C)C)c1C1CC1 ZINC000424177649 1042727851 /nfs/dbraw/zinc/72/78/51/1042727851.db2.gz QBYXUYDALHSXHL-CYBMUJFWSA-N 1 2 301.438 4.121 20 0 DIADLO CCc1c(NCc2c[nH+]cn2C(C)C)cnn1C(CC)CC ZINC000424169513 1042728100 /nfs/dbraw/zinc/72/81/00/1042728100.db2.gz ADHPRIPQJULXOA-UHFFFAOYSA-N 1 2 303.454 4.196 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2nccn2CC(C)C)c(Cl)c1 ZINC000424319853 1042733520 /nfs/dbraw/zinc/73/35/20/1042733520.db2.gz SMAVKHPUQRHPAT-ZDUSSCGKSA-N 1 2 321.852 4.052 20 0 DIADLO CC(C)(C)CCCC(=O)N1CC[NH2+][C@H](c2cccc(Cl)c2)C1 ZINC000513997099 1042765381 /nfs/dbraw/zinc/76/53/81/1042765381.db2.gz OMHSSZXSGPJWJO-INIZCTEOSA-N 1 2 322.880 4.029 20 0 DIADLO C[C@@H](CCC1CCCCC1)Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000514693564 1042787761 /nfs/dbraw/zinc/78/77/61/1042787761.db2.gz RBRHGRSMFRBOEV-INIZCTEOSA-N 1 2 312.461 4.487 20 0 DIADLO C[N@H+](Cc1noc(-c2ccccc2)n1)[C@H]1CCCc2ccccc21 ZINC000514849611 1042793801 /nfs/dbraw/zinc/79/38/01/1042793801.db2.gz IIASPPVZOWIMQD-SFHVURJKSA-N 1 2 319.408 4.246 20 0 DIADLO C[N@@H+](Cc1noc(-c2ccccc2)n1)[C@H]1CCCc2ccccc21 ZINC000514849611 1042793807 /nfs/dbraw/zinc/79/38/07/1042793807.db2.gz IIASPPVZOWIMQD-SFHVURJKSA-N 1 2 319.408 4.246 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC[C@@H]([C@@H]3CCCCO3)C2)c1 ZINC000664489378 1042803320 /nfs/dbraw/zinc/80/33/20/1042803320.db2.gz WSHNIFUQRWDCKZ-QAPCUYQASA-N 1 2 314.404 4.159 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCC=C(c4ccccn4)C3)cs2)co1 ZINC000515032686 1042806804 /nfs/dbraw/zinc/80/68/04/1042806804.db2.gz NPSMNAZYLZIQHR-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCC=C(c4ccccn4)C3)cs2)co1 ZINC000515032686 1042806812 /nfs/dbraw/zinc/80/68/12/1042806812.db2.gz NPSMNAZYLZIQHR-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO Cc1ccc([C@@H]2[C@H](C)CCC[N@@H+]2Cc2nc(C(F)F)no2)cc1 ZINC000425414409 1042817912 /nfs/dbraw/zinc/81/79/12/1042817912.db2.gz FXSVROSXFACODB-DOMZBBRYSA-N 1 2 321.371 4.289 20 0 DIADLO Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2Cc2nc(C(F)F)no2)cc1 ZINC000425414409 1042817916 /nfs/dbraw/zinc/81/79/16/1042817916.db2.gz FXSVROSXFACODB-DOMZBBRYSA-N 1 2 321.371 4.289 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(F)F)no1)c1ccc(F)c2ccccc21 ZINC000425458549 1042826331 /nfs/dbraw/zinc/82/63/31/1042826331.db2.gz NBWBIOPJWHYXQN-VIFPVBQESA-N 1 2 321.302 4.150 20 0 DIADLO COc1ccc([C@H]([NH2+]CCF)c2ccccc2Cl)cc1OC ZINC000436307074 1042833577 /nfs/dbraw/zinc/83/35/77/1042833577.db2.gz JRUFGHGRRAVKET-KRWDZBQOSA-N 1 2 323.795 4.006 20 0 DIADLO C[C@H](COCC(F)(F)F)Nc1cc[nH+]c2c(Cl)cccc12 ZINC000516874150 1042857995 /nfs/dbraw/zinc/85/79/95/1042857995.db2.gz NIATZFKCDCZQFR-SECBINFHSA-N 1 2 318.726 4.268 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1cc(F)cc(F)c1OC ZINC001143563305 1042863526 /nfs/dbraw/zinc/86/35/26/1042863526.db2.gz UTFRMEMBNORDDP-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1cc(F)cc(F)c1OC ZINC001143563305 1042863531 /nfs/dbraw/zinc/86/35/31/1042863531.db2.gz UTFRMEMBNORDDP-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO CC(C)c1cccc(C[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000517066773 1042865751 /nfs/dbraw/zinc/86/57/51/1042865751.db2.gz VUILFYNULYICAA-GOSISDBHSA-N 1 2 312.461 4.339 20 0 DIADLO CC[N@H+](C)[C@H](c1nc(CC2(C)CCCC2)no1)c1ccccc1 ZINC000517262164 1042873211 /nfs/dbraw/zinc/87/32/11/1042873211.db2.gz BDRNVOYZNCLLID-KRWDZBQOSA-N 1 2 313.445 4.234 20 0 DIADLO CC[N@@H+](C)[C@H](c1nc(CC2(C)CCCC2)no1)c1ccccc1 ZINC000517262164 1042873217 /nfs/dbraw/zinc/87/32/17/1042873217.db2.gz BDRNVOYZNCLLID-KRWDZBQOSA-N 1 2 313.445 4.234 20 0 DIADLO CC[C@H]1C[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)CCO1 ZINC000517403435 1042879396 /nfs/dbraw/zinc/87/93/96/1042879396.db2.gz QZEQCXQZYLYNBX-AWEZNQCLSA-N 1 2 322.861 4.074 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)CCO1 ZINC000517403435 1042879399 /nfs/dbraw/zinc/87/93/99/1042879399.db2.gz QZEQCXQZYLYNBX-AWEZNQCLSA-N 1 2 322.861 4.074 20 0 DIADLO CCCc1noc(C[N@H+](CC)Cc2ccc3ccccc3c2)n1 ZINC000517853901 1042900943 /nfs/dbraw/zinc/90/09/43/1042900943.db2.gz PUEQOZDMRXVFSN-UHFFFAOYSA-N 1 2 309.413 4.197 20 0 DIADLO CCCc1noc(C[N@@H+](CC)Cc2ccc3ccccc3c2)n1 ZINC000517853901 1042900946 /nfs/dbraw/zinc/90/09/46/1042900946.db2.gz PUEQOZDMRXVFSN-UHFFFAOYSA-N 1 2 309.413 4.197 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)cs1 ZINC000517863138 1042901433 /nfs/dbraw/zinc/90/14/33/1042901433.db2.gz VMIRQHWSLBPBGB-PBHICJAKSA-N 1 2 311.454 4.230 20 0 DIADLO CC(C)Oc1cccc([C@@H]([NH2+]C2CCSCC2)C(F)F)c1 ZINC000578337244 1042904805 /nfs/dbraw/zinc/90/48/05/1042904805.db2.gz AOIZQLOKWHRFCY-OAHLLOKOSA-N 1 2 315.429 4.265 20 0 DIADLO Fc1cncc(CNc2[nH+]c3ccccc3n2C2CCCCC2)c1 ZINC000438851646 1042910061 /nfs/dbraw/zinc/91/00/61/1042910061.db2.gz ZBMWERNLSFJZNA-UHFFFAOYSA-N 1 2 324.403 4.688 20 0 DIADLO Cc1c(Cl)c(C[N@H+]2C[C@H](C)OC(C)(C)C2)nc2ccccc12 ZINC000518898596 1042924481 /nfs/dbraw/zinc/92/44/81/1042924481.db2.gz PGMRHKJCUBAYFE-LBPRGKRZSA-N 1 2 318.848 4.196 20 0 DIADLO Cc1c(Cl)c(C[N@@H+]2C[C@H](C)OC(C)(C)C2)nc2ccccc12 ZINC000518898596 1042924486 /nfs/dbraw/zinc/92/44/86/1042924486.db2.gz PGMRHKJCUBAYFE-LBPRGKRZSA-N 1 2 318.848 4.196 20 0 DIADLO Cc1cc(C)c(NC(=O)c2csc3c2CC[C@@H](C)C3)c(C)[nH+]1 ZINC000518977581 1042927839 /nfs/dbraw/zinc/92/78/39/1042927839.db2.gz DIMHMRFOFKHUNJ-SNVBAGLBSA-N 1 2 314.454 4.445 20 0 DIADLO C[C@H](CC(=O)N1CCC[C@@H]1CCC1CCCCC1)n1cc[nH+]c1 ZINC000519161748 1042936011 /nfs/dbraw/zinc/93/60/11/1042936011.db2.gz MUAHNLBNEVRTDU-SJLPKXTDSA-N 1 2 317.477 4.186 20 0 DIADLO COc1cc(C)cc(NCc2c[nH+]c(C)n2-c2ccccc2)c1C ZINC000426554852 1042937416 /nfs/dbraw/zinc/93/74/16/1042937416.db2.gz XKOJQIXLJLQRQG-UHFFFAOYSA-N 1 2 321.424 4.418 20 0 DIADLO Fc1cc(C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)ccc1C(F)F ZINC000894395680 1042941520 /nfs/dbraw/zinc/94/15/20/1042941520.db2.gz AMSZAXNBNHIRFC-OAHLLOKOSA-N 1 2 309.335 4.214 20 0 DIADLO Fc1cc(C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)ccc1C(F)F ZINC000894395680 1042941523 /nfs/dbraw/zinc/94/15/23/1042941523.db2.gz AMSZAXNBNHIRFC-OAHLLOKOSA-N 1 2 309.335 4.214 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2cc(C(C)C)no2)c2cccnc2)cc1 ZINC000925067301 1042942923 /nfs/dbraw/zinc/94/29/23/1042942923.db2.gz NNCATCJZWOACAK-HXUWFJFHSA-N 1 2 321.424 4.381 20 0 DIADLO Cc1ccc(-c2ccc(C[N@@H+]3CCOC[C@H]3CC(F)F)o2)cc1 ZINC000519477571 1042950612 /nfs/dbraw/zinc/95/06/12/1042950612.db2.gz WSZZLISDFKMPBM-OAHLLOKOSA-N 1 2 321.367 4.111 20 0 DIADLO Cc1ccc(-c2ccc(C[N@H+]3CCOC[C@H]3CC(F)F)o2)cc1 ZINC000519477571 1042950618 /nfs/dbraw/zinc/95/06/18/1042950618.db2.gz WSZZLISDFKMPBM-OAHLLOKOSA-N 1 2 321.367 4.111 20 0 DIADLO CC1(C)C[N@H+](Cc2ccccc2OC2CC2)[C@@H]1c1cccnc1 ZINC000664821642 1042962561 /nfs/dbraw/zinc/96/25/61/1042962561.db2.gz TYLGVEZZRYIUIF-LJQANCHMSA-N 1 2 308.425 4.206 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccccc2OC2CC2)[C@@H]1c1cccnc1 ZINC000664821642 1042962569 /nfs/dbraw/zinc/96/25/69/1042962569.db2.gz TYLGVEZZRYIUIF-LJQANCHMSA-N 1 2 308.425 4.206 20 0 DIADLO Cc1nnc(C[NH2+]Cc2ccc(C3CCCCC3)cc2)s1 ZINC000894600962 1042969673 /nfs/dbraw/zinc/96/96/73/1042969673.db2.gz HFZOTSZOCYCNIR-UHFFFAOYSA-N 1 2 301.459 4.184 20 0 DIADLO FC(F)SCc1ccc(C[NH+]2CC(CC(F)(F)F)C2)o1 ZINC000839137686 1042992529 /nfs/dbraw/zinc/99/25/29/1042992529.db2.gz HFCGUMWNSSOZKJ-UHFFFAOYSA-N 1 2 315.307 4.120 20 0 DIADLO CCC[C@@](C)(CC)c1nc(Cc2cn3cccc(C)c3[nH+]2)no1 ZINC000519718981 1042999233 /nfs/dbraw/zinc/99/92/33/1042999233.db2.gz DGNYFRAMNXNAMF-GOSISDBHSA-N 1 2 312.417 4.084 20 0 DIADLO CCC[N@H+](Cc1nc(C(C)C)no1)[C@H](C)c1ccccc1OC ZINC000519907297 1043008129 /nfs/dbraw/zinc/00/81/29/1043008129.db2.gz UEAFWJKTHGEKGC-CQSZACIVSA-N 1 2 317.433 4.175 20 0 DIADLO CCC[N@@H+](Cc1nc(C(C)C)no1)[C@H](C)c1ccccc1OC ZINC000519907297 1043008134 /nfs/dbraw/zinc/00/81/34/1043008134.db2.gz UEAFWJKTHGEKGC-CQSZACIVSA-N 1 2 317.433 4.175 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](C)CC(=O)OC(C)(C)C ZINC000519903346 1043008594 /nfs/dbraw/zinc/00/85/94/1043008594.db2.gz XSGNGUMUVDMGFL-LLVKDONJSA-N 1 2 317.351 4.040 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CC(=O)OC(C)(C)C ZINC000519903346 1043008599 /nfs/dbraw/zinc/00/85/99/1043008599.db2.gz XSGNGUMUVDMGFL-LLVKDONJSA-N 1 2 317.351 4.040 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000519957985 1043010866 /nfs/dbraw/zinc/01/08/66/1043010866.db2.gz OQXVDGLFKKRHBK-NEPJUHHUSA-N 1 2 312.251 4.009 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000519957985 1043010871 /nfs/dbraw/zinc/01/08/71/1043010871.db2.gz OQXVDGLFKKRHBK-NEPJUHHUSA-N 1 2 312.251 4.009 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@@H+]1C[C@H](C)OC(C)(C)C1 ZINC000519957987 1043011137 /nfs/dbraw/zinc/01/11/37/1043011137.db2.gz OQXVDGLFKKRHBK-RYUDHWBXSA-N 1 2 312.251 4.009 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@H+]1C[C@H](C)OC(C)(C)C1 ZINC000519957987 1043011142 /nfs/dbraw/zinc/01/11/42/1043011142.db2.gz OQXVDGLFKKRHBK-RYUDHWBXSA-N 1 2 312.251 4.009 20 0 DIADLO Cc1nc(C(C)C)sc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000519963596 1043011932 /nfs/dbraw/zinc/01/19/32/1043011932.db2.gz FQWXMXHJHADREY-UHFFFAOYSA-N 1 2 303.431 4.147 20 0 DIADLO CCOC(=O)c1coc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)c1 ZINC000474096209 1043014971 /nfs/dbraw/zinc/01/49/71/1043014971.db2.gz IFVUJDPFQKFIED-LBPRGKRZSA-N 1 2 321.804 4.303 20 0 DIADLO CCOC(=O)c1coc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)c1 ZINC000474096209 1043014976 /nfs/dbraw/zinc/01/49/76/1043014976.db2.gz IFVUJDPFQKFIED-LBPRGKRZSA-N 1 2 321.804 4.303 20 0 DIADLO Cc1nc(C[NH2+][C@@H](COc2ccccc2)c2ccccc2)cs1 ZINC000520228661 1043025872 /nfs/dbraw/zinc/02/58/72/1043025872.db2.gz CRRATVIPBIJBMD-IBGZPJMESA-N 1 2 324.449 4.361 20 0 DIADLO Cc1nc(C[NH2+][C@H](COc2ccccc2)c2ccccc2)cs1 ZINC000520228662 1043025893 /nfs/dbraw/zinc/02/58/93/1043025893.db2.gz CRRATVIPBIJBMD-LJQANCHMSA-N 1 2 324.449 4.361 20 0 DIADLO Cc1ccc(F)c(NC(=O)[C@H](c2cccc(Cl)c2)[NH+](C)C)c1 ZINC000520313710 1043033890 /nfs/dbraw/zinc/03/38/90/1043033890.db2.gz JUPIBKAVXFEAKO-INIZCTEOSA-N 1 2 320.795 4.029 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2cn3ccsc3n2)C1 ZINC000441329022 1043037821 /nfs/dbraw/zinc/03/78/21/1043037821.db2.gz DODCSTJETVXQKY-WBMJQRKESA-N 1 2 315.417 4.118 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2cn3ccsc3n2)C1 ZINC000441329022 1043037825 /nfs/dbraw/zinc/03/78/25/1043037825.db2.gz DODCSTJETVXQKY-WBMJQRKESA-N 1 2 315.417 4.118 20 0 DIADLO Cc1ccc(C(C)(C)C[N@H+](C)Cc2noc(C(C)(C)C)n2)cc1 ZINC000441364604 1043039979 /nfs/dbraw/zinc/03/99/79/1043039979.db2.gz MPBOAXHODXOGNW-UHFFFAOYSA-N 1 2 315.461 4.085 20 0 DIADLO Cc1ccc(C(C)(C)C[N@@H+](C)Cc2noc(C(C)(C)C)n2)cc1 ZINC000441364604 1043039983 /nfs/dbraw/zinc/03/99/83/1043039983.db2.gz MPBOAXHODXOGNW-UHFFFAOYSA-N 1 2 315.461 4.085 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccccc1)c1nc(Cc2ccccc2)no1 ZINC000173791206 1043053118 /nfs/dbraw/zinc/05/31/18/1043053118.db2.gz IKAAQLIPMBDMEL-HUUCEWRRSA-N 1 2 307.397 4.072 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cc2ccccc2nc1Cl ZINC000015417189 1043053674 /nfs/dbraw/zinc/05/36/74/1043053674.db2.gz GITIIILQVMGYNH-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cc2ccccc2nc1Cl ZINC000015417189 1043053687 /nfs/dbraw/zinc/05/36/87/1043053687.db2.gz GITIIILQVMGYNH-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO Cc1cc(F)ccc1C[NH2+][C@H](C)c1nc(C2CCCCC2)no1 ZINC000173867164 1043055520 /nfs/dbraw/zinc/05/55/20/1043055520.db2.gz KSUUCDNJIFOAKR-CYBMUJFWSA-N 1 2 317.408 4.416 20 0 DIADLO FC(F)(F)C1CC[NH+](Cc2coc(-c3cccs3)n2)CC1 ZINC000174185204 1043060532 /nfs/dbraw/zinc/06/05/32/1043060532.db2.gz LMLHENKGVQZKIN-UHFFFAOYSA-N 1 2 316.348 4.177 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+]Cc2cnc(C(C)(C)C)s2)o1 ZINC000174478230 1043066704 /nfs/dbraw/zinc/06/67/04/1043066704.db2.gz VTEGXLGEKOZZGU-CQSZACIVSA-N 1 2 322.474 4.073 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)[C@@H]2CCC(C)=C(C)C2)n1 ZINC000843770813 1043072922 /nfs/dbraw/zinc/07/29/22/1043072922.db2.gz AECBHYZJXKAPSD-CQSZACIVSA-N 1 2 321.490 4.060 20 0 DIADLO CC[N@H+](Cc1csc([C@@H](C)OC)n1)Cc1ccccc1C ZINC000175058161 1043075517 /nfs/dbraw/zinc/07/55/17/1043075517.db2.gz CLUQQMWROSQDOZ-CQSZACIVSA-N 1 2 304.459 4.181 20 0 DIADLO CC[N@@H+](Cc1csc([C@@H](C)OC)n1)Cc1ccccc1C ZINC000175058161 1043075527 /nfs/dbraw/zinc/07/55/27/1043075527.db2.gz CLUQQMWROSQDOZ-CQSZACIVSA-N 1 2 304.459 4.181 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2coc(C3CC3)n2)c1C ZINC000865280639 1043076602 /nfs/dbraw/zinc/07/66/02/1043076602.db2.gz LPNPFXHQEVPSKR-UHFFFAOYSA-N 1 2 304.415 4.006 20 0 DIADLO CC(C)(C)c1cn(Cc2nc3cc(C(F)(F)F)ccc3o2)c[nH+]1 ZINC000865376218 1043088145 /nfs/dbraw/zinc/08/81/45/1043088145.db2.gz DVQLUSFPMXAGAJ-UHFFFAOYSA-N 1 2 323.318 4.389 20 0 DIADLO C[C@@H]([NH2+]Cc1cn(C2CC2)cn1)c1ccc(Cl)cc1Cl ZINC000865400396 1043090992 /nfs/dbraw/zinc/09/09/92/1043090992.db2.gz BQZXATMIRDQBCB-SNVBAGLBSA-N 1 2 310.228 4.376 20 0 DIADLO Cc1csc2nc(C)nc(Oc3cccc(-n4cc[nH+]c4)c3)c12 ZINC000125132280 1043091373 /nfs/dbraw/zinc/09/13/73/1043091373.db2.gz VYHGXDNZBCPNRF-UHFFFAOYSA-N 1 2 322.393 4.286 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2c(Cl)cncc2Cl)o1 ZINC000865419841 1043095079 /nfs/dbraw/zinc/09/50/79/1043095079.db2.gz ZNQUVRHBMJQCBK-GXSJLCMTSA-N 1 2 311.212 4.395 20 0 DIADLO Fc1ccc(-c2nc(C[NH+]3CC(CC(F)F)C3)cs2)cc1 ZINC000425356784 1043103003 /nfs/dbraw/zinc/10/30/03/1043103003.db2.gz OBSKQNOUCAKXKD-UHFFFAOYSA-N 1 2 312.360 4.036 20 0 DIADLO Cc1c(Cl)cccc1C[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000865481552 1043103102 /nfs/dbraw/zinc/10/31/02/1043103102.db2.gz HQORLQBFGACCCK-NSHDSACASA-N 1 2 307.825 4.180 20 0 DIADLO Cc1c(Cl)cccc1C[NH2+]Cc1nnc(C(C)(C)C)s1 ZINC000865490994 1043105411 /nfs/dbraw/zinc/10/54/11/1043105411.db2.gz JCXNLXCFTWXZIA-UHFFFAOYSA-N 1 2 309.866 4.087 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2ccccc2Cl)cs1 ZINC000177637118 1043110274 /nfs/dbraw/zinc/11/02/74/1043110274.db2.gz LYDRYOCQOJOHKL-WDEREUQCSA-N 1 2 310.850 4.355 20 0 DIADLO CC(C)(C)Oc1cccc(C[NH2+]Cc2noc3c2CCCC3)c1 ZINC000865570148 1043115214 /nfs/dbraw/zinc/11/52/14/1043115214.db2.gz XXHMRLBETWCQQY-UHFFFAOYSA-N 1 2 314.429 4.021 20 0 DIADLO F[C@@H]1CCCC[C@@H]1[NH2+]Cc1csc(COc2ccccc2)n1 ZINC000865698944 1043124817 /nfs/dbraw/zinc/12/48/17/1043124817.db2.gz JAXAXANZRFQZAH-CVEARBPZSA-N 1 2 320.433 4.092 20 0 DIADLO COc1ccc(Cl)cc1[C@@H](CC(C)C)[NH2+]Cc1ccon1 ZINC000178262535 1043125790 /nfs/dbraw/zinc/12/57/90/1043125790.db2.gz FFSKGASTDDLHIK-OAHLLOKOSA-N 1 2 308.809 4.214 20 0 DIADLO Cc1cccc(COc2ccc([C@@H](C)[NH2+]Cc3ccon3)cc2)c1 ZINC000178263792 1043126146 /nfs/dbraw/zinc/12/61/46/1043126146.db2.gz XDFKZKKOMPMGCX-MRXNPFEDSA-N 1 2 322.408 4.413 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2cccnc2Br)o1 ZINC000865814378 1043135038 /nfs/dbraw/zinc/13/50/38/1043135038.db2.gz DZRPGLHOSUVRFL-UHFFFAOYSA-N 1 2 323.234 4.024 20 0 DIADLO CN(C)c1cccc(C[N@H+](C)Cc2nc(C(C)(C)C)cs2)c1 ZINC000536348008 1043135734 /nfs/dbraw/zinc/13/57/34/1043135734.db2.gz LDFJKXPBEHMDFH-UHFFFAOYSA-N 1 2 317.502 4.139 20 0 DIADLO CN(C)c1cccc(C[N@@H+](C)Cc2nc(C(C)(C)C)cs2)c1 ZINC000536348008 1043135740 /nfs/dbraw/zinc/13/57/40/1043135740.db2.gz LDFJKXPBEHMDFH-UHFFFAOYSA-N 1 2 317.502 4.139 20 0 DIADLO Cc1noc(C)c1C[NH2+]Cc1cc(Cl)cc(Cl)c1F ZINC000865818447 1043136949 /nfs/dbraw/zinc/13/69/49/1043136949.db2.gz WVUBNZUYBGUHHS-UHFFFAOYSA-N 1 2 303.164 4.027 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@H](C)c1ccc(Cl)nc1)c1ccco1 ZINC000179117596 1043141023 /nfs/dbraw/zinc/14/10/23/1043141023.db2.gz UKDUWKZKMDTGAN-UKRRQHHQSA-N 1 2 322.836 4.393 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC[C@H](OC3CCC3)CC2)c1 ZINC000866145172 1043155644 /nfs/dbraw/zinc/15/56/44/1043155644.db2.gz HMGBXPLTQVFSLI-KRWDZBQOSA-N 1 2 314.404 4.302 20 0 DIADLO Cc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nc(C(C)C)no1 ZINC000183241691 1043159165 /nfs/dbraw/zinc/15/91/65/1043159165.db2.gz HBPUREFKPPTWGQ-INIZCTEOSA-N 1 2 301.434 4.378 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2nc3ccccc3s2)C2CC2)n1 ZINC000183501299 1043167035 /nfs/dbraw/zinc/16/70/35/1043167035.db2.gz LMOPQGSFDBPQTE-HNNXBMFYSA-N 1 2 315.467 4.302 20 0 DIADLO O[C@@H](c1ccccc1)C1(CNc2cc(C(F)(F)F)cc[nH+]2)CC1 ZINC000129891661 1043168287 /nfs/dbraw/zinc/16/82/87/1043168287.db2.gz XHQSBCCHRVBLHF-HNNXBMFYSA-N 1 2 322.330 4.026 20 0 DIADLO Cc1cccnc1[C@H]([NH2+][C@H]1c2ccccc2OC[C@H]1F)C(C)C ZINC000866267461 1043169577 /nfs/dbraw/zinc/16/95/77/1043169577.db2.gz IWJSQAZWQZYPOJ-SUMDDJOVSA-N 1 2 314.404 4.149 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCCN1c1cccc[nH+]1 ZINC000163290821 1043173829 /nfs/dbraw/zinc/17/38/29/1043173829.db2.gz HPWXRLMZUVVOTK-CQSZACIVSA-N 1 2 318.852 4.237 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1nc(C)cs1 ZINC000184344156 1043182674 /nfs/dbraw/zinc/18/26/74/1043182674.db2.gz QHUFFQKBCWEOIX-LLVKDONJSA-N 1 2 309.504 4.446 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@@H](C)c2cc3ccccc3s2)n1 ZINC000184358576 1043182834 /nfs/dbraw/zinc/18/28/34/1043182834.db2.gz FBSCZMXCSBEULI-WDEREUQCSA-N 1 2 301.415 4.259 20 0 DIADLO FC(F)c1ccc(C[NH2+][C@H]2c3ccccc3OC[C@H]2F)cc1 ZINC000866341850 1043183910 /nfs/dbraw/zinc/18/39/10/1043183910.db2.gz SEBLNRKXEWHEMF-ZBFHGGJFSA-N 1 2 307.315 4.186 20 0 DIADLO CCCNc1ccc(C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)cc1 ZINC000866348054 1043185587 /nfs/dbraw/zinc/18/55/87/1043185587.db2.gz MHCFLOVUTNXZEW-PKOBYXMFSA-N 1 2 314.404 4.070 20 0 DIADLO Cc1cc2cc(C[NH2+][C@H]3c4ccccc4OC[C@@H]3F)ccc2[nH]1 ZINC000866356509 1043187955 /nfs/dbraw/zinc/18/79/55/1043187955.db2.gz MICYCKZGCYJLLE-LPHOPBHVSA-N 1 2 310.372 4.038 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2ccn(C(C)C)n2)c2cccnc2)cc1 ZINC000925105251 1043190362 /nfs/dbraw/zinc/19/03/62/1043190362.db2.gz BTMHACZTOIMVRH-HXUWFJFHSA-N 1 2 320.440 4.047 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2cc3c(ccnc3Cl)o2)c1 ZINC000866385618 1043194781 /nfs/dbraw/zinc/19/47/81/1043194781.db2.gz YBYNKSRWISBOKM-SNVBAGLBSA-N 1 2 317.776 4.196 20 0 DIADLO Cc1cc(C[NH2+]C(c2ccccc2C)c2ccccc2C)no1 ZINC000185857183 1043209351 /nfs/dbraw/zinc/20/93/51/1043209351.db2.gz AUQRIBIBVOCPKI-UHFFFAOYSA-N 1 2 306.409 4.479 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc(C4CC4)cc3)CCCCC2)no1 ZINC000520527769 1043210744 /nfs/dbraw/zinc/21/07/44/1043210744.db2.gz XGOZUGWDYBKBKG-UHFFFAOYSA-N 1 2 311.429 4.205 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccccc2)Cc2ccccc2C)o1 ZINC000441540745 1043211096 /nfs/dbraw/zinc/21/10/96/1043211096.db2.gz LKEWRNGUJVNVQO-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccccc2)Cc2ccccc2C)o1 ZINC000441540745 1043211108 /nfs/dbraw/zinc/21/11/08/1043211108.db2.gz LKEWRNGUJVNVQO-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Clc1cccc(N(CCCn2cc[nH+]c2)Cc2ccco2)c1 ZINC000343301341 1043213869 /nfs/dbraw/zinc/21/38/69/1043213869.db2.gz JLMWPXMJCKONFN-UHFFFAOYSA-N 1 2 315.804 4.226 20 0 DIADLO COc1ccsc1[C@@H](C)[NH2+][C@@H](COCC(C)C)c1ccco1 ZINC000186145089 1043214061 /nfs/dbraw/zinc/21/40/61/1043214061.db2.gz KZUIQHIOZRKUKG-KGLIPLIRSA-N 1 2 323.458 4.414 20 0 DIADLO CCc1noc(CC)c1C[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000186379832 1043223451 /nfs/dbraw/zinc/22/34/51/1043223451.db2.gz JGISBTBRPSGQDO-LLVKDONJSA-N 1 2 307.463 4.230 20 0 DIADLO Cc1nccnc1[C@@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1F ZINC000866577139 1043225849 /nfs/dbraw/zinc/22/58/49/1043225849.db2.gz KJPUARXOWQBFIU-SECBINFHSA-N 1 2 314.191 4.082 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2cc(Cl)cc(Cl)c2F)nn1C ZINC000866578847 1043229063 /nfs/dbraw/zinc/22/90/63/1043229063.db2.gz UAUKPBFUVQTSDN-SECBINFHSA-N 1 2 316.207 4.025 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1cc(F)cc(F)c1 ZINC000186819937 1043234495 /nfs/dbraw/zinc/23/44/95/1043234495.db2.gz MLDVZECGBRHUEG-LLVKDONJSA-N 1 2 324.371 4.119 20 0 DIADLO Cc1cc(F)cc(C[N@H+](Cc2cccnc2)Cc2ccccn2)c1 ZINC001143586716 1043237641 /nfs/dbraw/zinc/23/76/41/1043237641.db2.gz UBBQDICGJWBRQX-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cc(F)cc(C[N@@H+](Cc2cccnc2)Cc2ccccn2)c1 ZINC001143586716 1043237652 /nfs/dbraw/zinc/23/76/52/1043237652.db2.gz UBBQDICGJWBRQX-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO FC(F)(F)c1csc(C[NH2+]Cc2sccc2Cl)n1 ZINC000193120911 1043280062 /nfs/dbraw/zinc/28/00/62/1043280062.db2.gz NFGJUSAULOMDOB-UHFFFAOYSA-N 1 2 312.769 4.167 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@H](C)c1nc2c(s1)CCCC2 ZINC000187597527 1043246541 /nfs/dbraw/zinc/24/65/41/1043246541.db2.gz WBOIULMRNAYGTC-LLVKDONJSA-N 1 2 320.433 4.020 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2nc(C(C)(C)C)co2)CC2CC2)cn1 ZINC000895105311 1043257945 /nfs/dbraw/zinc/25/79/45/1043257945.db2.gz RKAMFOXCEFQLMJ-UHFFFAOYSA-N 1 2 313.445 4.088 20 0 DIADLO Cc1ccc(C[N@H+](Cc2nc(C(C)(C)C)co2)CC2CC2)cn1 ZINC000895105311 1043257956 /nfs/dbraw/zinc/25/79/56/1043257956.db2.gz RKAMFOXCEFQLMJ-UHFFFAOYSA-N 1 2 313.445 4.088 20 0 DIADLO CC(C)n1cc(CNc2ccc([N@@H+]3C[C@H]4CC[C@@H]3C4)cc2)cn1 ZINC000192215627 1043266793 /nfs/dbraw/zinc/26/67/93/1043266793.db2.gz PLXHTGUXSJLDHL-HNAYVOBHSA-N 1 2 310.445 4.065 20 0 DIADLO CC(C)n1cc(CNc2ccc([N@H+]3C[C@H]4CC[C@@H]3C4)cc2)cn1 ZINC000192215627 1043266809 /nfs/dbraw/zinc/26/68/09/1043266809.db2.gz PLXHTGUXSJLDHL-HNAYVOBHSA-N 1 2 310.445 4.065 20 0 DIADLO C[C@H](Nc1ccc([NH+]2CCCC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000320119767 1043286344 /nfs/dbraw/zinc/28/63/44/1043286344.db2.gz XWZGCKKKRWILPX-AWEZNQCLSA-N 1 2 311.385 4.368 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](c2nc(C3CC3)no2)C(C)C)cc1Cl ZINC000195443109 1043299766 /nfs/dbraw/zinc/29/97/66/1043299766.db2.gz DIGHJAGXTDGOFJ-OAHLLOKOSA-N 1 2 319.836 4.396 20 0 DIADLO Cc1ccccc1[C@H](C)[NH2+][C@H](c1nccn1C)c1ccc(F)cc1 ZINC000268784638 1043331626 /nfs/dbraw/zinc/33/16/26/1043331626.db2.gz VDOFGYZUASRERV-KXBFYZLASA-N 1 2 323.415 4.308 20 0 DIADLO Cc1c(CNc2ccc([NH+]3CCCC3)cc2)cccc1[N+](=O)[O-] ZINC000320846136 1043333894 /nfs/dbraw/zinc/33/38/94/1043333894.db2.gz GXKVIHKQEKNTCU-UHFFFAOYSA-N 1 2 311.385 4.116 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H]2CCOc3c(Cl)cccc32)cs1 ZINC000268870935 1043338284 /nfs/dbraw/zinc/33/82/84/1043338284.db2.gz GDBIUOXAIHGYNI-TVQRCGJNSA-N 1 2 308.834 4.279 20 0 DIADLO CCC[C@H]([NH2+]Cc1nc(C)no1)c1cccc(C(F)(F)F)c1 ZINC000268948947 1043344210 /nfs/dbraw/zinc/34/42/10/1043344210.db2.gz XAWRARGBQKLXIA-ZDUSSCGKSA-N 1 2 313.323 4.028 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000795151860 1043360304 /nfs/dbraw/zinc/36/03/04/1043360304.db2.gz LSTXJJZXPKZLBC-AWEZNQCLSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000795151860 1043360311 /nfs/dbraw/zinc/36/03/11/1043360311.db2.gz LSTXJJZXPKZLBC-AWEZNQCLSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccccc2OC(F)(F)F)cs1 ZINC000269433184 1043365414 /nfs/dbraw/zinc/36/54/14/1043365414.db2.gz QGWPVILQFNEHQV-VIFPVBQESA-N 1 2 316.348 4.201 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccccc2OCC(C)C)cs1 ZINC000269400415 1043365501 /nfs/dbraw/zinc/36/55/01/1043365501.db2.gz GBAIGJUANUFOMN-CYBMUJFWSA-N 1 2 304.459 4.337 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1ncc(C(F)(F)F)s1)CC2 ZINC000521169796 1043368225 /nfs/dbraw/zinc/36/82/25/1043368225.db2.gz CDQIZMMEPWUEOI-NSHDSACASA-N 1 2 316.323 4.078 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](C)Cc1nccs1 ZINC000269637024 1043370742 /nfs/dbraw/zinc/37/07/42/1043370742.db2.gz JAMHSGNUVZKAEO-JTQLQIEISA-N 1 2 300.349 4.355 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)Cc1nccs1 ZINC000269637024 1043370754 /nfs/dbraw/zinc/37/07/54/1043370754.db2.gz JAMHSGNUVZKAEO-JTQLQIEISA-N 1 2 300.349 4.355 20 0 DIADLO CC(C)[N@@H+](Cc1coc(-c2cccc(F)c2)n1)Cc1ccco1 ZINC000521198446 1043374661 /nfs/dbraw/zinc/37/46/61/1043374661.db2.gz NGEUHWUQZZTIRD-UHFFFAOYSA-N 1 2 314.360 4.484 20 0 DIADLO CC(C)[N@H+](Cc1coc(-c2cccc(F)c2)n1)Cc1ccco1 ZINC000521198446 1043374665 /nfs/dbraw/zinc/37/46/65/1043374665.db2.gz NGEUHWUQZZTIRD-UHFFFAOYSA-N 1 2 314.360 4.484 20 0 DIADLO Cc1cccc([C@H]2CCCN2C(=O)Nc2c(C)cc(C)[nH+]c2C)n1 ZINC000521200146 1043375209 /nfs/dbraw/zinc/37/52/09/1043375209.db2.gz NLPUQAMKAVYPTR-QGZVFWFLSA-N 1 2 324.428 4.079 20 0 DIADLO Cc1[nH+]ccn1CCCCSc1nc2ccc(Cl)cc2[nH]1 ZINC000442412142 1043381626 /nfs/dbraw/zinc/38/16/26/1043381626.db2.gz QXWTZLRTEMPTTI-UHFFFAOYSA-N 1 2 320.849 4.294 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]Cc2c(C)oc3ccccc32)cs1 ZINC000270271318 1043383457 /nfs/dbraw/zinc/38/34/57/1043383457.db2.gz ROSSFARDMUECKL-LBPRGKRZSA-N 1 2 316.426 4.195 20 0 DIADLO O=C(CCC1CCC1)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000270438196 1043385853 /nfs/dbraw/zinc/38/58/53/1043385853.db2.gz JIZFBJRYPQGHPK-UHFFFAOYSA-N 1 2 321.424 4.121 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2CCC(F)(F)F)cc[nH+]1 ZINC000270424838 1043386179 /nfs/dbraw/zinc/38/61/79/1043386179.db2.gz MNDVKVFPPOAKKK-UHFFFAOYSA-N 1 2 308.303 4.137 20 0 DIADLO C[C@H](C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2)C(C)(C)C ZINC000270440627 1043387216 /nfs/dbraw/zinc/38/72/16/1043387216.db2.gz JPOVALKHILEQID-CQSZACIVSA-N 1 2 323.440 4.223 20 0 DIADLO CC(C)(C)/C=C/C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000270429672 1043387240 /nfs/dbraw/zinc/38/72/40/1043387240.db2.gz HRGWIOHWCCFQMW-ZHACJKMWSA-N 1 2 321.424 4.143 20 0 DIADLO O=C(Nc1cccc2c1CN(c1cccc[nH+]1)C2)C1CCCCC1 ZINC000270471981 1043387911 /nfs/dbraw/zinc/38/79/11/1043387911.db2.gz NJFACAXGYNKOCB-UHFFFAOYSA-N 1 2 321.424 4.121 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1ncc(C3CC3)o1)CCC2 ZINC000270546255 1043390752 /nfs/dbraw/zinc/39/07/52/1043390752.db2.gz STKQTZNKXZRZBK-ZDUSSCGKSA-N 1 2 317.458 4.080 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ncc(C3CC3)o1)CCC2 ZINC000270546255 1043390757 /nfs/dbraw/zinc/39/07/57/1043390757.db2.gz STKQTZNKXZRZBK-ZDUSSCGKSA-N 1 2 317.458 4.080 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cnc([C@H]2CCCO2)s1 ZINC000271051790 1043399008 /nfs/dbraw/zinc/39/90/08/1043399008.db2.gz PUAAIAPVSUWDMC-BLLLJJGKSA-N 1 2 320.433 4.327 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cnc([C@H]2CCCO2)s1 ZINC000271051790 1043399019 /nfs/dbraw/zinc/39/90/19/1043399019.db2.gz PUAAIAPVSUWDMC-BLLLJJGKSA-N 1 2 320.433 4.327 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1cnc([C@H]2CCCO2)s1 ZINC000271023539 1043399254 /nfs/dbraw/zinc/39/92/54/1043399254.db2.gz DIOAPFILGIOMHN-SMDDNHRTSA-N 1 2 320.483 4.175 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1cnc([C@H]2CCCO2)s1 ZINC000271023539 1043399269 /nfs/dbraw/zinc/39/92/69/1043399269.db2.gz DIOAPFILGIOMHN-SMDDNHRTSA-N 1 2 320.483 4.175 20 0 DIADLO c1snnc1C[NH+]1CCC(c2cccc3ccccc32)CC1 ZINC000271177839 1043405255 /nfs/dbraw/zinc/40/52/55/1043405255.db2.gz GNVAPYFUKJYURE-UHFFFAOYSA-N 1 2 309.438 4.071 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@H]1CC(C)(C)Oc2ccccc21 ZINC000925274637 1043406392 /nfs/dbraw/zinc/40/63/92/1043406392.db2.gz NOWOZILDEYWFAN-CABCVRRESA-N 1 2 312.413 4.252 20 0 DIADLO CC(C)c1nnc([C@H](C)[NH2+][C@H](C)c2ccc(F)c(Cl)c2)[nH]1 ZINC000271434726 1043416876 /nfs/dbraw/zinc/41/68/76/1043416876.db2.gz DRINFIBZGXQJIQ-ZJUUUORDSA-N 1 2 310.804 4.132 20 0 DIADLO COc1ccc(Cl)cc1[C@H](C)[NH2+][C@@H](C)c1nnc(C(C)C)[nH]1 ZINC000271431699 1043417632 /nfs/dbraw/zinc/41/76/32/1043417632.db2.gz DGRSQNJPAIDYLN-QWRGUYRKSA-N 1 2 322.840 4.002 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1cc(Cl)ccc1Cl ZINC000271446005 1043419782 /nfs/dbraw/zinc/41/97/82/1043419782.db2.gz CYGGKSIFRDVDEU-LKFCYVNXSA-N 1 2 310.228 4.445 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1cc(Cl)ccc1Cl ZINC000271446005 1043419789 /nfs/dbraw/zinc/41/97/89/1043419789.db2.gz CYGGKSIFRDVDEU-LKFCYVNXSA-N 1 2 310.228 4.445 20 0 DIADLO CC[C@H]([NH2+]Cc1cn[nH]c1C)c1ccc2cc(OC)ccc2c1 ZINC000271448939 1043420053 /nfs/dbraw/zinc/42/00/53/1043420053.db2.gz FHRZMYIGHOJLEK-IBGZPJMESA-N 1 2 309.413 4.121 20 0 DIADLO CCn1c(=S)n(C[NH+]2CCC(C)(C(C)C)CC2)nc1C1CC1 ZINC000777561966 1043421547 /nfs/dbraw/zinc/42/15/47/1043421547.db2.gz UXKNQSLHTXFMLJ-UHFFFAOYSA-N 1 2 322.522 4.027 20 0 DIADLO Clc1ccnc2c1CC[C@H]2[NH2+][C@@H]1COc2c1cccc2Cl ZINC000925519469 1043423656 /nfs/dbraw/zinc/42/36/56/1043423656.db2.gz RLLPTNWTDJHLRE-ZIAGYGMSSA-N 1 2 321.207 4.099 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+][C@@H](C)c1cccc(O)c1F ZINC000872034005 1043428704 /nfs/dbraw/zinc/42/87/04/1043428704.db2.gz FAXMWQBGVWMYAW-JTQLQIEISA-N 1 2 309.768 4.044 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+][C@H](C)c1cccc(O)c1F ZINC000872034008 1043428964 /nfs/dbraw/zinc/42/89/64/1043428964.db2.gz FAXMWQBGVWMYAW-SNVBAGLBSA-N 1 2 309.768 4.044 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@@H](C)C1(Cl)CC1)c1ccco1 ZINC000925566701 1043431865 /nfs/dbraw/zinc/43/18/65/1043431865.db2.gz FNVKALMAJDFEFG-BLLLJJGKSA-N 1 2 305.805 4.127 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@H](C)C1(Cl)CC1)c1ccco1 ZINC000925566707 1043431886 /nfs/dbraw/zinc/43/18/86/1043431886.db2.gz FNVKALMAJDFEFG-WBMJQRKESA-N 1 2 305.805 4.127 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2ccccc2SC)[nH]1 ZINC000442859784 1043436853 /nfs/dbraw/zinc/43/68/53/1043436853.db2.gz REWXUUIMUNWBPJ-RWMBFGLXSA-N 1 2 318.490 4.452 20 0 DIADLO Cc1csc(C2([NH2+][C@H](C)c3cc(O)ccc3F)CCC2)n1 ZINC000872055098 1043437256 /nfs/dbraw/zinc/43/72/56/1043437256.db2.gz FWPKRFJSVBGAGY-LLVKDONJSA-N 1 2 306.406 4.026 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+][C@@H](C)c1nnc(C(C)C)[nH]1 ZINC000271571771 1043438820 /nfs/dbraw/zinc/43/88/20/1043438820.db2.gz VVKCFNHBJKSXOZ-PWSUYJOCSA-N 1 2 321.494 4.228 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](C)c2ccccc2OC)cs1 ZINC000271597232 1043440670 /nfs/dbraw/zinc/44/06/70/1043440670.db2.gz AANKXAIZZVREAG-CYBMUJFWSA-N 1 2 304.459 4.345 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+][C@H](C)c1nnc(C(C)C)[nH]1 ZINC000442872468 1043441555 /nfs/dbraw/zinc/44/15/55/1043441555.db2.gz NMUCMGQTCHOYAN-VXGBXAGGSA-N 1 2 304.463 4.062 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+](C)[C@H](C)c3cccnc3)o2)cc1 ZINC000271615932 1043444852 /nfs/dbraw/zinc/44/48/52/1043444852.db2.gz XDGBKQJUVZNYIZ-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+](C)[C@H](C)c3cccnc3)o2)cc1 ZINC000271615932 1043444862 /nfs/dbraw/zinc/44/48/62/1043444862.db2.gz XDGBKQJUVZNYIZ-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1cccc(O)c1F)c1ccc(Cl)cc1 ZINC000872066103 1043445535 /nfs/dbraw/zinc/44/55/35/1043445535.db2.gz DYOXBELFESGAFN-ABAIWWIYSA-N 1 2 323.795 4.223 20 0 DIADLO CCOc1nnc(C[NH2+][C@H](c2cccc(C)c2)C(C)(C)C)s1 ZINC000271697361 1043449132 /nfs/dbraw/zinc/44/91/32/1043449132.db2.gz KIVSDNRXONCSFX-OAHLLOKOSA-N 1 2 319.474 4.122 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(F)c2ccccc21 ZINC000558172274 1043449445 /nfs/dbraw/zinc/44/94/45/1043449445.db2.gz GAIFYQATOFWYIY-LLVKDONJSA-N 1 2 311.360 4.090 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2cccc(OC(C)C)c2)s1 ZINC000283050446 1043456533 /nfs/dbraw/zinc/45/65/33/1043456533.db2.gz IYDJPOMOEPBWCC-NWDGAFQWSA-N 1 2 305.447 4.046 20 0 DIADLO C[C@H](Nc1ccc([NH+]2CCCC2)cc1)c1cnn(C2CCC2)c1 ZINC000925726724 1043457075 /nfs/dbraw/zinc/45/70/75/1043457075.db2.gz KRUWOOHNVSQYTI-HNNXBMFYSA-N 1 2 310.445 4.381 20 0 DIADLO c1cc(N2CCCCC2)ccc1[NH2+][C@H](C1CC1)C1CCOCC1 ZINC000925724413 1043457206 /nfs/dbraw/zinc/45/72/06/1043457206.db2.gz AQRGTXXXKSHJEQ-HXUWFJFHSA-N 1 2 314.473 4.294 20 0 DIADLO Fc1cc2c(cc1Cl)[C@@H]([NH2+]Cc1ncc(Cl)s1)CC2 ZINC000872111904 1043463502 /nfs/dbraw/zinc/46/35/02/1043463502.db2.gz GCXAIFQWRJPMTD-NSHDSACASA-N 1 2 317.216 4.366 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+][C@@H](C)c1nnc(C)s1 ZINC000283187705 1043465400 /nfs/dbraw/zinc/46/54/00/1043465400.db2.gz QKZNMAJWWCMOOO-SMDDNHRTSA-N 1 2 305.447 4.047 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+][C@H](C)c1nnc(C)s1 ZINC000283187702 1043465630 /nfs/dbraw/zinc/46/56/30/1043465630.db2.gz QKZNMAJWWCMOOO-BXUZGUMPSA-N 1 2 305.447 4.047 20 0 DIADLO Cc1noc([C@H]2CCC[N@@H+]2Cc2ccc(-c3ccc(C)cc3)o2)n1 ZINC000348814856 1043470108 /nfs/dbraw/zinc/47/01/08/1043470108.db2.gz IKWSUTLCWKDVIP-QGZVFWFLSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1noc([C@H]2CCC[N@H+]2Cc2ccc(-c3ccc(C)cc3)o2)n1 ZINC000348814856 1043470114 /nfs/dbraw/zinc/47/01/14/1043470114.db2.gz IKWSUTLCWKDVIP-QGZVFWFLSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1nccnc1[C@H](C)[NH2+][C@H](C)c1csc(-c2ccccc2)n1 ZINC000872131692 1043472873 /nfs/dbraw/zinc/47/28/73/1043472873.db2.gz ZPEFAIUMNNQMMX-OCCSQVGLSA-N 1 2 324.453 4.320 20 0 DIADLO CSc1ccc([C@H](C)[NH2+]Cc2nnc(-c3ccccc3)[nH]2)cc1 ZINC000777575388 1043472936 /nfs/dbraw/zinc/47/29/36/1043472936.db2.gz PZMGFISRNXOIIJ-ZDUSSCGKSA-N 1 2 324.453 4.044 20 0 DIADLO c1cn(Cc2ccc(N[C@H]3CC[C@@H](c4ccccc4)C3)nc2)c[nH+]1 ZINC000348836422 1043473295 /nfs/dbraw/zinc/47/32/95/1043473295.db2.gz WDJNEHMJTWTURN-MOPGFXCFSA-N 1 2 318.424 4.075 20 0 DIADLO Cc1noc([C@H]2CCCC[N@@H+]2Cc2ccc(-c3ccccc3)o2)n1 ZINC000348847235 1043474603 /nfs/dbraw/zinc/47/46/03/1043474603.db2.gz IMFZHQXAZZOOJJ-QGZVFWFLSA-N 1 2 323.396 4.365 20 0 DIADLO Cc1noc([C@H]2CCCC[N@H+]2Cc2ccc(-c3ccccc3)o2)n1 ZINC000348847235 1043474608 /nfs/dbraw/zinc/47/46/08/1043474608.db2.gz IMFZHQXAZZOOJJ-QGZVFWFLSA-N 1 2 323.396 4.365 20 0 DIADLO CCc1ccc([C@H](CC)[NH2+]Cc2nnc(-c3ccccc3)[nH]2)cc1 ZINC000777576070 1043477485 /nfs/dbraw/zinc/47/74/85/1043477485.db2.gz UVFCHGSFZBLQGU-SFHVURJKSA-N 1 2 320.440 4.275 20 0 DIADLO CCc1ccc([C@H](CC)[NH2+]Cc2nc(-c3ccccc3)n[nH]2)cc1 ZINC000777576070 1043477497 /nfs/dbraw/zinc/47/74/97/1043477497.db2.gz UVFCHGSFZBLQGU-SFHVURJKSA-N 1 2 320.440 4.275 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1ccc(C)cc1Br ZINC000348893813 1043478768 /nfs/dbraw/zinc/47/87/68/1043478768.db2.gz MYHQJEPXZCBBHL-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1ccc(C)cc1Br ZINC000348893813 1043478775 /nfs/dbraw/zinc/47/87/75/1043478775.db2.gz MYHQJEPXZCBBHL-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CCCC[C@H]([NH2+]Cc1nnc(-c2ccccc2)[nH]1)c1ccccc1 ZINC000777579195 1043484569 /nfs/dbraw/zinc/48/45/69/1043484569.db2.gz SWNXSIBUSAOVHR-SFHVURJKSA-N 1 2 320.440 4.493 20 0 DIADLO CCCC[C@H]([NH2+]Cc1nc(-c2ccccc2)n[nH]1)c1ccccc1 ZINC000777579195 1043484581 /nfs/dbraw/zinc/48/45/81/1043484581.db2.gz SWNXSIBUSAOVHR-SFHVURJKSA-N 1 2 320.440 4.493 20 0 DIADLO CCC[N@H+](Cc1noc(C(C)(C)C)n1)[C@H]1CCc2ccccc21 ZINC000521820003 1043485203 /nfs/dbraw/zinc/48/52/03/1043485203.db2.gz QNUOMHOTCAZMHV-INIZCTEOSA-N 1 2 313.445 4.267 20 0 DIADLO CCC[N@@H+](Cc1noc(C(C)(C)C)n1)[C@H]1CCc2ccccc21 ZINC000521820003 1043485213 /nfs/dbraw/zinc/48/52/13/1043485213.db2.gz QNUOMHOTCAZMHV-INIZCTEOSA-N 1 2 313.445 4.267 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](C)c2ccc(-c3cccs3)cc2)s1 ZINC000543740139 1043485450 /nfs/dbraw/zinc/48/54/50/1043485450.db2.gz XKXPKYYWXUHIGA-NSHDSACASA-N 1 2 315.467 4.426 20 0 DIADLO CCCc1nc(C[N@H+](CCOC)[C@H](C)c2ccccc2)cs1 ZINC000521858732 1043492941 /nfs/dbraw/zinc/49/29/41/1043492941.db2.gz LKBUOXYEGFEEPR-OAHLLOKOSA-N 1 2 318.486 4.305 20 0 DIADLO CCCc1nc(C[N@@H+](CCOC)[C@H](C)c2ccccc2)cs1 ZINC000521858732 1043492952 /nfs/dbraw/zinc/49/29/52/1043492952.db2.gz LKBUOXYEGFEEPR-OAHLLOKOSA-N 1 2 318.486 4.305 20 0 DIADLO C[C@@H](Nc1ccc2nc(C3CC3)oc2c1)c1cn2c([nH+]1)CCCC2 ZINC000925917549 1043493568 /nfs/dbraw/zinc/49/35/68/1043493568.db2.gz BVPLNEKPWZYOJS-GFCCVEGCSA-N 1 2 322.412 4.411 20 0 DIADLO c1ccc([C@@H](Nc2ccc(N3CCCC3)[nH+]c2)C2CCC2)nc1 ZINC000925932360 1043494320 /nfs/dbraw/zinc/49/43/20/1043494320.db2.gz JRFLYDOQIYXABU-IBGZPJMESA-N 1 2 308.429 4.030 20 0 DIADLO CC[C@@H]1CC[C@@H]1Nc1cccc(C[N@H+](C)Cc2cscn2)c1 ZINC000558403901 1043500730 /nfs/dbraw/zinc/50/07/30/1043500730.db2.gz POXUUGYUEAUMBA-QAPCUYQASA-N 1 2 315.486 4.376 20 0 DIADLO CC[C@@H]1CC[C@@H]1Nc1cccc(C[N@@H+](C)Cc2cscn2)c1 ZINC000558403901 1043500746 /nfs/dbraw/zinc/50/07/46/1043500746.db2.gz POXUUGYUEAUMBA-QAPCUYQASA-N 1 2 315.486 4.376 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)C(C1CCC1)C1CCC1 ZINC000349323669 1043501800 /nfs/dbraw/zinc/50/18/00/1043501800.db2.gz GAMBTWSBPCWPQY-UHFFFAOYSA-N 1 2 309.413 4.027 20 0 DIADLO Cc1[nH+]ccn1CCC[N@H+](C)Cc1csc(Cl)c1Cl ZINC000349384968 1043505477 /nfs/dbraw/zinc/50/54/77/1043505477.db2.gz QOORBHBSSHRPQV-UHFFFAOYSA-N 1 2 318.273 4.082 20 0 DIADLO Cc1[nH+]ccn1CCCN(C)Cc1csc(Cl)c1Cl ZINC000349384968 1043505489 /nfs/dbraw/zinc/50/54/89/1043505489.db2.gz QOORBHBSSHRPQV-UHFFFAOYSA-N 1 2 318.273 4.082 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)CC(=O)N1[C@H](C)CCC[C@H]1C ZINC000521921937 1043506437 /nfs/dbraw/zinc/50/64/37/1043506437.db2.gz PIHWFXHXQNFYDX-RBSFLKMASA-N 1 2 322.880 4.122 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)CC(=O)N1[C@H](C)CCC[C@H]1C ZINC000521921937 1043506449 /nfs/dbraw/zinc/50/64/49/1043506449.db2.gz PIHWFXHXQNFYDX-RBSFLKMASA-N 1 2 322.880 4.122 20 0 DIADLO Cc1csc([C@H]2CCN(c3[nH+]ccc4cc(F)ccc43)C2)n1 ZINC000872737629 1043507158 /nfs/dbraw/zinc/50/71/58/1043507158.db2.gz VVKONWTVHQJDAZ-ZDUSSCGKSA-N 1 2 313.401 4.133 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)cn1 ZINC000558425284 1043508785 /nfs/dbraw/zinc/50/87/85/1043508785.db2.gz WWRCUEKJDINZBH-HNNXBMFYSA-N 1 2 315.486 4.419 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)cn1 ZINC000558425284 1043508790 /nfs/dbraw/zinc/50/87/90/1043508790.db2.gz WWRCUEKJDINZBH-HNNXBMFYSA-N 1 2 315.486 4.419 20 0 DIADLO c1cnc2cccc(CNc3ccc([NH+]4CCCC4)cc3)c2c1 ZINC000873017772 1043513933 /nfs/dbraw/zinc/51/39/33/1043513933.db2.gz KHRAIEVTSVIZLO-UHFFFAOYSA-N 1 2 303.409 4.447 20 0 DIADLO CSCc1cc(F)ccc1C[NH2+]Cc1ncc(Cl)s1 ZINC000349568556 1043515159 /nfs/dbraw/zinc/51/51/59/1043515159.db2.gz MKEODWWLTBQJRB-UHFFFAOYSA-N 1 2 316.854 4.088 20 0 DIADLO Clc1cnc(C[NH2+][C@@H]2CCOc3c(Cl)cccc32)s1 ZINC000349628481 1043516244 /nfs/dbraw/zinc/51/62/44/1043516244.db2.gz GDHGHONHVZMSGJ-SNVBAGLBSA-N 1 2 315.225 4.063 20 0 DIADLO Cc1cccc(C[NH2+]Cc2c(Cl)cc(Cl)cc2N(C)C)n1 ZINC000558482757 1043516918 /nfs/dbraw/zinc/51/69/18/1043516918.db2.gz KZTRJCZPSQRDOD-UHFFFAOYSA-N 1 2 324.255 4.053 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000349650532 1043517678 /nfs/dbraw/zinc/51/76/78/1043517678.db2.gz AWWFPNXAWASCQB-FZMZJTMJSA-N 1 2 315.442 4.053 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000349650532 1043517687 /nfs/dbraw/zinc/51/76/87/1043517687.db2.gz AWWFPNXAWASCQB-FZMZJTMJSA-N 1 2 315.442 4.053 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccnn1C1CCC1 ZINC000926067202 1043518405 /nfs/dbraw/zinc/51/84/05/1043518405.db2.gz VJVQSCIDPBLSBJ-CQSZACIVSA-N 1 2 310.445 4.164 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccnn1C1CCC1 ZINC000926067202 1043518414 /nfs/dbraw/zinc/51/84/14/1043518414.db2.gz VJVQSCIDPBLSBJ-CQSZACIVSA-N 1 2 310.445 4.164 20 0 DIADLO CC1(C)CCc2onc(C[NH2+]Cc3coc4ccccc34)c2C1 ZINC000873175225 1043520510 /nfs/dbraw/zinc/52/05/10/1043520510.db2.gz RORKSAAXQWVGBC-UHFFFAOYSA-N 1 2 310.397 4.226 20 0 DIADLO CC(F)(F)C[NH2+][C@H]1CCCc2cc(Br)ccc21 ZINC000522019023 1043524055 /nfs/dbraw/zinc/52/40/55/1043524055.db2.gz OLWTVTJUQQVNMW-LBPRGKRZSA-N 1 2 304.178 4.071 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@@H](c1ccc(Cl)cc1F)C(C)C ZINC000926126977 1043532193 /nfs/dbraw/zinc/53/21/93/1043532193.db2.gz GCMYSUSLPDBDPA-YMTOWFKASA-N 1 2 311.788 4.218 20 0 DIADLO Cc1nocc1C[N@@H+]1CCc2sccc2[C@@H]1c1cccs1 ZINC000350314269 1043541683 /nfs/dbraw/zinc/54/16/83/1043541683.db2.gz KKHQJSKWOJTUAZ-MRXNPFEDSA-N 1 2 316.451 4.254 20 0 DIADLO Cc1nocc1C[N@H+]1CCc2sccc2[C@@H]1c1cccs1 ZINC000350314269 1043541691 /nfs/dbraw/zinc/54/16/91/1043541691.db2.gz KKHQJSKWOJTUAZ-MRXNPFEDSA-N 1 2 316.451 4.254 20 0 DIADLO COCC[C@@H]([NH2+]Cc1csc(C(C)C)n1)c1ccc(C)o1 ZINC000350312931 1043547233 /nfs/dbraw/zinc/54/72/33/1043547233.db2.gz WERHYVKVRQLOAD-CQSZACIVSA-N 1 2 308.447 4.035 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H]1CCc2c1nccc2Cl ZINC000926267150 1043555137 /nfs/dbraw/zinc/55/51/37/1043555137.db2.gz XNVSLCGFIGKNKV-AWEZNQCLSA-N 1 2 323.223 4.174 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2ccc(Cl)cn2)C1 ZINC000558626897 1043560002 /nfs/dbraw/zinc/56/00/02/1043560002.db2.gz JVTCYTNCQQWKHP-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2ccc(Cl)cn2)C1 ZINC000558626897 1043560014 /nfs/dbraw/zinc/56/00/14/1043560014.db2.gz JVTCYTNCQQWKHP-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO COc1ccc2cc([C@H](C)[NH2+][C@H](C)c3csnn3)ccc2c1 ZINC000398429340 1043560951 /nfs/dbraw/zinc/56/09/51/1043560951.db2.gz UEYQSTILHKKPDF-NWDGAFQWSA-N 1 2 313.426 4.112 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)c1ccc(C2CCCC2)cc1 ZINC001274961313 1043563962 /nfs/dbraw/zinc/56/39/62/1043563962.db2.gz KORLLGHYUZTYCM-UHFFFAOYSA-N 1 2 305.381 4.244 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2csc(C(F)(F)F)c2)no1 ZINC000926364742 1043569065 /nfs/dbraw/zinc/56/90/65/1043569065.db2.gz NQBSWTMMQHYDEP-DTWKUNHWSA-N 1 2 304.337 4.475 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2csc(C(F)(F)F)c2)no1 ZINC000926364741 1043569640 /nfs/dbraw/zinc/56/96/40/1043569640.db2.gz NQBSWTMMQHYDEP-BDAKNGLRSA-N 1 2 304.337 4.475 20 0 DIADLO Cc1nc(C[NH+]2CCC(c3cccc(F)c3F)CC2)cs1 ZINC000558707271 1043578767 /nfs/dbraw/zinc/57/87/67/1043578767.db2.gz CMLMZLLYMLBNLI-UHFFFAOYSA-N 1 2 308.397 4.109 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1cn2c(n1)CCCC2 ZINC000926468751 1043582939 /nfs/dbraw/zinc/58/29/39/1043582939.db2.gz ITTNTRQSGCEJEV-ZDUSSCGKSA-N 1 2 313.420 4.087 20 0 DIADLO Fc1cc(F)c(C[NH2+][C@@H](c2ccccn2)C2CCC2)c(F)c1 ZINC000926490757 1043584144 /nfs/dbraw/zinc/58/41/44/1043584144.db2.gz XRXFTTNICQWZBU-QGZVFWFLSA-N 1 2 306.331 4.130 20 0 DIADLO COc1cccnc1C[NH2+][C@H](C)c1csc(C(F)(F)F)c1 ZINC000926552617 1043598430 /nfs/dbraw/zinc/59/84/30/1043598430.db2.gz VFIYSRRXTWEULD-SECBINFHSA-N 1 2 316.348 4.021 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)cn1 ZINC001137082620 1043600528 /nfs/dbraw/zinc/60/05/28/1043600528.db2.gz IRSORYUKMKUFTO-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1cc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)cn1 ZINC001137082620 1043600541 /nfs/dbraw/zinc/60/05/41/1043600541.db2.gz IRSORYUKMKUFTO-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1ncccc1C(F)(F)F ZINC001648959717 1043602669 /nfs/dbraw/zinc/60/26/69/1043602669.db2.gz FNOUTKLHFMEZFR-UHFFFAOYSA-N 1 2 318.701 4.183 20 0 DIADLO Cn1cc(C[NH+]2Cc3ccccc3C2)c(-c2ccccc2Cl)n1 ZINC000353399998 1043603744 /nfs/dbraw/zinc/60/37/44/1043603744.db2.gz DEWADULLUBJCMN-UHFFFAOYSA-N 1 2 323.827 4.256 20 0 DIADLO Cc1oc2ccccc2c1[C@H](C)[NH2+]Cc1nnc(C2CC2)s1 ZINC000926596174 1043603796 /nfs/dbraw/zinc/60/37/96/1043603796.db2.gz LESDOXDLMXFGDH-JTQLQIEISA-N 1 2 313.426 4.321 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccc(Oc3ccccc3)nc2)no1 ZINC000353391423 1043605154 /nfs/dbraw/zinc/60/51/54/1043605154.db2.gz XHVPUARJORYTCV-AWEZNQCLSA-N 1 2 309.369 4.021 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)cc1O ZINC000353416498 1043606658 /nfs/dbraw/zinc/60/66/58/1043606658.db2.gz XYUXAJYSYFOZRJ-NSHDSACASA-N 1 2 320.458 4.006 20 0 DIADLO CC[N@H+](Cc1nc(C2CC2)no1)Cc1ccc2ccccc2c1 ZINC000353466216 1043608406 /nfs/dbraw/zinc/60/84/06/1043608406.db2.gz XQNVSYXUBMZLNX-UHFFFAOYSA-N 1 2 307.397 4.122 20 0 DIADLO CC[N@@H+](Cc1nc(C2CC2)no1)Cc1ccc2ccccc2c1 ZINC000353466216 1043608415 /nfs/dbraw/zinc/60/84/15/1043608415.db2.gz XQNVSYXUBMZLNX-UHFFFAOYSA-N 1 2 307.397 4.122 20 0 DIADLO C[C@@H](NC1(c2ccccc2Cl)CC1)c1cn2c([nH+]1)CCCC2 ZINC000926627981 1043609019 /nfs/dbraw/zinc/60/90/19/1043609019.db2.gz PDXPEGHARMCLIO-CYBMUJFWSA-N 1 2 315.848 4.213 20 0 DIADLO c1cn(Cc2ccc(N[C@H]3CCCCC34CCCC4)nc2)c[nH+]1 ZINC000353502749 1043610487 /nfs/dbraw/zinc/61/04/87/1043610487.db2.gz GVCCLFYJSISDSH-KRWDZBQOSA-N 1 2 310.445 4.241 20 0 DIADLO COc1cc([C@@H](C)[NH2+]C2(c3ccccc3Cl)CCC2)on1 ZINC000926643136 1043611339 /nfs/dbraw/zinc/61/13/39/1043611339.db2.gz QLLNKRVHJCUOEO-LLVKDONJSA-N 1 2 306.793 4.067 20 0 DIADLO c1cc(C[NH2+][C@@H](c2cc3ccccc3o2)c2cccnc2)co1 ZINC000353546801 1043614825 /nfs/dbraw/zinc/61/48/25/1043614825.db2.gz XACODSJMMXIVTC-LJQANCHMSA-N 1 2 304.349 4.300 20 0 DIADLO CC[C@@H]([NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)c1ccccc1F ZINC000639296688 1043618159 /nfs/dbraw/zinc/61/81/59/1043618159.db2.gz OZVKUTFYDOBDNB-IAGOWNOFSA-N 1 2 316.424 4.306 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(SC(C)C)cc2)s1 ZINC000353573200 1043619269 /nfs/dbraw/zinc/61/92/69/1043619269.db2.gz USLHFHJVRHDDCJ-NSHDSACASA-N 1 2 307.488 4.198 20 0 DIADLO CCOc1cccc(C[N@H+](C)Cc2nc3c(s2)CCCC3)c1 ZINC000353588693 1043621041 /nfs/dbraw/zinc/62/10/41/1043621041.db2.gz MXCQRFXQQWYRKP-UHFFFAOYSA-N 1 2 316.470 4.053 20 0 DIADLO CCOc1cccc(C[N@@H+](C)Cc2nc3c(s2)CCCC3)c1 ZINC000353588693 1043621047 /nfs/dbraw/zinc/62/10/47/1043621047.db2.gz MXCQRFXQQWYRKP-UHFFFAOYSA-N 1 2 316.470 4.053 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2cccc(C(F)(F)F)c2)c(C)s1 ZINC000443619205 1043623183 /nfs/dbraw/zinc/62/31/83/1043623183.db2.gz AKCXNKSFPXEFDV-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2cccc(C(F)(F)F)c2)c(C)s1 ZINC000443619205 1043623188 /nfs/dbraw/zinc/62/31/88/1043623188.db2.gz AKCXNKSFPXEFDV-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1nc(C[N@@H+]2CCSC[C@@H]2c2ccc(C)cc2)c(C)s1 ZINC000443625365 1043625081 /nfs/dbraw/zinc/62/50/81/1043625081.db2.gz JWSDDDFQRTVNQQ-QGZVFWFLSA-N 1 2 318.511 4.358 20 0 DIADLO Cc1nc(C[N@H+]2CCSC[C@@H]2c2ccc(C)cc2)c(C)s1 ZINC000443625365 1043625086 /nfs/dbraw/zinc/62/50/86/1043625086.db2.gz JWSDDDFQRTVNQQ-QGZVFWFLSA-N 1 2 318.511 4.358 20 0 DIADLO Cc1ccccc1C[N@H+](Cc1nc(C2CCCC2)no1)C1CC1 ZINC000443627205 1043627072 /nfs/dbraw/zinc/62/70/72/1043627072.db2.gz JGVSXOWUKKJEJI-UHFFFAOYSA-N 1 2 311.429 4.200 20 0 DIADLO Cc1ccccc1C[N@@H+](Cc1nc(C2CCCC2)no1)C1CC1 ZINC000443627205 1043627080 /nfs/dbraw/zinc/62/70/80/1043627080.db2.gz JGVSXOWUKKJEJI-UHFFFAOYSA-N 1 2 311.429 4.200 20 0 DIADLO CC(C)[N@H+](Cc1nc(C2CCCC2)no1)Cc1cccc(F)c1 ZINC000443628784 1043627140 /nfs/dbraw/zinc/62/71/40/1043627140.db2.gz RXWUVXBOFANLKM-UHFFFAOYSA-N 1 2 317.408 4.277 20 0 DIADLO CC(C)[N@@H+](Cc1nc(C2CCCC2)no1)Cc1cccc(F)c1 ZINC000443628784 1043627149 /nfs/dbraw/zinc/62/71/49/1043627149.db2.gz RXWUVXBOFANLKM-UHFFFAOYSA-N 1 2 317.408 4.277 20 0 DIADLO Cc1ncc([C@H](C)[NH2+][C@@H]2COCc3cccc(Cl)c32)s1 ZINC000926785998 1043633512 /nfs/dbraw/zinc/63/35/12/1043633512.db2.gz KSHLQNMVTCYSFB-TVQRCGJNSA-N 1 2 308.834 4.027 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@@H]1CCCC[C@@H]1F)c1ccccn1 ZINC000926785767 1043633877 /nfs/dbraw/zinc/63/38/77/1043633877.db2.gz NCNIPHPISQTKIM-FCEWJHQRSA-N 1 2 314.404 4.050 20 0 DIADLO CC(C)Cc1ncc(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)s1 ZINC000353698735 1043634037 /nfs/dbraw/zinc/63/40/37/1043634037.db2.gz PDMACKZNACQOSZ-QGZVFWFLSA-N 1 2 315.486 4.320 20 0 DIADLO CC(C)Cc1ncc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)s1 ZINC000353698735 1043634045 /nfs/dbraw/zinc/63/40/45/1043634045.db2.gz PDMACKZNACQOSZ-QGZVFWFLSA-N 1 2 315.486 4.320 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)s1 ZINC000353699749 1043634687 /nfs/dbraw/zinc/63/46/87/1043634687.db2.gz UAVVETAQPBAJRR-OAHLLOKOSA-N 1 2 301.459 4.245 20 0 DIADLO CC(C)c1ncc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)s1 ZINC000353699749 1043634689 /nfs/dbraw/zinc/63/46/89/1043634689.db2.gz UAVVETAQPBAJRR-OAHLLOKOSA-N 1 2 301.459 4.245 20 0 DIADLO Cc1nn(C[N@@H+]2CCC[C@H](c3ccccc3)CC2)c(=S)s1 ZINC000727429842 1043636854 /nfs/dbraw/zinc/63/68/54/1043636854.db2.gz CEZUOPHYNMLJHH-HNNXBMFYSA-N 1 2 319.499 4.210 20 0 DIADLO Cc1nn(C[N@H+]2CCC[C@H](c3ccccc3)CC2)c(=S)s1 ZINC000727429842 1043636859 /nfs/dbraw/zinc/63/68/59/1043636859.db2.gz CEZUOPHYNMLJHH-HNNXBMFYSA-N 1 2 319.499 4.210 20 0 DIADLO Cc1nc(C2([NH2+]C/C=C\c3ccccc3)CCCCCC2)no1 ZINC000558937097 1043642606 /nfs/dbraw/zinc/64/26/06/1043642606.db2.gz ZBNAHZLGJHZAOC-XFXZXTDPSA-N 1 2 311.429 4.231 20 0 DIADLO C[C@H]([NH2+][C@@H]1c2ccccc2CC[C@H]1F)c1ccnn1C1CCC1 ZINC000926860996 1043643978 /nfs/dbraw/zinc/64/39/78/1043643978.db2.gz LQTKYMIIVXMEOF-BOFPYLFWSA-N 1 2 313.420 4.284 20 0 DIADLO CCC[C@H]([NH2+]Cc1nc2c(s1)CCC2)c1ncccc1Cl ZINC000926882426 1043649003 /nfs/dbraw/zinc/64/90/03/1043649003.db2.gz RWDNLWNBEVVSEN-ZDUSSCGKSA-N 1 2 321.877 4.311 20 0 DIADLO CC[C@H]([NH2+][C@H]1CCCc2oc(C)nc21)c1cc(F)ccc1OC ZINC000926901408 1043652946 /nfs/dbraw/zinc/65/29/46/1043652946.db2.gz RIYHXUSEVFYNRL-GJZGRUSLSA-N 1 2 318.392 4.249 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2nccn2CC)o1 ZINC000353934287 1043661719 /nfs/dbraw/zinc/66/17/19/1043661719.db2.gz PLAYVJHJYKKBQW-GDBMZVCRSA-N 1 2 301.434 4.032 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2nccn2CC)o1 ZINC000353934287 1043661723 /nfs/dbraw/zinc/66/17/23/1043661723.db2.gz PLAYVJHJYKKBQW-GDBMZVCRSA-N 1 2 301.434 4.032 20 0 DIADLO CCC[C@H]([NH2+]Cc1ncc(C)cc1C)c1ncccc1Cl ZINC000926960847 1043664656 /nfs/dbraw/zinc/66/46/56/1043664656.db2.gz QSAXVXGLXIQPKL-HNNXBMFYSA-N 1 2 303.837 4.378 20 0 DIADLO Clc1cnc(C[NH+]2CCC3(C=Cc4ccccc43)CC2)s1 ZINC001137105153 1043675420 /nfs/dbraw/zinc/67/54/20/1043675420.db2.gz DYAMTXNZIISWHU-UHFFFAOYSA-N 1 2 316.857 4.357 20 0 DIADLO Cc1[nH]ncc1C[NH+]1CCC(c2ccccc2C(F)(F)F)CC1 ZINC000354081330 1043680091 /nfs/dbraw/zinc/68/00/91/1043680091.db2.gz FUKIHWTUCIPDPG-UHFFFAOYSA-N 1 2 323.362 4.117 20 0 DIADLO CCCCC[C@@H](C)CC(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927090009 1043684337 /nfs/dbraw/zinc/68/43/37/1043684337.db2.gz SFWKGXAQVDLUJD-MRXNPFEDSA-N 1 2 317.477 4.091 20 0 DIADLO CCCCCC(C)(C)C(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927092031 1043685405 /nfs/dbraw/zinc/68/54/05/1043685405.db2.gz XOLGBXMTXGSZCS-UHFFFAOYSA-N 1 2 317.477 4.091 20 0 DIADLO CCc1onc(C)c1C[NH2+][C@H](c1ccc(C)cc1)c1ccccn1 ZINC000927131834 1043695341 /nfs/dbraw/zinc/69/53/41/1043695341.db2.gz LCKDFOCRZRHOFS-HXUWFJFHSA-N 1 2 321.424 4.128 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc(Cl)cc2c1OCC2)c1nccs1 ZINC000927139093 1043696508 /nfs/dbraw/zinc/69/65/08/1043696508.db2.gz GATYUDDCGZWQJM-NXEZZACHSA-N 1 2 308.834 4.143 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc(Cl)cc2c1OCC2)c1cscn1 ZINC000927140789 1043699018 /nfs/dbraw/zinc/69/90/18/1043699018.db2.gz PGAHWGSSDRSHRZ-NXEZZACHSA-N 1 2 308.834 4.143 20 0 DIADLO Cc1ccc(C)c([C@H]2CCC[N@@H+]2Cc2noc(C(C)(C)C)n2)c1 ZINC000474226437 1043702997 /nfs/dbraw/zinc/70/29/97/1043702997.db2.gz KNFKGDSOPLILRY-MRXNPFEDSA-N 1 2 313.445 4.321 20 0 DIADLO Cc1ccc(C)c([C@H]2CCC[N@H+]2Cc2noc(C(C)(C)C)n2)c1 ZINC000474226437 1043703010 /nfs/dbraw/zinc/70/30/10/1043703010.db2.gz KNFKGDSOPLILRY-MRXNPFEDSA-N 1 2 313.445 4.321 20 0 DIADLO CCOc1ccc(C[NH2+]C(C)(C)c2nc3ccccc3s2)o1 ZINC000895559990 1043704954 /nfs/dbraw/zinc/70/49/54/1043704954.db2.gz XFIXAEPZVPIHFO-UHFFFAOYSA-N 1 2 316.426 4.313 20 0 DIADLO CCO[P@@](C)(=O)CC[C@H](C)Nc1ccc([NH+](C)C)cc1C ZINC000876817600 1043714168 /nfs/dbraw/zinc/71/41/68/1043714168.db2.gz CGCYRYGKFXETRR-LHSJRXKWSA-N 1 2 312.394 4.196 20 0 DIADLO CCO[P@@](C)(=O)CC[C@H](C)[NH2+]c1ccc(N(C)C)cc1C ZINC000876817600 1043714173 /nfs/dbraw/zinc/71/41/73/1043714173.db2.gz CGCYRYGKFXETRR-LHSJRXKWSA-N 1 2 312.394 4.196 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+](Cc3ncc(Cl)s3)C2)c1 ZINC001137113004 1043716519 /nfs/dbraw/zinc/71/65/19/1043716519.db2.gz OCMRUMOUSKFRHN-ZDUSSCGKSA-N 1 2 322.861 4.185 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+](Cc3ncc(Cl)s3)C2)c1 ZINC001137113004 1043716530 /nfs/dbraw/zinc/71/65/30/1043716530.db2.gz OCMRUMOUSKFRHN-ZDUSSCGKSA-N 1 2 322.861 4.185 20 0 DIADLO c1nc(C2CCCC2)sc1C[N@H+]1CCOC[C@@H]1CC1CCC1 ZINC000354739438 1043717314 /nfs/dbraw/zinc/71/73/14/1043717314.db2.gz YLURZUUXJJRFNK-INIZCTEOSA-N 1 2 320.502 4.192 20 0 DIADLO c1nc(C2CCCC2)sc1C[N@@H+]1CCOC[C@@H]1CC1CCC1 ZINC000354739438 1043717321 /nfs/dbraw/zinc/71/73/21/1043717321.db2.gz YLURZUUXJJRFNK-INIZCTEOSA-N 1 2 320.502 4.192 20 0 DIADLO COc1ccc(OC)c([C@@H](C)Nc2ccc([NH+](C)C)c(C)c2)c1 ZINC000777643927 1043726329 /nfs/dbraw/zinc/72/63/29/1043726329.db2.gz WYTYWTSJTDSMMZ-CQSZACIVSA-N 1 2 314.429 4.251 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)cc1F ZINC000777652668 1043727066 /nfs/dbraw/zinc/72/70/66/1043727066.db2.gz ARKKRXZQHILWLP-CYBMUJFWSA-N 1 2 314.404 4.390 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)cc1F ZINC000777652668 1043727074 /nfs/dbraw/zinc/72/70/74/1043727074.db2.gz ARKKRXZQHILWLP-CYBMUJFWSA-N 1 2 314.404 4.390 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)cc1F ZINC000777652670 1043728003 /nfs/dbraw/zinc/72/80/03/1043728003.db2.gz ARKKRXZQHILWLP-ZDUSSCGKSA-N 1 2 314.404 4.390 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)cc1F ZINC000777652670 1043728016 /nfs/dbraw/zinc/72/80/16/1043728016.db2.gz ARKKRXZQHILWLP-ZDUSSCGKSA-N 1 2 314.404 4.390 20 0 DIADLO CCOc1ccc(C[NH2+]C2(c3c(F)cccc3F)CCC2)o1 ZINC000895674342 1043728172 /nfs/dbraw/zinc/72/81/72/1043728172.db2.gz YDNPSLIDIXBSDK-UHFFFAOYSA-N 1 2 307.340 4.126 20 0 DIADLO COc1cccc2c1CC[C@H]2Nc1ccc2c(c1)CCC[N@H+]2C ZINC000777657488 1043729225 /nfs/dbraw/zinc/72/92/25/1043729225.db2.gz RDKRXSHKQXPVRH-GOSISDBHSA-N 1 2 308.425 4.177 20 0 DIADLO COc1cccc2c1CC[C@H]2Nc1ccc2c(c1)CCC[N@@H+]2C ZINC000777657488 1043729233 /nfs/dbraw/zinc/72/92/33/1043729233.db2.gz RDKRXSHKQXPVRH-GOSISDBHSA-N 1 2 308.425 4.177 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+]Cc1nc(Cl)cs1 ZINC000876994531 1043730842 /nfs/dbraw/zinc/73/08/42/1043730842.db2.gz KSLCMTDVTFSCLT-LBPRGKRZSA-N 1 2 310.850 4.436 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(Cl)cs1)c1ccc(F)cc1F ZINC000877050371 1043738411 /nfs/dbraw/zinc/73/84/11/1043738411.db2.gz MAZYXZBTKAMYAU-LLVKDONJSA-N 1 2 302.777 4.316 20 0 DIADLO CCOc1cc(Cl)ccc1C[NH2+]Cc1nc(Cl)cs1 ZINC000877114144 1043745095 /nfs/dbraw/zinc/74/50/95/1043745095.db2.gz LZTZMPYGJWEXJH-UHFFFAOYSA-N 1 2 317.241 4.138 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1nc2cc(C)ccc2[nH]1 ZINC000474355711 1043747228 /nfs/dbraw/zinc/74/72/28/1043747228.db2.gz MVKDIJYVEQXHAE-UHFFFAOYSA-N 1 2 313.832 4.377 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1nc2ccc(C)cc2[nH]1 ZINC000474355711 1043747240 /nfs/dbraw/zinc/74/72/40/1043747240.db2.gz MVKDIJYVEQXHAE-UHFFFAOYSA-N 1 2 313.832 4.377 20 0 DIADLO CCCc1csc(C[N@H+](C)Cc2ccccc2SC)n1 ZINC000355215730 1043752489 /nfs/dbraw/zinc/75/24/89/1043752489.db2.gz HKBKPEKTZPEWMV-UHFFFAOYSA-N 1 2 306.500 4.450 20 0 DIADLO CCCc1csc(C[N@@H+](C)Cc2ccccc2SC)n1 ZINC000355215730 1043752494 /nfs/dbraw/zinc/75/24/94/1043752494.db2.gz HKBKPEKTZPEWMV-UHFFFAOYSA-N 1 2 306.500 4.450 20 0 DIADLO Cc1ccc(-c2ccc(C(=O)Nc3ccn4cc[nH+]c4c3)s2)o1 ZINC000355291230 1043757680 /nfs/dbraw/zinc/75/76/80/1043757680.db2.gz OAFCUIJILDYKJW-UHFFFAOYSA-N 1 2 323.377 4.217 20 0 DIADLO Fc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)c(Cl)c1 ZINC000355332025 1043762065 /nfs/dbraw/zinc/76/20/65/1043762065.db2.gz HDCDHGYRWUSCRD-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO Cc1cc(C[NH2+][C@@H](CF)c2ccc(F)cc2)c2c(n1)CCCC2 ZINC000895853193 1043767127 /nfs/dbraw/zinc/76/71/27/1043767127.db2.gz MEALFQKHCVJXRF-IBGZPJMESA-N 1 2 316.395 4.208 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](Cc2ccccc2C)C2CC2)cs1 ZINC000355551322 1043775429 /nfs/dbraw/zinc/77/54/29/1043775429.db2.gz HPQQLCIVUIUZGO-CQSZACIVSA-N 1 2 316.470 4.324 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](Cc2ccccc2C)C2CC2)cs1 ZINC000355551322 1043775444 /nfs/dbraw/zinc/77/54/44/1043775444.db2.gz HPQQLCIVUIUZGO-CQSZACIVSA-N 1 2 316.470 4.324 20 0 DIADLO Clc1ccc(C[N@@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)nn1 ZINC000877607864 1043778177 /nfs/dbraw/zinc/77/81/77/1043778177.db2.gz MXXDINIDPNLYIX-QGZVFWFLSA-N 1 2 311.816 4.023 20 0 DIADLO Clc1ccc(C[N@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)nn1 ZINC000877607864 1043778207 /nfs/dbraw/zinc/77/82/07/1043778207.db2.gz MXXDINIDPNLYIX-QGZVFWFLSA-N 1 2 311.816 4.023 20 0 DIADLO Fc1ccc2occ(C[N@@H+]3CCC[C@H]3c3nccs3)c2c1 ZINC001141854795 1043781370 /nfs/dbraw/zinc/78/13/70/1043781370.db2.gz PWWUJFGGBMIZMH-AWEZNQCLSA-N 1 2 302.374 4.366 20 0 DIADLO Fc1ccc2occ(C[N@H+]3CCC[C@H]3c3nccs3)c2c1 ZINC001141854795 1043781379 /nfs/dbraw/zinc/78/13/79/1043781379.db2.gz PWWUJFGGBMIZMH-AWEZNQCLSA-N 1 2 302.374 4.366 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)Nc1c[nH+]cc2c1CCCC2 ZINC000877621499 1043781509 /nfs/dbraw/zinc/78/15/09/1043781509.db2.gz XXLFYBGAQLORHC-ASSNKEHSSA-N 1 2 310.378 4.095 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)Nc1c[nH+]cc2c1CCCC2 ZINC000877621505 1043781582 /nfs/dbraw/zinc/78/15/82/1043781582.db2.gz XXLFYBGAQLORHC-ZSEKCTLFSA-N 1 2 310.378 4.095 20 0 DIADLO Cc1cc(C[NH2+]C(C)(C)c2nc3cc(Cl)ccc3o2)sn1 ZINC000877669129 1043787510 /nfs/dbraw/zinc/78/75/10/1043787510.db2.gz VHZUCLIFFUDOFL-UHFFFAOYSA-N 1 2 321.833 4.271 20 0 DIADLO CCc1cnc(C[N@H+](C)CCSc2ccccc2F)s1 ZINC000355781332 1043787611 /nfs/dbraw/zinc/78/76/11/1043787611.db2.gz BOUFNFNWXGDJAD-UHFFFAOYSA-N 1 2 310.463 4.069 20 0 DIADLO CCc1cnc(C[N@@H+](C)CCSc2ccccc2F)s1 ZINC000355781332 1043787616 /nfs/dbraw/zinc/78/76/16/1043787616.db2.gz BOUFNFNWXGDJAD-UHFFFAOYSA-N 1 2 310.463 4.069 20 0 DIADLO COC(=O)c1cc(NCc2c[nH+]cn2C(C)C)cc2ccccc21 ZINC000877768730 1043796964 /nfs/dbraw/zinc/79/69/64/1043796964.db2.gz ZDXZEVIWWOXKHY-UHFFFAOYSA-N 1 2 323.396 4.016 20 0 DIADLO Cc1cc(C)c(NC(=O)CCOc2cccc(C)c2C)c(C)[nH+]1 ZINC000097214168 1043797791 /nfs/dbraw/zinc/79/77/91/1043797791.db2.gz SPDDNXOPSNRSAF-UHFFFAOYSA-N 1 2 312.413 4.031 20 0 DIADLO FC(F)(F)c1cscc1C[N@@H+]1CCc2ccsc2C1 ZINC000356124614 1043812647 /nfs/dbraw/zinc/81/26/47/1043812647.db2.gz JQQRJERQHLHHKS-UHFFFAOYSA-N 1 2 303.374 4.387 20 0 DIADLO FC(F)(F)c1cscc1C[N@H+]1CCc2ccsc2C1 ZINC000356124614 1043812659 /nfs/dbraw/zinc/81/26/59/1043812659.db2.gz JQQRJERQHLHHKS-UHFFFAOYSA-N 1 2 303.374 4.387 20 0 DIADLO COCCSc1ccc([C@H](C)[NH2+][C@H](C)c2ncc(C)o2)cc1 ZINC000356273043 1043827296 /nfs/dbraw/zinc/82/72/96/1043827296.db2.gz QSHATBCDMGWLGT-UONOGXRCSA-N 1 2 320.458 4.133 20 0 DIADLO Brc1cccnc1C[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000877961303 1043832727 /nfs/dbraw/zinc/83/27/27/1043832727.db2.gz NQQWXSICTWKZDX-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cccnc1C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000877961303 1043832745 /nfs/dbraw/zinc/83/27/45/1043832745.db2.gz NQQWXSICTWKZDX-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2nc3c(o2)CCCC3)c1 ZINC000877985174 1043835458 /nfs/dbraw/zinc/83/54/58/1043835458.db2.gz UYQLDIOJNPYGJS-MRXNPFEDSA-N 1 2 300.377 4.030 20 0 DIADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2nc3c(o2)CCCC3)c1 ZINC000877985174 1043835481 /nfs/dbraw/zinc/83/54/81/1043835481.db2.gz UYQLDIOJNPYGJS-MRXNPFEDSA-N 1 2 300.377 4.030 20 0 DIADLO COc1ccccc1-c1nc(C[N@H+](C)[C@H](C)c2ccco2)co1 ZINC000878003032 1043837176 /nfs/dbraw/zinc/83/71/76/1043837176.db2.gz SDMBBBWMDAJSIB-CYBMUJFWSA-N 1 2 312.369 4.136 20 0 DIADLO COc1ccccc1-c1nc(C[N@@H+](C)[C@H](C)c2ccco2)co1 ZINC000878003032 1043837186 /nfs/dbraw/zinc/83/71/86/1043837186.db2.gz SDMBBBWMDAJSIB-CYBMUJFWSA-N 1 2 312.369 4.136 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1coc(C(C)(C)C)n1 ZINC000929766004 1043837669 /nfs/dbraw/zinc/83/76/69/1043837669.db2.gz HEDXHQIJMGJHMO-INIZCTEOSA-N 1 2 301.434 4.038 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1coc(C(C)(C)C)n1 ZINC000929766004 1043837683 /nfs/dbraw/zinc/83/76/83/1043837683.db2.gz HEDXHQIJMGJHMO-INIZCTEOSA-N 1 2 301.434 4.038 20 0 DIADLO CC(C)(C)c1cc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)no1 ZINC000289651723 1043858602 /nfs/dbraw/zinc/85/86/02/1043858602.db2.gz XKHPFZQLLHCDBC-UHFFFAOYSA-N 1 2 308.372 4.275 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1coc(C(C)(C)C)n1)CCC2 ZINC000929975361 1043862667 /nfs/dbraw/zinc/86/26/67/1043862667.db2.gz FPDVTKKJDMXFJJ-AWEZNQCLSA-N 1 2 319.474 4.246 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1coc(C(C)(C)C)n1)CCC2 ZINC000929975361 1043862689 /nfs/dbraw/zinc/86/26/89/1043862689.db2.gz FPDVTKKJDMXFJJ-AWEZNQCLSA-N 1 2 319.474 4.246 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)c(C)nn1 ZINC000930041470 1043871404 /nfs/dbraw/zinc/87/14/04/1043871404.db2.gz BUOVBHOACKKFPJ-SFHVURJKSA-N 1 2 317.383 4.099 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)c(C)nn1 ZINC000930041470 1043871422 /nfs/dbraw/zinc/87/14/22/1043871422.db2.gz BUOVBHOACKKFPJ-SFHVURJKSA-N 1 2 317.383 4.099 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C(F)(F)F)co1)c1ccc(F)cc1F ZINC000878345352 1043872574 /nfs/dbraw/zinc/87/25/74/1043872574.db2.gz MKDCKDBNGYLHTD-MRVPVSSYSA-N 1 2 305.246 4.427 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(F)(F)F)co1)c1ccc(F)cc1F ZINC000878345353 1043873869 /nfs/dbraw/zinc/87/38/69/1043873869.db2.gz MKDCKDBNGYLHTD-QMMMGPOBSA-N 1 2 305.246 4.427 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1c(Cl)cncc1Cl ZINC000878344480 1043874756 /nfs/dbraw/zinc/87/47/56/1043874756.db2.gz DSVHUDQIWIYANM-SNVBAGLBSA-N 1 2 311.212 4.248 20 0 DIADLO COc1cccc([C@H](C)[NH2+]Cc2noc3c2CC(C)(C)CC3)c1 ZINC000878351468 1043876685 /nfs/dbraw/zinc/87/66/85/1043876685.db2.gz YSYKLFMCTYOTAC-ZDUSSCGKSA-N 1 2 314.429 4.049 20 0 DIADLO C[C@@H]([NH2+]Cc1scnc1Cl)c1ccc(F)cc1Cl ZINC000878363955 1043879143 /nfs/dbraw/zinc/87/91/43/1043879143.db2.gz BXOCWNCIUXZRDU-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2ccc(C)c(Cl)n2)C2CC2)n1 ZINC000878378160 1043883146 /nfs/dbraw/zinc/88/31/46/1043883146.db2.gz LDLLWYYIWDKDBU-ZDUSSCGKSA-N 1 2 307.850 4.049 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2ccc(C)c(Cl)n2)C2CC2)n1 ZINC000878378159 1043883465 /nfs/dbraw/zinc/88/34/65/1043883465.db2.gz LDLLWYYIWDKDBU-CYBMUJFWSA-N 1 2 307.850 4.049 20 0 DIADLO CCOc1ccc([C@@H]2CCCN2c2cc(C)[nH+]c(CC)n2)cc1 ZINC000561107679 1043886469 /nfs/dbraw/zinc/88/64/69/1043886469.db2.gz NNQGCLOEHVTLDD-KRWDZBQOSA-N 1 2 311.429 4.088 20 0 DIADLO CC[C@H]([NH2+]Cc1c(Cl)cncc1Cl)c1c(C)noc1C ZINC000878414201 1043886979 /nfs/dbraw/zinc/88/69/79/1043886979.db2.gz OTRNDSREFXKWMP-ZDUSSCGKSA-N 1 2 314.216 4.234 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1nc2c(o1)CCCC2 ZINC000878416912 1043888395 /nfs/dbraw/zinc/88/83/95/1043888395.db2.gz UPSUFLWVLVHGKQ-ZDUSSCGKSA-N 1 2 310.397 4.459 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CCC2)no1)c1csc2ccccc12 ZINC000878420973 1043889216 /nfs/dbraw/zinc/88/92/16/1043889216.db2.gz RUFIVVUFHHOLSM-LLVKDONJSA-N 1 2 313.426 4.403 20 0 DIADLO C[C@H]([NH2+]Cc1coc(C(C)(C)C)n1)c1ccc(OC(F)F)cc1 ZINC000930196760 1043889653 /nfs/dbraw/zinc/88/96/53/1043889653.db2.gz JSGDKSFYZBUGRN-NSHDSACASA-N 1 2 324.371 4.424 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1nc(C(C)C)ns1 ZINC000930200500 1043890322 /nfs/dbraw/zinc/89/03/22/1043890322.db2.gz IWGQVVLFXVOLRL-CQSZACIVSA-N 1 2 319.474 4.301 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(C)c(Cl)n2)o1 ZINC000878441152 1043891219 /nfs/dbraw/zinc/89/12/19/1043891219.db2.gz QQBQZKJTMSQPID-HNNXBMFYSA-N 1 2 320.820 4.120 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(C)c(Cl)n2)o1 ZINC000878441152 1043891243 /nfs/dbraw/zinc/89/12/43/1043891243.db2.gz QQBQZKJTMSQPID-HNNXBMFYSA-N 1 2 320.820 4.120 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccc2ncsc2c1 ZINC000878458818 1043896811 /nfs/dbraw/zinc/89/68/11/1043896811.db2.gz XMYXKVZJIBZBGG-LLVKDONJSA-N 1 2 313.426 4.014 20 0 DIADLO COc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1c(F)cncc1F ZINC000930232216 1043902195 /nfs/dbraw/zinc/90/21/95/1043902195.db2.gz BFLYRCBPELVPAT-QGZVFWFLSA-N 1 2 320.383 4.245 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@@H](C)C(=O)Nc1c(C)cccc1Cl ZINC000878643579 1043908640 /nfs/dbraw/zinc/90/86/40/1043908640.db2.gz MVNLKAXSTTUAFU-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@@H](C)C(=O)Nc1c(C)cccc1Cl ZINC000878643579 1043908648 /nfs/dbraw/zinc/90/86/48/1043908648.db2.gz MVNLKAXSTTUAFU-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+]Cc2nnc(CC)s2)cc1 ZINC000290142292 1043921972 /nfs/dbraw/zinc/92/19/72/1043921972.db2.gz KRTBMGBDCQYFJV-ZDUSSCGKSA-N 1 2 319.474 4.130 20 0 DIADLO COc1nnc(C[N@H+]([C@H](C)c2ccccc2)C2CCCC2)s1 ZINC000930435398 1043926608 /nfs/dbraw/zinc/92/66/08/1043926608.db2.gz LOWBSLBRDRFKQA-CYBMUJFWSA-N 1 2 317.458 4.053 20 0 DIADLO COc1nnc(C[N@@H+]([C@H](C)c2ccccc2)C2CCCC2)s1 ZINC000930435398 1043926624 /nfs/dbraw/zinc/92/66/24/1043926624.db2.gz LOWBSLBRDRFKQA-CYBMUJFWSA-N 1 2 317.458 4.053 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccccc1F ZINC000878918045 1043929006 /nfs/dbraw/zinc/92/90/06/1043929006.db2.gz CNPMMPMSBJETIS-SFHVURJKSA-N 1 2 302.393 4.179 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2cc3cc(C)c(C)cc3o2)s1 ZINC000290257503 1043933720 /nfs/dbraw/zinc/93/37/20/1043933720.db2.gz UUJGCMZABCVPCU-LBPRGKRZSA-N 1 2 315.442 4.314 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2ccc(Cl)cc2)n1)c1cccnc1 ZINC000357290821 1043936471 /nfs/dbraw/zinc/93/64/71/1043936471.db2.gz QNEJUVDZNMWUQQ-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC000290368279 1043944966 /nfs/dbraw/zinc/94/49/66/1043944966.db2.gz HGWHDCBFVKNRFE-GOSISDBHSA-N 1 2 306.413 4.055 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC000290368279 1043944974 /nfs/dbraw/zinc/94/49/74/1043944974.db2.gz HGWHDCBFVKNRFE-GOSISDBHSA-N 1 2 306.413 4.055 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccc(F)c(Cl)c1)C1CC1)c1ncccn1 ZINC000930610715 1043948735 /nfs/dbraw/zinc/94/87/35/1043948735.db2.gz DUIQDUAZNQALFE-BONVTDFDSA-N 1 2 305.784 4.071 20 0 DIADLO Cc1cccc2c(C[N@@H+]3CCc4ccc(Cl)cc4C3)[nH]nc21 ZINC001137141925 1043953372 /nfs/dbraw/zinc/95/33/72/1043953372.db2.gz NSPASEVDAUKJAQ-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1cccc2c(C[N@H+]3CCc4ccc(Cl)cc4C3)[nH]nc21 ZINC001137141925 1043953379 /nfs/dbraw/zinc/95/33/79/1043953379.db2.gz NSPASEVDAUKJAQ-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO CC(C)(C)OC1CC[NH+](Cc2ccnc(Cl)c2Cl)CC1 ZINC000290479809 1043956140 /nfs/dbraw/zinc/95/61/40/1043956140.db2.gz QVOAGSAJDBYJNM-UHFFFAOYSA-N 1 2 317.260 4.168 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2csnn2)C2CCCCC2)cc1 ZINC000639377466 1043957173 /nfs/dbraw/zinc/95/71/73/1043957173.db2.gz DRZAXAMEBVFXBZ-INIZCTEOSA-N 1 2 305.422 4.088 20 0 DIADLO CC(C)(C)c1nc(C[NH2+]C2(c3cccc(F)c3)CCC2)co1 ZINC000930814278 1043965761 /nfs/dbraw/zinc/96/57/61/1043965761.db2.gz MTQRRAACQYDVIL-UHFFFAOYSA-N 1 2 302.393 4.280 20 0 DIADLO Fc1cncc(F)c1C[NH2+]C1(c2ccccc2Cl)CCC1 ZINC000930842781 1043967830 /nfs/dbraw/zinc/96/78/30/1043967830.db2.gz JKMXSKXDLVPBKK-UHFFFAOYSA-N 1 2 308.759 4.182 20 0 DIADLO CC(C)c1nsc(C[NH2+][C@@H](c2ccccc2F)C(C)C)n1 ZINC000930970115 1043978517 /nfs/dbraw/zinc/97/85/17/1043978517.db2.gz YDKOBMHLXGJZLE-OAHLLOKOSA-N 1 2 307.438 4.288 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+](C)Cc2ccc3cc[nH]c3c2)n1 ZINC000879728386 1043984016 /nfs/dbraw/zinc/98/40/16/1043984016.db2.gz ROLRJRQQDWCTOM-ZDUSSCGKSA-N 1 2 312.417 4.087 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+](C)Cc2ccc3cc[nH]c3c2)n1 ZINC000879728386 1043984027 /nfs/dbraw/zinc/98/40/27/1043984027.db2.gz ROLRJRQQDWCTOM-ZDUSSCGKSA-N 1 2 312.417 4.087 20 0 DIADLO CCCc1nc(C[N@@H+]2CCC[C@H]2c2cncc(C)c2)cs1 ZINC000879749050 1043988013 /nfs/dbraw/zinc/98/80/13/1043988013.db2.gz SRJCBQSXKBFTLD-INIZCTEOSA-N 1 2 301.459 4.136 20 0 DIADLO CCCc1nc(C[N@H+]2CCC[C@H]2c2cncc(C)c2)cs1 ZINC000879749050 1043988025 /nfs/dbraw/zinc/98/80/25/1043988025.db2.gz SRJCBQSXKBFTLD-INIZCTEOSA-N 1 2 301.459 4.136 20 0 DIADLO Cc1ccc2c(c1C)OC[C@@H]2[NH2+]Cc1ccnc(Cl)c1Cl ZINC000290791929 1043987887 /nfs/dbraw/zinc/98/78/87/1043987887.db2.gz DFWNNALUTNMNFJ-ZDUSSCGKSA-N 1 2 323.223 4.229 20 0 DIADLO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2cc(C(F)(F)F)co2)c1 ZINC000879752324 1043990115 /nfs/dbraw/zinc/99/01/15/1043990115.db2.gz OVIMEKDJMBXTFT-HNNXBMFYSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1cncc([C@@H]2CCC[N@H+]2Cc2cc(C(F)(F)F)co2)c1 ZINC000879752324 1043990122 /nfs/dbraw/zinc/99/01/22/1043990122.db2.gz OVIMEKDJMBXTFT-HNNXBMFYSA-N 1 2 310.319 4.339 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(C(C)(C)C)n1)c1ccc2c(c1)CCCO2 ZINC000931080502 1043990250 /nfs/dbraw/zinc/99/02/50/1043990250.db2.gz RSDMLVVDTQOTPF-CYBMUJFWSA-N 1 2 314.429 4.148 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1nccc2ccccc21 ZINC000290847812 1043992898 /nfs/dbraw/zinc/99/28/98/1043992898.db2.gz ZGUNNWYHDINNKR-OAHLLOKOSA-N 1 2 318.424 4.403 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)CC(C)(C)CC(F)F ZINC000879842940 1043995137 /nfs/dbraw/zinc/99/51/37/1043995137.db2.gz ZJGNNYRMGJAECE-UHFFFAOYSA-N 1 2 321.371 4.395 20 0 DIADLO Fc1cc(C[NH+]2CCCCCC2)c(F)cc1Br ZINC001141910018 1043995281 /nfs/dbraw/zinc/99/52/81/1043995281.db2.gz IESGLMDAWSTFDE-UHFFFAOYSA-N 1 2 304.178 4.103 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(C(F)(F)F)nc2Cl)CCS1 ZINC001308619444 1044003842 /nfs/dbraw/zinc/00/38/42/1044003842.db2.gz NAEHVAXYXWWBQN-UHFFFAOYSA-N 1 2 324.799 4.081 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(C(F)(F)F)nc2Cl)CCS1 ZINC001308619444 1044003856 /nfs/dbraw/zinc/00/38/56/1044003856.db2.gz NAEHVAXYXWWBQN-UHFFFAOYSA-N 1 2 324.799 4.081 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2oc3ccc(F)cc3c2C)cs1 ZINC000358034670 1044010113 /nfs/dbraw/zinc/01/01/13/1044010113.db2.gz HNQYTWIUNYPCIG-SNVBAGLBSA-N 1 2 304.390 4.496 20 0 DIADLO CC[C@@H]1CCC[N@@H+]1Cc1cc(F)c(Br)cc1F ZINC001141915691 1044014573 /nfs/dbraw/zinc/01/45/73/1044014573.db2.gz MTUBBYRLLBXHKT-SNVBAGLBSA-N 1 2 304.178 4.102 20 0 DIADLO CC[C@@H]1CCC[N@H+]1Cc1cc(F)c(Br)cc1F ZINC001141915691 1044014590 /nfs/dbraw/zinc/01/45/90/1044014590.db2.gz MTUBBYRLLBXHKT-SNVBAGLBSA-N 1 2 304.178 4.102 20 0 DIADLO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1csc(C(F)(F)F)n1 ZINC000896797446 1044015344 /nfs/dbraw/zinc/01/53/44/1044015344.db2.gz JALNEJQPJZEYQB-SECBINFHSA-N 1 2 318.339 4.460 20 0 DIADLO Clc1ccc(C[N@@H+]2CC[C@H](Oc3ccccc3Cl)C2)cn1 ZINC000128372783 1044031088 /nfs/dbraw/zinc/03/10/88/1044031088.db2.gz PWLMWSVMFJKPSP-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccc(C[N@H+]2CC[C@H](Oc3ccccc3Cl)C2)cn1 ZINC000128372783 1044031103 /nfs/dbraw/zinc/03/11/03/1044031103.db2.gz PWLMWSVMFJKPSP-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCO[C@H](c3ccccc3)C2)cc1F ZINC000561945952 1044034173 /nfs/dbraw/zinc/03/41/73/1044034173.db2.gz ZVWGIMXEJYKZSG-HMECNJMJSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCO[C@H](c3ccccc3)C2)cc1F ZINC000561945952 1044034188 /nfs/dbraw/zinc/03/41/88/1044034188.db2.gz ZVWGIMXEJYKZSG-HMECNJMJSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCO[C@H](c3ccccc3)C2)cc1F ZINC000561945962 1044034582 /nfs/dbraw/zinc/03/45/82/1044034582.db2.gz ZVWGIMXEJYKZSG-PXPVJAHISA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCO[C@H](c3ccccc3)C2)cc1F ZINC000561945962 1044034596 /nfs/dbraw/zinc/03/45/96/1044034596.db2.gz ZVWGIMXEJYKZSG-PXPVJAHISA-N 1 2 315.363 4.052 20 0 DIADLO CCSc1ccccc1[C@H](C)[NH2+][C@@H](C)c1nnc(C(C)C)[nH]1 ZINC000358231690 1044035937 /nfs/dbraw/zinc/03/59/37/1044035937.db2.gz ADSFLPLKLORZSG-STQMWFEESA-N 1 2 318.490 4.452 20 0 DIADLO CC(C)c1nnc([C@H](C)[NH2+][C@@H]2C[C@@H](C)Sc3sccc32)[nH]1 ZINC000358249874 1044041388 /nfs/dbraw/zinc/04/13/88/1044041388.db2.gz JSIZSZVWUDLCAE-JFGNBEQYSA-N 1 2 322.503 4.266 20 0 DIADLO CCn1c(C[N@H+](CC)[C@H](C)c2cccnc2)nc2ccccc21 ZINC000561984434 1044043946 /nfs/dbraw/zinc/04/39/46/1044043946.db2.gz YUGLMAJZXUIFGE-OAHLLOKOSA-N 1 2 308.429 4.034 20 0 DIADLO CCn1c(C[N@@H+](CC)[C@H](C)c2cccnc2)nc2ccccc21 ZINC000561984434 1044043957 /nfs/dbraw/zinc/04/39/57/1044043957.db2.gz YUGLMAJZXUIFGE-OAHLLOKOSA-N 1 2 308.429 4.034 20 0 DIADLO C[N@H+](Cn1nc2sc3ccccc3n2c1=S)CC(C)(C)C ZINC000738091159 1044044721 /nfs/dbraw/zinc/04/47/21/1044044721.db2.gz WIJRPQAAMUDVAV-UHFFFAOYSA-N 1 2 320.487 4.015 20 0 DIADLO C[N@@H+](Cn1nc2sc3ccccc3n2c1=S)CC(C)(C)C ZINC000738091159 1044044737 /nfs/dbraw/zinc/04/47/37/1044044737.db2.gz WIJRPQAAMUDVAV-UHFFFAOYSA-N 1 2 320.487 4.015 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nnc(C(C)C)s2)cc(C)c1F ZINC000358294173 1044050471 /nfs/dbraw/zinc/05/04/71/1044050471.db2.gz YOEHYIQHJWZBAX-LBPRGKRZSA-N 1 2 307.438 4.268 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1csc(-c2ccccc2F)n1)c1cn[nH]c1 ZINC000291383504 1044068244 /nfs/dbraw/zinc/06/82/44/1044068244.db2.gz ZPVHCWLVTDSVKC-GHMZBOCLSA-N 1 2 316.405 4.084 20 0 DIADLO COc1c(F)c(F)ccc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001211889147 1044072824 /nfs/dbraw/zinc/07/28/24/1044072824.db2.gz HWVWVZKOIDAFJP-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@@H+]1CCC(F)(F)[C@@H](CO)C1 ZINC000291700342 1044097232 /nfs/dbraw/zinc/09/72/32/1044097232.db2.gz IAJZJRLLBAXQQB-NXEZZACHSA-N 1 2 324.198 4.004 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@H+]1CCC(F)(F)[C@@H](CO)C1 ZINC000291700342 1044097245 /nfs/dbraw/zinc/09/72/45/1044097245.db2.gz IAJZJRLLBAXQQB-NXEZZACHSA-N 1 2 324.198 4.004 20 0 DIADLO CC(C)[C@]1(C)C[C@H]1c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000346378453 1044098697 /nfs/dbraw/zinc/09/86/97/1044098697.db2.gz BMMDVRMSCREOBQ-YJBOKZPZSA-N 1 2 308.385 4.072 20 0 DIADLO Cc1nnc(C[N@H+]2CCC[C@H]2c2ccc(C(C)C)cc2)s1 ZINC000358858062 1044105252 /nfs/dbraw/zinc/10/52/52/1044105252.db2.gz IMMCRYYKCYUYJJ-INIZCTEOSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1nnc(C[N@@H+]2CCC[C@H]2c2ccc(C(C)C)cc2)s1 ZINC000358858062 1044105261 /nfs/dbraw/zinc/10/52/61/1044105261.db2.gz IMMCRYYKCYUYJJ-INIZCTEOSA-N 1 2 301.459 4.307 20 0 DIADLO Clc1cccnc1C[NH2+][C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000932212295 1044109620 /nfs/dbraw/zinc/10/96/20/1044109620.db2.gz AEFIAHRYLPORJA-OAHLLOKOSA-N 1 2 314.816 4.271 20 0 DIADLO CSc1cc(C[NH2+][C@H](C)c2csc(C(C)C)n2)ccn1 ZINC000346568375 1044115268 /nfs/dbraw/zinc/11/52/68/1044115268.db2.gz NZAMNBWTXCSFRB-LLVKDONJSA-N 1 2 307.488 4.234 20 0 DIADLO C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000932330397 1044117768 /nfs/dbraw/zinc/11/77/68/1044117768.db2.gz MPQMRHJSQPDVRT-AWEZNQCLSA-N 1 2 319.408 4.004 20 0 DIADLO C[C@H](C1CC1)N(Cc1ccccc1)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000932330400 1044118709 /nfs/dbraw/zinc/11/87/09/1044118709.db2.gz MPQMRHJSQPDVRT-CQSZACIVSA-N 1 2 319.408 4.004 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](c2ccccn2)C2CC2)cs1 ZINC000932379235 1044121527 /nfs/dbraw/zinc/12/15/27/1044121527.db2.gz NHHVECLIIVYLOB-KRWDZBQOSA-N 1 2 301.459 4.122 20 0 DIADLO O=C(Nc1cccc(C2CCC2)c1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000291975096 1044121634 /nfs/dbraw/zinc/12/16/34/1044121634.db2.gz DZODBSSTFDIION-INIZCTEOSA-N 1 2 324.428 4.089 20 0 DIADLO Clc1cncc(Cl)c1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC000932385945 1044123806 /nfs/dbraw/zinc/12/38/06/1044123806.db2.gz MHBTWEFELSOXKD-HNNXBMFYSA-N 1 2 308.212 4.024 20 0 DIADLO CC(C)C[N@H+](Cc1csc(C2CC2)n1)Cc1ccccn1 ZINC000932448496 1044129883 /nfs/dbraw/zinc/12/98/83/1044129883.db2.gz AMRYKDWNRRUWEP-UHFFFAOYSA-N 1 2 301.459 4.074 20 0 DIADLO CC(C)C[N@@H+](Cc1csc(C2CC2)n1)Cc1ccccn1 ZINC000932448496 1044129887 /nfs/dbraw/zinc/12/98/87/1044129887.db2.gz AMRYKDWNRRUWEP-UHFFFAOYSA-N 1 2 301.459 4.074 20 0 DIADLO CC(C)(C)CCC[S@](=O)Cc1c[nH+]cn1Cc1ccccc1 ZINC000359100446 1044130836 /nfs/dbraw/zinc/13/08/36/1044130836.db2.gz BFZFNYKLCBKQNF-QFIPXVFZSA-N 1 2 318.486 4.006 20 0 DIADLO O=C(CCn1cc[nH+]c1)Nc1ccccc1Sc1ccccc1 ZINC000346766015 1044140428 /nfs/dbraw/zinc/14/04/28/1044140428.db2.gz GVJBYLTXXBCMGV-UHFFFAOYSA-N 1 2 323.421 4.063 20 0 DIADLO CC[C@H]([NH2+][C@H](c1nccn1C)c1ccccc1)c1ccsc1 ZINC000562774804 1044155749 /nfs/dbraw/zinc/15/57/49/1044155749.db2.gz IAJZBWDRKMEREN-IRXDYDNUSA-N 1 2 311.454 4.312 20 0 DIADLO CC(C)c1nc(C[N@H+](C)Cc2cccc3cccnc32)cs1 ZINC001137176625 1044162437 /nfs/dbraw/zinc/16/24/37/1044162437.db2.gz BAPPDCUFZBKAEZ-UHFFFAOYSA-N 1 2 311.454 4.447 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)Cc2cccc3cccnc32)cs1 ZINC001137176625 1044162441 /nfs/dbraw/zinc/16/24/41/1044162441.db2.gz BAPPDCUFZBKAEZ-UHFFFAOYSA-N 1 2 311.454 4.447 20 0 DIADLO Cc1c2cc(F)ccc2oc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000359413562 1044164631 /nfs/dbraw/zinc/16/46/31/1044164631.db2.gz KWNSYFISAXKZOR-UHFFFAOYSA-N 1 2 312.344 4.453 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3n2C)o1 ZINC000562853066 1044168723 /nfs/dbraw/zinc/16/87/23/1044168723.db2.gz LNVUWOKDDMXZCR-SFHVURJKSA-N 1 2 309.413 4.202 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3n2C)o1 ZINC000562853066 1044168734 /nfs/dbraw/zinc/16/87/34/1044168734.db2.gz LNVUWOKDDMXZCR-SFHVURJKSA-N 1 2 309.413 4.202 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(C4CCC4)cc3)ccc2[nH+]1 ZINC000359526681 1044174707 /nfs/dbraw/zinc/17/47/07/1044174707.db2.gz PYBCGGIOYKAPNG-UHFFFAOYSA-N 1 2 305.381 4.163 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+]2CCC[C@@H]2c2cccnc2)n1 ZINC000346977644 1044178048 /nfs/dbraw/zinc/17/80/48/1044178048.db2.gz KIIDYWPXGFQGIB-CQSZACIVSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1csc(C[N@H+]2CCC[C@@H]2c2cccnc2)n1 ZINC000346977644 1044178053 /nfs/dbraw/zinc/17/80/53/1044178053.db2.gz KIIDYWPXGFQGIB-CQSZACIVSA-N 1 2 301.459 4.173 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccc1Cl)c1cc(Cl)cc2c1OCC2 ZINC000933269155 1044190855 /nfs/dbraw/zinc/19/08/55/1044190855.db2.gz FHVZBBUKLHWMKS-SNVBAGLBSA-N 1 2 323.223 4.174 20 0 DIADLO CCn1cnc2c1CC[N@@H+]([C@H](C)c1ccc(C(F)(F)F)cc1)C2 ZINC000933263176 1044190969 /nfs/dbraw/zinc/19/09/69/1044190969.db2.gz YNRLOLVCKSXHOP-GFCCVEGCSA-N 1 2 323.362 4.041 20 0 DIADLO CCn1cnc2c1CC[N@H+]([C@H](C)c1ccc(C(F)(F)F)cc1)C2 ZINC000933263176 1044190975 /nfs/dbraw/zinc/19/09/75/1044190975.db2.gz YNRLOLVCKSXHOP-GFCCVEGCSA-N 1 2 323.362 4.041 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2ccccc2SC)cs1 ZINC000281826828 1044198316 /nfs/dbraw/zinc/19/83/16/1044198316.db2.gz XKQMBZVEWXUVKU-RYUDHWBXSA-N 1 2 322.499 4.423 20 0 DIADLO Cc1cc(Cl)nc(C[NH2+]Cc2ncc(C(C)(C)C)s2)c1 ZINC000281851287 1044201417 /nfs/dbraw/zinc/20/14/17/1044201417.db2.gz BHFOKDMIPCONTD-UHFFFAOYSA-N 1 2 309.866 4.087 20 0 DIADLO CCO[C@@H]1C[C@H](Nc2cc(CSCC)cc[nH+]2)C12CCC2 ZINC000347205763 1044205586 /nfs/dbraw/zinc/20/55/86/1044205586.db2.gz QDPFPPGNZVVEHT-LSDHHAIUSA-N 1 2 306.475 4.094 20 0 DIADLO COc1ccncc1C[N@H+](CCC(F)(F)F)Cc1ccccc1 ZINC000347206786 1044207898 /nfs/dbraw/zinc/20/78/98/1044207898.db2.gz RUEOGNQCWAUAEC-UHFFFAOYSA-N 1 2 324.346 4.045 20 0 DIADLO COc1ccncc1C[N@@H+](CCC(F)(F)F)Cc1ccccc1 ZINC000347206786 1044207910 /nfs/dbraw/zinc/20/79/10/1044207910.db2.gz RUEOGNQCWAUAEC-UHFFFAOYSA-N 1 2 324.346 4.045 20 0 DIADLO Clc1cccc(-c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)c1 ZINC000522822343 1044208435 /nfs/dbraw/zinc/20/84/35/1044208435.db2.gz SXRUOBGKVIVLOL-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO CCSCc1cc[nH+]c(N[C@H](COC)Cc2ccccc2)c1 ZINC000347196958 1044208864 /nfs/dbraw/zinc/20/88/64/1044208864.db2.gz CGWAQUUWMWAEKX-KRWDZBQOSA-N 1 2 316.470 4.004 20 0 DIADLO C[C@H]1CSCC[N@H+]1Cc1nc(-c2ccccc2Cl)cs1 ZINC000359868108 1044211635 /nfs/dbraw/zinc/21/16/35/1044211635.db2.gz BYVAATZNXHUDDC-NSHDSACASA-N 1 2 324.902 4.401 20 0 DIADLO C[C@H]1CSCC[N@@H+]1Cc1nc(-c2ccccc2Cl)cs1 ZINC000359868108 1044211624 /nfs/dbraw/zinc/21/16/24/1044211624.db2.gz BYVAATZNXHUDDC-NSHDSACASA-N 1 2 324.902 4.401 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nc(C(C)C)c[nH]1)c1ccc(F)cc1F ZINC000883040995 1044216460 /nfs/dbraw/zinc/21/64/60/1044216460.db2.gz VERRDKAKDSXOGZ-OAHLLOKOSA-N 1 2 307.388 4.442 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+]Cc1nc(C(C)C)c[nH]1 ZINC000883037698 1044216876 /nfs/dbraw/zinc/21/68/76/1044216876.db2.gz ICSUYYRJZTYUNA-HNNXBMFYSA-N 1 2 315.461 4.309 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nccn1-c1ccccc1)c1c(C)noc1C ZINC000347252572 1044217505 /nfs/dbraw/zinc/21/75/05/1044217505.db2.gz QSCSKEJVMJWWKY-RHSMWYFYSA-N 1 2 324.428 4.279 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)n1 ZINC000883083365 1044220401 /nfs/dbraw/zinc/22/04/01/1044220401.db2.gz JOMNUBQJKZBEOW-AWEZNQCLSA-N 1 2 319.836 4.190 20 0 DIADLO COc1ccccc1CSCc1[nH+]cc(C)c(OC)c1C ZINC000522848704 1044221725 /nfs/dbraw/zinc/22/17/25/1044221725.db2.gz NQFZRLMKKFUCEV-UHFFFAOYSA-N 1 2 303.427 4.149 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+]C2(c3ccccc3Cl)CCC2)n1 ZINC000883157677 1044226066 /nfs/dbraw/zinc/22/60/66/1044226066.db2.gz GIJMXQPYZSGRRP-UHFFFAOYSA-N 1 2 303.837 4.356 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nnc(C)s1)c1sccc1Cl ZINC000883215630 1044237312 /nfs/dbraw/zinc/23/73/12/1044237312.db2.gz CETUIBIWRYJFFW-XCBNKYQSSA-N 1 2 301.868 4.363 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+][C@H](CC2CCC2)c2ccccc2)o1 ZINC000778237707 1044240350 /nfs/dbraw/zinc/24/03/50/1044240350.db2.gz RKCKDNLZUMLKFC-MRXNPFEDSA-N 1 2 313.445 4.388 20 0 DIADLO CCc1noc(C)c1C[NH2+]Cc1csc(-c2ccsc2)n1 ZINC000293026230 1044241365 /nfs/dbraw/zinc/24/13/65/1044241365.db2.gz RCNMEIJOKNATAX-UHFFFAOYSA-N 1 2 319.455 4.020 20 0 DIADLO CCC[C@H]([NH2+]Cc1nnc(C(C)(C)C)[nH]1)c1ccc(F)cc1F ZINC000293046346 1044244794 /nfs/dbraw/zinc/24/47/94/1044244794.db2.gz XRFYXLJBESPWTC-AWEZNQCLSA-N 1 2 322.403 4.011 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)C[N@H+]2C[C@H](C)[C@@H]2C)cc1 ZINC000563320570 1044248174 /nfs/dbraw/zinc/24/81/74/1044248174.db2.gz OJEMPTROGPDRKJ-HOTGVXAUSA-N 1 2 324.424 4.066 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)C[N@@H+]2C[C@H](C)[C@@H]2C)cc1 ZINC000563320570 1044248186 /nfs/dbraw/zinc/24/81/86/1044248186.db2.gz OJEMPTROGPDRKJ-HOTGVXAUSA-N 1 2 324.424 4.066 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2OC(C)C)nn1C ZINC000883267316 1044254226 /nfs/dbraw/zinc/25/42/26/1044254226.db2.gz AISRFHCRHJRMJQ-CYBMUJFWSA-N 1 2 321.852 4.020 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+][C@@H](C)c1cscn1 ZINC000883267157 1044255384 /nfs/dbraw/zinc/25/53/84/1044255384.db2.gz UZSGTZOZBKLZCI-NSHDSACASA-N 1 2 310.850 4.435 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+][C@@H](C)c1nccs1 ZINC000883266899 1044255761 /nfs/dbraw/zinc/25/57/61/1044255761.db2.gz NKCFJWIZWMDJFD-NSHDSACASA-N 1 2 310.850 4.435 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCn2ccnc21)c1cc(Cl)ccc1Cl ZINC000655704143 1044258642 /nfs/dbraw/zinc/25/86/42/1044258642.db2.gz QSOXPULAMUTYEV-HZMBPMFUSA-N 1 2 310.228 4.376 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cc(C)ccc2OC(F)F)s1 ZINC000293228150 1044261803 /nfs/dbraw/zinc/26/18/03/1044261803.db2.gz QGWHREOLURKVPD-LLVKDONJSA-N 1 2 312.385 4.212 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cccc(Cl)c3)CCCCCC2)no1 ZINC000101546218 1044264433 /nfs/dbraw/zinc/26/44/33/1044264433.db2.gz IHMILPPWKQDIPM-UHFFFAOYSA-N 1 2 319.836 4.371 20 0 DIADLO C[NH+](C)C1(c2nc(C(C)(C)c3ccc4ccccc4c3)no2)CC1 ZINC000896945152 1044269846 /nfs/dbraw/zinc/26/98/46/1044269846.db2.gz OSJYTGMSUJPAHJ-UHFFFAOYSA-N 1 2 321.424 4.099 20 0 DIADLO Cc1cc(C)cc(C2CC[NH+](Cc3nc(C(F)F)no3)CC2)c1 ZINC000934799793 1044283079 /nfs/dbraw/zinc/28/30/79/1044283079.db2.gz PCPOMNFHQIGDEW-UHFFFAOYSA-N 1 2 321.371 4.004 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2cccc(O)c2Cl)C2CC2)n1 ZINC000293478553 1044289067 /nfs/dbraw/zinc/28/90/67/1044289067.db2.gz FOUPBPLMOVBTAQ-AWEZNQCLSA-N 1 2 308.834 4.051 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1csc(C2CC2)n1 ZINC000883378732 1044291933 /nfs/dbraw/zinc/29/19/33/1044291933.db2.gz WQSGXYYYOONZTK-UHFFFAOYSA-N 1 2 305.472 4.281 20 0 DIADLO Cc1noc([C@@H](C)[N@H+]2CC=C(c3cccc4ccccc43)CC2)n1 ZINC000063762521 1044299430 /nfs/dbraw/zinc/29/94/30/1044299430.db2.gz YSWTTYZXRQDDOO-CQSZACIVSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+]2CC=C(c3cccc4ccccc43)CC2)n1 ZINC000063762521 1044299443 /nfs/dbraw/zinc/29/94/43/1044299443.db2.gz YSWTTYZXRQDDOO-CQSZACIVSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@@H](C)c2ccncc2F)c2ccccn2)c1 ZINC000563670186 1044300913 /nfs/dbraw/zinc/30/09/13/1044300913.db2.gz LFRXMERHXHRIIG-MGPUTAFESA-N 1 2 321.399 4.364 20 0 DIADLO C[C@@H]1C[NH+](Cc2sccc2Oc2ccccc2)C[C@@H](C)O1 ZINC001141994615 1044303145 /nfs/dbraw/zinc/30/31/45/1044303145.db2.gz SKFYUHFBTZCVKZ-ZIAGYGMSSA-N 1 2 303.427 4.150 20 0 DIADLO Cn1c[nH+]cc1CSc1nc2ccccc2n1-c1ccccc1 ZINC000360727441 1044304882 /nfs/dbraw/zinc/30/48/82/1044304882.db2.gz WIVQEVIWGTVQAP-UHFFFAOYSA-N 1 2 320.421 4.051 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000360725707 1044305263 /nfs/dbraw/zinc/30/52/63/1044305263.db2.gz MQLXHNXCGJXGGK-SKDRFNHKSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1csc(C2CC2)n1 ZINC000360725707 1044305279 /nfs/dbraw/zinc/30/52/79/1044305279.db2.gz MQLXHNXCGJXGGK-SKDRFNHKSA-N 1 2 304.381 4.183 20 0 DIADLO Cc1ccc2c(Nc3cnc(C(F)(F)F)cn3)cccc2[nH+]1 ZINC001212795080 1044318116 /nfs/dbraw/zinc/31/81/16/1044318116.db2.gz MWYMUCROBLGIQN-UHFFFAOYSA-N 1 2 304.275 4.096 20 0 DIADLO FC(F)c1cc(NCCn2cc[nH+]c2)c2cc(Cl)ccc2n1 ZINC000360848743 1044320522 /nfs/dbraw/zinc/32/05/22/1044320522.db2.gz IKLCAVLLGUMZKV-UHFFFAOYSA-N 1 2 322.746 4.134 20 0 DIADLO CSCc1cnc(C[NH2+][C@@H](c2ncccc2C)C(C)C)s1 ZINC000293733987 1044321018 /nfs/dbraw/zinc/32/10/18/1044321018.db2.gz ZNJOFDFZDHKBDP-OAHLLOKOSA-N 1 2 321.515 4.196 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C)[C@H](C)c3cc(C)ccc3C)ccn12 ZINC000563897586 1044322659 /nfs/dbraw/zinc/32/26/59/1044322659.db2.gz ZPYVYZAZENINBI-MRXNPFEDSA-N 1 2 321.424 4.093 20 0 DIADLO c1cncc([C@H](Nc2ccc(N3CCCCC3)[nH+]c2)C2CCC2)c1 ZINC000360882025 1044323250 /nfs/dbraw/zinc/32/32/50/1044323250.db2.gz BYTAXDQILFWKAG-HXUWFJFHSA-N 1 2 322.456 4.420 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C)[C@@H](C)c3cc(C)ccc3C)ccn12 ZINC000563897583 1044323205 /nfs/dbraw/zinc/32/32/05/1044323205.db2.gz ZPYVYZAZENINBI-INIZCTEOSA-N 1 2 321.424 4.093 20 0 DIADLO Cc1ccc2c(Nc3ccnn3-c3ccccc3)cccc2[nH+]1 ZINC001212796017 1044323875 /nfs/dbraw/zinc/32/38/75/1044323875.db2.gz NRECXBZNAUYZCG-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(F)c(F)cc2F)c1 ZINC001137892577 1044327490 /nfs/dbraw/zinc/32/74/90/1044327490.db2.gz ZAPWAICOXNILEP-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2cc(F)c(F)cc2F)c1 ZINC001137892577 1044327502 /nfs/dbraw/zinc/32/75/02/1044327502.db2.gz ZAPWAICOXNILEP-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1cccc([C@@H]2C[N@H+](Cc3ccc4occc4c3)CCO2)c1 ZINC000564128712 1044343975 /nfs/dbraw/zinc/34/39/75/1044343975.db2.gz FGOGZMXTNQQSHA-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO Fc1cccc([C@@H]2C[N@@H+](Cc3ccc4occc4c3)CCO2)c1 ZINC000564128712 1044343990 /nfs/dbraw/zinc/34/39/90/1044343990.db2.gz FGOGZMXTNQQSHA-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C[C@@H]1CCCC1(F)F ZINC000935759229 1044363970 /nfs/dbraw/zinc/36/39/70/1044363970.db2.gz HSBZDGFXVHAIRX-ZDUSSCGKSA-N 1 2 319.355 4.149 20 0 DIADLO Cc1ccc2c(Nc3cccc4c3C(=O)N=NC4=O)cccc2[nH+]1 ZINC001212797691 1044366319 /nfs/dbraw/zinc/36/63/19/1044366319.db2.gz DRZYWVTUNPQWFL-UHFFFAOYSA-N 1 2 316.320 4.033 20 0 DIADLO Cc1ccc2c(Nc3cc(Cl)ccc3C(N)=O)cccc2[nH+]1 ZINC001212797632 1044367122 /nfs/dbraw/zinc/36/71/22/1044367122.db2.gz AOVUGOBBQVJDES-UHFFFAOYSA-N 1 2 311.772 4.039 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)cc1O ZINC000564429197 1044378444 /nfs/dbraw/zinc/37/84/44/1044378444.db2.gz NPQVIIBCJKCYFK-VBKZILBWSA-N 1 2 323.392 4.434 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000564474607 1044384984 /nfs/dbraw/zinc/38/49/84/1044384984.db2.gz VQDCKOXAWXUTBE-HXUWFJFHSA-N 1 2 323.415 4.127 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000564474607 1044384999 /nfs/dbraw/zinc/38/49/99/1044384999.db2.gz VQDCKOXAWXUTBE-HXUWFJFHSA-N 1 2 323.415 4.127 20 0 DIADLO C/C(=C/c1ccccc1OC(F)F)C[N@@H+](C)Cc1cc(C)on1 ZINC000564529812 1044388986 /nfs/dbraw/zinc/38/89/86/1044388986.db2.gz URPBNNQZXLEIBF-WQLSENKSSA-N 1 2 322.355 4.120 20 0 DIADLO C/C(=C/c1ccccc1OC(F)F)C[N@H+](C)Cc1cc(C)on1 ZINC000564529812 1044388992 /nfs/dbraw/zinc/38/89/92/1044388992.db2.gz URPBNNQZXLEIBF-WQLSENKSSA-N 1 2 322.355 4.120 20 0 DIADLO CSCc1cnc(C[NH2+][C@H](C)c2ccc(F)cc2F)s1 ZINC000294182108 1044390918 /nfs/dbraw/zinc/39/09/18/1044390918.db2.gz QNJCECLXRFQRBC-SECBINFHSA-N 1 2 314.426 4.135 20 0 DIADLO Cc1cnn(C)c1C[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000564611841 1044395017 /nfs/dbraw/zinc/39/50/17/1044395017.db2.gz GTWXCSUZJHQSEU-ZDUSSCGKSA-N 1 2 303.837 4.108 20 0 DIADLO Cc1cnn(C)c1C[N@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000564611841 1044395037 /nfs/dbraw/zinc/39/50/37/1044395037.db2.gz GTWXCSUZJHQSEU-ZDUSSCGKSA-N 1 2 303.837 4.108 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1cc(C)on1)c1ccccc1OC(F)F ZINC000282878786 1044396779 /nfs/dbraw/zinc/39/67/79/1044396779.db2.gz VOFWBCKLDNCCJC-AAEUAGOBSA-N 1 2 310.344 4.386 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)Cc1cnccc1C ZINC000361423968 1044400960 /nfs/dbraw/zinc/40/09/60/1044400960.db2.gz XGIMPDJAASCSBX-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)Cc1cnccc1C ZINC000361423968 1044400965 /nfs/dbraw/zinc/40/09/65/1044400965.db2.gz XGIMPDJAASCSBX-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc(OC4CCC4)cc3)cc2[nH+]1 ZINC000361463025 1044405125 /nfs/dbraw/zinc/40/51/25/1044405125.db2.gz KWCVUBDHBAWVNB-UHFFFAOYSA-N 1 2 321.380 4.055 20 0 DIADLO C[N@H+](Cc1nccn1-c1ccccc1)Cc1ccc(Cl)cc1 ZINC000361496337 1044409877 /nfs/dbraw/zinc/40/98/77/1044409877.db2.gz KTLBHKDCDGWFFE-UHFFFAOYSA-N 1 2 311.816 4.158 20 0 DIADLO C[N@@H+](Cc1nccn1-c1ccccc1)Cc1ccc(Cl)cc1 ZINC000361496337 1044409883 /nfs/dbraw/zinc/40/98/83/1044409883.db2.gz KTLBHKDCDGWFFE-UHFFFAOYSA-N 1 2 311.816 4.158 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2nccn2-c2ccccc2)c1 ZINC000361509526 1044411999 /nfs/dbraw/zinc/41/19/99/1044411999.db2.gz VNTQXTKWPFQFLH-IBGZPJMESA-N 1 2 321.399 4.349 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2nccn2-c2ccccc2)c1 ZINC000361509526 1044412005 /nfs/dbraw/zinc/41/20/05/1044412005.db2.gz VNTQXTKWPFQFLH-IBGZPJMESA-N 1 2 321.399 4.349 20 0 DIADLO Cc1[nH]c(CNc2cnn(-c3ccc(C)cc3)c2C(C)C)[nH+]c1C ZINC000565239250 1044421438 /nfs/dbraw/zinc/42/14/38/1044421438.db2.gz VPIGSRBPPRPOIT-UHFFFAOYSA-N 1 2 323.444 4.256 20 0 DIADLO COc1cc(C[N@H+](Cc2ccsc2Cl)C2CC2)ccc1O ZINC000361601746 1044421524 /nfs/dbraw/zinc/42/15/24/1044421524.db2.gz HAIBXEIUAALONI-UHFFFAOYSA-N 1 2 323.845 4.280 20 0 DIADLO COc1cc(C[N@@H+](Cc2ccsc2Cl)C2CC2)ccc1O ZINC000361601746 1044421534 /nfs/dbraw/zinc/42/15/34/1044421534.db2.gz HAIBXEIUAALONI-UHFFFAOYSA-N 1 2 323.845 4.280 20 0 DIADLO Cc1ccc2c(c1)C[N@H+]([C@H](C)C(=O)Nc1c(C)cc(C)cc1C)C2 ZINC000361604822 1044424862 /nfs/dbraw/zinc/42/48/62/1044424862.db2.gz VTVALSCOBNZTGT-QGZVFWFLSA-N 1 2 322.452 4.263 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+]([C@H](C)C(=O)Nc1c(C)cc(C)cc1C)C2 ZINC000361604822 1044424872 /nfs/dbraw/zinc/42/48/72/1044424872.db2.gz VTVALSCOBNZTGT-QGZVFWFLSA-N 1 2 322.452 4.263 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1nccn1-c1ccccc1 ZINC000361607662 1044425667 /nfs/dbraw/zinc/42/56/67/1044425667.db2.gz DAOAEFGRWMXEFK-UKRRQHHQSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1nccn1-c1ccccc1 ZINC000361607662 1044425672 /nfs/dbraw/zinc/42/56/72/1044425672.db2.gz DAOAEFGRWMXEFK-UKRRQHHQSA-N 1 2 323.362 4.035 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)nc1 ZINC000565526683 1044439947 /nfs/dbraw/zinc/43/99/47/1044439947.db2.gz AUBQUNJECQHMEU-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)nc1 ZINC000565526683 1044439951 /nfs/dbraw/zinc/43/99/51/1044439951.db2.gz AUBQUNJECQHMEU-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1nc([C@@H]2C[N@H+](Cc3ccccc3)CCO2)sc1C(C)C ZINC000565659591 1044448356 /nfs/dbraw/zinc/44/83/56/1044448356.db2.gz VGGOHZLBGIKZRQ-INIZCTEOSA-N 1 2 316.470 4.148 20 0 DIADLO Cc1nc([C@@H]2C[N@@H+](Cc3ccccc3)CCO2)sc1C(C)C ZINC000565659591 1044448360 /nfs/dbraw/zinc/44/83/60/1044448360.db2.gz VGGOHZLBGIKZRQ-INIZCTEOSA-N 1 2 316.470 4.148 20 0 DIADLO Cc1ccc2c(Nc3cccc(C4=NCCO4)c3)cccc2[nH+]1 ZINC001212798727 1044451896 /nfs/dbraw/zinc/45/18/96/1044451896.db2.gz POYRJOXGAYAFLD-UHFFFAOYSA-N 1 2 303.365 4.064 20 0 DIADLO CCc1ccc([C@H](C)CC(=O)Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC000523093007 1044462848 /nfs/dbraw/zinc/46/28/48/1044462848.db2.gz CESFZHAJJMBMFY-CQSZACIVSA-N 1 2 321.424 4.337 20 0 DIADLO OC1CCN(c2ccc([NH2+][C@H]3CCCC34CCCC4)cc2)CC1 ZINC000294862789 1044466677 /nfs/dbraw/zinc/46/66/77/1044466677.db2.gz TXJPJJFPTQLQJP-IBGZPJMESA-N 1 2 314.473 4.173 20 0 DIADLO OC1CCN(c2ccc([NH2+][C@@H]3CCCC34CCCC4)cc2)CC1 ZINC000294862791 1044467181 /nfs/dbraw/zinc/46/71/81/1044467181.db2.gz TXJPJJFPTQLQJP-LJQANCHMSA-N 1 2 314.473 4.173 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000294894127 1044469387 /nfs/dbraw/zinc/46/93/87/1044469387.db2.gz GOQVYXYALANADB-NRFANRHFSA-N 1 2 321.873 4.018 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000294894127 1044469398 /nfs/dbraw/zinc/46/93/98/1044469398.db2.gz GOQVYXYALANADB-NRFANRHFSA-N 1 2 321.873 4.018 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@@H]2c2cccs2)s1 ZINC000294921193 1044473612 /nfs/dbraw/zinc/47/36/12/1044473612.db2.gz OCBFZBGBNANVGX-GFCCVEGCSA-N 1 2 310.513 4.405 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@@H]2c2cccs2)s1 ZINC000294921193 1044473616 /nfs/dbraw/zinc/47/36/16/1044473616.db2.gz OCBFZBGBNANVGX-GFCCVEGCSA-N 1 2 310.513 4.405 20 0 DIADLO CC(C)([NH2+]Cc1cc(F)ncc1F)c1cccc(Cl)c1F ZINC000294997599 1044479621 /nfs/dbraw/zinc/47/96/21/1044479621.db2.gz HNTHWSBKPQCTEE-UHFFFAOYSA-N 1 2 314.738 4.177 20 0 DIADLO CC[C@@H](Cc1ccc(C)cc1)Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000566528886 1044496622 /nfs/dbraw/zinc/49/66/22/1044496622.db2.gz BIGVWBREGSKVNC-IBGZPJMESA-N 1 2 320.440 4.068 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+][C@H](C)c2nc(C3CC3)no2)c1 ZINC000120239613 1044502999 /nfs/dbraw/zinc/50/29/99/1044502999.db2.gz ZXDKTVODCBHTPT-CHWSQXEVSA-N 1 2 315.417 4.146 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2conc2C)s1 ZINC000295255019 1044503386 /nfs/dbraw/zinc/50/33/86/1044503386.db2.gz GJTDWOYUJCFJJF-UHFFFAOYSA-N 1 2 302.399 4.148 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2conc2C)s1 ZINC000295255019 1044503401 /nfs/dbraw/zinc/50/34/01/1044503401.db2.gz GJTDWOYUJCFJJF-UHFFFAOYSA-N 1 2 302.399 4.148 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+][C@@H](C)c2nc(C3CC3)no2)c1 ZINC000120239471 1044503162 /nfs/dbraw/zinc/50/31/62/1044503162.db2.gz ZXDKTVODCBHTPT-STQMWFEESA-N 1 2 315.417 4.146 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)C)no2)c1 ZINC000120238541 1044503714 /nfs/dbraw/zinc/50/37/14/1044503714.db2.gz HVRSXEZENBZZAX-ZIAGYGMSSA-N 1 2 317.433 4.392 20 0 DIADLO COCc1ccc(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)o1 ZINC000120497714 1044508109 /nfs/dbraw/zinc/50/81/09/1044508109.db2.gz FPUHCJORDXPBGU-GFCCVEGCSA-N 1 2 316.426 4.229 20 0 DIADLO COCc1ccc(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)o1 ZINC000120497714 1044508121 /nfs/dbraw/zinc/50/81/21/1044508121.db2.gz FPUHCJORDXPBGU-GFCCVEGCSA-N 1 2 316.426 4.229 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccccc2)no1)c1cccc(C2CC2)c1 ZINC000295313631 1044508652 /nfs/dbraw/zinc/50/86/52/1044508652.db2.gz GFTYKKKGVBQIOS-CQSZACIVSA-N 1 2 319.408 4.465 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000362431842 1044509673 /nfs/dbraw/zinc/50/96/73/1044509673.db2.gz WCGRCDPPUDLROL-RHSMWYFYSA-N 1 2 301.434 4.339 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000362431842 1044509688 /nfs/dbraw/zinc/50/96/88/1044509688.db2.gz WCGRCDPPUDLROL-RHSMWYFYSA-N 1 2 301.434 4.339 20 0 DIADLO CCC1(C(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)CCC(F)(F)CC1 ZINC000665796108 1044509960 /nfs/dbraw/zinc/50/99/60/1044509960.db2.gz MNLJZQQLDJAACI-UHFFFAOYSA-N 1 2 321.371 4.416 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccco2)no1)c1cccc(C2CC2)c1 ZINC000295352223 1044516545 /nfs/dbraw/zinc/51/65/45/1044516545.db2.gz ISZYPYSWLWBPTM-GFCCVEGCSA-N 1 2 309.369 4.058 20 0 DIADLO CSc1ccc([C@H](C)[NH2+]Cc2nnc(C(C)C)s2)cc1 ZINC000295368972 1044517261 /nfs/dbraw/zinc/51/72/61/1044517261.db2.gz PEHBFJNYAQEOAE-NSHDSACASA-N 1 2 307.488 4.234 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+]Cc2nnc(C(C)C)s2)cc1 ZINC000295368965 1044518009 /nfs/dbraw/zinc/51/80/09/1044518009.db2.gz PEHBFJNYAQEOAE-LLVKDONJSA-N 1 2 307.488 4.234 20 0 DIADLO CCc1cnc(C[NH+]2CCC(c3c(F)cccc3F)CC2)s1 ZINC000362524489 1044523916 /nfs/dbraw/zinc/52/39/16/1044523916.db2.gz IJHJJHHAYAGZJK-UHFFFAOYSA-N 1 2 322.424 4.363 20 0 DIADLO CSc1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)s1 ZINC000567033619 1044537070 /nfs/dbraw/zinc/53/70/70/1044537070.db2.gz PFIFPFNLABSYJD-OAHLLOKOSA-N 1 2 304.484 4.448 20 0 DIADLO CSc1ccc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)s1 ZINC000567033619 1044537085 /nfs/dbraw/zinc/53/70/85/1044537085.db2.gz PFIFPFNLABSYJD-OAHLLOKOSA-N 1 2 304.484 4.448 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@@H]3C=CCCC3)c2)[nH+]c1C ZINC000778570434 1044543393 /nfs/dbraw/zinc/54/33/93/1044543393.db2.gz FZAWDIKQFQYRCZ-OAHLLOKOSA-N 1 2 309.413 4.378 20 0 DIADLO CC(C)c1cc(NCc2cc(C3CC3)no2)nc(C(C)C)[nH+]1 ZINC000884638282 1044543634 /nfs/dbraw/zinc/54/36/34/1044543634.db2.gz RZHHBMRNVQNSRW-UHFFFAOYSA-N 1 2 300.406 4.201 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ncccn1)c1ccc(Cl)c(Cl)c1 ZINC000567180113 1044549038 /nfs/dbraw/zinc/54/90/38/1044549038.db2.gz AFGLBOIXRIZYAL-OAHLLOKOSA-N 1 2 310.228 4.270 20 0 DIADLO CC(=O)Nc1ccc([C@H](C)[NH2+]CC(F)(F)c2ccccc2)cc1 ZINC000564009089 1044561069 /nfs/dbraw/zinc/56/10/69/1044561069.db2.gz VVMZXYDPZIUXCI-ZDUSSCGKSA-N 1 2 318.367 4.088 20 0 DIADLO CCc1nc(C[N@H+](C)C/C=C/c2ccc(F)c(F)c2)cs1 ZINC000567428688 1044564868 /nfs/dbraw/zinc/56/48/68/1044564868.db2.gz NKUINXWXULMCKS-SNAWJCMRSA-N 1 2 308.397 4.129 20 0 DIADLO CCc1nc(C[N@@H+](C)C/C=C/c2ccc(F)c(F)c2)cs1 ZINC000567428688 1044564880 /nfs/dbraw/zinc/56/48/80/1044564880.db2.gz NKUINXWXULMCKS-SNAWJCMRSA-N 1 2 308.397 4.129 20 0 DIADLO c1cn(-c2csc(CNc3ccc4scnc4c3)c2)c[nH+]1 ZINC000362988867 1044574125 /nfs/dbraw/zinc/57/41/25/1044574125.db2.gz FJNLOXHTEZHVCC-UHFFFAOYSA-N 1 2 312.423 4.156 20 0 DIADLO Cc1cccc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c1F ZINC000295922132 1044576887 /nfs/dbraw/zinc/57/68/87/1044576887.db2.gz AFKKGCNIDKYULU-VIFPVBQESA-N 1 2 318.339 4.460 20 0 DIADLO CO[C@H](CSCCc1[nH+]cc(C)cc1C)c1ccccc1 ZINC000567883430 1044587737 /nfs/dbraw/zinc/58/77/37/1044587737.db2.gz VGXYDHUZVWOXQE-GOSISDBHSA-N 1 2 301.455 4.362 20 0 DIADLO Cc1ccc(N(C)c2ccc(C[N@H+](C)Cc3ccon3)cc2)cc1 ZINC001137898528 1044591729 /nfs/dbraw/zinc/59/17/29/1044591729.db2.gz XNJXTQJVTDIHFA-UHFFFAOYSA-N 1 2 321.424 4.383 20 0 DIADLO Cc1ccc(N(C)c2ccc(C[N@@H+](C)Cc3ccon3)cc2)cc1 ZINC001137898528 1044591750 /nfs/dbraw/zinc/59/17/50/1044591750.db2.gz XNJXTQJVTDIHFA-UHFFFAOYSA-N 1 2 321.424 4.383 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000363210186 1044594380 /nfs/dbraw/zinc/59/43/80/1044594380.db2.gz CXZJTWIJNLCWOX-CYBMUJFWSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1occc1C[N@H+](C)[C@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000363210186 1044594390 /nfs/dbraw/zinc/59/43/90/1044594390.db2.gz CXZJTWIJNLCWOX-CYBMUJFWSA-N 1 2 311.385 4.139 20 0 DIADLO c1sc(C[N@@H+]2CCOCC3(CCC3)C2)nc1C1CCCCC1 ZINC000444684230 1044603451 /nfs/dbraw/zinc/60/34/51/1044603451.db2.gz IWTHNPXPHRGACV-UHFFFAOYSA-N 1 2 320.502 4.193 20 0 DIADLO c1sc(C[N@H+]2CCOCC3(CCC3)C2)nc1C1CCCCC1 ZINC000444684230 1044603462 /nfs/dbraw/zinc/60/34/62/1044603462.db2.gz IWTHNPXPHRGACV-UHFFFAOYSA-N 1 2 320.502 4.193 20 0 DIADLO C[C@H]1CC[C@@H]([NH2+]Cc2ncc(C(F)(F)F)cn2)c2ccccc21 ZINC000296283991 1044605661 /nfs/dbraw/zinc/60/56/61/1044605661.db2.gz FDCYQZZEPMWUHA-XHDPSFHLSA-N 1 2 321.346 4.224 20 0 DIADLO Cc1cc2cc([C@@H](C)[NH2+]Cc3nnc(C(C)C)[nH]3)oc2cc1C ZINC000296367459 1044611912 /nfs/dbraw/zinc/61/19/12/1044611912.db2.gz JAXWPZLALVVFBI-CYBMUJFWSA-N 1 2 312.417 4.142 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ncc(-c3cccs3)o2)ccc1F ZINC000444744592 1044617820 /nfs/dbraw/zinc/61/78/20/1044617820.db2.gz NMLPTCPPNBZJKX-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ncc(-c3cccs3)o2)ccc1F ZINC000444744592 1044617825 /nfs/dbraw/zinc/61/78/25/1044617825.db2.gz NMLPTCPPNBZJKX-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ncc(-c3ccccc3)o2)ccc1F ZINC000444743520 1044619093 /nfs/dbraw/zinc/61/90/93/1044619093.db2.gz IYZVHFXPYDCKPI-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ncc(-c3ccccc3)o2)ccc1F ZINC000444743520 1044619096 /nfs/dbraw/zinc/61/90/96/1044619096.db2.gz IYZVHFXPYDCKPI-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[NH2+][C@@H](C)c1ncco1 ZINC000886273822 1044629745 /nfs/dbraw/zinc/62/97/45/1044629745.db2.gz HDDIJAUAVUEDOK-AWEZNQCLSA-N 1 2 310.397 4.466 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c(C)c1 ZINC001202734724 1044631193 /nfs/dbraw/zinc/63/11/93/1044631193.db2.gz FTTCETWMCGGULR-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000523443942 1044637973 /nfs/dbraw/zinc/63/79/73/1044637973.db2.gz KABNUULREZYQTK-ZYHUDNBSSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000523443942 1044637983 /nfs/dbraw/zinc/63/79/83/1044637983.db2.gz KABNUULREZYQTK-ZYHUDNBSSA-N 1 2 323.305 4.069 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc2c(c1)C=CC1(CCC1)O2 ZINC000886389808 1044639614 /nfs/dbraw/zinc/63/96/14/1044639614.db2.gz YKDXASJSUQCIKR-UHFFFAOYSA-N 1 2 309.413 4.404 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C(F)(F)F)cn1)c1ccc(Cl)s1 ZINC000296653826 1044641157 /nfs/dbraw/zinc/64/11/57/1044641157.db2.gz ZCNJZEUKTABZBU-ZETCQYMHSA-N 1 2 321.755 4.061 20 0 DIADLO c1cc2c(o1)CCC[N@@H+](Cc1csc(-c3ccccc3)n1)C2 ZINC000568678958 1044642936 /nfs/dbraw/zinc/64/29/36/1044642936.db2.gz XAOFSUJHSHYUGO-UHFFFAOYSA-N 1 2 310.422 4.352 20 0 DIADLO c1cc2c(o1)CCC[N@H+](Cc1csc(-c3ccccc3)n1)C2 ZINC000568678958 1044642946 /nfs/dbraw/zinc/64/29/46/1044642946.db2.gz XAOFSUJHSHYUGO-UHFFFAOYSA-N 1 2 310.422 4.352 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+]Cc3ccn(C(C)C)n3)o2)cc1 ZINC000568677113 1044643091 /nfs/dbraw/zinc/64/30/91/1044643091.db2.gz OMNBOCIXHDXLPY-UHFFFAOYSA-N 1 2 309.413 4.322 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]C(c2cccs2)c2cccs2)c2nccn21 ZINC000296760091 1044646121 /nfs/dbraw/zinc/64/61/21/1044646121.db2.gz KCCALCZFILEECS-VXGBXAGGSA-N 1 2 315.467 4.391 20 0 DIADLO C[C@H]1C[C@H]([NH2+]C(c2cccs2)c2cccs2)c2nccn21 ZINC000296760088 1044646163 /nfs/dbraw/zinc/64/61/63/1044646163.db2.gz KCCALCZFILEECS-RYUDHWBXSA-N 1 2 315.467 4.391 20 0 DIADLO CC1(C)c2ccccc2CC[N@H+]1Cc1nc(C2CCCC2)no1 ZINC000568895765 1044658165 /nfs/dbraw/zinc/65/81/65/1044658165.db2.gz DRMPJQXPYYXRHQ-UHFFFAOYSA-N 1 2 311.429 4.021 20 0 DIADLO CC1(C)c2ccccc2CC[N@@H+]1Cc1nc(C2CCCC2)no1 ZINC000568895765 1044658170 /nfs/dbraw/zinc/65/81/70/1044658170.db2.gz DRMPJQXPYYXRHQ-UHFFFAOYSA-N 1 2 311.429 4.021 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](CO)c2c(Cl)cccc2Cl)cc1 ZINC000475619914 1044666710 /nfs/dbraw/zinc/66/67/10/1044666710.db2.gz BBDNWAYWGMRFPJ-INIZCTEOSA-N 1 2 324.251 4.379 20 0 DIADLO CCCCCN(C(=O)[C@H]1CCc2[nH+]c(C(C)C)[nH]c2C1)C(C)C ZINC000364545899 1044668858 /nfs/dbraw/zinc/66/88/58/1044668858.db2.gz XTAHYTZEFHAAEK-HNNXBMFYSA-N 1 2 319.493 4.065 20 0 DIADLO CCCCCN(C(=O)[C@H]1CCc2[nH]c(C(C)C)[nH+]c2C1)C(C)C ZINC000364545899 1044668863 /nfs/dbraw/zinc/66/88/63/1044668863.db2.gz XTAHYTZEFHAAEK-HNNXBMFYSA-N 1 2 319.493 4.065 20 0 DIADLO COc1ccc([C@H]([NH2+][C@@H]2CCc3cccnc32)c2ccco2)cc1 ZINC000886622441 1044671339 /nfs/dbraw/zinc/67/13/39/1044671339.db2.gz SRCBOHBENUQGDM-XLIONFOSSA-N 1 2 320.392 4.050 20 0 DIADLO Fc1cccc(F)c1C1([NH2+][C@H]2CCc3cccnc32)CCC1 ZINC000886644798 1044672635 /nfs/dbraw/zinc/67/26/35/1044672635.db2.gz KUNNRTWQHYWROH-HNNXBMFYSA-N 1 2 300.352 4.016 20 0 DIADLO CC(C)(C)[C@H]1CCC[N@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC000475621422 1044674947 /nfs/dbraw/zinc/67/49/47/1044674947.db2.gz DWDAXMZCNYOWGI-JTQLQIEISA-N 1 2 306.397 4.420 20 0 DIADLO CC(C)(C)[C@H]1CCC[N@@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC000475621422 1044674951 /nfs/dbraw/zinc/67/49/51/1044674951.db2.gz DWDAXMZCNYOWGI-JTQLQIEISA-N 1 2 306.397 4.420 20 0 DIADLO Fc1ccc(F)c(SCc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000569112556 1044676542 /nfs/dbraw/zinc/67/65/42/1044676542.db2.gz HLVRCOLWPJNKAT-UHFFFAOYSA-N 1 2 302.349 4.443 20 0 DIADLO Fc1ccccc1C[NH2+][C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000365019450 1044680366 /nfs/dbraw/zinc/68/03/66/1044680366.db2.gz YEHZLDXIURIPDW-SFHVURJKSA-N 1 2 313.420 4.305 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(C2CC2)c1)c1noc(-c2ccccc2)n1 ZINC000569210724 1044682441 /nfs/dbraw/zinc/68/24/41/1044682441.db2.gz ZDJOQIHKOYRBLB-AWEZNQCLSA-N 1 2 319.408 4.465 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2ccc([C@H]3C[C@@H]3C)o2)c(C)[nH+]1 ZINC000569201038 1044683005 /nfs/dbraw/zinc/68/30/05/1044683005.db2.gz LKSAQSAGPVSOHP-BONVTDFDSA-N 1 2 313.401 4.045 20 0 DIADLO FC(F)(F)C1CC[NH+](Cc2csc(-c3ccoc3)n2)CC1 ZINC000075997673 1044690770 /nfs/dbraw/zinc/69/07/70/1044690770.db2.gz LHDHVVGNSQELPE-UHFFFAOYSA-N 1 2 316.348 4.177 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)c(C)[nH+]1 ZINC000365811406 1044705756 /nfs/dbraw/zinc/70/57/56/1044705756.db2.gz BNSXYBFPIRQOTD-VXGBXAGGSA-N 1 2 320.845 4.464 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2c1cccc2F)c1nc(-c2ccccc2)no1 ZINC000886920629 1044719984 /nfs/dbraw/zinc/71/99/84/1044719984.db2.gz DZDAKVSTCNWRRZ-SJCJKPOMSA-N 1 2 323.371 4.214 20 0 DIADLO C[C@H]([NH2+]Cc1csnn1)c1cccc(SC(F)(F)F)c1 ZINC000886931213 1044720300 /nfs/dbraw/zinc/72/03/00/1044720300.db2.gz HCNJTUNXEGTBMO-QMMMGPOBSA-N 1 2 319.377 4.001 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2F)c1ncc(C(C)(C)C)o1 ZINC000886926558 1044720868 /nfs/dbraw/zinc/72/08/68/1044720868.db2.gz STSKGKSPLOJBJN-IAQYHMDHSA-N 1 2 302.393 4.449 20 0 DIADLO Cc1cccc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1C ZINC000366546806 1044723067 /nfs/dbraw/zinc/72/30/67/1044723067.db2.gz PRZOBRWHGWZTKJ-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H](C)c1cccc(F)c1 ZINC000366575635 1044725377 /nfs/dbraw/zinc/72/53/77/1044725377.db2.gz LYXQHOAQRPBFBN-ZDUSSCGKSA-N 1 2 323.371 4.266 20 0 DIADLO Clc1ccncc1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC001137236492 1044728877 /nfs/dbraw/zinc/72/88/77/1044728877.db2.gz FLSUUANXYUTMJZ-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccncc1C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC001137236492 1044728890 /nfs/dbraw/zinc/72/88/90/1044728890.db2.gz FLSUUANXYUTMJZ-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cn3ccccc3n2)C2CC2)o1 ZINC000524143091 1044748051 /nfs/dbraw/zinc/74/80/51/1044748051.db2.gz HPNFDGIPUDAXNV-KDOFPFPSSA-N 1 2 321.424 4.215 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cn3ccccc3n2)C2CC2)o1 ZINC000524143091 1044748067 /nfs/dbraw/zinc/74/80/67/1044748067.db2.gz HPNFDGIPUDAXNV-KDOFPFPSSA-N 1 2 321.424 4.215 20 0 DIADLO C[N@H+](Cc1nc(-c2ccc(Cl)s2)no1)Cc1ccccc1 ZINC000445559286 1044752828 /nfs/dbraw/zinc/75/28/28/1044752828.db2.gz UDDHOQJVCRXJCL-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccc(Cl)s2)no1)Cc1ccccc1 ZINC000445559286 1044752844 /nfs/dbraw/zinc/75/28/44/1044752844.db2.gz UDDHOQJVCRXJCL-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO Cc1nnc(C[N@@H+]2CCCCC[C@H]2/C=C/c2cccs2)s1 ZINC000367791026 1044753661 /nfs/dbraw/zinc/75/36/61/1044753661.db2.gz CAUFMTJETLGEGQ-VFNNOXKTSA-N 1 2 319.499 4.366 20 0 DIADLO Cc1nnc(C[N@H+]2CCCCC[C@H]2/C=C/c2cccs2)s1 ZINC000367791026 1044753680 /nfs/dbraw/zinc/75/36/80/1044753680.db2.gz CAUFMTJETLGEGQ-VFNNOXKTSA-N 1 2 319.499 4.366 20 0 DIADLO Clc1nccc(C[NH+]2CCC(c3ccncc3)CC2)c1Cl ZINC000368111005 1044765893 /nfs/dbraw/zinc/76/58/93/1044765893.db2.gz FSKFZNPIIQLCBD-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO CC(C)(C)[C@@H]1CCC[N@H+](Cc2ncc(Br)s2)C1 ZINC000475634808 1044828282 /nfs/dbraw/zinc/82/82/82/1044828282.db2.gz LERMYPGNDDDLEL-SNVBAGLBSA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2ncc(Br)s2)C1 ZINC000475634808 1044828303 /nfs/dbraw/zinc/82/83/03/1044828303.db2.gz LERMYPGNDDDLEL-SNVBAGLBSA-N 1 2 317.296 4.164 20 0 DIADLO c1n[nH]c2c1[C@H]([NH2+][C@H](Cc1ccccc1)c1ccccc1)CCC2 ZINC000368608587 1044781638 /nfs/dbraw/zinc/78/16/38/1044781638.db2.gz QAPTVNSZOKXEKZ-TZIWHRDSSA-N 1 2 317.436 4.361 20 0 DIADLO c1n[nH]c2c1[C@H]([NH2+][C@@H](Cc1ccccc1)c1ccccc1)CCC2 ZINC000368608584 1044781942 /nfs/dbraw/zinc/78/19/42/1044781942.db2.gz QAPTVNSZOKXEKZ-CTNGQTDRSA-N 1 2 317.436 4.361 20 0 DIADLO Fc1cccc(C2CC[NH+](Cc3ncc(C4CC4)o3)CC2)c1F ZINC000368727369 1044786568 /nfs/dbraw/zinc/78/65/68/1044786568.db2.gz IMYNAQWXEOTZJT-UHFFFAOYSA-N 1 2 318.367 4.210 20 0 DIADLO CCc1nc(C[N@H+](C)C[C@@H](OC(C)C)c2ccccc2)cs1 ZINC000570998809 1044792246 /nfs/dbraw/zinc/79/22/46/1044792246.db2.gz KNTPXNBGHXEMDO-QGZVFWFLSA-N 1 2 318.486 4.304 20 0 DIADLO CCc1nc(C[N@@H+](C)C[C@@H](OC(C)C)c2ccccc2)cs1 ZINC000570998809 1044792260 /nfs/dbraw/zinc/79/22/60/1044792260.db2.gz KNTPXNBGHXEMDO-QGZVFWFLSA-N 1 2 318.486 4.304 20 0 DIADLO CCc1noc(C)c1C[NH2+][C@@H](c1ccc(C)cc1)c1ccccn1 ZINC000369290774 1044801384 /nfs/dbraw/zinc/80/13/84/1044801384.db2.gz RBJVSCJOFMMOAM-FQEVSTJZSA-N 1 2 321.424 4.128 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+]2CCC[C@@H]2c2ccncc2)n1 ZINC000125466106 1044803330 /nfs/dbraw/zinc/80/33/30/1044803330.db2.gz MVXSIPPHNGMQKS-CQSZACIVSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1csc(C[N@H+]2CCC[C@@H]2c2ccncc2)n1 ZINC000125466106 1044803349 /nfs/dbraw/zinc/80/33/49/1044803349.db2.gz MVXSIPPHNGMQKS-CQSZACIVSA-N 1 2 301.459 4.173 20 0 DIADLO c1csc(-c2cc(C[N@@H+]3CCC[C@H]3c3ccncc3)no2)c1 ZINC000125477384 1044803898 /nfs/dbraw/zinc/80/38/98/1044803898.db2.gz JDZMXZDZEMQDCM-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2cc(C[N@H+]3CCC[C@H]3c3ccncc3)no2)c1 ZINC000125477384 1044803915 /nfs/dbraw/zinc/80/39/15/1044803915.db2.gz JDZMXZDZEMQDCM-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO CC(C)c1ccc([C@H]2CCC[N@@H+]2Cc2nc(C3CC3)nn2C)cc1 ZINC000571518912 1044817528 /nfs/dbraw/zinc/81/75/28/1044817528.db2.gz CUDRPOOKOKMOOF-GOSISDBHSA-N 1 2 324.472 4.153 20 0 DIADLO CC(C)c1ccc([C@H]2CCC[N@H+]2Cc2nc(C3CC3)nn2C)cc1 ZINC000571518912 1044817548 /nfs/dbraw/zinc/81/75/48/1044817548.db2.gz CUDRPOOKOKMOOF-GOSISDBHSA-N 1 2 324.472 4.153 20 0 DIADLO CC1=CCC[N@@H+]([C@H](C)c2nnc(-c3ccccc3F)s2)C1 ZINC000571770760 1044824677 /nfs/dbraw/zinc/82/46/77/1044824677.db2.gz SWPYMGATWHRBSR-GFCCVEGCSA-N 1 2 303.406 4.057 20 0 DIADLO CC1=CCC[N@H+]([C@H](C)c2nnc(-c3ccccc3F)s2)C1 ZINC000571770760 1044824703 /nfs/dbraw/zinc/82/47/03/1044824703.db2.gz SWPYMGATWHRBSR-GFCCVEGCSA-N 1 2 303.406 4.057 20 0 DIADLO Cc1ncsc1CN(C)c1cc[nH+]c2c(Cl)cccc12 ZINC000572066917 1044839430 /nfs/dbraw/zinc/83/94/30/1044839430.db2.gz CYCFBIHAQZWPTK-UHFFFAOYSA-N 1 2 303.818 4.290 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccccc1OC(F)F ZINC000573369078 1044903837 /nfs/dbraw/zinc/90/38/37/1044903837.db2.gz SLEHJXZNWWLOCM-LLVKDONJSA-N 1 2 324.371 4.424 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2cc3ccc(F)cc3[nH]2)CCO1 ZINC000573512739 1044910646 /nfs/dbraw/zinc/91/06/46/1044910646.db2.gz AWEZQWCXWKHINO-FQEVSTJZSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2cc3ccc(F)cc3[nH]2)CCO1 ZINC000573512739 1044910654 /nfs/dbraw/zinc/91/06/54/1044910654.db2.gz AWEZQWCXWKHINO-FQEVSTJZSA-N 1 2 324.399 4.189 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2cnn(C3CCCC3)c2)cs1 ZINC000337505332 1044911938 /nfs/dbraw/zinc/91/19/38/1044911938.db2.gz FEOGSHHRDZLOJD-OLZOCXBDSA-N 1 2 318.490 4.429 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CC[C@]3(C2)OCc2ccccc23)c1 ZINC000573717442 1044919758 /nfs/dbraw/zinc/91/97/58/1044919758.db2.gz JLQBJMKKKCGEPQ-HXUWFJFHSA-N 1 2 320.367 4.010 20 0 DIADLO Fc1cc(NCc2cc(-n3cc[nH+]c3)cs2)ccc1Cl ZINC000573769552 1044923041 /nfs/dbraw/zinc/92/30/41/1044923041.db2.gz VQQWKQDUGRRSNY-UHFFFAOYSA-N 1 2 307.781 4.338 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3c(Cl)cccc3C2)cc1F ZINC000524812328 1044925852 /nfs/dbraw/zinc/92/58/52/1044925852.db2.gz ZHSLVPJKPJXBCD-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(C[N@H+]2CCc3c(Cl)cccc3C2)cc1F ZINC000524812328 1044925867 /nfs/dbraw/zinc/92/58/67/1044925867.db2.gz ZHSLVPJKPJXBCD-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)n1 ZINC000573893220 1044931511 /nfs/dbraw/zinc/93/15/11/1044931511.db2.gz OHTSVLAMDATUKQ-PSLIRLAXSA-N 1 2 323.799 4.226 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nn(-c3ccccc3)c3c2CCC3)o1 ZINC000133295606 1044934434 /nfs/dbraw/zinc/93/44/34/1044934434.db2.gz OGCNMVSWRVUBQQ-HNNXBMFYSA-N 1 2 321.424 4.113 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cccnc1Cl ZINC000133505016 1044939653 /nfs/dbraw/zinc/93/96/53/1044939653.db2.gz WNTHFRARXOEVSZ-JTQLQIEISA-N 1 2 309.866 4.340 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1ccc2sccc2c1 ZINC000348461264 1044951041 /nfs/dbraw/zinc/95/10/41/1044951041.db2.gz JRWIUXBAKKXSQS-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccccc2)cs1)c1ccncc1F ZINC000337951415 1044966894 /nfs/dbraw/zinc/96/68/94/1044966894.db2.gz ZKRMARFSYFPUCU-LBPRGKRZSA-N 1 2 313.401 4.195 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1F ZINC000373524476 1044985020 /nfs/dbraw/zinc/98/50/20/1044985020.db2.gz SQROBRVQUYOSNC-IUDNXUCKSA-N 1 2 322.493 4.215 20 0 DIADLO Cc1ccc2ncc(C[N@@H+]3CCOC[C@@H]3c3ccccc3)cc2c1 ZINC000411300010 1044991221 /nfs/dbraw/zinc/99/12/21/1044991221.db2.gz PQZCWBLBMAORLN-OAQYLSRUSA-N 1 2 318.420 4.117 20 0 DIADLO Cc1ccc2ncc(C[N@H+]3CCOC[C@@H]3c3ccccc3)cc2c1 ZINC000411300010 1044991236 /nfs/dbraw/zinc/99/12/36/1044991236.db2.gz PQZCWBLBMAORLN-OAQYLSRUSA-N 1 2 318.420 4.117 20 0 DIADLO Cc1ccc2ncc(C[N@@H+]3CCOC[C@H]3c3ccccc3)cc2c1 ZINC000411300007 1044993259 /nfs/dbraw/zinc/99/32/59/1044993259.db2.gz PQZCWBLBMAORLN-NRFANRHFSA-N 1 2 318.420 4.117 20 0 DIADLO Cc1ccc2ncc(C[N@H+]3CCOC[C@H]3c3ccccc3)cc2c1 ZINC000411300007 1044993274 /nfs/dbraw/zinc/99/32/74/1044993274.db2.gz PQZCWBLBMAORLN-NRFANRHFSA-N 1 2 318.420 4.117 20 0 DIADLO C[C@@H]1C[N@@H+]([C@@H]2C[C@H]2c2cccc(F)c2)C[C@@H](c2ccsc2)O1 ZINC000411313755 1044994614 /nfs/dbraw/zinc/99/46/14/1044994614.db2.gz CEJNFKJLURKOFY-IUHNQTRMSA-N 1 2 317.429 4.205 20 0 DIADLO C[C@@H]1C[N@H+]([C@@H]2C[C@H]2c2cccc(F)c2)C[C@@H](c2ccsc2)O1 ZINC000411313755 1044994625 /nfs/dbraw/zinc/99/46/25/1044994625.db2.gz CEJNFKJLURKOFY-IUHNQTRMSA-N 1 2 317.429 4.205 20 0 DIADLO Cc1ccc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c(C)c1 ZINC000373694495 1045002616 /nfs/dbraw/zinc/00/26/16/1045002616.db2.gz KJFHEQYVYJLBNE-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@@H](C)c1cnn(C(C)C)c1)c1ccco1 ZINC000152630722 1045044909 /nfs/dbraw/zinc/04/49/09/1045044909.db2.gz IMLPCORZOZSPKF-DOTOQJQBSA-N 1 2 319.449 4.122 20 0 DIADLO CC[N@H+](Cc1ncc(-c2cccc(F)c2)o1)Cc1occc1C ZINC000412031002 1045049024 /nfs/dbraw/zinc/04/90/24/1045049024.db2.gz XDXVEQMFSHFCPX-UHFFFAOYSA-N 1 2 314.360 4.404 20 0 DIADLO CC[N@@H+](Cc1ncc(-c2cccc(F)c2)o1)Cc1occc1C ZINC000412031002 1045049036 /nfs/dbraw/zinc/04/90/36/1045049036.db2.gz XDXVEQMFSHFCPX-UHFFFAOYSA-N 1 2 314.360 4.404 20 0 DIADLO CC[N@H+](CC(=O)Nc1ccccc1C(C)C)Cc1occc1C ZINC000412050003 1045053718 /nfs/dbraw/zinc/05/37/18/1045053718.db2.gz ZXSMVWBMMWSKFB-UHFFFAOYSA-N 1 2 314.429 4.172 20 0 DIADLO CC[N@@H+](CC(=O)Nc1ccccc1C(C)C)Cc1occc1C ZINC000412050003 1045053730 /nfs/dbraw/zinc/05/37/30/1045053730.db2.gz ZXSMVWBMMWSKFB-UHFFFAOYSA-N 1 2 314.429 4.172 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](c2cccc(C)c2)c2ccccn2)o1 ZINC000153557186 1045059008 /nfs/dbraw/zinc/05/90/08/1045059008.db2.gz CXWUHOWIUBVILZ-FQEVSTJZSA-N 1 2 306.409 4.425 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1oc(C(C)C)nc1C ZINC000428458637 1045067980 /nfs/dbraw/zinc/06/79/80/1045067980.db2.gz CKAHHHNDCLTAQZ-UHFFFAOYSA-N 1 2 302.418 4.137 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1oc(C(C)C)nc1C ZINC000428458637 1045067990 /nfs/dbraw/zinc/06/79/90/1045067990.db2.gz CKAHHHNDCLTAQZ-UHFFFAOYSA-N 1 2 302.418 4.137 20 0 DIADLO FC(F)(F)[C@H]1CC[N@H+](Cc2ncc(C3CC3)o2)CC12CCC2 ZINC000374553484 1045070989 /nfs/dbraw/zinc/07/09/89/1045070989.db2.gz ZSHHMXIVAIEBQC-ZDUSSCGKSA-N 1 2 314.351 4.107 20 0 DIADLO FC(F)(F)[C@H]1CC[N@@H+](Cc2ncc(C3CC3)o2)CC12CCC2 ZINC000374553484 1045071006 /nfs/dbraw/zinc/07/10/06/1045071006.db2.gz ZSHHMXIVAIEBQC-ZDUSSCGKSA-N 1 2 314.351 4.107 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)c2ccccn21 ZINC000576949457 1045089211 /nfs/dbraw/zinc/08/92/11/1045089211.db2.gz GQWMELAOZAEDEH-KRWDZBQOSA-N 1 2 308.429 4.123 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c2ccccn21 ZINC000576949457 1045089220 /nfs/dbraw/zinc/08/92/20/1045089220.db2.gz GQWMELAOZAEDEH-KRWDZBQOSA-N 1 2 308.429 4.123 20 0 DIADLO Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccn3cc[nH+]c3c2)c(C)c1 ZINC000577151560 1045105278 /nfs/dbraw/zinc/10/52/78/1045105278.db2.gz GKLRWCYEUMVKSM-OAHLLOKOSA-N 1 2 322.412 4.176 20 0 DIADLO Clc1cc(Cl)cc(CC[N@@H+]2CCc3ncsc3C2)c1 ZINC000447263564 1045113209 /nfs/dbraw/zinc/11/32/09/1045113209.db2.gz JAZPTAVPHCDYCB-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO Clc1cc(Cl)cc(CC[N@H+]2CCc3ncsc3C2)c1 ZINC000447263564 1045113215 /nfs/dbraw/zinc/11/32/15/1045113215.db2.gz JAZPTAVPHCDYCB-UHFFFAOYSA-N 1 2 313.253 4.051 20 0 DIADLO Cc1nc(N2CC(C)(C)[C@@H]2c2cccs2)c2c([nH+]1)CCCC2 ZINC000577317951 1045116438 /nfs/dbraw/zinc/11/64/38/1045116438.db2.gz PVYZRRSPQZXDOT-INIZCTEOSA-N 1 2 313.470 4.313 20 0 DIADLO COC(=O)c1sccc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000447375484 1045123704 /nfs/dbraw/zinc/12/37/04/1045123704.db2.gz QNWWACLJQVJZOM-HNNXBMFYSA-N 1 2 319.401 4.011 20 0 DIADLO COC(=O)c1sccc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000447375484 1045123711 /nfs/dbraw/zinc/12/37/11/1045123711.db2.gz QNWWACLJQVJZOM-HNNXBMFYSA-N 1 2 319.401 4.011 20 0 DIADLO Cc1cc(C)c(NC(=O)CCc2cnc3ccccc3c2)c(C)[nH+]1 ZINC000525830662 1045126027 /nfs/dbraw/zinc/12/60/27/1045126027.db2.gz GUVREAFTTQDBLI-UHFFFAOYSA-N 1 2 319.408 4.126 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cncn1Cc1ccccc1 ZINC000525833055 1045127491 /nfs/dbraw/zinc/12/74/91/1045127491.db2.gz IFTDJVWJQAQSHC-MRXNPFEDSA-N 1 2 323.415 4.264 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cncn1Cc1ccccc1 ZINC000525833055 1045127498 /nfs/dbraw/zinc/12/74/98/1045127498.db2.gz IFTDJVWJQAQSHC-MRXNPFEDSA-N 1 2 323.415 4.264 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2ccccc2Br)C[C@@H](C)O1 ZINC000600702750 1045131058 /nfs/dbraw/zinc/13/10/58/1045131058.db2.gz ZURCNFHFAFFJNE-FRRDWIJNSA-N 1 2 312.251 4.009 20 0 DIADLO CC[C@@H]1C[N@H+]([C@@H](C)c2ccccc2Br)C[C@@H](C)O1 ZINC000600702750 1045131068 /nfs/dbraw/zinc/13/10/68/1045131068.db2.gz ZURCNFHFAFFJNE-FRRDWIJNSA-N 1 2 312.251 4.009 20 0 DIADLO CCc1nc(C)c(C[N@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)o1 ZINC000428484364 1045131738 /nfs/dbraw/zinc/13/17/38/1045131738.db2.gz LZNBFNGSYOXUEH-MLGOLLRUSA-N 1 2 314.429 4.426 20 0 DIADLO CCc1nc(C)c(C[N@@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)o1 ZINC000428484364 1045131749 /nfs/dbraw/zinc/13/17/49/1045131749.db2.gz LZNBFNGSYOXUEH-MLGOLLRUSA-N 1 2 314.429 4.426 20 0 DIADLO Cc1cccc([C@H](c2noc([C@@H]3C[C@H]3c3c[nH]c[nH+]3)n2)C(C)C)c1 ZINC000924067533 1045145891 /nfs/dbraw/zinc/14/58/91/1045145891.db2.gz BYPCKRQDNKQJNQ-BFYDXBDKSA-N 1 2 322.412 4.160 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2ccc(-c3ccc(F)cc3)s2)n1 ZINC000557169702 1045152346 /nfs/dbraw/zinc/15/23/46/1045152346.db2.gz KAZVMCHSNPKJPV-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO Fc1ccccc1-c1cnc(C[NH2+][C@H](c2cccnc2)C2CC2)o1 ZINC000526083118 1045166860 /nfs/dbraw/zinc/16/68/60/1045166860.db2.gz VFNRQGKYOPTRDP-IBGZPJMESA-N 1 2 323.371 4.117 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1ccc(Cl)cc1Cl ZINC000924536419 1045174027 /nfs/dbraw/zinc/17/40/27/1045174027.db2.gz UBAGKDQPPXHJJO-CYBMUJFWSA-N 1 2 311.212 4.457 20 0 DIADLO FC(F)(F)c1ncc(C[N@@H+]2CCC[C@@H]2c2ccccc2)s1 ZINC000447795742 1045176862 /nfs/dbraw/zinc/17/68/62/1045176862.db2.gz PYSDCLLQTBJALA-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1ncc(C[N@H+]2CCC[C@@H]2c2ccccc2)s1 ZINC000447795742 1045176865 /nfs/dbraw/zinc/17/68/65/1045176865.db2.gz PYSDCLLQTBJALA-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1cnc(C(F)(F)F)s1 ZINC000447796304 1045177096 /nfs/dbraw/zinc/17/70/96/1045177096.db2.gz UPLTUADZBCJUNY-UHFFFAOYSA-N 1 2 306.378 4.246 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1cnc(C(F)(F)F)s1 ZINC000447796304 1045177099 /nfs/dbraw/zinc/17/70/99/1045177099.db2.gz UPLTUADZBCJUNY-UHFFFAOYSA-N 1 2 306.378 4.246 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000447850123 1045184559 /nfs/dbraw/zinc/18/45/59/1045184559.db2.gz LKDJXNGPZZFVIN-YOEHRIQHSA-N 1 2 314.429 4.150 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000447850123 1045184564 /nfs/dbraw/zinc/18/45/64/1045184564.db2.gz LKDJXNGPZZFVIN-YOEHRIQHSA-N 1 2 314.429 4.150 20 0 DIADLO CC(C)(C)c1cnc(CNc2ccc(N3CCCC3)c[nH+]2)s1 ZINC000447940961 1045189958 /nfs/dbraw/zinc/18/99/58/1045189958.db2.gz JOWMAHZBXUDIGJ-UHFFFAOYSA-N 1 2 316.474 4.048 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+]Cc2nccc3ccccc32)s1 ZINC000447932204 1045191858 /nfs/dbraw/zinc/19/18/58/1045191858.db2.gz QEYNQDJNTPNEOE-UHFFFAOYSA-N 1 2 311.454 4.279 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2c1nccc2Cl)c1c(F)cccc1F ZINC000924723195 1045194755 /nfs/dbraw/zinc/19/47/55/1045194755.db2.gz ZIKAODJQFWXGNQ-XPTSAGLGSA-N 1 2 308.759 4.351 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(Cl)ccc(F)c1Cl)c1ccnnc1 ZINC000924719907 1045194778 /nfs/dbraw/zinc/19/47/78/1045194778.db2.gz BGIKKHFBHONXEQ-IUCAKERBSA-N 1 2 314.191 4.334 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1c(F)cccc1F)c1cccc(OC)n1 ZINC000924721068 1045195375 /nfs/dbraw/zinc/19/53/75/1045195375.db2.gz NFEFFNZTQWLJMH-RISCZKNCSA-N 1 2 306.356 4.170 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1oc2ccc(F)cc2c1C ZINC000924784106 1045198184 /nfs/dbraw/zinc/19/81/84/1045198184.db2.gz AMWAAZQDFALGLN-CQSZACIVSA-N 1 2 314.360 4.344 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@H](c1nc2ccccc2[nH]1)C(C)C ZINC000924784097 1045198433 /nfs/dbraw/zinc/19/84/33/1045198433.db2.gz ACIZGHPYIJVFSX-WBVHZDCISA-N 1 2 324.428 4.224 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H](C)c2ncco2)ccc1OCC(C)C ZINC000924815410 1045201206 /nfs/dbraw/zinc/20/12/06/1045201206.db2.gz QEDQDGGBYWZXRH-KGLIPLIRSA-N 1 2 318.417 4.130 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccccc1Oc1ccccc1)c1cnn(C)n1 ZINC000924899352 1045208773 /nfs/dbraw/zinc/20/87/73/1045208773.db2.gz DKOLAIQYTURGJN-HUUCEWRRSA-N 1 2 322.412 4.019 20 0 DIADLO CCCc1ccc([C@H]([NH2+][C@H](C)c2noc(C)n2)C(C)C)cc1 ZINC000578101769 1045209091 /nfs/dbraw/zinc/20/90/91/1045209091.db2.gz YJKDULMRKUGNEJ-CXAGYDPISA-N 1 2 301.434 4.378 20 0 DIADLO CCc1ccccc1C[N@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000527324278 1045215292 /nfs/dbraw/zinc/21/52/92/1045215292.db2.gz ISJPZMMHDQKDAG-UHFFFAOYSA-N 1 2 305.425 4.175 20 0 DIADLO CCc1ccccc1C[N@@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000527324278 1045215301 /nfs/dbraw/zinc/21/53/01/1045215301.db2.gz ISJPZMMHDQKDAG-UHFFFAOYSA-N 1 2 305.425 4.175 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccnn2CC2CCC2)cs1 ZINC000925034041 1045220370 /nfs/dbraw/zinc/22/03/70/1045220370.db2.gz POOHUINCOGEVIT-CHWSQXEVSA-N 1 2 318.490 4.114 20 0 DIADLO Clc1cccc2c1[C@H]([NH2+][C@@H]1CSc3ccccc31)COC2 ZINC000925091868 1045225808 /nfs/dbraw/zinc/22/58/08/1045225808.db2.gz DCAYMEVYEHLYFW-HUUCEWRRSA-N 1 2 317.841 4.348 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccccc2Br)ccn1 ZINC000527535007 1045230251 /nfs/dbraw/zinc/23/02/51/1045230251.db2.gz TUHYAKHTOQGSIR-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cc(C[N@H+](C)[C@@H](C)c2ccccc2Br)ccn1 ZINC000527535007 1045230257 /nfs/dbraw/zinc/23/02/57/1045230257.db2.gz TUHYAKHTOQGSIR-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2coc3ccccc23)cs1 ZINC000925234543 1045238176 /nfs/dbraw/zinc/23/81/76/1045238176.db2.gz ANILKMINSZUDMA-NEPJUHHUSA-N 1 2 316.426 4.448 20 0 DIADLO CCC[C@@H]([NH2+]Cc1c(CC)noc1CC)c1ncccc1Cl ZINC000925247741 1045238685 /nfs/dbraw/zinc/23/86/85/1045238685.db2.gz VAKZRLMIMHNKLT-OAHLLOKOSA-N 1 2 321.852 4.479 20 0 DIADLO CCCCN(C(=O)[C@@H]1CCCc2[nH+]c[nH]c21)[C@H]1CCC[C@H](C)C1 ZINC000578392407 1045238990 /nfs/dbraw/zinc/23/89/90/1045238990.db2.gz VRFUKZVZWHCOQE-HRCADAONSA-N 1 2 317.477 4.037 20 0 DIADLO Cc1cc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)ccn1 ZINC000527539138 1045239869 /nfs/dbraw/zinc/23/98/69/1045239869.db2.gz OOODQVHXUNZFAU-UHFFFAOYSA-N 1 2 307.224 4.476 20 0 DIADLO Cc1cc(F)ccc1-c1noc(-c2cccc(-n3cc[nH+]c3)c2)n1 ZINC000578407437 1045240789 /nfs/dbraw/zinc/24/07/89/1045240789.db2.gz FKQQWPNKSRVTCR-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CC(C)c1ncc2c(n1)CC[N@@H+](Cc1ccc(C(F)F)cc1)C2 ZINC000527619215 1045241466 /nfs/dbraw/zinc/24/14/66/1045241466.db2.gz OCJFNBSBOKQZKT-UHFFFAOYSA-N 1 2 317.383 4.096 20 0 DIADLO CC(C)c1ncc2c(n1)CC[N@H+](Cc1ccc(C(F)F)cc1)C2 ZINC000527619215 1045241473 /nfs/dbraw/zinc/24/14/73/1045241473.db2.gz OCJFNBSBOKQZKT-UHFFFAOYSA-N 1 2 317.383 4.096 20 0 DIADLO c1csc(-c2nc(C[N@@H+]3CCC=C(c4ccccn4)C3)co2)c1 ZINC000578421370 1045241719 /nfs/dbraw/zinc/24/17/19/1045241719.db2.gz UHOJUIBGMRQNDL-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO c1csc(-c2nc(C[N@H+]3CCC=C(c4ccccn4)C3)co2)c1 ZINC000578421370 1045241726 /nfs/dbraw/zinc/24/17/26/1045241726.db2.gz UHOJUIBGMRQNDL-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO C[C@H]([NH2+]Cc1ccc2cc[nH]c2c1)c1nc(C2CCCCC2)no1 ZINC000527669100 1045245707 /nfs/dbraw/zinc/24/57/07/1045245707.db2.gz ICZUPNCUJLISHG-ZDUSSCGKSA-N 1 2 324.428 4.449 20 0 DIADLO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccsc1Br)CO2 ZINC000527673353 1045248249 /nfs/dbraw/zinc/24/82/49/1045248249.db2.gz FCEITUXYBKDLTB-GFCCVEGCSA-N 1 2 324.243 4.042 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2cc(Cl)cs2)CCO1 ZINC000578582851 1045255834 /nfs/dbraw/zinc/25/58/34/1045255834.db2.gz PKXOPADZOYLVMB-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2cc(Cl)cs2)CCO1 ZINC000578582851 1045255843 /nfs/dbraw/zinc/25/58/43/1045255843.db2.gz PKXOPADZOYLVMB-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@@H]2c2ccccn2)cc(C(F)(F)F)c1 ZINC000578704497 1045267433 /nfs/dbraw/zinc/26/74/33/1045267433.db2.gz DKNSNVBWRZUBPX-MRXNPFEDSA-N 1 2 322.330 4.143 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@@H]2c2ccccn2)cc(C(F)(F)F)c1 ZINC000578704497 1045267440 /nfs/dbraw/zinc/26/74/40/1045267440.db2.gz DKNSNVBWRZUBPX-MRXNPFEDSA-N 1 2 322.330 4.143 20 0 DIADLO Cc1cc(NC(c2ccccc2)c2ccccc2)nc(C2CC2)[nH+]1 ZINC000578813047 1045273560 /nfs/dbraw/zinc/27/35/60/1045273560.db2.gz AEZRSHYANMUOPO-UHFFFAOYSA-N 1 2 315.420 4.864 20 0 DIADLO C[C@H]1CCCC[C@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000578858556 1045276464 /nfs/dbraw/zinc/27/64/64/1045276464.db2.gz SINAMZMWIYHGNG-WMLDXEAASA-N 1 2 322.412 4.275 20 0 DIADLO c1ccc2c(c1)NCCC[C@@H]2Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000578939455 1045283136 /nfs/dbraw/zinc/28/31/36/1045283136.db2.gz CGXIIVUKZXTOMO-IBGZPJMESA-N 1 2 322.456 4.431 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1ncc(Cl)s1 ZINC000579018255 1045287927 /nfs/dbraw/zinc/28/79/27/1045287927.db2.gz ZPNCFHBSIWBYJO-ZDUSSCGKSA-N 1 2 310.850 4.388 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000579018255 1045287932 /nfs/dbraw/zinc/28/79/32/1045287932.db2.gz ZPNCFHBSIWBYJO-ZDUSSCGKSA-N 1 2 310.850 4.388 20 0 DIADLO COCc1ccc([C@@H]2CCCN2c2[nH+]ccc3ccccc32)o1 ZINC000527964325 1045289232 /nfs/dbraw/zinc/28/92/32/1045289232.db2.gz ICPWQAIYSWMIRX-KRWDZBQOSA-N 1 2 308.381 4.316 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncccc2F)c(Cl)c1 ZINC000528037252 1045295431 /nfs/dbraw/zinc/29/54/31/1045295431.db2.gz GZIQJUZYXJCQSN-MNOVXSKESA-N 1 2 308.784 4.295 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ncccc2F)c(Cl)c1 ZINC000528037253 1045296123 /nfs/dbraw/zinc/29/61/23/1045296123.db2.gz GZIQJUZYXJCQSN-QWRGUYRKSA-N 1 2 308.784 4.295 20 0 DIADLO C/C(=C/c1cccc(C(F)(F)F)c1)C[N@@H+](C)Cc1ccon1 ZINC000579175428 1045297818 /nfs/dbraw/zinc/29/78/18/1045297818.db2.gz SHCUQIVRXMBXEA-WQLSENKSSA-N 1 2 310.319 4.229 20 0 DIADLO C/C(=C/c1cccc(C(F)(F)F)c1)C[N@H+](C)Cc1ccon1 ZINC000579175428 1045297822 /nfs/dbraw/zinc/29/78/22/1045297822.db2.gz SHCUQIVRXMBXEA-WQLSENKSSA-N 1 2 310.319 4.229 20 0 DIADLO c1cn(Cc2cccc(-c3noc([C@H]4CCCC45CC5)n3)c2)c[nH+]1 ZINC000528097082 1045303108 /nfs/dbraw/zinc/30/31/08/1045303108.db2.gz BTJJHBDZVHGEQR-MRXNPFEDSA-N 1 2 320.396 4.029 20 0 DIADLO Clc1ccc(C[NH2+][C@@H](c2ccccc2)c2ccncc2)nc1 ZINC000779149279 1045323484 /nfs/dbraw/zinc/32/34/84/1045323484.db2.gz FERWDYKNUPPGNH-SFHVURJKSA-N 1 2 309.800 4.009 20 0 DIADLO Fc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)c1Br ZINC000448991332 1045329964 /nfs/dbraw/zinc/32/99/64/1045329964.db2.gz JDYGXXRLILIKAO-CQSZACIVSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1cccc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c1Br ZINC000448991332 1045329969 /nfs/dbraw/zinc/32/99/69/1045329969.db2.gz JDYGXXRLILIKAO-CQSZACIVSA-N 1 2 323.209 4.253 20 0 DIADLO COc1cc2ccccc2cc1C[N@@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000449018945 1045332917 /nfs/dbraw/zinc/33/29/17/1045332917.db2.gz PNQPSFRHJVCTMJ-GOSISDBHSA-N 1 2 321.424 4.299 20 0 DIADLO COc1cc2ccccc2cc1C[N@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000449018945 1045332926 /nfs/dbraw/zinc/33/29/26/1045332926.db2.gz PNQPSFRHJVCTMJ-GOSISDBHSA-N 1 2 321.424 4.299 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1ccnn1C1CCCC1 ZINC000449008129 1045334539 /nfs/dbraw/zinc/33/45/39/1045334539.db2.gz OGUQCXDGKGEFCM-CYBMUJFWSA-N 1 2 301.459 4.179 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccnn1C1CCCC1 ZINC000449008129 1045334546 /nfs/dbraw/zinc/33/45/46/1045334546.db2.gz OGUQCXDGKGEFCM-CYBMUJFWSA-N 1 2 301.459 4.179 20 0 DIADLO c1cn(CCOc2ccccc2N[C@H]2CCCC23CCC3)c[nH+]1 ZINC000449050554 1045341534 /nfs/dbraw/zinc/34/15/34/1045341534.db2.gz PJOKTCIKECCWNN-SFHVURJKSA-N 1 2 311.429 4.097 20 0 DIADLO C[C@H]1COCCN1c1ccc([NH2+][C@@H]2CCC23CCCC3)cc1 ZINC000189213226 1045344053 /nfs/dbraw/zinc/34/40/53/1045344053.db2.gz GAEZPSVLJWSFPX-MAUKXSAKSA-N 1 2 300.446 4.046 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cccnc2C(F)(F)F)C2CC2)o1 ZINC000528357596 1045344908 /nfs/dbraw/zinc/34/49/08/1045344908.db2.gz UWKTUOWATZOYKB-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cccnc2C(F)(F)F)C2CC2)o1 ZINC000528357596 1045344911 /nfs/dbraw/zinc/34/49/11/1045344911.db2.gz UWKTUOWATZOYKB-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO FC(F)(F)c1ncccc1C[N@@H+]1CCCc2sccc2C1 ZINC000528375949 1045346534 /nfs/dbraw/zinc/34/65/34/1045346534.db2.gz DWDYPRPLOZMDCJ-UHFFFAOYSA-N 1 2 312.360 4.110 20 0 DIADLO FC(F)(F)c1ncccc1C[N@H+]1CCCc2sccc2C1 ZINC000528375949 1045346537 /nfs/dbraw/zinc/34/65/37/1045346537.db2.gz DWDYPRPLOZMDCJ-UHFFFAOYSA-N 1 2 312.360 4.110 20 0 DIADLO CCCCCC[C@H](C)NC(=O)c1ccc(Cn2cc[nH+]c2)cc1 ZINC000076341790 1045347957 /nfs/dbraw/zinc/34/79/57/1045347957.db2.gz HSIHWFILDBZYSR-INIZCTEOSA-N 1 2 313.445 4.020 20 0 DIADLO C[C@H]([NH2+]Cc1ncccc1Cl)c1ccccc1OC(F)F ZINC000528433617 1045356182 /nfs/dbraw/zinc/35/61/82/1045356182.db2.gz RDGJIRMCDCZITN-JTQLQIEISA-N 1 2 312.747 4.187 20 0 DIADLO Cc1ccc2sc(C[N@H+](Cc3ccncc3)C3CC3)nc2c1 ZINC000528424672 1045357056 /nfs/dbraw/zinc/35/70/56/1045357056.db2.gz MTGZZHFEWZKNDN-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO Cc1ccc2sc(C[N@@H+](Cc3ccncc3)C3CC3)nc2c1 ZINC000528424672 1045357059 /nfs/dbraw/zinc/35/70/59/1045357059.db2.gz MTGZZHFEWZKNDN-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO CC(C)CC[C@@H]1CC[C@@H]([NH2+][C@@H](c2nnc[nH]2)c2ccccc2)C1 ZINC000449239978 1045368385 /nfs/dbraw/zinc/36/83/85/1045368385.db2.gz XGWXLRIQNSIQDP-KBAYOESNSA-N 1 2 312.461 4.089 20 0 DIADLO COc1cc(C[NH2+]Cc2noc3c2CCCC3)cc2ccccc21 ZINC000449329845 1045375175 /nfs/dbraw/zinc/37/51/75/1045375175.db2.gz QCFYPRVMRJXVPF-UHFFFAOYSA-N 1 2 322.408 4.005 20 0 DIADLO Fc1ccc(C2CC2)cc1C[NH2+]Cc1c[nH]c(-c2ccccc2)n1 ZINC000449374355 1045384317 /nfs/dbraw/zinc/38/43/17/1045384317.db2.gz YRZSYQCTKRTIKR-UHFFFAOYSA-N 1 2 321.399 4.383 20 0 DIADLO Cc1ccc(OCc2nc(C[N@@H+]3CC[C@@H]3C3CC3)cs2)cc1 ZINC000449427131 1045392824 /nfs/dbraw/zinc/39/28/24/1045392824.db2.gz NKUQYHOHTAHPIO-QGZVFWFLSA-N 1 2 314.454 4.015 20 0 DIADLO Cc1ccc(OCc2nc(C[N@H+]3CC[C@@H]3C3CC3)cs2)cc1 ZINC000449427131 1045392828 /nfs/dbraw/zinc/39/28/28/1045392828.db2.gz NKUQYHOHTAHPIO-QGZVFWFLSA-N 1 2 314.454 4.015 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000449458859 1045396071 /nfs/dbraw/zinc/39/60/71/1045396071.db2.gz JHJWUVWJROBNMW-UONOGXRCSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000449458859 1045396073 /nfs/dbraw/zinc/39/60/73/1045396073.db2.gz JHJWUVWJROBNMW-UONOGXRCSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nccn1-c1ccccc1 ZINC000449462409 1045399932 /nfs/dbraw/zinc/39/99/32/1045399932.db2.gz SXRRBRNJJBQPNE-KBPBESRZSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1nccn1-c1ccccc1 ZINC000449462409 1045399937 /nfs/dbraw/zinc/39/99/37/1045399937.db2.gz SXRRBRNJJBQPNE-KBPBESRZSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000528722419 1045403229 /nfs/dbraw/zinc/40/32/29/1045403229.db2.gz YOPKWKFXNYWIJH-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H](c1ccccn1)[N@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000528722419 1045403233 /nfs/dbraw/zinc/40/32/33/1045403233.db2.gz YOPKWKFXNYWIJH-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO CCc1nc(C)c(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)o1 ZINC000528718540 1045403319 /nfs/dbraw/zinc/40/33/19/1045403319.db2.gz IEHJSOUODDJBID-UHFFFAOYSA-N 1 2 324.346 4.123 20 0 DIADLO CCc1nc(C)c(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)o1 ZINC000528718540 1045403321 /nfs/dbraw/zinc/40/33/21/1045403321.db2.gz IEHJSOUODDJBID-UHFFFAOYSA-N 1 2 324.346 4.123 20 0 DIADLO CCO[C@@H]1CC[N@H+](Cc2cc(Cl)sc2Cl)C[C@@H]1C ZINC000449504520 1045404396 /nfs/dbraw/zinc/40/43/96/1045404396.db2.gz QLCACCOMJFOEDY-GXSJLCMTSA-N 1 2 308.274 4.302 20 0 DIADLO CCO[C@@H]1CC[N@@H+](Cc2cc(Cl)sc2Cl)C[C@@H]1C ZINC000449504520 1045404401 /nfs/dbraw/zinc/40/44/01/1045404401.db2.gz QLCACCOMJFOEDY-GXSJLCMTSA-N 1 2 308.274 4.302 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+]2CCC(F)(F)C[C@H]2C)o1 ZINC000528763707 1045408728 /nfs/dbraw/zinc/40/87/28/1045408728.db2.gz BBJCHHBLSQEIBX-CYBMUJFWSA-N 1 2 306.356 4.270 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+]2CCC(F)(F)C[C@H]2C)o1 ZINC000528763707 1045408729 /nfs/dbraw/zinc/40/87/29/1045408729.db2.gz BBJCHHBLSQEIBX-CYBMUJFWSA-N 1 2 306.356 4.270 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+]2CCC(F)(F)C[C@@H]2C)o1 ZINC000528763708 1045408790 /nfs/dbraw/zinc/40/87/90/1045408790.db2.gz BBJCHHBLSQEIBX-ZDUSSCGKSA-N 1 2 306.356 4.270 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+]2CCC(F)(F)C[C@@H]2C)o1 ZINC000528763708 1045408792 /nfs/dbraw/zinc/40/87/92/1045408792.db2.gz BBJCHHBLSQEIBX-ZDUSSCGKSA-N 1 2 306.356 4.270 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1coc(-c2cccc(F)c2)n1 ZINC000528766007 1045411728 /nfs/dbraw/zinc/41/17/28/1045411728.db2.gz HZYYHPHSWMUMMH-LLVKDONJSA-N 1 2 310.319 4.100 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1coc(-c2cccc(F)c2)n1 ZINC000528766007 1045411729 /nfs/dbraw/zinc/41/17/29/1045411729.db2.gz HZYYHPHSWMUMMH-LLVKDONJSA-N 1 2 310.319 4.100 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1csc(Br)c1 ZINC000528769782 1045413030 /nfs/dbraw/zinc/41/30/30/1045413030.db2.gz SRONCLWORAUPTO-QMMMGPOBSA-N 1 2 310.207 4.130 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1csc(Br)c1 ZINC000528769782 1045413033 /nfs/dbraw/zinc/41/30/33/1045413033.db2.gz SRONCLWORAUPTO-QMMMGPOBSA-N 1 2 310.207 4.130 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3)cc2F)c2nccn21 ZINC000449574282 1045415626 /nfs/dbraw/zinc/41/56/26/1045415626.db2.gz UILDVUFTTOYOHJ-KUHUBIRLSA-N 1 2 321.399 4.485 20 0 DIADLO Cc1ncsc1C[N@@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000528794257 1045415694 /nfs/dbraw/zinc/41/56/94/1045415694.db2.gz BSLWIAUFMNZQJE-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1ncsc1C[N@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000528794257 1045415696 /nfs/dbraw/zinc/41/56/96/1045415696.db2.gz BSLWIAUFMNZQJE-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3F)o2)c2nccn21 ZINC000449575040 1045416073 /nfs/dbraw/zinc/41/60/73/1045416073.db2.gz WSXVUNDWQOHKRG-LRDDRELGSA-N 1 2 311.360 4.078 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](CC)c2cc(C)ccc2C)n1 ZINC000528799557 1045416675 /nfs/dbraw/zinc/41/66/75/1045416675.db2.gz IQRZYRHDRPSSOM-MRXNPFEDSA-N 1 2 301.434 4.270 20 0 DIADLO CCc1ncc(C[NH2+]Cc2ccc(-c3ccc(CC)cc3)o2)o1 ZINC000449610496 1045418496 /nfs/dbraw/zinc/41/84/96/1045418496.db2.gz QVQNWYVZHRADAF-UHFFFAOYSA-N 1 2 310.397 4.349 20 0 DIADLO COCc1cnc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2C)s1 ZINC000449730034 1045430081 /nfs/dbraw/zinc/43/00/81/1045430081.db2.gz CKTFIOTWHNFJSL-INIZCTEOSA-N 1 2 320.433 4.074 20 0 DIADLO COCc1cnc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2C)s1 ZINC000449730034 1045430089 /nfs/dbraw/zinc/43/00/89/1045430089.db2.gz CKTFIOTWHNFJSL-INIZCTEOSA-N 1 2 320.433 4.074 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)cc1O ZINC000449729856 1045430224 /nfs/dbraw/zinc/43/02/24/1045430224.db2.gz BWVNJZYRDXVWHA-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)cc1O ZINC000449729856 1045430228 /nfs/dbraw/zinc/43/02/28/1045430228.db2.gz BWVNJZYRDXVWHA-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2csc(-c3ccccn3)n2)cc1C ZINC000449763359 1045437629 /nfs/dbraw/zinc/43/76/29/1045437629.db2.gz RAHVFLSXWDDXDD-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2csc(-c3ccccn3)n2)cc1C ZINC000449763359 1045437632 /nfs/dbraw/zinc/43/76/32/1045437632.db2.gz RAHVFLSXWDDXDD-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](Cc2ccccc2)C(C)C)n1 ZINC000120413863 1045473020 /nfs/dbraw/zinc/47/30/20/1045473020.db2.gz DKFBFMUMPYXBDH-AWEZNQCLSA-N 1 2 319.474 4.294 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](Cc2ccccc2)C(C)C)n1 ZINC000120413863 1045473026 /nfs/dbraw/zinc/47/30/26/1045473026.db2.gz DKFBFMUMPYXBDH-AWEZNQCLSA-N 1 2 319.474 4.294 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1cccc(C(C)=O)c1 ZINC000450211080 1045475593 /nfs/dbraw/zinc/47/55/93/1045475593.db2.gz NVTCTLBONIXXCY-UHFFFAOYSA-N 1 2 317.816 4.183 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1cccc(C(C)=O)c1 ZINC000450211080 1045475596 /nfs/dbraw/zinc/47/55/96/1045475596.db2.gz NVTCTLBONIXXCY-UHFFFAOYSA-N 1 2 317.816 4.183 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2nnc(C(C)C)s2)c1 ZINC000450287959 1045483030 /nfs/dbraw/zinc/48/30/30/1045483030.db2.gz PWUDQQHOOUBWBM-HNNXBMFYSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2nnc(C(C)C)s2)c1 ZINC000450287959 1045483033 /nfs/dbraw/zinc/48/30/33/1045483033.db2.gz PWUDQQHOOUBWBM-HNNXBMFYSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2nnc(C3CC3)s2)c(C)c1 ZINC000450289788 1045484842 /nfs/dbraw/zinc/48/48/42/1045484842.db2.gz SNDAYQAXFXPNEN-CYBMUJFWSA-N 1 2 301.459 4.225 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nnc(C3CC3)s2)c(C)c1 ZINC000450289788 1045484845 /nfs/dbraw/zinc/48/48/45/1045484845.db2.gz SNDAYQAXFXPNEN-CYBMUJFWSA-N 1 2 301.459 4.225 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2nnc(C(C)C)s2)c1 ZINC000450299429 1045485092 /nfs/dbraw/zinc/48/50/92/1045485092.db2.gz PAIAPVKXFOHLCI-AWEZNQCLSA-N 1 2 303.475 4.471 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2nnc(C(C)C)s2)c1 ZINC000450299429 1045485093 /nfs/dbraw/zinc/48/50/93/1045485093.db2.gz PAIAPVKXFOHLCI-AWEZNQCLSA-N 1 2 303.475 4.471 20 0 DIADLO CCOc1cc(C[N@H+](C)[C@@H](C)c2ccco2)c(F)cc1OC ZINC000529521539 1045489263 /nfs/dbraw/zinc/48/92/63/1045489263.db2.gz ABZJODIQAIOCFV-LBPRGKRZSA-N 1 2 307.365 4.019 20 0 DIADLO CCOc1cc(C[N@@H+](C)[C@@H](C)c2ccco2)c(F)cc1OC ZINC000529521539 1045489266 /nfs/dbraw/zinc/48/92/66/1045489266.db2.gz ABZJODIQAIOCFV-LBPRGKRZSA-N 1 2 307.365 4.019 20 0 DIADLO FC(F)(F)c1sccc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000529567935 1045498056 /nfs/dbraw/zinc/49/80/56/1045498056.db2.gz XREUCQNPNNMWRY-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1sccc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000529567935 1045498058 /nfs/dbraw/zinc/49/80/58/1045498058.db2.gz XREUCQNPNNMWRY-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2Cl)C[N@@H+]1CC1CC(F)(F)C1 ZINC000450387952 1045499481 /nfs/dbraw/zinc/49/94/81/1045499481.db2.gz HDLKJBPJBWFEPS-NHYWBVRUSA-N 1 2 315.791 4.147 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2Cl)C[N@H+]1CC1CC(F)(F)C1 ZINC000450387952 1045499483 /nfs/dbraw/zinc/49/94/83/1045499483.db2.gz HDLKJBPJBWFEPS-NHYWBVRUSA-N 1 2 315.791 4.147 20 0 DIADLO CC(C)c1nnc(C[N@@H+](Cc2ccc(F)cc2)CC2CC2)s1 ZINC000450405735 1045501508 /nfs/dbraw/zinc/50/15/08/1045501508.db2.gz FAQRVBHNUGSSNU-UHFFFAOYSA-N 1 2 319.449 4.213 20 0 DIADLO CC(C)c1nnc(C[N@H+](Cc2ccc(F)cc2)CC2CC2)s1 ZINC000450405735 1045501516 /nfs/dbraw/zinc/50/15/16/1045501516.db2.gz FAQRVBHNUGSSNU-UHFFFAOYSA-N 1 2 319.449 4.213 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nnc(C3CC3)s2)o1 ZINC000450420705 1045503171 /nfs/dbraw/zinc/50/31/71/1045503171.db2.gz CQORDNJCAGKKOM-AWEZNQCLSA-N 1 2 317.458 4.434 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2nnc(C3CC3)s2)o1 ZINC000450420705 1045503173 /nfs/dbraw/zinc/50/31/73/1045503173.db2.gz CQORDNJCAGKKOM-AWEZNQCLSA-N 1 2 317.458 4.434 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccc(F)c2)s1 ZINC000450433662 1045504105 /nfs/dbraw/zinc/50/41/05/1045504105.db2.gz BKOAIHZYFUJQFQ-IUODEOHRSA-N 1 2 319.449 4.384 20 0 DIADLO CC(C)c1nnc(C[N@H+]2C[C@H](C)C[C@@H]2c2cccc(F)c2)s1 ZINC000450433662 1045504114 /nfs/dbraw/zinc/50/41/14/1045504114.db2.gz BKOAIHZYFUJQFQ-IUODEOHRSA-N 1 2 319.449 4.384 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2nnc(C3CC3)s2)cc1 ZINC000450436804 1045504742 /nfs/dbraw/zinc/50/47/42/1045504742.db2.gz RNNDDKOAAWSCPB-INIZCTEOSA-N 1 2 313.470 4.451 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2nnc(C3CC3)s2)cc1 ZINC000450436804 1045504747 /nfs/dbraw/zinc/50/47/47/1045504747.db2.gz RNNDDKOAAWSCPB-INIZCTEOSA-N 1 2 313.470 4.451 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccc(F)c2)s1 ZINC000450433661 1045504894 /nfs/dbraw/zinc/50/48/94/1045504894.db2.gz BKOAIHZYFUJQFQ-DOMZBBRYSA-N 1 2 319.449 4.384 20 0 DIADLO CC(C)c1nnc(C[N@H+]2C[C@H](C)C[C@H]2c2cccc(F)c2)s1 ZINC000450433661 1045504900 /nfs/dbraw/zinc/50/49/00/1045504900.db2.gz BKOAIHZYFUJQFQ-DOMZBBRYSA-N 1 2 319.449 4.384 20 0 DIADLO CC(=O)c1ccc(C[N@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)cc1 ZINC000450440215 1045506056 /nfs/dbraw/zinc/50/60/56/1045506056.db2.gz PBMQBNWSSHPRGB-IIBYNOLFSA-N 1 2 323.436 4.160 20 0 DIADLO CC(=O)c1ccc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)cc1 ZINC000450440215 1045506062 /nfs/dbraw/zinc/50/60/62/1045506062.db2.gz PBMQBNWSSHPRGB-IIBYNOLFSA-N 1 2 323.436 4.160 20 0 DIADLO CCC[C@]1(C)CCC[N@@H+]([C@@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001307500718 1045512026 /nfs/dbraw/zinc/51/20/26/1045512026.db2.gz VVJGKFUOVXZQRO-SJLPKXTDSA-N 1 2 323.864 4.456 20 0 DIADLO CCC[C@]1(C)CCC[N@H+]([C@@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001307500718 1045512034 /nfs/dbraw/zinc/51/20/34/1045512034.db2.gz VVJGKFUOVXZQRO-SJLPKXTDSA-N 1 2 323.864 4.456 20 0 DIADLO CC(C)c1nnc(C[N@H+](Cc2ccccc2)C(C)(C)C)s1 ZINC000450493471 1045512919 /nfs/dbraw/zinc/51/29/19/1045512919.db2.gz CRYYSKIKUWNIDM-UHFFFAOYSA-N 1 2 303.475 4.462 20 0 DIADLO CC(C)c1nnc(C[N@@H+](Cc2ccccc2)C(C)(C)C)s1 ZINC000450493471 1045512923 /nfs/dbraw/zinc/51/29/23/1045512923.db2.gz CRYYSKIKUWNIDM-UHFFFAOYSA-N 1 2 303.475 4.462 20 0 DIADLO CC(C)c1nc(C[NH+]2CCC(OC3CCCC3)CC2)cs1 ZINC000121133145 1045515406 /nfs/dbraw/zinc/51/54/06/1045515406.db2.gz HZIMUCURVUEFIW-UHFFFAOYSA-N 1 2 308.491 4.190 20 0 DIADLO CC[C@@H](NC(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccccc1F ZINC000654088389 1045517798 /nfs/dbraw/zinc/51/77/98/1045517798.db2.gz YOTZUPHLDGZIQB-MRXNPFEDSA-N 1 2 315.392 4.419 20 0 DIADLO CSc1cccc(N(C)C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000654087899 1045518189 /nfs/dbraw/zinc/51/81/89/1045518189.db2.gz ONKZZWUMHNXVMX-UHFFFAOYSA-N 1 2 315.442 4.397 20 0 DIADLO CCCCC[NH+](CCCCC)Cn1ncc2ccccc2c1=O ZINC000077443431 1045521189 /nfs/dbraw/zinc/52/11/89/1045521189.db2.gz FJOYPTUBMLXFIT-UHFFFAOYSA-N 1 2 315.461 4.036 20 0 DIADLO Cc1c[nH]c(C[N@H+](Cc2ccccc2)[C@H](C)c2ccccc2)n1 ZINC000628129591 1045525814 /nfs/dbraw/zinc/52/58/14/1045525814.db2.gz KHKVWTXEBMTZTI-QGZVFWFLSA-N 1 2 305.425 4.482 20 0 DIADLO Cc1c[nH]c(C[N@@H+](Cc2ccccc2)[C@H](C)c2ccccc2)n1 ZINC000628129591 1045525827 /nfs/dbraw/zinc/52/58/27/1045525827.db2.gz KHKVWTXEBMTZTI-QGZVFWFLSA-N 1 2 305.425 4.482 20 0 DIADLO Cc1ncc(C[N@@H+]2CCC[C@@H]2c2ccc(Br)cc2)o1 ZINC000628150564 1045531762 /nfs/dbraw/zinc/53/17/62/1045531762.db2.gz XXVREBZPLOOHOG-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ncc(C[N@H+]2CCC[C@@H]2c2ccc(Br)cc2)o1 ZINC000628150564 1045531770 /nfs/dbraw/zinc/53/17/70/1045531770.db2.gz XXVREBZPLOOHOG-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO CCC[N@H+](Cn1nc(C)sc1=S)[C@@H]1CCc2ccccc21 ZINC000750600954 1045537352 /nfs/dbraw/zinc/53/73/52/1045537352.db2.gz DEQBHMQRJLIHOR-OAHLLOKOSA-N 1 2 319.499 4.340 20 0 DIADLO CCC[N@@H+](Cn1nc(C)sc1=S)[C@@H]1CCc2ccccc21 ZINC000750600954 1045537366 /nfs/dbraw/zinc/53/73/66/1045537366.db2.gz DEQBHMQRJLIHOR-OAHLLOKOSA-N 1 2 319.499 4.340 20 0 DIADLO c1nc(C2CC2)oc1C[N@@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000628187635 1045538037 /nfs/dbraw/zinc/53/80/37/1045538037.db2.gz VRMLZVGSZDBLOQ-MRXNPFEDSA-N 1 2 323.396 4.420 20 0 DIADLO c1nc(C2CC2)oc1C[N@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000628187635 1045538045 /nfs/dbraw/zinc/53/80/45/1045538045.db2.gz VRMLZVGSZDBLOQ-MRXNPFEDSA-N 1 2 323.396 4.420 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2nc(C)c(C)[nH]2)o1 ZINC000628188846 1045538280 /nfs/dbraw/zinc/53/82/80/1045538280.db2.gz LFCHYXQOJAPNLW-WBMJQRKESA-N 1 2 301.434 4.155 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2nc(C)c(C)[nH]2)o1 ZINC000628188846 1045538294 /nfs/dbraw/zinc/53/82/94/1045538294.db2.gz LFCHYXQOJAPNLW-WBMJQRKESA-N 1 2 301.434 4.155 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CCN2Cc2[nH]c(C)c(C)[nH+]2)o1 ZINC000628188846 1045538299 /nfs/dbraw/zinc/53/82/99/1045538299.db2.gz LFCHYXQOJAPNLW-WBMJQRKESA-N 1 2 301.434 4.155 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1nnc(C2CC2)s1 ZINC000450661806 1045538967 /nfs/dbraw/zinc/53/89/67/1045538967.db2.gz GDOCQBAPHIXPTD-CQSZACIVSA-N 1 2 317.458 4.055 20 0 DIADLO CO[C@@H]1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C[C@H]1C ZINC000450769572 1045560983 /nfs/dbraw/zinc/56/09/83/1045560983.db2.gz WLWKWTJHUFZHEI-IAQYHMDHSA-N 1 2 324.346 4.115 20 0 DIADLO CC(C)C[C@@H](C(=O)N1CCC[C@@H]1C1CCCCC1)n1cc[nH+]c1 ZINC001626153667 1045561593 /nfs/dbraw/zinc/56/15/93/1045561593.db2.gz GNOBXNRTXQWATN-MSOLQXFVSA-N 1 2 317.477 4.042 20 0 DIADLO Cc1nc(C[NH+]2CCC([C@@H](F)c3ccccc3F)CC2)[nH]c1C ZINC000628271122 1045561760 /nfs/dbraw/zinc/56/17/60/1045561760.db2.gz NGKDOFVONWAVBJ-GOSISDBHSA-N 1 2 319.399 4.088 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@H](C)C3CC(F)(F)C3)cc2)c1C ZINC000628290029 1045562994 /nfs/dbraw/zinc/56/29/94/1045562994.db2.gz TZGYXIJYCSBINE-GFCCVEGCSA-N 1 2 305.372 4.335 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@@H](C)C3CC(F)(F)C3)cc2)c1C ZINC000628290030 1045564680 /nfs/dbraw/zinc/56/46/80/1045564680.db2.gz TZGYXIJYCSBINE-LBPRGKRZSA-N 1 2 305.372 4.335 20 0 DIADLO C(=C\c1ccccc1)\CC[N@@H+]1CCSC[C@H]1c1nccs1 ZINC000450761139 1045565066 /nfs/dbraw/zinc/56/50/66/1045565066.db2.gz QUDLSFPLBFGANN-FAOGRTBUSA-N 1 2 316.495 4.337 20 0 DIADLO C(=C\c1ccccc1)\CC[N@H+]1CCSC[C@H]1c1nccs1 ZINC000450761139 1045565073 /nfs/dbraw/zinc/56/50/73/1045565073.db2.gz QUDLSFPLBFGANN-FAOGRTBUSA-N 1 2 316.495 4.337 20 0 DIADLO Cc1[nH]c(CN2CC[C@H](C(F)(F)F)c3ccccc32)[nH+]c1C ZINC000628294380 1045565569 /nfs/dbraw/zinc/56/55/69/1045565569.db2.gz PHTPUCZHZGFZBE-ZDUSSCGKSA-N 1 2 309.335 4.083 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[N@H+](C)Cc1cnc(C)o1 ZINC000628325846 1045567576 /nfs/dbraw/zinc/56/75/76/1045567576.db2.gz GZZDUSCNGSXSQU-OAHLLOKOSA-N 1 2 320.820 4.154 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[N@@H+](C)Cc1cnc(C)o1 ZINC000628325846 1045567586 /nfs/dbraw/zinc/56/75/86/1045567586.db2.gz GZZDUSCNGSXSQU-OAHLLOKOSA-N 1 2 320.820 4.154 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2ccccc2OC2CC2)cs1 ZINC000450780195 1045567841 /nfs/dbraw/zinc/56/78/41/1045567841.db2.gz QBNCZKJXPDQBCI-QGZVFWFLSA-N 1 2 314.454 4.330 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2ccccc2OC2CC2)cs1 ZINC000450780195 1045567850 /nfs/dbraw/zinc/56/78/50/1045567850.db2.gz QBNCZKJXPDQBCI-QGZVFWFLSA-N 1 2 314.454 4.330 20 0 DIADLO C[N@H+](CC(=O)Nc1cccc2ccccc21)Cc1ccc(F)cc1 ZINC000008120418 1045575742 /nfs/dbraw/zinc/57/57/42/1045575742.db2.gz BSWKIODHRFXPAK-UHFFFAOYSA-N 1 2 322.383 4.049 20 0 DIADLO C[N@@H+](CC(=O)Nc1cccc2ccccc21)Cc1ccc(F)cc1 ZINC000008120418 1045575752 /nfs/dbraw/zinc/57/57/52/1045575752.db2.gz BSWKIODHRFXPAK-UHFFFAOYSA-N 1 2 322.383 4.049 20 0 DIADLO COc1cc(C[N@H+](C)Cc2cc(C(C)(C)C)n[nH]2)ccc1Cl ZINC000450869064 1045583276 /nfs/dbraw/zinc/58/32/76/1045583276.db2.gz JQKZIFRJIUIIDG-UHFFFAOYSA-N 1 2 321.852 4.001 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2cc(C(C)(C)C)n[nH]2)ccc1Cl ZINC000450869064 1045583287 /nfs/dbraw/zinc/58/32/87/1045583287.db2.gz JQKZIFRJIUIIDG-UHFFFAOYSA-N 1 2 321.852 4.001 20 0 DIADLO CNc1cccc(Br)c1Nc1ccc(C)[nH+]c1C ZINC001203374936 1045585583 /nfs/dbraw/zinc/58/55/83/1045585583.db2.gz PDWUDNHTPGFVKK-UHFFFAOYSA-N 1 2 306.207 4.246 20 0 DIADLO C[C@H](c1csnn1)[NH+]1CCC(C)(c2ccc(Cl)cc2)CC1 ZINC000450886508 1045590936 /nfs/dbraw/zinc/59/09/36/1045590936.db2.gz XBOHRHDDVQBYRU-GFCCVEGCSA-N 1 2 321.877 4.306 20 0 DIADLO CC[C@H]1C[C@@]1([NH2+]Cc1nnc(C(C)C)s1)c1cccc(C)c1 ZINC000450921553 1045596468 /nfs/dbraw/zinc/59/64/68/1045596468.db2.gz IQSCJLQCUYZTAR-KSSFIOAISA-N 1 2 315.486 4.385 20 0 DIADLO Cc1ccc2[nH]c([C@@H]3CCC[N@@H+]3Cc3ccc(C)nc3C)nc2c1 ZINC000451016706 1045610125 /nfs/dbraw/zinc/61/01/25/1045610125.db2.gz OKPXJDWZXLPWCA-IBGZPJMESA-N 1 2 320.440 4.220 20 0 DIADLO Cc1ccc2[nH]c([C@@H]3CCC[N@H+]3Cc3ccc(C)nc3C)nc2c1 ZINC000451016706 1045610131 /nfs/dbraw/zinc/61/01/31/1045610131.db2.gz OKPXJDWZXLPWCA-IBGZPJMESA-N 1 2 320.440 4.220 20 0 DIADLO Cc1ccc2nc([C@@H]3CCC[N@@H+]3Cc3ccc(C)nc3C)[nH]c2c1 ZINC000451016706 1045610133 /nfs/dbraw/zinc/61/01/33/1045610133.db2.gz OKPXJDWZXLPWCA-IBGZPJMESA-N 1 2 320.440 4.220 20 0 DIADLO Cc1ccc2nc([C@@H]3CCC[N@H+]3Cc3ccc(C)nc3C)[nH]c2c1 ZINC000451016706 1045610141 /nfs/dbraw/zinc/61/01/41/1045610141.db2.gz OKPXJDWZXLPWCA-IBGZPJMESA-N 1 2 320.440 4.220 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)s1 ZINC000451059009 1045619624 /nfs/dbraw/zinc/61/96/24/1045619624.db2.gz BRDPDDLHVLCLAF-CYBMUJFWSA-N 1 2 321.877 4.304 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)s1 ZINC000451059009 1045619626 /nfs/dbraw/zinc/61/96/26/1045619626.db2.gz BRDPDDLHVLCLAF-CYBMUJFWSA-N 1 2 321.877 4.304 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2ccnc(Cl)c2)C1 ZINC000800472829 1045624055 /nfs/dbraw/zinc/62/40/55/1045624055.db2.gz BNPYRFWGFDLZLA-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2ccnc(Cl)c2)C1 ZINC000800472829 1045624061 /nfs/dbraw/zinc/62/40/61/1045624061.db2.gz BNPYRFWGFDLZLA-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C)s1)c1ccc(Cl)c(Cl)c1 ZINC000391921846 1045624503 /nfs/dbraw/zinc/62/45/03/1045624503.db2.gz GCQYSQWZCCHGNW-LBPRGKRZSA-N 1 2 316.257 4.394 20 0 DIADLO COc1ccc([NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)c(OC)c1 ZINC000800483786 1045627097 /nfs/dbraw/zinc/62/70/97/1045627097.db2.gz PELQXAROVXINDQ-GDBMZVCRSA-N 1 2 312.413 4.237 20 0 DIADLO C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+]1CCC[C@@](C)(F)C1 ZINC000451123196 1045628406 /nfs/dbraw/zinc/62/84/06/1045628406.db2.gz UXKIGVYJZXROHA-BDJLRTHQSA-N 1 2 323.799 4.275 20 0 DIADLO C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[N@H+]1CCC[C@@](C)(F)C1 ZINC000451123196 1045628415 /nfs/dbraw/zinc/62/84/15/1045628415.db2.gz UXKIGVYJZXROHA-BDJLRTHQSA-N 1 2 323.799 4.275 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001460794130 1045641299 /nfs/dbraw/zinc/64/12/99/1045641299.db2.gz XOXYPVKKPFKEOQ-SKDRFNHKSA-N 1 2 309.784 4.381 20 0 DIADLO FC(F)[C@@H](CCc1ccccc1)[NH2+]CCSC(F)(F)F ZINC000779393560 1045661709 /nfs/dbraw/zinc/66/17/09/1045661709.db2.gz SVOVYUSPHFGPBT-LLVKDONJSA-N 1 2 313.335 4.096 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001460794130 1045641291 /nfs/dbraw/zinc/64/12/91/1045641291.db2.gz XOXYPVKKPFKEOQ-SKDRFNHKSA-N 1 2 309.784 4.381 20 0 DIADLO C[C@H]1CC[N@H+](Cn2nc(-c3ccccc3)sc2=S)[C@H]1C ZINC000751938873 1045644171 /nfs/dbraw/zinc/64/41/71/1045644171.db2.gz BKQUFOCNBQKZHQ-RYUDHWBXSA-N 1 2 305.472 4.029 20 0 DIADLO C[C@H]1CC[N@@H+](Cn2nc(-c3ccccc3)sc2=S)[C@H]1C ZINC000751938873 1045644180 /nfs/dbraw/zinc/64/41/80/1045644180.db2.gz BKQUFOCNBQKZHQ-RYUDHWBXSA-N 1 2 305.472 4.029 20 0 DIADLO Clc1cc(C[N@@H+]2CCCSCC2)ccc1Br ZINC000530335238 1045646387 /nfs/dbraw/zinc/64/63/87/1045646387.db2.gz SDZBBDOTXVHXCJ-UHFFFAOYSA-N 1 2 320.683 4.041 20 0 DIADLO Clc1cc(C[N@H+]2CCCSCC2)ccc1Br ZINC000530335238 1045646393 /nfs/dbraw/zinc/64/63/93/1045646393.db2.gz SDZBBDOTXVHXCJ-UHFFFAOYSA-N 1 2 320.683 4.041 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1OC(F)F)c1ccccc1F ZINC000530366386 1045651990 /nfs/dbraw/zinc/65/19/90/1045651990.db2.gz ZMJMWWGLZRYPSI-JTQLQIEISA-N 1 2 313.294 4.417 20 0 DIADLO Cl/C=C\C[N@H+](Cc1csc(Br)c1)C1CC1 ZINC000752083670 1045656444 /nfs/dbraw/zinc/65/64/44/1045656444.db2.gz VHVZUVZDTHXZKE-RJRFIUFISA-N 1 2 306.656 4.228 20 0 DIADLO Cl/C=C\C[N@@H+](Cc1csc(Br)c1)C1CC1 ZINC000752083670 1045656449 /nfs/dbraw/zinc/65/64/49/1045656449.db2.gz VHVZUVZDTHXZKE-RJRFIUFISA-N 1 2 306.656 4.228 20 0 DIADLO C[NH2+]c1ccc(NCc2ccc(OC)c(OCC(C)C)c2)cc1 ZINC000629389040 1045665799 /nfs/dbraw/zinc/66/57/99/1045665799.db2.gz IOPCZYOXXAQKMD-UHFFFAOYSA-N 1 2 314.429 4.384 20 0 DIADLO CC(C)Cc1noc(C[N@H+](Cc2ccoc2)C2CCCCC2)n1 ZINC000303949905 1045667693 /nfs/dbraw/zinc/66/76/93/1045667693.db2.gz VLGNOMDHDMBZNQ-UHFFFAOYSA-N 1 2 317.433 4.196 20 0 DIADLO CC(C)Cc1noc(C[N@@H+](Cc2ccoc2)C2CCCCC2)n1 ZINC000303949905 1045667700 /nfs/dbraw/zinc/66/77/00/1045667700.db2.gz VLGNOMDHDMBZNQ-UHFFFAOYSA-N 1 2 317.433 4.196 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)Nc1cccc2ccsc21 ZINC000752253112 1045670021 /nfs/dbraw/zinc/67/00/21/1045670021.db2.gz PFXZASNSIPUULD-UHFFFAOYSA-N 1 2 308.366 4.193 20 0 DIADLO Cc1cc([NH2+][C@@H]2CCC[C@@H]2CCCF)ccc1N1CCOCC1 ZINC000800982228 1045675798 /nfs/dbraw/zinc/67/57/98/1045675798.db2.gz FFCXUAPGZJCDEQ-SJLPKXTDSA-N 1 2 320.452 4.162 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1nc2cc(C(F)(F)F)ccc2o1 ZINC000121994785 1045693035 /nfs/dbraw/zinc/69/30/35/1045693035.db2.gz KMHXFXXXAIBNPX-UHFFFAOYSA-N 1 2 324.302 4.380 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1nc2cc(C(F)(F)F)ccc2o1 ZINC000121994785 1045693042 /nfs/dbraw/zinc/69/30/42/1045693042.db2.gz KMHXFXXXAIBNPX-UHFFFAOYSA-N 1 2 324.302 4.380 20 0 DIADLO CC[N@H+](Cc1csc([C@H](C)OC)n1)Cc1ccc(C)cc1 ZINC000530627913 1045702375 /nfs/dbraw/zinc/70/23/75/1045702375.db2.gz IXDZTEMSIMCIRU-AWEZNQCLSA-N 1 2 304.459 4.181 20 0 DIADLO CC[N@@H+](Cc1csc([C@H](C)OC)n1)Cc1ccc(C)cc1 ZINC000530627913 1045702382 /nfs/dbraw/zinc/70/23/82/1045702382.db2.gz IXDZTEMSIMCIRU-AWEZNQCLSA-N 1 2 304.459 4.181 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2nc3ccccc3o2)s1 ZINC000122076507 1045705475 /nfs/dbraw/zinc/70/54/75/1045705475.db2.gz VFOSQZLPTWXBSQ-GFCCVEGCSA-N 1 2 315.442 4.348 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2nc3ccccc3o2)s1 ZINC000122076507 1045705491 /nfs/dbraw/zinc/70/54/91/1045705491.db2.gz VFOSQZLPTWXBSQ-GFCCVEGCSA-N 1 2 315.442 4.348 20 0 DIADLO Cc1nc(N[C@@H]2CCOc3c(Cl)c(Cl)ccc32)cc[nH+]1 ZINC000752972427 1045716105 /nfs/dbraw/zinc/71/61/05/1045716105.db2.gz BMYUVCRPJSTWNV-LLVKDONJSA-N 1 2 310.184 4.028 20 0 DIADLO Clc1ccc(C[N@@H+]2CC[C@@H]2Cc2ccccc2)c(Cl)n1 ZINC000801520323 1045728524 /nfs/dbraw/zinc/72/85/24/1045728524.db2.gz FEMZPABDMZGIDV-CQSZACIVSA-N 1 2 307.224 4.205 20 0 DIADLO Clc1ccc(C[N@H+]2CC[C@@H]2Cc2ccccc2)c(Cl)n1 ZINC000801520323 1045728536 /nfs/dbraw/zinc/72/85/36/1045728536.db2.gz FEMZPABDMZGIDV-CQSZACIVSA-N 1 2 307.224 4.205 20 0 DIADLO CCCCCC(C)(C)C(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC000753290796 1045744662 /nfs/dbraw/zinc/74/46/62/1045744662.db2.gz MVQQSLIRDXCCBT-UHFFFAOYSA-N 1 2 320.477 4.272 20 0 DIADLO CCCc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)s1 ZINC001124708114 1045751537 /nfs/dbraw/zinc/75/15/37/1045751537.db2.gz IOXNNCHRNGCRAU-UHFFFAOYSA-N 1 2 311.410 4.139 20 0 DIADLO FC(F)(F)[C@H]1CCC[C@@H](c2csc(Cn3cc[nH+]c3)n2)C1 ZINC000630386614 1045757239 /nfs/dbraw/zinc/75/72/39/1045757239.db2.gz SGCUUOMXSJPOKP-MNOVXSKESA-N 1 2 315.364 4.224 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000530963148 1045760129 /nfs/dbraw/zinc/76/01/29/1045760129.db2.gz RSEMVTSDTAIPPG-LJQANCHMSA-N 1 2 324.424 4.020 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000530963148 1045760133 /nfs/dbraw/zinc/76/01/33/1045760133.db2.gz RSEMVTSDTAIPPG-LJQANCHMSA-N 1 2 324.424 4.020 20 0 DIADLO c1csc(-c2cc(C[N@@H+]3CCC[C@H]3c3ccccn3)no2)c1 ZINC000530962287 1045762228 /nfs/dbraw/zinc/76/22/28/1045762228.db2.gz CUSHOAZHUNVTCG-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2cc(C[N@H+]3CCC[C@H]3c3ccccn3)no2)c1 ZINC000530962287 1045762239 /nfs/dbraw/zinc/76/22/39/1045762239.db2.gz CUSHOAZHUNVTCG-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2cc(C)oc2C)c2ccco2)cc1 ZINC000753680339 1045789986 /nfs/dbraw/zinc/78/99/86/1045789986.db2.gz ZVGVYPNUEVGRQM-LJQANCHMSA-N 1 2 311.381 4.377 20 0 DIADLO FC(F)c1ccc(CNc2ccc(N3CCCCC3)[nH+]c2)cn1 ZINC000630953202 1045794409 /nfs/dbraw/zinc/79/44/09/1045794409.db2.gz WEKYYYSRWRRWMF-UHFFFAOYSA-N 1 2 318.371 4.017 20 0 DIADLO C[NH+](C)c1ccc(N[C@H](c2ccc(F)cc2)c2ccccn2)cc1 ZINC000753721693 1045794831 /nfs/dbraw/zinc/79/48/31/1045794831.db2.gz VIXVCHZCSKSKPX-HXUWFJFHSA-N 1 2 321.399 4.488 20 0 DIADLO C[NH+](C)c1ccc(N[C@@H](c2ccc(F)cc2)c2ccccn2)cc1 ZINC000753721690 1045795071 /nfs/dbraw/zinc/79/50/71/1045795071.db2.gz VIXVCHZCSKSKPX-FQEVSTJZSA-N 1 2 321.399 4.488 20 0 DIADLO Cc1cc(Cl)ccc1NC(=O)C[N@H+](Cc1ccco1)C(C)C ZINC000531344244 1045828112 /nfs/dbraw/zinc/82/81/12/1045828112.db2.gz SWSHOIZZLCSROM-UHFFFAOYSA-N 1 2 320.820 4.091 20 0 DIADLO Cc1cc(Cl)ccc1NC(=O)C[N@@H+](Cc1ccco1)C(C)C ZINC000531344244 1045828120 /nfs/dbraw/zinc/82/81/20/1045828120.db2.gz SWSHOIZZLCSROM-UHFFFAOYSA-N 1 2 320.820 4.091 20 0 DIADLO O[C@]1(CNc2cc3ccccc3c[nH+]2)CCC[C@@H](C(F)(F)F)C1 ZINC000631232811 1045838804 /nfs/dbraw/zinc/83/88/04/1045838804.db2.gz IBCXYVOHSOJQJK-GDBMZVCRSA-N 1 2 324.346 4.130 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C3CC3)no2)cc1 ZINC000282034257 1045845392 /nfs/dbraw/zinc/84/53/92/1045845392.db2.gz YLLGYJUWPZIKSS-GHMZBOCLSA-N 1 2 303.431 4.081 20 0 DIADLO CC(C)Cc1ncc(C[NH2+][C@H](CF)c2ccc(F)cc2)s1 ZINC000631284527 1045848588 /nfs/dbraw/zinc/84/85/88/1045848588.db2.gz PODPUPUKWYUHMJ-OAHLLOKOSA-N 1 2 310.413 4.281 20 0 DIADLO CC(C)c1cc(N2CCC(c3ncco3)CC2)nc(C(C)C)[nH+]1 ZINC000631322784 1045851201 /nfs/dbraw/zinc/85/12/01/1045851201.db2.gz MLMVPKZTHKSPRH-UHFFFAOYSA-N 1 2 314.433 4.095 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1cccc(C(F)(F)F)c1 ZINC000079316765 1045902473 /nfs/dbraw/zinc/90/24/73/1045902473.db2.gz MNKVUHMETBRJLH-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1cccc(C(F)(F)F)c1 ZINC000079316765 1045902482 /nfs/dbraw/zinc/90/24/82/1045902482.db2.gz MNKVUHMETBRJLH-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO CC[N@H+](Cc1cscn1)Cc1cccc(C(F)(F)F)c1 ZINC001137597971 1045904332 /nfs/dbraw/zinc/90/43/32/1045904332.db2.gz ZZPIZBWKTNNRFW-UHFFFAOYSA-N 1 2 300.349 4.184 20 0 DIADLO CC[N@@H+](Cc1cscn1)Cc1cccc(C(F)(F)F)c1 ZINC001137597971 1045904344 /nfs/dbraw/zinc/90/43/44/1045904344.db2.gz ZZPIZBWKTNNRFW-UHFFFAOYSA-N 1 2 300.349 4.184 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nc([C@H](C)OCC(C)C)no2)s1 ZINC000754667822 1045908598 /nfs/dbraw/zinc/90/85/98/1045908598.db2.gz LZODCSUZIVZEFI-OLZOCXBDSA-N 1 2 323.462 4.024 20 0 DIADLO CCc1noc(C)c1C[NH2+][C@H](C)c1nc2ccccc2s1 ZINC000754701776 1045914632 /nfs/dbraw/zinc/91/46/32/1045914632.db2.gz MIRFXHZKKAFJQW-SNVBAGLBSA-N 1 2 301.415 4.006 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2cc(Cl)nc(Cl)c2)n1 ZINC000754719998 1045918699 /nfs/dbraw/zinc/91/86/99/1045918699.db2.gz HCSSHHUAKJETHU-QMMMGPOBSA-N 1 2 302.230 4.004 20 0 DIADLO COc1cc2c(cc1F)CC[C@H]2[NH2+][C@@H](CF)c1ccc(F)cc1 ZINC000631798462 1045919186 /nfs/dbraw/zinc/91/91/86/1045919186.db2.gz SYLMMMKESAMRAU-SJORKVTESA-N 1 2 321.342 4.261 20 0 DIADLO COc1ccc2c(c1F)CC[C@H]2[NH2+][C@H](CF)c1ccc(F)cc1 ZINC000631797402 1045919294 /nfs/dbraw/zinc/91/92/94/1045919294.db2.gz AKKOOAPDQKOFPH-HZPDHXFCSA-N 1 2 321.342 4.261 20 0 DIADLO COc1ccc(OC)c([C@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)c1 ZINC000631795143 1045919320 /nfs/dbraw/zinc/91/93/20/1045919320.db2.gz GPIMCTMPYQJCHR-YVEFUNNKSA-N 1 2 321.367 4.204 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)c(OC)c1 ZINC000631795967 1045919596 /nfs/dbraw/zinc/91/95/96/1045919596.db2.gz QFCBZJRSUNFBBZ-PXAZEXFGSA-N 1 2 321.367 4.204 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)cc1F ZINC000631795518 1045919724 /nfs/dbraw/zinc/91/97/24/1045919724.db2.gz KJXGXFYCKICZKD-MEDUHNTESA-N 1 2 309.331 4.335 20 0 DIADLO COc1ccc2c(c1F)CC[C@@H]2[NH2+][C@@H](CF)c1ccc(F)cc1 ZINC000631797400 1045919802 /nfs/dbraw/zinc/91/98/02/1045919802.db2.gz AKKOOAPDQKOFPH-HOTGVXAUSA-N 1 2 321.342 4.261 20 0 DIADLO CC(C)c1ccc([C@@H](C)[N@@H+]2CCc3cc(Cl)nnc3C2)cc1 ZINC000829169956 1045958465 /nfs/dbraw/zinc/95/84/65/1045958465.db2.gz UFALIGDPNDOXGM-CYBMUJFWSA-N 1 2 315.848 4.373 20 0 DIADLO CC(C)c1ccc([C@@H](C)[N@H+]2CCc3cc(Cl)nnc3C2)cc1 ZINC000829169956 1045958479 /nfs/dbraw/zinc/95/84/79/1045958479.db2.gz UFALIGDPNDOXGM-CYBMUJFWSA-N 1 2 315.848 4.373 20 0 DIADLO Cc1ccc2c(ccc(C)c2C(=O)Nc2cc(N(C)C)cc[nH+]2)c1 ZINC001137799968 1045969338 /nfs/dbraw/zinc/96/93/38/1045969338.db2.gz PSMGBMFANCHBSE-UHFFFAOYSA-N 1 2 319.408 4.170 20 0 DIADLO C[NH+](C)c1ccc(N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000193118654 1045969276 /nfs/dbraw/zinc/96/92/76/1045969276.db2.gz GCRINLADWBVOFO-SFHVURJKSA-N 1 2 311.385 4.150 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@@](C)(F)C2)c(Br)c1 ZINC001137802657 1045971207 /nfs/dbraw/zinc/97/12/07/1045971207.db2.gz FNEAEUWBDMIGQH-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@@](C)(F)C2)c(Br)c1 ZINC001137802657 1045971215 /nfs/dbraw/zinc/97/12/15/1045971215.db2.gz FNEAEUWBDMIGQH-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc(C)nc2)c(Br)c1 ZINC001137808421 1045971295 /nfs/dbraw/zinc/97/12/95/1045971295.db2.gz OSLZNBJYZXOQRF-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc(C)nc2)c(Br)c1 ZINC001137808421 1045971302 /nfs/dbraw/zinc/97/13/02/1045971302.db2.gz OSLZNBJYZXOQRF-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2ccc(Cl)nc2Cl)CC1 ZINC000829702439 1045999175 /nfs/dbraw/zinc/99/91/75/1045999175.db2.gz OBOMJHANLLNVEQ-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CCC[C@H](Oc3ccccc3)C2)cc1F ZINC001137891372 1045999440 /nfs/dbraw/zinc/99/94/40/1045999440.db2.gz MTBYWUHRYQLIMU-HNNXBMFYSA-N 1 2 321.342 4.147 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CCC[C@H](Oc3ccccc3)C2)cc1F ZINC001137891372 1045999448 /nfs/dbraw/zinc/99/94/48/1045999448.db2.gz MTBYWUHRYQLIMU-HNNXBMFYSA-N 1 2 321.342 4.147 20 0 DIADLO Fc1cc(F)c(C[NH+]2CCC3(CC(F)(F)C3)CC2)cc1F ZINC001137886298 1046000316 /nfs/dbraw/zinc/00/03/16/1046000316.db2.gz JELIOVCZXWBRQV-UHFFFAOYSA-N 1 2 305.290 4.115 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(C)(F)F ZINC000453296093 1046019477 /nfs/dbraw/zinc/01/94/77/1046019477.db2.gz QVAWWYMZIIUVFM-VHSXEESVSA-N 1 2 311.294 4.322 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CC=C(c3ccccc3)CC2)c1F ZINC001137932199 1046022461 /nfs/dbraw/zinc/02/24/61/1046022461.db2.gz NDRXCVLPVBJXOE-UHFFFAOYSA-N 1 2 303.327 4.393 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CC=C(c3ccccc3)CC2)c1F ZINC001137932199 1046022477 /nfs/dbraw/zinc/02/24/77/1046022477.db2.gz NDRXCVLPVBJXOE-UHFFFAOYSA-N 1 2 303.327 4.393 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(F)c(F)c2F)cc1 ZINC001137939041 1046025470 /nfs/dbraw/zinc/02/54/70/1046025470.db2.gz GNCOOPIBQKOCOL-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(F)c(F)c2F)cc1 ZINC001137939041 1046025482 /nfs/dbraw/zinc/02/54/82/1046025482.db2.gz GNCOOPIBQKOCOL-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@H](Oc3ccccc3)C2)c(F)c1F ZINC001137939200 1046025852 /nfs/dbraw/zinc/02/58/52/1046025852.db2.gz OEUHHSBEEXRDRW-HNNXBMFYSA-N 1 2 321.342 4.147 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@H](Oc3ccccc3)C2)c(F)c1F ZINC001137939200 1046025865 /nfs/dbraw/zinc/02/58/65/1046025865.db2.gz OEUHHSBEEXRDRW-HNNXBMFYSA-N 1 2 321.342 4.147 20 0 DIADLO FC(F)(F)Sc1ccc(C[N@@H+]2CCc3ncccc3C2)cc1 ZINC001137955229 1046033388 /nfs/dbraw/zinc/03/33/88/1046033388.db2.gz NNZBGFAOXYZMOF-UHFFFAOYSA-N 1 2 324.371 4.252 20 0 DIADLO FC(F)(F)Sc1ccc(C[N@H+]2CCc3ncccc3C2)cc1 ZINC001137955229 1046033400 /nfs/dbraw/zinc/03/34/00/1046033400.db2.gz NNZBGFAOXYZMOF-UHFFFAOYSA-N 1 2 324.371 4.252 20 0 DIADLO COc1cccc2c1CC[N@H+](Cc1cccc(Cl)c1F)C2 ZINC001137963358 1046036513 /nfs/dbraw/zinc/03/65/13/1046036513.db2.gz FJNZHJLUYHNLOC-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc2c1CC[N@@H+](Cc1cccc(Cl)c1F)C2 ZINC001137963358 1046036526 /nfs/dbraw/zinc/03/65/26/1046036526.db2.gz FJNZHJLUYHNLOC-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CCn1cnc(C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2F)c1 ZINC000902657706 1046042709 /nfs/dbraw/zinc/04/27/09/1046042709.db2.gz GSCVXDPCUNGEOS-VIFPVBQESA-N 1 2 316.207 4.200 20 0 DIADLO Cc1ccc2[nH+]c(C)cc(OCc3nnc(C4CC4)s3)c2c1 ZINC000902692842 1046046246 /nfs/dbraw/zinc/04/62/46/1046046246.db2.gz CXUNPUVQYGWRFH-UHFFFAOYSA-N 1 2 311.410 4.160 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nccn1CC)c1cc(Cl)ccc1OC ZINC000453356006 1046055353 /nfs/dbraw/zinc/05/53/53/1046055353.db2.gz OVMWTNRMBXXEKB-WFASDCNBSA-N 1 2 321.852 4.367 20 0 DIADLO Fc1c(C[NH+]2CC(c3ccccc3)C2)cccc1C(F)(F)F ZINC001138012103 1046057433 /nfs/dbraw/zinc/05/74/33/1046057433.db2.gz VNMXUZVGRPXMLD-UHFFFAOYSA-N 1 2 309.306 4.444 20 0 DIADLO CCCn1cc([C@@H](C)[NH2+][C@@H](C)c2oc3ccccc3c2C)nn1 ZINC000902765629 1046063985 /nfs/dbraw/zinc/06/39/85/1046063985.db2.gz REUVPLNSHFPTGD-KGLIPLIRSA-N 1 2 312.417 4.155 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccccc1Oc1ccccc1)c1cn(C)nn1 ZINC000902786582 1046069663 /nfs/dbraw/zinc/06/96/63/1046069663.db2.gz PTTCTKOIIYBXSC-HUUCEWRRSA-N 1 2 322.412 4.019 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cn(C)nn1)c1ccccc1Oc1ccccc1 ZINC000902786578 1046069912 /nfs/dbraw/zinc/06/99/12/1046069912.db2.gz PTTCTKOIIYBXSC-CABCVRRESA-N 1 2 322.412 4.019 20 0 DIADLO c1ccc(COc2cccc(C[NH+]3CC4(C3)CCCCO4)c2)cc1 ZINC001138076708 1046085780 /nfs/dbraw/zinc/08/57/80/1046085780.db2.gz SNDHOMOUKIORHJ-UHFFFAOYSA-N 1 2 323.436 4.021 20 0 DIADLO CC(=O)[C@@H]1CCC[N@H+](Cc2cc(C(F)(F)F)ccc2Cl)C1 ZINC001138085491 1046088186 /nfs/dbraw/zinc/08/81/86/1046088186.db2.gz IWFVPKHXZTVICW-LLVKDONJSA-N 1 2 319.754 4.160 20 0 DIADLO CC(=O)[C@@H]1CCC[N@@H+](Cc2cc(C(F)(F)F)ccc2Cl)C1 ZINC001138085491 1046088201 /nfs/dbraw/zinc/08/82/01/1046088201.db2.gz IWFVPKHXZTVICW-LLVKDONJSA-N 1 2 319.754 4.160 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2CCCC[C@H]2c2cccnc2)c1F ZINC001138118520 1046100769 /nfs/dbraw/zinc/10/07/69/1046100769.db2.gz MKGZZDZKIZPSDH-KRWDZBQOSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2CCCC[C@H]2c2cccnc2)c1F ZINC001138118520 1046100779 /nfs/dbraw/zinc/10/07/79/1046100779.db2.gz MKGZZDZKIZPSDH-KRWDZBQOSA-N 1 2 302.368 4.395 20 0 DIADLO O[C@H](C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1)c1c(F)cccc1F ZINC000081604742 1046103327 /nfs/dbraw/zinc/10/33/27/1046103327.db2.gz LWYHGCPITHWQNJ-HZPDHXFCSA-N 1 2 323.770 4.099 20 0 DIADLO O[C@H](C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1)c1c(F)cccc1F ZINC000081604742 1046103330 /nfs/dbraw/zinc/10/33/30/1046103330.db2.gz LWYHGCPITHWQNJ-HZPDHXFCSA-N 1 2 323.770 4.099 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@@H](C)c3cccc(F)c3)cc2[nH+]1 ZINC000532186026 1046108793 /nfs/dbraw/zinc/10/87/93/1046108793.db2.gz GVXSXMPOXAIREB-LLVKDONJSA-N 1 2 311.360 4.143 20 0 DIADLO FC(F)Sc1ccc(C[N@@H+]2CCC[C@H](c3ccn[nH]3)C2)cc1 ZINC000194917969 1046110254 /nfs/dbraw/zinc/11/02/54/1046110254.db2.gz UPIGDMDCILIZLY-ZDUSSCGKSA-N 1 2 323.412 4.104 20 0 DIADLO FC(F)Sc1ccc(C[N@H+]2CCC[C@H](c3ccn[nH]3)C2)cc1 ZINC000194917969 1046110260 /nfs/dbraw/zinc/11/02/60/1046110260.db2.gz UPIGDMDCILIZLY-ZDUSSCGKSA-N 1 2 323.412 4.104 20 0 DIADLO c1csc([C@H]2CCC[N@H+]2Cc2ccc(N3CCCCC3)o2)n1 ZINC001138176950 1046111141 /nfs/dbraw/zinc/11/11/41/1046111141.db2.gz AFWYCEFQRWZWIF-OAHLLOKOSA-N 1 2 317.458 4.064 20 0 DIADLO c1csc([C@H]2CCC[N@@H+]2Cc2ccc(N3CCCCC3)o2)n1 ZINC001138176950 1046111147 /nfs/dbraw/zinc/11/11/47/1046111147.db2.gz AFWYCEFQRWZWIF-OAHLLOKOSA-N 1 2 317.458 4.064 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2ccc(C(F)(F)F)s2)co1 ZINC000903012581 1046141553 /nfs/dbraw/zinc/14/15/53/1046141553.db2.gz RALXKKKWTSHRTP-MRVPVSSYSA-N 1 2 304.337 4.168 20 0 DIADLO CCc1nc(C[NH2+][C@H](CCc2ccccc2)c2cccnc2)co1 ZINC000903012543 1046141864 /nfs/dbraw/zinc/14/18/64/1046141864.db2.gz QHTVWYGLZDFCTD-LJQANCHMSA-N 1 2 321.424 4.096 20 0 DIADLO CCCn1cc([C@H](C)[NH2+]C2(c3ccccc3Cl)CCC2)nn1 ZINC000903037529 1046144991 /nfs/dbraw/zinc/14/49/91/1046144991.db2.gz AKKLIWYNTDZLQV-ZDUSSCGKSA-N 1 2 318.852 4.072 20 0 DIADLO CC[C@@H]([NH2+][C@H](c1nncn1C)C(C)C)c1cccc(Cl)c1F ZINC000903066868 1046152616 /nfs/dbraw/zinc/15/26/16/1046152616.db2.gz XVCASZZRODMGTD-HIFRSBDPSA-N 1 2 324.831 4.046 20 0 DIADLO Cc1cc(C[NH2+]C2(c3noc(C)n3)CCCCCC2)cs1 ZINC000648439667 1046157026 /nfs/dbraw/zinc/15/70/26/1046157026.db2.gz IRYNQGAKUVNCNT-UHFFFAOYSA-N 1 2 305.447 4.087 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(F)c1F)c1ccc(C(F)(F)F)cn1 ZINC000903077046 1046157550 /nfs/dbraw/zinc/15/75/50/1046157550.db2.gz FCWMTILXNRGULH-SECBINFHSA-N 1 2 316.273 4.229 20 0 DIADLO FC(F)(F)c1c[nH]c2[nH+]ccc(NC3(c4ccccn4)CC3)c12 ZINC001168150333 1046158713 /nfs/dbraw/zinc/15/87/13/1046158713.db2.gz DZTRGGRSMLGZDW-UHFFFAOYSA-N 1 2 318.302 4.078 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000903079778 1046159216 /nfs/dbraw/zinc/15/92/16/1046159216.db2.gz KQTFJBMBZXRMOQ-GFCCVEGCSA-N 1 2 314.191 4.023 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000903079778 1046159222 /nfs/dbraw/zinc/15/92/22/1046159222.db2.gz KQTFJBMBZXRMOQ-GFCCVEGCSA-N 1 2 314.191 4.023 20 0 DIADLO COc1cccc(F)c1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001138387087 1046161932 /nfs/dbraw/zinc/16/19/32/1046161932.db2.gz XSRVECYVFGZAJV-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(F)c1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001138387087 1046161938 /nfs/dbraw/zinc/16/19/38/1046161938.db2.gz XSRVECYVFGZAJV-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2cnn(CC3CCC3)c2)cs1 ZINC000903091964 1046161800 /nfs/dbraw/zinc/16/18/00/1046161800.db2.gz DVBSMMBNYMDROI-OLZOCXBDSA-N 1 2 318.490 4.114 20 0 DIADLO COc1cccc(F)c1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001138385068 1046162433 /nfs/dbraw/zinc/16/24/33/1046162433.db2.gz ZVNXTBMIMRZHPK-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(F)c1C[N@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001138385068 1046162440 /nfs/dbraw/zinc/16/24/40/1046162440.db2.gz ZVNXTBMIMRZHPK-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(C(F)(F)F)s2)s1 ZINC000717963534 1046162622 /nfs/dbraw/zinc/16/26/22/1046162622.db2.gz UOQGPYMMACIIMB-RQJHMYQMSA-N 1 2 321.393 4.339 20 0 DIADLO CCc1cccc(Cl)c1C[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000475708372 1046167661 /nfs/dbraw/zinc/16/76/61/1046167661.db2.gz WSAJBQKAVAHNBX-QGZVFWFLSA-N 1 2 305.805 4.069 20 0 DIADLO CCc1cccc(Cl)c1C[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000475708372 1046167666 /nfs/dbraw/zinc/16/76/66/1046167666.db2.gz WSAJBQKAVAHNBX-QGZVFWFLSA-N 1 2 305.805 4.069 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+]1CCc2c(F)cccc2C1 ZINC000757148720 1046170257 /nfs/dbraw/zinc/17/02/57/1046170257.db2.gz FAJOWZYMSXOOHO-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+]1CCc2c(F)cccc2C1 ZINC000757148720 1046170263 /nfs/dbraw/zinc/17/02/63/1046170263.db2.gz FAJOWZYMSXOOHO-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO C[C@H](Nc1ccc([NH+]2CCCC2)cc1)c1cnn(CC2CCC2)c1 ZINC000903133844 1046172583 /nfs/dbraw/zinc/17/25/83/1046172583.db2.gz XXKDUOOKERFDGH-INIZCTEOSA-N 1 2 324.472 4.457 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)cc1F ZINC001138422961 1046175184 /nfs/dbraw/zinc/17/51/84/1046175184.db2.gz CSJAHPVZGNCMSC-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCC[C@@H]2c2ccccc2F)cc1F ZINC001138422961 1046175186 /nfs/dbraw/zinc/17/51/86/1046175186.db2.gz CSJAHPVZGNCMSC-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+](C)Cc3nc4ccccc4o3)cc2c1 ZINC001138420016 1046175469 /nfs/dbraw/zinc/17/54/69/1046175469.db2.gz KPHFMBVDXYQVLX-UHFFFAOYSA-N 1 2 305.381 4.250 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+](C)Cc3nc4ccccc4o3)cc2c1 ZINC001138420016 1046175474 /nfs/dbraw/zinc/17/54/74/1046175474.db2.gz KPHFMBVDXYQVLX-UHFFFAOYSA-N 1 2 305.381 4.250 20 0 DIADLO Cc1cc(Cl)ccc1NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000635146416 1046177379 /nfs/dbraw/zinc/17/73/79/1046177379.db2.gz CSEZFVJWKDVLFE-OAHLLOKOSA-N 1 2 305.809 4.071 20 0 DIADLO c1coc([C@H]([NH2+]Cc2nccc3c2CCCC3)c2ccccc2)c1 ZINC000903182634 1046185387 /nfs/dbraw/zinc/18/53/87/1046185387.db2.gz SWRZRHZWRUNJEL-OAQYLSRUSA-N 1 2 318.420 4.433 20 0 DIADLO C[C@@H]([NH2+]Cc1nccc2c1CCCC2)c1c(F)cccc1F ZINC000903183762 1046186796 /nfs/dbraw/zinc/18/67/96/1046186796.db2.gz GJTNCJUTGILHMA-GFCCVEGCSA-N 1 2 302.368 4.089 20 0 DIADLO CC(C)CC[C@H]([NH2+]Cc1cc(N(C)C)ccn1)c1ccoc1 ZINC000903198515 1046191190 /nfs/dbraw/zinc/19/11/90/1046191190.db2.gz LIWGMGJXBQMHOF-SFHVURJKSA-N 1 2 301.434 4.008 20 0 DIADLO CC(C)CC[C@@H]([NH2+]Cc1cc(N(C)C)ccn1)c1ccoc1 ZINC000903198514 1046192517 /nfs/dbraw/zinc/19/25/17/1046192517.db2.gz LIWGMGJXBQMHOF-GOSISDBHSA-N 1 2 301.434 4.008 20 0 DIADLO C[C@@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1cnn(CC2CCC2)c1 ZINC000903214760 1046195366 /nfs/dbraw/zinc/19/53/66/1046195366.db2.gz XFMAUPNQPNUJRF-FZKQIMNGSA-N 1 2 319.399 4.184 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1cc(OC)no1 ZINC000925262599 1046199996 /nfs/dbraw/zinc/19/99/96/1046199996.db2.gz NOWDAUDWHHOKHP-ZIAGYGMSSA-N 1 2 318.417 4.020 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCc3ncc(Cl)cc3C2)s1 ZINC001138528263 1046211379 /nfs/dbraw/zinc/21/13/79/1046211379.db2.gz QZCJVVCSVFEHHV-UHFFFAOYSA-N 1 2 306.862 4.307 20 0 DIADLO CCCc1ccc(C[N@H+]2CCc3ncc(Cl)cc3C2)s1 ZINC001138528263 1046211389 /nfs/dbraw/zinc/21/13/89/1046211389.db2.gz QZCJVVCSVFEHHV-UHFFFAOYSA-N 1 2 306.862 4.307 20 0 DIADLO CC(C)C[C@H]([NH2+][C@@H]1c2ccccc2OC[C@H]1F)c1ccncc1 ZINC000903266284 1046213316 /nfs/dbraw/zinc/21/33/16/1046213316.db2.gz MPJYCCGTKHRPDG-ZIFCJYIRSA-N 1 2 314.404 4.230 20 0 DIADLO CSc1cc(C)ccc1NC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000636023612 1046213606 /nfs/dbraw/zinc/21/36/06/1046213606.db2.gz PEXDSCZZASBFLK-HNNXBMFYSA-N 1 2 317.458 4.139 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)c(C)c1 ZINC000903312964 1046235482 /nfs/dbraw/zinc/23/54/82/1046235482.db2.gz DTHDAVMJNOYUHR-ZDUSSCGKSA-N 1 2 302.418 4.140 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@@H](c1ncccn1)C1CC1 ZINC000903323622 1046237295 /nfs/dbraw/zinc/23/72/95/1046237295.db2.gz BTKKETOAGAVUJD-SMDDNHRTSA-N 1 2 316.474 4.167 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+][C@@H](c1ncccn1)C1CC1 ZINC000903323616 1046237371 /nfs/dbraw/zinc/23/73/71/1046237371.db2.gz BTKKETOAGAVUJD-BXUZGUMPSA-N 1 2 316.474 4.167 20 0 DIADLO COc1cccc2cc([C@@H](C)[NH2+][C@H](c3ncccn3)C3CC3)oc21 ZINC000903327154 1046239214 /nfs/dbraw/zinc/23/92/14/1046239214.db2.gz PZZITOSPGDHKKI-PXAZEXFGSA-N 1 2 323.396 4.033 20 0 DIADLO CC[N@H+](Cc1cnn(-c2ccccc2)c1)Cc1ccccc1F ZINC001138602456 1046239949 /nfs/dbraw/zinc/23/99/49/1046239949.db2.gz AUSYCLYNWQJTHO-UHFFFAOYSA-N 1 2 309.388 4.034 20 0 DIADLO CC[N@@H+](Cc1cnn(-c2ccccc2)c1)Cc1ccccc1F ZINC001138602456 1046239957 /nfs/dbraw/zinc/23/99/57/1046239957.db2.gz AUSYCLYNWQJTHO-UHFFFAOYSA-N 1 2 309.388 4.034 20 0 DIADLO C[C@H]1C[C@H]([NH2+][C@H](c2ncccn2)C2CC2)c2ccsc2S1 ZINC000903327608 1046241326 /nfs/dbraw/zinc/24/13/26/1046241326.db2.gz WRRSZXIHXLRNCC-BPNCWPANSA-N 1 2 317.483 4.204 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H](c1ncccn1)C1CC1 ZINC000903331953 1046243077 /nfs/dbraw/zinc/24/30/77/1046243077.db2.gz LBSSIGFMIZZCGU-SUMWQHHRSA-N 1 2 307.397 4.333 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@H](c1ncccn1)C1CC1 ZINC000903331951 1046244004 /nfs/dbraw/zinc/24/40/04/1046244004.db2.gz LBSSIGFMIZZCGU-DYVFJYSZSA-N 1 2 307.397 4.333 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1F ZINC000102639235 1046246005 /nfs/dbraw/zinc/24/60/05/1046246005.db2.gz UCCMPDMXLSSSBH-ZDUSSCGKSA-N 1 2 323.371 4.348 20 0 DIADLO CCC[C@@H]([NH2+]Cc1cn(C)cn1)c1ccc(Cl)cc1Cl ZINC000903350935 1046254382 /nfs/dbraw/zinc/25/43/82/1046254382.db2.gz FZQBAUHUGBXGGF-OAHLLOKOSA-N 1 2 312.244 4.358 20 0 DIADLO CCCn1ncc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c1C ZINC001138642431 1046255154 /nfs/dbraw/zinc/25/51/54/1046255154.db2.gz YIPQLKAQVGSEOU-KRWDZBQOSA-N 1 2 319.399 4.217 20 0 DIADLO CCCn1ncc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)c1C ZINC001138642431 1046255169 /nfs/dbraw/zinc/25/51/69/1046255169.db2.gz YIPQLKAQVGSEOU-KRWDZBQOSA-N 1 2 319.399 4.217 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1csc(C)n1)c1cc(F)ccc1OC ZINC000903370127 1046256328 /nfs/dbraw/zinc/25/63/28/1046256328.db2.gz CQJNILZQYLXSKN-YGRLFVJLSA-N 1 2 308.422 4.401 20 0 DIADLO Cc1cc(C)cc(NC(=O)N[C@@H](C)c2c[nH+]c3c(C)cccn23)c1 ZINC001202852511 1046257246 /nfs/dbraw/zinc/25/72/46/1046257246.db2.gz IHLDHTBOPICVHN-HNNXBMFYSA-N 1 2 322.412 4.142 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1nc2ccc(F)cc2s1 ZINC000758302415 1046261290 /nfs/dbraw/zinc/26/12/90/1046261290.db2.gz JNXCOBJJUDREIE-UHFFFAOYSA-N 1 2 315.417 4.422 20 0 DIADLO Cc1cc(NCc2nc3ccc(F)cc3s2)ccc1[NH+](C)C ZINC000758393763 1046267398 /nfs/dbraw/zinc/26/73/98/1046267398.db2.gz JQUNDYPPBHLBSJ-UHFFFAOYSA-N 1 2 315.417 4.422 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2c(Cl)[nH]c3ccccc32)no1 ZINC001138684689 1046267367 /nfs/dbraw/zinc/26/73/67/1046267367.db2.gz MXUYOLQBHKPYCU-INIZCTEOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2c(Cl)[nH]c3ccccc32)no1 ZINC001138684689 1046267383 /nfs/dbraw/zinc/26/73/83/1046267383.db2.gz MXUYOLQBHKPYCU-INIZCTEOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1nc2c(o1)CC[N@H+](Cc1ccc(-c3ccc(F)cc3)cc1)C2 ZINC001138684883 1046268055 /nfs/dbraw/zinc/26/80/55/1046268055.db2.gz UMBQZYRWUQVVMI-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1nc2c(o1)CC[N@@H+](Cc1ccc(-c3ccc(F)cc3)cc1)C2 ZINC001138684883 1046268065 /nfs/dbraw/zinc/26/80/65/1046268065.db2.gz UMBQZYRWUQVVMI-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO CSc1ncc(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)cn1 ZINC001138705200 1046274308 /nfs/dbraw/zinc/27/43/08/1046274308.db2.gz KLXLWKCTSGUQIV-MRXNPFEDSA-N 1 2 317.433 4.065 20 0 DIADLO CSc1ncc(C[N@H+]2CCCC[C@@H]2c2ccccc2F)cn1 ZINC001138705200 1046274319 /nfs/dbraw/zinc/27/43/19/1046274319.db2.gz KLXLWKCTSGUQIV-MRXNPFEDSA-N 1 2 317.433 4.065 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1c(C)cccc1Cl)CC2 ZINC001138722004 1046277149 /nfs/dbraw/zinc/27/71/49/1046277149.db2.gz MZDTUHGVPNMCBA-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1c(C)cccc1Cl)CC2 ZINC001138722004 1046277158 /nfs/dbraw/zinc/27/71/58/1046277158.db2.gz MZDTUHGVPNMCBA-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc(Cl)cc2C)o1 ZINC000073605985 1046278667 /nfs/dbraw/zinc/27/86/67/1046278667.db2.gz AXHHGMAZXIJXIE-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc(Cl)cc2C)o1 ZINC000073605985 1046278675 /nfs/dbraw/zinc/27/86/75/1046278675.db2.gz AXHHGMAZXIJXIE-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]Cc1nnc(C2CC2)s1 ZINC000666254846 1046278847 /nfs/dbraw/zinc/27/88/47/1046278847.db2.gz RFKITDTUJKHFMB-SECBINFHSA-N 1 2 322.503 4.155 20 0 DIADLO CCc1cccc2cc(C[N@@H+]3CCC[C@@H]3CF)c(Cl)nc21 ZINC001138730535 1046282163 /nfs/dbraw/zinc/28/21/63/1046282163.db2.gz DSLNBYOEYYWGMR-OAHLLOKOSA-N 1 2 306.812 4.385 20 0 DIADLO CCc1cccc2cc(C[N@H+]3CCC[C@@H]3CF)c(Cl)nc21 ZINC001138730535 1046282177 /nfs/dbraw/zinc/28/21/77/1046282177.db2.gz DSLNBYOEYYWGMR-OAHLLOKOSA-N 1 2 306.812 4.385 20 0 DIADLO Cc1ncc([C@@H](C)[N@H+](Cc2ccc(F)cc2F)C2CC2)c(C)n1 ZINC000637899394 1046284434 /nfs/dbraw/zinc/28/44/34/1046284434.db2.gz ODDFHDHHBNHXBJ-GFCCVEGCSA-N 1 2 317.383 4.097 20 0 DIADLO Cc1ncc([C@@H](C)[N@@H+](Cc2ccc(F)cc2F)C2CC2)c(C)n1 ZINC000637899394 1046284438 /nfs/dbraw/zinc/28/44/38/1046284438.db2.gz ODDFHDHHBNHXBJ-GFCCVEGCSA-N 1 2 317.383 4.097 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ccc(C(F)F)nc2)C2CC2)c(F)c1 ZINC000637899816 1046284519 /nfs/dbraw/zinc/28/45/19/1046284519.db2.gz SQPNAPFGYVQXOX-UHFFFAOYSA-N 1 2 324.321 4.462 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ccc(C(F)F)nc2)C2CC2)c(F)c1 ZINC000637899816 1046284527 /nfs/dbraw/zinc/28/45/27/1046284527.db2.gz SQPNAPFGYVQXOX-UHFFFAOYSA-N 1 2 324.321 4.462 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@H+](Cc2coc(-c3ccccc3)n2)C1 ZINC000170755187 1046285852 /nfs/dbraw/zinc/28/58/52/1046285852.db2.gz ZCOUSCHNJLWEHE-ZDUSSCGKSA-N 1 2 310.319 4.116 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@@H+](Cc2coc(-c3ccccc3)n2)C1 ZINC000170755187 1046285860 /nfs/dbraw/zinc/28/58/60/1046285860.db2.gz ZCOUSCHNJLWEHE-ZDUSSCGKSA-N 1 2 310.319 4.116 20 0 DIADLO CC[N@H+](Cc1cnn(Cc2ccccc2)c1)Cc1ccccc1F ZINC001138767269 1046292281 /nfs/dbraw/zinc/29/22/81/1046292281.db2.gz NDAOCOSEBAXXJT-UHFFFAOYSA-N 1 2 323.415 4.093 20 0 DIADLO CC[N@@H+](Cc1cnn(Cc2ccccc2)c1)Cc1ccccc1F ZINC001138767269 1046292292 /nfs/dbraw/zinc/29/22/92/1046292292.db2.gz NDAOCOSEBAXXJT-UHFFFAOYSA-N 1 2 323.415 4.093 20 0 DIADLO C[C@@H]1c2c(F)cccc2CC[N@H+]1Cc1ccc(C(F)F)nc1 ZINC000638084737 1046295274 /nfs/dbraw/zinc/29/52/74/1046295274.db2.gz LVHCNMOCSIAJRJ-LLVKDONJSA-N 1 2 306.331 4.278 20 0 DIADLO C[C@@H]1c2c(F)cccc2CC[N@@H+]1Cc1ccc(C(F)F)nc1 ZINC000638084737 1046295281 /nfs/dbraw/zinc/29/52/81/1046295281.db2.gz LVHCNMOCSIAJRJ-LLVKDONJSA-N 1 2 306.331 4.278 20 0 DIADLO Clc1cc(C[N@H+](Cc2ccccc2)Cc2ccccn2)ccn1 ZINC001138818710 1046298324 /nfs/dbraw/zinc/29/83/24/1046298324.db2.gz WXMQKKBEZWCFCD-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1cc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)ccn1 ZINC001138818710 1046298333 /nfs/dbraw/zinc/29/83/33/1046298333.db2.gz WXMQKKBEZWCFCD-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO C[C@@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)[C@H]1CC1(F)F ZINC000638227016 1046302701 /nfs/dbraw/zinc/30/27/01/1046302701.db2.gz LWTNXMWDGAFLDW-MLGOLLRUSA-N 1 2 317.383 4.342 20 0 DIADLO O=C1CC[N@@H+](Cc2c[nH]c3c2cccc3Cl)[C@@H]2CCCC[C@H]12 ZINC001138830414 1046305083 /nfs/dbraw/zinc/30/50/83/1046305083.db2.gz LQUFSLYYXKQNGV-GOEBONIOSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c[nH]c3c2cccc3Cl)[C@@H]2CCCC[C@H]12 ZINC001138830414 1046305093 /nfs/dbraw/zinc/30/50/93/1046305093.db2.gz LQUFSLYYXKQNGV-GOEBONIOSA-N 1 2 316.832 4.155 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)c1ccc(Cl)s1 ZINC000638337082 1046315382 /nfs/dbraw/zinc/31/53/82/1046315382.db2.gz MBXAKLOYLYDSHI-IINYFYTJSA-N 1 2 324.881 4.492 20 0 DIADLO Fc1cnc(Cl)c(C[N@H+]2CC=C(c3ccccc3)CC2)c1 ZINC001138895346 1046320381 /nfs/dbraw/zinc/32/03/81/1046320381.db2.gz HJHVFPWJXFIOQQ-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Fc1cnc(Cl)c(C[N@@H+]2CC=C(c3ccccc3)CC2)c1 ZINC001138895346 1046320385 /nfs/dbraw/zinc/32/03/85/1046320385.db2.gz HJHVFPWJXFIOQQ-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nc2ccccc2o1)c1nc2ccccc2[nH]1 ZINC000638441898 1046321700 /nfs/dbraw/zinc/32/17/00/1046321700.db2.gz KOIJTJLCHXIDSB-SFHVURJKSA-N 1 2 320.396 4.191 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)n1 ZINC001138939972 1046331703 /nfs/dbraw/zinc/33/17/03/1046331703.db2.gz YCLJWSOJYKQPTL-LBPRGKRZSA-N 1 2 310.228 4.014 20 0 DIADLO Cc1c[nH]c(C[N@H+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)n1 ZINC001138939972 1046331718 /nfs/dbraw/zinc/33/17/18/1046331718.db2.gz YCLJWSOJYKQPTL-LBPRGKRZSA-N 1 2 310.228 4.014 20 0 DIADLO CCC1CC[NH+](Cc2cc(Br)cnc2Cl)CC1 ZINC001138940122 1046332359 /nfs/dbraw/zinc/33/23/59/1046332359.db2.gz ATCYEDLDNNNCFZ-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@@H+]1Cc1nnc(C(C)(C)C)o1 ZINC000832522895 1046335048 /nfs/dbraw/zinc/33/50/48/1046335048.db2.gz CAJIJHPBBNSJQF-OAHLLOKOSA-N 1 2 317.408 4.152 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@H+]1Cc1nnc(C(C)(C)C)o1 ZINC000832522895 1046335058 /nfs/dbraw/zinc/33/50/58/1046335058.db2.gz CAJIJHPBBNSJQF-OAHLLOKOSA-N 1 2 317.408 4.152 20 0 DIADLO Cc1nc(C[N@@H+]2[C@H](C)CO[C@@H](c3ccccc3)[C@H]2C)sc1C ZINC000246324256 1046342348 /nfs/dbraw/zinc/34/23/48/1046342348.db2.gz XGKYEZGSHXXJCU-RVZJWNSFSA-N 1 2 316.470 4.110 20 0 DIADLO Cc1nc(C[N@H+]2[C@H](C)CO[C@@H](c3ccccc3)[C@H]2C)sc1C ZINC000246324256 1046342362 /nfs/dbraw/zinc/34/23/62/1046342362.db2.gz XGKYEZGSHXXJCU-RVZJWNSFSA-N 1 2 316.470 4.110 20 0 DIADLO c1csc(-c2ccc(C[N@@H+]3CCn4cccc4C3)s2)c1 ZINC001139019256 1046358260 /nfs/dbraw/zinc/35/82/60/1046358260.db2.gz RZAQJJIRSPVLEP-UHFFFAOYSA-N 1 2 300.452 4.294 20 0 DIADLO c1csc(-c2ccc(C[N@H+]3CCn4cccc4C3)s2)c1 ZINC001139019256 1046358267 /nfs/dbraw/zinc/35/82/67/1046358267.db2.gz RZAQJJIRSPVLEP-UHFFFAOYSA-N 1 2 300.452 4.294 20 0 DIADLO Fc1cc(-c2ccco2)ccc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000639117686 1046362493 /nfs/dbraw/zinc/36/24/93/1046362493.db2.gz FOIKUCMMYZUYAZ-UHFFFAOYSA-N 1 2 312.344 4.241 20 0 DIADLO Fc1cc(Cl)cc(F)c1C[N@@H+]1CCC[C@@H](c2ccccn2)C1 ZINC001139051319 1046368827 /nfs/dbraw/zinc/36/88/27/1046368827.db2.gz JZABBMIVENPNFG-GFCCVEGCSA-N 1 2 322.786 4.393 20 0 DIADLO Fc1cc(Cl)cc(F)c1C[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC001139051319 1046368841 /nfs/dbraw/zinc/36/88/41/1046368841.db2.gz JZABBMIVENPNFG-GFCCVEGCSA-N 1 2 322.786 4.393 20 0 DIADLO Fc1cc(Cl)cc(F)c1C[NH+]1CCC(c2ccncc2)CC1 ZINC001139051494 1046369481 /nfs/dbraw/zinc/36/94/81/1046369481.db2.gz QOQQNEDLCWCIEW-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Cn1ccnc1[C@H](C1CC1)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000639184910 1046369611 /nfs/dbraw/zinc/36/96/11/1046369611.db2.gz ZWNPBKITEFKPSR-LSDHHAIUSA-N 1 2 301.459 4.016 20 0 DIADLO Cn1ccnc1[C@H](C1CC1)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000639184910 1046369622 /nfs/dbraw/zinc/36/96/22/1046369622.db2.gz ZWNPBKITEFKPSR-LSDHHAIUSA-N 1 2 301.459 4.016 20 0 DIADLO COc1ccc(C(C)C)cc1C[NH2+][C@H](C)c1c(F)cncc1F ZINC000653674392 1046380162 /nfs/dbraw/zinc/38/01/62/1046380162.db2.gz ATAGTGHXOSTFSM-GFCCVEGCSA-N 1 2 320.383 4.343 20 0 DIADLO CC[N@H+](Cc1c(C)n[nH]c1C)Cc1ccc(Cl)cc1Cl ZINC001139100657 1046386918 /nfs/dbraw/zinc/38/69/18/1046386918.db2.gz RZBILLMHMJGCAV-UHFFFAOYSA-N 1 2 312.244 4.355 20 0 DIADLO CC[N@@H+](Cc1c(C)n[nH]c1C)Cc1ccc(Cl)cc1Cl ZINC001139100657 1046386929 /nfs/dbraw/zinc/38/69/29/1046386929.db2.gz RZBILLMHMJGCAV-UHFFFAOYSA-N 1 2 312.244 4.355 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1ccc(Br)nc1Cl ZINC001139107232 1046387139 /nfs/dbraw/zinc/38/71/39/1046387139.db2.gz AJLGZDJLQBWZEG-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO CC1(F)CC[NH+](Cc2csc(COc3ccccc3)n2)CC1 ZINC000639388562 1046387582 /nfs/dbraw/zinc/38/75/82/1046387582.db2.gz HGMWBVUFVVOSLG-UHFFFAOYSA-N 1 2 320.433 4.046 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1C[NH2+][C@@H](CF)c1ccc(F)cc1 ZINC000639395624 1046389987 /nfs/dbraw/zinc/38/99/87/1046389987.db2.gz RBZASWHICXEOOQ-KRWDZBQOSA-N 1 2 321.415 4.194 20 0 DIADLO Cc1nc(-c2ccccc2)oc1C[NH2+]C(C)(C)c1nccs1 ZINC000639535928 1046409796 /nfs/dbraw/zinc/40/97/96/1046409796.db2.gz JEPYSCWFNOSLLQ-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2nc(CC3CC3)no2)C(C)(C)C)c1 ZINC000639567382 1046412733 /nfs/dbraw/zinc/41/27/33/1046412733.db2.gz NREHVMLZSPEBEV-SFHVURJKSA-N 1 2 313.445 4.208 20 0 DIADLO Cc1cc([C@@H]([NH2+]Cc2nc(C3CCC3)no2)C2CC2)ccc1F ZINC000639570438 1046413648 /nfs/dbraw/zinc/41/36/48/1046413648.db2.gz OJXYEFNDTJVQKE-KRWDZBQOSA-N 1 2 315.392 4.026 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2oc(-c3ccccc3)nc2C)s1 ZINC000639584083 1046415187 /nfs/dbraw/zinc/41/51/87/1046415187.db2.gz JKHUHYBFJZZYIH-CYBMUJFWSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2[nH]c(-c3ccccc3)nc2Cl)C1 ZINC001139279601 1046424038 /nfs/dbraw/zinc/42/40/38/1046424038.db2.gz OFXXTEHGPAJFIH-QGZVFWFLSA-N 1 2 321.827 4.444 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2[nH]c(-c3ccccc3)nc2Cl)C1 ZINC001139279601 1046424042 /nfs/dbraw/zinc/42/40/42/1046424042.db2.gz OFXXTEHGPAJFIH-QGZVFWFLSA-N 1 2 321.827 4.444 20 0 DIADLO Fc1cc(C[NH2+]Cc2ncc(Cl)s2)cc(C(F)(F)F)c1 ZINC000719394337 1046425328 /nfs/dbraw/zinc/42/53/28/1046425328.db2.gz LRJNYSIXFYUFDU-UHFFFAOYSA-N 1 2 324.730 4.244 20 0 DIADLO COc1ccc(-c2ccc(C[N@H+](C)Cc3ccon3)s2)cc1 ZINC001139286197 1046426481 /nfs/dbraw/zinc/42/64/81/1046426481.db2.gz GNBQRWGQUGMQMM-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1ccc(-c2ccc(C[N@@H+](C)Cc3ccon3)s2)cc1 ZINC001139286197 1046426484 /nfs/dbraw/zinc/42/64/84/1046426484.db2.gz GNBQRWGQUGMQMM-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@H+]1CC=C(c2cc(C)cc(C)c2)CC1 ZINC001168222042 1046432198 /nfs/dbraw/zinc/43/21/98/1046432198.db2.gz CCMRPKAJRVGKSC-QGZVFWFLSA-N 1 2 315.457 4.124 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@@H+]1CC=C(c2cc(C)cc(C)c2)CC1 ZINC001168222042 1046432201 /nfs/dbraw/zinc/43/22/01/1046432201.db2.gz CCMRPKAJRVGKSC-QGZVFWFLSA-N 1 2 315.457 4.124 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2ncc(-c3ccc(C)cc3)o2)s1 ZINC000639994710 1046441256 /nfs/dbraw/zinc/44/12/56/1046441256.db2.gz MHKNMWGHKOKZIK-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2coc(-c3ccc(F)cc3)n2)s1 ZINC000639994912 1046441757 /nfs/dbraw/zinc/44/17/57/1046441757.db2.gz OVPFGDPBCFGHKU-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO Fc1c(Cl)cccc1C[NH2+]Cc1nc2c(s1)CCCC2 ZINC000719539164 1046441853 /nfs/dbraw/zinc/44/18/53/1046441853.db2.gz JIBOPVDEVLOZOO-UHFFFAOYSA-N 1 2 310.825 4.104 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@@H]1CC(C)(C)Oc2ccccc21 ZINC000925274640 1046443788 /nfs/dbraw/zinc/44/37/88/1046443788.db2.gz NOWOZILDEYWFAN-LSDHHAIUSA-N 1 2 312.413 4.252 20 0 DIADLO CCn1cc(C[N@H+](C)[C@H](C)c2cc(Cl)ccc2Cl)cn1 ZINC000676889077 1046444384 /nfs/dbraw/zinc/44/43/84/1046444384.db2.gz OFXGAOWKRAHMBK-LLVKDONJSA-N 1 2 312.244 4.403 20 0 DIADLO CCn1cc(C[N@@H+](C)[C@H](C)c2cc(Cl)ccc2Cl)cn1 ZINC000676889077 1046444391 /nfs/dbraw/zinc/44/43/91/1046444391.db2.gz OFXGAOWKRAHMBK-LLVKDONJSA-N 1 2 312.244 4.403 20 0 DIADLO Cc1c(CN(C)[C@H](C)c2ccccc2Cl)[nH+]c2ccccn12 ZINC001137275622 1046450498 /nfs/dbraw/zinc/45/04/98/1046450498.db2.gz DWRVNEXHDLWPCQ-CYBMUJFWSA-N 1 2 313.832 4.489 20 0 DIADLO Clc1ccnc(Cl)c1C[N@@H+]1CCCc2ccccc2C1 ZINC001139478957 1046454311 /nfs/dbraw/zinc/45/43/11/1046454311.db2.gz HTURWBQQDODXLJ-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO Clc1ccnc(Cl)c1C[N@H+]1CCCc2ccccc2C1 ZINC001139478957 1046454315 /nfs/dbraw/zinc/45/43/15/1046454315.db2.gz HTURWBQQDODXLJ-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO Clc1ccnc(Cl)c1C[NH+]1CCC(c2cccnc2)CC1 ZINC001139480803 1046455012 /nfs/dbraw/zinc/45/50/12/1046455012.db2.gz OJBFYIYPDVTBSJ-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc(-c3ccccc3)nc2)no1 ZINC001139520244 1046461400 /nfs/dbraw/zinc/46/14/00/1046461400.db2.gz DAZXDRKVOFERLY-FQEVSTJZSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc(-c3ccccc3)nc2)no1 ZINC001139520244 1046461401 /nfs/dbraw/zinc/46/14/01/1046461401.db2.gz DAZXDRKVOFERLY-FQEVSTJZSA-N 1 2 319.408 4.382 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(Br)c2F)CCC1(F)F ZINC001139531591 1046464973 /nfs/dbraw/zinc/46/49/73/1046464973.db2.gz IZQCRNWCOOSHCQ-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(Br)c2F)CCC1(F)F ZINC001139531591 1046464982 /nfs/dbraw/zinc/46/49/82/1046464982.db2.gz IZQCRNWCOOSHCQ-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO CC(C)[N@H+](Cc1cc(-c2cccs2)on1)Cc1cccnc1 ZINC000125690692 1046472046 /nfs/dbraw/zinc/47/20/46/1046472046.db2.gz QDRGYTHGBHYEHT-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)[N@@H+](Cc1cc(-c2cccs2)on1)Cc1cccnc1 ZINC000125690692 1046472051 /nfs/dbraw/zinc/47/20/51/1046472051.db2.gz QDRGYTHGBHYEHT-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO C[C@@H]1COCC[N@@H+]1Cc1ccccc1-c1ccccc1Cl ZINC001139572331 1046474381 /nfs/dbraw/zinc/47/43/81/1046474381.db2.gz NOJDKHQXQFZCGE-CQSZACIVSA-N 1 2 301.817 4.228 20 0 DIADLO C[C@@H]1COCC[N@H+]1Cc1ccccc1-c1ccccc1Cl ZINC001139572331 1046474392 /nfs/dbraw/zinc/47/43/92/1046474392.db2.gz NOJDKHQXQFZCGE-CQSZACIVSA-N 1 2 301.817 4.228 20 0 DIADLO Clc1ccccc1-c1ccccc1C[N@@H+]1CCOCC12CC2 ZINC001139577019 1046476780 /nfs/dbraw/zinc/47/67/80/1046476780.db2.gz LNIWEVPSYSGGDR-UHFFFAOYSA-N 1 2 313.828 4.372 20 0 DIADLO Clc1ccccc1-c1ccccc1C[N@H+]1CCOCC12CC2 ZINC001139577019 1046476787 /nfs/dbraw/zinc/47/67/87/1046476787.db2.gz LNIWEVPSYSGGDR-UHFFFAOYSA-N 1 2 313.828 4.372 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)no1 ZINC000044893451 1046478244 /nfs/dbraw/zinc/47/82/44/1046478244.db2.gz GMYFWMFIPDQPMF-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)no1 ZINC000044893451 1046478246 /nfs/dbraw/zinc/47/82/46/1046478246.db2.gz GMYFWMFIPDQPMF-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO CCOc1ccc(C)cc1C[N@H+](C)Cc1cnc(Cl)s1 ZINC001139600272 1046483091 /nfs/dbraw/zinc/48/30/91/1046483091.db2.gz MGBVDRQTRLSUKR-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CCOc1ccc(C)cc1C[N@@H+](C)Cc1cnc(Cl)s1 ZINC001139600272 1046483103 /nfs/dbraw/zinc/48/31/03/1046483103.db2.gz MGBVDRQTRLSUKR-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)Cc1ccccc1OC1CCCC1 ZINC000091812486 1046483887 /nfs/dbraw/zinc/48/38/87/1046483887.db2.gz LYINPQSTWKKMCC-UHFFFAOYSA-N 1 2 314.429 4.245 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)Cc1ccccc1OC1CCCC1 ZINC000091812486 1046483894 /nfs/dbraw/zinc/48/38/94/1046483894.db2.gz LYINPQSTWKKMCC-UHFFFAOYSA-N 1 2 314.429 4.245 20 0 DIADLO Cc1cccc(C)c1C[NH2+][C@H](c1ccn(C)n1)c1ccc(F)cc1 ZINC000781906390 1046486280 /nfs/dbraw/zinc/48/62/80/1046486280.db2.gz CBLUNHPTTCKWKX-FQEVSTJZSA-N 1 2 323.415 4.055 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1cccnc1Cl)[C@@H]2C ZINC000781928192 1046488070 /nfs/dbraw/zinc/48/80/70/1046488070.db2.gz UQGICAOKFASTST-CHWSQXEVSA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1cccnc1Cl)[C@@H]2C ZINC000781928192 1046488074 /nfs/dbraw/zinc/48/80/74/1046488074.db2.gz UQGICAOKFASTST-CHWSQXEVSA-N 1 2 316.832 4.251 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nccn1C)c1cccc(F)c1)c1cccs1 ZINC000128403477 1046492805 /nfs/dbraw/zinc/49/28/05/1046492805.db2.gz NIQGUYIWOSQKQG-WBMJQRKESA-N 1 2 315.417 4.061 20 0 DIADLO Cc1cc(SCc2cc[nH+]c(N(C)C)c2)nc2ccccc12 ZINC000782110081 1046496255 /nfs/dbraw/zinc/49/62/55/1046496255.db2.gz IZUJCEZTHHGQBX-UHFFFAOYSA-N 1 2 309.438 4.297 20 0 DIADLO Cc1cccc2nc(C3CCN(c4cc[nH+]cc4F)CC3)oc21 ZINC000641522613 1046499423 /nfs/dbraw/zinc/49/94/23/1046499423.db2.gz VYESTUIRQKGUIU-UHFFFAOYSA-N 1 2 311.360 4.054 20 0 DIADLO CSc1ccc(C[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)o1 ZINC000641758038 1046511303 /nfs/dbraw/zinc/51/13/03/1046511303.db2.gz HDUOTBLJBWAOAT-LLVKDONJSA-N 1 2 313.344 4.196 20 0 DIADLO CSc1ccc(C[NH2+]Cc2c(F)cccc2N2CCCC2)o1 ZINC000641753907 1046511670 /nfs/dbraw/zinc/51/16/70/1046511670.db2.gz GVFHYTWBEOGIHE-UHFFFAOYSA-N 1 2 320.433 4.031 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[NH+]1CC2(C1)CC(F)(F)C2 ZINC000677733652 1046516930 /nfs/dbraw/zinc/51/69/30/1046516930.db2.gz OACRRTTWOODFNL-JTQLQIEISA-N 1 2 316.189 4.241 20 0 DIADLO CC[C@@H]([NH2+]Cc1nsc2ccccc12)c1ccc(F)cn1 ZINC000641792188 1046516372 /nfs/dbraw/zinc/51/63/72/1046516372.db2.gz QAIGUKVWEGSFMN-CYBMUJFWSA-N 1 2 301.390 4.071 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[NH+]1CC2(C1)CC(F)(F)C2 ZINC000677730132 1046517083 /nfs/dbraw/zinc/51/70/83/1046517083.db2.gz CIAOCMHBIDMALN-JTQLQIEISA-N 1 2 316.189 4.241 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)CCC2CCCCC2)n1 ZINC000833690274 1046524117 /nfs/dbraw/zinc/52/41/17/1046524117.db2.gz NFDDLASGQQVZFD-UHFFFAOYSA-N 1 2 323.506 4.284 20 0 DIADLO Cc1cnc(C[NH+]2CCC(Oc3cccc(Cl)c3)CC2)s1 ZINC001139810849 1046524374 /nfs/dbraw/zinc/52/43/74/1046524374.db2.gz UXGHBKLOWNKMHH-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO CCCc1nc(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccnc2)cs1 ZINC000359873973 1046526677 /nfs/dbraw/zinc/52/66/77/1046526677.db2.gz MHKWAVUZNAYMLA-BBRMVZONSA-N 1 2 301.459 4.074 20 0 DIADLO CCCc1nc(C[N@H+]2C[C@@H](C)C[C@H]2c2cccnc2)cs1 ZINC000359873973 1046526688 /nfs/dbraw/zinc/52/66/88/1046526688.db2.gz MHKWAVUZNAYMLA-BBRMVZONSA-N 1 2 301.459 4.074 20 0 DIADLO CCCc1nc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccnc2)cs1 ZINC000359873995 1046527900 /nfs/dbraw/zinc/52/79/00/1046527900.db2.gz MHKWAVUZNAYMLA-CZUORRHYSA-N 1 2 301.459 4.074 20 0 DIADLO CCCc1nc(C[N@H+]2C[C@H](C)C[C@@H]2c2cccnc2)cs1 ZINC000359873995 1046527910 /nfs/dbraw/zinc/52/79/10/1046527910.db2.gz MHKWAVUZNAYMLA-CZUORRHYSA-N 1 2 301.459 4.074 20 0 DIADLO Cn1c2ccccc2[nH+]c1NCc1cnc(-c2ccccc2)s1 ZINC000677807106 1046528230 /nfs/dbraw/zinc/52/82/30/1046528230.db2.gz FSZZGEYTBLYCJU-UHFFFAOYSA-N 1 2 320.421 4.309 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000641959518 1046532417 /nfs/dbraw/zinc/53/24/17/1046532417.db2.gz MXDFXYXBZITVCX-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000641959518 1046532424 /nfs/dbraw/zinc/53/24/24/1046532424.db2.gz MXDFXYXBZITVCX-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO CCN(Cc1c[nH+]cn1Cc1ccccc1)c1ccc(C)cc1 ZINC000782512392 1046532540 /nfs/dbraw/zinc/53/25/40/1046532540.db2.gz NJSKKOLSLKICQE-UHFFFAOYSA-N 1 2 305.425 4.266 20 0 DIADLO Cn1c(C[N@@H+]2CCc3cc(F)c(F)cc3C2)cc2ccccc21 ZINC001139872233 1046536824 /nfs/dbraw/zinc/53/68/24/1046536824.db2.gz BRMKAEISMYEROK-UHFFFAOYSA-N 1 2 312.363 4.015 20 0 DIADLO Cn1c(C[N@H+]2CCc3cc(F)c(F)cc3C2)cc2ccccc21 ZINC001139872233 1046536832 /nfs/dbraw/zinc/53/68/32/1046536832.db2.gz BRMKAEISMYEROK-UHFFFAOYSA-N 1 2 312.363 4.015 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CC(C)(C)Oc3cc(F)ccc32)cs1 ZINC000133289064 1046539523 /nfs/dbraw/zinc/53/95/23/1046539523.db2.gz WTXCVQDIXYDSNI-AWEZNQCLSA-N 1 2 320.433 4.237 20 0 DIADLO C[NH+](C)c1ccc(N[C@@H](c2ccccc2)C2CCOCC2)cc1 ZINC000782782583 1046543642 /nfs/dbraw/zinc/54/36/42/1046543642.db2.gz WIXGODGPYYONMG-FQEVSTJZSA-N 1 2 310.441 4.332 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1C[N@@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001139888053 1046546141 /nfs/dbraw/zinc/54/61/41/1046546141.db2.gz JEJNSYHZPVKJNP-ZIAGYGMSSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1C[N@H+]1CC[C@@](C)(F)[C@H](F)C1 ZINC001139888053 1046546147 /nfs/dbraw/zinc/54/61/47/1046546147.db2.gz JEJNSYHZPVKJNP-ZIAGYGMSSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1cccc(N2CC[NH+](Cc3ccc(Cl)s3)CC2)c1 ZINC000248105559 1046548300 /nfs/dbraw/zinc/54/83/00/1046548300.db2.gz LLLCHISEKJQPDQ-UHFFFAOYSA-N 1 2 306.862 4.032 20 0 DIADLO Fc1ccc2c(c1)[nH]cc2C1=CC[N@H+](Cc2cscn2)CC1 ZINC000052823717 1046549462 /nfs/dbraw/zinc/54/94/62/1046549462.db2.gz BFJLCLALXFKMQL-UHFFFAOYSA-N 1 2 313.401 4.053 20 0 DIADLO Fc1ccc2c(c1)[nH]cc2C1=CC[N@@H+](Cc2cscn2)CC1 ZINC000052823717 1046549478 /nfs/dbraw/zinc/54/94/78/1046549478.db2.gz BFJLCLALXFKMQL-UHFFFAOYSA-N 1 2 313.401 4.053 20 0 DIADLO Clc1nc(C[N@@H+]2CCC[C@H](Cc3ccccc3)C2)cs1 ZINC001139977249 1046559983 /nfs/dbraw/zinc/55/99/83/1046559983.db2.gz ROOMVPLFWKEHJT-CQSZACIVSA-N 1 2 306.862 4.251 20 0 DIADLO Clc1nc(C[N@H+]2CCC[C@H](Cc3ccccc3)C2)cs1 ZINC001139977249 1046559999 /nfs/dbraw/zinc/55/99/99/1046559999.db2.gz ROOMVPLFWKEHJT-CQSZACIVSA-N 1 2 306.862 4.251 20 0 DIADLO C[N@H+](Cc1cccnn1)Cc1cc(F)ccc1Oc1ccccc1 ZINC001139972237 1046561296 /nfs/dbraw/zinc/56/12/96/1046561296.db2.gz NRLXBRNVFVNRCO-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[N@@H+](Cc1cccnn1)Cc1cc(F)ccc1Oc1ccccc1 ZINC001139972237 1046561311 /nfs/dbraw/zinc/56/13/11/1046561311.db2.gz NRLXBRNVFVNRCO-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Clc1ccccc1C1CC[NH+](Cc2cnc(Cl)nc2)CC1 ZINC001139992237 1046561897 /nfs/dbraw/zinc/56/18/97/1046561897.db2.gz VMWVACCRNRKYLQ-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Cc1ccc(CO[NH+]=C(N)Cc2cccc(F)c2)c(Cl)c1 ZINC000783160252 1046562901 /nfs/dbraw/zinc/56/29/01/1046562901.db2.gz QOPWHHRSTJQTKD-UHFFFAOYSA-N 1 2 306.768 4.029 20 0 DIADLO C[C@@H]1CCCCC[N@@H+]1Cc1cnc(Br)cc1Cl ZINC001140077802 1046583902 /nfs/dbraw/zinc/58/39/02/1046583902.db2.gz PQCIEDCYHGURRL-SNVBAGLBSA-N 1 2 317.658 4.262 20 0 DIADLO C[C@@H]1CCCCC[N@H+]1Cc1cnc(Br)cc1Cl ZINC001140077802 1046583917 /nfs/dbraw/zinc/58/39/17/1046583917.db2.gz PQCIEDCYHGURRL-SNVBAGLBSA-N 1 2 317.658 4.262 20 0 DIADLO Cc1coc(C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)c1 ZINC000888222879 1046568673 /nfs/dbraw/zinc/56/86/73/1046568673.db2.gz SPWUJNPEKKPEGK-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO CC(C)c1cn(C[N@@H+]2CCC=C(c3ccco3)C2)c(=S)n1C ZINC000795652243 1046572617 /nfs/dbraw/zinc/57/26/17/1046572617.db2.gz WMQCNBKYUNNYOU-UHFFFAOYSA-N 1 2 317.458 4.019 20 0 DIADLO CC(C)c1cn(C[N@H+]2CCC=C(c3ccco3)C2)c(=S)n1C ZINC000795652243 1046572631 /nfs/dbraw/zinc/57/26/31/1046572631.db2.gz WMQCNBKYUNNYOU-UHFFFAOYSA-N 1 2 317.458 4.019 20 0 DIADLO CSc1nccc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)n1 ZINC001140038073 1046573929 /nfs/dbraw/zinc/57/39/29/1046573929.db2.gz MOVQPWATXKHHJF-HNNXBMFYSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1nccc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)n1 ZINC001140038073 1046573939 /nfs/dbraw/zinc/57/39/39/1046573939.db2.gz MOVQPWATXKHHJF-HNNXBMFYSA-N 1 2 319.861 4.189 20 0 DIADLO C[N@H+](Cc1cccc(C(F)(F)F)c1)Cc1cc(O)ccc1F ZINC001140049235 1046575253 /nfs/dbraw/zinc/57/52/53/1046575253.db2.gz ZPEORJNNVWPRCF-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO C[N@@H+](Cc1cccc(C(F)(F)F)c1)Cc1cc(O)ccc1F ZINC001140049235 1046575268 /nfs/dbraw/zinc/57/52/68/1046575268.db2.gz ZPEORJNNVWPRCF-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@H+]1Cc1c[nH]c(-c2ccccc2)n1 ZINC000678197388 1046583580 /nfs/dbraw/zinc/58/35/80/1046583580.db2.gz XKMCZQWSSLRFCF-HNNXBMFYSA-N 1 2 319.408 4.032 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1c[nH]c(-c2ccccc2)n1 ZINC000678197388 1046583588 /nfs/dbraw/zinc/58/35/88/1046583588.db2.gz XKMCZQWSSLRFCF-HNNXBMFYSA-N 1 2 319.408 4.032 20 0 DIADLO C[C@@H](CC(F)(F)F)Nc1[nH+]cnc2[nH]c3cc(F)ccc3c21 ZINC000642231296 1046583844 /nfs/dbraw/zinc/58/38/44/1046583844.db2.gz GCGVORKWTQEIJP-ZETCQYMHSA-N 1 2 312.270 4.003 20 0 DIADLO CC[C@H]1CCC[N@H+](Cc2cnc(Br)cc2Cl)C1 ZINC001140079774 1046586832 /nfs/dbraw/zinc/58/68/32/1046586832.db2.gz HAYQJYCJILVOSA-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@H]1CCC[N@@H+](Cc2cnc(Br)cc2Cl)C1 ZINC001140079774 1046586846 /nfs/dbraw/zinc/58/68/46/1046586846.db2.gz HAYQJYCJILVOSA-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(C(F)(F)F)ccn2)Cc2ccccc21 ZINC001140104672 1046588818 /nfs/dbraw/zinc/58/88/18/1046588818.db2.gz XETOCFANGDGYJZ-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(C(F)(F)F)ccn2)Cc2ccccc21 ZINC001140104672 1046588822 /nfs/dbraw/zinc/58/88/22/1046588822.db2.gz XETOCFANGDGYJZ-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]([NH2+]Cc1cnn(-c2ccccc2)c1)c1c(F)cccc1F ZINC000322118891 1046590872 /nfs/dbraw/zinc/59/08/72/1046590872.db2.gz QUWUGHJBIMXJBV-ZDUSSCGKSA-N 1 2 313.351 4.001 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)cc1F ZINC000678236598 1046595995 /nfs/dbraw/zinc/59/59/95/1046595995.db2.gz PCFNGWPSEWFPDE-GOSISDBHSA-N 1 2 321.342 4.068 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)cc1F ZINC000678236598 1046596008 /nfs/dbraw/zinc/59/60/08/1046596008.db2.gz PCFNGWPSEWFPDE-GOSISDBHSA-N 1 2 321.342 4.068 20 0 DIADLO CCCn1c(C)nn(C[N@@H+]2CCCC3(CCCCC3)C2)c1=S ZINC000760279620 1046597971 /nfs/dbraw/zinc/59/79/71/1046597971.db2.gz OVFXXMVIFVOGNN-UHFFFAOYSA-N 1 2 322.522 4.136 20 0 DIADLO CCCn1c(C)nn(C[N@H+]2CCCC3(CCCCC3)C2)c1=S ZINC000760279620 1046597978 /nfs/dbraw/zinc/59/79/78/1046597978.db2.gz OVFXXMVIFVOGNN-UHFFFAOYSA-N 1 2 322.522 4.136 20 0 DIADLO Fc1cccn2cc(C[N@@H+]3CCCCC[C@H]3c3ccco3)nc12 ZINC000678266383 1046604135 /nfs/dbraw/zinc/60/41/35/1046604135.db2.gz CQKRPOFCQQQDFO-INIZCTEOSA-N 1 2 313.376 4.184 20 0 DIADLO Fc1cccn2cc(C[N@H+]3CCCCC[C@H]3c3ccco3)nc12 ZINC000678266383 1046604144 /nfs/dbraw/zinc/60/41/44/1046604144.db2.gz CQKRPOFCQQQDFO-INIZCTEOSA-N 1 2 313.376 4.184 20 0 DIADLO CN(c1ccccc1)c1ccc(C[N@H+](C)Cc2ccon2)cc1 ZINC000678274027 1046606500 /nfs/dbraw/zinc/60/65/00/1046606500.db2.gz CERPJONTDYOWHN-UHFFFAOYSA-N 1 2 307.397 4.075 20 0 DIADLO CN(c1ccccc1)c1ccc(C[N@@H+](C)Cc2ccon2)cc1 ZINC000678274027 1046606504 /nfs/dbraw/zinc/60/65/04/1046606504.db2.gz CERPJONTDYOWHN-UHFFFAOYSA-N 1 2 307.397 4.075 20 0 DIADLO CC1(C)C[N@H+](Cc2nc(-c3ccccc3)cs2)C(C)(C)CO1 ZINC000678270107 1046606517 /nfs/dbraw/zinc/60/65/17/1046606517.db2.gz UYLXBPUGRAKGOL-UHFFFAOYSA-N 1 2 316.470 4.200 20 0 DIADLO CC1(C)C[N@@H+](Cc2nc(-c3ccccc3)cs2)C(C)(C)CO1 ZINC000678270107 1046606519 /nfs/dbraw/zinc/60/65/19/1046606519.db2.gz UYLXBPUGRAKGOL-UHFFFAOYSA-N 1 2 316.470 4.200 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ncccc1C(F)(F)F ZINC000678279182 1046608868 /nfs/dbraw/zinc/60/88/68/1046608868.db2.gz KJAVUAMAPUFGJX-GFCCVEGCSA-N 1 2 306.331 4.047 20 0 DIADLO CCCc1ccc(NCc2c[nH+]cn2Cc2ccccc2)cc1 ZINC000783566854 1046608944 /nfs/dbraw/zinc/60/89/44/1046608944.db2.gz SFJDUTIUGHKBJM-UHFFFAOYSA-N 1 2 305.425 4.496 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ncccc1C(F)(F)F ZINC000678279182 1046608870 /nfs/dbraw/zinc/60/88/70/1046608870.db2.gz KJAVUAMAPUFGJX-GFCCVEGCSA-N 1 2 306.331 4.047 20 0 DIADLO Cc1ccc(-c2ccc(C[N@@H+]3CCc4c[nH]nc4C3)s2)cc1 ZINC000678276130 1046609701 /nfs/dbraw/zinc/60/97/01/1046609701.db2.gz XTABCFQRXAEFDC-UHFFFAOYSA-N 1 2 309.438 4.005 20 0 DIADLO Cc1ccc(-c2ccc(C[N@H+]3CCc4c[nH]nc4C3)s2)cc1 ZINC000678276130 1046609705 /nfs/dbraw/zinc/60/97/05/1046609705.db2.gz XTABCFQRXAEFDC-UHFFFAOYSA-N 1 2 309.438 4.005 20 0 DIADLO CC(C)c1ccccc1C[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000783575689 1046610674 /nfs/dbraw/zinc/61/06/74/1046610674.db2.gz MZROTYGEAJJCLP-CYBMUJFWSA-N 1 2 301.434 4.341 20 0 DIADLO Cc1cnc(C[N@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)s1 ZINC000245539357 1046610965 /nfs/dbraw/zinc/61/09/65/1046610965.db2.gz NUZCRNCTMOLPLP-BBRMVZONSA-N 1 2 304.484 4.130 20 0 DIADLO Cc1cnc(C[N@@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)s1 ZINC000245539357 1046610971 /nfs/dbraw/zinc/61/09/71/1046610971.db2.gz NUZCRNCTMOLPLP-BBRMVZONSA-N 1 2 304.484 4.130 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@@H+](Cc2nccc3ccccc32)C1 ZINC000678284889 1046613842 /nfs/dbraw/zinc/61/38/42/1046613842.db2.gz IUXIYWBFYDRYLC-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@H+](Cc2nccc3ccccc32)C1 ZINC000678284889 1046613846 /nfs/dbraw/zinc/61/38/46/1046613846.db2.gz IUXIYWBFYDRYLC-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)[nH]1 ZINC001137330903 1046615360 /nfs/dbraw/zinc/61/53/60/1046615360.db2.gz HAUMTXMMNZWEMB-UHFFFAOYSA-N 1 2 308.347 4.209 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)[nH]1 ZINC001137330903 1046615368 /nfs/dbraw/zinc/61/53/68/1046615368.db2.gz HAUMTXMMNZWEMB-UHFFFAOYSA-N 1 2 308.347 4.209 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nc(-c2ccccc2C)no1 ZINC000678315424 1046619401 /nfs/dbraw/zinc/61/94/01/1046619401.db2.gz QLKNXLRBCNXOAT-KRWDZBQOSA-N 1 2 322.412 4.023 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nc(-c2ccccc2C)no1 ZINC000678315424 1046619405 /nfs/dbraw/zinc/61/94/05/1046619405.db2.gz QLKNXLRBCNXOAT-KRWDZBQOSA-N 1 2 322.412 4.023 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1noc2c1CCCC2 ZINC000678316137 1046619486 /nfs/dbraw/zinc/61/94/86/1046619486.db2.gz ZVEUTQHDIPJECV-STQMWFEESA-N 1 2 314.404 4.200 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1noc2c1CCCC2 ZINC000678316137 1046619487 /nfs/dbraw/zinc/61/94/87/1046619487.db2.gz ZVEUTQHDIPJECV-STQMWFEESA-N 1 2 314.404 4.200 20 0 DIADLO CCCCc1noc(COc2cc(CC)[nH+]c3ccccc32)n1 ZINC000678356535 1046625175 /nfs/dbraw/zinc/62/51/75/1046625175.db2.gz VIAGDLDKUZMNQT-UHFFFAOYSA-N 1 2 311.385 4.102 20 0 DIADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@H]1CCCn2ccnc21 ZINC000655760900 1046628938 /nfs/dbraw/zinc/62/89/38/1046628938.db2.gz AHJNUPXWNLPXOH-LSDHHAIUSA-N 1 2 323.362 4.310 20 0 DIADLO CC(C)(C)c1noc(C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)n1 ZINC000533028410 1046639941 /nfs/dbraw/zinc/63/99/41/1046639941.db2.gz FNEHINHBNDUEMP-MRXNPFEDSA-N 1 2 311.429 4.019 20 0 DIADLO CC(C)(C)c1noc(C[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)n1 ZINC000533028410 1046639948 /nfs/dbraw/zinc/63/99/48/1046639948.db2.gz FNEHINHBNDUEMP-MRXNPFEDSA-N 1 2 311.429 4.019 20 0 DIADLO F[C@H]1CCC[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC001140296659 1046642744 /nfs/dbraw/zinc/64/27/44/1046642744.db2.gz ZGWFLDBNKFESBJ-ZDUSSCGKSA-N 1 2 310.825 4.397 20 0 DIADLO F[C@H]1CCC[N@@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC001140296659 1046642748 /nfs/dbraw/zinc/64/27/48/1046642748.db2.gz ZGWFLDBNKFESBJ-ZDUSSCGKSA-N 1 2 310.825 4.397 20 0 DIADLO F[C@@H]1CCC[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC001140298665 1046645095 /nfs/dbraw/zinc/64/50/95/1046645095.db2.gz ZGWFLDBNKFESBJ-CYBMUJFWSA-N 1 2 310.825 4.397 20 0 DIADLO F[C@@H]1CCC[N@@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC001140298665 1046645104 /nfs/dbraw/zinc/64/51/04/1046645104.db2.gz ZGWFLDBNKFESBJ-CYBMUJFWSA-N 1 2 310.825 4.397 20 0 DIADLO O=C(CCCC1CC1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000643184393 1046646437 /nfs/dbraw/zinc/64/64/37/1046646437.db2.gz OUMLXEXMGWDMBD-UHFFFAOYSA-N 1 2 303.793 4.045 20 0 DIADLO Cc1cc(CNC(=O)N[C@H](CC2CC2)c2ccccc2)cc(C)[nH+]1 ZINC000643242008 1046651071 /nfs/dbraw/zinc/65/10/71/1046651071.db2.gz LLQIIDXRCAFZEM-LJQANCHMSA-N 1 2 323.440 4.039 20 0 DIADLO O=C(CCCC1CC1)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000643256394 1046652938 /nfs/dbraw/zinc/65/29/38/1046652938.db2.gz QVPPQLVGZKFGAL-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO CCSc1nn(C[N@@H+]2CC[C@@H](C(C)(C)C)C2)c(=S)s1 ZINC000784036872 1046654231 /nfs/dbraw/zinc/65/42/31/1046654231.db2.gz VACMCEXTFFTOOA-SNVBAGLBSA-N 1 2 317.549 4.112 20 0 DIADLO CCSc1nn(C[N@H+]2CC[C@@H](C(C)(C)C)C2)c(=S)s1 ZINC000784036872 1046654236 /nfs/dbraw/zinc/65/42/36/1046654236.db2.gz VACMCEXTFFTOOA-SNVBAGLBSA-N 1 2 317.549 4.112 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccncc1Cl ZINC000643347058 1046660796 /nfs/dbraw/zinc/66/07/96/1046660796.db2.gz SXXXPTJEVTWZQW-OTYXRUKQSA-N 1 2 309.196 4.173 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1ncc(-c2ccccc2)n1C ZINC000834741065 1046660761 /nfs/dbraw/zinc/66/07/61/1046660761.db2.gz JBQGJLNTQPYMQW-HNNXBMFYSA-N 1 2 320.440 4.326 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1cccc(-c3nccs3)c1)C2 ZINC001140337298 1046663762 /nfs/dbraw/zinc/66/37/62/1046663762.db2.gz JTEUXNVKZGLGLQ-UHFFFAOYSA-N 1 2 310.397 4.465 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1cccc(-c3nccs3)c1)C2 ZINC001140337298 1046663769 /nfs/dbraw/zinc/66/37/69/1046663769.db2.gz JTEUXNVKZGLGLQ-UHFFFAOYSA-N 1 2 310.397 4.465 20 0 DIADLO O=C(Nc1cccc(C2CCC2)c1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000643511094 1046669756 /nfs/dbraw/zinc/66/97/56/1046669756.db2.gz GTJCQVBSLPKZHB-SFHVURJKSA-N 1 2 324.428 4.020 20 0 DIADLO Clc1cc2c(c(Cl)c1)[C@@H]([NH2+][C@H]1CCCc3cn[nH]c31)CC2 ZINC000678598343 1046672310 /nfs/dbraw/zinc/67/23/10/1046672310.db2.gz FWADYMRRZPQFPH-KBPBESRZSA-N 1 2 322.239 4.371 20 0 DIADLO Clc1cc2c(c(Cl)c1)[C@@H]([NH2+][C@H]1CCCc3c[nH]nc31)CC2 ZINC000678598343 1046672317 /nfs/dbraw/zinc/67/23/17/1046672317.db2.gz FWADYMRRZPQFPH-KBPBESRZSA-N 1 2 322.239 4.371 20 0 DIADLO CCCCCn1cc(C[NH2+][C@H](C)c2nc(C)sc2C)c(C)n1 ZINC000678610171 1046678540 /nfs/dbraw/zinc/67/85/40/1046678540.db2.gz HMQXCOAIRCJZHB-CYBMUJFWSA-N 1 2 320.506 4.306 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1cccc(F)c1F ZINC000678609984 1046678565 /nfs/dbraw/zinc/67/85/65/1046678565.db2.gz BMPYMWHJBOEZKX-YMTOWFKASA-N 1 2 309.743 4.403 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1ccc(F)nc1C ZINC000784298787 1046679777 /nfs/dbraw/zinc/67/97/77/1046679777.db2.gz SZUCCJNANQSOBF-UHFFFAOYSA-N 1 2 318.783 4.164 20 0 DIADLO Cc1nc(-c2ccc(NCc3c[nH+]cn3C(C)C)cc2)oc1C ZINC000643767646 1046680632 /nfs/dbraw/zinc/68/06/32/1046680632.db2.gz FWCKYEBDPVIQRO-UHFFFAOYSA-N 1 2 310.401 4.348 20 0 DIADLO FC1(F)CCC[C@@H]1[NH2+][C@@H](Cc1ccncc1)c1cccs1 ZINC000643894511 1046689251 /nfs/dbraw/zinc/68/92/51/1046689251.db2.gz XJVPCMHOGSRNNZ-ZFWWWQNUSA-N 1 2 308.397 4.204 20 0 DIADLO CC(C)c1ccc(/C=C\CC(=O)OCCCn2cc[nH+]c2)cc1 ZINC000784447584 1046690272 /nfs/dbraw/zinc/69/02/72/1046690272.db2.gz LXUFZZZBNIDUPW-HYXAFXHYSA-N 1 2 312.413 4.043 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CCCOc3c(C)cc(Cl)cc32)co1 ZINC000834896912 1046710454 /nfs/dbraw/zinc/71/04/54/1046710454.db2.gz DKOADKOPYFACAQ-OAHLLOKOSA-N 1 2 320.820 4.202 20 0 DIADLO CCc1nc(C[NH2+][C@H](CC)c2ccccc2OC(F)F)co1 ZINC000834902065 1046713307 /nfs/dbraw/zinc/71/33/07/1046713307.db2.gz ZQZUCIXKPYCXDA-CYBMUJFWSA-N 1 2 310.344 4.079 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc3cc(Cl)ccc3n2C)s1 ZINC000533411763 1046717332 /nfs/dbraw/zinc/71/73/32/1046717332.db2.gz BUQVMSYHCAQRPV-UHFFFAOYSA-N 1 2 319.861 4.229 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc3cc(Cl)ccc3n2C)s1 ZINC000533411763 1046717343 /nfs/dbraw/zinc/71/73/43/1046717343.db2.gz BUQVMSYHCAQRPV-UHFFFAOYSA-N 1 2 319.861 4.229 20 0 DIADLO C[C@@H](C[NH2+][C@H](c1ncn[nH]1)C1CCCCC1)C1CCCCC1 ZINC000644536060 1046719875 /nfs/dbraw/zinc/71/98/75/1046719875.db2.gz DWMNPWWELCLSAA-YOEHRIQHSA-N 1 2 304.482 4.232 20 0 DIADLO O=C1CC[N@@H+](Cc2c[nH]c3cccc(Cl)c23)[C@@H]2CCCC[C@H]12 ZINC001140433203 1046722761 /nfs/dbraw/zinc/72/27/61/1046722761.db2.gz SIEPFCZVUDXGRZ-XJKSGUPXSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c[nH]c3cccc(Cl)c23)[C@@H]2CCCC[C@H]12 ZINC001140433203 1046722772 /nfs/dbraw/zinc/72/27/72/1046722772.db2.gz SIEPFCZVUDXGRZ-XJKSGUPXSA-N 1 2 316.832 4.155 20 0 DIADLO CCc1cnc(C[N@H+]2CC=C(c3c[nH]c4cc(C)ccc43)CC2)o1 ZINC000533488307 1046737326 /nfs/dbraw/zinc/73/73/26/1046737326.db2.gz ZCHBWAOCRUPHAT-UHFFFAOYSA-N 1 2 321.424 4.316 20 0 DIADLO CCc1cnc(C[N@@H+]2CC=C(c3c[nH]c4cc(C)ccc43)CC2)o1 ZINC000533488307 1046737339 /nfs/dbraw/zinc/73/73/39/1046737339.db2.gz ZCHBWAOCRUPHAT-UHFFFAOYSA-N 1 2 321.424 4.316 20 0 DIADLO CCOC1CC[NH+](Cc2c(Cl)ccc(F)c2Cl)CC1 ZINC001137356774 1046742952 /nfs/dbraw/zinc/74/29/52/1046742952.db2.gz SKUASNYESJHHRO-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO FC1CC[NH+](Cc2ccc(Cl)cc2Br)CC1 ZINC001140482627 1046745221 /nfs/dbraw/zinc/74/52/21/1046745221.db2.gz QZSQTARLMULIDU-UHFFFAOYSA-N 1 2 306.606 4.036 20 0 DIADLO CC(C)n1ccn(C[N@H+](Cc2ccc(F)cc2)C2CC2)c1=S ZINC000835071021 1046753170 /nfs/dbraw/zinc/75/31/70/1046753170.db2.gz UMSAXHMSUHXCPD-UHFFFAOYSA-N 1 2 319.449 4.361 20 0 DIADLO CC(C)n1ccn(C[N@@H+](Cc2ccc(F)cc2)C2CC2)c1=S ZINC000835071021 1046753187 /nfs/dbraw/zinc/75/31/87/1046753187.db2.gz UMSAXHMSUHXCPD-UHFFFAOYSA-N 1 2 319.449 4.361 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2c(Cl)ccc(F)c2Cl)[C@H](C)C1 ZINC001137358769 1046754160 /nfs/dbraw/zinc/75/41/60/1046754160.db2.gz CULIOBYDGJZLJT-NXEZZACHSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2c(Cl)ccc(F)c2Cl)[C@H](C)C1 ZINC001137358769 1046754172 /nfs/dbraw/zinc/75/41/72/1046754172.db2.gz CULIOBYDGJZLJT-NXEZZACHSA-N 1 2 306.208 4.132 20 0 DIADLO COc1ncc(C[N@@H+]2CC[C@H](C)C[C@H]2c2ccco2)cc1Cl ZINC000533558637 1046754344 /nfs/dbraw/zinc/75/43/44/1046754344.db2.gz XPHKMLSVVWTIMU-WFASDCNBSA-N 1 2 320.820 4.310 20 0 DIADLO COc1ncc(C[N@H+]2CC[C@H](C)C[C@H]2c2ccco2)cc1Cl ZINC000533558637 1046754356 /nfs/dbraw/zinc/75/43/56/1046754356.db2.gz XPHKMLSVVWTIMU-WFASDCNBSA-N 1 2 320.820 4.310 20 0 DIADLO CCc1nc(C[N@H+](C)[C@H]2CCCc3ccc(F)cc32)cs1 ZINC000533573847 1046754972 /nfs/dbraw/zinc/75/49/72/1046754972.db2.gz NZAMXZOVOGJKHZ-INIZCTEOSA-N 1 2 304.434 4.354 20 0 DIADLO CCc1nc(C[N@@H+](C)[C@H]2CCCc3ccc(F)cc32)cs1 ZINC000533573847 1046754987 /nfs/dbraw/zinc/75/49/87/1046754987.db2.gz NZAMXZOVOGJKHZ-INIZCTEOSA-N 1 2 304.434 4.354 20 0 DIADLO C[C@@H]([NH2+]Cc1cocn1)c1ccc2ccccc2c1OC(F)F ZINC000679048491 1046764705 /nfs/dbraw/zinc/76/47/05/1046764705.db2.gz HRHQDEOPPOZIME-LLVKDONJSA-N 1 2 318.323 4.280 20 0 DIADLO COc1cc2ccccc2cc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000645092377 1046765473 /nfs/dbraw/zinc/76/54/73/1046765473.db2.gz PJGVCHPLGXANOI-UHFFFAOYSA-N 1 2 320.392 4.421 20 0 DIADLO CC[C@@H](Cc1ccccc1)NC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455485354 1046772615 /nfs/dbraw/zinc/77/26/15/1046772615.db2.gz RFUKQLOIDOCXCR-KRWDZBQOSA-N 1 2 311.429 4.150 20 0 DIADLO Cc1cccc([C@@H](C)CNC(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000455480064 1046773567 /nfs/dbraw/zinc/77/35/67/1046773567.db2.gz HCLLUPQLZHWVGL-AWEZNQCLSA-N 1 2 311.429 4.240 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC[C@H](C)c2ccccc2)c(C)[nH+]1 ZINC000455489095 1046774746 /nfs/dbraw/zinc/77/47/46/1046774746.db2.gz VJHCIFINVNERMO-ZDUSSCGKSA-N 1 2 311.429 4.322 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C)Cc2ccccc2C)c(C)[nH+]1 ZINC000455491194 1046776076 /nfs/dbraw/zinc/77/60/76/1046776076.db2.gz YAYBVUZXIZSXLS-HNNXBMFYSA-N 1 2 311.429 4.068 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2cccc(O)c2Br)c1 ZINC001140547464 1046777247 /nfs/dbraw/zinc/77/72/47/1046777247.db2.gz HDXGYLSQWJZBAU-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2cccc(O)c2Br)c1 ZINC001140547464 1046777260 /nfs/dbraw/zinc/77/72/60/1046777260.db2.gz HDXGYLSQWJZBAU-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1CCO[C@@H](c2cccs2)C1 ZINC000645189764 1046777476 /nfs/dbraw/zinc/77/74/76/1046777476.db2.gz GXOCIQMAIDJSOV-MRXNPFEDSA-N 1 2 310.422 4.183 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC[C@@H](C[C@@H]3CCOC3)C2)c1 ZINC000645205264 1046777740 /nfs/dbraw/zinc/77/77/40/1046777740.db2.gz DHOVBVNKVDJGTQ-GJZGRUSLSA-N 1 2 314.404 4.017 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C)CCCC(F)(F)F)c(C)[nH+]1 ZINC000455514374 1046779392 /nfs/dbraw/zinc/77/93/92/1046779392.db2.gz JLLQMGQTHWLYBK-JTQLQIEISA-N 1 2 317.355 4.249 20 0 DIADLO Cc1cc(C)cc(CN(C)C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000455508520 1046779624 /nfs/dbraw/zinc/77/96/24/1046779624.db2.gz GCEXDVOKECAWRE-UHFFFAOYSA-N 1 2 311.429 4.288 20 0 DIADLO CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455507197 1046780341 /nfs/dbraw/zinc/78/03/41/1046780341.db2.gz YRFSUMHIMZVNQQ-MLGOLLRUSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC3(CC3)c3ccccc32)c(C)[nH+]1 ZINC000455540680 1046784282 /nfs/dbraw/zinc/78/42/82/1046784282.db2.gz YSTBYNKOPROIAK-UHFFFAOYSA-N 1 2 307.397 4.091 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(C(C)C)n1 ZINC001625982074 1046786550 /nfs/dbraw/zinc/78/65/50/1046786550.db2.gz YDEQPVSHSFWNRK-UHFFFAOYSA-N 1 2 320.396 4.156 20 0 DIADLO CC(=O)[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2C(F)(F)F)C1 ZINC001140568525 1046788296 /nfs/dbraw/zinc/78/82/96/1046788296.db2.gz JDJOGQRFVIPWHH-LLVKDONJSA-N 1 2 319.754 4.160 20 0 DIADLO CC(=O)[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2C(F)(F)F)C1 ZINC001140568525 1046788305 /nfs/dbraw/zinc/78/83/05/1046788305.db2.gz JDJOGQRFVIPWHH-LLVKDONJSA-N 1 2 319.754 4.160 20 0 DIADLO COc1ccc(-c2nc(C[N@H+](C)[C@H](C)c3ccco3)co2)cc1 ZINC000069067266 1046791218 /nfs/dbraw/zinc/79/12/18/1046791218.db2.gz YMBBTCHLYFQERM-CYBMUJFWSA-N 1 2 312.369 4.136 20 0 DIADLO COc1ccc(-c2nc(C[N@@H+](C)[C@H](C)c3ccco3)co2)cc1 ZINC000069067266 1046791228 /nfs/dbraw/zinc/79/12/28/1046791228.db2.gz YMBBTCHLYFQERM-CYBMUJFWSA-N 1 2 312.369 4.136 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)[C@H](C)c1ccco1 ZINC000069067083 1046791896 /nfs/dbraw/zinc/79/18/96/1046791896.db2.gz HKAVPINMSHUCOS-LLVKDONJSA-N 1 2 302.399 4.498 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)[C@H](C)c1ccco1 ZINC000069067083 1046791909 /nfs/dbraw/zinc/79/19/09/1046791909.db2.gz HKAVPINMSHUCOS-LLVKDONJSA-N 1 2 302.399 4.498 20 0 DIADLO Clc1ccccc1C[N@@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000072031780 1046796155 /nfs/dbraw/zinc/79/61/55/1046796155.db2.gz YPSMGYHLXGCQAY-MRXNPFEDSA-N 1 2 305.805 4.114 20 0 DIADLO Clc1ccccc1C[N@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000072031780 1046796171 /nfs/dbraw/zinc/79/61/71/1046796171.db2.gz YPSMGYHLXGCQAY-MRXNPFEDSA-N 1 2 305.805 4.114 20 0 DIADLO Cc1cccc([C@H]2CCCN2C(=O)NCc2c[nH+]c(C)cc2C)c1 ZINC000455567446 1046801278 /nfs/dbraw/zinc/80/12/78/1046801278.db2.gz ZANWQWSPGAMBGL-LJQANCHMSA-N 1 2 323.440 4.054 20 0 DIADLO Cc1cnccc1C[N@H+]1C[C@@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000648535262 1046817401 /nfs/dbraw/zinc/81/74/01/1046817401.db2.gz YRMYOEFZQNHZGQ-KSSFIOAISA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cnccc1C[N@@H+]1C[C@@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000648535262 1046817423 /nfs/dbraw/zinc/81/74/23/1046817423.db2.gz YRMYOEFZQNHZGQ-KSSFIOAISA-N 1 2 316.832 4.005 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nnc(-c3ccccc3)o2)[C@@H](c2ccco2)C1 ZINC000247707358 1046832087 /nfs/dbraw/zinc/83/20/87/1046832087.db2.gz ZGJBBDCYLIUSMV-GDBMZVCRSA-N 1 2 323.396 4.303 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccccc3)o2)[C@@H](c2ccco2)C1 ZINC000247707358 1046832105 /nfs/dbraw/zinc/83/21/05/1046832105.db2.gz ZGJBBDCYLIUSMV-GDBMZVCRSA-N 1 2 323.396 4.303 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+][C@@H](CCc1ccccc1)C(F)F ZINC000679387834 1046833383 /nfs/dbraw/zinc/83/33/83/1046833383.db2.gz FVAMBYFTBAAEQZ-PBHICJAKSA-N 1 2 304.384 4.307 20 0 DIADLO c1cn(-c2ccc(CN3CCCSc4ccccc43)cc2)c[nH+]1 ZINC000679386060 1046834001 /nfs/dbraw/zinc/83/40/01/1046834001.db2.gz JOXQTVAKBVBEKN-UHFFFAOYSA-N 1 2 321.449 4.375 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+]2CCC[C@H]2c2ccccc2)n1 ZINC000248005334 1046836656 /nfs/dbraw/zinc/83/66/56/1046836656.db2.gz KTLRLVJEQRYDRW-HIFRSBDPSA-N 1 2 317.458 4.221 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+]2CCC[C@H]2c2ccccc2)n1 ZINC000248005334 1046836672 /nfs/dbraw/zinc/83/66/72/1046836672.db2.gz KTLRLVJEQRYDRW-HIFRSBDPSA-N 1 2 317.458 4.221 20 0 DIADLO CCCc1nc(C)c(C[NH2+]C2(c3ccccc3Cl)CC2)o1 ZINC000645978301 1046837139 /nfs/dbraw/zinc/83/71/39/1046837139.db2.gz BVJLZXACDXPIOZ-UHFFFAOYSA-N 1 2 304.821 4.368 20 0 DIADLO C[N@@H+](Cc1csc2ccccc12)Cc1nccn1C(F)F ZINC000076199940 1046850738 /nfs/dbraw/zinc/85/07/38/1046850738.db2.gz SZYCWDNLUUGSKE-UHFFFAOYSA-N 1 2 307.369 4.125 20 0 DIADLO C[N@H+](Cc1csc2ccccc12)Cc1nccn1C(F)F ZINC000076199940 1046850756 /nfs/dbraw/zinc/85/07/56/1046850756.db2.gz SZYCWDNLUUGSKE-UHFFFAOYSA-N 1 2 307.369 4.125 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1cccc(O)c1Cl ZINC000646064432 1046851178 /nfs/dbraw/zinc/85/11/78/1046851178.db2.gz HMZWHSIWSLYTSP-GFCCVEGCSA-N 1 2 303.789 4.001 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1cccc(O)c1Cl ZINC000646064432 1046851193 /nfs/dbraw/zinc/85/11/93/1046851193.db2.gz HMZWHSIWSLYTSP-GFCCVEGCSA-N 1 2 303.789 4.001 20 0 DIADLO Clc1cccc(C2([NH2+]Cc3ncc(C4CC4)o3)CCC2)c1 ZINC000646095201 1046857345 /nfs/dbraw/zinc/85/73/45/1046857345.db2.gz JFHBDRXXVTUNHI-UHFFFAOYSA-N 1 2 302.805 4.374 20 0 DIADLO FC(F)Oc1cccc(Nc2ccccc2-n2cc[nH+]c2)c1 ZINC001212060644 1046858237 /nfs/dbraw/zinc/85/82/37/1046858237.db2.gz BWIQBRXXKBGMNL-UHFFFAOYSA-N 1 2 301.296 4.217 20 0 DIADLO Clc1cccc(C2([NH2+]Cc3nnc(C4CC4)s3)CCC2)c1 ZINC000646095254 1046858540 /nfs/dbraw/zinc/85/85/40/1046858540.db2.gz LIJQYCSVNWDESV-UHFFFAOYSA-N 1 2 319.861 4.238 20 0 DIADLO CC(C)c1nc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)cs1 ZINC000679542692 1046860778 /nfs/dbraw/zinc/86/07/78/1046860778.db2.gz BAXAUYXRBDCHAL-WDEREUQCSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)cs1 ZINC000679542692 1046860797 /nfs/dbraw/zinc/86/07/97/1046860797.db2.gz BAXAUYXRBDCHAL-WDEREUQCSA-N 1 2 306.397 4.429 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)n1 ZINC000646117413 1046861627 /nfs/dbraw/zinc/86/16/27/1046861627.db2.gz ZDPSRRGYWTVJMJ-RHSMWYFYSA-N 1 2 309.413 4.086 20 0 DIADLO CCc1noc([C@@H](C)[N@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)n1 ZINC000646117413 1046861640 /nfs/dbraw/zinc/86/16/40/1046861640.db2.gz ZDPSRRGYWTVJMJ-RHSMWYFYSA-N 1 2 309.413 4.086 20 0 DIADLO CC(C)c1nc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)cs1 ZINC000679542690 1046862012 /nfs/dbraw/zinc/86/20/12/1046862012.db2.gz BAXAUYXRBDCHAL-MNOVXSKESA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)cs1 ZINC000679542690 1046862031 /nfs/dbraw/zinc/86/20/31/1046862031.db2.gz BAXAUYXRBDCHAL-MNOVXSKESA-N 1 2 306.397 4.429 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1csc(C2CC2)n1 ZINC000679540840 1046864538 /nfs/dbraw/zinc/86/45/38/1046864538.db2.gz HFCKKRDWYVMPNC-KOLCDFICSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1csc(C2CC2)n1 ZINC000679540840 1046864565 /nfs/dbraw/zinc/86/45/65/1046864565.db2.gz HFCKKRDWYVMPNC-KOLCDFICSA-N 1 2 304.381 4.183 20 0 DIADLO Fc1cc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c(F)cc1Cl ZINC001140701761 1046865812 /nfs/dbraw/zinc/86/58/12/1046865812.db2.gz ZCYBOOUTLKYWCS-AWEZNQCLSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1cc(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c(F)cc1Cl ZINC001140701761 1046865826 /nfs/dbraw/zinc/86/58/26/1046865826.db2.gz ZCYBOOUTLKYWCS-AWEZNQCLSA-N 1 2 323.770 4.272 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000679548513 1046866011 /nfs/dbraw/zinc/86/60/11/1046866011.db2.gz VDBZAJKXWWJIGG-KGLIPLIRSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000679548513 1046866030 /nfs/dbraw/zinc/86/60/30/1046866030.db2.gz VDBZAJKXWWJIGG-KGLIPLIRSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cccc(O)c1Cl ZINC000646156442 1046868026 /nfs/dbraw/zinc/86/80/26/1046868026.db2.gz UQLYVOSSLURSIU-MWLCHTKSSA-N 1 2 307.743 4.208 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cccc(O)c1Cl ZINC000646156442 1046868042 /nfs/dbraw/zinc/86/80/42/1046868042.db2.gz UQLYVOSSLURSIU-MWLCHTKSSA-N 1 2 307.743 4.208 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1F)c1nc(-c2ccncc2)cs1 ZINC000076895751 1046870973 /nfs/dbraw/zinc/87/09/73/1046870973.db2.gz LDLUBZGOXXJHQY-GFCCVEGCSA-N 1 2 313.401 4.195 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cc(Cl)ccc2F)cc(Cl)n1 ZINC000797605395 1046873428 /nfs/dbraw/zinc/87/34/28/1046873428.db2.gz PMOGGENZVOXWEL-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cc(Cl)ccc2F)cc(Cl)n1 ZINC000797605395 1046873451 /nfs/dbraw/zinc/87/34/51/1046873451.db2.gz PMOGGENZVOXWEL-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1c(Cl)ncc2ccccc21 ZINC001140724847 1046874955 /nfs/dbraw/zinc/87/49/55/1046874955.db2.gz RCVOUECTJIZLMG-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1c(Cl)ncc2ccccc21 ZINC001140724847 1046874965 /nfs/dbraw/zinc/87/49/65/1046874965.db2.gz RCVOUECTJIZLMG-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1cc(C)ccc1Br ZINC001137380850 1046884438 /nfs/dbraw/zinc/88/44/38/1046884438.db2.gz YJUDVDMUJSZKOM-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1cc(C)ccc1Br ZINC001137380850 1046884443 /nfs/dbraw/zinc/88/44/43/1046884443.db2.gz YJUDVDMUJSZKOM-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO Cc1cc(F)ccc1C[NH+](Cc1cccnc1)Cc1cccnc1 ZINC001140779789 1046893215 /nfs/dbraw/zinc/89/32/15/1046893215.db2.gz ARTPQARGNCPBQX-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO FC(F)O[C@@H]1CCC[N@H+](Cc2nc(-c3ccccc3)cs2)C1 ZINC000679740416 1046897241 /nfs/dbraw/zinc/89/72/41/1046897241.db2.gz NEANKIYOBNFCCQ-CYBMUJFWSA-N 1 2 324.396 4.014 20 0 DIADLO FC(F)O[C@@H]1CCC[N@@H+](Cc2nc(-c3ccccc3)cs2)C1 ZINC000679740416 1046897261 /nfs/dbraw/zinc/89/72/61/1046897261.db2.gz NEANKIYOBNFCCQ-CYBMUJFWSA-N 1 2 324.396 4.014 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+](C)CC(=O)OCc1ccccc1 ZINC000303290906 1046907197 /nfs/dbraw/zinc/90/71/97/1046907197.db2.gz AUNWLQFTLFRLKW-AWEZNQCLSA-N 1 2 317.816 4.076 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)CC(=O)OCc1ccccc1 ZINC000303290906 1046907208 /nfs/dbraw/zinc/90/72/08/1046907208.db2.gz AUNWLQFTLFRLKW-AWEZNQCLSA-N 1 2 317.816 4.076 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1c[nH]c2ccncc12 ZINC001140806126 1046908089 /nfs/dbraw/zinc/90/80/89/1046908089.db2.gz VZCRBTWWBGZJAM-IBGZPJMESA-N 1 2 321.424 4.046 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1c[nH]c2ccncc12 ZINC001140806126 1046908098 /nfs/dbraw/zinc/90/80/98/1046908098.db2.gz VZCRBTWWBGZJAM-IBGZPJMESA-N 1 2 321.424 4.046 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H]3CC[C@H]4CCCC[C@@H]4C3)cc2[nH+]1 ZINC001137392755 1046911228 /nfs/dbraw/zinc/91/12/28/1046911228.db2.gz IRPNEXMZIZNKQJ-RBSFLKMASA-N 1 2 311.429 4.416 20 0 DIADLO c1cc(CCC[N@@H+]2CCCC[C@H]2c2noc(C3CC3)n2)cs1 ZINC000679924680 1046914236 /nfs/dbraw/zinc/91/42/36/1046914236.db2.gz UQTLASKXLFALDZ-HNNXBMFYSA-N 1 2 317.458 4.168 20 0 DIADLO c1cc(CCC[N@H+]2CCCC[C@H]2c2noc(C3CC3)n2)cs1 ZINC000679924680 1046914247 /nfs/dbraw/zinc/91/42/47/1046914247.db2.gz UQTLASKXLFALDZ-HNNXBMFYSA-N 1 2 317.458 4.168 20 0 DIADLO Cc1c2ccccc2oc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000161769968 1046914490 /nfs/dbraw/zinc/91/44/90/1046914490.db2.gz YMOVQLDGNXIGOY-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO COC(C)(C)[C@@H]1CCC[N@@H+]1Cc1cc(Cl)c(O)c(Cl)c1 ZINC001140834630 1046923992 /nfs/dbraw/zinc/92/39/92/1046923992.db2.gz SGHFIGFGXJWMBA-ZDUSSCGKSA-N 1 2 318.244 4.088 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+]Cc1ncc(-c2ccccc2F)o1 ZINC000679942770 1046916079 /nfs/dbraw/zinc/91/60/79/1046916079.db2.gz OYTOQLDCKQRUQC-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO COC(C)(C)[C@@H]1CCC[N@H+]1Cc1cc(Cl)c(O)c(Cl)c1 ZINC001140834630 1046923999 /nfs/dbraw/zinc/92/39/99/1046923999.db2.gz SGHFIGFGXJWMBA-ZDUSSCGKSA-N 1 2 318.244 4.088 20 0 DIADLO CC[C@@H](C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000161817384 1046916913 /nfs/dbraw/zinc/91/69/13/1046916913.db2.gz SXMQIJOJYPNYPA-QGZVFWFLSA-N 1 2 305.381 4.209 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+]Cc1ncc(-c2cccc(F)c2)o1 ZINC000679943567 1046917231 /nfs/dbraw/zinc/91/72/31/1046917231.db2.gz DLXUKQDWPPHBGL-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c(F)c1 ZINC001140826184 1046919510 /nfs/dbraw/zinc/91/95/10/1046919510.db2.gz DPNBXKXXAQFVMU-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c(F)c1 ZINC001140826184 1046919523 /nfs/dbraw/zinc/91/95/23/1046919523.db2.gz DPNBXKXXAQFVMU-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@@H](Cc1ccsc1)[N@@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000679983984 1046919581 /nfs/dbraw/zinc/91/95/81/1046919581.db2.gz HPVWOUGBFOCOSE-SWLSCSKDSA-N 1 2 317.458 4.167 20 0 DIADLO C[C@@H](Cc1ccsc1)[N@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000679983984 1046919607 /nfs/dbraw/zinc/91/96/07/1046919607.db2.gz HPVWOUGBFOCOSE-SWLSCSKDSA-N 1 2 317.458 4.167 20 0 DIADLO C[C@H](c1nc2ccccc2c(=O)[nH]1)[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000253547946 1046922259 /nfs/dbraw/zinc/92/22/59/1046922259.db2.gz AGZWRJFLSNJOJX-LBTNJELSSA-N 1 2 319.408 4.089 20 0 DIADLO C[C@H](c1nc2ccccc2c(=O)[nH]1)[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000253547946 1046922271 /nfs/dbraw/zinc/92/22/71/1046922271.db2.gz AGZWRJFLSNJOJX-LBTNJELSSA-N 1 2 319.408 4.089 20 0 DIADLO O=C(C/C=C\c1ccc(F)cc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000255863678 1046926175 /nfs/dbraw/zinc/92/61/75/1046926175.db2.gz MHPWGYSSZCFWDJ-IWQZZHSRSA-N 1 2 321.355 4.053 20 0 DIADLO FCC[NH2+]Cc1sc(Sc2ccccc2)nc1Cl ZINC000798087275 1046927357 /nfs/dbraw/zinc/92/73/57/1046927357.db2.gz URRYQOUPTDNAQD-UHFFFAOYSA-N 1 2 302.827 4.007 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1CCCCC[C@H]1/C=C/c1cccs1 ZINC000680003019 1046927278 /nfs/dbraw/zinc/92/72/78/1046927278.db2.gz KRSQLMXWSQQNSC-FDMDGMSGSA-N 1 2 301.459 4.238 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc(C)cc2Cl)o1 ZINC000078621949 1046933715 /nfs/dbraw/zinc/93/37/15/1046933715.db2.gz KSTKSHPLDQQZLN-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc(C)cc2Cl)o1 ZINC000078621949 1046933729 /nfs/dbraw/zinc/93/37/29/1046933729.db2.gz KSTKSHPLDQQZLN-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1ccc(Cl)cc1 ZINC000680042107 1046936904 /nfs/dbraw/zinc/93/69/04/1046936904.db2.gz YLCWXOUDFOZDJZ-LKFCYVNXSA-N 1 2 309.743 4.403 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1ccc(Cl)s1 ZINC000680041677 1046937800 /nfs/dbraw/zinc/93/78/00/1046937800.db2.gz MEQWUUCWWSNYKN-OIBJUYFYSA-N 1 2 315.772 4.464 20 0 DIADLO C[N@H+](Cc1ccc2ccccc2c1)Cc1ccc(O)c(F)c1F ZINC001140892635 1046942948 /nfs/dbraw/zinc/94/29/48/1046942948.db2.gz VBNLOAZKYVOMEN-UHFFFAOYSA-N 1 2 313.347 4.456 20 0 DIADLO CC[N@H+](Cc1ccc(C)c(C)c1)Cc1ccc(O)c(F)c1F ZINC001140892414 1046943796 /nfs/dbraw/zinc/94/37/96/1046943796.db2.gz MEWRCFWZWNAKPR-UHFFFAOYSA-N 1 2 305.368 4.309 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc(O)c(F)c1F ZINC001140894449 1046946221 /nfs/dbraw/zinc/94/62/21/1046946221.db2.gz YTTMNWOREMABOM-CQSZACIVSA-N 1 2 319.351 4.016 20 0 DIADLO CCCn1cc(C[N@H+](Cc2ccco2)Cc2ccccc2)cn1 ZINC000162209332 1046949196 /nfs/dbraw/zinc/94/91/96/1046949196.db2.gz JQDCWBZANMVXOJ-UHFFFAOYSA-N 1 2 309.413 4.089 20 0 DIADLO CCCn1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2)cn1 ZINC000162209332 1046949201 /nfs/dbraw/zinc/94/92/01/1046949201.db2.gz JQDCWBZANMVXOJ-UHFFFAOYSA-N 1 2 309.413 4.089 20 0 DIADLO CCCOc1cccc2c(NCc3cccc(F)n3)cc[nH+]c12 ZINC000798395773 1046950904 /nfs/dbraw/zinc/95/09/04/1046950904.db2.gz JAQUJISIXXNUPY-UHFFFAOYSA-N 1 2 311.360 4.170 20 0 DIADLO COc1ccc(F)c(C[NH2+]C2(c3ccccc3Cl)CC2)c1 ZINC000647224712 1046955320 /nfs/dbraw/zinc/95/53/20/1046955320.db2.gz VZTPLAAWFYBVKP-UHFFFAOYSA-N 1 2 305.780 4.267 20 0 DIADLO Cc1cc(NC(=O)c2cc(-c3ccc(Cl)s3)on2)cc[nH+]1 ZINC000079032556 1046956823 /nfs/dbraw/zinc/95/68/23/1046956823.db2.gz GCBKWLWCBMINIA-UHFFFAOYSA-N 1 2 319.773 4.012 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2c[nH]c(-c3ccccc3)n2)CCC1 ZINC000647237237 1046959235 /nfs/dbraw/zinc/95/92/35/1046959235.db2.gz LNRUEGLOEGIPBB-UHFFFAOYSA-N 1 2 321.399 4.385 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc2nc(C(F)(F)F)oc2c1 ZINC000647238486 1046961175 /nfs/dbraw/zinc/96/11/75/1046961175.db2.gz NFLGOALBVRLPRD-UHFFFAOYSA-N 1 2 324.306 4.236 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)s1 ZINC000680334146 1046966772 /nfs/dbraw/zinc/96/67/72/1046966772.db2.gz IIXRHEWPWFLTJF-MNOVXSKESA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1cnc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)s1 ZINC000680334146 1046966776 /nfs/dbraw/zinc/96/67/76/1046966776.db2.gz IIXRHEWPWFLTJF-MNOVXSKESA-N 1 2 306.397 4.429 20 0 DIADLO Oc1c(F)cc(C[N@@H+]2CCCC[C@H]2c2ccccc2)cc1F ZINC001140987741 1046969615 /nfs/dbraw/zinc/96/96/15/1046969615.db2.gz BSOUNSVGVBWPLU-KRWDZBQOSA-N 1 2 303.352 4.398 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CCCC[C@H]2c2ccccc2)cc1F ZINC001140987741 1046969624 /nfs/dbraw/zinc/96/96/24/1046969624.db2.gz BSOUNSVGVBWPLU-KRWDZBQOSA-N 1 2 303.352 4.398 20 0 DIADLO CC[C@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1ccccc1F ZINC000680355313 1046971984 /nfs/dbraw/zinc/97/19/84/1046971984.db2.gz WMXGKLDZBVIXMB-GJZGRUSLSA-N 1 2 307.315 4.278 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+][C@H]1COc2cc(F)cc(F)c21 ZINC000680355274 1046972265 /nfs/dbraw/zinc/97/22/65/1046972265.db2.gz ULWLRYZCLUXWKQ-ABAIWWIYSA-N 1 2 319.351 4.148 20 0 DIADLO CC(C)C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccncc1 ZINC000647297425 1046972400 /nfs/dbraw/zinc/97/24/00/1046972400.db2.gz BVKIXMNZPXIXEA-GOSISDBHSA-N 1 2 310.445 4.276 20 0 DIADLO CC[C@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1ccccc1F ZINC000680355315 1046973119 /nfs/dbraw/zinc/97/31/19/1046973119.db2.gz WMXGKLDZBVIXMB-LSDHHAIUSA-N 1 2 307.315 4.278 20 0 DIADLO c1cc(-c2ccccn2)sc1C[NH+]1CC(Oc2ccccc2)C1 ZINC001141000984 1046975265 /nfs/dbraw/zinc/97/52/65/1046975265.db2.gz SNXMPGOBVDIRBB-UHFFFAOYSA-N 1 2 322.433 4.073 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCc3cc(C)c(C)cc32)c(C)[nH+]1 ZINC000836630746 1046977096 /nfs/dbraw/zinc/97/70/96/1046977096.db2.gz ASCAVEQBPODKKI-UHFFFAOYSA-N 1 2 309.413 4.218 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1nc(-c2cccs2)oc1C ZINC000680382099 1046977816 /nfs/dbraw/zinc/97/78/16/1046977816.db2.gz CTBAYWBABLBUJZ-VIFPVBQESA-N 1 2 317.414 4.167 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccc(Oc3ccccc3)o2)cn1 ZINC000680480227 1046988390 /nfs/dbraw/zinc/98/83/90/1046988390.db2.gz BYTYJDSWKACRJJ-UHFFFAOYSA-N 1 2 324.380 4.108 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccc(Oc3ccccc3)o2)cn1 ZINC000680480227 1046988399 /nfs/dbraw/zinc/98/83/99/1046988399.db2.gz BYTYJDSWKACRJJ-UHFFFAOYSA-N 1 2 324.380 4.108 20 0 DIADLO CN1CCCc2cc([NH2+][C@@H]3CCC[C@H]([C@H]4CCOC4)C3)ccc21 ZINC000798932772 1046990124 /nfs/dbraw/zinc/99/01/24/1046990124.db2.gz KAGWSPJPJSTKTH-RYQLBKOJSA-N 1 2 314.473 4.076 20 0 DIADLO CCCCc1[nH]cc(CN2CCC[C@@H]2c2cc(F)cc(F)c2)[nH+]1 ZINC001141074394 1046997849 /nfs/dbraw/zinc/99/78/49/1046997849.db2.gz HEOUDQXXJFIHDN-QGZVFWFLSA-N 1 2 319.399 4.368 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124884 1047002446 /nfs/dbraw/zinc/00/24/46/1047002446.db2.gz AIGMTJNXTVKFIS-DOMZBBRYSA-N 1 2 319.836 4.259 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124884 1047002451 /nfs/dbraw/zinc/00/24/51/1047002451.db2.gz AIGMTJNXTVKFIS-DOMZBBRYSA-N 1 2 319.836 4.259 20 0 DIADLO CC(=O)Nc1ccc(C[NH+](Cc2ccco2)Cc2ccco2)cc1 ZINC000162563245 1047004514 /nfs/dbraw/zinc/00/45/14/1047004514.db2.gz JPCUDCWMLVMQBL-UHFFFAOYSA-N 1 2 324.380 4.033 20 0 DIADLO Cc1cccn2c(CN(Cc3ccco3)Cc3ccco3)c[nH+]c12 ZINC000162568380 1047006984 /nfs/dbraw/zinc/00/69/84/1047006984.db2.gz REKPCAGWEFZUMX-UHFFFAOYSA-N 1 2 321.380 4.031 20 0 DIADLO CCc1nocc1C[NH2+][C@@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000647970425 1047027493 /nfs/dbraw/zinc/02/74/93/1047027493.db2.gz PTSQCJOIUPAIFB-AWEZNQCLSA-N 1 2 316.298 4.159 20 0 DIADLO C(=C/c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1)\c1cccs1 ZINC000680750285 1047027661 /nfs/dbraw/zinc/02/76/61/1047027661.db2.gz TUCPSYUDHKNXCX-VOTSOKGWSA-N 1 2 320.377 4.154 20 0 DIADLO C[C@@H](c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1)C1CCCC1 ZINC000680748713 1047028632 /nfs/dbraw/zinc/02/86/32/1047028632.db2.gz DPCUYQUYQRPKFI-CYBMUJFWSA-N 1 2 308.385 4.216 20 0 DIADLO CC1(CC(F)F)C[NH+](Cc2ccc(F)cc2C(F)(F)F)C1 ZINC000648058969 1047031684 /nfs/dbraw/zinc/03/16/84/1047031684.db2.gz NGDQFDQJAPYASR-UHFFFAOYSA-N 1 2 311.269 4.322 20 0 DIADLO CC1(CC(F)F)C[NH+](Cc2ccc(Sc3ccccn3)o2)C1 ZINC000648059155 1047033636 /nfs/dbraw/zinc/03/36/36/1047033636.db2.gz ZYCDXGUWMGTWKC-UHFFFAOYSA-N 1 2 324.396 4.303 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1)Cc1cc(C)cnc1Cl ZINC001139594679 1047035984 /nfs/dbraw/zinc/03/59/84/1047035984.db2.gz FOFBPTWUPDKLIY-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1)Cc1cc(C)cnc1Cl ZINC001139594679 1047036001 /nfs/dbraw/zinc/03/60/01/1047036001.db2.gz FOFBPTWUPDKLIY-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO COc1ccc(C(F)(F)F)cc1C[N@@H+]1CCCC[C@@H](F)C1 ZINC001141199645 1047045139 /nfs/dbraw/zinc/04/51/39/1047045139.db2.gz KBXUUQZPVOTOPA-CYBMUJFWSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C(F)(F)F)cc1C[N@H+]1CCCC[C@@H](F)C1 ZINC001141199645 1047045153 /nfs/dbraw/zinc/04/51/53/1047045153.db2.gz KBXUUQZPVOTOPA-CYBMUJFWSA-N 1 2 305.315 4.038 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2cccc(-c3ccc(F)cc3)n2)C[C@@H]1F ZINC001141206123 1047046325 /nfs/dbraw/zinc/04/63/25/1047046325.db2.gz SXBNSXLCGYDWDX-ZWKOTPCHSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2cccc(-c3ccc(F)cc3)n2)C[C@@H]1F ZINC001141206123 1047046335 /nfs/dbraw/zinc/04/63/35/1047046335.db2.gz SXBNSXLCGYDWDX-ZWKOTPCHSA-N 1 2 320.358 4.160 20 0 DIADLO CCc1ccccc1C[N@@H+]1CCc2ncc(C(F)(F)F)cc2C1 ZINC001141226909 1047053416 /nfs/dbraw/zinc/05/34/16/1047053416.db2.gz PEPVEEIZAKKOCO-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO CCc1ccccc1C[N@H+]1CCc2ncc(C(F)(F)F)cc2C1 ZINC001141226909 1047053428 /nfs/dbraw/zinc/05/34/28/1047053428.db2.gz PEPVEEIZAKKOCO-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO Fc1cc(F)c(CNc2[nH+]c3ccccc3n2C2CC2)cc1F ZINC000680852707 1047054278 /nfs/dbraw/zinc/05/42/78/1047054278.db2.gz QKOMGGANADFNON-UHFFFAOYSA-N 1 2 317.314 4.401 20 0 DIADLO Cc1ccccc1Cn1c2ccccc2[nH+]c1NCc1cc[nH]c1 ZINC000680963516 1047072400 /nfs/dbraw/zinc/07/24/00/1047072400.db2.gz FDNFIYJULUMFAT-UHFFFAOYSA-N 1 2 316.408 4.333 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(OC)c(O[C@@H](C)CC)c1)C(F)F ZINC000648619216 1047073192 /nfs/dbraw/zinc/07/31/92/1047073192.db2.gz DTALWRLTGZFBDK-WCQYABFASA-N 1 2 301.377 4.006 20 0 DIADLO CCCC[N@H+](Cn1nc(NC(C)C)sc1=S)[C@H](C)CC ZINC001115862078 1047088204 /nfs/dbraw/zinc/08/82/04/1047088204.db2.gz HKVAJKODTIYAHR-GFCCVEGCSA-N 1 2 316.540 4.352 20 0 DIADLO CCCC[N@@H+](Cn1nc(NC(C)C)sc1=S)[C@H](C)CC ZINC001115862078 1047088211 /nfs/dbraw/zinc/08/82/11/1047088211.db2.gz HKVAJKODTIYAHR-GFCCVEGCSA-N 1 2 316.540 4.352 20 0 DIADLO COCCOc1ccccc1CNc1cc(C)c2ccccc2[nH+]1 ZINC001115878518 1047090609 /nfs/dbraw/zinc/09/06/09/1047090609.db2.gz SZSOHRCJYKDVOV-UHFFFAOYSA-N 1 2 322.408 4.181 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccco2)on1)Cc1cc2ccccc2[nH]1 ZINC001116235362 1047121733 /nfs/dbraw/zinc/12/17/33/1047121733.db2.gz TYSMBQXPBYPQOH-UHFFFAOYSA-N 1 2 307.353 4.048 20 0 DIADLO C[N@H+](Cc1cc(-c2ccco2)on1)Cc1cc2ccccc2[nH]1 ZINC001116235362 1047121735 /nfs/dbraw/zinc/12/17/35/1047121735.db2.gz TYSMBQXPBYPQOH-UHFFFAOYSA-N 1 2 307.353 4.048 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(-c2ccc(F)cc2)[nH]1)c1ccc(C)cc1 ZINC000536909212 1047124374 /nfs/dbraw/zinc/12/43/74/1047124374.db2.gz LADHLVXWHMQWFR-KRWDZBQOSA-N 1 2 324.403 4.160 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(-c2ccc(F)cc2)n[nH]1)c1ccc(C)cc1 ZINC000536909212 1047124386 /nfs/dbraw/zinc/12/43/86/1047124386.db2.gz LADHLVXWHMQWFR-KRWDZBQOSA-N 1 2 324.403 4.160 20 0 DIADLO Fc1cc(Cl)cc(C[NH2+]Cc2c(F)c(F)cc(F)c2F)c1 ZINC000681594465 1047131440 /nfs/dbraw/zinc/13/14/40/1047131440.db2.gz PWDMULZHKSZFII-UHFFFAOYSA-N 1 2 321.676 4.325 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)no1)c1c(F)cccc1F ZINC000537022235 1047133701 /nfs/dbraw/zinc/13/37/01/1047133701.db2.gz DJIRDKIIKDLHPU-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](C)Cc1cc2n(n1)CCC2 ZINC000649499397 1047137429 /nfs/dbraw/zinc/13/74/29/1047137429.db2.gz XGIVNSCBFBAWFW-GFCCVEGCSA-N 1 2 323.362 4.041 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)Cc1cc2n(n1)CCC2 ZINC000649499397 1047137432 /nfs/dbraw/zinc/13/74/32/1047137432.db2.gz XGIVNSCBFBAWFW-GFCCVEGCSA-N 1 2 323.362 4.041 20 0 DIADLO CC[C@H](C)[N@@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000681671179 1047139329 /nfs/dbraw/zinc/13/93/29/1047139329.db2.gz JNAIPZCEVPPAPF-JTQLQIEISA-N 1 2 307.235 4.087 20 0 DIADLO CC[C@H](C)[N@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000681671179 1047139334 /nfs/dbraw/zinc/13/93/34/1047139334.db2.gz JNAIPZCEVPPAPF-JTQLQIEISA-N 1 2 307.235 4.087 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(OCC3CC3)c(F)c2)o1 ZINC000537126005 1047140475 /nfs/dbraw/zinc/14/04/75/1047140475.db2.gz SIQZQPPLKDRWEZ-QWHCGFSZSA-N 1 2 318.392 4.323 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC001116444280 1047141794 /nfs/dbraw/zinc/14/17/94/1047141794.db2.gz VQUWSPIMPCXQJB-QWHCGFSZSA-N 1 2 316.470 4.167 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC001116444280 1047141796 /nfs/dbraw/zinc/14/17/96/1047141796.db2.gz VQUWSPIMPCXQJB-QWHCGFSZSA-N 1 2 316.470 4.167 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cc(OC(C)C)ccn1)c1nc(C)cs1 ZINC000649562379 1047142496 /nfs/dbraw/zinc/14/24/96/1047142496.db2.gz FMWYZKCUQCJUAU-QGZVFWFLSA-N 1 2 319.474 4.049 20 0 DIADLO C[C@@H]([NH2+]Cc1cc2n(n1)CCCC2)c1ccc(Cl)cc1Cl ZINC000649553595 1047143310 /nfs/dbraw/zinc/14/33/10/1047143310.db2.gz WUAAMNUYHBDHAG-LLVKDONJSA-N 1 2 324.255 4.377 20 0 DIADLO C[C@H]([NH2+]Cc1cc2n(n1)CCCC2)c1ccc(Cl)cc1Cl ZINC000649553596 1047143330 /nfs/dbraw/zinc/14/33/30/1047143330.db2.gz WUAAMNUYHBDHAG-NSHDSACASA-N 1 2 324.255 4.377 20 0 DIADLO CCCCN(C(=O)C[C@@H](C)n1cc[nH+]c1)[C@H](C)c1ccc(C)o1 ZINC000649595023 1047149963 /nfs/dbraw/zinc/14/99/63/1047149963.db2.gz YFYJQWLPENMZNR-GDBMZVCRSA-N 1 2 317.433 4.126 20 0 DIADLO CCCCN(C(=O)C[C@H](C)n1cc[nH+]c1)[C@@H](C)c1ccc(C)o1 ZINC000649595025 1047150001 /nfs/dbraw/zinc/15/00/01/1047150001.db2.gz YFYJQWLPENMZNR-HOCLYGCPSA-N 1 2 317.433 4.126 20 0 DIADLO CC(C)([NH2+]Cc1cc2n(n1)CCCC2)c1cccc(Cl)c1F ZINC000649586930 1047150070 /nfs/dbraw/zinc/15/00/70/1047150070.db2.gz URVSDZLKAIBUON-UHFFFAOYSA-N 1 2 321.827 4.037 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(Cl)nc1F ZINC001137478084 1047151779 /nfs/dbraw/zinc/15/17/79/1047151779.db2.gz UNXDFEKSQMZEEX-HNNXBMFYSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc(Cl)nc1F ZINC001137478084 1047151785 /nfs/dbraw/zinc/15/17/85/1047151785.db2.gz UNXDFEKSQMZEEX-HNNXBMFYSA-N 1 2 304.796 4.384 20 0 DIADLO Cc1ncsc1C[N@H+](Cc1ccccn1)Cc1ccccc1C ZINC000649620746 1047154032 /nfs/dbraw/zinc/15/40/32/1047154032.db2.gz RIDVZRBVLCQWLU-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO Cc1ncsc1C[N@@H+](Cc1ccccn1)Cc1ccccc1C ZINC000649620746 1047154037 /nfs/dbraw/zinc/15/40/37/1047154037.db2.gz RIDVZRBVLCQWLU-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ccc(C)nc2Cl)cc1 ZINC000838786711 1047156405 /nfs/dbraw/zinc/15/64/05/1047156405.db2.gz CJBGRZWMOBQZDU-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ccc(C)nc2Cl)cc1 ZINC000838786711 1047156411 /nfs/dbraw/zinc/15/64/11/1047156411.db2.gz CJBGRZWMOBQZDU-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@@H+]([C@@H](C)c2ccc(F)cc2F)C1 ZINC000682042750 1047163932 /nfs/dbraw/zinc/16/39/32/1047163932.db2.gz ZKHRXCFYPALMOB-HZMBPMFUSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@H+]([C@@H](C)c2ccc(F)cc2F)C1 ZINC000682042750 1047163934 /nfs/dbraw/zinc/16/39/34/1047163934.db2.gz ZKHRXCFYPALMOB-HZMBPMFUSA-N 1 2 323.305 4.069 20 0 DIADLO OC1CC[NH+](c2ccc(NCc3ccc(C4CC4)cc3)cc2)CC1 ZINC000838865955 1047167050 /nfs/dbraw/zinc/16/70/50/1047167050.db2.gz JZCSRYLHSSKJSH-UHFFFAOYSA-N 1 2 322.452 4.137 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1ccc(C)nc1Cl)CCC2 ZINC000838896022 1047169587 /nfs/dbraw/zinc/16/95/87/1047169587.db2.gz WAYJUOCTLZFKTQ-CQSZACIVSA-N 1 2 321.877 4.318 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccc(C)nc1Cl)CCC2 ZINC000838896022 1047169596 /nfs/dbraw/zinc/16/95/96/1047169596.db2.gz WAYJUOCTLZFKTQ-CQSZACIVSA-N 1 2 321.877 4.318 20 0 DIADLO C[C@H]1CC[C@@H](C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C1 ZINC000537344068 1047172988 /nfs/dbraw/zinc/17/29/88/1047172988.db2.gz FZCDRGCRTKVCLU-GOEBONIOSA-N 1 2 323.440 4.261 20 0 DIADLO Cc1cc(N[C@H](C)[C@H](O)c2ccc(F)cc2)[nH+]c2ccccc12 ZINC001116736236 1047173128 /nfs/dbraw/zinc/17/31/28/1047173128.db2.gz NILNTUNKHOMJOZ-YJYMSZOUSA-N 1 2 310.372 4.216 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+](C)Cc2oc3c(cccc3C)c2C)o1 ZINC000649819014 1047179884 /nfs/dbraw/zinc/17/98/84/1047179884.db2.gz ITUKSPGELQHPKR-CYBMUJFWSA-N 1 2 313.401 4.188 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+](C)Cc2oc3c(cccc3C)c2C)o1 ZINC000649819014 1047179892 /nfs/dbraw/zinc/17/98/92/1047179892.db2.gz ITUKSPGELQHPKR-CYBMUJFWSA-N 1 2 313.401 4.188 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2nc(-c3ccccc3)c[nH]2)n1 ZINC001116833321 1047180275 /nfs/dbraw/zinc/18/02/75/1047180275.db2.gz UVQBHLVVFQAENS-LJQANCHMSA-N 1 2 318.424 4.117 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2nc(-c3ccccc3)c[nH]2)n1 ZINC001116833321 1047180279 /nfs/dbraw/zinc/18/02/79/1047180279.db2.gz UVQBHLVVFQAENS-LJQANCHMSA-N 1 2 318.424 4.117 20 0 DIADLO CC[C@H]1CCC[N@@H+]1Cc1c(F)cc(Br)cc1F ZINC001141559046 1047186082 /nfs/dbraw/zinc/18/60/82/1047186082.db2.gz DXAKZCHYLWZMPR-JTQLQIEISA-N 1 2 304.178 4.102 20 0 DIADLO CC[C@H]1CCC[N@H+]1Cc1c(F)cc(Br)cc1F ZINC001141559046 1047186087 /nfs/dbraw/zinc/18/60/87/1047186087.db2.gz DXAKZCHYLWZMPR-JTQLQIEISA-N 1 2 304.178 4.102 20 0 DIADLO Cc1cc(N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@H]2O)[nH+]c2ccccc12 ZINC001116913008 1047190477 /nfs/dbraw/zinc/19/04/77/1047190477.db2.gz OSMBLFYPAZXNGE-GIPAHHNCSA-N 1 2 324.468 4.309 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(F)cc(Br)cc2F)C2(CC2)C1 ZINC001141563843 1047192182 /nfs/dbraw/zinc/19/21/82/1047192182.db2.gz WIJZXQMSJKKVMA-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(F)cc(Br)cc2F)C2(CC2)C1 ZINC001141563843 1047192188 /nfs/dbraw/zinc/19/21/88/1047192188.db2.gz WIJZXQMSJKKVMA-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Br)cc(Cl)c2F)C1 ZINC001141596543 1047211433 /nfs/dbraw/zinc/21/14/33/1047211433.db2.gz NVHLYGCBJLHSPU-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Br)cc(Cl)c2F)C1 ZINC001141596543 1047211446 /nfs/dbraw/zinc/21/14/46/1047211446.db2.gz NVHLYGCBJLHSPU-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1cscc1Cl ZINC000682731221 1047216204 /nfs/dbraw/zinc/21/62/04/1047216204.db2.gz WWRYRDQSFSQEPC-UHFFFAOYSA-N 1 2 307.802 4.446 20 0 DIADLO C[C@@H]1C[N@H+](C[C@]2(C)CC2(Cl)Cl)C[C@H](c2ccsc2)O1 ZINC000828047167 1047217781 /nfs/dbraw/zinc/21/77/81/1047217781.db2.gz HIPKUFLQXAGOKM-RTXFEEFZSA-N 1 2 320.285 4.094 20 0 DIADLO C[C@@H]1C[N@@H+](C[C@]2(C)CC2(Cl)Cl)C[C@H](c2ccsc2)O1 ZINC000828047167 1047217794 /nfs/dbraw/zinc/21/77/94/1047217794.db2.gz HIPKUFLQXAGOKM-RTXFEEFZSA-N 1 2 320.285 4.094 20 0 DIADLO C[C@@H]1C[N@H+](C[C@@]2(C)CC2(Cl)Cl)C[C@H](c2ccsc2)O1 ZINC000828047166 1047218401 /nfs/dbraw/zinc/21/84/01/1047218401.db2.gz HIPKUFLQXAGOKM-RAIGVLPGSA-N 1 2 320.285 4.094 20 0 DIADLO C[C@@H]1C[N@@H+](C[C@@]2(C)CC2(Cl)Cl)C[C@H](c2ccsc2)O1 ZINC000828047166 1047218411 /nfs/dbraw/zinc/21/84/11/1047218411.db2.gz HIPKUFLQXAGOKM-RAIGVLPGSA-N 1 2 320.285 4.094 20 0 DIADLO CCn1ccc(C[N@H+](C)Cc2csc(-c3ccccc3)n2)c1 ZINC000682778633 1047224449 /nfs/dbraw/zinc/22/44/49/1047224449.db2.gz NYBHKMOQVZPTJT-UHFFFAOYSA-N 1 2 311.454 4.264 20 0 DIADLO CCn1ccc(C[N@@H+](C)Cc2csc(-c3ccccc3)n2)c1 ZINC000682778633 1047224460 /nfs/dbraw/zinc/22/44/60/1047224460.db2.gz NYBHKMOQVZPTJT-UHFFFAOYSA-N 1 2 311.454 4.264 20 0 DIADLO CCCCOc1ccc(CNc2cc(COC)cc[nH+]2)cc1 ZINC000650245019 1047226490 /nfs/dbraw/zinc/22/64/90/1047226490.db2.gz ZCMLLPMRGPQBDK-UHFFFAOYSA-N 1 2 300.402 4.019 20 0 DIADLO CC(C)C[C@H]1COCC[N@@H+]1Cc1cc2ccnc(Cl)c2s1 ZINC001204873461 1047229694 /nfs/dbraw/zinc/22/96/94/1047229694.db2.gz BERYPAFDOUNGFJ-ZDUSSCGKSA-N 1 2 324.877 4.197 20 0 DIADLO CC(C)C[C@H]1COCC[N@H+]1Cc1cc2ccnc(Cl)c2s1 ZINC001204873461 1047229700 /nfs/dbraw/zinc/22/97/00/1047229700.db2.gz BERYPAFDOUNGFJ-ZDUSSCGKSA-N 1 2 324.877 4.197 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3coc(C4CC4)n3)CCCC2)c(F)c1 ZINC000760457048 1047238580 /nfs/dbraw/zinc/23/85/80/1047238580.db2.gz ARVPYOIXIJVHMI-UHFFFAOYSA-N 1 2 318.367 4.389 20 0 DIADLO Nc1ccc(Nc2ccc[nH+]c2N2CCCCC2)cc1Cl ZINC001212105795 1047244308 /nfs/dbraw/zinc/24/43/08/1047244308.db2.gz LSJZBKACRYWVHT-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@H]3c3nccs3)ccc2c1 ZINC001141649321 1047244515 /nfs/dbraw/zinc/24/45/15/1047244515.db2.gz RUDWUOCVZUTVOX-INIZCTEOSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@H]3c3nccs3)ccc2c1 ZINC001141649321 1047244520 /nfs/dbraw/zinc/24/45/20/1047244520.db2.gz RUDWUOCVZUTVOX-INIZCTEOSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@@H]3c3nccs3)ccc2c1 ZINC001141649323 1047246147 /nfs/dbraw/zinc/24/61/47/1047246147.db2.gz RUDWUOCVZUTVOX-MRXNPFEDSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@@H]3c3nccs3)ccc2c1 ZINC001141649323 1047246154 /nfs/dbraw/zinc/24/61/54/1047246154.db2.gz RUDWUOCVZUTVOX-MRXNPFEDSA-N 1 2 313.401 4.168 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccc(Br)o2)C2CC2)o1 ZINC000682994252 1047247779 /nfs/dbraw/zinc/24/77/79/1047247779.db2.gz NJFUDGKUALCSJM-UHFFFAOYSA-N 1 2 310.191 4.108 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccc(Br)o2)C2CC2)o1 ZINC000682994252 1047247795 /nfs/dbraw/zinc/24/77/95/1047247795.db2.gz NJFUDGKUALCSJM-UHFFFAOYSA-N 1 2 310.191 4.108 20 0 DIADLO CC(C)N(C)c1ccc(C[N@@H+]2CC[C@H]2c2cccc(F)c2)cn1 ZINC000682998421 1047250246 /nfs/dbraw/zinc/25/02/46/1047250246.db2.gz VRBSXQMUENJLNF-SFHVURJKSA-N 1 2 313.420 4.012 20 0 DIADLO CC(C)N(C)c1ccc(C[N@H+]2CC[C@H]2c2cccc(F)c2)cn1 ZINC000682998421 1047250268 /nfs/dbraw/zinc/25/02/68/1047250268.db2.gz VRBSXQMUENJLNF-SFHVURJKSA-N 1 2 313.420 4.012 20 0 DIADLO Cc1ccnc(C[N@@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000683008901 1047255024 /nfs/dbraw/zinc/25/50/24/1047255024.db2.gz FHLYBVFSLNUCNQ-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccnc(C[N@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000683008901 1047255047 /nfs/dbraw/zinc/25/50/47/1047255047.db2.gz FHLYBVFSLNUCNQ-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO CCn1ccc(C[N@H+](C)Cc2ncc(-c3ccc(C)cc3)o2)c1 ZINC000683031226 1047259848 /nfs/dbraw/zinc/25/98/48/1047259848.db2.gz QVNJMQFDQWBBMP-UHFFFAOYSA-N 1 2 309.413 4.103 20 0 DIADLO CCn1ccc(C[N@@H+](C)Cc2ncc(-c3ccc(C)cc3)o2)c1 ZINC000683031226 1047259861 /nfs/dbraw/zinc/25/98/61/1047259861.db2.gz QVNJMQFDQWBBMP-UHFFFAOYSA-N 1 2 309.413 4.103 20 0 DIADLO Fc1ccc(C[N@@H+]2CC[C@@H]3[C@H](C2)C3(F)F)c(Cl)c1Cl ZINC001462333003 1047274278 /nfs/dbraw/zinc/27/42/78/1047274278.db2.gz MZTXHQNBIDETOK-BDAKNGLRSA-N 1 2 310.146 4.220 20 0 DIADLO Fc1ccc(C[N@H+]2CC[C@@H]3[C@H](C2)C3(F)F)c(Cl)c1Cl ZINC001462333003 1047274295 /nfs/dbraw/zinc/27/42/95/1047274295.db2.gz MZTXHQNBIDETOK-BDAKNGLRSA-N 1 2 310.146 4.220 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1csc(Br)c1 ZINC000528769779 1047272740 /nfs/dbraw/zinc/27/27/40/1047272740.db2.gz SRONCLWORAUPTO-MRVPVSSYSA-N 1 2 310.207 4.130 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1csc(Br)c1 ZINC000528769779 1047272756 /nfs/dbraw/zinc/27/27/56/1047272756.db2.gz SRONCLWORAUPTO-MRVPVSSYSA-N 1 2 310.207 4.130 20 0 DIADLO CCO[C@@H]1C[C@H](Nc2ccc([NH+]3CCCC3)cc2)C12CCC2 ZINC000388266407 1047287111 /nfs/dbraw/zinc/28/71/11/1047287111.db2.gz MWJKZAWPDRQMKW-ZWKOTPCHSA-N 1 2 300.446 4.046 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1cc(Br)cc(F)c1F ZINC001141795292 1047291693 /nfs/dbraw/zinc/29/16/93/1047291693.db2.gz CGOYCPGZMCMLNX-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1cc(Br)cc(F)c1F ZINC001141795292 1047291700 /nfs/dbraw/zinc/29/17/00/1047291700.db2.gz CGOYCPGZMCMLNX-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]C/C=C/c2ccc(F)cc2F)n1 ZINC000897944002 1047304217 /nfs/dbraw/zinc/30/42/17/1047304217.db2.gz DRBWCXPOVNNDSB-SNAWJCMRSA-N 1 2 306.356 4.053 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]C/C=C/c2ccc(F)c(F)c2)n1 ZINC000897943889 1047305532 /nfs/dbraw/zinc/30/55/32/1047305532.db2.gz AJTJQFHSYPBTRV-SNAWJCMRSA-N 1 2 306.356 4.053 20 0 DIADLO COc1cccc2cc(CNc3ccc(N4CCCC4)[nH+]c3)oc21 ZINC000391802178 1047306193 /nfs/dbraw/zinc/30/61/93/1047306193.db2.gz DBCBHAMDNHZARY-UHFFFAOYSA-N 1 2 323.396 4.049 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(F)c(Br)cc2F)C2(CC2)C1 ZINC001141917383 1047309136 /nfs/dbraw/zinc/30/91/36/1047309136.db2.gz NXAKOTMKDLWRLS-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(F)c(Br)cc2F)C2(CC2)C1 ZINC001141917383 1047309148 /nfs/dbraw/zinc/30/91/48/1047309148.db2.gz NXAKOTMKDLWRLS-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO Cc1cccc(Nc2nn(C[N@H+]3CC[C@H](C)C3)c(=S)s2)c1 ZINC000725779991 1047313121 /nfs/dbraw/zinc/31/31/21/1047313121.db2.gz WAVJGGSCZCGEBU-LBPRGKRZSA-N 1 2 320.487 4.025 20 0 DIADLO Cc1cccc(Nc2nn(C[N@@H+]3CC[C@H](C)C3)c(=S)s2)c1 ZINC000725779991 1047313132 /nfs/dbraw/zinc/31/31/32/1047313132.db2.gz WAVJGGSCZCGEBU-LBPRGKRZSA-N 1 2 320.487 4.025 20 0 DIADLO CCc1cnc(C[NH2+][C@@H]2CCc3ccc(F)c(Cl)c32)s1 ZINC000651726460 1047324644 /nfs/dbraw/zinc/32/46/44/1047324644.db2.gz NFWDYRUGDCKWAZ-GFCCVEGCSA-N 1 2 310.825 4.275 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+]Cc1nc(C(C)C)n2ccccc12 ZINC000651748322 1047327608 /nfs/dbraw/zinc/32/76/08/1047327608.db2.gz HHILQUQUHJBJNL-OAHLLOKOSA-N 1 2 308.429 4.012 20 0 DIADLO Brc1ccccc1[C@H]1C[N@H+](CC2CCCC2)CCO1 ZINC000726070909 1047333171 /nfs/dbraw/zinc/33/31/71/1047333171.db2.gz SBWCIYWEYBNZRB-MRXNPFEDSA-N 1 2 324.262 4.013 20 0 DIADLO Brc1ccccc1[C@H]1C[N@@H+](CC2CCCC2)CCO1 ZINC000726070909 1047333183 /nfs/dbraw/zinc/33/31/83/1047333183.db2.gz SBWCIYWEYBNZRB-MRXNPFEDSA-N 1 2 324.262 4.013 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1C[C@H]1C1CCCC1 ZINC000651955913 1047336461 /nfs/dbraw/zinc/33/64/61/1047336461.db2.gz FLRSXGGFGDQPQR-JKSUJKDBSA-N 1 2 309.413 4.150 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2ccc(Br)cc2)c1 ZINC000652067613 1047341182 /nfs/dbraw/zinc/34/11/82/1047341182.db2.gz AARRZJQLRVPSMP-NSHDSACASA-N 1 2 321.218 4.164 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(F)cc1Br ZINC001142003137 1047341983 /nfs/dbraw/zinc/34/19/83/1047341983.db2.gz JKYSQABCGLGQKD-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1cc(F)c(F)cc1Br ZINC001142003137 1047341990 /nfs/dbraw/zinc/34/19/90/1047341990.db2.gz JKYSQABCGLGQKD-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(F)cc1 ZINC000652204091 1047346329 /nfs/dbraw/zinc/34/63/29/1047346329.db2.gz FTKGRWXFXVEIJG-OAHLLOKOSA-N 1 2 309.816 4.090 20 0 DIADLO C[C@@H]([NH2+][C@H]1CC(C)(C)Oc2ccc(F)cc21)c1nccs1 ZINC000652267676 1047350761 /nfs/dbraw/zinc/35/07/61/1047350761.db2.gz ZCWDPQRTEQFWOZ-MFKMUULPSA-N 1 2 306.406 4.235 20 0 DIADLO COCc1cc[nH+]c(N[C@H](c2ccc(Cl)cc2)C2CC2)c1 ZINC000652330416 1047355620 /nfs/dbraw/zinc/35/56/20/1047355620.db2.gz FOSRXQLSIVWQMP-KRWDZBQOSA-N 1 2 302.805 4.445 20 0 DIADLO CC[C@@H](Nc1cc(COC)cc[nH+]1)c1ccccc1OC(F)F ZINC000652330447 1047356137 /nfs/dbraw/zinc/35/61/37/1047356137.db2.gz GJMARVAPJVFMNI-CQSZACIVSA-N 1 2 322.355 4.393 20 0 DIADLO Fc1cc2cc(C[NH+]3CC4(CCC4)C3)c(Cl)nc2cc1F ZINC001142038086 1047356526 /nfs/dbraw/zinc/35/65/26/1047356526.db2.gz NKTUZUFFEWAQFL-UHFFFAOYSA-N 1 2 308.759 4.152 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CCCOc3c(C)cc(C)cc32)c1 ZINC000652330294 1047356700 /nfs/dbraw/zinc/35/67/00/1047356700.db2.gz BWOQFJPTUDMKAA-QGZVFWFLSA-N 1 2 312.413 4.171 20 0 DIADLO CCCC(C)(C)C(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC001142036916 1047356996 /nfs/dbraw/zinc/35/69/96/1047356996.db2.gz QMZLMMFWUHSMNV-CYBMUJFWSA-N 1 2 323.506 4.140 20 0 DIADLO CCCC(C)(C)C(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC001142036916 1047357009 /nfs/dbraw/zinc/35/70/09/1047357009.db2.gz QMZLMMFWUHSMNV-CYBMUJFWSA-N 1 2 323.506 4.140 20 0 DIADLO CCC[N@H+](Cn1ncsc1=S)[C@H]1CCc2ccccc21 ZINC000726588023 1047367423 /nfs/dbraw/zinc/36/74/23/1047367423.db2.gz BHBKFFAQCCYUQI-AWEZNQCLSA-N 1 2 305.472 4.031 20 0 DIADLO CCC[N@@H+](Cn1ncsc1=S)[C@H]1CCc2ccccc21 ZINC000726588023 1047367440 /nfs/dbraw/zinc/36/74/40/1047367440.db2.gz BHBKFFAQCCYUQI-AWEZNQCLSA-N 1 2 305.472 4.031 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2sc3ccccc3c2Cl)cn1 ZINC001203117628 1047368785 /nfs/dbraw/zinc/36/87/85/1047368785.db2.gz KJDJUTVSDSTALI-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2sc3ccccc3c2Cl)cn1 ZINC001203117628 1047368798 /nfs/dbraw/zinc/36/87/98/1047368798.db2.gz KJDJUTVSDSTALI-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO COc1cccc2cc(CNc3ccc4c(c3)CCC[NH2+]4)oc21 ZINC000841035302 1047373059 /nfs/dbraw/zinc/37/30/59/1047373059.db2.gz HMSCGAOMZWBTAE-UHFFFAOYSA-N 1 2 308.381 4.412 20 0 DIADLO O=C(CC1CCCCC1)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000045754319 1047377331 /nfs/dbraw/zinc/37/73/31/1047377331.db2.gz DFGURQULNJQEGT-UHFFFAOYSA-N 1 2 321.490 4.038 20 0 DIADLO Oc1cc(Cl)c(C[N@@H+]2CCCC(F)(F)CC2)c(Cl)c1 ZINC001142105560 1047380417 /nfs/dbraw/zinc/38/04/17/1047380417.db2.gz FRKISDSHBZKBFQ-UHFFFAOYSA-N 1 2 310.171 4.320 20 0 DIADLO FC1(F)CC[NH+](Cc2cc(Cl)ccc2OCC2CC2)CC1 ZINC000796542249 1047384220 /nfs/dbraw/zinc/38/42/20/1047384220.db2.gz CWHMHRHYDXMYMR-UHFFFAOYSA-N 1 2 315.791 4.360 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC2(C3CCC3)CCC2)c(C)[nH+]1 ZINC000653189667 1047385649 /nfs/dbraw/zinc/38/56/49/1047385649.db2.gz ALWYHNZPKNSSGU-UHFFFAOYSA-N 1 2 301.434 4.099 20 0 DIADLO Fc1ccccc1-c1nc(C[NH+]2CCC(F)(F)CC2)cs1 ZINC000796541024 1047385877 /nfs/dbraw/zinc/38/58/77/1047385877.db2.gz NGOBYWRCKYKCCP-UHFFFAOYSA-N 1 2 312.360 4.180 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C2CC2)C2CCCCC2)c(C)[nH+]1 ZINC000653181663 1047386198 /nfs/dbraw/zinc/38/61/98/1047386198.db2.gz RMOWMYYZRRTVHG-UHFFFAOYSA-N 1 2 301.434 4.336 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(-c3cccs3)s2)CCC1=O ZINC001139021974 1047388657 /nfs/dbraw/zinc/38/86/57/1047388657.db2.gz CRWYGPXNHSMOQF-UHFFFAOYSA-N 1 2 305.468 4.278 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(-c3cccs3)s2)CCC1=O ZINC001139021974 1047388671 /nfs/dbraw/zinc/38/86/71/1047388671.db2.gz CRWYGPXNHSMOQF-UHFFFAOYSA-N 1 2 305.468 4.278 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSc3ccccc3C2)c(Cl)n1 ZINC001142143969 1047389194 /nfs/dbraw/zinc/38/91/94/1047389194.db2.gz OKKNUQYJAIPROX-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO Cc1ccc(C[N@H+]2CCSc3ccccc3C2)c(Cl)n1 ZINC001142143969 1047389205 /nfs/dbraw/zinc/38/92/05/1047389205.db2.gz OKKNUQYJAIPROX-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO CCc1ccc(C[N@H+](Cc2cccnc2Cl)C2CC2)cc1 ZINC000726970890 1047397043 /nfs/dbraw/zinc/39/70/43/1047397043.db2.gz WGDUVGTXSHMKCB-UHFFFAOYSA-N 1 2 300.833 4.462 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2cccnc2Cl)C2CC2)cc1 ZINC000726970890 1047397047 /nfs/dbraw/zinc/39/70/47/1047397047.db2.gz WGDUVGTXSHMKCB-UHFFFAOYSA-N 1 2 300.833 4.462 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(C(F)F)cc2F)c(C)[nH+]1 ZINC000653540446 1047397503 /nfs/dbraw/zinc/39/75/03/1047397503.db2.gz INVPUXOHJITPRJ-UHFFFAOYSA-N 1 2 308.303 4.336 20 0 DIADLO Fc1cc(-c2ccccc2)ccc1C[NH2+][C@H]1CCCn2ccnc21 ZINC000655770438 1047400134 /nfs/dbraw/zinc/40/01/34/1047400134.db2.gz KHDOBNQHDSRIEM-IBGZPJMESA-N 1 2 321.399 4.314 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@H+](C[C@H]1CC1(Cl)Cl)CC3 ZINC000749276059 1047406650 /nfs/dbraw/zinc/40/66/50/1047406650.db2.gz CJVILWHMLZEVIK-LLVKDONJSA-N 1 2 309.240 4.028 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](C[C@H]1CC1(Cl)Cl)CC3 ZINC000749276059 1047406655 /nfs/dbraw/zinc/40/66/55/1047406655.db2.gz CJVILWHMLZEVIK-LLVKDONJSA-N 1 2 309.240 4.028 20 0 DIADLO Cc1cscc1C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC000749356176 1047413828 /nfs/dbraw/zinc/41/38/28/1047413828.db2.gz ZQOLLRRDNPPZDI-UHFFFAOYSA-N 1 2 311.410 4.316 20 0 DIADLO COc1ccc(C(C)C)cc1C[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000653671597 1047414116 /nfs/dbraw/zinc/41/41/16/1047414116.db2.gz LGLMVMBLKZPRFK-SFHVURJKSA-N 1 2 313.445 4.269 20 0 DIADLO COc1ccc(C(C)C)cc1C[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000653671597 1047414126 /nfs/dbraw/zinc/41/41/26/1047414126.db2.gz LGLMVMBLKZPRFK-SFHVURJKSA-N 1 2 313.445 4.269 20 0 DIADLO Brc1csc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000116877557 1047415704 /nfs/dbraw/zinc/41/57/04/1047415704.db2.gz KIMRUGANHNXBRU-ZDUSSCGKSA-N 1 2 311.248 4.176 20 0 DIADLO Brc1csc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000116877557 1047415713 /nfs/dbraw/zinc/41/57/13/1047415713.db2.gz KIMRUGANHNXBRU-ZDUSSCGKSA-N 1 2 311.248 4.176 20 0 DIADLO CC[C@@H]([NH2+]Cc1csc(N(C)C2CC2)n1)c1ccccc1F ZINC000653792635 1047423500 /nfs/dbraw/zinc/42/35/00/1047423500.db2.gz POJSGFAXXQGDOL-MRXNPFEDSA-N 1 2 319.449 4.122 20 0 DIADLO CC(C)C[C@H](C(=O)NCC1(C)CCC(C)(C)CC1)n1cc[nH+]c1 ZINC001142305453 1047426841 /nfs/dbraw/zinc/42/68/41/1047426841.db2.gz YGRGSMUWZLEHRS-MRXNPFEDSA-N 1 2 319.493 4.193 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1C[C@H](C)OC2(CCCCC2)C1 ZINC000653905834 1047432886 /nfs/dbraw/zinc/43/28/86/1047432886.db2.gz JIHZYZCDFPAGEO-GJZGRUSLSA-N 1 2 320.477 4.457 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1C[C@H](C)OC2(CCCCC2)C1 ZINC000653905834 1047432888 /nfs/dbraw/zinc/43/28/88/1047432888.db2.gz JIHZYZCDFPAGEO-GJZGRUSLSA-N 1 2 320.477 4.457 20 0 DIADLO CCn1c[nH+]cc1CNc1cccc(OCc2ccc(C)cc2)c1 ZINC000841853140 1047459537 /nfs/dbraw/zinc/45/95/37/1047459537.db2.gz WZPYLPQWGDEUMZ-UHFFFAOYSA-N 1 2 321.424 4.403 20 0 DIADLO Clc1nccc(C[N@@H+]2CCSC[C@H]2C2CCC2)c1Cl ZINC000841893113 1047462034 /nfs/dbraw/zinc/46/20/34/1047462034.db2.gz FMRZLCUEDORPSV-LBPRGKRZSA-N 1 2 317.285 4.106 20 0 DIADLO Clc1nccc(C[N@H+]2CCSC[C@H]2C2CCC2)c1Cl ZINC000841893113 1047462040 /nfs/dbraw/zinc/46/20/40/1047462040.db2.gz FMRZLCUEDORPSV-LBPRGKRZSA-N 1 2 317.285 4.106 20 0 DIADLO CCCOc1ccc(C[N@H+](C)Cc2ncc(CC)s2)cc1 ZINC000537621412 1047464291 /nfs/dbraw/zinc/46/42/91/1047464291.db2.gz PFGDIQYJIHVRGA-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO CCCOc1ccc(C[N@@H+](C)Cc2ncc(CC)s2)cc1 ZINC000537621412 1047464293 /nfs/dbraw/zinc/46/42/93/1047464293.db2.gz PFGDIQYJIHVRGA-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCc2c(F)cc(F)cc2C1 ZINC001168332413 1047472597 /nfs/dbraw/zinc/47/25/97/1047472597.db2.gz YNFSYNASSVMJNB-UHFFFAOYSA-N 1 2 305.393 4.245 20 0 DIADLO CSc1ccccc1C[N@H+]1CCc2c(F)cc(F)cc2C1 ZINC001168332413 1047472601 /nfs/dbraw/zinc/47/26/01/1047472601.db2.gz YNFSYNASSVMJNB-UHFFFAOYSA-N 1 2 305.393 4.245 20 0 DIADLO CC(C)C[C@@H]1COCC[N@@H+]1Cc1cnc(C2CCCC2)s1 ZINC000537628257 1047488473 /nfs/dbraw/zinc/48/84/73/1047488473.db2.gz XKGQCNXRTPMDDN-OAHLLOKOSA-N 1 2 308.491 4.048 20 0 DIADLO CC(C)C[C@@H]1COCC[N@H+]1Cc1cnc(C2CCCC2)s1 ZINC000537628257 1047488477 /nfs/dbraw/zinc/48/84/77/1047488477.db2.gz XKGQCNXRTPMDDN-OAHLLOKOSA-N 1 2 308.491 4.048 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1cnc(C2CC2)s1)C1CC1 ZINC000120572111 1047498007 /nfs/dbraw/zinc/49/80/07/1047498007.db2.gz RJXXAZZIDJVOJS-UHFFFAOYSA-N 1 2 302.418 4.324 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1cnc(C2CC2)s1)C1CC1 ZINC000120572111 1047498014 /nfs/dbraw/zinc/49/80/14/1047498014.db2.gz RJXXAZZIDJVOJS-UHFFFAOYSA-N 1 2 302.418 4.324 20 0 DIADLO Cc1ncc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccccn2)s1 ZINC000090399683 1047502606 /nfs/dbraw/zinc/50/26/06/1047502606.db2.gz YZJFFSVCBOMSOT-SCLBCKFNSA-N 1 2 309.438 4.287 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+][C@@H](CN1CCCC1)c1ccccc1 ZINC000120826592 1047503475 /nfs/dbraw/zinc/50/34/75/1047503475.db2.gz BNYBLUMJZFAAKW-PXNSSMCTSA-N 1 2 324.468 4.183 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1cc2ccccc2s1 ZINC000059020266 1047508133 /nfs/dbraw/zinc/50/81/33/1047508133.db2.gz AJNRWBMDDVNIOK-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO Cc1cc(C)c(NC(=O)CCOc2c(C)cccc2C)c(C)[nH+]1 ZINC000121120811 1047512394 /nfs/dbraw/zinc/51/23/94/1047512394.db2.gz LFVVACCAZWRVCX-UHFFFAOYSA-N 1 2 312.413 4.031 20 0 DIADLO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000091081048 1047514807 /nfs/dbraw/zinc/51/48/07/1047514807.db2.gz YAEJBNAUKUJNJQ-CQSZACIVSA-N 1 2 318.490 4.118 20 0 DIADLO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000091081048 1047514820 /nfs/dbraw/zinc/51/48/20/1047514820.db2.gz YAEJBNAUKUJNJQ-CQSZACIVSA-N 1 2 318.490 4.118 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000091990537 1047526833 /nfs/dbraw/zinc/52/68/33/1047526833.db2.gz JAUHWDRLIDHCPU-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000091990537 1047526837 /nfs/dbraw/zinc/52/68/37/1047526837.db2.gz JAUHWDRLIDHCPU-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1ncc(-c2ccccc2)s1 ZINC000091990466 1047527202 /nfs/dbraw/zinc/52/72/02/1047527202.db2.gz RYWVKFHDFKBAFM-AWEZNQCLSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ncc(-c2ccccc2)s1 ZINC000091990466 1047527212 /nfs/dbraw/zinc/52/72/12/1047527212.db2.gz RYWVKFHDFKBAFM-AWEZNQCLSA-N 1 2 309.438 4.398 20 0 DIADLO CC(C)c1ncc(C[N@@H+](Cc2ccco2)C[C@H]2CCCO2)s1 ZINC000092436250 1047533662 /nfs/dbraw/zinc/53/36/62/1047533662.db2.gz LLAFWNDOWKPSFD-OAHLLOKOSA-N 1 2 320.458 4.041 20 0 DIADLO CC(C)c1ncc(C[N@H+](Cc2ccco2)C[C@H]2CCCO2)s1 ZINC000092436250 1047533667 /nfs/dbraw/zinc/53/36/67/1047533667.db2.gz LLAFWNDOWKPSFD-OAHLLOKOSA-N 1 2 320.458 4.041 20 0 DIADLO Cc1cccc(C[N@H+](Cc2cncs2)Cc2ccccn2)c1 ZINC000093086561 1047543632 /nfs/dbraw/zinc/54/36/32/1047543632.db2.gz KOVLKFXIHJOHMN-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2cncs2)Cc2ccccn2)c1 ZINC000093086561 1047543637 /nfs/dbraw/zinc/54/36/37/1047543637.db2.gz KOVLKFXIHJOHMN-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c(F)c1F ZINC001143267679 1047546225 /nfs/dbraw/zinc/54/62/25/1047546225.db2.gz UBEHNAPMDPJBFT-OAHLLOKOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2cccnc2)c(F)c1F ZINC001143267679 1047546228 /nfs/dbraw/zinc/54/62/28/1047546228.db2.gz UBEHNAPMDPJBFT-OAHLLOKOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCCC[C@@](C)(F)C2)c(F)c1F ZINC001143270012 1047546254 /nfs/dbraw/zinc/54/62/54/1047546254.db2.gz VLBSISVGNUBXPY-MRXNPFEDSA-N 1 2 301.352 4.078 20 0 DIADLO CCOc1ccc(C[N@H+]2CCCC[C@@](C)(F)C2)c(F)c1F ZINC001143270012 1047546257 /nfs/dbraw/zinc/54/62/57/1047546257.db2.gz VLBSISVGNUBXPY-MRXNPFEDSA-N 1 2 301.352 4.078 20 0 DIADLO COc1ccc(F)c(C(F)(F)F)c1C[NH+]1CCC(C)(F)CC1 ZINC001143297017 1047549470 /nfs/dbraw/zinc/54/94/70/1047549470.db2.gz WDSKGXNTHJQZBE-UHFFFAOYSA-N 1 2 323.305 4.177 20 0 DIADLO COc1c(F)ccc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c1F ZINC001143320548 1047552398 /nfs/dbraw/zinc/55/23/98/1047552398.db2.gz KKMFEEFYTQZCKR-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(F)ccc(C[N@H+]2CCc3ccccc3[C@@H]2C)c1F ZINC001143320548 1047552406 /nfs/dbraw/zinc/55/24/06/1047552406.db2.gz KKMFEEFYTQZCKR-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO CC[N@@H+](Cc1ccn(-c2cccc(F)c2)n1)Cc1cccs1 ZINC000064555516 1047552570 /nfs/dbraw/zinc/55/25/70/1047552570.db2.gz WWVTWOOOICHAIV-UHFFFAOYSA-N 1 2 315.417 4.095 20 0 DIADLO CC[N@H+](Cc1ccn(-c2cccc(F)c2)n1)Cc1cccs1 ZINC000064555516 1047552576 /nfs/dbraw/zinc/55/25/76/1047552576.db2.gz WWVTWOOOICHAIV-UHFFFAOYSA-N 1 2 315.417 4.095 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cccc(-c3ccccn3)c2)s1 ZINC000093807648 1047552856 /nfs/dbraw/zinc/55/28/56/1047552856.db2.gz DPUSDFBQBBXGJN-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cccc(-c3ccccn3)c2)s1 ZINC000093807648 1047552860 /nfs/dbraw/zinc/55/28/60/1047552860.db2.gz DPUSDFBQBBXGJN-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1ccc(F)c(OC)c1F ZINC001143321672 1047553447 /nfs/dbraw/zinc/55/34/47/1047553447.db2.gz MPDNZJUTHLBKPJ-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1ccc(F)c(OC)c1F ZINC001143321672 1047553454 /nfs/dbraw/zinc/55/34/54/1047553454.db2.gz MPDNZJUTHLBKPJ-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO C[C@H]1CCN(C(=O)CCCC2CCCCC2)C[C@H]1n1cc[nH+]c1 ZINC000122781316 1047556307 /nfs/dbraw/zinc/55/63/07/1047556307.db2.gz SDPGYVAQIANBQQ-FUHWJXTLSA-N 1 2 317.477 4.043 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ncc(C)s1 ZINC000122910807 1047558843 /nfs/dbraw/zinc/55/88/43/1047558843.db2.gz ZNOBEBLFMCOFTA-NSHDSACASA-N 1 2 310.850 4.354 20 0 DIADLO CC(C)C[C@H](c1nc(-c2cccc3[nH]ccc32)no1)n1cc[nH+]c1 ZINC000923826746 1047561488 /nfs/dbraw/zinc/56/14/88/1047561488.db2.gz DCJGRSWCFRTYEL-MRXNPFEDSA-N 1 2 321.384 4.050 20 0 DIADLO Cc1cc(C)c(NC(=O)CCSc2ccccc2)c(C)[nH+]1 ZINC000097040016 1047569495 /nfs/dbraw/zinc/56/94/95/1047569495.db2.gz GDAYWBGLKXQEKX-UHFFFAOYSA-N 1 2 300.427 4.128 20 0 DIADLO CC(C)(C)c1nc(CNc2ccc(-n3cc[nH+]c3)cc2)cs1 ZINC000098171187 1047577610 /nfs/dbraw/zinc/57/76/10/1047577610.db2.gz SVNIJGTYPVFEMI-UHFFFAOYSA-N 1 2 312.442 4.238 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2cccc(O)c2Br)c(C)o1 ZINC000315048131 1047595643 /nfs/dbraw/zinc/59/56/43/1047595643.db2.gz RNHQHNNAOBELMT-SNVBAGLBSA-N 1 2 324.218 4.215 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000477161760 1047601690 /nfs/dbraw/zinc/60/16/90/1047601690.db2.gz JJHVCBJNAOHEMY-CYBMUJFWSA-N 1 2 319.399 4.469 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000477161760 1047601696 /nfs/dbraw/zinc/60/16/96/1047601696.db2.gz JJHVCBJNAOHEMY-CYBMUJFWSA-N 1 2 319.399 4.469 20 0 DIADLO CC(C)N(C(=O)c1c[nH]c2cc[nH+]cc21)[C@@H](C)c1ccccc1 ZINC001152976847 1047618091 /nfs/dbraw/zinc/61/80/91/1047618091.db2.gz FGYUFGJJDPCQGJ-AWEZNQCLSA-N 1 2 307.397 4.175 20 0 DIADLO O=C(CC1CCC1)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000347412925 1047636792 /nfs/dbraw/zinc/63/67/92/1047636792.db2.gz LTSSFMJDDSKQCT-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO CSCc1ccc(NCc2cccc(OC(F)F)c2)[nH+]c1 ZINC001154670153 1047654284 /nfs/dbraw/zinc/65/42/84/1047654284.db2.gz GZQHQOBRHOQQCI-UHFFFAOYSA-N 1 2 310.369 4.158 20 0 DIADLO Cc1ncc(CNc2cc(-c3ccnc(Cl)c3)cc[nH+]2)s1 ZINC001154792205 1047656743 /nfs/dbraw/zinc/65/67/43/1047656743.db2.gz CCIONVVSDPPDAJ-UHFFFAOYSA-N 1 2 316.817 4.174 20 0 DIADLO Cc1cccc2c(C)cc(N[C@H](C)c3nnc4ccccn43)[nH+]c12 ZINC001154807196 1047658077 /nfs/dbraw/zinc/65/80/77/1047658077.db2.gz HUYLLQYKDYBKFO-CQSZACIVSA-N 1 2 317.396 4.067 20 0 DIADLO Cc1cccc2c(C)cc(N[C@@H](C)c3nnc4ccccn43)[nH+]c12 ZINC001154807195 1047658324 /nfs/dbraw/zinc/65/83/24/1047658324.db2.gz HUYLLQYKDYBKFO-AWEZNQCLSA-N 1 2 317.396 4.067 20 0 DIADLO COc1ccc(C2([NH2+]Cc3ncc(-c4ccccc4)o3)CC2)cc1 ZINC000538159894 1047660391 /nfs/dbraw/zinc/66/03/91/1047660391.db2.gz KDFFNRNNQKIEOQ-UHFFFAOYSA-N 1 2 320.392 4.129 20 0 DIADLO COC(=O)CCCCCCNc1cc(-c2ccccc2)cc[nH+]1 ZINC001155004536 1047665167 /nfs/dbraw/zinc/66/51/67/1047665167.db2.gz ULAMQQXKWHZOHC-UHFFFAOYSA-N 1 2 312.413 4.284 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)CCCSC(C)(C)C)[nH+]c1C ZINC001155173810 1047670191 /nfs/dbraw/zinc/67/01/91/1047670191.db2.gz HWXNAIQDEXGXEE-AWEZNQCLSA-N 1 2 323.506 4.002 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1cnc(Cl)nc1Oc1ccc(F)cc1 ZINC001155181355 1047670710 /nfs/dbraw/zinc/67/07/10/1047670710.db2.gz FLOBAXOWOSNXOW-UHFFFAOYSA-N 1 2 322.771 4.497 20 0 DIADLO CCOC(=O)c1cnc(Cl)c(NC(=[NH2+])C(C)(C)C)c1Cl ZINC001155181280 1047671066 /nfs/dbraw/zinc/67/10/66/1047671066.db2.gz NIIUMLGIRLMSMO-UHFFFAOYSA-N 1 2 318.204 4.000 20 0 DIADLO Cc1nc2sc3c(c2c(NC(=[NH2+])C(C)(C)C)n1)CCCC3 ZINC001155180225 1047670950 /nfs/dbraw/zinc/67/09/50/1047670950.db2.gz MQACWYMHEOEJAI-UHFFFAOYSA-N 1 2 302.447 4.314 20 0 DIADLO COC(=O)/C=C/c1cc(C)c[nH+]c1NCc1ccc(C(C)C)cc1 ZINC001155947900 1047692133 /nfs/dbraw/zinc/69/21/33/1047692133.db2.gz GBXRTICKRISKDX-MDZDMXLPSA-N 1 2 324.424 4.312 20 0 DIADLO C[C@@H]1Cc2ccccc2[C@@H]1Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000538635972 1047693043 /nfs/dbraw/zinc/69/30/43/1047693043.db2.gz VRHSXCUOEGJCBR-BFUOFWGJSA-N 1 2 307.372 4.357 20 0 DIADLO C[C@H](Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1cc(F)ccc1F ZINC000538633780 1047693152 /nfs/dbraw/zinc/69/31/52/1047693152.db2.gz KJPPJTBYVQWDTA-NSHDSACASA-N 1 2 317.314 4.463 20 0 DIADLO C[C@@H]1Cc2ccccc2[C@H]1Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000538635980 1047693263 /nfs/dbraw/zinc/69/32/63/1047693263.db2.gz VRHSXCUOEGJCBR-YJYMSZOUSA-N 1 2 307.372 4.357 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccc2c(c1)COC2 ZINC000538637724 1047693695 /nfs/dbraw/zinc/69/36/95/1047693695.db2.gz JWSYGSSZUUGCPI-OAHLLOKOSA-N 1 2 323.440 4.275 20 0 DIADLO CSc1cc[nH+]c(N[C@@H](c2ccccc2)c2ccncc2)c1 ZINC001156095066 1047699791 /nfs/dbraw/zinc/69/97/91/1047699791.db2.gz HXPVRHJMOZBOBC-SFHVURJKSA-N 1 2 307.422 4.400 20 0 DIADLO Cc1ccoc1C[N@H+]1C[C@@H](c2ccccc2Cl)OC[C@@H]1C ZINC000538729394 1047701934 /nfs/dbraw/zinc/70/19/34/1047701934.db2.gz MBKQMXPFOAUJDS-GUYCJALGSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccoc1C[N@@H+]1C[C@@H](c2ccccc2Cl)OC[C@@H]1C ZINC000538729394 1047701939 /nfs/dbraw/zinc/70/19/39/1047701939.db2.gz MBKQMXPFOAUJDS-GUYCJALGSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc3c(s2)CCCC3)cc1F ZINC000538729475 1047702534 /nfs/dbraw/zinc/70/25/34/1047702534.db2.gz SFBPCNUILSOVNY-UHFFFAOYSA-N 1 2 304.434 4.101 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc3c(s2)CCCC3)cc1F ZINC000538729475 1047702542 /nfs/dbraw/zinc/70/25/42/1047702542.db2.gz SFBPCNUILSOVNY-UHFFFAOYSA-N 1 2 304.434 4.101 20 0 DIADLO CC(C)C[C@H]1COCC[N@@H+]1Cc1cnc(-c2cccs2)s1 ZINC000538734636 1047703056 /nfs/dbraw/zinc/70/30/56/1047703056.db2.gz SPYVETCPBIBWIS-ZDUSSCGKSA-N 1 2 322.499 4.119 20 0 DIADLO CC(C)C[C@H]1COCC[N@H+]1Cc1cnc(-c2cccs2)s1 ZINC000538734636 1047703063 /nfs/dbraw/zinc/70/30/63/1047703063.db2.gz SPYVETCPBIBWIS-ZDUSSCGKSA-N 1 2 322.499 4.119 20 0 DIADLO c1cc2c(s1)C[N@H+](Cc1csc(-c3ccccc3)n1)CC2 ZINC000538735849 1047704799 /nfs/dbraw/zinc/70/47/99/1047704799.db2.gz HSYAWAFOQBCAHS-UHFFFAOYSA-N 1 2 312.463 4.430 20 0 DIADLO c1cc2c(s1)C[N@@H+](Cc1csc(-c3ccccc3)n1)CC2 ZINC000538735849 1047704801 /nfs/dbraw/zinc/70/48/01/1047704801.db2.gz HSYAWAFOQBCAHS-UHFFFAOYSA-N 1 2 312.463 4.430 20 0 DIADLO COC(=O)c1ccc2cc[nH+]c(NC/C=C/c3ccccc3)c2c1 ZINC001156463454 1047714133 /nfs/dbraw/zinc/71/41/33/1047714133.db2.gz CFRASDGKVRHYBI-VMPITWQZSA-N 1 2 318.376 4.147 20 0 DIADLO Clc1ccc2c(cc[nH+]c2NCC2(c3ccccc3)COC2)c1 ZINC001156586254 1047718508 /nfs/dbraw/zinc/71/85/08/1047718508.db2.gz CTRUFIMJABQRQM-UHFFFAOYSA-N 1 2 324.811 4.268 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H](C)c3ccc(F)cn3)c(C)cc2c1 ZINC001156676209 1047720085 /nfs/dbraw/zinc/72/00/85/1047720085.db2.gz LFVRGGYLMOKVJH-LBPRGKRZSA-N 1 2 311.360 4.259 20 0 DIADLO Clc1ccc([C@@H]2COCCN2c2cccc(C3CC3)[nH+]2)cc1 ZINC001156731583 1047721300 /nfs/dbraw/zinc/72/13/00/1047721300.db2.gz NUJSKKFZXYJFDA-KRWDZBQOSA-N 1 2 314.816 4.190 20 0 DIADLO CC(C)C[C@@H](C(=O)N[C@H](C)c1ccccc1Cl)n1cc[nH+]c1 ZINC001156782402 1047723018 /nfs/dbraw/zinc/72/30/18/1047723018.db2.gz JRZKAJRHIFEUFX-CJNGLKHVSA-N 1 2 319.836 4.001 20 0 DIADLO Cc1cc(NCc2nccc3ccccc32)nc(C(C)(C)C)[nH+]1 ZINC001156869889 1047725234 /nfs/dbraw/zinc/72/52/34/1047725234.db2.gz OQTRUECLGQWMHL-UHFFFAOYSA-N 1 2 306.413 4.243 20 0 DIADLO Cc1cc(N2CCC[C@@H]2c2c(F)cccc2F)nc(C2CC2)[nH+]1 ZINC001156948494 1047729955 /nfs/dbraw/zinc/72/99/55/1047729955.db2.gz URSFCXVHSLOINQ-OAHLLOKOSA-N 1 2 315.367 4.282 20 0 DIADLO Cc1nc(N2CCC[C@H]2c2c(F)cccc2F)c(C)c(C)[nH+]1 ZINC001156948367 1047730144 /nfs/dbraw/zinc/73/01/44/1047730144.db2.gz SGDCHXZTOHHDOO-HNNXBMFYSA-N 1 2 303.356 4.022 20 0 DIADLO CCC[C@H]([NH2+]Cc1nnc(-c2ccc(F)cc2)[nH]1)c1ccccc1 ZINC000539120773 1047737685 /nfs/dbraw/zinc/73/76/85/1047737685.db2.gz FVPXXHXMQLXBTN-KRWDZBQOSA-N 1 2 324.403 4.242 20 0 DIADLO C[C@H]([NH2+]Cc1nc2ccccc2o1)c1ccccc1OC(F)F ZINC000539245287 1047744006 /nfs/dbraw/zinc/74/40/06/1047744006.db2.gz DBBCFGXQIBENTO-NSHDSACASA-N 1 2 318.323 4.280 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2ccc(OCC3CC3)c(F)c2)o1 ZINC000539327953 1047748488 /nfs/dbraw/zinc/74/84/88/1047748488.db2.gz LBHWRXVLBMLMRH-LBPRGKRZSA-N 1 2 318.392 4.016 20 0 DIADLO Cc1nc(N[C@@H](c2ccccn2)C(F)(F)F)cc(C(C)C)[nH+]1 ZINC001157683647 1047749003 /nfs/dbraw/zinc/74/90/03/1047749003.db2.gz ARCRCMDARARUTO-AWEZNQCLSA-N 1 2 310.323 4.019 20 0 DIADLO FC(F)(F)[C@H](Nc1[nH+]ccc2ccccc21)c1ccccn1 ZINC001157684857 1047749038 /nfs/dbraw/zinc/74/90/38/1047749038.db2.gz RAEDUEBHJYPQIA-CQSZACIVSA-N 1 2 303.287 4.345 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+][C@H](C)c1cn(C(C)C)nn1 ZINC000924692738 1047749227 /nfs/dbraw/zinc/74/92/27/1047749227.db2.gz RJFUHIPFKLDDAI-HUUCEWRRSA-N 1 2 316.449 4.058 20 0 DIADLO Cc1nc(N[C@H](c2ccccn2)C(F)(F)F)cc(C(C)C)[nH+]1 ZINC001157683648 1047749312 /nfs/dbraw/zinc/74/93/12/1047749312.db2.gz ARCRCMDARARUTO-CQSZACIVSA-N 1 2 310.323 4.019 20 0 DIADLO CSCc1cc[nH+]c(N[C@@H](c2ccccn2)C(F)(F)F)c1 ZINC001157686051 1047749362 /nfs/dbraw/zinc/74/93/62/1047749362.db2.gz JRKBZPRPYLNEKX-ZDUSSCGKSA-N 1 2 313.348 4.055 20 0 DIADLO CCSc1cc[nH+]c(N2CCC(c3ccc(N)cc3)CC2)c1 ZINC001157707223 1047749904 /nfs/dbraw/zinc/74/99/04/1047749904.db2.gz QQZVNJOIAHGMFZ-UHFFFAOYSA-N 1 2 313.470 4.160 20 0 DIADLO CSCc1ccc(NCc2ccc(F)c(Cl)c2F)[nH+]c1 ZINC001157710916 1047750570 /nfs/dbraw/zinc/75/05/70/1047750570.db2.gz LRNZBGBVTXUPHZ-UHFFFAOYSA-N 1 2 314.788 4.488 20 0 DIADLO COc1ccc(C2=CCN(c3cc(SC)cc[nH+]3)CC2)cc1 ZINC001157732985 1047751563 /nfs/dbraw/zinc/75/15/63/1047751563.db2.gz DDEYNHLELWGNDI-UHFFFAOYSA-N 1 2 312.438 4.106 20 0 DIADLO Cc1cc(N2CCC3(CCOC3(C)C)CC2)[nH+]c2ccccc12 ZINC001157797630 1047755248 /nfs/dbraw/zinc/75/52/48/1047755248.db2.gz GJZFFZLOHAXMHQ-UHFFFAOYSA-N 1 2 310.441 4.329 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1ccc2c(c1)CCC2 ZINC000478015388 1047762911 /nfs/dbraw/zinc/76/29/11/1047762911.db2.gz JFWIIRAAWIJDHG-UHFFFAOYSA-N 1 2 317.392 4.126 20 0 DIADLO COc1ccc2[nH+]c(N[C@H](C)c3ccc(C)cn3)c(C)cc2c1 ZINC001158012226 1047767607 /nfs/dbraw/zinc/76/76/07/1047767607.db2.gz JQRUGQWHRPYDNT-CQSZACIVSA-N 1 2 307.397 4.428 20 0 DIADLO Cc1cccc2c(C)cc(NCCc3cn4ccccc4n3)[nH+]c12 ZINC001158142571 1047769945 /nfs/dbraw/zinc/76/99/45/1047769945.db2.gz PVRAUIGHAQVGSD-UHFFFAOYSA-N 1 2 316.408 4.154 20 0 DIADLO Cc1cccc2c(C)cc(NCCC(=O)Nc3ccccc3)[nH+]c12 ZINC001158118399 1047770025 /nfs/dbraw/zinc/77/00/25/1047770025.db2.gz QMTMFQHWHDJSTK-UHFFFAOYSA-N 1 2 319.408 4.292 20 0 DIADLO Cc1cccn2cc(CNc3[nH+]ccc4cc(Cl)ccc43)nc12 ZINC001158154513 1047770851 /nfs/dbraw/zinc/77/08/51/1047770851.db2.gz QNZVZLHUMWFUKK-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO Cc1nc(NCc2c(Cl)cncc2Cl)cc(C(C)C)[nH+]1 ZINC001158302015 1047773963 /nfs/dbraw/zinc/77/39/63/1047773963.db2.gz XLOIGRSNOBMBEJ-UHFFFAOYSA-N 1 2 311.216 4.222 20 0 DIADLO Cc1cc(N[C@@H](C2CCC2)C(F)(F)F)nc(C(C)(C)C)[nH+]1 ZINC001158401702 1047779127 /nfs/dbraw/zinc/77/91/27/1047779127.db2.gz UPMLEEDAVSVZSW-LBPRGKRZSA-N 1 2 301.356 4.225 20 0 DIADLO Cc1[nH]c(=O)c(CNc2cc3ccccc3c[nH+]2)c2c1CCCC2 ZINC001158493518 1047786660 /nfs/dbraw/zinc/78/66/60/1047786660.db2.gz XOJWZSFWIMOFKT-UHFFFAOYSA-N 1 2 319.408 4.135 20 0 DIADLO COc1c[nH+]c(N[C@H](CCO)c2cccc3ccccc32)c(C)c1 ZINC001158506456 1047787517 /nfs/dbraw/zinc/78/75/17/1047787517.db2.gz QKAGYSFGSMPFFH-LJQANCHMSA-N 1 2 322.408 4.087 20 0 DIADLO COc1ccc2ccc(NC[C@H](C)c3ccc(O)cc3)[nH+]c2c1 ZINC001158605598 1047790006 /nfs/dbraw/zinc/79/00/06/1047790006.db2.gz ALKQLFKMJWWYRH-ZDUSSCGKSA-N 1 2 308.381 4.165 20 0 DIADLO COc1ccc2ccc(NC[C@@H](C)c3ccc(O)cc3)[nH+]c2c1 ZINC001158605597 1047790291 /nfs/dbraw/zinc/79/02/91/1047790291.db2.gz ALKQLFKMJWWYRH-CYBMUJFWSA-N 1 2 308.381 4.165 20 0 DIADLO c1cc(OCC2CC2)ccc1CNc1ccc(N2CCCC2)[nH+]c1 ZINC000478579373 1047798360 /nfs/dbraw/zinc/79/83/60/1047798360.db2.gz KQISGPGEFKMXEZ-UHFFFAOYSA-N 1 2 323.440 4.083 20 0 DIADLO Cc1ccn2cc(CN(C)c3cc(C)c4ccccc4[nH+]3)nc2c1 ZINC001158854536 1047801185 /nfs/dbraw/zinc/80/11/85/1047801185.db2.gz NLMZFATZSWUYKS-UHFFFAOYSA-N 1 2 316.408 4.136 20 0 DIADLO CSc1cc[nH+]c(NCc2ccc(-c3ccccn3)cc2)c1 ZINC001158911480 1047804178 /nfs/dbraw/zinc/80/41/78/1047804178.db2.gz IEFLLVFAYYNIEQ-UHFFFAOYSA-N 1 2 307.422 4.478 20 0 DIADLO COc1cc(C)c[nH+]c1N1Cc2nc(-c3ccccc3)sc2C1 ZINC001158984754 1047806545 /nfs/dbraw/zinc/80/65/45/1047806545.db2.gz BKVLGZBKYCYHJM-UHFFFAOYSA-N 1 2 323.421 4.042 20 0 DIADLO C=Cc1ccc(NCC[C@@H]2CCc3ccc4c(c32)CCO4)[nH+]c1 ZINC001159080633 1047811105 /nfs/dbraw/zinc/81/11/05/1047811105.db2.gz OJJHMFPLSZTPAW-INIZCTEOSA-N 1 2 306.409 4.192 20 0 DIADLO Nc1cc(Cl)[nH+]c(NCc2nc(-c3ccccc3)cs2)c1 ZINC001159211449 1047821139 /nfs/dbraw/zinc/82/11/39/1047821139.db2.gz WLPLXHXEBKLCLE-UHFFFAOYSA-N 1 2 316.817 4.053 20 0 DIADLO COc1cc(Nc2ccc(N)[nH+]c2)ccc1Oc1ccccc1 ZINC001159282175 1047826755 /nfs/dbraw/zinc/82/67/55/1047826755.db2.gz QMCJUFAGXSXIIN-UHFFFAOYSA-N 1 2 307.353 4.208 20 0 DIADLO Nc1ccc(Nc2cc(F)cc(C(F)(F)F)c2Cl)c[nH+]1 ZINC001159282128 1047827327 /nfs/dbraw/zinc/82/73/27/1047827327.db2.gz OECMWHHYRSAJSA-UHFFFAOYSA-N 1 2 305.662 4.219 20 0 DIADLO FC(F)(F)c1ccccc1CC=Nc1cc([C@H]2CCC[NH2+]2)no1 ZINC001159305716 1047829157 /nfs/dbraw/zinc/82/91/57/1047829157.db2.gz XZZIGNJMHJGUPX-BUUCAEBMSA-N 1 2 323.318 4.201 20 0 DIADLO CCc1cnc(C[NH2+][C@H](c2cc(F)ccc2F)C(C)C)s1 ZINC000479054734 1047833892 /nfs/dbraw/zinc/83/38/92/1047833892.db2.gz DJAGRHSHPJBKHW-INIZCTEOSA-N 1 2 310.413 4.471 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](c2cc(F)ccc2F)C(C)C)s1 ZINC000479054735 1047833995 /nfs/dbraw/zinc/83/39/95/1047833995.db2.gz DJAGRHSHPJBKHW-MRXNPFEDSA-N 1 2 310.413 4.471 20 0 DIADLO CC(=O)N(C)c1ccc(Nc2ccc([NH+]3CCCC3)cc2)cc1 ZINC001174526719 1047854109 /nfs/dbraw/zinc/85/41/09/1047854109.db2.gz YGTXXRAYSNDLGQ-UHFFFAOYSA-N 1 2 309.413 4.013 20 0 DIADLO CC(=O)c1cccc(Nc2ccc(N3CCCCC3)[nH+]c2)c1C ZINC001174525383 1047855160 /nfs/dbraw/zinc/85/51/60/1047855160.db2.gz WECITSRSUHUSLD-UHFFFAOYSA-N 1 2 309.413 4.327 20 0 DIADLO c1c[nH+]c(Nc2ccc(N3CCCC3)cc2)c(N2CCCC2)c1 ZINC001174526844 1047857820 /nfs/dbraw/zinc/85/78/20/1047857820.db2.gz AJUFXLHXVBILNL-UHFFFAOYSA-N 1 2 308.429 4.026 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+]Cc1c(Cl)cccc1OC ZINC000479289867 1047860885 /nfs/dbraw/zinc/86/08/85/1047860885.db2.gz WTDZOQKIERYNPZ-LBPRGKRZSA-N 1 2 304.821 4.157 20 0 DIADLO CNc1ncc2cc(Nc3c(C)cc[nH+]c3C(C)C)ccc2n1 ZINC001174531777 1047862137 /nfs/dbraw/zinc/86/21/37/1047862137.db2.gz FNRPSVDYEASFSD-UHFFFAOYSA-N 1 2 307.401 4.242 20 0 DIADLO c1cc(-c2cccc(Nc3ccc(N4CCCCC4)[nH+]c3)c2)n[nH]1 ZINC001174506594 1047870583 /nfs/dbraw/zinc/87/05/83/1047870583.db2.gz RZFFRSVEUVAVIZ-UHFFFAOYSA-N 1 2 319.412 4.206 20 0 DIADLO COc1cccc(C[NH2+][C@H](CCc2ccccc2)C(F)F)c1C ZINC001182990828 1047873315 /nfs/dbraw/zinc/87/33/15/1047873315.db2.gz ULCNAHHLADCOJO-QGZVFWFLSA-N 1 2 319.395 4.360 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2Cc2c(F)cccc2Cl)[nH+]c1C ZINC001197710643 1047873311 /nfs/dbraw/zinc/87/33/11/1047873311.db2.gz LEZYPHXSYMUMNO-OAHLLOKOSA-N 1 2 307.800 4.156 20 0 DIADLO Clc1ccc2c(cc[nH+]c2NCc2cccc3ccnn32)c1 ZINC001159613395 1047881880 /nfs/dbraw/zinc/88/18/80/1047881880.db2.gz OKIXIHMAMRZNPT-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO Cc1noc2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc12 ZINC001174522964 1047884894 /nfs/dbraw/zinc/88/48/94/1047884894.db2.gz FNJXOADCTZWGBP-UHFFFAOYSA-N 1 2 308.385 4.265 20 0 DIADLO CC(=O)c1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)c(F)c1 ZINC001174523588 1047885292 /nfs/dbraw/zinc/88/52/92/1047885292.db2.gz PVSVLVKFRUOAIY-UHFFFAOYSA-N 1 2 313.376 4.157 20 0 DIADLO Cn1c(Nc2ccc(N3CCCCC3)[nH+]c2)cc2ccccc21 ZINC001174521953 1047885667 /nfs/dbraw/zinc/88/56/67/1047885667.db2.gz CEHSWNDQTZYXIH-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO c1cc(Nc2ccc(N3CCCCC3)[nH+]c2)n(-c2ccccc2)n1 ZINC001174523004 1047885728 /nfs/dbraw/zinc/88/57/28/1047885728.db2.gz SVPYVBVBSRSGQK-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO c1cc2c(c(Nc3ccc(N4CCCCC4)[nH+]c3)c1)OCCC2 ZINC001174523231 1047885853 /nfs/dbraw/zinc/88/58/53/1047885853.db2.gz HBDLTUJDAGNUKO-UHFFFAOYSA-N 1 2 309.413 4.141 20 0 DIADLO CC1(C)C[C@@]1([NH2+]Cc1ccc(O)c(F)c1F)c1ccccc1 ZINC001183065172 1047885975 /nfs/dbraw/zinc/88/59/75/1047885975.db2.gz HRHWGASWKFIRIC-GOSISDBHSA-N 1 2 303.352 4.085 20 0 DIADLO CC(=O)c1ccc(F)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174523948 1047886973 /nfs/dbraw/zinc/88/69/73/1047886973.db2.gz ZLVLRZCLVVERPN-UHFFFAOYSA-N 1 2 313.376 4.157 20 0 DIADLO Cc1cc2c(cccc2Nc2ccc(N3CCCCC3)[nH+]c2)nn1 ZINC001174524573 1047888119 /nfs/dbraw/zinc/88/81/19/1047888119.db2.gz OHTIIXQQUFQWID-UHFFFAOYSA-N 1 2 319.412 4.067 20 0 DIADLO Cc1nn(C)c2cc(Nc3ccc(N4CCCCC4)[nH+]c3)ccc12 ZINC001174523849 1047888230 /nfs/dbraw/zinc/88/82/30/1047888230.db2.gz VKUMKLTUVILDNE-UHFFFAOYSA-N 1 2 321.428 4.011 20 0 DIADLO CC(C)(O)c1ccccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174524118 1047888922 /nfs/dbraw/zinc/88/89/22/1047888922.db2.gz FFMGREPHFCAWMI-UHFFFAOYSA-N 1 2 311.429 4.043 20 0 DIADLO COCc1csc(C[N@H+](C)Cc2nc3ccccc3s2)c1 ZINC000667488116 1047889266 /nfs/dbraw/zinc/88/92/66/1047889266.db2.gz TXOYUGOEQFNCRO-UHFFFAOYSA-N 1 2 318.467 4.136 20 0 DIADLO COCc1csc(C[N@@H+](C)Cc2nc3ccccc3s2)c1 ZINC000667488116 1047889282 /nfs/dbraw/zinc/88/92/82/1047889282.db2.gz TXOYUGOEQFNCRO-UHFFFAOYSA-N 1 2 318.467 4.136 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H](C)c3cccc(N)c3)cc(C)c2c1 ZINC001159638752 1047891720 /nfs/dbraw/zinc/89/17/20/1047891720.db2.gz SGNINQVLIFJIOI-ZDUSSCGKSA-N 1 2 307.397 4.307 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1ccnn1C1CCC1 ZINC000924721629 1047892320 /nfs/dbraw/zinc/89/23/20/1047892320.db2.gz PDRPIYCGGXHPOT-VXGBXAGGSA-N 1 2 305.372 4.298 20 0 DIADLO COc1cc(Nc2ccc[nH+]c2N2CCCCC2)cc(F)c1F ZINC001174580349 1047892796 /nfs/dbraw/zinc/89/27/96/1047892796.db2.gz JHXJRVLCHIPHOD-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1cc(F)ccc1F ZINC000927106685 1047897264 /nfs/dbraw/zinc/89/72/64/1047897264.db2.gz BXJAHMXPNRMCOU-GOSISDBHSA-N 1 2 319.399 4.063 20 0 DIADLO CC(C)C(=O)Nc1ccc(Nc2[nH+]cccc2N2CCCC2)cc1 ZINC001197962041 1047909316 /nfs/dbraw/zinc/90/93/16/1047909316.db2.gz LDNVHJAVNJRKDF-UHFFFAOYSA-N 1 2 324.428 4.020 20 0 DIADLO Fc1cc(Nc2cccn3cc[nH+]c23)ccc1OC(F)(F)F ZINC001213019049 1047925391 /nfs/dbraw/zinc/92/53/91/1047925391.db2.gz FACDNIJRBOSRQF-UHFFFAOYSA-N 1 2 311.238 4.116 20 0 DIADLO COc1c(F)ccc(F)c1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174660753 1047938978 /nfs/dbraw/zinc/93/89/78/1047938978.db2.gz WTICXCOQSNYHKZ-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+]1CCc2ccsc2C1 ZINC001198397624 1047957435 /nfs/dbraw/zinc/95/74/35/1047957435.db2.gz QRYNVAMYJSHDCM-UHFFFAOYSA-N 1 2 307.846 4.359 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+]1CCc2ccsc2C1 ZINC001198397624 1047957448 /nfs/dbraw/zinc/95/74/48/1047957448.db2.gz QRYNVAMYJSHDCM-UHFFFAOYSA-N 1 2 307.846 4.359 20 0 DIADLO CC(C)(C)c1ccc(NC(=S)Nc2cccc3[nH+]ccn32)cc1 ZINC001198457811 1047958438 /nfs/dbraw/zinc/95/84/38/1047958438.db2.gz SNKOZPJTBMKQBX-UHFFFAOYSA-N 1 2 324.453 4.441 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)[C@H]2CC[N@@H+]2Cc2ccccc2)cc1 ZINC001183745274 1047963503 /nfs/dbraw/zinc/96/35/03/1047963503.db2.gz QZCWTAIVCNTODM-OXJNMPFZSA-N 1 2 322.452 4.413 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)[C@H]2CC[N@H+]2Cc2ccccc2)cc1 ZINC001183745274 1047963515 /nfs/dbraw/zinc/96/35/15/1047963515.db2.gz QZCWTAIVCNTODM-OXJNMPFZSA-N 1 2 322.452 4.413 20 0 DIADLO CC(C)(C)c1ccc(NC(=S)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001198474584 1047965341 /nfs/dbraw/zinc/96/53/41/1047965341.db2.gz YOLXXKVNOMHITD-UHFFFAOYSA-N 1 2 324.453 4.441 20 0 DIADLO Nc1nc2cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)ccc2s1 ZINC001160005495 1047966586 /nfs/dbraw/zinc/96/65/86/1047966586.db2.gz IXCHKKADBDHAHO-UHFFFAOYSA-N 1 2 307.382 4.012 20 0 DIADLO COc1cccc([C@H](C)CC(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)c1 ZINC000479772897 1047966864 /nfs/dbraw/zinc/96/68/64/1047966864.db2.gz JPEYVPYUGLZOPE-GFCCVEGCSA-N 1 2 323.396 4.012 20 0 DIADLO CCCCCC[N@@H+](Cc1ccco1)[C@@H](C)c1nc(C)cc(=O)[nH]1 ZINC001198518337 1047971144 /nfs/dbraw/zinc/97/11/44/1047971144.db2.gz YGESDKIHJWSSET-HNNXBMFYSA-N 1 2 317.433 4.227 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(NC(=O)OC(C)(C)C)cc2)cc1N ZINC001160029307 1047974251 /nfs/dbraw/zinc/97/42/51/1047974251.db2.gz HDRXQRPBMFMQOU-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO COC(=O)c1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)s1 ZINC000553986878 1047978256 /nfs/dbraw/zinc/97/82/56/1047978256.db2.gz GFQUBEQSIQGRFR-AWEZNQCLSA-N 1 2 321.467 4.179 20 0 DIADLO COC(=O)c1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)s1 ZINC000553986878 1047978264 /nfs/dbraw/zinc/97/82/64/1047978264.db2.gz GFQUBEQSIQGRFR-AWEZNQCLSA-N 1 2 321.467 4.179 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CCO[C@H](c4cccs4)C3)[nH]c2c1 ZINC000667562209 1047979354 /nfs/dbraw/zinc/97/93/54/1047979354.db2.gz WLNULKNULHUZBK-KRWDZBQOSA-N 1 2 312.438 4.111 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CCO[C@H](c4cccs4)C3)[nH]c2c1 ZINC000667562209 1047979360 /nfs/dbraw/zinc/97/93/60/1047979360.db2.gz WLNULKNULHUZBK-KRWDZBQOSA-N 1 2 312.438 4.111 20 0 DIADLO Cn1c(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)nc2ccccc21 ZINC000553991408 1047979997 /nfs/dbraw/zinc/97/99/97/1047979997.db2.gz IDEITWTVWAWOHS-KRWDZBQOSA-N 1 2 311.454 4.218 20 0 DIADLO Cn1c(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)nc2ccccc21 ZINC000553991408 1047980011 /nfs/dbraw/zinc/98/00/11/1047980011.db2.gz IDEITWTVWAWOHS-KRWDZBQOSA-N 1 2 311.454 4.218 20 0 DIADLO CCOc1c(Cl)cccc1C[NH2+]Cc1nc2ccccc2o1 ZINC001183909028 1047981405 /nfs/dbraw/zinc/98/14/05/1047981405.db2.gz JQMOGQAYJYPJLJ-UHFFFAOYSA-N 1 2 316.788 4.170 20 0 DIADLO C[C@@H]1C[C@H](C(C)(C)C)CC[N@@H+]1CC(=O)Nc1c(F)cccc1F ZINC000553987972 1047983768 /nfs/dbraw/zinc/98/37/68/1047983768.db2.gz UUPXNRRITUCWLM-CHWSQXEVSA-N 1 2 324.415 4.050 20 0 DIADLO C[C@@H]1C[C@H](C(C)(C)C)CC[N@H+]1CC(=O)Nc1c(F)cccc1F ZINC000553987972 1047983775 /nfs/dbraw/zinc/98/37/75/1047983775.db2.gz UUPXNRRITUCWLM-CHWSQXEVSA-N 1 2 324.415 4.050 20 0 DIADLO CCc1ccc([C@H](C)NC[C@@H](c2cccs2)[NH+]2CCCC2)o1 ZINC000479847648 1047987307 /nfs/dbraw/zinc/98/73/07/1047987307.db2.gz CJMMZMUARBJFJZ-HOCLYGCPSA-N 1 2 318.486 4.391 20 0 DIADLO Oc1cccc(Nc2cc[nH+]c3cc(Br)ccc23)c1 ZINC001174888700 1047995573 /nfs/dbraw/zinc/99/55/73/1047995573.db2.gz YKSQFYGKKKLGPO-UHFFFAOYSA-N 1 2 315.170 4.447 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(Oc3cccnc3)cc2)c[nH+]1 ZINC001174849834 1047998731 /nfs/dbraw/zinc/99/87/31/1047998731.db2.gz XPAYYSUXPOBJNH-UHFFFAOYSA-N 1 2 320.396 4.469 20 0 DIADLO COc1ccc2ccc(NCc3cc(F)cc(OC)c3)[nH+]c2c1 ZINC001160214900 1048001207 /nfs/dbraw/zinc/00/12/07/1048001207.db2.gz LJWFYDUFRZFOHQ-UHFFFAOYSA-N 1 2 312.344 4.003 20 0 DIADLO c1sc(C2CCCCC2)nc1C[N@@H+]1CCCC[C@@]12CCOC2 ZINC001198770612 1048005049 /nfs/dbraw/zinc/00/50/49/1048005049.db2.gz SDNURLFZFFUSDK-SFHVURJKSA-N 1 2 320.502 4.336 20 0 DIADLO c1sc(C2CCCCC2)nc1C[N@H+]1CCCC[C@@]12CCOC2 ZINC001198770612 1048005063 /nfs/dbraw/zinc/00/50/63/1048005063.db2.gz SDNURLFZFFUSDK-SFHVURJKSA-N 1 2 320.502 4.336 20 0 DIADLO CC[C@@H](N[C@H](C[NH+](C)C)c1ccc(F)cc1)c1ccc(C)cc1 ZINC000554086868 1048005724 /nfs/dbraw/zinc/00/57/24/1048005724.db2.gz RLJDZXNKWYFFCC-WOJBJXKFSA-N 1 2 314.448 4.478 20 0 DIADLO C[C@@H]([NH2+][C@H](CN(C)C)c1ccc(F)cc1)c1ccc(F)cc1F ZINC000554086569 1048006372 /nfs/dbraw/zinc/00/63/72/1048006372.db2.gz OAGNPFXTKVKKGQ-KZULUSFZSA-N 1 2 322.374 4.057 20 0 DIADLO Oc1ccc2c(c1)CC[N@@H+](Cc1cccc(Cl)c1Cl)C2 ZINC001198830411 1048008751 /nfs/dbraw/zinc/00/87/51/1048008751.db2.gz TYSOQQSZDYJPTR-UHFFFAOYSA-N 1 2 308.208 4.257 20 0 DIADLO Oc1ccc2c(c1)CC[N@H+](Cc1cccc(Cl)c1Cl)C2 ZINC001198830411 1048008765 /nfs/dbraw/zinc/00/87/65/1048008765.db2.gz TYSOQQSZDYJPTR-UHFFFAOYSA-N 1 2 308.208 4.257 20 0 DIADLO Cc1ccc2ncc(C[N@@H+]3CCc4cc(F)cc(F)c4C3)cc2c1 ZINC001198844126 1048009001 /nfs/dbraw/zinc/00/90/01/1048009001.db2.gz FOPNJBXAUMFZOS-UHFFFAOYSA-N 1 2 324.374 4.380 20 0 DIADLO Cc1ccc2ncc(C[N@H+]3CCc4cc(F)cc(F)c4C3)cc2c1 ZINC001198844126 1048009013 /nfs/dbraw/zinc/00/90/13/1048009013.db2.gz FOPNJBXAUMFZOS-UHFFFAOYSA-N 1 2 324.374 4.380 20 0 DIADLO COc1ccc2[nH+]c(NCc3cccc4ncoc43)c(C)cc2c1 ZINC001160250575 1048011211 /nfs/dbraw/zinc/01/12/11/1048011211.db2.gz AYZUFYWQWSMWKB-UHFFFAOYSA-N 1 2 319.364 4.305 20 0 DIADLO CC(C)OC(=O)c1cccc(Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001174915594 1048026994 /nfs/dbraw/zinc/02/69/94/1048026994.db2.gz KEBIXPYHDKBUQO-UHFFFAOYSA-N 1 2 321.380 4.181 20 0 DIADLO COc1cc(F)c(Nc2ccc[nH+]c2N2CCCCC2)cc1F ZINC001174923695 1048032953 /nfs/dbraw/zinc/03/29/53/1048032953.db2.gz NRWPLYXPQBEBEK-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO CCc1cnc(CNc2ccc(Nc3ccccc3)c[nH+]2)s1 ZINC001203194761 1048038220 /nfs/dbraw/zinc/03/82/20/1048038220.db2.gz MUNLDNZHEXPCGH-UHFFFAOYSA-N 1 2 310.426 4.456 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1ccc2occc(=O)c2c1 ZINC001174944558 1048041936 /nfs/dbraw/zinc/04/19/36/1048041936.db2.gz VJWLNIAZFNUYMG-UHFFFAOYSA-N 1 2 308.381 4.439 20 0 DIADLO COc1cc(C)c(CNc2[nH+]c3ccccc3n2C2CC2)c(C)n1 ZINC001184463084 1048044226 /nfs/dbraw/zinc/04/42/26/1048044226.db2.gz VFDAKSASNNESFZ-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1ccc2c(Nc3ccc4occc(=O)c4c3)cccc2[nH+]1 ZINC001174946985 1048045613 /nfs/dbraw/zinc/04/56/13/1048045613.db2.gz SVZCBOBAMBOJQT-UHFFFAOYSA-N 1 2 302.333 4.393 20 0 DIADLO C[C@@](CO)(Nc1[nH+]ccc2cc(Cl)ccc21)c1ccccc1 ZINC001160435734 1048050697 /nfs/dbraw/zinc/05/06/97/1048050697.db2.gz NBQYWRYXFOZOIG-SFHVURJKSA-N 1 2 312.800 4.208 20 0 DIADLO C[C@@H](C[N@@H+]1CCn2c(C3CCCC3)nnc2[C@H]1C)c1ccccc1 ZINC000554288551 1048057147 /nfs/dbraw/zinc/05/71/47/1048057147.db2.gz YFLBKJLXXVSENZ-JKSUJKDBSA-N 1 2 324.472 4.116 20 0 DIADLO C[C@@H](C[N@H+]1CCn2c(C3CCCC3)nnc2[C@H]1C)c1ccccc1 ZINC000554288551 1048057162 /nfs/dbraw/zinc/05/71/62/1048057162.db2.gz YFLBKJLXXVSENZ-JKSUJKDBSA-N 1 2 324.472 4.116 20 0 DIADLO COc1c(C)cc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1C ZINC001174998680 1048063126 /nfs/dbraw/zinc/06/31/26/1048063126.db2.gz YRZQKVXPOPQPNP-UHFFFAOYSA-N 1 2 307.397 4.300 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H](CC(=O)OC)C2CCCCC2)c1 ZINC001160561949 1048065862 /nfs/dbraw/zinc/06/58/62/1048065862.db2.gz OAXCJYVHGDFPNR-HNNXBMFYSA-N 1 2 322.474 4.118 20 0 DIADLO CSCc1cc[nH+]c(N[C@H](c2ccccc2)C2(O)CCC2)c1 ZINC001160544184 1048066044 /nfs/dbraw/zinc/06/60/44/1048066044.db2.gz RPTNPSRHDIUHEC-QGZVFWFLSA-N 1 2 314.454 4.013 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3cccc(Cl)c3C)ccc2[nH+]1 ZINC001184655698 1048074181 /nfs/dbraw/zinc/07/41/81/1048074181.db2.gz QRRFZMLUNAFYLM-UHFFFAOYSA-N 1 2 314.776 4.249 20 0 DIADLO COc1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)c(F)c1F ZINC001175018700 1048074895 /nfs/dbraw/zinc/07/48/95/1048074895.db2.gz BXVJPZGAEVVNLC-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cn1 ZINC000480169243 1048076058 /nfs/dbraw/zinc/07/60/58/1048076058.db2.gz WVHJYZMZRGFBJG-QWRGUYRKSA-N 1 2 308.784 4.295 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3nnc(C)c4ccccc34)c[nH+]c12 ZINC001160686630 1048076916 /nfs/dbraw/zinc/07/69/16/1048076916.db2.gz LBDLRBVHYRJMTE-AWEZNQCLSA-N 1 2 317.396 4.067 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccc(Cl)cn1 ZINC000480174672 1048077345 /nfs/dbraw/zinc/07/73/45/1048077345.db2.gz TWYKJRGZGCKIHH-ZDUSSCGKSA-N 1 2 316.836 4.293 20 0 DIADLO CC[C@H]1C[C@H](CNc2ccc([NH+]3CCCC3)cc2C)CCO1 ZINC001199591590 1048078812 /nfs/dbraw/zinc/07/88/12/1048078812.db2.gz FFPIWOKQLBTIEM-AEFFLSMTSA-N 1 2 302.462 4.212 20 0 DIADLO CC[C@H]1C[C@H](C[NH2+]c2ccc(N3CCCC3)cc2C)CCO1 ZINC001199591590 1048078828 /nfs/dbraw/zinc/07/88/28/1048078828.db2.gz FFPIWOKQLBTIEM-AEFFLSMTSA-N 1 2 302.462 4.212 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3cc4ccsc4cn3)c[nH+]c12 ZINC001160686412 1048078987 /nfs/dbraw/zinc/07/89/87/1048078987.db2.gz FYGSNFVOFPIXOJ-LBPRGKRZSA-N 1 2 308.410 4.426 20 0 DIADLO CCSc1cc[nH+]c(NCc2cc(C)c(OC)cc2C)c1 ZINC001160775316 1048082187 /nfs/dbraw/zinc/08/21/87/1048082187.db2.gz FXEWYTHMLPZOGS-UHFFFAOYSA-N 1 2 302.443 4.431 20 0 DIADLO COc1ccc(Nc2cccn3cc(C)[nH+]c23)cc1C(F)(F)F ZINC001175068575 1048093480 /nfs/dbraw/zinc/09/34/80/1048093480.db2.gz HLXNFPMXMZUTMS-UHFFFAOYSA-N 1 2 321.302 4.414 20 0 DIADLO COc1ccc2ccc(NCc3ccc4onc(C)c4c3)[nH+]c2c1 ZINC001160868864 1048093992 /nfs/dbraw/zinc/09/39/92/1048093992.db2.gz VCELMUMUGLOQMA-UHFFFAOYSA-N 1 2 319.364 4.305 20 0 DIADLO CCc1ccc(CN(c2nc(C)[nH+]c3c2CCCC3)C2CC2)cc1 ZINC001184830843 1048095844 /nfs/dbraw/zinc/09/58/44/1048095844.db2.gz PIALIPTVGUIYIY-UHFFFAOYSA-N 1 2 321.468 4.395 20 0 DIADLO Cc1cc(NCc2nccc(Cl)c2Cl)nc(C(C)C)[nH+]1 ZINC001160932190 1048099966 /nfs/dbraw/zinc/09/99/66/1048099966.db2.gz UUSIJZOJEFIGIS-UHFFFAOYSA-N 1 2 311.216 4.222 20 0 DIADLO Cc1nc(N2CCC[C@H]2CCc2ccccc2)c2c([nH+]1)CCCC2 ZINC001184928531 1048105851 /nfs/dbraw/zinc/10/58/51/1048105851.db2.gz ZLIPZUZHTRZIHU-SFHVURJKSA-N 1 2 321.468 4.265 20 0 DIADLO Fc1cc(Cl)c(Nc2ccc[nH+]c2N2CCCC2)cc1F ZINC001184967980 1048107090 /nfs/dbraw/zinc/10/70/90/1048107090.db2.gz IDKIRPMAVWWFGF-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO CC(C)(C)c1ccc(N)c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001184968949 1048107472 /nfs/dbraw/zinc/10/74/72/1048107472.db2.gz QUEGAKDYUPKYQG-UHFFFAOYSA-N 1 2 310.445 4.305 20 0 DIADLO Nc1cc(Cl)c(Cl)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001184968579 1048108256 /nfs/dbraw/zinc/10/82/56/1048108256.db2.gz QJCPTRRRNCOWBJ-UHFFFAOYSA-N 1 2 323.227 4.314 20 0 DIADLO O=c1[nH]ccc2oc(C[NH2+]Cc3c(Cl)cccc3Cl)cc21 ZINC001199822650 1048109106 /nfs/dbraw/zinc/10/91/06/1048109106.db2.gz JCQJOKYJAZDERU-UHFFFAOYSA-N 1 2 323.179 4.130 20 0 DIADLO Cc1cccc(-c2cc(Nc3cccc4[nH+]c[nH]c43)n(C)n2)c1 ZINC001213030868 1048114657 /nfs/dbraw/zinc/11/46/57/1048114657.db2.gz VINWFSUAEQUELC-UHFFFAOYSA-N 1 2 303.369 4.015 20 0 DIADLO Cc1cc([C@H]([NH2+]Cc2ncc(C(C)C)o2)C2CC2)ccc1F ZINC000776032657 1048114785 /nfs/dbraw/zinc/11/47/85/1048114785.db2.gz ZNSVOZVSUISKFB-GOSISDBHSA-N 1 2 302.393 4.486 20 0 DIADLO Oc1cc(F)c(Nc2ccc([NH+]3CCCCC3)cc2)c(F)c1 ZINC001175100386 1048115969 /nfs/dbraw/zinc/11/59/69/1048115969.db2.gz RIEANBKLXIRBPY-UHFFFAOYSA-N 1 2 304.340 4.404 20 0 DIADLO O=C(c1ccc(Nc2cccc3[nH+]c[nH]c32)cc1)C(F)(F)F ZINC001213031627 1048119222 /nfs/dbraw/zinc/11/92/22/1048119222.db2.gz JXUYPGRYYQQABK-UHFFFAOYSA-N 1 2 305.259 4.052 20 0 DIADLO Cc1cc(Cl)c(C)c(NC2(c3ccccc3Cl)COC2)[nH+]1 ZINC001161268540 1048119386 /nfs/dbraw/zinc/11/93/86/1048119386.db2.gz ZMJGNZNBVSSONU-UHFFFAOYSA-N 1 2 323.223 4.343 20 0 DIADLO c1ccc(OCC2CC2)c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001185041961 1048122066 /nfs/dbraw/zinc/12/20/66/1048122066.db2.gz AEWMOZKSKJRWEO-UHFFFAOYSA-N 1 2 309.413 4.214 20 0 DIADLO CC(=O)c1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1Cl ZINC001185043304 1048122230 /nfs/dbraw/zinc/12/22/30/1048122230.db2.gz KTVOGUOKXZFZBV-UHFFFAOYSA-N 1 2 315.804 4.281 20 0 DIADLO CCN(CC)C(=O)c1cc(Nc2[nH+]cccc2C)ccc1Cl ZINC001185043889 1048122307 /nfs/dbraw/zinc/12/23/07/1048122307.db2.gz PNYQLFMXKDKTGQ-UHFFFAOYSA-N 1 2 317.820 4.269 20 0 DIADLO Oc1c(Nc2ccc[nH+]c2N2CCCC2)cccc1C(F)(F)F ZINC001185044651 1048124081 /nfs/dbraw/zinc/12/40/81/1048124081.db2.gz YLQBVVVJBRHOQT-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO COc1cc(C)c(Nc2cccc(Cn3cc[nH+]c3)c2)cc1C ZINC001175114942 1048124129 /nfs/dbraw/zinc/12/41/29/1048124129.db2.gz NRVCPRXDNRXDEV-UHFFFAOYSA-N 1 2 307.397 4.300 20 0 DIADLO Cc1ccccc1[C@@H](NC(=O)c1cccc2[nH+]ccn21)C(C)(C)C ZINC001126881793 1048125210 /nfs/dbraw/zinc/12/52/10/1048125210.db2.gz JPSRHGMIWJQJKF-GOSISDBHSA-N 1 2 321.424 4.160 20 0 DIADLO COc1cc(C(F)(F)F)ccc1Nc1cccc2[nH+]c[nH]c21 ZINC001213032406 1048126413 /nfs/dbraw/zinc/12/64/13/1048126413.db2.gz DHSUADAOBQQGAK-UHFFFAOYSA-N 1 2 307.275 4.334 20 0 DIADLO CC[C@@H](Nc1[nH+]cnc2[nH]c3cc(F)ccc3c21)C(F)(F)F ZINC001161382662 1048127555 /nfs/dbraw/zinc/12/75/55/1048127555.db2.gz MHFYWEOBNAALFA-SNVBAGLBSA-N 1 2 312.270 4.003 20 0 DIADLO CCOC(=O)c1cc(Nc2cccc3[nH+]c[nH]c32)ccc1Cl ZINC001213032578 1048129073 /nfs/dbraw/zinc/12/90/73/1048129073.db2.gz NAJHIEMTWGNXDJ-UHFFFAOYSA-N 1 2 315.760 4.137 20 0 DIADLO Clc1sccc1C[NH2+][C@@H]1COc2ccc(Cl)cc21 ZINC000480360438 1048129718 /nfs/dbraw/zinc/12/97/18/1048129718.db2.gz UWBARBNLVLHDOV-LLVKDONJSA-N 1 2 300.210 4.278 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1cc(C(F)(F)F)ccc1F ZINC001175076403 1048130525 /nfs/dbraw/zinc/13/05/25/1048130525.db2.gz MQCQTLJVMOPAIL-UHFFFAOYSA-N 1 2 309.266 4.074 20 0 DIADLO Cc1cccc(Nc2cccc3[nH+]c[nH]c32)c1N1CCCCC1=O ZINC001213033412 1048136872 /nfs/dbraw/zinc/13/68/72/1048136872.db2.gz FHGMTKZJFQYOFP-UHFFFAOYSA-N 1 2 320.396 4.132 20 0 DIADLO Cc1cc(NCc2cncn2CC2CCC2)[nH+]c2ccccc12 ZINC001161531351 1048137327 /nfs/dbraw/zinc/13/73/27/1048137327.db2.gz LKOYKLKKXQQXOU-UHFFFAOYSA-N 1 2 306.413 4.152 20 0 DIADLO CC(C)c1cc2c(ncnc2NCc2c[nH+]cn2C(C)C)s1 ZINC001161563162 1048138740 /nfs/dbraw/zinc/13/87/40/1048138740.db2.gz QFSKJNWPNNXYTK-UHFFFAOYSA-N 1 2 315.446 4.204 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cc(F)cc2ccc(Cl)nc21 ZINC001161565707 1048139255 /nfs/dbraw/zinc/13/92/55/1048139255.db2.gz RIHPDBVAYAHTJU-UHFFFAOYSA-N 1 2 318.783 4.417 20 0 DIADLO CC[C@H](CNc1nc2ccccc2n2c[nH+]cc12)c1ccccc1 ZINC001185149994 1048143935 /nfs/dbraw/zinc/14/39/35/1048143935.db2.gz YTRJXXUKOVROHF-OAHLLOKOSA-N 1 2 316.408 4.488 20 0 DIADLO COc1ccccc1-n1c[nH+]c2cc(NCC(F)(F)F)ccc21 ZINC001161636846 1048149703 /nfs/dbraw/zinc/14/97/03/1048149703.db2.gz OGWYRIWJVPUMPL-UHFFFAOYSA-N 1 2 321.302 4.008 20 0 DIADLO Fc1cccc(Nc2cccc3[nH+]c[nH]c32)c1N1CCCCC1 ZINC001213034357 1048151434 /nfs/dbraw/zinc/15/14/34/1048151434.db2.gz FMQBYGLKHVQIOC-UHFFFAOYSA-N 1 2 310.376 4.436 20 0 DIADLO CC(C)(C)CCNc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)nn1 ZINC001161677347 1048152528 /nfs/dbraw/zinc/15/25/28/1048152528.db2.gz OWHAOPBWGUGARZ-UHFFFAOYSA-N 1 2 321.428 4.177 20 0 DIADLO Fc1cc(F)c(-c2ccccc2)c(NCCCn2cc[nH+]c2)c1 ZINC001161689491 1048154527 /nfs/dbraw/zinc/15/45/27/1048154527.db2.gz WELVXZLFDCHBRY-UHFFFAOYSA-N 1 2 313.351 4.331 20 0 DIADLO C[C@@H]1C[C@H](Nc2cc(SCc3ccccc3)cc[nH+]2)CCO1 ZINC001161695689 1048155832 /nfs/dbraw/zinc/15/58/32/1048155832.db2.gz GBRHUYAOAHDVLS-GDBMZVCRSA-N 1 2 314.454 4.353 20 0 DIADLO Fc1cc(F)c(F)c(C[NH2+]Cc2ccccc2Cl)c1F ZINC001200933309 1048159383 /nfs/dbraw/zinc/15/93/83/1048159383.db2.gz XOUNEPVMAZMOLX-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2Cl)C[N@@H+]1C[C@@H]1CCC(C)(C)O1 ZINC000480522508 1048162132 /nfs/dbraw/zinc/16/21/32/1048162132.db2.gz DAGPRBJQKUTIFD-JKIFEVAISA-N 1 2 323.864 4.059 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2Cl)C[N@H+]1C[C@@H]1CCC(C)(C)O1 ZINC000480522508 1048162135 /nfs/dbraw/zinc/16/21/35/1048162135.db2.gz DAGPRBJQKUTIFD-JKIFEVAISA-N 1 2 323.864 4.059 20 0 DIADLO CCOc1ccc(Nc2cccc3[nH+]c(C)cn32)c(F)c1F ZINC001175149501 1048169581 /nfs/dbraw/zinc/16/95/81/1048169581.db2.gz AEYAUZALNZIHKA-UHFFFAOYSA-N 1 2 303.312 4.063 20 0 DIADLO CCCCCCOc1ccc(Nc2[nH+]cccc2CCO)cc1 ZINC001175190928 1048169879 /nfs/dbraw/zinc/16/98/79/1048169879.db2.gz VKGRUUATSDUCKQ-UHFFFAOYSA-N 1 2 314.429 4.319 20 0 DIADLO Cc1cc(N[C@@H](c2cncc(F)c2)C2CC2)nc(C(C)(C)C)[nH+]1 ZINC001161817805 1048177009 /nfs/dbraw/zinc/17/70/09/1048177009.db2.gz HCDNSKGPGQBBRZ-MRXNPFEDSA-N 1 2 314.408 4.180 20 0 DIADLO CN(C)c1ccccc1C[N@H+](C)Cc1ncc(-c2ccccc2)o1 ZINC000554746305 1048177254 /nfs/dbraw/zinc/17/72/54/1048177254.db2.gz VOOPAZDPEVYTIH-UHFFFAOYSA-N 1 2 321.424 4.040 20 0 DIADLO CN(C)c1ccccc1C[N@@H+](C)Cc1ncc(-c2ccccc2)o1 ZINC000554746305 1048177258 /nfs/dbraw/zinc/17/72/58/1048177258.db2.gz VOOPAZDPEVYTIH-UHFFFAOYSA-N 1 2 321.424 4.040 20 0 DIADLO Cc1ccc(C(C)(C)CN(C)c2nc(C)[nH+]c3c2CCCC3)cc1 ZINC001185517036 1048190757 /nfs/dbraw/zinc/19/07/57/1048190757.db2.gz ASPZJGUANRBERB-UHFFFAOYSA-N 1 2 323.484 4.386 20 0 DIADLO Cc1cc(NC[C@H](C)Oc2ccccc2C)nc(C2CCC2)[nH+]1 ZINC001185519320 1048192404 /nfs/dbraw/zinc/19/24/04/1048192404.db2.gz YINOMKWUEXEYLZ-HNNXBMFYSA-N 1 2 311.429 4.240 20 0 DIADLO CC(C)c1cc(N2CCS[C@H](C(C)C)C2)nc(C(C)C)[nH+]1 ZINC001185555524 1048195648 /nfs/dbraw/zinc/19/56/48/1048195648.db2.gz UFIYIBNKIJQOOM-HNNXBMFYSA-N 1 2 307.507 4.301 20 0 DIADLO CCOc1ccc(OC)cc1Nc1ccccc1-n1cc[nH+]c1 ZINC001175212669 1048196763 /nfs/dbraw/zinc/19/67/63/1048196763.db2.gz DJTSZLNMTQOQSS-UHFFFAOYSA-N 1 2 309.369 4.023 20 0 DIADLO CCOc1ccc(OC)cc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001175212929 1048197452 /nfs/dbraw/zinc/19/74/52/1048197452.db2.gz MICDORMNNSZZMW-UHFFFAOYSA-N 1 2 323.396 4.082 20 0 DIADLO CCc1ccccc1NC(=S)Nc1cccn2c(C)c(C)[nH+]c12 ZINC001201143264 1048198841 /nfs/dbraw/zinc/19/88/41/1048198841.db2.gz MMLXXTLROOWZFV-UHFFFAOYSA-N 1 2 324.453 4.322 20 0 DIADLO CCOC(=O)CCc1ccc[nH+]c1N[C@H](c1ccccc1)C1CC1 ZINC001161958012 1048199397 /nfs/dbraw/zinc/19/93/97/1048199397.db2.gz HTNZYZRJHIMTEA-LJQANCHMSA-N 1 2 324.424 4.141 20 0 DIADLO CC(C)c1cc(NCc2nc3ccccc3o2)nc(C(C)C)[nH+]1 ZINC001161967948 1048202406 /nfs/dbraw/zinc/20/24/06/1048202406.db2.gz ZAMRHRPDBBFPMA-UHFFFAOYSA-N 1 2 310.401 4.477 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2nnc(C(C)(C)C)o2)cc1 ZINC000774902543 1048203080 /nfs/dbraw/zinc/20/30/80/1048203080.db2.gz VKJULSVCHFZZOY-CYBMUJFWSA-N 1 2 317.433 4.005 20 0 DIADLO Cc1cc(NCc2cccc3[nH+]ccn32)c2cccnc2c1C ZINC001201124167 1048205041 /nfs/dbraw/zinc/20/50/41/1048205041.db2.gz KIFJCJFKXLPBHC-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO Cc1cnn(C)c1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000554847835 1048208046 /nfs/dbraw/zinc/20/80/46/1048208046.db2.gz AOXLZXNDMIBODF-OAHLLOKOSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1cnn(C)c1C[N@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000554847835 1048208057 /nfs/dbraw/zinc/20/80/57/1048208057.db2.gz AOXLZXNDMIBODF-OAHLLOKOSA-N 1 2 324.255 4.372 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2ccccc21)c1nc(C2CCCCC2)no1 ZINC000554864540 1048215527 /nfs/dbraw/zinc/21/55/27/1048215527.db2.gz APWKRVSCOFVLII-GUYCJALGSA-N 1 2 311.429 4.455 20 0 DIADLO C[C@H](c1ccc(F)cc1)N(C)c1nc2ccccc2n2c[nH+]cc12 ZINC001162032227 1048217242 /nfs/dbraw/zinc/21/72/42/1048217242.db2.gz KFZIFCFZSSNDIG-CYBMUJFWSA-N 1 2 320.371 4.219 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+]Cc2nc3cccc(Cl)c3n2C)o1 ZINC000480693133 1048224668 /nfs/dbraw/zinc/22/46/68/1048224668.db2.gz BTSKNORSIZGWDH-LLVKDONJSA-N 1 2 317.820 4.233 20 0 DIADLO Nc1ccc(Nc2cc(C(F)(F)F)ccc2N2CCCC2)c[nH+]1 ZINC001201286817 1048225830 /nfs/dbraw/zinc/22/58/30/1048225830.db2.gz BNTZPFCDOLVXBH-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO Nc1ccc(Nc2c(Cl)ccc3nc(Cl)ccc32)c[nH+]1 ZINC001201286101 1048226205 /nfs/dbraw/zinc/22/62/05/1048226205.db2.gz WMFZMYAFVGXNRA-UHFFFAOYSA-N 1 2 305.168 4.262 20 0 DIADLO CCOc1ccc(F)c(F)c1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001175278108 1048226260 /nfs/dbraw/zinc/22/62/60/1048226260.db2.gz HQRHUAKTXQCGSO-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO Cc1ccc(Oc2ccc(Nc3ccc(N)[nH+]c3)cc2C)cn1 ZINC001201291731 1048227949 /nfs/dbraw/zinc/22/79/49/1048227949.db2.gz PDFXXRRBDSMDED-UHFFFAOYSA-N 1 2 306.369 4.212 20 0 DIADLO COc1cc[nH+]c(C(C)(C)CNc2nc3ccccc3cc2C)c1 ZINC001162128135 1048228997 /nfs/dbraw/zinc/22/89/97/1048228997.db2.gz HXIBCTIQJNRGCZ-UHFFFAOYSA-N 1 2 321.424 4.337 20 0 DIADLO Nc1ccc(Nc2ccc(Oc3ccnc(Cl)c3)cc2)c[nH+]1 ZINC001201291360 1048229365 /nfs/dbraw/zinc/22/93/65/1048229365.db2.gz GSTQSIUMADPTIK-UHFFFAOYSA-N 1 2 312.760 4.248 20 0 DIADLO CCOc1ccc(F)c(F)c1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001175282400 1048229546 /nfs/dbraw/zinc/22/95/46/1048229546.db2.gz PKPWKTYZCDBBPD-UHFFFAOYSA-N 1 2 323.730 4.408 20 0 DIADLO Nc1ccc(Nc2cccc(F)c2OC2CCCCC2)c[nH+]1 ZINC001201295868 1048232361 /nfs/dbraw/zinc/23/23/61/1048232361.db2.gz VAMUIFASDCDVFN-UHFFFAOYSA-N 1 2 301.365 4.258 20 0 DIADLO Nc1ccc(Nc2cc(OCC3CC3)cc(C(F)(F)F)c2)c[nH+]1 ZINC001201295877 1048233359 /nfs/dbraw/zinc/23/33/59/1048233359.db2.gz VNWAMAHGGISXQF-UHFFFAOYSA-N 1 2 323.318 4.215 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(N[C@H](C)c2nnc3ccccn32)c1 ZINC001162188274 1048238850 /nfs/dbraw/zinc/23/88/50/1048238850.db2.gz JZKWYVCBSNPRJY-OAHLLOKOSA-N 1 2 323.444 4.057 20 0 DIADLO CCCCn1c(S[C@@H]2CC[C@H](C)C2)nnc1[C@@H](CC)[NH+](C)C ZINC000554969175 1048241433 /nfs/dbraw/zinc/24/14/33/1048241433.db2.gz FVMSHFFUYWTUJX-RRFJBIMHSA-N 1 2 324.538 4.372 20 0 DIADLO CC(=O)c1ccc(F)c(Nc2ccc[nH+]c2N2CCCCC2)c1 ZINC001175270982 1048248422 /nfs/dbraw/zinc/24/84/22/1048248422.db2.gz QUVXBVLIOLYCRT-UHFFFAOYSA-N 1 2 313.376 4.157 20 0 DIADLO CN(C)c1ccc(Nc2ccc(Oc3ccc(F)cc3)nc2)c[nH+]1 ZINC001175341465 1048250977 /nfs/dbraw/zinc/25/09/77/1048250977.db2.gz SFQKIKMKIKFHJO-UHFFFAOYSA-N 1 2 324.359 4.218 20 0 DIADLO Cc1nc2c(F)cccc2cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175347305 1048251984 /nfs/dbraw/zinc/25/19/84/1048251984.db2.gz HUDVQNDOLWFHDZ-UHFFFAOYSA-N 1 2 322.387 4.421 20 0 DIADLO COc1c(Cl)cc(Cl)cc1Nc1ccc(N(C)C)[nH+]c1 ZINC001175345561 1048252067 /nfs/dbraw/zinc/25/20/67/1048252067.db2.gz DTDODJIHNIIMEU-UHFFFAOYSA-N 1 2 312.200 4.207 20 0 DIADLO CN(C)c1ccc(N(Cc2ccccc2)c2ccccc2N)c[nH+]1 ZINC001175345141 1048252764 /nfs/dbraw/zinc/25/27/64/1048252764.db2.gz MDHYCSDWWFCVLU-UHFFFAOYSA-N 1 2 318.424 4.068 20 0 DIADLO C[S@@](=O)c1ccccc1Nc1cc[nH+]c2cc(Cl)ccc12 ZINC001175303708 1048254322 /nfs/dbraw/zinc/25/43/22/1048254322.db2.gz FNEPSJGVFYVTIW-OAQYLSRUSA-N 1 2 316.813 4.369 20 0 DIADLO Clc1cncc(Nc2ccc(N3CCCC3)[nH+]c2)c1Cl ZINC001175348792 1048254391 /nfs/dbraw/zinc/25/43/91/1048254391.db2.gz KBLAQWCZJYJWBM-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO CCCN(Cc1ccc(F)cc1)c1cc(CC)[nH+]c(CC)n1 ZINC001162297101 1048260056 /nfs/dbraw/zinc/26/00/56/1048260056.db2.gz IERDXCZQSFCKJL-UHFFFAOYSA-N 1 2 301.409 4.157 20 0 DIADLO CCc1cc(N2CCc3cc(C(C)(C)C)ccc3C2)nc(CC)[nH+]1 ZINC001162334551 1048263339 /nfs/dbraw/zinc/26/33/39/1048263339.db2.gz YGNOEPTWZMAIOD-UHFFFAOYSA-N 1 2 323.484 4.462 20 0 DIADLO Cc1cccc2nc(NCCCCNc3cccc[nH+]3)sc21 ZINC001162361526 1048267289 /nfs/dbraw/zinc/26/72/89/1048267289.db2.gz SFHCTUQNPJDRHP-UHFFFAOYSA-N 1 2 312.442 4.304 20 0 DIADLO CCSCc1cc[nH+]c(NCc2nccc3c2CCCC3)c1 ZINC001201458208 1048269026 /nfs/dbraw/zinc/26/90/26/1048269026.db2.gz NIMOUXLRJIDBIE-UHFFFAOYSA-N 1 2 313.470 4.221 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(C(F)(F)F)ccc2F)CCC1(F)F ZINC000555099745 1048269352 /nfs/dbraw/zinc/26/93/52/1048269352.db2.gz PZDFHAZNGVQKEG-SECBINFHSA-N 1 2 311.269 4.322 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(C(F)(F)F)ccc2F)CCC1(F)F ZINC000555099745 1048269359 /nfs/dbraw/zinc/26/93/59/1048269359.db2.gz PZDFHAZNGVQKEG-SECBINFHSA-N 1 2 311.269 4.322 20 0 DIADLO CC(C)Oc1cccc(F)c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175349209 1048269768 /nfs/dbraw/zinc/26/97/68/1048269768.db2.gz MHGUVNKBZAZTDV-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO CN(C)c1ccc(Nc2cc(-c3cccc(F)c3)ccn2)c[nH+]1 ZINC001175338377 1048270230 /nfs/dbraw/zinc/27/02/30/1048270230.db2.gz FTMUQXZJTSYWBW-UHFFFAOYSA-N 1 2 308.360 4.092 20 0 DIADLO Clc1cc(Nc2ccc(N3CCCC3)[nH+]c2)cnc1Cl ZINC001175350803 1048270721 /nfs/dbraw/zinc/27/07/21/1048270721.db2.gz YVYMUZDFNPNYLE-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO Fc1ccc(Cl)c(F)c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175350691 1048272803 /nfs/dbraw/zinc/27/28/03/1048272803.db2.gz HFNAVRQLTMATQF-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO CNc1ccc(Cl)cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175352621 1048274113 /nfs/dbraw/zinc/27/41/13/1048274113.db2.gz YIFWDXVKTVIRCA-UHFFFAOYSA-N 1 2 302.809 4.121 20 0 DIADLO c1ncc(-c2ccc(Nc3ccc(N4CCCC4)[nH+]c3)cc2)o1 ZINC001175352485 1048274322 /nfs/dbraw/zinc/27/43/22/1048274322.db2.gz PVROAWPMVPAWAL-UHFFFAOYSA-N 1 2 306.369 4.080 20 0 DIADLO Fc1cc(F)c2c(c1)[C@H](Nc1cc3ccccc3c[nH+]1)CCO2 ZINC001162399598 1048275049 /nfs/dbraw/zinc/27/50/49/1048275049.db2.gz JAYGACYYNLTPJI-MRXNPFEDSA-N 1 2 312.319 4.449 20 0 DIADLO Cc1cc(N[C@H]2CCCO[C@H]2CC(C)C)nc(C2CCC2)[nH+]1 ZINC001186212520 1048276460 /nfs/dbraw/zinc/27/64/60/1048276460.db2.gz QNPCLXSBXQOTOG-HOTGVXAUSA-N 1 2 303.450 4.058 20 0 DIADLO CSCc1cc[nH+]c(N[C@H]2CCOc3c(F)cc(F)cc32)c1 ZINC001162406915 1048276907 /nfs/dbraw/zinc/27/69/07/1048276907.db2.gz OERZRXRFJRKLJF-AWEZNQCLSA-N 1 2 322.380 4.159 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cccnc2Br)cc1 ZINC001201488525 1048279707 /nfs/dbraw/zinc/27/97/07/1048279707.db2.gz SUKSYHPFOQPJCY-UHFFFAOYSA-N 1 2 306.207 4.408 20 0 DIADLO Cc1cc(Nc2ccc([NH2+]C(C)C)cc2)n(-c2ccccn2)n1 ZINC001201487446 1048280444 /nfs/dbraw/zinc/28/04/44/1048280444.db2.gz IAQAXBWEOPNAHK-UHFFFAOYSA-N 1 2 307.401 4.140 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2c[nH]c(=O)c(C(F)(F)F)c2)cc1 ZINC001201491634 1048281923 /nfs/dbraw/zinc/28/19/23/1048281923.db2.gz RLUDVKHBFGMGJT-UHFFFAOYSA-N 1 2 311.307 4.370 20 0 DIADLO COc1nc(C)nc(Cl)c1Nc1ccc([NH2+]C(C)C)cc1 ZINC001201492207 1048282310 /nfs/dbraw/zinc/28/23/10/1048282310.db2.gz WVZIECOAGWZENY-UHFFFAOYSA-N 1 2 306.797 4.011 20 0 DIADLO CC[C@@H](Nc1[nH+]c(C)nc2[nH]ccc21)c1ccc(F)c(F)c1 ZINC001162463798 1048284141 /nfs/dbraw/zinc/28/41/41/1048284141.db2.gz XUHBPYSTAJHGCE-CQSZACIVSA-N 1 2 302.328 4.108 20 0 DIADLO CC(C)c1cc(N2CCCCC[C@H]2C[C@H](C)O)nc(C(C)C)[nH+]1 ZINC001186406842 1048297568 /nfs/dbraw/zinc/29/75/68/1048297568.db2.gz WLXRGUMZMKOFLA-HOTGVXAUSA-N 1 2 319.493 4.243 20 0 DIADLO Cn1ncc2cc(Nc3ccc([NH+]4CCCCC4)cc3)ccc21 ZINC001175423694 1048302453 /nfs/dbraw/zinc/30/24/53/1048302453.db2.gz BQWIFEFPAFYSNN-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2NCC(C)(C)C(C)(C)C ZINC001186556839 1048317174 /nfs/dbraw/zinc/31/71/74/1048317174.db2.gz KYFKXHRAQLLMFY-UHFFFAOYSA-N 1 2 303.454 4.066 20 0 DIADLO Cc1cc(F)c(CNc2ccc(N3CCCCC3)[nH+]c2)c(F)c1 ZINC001201567187 1048319098 /nfs/dbraw/zinc/31/90/98/1048319098.db2.gz REZOQIBVXIRYDT-UHFFFAOYSA-N 1 2 317.383 4.271 20 0 DIADLO c1cnc2cc(Nc3ccc([NH+]4CCCCC4)cc3)ccc2n1 ZINC001175488216 1048324987 /nfs/dbraw/zinc/32/49/87/1048324987.db2.gz TXPISNAHFPBTSX-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO FC1(F)CC[C@@H](C[NH2+]c2cc3c4c(c2)CCCN4CCC3)C1 ZINC001162650075 1048325252 /nfs/dbraw/zinc/32/52/52/1048325252.db2.gz PSHRNPKXHJUPDM-CYBMUJFWSA-N 1 2 306.400 4.233 20 0 DIADLO FC(F)(F)c1c[nH]c2[nH+]ccc(NC[C@@H]3CCC(F)(F)C3)c12 ZINC001162649432 1048325431 /nfs/dbraw/zinc/32/54/31/1048325431.db2.gz GXBYXRVOZWSUFP-MRVPVSSYSA-N 1 2 319.277 4.429 20 0 DIADLO CCO[C@@H]1CCCC[C@H]1Nc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC001186695648 1048330426 /nfs/dbraw/zinc/33/04/26/1048330426.db2.gz FNPLMGGHVNRPDK-GDBMZVCRSA-N 1 2 305.466 4.483 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1cncc(SCc2ccccc2)n1 ZINC001162661619 1048332067 /nfs/dbraw/zinc/33/20/67/1048332067.db2.gz FOVQMKJXBKLQDD-UHFFFAOYSA-N 1 2 300.431 4.204 20 0 DIADLO C[C@@H](Cc1ccsc1)N(C)c1nc2ccccc2n2c[nH+]cc12 ZINC001162686116 1048335487 /nfs/dbraw/zinc/33/54/87/1048335487.db2.gz NSLHXMNOQYMYDF-ZDUSSCGKSA-N 1 2 322.437 4.011 20 0 DIADLO Cc1cc(N2CCC[C@@H](CC(F)(F)F)C2)nc(C2CCC2)[nH+]1 ZINC001186763345 1048337697 /nfs/dbraw/zinc/33/76/97/1048337697.db2.gz BNCDTGIFJKUCOY-LBPRGKRZSA-N 1 2 313.367 4.221 20 0 DIADLO Clc1ccc([C@H]2COCC[N@@H+]2CCCc2ccccc2)cc1 ZINC001201671285 1048340072 /nfs/dbraw/zinc/34/00/72/1048340072.db2.gz GDPTTWACUQGAED-LJQANCHMSA-N 1 2 315.844 4.346 20 0 DIADLO Clc1ccc([C@H]2COCC[N@H+]2CCCc2ccccc2)cc1 ZINC001201671285 1048340085 /nfs/dbraw/zinc/34/00/85/1048340085.db2.gz GDPTTWACUQGAED-LJQANCHMSA-N 1 2 315.844 4.346 20 0 DIADLO CCCCO[C@@H]1C[C@H](N(C)c2cc(C)[nH+]c(C3CC3)n2)C1(C)C ZINC001162711276 1048340927 /nfs/dbraw/zinc/34/09/27/1048340927.db2.gz GKWIXWPQAGAFQP-JKSUJKDBSA-N 1 2 317.477 4.082 20 0 DIADLO CSCCC[N@@H+]1CC[C@H](Cc2ccc(F)cc2)C(F)(F)C1 ZINC001201697417 1048347401 /nfs/dbraw/zinc/34/74/01/1048347401.db2.gz AFAXRSZRONCDBD-CQSZACIVSA-N 1 2 317.420 4.079 20 0 DIADLO CSCCC[N@H+]1CC[C@H](Cc2ccc(F)cc2)C(F)(F)C1 ZINC001201697417 1048347418 /nfs/dbraw/zinc/34/74/18/1048347418.db2.gz AFAXRSZRONCDBD-CQSZACIVSA-N 1 2 317.420 4.079 20 0 DIADLO Cc1cccc(C)c1CCNc1nc2ccccc2n2c[nH+]cc12 ZINC001162763511 1048352278 /nfs/dbraw/zinc/35/22/78/1048352278.db2.gz SJEODRUSCANKKI-UHFFFAOYSA-N 1 2 316.408 4.154 20 0 DIADLO CCOC(=O)c1c(C)cc(N[C@H]2CCc3sccc32)[nH+]c1C ZINC001162765974 1048354027 /nfs/dbraw/zinc/35/40/27/1048354027.db2.gz ICHFRCWTTAFFRE-ZDUSSCGKSA-N 1 2 316.426 4.036 20 0 DIADLO Cc1nc(N2CCc3ccc(Cl)c(Cl)c3C2)c(C)c(C)[nH+]1 ZINC001186963462 1048361584 /nfs/dbraw/zinc/36/15/84/1048361584.db2.gz ABRIWLHKGPFREQ-UHFFFAOYSA-N 1 2 322.239 4.271 20 0 DIADLO Cc1cc([N@H+]2CCCC[C@@H]2C)ccc1Nc1ncnc2c1CCC2 ZINC001162819307 1048364879 /nfs/dbraw/zinc/36/48/79/1048364879.db2.gz WHQDGUKFVGQIQJ-HNNXBMFYSA-N 1 2 322.456 4.396 20 0 DIADLO Cc1cc([N@@H+]2CCCC[C@@H]2C)ccc1Nc1ncnc2c1CCC2 ZINC001162819307 1048364892 /nfs/dbraw/zinc/36/48/92/1048364892.db2.gz WHQDGUKFVGQIQJ-HNNXBMFYSA-N 1 2 322.456 4.396 20 0 DIADLO CCCOc1cccc(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001175599634 1048368031 /nfs/dbraw/zinc/36/80/31/1048368031.db2.gz MKSSDZFYXCHRAN-UHFFFAOYSA-N 1 2 307.397 4.464 20 0 DIADLO Cc1nc(N[C@@H]2C[C@H]2c2ccccc2Cl)c2c([nH+]1)CCCC2 ZINC001187063535 1048368894 /nfs/dbraw/zinc/36/88/94/1048368894.db2.gz JNQIMICJVMNTBD-WMLDXEAASA-N 1 2 313.832 4.285 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1ncc(C(C)C)o1 ZINC000775085173 1048373920 /nfs/dbraw/zinc/37/39/20/1048373920.db2.gz DZRJABBWLSMVGD-OAHLLOKOSA-N 1 2 302.418 4.438 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2conc2Cc2ccccc2)o1 ZINC000555524690 1048375227 /nfs/dbraw/zinc/37/52/27/1048375227.db2.gz WUCAMNIIVMDAEB-KDOFPFPSSA-N 1 2 322.408 4.272 20 0 DIADLO CSc1nc(N[C@H](C)c2cccc(F)c2Cl)cc(C)[nH+]1 ZINC001162894051 1048379187 /nfs/dbraw/zinc/37/91/87/1048379187.db2.gz ZSCYCXYKFJIPQV-SECBINFHSA-N 1 2 311.813 4.473 20 0 DIADLO Cc1cc(C(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)ccc1F ZINC001273535849 1048383368 /nfs/dbraw/zinc/38/33/68/1048383368.db2.gz IAMITNICHPALAI-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccnc(Cl)c2OC(F)(F)F)c1 ZINC001203656966 1048385391 /nfs/dbraw/zinc/38/53/91/1048385391.db2.gz FVOQXRPUCRQSOO-UHFFFAOYSA-N 1 2 317.698 4.389 20 0 DIADLO Cc1cc(N[C@H]2CCO[C@H](CC(C)C)C2)nc(C2CCC2)[nH+]1 ZINC001162921634 1048389020 /nfs/dbraw/zinc/38/90/20/1048389020.db2.gz IRKKMPDZSGSNIL-JKSUJKDBSA-N 1 2 303.450 4.058 20 0 DIADLO Cc1cc(N[C@@H]2CCc3c2c(F)ccc3F)nc(C(C)(C)C)[nH+]1 ZINC001162938148 1048392331 /nfs/dbraw/zinc/39/23/31/1048392331.db2.gz IUOANNTWASTFIK-CQSZACIVSA-N 1 2 317.383 4.460 20 0 DIADLO CSCc1cc[nH+]c(N[C@H]2CCc3c2c(F)ccc3F)c1 ZINC001162938291 1048392494 /nfs/dbraw/zinc/39/24/94/1048392494.db2.gz LQMUAGXLVDJNRM-AWEZNQCLSA-N 1 2 306.381 4.322 20 0 DIADLO Cc1ccc2sc(NCCCCn3cc[nH+]c3)nc2c1C ZINC001162948204 1048393251 /nfs/dbraw/zinc/39/32/51/1048393251.db2.gz BOWNCDRQRSGZLJ-UHFFFAOYSA-N 1 2 300.431 4.002 20 0 DIADLO Cc1[nH]nc2ccc(Nc3ccc(-n4cc[nH+]c4C)cc3)cc12 ZINC001175699074 1048402200 /nfs/dbraw/zinc/40/22/00/1048402200.db2.gz HQQIGQJFHFRZEH-UHFFFAOYSA-N 1 2 303.369 4.109 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2ccc3nc(C)sc3c2)cs1 ZINC000555607257 1048405345 /nfs/dbraw/zinc/40/53/45/1048405345.db2.gz RNJGAPRSVWFZIT-UHFFFAOYSA-N 1 2 317.483 4.256 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2ccc3nc(C)sc3c2)cs1 ZINC000555607257 1048405350 /nfs/dbraw/zinc/40/53/50/1048405350.db2.gz RNJGAPRSVWFZIT-UHFFFAOYSA-N 1 2 317.483 4.256 20 0 DIADLO CC(C)O[C@H](COc1ccccc1-n1cc[nH+]c1)c1ccccc1 ZINC000555626980 1048409960 /nfs/dbraw/zinc/40/99/60/1048409960.db2.gz HNXKNJMVRBROLY-HXUWFJFHSA-N 1 2 322.408 4.417 20 0 DIADLO CC(C)c1ccc(N[C@@H](c2ccccc2)c2cccnn2)[nH+]c1 ZINC001163104239 1048416731 /nfs/dbraw/zinc/41/67/31/1048416731.db2.gz LWAQLJNLNKEYHZ-IBGZPJMESA-N 1 2 304.397 4.197 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H](c2ccccc2)c2cccnn2)c1 ZINC001163108075 1048417240 /nfs/dbraw/zinc/41/72/40/1048417240.db2.gz HSXNSKWWFACSLW-SFHVURJKSA-N 1 2 322.437 4.185 20 0 DIADLO c1ccc([C@H](Nc2cc3ccccc3c[nH+]2)c2cccnn2)cc1 ZINC001163102546 1048417597 /nfs/dbraw/zinc/41/75/97/1048417597.db2.gz PGZSKHZLSGAWDD-FQEVSTJZSA-N 1 2 312.376 4.226 20 0 DIADLO Cc1ccc2cccc(Nc3c[nH+]c(N)cc3C(F)(F)F)c2n1 ZINC001175712898 1048419116 /nfs/dbraw/zinc/41/91/16/1048419116.db2.gz LXKRTTIKPSSLKJ-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccnc2C2CCC2)c[nH+]1 ZINC001175712208 1048419178 /nfs/dbraw/zinc/41/91/78/1048419178.db2.gz KAXZTXSEJJCZKB-UHFFFAOYSA-N 1 2 308.307 4.089 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(Cl)cc2F)c[nH+]1 ZINC001175712431 1048419252 /nfs/dbraw/zinc/41/92/52/1048419252.db2.gz ASJVJGXLLBAHAD-UHFFFAOYSA-N 1 2 305.662 4.219 20 0 DIADLO Cc1ccc2nc(Cl)cc(NCc3ccc4[nH+]ccn4c3)c2c1 ZINC001163136188 1048419676 /nfs/dbraw/zinc/41/96/76/1048419676.db2.gz AYVJZECFQAQBFE-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO CNc1ccc(Cl)cc1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175713692 1048420860 /nfs/dbraw/zinc/42/08/60/1048420860.db2.gz BTPJTOMPJWDWQQ-UHFFFAOYSA-N 1 2 316.714 4.121 20 0 DIADLO Clc1cccc2ccnc(NCc3ccc4[nH+]ccn4c3)c12 ZINC001163139034 1048421342 /nfs/dbraw/zinc/42/13/42/1048421342.db2.gz GBHRSDVAAVJFNZ-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO CCCOc1ccccc1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175714980 1048421280 /nfs/dbraw/zinc/42/12/80/1048421280.db2.gz HTYUYHRQWIYCID-UHFFFAOYSA-N 1 2 311.307 4.215 20 0 DIADLO Cc1cccc2c(C)cc(NCc3ccc4nccn4c3)[nH+]c12 ZINC001163137019 1048421566 /nfs/dbraw/zinc/42/15/66/1048421566.db2.gz WEUWBNLZFSSURK-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(-c3ncco3)cc2)c[nH+]1 ZINC001175714396 1048421849 /nfs/dbraw/zinc/42/18/49/1048421849.db2.gz VDVZAIXFHAISOT-UHFFFAOYSA-N 1 2 320.274 4.081 20 0 DIADLO Cc1cc2cc(Nc3c[nH+]c(N)cc3C(F)(F)F)ccc2o1 ZINC001175714369 1048421954 /nfs/dbraw/zinc/42/19/54/1048421954.db2.gz OBTGYAHKIISXKT-UHFFFAOYSA-N 1 2 307.275 4.481 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cnc(N)cc3C(F)(F)F)ccc12 ZINC001175714802 1048421965 /nfs/dbraw/zinc/42/19/65/1048421965.db2.gz VBHJOXIXXUPXBK-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Cc1[nH]c(CN2CCC[C@@H]2c2ccccc2C(F)(F)F)[nH+]c1C ZINC001175725006 1048425846 /nfs/dbraw/zinc/42/58/46/1048425846.db2.gz QHZSRWLPFVZJTB-OAHLLOKOSA-N 1 2 323.362 4.382 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H]3CCc4c3cccc4O)cc(C)c2c1 ZINC001163193659 1048433173 /nfs/dbraw/zinc/43/31/73/1048433173.db2.gz CPOHJKIPKFUVSK-QGZVFWFLSA-N 1 2 320.392 4.357 20 0 DIADLO CCC[C@H](C)c1cc(Nc2c[nH+]c(N)cc2C(F)(F)F)on1 ZINC001175709412 1048437991 /nfs/dbraw/zinc/43/79/91/1048437991.db2.gz AEDMAQLRLVCNNC-QMMMGPOBSA-N 1 2 314.311 4.318 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccnc(Br)c2)cc1 ZINC001175753026 1048439891 /nfs/dbraw/zinc/43/98/91/1048439891.db2.gz YVFCCXZAWSYEFN-UHFFFAOYSA-N 1 2 306.207 4.044 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccnc(Br)c2)cc1 ZINC001175753026 1048439896 /nfs/dbraw/zinc/43/98/96/1048439896.db2.gz YVFCCXZAWSYEFN-UHFFFAOYSA-N 1 2 306.207 4.044 20 0 DIADLO Cc1nc(N2CCC[C@H]2/C=C/c2ccccc2)c2c([nH+]1)CCCC2 ZINC001187765747 1048441968 /nfs/dbraw/zinc/44/19/68/1048441968.db2.gz PUZZMQLUFIARCF-JKGDOXCYSA-N 1 2 319.452 4.346 20 0 DIADLO Cc1nc(N2CCC(c3ccc4[nH]ccc4c3)CC2)c(C)c(C)[nH+]1 ZINC001187816515 1048442797 /nfs/dbraw/zinc/44/27/97/1048442797.db2.gz RSIUTYGWJWSVPQ-UHFFFAOYSA-N 1 2 320.440 4.267 20 0 DIADLO Cc1cccc(CCCNc2nc3ccc(F)cc3s2)[nH+]1 ZINC001163260907 1048444963 /nfs/dbraw/zinc/44/49/63/1048444963.db2.gz VZZZYQWVKPDWQE-UHFFFAOYSA-N 1 2 301.390 4.184 20 0 DIADLO Cc1ccc2[nH]cc(CCNc3cc(C)[nH+]c(C4CC4)n3)c2c1 ZINC001187880872 1048450309 /nfs/dbraw/zinc/45/03/09/1048450309.db2.gz RWZDKUZNUVXABS-UHFFFAOYSA-N 1 2 306.413 4.107 20 0 DIADLO Cc1cn2cccc(Nc3ccc(-c4ccccc4)nc3)c2[nH+]1 ZINC001175833175 1048457998 /nfs/dbraw/zinc/45/79/98/1048457998.db2.gz RSNVHMNTFGCQOM-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO c1cn(-c2cccc(Nc3cnn(C4CCCCC4)c3)c2)c[nH+]1 ZINC001175879018 1048469013 /nfs/dbraw/zinc/46/90/13/1048469013.db2.gz WZZPXSNKAGZNCL-UHFFFAOYSA-N 1 2 307.401 4.318 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(-c3cccnc3)cc2)c[nH+]1 ZINC001175886605 1048471884 /nfs/dbraw/zinc/47/18/84/1048471884.db2.gz KTOVKPWBCMKPNY-UHFFFAOYSA-N 1 2 304.397 4.343 20 0 DIADLO COc1cccc(Nc2ccc[nH+]c2N2CCCC2)c1Cl ZINC001175896785 1048477384 /nfs/dbraw/zinc/47/73/84/1048477384.db2.gz XCALEEZDIWRSAW-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO Cc1cc(C)c(CNc2ncnc3sc4c(c32)CCCC4)c[nH+]1 ZINC001163500429 1048479050 /nfs/dbraw/zinc/47/90/50/1048479050.db2.gz JBVRKAGEIUIMHN-UHFFFAOYSA-N 1 2 324.453 4.194 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)cs1 ZINC000481763093 1048482852 /nfs/dbraw/zinc/48/28/52/1048482852.db2.gz CVTZJLBFNZLCPR-CMPLNLGQSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)cs1 ZINC000481763093 1048482856 /nfs/dbraw/zinc/48/28/56/1048482856.db2.gz CVTZJLBFNZLCPR-CMPLNLGQSA-N 1 2 306.397 4.429 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC001175875273 1048489066 /nfs/dbraw/zinc/48/90/66/1048489066.db2.gz WLPGUGQVPGCKDI-BREBYQMCSA-N 1 2 323.305 4.068 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC001175875273 1048489072 /nfs/dbraw/zinc/48/90/72/1048489072.db2.gz WLPGUGQVPGCKDI-BREBYQMCSA-N 1 2 323.305 4.068 20 0 DIADLO CCOc1ccc2[nH]c(SCc3ccc(C)[nH+]c3C)nc2c1 ZINC001188217396 1048491613 /nfs/dbraw/zinc/49/16/13/1048491613.db2.gz IVWLLXWFWJAOKB-UHFFFAOYSA-N 1 2 313.426 4.266 20 0 DIADLO c1cn(Cc2ccc(Nc3ccc4scnc4c3)cc2)c[nH+]1 ZINC001175913629 1048499154 /nfs/dbraw/zinc/49/91/54/1048499154.db2.gz GBHJKGGNSKTFMP-UHFFFAOYSA-N 1 2 306.394 4.285 20 0 DIADLO CCCCC[C@H]1CCCCN1C(=O)Nc1cc(C)[nH+]cc1C ZINC001202245769 1048502502 /nfs/dbraw/zinc/50/25/02/1048502502.db2.gz PTVDLQIQZQGRKZ-INIZCTEOSA-N 1 2 303.450 4.087 20 0 DIADLO CCC(C)(C)c1ccc(CSc2nc(N)cc(C)[nH+]2)cc1 ZINC001188408585 1048512242 /nfs/dbraw/zinc/51/22/42/1048512242.db2.gz PMFOCWRYBXCORR-UHFFFAOYSA-N 1 2 301.459 4.347 20 0 DIADLO COc1cc(C)[nH+]c(CSC[C@@H](OC)c2ccc(F)cc2)c1 ZINC000600625784 1048513774 /nfs/dbraw/zinc/51/37/74/1048513774.db2.gz ORGMPMQSWOXNQZ-QGZVFWFLSA-N 1 2 321.417 4.159 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cnc3ccc(Cl)cn23)c1 ZINC000556045056 1048522530 /nfs/dbraw/zinc/52/25/30/1048522530.db2.gz QVUKLDSVWYNKKR-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cnc3ccc(Cl)cn23)c1 ZINC000556045056 1048522543 /nfs/dbraw/zinc/52/25/43/1048522543.db2.gz QVUKLDSVWYNKKR-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO COc1ccc2[nH+]c(N3CC[C@@H](F)C(F)(F)CC3)cc(C)c2c1 ZINC001163780494 1048523916 /nfs/dbraw/zinc/52/39/16/1048523916.db2.gz QKJVWILQSTZDOP-OAHLLOKOSA-N 1 2 324.346 4.125 20 0 DIADLO CC(C)c1cc(N2CC(Cc3ccsc3)C2)nc(C(C)C)[nH+]1 ZINC001163787565 1048525084 /nfs/dbraw/zinc/52/50/84/1048525084.db2.gz IURRIUKWXWAPGU-UHFFFAOYSA-N 1 2 315.486 4.464 20 0 DIADLO COc1ccccc1[C@H]1CCN(c2cc3ccccc3c[nH+]2)C1 ZINC001163806329 1048528358 /nfs/dbraw/zinc/52/83/58/1048528358.db2.gz IOYRSEUZYBDUDI-KRWDZBQOSA-N 1 2 304.393 4.237 20 0 DIADLO O=C(Nc1ccc2ccccc2c1)Nc1ccc2[nH+]ccn2c1 ZINC001188582235 1048529761 /nfs/dbraw/zinc/52/97/61/1048529761.db2.gz MGGAIVAISRTWIS-UHFFFAOYSA-N 1 2 302.337 4.132 20 0 DIADLO CCc1cnc(Cl)nc1NC(=[NH2+])C12CC3CC(CC(C3)C1)C2 ZINC001163840492 1048533475 /nfs/dbraw/zinc/53/34/75/1048533475.db2.gz YIQSPCZWLBYQSG-UHFFFAOYSA-N 1 2 318.852 4.298 20 0 DIADLO CCN(c1cc(SC)cc[nH+]1)[C@@H](C)Cc1ccc(OC)cc1 ZINC001163834559 1048534321 /nfs/dbraw/zinc/53/43/21/1048534321.db2.gz SJRKVPPRPHNREP-AWEZNQCLSA-N 1 2 316.470 4.270 20 0 DIADLO CSc1cc(NC(=[NH2+])C23CC4CC(CC(C4)C2)C3)nc(C)n1 ZINC001163839840 1048534440 /nfs/dbraw/zinc/53/44/40/1048534440.db2.gz QUWZVPBIUZNNGR-UHFFFAOYSA-N 1 2 316.474 4.112 20 0 DIADLO [NH2+]=C(Nc1cc(C(F)(F)F)ncn1)C12CC3CC(CC(C3)C1)C2 ZINC001163848454 1048538634 /nfs/dbraw/zinc/53/86/34/1048538634.db2.gz TUICJACMTPPKMG-UHFFFAOYSA-N 1 2 324.350 4.101 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(-c4ccccn4)cc3)ccc21 ZINC001176039625 1048544135 /nfs/dbraw/zinc/54/41/35/1048544135.db2.gz WAACWUAWULSWMH-UHFFFAOYSA-N 1 2 300.365 4.379 20 0 DIADLO Nc1ccccc1CNc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1 ZINC001163891656 1048545699 /nfs/dbraw/zinc/54/56/99/1048545699.db2.gz SMSUACGJGVHIMN-UHFFFAOYSA-N 1 2 314.392 4.424 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2Cc2ccc(F)c(Cl)c2)[nH+]c1C ZINC001176079311 1048546490 /nfs/dbraw/zinc/54/64/90/1048546490.db2.gz XSDJTTZLQWZFAT-OAHLLOKOSA-N 1 2 307.800 4.156 20 0 DIADLO Cc1cc(NCC(C)(C)[C@H]2CCCCO2)nc(C2CCC2)[nH+]1 ZINC001163921005 1048549343 /nfs/dbraw/zinc/54/93/43/1048549343.db2.gz WPKCAVIEMLNUAX-OAHLLOKOSA-N 1 2 303.450 4.060 20 0 DIADLO Cc1cc(NCCOc2ccccc2F)[nH+]cc1C(F)(F)F ZINC001163950646 1048555015 /nfs/dbraw/zinc/55/50/15/1048555015.db2.gz PRQHVGSDIQACSR-UHFFFAOYSA-N 1 2 314.282 4.039 20 0 DIADLO CCN(CC)C(=O)c1ccc(F)c(Nc2cc(C)cc(C)[nH+]2)c1 ZINC001176066001 1048559727 /nfs/dbraw/zinc/55/97/27/1048559727.db2.gz RPVCYMRYYGWZFI-UHFFFAOYSA-N 1 2 315.392 4.063 20 0 DIADLO COc1cc(Nc2cc(Cl)c3[nH+]ccn3c2)c(F)cc1F ZINC001176106989 1048567420 /nfs/dbraw/zinc/56/74/20/1048567420.db2.gz IZEVYVIBXBGBMD-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1ccccc1C(F)(F)F ZINC001203693848 1048568318 /nfs/dbraw/zinc/56/83/18/1048568318.db2.gz NZSXJXPJLAOIFW-UHFFFAOYSA-N 1 2 307.315 4.020 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1ccccc1C(F)(F)F ZINC001203693848 1048568334 /nfs/dbraw/zinc/56/83/34/1048568334.db2.gz NZSXJXPJLAOIFW-UHFFFAOYSA-N 1 2 307.315 4.020 20 0 DIADLO Cc1cc(NC(=O)c2sccc2SC(F)F)cc[nH+]1 ZINC000107343064 1048580818 /nfs/dbraw/zinc/58/08/18/1048580818.db2.gz QQESXEDVMDWXQZ-UHFFFAOYSA-N 1 2 300.355 4.019 20 0 DIADLO Cc1cn2cccc(Nc3c(F)ccc4ccc(C)nc43)c2[nH+]1 ZINC001176113819 1048570829 /nfs/dbraw/zinc/57/08/29/1048570829.db2.gz NZHKHYIJHCFUJX-UHFFFAOYSA-N 1 2 306.344 4.382 20 0 DIADLO COc1ccc(O[C@H](C)CNc2cc3ccc(C)cc3c[nH+]2)cc1 ZINC001164037096 1048572062 /nfs/dbraw/zinc/57/20/62/1048572062.db2.gz IEVYTOSRQYFRHQ-OAHLLOKOSA-N 1 2 322.408 4.431 20 0 DIADLO COc1cc[nH+]cc1Nc1cnc(Oc2ccccc2)cc1C ZINC001176118379 1048574799 /nfs/dbraw/zinc/57/47/99/1048574799.db2.gz HBPYQZDYZHOTOQ-UHFFFAOYSA-N 1 2 307.353 4.330 20 0 DIADLO COc1cc[nH+]cc1Nc1cccc(Oc2cccc(N)c2)c1 ZINC001176123078 1048576265 /nfs/dbraw/zinc/57/62/65/1048576265.db2.gz IHXZLEBNHVWUGA-UHFFFAOYSA-N 1 2 307.353 4.208 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(N2CCC(F)(F)CC2)cc1 ZINC001176124653 1048576338 /nfs/dbraw/zinc/57/63/38/1048576338.db2.gz TYGIIXARILFHLE-UHFFFAOYSA-N 1 2 319.355 4.069 20 0 DIADLO COC(=[NH2+])c1cccc(N[C@@H](c2ccccc2)c2ccncc2)c1 ZINC001164077699 1048577457 /nfs/dbraw/zinc/57/74/57/1048577457.db2.gz IZYQJWIQYFMFIR-IBGZPJMESA-N 1 2 317.392 4.255 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(OC2CCCC2)c(F)c1 ZINC001176124463 1048577669 /nfs/dbraw/zinc/57/76/69/1048577669.db2.gz PUUDTTODBZLTCB-UHFFFAOYSA-N 1 2 302.349 4.294 20 0 DIADLO CC(C)c1cccc(C[NH2+]Cc2nc(-c3ccccc3)no2)c1 ZINC000667993435 1048578142 /nfs/dbraw/zinc/57/81/42/1048578142.db2.gz YPLWXWKCPBXGSQ-UHFFFAOYSA-N 1 2 307.397 4.150 20 0 DIADLO CC(C)c1cc(NC[C@@H]2C[C@H]2C(F)(F)F)nc(C(C)C)[nH+]1 ZINC001164102672 1048582584 /nfs/dbraw/zinc/58/25/84/1048582584.db2.gz FWJXNXBLJFLWRY-WDEREUQCSA-N 1 2 301.356 4.334 20 0 DIADLO COCOc1ccc(Nc2c[nH+]c(CC(C)C)cc2C)cc1F ZINC001176189080 1048586738 /nfs/dbraw/zinc/58/67/38/1048586738.db2.gz RDFVWLFGENLWMO-UHFFFAOYSA-N 1 2 318.392 4.454 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3CCC[C@@H](C)C3)cc2)[nH+]c1C ZINC001176211248 1048606054 /nfs/dbraw/zinc/60/60/54/1048606054.db2.gz MEMWSSKBVHPVFH-WBMJQRKESA-N 1 2 311.429 4.458 20 0 DIADLO C/C(=C(/F)C(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1)C1CC1 ZINC001176221058 1048607213 /nfs/dbraw/zinc/60/72/13/1048607213.db2.gz ZQKYAHKCOPUMJV-YBEGLDIGSA-N 1 2 313.376 4.286 20 0 DIADLO CC(=C(F)C(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1)C1CC1 ZINC001176221058 1048607221 /nfs/dbraw/zinc/60/72/21/1048607221.db2.gz ZQKYAHKCOPUMJV-YBEGLDIGSA-N 1 2 313.376 4.286 20 0 DIADLO CCCCOc1ccc(NC(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC001189285541 1048609875 /nfs/dbraw/zinc/60/98/75/1048609875.db2.gz XZZJMVHDAPZFFY-UHFFFAOYSA-N 1 2 324.384 4.157 20 0 DIADLO CSCC1CCN(c2cc(C(C)C)[nH+]c(C(C)C)n2)CC1 ZINC001164271464 1048616072 /nfs/dbraw/zinc/61/60/72/1048616072.db2.gz YWNCWAJJSWEUBY-UHFFFAOYSA-N 1 2 307.507 4.303 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000482495057 1048619281 /nfs/dbraw/zinc/61/92/81/1048619281.db2.gz HADDIWDCTZDCCG-SWLSCSKDSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000482495057 1048619285 /nfs/dbraw/zinc/61/92/85/1048619285.db2.gz HADDIWDCTZDCCG-SWLSCSKDSA-N 1 2 323.362 4.240 20 0 DIADLO Cc1[nH]c(CNc2ccc3c(c2)OC2(CCCCC2)O3)[nH+]c1C ZINC000850204188 1048622911 /nfs/dbraw/zinc/62/29/11/1048622911.db2.gz ZNWFOZLJKJMRRX-UHFFFAOYSA-N 1 2 313.401 4.070 20 0 DIADLO Cc1[nH]c(CNc2ccc(N(C)Cc3ccccc3)cc2)[nH+]c1C ZINC000850208476 1048624109 /nfs/dbraw/zinc/62/41/09/1048624109.db2.gz ORDYHDWEPPYEED-UHFFFAOYSA-N 1 2 320.440 4.275 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(O)cc3C(F)(F)F)ccc21 ZINC001176340915 1048632865 /nfs/dbraw/zinc/63/28/65/1048632865.db2.gz ZVSMCFDKIXPDQI-UHFFFAOYSA-N 1 2 307.275 4.041 20 0 DIADLO CCN(CC)C(=O)c1cc(F)cc(Nc2[nH+]cc(C)cc2C)c1 ZINC001176297009 1048639739 /nfs/dbraw/zinc/63/97/39/1048639739.db2.gz HJLZHTYBVMFSNR-UHFFFAOYSA-N 1 2 315.392 4.063 20 0 DIADLO C[C@@]1(c2ccc(F)cc2)CC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000482588819 1048642166 /nfs/dbraw/zinc/64/21/66/1048642166.db2.gz HMIQRVASIYWGGF-OAHLLOKOSA-N 1 2 310.825 4.099 20 0 DIADLO C[C@@]1(c2ccc(F)cc2)CC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000482588819 1048642170 /nfs/dbraw/zinc/64/21/70/1048642170.db2.gz HMIQRVASIYWGGF-OAHLLOKOSA-N 1 2 310.825 4.099 20 0 DIADLO Cc1c[nH+]c(Nc2cccc3c2cnn3[C@H]2CCCCO2)c(C)c1 ZINC001176317306 1048650093 /nfs/dbraw/zinc/65/00/93/1048650093.db2.gz GAFOCPDHXWEMNR-GOSISDBHSA-N 1 2 322.412 4.491 20 0 DIADLO Oc1ccc2cc(Nc3ccc[nH+]c3N3CCCC3)ccc2c1 ZINC001176387007 1048653303 /nfs/dbraw/zinc/65/33/03/1048653303.db2.gz VMWZSJQFGGIFNF-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1ccc(Cl)cc1 ZINC000109324567 1048653583 /nfs/dbraw/zinc/65/35/83/1048653583.db2.gz LXWZQAZUXXYKHI-ZDUSSCGKSA-N 1 2 307.825 4.261 20 0 DIADLO Fc1cc(F)c(Nc2ccc(-n3cc[nH+]c3)cc2)c(F)c1F ZINC001176349146 1048655964 /nfs/dbraw/zinc/65/59/64/1048655964.db2.gz QYRTWCSDSYJENU-UHFFFAOYSA-N 1 2 307.250 4.172 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1cc2ccc(C)cc2[nH]1 ZINC000668098356 1048656183 /nfs/dbraw/zinc/65/61/83/1048656183.db2.gz GGHILAUEONPCRZ-IBGZPJMESA-N 1 2 322.456 4.420 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1cc2ccc(C)cc2[nH]1 ZINC000668098356 1048656195 /nfs/dbraw/zinc/65/61/95/1048656195.db2.gz GGHILAUEONPCRZ-IBGZPJMESA-N 1 2 322.456 4.420 20 0 DIADLO Fc1cc(F)c(Nc2cc(Cl)c3[nH+]ccn3c2)c(F)c1F ZINC001176349526 1048656217 /nfs/dbraw/zinc/65/62/17/1048656217.db2.gz JQOLXCLGYFYFJR-UHFFFAOYSA-N 1 2 315.657 4.288 20 0 DIADLO CC(C)c1nnc2n1CC[N@@H+](CCC1C[C@H](C)C[C@@H](C)C1)[C@H]2C ZINC001176373000 1048665341 /nfs/dbraw/zinc/66/53/41/1048665341.db2.gz LPEZGRLRFFLNHT-OAGGEKHMSA-N 1 2 318.509 4.241 20 0 DIADLO CC(C)c1nnc2n1CC[N@H+](CCC1C[C@H](C)C[C@@H](C)C1)[C@H]2C ZINC001176373000 1048665350 /nfs/dbraw/zinc/66/53/50/1048665350.db2.gz LPEZGRLRFFLNHT-OAGGEKHMSA-N 1 2 318.509 4.241 20 0 DIADLO CCC[C@H]([NH2+]Cc1nonc1C)c1ccc(Cl)c(Cl)c1 ZINC000775314078 1048667176 /nfs/dbraw/zinc/66/71/76/1048667176.db2.gz NPKWXEXDWRMSLQ-ZDUSSCGKSA-N 1 2 314.216 4.316 20 0 DIADLO CC(C)c1ccc(N(C)Cc2ncccc2C(F)(F)F)[nH+]c1 ZINC001165224483 1048668428 /nfs/dbraw/zinc/66/84/28/1048668428.db2.gz XVWWUBKANMGBSP-UHFFFAOYSA-N 1 2 309.335 4.255 20 0 DIADLO CN(Cc1ncccc1C(F)(F)F)c1[nH+]ccc2ccccc21 ZINC001165223187 1048668682 /nfs/dbraw/zinc/66/86/82/1048668682.db2.gz YRULLEDIVUPULW-UHFFFAOYSA-N 1 2 317.314 4.285 20 0 DIADLO Cc1nonc1C[NH2+][C@@H](C)c1ccc(Oc2ccccc2)cc1 ZINC000775332964 1048674439 /nfs/dbraw/zinc/67/44/39/1048674439.db2.gz QAOJCNFTOFCKKR-ZDUSSCGKSA-N 1 2 309.369 4.021 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2ccc(O)cc2F)cc[nH+]1 ZINC001176407842 1048676824 /nfs/dbraw/zinc/67/68/24/1048676824.db2.gz GSPZSXFAIHVJPA-UHFFFAOYSA-N 1 2 319.336 4.017 20 0 DIADLO F[C@@H]1CN(c2cc(SCc3ccccc3)cc[nH+]2)C[C@@H]2C[C@@H]21 ZINC001165366162 1048685129 /nfs/dbraw/zinc/68/51/29/1048685129.db2.gz CZBVUFKUXHRRPO-BHYGNILZSA-N 1 2 314.429 4.168 20 0 DIADLO CC(=O)OCc1cccc(Cl)c1Nc1[nH+]cc(C)cc1C ZINC001212775179 1048689695 /nfs/dbraw/zinc/68/96/95/1048689695.db2.gz UOFDTCNVQCZEAY-UHFFFAOYSA-N 1 2 304.777 4.159 20 0 DIADLO Fc1ccc(Br)cc1C[N@H+](Cc1ccoc1)C1CC1 ZINC001176496371 1048692893 /nfs/dbraw/zinc/69/28/93/1048692893.db2.gz QTMVCDOWCDJDAY-UHFFFAOYSA-N 1 2 324.193 4.346 20 0 DIADLO Fc1ccc(Br)cc1C[N@@H+](Cc1ccoc1)C1CC1 ZINC001176496371 1048692904 /nfs/dbraw/zinc/69/29/04/1048692904.db2.gz QTMVCDOWCDJDAY-UHFFFAOYSA-N 1 2 324.193 4.346 20 0 DIADLO COc1nscc1C[N@H+](C)Cc1cccc(C(C)(C)C)c1 ZINC001176474586 1048693528 /nfs/dbraw/zinc/69/35/28/1048693528.db2.gz NJHSHZWWQYFGPH-UHFFFAOYSA-N 1 2 304.459 4.081 20 0 DIADLO COc1nscc1C[N@@H+](C)Cc1cccc(C(C)(C)C)c1 ZINC001176474586 1048693533 /nfs/dbraw/zinc/69/35/33/1048693533.db2.gz NJHSHZWWQYFGPH-UHFFFAOYSA-N 1 2 304.459 4.081 20 0 DIADLO Cc1cc([C@@H]2CCCC[N@@H+]2Cc2ccc(C)cc2Cl)[nH]n1 ZINC001176486329 1048695246 /nfs/dbraw/zinc/69/52/46/1048695246.db2.gz SKOONLXYFKPHOD-KRWDZBQOSA-N 1 2 303.837 4.407 20 0 DIADLO Cc1cc([C@@H]2CCCC[N@H+]2Cc2ccc(C)cc2Cl)[nH]n1 ZINC001176486329 1048695249 /nfs/dbraw/zinc/69/52/49/1048695249.db2.gz SKOONLXYFKPHOD-KRWDZBQOSA-N 1 2 303.837 4.407 20 0 DIADLO FC(F)(F)C1CCC(Nc2[nH+]cccc2-n2cccc2)CC1 ZINC001165600089 1048701464 /nfs/dbraw/zinc/70/14/64/1048701464.db2.gz VPPOVQCQBJLDRI-UHFFFAOYSA-N 1 2 309.335 4.405 20 0 DIADLO FC(F)(F)Oc1cccc(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001176535778 1048709808 /nfs/dbraw/zinc/70/98/08/1048709808.db2.gz NMSHBNWFNPNISB-UHFFFAOYSA-N 1 2 323.318 4.324 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@@H+]1CCO[C@@H](c3cccc(F)c3)C1)CC2 ZINC000482953244 1048711693 /nfs/dbraw/zinc/71/16/93/1048711693.db2.gz WAJGLPOFCVOYAR-RBUKOAKNSA-N 1 2 315.363 4.026 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@H+]1CCO[C@@H](c3cccc(F)c3)C1)CC2 ZINC000482953244 1048711701 /nfs/dbraw/zinc/71/17/01/1048711701.db2.gz WAJGLPOFCVOYAR-RBUKOAKNSA-N 1 2 315.363 4.026 20 0 DIADLO COC(=O)c1cc(Nc2ccc([NH+]3CCCCC3)cc2)cs1 ZINC001203718205 1048712746 /nfs/dbraw/zinc/71/27/46/1048712746.db2.gz WAGGVCHXESKDER-UHFFFAOYSA-N 1 2 316.426 4.269 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000482966298 1048714661 /nfs/dbraw/zinc/71/46/61/1048714661.db2.gz VWOYPXQHGYSOLJ-IBGZPJMESA-N 1 2 308.425 4.196 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[N@H+]1CC[C@H]1c1ccccc1 ZINC000482966298 1048714674 /nfs/dbraw/zinc/71/46/74/1048714674.db2.gz VWOYPXQHGYSOLJ-IBGZPJMESA-N 1 2 308.425 4.196 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(s1)CCCC2)c1cccc(F)c1F ZINC000776492251 1048715398 /nfs/dbraw/zinc/71/53/98/1048715398.db2.gz UMQBAZPJZRQFIT-SNVBAGLBSA-N 1 2 308.397 4.151 20 0 DIADLO COc1ccccc1Cc1cn(CC2CCC(F)(F)CC2)c[nH+]1 ZINC001190284609 1048716771 /nfs/dbraw/zinc/71/67/71/1048716771.db2.gz ZHQIBLBOELAMJF-UHFFFAOYSA-N 1 2 320.383 4.308 20 0 DIADLO O=c1cc(Nc2ccc([NH+]3CCCCC3)cc2)cc(Cl)[nH]1 ZINC001203718286 1048717067 /nfs/dbraw/zinc/71/70/67/1048717067.db2.gz AAYQSRWMKJXPOV-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc(SC(F)F)cc1 ZINC000109577363 1048718937 /nfs/dbraw/zinc/71/89/37/1048718937.db2.gz HZWORTUAARYGKU-LBPRGKRZSA-N 1 2 308.397 4.380 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccc(SC(F)F)cc1 ZINC000109577363 1048718950 /nfs/dbraw/zinc/71/89/50/1048718950.db2.gz HZWORTUAARYGKU-LBPRGKRZSA-N 1 2 308.397 4.380 20 0 DIADLO CC(C)c1ccc(N2C[C@H]3[C@@H](C2)CCC[C@H]3OCC2CC2)[nH+]c1 ZINC001166113970 1048735405 /nfs/dbraw/zinc/73/54/05/1048735405.db2.gz LSDGKAOTCJYXOD-CEXWTWQISA-N 1 2 314.473 4.237 20 0 DIADLO Cc1nc(NCC(C)(c2ccccc2)c2ccccc2)cc[nH+]1 ZINC001166166795 1048738246 /nfs/dbraw/zinc/73/82/46/1048738246.db2.gz WKCLLLAXZAGIOK-UHFFFAOYSA-N 1 2 303.409 4.203 20 0 DIADLO CC[C@@](C)([NH2+]Cc1noc(-c2ccsc2)n1)c1ccccc1 ZINC000775394206 1048749284 /nfs/dbraw/zinc/74/92/84/1048749284.db2.gz KEINSRFALCENLN-QGZVFWFLSA-N 1 2 313.426 4.213 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3c(F)cc(F)c(O)c3F)ccc12 ZINC001176671308 1048754420 /nfs/dbraw/zinc/75/44/20/1048754420.db2.gz WYQJOZBVXGCUJJ-UHFFFAOYSA-N 1 2 304.271 4.410 20 0 DIADLO Cc1[nH+]ccn1-c1ccc(Nc2c(F)cc(F)c(O)c2F)cc1 ZINC001176672471 1048756114 /nfs/dbraw/zinc/75/61/14/1048756114.db2.gz XBYIRIHJXSGBMV-UHFFFAOYSA-N 1 2 319.286 4.047 20 0 DIADLO CCc1cccc(C[NH2+][C@H](CO)c2c(Cl)cccc2Cl)c1 ZINC000483239589 1048761259 /nfs/dbraw/zinc/76/12/59/1048761259.db2.gz GBXXOCNVGISIKY-MRXNPFEDSA-N 1 2 324.251 4.379 20 0 DIADLO CSCc1cc[nH+]c(N2CCC[C@H](Cc3ccccc3)C2)c1 ZINC001166563459 1048761207 /nfs/dbraw/zinc/76/12/07/1048761207.db2.gz HSUPBWRMTSOFAQ-QGZVFWFLSA-N 1 2 312.482 4.404 20 0 DIADLO Cc1cn2cccc(Nc3ccc(-c4ccncc4)cc3)c2[nH+]1 ZINC001176698201 1048761657 /nfs/dbraw/zinc/76/16/57/1048761657.db2.gz XDLKIAJDUUTFRS-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+](CCCC)[C@@H](C)c1ccc(C)o1 ZINC001190588819 1048762053 /nfs/dbraw/zinc/76/20/53/1048762053.db2.gz FYIYQVNSJBUQDT-HOTGVXAUSA-N 1 2 309.450 4.483 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+](CCCC)[C@@H](C)c1ccc(C)o1 ZINC001190588819 1048762066 /nfs/dbraw/zinc/76/20/66/1048762066.db2.gz FYIYQVNSJBUQDT-HOTGVXAUSA-N 1 2 309.450 4.483 20 0 DIADLO Cc1cccc2c(C)cc(N3CC[C@@H](c4ccncc4)C3)[nH+]c12 ZINC001166570028 1048763065 /nfs/dbraw/zinc/76/30/65/1048763065.db2.gz WDIWZVSLDWTSQV-QGZVFWFLSA-N 1 2 303.409 4.241 20 0 DIADLO CC(C)(C)c1cn(Cc2cc(F)cc(Br)c2)c[nH+]1 ZINC001166618929 1048773132 /nfs/dbraw/zinc/77/31/32/1048773132.db2.gz NFUYHTPVBMKBOX-UHFFFAOYSA-N 1 2 311.198 4.131 20 0 DIADLO c1ccc([C@H]2COCC[N@H+]2Cc2ccc(OCC3CC3)cc2)cc1 ZINC000483286249 1048773152 /nfs/dbraw/zinc/77/31/52/1048773152.db2.gz PVCSQPYYZNBHQU-OAQYLSRUSA-N 1 2 323.436 4.049 20 0 DIADLO c1ccc([C@H]2COCC[N@@H+]2Cc2ccc(OCC3CC3)cc2)cc1 ZINC000483286249 1048773164 /nfs/dbraw/zinc/77/31/64/1048773164.db2.gz PVCSQPYYZNBHQU-OAQYLSRUSA-N 1 2 323.436 4.049 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[NH+]1CCC(C)(CC)CC1 ZINC001190690758 1048777723 /nfs/dbraw/zinc/77/77/23/1048777723.db2.gz IZODYBSZYVLVHR-MRXNPFEDSA-N 1 2 323.864 4.456 20 0 DIADLO Brc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1 ZINC001176749173 1048777884 /nfs/dbraw/zinc/77/78/84/1048777884.db2.gz YLLRPYSQDYDYRN-UHFFFAOYSA-N 1 2 318.218 4.188 20 0 DIADLO Clc1nccc(Nc2ccc[nH+]c2N2CCCC2)c1Cl ZINC001176743385 1048778418 /nfs/dbraw/zinc/77/84/18/1048778418.db2.gz JGOVTWAKUQYGBF-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO Cc1cc(Nc2ccc[nH+]c2N2CCCC2)c2ccsc2n1 ZINC001176748865 1048778831 /nfs/dbraw/zinc/77/88/31/1048778831.db2.gz FXEATPQIYMUWJN-UHFFFAOYSA-N 1 2 310.426 4.344 20 0 DIADLO Clc1ccc(Nc2ccc[nH+]c2N2CCCC2)c(Cl)n1 ZINC001176743796 1048779090 /nfs/dbraw/zinc/77/90/90/1048779090.db2.gz MVJVCWOPYJERBF-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO c1csc(-c2cc(Nc3ccc[nH+]c3N3CCCC3)on2)c1 ZINC001176749367 1048779109 /nfs/dbraw/zinc/77/91/09/1048779109.db2.gz DZYHMQIWCMJQKE-UHFFFAOYSA-N 1 2 312.398 4.142 20 0 DIADLO C[N@H+](Cc1nnc(C(F)(F)F)s1)C1CCCCCCC1 ZINC000851743152 1048798241 /nfs/dbraw/zinc/79/82/41/1048798241.db2.gz ZSTQFPAURQFYEQ-UHFFFAOYSA-N 1 2 307.385 4.102 20 0 DIADLO C[N@@H+](Cc1nnc(C(F)(F)F)s1)C1CCCCCCC1 ZINC000851743152 1048798251 /nfs/dbraw/zinc/79/82/51/1048798251.db2.gz ZSTQFPAURQFYEQ-UHFFFAOYSA-N 1 2 307.385 4.102 20 0 DIADLO FCc1ccccc1C[N@@H+]1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC001190791467 1048786465 /nfs/dbraw/zinc/78/64/65/1048786465.db2.gz NBTGZMPZYSOQTJ-GOSISDBHSA-N 1 2 321.342 4.008 20 0 DIADLO FCc1ccccc1C[N@H+]1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC001190791467 1048786474 /nfs/dbraw/zinc/78/64/74/1048786474.db2.gz NBTGZMPZYSOQTJ-GOSISDBHSA-N 1 2 321.342 4.008 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1ccnc(Cl)c1Cl ZINC000811459635 1048788782 /nfs/dbraw/zinc/78/87/82/1048788782.db2.gz JRJVWMQKKHLRNJ-UHFFFAOYSA-N 1 2 301.139 4.163 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1ccnc(Cl)c1Cl ZINC000811459635 1048788795 /nfs/dbraw/zinc/78/87/95/1048788795.db2.gz JRJVWMQKKHLRNJ-UHFFFAOYSA-N 1 2 301.139 4.163 20 0 DIADLO COC(C)(C)[C@H]1CCCN1c1cc(C2CCCCC2)[nH+]c(C)n1 ZINC001166795795 1048794490 /nfs/dbraw/zinc/79/44/90/1048794490.db2.gz LJRGDQXIFNAKPE-QGZVFWFLSA-N 1 2 317.477 4.227 20 0 DIADLO c1ccc(CN(c2[nH+]ccc3ccccc32)C2CCOCC2)cc1 ZINC001166809127 1048798301 /nfs/dbraw/zinc/79/83/01/1048798301.db2.gz GWNFDVAMEBWRJR-UHFFFAOYSA-N 1 2 318.420 4.420 20 0 DIADLO CCc1cn(Cc2c(C)cc(C)nc2OCc2ccccc2)c[nH+]1 ZINC001166822991 1048799795 /nfs/dbraw/zinc/79/97/95/1048799795.db2.gz PTAIQRUWUVEYNU-UHFFFAOYSA-N 1 2 321.424 4.085 20 0 DIADLO CC[C@H](CC(F)F)C[N@@H+]1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000851746944 1048800638 /nfs/dbraw/zinc/80/06/38/1048800638.db2.gz CVTMHQZCJRLFMO-IAQYHMDHSA-N 1 2 319.342 4.020 20 0 DIADLO CC[C@H](CC(F)F)C[N@H+]1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000851746944 1048800662 /nfs/dbraw/zinc/80/06/62/1048800662.db2.gz CVTMHQZCJRLFMO-IAQYHMDHSA-N 1 2 319.342 4.020 20 0 DIADLO CC[C@H](CC(F)F)C[N@@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000851746942 1048802397 /nfs/dbraw/zinc/80/23/97/1048802397.db2.gz CVTMHQZCJRLFMO-ABAIWWIYSA-N 1 2 319.342 4.020 20 0 DIADLO CC[C@H](CC(F)F)C[N@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000851746942 1048802413 /nfs/dbraw/zinc/80/24/13/1048802413.db2.gz CVTMHQZCJRLFMO-ABAIWWIYSA-N 1 2 319.342 4.020 20 0 DIADLO Clc1cc(Br)cnc1C[N@@H+]1CCCC12CCC2 ZINC000851989462 1048816334 /nfs/dbraw/zinc/81/63/34/1048816334.db2.gz IRZVJIOZUHXKJE-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Clc1cc(Br)cnc1C[N@H+]1CCCC12CCC2 ZINC000851989462 1048816347 /nfs/dbraw/zinc/81/63/47/1048816347.db2.gz IRZVJIOZUHXKJE-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Fc1cccc(C[NH+]2CCC(=Cc3ccc(F)c(F)c3)CC2)n1 ZINC000851944169 1048816731 /nfs/dbraw/zinc/81/67/31/1048816731.db2.gz KIIWLXMBCBMCBA-UHFFFAOYSA-N 1 2 318.342 4.178 20 0 DIADLO CC[C@H](CC(F)F)Cn1c[nH+]c(Cc2ccccc2OC)c1 ZINC001166964782 1048817725 /nfs/dbraw/zinc/81/77/25/1048817725.db2.gz XTBPDKVUGNZIAZ-CYBMUJFWSA-N 1 2 308.372 4.164 20 0 DIADLO Cc1cn2cc(NC(=O)C[C@@H](c3ccccc3)C(C)C)ccc2[nH+]1 ZINC000483611888 1048824004 /nfs/dbraw/zinc/82/40/04/1048824004.db2.gz HKYRVBUDJOJLPG-GOSISDBHSA-N 1 2 321.424 4.411 20 0 DIADLO FC(F)(F)C[C@@H]1CCCC[C@@H]1[NH2+]CC(F)(F)Br ZINC000852115053 1048825483 /nfs/dbraw/zinc/82/54/83/1048825483.db2.gz ZXSJMRZEHUMXAQ-YUMQZZPRSA-N 1 2 324.131 4.075 20 0 DIADLO CCc1ccc([C@@H](CNCc2ccc(C)cc2F)[NH+](C)C)cc1 ZINC001177097732 1048828481 /nfs/dbraw/zinc/82/84/81/1048828481.db2.gz AIUDHMKNAYKDPF-HXUWFJFHSA-N 1 2 314.448 4.089 20 0 DIADLO COc1ccc2cc[nH+]c(N3CCC[C@H]3c3nccs3)c2c1 ZINC001167040856 1048836287 /nfs/dbraw/zinc/83/62/87/1048836287.db2.gz CTSSLPUVBQMSMA-HNNXBMFYSA-N 1 2 311.410 4.041 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc2c(c1)CCCO2 ZINC000852782660 1048860083 /nfs/dbraw/zinc/86/00/83/1048860083.db2.gz LLCFSNXDBWNAIW-CYBMUJFWSA-N 1 2 314.429 4.148 20 0 DIADLO CC(C)(C)c1ccc(NC(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC001191125658 1048861579 /nfs/dbraw/zinc/86/15/79/1048861579.db2.gz LWFZSNGVKOOZEQ-UHFFFAOYSA-N 1 2 308.385 4.276 20 0 DIADLO Cc1[nH]c(CNc2ccc(OC(F)(F)F)cc2Cl)[nH+]c1C ZINC000853094656 1048881319 /nfs/dbraw/zinc/88/13/19/1048881319.db2.gz IZFGUQWJRKEEGH-UHFFFAOYSA-N 1 2 319.714 4.191 20 0 DIADLO Cc1ccc(Nc2cc(C)c(Br)c(C)n2)c(C)[nH+]1 ZINC001203362961 1048882395 /nfs/dbraw/zinc/88/23/95/1048882395.db2.gz IQDLNLJCWIHHMS-UHFFFAOYSA-N 1 2 306.207 4.216 20 0 DIADLO COc1ccccc1Cn1ncc(C)c1Nc1ccc(C)[nH+]c1C ZINC001203369255 1048883056 /nfs/dbraw/zinc/88/30/56/1048883056.db2.gz NCNNARAQZLFTGI-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1cc([C@@H]2CCCN2c2cc(C(F)(F)F)cc(C)[nH+]2)no1 ZINC000853136907 1048884944 /nfs/dbraw/zinc/88/49/44/1048884944.db2.gz PBVPOGXPRLMSQG-ZDUSSCGKSA-N 1 2 311.307 4.047 20 0 DIADLO CNc1ccc(Nc2ccc(Oc3cc[nH+]c(C)c3)cc2)cn1 ZINC001203460281 1048906259 /nfs/dbraw/zinc/90/62/59/1048906259.db2.gz SVGZKXGMKJNYAI-UHFFFAOYSA-N 1 2 306.369 4.363 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+]C(C)(C)c2cccc(Cl)c2)o1 ZINC000775445448 1048908620 /nfs/dbraw/zinc/90/86/20/1048908620.db2.gz HTVSSXLPGGWCHA-UHFFFAOYSA-N 1 2 307.825 4.045 20 0 DIADLO Cc1ccc2[nH+]c(NCc3cccc(OC4CC4)c3F)[nH]c2c1 ZINC001203478806 1048911517 /nfs/dbraw/zinc/91/15/17/1048911517.db2.gz JEKCAUSVMXZKJR-UHFFFAOYSA-N 1 2 311.360 4.164 20 0 DIADLO Nc1c(F)cccc1CNc1[nH+]c2ccccc2n1C1CCCC1 ZINC001203523371 1048917893 /nfs/dbraw/zinc/91/78/93/1048917893.db2.gz YXLNNKYQFPFNKN-UHFFFAOYSA-N 1 2 324.403 4.485 20 0 DIADLO Brc1ccc2[nH]c(NCC3CCCCC3)[nH+]c2c1 ZINC001203529857 1048923476 /nfs/dbraw/zinc/92/34/76/1048923476.db2.gz KYNWFLPMRUEFQJ-UHFFFAOYSA-N 1 2 308.223 4.318 20 0 DIADLO Brc1ccc2[nH+]c(NCC3CCCCC3)[nH]c2c1 ZINC001203529857 1048923489 /nfs/dbraw/zinc/92/34/89/1048923489.db2.gz KYNWFLPMRUEFQJ-UHFFFAOYSA-N 1 2 308.223 4.318 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[NH2+]Cc1nc(C)c2ccccc2n1 ZINC001177612246 1048923711 /nfs/dbraw/zinc/92/37/11/1048923711.db2.gz SYHLOCRKMDEKTO-UHFFFAOYSA-N 1 2 323.440 4.427 20 0 DIADLO COc1ccc(F)c(CNc2[nH+]c3ccccc3n2C2CC2)c1 ZINC001203536419 1048924227 /nfs/dbraw/zinc/92/42/27/1048924227.db2.gz RTPVXVQMOJWTFX-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO COc1cccc(Nc2cc(C)c[nH+]c2C)c1Br ZINC001203661677 1048955101 /nfs/dbraw/zinc/95/51/01/1048955101.db2.gz YJONPUKDUUWFIG-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Brc1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)cc1 ZINC001191390380 1048930236 /nfs/dbraw/zinc/93/02/36/1048930236.db2.gz LHOBZFVFHOPJLI-MRXNPFEDSA-N 1 2 302.215 4.396 20 0 DIADLO Brc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)cc1 ZINC001191390380 1048930243 /nfs/dbraw/zinc/93/02/43/1048930243.db2.gz LHOBZFVFHOPJLI-MRXNPFEDSA-N 1 2 302.215 4.396 20 0 DIADLO Cc1ccc(F)cc1NC(=O)Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001191410608 1048939572 /nfs/dbraw/zinc/93/95/72/1048939572.db2.gz ONOWMLWIHPVTQY-UHFFFAOYSA-N 1 2 324.359 4.023 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(Cl)nc2Br)c1 ZINC001203656623 1048940231 /nfs/dbraw/zinc/94/02/31/1048940231.db2.gz XOYMRDDSLVTTMZ-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO CC[NH2+]Cc1noc([C@@H](CC(C)C)c2ccc(Cl)cc2)n1 ZINC000854132130 1048940883 /nfs/dbraw/zinc/94/08/83/1048940883.db2.gz MOABHSRTBXCRQY-AWEZNQCLSA-N 1 2 307.825 4.011 20 0 DIADLO Cc1cc(Oc2ccc(Nc3ccc(N)nc3F)cc2)cc[nH+]1 ZINC001203621585 1048942276 /nfs/dbraw/zinc/94/22/76/1048942276.db2.gz QSOFMFVLRDZGAR-UHFFFAOYSA-N 1 2 310.332 4.042 20 0 DIADLO Clc1ccnc(C[N@@H+]2CC[C@@H]2Cc2ccccc2)c1Cl ZINC001191437367 1048947125 /nfs/dbraw/zinc/94/71/25/1048947125.db2.gz SCAOFEUCGGMFSC-CYBMUJFWSA-N 1 2 307.224 4.205 20 0 DIADLO Clc1ccnc(C[N@H+]2CC[C@@H]2Cc2ccccc2)c1Cl ZINC001191437367 1048947137 /nfs/dbraw/zinc/94/71/37/1048947137.db2.gz SCAOFEUCGGMFSC-CYBMUJFWSA-N 1 2 307.224 4.205 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(NC(=O)OC(C)(C)C)nc2)c1 ZINC001203656962 1048950011 /nfs/dbraw/zinc/95/00/11/1048950011.db2.gz FUVHFYHPCVSHSD-UHFFFAOYSA-N 1 2 314.389 4.184 20 0 DIADLO Clc1cnc(NCc2ccc(-n3cc[nH+]c3)cc2)c(Cl)c1 ZINC000776721607 1048954497 /nfs/dbraw/zinc/95/44/97/1048954497.db2.gz AVBNFSGNOFBQDD-UHFFFAOYSA-N 1 2 319.195 4.186 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(C(=O)N3CCCCC3)cc2)c1 ZINC001203663289 1048955033 /nfs/dbraw/zinc/95/50/33/1048955033.db2.gz MQFSBWOVSBMLQY-UHFFFAOYSA-N 1 2 309.413 4.068 20 0 DIADLO O=C1CC[N@@H+](Cc2ccccc2C(F)(F)F)[C@H]2CCCC[C@H]12 ZINC001203684413 1048963579 /nfs/dbraw/zinc/96/35/79/1048963579.db2.gz VDQPPUADTSRELD-ZFWWWQNUSA-N 1 2 311.347 4.039 20 0 DIADLO O=C1CC[N@H+](Cc2ccccc2C(F)(F)F)[C@H]2CCCC[C@H]12 ZINC001203684413 1048963588 /nfs/dbraw/zinc/96/35/88/1048963588.db2.gz VDQPPUADTSRELD-ZFWWWQNUSA-N 1 2 311.347 4.039 20 0 DIADLO C[C@H](C(=O)Nc1ccc(C2CC2)c2ccccc12)n1cc[nH+]c1 ZINC001177927134 1048964247 /nfs/dbraw/zinc/96/42/47/1048964247.db2.gz UPLJXKSDDHDIAA-CYBMUJFWSA-N 1 2 305.381 4.113 20 0 DIADLO Clc1cscc1C[NH2+]Cc1c(Cl)cncc1Cl ZINC001203699451 1048969490 /nfs/dbraw/zinc/96/94/90/1048969490.db2.gz UAUZZXJBXFJCDU-UHFFFAOYSA-N 1 2 307.633 4.393 20 0 DIADLO c1cnn(-c2ncccc2Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001203712600 1048972339 /nfs/dbraw/zinc/97/23/39/1048972339.db2.gz LLQPXISMTGXIIK-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO FC(F)(F)c1cnc(Nc2ccc([NH+]3CCCCC3)cc2)nc1 ZINC001203712689 1048973924 /nfs/dbraw/zinc/97/39/24/1048973924.db2.gz MHWFMJRAYIDZJN-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO O=c1cc(Cl)[nH]cc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203717488 1048975106 /nfs/dbraw/zinc/97/51/06/1048975106.db2.gz CZPIPJDSZCQIET-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO c1cc2nccnc2c(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001203718823 1048975669 /nfs/dbraw/zinc/97/56/69/1048975669.db2.gz CAVXLSQILHCMNZ-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO c1cc([NH+]2CCCCC2)ccc1Nc1cncc(N2CCCC2)c1 ZINC001203718401 1048975681 /nfs/dbraw/zinc/97/56/81/1048975681.db2.gz GFHVERJNIBTSRR-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO O=C1OCc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc21 ZINC001203718386 1048975808 /nfs/dbraw/zinc/97/58/08/1048975808.db2.gz FRXFWIZTGLENHF-UHFFFAOYSA-N 1 2 308.381 4.091 20 0 DIADLO CCc1cnn2cc(Nc3ccc([NH+]4CCCCC4)cc3)cnc12 ZINC001203718568 1048976082 /nfs/dbraw/zinc/97/60/82/1048976082.db2.gz GISOGKMVHUHDAR-UHFFFAOYSA-N 1 2 321.428 4.026 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3cc(C)ccc3Cl)ccc2[nH+]1 ZINC001191677514 1048976385 /nfs/dbraw/zinc/97/63/85/1048976385.db2.gz YBUUZKNPUJZDPE-UHFFFAOYSA-N 1 2 314.776 4.249 20 0 DIADLO c1nnc(-c2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc2)o1 ZINC001203719261 1048976514 /nfs/dbraw/zinc/97/65/14/1048976514.db2.gz MFQZCHIUUUXSGQ-UHFFFAOYSA-N 1 2 320.396 4.471 20 0 DIADLO c1cc(Nc2ccc([NH+]3CCCCC3)cc2)n(-c2ccccn2)n1 ZINC001203719021 1048976935 /nfs/dbraw/zinc/97/69/35/1048976935.db2.gz PCTDRDOMGLQRFX-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO CCOCc1cccc(NCc2cc(C)[nH+]c3c2CCCC3)c1 ZINC001178055817 1048980017 /nfs/dbraw/zinc/98/00/17/1048980017.db2.gz QBCZBYGNRCYOMA-UHFFFAOYSA-N 1 2 310.441 4.417 20 0 DIADLO OCc1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1F ZINC001203726412 1048980790 /nfs/dbraw/zinc/98/07/90/1048980790.db2.gz ZYTAACXOYZBJIB-UHFFFAOYSA-N 1 2 300.377 4.052 20 0 DIADLO O=C1NCc2c(Nc3ccc([NH+]4CCCCC4)cc3)cccc2N1 ZINC001203724510 1048981091 /nfs/dbraw/zinc/98/10/91/1048981091.db2.gz PMHGRNXXKWPSSO-UHFFFAOYSA-N 1 2 322.412 4.056 20 0 DIADLO CN1Cc2c(cccc2Nc2ccc([NH+]3CCCCC3)cc2)C1=O ZINC001203725025 1048982538 /nfs/dbraw/zinc/98/25/38/1048982538.db2.gz ZLGSOTMVERHGND-UHFFFAOYSA-N 1 2 321.424 4.006 20 0 DIADLO c1cc2nnsc2c(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001203724665 1048982994 /nfs/dbraw/zinc/98/29/94/1048982994.db2.gz VESMEAQBBIUJDV-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO CCO[C@@H](c1noc([C@H]2CC[N@@H+]2C2CCCC2)n1)C1CCCC1 ZINC000904136240 1048984413 /nfs/dbraw/zinc/98/44/13/1048984413.db2.gz JNTVGNXUJNNFOK-HZPDHXFCSA-N 1 2 319.449 4.027 20 0 DIADLO CCO[C@@H](c1noc([C@H]2CC[N@H+]2C2CCCC2)n1)C1CCCC1 ZINC000904136240 1048984425 /nfs/dbraw/zinc/98/44/25/1048984425.db2.gz JNTVGNXUJNNFOK-HZPDHXFCSA-N 1 2 319.449 4.027 20 0 DIADLO CCCc1cc(C(=O)NCc2cc(C)[nH+]c(C)c2)ccc1Cl ZINC001276417494 1048985565 /nfs/dbraw/zinc/98/55/65/1048985565.db2.gz AWQIOEBQRGTJKQ-UHFFFAOYSA-N 1 2 316.832 4.234 20 0 DIADLO Cc1cc(CNC(=O)CCc2ccc(CC(C)C)cc2)cc(C)[nH+]1 ZINC001276417942 1048991177 /nfs/dbraw/zinc/99/11/77/1048991177.db2.gz GQDDDHCBEXVZSN-UHFFFAOYSA-N 1 2 324.468 4.146 20 0 DIADLO Cc1cc(NCc2cccc3cnccc32)ccc1-n1cc[nH+]c1 ZINC001178139150 1048991195 /nfs/dbraw/zinc/99/11/95/1048991195.db2.gz OSGPWRNQOGDWIV-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Cc1cc(CNC(=O)c2cc3cccc(C)c3s2)cc(C)[nH+]1 ZINC001276419681 1048995778 /nfs/dbraw/zinc/99/57/78/1048995778.db2.gz XWBRFXUSQCPDII-UHFFFAOYSA-N 1 2 310.422 4.152 20 0 DIADLO CCNc1ccccc1CNc1cc(CSCC)cc[nH+]1 ZINC001178188367 1048996170 /nfs/dbraw/zinc/99/61/70/1048996170.db2.gz XJSAIGXBEFAAPJ-UHFFFAOYSA-N 1 2 301.459 4.379 20 0 DIADLO Fc1ccc([C@H]2CSCC[N@@H+]2Cc2cccc(F)c2)cc1 ZINC001203785341 1048997180 /nfs/dbraw/zinc/99/71/80/1048997180.db2.gz BDNJUYVGNLUUMG-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1ccc([C@H]2CSCC[N@H+]2Cc2cccc(F)c2)cc1 ZINC001203785341 1048997193 /nfs/dbraw/zinc/99/71/93/1048997193.db2.gz BDNJUYVGNLUUMG-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO Cc1nc2c(s1)[C@H](Nc1ccc([NH+](C)C)cc1C)CCC2 ZINC000776767162 1049001457 /nfs/dbraw/zinc/00/14/57/1049001457.db2.gz ZKJZQKHVFCLPLI-MRXNPFEDSA-N 1 2 301.459 4.315 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H]1CCc2c1cc(F)cc2F ZINC000776767384 1049002401 /nfs/dbraw/zinc/00/24/01/1049002401.db2.gz XMMYNJRHYZMQRD-SFHVURJKSA-N 1 2 302.368 4.439 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H]1CCc2c1c(F)ccc2F ZINC000776766716 1049003803 /nfs/dbraw/zinc/00/38/03/1049003803.db2.gz MJXHKKPDBUMYSV-KRWDZBQOSA-N 1 2 302.368 4.439 20 0 DIADLO OCc1ccc2c(c1)CC[N@@H+](Cc1cc(Cl)cc(Cl)c1)C2 ZINC001203809177 1049004948 /nfs/dbraw/zinc/00/49/48/1049004948.db2.gz XXCVAYLLYNOMSJ-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO OCc1ccc2c(c1)CC[N@H+](Cc1cc(Cl)cc(Cl)c1)C2 ZINC001203809177 1049004954 /nfs/dbraw/zinc/00/49/54/1049004954.db2.gz XXCVAYLLYNOMSJ-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO c1cn(-c2csc(CNc3cccc(-c4ccon4)c3)c2)c[nH+]1 ZINC001203809537 1049005268 /nfs/dbraw/zinc/00/52/68/1049005268.db2.gz JGSQGTQMNGPCQT-UHFFFAOYSA-N 1 2 322.393 4.201 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC001191820520 1049007034 /nfs/dbraw/zinc/00/70/34/1049007034.db2.gz DWKRLWBFAZTRAR-AWEZNQCLSA-N 1 2 321.848 4.161 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC001191820520 1049007050 /nfs/dbraw/zinc/00/70/50/1049007050.db2.gz DWKRLWBFAZTRAR-AWEZNQCLSA-N 1 2 321.848 4.161 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1noc(-c2cc(C3CC3)oc2C2CC2)n1 ZINC000904264029 1049007434 /nfs/dbraw/zinc/00/74/34/1049007434.db2.gz CIUQYHRXIKSXLR-UHFFFAOYSA-N 1 2 322.368 4.037 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1noc([C@H]2CCC[C@H]2c2ccccc2)n1 ZINC000904263480 1049007877 /nfs/dbraw/zinc/00/78/77/1049007877.db2.gz ZUDUPSIEPRSFKS-HOTGVXAUSA-N 1 2 320.396 4.074 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1noc([C@H]2CCC[C@@H]2c2ccccc2)n1 ZINC000904268625 1049009663 /nfs/dbraw/zinc/00/96/63/1049009663.db2.gz XJSMHQRLGSEYHO-CABCVRRESA-N 1 2 320.396 4.074 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CCOc4cccc(F)c4C3)ccc2n1 ZINC000338968991 1049017397 /nfs/dbraw/zinc/01/73/97/1049017397.db2.gz UBXPWVAGDMBOPY-UHFFFAOYSA-N 1 2 322.383 4.077 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CCOc4cccc(F)c4C3)ccc2n1 ZINC000338968991 1049017407 /nfs/dbraw/zinc/01/74/07/1049017407.db2.gz UBXPWVAGDMBOPY-UHFFFAOYSA-N 1 2 322.383 4.077 20 0 DIADLO C[NH+](C)[C@@H](c1nc(-c2ccsc2)no1)c1ccc(Cl)cc1 ZINC000904298391 1049023339 /nfs/dbraw/zinc/02/33/39/1049023339.db2.gz AKWGQLMXBWAJKJ-CYBMUJFWSA-N 1 2 319.817 4.103 20 0 DIADLO C[NH+](C)[C@H](c1nc(-c2ccsc2)no1)c1ccc(Cl)cc1 ZINC000904298394 1049024017 /nfs/dbraw/zinc/02/40/17/1049024017.db2.gz AKWGQLMXBWAJKJ-ZDUSSCGKSA-N 1 2 319.817 4.103 20 0 DIADLO C[C@H](Nc1ccc([NH+]2CCCC2)cc1)c1ccc2c(c1)COC2 ZINC000776802291 1049024919 /nfs/dbraw/zinc/02/49/19/1049024919.db2.gz DMZCVBORQDDDNS-HNNXBMFYSA-N 1 2 308.425 4.490 20 0 DIADLO Cc1cc(NCc2ccc(OCC(F)F)cc2)ccc1[NH+](C)C ZINC001178360280 1049027293 /nfs/dbraw/zinc/02/72/93/1049027293.db2.gz LLPSOHXJHFMUKA-UHFFFAOYSA-N 1 2 320.383 4.317 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CC[C@@H]2SCCS[C@@H]12 ZINC000776803126 1049028117 /nfs/dbraw/zinc/02/81/17/1049028117.db2.gz SKDSAKPVYCPMOX-IKGGRYGDSA-N 1 2 320.527 4.078 20 0 DIADLO Cc1ccc(N(C)Cc2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC001192022780 1049030824 /nfs/dbraw/zinc/03/08/24/1049030824.db2.gz PAQXUHCBRYNDCP-UHFFFAOYSA-N 1 2 311.816 4.471 20 0 DIADLO Fc1ccc(C[N@@H+]2CCSC[C@@H]2c2ccc(F)cc2)cc1 ZINC001203917034 1049031016 /nfs/dbraw/zinc/03/10/16/1049031016.db2.gz DNMSWTISTPQDAP-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1ccc(C[N@H+]2CCSC[C@@H]2c2ccc(F)cc2)cc1 ZINC001203917034 1049031033 /nfs/dbraw/zinc/03/10/33/1049031033.db2.gz DNMSWTISTPQDAP-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO C[C@H]1CCN(CCCn2cc[nH+]c2)c2cc(Cl)ccc2S1 ZINC001192043938 1049033292 /nfs/dbraw/zinc/03/32/92/1049033292.db2.gz YJIDJZPSNBHEDU-ZDUSSCGKSA-N 1 2 321.877 4.318 20 0 DIADLO COc1ccc(-c2ccc(N(C)c3[nH+]cccc3N)cc2)cc1 ZINC001203947911 1049040834 /nfs/dbraw/zinc/04/08/34/1049040834.db2.gz VGSCXIPIJCZWBM-UHFFFAOYSA-N 1 2 305.381 4.107 20 0 DIADLO COc1ccc2ccccc2c1C[N@@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001203987447 1049051243 /nfs/dbraw/zinc/05/12/43/1049051243.db2.gz XRFSEIIPWAPKKX-INIZCTEOSA-N 1 2 309.331 4.028 20 0 DIADLO COc1ccc2ccccc2c1C[N@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001203987447 1049051253 /nfs/dbraw/zinc/05/12/53/1049051253.db2.gz XRFSEIIPWAPKKX-INIZCTEOSA-N 1 2 309.331 4.028 20 0 DIADLO O=C(c1cccc2[nH+]ccn21)N1CCCCC[C@H]1c1ccccc1 ZINC000776832130 1049055162 /nfs/dbraw/zinc/05/51/62/1049055162.db2.gz CNKRQHIGQJUHPP-KRWDZBQOSA-N 1 2 319.408 4.092 20 0 DIADLO CCCCC[C@H]1CCC[N@H+]1Cc1ncsc1Br ZINC001192215602 1049061585 /nfs/dbraw/zinc/06/15/85/1049061585.db2.gz WBJPEAJXSZSUNL-NSHDSACASA-N 1 2 317.296 4.450 20 0 DIADLO CCCCC[C@H]1CCC[N@@H+]1Cc1ncsc1Br ZINC001192215602 1049061568 /nfs/dbraw/zinc/06/15/68/1049061568.db2.gz WBJPEAJXSZSUNL-NSHDSACASA-N 1 2 317.296 4.450 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1cc(C2CC2)no1)C1CCC1 ZINC001192214450 1049063151 /nfs/dbraw/zinc/06/31/51/1049063151.db2.gz PLDOEOWCQWWKOS-UHFFFAOYSA-N 1 2 300.377 4.246 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1cc(C2CC2)no1)C1CCC1 ZINC001192214450 1049063162 /nfs/dbraw/zinc/06/31/62/1049063162.db2.gz PLDOEOWCQWWKOS-UHFFFAOYSA-N 1 2 300.377 4.246 20 0 DIADLO Cc1cccn2c(CNC(=O)Nc3ccccc3C(C)C)c[nH+]c12 ZINC001192261669 1049069133 /nfs/dbraw/zinc/06/91/33/1049069133.db2.gz ZNVWPNROMZVLER-UHFFFAOYSA-N 1 2 322.412 4.088 20 0 DIADLO CCc1noc(C)c1[C@H](C)Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000776846742 1049069593 /nfs/dbraw/zinc/06/95/93/1049069593.db2.gz GDKSFPFQGBTNEA-ZDUSSCGKSA-N 1 2 314.433 4.104 20 0 DIADLO CCN(C(=O)c1cccc2[nH+]ccn21)c1ccc2ccccc2c1 ZINC000776864457 1049071905 /nfs/dbraw/zinc/07/19/05/1049071905.db2.gz LMXRUMQKFRSUHZ-UHFFFAOYSA-N 1 2 315.376 4.154 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@H+](Cc3nc4c(o3)CCCC4)CC2)c1 ZINC001192292803 1049075437 /nfs/dbraw/zinc/07/54/37/1049075437.db2.gz ZSKYRXUKYOETIP-UHFFFAOYSA-N 1 2 322.452 4.460 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@@H+](Cc3nc4c(o3)CCCC4)CC2)c1 ZINC001192292803 1049075451 /nfs/dbraw/zinc/07/54/51/1049075451.db2.gz ZSKYRXUKYOETIP-UHFFFAOYSA-N 1 2 322.452 4.460 20 0 DIADLO C[C@H](c1nc(-c2ccccc2)no1)[N@@H+]1CC[C@H]1c1ccccc1 ZINC000484922766 1049082607 /nfs/dbraw/zinc/08/26/07/1049082607.db2.gz CRURZBYMGNIELT-PBHICJAKSA-N 1 2 305.381 4.245 20 0 DIADLO C[C@H](c1nc(-c2ccccc2)no1)[N@H+]1CC[C@H]1c1ccccc1 ZINC000484922766 1049082617 /nfs/dbraw/zinc/08/26/17/1049082617.db2.gz CRURZBYMGNIELT-PBHICJAKSA-N 1 2 305.381 4.245 20 0 DIADLO Cc1nc2c(o1)CC[N@H+](Cc1ccc(-c3ccccc3)cc1)C2 ZINC001204139998 1049093050 /nfs/dbraw/zinc/09/30/50/1049093050.db2.gz YVCGYFDZKWPXPK-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO Cc1nc2c(o1)CC[N@@H+](Cc1ccc(-c3ccccc3)cc1)C2 ZINC001204139998 1049093061 /nfs/dbraw/zinc/09/30/61/1049093061.db2.gz YVCGYFDZKWPXPK-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO O=C(Nc1ccc2sccc2c1)Nc1ccn2cc[nH+]c2c1 ZINC001192431215 1049097674 /nfs/dbraw/zinc/09/76/74/1049097674.db2.gz VJNSUNPNAVTUKY-UHFFFAOYSA-N 1 2 308.366 4.193 20 0 DIADLO CC(C)c1cc(C[NH2+]Cc2ccc(CSC(F)F)o2)on1 ZINC000114510644 1049100311 /nfs/dbraw/zinc/10/03/11/1049100311.db2.gz ALCGKUKHIWOHRV-UHFFFAOYSA-N 1 2 316.373 4.137 20 0 DIADLO CC(C)c1ccc(C[N@@H+]2CCc3nc(Cl)ccc3C2)cc1 ZINC001204165754 1049101813 /nfs/dbraw/zinc/10/18/13/1049101813.db2.gz KNMNJZOUVHPEJR-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc(C[N@H+]2CCc3nc(Cl)ccc3C2)cc1 ZINC001204165754 1049101818 /nfs/dbraw/zinc/10/18/18/1049101818.db2.gz KNMNJZOUVHPEJR-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO Fc1cccc(F)c1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC001204205481 1049112333 /nfs/dbraw/zinc/11/23/33/1049112333.db2.gz WIOKCEYAOVQWDL-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1cccc(F)c1C[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC001204205481 1049112339 /nfs/dbraw/zinc/11/23/39/1049112339.db2.gz WIOKCEYAOVQWDL-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1ccc(COc2ccc(C[N@H+]3CCC=C(F)C3)cc2)cc1 ZINC001192536248 1049116413 /nfs/dbraw/zinc/11/64/13/1049116413.db2.gz LNVWEXAYOLSDEO-UHFFFAOYSA-N 1 2 315.363 4.464 20 0 DIADLO Fc1ccc(COc2ccc(C[N@@H+]3CCC=C(F)C3)cc2)cc1 ZINC001192536248 1049116418 /nfs/dbraw/zinc/11/64/18/1049116418.db2.gz LNVWEXAYOLSDEO-UHFFFAOYSA-N 1 2 315.363 4.464 20 0 DIADLO CSc1cc(F)ccc1NCc1cc(-n2cc[nH+]c2)cs1 ZINC001179011765 1049121050 /nfs/dbraw/zinc/12/10/50/1049121050.db2.gz SQNQGDSVNQBHHF-UHFFFAOYSA-N 1 2 319.430 4.407 20 0 DIADLO CCn1cnc(Cl)c1C[NH2+]C1(c2ccccc2Cl)CCC1 ZINC001179071074 1049129217 /nfs/dbraw/zinc/12/92/17/1049129217.db2.gz DYJBXPSBYBOLCR-UHFFFAOYSA-N 1 2 324.255 4.379 20 0 DIADLO CCCCCCOc1ccccc1C[N@H+](C)Cc1ccno1 ZINC001204294979 1049131869 /nfs/dbraw/zinc/13/18/69/1049131869.db2.gz XDKIKXDIGGJOKQ-UHFFFAOYSA-N 1 2 302.418 4.266 20 0 DIADLO CCCCCCOc1ccccc1C[N@@H+](C)Cc1ccno1 ZINC001204294979 1049131873 /nfs/dbraw/zinc/13/18/73/1049131873.db2.gz XDKIKXDIGGJOKQ-UHFFFAOYSA-N 1 2 302.418 4.266 20 0 DIADLO CCCCCCOc1ccccc1C[N@H+]1CCC(=O)[C@@H](F)CC1 ZINC001204297082 1049132210 /nfs/dbraw/zinc/13/22/10/1049132210.db2.gz IDRYTSVTIZQZQA-KRWDZBQOSA-N 1 2 321.436 4.149 20 0 DIADLO CCCCCCOc1ccccc1C[N@@H+]1CCC(=O)[C@@H](F)CC1 ZINC001204297082 1049132216 /nfs/dbraw/zinc/13/22/16/1049132216.db2.gz IDRYTSVTIZQZQA-KRWDZBQOSA-N 1 2 321.436 4.149 20 0 DIADLO Cc1csc(C2([NH2+][C@H](C)c3cccnc3Cl)CCC2)n1 ZINC000776925281 1049135844 /nfs/dbraw/zinc/13/58/44/1049135844.db2.gz FXVKJAXSTSHUMD-LLVKDONJSA-N 1 2 307.850 4.230 20 0 DIADLO CSCc1ccc(C[N@@H+]2CCc3c(F)ccc(F)c3C2)cc1 ZINC001204312216 1049138808 /nfs/dbraw/zinc/13/88/08/1049138808.db2.gz CYGZUFBPYCBCRX-UHFFFAOYSA-N 1 2 319.420 4.386 20 0 DIADLO CSCc1ccc(C[N@H+]2CCc3c(F)ccc(F)c3C2)cc1 ZINC001204312216 1049138814 /nfs/dbraw/zinc/13/88/14/1049138814.db2.gz CYGZUFBPYCBCRX-UHFFFAOYSA-N 1 2 319.420 4.386 20 0 DIADLO CC(C)c1nc(C[N@H+](C)Cc2cn(C)c3ccccc23)cs1 ZINC001204326665 1049142865 /nfs/dbraw/zinc/14/28/65/1049142865.db2.gz WONSDXRQFPEOHC-UHFFFAOYSA-N 1 2 313.470 4.390 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)Cc2cn(C)c3ccccc23)cs1 ZINC001204326665 1049142870 /nfs/dbraw/zinc/14/28/70/1049142870.db2.gz WONSDXRQFPEOHC-UHFFFAOYSA-N 1 2 313.470 4.390 20 0 DIADLO CCn1c[nH+]cc1CN1CCc2cc(Cl)cc(Cl)c2[C@H]1C ZINC001204334061 1049145254 /nfs/dbraw/zinc/14/52/54/1049145254.db2.gz GDIBEJSAMNLMDW-LLVKDONJSA-N 1 2 324.255 4.329 20 0 DIADLO CCCCCCOc1ccc(C[N@@H+]2CCC(=O)[C@@H](C)C2)cc1 ZINC001204365311 1049151427 /nfs/dbraw/zinc/15/14/27/1049151427.db2.gz QLFCCMTVZJRXBX-INIZCTEOSA-N 1 2 303.446 4.057 20 0 DIADLO CCCCCCOc1ccc(C[N@H+]2CCC(=O)[C@@H](C)C2)cc1 ZINC001204365311 1049151431 /nfs/dbraw/zinc/15/14/31/1049151431.db2.gz QLFCCMTVZJRXBX-INIZCTEOSA-N 1 2 303.446 4.057 20 0 DIADLO COc1ccc(NCc2c[nH+]c3ccc(C)cn23)c2ccccc12 ZINC001179307748 1049152456 /nfs/dbraw/zinc/15/24/56/1049152456.db2.gz AYJDNVBZSLYYRK-UHFFFAOYSA-N 1 2 317.392 4.417 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3cccc4c3OC(C)(C)C=C4)n2c1 ZINC001179275031 1049153278 /nfs/dbraw/zinc/15/32/78/1049153278.db2.gz XMGNTOZHYQAWJD-UHFFFAOYSA-N 1 2 319.408 4.439 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc(OC(F)(F)F)cc1)C2 ZINC001204417048 1049159792 /nfs/dbraw/zinc/15/97/92/1049159792.db2.gz QIGDSHDECCQPCL-UHFFFAOYSA-N 1 2 323.314 4.110 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc(OC(F)(F)F)cc1)C2 ZINC001204417048 1049159795 /nfs/dbraw/zinc/15/97/95/1049159795.db2.gz QIGDSHDECCQPCL-UHFFFAOYSA-N 1 2 323.314 4.110 20 0 DIADLO Cc1ccc2[nH+]c(NCc3csc(Br)c3)[nH]c2c1 ZINC001179437176 1049163487 /nfs/dbraw/zinc/16/34/87/1049163487.db2.gz BNWDDISUCLCQFK-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO Cc1cc(NCc2cccc(Br)c2F)c[nH+]c1C ZINC001179447763 1049165392 /nfs/dbraw/zinc/16/53/92/1049165392.db2.gz QQWZRRXTXQBGEW-UHFFFAOYSA-N 1 2 309.182 4.212 20 0 DIADLO Cc1ccc(CNc2c[nH+]c(C)c(C)c2)c(Br)c1 ZINC001179447810 1049165421 /nfs/dbraw/zinc/16/54/21/1049165421.db2.gz SHBCZSZWDRYVKN-UHFFFAOYSA-N 1 2 305.219 4.381 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1C[N@H+]1CCC[C@H](C(F)F)C1 ZINC001204474741 1049171435 /nfs/dbraw/zinc/17/14/35/1049171435.db2.gz WXNHBCMSWBIICH-VIFPVBQESA-N 1 2 311.269 4.322 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1C[N@@H+]1CCC[C@H](C(F)F)C1 ZINC001204474741 1049171440 /nfs/dbraw/zinc/17/14/40/1049171440.db2.gz WXNHBCMSWBIICH-VIFPVBQESA-N 1 2 311.269 4.322 20 0 DIADLO COc1ccc(CNc2[nH+]c3ccccc3n2C2CC2)cc1C ZINC001179489982 1049173055 /nfs/dbraw/zinc/17/30/55/1049173055.db2.gz ZDWIVQVRHVWFCH-UHFFFAOYSA-N 1 2 307.397 4.300 20 0 DIADLO CCCOc1ccc(C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)cc1 ZINC001179578860 1049179063 /nfs/dbraw/zinc/17/90/63/1049179063.db2.gz AQTVYSODUMGRQZ-PKOBYXMFSA-N 1 2 315.388 4.037 20 0 DIADLO Clc1cccc([C@H]2CC[N@H+](Cc3nccs3)C2)c1Cl ZINC001204547912 1049187167 /nfs/dbraw/zinc/18/71/67/1049187167.db2.gz PWCRVZNCCDQVPC-JTQLQIEISA-N 1 2 313.253 4.439 20 0 DIADLO Clc1cccc([C@H]2CC[N@@H+](Cc3nccs3)C2)c1Cl ZINC001204547912 1049187176 /nfs/dbraw/zinc/18/71/76/1049187176.db2.gz PWCRVZNCCDQVPC-JTQLQIEISA-N 1 2 313.253 4.439 20 0 DIADLO CC[C@H](c1ccccc1)N(C(=O)c1cccc2[nH+]ccn21)C(C)C ZINC000857676294 1049190791 /nfs/dbraw/zinc/19/07/91/1049190791.db2.gz MMPCZGKPAPVRJE-QGZVFWFLSA-N 1 2 321.424 4.336 20 0 DIADLO Cc1[nH+]c[nH]c1CN(Cc1c(Cl)cccc1Cl)C(C)C ZINC001204591996 1049194870 /nfs/dbraw/zinc/19/48/70/1049194870.db2.gz JNHYNBDNLHVDJV-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO COCOc1cc(C)c(-c2ccccc2Cn2cc[nH+]c2)c(C)c1 ZINC001204605966 1049197557 /nfs/dbraw/zinc/19/75/57/1049197557.db2.gz UYAHNFLKFZZUQF-UHFFFAOYSA-N 1 2 322.408 4.198 20 0 DIADLO CCn1cc(C[N@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)nn1 ZINC001204615255 1049200909 /nfs/dbraw/zinc/20/09/09/1049200909.db2.gz GQVIYUFTIXJUHO-MRXNPFEDSA-N 1 2 320.440 4.158 20 0 DIADLO CCn1cc(C[N@@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)nn1 ZINC001204615255 1049200919 /nfs/dbraw/zinc/20/09/19/1049200919.db2.gz GQVIYUFTIXJUHO-MRXNPFEDSA-N 1 2 320.440 4.158 20 0 DIADLO Fc1cccc([C@H]([NH2+][C@@H]2CCCc3cn[nH]c32)c2ccccc2)c1 ZINC000857857434 1049202751 /nfs/dbraw/zinc/20/27/51/1049202751.db2.gz UFWXMVFHASTSHC-RTBURBONSA-N 1 2 321.399 4.305 20 0 DIADLO Fc1cccc([C@H]([NH2+][C@@H]2CCCc3c[nH]nc32)c2ccccc2)c1 ZINC000857857434 1049202755 /nfs/dbraw/zinc/20/27/55/1049202755.db2.gz UFWXMVFHASTSHC-RTBURBONSA-N 1 2 321.399 4.305 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1ccc(Cl)cc1 ZINC001179814492 1049209055 /nfs/dbraw/zinc/20/90/55/1049209055.db2.gz ACWWNBBJGZDNIL-UHFFFAOYSA-N 1 2 303.768 4.461 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cccc1F)c1cc(F)ccc1N(C)C ZINC001179830060 1049211006 /nfs/dbraw/zinc/21/10/06/1049211006.db2.gz JZEAFJSYAIZVTC-LLVKDONJSA-N 1 2 308.347 4.021 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2c(Cl)ccnc2F)cc1 ZINC001179844778 1049213386 /nfs/dbraw/zinc/21/33/86/1049213386.db2.gz BWOIAQUBOYBLMH-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2c(Cl)ccnc2F)cc1 ZINC001179844778 1049213400 /nfs/dbraw/zinc/21/34/00/1049213400.db2.gz BWOIAQUBOYBLMH-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CCCCCC[C@](C)(CCC)C(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000857948922 1049213772 /nfs/dbraw/zinc/21/37/72/1049213772.db2.gz UATBZEJSBOTYGL-APWZRJJASA-N 1 2 319.493 4.091 20 0 DIADLO Clc1ccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)cn1 ZINC000115740235 1049213915 /nfs/dbraw/zinc/21/39/15/1049213915.db2.gz XBOUEXOJYJTOQC-OAHLLOKOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccc(C[N@H+]2CCSC[C@@H]2c2ccccc2)cn1 ZINC000115740235 1049213923 /nfs/dbraw/zinc/21/39/23/1049213923.db2.gz XBOUEXOJYJTOQC-OAHLLOKOSA-N 1 2 304.846 4.025 20 0 DIADLO C[C@H]1CC[C@H](C)[N@H+](Cc2cc(Br)cnc2Cl)C1 ZINC001179855440 1049214985 /nfs/dbraw/zinc/21/49/85/1049214985.db2.gz SFWCPWRDVCCJCB-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[C@H](C)[N@@H+](Cc2cc(Br)cnc2Cl)C1 ZINC001179855440 1049214997 /nfs/dbraw/zinc/21/49/97/1049214997.db2.gz SFWCPWRDVCCJCB-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2ccccn2)c(Br)cc1F ZINC000858086440 1049216435 /nfs/dbraw/zinc/21/64/35/1049216435.db2.gz IIVCCEJDZCDLTR-NSHDSACASA-N 1 2 323.209 4.142 20 0 DIADLO C[N@H+](C/C=C/c1ccc(F)cc1)Cc1nc(-c2ccccc2)c[nH]1 ZINC000485328607 1049223114 /nfs/dbraw/zinc/22/31/14/1049223114.db2.gz HQVFBWYLPYGCPL-AATRIKPKSA-N 1 2 321.399 4.361 20 0 DIADLO C[N@@H+](C/C=C/c1ccc(F)cc1)Cc1nc(-c2ccccc2)c[nH]1 ZINC000485328607 1049223124 /nfs/dbraw/zinc/22/31/24/1049223124.db2.gz HQVFBWYLPYGCPL-AATRIKPKSA-N 1 2 321.399 4.361 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCc3c(F)ccc(F)c3C2)cc1F ZINC001179942407 1049232950 /nfs/dbraw/zinc/23/29/50/1049232950.db2.gz PXJBZXJROCJAJB-OWOJBTEDSA-N 1 2 321.317 4.315 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCc3c(F)ccc(F)c3C2)cc1F ZINC001179942407 1049232966 /nfs/dbraw/zinc/23/29/66/1049232966.db2.gz PXJBZXJROCJAJB-OWOJBTEDSA-N 1 2 321.317 4.315 20 0 DIADLO CCCn1c[nH+]cc1CN1CCc2c(Cl)cc(Cl)cc2C1 ZINC001179942364 1049233307 /nfs/dbraw/zinc/23/33/07/1049233307.db2.gz PIKYSBSJARDQSC-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(-c3ccccc3Cl)o2)CCC1=O ZINC001204718148 1049240772 /nfs/dbraw/zinc/24/07/72/1049240772.db2.gz WECKQBDCMJRXCR-LBPRGKRZSA-N 1 2 303.789 4.011 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)CCC1=O ZINC001204718148 1049240782 /nfs/dbraw/zinc/24/07/82/1049240782.db2.gz WECKQBDCMJRXCR-LBPRGKRZSA-N 1 2 303.789 4.011 20 0 DIADLO CCn1c[nH+]cc1CNc1cccc(SC(F)(F)F)c1 ZINC000858318996 1049241933 /nfs/dbraw/zinc/24/19/33/1049241933.db2.gz WBBCZIXTZSZSCM-UHFFFAOYSA-N 1 2 301.337 4.127 20 0 DIADLO COc1ccc(F)cc1C[N@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC001204729962 1049245130 /nfs/dbraw/zinc/24/51/30/1049245130.db2.gz OISGSFDMFCQBCL-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccc(F)cc1C[N@@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC001204729962 1049245137 /nfs/dbraw/zinc/24/51/37/1049245137.db2.gz OISGSFDMFCQBCL-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO CCc1cnccc1[C@@H](C)[C@H](c1[nH+]ccn1C)c1cccc(F)c1 ZINC000485432932 1049245192 /nfs/dbraw/zinc/24/51/92/1049245192.db2.gz CDXKLPSSAVEYHS-KUHUBIRLSA-N 1 2 323.415 4.452 20 0 DIADLO Cc1cccc(F)c1C[NH2+][C@@H](C)c1cc(-c2ccccc2)n(C)n1 ZINC000858366427 1049248622 /nfs/dbraw/zinc/24/86/22/1049248622.db2.gz CRSIRLDGSPVVJB-HNNXBMFYSA-N 1 2 323.415 4.385 20 0 DIADLO Cc1cn2c(cccc2-c2ccc(OCc3ccccc3)nc2)[nH+]1 ZINC001204744861 1049249347 /nfs/dbraw/zinc/24/93/47/1049249347.db2.gz JDBXLMPIEHDNSY-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2ccc(F)cc2C(F)(F)F)co1 ZINC000858423849 1049254590 /nfs/dbraw/zinc/25/45/90/1049254590.db2.gz PBVMQXKFDXVKSZ-SECBINFHSA-N 1 2 316.298 4.246 20 0 DIADLO c1cc(-c2ccccc2)sc1C[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000858445433 1049260040 /nfs/dbraw/zinc/26/00/40/1049260040.db2.gz JMPAAKPEBQFABX-INIZCTEOSA-N 1 2 309.438 4.305 20 0 DIADLO CCn1ncc(C[NH2+][C@H](C)c2ccccc2SC(C)(C)C)n1 ZINC000858444363 1049260119 /nfs/dbraw/zinc/26/01/19/1049260119.db2.gz KTYZZVUSDRHQSZ-CYBMUJFWSA-N 1 2 318.490 4.039 20 0 DIADLO CCC[N@H+](Cc1nn(C)cc1Cl)[C@@H](CC)c1ccccc1 ZINC001204803357 1049268476 /nfs/dbraw/zinc/26/84/76/1049268476.db2.gz MCWAZHKTIDYSQK-KRWDZBQOSA-N 1 2 305.853 4.437 20 0 DIADLO CCC[N@@H+](Cc1nn(C)cc1Cl)[C@@H](CC)c1ccccc1 ZINC001204803357 1049268487 /nfs/dbraw/zinc/26/84/87/1049268487.db2.gz MCWAZHKTIDYSQK-KRWDZBQOSA-N 1 2 305.853 4.437 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@@H+]2CCO[C@H](c3ccco3)C2)cc1C ZINC001204804198 1049269129 /nfs/dbraw/zinc/26/91/29/1049269129.db2.gz XVQQLSCJSNLSFO-MNBNYPOFSA-N 1 2 311.425 4.292 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@H+]2CCO[C@H](c3ccco3)C2)cc1C ZINC001204804198 1049269142 /nfs/dbraw/zinc/26/91/42/1049269142.db2.gz XVQQLSCJSNLSFO-MNBNYPOFSA-N 1 2 311.425 4.292 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@@H+]2CCO[C@H](c3ccco3)C2)cc1C ZINC001204804201 1049269589 /nfs/dbraw/zinc/26/95/89/1049269589.db2.gz XVQQLSCJSNLSFO-XXIDSNJLSA-N 1 2 311.425 4.292 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@H+]2CCO[C@H](c3ccco3)C2)cc1C ZINC001204804201 1049269603 /nfs/dbraw/zinc/26/96/03/1049269603.db2.gz XVQQLSCJSNLSFO-XXIDSNJLSA-N 1 2 311.425 4.292 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2ccnn2C2CCC2)cc1F ZINC001204816077 1049273635 /nfs/dbraw/zinc/27/36/35/1049273635.db2.gz GDWZQZFPEXZPSZ-GOSISDBHSA-N 1 2 317.383 4.223 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2ccnn2C2CCC2)cc1F ZINC001204816077 1049273651 /nfs/dbraw/zinc/27/36/51/1049273651.db2.gz GDWZQZFPEXZPSZ-GOSISDBHSA-N 1 2 317.383 4.223 20 0 DIADLO COc1cnc(F)c(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1 ZINC001180129401 1049276792 /nfs/dbraw/zinc/27/67/92/1049276792.db2.gz QXEYSKBMSYJORC-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cnc(F)c(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1 ZINC001180129401 1049276805 /nfs/dbraw/zinc/27/68/05/1049276805.db2.gz QXEYSKBMSYJORC-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1nc2ccccc2n1C(F)F ZINC000858575569 1049277402 /nfs/dbraw/zinc/27/74/02/1049277402.db2.gz BDZCRTSEZSAPNO-VHSXEESVSA-N 1 2 322.384 4.300 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@@H+]2CCC[C@@H](c3ccn[nH]3)C2)cc1C ZINC001204840647 1049282197 /nfs/dbraw/zinc/28/21/97/1049282197.db2.gz NNCIDBFRKNWUBC-FHHGHWCOSA-N 1 2 309.457 4.228 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@H+]2CCC[C@@H](c3ccn[nH]3)C2)cc1C ZINC001204840647 1049282212 /nfs/dbraw/zinc/28/22/12/1049282212.db2.gz NNCIDBFRKNWUBC-FHHGHWCOSA-N 1 2 309.457 4.228 20 0 DIADLO CCn1ccc(C[N@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC001180103849 1049284857 /nfs/dbraw/zinc/28/48/57/1049284857.db2.gz YDJAYORYZCWLGK-LLVKDONJSA-N 1 2 312.244 4.403 20 0 DIADLO CCn1ccc(C[N@@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC001180103849 1049284869 /nfs/dbraw/zinc/28/48/69/1049284869.db2.gz YDJAYORYZCWLGK-LLVKDONJSA-N 1 2 312.244 4.403 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccco2)Cc2ccc(C)s2)o1 ZINC001204860706 1049288471 /nfs/dbraw/zinc/28/84/71/1049288471.db2.gz YOYKQLQYHZUNKF-UHFFFAOYSA-N 1 2 317.410 4.454 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccco2)Cc2ccc(C)s2)o1 ZINC001204860706 1049288482 /nfs/dbraw/zinc/28/84/82/1049288482.db2.gz YOYKQLQYHZUNKF-UHFFFAOYSA-N 1 2 317.410 4.454 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1cnc(C2CC2)o1)C1CCC1 ZINC001180112128 1049289683 /nfs/dbraw/zinc/28/96/83/1049289683.db2.gz HFHIGVYBNPQSNZ-UHFFFAOYSA-N 1 2 300.377 4.246 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1cnc(C2CC2)o1)C1CCC1 ZINC001180112128 1049289693 /nfs/dbraw/zinc/28/96/93/1049289693.db2.gz HFHIGVYBNPQSNZ-UHFFFAOYSA-N 1 2 300.377 4.246 20 0 DIADLO CCCCC/C(=C\c1ccccc1)C[N@H+](C)Cc1nnc(C)o1 ZINC000668522044 1049292617 /nfs/dbraw/zinc/29/26/17/1049292617.db2.gz ZLYYCUKDYCQHEQ-QGOAFFKASA-N 1 2 313.445 4.474 20 0 DIADLO CCCCC/C(=C\c1ccccc1)C[N@@H+](C)Cc1nnc(C)o1 ZINC000668522044 1049292623 /nfs/dbraw/zinc/29/26/23/1049292623.db2.gz ZLYYCUKDYCQHEQ-QGOAFFKASA-N 1 2 313.445 4.474 20 0 DIADLO CCCCC/C(=C/c1ccccc1)C[N@H+](C)Cc1nnc(C)o1 ZINC000668522043 1049293540 /nfs/dbraw/zinc/29/35/40/1049293540.db2.gz ZLYYCUKDYCQHEQ-AQTBWJFISA-N 1 2 313.445 4.474 20 0 DIADLO CCCCC/C(=C/c1ccccc1)C[N@@H+](C)Cc1nnc(C)o1 ZINC000668522043 1049293553 /nfs/dbraw/zinc/29/35/53/1049293553.db2.gz ZLYYCUKDYCQHEQ-AQTBWJFISA-N 1 2 313.445 4.474 20 0 DIADLO Cc1nn(C)c2ccc(Nc3cccc4[nH+]c(C)ccc34)cc12 ZINC001204877336 1049295991 /nfs/dbraw/zinc/29/59/91/1049295991.db2.gz AFWCZPKOEJMFQC-UHFFFAOYSA-N 1 2 302.381 4.482 20 0 DIADLO Cc1cn2cc(-c3ccccc3OC[C@H]3CCOC3)cc(C)c2[nH+]1 ZINC000906162452 1049303933 /nfs/dbraw/zinc/30/39/33/1049303933.db2.gz RDLGLEHSFUIVEG-INIZCTEOSA-N 1 2 322.408 4.033 20 0 DIADLO Cc1nn(C)c(C[N@H+](Cc2ccc(F)cc2)C(C)(C)C)c1Cl ZINC001204907462 1049306645 /nfs/dbraw/zinc/30/66/45/1049306645.db2.gz HHCLCRZEDJJWHE-UHFFFAOYSA-N 1 2 323.843 4.322 20 0 DIADLO Cc1nn(C)c(C[N@@H+](Cc2ccc(F)cc2)C(C)(C)C)c1Cl ZINC001204907462 1049306657 /nfs/dbraw/zinc/30/66/57/1049306657.db2.gz HHCLCRZEDJJWHE-UHFFFAOYSA-N 1 2 323.843 4.322 20 0 DIADLO C[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1csc2ccccc21 ZINC001180225721 1049311424 /nfs/dbraw/zinc/31/14/24/1049311424.db2.gz GHUJSSSRVNSJIL-LLVKDONJSA-N 1 2 321.405 4.269 20 0 DIADLO CCC[N@H+](Cc1cc(Cl)n(C)n1)[C@@H](C)c1ccccc1OC ZINC000859098209 1049311811 /nfs/dbraw/zinc/31/18/11/1049311811.db2.gz BZFLZIPFRZTAGY-ZDUSSCGKSA-N 1 2 321.852 4.055 20 0 DIADLO CCC[N@@H+](Cc1cc(Cl)n(C)n1)[C@@H](C)c1ccccc1OC ZINC000859098209 1049311817 /nfs/dbraw/zinc/31/18/17/1049311817.db2.gz BZFLZIPFRZTAGY-ZDUSSCGKSA-N 1 2 321.852 4.055 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c(F)c1 ZINC001204928175 1049312276 /nfs/dbraw/zinc/31/22/76/1049312276.db2.gz HHNQSFXPVKVNBG-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)c(F)c1 ZINC001204928175 1049312290 /nfs/dbraw/zinc/31/22/90/1049312290.db2.gz HHNQSFXPVKVNBG-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1nc(F)c(Cl)c(Nc2ccn3cc[nH+]c3c2)c1Cl ZINC001204951551 1049320780 /nfs/dbraw/zinc/32/07/80/1049320780.db2.gz VIMIPWKRWUUYHC-UHFFFAOYSA-N 1 2 315.110 4.058 20 0 DIADLO Fc1ccc(Oc2ncccc2Nc2ccn3cc[nH+]c3c2)cc1 ZINC001204959715 1049321312 /nfs/dbraw/zinc/32/13/12/1049321312.db2.gz VJBKCXUAPZGZHZ-UHFFFAOYSA-N 1 2 320.327 4.404 20 0 DIADLO Cc1cnn(-c2ccccc2Cl)c1Nc1ccn2cc[nH+]c2c1 ZINC001204971328 1049327203 /nfs/dbraw/zinc/32/72/03/1049327203.db2.gz HPSZPAYTKXXQJQ-UHFFFAOYSA-N 1 2 323.787 4.225 20 0 DIADLO Fc1ccc(OC(F)(F)F)cc1Nc1ccn2cc[nH+]c2c1 ZINC001204977683 1049328064 /nfs/dbraw/zinc/32/80/64/1049328064.db2.gz IVPPRRKOEUZTBK-UHFFFAOYSA-N 1 2 311.238 4.116 20 0 DIADLO Cc1cc(Br)ccc1Nc1ccn2cc[nH+]c2c1 ZINC001204977651 1049328774 /nfs/dbraw/zinc/32/87/74/1049328774.db2.gz HXWSAJSCOVJINF-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO c1cn2ccc(Nc3ccc(Cc4ccncc4)cc3)cc2[nH+]1 ZINC001204978264 1049329269 /nfs/dbraw/zinc/32/92/69/1049329269.db2.gz RQNGCJZXZWTNAC-UHFFFAOYSA-N 1 2 300.365 4.064 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Cl)nc(Cl)c2)C[C@H](C)C1(F)F ZINC000859410658 1049331443 /nfs/dbraw/zinc/33/14/43/1049331443.db2.gz DCNTWXSWZDWWOK-DTORHVGOSA-N 1 2 309.187 4.112 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Cl)nc(Cl)c2)C[C@H](C)C1(F)F ZINC000859410658 1049331453 /nfs/dbraw/zinc/33/14/53/1049331453.db2.gz DCNTWXSWZDWWOK-DTORHVGOSA-N 1 2 309.187 4.112 20 0 DIADLO CC(C)(C)OC(=O)Nc1cccc(Nc2ccn3cc[nH+]c3c2)c1 ZINC001204983375 1049332117 /nfs/dbraw/zinc/33/21/17/1049332117.db2.gz UJQHVPSMYZUJSM-UHFFFAOYSA-N 1 2 324.384 4.425 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Cl)nc2Cl)C[C@H](C)C1(F)F ZINC000859413774 1049332427 /nfs/dbraw/zinc/33/24/27/1049332427.db2.gz BRQAPZQMEVTWGB-DTORHVGOSA-N 1 2 309.187 4.112 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Cl)nc2Cl)C[C@H](C)C1(F)F ZINC000859413774 1049332442 /nfs/dbraw/zinc/33/24/42/1049332442.db2.gz BRQAPZQMEVTWGB-DTORHVGOSA-N 1 2 309.187 4.112 20 0 DIADLO Cc1ccc2ncc(C[NH2+][C@H](C)c3c(F)cncc3F)cc2c1 ZINC001194164699 1049333132 /nfs/dbraw/zinc/33/31/32/1049333132.db2.gz MCBSZEVPMUQNPF-GFCCVEGCSA-N 1 2 313.351 4.067 20 0 DIADLO Fc1cc(Nc2ccn3cc[nH+]c3c2)cc(F)c1OCC1CC1 ZINC001204998350 1049334756 /nfs/dbraw/zinc/33/47/56/1049334756.db2.gz XJBKSOKSUZSVJX-UHFFFAOYSA-N 1 2 315.323 4.145 20 0 DIADLO CC(=O)c1ccc(Nc2ccn3cc[nH+]c3c2)c(C(F)(F)F)c1 ZINC001204997646 1049335951 /nfs/dbraw/zinc/33/59/51/1049335951.db2.gz LUGOCJZBWYMXPL-UHFFFAOYSA-N 1 2 319.286 4.299 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1cnc(Cl)n1[C@@H]1CCCCO1 ZINC001205038431 1049350884 /nfs/dbraw/zinc/35/08/84/1049350884.db2.gz HZLFVJHOQDFVAY-AWEZNQCLSA-N 1 2 320.824 4.245 20 0 DIADLO C[C@H]1CCC[C@@H](c2nc(-c3ccccc3-n3cc[nH+]c3)no2)C1 ZINC001205075382 1049363839 /nfs/dbraw/zinc/36/38/39/1049363839.db2.gz OCMWBMIHSLYZTH-UONOGXRCSA-N 1 2 308.385 4.216 20 0 DIADLO C[N@H+](CC1=CCCOC1)Cc1c(Cl)ccc(Cl)c1Cl ZINC000668568298 1049366047 /nfs/dbraw/zinc/36/60/47/1049366047.db2.gz ACOHDMCCBXSFDB-UHFFFAOYSA-N 1 2 320.647 4.425 20 0 DIADLO C[N@@H+](CC1=CCCOC1)Cc1c(Cl)ccc(Cl)c1Cl ZINC000668568298 1049366062 /nfs/dbraw/zinc/36/60/62/1049366062.db2.gz ACOHDMCCBXSFDB-UHFFFAOYSA-N 1 2 320.647 4.425 20 0 DIADLO COc1nsc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2)c1Cl ZINC001205077668 1049366063 /nfs/dbraw/zinc/36/60/63/1049366063.db2.gz RCVUFATVSBYEOZ-NSHDSACASA-N 1 2 310.850 4.307 20 0 DIADLO COc1nsc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2)c1Cl ZINC001205077668 1049366072 /nfs/dbraw/zinc/36/60/72/1049366072.db2.gz RCVUFATVSBYEOZ-NSHDSACASA-N 1 2 310.850 4.307 20 0 DIADLO C[C@H]1CCC[C@H](c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)C1 ZINC001205076622 1049366104 /nfs/dbraw/zinc/36/61/04/1049366104.db2.gz XTZGQRULYOREHC-ZFWWWQNUSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@@H]1CCC[C@@H](c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)C1 ZINC001205076621 1049366642 /nfs/dbraw/zinc/36/66/42/1049366642.db2.gz XTZGQRULYOREHC-UKRRQHHQSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(Cc2ccccc2)n1)c1ccns1 ZINC000860052523 1049366896 /nfs/dbraw/zinc/36/68/96/1049366896.db2.gz AUGJXZWQAHXQMF-GFCCVEGCSA-N 1 2 315.467 4.041 20 0 DIADLO Cc1cccc(N2CC[NH+](Cc3ccsc3Cl)CC2)c1 ZINC001180462648 1049367639 /nfs/dbraw/zinc/36/76/39/1049367639.db2.gz STVCTAPJIVVYJS-UHFFFAOYSA-N 1 2 306.862 4.032 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1ccc(O)c(F)c1F ZINC001180523231 1049371687 /nfs/dbraw/zinc/37/16/87/1049371687.db2.gz QWISGJVFHKUCIC-VIFPVBQESA-N 1 2 313.294 4.142 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccc(O)c(F)c1F ZINC001180523231 1049371693 /nfs/dbraw/zinc/37/16/93/1049371693.db2.gz QWISGJVFHKUCIC-VIFPVBQESA-N 1 2 313.294 4.142 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)Cc2cccc(F)c2)cc1OC ZINC001180497751 1049375073 /nfs/dbraw/zinc/37/50/73/1049375073.db2.gz RETROIHLXJGRGH-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)Cc2cccc(F)c2)cc1OC ZINC001180497751 1049375083 /nfs/dbraw/zinc/37/50/83/1049375083.db2.gz RETROIHLXJGRGH-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(O)cc2C(F)(F)F)cc1 ZINC001205098103 1049375845 /nfs/dbraw/zinc/37/58/45/1049375845.db2.gz KRJUBMHHTHBYKA-UHFFFAOYSA-N 1 2 318.298 4.479 20 0 DIADLO CCOc1ccc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)o1 ZINC001180558173 1049381843 /nfs/dbraw/zinc/38/18/43/1049381843.db2.gz KOZPYXXRMYSSIK-UHFFFAOYSA-N 1 2 307.340 4.121 20 0 DIADLO CCOc1ccc(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)o1 ZINC001180558173 1049381857 /nfs/dbraw/zinc/38/18/57/1049381857.db2.gz KOZPYXXRMYSSIK-UHFFFAOYSA-N 1 2 307.340 4.121 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1Cl ZINC000486066436 1049383400 /nfs/dbraw/zinc/38/34/00/1049383400.db2.gz DFUORBANKQEKGZ-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO Cc1ccc(Nc2noc3cc(Br)ccc23)c(C)[nH+]1 ZINC001203363737 1049384146 /nfs/dbraw/zinc/38/41/46/1049384146.db2.gz WIPAGKRCIDPWLF-UHFFFAOYSA-N 1 2 318.174 4.346 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(-c2ccc(O)cc2)cc1 ZINC001205140243 1049392006 /nfs/dbraw/zinc/39/20/06/1049392006.db2.gz KUCBHEAFYQRVAU-UHFFFAOYSA-N 1 2 315.376 4.289 20 0 DIADLO C[N@@H+](Cc1c(F)cccc1F)C[C@@H]1CC[C@H](c2ccccc2)O1 ZINC001194570809 1049392926 /nfs/dbraw/zinc/39/29/26/1049392926.db2.gz PTHGFFOKOXCRLX-HNAYVOBHSA-N 1 2 317.379 4.317 20 0 DIADLO C[N@H+](Cc1c(F)cccc1F)C[C@@H]1CC[C@H](c2ccccc2)O1 ZINC001194570809 1049392941 /nfs/dbraw/zinc/39/29/41/1049392941.db2.gz PTHGFFOKOXCRLX-HNAYVOBHSA-N 1 2 317.379 4.317 20 0 DIADLO COc1cc(Cl)cc(-c2cc(F)c(C[NH+](C)C)c(F)c2)c1 ZINC001205144828 1049393356 /nfs/dbraw/zinc/39/33/56/1049393356.db2.gz NHPSXXIMGKMXPH-UHFFFAOYSA-N 1 2 311.759 4.355 20 0 DIADLO Cc1cc(OCc2nc3cccnc3s2)c2ccccc2[nH+]1 ZINC000486202249 1049401702 /nfs/dbraw/zinc/40/17/02/1049401702.db2.gz GJMSZBGIGXLIFB-UHFFFAOYSA-N 1 2 307.378 4.127 20 0 DIADLO Cc1cc(C[NH+](Cc2cccnc2)Cc2cccnc2)ccc1F ZINC001205187078 1049405352 /nfs/dbraw/zinc/40/53/52/1049405352.db2.gz MCPIEYLORNHMTF-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ccc(C[NH+](Cc2ccccn2)Cc2ccccn2)cc1F ZINC001205205871 1049411106 /nfs/dbraw/zinc/41/11/06/1049411106.db2.gz LJEMVGLFNFCCOA-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)[NH+]1CCC(C)CC1 ZINC000003538714 1049433138 /nfs/dbraw/zinc/43/31/38/1049433138.db2.gz YHZHFIRWQLDXOV-LLVKDONJSA-N 1 2 315.244 4.052 20 0 DIADLO CC[C@H](CC(C)C)c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001205322407 1049437706 /nfs/dbraw/zinc/43/77/06/1049437706.db2.gz WBIQQMRTLIOTKP-CQSZACIVSA-N 1 2 310.401 4.462 20 0 DIADLO Cc1cc(C[NH2+]C(c2cccc(C)c2)c2cccc(C)c2)nn1C ZINC000486580317 1049439101 /nfs/dbraw/zinc/43/91/01/1049439101.db2.gz HRGYSORKNYSOPC-UHFFFAOYSA-N 1 2 319.452 4.225 20 0 DIADLO Cc1ncccc1Nc1cc[nH+]c2cc(Br)ccc12 ZINC001205354595 1049447352 /nfs/dbraw/zinc/44/73/52/1049447352.db2.gz FCWXVJQZNRWXER-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO COc1cc([NH2+]C[C@@H]2CCCC[C@H]2C)c(OC)c(C)c1OC ZINC001181206226 1049452838 /nfs/dbraw/zinc/45/28/38/1049452838.db2.gz QXPZUIBQFJNXCD-OCCSQVGLSA-N 1 2 307.434 4.259 20 0 DIADLO CC[C@]1(C)C[N@H+](Cc2ccc(Oc3ccccc3)o2)CCO1 ZINC001205426832 1049467638 /nfs/dbraw/zinc/46/76/38/1049467638.db2.gz OJTQCFWSGOUCGV-GOSISDBHSA-N 1 2 301.386 4.073 20 0 DIADLO CC[C@]1(C)C[N@@H+](Cc2ccc(Oc3ccccc3)o2)CCO1 ZINC001205426832 1049467648 /nfs/dbraw/zinc/46/76/48/1049467648.db2.gz OJTQCFWSGOUCGV-GOSISDBHSA-N 1 2 301.386 4.073 20 0 DIADLO CC(C)C1(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3Cl)C2)CC1 ZINC001205447006 1049472442 /nfs/dbraw/zinc/47/24/42/1049472442.db2.gz XJIDCGYAJWLEEP-MRXNPFEDSA-N 1 2 311.828 4.289 20 0 DIADLO CC(C)C1(C[N@H+]2CCO[C@@H](c3ccc(F)cc3Cl)C2)CC1 ZINC001205447006 1049472445 /nfs/dbraw/zinc/47/24/45/1049472445.db2.gz XJIDCGYAJWLEEP-MRXNPFEDSA-N 1 2 311.828 4.289 20 0 DIADLO CC(C)[N@H+](CCC(=O)Nc1cccc2ccccc21)CC(F)F ZINC000486796886 1049474722 /nfs/dbraw/zinc/47/47/22/1049474722.db2.gz BWAAQNXWTXEHHD-UHFFFAOYSA-N 1 2 320.383 4.144 20 0 DIADLO CC(C)[N@@H+](CCC(=O)Nc1cccc2ccccc21)CC(F)F ZINC000486796886 1049474725 /nfs/dbraw/zinc/47/47/25/1049474725.db2.gz BWAAQNXWTXEHHD-UHFFFAOYSA-N 1 2 320.383 4.144 20 0 DIADLO C/C=C\C[C@@H]([NH2+]C1CC(c2ccc(Cl)cc2)C1)C(=O)OCC ZINC001181453684 1049478405 /nfs/dbraw/zinc/47/84/05/1049478405.db2.gz BOMUCOPBIJKGDG-ZUQUYWSBSA-N 1 2 321.848 4.074 20 0 DIADLO Cc1c(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)ccnc1F ZINC000862245519 1049480124 /nfs/dbraw/zinc/48/01/24/1049480124.db2.gz REGUQXHDYCLDBT-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1c(C[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)ccnc1F ZINC000862245519 1049480130 /nfs/dbraw/zinc/48/01/30/1049480130.db2.gz REGUQXHDYCLDBT-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO C[C@@H]([NH2+]c1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1)C1CC(F)(F)C1 ZINC000862260640 1049483174 /nfs/dbraw/zinc/48/31/74/1049483174.db2.gz ANOVZXBATSSCEQ-MGPQQGTHSA-N 1 2 324.415 4.146 20 0 DIADLO CCON(Cc1ccc(-n2cc[nH+]c2)cc1)CC1CCCCC1 ZINC001195188900 1049485914 /nfs/dbraw/zinc/48/59/14/1049485914.db2.gz ZZEISLRAKJDFJY-UHFFFAOYSA-N 1 2 313.445 4.206 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@@H+]1CC[C@](F)(c2ccccc2C)C1 ZINC001205517643 1049491570 /nfs/dbraw/zinc/49/15/70/1049491570.db2.gz UASRQBUKZXSLQE-QGZVFWFLSA-N 1 2 321.827 4.005 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@H+]1CC[C@](F)(c2ccccc2C)C1 ZINC001205517643 1049491576 /nfs/dbraw/zinc/49/15/76/1049491576.db2.gz UASRQBUKZXSLQE-QGZVFWFLSA-N 1 2 321.827 4.005 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@H+](CC)Cc1occc1C ZINC001195233725 1049493139 /nfs/dbraw/zinc/49/31/39/1049493139.db2.gz KPQRZOGQWVXYEX-UHFFFAOYSA-N 1 2 315.392 4.119 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@@H+](CC)Cc1occc1C ZINC001195233725 1049493150 /nfs/dbraw/zinc/49/31/50/1049493150.db2.gz KPQRZOGQWVXYEX-UHFFFAOYSA-N 1 2 315.392 4.119 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3CCC(C)=C(Br)C3)cc21 ZINC001205547528 1049494851 /nfs/dbraw/zinc/49/48/51/1049494851.db2.gz CZQKMMITVCXLJZ-UHFFFAOYSA-N 1 2 319.246 4.351 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3CCC(C)=C(Br)C3)cc21 ZINC001205547528 1049494860 /nfs/dbraw/zinc/49/48/60/1049494860.db2.gz CZQKMMITVCXLJZ-UHFFFAOYSA-N 1 2 319.246 4.351 20 0 DIADLO C[C@@H](CC1CCCC1)Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001205601532 1049508942 /nfs/dbraw/zinc/50/89/42/1049508942.db2.gz XJFYAWPNNYZIBH-HRCADAONSA-N 1 2 317.477 4.076 20 0 DIADLO COc1cc(C)cc(NCc2ccc(-n3cc[nH+]c3)cc2)c1C ZINC000487191930 1049529136 /nfs/dbraw/zinc/52/91/36/1049529136.db2.gz TUJONOPLZSZKGU-UHFFFAOYSA-N 1 2 307.397 4.110 20 0 DIADLO CC[C@@H](C)[C@H](C[NH2+]CC(F)(F)c1ccc(Cl)cc1)OC ZINC001205735359 1049546871 /nfs/dbraw/zinc/54/68/71/1049546871.db2.gz JNTRBEDIOBSVAA-RISCZKNCSA-N 1 2 305.796 4.083 20 0 DIADLO Cc1nnc(C[N@@H+](C)Cc2ccccc2-c2ccccc2C)s1 ZINC000668774230 1049548197 /nfs/dbraw/zinc/54/81/97/1049548197.db2.gz RJKMDNHHYMQZIK-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Cc1nnc(C[N@H+](C)Cc2ccccc2-c2ccccc2C)s1 ZINC000668774230 1049548210 /nfs/dbraw/zinc/54/82/10/1049548210.db2.gz RJKMDNHHYMQZIK-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCN(C)C[C@H]1c1ccccc1 ZINC000339054652 1049560109 /nfs/dbraw/zinc/56/01/09/1049560109.db2.gz WHMBBJQDLQMZPW-NRFANRHFSA-N 1 2 323.484 4.002 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCN(C)C[C@H]1c1ccccc1 ZINC000339054652 1049560118 /nfs/dbraw/zinc/56/01/18/1049560118.db2.gz WHMBBJQDLQMZPW-NRFANRHFSA-N 1 2 323.484 4.002 20 0 DIADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1cc(Br)cc(C(F)(F)F)c1 ZINC001182061279 1049565574 /nfs/dbraw/zinc/56/55/74/1049565574.db2.gz CYWVEYJAWSENAG-DTWKUNHWSA-N 1 2 322.168 4.308 20 0 DIADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cc(Br)cc(C(F)(F)F)c1 ZINC001182061279 1049565586 /nfs/dbraw/zinc/56/55/86/1049565586.db2.gz CYWVEYJAWSENAG-DTWKUNHWSA-N 1 2 322.168 4.308 20 0 DIADLO CCCCn1nc(C)c(CNc2ccc([NH2+]C)cc2)c1Cl ZINC000863481210 1049567512 /nfs/dbraw/zinc/56/75/12/1049567512.db2.gz CHZUCBPUABJZCG-UHFFFAOYSA-N 1 2 306.841 4.299 20 0 DIADLO OCCCCCCC[N@@H+]1CCn2c(cc3ccc(Cl)cc32)C1 ZINC000773973405 1049569318 /nfs/dbraw/zinc/56/93/18/1049569318.db2.gz WXZLRETVAURJME-UHFFFAOYSA-N 1 2 320.864 4.053 20 0 DIADLO OCCCCCCC[N@H+]1CCn2c(cc3ccc(Cl)cc32)C1 ZINC000773973405 1049569329 /nfs/dbraw/zinc/56/93/29/1049569329.db2.gz WXZLRETVAURJME-UHFFFAOYSA-N 1 2 320.864 4.053 20 0 DIADLO Cc1csc(C[N@@H+](C)Cc2oc3c(cccc3C)c2C)n1 ZINC001195788287 1049570973 /nfs/dbraw/zinc/57/09/73/1049570973.db2.gz GQZBEUJPEWKOFN-UHFFFAOYSA-N 1 2 300.427 4.447 20 0 DIADLO Cc1csc(C[N@H+](C)Cc2oc3c(cccc3C)c2C)n1 ZINC001195788287 1049570986 /nfs/dbraw/zinc/57/09/86/1049570986.db2.gz GQZBEUJPEWKOFN-UHFFFAOYSA-N 1 2 300.427 4.447 20 0 DIADLO C[C@H]([NH2+]C[C@@H]1CCCC[C@H]1c1ccccc1)C(=O)OC(C)(C)C ZINC001205830296 1049576148 /nfs/dbraw/zinc/57/61/48/1049576148.db2.gz AFRYTJDHPUWSHC-SZMVWBNQSA-N 1 2 317.473 4.280 20 0 DIADLO CCCCC[N@@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC001195902131 1049581600 /nfs/dbraw/zinc/58/16/00/1049581600.db2.gz IZGSQZPIKOFNPV-UHFFFAOYSA-N 1 2 321.262 4.479 20 0 DIADLO CCCCC[N@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC001195902131 1049581617 /nfs/dbraw/zinc/58/16/17/1049581617.db2.gz IZGSQZPIKOFNPV-UHFFFAOYSA-N 1 2 321.262 4.479 20 0 DIADLO O=C(C[NH+]1CCC(C2CCCCC2)CC1)c1ccccc1F ZINC001195862666 1049581900 /nfs/dbraw/zinc/58/19/00/1049581900.db2.gz NFXIHQVQEMQDBC-UHFFFAOYSA-N 1 2 303.421 4.301 20 0 DIADLO CC(C)OC(=O)[C@H](C)[NH2+][C@H]1CCCC[C@@H]1c1ccccc1Cl ZINC001205849017 1049582359 /nfs/dbraw/zinc/58/23/59/1049582359.db2.gz KUDNBKUDPVDHLJ-LXZKKBNFSA-N 1 2 323.864 4.296 20 0 DIADLO Cc1cnccc1C[N@@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001205862428 1049585556 /nfs/dbraw/zinc/58/55/56/1049585556.db2.gz AYYVSZQJVBZYDQ-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cnccc1C[N@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001205862428 1049585569 /nfs/dbraw/zinc/58/55/69/1049585569.db2.gz AYYVSZQJVBZYDQ-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(C[S@](=O)Cc2ccc(Cl)cc2C)c(C)[nH+]1 ZINC000773994305 1049585513 /nfs/dbraw/zinc/58/55/13/1049585513.db2.gz MNVLCLUQPOHIQK-HXUWFJFHSA-N 1 2 307.846 4.109 20 0 DIADLO CCC[C@H](C)CCC[N@H+](C)[C@H](C(=O)OC)c1cccc(OC)c1 ZINC001195883667 1049586562 /nfs/dbraw/zinc/58/65/62/1049586562.db2.gz JGACOMMGDLYUGB-YJBOKZPZSA-N 1 2 321.461 4.058 20 0 DIADLO CCC[C@H](C)CCC[N@@H+](C)[C@H](C(=O)OC)c1cccc(OC)c1 ZINC001195883667 1049586580 /nfs/dbraw/zinc/58/65/80/1049586580.db2.gz JGACOMMGDLYUGB-YJBOKZPZSA-N 1 2 321.461 4.058 20 0 DIADLO Cc1ccc(Nc2cc(Cl)c3c(c2)CCC(=O)N3C)c(C)[nH+]1 ZINC001205888474 1049592512 /nfs/dbraw/zinc/59/25/12/1049592512.db2.gz NAVHBDWNCZIQAE-UHFFFAOYSA-N 1 2 315.804 4.004 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](C)c2cc3cnccc3o2)c(C)[nH+]1 ZINC001205900122 1049593953 /nfs/dbraw/zinc/59/39/53/1049593953.db2.gz VDKMXMBIVHFDAA-GFCCVEGCSA-N 1 2 324.384 4.031 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3C[C@H]3c3ccco3)c2)[nH+]c1C ZINC000863861466 1049598188 /nfs/dbraw/zinc/59/81/88/1049598188.db2.gz YAAQTHFVTSDXKY-HZPDHXFCSA-N 1 2 321.380 4.029 20 0 DIADLO C[C@@]1(C2CC2)C[N@H+](CCc2cc(Cl)cc(Cl)c2)CCO1 ZINC001196055334 1049606681 /nfs/dbraw/zinc/60/66/81/1049606681.db2.gz BBCWJKUNVLNHFG-INIZCTEOSA-N 1 2 314.256 4.037 20 0 DIADLO C[C@@]1(C2CC2)C[N@@H+](CCc2cc(Cl)cc(Cl)c2)CCO1 ZINC001196055334 1049606685 /nfs/dbraw/zinc/60/66/85/1049606685.db2.gz BBCWJKUNVLNHFG-INIZCTEOSA-N 1 2 314.256 4.037 20 0 DIADLO CCCC(=CC(=O)NCc1ccccc1-n1cc[nH+]c1)CCC ZINC000774167898 1049617033 /nfs/dbraw/zinc/61/70/33/1049617033.db2.gz LWFPACBDOGQKTP-UHFFFAOYSA-N 1 2 311.429 4.015 20 0 DIADLO Cc1c[nH]c2ncc(Nc3cc[nH+]c4ccc(Cl)cc34)cc12 ZINC001206020694 1049630441 /nfs/dbraw/zinc/63/04/41/1049630441.db2.gz OKPXKIMXGGGMBF-UHFFFAOYSA-N 1 2 308.772 4.238 20 0 DIADLO Cl/C=C(\Cl)C[NH+]1CCC2(CCc3ccccc3O2)CC1 ZINC001196284642 1049638779 /nfs/dbraw/zinc/63/87/79/1049638779.db2.gz CTPALQCAEYGCBQ-KAMYIIQDSA-N 1 2 312.240 4.165 20 0 DIADLO CC(C)(C)[C@H]1C[C@@H](Nc2cccc(-n3cc[nH+]c3)c2)CS1 ZINC000488358872 1049640245 /nfs/dbraw/zinc/64/02/45/1049640245.db2.gz YNWPITRCCBJFJZ-GDBMZVCRSA-N 1 2 301.459 4.204 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(O)cc(Cl)c2)Cc2ccccc2O1 ZINC001206085128 1049650072 /nfs/dbraw/zinc/65/00/72/1049650072.db2.gz RSFPEOHGBABYGW-UHFFFAOYSA-N 1 2 317.816 4.219 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(O)cc(Cl)c2)Cc2ccccc2O1 ZINC001206085128 1049650077 /nfs/dbraw/zinc/65/00/77/1049650077.db2.gz RSFPEOHGBABYGW-UHFFFAOYSA-N 1 2 317.816 4.219 20 0 DIADLO C[C@@]12CCN(c3cc[nH+]c4c(Cl)cccc34)C[C@@H]1C2(F)F ZINC000488466428 1049659879 /nfs/dbraw/zinc/65/98/79/1049659879.db2.gz QDMINPZORBOTBD-DZGCQCFKSA-N 1 2 308.759 4.370 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001206127383 1049660281 /nfs/dbraw/zinc/66/02/81/1049660281.db2.gz GNXIDCKTAYUARO-ZDUSSCGKSA-N 1 2 309.438 4.258 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001206127383 1049660288 /nfs/dbraw/zinc/66/02/88/1049660288.db2.gz GNXIDCKTAYUARO-ZDUSSCGKSA-N 1 2 309.438 4.258 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1nc2c(s1)C[C@@H](C)CC2 ZINC001206128767 1049662406 /nfs/dbraw/zinc/66/24/06/1049662406.db2.gz ZYZBGGYEMUUPLD-NWDGAFQWSA-N 1 2 318.511 4.449 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1nc2c(s1)C[C@@H](C)CC2 ZINC001206128767 1049662412 /nfs/dbraw/zinc/66/24/12/1049662412.db2.gz ZYZBGGYEMUUPLD-NWDGAFQWSA-N 1 2 318.511 4.449 20 0 DIADLO C[C@H]1CO[C@H](c2cccc(C(F)(F)F)c2)CN1c1cccc[nH+]1 ZINC000488490595 1049662855 /nfs/dbraw/zinc/66/28/55/1049662855.db2.gz QXZXHSZQOOJUMX-WFASDCNBSA-N 1 2 322.330 4.067 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+][C@@H](C)c1nnc([C@@H](C)CC)[nH]1 ZINC000488501987 1049664569 /nfs/dbraw/zinc/66/45/69/1049664569.db2.gz MCNFAAKVSNXJGN-IHRRRGAJSA-N 1 2 316.449 4.129 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)c(F)c(F)c(F)c1F)c1ccsc1 ZINC000774507540 1049678195 /nfs/dbraw/zinc/67/81/95/1049678195.db2.gz HRSJFBLWIHKRRB-LURJTMIESA-N 1 2 307.287 4.294 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1cc(F)ccc1Br ZINC001196693679 1049681672 /nfs/dbraw/zinc/68/16/72/1049681672.db2.gz OJYMUPZVEMMGJS-VIFPVBQESA-N 1 2 322.168 4.208 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1cc(F)ccc1Br ZINC001196693679 1049681676 /nfs/dbraw/zinc/68/16/76/1049681676.db2.gz OJYMUPZVEMMGJS-VIFPVBQESA-N 1 2 322.168 4.208 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+]1C[C@H](C)OC(C)(C)C1 ZINC000488614925 1049684644 /nfs/dbraw/zinc/68/46/44/1049684644.db2.gz SMAANTODRYAVFZ-RYUDHWBXSA-N 1 2 312.251 4.009 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+]1C[C@H](C)OC(C)(C)C1 ZINC000488614925 1049684643 /nfs/dbraw/zinc/68/46/43/1049684643.db2.gz SMAANTODRYAVFZ-RYUDHWBXSA-N 1 2 312.251 4.009 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2cnc(Cl)n2C)o1 ZINC001204346540 1049686078 /nfs/dbraw/zinc/68/60/78/1049686078.db2.gz ACQOOVQIPFPNQA-SWLSCSKDSA-N 1 2 321.852 4.202 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2cnc(Cl)n2C)o1 ZINC001204346540 1049686081 /nfs/dbraw/zinc/68/60/81/1049686081.db2.gz ACQOOVQIPFPNQA-SWLSCSKDSA-N 1 2 321.852 4.202 20 0 DIADLO COC(=O)[C@H](c1ccsc1)[N@H+](C)C[C@H](C)C1CCCCC1 ZINC001196818609 1049693288 /nfs/dbraw/zinc/69/32/88/1049693288.db2.gz LVGNLNKBBUDEFU-BBRMVZONSA-N 1 2 309.475 4.110 20 0 DIADLO COC(=O)[C@H](c1ccsc1)[N@@H+](C)C[C@H](C)C1CCCCC1 ZINC001196818609 1049693295 /nfs/dbraw/zinc/69/32/95/1049693295.db2.gz LVGNLNKBBUDEFU-BBRMVZONSA-N 1 2 309.475 4.110 20 0 DIADLO CCc1noc([C@@H](C)[N@H+](CC)Cc2ccc3ccccc3c2)n1 ZINC000488762278 1049693906 /nfs/dbraw/zinc/69/39/06/1049693906.db2.gz PUVDQLGGQVQOTE-CQSZACIVSA-N 1 2 309.413 4.368 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+](CC)Cc2ccc3ccccc3c2)n1 ZINC000488762278 1049693910 /nfs/dbraw/zinc/69/39/10/1049693910.db2.gz PUVDQLGGQVQOTE-CQSZACIVSA-N 1 2 309.413 4.368 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)cnc1F ZINC001206276634 1049695812 /nfs/dbraw/zinc/69/58/12/1049695812.db2.gz LZLHJNVFNOGPDL-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)cnc1F ZINC001206276634 1049695831 /nfs/dbraw/zinc/69/58/31/1049695831.db2.gz LZLHJNVFNOGPDL-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1cccc(Cl)c1C ZINC001182667217 1049697156 /nfs/dbraw/zinc/69/71/56/1049697156.db2.gz VDUMXNQQLJCWJU-HNNXBMFYSA-N 1 2 311.853 4.201 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1cccc(Cl)c1C ZINC001182667217 1049697160 /nfs/dbraw/zinc/69/71/60/1049697160.db2.gz VDUMXNQQLJCWJU-HNNXBMFYSA-N 1 2 311.853 4.201 20 0 DIADLO CSC[C@H]1CCCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000488977520 1049714091 /nfs/dbraw/zinc/71/40/91/1049714091.db2.gz MDEXMRFYPNEETH-LBPRGKRZSA-N 1 2 306.862 4.468 20 0 DIADLO CCCCO[C@H]1C[C@@H](Nc2ccc(N3CCCC3)c[nH+]2)C1(C)C ZINC001206376404 1049723526 /nfs/dbraw/zinc/72/35/26/1049723526.db2.gz GBWCQIILZBAWIS-SJORKVTESA-N 1 2 317.477 4.078 20 0 DIADLO COc1cnccc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)s1 ZINC001206480234 1049739876 /nfs/dbraw/zinc/73/98/76/1049739876.db2.gz OUBSSWPGCXHIEY-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cnccc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)s1 ZINC001206480234 1049739879 /nfs/dbraw/zinc/73/98/79/1049739879.db2.gz OUBSSWPGCXHIEY-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO CCCCC[C@H]1CCCN1C(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000489301467 1049742346 /nfs/dbraw/zinc/74/23/46/1049742346.db2.gz DMUKQEQXNMWATH-SFHVURJKSA-N 1 2 311.429 4.057 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+]1CCc2cc(F)c(F)cc2C1 ZINC001197342024 1049746349 /nfs/dbraw/zinc/74/63/49/1049746349.db2.gz MBPBWQJWRMOUEA-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+]1CCc2cc(F)c(F)cc2C1 ZINC001197342024 1049746353 /nfs/dbraw/zinc/74/63/53/1049746353.db2.gz MBPBWQJWRMOUEA-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(Oc3ccccc3)o2)[C@@H](C)CO1 ZINC001206523318 1049750014 /nfs/dbraw/zinc/75/00/14/1049750014.db2.gz JHJZCUCLTXULQU-LSDHHAIUSA-N 1 2 301.386 4.071 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)o2)[C@@H](C)CO1 ZINC001206523318 1049750029 /nfs/dbraw/zinc/75/00/29/1049750029.db2.gz JHJZCUCLTXULQU-LSDHHAIUSA-N 1 2 301.386 4.071 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCCC[C@H]1c1ncccn1 ZINC001197448573 1049750229 /nfs/dbraw/zinc/75/02/29/1049750229.db2.gz BWVSSQHBCVDJDX-SFHVURJKSA-N 1 2 310.445 4.031 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCCC[C@H]1c1ncccn1 ZINC001197448573 1049750237 /nfs/dbraw/zinc/75/02/37/1049750237.db2.gz BWVSSQHBCVDJDX-SFHVURJKSA-N 1 2 310.445 4.031 20 0 DIADLO Cc1ccc2ncc(C[N@@H+]3CCCC[C@H]3c3ncccn3)cc2c1 ZINC001197451866 1049754443 /nfs/dbraw/zinc/75/44/43/1049754443.db2.gz ZDHZBZJWKNSIGH-IBGZPJMESA-N 1 2 318.424 4.060 20 0 DIADLO Cc1ccc2ncc(C[N@H+]3CCCC[C@H]3c3ncccn3)cc2c1 ZINC001197451866 1049754450 /nfs/dbraw/zinc/75/44/50/1049754450.db2.gz ZDHZBZJWKNSIGH-IBGZPJMESA-N 1 2 318.424 4.060 20 0 DIADLO Cc1ccc(C[N@@H+]2[C@H](C)CC[C@@H]2C(=O)OC(C)(C)C)cc1Cl ZINC001206578463 1049761273 /nfs/dbraw/zinc/76/12/73/1049761273.db2.gz WTZORBDDKYCIHK-CZUORRHYSA-N 1 2 323.864 4.343 20 0 DIADLO Cc1ccc(C[N@H+]2[C@H](C)CC[C@@H]2C(=O)OC(C)(C)C)cc1Cl ZINC001206578463 1049761278 /nfs/dbraw/zinc/76/12/78/1049761278.db2.gz WTZORBDDKYCIHK-CZUORRHYSA-N 1 2 323.864 4.343 20 0 DIADLO Cc1cc2cc[nH]c2cc1-c1ccc(C[NH+]2CCOCC2)cc1F ZINC001206712399 1049782566 /nfs/dbraw/zinc/78/25/66/1049782566.db2.gz LZLUTNPNSCJXJJ-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Cc1cc(-c2ccc(C[NH+]3CCOCC3)cc2F)cc2cc[nH]c21 ZINC001206733860 1049786742 /nfs/dbraw/zinc/78/67/42/1049786742.db2.gz FHQCDBAMMKSAKO-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO COC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nc(C)sc1C ZINC000490079022 1049798602 /nfs/dbraw/zinc/79/86/02/1049798602.db2.gz XXFIJSIEBORMFO-MRXNPFEDSA-N 1 2 324.877 4.233 20 0 DIADLO COC[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nc(C)sc1C ZINC000490079022 1049798607 /nfs/dbraw/zinc/79/86/07/1049798607.db2.gz XXFIJSIEBORMFO-MRXNPFEDSA-N 1 2 324.877 4.233 20 0 DIADLO CC[N@H+](Cc1csc(C)n1)Cc1cccc(C(F)(F)F)c1 ZINC001206805880 1049804468 /nfs/dbraw/zinc/80/44/68/1049804468.db2.gz QIVWRTLXXGHJLM-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CC[N@@H+](Cc1csc(C)n1)Cc1cccc(C(F)(F)F)c1 ZINC001206805880 1049804479 /nfs/dbraw/zinc/80/44/79/1049804479.db2.gz QIVWRTLXXGHJLM-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO COc1ccc(-c2cc(C[N@@H+]3CC[C@H]3c3ccccc3)no2)cc1 ZINC001206829777 1049807293 /nfs/dbraw/zinc/80/72/93/1049807293.db2.gz NXGHHJYPHPNYGH-IBGZPJMESA-N 1 2 320.392 4.297 20 0 DIADLO COc1ccc(-c2cc(C[N@H+]3CC[C@H]3c3ccccc3)no2)cc1 ZINC001206829777 1049807296 /nfs/dbraw/zinc/80/72/96/1049807296.db2.gz NXGHHJYPHPNYGH-IBGZPJMESA-N 1 2 320.392 4.297 20 0 DIADLO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)cncc2F)cc1 ZINC001206861109 1049814512 /nfs/dbraw/zinc/81/45/12/1049814512.db2.gz UHPIPXIWGZFLRX-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc([C@H]2CCC[N@H+]2Cc2c(F)cncc2F)cc1 ZINC001206861109 1049814522 /nfs/dbraw/zinc/81/45/22/1049814522.db2.gz UHPIPXIWGZFLRX-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CSc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c(F)cncc1F ZINC001206859448 1049815600 /nfs/dbraw/zinc/81/56/00/1049815600.db2.gz BACULBJXCNYHCT-INIZCTEOSA-N 1 2 320.408 4.419 20 0 DIADLO CSc1ccccc1[C@@H]1CCC[N@H+]1Cc1c(F)cncc1F ZINC001206859448 1049815615 /nfs/dbraw/zinc/81/56/15/1049815615.db2.gz BACULBJXCNYHCT-INIZCTEOSA-N 1 2 320.408 4.419 20 0 DIADLO Cc1ncsc1C[N@@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001206987115 1049817726 /nfs/dbraw/zinc/81/77/26/1049817726.db2.gz ORIWVRDKIXGMCG-AWEZNQCLSA-N 1 2 324.902 4.395 20 0 DIADLO Cc1ncsc1C[N@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001206987115 1049817742 /nfs/dbraw/zinc/81/77/42/1049817742.db2.gz ORIWVRDKIXGMCG-AWEZNQCLSA-N 1 2 324.902 4.395 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@H+](C)Cc1ncccc1F ZINC001207037001 1049822932 /nfs/dbraw/zinc/82/29/32/1049822932.db2.gz KPZCGYXVLJWEKX-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@@H+](C)Cc1ncccc1F ZINC001207037001 1049822938 /nfs/dbraw/zinc/82/29/38/1049822938.db2.gz KPZCGYXVLJWEKX-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO Cc1ncc(C[N@H+](Cc2ccccc2)Cc2ccccn2)s1 ZINC001207058206 1049828368 /nfs/dbraw/zinc/82/83/68/1049828368.db2.gz DCXBDYLHZQFNFD-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)s1 ZINC001207058206 1049828373 /nfs/dbraw/zinc/82/83/73/1049828373.db2.gz DCXBDYLHZQFNFD-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO CCC[NH+](CCC)Cn1ncn(-c2cccc(Cl)c2)c1=S ZINC000913057934 1049834522 /nfs/dbraw/zinc/83/45/22/1049834522.db2.gz DLPUQXBSYCBDKW-UHFFFAOYSA-N 1 2 324.881 4.136 20 0 DIADLO Fc1cnc(C[NH+]2CCC(Sc3ccccc3)CC2)c(F)c1 ZINC001207099264 1049835029 /nfs/dbraw/zinc/83/50/29/1049835029.db2.gz PCCQEJKLIRTKEI-UHFFFAOYSA-N 1 2 320.408 4.117 20 0 DIADLO CCn1ccnc1C[N@H+](C)C(c1ccccc1)c1ccccc1 ZINC001207140166 1049842703 /nfs/dbraw/zinc/84/27/03/1049842703.db2.gz FQHXVPRZMGTSIU-UHFFFAOYSA-N 1 2 305.425 4.124 20 0 DIADLO CCn1ccnc1C[N@@H+](C)C(c1ccccc1)c1ccccc1 ZINC001207140166 1049842711 /nfs/dbraw/zinc/84/27/11/1049842711.db2.gz FQHXVPRZMGTSIU-UHFFFAOYSA-N 1 2 305.425 4.124 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001207173262 1049849342 /nfs/dbraw/zinc/84/93/42/1049849342.db2.gz MKPVPPXTZOKBNW-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001207173262 1049849346 /nfs/dbraw/zinc/84/93/46/1049849346.db2.gz MKPVPPXTZOKBNW-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001207175334 1049851632 /nfs/dbraw/zinc/85/16/32/1049851632.db2.gz KRINZARXHUJGCE-MRXNPFEDSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001207175334 1049851642 /nfs/dbraw/zinc/85/16/42/1049851642.db2.gz KRINZARXHUJGCE-MRXNPFEDSA-N 1 2 305.372 4.079 20 0 DIADLO FC(F)(F)c1ccnc(Nc2ccc([NH+]3CCCCC3)cc2)n1 ZINC000029525111 1049855927 /nfs/dbraw/zinc/85/59/27/1049855927.db2.gz BUQLVCOEAQGUHJ-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO CC(C)[C@@H]1C[C@H]([NH2+]CC(F)(F)c2cc(F)cc(F)c2)CS1 ZINC001207302522 1049879105 /nfs/dbraw/zinc/87/91/05/1049879105.db2.gz QHKBJMKBUBZXQE-KBPBESRZSA-N 1 2 321.383 4.176 20 0 DIADLO CC(C)[C@@H]1C[C@@H]([NH2+]CC(F)(F)c2cc(F)cc(F)c2)CS1 ZINC001207302523 1049879726 /nfs/dbraw/zinc/87/97/26/1049879726.db2.gz QHKBJMKBUBZXQE-KGLIPLIRSA-N 1 2 321.383 4.176 20 0 DIADLO Fc1cc2c(cc1F)C[N@H+](Cc1cc3ccncc3s1)CC2 ZINC001207326831 1049880322 /nfs/dbraw/zinc/88/03/22/1049880322.db2.gz UWOWMOZLAWEVEL-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO Fc1cc2c(cc1F)C[N@@H+](Cc1cc3ccncc3s1)CC2 ZINC001207326831 1049880327 /nfs/dbraw/zinc/88/03/27/1049880327.db2.gz UWOWMOZLAWEVEL-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO CO[C@@H]1CCC[C@H]([NH2+][C@H](c2cccc(Cl)c2)C(F)F)C1 ZINC001207553297 1049908171 /nfs/dbraw/zinc/90/81/71/1049908171.db2.gz IYEATWUDYGYIEE-BFHYXJOUSA-N 1 2 303.780 4.193 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001207563933 1049909924 /nfs/dbraw/zinc/90/99/24/1049909924.db2.gz IOCDGAMHFDSMGW-ZDUSSCGKSA-N 1 2 321.408 4.365 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001207563933 1049909932 /nfs/dbraw/zinc/90/99/32/1049909932.db2.gz IOCDGAMHFDSMGW-ZDUSSCGKSA-N 1 2 321.408 4.365 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+](C)[C@@H](C)c1ccncc1 ZINC000571697791 1049942669 /nfs/dbraw/zinc/94/26/69/1049942669.db2.gz LVASGKVPTBYBIK-ZDUSSCGKSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000571697791 1049942675 /nfs/dbraw/zinc/94/26/75/1049942675.db2.gz LVASGKVPTBYBIK-ZDUSSCGKSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+](C)[C@H](C)c1ccncc1 ZINC000571697788 1049943306 /nfs/dbraw/zinc/94/33/06/1049943306.db2.gz LVASGKVPTBYBIK-CYBMUJFWSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+](C)[C@H](C)c1ccncc1 ZINC000571697788 1049943314 /nfs/dbraw/zinc/94/33/14/1049943314.db2.gz LVASGKVPTBYBIK-CYBMUJFWSA-N 1 2 304.821 4.327 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[NH2+][C@@H](C)c1cncc(F)c1 ZINC000571739230 1049947741 /nfs/dbraw/zinc/94/77/41/1049947741.db2.gz FYOWUHJXFYQDQL-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO COc1ccc2c(c1)C[C@H]([NH2+][C@@H](c1ccccc1)C(F)F)CC2 ZINC001207872275 1049948257 /nfs/dbraw/zinc/94/82/57/1049948257.db2.gz BANAVGJVJIYWCT-AEFFLSMTSA-N 1 2 317.379 4.149 20 0 DIADLO CCc1nocc1CNc1[nH+]c2ccccc2n1CCC(C)C ZINC001207876506 1049948586 /nfs/dbraw/zinc/94/85/86/1049948586.db2.gz YEGBWYWYLCOMLG-UHFFFAOYSA-N 1 2 312.417 4.245 20 0 DIADLO Cc1ccc(CCC[N@@H+]2Cc3ccc(Br)cc3C2)o1 ZINC001207937167 1049959225 /nfs/dbraw/zinc/95/92/25/1049959225.db2.gz IAKXQGPWIJEBHL-UHFFFAOYSA-N 1 2 320.230 4.299 20 0 DIADLO Cc1ccc(CCC[N@H+]2Cc3ccc(Br)cc3C2)o1 ZINC001207937167 1049959229 /nfs/dbraw/zinc/95/92/29/1049959229.db2.gz IAKXQGPWIJEBHL-UHFFFAOYSA-N 1 2 320.230 4.299 20 0 DIADLO CC1=C[C@H](C)[C@H](C[N@@H+]2Cc3cc(Br)cnc3C2)CC1 ZINC001208180601 1049982286 /nfs/dbraw/zinc/98/22/86/1049982286.db2.gz HEEPUVCLSOKGHN-STQMWFEESA-N 1 2 321.262 4.152 20 0 DIADLO CC1=C[C@H](C)[C@H](C[N@H+]2Cc3cc(Br)cnc3C2)CC1 ZINC001208180601 1049982288 /nfs/dbraw/zinc/98/22/88/1049982288.db2.gz HEEPUVCLSOKGHN-STQMWFEESA-N 1 2 321.262 4.152 20 0 DIADLO CC/C=C\CCCCC[N@@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001208194546 1049983188 /nfs/dbraw/zinc/98/31/88/1049983188.db2.gz PRHUMRULUQPYMJ-ARJAWSKDSA-N 1 2 317.477 4.077 20 0 DIADLO CC/C=C\CCCCC[N@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001208194546 1049983195 /nfs/dbraw/zinc/98/31/95/1049983195.db2.gz PRHUMRULUQPYMJ-ARJAWSKDSA-N 1 2 317.477 4.077 20 0 DIADLO CC(C)CCn1cccc1C[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000572251489 1049997770 /nfs/dbraw/zinc/99/77/70/1049997770.db2.gz BHJSLWJCGPZUFC-SFHVURJKSA-N 1 2 318.486 4.169 20 0 DIADLO CC(C)CCn1cccc1C[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000572251489 1049997773 /nfs/dbraw/zinc/99/77/73/1049997773.db2.gz BHJSLWJCGPZUFC-SFHVURJKSA-N 1 2 318.486 4.169 20 0 DIADLO FC(F)(F)c1ccc(CCC[N@@H+]2CCCC(F)(F)C2)cc1 ZINC001208687122 1050002596 /nfs/dbraw/zinc/00/25/96/1050002596.db2.gz ZOIVLCOMZMQZGY-UHFFFAOYSA-N 1 2 307.306 4.369 20 0 DIADLO FC(F)(F)c1ccc(CCC[N@H+]2CCCC(F)(F)C2)cc1 ZINC001208687122 1050002602 /nfs/dbraw/zinc/00/26/02/1050002602.db2.gz ZOIVLCOMZMQZGY-UHFFFAOYSA-N 1 2 307.306 4.369 20 0 DIADLO FC[C@@H]1CC[N@H+](CC2(c3ccccc3)CCCC2)CC1(F)F ZINC001208770401 1050010004 /nfs/dbraw/zinc/01/00/04/1050010004.db2.gz AUAKGBSXZMOGLH-INIZCTEOSA-N 1 2 311.391 4.425 20 0 DIADLO FC[C@@H]1CC[N@@H+](CC2(c3ccccc3)CCCC2)CC1(F)F ZINC001208770401 1050010010 /nfs/dbraw/zinc/01/00/10/1050010010.db2.gz AUAKGBSXZMOGLH-INIZCTEOSA-N 1 2 311.391 4.425 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@@H+]1CCCc1ccccc1C(F)(F)F ZINC001208828222 1050014220 /nfs/dbraw/zinc/01/42/20/1050014220.db2.gz IXJRFYYRGGKACP-STQMWFEESA-N 1 2 307.306 4.020 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@H+]1CCCc1ccccc1C(F)(F)F ZINC001208828222 1050014222 /nfs/dbraw/zinc/01/42/22/1050014222.db2.gz IXJRFYYRGGKACP-STQMWFEESA-N 1 2 307.306 4.020 20 0 DIADLO c1cn(-c2cccc(NC3=CCN(c4ccccc4)CC3)c2)c[nH+]1 ZINC001209058283 1050032210 /nfs/dbraw/zinc/03/22/10/1050032210.db2.gz YDLSVVHQCXBQLS-UHFFFAOYSA-N 1 2 316.408 4.078 20 0 DIADLO c1ccc(N2CC=C(Nc3ccc([NH+]4CCCC4)cc3)CC2)cc1 ZINC001209057468 1050032440 /nfs/dbraw/zinc/03/24/40/1050032440.db2.gz MQBMKYPAKQRZKY-UHFFFAOYSA-N 1 2 319.452 4.493 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCO[C@H](c3ccccc3)C2)c(Cl)c1 ZINC001209112740 1050036725 /nfs/dbraw/zinc/03/67/25/1050036725.db2.gz LRYLHSOKRPQHJB-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc(CC[N@H+]2CCO[C@H](c3ccccc3)C2)c(Cl)c1 ZINC001209112740 1050036732 /nfs/dbraw/zinc/03/67/32/1050036732.db2.gz LRYLHSOKRPQHJB-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1cc(F)cc(CC[N@@H+]2CCc3c4ccccc4oc3C2)c1 ZINC001209134083 1050039984 /nfs/dbraw/zinc/03/99/84/1050039984.db2.gz YVRQPPLSRVBKDJ-UHFFFAOYSA-N 1 2 313.347 4.312 20 0 DIADLO Fc1cc(F)cc(CC[N@H+]2CCc3c4ccccc4oc3C2)c1 ZINC001209134083 1050039990 /nfs/dbraw/zinc/03/99/90/1050039990.db2.gz YVRQPPLSRVBKDJ-UHFFFAOYSA-N 1 2 313.347 4.312 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000589598651 1050049884 /nfs/dbraw/zinc/04/98/84/1050049884.db2.gz UWIQUAOKWOXXOS-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000589598651 1050049887 /nfs/dbraw/zinc/04/98/87/1050049887.db2.gz UWIQUAOKWOXXOS-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO Cn1nc(C[NH2+]Cc2c(Cl)cccc2Cl)c2ccccc21 ZINC000589647229 1050053576 /nfs/dbraw/zinc/05/35/76/1050053576.db2.gz OQHXDTDJZSCZJU-UHFFFAOYSA-N 1 2 320.223 4.170 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nc3ccccc3n2C(F)F)o1 ZINC000589842387 1050061271 /nfs/dbraw/zinc/06/12/71/1050061271.db2.gz PFARBGRQAKFHJC-LLVKDONJSA-N 1 2 305.328 4.184 20 0 DIADLO FC(F)(F)Oc1cccc(Cl)c1C[N@@H+]1CCC2(CC2)C1 ZINC001209520727 1050065986 /nfs/dbraw/zinc/06/59/86/1050065986.db2.gz CMFLTLILZQKIQB-UHFFFAOYSA-N 1 2 305.727 4.225 20 0 DIADLO FC(F)(F)Oc1cccc(Cl)c1C[N@H+]1CCC2(CC2)C1 ZINC001209520727 1050065991 /nfs/dbraw/zinc/06/59/91/1050065991.db2.gz CMFLTLILZQKIQB-UHFFFAOYSA-N 1 2 305.727 4.225 20 0 DIADLO Cc1[nH]ncc1C[N@@H+]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC001209557892 1050068469 /nfs/dbraw/zinc/06/84/69/1050068469.db2.gz BWNJVINWTFBQGN-OAHLLOKOSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC001209557892 1050068474 /nfs/dbraw/zinc/06/84/74/1050068474.db2.gz BWNJVINWTFBQGN-OAHLLOKOSA-N 1 2 309.335 4.074 20 0 DIADLO CC(=O)N(c1nc(C[N@@H+](C)C(C)(C)C)cs1)c1ccccc1 ZINC000646088429 1050070540 /nfs/dbraw/zinc/07/05/40/1050070540.db2.gz FCPUNPDYFKVECY-UHFFFAOYSA-N 1 2 317.458 4.058 20 0 DIADLO CC(=O)N(c1nc(C[N@H+](C)C(C)(C)C)cs1)c1ccccc1 ZINC000646088429 1050070546 /nfs/dbraw/zinc/07/05/46/1050070546.db2.gz FCPUNPDYFKVECY-UHFFFAOYSA-N 1 2 317.458 4.058 20 0 DIADLO Clc1cnc2[nH]cc(C[N@@H+]3CCC[C@@H]3c3nccs3)c2c1 ZINC001209598876 1050071409 /nfs/dbraw/zinc/07/14/09/1050071409.db2.gz DSNFBNZDVNHBDD-CYBMUJFWSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1cnc2[nH]cc(C[N@H+]3CCC[C@@H]3c3nccs3)c2c1 ZINC001209598876 1050071412 /nfs/dbraw/zinc/07/14/12/1050071412.db2.gz DSNFBNZDVNHBDD-CYBMUJFWSA-N 1 2 318.833 4.010 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1F)Cc1cnc(Cl)cc1C ZINC001209633593 1050072971 /nfs/dbraw/zinc/07/29/71/1050072971.db2.gz IXGLHJHOYUPKPH-UHFFFAOYSA-N 1 2 310.775 4.344 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1F)Cc1cnc(Cl)cc1C ZINC001209633593 1050072976 /nfs/dbraw/zinc/07/29/76/1050072976.db2.gz IXGLHJHOYUPKPH-UHFFFAOYSA-N 1 2 310.775 4.344 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2c(F)cccc2N2CCCC2)n1 ZINC000590074479 1050074306 /nfs/dbraw/zinc/07/43/06/1050074306.db2.gz KGXFJURPVPLLPZ-ZDUSSCGKSA-N 1 2 319.449 4.042 20 0 DIADLO Fc1ccc2c(C[N@@H+]3Cc4cccc(Cl)c4C3)c[nH]c2c1 ZINC001209694821 1050076482 /nfs/dbraw/zinc/07/64/82/1050076482.db2.gz XUIWYIKARILSKP-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO Fc1ccc2c(C[N@H+]3Cc4cccc(Cl)c4C3)c[nH]c2c1 ZINC001209694821 1050076487 /nfs/dbraw/zinc/07/64/87/1050076487.db2.gz XUIWYIKARILSKP-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO COc1c(Cl)ccc(C[NH+]2CC(c3ccccc3)C2)c1F ZINC001209700985 1050077566 /nfs/dbraw/zinc/07/75/66/1050077566.db2.gz PVCLKBQWUSNBIX-UHFFFAOYSA-N 1 2 305.780 4.087 20 0 DIADLO Nc1cccc2c(Br)cn(-c3cc[nH+]cc3Cl)c21 ZINC001212162496 1050078679 /nfs/dbraw/zinc/07/86/79/1050078679.db2.gz QRCPIGZRHVSFRV-UHFFFAOYSA-N 1 2 322.593 4.024 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cc3cc(Cl)ccc3[nH]1)C2 ZINC001209722280 1050078952 /nfs/dbraw/zinc/07/89/52/1050078952.db2.gz ZKSZFLJZFBYDEQ-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cc3cc(Cl)ccc3[nH]1)C2 ZINC001209722280 1050078959 /nfs/dbraw/zinc/07/89/59/1050078959.db2.gz ZKSZFLJZFBYDEQ-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1[nH]nc3ccc(Cl)cc31)C2 ZINC001209750597 1050080888 /nfs/dbraw/zinc/08/08/88/1050080888.db2.gz JOCIVBWXWHRZGN-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1[nH]nc3ccc(Cl)cc31)C2 ZINC001209750597 1050080892 /nfs/dbraw/zinc/08/08/92/1050080892.db2.gz JOCIVBWXWHRZGN-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO COc1ccc(Nc2ccc3c(c2)[nH+]cn3C)c2ccccc12 ZINC001209925194 1050107052 /nfs/dbraw/zinc/10/70/52/1050107052.db2.gz SEZUXEKXGZBPCQ-UHFFFAOYSA-N 1 2 303.365 4.479 20 0 DIADLO Fc1ccc(Nc2ccccc2C[NH+]2CCOCC2)cc1Cl ZINC001209927151 1050107810 /nfs/dbraw/zinc/10/78/10/1050107810.db2.gz MXHNSEGVNHEJRJ-UHFFFAOYSA-N 1 2 320.795 4.055 20 0 DIADLO CCCc1cccc(Nc2ccccc2C[NH+]2CCOCC2)c1 ZINC001209933319 1050107831 /nfs/dbraw/zinc/10/78/31/1050107831.db2.gz GOYYZYGTLFKFFF-UHFFFAOYSA-N 1 2 310.441 4.215 20 0 DIADLO Cc1cc(F)cc(C)c1Nc1ccccc1C[NH+]1CCOCC1 ZINC001209933373 1050108109 /nfs/dbraw/zinc/10/81/09/1050108109.db2.gz IRUGCDOYSRSJTK-UHFFFAOYSA-N 1 2 314.404 4.018 20 0 DIADLO CCOc1cccc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)C)no2)c1 ZINC000068839571 1050111327 /nfs/dbraw/zinc/11/13/27/1050111327.db2.gz CYVZTWLCSDPVRG-OLZOCXBDSA-N 1 2 303.406 4.004 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@H+](Cc2ncc(-c3ccccc3)o2)C1 ZINC000573024432 1050116467 /nfs/dbraw/zinc/11/64/67/1050116467.db2.gz JCOZDCNQVBJTQN-FQEVSTJZSA-N 1 2 322.383 4.412 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@@H+](Cc2ncc(-c3ccccc3)o2)C1 ZINC000573024432 1050116468 /nfs/dbraw/zinc/11/64/68/1050116468.db2.gz JCOZDCNQVBJTQN-FQEVSTJZSA-N 1 2 322.383 4.412 20 0 DIADLO Oc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1C(F)(F)F ZINC001209986174 1050117463 /nfs/dbraw/zinc/11/74/63/1050117463.db2.gz RXFHLPHWVJFNJA-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1cccnc1OC1CCCCC1 ZINC001210027193 1050125210 /nfs/dbraw/zinc/12/52/10/1050125210.db2.gz RQXTXDZHAFEVRQ-UHFFFAOYSA-N 1 2 322.412 4.023 20 0 DIADLO COC(=O)C1(c2ccc(Nc3ccc([NH+](C)C)c(C)c3)cc2)CC1 ZINC001210043268 1050127650 /nfs/dbraw/zinc/12/76/50/1050127650.db2.gz LCXWNGDWUCLYKJ-UHFFFAOYSA-N 1 2 324.424 4.009 20 0 DIADLO Brc1nc(Nc2ccc3c[nH+]ccc3c2)cs1 ZINC001210046073 1050128340 /nfs/dbraw/zinc/12/83/40/1050128340.db2.gz RJBRMGUPICSDSE-UHFFFAOYSA-N 1 2 306.188 4.197 20 0 DIADLO Oc1ccccc1-c1cc(Nc2ccc3c[nH+]ccc3c2)on1 ZINC001210046868 1050128446 /nfs/dbraw/zinc/12/84/46/1050128446.db2.gz WDFFMXFFGONTBZ-UHFFFAOYSA-N 1 2 303.321 4.339 20 0 DIADLO Cc1ncncc1[C@H](C)[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000573107497 1050133145 /nfs/dbraw/zinc/13/31/45/1050133145.db2.gz WMABAKUUCAQJFB-NSHDSACASA-N 1 2 322.239 4.432 20 0 DIADLO Cc1cc2[nH]ncc2cc1Nc1cccc2c1OCC[C@H]2[NH+](C)C ZINC001210107199 1050137790 /nfs/dbraw/zinc/13/77/90/1050137790.db2.gz WGEXAYWIQVGFNU-GOSISDBHSA-N 1 2 322.412 4.000 20 0 DIADLO CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1c(F)cccc1Cl ZINC000573167566 1050140166 /nfs/dbraw/zinc/14/01/66/1050140166.db2.gz MZTSXGDBDSBGJS-UHFFFAOYSA-N 1 2 323.843 4.150 20 0 DIADLO CCCn1ccnc1CCC[N@H+](C)Cc1c(F)cccc1Cl ZINC000573167566 1050140169 /nfs/dbraw/zinc/14/01/69/1050140169.db2.gz MZTSXGDBDSBGJS-UHFFFAOYSA-N 1 2 323.843 4.150 20 0 DIADLO CCCn1ccnc1CCC[N@@H+](C)Cc1c(F)cccc1Cl ZINC000573167566 1050140171 /nfs/dbraw/zinc/14/01/71/1050140171.db2.gz MZTSXGDBDSBGJS-UHFFFAOYSA-N 1 2 323.843 4.150 20 0 DIADLO CC(=O)c1c(F)cccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000733867702 1050157639 /nfs/dbraw/zinc/15/76/39/1050157639.db2.gz SOCBAIVMYIYSKL-UHFFFAOYSA-N 1 2 313.376 4.157 20 0 DIADLO Cl/C=C(/Cl)C[NH+]1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000746503334 1050158759 /nfs/dbraw/zinc/15/87/59/1050158759.db2.gz YUVCKOOPAVNZOC-FMIVXFBMSA-N 1 2 310.228 4.061 20 0 DIADLO CC[C@](C)([NH2+]Cc1ccnc(Cl)c1F)c1nc(C)cs1 ZINC000823882532 1050164547 /nfs/dbraw/zinc/16/45/47/1050164547.db2.gz OUIAJIMQFWQYRM-AWEZNQCLSA-N 1 2 313.829 4.054 20 0 DIADLO Cc1ncc(Br)cc1Nc1cccc2cc[nH+]cc21 ZINC001210224153 1050165791 /nfs/dbraw/zinc/16/57/91/1050165791.db2.gz RAGHQZJGMWMLCJ-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO Cc1cc(Br)ncc1Nc1cccc2cc[nH+]cc21 ZINC001210223926 1050165845 /nfs/dbraw/zinc/16/58/45/1050165845.db2.gz JDGCQEKXPUFRKG-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO CCN(Cc1ccc2ccccc2c1)C(=O)C[C@H](C)n1cc[nH+]c1 ZINC000573328782 1050166121 /nfs/dbraw/zinc/16/61/21/1050166121.db2.gz YMGWQZDYPNRZQI-INIZCTEOSA-N 1 2 321.424 4.036 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](c2cccnc2)c2cc(C)cc(C)c2)s1 ZINC000823888018 1050166286 /nfs/dbraw/zinc/16/62/86/1050166286.db2.gz VCEVWVYDMIWDOL-IBGZPJMESA-N 1 2 323.465 4.343 20 0 DIADLO Cc1nccc(Br)c1Nc1cccc2cc[nH+]cc21 ZINC001210224257 1050166189 /nfs/dbraw/zinc/16/61/89/1050166189.db2.gz IASSLEWZALBGNP-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO Cc1ccc(Br)nc1Nc1cccc2cc[nH+]cc21 ZINC001210225052 1050167870 /nfs/dbraw/zinc/16/78/70/1050167870.db2.gz BWRGEPLAJWTNAX-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO COc1cccc2cc(CNc3ccc4c(c3)CCC[N@H+]4C)oc21 ZINC000770540602 1050169939 /nfs/dbraw/zinc/16/99/39/1050169939.db2.gz IZLANUHRXXHDEQ-UHFFFAOYSA-N 1 2 322.408 4.436 20 0 DIADLO COc1cccc2cc(CNc3ccc4c(c3)CCC[N@@H+]4C)oc21 ZINC000770540602 1050169945 /nfs/dbraw/zinc/16/99/45/1050169945.db2.gz IZLANUHRXXHDEQ-UHFFFAOYSA-N 1 2 322.408 4.436 20 0 DIADLO COc1cc(OC)c(OC)cc1Nc1cccc2cc[nH+]cc21 ZINC001210232614 1050170160 /nfs/dbraw/zinc/17/01/60/1050170160.db2.gz RLBCXOBQZNLKCM-UHFFFAOYSA-N 1 2 310.353 4.004 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nnc(-c3ccc(C)cc3)o2)c(C)o1 ZINC000348073464 1050174481 /nfs/dbraw/zinc/17/44/81/1050174481.db2.gz GMXHFYWOOPAUAC-ZDUSSCGKSA-N 1 2 311.385 4.106 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nnc(-c3ccc(C)cc3)o2)c(C)o1 ZINC000348073458 1050174934 /nfs/dbraw/zinc/17/49/34/1050174934.db2.gz GMXHFYWOOPAUAC-CYBMUJFWSA-N 1 2 311.385 4.106 20 0 DIADLO CC1(C)Cc2cc(NCc3ccc(-n4cc[nH+]c4)cc3)ccc2O1 ZINC000770602595 1050180043 /nfs/dbraw/zinc/18/00/43/1050180043.db2.gz UGILJRDRXZXTFO-UHFFFAOYSA-N 1 2 319.408 4.198 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)o1 ZINC000770616680 1050180059 /nfs/dbraw/zinc/18/00/59/1050180059.db2.gz WTUKQOZPYFIXQN-GHMZBOCLSA-N 1 2 314.307 4.293 20 0 DIADLO Cc1cc(C)c(NC(=O)C[N@@H+]2C[C@@H]3CCCC[C@@]32C)c(Cl)c1 ZINC000626104956 1050182156 /nfs/dbraw/zinc/18/21/56/1050182156.db2.gz MHJAZZPXVWJIKD-KSSFIOAISA-N 1 2 320.864 4.160 20 0 DIADLO Cc1cc(C)c(NC(=O)C[N@H+]2C[C@@H]3CCCC[C@@]32C)c(Cl)c1 ZINC000626104956 1050182164 /nfs/dbraw/zinc/18/21/64/1050182164.db2.gz MHJAZZPXVWJIKD-KSSFIOAISA-N 1 2 320.864 4.160 20 0 DIADLO CC(C)c1cnc(C[NH+]2CCC(c3cccc(F)c3F)CC2)o1 ZINC000770688360 1050183143 /nfs/dbraw/zinc/18/31/43/1050183143.db2.gz VVGBHWDULIIAIU-UHFFFAOYSA-N 1 2 320.383 4.456 20 0 DIADLO CCCC(=CC(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C)CCC ZINC000770725308 1050185758 /nfs/dbraw/zinc/18/57/58/1050185758.db2.gz RMXNDZNKCVXXBL-UHFFFAOYSA-N 1 2 318.461 4.192 20 0 DIADLO Cc1[nH+]cc(Nc2ccc3nc(C(F)(F)F)ccc3c2)cc1N ZINC001210289317 1050191630 /nfs/dbraw/zinc/19/16/30/1050191630.db2.gz FZFYKLNKEHUWHQ-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Cc1[nH+]cc(Nc2cc(Cl)ccc2Br)cc1N ZINC001210287977 1050192670 /nfs/dbraw/zinc/19/26/70/1050192670.db2.gz KILDJAICUBAKFX-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO CC(C)(C)/C=C\C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000733927207 1050201189 /nfs/dbraw/zinc/20/11/89/1050201189.db2.gz KDCLMYQUOWRPGU-SREVYHEPSA-N 1 2 303.793 4.067 20 0 DIADLO CC(C)(C)c1nc(=S)n(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)[nH]1 ZINC000733992747 1050211009 /nfs/dbraw/zinc/21/10/09/1050211009.db2.gz UMLRNLHTYZJVTD-KRWDZBQOSA-N 1 2 320.506 4.018 20 0 DIADLO CC(C)(C)c1nc(=S)n(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)[nH]1 ZINC000733992747 1050211017 /nfs/dbraw/zinc/21/10/17/1050211017.db2.gz UMLRNLHTYZJVTD-KRWDZBQOSA-N 1 2 320.506 4.018 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+][C@H]1CCc2ccc(Cl)nc21 ZINC000771174903 1050224989 /nfs/dbraw/zinc/22/49/89/1050224989.db2.gz CMCWHUSFNYGPEI-GWCFXTLKSA-N 1 2 320.795 4.221 20 0 DIADLO CCCCOc1ccccc1C[NH2+]Cc1cc(F)cnc1Cl ZINC000824544413 1050226200 /nfs/dbraw/zinc/22/62/00/1050226200.db2.gz XFCMHDNTAXTTNX-UHFFFAOYSA-N 1 2 322.811 4.343 20 0 DIADLO C[N@H+](CC1CCCC1)Cn1nc(-c2cccs2)oc1=S ZINC000058207634 1050229150 /nfs/dbraw/zinc/22/91/50/1050229150.db2.gz OGPILLKDLUPQDU-UHFFFAOYSA-N 1 2 309.460 4.014 20 0 DIADLO C[N@@H+](CC1CCCC1)Cn1nc(-c2cccs2)oc1=S ZINC000058207634 1050229160 /nfs/dbraw/zinc/22/91/60/1050229160.db2.gz OGPILLKDLUPQDU-UHFFFAOYSA-N 1 2 309.460 4.014 20 0 DIADLO Cn1ccnc1-c1ccc(Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC001210431171 1050244284 /nfs/dbraw/zinc/24/42/84/1050244284.db2.gz MEEYUGSQXCBMPM-UHFFFAOYSA-N 1 2 315.380 4.016 20 0 DIADLO Cn1cc[nH+]c1-c1ccc(-n2ccc3cc(Cl)cc(N)c32)cc1 ZINC001210435665 1050245299 /nfs/dbraw/zinc/24/52/99/1050245299.db2.gz VOYRLVXCPYJXSZ-UHFFFAOYSA-N 1 2 322.799 4.267 20 0 DIADLO CCC[C@H](CCc1ccccc1)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001136957850 1050255055 /nfs/dbraw/zinc/25/50/55/1050255055.db2.gz XHPALMWJNSDVAK-QGZVFWFLSA-N 1 2 321.424 4.094 20 0 DIADLO c1ccc2sc(C[N@@H+]3CCSc4ccccc4C3)nc2c1 ZINC001136957378 1050255492 /nfs/dbraw/zinc/25/54/92/1050255492.db2.gz BVWPLKOVQBAKSD-UHFFFAOYSA-N 1 2 312.463 4.404 20 0 DIADLO c1ccc2sc(C[N@H+]3CCSc4ccccc4C3)nc2c1 ZINC001136957378 1050255496 /nfs/dbraw/zinc/25/54/96/1050255496.db2.gz BVWPLKOVQBAKSD-UHFFFAOYSA-N 1 2 312.463 4.404 20 0 DIADLO Cc1cccn2c(C[N@@H+](C)[C@@H](C)c3ccccc3Cl)cnc12 ZINC001136966292 1050258450 /nfs/dbraw/zinc/25/84/50/1050258450.db2.gz YDVSYDWMEOXHDS-AWEZNQCLSA-N 1 2 313.832 4.489 20 0 DIADLO Cc1cccn2c(C[N@H+](C)[C@@H](C)c3ccccc3Cl)cnc12 ZINC001136966292 1050258462 /nfs/dbraw/zinc/25/84/62/1050258462.db2.gz YDVSYDWMEOXHDS-AWEZNQCLSA-N 1 2 313.832 4.489 20 0 DIADLO Cc1cccn2c(C[N@@H+](C)[C@H](C)c3ccccc3Cl)cnc12 ZINC001136966293 1050259206 /nfs/dbraw/zinc/25/92/06/1050259206.db2.gz YDVSYDWMEOXHDS-CQSZACIVSA-N 1 2 313.832 4.489 20 0 DIADLO Cc1cccn2c(C[N@H+](C)[C@H](C)c3ccccc3Cl)cnc12 ZINC001136966293 1050259219 /nfs/dbraw/zinc/25/92/19/1050259219.db2.gz YDVSYDWMEOXHDS-CQSZACIVSA-N 1 2 313.832 4.489 20 0 DIADLO CC(C)CO[C@H](C)c1noc(C[NH+]2CCC(CC(C)C)CC2)n1 ZINC000760925350 1050265828 /nfs/dbraw/zinc/26/58/28/1050265828.db2.gz KKPUWQXLOGNSLF-OAHLLOKOSA-N 1 2 323.481 4.061 20 0 DIADLO Clc1cncc(C[N@H+](Cc2ccccc2)Cc2cccnc2)c1 ZINC001136994319 1050280393 /nfs/dbraw/zinc/28/03/93/1050280393.db2.gz QABQDKDVEJBLBB-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1cncc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)c1 ZINC001136994319 1050280410 /nfs/dbraw/zinc/28/04/10/1050280410.db2.gz QABQDKDVEJBLBB-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)cc1C ZINC001137007376 1050289182 /nfs/dbraw/zinc/28/91/82/1050289182.db2.gz BJBYKDJPHKFMEX-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)cc1C ZINC001137007376 1050289191 /nfs/dbraw/zinc/28/91/91/1050289191.db2.gz BJBYKDJPHKFMEX-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(F)c(F)cc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001210545984 1050290493 /nfs/dbraw/zinc/29/04/93/1050290493.db2.gz BUARDINKASJCJX-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(Br)ccc(F)c2F)C2(CC2)C1 ZINC001143338177 1050293401 /nfs/dbraw/zinc/29/34/01/1050293401.db2.gz LQECHSSATBSAJO-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(Br)ccc(F)c2F)C2(CC2)C1 ZINC001143338177 1050293413 /nfs/dbraw/zinc/29/34/13/1050293413.db2.gz LQECHSSATBSAJO-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO FC(F)(F)c1c[nH]c(C[N@@H+]2CCC[C@H](c3ccccc3)CC2)n1 ZINC001137017584 1050296077 /nfs/dbraw/zinc/29/60/77/1050296077.db2.gz OLEMSPPDKWXWGK-AWEZNQCLSA-N 1 2 323.362 4.198 20 0 DIADLO FC(F)(F)c1c[nH]c(C[N@H+]2CCC[C@H](c3ccccc3)CC2)n1 ZINC001137017584 1050296090 /nfs/dbraw/zinc/29/60/90/1050296090.db2.gz OLEMSPPDKWXWGK-AWEZNQCLSA-N 1 2 323.362 4.198 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2ccc(Cl)o2)c2cccnc2)cc1 ZINC000592456808 1050308083 /nfs/dbraw/zinc/30/80/83/1050308083.db2.gz IXZOCYJFLPLNOQ-KRWDZBQOSA-N 1 2 316.763 4.346 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)c1Cl ZINC001143365810 1050317213 /nfs/dbraw/zinc/31/72/13/1050317213.db2.gz WNZYPUVWQWDIBZ-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2cccnc2)c1Cl ZINC001143365810 1050317224 /nfs/dbraw/zinc/31/72/24/1050317224.db2.gz WNZYPUVWQWDIBZ-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1ccc(C(F)(F)F)c(C[N@@H+]2CCc3ncc(C)cc3C2)c1 ZINC001143683437 1050336787 /nfs/dbraw/zinc/33/67/87/1050336787.db2.gz HLEXRFTUQFGZNV-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1ccc(C(F)(F)F)c(C[N@H+]2CCc3ncc(C)cc3C2)c1 ZINC001143683437 1050336798 /nfs/dbraw/zinc/33/67/98/1050336798.db2.gz HLEXRFTUQFGZNV-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO C[N@H+](Cc1cccnc1)Cc1ccc(C(F)(F)F)cc1Cl ZINC001143706585 1050341096 /nfs/dbraw/zinc/34/10/96/1050341096.db2.gz DLXBWJUMXZBIJV-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1cccnc1)Cc1ccc(C(F)(F)F)cc1Cl ZINC001143706585 1050341105 /nfs/dbraw/zinc/34/11/05/1050341105.db2.gz DLXBWJUMXZBIJV-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO CCc1cc(OC)ccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001210712836 1050344477 /nfs/dbraw/zinc/34/44/77/1050344477.db2.gz HEUYJDUCGUZCLR-UHFFFAOYSA-N 1 2 307.397 4.246 20 0 DIADLO COC[C@@H]1CCC[N@@H+]1Cc1c(Cl)cc(Cl)cc1Cl ZINC001143797980 1050364168 /nfs/dbraw/zinc/36/41/68/1050364168.db2.gz ZRACOPXAKLHNCM-JTQLQIEISA-N 1 2 308.636 4.258 20 0 DIADLO COC[C@@H]1CCC[N@H+]1Cc1c(Cl)cc(Cl)cc1Cl ZINC001143797980 1050364182 /nfs/dbraw/zinc/36/41/82/1050364182.db2.gz ZRACOPXAKLHNCM-JTQLQIEISA-N 1 2 308.636 4.258 20 0 DIADLO OCC[C@H]1CCC[N@H+](Cc2c(Cl)cc(Cl)cc2Cl)C1 ZINC001143799883 1050364341 /nfs/dbraw/zinc/36/43/41/1050364341.db2.gz CCYSYVGRDFJZIK-SNVBAGLBSA-N 1 2 322.663 4.241 20 0 DIADLO OCC[C@H]1CCC[N@@H+](Cc2c(Cl)cc(Cl)cc2Cl)C1 ZINC001143799883 1050364346 /nfs/dbraw/zinc/36/43/46/1050364346.db2.gz CCYSYVGRDFJZIK-SNVBAGLBSA-N 1 2 322.663 4.241 20 0 DIADLO COc1c(F)c(F)c(Nc2c[nH+]c(C)cc2C)c(F)c1F ZINC001210763300 1050364670 /nfs/dbraw/zinc/36/46/70/1050364670.db2.gz FZFRHWGDCGNMDU-UHFFFAOYSA-N 1 2 300.255 4.007 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCCCC23CC3)c1Br ZINC001143819633 1050367477 /nfs/dbraw/zinc/36/74/77/1050367477.db2.gz HKFJQQCLBCJTHZ-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCCCC23CC3)c1Br ZINC001143819633 1050367486 /nfs/dbraw/zinc/36/74/86/1050367486.db2.gz HKFJQQCLBCJTHZ-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO COc1cc(Nc2cnc(C(F)(F)F)cc2Cl)cc(C)[nH+]1 ZINC001210774203 1050367677 /nfs/dbraw/zinc/36/76/77/1050367677.db2.gz LEWJOLLXVTXEBQ-UHFFFAOYSA-N 1 2 317.698 4.209 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(F)ccc(F)c2Br)C2(CC2)C1 ZINC001143824303 1050368625 /nfs/dbraw/zinc/36/86/25/1050368625.db2.gz ZXEHNJUFPJDKAK-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(F)ccc(F)c2Br)C2(CC2)C1 ZINC001143824303 1050368632 /nfs/dbraw/zinc/36/86/32/1050368632.db2.gz ZXEHNJUFPJDKAK-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCC3(CCC3)C2)c1Br ZINC001143819751 1050369236 /nfs/dbraw/zinc/36/92/36/1050369236.db2.gz MACRBGOTUADVGF-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCC3(CCC3)C2)c1Br ZINC001143819751 1050369249 /nfs/dbraw/zinc/36/92/49/1050369249.db2.gz MACRBGOTUADVGF-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO COc1cc(Nc2cc3oc(C)nc3cc2Cl)cc(C)[nH+]1 ZINC001210781174 1050369465 /nfs/dbraw/zinc/36/94/65/1050369465.db2.gz NSSUKDJAZJUEPK-UHFFFAOYSA-N 1 2 303.749 4.245 20 0 DIADLO CC[C@@]12C[C@@H](CO1)[N@H+](Cc1ccc(C(F)(F)F)c(Cl)c1)C2 ZINC001143810310 1050369834 /nfs/dbraw/zinc/36/98/34/1050369834.db2.gz QWTVXNJWPBBIIH-FZMZJTMJSA-N 1 2 319.754 4.112 20 0 DIADLO CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1ccc(C(F)(F)F)c(Cl)c1)C2 ZINC001143810310 1050369840 /nfs/dbraw/zinc/36/98/40/1050369840.db2.gz QWTVXNJWPBBIIH-FZMZJTMJSA-N 1 2 319.754 4.112 20 0 DIADLO COc1cc(Nc2cccc(Oc3cccnc3)c2)cc(C)[nH+]1 ZINC001210781140 1050370522 /nfs/dbraw/zinc/37/05/22/1050370522.db2.gz YCMXFPGKGSCHEU-UHFFFAOYSA-N 1 2 307.353 4.330 20 0 DIADLO CCOc1cccc([C@H](C)[NH2+]Cc2occc2Br)c1 ZINC000735322124 1050371227 /nfs/dbraw/zinc/37/12/27/1050371227.db2.gz FJTMMXPUHRVLOL-NSHDSACASA-N 1 2 324.218 4.292 20 0 DIADLO CC(C)[C@@H]1C[N@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)CCO1 ZINC001143812773 1050373757 /nfs/dbraw/zinc/37/37/57/1050373757.db2.gz ZCDKOWQFAXFQOY-AWEZNQCLSA-N 1 2 321.770 4.216 20 0 DIADLO CC(C)[C@@H]1C[N@@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)CCO1 ZINC001143812773 1050373770 /nfs/dbraw/zinc/37/37/70/1050373770.db2.gz ZCDKOWQFAXFQOY-AWEZNQCLSA-N 1 2 321.770 4.216 20 0 DIADLO CCOc1c(Cl)ccc(C[N@H+](C)Cc2cccnc2C)c1F ZINC001143837711 1050376934 /nfs/dbraw/zinc/37/69/34/1050376934.db2.gz ZUOMPSLNPOWGTP-UHFFFAOYSA-N 1 2 322.811 4.213 20 0 DIADLO CCOc1c(Cl)ccc(C[N@@H+](C)Cc2cccnc2C)c1F ZINC001143837711 1050376946 /nfs/dbraw/zinc/37/69/46/1050376946.db2.gz ZUOMPSLNPOWGTP-UHFFFAOYSA-N 1 2 322.811 4.213 20 0 DIADLO Oc1cc(Nc2ccc(-n3cc[nH+]c3)cc2)cc(C(F)(F)F)c1 ZINC001210825582 1050381580 /nfs/dbraw/zinc/38/15/80/1050381580.db2.gz KYNZPPMLYXKUJK-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1Cl)c1ccnn1CC1CCC1 ZINC000924859349 1050382427 /nfs/dbraw/zinc/38/24/27/1050382427.db2.gz VDQMTGVSNGTCHK-LBPRGKRZSA-N 1 2 321.827 4.327 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cc(O)cc(C(F)(F)F)c3)ccc21 ZINC001210827784 1050384151 /nfs/dbraw/zinc/38/41/51/1050384151.db2.gz IMNGDTXSJKSRNL-UHFFFAOYSA-N 1 2 307.275 4.041 20 0 DIADLO CC(C)O[C@@H]1CC[N@H+](Cc2c(F)ccc(Cl)c2Cl)C1 ZINC001143867066 1050385780 /nfs/dbraw/zinc/38/57/80/1050385780.db2.gz WIMIDIFSVVHERC-SNVBAGLBSA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@@H]1CC[N@@H+](Cc2c(F)ccc(Cl)c2Cl)C1 ZINC001143867066 1050385783 /nfs/dbraw/zinc/38/57/83/1050385783.db2.gz WIMIDIFSVVHERC-SNVBAGLBSA-N 1 2 306.208 4.132 20 0 DIADLO CC[C@]1(C)Oc2ccc(NCc3c[nH+]c4ccc(C)cn34)cc2O1 ZINC000785553758 1050388554 /nfs/dbraw/zinc/38/85/54/1050388554.db2.gz INHFRCXZKWFTDC-LJQANCHMSA-N 1 2 323.396 4.152 20 0 DIADLO Fc1cc(Nc2ccc(N3CCCC3)[nH+]c2)cc(F)c1Cl ZINC001210842073 1050388957 /nfs/dbraw/zinc/38/89/57/1050388957.db2.gz FXUUBTBEVDDIKA-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO Oc1cccc(Nc2ccc[nH+]c2N2CCCCC2)c1Cl ZINC001210844420 1050390004 /nfs/dbraw/zinc/39/00/04/1050390004.db2.gz GIRHTRXKRQISJA-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO CCCCCOc1ccc(OC(=O)C[C@H](C)n2cc[nH+]c2)cc1 ZINC000844279750 1050392753 /nfs/dbraw/zinc/39/27/53/1050392753.db2.gz VAOKZPZGNVTVQN-HNNXBMFYSA-N 1 2 316.401 4.009 20 0 DIADLO c1c[nH+]c(Nc2cccc(OC3CC3)c2)c(N2CCCCC2)c1 ZINC001210860966 1050395629 /nfs/dbraw/zinc/39/56/29/1050395629.db2.gz JXAJAZMSERVRLG-UHFFFAOYSA-N 1 2 309.413 4.357 20 0 DIADLO CC(C)c1cnc(CSCc2ccc(-n3cc[nH+]c3)cc2)o1 ZINC000790563797 1050396052 /nfs/dbraw/zinc/39/60/52/1050396052.db2.gz HCGHOOIAJPZAKJ-UHFFFAOYSA-N 1 2 313.426 4.417 20 0 DIADLO CCOc1ccc(F)c(C[N@H+](CC)Cc2ccccc2)c1F ZINC001143929413 1050401322 /nfs/dbraw/zinc/40/13/22/1050401322.db2.gz KDUNFYWKOSLZIF-UHFFFAOYSA-N 1 2 305.368 4.386 20 0 DIADLO CCOc1ccc(F)c(C[N@@H+](CC)Cc2ccccc2)c1F ZINC001143929413 1050401332 /nfs/dbraw/zinc/40/13/32/1050401332.db2.gz KDUNFYWKOSLZIF-UHFFFAOYSA-N 1 2 305.368 4.386 20 0 DIADLO Cc1nc2c(cc(Nc3[nH+]cc(C)cc3N)cc2F)n1C(C)C ZINC001210921295 1050413774 /nfs/dbraw/zinc/41/37/74/1050413774.db2.gz ZYDCZBNKPYQAIL-UHFFFAOYSA-N 1 2 313.380 4.094 20 0 DIADLO Cc1cn2c(cccc2Nc2cc(Cl)c(O)c(Cl)c2)[nH+]1 ZINC001210923672 1050416027 /nfs/dbraw/zinc/41/60/27/1050416027.db2.gz YDRKHWYXRWOAJV-UHFFFAOYSA-N 1 2 308.168 4.399 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)o1 ZINC000735674760 1050423167 /nfs/dbraw/zinc/42/31/67/1050423167.db2.gz UMBNKHSAIWGJCY-KSSFIOAISA-N 1 2 316.470 4.477 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)o1 ZINC000735674760 1050423181 /nfs/dbraw/zinc/42/31/81/1050423181.db2.gz UMBNKHSAIWGJCY-KSSFIOAISA-N 1 2 316.470 4.477 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[N@H+](C)Cc1cnoc1C ZINC000844443804 1050429165 /nfs/dbraw/zinc/42/91/65/1050429165.db2.gz MSBPMGCJGMBGJX-HNNXBMFYSA-N 1 2 320.820 4.154 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[N@@H+](C)Cc1cnoc1C ZINC000844443804 1050429178 /nfs/dbraw/zinc/42/91/78/1050429178.db2.gz MSBPMGCJGMBGJX-HNNXBMFYSA-N 1 2 320.820 4.154 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1cccnc1C(=O)OC(C)(C)C ZINC001210959507 1050432967 /nfs/dbraw/zinc/43/29/67/1050432967.db2.gz FEAFLWOYYKYEDR-UHFFFAOYSA-N 1 2 313.401 4.046 20 0 DIADLO CC[C@H](OC(=O)C[C@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC000844462398 1050433352 /nfs/dbraw/zinc/43/33/52/1050433352.db2.gz NGFYZEJZUJVYJZ-WFASDCNBSA-N 1 2 306.793 4.182 20 0 DIADLO Nc1cc(F)cc2c1ccn2-c1ccccc1[NH+]1CCCCC1 ZINC001210963315 1050434454 /nfs/dbraw/zinc/43/44/54/1050434454.db2.gz GLNHWPNEQKDCGC-UHFFFAOYSA-N 1 2 309.388 4.342 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)OC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000844469225 1050435058 /nfs/dbraw/zinc/43/50/58/1050435058.db2.gz DXGVREGWLXKUDD-YPMHNXCESA-N 1 2 321.446 4.027 20 0 DIADLO CC(C)(C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CC1 ZINC000574311038 1050438773 /nfs/dbraw/zinc/43/87/73/1050438773.db2.gz NYJQCMFQTLLPLP-UHFFFAOYSA-N 1 2 323.440 4.261 20 0 DIADLO CC[C@H](OC(=O)C[C@@H](C)n1cc[nH+]c1)c1cccc(Cl)c1F ZINC000844489973 1050439106 /nfs/dbraw/zinc/43/91/06/1050439106.db2.gz KXFOWPGDVRUOKR-RISCZKNCSA-N 1 2 324.783 4.321 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)OC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000844488893 1050439560 /nfs/dbraw/zinc/43/95/60/1050439560.db2.gz DGMVECCJDYKBLF-TZMCWYRMSA-N 1 2 312.369 4.193 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2CCC[C@H]2c2cccnc2)cc1F ZINC001144020184 1050442856 /nfs/dbraw/zinc/44/28/56/1050442856.db2.gz AWYBHIMRTVNWSC-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2CCC[C@H]2c2cccnc2)cc1F ZINC001144020184 1050442861 /nfs/dbraw/zinc/44/28/61/1050442861.db2.gz AWYBHIMRTVNWSC-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO COC(=O)c1ccc(-c2cccc(Nc3ccc(C)c[nH+]3)c2)o1 ZINC001211010346 1050444813 /nfs/dbraw/zinc/44/48/13/1050444813.db2.gz HGAOKZGDEYXIBA-UHFFFAOYSA-N 1 2 308.337 4.180 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@H+](Cc2csc(-c3cccs3)n2)C1 ZINC000761044555 1050477893 /nfs/dbraw/zinc/47/78/93/1050477893.db2.gz AOESGPSTUNQPRZ-SECBINFHSA-N 1 2 318.389 4.256 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@@H+](Cc2csc(-c3cccs3)n2)C1 ZINC000761044555 1050477898 /nfs/dbraw/zinc/47/78/98/1050477898.db2.gz AOESGPSTUNQPRZ-SECBINFHSA-N 1 2 318.389 4.256 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)cc1Cl ZINC001144130102 1050478350 /nfs/dbraw/zinc/47/83/50/1050478350.db2.gz XGTSLEXDPIXMOD-CQSZACIVSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)cc1Cl ZINC001144130102 1050478357 /nfs/dbraw/zinc/47/83/57/1050478357.db2.gz XGTSLEXDPIXMOD-CQSZACIVSA-N 1 2 323.770 4.272 20 0 DIADLO CSc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1F ZINC001211109758 1050478474 /nfs/dbraw/zinc/47/84/74/1050478474.db2.gz ANSHJIXZWNSWDU-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO CN(c1ccc(Nc2cccnc2F)c[nH+]1)C1CCCCC1 ZINC001212613475 1050487746 /nfs/dbraw/zinc/48/77/46/1050487746.db2.gz VYDMWINRPBYDQB-UHFFFAOYSA-N 1 2 300.381 4.128 20 0 DIADLO Nc1ccc(C(F)(F)F)cc1Nc1ccccc1-n1cc[nH+]c1 ZINC001211149350 1050498673 /nfs/dbraw/zinc/49/86/73/1050498673.db2.gz JKLUXXARLGRKHS-UHFFFAOYSA-N 1 2 318.302 4.217 20 0 DIADLO Brc1ccoc1CNc1ccc([NH+]2CCCC2)cc1 ZINC000226635372 1050500883 /nfs/dbraw/zinc/50/08/83/1050500883.db2.gz LUNKJHUEYCGNJK-UHFFFAOYSA-N 1 2 321.218 4.254 20 0 DIADLO CC(C)(C)[C@H]1CCC[N@H+](Cn2ncn(C(C)(C)C)c2=S)CC1 ZINC000738239378 1050528678 /nfs/dbraw/zinc/52/86/78/1050528678.db2.gz KKQRVOFPBLSVGI-AWEZNQCLSA-N 1 2 324.538 4.275 20 0 DIADLO CC(C)(C)[C@H]1CCC[N@@H+](Cn2ncn(C(C)(C)C)c2=S)CC1 ZINC000738239378 1050528691 /nfs/dbraw/zinc/52/86/91/1050528691.db2.gz KKQRVOFPBLSVGI-AWEZNQCLSA-N 1 2 324.538 4.275 20 0 DIADLO C[C@@H]1CSCC[N@@H+]1Cn1c(=S)oc2cc(Cl)ccc21 ZINC000738275896 1050528855 /nfs/dbraw/zinc/52/88/55/1050528855.db2.gz CLARTCFDUYILDG-SECBINFHSA-N 1 2 314.863 4.012 20 0 DIADLO C[C@@H]1CSCC[N@H+]1Cn1c(=S)oc2cc(Cl)ccc21 ZINC000738275896 1050528864 /nfs/dbraw/zinc/52/88/64/1050528864.db2.gz CLARTCFDUYILDG-SECBINFHSA-N 1 2 314.863 4.012 20 0 DIADLO COCCOc1cc(N[C@H](c2ccc(F)cc2)C(C)C)cc[nH+]1 ZINC001170066279 1050537764 /nfs/dbraw/zinc/53/77/64/1050537764.db2.gz JWRZVUAKEMYIIV-SFHVURJKSA-N 1 2 318.392 4.055 20 0 DIADLO COc1cccc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)n1 ZINC001211295450 1050542045 /nfs/dbraw/zinc/54/20/45/1050542045.db2.gz FTPIVCFDWCSFLY-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc(F)c(O)cc1F ZINC001211338315 1050552340 /nfs/dbraw/zinc/55/23/40/1050552340.db2.gz CIYOBOGFGXYWNE-UHFFFAOYSA-N 1 2 304.340 4.031 20 0 DIADLO Cc1cc(C)c([C@H](C)OC(=O)C[C@H](C)n2cc[nH+]c2)c(C)c1 ZINC000845283357 1050559652 /nfs/dbraw/zinc/55/96/52/1050559652.db2.gz VULZVKFBXGIQLX-HOTGVXAUSA-N 1 2 300.402 4.064 20 0 DIADLO Fc1ccc(Br)cc1C[N@H+](C/C=C\Cl)C1CC1 ZINC000746651209 1050567034 /nfs/dbraw/zinc/56/70/34/1050567034.db2.gz PWUQZGYLRQLZRT-BHQIHCQQSA-N 1 2 318.617 4.305 20 0 DIADLO Fc1ccc(Br)cc1C[N@@H+](C/C=C\Cl)C1CC1 ZINC000746651209 1050567042 /nfs/dbraw/zinc/56/70/42/1050567042.db2.gz PWUQZGYLRQLZRT-BHQIHCQQSA-N 1 2 318.617 4.305 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)s2)nc1 ZINC001144428695 1050576045 /nfs/dbraw/zinc/57/60/45/1050576045.db2.gz YWTQMEYCMHPOLM-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)nc1 ZINC001144428695 1050576062 /nfs/dbraw/zinc/57/60/62/1050576062.db2.gz YWTQMEYCMHPOLM-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO CC(=O)c1ncccc1Nc1ccc(N(C)C2CCCCC2)[nH+]c1 ZINC001212614268 1050581708 /nfs/dbraw/zinc/58/17/08/1050581708.db2.gz KJCKMZVAZQAEMJ-UHFFFAOYSA-N 1 2 324.428 4.192 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3snnc3-c3ccccc3)cc2)[nH]1 ZINC001213086420 1050583471 /nfs/dbraw/zinc/58/34/71/1050583471.db2.gz PWXLTJZHSIWJOF-UHFFFAOYSA-N 1 2 319.393 4.339 20 0 DIADLO Fc1cc(F)c(F)c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1F ZINC001213088848 1050583497 /nfs/dbraw/zinc/58/34/97/1050583497.db2.gz HJHSBQDHSNZLKG-UHFFFAOYSA-N 1 2 307.250 4.377 20 0 DIADLO Cc1cc2c(cccc2Nc2ccc(-c3[nH]cc[nH+]3)cc2)nn1 ZINC001213088832 1050583735 /nfs/dbraw/zinc/58/37/35/1050583735.db2.gz GMORAYYPVBCCAP-UHFFFAOYSA-N 1 2 301.353 4.072 20 0 DIADLO COc1cc2cccnc2c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213088854 1050583769 /nfs/dbraw/zinc/58/37/69/1050583769.db2.gz HRQYRXUCJINGJF-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO c1cnn(Cc2cccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)c2)c1 ZINC001213088835 1050584042 /nfs/dbraw/zinc/58/40/42/1050584042.db2.gz GOOIXBFUMISBAC-UHFFFAOYSA-N 1 2 315.380 4.065 20 0 DIADLO Nc1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc(C(F)(F)F)c1 ZINC001213088939 1050584946 /nfs/dbraw/zinc/58/49/46/1050584946.db2.gz LQFDGSNRZWVIJF-UHFFFAOYSA-N 1 2 318.302 4.421 20 0 DIADLO O=C(c1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1)C1CC1 ZINC001213091731 1050585212 /nfs/dbraw/zinc/58/52/12/1050585212.db2.gz ILXXUOXHPZFWKU-UHFFFAOYSA-N 1 2 303.365 4.413 20 0 DIADLO COc1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(C(C)=O)c1 ZINC001213091955 1050585939 /nfs/dbraw/zinc/58/59/39/1050585939.db2.gz TYKDCUOOCOGJLR-UHFFFAOYSA-N 1 2 307.353 4.032 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3ccccc3-c3cnco3)cc2)[nH]1 ZINC001213089900 1050586052 /nfs/dbraw/zinc/58/60/52/1050586052.db2.gz KDZURGDBBMLHFX-UHFFFAOYSA-N 1 2 302.337 4.475 20 0 DIADLO COC(=O)/C=C/c1cccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213091925 1050586667 /nfs/dbraw/zinc/58/66/67/1050586667.db2.gz RVZGVVGPUZAQOS-BJMVGYQFSA-N 1 2 319.364 4.007 20 0 DIADLO O=C1CCCc2cc(Nc3ccccc3-n3cc[nH+]c3)ccc21 ZINC001213104166 1050589752 /nfs/dbraw/zinc/58/97/52/1050589752.db2.gz WJLZEQAKOSGUBN-UHFFFAOYSA-N 1 2 303.365 4.135 20 0 DIADLO CCOc1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)c(OC)c1 ZINC001213117371 1050594458 /nfs/dbraw/zinc/59/44/58/1050594458.db2.gz WYPMMHDPGXRHII-UHFFFAOYSA-N 1 2 317.776 4.139 20 0 DIADLO Cc1ncc(Nc2ccc(N(C)C3CCCCC3)[nH+]c2)c(C)n1 ZINC001212614444 1050594940 /nfs/dbraw/zinc/59/49/40/1050594940.db2.gz NVTOCONCWOKQMU-UHFFFAOYSA-N 1 2 311.433 4.001 20 0 DIADLO C[C@@H](CC(=O)O[C@H]1CC[C@H](c2ccccc2)CC1)n1cc[nH+]c1 ZINC000845569262 1050595355 /nfs/dbraw/zinc/59/53/55/1050595355.db2.gz KCOORENXPDGOLC-SZMVWBNQSA-N 1 2 312.413 4.104 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2cc(C(C)=O)no2)o1 ZINC000574886959 1050602111 /nfs/dbraw/zinc/60/21/11/1050602111.db2.gz AXNDBEBRCDGMTJ-YVEFUNNKSA-N 1 2 316.401 4.006 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2cc(C(C)=O)no2)o1 ZINC000574886959 1050602121 /nfs/dbraw/zinc/60/21/21/1050602121.db2.gz AXNDBEBRCDGMTJ-YVEFUNNKSA-N 1 2 316.401 4.006 20 0 DIADLO Oc1cc(F)c(C[NH+]2CCC(c3ccccc3)CC2)c(F)c1 ZINC001144544829 1050609311 /nfs/dbraw/zinc/60/93/11/1050609311.db2.gz IXXAPIMNUMLDSM-UHFFFAOYSA-N 1 2 303.352 4.050 20 0 DIADLO CC(C)n1ccn(C[N@H+](Cc2cccc(F)c2)C2CC2)c1=S ZINC000746707566 1050617631 /nfs/dbraw/zinc/61/76/31/1050617631.db2.gz IWSIWQNEKSSFRJ-UHFFFAOYSA-N 1 2 319.449 4.361 20 0 DIADLO CC(C)n1ccn(C[N@@H+](Cc2cccc(F)c2)C2CC2)c1=S ZINC000746707566 1050617634 /nfs/dbraw/zinc/61/76/34/1050617634.db2.gz IWSIWQNEKSSFRJ-UHFFFAOYSA-N 1 2 319.449 4.361 20 0 DIADLO Oc1cccnc1C[N@H+](Cc1ccccc1)Cc1ccccc1F ZINC000575026300 1050626824 /nfs/dbraw/zinc/62/68/24/1050626824.db2.gz OIXIVDVTJDYLLW-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO Oc1cccnc1C[N@@H+](Cc1ccccc1)Cc1ccccc1F ZINC000575026300 1050626832 /nfs/dbraw/zinc/62/68/32/1050626832.db2.gz OIXIVDVTJDYLLW-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO Clc1cccc([C@H]2CCC[N@@H+]2Cc2ncn3ccccc23)c1 ZINC001144626228 1050629926 /nfs/dbraw/zinc/62/99/26/1050629926.db2.gz ZYZBDBMZSCALPA-QGZVFWFLSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1cccc([C@H]2CCC[N@H+]2Cc2ncn3ccccc23)c1 ZINC001144626228 1050629934 /nfs/dbraw/zinc/62/99/34/1050629934.db2.gz ZYZBDBMZSCALPA-QGZVFWFLSA-N 1 2 311.816 4.325 20 0 DIADLO c1[nH+]c(CN2CCC(Sc3ccccc3)CC2)c2ccccn12 ZINC001144625364 1050630857 /nfs/dbraw/zinc/63/08/57/1050630857.db2.gz KPYKBEDLRHRVCN-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO COc1cccc(C(F)(F)F)c1Nc1cccn2cc[nH+]c12 ZINC001213341239 1050633848 /nfs/dbraw/zinc/63/38/48/1050633848.db2.gz OZQHWDOYNSTKME-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO CC[C@@H](OC(=O)CCCn1cc[nH+]c1)c1cccc(Cl)c1F ZINC000787959920 1050634341 /nfs/dbraw/zinc/63/43/41/1050634341.db2.gz KKBFSAUUFIQBMD-CQSZACIVSA-N 1 2 324.783 4.150 20 0 DIADLO CCC[C@H]1CC[C@H](C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001144636755 1050637763 /nfs/dbraw/zinc/63/77/63/1050637763.db2.gz PTUZGRIUJIONEK-WKILWMFISA-N 1 2 311.429 4.417 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1F ZINC001144647170 1050638651 /nfs/dbraw/zinc/63/86/51/1050638651.db2.gz BFSSJJXBKYPSDR-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1F ZINC001144647170 1050638662 /nfs/dbraw/zinc/63/86/62/1050638662.db2.gz BFSSJJXBKYPSDR-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO CC(C)[N@H+](Cc1noc2c1CCCC2)Cc1cccc(F)c1 ZINC000595564025 1050639000 /nfs/dbraw/zinc/63/90/00/1050639000.db2.gz DJDILENIAABCCM-UHFFFAOYSA-N 1 2 302.393 4.103 20 0 DIADLO CC(C)[N@@H+](Cc1noc2c1CCCC2)Cc1cccc(F)c1 ZINC000595564025 1050639010 /nfs/dbraw/zinc/63/90/10/1050639010.db2.gz DJDILENIAABCCM-UHFFFAOYSA-N 1 2 302.393 4.103 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(F)c(O)cc2F)c1 ZINC001144646641 1050639470 /nfs/dbraw/zinc/63/94/70/1050639470.db2.gz FLILXLKLLSVRNZ-KRWDZBQOSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc(F)c(O)cc2F)c1 ZINC001144646641 1050639479 /nfs/dbraw/zinc/63/94/79/1050639479.db2.gz FLILXLKLLSVRNZ-KRWDZBQOSA-N 1 2 303.352 4.316 20 0 DIADLO Clc1ccc(SC2CCN(c3cccc[nH+]3)CC2)cc1 ZINC000575102061 1050644578 /nfs/dbraw/zinc/64/45/78/1050644578.db2.gz NCHYADHPSSSSHY-UHFFFAOYSA-N 1 2 304.846 4.496 20 0 DIADLO Cc1cc(Br)cnc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213488668 1050669344 /nfs/dbraw/zinc/66/93/44/1050669344.db2.gz BAHPCQUPUQWJES-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1ccnc(Br)c1Nc1cc(C2CC2)c[nH+]c1C ZINC001213491348 1050669451 /nfs/dbraw/zinc/66/94/51/1050669451.db2.gz IBOQHTXFWRZGKL-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ncccc1OC(F)(F)F ZINC001213495198 1050670097 /nfs/dbraw/zinc/67/00/97/1050670097.db2.gz VQNIJYATFZZJCK-UHFFFAOYSA-N 1 2 309.291 4.305 20 0 DIADLO Cc1cc(Br)ncc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213491819 1050670237 /nfs/dbraw/zinc/67/02/37/1050670237.db2.gz RJLUWZTWYKLAHC-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccnn1Cc1ccc(F)cc1 ZINC001213491768 1050670253 /nfs/dbraw/zinc/67/02/53/1050670253.db2.gz PGFVJUFQRMTURI-UHFFFAOYSA-N 1 2 322.387 4.395 20 0 DIADLO Cc1ncc(C2CC2)cc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001213492185 1050670273 /nfs/dbraw/zinc/67/02/73/1050670273.db2.gz ZCBVUTNNYDRHBF-UHFFFAOYSA-N 1 2 308.429 4.396 20 0 DIADLO Cc1nc(Cl)c(Nc2cc(C3CC3)c[nH+]c2C)c(Cl)n1 ZINC001213491863 1050670765 /nfs/dbraw/zinc/67/07/65/1050670765.db2.gz SJLCZGMFRGYTPH-UHFFFAOYSA-N 1 2 309.200 4.416 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnccc1Br ZINC001213495111 1050670782 /nfs/dbraw/zinc/67/07/82/1050670782.db2.gz QUGGVLUYGGQHLB-UHFFFAOYSA-N 1 2 304.191 4.169 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cc(Br)cnc1F ZINC001213491544 1050670804 /nfs/dbraw/zinc/67/08/04/1050670804.db2.gz NMVNMMKFFVYFHQ-UHFFFAOYSA-N 1 2 322.181 4.308 20 0 DIADLO COc1ccccc1-n1nccc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213497275 1050671821 /nfs/dbraw/zinc/67/18/21/1050671821.db2.gz LNTKDXYCJBXNFF-UHFFFAOYSA-N 1 2 320.396 4.205 20 0 DIADLO COc1cc(OC)c(Nc2cc(C3CC3)c[nH+]c2C)cc1F ZINC001213499052 1050671934 /nfs/dbraw/zinc/67/19/34/1050671934.db2.gz AKIKSDWXASHAEW-UHFFFAOYSA-N 1 2 302.349 4.167 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1nc(F)c(F)c(Cl)c1F ZINC001213497051 1050672170 /nfs/dbraw/zinc/67/21/70/1050672170.db2.gz GDSSSUSIYJVEBD-UHFFFAOYSA-N 1 2 313.710 4.477 20 0 DIADLO Cc1cc(C)c(Nc2cc(Cl)ncc2Br)c[nH+]1 ZINC001213505957 1050677326 /nfs/dbraw/zinc/67/73/26/1050677326.db2.gz VTTKZNHBUCQLDK-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1cc(C)c(Nc2ncc(Cl)cc2Br)c[nH+]1 ZINC001213503762 1050674613 /nfs/dbraw/zinc/67/46/13/1050674613.db2.gz WRIYWAFKZSJNFG-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(F)c2c1OCCC2=O ZINC001213503636 1050675279 /nfs/dbraw/zinc/67/52/79/1050675279.db2.gz QAWVYYNQDHSBKK-UHFFFAOYSA-N 1 2 312.344 4.115 20 0 DIADLO Cc1cc(N)c(Nc2c[nH+]c(C)cc2C)c(Br)c1 ZINC001213515730 1050676219 /nfs/dbraw/zinc/67/62/19/1050676219.db2.gz HLOHBJTWAHJXKG-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO Cc1cc(C)c(Nc2nc(Cl)c(Cl)nc2Cl)c[nH+]1 ZINC001213510540 1050676526 /nfs/dbraw/zinc/67/65/26/1050676526.db2.gz DWVPEIZOZLBUTQ-UHFFFAOYSA-N 1 2 303.580 4.192 20 0 DIADLO Cc1cc(C)c(Nc2nc(Cl)ccc2Br)c[nH+]1 ZINC001213508336 1050676648 /nfs/dbraw/zinc/67/66/48/1050676648.db2.gz QIEODYYZPNEWAI-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO CC(=O)Nc1ccc(Nc2c[nH+]c(C)cc2C)c(C(F)(F)F)c1 ZINC001213518469 1050677339 /nfs/dbraw/zinc/67/73/39/1050677339.db2.gz PYUBGWAFNRYZPT-UHFFFAOYSA-N 1 2 323.318 4.419 20 0 DIADLO Cc1cc(C)c(Nc2ccc3nnc(-c4ccccc4)n3c2)c[nH+]1 ZINC001213507783 1050677406 /nfs/dbraw/zinc/67/74/06/1050677406.db2.gz FQHIMEBLWAZMNT-UHFFFAOYSA-N 1 2 315.380 4.152 20 0 DIADLO Cc1cc(C)c(Nc2c(F)cccc2OC[C@H]2CCCO2)c[nH+]1 ZINC001213521030 1050680161 /nfs/dbraw/zinc/68/01/61/1050680161.db2.gz OZUYGEYZIUXXFF-CQSZACIVSA-N 1 2 316.376 4.139 20 0 DIADLO COc1ccc(Cn2ncc(C)c2Nc2c[nH+]cc(C)c2C)cc1 ZINC001213527430 1050680217 /nfs/dbraw/zinc/68/02/17/1050680217.db2.gz KRHJQXWNDMHDEL-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1c[nH+]cc(Nc2cn3cc(C(F)(F)F)ccc3n2)c1C ZINC001213527536 1050680269 /nfs/dbraw/zinc/68/02/69/1050680269.db2.gz RGPWLBWCEGMIGJ-UHFFFAOYSA-N 1 2 306.291 4.109 20 0 DIADLO Cc1c[nH+]cc(Nc2c(F)cccc2OC[C@H]2CCCO2)c1C ZINC001213533945 1050681373 /nfs/dbraw/zinc/68/13/73/1050681373.db2.gz DDTPARVRDQIDLL-CQSZACIVSA-N 1 2 316.376 4.139 20 0 DIADLO CC(=O)Nc1ccc(Nc2c[nH+]cc(C)c2C)c(C(F)(F)F)c1 ZINC001213534169 1050682058 /nfs/dbraw/zinc/68/20/58/1050682058.db2.gz PSRLHQNPDLYALI-UHFFFAOYSA-N 1 2 323.318 4.419 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc3cnn([C@H]4CCCCO4)c3c2)c1C ZINC001213530878 1050682685 /nfs/dbraw/zinc/68/26/85/1050682685.db2.gz PICVWXKQESBYGF-LJQANCHMSA-N 1 2 322.412 4.491 20 0 DIADLO C[N@H+](Cc1cc(Cl)cc(Cl)c1)Cc1cnc(Cl)cn1 ZINC000788479095 1050688365 /nfs/dbraw/zinc/68/83/65/1050688365.db2.gz NVKDOTDYZBCNJB-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO C[N@@H+](Cc1cc(Cl)cc(Cl)c1)Cc1cnc(Cl)cn1 ZINC000788479095 1050688372 /nfs/dbraw/zinc/68/83/72/1050688372.db2.gz NVKDOTDYZBCNJB-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+]1CCC[C@H]1c1ccccc1F ZINC001144754661 1050700205 /nfs/dbraw/zinc/70/02/05/1050700205.db2.gz KSVNDCMBDIDLHD-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+]1CCC[C@H]1c1ccccc1F ZINC001144754661 1050700213 /nfs/dbraw/zinc/70/02/13/1050700213.db2.gz KSVNDCMBDIDLHD-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+]1CCC[C@@H]1c1ccccc1F ZINC001144754662 1050702326 /nfs/dbraw/zinc/70/23/26/1050702326.db2.gz KSVNDCMBDIDLHD-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+]1CCC[C@@H]1c1ccccc1F ZINC001144754662 1050702338 /nfs/dbraw/zinc/70/23/38/1050702338.db2.gz KSVNDCMBDIDLHD-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H](Cc1ccccc1)c1ccccc1 ZINC000180001977 1050712046 /nfs/dbraw/zinc/71/20/46/1050712046.db2.gz UMBIJTGCPPLEGY-YWZLYKJASA-N 1 2 305.425 4.353 20 0 DIADLO CCCN(CCC)C(=O)c1cccc(Nc2cc(C)cc[nH+]2)c1 ZINC001213694895 1050720640 /nfs/dbraw/zinc/72/06/40/1050720640.db2.gz VRZSRVRDMYBSIC-UHFFFAOYSA-N 1 2 311.429 4.396 20 0 DIADLO C[NH+](C)c1ccc(N[C@H]2COCc3cccc(Cl)c32)cc1 ZINC000788717011 1050734162 /nfs/dbraw/zinc/73/41/62/1050734162.db2.gz BCHGTQKNLJUFPO-INIZCTEOSA-N 1 2 302.805 4.089 20 0 DIADLO Fc1cc(N2CCCCC2)ccc1Nc1cccn2cc[nH+]c12 ZINC001213837897 1050759416 /nfs/dbraw/zinc/75/94/16/1050759416.db2.gz UHFOUNAQYRTSPF-UHFFFAOYSA-N 1 2 310.376 4.207 20 0 DIADLO Cc1cn2cccc(Nc3ccc(N4CCCC4)cc3F)c2[nH+]1 ZINC001213846475 1050762043 /nfs/dbraw/zinc/76/20/43/1050762043.db2.gz UYOKSUUXICEFDJ-UHFFFAOYSA-N 1 2 310.376 4.126 20 0 DIADLO Fc1cc(N2CCCC2)ccc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001213850101 1050764635 /nfs/dbraw/zinc/76/46/35/1050764635.db2.gz YILMCEZPMWPFPP-UHFFFAOYSA-N 1 2 322.387 4.355 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cnsn1)c1ccc(C(F)(F)F)cc1 ZINC000846846173 1050770790 /nfs/dbraw/zinc/77/07/90/1050770790.db2.gz DPCXHPNWRZILLH-CYBMUJFWSA-N 1 2 315.364 4.044 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cnsn1)c1cccc(C(F)(F)F)c1 ZINC000846845521 1050770812 /nfs/dbraw/zinc/77/08/12/1050770812.db2.gz XVHJOFXIMFPYDB-ZDUSSCGKSA-N 1 2 315.364 4.044 20 0 DIADLO CC1=C(c2ccco2)C[N@H+](Cc2cnc(Cl)c(F)c2)CC1 ZINC000846894114 1050778959 /nfs/dbraw/zinc/77/89/59/1050778959.db2.gz QMNVBTLYSWYPIZ-UHFFFAOYSA-N 1 2 306.768 4.147 20 0 DIADLO CC1=C(c2ccco2)C[N@@H+](Cc2cnc(Cl)c(F)c2)CC1 ZINC000846894114 1050778972 /nfs/dbraw/zinc/77/89/72/1050778972.db2.gz QMNVBTLYSWYPIZ-UHFFFAOYSA-N 1 2 306.768 4.147 20 0 DIADLO CC(C)c1cc(NCc2ccc([C@@H](C)O)cc2)nc(C(C)C)[nH+]1 ZINC000761206627 1050781848 /nfs/dbraw/zinc/78/18/48/1050781848.db2.gz XJHHTIFPMJGTDI-CQSZACIVSA-N 1 2 313.445 4.389 20 0 DIADLO O=c1[nH]ccc2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc21 ZINC001213954424 1050790365 /nfs/dbraw/zinc/79/03/65/1050790365.db2.gz UZPDSFVGRYKAQE-UHFFFAOYSA-N 1 2 320.396 4.069 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@@H]1CCCc2cc(OC(F)F)ccc21 ZINC000180331671 1050810631 /nfs/dbraw/zinc/81/06/31/1050810631.db2.gz IVVRLLFPCUIGTP-QLJPJBMISA-N 1 2 321.371 4.048 20 0 DIADLO Cc1nc(NCc2c(Cl)ccc(Cl)c2Cl)cc[nH+]1 ZINC000742407906 1050840148 /nfs/dbraw/zinc/84/01/48/1050840148.db2.gz DLJZRAUYABYPEZ-UHFFFAOYSA-N 1 2 302.592 4.357 20 0 DIADLO Cc1ccc(O)cc1Nc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001214337263 1050876240 /nfs/dbraw/zinc/87/62/40/1050876240.db2.gz ZPAUTBJDSFCLFW-UHFFFAOYSA-N 1 2 315.373 4.186 20 0 DIADLO CCCCCC[C@](C)(CC)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000742634339 1050907750 /nfs/dbraw/zinc/90/77/50/1050907750.db2.gz NXBRMYFMGNHFMZ-MJGOQNOKSA-N 1 2 319.493 4.433 20 0 DIADLO C[C@H]1CN(c2ccc([NH2+]C[C@H]3CCc4ccccc43)cc2)CCO1 ZINC000790052577 1050910112 /nfs/dbraw/zinc/91/01/12/1050910112.db2.gz GXXIZZMDQXPGQS-FUHWJXTLSA-N 1 2 322.452 4.054 20 0 DIADLO Cc1cc(F)ncc1C[N@H+](C)Cc1ccc(Cl)cc1Cl ZINC001231980371 1050918697 /nfs/dbraw/zinc/91/86/97/1050918697.db2.gz VNTOEQAQKFARBB-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC001231980371 1050918709 /nfs/dbraw/zinc/91/87/09/1050918709.db2.gz VNTOEQAQKFARBB-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO COc1c(C)ccc(F)c1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001214534805 1050934357 /nfs/dbraw/zinc/93/43/57/1050934357.db2.gz TUHLFTDIZDGTAK-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2nnc(-c3cccs3)o2)c(C)o1 ZINC000348105463 1050989069 /nfs/dbraw/zinc/98/90/69/1050989069.db2.gz DCQXCBYKVYCMEC-WDEREUQCSA-N 1 2 317.414 4.420 20 0 DIADLO CCc1ccc(C[N@H+]2CC=C(c3c(F)cccc3F)CC2)cn1 ZINC000348195031 1050997969 /nfs/dbraw/zinc/99/79/69/1050997969.db2.gz VWLKPKGWJDPUCW-UHFFFAOYSA-N 1 2 314.379 4.212 20 0 DIADLO CCc1ccc(C[N@@H+]2CC=C(c3c(F)cccc3F)CC2)cn1 ZINC000348195031 1050997973 /nfs/dbraw/zinc/99/79/73/1050997973.db2.gz VWLKPKGWJDPUCW-UHFFFAOYSA-N 1 2 314.379 4.212 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1C[C@H](O)c1ccc(C)cc1 ZINC000743257734 1051002303 /nfs/dbraw/zinc/00/23/03/1051002303.db2.gz PCACEYQCGKRWTE-IBGZPJMESA-N 1 2 323.440 4.290 20 0 DIADLO COc1c(F)cc(Nc2cccc3[nH+]c(C)cn32)cc1Cl ZINC001214964177 1051036140 /nfs/dbraw/zinc/03/61/40/1051036140.db2.gz UMFZJCDLFQJMJU-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO COc1c(F)cc(Nc2cccn3cc(C)[nH+]c23)cc1Cl ZINC001214966659 1051037351 /nfs/dbraw/zinc/03/73/51/1051037351.db2.gz VWTZVSYEAHCRPU-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1ccc(Cl)nc1 ZINC000773045956 1051039528 /nfs/dbraw/zinc/03/95/28/1051039528.db2.gz KILJIHISMYLZOY-SSDOTTSWSA-N 1 2 318.701 4.142 20 0 DIADLO c1cn(Cc2ccc(NCc3cccc4sccc43)nc2)c[nH+]1 ZINC001171377336 1051047152 /nfs/dbraw/zinc/04/71/52/1051047152.db2.gz HUJPNPDLOAJWFH-UHFFFAOYSA-N 1 2 320.421 4.153 20 0 DIADLO COc1c[nH+]c(NCc2cccc3sccc32)c2[nH]ccc21 ZINC001171378187 1051048788 /nfs/dbraw/zinc/04/87/88/1051048788.db2.gz WKXJNALLQCVUQR-UHFFFAOYSA-N 1 2 309.394 4.398 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](c2cccc(F)c2)C(C)(C)C)n1 ZINC000181059672 1051049977 /nfs/dbraw/zinc/04/99/77/1051049977.db2.gz GGHHWAFNTFRABG-HNNXBMFYSA-N 1 2 305.397 4.209 20 0 DIADLO CSc1ccc(-n2c(C)[nH+]c3ccc(N)cc32)cc1Cl ZINC001215070512 1051065870 /nfs/dbraw/zinc/06/58/70/1051065870.db2.gz IDJRYEZYADDFFT-UHFFFAOYSA-N 1 2 303.818 4.291 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2cccc(Cl)n2)[C@H]1c1ccccc1 ZINC000743850214 1051073432 /nfs/dbraw/zinc/07/34/32/1051073432.db2.gz PSSURGIRZWKHGA-SUMWQHHRSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2cccc(Cl)n2)[C@H]1c1ccccc1 ZINC000743850214 1051073444 /nfs/dbraw/zinc/07/34/44/1051073444.db2.gz PSSURGIRZWKHGA-SUMWQHHRSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@H]([NH2+]Cc1cnn(C)c1Cl)c1ccc(Cl)cc1Cl ZINC000712470190 1051075013 /nfs/dbraw/zinc/07/50/13/1051075013.db2.gz SJDHWBOZEKPVRG-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cccc(C(=O)N(C)C)c3F)ccc12 ZINC001215154210 1051089891 /nfs/dbraw/zinc/08/98/91/1051089891.db2.gz CYQVJAWZGFFAQI-UHFFFAOYSA-N 1 2 323.371 4.128 20 0 DIADLO Cc1ccc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)cc1C ZINC001215190552 1051109552 /nfs/dbraw/zinc/10/95/52/1051109552.db2.gz RVMCQNSXVGLTMI-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO CS[C@@H](C)CCC(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC000773284173 1051127968 /nfs/dbraw/zinc/12/79/68/1051127968.db2.gz VDSRPFGTOGIQFQ-NSHDSACASA-N 1 2 317.458 4.164 20 0 DIADLO Fc1cccc(F)c1C[N@H+](C[C@H]1CC1(Cl)Cl)C1CC1 ZINC000792322750 1051134218 /nfs/dbraw/zinc/13/42/18/1051134218.db2.gz KESHJLPQWHAPCD-SECBINFHSA-N 1 2 306.183 4.123 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](C[C@H]1CC1(Cl)Cl)C1CC1 ZINC000792322750 1051134225 /nfs/dbraw/zinc/13/42/25/1051134225.db2.gz KESHJLPQWHAPCD-SECBINFHSA-N 1 2 306.183 4.123 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(NCC(=O)Cc2ccccc2)c1 ZINC001170187495 1051147485 /nfs/dbraw/zinc/14/74/85/1051147485.db2.gz YFQCRAKLGKHQGJ-UHFFFAOYSA-N 1 2 310.441 4.065 20 0 DIADLO C[C@H]1[C@H](c2cccc(F)c2)OCC[N@@H+]1CCCCC(F)(F)F ZINC001171478780 1051151611 /nfs/dbraw/zinc/15/16/11/1051151611.db2.gz AZNKGADTEJOHJR-SWLSCSKDSA-N 1 2 319.342 4.320 20 0 DIADLO C[C@H]1[C@H](c2cccc(F)c2)OCC[N@H+]1CCCCC(F)(F)F ZINC001171478780 1051151616 /nfs/dbraw/zinc/15/16/16/1051151616.db2.gz AZNKGADTEJOHJR-SWLSCSKDSA-N 1 2 319.342 4.320 20 0 DIADLO c1c(NCCOC2CCCCC2)cc2c3c1CCC[NH+]3CCC2 ZINC001171478779 1051151701 /nfs/dbraw/zinc/15/17/01/1051151701.db2.gz CFUNNGOBXNWHQM-UHFFFAOYSA-N 1 2 314.473 4.147 20 0 DIADLO CC[C@@H]1C[C@H](C)C[N@@H+]1Cn1nc(-c2sccc2C)oc1=S ZINC000744439655 1051176320 /nfs/dbraw/zinc/17/63/20/1051176320.db2.gz BPHBUOIHAAMAEC-CMPLNLGQSA-N 1 2 323.487 4.320 20 0 DIADLO CC[C@@H]1C[C@H](C)C[N@H+]1Cn1nc(-c2sccc2C)oc1=S ZINC000744439655 1051176327 /nfs/dbraw/zinc/17/63/27/1051176327.db2.gz BPHBUOIHAAMAEC-CMPLNLGQSA-N 1 2 323.487 4.320 20 0 DIADLO CCc1nn(C)cc1CNc1[nH+]c2ccccc2n1C1CCCC1 ZINC000181524569 1051177049 /nfs/dbraw/zinc/17/70/49/1051177049.db2.gz BPMLGWYLLQJNLK-UHFFFAOYSA-N 1 2 323.444 4.059 20 0 DIADLO C[C@H]([NH2+]Cc1noc2c1CCCC2)c1cccc(C(F)(F)F)c1 ZINC000181606839 1051189034 /nfs/dbraw/zinc/18/90/34/1051189034.db2.gz JDJWGKXFUVLKDO-NSHDSACASA-N 1 2 324.346 4.423 20 0 DIADLO CCCOc1cccc(C[N@H+](C)[C@H](CC)C(=O)OC(C)(C)C)c1 ZINC001171670401 1051190023 /nfs/dbraw/zinc/19/00/23/1051190023.db2.gz DZQSXXZRUZTEID-QGZVFWFLSA-N 1 2 321.461 4.028 20 0 DIADLO CCCOc1cccc(C[N@@H+](C)[C@H](CC)C(=O)OC(C)(C)C)c1 ZINC001171670401 1051190028 /nfs/dbraw/zinc/19/00/28/1051190028.db2.gz DZQSXXZRUZTEID-QGZVFWFLSA-N 1 2 321.461 4.028 20 0 DIADLO COc1cccc2c1C[N@@H+]([C@@H](C)c1c(F)cccc1F)CC2 ZINC001170341768 1051193061 /nfs/dbraw/zinc/19/30/61/1051193061.db2.gz DXYOPZOGHPPFSO-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cccc2c1C[N@H+]([C@@H](C)c1c(F)cccc1F)CC2 ZINC001170341768 1051193063 /nfs/dbraw/zinc/19/30/63/1051193063.db2.gz DXYOPZOGHPPFSO-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(F)c(F)c2OC(C)C)[nH+]1 ZINC001215421198 1051198402 /nfs/dbraw/zinc/19/84/02/1051198402.db2.gz TYMJAROQFHHGFT-UHFFFAOYSA-N 1 2 317.339 4.452 20 0 DIADLO COc1cc(C)[nH+]c(CN2CC3(CC=CC3)[C@@H]2c2ccccc2)c1 ZINC001171719853 1051199481 /nfs/dbraw/zinc/19/94/81/1051199481.db2.gz XLEUWJNOHGHPAZ-FQEVSTJZSA-N 1 2 320.436 4.292 20 0 DIADLO CSc1ccc(F)cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001215448331 1051205979 /nfs/dbraw/zinc/20/59/79/1051205979.db2.gz DVBZZQHKKVYTOC-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2cccc(Cl)c2)n1)c1ccccn1 ZINC000181780342 1051207257 /nfs/dbraw/zinc/20/72/57/1051207257.db2.gz LPKFSLDFMAYOCA-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)O[C@H](C)c1cccc(F)c1)c1ccccc1 ZINC000745097961 1051221520 /nfs/dbraw/zinc/22/15/20/1051221520.db2.gz OKAVJYOHOHTDAL-KDOFPFPSSA-N 1 2 315.388 4.123 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)O[C@H](C)c1cccc(F)c1)c1ccccc1 ZINC000745097961 1051221533 /nfs/dbraw/zinc/22/15/33/1051221533.db2.gz OKAVJYOHOHTDAL-KDOFPFPSSA-N 1 2 315.388 4.123 20 0 DIADLO CC[C@H](OC(=O)[C@H](c1ccccc1)[N@H+](C)CC)c1ccccc1 ZINC000745098699 1051221839 /nfs/dbraw/zinc/22/18/39/1051221839.db2.gz UZCBRLUQKPLCDF-OALUTQOASA-N 1 2 311.425 4.374 20 0 DIADLO CC[C@H](OC(=O)[C@H](c1ccccc1)[N@@H+](C)CC)c1ccccc1 ZINC000745098699 1051221846 /nfs/dbraw/zinc/22/18/46/1051221846.db2.gz UZCBRLUQKPLCDF-OALUTQOASA-N 1 2 311.425 4.374 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)O[C@H](C)c1ccccc1F)c1ccccc1 ZINC000745097593 1051222317 /nfs/dbraw/zinc/22/23/17/1051222317.db2.gz GVTVEQCKVWUOIS-RDTXWAMCSA-N 1 2 315.388 4.123 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)O[C@H](C)c1ccccc1F)c1ccccc1 ZINC000745097593 1051222328 /nfs/dbraw/zinc/22/23/28/1051222328.db2.gz GVTVEQCKVWUOIS-RDTXWAMCSA-N 1 2 315.388 4.123 20 0 DIADLO CC[C@H](OC(=O)[C@@H](c1ccccc1)[N@H+](C)CC)c1ccccc1 ZINC000745098700 1051222907 /nfs/dbraw/zinc/22/29/07/1051222907.db2.gz UZCBRLUQKPLCDF-RBUKOAKNSA-N 1 2 311.425 4.374 20 0 DIADLO CC[C@H](OC(=O)[C@@H](c1ccccc1)[N@@H+](C)CC)c1ccccc1 ZINC000745098700 1051222917 /nfs/dbraw/zinc/22/29/17/1051222917.db2.gz UZCBRLUQKPLCDF-RBUKOAKNSA-N 1 2 311.425 4.374 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)O[C@@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000745097879 1051223087 /nfs/dbraw/zinc/22/30/87/1051223087.db2.gz MJWREENURNAHOF-KBXCAEBGSA-N 1 2 315.388 4.123 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)O[C@@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000745097879 1051223095 /nfs/dbraw/zinc/22/30/95/1051223095.db2.gz MJWREENURNAHOF-KBXCAEBGSA-N 1 2 315.388 4.123 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cs1 ZINC000792897480 1051223359 /nfs/dbraw/zinc/22/33/59/1051223359.db2.gz BXBSEDHIGOEIDZ-WCQYABFASA-N 1 2 319.301 4.282 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cs1 ZINC000792897480 1051223372 /nfs/dbraw/zinc/22/33/72/1051223372.db2.gz BXBSEDHIGOEIDZ-WCQYABFASA-N 1 2 319.301 4.282 20 0 DIADLO Clc1cc(Br)cc2nc(/C=C\c3[nH]cc[nH+]3)oc21 ZINC000792918351 1051229353 /nfs/dbraw/zinc/22/93/53/1051229353.db2.gz ZJIAROCCULSZAW-UPHRSURJSA-N 1 2 324.565 4.137 20 0 DIADLO Fc1cc(Nc2ccc([NH+]3CCCCC3)cc2)cc2n[nH]cc21 ZINC001215555337 1051242107 /nfs/dbraw/zinc/24/21/07/1051242107.db2.gz HTHWIXWADZXSCC-UHFFFAOYSA-N 1 2 310.376 4.436 20 0 DIADLO Fc1cc(Nc2ccc([NH+]3CCCCC3)cc2)cc2[nH]ncc21 ZINC001215555337 1051242113 /nfs/dbraw/zinc/24/21/13/1051242113.db2.gz HTHWIXWADZXSCC-UHFFFAOYSA-N 1 2 310.376 4.436 20 0 DIADLO CC[C@H]1CCCC[C@H]1C(=O)Nc1nc(C[NH+](CC)CC)cs1 ZINC000793154760 1051254586 /nfs/dbraw/zinc/25/45/86/1051254586.db2.gz SPLYDZIZITXGGZ-DZGCQCFKSA-N 1 2 323.506 4.140 20 0 DIADLO COCc1ccc(Cl)c(Nc2[nH+]c3ccccc3n2C)c1 ZINC001215594060 1051263011 /nfs/dbraw/zinc/26/30/11/1051263011.db2.gz KSJNKBUFARMTIG-UHFFFAOYSA-N 1 2 301.777 4.117 20 0 DIADLO Cc1nc([C@@H]([NH2+]C2CCC(C)CC2)c2ccc(Cl)cc2)no1 ZINC000182682114 1051263284 /nfs/dbraw/zinc/26/32/84/1051263284.db2.gz JXJGMLMDFKRRFJ-LNTUIOFPSA-N 1 2 319.836 4.289 20 0 DIADLO COc1c(Nc2ccc(N3CCCCC3)[nH+]c2)ccc(C)c1F ZINC001215600007 1051267994 /nfs/dbraw/zinc/26/79/94/1051267994.db2.gz RJBWWGDECAFGQJ-UHFFFAOYSA-N 1 2 315.392 4.272 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc(F)c(CO)c3F)ccc12 ZINC001215653163 1051288260 /nfs/dbraw/zinc/28/82/60/1051288260.db2.gz OIGQHZRRZJSLNY-UHFFFAOYSA-N 1 2 300.308 4.057 20 0 DIADLO COCOc1ccc(Nc2cc[nH+]c3cc(Cl)ccc23)cn1 ZINC001215663917 1051291907 /nfs/dbraw/zinc/29/19/07/1051291907.db2.gz PXMJESFVPIEOQE-UHFFFAOYSA-N 1 2 315.760 4.010 20 0 DIADLO CCCc1cc[nH+]c(Nc2cc(C(F)(F)F)ccc2CO)c1 ZINC001215683680 1051299553 /nfs/dbraw/zinc/29/95/53/1051299553.db2.gz OASOSHHTOAMYKR-UHFFFAOYSA-N 1 2 310.319 4.289 20 0 DIADLO CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cn1cc(Cl)cn1 ZINC000746043535 1051308937 /nfs/dbraw/zinc/30/89/37/1051308937.db2.gz YYBORXUISLSMOJ-UHFFFAOYSA-N 1 2 317.742 4.035 20 0 DIADLO CC[N@H+](Cc1ccc(C(F)(F)F)cc1)Cn1cc(Cl)cn1 ZINC000746043535 1051308952 /nfs/dbraw/zinc/30/89/52/1051308952.db2.gz YYBORXUISLSMOJ-UHFFFAOYSA-N 1 2 317.742 4.035 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@H](Oc3cccc(F)c3)C2)cs1 ZINC000183387462 1051317311 /nfs/dbraw/zinc/31/73/11/1051317311.db2.gz AIQUUTWIPBTNHU-INIZCTEOSA-N 1 2 320.433 4.059 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@H](Oc3cccc(F)c3)C2)cs1 ZINC000183387462 1051317321 /nfs/dbraw/zinc/31/73/21/1051317321.db2.gz AIQUUTWIPBTNHU-INIZCTEOSA-N 1 2 320.433 4.059 20 0 DIADLO CC[NH+](CC)Cc1ccc(F)c(Nc2nnc(C(C)(C)C)o2)c1 ZINC001215723589 1051323224 /nfs/dbraw/zinc/32/32/24/1051323224.db2.gz PAZYMAUMVAXTJY-UHFFFAOYSA-N 1 2 320.412 4.092 20 0 DIADLO C[C@@]12CC[N@H+](Cc3cc(F)c(F)cc3F)C[C@@H]1C2(Cl)Cl ZINC000793615435 1051328516 /nfs/dbraw/zinc/32/85/16/1051328516.db2.gz RVICLTSPPTVBEV-QWHCGFSZSA-N 1 2 324.173 4.120 20 0 DIADLO C[C@@]12CC[N@@H+](Cc3cc(F)c(F)cc3F)C[C@@H]1C2(Cl)Cl ZINC000793615435 1051328526 /nfs/dbraw/zinc/32/85/26/1051328526.db2.gz RVICLTSPPTVBEV-QWHCGFSZSA-N 1 2 324.173 4.120 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)s1 ZINC000793615522 1051329613 /nfs/dbraw/zinc/32/96/13/1051329613.db2.gz SQKREJSTIFGFBQ-YPMHNXCESA-N 1 2 319.301 4.282 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)s1 ZINC000793615522 1051329617 /nfs/dbraw/zinc/32/96/17/1051329617.db2.gz SQKREJSTIFGFBQ-YPMHNXCESA-N 1 2 319.301 4.282 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(C4CCOCC4)cc3)ccc21 ZINC001212654276 1051353358 /nfs/dbraw/zinc/35/33/58/1051353358.db2.gz VIGMOXNWYDVAMD-UHFFFAOYSA-N 1 2 307.397 4.211 20 0 DIADLO Cc1cc[nH+]c(Nc2cnc(OCc3ccccc3)cc2C)c1 ZINC001215777681 1051363633 /nfs/dbraw/zinc/36/36/33/1051363633.db2.gz ZAKLTSCEYYNQMX-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO CC(C)Oc1cnc(F)c(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001215783411 1051367696 /nfs/dbraw/zinc/36/76/96/1051367696.db2.gz TZPLJHHZBTWTHP-UHFFFAOYSA-N 1 2 320.755 4.053 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@@H](C(C)(C)C)C[C@H]2C)c(C)[nH+]1 ZINC001129395468 1051375535 /nfs/dbraw/zinc/37/55/35/1051375535.db2.gz PWBYEEPVDCVIDL-GDBMZVCRSA-N 1 2 302.462 4.294 20 0 DIADLO CSc1cccc(F)c1Nc1ccc[nH+]c1N1CCCC1 ZINC001215821919 1051387426 /nfs/dbraw/zinc/38/74/26/1051387426.db2.gz GDCIXQUSHCNXOV-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO C[C@@H]1CC[N@H+](Cn2nc(C3CC3)sc2=S)[C@H]2CCCC[C@@H]12 ZINC000746375895 1051387752 /nfs/dbraw/zinc/38/77/52/1051387752.db2.gz YKGSRUJYJKJFFK-XBFCOCLRSA-N 1 2 323.531 4.410 20 0 DIADLO C[C@@H]1CC[N@@H+](Cn2nc(C3CC3)sc2=S)[C@H]2CCCC[C@@H]12 ZINC000746375895 1051387763 /nfs/dbraw/zinc/38/77/63/1051387763.db2.gz YKGSRUJYJKJFFK-XBFCOCLRSA-N 1 2 323.531 4.410 20 0 DIADLO S=c1sc(C2CC2)nn1C[N@@H+]1CCC2(C1)CCCCC2 ZINC000746379886 1051388341 /nfs/dbraw/zinc/38/83/41/1051388341.db2.gz LNOVNPWTNJAOCT-UHFFFAOYSA-N 1 2 309.504 4.165 20 0 DIADLO S=c1sc(C2CC2)nn1C[N@H+]1CCC2(C1)CCCCC2 ZINC000746379886 1051388349 /nfs/dbraw/zinc/38/83/49/1051388349.db2.gz LNOVNPWTNJAOCT-UHFFFAOYSA-N 1 2 309.504 4.165 20 0 DIADLO CSc1cccc(F)c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001215824530 1051388864 /nfs/dbraw/zinc/38/88/64/1051388864.db2.gz YOGBMMCMWXCYBA-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO CCCCCC[C@@H](CCC)[NH2+][C@H]1Oc2ccc(CCO)cc2O1 ZINC001172386842 1051390343 /nfs/dbraw/zinc/39/03/43/1051390343.db2.gz HHKCIDOEQQLBRF-APWZRJJASA-N 1 2 321.461 4.005 20 0 DIADLO CCOc1cc(Nc2ccc3c(c2)[nH+]cn3C)ccc1Cl ZINC001212580073 1051397907 /nfs/dbraw/zinc/39/79/07/1051397907.db2.gz PDLFRHPYLYRWHF-UHFFFAOYSA-N 1 2 301.777 4.369 20 0 DIADLO CSc1cc(F)c(Nc2cccc3[nH+]c(C)cn32)c(F)c1 ZINC001215841357 1051405961 /nfs/dbraw/zinc/40/59/61/1051405961.db2.gz SEYOVIJLZSMUDF-UHFFFAOYSA-N 1 2 305.353 4.386 20 0 DIADLO Cc1cccc(-c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)c1C ZINC001215850029 1051413906 /nfs/dbraw/zinc/41/39/06/1051413906.db2.gz KDKITNFHSJEMJP-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Clc1cc2n[nH]cc2c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001215859518 1051417625 /nfs/dbraw/zinc/41/76/25/1051417625.db2.gz MLFGMJGNNUAYJP-UHFFFAOYSA-N 1 2 323.787 4.205 20 0 DIADLO Clc1cc2n[nH]cc2c(Nc2ccccc2-n2cc[nH+]c2)c1 ZINC001215859991 1051419942 /nfs/dbraw/zinc/41/99/42/1051419942.db2.gz ZDPPIMQSTWNHMU-UHFFFAOYSA-N 1 2 309.760 4.146 20 0 DIADLO Cc1ncc2c(n1)CCC[C@H]2Nc1cc[nH+]c2c(Cl)cccc12 ZINC000804465041 1051421657 /nfs/dbraw/zinc/42/16/57/1051421657.db2.gz AICGRYWNAKRISZ-MRXNPFEDSA-N 1 2 324.815 4.476 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nc(C(F)(F)F)cs2)c(C)o1 ZINC000183798733 1051421865 /nfs/dbraw/zinc/42/18/65/1051421865.db2.gz IDYFOXXUVHGERW-QMMMGPOBSA-N 1 2 304.337 4.223 20 0 DIADLO COc1cccc(OC)c1-c1ccccc1Nc1[nH+]cccc1N ZINC001215862646 1051422166 /nfs/dbraw/zinc/42/21/66/1051422166.db2.gz XIHIVGXIIZJQDC-UHFFFAOYSA-N 1 2 321.380 4.092 20 0 DIADLO CC(C)c1ccc(NC(=O)C[N@@H+]2CC[C@@H]2c2ccccc2)cc1 ZINC000746458365 1051423890 /nfs/dbraw/zinc/42/38/90/1051423890.db2.gz XTJWFCJZPUMAPT-LJQANCHMSA-N 1 2 308.425 4.196 20 0 DIADLO CC(C)c1ccc(NC(=O)C[N@H+]2CC[C@@H]2c2ccccc2)cc1 ZINC000746458365 1051423893 /nfs/dbraw/zinc/42/38/93/1051423893.db2.gz XTJWFCJZPUMAPT-LJQANCHMSA-N 1 2 308.425 4.196 20 0 DIADLO C[C@](O)(CNc1cc[nH+]c2c(Cl)cccc12)c1cccs1 ZINC000804489991 1051429522 /nfs/dbraw/zinc/42/95/22/1051429522.db2.gz DSTUGOQAMHDECT-INIZCTEOSA-N 1 2 318.829 4.269 20 0 DIADLO C[C@@](O)(CNc1cc[nH+]c2c(Cl)cccc12)c1ccsc1 ZINC000804497530 1051430975 /nfs/dbraw/zinc/43/09/75/1051430975.db2.gz DKWZVSLZUHVAFA-MRXNPFEDSA-N 1 2 318.829 4.269 20 0 DIADLO CC(C)(C)OC(=O)C(C)(C)[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC001172552579 1051434581 /nfs/dbraw/zinc/43/45/81/1051434581.db2.gz GPNZGIAMTPXBGX-CVEARBPZSA-N 1 2 303.446 4.033 20 0 DIADLO CCC[C@@H]1CCC[N@H+](Cn2nc(C3CC3)n(C3CC3)c2=S)C1 ZINC000121322585 1051441431 /nfs/dbraw/zinc/44/14/31/1051441431.db2.gz YCFOMFNNIIHODR-CYBMUJFWSA-N 1 2 320.506 4.096 20 0 DIADLO CCC[C@@H]1CCC[N@@H+](Cn2nc(C3CC3)n(C3CC3)c2=S)C1 ZINC000121322585 1051441440 /nfs/dbraw/zinc/44/14/40/1051441440.db2.gz YCFOMFNNIIHODR-CYBMUJFWSA-N 1 2 320.506 4.096 20 0 DIADLO FC(F)(F)c1ccc(OC2C[NH+](Cc3cccs3)C2)cc1 ZINC001204017788 1051457430 /nfs/dbraw/zinc/45/74/30/1051457430.db2.gz ZYYHLIBOGWBNCF-UHFFFAOYSA-N 1 2 313.344 4.030 20 0 DIADLO Cc1ncc(CCNc2cc[nH+]c3c(Cl)cccc23)s1 ZINC000804562442 1051460115 /nfs/dbraw/zinc/46/01/15/1051460115.db2.gz ICMJWLRDINQLSI-UHFFFAOYSA-N 1 2 303.818 4.308 20 0 DIADLO COc1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)cc1SC ZINC001215933720 1051467283 /nfs/dbraw/zinc/46/72/83/1051467283.db2.gz XDVZQRKZYWZTOC-UHFFFAOYSA-N 1 2 319.817 4.462 20 0 DIADLO CC1=CC[N@H+](Cc2cc(Cl)ccc2Br)CC1 ZINC001168918170 1051468846 /nfs/dbraw/zinc/46/88/46/1051468846.db2.gz GUTWGJFYBALBIH-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO CC1=CC[N@@H+](Cc2cc(Cl)ccc2Br)CC1 ZINC001168918170 1051468850 /nfs/dbraw/zinc/46/88/50/1051468850.db2.gz GUTWGJFYBALBIH-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO C[C@@H]([NH2+]Cc1scnc1Cl)c1nc2ccccc2s1 ZINC001168981554 1051477663 /nfs/dbraw/zinc/47/76/63/1051477663.db2.gz NQADLLABZXMHGO-MRVPVSSYSA-N 1 2 309.847 4.257 20 0 DIADLO Fc1ncc(C2CC2)cc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001215954459 1051479644 /nfs/dbraw/zinc/47/96/44/1051479644.db2.gz PSQLPFDZXCIIGF-UHFFFAOYSA-N 1 2 302.740 4.143 20 0 DIADLO c1c(CCNc2ccc(-c3ccncc3)cc2)[nH+]c2ccccn12 ZINC001169004612 1051484703 /nfs/dbraw/zinc/48/47/03/1051484703.db2.gz OWSPLNOODDSIEG-UHFFFAOYSA-N 1 2 314.392 4.051 20 0 DIADLO CC1(C)CCc2cc(NCCc3cn4ccccc4[nH+]3)ccc2O1 ZINC001169009267 1051487752 /nfs/dbraw/zinc/48/77/52/1051487752.db2.gz PUFANUASIYPKNJ-UHFFFAOYSA-N 1 2 321.424 4.093 20 0 DIADLO c1cc2cc(NCc3ccccc3N3CCCCC3)[nH+]cc2[nH]1 ZINC000804598571 1051490811 /nfs/dbraw/zinc/49/08/11/1051490811.db2.gz OITYXDRUGYTLHE-UHFFFAOYSA-N 1 2 306.413 4.165 20 0 DIADLO CC(C)(C)CC(C)(C)Nc1cc[nH+]c(OC2CCOCC2)c1 ZINC001169051911 1051497401 /nfs/dbraw/zinc/49/74/01/1051497401.db2.gz DQTDGVFEKPFNOM-UHFFFAOYSA-N 1 2 306.450 4.266 20 0 DIADLO Cc1cc(NC(=O)N(C)c2ccc(C(C)(C)C)cc2)c(C)c[nH+]1 ZINC001216004452 1051519392 /nfs/dbraw/zinc/51/93/92/1051519392.db2.gz UFXWYXGOAIFDOU-UHFFFAOYSA-N 1 2 311.429 4.086 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1cc(OC(F)(F)F)ccc1N ZINC001216015482 1051524830 /nfs/dbraw/zinc/52/48/30/1051524830.db2.gz MCLCZWJODZCUBA-UHFFFAOYSA-N 1 2 311.307 4.177 20 0 DIADLO CC(C)c1ccc(N)c(Nc2cc(OC(F)(F)F)cc[nH+]2)c1 ZINC001216022443 1051529334 /nfs/dbraw/zinc/52/93/34/1051529334.db2.gz YMVSAJSCTUBFDH-UHFFFAOYSA-N 1 2 311.307 4.429 20 0 DIADLO COc1cccc2c1C[N@@H+]([C@@H](C)Cc1c(F)cccc1Cl)C2 ZINC001172855511 1051541426 /nfs/dbraw/zinc/54/14/26/1051541426.db2.gz FPGXKNCWDQDLSY-LBPRGKRZSA-N 1 2 319.807 4.435 20 0 DIADLO COc1cccc2c1C[N@H+]([C@@H](C)Cc1c(F)cccc1Cl)C2 ZINC001172855511 1051541431 /nfs/dbraw/zinc/54/14/31/1051541431.db2.gz FPGXKNCWDQDLSY-LBPRGKRZSA-N 1 2 319.807 4.435 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1cc(F)ccc1Cl ZINC001169188214 1051541770 /nfs/dbraw/zinc/54/17/70/1051541770.db2.gz QAURWMRZLKLHPU-GFCCVEGCSA-N 1 2 305.780 4.262 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1cc(F)ccc1Cl ZINC001169188214 1051541779 /nfs/dbraw/zinc/54/17/79/1051541779.db2.gz QAURWMRZLKLHPU-GFCCVEGCSA-N 1 2 305.780 4.262 20 0 DIADLO CC/C(=C/C(=O)NCc1cc(C)[nH+]c(C)c1)c1ccc(C)cc1 ZINC001129858856 1051542234 /nfs/dbraw/zinc/54/22/34/1051542234.db2.gz TXJXDVOKOVYEMI-PDGQHHTCSA-N 1 2 308.425 4.117 20 0 DIADLO CC(C)c1cc(Nc2cc(Cl)c3[nH+]ccn3c2)ccc1N ZINC001216043834 1051543883 /nfs/dbraw/zinc/54/38/83/1051543883.db2.gz XAQREBIEWMSJEZ-UHFFFAOYSA-N 1 2 300.793 4.437 20 0 DIADLO COc1c(Cl)ccc(Nc2ccc3c(c2)[nH+]cn3C)c1F ZINC001212585996 1051547944 /nfs/dbraw/zinc/54/79/44/1051547944.db2.gz KTKCAHPAKPEEQR-UHFFFAOYSA-N 1 2 305.740 4.118 20 0 DIADLO C[C@@H](CSc1ccc(Cl)cc1)[N@@H+]1Cc2cccnc2C1 ZINC001172875503 1051559060 /nfs/dbraw/zinc/55/90/60/1051559060.db2.gz LWZLPURSWXBDPM-LBPRGKRZSA-N 1 2 304.846 4.231 20 0 DIADLO C[C@@H](CSc1ccc(Cl)cc1)[N@H+]1Cc2cccnc2C1 ZINC001172875503 1051559070 /nfs/dbraw/zinc/55/90/70/1051559070.db2.gz LWZLPURSWXBDPM-LBPRGKRZSA-N 1 2 304.846 4.231 20 0 DIADLO CCc1ccc([C@H]2C[N@H+](Cc3ccccc3Cl)CCO2)cc1 ZINC001169283145 1051568113 /nfs/dbraw/zinc/56/81/13/1051568113.db2.gz GUFVZKXHYJVPBB-LJQANCHMSA-N 1 2 315.844 4.476 20 0 DIADLO CCc1ccc([C@H]2C[N@@H+](Cc3ccccc3Cl)CCO2)cc1 ZINC001169283145 1051568120 /nfs/dbraw/zinc/56/81/20/1051568120.db2.gz GUFVZKXHYJVPBB-LJQANCHMSA-N 1 2 315.844 4.476 20 0 DIADLO Clc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)cnc1Cl ZINC001212693407 1051573861 /nfs/dbraw/zinc/57/38/61/1051573861.db2.gz VGMIZWQNXPJIBT-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO CCC(=O)Nc1cccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212696747 1051583752 /nfs/dbraw/zinc/58/37/52/1051583752.db2.gz JLADIAZUODTVMX-UHFFFAOYSA-N 1 2 320.396 4.024 20 0 DIADLO Clc1cncc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1Cl ZINC001212694015 1051584007 /nfs/dbraw/zinc/58/40/07/1051584007.db2.gz FLSSAMAYIQNMRF-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO Clc1cc2ncoc2cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212699316 1051585873 /nfs/dbraw/zinc/58/58/73/1051585873.db2.gz ZGRJEHARSPCLEY-UHFFFAOYSA-N 1 2 324.771 4.470 20 0 DIADLO c1cn(Cc2ccc(Nc3ccc(-c4cnco4)cc3)cc2)c[nH+]1 ZINC001212696941 1051587266 /nfs/dbraw/zinc/58/72/66/1051587266.db2.gz WISGYEXZCRZTSU-UHFFFAOYSA-N 1 2 316.364 4.330 20 0 DIADLO Fc1cc(F)c(F)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1F ZINC001212696928 1051587875 /nfs/dbraw/zinc/58/78/75/1051587875.db2.gz VOOKQUVBTPWECM-UHFFFAOYSA-N 1 2 321.277 4.231 20 0 DIADLO c1cn(Cc2ccc(Nc3ccc(OCC4CC4)cc3)cc2)c[nH+]1 ZINC001212698006 1051588474 /nfs/dbraw/zinc/58/84/74/1051588474.db2.gz GRMLXDXLJMIBTH-UHFFFAOYSA-N 1 2 319.408 4.464 20 0 DIADLO Cc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(Cl)c1O ZINC001212697658 1051588521 /nfs/dbraw/zinc/58/85/21/1051588521.db2.gz MATSBCWCICCQQM-UHFFFAOYSA-N 1 2 313.788 4.342 20 0 DIADLO CCOC(=O)CCc1ccc[nH+]c1N[C@@H]1C[C@H](C)c2ccccc21 ZINC001169371916 1051594024 /nfs/dbraw/zinc/59/40/24/1051594024.db2.gz DHMINFPUGJVHLJ-KBXCAEBGSA-N 1 2 324.424 4.238 20 0 DIADLO C[C@H]1C[C@@H](Nc2cc[nH+]c(OC3CCOCC3)c2)c2ccccc21 ZINC001169381440 1051600609 /nfs/dbraw/zinc/60/06/09/1051600609.db2.gz SIECRQGWDQLKAB-IFXJQAMLSA-N 1 2 324.424 4.300 20 0 DIADLO CN(C)c1cc(F)cc(Nc2ccc[nH+]c2N2CCCCC2)c1 ZINC001216161033 1051606879 /nfs/dbraw/zinc/60/68/79/1051606879.db2.gz XUFFRZNOICVGPW-UHFFFAOYSA-N 1 2 314.408 4.021 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@H](C)c1ccnc(Cl)c1)c1ccco1 ZINC000152610825 1051626695 /nfs/dbraw/zinc/62/66/95/1051626695.db2.gz XMEAOGGZNOQRLO-UKRRQHHQSA-N 1 2 322.836 4.393 20 0 DIADLO Cc1c(CSC(C)C)cccc1NC(=O)/C=C\c1[nH]cc[nH+]1 ZINC000493563941 1051634584 /nfs/dbraw/zinc/63/45/84/1051634584.db2.gz WLHBOXAYSSHAFY-FPLPWBNLSA-N 1 2 315.442 4.012 20 0 DIADLO Cc1cc(NC[C@H](C)c2ccc(O)cc2)[nH+]cc1C(F)(F)F ZINC001169534403 1051637501 /nfs/dbraw/zinc/63/75/01/1051637501.db2.gz WHZXSUIVIVLNGR-NSHDSACASA-N 1 2 310.319 4.330 20 0 DIADLO C[C@H](Nc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1)c1cnccn1 ZINC001169539234 1051639245 /nfs/dbraw/zinc/63/92/45/1051639245.db2.gz TWVIXSIMJARDOV-ZDUSSCGKSA-N 1 2 315.380 4.193 20 0 DIADLO C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CCCC(=O)C1 ZINC001173209148 1051647368 /nfs/dbraw/zinc/64/73/68/1051647368.db2.gz FBVWCEWZNMAWJT-KRWDZBQOSA-N 1 2 307.437 4.262 20 0 DIADLO C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCCC(=O)C1 ZINC001173209148 1051647375 /nfs/dbraw/zinc/64/73/75/1051647375.db2.gz FBVWCEWZNMAWJT-KRWDZBQOSA-N 1 2 307.437 4.262 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(OC(C)C)c(OC)c2)c[nH+]1 ZINC001216246313 1051651511 /nfs/dbraw/zinc/65/15/11/1051651511.db2.gz ATUSZDKPECPIOY-UHFFFAOYSA-N 1 2 315.417 4.077 20 0 DIADLO CCCC[C@H](CC(C)C)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001173254512 1051656752 /nfs/dbraw/zinc/65/67/52/1051656752.db2.gz GSBKBRUFHXSGQE-CYBMUJFWSA-N 1 2 317.399 4.322 20 0 DIADLO CCCC[C@H](CC(C)C)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001173254512 1051656757 /nfs/dbraw/zinc/65/67/57/1051656757.db2.gz GSBKBRUFHXSGQE-CYBMUJFWSA-N 1 2 317.399 4.322 20 0 DIADLO COc1cc[nH+]cc1NC1(c2ccccc2C(F)(F)F)CC1 ZINC001169634994 1051661517 /nfs/dbraw/zinc/66/15/17/1051661517.db2.gz IKUJIWWQKMZISZ-UHFFFAOYSA-N 1 2 308.303 4.210 20 0 DIADLO CC(C)([NH2+]CC(=O)c1ccccc1F)c1cccc(Cl)c1F ZINC001169613692 1051663505 /nfs/dbraw/zinc/66/35/05/1051663505.db2.gz NEJOSCVRLZUBMC-UHFFFAOYSA-N 1 2 323.770 4.326 20 0 DIADLO CNc1ccc(NC2(c3ccccc3C(F)(F)F)CC2)c[nH+]1 ZINC001169637277 1051663585 /nfs/dbraw/zinc/66/35/85/1051663585.db2.gz UJSIPDVNBIETGS-UHFFFAOYSA-N 1 2 307.319 4.243 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@H+](C)Cc1cccc2[nH]ccc21 ZINC000494006075 1051675499 /nfs/dbraw/zinc/67/54/99/1051675499.db2.gz GAIDQOCNTNQYMH-GFCCVEGCSA-N 1 2 312.417 4.041 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000494006075 1051675506 /nfs/dbraw/zinc/67/55/06/1051675506.db2.gz GAIDQOCNTNQYMH-GFCCVEGCSA-N 1 2 312.417 4.041 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@](F)(c3ccccc3C)C2)c(Cl)n1 ZINC001169715105 1051681161 /nfs/dbraw/zinc/68/11/61/1051681161.db2.gz GZHAKZFTKMDUOW-GOSISDBHSA-N 1 2 318.823 4.423 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@](F)(c3ccccc3C)C2)c(Cl)n1 ZINC001169715105 1051681172 /nfs/dbraw/zinc/68/11/72/1051681172.db2.gz GZHAKZFTKMDUOW-GOSISDBHSA-N 1 2 318.823 4.423 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@@](F)(c3ccccc3C)C2)c(Cl)n1 ZINC001169715106 1051681442 /nfs/dbraw/zinc/68/14/42/1051681442.db2.gz GZHAKZFTKMDUOW-SFHVURJKSA-N 1 2 318.823 4.423 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@@](F)(c3ccccc3C)C2)c(Cl)n1 ZINC001169715106 1051681452 /nfs/dbraw/zinc/68/14/52/1051681452.db2.gz GZHAKZFTKMDUOW-SFHVURJKSA-N 1 2 318.823 4.423 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+]1CCC=C(Br)C1 ZINC001169733195 1051689747 /nfs/dbraw/zinc/68/97/47/1051689747.db2.gz KQUKYNOTTZEMHP-UHFFFAOYSA-N 1 2 300.627 4.133 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+]1CCC=C(Br)C1 ZINC001169733195 1051689758 /nfs/dbraw/zinc/68/97/58/1051689758.db2.gz KQUKYNOTTZEMHP-UHFFFAOYSA-N 1 2 300.627 4.133 20 0 DIADLO Cc1cc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)ccc1[NH+](C)C ZINC001169757494 1051694523 /nfs/dbraw/zinc/69/45/23/1051694523.db2.gz FADLHTOQRAUWCT-UYAOXDASSA-N 1 2 310.441 4.393 20 0 DIADLO Cc1cc([NH2+][C@@H]2CCO[C@@H](c3ccccc3)C2)ccc1N(C)C ZINC001169757494 1051694525 /nfs/dbraw/zinc/69/45/25/1051694525.db2.gz FADLHTOQRAUWCT-UYAOXDASSA-N 1 2 310.441 4.393 20 0 DIADLO CCCc1csc(C[NH2+][C@@H](c2nc(C)cs2)C2CC2)n1 ZINC000494151462 1051696296 /nfs/dbraw/zinc/69/62/96/1051696296.db2.gz CBRLRVLKWISUSO-CQSZACIVSA-N 1 2 307.488 4.101 20 0 DIADLO COc1ccc(C2([NH2+]Cc3nc(Cl)ccc3Cl)CC2)cc1 ZINC000766851600 1051710065 /nfs/dbraw/zinc/71/00/65/1051710065.db2.gz FQWRZFYTNFVQDB-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO c1cn2ccc(NCc3ccc(-c4ccccn4)cc3)cc2[nH+]1 ZINC001169889895 1051718008 /nfs/dbraw/zinc/71/80/08/1051718008.db2.gz UVVNBBUKNVPDET-UHFFFAOYSA-N 1 2 300.365 4.008 20 0 DIADLO O[C@@H](CNc1cc[nH+]c2c(Cl)cccc12)c1ccccc1F ZINC000804345370 1051746342 /nfs/dbraw/zinc/74/63/42/1051746342.db2.gz WJSUMSLZOKJKEE-INIZCTEOSA-N 1 2 316.763 4.173 20 0 DIADLO C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001173548354 1051748579 /nfs/dbraw/zinc/74/85/79/1051748579.db2.gz CGSUWJLFSLZOBV-QCZZGDTMSA-N 1 2 308.199 4.306 20 0 DIADLO C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@@H](F)[C@@H](F)C1 ZINC001173548354 1051748592 /nfs/dbraw/zinc/74/85/92/1051748592.db2.gz CGSUWJLFSLZOBV-QCZZGDTMSA-N 1 2 308.199 4.306 20 0 DIADLO C[C@@H]([NH2+]Cc1csnn1)c1ccc(Cl)c2ccccc21 ZINC000184969256 1051751683 /nfs/dbraw/zinc/75/16/83/1051751683.db2.gz QSCZKXCTVHGDTP-SNVBAGLBSA-N 1 2 303.818 4.196 20 0 DIADLO Clc1ccc2c(n1)CC[C@H]2Nc1ccc([NH+]2CCCC2)cc1 ZINC000806151790 1051756394 /nfs/dbraw/zinc/75/63/94/1051756394.db2.gz LRZXYKIKNUUOAA-MRXNPFEDSA-N 1 2 313.832 4.435 20 0 DIADLO CN(C)c1cc(CSc2nc(-c3ccccc3)co2)cc[nH+]1 ZINC000767108739 1051758487 /nfs/dbraw/zinc/75/84/87/1051758487.db2.gz JZFNVCREGOYPAM-UHFFFAOYSA-N 1 2 311.410 4.095 20 0 DIADLO C/C=C(/CC)C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000767091979 1051761052 /nfs/dbraw/zinc/76/10/52/1051761052.db2.gz NBWOZSPMYOPEBC-BNNQUZSASA-N 1 2 309.413 4.181 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CC[N@H+](Cc2csc(C3CC3)n2)C1 ZINC000185306195 1051762308 /nfs/dbraw/zinc/76/23/08/1051762308.db2.gz MSDXEQFKDKOKOJ-GFCCVEGCSA-N 1 2 320.408 4.288 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CC[N@@H+](Cc2csc(C3CC3)n2)C1 ZINC000185306195 1051762323 /nfs/dbraw/zinc/76/23/23/1051762323.db2.gz MSDXEQFKDKOKOJ-GFCCVEGCSA-N 1 2 320.408 4.288 20 0 DIADLO CC(C)c1ccc(Nc2[nH+]c3ccccc3n2C)c(Cl)n1 ZINC001216443352 1051768557 /nfs/dbraw/zinc/76/85/57/1051768557.db2.gz NNDFCDREWAUTCN-UHFFFAOYSA-N 1 2 300.793 4.489 20 0 DIADLO C[C@H]([NH2+]Cc1cc(O)cc(F)c1)c1nc(C(C)(C)C)cs1 ZINC000185524368 1051771002 /nfs/dbraw/zinc/77/10/02/1051771002.db2.gz ZAOGELVWJRMIPC-JTQLQIEISA-N 1 2 308.422 4.136 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1cc(Cl)c(N)c(Cl)c1 ZINC000806179351 1051773428 /nfs/dbraw/zinc/77/34/28/1051773428.db2.gz BOWZVEQQVRBDCY-RDDDGLTNSA-N 1 2 309.187 4.414 20 0 DIADLO CC(=O)c1cccc(Nc2ccc(N3CCCCC3)[nH+]c2)c1F ZINC001216497449 1051791609 /nfs/dbraw/zinc/79/16/09/1051791609.db2.gz MNACBNVVEMXDNV-UHFFFAOYSA-N 1 2 313.376 4.157 20 0 DIADLO Nc1c(Cl)cccc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001216525731 1051804969 /nfs/dbraw/zinc/80/49/69/1051804969.db2.gz ZVZZAJHVMHUSEF-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO Cc1cc(NC(=O)c2ccc(Cl)cc2C(F)(F)F)cc[nH+]1 ZINC000186669580 1051826397 /nfs/dbraw/zinc/82/63/97/1051826397.db2.gz WDJSPXRPBQMKLU-UHFFFAOYSA-N 1 2 314.694 4.315 20 0 DIADLO CCCc1cccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000187272486 1051841030 /nfs/dbraw/zinc/84/10/30/1051841030.db2.gz BOMPHGHIICAFRS-ZDUSSCGKSA-N 1 2 301.434 4.170 20 0 DIADLO COc1c(Nc2cccn3cc[nH+]c23)cccc1C(F)(F)F ZINC001216633214 1051842350 /nfs/dbraw/zinc/84/23/50/1051842350.db2.gz IALKPJGQLGFNKG-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2cccc(F)c2)cc[nH+]1 ZINC001173832488 1051849152 /nfs/dbraw/zinc/84/91/52/1051849152.db2.gz RIUKLWUWXCAQAX-UHFFFAOYSA-N 1 2 303.337 4.311 20 0 DIADLO COC(=O)c1sccc1C[N@H+](C)C/C(C)=C/c1ccccc1 ZINC000494232793 1051856914 /nfs/dbraw/zinc/85/69/14/1051856914.db2.gz CQVUSBZOGJXGDU-SDNWHVSQSA-N 1 2 315.438 4.070 20 0 DIADLO COC(=O)c1sccc1C[N@@H+](C)C/C(C)=C/c1ccccc1 ZINC000494232793 1051856922 /nfs/dbraw/zinc/85/69/22/1051856922.db2.gz CQVUSBZOGJXGDU-SDNWHVSQSA-N 1 2 315.438 4.070 20 0 DIADLO C/C(=C\c1ccccc1)C[N@@H+](C)[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000494232951 1051858086 /nfs/dbraw/zinc/85/80/86/1051858086.db2.gz FALHBXNPOFRAMZ-ZQHYZAEZSA-N 1 2 313.445 4.463 20 0 DIADLO C/C(=C\c1ccccc1)C[N@H+](C)[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000494232951 1051858093 /nfs/dbraw/zinc/85/80/93/1051858093.db2.gz FALHBXNPOFRAMZ-ZQHYZAEZSA-N 1 2 313.445 4.463 20 0 DIADLO CN(C)c1cc(CS[C@@H]2CCc3ccc(F)cc32)cc[nH+]1 ZINC000767865509 1051858097 /nfs/dbraw/zinc/85/80/97/1051858097.db2.gz GZXQBOIAGAGMCX-MRXNPFEDSA-N 1 2 302.418 4.207 20 0 DIADLO C/C(=C\c1ccccc1)C[N@@H+](C)Cc1nc(C2CCCC2)no1 ZINC000494235769 1051858469 /nfs/dbraw/zinc/85/84/69/1051858469.db2.gz YUEXXBLPOXRIHX-NTCAYCPXSA-N 1 2 311.429 4.263 20 0 DIADLO C/C(=C\c1ccccc1)C[N@H+](C)Cc1nc(C2CCCC2)no1 ZINC000494235769 1051858479 /nfs/dbraw/zinc/85/84/79/1051858479.db2.gz YUEXXBLPOXRIHX-NTCAYCPXSA-N 1 2 311.429 4.263 20 0 DIADLO C[C@@H](SCc1cc[nH+]c(N(C)C)c1)c1ccc(F)cc1F ZINC000767871602 1051860756 /nfs/dbraw/zinc/86/07/56/1051860756.db2.gz OUXRLSZRHJGZDW-LLVKDONJSA-N 1 2 308.397 4.420 20 0 DIADLO COc1cc(OC)c(Nc2cccc3cc[nH+]cc32)c(OC)c1 ZINC001173909905 1051871053 /nfs/dbraw/zinc/87/10/53/1051871053.db2.gz CGSKKXOIZJEHNF-UHFFFAOYSA-N 1 2 310.353 4.004 20 0 DIADLO CC[C@@H](OC(=O)CCCn1cc[nH+]c1)c1ccc(Cl)cc1F ZINC000768186520 1051898349 /nfs/dbraw/zinc/89/83/49/1051898349.db2.gz SOQNDHAIKJNKBN-OAHLLOKOSA-N 1 2 324.783 4.150 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)cnc1Cl ZINC000768256312 1051910279 /nfs/dbraw/zinc/91/02/79/1051910279.db2.gz BSQBYDZCHLEZGA-UHFFFAOYSA-N 1 2 322.786 4.486 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)cnc1Cl ZINC000768256312 1051910290 /nfs/dbraw/zinc/91/02/90/1051910290.db2.gz BSQBYDZCHLEZGA-UHFFFAOYSA-N 1 2 322.786 4.486 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cccc3c2OC(C)(C)C3)no1 ZINC000768429024 1051929559 /nfs/dbraw/zinc/92/95/59/1051929559.db2.gz IWIHLTQVYZBKNR-QGZVFWFLSA-N 1 2 312.413 4.034 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cccc3c2OC(C)(C)C3)no1 ZINC000768429024 1051929569 /nfs/dbraw/zinc/92/95/69/1051929569.db2.gz IWIHLTQVYZBKNR-QGZVFWFLSA-N 1 2 312.413 4.034 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccccc2OCC2CC2)no1 ZINC000768428997 1051930247 /nfs/dbraw/zinc/93/02/47/1051930247.db2.gz ISNQNYLTYTTXSY-GOSISDBHSA-N 1 2 312.413 4.109 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccccc2OCC2CC2)no1 ZINC000768428997 1051930256 /nfs/dbraw/zinc/93/02/56/1051930256.db2.gz ISNQNYLTYTTXSY-GOSISDBHSA-N 1 2 312.413 4.109 20 0 DIADLO Cc1cc(Oc2ccc(Nc3ccccc3C(N)=O)cc2)cc[nH+]1 ZINC001173981065 1051939577 /nfs/dbraw/zinc/93/95/77/1051939577.db2.gz GUGVQPHPBMIAAV-UHFFFAOYSA-N 1 2 319.364 4.025 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2ccn(-c3ccccc3)n2)s1 ZINC000768918901 1051981862 /nfs/dbraw/zinc/98/18/62/1051981862.db2.gz NJYIVSZYWOIWNA-UHFFFAOYSA-N 1 2 311.454 4.128 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2ccn(-c3ccccc3)n2)s1 ZINC000768918901 1051981873 /nfs/dbraw/zinc/98/18/73/1051981873.db2.gz NJYIVSZYWOIWNA-UHFFFAOYSA-N 1 2 311.454 4.128 20 0 DIADLO FC(F)(F)CC[N@@H+](Cc1cncs1)Cc1ccccc1 ZINC000191782730 1051986285 /nfs/dbraw/zinc/98/62/85/1051986285.db2.gz MXDKPYDBJXNXGD-UHFFFAOYSA-N 1 2 300.349 4.098 20 0 DIADLO FC(F)(F)CC[N@H+](Cc1cncs1)Cc1ccccc1 ZINC000191782730 1051986275 /nfs/dbraw/zinc/98/62/75/1051986275.db2.gz MXDKPYDBJXNXGD-UHFFFAOYSA-N 1 2 300.349 4.098 20 0 DIADLO Cc1cc(C)c(Nc2ccc(C(=O)N3CCCCC3)cc2)c[nH+]1 ZINC001174073003 1051993581 /nfs/dbraw/zinc/99/35/81/1051993581.db2.gz NKSXDOKZUOGPOB-UHFFFAOYSA-N 1 2 309.413 4.068 20 0 DIADLO CCc1cccc(Nc2ccc(C(=O)NC3CCCCC3)cc2)[nH+]1 ZINC001174082886 1051998502 /nfs/dbraw/zinc/99/85/02/1051998502.db2.gz WOCDLNOGONBSOR-UHFFFAOYSA-N 1 2 323.440 4.450 20 0 DIADLO COc1cncc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)c1 ZINC001174088208 1051999660 /nfs/dbraw/zinc/99/96/60/1051999660.db2.gz PSMRPQFKASMXQY-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)CC1(C)CCCCC1 ZINC000192261608 1052007247 /nfs/dbraw/zinc/00/72/47/1052007247.db2.gz MKSDETXQZJXLKO-UHFFFAOYSA-N 1 2 319.493 4.045 20 0 DIADLO c1c[nH+]c(N2CCCCC2)c(Nc2cccc3cnccc32)c1 ZINC001174135423 1052012471 /nfs/dbraw/zinc/01/24/71/1052012471.db2.gz BFJLPJWZEWPRQX-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO c1cn(Cc2cccc(Nc3cccc4cnccc43)c2)c[nH+]1 ZINC001174137097 1052013206 /nfs/dbraw/zinc/01/32/06/1052013206.db2.gz OTJKMPVAGSGUJH-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO COc1ccc(Nc2ccc[nH+]c2N2CCCCC2)cc1Cl ZINC001174151816 1052021098 /nfs/dbraw/zinc/02/10/98/1052021098.db2.gz LCULCNPXQIXAFD-UHFFFAOYSA-N 1 2 317.820 4.478 20 0 DIADLO COc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1Cl ZINC001174151832 1052021349 /nfs/dbraw/zinc/02/13/49/1052021349.db2.gz LYKMIEKIWBOIFY-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO CCc1cccc(Nc2ccc(C(=O)N3CCC(C)CC3)cc2)[nH+]1 ZINC001174159018 1052024075 /nfs/dbraw/zinc/02/40/75/1052024075.db2.gz BDPKNARGXHZMPX-UHFFFAOYSA-N 1 2 323.440 4.260 20 0 DIADLO COc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1Cl ZINC001174154654 1052024326 /nfs/dbraw/zinc/02/43/26/1052024326.db2.gz IPXMOLQQQIHKNC-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO Cc1cccc(Nc2cccc(C(=O)NCc3ccccc3)c2)[nH+]1 ZINC001174181277 1052035774 /nfs/dbraw/zinc/03/57/74/1052035774.db2.gz GGRFZHXJEGTRTD-UHFFFAOYSA-N 1 2 317.392 4.064 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(F)cc2Cl)cnc1Cl ZINC000769380358 1052037598 /nfs/dbraw/zinc/03/75/98/1052037598.db2.gz HVFAMJWNAIZKFQ-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(F)cc2Cl)cnc1Cl ZINC000769380358 1052037604 /nfs/dbraw/zinc/03/76/04/1052037604.db2.gz HVFAMJWNAIZKFQ-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Brc1ccoc1C[N@@H+]1CCCc2sccc2C1 ZINC000769382248 1052037825 /nfs/dbraw/zinc/03/78/25/1052037825.db2.gz TXVPDAPKGOVTNO-UHFFFAOYSA-N 1 2 312.232 4.052 20 0 DIADLO Brc1ccoc1C[N@H+]1CCCc2sccc2C1 ZINC000769382248 1052037835 /nfs/dbraw/zinc/03/78/35/1052037835.db2.gz TXVPDAPKGOVTNO-UHFFFAOYSA-N 1 2 312.232 4.052 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cccc(C(=O)NC(C)C)c3)ccc12 ZINC001174187791 1052038873 /nfs/dbraw/zinc/03/88/73/1052038873.db2.gz LVSKMOCVMRBPEU-UHFFFAOYSA-N 1 2 319.408 4.425 20 0 DIADLO CCCc1cc[nH+]c(Nc2cccc(C(=O)NCC(C)C)c2)c1 ZINC001174192331 1052041770 /nfs/dbraw/zinc/04/17/70/1052041770.db2.gz DKABDYWSAMNHHW-UHFFFAOYSA-N 1 2 311.429 4.164 20 0 DIADLO Cc1cc[nH+]c(Nc2cccc(C(=O)Nc3ccccc3)c2)c1 ZINC001174204292 1052048158 /nfs/dbraw/zinc/04/81/58/1052048158.db2.gz DVQIQSXABUSRSN-UHFFFAOYSA-N 1 2 303.365 4.386 20 0 DIADLO CC(=O)NCc1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1 ZINC001174231385 1052064328 /nfs/dbraw/zinc/06/43/28/1052064328.db2.gz DGLZBNOGKVXWHA-UHFFFAOYSA-N 1 2 323.440 4.057 20 0 DIADLO Fc1ccc(F)c2c1CC[N@H+](Cc1cncc3ccccc31)C2 ZINC000769528169 1052074312 /nfs/dbraw/zinc/07/43/12/1052074312.db2.gz OTZWXXCXDKTPHM-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1ccc(F)c2c1CC[N@@H+](Cc1cncc3ccccc31)C2 ZINC000769528169 1052074320 /nfs/dbraw/zinc/07/43/20/1052074320.db2.gz OTZWXXCXDKTPHM-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](COC)c2ccc(Cl)cc2)cs1 ZINC000194037220 1052091740 /nfs/dbraw/zinc/09/17/40/1052091740.db2.gz AZGDGAIXVBBPSB-FZMZJTMJSA-N 1 2 324.877 4.397 20 0 DIADLO COc1ccc2c(c1)OCC[N@@H+](Cc1cccc(C(F)F)c1)C2 ZINC000670098386 1052103892 /nfs/dbraw/zinc/10/38/92/1052103892.db2.gz ZJEKMGAOBCYDST-UHFFFAOYSA-N 1 2 319.351 4.027 20 0 DIADLO COc1ccc2c(c1)OCC[N@H+](Cc1cccc(C(F)F)c1)C2 ZINC000670098386 1052103898 /nfs/dbraw/zinc/10/38/98/1052103898.db2.gz ZJEKMGAOBCYDST-UHFFFAOYSA-N 1 2 319.351 4.027 20 0 DIADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1cc(C(CC)CC)no1 ZINC000769874256 1052124085 /nfs/dbraw/zinc/12/40/85/1052124085.db2.gz JRFXEAKKUNBASI-LLVKDONJSA-N 1 2 305.422 4.288 20 0 DIADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000769876981 1052125805 /nfs/dbraw/zinc/12/58/05/1052125805.db2.gz SJJNQBLUGPEMDW-GFCCVEGCSA-N 1 2 311.385 4.051 20 0 DIADLO FC(F)(F)c1cc(Nc2ccccc2-n2cc[nH+]c2)ccn1 ZINC001174361555 1052127920 /nfs/dbraw/zinc/12/79/20/1052127920.db2.gz PKCYQTRDQOFKPZ-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO CCOc1ccccc1C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000194888417 1052135844 /nfs/dbraw/zinc/13/58/44/1052135844.db2.gz VZOYAYQAUWJURO-NRFANRHFSA-N 1 2 318.420 4.360 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4[nH]c(=O)oc4c3)ccc21 ZINC001174381146 1052139120 /nfs/dbraw/zinc/13/91/20/1052139120.db2.gz HOJHVQCVURLLBH-UHFFFAOYSA-N 1 2 308.341 4.208 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(cc[nH]c4=O)c3)ccc21 ZINC001174381871 1052140310 /nfs/dbraw/zinc/14/03/10/1052140310.db2.gz VIFCILZIXXUOLB-UHFFFAOYSA-N 1 2 318.380 4.202 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc(-c4nnco4)cc3)ccc21 ZINC001174381569 1052140479 /nfs/dbraw/zinc/14/04/79/1052140479.db2.gz NMKJNWGXCIGQCZ-UHFFFAOYSA-N 1 2 319.368 4.411 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cn(C)nc3C(F)(F)F)ccc21 ZINC001174381862 1052141340 /nfs/dbraw/zinc/14/13/40/1052141340.db2.gz REGAIGQFGMTPNL-UHFFFAOYSA-N 1 2 323.322 4.113 20 0 DIADLO CCNC(=O)c1ccccc1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174381723 1052141487 /nfs/dbraw/zinc/14/14/87/1052141487.db2.gz QGYDFEUYRZZEDO-UHFFFAOYSA-N 1 2 322.412 4.111 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)[C@@H](C)c1ccccc1Br ZINC000194975911 1052141615 /nfs/dbraw/zinc/14/16/15/1052141615.db2.gz GUOILHZRZWTXTH-NSHDSACASA-N 1 2 323.234 4.247 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)[C@@H](C)c1ccccc1Br ZINC000194975911 1052141622 /nfs/dbraw/zinc/14/16/22/1052141622.db2.gz GUOILHZRZWTXTH-NSHDSACASA-N 1 2 323.234 4.247 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccnn3CC3CCC3)ccc21 ZINC001174382165 1052141505 /nfs/dbraw/zinc/14/15/05/1052141505.db2.gz BSADNIGPVSKHEQ-UHFFFAOYSA-N 1 2 309.417 4.357 20 0 DIADLO COC(=O)c1ccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)s1 ZINC001174381417 1052141546 /nfs/dbraw/zinc/14/15/46/1052141546.db2.gz ZXNQKVKZVZYCTN-UHFFFAOYSA-N 1 2 315.398 4.209 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cncc(N4CCCC4)c3)ccc21 ZINC001174382433 1052142677 /nfs/dbraw/zinc/14/26/77/1052142677.db2.gz PNASCXJYTLSGDL-UHFFFAOYSA-N 1 2 321.428 4.356 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc(OC4COC4)cc3)ccc21 ZINC001174383673 1052142805 /nfs/dbraw/zinc/14/28/05/1052142805.db2.gz RBAXWPSZZRZXNL-UHFFFAOYSA-N 1 2 323.396 4.138 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4c3C(=O)CC4)ccc21 ZINC001174382713 1052143003 /nfs/dbraw/zinc/14/30/03/1052143003.db2.gz CLRKIKUGMMYUOE-UHFFFAOYSA-N 1 2 305.381 4.490 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccccc3OC3COC3)ccc21 ZINC001174383309 1052143394 /nfs/dbraw/zinc/14/33/94/1052143394.db2.gz NUJQOESZRROQEP-UHFFFAOYSA-N 1 2 323.396 4.138 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4c3NC(=O)CC4)ccc21 ZINC001174386026 1052144658 /nfs/dbraw/zinc/14/46/58/1052144658.db2.gz XZCNLRWNBWXKMA-UHFFFAOYSA-N 1 2 320.396 4.246 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3c(CO)ccc(F)c3F)ccc21 ZINC001174385388 1052145270 /nfs/dbraw/zinc/14/52/70/1052145270.db2.gz QEDXNFSFPGTRRU-UHFFFAOYSA-N 1 2 317.339 4.131 20 0 DIADLO CC(C)(C)OC(=O)c1ccc(Nc2cc[nH+]c3[nH]ccc32)cc1 ZINC001174411054 1052164501 /nfs/dbraw/zinc/16/45/01/1052164501.db2.gz GMCGSJBPKKQHQX-UHFFFAOYSA-N 1 2 309.369 4.213 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(-c2ccccc2F)oc1=S ZINC000914567220 1052169665 /nfs/dbraw/zinc/16/96/65/1052169665.db2.gz JWTNEODUOJBFTI-UHFFFAOYSA-N 1 2 309.410 4.091 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(-c2ccccc2F)oc1=S ZINC000914567220 1052169669 /nfs/dbraw/zinc/16/96/69/1052169669.db2.gz JWTNEODUOJBFTI-UHFFFAOYSA-N 1 2 309.410 4.091 20 0 DIADLO CCn1c(-c2ccco2)nn(C[N@H+](C)[C@H](C)C(C)(C)C)c1=S ZINC000914568945 1052170381 /nfs/dbraw/zinc/17/03/81/1052170381.db2.gz PUNOFMOGMQWVKW-GFCCVEGCSA-N 1 2 322.478 4.018 20 0 DIADLO CCn1c(-c2ccco2)nn(C[N@@H+](C)[C@H](C)C(C)(C)C)c1=S ZINC000914568945 1052170387 /nfs/dbraw/zinc/17/03/87/1052170387.db2.gz PUNOFMOGMQWVKW-GFCCVEGCSA-N 1 2 322.478 4.018 20 0 DIADLO c1c[nH+]c(N2CCCCC2)c(Nc2cccc(N3CCCC3)c2)c1 ZINC001174486181 1052171601 /nfs/dbraw/zinc/17/16/01/1052171601.db2.gz AKDVWNMUQVSVAZ-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO C[C@H]1C[N@H+](Cc2sccc2Cl)C[C@H](c2ccccc2)O1 ZINC000494948137 1052177629 /nfs/dbraw/zinc/17/76/29/1052177629.db2.gz LAIVIKYAKRALHV-SWLSCSKDSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2sccc2Cl)C[C@H](c2ccccc2)O1 ZINC000494948137 1052177632 /nfs/dbraw/zinc/17/76/32/1052177632.db2.gz LAIVIKYAKRALHV-SWLSCSKDSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Cl)cs2)C[C@@H](c2ccccc2)O1 ZINC000494955562 1052182239 /nfs/dbraw/zinc/18/22/39/1052182239.db2.gz SQLXMZMZEKYKBZ-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Cl)cs2)C[C@@H](c2ccccc2)O1 ZINC000494955562 1052182241 /nfs/dbraw/zinc/18/22/41/1052182241.db2.gz SQLXMZMZEKYKBZ-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H](CC[NH2+][C@H](c1ncn[nH]1)C1CCCCC1)c1ccccc1 ZINC000494983402 1052188967 /nfs/dbraw/zinc/18/89/67/1052188967.db2.gz YDJXRMKYPZYVGD-QAPCUYQASA-N 1 2 312.461 4.210 20 0 DIADLO Clc1csc(C[N@@H+]2CCO[C@]3(CCc4ccccc43)C2)c1 ZINC000494987205 1052190539 /nfs/dbraw/zinc/19/05/39/1052190539.db2.gz SRMPNGGVLCGJSO-QGZVFWFLSA-N 1 2 319.857 4.075 20 0 DIADLO Clc1csc(C[N@H+]2CCO[C@]3(CCc4ccccc43)C2)c1 ZINC000494987205 1052190541 /nfs/dbraw/zinc/19/05/41/1052190541.db2.gz SRMPNGGVLCGJSO-QGZVFWFLSA-N 1 2 319.857 4.075 20 0 DIADLO CC(C)C1CCC([NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)CC1 ZINC000495049648 1052202617 /nfs/dbraw/zinc/20/26/17/1052202617.db2.gz RWFISESEPZKJOR-BDVYOWHSSA-N 1 2 304.482 4.231 20 0 DIADLO Nc1[nH+]cccc1O[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC001218191408 1052205970 /nfs/dbraw/zinc/20/59/70/1052205970.db2.gz AMQDMJHOOCOXSU-KRWDZBQOSA-N 1 2 310.784 4.486 20 0 DIADLO CCc1ccccc1NC(=O)C[N@H+](C)Cc1cc(Cl)cs1 ZINC000495070790 1052207743 /nfs/dbraw/zinc/20/77/43/1052207743.db2.gz WIJHHQICOOOZMM-UHFFFAOYSA-N 1 2 322.861 4.034 20 0 DIADLO CCc1ccccc1NC(=O)C[N@@H+](C)Cc1cc(Cl)cs1 ZINC000495070790 1052207750 /nfs/dbraw/zinc/20/77/50/1052207750.db2.gz WIJHHQICOOOZMM-UHFFFAOYSA-N 1 2 322.861 4.034 20 0 DIADLO CCCC(C)(C)CC(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000495116951 1052226782 /nfs/dbraw/zinc/22/67/82/1052226782.db2.gz IVWAQFCTONNOOA-UHFFFAOYSA-N 1 2 323.506 4.284 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@@H](C)Cc2cccs2)c(C)[nH+]1 ZINC001219009599 1052267542 /nfs/dbraw/zinc/26/75/42/1052267542.db2.gz GSUKBXWQDJFSDL-ZDUSSCGKSA-N 1 2 317.458 4.163 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1nnc2n1CCCCC2)c1csc(Cl)c1 ZINC000230407783 1052267679 /nfs/dbraw/zinc/26/76/79/1052267679.db2.gz IEWAQKRLQKQDEU-GHMZBOCLSA-N 1 2 324.881 4.131 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@]2(C)CCCc3ccccc32)c(C)[nH+]1 ZINC001219009462 1052268163 /nfs/dbraw/zinc/26/81/63/1052268163.db2.gz ALELLNUXDLUZOH-HXUWFJFHSA-N 1 2 323.440 4.380 20 0 DIADLO CC(C)(C)[C@H]1CCCC[C@@H]1NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001219556650 1052293008 /nfs/dbraw/zinc/29/30/08/1052293008.db2.gz AEWMLFLXXVFWMH-GJZGRUSLSA-N 1 2 314.433 4.061 20 0 DIADLO CCc1nc(C[N@@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)cs1 ZINC000303703983 1052338704 /nfs/dbraw/zinc/33/87/04/1052338704.db2.gz OOIKPNXSJPRDCR-SUMWQHHRSA-N 1 2 318.511 4.384 20 0 DIADLO CCc1nc(C[N@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)cs1 ZINC000303703983 1052338708 /nfs/dbraw/zinc/33/87/08/1052338708.db2.gz OOIKPNXSJPRDCR-SUMWQHHRSA-N 1 2 318.511 4.384 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2nc(CC(C)C)no2)o1 ZINC000303746255 1052341543 /nfs/dbraw/zinc/34/15/43/1052341543.db2.gz KBSAOHRWJSWWDZ-OAHLLOKOSA-N 1 2 317.433 4.287 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2nc(CC(C)C)no2)o1 ZINC000303746255 1052341550 /nfs/dbraw/zinc/34/15/50/1052341550.db2.gz KBSAOHRWJSWWDZ-OAHLLOKOSA-N 1 2 317.433 4.287 20 0 DIADLO CCn1c(-c2cccs2)nn(C[N@H+](C)[C@@H](C)C(C)C)c1=S ZINC000915208825 1052367736 /nfs/dbraw/zinc/36/77/36/1052367736.db2.gz HYRXOFFFEKLUAG-LBPRGKRZSA-N 1 2 324.519 4.096 20 0 DIADLO CCn1c(-c2cccs2)nn(C[N@@H+](C)[C@@H](C)C(C)C)c1=S ZINC000915208825 1052367744 /nfs/dbraw/zinc/36/77/44/1052367744.db2.gz HYRXOFFFEKLUAG-LBPRGKRZSA-N 1 2 324.519 4.096 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](C)c2csc3ccccc23)n1 ZINC000754738284 1052383266 /nfs/dbraw/zinc/38/32/66/1052383266.db2.gz ZYERSIRJZGSLRP-NSHDSACASA-N 1 2 301.415 4.259 20 0 DIADLO C[C@H](SCc1cc[nH+]c(N(C)C)c1)c1c(F)cccc1F ZINC000762475993 1052388464 /nfs/dbraw/zinc/38/84/64/1052388464.db2.gz WUOPJVLIJOOJHV-NSHDSACASA-N 1 2 308.397 4.420 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)N1CCCC[C@H]1c1ccccc1 ZINC000762852877 1052425638 /nfs/dbraw/zinc/42/56/38/1052425638.db2.gz LOFJZSHGFQJNBH-KRWDZBQOSA-N 1 2 320.396 4.093 20 0 DIADLO CCOc1ccc(-c2c[nH+]c(N3CCCCC3)cc2C)c(C)n1 ZINC001222106829 1052442295 /nfs/dbraw/zinc/44/22/95/1052442295.db2.gz RZSKAVRVHNVYAY-UHFFFAOYSA-N 1 2 311.429 4.149 20 0 DIADLO Cc1[nH+]cc(CNc2ccc3c(c2)CCC3)n1-c1ccccc1 ZINC000237871023 1052446028 /nfs/dbraw/zinc/44/60/28/1052446028.db2.gz LNWIDOYKVAAUFF-UHFFFAOYSA-N 1 2 303.409 4.282 20 0 DIADLO C[C@@H](OCCn1cc[nH+]c1)c1cc2cccc(F)c2nc1Cl ZINC001222134615 1052448778 /nfs/dbraw/zinc/44/87/78/1052448778.db2.gz HRRZWXVUNCACGB-LLVKDONJSA-N 1 2 319.767 4.002 20 0 DIADLO c1cn(CCO[C@H]2CCN(c3ccccc3)c3ccccc32)c[nH+]1 ZINC001222138959 1052449597 /nfs/dbraw/zinc/44/95/97/1052449597.db2.gz MMXYXRMKOIQXQS-FQEVSTJZSA-N 1 2 319.408 4.183 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C(F)=C3CCCC3)c2)[nH+]c1C ZINC000763029068 1052492679 /nfs/dbraw/zinc/49/26/79/1052492679.db2.gz KJJFCTSFIXJFGP-UHFFFAOYSA-N 1 2 313.376 4.430 20 0 DIADLO Cn1cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c(-c2ccccc2)n1 ZINC001222554377 1052512450 /nfs/dbraw/zinc/51/24/50/1052512450.db2.gz IRYTVJHVHBWGLJ-UHFFFAOYSA-N 1 2 318.355 4.079 20 0 DIADLO Cn1c[nH+]cc1COC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC001222595063 1052515868 /nfs/dbraw/zinc/51/58/68/1052515868.db2.gz NEJLYLQSYJIMIX-UHFFFAOYSA-N 1 2 314.335 4.005 20 0 DIADLO Cn1c[nH+]c2ccc(NCc3ccc(F)c(Cl)c3F)cc21 ZINC001168506331 1052546413 /nfs/dbraw/zinc/54/64/13/1052546413.db2.gz SCUGQBZAGOMCQN-UHFFFAOYSA-N 1 2 307.731 4.117 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@H+](Cc2nc3c(s2)CCCC3)C1 ZINC000670272140 1052548707 /nfs/dbraw/zinc/54/87/07/1052548707.db2.gz MGDGLOBXVGKXHT-SFHVURJKSA-N 1 2 316.445 4.093 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@@H+](Cc2nc3c(s2)CCCC3)C1 ZINC000670272140 1052548715 /nfs/dbraw/zinc/54/87/15/1052548715.db2.gz MGDGLOBXVGKXHT-SFHVURJKSA-N 1 2 316.445 4.093 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000528792965 1052587372 /nfs/dbraw/zinc/58/73/72/1052587372.db2.gz ISQHJUBKBINNMB-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000528792965 1052587378 /nfs/dbraw/zinc/58/73/78/1052587378.db2.gz ISQHJUBKBINNMB-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H](c1nc2ccccc2c(=O)[nH]1)[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000916152347 1052594598 /nfs/dbraw/zinc/59/45/98/1052594598.db2.gz PQUKVFQMJMKOIT-UONOGXRCSA-N 1 2 319.408 4.016 20 0 DIADLO C[C@H](c1nc2ccccc2c(=O)[nH]1)[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000916152347 1052594604 /nfs/dbraw/zinc/59/46/04/1052594604.db2.gz PQUKVFQMJMKOIT-UONOGXRCSA-N 1 2 319.408 4.016 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1c(F)cccc1Cl ZINC000037089944 1052596715 /nfs/dbraw/zinc/59/67/15/1052596715.db2.gz KAFKYHGGMOQTTD-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1c(F)cccc1Cl ZINC000037089943 1052596910 /nfs/dbraw/zinc/59/69/10/1052596910.db2.gz KAFKYHGGMOQTTD-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO Cc1ccc(C)c(OC(=O)c2cccc(Cn3cc[nH+]c3)c2)c1C ZINC000916298616 1052602449 /nfs/dbraw/zinc/60/24/49/1052602449.db2.gz IONQZYHGQHDQIC-UHFFFAOYSA-N 1 2 320.392 4.076 20 0 DIADLO CC[C@@H](C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(F)cc1 ZINC000124231885 1052638357 /nfs/dbraw/zinc/63/83/57/1052638357.db2.gz BJUKPBYKQNHRSJ-QGZVFWFLSA-N 1 2 323.371 4.348 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1csc(C2CCCC2)n1 ZINC000063993295 1052644975 /nfs/dbraw/zinc/64/49/75/1052644975.db2.gz VTVXGKSBMXKQLQ-QGZVFWFLSA-N 1 2 315.486 4.476 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1csc(C2CCCC2)n1 ZINC000063993295 1052644979 /nfs/dbraw/zinc/64/49/79/1052644979.db2.gz VTVXGKSBMXKQLQ-QGZVFWFLSA-N 1 2 315.486 4.476 20 0 DIADLO CC[C@H](C)[C@H]([NH2+]C[C@H]1CCCCC1(F)F)C(=O)OC(C)(C)C ZINC001168519201 1052648509 /nfs/dbraw/zinc/64/85/09/1052648509.db2.gz IYJADWFEYQBBRZ-MJBXVCDLSA-N 1 2 319.436 4.158 20 0 DIADLO COc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2F)c(Cl)c1 ZINC000916839965 1052659314 /nfs/dbraw/zinc/65/93/14/1052659314.db2.gz SQFLYPCQLLFTJM-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO Cc1cc(F)ccc1-c1ccc(C[NH2+]Cc2ncccc2F)o1 ZINC000126159012 1052667022 /nfs/dbraw/zinc/66/70/22/1052667022.db2.gz PDSDCCTWCYVHCG-UHFFFAOYSA-N 1 2 314.335 4.218 20 0 DIADLO Cc1ccc(Cl)cc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000126170300 1052667279 /nfs/dbraw/zinc/66/72/79/1052667279.db2.gz IWGXWSKMUUIRNI-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@H](c2cccc(O)c2)C1 ZINC000127111465 1052688112 /nfs/dbraw/zinc/68/81/12/1052688112.db2.gz XRCLBIWTRNAGBI-UGSOOPFHSA-N 1 2 317.816 4.180 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCO[C@H](c2cccc(O)c2)C1 ZINC000127111465 1052688116 /nfs/dbraw/zinc/68/81/16/1052688116.db2.gz XRCLBIWTRNAGBI-UGSOOPFHSA-N 1 2 317.816 4.180 20 0 DIADLO Cn1c(Cl)cnc1C[N@@H+]1CCCCC[C@@H]1c1ccccc1 ZINC000917064874 1052689276 /nfs/dbraw/zinc/68/92/76/1052689276.db2.gz PLTZASDGKFLYOI-OAHLLOKOSA-N 1 2 303.837 4.191 20 0 DIADLO Cn1c(Cl)cnc1C[N@H+]1CCCCC[C@@H]1c1ccccc1 ZINC000917064874 1052689277 /nfs/dbraw/zinc/68/92/77/1052689277.db2.gz PLTZASDGKFLYOI-OAHLLOKOSA-N 1 2 303.837 4.191 20 0 DIADLO CC(C)Oc1cc(F)c(F)cc1Nc1cccn2cc[nH+]c12 ZINC001212222049 1052696129 /nfs/dbraw/zinc/69/61/29/1052696129.db2.gz GAWMWHURBDTCHK-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1cc(F)ccc1Br ZINC000127550747 1052698844 /nfs/dbraw/zinc/69/88/44/1052698844.db2.gz UNXPMIFUTRJDEY-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1cc(F)ccc1Br ZINC000127550747 1052698849 /nfs/dbraw/zinc/69/88/49/1052698849.db2.gz UNXPMIFUTRJDEY-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000127630714 1052700472 /nfs/dbraw/zinc/70/04/72/1052700472.db2.gz NITSEMNJXPLZMV-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000127630714 1052700475 /nfs/dbraw/zinc/70/04/75/1052700475.db2.gz NITSEMNJXPLZMV-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000128001934 1052706444 /nfs/dbraw/zinc/70/64/44/1052706444.db2.gz CIUTWYWEEWIHEP-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000128001934 1052706448 /nfs/dbraw/zinc/70/64/48/1052706448.db2.gz CIUTWYWEEWIHEP-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO CC(C)c1noc(C[N@H+](C2CC2)[C@@H]2CCCc3ccccc32)n1 ZINC000067712261 1052709843 /nfs/dbraw/zinc/70/98/43/1052709843.db2.gz MPWYFFNMOLQULI-QGZVFWFLSA-N 1 2 311.429 4.235 20 0 DIADLO CC(C)c1noc(C[N@@H+](C2CC2)[C@@H]2CCCc3ccccc32)n1 ZINC000067712261 1052709847 /nfs/dbraw/zinc/70/98/47/1052709847.db2.gz MPWYFFNMOLQULI-QGZVFWFLSA-N 1 2 311.429 4.235 20 0 DIADLO CCCC[NH+](CCCC)Cn1nnc2ccccc2c1=S ZINC000917431342 1052728310 /nfs/dbraw/zinc/72/83/10/1052728310.db2.gz QLNKGEKOAGXOTI-UHFFFAOYSA-N 1 2 304.463 4.020 20 0 DIADLO S=c1oc2ccc(Cl)cc2n1C[N@@H+]1CCCSCC1 ZINC000917464118 1052730887 /nfs/dbraw/zinc/73/08/87/1052730887.db2.gz CZMSTMLIWIEERN-UHFFFAOYSA-N 1 2 314.863 4.014 20 0 DIADLO S=c1oc2ccc(Cl)cc2n1C[N@H+]1CCCSCC1 ZINC000917464118 1052730892 /nfs/dbraw/zinc/73/08/92/1052730892.db2.gz CZMSTMLIWIEERN-UHFFFAOYSA-N 1 2 314.863 4.014 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@@H]([C@H]3CCCC3(C)C)C2)c(C)[nH+]1 ZINC001277024928 1052755976 /nfs/dbraw/zinc/75/59/76/1052755976.db2.gz VJPRFCNNWNBYPO-IAGOWNOFSA-N 1 2 314.473 4.295 20 0 DIADLO CC(C)Oc1cc(COc2cc[nH+]cc2)cc(OC(C)C)c1 ZINC001225295618 1052769464 /nfs/dbraw/zinc/76/94/64/1052769464.db2.gz MNWOPKBPLZMJCR-UHFFFAOYSA-N 1 2 301.386 4.235 20 0 DIADLO CC(C)c1cccc(NC(=O)C[N@H+](C)[C@@H](C)c2ccco2)c1 ZINC000069067540 1052779177 /nfs/dbraw/zinc/77/91/77/1052779177.db2.gz NMYHGYGUQGBBOF-AWEZNQCLSA-N 1 2 300.402 4.035 20 0 DIADLO CC(C)c1cccc(NC(=O)C[N@@H+](C)[C@@H](C)c2ccco2)c1 ZINC000069067540 1052779182 /nfs/dbraw/zinc/77/91/82/1052779182.db2.gz NMYHGYGUQGBBOF-AWEZNQCLSA-N 1 2 300.402 4.035 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccnc(Cl)c1 ZINC000154810866 1052831959 /nfs/dbraw/zinc/83/19/59/1052831959.db2.gz OYRORQABRKLCDS-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO CCCCCC[C@H](C)CC(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001127451820 1052840650 /nfs/dbraw/zinc/84/06/50/1052840650.db2.gz GGMHCRJCXXAPFU-AWEZNQCLSA-N 1 2 305.466 4.391 20 0 DIADLO CC[C@@H]1CCC[C@@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000556418224 1052850692 /nfs/dbraw/zinc/85/06/92/1052850692.db2.gz ZQJHYQQFIZRNDZ-WBVHZDCISA-N 1 2 322.412 4.275 20 0 DIADLO CC[C@H]1CCC[C@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000556418221 1052851057 /nfs/dbraw/zinc/85/10/57/1052851057.db2.gz ZQJHYQQFIZRNDZ-DOTOQJQBSA-N 1 2 322.412 4.275 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)[C@@H]2C[C@@H]2c2ccccc2)cs1 ZINC000411288954 1052882262 /nfs/dbraw/zinc/88/22/62/1052882262.db2.gz DFWPNCRVOOWQJV-IAOVAPTHSA-N 1 2 316.470 4.229 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)[C@@H]2C[C@@H]2c2ccccc2)cs1 ZINC000411288954 1052882267 /nfs/dbraw/zinc/88/22/67/1052882267.db2.gz DFWPNCRVOOWQJV-IAOVAPTHSA-N 1 2 316.470 4.229 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+](C)Cc1ccc(F)cc1C ZINC000556833917 1052887265 /nfs/dbraw/zinc/88/72/65/1052887265.db2.gz CBTMVGQZJMTHJI-UHFFFAOYSA-N 1 2 311.404 4.136 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+](C)Cc1ccc(F)cc1C ZINC000556833917 1052887268 /nfs/dbraw/zinc/88/72/68/1052887268.db2.gz CBTMVGQZJMTHJI-UHFFFAOYSA-N 1 2 311.404 4.136 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1nc2ccccc2o1 ZINC000556980361 1052907887 /nfs/dbraw/zinc/90/78/87/1052907887.db2.gz DOELSERPUXVZMF-STQMWFEESA-N 1 2 310.372 4.475 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1nc2ccccc2o1 ZINC000556980361 1052907890 /nfs/dbraw/zinc/90/78/90/1052907890.db2.gz DOELSERPUXVZMF-STQMWFEESA-N 1 2 310.372 4.475 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2cc(Cl)ccc21)c1nc(C(C)(C)C)no1 ZINC000920060747 1052913583 /nfs/dbraw/zinc/91/35/83/1052913583.db2.gz TZWPIFTULNSXFR-QMTHXVAHSA-N 1 2 319.836 4.359 20 0 DIADLO CC(C)[C@H]1CCC[N@@H+]1Cn1nc(-c2cccs2)oc1=S ZINC000920486161 1052942444 /nfs/dbraw/zinc/94/24/44/1052942444.db2.gz ZEEDBZSHUPDPAD-LLVKDONJSA-N 1 2 309.460 4.012 20 0 DIADLO CC(C)[C@H]1CCC[N@H+]1Cn1nc(-c2cccs2)oc1=S ZINC000920486161 1052942448 /nfs/dbraw/zinc/94/24/48/1052942448.db2.gz ZEEDBZSHUPDPAD-LLVKDONJSA-N 1 2 309.460 4.012 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccc(OC)cc1 ZINC000921488138 1052972904 /nfs/dbraw/zinc/97/29/04/1052972904.db2.gz JLNHFSAESKJPKJ-OAHLLOKOSA-N 1 2 302.418 4.222 20 0 DIADLO Cc1cc[nH+]c(C)c1O[C@@H]1Cc2ccc(Br)cc2C1 ZINC001227258945 1052976979 /nfs/dbraw/zinc/97/69/79/1052976979.db2.gz BVHQSNOZGNBFTH-OAHLLOKOSA-N 1 2 318.214 4.007 20 0 DIADLO Cc1cc[nH+]c(C)c1O[C@H](C)c1ncc(C(F)(F)F)cc1F ZINC001227264138 1052977214 /nfs/dbraw/zinc/97/72/14/1052977214.db2.gz JNIIAISRBRCGAO-SNVBAGLBSA-N 1 2 314.282 4.391 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C)c2ccc(Cl)s2)c(C)[nH+]1 ZINC001127559065 1052980472 /nfs/dbraw/zinc/98/04/72/1052980472.db2.gz PRNIMMNPWNOVOG-JTQLQIEISA-N 1 2 308.834 4.213 20 0 DIADLO Cc1cccc(C[N@@H+]2CCO[C@H](c3ccccc3Cl)C2)c1 ZINC000078440885 1052984374 /nfs/dbraw/zinc/98/43/74/1052984374.db2.gz YKFUYRXSHPQDEW-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1cccc(C[N@H+]2CCO[C@H](c3ccccc3Cl)C2)c1 ZINC000078440885 1052984377 /nfs/dbraw/zinc/98/43/77/1052984377.db2.gz YKFUYRXSHPQDEW-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO COc1cc2c(cc1O[C@H]1CCc3c1cccc3C)C=[NH+]CC2 ZINC001228087538 1053042784 /nfs/dbraw/zinc/04/27/84/1053042784.db2.gz MMUGADCIPMHKOM-SFHVURJKSA-N 1 2 307.393 4.045 20 0 DIADLO CC[C@@H](C)Oc1cccc(C(=O)C[N@H+](C)Cc2ccccc2)c1 ZINC001228104324 1053044676 /nfs/dbraw/zinc/04/46/76/1053044676.db2.gz OVKMQXUGZCTGSW-MRXNPFEDSA-N 1 2 311.425 4.179 20 0 DIADLO CC[C@@H](C)Oc1cccc(C(=O)C[N@@H+](C)Cc2ccccc2)c1 ZINC001228104324 1053044677 /nfs/dbraw/zinc/04/46/77/1053044677.db2.gz OVKMQXUGZCTGSW-MRXNPFEDSA-N 1 2 311.425 4.179 20 0 DIADLO CCC(C)(C)OC1C[NH+](Cc2ccc(C(F)(F)F)c(C)c2)C1 ZINC001474629673 1053088836 /nfs/dbraw/zinc/08/88/36/1053088836.db2.gz ABUCTVUWLFBBPS-UHFFFAOYSA-N 1 2 315.379 4.403 20 0 DIADLO CC(C)c1cc(N[C@H]2CCO[C@@H](C(C)C)C2)nc(C(C)C)[nH+]1 ZINC000540038846 1053096252 /nfs/dbraw/zinc/09/62/52/1053096252.db2.gz PNXMKTNGZVGZRB-GOEBONIOSA-N 1 2 305.466 4.339 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)CC(C)(C)C ZINC000617230453 1053111342 /nfs/dbraw/zinc/11/13/42/1053111342.db2.gz LCQDALIGQUNPLU-CYBMUJFWSA-N 1 2 317.408 4.412 20 0 DIADLO COc1ccc2oc(CNc3ccc([NH+](C)C)c(C)c3)cc2c1 ZINC000763485441 1053128692 /nfs/dbraw/zinc/12/86/92/1053128692.db2.gz FHMSCERXJYVUMW-UHFFFAOYSA-N 1 2 310.397 4.428 20 0 DIADLO CC[C@H](C)Sc1ccc(NC(=O)[C@@H](C)n2cc[nH+]c2)c(C)c1 ZINC001318081479 1053149001 /nfs/dbraw/zinc/14/90/01/1053149001.db2.gz GOEWVERMIODYEV-UONOGXRCSA-N 1 2 317.458 4.282 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@@H](C)c1ncccn1 ZINC001351283626 1053161401 /nfs/dbraw/zinc/16/14/01/1053161401.db2.gz NYRVBDMUKSBCJE-OCCSQVGLSA-N 1 2 324.453 4.320 20 0 DIADLO Cc1cc(N2CCO[C@H](c3cccc(F)c3)C2)[nH+]c2ccccc12 ZINC001318398303 1053166865 /nfs/dbraw/zinc/16/68/65/1053166865.db2.gz BJWFWHIIVIDDHH-IBGZPJMESA-N 1 2 322.383 4.260 20 0 DIADLO Cc1cc(NC[C@H]2CCc3ccccc3N2)[nH+]c2ccccc12 ZINC001318780910 1053191759 /nfs/dbraw/zinc/19/17/59/1053191759.db2.gz WBWNOYXYRFVPKU-MRXNPFEDSA-N 1 2 303.409 4.382 20 0 DIADLO Cc1cc(C)c(NC(=O)CC[C@H]2CCc3ccccc32)c(C)[nH+]1 ZINC001351555147 1053194175 /nfs/dbraw/zinc/19/41/75/1053194175.db2.gz OPAVOGVWZHPTKW-QGZVFWFLSA-N 1 2 308.425 4.456 20 0 DIADLO CC(C)Cc1cccc([C@H](C)C(=O)Nc2cccc3[nH+]ccn32)c1 ZINC001360225703 1053201404 /nfs/dbraw/zinc/20/14/04/1053201404.db2.gz WHIBSGJJICYPGN-HNNXBMFYSA-N 1 2 321.424 4.275 20 0 DIADLO Cc1ccccc1C1(C(=O)Nc2cccc3[nH+]ccn32)CCCC1 ZINC001360441144 1053227940 /nfs/dbraw/zinc/22/79/40/1053227940.db2.gz HNSRRMDIFZQXST-UHFFFAOYSA-N 1 2 319.408 4.093 20 0 DIADLO C[N@H+](Cc1ccn(-c2ccccc2)n1)[C@@H]1CCc2c1cccc2F ZINC001319312452 1053236091 /nfs/dbraw/zinc/23/60/91/1053236091.db2.gz NTVHADZGKRJTNT-HXUWFJFHSA-N 1 2 321.399 4.131 20 0 DIADLO C[N@@H+](Cc1ccn(-c2ccccc2)n1)[C@@H]1CCc2c1cccc2F ZINC001319312452 1053236097 /nfs/dbraw/zinc/23/60/97/1053236097.db2.gz NTVHADZGKRJTNT-HXUWFJFHSA-N 1 2 321.399 4.131 20 0 DIADLO C[C@@H](C(=O)Nc1ccc2ccccc2c1)[N@H+](C)CCC(F)(F)F ZINC001319417536 1053243101 /nfs/dbraw/zinc/24/31/01/1053243101.db2.gz ZBLCZLKXJRZCSH-LBPRGKRZSA-N 1 2 324.346 4.051 20 0 DIADLO C[C@@H](C(=O)Nc1ccc2ccccc2c1)[N@@H+](C)CCC(F)(F)F ZINC001319417536 1053243108 /nfs/dbraw/zinc/24/31/08/1053243108.db2.gz ZBLCZLKXJRZCSH-LBPRGKRZSA-N 1 2 324.346 4.051 20 0 DIADLO Cc1cc(N[C@@H]2CC[C@@H]3SCCS[C@@H]23)[nH+]c2ccccc12 ZINC001319583220 1053252974 /nfs/dbraw/zinc/25/29/74/1053252974.db2.gz IJYPSGCCDFORNO-VYDXJSESSA-N 1 2 316.495 4.335 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1C1CCC1 ZINC001352045823 1053266106 /nfs/dbraw/zinc/26/61/06/1053266106.db2.gz BWEIQYMEIDHKQD-UHFFFAOYSA-N 1 2 317.392 4.392 20 0 DIADLO Cc1cc(N2CCC[C@H](C[C@@H]3CCOC3)C2)[nH+]c2ccccc12 ZINC001319782686 1053274338 /nfs/dbraw/zinc/27/43/38/1053274338.db2.gz CXXJOOAQUHWZDG-SJORKVTESA-N 1 2 310.441 4.186 20 0 DIADLO CC(C)c1ocnc1C[NH2+][C@@H](C)c1cccc(OC(F)F)c1 ZINC001319805343 1053275367 /nfs/dbraw/zinc/27/53/67/1053275367.db2.gz KDPQSDGJJXVKDX-NSHDSACASA-N 1 2 310.344 4.250 20 0 DIADLO CC(C)c1noc(C[N@@H+]2C[C@@H]3CCCC[C@@]32c2ccccc2)n1 ZINC001319808169 1053276247 /nfs/dbraw/zinc/27/62/47/1053276247.db2.gz IYQMCLXLYRKGNS-QFBILLFUSA-N 1 2 311.429 4.094 20 0 DIADLO CC(C)c1noc(C[N@H+]2C[C@@H]3CCCC[C@@]32c2ccccc2)n1 ZINC001319808169 1053276259 /nfs/dbraw/zinc/27/62/59/1053276259.db2.gz IYQMCLXLYRKGNS-QFBILLFUSA-N 1 2 311.429 4.094 20 0 DIADLO Cc1nc(NCC[C@@H](C)c2cccc(C(F)(F)F)c2)cc[nH+]1 ZINC000470873893 1053305680 /nfs/dbraw/zinc/30/56/80/1053305680.db2.gz QQOFJYCKUDCPJW-LLVKDONJSA-N 1 2 309.335 4.410 20 0 DIADLO CN(C)c1cc(CS[C@H]2CCc3c2cccc3F)cc[nH+]1 ZINC001320400519 1053332054 /nfs/dbraw/zinc/33/20/54/1053332054.db2.gz GRACPPFEHAERKN-INIZCTEOSA-N 1 2 302.418 4.207 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@H+]1Cc1cn(C)nc1C(F)F ZINC001320464718 1053336112 /nfs/dbraw/zinc/33/61/12/1053336112.db2.gz YUQOXLHHNZWBOH-WDEREUQCSA-N 1 2 323.362 4.005 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@@H+]1Cc1cn(C)nc1C(F)F ZINC001320464718 1053336127 /nfs/dbraw/zinc/33/61/27/1053336127.db2.gz YUQOXLHHNZWBOH-WDEREUQCSA-N 1 2 323.362 4.005 20 0 DIADLO Cc1ccc(N[C@H](C)c2ncc(Br)cc2F)c(C)[nH+]1 ZINC001320470144 1053336701 /nfs/dbraw/zinc/33/67/01/1053336701.db2.gz IQCVHYAQEBRYHQ-SNVBAGLBSA-N 1 2 324.197 4.168 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H]2CCOc3c(F)cccc32)cs1 ZINC001320553992 1053343190 /nfs/dbraw/zinc/34/31/90/1053343190.db2.gz QCTMIVOSBLXTAE-CQSZACIVSA-N 1 2 306.406 4.019 20 0 DIADLO Cc1coc(C[N@@H+]2CCc3c(Br)cc(C)cc3C2)c1 ZINC001560773394 1053352445 /nfs/dbraw/zinc/35/24/45/1053352445.db2.gz YQLHMCOXDUMRFN-UHFFFAOYSA-N 1 2 320.230 4.217 20 0 DIADLO Cc1coc(C[N@H+]2CCc3c(Br)cc(C)cc3C2)c1 ZINC001560773394 1053352456 /nfs/dbraw/zinc/35/24/56/1053352456.db2.gz YQLHMCOXDUMRFN-UHFFFAOYSA-N 1 2 320.230 4.217 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@@H](c3cc4ccccc4[nH]3)C2)no1 ZINC000618750942 1053362593 /nfs/dbraw/zinc/36/25/93/1053362593.db2.gz YDNSTIOEBDQQKE-OAHLLOKOSA-N 1 2 324.428 4.054 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@@H](c3cc4ccccc4[nH]3)C2)no1 ZINC000618750942 1053362601 /nfs/dbraw/zinc/36/26/01/1053362601.db2.gz YDNSTIOEBDQQKE-OAHLLOKOSA-N 1 2 324.428 4.054 20 0 DIADLO Cc1cc(NC(=O)c2ccc(-c3cccs3)s2)c(C)c[nH+]1 ZINC001320872949 1053370549 /nfs/dbraw/zinc/37/05/49/1053370549.db2.gz CXWSHBZNELPRPW-UHFFFAOYSA-N 1 2 314.435 4.163 20 0 DIADLO CC(=O)Nc1ccc([C@@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)cc1 ZINC000182216090 1053378724 /nfs/dbraw/zinc/37/87/24/1053378724.db2.gz RSCLVOCAIADQEZ-CQSZACIVSA-N 1 2 323.440 4.201 20 0 DIADLO CC(=O)Nc1ccc([C@@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)cc1 ZINC000182216090 1053378737 /nfs/dbraw/zinc/37/87/37/1053378737.db2.gz RSCLVOCAIADQEZ-CQSZACIVSA-N 1 2 323.440 4.201 20 0 DIADLO CCCCC[C@@H](NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1)c1ccccc1 ZINC000847434026 1053399925 /nfs/dbraw/zinc/39/99/25/1053399925.db2.gz RIEIVSZPOOZFEF-MAUKXSAKSA-N 1 2 313.445 4.026 20 0 DIADLO CCCCC[C@@H](NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1)c1ccccc1 ZINC000847434026 1053399942 /nfs/dbraw/zinc/39/99/42/1053399942.db2.gz RIEIVSZPOOZFEF-MAUKXSAKSA-N 1 2 313.445 4.026 20 0 DIADLO Cc1cc(SC(C)(C)C)ccc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001321334388 1053409080 /nfs/dbraw/zinc/40/90/80/1053409080.db2.gz JSPTYYIIIKWUBI-CYBMUJFWSA-N 1 2 317.458 4.282 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2noc3c2CC(C)(C)CC3)c(C)o1 ZINC001352889667 1053426759 /nfs/dbraw/zinc/42/67/59/1053426759.db2.gz LFDGRINTRKCDGY-GFCCVEGCSA-N 1 2 302.418 4.250 20 0 DIADLO Cc1ccc(C(C)(C)CNC(=O)c2c(C)cc(C)[nH+]c2C)cc1 ZINC001435050127 1053428258 /nfs/dbraw/zinc/42/82/58/1053428258.db2.gz CPYQHPQGAWURQH-UHFFFAOYSA-N 1 2 310.441 4.023 20 0 DIADLO COc1cccc2c1CC[C@@H]([NH2+][C@@H](c1ccccc1)C(F)F)C2 ZINC001474761670 1053429704 /nfs/dbraw/zinc/42/97/04/1053429704.db2.gz CYAPKQRZKIHBMU-QAPCUYQASA-N 1 2 317.379 4.149 20 0 DIADLO CCc1cccc2cc(C[NH+]3CC(Oc4ccccc4)C3)oc21 ZINC001474762014 1053430794 /nfs/dbraw/zinc/43/07/94/1053430794.db2.gz NZASKGXCCWNGHQ-UHFFFAOYSA-N 1 2 307.393 4.258 20 0 DIADLO FC(F)[C@H]([NH2+]C1CCC2(CCOCC2)CC1)c1ccccc1 ZINC001474763140 1053437843 /nfs/dbraw/zinc/43/78/43/1053437843.db2.gz UKZQUNYOXHOVPT-MRXNPFEDSA-N 1 2 309.400 4.322 20 0 DIADLO Fc1cc2c(c(F)c1)CC[C@H]2Oc1ccc(-n2cc[nH+]c2)cc1 ZINC001229954902 1053437848 /nfs/dbraw/zinc/43/78/48/1053437848.db2.gz VXTHOAHGABKSSO-GOSISDBHSA-N 1 2 312.319 4.217 20 0 DIADLO C[C@H](Oc1ccc(-n2cc[nH+]c2)cc1)c1cccc(F)c1F ZINC001229955176 1053438095 /nfs/dbraw/zinc/43/80/95/1053438095.db2.gz XZWSUHAYAOEBBH-LBPRGKRZSA-N 1 2 300.308 4.291 20 0 DIADLO FC(F)(F)C1CCC(Oc2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001229949521 1053438666 /nfs/dbraw/zinc/43/86/66/1053438666.db2.gz CTTHIBCLPWMZAZ-UHFFFAOYSA-N 1 2 310.319 4.372 20 0 DIADLO COc1ccc([C@H](C)Oc2ccc(-n3cc[nH+]c3)cc2)c(F)c1 ZINC001229954901 1053439083 /nfs/dbraw/zinc/43/90/83/1053439083.db2.gz VSXXDISNUFJRSL-ZDUSSCGKSA-N 1 2 312.344 4.160 20 0 DIADLO Cc1cccc(Cl)c1NC(=S)Nc1cccc2[nH+]ccn21 ZINC001200184073 1053443324 /nfs/dbraw/zinc/44/33/24/1053443324.db2.gz VLANWHMLYDIQEU-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO COc1ccc2c(c1)[C@H](Nc1ccc([NH+](C)C)cc1)CCCO2 ZINC000182495773 1053455931 /nfs/dbraw/zinc/45/59/31/1053455931.db2.gz XVUYRQOZHLBALP-GOSISDBHSA-N 1 2 312.413 4.087 20 0 DIADLO CCC[C@@H]1CC(=O)N(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)C1 ZINC001322142294 1053462075 /nfs/dbraw/zinc/46/20/75/1053462075.db2.gz VTFUAUFMDUGUFR-PBHICJAKSA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@@H]1CC(=O)N(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)C1 ZINC001322142294 1053462083 /nfs/dbraw/zinc/46/20/83/1053462083.db2.gz VTFUAUFMDUGUFR-PBHICJAKSA-N 1 2 320.864 4.083 20 0 DIADLO C[C@]([NH3+])(c1nc(-c2ccc3ccccc3c2)no1)c1ccccc1 ZINC000324724114 1053465505 /nfs/dbraw/zinc/46/55/05/1053465505.db2.gz HPBMYQDTACWKFE-HXUWFJFHSA-N 1 2 315.376 4.112 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2C/C(Cl)=C\Cl)cc1OC ZINC000763551249 1053469306 /nfs/dbraw/zinc/46/93/06/1053469306.db2.gz CETLNMMLAIZYPC-SRXBQZRASA-N 1 2 316.228 4.160 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2C/C(Cl)=C\Cl)cc1OC ZINC000763551249 1053469320 /nfs/dbraw/zinc/46/93/20/1053469320.db2.gz CETLNMMLAIZYPC-SRXBQZRASA-N 1 2 316.228 4.160 20 0 DIADLO CC(C)n1ccc(C[NH2+]C2(c3ccccc3Cl)CCC2)n1 ZINC000649643270 1053469356 /nfs/dbraw/zinc/46/93/56/1053469356.db2.gz DYVMAASUDISXLK-UHFFFAOYSA-N 1 2 303.837 4.286 20 0 DIADLO Fc1cccc([C@H]2C[N@@H+]([C@@H]3CCc4c3cccc4F)CCO2)c1 ZINC001322271800 1053476097 /nfs/dbraw/zinc/47/60/97/1053476097.db2.gz GEJCTVNUXPSXNT-RTBURBONSA-N 1 2 315.363 4.026 20 0 DIADLO Fc1cccc([C@H]2C[N@H+]([C@@H]3CCc4c3cccc4F)CCO2)c1 ZINC001322271800 1053476103 /nfs/dbraw/zinc/47/61/03/1053476103.db2.gz GEJCTVNUXPSXNT-RTBURBONSA-N 1 2 315.363 4.026 20 0 DIADLO N#CCC[C@@H]([NH2+]Cc1cccc(Cl)c1O)c1ccccc1 ZINC000182656180 1053491149 /nfs/dbraw/zinc/49/11/49/1053491149.db2.gz JKMLRPHRJNDMCA-MRXNPFEDSA-N 1 2 300.789 4.180 20 0 DIADLO Oc1c(Cl)cccc1C[NH2+]C1(c2ccc(F)cc2F)CCC1 ZINC000182676430 1053495337 /nfs/dbraw/zinc/49/53/37/1053495337.db2.gz UZMJUWLVYNKHQX-UHFFFAOYSA-N 1 2 323.770 4.493 20 0 DIADLO Cc1cc(-c2ccccc2)ccc1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC001353176559 1053497648 /nfs/dbraw/zinc/49/76/48/1053497648.db2.gz BIWXHBVBLKRKHF-MRXNPFEDSA-N 1 2 319.408 4.448 20 0 DIADLO C[C@H](CSc1ccccc1)[N@H+](C)Cc1ncc(Cl)s1 ZINC000649666382 1053503222 /nfs/dbraw/zinc/50/32/22/1053503222.db2.gz PRKHKXXPYDORSW-LLVKDONJSA-N 1 2 312.891 4.409 20 0 DIADLO C[C@H](CSc1ccccc1)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000649666382 1053503225 /nfs/dbraw/zinc/50/32/25/1053503225.db2.gz PRKHKXXPYDORSW-LLVKDONJSA-N 1 2 312.891 4.409 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc3c(c2)OCCO3)ccc1[NH+](C)C ZINC000182851774 1053532121 /nfs/dbraw/zinc/53/21/21/1053532121.db2.gz AFPKFFRBKRFCOM-CQSZACIVSA-N 1 2 312.413 4.005 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)oc1C ZINC001322653524 1053533735 /nfs/dbraw/zinc/53/37/35/1053533735.db2.gz WBJKYBAZRFFFDA-CZUORRHYSA-N 1 2 301.434 4.402 20 0 DIADLO Cc1cc(N2CCO[C@@H](c3ccccc3)C2)[nH+]c2ccccc12 ZINC001322855863 1053545911 /nfs/dbraw/zinc/54/59/11/1053545911.db2.gz COWMBHYIESCIRY-LJQANCHMSA-N 1 2 304.393 4.121 20 0 DIADLO C[C@H](CC1CCCCC1)C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC001322859646 1053547881 /nfs/dbraw/zinc/54/78/81/1053547881.db2.gz MUPKODADVURTLL-WBVHZDCISA-N 1 2 319.493 4.021 20 0 DIADLO Cc1ccc(NC(=S)Nc2cccc3[nH+]ccn32)c(Cl)c1 ZINC001200328214 1053562275 /nfs/dbraw/zinc/56/22/75/1053562275.db2.gz VGOHDZZKDQRMQE-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO Cc1cc(NC[C@@H](O)c2ccccc2Cl)[nH+]c2ccccc12 ZINC001323116919 1053564448 /nfs/dbraw/zinc/56/44/48/1053564448.db2.gz HDSXUZHWQGGETM-QGZVFWFLSA-N 1 2 312.800 4.342 20 0 DIADLO C[N@H+](Cc1cc2ccccc2[nH]1)Cc1cc(F)c(F)cc1F ZINC001323321956 1053574794 /nfs/dbraw/zinc/57/47/94/1053574794.db2.gz KSPXDOSIQYPYSU-UHFFFAOYSA-N 1 2 304.315 4.217 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2[nH]1)Cc1cc(F)c(F)cc1F ZINC001323321956 1053574807 /nfs/dbraw/zinc/57/48/07/1053574807.db2.gz KSPXDOSIQYPYSU-UHFFFAOYSA-N 1 2 304.315 4.217 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1ncoc1C(C)C ZINC001323425131 1053580166 /nfs/dbraw/zinc/58/01/66/1053580166.db2.gz GBFMQIYAMAYHEE-CQSZACIVSA-N 1 2 302.418 4.436 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000620128041 1053608924 /nfs/dbraw/zinc/60/89/24/1053608924.db2.gz UKPRFAGVYHSDBM-LPMFXHHGSA-N 1 2 317.379 4.488 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000620128041 1053608928 /nfs/dbraw/zinc/60/89/28/1053608928.db2.gz UKPRFAGVYHSDBM-LPMFXHHGSA-N 1 2 317.379 4.488 20 0 DIADLO Cc1ccc(N[C@H](C)c2cc(Br)ncc2F)c(C)[nH+]1 ZINC001323931691 1053611010 /nfs/dbraw/zinc/61/10/10/1053611010.db2.gz WCJIUYMAXMBRQW-SECBINFHSA-N 1 2 324.197 4.168 20 0 DIADLO CCCCc1ccc(NC(=S)Nc2cccc3[nH+]ccn32)cc1 ZINC001200383326 1053615095 /nfs/dbraw/zinc/61/50/95/1053615095.db2.gz ZRXOCDDHJFRDGN-UHFFFAOYSA-N 1 2 324.453 4.486 20 0 DIADLO FC(F)n1ccnc1C[N@@H+]1C[C@H]2CCCC[C@@]21c1ccccc1 ZINC001324058641 1053620686 /nfs/dbraw/zinc/62/06/86/1053620686.db2.gz AUIAISKEURHHQJ-CRAIPNDOSA-N 1 2 317.383 4.180 20 0 DIADLO FC(F)n1ccnc1C[N@H+]1C[C@H]2CCCC[C@@]21c1ccccc1 ZINC001324058641 1053620693 /nfs/dbraw/zinc/62/06/93/1053620693.db2.gz AUIAISKEURHHQJ-CRAIPNDOSA-N 1 2 317.383 4.180 20 0 DIADLO Oc1cc2c(cc1O[C@H]1CCc3cc(Cl)ccc31)CC[NH+]=C2 ZINC001230920224 1053624695 /nfs/dbraw/zinc/62/46/95/1053624695.db2.gz KFDDUSDWGVVVCM-KRWDZBQOSA-N 1 2 313.784 4.087 20 0 DIADLO CCCCc1ccc(C(=O)Nc2ccc(C)[nH+]c2N(C)C)cc1 ZINC001435644945 1053628596 /nfs/dbraw/zinc/62/85/96/1053628596.db2.gz VEQUZHSNKBKATI-UHFFFAOYSA-N 1 2 311.429 4.051 20 0 DIADLO Cc1cc(Nc2ccnc(C3CC3)n2)c[nH+]c1N1CCCC[C@@H]1C ZINC000503296627 1053651851 /nfs/dbraw/zinc/65/18/51/1053651851.db2.gz SMSHPVXOESAXET-AWEZNQCLSA-N 1 2 323.444 4.180 20 0 DIADLO Clc1ccc([C@H]2C[N@H+](Cc3cccn3C3CC3)CCO2)cc1 ZINC001324429375 1053653014 /nfs/dbraw/zinc/65/30/14/1053653014.db2.gz SCJIDOVBBXHADH-GOSISDBHSA-N 1 2 316.832 4.050 20 0 DIADLO Clc1ccc([C@H]2C[N@@H+](Cc3cccn3C3CC3)CCO2)cc1 ZINC001324429375 1053653019 /nfs/dbraw/zinc/65/30/19/1053653019.db2.gz SCJIDOVBBXHADH-GOSISDBHSA-N 1 2 316.832 4.050 20 0 DIADLO C[C@H](Oc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc(N(C)C)c1 ZINC001231080255 1053669642 /nfs/dbraw/zinc/66/96/42/1053669642.db2.gz AXFBBWGGSNSKIT-AWEZNQCLSA-N 1 2 307.397 4.283 20 0 DIADLO c1c[nH+]c(-c2ccc(O[C@@H]3C[C@H](OCc4ccccc4)C3)cc2)[nH]1 ZINC001231080613 1053669830 /nfs/dbraw/zinc/66/98/30/1053669830.db2.gz FXOALIDLUQYOEJ-KDURUIRLSA-N 1 2 320.392 4.203 20 0 DIADLO Clc1ccnc2c1CC[C@@H]2Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231080265 1053669896 /nfs/dbraw/zinc/66/98/96/1053669896.db2.gz AYHGBGAXWIVCQX-HNNXBMFYSA-N 1 2 311.772 4.191 20 0 DIADLO Cc1ccc(OC[C@H](C)Oc2ccc(-c3c[nH+]cn3C)cc2)cc1 ZINC001231083186 1053670843 /nfs/dbraw/zinc/67/08/43/1053670843.db2.gz DZVBJFDMYMPATM-INIZCTEOSA-N 1 2 322.408 4.242 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(O[C@H]2CCc3cc(F)ccc32)cc1 ZINC001231083219 1053671577 /nfs/dbraw/zinc/67/15/77/1053671577.db2.gz GGIRYPYCQFFVCW-IBGZPJMESA-N 1 2 308.356 4.293 20 0 DIADLO O=C1CC[C@@H](Oc2ccc(-c3[nH]cc[nH+]3)cc2)c2ccccc21 ZINC001231081834 1053671889 /nfs/dbraw/zinc/67/18/89/1053671889.db2.gz OGKWJZXOGJTSPC-GOSISDBHSA-N 1 2 304.349 4.173 20 0 DIADLO Cc1cccc(OC[C@@H](C)Oc2ccc(-c3c[nH+]cn3C)cc2)c1 ZINC001231083441 1053672057 /nfs/dbraw/zinc/67/20/57/1053672057.db2.gz KJULDUWBTBOMJA-MRXNPFEDSA-N 1 2 322.408 4.242 20 0 DIADLO C[C@@H](COCc1ccccc1)Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231082382 1053672316 /nfs/dbraw/zinc/67/23/16/1053672316.db2.gz VIMNZNGYXXSEBH-HNNXBMFYSA-N 1 2 308.381 4.061 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@H]3C2)c(C)[nH+]1 ZINC001353885127 1053696867 /nfs/dbraw/zinc/69/68/67/1053696867.db2.gz HGOFREMJRWVCTP-YESZJQIVSA-N 1 2 300.446 4.096 20 0 DIADLO Cc1cc(Cl)nc(C[NH2+]Cc2c(Cl)cccc2N(C)C)c1 ZINC001325183408 1053704063 /nfs/dbraw/zinc/70/40/63/1053704063.db2.gz BFUGGAIYUWTODC-UHFFFAOYSA-N 1 2 324.255 4.053 20 0 DIADLO Fc1cc2[nH+]ccc(N3CC[C@H]4OCCC[C@H]4C3)c2cc1Cl ZINC001325182739 1053704200 /nfs/dbraw/zinc/70/42/00/1053704200.db2.gz VWJGGGJSVONXMC-APPDUMDISA-N 1 2 320.795 4.033 20 0 DIADLO C[C@H]1C[N@H+](CCCCC(F)(F)F)C[C@H](c2ccc(F)cc2)O1 ZINC000154298622 1053733049 /nfs/dbraw/zinc/73/30/49/1053733049.db2.gz AUWQKEBIFCJZMF-SWLSCSKDSA-N 1 2 319.342 4.320 20 0 DIADLO C[C@H]1C[N@@H+](CCCCC(F)(F)F)C[C@H](c2ccc(F)cc2)O1 ZINC000154298622 1053733057 /nfs/dbraw/zinc/73/30/57/1053733057.db2.gz AUWQKEBIFCJZMF-SWLSCSKDSA-N 1 2 319.342 4.320 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+](C)CCOCc1ccccc1 ZINC000154611541 1053743170 /nfs/dbraw/zinc/74/31/70/1053743170.db2.gz YWGINDJIGZWQNN-OAHLLOKOSA-N 1 2 316.445 4.182 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)CCOCc1ccccc1 ZINC000154611541 1053743182 /nfs/dbraw/zinc/74/31/82/1053743182.db2.gz YWGINDJIGZWQNN-OAHLLOKOSA-N 1 2 316.445 4.182 20 0 DIADLO CCc1ccc(C[NH+](Cc2ccccn2)Cc2ccccn2)s1 ZINC001231500928 1053772114 /nfs/dbraw/zinc/77/21/14/1053772114.db2.gz RNVZODDFTSPIOK-UHFFFAOYSA-N 1 2 323.465 4.303 20 0 DIADLO C[N@H+](Cc1ccc(F)c(Oc2ccccc2)c1)Cc1cncnc1 ZINC001231539998 1053783020 /nfs/dbraw/zinc/78/30/20/1053783020.db2.gz ZMKZVHHAWDBSSO-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[N@@H+](Cc1ccc(F)c(Oc2ccccc2)c1)Cc1cncnc1 ZINC001231539998 1053783029 /nfs/dbraw/zinc/78/30/29/1053783029.db2.gz ZMKZVHHAWDBSSO-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2cc(Br)c[nH]2)cc1 ZINC001231572290 1053786856 /nfs/dbraw/zinc/78/68/56/1053786856.db2.gz UELAJSLPHOVUAW-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2cc(Br)c[nH]2)cc1 ZINC001231572290 1053786870 /nfs/dbraw/zinc/78/68/70/1053786870.db2.gz UELAJSLPHOVUAW-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)cs1 ZINC000620934082 1053798096 /nfs/dbraw/zinc/79/80/96/1053798096.db2.gz DCSFBCATEQDSLB-INIZCTEOSA-N 1 2 316.470 4.483 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)cs1 ZINC000620934082 1053798106 /nfs/dbraw/zinc/79/81/06/1053798106.db2.gz DCSFBCATEQDSLB-INIZCTEOSA-N 1 2 316.470 4.483 20 0 DIADLO COc1cc(F)ccc1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001231603107 1053799507 /nfs/dbraw/zinc/79/95/07/1053799507.db2.gz GQIUWZBWZJZSBY-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)ccc1C[N@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001231603107 1053799518 /nfs/dbraw/zinc/79/95/18/1053799518.db2.gz GQIUWZBWZJZSBY-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)ccc1C[N@@H+]1CCc2c(Cl)cccc2C1 ZINC001231604563 1053802286 /nfs/dbraw/zinc/80/22/86/1053802286.db2.gz CYQODTUKOUCDNH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(F)ccc1C[N@H+]1CCc2c(Cl)cccc2C1 ZINC001231604563 1053802296 /nfs/dbraw/zinc/80/22/96/1053802296.db2.gz CYQODTUKOUCDNH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)ccn1 ZINC000671098169 1053803396 /nfs/dbraw/zinc/80/33/96/1053803396.db2.gz HXEGUBQOOWLDFW-KUHUBIRLSA-N 1 2 308.381 4.123 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2Br)nc1 ZINC000156394255 1053807093 /nfs/dbraw/zinc/80/70/93/1053807093.db2.gz XQLDUOMDRRQYHT-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2Br)nc1 ZINC000156394255 1053807104 /nfs/dbraw/zinc/80/71/04/1053807104.db2.gz XQLDUOMDRRQYHT-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1ccccc1Br)c1ccco1 ZINC000156585852 1053815841 /nfs/dbraw/zinc/81/58/41/1053815841.db2.gz BXXVVRQDJHQTKG-SMDDNHRTSA-N 1 2 324.218 4.080 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1ccccc1Br)c1ccco1 ZINC000156585602 1053816148 /nfs/dbraw/zinc/81/61/48/1053816148.db2.gz BXXVVRQDJHQTKG-FZMZJTMJSA-N 1 2 324.218 4.080 20 0 DIADLO CC(C)[C@@H]1C[C@H]1C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001436229859 1053817695 /nfs/dbraw/zinc/81/76/95/1053817695.db2.gz VZROHCMXNDUXOW-ZWKOTPCHSA-N 1 2 324.424 4.084 20 0 DIADLO COCc1ccc(C[N@H+](Cc2ccccc2)Cc2ccncc2)o1 ZINC001231691000 1053832204 /nfs/dbraw/zinc/83/22/04/1053832204.db2.gz ACDJBDBNZOAKBJ-UHFFFAOYSA-N 1 2 322.408 4.023 20 0 DIADLO COCc1ccc(C[N@@H+](Cc2ccccc2)Cc2ccncc2)o1 ZINC001231691000 1053832213 /nfs/dbraw/zinc/83/22/13/1053832213.db2.gz ACDJBDBNZOAKBJ-UHFFFAOYSA-N 1 2 322.408 4.023 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CCCC[C@@](C)(F)C2)c(OC)c1 ZINC001231694183 1053834643 /nfs/dbraw/zinc/83/46/43/1053834643.db2.gz JALKUBNJEACAML-MRXNPFEDSA-N 1 2 315.816 4.071 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CCCC[C@@](C)(F)C2)c(OC)c1 ZINC001231694183 1053834661 /nfs/dbraw/zinc/83/46/61/1053834661.db2.gz JALKUBNJEACAML-MRXNPFEDSA-N 1 2 315.816 4.071 20 0 DIADLO CC(C)([NH2+]Cc1nc(C2CCCC2)no1)c1ccc(Cl)cc1 ZINC000157031465 1053837313 /nfs/dbraw/zinc/83/73/13/1053837313.db2.gz SUWKQDOLWBZHDE-UHFFFAOYSA-N 1 2 319.836 4.406 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CC[C@H]2c2ccccc2)c(OC)c1 ZINC001231699115 1053837999 /nfs/dbraw/zinc/83/79/99/1053837999.db2.gz ILNBEKXANQXKQV-KRWDZBQOSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CC[C@H]2c2ccccc2)c(OC)c1 ZINC001231699115 1053838007 /nfs/dbraw/zinc/83/80/07/1053838007.db2.gz ILNBEKXANQXKQV-KRWDZBQOSA-N 1 2 317.816 4.304 20 0 DIADLO Oc1cc(C[N@@H+]2CCSC[C@H]2c2ccccc2)ccc1Cl ZINC001231733884 1053840042 /nfs/dbraw/zinc/84/00/42/1053840042.db2.gz KSCSZUGYMOCUHO-INIZCTEOSA-N 1 2 319.857 4.336 20 0 DIADLO Oc1cc(C[N@H+]2CCSC[C@H]2c2ccccc2)ccc1Cl ZINC001231733884 1053840062 /nfs/dbraw/zinc/84/00/62/1053840062.db2.gz KSCSZUGYMOCUHO-INIZCTEOSA-N 1 2 319.857 4.336 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1ccc(Cl)c(O)c1 ZINC001231737908 1053846793 /nfs/dbraw/zinc/84/67/93/1053846793.db2.gz YJVMTNWCQOICJB-UHFFFAOYSA-N 1 2 317.816 4.139 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1ccc(Cl)c(O)c1 ZINC001231737908 1053846808 /nfs/dbraw/zinc/84/68/08/1053846808.db2.gz YJVMTNWCQOICJB-UHFFFAOYSA-N 1 2 317.816 4.139 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1cccnc1OC(C)C ZINC001231761500 1053848657 /nfs/dbraw/zinc/84/86/57/1053848657.db2.gz FMEMYGLVGYZIEI-UHFFFAOYSA-N 1 2 302.393 4.030 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1cccnc1OC(C)C ZINC001231761500 1053848667 /nfs/dbraw/zinc/84/86/67/1053848667.db2.gz FMEMYGLVGYZIEI-UHFFFAOYSA-N 1 2 302.393 4.030 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCCC[C@@H]1C(=O)OC(C)(C)C ZINC001231785458 1053857339 /nfs/dbraw/zinc/85/73/39/1053857339.db2.gz OVQIHIIDGIJITC-OAHLLOKOSA-N 1 2 321.486 4.105 20 0 DIADLO CSc1ccccc1C[N@H+]1CCCC[C@@H]1C(=O)OC(C)(C)C ZINC001231785458 1053857362 /nfs/dbraw/zinc/85/73/62/1053857362.db2.gz OVQIHIIDGIJITC-OAHLLOKOSA-N 1 2 321.486 4.105 20 0 DIADLO C/C(=C/C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1)C(C)(C)C ZINC001436379784 1053859518 /nfs/dbraw/zinc/85/95/18/1053859518.db2.gz BRZADEQMAAEXPL-QBFSEMIESA-N 1 2 311.429 4.232 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2oc3ccccc3c2C)s1 ZINC000274157333 1053859483 /nfs/dbraw/zinc/85/94/83/1053859483.db2.gz FXYCRYNHXGDKPA-GHMZBOCLSA-N 1 2 301.415 4.313 20 0 DIADLO Cc1csc2sc(C[N@@H+]3Cc4cccnc4C3)c(C)c12 ZINC001231827845 1053884255 /nfs/dbraw/zinc/88/42/55/1053884255.db2.gz BKZZOAZDSRASPK-UHFFFAOYSA-N 1 2 300.452 4.490 20 0 DIADLO Cc1csc2sc(C[N@H+]3Cc4cccnc4C3)c(C)c12 ZINC001231827845 1053884271 /nfs/dbraw/zinc/88/42/71/1053884271.db2.gz BKZZOAZDSRASPK-UHFFFAOYSA-N 1 2 300.452 4.490 20 0 DIADLO COC(C)(C)[C@H](C)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000671119601 1053888012 /nfs/dbraw/zinc/88/80/12/1053888012.db2.gz GGHSHDXEGAZLAA-AWEZNQCLSA-N 1 2 313.445 4.112 20 0 DIADLO C[N@H+](Cc1ccncc1)Cc1ccc(C(F)(F)F)c(F)c1F ZINC001231856962 1053891402 /nfs/dbraw/zinc/89/14/02/1053891402.db2.gz SILOAIQYRNBDIQ-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO C[N@@H+](Cc1ccncc1)Cc1ccc(C(F)(F)F)c(F)c1F ZINC001231856962 1053891414 /nfs/dbraw/zinc/89/14/14/1053891414.db2.gz SILOAIQYRNBDIQ-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO CC(C)c1ocnc1C[N@@H+](Cc1ccccc1F)CC1CC1 ZINC001327914433 1053895082 /nfs/dbraw/zinc/89/50/82/1053895082.db2.gz XSQAVGDOVCCJKG-UHFFFAOYSA-N 1 2 302.393 4.349 20 0 DIADLO CC(C)c1ocnc1C[N@H+](Cc1ccccc1F)CC1CC1 ZINC001327914433 1053895093 /nfs/dbraw/zinc/89/50/93/1053895093.db2.gz XSQAVGDOVCCJKG-UHFFFAOYSA-N 1 2 302.393 4.349 20 0 DIADLO C[C@@]1(F)CCC[N@H+](Cc2ccc(OC3CCCCC3)nc2)C1 ZINC001231873655 1053898632 /nfs/dbraw/zinc/89/86/32/1053898632.db2.gz NIKVTWVMJSKXHN-GOSISDBHSA-N 1 2 306.425 4.117 20 0 DIADLO C[C@@]1(F)CCC[N@@H+](Cc2ccc(OC3CCCCC3)nc2)C1 ZINC001231873655 1053898648 /nfs/dbraw/zinc/89/86/48/1053898648.db2.gz NIKVTWVMJSKXHN-GOSISDBHSA-N 1 2 306.425 4.117 20 0 DIADLO C/C(=C/c1ccc(Cl)cc1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001436593608 1053914165 /nfs/dbraw/zinc/91/41/65/1053914165.db2.gz DURMHHMWTKNHJB-BENRWUELSA-N 1 2 311.772 4.030 20 0 DIADLO CC(C)Oc1cccc([C@@H]([NH2+]C[C@H]2CCSC2)C(F)F)c1 ZINC000671123172 1053917848 /nfs/dbraw/zinc/91/78/48/1053917848.db2.gz PHEMTEMAQLBLBI-IUODEOHRSA-N 1 2 315.429 4.123 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)C1CCC(c2ccccc2)CC1 ZINC001436600812 1053918038 /nfs/dbraw/zinc/91/80/38/1053918038.db2.gz YLDOPJQAIUAKMI-UHFFFAOYSA-N 1 2 319.408 4.247 20 0 DIADLO COc1ccnc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)s2)c1 ZINC001231968906 1053927170 /nfs/dbraw/zinc/92/71/70/1053927170.db2.gz IQBQKJCVMBZPRG-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccnc(C[N@H+]2CCC[C@H]2c2ccc(Cl)s2)c1 ZINC001231968906 1053927180 /nfs/dbraw/zinc/92/71/80/1053927180.db2.gz IQBQKJCVMBZPRG-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO CCC[C@@H]1CCCC[N@@H+]1Cc1ncc(Br)cc1F ZINC001231988056 1053929568 /nfs/dbraw/zinc/92/95/68/1053929568.db2.gz LVHUOZCCVHNAKC-GFCCVEGCSA-N 1 2 315.230 4.138 20 0 DIADLO CCC[C@@H]1CCCC[N@H+]1Cc1ncc(Br)cc1F ZINC001231988056 1053929580 /nfs/dbraw/zinc/92/95/80/1053929580.db2.gz LVHUOZCCVHNAKC-GFCCVEGCSA-N 1 2 315.230 4.138 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2cc(Cl)cnc2F)cc1 ZINC001231995607 1053934051 /nfs/dbraw/zinc/93/40/51/1053934051.db2.gz SXIPTESXZBAPLR-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2cc(Cl)cnc2F)cc1 ZINC001231995607 1053934062 /nfs/dbraw/zinc/93/40/62/1053934062.db2.gz SXIPTESXZBAPLR-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO CC[N@H+](Cc1nccn1Cc1ccccc1)Cc1ccc(C)cc1 ZINC000621284718 1053936066 /nfs/dbraw/zinc/93/60/66/1053936066.db2.gz WJYJXQXKNIBVGA-UHFFFAOYSA-N 1 2 319.452 4.262 20 0 DIADLO CC[N@@H+](Cc1nccn1Cc1ccccc1)Cc1ccc(C)cc1 ZINC000621284718 1053936073 /nfs/dbraw/zinc/93/60/73/1053936073.db2.gz WJYJXQXKNIBVGA-UHFFFAOYSA-N 1 2 319.452 4.262 20 0 DIADLO Cc1cc(C(F)(F)F)ccc1C[N@@H+]1CCC(F)(F)[C@H](F)C1 ZINC001232002402 1053937481 /nfs/dbraw/zinc/93/74/81/1053937481.db2.gz UOTXHYCQNPHYSX-GFCCVEGCSA-N 1 2 311.269 4.193 20 0 DIADLO Cc1cc(C(F)(F)F)ccc1C[N@H+]1CCC(F)(F)[C@H](F)C1 ZINC001232002402 1053937498 /nfs/dbraw/zinc/93/74/98/1053937498.db2.gz UOTXHYCQNPHYSX-GFCCVEGCSA-N 1 2 311.269 4.193 20 0 DIADLO Cc1cc2c(cn1)C[N@H+](Cc1ccc(C(F)(F)F)cc1C)C2 ZINC001232006823 1053939310 /nfs/dbraw/zinc/93/93/10/1053939310.db2.gz OSQDPAZPPAZJBW-UHFFFAOYSA-N 1 2 306.331 4.233 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+](Cc1ccc(C(F)(F)F)cc1C)C2 ZINC001232006823 1053939328 /nfs/dbraw/zinc/93/93/28/1053939328.db2.gz OSQDPAZPPAZJBW-UHFFFAOYSA-N 1 2 306.331 4.233 20 0 DIADLO CCCC[N@H+](Cc1nnc(OCC)s1)[C@H](C)c1ccccc1 ZINC000621301613 1053945903 /nfs/dbraw/zinc/94/59/03/1053945903.db2.gz ZUIBZIPSLDBTHK-CQSZACIVSA-N 1 2 319.474 4.300 20 0 DIADLO CCCC[N@@H+](Cc1nnc(OCC)s1)[C@H](C)c1ccccc1 ZINC000621301613 1053945917 /nfs/dbraw/zinc/94/59/17/1053945917.db2.gz ZUIBZIPSLDBTHK-CQSZACIVSA-N 1 2 319.474 4.300 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(F)cc(F)cc2Cl)CCC1(F)F ZINC001232097064 1053961851 /nfs/dbraw/zinc/96/18/51/1053961851.db2.gz ITMXZDOLPZOONJ-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(F)cc(F)cc2Cl)CCC1(F)F ZINC001232097064 1053961863 /nfs/dbraw/zinc/96/18/63/1053961863.db2.gz ITMXZDOLPZOONJ-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1nc(Cl)ccc1Br ZINC001232058971 1053951998 /nfs/dbraw/zinc/95/19/98/1053951998.db2.gz ZHIFGHWFLCFQKE-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)oc1C ZINC000621351806 1053953322 /nfs/dbraw/zinc/95/33/22/1053953322.db2.gz BLDJXLYOYSLNLG-UHFFFAOYSA-N 1 2 324.346 4.479 20 0 DIADLO FC(F)(F)c1cccc(C[N@H+]2CC=C(c3ccccc3)CC2)n1 ZINC001232071728 1053954564 /nfs/dbraw/zinc/95/45/64/1053954564.db2.gz NGNSYJCWJUAYDW-UHFFFAOYSA-N 1 2 318.342 4.390 20 0 DIADLO FC(F)(F)c1cccc(C[N@@H+]2CC=C(c3ccccc3)CC2)n1 ZINC001232071728 1053954571 /nfs/dbraw/zinc/95/45/71/1053954571.db2.gz NGNSYJCWJUAYDW-UHFFFAOYSA-N 1 2 318.342 4.390 20 0 DIADLO CCc1cc(N2CCC[C@]2(CC)Cc2ccccc2)nc(C)[nH+]1 ZINC001472828483 1053958802 /nfs/dbraw/zinc/95/88/02/1053958802.db2.gz UGCPHBUVNASQNZ-HXUWFJFHSA-N 1 2 309.457 4.339 20 0 DIADLO Fc1cc(F)c(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c(Cl)c1 ZINC001232096762 1053963184 /nfs/dbraw/zinc/96/31/84/1053963184.db2.gz GGTVWQPOWGQSLF-DTORHVGOSA-N 1 2 307.718 4.095 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c(Cl)c1 ZINC001232096762 1053963194 /nfs/dbraw/zinc/96/31/94/1053963194.db2.gz GGTVWQPOWGQSLF-DTORHVGOSA-N 1 2 307.718 4.095 20 0 DIADLO COc1ccc2c(c1)OCC[C@H]2[NH2+]Cc1c(F)cccc1Cl ZINC001200775687 1053964574 /nfs/dbraw/zinc/96/45/74/1053964574.db2.gz YEXOCDHEWHLANP-MRXNPFEDSA-N 1 2 321.779 4.101 20 0 DIADLO COc1ccnc(Cl)c1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001232152790 1053971034 /nfs/dbraw/zinc/97/10/34/1053971034.db2.gz UDHNDHUTTCQNDE-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccnc(Cl)c1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001232152790 1053971048 /nfs/dbraw/zinc/97/10/48/1053971048.db2.gz UDHNDHUTTCQNDE-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ncccc2Br)cc1C ZINC001232166783 1053975885 /nfs/dbraw/zinc/97/58/85/1053975885.db2.gz HEZMWEUZDRTRPE-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ncccc2Br)cc1C ZINC001232166783 1053975893 /nfs/dbraw/zinc/97/58/93/1053975893.db2.gz HEZMWEUZDRTRPE-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO CC[C@@H]1CO[C@@](C)(CCC(C)C)[N@@H+]1Cc1cn(C)nc1C1CC1 ZINC001232175019 1053980596 /nfs/dbraw/zinc/98/05/96/1053980596.db2.gz SBQNSJKUVHOHIH-MJGOQNOKSA-N 1 2 319.493 4.061 20 0 DIADLO CC[C@@H]1CO[C@@](C)(CCC(C)C)[N@H+]1Cc1cn(C)nc1C1CC1 ZINC001232175019 1053980612 /nfs/dbraw/zinc/98/06/12/1053980612.db2.gz SBQNSJKUVHOHIH-MJGOQNOKSA-N 1 2 319.493 4.061 20 0 DIADLO CCCCC1CCC(C(=O)NCc2cc(C)[nH+]c(C)c2)CC1 ZINC001436878899 1053983075 /nfs/dbraw/zinc/98/30/75/1053983075.db2.gz PYRQYPDGEVVYOJ-UHFFFAOYSA-N 1 2 302.462 4.311 20 0 DIADLO FC(F)c1cccc(C[NH2+][C@H]2c3ccccc3OC[C@@H]2F)c1 ZINC001329376170 1053986888 /nfs/dbraw/zinc/98/68/88/1053986888.db2.gz RZJUGVJIXUBPMA-HOCLYGCPSA-N 1 2 307.315 4.186 20 0 DIADLO CC[N@H+](Cc1ncsc1C)Cc1ccc(C(F)(F)F)cc1 ZINC001232205762 1053986818 /nfs/dbraw/zinc/98/68/18/1053986818.db2.gz UFCMEVQWWRBHOA-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CC[N@@H+](Cc1ncsc1C)Cc1ccc(C(F)(F)F)cc1 ZINC001232205762 1053986835 /nfs/dbraw/zinc/98/68/35/1053986835.db2.gz UFCMEVQWWRBHOA-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO Cc1ccc(Cl)c(O[C@H]2CCC[N@H+](Cc3cnsc3)C2)c1 ZINC001232227367 1053996073 /nfs/dbraw/zinc/99/60/73/1053996073.db2.gz MTQFDAJHJSWSIY-AWEZNQCLSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1ccc(Cl)c(O[C@H]2CCC[N@@H+](Cc3cnsc3)C2)c1 ZINC001232227367 1053996085 /nfs/dbraw/zinc/99/60/85/1053996085.db2.gz MTQFDAJHJSWSIY-AWEZNQCLSA-N 1 2 322.861 4.148 20 0 DIADLO c1cc(C[N@@H+]2CCC[C@@H]2c2nccs2)n(Cc2ccccc2)c1 ZINC001232234345 1053998543 /nfs/dbraw/zinc/99/85/43/1053998543.db2.gz WNQJBGSBIDBHFQ-GOSISDBHSA-N 1 2 323.465 4.330 20 0 DIADLO c1cc(C[N@H+]2CCC[C@@H]2c2nccs2)n(Cc2ccccc2)c1 ZINC001232234345 1053998554 /nfs/dbraw/zinc/99/85/54/1053998554.db2.gz WNQJBGSBIDBHFQ-GOSISDBHSA-N 1 2 323.465 4.330 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1cccn1Cc1ccccc1)C2 ZINC001232234511 1053999457 /nfs/dbraw/zinc/99/94/57/1053999457.db2.gz BISCKEBMBNXNRR-UHFFFAOYSA-N 1 2 318.420 4.061 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1cccn1Cc1ccccc1)C2 ZINC001232234511 1053999469 /nfs/dbraw/zinc/99/94/69/1053999469.db2.gz BISCKEBMBNXNRR-UHFFFAOYSA-N 1 2 318.420 4.061 20 0 DIADLO c1cc(C[N@@H+]2CCC[C@H]2c2nccs2)n(Cc2ccccc2)c1 ZINC001232234346 1054000041 /nfs/dbraw/zinc/00/00/41/1054000041.db2.gz WNQJBGSBIDBHFQ-SFHVURJKSA-N 1 2 323.465 4.330 20 0 DIADLO c1cc(C[N@H+]2CCC[C@H]2c2nccs2)n(Cc2ccccc2)c1 ZINC001232234346 1054000059 /nfs/dbraw/zinc/00/00/59/1054000059.db2.gz WNQJBGSBIDBHFQ-SFHVURJKSA-N 1 2 323.465 4.330 20 0 DIADLO CC1CCC(C)(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)CC1 ZINC001354918879 1054003996 /nfs/dbraw/zinc/00/39/96/1054003996.db2.gz QWIXVVYVYUAVTH-UHFFFAOYSA-N 1 2 315.392 4.166 20 0 DIADLO Cc1cc(Cl)cc(C)c1NC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001329846388 1054009626 /nfs/dbraw/zinc/00/96/26/1054009626.db2.gz GBKDSHKLPDCZCU-HNNXBMFYSA-N 1 2 319.836 4.379 20 0 DIADLO Oc1ccc(C[N@@H+]2Cc3ccc(Cl)cc3C2)c2cccnc12 ZINC001232276831 1054011483 /nfs/dbraw/zinc/01/14/83/1054011483.db2.gz DWPJTYMRRJSFBL-UHFFFAOYSA-N 1 2 310.784 4.110 20 0 DIADLO Oc1ccc(C[N@H+]2Cc3ccc(Cl)cc3C2)c2cccnc12 ZINC001232276831 1054011497 /nfs/dbraw/zinc/01/14/97/1054011497.db2.gz DWPJTYMRRJSFBL-UHFFFAOYSA-N 1 2 310.784 4.110 20 0 DIADLO CCc1sc(C[N@@H+]2C[C@@H](C)C[C@H]2CF)cc1Br ZINC001232286601 1054013264 /nfs/dbraw/zinc/01/32/64/1054013264.db2.gz GPWIOWPMDKEZKT-UWVGGRQHSA-N 1 2 320.271 4.253 20 0 DIADLO CCc1sc(C[N@H+]2C[C@@H](C)C[C@H]2CF)cc1Br ZINC001232286601 1054013272 /nfs/dbraw/zinc/01/32/72/1054013272.db2.gz GPWIOWPMDKEZKT-UWVGGRQHSA-N 1 2 320.271 4.253 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c(C)n1 ZINC001232337100 1054023129 /nfs/dbraw/zinc/02/31/29/1054023129.db2.gz FOKNHXHNIZVDQH-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)c(C)n1 ZINC001232337100 1054023143 /nfs/dbraw/zinc/02/31/43/1054023143.db2.gz FOKNHXHNIZVDQH-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO CC[N@H+](Cc1cnc(SC)cc1C)Cc1cccc(F)c1F ZINC001232350898 1054025954 /nfs/dbraw/zinc/02/59/54/1054025954.db2.gz YWADJQNTIPVQRL-UHFFFAOYSA-N 1 2 322.424 4.412 20 0 DIADLO CC[N@@H+](Cc1cnc(SC)cc1C)Cc1cccc(F)c1F ZINC001232350898 1054025960 /nfs/dbraw/zinc/02/59/60/1054025960.db2.gz YWADJQNTIPVQRL-UHFFFAOYSA-N 1 2 322.424 4.412 20 0 DIADLO COc1cc(C)c(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)cn1 ZINC001232354338 1054026806 /nfs/dbraw/zinc/02/68/06/1054026806.db2.gz MXZXPEAIFRZTTM-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C)c(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)cn1 ZINC001232354338 1054026821 /nfs/dbraw/zinc/02/68/21/1054026821.db2.gz MXZXPEAIFRZTTM-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO Cc1c(F)cc(C[N@H+](C)Cc2nc3ccccc3o2)cc1F ZINC001232424593 1054042887 /nfs/dbraw/zinc/04/28/87/1054042887.db2.gz PWGQMAHQSPMWDK-UHFFFAOYSA-N 1 2 302.324 4.046 20 0 DIADLO Cc1c(F)cc(C[N@@H+](C)Cc2nc3ccccc3o2)cc1F ZINC001232424593 1054042896 /nfs/dbraw/zinc/04/28/96/1054042896.db2.gz PWGQMAHQSPMWDK-UHFFFAOYSA-N 1 2 302.324 4.046 20 0 DIADLO CCc1csc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)n1 ZINC001232476294 1054053445 /nfs/dbraw/zinc/05/34/45/1054053445.db2.gz WOMYNVMQVFXFNV-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO CCc1csc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2)n1 ZINC001232476294 1054053457 /nfs/dbraw/zinc/05/34/57/1054053457.db2.gz WOMYNVMQVFXFNV-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+](C)Cc1ccc(F)cc1F ZINC001232501138 1054059433 /nfs/dbraw/zinc/05/94/33/1054059433.db2.gz JCJICJATIKBEDK-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+](C)Cc1ccc(F)cc1F ZINC001232501138 1054059453 /nfs/dbraw/zinc/05/94/53/1054059453.db2.gz JCJICJATIKBEDK-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CCC[N@H+](Cc1cn(C)nc1Cl)[C@@H](C)c1ccccc1OC ZINC001331067296 1054060054 /nfs/dbraw/zinc/06/00/54/1054060054.db2.gz MEIHPLNFXMLZMV-ZDUSSCGKSA-N 1 2 321.852 4.055 20 0 DIADLO CCC[N@@H+](Cc1cn(C)nc1Cl)[C@@H](C)c1ccccc1OC ZINC001331067296 1054060070 /nfs/dbraw/zinc/06/00/70/1054060070.db2.gz MEIHPLNFXMLZMV-ZDUSSCGKSA-N 1 2 321.852 4.055 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2cc3ccoc3cn2)c(F)c1 ZINC001232556406 1054070088 /nfs/dbraw/zinc/07/00/88/1054070088.db2.gz JEPGHYBGZSEGQR-QGZVFWFLSA-N 1 2 314.335 4.443 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2cc3ccoc3cn2)c(F)c1 ZINC001232556406 1054070102 /nfs/dbraw/zinc/07/01/02/1054070102.db2.gz JEPGHYBGZSEGQR-QGZVFWFLSA-N 1 2 314.335 4.443 20 0 DIADLO Fc1ccc(F)c([C@H]2CCC[N@@H+]2Cc2cc3ccoc3cn2)c1 ZINC001232553452 1054071193 /nfs/dbraw/zinc/07/11/93/1054071193.db2.gz UGHCDPIGAYJNRA-QGZVFWFLSA-N 1 2 314.335 4.443 20 0 DIADLO Fc1ccc(F)c([C@H]2CCC[N@H+]2Cc2cc3ccoc3cn2)c1 ZINC001232553452 1054071202 /nfs/dbraw/zinc/07/12/02/1054071202.db2.gz UGHCDPIGAYJNRA-QGZVFWFLSA-N 1 2 314.335 4.443 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]C(c2ccccc2)c2ccccc2)c2nccn21 ZINC000293876313 1054072274 /nfs/dbraw/zinc/07/22/74/1054072274.db2.gz FHFQFUSSJZOTIA-QAPCUYQASA-N 1 2 303.409 4.268 20 0 DIADLO FC1CC2(C1)CC[NH+](Cc1ncc(Cl)cc1Cl)CC2 ZINC001232570745 1054073484 /nfs/dbraw/zinc/07/34/84/1054073484.db2.gz PIFLMAOAFBZDDB-UHFFFAOYSA-N 1 2 303.208 4.103 20 0 DIADLO CCOc1ccnc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)c1 ZINC001232587708 1054075361 /nfs/dbraw/zinc/07/53/61/1054075361.db2.gz LCUDYHYOQHQYDB-ZDUSSCGKSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1ccnc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)c1 ZINC001232587708 1054075373 /nfs/dbraw/zinc/07/53/73/1054075373.db2.gz LCUDYHYOQHQYDB-ZDUSSCGKSA-N 1 2 304.821 4.327 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2nc(C)c[nH]2)c2cccc(F)c2)cc1 ZINC001331517193 1054080845 /nfs/dbraw/zinc/08/08/45/1054080845.db2.gz CUKSZXMJKOBBDQ-HXUWFJFHSA-N 1 2 323.415 4.299 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)c(C)[nH+]1 ZINC001355213443 1054083427 /nfs/dbraw/zinc/08/34/27/1054083427.db2.gz YVZBTZIZCZXSBR-WMZOPIPTSA-N 1 2 308.425 4.025 20 0 DIADLO COC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccc3ccsc3c1)C2 ZINC001232617222 1054084908 /nfs/dbraw/zinc/08/49/08/1054084908.db2.gz YEOCFFLGUGUCNL-UHFFFAOYSA-N 1 2 323.417 4.204 20 0 DIADLO COC(=O)c1ccc2c(c1)C[N@H+](Cc1ccc3ccsc3c1)C2 ZINC001232617222 1054084912 /nfs/dbraw/zinc/08/49/12/1054084912.db2.gz YEOCFFLGUGUCNL-UHFFFAOYSA-N 1 2 323.417 4.204 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1cnc(Cl)cc1Br ZINC001232680680 1054098450 /nfs/dbraw/zinc/09/84/50/1054098450.db2.gz GFBJTBBGTTYQMO-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO FC(F)c1cccc(C[NH2+]Cc2csc(C(F)(F)F)n2)c1 ZINC001355284299 1054101398 /nfs/dbraw/zinc/10/13/98/1054101398.db2.gz QNXJMUVAKHCKFH-UHFFFAOYSA-N 1 2 322.302 4.389 20 0 DIADLO Fc1cc(C[N@@H+]2CC[C@H]3CCCO[C@H]3C2)c(Cl)cc1Cl ZINC001232703759 1054104932 /nfs/dbraw/zinc/10/49/32/1054104932.db2.gz ZIHQARDAMDXDJB-BMIGLBTASA-N 1 2 318.219 4.133 20 0 DIADLO Fc1cc(C[N@H+]2CC[C@H]3CCCO[C@H]3C2)c(Cl)cc1Cl ZINC001232703759 1054104941 /nfs/dbraw/zinc/10/49/41/1054104941.db2.gz ZIHQARDAMDXDJB-BMIGLBTASA-N 1 2 318.219 4.133 20 0 DIADLO O=C1CC[N@@H+](Cc2cc3ccc(Cl)cc3[nH]2)[C@@H]2CCCC[C@H]12 ZINC001232726721 1054107974 /nfs/dbraw/zinc/10/79/74/1054107974.db2.gz JOENYJCSFCBINC-DOTOQJQBSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2cc3ccc(Cl)cc3[nH]2)[C@@H]2CCCC[C@H]12 ZINC001232726721 1054107978 /nfs/dbraw/zinc/10/79/78/1054107978.db2.gz JOENYJCSFCBINC-DOTOQJQBSA-N 1 2 316.832 4.155 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)c1ccc(C2CCCC2)cc1 ZINC001437899698 1054109247 /nfs/dbraw/zinc/10/92/47/1054109247.db2.gz AWADUBWECISAMK-UHFFFAOYSA-N 1 2 305.381 4.244 20 0 DIADLO CC(C)Cc1ccc(CCC(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001437907976 1054111623 /nfs/dbraw/zinc/11/16/23/1054111623.db2.gz LRINMDLHELMHMA-UHFFFAOYSA-N 1 2 321.424 4.104 20 0 DIADLO Cc1c(C[N@H+](C)Cc2nc3ccccc3s2)ccnc1Cl ZINC001232751169 1054115312 /nfs/dbraw/zinc/11/53/12/1054115312.db2.gz JLMRSWOSDFPNLZ-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO Cc1c(C[N@@H+](C)Cc2nc3ccccc3s2)ccnc1Cl ZINC001232751169 1054115318 /nfs/dbraw/zinc/11/53/18/1054115318.db2.gz JLMRSWOSDFPNLZ-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO CC1=C(C)C[C@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)CC1 ZINC001355356654 1054117387 /nfs/dbraw/zinc/11/73/87/1054117387.db2.gz FVUYTEXSRPHXAP-CQSZACIVSA-N 1 2 313.376 4.086 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+]CCCC(F)F)C(F)F)c1 ZINC001332447396 1054118850 /nfs/dbraw/zinc/11/88/50/1054118850.db2.gz DQOISBZYDYEORX-AWEZNQCLSA-N 1 2 307.331 4.415 20 0 DIADLO CC(C)Oc1cccc([C@@H]([NH2+]CCCC(F)F)C(F)F)c1 ZINC001332447401 1054119643 /nfs/dbraw/zinc/11/96/43/1054119643.db2.gz DQOISBZYDYEORX-CQSZACIVSA-N 1 2 307.331 4.415 20 0 DIADLO CCCn1cnc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)c1 ZINC001232799028 1054121317 /nfs/dbraw/zinc/12/13/17/1054121317.db2.gz UHQYHACOCLHKCP-KRWDZBQOSA-N 1 2 303.837 4.284 20 0 DIADLO CCCn1cnc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)c1 ZINC001232799028 1054121322 /nfs/dbraw/zinc/12/13/22/1054121322.db2.gz UHQYHACOCLHKCP-KRWDZBQOSA-N 1 2 303.837 4.284 20 0 DIADLO CC(C)(C)c1nc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)co1 ZINC001332712192 1054125250 /nfs/dbraw/zinc/12/52/50/1054125250.db2.gz NKEZFVHTQNMCGZ-UHFFFAOYSA-N 1 2 308.372 4.275 20 0 DIADLO Cc1cc(N[C@H](c2ccccc2)[C@H]2CCCO2)nc(C(C)C)[nH+]1 ZINC000505778198 1054124967 /nfs/dbraw/zinc/12/49/67/1054124967.db2.gz RNGAWIKJQZYEHW-SJLPKXTDSA-N 1 2 311.429 4.241 20 0 DIADLO CCCn1cnc(C[NH+]2CCC(c3ccccc3Cl)CC2)c1 ZINC001232799738 1054125881 /nfs/dbraw/zinc/12/58/81/1054125881.db2.gz VAVMRJMMRAYKPG-UHFFFAOYSA-N 1 2 317.864 4.326 20 0 DIADLO CCCCCC[C@H](CC)CN(C)C(=O)c1cccc2[nH+]ccn21 ZINC001438004624 1054126047 /nfs/dbraw/zinc/12/60/47/1054126047.db2.gz XBOBGSJPERPFMN-INIZCTEOSA-N 1 2 315.461 4.403 20 0 DIADLO CC(C)c1nsc(C[NH2+][C@H](C)c2ccc(Cl)c(F)c2)n1 ZINC001332713277 1054126111 /nfs/dbraw/zinc/12/61/11/1054126111.db2.gz CSAZXKNNXLFRJX-SECBINFHSA-N 1 2 313.829 4.305 20 0 DIADLO C[C@H]([NH2+]Cc1cccc2c1OCC2)c1nc(C(C)(C)C)cs1 ZINC001332780935 1054127017 /nfs/dbraw/zinc/12/70/17/1054127017.db2.gz KSUOEXPKRVKYFE-LBPRGKRZSA-N 1 2 316.470 4.226 20 0 DIADLO Cc1cc(C)nc(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC001332853581 1054130005 /nfs/dbraw/zinc/13/00/05/1054130005.db2.gz LUSYFETXNYBVRX-CYBMUJFWSA-N 1 2 303.475 4.303 20 0 DIADLO CC(C)([NH2+]Cc1c(F)cncc1F)c1cccc(Cl)c1F ZINC001332886553 1054132340 /nfs/dbraw/zinc/13/23/40/1054132340.db2.gz YNUZBXZHVPBZGV-UHFFFAOYSA-N 1 2 314.738 4.177 20 0 DIADLO CC(C)c1ccccc1C[NH2+]Cc1cc(COC(C)(C)C)on1 ZINC000848549325 1054143103 /nfs/dbraw/zinc/14/31/03/1054143103.db2.gz NJQRTFSWJMNXPW-UHFFFAOYSA-N 1 2 316.445 4.403 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cncc(-c2ccccc2)c1 ZINC001232900588 1054143522 /nfs/dbraw/zinc/14/35/22/1054143522.db2.gz ABHBQAKLKDEIFF-MRXNPFEDSA-N 1 2 303.409 4.127 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cncc(-c2ccccc2)c1 ZINC001232900588 1054143528 /nfs/dbraw/zinc/14/35/28/1054143528.db2.gz ABHBQAKLKDEIFF-MRXNPFEDSA-N 1 2 303.409 4.127 20 0 DIADLO Oc1c(F)ccc(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)c1F ZINC001232934991 1054148801 /nfs/dbraw/zinc/14/88/01/1054148801.db2.gz LQLNIOZHVTWOJS-NSHDSACASA-N 1 2 323.770 4.313 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(F)c(O)c2F)cc1 ZINC001232934561 1054149972 /nfs/dbraw/zinc/14/99/72/1054149972.db2.gz AVQSZGWGBMAQIN-MRXNPFEDSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccc(F)c(O)c2F)cc1 ZINC001232934561 1054149975 /nfs/dbraw/zinc/14/99/75/1054149975.db2.gz AVQSZGWGBMAQIN-MRXNPFEDSA-N 1 2 303.352 4.316 20 0 DIADLO Oc1c(F)ccc(C[N@@H+]2CCCC[C@H]2c2ccccc2)c1F ZINC001232930707 1054151097 /nfs/dbraw/zinc/15/10/97/1054151097.db2.gz FBPNJXMSJQBDJJ-INIZCTEOSA-N 1 2 303.352 4.398 20 0 DIADLO CC(C)(C)c1cccc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001355482291 1054151929 /nfs/dbraw/zinc/15/19/29/1054151929.db2.gz KAOQPCXSFPCRLQ-UHFFFAOYSA-N 1 2 319.408 4.422 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2ccncc2Br)o1 ZINC001333368348 1054152336 /nfs/dbraw/zinc/15/23/36/1054152336.db2.gz CAFBRWJJGXOJBF-UHFFFAOYSA-N 1 2 323.234 4.024 20 0 DIADLO Oc1c(F)ccc(C[NH+]2CCC(c3ccc(F)cc3)CC2)c1F ZINC001232936944 1054152580 /nfs/dbraw/zinc/15/25/80/1054152580.db2.gz ZYQNSACBDGKBRC-UHFFFAOYSA-N 1 2 321.342 4.189 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cc(Cl)cnc1Br ZINC001232961558 1054160075 /nfs/dbraw/zinc/16/00/75/1054160075.db2.gz PIFOKEYHHNUQNB-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cc(Cl)cnc1Br ZINC001232961558 1054160085 /nfs/dbraw/zinc/16/00/85/1054160085.db2.gz PIFOKEYHHNUQNB-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1ccccc1OCC(C)C ZINC001333555594 1054158335 /nfs/dbraw/zinc/15/83/35/1054158335.db2.gz OPFXFXHSXCVNSJ-MRXNPFEDSA-N 1 2 314.429 4.185 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cc(F)c1F ZINC001232971252 1054163132 /nfs/dbraw/zinc/16/31/32/1054163132.db2.gz ZCYSXKPTOQTLOE-HNNXBMFYSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cc(F)c1F ZINC001232971252 1054163136 /nfs/dbraw/zinc/16/31/36/1054163136.db2.gz ZCYSXKPTOQTLOE-HNNXBMFYSA-N 1 2 307.315 4.147 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2nc(C)sc2C)cc1F ZINC001333617201 1054164764 /nfs/dbraw/zinc/16/47/64/1054164764.db2.gz UKDONPCCDPNDHA-INIZCTEOSA-N 1 2 320.433 4.245 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2nc(C)sc2C)cc1F ZINC001333617201 1054164767 /nfs/dbraw/zinc/16/47/67/1054164767.db2.gz UKDONPCCDPNDHA-INIZCTEOSA-N 1 2 320.433 4.245 20 0 DIADLO COc1cc2c(cc1OC)C[NH+](Cc1ccc(C3CC3)cc1)C2 ZINC001232985967 1054166644 /nfs/dbraw/zinc/16/66/44/1054166644.db2.gz DHQJRDVMOCJITC-UHFFFAOYSA-N 1 2 309.409 4.097 20 0 DIADLO COc1cc(Cl)cc(F)c1C[N@H+](C)Cc1cccc(F)c1 ZINC001233002049 1054167946 /nfs/dbraw/zinc/16/79/46/1054167946.db2.gz MMJDXSXLFSDXNR-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(Cl)cc(F)c1C[N@@H+](C)Cc1cccc(F)c1 ZINC001233002049 1054167954 /nfs/dbraw/zinc/16/79/54/1054167954.db2.gz MMJDXSXLFSDXNR-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2c(F)cc(Cl)cc2OC)cc1 ZINC001232999931 1054168380 /nfs/dbraw/zinc/16/83/80/1054168380.db2.gz LVKVCYCVWJOQJR-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2c(F)cc(Cl)cc2OC)cc1 ZINC001232999931 1054168387 /nfs/dbraw/zinc/16/83/87/1054168387.db2.gz LVKVCYCVWJOQJR-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO Oc1cc(Br)cc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1 ZINC001232998669 1054168549 /nfs/dbraw/zinc/16/85/49/1054168549.db2.gz CJLKFWSXYGSYCG-MRXNPFEDSA-N 1 2 318.214 4.102 20 0 DIADLO Oc1cc(Br)cc(C[N@H+]2CC[C@@H]2c2ccccc2)c1 ZINC001232998669 1054168556 /nfs/dbraw/zinc/16/85/56/1054168556.db2.gz CJLKFWSXYGSYCG-MRXNPFEDSA-N 1 2 318.214 4.102 20 0 DIADLO CC(C)c1ocnc1C[NH2+][C@@H]1CC2(CCC2)Oc2ccccc21 ZINC001333738891 1054170865 /nfs/dbraw/zinc/17/08/65/1054170865.db2.gz GBYJMWMMTMPFMX-OAHLLOKOSA-N 1 2 312.413 4.334 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)cn1 ZINC001233012527 1054171378 /nfs/dbraw/zinc/17/13/78/1054171378.db2.gz OFWQDBOTXQYJCY-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCc3cccc(C(F)(F)F)c3C2)cn1 ZINC001233012527 1054171381 /nfs/dbraw/zinc/17/13/81/1054171381.db2.gz OFWQDBOTXQYJCY-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Clc1sccc1C[N@@H+]1CC[C@H]1COCc1ccccc1 ZINC001233056447 1054176771 /nfs/dbraw/zinc/17/67/71/1054176771.db2.gz IZOZVTWQNNRDGA-HNNXBMFYSA-N 1 2 307.846 4.193 20 0 DIADLO Clc1sccc1C[N@H+]1CC[C@H]1COCc1ccccc1 ZINC001233056447 1054176781 /nfs/dbraw/zinc/17/67/81/1054176781.db2.gz IZOZVTWQNNRDGA-HNNXBMFYSA-N 1 2 307.846 4.193 20 0 DIADLO C[C@H]1CCCCC[N@@H+]1Cc1ccc(Cl)c(Br)n1 ZINC001233091126 1054183279 /nfs/dbraw/zinc/18/32/79/1054183279.db2.gz HBCYGHSABQXOFX-JTQLQIEISA-N 1 2 317.658 4.262 20 0 DIADLO C[C@H]1CCCCC[N@H+]1Cc1ccc(Cl)c(Br)n1 ZINC001233091126 1054183285 /nfs/dbraw/zinc/18/32/85/1054183285.db2.gz HBCYGHSABQXOFX-JTQLQIEISA-N 1 2 317.658 4.262 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(Cl)c(Br)n2)[C@@H](C)C1 ZINC001233092748 1054185346 /nfs/dbraw/zinc/18/53/46/1054185346.db2.gz VNDFUNSHPCEPJQ-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)c(Br)n2)[C@@H](C)C1 ZINC001233092748 1054185350 /nfs/dbraw/zinc/18/53/50/1054185350.db2.gz VNDFUNSHPCEPJQ-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccc(Cl)c(Br)n2)[C@@H](C)C1 ZINC001233092746 1054185673 /nfs/dbraw/zinc/18/56/73/1054185673.db2.gz VNDFUNSHPCEPJQ-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccc(Cl)c(Br)n2)[C@@H](C)C1 ZINC001233092746 1054185681 /nfs/dbraw/zinc/18/56/81/1054185681.db2.gz VNDFUNSHPCEPJQ-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO CC[N@H+](Cc1[nH]nc2cc(F)ccc21)Cc1cccc(F)c1F ZINC001233128475 1054188637 /nfs/dbraw/zinc/18/86/37/1054188637.db2.gz LLHNLQGRVLCULV-UHFFFAOYSA-N 1 2 319.330 4.002 20 0 DIADLO CC[N@@H+](Cc1[nH]nc2cc(F)ccc21)Cc1cccc(F)c1F ZINC001233128475 1054188642 /nfs/dbraw/zinc/18/86/42/1054188642.db2.gz LLHNLQGRVLCULV-UHFFFAOYSA-N 1 2 319.330 4.002 20 0 DIADLO CCC[C@H]([NH2+]Cc1cccnc1OCC)c1ncccc1Cl ZINC001334354996 1054188926 /nfs/dbraw/zinc/18/89/26/1054188926.db2.gz CNZWYACFTAVYKM-HNNXBMFYSA-N 1 2 319.836 4.160 20 0 DIADLO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)CC2 ZINC000638543257 1054196570 /nfs/dbraw/zinc/19/65/70/1054196570.db2.gz HCUICERUFNBSDN-ZWKOTPCHSA-N 1 2 310.445 4.012 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N[C@@H](CC(C)C)c3ccccc3)ccn12 ZINC001355721291 1054206912 /nfs/dbraw/zinc/20/69/12/1054206912.db2.gz RUKQBDYWTSFOKU-SFHVURJKSA-N 1 2 321.424 4.160 20 0 DIADLO Fc1ccc(-c2nc(C[N@H+]3CCCC[C@H](F)C3)cs2)cc1 ZINC001233240746 1054214577 /nfs/dbraw/zinc/21/45/77/1054214577.db2.gz PAXMMMPOMADURE-AWEZNQCLSA-N 1 2 308.397 4.273 20 0 DIADLO Fc1ccc(-c2nc(C[N@@H+]3CCCC[C@H](F)C3)cs2)cc1 ZINC001233240746 1054214585 /nfs/dbraw/zinc/21/45/85/1054214585.db2.gz PAXMMMPOMADURE-AWEZNQCLSA-N 1 2 308.397 4.273 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001335315068 1054214641 /nfs/dbraw/zinc/21/46/41/1054214641.db2.gz POJAPDADDMNRBT-IBGZPJMESA-N 1 2 320.440 4.142 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001335315068 1054214646 /nfs/dbraw/zinc/21/46/46/1054214646.db2.gz POJAPDADDMNRBT-IBGZPJMESA-N 1 2 320.440 4.142 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1cc(Br)ncc1Cl ZINC001233425149 1054270160 /nfs/dbraw/zinc/27/01/60/1054270160.db2.gz ORFQRTBJKGPQEJ-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(Cl)o1 ZINC001233317285 1054227847 /nfs/dbraw/zinc/22/78/47/1054227847.db2.gz GFJCKFKCPCDZOR-OAHLLOKOSA-N 1 2 305.805 4.416 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(Cl)o1 ZINC001233317285 1054227859 /nfs/dbraw/zinc/22/78/59/1054227859.db2.gz GFJCKFKCPCDZOR-OAHLLOKOSA-N 1 2 305.805 4.416 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCc3ccccc3[C@@H]2C)cc1F ZINC001233340520 1054240053 /nfs/dbraw/zinc/24/00/53/1054240053.db2.gz GJHWQTGHMFGYGP-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCc3ccccc3[C@@H]2C)cc1F ZINC001233340520 1054240060 /nfs/dbraw/zinc/24/00/60/1054240060.db2.gz GJHWQTGHMFGYGP-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+]1CCC(=O)[C@@H]2CCCC[C@@H]21 ZINC001233350933 1054244194 /nfs/dbraw/zinc/24/41/94/1054244194.db2.gz ZTSFSABWZKNMTD-DOMZBBRYSA-N 1 2 323.889 4.396 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+]1CCC(=O)[C@@H]2CCCC[C@@H]21 ZINC001233350933 1054244205 /nfs/dbraw/zinc/24/42/05/1054244205.db2.gz ZTSFSABWZKNMTD-DOMZBBRYSA-N 1 2 323.889 4.396 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+]1CCc2cnccc2C1 ZINC001233350748 1054245165 /nfs/dbraw/zinc/24/51/65/1054245165.db2.gz SCVWHDIGFHALIC-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+]1CCc2cnccc2C1 ZINC001233350748 1054245176 /nfs/dbraw/zinc/24/51/76/1054245176.db2.gz SCVWHDIGFHALIC-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO Cc1c2cc(F)ccc2sc1C(=O)Nc1c(C)c[nH+]cc1C ZINC001439227546 1054251382 /nfs/dbraw/zinc/25/13/82/1054251382.db2.gz WPZFRZHJIYUWGD-UHFFFAOYSA-N 1 2 314.385 4.035 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)c1F ZINC001233396090 1054258655 /nfs/dbraw/zinc/25/86/55/1054258655.db2.gz JJHXCMNESQIDBN-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO COc1ccc(C[N@H+]2Cc3ccccc3[C@H](C)C2)c(Cl)c1O ZINC001233397928 1054258708 /nfs/dbraw/zinc/25/87/08/1054258708.db2.gz QTLHIKSWYDEZDL-GFCCVEGCSA-N 1 2 317.816 4.174 20 0 DIADLO CC[N@H+](Cc1cn2ccc(Cl)cc2n1)Cc1ccccc1F ZINC001233392431 1054258820 /nfs/dbraw/zinc/25/88/20/1054258820.db2.gz YZDZMFBUIKPYKW-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO CC[N@@H+](Cc1cn2ccc(Cl)cc2n1)Cc1ccccc1F ZINC001233392431 1054258829 /nfs/dbraw/zinc/25/88/29/1054258829.db2.gz YZDZMFBUIKPYKW-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(c3ccccc3)[C@H](C)C(C)C)ccn12 ZINC001439319298 1054263667 /nfs/dbraw/zinc/26/36/67/1054263667.db2.gz WGHKHTUSCJTIBX-MRXNPFEDSA-N 1 2 321.424 4.334 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2csc(Br)c2)C1 ZINC001233412522 1054263988 /nfs/dbraw/zinc/26/39/88/1054263988.db2.gz GWMJUCAGUNQTAA-GFCCVEGCSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2csc(Br)c2)C1 ZINC001233412522 1054263997 /nfs/dbraw/zinc/26/39/97/1054263997.db2.gz GWMJUCAGUNQTAA-GFCCVEGCSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Br)ncc2Cl)[C@@H](C)C1 ZINC001233428153 1054271235 /nfs/dbraw/zinc/27/12/35/1054271235.db2.gz ZMGIVKJBSDCQAZ-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Br)ncc2Cl)[C@@H](C)C1 ZINC001233428153 1054271244 /nfs/dbraw/zinc/27/12/44/1054271244.db2.gz ZMGIVKJBSDCQAZ-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@@H+]1Cc1cc(Br)c(Cl)cc1F ZINC001233439108 1054273052 /nfs/dbraw/zinc/27/30/52/1054273052.db2.gz RWMQJQWBHGCYSW-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@H]1CCC[N@H+]1Cc1cc(Br)c(Cl)cc1F ZINC001233439108 1054273066 /nfs/dbraw/zinc/27/30/66/1054273066.db2.gz RWMQJQWBHGCYSW-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO F[C@@H]1C[N@H+](Cc2ccc3nc(Cl)ccc3c2)CCC1(F)F ZINC001233442533 1054274628 /nfs/dbraw/zinc/27/46/28/1054274628.db2.gz WZMNSRKWVSHMJZ-CYBMUJFWSA-N 1 2 314.738 4.067 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2ccc3nc(Cl)ccc3c2)CCC1(F)F ZINC001233442533 1054274639 /nfs/dbraw/zinc/27/46/39/1054274639.db2.gz WZMNSRKWVSHMJZ-CYBMUJFWSA-N 1 2 314.738 4.067 20 0 DIADLO Cn1c(Cl)ncc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000848880776 1054279429 /nfs/dbraw/zinc/27/94/29/1054279429.db2.gz HYUWYEWVSXFBFH-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1c(Cl)ncc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000848880776 1054279440 /nfs/dbraw/zinc/27/94/40/1054279440.db2.gz HYUWYEWVSXFBFH-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO Cc1nc(Cl)c(C[NH+]2CCC(C)CC2)cc1Br ZINC001233464837 1054280076 /nfs/dbraw/zinc/28/00/76/1054280076.db2.gz IONTWTOLKMPZCU-UHFFFAOYSA-N 1 2 317.658 4.038 20 0 DIADLO COc1ccc2c(c1)[C@H](Nc1ccc(C)[nH+]c1C)CCS2 ZINC001338751139 1054312084 /nfs/dbraw/zinc/31/20/84/1054312084.db2.gz XCCBUTVMUPBPPH-MRXNPFEDSA-N 1 2 300.427 4.356 20 0 DIADLO C[C@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C1CCCC1 ZINC001356316359 1054317771 /nfs/dbraw/zinc/31/77/71/1054317771.db2.gz JCCGWYSHGAXHCI-LBPRGKRZSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC001338992555 1054319682 /nfs/dbraw/zinc/31/96/82/1054319682.db2.gz LMIQEQJXJGEGOW-NSHDSACASA-N 1 2 323.223 4.169 20 0 DIADLO CSc1ccc(CCC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC001356376540 1054323475 /nfs/dbraw/zinc/32/34/75/1054323475.db2.gz IZIUBMHRBNQNHJ-UHFFFAOYSA-N 1 2 314.454 4.300 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(C(C)(C)C)n1)c1ccc2ncsc2c1 ZINC001341157254 1054378240 /nfs/dbraw/zinc/37/82/40/1054378240.db2.gz XEEDNLIYVWJWFM-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO CCN(C(=O)[C@H]1CC[C@@H](Nc2cccc[nH+]2)CC1)c1ccccc1 ZINC001441079672 1054381333 /nfs/dbraw/zinc/38/13/33/1054381333.db2.gz BIBRUFZBQNHXQY-CALCHBBNSA-N 1 2 323.440 4.105 20 0 DIADLO C[N@@H+](Cc1coc(-c2ccccc2)n1)Cc1cc2ccccc2[nH]1 ZINC001341569016 1054395254 /nfs/dbraw/zinc/39/52/54/1054395254.db2.gz JUEIKXXQASXGJY-UHFFFAOYSA-N 1 2 317.392 4.455 20 0 DIADLO C[N@H+](Cc1coc(-c2ccccc2)n1)Cc1cc2ccccc2[nH]1 ZINC001341569016 1054395265 /nfs/dbraw/zinc/39/52/65/1054395265.db2.gz JUEIKXXQASXGJY-UHFFFAOYSA-N 1 2 317.392 4.455 20 0 DIADLO c1ccc(C[NH+]2CC(Oc3ncccc3-c3ccccc3)C2)cc1 ZINC001233977421 1054404280 /nfs/dbraw/zinc/40/42/80/1054404280.db2.gz ZKBUMESDSGWABY-UHFFFAOYSA-N 1 2 316.404 4.012 20 0 DIADLO O=C(C/C=C/Cc1ccccc1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001442512523 1054424303 /nfs/dbraw/zinc/42/43/03/1054424303.db2.gz CTCAVJWHAXQOSQ-SNAWJCMRSA-N 1 2 317.392 4.204 20 0 DIADLO C[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001357253876 1054446139 /nfs/dbraw/zinc/44/61/39/1054446139.db2.gz HFHAFBOXXVJEKF-JSGCOSHPSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1cc(NC(=O)c2cc3occc3s2)ccc1-n1cc[nH+]c1 ZINC001443313480 1054447229 /nfs/dbraw/zinc/44/72/29/1054447229.db2.gz OMOWDUOVUCICOQ-UHFFFAOYSA-N 1 2 323.377 4.241 20 0 DIADLO Cc1cc(NC(=O)[C@H]2CCCC3(CC3)C2)ccc1-n1cc[nH+]c1 ZINC001443315241 1054447336 /nfs/dbraw/zinc/44/73/36/1054447336.db2.gz YJNPACMOTAPYIE-HNNXBMFYSA-N 1 2 309.413 4.090 20 0 DIADLO Cc1cccc(C[N@@H+](C)[C@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000671240179 1054456650 /nfs/dbraw/zinc/45/66/50/1054456650.db2.gz PBQQULGWPGAVAS-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1cccc(C[N@H+](C)[C@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000671240179 1054456655 /nfs/dbraw/zinc/45/66/55/1054456655.db2.gz PBQQULGWPGAVAS-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1nc(F)ccc1CNc1[nH+]c2ccccc2n1C(C)(C)C ZINC001343950165 1054458823 /nfs/dbraw/zinc/45/88/23/1054458823.db2.gz FWJUYILYWZGWBS-UHFFFAOYSA-N 1 2 312.392 4.246 20 0 DIADLO CC(C)CC[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C(C)(C)C ZINC001444081809 1054467820 /nfs/dbraw/zinc/46/78/20/1054467820.db2.gz HEXPJEJYDOZAJL-INIZCTEOSA-N 1 2 301.434 4.144 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(CO)o1)c1cc(F)c(Cl)cc1Cl ZINC000174237769 1054504725 /nfs/dbraw/zinc/50/47/25/1054504725.db2.gz HBXQTBXDNVFMRZ-QMMMGPOBSA-N 1 2 318.175 4.069 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3CCC[C@@H](F)C3)c2)[nH+]c1C ZINC001345639455 1054505543 /nfs/dbraw/zinc/50/55/43/1054505543.db2.gz UCCFCBVOVCIRCA-LSDHHAIUSA-N 1 2 315.392 4.160 20 0 DIADLO FC(F)Oc1ccc(Cl)cc1C[NH+]1CC2(C1)CCCC2 ZINC001234413389 1054518462 /nfs/dbraw/zinc/51/84/62/1054518462.db2.gz KWRUYEODUCJICC-UHFFFAOYSA-N 1 2 301.764 4.317 20 0 DIADLO Fc1cccc(F)c1[C@H]1CC[N@H+](Cc2cnc(Cl)s2)C1 ZINC000185331788 1054522957 /nfs/dbraw/zinc/52/29/57/1054522957.db2.gz IWBBFRATLJRGPT-VIFPVBQESA-N 1 2 314.788 4.064 20 0 DIADLO Fc1cccc(F)c1[C@H]1CC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC000185331788 1054522970 /nfs/dbraw/zinc/52/29/70/1054522970.db2.gz IWBBFRATLJRGPT-VIFPVBQESA-N 1 2 314.788 4.064 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2cscn2)cc1Cl ZINC000671295653 1054528135 /nfs/dbraw/zinc/52/81/35/1054528135.db2.gz YBVJUZNTPGRYAL-LLVKDONJSA-N 1 2 310.850 4.435 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1cc(-c2cccs2)on1 ZINC000623120646 1054535023 /nfs/dbraw/zinc/53/50/23/1054535023.db2.gz FKCKQWXUQIPTMT-UHFFFAOYSA-N 1 2 304.337 4.177 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1cc(-c2cccs2)on1 ZINC000623120646 1054535042 /nfs/dbraw/zinc/53/50/42/1054535042.db2.gz FKCKQWXUQIPTMT-UHFFFAOYSA-N 1 2 304.337 4.177 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1coc(-c2ccc(F)cc2)n1 ZINC000623120684 1054536053 /nfs/dbraw/zinc/53/60/53/1054536053.db2.gz HFKJSGBFKBYLDY-UHFFFAOYSA-N 1 2 316.298 4.255 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1coc(-c2ccc(F)cc2)n1 ZINC000623120684 1054536068 /nfs/dbraw/zinc/53/60/68/1054536068.db2.gz HFKJSGBFKBYLDY-UHFFFAOYSA-N 1 2 316.298 4.255 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Nc1cccc(Oc2ccccc2)c1 ZINC000623238975 1054548480 /nfs/dbraw/zinc/54/84/80/1054548480.db2.gz FQGCZQRQFKGLEC-UHFFFAOYSA-N 1 2 321.380 4.094 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@H](C)COc2ccccc2C)cc1 ZINC001234589065 1054550491 /nfs/dbraw/zinc/55/04/91/1054550491.db2.gz WLPMCRMIDBPBQR-OAHLLOKOSA-N 1 2 313.397 4.203 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccccc2F)c(OC(C)C)c1 ZINC001234715088 1054583194 /nfs/dbraw/zinc/58/31/94/1054583194.db2.gz QXJLZHVOWIPCBI-UHFFFAOYSA-N 1 2 317.404 4.254 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccccc2F)c(OC(C)C)c1 ZINC001234715088 1054583205 /nfs/dbraw/zinc/58/32/05/1054583205.db2.gz QXJLZHVOWIPCBI-UHFFFAOYSA-N 1 2 317.404 4.254 20 0 DIADLO Cc1cc(C)c(C(=O)N(C)[C@@H]2CCCc3ccccc32)c(C)[nH+]1 ZINC001347832000 1054588157 /nfs/dbraw/zinc/58/81/57/1054588157.db2.gz TXWVZLOCIWAYTO-GOSISDBHSA-N 1 2 308.425 4.156 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C)C(C)(C)c2ccccc2)c(C)[nH+]1 ZINC001358135244 1054606785 /nfs/dbraw/zinc/60/67/85/1054606785.db2.gz WPAOKCKUXRUHTQ-INIZCTEOSA-N 1 2 310.441 4.103 20 0 DIADLO Cc1cc(NC(=O)Cc2ccc(C3CCCCC3)cc2)c(C)c[nH+]1 ZINC001358141656 1054608581 /nfs/dbraw/zinc/60/85/81/1054608581.db2.gz SEXJEEJBAMVHQU-UHFFFAOYSA-N 1 2 322.452 4.349 20 0 DIADLO CC(C)C[C@H](C(=O)N(CC(C)C)c1ccccc1)n1cc[nH+]c1 ZINC001449219585 1054616709 /nfs/dbraw/zinc/61/67/09/1054616709.db2.gz KNCWBMVMMXPDHI-GOSISDBHSA-N 1 2 313.445 4.160 20 0 DIADLO CC(C)c1ocnc1C[N@@H+]1CCc2cc(C(F)(F)F)ccc2C1 ZINC001348247691 1054623524 /nfs/dbraw/zinc/62/35/24/1054623524.db2.gz LVQKONGRXUQYIN-UHFFFAOYSA-N 1 2 324.346 4.375 20 0 DIADLO CC(C)c1ocnc1C[N@H+]1CCc2cc(C(F)(F)F)ccc2C1 ZINC001348247691 1054623527 /nfs/dbraw/zinc/62/35/27/1054623527.db2.gz LVQKONGRXUQYIN-UHFFFAOYSA-N 1 2 324.346 4.375 20 0 DIADLO Cc1cn2cc(NC(=O)C[C@@H]3C[C@H](C)CC(C)(C)C3)ccc2[nH+]1 ZINC001358364368 1054665111 /nfs/dbraw/zinc/66/51/11/1054665111.db2.gz WQYYNCWJQBMERH-ZFWWWQNUSA-N 1 2 313.445 4.434 20 0 DIADLO Cc1cn2cc(NC(=O)C[C@H]3C[C@H](C)CC(C)(C)C3)ccc2[nH+]1 ZINC001358364365 1054665315 /nfs/dbraw/zinc/66/53/15/1054665315.db2.gz WQYYNCWJQBMERH-DZGCQCFKSA-N 1 2 313.445 4.434 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000179138219 1054668435 /nfs/dbraw/zinc/66/84/35/1054668435.db2.gz CUZLCCHKIPHNEH-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000179138219 1054668442 /nfs/dbraw/zinc/66/84/42/1054668442.db2.gz CUZLCCHKIPHNEH-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H]3[C@@H](c4ccccc4)C3(C)C)ccc2[nH+]1 ZINC001358373390 1054669563 /nfs/dbraw/zinc/66/95/63/1054669563.db2.gz WUDJCGWZNAXHRX-MSOLQXFVSA-N 1 2 319.408 4.021 20 0 DIADLO Cc1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccc(C)nc2)c(F)c1 ZINC001235199745 1054683096 /nfs/dbraw/zinc/68/30/96/1054683096.db2.gz VXXPIMWOIFQMNK-SFHVURJKSA-N 1 2 302.368 4.314 20 0 DIADLO Cc1cc(F)c(C[N@H+]2CCC[C@H]2c2ccc(C)nc2)c(F)c1 ZINC001235199745 1054683103 /nfs/dbraw/zinc/68/31/03/1054683103.db2.gz VXXPIMWOIFQMNK-SFHVURJKSA-N 1 2 302.368 4.314 20 0 DIADLO COc1cc(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)ccc1O ZINC000179504453 1054685491 /nfs/dbraw/zinc/68/54/91/1054685491.db2.gz USSWLXDHUKUGMT-UHFFFAOYSA-N 1 2 315.417 4.050 20 0 DIADLO CCO[C@@H](C)c1nc(C[NH2+]C(C)(C)c2cccc(F)c2)cs1 ZINC000179574462 1054688237 /nfs/dbraw/zinc/68/82/37/1054688237.db2.gz AJMPQCVLGSDYIL-LBPRGKRZSA-N 1 2 322.449 4.405 20 0 DIADLO Cc1cccc(C(C)(C)[NH2+]Cc2noc(-c3ccccc3C)n2)c1 ZINC000179595623 1054690678 /nfs/dbraw/zinc/69/06/78/1054690678.db2.gz HMAUPHWLMYTOIU-UHFFFAOYSA-N 1 2 321.424 4.378 20 0 DIADLO C[C@H](CC(=O)N(Cc1ccccc1)c1ccccc1)n1cc[nH+]c1 ZINC001348890005 1054690677 /nfs/dbraw/zinc/69/06/77/1054690677.db2.gz SLEPKJXPDVXNEB-QGZVFWFLSA-N 1 2 319.408 4.068 20 0 DIADLO c1coc(C[N@H+](Cc2ccccc2)Cc2cccc3nccn32)c1 ZINC000179582605 1054690787 /nfs/dbraw/zinc/69/07/87/1054690787.db2.gz MWKHAFBWTMJNAW-UHFFFAOYSA-N 1 2 317.392 4.130 20 0 DIADLO c1coc(C[N@@H+](Cc2ccccc2)Cc2cccc3nccn32)c1 ZINC000179582605 1054690790 /nfs/dbraw/zinc/69/07/90/1054690790.db2.gz MWKHAFBWTMJNAW-UHFFFAOYSA-N 1 2 317.392 4.130 20 0 DIADLO C[C@@H](CC(=O)N(Cc1ccccc1)c1ccccc1)n1cc[nH+]c1 ZINC001348889563 1054690926 /nfs/dbraw/zinc/69/09/26/1054690926.db2.gz SLEPKJXPDVXNEB-KRWDZBQOSA-N 1 2 319.408 4.068 20 0 DIADLO C[N@H+](Cc1cc2cccc(F)c2[nH]1)Cc1cccc(F)c1F ZINC001235253342 1054692003 /nfs/dbraw/zinc/69/20/03/1054692003.db2.gz RDRDYXBWAJDSQV-UHFFFAOYSA-N 1 2 304.315 4.217 20 0 DIADLO C[N@@H+](Cc1cc2cccc(F)c2[nH]1)Cc1cccc(F)c1F ZINC001235253342 1054692010 /nfs/dbraw/zinc/69/20/10/1054692010.db2.gz RDRDYXBWAJDSQV-UHFFFAOYSA-N 1 2 304.315 4.217 20 0 DIADLO CCc1cccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)n1 ZINC001235263982 1054694643 /nfs/dbraw/zinc/69/46/43/1054694643.db2.gz KOFSTSSNCSEHRU-KRWDZBQOSA-N 1 2 302.368 4.259 20 0 DIADLO CCc1cccc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)n1 ZINC001235263982 1054694650 /nfs/dbraw/zinc/69/46/50/1054694650.db2.gz KOFSTSSNCSEHRU-KRWDZBQOSA-N 1 2 302.368 4.259 20 0 DIADLO CCc1nnc(C[NH2+][C@H](CC(C)C)c2ccc(Cl)cc2)o1 ZINC000179716649 1054698557 /nfs/dbraw/zinc/69/85/57/1054698557.db2.gz OOWSDYDHHIVVJM-CQSZACIVSA-N 1 2 307.825 4.162 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)c(F)cn1 ZINC001235314965 1054699929 /nfs/dbraw/zinc/69/99/29/1054699929.db2.gz CMNMGOPVNPLLOZ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)c(F)cn1 ZINC001235314965 1054699934 /nfs/dbraw/zinc/69/99/34/1054699934.db2.gz CMNMGOPVNPLLOZ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1cnc(F)c(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)c1 ZINC001235336455 1054702313 /nfs/dbraw/zinc/70/23/13/1054702313.db2.gz ZSFQICIFDDOZNB-QGZVFWFLSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1cnc(F)c(C[N@H+]2CCCC[C@@H]2c2ccccc2F)c1 ZINC001235336455 1054702320 /nfs/dbraw/zinc/70/23/20/1054702320.db2.gz ZSFQICIFDDOZNB-QGZVFWFLSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1cnc(F)c(C[N@H+](C)Cc2ccccc2C(F)(F)F)c1 ZINC001235339649 1054703186 /nfs/dbraw/zinc/70/31/86/1054703186.db2.gz NYJHJCKZHGGSFK-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1cnc(F)c(C[N@@H+](C)Cc2ccccc2C(F)(F)F)c1 ZINC001235339649 1054703202 /nfs/dbraw/zinc/70/32/02/1054703202.db2.gz NYJHJCKZHGGSFK-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO CC[C@@H]1CCCC[C@H]1[N@H+](C)Cc1ncsc1Br ZINC001473387643 1054703145 /nfs/dbraw/zinc/70/31/45/1054703145.db2.gz AUCIMQOSKKYFCV-ZYHUDNBSSA-N 1 2 317.296 4.306 20 0 DIADLO CC[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ncsc1Br ZINC001473387643 1054703156 /nfs/dbraw/zinc/70/31/56/1054703156.db2.gz AUCIMQOSKKYFCV-ZYHUDNBSSA-N 1 2 317.296 4.306 20 0 DIADLO CCOc1cc(O)cc(C[N@@H+]2CCc3cccc(Cl)c3C2)c1 ZINC001235400346 1054712298 /nfs/dbraw/zinc/71/22/98/1054712298.db2.gz GSXJGYPNYSJZTM-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1cc(O)cc(C[N@H+]2CCc3cccc(Cl)c3C2)c1 ZINC001235400346 1054712308 /nfs/dbraw/zinc/71/23/08/1054712308.db2.gz GSXJGYPNYSJZTM-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1cc(O)cc(C[N@H+](C)Cc2ccccc2Cl)c1 ZINC001235399168 1054713008 /nfs/dbraw/zinc/71/30/08/1054713008.db2.gz YAEZECAOWVQQRI-UHFFFAOYSA-N 1 2 305.805 4.076 20 0 DIADLO CCOc1cc(O)cc(C[N@@H+](C)Cc2ccccc2Cl)c1 ZINC001235399168 1054713020 /nfs/dbraw/zinc/71/30/20/1054713020.db2.gz YAEZECAOWVQQRI-UHFFFAOYSA-N 1 2 305.805 4.076 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1nc2ccccc2s1 ZINC000179916002 1054717116 /nfs/dbraw/zinc/71/71/16/1054717116.db2.gz LDJDLXQYFLCWBD-NSHDSACASA-N 1 2 316.401 4.295 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccc(C)nc2)cc(F)c1F ZINC001235441741 1054721026 /nfs/dbraw/zinc/72/10/26/1054721026.db2.gz RNDGZZOJDZFHHF-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccc(C)nc2)cc(F)c1F ZINC001235441741 1054721045 /nfs/dbraw/zinc/72/10/45/1054721045.db2.gz RNDGZZOJDZFHHF-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)[C@@H](C)[N@@H+]1CCC(C)=C(C)C1 ZINC001473431382 1054721230 /nfs/dbraw/zinc/72/12/30/1054721230.db2.gz CDUGMZDOBDDPTP-CQSZACIVSA-N 1 2 306.837 4.018 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)[C@@H](C)[N@H+]1CCC(C)=C(C)C1 ZINC001473431382 1054721246 /nfs/dbraw/zinc/72/12/46/1054721246.db2.gz CDUGMZDOBDDPTP-CQSZACIVSA-N 1 2 306.837 4.018 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3ccncc3Cl)CCC2)c(F)c1 ZINC000179990737 1054724188 /nfs/dbraw/zinc/72/41/88/1054724188.db2.gz VEEGTHISMXZFCJ-UHFFFAOYSA-N 1 2 308.759 4.182 20 0 DIADLO COc1cc(C[N@H+](C)Cc2ccccc2Cl)cc(F)c1F ZINC001235448960 1054726006 /nfs/dbraw/zinc/72/60/06/1054726006.db2.gz PPGFYSUCRLCXOI-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2ccccc2Cl)cc(F)c1F ZINC001235448960 1054726024 /nfs/dbraw/zinc/72/60/24/1054726024.db2.gz PPGFYSUCRLCXOI-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO Fc1ccccc1C1CC[NH+](Cc2cncc(F)c2Cl)CC1 ZINC001235494486 1054730222 /nfs/dbraw/zinc/73/02/22/1054730222.db2.gz GRCCHCFXXSOKKJ-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cncc(F)c2Cl)cc1 ZINC001235497629 1054732912 /nfs/dbraw/zinc/73/29/12/1054732912.db2.gz WPVHDVJBZRSKLL-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cncc(F)c2Cl)cc1 ZINC001235497629 1054732922 /nfs/dbraw/zinc/73/29/22/1054732922.db2.gz WPVHDVJBZRSKLL-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cncc(F)c1Cl ZINC001235498791 1054733642 /nfs/dbraw/zinc/73/36/42/1054733642.db2.gz JUQBGPRWQMAYTE-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cncc(F)c1Cl ZINC001235498791 1054733658 /nfs/dbraw/zinc/73/36/58/1054733658.db2.gz JUQBGPRWQMAYTE-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO FC(F)(F)c1ccccc1CNc1ccc(N2CCCC2)c[nH+]1 ZINC000513054770 1054742646 /nfs/dbraw/zinc/74/26/46/1054742646.db2.gz SAYJDESQODQPJU-UHFFFAOYSA-N 1 2 321.346 4.313 20 0 DIADLO Cc1ccnc(C[N@@H+]2CCCC[C@H]2c2cccnc2)c1Cl ZINC001235581408 1054743653 /nfs/dbraw/zinc/74/36/53/1054743653.db2.gz PYOGGNRLQDWPDB-INIZCTEOSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1ccnc(C[N@H+]2CCCC[C@H]2c2cccnc2)c1Cl ZINC001235581408 1054743668 /nfs/dbraw/zinc/74/36/68/1054743668.db2.gz PYOGGNRLQDWPDB-INIZCTEOSA-N 1 2 301.821 4.166 20 0 DIADLO Clc1cc(C[N@@H+]2CCCC3(COC3)C2)cc(Cl)c1Cl ZINC001235589168 1054745959 /nfs/dbraw/zinc/74/59/59/1054745959.db2.gz HQHYWQISYHRLJE-UHFFFAOYSA-N 1 2 320.647 4.259 20 0 DIADLO Clc1cc(C[N@H+]2CCCC3(COC3)C2)cc(Cl)c1Cl ZINC001235589168 1054745978 /nfs/dbraw/zinc/74/59/78/1054745978.db2.gz HQHYWQISYHRLJE-UHFFFAOYSA-N 1 2 320.647 4.259 20 0 DIADLO Cc1ccnc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1Cl ZINC001235586257 1054747438 /nfs/dbraw/zinc/74/74/38/1054747438.db2.gz RGSXXHZEFJLEAX-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccnc(C[N@H+]2CCSC[C@H]2c2ccccc2)c1Cl ZINC001235586257 1054747461 /nfs/dbraw/zinc/74/74/61/1054747461.db2.gz RGSXXHZEFJLEAX-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO CC(C)(C)[C@@H]1CSCC[N@@H+]1Cc1ccc(Cl)nc1Cl ZINC001473749548 1054757765 /nfs/dbraw/zinc/75/77/65/1054757765.db2.gz IHNANCXSBOOTQM-NSHDSACASA-N 1 2 319.301 4.352 20 0 DIADLO CC(C)(C)[C@@H]1CSCC[N@H+]1Cc1ccc(Cl)nc1Cl ZINC001473749548 1054757776 /nfs/dbraw/zinc/75/77/76/1054757776.db2.gz IHNANCXSBOOTQM-NSHDSACASA-N 1 2 319.301 4.352 20 0 DIADLO CC(C)(C)OC(=O)n1cccc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001235641802 1054760421 /nfs/dbraw/zinc/76/04/21/1054760421.db2.gz IYFDXFWCPIUKKH-QGZVFWFLSA-N 1 2 312.413 4.218 20 0 DIADLO CC(C)(C)OC(=O)n1cccc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC001235641802 1054760437 /nfs/dbraw/zinc/76/04/37/1054760437.db2.gz IYFDXFWCPIUKKH-QGZVFWFLSA-N 1 2 312.413 4.218 20 0 DIADLO Nc1ccnc(Cl)c1C[N@@H+]1CCCC[C@H]1c1ccccc1F ZINC001235676580 1054770586 /nfs/dbraw/zinc/77/05/86/1054770586.db2.gz BKOOCDYRZMFSOZ-INIZCTEOSA-N 1 2 319.811 4.184 20 0 DIADLO Nc1ccnc(Cl)c1C[N@H+]1CCCC[C@H]1c1ccccc1F ZINC001235676580 1054770597 /nfs/dbraw/zinc/77/05/97/1054770597.db2.gz BKOOCDYRZMFSOZ-INIZCTEOSA-N 1 2 319.811 4.184 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2ncc(C)s2)c2ccccc2)cc1 ZINC000180644384 1054772811 /nfs/dbraw/zinc/77/28/11/1054772811.db2.gz JCHWOEGPBXYVGW-IBGZPJMESA-N 1 2 324.449 4.339 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@H](Cc4ccccc4)C3)[nH]c2c1 ZINC001235691877 1054777109 /nfs/dbraw/zinc/77/71/09/1054777109.db2.gz KSWQRRTZDNUYJA-MRXNPFEDSA-N 1 2 323.415 4.157 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@H](Cc4ccccc4)C3)[nH]c2c1 ZINC001235691877 1054777124 /nfs/dbraw/zinc/77/71/24/1054777124.db2.gz KSWQRRTZDNUYJA-MRXNPFEDSA-N 1 2 323.415 4.157 20 0 DIADLO Cc1ccc(Br)c(C[NH+]2CC3(C2)CCCC3)c1F ZINC001235748590 1054797291 /nfs/dbraw/zinc/79/72/91/1054797291.db2.gz UPCPPZURBFATPV-UHFFFAOYSA-N 1 2 312.226 4.273 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCCc3scnc31)CCCO2 ZINC000623877356 1054799142 /nfs/dbraw/zinc/79/91/42/1054799142.db2.gz ZVSABLMVURMJEN-ZIAGYGMSSA-N 1 2 318.417 4.163 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+][C@H]1CCCc3scnc31)CCCO2 ZINC000623877354 1054800525 /nfs/dbraw/zinc/80/05/25/1054800525.db2.gz ZVSABLMVURMJEN-KGLIPLIRSA-N 1 2 318.417 4.163 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2C[C@@H](C)C[C@H]2CF)c1Br ZINC001235760656 1054802340 /nfs/dbraw/zinc/80/23/40/1054802340.db2.gz SHPZDROUEIQTQL-ONGXEEELSA-N 1 2 318.205 4.077 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2C[C@@H](C)C[C@H]2CF)c1Br ZINC001235760656 1054802351 /nfs/dbraw/zinc/80/23/51/1054802351.db2.gz SHPZDROUEIQTQL-ONGXEEELSA-N 1 2 318.205 4.077 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@H](F)C2)ccc1OCc1ccccc1 ZINC001235769103 1054804354 /nfs/dbraw/zinc/80/43/54/1054804354.db2.gz KMJXOXPUIAPNQU-KRWDZBQOSA-N 1 2 317.379 4.339 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@H](F)C2)ccc1OCc1ccccc1 ZINC001235769103 1054804366 /nfs/dbraw/zinc/80/43/66/1054804366.db2.gz KMJXOXPUIAPNQU-KRWDZBQOSA-N 1 2 317.379 4.339 20 0 DIADLO CC(C)Oc1ccccc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000623870377 1054804455 /nfs/dbraw/zinc/80/44/55/1054804455.db2.gz XXBZLBCJPVQOGY-CQSZACIVSA-N 1 2 302.443 4.098 20 0 DIADLO COc1nccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c1Cl ZINC001235828922 1054814785 /nfs/dbraw/zinc/81/47/85/1054814785.db2.gz BODYWQJUAPECCV-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c1Cl ZINC001235828922 1054814798 /nfs/dbraw/zinc/81/47/98/1054814798.db2.gz BODYWQJUAPECCV-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)c1cc(N[C@@H]2CCOC3(CCC3)C2)nc(C(C)C)[nH+]1 ZINC000534142259 1054815927 /nfs/dbraw/zinc/81/59/27/1054815927.db2.gz DTIROSYDJHEZIJ-CQSZACIVSA-N 1 2 303.450 4.237 20 0 DIADLO COc1nccc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c1Cl ZINC001235841974 1054818335 /nfs/dbraw/zinc/81/83/35/1054818335.db2.gz JSWBGWHNWLXMSS-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(C[N@H+]2CCC[C@@H]2c2ccccc2F)c1Cl ZINC001235841974 1054818345 /nfs/dbraw/zinc/81/83/45/1054818345.db2.gz JSWBGWHNWLXMSS-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1c(Br)ccnc1Cl ZINC001235869441 1054826388 /nfs/dbraw/zinc/82/63/88/1054826388.db2.gz AYOAOINOEUJDKG-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1c(Br)ccnc1Cl ZINC001235869441 1054826391 /nfs/dbraw/zinc/82/63/91/1054826391.db2.gz AYOAOINOEUJDKG-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO CCc1ccc2nc(NCc3cccc4[nH+]ccn43)sc2c1 ZINC000537506279 1054838964 /nfs/dbraw/zinc/83/89/64/1054838964.db2.gz MHWSKJLLPJLENH-UHFFFAOYSA-N 1 2 308.410 4.119 20 0 DIADLO COc1c2ccccc2oc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000623968693 1054839644 /nfs/dbraw/zinc/83/96/44/1054839644.db2.gz KYBKHLDEDXWKHP-GFCCVEGCSA-N 1 2 314.410 4.065 20 0 DIADLO Fc1cc(C[NH2+][C@@H]2CCCc3scnc32)c(F)cc1Cl ZINC000623973616 1054842283 /nfs/dbraw/zinc/84/22/83/1054842283.db2.gz VRIBSGQGCJMCKA-GFCCVEGCSA-N 1 2 314.788 4.242 20 0 DIADLO Fc1cc2c(c(F)c1F)[C@H]([NH2+][C@H]1CCCc3scnc31)CC2 ZINC000623996131 1054850658 /nfs/dbraw/zinc/85/06/58/1054850658.db2.gz UTPKWRBYFVXISK-MNOVXSKESA-N 1 2 324.371 4.215 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(OC(C)(C)C)cc3)nn2)c1C ZINC001235928691 1054852450 /nfs/dbraw/zinc/85/24/50/1054852450.db2.gz LILPGLBQUPOQGY-UHFFFAOYSA-N 1 2 322.412 4.123 20 0 DIADLO FC(F)(F)Oc1ccc(-c2ccccc2Cn2cc[nH+]c2)cc1 ZINC001235938480 1054859137 /nfs/dbraw/zinc/85/91/37/1054859137.db2.gz GPAUHRHONFEZEF-UHFFFAOYSA-N 1 2 318.298 4.497 20 0 DIADLO Nc1cn2ccc(/C=C/c3ccc(C(F)(F)F)cc3)cc2[nH+]1 ZINC001235979574 1054878305 /nfs/dbraw/zinc/87/83/05/1054878305.db2.gz IGQGVCWYXCNPRN-OWOJBTEDSA-N 1 2 303.287 4.106 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2cccc(F)c2)C2CCCC2)n1 ZINC000180997090 1054898398 /nfs/dbraw/zinc/89/83/98/1054898398.db2.gz IZUKZXHVFGTVAK-SFHVURJKSA-N 1 2 317.408 4.182 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@H](c2cccc(F)c2)C(C)(C)C)n1 ZINC000181066918 1054901062 /nfs/dbraw/zinc/90/10/62/1054901062.db2.gz QVFIQSPIFZWNRG-QGZVFWFLSA-N 1 2 319.424 4.284 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@H](CC)c2ccc(C)cc2)n1 ZINC000181677220 1054929822 /nfs/dbraw/zinc/92/98/22/1054929822.db2.gz NDDYMIQUAZFIJS-DZGCQCFKSA-N 1 2 319.474 4.433 20 0 DIADLO COc1ccc(-c2cccc(C3CC3)c2)cc1C[NH+]1CCOCC1 ZINC001236088031 1054935827 /nfs/dbraw/zinc/93/58/27/1054935827.db2.gz QUUOQIGSRJRRFD-UHFFFAOYSA-N 1 2 323.436 4.072 20 0 DIADLO CC[N@H+](Cc1ccc(N)c(F)c1)Cc1c(F)cccc1Cl ZINC001236103878 1054946051 /nfs/dbraw/zinc/94/60/51/1054946051.db2.gz FIUHXWDYNMXEQR-UHFFFAOYSA-N 1 2 310.775 4.223 20 0 DIADLO CC[N@@H+](Cc1ccc(N)c(F)c1)Cc1c(F)cccc1Cl ZINC001236103878 1054946063 /nfs/dbraw/zinc/94/60/63/1054946063.db2.gz FIUHXWDYNMXEQR-UHFFFAOYSA-N 1 2 310.775 4.223 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3cc(N)ccc3C2)c(Cl)cc1Cl ZINC001236107717 1054952342 /nfs/dbraw/zinc/95/23/42/1054952342.db2.gz AWCZQQUUDQTPRC-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO Cc1cc(C[N@H+]2CCc3cc(N)ccc3C2)c(Cl)cc1Cl ZINC001236107717 1054952356 /nfs/dbraw/zinc/95/23/56/1054952356.db2.gz AWCZQQUUDQTPRC-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)C)no2)cc1 ZINC000182117897 1054961732 /nfs/dbraw/zinc/96/17/32/1054961732.db2.gz KHFOCKORBGEDKL-GFCCVEGCSA-N 1 2 305.447 4.156 20 0 DIADLO Cc1cc(C)c(NC(=O)CCc2ccc3[nH]ccc3c2)c(C)[nH+]1 ZINC000182260344 1054975939 /nfs/dbraw/zinc/97/59/39/1054975939.db2.gz QPJSQYAAGFKLTN-UHFFFAOYSA-N 1 2 307.397 4.059 20 0 DIADLO CCc1ccc(-c2noc(C[NH2+][C@H](C)c3ccc(C)cc3)n2)cc1 ZINC000182320967 1054979299 /nfs/dbraw/zinc/97/92/99/1054979299.db2.gz ZLMTYFFLPAVYFP-OAHLLOKOSA-N 1 2 321.424 4.458 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(-c2ccoc2)no1)c1cccc(Cl)c1 ZINC000182590216 1054997638 /nfs/dbraw/zinc/99/76/38/1054997638.db2.gz OWFBBLYEIWVYOZ-AWEZNQCLSA-N 1 2 317.776 4.224 20 0 DIADLO CC(C)(C)c1ccc(C2([NH2+]Cc3csnn3)CCCC2)cc1 ZINC000182665863 1055002465 /nfs/dbraw/zinc/00/24/65/1055002465.db2.gz MYPRLTSTPWWSLF-UHFFFAOYSA-N 1 2 315.486 4.395 20 0 DIADLO CCC(CC)C[NH2+][C@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000182680820 1055004179 /nfs/dbraw/zinc/00/41/79/1055004179.db2.gz DTWAKZCERQKAFD-HNNXBMFYSA-N 1 2 307.825 4.147 20 0 DIADLO COc1cc(C)cc(F)c1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001236230041 1055018764 /nfs/dbraw/zinc/01/87/64/1055018764.db2.gz MSHDZXQFAOQMRQ-UHFFFAOYSA-N 1 2 300.308 4.135 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nc(CCC(C)C)no2)c(C)s1 ZINC000182986507 1055021575 /nfs/dbraw/zinc/02/15/75/1055021575.db2.gz YUIDLHANWIDFQD-LBPRGKRZSA-N 1 2 307.463 4.187 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ncc(C(C)C)s2)cc1C ZINC000183032540 1055025715 /nfs/dbraw/zinc/02/57/15/1055025715.db2.gz VLVNKTXOMYMBNO-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ncc(C(C)C)s2)cc1C ZINC000183032540 1055025724 /nfs/dbraw/zinc/02/57/24/1055025724.db2.gz VLVNKTXOMYMBNO-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO CC(C)CCn1ccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000183052080 1055026195 /nfs/dbraw/zinc/02/61/95/1055026195.db2.gz FBMPSMLTNCPZQL-MRXNPFEDSA-N 1 2 323.444 4.288 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](CC(C)C)c2ccccc2C)n1 ZINC000183235912 1055035612 /nfs/dbraw/zinc/03/56/12/1055035612.db2.gz QFLBFSDIICPNDX-INIZCTEOSA-N 1 2 301.434 4.208 20 0 DIADLO COc1ccc(F)cc1N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000183302397 1055040932 /nfs/dbraw/zinc/04/09/32/1055040932.db2.gz UNTVPYWVMSKTLI-ZDUSSCGKSA-N 1 2 311.360 4.193 20 0 DIADLO CC(C)C(=O)Nc1ccc(-c2cc[nH+]c(N3CCCCC3)c2)cc1 ZINC001236261840 1055044035 /nfs/dbraw/zinc/04/40/35/1055044035.db2.gz YDHSRONVXNJANO-UHFFFAOYSA-N 1 2 323.440 4.333 20 0 DIADLO CC(C)C(=O)Nc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001236263459 1055044323 /nfs/dbraw/zinc/04/43/23/1055044323.db2.gz HLOUQASUBUIMOP-UHFFFAOYSA-N 1 2 319.408 4.193 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccc(-c3ccccc3)cc2)c[nH+]1 ZINC001536109015 1055048702 /nfs/dbraw/zinc/04/87/02/1055048702.db2.gz IATVYUXRWSSRSH-UHFFFAOYSA-N 1 2 316.404 4.295 20 0 DIADLO Nc1ccc(-c2ccc(-c3nnc(-c4ccccc4)o3)cc2)c[nH+]1 ZINC001236313287 1055053161 /nfs/dbraw/zinc/05/31/61/1055053161.db2.gz LKXLAYVBZAFUKN-UHFFFAOYSA-N 1 2 314.348 4.048 20 0 DIADLO O=C(Nc1ccc(-c2cccn3cc[nH+]c23)cc1)c1ccccc1 ZINC001236331945 1055061180 /nfs/dbraw/zinc/06/11/80/1055061180.db2.gz KGJGYDWCEMIZMJ-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO Cc1c(-c2cccc(-c3c[nH+]cn3C)c2)cnn1-c1ccccc1 ZINC001236402370 1055094725 /nfs/dbraw/zinc/09/47/25/1055094725.db2.gz AHLJFIJBIDTDQV-UHFFFAOYSA-N 1 2 314.392 4.248 20 0 DIADLO CC(C)COC[C@@H]([NH2+]Cc1sccc1Cl)c1ccco1 ZINC000193073645 1055099691 /nfs/dbraw/zinc/09/96/91/1055099691.db2.gz KUZKLOXYDOPZCW-CYBMUJFWSA-N 1 2 313.850 4.498 20 0 DIADLO COc1cc(CNc2cc(C)c[nH+]c2C)c(SC)cc1OC ZINC000404608765 1055119945 /nfs/dbraw/zinc/11/99/45/1055119945.db2.gz QUBIDGUMWATVCC-UHFFFAOYSA-N 1 2 318.442 4.050 20 0 DIADLO Cc1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)c(N(C)C)[nH+]1 ZINC001536523337 1055122778 /nfs/dbraw/zinc/12/27/78/1055122778.db2.gz OIMGSNJXVJTYJR-UHFFFAOYSA-N 1 2 324.211 4.015 20 0 DIADLO CCCOc1ccc(Cl)cc1-c1c[nH+]c2c(c1)CCCN2 ZINC001236456518 1055124505 /nfs/dbraw/zinc/12/45/05/1055124505.db2.gz COUVZHPPTQDDCM-UHFFFAOYSA-N 1 2 302.805 4.192 20 0 DIADLO CC[C@@H](OC(=O)CCCn1cc[nH+]c1)c1c(F)cccc1Cl ZINC000764275571 1055145133 /nfs/dbraw/zinc/14/51/33/1055145133.db2.gz SJEZXDVLYQOTLP-CQSZACIVSA-N 1 2 324.783 4.150 20 0 DIADLO CCOc1ncc(Cl)cc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001236499780 1055150529 /nfs/dbraw/zinc/15/05/29/1055150529.db2.gz UVEPUCXXHGPACM-UHFFFAOYSA-N 1 2 317.751 4.126 20 0 DIADLO Cc1cccc(C[N@H+](Cc2c(N)ccnc2Cl)C2CC2)c1C ZINC001236533836 1055165471 /nfs/dbraw/zinc/16/54/71/1055165471.db2.gz BOJADAJCPQHZPM-UHFFFAOYSA-N 1 2 315.848 4.099 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2c(N)ccnc2Cl)C2CC2)c1C ZINC001236533836 1055165475 /nfs/dbraw/zinc/16/54/75/1055165475.db2.gz BOJADAJCPQHZPM-UHFFFAOYSA-N 1 2 315.848 4.099 20 0 DIADLO CCOc1ccc(C)c(F)c1-c1ccccc1Cn1cc[nH+]c1 ZINC001236539722 1055168218 /nfs/dbraw/zinc/16/82/18/1055168218.db2.gz MZVUAMFKYDPCTN-UHFFFAOYSA-N 1 2 310.372 4.445 20 0 DIADLO Cc1cc(C)c(Cl)c(-c2c[nH+]c(N3CCOCC3)cc2C)c1 ZINC001236547966 1055175903 /nfs/dbraw/zinc/17/59/03/1055175903.db2.gz FTDBRVKYOJRFBY-UHFFFAOYSA-N 1 2 316.832 4.164 20 0 DIADLO COC(=[NH2+])c1cccc(-c2cncc(OCc3ccccc3)c2)c1 ZINC001236569869 1055191523 /nfs/dbraw/zinc/19/15/23/1055191523.db2.gz XIPOZPGMNCXVPU-UHFFFAOYSA-N 1 2 318.376 4.299 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2c(Br)ccnc2Cl)[C@H]1C ZINC001236598870 1055200196 /nfs/dbraw/zinc/20/01/96/1055200196.db2.gz RTQLYTBDHVOICO-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2c(Br)ccnc2Cl)[C@H]1C ZINC001236598870 1055200211 /nfs/dbraw/zinc/20/02/11/1055200211.db2.gz RTQLYTBDHVOICO-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1nc(C)c(C[N@@H+]2CCSC[C@H]2c2cccc(Cl)c2)o1 ZINC001236594269 1055202312 /nfs/dbraw/zinc/20/23/12/1055202312.db2.gz IXAAVWBICIQDBJ-HNNXBMFYSA-N 1 2 322.861 4.235 20 0 DIADLO Cc1nc(C)c(C[N@H+]2CCSC[C@H]2c2cccc(Cl)c2)o1 ZINC001236594269 1055202325 /nfs/dbraw/zinc/20/23/25/1055202325.db2.gz IXAAVWBICIQDBJ-HNNXBMFYSA-N 1 2 322.861 4.235 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@H+](C)Cc1ccsc1 ZINC001236609083 1055204215 /nfs/dbraw/zinc/20/42/15/1055204215.db2.gz VWNUJZMVGRBAJU-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@@H+](C)Cc1ccsc1 ZINC001236609083 1055204224 /nfs/dbraw/zinc/20/42/24/1055204224.db2.gz VWNUJZMVGRBAJU-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC001236635427 1055209101 /nfs/dbraw/zinc/20/91/01/1055209101.db2.gz MHZVYAUIMBGGQZ-ZJUUUORDSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC001236635427 1055209108 /nfs/dbraw/zinc/20/91/08/1055209108.db2.gz MHZVYAUIMBGGQZ-ZJUUUORDSA-N 1 2 306.759 4.374 20 0 DIADLO C[N@@H+](Cc1cncs1)Cc1cc(Cl)c(F)c(Cl)c1 ZINC001236660140 1055213638 /nfs/dbraw/zinc/21/36/38/1055213638.db2.gz VBDJPYKKNSWOLP-UHFFFAOYSA-N 1 2 305.205 4.221 20 0 DIADLO C[N@H+](Cc1cncs1)Cc1cc(Cl)c(F)c(Cl)c1 ZINC001236660140 1055213626 /nfs/dbraw/zinc/21/36/26/1055213626.db2.gz VBDJPYKKNSWOLP-UHFFFAOYSA-N 1 2 305.205 4.221 20 0 DIADLO Fc1c(Cl)cc(C[N@H+]2C[C@H]3[C@H](CC3(F)F)C2)cc1Cl ZINC001236654098 1055214626 /nfs/dbraw/zinc/21/46/26/1055214626.db2.gz UQPOHFWOOKBLFL-BDAKNGLRSA-N 1 2 310.146 4.220 20 0 DIADLO Fc1c(Cl)cc(C[N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)cc1Cl ZINC001236654098 1055214633 /nfs/dbraw/zinc/21/46/33/1055214633.db2.gz UQPOHFWOOKBLFL-BDAKNGLRSA-N 1 2 310.146 4.220 20 0 DIADLO Fc1c(Cl)cc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)cc1Cl ZINC001236661474 1055218588 /nfs/dbraw/zinc/21/85/88/1055218588.db2.gz JYJLPHTUVHOBDK-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1c(Cl)cc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)cc1Cl ZINC001236661474 1055218600 /nfs/dbraw/zinc/21/86/00/1055218600.db2.gz JYJLPHTUVHOBDK-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO CC[C@H](C)N1CC[C@@]2(CCC[N@@H+](c3ccc(C)cc3)CC2)C1=O ZINC001278000401 1055237683 /nfs/dbraw/zinc/23/76/83/1055237683.db2.gz HHUCEWWWKLPTCM-PXNSSMCTSA-N 1 2 314.473 4.003 20 0 DIADLO CC[C@H](C)N1CC[C@@]2(CCC[N@H+](c3ccc(C)cc3)CC2)C1=O ZINC001278000401 1055237697 /nfs/dbraw/zinc/23/76/97/1055237697.db2.gz HHUCEWWWKLPTCM-PXNSSMCTSA-N 1 2 314.473 4.003 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)ccc1F ZINC001236707749 1055238127 /nfs/dbraw/zinc/23/81/27/1055238127.db2.gz KJESBPJFBRQNNK-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO Cc1cccc(F)c1NC(=O)[C@@H](c1ccc(Cl)cc1)[NH+](C)C ZINC001537172360 1055245192 /nfs/dbraw/zinc/24/51/92/1055245192.db2.gz WOZRIVYRDMNYTN-MRXNPFEDSA-N 1 2 320.795 4.029 20 0 DIADLO O=C(Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1cccs1 ZINC001587253363 1055252175 /nfs/dbraw/zinc/25/21/75/1055252175.db2.gz ZELPVQNFYUIZNN-UHFFFAOYSA-N 1 2 324.405 4.167 20 0 DIADLO COc1cc(C[N@@H+]2CCc3ccccc3[C@H]2C)c(F)cc1F ZINC001236817915 1055271175 /nfs/dbraw/zinc/27/11/75/1055271175.db2.gz OWOBDQUPZNQPPE-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(C[N@H+]2CCc3ccccc3[C@H]2C)c(F)cc1F ZINC001236817915 1055271200 /nfs/dbraw/zinc/27/12/00/1055271200.db2.gz OWOBDQUPZNQPPE-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@H](F)CC2)cc(Br)c1F ZINC001236848834 1055291317 /nfs/dbraw/zinc/29/13/17/1055291317.db2.gz UMYDKFUJWJRTGS-JTQLQIEISA-N 1 2 322.168 4.051 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@H](F)CC2)cc(Br)c1F ZINC001236848834 1055291323 /nfs/dbraw/zinc/29/13/23/1055291323.db2.gz UMYDKFUJWJRTGS-JTQLQIEISA-N 1 2 322.168 4.051 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2cccc3c2OCO3)c1Cl ZINC001236854205 1055292570 /nfs/dbraw/zinc/29/25/70/1055292570.db2.gz GWFBQVQVNCYYGM-UHFFFAOYSA-N 1 2 303.789 4.009 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2cccc3c2OCO3)c1Cl ZINC001236854205 1055292588 /nfs/dbraw/zinc/29/25/88/1055292588.db2.gz GWFBQVQVNCYYGM-UHFFFAOYSA-N 1 2 303.789 4.009 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@H](C)c1cc(F)ccc1F)CCC2 ZINC000764939184 1055295702 /nfs/dbraw/zinc/29/57/02/1055295702.db2.gz JOPZZUAFYDSLIE-SJKOYZFVSA-N 1 2 319.399 4.470 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cccc(C)c2Cl)c(OC)c1 ZINC001236858643 1055296361 /nfs/dbraw/zinc/29/63/61/1055296361.db2.gz OKSJXMCIPSJAHF-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cccc(C)c2Cl)c(OC)c1 ZINC001236858643 1055296372 /nfs/dbraw/zinc/29/63/72/1055296372.db2.gz OKSJXMCIPSJAHF-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO Clc1cc2ccccc2nc1C[N@@H+]1CCC[C@@H]1c1cnccn1 ZINC001236874273 1055298252 /nfs/dbraw/zinc/29/82/52/1055298252.db2.gz KELQGJIMDHNILC-GOSISDBHSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1cc2ccccc2nc1C[N@H+]1CCC[C@@H]1c1cnccn1 ZINC001236874273 1055298263 /nfs/dbraw/zinc/29/82/63/1055298263.db2.gz KELQGJIMDHNILC-GOSISDBHSA-N 1 2 324.815 4.015 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2cncc(-c3ccc(F)cc3)c2)C[C@H]1F ZINC001236998328 1055331866 /nfs/dbraw/zinc/33/18/66/1055331866.db2.gz WNOXZBSKGJBGQX-QZTJIDSGSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2cncc(-c3ccc(F)cc3)c2)C[C@H]1F ZINC001236998328 1055331877 /nfs/dbraw/zinc/33/18/77/1055331877.db2.gz WNOXZBSKGJBGQX-QZTJIDSGSA-N 1 2 320.358 4.160 20 0 DIADLO Cc1cc(NC(=O)C2=C(c3ccccc3)CCCC2)c(C)c[nH+]1 ZINC001537540360 1055352597 /nfs/dbraw/zinc/35/25/97/1055352597.db2.gz QDONCPZMESKTAR-UHFFFAOYSA-N 1 2 306.409 4.087 20 0 DIADLO CC[C@@H](C)c1cccc(NC(=O)c2ccn3c(C)c[nH+]c3c2)c1 ZINC001587734000 1055353487 /nfs/dbraw/zinc/35/34/87/1055353487.db2.gz IPFQPZZNQNQDKI-CYBMUJFWSA-N 1 2 307.397 4.409 20 0 DIADLO COc1cc2c(cc1OC)C[NH+](Cc1ccc(C3CCC3)cc1)C2 ZINC001237109328 1055376027 /nfs/dbraw/zinc/37/60/27/1055376027.db2.gz ZOZPEABVEOYFMP-UHFFFAOYSA-N 1 2 323.436 4.487 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C=Cc1ccc(C(C)(C)C)cc1 ZINC001537609183 1055379194 /nfs/dbraw/zinc/37/91/94/1055379194.db2.gz DFDAXBAXFGPODP-FLIBITNWSA-N 1 2 308.425 4.070 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccnc2c(Cl)cccc12 ZINC001237152419 1055385898 /nfs/dbraw/zinc/38/58/98/1055385898.db2.gz OLHJCNJHNYVOTR-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccnc2c(Cl)cccc12 ZINC001237152419 1055385904 /nfs/dbraw/zinc/38/59/04/1055385904.db2.gz OLHJCNJHNYVOTR-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2Cc2ccc3cccccc2-3)no1 ZINC001237191184 1055397525 /nfs/dbraw/zinc/39/75/25/1055397525.db2.gz SLPGFCRUNWGWGJ-GOSISDBHSA-N 1 2 307.397 4.210 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2Cc2ccc3cccccc2-3)no1 ZINC001237191184 1055397531 /nfs/dbraw/zinc/39/75/31/1055397531.db2.gz SLPGFCRUNWGWGJ-GOSISDBHSA-N 1 2 307.397 4.210 20 0 DIADLO N#Cc1cc([N+](=O)[O-])ccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC000325450094 1055399174 /nfs/dbraw/zinc/39/91/74/1055399174.db2.gz XGIMTXBBCYXSFZ-UHFFFAOYSA-N 1 2 322.368 4.200 20 0 DIADLO c1coc([C@@H]([NH2+]Cc2cnn(C3CCC3)c2)c2ccccc2)c1 ZINC000921513232 1055401426 /nfs/dbraw/zinc/40/14/26/1055401426.db2.gz QODOVANSQSOPPD-IBGZPJMESA-N 1 2 307.397 4.080 20 0 DIADLO C[N@H+](Cc1ccc2sc3ccccc3c2c1)Cc1ncccn1 ZINC001237196250 1055402182 /nfs/dbraw/zinc/40/21/82/1055402182.db2.gz RDKVRZYVCYZZPC-UHFFFAOYSA-N 1 2 319.433 4.477 20 0 DIADLO C[N@@H+](Cc1ccc2sc3ccccc3c2c1)Cc1ncccn1 ZINC001237196250 1055402185 /nfs/dbraw/zinc/40/21/85/1055402185.db2.gz RDKVRZYVCYZZPC-UHFFFAOYSA-N 1 2 319.433 4.477 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc3sc4ccccc4c3c2)CCC1=O ZINC001237195038 1055402663 /nfs/dbraw/zinc/40/26/63/1055402663.db2.gz IBEHKYRPPNPQPC-ZDUSSCGKSA-N 1 2 309.434 4.465 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc3sc4ccccc4c3c2)CCC1=O ZINC001237195038 1055402673 /nfs/dbraw/zinc/40/26/73/1055402673.db2.gz IBEHKYRPPNPQPC-ZDUSSCGKSA-N 1 2 309.434 4.465 20 0 DIADLO CC(C)Oc1ccc(C[NH2+]Cc2nc(C(C)(C)C)co2)cc1 ZINC000921525118 1055409778 /nfs/dbraw/zinc/40/97/78/1055409778.db2.gz KPGWTOOUDBDTMV-UHFFFAOYSA-N 1 2 302.418 4.049 20 0 DIADLO Nc1ccccc1C[N@@H+]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001237266586 1055410721 /nfs/dbraw/zinc/41/07/21/1055410721.db2.gz XHGSQKPGYCBUQU-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1ccccc1C[N@H+]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001237266586 1055410726 /nfs/dbraw/zinc/41/07/26/1055410726.db2.gz XHGSQKPGYCBUQU-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Oc1cc(F)cc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)c1 ZINC001237285559 1055415119 /nfs/dbraw/zinc/41/51/19/1055415119.db2.gz VQYDGSCWWWVOIV-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO Cc1ccc(-c2nc(C(=O)Nc3cc[nH+]c(C)c3)cs2)cc1 ZINC000010165087 1055415950 /nfs/dbraw/zinc/41/59/50/1055415950.db2.gz VQMMDXCXZXAAJV-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2nccs2)ccc1C(F)F ZINC001237281929 1055416079 /nfs/dbraw/zinc/41/60/79/1055416079.db2.gz YOCDKNUHAFVRSV-ZDUSSCGKSA-N 1 2 324.396 4.426 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2nccs2)ccc1C(F)F ZINC001237281929 1055416081 /nfs/dbraw/zinc/41/60/81/1055416081.db2.gz YOCDKNUHAFVRSV-ZDUSSCGKSA-N 1 2 324.396 4.426 20 0 DIADLO Oc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001237287598 1055419318 /nfs/dbraw/zinc/41/93/18/1055419318.db2.gz SELKHXMXUBKGIM-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)cc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001237287598 1055419328 /nfs/dbraw/zinc/41/93/28/1055419328.db2.gz SELKHXMXUBKGIM-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO C[N@H+](Cc1cnc(-c2ccccc2)o1)Cc1cccc(F)c1F ZINC001237367542 1055442883 /nfs/dbraw/zinc/44/28/83/1055442883.db2.gz FDEQDIPBFGOGKS-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1cnc(-c2ccccc2)o1)Cc1cccc(F)c1F ZINC001237367542 1055442888 /nfs/dbraw/zinc/44/28/88/1055442888.db2.gz FDEQDIPBFGOGKS-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO CCCC1CC[NH+](Cc2cc(Cl)nc(Cl)c2O)CC1 ZINC001237535269 1055470235 /nfs/dbraw/zinc/47/02/35/1055470235.db2.gz QTKXMMVWLOOTSE-UHFFFAOYSA-N 1 2 303.233 4.106 20 0 DIADLO C[N@H+](CCF)Cc1cc(Cl)ccc1NC(=O)OC(C)(C)C ZINC001237376947 1055444416 /nfs/dbraw/zinc/44/44/16/1055444416.db2.gz IEEURRRGHMKOCR-UHFFFAOYSA-N 1 2 316.804 4.088 20 0 DIADLO C[N@@H+](CCF)Cc1cc(Cl)ccc1NC(=O)OC(C)(C)C ZINC001237376947 1055444424 /nfs/dbraw/zinc/44/44/24/1055444424.db2.gz IEEURRRGHMKOCR-UHFFFAOYSA-N 1 2 316.804 4.088 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3cc4ccccn4n3)CC2)cc1 ZINC001237439568 1055454083 /nfs/dbraw/zinc/45/40/83/1055454083.db2.gz SDXMANQTOVPWHW-UHFFFAOYSA-N 1 2 323.827 4.277 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3cc4ccccn4n3)CC2)cc1 ZINC001237439568 1055454091 /nfs/dbraw/zinc/45/40/91/1055454091.db2.gz SDXMANQTOVPWHW-UHFFFAOYSA-N 1 2 323.827 4.277 20 0 DIADLO Fc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1cc2ccccn2n1 ZINC001237443498 1055454294 /nfs/dbraw/zinc/45/42/94/1055454294.db2.gz UNZIUDZXTCMMHN-IBGZPJMESA-N 1 2 309.388 4.201 20 0 DIADLO Fc1ccccc1[C@@H]1CCCC[N@H+]1Cc1cc2ccccn2n1 ZINC001237443498 1055454302 /nfs/dbraw/zinc/45/43/02/1055454302.db2.gz UNZIUDZXTCMMHN-IBGZPJMESA-N 1 2 309.388 4.201 20 0 DIADLO C[N@H+](Cc1c(Cl)[nH]c2cnccc21)Cc1cccc(F)c1F ZINC001237466805 1055456068 /nfs/dbraw/zinc/45/60/68/1055456068.db2.gz LBSNIAYIPONWJD-UHFFFAOYSA-N 1 2 321.758 4.127 20 0 DIADLO C[N@@H+](Cc1c(Cl)[nH]c2cnccc21)Cc1cccc(F)c1F ZINC001237466805 1055456072 /nfs/dbraw/zinc/45/60/72/1055456072.db2.gz LBSNIAYIPONWJD-UHFFFAOYSA-N 1 2 321.758 4.127 20 0 DIADLO COc1cc2c(cc1OC)C[NH+](Cc1cccc(C(C)C)c1)C2 ZINC001237458399 1055456551 /nfs/dbraw/zinc/45/65/51/1055456551.db2.gz AGYKSAUGONKXTK-UHFFFAOYSA-N 1 2 311.425 4.343 20 0 DIADLO Cc1cc(F)cc(NC(=O)C[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC001588281297 1055464166 /nfs/dbraw/zinc/46/41/66/1055464166.db2.gz JYWFXSWOAXIEFF-QGZVFWFLSA-N 1 2 323.371 4.018 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cccc(-c3ccccc3)n2)no1 ZINC001237542232 1055469887 /nfs/dbraw/zinc/46/98/87/1055469887.db2.gz FDWVEUWNZFAADZ-HXUWFJFHSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cccc(-c3ccccc3)n2)no1 ZINC001237542232 1055469889 /nfs/dbraw/zinc/46/98/89/1055469889.db2.gz FDWVEUWNZFAADZ-HXUWFJFHSA-N 1 2 319.408 4.382 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1cccc(-c3ccccc3)n1)C2 ZINC001237548167 1055472103 /nfs/dbraw/zinc/47/21/03/1055472103.db2.gz CWLYXGBIZMTMRZ-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1cccc(-c3ccccc3)n1)C2 ZINC001237548167 1055472116 /nfs/dbraw/zinc/47/21/16/1055472116.db2.gz CWLYXGBIZMTMRZ-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO Fc1cc(NCc2cccc3ccoc32)ccc1-n1cc[nH+]c1 ZINC001620849102 1055476607 /nfs/dbraw/zinc/47/66/07/1055476607.db2.gz PGONAEJBTSFYPW-UHFFFAOYSA-N 1 2 307.328 4.370 20 0 DIADLO FC(F)c1cccc(NCc2cc(-n3cc[nH+]c3)cs2)c1 ZINC001620850277 1055479570 /nfs/dbraw/zinc/47/95/70/1055479570.db2.gz KTPWEYGHHWXZEU-UHFFFAOYSA-N 1 2 305.353 4.484 20 0 DIADLO CCN(Cc1c[nH+]cn1CC)Cc1ccc(Cl)cc1Cl ZINC001237593132 1055482411 /nfs/dbraw/zinc/48/24/11/1055482411.db2.gz GSAGELNMDOZZIU-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H](C)c3ccccc3)cc2)[nH+]c1C ZINC001589437245 1055484149 /nfs/dbraw/zinc/48/41/49/1055484149.db2.gz MOJFMABREADHDT-CYBMUJFWSA-N 1 2 319.408 4.436 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+]1CCc2ccccc2C1 ZINC000022910442 1055498465 /nfs/dbraw/zinc/49/84/65/1055498465.db2.gz PXNNSDGMXINKLG-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+]1CCc2ccccc2C1 ZINC000022910442 1055498469 /nfs/dbraw/zinc/49/84/69/1055498469.db2.gz PXNNSDGMXINKLG-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1ccc2ccccc2c1 ZINC000023889557 1055506065 /nfs/dbraw/zinc/50/60/65/1055506065.db2.gz JEOGPNVPPYCFHZ-UHFFFAOYSA-N 1 2 313.360 4.278 20 0 DIADLO Cc1cc(NCc2ccc(OCC3CC3)cc2)ccc1[NH+](C)C ZINC001620884487 1055509195 /nfs/dbraw/zinc/50/91/95/1055509195.db2.gz HZOKLYVLXKLBGS-UHFFFAOYSA-N 1 2 310.441 4.462 20 0 DIADLO CCC(CC)Oc1ccc(C(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC001538057854 1055515353 /nfs/dbraw/zinc/51/53/53/1055515353.db2.gz FBEVMUPRNZHZAS-UHFFFAOYSA-N 1 2 323.396 4.154 20 0 DIADLO CC(C)c1cc(Br)ccc1C[N@@H+]1CC[C@@H](F)C1 ZINC001237733902 1055519041 /nfs/dbraw/zinc/51/90/41/1055519041.db2.gz XHCOSDGMPWBHKC-CYBMUJFWSA-N 1 2 300.215 4.116 20 0 DIADLO CC(C)c1cc(Br)ccc1C[N@H+]1CC[C@@H](F)C1 ZINC001237733902 1055519046 /nfs/dbraw/zinc/51/90/46/1055519046.db2.gz XHCOSDGMPWBHKC-CYBMUJFWSA-N 1 2 300.215 4.116 20 0 DIADLO C[N@H+](Cc1cc(-c2cccc(Cl)c2)no1)Cc1cncs1 ZINC001237778982 1055530296 /nfs/dbraw/zinc/53/02/96/1055530296.db2.gz RFOWWQTXYDYKRV-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO C[N@@H+](Cc1cc(-c2cccc(Cl)c2)no1)Cc1cncs1 ZINC001237778982 1055530298 /nfs/dbraw/zinc/53/02/98/1055530298.db2.gz RFOWWQTXYDYKRV-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccccc2F)c(Cl)n1 ZINC001237804410 1055531479 /nfs/dbraw/zinc/53/14/79/1055531479.db2.gz URVYTENSUZOAFX-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2ccccc2F)c(Cl)n1 ZINC001237804410 1055531491 /nfs/dbraw/zinc/53/14/91/1055531491.db2.gz URVYTENSUZOAFX-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2)Cc2ccncc2)ccc1F ZINC001237813262 1055536037 /nfs/dbraw/zinc/53/60/37/1055536037.db2.gz HXSJJQNIWHPXBG-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2)Cc2ccncc2)ccc1F ZINC001237813262 1055536045 /nfs/dbraw/zinc/53/60/45/1055536045.db2.gz HXSJJQNIWHPXBG-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO CCc1ncc(C[N@@H+]2CCSC[C@@H]2c2ccc(F)cc2)s1 ZINC001237825527 1055536214 /nfs/dbraw/zinc/53/62/14/1055536214.db2.gz BNTAUEFQEICERU-OAHLLOKOSA-N 1 2 322.474 4.135 20 0 DIADLO CCc1ncc(C[N@H+]2CCSC[C@@H]2c2ccc(F)cc2)s1 ZINC001237825527 1055536221 /nfs/dbraw/zinc/53/62/21/1055536221.db2.gz BNTAUEFQEICERU-OAHLLOKOSA-N 1 2 322.474 4.135 20 0 DIADLO CCCOc1cc(F)ccc1C[N@@H+]1CCOc2ccccc2C1 ZINC001237906135 1055553570 /nfs/dbraw/zinc/55/35/70/1055553570.db2.gz QXSRNZFRADDQCS-UHFFFAOYSA-N 1 2 315.388 4.009 20 0 DIADLO CCCOc1cc(F)ccc1C[N@H+]1CCOc2ccccc2C1 ZINC001237906135 1055553579 /nfs/dbraw/zinc/55/35/79/1055553579.db2.gz QXSRNZFRADDQCS-UHFFFAOYSA-N 1 2 315.388 4.009 20 0 DIADLO CCCOc1cc(F)ccc1C[N@H+](Cc1ccco1)C1CC1 ZINC001237907611 1055556952 /nfs/dbraw/zinc/55/69/52/1055556952.db2.gz CGBVPJQOORYNML-UHFFFAOYSA-N 1 2 303.377 4.372 20 0 DIADLO CCCOc1cc(F)ccc1C[N@@H+](Cc1ccco1)C1CC1 ZINC001237907611 1055556956 /nfs/dbraw/zinc/55/69/56/1055556956.db2.gz CGBVPJQOORYNML-UHFFFAOYSA-N 1 2 303.377 4.372 20 0 DIADLO Cn1cc(CNc2ccc([NH+]3CCCC3)cc2)c(C2CCCC2)n1 ZINC000921568716 1055567453 /nfs/dbraw/zinc/56/74/53/1055567453.db2.gz JXSSYZDASYDOMN-UHFFFAOYSA-N 1 2 324.472 4.290 20 0 DIADLO c1cc(C[NH2+]Cc2csc(-c3ccccc3)n2)n(C2CCC2)n1 ZINC000921608058 1055578684 /nfs/dbraw/zinc/57/86/84/1055578684.db2.gz ROAXLFFQLMMDLH-UHFFFAOYSA-N 1 2 324.453 4.021 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2cc3c(s2)CCCC3)n1 ZINC000921607737 1055579000 /nfs/dbraw/zinc/57/90/00/1055579000.db2.gz ATRDKJYOIWJTHY-UHFFFAOYSA-N 1 2 304.459 4.202 20 0 DIADLO Oc1c(F)cc(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1Cl ZINC001237998803 1055580295 /nfs/dbraw/zinc/58/02/95/1055580295.db2.gz XIHCYJOMNKAJDY-CYBMUJFWSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1Cl ZINC001237998803 1055580312 /nfs/dbraw/zinc/58/03/12/1055580312.db2.gz XIHCYJOMNKAJDY-CYBMUJFWSA-N 1 2 323.770 4.313 20 0 DIADLO Cc1ccc(CC[N@@H+](C)Cc2cc(F)c(O)c(Cl)c2)cc1 ZINC001237998280 1055580712 /nfs/dbraw/zinc/58/07/12/1055580712.db2.gz SXBDYCSBOBNYCK-UHFFFAOYSA-N 1 2 307.796 4.168 20 0 DIADLO Cc1ccc(CC[N@H+](C)Cc2cc(F)c(O)c(Cl)c2)cc1 ZINC001237998280 1055580720 /nfs/dbraw/zinc/58/07/20/1055580720.db2.gz SXBDYCSBOBNYCK-UHFFFAOYSA-N 1 2 307.796 4.168 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@H]2CCc3c2cccc3Cl)n1 ZINC000921614094 1055583011 /nfs/dbraw/zinc/58/30/11/1055583011.db2.gz MOFVXVUKNVYMNQ-AWEZNQCLSA-N 1 2 304.821 4.403 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cnc(F)cc2Cl)c1 ZINC001238017104 1055584745 /nfs/dbraw/zinc/58/47/45/1055584745.db2.gz BAWNNIHVLGAORZ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2cnc(F)cc2Cl)c1 ZINC001238017104 1055584756 /nfs/dbraw/zinc/58/47/56/1055584756.db2.gz BAWNNIHVLGAORZ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cnc(F)cc1Cl ZINC001238026893 1055586346 /nfs/dbraw/zinc/58/63/46/1055586346.db2.gz DHVOTXHEWUZRRP-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cnc(F)cc1Cl ZINC001238026893 1055586356 /nfs/dbraw/zinc/58/63/56/1055586356.db2.gz DHVOTXHEWUZRRP-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO C[N@@H+](Cc1cccc2cccnc21)Cc1cnc(F)cc1Cl ZINC001238026830 1055587933 /nfs/dbraw/zinc/58/79/33/1055587933.db2.gz ZYLSKFJHWTYULI-UHFFFAOYSA-N 1 2 315.779 4.054 20 0 DIADLO C[N@H+](Cc1cccc2cccnc21)Cc1cnc(F)cc1Cl ZINC001238026830 1055587941 /nfs/dbraw/zinc/58/79/41/1055587941.db2.gz ZYLSKFJHWTYULI-UHFFFAOYSA-N 1 2 315.779 4.054 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1C[NH+]1CC2(C1)CCCO2 ZINC001238054955 1055593654 /nfs/dbraw/zinc/59/36/54/1055593654.db2.gz CGDDSYVVWWWNIK-UHFFFAOYSA-N 1 2 309.409 4.152 20 0 DIADLO O=C(CC(C1CCC1)C1CCC1)Nc1ccccc1-n1cc[nH+]c1 ZINC001595396399 1055593836 /nfs/dbraw/zinc/59/38/36/1055593836.db2.gz YVOHXCRNSPNYDD-UHFFFAOYSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1C[N@H+]1CCC(=O)C[C@@H]1C ZINC001238054658 1055594180 /nfs/dbraw/zinc/59/41/80/1055594180.db2.gz DEJGYWIZWQGILU-INIZCTEOSA-N 1 2 309.409 4.341 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1C[N@@H+]1CCC(=O)C[C@@H]1C ZINC001238054658 1055594195 /nfs/dbraw/zinc/59/41/95/1055594195.db2.gz DEJGYWIZWQGILU-INIZCTEOSA-N 1 2 309.409 4.341 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(F)c(Br)c2F)C2(CC2)C1 ZINC001238087765 1055602992 /nfs/dbraw/zinc/60/29/92/1055602992.db2.gz WPTOUZFCGVANHR-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(F)c(Br)c2F)C2(CC2)C1 ZINC001238087765 1055603000 /nfs/dbraw/zinc/60/30/00/1055603000.db2.gz WPTOUZFCGVANHR-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(Br)c(F)c(C[N@@H+]2CC3CCC2CC3)c1 ZINC001238079170 1055603619 /nfs/dbraw/zinc/60/36/19/1055603619.db2.gz OESBDRWZSFQGLO-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(Br)c(F)c(C[N@H+]2CC3CCC2CC3)c1 ZINC001238079170 1055603620 /nfs/dbraw/zinc/60/36/20/1055603620.db2.gz OESBDRWZSFQGLO-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1csc(-c2ccco2)n1 ZINC000172152921 1055606804 /nfs/dbraw/zinc/60/68/04/1055606804.db2.gz DCBNOEBCLIHTGW-OAHLLOKOSA-N 1 2 313.426 4.079 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1csc(-c2ccco2)n1 ZINC000172152921 1055606820 /nfs/dbraw/zinc/60/68/20/1055606820.db2.gz DCBNOEBCLIHTGW-OAHLLOKOSA-N 1 2 313.426 4.079 20 0 DIADLO COc1cnc(F)c(C[N@H+](C)Cc2ccc3ccccc3c2)c1 ZINC001238127515 1055607920 /nfs/dbraw/zinc/60/79/20/1055607920.db2.gz WKKAOHPDOOBLAT-UHFFFAOYSA-N 1 2 310.372 4.015 20 0 DIADLO COc1cnc(F)c(C[N@@H+](C)Cc2ccc3ccccc3c2)c1 ZINC001238127515 1055607926 /nfs/dbraw/zinc/60/79/26/1055607926.db2.gz WKKAOHPDOOBLAT-UHFFFAOYSA-N 1 2 310.372 4.015 20 0 DIADLO COc1cccc([C@@H]2CCCC[N@@H+]2Cc2cccc3c[nH+]cn32)c1 ZINC001238113045 1055608548 /nfs/dbraw/zinc/60/85/48/1055608548.db2.gz IFVUMPSRPVYWHA-FQEVSTJZSA-N 1 2 321.424 4.070 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000029951262 1055624347 /nfs/dbraw/zinc/62/43/47/1055624347.db2.gz UEDFTDJOMVPFOF-OAHLLOKOSA-N 1 2 305.381 4.005 20 0 DIADLO COC(=O)c1occc1C[N@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000030005690 1055625116 /nfs/dbraw/zinc/62/51/16/1055625116.db2.gz TXHGFXBVURFOOA-LBPRGKRZSA-N 1 2 313.353 4.005 20 0 DIADLO COC(=O)c1occc1C[N@@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000030005690 1055625119 /nfs/dbraw/zinc/62/51/19/1055625119.db2.gz TXHGFXBVURFOOA-LBPRGKRZSA-N 1 2 313.353 4.005 20 0 DIADLO Fc1ccnc(Cl)c1C[NH+]1CCC(c2cccs2)CC1 ZINC001238233273 1055627161 /nfs/dbraw/zinc/62/71/61/1055627161.db2.gz ZQVXNFZJUVPEMS-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO FC[C@H]1CCC[N@H+](Cc2ccc(F)c(C(F)(F)F)c2F)C1 ZINC001238253070 1055630108 /nfs/dbraw/zinc/63/01/08/1055630108.db2.gz PRPKDFRTDUTOCY-SECBINFHSA-N 1 2 311.269 4.165 20 0 DIADLO FC[C@H]1CCC[N@@H+](Cc2ccc(F)c(C(F)(F)F)c2F)C1 ZINC001238253070 1055630113 /nfs/dbraw/zinc/63/01/13/1055630113.db2.gz PRPKDFRTDUTOCY-SECBINFHSA-N 1 2 311.269 4.165 20 0 DIADLO CSCC[N@H+](C)Cc1c(Br)ccc(C)c1Cl ZINC001238279248 1055633283 /nfs/dbraw/zinc/63/32/83/1055633283.db2.gz OKRSDIMHHXVUAA-UHFFFAOYSA-N 1 2 322.699 4.206 20 0 DIADLO CSCC[N@@H+](C)Cc1c(Br)ccc(C)c1Cl ZINC001238279248 1055633291 /nfs/dbraw/zinc/63/32/91/1055633291.db2.gz OKRSDIMHHXVUAA-UHFFFAOYSA-N 1 2 322.699 4.206 20 0 DIADLO CC(C)Oc1c(F)cccc1C[N@H+](C)Cc1ccc(Cl)nc1 ZINC001238321985 1055638330 /nfs/dbraw/zinc/63/83/30/1055638330.db2.gz FZVHIOQPEGIEKX-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO CC(C)Oc1c(F)cccc1C[N@@H+](C)Cc1ccc(Cl)nc1 ZINC001238321985 1055638343 /nfs/dbraw/zinc/63/83/43/1055638343.db2.gz FZVHIOQPEGIEKX-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO C[C@H]1CC[N@@H+]1Cc1ccc(OCc2ccccc2)c(F)c1F ZINC001238349263 1055643720 /nfs/dbraw/zinc/64/37/20/1055643720.db2.gz BCLFUDQZXDDBPK-ZDUSSCGKSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@H]1CC[N@H+]1Cc1ccc(OCc2ccccc2)c(F)c1F ZINC001238349263 1055643725 /nfs/dbraw/zinc/64/37/25/1055643725.db2.gz BCLFUDQZXDDBPK-ZDUSSCGKSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccnc(Br)c1Cl ZINC001238377702 1055648266 /nfs/dbraw/zinc/64/82/66/1055648266.db2.gz QSDTWHITLDGSSM-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccnc(Br)c1Cl ZINC001238377702 1055648273 /nfs/dbraw/zinc/64/82/73/1055648273.db2.gz QSDTWHITLDGSSM-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(F)c(Cl)c(F)cc2Br)C1 ZINC001238402663 1055653216 /nfs/dbraw/zinc/65/32/16/1055653216.db2.gz FOKKWHFAKHVYKK-SSDOTTSWSA-N 1 2 324.596 4.223 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(F)c(Cl)c(F)cc2Br)C1 ZINC001238402663 1055653217 /nfs/dbraw/zinc/65/32/17/1055653217.db2.gz FOKKWHFAKHVYKK-SSDOTTSWSA-N 1 2 324.596 4.223 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](Cc2ccco2)C2CC2)c1F ZINC001238431119 1055657511 /nfs/dbraw/zinc/65/75/11/1055657511.db2.gz VXNQVBRAORTUFD-UHFFFAOYSA-N 1 2 303.377 4.371 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](Cc2ccco2)C2CC2)c1F ZINC001238431119 1055657516 /nfs/dbraw/zinc/65/75/16/1055657516.db2.gz VXNQVBRAORTUFD-UHFFFAOYSA-N 1 2 303.377 4.371 20 0 DIADLO Cc1cnc(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)c(C)c1 ZINC001238426511 1055658888 /nfs/dbraw/zinc/65/88/88/1055658888.db2.gz MXFHTYARIRKWTL-OAQYLSRUSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1cnc(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)c(C)c1 ZINC001238426511 1055658893 /nfs/dbraw/zinc/65/88/93/1055658893.db2.gz MXFHTYARIRKWTL-OAQYLSRUSA-N 1 2 317.436 4.105 20 0 DIADLO CC(C)[C@@H]([NH2+]CCSC1CCCCC1)C(=O)OC(C)(C)C ZINC001168570582 1055659162 /nfs/dbraw/zinc/65/91/62/1055659162.db2.gz QRIZMKYTGIHSMC-OAHLLOKOSA-N 1 2 315.523 4.008 20 0 DIADLO Cc1cnc(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)c(C)c1 ZINC001238440978 1055660132 /nfs/dbraw/zinc/66/01/32/1055660132.db2.gz MZPHCHRCRLKXPG-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cnc(C[N@H+]2CCc3cccc(C(F)(F)F)c3C2)c(C)c1 ZINC001238440978 1055660136 /nfs/dbraw/zinc/66/01/36/1055660136.db2.gz MZPHCHRCRLKXPG-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCOC3(CCCCC3)C2)c(F)c1 ZINC001238450542 1055660751 /nfs/dbraw/zinc/66/07/51/1055660751.db2.gz WXGHJXMRCBMCEV-UHFFFAOYSA-N 1 2 321.436 4.148 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCOC3(CCCCC3)C2)c(F)c1 ZINC001238450542 1055660757 /nfs/dbraw/zinc/66/07/57/1055660757.db2.gz WXGHJXMRCBMCEV-UHFFFAOYSA-N 1 2 321.436 4.148 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1ccc(OC(C)C)cc1F ZINC001238452521 1055663777 /nfs/dbraw/zinc/66/37/77/1055663777.db2.gz YGSFLSKZRAXHAT-UHFFFAOYSA-N 1 2 317.404 4.254 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1ccc(OC(C)C)cc1F ZINC001238452521 1055663786 /nfs/dbraw/zinc/66/37/86/1055663786.db2.gz YGSFLSKZRAXHAT-UHFFFAOYSA-N 1 2 317.404 4.254 20 0 DIADLO COc1c(C[N@@H+]2CCC[C@@H]2c2ccc(C)nc2)ccc(F)c1F ZINC001238469786 1055665129 /nfs/dbraw/zinc/66/51/29/1055665129.db2.gz PPHWNKJKDKXDSY-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO COc1c(C[N@H+]2CCC[C@@H]2c2ccc(C)nc2)ccc(F)c1F ZINC001238469786 1055665142 /nfs/dbraw/zinc/66/51/42/1055665142.db2.gz PPHWNKJKDKXDSY-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)cs1 ZINC000671677566 1055666817 /nfs/dbraw/zinc/66/68/17/1055666817.db2.gz JVNDHYHLIMTNLY-UHFFFAOYSA-N 1 2 317.801 4.148 20 0 DIADLO COc1c(C[N@@H+]2CCC[C@H]2c2ccccc2F)ccc(F)c1F ZINC001238477519 1055668900 /nfs/dbraw/zinc/66/89/00/1055668900.db2.gz PGVBUKOSOBQVLF-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(C[N@H+]2CCC[C@H]2c2ccccc2F)ccc(F)c1F ZINC001238477519 1055668908 /nfs/dbraw/zinc/66/89/08/1055668908.db2.gz PGVBUKOSOBQVLF-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cnc(C[N@@H+]2CCC[C@H]2c2ccccc2F)c(Cl)c1 ZINC001238489911 1055672210 /nfs/dbraw/zinc/67/22/10/1055672210.db2.gz VJQJLFLICSISOA-KRWDZBQOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cnc(C[N@H+]2CCC[C@H]2c2ccccc2F)c(Cl)c1 ZINC001238489911 1055672216 /nfs/dbraw/zinc/67/22/16/1055672216.db2.gz VJQJLFLICSISOA-KRWDZBQOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc(F)c(C3CC3)c2)no1 ZINC001238504387 1055673537 /nfs/dbraw/zinc/67/35/37/1055673537.db2.gz UYGKJLZPGODZOU-SFHVURJKSA-N 1 2 300.377 4.337 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc(F)c(C3CC3)c2)no1 ZINC001238504387 1055673540 /nfs/dbraw/zinc/67/35/40/1055673540.db2.gz UYGKJLZPGODZOU-SFHVURJKSA-N 1 2 300.377 4.337 20 0 DIADLO Cc1noc([C@H](C)[N@H+](C)Cc2ccc(-c3ccccc3)cc2)n1 ZINC000042146013 1055674367 /nfs/dbraw/zinc/67/43/67/1055674367.db2.gz RNEIGPZRYFVDHU-AWEZNQCLSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1noc([C@H](C)[N@@H+](C)Cc2ccc(-c3ccccc3)cc2)n1 ZINC000042146013 1055674374 /nfs/dbraw/zinc/67/43/74/1055674374.db2.gz RNEIGPZRYFVDHU-AWEZNQCLSA-N 1 2 307.397 4.238 20 0 DIADLO Fc1c(C[N@@H+]2CCC3(CC3)C2)cc(Cl)cc1C(F)(F)F ZINC001238505758 1055675100 /nfs/dbraw/zinc/67/51/00/1055675100.db2.gz NIYGUIYDBHIJNQ-UHFFFAOYSA-N 1 2 307.718 4.484 20 0 DIADLO Fc1c(C[N@H+]2CCC3(CC3)C2)cc(Cl)cc1C(F)(F)F ZINC001238505758 1055675104 /nfs/dbraw/zinc/67/51/04/1055675104.db2.gz NIYGUIYDBHIJNQ-UHFFFAOYSA-N 1 2 307.718 4.484 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(F)c(C2CC2)c1 ZINC001238510675 1055675175 /nfs/dbraw/zinc/67/51/75/1055675175.db2.gz FFEGJENDGHZIKE-KRWDZBQOSA-N 1 2 319.420 4.009 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(F)c(C2CC2)c1 ZINC001238510675 1055675190 /nfs/dbraw/zinc/67/51/90/1055675190.db2.gz FFEGJENDGHZIKE-KRWDZBQOSA-N 1 2 319.420 4.009 20 0 DIADLO CC(C)c1ccccc1NC(=O)[C@@H](C)[N@H+](C)CCC(F)(F)F ZINC000104678114 1055678443 /nfs/dbraw/zinc/67/84/43/1055678443.db2.gz RWSHDDFNMQEPIR-GFCCVEGCSA-N 1 2 316.367 4.021 20 0 DIADLO CC(C)c1ccccc1NC(=O)[C@@H](C)[N@@H+](C)CCC(F)(F)F ZINC000104678114 1055678449 /nfs/dbraw/zinc/67/84/49/1055678449.db2.gz RWSHDDFNMQEPIR-GFCCVEGCSA-N 1 2 316.367 4.021 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@H](c2ccc(F)cc2)C2CCC2)n1 ZINC000104704105 1055678882 /nfs/dbraw/zinc/67/88/82/1055678882.db2.gz XWGMZHMGLPBNTI-SFHVURJKSA-N 1 2 317.408 4.038 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1ccc(F)c(OC(C)C)c1F ZINC001238530186 1055680783 /nfs/dbraw/zinc/68/07/83/1055680783.db2.gz RCSXNUVDHIQIME-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1ccc(F)c(OC(C)C)c1F ZINC001238530186 1055680785 /nfs/dbraw/zinc/68/07/85/1055680785.db2.gz RCSXNUVDHIQIME-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO Cc1ccc(Cl)c(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c1 ZINC001238558383 1055687171 /nfs/dbraw/zinc/68/71/71/1055687171.db2.gz XUGLQWFKQSVZKS-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccc(Cl)c(C[N@H+]2CCO[C@H](c3ccccc3)C2)c1 ZINC001238558383 1055687179 /nfs/dbraw/zinc/68/71/79/1055687179.db2.gz XUGLQWFKQSVZKS-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Fc1ccc(-c2ccccc2C[N@@H+]2CCn3cccc3C2)c(F)c1 ZINC001238580510 1055690848 /nfs/dbraw/zinc/69/08/48/1055690848.db2.gz QNZHDGCBBIRDJL-UHFFFAOYSA-N 1 2 324.374 4.449 20 0 DIADLO Fc1ccc(-c2ccccc2C[N@H+]2CCn3cccc3C2)c(F)c1 ZINC001238580510 1055690856 /nfs/dbraw/zinc/69/08/56/1055690856.db2.gz QNZHDGCBBIRDJL-UHFFFAOYSA-N 1 2 324.374 4.449 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3ncsc3C2)cnc1-c1ccccc1 ZINC001238616369 1055698580 /nfs/dbraw/zinc/69/85/80/1055698580.db2.gz VFUITFDBCQDGHA-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1cc(C[N@H+]2CCc3ncsc3C2)cnc1-c1ccccc1 ZINC001238616369 1055698587 /nfs/dbraw/zinc/69/85/87/1055698587.db2.gz VFUITFDBCQDGHA-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(Cl)cccc3C2)cnc1C1CC1 ZINC001238629270 1055703182 /nfs/dbraw/zinc/70/31/82/1055703182.db2.gz WFBYOKWWKKFVHS-UHFFFAOYSA-N 1 2 312.844 4.479 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(Cl)cccc3C2)cnc1C1CC1 ZINC001238629270 1055703190 /nfs/dbraw/zinc/70/31/90/1055703190.db2.gz WFBYOKWWKKFVHS-UHFFFAOYSA-N 1 2 312.844 4.479 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC001238654595 1055710520 /nfs/dbraw/zinc/71/05/20/1055710520.db2.gz YJHNUKXMQVMGJC-LLVKDONJSA-N 1 2 323.305 4.138 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC001238654595 1055710530 /nfs/dbraw/zinc/71/05/30/1055710530.db2.gz YJHNUKXMQVMGJC-LLVKDONJSA-N 1 2 323.305 4.138 20 0 DIADLO CCc1ccc(F)cc1C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001565582317 1055710817 /nfs/dbraw/zinc/71/08/17/1055710817.db2.gz QXSPMVOBWJUZJK-UHFFFAOYSA-N 1 2 323.371 4.135 20 0 DIADLO CSc1ccccc1C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001565581820 1055711264 /nfs/dbraw/zinc/71/12/64/1055711264.db2.gz WLPDIUVVEVIEPY-UHFFFAOYSA-N 1 2 323.421 4.155 20 0 DIADLO Cc1scc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)c1C ZINC001565581228 1055711783 /nfs/dbraw/zinc/71/17/83/1055711783.db2.gz AFPLZNCYZACHEJ-UHFFFAOYSA-N 1 2 311.410 4.111 20 0 DIADLO CSc1ccc(Cl)cc1C[N@@H+]1CCc2ncccc2C1 ZINC001238676977 1055718254 /nfs/dbraw/zinc/71/82/54/1055718254.db2.gz NNKSLWDUWSPYPC-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CSc1ccc(Cl)cc1C[N@H+]1CCc2ncccc2C1 ZINC001238676977 1055718267 /nfs/dbraw/zinc/71/82/67/1055718267.db2.gz NNKSLWDUWSPYPC-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CSc1ccc(Cl)cc1C[N@@H+]1CCc2ccncc2C1 ZINC001238678731 1055719796 /nfs/dbraw/zinc/71/97/96/1055719796.db2.gz XSAUNBZUWMCNFQ-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CSc1ccc(Cl)cc1C[N@H+]1CCc2ccncc2C1 ZINC001238678731 1055719807 /nfs/dbraw/zinc/71/98/07/1055719807.db2.gz XSAUNBZUWMCNFQ-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CSc1cc(C)cc(C[N@@H+]2CCc3nc(Cl)ccc3C2)c1 ZINC001238680682 1055720416 /nfs/dbraw/zinc/72/04/16/1055720416.db2.gz AWHBLCGNXJTFJY-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CSc1cc(C)cc(C[N@H+]2CCc3nc(Cl)ccc3C2)c1 ZINC001238680682 1055720428 /nfs/dbraw/zinc/72/04/28/1055720428.db2.gz AWHBLCGNXJTFJY-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CCOc1ccc(C)c(C[N@@H+]2CCc3ncc(Cl)cc3C2)c1 ZINC001238710946 1055728630 /nfs/dbraw/zinc/72/86/30/1055728630.db2.gz GWEITWAWCSFKOD-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1ccc(C)c(C[N@H+]2CCc3ncc(Cl)cc3C2)c1 ZINC001238710946 1055728641 /nfs/dbraw/zinc/72/86/41/1055728641.db2.gz GWEITWAWCSFKOD-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCCCCCc1ccc(C[N@H+]2CCC(=O)[C@H](F)CC2)s1 ZINC001238707045 1055728722 /nfs/dbraw/zinc/72/87/22/1055728722.db2.gz SPCJZMYSINZFBL-MRXNPFEDSA-N 1 2 311.466 4.374 20 0 DIADLO CCCCCCc1ccc(C[N@@H+]2CCC(=O)[C@H](F)CC2)s1 ZINC001238707045 1055728734 /nfs/dbraw/zinc/72/87/34/1055728734.db2.gz SPCJZMYSINZFBL-MRXNPFEDSA-N 1 2 311.466 4.374 20 0 DIADLO CC(C)c1ccc(C[N@@H+]2CCc3ccccc3C2)c(Cl)n1 ZINC001238719516 1055731394 /nfs/dbraw/zinc/73/13/94/1055731394.db2.gz AHWPZHXNWJTOJH-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc(C[N@H+]2CCc3ccccc3C2)c(Cl)n1 ZINC001238719516 1055731402 /nfs/dbraw/zinc/73/14/02/1055731402.db2.gz AHWPZHXNWJTOJH-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c(F)cn1 ZINC001238729895 1055735983 /nfs/dbraw/zinc/73/59/83/1055735983.db2.gz PAUOLEDETHMMNJ-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c(F)cn1 ZINC001238729895 1055735990 /nfs/dbraw/zinc/73/59/90/1055735990.db2.gz PAUOLEDETHMMNJ-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2)c(F)cn1 ZINC001238731909 1055738132 /nfs/dbraw/zinc/73/81/32/1055738132.db2.gz LUIKBUOCKBNLLU-LBPRGKRZSA-N 1 2 322.811 4.466 20 0 DIADLO CCOc1cc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2)c(F)cn1 ZINC001238731909 1055738144 /nfs/dbraw/zinc/73/81/44/1055738144.db2.gz LUIKBUOCKBNLLU-LBPRGKRZSA-N 1 2 322.811 4.466 20 0 DIADLO CC(C)Oc1c(C[N@H+](C)Cc2cccc(O)c2)ccc(F)c1F ZINC001238738348 1055738182 /nfs/dbraw/zinc/73/81/82/1055738182.db2.gz CZRLMZYSFVSZCS-UHFFFAOYSA-N 1 2 321.367 4.090 20 0 DIADLO CC(C)Oc1c(C[N@@H+](C)Cc2cccc(O)c2)ccc(F)c1F ZINC001238738348 1055738194 /nfs/dbraw/zinc/73/81/94/1055738194.db2.gz CZRLMZYSFVSZCS-UHFFFAOYSA-N 1 2 321.367 4.090 20 0 DIADLO COc1cc(C)c(C)cc1C[N@@H+]1CCc2ccc(C(C)=O)cc2C1 ZINC001238766024 1055743983 /nfs/dbraw/zinc/74/39/83/1055743983.db2.gz IEFVJGQSGKEJRF-UHFFFAOYSA-N 1 2 323.436 4.073 20 0 DIADLO COc1cc(C)c(C)cc1C[N@H+]1CCc2ccc(C(C)=O)cc2C1 ZINC001238766024 1055743992 /nfs/dbraw/zinc/74/39/92/1055743992.db2.gz IEFVJGQSGKEJRF-UHFFFAOYSA-N 1 2 323.436 4.073 20 0 DIADLO Cc1nc2c(s1)C[N@H+](Cc1c(C)cc(F)cc1Cl)CC2 ZINC001238785512 1055752387 /nfs/dbraw/zinc/75/23/87/1055752387.db2.gz QVONDNQKWMJSCL-UHFFFAOYSA-N 1 2 310.825 4.111 20 0 DIADLO Cc1nc2c(s1)C[N@@H+](Cc1c(C)cc(F)cc1Cl)CC2 ZINC001238785512 1055752401 /nfs/dbraw/zinc/75/24/01/1055752401.db2.gz QVONDNQKWMJSCL-UHFFFAOYSA-N 1 2 310.825 4.111 20 0 DIADLO CCCCN(C(=O)[C@H](CC(C)C)n1cc[nH+]c1)c1ccccc1 ZINC001566224997 1055753513 /nfs/dbraw/zinc/75/35/13/1055753513.db2.gz GGIAVAJQWHOQCO-SFHVURJKSA-N 1 2 313.445 4.304 20 0 DIADLO Cc1cc(OC(C)C)ncc1-c1ccccc1Cn1cc[nH+]c1 ZINC001238826385 1055755417 /nfs/dbraw/zinc/75/54/17/1055755417.db2.gz PVESBUMICSGGDN-UHFFFAOYSA-N 1 2 307.397 4.089 20 0 DIADLO CCC(C)(C)C1CCC(CC(=O)NCc2[nH]c(C)c(C)[nH+]2)CC1 ZINC001566257830 1055756029 /nfs/dbraw/zinc/75/60/29/1055756029.db2.gz IVVDRAUOFLJJEM-UHFFFAOYSA-N 1 2 319.493 4.275 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@H]3CC[C@H]3c3ccc(F)cc3)cc2[nH+]1 ZINC001566329600 1055762252 /nfs/dbraw/zinc/76/22/52/1055762252.db2.gz DGNRKQIYCKPJIW-HOTGVXAUSA-N 1 2 323.371 4.143 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CC[C@@H]3CCc4ccccc43)cc2[nH+]1 ZINC001566330076 1055762482 /nfs/dbraw/zinc/76/24/82/1055762482.db2.gz VEFVGBGJNDVNOR-HNNXBMFYSA-N 1 2 319.408 4.320 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccccc3C3CCC3)cc2[nH+]1 ZINC001566328875 1055762743 /nfs/dbraw/zinc/76/27/43/1055762743.db2.gz HAAGDWLSRRKRKT-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO CCCCc1noc(C[NH2+]C(C)(C)c2ccc(Cl)cc2)n1 ZINC000057846748 1055790988 /nfs/dbraw/zinc/79/09/88/1055790988.db2.gz CSGRFNGDRORJAI-UHFFFAOYSA-N 1 2 307.825 4.091 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2Cl)nn1C ZINC000282197191 1055792765 /nfs/dbraw/zinc/79/27/65/1055792765.db2.gz NSZZXDARUOOXFH-MNOVXSKESA-N 1 2 312.244 4.447 20 0 DIADLO Fc1cc(C[NH+]2CCOCC2)ccc1-c1cccc(Cl)c1F ZINC001238957851 1055801472 /nfs/dbraw/zinc/80/14/72/1055801472.db2.gz AXQVXTKKLGXBTD-UHFFFAOYSA-N 1 2 323.770 4.117 20 0 DIADLO C[C@@H]1CO[C@@H](C(F)(F)F)C[N@H+]1Cc1csc2ccccc12 ZINC000671712833 1055806082 /nfs/dbraw/zinc/80/60/82/1055806082.db2.gz JEPZDGHDXZBWCK-QMTHXVAHSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@@H]1CO[C@@H](C(F)(F)F)C[N@@H+]1Cc1csc2ccccc12 ZINC000671712833 1055806077 /nfs/dbraw/zinc/80/60/77/1055806077.db2.gz JEPZDGHDXZBWCK-QMTHXVAHSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC001539234536 1055807148 /nfs/dbraw/zinc/80/71/48/1055807148.db2.gz NXMRRLDUQABMIL-AWEZNQCLSA-N 1 2 321.380 4.019 20 0 DIADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC001539234536 1055807165 /nfs/dbraw/zinc/80/71/65/1055807165.db2.gz NXMRRLDUQABMIL-AWEZNQCLSA-N 1 2 321.380 4.019 20 0 DIADLO Cc1cn2c(cccc2-c2cc(Cl)cnc2OC(C)C)[nH+]1 ZINC001239319329 1055868537 /nfs/dbraw/zinc/86/85/37/1055868537.db2.gz QLIOPIMXWIIODW-UHFFFAOYSA-N 1 2 301.777 4.145 20 0 DIADLO CC(C)Oc1ncc(Cl)cc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001239319359 1055868587 /nfs/dbraw/zinc/86/85/87/1055868587.db2.gz QSRQEURFYXWMCW-UHFFFAOYSA-N 1 2 313.788 4.375 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2coc(-c3cccs3)n2)cc1 ZINC000061760485 1055870221 /nfs/dbraw/zinc/87/02/21/1055870221.db2.gz VWXDUYALOSZJPI-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2coc(-c3cccs3)n2)cc1 ZINC000061760485 1055870235 /nfs/dbraw/zinc/87/02/35/1055870235.db2.gz VWXDUYALOSZJPI-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO CCCCCCOc1cccc(CNc2cc(CO)cc[nH+]2)c1 ZINC001620978795 1055880432 /nfs/dbraw/zinc/88/04/32/1055880432.db2.gz YLGDJYWSYFNWGI-UHFFFAOYSA-N 1 2 314.429 4.145 20 0 DIADLO Cc1cc(-c2cccc(C(=O)C(F)(F)F)c2)c2[nH+]ccn2c1 ZINC001239385568 1055884880 /nfs/dbraw/zinc/88/48/80/1055884880.db2.gz GWKMCSYGDJJSFG-UHFFFAOYSA-N 1 2 304.271 4.055 20 0 DIADLO CCCc1sc(C(=O)NCc2cc(C)[nH+]c(C)c2)cc1CC ZINC001597955688 1055897306 /nfs/dbraw/zinc/89/73/06/1055897306.db2.gz CWJLVIACQXUYOM-UHFFFAOYSA-N 1 2 316.470 4.205 20 0 DIADLO CCCC[C@@H](C(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C)C(C)C ZINC001598028457 1055904761 /nfs/dbraw/zinc/90/47/61/1055904761.db2.gz KJIHWOXXJYZZJC-MRXNPFEDSA-N 1 2 320.477 4.128 20 0 DIADLO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2csc(C3CCCC3)n2)c1 ZINC000063994636 1055908882 /nfs/dbraw/zinc/90/88/82/1055908882.db2.gz ALQDMCIHUDZRFN-INIZCTEOSA-N 1 2 301.459 4.466 20 0 DIADLO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2csc(C3CCCC3)n2)c1 ZINC000063994636 1055908893 /nfs/dbraw/zinc/90/88/93/1055908893.db2.gz ALQDMCIHUDZRFN-INIZCTEOSA-N 1 2 301.459 4.466 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@@H]1CCCC[C@@H]1C1CC1 ZINC001598071071 1055910330 /nfs/dbraw/zinc/91/03/30/1055910330.db2.gz AXBHEBZTIPYZTI-IAGOWNOFSA-N 1 2 309.413 4.232 20 0 DIADLO CSc1ccc(-c2cc(C[NH+]3CCOCC3)ccc2F)cc1 ZINC001239499133 1055913154 /nfs/dbraw/zinc/91/31/54/1055913154.db2.gz UPCCEIZNBWMHLK-UHFFFAOYSA-N 1 2 317.429 4.047 20 0 DIADLO C[C@@H]1CC[C@H](C)C[N@H+]1Cc1ncc(Br)cc1Cl ZINC001615640240 1055925265 /nfs/dbraw/zinc/92/52/65/1055925265.db2.gz UEKIMBKPRZYKKO-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1ncc(Br)cc1Cl ZINC001615640240 1055925273 /nfs/dbraw/zinc/92/52/73/1055925273.db2.gz UEKIMBKPRZYKKO-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCC[C@H]1CC1CCCCC1 ZINC001598167463 1055920661 /nfs/dbraw/zinc/92/06/61/1055920661.db2.gz YKKLHCYCGVCEAB-INIZCTEOSA-N 1 2 311.429 4.138 20 0 DIADLO CC(C)Cc1cccc([C@H](C)C(=O)Nc2ccc3[nH+]ccn3c2)c1 ZINC001539936089 1055935443 /nfs/dbraw/zinc/93/54/43/1055935443.db2.gz ZWJLQDYWVOVLTD-HNNXBMFYSA-N 1 2 321.424 4.275 20 0 DIADLO Cc1coc(C(=O)Oc2ccc(-c3[nH+]cc4n3CCCC4)cc2)c1 ZINC001539990542 1055948026 /nfs/dbraw/zinc/94/80/26/1055948026.db2.gz WJQHTRDQIIKRDR-UHFFFAOYSA-N 1 2 322.364 4.007 20 0 DIADLO Clc1ccc(-c2n[nH]cc2CNc2cc3cc[nH]c3c[nH+]2)cc1 ZINC001620987142 1055960854 /nfs/dbraw/zinc/96/08/54/1055960854.db2.gz KVIMKMXVQCGVOH-UHFFFAOYSA-N 1 2 323.787 4.219 20 0 DIADLO CC(C)CC[C@@H]([NH2+]Cc1csc(N(C)C)n1)c1ccoc1 ZINC000671749836 1055963514 /nfs/dbraw/zinc/96/35/14/1055963514.db2.gz XCBNKMYTNLCMNK-OAHLLOKOSA-N 1 2 307.463 4.069 20 0 DIADLO Cl/C=C(/Cl)C[N@@H+]1CCCSC[C@H]1c1ccccc1 ZINC001620543155 1055965829 /nfs/dbraw/zinc/96/58/29/1055965829.db2.gz UGWWNODONMHYPV-SSUFTNFISA-N 1 2 302.270 4.486 20 0 DIADLO Cl/C=C(/Cl)C[N@H+]1CCCSC[C@H]1c1ccccc1 ZINC001620543155 1055965837 /nfs/dbraw/zinc/96/58/37/1055965837.db2.gz UGWWNODONMHYPV-SSUFTNFISA-N 1 2 302.270 4.486 20 0 DIADLO Cc1c2ccccc2oc1C[NH2+]Cc1nc2cc(F)ccc2o1 ZINC001620796015 1055975274 /nfs/dbraw/zinc/97/52/74/1055975274.db2.gz XLJMRJLRNJZDAB-UHFFFAOYSA-N 1 2 310.328 4.311 20 0 DIADLO c1ccc(Nc2ccc(NCc3ccc4c(c3)CCO4)[nH+]c2)cc1 ZINC001621012130 1055978580 /nfs/dbraw/zinc/97/85/80/1055978580.db2.gz HUAQZVVWNKHISU-UHFFFAOYSA-N 1 2 317.392 4.372 20 0 DIADLO FC(F)c1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)cn1 ZINC001620704384 1055983266 /nfs/dbraw/zinc/98/32/66/1055983266.db2.gz KCQCRUNJYIZBMP-QGZVFWFLSA-N 1 2 314.335 4.491 20 0 DIADLO Nc1ccc[nH+]c1Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000020317447 1055988433 /nfs/dbraw/zinc/98/84/33/1055988433.db2.gz BUIPLQVPBKOXNC-UHFFFAOYSA-N 1 2 321.224 4.445 20 0 DIADLO CCC(CC)C[NH2+]c1ccc(N2CCOC[C@H]2C)c(Cl)c1 ZINC001621024407 1055991555 /nfs/dbraw/zinc/99/15/55/1055991555.db2.gz WIPZPSXKYXNYDR-CYBMUJFWSA-N 1 2 310.869 4.413 20 0 DIADLO COc1ccc(Br)cc1CNc1c[nH+]c(C)c(C)c1 ZINC001621047061 1056005680 /nfs/dbraw/zinc/00/56/80/1056005680.db2.gz FXDLEMVOBHRXPL-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO CC(C)(C)c1noc(C[NH2+][C@H](c2ccccc2)C(C)(C)C)n1 ZINC000067978102 1056001195 /nfs/dbraw/zinc/00/11/95/1056001195.db2.gz XSGIGXRUUMJFBY-OAHLLOKOSA-N 1 2 301.434 4.244 20 0 DIADLO COc1ccc(C[NH2+][C@H]2c3ccccc3CC[C@@H]2F)c(Cl)c1 ZINC001621043367 1056004290 /nfs/dbraw/zinc/00/42/90/1056004290.db2.gz DENNTHWHBQCJAZ-ROUUACIJSA-N 1 2 319.807 4.464 20 0 DIADLO CC[C@H]([NH2+]Cc1cccc(O)c1)c1nc(C(F)(F)F)cs1 ZINC001620814105 1056007100 /nfs/dbraw/zinc/00/71/00/1056007100.db2.gz DTIMIYGEHMMVDZ-NSHDSACASA-N 1 2 316.348 4.108 20 0 DIADLO COc1cccc2[nH]c(NCc3cccc(C(F)(F)F)c3)[nH+]c21 ZINC001621053126 1056010834 /nfs/dbraw/zinc/01/08/34/1056010834.db2.gz CZAKYKVPLLGNNP-UHFFFAOYSA-N 1 2 321.302 4.202 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000072575192 1056029827 /nfs/dbraw/zinc/02/98/27/1056029827.db2.gz FOVVFMFPPPANPF-SJORKVTESA-N 1 2 317.477 4.112 20 0 DIADLO CC(C)(C)Oc1ccccc1C[NH2+]Cc1nc2ccccc2o1 ZINC001620816772 1056031086 /nfs/dbraw/zinc/03/10/86/1056031086.db2.gz UQLSMKLXCJCFBS-UHFFFAOYSA-N 1 2 310.397 4.295 20 0 DIADLO CCC[C@@H](NC(=O)[C@H](CC(C)C)n1cc[nH+]c1)c1ccccc1 ZINC001540587323 1056048558 /nfs/dbraw/zinc/04/85/58/1056048558.db2.gz GABPVTNGFFKGMQ-MSOLQXFVSA-N 1 2 313.445 4.128 20 0 DIADLO COc1cccc(-c2c[nH+]c(N3CCCCC3)cc2C)c1F ZINC001239750107 1056057325 /nfs/dbraw/zinc/05/73/25/1056057325.db2.gz TYGWGVJTZXQQBA-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO c1cn2cccc(Nc3cncc(Oc4ccccc4)c3)c2[nH+]1 ZINC001203557435 1056064600 /nfs/dbraw/zinc/06/46/00/1056064600.db2.gz YDSUJUWCAKMCMY-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)[C@@H]1CCC[C@H]2CCCC[C@H]21 ZINC001540719892 1056067809 /nfs/dbraw/zinc/06/78/09/1056067809.db2.gz ZETNSYYZAMWYLE-BRWVUGGUSA-N 1 2 323.440 4.417 20 0 DIADLO C/C(=C/C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1C ZINC001541009421 1056088307 /nfs/dbraw/zinc/08/83/07/1056088307.db2.gz HXWRUNSYXMJRJJ-VBKFSLOCSA-N 1 2 317.392 4.223 20 0 DIADLO c1ccc(COc2ccccc2-c2c[nH+]c3c(c2)CCCN3)cc1 ZINC001239830618 1056096629 /nfs/dbraw/zinc/09/66/29/1056096629.db2.gz BXFBPZKCTHUCOV-UHFFFAOYSA-N 1 2 316.404 4.328 20 0 DIADLO CCCC1(C(=O)N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)CCC1 ZINC001611052619 1056101679 /nfs/dbraw/zinc/10/16/79/1056101679.db2.gz OSMHLPCOIQQQNT-HNNXBMFYSA-N 1 2 311.429 4.020 20 0 DIADLO CCC[C@@H](CC)C(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC001542205290 1056110398 /nfs/dbraw/zinc/11/03/98/1056110398.db2.gz WTDCRPWNNAVCJZ-UONOGXRCSA-N 1 2 323.506 4.140 20 0 DIADLO CCC[C@@H](CC)C(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC001542205290 1056110411 /nfs/dbraw/zinc/11/04/11/1056110411.db2.gz WTDCRPWNNAVCJZ-UONOGXRCSA-N 1 2 323.506 4.140 20 0 DIADLO CC(C)CC(CC(C)C)C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC001542298236 1056115204 /nfs/dbraw/zinc/11/52/04/1056115204.db2.gz VWDPYZPJOSTFOC-KRWDZBQOSA-N 1 2 321.509 4.122 20 0 DIADLO COc1ccccc1C[N@H+](Cc1nc2ccccc2o1)C1CC1 ZINC000052183157 1056117064 /nfs/dbraw/zinc/11/70/64/1056117064.db2.gz FYNYAIKXOSJBTI-UHFFFAOYSA-N 1 2 308.381 4.001 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1nc2ccccc2o1)C1CC1 ZINC000052183157 1056117071 /nfs/dbraw/zinc/11/70/71/1056117071.db2.gz FYNYAIKXOSJBTI-UHFFFAOYSA-N 1 2 308.381 4.001 20 0 DIADLO Clc1cccc(Br)c1C[N@H+]1CCC[C@H]2C[C@H]21 ZINC001137815825 1056156845 /nfs/dbraw/zinc/15/68/45/1056156845.db2.gz BPWRRQRWDMUYQT-TVQRCGJNSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1cccc(Br)c1C[N@@H+]1CCC[C@H]2C[C@H]21 ZINC001137815825 1056156839 /nfs/dbraw/zinc/15/68/39/1056156839.db2.gz BPWRRQRWDMUYQT-TVQRCGJNSA-N 1 2 300.627 4.087 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cccc(C(=O)N(C)C)c2)c1 ZINC001239925005 1056163420 /nfs/dbraw/zinc/16/34/20/1056163420.db2.gz JAAJNXFFTSSCAU-UHFFFAOYSA-N 1 2 310.441 4.210 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3cc[nH]c3C(C)C)cc2)[nH+]c1C ZINC000921656648 1056167254 /nfs/dbraw/zinc/16/72/54/1056167254.db2.gz UIRGVEDZVWDPJN-UHFFFAOYSA-N 1 2 322.412 4.397 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C(C3CC3)C3CC3)cc2)[nH+]c1C ZINC000921662475 1056171639 /nfs/dbraw/zinc/17/16/39/1056171639.db2.gz MZYFAFPUDOHUPE-UHFFFAOYSA-N 1 2 309.413 4.068 20 0 DIADLO Cc1ccc(C)c(C[NH2+][C@@H](c2nccn2C)c2ccc(F)cc2)c1 ZINC000030644363 1056172515 /nfs/dbraw/zinc/17/25/15/1056172515.db2.gz GHZNYVBPFVSFAJ-LJQANCHMSA-N 1 2 323.415 4.055 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3conc3C(C)C)cc2)[nH+]c1C ZINC000921668513 1056178397 /nfs/dbraw/zinc/17/83/97/1056178397.db2.gz GMBXPRXGAIZGNW-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO CCc1cc(Nc2ccc([NH+]3CCCCC3)cc2)nc(CC)n1 ZINC001611731710 1056182381 /nfs/dbraw/zinc/18/23/81/1056182381.db2.gz BWFKRLQEDVRRTB-UHFFFAOYSA-N 1 2 310.445 4.335 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cncc2ccccc21 ZINC001239948265 1056183680 /nfs/dbraw/zinc/18/36/80/1056183680.db2.gz OTILRJAQNTXEST-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO Cc1nc(NCCc2ccc(Cl)s2)c2c([nH+]1)CCCC2 ZINC001611812222 1056194076 /nfs/dbraw/zinc/19/40/76/1056194076.db2.gz HOBJSRKPABXNDL-UHFFFAOYSA-N 1 2 307.850 4.033 20 0 DIADLO Cc1cc(C)cc(OCCNc2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC001611861170 1056199256 /nfs/dbraw/zinc/19/92/56/1056199256.db2.gz UPXKUFTZKPECKM-UHFFFAOYSA-N 1 2 311.429 4.160 20 0 DIADLO Cc1cc(N2CCC(Nc3ccccc3)CC2)nc(C2CCC2)[nH+]1 ZINC001611869672 1056200897 /nfs/dbraw/zinc/20/08/97/1056200897.db2.gz GFXAACJWXINWLJ-UHFFFAOYSA-N 1 2 322.456 4.133 20 0 DIADLO CCCCCC[C@H](C)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001611875597 1056202226 /nfs/dbraw/zinc/20/22/26/1056202226.db2.gz ZYILQXGWZBNEMQ-ZDUSSCGKSA-N 1 2 303.454 4.352 20 0 DIADLO CCCOc1ccc(-c2cc(C)c3[nH+]ccn3c2)c(F)c1F ZINC001239969635 1056208858 /nfs/dbraw/zinc/20/88/58/1056208858.db2.gz RPMJYGLBHYSQEX-UHFFFAOYSA-N 1 2 302.324 4.377 20 0 DIADLO CC[C@H](Cc1ccccc1)Nc1nc2ccccc2n2c[nH+]cc12 ZINC001611929960 1056210579 /nfs/dbraw/zinc/21/05/79/1056210579.db2.gz HPOHVPRWOFDCJA-MRXNPFEDSA-N 1 2 316.408 4.316 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@H]2CCCc3cn(C(C)C)nc32)o1 ZINC000765820140 1056211238 /nfs/dbraw/zinc/21/12/38/1056211238.db2.gz SVAGZIUPLHWKMH-BBRMVZONSA-N 1 2 301.434 4.348 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)CCC2 ZINC000765820014 1056215664 /nfs/dbraw/zinc/21/56/64/1056215664.db2.gz RWWXYVAYRIJFKC-WBMJQRKESA-N 1 2 319.399 4.470 20 0 DIADLO Cc1nc(N2CC[C@@H](c3ccccc3)[C@@H](C)C2)c2c([nH+]1)CCCC2 ZINC001612036260 1056225803 /nfs/dbraw/zinc/22/58/03/1056225803.db2.gz VKYWNCBRNVJQJM-MAUKXSAKSA-N 1 2 321.468 4.294 20 0 DIADLO CC(C)c1ccc2ncnc(Nc3ccc4c(c3)[nH+]cn4C)c2c1 ZINC001612043145 1056227882 /nfs/dbraw/zinc/22/78/82/1056227882.db2.gz LVSQQNDEIMEUHA-UHFFFAOYSA-N 1 2 317.396 4.384 20 0 DIADLO COc1c(C)cccc1C[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000655813354 1056230860 /nfs/dbraw/zinc/23/08/60/1056230860.db2.gz WHZYCZVLFAADQQ-CYBMUJFWSA-N 1 2 304.459 4.434 20 0 DIADLO Cc1cc(N2CC[C@H](c3ccccc3)[C@H]2C)nc(C2CCC2)[nH+]1 ZINC001612074104 1056233490 /nfs/dbraw/zinc/23/34/90/1056233490.db2.gz VBKWHQRVBDBBOU-QAPCUYQASA-N 1 2 307.441 4.435 20 0 DIADLO CCc1ccc(-c2ccc(C(=O)Nc3cc(C)[nH+]cc3C)o2)cc1 ZINC001584009447 1056234814 /nfs/dbraw/zinc/23/48/14/1056234814.db2.gz JWEGIHBTYRUILA-UHFFFAOYSA-N 1 2 320.392 4.195 20 0 DIADLO Cc1cc(NC(=O)c2c(Cl)cc(Cl)cc2Cl)cc[nH+]1 ZINC001584004818 1056235892 /nfs/dbraw/zinc/23/58/92/1056235892.db2.gz HYDHVDISCSOSLR-UHFFFAOYSA-N 1 2 315.587 4.024 20 0 DIADLO Cc1nc(N2CCC(CCC(C)C)CC2)c2c([nH+]1)CCCC2 ZINC001612109393 1056239962 /nfs/dbraw/zinc/23/99/62/1056239962.db2.gz QGNKAFXETKVOCM-UHFFFAOYSA-N 1 2 301.478 4.316 20 0 DIADLO Cc1nc(N[C@H](C)[C@H](C)c2ccccc2C(F)(F)F)cc[nH+]1 ZINC001612148806 1056245327 /nfs/dbraw/zinc/24/53/27/1056245327.db2.gz IWSGACIJMAENAL-WDEREUQCSA-N 1 2 309.335 4.408 20 0 DIADLO CNc1ccc(Nc2nc3cc(Cl)cc(Cl)c3o2)c[nH+]1 ZINC001612145082 1056245403 /nfs/dbraw/zinc/24/54/03/1056245403.db2.gz JPHUILDXFDIILS-UHFFFAOYSA-N 1 2 309.156 4.315 20 0 DIADLO CCCC[C@H](Nc1[nH+]cnc2c1cnn2C(C)(C)C)C1CCC1 ZINC001612139139 1056246069 /nfs/dbraw/zinc/24/60/69/1056246069.db2.gz MQIBKJMGVCHJEJ-HNNXBMFYSA-N 1 2 315.465 4.352 20 0 DIADLO CCc1cc(N(C)Cc2ccc(Cl)c(F)c2)nc(CC)[nH+]1 ZINC001612215226 1056254506 /nfs/dbraw/zinc/25/45/06/1056254506.db2.gz HDISDEAZURVOFU-UHFFFAOYSA-N 1 2 307.800 4.030 20 0 DIADLO CCc1cc(NCc2cccc(CSC)c2)nc(CC)[nH+]1 ZINC001612272339 1056264128 /nfs/dbraw/zinc/26/41/28/1056264128.db2.gz GMRCPFJQNXFEBJ-UHFFFAOYSA-N 1 2 301.459 4.077 20 0 DIADLO Cc1cc(C)c2c(c1)CN(c1cc(C)[nH+]c(C3CCC3)n1)CC2 ZINC001612268871 1056264767 /nfs/dbraw/zinc/26/47/67/1056264767.db2.gz LQTWZDMBHXJEBJ-UHFFFAOYSA-N 1 2 307.441 4.232 20 0 DIADLO CCc1cc(N[C@H](C)c2ccccc2SC)nc(CC)[nH+]1 ZINC001612297513 1056267924 /nfs/dbraw/zinc/26/79/24/1056267924.db2.gz APJVTFDCSFUVFZ-GFCCVEGCSA-N 1 2 301.459 4.496 20 0 DIADLO CCc1nnc(C[NH2+]Cc2cccc(-c3ccccc3)c2)s1 ZINC000353074235 1056269540 /nfs/dbraw/zinc/26/95/40/1056269540.db2.gz TXEBGQJHNVYLTI-UHFFFAOYSA-N 1 2 309.438 4.057 20 0 DIADLO Cc1cc(CNC(=O)CCCc2ccc(C3CC3)cc2)cc(C)[nH+]1 ZINC001584184809 1056279322 /nfs/dbraw/zinc/27/93/22/1056279322.db2.gz WNPBDHGZPURCIE-UHFFFAOYSA-N 1 2 322.452 4.215 20 0 DIADLO Cc1nc(N2CC[C@H](C(C)(C)C)C[C@@H]2C)c2c([nH+]1)CCCC2 ZINC001612443650 1056288969 /nfs/dbraw/zinc/28/89/69/1056288969.db2.gz JAFUEHKNLTWKGM-ZFWWWQNUSA-N 1 2 301.478 4.315 20 0 DIADLO Cc1nc(N2CC[C@@H](C(C)(C)C)C[C@@H]2C)c2c([nH+]1)CCCC2 ZINC001612443647 1056289059 /nfs/dbraw/zinc/28/90/59/1056289059.db2.gz JAFUEHKNLTWKGM-DZGCQCFKSA-N 1 2 301.478 4.315 20 0 DIADLO Cc1nc(N2CC[C@@H](C(C)(C)C)C[C@H]2C)c2c([nH+]1)CCCC2 ZINC001612443649 1056289571 /nfs/dbraw/zinc/28/95/71/1056289571.db2.gz JAFUEHKNLTWKGM-UKRRQHHQSA-N 1 2 301.478 4.315 20 0 DIADLO Cc1cc(C)c(NC(=O)CCC[N@@H+]2CCC[C@@H]2C(F)F)c(C)c1 ZINC000353171288 1056289751 /nfs/dbraw/zinc/28/97/51/1056289751.db2.gz HZNQPXYIOVCIII-OAHLLOKOSA-N 1 2 324.415 4.060 20 0 DIADLO Cc1cc(C)c(NC(=O)CCC[N@H+]2CCC[C@@H]2C(F)F)c(C)c1 ZINC000353171288 1056289766 /nfs/dbraw/zinc/28/97/66/1056289766.db2.gz HZNQPXYIOVCIII-OAHLLOKOSA-N 1 2 324.415 4.060 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@@H+]1Cc1cncnc1 ZINC000353140141 1056290351 /nfs/dbraw/zinc/29/03/51/1056290351.db2.gz AFFDSDUEJSHOOX-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@H+]1Cc1cncnc1 ZINC000353140141 1056290362 /nfs/dbraw/zinc/29/03/62/1056290362.db2.gz AFFDSDUEJSHOOX-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO Cc1nc(N2CCC3(CCc4ccccc4C3)CC2)c(C)c(C)[nH+]1 ZINC001612567026 1056305619 /nfs/dbraw/zinc/30/56/19/1056305619.db2.gz JWTHZRLGCXEVMZ-UHFFFAOYSA-N 1 2 321.468 4.177 20 0 DIADLO Nc1ccc(Cl)cc1Nc1cc[nH+]c2ccc(Cl)cc12 ZINC001212427246 1056309155 /nfs/dbraw/zinc/30/91/55/1056309155.db2.gz JIJMTXWGAUNIPG-UHFFFAOYSA-N 1 2 304.180 4.289 20 0 DIADLO CCC(C)(C)[C@@H](C)Nc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC001612600815 1056310083 /nfs/dbraw/zinc/31/00/83/1056310083.db2.gz USFCGTQESLISFV-CYBMUJFWSA-N 1 2 309.417 4.052 20 0 DIADLO COc1cccc2[nH+]c(N[C@H]3CCNc4ccccc43)ccc21 ZINC001168640277 1056313726 /nfs/dbraw/zinc/31/37/26/1056313726.db2.gz YGVXFKMCDWYQNA-KRWDZBQOSA-N 1 2 305.381 4.212 20 0 DIADLO CC(C)c1ncc(C[N@H+](C)Cc2cc(F)c(F)c(F)c2)s1 ZINC000347659479 1056317691 /nfs/dbraw/zinc/31/76/91/1056317691.db2.gz ATAHSRUCFIVIQX-UHFFFAOYSA-N 1 2 314.376 4.316 20 0 DIADLO CC(C)c1ncc(C[N@@H+](C)Cc2cc(F)c(F)c(F)c2)s1 ZINC000347659479 1056317706 /nfs/dbraw/zinc/31/77/06/1056317706.db2.gz ATAHSRUCFIVIQX-UHFFFAOYSA-N 1 2 314.376 4.316 20 0 DIADLO CCC(CC)CCCN(C)c1[nH+]cnc2c1cnn2C(C)(C)C ZINC001612661494 1056317668 /nfs/dbraw/zinc/31/76/68/1056317668.db2.gz HXTYSQXCEBGTAS-UHFFFAOYSA-N 1 2 317.481 4.234 20 0 DIADLO Cc1nc(N(C)C[C@@H](C)C2CCCCC2)c2c([nH+]1)CCCC2 ZINC001612728284 1056323970 /nfs/dbraw/zinc/32/39/70/1056323970.db2.gz YTMWSGCDPDQXHI-CQSZACIVSA-N 1 2 301.478 4.316 20 0 DIADLO COc1ccc(-c2ccc(-c3nc4c(ccn4C)c[nH+]3)cc2)cc1 ZINC001240097072 1056324382 /nfs/dbraw/zinc/32/43/82/1056324382.db2.gz JMOLYCMLVKFBEH-UHFFFAOYSA-N 1 2 315.376 4.311 20 0 DIADLO C[C@@H]([NH2+][C@H](COCc1ccccc1)c1ccccc1)c1ncc[nH]1 ZINC000353535497 1056328534 /nfs/dbraw/zinc/32/85/34/1056328534.db2.gz WDFZNUWMIQQQQJ-VQIMIIECSA-N 1 2 321.424 4.018 20 0 DIADLO C[C@@H]([NH2+][C@@H](COCc1ccccc1)c1ccccc1)c1ncc[nH]1 ZINC000353535494 1056329908 /nfs/dbraw/zinc/32/99/08/1056329908.db2.gz WDFZNUWMIQQQQJ-APWZRJJASA-N 1 2 321.424 4.018 20 0 DIADLO Cc1cc[nH+]c(C)c1-c1cccc(C(=O)N2CCC(C)CC2)c1 ZINC001240108600 1056330867 /nfs/dbraw/zinc/33/08/67/1056330867.db2.gz BXZZSYVGAHKXTH-UHFFFAOYSA-N 1 2 308.425 4.238 20 0 DIADLO Cc1cnc(Cl)c(C[NH2+]Cc2nc(C(C)(C)C)cs2)c1 ZINC000921697318 1056331343 /nfs/dbraw/zinc/33/13/43/1056331343.db2.gz JRNIGIILVGUDJL-UHFFFAOYSA-N 1 2 309.866 4.087 20 0 DIADLO O=C(Nc1ccccc1)c1cccc(-c2cccc3[nH+]ccn32)c1 ZINC001240114026 1056334793 /nfs/dbraw/zinc/33/47/93/1056334793.db2.gz PIDRRTYWXQDRRP-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO CCc1cc(N2C[C@H](c3ccccc3)CC2(C)C)nc(CC)[nH+]1 ZINC001613005230 1056344249 /nfs/dbraw/zinc/34/42/49/1056344249.db2.gz VHMMXGLMXCXNKV-MRXNPFEDSA-N 1 2 309.457 4.374 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccc(CNC(C)=O)cc2)c1 ZINC001240153492 1056356712 /nfs/dbraw/zinc/35/67/12/1056356712.db2.gz JJSURQPPKHJYQY-UHFFFAOYSA-N 1 2 310.441 4.144 20 0 DIADLO C[C@H](CCSc1[nH+]cc2ccccn21)OCc1ccccc1 ZINC001613234908 1056361646 /nfs/dbraw/zinc/36/16/46/1056361646.db2.gz UWIRGBXTGDSVQN-OAHLLOKOSA-N 1 2 312.438 4.422 20 0 DIADLO Cc1ccc(C)c(-c2ccc(-c3ccc4[nH+]ccn4c3)nn2)c1 ZINC001240216102 1056373571 /nfs/dbraw/zinc/37/35/71/1056373571.db2.gz CDSIKQPSLZVTAT-UHFFFAOYSA-N 1 2 300.365 4.075 20 0 DIADLO CCOC(=O)c1cccc2c(-c3ccc4[nH+]ccn4c3)cccc12 ZINC001240218917 1056375596 /nfs/dbraw/zinc/37/55/96/1056375596.db2.gz POHAUNPTTVZIBZ-UHFFFAOYSA-N 1 2 316.360 4.331 20 0 DIADLO CC(C)(C)OC(=O)c1ccc(F)cc1-c1ccc2[nH+]ccn2c1 ZINC001240218674 1056376169 /nfs/dbraw/zinc/37/61/69/1056376169.db2.gz JNVWWVZSNBDXRK-UHFFFAOYSA-N 1 2 312.344 4.096 20 0 DIADLO CCOC(=O)[C@H](CC)c1ccc(-c2ccc3[nH+]ccn3c2)cc1 ZINC001240218734 1056376499 /nfs/dbraw/zinc/37/64/99/1056376499.db2.gz WVLHDTFPUQQITJ-QGZVFWFLSA-N 1 2 308.381 4.058 20 0 DIADLO Fc1ccccc1COc1cc(-c2ccc3[nH+]ccn3c2)ccn1 ZINC001240221985 1056378081 /nfs/dbraw/zinc/37/80/81/1056378081.db2.gz SBTGQKPCAYPJIS-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO COc1cccc2[nH+]c(N[C@H]3CCCc4cccnc43)ccc21 ZINC001168655105 1056388808 /nfs/dbraw/zinc/38/88/08/1056388808.db2.gz CFQMMUVQXFVOLJ-INIZCTEOSA-N 1 2 305.381 4.128 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000303733259 1056407437 /nfs/dbraw/zinc/40/74/37/1056407437.db2.gz FLDPZGVHYLLFIY-OALUTQOASA-N 1 2 317.379 4.489 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000303733259 1056407441 /nfs/dbraw/zinc/40/74/41/1056407441.db2.gz FLDPZGVHYLLFIY-OALUTQOASA-N 1 2 317.379 4.489 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSC1(CO)CCCCC1 ZINC001613785323 1056407973 /nfs/dbraw/zinc/40/79/73/1056407973.db2.gz DZKVRTSJNFBLFA-UHFFFAOYSA-N 1 2 316.470 4.109 20 0 DIADLO COc1c(C)c[nH+]c(CSc2nc3cc(C)ccc3o2)c1C ZINC000303808172 1056420272 /nfs/dbraw/zinc/42/02/72/1056420272.db2.gz UQTDSRMGMUFMKX-UHFFFAOYSA-N 1 2 314.410 4.449 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccnc(C(F)(F)F)c2)c1 ZINC001240340161 1056434320 /nfs/dbraw/zinc/43/43/20/1056434320.db2.gz VWRVRVBPINEXBF-UHFFFAOYSA-N 1 2 303.287 4.168 20 0 DIADLO Cc1cc(C)c(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)s1 ZINC001584953496 1056449719 /nfs/dbraw/zinc/44/97/19/1056449719.db2.gz VGWYIUJJMGAHQT-UHFFFAOYSA-N 1 2 311.410 4.111 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)C(C)C ZINC000921744430 1056454474 /nfs/dbraw/zinc/45/44/74/1056454474.db2.gz DABNLWHOHNMSDX-MRXNPFEDSA-N 1 2 301.434 4.162 20 0 DIADLO Cc1cnc(Cl)c(C[NH2+]C2(c3nccs3)CCCC2)c1 ZINC000921750565 1056459227 /nfs/dbraw/zinc/45/92/27/1056459227.db2.gz WYAUYRKPURKVLC-UHFFFAOYSA-N 1 2 307.850 4.059 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2cc(F)ccc2-c2ccoc2)c[nH+]1 ZINC001585011376 1056461863 /nfs/dbraw/zinc/46/18/63/1056461863.db2.gz DSCLYBIJEHJWKO-UHFFFAOYSA-N 1 2 324.355 4.028 20 0 DIADLO CC(C)[C@H]1N(C(=O)C[C@H](C)n2cc[nH+]c2)CC12CCCCCC2 ZINC001544619368 1056468154 /nfs/dbraw/zinc/46/81/54/1056468154.db2.gz QHQGBZRXPCTMKT-FUHWJXTLSA-N 1 2 317.477 4.042 20 0 DIADLO C[C@@H](c1nc(-c2ccccc2)no1)[N@H+](C)Cc1ccc(F)cc1 ZINC000072863360 1056472223 /nfs/dbraw/zinc/47/22/23/1056472223.db2.gz SDJBLAZQHWMKCV-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1nc(-c2ccccc2)no1)[N@@H+](C)Cc1ccc(F)cc1 ZINC000072863360 1056472231 /nfs/dbraw/zinc/47/22/31/1056472231.db2.gz SDJBLAZQHWMKCV-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3nnc(-c4ccccc4)o3)CCC2)cc1 ZINC000624772807 1056473747 /nfs/dbraw/zinc/47/37/47/1056473747.db2.gz OMSJQYFTAOAMOF-UHFFFAOYSA-N 1 2 323.371 4.045 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2cc(C)cnc2Cl)on1 ZINC000921786158 1056492466 /nfs/dbraw/zinc/49/24/66/1056492466.db2.gz QLAYCNFARVUCKL-UHFFFAOYSA-N 1 2 307.825 4.225 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1cccc(-n2ccnc2)c1 ZINC000921798384 1056499241 /nfs/dbraw/zinc/49/92/41/1056499241.db2.gz FLCBMCCPDGLIHW-AWEZNQCLSA-N 1 2 324.428 4.009 20 0 DIADLO COc1ccc2c(c1)[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)CCC2 ZINC000921816388 1056514187 /nfs/dbraw/zinc/51/41/87/1056514187.db2.gz AGVSRKFGVUBECF-INIZCTEOSA-N 1 2 314.429 4.148 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]Cc2ccc(CSC)cc2)cs1 ZINC000921825792 1056521776 /nfs/dbraw/zinc/52/17/76/1056521776.db2.gz XNBQLFFKOQZLKW-GFCCVEGCSA-N 1 2 322.499 4.003 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]Cc2ccc(CSC)cc2)cs1 ZINC000921825795 1056522262 /nfs/dbraw/zinc/52/22/62/1056522262.db2.gz XNBQLFFKOQZLKW-LBPRGKRZSA-N 1 2 322.499 4.003 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2cncc(Cl)c2)[C@H]1c1ccccc1 ZINC001615524683 1056527302 /nfs/dbraw/zinc/52/73/02/1056527302.db2.gz XGMKJFBPZTVSBK-CXAGYDPISA-N 1 2 318.873 4.414 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2cncc(Cl)c2)[C@H]1c1ccccc1 ZINC001615524683 1056527317 /nfs/dbraw/zinc/52/73/17/1056527317.db2.gz XGMKJFBPZTVSBK-CXAGYDPISA-N 1 2 318.873 4.414 20 0 DIADLO CC(C)[C@@H]1CCCC[N@@H+]1Cc1c(F)c(F)c(F)c(F)c1F ZINC001615519706 1056527483 /nfs/dbraw/zinc/52/74/83/1056527483.db2.gz MCIKIJYGUPWFOB-JTQLQIEISA-N 1 2 307.306 4.393 20 0 DIADLO CC(C)[C@@H]1CCCC[N@H+]1Cc1c(F)c(F)c(F)c(F)c1F ZINC001615519706 1056527499 /nfs/dbraw/zinc/52/74/99/1056527499.db2.gz MCIKIJYGUPWFOB-JTQLQIEISA-N 1 2 307.306 4.393 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2cncc(Cl)c2)[C@H]1c1ccccc1 ZINC001615524686 1056527939 /nfs/dbraw/zinc/52/79/39/1056527939.db2.gz XGMKJFBPZTVSBK-SUMWQHHRSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2cncc(Cl)c2)[C@H]1c1ccccc1 ZINC001615524686 1056527951 /nfs/dbraw/zinc/52/79/51/1056527951.db2.gz XGMKJFBPZTVSBK-SUMWQHHRSA-N 1 2 318.873 4.414 20 0 DIADLO Fc1ccc(C(F)(F)C[NH+]2CCc3ccccc3CC2)cc1 ZINC001615535500 1056528949 /nfs/dbraw/zinc/52/89/49/1056528949.db2.gz GRYDSUACXXFCJV-UHFFFAOYSA-N 1 2 305.343 4.018 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@@H+]2CC/C=C\c2ccccc2)o1 ZINC001615583689 1056538419 /nfs/dbraw/zinc/53/84/19/1056538419.db2.gz NJUBWQWEBUBSPG-SMTIMMHKSA-N 1 2 311.425 4.319 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@H+]2CC/C=C\c2ccccc2)o1 ZINC001615583689 1056538437 /nfs/dbraw/zinc/53/84/37/1056538437.db2.gz NJUBWQWEBUBSPG-SMTIMMHKSA-N 1 2 311.425 4.319 20 0 DIADLO Cc1nc(C[N@@H+]2CC(C)(C)OCC2(C)C)sc1C(C)(C)C ZINC001615571282 1056539249 /nfs/dbraw/zinc/53/92/49/1056539249.db2.gz ZOSTZGWOJZYNMG-UHFFFAOYSA-N 1 2 310.507 4.138 20 0 DIADLO Cc1nc(C[N@H+]2CC(C)(C)OCC2(C)C)sc1C(C)(C)C ZINC001615571282 1056539260 /nfs/dbraw/zinc/53/92/60/1056539260.db2.gz ZOSTZGWOJZYNMG-UHFFFAOYSA-N 1 2 310.507 4.138 20 0 DIADLO CC(C)CCC[C@@H](C)N(CCC(C)C)C(=O)Cc1[nH]cc[nH+]1 ZINC001544979089 1056539758 /nfs/dbraw/zinc/53/97/58/1056539758.db2.gz KJOIRTNUJMBGJU-MRXNPFEDSA-N 1 2 307.482 4.042 20 0 DIADLO Cc1ccc(Oc2nc(-c3ccn4cc[nH+]c4c3)ncc2F)cc1 ZINC001240502981 1056541254 /nfs/dbraw/zinc/54/12/54/1056541254.db2.gz DDHFPAHOFKCBKB-UHFFFAOYSA-N 1 2 320.327 4.031 20 0 DIADLO CCn1c2ccc(Br)cc2[nH+]c1NCc1ccoc1 ZINC000765943880 1056542756 /nfs/dbraw/zinc/54/27/56/1056542756.db2.gz HJDPNXLCDSROOI-UHFFFAOYSA-N 1 2 320.190 4.024 20 0 DIADLO CC(C)(C)c1cc(-c2ccn3cc[nH+]c3c2)nc(C(C)(C)C)n1 ZINC001240504411 1056543081 /nfs/dbraw/zinc/54/30/81/1056543081.db2.gz OSUYLHAEHGHMAW-UHFFFAOYSA-N 1 2 308.429 4.386 20 0 DIADLO CC(C)(C)OC(=O)c1ccc(-c2ccn3cc[nH+]c3c2)cc1F ZINC001240511039 1056544330 /nfs/dbraw/zinc/54/43/30/1056544330.db2.gz ZUDRCFMCFGULIY-UHFFFAOYSA-N 1 2 312.344 4.096 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@@H+]2Cc2ccc(Cl)nn2)o1 ZINC001615584924 1056544817 /nfs/dbraw/zinc/54/48/17/1056544817.db2.gz ZCYNRTIHVRZTAB-HNNXBMFYSA-N 1 2 319.836 4.403 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@H+]2Cc2ccc(Cl)nn2)o1 ZINC001615584924 1056544828 /nfs/dbraw/zinc/54/48/28/1056544828.db2.gz ZCYNRTIHVRZTAB-HNNXBMFYSA-N 1 2 319.836 4.403 20 0 DIADLO COc1ccc(-c2cccnc2)cc1-c1ccn2cc[nH+]c2c1 ZINC001240509397 1056545155 /nfs/dbraw/zinc/54/51/55/1056545155.db2.gz YPGHOOQYRZOVPV-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO Fc1cc(O[C@@H]2CCCCO2)ccc1-c1ccn2cc[nH+]c2c1 ZINC001240517924 1056549387 /nfs/dbraw/zinc/54/93/87/1056549387.db2.gz IRLXLKPBSPOFIY-GOSISDBHSA-N 1 2 312.344 4.046 20 0 DIADLO FC(F)(F)COc1ccccc1CNc1cc2cc[nH]c2c[nH+]1 ZINC000672170893 1056557276 /nfs/dbraw/zinc/55/72/76/1056557276.db2.gz FSKQPRBIVNWGFL-UHFFFAOYSA-N 1 2 321.302 4.116 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC[C@H](C)C[C@H]1c1ccc(C)o1 ZINC001615679220 1056563530 /nfs/dbraw/zinc/56/35/30/1056563530.db2.gz SOYWCTHIGDPNBK-BPUTZDHNSA-N 1 2 307.434 4.093 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CC[C@H](C)C[C@H]1c1ccc(C)o1 ZINC001615679220 1056563542 /nfs/dbraw/zinc/56/35/42/1056563542.db2.gz SOYWCTHIGDPNBK-BPUTZDHNSA-N 1 2 307.434 4.093 20 0 DIADLO Fc1cc(Br)ccc1CNc1cc2cc[nH]c2c[nH+]1 ZINC000672213643 1056569076 /nfs/dbraw/zinc/56/90/76/1056569076.db2.gz JYFSBUOWOCFYDT-UHFFFAOYSA-N 1 2 320.165 4.077 20 0 DIADLO CCc1ccc(N2CC[NH+](Cc3ccsc3Cl)CC2)cc1 ZINC001615740897 1056572357 /nfs/dbraw/zinc/57/23/57/1056572357.db2.gz XHBPTNWHLWKUSV-UHFFFAOYSA-N 1 2 320.889 4.286 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cccc(-c3cc[nH]n3)c2)cc1F ZINC001240564587 1056580877 /nfs/dbraw/zinc/58/08/77/1056580877.db2.gz HDAVANMHDYMRNH-UHFFFAOYSA-N 1 2 313.351 4.084 20 0 DIADLO c1cc2cc(NCc3cccc(-c4cccnc4)c3)[nH+]cc2[nH]1 ZINC000672251836 1056591694 /nfs/dbraw/zinc/59/16/94/1056591694.db2.gz NGHWHSCJKXMBRO-UHFFFAOYSA-N 1 2 300.365 4.237 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(N3CCCCC3)nc2)c1 ZINC001240584920 1056593120 /nfs/dbraw/zinc/59/31/20/1056593120.db2.gz RVWHHJBFYDPOHP-UHFFFAOYSA-N 1 2 309.413 4.101 20 0 DIADLO c1cc(-c2ccc(N3CCCC3)cc2)cc(N2CCCCC2)[nH+]1 ZINC001240590099 1056597469 /nfs/dbraw/zinc/59/74/69/1056597469.db2.gz MEJKZXOBLPATOV-UHFFFAOYSA-N 1 2 307.441 4.339 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[N@H+](C)Cc1cccc(F)c1 ZINC000007843295 1056597581 /nfs/dbraw/zinc/59/75/81/1056597581.db2.gz NOCYIKVXJRXRNG-UHFFFAOYSA-N 1 2 314.404 4.020 20 0 DIADLO CC(C)c1ccccc1NC(=O)C[N@@H+](C)Cc1cccc(F)c1 ZINC000007843295 1056597594 /nfs/dbraw/zinc/59/75/94/1056597594.db2.gz NOCYIKVXJRXRNG-UHFFFAOYSA-N 1 2 314.404 4.020 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(N3CCCC3)cc2)c1 ZINC001240591233 1056597961 /nfs/dbraw/zinc/59/79/61/1056597961.db2.gz MRTBARFEDWWBBP-UHFFFAOYSA-N 1 2 303.409 4.354 20 0 DIADLO Fc1ccc(-c2ccc(N3CCCC3)cc2)cc1-n1cc[nH+]c1 ZINC001240591936 1056598941 /nfs/dbraw/zinc/59/89/41/1056598941.db2.gz RGTSMOCUSAAYHM-UHFFFAOYSA-N 1 2 307.372 4.279 20 0 DIADLO c1cn(Cc2ccccc2-c2ccc(N3CCCC3)cc2)c[nH+]1 ZINC001240592000 1056599320 /nfs/dbraw/zinc/59/93/20/1056599320.db2.gz OVUDOZBUOYBRHJ-UHFFFAOYSA-N 1 2 303.409 4.199 20 0 DIADLO CC(C)(C)OC(=O)C1([NH2+]CCc2ccc(Cl)cc2)CCCC1 ZINC001615975407 1056601070 /nfs/dbraw/zinc/60/10/70/1056601070.db2.gz CUKQMDQIRSOUCB-UHFFFAOYSA-N 1 2 323.864 4.127 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccsc2)c(Cl)c1OC ZINC000678126270 1056601342 /nfs/dbraw/zinc/60/13/42/1056601342.db2.gz MXAWAALNMFSYFQ-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccsc2)c(Cl)c1OC ZINC000678126270 1056601350 /nfs/dbraw/zinc/60/13/50/1056601350.db2.gz MXAWAALNMFSYFQ-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1nsc2ccccc21 ZINC001616043487 1056608476 /nfs/dbraw/zinc/60/84/76/1056608476.db2.gz YFRDSYKDTAFQLB-CYBMUJFWSA-N 1 2 310.422 4.252 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1nsc2ccccc21 ZINC001616043487 1056608482 /nfs/dbraw/zinc/60/84/82/1056608482.db2.gz YFRDSYKDTAFQLB-CYBMUJFWSA-N 1 2 310.422 4.252 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)Nc1c(C)c[nH+]cc1C ZINC001616246111 1056624481 /nfs/dbraw/zinc/62/44/81/1056624481.db2.gz FGMQMKMTFLSPCK-CJNGLKHVSA-N 1 2 308.425 4.048 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C=C[C@]1(C)CC[C@@H](C)C1(C)C ZINC001616247029 1056624489 /nfs/dbraw/zinc/62/44/89/1056624489.db2.gz PNOHUDRGONLKGG-CILNZUJHSA-N 1 2 300.446 4.077 20 0 DIADLO Clc1cncc(Cl)c1C[NH+]1CCC(c2ccncc2)CC1 ZINC001137608459 1056644488 /nfs/dbraw/zinc/64/44/88/1056644488.db2.gz UIJGVERBBSPFBQ-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@H+]1Cc1ccc(Cl)cn1 ZINC001616402623 1056649937 /nfs/dbraw/zinc/64/99/37/1056649937.db2.gz MNIINLYSJDHFGT-NWDGAFQWSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@@H+]1Cc1ccc(Cl)cn1 ZINC001616402623 1056649940 /nfs/dbraw/zinc/64/99/40/1056649940.db2.gz MNIINLYSJDHFGT-NWDGAFQWSA-N 1 2 304.796 4.382 20 0 DIADLO Cc1nc(C[N@@H+]2[C@@H](C)Cc3cc(F)ccc3[C@@H]2C)c(C)s1 ZINC001616403545 1056652479 /nfs/dbraw/zinc/65/24/79/1056652479.db2.gz SLNWTGRVLKSHPG-QWRGUYRKSA-N 1 2 304.434 4.407 20 0 DIADLO Cc1nc(C[N@H+]2[C@@H](C)Cc3cc(F)ccc3[C@@H]2C)c(C)s1 ZINC001616403545 1056652485 /nfs/dbraw/zinc/65/24/85/1056652485.db2.gz SLNWTGRVLKSHPG-QWRGUYRKSA-N 1 2 304.434 4.407 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1csc(N(C)C)n1 ZINC000157056559 1056664825 /nfs/dbraw/zinc/66/48/25/1056664825.db2.gz MVHXJKCHEJTVKD-LBPRGKRZSA-N 1 2 315.442 4.115 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CC[C@H](Oc3ccccc3Cl)C2)c1 ZINC001616514117 1056667616 /nfs/dbraw/zinc/66/76/16/1056667616.db2.gz AYIBNSSHBGAQSQ-AWEZNQCLSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CC[C@H](Oc3ccccc3Cl)C2)c1 ZINC001616514117 1056667625 /nfs/dbraw/zinc/66/76/25/1056667625.db2.gz AYIBNSSHBGAQSQ-AWEZNQCLSA-N 1 2 323.770 4.272 20 0 DIADLO CCc1c(C)cc(-c2c[nH+]c(N3CCOCC3)c(C)c2)cc1C ZINC001240740877 1056671848 /nfs/dbraw/zinc/67/18/48/1056671848.db2.gz NBFBEMLBTMWACF-UHFFFAOYSA-N 1 2 310.441 4.073 20 0 DIADLO c1cc2c[nH+]c(-c3ccc(OCc4ccccc4)cc3)nc2[nH]1 ZINC001240748074 1056676635 /nfs/dbraw/zinc/67/66/35/1056676635.db2.gz YJHNOHMVJLNTMC-UHFFFAOYSA-N 1 2 301.349 4.156 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@H]2CCCc3ccc(F)cc32)n1 ZINC000921959457 1056681756 /nfs/dbraw/zinc/68/17/56/1056681756.db2.gz GSJURKYTSAHFOL-HNNXBMFYSA-N 1 2 302.393 4.278 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(C(F)F)cc1 ZINC001240771343 1056691834 /nfs/dbraw/zinc/69/18/34/1056691834.db2.gz UVXACJLPVNWQFN-UHFFFAOYSA-N 1 2 300.308 4.486 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cncc(C(F)(F)F)c1 ZINC001240791654 1056702225 /nfs/dbraw/zinc/70/22/25/1056702225.db2.gz AVXXKCMDTFHBAZ-UHFFFAOYSA-N 1 2 321.346 4.461 20 0 DIADLO c1nsnc1C[NH2+][C@H](CCc1ccccc1)c1ccccc1 ZINC001616699103 1056703172 /nfs/dbraw/zinc/70/31/72/1056703172.db2.gz HBXZFZJAJTUOME-GOSISDBHSA-N 1 2 309.438 4.002 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1noc2c1CCCC2 ZINC000672577371 1056727182 /nfs/dbraw/zinc/72/71/82/1056727182.db2.gz UXRMLWXCYLSZIA-KRWDZBQOSA-N 1 2 314.429 4.145 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1noc2c1CCCC2 ZINC000672577371 1056727195 /nfs/dbraw/zinc/72/71/95/1056727195.db2.gz UXRMLWXCYLSZIA-KRWDZBQOSA-N 1 2 314.429 4.145 20 0 DIADLO C[C@@H]([NH2+]Cc1nncs1)c1ccc(Oc2ccccc2)cc1 ZINC001616874339 1056730227 /nfs/dbraw/zinc/73/02/27/1056730227.db2.gz OHJYYJRBBVFALJ-CYBMUJFWSA-N 1 2 311.410 4.181 20 0 DIADLO C[C@H]([NH2+]Cc1nncs1)c1ccc(Oc2ccccc2)cc1 ZINC001616874340 1056730497 /nfs/dbraw/zinc/73/04/97/1056730497.db2.gz OHJYYJRBBVFALJ-ZDUSSCGKSA-N 1 2 311.410 4.181 20 0 DIADLO CC[C@]1(C)COCC[N@@H+]1Cc1ccc(OC(C)C)c(Cl)c1 ZINC001616888238 1056733938 /nfs/dbraw/zinc/73/39/38/1056733938.db2.gz VUTPGMYMDFIIFQ-QGZVFWFLSA-N 1 2 311.853 4.128 20 0 DIADLO CC[C@]1(C)COCC[N@H+]1Cc1ccc(OC(C)C)c(Cl)c1 ZINC001616888238 1056733948 /nfs/dbraw/zinc/73/39/48/1056733948.db2.gz VUTPGMYMDFIIFQ-QGZVFWFLSA-N 1 2 311.853 4.128 20 0 DIADLO Cc1cc(-c2ccc(Oc3cccnc3)cc2)c2[nH+]ccn2c1 ZINC001240880221 1056735845 /nfs/dbraw/zinc/73/58/45/1056735845.db2.gz DZNVVGQLIQJCFD-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO COc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCCC1(F)F)CCCS2 ZINC000672619991 1056738364 /nfs/dbraw/zinc/73/83/64/1056738364.db2.gz HHHWJYYGSGZYCR-DZGCQCFKSA-N 1 2 313.413 4.400 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCCC2(F)F)cc1OCC ZINC000672621747 1056739833 /nfs/dbraw/zinc/73/98/33/1056739833.db2.gz HYAHFVOPYISMAE-BLLLJJGKSA-N 1 2 313.388 4.322 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc4ccccc4c3)nn2)c1C ZINC001240909923 1056753350 /nfs/dbraw/zinc/75/33/50/1056753350.db2.gz QJNCHSSVJOSYAX-UHFFFAOYSA-N 1 2 300.365 4.099 20 0 DIADLO CCCOc1ccc(C[NH2+]Cc2nc(C(C)(C)C)co2)c(C)c1 ZINC000922045092 1056765418 /nfs/dbraw/zinc/76/54/18/1056765418.db2.gz WTUJOAYAAZTOGP-UHFFFAOYSA-N 1 2 316.445 4.359 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2cccc(C(=O)OC(C)C)c2)cc1 ZINC001240948322 1056777140 /nfs/dbraw/zinc/77/71/40/1056777140.db2.gz XHEJNNWHIWXSLZ-UHFFFAOYSA-N 1 2 311.381 4.281 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)c(C)[nH+]1 ZINC001128319217 1056780011 /nfs/dbraw/zinc/78/00/11/1056780011.db2.gz PDFQAEUXLBVJPC-IAGOWNOFSA-N 1 2 302.462 4.342 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2cccnc2Cl)s1 ZINC000172836286 1056808787 /nfs/dbraw/zinc/80/87/87/1056808787.db2.gz JFWFWDGBFULEGH-LLVKDONJSA-N 1 2 309.866 4.255 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cccnc2Cl)s1 ZINC000172836286 1056808792 /nfs/dbraw/zinc/80/87/92/1056808792.db2.gz JFWFWDGBFULEGH-LLVKDONJSA-N 1 2 309.866 4.255 20 0 DIADLO C[C@H]1COC(C)(C)C[N@H+]1CCc1c(Cl)cccc1Cl ZINC001617720814 1056873841 /nfs/dbraw/zinc/87/38/41/1056873841.db2.gz YHVYSVYPEJVSII-NSHDSACASA-N 1 2 302.245 4.035 20 0 DIADLO O=C(c1cccc2[nH+]ccn21)N1CCCCC12CCCCCC2 ZINC001617536954 1056845165 /nfs/dbraw/zinc/84/51/65/1056845165.db2.gz HMXGARHULMNGLK-UHFFFAOYSA-N 1 2 311.429 4.053 20 0 DIADLO Cc1ccc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c(O)c1 ZINC001241051781 1056846853 /nfs/dbraw/zinc/84/68/53/1056846853.db2.gz ZKHCEYYCEISQNC-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO Cc1ccc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c(O)c1 ZINC001241051781 1056846857 /nfs/dbraw/zinc/84/68/57/1056846857.db2.gz ZKHCEYYCEISQNC-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO CCCCc1ccc(-c2c[nH+]c(N3CCOCC3)cc2C)cc1 ZINC001241053288 1056848428 /nfs/dbraw/zinc/84/84/28/1056848428.db2.gz UAHFRJSIRZTROM-UHFFFAOYSA-N 1 2 310.441 4.236 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1CC(=O)Nc1cccc(Cl)c1Cl ZINC000009997667 1056857243 /nfs/dbraw/zinc/85/72/43/1056857243.db2.gz LQDBWJXCDNVYMI-QWRGUYRKSA-N 1 2 315.244 4.195 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1cc(F)cc(OCC(C)C)c1 ZINC001241076491 1056868828 /nfs/dbraw/zinc/86/88/28/1056868828.db2.gz OFHCLVUJRKMCNW-UHFFFAOYSA-N 1 2 314.360 4.412 20 0 DIADLO Fc1cc(-c2ccc(Cn3cc[nH+]c3)cn2)cc(C(F)(F)F)c1 ZINC001241080952 1056872423 /nfs/dbraw/zinc/87/24/23/1056872423.db2.gz ATFQPXPVSSRJCF-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO C[C@H]1COC(C)(C)C[N@@H+]1CCc1c(Cl)cccc1Cl ZINC001617720814 1056873835 /nfs/dbraw/zinc/87/38/35/1056873835.db2.gz YHVYSVYPEJVSII-NSHDSACASA-N 1 2 302.245 4.035 20 0 DIADLO Brc1ccoc1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001143128748 1056877458 /nfs/dbraw/zinc/87/74/58/1056877458.db2.gz SNLJFMKLBGZGTQ-UHFFFAOYSA-N 1 2 318.214 4.331 20 0 DIADLO Brc1ccoc1C[N@@H+]1CC=C(c2ccccc2)CC1 ZINC001143128748 1056877465 /nfs/dbraw/zinc/87/74/65/1056877465.db2.gz SNLJFMKLBGZGTQ-UHFFFAOYSA-N 1 2 318.214 4.331 20 0 DIADLO Fc1ccc([C@@H]([NH2+][C@H]2CCCc3[nH]ncc32)C2CC2)cc1Cl ZINC000453309398 1056880372 /nfs/dbraw/zinc/88/03/72/1056880372.db2.gz DURHFSFYGPPSIF-RDJZCZTQSA-N 1 2 319.811 4.321 20 0 DIADLO C[C@H](c1ccc(Oc2ccccc2)cc1)[N@@H+]1CCc2c[nH]nc2C1 ZINC000682074553 1056886930 /nfs/dbraw/zinc/88/69/30/1056886930.db2.gz VKORHKAVBXUZPF-OAHLLOKOSA-N 1 2 319.408 4.321 20 0 DIADLO C[C@H](c1ccc(Oc2ccccc2)cc1)[N@H+]1CCc2c[nH]nc2C1 ZINC000682074553 1056886934 /nfs/dbraw/zinc/88/69/34/1056886934.db2.gz VKORHKAVBXUZPF-OAHLLOKOSA-N 1 2 319.408 4.321 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1-c1cc(-n2cc[nH+]c2)ccn1 ZINC001241097979 1056890695 /nfs/dbraw/zinc/89/06/95/1056890695.db2.gz PAWKSRWNLWBIOF-UHFFFAOYSA-N 1 2 307.250 4.092 20 0 DIADLO C[C@H](CCCC(C)(C)O)[NH2+]c1cc2c3c(c1)CCCN3CCC2 ZINC001168704897 1056894226 /nfs/dbraw/zinc/89/42/26/1056894226.db2.gz JIQUGKRGEHFDML-OAHLLOKOSA-N 1 2 316.489 4.127 20 0 DIADLO C[C@H](CCCC(C)(C)O)Nc1cc2c3c(c1)CCC[NH+]3CCC2 ZINC001168704897 1056894233 /nfs/dbraw/zinc/89/42/33/1056894233.db2.gz JIQUGKRGEHFDML-OAHLLOKOSA-N 1 2 316.489 4.127 20 0 DIADLO Cc1cccc2c1CC(C)(C)[N@H+](Cc1cnc(Cl)s1)C2 ZINC001618092482 1056923598 /nfs/dbraw/zinc/92/35/98/1056923598.db2.gz UIWSUISAIFKWJW-UHFFFAOYSA-N 1 2 306.862 4.442 20 0 DIADLO Cc1cccc2c1CC(C)(C)[N@@H+](Cc1cnc(Cl)s1)C2 ZINC001618092482 1056923605 /nfs/dbraw/zinc/92/36/05/1056923605.db2.gz UIWSUISAIFKWJW-UHFFFAOYSA-N 1 2 306.862 4.442 20 0 DIADLO C[C@@H](c1cnn(C)c1)[N@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000347693452 1056926739 /nfs/dbraw/zinc/92/67/39/1056926739.db2.gz WMXXIUUACRTAOA-NSHDSACASA-N 1 2 303.793 4.013 20 0 DIADLO C[C@@H](c1cnn(C)c1)[N@@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000347693452 1056926748 /nfs/dbraw/zinc/92/67/48/1056926748.db2.gz WMXXIUUACRTAOA-NSHDSACASA-N 1 2 303.793 4.013 20 0 DIADLO C[C@H](c1cnn(C)c1)[N@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000347693451 1056926790 /nfs/dbraw/zinc/92/67/90/1056926790.db2.gz WMXXIUUACRTAOA-LLVKDONJSA-N 1 2 303.793 4.013 20 0 DIADLO C[C@H](c1cnn(C)c1)[N@@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000347693451 1056926797 /nfs/dbraw/zinc/92/67/97/1056926797.db2.gz WMXXIUUACRTAOA-LLVKDONJSA-N 1 2 303.793 4.013 20 0 DIADLO CCn1ccc(C[N@H+](C)Cc2coc(-c3ccc(C)cc3)n2)c1 ZINC000683000341 1056929798 /nfs/dbraw/zinc/92/97/98/1056929798.db2.gz VQMUOPNPULJVNV-UHFFFAOYSA-N 1 2 309.413 4.103 20 0 DIADLO CCn1ccc(C[N@@H+](C)Cc2coc(-c3ccc(C)cc3)n2)c1 ZINC000683000341 1056929807 /nfs/dbraw/zinc/92/98/07/1056929807.db2.gz VQMUOPNPULJVNV-UHFFFAOYSA-N 1 2 309.413 4.103 20 0 DIADLO COc1cc([C@@H](C)[NH2+]Cc2csc(C3CCCC3)n2)ccn1 ZINC000347693791 1056931799 /nfs/dbraw/zinc/93/17/99/1056931799.db2.gz ZKERAGRSQWMILU-GFCCVEGCSA-N 1 2 317.458 4.055 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(-c3ccc(F)cc3C)o2)cs1 ZINC000115612841 1056942645 /nfs/dbraw/zinc/94/26/45/1056942645.db2.gz QHBRMQJOLFFKOO-UHFFFAOYSA-N 1 2 316.401 4.449 20 0 DIADLO C[N@H+](Cc1nc(C(C)(C)C)no1)Cc1cccc2ccccc21 ZINC000079889841 1056954131 /nfs/dbraw/zinc/95/41/31/1056954131.db2.gz ZBSIFZKEEYAAKK-UHFFFAOYSA-N 1 2 309.413 4.152 20 0 DIADLO C[N@@H+](Cc1nc(C(C)(C)C)no1)Cc1cccc2ccccc21 ZINC000079889841 1056954137 /nfs/dbraw/zinc/95/41/37/1056954137.db2.gz ZBSIFZKEEYAAKK-UHFFFAOYSA-N 1 2 309.413 4.152 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)c(C)[nH+]1 ZINC000115984626 1056960191 /nfs/dbraw/zinc/96/01/91/1056960191.db2.gz DSRKKVCFVMKBFU-CHWSQXEVSA-N 1 2 316.351 4.027 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cccc(O[C@H]2CCCCO2)c1 ZINC001241215092 1056963926 /nfs/dbraw/zinc/96/39/26/1056963926.db2.gz YNLHGTPSBDXDAR-IBGZPJMESA-N 1 2 308.381 4.215 20 0 DIADLO COCc1nc(C[N@@H+]2CCCC[C@H]2c2ccccc2)cs1 ZINC000358020390 1056971273 /nfs/dbraw/zinc/97/12/73/1056971273.db2.gz NFTXGCWNMCIHBC-INIZCTEOSA-N 1 2 302.443 4.017 20 0 DIADLO COCc1nc(C[N@H+]2CCCC[C@H]2c2ccccc2)cs1 ZINC000358020390 1056971281 /nfs/dbraw/zinc/97/12/81/1056971281.db2.gz NFTXGCWNMCIHBC-INIZCTEOSA-N 1 2 302.443 4.017 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(C2(C(F)(F)F)CC2)cn1 ZINC001241240094 1056975339 /nfs/dbraw/zinc/97/53/39/1056975339.db2.gz JOJKTFXPDMJWON-UHFFFAOYSA-N 1 2 321.346 4.112 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cc(C2(C(F)(F)F)CC2)ccn1 ZINC001241240623 1056976464 /nfs/dbraw/zinc/97/64/64/1056976464.db2.gz PYUURKAWGSPSHI-UHFFFAOYSA-N 1 2 321.346 4.112 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(SC(F)(F)F)cn1 ZINC001241241192 1056976587 /nfs/dbraw/zinc/97/65/87/1056976587.db2.gz ZFOWWKPYDVTXTQ-UHFFFAOYSA-N 1 2 313.348 4.130 20 0 DIADLO Cc1ccc2c(F)c(F)cc(-c3c[nH+]c(N(C)C)cc3C)c2n1 ZINC001241242444 1056976811 /nfs/dbraw/zinc/97/68/11/1056976811.db2.gz BQJBUYUYIJCHBI-UHFFFAOYSA-N 1 2 313.351 4.258 20 0 DIADLO COc1ccc(-c2cccnc2)cc1-c1c[nH+]c(N(C)C)cc1C ZINC001241243267 1056977882 /nfs/dbraw/zinc/97/78/82/1056977882.db2.gz PNVOCPHPIXASRL-UHFFFAOYSA-N 1 2 319.408 4.194 20 0 DIADLO COc1ncc(-c2ccccc2)cc1-c1c[nH+]c(N(C)C)cc1C ZINC001241252621 1056981673 /nfs/dbraw/zinc/98/16/73/1056981673.db2.gz USLMNWGSEYILGR-UHFFFAOYSA-N 1 2 319.408 4.194 20 0 DIADLO CCOc1cccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)c1F ZINC001241266545 1056987570 /nfs/dbraw/zinc/98/75/70/1056987570.db2.gz IBHCDDDIIRSBAS-UHFFFAOYSA-N 1 2 309.331 4.231 20 0 DIADLO Cc1nn(C)c(C[NH2+]Cc2c(Cl)oc3ccccc32)c1Cl ZINC000922284488 1056997964 /nfs/dbraw/zinc/99/79/64/1056997964.db2.gz PYFFOBIVCYPWLD-UHFFFAOYSA-N 1 2 324.211 4.071 20 0 DIADLO CCOc1ccc(F)c(F)c1-c1ccccc1Cn1cc[nH+]c1 ZINC001241310131 1057008109 /nfs/dbraw/zinc/00/81/09/1057008109.db2.gz RRLLSKNCTVYJEH-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+]Cc2cc(C3CC3)no2)c1Cl ZINC000922338698 1057012140 /nfs/dbraw/zinc/01/21/40/1057012140.db2.gz QBAMERZQMFVRFK-UHFFFAOYSA-N 1 2 311.212 4.457 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000118002265 1057012810 /nfs/dbraw/zinc/01/28/10/1057012810.db2.gz IDGKEVLTKKOLFE-AWEZNQCLSA-N 1 2 311.385 4.221 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000118002265 1057012811 /nfs/dbraw/zinc/01/28/11/1057012811.db2.gz IDGKEVLTKKOLFE-AWEZNQCLSA-N 1 2 311.385 4.221 20 0 DIADLO Cc1cc(-c2ccc(CC(C)C)cc2)c[nH+]c1N1CCOCC1 ZINC001241325886 1057014083 /nfs/dbraw/zinc/01/40/83/1057014083.db2.gz KJSNGJPWQWLGIK-UHFFFAOYSA-N 1 2 310.441 4.092 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccccc2[S@@](C)=O)c1 ZINC001241344505 1057020992 /nfs/dbraw/zinc/02/09/92/1057020992.db2.gz VJPLGUVHTGNWQD-OAQYLSRUSA-N 1 2 301.455 4.246 20 0 DIADLO c1ccc(N2CC=C(c3cc[nH+]c(N4CCCCC4)c3)CC2)cc1 ZINC001241352063 1057023908 /nfs/dbraw/zinc/02/39/08/1057023908.db2.gz LCIUJKJJGBWOFC-UHFFFAOYSA-N 1 2 319.452 4.366 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(C2=CCN(c3ccccc3)CC2)cc1 ZINC001241355904 1057025823 /nfs/dbraw/zinc/02/58/23/1057025823.db2.gz UDVLPSDZLFKMKQ-UHFFFAOYSA-N 1 2 315.420 4.381 20 0 DIADLO c1cn(Cc2ccc(C3=CCN(c4ccccc4)CC3)cc2)c[nH+]1 ZINC001241355090 1057025841 /nfs/dbraw/zinc/02/58/41/1057025841.db2.gz NJPLWZSBLKSFPZ-UHFFFAOYSA-N 1 2 315.420 4.225 20 0 DIADLO CC[C@@H]([NH2+]Cc1csc(C2CC2)n1)c1cc(F)ccc1OC ZINC000922621493 1057040638 /nfs/dbraw/zinc/04/06/38/1057040638.db2.gz LURDDTXAGXLQKY-OAHLLOKOSA-N 1 2 320.433 4.409 20 0 DIADLO Cc1[nH+]cc(CNc2cnn(C3CCCC3)c2)n1-c1ccccc1 ZINC000922625615 1057041446 /nfs/dbraw/zinc/04/14/46/1057041446.db2.gz WDPCXFSJMPHPMK-UHFFFAOYSA-N 1 2 321.428 4.104 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(CO)o1)c1cc(Cl)cc(Cl)c1F ZINC000922669424 1057047435 /nfs/dbraw/zinc/04/74/35/1057047435.db2.gz JSVHGTHAKNVVQS-MRVPVSSYSA-N 1 2 318.175 4.069 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)cc1C ZINC000922673810 1057047990 /nfs/dbraw/zinc/04/79/90/1057047990.db2.gz CDDFCPSOJZOUTQ-ZDUSSCGKSA-N 1 2 302.418 4.140 20 0 DIADLO FC(F)n1ccc(C[N@H+](Cc2ccc(Cl)cc2)C2CC2)n1 ZINC000347729275 1057051592 /nfs/dbraw/zinc/05/15/92/1057051592.db2.gz WPWIHZZYBCDJRF-UHFFFAOYSA-N 1 2 311.763 4.096 20 0 DIADLO FC(F)n1ccc(C[N@@H+](Cc2ccc(Cl)cc2)C2CC2)n1 ZINC000347729275 1057051593 /nfs/dbraw/zinc/05/15/93/1057051593.db2.gz WPWIHZZYBCDJRF-UHFFFAOYSA-N 1 2 311.763 4.096 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+][C@H]2CCCc3cccnc32)s1 ZINC000922883761 1057075070 /nfs/dbraw/zinc/07/50/70/1057075070.db2.gz LNSQHAHAMZPAKF-ZDUSSCGKSA-N 1 2 301.459 4.003 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2ccc(SC(C)C)cc2)cc1 ZINC001241613717 1057110234 /nfs/dbraw/zinc/11/02/34/1057110234.db2.gz XPJCPBMACLXFKJ-QGZVFWFLSA-N 1 2 315.438 4.027 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1nc2cc(C)ccc2s1 ZINC000625303479 1057123696 /nfs/dbraw/zinc/12/36/96/1057123696.db2.gz RKLPZVBLZKFHLA-SNVBAGLBSA-N 1 2 301.415 4.060 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2cc(O)ccc2Cl)C2CC2)s1 ZINC000625321170 1057124956 /nfs/dbraw/zinc/12/49/56/1057124956.db2.gz ZSYOROLVLDAIMZ-AWEZNQCLSA-N 1 2 308.834 4.051 20 0 DIADLO CCc1ccc(C[N@H+](Cc2ccco2)Cc2ccc(O)cc2)cn1 ZINC000347809503 1057131425 /nfs/dbraw/zinc/13/14/25/1057131425.db2.gz IWNVAPNSMGLIES-UHFFFAOYSA-N 1 2 322.408 4.145 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2ccco2)Cc2ccc(O)cc2)cn1 ZINC000347809503 1057131427 /nfs/dbraw/zinc/13/14/27/1057131427.db2.gz IWNVAPNSMGLIES-UHFFFAOYSA-N 1 2 322.408 4.145 20 0 DIADLO COc1cc(-c2ccc(-n3cc[nH+]c3)cc2OC)ccc1Cl ZINC001241737701 1057152554 /nfs/dbraw/zinc/15/25/54/1057152554.db2.gz AWOJDTUMBKGAPL-UHFFFAOYSA-N 1 2 314.772 4.210 20 0 DIADLO Cc1nc2ccccc2nc1C[N@@H+]1CCc2cc(Cl)ccc2C1 ZINC000483996689 1057153690 /nfs/dbraw/zinc/15/36/90/1057153690.db2.gz VUKJUBSAPNJSAU-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1nc2ccccc2nc1C[N@H+]1CCc2cc(Cl)ccc2C1 ZINC000483996689 1057153691 /nfs/dbraw/zinc/15/36/91/1057153691.db2.gz VUKJUBSAPNJSAU-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO CCCOc1ccc(-c2ccc(-n3cc[nH+]c3)cc2OC)cc1 ZINC001241750651 1057156024 /nfs/dbraw/zinc/15/60/24/1057156024.db2.gz PSVKBFPNXNAVPR-UHFFFAOYSA-N 1 2 308.381 4.337 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cnn(-c2ccccc2)c1 ZINC001241752862 1057156935 /nfs/dbraw/zinc/15/69/35/1057156935.db2.gz PLOOQXCODZTNKK-UHFFFAOYSA-N 1 2 318.424 4.233 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1cc2cnccc2o1 ZINC000657967203 1057165639 /nfs/dbraw/zinc/16/56/39/1057165639.db2.gz MJQOOBHJNLXNQI-AWEZNQCLSA-N 1 2 322.412 4.386 20 0 DIADLO COc1cc(C(F)(F)F)ccc1-c1cccc2[nH+]c(C)cn21 ZINC001241805517 1057171154 /nfs/dbraw/zinc/17/11/54/1057171154.db2.gz YFRONJOBWNTTTN-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Cn1ccc2c1cccc2-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001241823783 1057176821 /nfs/dbraw/zinc/17/68/21/1057176821.db2.gz VWFRYUKFEYMRON-UHFFFAOYSA-N 1 2 300.352 4.185 20 0 DIADLO Cc1c(-c2cccnc2OCc2ccccc2)ccc2[nH+]ccn21 ZINC001241832202 1057181349 /nfs/dbraw/zinc/18/13/49/1057181349.db2.gz NPQBZXIDVMWHDE-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO C[C@H]1C[NH+](Cc2csc(C(C)(C)C)n2)C[C@H](C)C1(F)F ZINC000625644245 1057182606 /nfs/dbraw/zinc/18/26/06/1057182606.db2.gz ADNWJXAGGFGYOV-QWRGUYRKSA-N 1 2 302.434 4.164 20 0 DIADLO CC(C)([NH2+]Cc1cc(C2CC2)no1)c1nc2ccccc2s1 ZINC000625720290 1057194527 /nfs/dbraw/zinc/19/45/27/1057194527.db2.gz QDSJLCVNIACJDJ-UHFFFAOYSA-N 1 2 313.426 4.187 20 0 DIADLO FC(F)C1([NH2+]Cc2ccc(OCC(F)(F)F)cc2)CCCC1 ZINC000674135582 1057211679 /nfs/dbraw/zinc/21/16/79/1057211679.db2.gz VCNBMLLCEIQSMI-UHFFFAOYSA-N 1 2 323.305 4.295 20 0 DIADLO CCOC(=O)c1cc2cc(-c3cc(C)[nH+]c(C)c3)ccc2nc1C ZINC001241994692 1057233304 /nfs/dbraw/zinc/23/33/04/1057233304.db2.gz BRVWAQPGQMHAGH-UHFFFAOYSA-N 1 2 320.392 4.399 20 0 DIADLO Cc1cc(-c2ccnc(OCc3ccccc3F)c2)cc(C)[nH+]1 ZINC001241995816 1057233509 /nfs/dbraw/zinc/23/35/09/1057233509.db2.gz SAEDHRCSKQUJGC-UHFFFAOYSA-N 1 2 308.356 4.479 20 0 DIADLO COc1cccc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3OC)cc21 ZINC001242001946 1057237103 /nfs/dbraw/zinc/23/71/03/1057237103.db2.gz KJTKDFOCZISCFM-UHFFFAOYSA-N 1 2 319.364 4.038 20 0 DIADLO c1ccc(C([NH2+]Cc2noc3c2CCCC3)c2ccccc2)cc1 ZINC000171728458 1057238609 /nfs/dbraw/zinc/23/86/09/1057238609.db2.gz XFODPCHWAOOVJW-UHFFFAOYSA-N 1 2 318.420 4.433 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1nccc2cc(-c3ccc(F)cc3)[nH]c21 ZINC001242078926 1057256210 /nfs/dbraw/zinc/25/62/10/1057256210.db2.gz UAFDDPWORMHWNN-UHFFFAOYSA-N 1 2 318.355 4.322 20 0 DIADLO Cc1cc(-c2ccc(OC(C)C)cc2C(F)(F)F)c[nH+]c1N ZINC001242102773 1057264073 /nfs/dbraw/zinc/26/40/73/1057264073.db2.gz DTHQVDHKTODATF-UHFFFAOYSA-N 1 2 310.319 4.445 20 0 DIADLO Clc1cccc(-c2ncnc3c2C[N@H+](Cc2ccccc2)C3)c1 ZINC001242143453 1057278510 /nfs/dbraw/zinc/27/85/10/1057278510.db2.gz MFTKRKSDJSKGGC-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1cccc(-c2ncnc3c2C[N@@H+](Cc2ccccc2)C3)c1 ZINC001242143453 1057278511 /nfs/dbraw/zinc/27/85/11/1057278511.db2.gz MFTKRKSDJSKGGC-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+]1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000245402899 1057286837 /nfs/dbraw/zinc/28/68/37/1057286837.db2.gz JVJNJZKWMHFYSN-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+]1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000245402899 1057286844 /nfs/dbraw/zinc/28/68/44/1057286844.db2.gz JVJNJZKWMHFYSN-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO CCOC(=O)Cc1ccc(Nc2ccc3c(C)cc[nH+]c3c2)cc1 ZINC001212521728 1057287165 /nfs/dbraw/zinc/28/71/65/1057287165.db2.gz VZTATDVPXDRHOX-UHFFFAOYSA-N 1 2 320.392 4.392 20 0 DIADLO C(CC1CCCC1)C[N@@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000674860632 1057292185 /nfs/dbraw/zinc/29/21/85/1057292185.db2.gz CWTHNLZNHVNVQN-MRXNPFEDSA-N 1 2 303.450 4.444 20 0 DIADLO C(CC1CCCC1)C[N@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000674860632 1057292191 /nfs/dbraw/zinc/29/21/91/1057292191.db2.gz CWTHNLZNHVNVQN-MRXNPFEDSA-N 1 2 303.450 4.444 20 0 DIADLO Cc1cn2cc(-c3cccnc3OC3CCCCC3)ccc2[nH+]1 ZINC001242227968 1057302873 /nfs/dbraw/zinc/30/28/73/1057302873.db2.gz LQRYXCZXSDHOEQ-UHFFFAOYSA-N 1 2 307.397 4.416 20 0 DIADLO Clc1ccc([C@@H]2CC[N@@H+]2Cc2cccc3nsnc32)cc1 ZINC000766085969 1057307142 /nfs/dbraw/zinc/30/71/42/1057307142.db2.gz XCRQYRJWTPGICI-HNNXBMFYSA-N 1 2 315.829 4.292 20 0 DIADLO Clc1ccc([C@@H]2CC[N@H+]2Cc2cccc3nsnc32)cc1 ZINC000766085969 1057307145 /nfs/dbraw/zinc/30/71/45/1057307145.db2.gz XCRQYRJWTPGICI-HNNXBMFYSA-N 1 2 315.829 4.292 20 0 DIADLO COc1ccnc(C[NH2+][C@H](C)c2oc3ccccc3c2C)c1F ZINC000658228248 1057328880 /nfs/dbraw/zinc/32/88/80/1057328880.db2.gz PVTDGBGHLMIIHL-GFCCVEGCSA-N 1 2 314.360 4.135 20 0 DIADLO Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1ccc(Cl)c(Cl)c1 ZINC000675249776 1057333060 /nfs/dbraw/zinc/33/30/60/1057333060.db2.gz BRNHBXHJGTXYHG-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1ccc(Cl)c(Cl)c1 ZINC000675249776 1057333064 /nfs/dbraw/zinc/33/30/64/1057333064.db2.gz BRNHBXHJGTXYHG-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1cncc2ccccc21 ZINC000766110079 1057346687 /nfs/dbraw/zinc/34/66/87/1057346687.db2.gz RBKJPPBUEONMNX-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO Cc1cc(-c2ccc(-c3ccc(-n4cc[nH+]c4)cc3)nn2)c(C)o1 ZINC001242405791 1057360138 /nfs/dbraw/zinc/36/01/38/1057360138.db2.gz XIBWUIGDIUEJRZ-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO CCc1ccc(-c2noc([C@@H](C)[NH2+][C@H](C)c3ccncc3)n2)cc1 ZINC000675446457 1057370425 /nfs/dbraw/zinc/37/04/25/1057370425.db2.gz WQCYOOQBTWQSBT-ZIAGYGMSSA-N 1 2 322.412 4.106 20 0 DIADLO c1cn2c(cccc2-c2ccc3c(cnn3[C@H]3CCCCO3)c2)[nH+]1 ZINC001242447023 1057370529 /nfs/dbraw/zinc/37/05/29/1057370529.db2.gz NHULVDQHOQMMKS-LJQANCHMSA-N 1 2 318.380 4.050 20 0 DIADLO CCc1ccc(-c2noc([C@H](C)[NH2+][C@H](C)c3ccncc3)n2)cc1 ZINC000675446455 1057371025 /nfs/dbraw/zinc/37/10/25/1057371025.db2.gz WQCYOOQBTWQSBT-KGLIPLIRSA-N 1 2 322.412 4.106 20 0 DIADLO Cn1ccc2c[nH+]c(/C=C/c3ccccc3C(F)(F)F)nc21 ZINC001242491245 1057381958 /nfs/dbraw/zinc/38/19/58/1057381958.db2.gz LXKBVDXYVWFOHD-VOTSOKGWSA-N 1 2 303.287 4.158 20 0 DIADLO Cn1ccnc1-c1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc1 ZINC001242497943 1057385839 /nfs/dbraw/zinc/38/58/39/1057385839.db2.gz ZQWRDUQVACOPRD-UHFFFAOYSA-N 1 2 318.355 4.079 20 0 DIADLO CC(C)CN(C(=O)CCCn1cc[nH+]c1)c1ccc(Cl)cc1 ZINC000675579374 1057388118 /nfs/dbraw/zinc/38/81/18/1057388118.db2.gz SWHWXHTVGQGZMO-UHFFFAOYSA-N 1 2 319.836 4.006 20 0 DIADLO COc1cc2ccccc2c(-c2ccc(Cn3cc[nH+]c3)cn2)c1 ZINC001242605072 1057420788 /nfs/dbraw/zinc/42/07/88/1057420788.db2.gz BBWODHRMMOZWKY-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(C)c(C(F)(F)F)c1 ZINC001242671358 1057441708 /nfs/dbraw/zinc/44/17/08/1057441708.db2.gz CTRARDSVCWDCTK-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc2cc(F)ccc2o1 ZINC001242706535 1057453507 /nfs/dbraw/zinc/45/35/07/1057453507.db2.gz LHYIFJRKPNOAEQ-UHFFFAOYSA-N 1 2 308.312 4.433 20 0 DIADLO C[N@H+](Cc1nnc2ccccn21)Cc1ccc(C2CCCC2)cc1 ZINC000676226839 1057457144 /nfs/dbraw/zinc/45/71/44/1057457144.db2.gz CLNPSWCYTGRDEL-UHFFFAOYSA-N 1 2 320.440 4.019 20 0 DIADLO C[N@@H+](Cc1nnc2ccccn21)Cc1ccc(C2CCCC2)cc1 ZINC000676226839 1057457158 /nfs/dbraw/zinc/45/71/58/1057457158.db2.gz CLNPSWCYTGRDEL-UHFFFAOYSA-N 1 2 320.440 4.019 20 0 DIADLO Cc1cc(C)cc(CCC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000676362730 1057467818 /nfs/dbraw/zinc/46/78/18/1057467818.db2.gz KXCHKIXQRZOGRG-UHFFFAOYSA-N 1 2 319.408 4.060 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1cccc2ccccc21 ZINC000676477817 1057473897 /nfs/dbraw/zinc/47/38/97/1057473897.db2.gz CLJWPNIZQMSUFG-OAHLLOKOSA-N 1 2 322.408 4.282 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1cccc2ccccc21 ZINC000676477817 1057473902 /nfs/dbraw/zinc/47/39/02/1057473902.db2.gz CLJWPNIZQMSUFG-OAHLLOKOSA-N 1 2 322.408 4.282 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1ccc(Cl)cc1C ZINC000676479864 1057477530 /nfs/dbraw/zinc/47/75/30/1057477530.db2.gz RNZKBFNVFAKUAB-ZDUSSCGKSA-N 1 2 320.820 4.091 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1ccc(Cl)cc1C ZINC000676479864 1057477531 /nfs/dbraw/zinc/47/75/31/1057477531.db2.gz RNZKBFNVFAKUAB-ZDUSSCGKSA-N 1 2 320.820 4.091 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+][C@H](C)c1nc(C)sc1C ZINC000676489531 1057479633 /nfs/dbraw/zinc/47/96/33/1057479633.db2.gz JYNDZBAWWHLACI-SECBINFHSA-N 1 2 310.850 4.273 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cccc(O)c1Cl ZINC001242800937 1057481916 /nfs/dbraw/zinc/48/19/16/1057481916.db2.gz VDFASSBTGYVIRC-UHFFFAOYSA-N 1 2 302.805 4.406 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cccc(OC3CC3)c2)cc1F ZINC001242806053 1057484901 /nfs/dbraw/zinc/48/49/01/1057484901.db2.gz URPDZXOUBJRUDU-UHFFFAOYSA-N 1 2 303.352 4.235 20 0 DIADLO COc1c(F)cc(F)cc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001242808583 1057486432 /nfs/dbraw/zinc/48/64/32/1057486432.db2.gz HVFYYJJOYYHENU-UHFFFAOYSA-N 1 2 318.367 4.334 20 0 DIADLO Oc1c(Cl)cc(-c2ccc([C@H]3CC[NH2+]C3)cc2)cc1Cl ZINC001242852937 1057499579 /nfs/dbraw/zinc/49/95/79/1057499579.db2.gz HBSHFKVKNZRICF-LBPRGKRZSA-N 1 2 308.208 4.443 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl)c1cn(C)cn1 ZINC000710178940 1057502591 /nfs/dbraw/zinc/50/25/91/1057502591.db2.gz UNAINHIMBBNQOZ-RKDXNWHRSA-N 1 2 316.207 4.278 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)C)no2)cc1 ZINC000073637372 1057508316 /nfs/dbraw/zinc/50/83/16/1057508316.db2.gz MUIHZCAPQBNVJX-CHWSQXEVSA-N 1 2 303.406 4.004 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C(C)C)no2)cc1 ZINC000073637373 1057509088 /nfs/dbraw/zinc/50/90/88/1057509088.db2.gz MUIHZCAPQBNVJX-QWHCGFSZSA-N 1 2 303.406 4.004 20 0 DIADLO FC1(F)CCC[N@H+](Cc2csc(C3CCCC3)n2)CC1 ZINC000625768001 1057513368 /nfs/dbraw/zinc/51/33/68/1057513368.db2.gz DOKCCRQHOULECF-UHFFFAOYSA-N 1 2 300.418 4.422 20 0 DIADLO FC1(F)CCC[N@@H+](Cc2csc(C3CCCC3)n2)CC1 ZINC000625768001 1057513373 /nfs/dbraw/zinc/51/33/73/1057513373.db2.gz DOKCCRQHOULECF-UHFFFAOYSA-N 1 2 300.418 4.422 20 0 DIADLO Cc1[nH]c2c(cc(C)cc2CNc2cc(C)[nH+]c(C3CC3)n2)c1C ZINC000341500597 1057521006 /nfs/dbraw/zinc/52/10/06/1057521006.db2.gz MLIFXGZVEBQMGG-UHFFFAOYSA-N 1 2 320.440 4.681 20 0 DIADLO Fc1cc(F)c(F)c(C[NH2+]Cc2cc(Cl)cs2)c1F ZINC000785480762 1057523291 /nfs/dbraw/zinc/52/32/91/1057523291.db2.gz BWKPKNRHPADVQB-UHFFFAOYSA-N 1 2 309.715 4.248 20 0 DIADLO Cc1ccc2ccccc2c1-c1c[nH+]c(N2CCOCC2)c(C)c1 ZINC001242982130 1057534973 /nfs/dbraw/zinc/53/49/73/1057534973.db2.gz ZIENKODNYMYEGQ-UHFFFAOYSA-N 1 2 318.420 4.355 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000625947388 1057540798 /nfs/dbraw/zinc/54/07/98/1057540798.db2.gz JLUWSGPLPHMLBX-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000625947388 1057540807 /nfs/dbraw/zinc/54/08/07/1057540807.db2.gz JLUWSGPLPHMLBX-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO Nc1ccc(C(F)(F)F)cc1-c1ccccc1Cn1cc[nH+]c1 ZINC001243005044 1057544116 /nfs/dbraw/zinc/54/41/16/1057544116.db2.gz FOVWTQDGHBIVBK-UHFFFAOYSA-N 1 2 317.314 4.199 20 0 DIADLO Nc1ccc(C(F)(F)F)cc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001243006249 1057545360 /nfs/dbraw/zinc/54/53/60/1057545360.db2.gz GWBGPSKBPVZZGM-UHFFFAOYSA-N 1 2 303.287 4.140 20 0 DIADLO C[C@@H]([NH2+]Cc1nccn1C1CC1)c1ccc(Cl)cc1Cl ZINC000711755257 1057547359 /nfs/dbraw/zinc/54/73/59/1057547359.db2.gz IKERGVVAGJBYFB-SNVBAGLBSA-N 1 2 310.228 4.376 20 0 DIADLO c1coc([C@H]([NH2+]Cc2scnc2C2CC2)c2ccccc2)c1 ZINC000486985689 1057571070 /nfs/dbraw/zinc/57/10/70/1057571070.db2.gz HVOGTMIVMMGLGK-QGZVFWFLSA-N 1 2 310.422 4.493 20 0 DIADLO CCCOc1ccccc1-c1ccc(-n2cc[nH+]c2)cc1OC ZINC001243128543 1057581947 /nfs/dbraw/zinc/58/19/47/1057581947.db2.gz QZBQVVDKPSTHAC-UHFFFAOYSA-N 1 2 308.381 4.337 20 0 DIADLO COCOc1ccccc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001243183521 1057595895 /nfs/dbraw/zinc/59/58/95/1057595895.db2.gz PWQVMYGNDBANPD-UHFFFAOYSA-N 1 2 312.413 4.030 20 0 DIADLO COc1c(F)cc(-c2c[nH+]c(N3CCCCC3)cc2C)cc1F ZINC001243224707 1057611915 /nfs/dbraw/zinc/61/19/15/1057611915.db2.gz SMFOEKOMNKYQRD-UHFFFAOYSA-N 1 2 318.367 4.334 20 0 DIADLO COc1c(F)cc(-c2cc[nH+]c(N3CCCCC3)c2)cc1F ZINC001243224125 1057612244 /nfs/dbraw/zinc/61/22/44/1057612244.db2.gz OIAPBZURQIWXHM-UHFFFAOYSA-N 1 2 304.340 4.026 20 0 DIADLO CC(C)c1ccc(CNc2cc(CSCCO)cc[nH+]2)cc1 ZINC000095448819 1057617038 /nfs/dbraw/zinc/61/70/38/1057617038.db2.gz AHDUWJGBDNEFQK-UHFFFAOYSA-N 1 2 316.470 4.043 20 0 DIADLO COc1ccc([C@@H]([NH2+][C@@H](C)c2ncc[nH]2)c2ccc(C)cc2)cc1 ZINC000513713733 1057623742 /nfs/dbraw/zinc/62/37/42/1057623742.db2.gz SJHXBWLENBOKBP-KXBFYZLASA-N 1 2 321.424 4.167 20 0 DIADLO c1ccc([C@H]2CCCC[N@H+]2Cc2nnc(C3CC3)n2C2CC2)cc1 ZINC000273811771 1057624534 /nfs/dbraw/zinc/62/45/34/1057624534.db2.gz DFCUSNQWSRKXDP-GOSISDBHSA-N 1 2 322.456 4.218 20 0 DIADLO c1ccc([C@H]2CCCC[N@@H+]2Cc2nnc(C3CC3)n2C2CC2)cc1 ZINC000273811771 1057624538 /nfs/dbraw/zinc/62/45/38/1057624538.db2.gz DFCUSNQWSRKXDP-GOSISDBHSA-N 1 2 322.456 4.218 20 0 DIADLO Cc1cc(-c2ccc(F)c(C(=O)N3CCCCC3)c2)cc(C)[nH+]1 ZINC001243296011 1057637916 /nfs/dbraw/zinc/63/79/16/1057637916.db2.gz GJFQJSSIPWFRLE-UHFFFAOYSA-N 1 2 312.388 4.131 20 0 DIADLO Cc1cc[nH+]c(C)c1-c1ccc(F)c(C(=O)N2CCCCC2)c1 ZINC001243297434 1057639001 /nfs/dbraw/zinc/63/90/01/1057639001.db2.gz WDSXQPKYTFNWHL-UHFFFAOYSA-N 1 2 312.388 4.131 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(C)c(F)c2)cs1 ZINC000165229890 1057639550 /nfs/dbraw/zinc/63/95/50/1057639550.db2.gz JPQOCXDTCYDURW-NWDGAFQWSA-N 1 2 308.422 4.149 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000727222086 1057642408 /nfs/dbraw/zinc/64/24/08/1057642408.db2.gz PHHQXOMEBWINFC-OAHLLOKOSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000727222086 1057642409 /nfs/dbraw/zinc/64/24/09/1057642409.db2.gz PHHQXOMEBWINFC-OAHLLOKOSA-N 1 2 324.255 4.372 20 0 DIADLO Clc1cc2n[nH]cc2c(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243314266 1057643256 /nfs/dbraw/zinc/64/32/56/1057643256.db2.gz ASOVUICYLRWRFX-UHFFFAOYSA-N 1 2 308.772 4.128 20 0 DIADLO Cc1cccc(-c2nnc([C@H](C)[N@H+](C)Cc3ccsc3)o2)c1 ZINC000727269235 1057645281 /nfs/dbraw/zinc/64/52/81/1057645281.db2.gz LXVVMPWEUOUTTD-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1cccc(-c2nnc([C@H](C)[N@@H+](C)Cc3ccsc3)o2)c1 ZINC000727269235 1057645283 /nfs/dbraw/zinc/64/52/83/1057645283.db2.gz LXVVMPWEUOUTTD-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(-c2nn(C[N@@H+](C)C3CCCC3)c(=S)o2)c(C)c1 ZINC000727419382 1057654037 /nfs/dbraw/zinc/65/40/37/1057654037.db2.gz YPJFWVWRVILRGJ-UHFFFAOYSA-N 1 2 317.458 4.321 20 0 DIADLO Cc1ccc(-c2nn(C[N@H+](C)C3CCCC3)c(=S)o2)c(C)c1 ZINC000727419382 1057654039 /nfs/dbraw/zinc/65/40/39/1057654039.db2.gz YPJFWVWRVILRGJ-UHFFFAOYSA-N 1 2 317.458 4.321 20 0 DIADLO Fc1ccc(-c2cccc(OC(F)F)c2)cc1-n1cc[nH+]c1 ZINC001243358903 1057658243 /nfs/dbraw/zinc/65/82/43/1057658243.db2.gz CLHGEKHMZLXXQS-UHFFFAOYSA-N 1 2 304.271 4.280 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cc(Cl)nc(Cl)c2)cc1F ZINC001243371406 1057662579 /nfs/dbraw/zinc/66/25/79/1057662579.db2.gz HUMBRIRCPMUXNW-UHFFFAOYSA-N 1 2 317.166 4.395 20 0 DIADLO Fc1ccc(-c2cc(Cl)nc(Cl)c2)cc1-n1cc[nH+]c1 ZINC001243370885 1057662971 /nfs/dbraw/zinc/66/29/71/1057662971.db2.gz AXPRWRYZHLPAIM-UHFFFAOYSA-N 1 2 308.143 4.380 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cccc(OCC(F)(F)F)c1 ZINC001243389378 1057667343 /nfs/dbraw/zinc/66/73/43/1057667343.db2.gz CKIIUNXVAXAQPS-UHFFFAOYSA-N 1 2 306.287 4.251 20 0 DIADLO C[N@H+]1Cc2ccccc2[C@H](NCc2cccc(Cl)c2Cl)C1 ZINC000536054021 1057674257 /nfs/dbraw/zinc/67/42/57/1057674257.db2.gz RQDHFWJVHPHTCW-MRXNPFEDSA-N 1 2 321.251 4.270 20 0 DIADLO C[N@@H+]1Cc2ccccc2[C@H](NCc2cccc(Cl)c2Cl)C1 ZINC000536054021 1057674263 /nfs/dbraw/zinc/67/42/63/1057674263.db2.gz RQDHFWJVHPHTCW-MRXNPFEDSA-N 1 2 321.251 4.270 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cc(F)c(F)cc1OC(C)C ZINC001243412584 1057675193 /nfs/dbraw/zinc/67/51/93/1057675193.db2.gz IUJNTPNAIBGXQY-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Fc1ccc(-c2ccnc(Cl)c2Cl)cc1-n1cc[nH+]c1 ZINC001243417898 1057677219 /nfs/dbraw/zinc/67/72/19/1057677219.db2.gz JIUHTWLPZPPBLP-UHFFFAOYSA-N 1 2 308.143 4.380 20 0 DIADLO CC[C@@H]1CCC[N@@H+]1Cn1nc(-c2ccccc2Cl)oc1=S ZINC000727824214 1057677523 /nfs/dbraw/zinc/67/75/23/1057677523.db2.gz OLKZIVNFSILLOO-LLVKDONJSA-N 1 2 323.849 4.358 20 0 DIADLO CC[C@@H]1CCC[N@H+]1Cn1nc(-c2ccccc2Cl)oc1=S ZINC000727824214 1057677525 /nfs/dbraw/zinc/67/75/25/1057677525.db2.gz OLKZIVNFSILLOO-LLVKDONJSA-N 1 2 323.849 4.358 20 0 DIADLO Cc1ccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c(OC(C)C)c1 ZINC001243421992 1057678886 /nfs/dbraw/zinc/67/88/86/1057678886.db2.gz KYEHABPFKAJXRB-UHFFFAOYSA-N 1 2 310.319 4.445 20 0 DIADLO c1cc2c[nH+]c(-c3ccc(CNc4ccccc4)cc3)nc2[nH]1 ZINC001243439139 1057684722 /nfs/dbraw/zinc/68/47/22/1057684722.db2.gz IJALWPAHESAUIW-UHFFFAOYSA-N 1 2 300.365 4.189 20 0 DIADLO CC(C)Oc1cccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c1F ZINC001243453480 1057689372 /nfs/dbraw/zinc/68/93/72/1057689372.db2.gz ZCSMNBSCDWBULL-UHFFFAOYSA-N 1 2 314.282 4.276 20 0 DIADLO CC(C)(C)c1ccccc1NC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000728159226 1057691709 /nfs/dbraw/zinc/69/17/09/1057691709.db2.gz UJYZJTJASUQOKD-UHFFFAOYSA-N 1 2 319.408 4.422 20 0 DIADLO CC[N@@H+]1CCCC[C@H]1c1ccc(-c2cc(F)cc(F)c2O)nc1 ZINC001243501975 1057697027 /nfs/dbraw/zinc/69/70/27/1057697027.db2.gz OZYJWXRXMBJWFV-KRWDZBQOSA-N 1 2 318.367 4.279 20 0 DIADLO CC[N@H+]1CCCC[C@H]1c1ccc(-c2cc(F)cc(F)c2O)nc1 ZINC001243501975 1057697028 /nfs/dbraw/zinc/69/70/28/1057697028.db2.gz OZYJWXRXMBJWFV-KRWDZBQOSA-N 1 2 318.367 4.279 20 0 DIADLO CC[N@@H+]1CCCC[C@@H]1c1ccc(-c2cc(F)cc(F)c2O)nc1 ZINC001243501976 1057697208 /nfs/dbraw/zinc/69/72/08/1057697208.db2.gz OZYJWXRXMBJWFV-QGZVFWFLSA-N 1 2 318.367 4.279 20 0 DIADLO CC[N@H+]1CCCC[C@@H]1c1ccc(-c2cc(F)cc(F)c2O)nc1 ZINC001243501976 1057697212 /nfs/dbraw/zinc/69/72/12/1057697212.db2.gz OZYJWXRXMBJWFV-QGZVFWFLSA-N 1 2 318.367 4.279 20 0 DIADLO CC[C@@H]1CCC[N@H+](Cn2nc(-c3ccccc3)sc2=S)C1 ZINC000729982337 1057700109 /nfs/dbraw/zinc/70/01/09/1057700109.db2.gz XNRNWUGCNOANFD-CYBMUJFWSA-N 1 2 319.499 4.421 20 0 DIADLO CC[C@@H]1CCC[N@@H+](Cn2nc(-c3ccccc3)sc2=S)C1 ZINC000729982337 1057700115 /nfs/dbraw/zinc/70/01/15/1057700115.db2.gz XNRNWUGCNOANFD-CYBMUJFWSA-N 1 2 319.499 4.421 20 0 DIADLO CCOc1cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c(F)cc1F ZINC001243532823 1057705548 /nfs/dbraw/zinc/70/55/48/1057705548.db2.gz UUAOONPSVWKHIG-UHFFFAOYSA-N 1 2 318.298 4.355 20 0 DIADLO CCOc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)c(F)cc1F ZINC001243533100 1057705568 /nfs/dbraw/zinc/70/55/68/1057705568.db2.gz XPXPNXSMNLVOIW-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO Cc1ccsc1-c1nn(C[N@H+]2CCC[C@H]2C(C)C)c(=S)o1 ZINC000730253058 1057709967 /nfs/dbraw/zinc/70/99/67/1057709967.db2.gz PZLHWSZNKUJWNB-LBPRGKRZSA-N 1 2 323.487 4.320 20 0 DIADLO Cc1ccsc1-c1nn(C[N@@H+]2CCC[C@H]2C(C)C)c(=S)o1 ZINC000730253058 1057709972 /nfs/dbraw/zinc/70/99/72/1057709972.db2.gz PZLHWSZNKUJWNB-LBPRGKRZSA-N 1 2 323.487 4.320 20 0 DIADLO Cc1nc(Br)ccc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001243558746 1057712778 /nfs/dbraw/zinc/71/27/78/1057712778.db2.gz MUAIZVOCZHLAAU-UHFFFAOYSA-N 1 2 314.186 4.005 20 0 DIADLO Oc1cc(C(F)(F)F)ccc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001243611489 1057732827 /nfs/dbraw/zinc/73/28/27/1057732827.db2.gz IMMFRZGUZGHVCD-UHFFFAOYSA-N 1 2 322.261 4.403 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)CC(=O)OCc2ccccc2)c(C)c1 ZINC000731031108 1057732839 /nfs/dbraw/zinc/73/28/39/1057732839.db2.gz QESXBYTYZICLDM-QGZVFWFLSA-N 1 2 311.425 4.040 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)CC(=O)OCc2ccccc2)c(C)c1 ZINC000731031108 1057732842 /nfs/dbraw/zinc/73/28/42/1057732842.db2.gz QESXBYTYZICLDM-QGZVFWFLSA-N 1 2 311.425 4.040 20 0 DIADLO NC(Cc1cccs1)=[NH+]OCc1ccc(Cl)c(Cl)c1 ZINC000731029567 1057732935 /nfs/dbraw/zinc/73/29/35/1057732935.db2.gz XBGVPPNPDISKAT-UHFFFAOYSA-N 1 2 315.225 4.296 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1csc(-c3ccoc3)n1)C2 ZINC000731032164 1057733021 /nfs/dbraw/zinc/73/30/21/1057733021.db2.gz VRICRSALNFCPCO-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1csc(-c3ccoc3)n1)C2 ZINC000731032164 1057733026 /nfs/dbraw/zinc/73/30/26/1057733026.db2.gz VRICRSALNFCPCO-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO NC(Cc1cccs1)=[NH+]OCc1ccccc1C(F)(F)F ZINC000731028345 1057733438 /nfs/dbraw/zinc/73/34/38/1057733438.db2.gz BLURGWVSMMUHBD-UHFFFAOYSA-N 1 2 314.332 4.008 20 0 DIADLO c1cc(-c2ccc(C3CCOCC3)cc2)cc(N2CCCC2)[nH+]1 ZINC001243628755 1057739634 /nfs/dbraw/zinc/73/96/34/1057739634.db2.gz XMTUTFXHPREPFF-UHFFFAOYSA-N 1 2 308.425 4.243 20 0 DIADLO CSc1ncc(Cl)cc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001243640418 1057741071 /nfs/dbraw/zinc/74/10/71/1057741071.db2.gz ODELNUPZWLDUEQ-UHFFFAOYSA-N 1 2 319.792 4.449 20 0 DIADLO Cc1cc(C(F)(F)F)cc(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC001243657282 1057745308 /nfs/dbraw/zinc/74/53/08/1057745308.db2.gz PDAUASFLEPETHB-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO CCCCc1nc(C)cc(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC001243657242 1057745490 /nfs/dbraw/zinc/74/54/90/1057745490.db2.gz SWAAVXVTHKWRJS-UHFFFAOYSA-N 1 2 306.413 4.039 20 0 DIADLO c1cn(Cc2ccc(-c3ccnc(C4CCCC4)n3)cc2)c[nH+]1 ZINC001243655934 1057745537 /nfs/dbraw/zinc/74/55/37/1057745537.db2.gz HGLJYQIVSRTAAF-UHFFFAOYSA-N 1 2 304.397 4.046 20 0 DIADLO COc1cccc2cc(-c3ccc(Cn4cc[nH+]c4)cc3)cnc21 ZINC001243657076 1057745620 /nfs/dbraw/zinc/74/56/20/1057745620.db2.gz KFKQINAFPBUDSB-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO COc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)cc2ccoc21 ZINC001243658818 1057746142 /nfs/dbraw/zinc/74/61/42/1057746142.db2.gz IZZBWZXFLZDDQB-UHFFFAOYSA-N 1 2 304.349 4.353 20 0 DIADLO Cc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)cc(C)c1N(C)C ZINC001243659059 1057746357 /nfs/dbraw/zinc/74/63/57/1057746357.db2.gz ZPTXNGORWFRBOW-UHFFFAOYSA-N 1 2 305.425 4.281 20 0 DIADLO COc1cc2[nH]ccc2c(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243658146 1057746476 /nfs/dbraw/zinc/74/64/76/1057746476.db2.gz DVQKGNIKKNNJFT-UHFFFAOYSA-N 1 2 303.365 4.088 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(-c4ccccn4)nc3)cc2)c[nH+]1 ZINC001243658598 1057746549 /nfs/dbraw/zinc/74/65/49/1057746549.db2.gz VGVTVFPRKNKLCI-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO Fc1ccc2nccc(-c3ccc(Cn4cc[nH+]c4)cc3)c2c1 ZINC001243659028 1057746598 /nfs/dbraw/zinc/74/65/98/1057746598.db2.gz ZAICNCNXTCWXGO-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO Fc1cnc(-c2ccc(Cn3cc[nH+]c3)cc2)c2ccccc12 ZINC001243657472 1057746768 /nfs/dbraw/zinc/74/67/68/1057746768.db2.gz QDUZRQYNXCFNID-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO Cc1nc(OC(C)C)ccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243659205 1057746872 /nfs/dbraw/zinc/74/68/72/1057746872.db2.gz NRBHNOSFFLTJTB-UHFFFAOYSA-N 1 2 307.397 4.089 20 0 DIADLO c1cn(Cc2ccc(-c3cccc(-c4cccnc4)n3)cc2)c[nH+]1 ZINC001243660653 1057747157 /nfs/dbraw/zinc/74/71/57/1057747157.db2.gz UIGSOKJETMWIPK-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO c1cn(Cc2ccc(-c3ccnc(OCC4CCC4)c3)cc2)c[nH+]1 ZINC001243660279 1057747204 /nfs/dbraw/zinc/74/72/04/1057747204.db2.gz TWRFEVWHDOIGMW-UHFFFAOYSA-N 1 2 319.408 4.172 20 0 DIADLO Cc1cc(OCC(C)C)ncc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243660703 1057747360 /nfs/dbraw/zinc/74/73/60/1057747360.db2.gz UWGIBSWPOCZFAE-UHFFFAOYSA-N 1 2 321.424 4.337 20 0 DIADLO COc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1SC ZINC001243659780 1057747400 /nfs/dbraw/zinc/74/74/00/1057747400.db2.gz DLLZDZXERTYRHC-UHFFFAOYSA-N 1 2 310.422 4.329 20 0 DIADLO CCN(CC)c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001243659063 1057747530 /nfs/dbraw/zinc/74/75/30/1057747530.db2.gz ZZTGTRMNNUHSQR-UHFFFAOYSA-N 1 2 305.425 4.445 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(OC(C)C)nc1C ZINC001243661778 1057747889 /nfs/dbraw/zinc/74/78/89/1057747889.db2.gz DBSWSXPMBBRAHF-UHFFFAOYSA-N 1 2 323.396 4.039 20 0 DIADLO Cc1nc(OC(C)C)ccc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001243660916 1057748088 /nfs/dbraw/zinc/74/80/88/1057748088.db2.gz KIBKBJDQSNFSNZ-UHFFFAOYSA-N 1 2 307.397 4.245 20 0 DIADLO COc1cc2cccnc2c(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243663001 1057748787 /nfs/dbraw/zinc/74/87/87/1057748787.db2.gz SGWZMIJXMRCPFN-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Cc1nc(OC(C)C)ccc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001243663132 1057748796 /nfs/dbraw/zinc/74/87/96/1057748796.db2.gz QQPVIUACIFZMQX-UHFFFAOYSA-N 1 2 311.360 4.169 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cn1ccc(-c2ccccc2)n1 ZINC000731657806 1057750057 /nfs/dbraw/zinc/75/00/57/1057750057.db2.gz NXWQJARZKLWLDP-CQSZACIVSA-N 1 2 309.438 4.188 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cn1ccc(-c2ccccc2)n1 ZINC000731657806 1057750061 /nfs/dbraw/zinc/75/00/61/1057750061.db2.gz NXWQJARZKLWLDP-CQSZACIVSA-N 1 2 309.438 4.188 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cccc(CO)c1Cl ZINC001243707440 1057758469 /nfs/dbraw/zinc/75/84/69/1057758469.db2.gz WPWCIIMXZDHXEU-UHFFFAOYSA-N 1 2 316.832 4.193 20 0 DIADLO CC(=O)OCc1cccc(Cl)c1-c1cn2cc[nH+]c2cc1C ZINC001243724179 1057763470 /nfs/dbraw/zinc/76/34/70/1057763470.db2.gz SWXYQNGZSYGEOF-UHFFFAOYSA-N 1 2 314.772 4.026 20 0 DIADLO C/C(=C\C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc(F)c1 ZINC000732066224 1057767050 /nfs/dbraw/zinc/76/70/50/1057767050.db2.gz LGDUYVHSEAAEOU-ACCUITESSA-N 1 2 321.355 4.258 20 0 DIADLO CC[C@@H](C)C[N@H+](C)Cn1nc(-c2ccccc2)n(CC)c1=S ZINC000732184914 1057769573 /nfs/dbraw/zinc/76/95/73/1057769573.db2.gz YLYYOTMEPQHHOA-CQSZACIVSA-N 1 2 318.490 4.036 20 0 DIADLO CC[C@@H](C)C[N@@H+](C)Cn1nc(-c2ccccc2)n(CC)c1=S ZINC000732184914 1057769576 /nfs/dbraw/zinc/76/95/76/1057769576.db2.gz YLYYOTMEPQHHOA-CQSZACIVSA-N 1 2 318.490 4.036 20 0 DIADLO CC[C@H](C)C[N@H+](C)Cn1nc2sc3ccccc3n2c1=S ZINC000732183820 1057769587 /nfs/dbraw/zinc/76/95/87/1057769587.db2.gz ORVQMJBYNUTHKD-NSHDSACASA-N 1 2 320.487 4.015 20 0 DIADLO CC[C@H](C)C[N@@H+](C)Cn1nc2sc3ccccc3n2c1=S ZINC000732183820 1057769590 /nfs/dbraw/zinc/76/95/90/1057769590.db2.gz ORVQMJBYNUTHKD-NSHDSACASA-N 1 2 320.487 4.015 20 0 DIADLO Clc1ccc(-c2ccccc2Cn2cc[nH+]c2)c2c[nH]nc21 ZINC001243779614 1057777270 /nfs/dbraw/zinc/77/72/70/1057777270.db2.gz AQJKPGHXVXJBRV-UHFFFAOYSA-N 1 2 308.772 4.128 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc(Cl)c3n[nH]cc32)cc1F ZINC001243787421 1057778876 /nfs/dbraw/zinc/77/88/76/1057778876.db2.gz QHKVKIQPXQAKDT-UHFFFAOYSA-N 1 2 321.758 4.223 20 0 DIADLO CC[N@H+](CC1CC1)Cn1nc(-c2ccccc2Cl)oc1=S ZINC000732663520 1057782684 /nfs/dbraw/zinc/78/26/84/1057782684.db2.gz WKSQYJLHISQIHE-UHFFFAOYSA-N 1 2 323.849 4.215 20 0 DIADLO CC[N@@H+](CC1CC1)Cn1nc(-c2ccccc2Cl)oc1=S ZINC000732663520 1057782690 /nfs/dbraw/zinc/78/26/90/1057782690.db2.gz WKSQYJLHISQIHE-UHFFFAOYSA-N 1 2 323.849 4.215 20 0 DIADLO Cc1cc(-c2ccc(Br)cc2F)cn2cc[nH+]c12 ZINC001243805689 1057783970 /nfs/dbraw/zinc/78/39/70/1057783970.db2.gz OFQPNQBITHOAAE-UHFFFAOYSA-N 1 2 305.150 4.211 20 0 DIADLO COc1ccc(-c2ccc3[nH+]c(C)cn3c2)c(OC(F)(F)F)c1 ZINC001243814146 1057785636 /nfs/dbraw/zinc/78/56/36/1057785636.db2.gz KZOYWIHOOOBOLN-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2ccnc(Cl)c2)cc1F ZINC000732986834 1057795768 /nfs/dbraw/zinc/79/57/68/1057795768.db2.gz OCQPRMLBHJLNQO-OAHLLOKOSA-N 1 2 308.759 4.350 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2ccnc(Cl)c2)cc1F ZINC000732986834 1057795770 /nfs/dbraw/zinc/79/57/70/1057795770.db2.gz OCQPRMLBHJLNQO-OAHLLOKOSA-N 1 2 308.759 4.350 20 0 DIADLO Cc1cc(-c2cc[nH+]c(N3CCOCC3)c2)cc(C(C)(C)C)c1 ZINC001243902348 1057802347 /nfs/dbraw/zinc/80/23/47/1057802347.db2.gz FHCRKNDUXWVFGZ-UHFFFAOYSA-N 1 2 310.441 4.191 20 0 DIADLO Cc1cn2cc(-c3ccc(OC(F)(F)F)c(F)c3)ccc2[nH+]1 ZINC001243923480 1057809018 /nfs/dbraw/zinc/80/90/18/1057809018.db2.gz LJLIMRQDNJEWGZ-UHFFFAOYSA-N 1 2 310.250 4.347 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ncc(C(C)C)o1)CCC2 ZINC000733310786 1057812003 /nfs/dbraw/zinc/81/20/03/1057812003.db2.gz WQJQPKPNFBUCRX-ZDUSSCGKSA-N 1 2 305.447 4.072 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1ncc(C(C)C)o1)CCC2 ZINC000733310786 1057812008 /nfs/dbraw/zinc/81/20/08/1057812008.db2.gz WQJQPKPNFBUCRX-ZDUSSCGKSA-N 1 2 305.447 4.072 20 0 DIADLO COc1ccc(-c2cn3cc[nH+]c3cc2C)c(C(F)(F)F)c1 ZINC001243945211 1057816266 /nfs/dbraw/zinc/81/62/66/1057816266.db2.gz JWRXPKZUXOYCJU-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Cc1nc2scc(-c3ccccc3)c2c(C2=C[NH2+]CCC2)n1 ZINC001243948323 1057817600 /nfs/dbraw/zinc/81/76/00/1057817600.db2.gz APNKSJOEEZQWFV-UHFFFAOYSA-N 1 2 307.422 4.391 20 0 DIADLO COc1ccc(-c2ccc3[nH+]ccn3c2C)c(C(F)(F)F)c1 ZINC001243948179 1057817860 /nfs/dbraw/zinc/81/78/60/1057817860.db2.gz XFFHKTDUJNEZGE-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(-c3ncc[nH]3)cc2)c1 ZINC001243978163 1057827157 /nfs/dbraw/zinc/82/71/57/1057827157.db2.gz KICIOPTZLCHWPH-UHFFFAOYSA-N 1 2 300.365 4.144 20 0 DIADLO CC(=O)Nc1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c(C)c1C ZINC001243980507 1057828204 /nfs/dbraw/zinc/82/82/04/1057828204.db2.gz OVDLNIRTLBYGPV-UHFFFAOYSA-N 1 2 305.381 4.319 20 0 DIADLO O=C1CCCc2cc(-c3ccccc3Cn3cc[nH+]c3)ccc21 ZINC001243988545 1057830701 /nfs/dbraw/zinc/83/07/01/1057830701.db2.gz IAWCDGZOYAPUAA-UHFFFAOYSA-N 1 2 302.377 4.117 20 0 DIADLO O=C1CCCc2cc(-c3ccc(Cn4cc[nH+]c4)cc3)ccc21 ZINC001243992239 1057831436 /nfs/dbraw/zinc/83/14/36/1057831436.db2.gz WOLRYWDIBBEHND-UHFFFAOYSA-N 1 2 302.377 4.117 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc3c(c2)CCCC3=O)cc1 ZINC001243992739 1057831976 /nfs/dbraw/zinc/83/19/76/1057831976.db2.gz REJWKKYGUUBFFJ-UHFFFAOYSA-N 1 2 302.377 4.273 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccc3nc(N)ncc3c2)c1 ZINC001243996982 1057832593 /nfs/dbraw/zinc/83/25/93/1057832593.db2.gz DORYJAXBAYZZGV-UHFFFAOYSA-N 1 2 306.413 4.034 20 0 DIADLO COC(=O)c1c(C)cc(-c2ccc(-c3c[nH+]cn3C)cc2)cc1C ZINC001244005596 1057836354 /nfs/dbraw/zinc/83/63/54/1057836354.db2.gz ANPQSRINTDTUEJ-UHFFFAOYSA-N 1 2 320.392 4.158 20 0 DIADLO FC(F)COc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001244067279 1057855913 /nfs/dbraw/zinc/85/59/13/1057855913.db2.gz NXZYORUNDUJHDJ-UHFFFAOYSA-N 1 2 314.335 4.242 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cc(C)c3c(c2)NC(=O)CO3)c1 ZINC001244070383 1057857161 /nfs/dbraw/zinc/85/71/61/1057857161.db2.gz XLTXQUUKOMDCMB-UHFFFAOYSA-N 1 2 324.424 4.148 20 0 DIADLO Fc1ccc(-c2ccc(OCC(F)F)cc2)cc1-n1cc[nH+]c1 ZINC001244072786 1057858704 /nfs/dbraw/zinc/85/87/04/1057858704.db2.gz OZALDFBGJIPUHN-UHFFFAOYSA-N 1 2 318.298 4.322 20 0 DIADLO COc1cccc(C(F)(F)F)c1-c1ccc2[nH+]ccn2c1C ZINC001244085063 1057864002 /nfs/dbraw/zinc/86/40/02/1057864002.db2.gz IKTLNQNYSQSTLN-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(C)cc(C)c1OC ZINC001244118812 1057874884 /nfs/dbraw/zinc/87/48/84/1057874884.db2.gz OBZTVENPMBEPQR-UHFFFAOYSA-N 1 2 308.381 4.173 20 0 DIADLO Cc1ncc(C(F)(F)F)cc1-c1ccccc1Cn1cc[nH+]c1 ZINC001244261247 1057914584 /nfs/dbraw/zinc/91/45/84/1057914584.db2.gz PDFLMIZHVHDMAY-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO Nc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1OC(F)(F)F ZINC001244268648 1057918192 /nfs/dbraw/zinc/91/81/92/1057918192.db2.gz YSANBCBAFHZYRU-UHFFFAOYSA-N 1 2 319.286 4.020 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2ccc(C3CC3)cc2Cl)cc1 ZINC001244275768 1057921053 /nfs/dbraw/zinc/92/10/53/1057921053.db2.gz YFBWWYXEQWBTOG-KRWDZBQOSA-N 1 2 315.800 4.057 20 0 DIADLO FC(F)(F)Cc1ccc(-c2ccccc2Cn2cc[nH+]c2)cn1 ZINC001244294876 1057924858 /nfs/dbraw/zinc/92/48/58/1057924858.db2.gz LACYNSLLWQWFSB-UHFFFAOYSA-N 1 2 317.314 4.098 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(F)c(Cl)cc1F ZINC001244305672 1057929336 /nfs/dbraw/zinc/92/93/36/1057929336.db2.gz JUWBFBVPQKFRIX-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO COc1cc(F)c(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc1Cl ZINC001244353979 1057940707 /nfs/dbraw/zinc/94/07/07/1057940707.db2.gz XEVAMCLVBUJFOY-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO C/C(=C\C=C\[NH3+])c1ccc(C(=O)Nc2cccc(C)c2C)cc1 ZINC001244383625 1057947785 /nfs/dbraw/zinc/94/77/85/1057947785.db2.gz RDAUVALQGHUTCN-UQOMUMHLSA-N 1 2 306.409 4.431 20 0 DIADLO C/C(=C\C=C\[NH3+])c1c(Br)cccc1OC(F)(F)F ZINC001244521377 1057984176 /nfs/dbraw/zinc/98/41/76/1057984176.db2.gz RKNFSGOXEGSVJC-FCXRPNKRSA-N 1 2 322.124 4.223 20 0 DIADLO Cc1cc(-c2cc(Cl)cc(OC(F)(F)F)c2)c[nH+]c1N ZINC001244522005 1057984262 /nfs/dbraw/zinc/98/42/62/1057984262.db2.gz BSWNQPHFUVQFGL-UHFFFAOYSA-N 1 2 302.683 4.191 20 0 DIADLO OCc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1C(F)(F)F ZINC001244587863 1058002711 /nfs/dbraw/zinc/00/27/11/1058002711.db2.gz FWSGZVUEDIGLDK-UHFFFAOYSA-N 1 2 318.298 4.050 20 0 DIADLO Oc1c(Cl)ccc(-c2cncc(C[NH+]3CCCCC3)c2)c1F ZINC001244633477 1058016373 /nfs/dbraw/zinc/01/63/73/1058016373.db2.gz MRFRWUPMDWITCD-UHFFFAOYSA-N 1 2 320.795 4.233 20 0 DIADLO COCOc1ccc(C(F)(F)F)cc1-c1ccn2cc[nH+]c2c1 ZINC001244637490 1058016970 /nfs/dbraw/zinc/01/69/70/1058016970.db2.gz UOLQZIWRMRIANF-UHFFFAOYSA-N 1 2 322.286 4.003 20 0 DIADLO Cc1cn2cc(-c3cc(F)cc(N4CCCCC4)c3)ccc2[nH+]1 ZINC001244822296 1058053544 /nfs/dbraw/zinc/05/35/44/1058053544.db2.gz PCIZRFQFIIKPGP-UHFFFAOYSA-N 1 2 309.388 4.439 20 0 DIADLO Fc1cccc2oc(-c3cccc(C[NH+]4CCOCC4)c3)cc21 ZINC001244925875 1058072683 /nfs/dbraw/zinc/07/26/83/1058072683.db2.gz OWYKRGSYMBKPKP-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO Fc1ccc(-c2c(Cl)ccnc2Cl)cc1-n1cc[nH+]c1 ZINC001244939743 1058076009 /nfs/dbraw/zinc/07/60/09/1058076009.db2.gz BCYNDEQQGDFGNJ-UHFFFAOYSA-N 1 2 308.143 4.380 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2c(Cl)ccnc2Cl)cc1F ZINC001244943466 1058077068 /nfs/dbraw/zinc/07/70/68/1058077068.db2.gz VOWVKHRGJFKMHL-UHFFFAOYSA-N 1 2 317.166 4.395 20 0 DIADLO CNc1cc(-c2cccc(OC(F)(F)C(F)F)c2)cc[nH+]1 ZINC001244973264 1058084347 /nfs/dbraw/zinc/08/43/47/1058084347.db2.gz KZYQWTLFLTTZCB-UHFFFAOYSA-N 1 2 300.255 4.027 20 0 DIADLO CNc1cc(-c2cnc3[nH]c(-c4ccccc4)cc3c2)cc[nH+]1 ZINC001244973598 1058084360 /nfs/dbraw/zinc/08/43/60/1058084360.db2.gz PNRCJGVWELUWNY-UHFFFAOYSA-N 1 2 300.365 4.334 20 0 DIADLO Cc1c(-c2c(Cl)cc(CO)cc2Cl)ccc2[nH+]ccn21 ZINC001245009383 1058091315 /nfs/dbraw/zinc/09/13/15/1058091315.db2.gz BHVJNGWIMDKICA-UHFFFAOYSA-N 1 2 307.180 4.109 20 0 DIADLO Cc1cc(-c2c(Cl)cc(CO)cc2Cl)cn2cc[nH+]c12 ZINC001245008438 1058091421 /nfs/dbraw/zinc/09/14/21/1058091421.db2.gz QFBQVTQXQWZFOJ-UHFFFAOYSA-N 1 2 307.180 4.109 20 0 DIADLO Cc1cc(OC(C)C)c(-c2ccc(Cn3cc[nH+]c3)cn2)cc1C ZINC001245029354 1058098030 /nfs/dbraw/zinc/09/80/30/1058098030.db2.gz VTHIJUZKKPGMBS-UHFFFAOYSA-N 1 2 321.424 4.397 20 0 DIADLO Clc1cccc(-c2ccccc2C[NH+]2CCOCC2)c1Cl ZINC001245098464 1058112857 /nfs/dbraw/zinc/11/28/57/1058112857.db2.gz MGVNAODKZGXBNO-UHFFFAOYSA-N 1 2 322.235 4.493 20 0 DIADLO Cc1ccc(Cl)cc1NC(=S)Nc1cccc2[nH+]ccn21 ZINC001245134259 1058118817 /nfs/dbraw/zinc/11/88/17/1058118817.db2.gz JSMDELGTXJCJRT-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO Fc1ccc(Cl)c(-c2ccc(C[NH+]3CCOCC3)cc2F)c1 ZINC001245137147 1058119207 /nfs/dbraw/zinc/11/92/07/1058119207.db2.gz MVDHBJNNIRXAEH-UHFFFAOYSA-N 1 2 323.770 4.117 20 0 DIADLO Cc1cc(-c2cccc(OC(F)(F)F)c2F)c2[nH+]ccn2c1 ZINC001245174867 1058123865 /nfs/dbraw/zinc/12/38/65/1058123865.db2.gz IJOJZIIHVAZGIT-UHFFFAOYSA-N 1 2 310.250 4.347 20 0 DIADLO COC(=O)c1cc(C)c(-c2c[nH+]cn2Cc2ccccc2)c(C)c1 ZINC001245199163 1058126769 /nfs/dbraw/zinc/12/67/69/1058126769.db2.gz RVWLDADEPCVUJT-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1-c1ccc(C2=CCOCC2)cc1 ZINC001245198230 1058126877 /nfs/dbraw/zinc/12/68/77/1058126877.db2.gz VZZAUFJUHNIZPP-UHFFFAOYSA-N 1 2 316.404 4.402 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccc(-c3ccn(C)n3)nc2)c1 ZINC001245205210 1058128207 /nfs/dbraw/zinc/12/82/07/1058128207.db2.gz MTTYEZLZCZYCPN-UHFFFAOYSA-N 1 2 320.440 4.304 20 0 DIADLO Cc1cc(-c2cncc(C[NH+]3CCOCC3)c2)cc(C(C)(C)C)c1 ZINC001245250914 1058135385 /nfs/dbraw/zinc/13/53/85/1058135385.db2.gz OTDWTXBETKYAKW-UHFFFAOYSA-N 1 2 324.468 4.187 20 0 DIADLO CCc1cc(C)cc(CC)c1-c1cncc(C[NH+]2CCOCC2)c1 ZINC001245250787 1058135417 /nfs/dbraw/zinc/13/54/17/1058135417.db2.gz PXXNZOORMLPPAP-UHFFFAOYSA-N 1 2 324.468 4.014 20 0 DIADLO CN(C)c1cc(-c2cccc(SCC(F)(F)F)c2)cc[nH+]1 ZINC001245408698 1058161375 /nfs/dbraw/zinc/16/13/75/1058161375.db2.gz HYZYADDBVBSHFE-UHFFFAOYSA-N 1 2 312.360 4.469 20 0 DIADLO FC(F)(F)CSc1cccc(-c2nc3[nH]ccc3c[nH+]2)c1 ZINC001245409556 1058162025 /nfs/dbraw/zinc/16/20/25/1058162025.db2.gz BNTZILWXHAIAAB-UHFFFAOYSA-N 1 2 309.316 4.231 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cc(F)cc(N)c2Cl)cc1 ZINC001245466567 1058173054 /nfs/dbraw/zinc/17/30/54/1058173054.db2.gz KENVPPLHESAPAQ-UHFFFAOYSA-N 1 2 301.752 4.129 20 0 DIADLO Cc1c(-c2cccc(Br)c2F)ccc2[nH+]ccn21 ZINC001245486576 1058180655 /nfs/dbraw/zinc/18/06/55/1058180655.db2.gz WYFXMGRVKZSKFC-UHFFFAOYSA-N 1 2 305.150 4.211 20 0 DIADLO CC(C)(C)[C@@H]1CCC[C@H](NC(=O)c2cccc3[nH+]ccn32)CC1 ZINC001516564429 1058182498 /nfs/dbraw/zinc/18/24/98/1058182498.db2.gz PIOFCWWNJNNZBI-CABCVRRESA-N 1 2 313.445 4.059 20 0 DIADLO Cc1cc(NC(=O)C=C[C@]2(C)CC[C@H](C)C2(C)C)c(C)c[nH+]1 ZINC001527662913 1058199243 /nfs/dbraw/zinc/19/92/43/1058199243.db2.gz XDPGDQNBFDGNOX-RITZEBRRSA-N 1 2 300.446 4.077 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@]2(C)CCCc3ccccc32)c(C)[nH+]1 ZINC001527694950 1058208034 /nfs/dbraw/zinc/20/80/34/1058208034.db2.gz BHIFXDWJQCSTMO-NRFANRHFSA-N 1 2 322.452 4.031 20 0 DIADLO Cc1cc(-c2nc(-c3ccccc3)nc3ccccc32)c[nH+]c1N ZINC001245535873 1058215894 /nfs/dbraw/zinc/21/58/94/1058215894.db2.gz GZGNHLNHMCIQFZ-UHFFFAOYSA-N 1 2 312.376 4.249 20 0 DIADLO Cc1cc(-c2ncnc3scc(-c4ccccc4)c32)c[nH+]c1N ZINC001245536099 1058217380 /nfs/dbraw/zinc/21/73/80/1058217380.db2.gz LCQOMIDGVLFGTC-UHFFFAOYSA-N 1 2 318.405 4.311 20 0 DIADLO Cc1cc(-c2cccc3ncc(C(F)(F)F)cc32)c[nH+]c1N ZINC001245538340 1058217966 /nfs/dbraw/zinc/21/79/66/1058217966.db2.gz CGJCDFKNJWARRY-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1cc(-c2cc(C(F)(F)F)nc3ccccc32)c[nH+]c1N ZINC001245540090 1058218065 /nfs/dbraw/zinc/21/80/65/1058218065.db2.gz QJIXREDJEQFUNP-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO COc1cc(-c2c[nH+]c(N)c(C)c2)ccc1Oc1ccccc1 ZINC001245540925 1058218663 /nfs/dbraw/zinc/21/86/63/1058218663.db2.gz KAUAXFQYEJDLBF-UHFFFAOYSA-N 1 2 306.365 4.440 20 0 DIADLO CC(C)(C)c1cccc(OC(=O)CCCn2cc[nH+]c2)c1Cl ZINC001527850895 1058258546 /nfs/dbraw/zinc/25/85/46/1058258546.db2.gz OXTKIMQOHKYBAJ-UHFFFAOYSA-N 1 2 320.820 4.220 20 0 DIADLO COc1ccc2[nH]c(-c3ccc(Cn4cc[nH+]c4)cc3)cc2c1 ZINC001245594688 1058267033 /nfs/dbraw/zinc/26/70/33/1058267033.db2.gz GODHAYIJUWXMBR-UHFFFAOYSA-N 1 2 303.365 4.088 20 0 DIADLO COc1ccc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3OC)cc2c1 ZINC001245596689 1058268780 /nfs/dbraw/zinc/26/87/80/1058268780.db2.gz GQFFTJJEDRGDOD-UHFFFAOYSA-N 1 2 319.364 4.038 20 0 DIADLO COc1ccc2[nH]c(-c3cccc(-c4c[nH+]cn4C)c3)cc2c1 ZINC001245596492 1058269781 /nfs/dbraw/zinc/26/97/81/1058269781.db2.gz YBEYWVFQHGAMPV-UHFFFAOYSA-N 1 2 303.365 4.244 20 0 DIADLO O=C1CCCCc2ccc(-c3ccc(-n4cc[nH+]c4)cc3)cc21 ZINC001245597996 1058271936 /nfs/dbraw/zinc/27/19/36/1058271936.db2.gz RMACXJHQAMMCHI-UHFFFAOYSA-N 1 2 302.377 4.448 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2Cc2cncn2C(C)C)sc1C ZINC001549006975 1058277636 /nfs/dbraw/zinc/27/76/36/1058277636.db2.gz PRZHNXAWNYSRBJ-MRXNPFEDSA-N 1 2 318.490 4.265 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2Cc2cncn2C(C)C)sc1C ZINC001549006975 1058277658 /nfs/dbraw/zinc/27/76/58/1058277658.db2.gz PRZHNXAWNYSRBJ-MRXNPFEDSA-N 1 2 318.490 4.265 20 0 DIADLO COc1c(Br)cccc1-c1cc(C)cn2cc[nH+]c12 ZINC001245683530 1058348457 /nfs/dbraw/zinc/34/84/57/1058348457.db2.gz NUQHUPYLJZQCLA-UHFFFAOYSA-N 1 2 317.186 4.081 20 0 DIADLO COc1c(Br)cccc1-c1ccc2[nH+]ccn2c1C ZINC001245685358 1058348635 /nfs/dbraw/zinc/34/86/35/1058348635.db2.gz RTQPVDZXIHABPL-UHFFFAOYSA-N 1 2 317.186 4.081 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2Cc2cnc(F)cc2C)sc1C ZINC001550622969 1058350610 /nfs/dbraw/zinc/35/06/10/1058350610.db2.gz NNWCVYFDYGHJHC-OAHLLOKOSA-N 1 2 319.449 4.330 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2Cc2cnc(F)cc2C)sc1C ZINC001550622969 1058350632 /nfs/dbraw/zinc/35/06/32/1058350632.db2.gz NNWCVYFDYGHJHC-OAHLLOKOSA-N 1 2 319.449 4.330 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CC[C@@H]3CCCC[C@H]3C2)c(C)[nH+]1 ZINC001562900838 1058357939 /nfs/dbraw/zinc/35/79/39/1058357939.db2.gz SUDCASITPGQGAS-YESZJQIVSA-N 1 2 315.461 4.487 20 0 DIADLO CCC(=CC(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1)CC ZINC001518865272 1058380837 /nfs/dbraw/zinc/38/08/37/1058380837.db2.gz DRBVQXHOTBNHSC-MRXNPFEDSA-N 1 2 317.477 4.091 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCC(c2c[nH+]cn2C)CC1 ZINC001519058897 1058398356 /nfs/dbraw/zinc/39/83/56/1058398356.db2.gz HEXLOUGLZZCRND-INIZCTEOSA-N 1 2 319.493 4.123 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@H]2C2CCCC2)[nH+]c1C ZINC001551741505 1058408596 /nfs/dbraw/zinc/40/85/96/1058408596.db2.gz PSMYDPDPDWIXSV-DLBZAZTESA-N 1 2 323.440 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C2(F)CCCCC2)[nH+]c1C ZINC001551739729 1058409654 /nfs/dbraw/zinc/40/96/54/1058409654.db2.gz LNCUSRKHHQPHPE-UHFFFAOYSA-N 1 2 315.392 4.304 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@@H]2CC(C)C)[nH+]c1C ZINC001551738010 1058409722 /nfs/dbraw/zinc/40/97/22/1058409722.db2.gz GDOVZSRUFWGOQZ-HOCLYGCPSA-N 1 2 311.429 4.314 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2CCCC[C@@H]2F)[nH+]c1C ZINC001551740846 1058409762 /nfs/dbraw/zinc/40/97/62/1058409762.db2.gz OGRYSWKNFJJZHI-ZFWWWQNUSA-N 1 2 315.392 4.160 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)CC(C)(C)C(F)F)[nH+]c1C ZINC001551743671 1058411122 /nfs/dbraw/zinc/41/11/22/1058411122.db2.gz YJMPWHYFWIFMMT-UHFFFAOYSA-N 1 2 321.371 4.313 20 0 DIADLO COc1c(Cl)ccc(F)c1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001245734716 1058415740 /nfs/dbraw/zinc/41/57/40/1058415740.db2.gz XDZGZWPPQDZSJZ-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@@H]2C[C@@H](C)CC[C@@H]2C(C)C)c(C)[nH+]1 ZINC001519675463 1058457535 /nfs/dbraw/zinc/45/75/35/1058457535.db2.gz UKPQHESUXKBGGM-DOPJRALCSA-N 1 2 316.489 4.445 20 0 DIADLO Cc1cc(N[C@H]2CCO[C@H](c3cccnc3)C2)[nH+]c2ccccc12 ZINC001553701189 1058497363 /nfs/dbraw/zinc/49/73/63/1058497363.db2.gz RRSPIFUNXOAMGX-LPHOPBHVSA-N 1 2 319.408 4.270 20 0 DIADLO Cc1cc(N[C@H]2CCO[C@@H](c3ccccn3)C2)[nH+]c2ccccc12 ZINC001553701545 1058500793 /nfs/dbraw/zinc/50/07/93/1058500793.db2.gz BRWLOJXFRVRMDX-HNAYVOBHSA-N 1 2 319.408 4.270 20 0 DIADLO CCn1c[nH+]cc1[C@H]1CCCCN1c1nc2cccc(C)c2o1 ZINC001553701378 1058501461 /nfs/dbraw/zinc/50/14/61/1058501461.db2.gz DMTVKUXYVHWZDG-OAHLLOKOSA-N 1 2 310.401 4.084 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3ccc(C4CC4)o3)cc2)[nH+]c1C ZINC001553911243 1058508921 /nfs/dbraw/zinc/50/89/21/1058508921.db2.gz JBERDGZCTUVECO-UHFFFAOYSA-N 1 2 321.380 4.416 20 0 DIADLO CCCc1[nH]ccc1C(=O)Nc1ccccc1-c1[nH]c(C)c(C)[nH+]1 ZINC001553989236 1058513668 /nfs/dbraw/zinc/51/36/68/1058513668.db2.gz PADWSPKAYJDVDP-UHFFFAOYSA-N 1 2 322.412 4.226 20 0 DIADLO CC(C)c1cn(Cc2cccc(OCc3ccccn3)c2)c[nH+]1 ZINC001554042198 1058514204 /nfs/dbraw/zinc/51/42/04/1058514204.db2.gz CSCHKIARZMCYMC-UHFFFAOYSA-N 1 2 307.397 4.029 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(C)c(Cl)c3C)nn2)c1C ZINC001245827017 1058521306 /nfs/dbraw/zinc/52/13/06/1058521306.db2.gz RCMJIMDWFXDUGD-UHFFFAOYSA-N 1 2 312.804 4.216 20 0 DIADLO Cc1cc(CNC(=O)c2cc3cccc(Cl)c3o2)cc(C)[nH+]1 ZINC001529061180 1058593756 /nfs/dbraw/zinc/59/37/56/1058593756.db2.gz WBKCOQGWBGKOKA-UHFFFAOYSA-N 1 2 314.772 4.028 20 0 DIADLO CC(C)C[C@@H](C)C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001529257333 1058657168 /nfs/dbraw/zinc/65/71/68/1058657168.db2.gz QDMNOEAOMOWCCN-HZPDHXFCSA-N 1 2 319.493 4.026 20 0 DIADLO Cc1cc(NC(=O)c2cc3cccc(Cl)c3s2)c(C)c[nH+]1 ZINC001520768981 1058680423 /nfs/dbraw/zinc/68/04/23/1058680423.db2.gz SMZBDRKVYRTVCT-UHFFFAOYSA-N 1 2 316.813 4.241 20 0 DIADLO Cc1cc(CNC(=O)c2sccc2-c2ccccc2)cc(C)[nH+]1 ZINC001529385085 1058693230 /nfs/dbraw/zinc/69/32/30/1058693230.db2.gz PHKPXWCEGWAXAP-UHFFFAOYSA-N 1 2 322.433 4.357 20 0 DIADLO CCC[C@@H](CC)C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001520868336 1058703710 /nfs/dbraw/zinc/70/37/10/1058703710.db2.gz SKHIGGYUNMKPQQ-CVEARBPZSA-N 1 2 319.493 4.170 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC001529432367 1058711202 /nfs/dbraw/zinc/71/12/02/1058711202.db2.gz KKCOTYXNHOQGIE-IAGOWNOFSA-N 1 2 319.408 4.247 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(CC(C)(C)C)c3ccccc3)ccn12 ZINC001529543191 1058748401 /nfs/dbraw/zinc/74/84/01/1058748401.db2.gz GJSVVXQROQMDAK-UHFFFAOYSA-N 1 2 321.424 4.336 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3CC34CCCC4)cc2)[nH+]c1C ZINC001558134668 1058840459 /nfs/dbraw/zinc/84/04/59/1058840459.db2.gz HFWARTBHCPQWQU-MRXNPFEDSA-N 1 2 309.413 4.212 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3CCCC[C@H]3C)cc2)[nH+]c1C ZINC001558135429 1058842788 /nfs/dbraw/zinc/84/27/88/1058842788.db2.gz QQBONBVESZSASA-SJKOYZFVSA-N 1 2 311.429 4.458 20 0 DIADLO CCCCCC[C@@H](C)C(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001558351053 1058860008 /nfs/dbraw/zinc/86/00/08/1058860008.db2.gz FYDFLNLHIOKFNU-CJNGLKHVSA-N 1 2 305.466 4.297 20 0 DIADLO CCCCCC[C@H](C)C(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001558351052 1058862175 /nfs/dbraw/zinc/86/21/75/1058862175.db2.gz FYDFLNLHIOKFNU-BBRMVZONSA-N 1 2 305.466 4.297 20 0 DIADLO CC(C)[C@H](CCc1ccccc1)C(=O)Nc1cccc2[nH+]ccn21 ZINC001521674349 1058939760 /nfs/dbraw/zinc/93/97/60/1058939760.db2.gz ZLAYVWYISNQISH-KRWDZBQOSA-N 1 2 321.424 4.178 20 0 DIADLO CCOc1ccc(Nc2nc3ccccc3n3c[nH+]cc23)cc1F ZINC001559076756 1058967366 /nfs/dbraw/zinc/96/73/66/1058967366.db2.gz ODHDEXUHOWITKV-UHFFFAOYSA-N 1 2 322.343 4.164 20 0 DIADLO COc1cccc([C@H](C)Nc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001559075957 1058968070 /nfs/dbraw/zinc/96/80/70/1058968070.db2.gz CMXSEAPNUUFWHI-ZDUSSCGKSA-N 1 2 318.380 4.064 20 0 DIADLO CC[C@@H](CNc1[nH+]cnc2c1cnn2C(C)(C)C)c1ccccc1 ZINC001559089327 1058980424 /nfs/dbraw/zinc/98/04/24/1058980424.db2.gz JBVAEIJAKZPIOY-AWEZNQCLSA-N 1 2 323.444 4.187 20 0 DIADLO CSc1ccccc1[C@H](C)NC(=O)c1c(C)cc(C)[nH+]c1C ZINC001530414732 1059034426 /nfs/dbraw/zinc/03/44/26/1059034426.db2.gz SNEHAUSZNILUDD-ZDUSSCGKSA-N 1 2 314.454 4.220 20 0 DIADLO CC(C)CCOc1ccccc1NC(=O)c1cccc2[nH+]ccn21 ZINC001530419095 1059037275 /nfs/dbraw/zinc/03/72/75/1059037275.db2.gz XFBOYJYTUUPMRV-UHFFFAOYSA-N 1 2 323.396 4.012 20 0 DIADLO Cc1c(Nc2nc3ccccc3n3c[nH+]cc23)cccc1N(C)C ZINC001559151686 1059038923 /nfs/dbraw/zinc/03/89/23/1059038923.db2.gz NVBIKVAXCMPOAM-UHFFFAOYSA-N 1 2 317.396 4.001 20 0 DIADLO CCc1cc(NC[C@@]2(C)CCCc3ccccc32)nc(CC)[nH+]1 ZINC001559156731 1059041995 /nfs/dbraw/zinc/04/19/95/1059041995.db2.gz IBXDNCOJFZABIB-HXUWFJFHSA-N 1 2 309.457 4.308 20 0 DIADLO Cc1ccc([C@H]2CCN(c3cc(C)[nH+]c(C4CCC4)n3)C2)cc1 ZINC001559163210 1059048416 /nfs/dbraw/zinc/04/84/16/1059048416.db2.gz MNLMRCPTFNQSQG-SFHVURJKSA-N 1 2 307.441 4.355 20 0 DIADLO CC(C)(C)C[C@H]1CCN(c2nc3ccccc3n3c[nH+]cc23)C1 ZINC001559214349 1059093890 /nfs/dbraw/zinc/09/38/90/1059093890.db2.gz YCZKDGXDYUOPAK-CQSZACIVSA-N 1 2 308.429 4.145 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(Nc3ccc4c(c3)[C@@H](O)CCCC4)c12 ZINC001559231662 1059108362 /nfs/dbraw/zinc/10/83/62/1059108362.db2.gz CLUZQHOZKCPGFN-INIZCTEOSA-N 1 2 322.412 4.024 20 0 DIADLO CC(C)c1cc(NCC(F)(F)Br)nc(C(C)C)[nH+]1 ZINC001559245058 1059117359 /nfs/dbraw/zinc/11/73/59/1059117359.db2.gz MBFNHLSGVHKTLZ-UHFFFAOYSA-N 1 2 322.197 4.123 20 0 DIADLO CN(C)c1[nH+]ccc2cc(NC(=O)/C=C\c3cccs3)ccc21 ZINC001522598127 1059119724 /nfs/dbraw/zinc/11/97/24/1059119724.db2.gz NXIGISDODLUFMD-VURMDHGXSA-N 1 2 323.421 4.014 20 0 DIADLO CC(C)c1cc(N[C@@H]2Cc3ccccc3N(C)C2)nc(C(C)C)[nH+]1 ZINC001559257989 1059127088 /nfs/dbraw/zinc/12/70/88/1059127088.db2.gz MZDWVVWTVMPXOX-MRXNPFEDSA-N 1 2 324.472 4.196 20 0 DIADLO Cc1cc(N[C@@H](CF)c2ccc(F)cc2)nc(C2CCC2)[nH+]1 ZINC001559263037 1059129451 /nfs/dbraw/zinc/12/94/51/1059129451.db2.gz VEWURIASXRVEHM-HNNXBMFYSA-N 1 2 303.356 4.314 20 0 DIADLO CCc1cc(N2CCc3ccc(Cl)c(C)c3C2)nc(CC)[nH+]1 ZINC001559263001 1059129909 /nfs/dbraw/zinc/12/99/09/1059129909.db2.gz KSRHEHCZUSAGQW-UHFFFAOYSA-N 1 2 315.848 4.126 20 0 DIADLO FC1(F)CCC[C@H]1CCNc1nc2ccccc2n2c[nH+]cc12 ZINC001559266550 1059131983 /nfs/dbraw/zinc/13/19/83/1059131983.db2.gz FALNFBRBIQJMAU-LBPRGKRZSA-N 1 2 316.355 4.120 20 0 DIADLO CC(C)c1cc(NCC[C@@H]2CC(C)(C)CO2)nc(C(C)C)[nH+]1 ZINC001559277096 1059137605 /nfs/dbraw/zinc/13/76/05/1059137605.db2.gz DJCXASQILRQROK-CQSZACIVSA-N 1 2 305.466 4.341 20 0 DIADLO Cc1cc(NCC[C@@H]2C[C@H]2Cc2ccccc2)nc(C2CC2)[nH+]1 ZINC001559296365 1059148264 /nfs/dbraw/zinc/14/82/64/1059148264.db2.gz MGMSLFYFXYSHLY-QZTJIDSGSA-N 1 2 307.441 4.343 20 0 DIADLO Cc1ccc2c(ccc(C)c2CSc2nc(N)cc(C)[nH+]2)c1 ZINC001559343286 1059173967 /nfs/dbraw/zinc/17/39/67/1059173967.db2.gz NGNWXUMOQBCPAC-UHFFFAOYSA-N 1 2 309.438 4.430 20 0 DIADLO CCc1cn(CCCCOc2ccccc2C(F)(F)F)c[nH+]1 ZINC001559466384 1059246498 /nfs/dbraw/zinc/24/64/98/1059246498.db2.gz RDKKZNDUXAPOML-UHFFFAOYSA-N 1 2 312.335 4.324 20 0 DIADLO COc1ccccc1Cc1cn(CCCSC(C)(C)C)c[nH+]1 ZINC001559479267 1059253310 /nfs/dbraw/zinc/25/33/10/1059253310.db2.gz YDEDNOHOSZGCRE-UHFFFAOYSA-N 1 2 318.486 4.404 20 0 DIADLO CCC[C@@H](C(=O)OCC)[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC001559486764 1059259690 /nfs/dbraw/zinc/25/96/90/1059259690.db2.gz FMWKKJRMZSBWQX-AWEZNQCLSA-N 1 2 318.244 4.157 20 0 DIADLO CCC[C@@H](C(=O)OCC)[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC001559486764 1059259672 /nfs/dbraw/zinc/25/96/72/1059259672.db2.gz FMWKKJRMZSBWQX-AWEZNQCLSA-N 1 2 318.244 4.157 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cccc2c1OC(F)(F)O2 ZINC001559487948 1059259735 /nfs/dbraw/zinc/25/97/35/1059259735.db2.gz SEVWWRVKYGQRBP-NSHDSACASA-N 1 2 323.314 4.340 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cccc2c1OC(F)(F)O2 ZINC001559487948 1059259762 /nfs/dbraw/zinc/25/97/62/1059259762.db2.gz SEVWWRVKYGQRBP-NSHDSACASA-N 1 2 323.314 4.340 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+](Cc1ccc(C)c(Cl)n1)CC2 ZINC001559502270 1059288459 /nfs/dbraw/zinc/28/84/59/1059288459.db2.gz HJZVTMJPKRCHGR-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+](Cc1ccc(C)c(Cl)n1)CC2 ZINC001559502270 1059288480 /nfs/dbraw/zinc/28/84/80/1059288480.db2.gz HJZVTMJPKRCHGR-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1ccc(C)cc1Br ZINC001559509845 1059301266 /nfs/dbraw/zinc/30/12/66/1059301266.db2.gz LKHPGMJYKAQLBL-UHFFFAOYSA-N 1 2 308.219 4.291 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1ccc(C)cc1Br ZINC001559509845 1059301288 /nfs/dbraw/zinc/30/12/88/1059301288.db2.gz LKHPGMJYKAQLBL-UHFFFAOYSA-N 1 2 308.219 4.291 20 0 DIADLO CCc1ncc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)o1 ZINC001559531354 1059332290 /nfs/dbraw/zinc/33/22/90/1059332290.db2.gz PGCVDBUYLKTGAS-UHFFFAOYSA-N 1 2 320.383 4.460 20 0 DIADLO CCc1ncc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)o1 ZINC001559531354 1059332307 /nfs/dbraw/zinc/33/23/07/1059332307.db2.gz PGCVDBUYLKTGAS-UHFFFAOYSA-N 1 2 320.383 4.460 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2cccc(Br)c2)C[C@@H](C)O1 ZINC001559544791 1059348093 /nfs/dbraw/zinc/34/80/93/1059348093.db2.gz HMVNQVMUZURIAP-TYNCELHUSA-N 1 2 312.251 4.009 20 0 DIADLO CC[C@@H]1C[N@H+]([C@@H](C)c2cccc(Br)c2)C[C@@H](C)O1 ZINC001559544791 1059348111 /nfs/dbraw/zinc/34/81/11/1059348111.db2.gz HMVNQVMUZURIAP-TYNCELHUSA-N 1 2 312.251 4.009 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@H](C(C)C)CC1 ZINC001559546114 1059349669 /nfs/dbraw/zinc/34/96/69/1059349669.db2.gz OBZBGWYUOSDGCZ-WMLDXEAASA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@H](C(C)C)CC1 ZINC001559546114 1059349691 /nfs/dbraw/zinc/34/96/91/1059349691.db2.gz OBZBGWYUOSDGCZ-WMLDXEAASA-N 1 2 323.864 4.312 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3CCC[N@@H+]3Cc3ccco3)n2)cc1C ZINC001247223777 1059350269 /nfs/dbraw/zinc/35/02/69/1059350269.db2.gz MRNWFEDGLPDSOP-KRWDZBQOSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3CCC[N@H+]3Cc3ccco3)n2)cc1C ZINC001247223777 1059350292 /nfs/dbraw/zinc/35/02/92/1059350292.db2.gz MRNWFEDGLPDSOP-KRWDZBQOSA-N 1 2 323.396 4.284 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@@H](C(C)C)CC1 ZINC001559546113 1059351774 /nfs/dbraw/zinc/35/17/74/1059351774.db2.gz OBZBGWYUOSDGCZ-RHSMWYFYSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@@H](C(C)C)CC1 ZINC001559546113 1059351795 /nfs/dbraw/zinc/35/17/95/1059351795.db2.gz OBZBGWYUOSDGCZ-RHSMWYFYSA-N 1 2 323.864 4.312 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3cccc(Cl)c3Cl)ccn12 ZINC001523845047 1059377755 /nfs/dbraw/zinc/37/77/55/1059377755.db2.gz SXGWYWZUXVWNEF-UHFFFAOYSA-N 1 2 321.163 4.169 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@@H+]1CCC2(C1)CCCCC2 ZINC001559561669 1059381837 /nfs/dbraw/zinc/38/18/37/1059381837.db2.gz MLSROYHMFIYXFA-MRXNPFEDSA-N 1 2 321.848 4.210 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@H+]1CCC2(C1)CCCCC2 ZINC001559561669 1059381860 /nfs/dbraw/zinc/38/18/60/1059381860.db2.gz MLSROYHMFIYXFA-MRXNPFEDSA-N 1 2 321.848 4.210 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2c(F)cncc2F)cc1 ZINC001559560634 1059383188 /nfs/dbraw/zinc/38/31/88/1059383188.db2.gz OQTAFKNOFHFKEZ-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2c(F)cncc2F)cc1 ZINC001559560634 1059383207 /nfs/dbraw/zinc/38/32/07/1059383207.db2.gz OQTAFKNOFHFKEZ-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@@H]3CC[C@@H]4CCCC[C@@H]4C3)ccn12 ZINC001523968616 1059404307 /nfs/dbraw/zinc/40/43/07/1059404307.db2.gz XNNQSTSIXKVGCK-ZMSDIMECSA-N 1 2 312.413 4.158 20 0 DIADLO CC(C)C1(c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)CCC1 ZINC001247374931 1059415665 /nfs/dbraw/zinc/41/56/65/1059415665.db2.gz ORUPVUJRTNKOEI-UHFFFAOYSA-N 1 2 308.385 4.000 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)Cc1c(C)cccc1Cl ZINC001559625553 1059456116 /nfs/dbraw/zinc/45/61/16/1059456116.db2.gz XABUIQMPJDVYCO-UHFFFAOYSA-N 1 2 319.861 4.298 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)Cc1c(C)cccc1Cl ZINC001559625553 1059456118 /nfs/dbraw/zinc/45/61/18/1059456118.db2.gz XABUIQMPJDVYCO-UHFFFAOYSA-N 1 2 319.861 4.298 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cc(F)cc2ccoc21 ZINC001524201067 1059464738 /nfs/dbraw/zinc/46/47/38/1059464738.db2.gz MENLUZAEQKCZTN-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO C(=C/c1ccccc1)\c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001247411416 1059465388 /nfs/dbraw/zinc/46/53/88/1059465388.db2.gz UFBKLKNBPNBAJL-ZHACJKMWSA-N 1 2 314.348 4.093 20 0 DIADLO CCC(C)(C)c1ccc(C[N@H+](C)[C@@H](C)C(=O)OC(C)C)cc1 ZINC001559649329 1059476049 /nfs/dbraw/zinc/47/60/49/1059476049.db2.gz DEYNJLYOKURQKS-HNNXBMFYSA-N 1 2 305.462 4.146 20 0 DIADLO CCC(C)(C)c1ccc(C[N@@H+](C)[C@@H](C)C(=O)OC(C)C)cc1 ZINC001559649329 1059476064 /nfs/dbraw/zinc/47/60/64/1059476064.db2.gz DEYNJLYOKURQKS-HNNXBMFYSA-N 1 2 305.462 4.146 20 0 DIADLO CCC[C@@H](C(=O)OCC)[NH+]1CCC(=Cc2cccc(F)c2)CC1 ZINC001559664663 1059493972 /nfs/dbraw/zinc/49/39/72/1059493972.db2.gz OHVRLJNYNNIUJC-SFHVURJKSA-N 1 2 319.420 4.037 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H](C)C2(CCC2)C1 ZINC001559682861 1059509303 /nfs/dbraw/zinc/50/93/03/1059509303.db2.gz RVGDZWKPTSQFIK-XJKSGUPXSA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](C)C2(CCC2)C1 ZINC001559682861 1059509325 /nfs/dbraw/zinc/50/93/25/1059509325.db2.gz RVGDZWKPTSQFIK-XJKSGUPXSA-N 1 2 321.848 4.066 20 0 DIADLO CCNc1nc(C[NH2+][C@@H](CC)c2cc(F)ccc2F)cs1 ZINC001559693797 1059522251 /nfs/dbraw/zinc/52/22/51/1059522251.db2.gz QNMZPTMUOOJRAU-AWEZNQCLSA-N 1 2 311.401 4.094 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2ccc3sccc3c2)c(C)[nH+]1 ZINC001524453954 1059524123 /nfs/dbraw/zinc/52/41/23/1059524123.db2.gz NFLRJBNEXPTVDG-UHFFFAOYSA-N 1 2 310.422 4.152 20 0 DIADLO CCOc1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)nc1 ZINC001559724916 1059556101 /nfs/dbraw/zinc/55/61/01/1059556101.db2.gz JWAJELJSUVYJEX-LBPRGKRZSA-N 1 2 319.474 4.085 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)ccc(C)c2F)o1 ZINC001559726622 1059557862 /nfs/dbraw/zinc/55/78/62/1059557862.db2.gz VNQMDRDMPGSVBX-INIZCTEOSA-N 1 2 321.367 4.350 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)ccc(C)c2F)o1 ZINC001559726622 1059557881 /nfs/dbraw/zinc/55/78/81/1059557881.db2.gz VNQMDRDMPGSVBX-INIZCTEOSA-N 1 2 321.367 4.350 20 0 DIADLO CCC[N@H+](C/C=C\c1ccc(Cl)cc1)CC(=O)OC(C)(C)C ZINC001559734377 1059566104 /nfs/dbraw/zinc/56/61/04/1059566104.db2.gz MXUXNSBDFYWWDL-SREVYHEPSA-N 1 2 323.864 4.407 20 0 DIADLO CCC[N@@H+](C/C=C\c1ccc(Cl)cc1)CC(=O)OC(C)(C)C ZINC001559734377 1059566126 /nfs/dbraw/zinc/56/61/26/1059566126.db2.gz MXUXNSBDFYWWDL-SREVYHEPSA-N 1 2 323.864 4.407 20 0 DIADLO [NH3+][C@H](c1nc(-c2cccc(Cl)c2Cl)no1)c1ccccc1 ZINC001247651685 1059585368 /nfs/dbraw/zinc/58/53/68/1059585368.db2.gz PAALFYLBZSIZIJ-ZDUSSCGKSA-N 1 2 320.179 4.092 20 0 DIADLO CC1=CC[C@H](c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)CC1 ZINC001247762361 1059616149 /nfs/dbraw/zinc/61/61/49/1059616149.db2.gz GTQQLJJALBYZEY-HNNXBMFYSA-N 1 2 306.369 4.136 20 0 DIADLO C[N@H+](CC(=O)OC(C)(C)C)Cc1ccc(Cl)c2ccccc12 ZINC001559793283 1059628080 /nfs/dbraw/zinc/62/80/80/1059628080.db2.gz KJVHMLNTHJJIRD-UHFFFAOYSA-N 1 2 319.832 4.267 20 0 DIADLO C[N@@H+](CC(=O)OC(C)(C)C)Cc1ccc(Cl)c2ccccc12 ZINC001559793283 1059628091 /nfs/dbraw/zinc/62/80/91/1059628091.db2.gz KJVHMLNTHJJIRD-UHFFFAOYSA-N 1 2 319.832 4.267 20 0 DIADLO C[C@H](C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CCC1 ZINC001532440142 1059632486 /nfs/dbraw/zinc/63/24/86/1059632486.db2.gz PZPKAIQIAUXRLI-AWEZNQCLSA-N 1 2 324.424 4.228 20 0 DIADLO CO[C@@H](CC(C)C)C[N@@H+]1CCn2c(cc3ccc(Cl)cc32)C1 ZINC001559804733 1059639906 /nfs/dbraw/zinc/63/99/06/1059639906.db2.gz VDEGROVQZMPTHK-KRWDZBQOSA-N 1 2 320.864 4.171 20 0 DIADLO CO[C@@H](CC(C)C)C[N@H+]1CCn2c(cc3ccc(Cl)cc32)C1 ZINC001559804733 1059639918 /nfs/dbraw/zinc/63/99/18/1059639918.db2.gz VDEGROVQZMPTHK-KRWDZBQOSA-N 1 2 320.864 4.171 20 0 DIADLO CC[C@]([NH2+]C[C@@H](C)CC(C)(C)C)(C(=O)OC)c1ccccc1 ZINC001559829818 1059660435 /nfs/dbraw/zinc/66/04/35/1059660435.db2.gz CVAQBJOAFHDJFJ-HNAYVOBHSA-N 1 2 305.462 4.127 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@@H+](CC[C@@H]1CC1(Cl)Cl)CC2 ZINC001559874993 1059692083 /nfs/dbraw/zinc/69/20/83/1059692083.db2.gz IBCXGYZYOVRTBK-SNVBAGLBSA-N 1 2 322.638 4.421 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@H+](CC[C@@H]1CC1(Cl)Cl)CC2 ZINC001559874993 1059692096 /nfs/dbraw/zinc/69/20/96/1059692096.db2.gz IBCXGYZYOVRTBK-SNVBAGLBSA-N 1 2 322.638 4.421 20 0 DIADLO CCc1ccc([N@H+](CC2CCC3(CC2)OCCO3)C(C)C)cc1 ZINC001559886713 1059706239 /nfs/dbraw/zinc/70/62/39/1059706239.db2.gz ROSYSGTZCJLLAV-UHFFFAOYSA-N 1 2 317.473 4.397 20 0 DIADLO CCc1ccc([N@@H+](CC2CCC3(CC2)OCCO3)C(C)C)cc1 ZINC001559886713 1059706260 /nfs/dbraw/zinc/70/62/60/1059706260.db2.gz ROSYSGTZCJLLAV-UHFFFAOYSA-N 1 2 317.473 4.397 20 0 DIADLO Cc1ccc([N@@H+](CCCOCC(F)(F)F)CC(C)C)cc1 ZINC001559921396 1059737586 /nfs/dbraw/zinc/73/75/86/1059737586.db2.gz KMSRQNWPBXPULU-UHFFFAOYSA-N 1 2 303.368 4.426 20 0 DIADLO Cc1ccc([N@H+](CCCOCC(F)(F)F)CC(C)C)cc1 ZINC001559921396 1059737606 /nfs/dbraw/zinc/73/76/06/1059737606.db2.gz KMSRQNWPBXPULU-UHFFFAOYSA-N 1 2 303.368 4.426 20 0 DIADLO CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)c1c(C)cc(C)[nH+]c1C ZINC001533021754 1059773718 /nfs/dbraw/zinc/77/37/18/1059773718.db2.gz NAUWEJGVMHZBDL-IBGZPJMESA-N 1 2 324.468 4.409 20 0 DIADLO C[C@H]1COC2(CCC2)C[N@@H+]1CCc1cccc(Cl)c1Cl ZINC001559976909 1059784076 /nfs/dbraw/zinc/78/40/76/1059784076.db2.gz IRDUKZCJLYZQJP-LBPRGKRZSA-N 1 2 314.256 4.179 20 0 DIADLO C[C@H]1COC2(CCC2)C[N@H+]1CCc1cccc(Cl)c1Cl ZINC001559976909 1059784085 /nfs/dbraw/zinc/78/40/85/1059784085.db2.gz IRDUKZCJLYZQJP-LBPRGKRZSA-N 1 2 314.256 4.179 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1C)[C@@H](C)C(=O)OC(C)(C)C ZINC001559993729 1059799955 /nfs/dbraw/zinc/79/99/55/1059799955.db2.gz GRBDYLUMOCNEOZ-ZDUSSCGKSA-N 1 2 311.853 4.201 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)cc1C)[C@@H](C)C(=O)OC(C)(C)C ZINC001559993729 1059799970 /nfs/dbraw/zinc/79/99/70/1059799970.db2.gz GRBDYLUMOCNEOZ-ZDUSSCGKSA-N 1 2 311.853 4.201 20 0 DIADLO Fc1cccc([C@@H]2COCC[N@@H+]2C[C@@H]2CCCCC2(F)F)c1 ZINC001560001716 1059805875 /nfs/dbraw/zinc/80/58/75/1059805875.db2.gz GEGCZCJPFQYKEF-HOCLYGCPSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1cccc([C@@H]2COCC[N@H+]2C[C@@H]2CCCCC2(F)F)c1 ZINC001560001716 1059805896 /nfs/dbraw/zinc/80/58/96/1059805896.db2.gz GEGCZCJPFQYKEF-HOCLYGCPSA-N 1 2 313.363 4.025 20 0 DIADLO Cc1ccc(N2CC[NH+](Cc3ccc(Cl)s3)CC2)c(C)c1 ZINC001560019177 1059828798 /nfs/dbraw/zinc/82/87/98/1059828798.db2.gz SLQJHRLVHLVUIN-UHFFFAOYSA-N 1 2 320.889 4.341 20 0 DIADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2Cl)on1)c1ccns1 ZINC001560047520 1059863711 /nfs/dbraw/zinc/86/37/11/1059863711.db2.gz LFBRCQUYUAEIAE-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO Cc1cc(C)c(CNC(=O)C2CC(C)(C)CC(C)(C)C2)c[nH+]1 ZINC001525405727 1059869582 /nfs/dbraw/zinc/86/95/82/1059869582.db2.gz VRMHRCNMOZUSHB-UHFFFAOYSA-N 1 2 302.462 4.167 20 0 DIADLO Fc1ccc(C(F)(F)C[NH2+][C@@H]2CCO[C@H]2c2ccccc2)cc1 ZINC001560066459 1059878983 /nfs/dbraw/zinc/87/89/83/1059878983.db2.gz WCPCPJHNBIWPNK-SJORKVTESA-N 1 2 321.342 4.037 20 0 DIADLO CCCOC(=O)[C@H](C)[NH2+][C@@H]1CCC(C)(C)C[C@H]1c1ccccc1 ZINC001560092855 1059904257 /nfs/dbraw/zinc/90/42/57/1059904257.db2.gz QTQNRWPTXSMUIB-RYQLBKOJSA-N 1 2 317.473 4.280 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1c(C)cccc1Br ZINC001248598852 1059908911 /nfs/dbraw/zinc/90/89/11/1059908911.db2.gz FCYUVNSUBWGFCT-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1c(C)cccc1Br ZINC001248598852 1059908927 /nfs/dbraw/zinc/90/89/27/1059908927.db2.gz FCYUVNSUBWGFCT-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2c(C)cccc2Br)cn1 ZINC001248623715 1059918399 /nfs/dbraw/zinc/91/83/99/1059918399.db2.gz BEKGEARXTKTASL-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2c(C)cccc2Br)cn1 ZINC001248623715 1059918412 /nfs/dbraw/zinc/91/84/12/1059918412.db2.gz BEKGEARXTKTASL-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+]1CCCC[C@H]1c1ncccn1 ZINC001560114989 1059921719 /nfs/dbraw/zinc/92/17/19/1059921719.db2.gz JVMNKMVVLJWEJM-INIZCTEOSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+]1CCCC[C@H]1c1ncccn1 ZINC001560114989 1059921739 /nfs/dbraw/zinc/92/17/39/1059921739.db2.gz JVMNKMVVLJWEJM-INIZCTEOSA-N 1 2 301.821 4.166 20 0 DIADLO CCCCCCc1csc(C[N@@H+]2CCc3ncncc3C2)c1 ZINC001248683189 1059934210 /nfs/dbraw/zinc/93/42/10/1059934210.db2.gz MUFYCCKFWHCMAX-UHFFFAOYSA-N 1 2 315.486 4.219 20 0 DIADLO CCCCCCc1csc(C[N@H+]2CCc3ncncc3C2)c1 ZINC001248683189 1059934232 /nfs/dbraw/zinc/93/42/32/1059934232.db2.gz MUFYCCKFWHCMAX-UHFFFAOYSA-N 1 2 315.486 4.219 20 0 DIADLO Cc1noc2ccc(C[N@@H+](C)Cc3csc(C(C)C)n3)cc12 ZINC001248706475 1059942701 /nfs/dbraw/zinc/94/27/01/1059942701.db2.gz VELWFAIYQGISKX-UHFFFAOYSA-N 1 2 315.442 4.348 20 0 DIADLO Cc1noc2ccc(C[N@H+](C)Cc3csc(C(C)C)n3)cc12 ZINC001248706475 1059942724 /nfs/dbraw/zinc/94/27/24/1059942724.db2.gz VELWFAIYQGISKX-UHFFFAOYSA-N 1 2 315.442 4.348 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1ncc(C(F)(F)F)cc1F ZINC001248787037 1059974951 /nfs/dbraw/zinc/97/49/51/1059974951.db2.gz NKRATYHXVSJDLK-LLVKDONJSA-N 1 2 324.321 4.359 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1ncc(C(F)(F)F)cc1F ZINC001248787037 1059974974 /nfs/dbraw/zinc/97/49/74/1059974974.db2.gz NKRATYHXVSJDLK-LLVKDONJSA-N 1 2 324.321 4.359 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1ncc(C(F)(F)F)cc1F ZINC001248787038 1059975461 /nfs/dbraw/zinc/97/54/61/1059975461.db2.gz NKRATYHXVSJDLK-NSHDSACASA-N 1 2 324.321 4.359 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1ncc(C(F)(F)F)cc1F ZINC001248787038 1059975482 /nfs/dbraw/zinc/97/54/82/1059975482.db2.gz NKRATYHXVSJDLK-NSHDSACASA-N 1 2 324.321 4.359 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ncc(C(F)(F)F)cc2F)Cc2ccccc21 ZINC001248786771 1059975904 /nfs/dbraw/zinc/97/59/04/1059975904.db2.gz DNUKHGLJRDDCOB-LLVKDONJSA-N 1 2 324.321 4.359 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ncc(C(F)(F)F)cc2F)Cc2ccccc21 ZINC001248786771 1059975925 /nfs/dbraw/zinc/97/59/25/1059975925.db2.gz DNUKHGLJRDDCOB-LLVKDONJSA-N 1 2 324.321 4.359 20 0 DIADLO Cc1ccccc1C[N@@H+](C)Cc1ncc(C(F)(F)F)cc1F ZINC001248789028 1059976293 /nfs/dbraw/zinc/97/62/93/1059976293.db2.gz KGTASIFGHSUNMD-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ccccc1C[N@H+](C)Cc1ncc(C(F)(F)F)cc1F ZINC001248789028 1059976313 /nfs/dbraw/zinc/97/63/13/1059976313.db2.gz KGTASIFGHSUNMD-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO CC(C)CC1(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)CCCC1 ZINC001525657541 1059977020 /nfs/dbraw/zinc/97/70/20/1059977020.db2.gz IFMMNMYRFYKFIK-UHFFFAOYSA-N 1 2 311.429 4.417 20 0 DIADLO Cc1ncc(Br)cc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001248781416 1059977216 /nfs/dbraw/zinc/97/72/16/1059977216.db2.gz JTBLFGAXEVXCJK-MRXNPFEDSA-N 1 2 317.230 4.100 20 0 DIADLO Cc1ncc(Br)cc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC001248781416 1059977228 /nfs/dbraw/zinc/97/72/28/1059977228.db2.gz JTBLFGAXEVXCJK-MRXNPFEDSA-N 1 2 317.230 4.100 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@@H+]2CCc3ccsc3C2)c1 ZINC001560199222 1059982212 /nfs/dbraw/zinc/98/22/12/1059982212.db2.gz NZCWNXOLHSIQEV-UHFFFAOYSA-N 1 2 313.344 4.047 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@H+]2CCc3ccsc3C2)c1 ZINC001560199222 1059982233 /nfs/dbraw/zinc/98/22/33/1059982233.db2.gz NZCWNXOLHSIQEV-UHFFFAOYSA-N 1 2 313.344 4.047 20 0 DIADLO Cc1cc(C[N@H+](Cc2cccnc2)Cc2ccccn2)cs1 ZINC001248803069 1059987121 /nfs/dbraw/zinc/98/71/21/1059987121.db2.gz DYWJHCORGRYEEF-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1cc(C[N@@H+](Cc2cccnc2)Cc2ccccn2)cs1 ZINC001248803069 1059987149 /nfs/dbraw/zinc/98/71/49/1059987149.db2.gz DYWJHCORGRYEEF-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)c(F)c2)nc1 ZINC001560215639 1059991516 /nfs/dbraw/zinc/99/15/16/1059991516.db2.gz OYDXQBZXTFPPGD-QGZVFWFLSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)c(F)c2)nc1 ZINC001560215639 1059991537 /nfs/dbraw/zinc/99/15/37/1059991537.db2.gz OYDXQBZXTFPPGD-QGZVFWFLSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3Cc4ccccc4C(C)(C)C3)nc2c1 ZINC001248843407 1060013284 /nfs/dbraw/zinc/01/32/84/1060013284.db2.gz KKEZCPBFKWQHBA-UHFFFAOYSA-N 1 2 305.425 4.165 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3Cc4ccccc4C(C)(C)C3)nc2c1 ZINC001248843407 1060013308 /nfs/dbraw/zinc/01/33/08/1060013308.db2.gz KKEZCPBFKWQHBA-UHFFFAOYSA-N 1 2 305.425 4.165 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3Cc4ccccc4C(C)(C)C3)[nH]c2c1 ZINC001248843407 1060013327 /nfs/dbraw/zinc/01/33/27/1060013327.db2.gz KKEZCPBFKWQHBA-UHFFFAOYSA-N 1 2 305.425 4.165 20 0 DIADLO Cc1ccc2nc(C[N@H+]3Cc4ccccc4C(C)(C)C3)[nH]c2c1 ZINC001248843407 1060013351 /nfs/dbraw/zinc/01/33/51/1060013351.db2.gz KKEZCPBFKWQHBA-UHFFFAOYSA-N 1 2 305.425 4.165 20 0 DIADLO Cc1cc(CNC(=O)c2cccc(C3CCCC3)c2)cc(C)[nH+]1 ZINC001525865253 1060058400 /nfs/dbraw/zinc/05/84/00/1060058400.db2.gz PPQIDVQMTXVYNO-UHFFFAOYSA-N 1 2 308.425 4.286 20 0 DIADLO Fc1cc(CNc2ccc(N3CCCCC3)c[nH+]2)cc(F)c1F ZINC001560281526 1060059350 /nfs/dbraw/zinc/05/93/50/1060059350.db2.gz MFQJIQWBWUIWJY-UHFFFAOYSA-N 1 2 321.346 4.101 20 0 DIADLO Cc1cc(C)nc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)n1 ZINC001248966828 1060095742 /nfs/dbraw/zinc/09/57/42/1060095742.db2.gz WALRHMBGUDBXGG-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C)nc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)n1 ZINC001248966828 1060095765 /nfs/dbraw/zinc/09/57/65/1060095765.db2.gz WALRHMBGUDBXGG-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(C)c(C)nc2Cl)cn1 ZINC001249029825 1060120489 /nfs/dbraw/zinc/12/04/89/1060120489.db2.gz YTJVJDWVZDLGSR-KRWDZBQOSA-N 1 2 315.848 4.392 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc(C)c(C)nc2Cl)cn1 ZINC001249029825 1060120503 /nfs/dbraw/zinc/12/05/03/1060120503.db2.gz YTJVJDWVZDLGSR-KRWDZBQOSA-N 1 2 315.848 4.392 20 0 DIADLO c1ccc2c(c1)C[NH2+][C@@H]2c1nc(-c2cccc3ccccc32)no1 ZINC001249133666 1060169621 /nfs/dbraw/zinc/16/96/21/1060169621.db2.gz UFNRPGAJWJGWIW-SFHVURJKSA-N 1 2 313.360 4.082 20 0 DIADLO C[C@@H](CCc1ccccc1)C[NH2+]c1ccc2c(c1)N(C)CCO2 ZINC001560389858 1060176710 /nfs/dbraw/zinc/17/67/10/1060176710.db2.gz SCXXWWNPVCFUHJ-INIZCTEOSA-N 1 2 310.441 4.196 20 0 DIADLO Cc1cc(NCc2csc(C(C)C)n2)ccc1-n1cc[nH+]c1 ZINC001560392352 1060178987 /nfs/dbraw/zinc/17/89/87/1060178987.db2.gz ZSRUDIXBWAWWCD-UHFFFAOYSA-N 1 2 312.442 4.373 20 0 DIADLO c1sc(C2CC2)nc1CNc1ccc(N2CCCCC2)[nH+]c1 ZINC001560407369 1060193346 /nfs/dbraw/zinc/19/33/46/1060193346.db2.gz WPJUVZSAFCPLFC-UHFFFAOYSA-N 1 2 314.458 4.018 20 0 DIADLO Cc1ccc(-c2noc([C@H]3CC[N@@H+]3Cc3ccccc3)n2)c(C)c1 ZINC001249255562 1060203378 /nfs/dbraw/zinc/20/33/78/1060203378.db2.gz JZXJLRPWSNDWTM-GOSISDBHSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1ccc(-c2noc([C@H]3CC[N@H+]3Cc3ccccc3)n2)c(C)c1 ZINC001249255562 1060203400 /nfs/dbraw/zinc/20/34/00/1060203400.db2.gz JZXJLRPWSNDWTM-GOSISDBHSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3CC[N@@H+]3Cc3ccccc3)n2)c(C)c1 ZINC001249255564 1060204622 /nfs/dbraw/zinc/20/46/22/1060204622.db2.gz JZXJLRPWSNDWTM-SFHVURJKSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3CC[N@H+]3Cc3ccccc3)n2)c(C)c1 ZINC001249255564 1060204631 /nfs/dbraw/zinc/20/46/31/1060204631.db2.gz JZXJLRPWSNDWTM-SFHVURJKSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1cc(NCc2ccc3c(c2)CC(C)(C)O3)ccc1[NH+](C)C ZINC001560422541 1060207020 /nfs/dbraw/zinc/20/70/20/1060207020.db2.gz TZEBMONYZXAEEL-UHFFFAOYSA-N 1 2 310.441 4.387 20 0 DIADLO COCCC1(CNc2ccc([NH+](C)C)c(C)c2)CCCCC1 ZINC001560422955 1060207401 /nfs/dbraw/zinc/20/74/01/1060207401.db2.gz NMQZZEHHHJSHDS-UHFFFAOYSA-N 1 2 304.478 4.460 20 0 DIADLO C/C(=C/C(C)(C)C)C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC001526417753 1060212882 /nfs/dbraw/zinc/21/28/82/1060212882.db2.gz IBOJVNOQXISUDP-SEYXRHQNSA-N 1 2 311.429 4.232 20 0 DIADLO CC1CC[NH+](Cc2cc(Br)sc2Cl)CC1 ZINC001249379152 1060230790 /nfs/dbraw/zinc/23/07/90/1060230790.db2.gz NZGAWQQGYBHEGR-UHFFFAOYSA-N 1 2 308.672 4.396 20 0 DIADLO CC[C@@H](C)c1nn(C)cc1C[N@@H+]1CCc2cccc(Cl)c2C1 ZINC001249408492 1060238498 /nfs/dbraw/zinc/23/84/98/1060238498.db2.gz FPXOTWZDNGRMNR-CYBMUJFWSA-N 1 2 317.864 4.145 20 0 DIADLO CC[C@@H](C)c1nn(C)cc1C[N@H+]1CCc2cccc(Cl)c2C1 ZINC001249408492 1060238511 /nfs/dbraw/zinc/23/85/11/1060238511.db2.gz FPXOTWZDNGRMNR-CYBMUJFWSA-N 1 2 317.864 4.145 20 0 DIADLO CC[C@H](C)c1nn(C)cc1C[N@H+](C)Cc1ccccc1Cl ZINC001249405874 1060238747 /nfs/dbraw/zinc/23/87/47/1060238747.db2.gz BVMKWXGMSVJJDJ-ZDUSSCGKSA-N 1 2 305.853 4.219 20 0 DIADLO CC[C@H](C)c1nn(C)cc1C[N@@H+](C)Cc1ccccc1Cl ZINC001249405874 1060238761 /nfs/dbraw/zinc/23/87/61/1060238761.db2.gz BVMKWXGMSVJJDJ-ZDUSSCGKSA-N 1 2 305.853 4.219 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(-c3ccco3)cc2F)sc1C ZINC001560460991 1060253477 /nfs/dbraw/zinc/25/34/77/1060253477.db2.gz AMPHQICPSKSDQU-UHFFFAOYSA-N 1 2 316.401 4.449 20 0 DIADLO Oc1ccc(Oc2cccc(C[N@@H+]3CCn4cccc4C3)c2)cc1 ZINC001249504183 1060267281 /nfs/dbraw/zinc/26/72/81/1060267281.db2.gz YIHXBLSXRNPNMD-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO Oc1ccc(Oc2cccc(C[N@H+]3CCn4cccc4C3)c2)cc1 ZINC001249504183 1060267301 /nfs/dbraw/zinc/26/73/01/1060267301.db2.gz YIHXBLSXRNPNMD-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3cccc(C4CCC4)c3)ccn12 ZINC001534438974 1060270802 /nfs/dbraw/zinc/27/08/02/1060270802.db2.gz RWHXXGWTDZXKQA-UHFFFAOYSA-N 1 2 305.381 4.163 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+]2CCC[C@H]2c2ccncc2)cn1 ZINC001249514407 1060273141 /nfs/dbraw/zinc/27/31/41/1060273141.db2.gz KAAOHOQWXCKIBC-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+]2CCC[C@H]2c2ccncc2)cn1 ZINC001249514407 1060273165 /nfs/dbraw/zinc/27/31/65/1060273165.db2.gz KAAOHOQWXCKIBC-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+]2CCCC[C@@](C)(F)C2)cn1 ZINC001249512422 1060273646 /nfs/dbraw/zinc/27/36/46/1060273646.db2.gz OYDPVJMCJFPMGW-CQSZACIVSA-N 1 2 304.331 4.123 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+]2CCCC[C@@](C)(F)C2)cn1 ZINC001249512422 1060273661 /nfs/dbraw/zinc/27/36/61/1060273661.db2.gz OYDPVJMCJFPMGW-CQSZACIVSA-N 1 2 304.331 4.123 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+](C)Cc2ccccc2F)cn1 ZINC001249514550 1060273853 /nfs/dbraw/zinc/27/38/53/1060273853.db2.gz PJGSAPSPLKQGBZ-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+](C)Cc2ccccc2F)cn1 ZINC001249514550 1060273876 /nfs/dbraw/zinc/27/38/76/1060273876.db2.gz PJGSAPSPLKQGBZ-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO FCC(CF)[NH2+]Cc1cccc(OCCCc2ccccc2)c1 ZINC001560483461 1060276067 /nfs/dbraw/zinc/27/60/67/1060276067.db2.gz ZJKULXFAUWXPOK-UHFFFAOYSA-N 1 2 319.395 4.095 20 0 DIADLO CCCOc1ccc(C[NH2+][C@@H]2CCCC2(F)F)cc1OCC ZINC001560494040 1060287687 /nfs/dbraw/zinc/28/76/87/1060287687.db2.gz XAYPEJAKQWYLDY-MRXNPFEDSA-N 1 2 313.388 4.152 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001534563875 1060302582 /nfs/dbraw/zinc/30/25/82/1060302582.db2.gz CMAADKSCRBHNCP-OAHLLOKOSA-N 1 2 305.466 4.391 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H](Oc3ccc(Cl)cc3)C2)ns1 ZINC001249589051 1060307975 /nfs/dbraw/zinc/30/79/75/1060307975.db2.gz RJYQZFPLGSEQER-INIZCTEOSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H](Oc3ccc(Cl)cc3)C2)ns1 ZINC001249589051 1060307995 /nfs/dbraw/zinc/30/79/95/1060307995.db2.gz RJYQZFPLGSEQER-INIZCTEOSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1c(N)c(F)ccc1Nc1cc[nH+]c2ccc(Cl)cc12 ZINC001249630708 1060320074 /nfs/dbraw/zinc/32/00/74/1060320074.db2.gz AQHFZROTEVLDKI-UHFFFAOYSA-N 1 2 301.752 4.083 20 0 DIADLO COc1cccc(Nc2ccc(NCc3c(C)noc3C)[nH+]c2)c1 ZINC001560533886 1060337248 /nfs/dbraw/zinc/33/72/48/1060337248.db2.gz HXPPSBKFGSQHBD-UHFFFAOYSA-N 1 2 324.384 4.051 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC001534712551 1060346862 /nfs/dbraw/zinc/34/68/62/1060346862.db2.gz MIBRMXXVTIVTRM-RTBURBONSA-N 1 2 316.404 4.016 20 0 DIADLO COc1cc(C[NH2+]CC(F)(F)C(C)(C)C)ccc1OC(F)F ZINC001560541611 1060349739 /nfs/dbraw/zinc/34/97/39/1060349739.db2.gz BKUAOCBIHRGVGU-UHFFFAOYSA-N 1 2 323.330 4.068 20 0 DIADLO Cc1cn2cc(NC(=S)Nc3c(C)cc(C)cc3C)ccc2[nH+]1 ZINC001249720912 1060370395 /nfs/dbraw/zinc/37/03/95/1060370395.db2.gz GVULDRQFSFYCFP-UHFFFAOYSA-N 1 2 324.453 4.377 20 0 DIADLO CCc1ccc(CNc2[nH]c3ccc(Br)cc3[nH+]2)o1 ZINC001560574762 1060388891 /nfs/dbraw/zinc/38/88/91/1060388891.db2.gz ZNXJUCGWTBCGTK-UHFFFAOYSA-N 1 2 320.190 4.093 20 0 DIADLO CCc1ccc(CNc2[nH]c3cc(Br)ccc3[nH+]2)o1 ZINC001560574762 1060388912 /nfs/dbraw/zinc/38/89/12/1060388912.db2.gz ZNXJUCGWTBCGTK-UHFFFAOYSA-N 1 2 320.190 4.093 20 0 DIADLO COc1cc(C[NH+]2CCC3(CC3)CC2)c(F)c(F)c1Cl ZINC001249789984 1060402629 /nfs/dbraw/zinc/40/26/29/1060402629.db2.gz JXADXRBBVHDUON-UHFFFAOYSA-N 1 2 301.764 4.003 20 0 DIADLO COc1cc(C[N@@H+]2CCCC3(CCC3)C2)c(F)c(F)c1Cl ZINC001249803827 1060407007 /nfs/dbraw/zinc/40/70/07/1060407007.db2.gz LQZWJLIHRLISHM-UHFFFAOYSA-N 1 2 315.791 4.393 20 0 DIADLO COc1cc(C[N@H+]2CCCC3(CCC3)C2)c(F)c(F)c1Cl ZINC001249803827 1060407015 /nfs/dbraw/zinc/40/70/15/1060407015.db2.gz LQZWJLIHRLISHM-UHFFFAOYSA-N 1 2 315.791 4.393 20 0 DIADLO CCc1ccc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1CC ZINC001527029764 1060419766 /nfs/dbraw/zinc/41/97/66/1060419766.db2.gz MYGBGLXWPOIJOG-UHFFFAOYSA-N 1 2 319.408 4.249 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1ccc(C2CC2)cc1 ZINC001527042990 1060422245 /nfs/dbraw/zinc/42/22/45/1060422245.db2.gz WLUOZNRKQFRCJM-UHFFFAOYSA-N 1 2 303.365 4.002 20 0 DIADLO Cc1cn2cccc(Nc3ccc4c(c3)C(=O)CCCC4)c2[nH+]1 ZINC001249890469 1060452899 /nfs/dbraw/zinc/45/28/99/1060452899.db2.gz OANXYEIYVQHNAH-UHFFFAOYSA-N 1 2 305.381 4.295 20 0 DIADLO Fc1ccc2c(c1F)C[N@@H+](Cc1ccc3c(c1)CCCC3)CC2 ZINC001560640584 1060459730 /nfs/dbraw/zinc/45/97/30/1060459730.db2.gz KIIDFYWQCFUUPP-UHFFFAOYSA-N 1 2 313.391 4.402 20 0 DIADLO Fc1ccc2c(c1F)C[N@H+](Cc1ccc3c(c1)CCCC3)CC2 ZINC001560640584 1060459735 /nfs/dbraw/zinc/45/97/35/1060459735.db2.gz KIIDFYWQCFUUPP-UHFFFAOYSA-N 1 2 313.391 4.402 20 0 DIADLO O=C(CCCCCc1cccs1)Nc1ccn2cc[nH+]c2c1 ZINC001535107828 1060463988 /nfs/dbraw/zinc/46/39/88/1060463988.db2.gz DTLNWASNLIWHHI-UHFFFAOYSA-N 1 2 313.426 4.137 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)nc1C ZINC001249914705 1060477136 /nfs/dbraw/zinc/47/71/36/1060477136.db2.gz VPDDGEBAFWTOBC-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)nc1C ZINC001249914705 1060477148 /nfs/dbraw/zinc/47/71/48/1060477148.db2.gz VPDDGEBAFWTOBC-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO CN1Cc2c(cccc2Nc2cc[nH+]c3cc(Cl)ccc23)C1=O ZINC001249938021 1060492351 /nfs/dbraw/zinc/49/23/51/1060492351.db2.gz VJSGIQITJPPXGO-UHFFFAOYSA-N 1 2 323.783 4.217 20 0 DIADLO CC(C)O[C@@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001249941785 1060495927 /nfs/dbraw/zinc/49/59/27/1060495927.db2.gz MXYPMHWBCIYQIO-GFCCVEGCSA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001249941785 1060495940 /nfs/dbraw/zinc/49/59/40/1060495940.db2.gz MXYPMHWBCIYQIO-GFCCVEGCSA-N 1 2 306.208 4.132 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(C(C)(C)C)s3)ccc2[nH+]1 ZINC001527356056 1060498892 /nfs/dbraw/zinc/49/88/92/1060498892.db2.gz NZFVGFMPSLPRRA-UHFFFAOYSA-N 1 2 313.426 4.254 20 0 DIADLO CCCO[C@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001249945896 1060499372 /nfs/dbraw/zinc/49/93/72/1060499372.db2.gz WEHOLMZAULDKPF-LBPRGKRZSA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001249945896 1060499396 /nfs/dbraw/zinc/49/93/96/1060499396.db2.gz WEHOLMZAULDKPF-LBPRGKRZSA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001249945862 1060500515 /nfs/dbraw/zinc/50/05/15/1060500515.db2.gz UAVHRIBXNCTJQO-GFCCVEGCSA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001249945862 1060500535 /nfs/dbraw/zinc/50/05/35/1060500535.db2.gz UAVHRIBXNCTJQO-GFCCVEGCSA-N 1 2 306.208 4.133 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2nccs2)cc1C(C)(C)C ZINC001560678272 1060517675 /nfs/dbraw/zinc/51/76/75/1060517675.db2.gz XXWIWGNDOSIRRR-UHFFFAOYSA-N 1 2 304.459 4.081 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2nccs2)cc1C(C)(C)C ZINC001560678272 1060517691 /nfs/dbraw/zinc/51/76/91/1060517691.db2.gz XXWIWGNDOSIRRR-UHFFFAOYSA-N 1 2 304.459 4.081 20 0 DIADLO C[N@H+](C/C=C\c1cccc(F)c1)Cc1ccn(-c2ccccc2)n1 ZINC001560681816 1060523371 /nfs/dbraw/zinc/52/33/71/1060523371.db2.gz VTDHLLZQCXGKEU-VURMDHGXSA-N 1 2 321.399 4.157 20 0 DIADLO C[N@@H+](C/C=C\c1cccc(F)c1)Cc1ccn(-c2ccccc2)n1 ZINC001560681816 1060523390 /nfs/dbraw/zinc/52/33/90/1060523390.db2.gz VTDHLLZQCXGKEU-VURMDHGXSA-N 1 2 321.399 4.157 20 0 DIADLO Cc1[nH]nc(C[N@@H+]2CCC[C@H](CCCc3ccccc3)C2)c1C ZINC001560688987 1060535313 /nfs/dbraw/zinc/53/53/13/1060535313.db2.gz ABLVNXDPFHHLRX-IBGZPJMESA-N 1 2 311.473 4.261 20 0 DIADLO Cc1[nH]nc(C[N@H+]2CCC[C@H](CCCc3ccccc3)C2)c1C ZINC001560688987 1060535332 /nfs/dbraw/zinc/53/53/32/1060535332.db2.gz ABLVNXDPFHHLRX-IBGZPJMESA-N 1 2 311.473 4.261 20 0 DIADLO Fc1cccc(/C=C/C[N@@H+]2CCc3c(F)cc(F)cc3C2)c1 ZINC001560689006 1060536385 /nfs/dbraw/zinc/53/63/85/1060536385.db2.gz AJTTVPYVHKIDSV-DUXPYHPUSA-N 1 2 303.327 4.175 20 0 DIADLO Fc1cccc(/C=C/C[N@H+]2CCc3c(F)cc(F)cc3C2)c1 ZINC001560689006 1060536405 /nfs/dbraw/zinc/53/64/05/1060536405.db2.gz AJTTVPYVHKIDSV-DUXPYHPUSA-N 1 2 303.327 4.175 20 0 DIADLO C[C@@H]1[N@H+](CCCc2c(Cl)cccc2Cl)CCOC1(C)C ZINC001560687665 1060537240 /nfs/dbraw/zinc/53/72/40/1060537240.db2.gz NNVKYXZLHLMNHS-LBPRGKRZSA-N 1 2 316.272 4.425 20 0 DIADLO C[C@@H]1[N@@H+](CCCc2c(Cl)cccc2Cl)CCOC1(C)C ZINC001560687665 1060537268 /nfs/dbraw/zinc/53/72/68/1060537268.db2.gz NNVKYXZLHLMNHS-LBPRGKRZSA-N 1 2 316.272 4.425 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)ccn1 ZINC001250009966 1060538016 /nfs/dbraw/zinc/53/80/16/1060538016.db2.gz RCHVNCBMBJJEDR-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)ccn1 ZINC001250009966 1060538032 /nfs/dbraw/zinc/53/80/32/1060538032.db2.gz RCHVNCBMBJJEDR-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO COc1ccc([C@H](C)[C@@H](C)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC001560703971 1060561174 /nfs/dbraw/zinc/56/11/74/1060561174.db2.gz UCHUGCCNTMQHIJ-HZPDHXFCSA-N 1 2 321.424 4.485 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1c1ccccc1)C(=O)OC(C)(C)C ZINC001560712597 1060569951 /nfs/dbraw/zinc/56/99/51/1060569951.db2.gz OVKGTKKRRBAHOC-USXIJHARSA-N 1 2 303.446 4.033 20 0 DIADLO CCOc1cc(OC)ccc1C[N@H+](C)Cc1ccccc1Cl ZINC001250061215 1060575471 /nfs/dbraw/zinc/57/54/71/1060575471.db2.gz XCVXJZLMVBDOGM-UHFFFAOYSA-N 1 2 319.832 4.379 20 0 DIADLO CCOc1cc(OC)ccc1C[N@@H+](C)Cc1ccccc1Cl ZINC001250061215 1060575491 /nfs/dbraw/zinc/57/54/91/1060575491.db2.gz XCVXJZLMVBDOGM-UHFFFAOYSA-N 1 2 319.832 4.379 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2cn(-c3ccccc3C)nn2)cc1 ZINC001560717443 1060577193 /nfs/dbraw/zinc/57/71/93/1060577193.db2.gz MMSVYWBOSZEYJB-KRWDZBQOSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2cn(-c3ccccc3C)nn2)cc1 ZINC001560717443 1060577210 /nfs/dbraw/zinc/57/72/10/1060577210.db2.gz MMSVYWBOSZEYJB-KRWDZBQOSA-N 1 2 320.440 4.077 20 0 DIADLO COc1cc(Nc2c[nH+]c(C)cc2C)ccc1OC(F)(F)F ZINC001250079285 1060593264 /nfs/dbraw/zinc/59/32/64/1060593264.db2.gz DTFJSLQXEPUAPN-UHFFFAOYSA-N 1 2 312.291 4.349 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccccc2OC)C2CC2)c(F)c1 ZINC001560730141 1060597891 /nfs/dbraw/zinc/59/78/91/1060597891.db2.gz MGNHVZWCBNFHDL-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccccc2OC)C2CC2)c(F)c1 ZINC001560730141 1060597906 /nfs/dbraw/zinc/59/79/06/1060597906.db2.gz MGNHVZWCBNFHDL-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO CC(C)c1ccc(C[N@H+](Cc2cnn(C)c2Cl)C2CC2)cc1 ZINC001560730676 1060598816 /nfs/dbraw/zinc/59/88/16/1060598816.db2.gz AAMRJWJMTBLFNM-UHFFFAOYSA-N 1 2 317.864 4.362 20 0 DIADLO CC(C)c1ccc(C[N@@H+](Cc2cnn(C)c2Cl)C2CC2)cc1 ZINC001560730676 1060598829 /nfs/dbraw/zinc/59/88/29/1060598829.db2.gz AAMRJWJMTBLFNM-UHFFFAOYSA-N 1 2 317.864 4.362 20 0 DIADLO Nc1cc(C(F)(F)F)c(Cc2ccccc2C(F)(F)F)c[nH+]1 ZINC001250100166 1060606653 /nfs/dbraw/zinc/60/66/53/1060606653.db2.gz FZPMKGAFSCDVBR-UHFFFAOYSA-N 1 2 320.236 4.292 20 0 DIADLO CCCc1ccc(C[N@H+]([C@@H](CC)C(=O)OCC)C2CC2)s1 ZINC001560768070 1060632600 /nfs/dbraw/zinc/63/26/00/1060632600.db2.gz PUPSZHAVSHEZJQ-INIZCTEOSA-N 1 2 309.475 4.007 20 0 DIADLO CCCc1ccc(C[N@@H+]([C@@H](CC)C(=O)OCC)C2CC2)s1 ZINC001560768070 1060632606 /nfs/dbraw/zinc/63/26/06/1060632606.db2.gz PUPSZHAVSHEZJQ-INIZCTEOSA-N 1 2 309.475 4.007 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@@H+]2CCC[C@H](C(F)F)C2)c(F)c1 ZINC001250148375 1060645750 /nfs/dbraw/zinc/64/57/50/1060645750.db2.gz SMWADWFDNLOKPR-NSHDSACASA-N 1 2 319.342 4.229 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@H+]2CCC[C@H](C(F)F)C2)c(F)c1 ZINC001250148375 1060645755 /nfs/dbraw/zinc/64/57/55/1060645755.db2.gz SMWADWFDNLOKPR-NSHDSACASA-N 1 2 319.342 4.229 20 0 DIADLO Cc1cc(Br)c(OC(C)C)c(C[N@@H+]2CC[C@@H]2C)c1 ZINC001250155290 1060650018 /nfs/dbraw/zinc/65/00/18/1060650018.db2.gz MBSHJKBGCMXUMF-LBPRGKRZSA-N 1 2 312.251 4.139 20 0 DIADLO Cc1cc(Br)c(OC(C)C)c(C[N@H+]2CC[C@@H]2C)c1 ZINC001250155290 1060650023 /nfs/dbraw/zinc/65/00/23/1060650023.db2.gz MBSHJKBGCMXUMF-LBPRGKRZSA-N 1 2 312.251 4.139 20 0 DIADLO COC1(C[N@@H+]2CCn3c(cc4ccc(Cl)cc43)C2)CCCC1 ZINC001560796617 1060656327 /nfs/dbraw/zinc/65/63/27/1060656327.db2.gz FUYNNWYPOZYZRQ-UHFFFAOYSA-N 1 2 318.848 4.070 20 0 DIADLO COC1(C[N@H+]2CCn3c(cc4ccc(Cl)cc43)C2)CCCC1 ZINC001560796617 1060656331 /nfs/dbraw/zinc/65/63/31/1060656331.db2.gz FUYNNWYPOZYZRQ-UHFFFAOYSA-N 1 2 318.848 4.070 20 0 DIADLO CCCCCC[C@H](C)Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001560798370 1060659041 /nfs/dbraw/zinc/65/90/41/1060659041.db2.gz FOBFBGLKYFPAJM-YESZJQIVSA-N 1 2 319.493 4.466 20 0 DIADLO CCOc1cc(C)ccc1C[N@@H+]1CCc2ccc(C(C)=O)cc2C1 ZINC001250179899 1060662115 /nfs/dbraw/zinc/66/21/15/1060662115.db2.gz KIFNDSJDLKKXOY-UHFFFAOYSA-N 1 2 323.436 4.155 20 0 DIADLO CCOc1cc(C)ccc1C[N@H+]1CCc2ccc(C(C)=O)cc2C1 ZINC001250179899 1060662121 /nfs/dbraw/zinc/66/21/21/1060662121.db2.gz KIFNDSJDLKKXOY-UHFFFAOYSA-N 1 2 323.436 4.155 20 0 DIADLO CCOc1cc(C)ccc1C[N@H+](C)Cc1ccc(F)cc1F ZINC001250179981 1060662183 /nfs/dbraw/zinc/66/21/83/1060662183.db2.gz MDYXECOJEJLEPK-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CCOc1cc(C)ccc1C[N@@H+](C)Cc1ccc(F)cc1F ZINC001250179981 1060662188 /nfs/dbraw/zinc/66/21/88/1060662188.db2.gz MDYXECOJEJLEPK-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO COc1c(F)c(Cl)ccc1Nc1cccn2cc(C)[nH+]c12 ZINC001250188660 1060666106 /nfs/dbraw/zinc/66/61/06/1060666106.db2.gz DUWIDCPFZHPOOR-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO Clc1cc(Br)cc(C[NH+]2CC3(C2)CCCC3)c1 ZINC001560814627 1060674421 /nfs/dbraw/zinc/67/44/21/1060674421.db2.gz DAJWUPWOIMDDIE-UHFFFAOYSA-N 1 2 314.654 4.479 20 0 DIADLO FC(F)C[C@@H]1COCC[N@@H+]1Cc1ccc(C2CC2)c(C2CC2)c1 ZINC001560820529 1060679151 /nfs/dbraw/zinc/67/91/51/1060679151.db2.gz ULNLIZOOHXOYFE-MRXNPFEDSA-N 1 2 321.411 4.297 20 0 DIADLO FC(F)C[C@@H]1COCC[N@H+]1Cc1ccc(C2CC2)c(C2CC2)c1 ZINC001560820529 1060679160 /nfs/dbraw/zinc/67/91/60/1060679160.db2.gz ULNLIZOOHXOYFE-MRXNPFEDSA-N 1 2 321.411 4.297 20 0 DIADLO CN(C)c1ccc(F)cc1C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC001560827787 1060686585 /nfs/dbraw/zinc/68/65/85/1060686585.db2.gz YYQZBMGLOVPUNZ-GOSISDBHSA-N 1 2 318.823 4.492 20 0 DIADLO CN(C)c1ccc(F)cc1C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC001560827787 1060686592 /nfs/dbraw/zinc/68/65/92/1060686592.db2.gz YYQZBMGLOVPUNZ-GOSISDBHSA-N 1 2 318.823 4.492 20 0 DIADLO CC(C)Cc1ccc([C@H](C)[C@@H](C)[NH2+][C@@H](C)C(=O)OC(C)C)cc1 ZINC001560837749 1060695549 /nfs/dbraw/zinc/69/55/49/1060695549.db2.gz ANUBFEQAKNYEDC-ZACQAIPSSA-N 1 2 319.489 4.307 20 0 DIADLO FC(F)(F)Oc1cccc(Cc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001250222748 1060703176 /nfs/dbraw/zinc/70/31/76/1060703176.db2.gz WBTIYBDYQMFSGF-UHFFFAOYSA-N 1 2 322.330 4.171 20 0 DIADLO C[N@H+](C/C=C/c1ccc(F)cc1F)Cc1c(F)cccc1F ZINC001560846618 1060703602 /nfs/dbraw/zinc/70/36/02/1060703602.db2.gz BLPAPFDPESIBBT-ONEGZZNKSA-N 1 2 309.306 4.388 20 0 DIADLO C[N@@H+](C/C=C/c1ccc(F)cc1F)Cc1c(F)cccc1F ZINC001560846618 1060703620 /nfs/dbraw/zinc/70/36/20/1060703620.db2.gz BLPAPFDPESIBBT-ONEGZZNKSA-N 1 2 309.306 4.388 20 0 DIADLO CCOc1nccc(Nc2cc(Cl)c3[nH+]ccn3c2)c1Cl ZINC001250245197 1060725398 /nfs/dbraw/zinc/72/53/98/1060725398.db2.gz WJOZFMUDUDDNHB-UHFFFAOYSA-N 1 2 323.183 4.178 20 0 DIADLO c1ccc(COCCCCc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC001250252276 1060732101 /nfs/dbraw/zinc/73/21/01/1060732101.db2.gz BZXGDZBKCYFILZ-UHFFFAOYSA-N 1 2 310.441 4.221 20 0 DIADLO Cc1cc(F)c(C[NH+]2CC(Cc3ccc(F)c(F)c3)C2)c(F)c1 ZINC001560876485 1060735245 /nfs/dbraw/zinc/73/52/45/1060735245.db2.gz LYZFWYUXJQYIHY-UHFFFAOYSA-N 1 2 323.333 4.226 20 0 DIADLO COc1cc(Nc2cccc3[nH+]ccn32)c(F)c(F)c1Cl ZINC001250260388 1060738257 /nfs/dbraw/zinc/73/82/57/1060738257.db2.gz RLPOFFFETHYCBJ-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO COc1cccnc1C[NH2+][C@@H](C)c1ccc(-c2ccccc2)cn1 ZINC001560888113 1060751644 /nfs/dbraw/zinc/75/16/44/1060751644.db2.gz UPOVJNPBGOCKNX-HNNXBMFYSA-N 1 2 319.408 4.003 20 0 DIADLO Fc1cc(C[NH+]2CC3CC(C3)C2)c(Cl)c(C(F)(F)F)c1 ZINC001250281103 1060754518 /nfs/dbraw/zinc/75/45/18/1060754518.db2.gz OTUJSCSREJSBEW-UHFFFAOYSA-N 1 2 307.718 4.340 20 0 DIADLO C[C@H](CCc1ccc(F)cc1)Nc1ccc(N2CCCC2)c[nH+]1 ZINC001560897736 1060759875 /nfs/dbraw/zinc/75/98/75/1060759875.db2.gz LRRLUCGLEGDEDE-OAHLLOKOSA-N 1 2 313.420 4.254 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1c(C)cc(Cl)cc1C)C2 ZINC001560905890 1060768431 /nfs/dbraw/zinc/76/84/31/1060768431.db2.gz SSHBGRVWCUWVJE-UHFFFAOYSA-N 1 2 301.817 4.481 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1c(C)cc(Cl)cc1C)C2 ZINC001560905890 1060768440 /nfs/dbraw/zinc/76/84/40/1060768440.db2.gz SSHBGRVWCUWVJE-UHFFFAOYSA-N 1 2 301.817 4.481 20 0 DIADLO COc1ccc(F)c(Nc2cccn3cc(C)[nH+]c23)c1Cl ZINC001250304940 1060769676 /nfs/dbraw/zinc/76/96/76/1060769676.db2.gz DVNZRGYMTKOZHZ-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO CCOc1cc(C[N@H+](C)Cc2cccc(C)c2)c(Cl)cn1 ZINC001250303898 1060769840 /nfs/dbraw/zinc/76/98/40/1060769840.db2.gz VJDXIDUBEWMSPL-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCOc1cc(C[N@@H+](C)Cc2cccc(C)c2)c(Cl)cn1 ZINC001250303898 1060769856 /nfs/dbraw/zinc/76/98/56/1060769856.db2.gz VJDXIDUBEWMSPL-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO COc1ccc(F)c(Nc2ccccc2-n2cc[nH+]c2)c1Cl ZINC001250306508 1060771577 /nfs/dbraw/zinc/77/15/77/1060771577.db2.gz LNPJOJNEMSCLBV-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO COc1ccc(F)c(Nc2ccc(-n3cc[nH+]c3)cc2)c1Cl ZINC001250306721 1060772141 /nfs/dbraw/zinc/77/21/41/1060772141.db2.gz VABLBOJTFYQXBX-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO O=C1Cc2ccc(Nc3cc[nH+]c4cc(Cl)ccc34)cc2N1 ZINC001250313562 1060776372 /nfs/dbraw/zinc/77/63/72/1060776372.db2.gz JHAIZKAKPTWBMD-UHFFFAOYSA-N 1 2 309.756 4.126 20 0 DIADLO C[C@H](CSc1ccccc1)[N@H+](C)Cc1nc(Cl)cs1 ZINC001560920094 1060784297 /nfs/dbraw/zinc/78/42/97/1060784297.db2.gz WBDHXHPFEHHUID-LLVKDONJSA-N 1 2 312.891 4.409 20 0 DIADLO C[C@H](CSc1ccccc1)[N@@H+](C)Cc1nc(Cl)cs1 ZINC001560920094 1060784312 /nfs/dbraw/zinc/78/43/12/1060784312.db2.gz WBDHXHPFEHHUID-LLVKDONJSA-N 1 2 312.891 4.409 20 0 DIADLO CCOc1nccc(C[N@@H+]2CCc3ccc(C)cc3C2)c1Cl ZINC001250361211 1060788709 /nfs/dbraw/zinc/78/87/09/1060788709.db2.gz NLGHGNCSVWUAOD-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1nccc(C[N@H+]2CCc3ccc(C)cc3C2)c1Cl ZINC001250361211 1060788716 /nfs/dbraw/zinc/78/87/16/1060788716.db2.gz NLGHGNCSVWUAOD-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO C[C@H]1C[C@H](C[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)C[C@@H](C)C1 ZINC001560924568 1060789431 /nfs/dbraw/zinc/78/94/31/1060789431.db2.gz LUQHUVBNMHFCFT-HWMZRRJGSA-N 1 2 304.482 4.088 20 0 DIADLO C[C@@H]([NH2+][C@H](C)[C@H](C)c1ccc(Cl)cc1)C(=O)OC(C)(C)C ZINC001560926183 1060790281 /nfs/dbraw/zinc/79/02/81/1060790281.db2.gz GTNZINUPFKQWNY-YNEHKIRRSA-N 1 2 311.853 4.152 20 0 DIADLO CCCCO[C@H]1C[C@@H](Nc2c[nH+]cc3c2CCCC3)C1(C)C ZINC001560927477 1060790754 /nfs/dbraw/zinc/79/07/54/1060790754.db2.gz RIJUFHRSVZTVIH-MSOLQXFVSA-N 1 2 302.462 4.356 20 0 DIADLO C[C@@H]([NH2+][C@H]1CC[C@H](c2ccc(Cl)cc2)C1)C(=O)OC(C)(C)C ZINC001560926814 1060791460 /nfs/dbraw/zinc/79/14/60/1060791460.db2.gz ZAZOYCGNIBGQAB-INWMFGNUSA-N 1 2 323.864 4.296 20 0 DIADLO CCOc1nccc(C[N@H+](CC)Cc2cccs2)c1Cl ZINC001250384772 1060793392 /nfs/dbraw/zinc/79/33/92/1060793392.db2.gz APAQGNCBRFGMKN-UHFFFAOYSA-N 1 2 310.850 4.217 20 0 DIADLO CCOc1nccc(C[N@@H+](CC)Cc2cccs2)c1Cl ZINC001250384772 1060793402 /nfs/dbraw/zinc/79/34/02/1060793402.db2.gz APAQGNCBRFGMKN-UHFFFAOYSA-N 1 2 310.850 4.217 20 0 DIADLO CCOc1nccc(C[N@@H+]2Cc3ccccc3C[C@H]2C)c1Cl ZINC001250385926 1060793462 /nfs/dbraw/zinc/79/34/62/1060793462.db2.gz YWBRTJGZYWMARK-CYBMUJFWSA-N 1 2 316.832 4.081 20 0 DIADLO CCOc1nccc(C[N@H+]2Cc3ccccc3C[C@H]2C)c1Cl ZINC001250385926 1060793475 /nfs/dbraw/zinc/79/34/75/1060793475.db2.gz YWBRTJGZYWMARK-CYBMUJFWSA-N 1 2 316.832 4.081 20 0 DIADLO C[N@@H+](Cc1cc(O)c(Cl)c(F)c1F)CC1CCCCC1 ZINC001250410002 1060794814 /nfs/dbraw/zinc/79/48/14/1060794814.db2.gz DPZGWKZAZGPYRS-UHFFFAOYSA-N 1 2 303.780 4.336 20 0 DIADLO C[N@H+](Cc1cc(O)c(Cl)c(F)c1F)CC1CCCCC1 ZINC001250410002 1060794827 /nfs/dbraw/zinc/79/48/27/1060794827.db2.gz DPZGWKZAZGPYRS-UHFFFAOYSA-N 1 2 303.780 4.336 20 0 DIADLO CCCCn1c(CC2CCOCC2)[nH+]c2ccc(F)c(F)c21 ZINC001250431155 1060798824 /nfs/dbraw/zinc/79/88/24/1060798824.db2.gz FOZTVLHYRDQZKJ-UHFFFAOYSA-N 1 2 308.372 4.084 20 0 DIADLO c1ccc(COc2ccc3[nH]c(CC4CCOCC4)[nH+]c3c2)cc1 ZINC001250431805 1060800300 /nfs/dbraw/zinc/80/03/00/1060800300.db2.gz SLPNCHDFTGINLG-UHFFFAOYSA-N 1 2 322.408 4.111 20 0 DIADLO CSCCc1[nH+]c2cc(OCc3ccccc3)ccc2n1C ZINC001250426219 1060800585 /nfs/dbraw/zinc/80/05/85/1060800585.db2.gz LJCWLHYBBRZSOZ-UHFFFAOYSA-N 1 2 312.438 4.058 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cncc(Br)c2Cl)[C@@H](C)C1 ZINC001250464720 1060823082 /nfs/dbraw/zinc/82/30/82/1060823082.db2.gz JALFIIZOJCQWJT-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cncc(Br)c2Cl)[C@@H](C)C1 ZINC001250464720 1060823095 /nfs/dbraw/zinc/82/30/95/1060823095.db2.gz JALFIIZOJCQWJT-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1c(F)nccc1CNc1ccc(Nc2ccccc2)c[nH+]1 ZINC001560939856 1060802486 /nfs/dbraw/zinc/80/24/86/1060802486.db2.gz TXJUSCYVVSNZBD-UHFFFAOYSA-N 1 2 308.360 4.280 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(C3CC3)cc2)C[C@H](CC(F)(F)F)O1 ZINC001560941003 1060804155 /nfs/dbraw/zinc/80/41/55/1060804155.db2.gz BZQGOVFFSAKEJA-WBMJQRKESA-N 1 2 313.363 4.106 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(C3CC3)cc2)C[C@H](CC(F)(F)F)O1 ZINC001560941003 1060804169 /nfs/dbraw/zinc/80/41/69/1060804169.db2.gz BZQGOVFFSAKEJA-WBMJQRKESA-N 1 2 313.363 4.106 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(C3CC3)cc2)C[C@@H](CC(F)(F)F)O1 ZINC001560941000 1060804802 /nfs/dbraw/zinc/80/48/02/1060804802.db2.gz BZQGOVFFSAKEJA-BLLLJJGKSA-N 1 2 313.363 4.106 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(C3CC3)cc2)C[C@@H](CC(F)(F)F)O1 ZINC001560941000 1060804815 /nfs/dbraw/zinc/80/48/15/1060804815.db2.gz BZQGOVFFSAKEJA-BLLLJJGKSA-N 1 2 313.363 4.106 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[N@@H+]1CC[C@@H]2C[C@@H]2C1 ZINC001560942279 1060808094 /nfs/dbraw/zinc/80/80/94/1060808094.db2.gz LWNBKMDVIVZJFL-RKDXNWHRSA-N 1 2 318.617 4.083 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[N@H+]1CC[C@@H]2C[C@@H]2C1 ZINC001560942279 1060808098 /nfs/dbraw/zinc/80/80/98/1060808098.db2.gz LWNBKMDVIVZJFL-RKDXNWHRSA-N 1 2 318.617 4.083 20 0 DIADLO Fc1cc2[nH]c(-c3cccc(Cl)c3)nc2cc1-n1cc[nH+]c1 ZINC001250462417 1060820318 /nfs/dbraw/zinc/82/03/18/1060820318.db2.gz BBQCSDNVQDNQSL-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2cncc(Br)c2Cl)[C@H]1C ZINC001250464986 1060822129 /nfs/dbraw/zinc/82/21/29/1060822129.db2.gz PBXXLCBSMHWLAK-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2cncc(Br)c2Cl)[C@H]1C ZINC001250464986 1060822147 /nfs/dbraw/zinc/82/21/47/1060822147.db2.gz PBXXLCBSMHWLAK-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCCCC[N@@H+]1Cc1cncc(Br)c1Cl ZINC001250467547 1060826780 /nfs/dbraw/zinc/82/67/80/1060826780.db2.gz MEAQIWZUSCZPGF-JTQLQIEISA-N 1 2 317.658 4.262 20 0 DIADLO C[C@H]1CCCCC[N@H+]1Cc1cncc(Br)c1Cl ZINC001250467547 1060826789 /nfs/dbraw/zinc/82/67/89/1060826789.db2.gz MEAQIWZUSCZPGF-JTQLQIEISA-N 1 2 317.658 4.262 20 0 DIADLO CCSCc1ccc[nH+]c1N[C@H]1C[C@H](OC(C)C)C1(C)C ZINC001560982087 1060845780 /nfs/dbraw/zinc/84/57/80/1060845780.db2.gz POKSMSNRRDPLBB-GJZGRUSLSA-N 1 2 308.491 4.339 20 0 DIADLO COc1ccc(CCc2[nH]c3cc(Cl)c(OC)cc3[nH+]2)cc1 ZINC001250553499 1060890395 /nfs/dbraw/zinc/89/03/95/1060890395.db2.gz FTTXBGLEEWNBME-UHFFFAOYSA-N 1 2 316.788 4.019 20 0 DIADLO CCOc1ccc2[nH]c(C[C@@H](C)CCCC(C)(C)O)[nH+]c2c1 ZINC001250557060 1060895447 /nfs/dbraw/zinc/89/54/47/1060895447.db2.gz YCEMVCVOJPFTNM-ZDUSSCGKSA-N 1 2 304.434 4.081 20 0 DIADLO C[C@@H](CCCC(C)(C)O)Cc1[nH]c2cc3c(cc2[nH+]1)CCC3 ZINC001250556621 1060896356 /nfs/dbraw/zinc/89/63/56/1060896356.db2.gz OBVYOFNNXMEQTD-ZDUSSCGKSA-N 1 2 300.446 4.171 20 0 DIADLO CC[N@@H+](Cc1cc(C)oc1C)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC001561050896 1060899545 /nfs/dbraw/zinc/89/95/45/1060899545.db2.gz JPNJWYKOZQFNTJ-LBPRGKRZSA-N 1 2 318.486 4.500 20 0 DIADLO CC[N@H+](Cc1cc(C)oc1C)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC001561050896 1060899554 /nfs/dbraw/zinc/89/95/54/1060899554.db2.gz JPNJWYKOZQFNTJ-LBPRGKRZSA-N 1 2 318.486 4.500 20 0 DIADLO CCc1ccc2c(c1)CC[N@@H+](Cc1nc(-c3ccccc3)c[nH]1)C2 ZINC001561052999 1060901491 /nfs/dbraw/zinc/90/14/91/1060901491.db2.gz RCNWFHCNWKKLHK-UHFFFAOYSA-N 1 2 317.436 4.197 20 0 DIADLO CCc1ccc2c(c1)CC[N@H+](Cc1nc(-c3ccccc3)c[nH]1)C2 ZINC001561052999 1060901513 /nfs/dbraw/zinc/90/15/13/1060901513.db2.gz RCNWFHCNWKKLHK-UHFFFAOYSA-N 1 2 317.436 4.197 20 0 DIADLO Cc1cc(F)cc2[nH+]c([C@@H](C)Cc3ccc4c(c3)OCO4)[nH]c21 ZINC001250568141 1060905408 /nfs/dbraw/zinc/90/54/08/1060905408.db2.gz RTTZIUDJSBSPQA-NSHDSACASA-N 1 2 312.344 4.085 20 0 DIADLO COc1ccc2[nH]c(CCc3ccc(C(F)(F)F)cc3)[nH+]c2c1 ZINC001250576101 1060912414 /nfs/dbraw/zinc/91/24/14/1060912414.db2.gz ADOUIFKHFVLWMV-UHFFFAOYSA-N 1 2 320.314 4.376 20 0 DIADLO COc1ccc2[nH]c(CCc3ccccc3C(F)(F)F)[nH+]c2c1 ZINC001250583507 1060916939 /nfs/dbraw/zinc/91/69/39/1060916939.db2.gz KTONBYJYSMSBPC-UHFFFAOYSA-N 1 2 320.314 4.376 20 0 DIADLO COc1ccccc1CCc1[nH]c2cc(Cl)c(OC)cc2[nH+]1 ZINC001250583422 1060917286 /nfs/dbraw/zinc/91/72/86/1060917286.db2.gz FRGIBIMDFGJIEZ-UHFFFAOYSA-N 1 2 316.788 4.019 20 0 DIADLO c1ccc(N2CCC(c3[nH]c4cc5c(cc4[nH+]3)CCC5)CC2)cc1 ZINC001250585016 1060919571 /nfs/dbraw/zinc/91/95/71/1060919571.db2.gz WJCYHRFBYDKBGD-UHFFFAOYSA-N 1 2 317.436 4.436 20 0 DIADLO Cn1c(CCc2ccccc2Cl)[nH+]c2ccc(F)c(F)c21 ZINC001250586409 1060920487 /nfs/dbraw/zinc/92/04/87/1060920487.db2.gz RABQCTBQCWBZNW-UHFFFAOYSA-N 1 2 306.743 4.290 20 0 DIADLO FC(F)(F)c1cccc(Cc2[nH]c3cc4c(cc3[nH+]2)OCC4)c1 ZINC001250594207 1060925213 /nfs/dbraw/zinc/92/52/13/1060925213.db2.gz CFVYQBDJXJLFLY-UHFFFAOYSA-N 1 2 318.298 4.107 20 0 DIADLO COc1cc2[nH+]c(Cc3cccc(C(F)(F)F)c3)[nH]c2cc1F ZINC001250594765 1060928117 /nfs/dbraw/zinc/92/81/17/1060928117.db2.gz SSJCXBFMGQCYMD-UHFFFAOYSA-N 1 2 324.277 4.320 20 0 DIADLO CCC[C@@]1(C)CCC[N@@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001473191247 1060944834 /nfs/dbraw/zinc/94/48/34/1060944834.db2.gz KFWLMVYGDAJZMM-WMZOPIPTSA-N 1 2 323.864 4.456 20 0 DIADLO CCC[C@@]1(C)CCC[N@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001473191247 1060944857 /nfs/dbraw/zinc/94/48/57/1060944857.db2.gz KFWLMVYGDAJZMM-WMZOPIPTSA-N 1 2 323.864 4.456 20 0 DIADLO c1nc(C[N@@H+]2CCCC3(C2)CCCCCC3)nn1-c1ccccc1 ZINC001473200666 1060959180 /nfs/dbraw/zinc/95/91/80/1060959180.db2.gz GPXVUOVRDWOTJM-UHFFFAOYSA-N 1 2 324.472 4.204 20 0 DIADLO c1nc(C[N@H+]2CCCC3(C2)CCCCCC3)nn1-c1ccccc1 ZINC001473200666 1060959201 /nfs/dbraw/zinc/95/92/01/1060959201.db2.gz GPXVUOVRDWOTJM-UHFFFAOYSA-N 1 2 324.472 4.204 20 0 DIADLO CC[N@H+](Cc1ccoc1C)Cc1ccccc1Br ZINC001462143983 1060964266 /nfs/dbraw/zinc/96/42/66/1060964266.db2.gz JZAXQKKDWOXYSS-UHFFFAOYSA-N 1 2 308.219 4.373 20 0 DIADLO CC[N@@H+](Cc1ccoc1C)Cc1ccccc1Br ZINC001462143983 1060964283 /nfs/dbraw/zinc/96/42/83/1060964283.db2.gz JZAXQKKDWOXYSS-UHFFFAOYSA-N 1 2 308.219 4.373 20 0 DIADLO Fc1ccc2c(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)c[nH]c2c1 ZINC001250635860 1060969056 /nfs/dbraw/zinc/96/90/56/1060969056.db2.gz CGXDNYJASQZEDH-UHFFFAOYSA-N 1 2 320.371 4.451 20 0 DIADLO COc1ccc2c(c1)OCC[N@@H+](Cc1cccc(Cl)c1C)C2 ZINC001462149407 1060970299 /nfs/dbraw/zinc/97/02/99/1060970299.db2.gz SBSJHESODVCFRD-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO COc1ccc2c(c1)OCC[N@H+](Cc1cccc(Cl)c1C)C2 ZINC001462149407 1060970316 /nfs/dbraw/zinc/97/03/16/1060970316.db2.gz SBSJHESODVCFRD-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO CC1(C)C[C@@H](C[N@@H+](Cc2ccccc2)CC(F)F)C(C)(C)O1 ZINC001473209645 1060973458 /nfs/dbraw/zinc/97/34/58/1060973458.db2.gz ARGKDEGHJLVRDN-HNNXBMFYSA-N 1 2 311.416 4.347 20 0 DIADLO CC1(C)C[C@@H](C[N@H+](Cc2ccccc2)CC(F)F)C(C)(C)O1 ZINC001473209645 1060973480 /nfs/dbraw/zinc/97/34/80/1060973480.db2.gz ARGKDEGHJLVRDN-HNNXBMFYSA-N 1 2 311.416 4.347 20 0 DIADLO COc1c(C)c[nH+]c(CN2CCCCCc3ccccc32)c1C ZINC001473241373 1061020335 /nfs/dbraw/zinc/02/03/35/1061020335.db2.gz CANYPBWOKRUFSX-UHFFFAOYSA-N 1 2 310.441 4.440 20 0 DIADLO CN(C)c1cccc(C[N@H+](C)Cc2cccc(Cl)c2Cl)n1 ZINC001473254832 1061030002 /nfs/dbraw/zinc/03/00/02/1061030002.db2.gz AMUYEQYUEBIABP-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1cccc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)n1 ZINC001473254832 1061030017 /nfs/dbraw/zinc/03/00/17/1061030017.db2.gz AMUYEQYUEBIABP-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(CCCn1cc[nH+]c1)c1ccc(Oc2ccccc2)cc1 ZINC001473270149 1061043174 /nfs/dbraw/zinc/04/31/74/1061043174.db2.gz OEVPUCUASNACEM-UHFFFAOYSA-N 1 2 307.397 4.202 20 0 DIADLO Fc1cc2[nH]c(-c3cc4ccccc4o3)nc2cc1-n1cc[nH+]c1 ZINC001250748840 1061054987 /nfs/dbraw/zinc/05/49/87/1061054987.db2.gz MWUSILZPWJYPQY-UHFFFAOYSA-N 1 2 318.311 4.301 20 0 DIADLO Cn1ccc2ccc(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)cc21 ZINC001250756062 1061057209 /nfs/dbraw/zinc/05/72/09/1061057209.db2.gz IBVJPIKIPJHVAG-UHFFFAOYSA-N 1 2 316.408 4.322 20 0 DIADLO Cn1ccc2cc(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)ccc21 ZINC001250757213 1061057400 /nfs/dbraw/zinc/05/74/00/1061057400.db2.gz CPGXESPCHYYUGS-UHFFFAOYSA-N 1 2 316.408 4.322 20 0 DIADLO Cc1conc1C[N@H+](Cc1ccccc1F)C1CCCCC1 ZINC001473287462 1061059896 /nfs/dbraw/zinc/05/98/96/1061059896.db2.gz UNVREMWCITZWJN-UHFFFAOYSA-N 1 2 302.393 4.457 20 0 DIADLO Cc1conc1C[N@@H+](Cc1ccccc1F)C1CCCCC1 ZINC001473287462 1061059900 /nfs/dbraw/zinc/05/99/00/1061059900.db2.gz UNVREMWCITZWJN-UHFFFAOYSA-N 1 2 302.393 4.457 20 0 DIADLO CSc1ccc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3)nc2c1 ZINC001250771924 1061061726 /nfs/dbraw/zinc/06/17/26/1061061726.db2.gz IFXWFNAXVJHMSP-UHFFFAOYSA-N 1 2 306.394 4.138 20 0 DIADLO COc1cc(Cl)cc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3)nc21 ZINC001250771707 1061063217 /nfs/dbraw/zinc/06/32/17/1061063217.db2.gz AAJSWFVGADLQMC-UHFFFAOYSA-N 1 2 324.771 4.078 20 0 DIADLO CCCc1cccc(C[N@@H+]2C[C@@H](C(F)(F)F)OC(C)(C)C2)c1 ZINC001462274080 1061069506 /nfs/dbraw/zinc/06/95/06/1061069506.db2.gz STBIFDMENAPDBL-HNNXBMFYSA-N 1 2 315.379 4.181 20 0 DIADLO CCCc1cccc(C[N@H+]2C[C@@H](C(F)(F)F)OC(C)(C)C2)c1 ZINC001462274080 1061069514 /nfs/dbraw/zinc/06/95/14/1061069514.db2.gz STBIFDMENAPDBL-HNNXBMFYSA-N 1 2 315.379 4.181 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(C(F)(F)F)ccc2Br)[C@H]1C ZINC001462280039 1061074855 /nfs/dbraw/zinc/07/48/55/1061074855.db2.gz DOMDGDVERYYDRR-IUCAKERBSA-N 1 2 322.168 4.308 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(C(F)(F)F)ccc2Br)[C@H]1C ZINC001462280039 1061074869 /nfs/dbraw/zinc/07/48/69/1061074869.db2.gz DOMDGDVERYYDRR-IUCAKERBSA-N 1 2 322.168 4.308 20 0 DIADLO Cc1cccc(C2=CC[N@H+](Cc3scnc3Cl)CC2)c1 ZINC001473310708 1061076047 /nfs/dbraw/zinc/07/60/47/1061076047.db2.gz RZVAWJSXVBCUBO-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO Cc1cccc(C2=CC[N@@H+](Cc3scnc3Cl)CC2)c1 ZINC001473310708 1061076055 /nfs/dbraw/zinc/07/60/55/1061076055.db2.gz RZVAWJSXVBCUBO-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO COc1cc2c(cc1Cl)C[N@H+](Cc1cccc(C)c1F)CC2 ZINC001462282744 1061077235 /nfs/dbraw/zinc/07/72/35/1061077235.db2.gz IHBRHUWDLPOMQM-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO COc1cc2c(cc1Cl)C[N@@H+](Cc1cccc(C)c1F)CC2 ZINC001462282744 1061077249 /nfs/dbraw/zinc/07/72/49/1061077249.db2.gz IHBRHUWDLPOMQM-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO C[C@H]1CN(c2cccc(F)c2)CC[N@@H+]1Cc1cscc1Cl ZINC001462298390 1061089610 /nfs/dbraw/zinc/08/96/10/1061089610.db2.gz RYHLYRDDDQUEFH-LBPRGKRZSA-N 1 2 324.852 4.251 20 0 DIADLO C[C@H]1CN(c2cccc(F)c2)CC[N@H+]1Cc1cscc1Cl ZINC001462298390 1061089625 /nfs/dbraw/zinc/08/96/25/1061089625.db2.gz RYHLYRDDDQUEFH-LBPRGKRZSA-N 1 2 324.852 4.251 20 0 DIADLO c1cc2cnccc2c(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c1 ZINC001250844679 1061092833 /nfs/dbraw/zinc/09/28/33/1061092833.db2.gz PAHPWTYAXSDXNO-UHFFFAOYSA-N 1 2 314.392 4.378 20 0 DIADLO Cc1cc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c(C)cc1O ZINC001250849558 1061094643 /nfs/dbraw/zinc/09/46/43/1061094643.db2.gz FBAVEMHFXKQHCI-UHFFFAOYSA-N 1 2 307.397 4.153 20 0 DIADLO COc1cc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)ccc1C ZINC001250846679 1061095157 /nfs/dbraw/zinc/09/51/57/1061095157.db2.gz BQUQZRZVCPCRMS-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO CCCCC[C@H]([NH2+]Cc1nc(CC2CC2)no1)c1ccccc1 ZINC001473340895 1061099442 /nfs/dbraw/zinc/09/94/42/1061099442.db2.gz NJLYQPVOSKVKEF-KRWDZBQOSA-N 1 2 313.445 4.433 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccc(-c4ccccn4)cc3)[nH+]c2c1 ZINC001250867386 1061102948 /nfs/dbraw/zinc/10/29/48/1061102948.db2.gz LRPRMDOVHQJVAV-UHFFFAOYSA-N 1 2 314.392 4.358 20 0 DIADLO CCC1(CC)C[NH+](Cc2cc(F)ccc2Br)C1 ZINC001462317959 1061103296 /nfs/dbraw/zinc/10/32/96/1061103296.db2.gz WWBZUNFEZLEWDY-UHFFFAOYSA-N 1 2 300.215 4.210 20 0 DIADLO Cc1ccc(F)cc1-c1nc2cc(-n3cc[nH+]c3)c(F)cc2[nH]1 ZINC001250887185 1061109469 /nfs/dbraw/zinc/10/94/69/1061109469.db2.gz INDVJDXDVPCQPD-UHFFFAOYSA-N 1 2 310.307 4.002 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@H](C)C(C)(C)C1 ZINC001473364693 1061113134 /nfs/dbraw/zinc/11/31/34/1061113134.db2.gz CIXLARLHBXWWNU-CZUORRHYSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CC[C@@H](C)C(C)(C)C1 ZINC001473364693 1061113141 /nfs/dbraw/zinc/11/31/41/1061113141.db2.gz CIXLARLHBXWWNU-CZUORRHYSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@H](C)C(C)(C)C1 ZINC001473364691 1061113159 /nfs/dbraw/zinc/11/31/59/1061113159.db2.gz CIXLARLHBXWWNU-BBRMVZONSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@H](C)C(C)(C)C1 ZINC001473364691 1061113165 /nfs/dbraw/zinc/11/31/65/1061113165.db2.gz CIXLARLHBXWWNU-BBRMVZONSA-N 1 2 323.864 4.312 20 0 DIADLO C[C@@H]1CC(C)(C)C[N@H+]1Cc1c(F)cc(Br)cc1F ZINC001462351334 1061124395 /nfs/dbraw/zinc/12/43/95/1061124395.db2.gz SQKAVBQSTJCQKV-SECBINFHSA-N 1 2 318.205 4.348 20 0 DIADLO Clc1ccc2c(cc3n2CC[N@H+](CCc2cccs2)C3)c1 ZINC001473382087 1061124298 /nfs/dbraw/zinc/12/42/98/1061124298.db2.gz UAQYHJCRXAXLCO-UHFFFAOYSA-N 1 2 316.857 4.415 20 0 DIADLO Clc1ccc2c(cc3n2CC[N@@H+](CCc2cccs2)C3)c1 ZINC001473382087 1061124308 /nfs/dbraw/zinc/12/43/08/1061124308.db2.gz UAQYHJCRXAXLCO-UHFFFAOYSA-N 1 2 316.857 4.415 20 0 DIADLO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1c(F)cc(Br)cc1F ZINC001462351334 1061124391 /nfs/dbraw/zinc/12/43/91/1061124391.db2.gz SQKAVBQSTJCQKV-SECBINFHSA-N 1 2 318.205 4.348 20 0 DIADLO Fc1cccc(F)c1C[N@H+](C[C@H]1CCC2(CCCC2)O1)C1CC1 ZINC001473380562 1061124781 /nfs/dbraw/zinc/12/47/81/1061124781.db2.gz KGIMSGNICVHEFN-OAHLLOKOSA-N 1 2 321.411 4.421 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](C[C@H]1CCC2(CCCC2)O1)C1CC1 ZINC001473380562 1061124785 /nfs/dbraw/zinc/12/47/85/1061124785.db2.gz KGIMSGNICVHEFN-OAHLLOKOSA-N 1 2 321.411 4.421 20 0 DIADLO C[C@@H]1C[NH+](Cc2ccc(C3CCCCC3)cc2)C[C@@H](C)S1=O ZINC001473383159 1061124895 /nfs/dbraw/zinc/12/48/95/1061124895.db2.gz CPSMWHPMNADVOZ-HZPDHXFCSA-N 1 2 319.514 4.076 20 0 DIADLO CCOc1cc(C[N@H+](CC)Cc2occc2C)c(F)cc1OC ZINC001462358663 1061125997 /nfs/dbraw/zinc/12/59/97/1061125997.db2.gz YREDYORQKPJBTQ-UHFFFAOYSA-N 1 2 321.392 4.157 20 0 DIADLO CCOc1cc(C[N@@H+](CC)Cc2occc2C)c(F)cc1OC ZINC001462358663 1061126003 /nfs/dbraw/zinc/12/60/03/1061126003.db2.gz YREDYORQKPJBTQ-UHFFFAOYSA-N 1 2 321.392 4.157 20 0 DIADLO CCc1ccc([C@@H]2C[N@H+](Cc3ccc(Cl)cc3)CCO2)cc1 ZINC001473384191 1061127433 /nfs/dbraw/zinc/12/74/33/1061127433.db2.gz KFIAIMMLWVJVSN-IBGZPJMESA-N 1 2 315.844 4.476 20 0 DIADLO CCc1ccc([C@@H]2C[N@@H+](Cc3ccc(Cl)cc3)CCO2)cc1 ZINC001473384191 1061127440 /nfs/dbraw/zinc/12/74/40/1061127440.db2.gz KFIAIMMLWVJVSN-IBGZPJMESA-N 1 2 315.844 4.476 20 0 DIADLO Fc1cc2[nH]c(-c3ccn4cc[nH+]c4c3)nc2c(C(F)(F)F)c1 ZINC001250927766 1061128854 /nfs/dbraw/zinc/12/88/54/1061128854.db2.gz IUCZVABVHPOSSX-UHFFFAOYSA-N 1 2 320.249 4.036 20 0 DIADLO CC[C@]1(C)C[N@@H+]([C@@H](C)c2ccccc2Br)CCO1 ZINC001473389179 1061130241 /nfs/dbraw/zinc/13/02/41/1061130241.db2.gz KLHGGWJDXWFYOK-SWLSCSKDSA-N 1 2 312.251 4.011 20 0 DIADLO CC[C@]1(C)C[N@H+]([C@@H](C)c2ccccc2Br)CCO1 ZINC001473389179 1061130246 /nfs/dbraw/zinc/13/02/46/1061130246.db2.gz KLHGGWJDXWFYOK-SWLSCSKDSA-N 1 2 312.251 4.011 20 0 DIADLO Oc1ccc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)c(F)c1F ZINC001462371165 1061133818 /nfs/dbraw/zinc/13/38/18/1061133818.db2.gz YWSPMGDVOSQUAQ-UHFFFAOYSA-N 1 2 309.743 4.103 20 0 DIADLO CCn1c2cc(C)ccc2nc1-c1cccc(-n2cc[nH+]c2)c1 ZINC001250939992 1061137009 /nfs/dbraw/zinc/13/70/09/1061137009.db2.gz BVBYBIQVDIQWFH-UHFFFAOYSA-N 1 2 302.381 4.217 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(C(F)(F)F)s2)CC2(CCCC2)O1 ZINC001462405299 1061152148 /nfs/dbraw/zinc/15/21/48/1061152148.db2.gz NRTKFKWVZDOIDV-LLVKDONJSA-N 1 2 319.392 4.300 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(C(F)(F)F)s2)CC2(CCCC2)O1 ZINC001462405299 1061152152 /nfs/dbraw/zinc/15/21/52/1061152152.db2.gz NRTKFKWVZDOIDV-LLVKDONJSA-N 1 2 319.392 4.300 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3cccc(-c4ccccn4)c3)[nH+]c2c1 ZINC001250967927 1061153828 /nfs/dbraw/zinc/15/38/28/1061153828.db2.gz JLMZIXIOMPIBQB-UHFFFAOYSA-N 1 2 314.392 4.358 20 0 DIADLO Clc1cc2nc(-c3ccc4[nH+]ccn4c3)[nH]c2cc1Cl ZINC001250978719 1061157279 /nfs/dbraw/zinc/15/72/79/1061157279.db2.gz QPNULVZRJCXQPY-UHFFFAOYSA-N 1 2 303.152 4.184 20 0 DIADLO Clc1ccc2c(c1)nc(-c1ccc3[nH+]ccn3c1)n2C1CC1 ZINC001250979316 1061157725 /nfs/dbraw/zinc/15/77/25/1061157725.db2.gz WYAFSQNGOPRLOP-UHFFFAOYSA-N 1 2 308.772 4.339 20 0 DIADLO Cc1ccc(-c2nc3cc(Cl)ccc3n2CC(C)C)c(N)[nH+]1 ZINC001250981886 1061160667 /nfs/dbraw/zinc/16/06/67/1061160667.db2.gz LOLKUQKIHOXOHH-UHFFFAOYSA-N 1 2 314.820 4.298 20 0 DIADLO C[C@@H]1CCSCC[N@@H+]1Cc1ccc(Cl)nc1C(F)(F)F ZINC001473445558 1061163716 /nfs/dbraw/zinc/16/37/16/1061163716.db2.gz PMFRIQRWHHTTSF-SECBINFHSA-N 1 2 324.799 4.081 20 0 DIADLO C[C@@H]1CCSCC[N@H+]1Cc1ccc(Cl)nc1C(F)(F)F ZINC001473445558 1061163724 /nfs/dbraw/zinc/16/37/24/1061163724.db2.gz PMFRIQRWHHTTSF-SECBINFHSA-N 1 2 324.799 4.081 20 0 DIADLO C[C@@H]1CO[C@H](C(F)(F)F)C[N@@H+]1CCc1ccc2ccccc2c1 ZINC001473460961 1061172799 /nfs/dbraw/zinc/17/27/99/1061172799.db2.gz JKRFWECWLYDBBZ-DYVFJYSZSA-N 1 2 323.358 4.034 20 0 DIADLO C[C@@H]1CO[C@H](C(F)(F)F)C[N@H+]1CCc1ccc2ccccc2c1 ZINC001473460961 1061172803 /nfs/dbraw/zinc/17/28/03/1061172803.db2.gz JKRFWECWLYDBBZ-DYVFJYSZSA-N 1 2 323.358 4.034 20 0 DIADLO Brc1scnc1C[NH+]1CCCCCCCC1 ZINC001473479745 1061182133 /nfs/dbraw/zinc/18/21/33/1061182133.db2.gz XMZXTFLVURZCJO-UHFFFAOYSA-N 1 2 303.269 4.062 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3cc(F)c(F)cc3Cl)[nH+]c2c1 ZINC001251011152 1061183237 /nfs/dbraw/zinc/18/32/37/1061183237.db2.gz YDWDYFCZLLSKGW-UHFFFAOYSA-N 1 2 307.731 4.228 20 0 DIADLO COc1nc(C)cc(C)c1C[N@H+](C)Cc1cc(Cl)cs1 ZINC001462463799 1061190395 /nfs/dbraw/zinc/19/03/95/1061190395.db2.gz WIHHYFYZOCOTBH-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COc1nc(C)cc(C)c1C[N@@H+](C)Cc1cc(Cl)cs1 ZINC001462463799 1061190404 /nfs/dbraw/zinc/19/04/04/1061190404.db2.gz WIHHYFYZOCOTBH-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@@H+]1C[C@H](C(F)(F)F)OC(C)(C)C1 ZINC001473496321 1061190468 /nfs/dbraw/zinc/19/04/68/1061190468.db2.gz BUJGXWKRQKGCJZ-UONOGXRCSA-N 1 2 319.342 4.319 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@H+]1C[C@H](C(F)(F)F)OC(C)(C)C1 ZINC001473496321 1061190475 /nfs/dbraw/zinc/19/04/75/1061190475.db2.gz BUJGXWKRQKGCJZ-UONOGXRCSA-N 1 2 319.342 4.319 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@@H+]1C[C@@H](C(F)(F)F)OC(C)(C)C1 ZINC001473496319 1061191280 /nfs/dbraw/zinc/19/12/80/1061191280.db2.gz BUJGXWKRQKGCJZ-KBPBESRZSA-N 1 2 319.342 4.319 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@H+]1C[C@@H](C(F)(F)F)OC(C)(C)C1 ZINC001473496319 1061191288 /nfs/dbraw/zinc/19/12/88/1061191288.db2.gz BUJGXWKRQKGCJZ-KBPBESRZSA-N 1 2 319.342 4.319 20 0 DIADLO Cc1cc(C)c(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c(O)c1 ZINC001251048678 1061200950 /nfs/dbraw/zinc/20/09/50/1061200950.db2.gz VBUJAOOHMARLBO-UHFFFAOYSA-N 1 2 307.397 4.153 20 0 DIADLO CC(C)C[C@H](C)[NH2+]c1ccc(N2CCOC[C@H]2C)c(Cl)c1 ZINC001462483004 1061202839 /nfs/dbraw/zinc/20/28/39/1061202839.db2.gz UBQFWYRWNRNKMQ-UONOGXRCSA-N 1 2 310.869 4.412 20 0 DIADLO FC1(F)CCCC[C@@H]1C[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC001473510678 1061204637 /nfs/dbraw/zinc/20/46/37/1061204637.db2.gz GYHBSSOPWRTAQI-OAHLLOKOSA-N 1 2 304.384 4.282 20 0 DIADLO FC1(F)CCCC[C@@H]1C[N@H+]1CCn2c(cc3ccccc32)C1 ZINC001473510678 1061204649 /nfs/dbraw/zinc/20/46/49/1061204649.db2.gz GYHBSSOPWRTAQI-OAHLLOKOSA-N 1 2 304.384 4.282 20 0 DIADLO FC1(F)CCCC[C@H]1C[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC001473510668 1061205533 /nfs/dbraw/zinc/20/55/33/1061205533.db2.gz GYHBSSOPWRTAQI-HNNXBMFYSA-N 1 2 304.384 4.282 20 0 DIADLO FC1(F)CCCC[C@H]1C[N@H+]1CCn2c(cc3ccccc32)C1 ZINC001473510668 1061205554 /nfs/dbraw/zinc/20/55/54/1061205554.db2.gz GYHBSSOPWRTAQI-HNNXBMFYSA-N 1 2 304.384 4.282 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(C(F)(F)F)c2)Cc2ccccc2O1 ZINC001473514001 1061208162 /nfs/dbraw/zinc/20/81/62/1061208162.db2.gz KZYMCYDCYFCXBU-CYBMUJFWSA-N 1 2 321.342 4.489 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2)Cc2ccccc2O1 ZINC001473514001 1061208183 /nfs/dbraw/zinc/20/81/83/1061208183.db2.gz KZYMCYDCYFCXBU-CYBMUJFWSA-N 1 2 321.342 4.489 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)/C=C3/CC[C@@H](C)C3)cc2)[nH+]c1C ZINC001455244740 1061214235 /nfs/dbraw/zinc/21/42/35/1061214235.db2.gz ALIYUMROTZTJBQ-QJMZJAKPSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C=C3CC[C@@H](C)C3)cc2)[nH+]c1C ZINC001455244740 1061214253 /nfs/dbraw/zinc/21/42/53/1061214253.db2.gz ALIYUMROTZTJBQ-QJMZJAKPSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)n2cc[nH+]c2)cc1-c1ccsc1 ZINC001455465852 1061223514 /nfs/dbraw/zinc/22/35/14/1061223514.db2.gz VEYNTMOTKQAHJN-CYBMUJFWSA-N 1 2 311.410 4.120 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1nc2cc(Cl)ccc2n1CC(C)C ZINC001251091553 1061233005 /nfs/dbraw/zinc/23/30/05/1061233005.db2.gz HPIKMBBXJKALPG-UHFFFAOYSA-N 1 2 314.820 4.298 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)/C=C/C2CCCCCC2)[nH+]c1C ZINC001455773794 1061234063 /nfs/dbraw/zinc/23/40/63/1061234063.db2.gz SAKRPCMDPUFORV-FLVLSHQESA-N 1 2 315.461 4.217 20 0 DIADLO Clc1cc(C[N@@H+]2CCSC[C@H]2C2CCC2)cc(Cl)n1 ZINC001473567965 1061259443 /nfs/dbraw/zinc/25/94/43/1061259443.db2.gz BSLOQMIOCSNQOQ-LBPRGKRZSA-N 1 2 317.285 4.106 20 0 DIADLO Clc1cc(C[N@H+]2CCSC[C@H]2C2CCC2)cc(Cl)n1 ZINC001473567965 1061259462 /nfs/dbraw/zinc/25/94/62/1061259462.db2.gz BSLOQMIOCSNQOQ-LBPRGKRZSA-N 1 2 317.285 4.106 20 0 DIADLO CC(C)(C)OC(=O)CC[C@H]1CCCC[N@@H+]1C/C(Cl)=C\Cl ZINC001473575223 1061263625 /nfs/dbraw/zinc/26/36/25/1061263625.db2.gz OFRFAWJBVZVOJN-RSKUSDAESA-N 1 2 322.276 4.282 20 0 DIADLO CC(C)(C)OC(=O)CC[C@H]1CCCC[N@H+]1C/C(Cl)=C\Cl ZINC001473575223 1061263641 /nfs/dbraw/zinc/26/36/41/1061263641.db2.gz OFRFAWJBVZVOJN-RSKUSDAESA-N 1 2 322.276 4.282 20 0 DIADLO C[C@H]1[C@H](c2cccc(F)c2)OCC[N@@H+]1CCCC(C)(F)F ZINC001473580313 1061268314 /nfs/dbraw/zinc/26/83/14/1061268314.db2.gz ONGKLLUEJYGFJC-SWLSCSKDSA-N 1 2 301.352 4.023 20 0 DIADLO C[C@H]1[C@H](c2cccc(F)c2)OCC[N@H+]1CCCC(C)(F)F ZINC001473580313 1061268333 /nfs/dbraw/zinc/26/83/33/1061268333.db2.gz ONGKLLUEJYGFJC-SWLSCSKDSA-N 1 2 301.352 4.023 20 0 DIADLO COC(=O)[C@@H]([NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1)c1cccc2ccccc21 ZINC001462590667 1061283395 /nfs/dbraw/zinc/28/33/95/1061283395.db2.gz XIMZJDYJXBPYEL-MQJTVSLUSA-N 1 2 323.436 4.222 20 0 DIADLO CCCC[N@@H+](Cc1c(C)oc(C)c1C)Cc1c(Cl)cnn1C ZINC001462602956 1061291203 /nfs/dbraw/zinc/29/12/03/1061291203.db2.gz MBUPOFACUPFRNK-UHFFFAOYSA-N 1 2 323.868 4.394 20 0 DIADLO CCCC[N@H+](Cc1c(C)oc(C)c1C)Cc1c(Cl)cnn1C ZINC001462602956 1061291221 /nfs/dbraw/zinc/29/12/21/1061291221.db2.gz MBUPOFACUPFRNK-UHFFFAOYSA-N 1 2 323.868 4.394 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3csc(C(F)(F)F)c3)[nH+]c2c1 ZINC001251284751 1061302692 /nfs/dbraw/zinc/30/26/92/1061302692.db2.gz ONWWJNORRSVNFZ-UHFFFAOYSA-N 1 2 311.332 4.376 20 0 DIADLO C[C@]1(C2CC2)C[N@H+](CCc2cccc(Cl)c2Cl)CCO1 ZINC001473638365 1061311622 /nfs/dbraw/zinc/31/16/22/1061311622.db2.gz TUUVSFMYULFMIQ-MRXNPFEDSA-N 1 2 314.256 4.037 20 0 DIADLO C[C@]1(C2CC2)C[N@@H+](CCc2cccc(Cl)c2Cl)CCO1 ZINC001473638365 1061311632 /nfs/dbraw/zinc/31/16/32/1061311632.db2.gz TUUVSFMYULFMIQ-MRXNPFEDSA-N 1 2 314.256 4.037 20 0 DIADLO CCCCn1c2cc(F)ccc2nc1-c1cccc2[nH+]ccn21 ZINC001251326634 1061317082 /nfs/dbraw/zinc/31/70/82/1061317082.db2.gz QFUAJSUKAMFDNE-UHFFFAOYSA-N 1 2 308.360 4.290 20 0 DIADLO Cc1cc(CNC(=O)N[C@@H]2CCCCC23CCCC3)cc(C)[nH+]1 ZINC001251336469 1061321298 /nfs/dbraw/zinc/32/12/98/1061321298.db2.gz BURRNBHVPXYRQO-QGZVFWFLSA-N 1 2 315.461 4.001 20 0 DIADLO Fc1cccc(/C=C/C[N@@H+]2CCc3cc(F)cc(F)c3C2)c1 ZINC001462676129 1061334370 /nfs/dbraw/zinc/33/43/70/1061334370.db2.gz VXDCNFDDEZNHDI-DUXPYHPUSA-N 1 2 303.327 4.175 20 0 DIADLO Fc1cccc(/C=C/C[N@H+]2CCc3cc(F)cc(F)c3C2)c1 ZINC001462676129 1061334392 /nfs/dbraw/zinc/33/43/92/1061334392.db2.gz VXDCNFDDEZNHDI-DUXPYHPUSA-N 1 2 303.327 4.175 20 0 DIADLO Clc1csc(CNc2[nH+]c3ccccc3n2CC2CC2)n1 ZINC001462679493 1061335031 /nfs/dbraw/zinc/33/50/31/1061335031.db2.gz ASWIQXWMCKTLNR-UHFFFAOYSA-N 1 2 318.833 4.168 20 0 DIADLO COc1nc(C)cc(C)c1C[N@H+](C)[C@H](C)c1ccc(F)cc1F ZINC001473675058 1061336799 /nfs/dbraw/zinc/33/67/99/1061336799.db2.gz SDZJZZIQPJDTHO-CYBMUJFWSA-N 1 2 320.383 4.178 20 0 DIADLO COc1nc(C)cc(C)c1C[N@@H+](C)[C@H](C)c1ccc(F)cc1F ZINC001473675058 1061336818 /nfs/dbraw/zinc/33/68/18/1061336818.db2.gz SDZJZZIQPJDTHO-CYBMUJFWSA-N 1 2 320.383 4.178 20 0 DIADLO Cc1cc(C)[nH+]c(CN(C)[C@H](CCc2ccccc2)C(F)F)c1 ZINC001473692250 1061350988 /nfs/dbraw/zinc/35/09/88/1061350988.db2.gz YYWVFLHDUYKMFE-GOSISDBHSA-N 1 2 318.411 4.397 20 0 DIADLO CCOC(=O)[C@@H](Cc1ccccc1)[NH2+]CCCC1CCCCC1 ZINC001473698534 1061353185 /nfs/dbraw/zinc/35/31/85/1061353185.db2.gz REGVLAWDAOQFEB-LJQANCHMSA-N 1 2 317.473 4.111 20 0 DIADLO Fc1cc2[nH]c(-c3cccc4occc43)nc2cc1-n1cc[nH+]c1 ZINC001251479670 1061374125 /nfs/dbraw/zinc/37/41/25/1061374125.db2.gz QUQFMZAOGCSUFE-UHFFFAOYSA-N 1 2 318.311 4.301 20 0 DIADLO Fc1cc2[nH]c(-c3cccc4ccoc43)nc2cc1-n1cc[nH+]c1 ZINC001251478911 1061374853 /nfs/dbraw/zinc/37/48/53/1061374853.db2.gz CMMRYIDVXSOCMB-UHFFFAOYSA-N 1 2 318.311 4.301 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1nccc(Cl)c1Cl ZINC001473733608 1061380032 /nfs/dbraw/zinc/38/00/32/1061380032.db2.gz FBTHNMZBINOILD-JTQLQIEISA-N 1 2 311.212 4.248 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2ccc3cc[nH]c3c2)nc2ccccc12 ZINC001473743165 1061383047 /nfs/dbraw/zinc/38/30/47/1061383047.db2.gz ZWLQWZURQVSXEU-UHFFFAOYSA-N 1 2 316.408 4.052 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2ccc3cc[nH]c3c2)nc2ccccc12 ZINC001473743165 1061383060 /nfs/dbraw/zinc/38/30/60/1061383060.db2.gz ZWLQWZURQVSXEU-UHFFFAOYSA-N 1 2 316.408 4.052 20 0 DIADLO Fc1ccc2[nH]c(-c3ccc(-n4cc[nH+]c4)c(Cl)c3)nc2c1 ZINC001251507869 1061384356 /nfs/dbraw/zinc/38/43/56/1061384356.db2.gz XDONHZLEBPIXIG-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3cc(O)cc4ccccc43)[nH+]c2c1 ZINC001251532027 1061393161 /nfs/dbraw/zinc/39/31/61/1061393161.db2.gz UZJMUBZJBOVWGA-UHFFFAOYSA-N 1 2 303.365 4.155 20 0 DIADLO COc1ccc(CN2CCC[C@H]2c2[nH]c(C)c(C)[nH+]2)cc1Cl ZINC001473790569 1061411580 /nfs/dbraw/zinc/41/15/80/1061411580.db2.gz KUHJPVRFUWUSLB-HNNXBMFYSA-N 1 2 319.836 4.026 20 0 DIADLO Cc1cccc(C2=CC[N@H+](Cc3nc(C4CCC4)no3)CC2)c1C ZINC001473872736 1061446053 /nfs/dbraw/zinc/44/60/53/1061446053.db2.gz RPQGFXJABVFKJV-UHFFFAOYSA-N 1 2 323.440 4.243 20 0 DIADLO Cc1cccc(C2=CC[N@@H+](Cc3nc(C4CCC4)no3)CC2)c1C ZINC001473872736 1061446061 /nfs/dbraw/zinc/44/60/61/1061446061.db2.gz RPQGFXJABVFKJV-UHFFFAOYSA-N 1 2 323.440 4.243 20 0 DIADLO CCCn1cc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c(C)n1 ZINC001473919743 1061467964 /nfs/dbraw/zinc/46/79/64/1061467964.db2.gz ZEYAIHRZKBVGTB-LJQANCHMSA-N 1 2 309.413 4.074 20 0 DIADLO Cc1nc2ccc(NCc3c[nH+]c4ccc(C)cn34)cc2s1 ZINC001473944951 1061487956 /nfs/dbraw/zinc/48/79/56/1061487956.db2.gz LILVSDDMOVGSGF-UHFFFAOYSA-N 1 2 308.410 4.173 20 0 DIADLO CCCN(CC(C)C)C(=O)C[N@H+](CC)Cc1ccccc1Cl ZINC001463867247 1061527537 /nfs/dbraw/zinc/52/75/37/1061527537.db2.gz PVFHEHOYUNKCCN-UHFFFAOYSA-N 1 2 324.896 4.057 20 0 DIADLO CCCN(CC(C)C)C(=O)C[N@@H+](CC)Cc1ccccc1Cl ZINC001463867247 1061527552 /nfs/dbraw/zinc/52/75/52/1061527552.db2.gz PVFHEHOYUNKCCN-UHFFFAOYSA-N 1 2 324.896 4.057 20 0 DIADLO CCc1cc(N(C)Cc2c(F)cccc2Cl)nc(CC)[nH+]1 ZINC001458058394 1061549848 /nfs/dbraw/zinc/54/98/48/1061549848.db2.gz IUNXSHHWIITJSX-UHFFFAOYSA-N 1 2 307.800 4.030 20 0 DIADLO Cc1cc(CNC(=O)N2CCC[C@@H](C(C)(C)C)CC2)cc(C)[nH+]1 ZINC001252017671 1061555847 /nfs/dbraw/zinc/55/58/47/1061555847.db2.gz JZRXJJQWHGTANS-QGZVFWFLSA-N 1 2 317.477 4.056 20 0 DIADLO Cc1cc(-c2ccccc2)ccc1NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC001464091876 1061557127 /nfs/dbraw/zinc/55/71/27/1061557127.db2.gz NYNPEFHMXDQVIV-OAHLLOKOSA-N 1 2 319.408 4.202 20 0 DIADLO Cc1cc(-c2ccccc2)ccc1NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC001464091876 1061557145 /nfs/dbraw/zinc/55/71/45/1061557145.db2.gz NYNPEFHMXDQVIV-OAHLLOKOSA-N 1 2 319.408 4.202 20 0 DIADLO CCc1cc(N2CCC[C@@H]2CCc2ccccc2)nc(CC)[nH+]1 ZINC001458115871 1061578336 /nfs/dbraw/zinc/57/83/36/1061578336.db2.gz OEIWBTKABMZWGP-GOSISDBHSA-N 1 2 309.457 4.203 20 0 DIADLO C[C@H]([NH2+]Cc1cc2cccnc2o1)c1c(F)cccc1Cl ZINC001474037363 1061580538 /nfs/dbraw/zinc/58/05/38/1061580538.db2.gz GBBUHVJSIBQDRW-JTQLQIEISA-N 1 2 304.752 4.471 20 0 DIADLO Cc1cccc(OC[C@@H](C)Nc2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC001458132906 1061588437 /nfs/dbraw/zinc/58/84/37/1061588437.db2.gz BDCMRCRJYCNYRA-OAHLLOKOSA-N 1 2 311.429 4.240 20 0 DIADLO CCc1cc(N[C@H]2CCCOc3ccc(F)cc32)nc(CC)[nH+]1 ZINC001458133193 1061589084 /nfs/dbraw/zinc/58/90/84/1061589084.db2.gz KWGWSGFJPYJKMX-HNNXBMFYSA-N 1 2 315.392 4.066 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@]34C[C@H]3CCCC4)c2)[nH+]c1C ZINC001464458423 1061596811 /nfs/dbraw/zinc/59/68/11/1061596811.db2.gz JGNCACAUQNSWRA-DNVCBOLYSA-N 1 2 309.413 4.212 20 0 DIADLO Cc1nc(N2CCC[C@@H](c3ccccc3)CC2)c2c([nH+]1)CCCC2 ZINC001458155806 1061603920 /nfs/dbraw/zinc/60/39/20/1061603920.db2.gz FIDFRMJXCHZNNB-GOSISDBHSA-N 1 2 321.468 4.438 20 0 DIADLO CC(C)Cc1ccc(CNc2ccc(-n3cc[nH+]c3)c(F)c2)cn1 ZINC001474057929 1061604553 /nfs/dbraw/zinc/60/45/53/1061604553.db2.gz AUAOOQJJFMWMLN-UHFFFAOYSA-N 1 2 324.403 4.217 20 0 DIADLO CCc1ccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1CC ZINC001464567248 1061608446 /nfs/dbraw/zinc/60/84/46/1061608446.db2.gz BATPQDVLTHZCDK-UHFFFAOYSA-N 1 2 319.408 4.454 20 0 DIADLO CCCOc1ccc(CNc2ccc(C)[nH+]c2C)cc1OC ZINC001474079347 1061627608 /nfs/dbraw/zinc/62/76/08/1061627608.db2.gz JLUQNQGFDKXLEZ-UHFFFAOYSA-N 1 2 300.402 4.108 20 0 DIADLO CCC[C@H]1[C@@H](C)CCCN1c1nc2ccccc2n2c[nH+]cc12 ZINC001458210045 1061632543 /nfs/dbraw/zinc/63/25/43/1061632543.db2.gz CUIMATXITPYEIF-HOCLYGCPSA-N 1 2 308.429 4.288 20 0 DIADLO Cc1c(NCc2cc(C)[nH+]c3c2CCCC3)cnn1CC(C)C ZINC001474088697 1061633566 /nfs/dbraw/zinc/63/35/66/1061633566.db2.gz OVQSWWVRUPKBIE-UHFFFAOYSA-N 1 2 312.461 4.042 20 0 DIADLO CCc1cc(NC[C@@H](OC)c2ccc(Cl)cc2)nc(CC)[nH+]1 ZINC001458214318 1061637487 /nfs/dbraw/zinc/63/74/87/1061637487.db2.gz YWMTTYCXMPCJFS-OAHLLOKOSA-N 1 2 319.836 4.054 20 0 DIADLO CCc1c2ccccc2oc1C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001458213696 1061637538 /nfs/dbraw/zinc/63/75/38/1061637538.db2.gz GRTACDLCVHTDCQ-UHFFFAOYSA-N 1 2 323.396 4.017 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]23)c(N(C)C)[nH+]1 ZINC001458216884 1061638894 /nfs/dbraw/zinc/63/88/94/1061638894.db2.gz PXOINUNEZGKAIQ-HRCADAONSA-N 1 2 315.461 4.001 20 0 DIADLO Cc1cc(NCc2nc(C(C)(C)C)cs2)ccc1[NH+](C)C ZINC001474094251 1061639875 /nfs/dbraw/zinc/63/98/75/1061639875.db2.gz XHTCWGDMBMASLC-UHFFFAOYSA-N 1 2 303.475 4.427 20 0 DIADLO Cc1nc(NC[C@@H](C)Sc2ccccc2)c2c([nH+]1)CCCC2 ZINC001458223044 1061641786 /nfs/dbraw/zinc/64/17/86/1061641786.db2.gz YHSMKLMHUXBWOE-CYBMUJFWSA-N 1 2 313.470 4.257 20 0 DIADLO Cc1cc(N(C)[C@H](C)Cc2ccsc2)nc(C2CCC2)[nH+]1 ZINC001458230982 1061648847 /nfs/dbraw/zinc/64/88/47/1061648847.db2.gz JERLAJSIHSYKLY-CYBMUJFWSA-N 1 2 301.459 4.181 20 0 DIADLO Cc1cc(N(C)[C@@H](C)Cc2cccs2)nc(C2CCC2)[nH+]1 ZINC001458234571 1061650746 /nfs/dbraw/zinc/65/07/46/1061650746.db2.gz VTIRBTPLUGHQGC-ZDUSSCGKSA-N 1 2 301.459 4.181 20 0 DIADLO CCc1nc(N2CCCC[C@H]2c2ccc(F)cc2F)cc(C)[nH+]1 ZINC001458251382 1061661110 /nfs/dbraw/zinc/66/11/10/1061661110.db2.gz LOAVJSRWGOXEJE-INIZCTEOSA-N 1 2 317.383 4.357 20 0 DIADLO Cc1cc([N@H+]2CCCC[C@@H]2C)ccc1Nc1cnc(F)cn1 ZINC001458257311 1061662385 /nfs/dbraw/zinc/66/23/85/1061662385.db2.gz AMBRTSNTYOTWJE-ZDUSSCGKSA-N 1 2 300.381 4.047 20 0 DIADLO Cc1cc([N@@H+]2CCCC[C@@H]2C)ccc1Nc1cnc(F)cn1 ZINC001458257311 1061662389 /nfs/dbraw/zinc/66/23/89/1061662389.db2.gz AMBRTSNTYOTWJE-ZDUSSCGKSA-N 1 2 300.381 4.047 20 0 DIADLO Fc1cccc(OC(F)F)c1C[NH2+]Cc1cscc1Cl ZINC001474134832 1061681797 /nfs/dbraw/zinc/68/17/97/1061681797.db2.gz VPRQNWQTTHKXEY-UHFFFAOYSA-N 1 2 321.751 4.432 20 0 DIADLO Cc1cc(C)nc(Nc2ccc3c(c2)[nH+]c(C(C)(C)C)n3C)n1 ZINC001458302931 1061686144 /nfs/dbraw/zinc/68/61/44/1061686144.db2.gz PVRXKDBBWDAWRG-UHFFFAOYSA-N 1 2 309.417 4.021 20 0 DIADLO CC(C)c1cc(NCc2ccccc2N(C)C)nc(C(C)C)[nH+]1 ZINC001458330775 1061702281 /nfs/dbraw/zinc/70/22/81/1061702281.db2.gz QAIGZXPDKMXDLV-UHFFFAOYSA-N 1 2 312.461 4.402 20 0 DIADLO Cc1cc(Br)cc(C[NH2+]C2(C(F)F)CCCC2)c1 ZINC001474166021 1061711149 /nfs/dbraw/zinc/71/11/49/1061711149.db2.gz PGZCVLOTBSYFSW-UHFFFAOYSA-N 1 2 318.205 4.425 20 0 DIADLO Fc1cccc(Br)c1CNc1cc2cc[nH]c2c[nH+]1 ZINC001474193728 1061742642 /nfs/dbraw/zinc/74/26/42/1061742642.db2.gz VAJJYNSHAJSJCA-UHFFFAOYSA-N 1 2 320.165 4.077 20 0 DIADLO CCc1cc(NCCc2cc3ccccc3s2)nc(CC)[nH+]1 ZINC001458405545 1061744298 /nfs/dbraw/zinc/74/42/98/1061744298.db2.gz KHRZAVJTPZNMAS-UHFFFAOYSA-N 1 2 311.454 4.471 20 0 DIADLO CCc1cc(N2CC(C)(C)[C@H]2c2cccs2)nc(CC)[nH+]1 ZINC001458414650 1061749534 /nfs/dbraw/zinc/74/95/34/1061749534.db2.gz NLEZOFLTMFQVCI-MRXNPFEDSA-N 1 2 301.459 4.250 20 0 DIADLO CCC1(CNc2ccc(Nc3ccccc3)c[nH+]2)CCOCC1 ZINC001474216282 1061771119 /nfs/dbraw/zinc/77/11/19/1061771119.db2.gz NRHPCGUEPHFFLE-UHFFFAOYSA-N 1 2 311.429 4.444 20 0 DIADLO CCCOc1ccc(NCc2c[nH+]cn2CC)cc1C(C)C ZINC001474244922 1061809459 /nfs/dbraw/zinc/80/94/59/1061809459.db2.gz JGZFOKDEPVCCKJ-UHFFFAOYSA-N 1 2 301.434 4.427 20 0 DIADLO CCc1cc(N2CCC[C@@]2(C)Cc2ccc(C)cc2)nc(C)[nH+]1 ZINC001458514018 1061812970 /nfs/dbraw/zinc/81/29/70/1061812970.db2.gz HVYALWQHKBQHEV-FQEVSTJZSA-N 1 2 309.457 4.257 20 0 DIADLO Cc1ccc2[nH+]c(NCc3csc(C(C)(C)C)n3)[nH]c2c1 ZINC001474248900 1061815939 /nfs/dbraw/zinc/81/59/39/1061815939.db2.gz RFAQIRFHIPBOJZ-UHFFFAOYSA-N 1 2 300.431 4.237 20 0 DIADLO COc1cccc2[nH]c(NCc3cc4ccccc4s3)[nH+]c21 ZINC001474254341 1061823158 /nfs/dbraw/zinc/82/31/58/1061823158.db2.gz OCGXMIMKSNUFFU-UHFFFAOYSA-N 1 2 309.394 4.398 20 0 DIADLO CCC(C)(C)CCNc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC001458529846 1061824396 /nfs/dbraw/zinc/82/43/96/1061824396.db2.gz IGWRJIMZWQBVEU-UHFFFAOYSA-N 1 2 309.417 4.054 20 0 DIADLO CC(C)Cc1ccc(NC(=O)[C@H](CC(C)C)n2cc[nH+]c2)cc1 ZINC001465898225 1061834851 /nfs/dbraw/zinc/83/48/51/1061834851.db2.gz NGJCQFWZIUCGOZ-SFHVURJKSA-N 1 2 313.445 4.308 20 0 DIADLO COc1cc(Cl)c(F)cc1NCc1c[nH+]c2ccc(C)cn12 ZINC001474280331 1061846405 /nfs/dbraw/zinc/84/64/05/1061846405.db2.gz UHCKKZHMRINKBF-UHFFFAOYSA-N 1 2 319.767 4.056 20 0 DIADLO CCc1cc(NC[C@@H]2[C@@H](c3ccccc3)C2(F)F)nc(CC)[nH+]1 ZINC001458586479 1061846849 /nfs/dbraw/zinc/84/68/49/1061846849.db2.gz SFIPPXMMNLUPTM-RHSMWYFYSA-N 1 2 317.383 4.062 20 0 DIADLO Cc1cc(NC(=O)Nc2cccc(NC3CCCC3)c2)c(C)c[nH+]1 ZINC001465948507 1061847175 /nfs/dbraw/zinc/84/71/75/1061847175.db2.gz CXNHYAFCMCETNU-UHFFFAOYSA-N 1 2 324.428 4.119 20 0 DIADLO CCc1cc(N2CCC[C@@]2(C)Cc2cccs2)nc(CC)[nH+]1 ZINC001458662018 1061865956 /nfs/dbraw/zinc/86/59/56/1061865956.db2.gz BPTOSRDABFJVRX-SFHVURJKSA-N 1 2 315.486 4.265 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1ccc2cc[nH]c2c1 ZINC001474301940 1061870594 /nfs/dbraw/zinc/87/05/94/1061870594.db2.gz MSCGCHJOJNBOKR-UHFFFAOYSA-N 1 2 310.788 4.320 20 0 DIADLO Cc1cc(N[C@@H]2CCCc3ccccc3C2)nc(C2CCC2)[nH+]1 ZINC001458675629 1061871788 /nfs/dbraw/zinc/87/17/88/1061871788.db2.gz IYDVJJFWOPCQCT-GOSISDBHSA-N 1 2 307.441 4.412 20 0 DIADLO Cc1cc(N[C@H]2CCCc3ccccc3C2)nc(C2CCC2)[nH+]1 ZINC001458675635 1061872694 /nfs/dbraw/zinc/87/26/94/1061872694.db2.gz IYDVJJFWOPCQCT-SFHVURJKSA-N 1 2 307.441 4.412 20 0 DIADLO CC(C)c1ccc(CN(C)Cc2ccnn2-c2cc[nH+]cc2)cc1 ZINC001474315749 1061886610 /nfs/dbraw/zinc/88/66/10/1061886610.db2.gz WQHZVFFYDLLEJT-UHFFFAOYSA-N 1 2 320.440 4.023 20 0 DIADLO C[C@@H]1C[NH+](Cc2c(F)cccc2OC(F)(F)F)C[C@@H](C)S1 ZINC001474340100 1061932792 /nfs/dbraw/zinc/93/27/92/1061932792.db2.gz VWZUQYUNHMDLGU-NXEZZACHSA-N 1 2 323.355 4.050 20 0 DIADLO CCC1(CC)CCC(NC(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC001466417911 1061935141 /nfs/dbraw/zinc/93/51/41/1061935141.db2.gz LUYFRVUOUZFCJW-UHFFFAOYSA-N 1 2 314.433 4.205 20 0 DIADLO C[C@H]1C[N@H+](CCCc2c(Cl)cccc2Cl)CC(C)(C)O1 ZINC001474341194 1061941552 /nfs/dbraw/zinc/94/15/52/1061941552.db2.gz NSVGYMBXJNXRSU-LBPRGKRZSA-N 1 2 316.272 4.425 20 0 DIADLO C[C@H]1C[N@@H+](CCCc2c(Cl)cccc2Cl)CC(C)(C)O1 ZINC001474341194 1061941568 /nfs/dbraw/zinc/94/15/68/1061941568.db2.gz NSVGYMBXJNXRSU-LBPRGKRZSA-N 1 2 316.272 4.425 20 0 DIADLO CCCC[N@H+](Cc1nn(C)cc1Cl)[C@@H](C)c1ccccc1 ZINC001474361406 1061986107 /nfs/dbraw/zinc/98/61/07/1061986107.db2.gz QGOVQKQPYWDLDP-AWEZNQCLSA-N 1 2 305.853 4.437 20 0 DIADLO CCCC[N@@H+](Cc1nn(C)cc1Cl)[C@@H](C)c1ccccc1 ZINC001474361406 1061986121 /nfs/dbraw/zinc/98/61/21/1061986121.db2.gz QGOVQKQPYWDLDP-AWEZNQCLSA-N 1 2 305.853 4.437 20 0 DIADLO Cc1cc(C)c(NC(=O)Nc2c[nH]nc2-c2ccccc2)c(C)[nH+]1 ZINC001466754371 1062000291 /nfs/dbraw/zinc/00/02/91/1062000291.db2.gz BLWLPQICOBPBAC-UHFFFAOYSA-N 1 2 321.384 4.041 20 0 DIADLO Cc1cc(C)c(NC(=O)N2Cc3ccccc3[C@H](C)C2)c(C)[nH+]1 ZINC001466756069 1062000647 /nfs/dbraw/zinc/00/06/47/1062000647.db2.gz KAMJSUFNFJYLBW-CYBMUJFWSA-N 1 2 309.413 4.158 20 0 DIADLO CCc1nc(SCc2[nH+]cc(C)c(OC)c2C)sc1C ZINC001459164719 1062029689 /nfs/dbraw/zinc/02/96/89/1062029689.db2.gz KTRNXCYTZWKPLP-UHFFFAOYSA-N 1 2 308.472 4.327 20 0 DIADLO Cc1nn(-c2ccccc2Cl)cc1C[N@H+](C)Cc1ccco1 ZINC001474398454 1062052295 /nfs/dbraw/zinc/05/22/95/1062052295.db2.gz UIETXIICNLXZLM-UHFFFAOYSA-N 1 2 315.804 4.059 20 0 DIADLO Cc1nn(-c2ccccc2Cl)cc1C[N@@H+](C)Cc1ccco1 ZINC001474398454 1062052308 /nfs/dbraw/zinc/05/23/08/1062052308.db2.gz UIETXIICNLXZLM-UHFFFAOYSA-N 1 2 315.804 4.059 20 0 DIADLO FC1(F)CCC([N@@H+]2CCOC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001254225650 1062057632 /nfs/dbraw/zinc/05/76/32/1062057632.db2.gz BXEGSTBSINYZIY-OAHLLOKOSA-N 1 2 315.791 4.291 20 0 DIADLO FC1(F)CCC([N@H+]2CCOC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001254225650 1062057655 /nfs/dbraw/zinc/05/76/55/1062057655.db2.gz BXEGSTBSINYZIY-OAHLLOKOSA-N 1 2 315.791 4.291 20 0 DIADLO COCCOc1ccc(C[N@H+](C)[C@H](C)c2ccccc2Cl)o1 ZINC001474401680 1062059873 /nfs/dbraw/zinc/05/98/73/1062059873.db2.gz RLNHKCRRXNRBMO-CYBMUJFWSA-N 1 2 323.820 4.151 20 0 DIADLO COCCOc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)o1 ZINC001474401680 1062059897 /nfs/dbraw/zinc/05/98/97/1062059897.db2.gz RLNHKCRRXNRBMO-CYBMUJFWSA-N 1 2 323.820 4.151 20 0 DIADLO CCc1cn(CCOC(c2ccccc2)c2ccccc2)c[nH+]1 ZINC001459262829 1062060269 /nfs/dbraw/zinc/06/02/69/1062060269.db2.gz OYNTWJHYOWVBSK-UHFFFAOYSA-N 1 2 306.409 4.252 20 0 DIADLO CCc1cn(Cc2csc(Cc3ccc(Cl)cc3)n2)c[nH+]1 ZINC001459262891 1062061675 /nfs/dbraw/zinc/06/16/75/1062061675.db2.gz PQOAFHLAQJJPDU-UHFFFAOYSA-N 1 2 317.845 4.195 20 0 DIADLO Clc1ccc(-c2c[nH]c(SCCCn3cc[nH+]c3)n2)cc1 ZINC001459291463 1062070091 /nfs/dbraw/zinc/07/00/91/1062070091.db2.gz KTVXUSYHHQROSL-UHFFFAOYSA-N 1 2 318.833 4.109 20 0 DIADLO CCCCCCC(=O)Cn1c[nH+]c(Cc2ccccc2OC)c1 ZINC001459300161 1062072399 /nfs/dbraw/zinc/07/23/99/1062072399.db2.gz HBLGCZZBQKDBII-UHFFFAOYSA-N 1 2 314.429 4.022 20 0 DIADLO COc1nccc(C[N@H+](Cc2ccc(Cl)cc2)C2CC2)c1F ZINC001474414943 1062083255 /nfs/dbraw/zinc/08/32/55/1062083255.db2.gz QQLKIXFILFNKMR-UHFFFAOYSA-N 1 2 320.795 4.047 20 0 DIADLO COc1nccc(C[N@@H+](Cc2ccc(Cl)cc2)C2CC2)c1F ZINC001474414943 1062083277 /nfs/dbraw/zinc/08/32/77/1062083277.db2.gz QQLKIXFILFNKMR-UHFFFAOYSA-N 1 2 320.795 4.047 20 0 DIADLO C[N@H+](Cc1cc2n(n1)CCCC2)Cc1ccc(Cl)c(Cl)c1 ZINC001474415177 1062083722 /nfs/dbraw/zinc/08/37/22/1062083722.db2.gz NGYLNMNQDXALSE-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO C[N@@H+](Cc1cc2n(n1)CCCC2)Cc1ccc(Cl)c(Cl)c1 ZINC001474415177 1062083733 /nfs/dbraw/zinc/08/37/33/1062083733.db2.gz NGYLNMNQDXALSE-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO Cc1conc1C[N@H+](Cc1ccccc1)Cc1ccccc1C ZINC001459374602 1062117469 /nfs/dbraw/zinc/11/74/69/1062117469.db2.gz LIINOZRGSGMETO-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Cc1conc1C[N@@H+](Cc1ccccc1)Cc1ccccc1C ZINC001459374602 1062117481 /nfs/dbraw/zinc/11/74/81/1062117481.db2.gz LIINOZRGSGMETO-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO COc1cc(C)[nH+]c(CN(Cc2ccccc2F)CC(C)C)c1 ZINC001459383632 1062119561 /nfs/dbraw/zinc/11/95/61/1062119561.db2.gz UJTHAYCQAWDABH-UHFFFAOYSA-N 1 2 316.420 4.196 20 0 DIADLO CC1(C)CCC[N@H+](Cc2nc(Cl)ccc2Br)C1 ZINC001474446203 1062123314 /nfs/dbraw/zinc/12/33/14/1062123314.db2.gz PMIIWTQMPJYRIE-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO CC1(C)CCC[N@@H+](Cc2nc(Cl)ccc2Br)C1 ZINC001474446203 1062123327 /nfs/dbraw/zinc/12/33/27/1062123327.db2.gz PMIIWTQMPJYRIE-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+](Cc1ccccc1Cl)C1CCCC1 ZINC001459445287 1062144613 /nfs/dbraw/zinc/14/46/13/1062144613.db2.gz CENQGPIOZHJVGV-AWEZNQCLSA-N 1 2 323.864 4.426 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+](Cc1ccccc1Cl)C1CCCC1 ZINC001459445287 1062144624 /nfs/dbraw/zinc/14/46/24/1062144624.db2.gz CENQGPIOZHJVGV-AWEZNQCLSA-N 1 2 323.864 4.426 20 0 DIADLO Cc1cc(Cl)nc(C[NH2+]Cc2cncc(Cl)c2Cl)c1 ZINC001474469541 1062148509 /nfs/dbraw/zinc/14/85/09/1062148509.db2.gz WJARLZRQMPOYGT-UHFFFAOYSA-N 1 2 316.619 4.035 20 0 DIADLO CC(C)(C)[C@H]1CCC[N@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001474473973 1062150505 /nfs/dbraw/zinc/15/05/05/1062150505.db2.gz HCMHLXQDZWWDJE-JTQLQIEISA-N 1 2 306.397 4.420 20 0 DIADLO CC(C)(C)[C@H]1CCC[N@@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001474473973 1062150514 /nfs/dbraw/zinc/15/05/14/1062150514.db2.gz HCMHLXQDZWWDJE-JTQLQIEISA-N 1 2 306.397 4.420 20 0 DIADLO C/C=C\C[C@H]([NH2+]CCc1ccc(C(C)(C)C)cc1)C(=O)OCC ZINC001474496518 1062176516 /nfs/dbraw/zinc/17/65/16/1062176516.db2.gz NWEKILGVZLYGSP-POZKEBTKSA-N 1 2 317.473 4.014 20 0 DIADLO C/C=C/C[C@@H]([NH2+]CCc1ccc(C(C)(C)C)cc1)C(=O)OCC ZINC001474496517 1062177347 /nfs/dbraw/zinc/17/73/47/1062177347.db2.gz NWEKILGVZLYGSP-JHTBKMLMSA-N 1 2 317.473 4.014 20 0 DIADLO CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1nc(Cl)cs1 ZINC001474500831 1062178941 /nfs/dbraw/zinc/17/89/41/1062178941.db2.gz KUZBUILTWCEMMA-CYBMUJFWSA-N 1 2 310.850 4.388 20 0 DIADLO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1nc(Cl)cs1 ZINC001474500831 1062178956 /nfs/dbraw/zinc/17/89/56/1062178956.db2.gz KUZBUILTWCEMMA-CYBMUJFWSA-N 1 2 310.850 4.388 20 0 DIADLO C[C@@H]([NH2+]Cc1cc2c(ccnc2Cl)o1)c1c(F)cncc1F ZINC001474512629 1062193362 /nfs/dbraw/zinc/19/33/62/1062193362.db2.gz QCSQANYBCVDJGO-MRVPVSSYSA-N 1 2 323.730 4.005 20 0 DIADLO FC(F)(C[NH2+]C[C@@H]1CC1(Cl)Cl)c1ccc(Cl)cc1 ZINC001474511686 1062195294 /nfs/dbraw/zinc/19/52/94/1062195294.db2.gz NUVPNEKTKSMNKG-VIFPVBQESA-N 1 2 314.590 4.215 20 0 DIADLO Cc1ccccc1CC[N@@H+](C)Cc1c(Cl)ccnc1Cl ZINC001474544267 1062237311 /nfs/dbraw/zinc/23/73/11/1062237311.db2.gz MNAALICXLNRKFC-UHFFFAOYSA-N 1 2 309.240 4.371 20 0 DIADLO Cc1ccccc1CC[N@H+](C)Cc1c(Cl)ccnc1Cl ZINC001474544267 1062237322 /nfs/dbraw/zinc/23/73/22/1062237322.db2.gz MNAALICXLNRKFC-UHFFFAOYSA-N 1 2 309.240 4.371 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1C[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1 ZINC001474553235 1062251721 /nfs/dbraw/zinc/25/17/21/1062251721.db2.gz YLKSHOOHESPJRY-DJIMGWMZSA-N 1 2 304.482 4.232 20 0 DIADLO CCC1(CC)CC[N@@H+]([C@@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001459650133 1062274184 /nfs/dbraw/zinc/27/41/84/1062274184.db2.gz NXWCYYGDXZNPCA-OAHLLOKOSA-N 1 2 309.837 4.066 20 0 DIADLO CCC1(CC)CC[N@H+]([C@@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001459650133 1062274203 /nfs/dbraw/zinc/27/42/03/1062274203.db2.gz NXWCYYGDXZNPCA-OAHLLOKOSA-N 1 2 309.837 4.066 20 0 DIADLO CCNc1nc(C[NH2+]C(c2ccccc2)c2ccccc2)cs1 ZINC001459667186 1062286619 /nfs/dbraw/zinc/28/66/19/1062286619.db2.gz CRPXDYSIFIRCDR-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO CCc1nnc([C@H](c2ccc(Cl)cc2)[NH+]2CCCCCC2)o1 ZINC001255091511 1062310539 /nfs/dbraw/zinc/31/05/39/1062310539.db2.gz QTAFVTJHNJMKSY-INIZCTEOSA-N 1 2 319.836 4.251 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)N(C(=O)c3c(C)cc(C)[nH+]c3C)C2)cc1 ZINC001459700700 1062316855 /nfs/dbraw/zinc/31/68/55/1062316855.db2.gz XTJSTPNZMSQUEW-QFBILLFUSA-N 1 2 322.452 4.333 20 0 DIADLO CCCc1ccc(C[N@H+](C)[C@@H](CC)C(=O)OC(C)(C)C)s1 ZINC001474607791 1062322067 /nfs/dbraw/zinc/32/20/67/1062322067.db2.gz FTLXBOQZXYWEDS-HNNXBMFYSA-N 1 2 311.491 4.253 20 0 DIADLO CCCc1ccc(C[N@@H+](C)[C@@H](CC)C(=O)OC(C)(C)C)s1 ZINC001474607791 1062322094 /nfs/dbraw/zinc/32/20/94/1062322094.db2.gz FTLXBOQZXYWEDS-HNNXBMFYSA-N 1 2 311.491 4.253 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ccc(O)c(F)c1F)c1ccccc1F ZINC001474619568 1062342235 /nfs/dbraw/zinc/34/22/35/1062342235.db2.gz YNGFBDDPUNTZCP-QGZVFWFLSA-N 1 2 309.331 4.296 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2nc(C3CCC3)no2)C(C)C)cc1 ZINC001459730985 1062343622 /nfs/dbraw/zinc/34/36/22/1062343622.db2.gz ORAXNKNRXGCDRF-SFHVURJKSA-N 1 2 313.445 4.386 20 0 DIADLO CC[NH+](CC)[C@@H](c1nnc(C2CCC2)o1)c1ccc(Cl)cc1 ZINC001255202028 1062357491 /nfs/dbraw/zinc/35/74/91/1062357491.db2.gz NLQGJCMUMLAFCW-OAHLLOKOSA-N 1 2 319.836 4.422 20 0 DIADLO CCc1cccc2cc(C[N@@H+]3C[C@H](C)O[C@@](C)(C(F)F)C3)oc21 ZINC001474636603 1062359356 /nfs/dbraw/zinc/35/93/56/1062359356.db2.gz QWFNQTNSPPQSMT-KPZWWZAWSA-N 1 2 323.383 4.240 20 0 DIADLO CCc1cccc2cc(C[N@H+]3C[C@H](C)O[C@@](C)(C(F)F)C3)oc21 ZINC001474636603 1062359379 /nfs/dbraw/zinc/35/93/79/1062359379.db2.gz QWFNQTNSPPQSMT-KPZWWZAWSA-N 1 2 323.383 4.240 20 0 DIADLO CCc1cccc2cc(C[N@@H+]3C[C@H](C)O[C@](C)(C(F)F)C3)oc21 ZINC001474636605 1062360530 /nfs/dbraw/zinc/36/05/30/1062360530.db2.gz QWFNQTNSPPQSMT-SGTLLEGYSA-N 1 2 323.383 4.240 20 0 DIADLO CCc1cccc2cc(C[N@H+]3C[C@H](C)O[C@](C)(C(F)F)C3)oc21 ZINC001474636605 1062360547 /nfs/dbraw/zinc/36/05/47/1062360547.db2.gz QWFNQTNSPPQSMT-SGTLLEGYSA-N 1 2 323.383 4.240 20 0 DIADLO Oc1ccc2c(c1)C[N@@H+](CCCc1c(F)cccc1Cl)C2 ZINC001474636130 1062361100 /nfs/dbraw/zinc/36/11/00/1062361100.db2.gz JGVZFZKFTBNMJM-UHFFFAOYSA-N 1 2 305.780 4.133 20 0 DIADLO Oc1ccc2c(c1)C[N@H+](CCCc1c(F)cccc1Cl)C2 ZINC001474636130 1062361125 /nfs/dbraw/zinc/36/11/25/1062361125.db2.gz JGVZFZKFTBNMJM-UHFFFAOYSA-N 1 2 305.780 4.133 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cnon2)[C@@H]2CCc3ccccc32)cc1 ZINC001459750247 1062364156 /nfs/dbraw/zinc/36/41/56/1062364156.db2.gz OUWBYSVUXCCSTD-HXUWFJFHSA-N 1 2 319.408 4.068 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cnon2)[C@@H]2CCc3ccccc32)cc1 ZINC001459750247 1062364169 /nfs/dbraw/zinc/36/41/69/1062364169.db2.gz OUWBYSVUXCCSTD-HXUWFJFHSA-N 1 2 319.408 4.068 20 0 DIADLO C/C=C\C[C@H]1CCC[N@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001474652030 1062384200 /nfs/dbraw/zinc/38/42/00/1062384200.db2.gz AZYZZGPPTJZQRS-QUCGXOGASA-N 1 2 304.381 4.340 20 0 DIADLO C/C=C\C[C@H]1CCC[N@@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001474652030 1062384225 /nfs/dbraw/zinc/38/42/25/1062384225.db2.gz AZYZZGPPTJZQRS-QUCGXOGASA-N 1 2 304.381 4.340 20 0 DIADLO CC[C@H](c1ccccc1)[N@H+](CC(=O)OC)Cc1csc(C)c1 ZINC001459832328 1062433242 /nfs/dbraw/zinc/43/32/42/1062433242.db2.gz IKVAMSYUAGQGIQ-QGZVFWFLSA-N 1 2 317.454 4.183 20 0 DIADLO CC[C@H](c1ccccc1)[N@@H+](CC(=O)OC)Cc1csc(C)c1 ZINC001459832328 1062433250 /nfs/dbraw/zinc/43/32/50/1062433250.db2.gz IKVAMSYUAGQGIQ-QGZVFWFLSA-N 1 2 317.454 4.183 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2cc3ccc(C(C)C)cc3[nH]2)c[nH+]1 ZINC001469004152 1062458207 /nfs/dbraw/zinc/45/82/07/1062458207.db2.gz FJZLSDODKADZNV-UHFFFAOYSA-N 1 2 321.424 4.233 20 0 DIADLO CCc1ccc2c(c1)C[N@@H+](Cc1cccc(O)c1Cl)CC2 ZINC001474760001 1062466832 /nfs/dbraw/zinc/46/68/32/1062466832.db2.gz DVXAKKBBOWUPJQ-UHFFFAOYSA-N 1 2 301.817 4.166 20 0 DIADLO CCc1ccc2c(c1)C[N@H+](Cc1cccc(O)c1Cl)CC2 ZINC001474760001 1062466839 /nfs/dbraw/zinc/46/68/39/1062466839.db2.gz DVXAKKBBOWUPJQ-UHFFFAOYSA-N 1 2 301.817 4.166 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@H+]1Cc1ccc2cnccc2c1 ZINC001459883088 1062467965 /nfs/dbraw/zinc/46/79/65/1062467965.db2.gz PLFPNDFQTAJGFF-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@@H+]1Cc1ccc2cnccc2c1 ZINC001459883088 1062467975 /nfs/dbraw/zinc/46/79/75/1062467975.db2.gz PLFPNDFQTAJGFF-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)[NH2+][C@H](c1ccccc1)C(F)F ZINC001474764213 1062469585 /nfs/dbraw/zinc/46/95/85/1062469585.db2.gz UVNMQKWRFOVFMS-UPBLURMWSA-N 1 2 319.332 4.305 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccc(C)c(F)c1 ZINC001459881429 1062470240 /nfs/dbraw/zinc/47/02/40/1062470240.db2.gz ZUUOUFKVROQMAM-OAHLLOKOSA-N 1 2 302.393 4.242 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2Cc3ccccc3OC[C@H]2C)c1 ZINC001459931943 1062504067 /nfs/dbraw/zinc/50/40/67/1062504067.db2.gz HSBADNMPNURSPC-CYBMUJFWSA-N 1 2 317.816 4.132 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2Cc3ccccc3OC[C@H]2C)c1 ZINC001459931943 1062504082 /nfs/dbraw/zinc/50/40/82/1062504082.db2.gz HSBADNMPNURSPC-CYBMUJFWSA-N 1 2 317.816 4.132 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1ccc(Cl)c(F)c1 ZINC001459933261 1062509419 /nfs/dbraw/zinc/50/94/19/1062509419.db2.gz KDHFYLCTUUABHZ-GFCCVEGCSA-N 1 2 305.780 4.262 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1ccc(Cl)c(F)c1 ZINC001459933261 1062509448 /nfs/dbraw/zinc/50/94/48/1062509448.db2.gz KDHFYLCTUUABHZ-GFCCVEGCSA-N 1 2 305.780 4.262 20 0 DIADLO CCC[N@H+](Cc1ccccc1OC(C)C)[C@@H](CC)C(=O)OCC ZINC001459941446 1062511986 /nfs/dbraw/zinc/51/19/86/1062511986.db2.gz HEALNIPTBURHKV-KRWDZBQOSA-N 1 2 321.461 4.028 20 0 DIADLO CCC[N@@H+](Cc1ccccc1OC(C)C)[C@@H](CC)C(=O)OCC ZINC001459941446 1062512009 /nfs/dbraw/zinc/51/20/09/1062512009.db2.gz HEALNIPTBURHKV-KRWDZBQOSA-N 1 2 321.461 4.028 20 0 DIADLO CCOC(=O)[C@H](C)[N@H+](Cc1ccc(C2CCCC2)cc1)C1CC1 ZINC001459956663 1062526950 /nfs/dbraw/zinc/52/69/50/1062526950.db2.gz GSLLVTWJOKVQOO-HNNXBMFYSA-N 1 2 315.457 4.260 20 0 DIADLO CCOC(=O)[C@H](C)[N@@H+](Cc1ccc(C2CCCC2)cc1)C1CC1 ZINC001459956663 1062526967 /nfs/dbraw/zinc/52/69/67/1062526967.db2.gz GSLLVTWJOKVQOO-HNNXBMFYSA-N 1 2 315.457 4.260 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)c(C)c1 ZINC001459995640 1062553073 /nfs/dbraw/zinc/55/30/73/1062553073.db2.gz WAIZDOSUOIVCFI-LJQANCHMSA-N 1 2 317.379 4.155 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)c(C)c1 ZINC001459995640 1062553091 /nfs/dbraw/zinc/55/30/91/1062553091.db2.gz WAIZDOSUOIVCFI-LJQANCHMSA-N 1 2 317.379 4.155 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2cc(Cl)cc(Cl)c2F)CCCO1 ZINC001460009262 1062569201 /nfs/dbraw/zinc/56/92/01/1062569201.db2.gz ZUNVWTUVLUWEDA-GFCCVEGCSA-N 1 2 306.208 4.133 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2F)CCCO1 ZINC001460009262 1062569217 /nfs/dbraw/zinc/56/92/17/1062569217.db2.gz ZUNVWTUVLUWEDA-GFCCVEGCSA-N 1 2 306.208 4.133 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+]([C@H](C)CSc1ccc(F)cc1)C2 ZINC001255746217 1062569613 /nfs/dbraw/zinc/56/96/13/1062569613.db2.gz FPQSZHVUSGQJRN-CYBMUJFWSA-N 1 2 302.418 4.026 20 0 DIADLO Cc1cc2c(cn1)C[N@H+]([C@H](C)CSc1ccc(F)cc1)C2 ZINC001255746217 1062569634 /nfs/dbraw/zinc/56/96/34/1062569634.db2.gz FPQSZHVUSGQJRN-CYBMUJFWSA-N 1 2 302.418 4.026 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@H+](Cc2nsc3ccccc32)C1 ZINC001460025325 1062578317 /nfs/dbraw/zinc/57/83/17/1062578317.db2.gz ZZDUKPINUKAAFP-SFHVURJKSA-N 1 2 312.413 4.367 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@@H+](Cc2nsc3ccccc32)C1 ZINC001460025325 1062578332 /nfs/dbraw/zinc/57/83/32/1062578332.db2.gz ZZDUKPINUKAAFP-SFHVURJKSA-N 1 2 312.413 4.367 20 0 DIADLO Cc1ccc(SC[C@H](C)[N@H+](C)CC(=O)c2ccccc2)cc1 ZINC001255771359 1062594398 /nfs/dbraw/zinc/59/43/98/1062594398.db2.gz RPLTTWVSGNGLRU-INIZCTEOSA-N 1 2 313.466 4.290 20 0 DIADLO Cc1ccc(SC[C@H](C)[N@@H+](C)CC(=O)c2ccccc2)cc1 ZINC001255771359 1062594420 /nfs/dbraw/zinc/59/44/20/1062594420.db2.gz RPLTTWVSGNGLRU-INIZCTEOSA-N 1 2 313.466 4.290 20 0 DIADLO Clc1ccc2cc3n(c2c1)CC[N@@H+](CCc1ccccc1)C3 ZINC001460048762 1062599659 /nfs/dbraw/zinc/59/96/59/1062599659.db2.gz RSASGGFMKOONMY-UHFFFAOYSA-N 1 2 310.828 4.353 20 0 DIADLO Clc1ccc2cc3n(c2c1)CC[N@H+](CCc1ccccc1)C3 ZINC001460048762 1062599671 /nfs/dbraw/zinc/59/96/71/1062599671.db2.gz RSASGGFMKOONMY-UHFFFAOYSA-N 1 2 310.828 4.353 20 0 DIADLO Cc1cc(NC(=O)N[C@@H](CCC(C)C)C(C)(C)C)c(C)c[nH+]1 ZINC001476303693 1062628320 /nfs/dbraw/zinc/62/83/20/1062628320.db2.gz QUAIXVROBUCIRR-INIZCTEOSA-N 1 2 305.466 4.093 20 0 DIADLO CCc1ncc(C[N@@H+](Cc2ccc(F)cc2Cl)CC2CC2)o1 ZINC001460099542 1062638243 /nfs/dbraw/zinc/63/82/43/1062638243.db2.gz NNQCZUABANHHBE-UHFFFAOYSA-N 1 2 322.811 4.442 20 0 DIADLO CCc1ncc(C[N@H+](Cc2ccc(F)cc2Cl)CC2CC2)o1 ZINC001460099542 1062638253 /nfs/dbraw/zinc/63/82/53/1062638253.db2.gz NNQCZUABANHHBE-UHFFFAOYSA-N 1 2 322.811 4.442 20 0 DIADLO Fc1ccccc1C[N@@H+]1CCCC[C@@H]1c1nc2ccccc2[nH]1 ZINC001460113651 1062645022 /nfs/dbraw/zinc/64/50/22/1062645022.db2.gz VMNHTEXDAYZKAT-GOSISDBHSA-N 1 2 309.388 4.429 20 0 DIADLO Fc1ccccc1C[N@H+]1CCCC[C@@H]1c1nc2ccccc2[nH]1 ZINC001460113651 1062645026 /nfs/dbraw/zinc/64/50/26/1062645026.db2.gz VMNHTEXDAYZKAT-GOSISDBHSA-N 1 2 309.388 4.429 20 0 DIADLO Fc1ccccc1C[N@@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC001460113653 1062645221 /nfs/dbraw/zinc/64/52/21/1062645221.db2.gz VMNHTEXDAYZKAT-SFHVURJKSA-N 1 2 309.388 4.429 20 0 DIADLO Fc1ccccc1C[N@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC001460113653 1062645229 /nfs/dbraw/zinc/64/52/29/1062645229.db2.gz VMNHTEXDAYZKAT-SFHVURJKSA-N 1 2 309.388 4.429 20 0 DIADLO c1[nH]c2c([nH+]1)[C@H](c1nnc(-c3ccc4ccccc4c3)o1)CCC2 ZINC001256002746 1062682647 /nfs/dbraw/zinc/68/26/47/1062682647.db2.gz UKKSOWHLZODMTG-OAHLLOKOSA-N 1 2 316.364 4.081 20 0 DIADLO Clc1ccc(CC[N@@H+]2CCn3c(cc4ccccc43)C2)cc1 ZINC001460183383 1062684440 /nfs/dbraw/zinc/68/44/40/1062684440.db2.gz UBCGDJJMUIKDTH-UHFFFAOYSA-N 1 2 310.828 4.353 20 0 DIADLO Clc1ccc(CC[N@H+]2CCn3c(cc4ccccc43)C2)cc1 ZINC001460183383 1062684450 /nfs/dbraw/zinc/68/44/50/1062684450.db2.gz UBCGDJJMUIKDTH-UHFFFAOYSA-N 1 2 310.828 4.353 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(Cl)c2Cl)[C@@H]1[C@H]1CCCO1 ZINC001460193827 1062689885 /nfs/dbraw/zinc/68/98/85/1062689885.db2.gz FCHFJOPGRGBAIJ-UKRRQHHQSA-N 1 2 314.256 4.383 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(Cl)c2Cl)[C@@H]1[C@H]1CCCO1 ZINC001460193827 1062689893 /nfs/dbraw/zinc/68/98/93/1062689893.db2.gz FCHFJOPGRGBAIJ-UKRRQHHQSA-N 1 2 314.256 4.383 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC2(C)CCC(C)CC2)c(C)[nH+]1 ZINC001476697943 1062702882 /nfs/dbraw/zinc/70/28/82/1062702882.db2.gz NRKBBDPOMYDXCQ-UHFFFAOYSA-N 1 2 303.450 4.345 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2CCC[C@H](C(C)C)C2)c(C)[nH+]1 ZINC001476697592 1062704784 /nfs/dbraw/zinc/70/47/84/1062704784.db2.gz BNQJFZVICJFCPW-HOTGVXAUSA-N 1 2 303.450 4.343 20 0 DIADLO Cc1c(F)ccc2c1N(Cc1ccc(-n3cc[nH+]c3)cc1)CCC2 ZINC001460255661 1062733256 /nfs/dbraw/zinc/73/32/56/1062733256.db2.gz UDZYHEGPOSFNNU-UHFFFAOYSA-N 1 2 321.399 4.273 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2)C[C@H](CC)O1 ZINC001460267100 1062740755 /nfs/dbraw/zinc/74/07/55/1062740755.db2.gz PCTAEPSUWPPSAW-GASCZTMLSA-N 1 2 301.352 4.095 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2cccc(C(F)(F)F)c2)C[C@H](CC)O1 ZINC001460267100 1062740775 /nfs/dbraw/zinc/74/07/75/1062740775.db2.gz PCTAEPSUWPPSAW-GASCZTMLSA-N 1 2 301.352 4.095 20 0 DIADLO CC[C@H]1C[NH+](Cc2cccc(C(F)(F)F)c2)C[C@H](CC)O1 ZINC001460267101 1062742854 /nfs/dbraw/zinc/74/28/54/1062742854.db2.gz PCTAEPSUWPPSAW-GJZGRUSLSA-N 1 2 301.352 4.095 20 0 DIADLO C[C@@H](NC(=O)Nc1ccc2[nH+]ccn2c1)c1cccc(C2CC2)c1 ZINC001476897556 1062744338 /nfs/dbraw/zinc/74/43/38/1062744338.db2.gz HZTIPDSFGNAJRX-CYBMUJFWSA-N 1 2 320.396 4.094 20 0 DIADLO CC(C)Cc1nnc([C@H](c2ccc(Cl)cc2)[NH+]2CCCC2)o1 ZINC001256450926 1062830197 /nfs/dbraw/zinc/83/01/97/1062830197.db2.gz ZNUNQSSJHRCWBC-INIZCTEOSA-N 1 2 319.836 4.107 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2CCO[C@H](CC(F)(F)F)C2)cc1 ZINC001460482808 1062874448 /nfs/dbraw/zinc/87/44/48/1062874448.db2.gz HSIAKWVHONWUHQ-MRXNPFEDSA-N 1 2 315.379 4.038 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2CCO[C@H](CC(F)(F)F)C2)cc1 ZINC001460482808 1062874461 /nfs/dbraw/zinc/87/44/61/1062874461.db2.gz HSIAKWVHONWUHQ-MRXNPFEDSA-N 1 2 315.379 4.038 20 0 DIADLO CN(C)c1cc(CN2CC(C)(C)c3cc(Cl)ccc32)cc[nH+]1 ZINC001460613453 1062932663 /nfs/dbraw/zinc/93/26/63/1062932663.db2.gz QYEKSPNVAJKMNY-UHFFFAOYSA-N 1 2 315.848 4.099 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2cc(Cl)cc(Cl)c2)c(C)[nH+]1 ZINC001278954743 1062934660 /nfs/dbraw/zinc/93/46/60/1062934660.db2.gz NDXGLZLRWMDFHA-UHFFFAOYSA-N 1 2 323.223 4.244 20 0 DIADLO CCC[C@H](C)CCC[NH2+][C@@](C)(Cc1ccc(F)cc1)C(=O)OC ZINC001460707058 1063002574 /nfs/dbraw/zinc/00/25/74/1063002574.db2.gz PWWUGGZWOFPLNI-KXBFYZLASA-N 1 2 323.452 4.106 20 0 DIADLO CC(=O)C[N@@H+](C)Cc1ccccc1Oc1ccc(F)c(Cl)c1 ZINC001460718444 1063008858 /nfs/dbraw/zinc/00/88/58/1063008858.db2.gz LUGOFIQNUAPFKK-UHFFFAOYSA-N 1 2 321.779 4.292 20 0 DIADLO CC(=O)C[N@H+](C)Cc1ccccc1Oc1ccc(F)c(Cl)c1 ZINC001460718444 1063008884 /nfs/dbraw/zinc/00/88/84/1063008884.db2.gz LUGOFIQNUAPFKK-UHFFFAOYSA-N 1 2 321.779 4.292 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@@H](CCC(C)C)C(C)(C)C)c[nH+]1 ZINC001477913153 1063017143 /nfs/dbraw/zinc/01/71/43/1063017143.db2.gz KXDAZRIDDSDDHT-KRWDZBQOSA-N 1 2 319.493 4.349 20 0 DIADLO c1cn(-c2ccccc2-c2nnc(CCC3CCCCC3)o2)c[nH+]1 ZINC001256850272 1063018139 /nfs/dbraw/zinc/01/81/39/1063018139.db2.gz UWKISWYZQAEVGU-UHFFFAOYSA-N 1 2 322.412 4.435 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC001460730124 1063024816 /nfs/dbraw/zinc/02/48/16/1063024816.db2.gz NVARAESVFDZFNV-RULNRJAQSA-N 1 2 323.305 4.068 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC001460730124 1063024839 /nfs/dbraw/zinc/02/48/39/1063024839.db2.gz NVARAESVFDZFNV-RULNRJAQSA-N 1 2 323.305 4.068 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)[C@H](C)CC2CCCCC2)[nH+]c1C ZINC001471859753 1063025295 /nfs/dbraw/zinc/02/52/95/1063025295.db2.gz SKWZCVSOFNMMIL-DYVFJYSZSA-N 1 2 317.477 4.297 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001460790615 1063058713 /nfs/dbraw/zinc/05/87/13/1063058713.db2.gz RZPZHAZRXYNFEK-LBPRGKRZSA-N 1 2 309.784 4.128 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001460790615 1063058735 /nfs/dbraw/zinc/05/87/35/1063058735.db2.gz RZPZHAZRXYNFEK-LBPRGKRZSA-N 1 2 309.784 4.128 20 0 DIADLO CC(C)C[C@H](C)CC(=O)N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC001472532985 1063095603 /nfs/dbraw/zinc/09/56/03/1063095603.db2.gz OFAWVQZYURTMBZ-JKSUJKDBSA-N 1 2 313.445 4.122 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1CCC=CCCC1 ZINC001472555407 1063101024 /nfs/dbraw/zinc/10/10/24/1063101024.db2.gz IQFXNWIJVBQQHR-OAHLLOKOSA-N 1 2 309.413 4.460 20 0 DIADLO c1cn(-c2cccc(-c3nnc(CC4CCCCC4)o3)c2)c[nH+]1 ZINC001257071799 1063101078 /nfs/dbraw/zinc/10/10/78/1063101078.db2.gz DEERHNYEWRXHBL-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2nnc(CC3CCCCC3)o2)c1 ZINC001257082678 1063105580 /nfs/dbraw/zinc/10/55/80/1063105580.db2.gz GFEWZGDELOHPDR-UHFFFAOYSA-N 1 2 322.412 4.260 20 0 DIADLO Cl/C=C(/Cl)C[N@@H+]1CCC[C@]2(C=Cc3ccccc3O2)C1 ZINC001460862316 1063106332 /nfs/dbraw/zinc/10/63/32/1063106332.db2.gz VKOMINSJECUZCC-DKGMDFAASA-N 1 2 310.224 4.246 20 0 DIADLO Cl/C=C(/Cl)C[N@H+]1CCC[C@]2(C=Cc3ccccc3O2)C1 ZINC001460862316 1063106346 /nfs/dbraw/zinc/10/63/46/1063106346.db2.gz VKOMINSJECUZCC-DKGMDFAASA-N 1 2 310.224 4.246 20 0 DIADLO C[C@H](c1ccc2c(c1)CCC2)[N@@H+]1CCn2nc(C(C)(C)C)cc2C1 ZINC001460884288 1063115276 /nfs/dbraw/zinc/11/52/76/1063115276.db2.gz RQEGPZCLPMPYEB-OAHLLOKOSA-N 1 2 323.484 4.246 20 0 DIADLO C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CCn2nc(C(C)(C)C)cc2C1 ZINC001460884288 1063115300 /nfs/dbraw/zinc/11/53/00/1063115300.db2.gz RQEGPZCLPMPYEB-OAHLLOKOSA-N 1 2 323.484 4.246 20 0 DIADLO C/C(=C/C1CCC(C)CC1)C(=O)NCc1c[nH+]c(C)cc1C ZINC001460887628 1063118010 /nfs/dbraw/zinc/11/80/10/1063118010.db2.gz BUJPIDCCOUZSRP-GDNBJRDFSA-N 1 2 300.446 4.087 20 0 DIADLO CCCCOc1cccc(Nc2[nH+]cnc3[nH]cc(CC)c32)c1 ZINC001472666093 1063132731 /nfs/dbraw/zinc/13/27/31/1063132731.db2.gz ASMOWHJMONPRGD-UHFFFAOYSA-N 1 2 310.401 4.443 20 0 DIADLO CCc1cc(NCc2ccc3[nH]c(C)c(C)c3c2)nc(CC)[nH+]1 ZINC001472673265 1063140314 /nfs/dbraw/zinc/14/03/14/1063140314.db2.gz JKCVFURJXUORTI-UHFFFAOYSA-N 1 2 308.429 4.312 20 0 DIADLO Cc1cccnc1[C@@H](C)[NH2+]Cc1csc(C2CCCC2)n1 ZINC001460935341 1063144583 /nfs/dbraw/zinc/14/45/83/1063144583.db2.gz LSITXXMKYJHABM-CYBMUJFWSA-N 1 2 301.459 4.355 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3ncccc3C)cs2)o1 ZINC001460938092 1063146229 /nfs/dbraw/zinc/14/62/29/1063146229.db2.gz QHYQUBCORHSFFE-ZDUSSCGKSA-N 1 2 313.426 4.266 20 0 DIADLO CCC[C@H](Cc1ccccc1)Nc1nc(C)[nH+]c2c1CCCC2 ZINC001472684812 1063147673 /nfs/dbraw/zinc/14/76/73/1063147673.db2.gz GZVYVJSNIWZQKI-QGZVFWFLSA-N 1 2 309.457 4.487 20 0 DIADLO CCCC[N@H+](C)c1ccc(Nc2ccc(C(F)(F)F)nn2)cc1 ZINC001472688760 1063152737 /nfs/dbraw/zinc/15/27/37/1063152737.db2.gz JKFHLQQNIAMNDM-UHFFFAOYSA-N 1 2 324.350 4.475 20 0 DIADLO CCCC[N@@H+](C)c1ccc(Nc2ccc(C(F)(F)F)nn2)cc1 ZINC001472688760 1063152750 /nfs/dbraw/zinc/15/27/50/1063152750.db2.gz JKFHLQQNIAMNDM-UHFFFAOYSA-N 1 2 324.350 4.475 20 0 DIADLO Cc1cccc(O[C@@H](C)CNc2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC001472700310 1063161203 /nfs/dbraw/zinc/16/12/03/1063161203.db2.gz NILZNRFPPYSJQO-HNNXBMFYSA-N 1 2 311.429 4.240 20 0 DIADLO Cc1cccc([C@H](C)CNc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001472702755 1063163370 /nfs/dbraw/zinc/16/33/70/1063163370.db2.gz LAGZENXGFAVINJ-OAHLLOKOSA-N 1 2 316.408 4.407 20 0 DIADLO Cc1cc(C)c2c(c1)CC[N@@H+](Cc1ncccc1C(F)(F)F)C2 ZINC001460978439 1063165938 /nfs/dbraw/zinc/16/59/38/1063165938.db2.gz RRVVYHFEHHQBEL-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C)c2c(c1)CC[N@H+](Cc1ncccc1C(F)(F)F)C2 ZINC001460978439 1063165955 /nfs/dbraw/zinc/16/59/55/1063165955.db2.gz RRVVYHFEHHQBEL-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO CCc1cc(NC[C@@H](C)Oc2ccc(Cl)cc2)nc(CC)[nH+]1 ZINC001472706569 1063166064 /nfs/dbraw/zinc/16/60/64/1063166064.db2.gz MOXUIYVEHCKVKW-GFCCVEGCSA-N 1 2 319.836 4.134 20 0 DIADLO CC(C)c1cc(N[C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)nc(C(C)C)[nH+]1 ZINC001472713150 1063171508 /nfs/dbraw/zinc/17/15/08/1063171508.db2.gz QTYWVVHOYSGEQK-XKQJLSEDSA-N 1 2 317.477 4.339 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H]2c2nnc([C@@H]3CC[N@@H+]3C(C)(C)C)o2)cc1 ZINC001257280124 1063176865 /nfs/dbraw/zinc/17/68/65/1063176865.db2.gz QJSRSYUZHKRFAI-JYJNAYRXSA-N 1 2 311.429 4.194 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H]2c2nnc([C@@H]3CC[N@H+]3C(C)(C)C)o2)cc1 ZINC001257280124 1063176872 /nfs/dbraw/zinc/17/68/72/1063176872.db2.gz QJSRSYUZHKRFAI-JYJNAYRXSA-N 1 2 311.429 4.194 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H]2c2nnc([C@H]3CC[N@@H+]3C(C)(C)C)o2)cc1 ZINC001257280123 1063177189 /nfs/dbraw/zinc/17/71/89/1063177189.db2.gz QJSRSYUZHKRFAI-HRCADAONSA-N 1 2 311.429 4.194 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H]2c2nnc([C@H]3CC[N@H+]3C(C)(C)C)o2)cc1 ZINC001257280123 1063177198 /nfs/dbraw/zinc/17/71/98/1063177198.db2.gz QJSRSYUZHKRFAI-HRCADAONSA-N 1 2 311.429 4.194 20 0 DIADLO CCc1cc(N2CC[C@H](Cc3ccccc3)[C@H]2C)nc(CC)[nH+]1 ZINC001472719182 1063180451 /nfs/dbraw/zinc/18/04/51/1063180451.db2.gz ZKDAPIYPPCWDNQ-NVXWUHKLSA-N 1 2 309.457 4.059 20 0 DIADLO CCC[C@@H](C)[NH2+][C@@H](CCc1ccccc1)C(=O)OC(C)(C)C ZINC001257310271 1063195784 /nfs/dbraw/zinc/19/57/84/1063195784.db2.gz SPTGIIWZAOMONP-WBVHZDCISA-N 1 2 305.462 4.108 20 0 DIADLO CC(C)c1cc(NCC[C@H]2CCO[C@H](C)C2)nc(C(C)C)[nH+]1 ZINC001472755726 1063209265 /nfs/dbraw/zinc/20/92/65/1063209265.db2.gz IZBCGDUPJHBHQL-CABCVRRESA-N 1 2 305.466 4.341 20 0 DIADLO CCCC(CCC)[NH2+][C@@H](C[NH3+])c1ccc(Br)cc1 ZINC001257330639 1063213751 /nfs/dbraw/zinc/21/37/51/1063213751.db2.gz UBALFZIHTRHWBT-HNNXBMFYSA-N 1 2 313.283 4.007 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1nc2c(s1)CCCC2 ZINC001461058209 1063226139 /nfs/dbraw/zinc/22/61/39/1063226139.db2.gz WQMCNCIHENALMD-NSHDSACASA-N 1 2 320.433 4.020 20 0 DIADLO Cc1nc(N2CCC[C@H](c3ccccc3)C2)c2c([nH+]1)CCCC2 ZINC001472789676 1063236297 /nfs/dbraw/zinc/23/62/97/1063236297.db2.gz QZONUKUHDGIWRB-KRWDZBQOSA-N 1 2 307.441 4.048 20 0 DIADLO CCCCOC(=O)CC[C@H](C)[N@@H+]1Cc2ccc(Cl)cc2C1 ZINC001257401616 1063253266 /nfs/dbraw/zinc/25/32/66/1063253266.db2.gz CSECCTZCIAUGGY-ZDUSSCGKSA-N 1 2 309.837 4.168 20 0 DIADLO CCCCOC(=O)CC[C@H](C)[N@H+]1Cc2ccc(Cl)cc2C1 ZINC001257401616 1063253274 /nfs/dbraw/zinc/25/32/74/1063253274.db2.gz CSECCTZCIAUGGY-ZDUSSCGKSA-N 1 2 309.837 4.168 20 0 DIADLO CC[C@@H](Nc1nc(C)[nH+]c(C)c1Br)[C@H]1CC1(C)C ZINC001472809169 1063255484 /nfs/dbraw/zinc/25/54/84/1063255484.db2.gz LFIKLQQYAVJTKJ-GHMZBOCLSA-N 1 2 312.255 4.093 20 0 DIADLO Cc1cc(N[C@@H]2C[C@H](OC(C)(C)C)C23CCC3)nc(C2CC2)[nH+]1 ZINC001472831849 1063272730 /nfs/dbraw/zinc/27/27/30/1063272730.db2.gz USCLPEFNCIBCAG-CABCVRRESA-N 1 2 315.461 4.201 20 0 DIADLO Cc1nc(N[C@H](C)c2ccc3c(c2)CCCO3)c2c([nH+]1)CCCC2 ZINC001472836457 1063276140 /nfs/dbraw/zinc/27/61/40/1063276140.db2.gz MWBQQRDOXKERIZ-CYBMUJFWSA-N 1 2 323.440 4.162 20 0 DIADLO c1[nH+]cn(CCNc2nc3ccccc3s2)c1-c1ccccc1 ZINC001472844452 1063280694 /nfs/dbraw/zinc/28/06/94/1063280694.db2.gz RHOIQCKKENNBHQ-UHFFFAOYSA-N 1 2 320.421 4.272 20 0 DIADLO CCC[C@H](C)CC[C@@H](C)[N@@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001257480102 1063299276 /nfs/dbraw/zinc/29/92/76/1063299276.db2.gz TZSMGWVAIZIDTR-ARFHVFGLSA-N 1 2 307.482 4.011 20 0 DIADLO CCC[C@H](C)CC[C@@H](C)[N@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001257480102 1063299295 /nfs/dbraw/zinc/29/92/95/1063299295.db2.gz TZSMGWVAIZIDTR-ARFHVFGLSA-N 1 2 307.482 4.011 20 0 DIADLO Cc1ccc(Cl)cc1CNc1nc(C)[nH+]c2c1CCCC2 ZINC001472894342 1063303069 /nfs/dbraw/zinc/30/30/69/1063303069.db2.gz STYUALQWXNIURD-UHFFFAOYSA-N 1 2 301.821 4.238 20 0 DIADLO CCC[C@H](C)CC[C@H](C)[N@@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001257480819 1063304646 /nfs/dbraw/zinc/30/46/46/1063304646.db2.gz ZADCUGFUDAPJJU-ULQDDVLXSA-N 1 2 321.509 4.401 20 0 DIADLO CCC[C@H](C)CC[C@H](C)[N@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001257480819 1063304667 /nfs/dbraw/zinc/30/46/67/1063304667.db2.gz ZADCUGFUDAPJJU-ULQDDVLXSA-N 1 2 321.509 4.401 20 0 DIADLO CCC[C@H](C)CC[C@H](C)[N@@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001257480820 1063305616 /nfs/dbraw/zinc/30/56/16/1063305616.db2.gz ZADCUGFUDAPJJU-YESZJQIVSA-N 1 2 321.509 4.401 20 0 DIADLO CCC[C@H](C)CC[C@H](C)[N@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001257480820 1063305630 /nfs/dbraw/zinc/30/56/30/1063305630.db2.gz ZADCUGFUDAPJJU-YESZJQIVSA-N 1 2 321.509 4.401 20 0 DIADLO CCNc1ccc(Nc2nc(-c3cccc(C)c3)ns2)c[nH+]1 ZINC001472904881 1063308287 /nfs/dbraw/zinc/30/82/87/1063308287.db2.gz CBUUVIAFCUINOV-UHFFFAOYSA-N 1 2 311.414 4.084 20 0 DIADLO CCNc1nc(SCc2ccc(C)[nH+]c2C)nc2ccccc21 ZINC001472961074 1063330604 /nfs/dbraw/zinc/33/06/04/1063330604.db2.gz MJUCWNRVFCVLKI-UHFFFAOYSA-N 1 2 324.453 4.366 20 0 DIADLO C[C@@H](Cc1ccc(Br)cc1)[N@@H+]1CCCC(F)(F)C1 ZINC001257559445 1063336819 /nfs/dbraw/zinc/33/68/19/1063336819.db2.gz FHNFBSQNIFUOKU-NSHDSACASA-N 1 2 318.205 4.111 20 0 DIADLO C[C@@H](Cc1ccc(Br)cc1)[N@H+]1CCCC(F)(F)C1 ZINC001257559445 1063336842 /nfs/dbraw/zinc/33/68/42/1063336842.db2.gz FHNFBSQNIFUOKU-NSHDSACASA-N 1 2 318.205 4.111 20 0 DIADLO Nc1[nH+]cccc1CSc1ncc(-c2ccc(Cl)cc2)o1 ZINC001472969618 1063337579 /nfs/dbraw/zinc/33/75/79/1063337579.db2.gz IBDNUZPBNXTSLT-UHFFFAOYSA-N 1 2 317.801 4.265 20 0 DIADLO FC1(F)C[N@@H+]([C@@H]2CCCSC2)CC[C@H]1Cc1ccccc1 ZINC001257685959 1063368493 /nfs/dbraw/zinc/36/84/93/1063368493.db2.gz XJUBEXGANBJVAC-JKSUJKDBSA-N 1 2 311.441 4.082 20 0 DIADLO FC1(F)C[N@H+]([C@@H]2CCCSC2)CC[C@H]1Cc1ccccc1 ZINC001257685959 1063368510 /nfs/dbraw/zinc/36/85/10/1063368510.db2.gz XJUBEXGANBJVAC-JKSUJKDBSA-N 1 2 311.441 4.082 20 0 DIADLO C[NH+](C)[C@@H](CNCc1cccc(F)c1F)c1ccc(Cl)cc1 ZINC001461266025 1063377293 /nfs/dbraw/zinc/37/72/93/1063377293.db2.gz RJNZZHZKUXFIOM-INIZCTEOSA-N 1 2 324.802 4.011 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@@H+]1CCc1cccc(Cl)c1Cl ZINC001473105507 1063401275 /nfs/dbraw/zinc/40/12/75/1063401275.db2.gz MCBBGYKTQYCWGQ-YPMHNXCESA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@H+]1CCc1cccc(Cl)c1Cl ZINC001473105507 1063401283 /nfs/dbraw/zinc/40/12/83/1063401283.db2.gz MCBBGYKTQYCWGQ-YPMHNXCESA-N 1 2 302.245 4.035 20 0 DIADLO CCCOc1cc(C)ccc1C[NH2+]Cc1nc2ccccc2o1 ZINC001461282185 1063388912 /nfs/dbraw/zinc/38/89/12/1063388912.db2.gz KEDZQRIUJASGLJ-UHFFFAOYSA-N 1 2 310.397 4.215 20 0 DIADLO COc1ccccc1Cc1cn(Cc2sccc2Cl)c[nH+]1 ZINC001473100747 1063399072 /nfs/dbraw/zinc/39/90/72/1063399072.db2.gz FYDPNBSSVRTKBF-UHFFFAOYSA-N 1 2 318.829 4.246 20 0 DIADLO CC(C)(C)Cc1nnc(/C=C/c2ccc(Cn3cc[nH+]c3)cc2)o1 ZINC001257830299 1063400751 /nfs/dbraw/zinc/40/07/51/1063400751.db2.gz DWAVJVZZPXKMKY-CMDGGOBGSA-N 1 2 322.412 4.073 20 0 DIADLO COc1ccccc1Cc1cn(C[C@@H]2CCCCC2(F)F)c[nH+]1 ZINC001473101571 1063401333 /nfs/dbraw/zinc/40/13/33/1063401333.db2.gz VIBQSRWITQMTJH-HNNXBMFYSA-N 1 2 320.383 4.308 20 0 DIADLO Cc1coc(-c2cc(NCc3cccc4[nH+]ccn43)ccc2C)n1 ZINC001461319560 1063416810 /nfs/dbraw/zinc/41/68/10/1063416810.db2.gz XQVAZXVXNKFKML-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3cc(F)cc4cccnc43)ccc21 ZINC001461331390 1063424103 /nfs/dbraw/zinc/42/41/03/1063424103.db2.gz PPKRTJNTLRUAHB-UHFFFAOYSA-N 1 2 321.399 4.368 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3cc(F)cc4cccnc43)ccc21 ZINC001461331390 1063424111 /nfs/dbraw/zinc/42/41/11/1063424111.db2.gz PPKRTJNTLRUAHB-UHFFFAOYSA-N 1 2 321.399 4.368 20 0 DIADLO COc1ccc(CNc2ccc(-n3cc[nH+]c3)c(C)c2)cc1C ZINC001461333404 1063424322 /nfs/dbraw/zinc/42/43/22/1063424322.db2.gz UXQMAXVDFXCTSH-UHFFFAOYSA-N 1 2 307.397 4.110 20 0 DIADLO CN(C)c1ccc(NCc2ccc(-c3ccccc3F)o2)c[nH+]1 ZINC001461331469 1063424550 /nfs/dbraw/zinc/42/45/50/1063424550.db2.gz MSSZSMYMTLHHOH-UHFFFAOYSA-N 1 2 311.360 4.159 20 0 DIADLO CCN(CC)c1ccc(NCc2cc(C)nc3c2CCCC3)c[nH+]1 ZINC001461366072 1063447202 /nfs/dbraw/zinc/44/72/02/1063447202.db2.gz DOVNCVKGJRADSG-UHFFFAOYSA-N 1 2 324.472 4.122 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](CC[C@@H]3C[C@H]3C3CC3)CCO2)cc1Cl ZINC001473144968 1063449102 /nfs/dbraw/zinc/44/91/02/1063449102.db2.gz NUVCGYWPVGTQPH-QIIPPGSGSA-N 1 2 323.839 4.289 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](CC[C@@H]3C[C@H]3C3CC3)CCO2)cc1Cl ZINC001473144968 1063449112 /nfs/dbraw/zinc/44/91/12/1063449112.db2.gz NUVCGYWPVGTQPH-QIIPPGSGSA-N 1 2 323.839 4.289 20 0 DIADLO Cc1nnsc1C[N@H+](Cc1ccccc1Cl)C1CCCC1 ZINC001473155136 1063460224 /nfs/dbraw/zinc/46/02/24/1063460224.db2.gz OKTRYYFJXFGXLF-UHFFFAOYSA-N 1 2 321.877 4.445 20 0 DIADLO Cc1nnsc1C[N@@H+](Cc1ccccc1Cl)C1CCCC1 ZINC001473155136 1063460231 /nfs/dbraw/zinc/46/02/31/1063460231.db2.gz OKTRYYFJXFGXLF-UHFFFAOYSA-N 1 2 321.877 4.445 20 0 DIADLO CCc1cccc(C[N@@H+]2CCO[C@H](c3ccccc3Cl)C2)c1 ZINC001473158156 1063461755 /nfs/dbraw/zinc/46/17/55/1063461755.db2.gz GTGHQRNOHUYBER-IBGZPJMESA-N 1 2 315.844 4.476 20 0 DIADLO CCc1cccc(C[N@H+]2CCO[C@H](c3ccccc3Cl)C2)c1 ZINC001473158156 1063461769 /nfs/dbraw/zinc/46/17/69/1063461769.db2.gz GTGHQRNOHUYBER-IBGZPJMESA-N 1 2 315.844 4.476 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H]2CCCOc3c(F)cccc32)s1 ZINC001461393301 1063469405 /nfs/dbraw/zinc/46/94/05/1063469405.db2.gz RORWQXAURUNSED-CQSZACIVSA-N 1 2 320.433 4.409 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cc(Br)cc(F)c2F)[C@@H]1C ZINC001473185497 1063494374 /nfs/dbraw/zinc/49/43/74/1063494374.db2.gz JFRBXOTVJIEJJZ-NXEZZACHSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cc(Br)cc(F)c2F)[C@@H]1C ZINC001473185497 1063494383 /nfs/dbraw/zinc/49/43/83/1063494383.db2.gz JFRBXOTVJIEJJZ-NXEZZACHSA-N 1 2 318.205 4.348 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@H](C)C[C@@H](C)CC(C)C)[C@@H]2C ZINC001258066426 1063494115 /nfs/dbraw/zinc/49/41/15/1063494115.db2.gz QKRVKAFDYLCIRG-GVDBMIGSSA-N 1 2 321.509 4.257 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@H](C)C[C@@H](C)CC(C)C)[C@@H]2C ZINC001258066426 1063494136 /nfs/dbraw/zinc/49/41/36/1063494136.db2.gz QKRVKAFDYLCIRG-GVDBMIGSSA-N 1 2 321.509 4.257 20 0 DIADLO CC(C)C[C@@H](C)C[C@H](C)[N@@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001258075710 1063501817 /nfs/dbraw/zinc/50/18/17/1063501817.db2.gz WKOKJLZCQZGCBX-CVEARBPZSA-N 1 2 319.493 4.011 20 0 DIADLO CC(C)C[C@@H](C)C[C@H](C)[N@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001258075710 1063501827 /nfs/dbraw/zinc/50/18/27/1063501827.db2.gz WKOKJLZCQZGCBX-CVEARBPZSA-N 1 2 319.493 4.011 20 0 DIADLO COC(=O)[C@@H](Cc1ccc(Cl)cc1)[NH2+][C@@H](C)CCC=C(C)C ZINC001258076536 1063502510 /nfs/dbraw/zinc/50/25/10/1063502510.db2.gz MZTAAHYDMDANQB-WMLDXEAASA-N 1 2 323.864 4.149 20 0 DIADLO FCC(CF)[NH2+]Cc1ccc(-c2cccc(Cl)c2)s1 ZINC001461526142 1063559184 /nfs/dbraw/zinc/55/91/84/1063559184.db2.gz GELBAPGQZUFQQF-UHFFFAOYSA-N 1 2 301.789 4.466 20 0 DIADLO C[C@H](CC(=O)N(C)c1ccc(-c2ccccc2)cc1)n1cc[nH+]c1 ZINC001514767362 1063611417 /nfs/dbraw/zinc/61/14/17/1063611417.db2.gz ASMCSCLTSLFASJ-MRXNPFEDSA-N 1 2 319.408 4.164 20 0 DIADLO CC(C)(C)C(F)(F)C[NH2+]Cc1ccc(OCC(F)F)cc1 ZINC001461652085 1063638653 /nfs/dbraw/zinc/63/86/53/1063638653.db2.gz IPHOYTOEHZPJGF-UHFFFAOYSA-N 1 2 307.331 4.102 20 0 DIADLO Cc1ccc(C[NH2+]Cc2c(Cl)cc(Cl)cc2N(C)C)o1 ZINC001461664818 1063645751 /nfs/dbraw/zinc/64/57/51/1063645751.db2.gz DGHVPZFNHIQJDI-UHFFFAOYSA-N 1 2 313.228 4.251 20 0 DIADLO Fc1cccc(C[NH2+]Cc2c(F)ccc(F)c2Cl)c1F ZINC001461667241 1063646394 /nfs/dbraw/zinc/64/63/94/1063646394.db2.gz BHVOUFJFIBLUQT-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO FC[C@@H]([NH2+]Cc1cnc2c(F)cccc2c1)c1ccc(F)cc1 ZINC001461700263 1063665897 /nfs/dbraw/zinc/66/58/97/1063665897.db2.gz TWFFOZWNLCZBRA-QGZVFWFLSA-N 1 2 316.326 4.313 20 0 DIADLO CC(C)Cc1ncc(C[NH2+][C@@H]2c3ccccc3CC[C@H]2F)s1 ZINC001461707769 1063672246 /nfs/dbraw/zinc/67/22/46/1063672246.db2.gz COGYEEMQFZSEOW-SJLPKXTDSA-N 1 2 318.461 4.457 20 0 DIADLO COc1nc2ccccc2cc1CNc1[nH]c2cc(C)ccc2[nH+]1 ZINC001461712766 1063673853 /nfs/dbraw/zinc/67/38/53/1063673853.db2.gz YJHJQXGNJWYSPO-UHFFFAOYSA-N 1 2 318.380 4.040 20 0 DIADLO COc1ccc(Cl)cc1CNc1[nH]c2cc(C)ccc2[nH+]1 ZINC001461719846 1063677917 /nfs/dbraw/zinc/67/79/17/1063677917.db2.gz YQJDELGBBOEQJH-UHFFFAOYSA-N 1 2 301.777 4.145 20 0 DIADLO Fc1ccc2nc(C[NH2+]Cc3cscc3Cl)sc2c1 ZINC001461752476 1063695353 /nfs/dbraw/zinc/69/53/53/1063695353.db2.gz HTAGLWKUUPJMLR-UHFFFAOYSA-N 1 2 312.822 4.440 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CC[C@@H]2c2ccccc2)cc1OC ZINC001461838083 1063744472 /nfs/dbraw/zinc/74/44/72/1063744472.db2.gz MCQQVJWYHQDXDT-MRXNPFEDSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CC[C@@H]2c2ccccc2)cc1OC ZINC001461838083 1063744482 /nfs/dbraw/zinc/74/44/82/1063744482.db2.gz MCQQVJWYHQDXDT-MRXNPFEDSA-N 1 2 317.816 4.304 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1Cl)[NH+]1CC2(C1)CCCCO2 ZINC001258678959 1063745974 /nfs/dbraw/zinc/74/59/74/1063745974.db2.gz XBFDOPRHESWKFZ-GFCCVEGCSA-N 1 2 314.256 4.179 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCO[C@H](c3cccc(F)c3)C2)s1 ZINC001461906228 1063789637 /nfs/dbraw/zinc/78/96/37/1063789637.db2.gz CXCZBDOGWJIRQB-SFHVURJKSA-N 1 2 319.445 4.413 20 0 DIADLO CCCc1ccc(C[N@H+]2CCO[C@H](c3cccc(F)c3)C2)s1 ZINC001461906228 1063789641 /nfs/dbraw/zinc/78/96/41/1063789641.db2.gz CXCZBDOGWJIRQB-SFHVURJKSA-N 1 2 319.445 4.413 20 0 DIADLO CCCC[C@@H](CCC)[N@H+]1Cc2nnc(C(F)(F)F)n2[C@@H](C)C1 ZINC001258767682 1063812420 /nfs/dbraw/zinc/81/24/20/1063812420.db2.gz XBUVUROTNRTLAF-NWDGAFQWSA-N 1 2 318.387 4.032 20 0 DIADLO CCCC[C@@H](CCC)[N@@H+]1Cc2nnc(C(F)(F)F)n2[C@@H](C)C1 ZINC001258767682 1063812427 /nfs/dbraw/zinc/81/24/27/1063812427.db2.gz XBUVUROTNRTLAF-NWDGAFQWSA-N 1 2 318.387 4.032 20 0 DIADLO Cc1ccc(-c2nnc(-c3cccc(-n4cc[nH+]c4)c3)o2)cc1F ZINC001258785551 1063823529 /nfs/dbraw/zinc/82/35/29/1063823529.db2.gz PCRAICYBWIOPDC-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CCn1nc(C[N@@H+]2CCc3cccc(F)c3[C@@H]2C)c2ccccc21 ZINC001461958940 1063837781 /nfs/dbraw/zinc/83/77/81/1063837781.db2.gz CSVYCMSNUCDEID-AWEZNQCLSA-N 1 2 323.415 4.315 20 0 DIADLO CCn1nc(C[N@H+]2CCc3cccc(F)c3[C@@H]2C)c2ccccc21 ZINC001461958940 1063837798 /nfs/dbraw/zinc/83/77/98/1063837798.db2.gz CSVYCMSNUCDEID-AWEZNQCLSA-N 1 2 323.415 4.315 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@@H+]2CCO[C@@H](c3ccco3)C2)c(C)c1 ZINC001461966943 1063845016 /nfs/dbraw/zinc/84/50/16/1063845016.db2.gz JJIYECVTJMSLHF-PEAOBZDDSA-N 1 2 311.425 4.292 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@H+]2CCO[C@@H](c3ccco3)C2)c(C)c1 ZINC001461966943 1063845023 /nfs/dbraw/zinc/84/50/23/1063845023.db2.gz JJIYECVTJMSLHF-PEAOBZDDSA-N 1 2 311.425 4.292 20 0 DIADLO C[N@H+](Cc1cn(C2CC2)cn1)Cc1cc(Cl)cc(Cl)c1 ZINC001461967418 1063845329 /nfs/dbraw/zinc/84/53/29/1063845329.db2.gz OHGAALHWKKIMGE-UHFFFAOYSA-N 1 2 310.228 4.157 20 0 DIADLO C[N@@H+](Cc1cn(C2CC2)cn1)Cc1cc(Cl)cc(Cl)c1 ZINC001461967418 1063845338 /nfs/dbraw/zinc/84/53/38/1063845338.db2.gz OHGAALHWKKIMGE-UHFFFAOYSA-N 1 2 310.228 4.157 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@@H+]1CCC[C@H]1c1cc(C)no1 ZINC001461970396 1063847960 /nfs/dbraw/zinc/84/79/60/1063847960.db2.gz HIVRKFKPAMFLHS-HNNXBMFYSA-N 1 2 320.820 4.372 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@H+]1CCC[C@H]1c1cc(C)no1 ZINC001461970396 1063847963 /nfs/dbraw/zinc/84/79/63/1063847963.db2.gz HIVRKFKPAMFLHS-HNNXBMFYSA-N 1 2 320.820 4.372 20 0 DIADLO Cc1cccc(C)c1NC(=O)CNc1cc(C)c2ccccc2[nH+]1 ZINC001261208089 1063911858 /nfs/dbraw/zinc/91/18/58/1063911858.db2.gz DRIVNUZVNUNRKT-UHFFFAOYSA-N 1 2 319.408 4.211 20 0 DIADLO CCCCC[C@@H]([NH2+]C[C@H](C)c1cccc(Cl)c1)C(=O)OC ZINC001462117992 1063937574 /nfs/dbraw/zinc/93/75/74/1063937574.db2.gz ZMAOFNKIWMNVEI-XJKSGUPXSA-N 1 2 311.853 4.155 20 0 DIADLO CC[C@@H](CC(F)F)C[N@@H+]1CCO[C@H](c2ccc(Cl)s2)C1 ZINC001261638381 1063939355 /nfs/dbraw/zinc/93/93/55/1063939355.db2.gz ZQJZVROLXDQPSV-QWRGUYRKSA-N 1 2 323.836 4.456 20 0 DIADLO CC[C@@H](CC(F)F)C[N@H+]1CCO[C@H](c2ccc(Cl)s2)C1 ZINC001261638381 1063939364 /nfs/dbraw/zinc/93/93/64/1063939364.db2.gz ZQJZVROLXDQPSV-QWRGUYRKSA-N 1 2 323.836 4.456 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1ncoc1C(C)C)C(C)(C)C ZINC001262334675 1063962058 /nfs/dbraw/zinc/96/20/58/1063962058.db2.gz DMRPEISAJBLUKB-KRWDZBQOSA-N 1 2 301.434 4.378 20 0 DIADLO CCCC(C)(C)C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001262824409 1063975246 /nfs/dbraw/zinc/97/52/46/1063975246.db2.gz JJVGMKNZMZSMEP-HNNXBMFYSA-N 1 2 319.493 4.170 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3c(C)cc(C)cc3Cl)ccn12 ZINC001264077805 1064014562 /nfs/dbraw/zinc/01/45/62/1064014562.db2.gz QUZGWONDWMQHTL-UHFFFAOYSA-N 1 2 313.788 4.165 20 0 DIADLO Cc1cc(C)c(NC(=O)CC(C)(C)CC(F)(F)F)c(C)[nH+]1 ZINC001264804546 1064138361 /nfs/dbraw/zinc/13/83/61/1064138361.db2.gz JWJZHAXRJLRMOV-UHFFFAOYSA-N 1 2 302.340 4.314 20 0 DIADLO CCN(CC)c1ccc(NCc2cccc(OC(C)C)c2)c[nH+]1 ZINC000390021807 1064144521 /nfs/dbraw/zinc/14/45/21/1064144521.db2.gz UKCKBSHIBVXMGB-UHFFFAOYSA-N 1 2 313.445 4.327 20 0 DIADLO Cc1ccc([C@H](C)Nc2cc(N3CCCCC3)nc[nH+]2)c(C)c1 ZINC000599533861 1064181649 /nfs/dbraw/zinc/18/16/49/1064181649.db2.gz QAUVDDSQNVUDQE-INIZCTEOSA-N 1 2 310.445 4.257 20 0 DIADLO Cc1ccc([C@H](C)Nc2cc(N3CCCCC3)[nH+]cn2)c(C)c1 ZINC000599533861 1064181656 /nfs/dbraw/zinc/18/16/56/1064181656.db2.gz QAUVDDSQNVUDQE-INIZCTEOSA-N 1 2 310.445 4.257 20 0 DIADLO Cc1cc(C)c(C(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)c(C)[nH+]1 ZINC001265153370 1064196935 /nfs/dbraw/zinc/19/69/35/1064196935.db2.gz VUNSIQKFHYNMSP-MAUKXSAKSA-N 1 2 308.425 4.025 20 0 DIADLO CC(C)c1ccc(C(=O)Nc2cccc3[nH+]ccn32)cc1Cl ZINC001265165210 1064198882 /nfs/dbraw/zinc/19/88/82/1064198882.db2.gz LWZZVGXIJGRQRD-UHFFFAOYSA-N 1 2 313.788 4.363 20 0 DIADLO CC[C@@H](C)c1cccc(NC(=O)Cc2cn3cccc(C)c3[nH+]2)c1 ZINC001279963106 1064372695 /nfs/dbraw/zinc/37/26/95/1064372695.db2.gz WFPOBCFNVIQWJJ-CQSZACIVSA-N 1 2 321.424 4.337 20 0 DIADLO CCC(C)(C)c1ccc(C(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001280275899 1064391032 /nfs/dbraw/zinc/39/10/32/1064391032.db2.gz SQHSQOTXJSXCKV-UHFFFAOYSA-N 1 2 307.397 4.274 20 0 DIADLO O=C(Nc1cc(Cl)cc(Cl)c1F)c1cccc2[nH+]ccn21 ZINC001288100862 1064511791 /nfs/dbraw/zinc/51/17/91/1064511791.db2.gz AIMRZUQNNBLZQO-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3C[C@H]3C3CCCC3)c2)[nH+]c1C ZINC001292074511 1064757552 /nfs/dbraw/zinc/75/75/52/1064757552.db2.gz ZACBLTIZTNAAGI-ROUUACIJSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1[nH+]c[nH]c1CC(=O)N(CCC(C)C)[C@@H](C)CCCC(C)C ZINC001294134774 1064848961 /nfs/dbraw/zinc/84/89/61/1064848961.db2.gz NNRIQJJEXVBBJG-INIZCTEOSA-N 1 2 321.509 4.350 20 0 DIADLO CCc1ccc(C(C)(C)C(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)cc1 ZINC001294769099 1064884433 /nfs/dbraw/zinc/88/44/33/1064884433.db2.gz RSHNEFLITCOTDC-UHFFFAOYSA-N 1 2 321.424 4.350 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1noc(C)n1)c1ccc(Cl)cc1)[C@H]1C[C@@H]1C ZINC000666122455 1065077897 /nfs/dbraw/zinc/07/78/97/1065077897.db2.gz NYEJJDRVNFLXDA-BLQKSXIESA-N 1 2 319.836 4.145 20 0 DIADLO CCc1cc(N(C)Cc2ccc(C(F)(F)F)cc2)nc(CC)[nH+]1 ZINC001306913665 1065202338 /nfs/dbraw/zinc/20/23/38/1065202338.db2.gz RUXJUIXNFAOKAK-UHFFFAOYSA-N 1 2 323.362 4.257 20 0 DIADLO CCc1cc(NC[C@H](Nc2ccccc2)C(C)C)nc(CC)[nH+]1 ZINC001306923416 1065206914 /nfs/dbraw/zinc/20/69/14/1065206914.db2.gz AUCSCLFUYORYSF-KRWDZBQOSA-N 1 2 312.461 4.150 20 0 DIADLO Cc1ccc([C@H](C)Nc2nc3ccccc3n3c[nH+]cc23)cc1 ZINC001306937765 1065212407 /nfs/dbraw/zinc/21/24/07/1065212407.db2.gz SEQXSKTZGFARLH-AWEZNQCLSA-N 1 2 302.381 4.364 20 0 DIADLO CC1CC[NH+](c2ccc(Nc3ncc(Cl)cn3)cc2)CC1 ZINC001306974936 1065230048 /nfs/dbraw/zinc/23/00/48/1065230048.db2.gz NAMPCHNFINKKCM-UHFFFAOYSA-N 1 2 302.809 4.110 20 0 DIADLO CCO[C@@H]1C[C@@H](N(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)C1(C)C ZINC001306976280 1065231216 /nfs/dbraw/zinc/23/12/16/1065231216.db2.gz LZLKBUHFSYEPFC-HZPDHXFCSA-N 1 2 319.493 4.363 20 0 DIADLO CCO[C@H]1C[C@@H](Nc2cc(C)[nH+]c(C3CC3)n2)C1(CC)CC ZINC001306982686 1065233968 /nfs/dbraw/zinc/23/39/68/1065233968.db2.gz NQXHVCOIZAGLEH-CABCVRRESA-N 1 2 303.450 4.058 20 0 DIADLO CCO[C@H]1C[C@H](Nc2cc(C)[nH+]c(C3CC3)n2)C1(CC)CC ZINC001306982687 1065234146 /nfs/dbraw/zinc/23/41/46/1065234146.db2.gz NQXHVCOIZAGLEH-GJZGRUSLSA-N 1 2 303.450 4.058 20 0 DIADLO Cc1nc(N2CC[C@@H](Cc3ccccc3)[C@@H]2C)c2c([nH+]1)CCCC2 ZINC001306988369 1065236634 /nfs/dbraw/zinc/23/66/34/1065236634.db2.gz BOAGEGPBIQDXDV-YJBOKZPZSA-N 1 2 321.468 4.121 20 0 DIADLO CC[C@@H]1CN(c2nc(C)[nH+]c(C)c2C)CC[C@H]1c1ccccc1 ZINC001306989452 1065238312 /nfs/dbraw/zinc/23/83/12/1065238312.db2.gz LFWFSLVMXPDAPT-IEBWSBKVSA-N 1 2 309.457 4.422 20 0 DIADLO CCCCO[C@H]1C[C@@H](Nc2cc(C)[nH+]c(C3CCC3)n2)C1(C)C ZINC001306989126 1065238395 /nfs/dbraw/zinc/23/83/95/1065238395.db2.gz AUQCYYBIDMPRAI-CVEARBPZSA-N 1 2 317.477 4.448 20 0 DIADLO CCc1cc(Nc2ccc([N@@H+]3CCCC[C@H]3C)cc2C)ncn1 ZINC001307001634 1065244568 /nfs/dbraw/zinc/24/45/68/1065244568.db2.gz ZSCALKDHWCPJKT-OAHLLOKOSA-N 1 2 310.445 4.470 20 0 DIADLO CCc1cc(Nc2ccc([N@H+]3CCCC[C@H]3C)cc2C)ncn1 ZINC001307001634 1065244582 /nfs/dbraw/zinc/24/45/82/1065244582.db2.gz ZSCALKDHWCPJKT-OAHLLOKOSA-N 1 2 310.445 4.470 20 0 DIADLO CO[C@@H]1[C@@H](C)[C@H](Nc2cc(C(C)C)[nH+]c(C(C)C)n2)C1(C)C ZINC001307079537 1065252630 /nfs/dbraw/zinc/25/26/30/1065252630.db2.gz XWVUPRXMHFOYOI-VBNZEHGJSA-N 1 2 305.466 4.195 20 0 DIADLO CCn1c[nH+]cc1/C=C(\Cl)c1nc2c(cccc2F)n1CC ZINC000901472623 1065256753 /nfs/dbraw/zinc/25/67/53/1065256753.db2.gz OYRKLHHYNCVOAZ-WQLSENKSSA-N 1 2 318.783 4.149 20 0 DIADLO CC(C)[C@@H](CC(F)(F)F)Nc1nc2ccccc2n2c[nH+]cc12 ZINC001307096061 1065261556 /nfs/dbraw/zinc/26/15/56/1065261556.db2.gz DAPZVUXHUNEWHC-GFCCVEGCSA-N 1 2 322.334 4.271 20 0 DIADLO Cc1nc(N(C)[C@@H]2CCC[C@H]2c2ccccc2)c2c([nH+]1)CCCC2 ZINC001307139903 1065281906 /nfs/dbraw/zinc/28/19/06/1065281906.db2.gz PTSKTFUZHWGPHX-FXAWDEMLSA-N 1 2 321.468 4.436 20 0 DIADLO CCCN(Cc1ccccc1F)c1nc(C)[nH+]c2c1CCCC2 ZINC001307168301 1065291800 /nfs/dbraw/zinc/29/18/00/1065291800.db2.gz RKNZXJAEMXXWLQ-UHFFFAOYSA-N 1 2 313.420 4.220 20 0 DIADLO CCC1(CC)CCCN(c2nc3ccccc3n3c[nH+]cc23)C1 ZINC001307168498 1065292357 /nfs/dbraw/zinc/29/23/57/1065292357.db2.gz LCCNOQPTDFTTTD-UHFFFAOYSA-N 1 2 308.429 4.289 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2NCC[C@@H]1CCCC1(C)C ZINC001307173014 1065293703 /nfs/dbraw/zinc/29/37/03/1065293703.db2.gz XLBMFVZNIACKAZ-ZDUSSCGKSA-N 1 2 315.465 4.210 20 0 DIADLO CC(C)(C)c1ccc(CNc2nc3ccccc3n3c[nH+]cc23)o1 ZINC001307187802 1065296330 /nfs/dbraw/zinc/29/63/30/1065296330.db2.gz BVUGWQJTXDINPJ-UHFFFAOYSA-N 1 2 320.396 4.385 20 0 DIADLO CCc1cc(N[C@@H]2[C@@H]3Cc4c(cccc4Cl)[C@@H]32)nc(CC)[nH+]1 ZINC001307185777 1065296651 /nfs/dbraw/zinc/29/66/51/1065296651.db2.gz TWFXDFGLTCWNID-JEBQAFNWSA-N 1 2 313.832 4.005 20 0 DIADLO CCC(CC)(CNc1nc(C)[nH+]c2c1CCCC2)C(F)(F)F ZINC001307190545 1065298239 /nfs/dbraw/zinc/29/82/39/1065298239.db2.gz VHIAYVJDFPSVOI-UHFFFAOYSA-N 1 2 315.383 4.444 20 0 DIADLO COc1ccc(CNc2cc(C)[nH+]c(C3CCC3)n2)cc1Cl ZINC001307203777 1065301964 /nfs/dbraw/zinc/30/19/64/1065301964.db2.gz BDMVGIPKCVMEOV-UHFFFAOYSA-N 1 2 317.820 4.327 20 0 DIADLO CC(C)c1ccc(-c2noc(Cn3c[nH+]c(C(C)(C)C)c3)n2)cc1 ZINC001307382102 1065363190 /nfs/dbraw/zinc/36/31/90/1065363190.db2.gz UWIKBRJHORHILW-UHFFFAOYSA-N 1 2 324.428 4.402 20 0 DIADLO CC(C)[N@H+](Cc1nc(C2CCC2)no1)Cc1cccc(Cl)c1 ZINC001307414390 1065374286 /nfs/dbraw/zinc/37/42/86/1065374286.db2.gz BCYOHXUNCSSUBP-UHFFFAOYSA-N 1 2 319.836 4.401 20 0 DIADLO CC(C)[N@@H+](Cc1nc(C2CCC2)no1)Cc1cccc(Cl)c1 ZINC001307414390 1065374294 /nfs/dbraw/zinc/37/42/94/1065374294.db2.gz BCYOHXUNCSSUBP-UHFFFAOYSA-N 1 2 319.836 4.401 20 0 DIADLO Cc1cc(C[NH+]2Cc3ccccc3-c3ccccc3C2)c(C)nn1 ZINC001307446869 1065407299 /nfs/dbraw/zinc/40/72/99/1065407299.db2.gz WLRXSTZPWDUALV-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO COC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccc(CC(C)C)cc1)C2 ZINC001307460591 1065413142 /nfs/dbraw/zinc/41/31/42/1065413142.db2.gz TZOWCZRRTGOKOZ-UHFFFAOYSA-N 1 2 323.436 4.188 20 0 DIADLO COC(=O)c1ccc2c(c1)C[N@H+](Cc1ccc(CC(C)C)cc1)C2 ZINC001307460591 1065413155 /nfs/dbraw/zinc/41/31/55/1065413155.db2.gz TZOWCZRRTGOKOZ-UHFFFAOYSA-N 1 2 323.436 4.188 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@@H]2c2cccn2C)nc1Cl ZINC001307524930 1065463937 /nfs/dbraw/zinc/46/39/37/1065463937.db2.gz YVJCPTWDUSAQTP-MRXNPFEDSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)nc1Cl ZINC001307524930 1065463942 /nfs/dbraw/zinc/46/39/42/1065463942.db2.gz YVJCPTWDUSAQTP-MRXNPFEDSA-N 1 2 303.837 4.109 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1c[nH]nn1)c1ccc(C2CCCCC2)cc1 ZINC001307538114 1065472562 /nfs/dbraw/zinc/47/25/62/1065472562.db2.gz BZQWPLNYZRXCLB-LJQANCHMSA-N 1 2 312.461 4.339 20 0 DIADLO CCc1cccc2c1N(Cc1ccc(-n3cc[nH+]c3)cc1)CCC2 ZINC001307554420 1065480717 /nfs/dbraw/zinc/48/07/17/1065480717.db2.gz OIFUHOHWOZARQK-UHFFFAOYSA-N 1 2 317.436 4.388 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1cccc(Cl)n1 ZINC001307589259 1065500290 /nfs/dbraw/zinc/50/02/90/1065500290.db2.gz UUQKJEDTUCJPDO-RYUDHWBXSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1cccc(Cl)n1 ZINC001307589259 1065500301 /nfs/dbraw/zinc/50/03/01/1065500301.db2.gz UUQKJEDTUCJPDO-RYUDHWBXSA-N 1 2 304.796 4.382 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+]([C@@H]3C=CCCCCC3)CCO2)c(F)c1 ZINC001307699776 1065569571 /nfs/dbraw/zinc/56/95/71/1065569571.db2.gz HKHICPLJSOQAHY-QAPCUYQASA-N 1 2 307.384 4.227 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+]([C@@H]3C=CCCCCC3)CCO2)c(F)c1 ZINC001307699776 1065569582 /nfs/dbraw/zinc/56/95/82/1065569582.db2.gz HKHICPLJSOQAHY-QAPCUYQASA-N 1 2 307.384 4.227 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+]([C@@H]3C=CCCCCC3)CCO2)c(F)c1 ZINC001307699774 1065570936 /nfs/dbraw/zinc/57/09/36/1065570936.db2.gz HKHICPLJSOQAHY-CRAIPNDOSA-N 1 2 307.384 4.227 20 0 DIADLO Fc1ccc([C@H]2C[N@H+]([C@@H]3C=CCCCCC3)CCO2)c(F)c1 ZINC001307699774 1065570945 /nfs/dbraw/zinc/57/09/45/1065570945.db2.gz HKHICPLJSOQAHY-CRAIPNDOSA-N 1 2 307.384 4.227 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2ccn(-c3ccccc3F)n2)c1 ZINC001307743856 1065600594 /nfs/dbraw/zinc/60/05/94/1065600594.db2.gz LZCWTSNZQRJCFL-UHFFFAOYSA-N 1 2 323.415 4.260 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2ccn(-c3ccccc3F)n2)c1 ZINC001307743856 1065600600 /nfs/dbraw/zinc/60/06/00/1065600600.db2.gz LZCWTSNZQRJCFL-UHFFFAOYSA-N 1 2 323.415 4.260 20 0 DIADLO C[C@@H]1CC[C@@H](c2ccccc2)[N@H+](Cc2cc(Cl)n(C)n2)C1 ZINC001307756456 1065607367 /nfs/dbraw/zinc/60/73/67/1065607367.db2.gz NWNZYEITTDOLKL-CJNGLKHVSA-N 1 2 303.837 4.047 20 0 DIADLO C[C@@H]1CC[C@@H](c2ccccc2)[N@@H+](Cc2cc(Cl)n(C)n2)C1 ZINC001307756456 1065607375 /nfs/dbraw/zinc/60/73/75/1065607375.db2.gz NWNZYEITTDOLKL-CJNGLKHVSA-N 1 2 303.837 4.047 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ccncc2Br)c1C ZINC001307793959 1065624442 /nfs/dbraw/zinc/62/44/42/1065624442.db2.gz RGVPZXXLXJJDEZ-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ccncc2Br)c1C ZINC001307793959 1065624447 /nfs/dbraw/zinc/62/44/47/1065624447.db2.gz RGVPZXXLXJJDEZ-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(CCC[N@@H+]2CCn3c(cc4ccccc43)C2)cc1 ZINC001307802981 1065630045 /nfs/dbraw/zinc/63/00/45/1065630045.db2.gz HLWWCBVVNBHYLD-UHFFFAOYSA-N 1 2 304.437 4.398 20 0 DIADLO Cc1ccc(CCC[N@H+]2CCn3c(cc4ccccc43)C2)cc1 ZINC001307802981 1065630053 /nfs/dbraw/zinc/63/00/53/1065630053.db2.gz HLWWCBVVNBHYLD-UHFFFAOYSA-N 1 2 304.437 4.398 20 0 DIADLO COc1nscc1C[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC001307824009 1065639936 /nfs/dbraw/zinc/63/99/36/1065639936.db2.gz OLWARTIAYAWNDA-INIZCTEOSA-N 1 2 314.454 4.269 20 0 DIADLO COc1nscc1C[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC001307824009 1065639938 /nfs/dbraw/zinc/63/99/38/1065639938.db2.gz OLWARTIAYAWNDA-INIZCTEOSA-N 1 2 314.454 4.269 20 0 DIADLO CCOc1ccccc1OCC[N@@H+]1Cc2ccc(Cl)cc2C1 ZINC001307829975 1065641882 /nfs/dbraw/zinc/64/18/82/1065641882.db2.gz VKSPKQYKMTXXAV-UHFFFAOYSA-N 1 2 317.816 4.133 20 0 DIADLO CCOc1ccccc1OCC[N@H+]1Cc2ccc(Cl)cc2C1 ZINC001307829975 1065641889 /nfs/dbraw/zinc/64/18/89/1065641889.db2.gz VKSPKQYKMTXXAV-UHFFFAOYSA-N 1 2 317.816 4.133 20 0 DIADLO CC[C@@H]1C[NH+](CCc2cc(Cl)cc(Cl)c2)C[C@@H](CC)O1 ZINC001307856553 1065655824 /nfs/dbraw/zinc/65/58/24/1065655824.db2.gz LTJGIEOFADYHAB-HZPDHXFCSA-N 1 2 316.272 4.425 20 0 DIADLO Cn1nc(C[N@@H+]2CC(C)(C)C[C@@H]2c2ccccc2)cc1Cl ZINC001307863987 1065657689 /nfs/dbraw/zinc/65/76/89/1065657689.db2.gz XXYOUQYXYHYIKB-OAHLLOKOSA-N 1 2 303.837 4.047 20 0 DIADLO Cn1nc(C[N@H+]2CC(C)(C)C[C@@H]2c2ccccc2)cc1Cl ZINC001307863987 1065657701 /nfs/dbraw/zinc/65/77/01/1065657701.db2.gz XXYOUQYXYHYIKB-OAHLLOKOSA-N 1 2 303.837 4.047 20 0 DIADLO Fc1cccc(Cl)c1[C@H]1C[N@H+](CC2CCCCC2)CCO1 ZINC001307901917 1065673660 /nfs/dbraw/zinc/67/36/60/1065673660.db2.gz XKBLMHKXBLJEPB-MRXNPFEDSA-N 1 2 311.828 4.433 20 0 DIADLO Fc1cccc(Cl)c1[C@H]1C[N@@H+](CC2CCCCC2)CCO1 ZINC001307901917 1065673663 /nfs/dbraw/zinc/67/36/63/1065673663.db2.gz XKBLMHKXBLJEPB-MRXNPFEDSA-N 1 2 311.828 4.433 20 0 DIADLO COC/C(C)=C/C[N@@H+]1C[C@H](c2cccc(Cl)c2)OCC1(C)C ZINC001307935033 1065688829 /nfs/dbraw/zinc/68/88/29/1065688829.db2.gz QLBHWXWJAOUQRA-LEHPZIBWSA-N 1 2 323.864 4.085 20 0 DIADLO COC/C(C)=C/C[N@H+]1C[C@H](c2cccc(Cl)c2)OCC1(C)C ZINC001307935033 1065688834 /nfs/dbraw/zinc/68/88/34/1065688834.db2.gz QLBHWXWJAOUQRA-LEHPZIBWSA-N 1 2 323.864 4.085 20 0 DIADLO Oc1ccc2c(c1)C[N@@H+](CCOc1cc(Cl)cc(Cl)c1)C2 ZINC001307948487 1065694508 /nfs/dbraw/zinc/69/45/08/1065694508.db2.gz ZWHXNCJKSBYCOL-UHFFFAOYSA-N 1 2 324.207 4.094 20 0 DIADLO Oc1ccc2c(c1)C[N@H+](CCOc1cc(Cl)cc(Cl)c1)C2 ZINC001307948487 1065694517 /nfs/dbraw/zinc/69/45/17/1065694517.db2.gz ZWHXNCJKSBYCOL-UHFFFAOYSA-N 1 2 324.207 4.094 20 0 DIADLO Cc1ccc2c(c1Br)C[N@@H+](C[C@@H]1CCC(C)(C)O1)C2 ZINC001307956049 1065700842 /nfs/dbraw/zinc/70/08/42/1065700842.db2.gz YGTMBOIIFNEKMH-ZDUSSCGKSA-N 1 2 324.262 4.031 20 0 DIADLO Cc1ccc2c(c1Br)C[N@H+](C[C@@H]1CCC(C)(C)O1)C2 ZINC001307956049 1065700854 /nfs/dbraw/zinc/70/08/54/1065700854.db2.gz YGTMBOIIFNEKMH-ZDUSSCGKSA-N 1 2 324.262 4.031 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@H+](Cc2cccnc2Cl)C1 ZINC001308014503 1065726657 /nfs/dbraw/zinc/72/66/57/1065726657.db2.gz HMYNCNTUBRKWFO-QGZVFWFLSA-N 1 2 304.796 4.196 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@@H+](Cc2cccnc2Cl)C1 ZINC001308014503 1065726667 /nfs/dbraw/zinc/72/66/67/1065726667.db2.gz HMYNCNTUBRKWFO-QGZVFWFLSA-N 1 2 304.796 4.196 20 0 DIADLO CC(C)COC(=O)C[NH2+][C@@H]1CCC(C)(C)C[C@@H]1c1ccccc1 ZINC001308024261 1065729256 /nfs/dbraw/zinc/72/92/56/1065729256.db2.gz SUHUIKZUBALQGW-QZTJIDSGSA-N 1 2 317.473 4.138 20 0 DIADLO CC(C)COC(=O)C[N@@H+]1CC[C@H](c2ccccc2Cl)C1(C)C ZINC001308033409 1065734072 /nfs/dbraw/zinc/73/40/72/1065734072.db2.gz BINSNKRFAZPGOK-OAHLLOKOSA-N 1 2 323.864 4.107 20 0 DIADLO CC(C)COC(=O)C[N@H+]1CC[C@H](c2ccccc2Cl)C1(C)C ZINC001308033409 1065734079 /nfs/dbraw/zinc/73/40/79/1065734079.db2.gz BINSNKRFAZPGOK-OAHLLOKOSA-N 1 2 323.864 4.107 20 0 DIADLO C[C@@H]1CCC[C@@H](CCN2CC[NH+](CCCOC(C)(C)C)CC2)C1 ZINC001308032823 1065734403 /nfs/dbraw/zinc/73/44/03/1065734403.db2.gz JNXFUNSBNVHSEJ-MOPGFXCFSA-N 1 2 324.553 4.026 20 0 DIADLO CC(C)c1cc([C@@H]2CCC[N@H+](CC=C(Cl)Cl)C2)n[nH]1 ZINC001308056413 1065745101 /nfs/dbraw/zinc/74/51/01/1065745101.db2.gz VWIJVHYGNSHGKD-LLVKDONJSA-N 1 2 302.249 4.032 20 0 DIADLO CC(C)c1cc([C@@H]2CCC[N@@H+](CC=C(Cl)Cl)C2)n[nH]1 ZINC001308056413 1065745114 /nfs/dbraw/zinc/74/51/14/1065745114.db2.gz VWIJVHYGNSHGKD-LLVKDONJSA-N 1 2 302.249 4.032 20 0 DIADLO CCOC(=O)[C@@H](CCCC(C)C)[NH2+]C[C@H]1CCCCC1(F)F ZINC001308063159 1065748477 /nfs/dbraw/zinc/74/84/77/1065748477.db2.gz DRODJJYENMVVKD-HUUCEWRRSA-N 1 2 319.436 4.160 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2Cc2cc(Cl)ccc2F)[nH+]c1C ZINC001308070959 1065750059 /nfs/dbraw/zinc/75/00/59/1065750059.db2.gz OHBPFBFWMOBARN-OAHLLOKOSA-N 1 2 307.800 4.156 20 0 DIADLO C[C@]12C[N@H+](CC(F)(F)c3ccc(F)cc3)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC001308118299 1065770264 /nfs/dbraw/zinc/77/02/64/1065770264.db2.gz HGVSBMFMYGBNIC-JSQNDZKTSA-N 1 2 307.359 4.062 20 0 DIADLO C[C@]12C[N@@H+](CC(F)(F)c3ccc(F)cc3)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC001308118299 1065770276 /nfs/dbraw/zinc/77/02/76/1065770276.db2.gz HGVSBMFMYGBNIC-JSQNDZKTSA-N 1 2 307.359 4.062 20 0 DIADLO c1nc(C2CC2)sc1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC001308180578 1065791447 /nfs/dbraw/zinc/79/14/47/1065791447.db2.gz LXQOUSUMGWSWBV-GOSISDBHSA-N 1 2 321.449 4.295 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](c2nc3ccccc3[nH]2)C(C)C)s1 ZINC001308201566 1065810346 /nfs/dbraw/zinc/81/03/46/1065810346.db2.gz LVUMSHZXZHFHGB-MRXNPFEDSA-N 1 2 314.458 4.069 20 0 DIADLO FC(F)Oc1ccc(NCc2cccc3[nH+]ccn32)cc1Cl ZINC001308214434 1065822267 /nfs/dbraw/zinc/82/22/67/1065822267.db2.gz BTUNGYYONPUQER-UHFFFAOYSA-N 1 2 323.730 4.201 20 0 DIADLO COc1ccc(-c2ccccc2C)cc1C[NH2+]Cc1nccs1 ZINC001308216300 1065824110 /nfs/dbraw/zinc/82/41/10/1065824110.db2.gz JOZOCIIMOZYZHM-UHFFFAOYSA-N 1 2 324.449 4.417 20 0 DIADLO Cc1ncc(C[NH2+]C(c2ccc(F)cc2)c2ccc(F)cc2)o1 ZINC001308258172 1065860542 /nfs/dbraw/zinc/86/05/42/1065860542.db2.gz YNMAXKSVLWRCGX-UHFFFAOYSA-N 1 2 314.335 4.140 20 0 DIADLO CC(C)c1csc(C[NH2+]Cc2cnc(-c3ccccc3)nc2)n1 ZINC001308305770 1065900951 /nfs/dbraw/zinc/90/09/51/1065900951.db2.gz XZRMJGZHAWZFLG-UHFFFAOYSA-N 1 2 324.453 4.013 20 0 DIADLO Cc1ccc(-c2ncc(CNc3ccc(N(C)C)c[nH+]3)s2)cc1 ZINC001308315820 1065909029 /nfs/dbraw/zinc/90/90/29/1065909029.db2.gz JQTMEFLWMZAOPN-UHFFFAOYSA-N 1 2 324.453 4.192 20 0 DIADLO CNc1ccc(C)cc1CNc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001308324461 1065912340 /nfs/dbraw/zinc/91/23/40/1065912340.db2.gz JCPLTZMOZXKVSV-UHFFFAOYSA-N 1 2 306.413 4.143 20 0 DIADLO CCc1cc(OC)ccc1CNc1ccc([NH+]2CCCC2)cc1 ZINC001308324731 1065913057 /nfs/dbraw/zinc/91/30/57/1065913057.db2.gz QNHBLFYNKVIGRQ-UHFFFAOYSA-N 1 2 310.441 4.470 20 0 DIADLO Fc1ccc(Cl)cc1C[NH2+][C@@H]1COc2ccc(Cl)cc21 ZINC001308326042 1065914144 /nfs/dbraw/zinc/91/41/44/1065914144.db2.gz YVVYRYWBJUCCTH-CQSZACIVSA-N 1 2 312.171 4.356 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+]Cc1cscc1Cl)CCC2 ZINC001308342113 1065926608 /nfs/dbraw/zinc/92/66/08/1065926608.db2.gz FTJNJHCPFHRDPP-CQSZACIVSA-N 1 2 309.866 4.346 20 0 DIADLO Cc1cc(NCc2cccc(OC3CC3)c2F)ccc1[NH+](C)C ZINC001308352808 1065934799 /nfs/dbraw/zinc/93/47/99/1065934799.db2.gz FEZSPKMFJJAYJM-UHFFFAOYSA-N 1 2 314.404 4.353 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1ccc2c(c1)CCCO2 ZINC001308356634 1065935977 /nfs/dbraw/zinc/93/59/77/1065935977.db2.gz KMXOLPIPCKBGGO-UHFFFAOYSA-N 1 2 312.413 4.196 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+]Cc2cc(C(C)(C)C)oc2C)[nH]1 ZINC001308394462 1065960161 /nfs/dbraw/zinc/96/01/61/1065960161.db2.gz PONOZRHLCACGDM-RYUDHWBXSA-N 1 2 318.465 4.368 20 0 DIADLO Clc1ccc(-c2ccc(C[NH2+][C@@H]3CCn4ccnc43)o2)cc1 ZINC001308413552 1065972302 /nfs/dbraw/zinc/97/23/02/1065972302.db2.gz SLSUXLGWVLTZTG-OAHLLOKOSA-N 1 2 313.788 4.031 20 0 DIADLO Cc1ccc(-c2ccc(CNc3cc(CO)cc[nH+]3)s2)cc1 ZINC001308442454 1065990644 /nfs/dbraw/zinc/99/06/44/1065990644.db2.gz HMTIYSSBASOJJO-UHFFFAOYSA-N 1 2 310.422 4.223 20 0 DIADLO Fc1cccc2cc(NCc3cc(-n4cc[nH+]c4)cs3)cnc12 ZINC001308456293 1066000711 /nfs/dbraw/zinc/00/07/11/1066000711.db2.gz WGDDLQIEQUIHOD-UHFFFAOYSA-N 1 2 324.384 4.233 20 0 DIADLO CCCn1cncc1CNc1ccc(Nc2ccccc2)c[nH+]1 ZINC001308470735 1066010653 /nfs/dbraw/zinc/01/06/53/1066010653.db2.gz DHXAHAMDFRTJCP-UHFFFAOYSA-N 1 2 307.401 4.044 20 0 DIADLO C[C@@H](c1ccccc1)N1CC[C@@H]([NH2+]CC(F)(F)C(C)(C)C)C1 ZINC001308471505 1066010964 /nfs/dbraw/zinc/01/09/64/1066010964.db2.gz PLMJCKPARDPVPC-GOEBONIOSA-N 1 2 310.432 4.093 20 0 DIADLO C[C@H](c1ccccc1)N1CC[C@H]([NH2+]CC(F)(F)C(C)(C)C)C1 ZINC001308471509 1066011208 /nfs/dbraw/zinc/01/12/08/1066011208.db2.gz PLMJCKPARDPVPC-ZBFHGGJFSA-N 1 2 310.432 4.093 20 0 DIADLO FC(F)Oc1ccccc1C[NH2+][C@H]1c2ccccc2CC[C@H]1F ZINC001308500220 1066030215 /nfs/dbraw/zinc/03/02/15/1066030215.db2.gz NXOAGOOJZNPTSN-WBVHZDCISA-N 1 2 321.342 4.403 20 0 DIADLO FC(F)Oc1ccccc1C[NH2+][C@@H]1c2ccccc2CC[C@H]1F ZINC001308500218 1066030579 /nfs/dbraw/zinc/03/05/79/1066030579.db2.gz NXOAGOOJZNPTSN-NVXWUHKLSA-N 1 2 321.342 4.403 20 0 DIADLO Cc1cc(NCc2ccc(Br)c(F)c2)c[nH+]c1C ZINC001308503753 1066032160 /nfs/dbraw/zinc/03/21/60/1066032160.db2.gz TZLAROJVYZYXGL-UHFFFAOYSA-N 1 2 309.182 4.212 20 0 DIADLO CC[C@@H]1CCC[C@@H](CNc2[nH+]c3ccccc3n2CCOC)C1 ZINC001308506936 1066033636 /nfs/dbraw/zinc/03/36/36/1066033636.db2.gz FXOKHVCTIACHTK-HZPDHXFCSA-N 1 2 315.461 4.311 20 0 DIADLO CCn1cnc(Cl)c1CNc1[nH+]c2ccccc2n1C(C)C ZINC001308507802 1066035017 /nfs/dbraw/zinc/03/50/17/1066035017.db2.gz QDCGPVVQEQHLMT-UHFFFAOYSA-N 1 2 317.824 4.099 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1cccc(F)c1 ZINC001308508592 1066035202 /nfs/dbraw/zinc/03/52/02/1066035202.db2.gz ZRTALRLXPGMSCR-UHFFFAOYSA-N 1 2 303.768 4.461 20 0 DIADLO COCc1ccc(CNc2[nH+]c3ccccc3n2C(C)C)cc1 ZINC001308507504 1066035584 /nfs/dbraw/zinc/03/55/84/1066035584.db2.gz MWTCRLFWYYMZOY-UHFFFAOYSA-N 1 2 309.413 4.376 20 0 DIADLO COc1cccc2[nH]c(NCc3ccc(C(F)F)c(F)c3)[nH+]c21 ZINC001308508360 1066036197 /nfs/dbraw/zinc/03/61/97/1066036197.db2.gz SNJIITYRYKAOPJ-UHFFFAOYSA-N 1 2 321.302 4.260 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1cccc2nsnc21 ZINC001308507110 1066036487 /nfs/dbraw/zinc/03/64/87/1066036487.db2.gz HRZCNLSPFCBRRT-UHFFFAOYSA-N 1 2 323.425 4.234 20 0 DIADLO COc1ccc(CNc2[nH+]c3ccccc3n2C(C)C)c(F)c1 ZINC001308508498 1066036649 /nfs/dbraw/zinc/03/66/49/1066036649.db2.gz XCKRVRSOIOORKW-UHFFFAOYSA-N 1 2 313.376 4.377 20 0 DIADLO CC(C)c1nc(CNc2[nH]c3ccc(Cl)cc3[nH+]2)cs1 ZINC001308510275 1066037808 /nfs/dbraw/zinc/03/78/08/1066037808.db2.gz PXMJAEZFRWGRFW-UHFFFAOYSA-N 1 2 306.822 4.408 20 0 DIADLO CC(C)c1nc(CNc2[nH]c3cc(Cl)ccc3[nH+]2)cs1 ZINC001308510275 1066037819 /nfs/dbraw/zinc/03/78/19/1066037819.db2.gz PXMJAEZFRWGRFW-UHFFFAOYSA-N 1 2 306.822 4.408 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1cccc(F)c1F ZINC001308552853 1066065923 /nfs/dbraw/zinc/06/59/23/1066065923.db2.gz WRSGETJGTOAXHR-UHFFFAOYSA-N 1 2 307.731 4.117 20 0 DIADLO Oc1ccc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)c(F)c1F ZINC001308572373 1066085588 /nfs/dbraw/zinc/08/55/88/1066085588.db2.gz BIOHYZOHXZZQOC-CYBMUJFWSA-N 1 2 307.340 4.381 20 0 DIADLO Oc1ccc(C[N@H+]2CCCCC[C@@H]2c2ccco2)c(F)c1F ZINC001308572373 1066085598 /nfs/dbraw/zinc/08/55/98/1066085598.db2.gz BIOHYZOHXZZQOC-CYBMUJFWSA-N 1 2 307.340 4.381 20 0 DIADLO CC(C)(C)c1ccc2c(c1)CC[N@@H+](Cc1cn(C3CC3)cn1)C2 ZINC001308585163 1066101039 /nfs/dbraw/zinc/10/10/39/1066101039.db2.gz XHTCULNKMCAVIL-UHFFFAOYSA-N 1 2 309.457 4.074 20 0 DIADLO CC(C)(C)c1ccc2c(c1)CC[N@H+](Cc1cn(C3CC3)cn1)C2 ZINC001308585163 1066101045 /nfs/dbraw/zinc/10/10/45/1066101045.db2.gz XHTCULNKMCAVIL-UHFFFAOYSA-N 1 2 309.457 4.074 20 0 DIADLO C[C@@H](Cc1ccsc1)[N@H+](C)Cc1csc(C(F)(F)F)n1 ZINC001308595984 1066107355 /nfs/dbraw/zinc/10/73/55/1066107355.db2.gz YBVAKZQMAZPHDC-VIFPVBQESA-N 1 2 320.405 4.286 20 0 DIADLO C[C@@H](Cc1ccsc1)[N@@H+](C)Cc1csc(C(F)(F)F)n1 ZINC001308595984 1066107359 /nfs/dbraw/zinc/10/73/59/1066107359.db2.gz YBVAKZQMAZPHDC-VIFPVBQESA-N 1 2 320.405 4.286 20 0 DIADLO CCc1cccc(F)c1C[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC001308598251 1066109235 /nfs/dbraw/zinc/10/92/35/1066109235.db2.gz ISVDAVZAMFQSHO-FZKQIMNGSA-N 1 2 319.445 4.412 20 0 DIADLO CCc1cccc(F)c1C[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC001308598251 1066109236 /nfs/dbraw/zinc/10/92/36/1066109236.db2.gz ISVDAVZAMFQSHO-FZKQIMNGSA-N 1 2 319.445 4.412 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ncc(C(C)(C)C)s1 ZINC001308600618 1066110946 /nfs/dbraw/zinc/11/09/46/1066110946.db2.gz LXMKGEDJVDBFOT-ZDUSSCGKSA-N 1 2 300.471 4.387 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ncc(C(C)(C)C)s1 ZINC001308600618 1066110950 /nfs/dbraw/zinc/11/09/50/1066110950.db2.gz LXMKGEDJVDBFOT-ZDUSSCGKSA-N 1 2 300.471 4.387 20 0 DIADLO C[N@H+](Cc1cc(O)cc(Cl)c1)Cc1cc(F)c(F)c(F)c1 ZINC001308637911 1066131467 /nfs/dbraw/zinc/13/14/67/1066131467.db2.gz AWKUDXURFSLXQF-UHFFFAOYSA-N 1 2 315.722 4.095 20 0 DIADLO C[N@@H+](Cc1cc(O)cc(Cl)c1)Cc1cc(F)c(F)c(F)c1 ZINC001308637911 1066131471 /nfs/dbraw/zinc/13/14/71/1066131471.db2.gz AWKUDXURFSLXQF-UHFFFAOYSA-N 1 2 315.722 4.095 20 0 DIADLO Cc1cc(C)cc(CC[NH2+][C@@H](CC(C)C)C(=O)OC(C)(C)C)c1 ZINC001308658109 1066140714 /nfs/dbraw/zinc/14/07/14/1066140714.db2.gz WFKFKEXFLNENSD-SFHVURJKSA-N 1 2 319.489 4.192 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCC[C@H]1c1ccccc1)C(=O)OC1CCCC1 ZINC001308706145 1066189517 /nfs/dbraw/zinc/18/95/17/1066189517.db2.gz YSPLIUSJGUZSJV-SNRMKQJTSA-N 1 2 315.457 4.177 20 0 DIADLO C[C@H]1CSc2ccc(Cl)cc2N(Cc2ccc[nH+]c2N)C1 ZINC001308795788 1066270148 /nfs/dbraw/zinc/27/01/48/1066270148.db2.gz AFFISCHCBBAVAL-LLVKDONJSA-N 1 2 319.861 4.066 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(F)c2OC(F)(F)F)[C@@H]1C1CC1 ZINC001308799822 1066275115 /nfs/dbraw/zinc/27/51/15/1066275115.db2.gz AIDAWSOTSLOJNR-CQSZACIVSA-N 1 2 317.326 4.345 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(F)c2OC(F)(F)F)[C@@H]1C1CC1 ZINC001308799822 1066275130 /nfs/dbraw/zinc/27/51/30/1066275130.db2.gz AIDAWSOTSLOJNR-CQSZACIVSA-N 1 2 317.326 4.345 20 0 DIADLO C[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2)C[C@H](C)C1)C(=O)OC(C)(C)C ZINC001308859241 1066338434 /nfs/dbraw/zinc/33/84/34/1066338434.db2.gz KRJFYWKUECQILB-BURFUSLBSA-N 1 2 317.473 4.279 20 0 DIADLO FC(F)[C@H](CCc1ccccc1)[NH2+]C[C@H]1CC1(Cl)Cl ZINC001308862789 1066342371 /nfs/dbraw/zinc/34/23/71/1066342371.db2.gz IGKANIIHUZLZEU-NEPJUHHUSA-N 1 2 308.199 4.036 20 0 DIADLO C/C=C\C[C@@H]1CCC[N@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC001308885571 1066366086 /nfs/dbraw/zinc/36/60/86/1066366086.db2.gz HXXWRIZPQDIPQZ-OTDNITJGSA-N 1 2 304.381 4.340 20 0 DIADLO C/C=C\C[C@@H]1CCC[N@@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC001308885571 1066366108 /nfs/dbraw/zinc/36/61/08/1066366108.db2.gz HXXWRIZPQDIPQZ-OTDNITJGSA-N 1 2 304.381 4.340 20 0 DIADLO CC(C)C1(C[NH2+]c2ccc(N3CCOC[C@H]3C)c(Cl)c2)CC1 ZINC001308887042 1066368261 /nfs/dbraw/zinc/36/82/61/1066368261.db2.gz DLSDVYCPEYUCFW-CQSZACIVSA-N 1 2 322.880 4.413 20 0 DIADLO Clc1cc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)ccc1-c1ccccc1 ZINC001308898603 1066377180 /nfs/dbraw/zinc/37/71/80/1066377180.db2.gz HMASPUYQXBUGGC-CALCHBBNSA-N 1 2 313.828 4.370 20 0 DIADLO Clc1cc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)ccc1-c1ccccc1 ZINC001308898603 1066377189 /nfs/dbraw/zinc/37/71/89/1066377189.db2.gz HMASPUYQXBUGGC-CALCHBBNSA-N 1 2 313.828 4.370 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3ccc(Cl)c(C)c3C2)o1 ZINC001308911147 1066389160 /nfs/dbraw/zinc/38/91/60/1066389160.db2.gz SBAAVMXQEGWRGT-UHFFFAOYSA-N 1 2 305.805 4.198 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3ccc(Cl)c(C)c3C2)o1 ZINC001308911147 1066389176 /nfs/dbraw/zinc/38/91/76/1066389176.db2.gz SBAAVMXQEGWRGT-UHFFFAOYSA-N 1 2 305.805 4.198 20 0 DIADLO COC(=O)CCC[C@@H]1CCC[C@@H](Nc2c[nH+]c(C)c(C)c2)C1 ZINC001308917988 1066397136 /nfs/dbraw/zinc/39/71/36/1066397136.db2.gz IHEVTXDZXAQJOI-JKSUJKDBSA-N 1 2 304.434 4.012 20 0 DIADLO COC(=O)[C@H]([NH2+]C[C@@H](C)C(C)(C)C)c1cccc2ccccc21 ZINC001308940022 1066410405 /nfs/dbraw/zinc/41/04/05/1066410405.db2.gz MNRYXCPYJCUHEU-RDTXWAMCSA-N 1 2 313.441 4.326 20 0 DIADLO COc1nscc1C[N@H+](C)Cc1ccc(C2CCC2)cc1 ZINC001308955778 1066418747 /nfs/dbraw/zinc/41/87/47/1066418747.db2.gz WCMASPJWIBGRNG-UHFFFAOYSA-N 1 2 302.443 4.051 20 0 DIADLO COc1nscc1C[N@@H+](C)Cc1ccc(C2CCC2)cc1 ZINC001308955778 1066418754 /nfs/dbraw/zinc/41/87/54/1066418754.db2.gz WCMASPJWIBGRNG-UHFFFAOYSA-N 1 2 302.443 4.051 20 0 DIADLO CC(C)N(C)c1ccc(C[N@@H+]2CC[C@H]2c2ccc(F)cc2)cn1 ZINC001308966989 1066423212 /nfs/dbraw/zinc/42/32/12/1066423212.db2.gz GZIWGJKSLKHBAE-SFHVURJKSA-N 1 2 313.420 4.012 20 0 DIADLO CC(C)N(C)c1ccc(C[N@H+]2CC[C@H]2c2ccc(F)cc2)cn1 ZINC001308966989 1066423215 /nfs/dbraw/zinc/42/32/15/1066423215.db2.gz GZIWGJKSLKHBAE-SFHVURJKSA-N 1 2 313.420 4.012 20 0 DIADLO CC(C)N(C)c1ccc(C[N@@H+]2CC[C@@H]2c2ccc(F)cc2)cn1 ZINC001308966988 1066423651 /nfs/dbraw/zinc/42/36/51/1066423651.db2.gz GZIWGJKSLKHBAE-GOSISDBHSA-N 1 2 313.420 4.012 20 0 DIADLO CC(C)N(C)c1ccc(C[N@H+]2CC[C@@H]2c2ccc(F)cc2)cn1 ZINC001308966988 1066423659 /nfs/dbraw/zinc/42/36/59/1066423659.db2.gz GZIWGJKSLKHBAE-GOSISDBHSA-N 1 2 313.420 4.012 20 0 DIADLO Cc1cc(NC(=O)NCC[C@@H]2C[C@H](C)CC(C)(C)C2)c(C)c[nH+]1 ZINC001310450372 1066525046 /nfs/dbraw/zinc/52/50/46/1066525046.db2.gz FQOPJQSPORMBBV-XJKSGUPXSA-N 1 2 317.477 4.094 20 0 DIADLO Cc1cc(C)c(NC(=O)NC2(C)CCC(C)(C)CC2)c(C)[nH+]1 ZINC001310835579 1066566874 /nfs/dbraw/zinc/56/68/74/1066566874.db2.gz WLFDYHDKVMWCKI-UHFFFAOYSA-N 1 2 303.450 4.487 20 0 DIADLO CC(C)c1noc([C@H](C)[NH2+][C@H](C)c2ccc3c(c2)CCCC3)n1 ZINC000079291108 185163616 /nfs/dbraw/zinc/16/36/16/185163616.db2.gz CNABWMNDTNFPQN-KGLIPLIRSA-N 1 2 313.445 4.484 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1cnc(Cl)s1 ZINC000079316792 185164779 /nfs/dbraw/zinc/16/47/79/185164779.db2.gz WJJHEIWKCLLMQB-MRVPVSSYSA-N 1 2 302.777 4.268 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cnc(Cl)s1 ZINC000079316792 185164780 /nfs/dbraw/zinc/16/47/80/185164780.db2.gz WJJHEIWKCLLMQB-MRVPVSSYSA-N 1 2 302.777 4.268 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@H+](Cc2nc(Cl)ccc2Cl)C1 ZINC000088420044 185249531 /nfs/dbraw/zinc/24/95/31/185249531.db2.gz VMBCKIACSIVAFO-MRVPVSSYSA-N 1 2 313.150 4.163 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2nc(Cl)ccc2Cl)C1 ZINC000088420044 185249532 /nfs/dbraw/zinc/24/95/32/185249532.db2.gz VMBCKIACSIVAFO-MRVPVSSYSA-N 1 2 313.150 4.163 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccccc1OC(F)F ZINC000090458637 185297637 /nfs/dbraw/zinc/29/76/37/185297637.db2.gz LKYANPHAQJBZKJ-JTQLQIEISA-N 1 2 324.396 4.473 20 0 DIADLO CCC(CC)(CC)[S@@](=O)Cc1cn2cc(Cl)ccc2[nH+]1 ZINC000190564450 334949616 /nfs/dbraw/zinc/94/96/16/334949616.db2.gz YMNFKVJFQNNCDJ-FQEVSTJZSA-N 1 2 312.866 4.205 20 0 DIADLO Cc1ccc(C(=O)N(C)Cc2ccco2)cc1Oc1cc[nH+]cc1 ZINC000115005832 185655770 /nfs/dbraw/zinc/65/57/70/185655770.db2.gz WRHKJONFVDIOQK-UHFFFAOYSA-N 1 2 322.364 4.048 20 0 DIADLO CCCCc1nc(C[NH2+]C(C)(C)c2nc(C)cs2)cs1 ZINC000072663001 191210136 /nfs/dbraw/zinc/21/01/36/191210136.db2.gz XDHXHFWDWDZENN-UHFFFAOYSA-N 1 2 309.504 4.276 20 0 DIADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@H+](C)Cc1nccn1C(F)F ZINC000072766511 191227366 /nfs/dbraw/zinc/22/73/66/191227366.db2.gz UKSJFOLWZOXUPW-VIFPVBQESA-N 1 2 317.742 4.264 20 0 DIADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+](C)Cc1nccn1C(F)F ZINC000072766511 191227368 /nfs/dbraw/zinc/22/73/68/191227368.db2.gz UKSJFOLWZOXUPW-VIFPVBQESA-N 1 2 317.742 4.264 20 0 DIADLO Clc1ccc2[nH]c(SCc3cn4ccccc4[nH+]3)nc2c1 ZINC000004406709 181107179 /nfs/dbraw/zinc/10/71/79/181107179.db2.gz JVLNKRMNEKTZFY-UHFFFAOYSA-N 1 2 314.801 4.156 20 0 DIADLO CCCCO[C@H](C)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000078651394 191905442 /nfs/dbraw/zinc/90/54/42/191905442.db2.gz DDLVBCNVDGTDDW-CQSZACIVSA-N 1 2 314.385 4.018 20 0 DIADLO Cc1ccc(NC(=O)N[C@H](CC(C)(C)C)C(F)(F)F)c(C)[nH+]1 ZINC000181786703 334982297 /nfs/dbraw/zinc/98/22/97/334982297.db2.gz GKMDOBMSGQGOJA-GFCCVEGCSA-N 1 2 317.355 4.187 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2nc3ccccc3n2C)cs1 ZINC000091337247 193043985 /nfs/dbraw/zinc/04/39/85/193043985.db2.gz CXHJPIIYNONTAQ-NEPJUHHUSA-N 1 2 314.458 4.004 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1csc(-c2ccsc2)n1 ZINC000091704688 193094812 /nfs/dbraw/zinc/09/48/12/193094812.db2.gz BRBPFKRKLBLYPR-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1csc(-c2ccsc2)n1 ZINC000091704688 193094814 /nfs/dbraw/zinc/09/48/14/193094814.db2.gz BRBPFKRKLBLYPR-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO CC(C)[C@H]([NH2+][C@H](C)c1nccs1)c1nc2ccccc2[nH]1 ZINC000093401138 193245083 /nfs/dbraw/zinc/24/50/83/193245083.db2.gz SDLGIHOORJGQLM-RISCZKNCSA-N 1 2 300.431 4.067 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1CC(=O)Nc1cc(Cl)ccc1Cl ZINC000009997674 181652766 /nfs/dbraw/zinc/65/27/66/181652766.db2.gz NLQCOEJSLUJKEL-PHIMTYICSA-N 1 2 315.244 4.195 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1CC(=O)Nc1cc(Cl)ccc1Cl ZINC000009997674 181652769 /nfs/dbraw/zinc/65/27/69/181652769.db2.gz NLQCOEJSLUJKEL-PHIMTYICSA-N 1 2 315.244 4.195 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C34CC5CC(CC(C5)C3)C4)cc2[nH+]1 ZINC000017876965 182086827 /nfs/dbraw/zinc/08/68/27/182086827.db2.gz JQVAPSAFBZZRHW-UHFFFAOYSA-N 1 2 309.413 4.026 20 0 DIADLO Cc1nc([C@@H]([NH2+]CCCC(C)C)c2ccc(Cl)cc2)no1 ZINC000525864333 335032140 /nfs/dbraw/zinc/03/21/40/335032140.db2.gz JLOCNCNXZDVXHZ-HNNXBMFYSA-N 1 2 307.825 4.147 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H]2CCSc3ccc(F)cc32)cs1 ZINC000036968757 182856966 /nfs/dbraw/zinc/85/69/66/182856966.db2.gz LSPUHHRZTKUSMD-ZANVPECISA-N 1 2 308.447 4.478 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1sccc1Br ZINC000043503142 183367450 /nfs/dbraw/zinc/36/74/50/183367450.db2.gz TVJSWOOICOLFHS-UHFFFAOYSA-N 1 2 302.262 4.204 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1sccc1Br ZINC000043503142 183367452 /nfs/dbraw/zinc/36/74/52/183367452.db2.gz TVJSWOOICOLFHS-UHFFFAOYSA-N 1 2 302.262 4.204 20 0 DIADLO CC(C)Cc1noc(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)n1 ZINC000104707417 194029508 /nfs/dbraw/zinc/02/95/08/194029508.db2.gz FBWMKRMVRUZJIN-UHFFFAOYSA-N 1 2 319.836 4.091 20 0 DIADLO CCCCc1nc(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)no1 ZINC000104708145 194029686 /nfs/dbraw/zinc/02/96/86/194029686.db2.gz CEODMGCCDCEAAM-UHFFFAOYSA-N 1 2 319.836 4.235 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCC2)n1 ZINC000104703759 194029940 /nfs/dbraw/zinc/02/99/40/194029940.db2.gz PDRVDDDURZTVGL-GOSISDBHSA-N 1 2 317.408 4.182 20 0 DIADLO CC(C)(C)c1noc(C[NH2+][C@H](c2ccc(F)cc2)C2CCC2)n1 ZINC000104703635 194029023 /nfs/dbraw/zinc/02/90/23/194029023.db2.gz BUXYJQNAZGHLJW-INIZCTEOSA-N 1 2 317.408 4.137 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1ccc(Cl)s1 ZINC000193114271 335042920 /nfs/dbraw/zinc/04/29/20/335042920.db2.gz HARFIRDNYVSUHJ-BDAKNGLRSA-N 1 2 313.854 4.494 20 0 DIADLO CCCc1csc(C[N@H+](C)Cc2ccccc2OCC)n1 ZINC000426040519 335044244 /nfs/dbraw/zinc/04/42/44/335044244.db2.gz WFQJNUXVPSLKLZ-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO CCCc1csc(C[N@@H+](C)Cc2ccccc2OCC)n1 ZINC000426040519 335044246 /nfs/dbraw/zinc/04/42/46/335044246.db2.gz WFQJNUXVPSLKLZ-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2C(F)(F)F)C2CC2)oc1C ZINC000064142222 184292702 /nfs/dbraw/zinc/29/27/02/184292702.db2.gz ZTENBGHULZXICI-UHFFFAOYSA-N 1 2 324.346 4.475 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2C(F)(F)F)C2CC2)oc1C ZINC000064142222 184292704 /nfs/dbraw/zinc/29/27/04/184292704.db2.gz ZTENBGHULZXICI-UHFFFAOYSA-N 1 2 324.346 4.475 20 0 DIADLO Cc1cc(NC(=O)N(C)Cc2ccccc2C(F)(F)F)cc[nH+]1 ZINC000119669340 195013897 /nfs/dbraw/zinc/01/38/97/195013897.db2.gz BMYUGFGNBRIJMH-UHFFFAOYSA-N 1 2 323.318 4.073 20 0 DIADLO CC[C@@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1ccc(Cl)s1 ZINC000272299719 130016669 /nfs/dbraw/zinc/01/66/69/130016669.db2.gz QFHKKLNIWHEXIC-SECBINFHSA-N 1 2 313.854 4.323 20 0 DIADLO CC[C@@H](C)[C@@H](C)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000272539356 130039580 /nfs/dbraw/zinc/03/95/80/130039580.db2.gz KXSNTJPVAIICAT-HUUCEWRRSA-N 1 2 323.440 4.223 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+](C)Cc2ccc(Cl)c(Cl)c2)s1 ZINC000273202633 130097673 /nfs/dbraw/zinc/09/76/73/130097673.db2.gz RVIWLZRILCDIPC-MRVPVSSYSA-N 1 2 316.257 4.346 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)s1 ZINC000273202633 130097675 /nfs/dbraw/zinc/09/76/75/130097675.db2.gz RVIWLZRILCDIPC-MRVPVSSYSA-N 1 2 316.257 4.346 20 0 DIADLO CCc1nnc(C[NH2+][C@H](c2ccccc2F)C2CCCC2)s1 ZINC000273238487 130099839 /nfs/dbraw/zinc/09/98/39/130099839.db2.gz XDEIFIUFQLTEIF-KRWDZBQOSA-N 1 2 319.449 4.261 20 0 DIADLO Cc1c([C@H](C)[NH2+]Cc2csc(C3CCCCC3)n2)cnn1C ZINC000273399046 130117393 /nfs/dbraw/zinc/11/73/93/130117393.db2.gz LVMLGJBXGGNFTL-LBPRGKRZSA-N 1 2 318.490 4.084 20 0 DIADLO Cc1ccsc1[C@@H]1C[C@H]1c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000273977430 130194176 /nfs/dbraw/zinc/19/41/76/130194176.db2.gz QZWWTZCBEZYHIR-ZIAGYGMSSA-N 1 2 311.410 4.005 20 0 DIADLO Cc1ccc(C[C@H](C)c2nc(Cc3ccc(C)[nH+]c3)no2)cc1 ZINC000273986029 130194983 /nfs/dbraw/zinc/19/49/83/130194983.db2.gz SEZKWBFOXCMVEC-AWEZNQCLSA-N 1 2 307.397 4.018 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nnc(C)s1)c1ccc(Cl)s1 ZINC000274182691 130214220 /nfs/dbraw/zinc/21/42/20/130214220.db2.gz JAFRDMGJPWSKAQ-CBAPKCEASA-N 1 2 301.868 4.363 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2nc(Cl)ccc2Cl)s1 ZINC000274287203 130223085 /nfs/dbraw/zinc/22/30/85/130223085.db2.gz FJXMLZWHMGZRRA-UHFFFAOYSA-N 1 2 316.257 4.178 20 0 DIADLO CSc1ccc(NCc2ccc3c(c2)COC(C)(C)O3)[nH+]c1 ZINC000274419967 130233838 /nfs/dbraw/zinc/23/38/38/130233838.db2.gz XUXIALDSHVQTCB-UHFFFAOYSA-N 1 2 316.426 4.061 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@@H]2CCc3c2cccc3O)cs1 ZINC000274433867 130234006 /nfs/dbraw/zinc/23/40/06/130234006.db2.gz KLWYUFMAAUVPOV-SMDDNHRTSA-N 1 2 302.443 4.310 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+][C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000274616199 130250131 /nfs/dbraw/zinc/25/01/31/130250131.db2.gz OOMRQEWHFAVTEH-ZJUUUORDSA-N 1 2 315.364 4.277 20 0 DIADLO Cc1csc(C2([NH2+][C@@H](C)c3ccc(Cl)cn3)CCC2)n1 ZINC000274737778 130258101 /nfs/dbraw/zinc/25/81/01/130258101.db2.gz DRURSXGUWQKNEY-NSHDSACASA-N 1 2 307.850 4.230 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cc(F)cc(Cl)c1)c1nc(C2CC2)no1 ZINC000274940867 130276314 /nfs/dbraw/zinc/27/63/14/130276314.db2.gz BCEWFZQZEGNDFK-CQSZACIVSA-N 1 2 323.799 4.226 20 0 DIADLO CCc1ccc([C@H](C)[NH2+]Cc2nc3cc(Cl)ccc3n2C)o1 ZINC000275283105 130302889 /nfs/dbraw/zinc/30/28/89/130302889.db2.gz FBLUSFVFMFXSEA-NSHDSACASA-N 1 2 317.820 4.233 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+]Cc2nc3cc(Cl)ccc3n2C)o1 ZINC000275283099 130303019 /nfs/dbraw/zinc/30/30/19/130303019.db2.gz FBLUSFVFMFXSEA-LLVKDONJSA-N 1 2 317.820 4.233 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncn(C)n1)c1ccc(Oc2ccccc2)cc1 ZINC000275709898 130368548 /nfs/dbraw/zinc/36/85/48/130368548.db2.gz LXQTZGVFRHNYJJ-CABCVRRESA-N 1 2 322.412 4.019 20 0 DIADLO CC[C@H](CC(=O)N1CCCC[C@H]1c1[nH+]ccn1CC)C(C)C ZINC000366607388 130874682 /nfs/dbraw/zinc/87/46/82/130874682.db2.gz JMTFHHXXVJVDNZ-CVEARBPZSA-N 1 2 305.466 4.029 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)nn1C ZINC000282417290 130920510 /nfs/dbraw/zinc/92/05/10/130920510.db2.gz YMGCPOMBEVONTI-FOIQADDNSA-N 1 2 323.415 4.308 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2nnc(C)s2)cc1 ZINC000284329929 131069962 /nfs/dbraw/zinc/06/99/62/131069962.db2.gz MGKDHOQBORFWPG-OLZOCXBDSA-N 1 2 319.474 4.437 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](COc2ccccc2)c2ccccc2)no1 ZINC000284963145 131126051 /nfs/dbraw/zinc/12/60/51/131126051.db2.gz FMPGLABKYFEMDR-UZLBHIALSA-N 1 2 322.408 4.454 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1nc(C)cs1 ZINC000285081705 131136936 /nfs/dbraw/zinc/13/69/36/131136936.db2.gz PRKHPRSJWQKIHF-HNNXBMFYSA-N 1 2 313.426 4.347 20 0 DIADLO c1cc([C@@H]2CCCC[N@H+]2Cc2nc(-c3ccccc3)cs2)n[nH]1 ZINC000285348563 131159946 /nfs/dbraw/zinc/15/99/46/131159946.db2.gz LCLHNLRFBYXITN-KRWDZBQOSA-N 1 2 324.453 4.260 20 0 DIADLO c1cc([C@@H]2CCCC[N@@H+]2Cc2nc(-c3ccccc3)cs2)n[nH]1 ZINC000285348563 131159947 /nfs/dbraw/zinc/15/99/47/131159947.db2.gz LCLHNLRFBYXITN-KRWDZBQOSA-N 1 2 324.453 4.260 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1ccncc1F ZINC000340206568 131172750 /nfs/dbraw/zinc/17/27/50/131172750.db2.gz OSSHXDMSRLTKFV-LIRRHRJNSA-N 1 2 307.372 4.056 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCSc2ccc(F)cc21)c1c(F)cncc1F ZINC000285497261 131174345 /nfs/dbraw/zinc/17/43/45/131174345.db2.gz ACUJREYDPHBJIX-LKFCYVNXSA-N 1 2 324.371 4.387 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1nc(Cl)ccc1Cl ZINC000285578725 131183047 /nfs/dbraw/zinc/18/30/47/131183047.db2.gz ILRUWRROWPHIFR-UHFFFAOYSA-N 1 2 314.216 4.018 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000285579607 131183490 /nfs/dbraw/zinc/18/34/90/131183490.db2.gz VAGDHGYXBAQANO-UHFFFAOYSA-N 1 2 307.463 4.070 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccc(F)cc1F ZINC000285786264 131202890 /nfs/dbraw/zinc/20/28/90/131202890.db2.gz SUEAYXCCTHZZHH-RFAUZJTJSA-N 1 2 312.310 4.440 20 0 DIADLO Cc1c([C@@H](C)Nc2cc[nH+]c3c(Cl)cccc23)cnn1C ZINC000286075858 131218596 /nfs/dbraw/zinc/21/85/96/131218596.db2.gz JJOZXOVDUFGWIJ-SNVBAGLBSA-N 1 2 300.793 4.103 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000286947661 131257269 /nfs/dbraw/zinc/25/72/69/131257269.db2.gz CSKPKONJWAZGKH-YQVWRLOYSA-N 1 2 321.424 4.190 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(Cc1ccco1)C1CCCC1 ZINC000286977192 131259115 /nfs/dbraw/zinc/25/91/15/131259115.db2.gz BRABLBNNNNXYCV-UHFFFAOYSA-N 1 2 313.401 4.268 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000286982455 131259143 /nfs/dbraw/zinc/25/91/43/131259143.db2.gz BYWSRCIGIZJXKW-IAGOWNOFSA-N 1 2 309.413 4.156 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2nccn2-c2ccccc2)oc1C ZINC000287188745 131268146 /nfs/dbraw/zinc/26/81/46/131268146.db2.gz VPUUWZIHWNSEJS-LSDHHAIUSA-N 1 2 309.413 4.494 20 0 DIADLO Oc1ccc(C2CCN(c3[nH+]ccc4ccc(F)cc43)CC2)cc1 ZINC000340253438 131278129 /nfs/dbraw/zinc/27/81/29/131278129.db2.gz GLJYUAYXNGDGDU-UHFFFAOYSA-N 1 2 322.383 4.464 20 0 DIADLO O=C(CCc1[nH]cc[nH+]1)Nc1ccc(SC2CCCC2)cc1 ZINC000287383517 131278419 /nfs/dbraw/zinc/27/84/19/131278419.db2.gz BJTYIXJHQCAOTK-UHFFFAOYSA-N 1 2 315.442 4.016 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000287400832 131278852 /nfs/dbraw/zinc/27/88/52/131278852.db2.gz DMOLOJWTCKCUOF-DOMZBBRYSA-N 1 2 313.401 4.297 20 0 DIADLO Cc1ccccc1[C@@H]1CCN(C(=O)Nc2c(C)cc[nH+]c2C)C1 ZINC000287418718 131279735 /nfs/dbraw/zinc/27/97/35/131279735.db2.gz FQANCPJHTPRLCP-MRXNPFEDSA-N 1 2 309.413 4.028 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@@](C)(c2ccccc2)C1 ZINC000287458071 131281481 /nfs/dbraw/zinc/28/14/81/131281481.db2.gz IPODMVZQMYKAMX-HXUWFJFHSA-N 1 2 323.440 4.284 20 0 DIADLO CCN(Cc1cccc(Cl)c1)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287462393 131281822 /nfs/dbraw/zinc/28/18/22/131281822.db2.gz IWAVRXIAGNRAQQ-UHFFFAOYSA-N 1 2 317.820 4.406 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(Cc1cccs1)C(C)C ZINC000287674599 131294887 /nfs/dbraw/zinc/29/48/87/131294887.db2.gz XWCZONBLSAMVJV-UHFFFAOYSA-N 1 2 303.431 4.202 20 0 DIADLO COc1ccncc1C[N@H+](C)[C@@H](C)c1sc(C(C)C)nc1C ZINC000287750433 131298892 /nfs/dbraw/zinc/29/88/92/131298892.db2.gz LOWNCPBWRUVFRJ-ZDUSSCGKSA-N 1 2 319.474 4.172 20 0 DIADLO COc1ccncc1C[N@@H+](C)[C@@H](C)c1sc(C(C)C)nc1C ZINC000287750433 131298894 /nfs/dbraw/zinc/29/88/94/131298894.db2.gz LOWNCPBWRUVFRJ-ZDUSSCGKSA-N 1 2 319.474 4.172 20 0 DIADLO Cc1nn(C)cc1[C@@H](C)Nc1cc[nH+]c2c(Cl)cccc12 ZINC000288160406 131315110 /nfs/dbraw/zinc/31/51/10/131315110.db2.gz ZPMAABHEVVBJOH-SNVBAGLBSA-N 1 2 300.793 4.103 20 0 DIADLO CCc1oc2ccccc2c1C[NH2+]Cc1nccc(C(F)F)n1 ZINC000288423300 131324546 /nfs/dbraw/zinc/32/45/46/131324546.db2.gz JZSCJNNCNZRBBF-UHFFFAOYSA-N 1 2 317.339 4.013 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+](C)Cc1ccccc1N(C)C ZINC000288582448 131331768 /nfs/dbraw/zinc/33/17/68/131331768.db2.gz CKRHMOGTNFHSJC-AWEZNQCLSA-N 1 2 315.461 4.231 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)Cc1ccccc1N(C)C ZINC000288582448 131331769 /nfs/dbraw/zinc/33/17/69/131331769.db2.gz CKRHMOGTNFHSJC-AWEZNQCLSA-N 1 2 315.461 4.231 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+]2CCCc3occc3C2)s1 ZINC000288792795 131339356 /nfs/dbraw/zinc/33/93/56/131339356.db2.gz LIRCQIHAJBARQZ-UHFFFAOYSA-N 1 2 316.348 4.012 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+]2CCCc3occc3C2)s1 ZINC000288792795 131339358 /nfs/dbraw/zinc/33/93/58/131339358.db2.gz LIRCQIHAJBARQZ-UHFFFAOYSA-N 1 2 316.348 4.012 20 0 DIADLO Cc1ccc(NC(=O)N([C@@H](C)c2ccccc2)C2CC2)c(C)[nH+]1 ZINC000289085345 131357574 /nfs/dbraw/zinc/35/75/74/131357574.db2.gz OEPUEMJKKDHSBC-HNNXBMFYSA-N 1 2 309.413 4.456 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H](c2ccc(CC(C)C)cc2)C2CC2)no1 ZINC000289300675 131371960 /nfs/dbraw/zinc/37/19/60/131371960.db2.gz BLULCMIKQGAJKH-FZKQIMNGSA-N 1 2 313.445 4.378 20 0 DIADLO COC[C@@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(Cl)cc1 ZINC000289328466 131373901 /nfs/dbraw/zinc/37/39/01/131373901.db2.gz DGTSEEUUIAMTOS-OAHLLOKOSA-N 1 2 322.836 4.103 20 0 DIADLO c1csc([C@H]2CSCC[N@H+]2Cc2ccc3occc3c2)n1 ZINC000289493421 131390476 /nfs/dbraw/zinc/39/04/76/131390476.db2.gz BSLXCQMCHXFBGK-CQSZACIVSA-N 1 2 316.451 4.179 20 0 DIADLO c1csc([C@H]2CSCC[N@@H+]2Cc2ccc3occc3c2)n1 ZINC000289493421 131390479 /nfs/dbraw/zinc/39/04/79/131390479.db2.gz BSLXCQMCHXFBGK-CQSZACIVSA-N 1 2 316.451 4.179 20 0 DIADLO COCc1nc(C[NH2+][C@H](CCC(C)C)c2ccoc2)cs1 ZINC000289566236 131396081 /nfs/dbraw/zinc/39/60/81/131396081.db2.gz ARAIPFCXIJHNGG-OAHLLOKOSA-N 1 2 308.447 4.150 20 0 DIADLO COCc1nc(C[NH2+][C@@H](CCC(C)C)c2ccoc2)cs1 ZINC000289566234 131396206 /nfs/dbraw/zinc/39/62/06/131396206.db2.gz ARAIPFCXIJHNGG-HNNXBMFYSA-N 1 2 308.447 4.150 20 0 DIADLO CC[C@@H](CC(=O)N(C)[C@H](c1[nH]cc[nH+]1)c1ccccc1)C(C)C ZINC000293851608 131775778 /nfs/dbraw/zinc/77/57/78/131775778.db2.gz FXSWEMUPVATYJF-YJBOKZPZSA-N 1 2 313.445 4.030 20 0 DIADLO Cc1ccc(Br)c(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)c1 ZINC000294129849 131802434 /nfs/dbraw/zinc/80/24/34/131802434.db2.gz OONLUBIVUKLGTA-ZWNOBZJWSA-N 1 2 306.207 4.072 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000297552324 132022458 /nfs/dbraw/zinc/02/24/58/132022458.db2.gz ZSPYVMLHLWDBKP-ZWKOTPCHSA-N 1 2 323.440 4.498 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@H]1C[C@@H](C)n2ccnc21 ZINC000297646118 132026831 /nfs/dbraw/zinc/02/68/31/132026831.db2.gz JZHGSLQIHXPTRS-VYDXJSESSA-N 1 2 313.445 4.164 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](c1ccccc1)c1cccc(F)c1 ZINC000297725673 132031025 /nfs/dbraw/zinc/03/10/25/132031025.db2.gz NKIIVIHKCZFARG-KXBFYZLASA-N 1 2 323.415 4.482 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1nccn1CC ZINC000297818028 132035459 /nfs/dbraw/zinc/03/54/59/132035459.db2.gz REZHARHEXBYJTQ-HOTGVXAUSA-N 1 2 315.461 4.240 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@H]1CCCC[C@H]1CC(F)(F)F ZINC000297905929 132039769 /nfs/dbraw/zinc/03/97/69/132039769.db2.gz XZWZGQSJHROONF-AAEUAGOBSA-N 1 2 315.339 4.023 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(C)cc1OC(C)(C)C ZINC000297955596 132042298 /nfs/dbraw/zinc/04/22/98/132042298.db2.gz ZBLRVEYNARIXCD-HNNXBMFYSA-N 1 2 315.461 4.240 20 0 DIADLO COCc1cc(C[N@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)no1 ZINC000297970423 132042813 /nfs/dbraw/zinc/04/28/13/132042813.db2.gz XFBUXRDTSYZGGW-GFCCVEGCSA-N 1 2 320.820 4.200 20 0 DIADLO COCc1cc(C[N@@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)no1 ZINC000297970423 132042816 /nfs/dbraw/zinc/04/28/16/132042816.db2.gz XFBUXRDTSYZGGW-GFCCVEGCSA-N 1 2 320.820 4.200 20 0 DIADLO C[C@H](c1nc2ccccc2n1C(F)F)[N@H+](C)Cc1ccccn1 ZINC000298126075 132047532 /nfs/dbraw/zinc/04/75/32/132047532.db2.gz KPWNACGRROBDPZ-GFCCVEGCSA-N 1 2 316.355 4.019 20 0 DIADLO C[C@H](c1nc2ccccc2n1C(F)F)[N@@H+](C)Cc1ccccn1 ZINC000298126075 132047534 /nfs/dbraw/zinc/04/75/34/132047534.db2.gz KPWNACGRROBDPZ-GFCCVEGCSA-N 1 2 316.355 4.019 20 0 DIADLO CCc1noc([C@H](C)[NH2+]C(c2ccccc2)c2ccccc2)n1 ZINC000298202646 132050124 /nfs/dbraw/zinc/05/01/24/132050124.db2.gz GZWLRSDGORMDKL-AWEZNQCLSA-N 1 2 307.397 4.072 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nc(=O)c2sccc2[nH]1)c1ccccc1 ZINC000298789512 132077580 /nfs/dbraw/zinc/07/75/80/132077580.db2.gz DHXCPHXJSZYBDD-CYBMUJFWSA-N 1 2 313.426 4.028 20 0 DIADLO COc1c(C[NH2+]Cc2ncc(C(C)C)s2)oc2ccccc21 ZINC000353211386 132082141 /nfs/dbraw/zinc/08/21/41/132082141.db2.gz ZXXIIPAUGZASBS-UHFFFAOYSA-N 1 2 316.426 4.311 20 0 DIADLO Clc1ccccc1C[N@@H+](Cc1nc(C2CC2)no1)CC1CC1 ZINC000299031767 132087370 /nfs/dbraw/zinc/08/73/70/132087370.db2.gz JTKLIBJMLLCLII-UHFFFAOYSA-N 1 2 317.820 4.013 20 0 DIADLO Clc1ccccc1C[N@H+](Cc1nc(C2CC2)no1)CC1CC1 ZINC000299031767 132087372 /nfs/dbraw/zinc/08/73/72/132087372.db2.gz JTKLIBJMLLCLII-UHFFFAOYSA-N 1 2 317.820 4.013 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)oc1C ZINC000299122634 132090147 /nfs/dbraw/zinc/09/01/47/132090147.db2.gz HEHYJYJRCDSSCP-BDJLRTHQSA-N 1 2 300.402 4.172 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)oc1C ZINC000299122634 132090149 /nfs/dbraw/zinc/09/01/49/132090149.db2.gz HEHYJYJRCDSSCP-BDJLRTHQSA-N 1 2 300.402 4.172 20 0 DIADLO Cc1noc(C[N@H+](Cc2ccccc2)[C@@H](C)c2cccs2)n1 ZINC000299339746 132099717 /nfs/dbraw/zinc/09/97/17/132099717.db2.gz AAHQDGSKYFJKPX-ZDUSSCGKSA-N 1 2 313.426 4.203 20 0 DIADLO Cc1noc(C[N@@H+](Cc2ccccc2)[C@@H](C)c2cccs2)n1 ZINC000299339746 132099719 /nfs/dbraw/zinc/09/97/19/132099719.db2.gz AAHQDGSKYFJKPX-ZDUSSCGKSA-N 1 2 313.426 4.203 20 0 DIADLO Cc1noc(C[N@H+](Cc2ccccc2)[C@H](C)c2cccs2)n1 ZINC000299339740 132100149 /nfs/dbraw/zinc/10/01/49/132100149.db2.gz AAHQDGSKYFJKPX-CYBMUJFWSA-N 1 2 313.426 4.203 20 0 DIADLO Cc1noc(C[N@@H+](Cc2ccccc2)[C@H](C)c2cccs2)n1 ZINC000299339740 132100151 /nfs/dbraw/zinc/10/01/51/132100151.db2.gz AAHQDGSKYFJKPX-CYBMUJFWSA-N 1 2 313.426 4.203 20 0 DIADLO O=C(c1cc(Cl)cc(Cl)c1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000299567014 132111546 /nfs/dbraw/zinc/11/15/46/132111546.db2.gz SZPIRASUQUYKCD-CYBMUJFWSA-N 1 2 324.211 4.084 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cc4ccccc4o3)CCCCC2)no1 ZINC000299576962 132111874 /nfs/dbraw/zinc/11/18/74/132111874.db2.gz HUYYMLNCGGLOTA-UHFFFAOYSA-N 1 2 311.385 4.073 20 0 DIADLO Cc1cc(F)cc(C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)c1 ZINC000340667545 132136471 /nfs/dbraw/zinc/13/64/71/132136471.db2.gz PTJANYIQDZDNER-UHFFFAOYSA-N 1 2 323.371 4.151 20 0 DIADLO C[C@@H]1CCC[C@@H](C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)C1 ZINC000340670193 132139250 /nfs/dbraw/zinc/13/92/50/132139250.db2.gz XENSIYWZQKEJKC-TZMCWYRMSA-N 1 2 311.429 4.216 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)c(Cl)c1)Cc1ncc(C)cn1 ZINC000340678155 132145416 /nfs/dbraw/zinc/14/54/16/132145416.db2.gz PVABJJDTQSCHJJ-UHFFFAOYSA-N 1 2 310.228 4.114 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)c(Cl)c1)Cc1ncc(C)cn1 ZINC000340678155 132145417 /nfs/dbraw/zinc/14/54/17/132145417.db2.gz PVABJJDTQSCHJJ-UHFFFAOYSA-N 1 2 310.228 4.114 20 0 DIADLO CC(C)C[N@H+](Cc1ncc(C2CC2)o1)Cc1ccccc1F ZINC000340679223 132145738 /nfs/dbraw/zinc/14/57/38/132145738.db2.gz BQPBPMMAYXDFNQ-UHFFFAOYSA-N 1 2 302.393 4.349 20 0 DIADLO CC(C)C[N@@H+](Cc1ncc(C2CC2)o1)Cc1ccccc1F ZINC000340679223 132145740 /nfs/dbraw/zinc/14/57/40/132145740.db2.gz BQPBPMMAYXDFNQ-UHFFFAOYSA-N 1 2 302.393 4.349 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)nc1 ZINC000340686497 132153319 /nfs/dbraw/zinc/15/33/19/132153319.db2.gz UVNRWDYECCSVFZ-UHFFFAOYSA-N 1 2 303.409 4.103 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)nc1 ZINC000340686497 132153320 /nfs/dbraw/zinc/15/33/20/132153320.db2.gz UVNRWDYECCSVFZ-UHFFFAOYSA-N 1 2 303.409 4.103 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2c1cccc2Cl)c1nc(C(C)(C)C)no1 ZINC000194524632 335074451 /nfs/dbraw/zinc/07/44/51/335074451.db2.gz JQDUDHWNWOVLQQ-YGRLFVJLSA-N 1 2 319.836 4.359 20 0 DIADLO CC1=C(C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)CCC1 ZINC000425562691 335090852 /nfs/dbraw/zinc/09/08/52/335090852.db2.gz CTZOCEHRDWAGOR-UHFFFAOYSA-N 1 2 321.424 4.325 20 0 DIADLO COC[C@@H](C)CNc1ccc(SCc2ccccc2)c[nH+]1 ZINC000525863866 435008814 /nfs/dbraw/zinc/00/88/14/435008814.db2.gz ZIAKWSIPFLGDMF-AWEZNQCLSA-N 1 2 302.443 4.068 20 0 DIADLO Cc1cn2c([nH+]1)[C@@H](CNc1nc3ccccc3cc1C)CCC2 ZINC000533560907 435246354 /nfs/dbraw/zinc/24/63/54/435246354.db2.gz MCKSBPLCNVHZNQ-MRXNPFEDSA-N 1 2 306.413 4.038 20 0 DIADLO CC(C)c1nc(NCCc2csc(C(C)(C)C)n2)cc[nH+]1 ZINC000497558625 435301864 /nfs/dbraw/zinc/30/18/64/435301864.db2.gz VDTOBEKTXXXHKR-UHFFFAOYSA-N 1 2 304.463 4.009 20 0 DIADLO CCO[C@H]1C[C@@H](Nc2ccc3cc(OC)ccc3[nH+]2)C12CCC2 ZINC000608088377 435349743 /nfs/dbraw/zinc/34/97/43/435349743.db2.gz OTSLWLIKPPBHOI-SJORKVTESA-N 1 2 312.413 4.003 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3ncc(-c4ccccc4)o3)CC2)cc1 ZINC000533391282 331515530 /nfs/dbraw/zinc/51/55/30/331515530.db2.gz CLRPXNZUDDIONT-UHFFFAOYSA-N 1 2 308.356 4.260 20 0 DIADLO Cc1nc([C@@H](C)[NH+]2CCC(C)(c3cccc(Cl)c3)CC2)no1 ZINC000517441733 331691150 /nfs/dbraw/zinc/69/11/50/331691150.db2.gz DFFQIZIOLOZGDI-GFCCVEGCSA-N 1 2 319.836 4.146 20 0 DIADLO COCc1ccc(C[NH2+]Cc2cc(Cl)sc2Cl)o1 ZINC000312745120 331725325 /nfs/dbraw/zinc/72/53/25/331725325.db2.gz MPHSBVQQAVAPEK-UHFFFAOYSA-N 1 2 306.214 4.084 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C\c2ccnc3ccccc23)c(C)[nH+]1 ZINC000255397892 331737745 /nfs/dbraw/zinc/73/77/45/331737745.db2.gz SVLLEDVSXQIJDK-HJWRWDBZSA-N 1 2 317.392 4.207 20 0 DIADLO Cc1ccc(NC(=O)[C@H]2C[C@H]2c2cccc(Cl)c2)c(C)[nH+]1 ZINC000176204955 332928725 /nfs/dbraw/zinc/92/87/25/332928725.db2.gz ANEZADCEPMFDCA-GJZGRUSLSA-N 1 2 300.789 4.094 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1c(F)cncc1F ZINC000556915628 331753150 /nfs/dbraw/zinc/75/31/50/331753150.db2.gz NRBGEYSBUYCLRR-NEPJUHHUSA-N 1 2 306.356 4.170 20 0 DIADLO Cc1cccc(C[NH2+][C@H](C)c2noc(Cc3ccccc3)n2)c1C ZINC000557832478 331820140 /nfs/dbraw/zinc/82/01/40/331820140.db2.gz VEHLKUHSVAGGQZ-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(-c2ccco2)no1)c1ccc(Cl)cc1 ZINC000029979306 331846247 /nfs/dbraw/zinc/84/62/47/331846247.db2.gz FQAMBPBPBXBAHO-CYBMUJFWSA-N 1 2 317.776 4.224 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC[C@H]1c1ccccn1 ZINC000526047015 331905187 /nfs/dbraw/zinc/90/51/87/331905187.db2.gz PXZPGSKZPDBWGH-KRWDZBQOSA-N 1 2 319.408 4.288 20 0 DIADLO CCN(C)c1ccc(CNc2ccc3oc(C(C)C)nc3c2)c[nH+]1 ZINC000558765631 331941946 /nfs/dbraw/zinc/94/19/46/331941946.db2.gz ROEZLXJCMBLRKE-UHFFFAOYSA-N 1 2 324.428 4.414 20 0 DIADLO Cc1cccc2[nH+]c(CNc3ccccc3CC(F)(F)F)cn21 ZINC000083143258 331993717 /nfs/dbraw/zinc/99/37/17/331993717.db2.gz SQEVAYKJEGQBPM-UHFFFAOYSA-N 1 2 319.330 4.360 20 0 DIADLO Cc1ccc(NC(=O)N[C@H]2CCc3sc(Cl)cc32)c(C)[nH+]1 ZINC000518261611 332001845 /nfs/dbraw/zinc/00/18/45/332001845.db2.gz LXJOJZYHAVYOPT-LBPRGKRZSA-N 1 2 321.833 4.222 20 0 DIADLO Cc1nocc1C[NH2+]C(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000559250961 332005550 /nfs/dbraw/zinc/00/55/50/332005550.db2.gz ZZAMEUAYNGEWQS-UHFFFAOYSA-N 1 2 314.335 4.140 20 0 DIADLO Cc1sccc1C[NH2+]C(C)(C)c1cc(C(F)(F)F)on1 ZINC000559303853 332021443 /nfs/dbraw/zinc/02/14/43/332021443.db2.gz GRFHKGGGSSJGAZ-UHFFFAOYSA-N 1 2 304.337 4.088 20 0 DIADLO Cc1cnc(C[NH+]2CCC(=Cc3cccc(F)c3)CC2)s1 ZINC000449326536 332038290 /nfs/dbraw/zinc/03/82/90/332038290.db2.gz WYTGJJKWVDTUBD-UHFFFAOYSA-N 1 2 302.418 4.270 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)Cc3cccs3)cc2[nH+]1 ZINC000409718167 332049587 /nfs/dbraw/zinc/04/95/87/332049587.db2.gz FLRREJBFGSDECO-UHFFFAOYSA-N 1 2 313.426 4.148 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CCc2cc(F)ccc2C1 ZINC000091893670 332091845 /nfs/dbraw/zinc/09/18/45/332091845.db2.gz MKGMGZLKRROTHV-GFCCVEGCSA-N 1 2 302.393 4.231 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCc2cc(F)ccc2C1 ZINC000091893670 332091846 /nfs/dbraw/zinc/09/18/46/332091846.db2.gz MKGMGZLKRROTHV-GFCCVEGCSA-N 1 2 302.393 4.231 20 0 DIADLO CCc1noc([C@@H](C)[N@H+]2CC=C(c3ccccc3Cl)CC2)n1 ZINC000091842830 332113204 /nfs/dbraw/zinc/11/32/04/332113204.db2.gz ZNCUZYYAEAOTNM-GFCCVEGCSA-N 1 2 317.820 4.136 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+]2CC=C(c3ccccc3Cl)CC2)n1 ZINC000091842830 332113206 /nfs/dbraw/zinc/11/32/06/332113206.db2.gz ZNCUZYYAEAOTNM-GFCCVEGCSA-N 1 2 317.820 4.136 20 0 DIADLO Fc1ccc2c(c1)CC[N@@H+](Cc1coc(-c3ccccc3)n1)C2 ZINC000091892371 332114005 /nfs/dbraw/zinc/11/40/05/332114005.db2.gz HQBQAGWJDHLYCX-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1ccc2c(c1)CC[N@H+](Cc1coc(-c3ccccc3)n1)C2 ZINC000091892371 332114006 /nfs/dbraw/zinc/11/40/06/332114006.db2.gz HQBQAGWJDHLYCX-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO CCCc1csc(C[N@H+](CCOC)[C@@H](C)c2ccccc2)n1 ZINC000426401330 332114441 /nfs/dbraw/zinc/11/44/41/332114441.db2.gz OMNVYUUTHJMUHL-HNNXBMFYSA-N 1 2 318.486 4.305 20 0 DIADLO CCCc1csc(C[N@@H+](CCOC)[C@@H](C)c2ccccc2)n1 ZINC000426401330 332114442 /nfs/dbraw/zinc/11/44/42/332114442.db2.gz OMNVYUUTHJMUHL-HNNXBMFYSA-N 1 2 318.486 4.305 20 0 DIADLO Cc1ccccc1NC(=O)[C@@H](C)[N@H+](C)Cc1ccccc1Cl ZINC000016376591 332132015 /nfs/dbraw/zinc/13/20/15/332132015.db2.gz VZGAXHDUDYRGBF-CQSZACIVSA-N 1 2 316.832 4.107 20 0 DIADLO Cc1ccccc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1Cl ZINC000016376591 332132017 /nfs/dbraw/zinc/13/20/17/332132017.db2.gz VZGAXHDUDYRGBF-CQSZACIVSA-N 1 2 316.832 4.107 20 0 DIADLO Cc1cccnc1C[N@H+]1C[C@@H](c2ccccc2Cl)OC[C@@H]1C ZINC000093173514 332135111 /nfs/dbraw/zinc/13/51/11/332135111.db2.gz WXYUABJLHXNUML-KSSFIOAISA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cccnc1C[N@@H+]1C[C@@H](c2ccccc2Cl)OC[C@@H]1C ZINC000093173514 332135112 /nfs/dbraw/zinc/13/51/12/332135112.db2.gz WXYUABJLHXNUML-KSSFIOAISA-N 1 2 316.832 4.005 20 0 DIADLO CC(C)CN(C(=O)C[C@H](C)n1cc[nH+]c1)c1ccccc1Cl ZINC000569581963 332144548 /nfs/dbraw/zinc/14/45/48/332144548.db2.gz OLVVLRZSORORCR-AWEZNQCLSA-N 1 2 319.836 4.177 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+]2CCC=C(c3ccccn3)C2)n1 ZINC000569589113 332147342 /nfs/dbraw/zinc/14/73/42/332147342.db2.gz WYUFMXPWWAEFKI-UHFFFAOYSA-N 1 2 313.470 4.125 20 0 DIADLO CC(C)(C)c1csc(C[N@H+]2CCC=C(c3ccccn3)C2)n1 ZINC000569589113 332147343 /nfs/dbraw/zinc/14/73/43/332147343.db2.gz WYUFMXPWWAEFKI-UHFFFAOYSA-N 1 2 313.470 4.125 20 0 DIADLO CCc1nc(C[N@H+](Cc2ccccc2)[C@@H]2CCCC2(C)C)no1 ZINC000426804096 332155431 /nfs/dbraw/zinc/15/54/31/332155431.db2.gz RUTSUCSIKBXXJH-MRXNPFEDSA-N 1 2 313.445 4.213 20 0 DIADLO CCc1nc(C[N@@H+](Cc2ccccc2)[C@@H]2CCCC2(C)C)no1 ZINC000426804096 332155432 /nfs/dbraw/zinc/15/54/32/332155432.db2.gz RUTSUCSIKBXXJH-MRXNPFEDSA-N 1 2 313.445 4.213 20 0 DIADLO Cc1cc(N[C@@H](COc2ccccc2)c2ccccc2)nc[nH+]1 ZINC000426899373 332160577 /nfs/dbraw/zinc/16/05/77/332160577.db2.gz SJVOPMBXPCUPFY-SFHVURJKSA-N 1 2 305.381 4.017 20 0 DIADLO Cc1nc(N[C@@H](COc2ccccc2)c2ccccc2)cc[nH+]1 ZINC000426898011 332160662 /nfs/dbraw/zinc/16/06/62/332160662.db2.gz JUHQLTNYZFEBCB-SFHVURJKSA-N 1 2 305.381 4.017 20 0 DIADLO CCOc1ccccc1C[N@H+](C)[C@@H](C)c1nc2ccccc2o1 ZINC000180979855 332171232 /nfs/dbraw/zinc/17/12/32/332171232.db2.gz JSLVJNQSKBVOCE-AWEZNQCLSA-N 1 2 310.397 4.420 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)[C@@H](C)c1nc2ccccc2o1 ZINC000180979855 332171233 /nfs/dbraw/zinc/17/12/33/332171233.db2.gz JSLVJNQSKBVOCE-AWEZNQCLSA-N 1 2 310.397 4.420 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CCCC2)no1)c1cccc(Cl)c1 ZINC000181422599 332193035 /nfs/dbraw/zinc/19/30/35/332193035.db2.gz IRWVLSNBRVLWSN-LLVKDONJSA-N 1 2 305.809 4.231 20 0 DIADLO Cc1nc(C[NH2+]C(c2cccs2)c2cccs2)cs1 ZINC000041010629 332208114 /nfs/dbraw/zinc/20/81/14/332208114.db2.gz DNKKMKWSHYICFQ-UHFFFAOYSA-N 1 2 306.481 4.454 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC000370779749 332248877 /nfs/dbraw/zinc/24/88/77/332248877.db2.gz APCHDCGGCKGBMJ-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1CCC[C@@H]1c1nccs1 ZINC000370779749 332248879 /nfs/dbraw/zinc/24/88/79/332248879.db2.gz APCHDCGGCKGBMJ-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO CCn1cc[nH+]c1CNc1ccccc1CN(C)c1ccccc1 ZINC000559465645 332262164 /nfs/dbraw/zinc/26/21/64/332262164.db2.gz MZULVFKNDGHTNC-UHFFFAOYSA-N 1 2 320.440 4.152 20 0 DIADLO CCCc1csc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)n1 ZINC000426068470 335097536 /nfs/dbraw/zinc/09/75/36/335097536.db2.gz YJGLOGTYVGZXOB-MRXNPFEDSA-N 1 2 318.511 4.386 20 0 DIADLO CCCc1csc(C[N@H+]2CCSC[C@@H]2c2ccccc2)n1 ZINC000426068470 335097537 /nfs/dbraw/zinc/09/75/37/335097537.db2.gz YJGLOGTYVGZXOB-MRXNPFEDSA-N 1 2 318.511 4.386 20 0 DIADLO C[C@@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1cccc(C2CC2)c1 ZINC000559785498 332282107 /nfs/dbraw/zinc/28/21/07/332282107.db2.gz CNMFIEJWPWBNDK-XIKOKIGWSA-N 1 2 317.379 4.226 20 0 DIADLO COc1ccc([C@H](Cc2ccccc2)[NH2+]CC(C)(F)F)cc1 ZINC000559886522 332289378 /nfs/dbraw/zinc/28/93/78/332289378.db2.gz LKBOJNBZFLWDIF-KRWDZBQOSA-N 1 2 305.368 4.224 20 0 DIADLO CC[C@@H]([NH2+]CC(C)(F)F)c1cc(F)cc(Br)c1 ZINC000559892138 332290240 /nfs/dbraw/zinc/29/02/40/332290240.db2.gz WJUIAIWKHKWRNW-LLVKDONJSA-N 1 2 310.157 4.284 20 0 DIADLO CCCOc1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000559916538 332292680 /nfs/dbraw/zinc/29/26/80/332292680.db2.gz HFVDSYPXIYSHCO-CYBMUJFWSA-N 1 2 317.433 4.007 20 0 DIADLO Cc1ccc2[nH+]c(/C=C\c3ncc(Br)s3)cn2c1 ZINC000559941451 332295364 /nfs/dbraw/zinc/29/53/64/332295364.db2.gz XWHGJIALOOBURK-HYXAFXHYSA-N 1 2 320.215 4.032 20 0 DIADLO CSCCCOc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000559947427 332296021 /nfs/dbraw/zinc/29/60/21/332296021.db2.gz LWOCTGJZEDWLGY-UHFFFAOYSA-N 1 2 302.443 4.018 20 0 DIADLO Cc1ccc2[nH+]c(CNc3ccc(C)c(OC(C)C)c3)cn2c1 ZINC000560077921 332308767 /nfs/dbraw/zinc/30/87/67/332308767.db2.gz RJYXRAOGQLSOKS-UHFFFAOYSA-N 1 2 309.413 4.350 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CCC=C(c3ccccc3)C2)n1 ZINC000560169219 332316533 /nfs/dbraw/zinc/31/65/33/332316533.db2.gz NLZFYUUDZYXGSD-UHFFFAOYSA-N 1 2 324.371 4.451 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CCC=C(c3ccccc3)C2)n1 ZINC000560169219 332316535 /nfs/dbraw/zinc/31/65/35/332316535.db2.gz NLZFYUUDZYXGSD-UHFFFAOYSA-N 1 2 324.371 4.451 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)n1 ZINC000114747049 332328926 /nfs/dbraw/zinc/32/89/26/332328926.db2.gz XMTCVRHSNMNXMO-UWVGGRQHSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1ccc[nH+]c1CCc1noc([C@@H]2C[C@H]2C2CCCCC2)n1 ZINC000560354405 332333949 /nfs/dbraw/zinc/33/39/49/332333949.db2.gz RMCXAENOPJIETN-JKSUJKDBSA-N 1 2 311.429 4.242 20 0 DIADLO COc1cccc(Cl)c1C[N@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000560533015 332353769 /nfs/dbraw/zinc/35/37/69/332353769.db2.gz UPLZOYDLYXAUPO-LBPRGKRZSA-N 1 2 305.805 4.247 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000560533015 332353770 /nfs/dbraw/zinc/35/37/70/332353770.db2.gz UPLZOYDLYXAUPO-LBPRGKRZSA-N 1 2 305.805 4.247 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(F)c(Cl)c2)[C@@H]1c1ccncc1 ZINC000560546220 332356984 /nfs/dbraw/zinc/35/69/84/332356984.db2.gz UXIZJYHLESXZGW-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(F)c(Cl)c2)[C@@H]1c1ccncc1 ZINC000560546220 332356985 /nfs/dbraw/zinc/35/69/85/332356985.db2.gz UXIZJYHLESXZGW-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO C[C@H](Nc1cccc(COc2cccc(F)c2)c1)c1[nH]cc[nH+]1 ZINC000560548563 332357755 /nfs/dbraw/zinc/35/77/55/332357755.db2.gz IVQUWMMXYCYZJY-ZDUSSCGKSA-N 1 2 311.360 4.301 20 0 DIADLO CSc1ccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)nc1 ZINC000560553647 332359223 /nfs/dbraw/zinc/35/92/23/332359223.db2.gz WZNLFMYOGUUVCX-HNNXBMFYSA-N 1 2 302.447 4.260 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CCCC[C@@H]3c3cc[nH]n3)cc2c1C ZINC000564494916 332370473 /nfs/dbraw/zinc/37/04/73/332370473.db2.gz GTHFBMHUPGDEAR-LJQANCHMSA-N 1 2 308.429 4.235 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CCCC[C@@H]3c3cc[nH]n3)cc2c1C ZINC000564494916 332370475 /nfs/dbraw/zinc/37/04/75/332370475.db2.gz GTHFBMHUPGDEAR-LJQANCHMSA-N 1 2 308.429 4.235 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)CCCOc1ccccc1Cl ZINC000425585015 335107038 /nfs/dbraw/zinc/10/70/38/335107038.db2.gz GXYVICVRPRFBKO-UHFFFAOYSA-N 1 2 318.804 4.150 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)CSc1ccc(F)cc1 ZINC000425585792 335107103 /nfs/dbraw/zinc/10/71/03/335107103.db2.gz ISSZTCRNNAURJN-GFCCVEGCSA-N 1 2 318.417 4.204 20 0 DIADLO CCN(c1ccc(C(=O)Nc2c(C)cc[nH+]c2C)cc1)C(C)C ZINC000425586909 335107475 /nfs/dbraw/zinc/10/74/75/335107475.db2.gz MCYUMJWXNZOXTG-UHFFFAOYSA-N 1 2 311.429 4.185 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1cc(Cl)ccc1OC(C)C ZINC000425589472 335108202 /nfs/dbraw/zinc/10/82/02/335108202.db2.gz SQWPQUFWFHMFDH-UHFFFAOYSA-N 1 2 318.804 4.391 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)Cc1cccc(Cl)c1 ZINC000425578565 335105837 /nfs/dbraw/zinc/10/58/37/335105837.db2.gz BYWZMIADXBSSAK-GFCCVEGCSA-N 1 2 302.805 4.169 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)Sc1ccc(Cl)cc1 ZINC000425583443 335106622 /nfs/dbraw/zinc/10/66/22/335106622.db2.gz AAFSPMHGZAHQEZ-LBPRGKRZSA-N 1 2 320.845 4.471 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1cc2c(s1)CCCCC2 ZINC000425583508 335106668 /nfs/dbraw/zinc/10/66/68/335106668.db2.gz AUMJBORHFVQOSK-UHFFFAOYSA-N 1 2 300.427 4.281 20 0 DIADLO Cc1ccc(C)c(SCC(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000425584102 335106870 /nfs/dbraw/zinc/10/68/70/335106870.db2.gz CNTWLGQJOUCDNX-UHFFFAOYSA-N 1 2 300.427 4.046 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1oc(C(C)C)nc1C ZINC000428308998 332449360 /nfs/dbraw/zinc/44/93/60/332449360.db2.gz BIMVLWCOYBKNBH-LBPRGKRZSA-N 1 2 306.381 4.105 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(C[C@@H]2CCC[C@H]2C)n1 ZINC000561916719 332515561 /nfs/dbraw/zinc/51/55/61/332515561.db2.gz CTSFQBNMMSPVLD-KGLIPLIRSA-N 1 2 324.428 4.009 20 0 DIADLO Cc1cccc([C@@H](c2noc(Cc3ccc[nH+]c3C)n2)C(C)C)c1 ZINC000561943600 332519097 /nfs/dbraw/zinc/51/90/97/332519097.db2.gz VUPDEHJPMUYKPJ-IBGZPJMESA-N 1 2 321.424 4.460 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)cn1 ZINC000427833503 332533947 /nfs/dbraw/zinc/53/39/47/332533947.db2.gz WDOFSNHCFIHPNJ-KBPBESRZSA-N 1 2 324.453 4.320 20 0 DIADLO c1c(-c2ccc(N[C@H]3CC[C@H]3C3CC3)cc2)[nH+]c2n1CCCC2 ZINC000562079283 332543513 /nfs/dbraw/zinc/54/35/13/332543513.db2.gz GCCBNIRVCURMEG-ROUUACIJSA-N 1 2 307.441 4.487 20 0 DIADLO COCc1nc(C[NH2+]Cc2ccc(-c3ccccc3)cc2)cs1 ZINC000562082097 332544076 /nfs/dbraw/zinc/54/40/76/332544076.db2.gz FMUSGFCDWATBMH-UHFFFAOYSA-N 1 2 324.449 4.246 20 0 DIADLO CSC[C@@H](C)[NH2+][C@@H](c1cccc(OC(C)C)c1)C(F)F ZINC000562449955 332594509 /nfs/dbraw/zinc/59/45/09/332594509.db2.gz CVBJPJRZROKYKP-RISCZKNCSA-N 1 2 303.418 4.121 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc(/C=C2/CC[C@@H](C)C2)n1 ZINC000562551200 332603229 /nfs/dbraw/zinc/60/32/29/332603229.db2.gz WEPVUDVJVDPTDQ-DKXRRRNBSA-N 1 2 322.412 4.174 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc(/C=C2/CC[C@H](C)C2)n1 ZINC000562551202 332603234 /nfs/dbraw/zinc/60/32/34/332603234.db2.gz WEPVUDVJVDPTDQ-FRRXJZEGSA-N 1 2 322.412 4.174 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2ccc(F)c(C3CC3)c2)c[nH+]1 ZINC000562898893 332638045 /nfs/dbraw/zinc/63/80/45/332638045.db2.gz XSPJKIIXPHEVES-UHFFFAOYSA-N 1 2 313.376 4.037 20 0 DIADLO CCn1cc[nH+]c1CNc1ccc(Cl)c(C(F)(F)F)c1 ZINC000051921406 332675480 /nfs/dbraw/zinc/67/54/80/332675480.db2.gz WUDRLXLAHIVVPM-UHFFFAOYSA-N 1 2 303.715 4.187 20 0 DIADLO CCCOc1cc(F)ccc1NCc1cn2cc(C)ccc2[nH+]1 ZINC000570430212 332753626 /nfs/dbraw/zinc/75/36/26/332753626.db2.gz RTPZNXIXAQFPMB-UHFFFAOYSA-N 1 2 313.376 4.183 20 0 DIADLO Cc1ccc(NC(=O)NCc2ccc(C(F)(F)F)cc2)c(C)[nH+]1 ZINC000176745525 332954656 /nfs/dbraw/zinc/95/46/56/332954656.db2.gz FXBGCOQVXIGXAA-UHFFFAOYSA-N 1 2 323.318 4.039 20 0 DIADLO c1nn(Cc2ccccc2)cc1CNc1ccc2ccccc2[nH+]1 ZINC000301077256 332969638 /nfs/dbraw/zinc/96/96/38/332969638.db2.gz HSMBFFRKBQIEHT-UHFFFAOYSA-N 1 2 314.392 4.092 20 0 DIADLO COc1cccc([C@@H](C)CC(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000177098263 332970532 /nfs/dbraw/zinc/97/05/32/332970532.db2.gz XNIFHVVLDLNALH-LBPRGKRZSA-N 1 2 312.413 4.148 20 0 DIADLO COc1cccc([C@H](C)CC(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000177098251 332970686 /nfs/dbraw/zinc/97/06/86/332970686.db2.gz XNIFHVVLDLNALH-GFCCVEGCSA-N 1 2 312.413 4.148 20 0 DIADLO COC(=O)c1sccc1C[NH2+][C@H](C)c1cc2ccccc2o1 ZINC000182622392 333043559 /nfs/dbraw/zinc/04/35/59/333043559.db2.gz XIZLMZBLVXXZMO-LLVKDONJSA-N 1 2 315.394 4.132 20 0 DIADLO COC(=O)c1sccc1C[N@H+](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000378678479 333044419 /nfs/dbraw/zinc/04/44/19/333044419.db2.gz QSNDQVBAPFJTLO-NSHDSACASA-N 1 2 323.845 4.381 20 0 DIADLO COC(=O)c1sccc1C[N@@H+](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000378678479 333044420 /nfs/dbraw/zinc/04/44/20/333044420.db2.gz QSNDQVBAPFJTLO-NSHDSACASA-N 1 2 323.845 4.381 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2nc3ccccc3s2)n1 ZINC000172353460 333061837 /nfs/dbraw/zinc/06/18/37/333061837.db2.gz HYAAZIBFBWJSJS-UHFFFAOYSA-N 1 2 303.456 4.086 20 0 DIADLO Cc1oncc1C[NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl ZINC000189316706 333072299 /nfs/dbraw/zinc/07/22/99/333072299.db2.gz JEGZSEPYXOXFCL-SSDOTTSWSA-N 1 2 303.164 4.280 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC(OC3CCCC3)CC2)c1 ZINC000563038561 333119434 /nfs/dbraw/zinc/11/94/34/333119434.db2.gz NBNSDOJVIYCJGC-UHFFFAOYSA-N 1 2 314.404 4.302 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)C[N@H+]1CC=C(C(C)(C)C)CC1 ZINC000533930267 333134247 /nfs/dbraw/zinc/13/42/47/333134247.db2.gz WYVRWPIBJUTBDV-UHFFFAOYSA-N 1 2 320.864 4.265 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)C[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000533930267 333134248 /nfs/dbraw/zinc/13/42/48/333134248.db2.gz WYVRWPIBJUTBDV-UHFFFAOYSA-N 1 2 320.864 4.265 20 0 DIADLO Fc1cccc(C[C@H]([NH2+]Cc2cocn2)c2cccc(F)c2)c1 ZINC000182077510 333148600 /nfs/dbraw/zinc/14/86/00/333148600.db2.gz ZPPFVYCJLAAOGI-SFHVURJKSA-N 1 2 314.335 4.026 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2ccccn2)c(Br)c1 ZINC000182066043 333148624 /nfs/dbraw/zinc/14/86/24/333148624.db2.gz ABKQRPKGPSQQGT-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)c2ccccn2)c(Br)c1 ZINC000182066043 333148625 /nfs/dbraw/zinc/14/86/25/333148625.db2.gz ABKQRPKGPSQQGT-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO CCn1cc([C@H](C)[NH2+][C@H](c2cccc(C)c2)c2ccccn2)cn1 ZINC000179535446 333152137 /nfs/dbraw/zinc/15/21/37/333152137.db2.gz GIWXKWZZMDTMGV-OXJNMPFZSA-N 1 2 320.440 4.047 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2noc(C(C)(C)C)n2)cc1 ZINC000179531877 333152211 /nfs/dbraw/zinc/15/22/11/333152211.db2.gz DXWONQMLPGHBDT-ZDUSSCGKSA-N 1 2 317.433 4.005 20 0 DIADLO c1ccc([C@@H]([NH2+]Cc2noc(C3CCCCC3)n2)C2CC2)cc1 ZINC000179687716 333154397 /nfs/dbraw/zinc/15/43/97/333154397.db2.gz OQYPEKNWESBALW-GOSISDBHSA-N 1 2 311.429 4.358 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](Cc3ccsc3)CCO2)cc1Cl ZINC000092972939 333157667 /nfs/dbraw/zinc/15/76/67/333157667.db2.gz WTLGVKBOOWWHLC-HNNXBMFYSA-N 1 2 311.809 4.114 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](Cc3ccsc3)CCO2)cc1Cl ZINC000092972939 333157669 /nfs/dbraw/zinc/15/76/69/333157669.db2.gz WTLGVKBOOWWHLC-HNNXBMFYSA-N 1 2 311.809 4.114 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1C[NH2+]C1(C(F)F)CCCCC1 ZINC000582029540 333174076 /nfs/dbraw/zinc/17/40/76/333174076.db2.gz AHHUZNNOWHWZNW-UHFFFAOYSA-N 1 2 313.436 4.313 20 0 DIADLO Cc1ncncc1[C@@H](C)[NH2+]Cc1cc(Cl)sc1Cl ZINC000580327654 333193074 /nfs/dbraw/zinc/19/30/74/333193074.db2.gz BIZBQJWPTNLTIP-SSDOTTSWSA-N 1 2 302.230 4.004 20 0 DIADLO Cc1cc(C)cc(C[NH2+][C@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000185403303 333208441 /nfs/dbraw/zinc/20/84/41/333208441.db2.gz PVZPOKFYKHYKEX-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO CC(C)c1ccc(-c2noc(C[N@H+](C)Cc3ccoc3)n2)cc1 ZINC000497456878 333253102 /nfs/dbraw/zinc/25/31/02/333253102.db2.gz AJINFUCTUOILSA-UHFFFAOYSA-N 1 2 311.385 4.085 20 0 DIADLO CC(C)c1ccc(-c2noc(C[N@@H+](C)Cc3ccoc3)n2)cc1 ZINC000497456878 333253103 /nfs/dbraw/zinc/25/31/03/333253103.db2.gz AJINFUCTUOILSA-UHFFFAOYSA-N 1 2 311.385 4.085 20 0 DIADLO CC(C)([NH2+]Cc1ccc(Cl)s1)c1cc(C(F)(F)F)on1 ZINC000492228577 333281596 /nfs/dbraw/zinc/28/15/96/333281596.db2.gz XFBPZLBWMOKTHQ-UHFFFAOYSA-N 1 2 324.755 4.433 20 0 DIADLO COc1cncc(/C=C\CC[NH2+][C@H](c2ccccc2)C(F)F)c1 ZINC000582119477 333294708 /nfs/dbraw/zinc/29/47/08/333294708.db2.gz WDUGTKABFTXZDZ-XTKXOIQPSA-N 1 2 318.367 4.090 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+]2CCC[C@@H]2c2ccccn2)o1 ZINC000531201617 333330700 /nfs/dbraw/zinc/33/07/00/333330700.db2.gz NVORMRRMWONNSV-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+]2CCC[C@@H]2c2ccccn2)o1 ZINC000531201617 333330701 /nfs/dbraw/zinc/33/07/01/333330701.db2.gz NVORMRRMWONNSV-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+]2CCC[C@H]2c2ccccn2)o1 ZINC000531201616 333330742 /nfs/dbraw/zinc/33/07/42/333330742.db2.gz NVORMRRMWONNSV-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+]2CCC[C@H]2c2ccccn2)o1 ZINC000531201616 333330743 /nfs/dbraw/zinc/33/07/43/333330743.db2.gz NVORMRRMWONNSV-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO c1oc(-c2ccccc2)nc1C[NH2+][C@@H]1CSc2ccccc21 ZINC000531251092 333337863 /nfs/dbraw/zinc/33/78/63/333337863.db2.gz JMTHYEBRXRSDJQ-MRXNPFEDSA-N 1 2 308.406 4.278 20 0 DIADLO Cc1cc2[nH+]cn(Cc3ncc(Cl)cc3Cl)c2cc1C ZINC000540735996 333340789 /nfs/dbraw/zinc/34/07/89/333340789.db2.gz AAKCHLVKWCXWFG-UHFFFAOYSA-N 1 2 306.196 4.403 20 0 DIADLO Clc1ccc(Cl)c(CC[N@@H+]2CCC[C@H]2c2ncc[nH]2)c1 ZINC000488123352 333362720 /nfs/dbraw/zinc/36/27/20/333362720.db2.gz IIHVZRBNCIOXDH-AWEZNQCLSA-N 1 2 310.228 4.096 20 0 DIADLO Clc1ccc(Cl)c(CC[N@H+]2CCC[C@H]2c2ncc[nH]2)c1 ZINC000488123352 333362721 /nfs/dbraw/zinc/36/27/21/333362721.db2.gz IIHVZRBNCIOXDH-AWEZNQCLSA-N 1 2 310.228 4.096 20 0 DIADLO Cc1nc(C[NH2+][C@H]2CC(C)(C)Cc3occc32)nc2ccccc12 ZINC000531707702 333548615 /nfs/dbraw/zinc/54/86/15/333548615.db2.gz NHCADXWGWYIGKS-KRWDZBQOSA-N 1 2 321.424 4.335 20 0 DIADLO CCc1ccc([C@@H](C)Nc2ccc(N3CCCC3)[nH+]c2)s1 ZINC000041203911 333552909 /nfs/dbraw/zinc/55/29/09/333552909.db2.gz CCGVTYXLEFRXHG-CYBMUJFWSA-N 1 2 301.459 4.479 20 0 DIADLO Cc1cc(NC(=O)N[C@H](CC(C)C)c2cccs2)c(C)c[nH+]1 ZINC000534325553 333576632 /nfs/dbraw/zinc/57/66/32/333576632.db2.gz XVGHDODCYJRECA-OAHLLOKOSA-N 1 2 317.458 4.091 20 0 DIADLO Cc1nsc(C)c1C[NH2+][C@H](C)c1ncc(-c2ccccc2)o1 ZINC000563355458 333595453 /nfs/dbraw/zinc/59/54/53/333595453.db2.gz PQFJOGYHRDGJMQ-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)c(C(F)(F)F)c1)c1cscn1 ZINC000563443222 333607609 /nfs/dbraw/zinc/60/76/09/333607609.db2.gz DXESKIVNMASHJA-QMMMGPOBSA-N 1 2 304.312 4.152 20 0 DIADLO CCC[C@@](C)(CC)C(=O)N[C@H]1CC[C@H](Nc2cccc[nH+]2)CC1 ZINC000563543280 333621802 /nfs/dbraw/zinc/62/18/02/333621802.db2.gz SWAHJQDGWFWJFS-GPMSIDNRSA-N 1 2 317.477 4.137 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H](C)c2ccc(Cl)s2)c(C)[nH+]1 ZINC000152189818 333642017 /nfs/dbraw/zinc/64/20/17/333642017.db2.gz MIKRGXCIROMYOA-JTQLQIEISA-N 1 2 309.822 4.296 20 0 DIADLO Cc1ccc(NC(=O)NCc2cccc(C(F)(F)F)c2)c(C)[nH+]1 ZINC000152201710 333644022 /nfs/dbraw/zinc/64/40/22/333644022.db2.gz HAIFDKMURHHSFW-UHFFFAOYSA-N 1 2 323.318 4.039 20 0 DIADLO Cc1ccc(NC(=O)N(CC2CC2)C2CCCCC2)c(C)[nH+]1 ZINC000152219840 333645180 /nfs/dbraw/zinc/64/51/80/333645180.db2.gz XPDQPPSDIWAUOY-UHFFFAOYSA-N 1 2 301.434 4.275 20 0 DIADLO CSc1ccc(CNc2cc(C(F)(F)F)cc[nH+]2)s1 ZINC000563661783 333649389 /nfs/dbraw/zinc/64/93/89/333649389.db2.gz LGTHPONLURPVOZ-UHFFFAOYSA-N 1 2 304.362 4.496 20 0 DIADLO O=C(C[C@@H]1CC[C@H]2C[C@H]21)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000571272788 333695492 /nfs/dbraw/zinc/69/54/92/333695492.db2.gz SLJTZQYVJKDALQ-SUNYJGFJSA-N 1 2 308.381 4.249 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cc(CC(C)C)c[nH]1 ZINC000412304278 333748591 /nfs/dbraw/zinc/74/85/91/333748591.db2.gz HDAFKAQYMJDVQY-UHFFFAOYSA-N 1 2 322.412 4.164 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)oc1C ZINC000323688882 333813171 /nfs/dbraw/zinc/81/31/71/333813171.db2.gz IGHNOMIKOQTEIL-IBGZPJMESA-N 1 2 310.372 4.310 20 0 DIADLO Cc1csc2ncnc(N3CCC(c4ccc(C)[nH+]c4)CC3)c12 ZINC000413246887 333839660 /nfs/dbraw/zinc/83/96/60/333839660.db2.gz PMZCVTBHUCOXDM-UHFFFAOYSA-N 1 2 324.453 4.087 20 0 DIADLO CC(=O)c1ccc2c(c1)CN(c1cc(C(C)C)[nH+]c(C(C)C)n1)C2 ZINC000413514254 333853537 /nfs/dbraw/zinc/85/35/37/333853537.db2.gz ZNFJWDXIQOCOEN-UHFFFAOYSA-N 1 2 323.440 4.446 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@H](C)c1ccn(C)n1 ZINC000414124736 333898849 /nfs/dbraw/zinc/89/88/49/333898849.db2.gz CKLVGXYVGPDFOE-DOMZBBRYSA-N 1 2 311.351 4.073 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)nc1C ZINC000414162157 333915512 /nfs/dbraw/zinc/91/55/12/333915512.db2.gz GNZYPKLZLIINHJ-JTQLQIEISA-N 1 2 315.364 4.025 20 0 DIADLO CCn1ccc(C[NH2+][C@@H](c2cccc(C)c2)c2cccc(F)c2)n1 ZINC000414206060 333921297 /nfs/dbraw/zinc/92/12/97/333921297.db2.gz IDWXNVCXRVKHJI-FQEVSTJZSA-N 1 2 323.415 4.230 20 0 DIADLO CCn1ccc(C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)n1 ZINC000414210284 333922285 /nfs/dbraw/zinc/92/22/85/333922285.db2.gz OGQFPBXHDKSQDH-LLVKDONJSA-N 1 2 303.793 4.153 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2c1ccc(Cl)c2Cl)c1csnn1 ZINC000414297999 333935756 /nfs/dbraw/zinc/93/57/56/333935756.db2.gz IHXMHLPJOZCBKB-RDDDGLTNSA-N 1 2 314.241 4.183 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1)c1csnn1 ZINC000414557098 334017166 /nfs/dbraw/zinc/01/71/66/334017166.db2.gz ZLBYHZIAWDCURN-SSDOTTSWSA-N 1 2 321.755 4.061 20 0 DIADLO c1ccc(-c2ccc(C[NH2+]Cc3nnc(C4CC4)s3)cc2)cc1 ZINC000414560958 334018993 /nfs/dbraw/zinc/01/89/93/334018993.db2.gz XWZCVBZRHXWXBS-UHFFFAOYSA-N 1 2 321.449 4.372 20 0 DIADLO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@H](C)c1cccnc1Cl ZINC000271418597 334023010 /nfs/dbraw/zinc/02/30/10/334023010.db2.gz BJRJOIKGWHTIBU-DOMZBBRYSA-N 1 2 302.805 4.136 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1cccc(C(F)(F)F)c1 ZINC000271652048 334024950 /nfs/dbraw/zinc/02/49/50/334024950.db2.gz JFCOIBPPJWOFSU-SNVBAGLBSA-N 1 2 310.319 4.422 20 0 DIADLO COc1ccc2c(c1)[C@@H]([NH2+]Cc1c(F)cccc1Cl)CCO2 ZINC000274267451 334058416 /nfs/dbraw/zinc/05/84/16/334058416.db2.gz PQPFDBQUWZHTRN-INIZCTEOSA-N 1 2 321.779 4.101 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@H+]2CC(C)=C[C@@H](C)C2)c(Cl)c1 ZINC000430284082 334069679 /nfs/dbraw/zinc/06/96/79/334069679.db2.gz KLISZWSMAIXNHO-IUODEOHRSA-N 1 2 320.864 4.182 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@@H+]2CC(C)=C[C@@H](C)C2)c(Cl)c1 ZINC000430284082 334069680 /nfs/dbraw/zinc/06/96/80/334069680.db2.gz KLISZWSMAIXNHO-IUODEOHRSA-N 1 2 320.864 4.182 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cc(F)ccc3Cl)CCC2)n1 ZINC000275634697 334072547 /nfs/dbraw/zinc/07/25/47/334072547.db2.gz RAARUMMRUKGNPM-UHFFFAOYSA-N 1 2 310.825 4.413 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2ccc(-c3cccs3)cc2)no1 ZINC000277666236 334089731 /nfs/dbraw/zinc/08/97/31/334089731.db2.gz JLTHUKROMZAUMG-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO CS[C@H](C(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccccc1 ZINC000414779185 334092739 /nfs/dbraw/zinc/09/27/39/334092739.db2.gz FMZFLJHWICJUHE-INIZCTEOSA-N 1 2 300.427 4.050 20 0 DIADLO CC(C)[C@@H](NC(=O)[C@@H](C)c1ccc2ccccc2c1)c1[nH]cc[nH+]1 ZINC000278515552 334097237 /nfs/dbraw/zinc/09/72/37/334097237.db2.gz BHSLPZIKNFCNDN-KBXCAEBGSA-N 1 2 321.424 4.180 20 0 DIADLO Brc1csc(CNc2ccc3c(c2)CCC[NH2+]3)c1 ZINC000414853333 334127324 /nfs/dbraw/zinc/12/73/24/334127324.db2.gz SADJPFIEEQYCRB-UHFFFAOYSA-N 1 2 323.259 4.481 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)C)no2)cc1 ZINC000281835969 334128972 /nfs/dbraw/zinc/12/89/72/334128972.db2.gz LFMBVVOLZZCHJE-NEPJUHHUSA-N 1 2 305.447 4.327 20 0 DIADLO CC[N@H+](Cc1cn(C(C)C)nc1C)Cc1c(F)cccc1F ZINC000343589156 335180076 /nfs/dbraw/zinc/18/00/76/335180076.db2.gz FSLYUATZTKJBFO-UHFFFAOYSA-N 1 2 307.388 4.073 20 0 DIADLO CC[N@@H+](Cc1cn(C(C)C)nc1C)Cc1c(F)cccc1F ZINC000343589156 335180078 /nfs/dbraw/zinc/18/00/78/335180078.db2.gz FSLYUATZTKJBFO-UHFFFAOYSA-N 1 2 307.388 4.073 20 0 DIADLO Cn1ccnc1C[NH2+][C@@H](c1cccs1)c1ccc(Cl)cc1 ZINC000340436720 334200740 /nfs/dbraw/zinc/20/07/40/334200740.db2.gz PBOATDKWHSBPTF-MRXNPFEDSA-N 1 2 317.845 4.014 20 0 DIADLO CC1=CC[N@H+]([C@H](C)c2nc(Cc3ccc(Cl)cc3)no2)CC1 ZINC000534480977 334276541 /nfs/dbraw/zinc/27/65/41/334276541.db2.gz XWFCYOKIVBEPPL-CYBMUJFWSA-N 1 2 317.820 4.027 20 0 DIADLO CC1=CC[N@@H+]([C@H](C)c2nc(Cc3ccc(Cl)cc3)no2)CC1 ZINC000534480977 334276543 /nfs/dbraw/zinc/27/65/43/334276543.db2.gz XWFCYOKIVBEPPL-CYBMUJFWSA-N 1 2 317.820 4.027 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccncn1)c1cc(F)c(Cl)cc1Cl ZINC000453052878 334228518 /nfs/dbraw/zinc/22/85/18/334228518.db2.gz DVMVEIDCPKKPPZ-BDAKNGLRSA-N 1 2 314.191 4.334 20 0 DIADLO Cc1c(N[C@H]2C[C@H](C)n3cc[nH+]c32)cnn1-c1cc(C)ccc1C ZINC000296349109 334232637 /nfs/dbraw/zinc/23/26/37/334232637.db2.gz HISRJNTVNCSKDW-HOCLYGCPSA-N 1 2 321.428 4.112 20 0 DIADLO Cc1csc(C2([NH2+]Cc3csc(C(C)(C)C)n3)CCC2)n1 ZINC000299544671 334256184 /nfs/dbraw/zinc/25/61/84/334256184.db2.gz AQRBMVOBDLDWKJ-UHFFFAOYSA-N 1 2 321.515 4.375 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2ccc(Cl)cc2)c2ncc[nH]2)cc1 ZINC000187684248 334267949 /nfs/dbraw/zinc/26/79/49/334267949.db2.gz AYOMHLVDYFXWRE-INIZCTEOSA-N 1 2 315.779 4.081 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[NH+]1CCN(Cc2ccsc2)CC1 ZINC000534522133 334278570 /nfs/dbraw/zinc/27/85/70/334278570.db2.gz WDOCJEQQJORTOF-AWEZNQCLSA-N 1 2 320.889 4.280 20 0 DIADLO COc1cc(C)[nH+]c(CSc2nc3ccc(Cl)cc3o2)c1 ZINC000534520091 334278641 /nfs/dbraw/zinc/27/86/41/334278641.db2.gz XYWADXBPNNFTIK-UHFFFAOYSA-N 1 2 320.801 4.486 20 0 DIADLO CC(C)(C)CCC(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000534552070 334281991 /nfs/dbraw/zinc/28/19/91/334281991.db2.gz CLXJTLUJCMZERZ-UHFFFAOYSA-N 1 2 323.440 4.367 20 0 DIADLO COc1ccc(C)cc1C[N@@H+]1CCc2c3ccccc3[nH]c2C1 ZINC000534667522 334319129 /nfs/dbraw/zinc/31/91/29/334319129.db2.gz SAGNWVXWJIZNAL-UHFFFAOYSA-N 1 2 306.409 4.043 20 0 DIADLO COc1ccc(C)cc1C[N@H+]1CCc2c3ccccc3[nH]c2C1 ZINC000534667522 334319130 /nfs/dbraw/zinc/31/91/30/334319130.db2.gz SAGNWVXWJIZNAL-UHFFFAOYSA-N 1 2 306.409 4.043 20 0 DIADLO COc1c(C)cc(C[N@H+](C)[C@@H](C)c2nc(C(C)C)no2)cc1C ZINC000101566169 334327794 /nfs/dbraw/zinc/32/77/94/334327794.db2.gz KVEXCXYXTZMNMK-AWEZNQCLSA-N 1 2 317.433 4.011 20 0 DIADLO COc1c(C)cc(C[N@@H+](C)[C@@H](C)c2nc(C(C)C)no2)cc1C ZINC000101566169 334327796 /nfs/dbraw/zinc/32/77/96/334327796.db2.gz KVEXCXYXTZMNMK-AWEZNQCLSA-N 1 2 317.433 4.011 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(F)c(F)c2)C[C@H](c2ccc(F)cc2)O1 ZINC000303841684 334334627 /nfs/dbraw/zinc/33/46/27/334334627.db2.gz BRQAKIRGZLHUFC-KZULUSFZSA-N 1 2 321.342 4.066 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(F)c(F)c2)C[C@H](c2ccc(F)cc2)O1 ZINC000303841684 334334628 /nfs/dbraw/zinc/33/46/28/334334628.db2.gz BRQAKIRGZLHUFC-KZULUSFZSA-N 1 2 321.342 4.066 20 0 DIADLO C[N@H+](Cc1cscn1)Cc1ccc(OCc2ccccc2)cc1 ZINC000063742455 334343292 /nfs/dbraw/zinc/34/32/92/334343292.db2.gz NQDQLYMHQCNUPL-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO C[N@@H+](Cc1cscn1)Cc1ccc(OCc2ccccc2)cc1 ZINC000063742455 334343294 /nfs/dbraw/zinc/34/32/94/334343294.db2.gz NQDQLYMHQCNUPL-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000303927313 334347431 /nfs/dbraw/zinc/34/74/31/334347431.db2.gz PYXDCZDIWTUAJH-ACJLOTCBSA-N 1 2 319.807 4.441 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000303927313 334347433 /nfs/dbraw/zinc/34/74/33/334347433.db2.gz PYXDCZDIWTUAJH-ACJLOTCBSA-N 1 2 319.807 4.441 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2)C[C@@H](c2ccc(F)cc2)O1 ZINC000303957569 334349181 /nfs/dbraw/zinc/34/91/81/334349181.db2.gz XZHHNKTYHXVOMD-ACJLOTCBSA-N 1 2 319.807 4.441 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2)C[C@@H](c2ccc(F)cc2)O1 ZINC000303957569 334349183 /nfs/dbraw/zinc/34/91/83/334349183.db2.gz XZHHNKTYHXVOMD-ACJLOTCBSA-N 1 2 319.807 4.441 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2ccc(C)cc2OC)o1 ZINC000531980918 334352926 /nfs/dbraw/zinc/35/29/26/334352926.db2.gz IVSWHFIFGBBMJE-PBHICJAKSA-N 1 2 317.429 4.197 20 0 DIADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)[C@H](c1ccccc1)C1CC1 ZINC000535027086 334356642 /nfs/dbraw/zinc/35/66/42/334356642.db2.gz BXXSKFXHPFTNBE-LJQANCHMSA-N 1 2 317.392 4.209 20 0 DIADLO Cc1ccc(C(=O)NC(C)(C)C2CC2)cc1Oc1cc[nH+]cc1 ZINC000535030075 334356875 /nfs/dbraw/zinc/35/68/75/334356875.db2.gz JLCJLNKMCSGQQD-UHFFFAOYSA-N 1 2 310.397 4.101 20 0 DIADLO CCCOc1ccc(C[N@H+](C)Cc2csc(CC)n2)cc1 ZINC000535084727 334367041 /nfs/dbraw/zinc/36/70/41/334367041.db2.gz NMIDRDSDUJXCKT-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO CCCOc1ccc(C[N@@H+](C)Cc2csc(CC)n2)cc1 ZINC000535084727 334367043 /nfs/dbraw/zinc/36/70/43/334367043.db2.gz NMIDRDSDUJXCKT-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO Cc1ccnc(C[NH2+][C@@H](c2ccccc2)c2cccc(Cl)c2)n1 ZINC000535137911 334374751 /nfs/dbraw/zinc/37/47/51/334374751.db2.gz KTXTYWCXHXXKOG-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)Cc2cccc(Cl)c2)c(C)[nH+]1 ZINC000535206671 334380232 /nfs/dbraw/zinc/38/02/32/334380232.db2.gz MGTPZKIFAJJLSD-LBPRGKRZSA-N 1 2 316.832 4.478 20 0 DIADLO Cc1ccc(NC(=O)C[C@@H](c2[nH]cc[nH+]2)c2ccccc2)cc1C ZINC000340784508 334385433 /nfs/dbraw/zinc/38/54/33/334385433.db2.gz AWXXUJJQIJKDGO-GOSISDBHSA-N 1 2 319.408 4.187 20 0 DIADLO O=C(C[C@H]1C[C@H]1c1ccccc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000340898066 334389275 /nfs/dbraw/zinc/38/92/75/334389275.db2.gz NWOLCIMBYIJAHS-APWZRJJASA-N 1 2 317.392 4.005 20 0 DIADLO Fc1ccc2cc[nH+]c(NCc3nc(-c4cccs4)c[nH]3)c2c1 ZINC000340859714 334390847 /nfs/dbraw/zinc/39/08/47/334390847.db2.gz BGZBYSHAWBTQFJ-UHFFFAOYSA-N 1 2 324.384 4.438 20 0 DIADLO Cc1ccc(NC(=O)C[C@H](c2[nH]cc[nH+]2)c2ccccc2)cc1F ZINC000341011418 334399457 /nfs/dbraw/zinc/39/94/57/334399457.db2.gz FUTDKVUWPGBJBJ-INIZCTEOSA-N 1 2 323.371 4.018 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)o1 ZINC000341070657 334407492 /nfs/dbraw/zinc/40/74/92/334407492.db2.gz QIGISSHUCQETPH-VHSXEESVSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1c[nH+]c(CNc2ccc(SCc3ccccc3)cn2)n1C ZINC000341281713 334428253 /nfs/dbraw/zinc/42/82/53/334428253.db2.gz MIZLENYXVLXZOH-UHFFFAOYSA-N 1 2 324.453 4.028 20 0 DIADLO CC[C@@H](C)n1ncc(NCc2c[nH+]c3c(C)cccn23)c1C1CC1 ZINC000341380707 334437262 /nfs/dbraw/zinc/43/72/62/334437262.db2.gz QUBHWPKSMCQDJW-CQSZACIVSA-N 1 2 323.444 4.300 20 0 DIADLO Cc1cc(N2CCC[C@@H]2Cc2ccc(F)cc2)nc(C2CC2)[nH+]1 ZINC000341496390 334448288 /nfs/dbraw/zinc/44/82/88/334448288.db2.gz KTGJLNNMAITYJL-QGZVFWFLSA-N 1 2 311.404 4.013 20 0 DIADLO Cc1ccc2oc(C(=O)Nc3ccc(-n4cc[nH+]c4)cc3)cc2c1 ZINC000341910444 334491048 /nfs/dbraw/zinc/49/10/48/334491048.db2.gz RFYDXYZIZYPSGW-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO Cn1c(CCSCc2ncc(Cl)s2)[nH+]c2ccccc21 ZINC000342007315 334500830 /nfs/dbraw/zinc/50/08/30/334500830.db2.gz WQYNTLBEIRXLQR-UHFFFAOYSA-N 1 2 323.874 4.159 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccccc2C(F)(F)F)o1 ZINC000341992746 334503888 /nfs/dbraw/zinc/50/38/88/334503888.db2.gz COXPOMBUFNDXQT-ZJUUUORDSA-N 1 2 313.323 4.063 20 0 DIADLO Cn1c2c(cccc2F)[nH+]c1N1CCC[C@H]1c1ccc(F)cc1 ZINC000443440609 338451777 /nfs/dbraw/zinc/45/17/77/338451777.db2.gz SOKWWXNHSJEOFM-INIZCTEOSA-N 1 2 313.351 4.193 20 0 DIADLO Clc1cnc(NCc2cccc(-n3cc[nH+]c3)c2)c(Cl)c1 ZINC000342417491 334534690 /nfs/dbraw/zinc/53/46/90/334534690.db2.gz RIPJOHDHQREVDJ-UHFFFAOYSA-N 1 2 319.195 4.186 20 0 DIADLO Cc1ccc([C@H]2CCCN2c2[nH+]c3cccc(F)c3n2C)s1 ZINC000443499697 338452882 /nfs/dbraw/zinc/45/28/82/338452882.db2.gz IOLKRSBHUQQLCP-CQSZACIVSA-N 1 2 315.417 4.424 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@@H](c2cccs2)C2CC2)n1 ZINC000342516755 334548768 /nfs/dbraw/zinc/54/87/68/334548768.db2.gz XBIVKVCSCMJOLT-IINYFYTJSA-N 1 2 323.487 4.186 20 0 DIADLO Cc1c[nH+]c(CN2CCc3cc(Cl)c(Cl)cc3[C@@H]2C)n1C ZINC000342793657 334571972 /nfs/dbraw/zinc/57/19/72/334571972.db2.gz RMBOQGKKHDDRQU-NSHDSACASA-N 1 2 324.255 4.155 20 0 DIADLO Cc1ccc(NC(=O)N[C@H]2c3ccccc3CC[C@H]2C)c(C)[nH+]1 ZINC000342894900 334587273 /nfs/dbraw/zinc/58/72/73/334587273.db2.gz ARJRLZCCCFGRSQ-KZULUSFZSA-N 1 2 309.413 4.144 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)cs1 ZINC000343105955 334600915 /nfs/dbraw/zinc/60/09/15/334600915.db2.gz XEGUWTUYCNITKS-ZUZCIYMTSA-N 1 2 322.861 4.281 20 0 DIADLO Cc1ccc(C(=O)N2C[C@H](C)[C@@H](C)[C@H]2C)cc1Oc1cc[nH+]cc1 ZINC000416071810 334649595 /nfs/dbraw/zinc/64/95/95/334649595.db2.gz MATMVWYZTDHUNO-ARFHVFGLSA-N 1 2 324.424 4.299 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@@H]1CCC[C@@H]1C(C)(C)C ZINC000417126150 334696909 /nfs/dbraw/zinc/69/69/09/334696909.db2.gz PGUNAPXVUZVTNW-LSDHHAIUSA-N 1 2 303.450 4.377 20 0 DIADLO Cc1ccc(C(=O)Nc2ccccc2-n2cc[nH+]c2)cc1Cl ZINC000343242982 334735602 /nfs/dbraw/zinc/73/56/02/334735602.db2.gz BFOIIKPKUDMENP-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO CC(C)n1c[nH+]cc1CN(C)Cc1cccc(Cl)c1Cl ZINC000425328776 334769729 /nfs/dbraw/zinc/76/97/29/334769729.db2.gz UXTSLQBJUMREBZ-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)Nc1c(C)cc[nH+]c1C ZINC000331239307 334849633 /nfs/dbraw/zinc/84/96/33/334849633.db2.gz JZLQBYHGFLIGNO-RCBQFDQVSA-N 1 2 304.434 4.011 20 0 DIADLO FC(F)CC1C[NH+](Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000425368488 334859743 /nfs/dbraw/zinc/85/97/43/334859743.db2.gz WZUXUCQHQXYFJN-UHFFFAOYSA-N 1 2 313.697 4.446 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cc(F)ccc1Cl)c1nc(C2CC2)no1 ZINC000189351014 334892533 /nfs/dbraw/zinc/89/25/33/334892533.db2.gz CWAZLWXDLBYYBW-AWEZNQCLSA-N 1 2 323.799 4.226 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2nc(C(F)F)no2)C(C)C)cc1 ZINC000425424909 334904155 /nfs/dbraw/zinc/90/41/55/334904155.db2.gz NZIGHYCQYNTDHI-AWEZNQCLSA-N 1 2 309.360 4.057 20 0 DIADLO CCCc1ccc([C@H]([NH2+]Cc2nc(C(F)F)no2)C(C)C)cc1 ZINC000425428526 334904765 /nfs/dbraw/zinc/90/47/65/334904765.db2.gz WICDYXRCWKUBQQ-OAHLLOKOSA-N 1 2 323.387 4.447 20 0 DIADLO CC(C)(C)C[C@H]([NH2+]Cc1nc(C(F)F)no1)c1ccccc1 ZINC000425460567 334913921 /nfs/dbraw/zinc/91/39/21/334913921.db2.gz QYTFXQABFIKXNK-LBPRGKRZSA-N 1 2 309.360 4.274 20 0 DIADLO COCC[C@H]1CCCCN(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000563710784 334920057 /nfs/dbraw/zinc/92/00/57/334920057.db2.gz VXLDAOBLWSONAY-CQSZACIVSA-N 1 2 302.393 4.017 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1nc(C2CC2)cs1 ZINC000343619182 335182074 /nfs/dbraw/zinc/18/20/74/335182074.db2.gz UVAROXVXADUTGJ-MRXNPFEDSA-N 1 2 301.459 4.086 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1nc(C2CC2)cs1 ZINC000343619182 335182075 /nfs/dbraw/zinc/18/20/75/335182075.db2.gz UVAROXVXADUTGJ-MRXNPFEDSA-N 1 2 301.459 4.086 20 0 DIADLO COc1cncc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)c1 ZINC000343778472 335192304 /nfs/dbraw/zinc/19/23/04/335192304.db2.gz YFOXQKYZVRHKEZ-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1cncc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)c1 ZINC000343778472 335192305 /nfs/dbraw/zinc/19/23/05/335192305.db2.gz YFOXQKYZVRHKEZ-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@H](C3CC3)C2)cc1Oc1cc[nH+]cc1 ZINC000343875053 335199255 /nfs/dbraw/zinc/19/92/55/335199255.db2.gz ULSGDEGQYNWXSF-KRWDZBQOSA-N 1 2 322.408 4.054 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)cn1)c1nc(C(F)(F)F)cs1 ZINC000343830566 335200144 /nfs/dbraw/zinc/20/01/44/335200144.db2.gz BSZPKUDWGSCKID-ZETCQYMHSA-N 1 2 321.755 4.061 20 0 DIADLO COc1cc[nH+]cc1CSc1nc2ccc(Cl)cc2o1 ZINC000343831976 335200336 /nfs/dbraw/zinc/20/03/36/335200336.db2.gz DQUMTHYRHMOQEC-UHFFFAOYSA-N 1 2 306.774 4.177 20 0 DIADLO COc1cc[nH+]cc1CSc1ccccc1Br ZINC000343838125 335200843 /nfs/dbraw/zinc/20/08/43/335200843.db2.gz XTUHGWVVDYABEN-UHFFFAOYSA-N 1 2 310.216 4.145 20 0 DIADLO CC(C)CC1(C)CC[NH+](Cc2nccn2CC(F)(F)F)CC1 ZINC000343992138 335206321 /nfs/dbraw/zinc/20/63/21/335206321.db2.gz MLMDXQPDGZTDEP-UHFFFAOYSA-N 1 2 317.399 4.094 20 0 DIADLO COC[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1cccc(Cl)c1 ZINC000344198417 335224396 /nfs/dbraw/zinc/22/43/96/335224396.db2.gz OUEZLLRYTCAOBO-AWEZNQCLSA-N 1 2 322.861 4.151 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(C3CC3)n2)Cc2ccccc2O1 ZINC000344162047 335226120 /nfs/dbraw/zinc/22/61/20/335226120.db2.gz YOFHWBKGCWQMOZ-UHFFFAOYSA-N 1 2 314.454 4.194 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(C3CC3)n2)Cc2ccccc2O1 ZINC000344162047 335226121 /nfs/dbraw/zinc/22/61/21/335226121.db2.gz YOFHWBKGCWQMOZ-UHFFFAOYSA-N 1 2 314.454 4.194 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCCc4occc4C3)cs2)o1 ZINC000344242773 335231530 /nfs/dbraw/zinc/23/15/30/335231530.db2.gz ZEMQELLNUJWEPO-UHFFFAOYSA-N 1 2 314.410 4.253 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCCc4occc4C3)cs2)o1 ZINC000344242773 335231531 /nfs/dbraw/zinc/23/15/31/335231531.db2.gz ZEMQELLNUJWEPO-UHFFFAOYSA-N 1 2 314.410 4.253 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+]2CCCc3occc3C2)o1 ZINC000344292590 335237155 /nfs/dbraw/zinc/23/71/55/335237155.db2.gz OAWSFDMAWPOQTH-UHFFFAOYSA-N 1 2 312.344 4.022 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+]2CCCc3occc3C2)o1 ZINC000344292590 335237156 /nfs/dbraw/zinc/23/71/56/335237156.db2.gz OAWSFDMAWPOQTH-UHFFFAOYSA-N 1 2 312.344 4.022 20 0 DIADLO CC[C@]1(C)CCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000344328414 335241048 /nfs/dbraw/zinc/24/10/48/335241048.db2.gz VRSZOOHWKUODGV-LJQANCHMSA-N 1 2 310.397 4.136 20 0 DIADLO CC[C@]1(C)CCN(C(=O)c2ccc(C)c(Oc3cc[nH+]cc3)c2)C1 ZINC000344344823 335242991 /nfs/dbraw/zinc/24/29/91/335242991.db2.gz DEAUFEDNZBMQCR-HXUWFJFHSA-N 1 2 324.424 4.445 20 0 DIADLO c1nc(C[NH2+][C@H]2CCOc3c(-c4ccccc4)cccc32)cs1 ZINC000344423825 335247639 /nfs/dbraw/zinc/24/76/39/335247639.db2.gz PWDCHKHFXFQYKJ-SFHVURJKSA-N 1 2 322.433 4.424 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2cccc(Cl)c2Cl)s1 ZINC000344627879 335264986 /nfs/dbraw/zinc/26/49/86/335264986.db2.gz GKKPIOOOAAGREH-UHFFFAOYSA-N 1 2 316.257 4.258 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2cc(Cl)cc(Cl)c2)s1 ZINC000344632895 335265491 /nfs/dbraw/zinc/26/54/91/335265491.db2.gz VBWZQXOICBVOMX-UHFFFAOYSA-N 1 2 316.257 4.258 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2cncc(F)c2)C2CC2)o1 ZINC000344699048 335267949 /nfs/dbraw/zinc/26/79/49/335267949.db2.gz XGYMGFADDOOIRU-YVEFUNNKSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cncc(F)c2)C2CC2)o1 ZINC000344699048 335267951 /nfs/dbraw/zinc/26/79/51/335267951.db2.gz XGYMGFADDOOIRU-YVEFUNNKSA-N 1 2 300.377 4.102 20 0 DIADLO CC(C)c1occc1C(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000366875601 335273189 /nfs/dbraw/zinc/27/31/89/335273189.db2.gz JFJKXEFRUCTWNJ-UHFFFAOYSA-N 1 2 309.369 4.056 20 0 DIADLO CCc1cncc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)c1 ZINC000345157470 335302309 /nfs/dbraw/zinc/30/23/09/335302309.db2.gz LHDXPFLVUCKXLO-UHFFFAOYSA-N 1 2 319.364 4.084 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CCS[C@@H](C)[C@H]1c1ccccc1 ZINC000345158262 335302495 /nfs/dbraw/zinc/30/24/95/335302495.db2.gz PUZASUFEKKRSQR-YJBOKZPZSA-N 1 2 315.486 4.143 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CCS[C@@H](C)[C@H]1c1ccccc1 ZINC000345158262 335302496 /nfs/dbraw/zinc/30/24/96/335302496.db2.gz PUZASUFEKKRSQR-YJBOKZPZSA-N 1 2 315.486 4.143 20 0 DIADLO C[C@H]1CC[C@H](C(=O)Nc2ccc(-c3cn4c([nH+]3)CCCC4)cc2)C1 ZINC000345133628 335304388 /nfs/dbraw/zinc/30/43/88/335304388.db2.gz AUIIHBZZUFZRFN-HOCLYGCPSA-N 1 2 323.440 4.261 20 0 DIADLO Clc1ccc(C2([NH2+]Cc3csc(C4CC4)n3)CC2)cc1 ZINC000113342084 335325139 /nfs/dbraw/zinc/32/51/39/335325139.db2.gz SYEFONFHKODZMJ-UHFFFAOYSA-N 1 2 304.846 4.453 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ccccc1Cl)c1nc(C2CC2)no1 ZINC000113357712 335325550 /nfs/dbraw/zinc/32/55/50/335325550.db2.gz AIKGVGXGVUWTGY-AWEZNQCLSA-N 1 2 305.809 4.087 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2ccc(Cl)s2)s1 ZINC000345881890 335358035 /nfs/dbraw/zinc/35/80/35/335358035.db2.gz USUNIZQVOARAJK-MRVPVSSYSA-N 1 2 301.868 4.227 20 0 DIADLO Cc1ccc(Cc2noc(-c3cccc4ccsc43)n2)c[nH+]1 ZINC000346132539 335379644 /nfs/dbraw/zinc/37/96/44/335379644.db2.gz LZQKBNKKWDWDPE-UHFFFAOYSA-N 1 2 307.378 4.246 20 0 DIADLO C[C@@H](Nc1ccccc1COCc1ccccc1)c1[nH+]ccn1C ZINC000346239191 335387293 /nfs/dbraw/zinc/38/72/93/335387293.db2.gz PBNVVHULDCJRRV-MRXNPFEDSA-N 1 2 321.424 4.310 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2Cc3ccccc3OC[C@H]2C)s1 ZINC000346296967 335393409 /nfs/dbraw/zinc/39/34/09/335393409.db2.gz NLCKDWFQJJWNGR-CYBMUJFWSA-N 1 2 302.443 4.050 20 0 DIADLO CC(C)c1cnc(C[N@H+]2Cc3ccccc3OC[C@H]2C)s1 ZINC000346296967 335393411 /nfs/dbraw/zinc/39/34/11/335393411.db2.gz NLCKDWFQJJWNGR-CYBMUJFWSA-N 1 2 302.443 4.050 20 0 DIADLO CC1(C)CCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000346350827 335397067 /nfs/dbraw/zinc/39/70/67/335397067.db2.gz NVLCLPWYVNTLDG-UHFFFAOYSA-N 1 2 310.397 4.136 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1ccc2ncsc2c1)C(=O)OC(C)(C)C ZINC000479486618 335406022 /nfs/dbraw/zinc/40/60/22/335406022.db2.gz BWYXVXWPRZLKOG-YPMHNXCESA-N 1 2 320.458 4.067 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)cn1)c1nc(-c2ccccc2)cs1 ZINC000346568159 335416970 /nfs/dbraw/zinc/41/69/70/335416970.db2.gz OGIDHADJUBULDP-LBPRGKRZSA-N 1 2 313.401 4.195 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccccc1Oc1ccccc1)c1nncn1C ZINC000346932378 335455692 /nfs/dbraw/zinc/45/56/92/335455692.db2.gz AXQZTPKLSRUBKM-HUUCEWRRSA-N 1 2 322.412 4.019 20 0 DIADLO CCO[C@@H](C)c1noc(C[NH2+][C@@H](CC(C)C)c2cccs2)n1 ZINC000347611668 335510384 /nfs/dbraw/zinc/51/03/84/335510384.db2.gz NEHCPAIJRYLKFZ-STQMWFEESA-N 1 2 323.462 4.106 20 0 DIADLO Cn1c[nH+]cc1CNc1ccccc1-c1cc(F)c(F)c(F)c1 ZINC000347730390 335520457 /nfs/dbraw/zinc/52/04/57/335520457.db2.gz IESTZBFTJGILNF-UHFFFAOYSA-N 1 2 317.314 4.117 20 0 DIADLO CCn1cc[nH+]c1CN1C[C@H](c2ccccc2)c2ccccc21 ZINC000444771404 338487582 /nfs/dbraw/zinc/48/75/82/338487582.db2.gz JAXFJHKBQJHATC-GOSISDBHSA-N 1 2 303.409 4.055 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@H]2CCc3c2cc(Cl)cc3Cl)n1 ZINC000348094810 335552926 /nfs/dbraw/zinc/55/29/26/335552926.db2.gz ZNXCALMJTAOXMV-CPFSXVBKSA-N 1 2 312.200 4.023 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2nc(-c3ccccc3)oc2C)n1 ZINC000348105513 335553991 /nfs/dbraw/zinc/55/39/91/335553991.db2.gz FACCNQSIDOHWQH-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1cc(N[C@H](Cc2ccc(Cl)cc2)c2ccccn2)nc[nH+]1 ZINC000348116321 335555018 /nfs/dbraw/zinc/55/50/18/335555018.db2.gz JXQKQRSKIRAXBI-QGZVFWFLSA-N 1 2 324.815 4.229 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2cc3ccccc3s2)o1 ZINC000348190051 335563977 /nfs/dbraw/zinc/56/39/77/335563977.db2.gz ZUVWRZUISODPCB-QWRGUYRKSA-N 1 2 301.415 4.259 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1c(C)noc1C ZINC000348326456 335577628 /nfs/dbraw/zinc/57/76/28/335577628.db2.gz YOJTZOXJWCMSKE-MRXNPFEDSA-N 1 2 311.385 4.187 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2cccc(OC(C)(C)C)n2)cs1 ZINC000348329462 335578289 /nfs/dbraw/zinc/57/82/89/335578289.db2.gz YQQLUKUNKMEWOA-GFCCVEGCSA-N 1 2 319.474 4.129 20 0 DIADLO Cc1csc([C@@H]2CCCCN2c2cc(C)[nH+]c(C(C)C)n2)n1 ZINC000348356115 335580033 /nfs/dbraw/zinc/58/00/33/335580033.db2.gz WNTAVBZLGXLLFR-AWEZNQCLSA-N 1 2 316.474 4.405 20 0 DIADLO CC(C)OC1CCN(c2cc(C(C)C)[nH+]c(C(C)C)n2)CC1 ZINC000535593363 335657207 /nfs/dbraw/zinc/65/72/07/335657207.db2.gz RQJIZZQEEDTVFU-UHFFFAOYSA-N 1 2 305.466 4.117 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3ccccc3OC(C)C)ccc2[nH+]1 ZINC000349466033 335674085 /nfs/dbraw/zinc/67/40/85/335674085.db2.gz VZMKZDJVNZNSJD-UHFFFAOYSA-N 1 2 324.384 4.074 20 0 DIADLO CCOc1ccc(C[NH+](Cc2ccco2)Cc2ccco2)cc1 ZINC000349612233 335685020 /nfs/dbraw/zinc/68/50/20/335685020.db2.gz AROLGLGKTCABHM-UHFFFAOYSA-N 1 2 311.381 4.474 20 0 DIADLO Oc1cc(F)cc(C[NH2+]Cc2nc3cc(Cl)ccc3s2)c1 ZINC000349613532 335685100 /nfs/dbraw/zinc/68/51/00/335685100.db2.gz RZPFHPKWRCZPAH-UHFFFAOYSA-N 1 2 322.792 4.084 20 0 DIADLO Clc1ccc(Cl)c(OCC[NH+]2Cc3ccccc3C2)c1 ZINC000519285819 335828316 /nfs/dbraw/zinc/82/83/16/335828316.db2.gz NDWGQKJJWMKMPM-UHFFFAOYSA-N 1 2 308.208 4.388 20 0 DIADLO CCCc1ccc([C@H]([NH2+]Cc2noc(C3CC3)n2)C(C)C)cc1 ZINC000097078879 335839506 /nfs/dbraw/zinc/83/95/06/335839506.db2.gz RGZBDMYZSKZDLR-GOSISDBHSA-N 1 2 313.445 4.386 20 0 DIADLO FC(F)[C@H](Cc1ccccc1)[NH2+]Cc1ccc2ccccc2n1 ZINC000536704743 335866126 /nfs/dbraw/zinc/86/61/26/335866126.db2.gz FZVVSVKALQIEHL-SFHVURJKSA-N 1 2 312.363 4.201 20 0 DIADLO CCc1cc(N(C)[C@@H]2CCC[C@@H](C)C2)nc(-c2ccncc2)[nH+]1 ZINC000520270539 335952289 /nfs/dbraw/zinc/95/22/89/335952289.db2.gz VNIMVUAGHUBQHB-RHSMWYFYSA-N 1 2 310.445 4.116 20 0 DIADLO Cc1ccc2c(CC(=O)Nc3c(C)cc(C)[nH+]c3C)coc2c1 ZINC000520507724 335984888 /nfs/dbraw/zinc/98/48/88/335984888.db2.gz VCGIAQGDLKFLDC-UHFFFAOYSA-N 1 2 308.381 4.243 20 0 DIADLO CCc1sc(C(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)cc1C ZINC000520615583 335995602 /nfs/dbraw/zinc/99/56/02/335995602.db2.gz HEUVVLSTXAFLEZ-UHFFFAOYSA-N 1 2 311.410 4.261 20 0 DIADLO COc1cc[nH+]cc1NC(=O)C12CC3C[C@@](C)(C1)C[C@](C)(C3)C2 ZINC000216275777 336017501 /nfs/dbraw/zinc/01/75/01/336017501.db2.gz NQIYNSZOSOWEEP-DFDFAMMDSA-N 1 2 314.429 4.025 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2cocn2)c2ccsc2)cc1 ZINC000192295853 336027594 /nfs/dbraw/zinc/02/75/94/336027594.db2.gz AEVDUKFTCHUBBX-OAHLLOKOSA-N 1 2 304.802 4.269 20 0 DIADLO CC(C)(C)c1[nH]c2ccc(NC(=O)c3ccoc3Cl)cc2[nH+]1 ZINC000192396562 336030548 /nfs/dbraw/zinc/03/05/48/336030548.db2.gz PXWLRBNJPZQUHZ-UHFFFAOYSA-N 1 2 317.776 4.359 20 0 DIADLO Cc1nccc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)n1 ZINC000351451041 336035735 /nfs/dbraw/zinc/03/57/35/336035735.db2.gz JQGBWEGBLLGQRB-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO Cc1nccc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)n1 ZINC000351451041 336035736 /nfs/dbraw/zinc/03/57/36/336035736.db2.gz JQGBWEGBLLGQRB-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO CCCc1nc(C)c(NCc2ccc(N3CCCC3)[nH+]c2)s1 ZINC000351497805 336038612 /nfs/dbraw/zinc/03/86/12/336038612.db2.gz YEWLXBFXHSDEAS-UHFFFAOYSA-N 1 2 316.474 4.011 20 0 DIADLO Cc1nccc(C[N@@H+]2CCc3c(Cl)cc(Cl)cc3[C@@H]2C)n1 ZINC000351773693 336068292 /nfs/dbraw/zinc/06/82/92/336068292.db2.gz HQFHTDDOQCXRKI-JTQLQIEISA-N 1 2 322.239 4.211 20 0 DIADLO Cc1nccc(C[N@H+]2CCc3c(Cl)cc(Cl)cc3[C@@H]2C)n1 ZINC000351773693 336068294 /nfs/dbraw/zinc/06/82/94/336068294.db2.gz HQFHTDDOQCXRKI-JTQLQIEISA-N 1 2 322.239 4.211 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1nc2ccccc2s1 ZINC000029189067 336068833 /nfs/dbraw/zinc/06/88/33/336068833.db2.gz PECPYJRSRACPFX-NSHDSACASA-N 1 2 300.452 4.477 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1nc2ccccc2s1 ZINC000029189067 336068834 /nfs/dbraw/zinc/06/88/34/336068834.db2.gz PECPYJRSRACPFX-NSHDSACASA-N 1 2 300.452 4.477 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc2ccccc2o1)c1nnc2n1CCCCC2 ZINC000324181626 336103269 /nfs/dbraw/zinc/10/32/69/336103269.db2.gz HWKWTQIWOJMECS-UONOGXRCSA-N 1 2 324.428 4.163 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+]2CCC[C@H]2c2ccc(C)o2)n1 ZINC000331375013 336133962 /nfs/dbraw/zinc/13/39/62/336133962.db2.gz CSXDMEULHFCPTN-KBPBESRZSA-N 1 2 303.406 4.212 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+]2CCC[C@H]2c2ccc(C)o2)n1 ZINC000331375013 336133964 /nfs/dbraw/zinc/13/39/64/336133964.db2.gz CSXDMEULHFCPTN-KBPBESRZSA-N 1 2 303.406 4.212 20 0 DIADLO CC(C)C[C@@H](C)CC(=O)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000445966272 338516399 /nfs/dbraw/zinc/51/63/99/338516399.db2.gz PRFGYBYCVZCAOX-CQSZACIVSA-N 1 2 317.408 4.154 20 0 DIADLO Cc1c2ccccc2oc1CNC(=O)Nc1c(C)cc[nH+]c1C ZINC000351923302 336178911 /nfs/dbraw/zinc/17/89/11/336178911.db2.gz STTRRQMDWLDVEG-UHFFFAOYSA-N 1 2 309.369 4.075 20 0 DIADLO Cc1cccc(C)c1C[N@@H+]1CCSC[C@@H]1c1nccs1 ZINC000351948096 336181967 /nfs/dbraw/zinc/18/19/67/336181967.db2.gz XXZGYHTUFPUVQU-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1cccc(C)c1C[N@H+]1CCSC[C@@H]1c1nccs1 ZINC000351948096 336181968 /nfs/dbraw/zinc/18/19/68/336181968.db2.gz XXZGYHTUFPUVQU-OAHLLOKOSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ncc(Cl)s2)s1 ZINC000351989539 336186368 /nfs/dbraw/zinc/18/63/68/336186368.db2.gz UQDYOHZXZFAUFR-QMMMGPOBSA-N 1 2 301.868 4.063 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ncc(Cl)s2)s1 ZINC000351989539 336186369 /nfs/dbraw/zinc/18/63/69/336186369.db2.gz UQDYOHZXZFAUFR-QMMMGPOBSA-N 1 2 301.868 4.063 20 0 DIADLO Oc1cc(F)cc(C[N@H+](Cc2ccco2)Cc2ccccc2)c1 ZINC000352010554 336188461 /nfs/dbraw/zinc/18/84/61/336188461.db2.gz GJGGWHARMZDQNA-UHFFFAOYSA-N 1 2 311.356 4.327 20 0 DIADLO Oc1cc(F)cc(C[N@@H+](Cc2ccco2)Cc2ccccc2)c1 ZINC000352010554 336188463 /nfs/dbraw/zinc/18/84/63/336188463.db2.gz GJGGWHARMZDQNA-UHFFFAOYSA-N 1 2 311.356 4.327 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000352028602 336190261 /nfs/dbraw/zinc/19/02/61/336190261.db2.gz QOPGRUKDWKIRPE-CQSZACIVSA-N 1 2 324.415 4.034 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000352028602 336190263 /nfs/dbraw/zinc/19/02/63/336190263.db2.gz QOPGRUKDWKIRPE-CQSZACIVSA-N 1 2 324.415 4.034 20 0 DIADLO CC(C)Sc1ccc(C(=O)N[C@@H](c2[nH]cc[nH+]2)C(C)C)cc1 ZINC000352142337 336196604 /nfs/dbraw/zinc/19/66/04/336196604.db2.gz UXAXBTBYIWLWGE-OAHLLOKOSA-N 1 2 317.458 4.037 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2CCCc3sccc32)c(C)[nH+]1 ZINC000333014230 336196697 /nfs/dbraw/zinc/19/66/97/336196697.db2.gz BTKXSHBMKOODID-AWEZNQCLSA-N 1 2 315.442 4.267 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCSC[C@@H]1c1nccs1 ZINC000352276210 336209551 /nfs/dbraw/zinc/20/95/51/336209551.db2.gz SMIDUUYUXKBGHK-CYBMUJFWSA-N 1 2 322.524 4.155 20 0 DIADLO CSc1ccccc1C[N@H+]1CCSC[C@@H]1c1nccs1 ZINC000352276210 336209552 /nfs/dbraw/zinc/20/95/52/336209552.db2.gz SMIDUUYUXKBGHK-CYBMUJFWSA-N 1 2 322.524 4.155 20 0 DIADLO Cc1[nH+]c2cc(CNC(=O)CCC(C)(C)C)ccc2n1C1CC1 ZINC000352413324 336216994 /nfs/dbraw/zinc/21/69/94/336216994.db2.gz NVDOAEWMQFBSPL-UHFFFAOYSA-N 1 2 313.445 4.122 20 0 DIADLO Fc1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)c(Cl)c1 ZINC000352437894 336218667 /nfs/dbraw/zinc/21/86/67/336218667.db2.gz DWGVFMMXZPNLLS-HOTGVXAUSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)c(Cl)c1 ZINC000352437894 336218668 /nfs/dbraw/zinc/21/86/68/336218668.db2.gz DWGVFMMXZPNLLS-HOTGVXAUSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(C[N@@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)c(Cl)c1 ZINC000352437895 336218689 /nfs/dbraw/zinc/21/86/89/336218689.db2.gz DWGVFMMXZPNLLS-HZPDHXFCSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)c(Cl)c1 ZINC000352437895 336218690 /nfs/dbraw/zinc/21/86/90/336218690.db2.gz DWGVFMMXZPNLLS-HZPDHXFCSA-N 1 2 309.812 4.013 20 0 DIADLO Cc1cc(C(=O)C[N@@H+]2CCC=C(c3ccco3)C2)c(C)n1C1CC1 ZINC000352544017 336223777 /nfs/dbraw/zinc/22/37/77/336223777.db2.gz MSXWZTCJLOAPAY-UHFFFAOYSA-N 1 2 324.424 4.005 20 0 DIADLO Cc1cc(C(=O)C[N@H+]2CCC=C(c3ccco3)C2)c(C)n1C1CC1 ZINC000352544017 336223778 /nfs/dbraw/zinc/22/37/78/336223778.db2.gz MSXWZTCJLOAPAY-UHFFFAOYSA-N 1 2 324.424 4.005 20 0 DIADLO CC(C)c1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000029951563 336229185 /nfs/dbraw/zinc/22/91/85/336229185.db2.gz CVBXWBKIHZMXLJ-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1ccc(F)cc1Br ZINC000042229576 336239289 /nfs/dbraw/zinc/23/92/89/336239289.db2.gz MOWMEIWKTNIHRN-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1ccc(F)cc1Br ZINC000042229576 336239290 /nfs/dbraw/zinc/23/92/90/336239290.db2.gz MOWMEIWKTNIHRN-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1ccc(F)cc1Br ZINC000042229540 336239360 /nfs/dbraw/zinc/23/93/60/336239360.db2.gz MMTXIPHHPPJIOZ-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1ccc(F)cc1Br ZINC000042229540 336239361 /nfs/dbraw/zinc/23/93/61/336239361.db2.gz MMTXIPHHPPJIOZ-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO CC[C@@H](C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccccc1 ZINC000103964781 336243232 /nfs/dbraw/zinc/24/32/32/336243232.db2.gz RNWGHQIBBFFRFI-QGZVFWFLSA-N 1 2 305.381 4.209 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1cccc2ccccc21 ZINC000103966957 336244170 /nfs/dbraw/zinc/24/41/70/336244170.db2.gz WNMVNIZNWJPXHR-UHFFFAOYSA-N 1 2 313.360 4.482 20 0 DIADLO C[C@H]([NH2+][C@H](c1nccn1C)c1ccc(Cl)cc1)c1ccoc1 ZINC000532455672 336248400 /nfs/dbraw/zinc/24/84/00/336248400.db2.gz DINAWNJUZFFVGS-LRDDRELGSA-N 1 2 315.804 4.107 20 0 DIADLO Cc1cc(C)cc(CCC(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC000532458603 336248428 /nfs/dbraw/zinc/24/84/28/336248428.db2.gz QSHHXXRKIULBCD-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cc(F)ccc1F ZINC000192751953 336260531 /nfs/dbraw/zinc/26/05/31/336260531.db2.gz VINSLQNCMNQOMY-GFCCVEGCSA-N 1 2 303.356 4.133 20 0 DIADLO Fc1ccc(Br)c(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)c1 ZINC000104674929 336263494 /nfs/dbraw/zinc/26/34/94/336263494.db2.gz BGXRHCQBMIKTEK-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1ccc(Br)c(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c1 ZINC000104674929 336263495 /nfs/dbraw/zinc/26/34/95/336263495.db2.gz BGXRHCQBMIKTEK-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO Brc1ccsc1C[N@@H+]1CCc2ccccc2C1 ZINC000043501800 336263532 /nfs/dbraw/zinc/26/35/32/336263532.db2.gz IEEOYTSZCJNYCA-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1ccsc1C[N@H+]1CCc2ccccc2C1 ZINC000043501800 336263533 /nfs/dbraw/zinc/26/35/33/336263533.db2.gz IEEOYTSZCJNYCA-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO C[N@H+](Cc1sccc1Br)Cc1ccccc1F ZINC000043501892 336263539 /nfs/dbraw/zinc/26/35/39/336263539.db2.gz HKYWICXZWOMEMG-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[N@@H+](Cc1sccc1Br)Cc1ccccc1F ZINC000043501892 336263540 /nfs/dbraw/zinc/26/35/40/336263540.db2.gz HKYWICXZWOMEMG-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO CC(C)N(Cc1[nH+]ccn1Cc1ccccc1)c1ccccc1 ZINC000532657678 336265150 /nfs/dbraw/zinc/26/51/50/336265150.db2.gz SHOCAGOPLHDVOL-UHFFFAOYSA-N 1 2 305.425 4.346 20 0 DIADLO Cc1[nH+]c2ccccc2n1CC(=O)N(c1cccc(C)c1)C(C)C ZINC000532737056 336268933 /nfs/dbraw/zinc/26/89/33/336268933.db2.gz AARXDZLZBQQCOT-UHFFFAOYSA-N 1 2 321.424 4.095 20 0 DIADLO CCc1noc([C@@H](C)[NH+]2CCC(=Cc3cccc(F)c3)CC2)n1 ZINC000532748378 336269527 /nfs/dbraw/zinc/26/95/27/336269527.db2.gz GCIOJABXTHHQCQ-CYBMUJFWSA-N 1 2 315.392 4.012 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CSCC[N@@H+]2CC2(F)CC2)c1 ZINC000526984830 336277465 /nfs/dbraw/zinc/27/74/65/336277465.db2.gz GGBXHIGJLUFNAW-ZDUSSCGKSA-N 1 2 319.367 4.297 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CSCC[N@H+]2CC2(F)CC2)c1 ZINC000526984830 336277466 /nfs/dbraw/zinc/27/74/66/336277466.db2.gz GGBXHIGJLUFNAW-ZDUSSCGKSA-N 1 2 319.367 4.297 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CSCC[N@@H+]2CC2(F)CC2)c1 ZINC000526984829 336277502 /nfs/dbraw/zinc/27/75/02/336277502.db2.gz GGBXHIGJLUFNAW-CYBMUJFWSA-N 1 2 319.367 4.297 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CSCC[N@H+]2CC2(F)CC2)c1 ZINC000526984829 336277503 /nfs/dbraw/zinc/27/75/03/336277503.db2.gz GGBXHIGJLUFNAW-CYBMUJFWSA-N 1 2 319.367 4.297 20 0 DIADLO CSCCCCC(=O)Nc1ccc2[nH]c(C(C)(C)C)[nH+]c2c1 ZINC000527000239 336278912 /nfs/dbraw/zinc/27/89/12/336278912.db2.gz PYQMPSWNSCCNPR-UHFFFAOYSA-N 1 2 319.474 4.332 20 0 DIADLO CSc1ccc(C[NH2+][C@H](c2nc(C3CC3)no2)C(C)C)s1 ZINC000352849626 336279035 /nfs/dbraw/zinc/27/90/35/336279035.db2.gz XKVAJUJPRUBGFG-ZDUSSCGKSA-N 1 2 323.487 4.217 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc(N3CCCC3)[nH+]c2)c(F)c1 ZINC000192987179 336286689 /nfs/dbraw/zinc/28/66/89/336286689.db2.gz CIHVBFZEHSYXCO-CYBMUJFWSA-N 1 2 315.392 4.003 20 0 DIADLO c1ccc2oc(C3CCN(c4[nH]c5ccccc5[nH+]4)CC3)nc2c1 ZINC000301079110 336288744 /nfs/dbraw/zinc/28/87/44/336288744.db2.gz NANRPWUNOGHLTR-UHFFFAOYSA-N 1 2 318.380 4.088 20 0 DIADLO COc1ccc([C@@H](C)Nc2cc(C)[nH+]c(C(C)C)n2)cc1F ZINC000301080122 336288919 /nfs/dbraw/zinc/28/89/19/336288919.db2.gz SSCAVWSZMFTMAD-GFCCVEGCSA-N 1 2 303.381 4.229 20 0 DIADLO Cc1cc(NCc2ccc(Cl)cc2)nc(-c2cccnc2)[nH+]1 ZINC000301113671 336290650 /nfs/dbraw/zinc/29/06/50/336290650.db2.gz WMBZCWMYDAIYRE-UHFFFAOYSA-N 1 2 310.788 4.113 20 0 DIADLO Cc1ccn2c(/C=C/c3ncc(Br)s3)c[nH+]c2c1 ZINC000193049988 336293059 /nfs/dbraw/zinc/29/30/59/336293059.db2.gz NVYBHMBPTXYGRB-NSCUHMNNSA-N 1 2 320.215 4.032 20 0 DIADLO CCc1cc(N[C@@H](C)c2ccccc2)nc(-c2ccncc2)[nH+]1 ZINC000301180436 336293594 /nfs/dbraw/zinc/29/35/94/336293594.db2.gz PEJRSHGHXWLJCJ-AWEZNQCLSA-N 1 2 304.397 4.274 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)Nc1cc(C)[nH+]cn1 ZINC000301221404 336295450 /nfs/dbraw/zinc/29/54/50/336295450.db2.gz AMNLRHXTBSMYON-LBPRGKRZSA-N 1 2 310.426 4.390 20 0 DIADLO c1cc(CNc2cc[nH+]c(C3CC3)n2)cc(OC2CCCCC2)n1 ZINC000301222832 336295572 /nfs/dbraw/zinc/29/55/72/336295572.db2.gz BNVYQYWHZIPUPO-UHFFFAOYSA-N 1 2 324.428 4.073 20 0 DIADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1ccc(OC(F)(F)F)cc1 ZINC000301232611 336295908 /nfs/dbraw/zinc/29/59/08/336295908.db2.gz ILBXVXUXLJORQV-JTQLQIEISA-N 1 2 323.318 4.426 20 0 DIADLO Cc1cccn2c(/C=C/c3ncc(Br)s3)c[nH+]c12 ZINC000193051577 336299391 /nfs/dbraw/zinc/29/93/91/336299391.db2.gz ROPZUCSKJBYCHA-SNAWJCMRSA-N 1 2 320.215 4.032 20 0 DIADLO Cc1nc(N2CCC(c3c[nH]c4ccccc43)CC2)c(C)c(C)[nH+]1 ZINC000301429133 336306102 /nfs/dbraw/zinc/30/61/02/336306102.db2.gz FKDIMQWEABYQNP-UHFFFAOYSA-N 1 2 320.440 4.267 20 0 DIADLO Cc1ccc([C@@H]2OCCC[C@H]2CNc2cc[nH+]c(C3CC3)n2)cc1 ZINC000301438116 336306765 /nfs/dbraw/zinc/30/67/65/336306765.db2.gz LFSPCLBMDHSLHY-HKUYNNGSSA-N 1 2 323.440 4.242 20 0 DIADLO Cc1ccc([C@@H]2OCCC[C@@H]2CNc2cc[nH+]c(C3CC3)n2)cc1 ZINC000301438118 336306818 /nfs/dbraw/zinc/30/68/18/336306818.db2.gz LFSPCLBMDHSLHY-MJGOQNOKSA-N 1 2 323.440 4.242 20 0 DIADLO COc1cccc(CNc2[nH+]c3ccccc3cc2C)c1OC ZINC000301543521 336313671 /nfs/dbraw/zinc/31/36/71/336313671.db2.gz DATIKIWLOIBFNN-UHFFFAOYSA-N 1 2 308.381 4.173 20 0 DIADLO Cc1ccc(CNc2cc[nH+]c(C3CC3)n2)c(OCC2CC2)c1 ZINC000301567781 336315469 /nfs/dbraw/zinc/31/54/69/336315469.db2.gz MZXROFSPRUXVBX-UHFFFAOYSA-N 1 2 309.413 4.063 20 0 DIADLO CC(C)(C)c1nc(NCc2coc(-c3ccccc3)n2)cc[nH+]1 ZINC000301568158 336315589 /nfs/dbraw/zinc/31/55/89/336315589.db2.gz KEZOVCKRDPJROO-UHFFFAOYSA-N 1 2 308.385 4.041 20 0 DIADLO C[C@@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1ccc(-n2cccn2)cc1 ZINC000301583760 336316332 /nfs/dbraw/zinc/31/63/32/336316332.db2.gz OGFIFWNELBZELZ-CQSZACIVSA-N 1 2 321.428 4.133 20 0 DIADLO Cc1cccc2[nH+]c(CNc3nc(-c4ccccc4)cs3)cn21 ZINC000301610098 336318249 /nfs/dbraw/zinc/31/82/49/336318249.db2.gz QHIJOAGOCVQXHK-UHFFFAOYSA-N 1 2 320.421 4.378 20 0 DIADLO C[C@H]1CCN(c2nc(-c3ccccc3)cs2)C[C@H]1n1cc[nH+]c1 ZINC000301624034 336319075 /nfs/dbraw/zinc/31/90/75/336319075.db2.gz FSTSETZBBINHQL-WMLDXEAASA-N 1 2 324.453 4.094 20 0 DIADLO Cc1cc(N[C@@H](CCO)c2cccs2)c2cccc(F)c2[nH+]1 ZINC000301645626 336320367 /nfs/dbraw/zinc/32/03/67/336320367.db2.gz CUINUEYUPSDYLU-AWEZNQCLSA-N 1 2 316.401 4.279 20 0 DIADLO Cc1nc2c(s1)[C@H](N(C)c1cc(C)[nH+]c(C(C)C)n1)CCC2 ZINC000301681340 336323045 /nfs/dbraw/zinc/32/30/45/336323045.db2.gz VFUIMLSWZSOQLX-CQSZACIVSA-N 1 2 316.474 4.187 20 0 DIADLO CCCO[C@@H]1CCCN(c2cc(C)[nH+]c3c(F)cccc23)CC1 ZINC000301684379 336323273 /nfs/dbraw/zinc/32/32/73/336323273.db2.gz TULZMMHMEXQLFA-OAHLLOKOSA-N 1 2 316.420 4.468 20 0 DIADLO Cc1cc(NCCC(=O)Nc2ccccc2)c2cccc(F)c2[nH+]1 ZINC000301692691 336323783 /nfs/dbraw/zinc/32/37/83/336323783.db2.gz XHARRLVOMQFXPI-UHFFFAOYSA-N 1 2 323.371 4.123 20 0 DIADLO Cc1cc(N2CC[C@@H](Nc3ccccc3)C2)c2cccc(F)c2[nH+]1 ZINC000301696471 336323957 /nfs/dbraw/zinc/32/39/57/336323957.db2.gz ZCMDXJYOJGLYDS-MRXNPFEDSA-N 1 2 321.399 4.373 20 0 DIADLO Cc1cc([C@](C)(O)CNc2[nH+]c3ccccc3cc2C)c(C)o1 ZINC000301739100 336326670 /nfs/dbraw/zinc/32/66/70/336326670.db2.gz WRDHXPPPJXSMFQ-LJQANCHMSA-N 1 2 310.397 4.073 20 0 DIADLO CC(C)(CO)[C@H](CNc1ccc2ccccc2[nH+]1)c1ccccc1 ZINC000301798049 336330552 /nfs/dbraw/zinc/33/05/52/336330552.db2.gz UZOISTZWDMRDDH-GOSISDBHSA-N 1 2 320.436 4.449 20 0 DIADLO CC(C)c1cc(NC[C@](C)(O)c2ccsc2)nc(C(C)C)[nH+]1 ZINC000301829643 336332823 /nfs/dbraw/zinc/33/28/23/336332823.db2.gz RFGDCVHHMNOXJP-KRWDZBQOSA-N 1 2 319.474 4.105 20 0 DIADLO CC(C)c1cc(N[C@H](C)C[C@@H](O)c2ccco2)nc(C(C)C)[nH+]1 ZINC000301846554 336333872 /nfs/dbraw/zinc/33/38/72/336333872.db2.gz BADGXVDYBFUJSD-UKRRQHHQSA-N 1 2 317.433 4.241 20 0 DIADLO Cc1ccccc1[C@@H](C)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC000301851672 336334156 /nfs/dbraw/zinc/33/41/56/336334156.db2.gz XEIBUUGJZFUCOQ-CYBMUJFWSA-N 1 2 309.417 4.063 20 0 DIADLO C[C@@H](Nc1nc(N)c2ccccc2[nH+]1)c1c(F)cccc1Cl ZINC000301883496 336336112 /nfs/dbraw/zinc/33/61/12/336336112.db2.gz JCVIFZSNEUIGOG-SECBINFHSA-N 1 2 316.767 4.178 20 0 DIADLO CC(C)c1cc(N2CCC[C@@H]2c2ccncc2)nc(C(C)C)[nH+]1 ZINC000301918368 336338024 /nfs/dbraw/zinc/33/80/24/336338024.db2.gz JVLRKSVGPITTRL-QGZVFWFLSA-N 1 2 310.445 4.460 20 0 DIADLO Cc1cccn2cc(CNc3nc(-c4ccccc4)cs3)[nH+]c12 ZINC000301993507 336341921 /nfs/dbraw/zinc/34/19/21/336341921.db2.gz OJAGIGYDEIJFGC-UHFFFAOYSA-N 1 2 320.421 4.378 20 0 DIADLO Cc1cc(N[C@@H]2CCc3c2cccc3O)c2cccc(F)c2[nH+]1 ZINC000301999968 336342262 /nfs/dbraw/zinc/34/22/62/336342262.db2.gz RKAFETSOXGKUOF-MRXNPFEDSA-N 1 2 308.356 4.487 20 0 DIADLO CC(C)c1nc(N[C@H]2CCCOc3c(F)cccc32)cc[nH+]1 ZINC000302014362 336343181 /nfs/dbraw/zinc/34/31/81/336343181.db2.gz BLFQWJYQKZLIEZ-AWEZNQCLSA-N 1 2 301.365 4.065 20 0 DIADLO Clc1ccc(Cl)c2nc(NCCCn3cc[nH+]c3)ccc12 ZINC000302040915 336344938 /nfs/dbraw/zinc/34/49/38/336344938.db2.gz LJWLTOGIUQFTIJ-UHFFFAOYSA-N 1 2 321.211 4.240 20 0 DIADLO COc1cccc([C@H]2CCCN2c2nc(C)[nH+]c3c2CCCC3)c1 ZINC000302059696 336346185 /nfs/dbraw/zinc/34/61/85/336346185.db2.gz SHEIXTBUEOAGMM-LJQANCHMSA-N 1 2 323.440 4.014 20 0 DIADLO CCc1cc(N2C[C@H](C)[C@H]3CCCC[C@@H]32)nc(-c2ccncc2)[nH+]1 ZINC000302066108 336346497 /nfs/dbraw/zinc/34/64/97/336346497.db2.gz AWEJQJAECIROMY-QGTPRVQTSA-N 1 2 322.456 4.116 20 0 DIADLO CCC(CC)[C@H]1C[C@H](Nc2cc(C(F)(F)F)cc[nH+]2)CCO1 ZINC000302081869 336347667 /nfs/dbraw/zinc/34/76/67/336347667.db2.gz YDCWSDMNGNODFR-ZIAGYGMSSA-N 1 2 316.367 4.496 20 0 DIADLO CCC(CC)c1cc(CNc2nc(C)[nH+]c3c2CCCC3)on1 ZINC000302105324 336348773 /nfs/dbraw/zinc/34/87/73/336348773.db2.gz RRLIPDMVBBNSMZ-UHFFFAOYSA-N 1 2 314.433 4.168 20 0 DIADLO C[C@](O)(CNc1ccc2ccccc2[nH+]1)c1ccccc1Cl ZINC000302150309 336350913 /nfs/dbraw/zinc/35/09/13/336350913.db2.gz BHGFNFJYXBTQSP-SFHVURJKSA-N 1 2 312.800 4.208 20 0 DIADLO CC(C)C[C@@H]1OCCC[C@@H]1Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000302507417 336360388 /nfs/dbraw/zinc/36/03/88/336360388.db2.gz WMSUDWACYDMLJO-STQMWFEESA-N 1 2 302.340 4.106 20 0 DIADLO COc1ccc(CNc2cc(C)[nH+]c3c(F)cccc23)cc1O ZINC000302673126 336364425 /nfs/dbraw/zinc/36/44/25/336364425.db2.gz SJXIBRIMEAUYMF-UHFFFAOYSA-N 1 2 312.344 4.009 20 0 DIADLO FC(F)(F)c1ccc(Oc2cccc(-n3cc[nH+]c3)c2)nc1 ZINC000302676559 336364511 /nfs/dbraw/zinc/36/45/11/336364511.db2.gz MYWIFANNJASKFJ-UHFFFAOYSA-N 1 2 305.259 4.078 20 0 DIADLO Cc1cc(N2CC[C@H](C(F)(F)F)C(C)(C)C2)nc(C(C)C)[nH+]1 ZINC000302712188 336366072 /nfs/dbraw/zinc/36/60/72/336366072.db2.gz LAHDWWFVPGOIPZ-LBPRGKRZSA-N 1 2 315.383 4.323 20 0 DIADLO Oc1cccc2c1CCC[C@@H]2Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000302727748 336366765 /nfs/dbraw/zinc/36/67/65/336366765.db2.gz QBOPFEZLQYEADE-ZDUSSCGKSA-N 1 2 308.303 4.296 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCC(c2ccncc2)CC1 ZINC000302778309 336368689 /nfs/dbraw/zinc/36/86/89/336368689.db2.gz GYELBSLSJIDPBE-UHFFFAOYSA-N 1 2 303.409 4.322 20 0 DIADLO CCO[C@@H](CNc1cc(C(F)(F)F)cc[nH+]1)c1ccccc1 ZINC000302837547 336371471 /nfs/dbraw/zinc/37/14/71/336371471.db2.gz XRODCWLJPNFXDC-AWEZNQCLSA-N 1 2 310.319 4.290 20 0 DIADLO CSc1ccc(CNc2ccc(N3CCCCC3)[nH+]c2)s1 ZINC000563919884 336384184 /nfs/dbraw/zinc/38/41/84/336384184.db2.gz LQGPSIPELOTEIJ-UHFFFAOYSA-N 1 2 319.499 4.467 20 0 DIADLO CC[C@@H](C)c1nnc([C@@H](C)[NH2+]Cc2ccc(C)cc2Cl)[nH]1 ZINC000514609240 336386175 /nfs/dbraw/zinc/38/61/75/336386175.db2.gz OKOZXQXXKHYIBY-VXGBXAGGSA-N 1 2 306.841 4.131 20 0 DIADLO c1sc(-c2ccccc2)nc1CNc1cc[nH+]c(C2CC2)n1 ZINC000110124692 336395820 /nfs/dbraw/zinc/39/58/20/336395820.db2.gz SJXUXTOKTPJMSI-UHFFFAOYSA-N 1 2 308.410 4.090 20 0 DIADLO CCCOc1cccc2c(N[C@@H](C)c3cn(C)nc3C)cc[nH+]c12 ZINC000194712246 336400480 /nfs/dbraw/zinc/40/04/80/336400480.db2.gz YUIKVZPBEFBOHR-ZDUSSCGKSA-N 1 2 324.428 4.239 20 0 DIADLO C[C@H]([NH2+]Cc1cc2cc(F)ccc2o1)c1c(F)cncc1F ZINC000353120078 336403392 /nfs/dbraw/zinc/40/33/92/336403392.db2.gz PDKDASRUGCREQC-VIFPVBQESA-N 1 2 306.287 4.096 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+][C@H](C)c2nc(-c3ccncc3)cs2)c1 ZINC000353617056 336429057 /nfs/dbraw/zinc/42/90/57/336429057.db2.gz CPSLPKDNHWSOND-UONOGXRCSA-N 1 2 324.453 4.320 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)Nc1cccc2ccsc21 ZINC000353671240 336433670 /nfs/dbraw/zinc/43/36/70/336433670.db2.gz AHJMSJCLFASYOE-UHFFFAOYSA-N 1 2 308.366 4.193 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cnc2ccsc2c1)c1c(F)cncc1F ZINC000353931743 336449509 /nfs/dbraw/zinc/44/95/09/336449509.db2.gz JRKCMCHJJRSLKE-VHSXEESVSA-N 1 2 319.380 4.381 20 0 DIADLO CCCCOC1CC[NH+](Cc2csc(C(C)(C)C)n2)CC1 ZINC000353998205 336453544 /nfs/dbraw/zinc/45/35/44/336453544.db2.gz RPSPNIPJELVQCP-UHFFFAOYSA-N 1 2 310.507 4.222 20 0 DIADLO CC(C)c1csc(C[NH2+][C@@H](c2ccc(F)cn2)C(C)C)n1 ZINC000354086699 336458475 /nfs/dbraw/zinc/45/84/75/336458475.db2.gz SPATUHLBSMRGHK-MRXNPFEDSA-N 1 2 307.438 4.288 20 0 DIADLO Cc1[nH]c(C(=O)N[C@@H](C)c2ccc(-c3ccc(F)cc3)cc2)c[nH+]1 ZINC000354971502 336489620 /nfs/dbraw/zinc/48/96/20/336489620.db2.gz ANNSNLHYFSRFIP-LBPRGKRZSA-N 1 2 323.371 4.015 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)CCc1ccc(Cl)s1)C(=O)OC(C)(C)C ZINC000470328731 339317387 /nfs/dbraw/zinc/31/73/87/339317387.db2.gz RJMLRZFSFXSTFH-WDEREUQCSA-N 1 2 317.882 4.042 20 0 DIADLO CCSCCNc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000355734574 336520421 /nfs/dbraw/zinc/52/04/21/336520421.db2.gz NBLQGWDZRWDMQQ-UHFFFAOYSA-N 1 2 301.459 4.051 20 0 DIADLO C[C@@H]1C[C@H](C)[C@@H](C)N(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000355935170 336528841 /nfs/dbraw/zinc/52/88/41/336528841.db2.gz QQLQZLMQBVXPFT-OWCLPIDISA-N 1 2 324.424 4.381 20 0 DIADLO Cc1ccc(Cc2noc([C@H](C)c3cccc(Cl)c3)n2)c[nH+]1 ZINC000356108446 336535997 /nfs/dbraw/zinc/53/59/97/336535997.db2.gz IUYYNGWPVHBHKZ-GFCCVEGCSA-N 1 2 313.788 4.169 20 0 DIADLO Cc1ccc(Cc2noc(-c3cccc(C(F)(F)F)c3)n2)c[nH+]1 ZINC000356118872 336536677 /nfs/dbraw/zinc/53/66/77/336536677.db2.gz YRVKMNRRQBRRLW-UHFFFAOYSA-N 1 2 319.286 4.050 20 0 DIADLO Cc1cc(Cl)cc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC000357322357 336580592 /nfs/dbraw/zinc/58/05/92/336580592.db2.gz PDOKSMDMWAHRDS-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H](C)c1ccsc1 ZINC000357926246 336603598 /nfs/dbraw/zinc/60/35/98/336603598.db2.gz PXUMGSOWVVUYJB-LBPRGKRZSA-N 1 2 311.410 4.189 20 0 DIADLO Cc1cc(NCc2[nH+]ccn2CC(F)(F)F)ccc1C1CC1 ZINC000358190661 336616045 /nfs/dbraw/zinc/61/60/45/336616045.db2.gz VERQQJKXTKIHKN-UHFFFAOYSA-N 1 2 309.335 4.243 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1cccc(F)c1)c1ccccn1)c1cncs1 ZINC000358260946 336620084 /nfs/dbraw/zinc/62/00/84/336620084.db2.gz CCSVVGVLJKUZFJ-PXAZEXFGSA-N 1 2 313.401 4.117 20 0 DIADLO COc1ccc(-c2ccncc2)cc1CNc1ccc(C)[nH+]c1C ZINC000358447851 336630386 /nfs/dbraw/zinc/63/03/86/336630386.db2.gz QHMXKMJQWNYJTA-UHFFFAOYSA-N 1 2 319.408 4.381 20 0 DIADLO Cc1nc(SCc2ccc(C)[nH+]c2C)n(CC(C)C)c1C ZINC000358610369 336636741 /nfs/dbraw/zinc/63/67/41/336636741.db2.gz LOYBCLWUWMCDNX-UHFFFAOYSA-N 1 2 303.475 4.460 20 0 DIADLO CCc1noc(-c2ccc(Oc3cc[nH+]cc3)c(Cl)c2)n1 ZINC000358651776 336638369 /nfs/dbraw/zinc/63/83/69/336638369.db2.gz NOMRIEYRYVNDQA-UHFFFAOYSA-N 1 2 301.733 4.140 20 0 DIADLO CC(C)Sc1ccccc1C(=O)Nc1cccc2[nH+]ccn21 ZINC000358774932 336642863 /nfs/dbraw/zinc/64/28/63/336642863.db2.gz COTKFGJNCGDITC-UHFFFAOYSA-N 1 2 311.410 4.087 20 0 DIADLO Cc1ccc(-c2nc(CCn3c(C)[nH+]c4ccccc43)no2)s1 ZINC000359132709 336659267 /nfs/dbraw/zinc/65/92/67/336659267.db2.gz RTDMSFFQKIHVCF-UHFFFAOYSA-N 1 2 324.409 4.007 20 0 DIADLO CCc1c[nH+]ccc1[C@H](C)[C@@H]1CCC(=O)Nc2ccc(F)cc21 ZINC000360616428 336716229 /nfs/dbraw/zinc/71/62/29/336716229.db2.gz UPRFHMJGWJCADT-LRDDRELGSA-N 1 2 312.388 4.403 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2nccs2)c2ccccc2)cc(C)c1O ZINC000367373137 336730163 /nfs/dbraw/zinc/73/01/63/336730163.db2.gz WHQWPIBPBNEIRS-QGZVFWFLSA-N 1 2 324.449 4.345 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+][C@H]1CCOc2c(F)ccc(F)c21 ZINC000361185830 336743185 /nfs/dbraw/zinc/74/31/85/336743185.db2.gz IUQWMQWSWJVROF-NHYWBVRUSA-N 1 2 319.351 4.148 20 0 DIADLO Cc1oc2ccccc2c1CC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000362226740 336788637 /nfs/dbraw/zinc/78/86/37/336788637.db2.gz LIDNCRIKBDUMHG-UHFFFAOYSA-N 1 2 308.381 4.243 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1csc(-c2ccccc2)n1 ZINC000362395023 336795492 /nfs/dbraw/zinc/79/54/92/336795492.db2.gz GTJCJQSEOYJYRZ-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO Cc1cnc(C[NH+]2CCC(c3c(F)cccc3F)CC2)s1 ZINC000362580497 336805030 /nfs/dbraw/zinc/80/50/30/336805030.db2.gz KXERRFMVAPDHPS-UHFFFAOYSA-N 1 2 308.397 4.109 20 0 DIADLO Fc1cccc(F)c1C1CCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000362682160 336809017 /nfs/dbraw/zinc/80/90/17/336809017.db2.gz WWLRXJQADCTFPX-UHFFFAOYSA-N 1 2 315.367 4.016 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc(Cl)s2)[nH+]1 ZINC000371246487 336898339 /nfs/dbraw/zinc/89/83/39/336898339.db2.gz DVDJIELSNQPHMU-UHFFFAOYSA-N 1 2 317.801 4.352 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H](C)c2cccc(F)c2)[nH+]1 ZINC000371247532 336898361 /nfs/dbraw/zinc/89/83/61/336898361.db2.gz NXKMGWASGXTRJH-CYBMUJFWSA-N 1 2 323.371 4.266 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cc(C)ccc2C)[nH+]1 ZINC000371247743 336898459 /nfs/dbraw/zinc/89/84/59/336898459.db2.gz QBGHMWCRSQECNZ-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H](C)c2cccc(F)c2)[nH+]1 ZINC000371247533 336898463 /nfs/dbraw/zinc/89/84/63/336898463.db2.gz NXKMGWASGXTRJH-ZDUSSCGKSA-N 1 2 323.371 4.266 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc3cc[nH]c3c2)[nH+]1 ZINC000371246981 336898485 /nfs/dbraw/zinc/89/84/85/336898485.db2.gz JBTYVZTWUUPAEE-UHFFFAOYSA-N 1 2 316.364 4.119 20 0 DIADLO Cn1ccc(C[NH2+][C@H](c2cccs2)c2ccc(Cl)cc2)n1 ZINC000371544643 336907588 /nfs/dbraw/zinc/90/75/88/336907588.db2.gz YAVOSVKWXFTOKG-INIZCTEOSA-N 1 2 317.845 4.014 20 0 DIADLO O=C(NCC1(C2CC2)CCC1)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000120711138 336919697 /nfs/dbraw/zinc/91/96/97/336919697.db2.gz YAAVXCCLEKMOGZ-UHFFFAOYSA-N 1 2 322.408 4.184 20 0 DIADLO Cc1nc(C[NH2+][C@@H](CCCc2ccccc2)c2ccccc2)no1 ZINC000121445069 336954536 /nfs/dbraw/zinc/95/45/36/336954536.db2.gz BWUYENWCDWYRBM-IBGZPJMESA-N 1 2 321.424 4.232 20 0 DIADLO Cc1nnc(C[NH2+][C@H](c2ccccc2)c2cc(C)ccc2C)s1 ZINC000391769232 336962504 /nfs/dbraw/zinc/96/25/04/336962504.db2.gz CCQCDTANAQLDCH-LJQANCHMSA-N 1 2 323.465 4.343 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1cccc(CO)c1 ZINC000121544606 336963174 /nfs/dbraw/zinc/96/31/74/336963174.db2.gz LPTSERZBNIJJAX-RDTXWAMCSA-N 1 2 324.449 4.076 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000121649758 336969862 /nfs/dbraw/zinc/96/98/62/336969862.db2.gz MAUSDPLOTJJBBW-KRWDZBQOSA-N 1 2 313.376 4.192 20 0 DIADLO Cc1ccc(F)c(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1 ZINC000373709701 336969865 /nfs/dbraw/zinc/96/98/65/336969865.db2.gz ZWRFPPSGSNWIIA-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO CCc1ccsc1C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000373707484 336969927 /nfs/dbraw/zinc/96/99/27/336969927.db2.gz RUWYCKGVUUZUKJ-UHFFFAOYSA-N 1 2 311.410 4.261 20 0 DIADLO Cc1ccoc1CNc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000122078559 336991938 /nfs/dbraw/zinc/99/19/38/336991938.db2.gz YSAAFBFALCGDPV-UHFFFAOYSA-N 1 2 307.397 4.400 20 0 DIADLO Cc1oncc1C[N@@H+]1CCCC[C@@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000375695825 337016897 /nfs/dbraw/zinc/01/68/97/337016897.db2.gz CHVYNVCLVHCWOW-GOSISDBHSA-N 1 2 322.412 4.100 20 0 DIADLO Cc1oncc1C[N@H+]1CCCC[C@@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000375695825 337016898 /nfs/dbraw/zinc/01/68/98/337016898.db2.gz CHVYNVCLVHCWOW-GOSISDBHSA-N 1 2 322.412 4.100 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cc[nH]c2C(C)C)[nH+]1 ZINC000376071210 337026367 /nfs/dbraw/zinc/02/63/67/337026367.db2.gz WKDRLXRLAJLFFA-UHFFFAOYSA-N 1 2 308.385 4.089 20 0 DIADLO Cc1cnc(C[NH+]2CCC(F)(c3cccc(Cl)c3)CC2)o1 ZINC000376383966 337032381 /nfs/dbraw/zinc/03/23/81/337032381.db2.gz HKZBUPFRNZEWAT-UHFFFAOYSA-N 1 2 308.784 4.097 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cccc(C(C)C)n2)[nH+]1 ZINC000376790492 337041185 /nfs/dbraw/zinc/04/11/85/337041185.db2.gz DKKLETIZMZBLJV-UHFFFAOYSA-N 1 2 320.396 4.156 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1cncc(F)c1 ZINC000123283507 337041982 /nfs/dbraw/zinc/04/19/82/337041982.db2.gz KEGHRQYLGRJIGH-WBMJQRKESA-N 1 2 313.401 4.117 20 0 DIADLO CSCC(C)(C)C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC000377119960 337047134 /nfs/dbraw/zinc/04/71/34/337047134.db2.gz LRPAMKQBJMXOQS-UHFFFAOYSA-N 1 2 317.458 4.021 20 0 DIADLO CCOc1cc(Cl)ccc1C(=O)Nc1c(C)cc[nH+]c1C ZINC000425595802 337047882 /nfs/dbraw/zinc/04/78/82/337047882.db2.gz JQSZMMICJSTKBA-UHFFFAOYSA-N 1 2 304.777 4.003 20 0 DIADLO c1csc([C@H]2CCC[N@H+]2Cc2nc3ccccc3s2)n1 ZINC000377200069 337048582 /nfs/dbraw/zinc/04/85/82/337048582.db2.gz ZUZBSBSFRFZUIJ-GFCCVEGCSA-N 1 2 301.440 4.090 20 0 DIADLO c1csc([C@H]2CCC[N@@H+]2Cc2nc3ccccc3s2)n1 ZINC000377200069 337048583 /nfs/dbraw/zinc/04/85/83/337048583.db2.gz ZUZBSBSFRFZUIJ-GFCCVEGCSA-N 1 2 301.440 4.090 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+]([C@H](C)c2nc3ccccc3o2)CCO1 ZINC000378483559 337073938 /nfs/dbraw/zinc/07/39/38/337073938.db2.gz ITALRBGTRWUBOZ-BEFAXECRSA-N 1 2 322.408 4.271 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+]([C@H](C)c2nc3ccccc3o2)CCO1 ZINC000378483559 337073939 /nfs/dbraw/zinc/07/39/39/337073939.db2.gz ITALRBGTRWUBOZ-BEFAXECRSA-N 1 2 322.408 4.271 20 0 DIADLO C[C@@H](Nc1cccc(-c2cn3c([nH+]2)CCCC3)c1)c1ccncc1 ZINC000378509578 337074695 /nfs/dbraw/zinc/07/46/95/337074695.db2.gz BBIVTRAHGNFMEW-OAHLLOKOSA-N 1 2 318.424 4.455 20 0 DIADLO c1c2ccccc2oc1[C@@H]([NH2+]Cc1cncnc1)c1ccccc1 ZINC000171131778 337086860 /nfs/dbraw/zinc/08/68/60/337086860.db2.gz DODSDMUDGACOOL-FQEVSTJZSA-N 1 2 315.376 4.102 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000171500010 337087511 /nfs/dbraw/zinc/08/75/11/337087511.db2.gz DYSXVCKNWRYWQT-UHFFFAOYSA-N 1 2 318.323 4.153 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000171500010 337087512 /nfs/dbraw/zinc/08/75/12/337087512.db2.gz DYSXVCKNWRYWQT-UHFFFAOYSA-N 1 2 318.323 4.153 20 0 DIADLO Cc1ccc(C(=O)N2CCC[C@H](C)CC2)cc1Oc1cc[nH+]cc1 ZINC000172067571 337089528 /nfs/dbraw/zinc/08/95/28/337089528.db2.gz DZDPMFKWSNFANI-HNNXBMFYSA-N 1 2 324.424 4.445 20 0 DIADLO O=C(Cc1ccccc1)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000171945718 337090528 /nfs/dbraw/zinc/09/05/28/337090528.db2.gz KVGLKBGUMPWXRY-UHFFFAOYSA-N 1 2 304.349 4.055 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2cc(C(C)(C)C)on2)cc1 ZINC000582575348 337107778 /nfs/dbraw/zinc/10/77/78/337107778.db2.gz WAGPXBCKZQTGOR-CYBMUJFWSA-N 1 2 302.418 4.174 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2cc(C(C)(C)C)on2)cc1 ZINC000582575348 337107779 /nfs/dbraw/zinc/10/77/79/337107779.db2.gz WAGPXBCKZQTGOR-CYBMUJFWSA-N 1 2 302.418 4.174 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1C[C@@H](C)C[C@H]1c1ccccc1F ZINC000173696867 337137327 /nfs/dbraw/zinc/13/73/27/337137327.db2.gz DGJBFYYJSCGFEU-YOEHRIQHSA-N 1 2 301.409 4.186 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1F ZINC000173696867 337137328 /nfs/dbraw/zinc/13/73/28/337137328.db2.gz DGJBFYYJSCGFEU-YOEHRIQHSA-N 1 2 301.409 4.186 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)c(F)c1)c1ncc(-c2ccccc2)o1 ZINC000174002828 337140399 /nfs/dbraw/zinc/14/03/99/337140399.db2.gz LEEQLZYTFOTOJG-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO Cc1ccccc1C[N@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000174959686 337143762 /nfs/dbraw/zinc/14/37/62/337143762.db2.gz VRDYFHLGINGVRZ-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1ccccc1C[N@@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000174959686 337143763 /nfs/dbraw/zinc/14/37/63/337143763.db2.gz VRDYFHLGINGVRZ-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO C[C@@H](c1ccc([S@](C)=O)cc1)[N@H+](C)Cc1ccccc1Cl ZINC000175390981 337145663 /nfs/dbraw/zinc/14/56/63/337145663.db2.gz FGDOKJDHVYWCAK-ZSEKCTLFSA-N 1 2 321.873 4.270 20 0 DIADLO C[C@@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)Cc1ccccc1Cl ZINC000175390981 337145664 /nfs/dbraw/zinc/14/56/64/337145664.db2.gz FGDOKJDHVYWCAK-ZSEKCTLFSA-N 1 2 321.873 4.270 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cnc(Cl)s1 ZINC000175425858 337147162 /nfs/dbraw/zinc/14/71/62/337147162.db2.gz UAQFZSWUFTWAOK-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1cnc(Cl)s1 ZINC000175425858 337147163 /nfs/dbraw/zinc/14/71/63/337147163.db2.gz UAQFZSWUFTWAOK-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO C[N@H+](Cc1nc2c(s1)CCCC2)Cc1ccc2ccccc2n1 ZINC000175543753 337147985 /nfs/dbraw/zinc/14/79/85/337147985.db2.gz PIPPLGAZJQMWEC-UHFFFAOYSA-N 1 2 323.465 4.202 20 0 DIADLO C[N@@H+](Cc1nc2c(s1)CCCC2)Cc1ccc2ccccc2n1 ZINC000175543753 337147986 /nfs/dbraw/zinc/14/79/86/337147986.db2.gz PIPPLGAZJQMWEC-UHFFFAOYSA-N 1 2 323.465 4.202 20 0 DIADLO CCCC[C@@H](CCC)NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000175997085 337150039 /nfs/dbraw/zinc/15/00/39/337150039.db2.gz QLVMZQDLWUISEX-CABCVRRESA-N 1 2 306.454 4.005 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCCC[C@@H]2c2ncc[nH]2)cc1 ZINC000177040904 337152958 /nfs/dbraw/zinc/15/29/58/337152958.db2.gz YCMBFUWJBZVWNW-CQSZACIVSA-N 1 2 309.335 4.156 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCCC[C@@H]2c2ncc[nH]2)cc1 ZINC000177040904 337152959 /nfs/dbraw/zinc/15/29/59/337152959.db2.gz YCMBFUWJBZVWNW-CQSZACIVSA-N 1 2 309.335 4.156 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000176986903 337154048 /nfs/dbraw/zinc/15/40/48/337154048.db2.gz WGPSZCINYYLXNW-INIZCTEOSA-N 1 2 305.468 4.044 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000176986903 337154049 /nfs/dbraw/zinc/15/40/49/337154049.db2.gz WGPSZCINYYLXNW-INIZCTEOSA-N 1 2 305.468 4.044 20 0 DIADLO CC[C@@H](OC1CCCCC1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000177811206 337157588 /nfs/dbraw/zinc/15/75/88/337157588.db2.gz KLXOZTLFDIFFIP-MRXNPFEDSA-N 1 2 304.434 4.073 20 0 DIADLO CC[C@H]([NH2+]Cc1cn2c(cccc2C)n1)c1cc(F)ccc1F ZINC000178057718 337160255 /nfs/dbraw/zinc/16/02/55/337160255.db2.gz WXGPRHUOVJHXRC-KRWDZBQOSA-N 1 2 315.367 4.162 20 0 DIADLO CC[C@@H]([NH2+]Cc1cn2c(cccc2C)n1)c1cc(F)ccc1F ZINC000178057733 337160272 /nfs/dbraw/zinc/16/02/72/337160272.db2.gz WXGPRHUOVJHXRC-QGZVFWFLSA-N 1 2 315.367 4.162 20 0 DIADLO Cc1cccc(C2=CCN(C(=O)Nc3ccc(C)[nH+]c3C)CC2)c1 ZINC000179403776 337167749 /nfs/dbraw/zinc/16/77/49/337167749.db2.gz VDOJUSYHFAUHHH-UHFFFAOYSA-N 1 2 321.424 4.328 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2ccc(F)cc21)c1nc(C(C)(C)C)no1 ZINC000179754914 337171708 /nfs/dbraw/zinc/17/17/08/337171708.db2.gz GFGZYDDBDDQDED-ABAIWWIYSA-N 1 2 317.408 4.234 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2csnn2)c2cccs2)cc1 ZINC000179842940 337172180 /nfs/dbraw/zinc/17/21/80/337172180.db2.gz CZFNSEHJXDKVAR-CQSZACIVSA-N 1 2 321.858 4.132 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)n1 ZINC000180919021 337178636 /nfs/dbraw/zinc/17/86/36/337178636.db2.gz WLMVYOPHQQIMEX-KBPBESRZSA-N 1 2 322.412 4.106 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)n1 ZINC000180919042 337178746 /nfs/dbraw/zinc/17/87/46/337178746.db2.gz WLMVYOPHQQIMEX-ZIAGYGMSSA-N 1 2 322.412 4.106 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1nnc(C2CCC2)n1C ZINC000181025243 337179342 /nfs/dbraw/zinc/17/93/42/337179342.db2.gz ONBSGYDBUBCHTO-ZDUSSCGKSA-N 1 2 324.428 4.022 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nnc(C2CCC2)n1C ZINC000181025243 337179343 /nfs/dbraw/zinc/17/93/43/337179343.db2.gz ONBSGYDBUBCHTO-ZDUSSCGKSA-N 1 2 324.428 4.022 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cccc(O)c1)c1ncc(-c2ccccc2)o1 ZINC000181579823 337183161 /nfs/dbraw/zinc/18/31/61/337183161.db2.gz QDTOGCRLBKHUDY-UONOGXRCSA-N 1 2 308.381 4.459 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[NH2+][C@@H](C)c3cccnc3)o2)cc1C ZINC000181652669 337183543 /nfs/dbraw/zinc/18/35/43/337183543.db2.gz LZDPNPYARVVFKG-LSDHHAIUSA-N 1 2 322.412 4.160 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ncc(Cl)cc2Cl)n1 ZINC000182473376 337186353 /nfs/dbraw/zinc/18/63/53/337186353.db2.gz XCMKHUVDCJADET-MRXNPFEDSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2ncc(Cl)cc2Cl)n1 ZINC000182473376 337186354 /nfs/dbraw/zinc/18/63/54/337186354.db2.gz XCMKHUVDCJADET-MRXNPFEDSA-N 1 2 322.239 4.429 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CCc3ccc(C(C)(C)C)cc3C2)o1 ZINC000182249430 337187634 /nfs/dbraw/zinc/18/76/34/337187634.db2.gz UYYQLYDFRARTEF-UHFFFAOYSA-N 1 2 313.445 4.049 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CCc3ccc(C(C)(C)C)cc3C2)o1 ZINC000182249430 337187635 /nfs/dbraw/zinc/18/76/35/337187635.db2.gz UYYQLYDFRARTEF-UHFFFAOYSA-N 1 2 313.445 4.049 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nc(-c3ccc(F)cc3)no2)cc1 ZINC000182341713 337188057 /nfs/dbraw/zinc/18/80/57/337188057.db2.gz ZSEUQMVFTPRKDG-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2cccc(Cl)c2)n1)c1cccnc1 ZINC000182892030 337190579 /nfs/dbraw/zinc/19/05/79/337190579.db2.gz GWDCWEUTNKNQRN-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO Cn1c2ccccc2nc1C[N@H+](C)Cc1ccc(C(F)F)cc1 ZINC000183970993 337194198 /nfs/dbraw/zinc/19/41/98/337194198.db2.gz JZANTXCCBMOQIS-UHFFFAOYSA-N 1 2 315.367 4.143 20 0 DIADLO Cn1c2ccccc2nc1C[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000183970993 337194199 /nfs/dbraw/zinc/19/41/99/337194199.db2.gz JZANTXCCBMOQIS-UHFFFAOYSA-N 1 2 315.367 4.143 20 0 DIADLO Cc1cncc([C@@H](C)[NH2+][C@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000184426050 337197128 /nfs/dbraw/zinc/19/71/28/337197128.db2.gz GLSAAWROSIUMHL-FOIQADDNSA-N 1 2 321.399 4.364 20 0 DIADLO C[C@@H](c1cnccn1)[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC000184501255 337199262 /nfs/dbraw/zinc/19/92/62/337199262.db2.gz UTTXKVWGWFESGI-HNNXBMFYSA-N 1 2 301.393 4.220 20 0 DIADLO CO[C@H](C)c1nc(CSCc2ccc(C)[nH+]c2C)cs1 ZINC000184828100 337200383 /nfs/dbraw/zinc/20/03/83/337200383.db2.gz MEBCZVZPSKUJGU-GFCCVEGCSA-N 1 2 308.472 4.296 20 0 DIADLO Cc1ccc(CS[C@@H](C)c2cn(-c3ccccc3)nn2)c(C)[nH+]1 ZINC000184830323 337200389 /nfs/dbraw/zinc/20/03/89/337200389.db2.gz GDVYOYVEFVPSFM-HNNXBMFYSA-N 1 2 324.453 4.274 20 0 DIADLO Cc1ccc(CSCc2cc(F)cc3c2OCOC3)c(C)[nH+]1 ZINC000184822382 337200392 /nfs/dbraw/zinc/20/03/92/337200392.db2.gz SZNHFENILURYHN-UHFFFAOYSA-N 1 2 319.401 4.137 20 0 DIADLO Cc1ccc(CS[C@H](C)c2cn(-c3ccccc3)nn2)c(C)[nH+]1 ZINC000184830344 337200440 /nfs/dbraw/zinc/20/04/40/337200440.db2.gz GDVYOYVEFVPSFM-OAHLLOKOSA-N 1 2 324.453 4.274 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(Cl)s1)c1ncc(-c2ccccc2)o1 ZINC000184888972 337200618 /nfs/dbraw/zinc/20/06/18/337200618.db2.gz USGIYKHKTYQBDW-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO CCOc1cccc(CNc2c[nH+]ccc2C)c1OC(F)F ZINC000184894109 337200624 /nfs/dbraw/zinc/20/06/24/337200624.db2.gz PQWXUZPDMAPDMN-UHFFFAOYSA-N 1 2 308.328 4.002 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2nc3ccccc3n2C2CC2)o1 ZINC000184784905 337201194 /nfs/dbraw/zinc/20/11/94/337201194.db2.gz LDFHMNQQHVVQJV-XJKSGUPXSA-N 1 2 321.424 4.377 20 0 DIADLO CC(C)c1nc(N(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)cc[nH+]1 ZINC000582867337 337209201 /nfs/dbraw/zinc/20/92/01/337209201.db2.gz KKTMUXMGIQCBTC-TXEJJXNPSA-N 1 2 301.356 4.157 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cc(O)cc(F)c1 ZINC000186165099 337254019 /nfs/dbraw/zinc/25/40/19/337254019.db2.gz KRXBRVGANMLVTF-LLVKDONJSA-N 1 2 316.401 4.334 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]C1(c2cccc(F)c2)CC1 ZINC000514144351 337257191 /nfs/dbraw/zinc/25/71/91/337257191.db2.gz DXNFCMZQSOKIAN-UHFFFAOYSA-N 1 2 305.780 4.267 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2nc(-c3ccccc3Cl)cs2)CCO1 ZINC000186651319 337258178 /nfs/dbraw/zinc/25/81/78/337258178.db2.gz ZCCJCXUPZXKFAN-GFCCVEGCSA-N 1 2 322.861 4.074 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2nc(-c3ccccc3Cl)cs2)CCO1 ZINC000186651319 337258179 /nfs/dbraw/zinc/25/81/79/337258179.db2.gz ZCCJCXUPZXKFAN-GFCCVEGCSA-N 1 2 322.861 4.074 20 0 DIADLO Clc1ccccc1-c1csc(C[NH+]2CCSCC2)n1 ZINC000186675106 337258401 /nfs/dbraw/zinc/25/84/01/337258401.db2.gz POWVOHPVVDLXKZ-UHFFFAOYSA-N 1 2 310.875 4.012 20 0 DIADLO Cc1cccc(C[N@@H+]2CCSC[C@H]2c2nccs2)c1C ZINC000186666751 337258432 /nfs/dbraw/zinc/25/84/32/337258432.db2.gz MGAUVFWIIIPJSS-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1cccc(C[N@H+]2CCSC[C@H]2c2nccs2)c1C ZINC000186666751 337258433 /nfs/dbraw/zinc/25/84/33/337258433.db2.gz MGAUVFWIIIPJSS-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO CC(C)CSCCC[N@@H+]1CCSC[C@@H]1c1nccs1 ZINC000187022687 337261259 /nfs/dbraw/zinc/26/12/59/337261259.db2.gz JESQPGLMDDTEAW-CYBMUJFWSA-N 1 2 316.561 4.012 20 0 DIADLO CC(C)CSCCC[N@H+]1CCSC[C@@H]1c1nccs1 ZINC000187022687 337261260 /nfs/dbraw/zinc/26/12/60/337261260.db2.gz JESQPGLMDDTEAW-CYBMUJFWSA-N 1 2 316.561 4.012 20 0 DIADLO Cc1ccc(C[S@@](=O)Cc2cccc3ccccc32)c(C)[nH+]1 ZINC000187070203 337261702 /nfs/dbraw/zinc/26/17/02/337261702.db2.gz JAMSBKCYJWLKAH-JOCHJYFZSA-N 1 2 309.434 4.301 20 0 DIADLO Cc1ccc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)c(C)n1 ZINC000187200653 337263616 /nfs/dbraw/zinc/26/36/16/337263616.db2.gz CDKGTEHRKLSGIG-NRFANRHFSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1ccc(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)c(C)n1 ZINC000187200653 337263617 /nfs/dbraw/zinc/26/36/17/337263617.db2.gz CDKGTEHRKLSGIG-NRFANRHFSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2ncc(-c3ccccc3)o2)c(C)n1 ZINC000187524369 337266628 /nfs/dbraw/zinc/26/66/28/337266628.db2.gz LRKYNAYWAWERQX-OAHLLOKOSA-N 1 2 307.397 4.204 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2ncc(-c3ccccc3)o2)c(C)n1 ZINC000187524351 337266677 /nfs/dbraw/zinc/26/66/77/337266677.db2.gz LRKYNAYWAWERQX-HNNXBMFYSA-N 1 2 307.397 4.204 20 0 DIADLO Fc1cc2[nH+]cn(Cc3ccc(Br)cc3)c2cc1F ZINC000024380219 337269205 /nfs/dbraw/zinc/26/92/05/337269205.db2.gz JIWPCGPAONFFHX-UHFFFAOYSA-N 1 2 323.140 4.125 20 0 DIADLO Cc1ncccc1C[N@H+]1C[C@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000188752007 337275439 /nfs/dbraw/zinc/27/54/39/337275439.db2.gz UVFBVRMQGGLOEY-SCLBCKFNSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ncccc1C[N@@H+]1C[C@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000188752007 337275440 /nfs/dbraw/zinc/27/54/40/337275440.db2.gz UVFBVRMQGGLOEY-SCLBCKFNSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2cnc(CC(C)C)s2)cs1 ZINC000189932907 337283977 /nfs/dbraw/zinc/28/39/77/337283977.db2.gz ROLUDKNCCHQOCA-OAHLLOKOSA-N 1 2 321.515 4.444 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2cnc(CC(C)C)s2)cs1 ZINC000189932907 337283978 /nfs/dbraw/zinc/28/39/78/337283978.db2.gz ROLUDKNCCHQOCA-OAHLLOKOSA-N 1 2 321.515 4.444 20 0 DIADLO CSc1cccc(NCc2ccc(N(C)C(C)C)[nH+]c2)c1 ZINC000190812753 337291100 /nfs/dbraw/zinc/29/11/00/337291100.db2.gz ISDUZVBDNQPAKG-UHFFFAOYSA-N 1 2 301.459 4.260 20 0 DIADLO C[C@H](c1ccco1)[N@H+](Cc1nccn1-c1ccccc1)C1CC1 ZINC000191273205 337295362 /nfs/dbraw/zinc/29/53/62/337295362.db2.gz GMZSSEHLQVAAFD-OAHLLOKOSA-N 1 2 307.397 4.191 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](Cc1nccn1-c1ccccc1)C1CC1 ZINC000191273205 337295363 /nfs/dbraw/zinc/29/53/63/337295363.db2.gz GMZSSEHLQVAAFD-OAHLLOKOSA-N 1 2 307.397 4.191 20 0 DIADLO CCN(C)c1ccc(CNc2ccc(C)c(-c3ncco3)c2)c[nH+]1 ZINC000191442596 337297070 /nfs/dbraw/zinc/29/70/70/337297070.db2.gz DJINZPHSRSTYOL-UHFFFAOYSA-N 1 2 322.412 4.113 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccc(Br)o2)C1 ZINC000191493414 337297312 /nfs/dbraw/zinc/29/73/12/337297312.db2.gz IYEPPJUNKOFUME-RISCZKNCSA-N 1 2 321.218 4.020 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc(Br)o2)C1 ZINC000191493414 337297313 /nfs/dbraw/zinc/29/73/13/337297313.db2.gz IYEPPJUNKOFUME-RISCZKNCSA-N 1 2 321.218 4.020 20 0 DIADLO Cc1noc(C)c1C[N@H+](CCC(F)(F)F)Cc1ccccc1 ZINC000191781024 337300154 /nfs/dbraw/zinc/30/01/54/337300154.db2.gz ZUBZPDNJBTWIAY-UHFFFAOYSA-N 1 2 312.335 4.246 20 0 DIADLO Cc1noc(C)c1C[N@@H+](CCC(F)(F)F)Cc1ccccc1 ZINC000191781024 337300155 /nfs/dbraw/zinc/30/01/55/337300155.db2.gz ZUBZPDNJBTWIAY-UHFFFAOYSA-N 1 2 312.335 4.246 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)c1C(C)C ZINC000191956562 337301406 /nfs/dbraw/zinc/30/14/06/337301406.db2.gz RXLBWOVHNWLBBD-UNEWFSDZSA-N 1 2 324.424 4.173 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccn1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000192151873 337303315 /nfs/dbraw/zinc/30/33/15/337303315.db2.gz MASFZEUBZULSMH-CQSZACIVSA-N 1 2 323.371 4.259 20 0 DIADLO Oc1cccc2c1CCC[C@H]2[NH2+]Cc1ncc(-c2ccccc2)o1 ZINC000192346542 337304752 /nfs/dbraw/zinc/30/47/52/337304752.db2.gz CTMVNYXXDDWRNV-QGZVFWFLSA-N 1 2 320.392 4.214 20 0 DIADLO Clc1ccsc1C[NH2+]Cc1nnc(-c2ccccc2)s1 ZINC000193150145 337309941 /nfs/dbraw/zinc/30/99/41/337309941.db2.gz YLVXRDIZBOEODN-UHFFFAOYSA-N 1 2 321.858 4.210 20 0 DIADLO CC(C)=CCC[C@@H](C)CC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000584412376 337321462 /nfs/dbraw/zinc/32/14/62/337321462.db2.gz KRAMIBHEKBDBOY-HZPDHXFCSA-N 1 2 303.450 4.236 20 0 DIADLO Cc1csc(C[NH2+][C@@H](C)c2sccc2Br)n1 ZINC000038091143 337372449 /nfs/dbraw/zinc/37/24/49/337372449.db2.gz OFLGOSUQNQLSQF-QMMMGPOBSA-N 1 2 317.277 4.126 20 0 DIADLO Cc1ccc2oc(-c3noc(Cc4ccc[nH+]c4C)n3)cc2c1 ZINC000583898388 337384685 /nfs/dbraw/zinc/38/46/85/337384685.db2.gz QWHXZIYBPYQPHN-UHFFFAOYSA-N 1 2 305.337 4.085 20 0 DIADLO C[C@@H]([NH2+]Cc1noc(-c2ccsc2)n1)c1cccc(Cl)c1 ZINC000112537289 337390545 /nfs/dbraw/zinc/39/05/45/337390545.db2.gz DXMBQRBUTXPAFT-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO C[C@H](CC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1)C1CCCCC1 ZINC000120120578 337395533 /nfs/dbraw/zinc/39/55/33/337395533.db2.gz AQJUQSGRTGEYNN-ZBFHGGJFSA-N 1 2 303.450 4.070 20 0 DIADLO CCCC(=O)Nc1cccc(NCc2[nH+]ccn2C(C)C)c1C ZINC000124215111 337404162 /nfs/dbraw/zinc/40/41/62/337404162.db2.gz HXHNCXVCSLZMPB-UHFFFAOYSA-N 1 2 314.433 4.123 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@@H](c2nccn2C)c2cccc(F)c2)c1 ZINC000128545091 337425637 /nfs/dbraw/zinc/42/56/37/337425637.db2.gz XRCWDBMWVOCPEY-HNAYVOBHSA-N 1 2 323.415 4.308 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@@H](C)c1cccc(O)c1)c1ccco1 ZINC000194932714 337464332 /nfs/dbraw/zinc/46/43/32/337464332.db2.gz CAELOLVGVIMSEJ-XOBRGWDASA-N 1 2 323.392 4.434 20 0 DIADLO C[C@H]([NH2+][C@H](c1cccc(F)c1)c1ccccn1)c1cccc(O)c1 ZINC000194941218 337464363 /nfs/dbraw/zinc/46/43/63/337464363.db2.gz XVEOGKUDGNYRAO-VBKZILBWSA-N 1 2 322.383 4.367 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)c1cc(Cl)c[nH]1 ZINC000065173882 337471475 /nfs/dbraw/zinc/47/14/75/337471475.db2.gz RYUMBEOBMQAKTR-UHFFFAOYSA-N 1 2 313.744 4.108 20 0 DIADLO Cc1[nH+]cccc1Cc1noc(-c2cccc(OCC(C)C)c2)n1 ZINC000420512910 337506270 /nfs/dbraw/zinc/50/62/70/337506270.db2.gz SWYRWMUTILNBRH-UHFFFAOYSA-N 1 2 323.396 4.066 20 0 DIADLO Cc1cc(CNC(=O)N2CCC[C@@H]2c2ccccc2C)cc(C)[nH+]1 ZINC000420851884 337511575 /nfs/dbraw/zinc/51/15/75/337511575.db2.gz RUJQEBJTIOSFPM-LJQANCHMSA-N 1 2 323.440 4.054 20 0 DIADLO CSc1ccc(C)c(NC(=O)NCc2cc(C)[nH+]c(C)c2)c1 ZINC000421084317 337522383 /nfs/dbraw/zinc/52/23/83/337522383.db2.gz GEJWMGSZWXXOMM-UHFFFAOYSA-N 1 2 315.442 4.050 20 0 DIADLO Cc1cccc2[nH+]c(CNc3ccc4c(c3)C(=O)CCCC4)cn21 ZINC000421194976 337524446 /nfs/dbraw/zinc/52/44/46/337524446.db2.gz MFGJCCSCSVQERJ-UHFFFAOYSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H]2CCc3ccc(C(C)C)cc32)nn1C ZINC000421346099 337527786 /nfs/dbraw/zinc/52/77/86/337527786.db2.gz SFUQRNXLNXGJIS-INIZCTEOSA-N 1 2 317.864 4.282 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+]Cc2cccc(C3CC3)c2)s1 ZINC000421352741 337528113 /nfs/dbraw/zinc/52/81/13/337528113.db2.gz DJHOGSSJYIRZME-UHFFFAOYSA-N 1 2 301.459 4.003 20 0 DIADLO CC[C@H](C)[C@@H](C(=O)NCc1cc(C)[nH+]c(C)c1)c1ccccc1 ZINC000421560443 337541328 /nfs/dbraw/zinc/54/13/28/337541328.db2.gz QPNXGNASHGTMJS-IFXJQAMLSA-N 1 2 310.441 4.145 20 0 DIADLO CC[C@@H](CC(=O)NCc1cc(C)[nH+]c(C)c1)c1ccc(C)cc1 ZINC000421573743 337542178 /nfs/dbraw/zinc/54/21/78/337542178.db2.gz BWZWNGIKDVGMJL-SFHVURJKSA-N 1 2 310.441 4.207 20 0 DIADLO C(=C/c1ccc(-n2cc[nH+]c2)cc1)\c1nc(C2CCCC2)no1 ZINC000074123006 337551387 /nfs/dbraw/zinc/55/13/87/337551387.db2.gz ADRGZYLMUYXSLU-JXMROGBWSA-N 1 2 306.369 4.083 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)C(C)(C)C ZINC000261434124 337604587 /nfs/dbraw/zinc/60/45/87/337604587.db2.gz JUVQEYFYPNONKT-GFCCVEGCSA-N 1 2 303.381 4.022 20 0 DIADLO CCC(CC)c1cc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)on1 ZINC000162606596 337645512 /nfs/dbraw/zinc/64/55/12/337645512.db2.gz HJIWRFUMSDFAEQ-UHFFFAOYSA-N 1 2 324.384 4.221 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@H](C)c1ccncc1Cl)c1ccco1 ZINC000421823912 337646175 /nfs/dbraw/zinc/64/61/75/337646175.db2.gz FYVZWLPHHRNMAV-CJNGLKHVSA-N 1 2 322.836 4.393 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccncc1Cl ZINC000421846416 337654464 /nfs/dbraw/zinc/65/44/64/337654464.db2.gz SIUVCJKOFLAKNZ-LKFCYVNXSA-N 1 2 309.196 4.173 20 0 DIADLO Cc1cc(CNC(=O)N(CCC(C)C)C2CCCC2)cc(C)[nH+]1 ZINC000422199961 337675301 /nfs/dbraw/zinc/67/53/01/337675301.db2.gz FAWFXKGUMQETPR-UHFFFAOYSA-N 1 2 317.477 4.199 20 0 DIADLO Cc1c[nH+]cc(CCc2nc(-c3ccc(Cl)cc3F)no2)c1 ZINC000580440956 337675932 /nfs/dbraw/zinc/67/59/32/337675932.db2.gz XJSOFEKVYBSVOH-UHFFFAOYSA-N 1 2 317.751 4.018 20 0 DIADLO Cc1cccc2c1ccn(Cc1ccc(C(C)C)[nH+]c1C)c2=O ZINC000580444412 337676260 /nfs/dbraw/zinc/67/62/60/337676260.db2.gz HRPOVUMAAXJAKN-UHFFFAOYSA-N 1 2 306.409 4.185 20 0 DIADLO COc1ccc(Cl)cc1[C@@H](C)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423218974 337705146 /nfs/dbraw/zinc/70/51/46/337705146.db2.gz STAMMMAATYAFGR-LLVKDONJSA-N 1 2 302.805 4.490 20 0 DIADLO CC(C)c1cccc([C@@H](C)[NH2+]Cc2ncn(-c3ccccc3)n2)c1 ZINC000527904428 337769904 /nfs/dbraw/zinc/76/99/04/337769904.db2.gz XDNYZAOXNPCSKT-MRXNPFEDSA-N 1 2 320.440 4.242 20 0 DIADLO CC(C)c1cccc([C@H](C)[NH2+]Cc2ncn(-c3ccccc3)n2)c1 ZINC000527904425 337769976 /nfs/dbraw/zinc/76/99/76/337769976.db2.gz XDNYZAOXNPCSKT-INIZCTEOSA-N 1 2 320.440 4.242 20 0 DIADLO COc1ccc(Cl)cc1[C@@H](C)[NH2+][C@@H](C)c1ncccc1F ZINC000528036553 337782651 /nfs/dbraw/zinc/78/26/51/337782651.db2.gz SKGSAIZMFWYKIO-MNOVXSKESA-N 1 2 308.784 4.295 20 0 DIADLO C[C@@]12CCN(c3[nH+]ccc4ccccc43)C[C@@H]1C2(Cl)Cl ZINC000528011700 337783531 /nfs/dbraw/zinc/78/35/31/337783531.db2.gz WMOFUYYDMMOCCU-DZGCQCFKSA-N 1 2 307.224 4.255 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)on1 ZINC000044299409 337809026 /nfs/dbraw/zinc/80/90/26/337809026.db2.gz XNHZKVKOHNLTBP-QMMMGPOBSA-N 1 2 303.164 4.280 20 0 DIADLO CCN(Cc1[nH+]ccn1Cc1ccccc1)c1ccc(F)cc1 ZINC000533352386 337843040 /nfs/dbraw/zinc/84/30/40/337843040.db2.gz FLWMHLZYBVYZHK-UHFFFAOYSA-N 1 2 309.388 4.097 20 0 DIADLO Cc1ccc(-c2nc(C(=O)Nc3ccc(C)[nH+]c3C)cs2)cc1 ZINC000119113801 337854589 /nfs/dbraw/zinc/85/45/89/337854589.db2.gz FYKWAIJNWILLKE-UHFFFAOYSA-N 1 2 323.421 4.383 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](OC2CCCC2)c2ccccc2)c(C)[nH+]1 ZINC000119187712 337855011 /nfs/dbraw/zinc/85/50/11/337855011.db2.gz WYHWYUARAAGYGV-IBGZPJMESA-N 1 2 324.424 4.337 20 0 DIADLO Cc1ccc(NC(=O)c2c(Cl)c3ccccc3n2C)c(C)[nH+]1 ZINC000119141910 337855493 /nfs/dbraw/zinc/85/54/93/337855493.db2.gz YYNYDYJRVJQJLJ-UHFFFAOYSA-N 1 2 313.788 4.096 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)CCc2ccccc2F)c(C)[nH+]1 ZINC000119218305 337856400 /nfs/dbraw/zinc/85/64/00/337856400.db2.gz ACIOLGGVAIVXRD-LBPRGKRZSA-N 1 2 300.377 4.045 20 0 DIADLO Cc1cc(NC(=O)N(C)[C@H](C)Cc2ccc(Cl)cc2)cc[nH+]1 ZINC000119722704 337862867 /nfs/dbraw/zinc/86/28/67/337862867.db2.gz JAPWDECJLPGOGP-CYBMUJFWSA-N 1 2 317.820 4.138 20 0 DIADLO Fc1ccc(-c2nc(CSCCn3cc[nH+]c3)cs2)cc1 ZINC000090199958 337878983 /nfs/dbraw/zinc/87/89/83/337878983.db2.gz KYCDURCSNVPIEB-UHFFFAOYSA-N 1 2 319.430 4.079 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@H](c2ncccc2C)C(C)C)n1 ZINC000120844619 337881406 /nfs/dbraw/zinc/88/14/06/337881406.db2.gz HHWGCIFXSFISOH-ZBFHGGJFSA-N 1 2 316.449 4.164 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1ccco1)c1ccccn1 ZINC000090913511 337887021 /nfs/dbraw/zinc/88/70/21/337887021.db2.gz MNGRNQHSMKKHEN-AUUYWEPGSA-N 1 2 308.381 4.123 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@H](C)c1ccco1)c1ccccn1 ZINC000090913509 337887121 /nfs/dbraw/zinc/88/71/21/337887121.db2.gz MNGRNQHSMKKHEN-KUHUBIRLSA-N 1 2 308.381 4.123 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@@H](C)c2nccs2)c2ccccn2)c1 ZINC000090946264 337887241 /nfs/dbraw/zinc/88/72/41/337887241.db2.gz QUXDDKBODQBHLC-WMLDXEAASA-N 1 2 309.438 4.287 20 0 DIADLO COc1cc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)ccn1 ZINC000537127077 337893794 /nfs/dbraw/zinc/89/37/94/337893794.db2.gz XNTZBHHSBQOBAJ-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000121511995 337894398 /nfs/dbraw/zinc/89/43/98/337894398.db2.gz JGBBCBIISZPUIC-LJQANCHMSA-N 1 2 321.424 4.464 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(-c3cccs3)nc2C)c(C)[nH+]1 ZINC000121567924 337895634 /nfs/dbraw/zinc/89/56/34/337895634.db2.gz XWKGZVPUYBLRBX-UHFFFAOYSA-N 1 2 323.421 4.383 20 0 DIADLO C[C@@H]1CCN(C(=O)CCCC2CCCCC2)C[C@@H]1n1cc[nH+]c1 ZINC000122780643 337925329 /nfs/dbraw/zinc/92/53/29/337925329.db2.gz SDPGYVAQIANBQQ-AEFFLSMTSA-N 1 2 317.477 4.043 20 0 DIADLO C[C@H]1CCN(C(=O)CCCC2CCCCC2)C[C@@H]1n1cc[nH+]c1 ZINC000122780886 337925331 /nfs/dbraw/zinc/92/53/31/337925331.db2.gz SDPGYVAQIANBQQ-WMZOPIPTSA-N 1 2 317.477 4.043 20 0 DIADLO CC(C)c1cc(N2CCC[C@@H]2C2CCOCC2)nc(C(C)C)[nH+]1 ZINC000537410299 337934051 /nfs/dbraw/zinc/93/40/51/337934051.db2.gz HFPRRXCXXNSYOV-QGZVFWFLSA-N 1 2 317.477 4.119 20 0 DIADLO Fc1ccc([C@@H]2CCCN(c3cc[nH+]c(C4CC4)n3)CC2)cc1 ZINC000537570654 337944065 /nfs/dbraw/zinc/94/40/65/337944065.db2.gz DMEKQTACUZZACF-CQSZACIVSA-N 1 2 311.404 4.267 20 0 DIADLO Fc1ccc([C@H]2CCCN(c3cc[nH+]c(C4CC4)n3)CC2)cc1 ZINC000537570653 337944083 /nfs/dbraw/zinc/94/40/83/337944083.db2.gz DMEKQTACUZZACF-AWEZNQCLSA-N 1 2 311.404 4.267 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)[C@H]1CCC[C@@H](F)C1 ZINC000424658630 337944200 /nfs/dbraw/zinc/94/42/00/337944200.db2.gz FCWWMBGLVFSCIF-UONOGXRCSA-N 1 2 314.360 4.341 20 0 DIADLO Cc1ccccc1[C@@H]1CN(c2[nH+]ccc3ccc(F)cc32)CCO1 ZINC000537658926 337957099 /nfs/dbraw/zinc/95/70/99/337957099.db2.gz MJURPSSPLYSDPB-IBGZPJMESA-N 1 2 322.383 4.260 20 0 DIADLO CC[C@@H]1CCC[C@H]1c1nc(CCn2c(C)[nH+]c3ccccc32)no1 ZINC000514913054 337973946 /nfs/dbraw/zinc/97/39/46/337973946.db2.gz DEAFVTCZJQOURS-HUUCEWRRSA-N 1 2 324.428 4.264 20 0 DIADLO CCCCN(C(=O)c1ccc2[nH+]ccn2c1)[C@H]1CCC[C@@H](C)C1 ZINC000515245059 337982914 /nfs/dbraw/zinc/98/29/14/337982914.db2.gz YYYRIJCJMOEZBM-WBVHZDCISA-N 1 2 313.445 4.155 20 0 DIADLO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+][C@@H](C(C)C)C(F)(F)F)cc1 ZINC000515317599 337984829 /nfs/dbraw/zinc/98/48/29/337984829.db2.gz UYLBHTXIJQRNNU-SRMUXQRQSA-N 1 2 315.379 4.364 20 0 DIADLO COc1cc(C)ccc1[C@H](C)[NH2+][C@@H](C)c1c(F)cncc1F ZINC000515390588 337987681 /nfs/dbraw/zinc/98/76/81/337987681.db2.gz HBQJDAIMNGWQOT-RYUDHWBXSA-N 1 2 306.356 4.089 20 0 DIADLO COc1cc(C)ccc1[C@H](C)[NH2+][C@H](C)c1c(F)cncc1F ZINC000515390587 337987698 /nfs/dbraw/zinc/98/76/98/337987698.db2.gz HBQJDAIMNGWQOT-NWDGAFQWSA-N 1 2 306.356 4.089 20 0 DIADLO Cc1cc(CN(C)c2cccc[nH+]2)cc(C)c1OCC(F)(F)F ZINC000515589859 337993639 /nfs/dbraw/zinc/99/36/39/337993639.db2.gz YEZKIFBJVADMSE-UHFFFAOYSA-N 1 2 324.346 4.276 20 0 DIADLO CC[N@H+](Cc1nnc(C2CC2)o1)Cc1ccc2ccccc2c1 ZINC000516307943 338010311 /nfs/dbraw/zinc/01/03/11/338010311.db2.gz UWVVWPXVSMUEBL-UHFFFAOYSA-N 1 2 307.397 4.122 20 0 DIADLO CC[N@@H+](Cc1nnc(C2CC2)o1)Cc1ccc2ccccc2c1 ZINC000516307943 338010312 /nfs/dbraw/zinc/01/03/12/338010312.db2.gz UWVVWPXVSMUEBL-UHFFFAOYSA-N 1 2 307.397 4.122 20 0 DIADLO Cc1ccccc1[C@H](c1noc(Cc2ccc[nH+]c2C)n1)C(C)C ZINC000516347482 338010456 /nfs/dbraw/zinc/01/04/56/338010456.db2.gz YJVWDAGSDLREMF-LJQANCHMSA-N 1 2 321.424 4.460 20 0 DIADLO COc1cccc2c1CCC[C@@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000516534036 338014728 /nfs/dbraw/zinc/01/47/28/338014728.db2.gz DCZLJDDDFHNCDR-SFHVURJKSA-N 1 2 323.440 4.180 20 0 DIADLO CCCc1csc(C[N@H+](C)Cc2ccc(Cl)s2)n1 ZINC000426035574 338019867 /nfs/dbraw/zinc/01/98/67/338019867.db2.gz JSPIQXSKNTVSRF-UHFFFAOYSA-N 1 2 300.880 4.443 20 0 DIADLO CCCc1csc(C[N@@H+](C)Cc2ccc(Cl)s2)n1 ZINC000426035574 338019868 /nfs/dbraw/zinc/01/98/68/338019868.db2.gz JSPIQXSKNTVSRF-UHFFFAOYSA-N 1 2 300.880 4.443 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)s1 ZINC000426032768 338019911 /nfs/dbraw/zinc/01/99/11/338019911.db2.gz AAXVRCNEEJBDRC-QWRGUYRKSA-N 1 2 301.415 4.313 20 0 DIADLO CCCc1csc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)n1 ZINC000426359743 338028697 /nfs/dbraw/zinc/02/86/97/338028697.db2.gz JBZLJQQAILDMAC-CMPLNLGQSA-N 1 2 306.397 4.258 20 0 DIADLO CCCc1csc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)n1 ZINC000426359743 338028698 /nfs/dbraw/zinc/02/86/98/338028698.db2.gz JBZLJQQAILDMAC-CMPLNLGQSA-N 1 2 306.397 4.258 20 0 DIADLO COc1ccc(CC[C@H](C)[NH2+]c2ccc(C)cc2OC)cc1O ZINC000426404485 338030836 /nfs/dbraw/zinc/03/08/36/338030836.db2.gz ZXVFZWJFMNCHEP-AWEZNQCLSA-N 1 2 315.413 4.151 20 0 DIADLO CCCc1csc(C[N@H+]2C[C@@H](c3ccccc3)O[C@@H](C)C2)n1 ZINC000426417587 338031408 /nfs/dbraw/zinc/03/14/08/338031408.db2.gz BORZCBLAPHOMBK-YOEHRIQHSA-N 1 2 316.470 4.058 20 0 DIADLO CCCc1csc(C[N@@H+]2C[C@@H](c3ccccc3)O[C@@H](C)C2)n1 ZINC000426417587 338031409 /nfs/dbraw/zinc/03/14/09/338031409.db2.gz BORZCBLAPHOMBK-YOEHRIQHSA-N 1 2 316.470 4.058 20 0 DIADLO Cc1ccc([C@@H](C)c2noc(CCc3c[nH+]cc(C)c3)n2)cc1 ZINC000426427827 338031953 /nfs/dbraw/zinc/03/19/53/338031953.db2.gz GXAZEKOACXPBPI-OAHLLOKOSA-N 1 2 307.397 4.018 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+](C)Cc1nc2c(s1)CCCC2 ZINC000428235806 338043649 /nfs/dbraw/zinc/04/36/49/338043649.db2.gz CXAIRGGMFCCHPC-UHFFFAOYSA-N 1 2 319.474 4.074 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+](C)Cc1nc2c(s1)CCCC2 ZINC000428235806 338043650 /nfs/dbraw/zinc/04/36/50/338043650.db2.gz CXAIRGGMFCCHPC-UHFFFAOYSA-N 1 2 319.474 4.074 20 0 DIADLO Cc1csc(C2([NH2+]Cc3oc(C(C)C)nc3C)CCCC2)n1 ZINC000428353220 338048463 /nfs/dbraw/zinc/04/84/63/338048463.db2.gz UGEXUDKVYQJMHN-UHFFFAOYSA-N 1 2 319.474 4.430 20 0 DIADLO CCc1nc(C)c(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)o1 ZINC000428378820 338049450 /nfs/dbraw/zinc/04/94/50/338049450.db2.gz IOKLATSQBSMHHR-GFCCVEGCSA-N 1 2 315.442 4.348 20 0 DIADLO CCc1nc(C)c(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)o1 ZINC000428378820 338049451 /nfs/dbraw/zinc/04/94/51/338049451.db2.gz IOKLATSQBSMHHR-GFCCVEGCSA-N 1 2 315.442 4.348 20 0 DIADLO Cc1nc(C(C)C)oc1C[NH2+]C1(c2nccs2)CCCC1 ZINC000428387047 338049858 /nfs/dbraw/zinc/04/98/58/338049858.db2.gz XTJHSIAKKCTGET-UHFFFAOYSA-N 1 2 305.447 4.122 20 0 DIADLO CC[C@@](C)([NH2+]Cc1oc(C(C)C)nc1C)c1nc(C)cs1 ZINC000428386590 338049889 /nfs/dbraw/zinc/04/98/89/338049889.db2.gz XJVZCWLURQRMGU-MRXNPFEDSA-N 1 2 307.463 4.286 20 0 DIADLO CC(C)c1nnc(C[N@H+](Cc2cccc(F)c2)C2CCCC2)[nH]1 ZINC000428394830 338050076 /nfs/dbraw/zinc/05/00/76/338050076.db2.gz XGILSSLCYFAFIM-UHFFFAOYSA-N 1 2 316.424 4.012 20 0 DIADLO CC(C)c1nnc(C[N@@H+](Cc2cccc(F)c2)C2CCCC2)[nH]1 ZINC000428394830 338050077 /nfs/dbraw/zinc/05/00/77/338050077.db2.gz XGILSSLCYFAFIM-UHFFFAOYSA-N 1 2 316.424 4.012 20 0 DIADLO Cc1cc[nH+]c(N2CCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)c1 ZINC000428695012 338058660 /nfs/dbraw/zinc/05/86/60/338058660.db2.gz UXOCNQHBECLHRJ-OAHLLOKOSA-N 1 2 312.804 4.261 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2nnc(-c3ccccc3)s2)c1C ZINC000428705282 338058775 /nfs/dbraw/zinc/05/87/75/338058775.db2.gz BZFKUKYQQYJXNV-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2nnc(-c3ccccc3)s2)c1C ZINC000428705282 338058776 /nfs/dbraw/zinc/05/87/76/338058776.db2.gz BZFKUKYQQYJXNV-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+](C)Cc2cccc(C)c2C)n1 ZINC000428708973 338059095 /nfs/dbraw/zinc/05/90/95/338059095.db2.gz GNTKBPOOBCIEMZ-HNNXBMFYSA-N 1 2 301.434 4.222 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+](C)Cc2cccc(C)c2C)n1 ZINC000428708973 338059096 /nfs/dbraw/zinc/05/90/96/338059096.db2.gz GNTKBPOOBCIEMZ-HNNXBMFYSA-N 1 2 301.434 4.222 20 0 DIADLO Clc1ccc(C2CC[NH+](Cc3ccon3)CC2)c(Cl)c1 ZINC000428730796 338059814 /nfs/dbraw/zinc/05/98/14/338059814.db2.gz PYIZCAQVVIYSQB-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO Cc1cc(F)ccc1C1CC[NH+](Cc2noc(C(C)C)n2)CC1 ZINC000428734538 338059980 /nfs/dbraw/zinc/05/99/80/338059980.db2.gz ATAAQWHZYPFVNC-UHFFFAOYSA-N 1 2 317.408 4.020 20 0 DIADLO CC[C@H](F)C[N@@H+]1C[C@@H](C)O[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000428933379 338065406 /nfs/dbraw/zinc/06/54/06/338065406.db2.gz UMFPPVPJXVCPCO-BYCMXARLSA-N 1 2 319.342 4.215 20 0 DIADLO CC[C@H](F)C[N@H+]1C[C@@H](C)O[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000428933379 338065407 /nfs/dbraw/zinc/06/54/07/338065407.db2.gz UMFPPVPJXVCPCO-BYCMXARLSA-N 1 2 319.342 4.215 20 0 DIADLO COC[C@@H]([NH2+]Cc1oc(C(C)C)nc1C)c1cccc(Cl)c1 ZINC000428966773 338067044 /nfs/dbraw/zinc/06/70/44/338067044.db2.gz LCJQAKPNMFKYOZ-OAHLLOKOSA-N 1 2 322.836 4.237 20 0 DIADLO CCCc1nc(C)c(C[N@H+](C)Cc2cc(Cl)ccc2F)o1 ZINC000428983165 338067675 /nfs/dbraw/zinc/06/76/75/338067675.db2.gz PHPCPLGZUZNOER-UHFFFAOYSA-N 1 2 310.800 4.360 20 0 DIADLO CCCc1nc(C)c(C[N@@H+](C)Cc2cc(Cl)ccc2F)o1 ZINC000428983165 338067676 /nfs/dbraw/zinc/06/76/76/338067676.db2.gz PHPCPLGZUZNOER-UHFFFAOYSA-N 1 2 310.800 4.360 20 0 DIADLO C[C@@H]1CC[C@@H](N(C)C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000429251953 338074841 /nfs/dbraw/zinc/07/48/41/338074841.db2.gz JPNCLLSAFONWOT-GDBMZVCRSA-N 1 2 310.397 4.135 20 0 DIADLO Cc1ccc(C(=O)N(C)[C@H]2CC[C@H](C)C2)cc1Oc1cc[nH+]cc1 ZINC000429255826 338074929 /nfs/dbraw/zinc/07/49/29/338074929.db2.gz QSVPPSKXHXCELB-YOEHRIQHSA-N 1 2 324.424 4.443 20 0 DIADLO Cc1c(C)c(C)c(C[N@@H+](C)Cc2nncn2C(C)C)c(C)c1C ZINC000429297474 338077128 /nfs/dbraw/zinc/07/71/28/338077128.db2.gz VJNRAKBMEPVNIY-UHFFFAOYSA-N 1 2 314.477 4.033 20 0 DIADLO Cc1c(C)c(C)c(C[N@H+](C)Cc2nncn2C(C)C)c(C)c1C ZINC000429297474 338077129 /nfs/dbraw/zinc/07/71/29/338077129.db2.gz VJNRAKBMEPVNIY-UHFFFAOYSA-N 1 2 314.477 4.033 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@H](C)C(=O)Nc1cc(Cl)ccc1C ZINC000429367774 338078677 /nfs/dbraw/zinc/07/86/77/338078677.db2.gz OTZGEWMCTDPVDG-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@H](C)C(=O)Nc1cc(Cl)ccc1C ZINC000429367774 338078678 /nfs/dbraw/zinc/07/86/78/338078678.db2.gz OTZGEWMCTDPVDG-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1cc(F)ccc1Br ZINC000429373461 338079030 /nfs/dbraw/zinc/07/90/30/338079030.db2.gz RXQKIWQBMCTMNC-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc2ccccc21 ZINC000429374723 338079007 /nfs/dbraw/zinc/07/90/07/338079007.db2.gz DNNHIUCDWPUHMU-HNNXBMFYSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@@H](C)C(=O)Nc1cccc2ccccc21 ZINC000429374723 338079008 /nfs/dbraw/zinc/07/90/08/338079008.db2.gz DNNHIUCDWPUHMU-HNNXBMFYSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1cc(F)ccc1Br ZINC000429373461 338079029 /nfs/dbraw/zinc/07/90/29/338079029.db2.gz RXQKIWQBMCTMNC-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(Cl)cc1C ZINC000429393484 338079595 /nfs/dbraw/zinc/07/95/95/338079595.db2.gz LULMGMPIZYGSAW-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@@H](C)C(=O)Nc1ccc(Cl)cc1C ZINC000429393484 338079596 /nfs/dbraw/zinc/07/95/96/338079596.db2.gz LULMGMPIZYGSAW-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO C[C@H](Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1[nH+]ccn1C ZINC000429460227 338081805 /nfs/dbraw/zinc/08/18/05/338081805.db2.gz XHOLYNFBDXTZRT-NSHDSACASA-N 1 2 311.351 4.433 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)N(C)Cc1cn2c([nH+]1)CCCC2 ZINC000429535273 338083234 /nfs/dbraw/zinc/08/32/34/338083234.db2.gz AYXCSAJBZYWGFD-QGZVFWFLSA-N 1 2 319.399 4.081 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1c(Cl)cccc1OC ZINC000429687537 338087350 /nfs/dbraw/zinc/08/73/50/338087350.db2.gz TUTHMPBIMHMWLQ-INIZCTEOSA-N 1 2 304.821 4.327 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1c(Cl)cccc1OC ZINC000429687537 338087351 /nfs/dbraw/zinc/08/73/51/338087351.db2.gz TUTHMPBIMHMWLQ-INIZCTEOSA-N 1 2 304.821 4.327 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2cc(C(C)(C)C)on2)s1 ZINC000429697933 338087580 /nfs/dbraw/zinc/08/75/80/338087580.db2.gz MSUNGOYXWJESMP-GFCCVEGCSA-N 1 2 321.490 4.492 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cc(C(C)(C)C)on2)s1 ZINC000429697933 338087581 /nfs/dbraw/zinc/08/75/81/338087581.db2.gz MSUNGOYXWJESMP-GFCCVEGCSA-N 1 2 321.490 4.492 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H](c1ncc(C)s1)C1CC1 ZINC000429697118 338087620 /nfs/dbraw/zinc/08/76/20/338087620.db2.gz JWRVFMOUTHMJHA-OAHLLOKOSA-N 1 2 322.861 4.354 20 0 DIADLO Cc1ccc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)cc1Cl ZINC000430017243 338093589 /nfs/dbraw/zinc/09/35/89/338093589.db2.gz ASHRYHIFPKUJFJ-UHFFFAOYSA-N 1 2 317.713 4.495 20 0 DIADLO Cc1cc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)ccc1Cl ZINC000430033916 338094086 /nfs/dbraw/zinc/09/40/86/338094086.db2.gz LPXYUHDQCMKIST-UHFFFAOYSA-N 1 2 317.713 4.495 20 0 DIADLO CCOc1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccnc2)cc1F ZINC000430088618 338095714 /nfs/dbraw/zinc/09/57/14/338095714.db2.gz KWSUGRWCXAXZQM-SFHVURJKSA-N 1 2 314.404 4.203 20 0 DIADLO CCOc1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)cc1F ZINC000430088618 338095715 /nfs/dbraw/zinc/09/57/15/338095715.db2.gz KWSUGRWCXAXZQM-SFHVURJKSA-N 1 2 314.404 4.203 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ncc(C(F)(F)F)s2)c1C ZINC000430096392 338096347 /nfs/dbraw/zinc/09/63/47/338096347.db2.gz SCYCURVGSDMKHK-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ncc(C(F)(F)F)s2)c1C ZINC000430096392 338096348 /nfs/dbraw/zinc/09/63/48/338096348.db2.gz SCYCURVGSDMKHK-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccc(Cl)cn1 ZINC000430740362 338112898 /nfs/dbraw/zinc/11/28/98/338112898.db2.gz BJYMQSFBZGLBIC-ZETCQYMHSA-N 1 2 318.701 4.142 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccc(Cl)cn1 ZINC000430740358 338113004 /nfs/dbraw/zinc/11/30/04/338113004.db2.gz BJYMQSFBZGLBIC-SSDOTTSWSA-N 1 2 318.701 4.142 20 0 DIADLO CCC[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccccn1 ZINC000430750812 338113477 /nfs/dbraw/zinc/11/34/77/338113477.db2.gz PMSKJULLGZQWDV-ZDUSSCGKSA-N 1 2 312.310 4.269 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1cc(Cl)ccc1F ZINC000430868284 338117476 /nfs/dbraw/zinc/11/74/76/338117476.db2.gz VHMOCVQFWUBCIX-MRXNPFEDSA-N 1 2 321.827 4.423 20 0 DIADLO CCCc1csc(CN2CCCC[C@H]2c2[nH+]ccn2CC)n1 ZINC000430872967 338117586 /nfs/dbraw/zinc/11/75/86/338117586.db2.gz NTAYQYHJXWDDMR-HNNXBMFYSA-N 1 2 318.490 4.039 20 0 DIADLO Cn1c2cc(F)ccc2[nH+]c1N1CCC[C@@H]1c1ccsc1 ZINC000431030188 338120817 /nfs/dbraw/zinc/12/08/17/338120817.db2.gz KELNIDPEQKAPAP-CQSZACIVSA-N 1 2 301.390 4.115 20 0 DIADLO Cc1nc2ccc(C(=O)Nc3ccc4[nH]c(C)[nH+]c4c3)cc2s1 ZINC000431350538 338128905 /nfs/dbraw/zinc/12/89/05/338128905.db2.gz OOBAZXQDGHKIFM-UHFFFAOYSA-N 1 2 322.393 4.042 20 0 DIADLO Cc1nc2ccc(C(=O)Nc3ccc4[nH+]c(C)[nH]c4c3)cc2s1 ZINC000431350538 338128906 /nfs/dbraw/zinc/12/89/06/338128906.db2.gz OOBAZXQDGHKIFM-UHFFFAOYSA-N 1 2 322.393 4.042 20 0 DIADLO CC[C@H]1CCC[C@H]1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000162836479 338137794 /nfs/dbraw/zinc/13/77/94/338137794.db2.gz DQLRFDHXHKGEIS-KBXCAEBGSA-N 1 2 310.397 4.182 20 0 DIADLO CC(C)n1cc[nH+]c1CN1CCCC[C@@H]1c1ccc(F)cc1F ZINC000432019841 338143761 /nfs/dbraw/zinc/14/37/61/338143761.db2.gz MZYRCPLSPMCWSG-QGZVFWFLSA-N 1 2 319.399 4.469 20 0 DIADLO COC[C@H]([NH2+]Cc1ccc(F)c(Cl)c1Cl)c1ccco1 ZINC000432249223 338150809 /nfs/dbraw/zinc/15/08/09/338150809.db2.gz DQMMTPPXUKYTEY-NSHDSACASA-N 1 2 318.175 4.203 20 0 DIADLO FC(F)(F)c1ccc([C@H]2CCCC[N@@H+]2Cc2cocn2)cc1 ZINC000432737107 338165084 /nfs/dbraw/zinc/16/50/84/338165084.db2.gz AMACHIVQYUBZRZ-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1ccc([C@H]2CCCC[N@H+]2Cc2cocn2)cc1 ZINC000432737107 338165085 /nfs/dbraw/zinc/16/50/85/338165085.db2.gz AMACHIVQYUBZRZ-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO C[N@H+](Cc1nc2ccc(F)cc2s1)Cc1ccc(F)c(F)c1 ZINC000432747370 338165997 /nfs/dbraw/zinc/16/59/97/338165997.db2.gz JEVYYZNISPCYKS-UHFFFAOYSA-N 1 2 322.355 4.346 20 0 DIADLO C[N@@H+](Cc1nc2ccc(F)cc2s1)Cc1ccc(F)c(F)c1 ZINC000432747370 338165998 /nfs/dbraw/zinc/16/59/98/338165998.db2.gz JEVYYZNISPCYKS-UHFFFAOYSA-N 1 2 322.355 4.346 20 0 DIADLO Clc1cccc(CCSCCn2cc[nH+]c2)c1Cl ZINC000432760226 338166842 /nfs/dbraw/zinc/16/68/42/338166842.db2.gz ZEBXWSFZPWVCTG-UHFFFAOYSA-N 1 2 301.242 4.166 20 0 DIADLO C[N@@H+](Cc1cn2c(n1)CCCC2)Cc1ccc(C(C)(C)C)s1 ZINC000432789547 338167946 /nfs/dbraw/zinc/16/79/46/338167946.db2.gz SWTVBHNDTLBGMX-UHFFFAOYSA-N 1 2 317.502 4.210 20 0 DIADLO C[N@H+](Cc1cn2c(n1)CCCC2)Cc1ccc(C(C)(C)C)s1 ZINC000432789547 338167947 /nfs/dbraw/zinc/16/79/47/338167947.db2.gz SWTVBHNDTLBGMX-UHFFFAOYSA-N 1 2 317.502 4.210 20 0 DIADLO CN(Cc1cn2c([nH+]1)CCCC2)Cc1ccc(C(C)(C)C)s1 ZINC000432789547 338167948 /nfs/dbraw/zinc/16/79/48/338167948.db2.gz SWTVBHNDTLBGMX-UHFFFAOYSA-N 1 2 317.502 4.210 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@@H](c3ccccc3)C2)c(C)[nH+]1 ZINC000433020098 338176567 /nfs/dbraw/zinc/17/65/67/338176567.db2.gz BJVHVSKZOAARGZ-QGZVFWFLSA-N 1 2 309.413 4.110 20 0 DIADLO COc1cc[nH+]cc1CN1CC[C@H](C(F)(F)F)c2ccccc21 ZINC000433034508 338177556 /nfs/dbraw/zinc/17/75/56/338177556.db2.gz IHUYOMLKUCJFAN-AWEZNQCLSA-N 1 2 322.330 4.146 20 0 DIADLO COc1ccc(OCCC[NH2+][C@H](c2ccccc2)C(F)F)cc1 ZINC000433054951 338178957 /nfs/dbraw/zinc/17/89/57/338178957.db2.gz WTTSSCCJSMKXQY-QGZVFWFLSA-N 1 2 321.367 4.060 20 0 DIADLO Cc1ccoc1CNC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000433156998 338183357 /nfs/dbraw/zinc/18/33/57/338183357.db2.gz DUOCAGVPGUSECH-UHFFFAOYSA-N 1 2 323.352 4.097 20 0 DIADLO COc1cc(NCc2c[nH+]c3ccc(Cl)cn23)ccc1Cl ZINC000433186622 338184669 /nfs/dbraw/zinc/18/46/69/338184669.db2.gz KIBYJXYUXUZOKH-UHFFFAOYSA-N 1 2 322.195 4.262 20 0 DIADLO C[N@H+](Cc1nc2cccnc2s1)Cc1ccc(F)c(Cl)c1 ZINC000433237203 338187404 /nfs/dbraw/zinc/18/74/04/338187404.db2.gz UUVSUSKZCLQTLM-UHFFFAOYSA-N 1 2 321.808 4.116 20 0 DIADLO C[N@@H+](Cc1nc2cccnc2s1)Cc1ccc(F)c(Cl)c1 ZINC000433237203 338187405 /nfs/dbraw/zinc/18/74/05/338187405.db2.gz UUVSUSKZCLQTLM-UHFFFAOYSA-N 1 2 321.808 4.116 20 0 DIADLO CC(C)(C)c1noc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)n1 ZINC000433290669 338189578 /nfs/dbraw/zinc/18/95/78/338189578.db2.gz UBLDYRSOQBSFEH-ZDUSSCGKSA-N 1 2 319.836 4.010 20 0 DIADLO CC(C)(C)c1noc(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)n1 ZINC000433290669 338189579 /nfs/dbraw/zinc/18/95/79/338189579.db2.gz UBLDYRSOQBSFEH-ZDUSSCGKSA-N 1 2 319.836 4.010 20 0 DIADLO Cc1nc([C@@](C)([NH2+]Cc2ccc(C(C)(C)C)cc2)C2CC2)no1 ZINC000433292182 338189665 /nfs/dbraw/zinc/18/96/65/338189665.db2.gz WMSUWGOQTCMXCD-IBGZPJMESA-N 1 2 313.445 4.091 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2ncc(C(F)(F)F)s2)cc1F ZINC000433330659 338192779 /nfs/dbraw/zinc/19/27/79/338192779.db2.gz CFNRKBCJYJJGIK-SECBINFHSA-N 1 2 318.339 4.460 20 0 DIADLO Cc1cccc([C@H]2CCCN2c2[nH+]c(C)nc3[nH]ccc32)c1C ZINC000433777452 338201516 /nfs/dbraw/zinc/20/15/16/338201516.db2.gz MBTYYFPNJDDFTO-QGZVFWFLSA-N 1 2 306.413 4.225 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)o1 ZINC000433788866 338201898 /nfs/dbraw/zinc/20/18/98/338201898.db2.gz JPKNNCJNANWVGB-NHYWBVRUSA-N 1 2 307.825 4.333 20 0 DIADLO Cc1nc2[nH]ccc2c(N2CCC[C@H]2c2ccc(Cl)cc2)[nH+]1 ZINC000433785529 338201930 /nfs/dbraw/zinc/20/19/30/338201930.db2.gz RODIRKNAWWPXHX-HNNXBMFYSA-N 1 2 312.804 4.261 20 0 DIADLO COc1ccc([C@H](Nc2[nH+]c(C)nc3[nH]ccc32)C(C)C)cc1 ZINC000433800764 338202238 /nfs/dbraw/zinc/20/22/38/338202238.db2.gz WTYIDRUYIFXNSN-MRXNPFEDSA-N 1 2 310.401 4.084 20 0 DIADLO COc1cccc2c(N3CC[C@@H](CC(F)(F)F)C3)cc[nH+]c12 ZINC000433807649 338202551 /nfs/dbraw/zinc/20/25/51/338202551.db2.gz JOVGAYXZRVYATB-NSHDSACASA-N 1 2 310.319 4.022 20 0 DIADLO CC(C)OC(C)(C)C(=O)Nc1ccc2[nH]c(C(C)(C)C)[nH+]c2c1 ZINC000448547852 338211093 /nfs/dbraw/zinc/21/10/93/338211093.db2.gz JNNCOFKAQDFVFR-UHFFFAOYSA-N 1 2 317.433 4.003 20 0 DIADLO Cc1ccn2c(/C=C\c3ncc(Br)s3)c[nH+]c2c1 ZINC000434627525 338221836 /nfs/dbraw/zinc/22/18/36/338221836.db2.gz NVYBHMBPTXYGRB-IHWYPQMZSA-N 1 2 320.215 4.032 20 0 DIADLO Cc1cccc2[nH+]cc(/C=C\c3ncc(Br)s3)n21 ZINC000434633830 338222006 /nfs/dbraw/zinc/22/20/06/338222006.db2.gz MAZIEDDNZLQCOE-WAYWQWQTSA-N 1 2 320.215 4.032 20 0 DIADLO Cc1cccc2[nH+]cc(/C=C/c3ncc(Br)s3)n21 ZINC000434633829 338222087 /nfs/dbraw/zinc/22/20/87/338222087.db2.gz MAZIEDDNZLQCOE-AATRIKPKSA-N 1 2 320.215 4.032 20 0 DIADLO CCCC(CCC)[S@](=O)Cc1[nH+]ccn1-c1ccccc1 ZINC000434637200 338222152 /nfs/dbraw/zinc/22/21/52/338222152.db2.gz MGEASHKGKDGVDS-OAQYLSRUSA-N 1 2 304.459 4.090 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ncc(C(F)(F)F)s2)cc1 ZINC000434836140 338226240 /nfs/dbraw/zinc/22/62/40/338226240.db2.gz KBKPBKBWWCVFPX-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ncc(C(F)(F)F)s2)cc1 ZINC000434836140 338226241 /nfs/dbraw/zinc/22/62/41/338226241.db2.gz KBKPBKBWWCVFPX-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO c1coc(C[NH+](Cc2ccco2)Cc2ccc(-c3cc[nH]n3)o2)c1 ZINC000434836678 338226270 /nfs/dbraw/zinc/22/62/70/338226270.db2.gz OQILRHQHAARKNZ-UHFFFAOYSA-N 1 2 323.352 4.058 20 0 DIADLO COc1cccc(C[N@@H+]2CC[C@H]2c2ccccc2)c1OC(F)F ZINC000434981527 338228445 /nfs/dbraw/zinc/22/84/45/338228445.db2.gz KXGWXIZWRFYEFQ-HNNXBMFYSA-N 1 2 319.351 4.244 20 0 DIADLO COc1cccc(C[N@H+]2CC[C@H]2c2ccccc2)c1OC(F)F ZINC000434981527 338228446 /nfs/dbraw/zinc/22/84/46/338228446.db2.gz KXGWXIZWRFYEFQ-HNNXBMFYSA-N 1 2 319.351 4.244 20 0 DIADLO COc1cc(C[N@@H+]2CC[C@@H]2c2ccccc2)cc(Cl)c1OC ZINC000434985055 338228664 /nfs/dbraw/zinc/22/86/64/338228664.db2.gz FPVQUBCXUMVKQR-MRXNPFEDSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(C[N@H+]2CC[C@@H]2c2ccccc2)cc(Cl)c1OC ZINC000434985055 338228665 /nfs/dbraw/zinc/22/86/65/338228665.db2.gz FPVQUBCXUMVKQR-MRXNPFEDSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)c(OC(F)F)c1 ZINC000434990515 338229172 /nfs/dbraw/zinc/22/91/72/338229172.db2.gz IXQZBVFYCNJCMV-INIZCTEOSA-N 1 2 319.351 4.244 20 0 DIADLO COc1ccc(C[N@H+]2CC[C@H]2c2ccccc2)c(OC(F)F)c1 ZINC000434990515 338229173 /nfs/dbraw/zinc/22/91/73/338229173.db2.gz IXQZBVFYCNJCMV-INIZCTEOSA-N 1 2 319.351 4.244 20 0 DIADLO C[N@H+](Cc1ccc(-c2cc[nH]n2)o1)Cc1ccc(F)cc1Cl ZINC000435123983 338232421 /nfs/dbraw/zinc/23/24/21/338232421.db2.gz KRZYKCADTXUGHW-UHFFFAOYSA-N 1 2 319.767 4.094 20 0 DIADLO C[N@@H+](Cc1ccc(-c2cc[nH]n2)o1)Cc1ccc(F)cc1Cl ZINC000435123983 338232422 /nfs/dbraw/zinc/23/24/22/338232422.db2.gz KRZYKCADTXUGHW-UHFFFAOYSA-N 1 2 319.767 4.094 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1ncc(C(F)(F)F)s1 ZINC000435125115 338232428 /nfs/dbraw/zinc/23/24/28/338232428.db2.gz VCRFBMMWOBUXEJ-SECBINFHSA-N 1 2 318.339 4.494 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ncc(C(F)(F)F)s1 ZINC000435125115 338232429 /nfs/dbraw/zinc/23/24/29/338232429.db2.gz VCRFBMMWOBUXEJ-SECBINFHSA-N 1 2 318.339 4.494 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)s1 ZINC000435127430 338232763 /nfs/dbraw/zinc/23/27/63/338232763.db2.gz WIEJDWXUNMDHKW-GHMZBOCLSA-N 1 2 304.381 4.317 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)s1 ZINC000435127430 338232764 /nfs/dbraw/zinc/23/27/64/338232764.db2.gz WIEJDWXUNMDHKW-GHMZBOCLSA-N 1 2 304.381 4.317 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ncc(C(F)(F)F)s2)c1 ZINC000435133587 338232844 /nfs/dbraw/zinc/23/28/44/338232844.db2.gz RZVXWUPNYOUAQO-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ncc(C(F)(F)F)s2)c1 ZINC000435133587 338232845 /nfs/dbraw/zinc/23/28/45/338232845.db2.gz RZVXWUPNYOUAQO-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO CCS[C@H]1CCCC[N@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC000435136023 338233100 /nfs/dbraw/zinc/23/31/00/338233100.db2.gz XKBJNZGHAOUGJJ-JTQLQIEISA-N 1 2 324.437 4.270 20 0 DIADLO CCS[C@H]1CCCC[N@@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC000435136023 338233101 /nfs/dbraw/zinc/23/31/01/338233101.db2.gz XKBJNZGHAOUGJJ-JTQLQIEISA-N 1 2 324.437 4.270 20 0 DIADLO Cc1cc(N[C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)nc[nH+]1 ZINC000435595059 338243050 /nfs/dbraw/zinc/24/30/50/338243050.db2.gz BANRKNNIULFQDV-MQMHXKEQSA-N 1 2 307.319 4.162 20 0 DIADLO C[C@H]1[C@@H](c2ccccc2)[C@H]1C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000435679278 338245077 /nfs/dbraw/zinc/24/50/77/338245077.db2.gz XSUMUDBCQHEVCM-KKXDTOCCSA-N 1 2 317.392 4.065 20 0 DIADLO Cc1[nH+]cccc1NCc1ccc(N(C)c2ccccc2)nc1 ZINC000435711460 338245929 /nfs/dbraw/zinc/24/59/29/338245929.db2.gz PFXACACVAMUAQU-UHFFFAOYSA-N 1 2 304.397 4.165 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(C)c(Oc3cc[nH+]cc3)c2)cn1 ZINC000154950693 338253282 /nfs/dbraw/zinc/25/32/82/338253282.db2.gz SCJPHVCYTFRAGX-UHFFFAOYSA-N 1 2 319.364 4.138 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)CC1CCC(C)CC1 ZINC000435985698 338255164 /nfs/dbraw/zinc/25/51/64/338255164.db2.gz TXSXNVURSSWXLX-JCYILVPMSA-N 1 2 317.477 4.173 20 0 DIADLO CCCC(C)(C)CC(=O)N1CCCC[C@H]1c1[nH+]ccn1CC ZINC000435994307 338255248 /nfs/dbraw/zinc/25/52/48/338255248.db2.gz HQYJQUDXEZRETO-HNNXBMFYSA-N 1 2 305.466 4.173 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)C[C@H](C)C(C)(C)C ZINC000435991970 338255258 /nfs/dbraw/zinc/25/52/58/338255258.db2.gz JNGFNLRVNQARJR-GJZGRUSLSA-N 1 2 305.466 4.029 20 0 DIADLO CCCC(C)(C)CC(=O)N1CCCC[C@@H]1c1[nH+]ccn1CC ZINC000435994308 338255273 /nfs/dbraw/zinc/25/52/73/338255273.db2.gz HQYJQUDXEZRETO-OAHLLOKOSA-N 1 2 305.466 4.173 20 0 DIADLO CCC[C@@H](C)C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436152034 338259687 /nfs/dbraw/zinc/25/96/87/338259687.db2.gz FXGVQYFMYWGDIL-CQSZACIVSA-N 1 2 311.429 4.261 20 0 DIADLO CCCC1(C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)CC1 ZINC000436201314 338261745 /nfs/dbraw/zinc/26/17/45/338261745.db2.gz UDMOJWJQLKBXHT-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO FCC[NH2+][C@H](c1ccccc1)c1ccccc1Br ZINC000436305758 338267966 /nfs/dbraw/zinc/26/79/66/338267966.db2.gz HENWQWDWDJXYHR-OAHLLOKOSA-N 1 2 308.194 4.098 20 0 DIADLO COc1cccc2c(N[C@@H]3CCO[C@H](CC(C)C)C3)cc[nH+]c12 ZINC000436463452 338272964 /nfs/dbraw/zinc/27/29/64/338272964.db2.gz YPMFODFPKSYNSV-HUUCEWRRSA-N 1 2 314.429 4.249 20 0 DIADLO COc1cccc2c(N[C@H]3CCO[C@@H](CC(C)C)C3)cc[nH+]c12 ZINC000436463451 338273003 /nfs/dbraw/zinc/27/30/03/338273003.db2.gz YPMFODFPKSYNSV-GJZGRUSLSA-N 1 2 314.429 4.249 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](c2ccccc2)C2CC2)c(C)[nH+]1 ZINC000436486285 338273773 /nfs/dbraw/zinc/27/37/73/338273773.db2.gz BPOFQYNQJNKWIS-SFHVURJKSA-N 1 2 309.413 4.280 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@H](C)[C@@H]3CCCC[C@H]32)c(C)[nH+]1 ZINC000436488236 338274047 /nfs/dbraw/zinc/27/40/47/338274047.db2.gz DNHUESHJOCDYTI-VBNZEHGJSA-N 1 2 301.434 4.049 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@H](Cc3ccccc3)C2)c(C)[nH+]1 ZINC000436491988 338274139 /nfs/dbraw/zinc/27/41/39/338274139.db2.gz JBZGKCPEMDSAEL-GOSISDBHSA-N 1 2 323.440 4.103 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](C)CCc2ccccc2)c(C)[nH+]1 ZINC000436494768 338274275 /nfs/dbraw/zinc/27/42/75/338274275.db2.gz NZEFIZUNQGSOKZ-CQSZACIVSA-N 1 2 311.429 4.150 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@H]2CCc3ccccc32)c(C)[nH+]1 ZINC000436494834 338274306 /nfs/dbraw/zinc/27/43/06/338274306.db2.gz OHCKDDGOEFORGL-KRWDZBQOSA-N 1 2 309.413 4.158 20 0 DIADLO Cc1cc(C)c(NC(=O)NCCc2cc3ccccc3o2)c(C)[nH+]1 ZINC000436497098 338274368 /nfs/dbraw/zinc/27/43/68/338274368.db2.gz RUEZXPDTZIIMPS-UHFFFAOYSA-N 1 2 323.396 4.117 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C)c2ccc(F)cc2F)c(C)[nH+]1 ZINC000436500011 338274521 /nfs/dbraw/zinc/27/45/21/338274521.db2.gz YSBZHFSPSPVWGO-NSHDSACASA-N 1 2 319.355 4.168 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cc(C(C)C)c(O)cc3C)cc2[nH+]1 ZINC000436833143 338289145 /nfs/dbraw/zinc/28/91/45/338289145.db2.gz JABSQNHODXIGRO-UHFFFAOYSA-N 1 2 323.396 4.261 20 0 DIADLO Cc1cc[nH]c1C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(C)c1 ZINC000437186710 338303351 /nfs/dbraw/zinc/30/33/51/338303351.db2.gz KVOQUDZBIWHHHZ-UHFFFAOYSA-N 1 2 307.353 4.071 20 0 DIADLO Fc1cccc(CSCc2[nH+]ccn2CC(F)(F)F)c1 ZINC000437270548 338305538 /nfs/dbraw/zinc/30/55/38/338305538.db2.gz XRFXDSOALINOAE-UHFFFAOYSA-N 1 2 304.312 4.018 20 0 DIADLO c1cn(-c2cccc(NCCCCOc3ccccc3)c2)c[nH+]1 ZINC000437575815 338313858 /nfs/dbraw/zinc/31/38/58/338313858.db2.gz GTOFFENSWZBQDB-UHFFFAOYSA-N 1 2 307.397 4.143 20 0 DIADLO Cn1ncc(Cl)c1C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000437584982 338314821 /nfs/dbraw/zinc/31/48/21/338314821.db2.gz YYAOADMVTFAUTE-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1ncc(Cl)c1C[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000437584982 338314822 /nfs/dbraw/zinc/31/48/22/338314822.db2.gz YYAOADMVTFAUTE-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO Fc1ccc(OCc2c[nH+]cn2Cc2ccccc2)cc1Cl ZINC000437619152 338316377 /nfs/dbraw/zinc/31/63/77/338316377.db2.gz GSDORCMINUEGKH-UHFFFAOYSA-N 1 2 316.763 4.303 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC[C@H]2c2cccn2C)cs1 ZINC000437645221 338317008 /nfs/dbraw/zinc/31/70/08/338317008.db2.gz IURYQKMXNHRGAB-KRWDZBQOSA-N 1 2 317.502 4.407 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC[C@H]2c2cccn2C)cs1 ZINC000437645221 338317009 /nfs/dbraw/zinc/31/70/09/338317009.db2.gz IURYQKMXNHRGAB-KRWDZBQOSA-N 1 2 317.502 4.407 20 0 DIADLO CC[N@H+](Cc1c(Cl)cnn1C)[C@@H](C)c1cc2ccccc2o1 ZINC000437684556 338318136 /nfs/dbraw/zinc/31/81/36/338318136.db2.gz BAVBEKPVJWSVQO-LBPRGKRZSA-N 1 2 317.820 4.403 20 0 DIADLO CC[N@@H+](Cc1c(Cl)cnn1C)[C@@H](C)c1cc2ccccc2o1 ZINC000437684556 338318137 /nfs/dbraw/zinc/31/81/37/338318137.db2.gz BAVBEKPVJWSVQO-LBPRGKRZSA-N 1 2 317.820 4.403 20 0 DIADLO CC[C@H]1CC[C@H](C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)CC1 ZINC000438039222 338328783 /nfs/dbraw/zinc/32/87/83/338328783.db2.gz DYBNMIXUZKRZNZ-SHTZXODSSA-N 1 2 311.429 4.242 20 0 DIADLO CCCCS(=O)(=O)Nc1ccc([NH2+]CCC(C)(C)C)cc1 ZINC000438077418 338330108 /nfs/dbraw/zinc/33/01/08/338330108.db2.gz UMRVUFYDXQQJBA-UHFFFAOYSA-N 1 2 312.479 4.077 20 0 DIADLO FC(F)(F)[C@@H]1CCC[C@@H](Nc2ccc(N3CCCC3)c[nH+]2)C1 ZINC000438089203 338330744 /nfs/dbraw/zinc/33/07/44/338330744.db2.gz UHSSZSKUSQQOMF-CHWSQXEVSA-N 1 2 313.367 4.215 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NCC[C@H]2CCOC2)c1 ZINC000438089683 338330840 /nfs/dbraw/zinc/33/08/40/338330840.db2.gz RGWNENJTFHAXNV-INIZCTEOSA-N 1 2 313.445 4.189 20 0 DIADLO FC(F)(F)[C@@H]1CCC[C@H](Nc2ccc(N3CCCC3)c[nH+]2)C1 ZINC000438089204 338330875 /nfs/dbraw/zinc/33/08/75/338330875.db2.gz UHSSZSKUSQQOMF-OLZOCXBDSA-N 1 2 313.367 4.215 20 0 DIADLO Cc1ccc2cc(CNc3ccc(-n4cc[nH+]c4)cc3)ccc2n1 ZINC000438118824 338333272 /nfs/dbraw/zinc/33/32/72/338333272.db2.gz YFEAWTLKYWABFG-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000438135006 338333938 /nfs/dbraw/zinc/33/39/38/338333938.db2.gz UTSTWYYMDBRQNS-CJNGLKHVSA-N 1 2 314.433 4.075 20 0 DIADLO CCOC(=O)c1ccc(CNc2ccc(-c3ccccc3)c[nH+]2)o1 ZINC000438238418 338337618 /nfs/dbraw/zinc/33/76/18/338337618.db2.gz JTUOFHDJBKBFHN-UHFFFAOYSA-N 1 2 322.364 4.130 20 0 DIADLO Clc1ccc2[nH]c([C@@H]3CCC[N@@H+]3Cc3ccco3)nc2c1 ZINC000438261038 338338100 /nfs/dbraw/zinc/33/81/00/338338100.db2.gz PUQLIGVOJOPVFU-HNNXBMFYSA-N 1 2 301.777 4.146 20 0 DIADLO Clc1ccc2[nH]c([C@@H]3CCC[N@H+]3Cc3ccco3)nc2c1 ZINC000438261038 338338101 /nfs/dbraw/zinc/33/81/01/338338101.db2.gz PUQLIGVOJOPVFU-HNNXBMFYSA-N 1 2 301.777 4.146 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H](c3cccc(Cl)c3)OC[C@H]2C)cn1 ZINC000438550806 338347766 /nfs/dbraw/zinc/34/77/66/338347766.db2.gz BPGONHZIGBDWLU-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H](c3cccc(Cl)c3)OC[C@H]2C)cn1 ZINC000438550806 338347767 /nfs/dbraw/zinc/34/77/67/338347767.db2.gz BPGONHZIGBDWLU-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@H](c3ccccc3)C[C@@H]2C)no1 ZINC000439334138 338367623 /nfs/dbraw/zinc/36/76/23/338367623.db2.gz XCIWTGJMQKIZCS-RDJZCZTQSA-N 1 2 313.445 4.180 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@H](c3ccccc3)C[C@@H]2C)no1 ZINC000439334138 338367624 /nfs/dbraw/zinc/36/76/24/338367624.db2.gz XCIWTGJMQKIZCS-RDJZCZTQSA-N 1 2 313.445 4.180 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCc3c4cccc(F)c4[nH]c3C2)c(C)n1 ZINC000439474701 338370965 /nfs/dbraw/zinc/37/09/65/338370965.db2.gz NSPVUINEUUWTHH-UHFFFAOYSA-N 1 2 323.415 4.267 20 0 DIADLO Cc1ccc(C[N@H+]2CCCc3c4cccc(F)c4[nH]c3C2)c(C)n1 ZINC000439474701 338370966 /nfs/dbraw/zinc/37/09/66/338370966.db2.gz NSPVUINEUUWTHH-UHFFFAOYSA-N 1 2 323.415 4.267 20 0 DIADLO Cn1c[nH+]cc1CSc1ncc(-c2ccc(Cl)cc2)o1 ZINC000439539581 338372622 /nfs/dbraw/zinc/37/26/22/338372622.db2.gz GIUYLWYTVDJGMR-UHFFFAOYSA-N 1 2 305.790 4.021 20 0 DIADLO CCC[C@H]([NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)OCC ZINC000439545593 338372876 /nfs/dbraw/zinc/37/28/76/338372876.db2.gz HQLOANJXVFPRBP-FZMZJTMJSA-N 1 2 317.351 4.088 20 0 DIADLO COc1cccc2c(N3CCC[C@H](C(F)(F)F)[C@@H]3C)cc[nH+]c12 ZINC000440643676 338393964 /nfs/dbraw/zinc/39/39/64/338393964.db2.gz ABEDVWXZSPIBAX-AAEUAGOBSA-N 1 2 324.346 4.411 20 0 DIADLO COc1cccc2c(N[C@H]3CCOc4ccc(F)cc43)cc[nH+]c12 ZINC000440664838 338394841 /nfs/dbraw/zinc/39/48/41/338394841.db2.gz ZATPWEONSJWUOO-INIZCTEOSA-N 1 2 324.355 4.318 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)[C@H]2C[C@@H]2C2CC2)c1C(C)C ZINC000441579401 338417214 /nfs/dbraw/zinc/41/72/14/338417214.db2.gz HXIKDNJCFIASSD-CVEARBPZSA-N 1 2 308.425 4.073 20 0 DIADLO C[C@H](CCC(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccccc1 ZINC000441810642 338419220 /nfs/dbraw/zinc/41/92/20/338419220.db2.gz WWCWZNWAVXEOPX-MRXNPFEDSA-N 1 2 319.408 4.395 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+][C@@H](CO)c1c(F)cccc1F ZINC000442848774 338434405 /nfs/dbraw/zinc/43/44/05/338434405.db2.gz BFASENCKXUQRNZ-ABAIWWIYSA-N 1 2 323.408 4.071 20 0 DIADLO Cc1ccc(NC(=O)COc2ccc(C(C)C)c(C)c2)c(C)[nH+]1 ZINC000446422979 338527785 /nfs/dbraw/zinc/52/77/85/338527785.db2.gz BCFMMTRCVGLVMG-UHFFFAOYSA-N 1 2 312.413 4.148 20 0 DIADLO CCN(c1ccc(C(=O)Nc2ccc(C)[nH+]c2C)cc1)C(C)C ZINC000446439639 338528186 /nfs/dbraw/zinc/52/81/86/338528186.db2.gz ZHZZBFCXDIKEBJ-UHFFFAOYSA-N 1 2 311.429 4.185 20 0 DIADLO Cc1ccc(NC(=O)c2csc3c2CC[C@@H](C)C3)c(C)[nH+]1 ZINC000446439517 338528196 /nfs/dbraw/zinc/52/81/96/338528196.db2.gz SHCCPZJLHRCSKH-SNVBAGLBSA-N 1 2 300.427 4.137 20 0 DIADLO Cc1ccc(NC(=O)N[C@H](C)c2ccc(F)c(C)c2)c(C)[nH+]1 ZINC000447164701 338546675 /nfs/dbraw/zinc/54/66/75/338546675.db2.gz DLHNZKDZCKAXRM-GFCCVEGCSA-N 1 2 301.365 4.029 20 0 DIADLO CCSc1cccc(NC(=O)Nc2ccc(C)[nH+]c2C)c1 ZINC000447186636 338547167 /nfs/dbraw/zinc/54/71/67/338547167.db2.gz YGFHBBYLEILKSM-UHFFFAOYSA-N 1 2 301.415 4.454 20 0 DIADLO Cc1ccc(NC(=O)NC(C)(C)c2cccc(Cl)c2)c(C)[nH+]1 ZINC000447189511 338547292 /nfs/dbraw/zinc/54/72/92/338547292.db2.gz GHYLKJUHAQRICN-UHFFFAOYSA-N 1 2 317.820 4.409 20 0 DIADLO Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000575005653 338550543 /nfs/dbraw/zinc/55/05/43/338550543.db2.gz SCWVAPPAFHDREB-ZDUSSCGKSA-N 1 2 316.449 4.045 20 0 DIADLO COCCC[C@H](C)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000447571483 338557803 /nfs/dbraw/zinc/55/78/03/338557803.db2.gz KIRCCJFKFGUAEE-HNNXBMFYSA-N 1 2 313.445 4.113 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@H](C)c2ccnn2C)c1 ZINC000447603883 338561811 /nfs/dbraw/zinc/56/18/11/338561811.db2.gz ZENGYLVXHJEYEF-OAHLLOKOSA-N 1 2 323.444 4.257 20 0 DIADLO COC[C@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1ccc(F)cc1 ZINC000447939778 338572133 /nfs/dbraw/zinc/57/21/33/338572133.db2.gz GUKKHZJIBRLPAI-AWEZNQCLSA-N 1 2 322.449 4.057 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2cc(Cl)sc2Cl)s1 ZINC000449191119 338600868 /nfs/dbraw/zinc/60/08/68/338600868.db2.gz PCQICAPGDKMVEZ-UHFFFAOYSA-N 1 2 322.286 4.320 20 0 DIADLO C[C@H](Cc1ccoc1)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000449209775 338602588 /nfs/dbraw/zinc/60/25/88/338602588.db2.gz FWSIYUPARLXCLD-OAHLLOKOSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cn(C)nc3C3CCCCC3)cn2c1 ZINC000449371838 338618581 /nfs/dbraw/zinc/61/85/81/338618581.db2.gz ZEPQFIQPNZYQKO-UHFFFAOYSA-N 1 2 323.444 4.036 20 0 DIADLO CCc1ccc(NCc2[nH+]ccn2Cc2ccccc2)cc1OC ZINC000449647814 338644142 /nfs/dbraw/zinc/64/41/42/338644142.db2.gz FFWFVBHLWYGVKF-UHFFFAOYSA-N 1 2 321.424 4.115 20 0 DIADLO Clc1scc(C[NH2+]Cc2cnc(C3CC3)o2)c1Cl ZINC000449705899 338647320 /nfs/dbraw/zinc/64/73/20/338647320.db2.gz LOQMMVGONJVGIH-UHFFFAOYSA-N 1 2 303.214 4.210 20 0 DIADLO FC(F)(F)c1ccc2c(cc[nH+]c2N2CCO[C@@H]3CCC[C@H]32)c1 ZINC000450368707 338680200 /nfs/dbraw/zinc/68/02/00/338680200.db2.gz JHRHMJSGMKQPPA-HUUCEWRRSA-N 1 2 322.330 4.011 20 0 DIADLO FCC1(CNc2cc[nH+]c3c(Cl)cccc23)CCOCC1 ZINC000450731867 338702234 /nfs/dbraw/zinc/70/22/34/338702234.db2.gz BJRZMQFXJZKJQF-UHFFFAOYSA-N 1 2 308.784 4.066 20 0 DIADLO Cc1cccc(Cl)c1C[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000450740786 338702719 /nfs/dbraw/zinc/70/27/19/338702719.db2.gz VIEZOIZFAFCHPL-LLVKDONJSA-N 1 2 307.825 4.180 20 0 DIADLO CCO[C@@H]1CCN(c2cc[nH+]c3cc(F)c(Cl)cc32)C[C@@H]1C ZINC000450749155 338703365 /nfs/dbraw/zinc/70/33/65/338703365.db2.gz WZAQTELFEYUKIK-APPDUMDISA-N 1 2 322.811 4.279 20 0 DIADLO C[C@@H]1C[C@@H](Nc2ncc(C(F)(F)F)cc2Cl)c2[nH+]ccn21 ZINC000450832152 338707520 /nfs/dbraw/zinc/70/75/20/338707520.db2.gz QRUQHWUULHGSHF-GMSGAONNSA-N 1 2 316.714 4.068 20 0 DIADLO Fc1ccc2cc[nH+]c(N3CCC[C@@]4(CCSC4)C3)c2c1 ZINC000450907454 338711868 /nfs/dbraw/zinc/71/18/68/338711868.db2.gz SQWUNNGDJNPYTF-QGZVFWFLSA-N 1 2 302.418 4.097 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1csnn1)c1ccc(F)c2ccccc21 ZINC000451038283 338718822 /nfs/dbraw/zinc/71/88/22/338718822.db2.gz NBRICOIMMFELHJ-MNOVXSKESA-N 1 2 301.390 4.242 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccc(F)c(Cl)c1)C1CC1)c1csnn1 ZINC000451358361 338731102 /nfs/dbraw/zinc/73/11/02/338731102.db2.gz URCTYMLPKXOTSY-RMLUDKJBSA-N 1 2 311.813 4.133 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CNc1ccccc1OCCF ZINC000453139365 338798610 /nfs/dbraw/zinc/79/86/10/338798610.db2.gz MTMGTYCCKKKABI-UHFFFAOYSA-N 1 2 302.393 4.474 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@@H]2CCn3ccnc32)c1 ZINC000453187934 338804774 /nfs/dbraw/zinc/80/47/74/338804774.db2.gz FFOABMVNCRQRHV-QGZVFWFLSA-N 1 2 321.428 4.104 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@H]2CCn3ccnc32)c1 ZINC000453187933 338804791 /nfs/dbraw/zinc/80/47/91/338804791.db2.gz FFOABMVNCRQRHV-KRWDZBQOSA-N 1 2 321.428 4.104 20 0 DIADLO Cc1cc(C)c(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)cc1Br ZINC000453198572 338806689 /nfs/dbraw/zinc/80/66/89/338806689.db2.gz IJPKCQSJPJXGND-BXUZGUMPSA-N 1 2 320.234 4.380 20 0 DIADLO CCCCn1ncc(N[C@@H]2C[C@H](C)n3cc[nH+]c32)c1C(C)C ZINC000453208291 338807966 /nfs/dbraw/zinc/80/79/66/338807966.db2.gz JWANUYPXPHDFIW-UONOGXRCSA-N 1 2 301.438 4.121 20 0 DIADLO CC(C)CCn1ncc(N[C@H]2C[C@H](C)n3cc[nH+]c32)c1C(C)C ZINC000453209004 338808068 /nfs/dbraw/zinc/80/80/68/338808068.db2.gz KXDJLGPQCBHGLS-GJZGRUSLSA-N 1 2 315.465 4.367 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)Nc1cnn(CCC(C)C)c1C(C)C ZINC000453210204 338808213 /nfs/dbraw/zinc/80/82/13/338808213.db2.gz MFLXATNWMVVOMO-HNNXBMFYSA-N 1 2 317.481 4.442 20 0 DIADLO COc1cc(N[C@@H]2C[C@H](C)n3cc[nH+]c32)ccc1C(F)(F)F ZINC000453232375 338811496 /nfs/dbraw/zinc/81/14/96/338811496.db2.gz WXDXATVXBMGFOV-JOYOIKCWSA-N 1 2 311.307 4.028 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1sc(-c2cccnc2)nc1C)C(F)F ZINC000453233118 338811682 /nfs/dbraw/zinc/81/16/82/338811682.db2.gz HDPUXYYVAIIMDI-CABZTGNLSA-N 1 2 311.401 4.208 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+][C@@H](CC)C(F)F)cc1OCC ZINC000453246115 338813671 /nfs/dbraw/zinc/81/36/71/338813671.db2.gz MEMYVXYLEAACTN-YPMHNXCESA-N 1 2 301.377 4.178 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)C(C)(F)F)c1ccc(OCC(F)(F)F)cc1 ZINC000453296095 338820107 /nfs/dbraw/zinc/82/01/07/338820107.db2.gz QVAWWYMZIIUVFM-ZJUUUORDSA-N 1 2 311.294 4.322 20 0 DIADLO Cn1cc(Cl)c(C[NH2+][C@H](c2ccccc2F)C2CCCC2)n1 ZINC000453314645 338823117 /nfs/dbraw/zinc/82/31/17/338823117.db2.gz FVKUKTZGQVWVMP-KRWDZBQOSA-N 1 2 321.827 4.234 20 0 DIADLO Cn1cc(Cl)c(C[NH2+][C@@H](c2ccccc2F)C2CCCC2)n1 ZINC000453314646 338823139 /nfs/dbraw/zinc/82/31/39/338823139.db2.gz FVKUKTZGQVWVMP-QGZVFWFLSA-N 1 2 321.827 4.234 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@H](c1cc(F)ccc1F)C(C)C ZINC000453335900 338826681 /nfs/dbraw/zinc/82/66/81/338826681.db2.gz FBUUUDJYLQDKFS-LRDDRELGSA-N 1 2 307.388 4.229 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1cc(F)ccc1F ZINC000453347702 338828799 /nfs/dbraw/zinc/82/87/99/338828799.db2.gz KXZMUQHKYLIGJW-LYRGGWFBSA-N 1 2 305.372 4.154 20 0 DIADLO CC[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1cc(Cl)ccc1OC ZINC000453361283 338831519 /nfs/dbraw/zinc/83/15/19/338831519.db2.gz QUAJKQKHVQNLCO-BYCMXARLSA-N 1 2 319.836 4.292 20 0 DIADLO COc1ccc([C@H]([NH2+][C@@H](C)c2cnccc2C)c2ccco2)cc1 ZINC000453393678 338837253 /nfs/dbraw/zinc/83/72/53/338837253.db2.gz FSVANMZIVYOANG-YWZLYKJASA-N 1 2 322.408 4.432 20 0 DIADLO CCCCc1ccc(NC(=O)N[C@@H]2C[C@@H](C)n3cc[nH+]c32)cc1 ZINC000454155611 338854788 /nfs/dbraw/zinc/85/47/88/338854788.db2.gz BKNWGXVPTUPOQO-CZUORRHYSA-N 1 2 312.417 4.053 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCc3sccc3[C@@H]2C)c(C)[nH+]1 ZINC000455471363 338895481 /nfs/dbraw/zinc/89/54/81/338895481.db2.gz INYVEFVXCQPADY-ZDUSSCGKSA-N 1 2 315.442 4.220 20 0 DIADLO CCC[C@H](C)[C@H]1CCCN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455507195 338897154 /nfs/dbraw/zinc/89/71/54/338897154.db2.gz YRFSUMHIMZVNQQ-BLLLJJGKSA-N 1 2 303.450 4.439 20 0 DIADLO CC(C)[C@H](CC1CCCCC1)C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456377483 338928169 /nfs/dbraw/zinc/92/81/69/338928169.db2.gz KZGGUUAQVZXIIC-XIRDDKMYSA-N 1 2 317.477 4.248 20 0 DIADLO CC(C)[C@H](CC1CCCCC1)C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000456377477 338928256 /nfs/dbraw/zinc/92/82/56/338928256.db2.gz KZGGUUAQVZXIIC-BHYGNILZSA-N 1 2 317.477 4.248 20 0 DIADLO CC(C)c1ccc(C(=O)N[C@@H]2C[C@H](C)n3cc[nH+]c32)cc1Cl ZINC000456440971 338930157 /nfs/dbraw/zinc/93/01/57/338930157.db2.gz YUGJOHZJCNOYES-XHDPSFHLSA-N 1 2 317.820 4.096 20 0 DIADLO CCCC[C@H](C)N(CCCC)C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000459057532 339012313 /nfs/dbraw/zinc/01/23/13/339012313.db2.gz LAMIBCODSVGAFT-HOTGVXAUSA-N 1 2 322.497 4.354 20 0 DIADLO CCCCCN(C(=O)N[C@@H]1C[C@H](C)n2cc[nH+]c21)[C@H](C)CCC ZINC000459106229 339013810 /nfs/dbraw/zinc/01/38/10/339013810.db2.gz IVDXNBZQIWYTRM-OWCLPIDISA-N 1 2 320.481 4.279 20 0 DIADLO CCCC[C@H](C)N(CCCC)C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000459122918 339014207 /nfs/dbraw/zinc/01/42/07/339014207.db2.gz SYNPMFHLKFKMEM-XHSDSOJGSA-N 1 2 320.481 4.279 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2c(F)cc(C)cc2Cl)on1 ZINC000459317411 339021329 /nfs/dbraw/zinc/02/13/29/339021329.db2.gz BXPSZOVNFDATSA-HNNXBMFYSA-N 1 2 308.784 4.421 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2c(F)cc(C)cc2Cl)on1 ZINC000459317411 339021330 /nfs/dbraw/zinc/02/13/30/339021330.db2.gz BXPSZOVNFDATSA-HNNXBMFYSA-N 1 2 308.784 4.421 20 0 DIADLO CC(C)[C@@H]1C[C@H]1NC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000459395019 339026882 /nfs/dbraw/zinc/02/68/82/339026882.db2.gz AMOSZFDJIMMAPK-DLBZAZTESA-N 1 2 311.385 4.040 20 0 DIADLO c1ccc([C@@H]2[N@H+](Cc3nc(C4CC4)no3)CC23CCCC3)cc1 ZINC000459560497 339035896 /nfs/dbraw/zinc/03/58/96/339035896.db2.gz ALMSOLVTEZYNAC-KRWDZBQOSA-N 1 2 309.413 4.064 20 0 DIADLO c1ccc([C@@H]2[N@@H+](Cc3nc(C4CC4)no3)CC23CCCC3)cc1 ZINC000459560497 339035897 /nfs/dbraw/zinc/03/58/97/339035897.db2.gz ALMSOLVTEZYNAC-KRWDZBQOSA-N 1 2 309.413 4.064 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)o1 ZINC000459567715 339036298 /nfs/dbraw/zinc/03/62/98/339036298.db2.gz AECNHWIYEGIPCR-WMLDXEAASA-N 1 2 311.429 4.310 20 0 DIADLO CCc1nnc([C@H](C)[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)o1 ZINC000459567715 339036299 /nfs/dbraw/zinc/03/62/99/339036299.db2.gz AECNHWIYEGIPCR-WMLDXEAASA-N 1 2 311.429 4.310 20 0 DIADLO CC1(CC(F)(F)F)C[NH+](C/C=C\c2ccc(F)cc2F)C1 ZINC000459637752 339039642 /nfs/dbraw/zinc/03/96/42/339039642.db2.gz LYRJBJSYIBEWTK-IHWYPQMZSA-N 1 2 305.290 4.252 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1c[nH]c(-c2ccccc2)n1 ZINC000459654472 339040649 /nfs/dbraw/zinc/04/06/49/339040649.db2.gz ZRUMYUHXWLUHES-HNNXBMFYSA-N 1 2 321.424 4.245 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000459653439 339040654 /nfs/dbraw/zinc/04/06/54/339040654.db2.gz BZSADPPBGCCHIM-OLZOCXBDSA-N 1 2 317.433 4.096 20 0 DIADLO Cc1nc([C@H](C)[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)no1 ZINC000459744847 339045811 /nfs/dbraw/zinc/04/58/11/339045811.db2.gz MKELKERVYMLGNF-YOEHRIQHSA-N 1 2 311.429 4.446 20 0 DIADLO Cc1nc([C@H](C)[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)no1 ZINC000459744847 339045812 /nfs/dbraw/zinc/04/58/12/339045812.db2.gz MKELKERVYMLGNF-YOEHRIQHSA-N 1 2 311.429 4.446 20 0 DIADLO CC(C)[C@H](CC(=O)Nc1cccc2[nH+]ccn21)c1ccccc1 ZINC000460341684 339055818 /nfs/dbraw/zinc/05/58/18/339055818.db2.gz OTCGCLJFFBFUJI-INIZCTEOSA-N 1 2 307.397 4.103 20 0 DIADLO CC[C@@H](C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1)C1CCC(C)CC1 ZINC000461344952 339062143 /nfs/dbraw/zinc/06/21/43/339062143.db2.gz OJGPXFTYUOVJMD-BHUNQDJPSA-N 1 2 317.477 4.316 20 0 DIADLO CC[C@H](C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1)C1CCC(C)CC1 ZINC000461344954 339062145 /nfs/dbraw/zinc/06/21/45/339062145.db2.gz OJGPXFTYUOVJMD-SJJHQCBESA-N 1 2 317.477 4.316 20 0 DIADLO Cc1cc[nH+]c(NC[C@H]2CCN(c3ccccc3F)C2)c1Cl ZINC000461875255 339067724 /nfs/dbraw/zinc/06/77/24/339067724.db2.gz AQIYGJARZIZVHQ-CYBMUJFWSA-N 1 2 319.811 4.121 20 0 DIADLO Cc1nc(N2CCC(c3cccc(Cl)c3Cl)CC2)cc[nH+]1 ZINC000461981019 339070382 /nfs/dbraw/zinc/07/03/82/339070382.db2.gz FRMHIUYJNPHFBE-UHFFFAOYSA-N 1 2 322.239 4.476 20 0 DIADLO Cc1cc(N2CCC(c3cccc(Cl)c3Cl)CC2)nc[nH+]1 ZINC000461987939 339070492 /nfs/dbraw/zinc/07/04/92/339070492.db2.gz LBIIQSDEJDSXPT-UHFFFAOYSA-N 1 2 322.239 4.476 20 0 DIADLO FC(F)(F)Cn1cc[nH+]c1CNc1ccc(Cl)cc1Cl ZINC000462212711 339074241 /nfs/dbraw/zinc/07/42/41/339074241.db2.gz VPMVMJVBFILQHP-UHFFFAOYSA-N 1 2 324.133 4.364 20 0 DIADLO COC(=O)[C@@H]([NH2+][C@H](C)c1ccc(Cl)c2ccccc21)C1CC1 ZINC000462352651 339076337 /nfs/dbraw/zinc/07/63/37/339076337.db2.gz AULHHLXYRSEDMU-DIFFPNOSSA-N 1 2 317.816 4.095 20 0 DIADLO c1ccc(COc2ccc[nH+]c2N[C@@H]2CCO[C@H](C3CC3)C2)cc1 ZINC000462689882 339084212 /nfs/dbraw/zinc/08/42/12/339084212.db2.gz FWYJQYPFLGZZBI-MJGOQNOKSA-N 1 2 324.424 4.030 20 0 DIADLO Cc1nc(N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cc[nH+]1 ZINC000462779791 339088170 /nfs/dbraw/zinc/08/81/70/339088170.db2.gz UZDKWKYUBXCIET-CQSZACIVSA-N 1 2 308.212 4.433 20 0 DIADLO FC(F)(F)[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccccc1 ZINC000462800126 339089703 /nfs/dbraw/zinc/08/97/03/339089703.db2.gz CMIUQDPHOZAYJZ-INIZCTEOSA-N 1 2 321.346 4.397 20 0 DIADLO CCCOc1cc(C)ccc1C[NH2+][C@H](C)c1csc(C)n1 ZINC000462805559 339090077 /nfs/dbraw/zinc/09/00/77/339090077.db2.gz VDZGMLVMAWLLIE-CYBMUJFWSA-N 1 2 304.459 4.400 20 0 DIADLO CCc1cc(N2CCC[C@](C)(CC)C2)nc(-c2ccncc2)[nH+]1 ZINC000462959729 339099087 /nfs/dbraw/zinc/09/90/87/339099087.db2.gz WIAVKKODQSGXKZ-IBGZPJMESA-N 1 2 310.445 4.118 20 0 DIADLO C[C@H](CC(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1)C(C)(C)C ZINC000463031251 339101893 /nfs/dbraw/zinc/10/18/93/339101893.db2.gz FMELWQVNBPURFL-CABCVRRESA-N 1 2 322.518 4.026 20 0 DIADLO C[C@@H](c1ccsc1)[NH+]1CCN(C(=O)CCCC(C)(C)C)CC1 ZINC000463032800 339101971 /nfs/dbraw/zinc/10/19/71/339101971.db2.gz IICNLLSOHHZGJL-HNNXBMFYSA-N 1 2 322.518 4.170 20 0 DIADLO CCCC[C@H](CC)C(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000463033910 339101988 /nfs/dbraw/zinc/10/19/88/339101988.db2.gz CUJZQWGZUKHOSH-CVEARBPZSA-N 1 2 322.518 4.170 20 0 DIADLO c1nn(-c2ccccc2)c2nc[nH+]c(SCC3CCCC3)c12 ZINC000463042819 339102805 /nfs/dbraw/zinc/10/28/05/339102805.db2.gz LKRTVCOCUIJPHG-UHFFFAOYSA-N 1 2 310.426 4.098 20 0 DIADLO Cc1cc(N2C[C@@H](C)C[C@H]2c2ccccc2F)nc(C2CC2)[nH+]1 ZINC000463088916 339105350 /nfs/dbraw/zinc/10/53/50/339105350.db2.gz YZHLFEINVZYPFR-SJCJKPOMSA-N 1 2 311.404 4.389 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463415847 339116935 /nfs/dbraw/zinc/11/69/35/339116935.db2.gz RJAFAMJZPUZMQQ-GFCCVEGCSA-N 1 2 315.363 4.279 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463415847 339116936 /nfs/dbraw/zinc/11/69/36/339116936.db2.gz RJAFAMJZPUZMQQ-GFCCVEGCSA-N 1 2 315.363 4.279 20 0 DIADLO Cc1nc(N2CCc3cc(Cl)c(Cl)cc3[C@@H]2C)cc[nH+]1 ZINC000463476009 339119092 /nfs/dbraw/zinc/11/90/92/339119092.db2.gz NGUGAMNPKXQXJG-VIFPVBQESA-N 1 2 308.212 4.216 20 0 DIADLO CC(C)c1nc(N2CCc3c(F)cc(F)cc3[C@H]2C)cc[nH+]1 ZINC000463496115 339119552 /nfs/dbraw/zinc/11/95/52/339119552.db2.gz KQPGKXGZLLPBLK-LLVKDONJSA-N 1 2 303.356 4.002 20 0 DIADLO Cc1cn2cc(NC(=O)[C@H](c3ccccc3)C(C)C)ccc2[nH+]1 ZINC000463614068 339122781 /nfs/dbraw/zinc/12/27/81/339122781.db2.gz RLFHFHVXLXWILI-SFHVURJKSA-N 1 2 307.397 4.021 20 0 DIADLO Cc1cc(Cl)ccc1C[NH2+]Cc1ncc(-c2ccccc2)cn1 ZINC000463742238 339125315 /nfs/dbraw/zinc/12/53/15/339125315.db2.gz VMHJHBUTPLJSQA-UHFFFAOYSA-N 1 2 323.827 4.395 20 0 DIADLO CC[C@H](C)C[C@@H](C)NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000463912472 339128871 /nfs/dbraw/zinc/12/88/71/339128871.db2.gz AKAAIHVSPJKOHA-LSDHHAIUSA-N 1 2 312.413 4.428 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCCC3(C2)CCCCCC3)no1 ZINC000464762099 339151522 /nfs/dbraw/zinc/15/15/22/339151522.db2.gz SODFUHIBLSOMFL-UHFFFAOYSA-N 1 2 305.466 4.349 20 0 DIADLO CCCCc1nc(C[N@H+]2CCCC3(C2)CCCCCC3)no1 ZINC000464762099 339151523 /nfs/dbraw/zinc/15/15/23/339151523.db2.gz SODFUHIBLSOMFL-UHFFFAOYSA-N 1 2 305.466 4.349 20 0 DIADLO CC(C)[C@@H]1C[N@H+](Cc2csc(C3CCCC3)n2)CCS1 ZINC000464769662 339152084 /nfs/dbraw/zinc/15/20/84/339152084.db2.gz ISKNMUIEPCZNAZ-HNNXBMFYSA-N 1 2 310.532 4.374 20 0 DIADLO CC(C)[C@@H]1C[N@@H+](Cc2csc(C3CCCC3)n2)CCS1 ZINC000464769662 339152085 /nfs/dbraw/zinc/15/20/85/339152085.db2.gz ISKNMUIEPCZNAZ-HNNXBMFYSA-N 1 2 310.532 4.374 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2)[C@@H](c2ccccc2)CO1 ZINC000464826267 339155467 /nfs/dbraw/zinc/15/54/67/339155467.db2.gz ZJKJUTUHDJFGQR-RDTXWAMCSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2)[C@@H](c2ccccc2)CO1 ZINC000464826267 339155468 /nfs/dbraw/zinc/15/54/68/339155468.db2.gz ZJKJUTUHDJFGQR-RDTXWAMCSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccn(-c3ccccc3)n2)[C@@H](c2ccco2)C1 ZINC000464847457 339157355 /nfs/dbraw/zinc/15/73/55/339157355.db2.gz FKVIBBGIPXOKBN-VQIMIIECSA-N 1 2 321.424 4.439 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccn(-c3ccccc3)n2)[C@@H](c2ccco2)C1 ZINC000464847457 339157356 /nfs/dbraw/zinc/15/73/56/339157356.db2.gz FKVIBBGIPXOKBN-VQIMIIECSA-N 1 2 321.424 4.439 20 0 DIADLO CCCCc1nc(C[N@H+](C)CCOCc2ccccc2)cs1 ZINC000464847228 339157399 /nfs/dbraw/zinc/15/73/99/339157399.db2.gz DXXXLKACPNTKJE-UHFFFAOYSA-N 1 2 318.486 4.134 20 0 DIADLO CCCCc1nc(C[N@@H+](C)CCOCc2ccccc2)cs1 ZINC000464847228 339157400 /nfs/dbraw/zinc/15/74/00/339157400.db2.gz DXXXLKACPNTKJE-UHFFFAOYSA-N 1 2 318.486 4.134 20 0 DIADLO CCc1ccc(-c2ccc(C[NH2+][C@@H](C)c3nc(C)no3)o2)cc1 ZINC000465000367 339165154 /nfs/dbraw/zinc/16/51/54/339165154.db2.gz BNLBNGRNUSSMCZ-LBPRGKRZSA-N 1 2 311.385 4.051 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000465462777 339177543 /nfs/dbraw/zinc/17/75/43/339177543.db2.gz JDPKMLDCFOVMKD-SNVBAGLBSA-N 1 2 323.223 4.115 20 0 DIADLO COc1cccc2c(NCc3cccc4cc[nH]c43)cc[nH+]c12 ZINC000466399283 339202550 /nfs/dbraw/zinc/20/25/50/339202550.db2.gz MSESGTYKGJQLMG-UHFFFAOYSA-N 1 2 303.365 4.337 20 0 DIADLO COc1cc(C)nc(CNc2ccc(-c3ccccc3)c[nH+]2)c1 ZINC000466624251 339210747 /nfs/dbraw/zinc/21/07/47/339210747.db2.gz CXIRZGNWQOIYPB-UHFFFAOYSA-N 1 2 305.381 4.073 20 0 DIADLO Cc1cc(NC[C@@]2(C)CCO[C@H]2C2CC2)c2cccc(F)c2[nH+]1 ZINC000466630783 339211034 /nfs/dbraw/zinc/21/10/34/339211034.db2.gz KMIXRWIIRNVZTR-RBUKOAKNSA-N 1 2 314.404 4.299 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1COc1cnc2ccccc2c1 ZINC000466831677 339218635 /nfs/dbraw/zinc/21/86/35/339218635.db2.gz OMRIVXBYFMNWGG-UHFFFAOYSA-N 1 2 315.376 4.059 20 0 DIADLO C[N@H+](Cc1nc2ccc(F)cc2o1)Cc1ccc(F)cc1Cl ZINC000466961447 339222814 /nfs/dbraw/zinc/22/28/14/339222814.db2.gz KUBJEXNCQQVZAL-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO C[N@@H+](Cc1nc2ccc(F)cc2o1)Cc1ccc(F)cc1Cl ZINC000466961447 339222815 /nfs/dbraw/zinc/22/28/15/339222815.db2.gz KUBJEXNCQQVZAL-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO FC(F)(F)CCCC[N@@H+]1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000467194930 339227801 /nfs/dbraw/zinc/22/78/01/339227801.db2.gz LDIJOOLWPYRAEO-CQSZACIVSA-N 1 2 321.770 4.446 20 0 DIADLO FC(F)(F)CCCC[N@H+]1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000467194930 339227802 /nfs/dbraw/zinc/22/78/02/339227802.db2.gz LDIJOOLWPYRAEO-CQSZACIVSA-N 1 2 321.770 4.446 20 0 DIADLO Clc1cccc([C@@H]2C[N@H+](CCCc3ccsc3)CCO2)c1 ZINC000467194204 339227811 /nfs/dbraw/zinc/22/78/11/339227811.db2.gz CDAXOBLJMJPFSZ-KRWDZBQOSA-N 1 2 321.873 4.408 20 0 DIADLO Clc1cccc([C@@H]2C[N@@H+](CCCc3ccsc3)CCO2)c1 ZINC000467194204 339227812 /nfs/dbraw/zinc/22/78/12/339227812.db2.gz CDAXOBLJMJPFSZ-KRWDZBQOSA-N 1 2 321.873 4.408 20 0 DIADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@H](Nc2cccc3c2OCO3)C1 ZINC000467355015 339233710 /nfs/dbraw/zinc/23/37/10/339233710.db2.gz ORBHQSIROVFPQR-CABCVRRESA-N 1 2 310.397 4.257 20 0 DIADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@H](Nc2cccc3c2OCCO3)C1 ZINC000467354972 339233729 /nfs/dbraw/zinc/23/37/29/339233729.db2.gz NKVFLISQEDNYTM-CVEARBPZSA-N 1 2 324.424 4.300 20 0 DIADLO CC[C@@H]1CCCC[C@H]1N(C)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000467469951 339239968 /nfs/dbraw/zinc/23/99/68/339239968.db2.gz ZYDKJYWWTWVKEZ-GDBMZVCRSA-N 1 2 314.433 4.075 20 0 DIADLO CC(C)=CCN(Cc1[nH+]ccn1C)Cc1ccc(Cl)cc1 ZINC000467554885 339242571 /nfs/dbraw/zinc/24/25/71/339242571.db2.gz RRGVQIZDTZFPOA-UHFFFAOYSA-N 1 2 303.837 4.042 20 0 DIADLO CC(C)=CC[N@@H+](Cc1nccn1C)Cc1ccc(Cl)cc1 ZINC000467554885 339242572 /nfs/dbraw/zinc/24/25/72/339242572.db2.gz RRGVQIZDTZFPOA-UHFFFAOYSA-N 1 2 303.837 4.042 20 0 DIADLO CC(C)=CC[N@H+](Cc1nccn1C)Cc1ccc(Cl)cc1 ZINC000467554885 339242573 /nfs/dbraw/zinc/24/25/73/339242573.db2.gz RRGVQIZDTZFPOA-UHFFFAOYSA-N 1 2 303.837 4.042 20 0 DIADLO CCCCc1nc(COc2cccc(-n3cc[nH+]c3)c2)cs1 ZINC000467790863 339246785 /nfs/dbraw/zinc/24/67/85/339246785.db2.gz VOXSPLHYCWOZBG-UHFFFAOYSA-N 1 2 313.426 4.250 20 0 DIADLO CC(C)Oc1cccc(COc2cccc(-n3cc[nH+]c3)c2)c1 ZINC000467801093 339246853 /nfs/dbraw/zinc/24/68/53/339246853.db2.gz XZTLDCNYVYJXGH-UHFFFAOYSA-N 1 2 308.381 4.239 20 0 DIADLO Fc1ccccc1SCC[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000468126914 339254881 /nfs/dbraw/zinc/25/48/81/339254881.db2.gz OPBQTZRHBCENDX-HNNXBMFYSA-N 1 2 323.458 4.053 20 0 DIADLO Fc1ccccc1SCC[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000468126914 339254882 /nfs/dbraw/zinc/25/48/82/339254882.db2.gz OPBQTZRHBCENDX-HNNXBMFYSA-N 1 2 323.458 4.053 20 0 DIADLO Cc1cccc(C[NH2+]Cc2ccc(Cl)o2)c1Br ZINC000468591370 339266915 /nfs/dbraw/zinc/26/69/15/339266915.db2.gz QURBBSJFPYVMLF-UHFFFAOYSA-N 1 2 314.610 4.294 20 0 DIADLO CC(=O)c1ccc(OCc2ccc3[nH]c(C)[nH+]c3c2)c(Cl)c1 ZINC000468983577 339276752 /nfs/dbraw/zinc/27/67/52/339276752.db2.gz OYFXJFMHENJYQM-UHFFFAOYSA-N 1 2 314.772 4.306 20 0 DIADLO CC(=O)c1ccc(OCc2ccc3[nH+]c(C)[nH]c3c2)c(Cl)c1 ZINC000468983577 339276753 /nfs/dbraw/zinc/27/67/53/339276753.db2.gz OYFXJFMHENJYQM-UHFFFAOYSA-N 1 2 314.772 4.306 20 0 DIADLO C[C@@H]([N@H+](Cc1noc(C2CC2)n1)Cc1ccccc1)C(C)(C)C ZINC000469447089 339289673 /nfs/dbraw/zinc/28/96/73/339289673.db2.gz XSCSCJVAMXPBSB-CQSZACIVSA-N 1 2 313.445 4.384 20 0 DIADLO C[C@@H]([N@@H+](Cc1noc(C2CC2)n1)Cc1ccccc1)C(C)(C)C ZINC000469447089 339289674 /nfs/dbraw/zinc/28/96/74/339289674.db2.gz XSCSCJVAMXPBSB-CQSZACIVSA-N 1 2 313.445 4.384 20 0 DIADLO Fc1c(Cl)cccc1CNc1[nH+]cccc1OC(F)F ZINC000469470446 339290684 /nfs/dbraw/zinc/29/06/84/339290684.db2.gz KJBVWZVTGWSOMB-UHFFFAOYSA-N 1 2 302.683 4.088 20 0 DIADLO C[C@@H]1c2cc(Cl)c(Cl)cc2CC[N@H+]1CCOCC(F)F ZINC000469714134 339296151 /nfs/dbraw/zinc/29/61/51/339296151.db2.gz TXJPGQXTDICXFM-SECBINFHSA-N 1 2 324.198 4.194 20 0 DIADLO C[C@@H]1c2cc(Cl)c(Cl)cc2CC[N@@H+]1CCOCC(F)F ZINC000469714134 339296152 /nfs/dbraw/zinc/29/61/52/339296152.db2.gz TXJPGQXTDICXFM-SECBINFHSA-N 1 2 324.198 4.194 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1csc(C(C)C)n1)c1ccc(F)cc1 ZINC000469773052 339298646 /nfs/dbraw/zinc/29/86/46/339298646.db2.gz UKGLMNOJVJQIFP-IUODEOHRSA-N 1 2 322.449 4.444 20 0 DIADLO C[C@@H]1C[N@H+](CCO[C@@H]2CCCC[C@H]2C)C[C@H](c2ccsc2)O1 ZINC000470200038 339314045 /nfs/dbraw/zinc/31/40/45/339314045.db2.gz IVZLLPWFLIHYEW-JOCBIADPSA-N 1 2 323.502 4.105 20 0 DIADLO C[C@@H]1C[N@@H+](CCO[C@@H]2CCCC[C@H]2C)C[C@H](c2ccsc2)O1 ZINC000470200038 339314046 /nfs/dbraw/zinc/31/40/46/339314046.db2.gz IVZLLPWFLIHYEW-JOCBIADPSA-N 1 2 323.502 4.105 20 0 DIADLO CC(C)(C)[C@H]1CN(C(=O)c2ccc3[nH+]ccn3c2)c2ccccc21 ZINC000470308311 339316856 /nfs/dbraw/zinc/31/68/56/339316856.db2.gz LYLKWQVAJFDWKQ-INIZCTEOSA-N 1 2 319.408 4.124 20 0 DIADLO C[C@H](CCc1ccc(Cl)s1)[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC000470328728 339317397 /nfs/dbraw/zinc/31/73/97/339317397.db2.gz RJMLRZFSFXSTFH-GHMZBOCLSA-N 1 2 317.882 4.042 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCC[N@@H+]2Cc2cc[nH]n2)c1 ZINC000470548304 339321906 /nfs/dbraw/zinc/32/19/06/339321906.db2.gz RTSBNHBEWKKGBZ-OAHLLOKOSA-N 1 2 309.335 4.156 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCC[N@H+]2Cc2cc[nH]n2)c1 ZINC000470548304 339321907 /nfs/dbraw/zinc/32/19/07/339321907.db2.gz RTSBNHBEWKKGBZ-OAHLLOKOSA-N 1 2 309.335 4.156 20 0 DIADLO CC[C@@H](NC(=O)c1ccc(C2CCCCC2)cc1)c1[nH]cc[nH+]1 ZINC000470701115 339325313 /nfs/dbraw/zinc/32/53/13/339325313.db2.gz KXOAYYQCFKEFNL-QGZVFWFLSA-N 1 2 311.429 4.339 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@@H+]1C[C@@H](C)O[C@H](C2CC2)C1 ZINC000470910540 339331046 /nfs/dbraw/zinc/33/10/46/339331046.db2.gz ILBUEQUHIXZHQM-WQGACYEGSA-N 1 2 324.262 4.009 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@H+]1C[C@@H](C)O[C@H](C2CC2)C1 ZINC000470910540 339331047 /nfs/dbraw/zinc/33/10/47/339331047.db2.gz ILBUEQUHIXZHQM-WQGACYEGSA-N 1 2 324.262 4.009 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)cs1 ZINC000470946899 339332240 /nfs/dbraw/zinc/33/22/40/339332240.db2.gz GZAXCCUHWFLGLT-ZYHUDNBSSA-N 1 2 306.397 4.258 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)cs1 ZINC000470946899 339332241 /nfs/dbraw/zinc/33/22/41/339332241.db2.gz GZAXCCUHWFLGLT-ZYHUDNBSSA-N 1 2 306.397 4.258 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1csc(-c2ccoc2)n1 ZINC000470954388 339332685 /nfs/dbraw/zinc/33/26/85/339332685.db2.gz YQNHZUYFSMYXEA-SKDRFNHKSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1csc(-c2ccoc2)n1 ZINC000470954388 339332686 /nfs/dbraw/zinc/33/26/86/339332686.db2.gz YQNHZUYFSMYXEA-SKDRFNHKSA-N 1 2 316.348 4.176 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1nc2cc(F)ccc2o1 ZINC000471003759 339334280 /nfs/dbraw/zinc/33/42/80/339334280.db2.gz FUGCSDPBNYKIAT-UHFFFAOYSA-N 1 2 316.401 4.321 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1nc2cc(F)ccc2o1 ZINC000471003759 339334281 /nfs/dbraw/zinc/33/42/81/339334281.db2.gz FUGCSDPBNYKIAT-UHFFFAOYSA-N 1 2 316.401 4.321 20 0 DIADLO COc1ccc(-c2nc(C[N@@H+]3CC[C@@H]3c3ccccc3)co2)cc1 ZINC000471172823 339339452 /nfs/dbraw/zinc/33/94/52/339339452.db2.gz JTKLMFDTRUFCJE-LJQANCHMSA-N 1 2 320.392 4.297 20 0 DIADLO COc1ccc(-c2nc(C[N@H+]3CC[C@@H]3c3ccccc3)co2)cc1 ZINC000471172823 339339453 /nfs/dbraw/zinc/33/94/53/339339453.db2.gz JTKLMFDTRUFCJE-LJQANCHMSA-N 1 2 320.392 4.297 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000471174907 339339475 /nfs/dbraw/zinc/33/94/75/339339475.db2.gz AXLQGXDUXWYHRX-KRWDZBQOSA-N 1 2 309.388 4.142 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000471174907 339339476 /nfs/dbraw/zinc/33/94/76/339339476.db2.gz AXLQGXDUXWYHRX-KRWDZBQOSA-N 1 2 309.388 4.142 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+]2CC[C@H]2c2ccccc2)o1 ZINC000471178575 339339684 /nfs/dbraw/zinc/33/96/84/339339684.db2.gz OLUSTJHSXFORFW-KRWDZBQOSA-N 1 2 308.356 4.428 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+]2CC[C@H]2c2ccccc2)o1 ZINC000471178575 339339685 /nfs/dbraw/zinc/33/96/85/339339685.db2.gz OLUSTJHSXFORFW-KRWDZBQOSA-N 1 2 308.356 4.428 20 0 DIADLO COc1cccc(C=C2CCN(c3cc[nH+]c(C4CC4)n3)CC2)c1 ZINC000471743253 339352914 /nfs/dbraw/zinc/35/29/14/339352914.db2.gz BYVNKCSQRMCRFN-UHFFFAOYSA-N 1 2 321.424 4.046 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3[nH]c(C)cc3C)cc2[nH+]1 ZINC000471762567 339353360 /nfs/dbraw/zinc/35/33/60/339353360.db2.gz XGKUARPQBKAUAA-UHFFFAOYSA-N 1 2 310.401 4.103 20 0 DIADLO Cn1ccc2cccc(NCc3c[nH+]c4ccc(Cl)cn34)c21 ZINC000471803773 339354705 /nfs/dbraw/zinc/35/47/05/339354705.db2.gz JGVSVFPQIMIWHD-UHFFFAOYSA-N 1 2 310.788 4.092 20 0 DIADLO Cn1ccc2cccc(NCc3cc(-n4cc[nH+]c4)cs3)c21 ZINC000471807636 339354855 /nfs/dbraw/zinc/35/48/55/339354855.db2.gz BQTHJCVJYKKCRP-UHFFFAOYSA-N 1 2 308.410 4.038 20 0 DIADLO CCCCOc1cccc(C[NH2+]Cc2ncc(Cl)s2)c1 ZINC000472071704 339362307 /nfs/dbraw/zinc/36/23/07/339362307.db2.gz BBNYOTHZOWQKTM-UHFFFAOYSA-N 1 2 310.850 4.265 20 0 DIADLO Cc1ccc(NC(=O)C2(CCOCc3ccccc3)CC2)c(C)[nH+]1 ZINC000472342185 339370231 /nfs/dbraw/zinc/37/02/31/339370231.db2.gz YYZNKYVWASARSA-UHFFFAOYSA-N 1 2 324.424 4.024 20 0 DIADLO Cc1ccccc1-c1nc(C[N@@H+]2CCc3ccccc3[C@@H]2C)no1 ZINC000472567613 339374040 /nfs/dbraw/zinc/37/40/40/339374040.db2.gz CVGSAUHXTQQUNE-HNNXBMFYSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1ccccc1-c1nc(C[N@H+]2CCc3ccccc3[C@@H]2C)no1 ZINC000472567613 339374041 /nfs/dbraw/zinc/37/40/41/339374041.db2.gz CVGSAUHXTQQUNE-HNNXBMFYSA-N 1 2 319.408 4.164 20 0 DIADLO CC[N@H+](Cc1ncc(Cl)s1)[C@H](C)c1cccc(OC)c1 ZINC000473130684 339381762 /nfs/dbraw/zinc/38/17/62/339381762.db2.gz CSBKLPIWDHETIQ-LLVKDONJSA-N 1 2 310.850 4.388 20 0 DIADLO CC[N@@H+](Cc1ncc(Cl)s1)[C@H](C)c1cccc(OC)c1 ZINC000473130684 339381763 /nfs/dbraw/zinc/38/17/63/339381763.db2.gz CSBKLPIWDHETIQ-LLVKDONJSA-N 1 2 310.850 4.388 20 0 DIADLO CCn1nc(C[N@H+](C)[C@H](C)c2ccccc2F)c2ccccc21 ZINC000473137890 339381910 /nfs/dbraw/zinc/38/19/10/339381910.db2.gz JLCIEBIZIPOXQT-CQSZACIVSA-N 1 2 311.404 4.388 20 0 DIADLO CCn1nc(C[N@@H+](C)[C@H](C)c2ccccc2F)c2ccccc21 ZINC000473137890 339381911 /nfs/dbraw/zinc/38/19/11/339381911.db2.gz JLCIEBIZIPOXQT-CQSZACIVSA-N 1 2 311.404 4.388 20 0 DIADLO Fc1cccc(C[C@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)c1 ZINC000473136798 339381930 /nfs/dbraw/zinc/38/19/30/339381930.db2.gz ACNLFLKOCXLCQW-CYBMUJFWSA-N 1 2 310.825 4.143 20 0 DIADLO Fc1cccc(C[C@H]2CCC[N@H+]2Cc2ncc(Cl)s2)c1 ZINC000473136798 339381931 /nfs/dbraw/zinc/38/19/31/339381931.db2.gz ACNLFLKOCXLCQW-CYBMUJFWSA-N 1 2 310.825 4.143 20 0 DIADLO Clc1cnc(C[N@@H+]2CCC[C@@H](Cc3ccccc3)C2)s1 ZINC000473137366 339382029 /nfs/dbraw/zinc/38/20/29/339382029.db2.gz HNSRHIBUSAPZTE-AWEZNQCLSA-N 1 2 306.862 4.251 20 0 DIADLO Clc1cnc(C[N@H+]2CCC[C@@H](Cc3ccccc3)C2)s1 ZINC000473137366 339382030 /nfs/dbraw/zinc/38/20/30/339382030.db2.gz HNSRHIBUSAPZTE-AWEZNQCLSA-N 1 2 306.862 4.251 20 0 DIADLO CC1(c2ccccc2)CC[NH+](Cc2ncc(Cl)s2)CC1 ZINC000473143292 339382466 /nfs/dbraw/zinc/38/24/66/339382466.db2.gz XAPRAMTWBFRVBQ-UHFFFAOYSA-N 1 2 306.862 4.350 20 0 DIADLO Fc1cccc(CC2CC[NH+](Cc3ncc(Cl)s3)CC2)c1 ZINC000473142911 339382544 /nfs/dbraw/zinc/38/25/44/339382544.db2.gz RUVFREYUVFPVMN-UHFFFAOYSA-N 1 2 324.852 4.390 20 0 DIADLO CCn1nc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)c2ccccc21 ZINC000473151783 339383234 /nfs/dbraw/zinc/38/32/34/339383234.db2.gz VJBOQDUNJFRBPA-AWEZNQCLSA-N 1 2 309.413 4.375 20 0 DIADLO CCn1nc(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)c2ccccc21 ZINC000473151783 339383235 /nfs/dbraw/zinc/38/32/35/339383235.db2.gz VJBOQDUNJFRBPA-AWEZNQCLSA-N 1 2 309.413 4.375 20 0 DIADLO CCc1[nH+]c(C)ccc1OCc1coc(-c2cccc(F)c2)n1 ZINC000473677072 339390195 /nfs/dbraw/zinc/39/01/95/339390195.db2.gz NAXZXBZFXVKIQF-UHFFFAOYSA-N 1 2 312.344 4.326 20 0 DIADLO CCc1[nH+]c(C)ccc1OCc1coc(-c2ccc(OC)cc2)n1 ZINC000473681096 339390323 /nfs/dbraw/zinc/39/03/23/339390323.db2.gz WNJQASXHWIOJPN-UHFFFAOYSA-N 1 2 324.380 4.195 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000473999339 339396724 /nfs/dbraw/zinc/39/67/24/339396724.db2.gz HXUBRAUERTZDQM-WFASDCNBSA-N 1 2 311.381 4.448 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000473999332 339396733 /nfs/dbraw/zinc/39/67/33/339396733.db2.gz HXUBRAUERTZDQM-DOMZBBRYSA-N 1 2 311.381 4.448 20 0 DIADLO CSCCc1ccc(NCCCc2ccc(C)[nH+]c2)cc1 ZINC000474402172 339412703 /nfs/dbraw/zinc/41/27/03/339412703.db2.gz JKVWFJMTVMLBBR-UHFFFAOYSA-N 1 2 300.471 4.340 20 0 DIADLO CCc1cccc(F)c1C[NH2+]Cc1nc(C(F)(F)F)cs1 ZINC000474819524 339428227 /nfs/dbraw/zinc/42/82/27/339428227.db2.gz OUIKOZCJBKCXOO-UHFFFAOYSA-N 1 2 318.339 4.153 20 0 DIADLO COc1ccc([C@H](C)[C@@H](C)Nc2c[nH+]cc(C)c2)cc1OC ZINC000474894645 339430315 /nfs/dbraw/zinc/43/03/15/339430315.db2.gz IWGQJYIDTGNBOM-ZIAGYGMSSA-N 1 2 300.402 4.011 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@@H](C)c2cc3cccc(F)c3o2)n1 ZINC000475704522 339460017 /nfs/dbraw/zinc/46/00/17/339460017.db2.gz HHYKRQSBOQKYNL-NSHDSACASA-N 1 2 317.364 4.004 20 0 DIADLO CCC(CC)CN(CC)C(=O)CCn1c(C)[nH+]c2ccccc21 ZINC000475991796 339466998 /nfs/dbraw/zinc/46/69/98/339466998.db2.gz SKNJSHYHSGQHLD-UHFFFAOYSA-N 1 2 315.461 4.020 20 0 DIADLO Cc1ccccc1CCC(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000477976591 339506654 /nfs/dbraw/zinc/50/66/54/339506654.db2.gz PIBZDVFNUAJCJB-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO CC(C)(C)c1nn(Cc2ccccc2)cc1CNc1cccc[nH+]1 ZINC000478293075 339512764 /nfs/dbraw/zinc/51/27/64/339512764.db2.gz YRRZKNUYMVASAE-UHFFFAOYSA-N 1 2 320.440 4.236 20 0 DIADLO CC[C@H](C)CC(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000478667301 339520317 /nfs/dbraw/zinc/52/03/17/339520317.db2.gz JSNBIMRTWNPILE-AWEZNQCLSA-N 1 2 311.429 4.261 20 0 DIADLO CSc1ccc(CSCc2cn3ccccc3[nH+]2)cc1 ZINC000478737279 339521464 /nfs/dbraw/zinc/52/14/64/339521464.db2.gz ZYFYKVRMBNUKDK-UHFFFAOYSA-N 1 2 300.452 4.490 20 0 DIADLO Cc1csc(C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)c1Cl ZINC000480147131 339560574 /nfs/dbraw/zinc/56/05/74/339560574.db2.gz KPYLSUSSWXEFHP-UHFFFAOYSA-N 1 2 317.801 4.352 20 0 DIADLO CCN(C)c1ccc(CNc2ccc(F)cc2OC(C)C)c[nH+]1 ZINC000480265397 339566144 /nfs/dbraw/zinc/56/61/44/339566144.db2.gz MTZCRRQJSRLZCJ-UHFFFAOYSA-N 1 2 317.408 4.076 20 0 DIADLO COc1c(Cl)cccc1NCc1ccc(N(C)C(C)C)[nH+]c1 ZINC000480277990 339566924 /nfs/dbraw/zinc/56/69/24/339566924.db2.gz LPDGKCJOSDIYBC-UHFFFAOYSA-N 1 2 319.836 4.200 20 0 DIADLO Cc1cc(N2CCC[C@H]2C2CCCCC2)nc(-c2ccncc2)[nH+]1 ZINC000480410166 339572478 /nfs/dbraw/zinc/57/24/78/339572478.db2.gz ZHYYEKGVWPXVGF-SFHVURJKSA-N 1 2 322.456 4.396 20 0 DIADLO COc1cccc2c(N3CC[C@H](C(F)(F)F)[C@@H]3C)cc[nH+]c12 ZINC000480547695 339576880 /nfs/dbraw/zinc/57/68/80/339576880.db2.gz CUHBLDOAVGNREF-JQWIXIFHSA-N 1 2 310.319 4.021 20 0 DIADLO Cc1cc(N2CC[C@H](C(F)(F)F)[C@@H]2C)c2cccc(F)c2[nH+]1 ZINC000480561379 339577778 /nfs/dbraw/zinc/57/77/78/339577778.db2.gz YLFCCIGBSKHDGP-JQWIXIFHSA-N 1 2 312.310 4.459 20 0 DIADLO CCSc1ccc(C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)cc1 ZINC000480594121 339578793 /nfs/dbraw/zinc/57/87/93/339578793.db2.gz HCOBDSDTCLZCPH-UHFFFAOYSA-N 1 2 323.421 4.441 20 0 DIADLO Cc1ccc(C(C)(C)C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000482541095 339635243 /nfs/dbraw/zinc/63/52/43/339635243.db2.gz CJGWRWZJDPKOHK-UHFFFAOYSA-N 1 2 319.408 4.097 20 0 DIADLO CN(CC(C)(C)C)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000485352933 339701718 /nfs/dbraw/zinc/70/17/18/339701718.db2.gz XGIWHMQPBACPHH-UHFFFAOYSA-N 1 2 313.401 4.384 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1 ZINC000485435242 339703319 /nfs/dbraw/zinc/70/33/19/339703319.db2.gz UMSJGLQLEXVYQX-MSOLQXFVSA-N 1 2 323.440 4.231 20 0 DIADLO CC[C@H]1C[C@]1(NC(=O)Nc1c(C)cc[nH+]c1C)c1cccc(C)c1 ZINC000485494278 339704477 /nfs/dbraw/zinc/70/44/77/339704477.db2.gz IOPCEKBULUYUEX-OXJNMPFZSA-N 1 2 323.440 4.454 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1C[C@H](C)CC[C@H]1C(C)C ZINC000485499927 339704620 /nfs/dbraw/zinc/70/46/20/339704620.db2.gz PURAKWFBODCARK-UHOFOFEASA-N 1 2 303.450 4.281 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](C)c1ccc(Cl)s1 ZINC000485531468 339704989 /nfs/dbraw/zinc/70/49/89/339704989.db2.gz YXZKSZQXCXKJTP-VIFPVBQESA-N 1 2 309.822 4.296 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCCCc1ccc(Cl)cc1 ZINC000485629795 339707684 /nfs/dbraw/zinc/70/76/84/339707684.db2.gz KIUDNQRVMIACMS-UHFFFAOYSA-N 1 2 317.820 4.106 20 0 DIADLO CC[C@H](SC)C(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000485666912 339708674 /nfs/dbraw/zinc/70/86/74/339708674.db2.gz PBHGWITTYTUJQW-HNNXBMFYSA-N 1 2 316.470 4.169 20 0 DIADLO Fc1cc(Cl)cc(C[NH2+]Cc2ccn(C3CCCC3)n2)c1 ZINC000485716774 339711012 /nfs/dbraw/zinc/71/10/12/339711012.db2.gz FBSUGLGUNCMDAX-UHFFFAOYSA-N 1 2 307.800 4.081 20 0 DIADLO Cc1cccc(-c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)c1F ZINC000485857916 339714610 /nfs/dbraw/zinc/71/46/10/339714610.db2.gz LGPWQOGPJVHHCR-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Fc1c[nH+]ccc1NCc1c(OC(F)F)ccc2ccccc21 ZINC000486364073 339725996 /nfs/dbraw/zinc/72/59/96/339725996.db2.gz DXDATWUJCNXMHW-UHFFFAOYSA-N 1 2 318.298 4.009 20 0 DIADLO Cc1cc(N[C@@H]2CCOC3(CCC3)C2)c2cccc(F)c2[nH+]1 ZINC000486919454 339738109 /nfs/dbraw/zinc/73/81/09/339738109.db2.gz GYUNJJJVOBAZHB-CYBMUJFWSA-N 1 2 300.377 4.196 20 0 DIADLO CCCc1csc(C[NH2+][C@@H](COC)c2ccc(Cl)cc2)n1 ZINC000487155733 339744644 /nfs/dbraw/zinc/74/46/44/339744644.db2.gz JCEGMTJTBXSXIB-HNNXBMFYSA-N 1 2 324.877 4.226 20 0 DIADLO Cc1cc(C[NH+](Cc2cccs2)Cc2cccs2)nn1C ZINC000487407636 339753215 /nfs/dbraw/zinc/75/32/15/339753215.db2.gz CJTSTECWRHOEBS-UHFFFAOYSA-N 1 2 317.483 4.054 20 0 DIADLO C[C@H](SCc1[nH+]ccn1C)c1cccc(Br)c1 ZINC000487903230 339765299 /nfs/dbraw/zinc/76/52/99/339765299.db2.gz BFJYTDCGCMLUFS-JTQLQIEISA-N 1 2 311.248 4.177 20 0 DIADLO O=C(Nc1ccc(C2CCC2)cc1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000488645660 339789755 /nfs/dbraw/zinc/78/97/55/339789755.db2.gz NNZJQNIAFJYBFS-UHFFFAOYSA-N 1 2 317.392 4.392 20 0 DIADLO C[C@@H]1CN(c2cccc[nH+]2)C[C@H](c2cccc(C(F)(F)F)c2)O1 ZINC000488686732 339790533 /nfs/dbraw/zinc/79/05/33/339790533.db2.gz PHKQPGDYCMKBJJ-IUODEOHRSA-N 1 2 322.330 4.067 20 0 DIADLO COC[C@@H]([NH2+]Cc1c(F)cccc1F)c1ccc(Cl)cc1 ZINC000488701374 339790832 /nfs/dbraw/zinc/79/08/32/339790832.db2.gz GLFKYFRUGCGYBM-MRXNPFEDSA-N 1 2 311.759 4.096 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)C=Cc2ccccc2)[nH+]1 ZINC000492142531 339892481 /nfs/dbraw/zinc/89/24/81/339892481.db2.gz VOGJSCCNFAFGTK-QXMHVHEDSA-N 1 2 303.365 4.037 20 0 DIADLO CC(C)([NH2+]Cc1cc(Cl)cs1)c1cc(C(F)(F)F)on1 ZINC000492151614 339892780 /nfs/dbraw/zinc/89/27/80/339892780.db2.gz MRWUQUPLPGFAOA-UHFFFAOYSA-N 1 2 324.755 4.433 20 0 DIADLO C[C@H](C(=O)Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C)C(C)(F)F ZINC000492196782 339894104 /nfs/dbraw/zinc/89/41/04/339894104.db2.gz VIOZWHKIAKDSHB-SNVBAGLBSA-N 1 2 323.387 4.101 20 0 DIADLO CC(C)([NH2+]Cc1ccn(-c2ccccc2)n1)c1ccccc1F ZINC000492330510 339897779 /nfs/dbraw/zinc/89/77/79/339897779.db2.gz ARMNXICWUAPYOV-UHFFFAOYSA-N 1 2 309.388 4.036 20 0 DIADLO Cc1ccccc1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000492580743 339904514 /nfs/dbraw/zinc/90/45/14/339904514.db2.gz PPWDUWIRPACXIY-UHFFFAOYSA-N 1 2 304.349 4.435 20 0 DIADLO CCCc1csc(C[NH2+]Cc2ccc(C)cc2OCC)n1 ZINC000494159040 339942419 /nfs/dbraw/zinc/94/24/19/339942419.db2.gz AVKGWPTWAORWJG-UHFFFAOYSA-N 1 2 304.459 4.093 20 0 DIADLO FC(F)[C@@H](CCc1ccccc1)[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000498765969 340022952 /nfs/dbraw/zinc/02/29/52/340022952.db2.gz DYRIXNIIHLEUJJ-QZTJIDSGSA-N 1 2 316.395 4.389 20 0 DIADLO COC(=O)C[N@H+](Cc1ccc(-c2ccccc2C)s1)C(C)C ZINC000498851389 340024417 /nfs/dbraw/zinc/02/44/17/340024417.db2.gz DWQCUDZWJWNXOX-UHFFFAOYSA-N 1 2 317.454 4.107 20 0 DIADLO COC(=O)C[N@@H+](Cc1ccc(-c2ccccc2C)s1)C(C)C ZINC000498851389 340024418 /nfs/dbraw/zinc/02/44/18/340024418.db2.gz DWQCUDZWJWNXOX-UHFFFAOYSA-N 1 2 317.454 4.107 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCOC2(CCC2)C1 ZINC000499244039 340033086 /nfs/dbraw/zinc/03/30/86/340033086.db2.gz PQJVEXMXPOLIFE-NSHDSACASA-N 1 2 300.229 4.309 20 0 DIADLO Cc1cc(N(Cc2ccccc2)Cc2ccccc2C)nc[nH+]1 ZINC000498976757 340027356 /nfs/dbraw/zinc/02/73/56/340027356.db2.gz GUMUICFTBQUMIO-UHFFFAOYSA-N 1 2 303.409 4.300 20 0 DIADLO C[N@H+](Cc1csc(-c2ccccc2)n1)Cc1ccc(O)cc1 ZINC000499092385 340029467 /nfs/dbraw/zinc/02/94/67/340029467.db2.gz FYQZXOITVDNACP-UHFFFAOYSA-N 1 2 310.422 4.148 20 0 DIADLO C[N@@H+](Cc1csc(-c2ccccc2)n1)Cc1ccc(O)cc1 ZINC000499092385 340029468 /nfs/dbraw/zinc/02/94/68/340029468.db2.gz FYQZXOITVDNACP-UHFFFAOYSA-N 1 2 310.422 4.148 20 0 DIADLO C[C@@H]1CC[C@@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)[C@@H](C)C1 ZINC000499150944 340031230 /nfs/dbraw/zinc/03/12/30/340031230.db2.gz ZWZNKOVRVYEVDZ-ZRGWGRIASA-N 1 2 324.424 4.428 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CCOC2(CCC2)C1 ZINC000499244039 340033085 /nfs/dbraw/zinc/03/30/85/340033085.db2.gz PQJVEXMXPOLIFE-NSHDSACASA-N 1 2 300.229 4.309 20 0 DIADLO CC[C@H](c1ccc(Br)cc1)[N@@H+]1CCOC2(CCC2)C1 ZINC000499256042 340033559 /nfs/dbraw/zinc/03/35/59/340033559.db2.gz ZMASVZSZEZRVAW-OAHLLOKOSA-N 1 2 324.262 4.155 20 0 DIADLO CC[C@H](c1ccc(Br)cc1)[N@H+]1CCOC2(CCC2)C1 ZINC000499256042 340033560 /nfs/dbraw/zinc/03/35/60/340033560.db2.gz ZMASVZSZEZRVAW-OAHLLOKOSA-N 1 2 324.262 4.155 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@H](c2ccc(Cl)cc2)C2CCCC2)no1 ZINC000499908655 340046905 /nfs/dbraw/zinc/04/69/05/340046905.db2.gz KECBXBANXDXRPF-KRWDZBQOSA-N 1 2 319.836 4.395 20 0 DIADLO Cc1nc(C[N@H+](C)[C@H](c2ccc(Cl)cc2)C2CCCC2)no1 ZINC000499908655 340046906 /nfs/dbraw/zinc/04/69/06/340046906.db2.gz KECBXBANXDXRPF-KRWDZBQOSA-N 1 2 319.836 4.395 20 0 DIADLO CCC[C@@H](C)CC(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1 ZINC000500005352 340048484 /nfs/dbraw/zinc/04/84/84/340048484.db2.gz JJFKICHPIRNCAY-CQSZACIVSA-N 1 2 323.506 4.140 20 0 DIADLO CCCC[C@@H](CCC)NC(=O)CCn1c(C)[nH+]c2ccccc21 ZINC000500024953 340048832 /nfs/dbraw/zinc/04/88/32/340048832.db2.gz WBFXZWAEVDELCP-MRXNPFEDSA-N 1 2 315.461 4.210 20 0 DIADLO CCC[C@@H](CC1CCCC1)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000500032945 340049048 /nfs/dbraw/zinc/04/90/48/340049048.db2.gz WXKHTFPXBZGBQG-KRWDZBQOSA-N 1 2 317.477 4.112 20 0 DIADLO c1cc([C@@H]2C[N@H+](CCSC3CCCCC3)CCO2)cs1 ZINC000500115368 340050585 /nfs/dbraw/zinc/05/05/85/340050585.db2.gz LIZODMOWWNSALW-INIZCTEOSA-N 1 2 311.516 4.187 20 0 DIADLO c1cc([C@@H]2C[N@@H+](CCSC3CCCCC3)CCO2)cs1 ZINC000500115368 340050586 /nfs/dbraw/zinc/05/05/86/340050586.db2.gz LIZODMOWWNSALW-INIZCTEOSA-N 1 2 311.516 4.187 20 0 DIADLO Cc1cc(NC(=O)c2cc(-c3ccccc3)ccc2Cl)cc[nH+]1 ZINC000500310760 340055010 /nfs/dbraw/zinc/05/50/10/340055010.db2.gz CYJMUEIAYQNVRY-UHFFFAOYSA-N 1 2 322.795 4.385 20 0 DIADLO C/C(=C/c1ccccc1)C[NH2+][C@H](C)c1noc(-c2ccccc2)n1 ZINC000500375269 340056032 /nfs/dbraw/zinc/05/60/32/340056032.db2.gz IDPCSGTZBBRAER-UGEDRFTOSA-N 1 2 319.408 4.491 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@@H+]1Cc1ccc(Cl)c(Cl)c1 ZINC000500400918 340056926 /nfs/dbraw/zinc/05/69/26/340056926.db2.gz UMCVMQGTSRVANL-MRXNPFEDSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@H+]1Cc1ccc(Cl)c(Cl)c1 ZINC000500400918 340056927 /nfs/dbraw/zinc/05/69/27/340056927.db2.gz UMCVMQGTSRVANL-MRXNPFEDSA-N 1 2 324.255 4.454 20 0 DIADLO CC(C)OC[C@H](C)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000500437653 340058710 /nfs/dbraw/zinc/05/87/10/340058710.db2.gz DMRSQATYNYPPDM-HNNXBMFYSA-N 1 2 313.445 4.112 20 0 DIADLO C[C@@H]1C[C@@]1([NH2+]Cc1ncc(Cl)s1)c1ccc(Cl)cc1 ZINC000500449909 340059133 /nfs/dbraw/zinc/05/91/33/340059133.db2.gz FAMVBWADYHCQLJ-OTYXRUKQSA-N 1 2 313.253 4.475 20 0 DIADLO Fc1ccc(COc2cccc(C[NH2+]C3(C(F)F)CC3)c2)cc1 ZINC000500498090 340060799 /nfs/dbraw/zinc/06/07/99/340060799.db2.gz MUFNXKBOUTUOGN-UHFFFAOYSA-N 1 2 321.342 4.292 20 0 DIADLO COc1ccccc1-c1ccc(C[NH2+]C2(C(F)F)CC2)cc1 ZINC000500569596 340062605 /nfs/dbraw/zinc/06/26/05/340062605.db2.gz YZIPYHKYIJIKBS-UHFFFAOYSA-N 1 2 303.352 4.250 20 0 DIADLO Cc1ccc(CCC(=O)Nc2cccc(-n3cc[nH+]c3)c2)c(C)c1 ZINC000500717963 340065826 /nfs/dbraw/zinc/06/58/26/340065826.db2.gz NVJZLIKDBNVGDZ-UHFFFAOYSA-N 1 2 319.408 4.060 20 0 DIADLO CC(C)c1ccc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000500748506 340066323 /nfs/dbraw/zinc/06/63/23/340066323.db2.gz ZJTYTSPSWXJNPQ-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO CCC[C@H](C)[N@@H+]1CCO[C@H](c2cccc(Br)c2)C1 ZINC000501143347 340075097 /nfs/dbraw/zinc/07/50/97/340075097.db2.gz RCRCLTMYXJPZOF-WFASDCNBSA-N 1 2 312.251 4.011 20 0 DIADLO CCC[C@H](C)[N@H+]1CCO[C@H](c2cccc(Br)c2)C1 ZINC000501143347 340075098 /nfs/dbraw/zinc/07/50/98/340075098.db2.gz RCRCLTMYXJPZOF-WFASDCNBSA-N 1 2 312.251 4.011 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CCCc1ccc(Cl)c(Cl)c1 ZINC000501266668 340077554 /nfs/dbraw/zinc/07/75/54/340077554.db2.gz YFUHHNZOQQHGOL-UHFFFAOYSA-N 1 2 323.223 4.080 20 0 DIADLO CCOc1cc(F)ccc1NCc1cn2cc(Cl)ccc2[nH+]1 ZINC000502248655 340097666 /nfs/dbraw/zinc/09/76/66/340097666.db2.gz LSWKBJBQSGZQPH-UHFFFAOYSA-N 1 2 319.767 4.138 20 0 DIADLO CCCCc1noc(C[NH2+][C@]2(c3cccc(C)c3)C[C@H]2CC)n1 ZINC000502592362 340108611 /nfs/dbraw/zinc/10/86/11/340108611.db2.gz PLYPBSOBACVDSW-DNVCBOLYSA-N 1 2 313.445 4.136 20 0 DIADLO CCCCc1noc(C[NH2+][C@@]2(c3cccc(C)c3)C[C@@H]2CC)n1 ZINC000502592365 340108673 /nfs/dbraw/zinc/10/86/73/340108673.db2.gz PLYPBSOBACVDSW-KXBFYZLASA-N 1 2 313.445 4.136 20 0 DIADLO CC(C)(C)CC[N@@H+]1CCOC[C@H]1c1nc2ccccc2s1 ZINC000502846488 340114466 /nfs/dbraw/zinc/11/44/66/340114466.db2.gz QLFCYCBKALQGRE-AWEZNQCLSA-N 1 2 304.459 4.106 20 0 DIADLO CC(C)(C)CC[N@H+]1CCOC[C@H]1c1nc2ccccc2s1 ZINC000502846488 340114467 /nfs/dbraw/zinc/11/44/67/340114467.db2.gz QLFCYCBKALQGRE-AWEZNQCLSA-N 1 2 304.459 4.106 20 0 DIADLO Cc1cc(F)cc([C@@]2(F)CC[N@H+](Cc3ccncc3Cl)C2)c1 ZINC000502891021 340115792 /nfs/dbraw/zinc/11/57/92/340115792.db2.gz DHYPKHONBJERSZ-QGZVFWFLSA-N 1 2 322.786 4.253 20 0 DIADLO Cc1cc(F)cc([C@@]2(F)CC[N@@H+](Cc3ccncc3Cl)C2)c1 ZINC000502891021 340115793 /nfs/dbraw/zinc/11/57/93/340115793.db2.gz DHYPKHONBJERSZ-QGZVFWFLSA-N 1 2 322.786 4.253 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000502952118 340117445 /nfs/dbraw/zinc/11/74/45/340117445.db2.gz KKXNBCUFBNQJSQ-LJQANCHMSA-N 1 2 316.420 4.351 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000502952118 340117446 /nfs/dbraw/zinc/11/74/46/340117446.db2.gz KKXNBCUFBNQJSQ-LJQANCHMSA-N 1 2 316.420 4.351 20 0 DIADLO O=C(Nc1cccc2ccsc21)[C@@H]1CC[N@@H+]1Cc1ccccc1 ZINC000502955601 340117479 /nfs/dbraw/zinc/11/74/79/340117479.db2.gz GGDNTBSZAFMUGV-KRWDZBQOSA-N 1 2 322.433 4.114 20 0 DIADLO O=C(Nc1cccc2ccsc21)[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000502955601 340117480 /nfs/dbraw/zinc/11/74/80/340117480.db2.gz GGDNTBSZAFMUGV-KRWDZBQOSA-N 1 2 322.433 4.114 20 0 DIADLO c1ccc2sc([C@H]3COCC[N@H+]3C[C@H]3CC=CCC3)nc2c1 ZINC000503037880 340119370 /nfs/dbraw/zinc/11/93/70/340119370.db2.gz YPZOSSMGKWCBTO-GOEBONIOSA-N 1 2 314.454 4.026 20 0 DIADLO c1ccc2sc([C@H]3COCC[N@@H+]3C[C@H]3CC=CCC3)nc2c1 ZINC000503037880 340119371 /nfs/dbraw/zinc/11/93/71/340119371.db2.gz YPZOSSMGKWCBTO-GOEBONIOSA-N 1 2 314.454 4.026 20 0 DIADLO Cc1cc(F)cc2c1C[N@H+](Cc1ncc(C(C)C)s1)CC2 ZINC000503101874 340121014 /nfs/dbraw/zinc/12/10/14/340121014.db2.gz WSIITADBHIFAGX-UHFFFAOYSA-N 1 2 304.434 4.272 20 0 DIADLO Cc1cc(F)cc2c1C[N@@H+](Cc1ncc(C(C)C)s1)CC2 ZINC000503101874 340121015 /nfs/dbraw/zinc/12/10/15/340121015.db2.gz WSIITADBHIFAGX-UHFFFAOYSA-N 1 2 304.434 4.272 20 0 DIADLO CCCC[C@H](C)C(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1 ZINC000503130246 340121637 /nfs/dbraw/zinc/12/16/37/340121637.db2.gz JPSWCTUMYSMTJP-AWEZNQCLSA-N 1 2 323.506 4.140 20 0 DIADLO CCCC[C@H](C)C(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC000503130627 340121660 /nfs/dbraw/zinc/12/16/60/340121660.db2.gz LAYONKMDGXOZHQ-KBPBESRZSA-N 1 2 323.506 4.140 20 0 DIADLO CCCC[C@H](C)C(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC000503130627 340121661 /nfs/dbraw/zinc/12/16/61/340121661.db2.gz LAYONKMDGXOZHQ-KBPBESRZSA-N 1 2 323.506 4.140 20 0 DIADLO C(=C\[C@H]1CCCN1c1cc[nH+]c2ccncc21)\c1ccccc1 ZINC000503317199 340125383 /nfs/dbraw/zinc/12/53/83/340125383.db2.gz SHQSHAQAGQEARY-XZVRFQMRSA-N 1 2 301.393 4.312 20 0 DIADLO C/C(=C/c1ccccc1C(F)(F)F)C[N@@H+](C)Cc1ccon1 ZINC000503884272 340135647 /nfs/dbraw/zinc/13/56/47/340135647.db2.gz HCBZQFNIRWVHMU-XFXZXTDPSA-N 1 2 310.319 4.229 20 0 DIADLO C/C(=C/c1ccccc1C(F)(F)F)C[N@H+](C)Cc1ccon1 ZINC000503884272 340135648 /nfs/dbraw/zinc/13/56/48/340135648.db2.gz HCBZQFNIRWVHMU-XFXZXTDPSA-N 1 2 310.319 4.229 20 0 DIADLO C[C@H]1C[C@H]([NH2+]C2(C(F)F)CC2)c2cccc(Br)c21 ZINC000503950068 340138391 /nfs/dbraw/zinc/13/83/91/340138391.db2.gz SMRVRTRZFHYBTK-KWQFWETISA-N 1 2 316.189 4.385 20 0 DIADLO Cc1nc(C[N@H+](C)CCOc2cccc(C(C)(C)C)c2)cs1 ZINC000504094377 340140808 /nfs/dbraw/zinc/14/08/08/340140808.db2.gz NLOYPQFTXRNOMB-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO Cc1nc(C[N@@H+](C)CCOc2cccc(C(C)(C)C)c2)cs1 ZINC000504094377 340140809 /nfs/dbraw/zinc/14/08/09/340140809.db2.gz NLOYPQFTXRNOMB-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N(Cc1ccccc1)C1CCCCC1 ZINC000504152694 340142001 /nfs/dbraw/zinc/14/20/01/340142001.db2.gz YXYHZWUKORLGAY-UHFFFAOYSA-N 1 2 323.440 4.179 20 0 DIADLO Cc1cccc([C@H]2CCCCCN2C(=O)Nc2cc[nH+]c(C)c2)c1 ZINC000504169487 340142297 /nfs/dbraw/zinc/14/22/97/340142297.db2.gz PHIBFYOOPFFOLZ-LJQANCHMSA-N 1 2 323.440 4.270 20 0 DIADLO CC[C@H](CC(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000504688160 340151190 /nfs/dbraw/zinc/15/11/90/340151190.db2.gz WXCZKNDCOHBDNE-OAHLLOKOSA-N 1 2 307.397 4.165 20 0 DIADLO C[C@@H]1CCc2nc(C[N@H+](C)Cc3cccc(F)c3)sc2C1 ZINC000505577488 340171561 /nfs/dbraw/zinc/17/15/61/340171561.db2.gz WWUYZNVNTMQLLA-GFCCVEGCSA-N 1 2 304.434 4.039 20 0 DIADLO C[C@@H]1CCc2nc(C[N@@H+](C)Cc3cccc(F)c3)sc2C1 ZINC000505577488 340171562 /nfs/dbraw/zinc/17/15/62/340171562.db2.gz WWUYZNVNTMQLLA-GFCCVEGCSA-N 1 2 304.434 4.039 20 0 DIADLO CCc1[nH]ccc1C(=O)Nc1ccc2[nH]c(C(C)(C)C)[nH+]c2c1 ZINC000505876544 340180469 /nfs/dbraw/zinc/18/04/69/340180469.db2.gz JYLGANRUQKJYKS-UHFFFAOYSA-N 1 2 310.401 4.003 20 0 DIADLO C[N@H+](Cc1ccco1)Cc1cc(Cl)ccc1OC(F)F ZINC000506085938 340185076 /nfs/dbraw/zinc/18/50/76/340185076.db2.gz NZTYQLKZAHTEMW-UHFFFAOYSA-N 1 2 301.720 4.166 20 0 DIADLO C[N@@H+](Cc1ccco1)Cc1cc(Cl)ccc1OC(F)F ZINC000506085938 340185077 /nfs/dbraw/zinc/18/50/77/340185077.db2.gz NZTYQLKZAHTEMW-UHFFFAOYSA-N 1 2 301.720 4.166 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000506192063 340188200 /nfs/dbraw/zinc/18/82/00/340188200.db2.gz RGXQBGUFXSPRTQ-UHFFFAOYSA-N 1 2 322.408 4.372 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000506192063 340188201 /nfs/dbraw/zinc/18/82/01/340188201.db2.gz RGXQBGUFXSPRTQ-UHFFFAOYSA-N 1 2 322.408 4.372 20 0 DIADLO Cc1c(NCc2ccc(C)[nH+]c2C)cnn1-c1cc(C)ccc1C ZINC000506245191 340189860 /nfs/dbraw/zinc/18/98/60/340189860.db2.gz JXLHMDOVBBUBQE-UHFFFAOYSA-N 1 2 320.440 4.422 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cc1cccc(O)c1Cl ZINC000507001958 340205183 /nfs/dbraw/zinc/20/51/83/340205183.db2.gz NIOABOCQJMCTQG-UHFFFAOYSA-N 1 2 302.226 4.393 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1cccc(O)c1Cl ZINC000507001958 340205184 /nfs/dbraw/zinc/20/51/84/340205184.db2.gz NIOABOCQJMCTQG-UHFFFAOYSA-N 1 2 302.226 4.393 20 0 DIADLO CCCn1c(C[N@H+](Cc2ccco2)C(C)C)nc2ccccc21 ZINC000506433581 340194583 /nfs/dbraw/zinc/19/45/83/340194583.db2.gz QMZSIAQLAYHMOA-UHFFFAOYSA-N 1 2 311.429 4.450 20 0 DIADLO CCCn1c(C[N@@H+](Cc2ccco2)C(C)C)nc2ccccc21 ZINC000506433581 340194584 /nfs/dbraw/zinc/19/45/84/340194584.db2.gz QMZSIAQLAYHMOA-UHFFFAOYSA-N 1 2 311.429 4.450 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccccc2F)C2CC2)c(OC)c1 ZINC000506583227 340197088 /nfs/dbraw/zinc/19/70/88/340197088.db2.gz AEHXGMJWEWEZJE-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccccc2F)C2CC2)c(OC)c1 ZINC000506583227 340197089 /nfs/dbraw/zinc/19/70/89/340197089.db2.gz AEHXGMJWEWEZJE-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO Cc1cc(N(C)CCC2CCCCC2)nc(-c2ccncc2)[nH+]1 ZINC000506769335 340201260 /nfs/dbraw/zinc/20/12/60/340201260.db2.gz XEUKACIBVGCGQK-UHFFFAOYSA-N 1 2 310.445 4.254 20 0 DIADLO CC(C)(CNc1cccc[nH+]1)c1cccc(Br)c1 ZINC000506798738 340202202 /nfs/dbraw/zinc/20/22/02/340202202.db2.gz WJZXEZOXCGWEIX-UHFFFAOYSA-N 1 2 305.219 4.234 20 0 DIADLO CCCCc1nc(C[N@H+](C)[C@H](C)c2ccc(C)cc2C)no1 ZINC000507002479 340205052 /nfs/dbraw/zinc/20/50/52/340205052.db2.gz PSIOJEOQYXEJLT-OAHLLOKOSA-N 1 2 301.434 4.222 20 0 DIADLO CCCCc1nc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2C)no1 ZINC000507002479 340205053 /nfs/dbraw/zinc/20/50/53/340205053.db2.gz PSIOJEOQYXEJLT-OAHLLOKOSA-N 1 2 301.434 4.222 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2c(F)ccc(O)c2F)c1 ZINC000507077668 340206633 /nfs/dbraw/zinc/20/66/33/340206633.db2.gz MGPOJZGZSABBDG-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2c(F)ccc(O)c2F)c1 ZINC000507077668 340206634 /nfs/dbraw/zinc/20/66/34/340206634.db2.gz MGPOJZGZSABBDG-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1ncsc1CCSCc1cn2cc(Cl)ccc2[nH+]1 ZINC000507106004 340207579 /nfs/dbraw/zinc/20/75/79/340207579.db2.gz XAXLMKRMTQFUAA-UHFFFAOYSA-N 1 2 323.874 4.229 20 0 DIADLO CN(Cc1c[nH+]c2ccccn12)Cc1c(Cl)cccc1Cl ZINC000507115837 340208028 /nfs/dbraw/zinc/20/80/28/340208028.db2.gz JDOKVDPFNNJIGV-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO CC[N@H+](Cc1c(C)noc1C)Cc1ccccc1Br ZINC000507117669 340208189 /nfs/dbraw/zinc/20/81/89/340208189.db2.gz VOLSTQSFFGGWKB-UHFFFAOYSA-N 1 2 323.234 4.076 20 0 DIADLO CC[N@@H+](Cc1c(C)noc1C)Cc1ccccc1Br ZINC000507117669 340208190 /nfs/dbraw/zinc/20/81/90/340208190.db2.gz VOLSTQSFFGGWKB-UHFFFAOYSA-N 1 2 323.234 4.076 20 0 DIADLO FCCCCSCc1cn2cc(Br)ccc2[nH+]1 ZINC000507132835 340208865 /nfs/dbraw/zinc/20/88/65/340208865.db2.gz QBAYLRNBBZOPOG-UHFFFAOYSA-N 1 2 317.227 4.080 20 0 DIADLO COc1ccccc1C[N@H+](Cc1cccc(O)c1Cl)C1CC1 ZINC000507170861 340210890 /nfs/dbraw/zinc/21/08/90/340210890.db2.gz QZLGVZZLMRIVKT-UHFFFAOYSA-N 1 2 317.816 4.219 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1cccc(O)c1Cl)C1CC1 ZINC000507170861 340210891 /nfs/dbraw/zinc/21/08/91/340210891.db2.gz QZLGVZZLMRIVKT-UHFFFAOYSA-N 1 2 317.816 4.219 20 0 DIADLO CCc1nocc1C[N@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000507204097 340213084 /nfs/dbraw/zinc/21/30/84/340213084.db2.gz PODSJLVLVLVMER-UHFFFAOYSA-N 1 2 310.397 4.341 20 0 DIADLO CCc1nocc1C[N@@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000507204097 340213085 /nfs/dbraw/zinc/21/30/85/340213085.db2.gz PODSJLVLVLVMER-UHFFFAOYSA-N 1 2 310.397 4.341 20 0 DIADLO C[N@@H+](Cc1c(F)cccc1Cl)C[C@@H]1OCCc2ccccc21 ZINC000507218349 340214298 /nfs/dbraw/zinc/21/42/98/340214298.db2.gz KGEWTZGUWNTGCN-SFHVURJKSA-N 1 2 319.807 4.225 20 0 DIADLO C[N@H+](Cc1c(F)cccc1Cl)C[C@@H]1OCCc2ccccc21 ZINC000507218349 340214299 /nfs/dbraw/zinc/21/42/99/340214299.db2.gz KGEWTZGUWNTGCN-SFHVURJKSA-N 1 2 319.807 4.225 20 0 DIADLO CCn1cc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000507229475 340214560 /nfs/dbraw/zinc/21/45/60/340214560.db2.gz MJHLXCQGIPZKHM-LLVKDONJSA-N 1 2 312.244 4.403 20 0 DIADLO CCn1cc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000507229475 340214561 /nfs/dbraw/zinc/21/45/61/340214561.db2.gz MJHLXCQGIPZKHM-LLVKDONJSA-N 1 2 312.244 4.403 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@@H]2c2ccsc2)s1 ZINC000507230756 340214694 /nfs/dbraw/zinc/21/46/94/340214694.db2.gz OZCWMLQLFXIGLU-CYBMUJFWSA-N 1 2 310.513 4.405 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@@H]2c2ccsc2)s1 ZINC000507230756 340214695 /nfs/dbraw/zinc/21/46/95/340214695.db2.gz OZCWMLQLFXIGLU-CYBMUJFWSA-N 1 2 310.513 4.405 20 0 DIADLO COc1cc(C[N@H+](C)[C@H](C)c2c(F)cccc2F)cc(OC)c1 ZINC000507251781 340215586 /nfs/dbraw/zinc/21/55/86/340215586.db2.gz JZAAZPYEPNAKHX-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1cc(C[N@@H+](C)[C@H](C)c2c(F)cccc2F)cc(OC)c1 ZINC000507251781 340215587 /nfs/dbraw/zinc/21/55/87/340215587.db2.gz JZAAZPYEPNAKHX-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO CCc1ncc(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)s1 ZINC000507342175 340217664 /nfs/dbraw/zinc/21/76/64/340217664.db2.gz RDXPGOWHICTTCI-LJQANCHMSA-N 1 2 323.465 4.112 20 0 DIADLO CCc1ncc(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)s1 ZINC000507342175 340217665 /nfs/dbraw/zinc/21/76/65/340217665.db2.gz RDXPGOWHICTTCI-LJQANCHMSA-N 1 2 323.465 4.112 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3)C2)o1 ZINC000507360179 340217971 /nfs/dbraw/zinc/21/79/71/340217971.db2.gz RDXGAEGPVYDHLT-XVSDVWIESA-N 1 2 315.388 4.116 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+]2CCO[C@H](c3ccc(F)cc3)C2)o1 ZINC000507360179 340217972 /nfs/dbraw/zinc/21/79/72/340217972.db2.gz RDXGAEGPVYDHLT-XVSDVWIESA-N 1 2 315.388 4.116 20 0 DIADLO Cc1nccc(C[N@H+](Cc2ccccc2)Cc2ccccc2F)n1 ZINC000507417244 340218838 /nfs/dbraw/zinc/21/88/38/340218838.db2.gz HOYHJHJHYJILIV-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1nccc(C[N@@H+](Cc2ccccc2)Cc2ccccc2F)n1 ZINC000507417244 340218839 /nfs/dbraw/zinc/21/88/39/340218839.db2.gz HOYHJHJHYJILIV-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000507474630 340221650 /nfs/dbraw/zinc/22/16/50/340221650.db2.gz YBRYTUGDZZQRLO-HRAATJIYSA-N 1 2 317.436 4.479 20 0 DIADLO COCC[C@@H]([NH2+][C@H](CCc1ccccc1)C(F)F)c1ccco1 ZINC000507479200 340221709 /nfs/dbraw/zinc/22/17/09/340221709.db2.gz NYFYGOVLUQHHCE-HZPDHXFCSA-N 1 2 323.383 4.213 20 0 DIADLO C[C@H](Nc1cccc([NH+]2CCCCCC2)c1)[C@@H]1CCCOC1 ZINC000507480620 340221790 /nfs/dbraw/zinc/22/17/90/340221790.db2.gz PGYVCBWZNPYXBU-DLBZAZTESA-N 1 2 302.462 4.294 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+][C@@H](C)c1c(F)cccc1OC ZINC000507499787 340222892 /nfs/dbraw/zinc/22/28/92/340222892.db2.gz ZUASVLSWLSEYII-STQMWFEESA-N 1 2 302.393 4.204 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)o1 ZINC000507670466 340227899 /nfs/dbraw/zinc/22/78/99/340227899.db2.gz VJQTXSQWNLQBCS-QGZVFWFLSA-N 1 2 305.805 4.069 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)o1 ZINC000507670466 340227900 /nfs/dbraw/zinc/22/79/00/340227900.db2.gz VJQTXSQWNLQBCS-QGZVFWFLSA-N 1 2 305.805 4.069 20 0 DIADLO CCCCc1nc(C[N@H+](Cc2ccccc2)CC(C)(C)C)no1 ZINC000507818931 340233165 /nfs/dbraw/zinc/23/31/65/340233165.db2.gz PNEQVCDGHQJZGG-UHFFFAOYSA-N 1 2 315.461 4.461 20 0 DIADLO CCCCc1nc(C[N@@H+](Cc2ccccc2)CC(C)(C)C)no1 ZINC000507818931 340233166 /nfs/dbraw/zinc/23/31/66/340233166.db2.gz PNEQVCDGHQJZGG-UHFFFAOYSA-N 1 2 315.461 4.461 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCO[C@@H](c3cccs3)C2)c1 ZINC000507835180 340233681 /nfs/dbraw/zinc/23/36/81/340233681.db2.gz VTAYMOGLPKBUHH-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCO[C@@H](c3cccs3)C2)c1 ZINC000507835180 340233682 /nfs/dbraw/zinc/23/36/82/340233682.db2.gz VTAYMOGLPKBUHH-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(-c3ccc(Cl)cc3)n2)[C@@H](C)CO1 ZINC000508057834 340238550 /nfs/dbraw/zinc/23/85/50/340238550.db2.gz PMDAKTWDHPHRKK-NWDGAFQWSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(-c3ccc(Cl)cc3)n2)[C@@H](C)CO1 ZINC000508057834 340238551 /nfs/dbraw/zinc/23/85/51/340238551.db2.gz PMDAKTWDHPHRKK-NWDGAFQWSA-N 1 2 322.861 4.073 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(-c3ccc(F)cc3)s2)no1 ZINC000508519138 340245621 /nfs/dbraw/zinc/24/56/21/340245621.db2.gz STAICLKZKQWNFQ-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(-c3ccc(F)cc3)s2)no1 ZINC000508519138 340245622 /nfs/dbraw/zinc/24/56/22/340245622.db2.gz STAICLKZKQWNFQ-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cccc(Oc3ccccc3)c2)no1 ZINC000508528129 340245942 /nfs/dbraw/zinc/24/59/42/340245942.db2.gz LAIJEVBEIKZHOO-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cccc(Oc3ccccc3)c2)no1 ZINC000508528129 340245943 /nfs/dbraw/zinc/24/59/43/340245943.db2.gz LAIJEVBEIKZHOO-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO CC(C)Oc1c(Cl)cccc1NCc1cn2ccccc2[nH+]1 ZINC000508731595 340251925 /nfs/dbraw/zinc/25/19/25/340251925.db2.gz XTCJYKSZJWPJRG-UHFFFAOYSA-N 1 2 315.804 4.387 20 0 DIADLO CC(C)CCOc1cccc(NCc2cn3ccccc3[nH+]2)c1 ZINC000508739382 340252153 /nfs/dbraw/zinc/25/21/53/340252153.db2.gz JVZRAKZTRGSQBP-UHFFFAOYSA-N 1 2 309.413 4.371 20 0 DIADLO Clc1ccccc1[C@H]1C[N@H+](C/C=C\c2ccccc2)CCO1 ZINC000509048411 340259336 /nfs/dbraw/zinc/25/93/36/340259336.db2.gz NEZTWQFKAXOFTJ-WMHRWZGDSA-N 1 2 313.828 4.427 20 0 DIADLO Clc1ccccc1[C@H]1C[N@@H+](C/C=C\c2ccccc2)CCO1 ZINC000509048411 340259337 /nfs/dbraw/zinc/25/93/37/340259337.db2.gz NEZTWQFKAXOFTJ-WMHRWZGDSA-N 1 2 313.828 4.427 20 0 DIADLO Clc1ccccc1[C@@H]1C[N@H+](C/C=C\c2ccccc2)CCO1 ZINC000509048410 340259418 /nfs/dbraw/zinc/25/94/18/340259418.db2.gz NEZTWQFKAXOFTJ-QBUQCISBSA-N 1 2 313.828 4.427 20 0 DIADLO Clc1ccccc1[C@@H]1C[N@@H+](C/C=C\c2ccccc2)CCO1 ZINC000509048410 340259419 /nfs/dbraw/zinc/25/94/19/340259419.db2.gz NEZTWQFKAXOFTJ-QBUQCISBSA-N 1 2 313.828 4.427 20 0 DIADLO O=C(NCCC1CCCC1)c1ccccc1Oc1cc[nH+]cc1 ZINC000509156370 340262594 /nfs/dbraw/zinc/26/25/94/340262594.db2.gz UTKPTLGYGUUXJQ-UHFFFAOYSA-N 1 2 310.397 4.184 20 0 DIADLO C[C@H](CCC1CC1)NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509311852 340265858 /nfs/dbraw/zinc/26/58/58/340265858.db2.gz BQUWSMNGJISLDU-CQSZACIVSA-N 1 2 310.397 4.182 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+]3CCOC(C)(C)[C@H]3C)n2)cc1 ZINC000509357939 340267117 /nfs/dbraw/zinc/26/71/17/340267117.db2.gz MBJNXXUWHBXNLK-CQSZACIVSA-N 1 2 316.470 4.118 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+]3CCOC(C)(C)[C@H]3C)n2)cc1 ZINC000509357939 340267118 /nfs/dbraw/zinc/26/71/18/340267118.db2.gz MBJNXXUWHBXNLK-CQSZACIVSA-N 1 2 316.470 4.118 20 0 DIADLO FC(F)(F)[C@@H]1CCN(c2[nH]c3ccccc3[nH+]2)CC12CCC2 ZINC000509459622 340270202 /nfs/dbraw/zinc/27/02/02/340270202.db2.gz NVXWDAFFQFPAGD-CYBMUJFWSA-N 1 2 309.335 4.122 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCc4cc(F)ccc4C3)co2)cc1 ZINC000509463615 340270363 /nfs/dbraw/zinc/27/03/63/340270363.db2.gz NHSOGXLFURQRFY-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCc4cc(F)ccc4C3)co2)cc1 ZINC000509463615 340270364 /nfs/dbraw/zinc/27/03/64/340270364.db2.gz NHSOGXLFURQRFY-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Oc1ccc2c(c1)C[N@@H+](Cc1csc(-c3ccccc3)n1)CC2 ZINC000509582294 340274023 /nfs/dbraw/zinc/27/40/23/340274023.db2.gz GFLZCORYFSOTCR-UHFFFAOYSA-N 1 2 322.433 4.074 20 0 DIADLO Oc1ccc2c(c1)C[N@H+](Cc1csc(-c3ccccc3)n1)CC2 ZINC000509582294 340274024 /nfs/dbraw/zinc/27/40/24/340274024.db2.gz GFLZCORYFSOTCR-UHFFFAOYSA-N 1 2 322.433 4.074 20 0 DIADLO COC(=O)c1cccc(Cl)c1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000509639794 340275171 /nfs/dbraw/zinc/27/51/71/340275171.db2.gz DTYQVZQLEMGZCL-QGZVFWFLSA-N 1 2 315.800 4.074 20 0 DIADLO COC(=O)c1cccc(Cl)c1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000509639794 340275172 /nfs/dbraw/zinc/27/51/72/340275172.db2.gz DTYQVZQLEMGZCL-QGZVFWFLSA-N 1 2 315.800 4.074 20 0 DIADLO O=C(c1ccccc1Oc1cc[nH+]cc1)N1CCC[C@H]2CCC[C@@H]21 ZINC000509993383 340284870 /nfs/dbraw/zinc/28/48/70/340284870.db2.gz FSZOMXIFAMOQPQ-QAPCUYQASA-N 1 2 322.408 4.279 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(-c2ccccc2)n1)c1ccncc1F ZINC000510040111 340286039 /nfs/dbraw/zinc/28/60/39/340286039.db2.gz OTBFSNBPHSRQMY-GFCCVEGCSA-N 1 2 313.401 4.195 20 0 DIADLO FC(F)Oc1ccc(C[NH2+]C2(C(F)F)CCCCC2)cc1 ZINC000510103212 340288816 /nfs/dbraw/zinc/28/88/16/340288816.db2.gz IAXRVBDMQKUPRU-UHFFFAOYSA-N 1 2 305.315 4.346 20 0 DIADLO COc1ccccc1[C@@H]1CC[C@H](C)C[N@@H+]1Cc1cscn1 ZINC000510224993 340293211 /nfs/dbraw/zinc/29/32/11/340293211.db2.gz WBLJEKIPFQPCOP-BBRMVZONSA-N 1 2 302.443 4.125 20 0 DIADLO COc1ccccc1[C@@H]1CC[C@H](C)C[N@H+]1Cc1cscn1 ZINC000510224993 340293212 /nfs/dbraw/zinc/29/32/12/340293212.db2.gz WBLJEKIPFQPCOP-BBRMVZONSA-N 1 2 302.443 4.125 20 0 DIADLO CC(C)c1noc(C[N@@H+](Cc2ccccc2Cl)CC2CC2)n1 ZINC000510236506 340293601 /nfs/dbraw/zinc/29/36/01/340293601.db2.gz DMCNTRPWHVNSDV-UHFFFAOYSA-N 1 2 319.836 4.259 20 0 DIADLO CC(C)c1noc(C[N@H+](Cc2ccccc2Cl)CC2CC2)n1 ZINC000510236506 340293602 /nfs/dbraw/zinc/29/36/02/340293602.db2.gz DMCNTRPWHVNSDV-UHFFFAOYSA-N 1 2 319.836 4.259 20 0 DIADLO CCCC1(CNC(=O)c2ccccc2Oc2cc[nH+]cc2)CC1 ZINC000510305072 340295557 /nfs/dbraw/zinc/29/55/57/340295557.db2.gz NUMLYVRBMQECAJ-UHFFFAOYSA-N 1 2 310.397 4.184 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc(-c3cccs3)no2)cc1C ZINC000510635338 340304449 /nfs/dbraw/zinc/30/44/49/340304449.db2.gz YRHIAJHVWMTRTK-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc(-c3cccs3)no2)cc1C ZINC000510635338 340304450 /nfs/dbraw/zinc/30/44/50/340304450.db2.gz YRHIAJHVWMTRTK-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2nccs2)c2cccc(F)c2)c1 ZINC000510734661 340308596 /nfs/dbraw/zinc/30/85/96/340308596.db2.gz MPIMHTXYNZDREL-GOSISDBHSA-N 1 2 312.413 4.470 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc(C)c(C)cc3Cl)ccc2[nH+]1 ZINC000510981111 340316992 /nfs/dbraw/zinc/31/69/92/340316992.db2.gz XIHWOVMPPIJSJX-UHFFFAOYSA-N 1 2 313.788 4.165 20 0 DIADLO Cc1cc(NC(=O)[C@H]2C[C@@H]2C(F)F)ccc1Oc1cc[nH+]cc1 ZINC000511373224 340326137 /nfs/dbraw/zinc/32/61/37/340326137.db2.gz WEXKLNCUFOBSQH-KBPBESRZSA-N 1 2 318.323 4.022 20 0 DIADLO Cc1cccc(NC(=O)C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000511584847 340331412 /nfs/dbraw/zinc/33/14/12/340331412.db2.gz KBXHAIGRTGPDSZ-QGZVFWFLSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1cccc(NC(=O)C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000511584847 340331413 /nfs/dbraw/zinc/33/14/13/340331413.db2.gz KBXHAIGRTGPDSZ-QGZVFWFLSA-N 1 2 314.816 4.034 20 0 DIADLO COC(=O)c1ccc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)s1 ZINC000511597160 340331957 /nfs/dbraw/zinc/33/19/57/340331957.db2.gz UFJFOKQMXAYUDT-CQSZACIVSA-N 1 2 321.829 4.135 20 0 DIADLO COC(=O)c1ccc(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)s1 ZINC000511597160 340331958 /nfs/dbraw/zinc/33/19/58/340331958.db2.gz UFJFOKQMXAYUDT-CQSZACIVSA-N 1 2 321.829 4.135 20 0 DIADLO Cc1nc(C)c(C[N@H+](Cc2ccc(F)cc2F)C2CC2)s1 ZINC000172755603 340339769 /nfs/dbraw/zinc/33/97/69/340339769.db2.gz FALFLJPFXWWKCL-UHFFFAOYSA-N 1 2 308.397 4.203 20 0 DIADLO Cc1nc(C)c(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)s1 ZINC000172755603 340339770 /nfs/dbraw/zinc/33/97/70/340339770.db2.gz FALFLJPFXWWKCL-UHFFFAOYSA-N 1 2 308.397 4.203 20 0 DIADLO CC[C@H]1C[N@H+](Cc2csc(-c3ccc(C)cc3)n2)C[C@@H](C)O1 ZINC000511855805 340340687 /nfs/dbraw/zinc/34/06/87/340340687.db2.gz QWHXOPKKEBCHOH-PBHICJAKSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2csc(-c3ccc(C)cc3)n2)C[C@@H](C)O1 ZINC000511855805 340340688 /nfs/dbraw/zinc/34/06/88/340340688.db2.gz QWHXOPKKEBCHOH-PBHICJAKSA-N 1 2 316.470 4.118 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)C12CC3C[C@@](C)(C1)C[C@](C)(C3)C2 ZINC000511889486 340341888 /nfs/dbraw/zinc/34/18/88/340341888.db2.gz JBBBEECEWNCELG-ODNNXGBQSA-N 1 2 312.457 4.001 20 0 DIADLO Cc1cc(N2[C@H](C)C[C@H]3CCCC[C@@H]32)nc(-c2ccncc2)[nH+]1 ZINC000172821016 340343129 /nfs/dbraw/zinc/34/31/29/340343129.db2.gz IZBXKTVXPZRFDN-OIISXLGYSA-N 1 2 308.429 4.004 20 0 DIADLO C[C@H]([NH2+]C/C=C/c1ccc(F)c(F)c1)c1nc(C(C)(C)C)no1 ZINC000512013530 340345391 /nfs/dbraw/zinc/34/53/91/340345391.db2.gz BWULNGTWUZIKHO-QRGHLMKCSA-N 1 2 321.371 4.009 20 0 DIADLO Cc1cccn2cc(CNc3cccc(CC(F)(F)F)c3)[nH+]c12 ZINC000172938682 340349240 /nfs/dbraw/zinc/34/92/40/340349240.db2.gz PGBAADHRVGPTFI-UHFFFAOYSA-N 1 2 319.330 4.360 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](Cc1nc(C2CCCC2)no1)C1CC1 ZINC000512237593 340353641 /nfs/dbraw/zinc/35/36/41/340353641.db2.gz TZVRROFYXKCGHF-AWEZNQCLSA-N 1 2 311.429 4.453 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](Cc1nc(C2CCCC2)no1)C1CC1 ZINC000512237593 340353642 /nfs/dbraw/zinc/35/36/42/340353642.db2.gz TZVRROFYXKCGHF-AWEZNQCLSA-N 1 2 311.429 4.453 20 0 DIADLO Cc1c2cccc(Cl)c2sc1C[N@@H+](C)Cc1nccn1C ZINC000512259560 340354388 /nfs/dbraw/zinc/35/43/88/340354388.db2.gz INUGWYZHODQFML-UHFFFAOYSA-N 1 2 319.861 4.229 20 0 DIADLO Cc1c2cccc(Cl)c2sc1C[N@H+](C)Cc1nccn1C ZINC000512259560 340354389 /nfs/dbraw/zinc/35/43/89/340354389.db2.gz INUGWYZHODQFML-UHFFFAOYSA-N 1 2 319.861 4.229 20 0 DIADLO COc1cc(C)[nH+]c(CSCCCCC2CCOCC2)c1 ZINC000512322268 340357004 /nfs/dbraw/zinc/35/70/04/340357004.db2.gz IWGKMVHABNLVMR-UHFFFAOYSA-N 1 2 309.475 4.229 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1cccc(N[C@@H](C)C(C)C)c1C ZINC000173173411 340359394 /nfs/dbraw/zinc/35/93/94/340359394.db2.gz HAFSXAASMCNXCL-HNNXBMFYSA-N 1 2 311.429 4.407 20 0 DIADLO CC(C)(C)c1ccc(C[N@@H+]2CCCC[C@@H]2c2ncc[nH]2)s1 ZINC000512487083 340363621 /nfs/dbraw/zinc/36/36/21/340363621.db2.gz PWVNIIAOPHHSFQ-CQSZACIVSA-N 1 2 303.475 4.496 20 0 DIADLO CC(C)(C)c1ccc(C[N@H+]2CCCC[C@@H]2c2ncc[nH]2)s1 ZINC000512487083 340363622 /nfs/dbraw/zinc/36/36/22/340363622.db2.gz PWVNIIAOPHHSFQ-CQSZACIVSA-N 1 2 303.475 4.496 20 0 DIADLO Clc1ccc(CN2CCCC[C@H]2c2[nH]cc[nH+]2)c(Cl)c1 ZINC000512527348 340365683 /nfs/dbraw/zinc/36/56/83/340365683.db2.gz QTPXFFMTASAAST-AWEZNQCLSA-N 1 2 310.228 4.444 20 0 DIADLO Cc1sccc1C[N@@H+]1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000512595405 340368304 /nfs/dbraw/zinc/36/83/04/340368304.db2.gz OQNJUTNZTPIGHA-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1sccc1C[N@H+]1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000512595405 340368305 /nfs/dbraw/zinc/36/83/05/340368305.db2.gz OQNJUTNZTPIGHA-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO CCC[N@@H+](Cc1ccc(OCc2ccccn2)cc1)CC(F)F ZINC000512647588 340370778 /nfs/dbraw/zinc/37/07/78/340370778.db2.gz FIUKBSMXSLWGFR-UHFFFAOYSA-N 1 2 320.383 4.138 20 0 DIADLO CCC[N@H+](Cc1ccc(OCc2ccccn2)cc1)CC(F)F ZINC000512647588 340370779 /nfs/dbraw/zinc/37/07/79/340370779.db2.gz FIUKBSMXSLWGFR-UHFFFAOYSA-N 1 2 320.383 4.138 20 0 DIADLO C[C@@H]1CC[C@@H](C)[N@H+](CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000174008153 340380005 /nfs/dbraw/zinc/38/00/05/340380005.db2.gz PLZBJAPGSOIOHJ-GHMZBOCLSA-N 1 2 315.244 4.052 20 0 DIADLO C[C@@H]1CC[C@@H](C)[N@@H+](CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000174008153 340380006 /nfs/dbraw/zinc/38/00/06/340380006.db2.gz PLZBJAPGSOIOHJ-GHMZBOCLSA-N 1 2 315.244 4.052 20 0 DIADLO CCn1nc(C[NH2+]C2(C(F)F)CCCCC2)c2ccccc21 ZINC000512866189 340381657 /nfs/dbraw/zinc/38/16/57/340381657.db2.gz XVFDSTGECHOYQG-UHFFFAOYSA-N 1 2 307.388 4.114 20 0 DIADLO Fc1cccc(Cl)c1CNc1ccc(N2CCCC2)c[nH+]1 ZINC000513055091 340391183 /nfs/dbraw/zinc/39/11/83/340391183.db2.gz XGKOIOPKQGLLIV-UHFFFAOYSA-N 1 2 305.784 4.086 20 0 DIADLO Cn1ccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2C(F)(F)F)n1 ZINC000513129105 340394479 /nfs/dbraw/zinc/39/44/79/340394479.db2.gz VWWPNLRNJKFGML-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1ccc(C[N@H+]2CCCC[C@@H]2c2ccccc2C(F)(F)F)n1 ZINC000513129105 340394480 /nfs/dbraw/zinc/39/44/80/340394480.db2.gz VWWPNLRNJKFGML-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1nccc1C[N@@H+]1CCCC[C@@H]1c1ccccc1C(F)(F)F ZINC000513134511 340394766 /nfs/dbraw/zinc/39/47/66/340394766.db2.gz YWHYVYRNBVSWJL-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1nccc1C[N@H+]1CCCC[C@@H]1c1ccccc1C(F)(F)F ZINC000513134511 340394767 /nfs/dbraw/zinc/39/47/67/340394767.db2.gz YWHYVYRNBVSWJL-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)ccc1Cl)c1c(F)cncc1F ZINC000513251442 340399260 /nfs/dbraw/zinc/39/92/60/340399260.db2.gz AXTBUOITBIDVEA-MRVPVSSYSA-N 1 2 300.711 4.003 20 0 DIADLO O=C(c1ccccc1Oc1cc[nH+]cc1)N1CC(C2CCCC2)C1 ZINC000514060647 340443467 /nfs/dbraw/zinc/44/34/67/340443467.db2.gz QFIMZIWZAZIEBJ-UHFFFAOYSA-N 1 2 322.408 4.136 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCC(Cc2cccnc2)CC1 ZINC000517191450 340465158 /nfs/dbraw/zinc/46/51/58/340465158.db2.gz MRPZWKZDMGNAGH-UHFFFAOYSA-N 1 2 317.436 4.397 20 0 DIADLO Cc1cccc([C@@H]2CCCN2C(=O)Nc2c(C)cc(C)[nH+]c2C)n1 ZINC000521200145 340483304 /nfs/dbraw/zinc/48/33/04/340483304.db2.gz NLPUQAMKAVYPTR-KRWDZBQOSA-N 1 2 324.428 4.079 20 0 DIADLO Cc1oc2ccccc2c1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000186020418 340507496 /nfs/dbraw/zinc/50/74/96/340507496.db2.gz MCHHGBRYZJAIER-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO COc1ccsc1[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000186146296 340508674 /nfs/dbraw/zinc/50/86/74/340508674.db2.gz JCQPDSQYAIOSDN-GFCCVEGCSA-N 1 2 314.410 4.263 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cn(C(C)(C)C)nn1)c1ccccc1Cl ZINC000191072718 340549698 /nfs/dbraw/zinc/54/96/98/340549698.db2.gz SQUNSXKKTRRHGF-MRXNPFEDSA-N 1 2 320.868 4.173 20 0 DIADLO CCc1c(NCc2[nH+]ccn2C(C)C)cnn1-c1ccccc1C ZINC000192689999 340568580 /nfs/dbraw/zinc/56/85/80/340568580.db2.gz FXVBMZZMBPIPRF-UHFFFAOYSA-N 1 2 323.444 4.133 20 0 DIADLO Fc1cc(NCc2cc(Cl)cs2)ccc1-n1cc[nH+]c1 ZINC000193161448 340573226 /nfs/dbraw/zinc/57/32/26/340573226.db2.gz KAGPEUSZRWQKNU-UHFFFAOYSA-N 1 2 307.781 4.338 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NCc2cc(Cl)cs2)c1 ZINC000193160237 340573251 /nfs/dbraw/zinc/57/32/51/340573251.db2.gz IRDWNBNVEVDPFW-UHFFFAOYSA-N 1 2 303.818 4.414 20 0 DIADLO CC[C@@H](CC(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccc(C)cc1 ZINC000523091980 340614886 /nfs/dbraw/zinc/61/48/86/340614886.db2.gz IBAXKDHRWVPPQI-INIZCTEOSA-N 1 2 321.424 4.474 20 0 DIADLO CC[C@H](C)[C@H](C)NC(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000523147192 340616829 /nfs/dbraw/zinc/61/68/29/340616829.db2.gz SGNDCNBSMNSGPH-ZFWWWQNUSA-N 1 2 312.413 4.347 20 0 DIADLO Cc1cn2cc(NC(=O)N3CCC[C@@H]3CC(C)(C)C)ccc2[nH+]1 ZINC000523418935 340623502 /nfs/dbraw/zinc/62/35/02/340623502.db2.gz KNZUFZAUQHSIFX-OAHLLOKOSA-N 1 2 314.433 4.075 20 0 DIADLO CC[C@@H]([NH2+]Cc1c(Cl)cccc1OC)c1ccc(F)cn1 ZINC000233896351 340649573 /nfs/dbraw/zinc/64/95/73/340649573.db2.gz PTXTWKXAFZQTAX-CQSZACIVSA-N 1 2 308.784 4.124 20 0 DIADLO Fc1c(Cl)cc(NCc2cn3ccccc3[nH+]2)cc1Cl ZINC000236279315 340662557 /nfs/dbraw/zinc/66/25/57/340662557.db2.gz FBPQHHXHRWMJIU-UHFFFAOYSA-N 1 2 310.159 4.392 20 0 DIADLO COc1cccc(OC(F)(F)F)c1C[NH2+][C@H](C)c1ccoc1 ZINC000575010258 340702071 /nfs/dbraw/zinc/70/20/71/340702071.db2.gz JBRZWYCIMFLUFB-SNVBAGLBSA-N 1 2 315.291 4.038 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1ncccc1Cl ZINC000528429703 340718312 /nfs/dbraw/zinc/71/83/12/340718312.db2.gz AWQFUMRYHKVARE-ZDUSSCGKSA-N 1 2 304.821 4.373 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2nc3cc(C)ccc3s2)cs1 ZINC000528447934 340719602 /nfs/dbraw/zinc/71/96/02/340719602.db2.gz IWVHMNGXJRZZNR-LLVKDONJSA-N 1 2 317.483 4.474 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1nc2ccccc2o1 ZINC000528653839 340727984 /nfs/dbraw/zinc/72/79/84/340727984.db2.gz ADNGNTHRQMCQIG-UGSOOPFHSA-N 1 2 307.397 4.415 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1cc(C)ccc1C ZINC000528801345 340735033 /nfs/dbraw/zinc/73/50/33/340735033.db2.gz NAGPPGKHLUWPDP-OAHLLOKOSA-N 1 2 301.434 4.225 20 0 DIADLO CCOC1(C)CC[NH+](Cc2c(F)ccc(F)c2Cl)CC1 ZINC000529575319 340763971 /nfs/dbraw/zinc/76/39/71/340763971.db2.gz SUJREYUJYRUHBI-UHFFFAOYSA-N 1 2 303.780 4.009 20 0 DIADLO COc1c(C)c[nH+]c(CSc2ccc(N)cc2Cl)c1C ZINC000037205006 340773351 /nfs/dbraw/zinc/77/33/51/340773351.db2.gz HJZHNCVLWBZKQB-UHFFFAOYSA-N 1 2 308.834 4.235 20 0 DIADLO Cc1ccccc1-c1cnc(C[NH2+]C2(c3ccccc3)CC2)o1 ZINC000538157762 340811696 /nfs/dbraw/zinc/81/16/96/340811696.db2.gz KZVXOVSMCBTGGY-UHFFFAOYSA-N 1 2 304.393 4.429 20 0 DIADLO FC(F)Oc1cccc(CSCc2c[nH+]c3ccccn23)c1 ZINC000538533033 340831933 /nfs/dbraw/zinc/83/19/33/340831933.db2.gz NLBRSUCJTJFYJS-UHFFFAOYSA-N 1 2 320.364 4.369 20 0 DIADLO COc1ccc(C[NH2+][C@@H](C)c2nc3c(s2)CCCC3)c(F)c1 ZINC000539057787 340868938 /nfs/dbraw/zinc/86/89/38/340868938.db2.gz IGAZNXFPZYFENM-NSHDSACASA-N 1 2 320.433 4.020 20 0 DIADLO C[C@@H]1C[C@H]1[C@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000539426860 340885174 /nfs/dbraw/zinc/88/51/74/340885174.db2.gz VZDVHOZCEWFPEV-QSGSBWRWSA-N 1 2 317.820 4.087 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1csc(C2CC2)n1 ZINC000128905255 340927654 /nfs/dbraw/zinc/92/76/54/340927654.db2.gz COSNODNMOGYVGM-UHFFFAOYSA-N 1 2 316.405 4.141 20 0 DIADLO Cc1ccnc(C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)n1 ZINC000540354864 340928314 /nfs/dbraw/zinc/92/83/14/340928314.db2.gz UCNOATTZMOPYAM-MRXNPFEDSA-N 1 2 319.408 4.428 20 0 DIADLO COC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1-c1ccc(Cl)cc1 ZINC000540414344 340930383 /nfs/dbraw/zinc/93/03/83/340930383.db2.gz NVLMGMZOEQQIOK-STQMWFEESA-N 1 2 317.816 4.219 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(F)cc1F ZINC000540424325 340930806 /nfs/dbraw/zinc/93/08/06/340930806.db2.gz JZCHPWKGJGVWCQ-KRWDZBQOSA-N 1 2 306.356 4.317 20 0 DIADLO Cn1ccc([C@H]([NH2+]Cc2cccs2)c2ccc(Cl)cc2)n1 ZINC000541748859 340982547 /nfs/dbraw/zinc/98/25/47/340982547.db2.gz GLNOFPASWMZDCL-MRXNPFEDSA-N 1 2 317.845 4.014 20 0 DIADLO CC(C)(C)c1csc(Cc2[nH+]ccn2Cc2ccccc2)n1 ZINC000542198455 340999446 /nfs/dbraw/zinc/99/94/46/340999446.db2.gz RRDHQSSBRKEETH-UHFFFAOYSA-N 1 2 311.454 4.276 20 0 DIADLO COc1cccc([C@H]2C[C@H](C)CN2c2[nH]c3ccccc3[nH+]2)c1 ZINC000542205343 340999785 /nfs/dbraw/zinc/99/97/85/340999785.db2.gz NOEHLGXPUQZANQ-SCLBCKFNSA-N 1 2 307.397 4.159 20 0 DIADLO Cc1ccc(C[NH2+][C@H](c2ccc(F)cc2)c2cnccn2)c(C)c1 ZINC000542479871 341009316 /nfs/dbraw/zinc/00/93/16/341009316.db2.gz XAYGTZDDNVCEFJ-HXUWFJFHSA-N 1 2 321.399 4.112 20 0 DIADLO c1csc(-c2cnc(C[NH2+][C@H](c3cccnc3)C3CC3)o2)c1 ZINC000542518771 341011777 /nfs/dbraw/zinc/01/17/77/341011777.db2.gz XKSKADIZDPCLQB-KRWDZBQOSA-N 1 2 311.410 4.039 20 0 DIADLO C[C@H](c1ccccc1Br)[N@H+](C)Cc1ccncc1 ZINC000130300223 341014873 /nfs/dbraw/zinc/01/48/73/341014873.db2.gz DRACIWCONCQDBY-GFCCVEGCSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@H](c1ccccc1Br)[N@@H+](C)Cc1ccncc1 ZINC000130300223 341014874 /nfs/dbraw/zinc/01/48/74/341014874.db2.gz DRACIWCONCQDBY-GFCCVEGCSA-N 1 2 305.219 4.037 20 0 DIADLO Cc1c2cc(Cl)ccc2oc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000070890787 341018111 /nfs/dbraw/zinc/01/81/11/341018111.db2.gz SSHXTEZKTFYCNB-UHFFFAOYSA-N 1 2 300.745 4.350 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1nc(C2CCCC2)no1 ZINC000130341828 341018851 /nfs/dbraw/zinc/01/88/51/341018851.db2.gz BLAKIKFWUQEXML-LBPRGKRZSA-N 1 2 303.381 4.059 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc(C2CCCC2)no1 ZINC000130341828 341018852 /nfs/dbraw/zinc/01/88/52/341018852.db2.gz BLAKIKFWUQEXML-LBPRGKRZSA-N 1 2 303.381 4.059 20 0 DIADLO Cc1ccc(Cc2noc(CCc3ccc(C(C)C)cc3)n2)c[nH+]1 ZINC000564259369 341020490 /nfs/dbraw/zinc/02/04/90/341020490.db2.gz ANBCYEAXLYMPIV-UHFFFAOYSA-N 1 2 321.424 4.272 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1ncccc1C(F)(F)F ZINC000130431472 341021553 /nfs/dbraw/zinc/02/15/53/341021553.db2.gz OUKFHEMEIBROCR-UHFFFAOYSA-N 1 2 324.346 4.131 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1ncccc1C(F)(F)F ZINC000130431472 341021554 /nfs/dbraw/zinc/02/15/54/341021554.db2.gz OUKFHEMEIBROCR-UHFFFAOYSA-N 1 2 324.346 4.131 20 0 DIADLO CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]Cc1nnc(C)s1 ZINC000542810999 341021632 /nfs/dbraw/zinc/02/16/32/341021632.db2.gz JTKZSMRMZJEPNQ-NSHDSACASA-N 1 2 315.442 4.314 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2ccco2)c2ccccc2OC)cc1 ZINC000130534196 341026870 /nfs/dbraw/zinc/02/68/70/341026870.db2.gz FCNXZOPPOWFTSB-HXUWFJFHSA-N 1 2 323.392 4.176 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2c(cccc2C)[nH]1)c1ccc(F)cc1F ZINC000130543896 341027226 /nfs/dbraw/zinc/02/72/26/341027226.db2.gz PKGDBCBXPIVDEM-OAHLLOKOSA-N 1 2 315.367 4.390 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2cccc(C)c2[nH]1)c1ccc(F)cc1F ZINC000130543896 341027227 /nfs/dbraw/zinc/02/72/27/341027227.db2.gz PKGDBCBXPIVDEM-OAHLLOKOSA-N 1 2 315.367 4.390 20 0 DIADLO C[C@H](C(=O)Nc1cccc(Cl)c1)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000543061726 341029932 /nfs/dbraw/zinc/02/99/32/341029932.db2.gz OUGDKALBTDCNEY-QWHCGFSZSA-N 1 2 314.816 4.244 20 0 DIADLO C[C@H](C(=O)Nc1cccc(Cl)c1)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000543061726 341029933 /nfs/dbraw/zinc/02/99/33/341029933.db2.gz OUGDKALBTDCNEY-QWHCGFSZSA-N 1 2 314.816 4.244 20 0 DIADLO CC[C@H]1CCN(C(=O)c2ccc(C)c(Oc3cc[nH+]cc3)c2)C1 ZINC000130614904 341033028 /nfs/dbraw/zinc/03/30/28/341033028.db2.gz CVJIZNBGEQJWDS-HNNXBMFYSA-N 1 2 310.397 4.054 20 0 DIADLO c1csc([C@H]([NH2+]Cc2noc(-c3ccsc3)n2)C2CC2)c1 ZINC000543438667 341044498 /nfs/dbraw/zinc/04/44/98/341044498.db2.gz LQNPSNDRFVEVRB-CQSZACIVSA-N 1 2 317.439 4.101 20 0 DIADLO c1csc([C@H]([NH2+]Cc2noc(-c3ccccc3)n2)C2CC2)c1 ZINC000543448309 341045264 /nfs/dbraw/zinc/04/52/64/341045264.db2.gz KLKAVNLMTKSAPF-MRXNPFEDSA-N 1 2 311.410 4.039 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+][C@H](C)c2ncc(C(C)(C)C)o2)cn1 ZINC000543504461 341047726 /nfs/dbraw/zinc/04/77/26/341047726.db2.gz UPMJQZPWMIIFRC-CHWSQXEVSA-N 1 2 304.438 4.161 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+][C@@H](C)c2ncc(C(C)(C)C)o2)cn1 ZINC000543504467 341047801 /nfs/dbraw/zinc/04/78/01/341047801.db2.gz UPMJQZPWMIIFRC-STQMWFEESA-N 1 2 304.438 4.161 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2nc(C3CCCC3)no2)cc1 ZINC000130844004 341048849 /nfs/dbraw/zinc/04/88/49/341048849.db2.gz PNOGRISYWYQUGT-INIZCTEOSA-N 1 2 315.392 4.203 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2nc(C3CCCC3)no2)cc1 ZINC000130844004 341048850 /nfs/dbraw/zinc/04/88/50/341048850.db2.gz PNOGRISYWYQUGT-INIZCTEOSA-N 1 2 315.392 4.203 20 0 DIADLO CC[C@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1ccn(C)n1 ZINC000543625475 341051506 /nfs/dbraw/zinc/05/15/06/341051506.db2.gz MEGSWLGBSPTYLZ-ZDUSSCGKSA-N 1 2 324.255 4.457 20 0 DIADLO Cc1nnc(C[NH2+]Cc2ccc(-c3cc(C)cc(C)c3)cc2)s1 ZINC000543729323 341055500 /nfs/dbraw/zinc/05/55/00/341055500.db2.gz MCSNGTBJYNUCGS-UHFFFAOYSA-N 1 2 323.465 4.420 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](c2cc3ccccc3o2)C(C)C)s1 ZINC000543739597 341056007 /nfs/dbraw/zinc/05/60/07/341056007.db2.gz FGJGFPCSEDUAKV-MRXNPFEDSA-N 1 2 301.415 4.080 20 0 DIADLO Cc1nnc(C[NH2+][C@H](C)c2ccc(-c3cccs3)cc2)s1 ZINC000543740136 341056089 /nfs/dbraw/zinc/05/60/89/341056089.db2.gz XKXPKYYWXUHIGA-LLVKDONJSA-N 1 2 315.467 4.426 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1C[N@@H+]([C@@H]2C=CCCC2)CCO1 ZINC000543806881 341059882 /nfs/dbraw/zinc/05/98/82/341059882.db2.gz DSFSWEBXDGIFHE-CJNGLKHVSA-N 1 2 311.347 4.187 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1C[N@H+]([C@@H]2C=CCCC2)CCO1 ZINC000543806881 341059883 /nfs/dbraw/zinc/05/98/83/341059883.db2.gz DSFSWEBXDGIFHE-CJNGLKHVSA-N 1 2 311.347 4.187 20 0 DIADLO Cc1ccc(Cc2noc(-c3ccc(OCC(C)C)cc3)n2)c[nH+]1 ZINC000544164701 341072528 /nfs/dbraw/zinc/07/25/28/341072528.db2.gz MVQBCLZGCWUZJR-UHFFFAOYSA-N 1 2 323.396 4.066 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2ncc(-c3cccs3)o2)cn1 ZINC000544471303 341083656 /nfs/dbraw/zinc/08/36/56/341083656.db2.gz OOAKCWVIJWPBDJ-GFCCVEGCSA-N 1 2 316.430 4.031 20 0 DIADLO C[C@@H](CCC(C)(C)C)C(=O)NCc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000544540566 341085162 /nfs/dbraw/zinc/08/51/62/341085162.db2.gz LNVVJMCFQKEVMC-AWEZNQCLSA-N 1 2 313.445 4.155 20 0 DIADLO CC[C@@H]([NH2+][C@@H](c1ccccc1)c1cccc(F)c1)c1ccn(C)n1 ZINC000544566414 341085879 /nfs/dbraw/zinc/08/58/79/341085879.db2.gz GLYXTMFXYKLEPX-QUCCMNQESA-N 1 2 323.415 4.390 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2ccn(-c3ccccc3)n2)C2CCC2)o1 ZINC000544578063 341086869 /nfs/dbraw/zinc/08/68/69/341086869.db2.gz QYJZZFXBGOXQNM-HXUWFJFHSA-N 1 2 321.424 4.405 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ccon2)cc1OC ZINC000544605966 341088389 /nfs/dbraw/zinc/08/83/89/341088389.db2.gz WCEIANFVTYTAQV-ZIAGYGMSSA-N 1 2 318.417 4.274 20 0 DIADLO COc1ccc2oc([C@H](C)[NH2+][C@H](C)c3ccon3)c(C)c2c1 ZINC000544605071 341088435 /nfs/dbraw/zinc/08/84/35/341088435.db2.gz XVSLBCWCSSIVAD-NEPJUHHUSA-N 1 2 300.358 4.150 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccon2)cc1OC ZINC000544605962 341088437 /nfs/dbraw/zinc/08/84/37/341088437.db2.gz WCEIANFVTYTAQV-KGLIPLIRSA-N 1 2 318.417 4.274 20 0 DIADLO Cc1ccc(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)c(C)c1 ZINC000544728430 341092292 /nfs/dbraw/zinc/09/22/92/341092292.db2.gz CWYRIRFWXPVIII-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Cc1cc(F)ccc1-c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000544740134 341092515 /nfs/dbraw/zinc/09/25/15/341092515.db2.gz YBQUEEQLBWQGSI-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1cnc(C2CC2)s1 ZINC000131598016 341100170 /nfs/dbraw/zinc/10/01/70/341100170.db2.gz PSLSEBHMLIOGRX-JTQLQIEISA-N 1 2 308.397 4.492 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cnc(C2CC2)s1 ZINC000131598016 341100171 /nfs/dbraw/zinc/10/01/71/341100171.db2.gz PSLSEBHMLIOGRX-JTQLQIEISA-N 1 2 308.397 4.492 20 0 DIADLO CC[C@H](Cc1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1)C(C)C ZINC000544954783 341101097 /nfs/dbraw/zinc/10/10/97/341101097.db2.gz QLNSNHMKSLPSAH-MRXNPFEDSA-N 1 2 324.428 4.206 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CCn1ccc2cc(Cl)ccc21 ZINC000131704853 341109376 /nfs/dbraw/zinc/10/93/76/341109376.db2.gz IPMNKGRCBSVXDO-UHFFFAOYSA-N 1 2 313.788 4.027 20 0 DIADLO Brc1ccccc1C[N@H+](Cc1ccccn1)C1CC1 ZINC000072979352 341111815 /nfs/dbraw/zinc/11/18/15/341111815.db2.gz BXDIGMGBPZTJCU-UHFFFAOYSA-N 1 2 317.230 4.009 20 0 DIADLO Brc1ccccc1C[N@@H+](Cc1ccccn1)C1CC1 ZINC000072979352 341111816 /nfs/dbraw/zinc/11/18/16/341111816.db2.gz BXDIGMGBPZTJCU-UHFFFAOYSA-N 1 2 317.230 4.009 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@H](C)[C@@H](C)C2)cc1Oc1cc[nH+]cc1 ZINC000131864249 341112885 /nfs/dbraw/zinc/11/28/85/341112885.db2.gz XYGACXAUPDDZPJ-HOCLYGCPSA-N 1 2 324.424 4.300 20 0 DIADLO CC[C@@H]([NH2+][C@@H]1COc2ccc(F)cc21)c1cc(F)ccc1F ZINC000545235836 341116400 /nfs/dbraw/zinc/11/64/00/341116400.db2.gz OSSQAFOIPOGLHK-HZPDHXFCSA-N 1 2 307.315 4.278 20 0 DIADLO CC[C@@H](C)c1csc([C@@H]2C[N@H+](Cc3ccccc3)CCO2)n1 ZINC000132507006 341125116 /nfs/dbraw/zinc/12/51/16/341125116.db2.gz XPMQDJUTZBNVNP-PBHICJAKSA-N 1 2 316.470 4.230 20 0 DIADLO CC[C@@H](C)c1csc([C@@H]2C[N@@H+](Cc3ccccc3)CCO2)n1 ZINC000132507006 341125117 /nfs/dbraw/zinc/12/51/17/341125117.db2.gz XPMQDJUTZBNVNP-PBHICJAKSA-N 1 2 316.470 4.230 20 0 DIADLO CC(=O)Nc1cccc(COc2cc(C)[nH+]c3c(C)cccc23)c1 ZINC000545472683 341126568 /nfs/dbraw/zinc/12/65/68/341126568.db2.gz VSXYGOMWKFCPDZ-UHFFFAOYSA-N 1 2 320.392 4.389 20 0 DIADLO c1ccc(COc2ccc[nH+]c2N[C@@H]2CCC[C@H]3OCC[C@@H]32)cc1 ZINC000545474388 341126766 /nfs/dbraw/zinc/12/67/66/341126766.db2.gz WFTYVVMCVLBJNG-KZNAEPCWSA-N 1 2 324.424 4.030 20 0 DIADLO CC[C@@]1(C)CCC[N@H+](CC(=O)Nc2c(C)cccc2Cl)C1 ZINC000132570075 341127867 /nfs/dbraw/zinc/12/78/67/341127867.db2.gz PMEYCPWIKOMOMU-KRWDZBQOSA-N 1 2 308.853 4.099 20 0 DIADLO CC[C@@]1(C)CCC[N@@H+](CC(=O)Nc2c(C)cccc2Cl)C1 ZINC000132570075 341127868 /nfs/dbraw/zinc/12/78/68/341127868.db2.gz PMEYCPWIKOMOMU-KRWDZBQOSA-N 1 2 308.853 4.099 20 0 DIADLO Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1noc(-c2ccsc2)n1 ZINC000545518687 341128180 /nfs/dbraw/zinc/12/81/80/341128180.db2.gz RQWPJOMZARCBDU-CYBMUJFWSA-N 1 2 313.426 4.266 20 0 DIADLO c1csc(-c2cc(C[N@@H+]3CCc4ccsc4C3)no2)c1 ZINC000132601073 341130372 /nfs/dbraw/zinc/13/03/72/341130372.db2.gz HYEZUPSZIPWVHF-UHFFFAOYSA-N 1 2 302.424 4.023 20 0 DIADLO c1csc(-c2cc(C[N@H+]3CCc4ccsc4C3)no2)c1 ZINC000132601073 341130373 /nfs/dbraw/zinc/13/03/73/341130373.db2.gz HYEZUPSZIPWVHF-UHFFFAOYSA-N 1 2 302.424 4.023 20 0 DIADLO CC1(C)C[C@@H]1c1noc(CCn2c3ccccc3[nH+]c2C2CC2)n1 ZINC000545613592 341133411 /nfs/dbraw/zinc/13/34/11/341133411.db2.gz CCNXAEGNQUNPOQ-CYBMUJFWSA-N 1 2 322.412 4.053 20 0 DIADLO C[C@H](CC1CCCCC1)c1nc(Cc2cn3ccccc3[nH+]2)no1 ZINC000545622570 341133789 /nfs/dbraw/zinc/13/37/89/341133789.db2.gz MIDXKJACHBJQBZ-CQSZACIVSA-N 1 2 324.428 4.382 20 0 DIADLO Cc1ccc(Cc2noc(C3(Cc4ccccc4)CCC3)n2)c[nH+]1 ZINC000545638639 341134435 /nfs/dbraw/zinc/13/44/35/341134435.db2.gz WVMQINSOHZANJO-UHFFFAOYSA-N 1 2 319.408 4.028 20 0 DIADLO Fc1ccc(-c2nc(C[N@@H+]3CCc4ccsc4C3)co2)cc1 ZINC000132734774 341144267 /nfs/dbraw/zinc/14/42/67/341144267.db2.gz RAQFIBDFQBIZFL-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1ccc(-c2nc(C[N@H+]3CCc4ccsc4C3)co2)cc1 ZINC000132734774 341144268 /nfs/dbraw/zinc/14/42/68/341144268.db2.gz RAQFIBDFQBIZFL-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)c(C)[nH+]1 ZINC000132901881 341149004 /nfs/dbraw/zinc/14/90/04/341149004.db2.gz VSWBKIIUZPROAA-ZFWWWQNUSA-N 1 2 316.351 4.027 20 0 DIADLO Cc1nc([C@@H]([NH2+]CC2CCC(C)CC2)c2ccccc2F)no1 ZINC000133128491 341156427 /nfs/dbraw/zinc/15/64/27/341156427.db2.gz FTUSMYZURZOSDW-AJUCZRQESA-N 1 2 317.408 4.022 20 0 DIADLO CCCC[C@@H](CC)Cc1nc(Cc2cn3ccccc3[nH+]2)no1 ZINC000546335513 341163958 /nfs/dbraw/zinc/16/39/58/341163958.db2.gz SWNVQZSHZFDCDA-CQSZACIVSA-N 1 2 312.417 4.067 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc([C@H]2CCCC[C@H]2C)no1 ZINC000546397757 341166568 /nfs/dbraw/zinc/16/65/68/341166568.db2.gz KKEYWMKMFAFUCJ-OCCSQVGLSA-N 1 2 310.401 4.070 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc([C@@H]2CCCC[C@H]2C)no1 ZINC000546397758 341166600 /nfs/dbraw/zinc/16/66/00/341166600.db2.gz KKEYWMKMFAFUCJ-TZMCWYRMSA-N 1 2 310.401 4.070 20 0 DIADLO C[N@H+](Cc1ccncc1Cl)Cc1ccccc1C(F)(F)F ZINC000075596544 341179178 /nfs/dbraw/zinc/17/91/78/341179178.db2.gz KWPYEGDMIOMSES-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccncc1Cl)Cc1ccccc1C(F)(F)F ZINC000075596544 341179179 /nfs/dbraw/zinc/17/91/79/341179179.db2.gz KWPYEGDMIOMSES-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO Clc1cnccc1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC000075746235 341181788 /nfs/dbraw/zinc/18/17/88/341181788.db2.gz FCAMFUGOHIYQDZ-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cnccc1C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC000075746235 341181789 /nfs/dbraw/zinc/18/17/89/341181789.db2.gz FCAMFUGOHIYQDZ-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Cc1nc(C[N@H+]2C[C@H](c3cc(C)ccc3C)OC[C@H]2C)cs1 ZINC000075837279 341185242 /nfs/dbraw/zinc/18/52/42/341185242.db2.gz WKKUIMUPCWSJTF-RDTXWAMCSA-N 1 2 316.470 4.030 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@H](c3cc(C)ccc3C)OC[C@H]2C)cs1 ZINC000075837279 341185243 /nfs/dbraw/zinc/18/52/43/341185243.db2.gz WKKUIMUPCWSJTF-RDTXWAMCSA-N 1 2 316.470 4.030 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2nc(C(C)(C)C)no2)C1 ZINC000075842985 341185974 /nfs/dbraw/zinc/18/59/74/341185974.db2.gz JSKHVJAEMYBDLW-SWLSCSKDSA-N 1 2 317.408 4.089 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2nc(C(C)(C)C)no2)C1 ZINC000075842985 341185975 /nfs/dbraw/zinc/18/59/75/341185975.db2.gz JSKHVJAEMYBDLW-SWLSCSKDSA-N 1 2 317.408 4.089 20 0 DIADLO Cc1ccc(Cc2nc(-c3ccccc3C(F)(F)F)no2)c[nH+]1 ZINC000546940164 341187953 /nfs/dbraw/zinc/18/79/53/341187953.db2.gz UUGPSNQZEAOJTE-UHFFFAOYSA-N 1 2 319.286 4.050 20 0 DIADLO Cc1cccn2cc(Cc3noc([C@H](C)CC4CCCC4)n3)[nH+]c12 ZINC000547089766 341195512 /nfs/dbraw/zinc/19/55/12/341195512.db2.gz CVNFMDYUAFWROC-CQSZACIVSA-N 1 2 324.428 4.300 20 0 DIADLO Clc1ccccc1-c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000547101394 341195875 /nfs/dbraw/zinc/19/58/75/341195875.db2.gz OIOBNRKLDDVYAO-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO C(=C\c1ccccc1)\c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000547104362 341196071 /nfs/dbraw/zinc/19/60/71/341196071.db2.gz RGZHUVQTIHPZIA-KTKRTIGZSA-N 1 2 314.348 4.093 20 0 DIADLO Clc1snnc1C[NH2+]C1(c2ccccc2)CCCCC1 ZINC000134042762 341205108 /nfs/dbraw/zinc/20/51/08/341205108.db2.gz RLDMRSWKDDAQEM-UHFFFAOYSA-N 1 2 307.850 4.141 20 0 DIADLO Cc1cc(NC(=O)c2ccc(OC3CCC3)cc2Cl)cc[nH+]1 ZINC000134396054 341214689 /nfs/dbraw/zinc/21/46/89/341214689.db2.gz COMGYPHVFOGBNX-UHFFFAOYSA-N 1 2 316.788 4.227 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@H](COCC(C)C)c2ccco2)o1 ZINC000152642124 341215902 /nfs/dbraw/zinc/21/59/02/341215902.db2.gz SXDFYXLVJURABI-GOEBONIOSA-N 1 2 305.418 4.500 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)nc2ccccc12 ZINC000547517968 341219773 /nfs/dbraw/zinc/21/97/73/341219773.db2.gz KAMVIORZSRORDG-JSGCOSHPSA-N 1 2 323.362 4.101 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)nc2ccccc12 ZINC000547517968 341219774 /nfs/dbraw/zinc/21/97/74/341219774.db2.gz KAMVIORZSRORDG-JSGCOSHPSA-N 1 2 323.362 4.101 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+](Cc2nccs2)C2CC2)cc1 ZINC000134960109 341227337 /nfs/dbraw/zinc/22/73/37/341227337.db2.gz BVFAJWFQJKBWRT-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+](Cc2nccs2)C2CC2)cc1 ZINC000134960109 341227338 /nfs/dbraw/zinc/22/73/38/341227338.db2.gz BVFAJWFQJKBWRT-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO C[C@@H]1C[C@H](C)[N@H+]1Cc1csc(Cc2ccc(Cl)cc2)n1 ZINC000547769069 341231398 /nfs/dbraw/zinc/23/13/98/341231398.db2.gz LHJVENNQZYEXFA-TXEJJXNPSA-N 1 2 306.862 4.370 20 0 DIADLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1csc(Cc2ccc(Cl)cc2)n1 ZINC000547769069 341231399 /nfs/dbraw/zinc/23/13/99/341231399.db2.gz LHJVENNQZYEXFA-TXEJJXNPSA-N 1 2 306.862 4.370 20 0 DIADLO CCc1ccc(NC(=O)Nc2ccc3c(c2)[nH+]c(C)n3C)cc1 ZINC000547828661 341235799 /nfs/dbraw/zinc/23/57/99/341235799.db2.gz CKBCJNGARHOYNX-UHFFFAOYSA-N 1 2 308.385 4.088 20 0 DIADLO Cc1ccc(-c2cncc(C(=O)Nc3cc[nH+]c(C)c3)c2)cc1 ZINC000135508382 341241112 /nfs/dbraw/zinc/24/11/12/341241112.db2.gz TYQVJKOGHXJOEA-UHFFFAOYSA-N 1 2 303.365 4.013 20 0 DIADLO Cc1ccc(OCc2nc(C[NH+]3[C@@H](C)C[C@@H]3C)cs2)cc1 ZINC000548097790 341247105 /nfs/dbraw/zinc/24/71/05/341247105.db2.gz YQIUKRNSYHMWET-KBPBESRZSA-N 1 2 302.443 4.013 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)c(C)s1 ZINC000548300860 341255023 /nfs/dbraw/zinc/25/50/23/341255023.db2.gz WLNVUYBDJYAVKS-QGZVFWFLSA-N 1 2 323.408 4.217 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)c(C)s1 ZINC000548300860 341255024 /nfs/dbraw/zinc/25/50/24/341255024.db2.gz WLNVUYBDJYAVKS-QGZVFWFLSA-N 1 2 323.408 4.217 20 0 DIADLO COC[C@H]([NH2+]Cc1cnc(C2CCCC2)s1)c1ccc(C)o1 ZINC000136270135 341256128 /nfs/dbraw/zinc/25/61/28/341256128.db2.gz RUSWSUBNECOHKX-HNNXBMFYSA-N 1 2 320.458 4.179 20 0 DIADLO C[C@H]1C[C@H](C)[NH+]1Cc1cc(Br)ccc1OC(F)F ZINC000548425907 341260023 /nfs/dbraw/zinc/26/00/23/341260023.db2.gz OYQRGFZDEJWWGR-IUCAKERBSA-N 1 2 320.177 4.033 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000548628467 341267794 /nfs/dbraw/zinc/26/77/94/341267794.db2.gz FFLYMBGGGFLRKT-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000548628467 341267795 /nfs/dbraw/zinc/26/77/95/341267795.db2.gz FFLYMBGGGFLRKT-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO Cc1ccc(C)c(NC(=O)C[N@@H+](C)Cc2cc3ccccc3o2)c1 ZINC000080061441 341269001 /nfs/dbraw/zinc/26/90/01/341269001.db2.gz DECYJWXWFZWRLN-UHFFFAOYSA-N 1 2 322.408 4.120 20 0 DIADLO Cc1ccc(C)c(NC(=O)C[N@H+](C)Cc2cc3ccccc3o2)c1 ZINC000080061441 341269002 /nfs/dbraw/zinc/26/90/02/341269002.db2.gz DECYJWXWFZWRLN-UHFFFAOYSA-N 1 2 322.408 4.120 20 0 DIADLO c1[nH+]c(-c2ccc(N[C@H]3CCC[C@H]4C[C@H]43)cc2)n2c1CCCC2 ZINC000548884918 341279820 /nfs/dbraw/zinc/27/98/20/341279820.db2.gz FXUDWNIHHIRFNK-IPELMVKDSA-N 1 2 307.441 4.487 20 0 DIADLO CCCOc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000548899236 341280279 /nfs/dbraw/zinc/28/02/79/341280279.db2.gz PWPKSQGKWPOOAS-UHFFFAOYSA-N 1 2 307.397 4.273 20 0 DIADLO Cc1ccncc1C[N@@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000548944521 341281983 /nfs/dbraw/zinc/28/19/83/341281983.db2.gz XWCDIGGKMNSUCU-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccncc1C[N@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000548944521 341281984 /nfs/dbraw/zinc/28/19/84/341281984.db2.gz XWCDIGGKMNSUCU-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO CCN(C(=O)c1cccc(Oc2cc[nH+]cc2)c1)[C@@H](C)C(C)C ZINC000564360883 341282813 /nfs/dbraw/zinc/28/28/13/341282813.db2.gz XPBCLARYYQDRMO-HNNXBMFYSA-N 1 2 312.413 4.381 20 0 DIADLO CCC1(CNC(=O)c2ccccc2Oc2cc[nH+]cc2)CCC1 ZINC000549016600 341283662 /nfs/dbraw/zinc/28/36/62/341283662.db2.gz LGNGMVIIRXXZBT-UHFFFAOYSA-N 1 2 310.397 4.184 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1Cn1c2ccc(Cl)cc2oc1=O ZINC000549035628 341284181 /nfs/dbraw/zinc/28/41/81/341284181.db2.gz FPHSTBHZJUIVEQ-UHFFFAOYSA-N 1 2 316.788 4.123 20 0 DIADLO Cc1nc(-c2ccc(OCc3ccc(C(C)C)[nH+]c3C)cc2)no1 ZINC000549041893 341284678 /nfs/dbraw/zinc/28/46/78/341284678.db2.gz XQJSDIVUAMRGFP-UHFFFAOYSA-N 1 2 323.396 4.451 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@H+]1CC[C@H](OC(F)F)C1 ZINC000549080753 341285719 /nfs/dbraw/zinc/28/57/19/341285719.db2.gz FMPSUHCTGMGPNB-SCZZXKLOSA-N 1 2 310.171 4.368 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+]1CC[C@H](OC(F)F)C1 ZINC000549080753 341285718 /nfs/dbraw/zinc/28/57/18/341285718.db2.gz FMPSUHCTGMGPNB-SCZZXKLOSA-N 1 2 310.171 4.368 20 0 DIADLO CCc1cc(N2CC(C)(C)[C@@H]3CCC[C@H]32)nc(-c2ccncc2)[nH+]1 ZINC000549267593 341290028 /nfs/dbraw/zinc/29/00/28/341290028.db2.gz LTSMLWLHSWYKSU-IAGOWNOFSA-N 1 2 322.456 4.116 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1C[C@@H](C)OC[C@@H]1c1ccccc1 ZINC000549463996 341295269 /nfs/dbraw/zinc/29/52/69/341295269.db2.gz BJAVNDIGPUZXFB-IIBYNOLFSA-N 1 2 324.468 4.475 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1C[C@@H](C)OC[C@@H]1c1ccccc1 ZINC000549463996 341295270 /nfs/dbraw/zinc/29/52/70/341295270.db2.gz BJAVNDIGPUZXFB-IIBYNOLFSA-N 1 2 324.468 4.475 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000245484568 341296710 /nfs/dbraw/zinc/29/67/10/341296710.db2.gz HQZYDCLIVUKUJO-PIIMJCKOSA-N 1 2 308.381 4.249 20 0 DIADLO Cc1nc([C@H]([NH2+]C[C@H]2CCC[C@@H](C)C2)c2ccccc2F)no1 ZINC000245515281 341298760 /nfs/dbraw/zinc/29/87/60/341298760.db2.gz HIOFJPJZSOFTPT-HACGYAERSA-N 1 2 317.408 4.022 20 0 DIADLO Cc1cccnc1C[N@H+]1C[C@H](c2ccccc2Cl)OC[C@H]1C ZINC000245546981 341301081 /nfs/dbraw/zinc/30/10/81/341301081.db2.gz WXYUABJLHXNUML-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cccnc1C[N@@H+]1C[C@H](c2ccccc2Cl)OC[C@H]1C ZINC000245546981 341301082 /nfs/dbraw/zinc/30/10/82/341301082.db2.gz WXYUABJLHXNUML-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO C[C@@H]1C[C@H]1[C@@H]([NH2+]Cc1noc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000245908539 341317983 /nfs/dbraw/zinc/31/79/83/341317983.db2.gz OZUKFESVGBIESG-HQQWDMGQSA-N 1 2 317.820 4.087 20 0 DIADLO CCCC[C@H](CCC)C[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000550679989 341321333 /nfs/dbraw/zinc/32/13/33/341321333.db2.gz DUYBWRAZONQKTL-ZFWWWQNUSA-N 1 2 306.479 4.152 20 0 DIADLO Cc1noc(C(C)(C)[NH2+]Cc2cccc(-c3ccccc3)c2)n1 ZINC000551227663 341334425 /nfs/dbraw/zinc/33/44/25/341334425.db2.gz PZTBYVZMCOZLET-UHFFFAOYSA-N 1 2 307.397 4.070 20 0 DIADLO Cc1nc(-c2cc([C@@H](C)[NH2+]CC(C)(F)F)cs2)cs1 ZINC000551240752 341335109 /nfs/dbraw/zinc/33/51/09/341335109.db2.gz HAZNQQXCNXVEAR-MRVPVSSYSA-N 1 2 302.415 4.486 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cccc(-c4nccs4)c3)cn2c1 ZINC000551245027 341335407 /nfs/dbraw/zinc/33/54/07/341335407.db2.gz NRYNKQLDVUPTOA-UHFFFAOYSA-N 1 2 320.421 4.378 20 0 DIADLO Cc1ccccc1[C@H](C)[N@@H+](Cc1noc(C2CC2)n1)CC(C)C ZINC000551422138 341341270 /nfs/dbraw/zinc/34/12/70/341341270.db2.gz XQQFEYWLXLAHDY-HNNXBMFYSA-N 1 2 313.445 4.475 20 0 DIADLO Cc1ccccc1[C@H](C)[N@H+](Cc1noc(C2CC2)n1)CC(C)C ZINC000551422138 341341271 /nfs/dbraw/zinc/34/12/71/341341271.db2.gz XQQFEYWLXLAHDY-HNNXBMFYSA-N 1 2 313.445 4.475 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000246402667 341347599 /nfs/dbraw/zinc/34/75/99/341347599.db2.gz BOZMJFUHDGEZRO-MEDUHNTESA-N 1 2 309.381 4.161 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000246402667 341347600 /nfs/dbraw/zinc/34/76/00/341347600.db2.gz BOZMJFUHDGEZRO-MEDUHNTESA-N 1 2 309.381 4.161 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@H](C)c2ncc(-c3ccc(Cl)cc3)o2)CCO1 ZINC000246894085 341358346 /nfs/dbraw/zinc/35/83/46/341358346.db2.gz XJIXXPPBVUELEZ-IUODEOHRSA-N 1 2 320.820 4.167 20 0 DIADLO CC[C@@H]1C[N@H+]([C@H](C)c2ncc(-c3ccc(Cl)cc3)o2)CCO1 ZINC000246894085 341358347 /nfs/dbraw/zinc/35/83/47/341358347.db2.gz XJIXXPPBVUELEZ-IUODEOHRSA-N 1 2 320.820 4.167 20 0 DIADLO C[C@@]1(c2ccccc2)CCC[N@H+](Cc2nnsc2Cl)CC1 ZINC000552092305 341369182 /nfs/dbraw/zinc/36/91/82/341369182.db2.gz SHMFYIFFTOYDQK-MRXNPFEDSA-N 1 2 321.877 4.135 20 0 DIADLO C[C@@]1(c2ccccc2)CCC[N@@H+](Cc2nnsc2Cl)CC1 ZINC000552092305 341369183 /nfs/dbraw/zinc/36/91/83/341369183.db2.gz SHMFYIFFTOYDQK-MRXNPFEDSA-N 1 2 321.877 4.135 20 0 DIADLO CC[N@H+](CCCNC(=O)C[C@@H](C)c1ccccc1)c1ccccc1 ZINC000248151987 341374081 /nfs/dbraw/zinc/37/40/81/341374081.db2.gz AAURBBDRHBSWAT-GOSISDBHSA-N 1 2 324.468 4.213 20 0 DIADLO CC[N@@H+](CCCNC(=O)C[C@@H](C)c1ccccc1)c1ccccc1 ZINC000248151987 341374082 /nfs/dbraw/zinc/37/40/82/341374082.db2.gz AAURBBDRHBSWAT-GOSISDBHSA-N 1 2 324.468 4.213 20 0 DIADLO Cc1ccc(CS(=O)(=O)CC[C@H]2C[C@H](C)C[C@H](C)C2)c(C)[nH+]1 ZINC000248425681 341377486 /nfs/dbraw/zinc/37/74/86/341377486.db2.gz LCWFJAUUUSYNSU-HALDLXJZSA-N 1 2 323.502 4.076 20 0 DIADLO FC(F)Oc1ccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)cn1 ZINC000552260552 341382012 /nfs/dbraw/zinc/38/20/12/341382012.db2.gz HHCWDQBLHMQNAH-CQSZACIVSA-N 1 2 322.359 4.140 20 0 DIADLO FC(F)Oc1ccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)cn1 ZINC000552260551 341382057 /nfs/dbraw/zinc/38/20/57/341382057.db2.gz HHCWDQBLHMQNAH-AWEZNQCLSA-N 1 2 322.359 4.140 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)n1 ZINC000248791017 341386961 /nfs/dbraw/zinc/38/69/61/341386961.db2.gz NOKORCHLQKSVKS-GHMZBOCLSA-N 1 2 319.371 4.164 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)n1 ZINC000248791017 341386962 /nfs/dbraw/zinc/38/69/62/341386962.db2.gz NOKORCHLQKSVKS-GHMZBOCLSA-N 1 2 319.371 4.164 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+]CC(F)(F)c1ccc(Cl)cc1 ZINC000552334967 341387406 /nfs/dbraw/zinc/38/74/06/341387406.db2.gz DNCUHDBLZZGZBP-GFCCVEGCSA-N 1 2 310.775 4.486 20 0 DIADLO COC[C@H]([NH2+]Cc1csc(-c2ccccc2)n1)c1ccccc1 ZINC000552433343 341393563 /nfs/dbraw/zinc/39/35/63/341393563.db2.gz YMQGGXGXAPZIHG-SFHVURJKSA-N 1 2 324.449 4.287 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](C)C/C(C)=C\c2ccccc2)cs1 ZINC000552486846 341395937 /nfs/dbraw/zinc/39/59/37/341395937.db2.gz BVHMYTDUYKRUBW-BAAYTWLHSA-N 1 2 316.470 4.386 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](C)C/C(C)=C\c2ccccc2)cs1 ZINC000552486846 341395938 /nfs/dbraw/zinc/39/59/38/341395938.db2.gz BVHMYTDUYKRUBW-BAAYTWLHSA-N 1 2 316.470 4.386 20 0 DIADLO Cc1nc(CSCc2cn3cccc(C)c3[nH+]2)sc1C ZINC000088307006 341398928 /nfs/dbraw/zinc/39/89/28/341398928.db2.gz JICBVDHASRUNLD-UHFFFAOYSA-N 1 2 303.456 4.149 20 0 DIADLO COc1cccc2c(N3CCC(CC(F)(F)F)CC3)cc[nH+]c12 ZINC000553592056 341432153 /nfs/dbraw/zinc/43/21/53/341432153.db2.gz IGRJHIINOKEHGE-UHFFFAOYSA-N 1 2 324.346 4.412 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC000554386809 341452935 /nfs/dbraw/zinc/45/29/35/341452935.db2.gz CUYHTHNQAVMUKW-QZTJIDSGSA-N 1 2 323.440 4.231 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1nc(C2CCCCC2)no1 ZINC000554864538 341467296 /nfs/dbraw/zinc/46/72/96/341467296.db2.gz APWKRVSCOFVLII-CXAGYDPISA-N 1 2 311.429 4.455 20 0 DIADLO FC(F)(F)c1ccc(-c2nc(CNc3c[nH]c[nH+]3)cs2)cc1 ZINC000555104180 341475242 /nfs/dbraw/zinc/47/52/42/341475242.db2.gz GQHLMNNHANOLPX-UHFFFAOYSA-N 1 2 324.331 4.164 20 0 DIADLO CC(F)(F)C[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000555609823 341487006 /nfs/dbraw/zinc/48/70/06/341487006.db2.gz LPRDXMOSAWUFTC-UHFFFAOYSA-N 1 2 302.777 4.208 20 0 DIADLO C[C@]1(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)C[C@H]2C[C@H]2C1 ZINC000555626664 341487679 /nfs/dbraw/zinc/48/76/79/341487679.db2.gz WPKGSRZETFQSGH-BDQBCWGISA-N 1 2 308.381 4.249 20 0 DIADLO C[C@@H](CC1CCCCC1)NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000556045020 341492837 /nfs/dbraw/zinc/49/28/37/341492837.db2.gz LNYDIJPFIMCCPS-HOCLYGCPSA-N 1 2 318.465 4.005 20 0 DIADLO COc1cc(C)[nH+]c(CSC[C@@H](OC)c2ccccc2)c1 ZINC000556112997 341494717 /nfs/dbraw/zinc/49/47/17/341494717.db2.gz MGEHWHANUCAPNI-QGZVFWFLSA-N 1 2 303.427 4.020 20 0 DIADLO O=C(C/C=C\c1ccc(F)cc1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000254950657 341494725 /nfs/dbraw/zinc/49/47/25/341494725.db2.gz NDSXCYQHVRJVJI-UPHRSURJSA-N 1 2 321.355 4.258 20 0 DIADLO CC(F)(F)C[NH2+][C@H](c1ccc(Br)cc1)C1CC1 ZINC000556227015 341498119 /nfs/dbraw/zinc/49/81/19/341498119.db2.gz FTUSWFWCNGWTSC-LBPRGKRZSA-N 1 2 304.178 4.145 20 0 DIADLO CC(C)OCCC[NH2+][C@H](c1cccc(OC(C)C)c1)C(F)F ZINC000556238643 341498582 /nfs/dbraw/zinc/49/85/82/341498582.db2.gz LZNPBGFASBLDHV-MRXNPFEDSA-N 1 2 315.404 4.185 20 0 DIADLO CC(C)Oc1cccc([C@@H]([NH2+]C[C@H]2CCCS2)C(F)F)c1 ZINC000556260535 341499820 /nfs/dbraw/zinc/49/98/20/341499820.db2.gz FJFNUMXMMFONKM-HUUCEWRRSA-N 1 2 315.429 4.265 20 0 DIADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccc(F)cc1F ZINC000152714785 341502876 /nfs/dbraw/zinc/50/28/76/341502876.db2.gz AMGGZQRSUUXQPI-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCc3ccc(Cl)cn3)c2c1 ZINC000564702372 341507238 /nfs/dbraw/zinc/50/72/38/341507238.db2.gz QPHSTIQAPKXWPT-UHFFFAOYSA-N 1 2 314.772 4.179 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccccc3OC(C)(C)C)ccn12 ZINC000565188711 341519787 /nfs/dbraw/zinc/51/97/87/341519787.db2.gz ODTONALIZMIUSI-UHFFFAOYSA-N 1 2 323.396 4.072 20 0 DIADLO CC[C@@H]1CCCC[C@H]1c1noc([C@H](c2ccccc2)[NH+](C)C)n1 ZINC000566013212 341545440 /nfs/dbraw/zinc/54/54/40/341545440.db2.gz IXQJKCCPZWFODU-OIISXLGYSA-N 1 2 313.445 4.404 20 0 DIADLO CCSc1cccc(F)c1NCc1cn2ccccc2[nH+]1 ZINC000566829402 341569388 /nfs/dbraw/zinc/56/93/88/341569388.db2.gz OIODEPHSAKKJKQ-UHFFFAOYSA-N 1 2 301.390 4.198 20 0 DIADLO C[C@H]1CCCC[C@@H]1NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000566985085 341573479 /nfs/dbraw/zinc/57/34/79/341573479.db2.gz IMMGJTLTJJKSLG-YOEHRIQHSA-N 1 2 310.397 4.182 20 0 DIADLO CCn1ccnc1C[NH2+][C@@H](c1ccccc1)c1cc(C)ccc1C ZINC000263883163 341575834 /nfs/dbraw/zinc/57/58/34/341575834.db2.gz FTYWPEWMTFLCSX-NRFANRHFSA-N 1 2 319.452 4.399 20 0 DIADLO Fc1cccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)c1F ZINC000567311321 341594515 /nfs/dbraw/zinc/59/45/15/341594515.db2.gz LYPIRCPCOCUJNN-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO Cc1cccc2[nH+]c(C[S@@](=O)c3ccc(C(C)C)cc3)cn21 ZINC000155568808 341609446 /nfs/dbraw/zinc/60/94/46/341609446.db2.gz HALFEBFHVFSKHY-QFIPXVFZSA-N 1 2 312.438 4.074 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1Cl)c1ccc(C)o1 ZINC000156411148 341621049 /nfs/dbraw/zinc/62/10/49/341621049.db2.gz GUSWMXHDXKZIIO-IAQYHMDHSA-N 1 2 311.784 4.419 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H]2C[C@H](C)Sc3sccc32)s1 ZINC000274140698 341641081 /nfs/dbraw/zinc/64/10/81/341641081.db2.gz DCKVWYGELASDKH-DKCNOQQISA-N 1 2 311.501 4.184 20 0 DIADLO Fc1cc(-c2ccncc2)ccc1C[NH2+]Cc1cnc(C2CC2)o1 ZINC000568591666 341675960 /nfs/dbraw/zinc/67/59/60/341675960.db2.gz XFXGQORZTAEUNS-UHFFFAOYSA-N 1 2 323.371 4.043 20 0 DIADLO CCCc1csc(C[NH2+][C@@H](COC)c2cccc(Cl)c2)n1 ZINC000568808186 341682289 /nfs/dbraw/zinc/68/22/89/341682289.db2.gz NVESBIKNIDRXCT-HNNXBMFYSA-N 1 2 324.877 4.226 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1nc2ccc(F)cc2o1 ZINC000163484608 341698906 /nfs/dbraw/zinc/69/89/06/341698906.db2.gz BVUZBGGLDPUECX-UHFFFAOYSA-N 1 2 314.360 4.000 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@H](c2ccccc2F)[C@H](C)O)cs1 ZINC000572967316 341711528 /nfs/dbraw/zinc/71/15/28/341711528.db2.gz YRTKWWZXXKKMTL-MKBNYLNASA-N 1 2 322.449 4.178 20 0 DIADLO O=C(NC12CCC(CC1)CC2)c1ccccc1Oc1cc[nH+]cc1 ZINC000573184460 341720198 /nfs/dbraw/zinc/72/01/98/341720198.db2.gz VCXBGSRTQHDVCZ-UHFFFAOYSA-N 1 2 322.408 4.327 20 0 DIADLO Fc1cc(C[NH+]2CC3(CCC3(F)F)C2)cc(C(F)(F)F)c1 ZINC000573412297 341727816 /nfs/dbraw/zinc/72/78/16/341727816.db2.gz IGFJRSIABCORCH-UHFFFAOYSA-N 1 2 309.253 4.076 20 0 DIADLO COc1cccc2cc([C@H](C)[NH2+][C@@H](C)c3cscn3)oc21 ZINC000573466731 341729203 /nfs/dbraw/zinc/72/92/03/341729203.db2.gz CLYGBOSYNDLNPC-QWRGUYRKSA-N 1 2 302.399 4.310 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2ccc(-c3ccccn3)nc2)cs1 ZINC000575863512 341811297 /nfs/dbraw/zinc/81/12/97/341811297.db2.gz OJKNAZIQWNXLDA-ZDUSSCGKSA-N 1 2 324.453 4.013 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)s1 ZINC000341843900 341834371 /nfs/dbraw/zinc/83/43/71/341834371.db2.gz NVPRPUAZKFCSLD-ZETCQYMHSA-N 1 2 302.230 4.004 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](CC(C)C)c2ccccc2)n1 ZINC000192567819 341875779 /nfs/dbraw/zinc/87/57/79/341875779.db2.gz ODJPIXLGRXFFFR-INIZCTEOSA-N 1 2 301.434 4.289 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)CN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000192654240 341882373 /nfs/dbraw/zinc/88/23/73/341882373.db2.gz MQCDQCDZDAFBHX-WFASDCNBSA-N 1 2 322.330 4.067 20 0 DIADLO Oc1ccc(C2=CCN(c3cc(C(F)(F)F)cc[nH+]3)CC2)cc1 ZINC000176753413 341900156 /nfs/dbraw/zinc/90/01/56/341900156.db2.gz MMRHNYMDLPGZCD-UHFFFAOYSA-N 1 2 320.314 4.100 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2coc(C)n2)c2ccc(C)cc2)cc1 ZINC000577510479 341914546 /nfs/dbraw/zinc/91/45/46/341914546.db2.gz MAWBKQZAQLFOMK-HXUWFJFHSA-N 1 2 322.408 4.179 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccccc1)c1ccc(F)cc1)c1cnccn1 ZINC000177765724 341937781 /nfs/dbraw/zinc/93/77/81/341937781.db2.gz FBIGIJILKAUAED-IFXJQAMLSA-N 1 2 307.372 4.056 20 0 DIADLO CCc1nnc(C[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)o1 ZINC000341448689 517868293 /nfs/dbraw/zinc/86/82/93/517868293.db2.gz BYSFTJXAMXVIGS-CQSZACIVSA-N 1 2 305.397 4.038 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1ccc2ncccc2c1 ZINC000338322088 518899256 /nfs/dbraw/zinc/89/92/56/518899256.db2.gz GTMYOHKBNSHUHJ-UHFFFAOYSA-N 1 2 307.397 4.419 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@@H](CC2CCC2)c2ccccc2)no1 ZINC000182297513 519098447 /nfs/dbraw/zinc/09/84/47/519098447.db2.gz PZMWTZQCMYWOEE-INIZCTEOSA-N 1 2 313.445 4.388 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1ncn(-c2ccccc2)n1)c1ccccc1 ZINC000181798924 519399021 /nfs/dbraw/zinc/39/90/21/519399021.db2.gz DFVMXEVZNSZHHQ-IBGZPJMESA-N 1 2 320.440 4.144 20 0 DIADLO CC(C)N(C)c1ccc(CNc2cccc(C(F)F)c2)c[nH+]1 ZINC000191423335 519633007 /nfs/dbraw/zinc/63/30/07/519633007.db2.gz ILNBYEADQGMJSY-UHFFFAOYSA-N 1 2 305.372 4.476 20 0 DIADLO CC(C)[C@H](C)Nc1cccc(C[N@H+](C)Cc2cscn2)c1 ZINC000191453514 519813162 /nfs/dbraw/zinc/81/31/62/519813162.db2.gz COGXBNDLMXJWJN-AWEZNQCLSA-N 1 2 303.475 4.232 20 0 DIADLO CC(C)[C@H](C)Nc1cccc(C[N@@H+](C)Cc2cscn2)c1 ZINC000191453514 519813163 /nfs/dbraw/zinc/81/31/63/519813163.db2.gz COGXBNDLMXJWJN-AWEZNQCLSA-N 1 2 303.475 4.232 20 0 DIADLO CC(C)c1ncc(C[N@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)s1 ZINC000354109157 519874767 /nfs/dbraw/zinc/87/47/67/519874767.db2.gz ZEKJNYQBYCPTFK-WFASDCNBSA-N 1 2 322.499 4.290 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)s1 ZINC000354109157 519874769 /nfs/dbraw/zinc/87/47/69/519874769.db2.gz ZEKJNYQBYCPTFK-WFASDCNBSA-N 1 2 322.499 4.290 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)o1 ZINC000182448262 519887802 /nfs/dbraw/zinc/88/78/02/519887802.db2.gz JGOQDMDBXKDWES-SNVBAGLBSA-N 1 2 313.323 4.063 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)o1 ZINC000180297327 519888034 /nfs/dbraw/zinc/88/80/34/519888034.db2.gz YZLHPVPHOWRXOJ-KRWDZBQOSA-N 1 2 317.408 4.353 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)o1 ZINC000181607811 519888077 /nfs/dbraw/zinc/88/80/77/519888077.db2.gz ZZUCFXNSUAFSJH-SNVBAGLBSA-N 1 2 313.323 4.063 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccccc2F)C2CCCC2)o1 ZINC000181491708 519888083 /nfs/dbraw/zinc/88/80/83/519888083.db2.gz UZTSTYASCYSLPB-KRWDZBQOSA-N 1 2 317.408 4.353 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)o1 ZINC000182590804 519888098 /nfs/dbraw/zinc/88/80/98/519888098.db2.gz GGBYNZYXCICUNS-INIZCTEOSA-N 1 2 319.836 4.477 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CC=C(c2c(F)cccc2F)CC1 ZINC000337207969 520100018 /nfs/dbraw/zinc/10/00/18/520100018.db2.gz PQBIJPPTKBGKGP-UHFFFAOYSA-N 1 2 317.383 4.032 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CC=C(c2c(F)cccc2F)CC1 ZINC000337207969 520100030 /nfs/dbraw/zinc/10/00/30/520100030.db2.gz PQBIJPPTKBGKGP-UHFFFAOYSA-N 1 2 317.383 4.032 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000368808900 520317194 /nfs/dbraw/zinc/31/71/94/520317194.db2.gz CWZXFWFGOWKMHG-SFHVURJKSA-N 1 2 305.466 4.112 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000368808900 520317203 /nfs/dbraw/zinc/31/72/03/520317203.db2.gz CWZXFWFGOWKMHG-SFHVURJKSA-N 1 2 305.466 4.112 20 0 DIADLO CCCC[N@H+](Cc1nnc(C(C)C)o1)Cc1ccccc1F ZINC000339290414 520549409 /nfs/dbraw/zinc/54/94/09/520549409.db2.gz KCTNHBHNQCNKGW-UHFFFAOYSA-N 1 2 305.397 4.134 20 0 DIADLO CCCC[N@@H+](Cc1nnc(C(C)C)o1)Cc1ccccc1F ZINC000339290414 520549414 /nfs/dbraw/zinc/54/94/14/520549414.db2.gz KCTNHBHNQCNKGW-UHFFFAOYSA-N 1 2 305.397 4.134 20 0 DIADLO CCC[C@@H]([NH2+]Cc1cn[nH]c1C)c1cccc(C(F)(F)F)c1 ZINC000236910683 520779378 /nfs/dbraw/zinc/77/93/78/520779378.db2.gz IWTAFWCWPRDMCY-OAHLLOKOSA-N 1 2 311.351 4.368 20 0 DIADLO CCC[C@@H]([NH2+]Cc1noc(-c2ccsc2)n1)c1ccccc1 ZINC000181785507 520785733 /nfs/dbraw/zinc/78/57/33/520785733.db2.gz HJKMYJGNIHPZKY-OAHLLOKOSA-N 1 2 313.426 4.429 20 0 DIADLO CCCCS[C@H](C)C(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000366355892 520977114 /nfs/dbraw/zinc/97/71/14/520977114.db2.gz OAOHJESEDBIUQC-CYBMUJFWSA-N 1 2 317.458 4.245 20 0 DIADLO CCC[C@H]([NH2+]Cc1nnc(C(C)C)o1)c1ccc(F)cc1F ZINC000181666238 521166135 /nfs/dbraw/zinc/16/61/35/521166135.db2.gz LBNSCDZTPDQXJA-AWEZNQCLSA-N 1 2 309.360 4.102 20 0 DIADLO CCC[C@H]([NH2+]Cc1noc(-c2ccsc2)n1)c1ccccc1 ZINC000181785491 521168901 /nfs/dbraw/zinc/16/89/01/521168901.db2.gz HJKMYJGNIHPZKY-HNNXBMFYSA-N 1 2 313.426 4.429 20 0 DIADLO CC[N@@H+](Cc1csc(-c2ccoc2)n1)Cc1cccs1 ZINC000108356947 521441726 /nfs/dbraw/zinc/44/17/26/521441726.db2.gz IEZWFSWHFFPUTE-UHFFFAOYSA-N 1 2 304.440 4.487 20 0 DIADLO CC[N@H+](Cc1csc(-c2ccoc2)n1)Cc1cccs1 ZINC000108356947 521441732 /nfs/dbraw/zinc/44/17/32/521441732.db2.gz IEZWFSWHFFPUTE-UHFFFAOYSA-N 1 2 304.440 4.487 20 0 DIADLO CC[N@H+](Cc1csc(-c2cccs2)n1)Cc1ccncc1 ZINC000267891459 521443417 /nfs/dbraw/zinc/44/34/17/521443417.db2.gz IXGSVLKNBNZESX-UHFFFAOYSA-N 1 2 315.467 4.289 20 0 DIADLO CC[N@@H+](Cc1csc(-c2cccs2)n1)Cc1ccncc1 ZINC000267891459 521443426 /nfs/dbraw/zinc/44/34/26/521443426.db2.gz IXGSVLKNBNZESX-UHFFFAOYSA-N 1 2 315.467 4.289 20 0 DIADLO CCCc1nc(C[NH2+]C(C)(C)c2ccccc2OC)cs1 ZINC000114718939 521515220 /nfs/dbraw/zinc/51/52/20/521515220.db2.gz HSAGTJKLKJJBRO-UHFFFAOYSA-N 1 2 304.459 4.129 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+][C@@H](COC)c1ccc(C)o1 ZINC000156501892 521584802 /nfs/dbraw/zinc/58/48/02/521584802.db2.gz MDTHOOXCZGHPHY-HOCLYGCPSA-N 1 2 303.402 4.025 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)n1 ZINC000180022981 521587065 /nfs/dbraw/zinc/58/70/65/521587065.db2.gz BURCSPMMVGTCNM-FABXCBLPSA-N 1 2 319.836 4.162 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@H](C)c2cccc(C)c2C)n1 ZINC000183707355 521721846 /nfs/dbraw/zinc/72/18/46/521721846.db2.gz KQOAYPHFRYNANO-KGLIPLIRSA-N 1 2 319.474 4.351 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@@H](C)c2ccc(C)cc2)n1 ZINC000182313882 521729401 /nfs/dbraw/zinc/72/94/01/521729401.db2.gz SEGFQWLHTGPFBX-QWHCGFSZSA-N 1 2 305.447 4.043 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)C[C@@H](C)c1ccc(F)cc1F ZINC000269851563 522078091 /nfs/dbraw/zinc/07/80/91/522078091.db2.gz IZSKBFOFMNKHGZ-LLVKDONJSA-N 1 2 304.340 4.055 20 0 DIADLO CCc1nc(C[NH2+][C@@H](CCc2ccccc2)c2ccccc2)no1 ZINC000180379347 522348543 /nfs/dbraw/zinc/34/85/43/522348543.db2.gz BRLLIHDHUZHHHD-SFHVURJKSA-N 1 2 321.424 4.096 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1cc(F)c(F)c(F)c1)c1ccc(C)o1 ZINC000156436540 522378533 /nfs/dbraw/zinc/37/85/33/522378533.db2.gz PWWCNXDYJPXVIQ-QMTHXVAHSA-N 1 2 313.319 4.044 20 0 DIADLO COC(=O)c1oc([C@@H](C)[NH2+][C@H](C)c2cccc(F)c2F)cc1C ZINC000181954136 522405786 /nfs/dbraw/zinc/40/57/86/522405786.db2.gz SCBRHBCRLGBWMM-GHMZBOCLSA-N 1 2 323.339 4.065 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cnn(C(C)C)c2C)cs1 ZINC000191280826 522423099 /nfs/dbraw/zinc/42/30/99/522423099.db2.gz FWZVFKQMJQGZQM-VXGBXAGGSA-N 1 2 306.479 4.203 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2cnn(C(C)C)c2C)cs1 ZINC000191280842 522453176 /nfs/dbraw/zinc/45/31/76/522453176.db2.gz FWZVFKQMJQGZQM-NEPJUHHUSA-N 1 2 306.479 4.203 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2cc(OC)ccc2OC)cs1 ZINC000162285289 522455123 /nfs/dbraw/zinc/45/51/23/522455123.db2.gz JAQNXYZIKUKBGK-NEPJUHHUSA-N 1 2 320.458 4.135 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(OC)cc2F)cs1 ZINC000162285560 522455176 /nfs/dbraw/zinc/45/51/76/522455176.db2.gz PAWKDFGYWLLSFT-QWRGUYRKSA-N 1 2 308.422 4.265 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1nc(C)sc1C)CCC2 ZINC000336837838 522478833 /nfs/dbraw/zinc/47/88/33/522478833.db2.gz FUELTNICKXSREG-CQSZACIVSA-N 1 2 321.515 4.288 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1nc(C)sc1C)CCC2 ZINC000336837838 522478840 /nfs/dbraw/zinc/47/88/40/522478840.db2.gz FUELTNICKXSREG-CQSZACIVSA-N 1 2 321.515 4.288 20 0 DIADLO CCc1nn(C)c(CC)c1C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000181029741 522661970 /nfs/dbraw/zinc/66/19/70/522661970.db2.gz AIKKMGSNAGCFMA-FQEVSTJZSA-N 1 2 323.440 4.017 20 0 DIADLO CC[C@H]([NH2+]Cc1sccc1Br)c1nccs1 ZINC000070732898 522675529 /nfs/dbraw/zinc/67/55/29/522675529.db2.gz YDFKTZYFPPVRTI-VIFPVBQESA-N 1 2 317.277 4.208 20 0 DIADLO CCc1nnc(C[N@H+](Cc2ccccc2F)C2CCCCC2)o1 ZINC000104708550 522726559 /nfs/dbraw/zinc/72/65/59/522726559.db2.gz QTMUMTIEWJZAOS-UHFFFAOYSA-N 1 2 317.408 4.106 20 0 DIADLO CCc1nnc(C[N@@H+](Cc2ccccc2F)C2CCCCC2)o1 ZINC000104708550 522726568 /nfs/dbraw/zinc/72/65/68/522726568.db2.gz QTMUMTIEWJZAOS-UHFFFAOYSA-N 1 2 317.408 4.106 20 0 DIADLO CC[C@H](Nc1ccc(-c2nc(C)cs2)cc1)c1[nH+]ccn1C ZINC000183014944 522765108 /nfs/dbraw/zinc/76/51/08/522765108.db2.gz IAJDVFZANHWVJO-HNNXBMFYSA-N 1 2 312.442 4.415 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1cccc(Cl)c1 ZINC000182599717 522893913 /nfs/dbraw/zinc/89/39/13/522893913.db2.gz QHLMVQHBJNIINE-CYBMUJFWSA-N 1 2 307.825 4.261 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000182307286 522918030 /nfs/dbraw/zinc/91/80/30/522918030.db2.gz UMIFKULKZKDBIH-IINYFYTJSA-N 1 2 305.809 4.402 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2csc(C3CC3)n2)o1 ZINC000130850297 523022981 /nfs/dbraw/zinc/02/29/81/523022981.db2.gz LPDIRDMWOVQKIY-OAHLLOKOSA-N 1 2 318.442 4.097 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2csc(C3CC3)n2)o1 ZINC000130850297 523022985 /nfs/dbraw/zinc/02/29/85/523022985.db2.gz LPDIRDMWOVQKIY-OAHLLOKOSA-N 1 2 318.442 4.097 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](C)[C@@H](C)c2ccccc2C)cs1 ZINC000267024802 523465911 /nfs/dbraw/zinc/46/59/11/523465911.db2.gz LAMQTXVFDZIRDJ-KBPBESRZSA-N 1 2 304.459 4.352 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](C)[C@@H](C)c2ccccc2C)cs1 ZINC000267024802 523465919 /nfs/dbraw/zinc/46/59/19/523465919.db2.gz LAMQTXVFDZIRDJ-KBPBESRZSA-N 1 2 304.459 4.352 20 0 DIADLO COCCC[C@H](C)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000182923866 523493172 /nfs/dbraw/zinc/49/31/72/523493172.db2.gz UILBLPLZWIGDCH-HNNXBMFYSA-N 1 2 313.445 4.113 20 0 DIADLO COC(=O)[C@@H](c1ccsc1)[N@@H+]1CCC[C@@H]1c1ccc(C)s1 ZINC000337190421 523659433 /nfs/dbraw/zinc/65/94/33/523659433.db2.gz RVPTXKIHGFRLKO-UKRRQHHQSA-N 1 2 321.467 4.169 20 0 DIADLO COC(=O)[C@@H](c1ccsc1)[N@H+]1CCC[C@@H]1c1ccc(C)s1 ZINC000337190421 523659437 /nfs/dbraw/zinc/65/94/37/523659437.db2.gz RVPTXKIHGFRLKO-UKRRQHHQSA-N 1 2 321.467 4.169 20 0 DIADLO CC[C@@](C)([NH2+]Cc1coc(-c2ccccc2)n1)c1nccs1 ZINC000237065179 523660936 /nfs/dbraw/zinc/66/09/36/523660936.db2.gz VLGJMJSTQUKQKS-QGZVFWFLSA-N 1 2 313.426 4.213 20 0 DIADLO COc1ccc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)nc1 ZINC000338377926 524012115 /nfs/dbraw/zinc/01/21/15/524012115.db2.gz OCDVLAHJKBEWDT-UHFFFAOYSA-N 1 2 324.346 4.045 20 0 DIADLO COc1ccc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)nc1 ZINC000338377926 524012118 /nfs/dbraw/zinc/01/21/18/524012118.db2.gz OCDVLAHJKBEWDT-UHFFFAOYSA-N 1 2 324.346 4.045 20 0 DIADLO COc1ccc(C[N@H+](Cc2ncc(C)o2)Cc2ccccc2)cc1 ZINC000266629450 524015699 /nfs/dbraw/zinc/01/56/99/524015699.db2.gz IFRUUSZDXSTQKN-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ncc(C)o2)Cc2ccccc2)cc1 ZINC000266629450 524015703 /nfs/dbraw/zinc/01/57/03/524015703.db2.gz IFRUUSZDXSTQKN-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+]Cc2csc(-c3ccco3)n2)o1 ZINC000128461681 524026317 /nfs/dbraw/zinc/02/63/17/524026317.db2.gz JISGVLUTPMNZTP-LLVKDONJSA-N 1 2 302.399 4.409 20 0 DIADLO C[C@H]1CCC[C@H](C)N1C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000112635391 524187712 /nfs/dbraw/zinc/18/77/12/524187712.db2.gz NXNQMVYSUOVTIS-GJZGRUSLSA-N 1 2 310.397 4.277 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1)c1ccccn1 ZINC000339252684 524259143 /nfs/dbraw/zinc/25/91/43/524259143.db2.gz HNENNHRMMCXWLJ-CQSZACIVSA-N 1 2 319.364 4.011 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+][C@H](C)c1nc2ccccc2o1 ZINC000182066732 524331176 /nfs/dbraw/zinc/33/11/76/524331176.db2.gz WBRYTOGAYATHIU-VXGBXAGGSA-N 1 2 314.360 4.387 20 0 DIADLO Cc1cccc(C[N@@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)n1 ZINC000338367260 524402905 /nfs/dbraw/zinc/40/29/05/524402905.db2.gz BAKCVMGKKATKMU-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1cccc(C[N@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)n1 ZINC000338367260 524402918 /nfs/dbraw/zinc/40/29/18/524402918.db2.gz BAKCVMGKKATKMU-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO C[C@@H](CC1CC1)[NH2+]c1ccc(OCc2noc(C3CC3)n2)cc1 ZINC000179852806 524428157 /nfs/dbraw/zinc/42/81/57/524428157.db2.gz HPGBCXKMTVITHV-LBPRGKRZSA-N 1 2 313.401 4.127 20 0 DIADLO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2nc(-c3cccs3)no2)c1 ZINC000182901553 524461109 /nfs/dbraw/zinc/46/11/09/524461109.db2.gz YQWUXYYUZDLKQN-CYBMUJFWSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@@H]1CC[C@@H](C)N(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000337955753 524572413 /nfs/dbraw/zinc/57/24/13/524572413.db2.gz PGRTWUZNEAIORL-HUUCEWRRSA-N 1 2 310.397 4.135 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)s1 ZINC000173864960 524594853 /nfs/dbraw/zinc/59/48/53/524594853.db2.gz KBLVFYVWERBMAD-LBPRGKRZSA-N 1 2 305.447 4.338 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3n2C(C)C)on1 ZINC000267373898 524685059 /nfs/dbraw/zinc/68/50/59/524685059.db2.gz SJCDOOWLNLBRCX-GOSISDBHSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3n2C(C)C)on1 ZINC000267373898 524685063 /nfs/dbraw/zinc/68/50/63/524685063.db2.gz SJCDOOWLNLBRCX-GOSISDBHSA-N 1 2 324.428 4.251 20 0 DIADLO COc1ccccc1[C@@H](C)CC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000102982825 524714670 /nfs/dbraw/zinc/71/46/70/524714670.db2.gz QFWSHDAAIOLBDM-LBPRGKRZSA-N 1 2 312.413 4.148 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1noc(-c2ccccc2)n1 ZINC000124339065 524725755 /nfs/dbraw/zinc/72/57/55/524725755.db2.gz PCVKJQPYORBASL-KGLIPLIRSA-N 1 2 323.396 4.157 20 0 DIADLO COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nc(C)c(C)o1 ZINC000181714439 524786990 /nfs/dbraw/zinc/78/69/90/524786990.db2.gz ZLNKTVIVBIVUIA-INIZCTEOSA-N 1 2 302.418 4.177 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2coc(-c3cccs3)n2)o1 ZINC000237669515 524973001 /nfs/dbraw/zinc/97/30/01/524973001.db2.gz GMJJSQBYWGITTA-SMDDNHRTSA-N 1 2 314.410 4.409 20 0 DIADLO Cc1ccccc1-c1nc(C(=O)Nc2cc[nH+]cc2C)cs1 ZINC000107286193 525008157 /nfs/dbraw/zinc/00/81/57/525008157.db2.gz VQORCDNRXQKXLX-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO Cc1ccccc1C1CCN(C(=O)Nc2cc[nH+]cc2C)CC1 ZINC000179869216 525089663 /nfs/dbraw/zinc/08/96/63/525089663.db2.gz VZKYHCFLCPASDU-UHFFFAOYSA-N 1 2 309.413 4.110 20 0 DIADLO Cc1ccc(NC(=O)[C@H]2CCCC[C@@H]2C(F)(F)F)c(C)[nH+]1 ZINC000268031078 525221603 /nfs/dbraw/zinc/22/16/03/525221603.db2.gz XRSMWGISQCTQAV-RYUDHWBXSA-N 1 2 300.324 4.006 20 0 DIADLO Cc1cc(N[C@H](c2[nH]cc[nH+]2)c2cccnc2)ccc1OC(C)C ZINC000195110795 525302262 /nfs/dbraw/zinc/30/22/62/525302262.db2.gz TYENIQLOPAQZQC-SFHVURJKSA-N 1 2 322.412 4.102 20 0 DIADLO CSC1(CNc2cc(C)[nH+]c3c(F)cccc23)CCOCC1 ZINC000127603290 525340178 /nfs/dbraw/zinc/34/01/78/525340178.db2.gz QQNVEIWTAGESOZ-UHFFFAOYSA-N 1 2 320.433 4.006 20 0 DIADLO Cc1ccccc1[C@@H]([NH2+]Cc1nc(C(C)C)no1)C(C)(C)C ZINC000180086023 525375226 /nfs/dbraw/zinc/37/52/26/525375226.db2.gz BRFQJYYUZDHCKP-MRXNPFEDSA-N 1 2 301.434 4.378 20 0 DIADLO Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1noc(-c2ccccc2)n1 ZINC000124422301 525418458 /nfs/dbraw/zinc/41/84/58/525418458.db2.gz IIBNAJRTICDVJP-GJZGRUSLSA-N 1 2 307.397 4.457 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nnc(-c3ccccc3)s2)c(C)o1 ZINC000156479886 525467009 /nfs/dbraw/zinc/46/70/09/525467009.db2.gz KJJWHNZYWNSFRJ-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@H]([NH2+]Cc1nc2cc(C(F)(F)F)ccc2o1)c1ccccn1 ZINC000181790245 525486591 /nfs/dbraw/zinc/48/65/91/525486591.db2.gz BYHIVDBWIBOXFM-JTQLQIEISA-N 1 2 321.302 4.092 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2noc(-c3ccccc3)n2)c(C)s1 ZINC000182763282 525523808 /nfs/dbraw/zinc/52/38/08/525523808.db2.gz PBPITQVKDNUPDY-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(-c2ccsc2)n1)c1ccncc1F ZINC000337947394 525555580 /nfs/dbraw/zinc/55/55/80/525555580.db2.gz STKLPRSORUKOCM-SNVBAGLBSA-N 1 2 319.430 4.257 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(F)(F)F)cs1)c1ccc(F)cc1F ZINC000157304793 525559199 /nfs/dbraw/zinc/55/91/99/525559199.db2.gz UUDVBITZZFIICN-SSDOTTSWSA-N 1 2 322.302 4.291 20 0 DIADLO C[C@@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1ccc2ccccc2c1 ZINC000181507177 525565549 /nfs/dbraw/zinc/56/55/49/525565549.db2.gz DGTGFWAJLYVLDX-CYBMUJFWSA-N 1 2 309.413 4.371 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1noc(-c2ccccc2)n1 ZINC000124253910 525582379 /nfs/dbraw/zinc/58/23/79/525582379.db2.gz CPFBINPCOZNOQH-YVEFUNNKSA-N 1 2 323.371 4.214 20 0 DIADLO C[C@@H]([NH2+][C@@H](CCO)c1ccco1)c1ccc(Cl)cc1Cl ZINC000186542043 525626703 /nfs/dbraw/zinc/62/67/03/525626703.db2.gz NAFDEWISXNHXOW-YGRLFVJLSA-N 1 2 314.212 4.361 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+](C)[C@@H](C)c3ccccn3)o2)cc1 ZINC000129192899 525771167 /nfs/dbraw/zinc/77/11/67/525771167.db2.gz BBFOOEZVZQIVTR-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+](C)[C@@H](C)c3ccccn3)o2)cc1 ZINC000129192899 525771172 /nfs/dbraw/zinc/77/11/72/525771172.db2.gz BBFOOEZVZQIVTR-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO COc1cccc(C[N@H+](Cc2ccccc2F)C2CC2)c1OC ZINC000339407962 525923667 /nfs/dbraw/zinc/92/36/67/525923667.db2.gz SERDJTLULWBYHJ-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO COc1cccc(C[N@@H+](Cc2ccccc2F)C2CC2)c1OC ZINC000339407962 525923676 /nfs/dbraw/zinc/92/36/76/525923676.db2.gz SERDJTLULWBYHJ-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2ncnn2C(C)(C)C)cc1 ZINC000338302032 525995230 /nfs/dbraw/zinc/99/52/30/525995230.db2.gz CFOOMKATRUXBRU-QGZVFWFLSA-N 1 2 312.461 4.069 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2ncnn2C(C)(C)C)cc1 ZINC000338302032 525995243 /nfs/dbraw/zinc/99/52/43/525995243.db2.gz CFOOMKATRUXBRU-QGZVFWFLSA-N 1 2 312.461 4.069 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@@H](c2ccccc2)C(C)(C)C)no1 ZINC000299079883 534900313 /nfs/dbraw/zinc/90/03/13/534900313.db2.gz ROVQHLRECUYYGU-HNNXBMFYSA-N 1 2 301.434 4.244 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1csc(C2CCCC2)n1 ZINC000129363985 526125194 /nfs/dbraw/zinc/12/51/94/526125194.db2.gz FWAMBQAKEHSOGD-CYBMUJFWSA-N 1 2 301.459 4.389 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1csc(C2CCCC2)n1 ZINC000129363985 526125201 /nfs/dbraw/zinc/12/52/01/526125201.db2.gz FWAMBQAKEHSOGD-CYBMUJFWSA-N 1 2 301.459 4.389 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000181148689 526179499 /nfs/dbraw/zinc/17/94/99/526179499.db2.gz HOINRZSFQVJHKF-DOMZBBRYSA-N 1 2 314.410 4.024 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000181148689 526179511 /nfs/dbraw/zinc/17/95/11/526179511.db2.gz HOINRZSFQVJHKF-DOMZBBRYSA-N 1 2 314.410 4.024 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1CCC[C@H]1c1ccc(Cl)cc1 ZINC000179857463 526238608 /nfs/dbraw/zinc/23/86/08/526238608.db2.gz OEMKHSUBOAFEKK-INIZCTEOSA-N 1 2 315.804 4.412 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CSc1ccc2ccccc2c1 ZINC000107287574 526239517 /nfs/dbraw/zinc/23/95/17/526239517.db2.gz KJYCTXZVTOOQCM-UHFFFAOYSA-N 1 2 308.406 4.274 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@@H](OC1CCCC1)c1ccccc1 ZINC000107286637 526240531 /nfs/dbraw/zinc/24/05/31/526240531.db2.gz AHURRCUJKKAGSV-SFHVURJKSA-N 1 2 310.397 4.029 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1cc(C2CC2)nc2ccccc21 ZINC000107292082 526240755 /nfs/dbraw/zinc/24/07/55/526240755.db2.gz WFNCPGBHGLASRO-UHFFFAOYSA-N 1 2 303.365 4.068 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 ZINC000107287687 526242206 /nfs/dbraw/zinc/24/22/06/526242206.db2.gz YIJAMYSEQBHUQD-UHFFFAOYSA-N 1 2 305.381 4.002 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1nc(C(F)(F)F)cs1 ZINC000189355285 526302546 /nfs/dbraw/zinc/30/25/46/526302546.db2.gz PYGYBRJQRYUOHV-UHFFFAOYSA-N 1 2 324.730 4.244 20 0 DIADLO Cc1csc(C[N@H+](CCc2ccccc2)Cc2cccnc2)n1 ZINC000191355353 526342127 /nfs/dbraw/zinc/34/21/27/526342127.db2.gz HMIAAGSEYIDOHZ-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO Cc1csc(C[N@@H+](CCc2ccccc2)Cc2cccnc2)n1 ZINC000191355353 526342133 /nfs/dbraw/zinc/34/21/33/526342133.db2.gz HMIAAGSEYIDOHZ-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO Cc1csc(C[NH2+][C@H](C)c2cc(C)ccc2OC(F)F)n1 ZINC000126200991 526360979 /nfs/dbraw/zinc/36/09/79/526360979.db2.gz ANBSIKQZJBOXKE-LLVKDONJSA-N 1 2 312.385 4.212 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CC=C(c3cc(C)cc(C)c3)CC2)s1 ZINC000338282581 526402196 /nfs/dbraw/zinc/40/21/96/526402196.db2.gz GUCUZQNLJNSBLA-AWEZNQCLSA-N 1 2 313.470 4.314 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CC=C(c3cc(C)cc(C)c3)CC2)s1 ZINC000338282581 526402202 /nfs/dbraw/zinc/40/22/02/526402202.db2.gz GUCUZQNLJNSBLA-AWEZNQCLSA-N 1 2 313.470 4.314 20 0 DIADLO Fc1ccccc1[C@H]([NH2+]Cc1nc(C2CC2)no1)C1CCCC1 ZINC000181492962 526418398 /nfs/dbraw/zinc/41/83/98/526418398.db2.gz YDWHIOSEMPJHBO-QGZVFWFLSA-N 1 2 315.392 4.107 20 0 DIADLO c1cn(-c2csc(CNc3ccc(C4CCC4)c[nH+]3)c2)cn1 ZINC000339566594 526528027 /nfs/dbraw/zinc/52/80/27/526528027.db2.gz ZYADDTSIKWXNBS-UHFFFAOYSA-N 1 2 310.426 4.208 20 0 DIADLO c1cn(Cc2ccccc2)c(CNc2ccc(C3CCC3)c[nH+]2)n1 ZINC000339569402 526535411 /nfs/dbraw/zinc/53/54/11/526535411.db2.gz NHSWXUNIWRYBCL-UHFFFAOYSA-N 1 2 318.424 4.206 20 0 DIADLO c1cncc([C@@H]2CCC[C@@H](Nc3ccc(N4CCCC4)c[nH+]3)C2)c1 ZINC000337372525 526549287 /nfs/dbraw/zinc/54/92/87/526549287.db2.gz DIVWWQCXMGPXHL-SJLPKXTDSA-N 1 2 322.456 4.215 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C(C)C ZINC000236731806 526554596 /nfs/dbraw/zinc/55/45/96/526554596.db2.gz SYQSPADITGTFMN-OAHLLOKOSA-N 1 2 311.351 4.224 20 0 DIADLO c1csc(C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)n1 ZINC000129844752 526583084 /nfs/dbraw/zinc/58/30/84/526583084.db2.gz AHCHCNGENKHDBJ-HNNXBMFYSA-N 1 2 314.454 4.459 20 0 DIADLO Cc1nc(C)c(CSCc2cn3c(cccc3C)[nH+]2)s1 ZINC000360978464 526727663 /nfs/dbraw/zinc/72/76/63/526727663.db2.gz IPSKXPUFUVBFLC-UHFFFAOYSA-N 1 2 303.456 4.149 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+](Cc1ccncc1)C1CC1 ZINC000124919302 526740855 /nfs/dbraw/zinc/74/08/55/526740855.db2.gz YHNNYUCUUIZDSG-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+](Cc1ccncc1)C1CC1 ZINC000124919302 526740859 /nfs/dbraw/zinc/74/08/59/526740859.db2.gz YHNNYUCUUIZDSG-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc(C(C)(C)C)s3)CCCC2)no1 ZINC000126918714 526768680 /nfs/dbraw/zinc/76/86/80/526768680.db2.gz ASJZSHPFUQXKFQ-UHFFFAOYSA-N 1 2 319.474 4.296 20 0 DIADLO O=C(c1ccccc1Oc1cc[nH+]cc1)N1CCCC2(CCC2)C1 ZINC000338002889 526811677 /nfs/dbraw/zinc/81/16/77/526811677.db2.gz SOCPOGCYOAVPIC-UHFFFAOYSA-N 1 2 322.408 4.280 20 0 DIADLO Cc1nc(C[N@H+](CCc2ccccc2)Cc2cccnc2)cs1 ZINC000191344768 526847431 /nfs/dbraw/zinc/84/74/31/526847431.db2.gz MATKLXNZUHSPQG-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO Cc1nc(C[N@@H+](CCc2ccccc2)Cc2cccnc2)cs1 ZINC000191344768 526847437 /nfs/dbraw/zinc/84/74/37/526847437.db2.gz MATKLXNZUHSPQG-UHFFFAOYSA-N 1 2 323.465 4.091 20 0 DIADLO Cc1nc(C[N@@H+](Cc2cccs2)C[C@H]2CCCO2)c(C)s1 ZINC000336840568 526849537 /nfs/dbraw/zinc/84/95/37/526849537.db2.gz WURKBDXJRQYAPC-CQSZACIVSA-N 1 2 322.499 4.003 20 0 DIADLO Cc1nc(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)c(C)s1 ZINC000336840568 526849540 /nfs/dbraw/zinc/84/95/40/526849540.db2.gz WURKBDXJRQYAPC-CQSZACIVSA-N 1 2 322.499 4.003 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(OCC3CC3)c(F)c2)oc1C ZINC000181588441 526891221 /nfs/dbraw/zinc/89/12/21/526891221.db2.gz CUSYUOZPTKEPSN-LBPRGKRZSA-N 1 2 318.392 4.070 20 0 DIADLO Cc1sccc1C[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000339212939 526919942 /nfs/dbraw/zinc/91/99/42/526919942.db2.gz FBRRTIUYTCEPNN-HNNXBMFYSA-N 1 2 300.452 4.392 20 0 DIADLO Clc1ccc([C@@H]2CSCC[N@@H+]2Cc2ccccn2)cc1 ZINC000116411008 526962065 /nfs/dbraw/zinc/96/20/65/526962065.db2.gz QSTMQWPONVALJJ-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccc([C@@H]2CSCC[N@H+]2Cc2ccccn2)cc1 ZINC000116411008 526962069 /nfs/dbraw/zinc/96/20/69/526962069.db2.gz QSTMQWPONVALJJ-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccc([C@H]2CSCC[N@@H+]2Cc2ccccn2)cc1 ZINC000116411005 526963875 /nfs/dbraw/zinc/96/38/75/526963875.db2.gz QSTMQWPONVALJJ-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccc([C@H]2CSCC[N@H+]2Cc2ccccn2)cc1 ZINC000116411005 526963879 /nfs/dbraw/zinc/96/38/79/526963879.db2.gz QSTMQWPONVALJJ-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Cc1nc(SCc2c[nH+]cn2C)n(C2CCCCC2)c1C ZINC000267152320 527022238 /nfs/dbraw/zinc/02/22/38/527022238.db2.gz OBBGYWOFHNRAKA-UHFFFAOYSA-N 1 2 304.463 4.031 20 0 DIADLO Cc1ncc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3o2)s1 ZINC000336853316 527256278 /nfs/dbraw/zinc/25/62/78/527256278.db2.gz AIOCWRJUZMKQRG-OAHLLOKOSA-N 1 2 313.426 4.320 20 0 DIADLO Cc1ncc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3o2)s1 ZINC000336853316 527256283 /nfs/dbraw/zinc/25/62/83/527256283.db2.gz AIOCWRJUZMKQRG-OAHLLOKOSA-N 1 2 313.426 4.320 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)N1CCCC12CCC2 ZINC000365658153 527370049 /nfs/dbraw/zinc/37/00/49/527370049.db2.gz CRZSKPHTJKLGDH-UHFFFAOYSA-N 1 2 323.396 4.424 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1cc(-c2cccs2)on1 ZINC000181087751 527410688 /nfs/dbraw/zinc/41/06/88/527410688.db2.gz UESWXZCDHQWPAZ-OAHLLOKOSA-N 1 2 313.426 4.079 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1cc(-c2cccs2)on1 ZINC000181087751 527410694 /nfs/dbraw/zinc/41/06/94/527410694.db2.gz UESWXZCDHQWPAZ-OAHLLOKOSA-N 1 2 313.426 4.079 20 0 DIADLO Cc1nn(C(C)(C)C)cc1[C@H](C)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000185315835 527588822 /nfs/dbraw/zinc/58/88/22/527588822.db2.gz APQCFDFFQIIIOO-LBPRGKRZSA-N 1 2 313.449 4.095 20 0 DIADLO CC(C)(C)c1noc(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)n1 ZINC000299088738 534938582 /nfs/dbraw/zinc/93/85/82/534938582.db2.gz VAPAMOSQDNAPSY-OAHLLOKOSA-N 1 2 319.424 4.383 20 0 DIADLO CCc1ccc2occ(C(=O)N3CCCC[C@H]3c3[nH]cc[nH+]3)c2c1 ZINC000286181854 535835364 /nfs/dbraw/zinc/83/53/64/535835364.db2.gz ZJDRLCAFPPGYBT-INIZCTEOSA-N 1 2 323.396 4.086 20 0 DIADLO CC[C@H]([NH2+]Cc1nn(CC)c2ccccc12)c1nc(C)cs1 ZINC000274421635 535923779 /nfs/dbraw/zinc/92/37/79/535923779.db2.gz KLFZGGPTTKDZJD-AWEZNQCLSA-N 1 2 314.458 4.062 20 0 DIADLO CCn1c(C)cc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1C ZINC000280335649 535967727 /nfs/dbraw/zinc/96/77/27/535967727.db2.gz VXHIWTXIKGMVRZ-UHFFFAOYSA-N 1 2 322.412 4.076 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)c1ccnc(SC(C)(C)C)c1 ZINC000272223375 536090913 /nfs/dbraw/zinc/09/09/13/536090913.db2.gz HASSCELHTTXGKQ-UHFFFAOYSA-N 1 2 315.442 4.182 20 0 DIADLO COc1cc[nH+]cc1CS[C@H](C)c1nc2ccccc2o1 ZINC000289373491 537120635 /nfs/dbraw/zinc/12/06/35/537120635.db2.gz JWSDWSKYGAZWFU-LLVKDONJSA-N 1 2 300.383 4.226 20 0 DIADLO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cc1ncsc1Br ZINC001167798586 1042116887 /nfs/dbraw/zinc/11/68/87/1042116887.db2.gz NLEDIZIETMHCTI-JQWIXIFHSA-N 1 2 317.296 4.306 20 0 DIADLO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1ncsc1Br ZINC001167798586 1042116898 /nfs/dbraw/zinc/11/68/98/1042116898.db2.gz NLEDIZIETMHCTI-JQWIXIFHSA-N 1 2 317.296 4.306 20 0 DIADLO COC[C@@H]1CCC[N@@H+]1Cc1c(Cl)ccc(Cl)c1Cl ZINC001231480753 1053760176 /nfs/dbraw/zinc/76/01/76/1053760176.db2.gz XFSQNCONGVJQNY-VIFPVBQESA-N 1 2 308.636 4.258 20 0 DIADLO COC[C@@H]1CCC[N@H+]1Cc1c(Cl)ccc(Cl)c1Cl ZINC001231480753 1053760188 /nfs/dbraw/zinc/76/01/88/1053760188.db2.gz XFSQNCONGVJQNY-VIFPVBQESA-N 1 2 308.636 4.258 20 0 DIADLO Fc1ccc(Cl)c(Br)c1C[N@@H+]1CCC2(CC2)C1 ZINC001232690561 1054101021 /nfs/dbraw/zinc/10/10/21/1054101021.db2.gz IMIVDZJDKJYTPD-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO Fc1ccc(Cl)c(Br)c1C[N@H+]1CCC2(CC2)C1 ZINC001232690561 1054101027 /nfs/dbraw/zinc/10/10/27/1054101027.db2.gz IMIVDZJDKJYTPD-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+]2CCC(F)(F)C[C@@H]2C)s1 ZINC000625980788 1057543228 /nfs/dbraw/zinc/54/32/28/1057543228.db2.gz QQQWOEUQTPFWNC-ZETCQYMHSA-N 1 2 314.323 4.090 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+]2CCC(F)(F)C[C@@H]2C)s1 ZINC000625980788 1057543235 /nfs/dbraw/zinc/54/32/35/1057543235.db2.gz QQQWOEUQTPFWNC-ZETCQYMHSA-N 1 2 314.323 4.090 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@@H]2c2cccs2)cn1 ZINC001560718881 1060579975 /nfs/dbraw/zinc/57/99/75/1060579975.db2.gz LHBMHLMBRRTPJZ-GFCCVEGCSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@@H]2c2cccs2)cn1 ZINC001560718881 1060579994 /nfs/dbraw/zinc/57/99/94/1060579994.db2.gz LHBMHLMBRRTPJZ-GFCCVEGCSA-N 1 2 323.259 4.243 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc(OC(F)(F)F)cc1)C2 ZINC001204415242 1035546043 /nfs/dbraw/zinc/54/60/43/1035546043.db2.gz MHGKMCUATKOECK-UHFFFAOYSA-N 1 2 323.314 4.110 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc(OC(F)(F)F)cc1)C2 ZINC001204415242 1035546051 /nfs/dbraw/zinc/54/60/51/1035546051.db2.gz MHGKMCUATKOECK-UHFFFAOYSA-N 1 2 323.314 4.110 20 0 DIADLO C[C@@H]1CCN(C(=O)CCC2CCCCCC2)C[C@H]1n1cc[nH+]c1 ZINC000654893795 1035616124 /nfs/dbraw/zinc/61/61/24/1035616124.db2.gz UGDMQTKEXFETKS-SJLPKXTDSA-N 1 2 317.477 4.043 20 0 DIADLO COc1c(C)c[nH+]c(C/N=C/c2c(O)ccc3ccccc32)c1C ZINC000064853169 1035714126 /nfs/dbraw/zinc/71/41/26/1035714126.db2.gz AYOMLBHMWHAOHE-SRZZPIQSSA-N 1 2 320.392 4.185 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@@H]2c2cccc(Cl)c2)cn1 ZINC001139933359 1035725142 /nfs/dbraw/zinc/72/51/42/1035725142.db2.gz ZRHBFNCPAOKBHV-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@@H]2c2cccc(Cl)c2)cn1 ZINC001139933359 1035725162 /nfs/dbraw/zinc/72/51/62/1035725162.db2.gz ZRHBFNCPAOKBHV-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccnc(C[N@H+]2CC=C(c3cccc4ccccc43)CC2)n1 ZINC000339583870 1035766255 /nfs/dbraw/zinc/76/62/55/1035766255.db2.gz JYXBGWXSQDZKSE-UHFFFAOYSA-N 1 2 315.420 4.228 20 0 DIADLO Cc1ccnc(C[N@@H+]2CC=C(c3cccc4ccccc43)CC2)n1 ZINC000339583870 1035766267 /nfs/dbraw/zinc/76/62/67/1035766267.db2.gz JYXBGWXSQDZKSE-UHFFFAOYSA-N 1 2 315.420 4.228 20 0 DIADLO CC[C@@H]1CCC[C@]1(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001125301513 1035845917 /nfs/dbraw/zinc/84/59/17/1035845917.db2.gz UJYPEYSXRBUVQO-ACJLOTCBSA-N 1 2 315.392 4.166 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2cccc(OC(C)C)c2)c(C)s1 ZINC000339625611 1035882080 /nfs/dbraw/zinc/88/20/80/1035882080.db2.gz KXAMPPAXCGNIEA-UHFFFAOYSA-N 1 2 304.459 4.179 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2cccc(OC(C)C)c2)c(C)s1 ZINC000339625611 1035882096 /nfs/dbraw/zinc/88/20/96/1035882096.db2.gz KXAMPPAXCGNIEA-UHFFFAOYSA-N 1 2 304.459 4.179 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H]2CCSc3ccc(F)cc32)cs1 ZINC000036968751 1035911739 /nfs/dbraw/zinc/91/17/39/1035911739.db2.gz LSPUHHRZTKUSMD-NOZJJQNGSA-N 1 2 308.447 4.478 20 0 DIADLO CC(C)n1cc(C[N@H+](Cc2ccco2)Cc2ccccc2)cn1 ZINC000179671470 1035919099 /nfs/dbraw/zinc/91/90/99/1035919099.db2.gz PFQZUMVJAQYWEK-UHFFFAOYSA-N 1 2 309.413 4.259 20 0 DIADLO CC(C)n1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2)cn1 ZINC000179671470 1035919115 /nfs/dbraw/zinc/91/91/15/1035919115.db2.gz PFQZUMVJAQYWEK-UHFFFAOYSA-N 1 2 309.413 4.259 20 0 DIADLO c1coc(C[N@H+](Cc2cnn3ccccc23)Cc2ccccc2)c1 ZINC000179671502 1035921114 /nfs/dbraw/zinc/92/11/14/1035921114.db2.gz HHBYMQWPFNFZJR-UHFFFAOYSA-N 1 2 317.392 4.130 20 0 DIADLO c1coc(C[N@@H+](Cc2cnn3ccccc23)Cc2ccccc2)c1 ZINC000179671502 1035921126 /nfs/dbraw/zinc/92/11/26/1035921126.db2.gz HHBYMQWPFNFZJR-UHFFFAOYSA-N 1 2 317.392 4.130 20 0 DIADLO CC[N@H+](CCc1cccs1)Cc1noc(C2CCCCC2)n1 ZINC000533462909 1035938643 /nfs/dbraw/zinc/93/86/43/1035938643.db2.gz RPSKVLANSDVQPN-UHFFFAOYSA-N 1 2 319.474 4.243 20 0 DIADLO CC[N@@H+](CCc1cccs1)Cc1noc(C2CCCCC2)n1 ZINC000533462909 1035938662 /nfs/dbraw/zinc/93/86/62/1035938662.db2.gz RPSKVLANSDVQPN-UHFFFAOYSA-N 1 2 319.474 4.243 20 0 DIADLO Brc1ccc(CNc2ccc([NH+]3CCCC3)cc2)o1 ZINC000037102288 1035942234 /nfs/dbraw/zinc/94/22/34/1035942234.db2.gz DGGASJPLRDNFTA-UHFFFAOYSA-N 1 2 321.218 4.254 20 0 DIADLO C[C@]1(F)CC[N@H+](CCc2ccc(Cl)cc2Cl)C[C@@H]1F ZINC001209081246 1036007690 /nfs/dbraw/zinc/00/76/90/1036007690.db2.gz NBLVQTBLXUFPSB-KBPBESRZSA-N 1 2 308.199 4.308 20 0 DIADLO C[C@]1(F)CC[N@@H+](CCc2ccc(Cl)cc2Cl)C[C@@H]1F ZINC001209081246 1036007710 /nfs/dbraw/zinc/00/77/10/1036007710.db2.gz NBLVQTBLXUFPSB-KBPBESRZSA-N 1 2 308.199 4.308 20 0 DIADLO CCc1cc(N(Cc2ccccn2)C2CCCCC2)nc(C)[nH+]1 ZINC001167102150 1036050383 /nfs/dbraw/zinc/05/03/83/1036050383.db2.gz NAEPEWLSDJTXIY-UHFFFAOYSA-N 1 2 310.445 4.082 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccncc2Br)[C@H]1c1ccccc1 ZINC000625210055 1036058180 /nfs/dbraw/zinc/05/81/80/1036058180.db2.gz AVBVQPAQZLAPNS-MLGOLLRUSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccncc2Br)[C@H]1c1ccccc1 ZINC000625210055 1036058201 /nfs/dbraw/zinc/05/82/01/1036058201.db2.gz AVBVQPAQZLAPNS-MLGOLLRUSA-N 1 2 317.230 4.037 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncccc1Cl)c1cc(F)ccc1OC ZINC000932473000 1036084638 /nfs/dbraw/zinc/08/46/38/1036084638.db2.gz SXBBGQJAQFEVOJ-CQSZACIVSA-N 1 2 308.784 4.124 20 0 DIADLO COc1ccccc1[C@H](C)N(C)c1cc(C)[nH+]c(C(C)(C)C)n1 ZINC001167107324 1036089632 /nfs/dbraw/zinc/08/96/32/1036089632.db2.gz QXHUWRZVNCTNCB-AWEZNQCLSA-N 1 2 313.445 4.289 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+]Cc2coc(-c3cccs3)n2)o1 ZINC000155057709 1036106219 /nfs/dbraw/zinc/10/62/19/1036106219.db2.gz DJZJJLFMRRNRDR-LLVKDONJSA-N 1 2 302.399 4.409 20 0 DIADLO CC[C@H](c1ccccc1)N(C)c1cc(N2CCCCC2)[nH+]cn1 ZINC001167127418 1036143006 /nfs/dbraw/zinc/14/30/06/1036143006.db2.gz DRVZDYMDKIVPCB-QGZVFWFLSA-N 1 2 310.445 4.054 20 0 DIADLO CC[C@H](c1ccccc1)N(C)c1cc(N2CCCCC2)nc[nH+]1 ZINC001167127418 1036143018 /nfs/dbraw/zinc/14/30/18/1036143018.db2.gz DRVZDYMDKIVPCB-QGZVFWFLSA-N 1 2 310.445 4.054 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCOC[C@@H]2c2ccccc2)cc1F ZINC000579885924 1036153217 /nfs/dbraw/zinc/15/32/17/1036153217.db2.gz RLVKQXXPQASKMW-PHWHVTFISA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCOC[C@@H]2c2ccccc2)cc1F ZINC000579885924 1036153224 /nfs/dbraw/zinc/15/32/24/1036153224.db2.gz RLVKQXXPQASKMW-PHWHVTFISA-N 1 2 315.363 4.052 20 0 DIADLO CC(C)=C[C@H]1[C@@H](C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)C1(C)C ZINC000072058469 1036175075 /nfs/dbraw/zinc/17/50/75/1036175075.db2.gz CMYGRPKTSAXJRS-HOTGVXAUSA-N 1 2 309.413 4.254 20 0 DIADLO CC(C)=C[C@@H]1[C@@H](C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)C1(C)C ZINC000072058468 1036175260 /nfs/dbraw/zinc/17/52/60/1036175260.db2.gz CMYGRPKTSAXJRS-CVEARBPZSA-N 1 2 309.413 4.254 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(F)c(Cl)c2Cl)CCCO1 ZINC000683352117 1036194987 /nfs/dbraw/zinc/19/49/87/1036194987.db2.gz XPZORGYEFNWJCC-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(F)c(Cl)c2Cl)CCCO1 ZINC000683352117 1036194997 /nfs/dbraw/zinc/19/49/97/1036194997.db2.gz XPZORGYEFNWJCC-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO Clc1scc(CN2CCC[C@H](n3cc[nH+]c3)C2)c1Cl ZINC000683352919 1036199086 /nfs/dbraw/zinc/19/90/86/1036199086.db2.gz MWGORRTVAMRLIC-NSHDSACASA-N 1 2 316.257 4.089 20 0 DIADLO Cc1cccn2cc(C[N@@H+](C)Cc3ccc(F)c(Cl)c3)nc12 ZINC000683367810 1036220363 /nfs/dbraw/zinc/22/03/63/1036220363.db2.gz HFISBIOYPGJAIU-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1cccn2cc(C[N@H+](C)Cc3ccc(F)c(Cl)c3)nc12 ZINC000683367810 1036220370 /nfs/dbraw/zinc/22/03/70/1036220370.db2.gz HFISBIOYPGJAIU-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO C[N@H+](CCOc1cccc(Cl)c1)Cc1csc(C2CC2)n1 ZINC000340125735 1036222046 /nfs/dbraw/zinc/22/20/46/1036222046.db2.gz ZQZAZATYUYTKJU-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO C[N@@H+](CCOc1cccc(Cl)c1)Cc1csc(C2CC2)n1 ZINC000340125735 1036222063 /nfs/dbraw/zinc/22/20/63/1036222063.db2.gz ZQZAZATYUYTKJU-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO Cc1cc(Nc2cc(Cl)c3[nH+]ccn3c2)ccc1N(C)C ZINC001210042666 1036366788 /nfs/dbraw/zinc/36/67/88/1036366788.db2.gz LARAYDBADVVTAX-UHFFFAOYSA-N 1 2 300.793 4.106 20 0 DIADLO C[C@H]1c2ccc(F)cc2CC[N@H+]1Cc1ccc(C(F)(F)F)cn1 ZINC000683521386 1036437657 /nfs/dbraw/zinc/43/76/57/1036437657.db2.gz KHAUYBDGBPDGEG-NSHDSACASA-N 1 2 324.321 4.359 20 0 DIADLO C[C@H]1c2ccc(F)cc2CC[N@@H+]1Cc1ccc(C(F)(F)F)cn1 ZINC000683521386 1036437668 /nfs/dbraw/zinc/43/76/68/1036437668.db2.gz KHAUYBDGBPDGEG-NSHDSACASA-N 1 2 324.321 4.359 20 0 DIADLO COC(=O)[C@@H](c1cc(Cl)cc(Cl)c1)[N@@H+](C)CC(C)(C)C ZINC001167291178 1036463523 /nfs/dbraw/zinc/46/35/23/1036463523.db2.gz ICYUZXJSCGNCSQ-CYBMUJFWSA-N 1 2 318.244 4.185 20 0 DIADLO COC(=O)[C@@H](c1cc(Cl)cc(Cl)c1)[N@H+](C)CC(C)(C)C ZINC001167291178 1036463506 /nfs/dbraw/zinc/46/35/06/1036463506.db2.gz ICYUZXJSCGNCSQ-CYBMUJFWSA-N 1 2 318.244 4.185 20 0 DIADLO Cc1ccc(COc2ccc(-c3[nH+]cc4n3CCCC4)cc2)cn1 ZINC000655675274 1036472766 /nfs/dbraw/zinc/47/27/66/1036472766.db2.gz PKYOZYPBJZKDQY-UHFFFAOYSA-N 1 2 319.408 4.169 20 0 DIADLO Cc1[nH+]cc(Nc2cc(C(F)(F)F)ccc2Cl)cc1N ZINC001210288942 1036592362 /nfs/dbraw/zinc/59/23/62/1036592362.db2.gz XSFZONUVMYUBJM-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(C(F)(F)F)c(F)c2F)cc1N ZINC001210290657 1036594485 /nfs/dbraw/zinc/59/44/85/1036594485.db2.gz CRULVTRJNFMWMA-UHFFFAOYSA-N 1 2 303.234 4.013 20 0 DIADLO Cc1[nH+]cc(Nc2cccc(COc3ccccc3)c2)cc1N ZINC001210289940 1036595166 /nfs/dbraw/zinc/59/51/66/1036595166.db2.gz BFBGQHJYDVKIEU-UHFFFAOYSA-N 1 2 305.381 4.295 20 0 DIADLO COc1cccc([C@H](C)[NH2+][C@H](C)c2nnc(-c3ccccc3)o2)c1 ZINC000340431632 1036600501 /nfs/dbraw/zinc/60/05/01/1036600501.db2.gz VATXHPRZGHLERQ-UONOGXRCSA-N 1 2 323.396 4.157 20 0 DIADLO CC[C@H]1C[C@H](C[NH2+]c2ccc(N3CCCCC3)cc2)CCO1 ZINC001648856027 1036647432 /nfs/dbraw/zinc/64/74/32/1036647432.db2.gz QNPNWOJCISGICH-APWZRJJASA-N 1 2 302.462 4.294 20 0 DIADLO CC[C@H]1C[C@@H](C[NH2+]c2ccc(N3CCCCC3)cc2)CCO1 ZINC001648856028 1036648241 /nfs/dbraw/zinc/64/82/41/1036648241.db2.gz QNPNWOJCISGICH-LPHOPBHVSA-N 1 2 302.462 4.294 20 0 DIADLO COc1ccc(Br)cc1NCc1cc(C)[nH+]c(C)c1 ZINC001648889005 1036674662 /nfs/dbraw/zinc/67/46/62/1036674662.db2.gz CBRHOOBLPPBWNU-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO Cc1cccn2c(CNc3ccc(COC(C)C)cc3)c[nH+]c12 ZINC001648903317 1036682129 /nfs/dbraw/zinc/68/21/29/1036682129.db2.gz KRNRNIKLHOURCX-UHFFFAOYSA-N 1 2 309.413 4.180 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1ccc2ccccc2c1 ZINC000047514841 1036779718 /nfs/dbraw/zinc/77/97/18/1036779718.db2.gz DVGCNTJIBCBXOB-UHFFFAOYSA-N 1 2 313.360 4.278 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C/c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000121107746 1036789800 /nfs/dbraw/zinc/78/98/00/1036789800.db2.gz DFMSHGLHVYNLKL-RMKNXTFCSA-N 1 2 300.789 4.312 20 0 DIADLO CCc1oc2ccccc2c1CC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001125404489 1036812795 /nfs/dbraw/zinc/81/27/95/1036812795.db2.gz QWJNJQKBOUKUBL-UHFFFAOYSA-N 1 2 322.408 4.497 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1ccc2cnccc2c1 ZINC000683751553 1036824111 /nfs/dbraw/zinc/82/41/11/1036824111.db2.gz YEWWLIOGAXWUJS-UHFFFAOYSA-N 1 2 320.371 4.356 20 0 DIADLO Brc1cccc(C[N@@H+]2CCc3sccc3C2)c1 ZINC000042229704 1036824379 /nfs/dbraw/zinc/82/43/79/1036824379.db2.gz BQJCARNUIKNMTK-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1cccc(C[N@H+]2CCc3sccc3C2)c1 ZINC000042229704 1036824396 /nfs/dbraw/zinc/82/43/96/1036824396.db2.gz BQJCARNUIKNMTK-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Cn1ccnc1[C@H]([NH2+]Cc1cc(Cl)cs1)c1ccccc1 ZINC000683765179 1036859497 /nfs/dbraw/zinc/85/94/97/1036859497.db2.gz CUIYVVVKXDHAJQ-OAHLLOKOSA-N 1 2 317.845 4.014 20 0 DIADLO Cc1nc([C@H]([NH2+][C@@H](C)[C@@H]2CC2(C)C)c2ccc(Cl)cc2)no1 ZINC000683774464 1036892490 /nfs/dbraw/zinc/89/24/90/1036892490.db2.gz VKXSELQDYRANFW-NZVBXONLSA-N 1 2 319.836 4.145 20 0 DIADLO Cc1nc([C@H]([NH2+][C@@H](C)[C@H]2CC2(C)C)c2ccc(Cl)cc2)no1 ZINC000683774463 1036893896 /nfs/dbraw/zinc/89/38/96/1036893896.db2.gz VKXSELQDYRANFW-COLVAYQJSA-N 1 2 319.836 4.145 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CCc3c2cccc3Cl)c(C)[nH+]1 ZINC001125416929 1036933859 /nfs/dbraw/zinc/93/38/59/1036933859.db2.gz IEAGLGROJYSLEK-MRXNPFEDSA-N 1 2 314.816 4.078 20 0 DIADLO CO[C@@H](c1ccccc1)[C@H](C)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000683816071 1036962979 /nfs/dbraw/zinc/96/29/79/1036962979.db2.gz IZGOLCZGGFYTCV-HNAYVOBHSA-N 1 2 307.397 4.060 20 0 DIADLO Fc1cccc([C@H]2CC[N@@H+]2Cc2cnc(-c3ccco3)s2)c1 ZINC000683832594 1036992538 /nfs/dbraw/zinc/99/25/38/1036992538.db2.gz KCIFHGZBDJSXPX-OAHLLOKOSA-N 1 2 314.385 4.489 20 0 DIADLO Fc1cccc([C@H]2CC[N@H+]2Cc2cnc(-c3ccco3)s2)c1 ZINC000683832594 1036992557 /nfs/dbraw/zinc/99/25/57/1036992557.db2.gz KCIFHGZBDJSXPX-OAHLLOKOSA-N 1 2 314.385 4.489 20 0 DIADLO COc1cccc2c(NC[C@H](C)c3c(C)noc3C)cc[nH+]c12 ZINC000275870697 1037082038 /nfs/dbraw/zinc/08/20/38/1037082038.db2.gz VJFYOLJCEHUKSC-NSHDSACASA-N 1 2 311.385 4.064 20 0 DIADLO CC(C)[C@@H]([NH2+][C@H]1CCc2ccc(F)cc21)c1nc(C2CC2)no1 ZINC000089670917 1037259884 /nfs/dbraw/zinc/25/98/84/1037259884.db2.gz IPXQVUOPUDTHDN-JKSUJKDBSA-N 1 2 315.392 4.060 20 0 DIADLO Clc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)c(Cl)n1 ZINC001211277132 1037270703 /nfs/dbraw/zinc/27/07/03/1037270703.db2.gz CYVDKKHJGGFSLH-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO CN(C)c1ccccc1C[N@H+](C)Cc1cc(-c2ccccc2)on1 ZINC000580798032 1037300534 /nfs/dbraw/zinc/30/05/34/1037300534.db2.gz UISAHCVEIZFSMT-UHFFFAOYSA-N 1 2 321.424 4.040 20 0 DIADLO CN(C)c1ccccc1C[N@@H+](C)Cc1cc(-c2ccccc2)on1 ZINC000580798032 1037300549 /nfs/dbraw/zinc/30/05/49/1037300549.db2.gz UISAHCVEIZFSMT-UHFFFAOYSA-N 1 2 321.424 4.040 20 0 DIADLO Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2Br)n1 ZINC000127236752 1037342415 /nfs/dbraw/zinc/34/24/15/1037342415.db2.gz XKWJYALGDPNCNR-NSHDSACASA-N 1 2 323.209 4.142 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2cc(F)cc(F)c2)[C@@H](C)CO1 ZINC001167438469 1037352860 /nfs/dbraw/zinc/35/28/60/1037352860.db2.gz ODFHIUDESVVKAH-LIRRHRJNSA-N 1 2 317.379 4.235 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2cc(F)cc(F)c2)[C@@H](C)CO1 ZINC001167438469 1037352874 /nfs/dbraw/zinc/35/28/74/1037352874.db2.gz ODFHIUDESVVKAH-LIRRHRJNSA-N 1 2 317.379 4.235 20 0 DIADLO CCOC(=O)Cc1ccc(Cl)c(Nc2c[nH+]c(C)cc2C)c1 ZINC001213520764 1037355001 /nfs/dbraw/zinc/35/50/01/1037355001.db2.gz HMFWHIIKJSSKSI-UHFFFAOYSA-N 1 2 318.804 4.201 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1ccccn1 ZINC000684111924 1037360544 /nfs/dbraw/zinc/36/05/44/1037360544.db2.gz VEDVNDOWWLUHQR-CYBMUJFWSA-N 1 2 303.475 4.467 20 0 DIADLO Cc1ccc(OCc2nc(C[NH2+]C3(CF)CCC3)cs2)cc1 ZINC000565833026 1037388097 /nfs/dbraw/zinc/38/80/97/1037388097.db2.gz IBIFSTHAPKMOIU-UHFFFAOYSA-N 1 2 320.433 4.012 20 0 DIADLO Cc1oncc1C[NH+](Cc1cccs1)Cc1cccs1 ZINC000128168688 1037426963 /nfs/dbraw/zinc/42/69/63/1037426963.db2.gz FLLCETDZDCCLGF-UHFFFAOYSA-N 1 2 304.440 4.308 20 0 DIADLO CC1(C)CCC[C@@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000581156676 1037456236 /nfs/dbraw/zinc/45/62/36/1037456236.db2.gz BWRZEAQSJKKXBK-MRXNPFEDSA-N 1 2 322.412 4.275 20 0 DIADLO C=C/C(C)=C/CC(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000684190255 1037521413 /nfs/dbraw/zinc/52/14/13/1037521413.db2.gz AYOLYBBNAINVIC-VIZOYTHASA-N 1 2 321.424 4.347 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000581323756 1037532566 /nfs/dbraw/zinc/53/25/66/1037532566.db2.gz VSDJLVHDSNWJCL-UHFFFAOYSA-N 1 2 314.477 4.166 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000581323756 1037532577 /nfs/dbraw/zinc/53/25/77/1037532577.db2.gz VSDJLVHDSNWJCL-UHFFFAOYSA-N 1 2 314.477 4.166 20 0 DIADLO CCN(C(=O)C[C@@H](C)n1cc[nH+]c1)c1cccc2ccccc21 ZINC000581373110 1037561901 /nfs/dbraw/zinc/56/19/01/1037561901.db2.gz JRGKBULKOVLYBW-OAHLLOKOSA-N 1 2 307.397 4.041 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)o1 ZINC000341070655 1037663068 /nfs/dbraw/zinc/66/30/68/1037663068.db2.gz QIGISSHUCQETPH-NXEZZACHSA-N 1 2 313.323 4.063 20 0 DIADLO c1[nH]c([C@@H]2CCCC[N@H+]2Cc2ccccn2)nc1-c1ccccc1 ZINC000276270053 1037679823 /nfs/dbraw/zinc/67/98/23/1037679823.db2.gz CSDZRKNTUJYLSO-IBGZPJMESA-N 1 2 318.424 4.199 20 0 DIADLO c1[nH]c([C@@H]2CCCC[N@@H+]2Cc2ccccn2)nc1-c1ccccc1 ZINC000276270053 1037679825 /nfs/dbraw/zinc/67/98/25/1037679825.db2.gz CSDZRKNTUJYLSO-IBGZPJMESA-N 1 2 318.424 4.199 20 0 DIADLO CCc1cc(C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cn2)on1 ZINC000581530534 1037716455 /nfs/dbraw/zinc/71/64/55/1037716455.db2.gz WPXHGMSOANCNPE-CQSZACIVSA-N 1 2 323.396 4.275 20 0 DIADLO c1coc(C[N@H+](Cc2cccs2)Cc2ccc3c(n2)CCC3)c1 ZINC000581533990 1037719922 /nfs/dbraw/zinc/71/99/22/1037719922.db2.gz VXXJZXXBNVKKTI-UHFFFAOYSA-N 1 2 324.449 4.427 20 0 DIADLO c1coc(C[N@@H+](Cc2cccs2)Cc2ccc3c(n2)CCC3)c1 ZINC000581533990 1037719944 /nfs/dbraw/zinc/71/99/44/1037719944.db2.gz VXXJZXXBNVKKTI-UHFFFAOYSA-N 1 2 324.449 4.427 20 0 DIADLO Cc1cc2c(s1)N(c1cccc(N)c1)c1ccccc1NC2=[NH2+] ZINC001167469365 1037724035 /nfs/dbraw/zinc/72/40/35/1037724035.db2.gz LMVYLJWNBMQDRQ-UHFFFAOYSA-N 1 2 320.421 4.459 20 0 DIADLO CCC[C@@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1ccccn1 ZINC000090228568 1037760534 /nfs/dbraw/zinc/76/05/34/1037760534.db2.gz QKMOJXBIWHVPKD-CYBMUJFWSA-N 1 2 312.310 4.269 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(Cl)n1)c1nc2ccccc2s1 ZINC000754711267 1037769165 /nfs/dbraw/zinc/76/91/65/1037769165.db2.gz KXLDJRKIHPBDQT-SNVBAGLBSA-N 1 2 303.818 4.196 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2CCCCC[C@H]2c2ccncc2)n1 ZINC000891440449 1037818462 /nfs/dbraw/zinc/81/84/62/1037818462.db2.gz MDFFOQPXSNGBDS-INIZCTEOSA-N 1 2 313.445 4.484 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2CCCCC[C@H]2c2ccncc2)n1 ZINC000891440449 1037818476 /nfs/dbraw/zinc/81/84/76/1037818476.db2.gz MDFFOQPXSNGBDS-INIZCTEOSA-N 1 2 313.445 4.484 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2coc(-c3cccc(F)c3)n2)s1 ZINC000076342205 1037826367 /nfs/dbraw/zinc/82/63/67/1037826367.db2.gz JRJMAUMXKCLLIK-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2coc(-c3cccc(F)c3)n2)s1 ZINC000076342205 1037826387 /nfs/dbraw/zinc/82/63/87/1037826387.db2.gz JRJMAUMXKCLLIK-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1c[nH+]c(CNc2cccc(Cl)c2SC(C)C)n1C ZINC000341268566 1037829333 /nfs/dbraw/zinc/82/93/33/1037829333.db2.gz YWCGOPDJQKMSGA-UHFFFAOYSA-N 1 2 309.866 4.495 20 0 DIADLO c1c2ccncc2sc1CNc1ccc(N2CCCCC2)c[nH+]1 ZINC000656770128 1037855635 /nfs/dbraw/zinc/85/56/35/1037855635.db2.gz OWKPAWLWICJQCD-UHFFFAOYSA-N 1 2 324.453 4.294 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2c(C)oc3ccccc32)s1 ZINC000926162251 1037861671 /nfs/dbraw/zinc/86/16/71/1037861671.db2.gz ANUKKIKFTBKUJR-UWVGGRQHSA-N 1 2 301.415 4.313 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2c(C)oc3ccccc32)s1 ZINC000926162250 1037862168 /nfs/dbraw/zinc/86/21/68/1037862168.db2.gz ANUKKIKFTBKUJR-NXEZZACHSA-N 1 2 301.415 4.313 20 0 DIADLO C[C@@]1([NH2+]Cc2ncc(Cl)cc2Cl)CCOc2ccccc21 ZINC000933376625 1037928943 /nfs/dbraw/zinc/92/89/43/1037928943.db2.gz ZFFFLWFKNRYDHS-MRXNPFEDSA-N 1 2 323.223 4.176 20 0 DIADLO CC[C@H](C)n1ncc(NCc2c[nH+]c3c(C)cccn23)c1C1CC1 ZINC000341380703 1037945675 /nfs/dbraw/zinc/94/56/75/1037945675.db2.gz QUBHWPKSMCQDJW-AWEZNQCLSA-N 1 2 323.444 4.300 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N3CCCCCc4ccccc43)ccn12 ZINC000581735308 1037953402 /nfs/dbraw/zinc/95/34/02/1037953402.db2.gz MHXNOOGAJKZMHO-UHFFFAOYSA-N 1 2 319.408 4.016 20 0 DIADLO CCOc1ccc(C[NH2+]Cc2csc(C3CC3)n2)cc1Cl ZINC000341387607 1037954279 /nfs/dbraw/zinc/95/42/79/1037954279.db2.gz PXXDNIMUYBNYCL-UHFFFAOYSA-N 1 2 322.861 4.362 20 0 DIADLO Cc1c[nH+]c(CNc2cccc(CSc3ccccn3)c2)n1C ZINC000341390278 1037958314 /nfs/dbraw/zinc/95/83/14/1037958314.db2.gz JZHYPEIRVCLFND-UHFFFAOYSA-N 1 2 324.453 4.028 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2coc(-c3cccs3)n2)s1 ZINC000090404823 1037970623 /nfs/dbraw/zinc/97/06/23/1037970623.db2.gz RJRDTSUJSYMNMJ-VIFPVBQESA-N 1 2 305.428 4.019 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccco2)Cc2cccs2)o1 ZINC000891473191 1037976571 /nfs/dbraw/zinc/97/65/71/1037976571.db2.gz APNVEXTUVPERQC-UHFFFAOYSA-N 1 2 303.383 4.145 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccco2)Cc2cccs2)o1 ZINC000891473191 1037976589 /nfs/dbraw/zinc/97/65/89/1037976589.db2.gz APNVEXTUVPERQC-UHFFFAOYSA-N 1 2 303.383 4.145 20 0 DIADLO COc1ccc(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)o1 ZINC000891517904 1038007020 /nfs/dbraw/zinc/00/70/20/1038007020.db2.gz ZSUANXZLQJZYQT-LLVKDONJSA-N 1 2 302.399 4.091 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)o1 ZINC000891517904 1038007042 /nfs/dbraw/zinc/00/70/42/1038007042.db2.gz ZSUANXZLQJZYQT-LLVKDONJSA-N 1 2 302.399 4.091 20 0 DIADLO Cc1cc(C)c(NC(=O)CCc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000097040368 1038016076 /nfs/dbraw/zinc/01/60/76/1038016076.db2.gz WLBNKDDLUSYTIW-UHFFFAOYSA-N 1 2 302.805 4.232 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+][C@@H](COCC(C)C)c2ccco2)s1 ZINC000090406791 1038036453 /nfs/dbraw/zinc/03/64/53/1038036453.db2.gz JJLOYXAWJMMDHB-OCCSQVGLSA-N 1 2 308.447 4.109 20 0 DIADLO Cc1cc(C)c(CNc2cc[nH+]c3c(Cl)cccc23)c(=O)[nH]1 ZINC000341479470 1038055719 /nfs/dbraw/zinc/05/57/19/1038055719.db2.gz XSJCHVNVYUNDFC-UHFFFAOYSA-N 1 2 313.788 4.218 20 0 DIADLO Cc1ccc(F)c(NC(=O)C[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000341507717 1038060796 /nfs/dbraw/zinc/06/07/96/1038060796.db2.gz PPGMQUWCZYMOPH-OAHLLOKOSA-N 1 2 323.371 4.018 20 0 DIADLO COc1ccc(CO)cc1Nc1cc[nH+]c2cc(Cl)ccc12 ZINC001211519737 1038069353 /nfs/dbraw/zinc/06/93/53/1038069353.db2.gz ZMDIGNYMZMBZSI-UHFFFAOYSA-N 1 2 314.772 4.133 20 0 DIADLO Fc1ccc2oc(/C(Cl)=C\c3cccc4[nH+]ccn43)nc2c1 ZINC000255370458 1038074578 /nfs/dbraw/zinc/07/45/78/1038074578.db2.gz LDTKCHLLTWAGNI-FMIVXFBMSA-N 1 2 313.719 4.352 20 0 DIADLO Cc1ccc(C2=CC[N@H+]([C@H](C)c3nc(C4CC4)no3)CC2)cc1 ZINC000051287345 1038117048 /nfs/dbraw/zinc/11/70/48/1038117048.db2.gz HTYNYACDBUETQG-CQSZACIVSA-N 1 2 309.413 4.106 20 0 DIADLO Cc1ccc(C2=CC[N@@H+]([C@H](C)c3nc(C4CC4)no3)CC2)cc1 ZINC000051287345 1038117057 /nfs/dbraw/zinc/11/70/57/1038117057.db2.gz HTYNYACDBUETQG-CQSZACIVSA-N 1 2 309.413 4.106 20 0 DIADLO CC[N@H+](Cc1nc(C(C)(C)C)co1)[C@@H](C)c1cccc(O)c1 ZINC000891713432 1038158047 /nfs/dbraw/zinc/15/80/47/1038158047.db2.gz DKLDIEJVUDWJQK-ZDUSSCGKSA-N 1 2 302.418 4.261 20 0 DIADLO CC[N@@H+](Cc1nc(C(C)(C)C)co1)[C@@H](C)c1cccc(O)c1 ZINC000891713432 1038158058 /nfs/dbraw/zinc/15/80/58/1038158058.db2.gz DKLDIEJVUDWJQK-ZDUSSCGKSA-N 1 2 302.418 4.261 20 0 DIADLO CCCc1noc(C[NH2+][C@H](CC(C)(C)C)c2ccccc2)n1 ZINC000341594765 1038166835 /nfs/dbraw/zinc/16/68/35/1038166835.db2.gz NNRZWUYSXYQUOG-OAHLLOKOSA-N 1 2 301.434 4.289 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccccc1OC(F)(F)F ZINC000581955160 1038172955 /nfs/dbraw/zinc/17/29/55/1038172955.db2.gz WMEIKXCNCHTARP-ZJUUUORDSA-N 1 2 316.348 4.454 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cc1nc2cccnc2s1 ZINC000341614334 1038179702 /nfs/dbraw/zinc/17/97/02/1038179702.db2.gz ZAXQNSMNGQQMBY-UHFFFAOYSA-N 1 2 309.847 4.038 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1nc2cccnc2s1 ZINC000341614334 1038179704 /nfs/dbraw/zinc/17/97/04/1038179704.db2.gz ZAXQNSMNGQQMBY-UHFFFAOYSA-N 1 2 309.847 4.038 20 0 DIADLO Cc1cc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c(C)s1 ZINC000684519391 1038205086 /nfs/dbraw/zinc/20/50/86/1038205086.db2.gz MEKAQLAXHREIIG-UHFFFAOYSA-N 1 2 311.410 4.316 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(C(=O)OC(C)(C)C)s1)c1cscn1 ZINC000598983542 1038207736 /nfs/dbraw/zinc/20/77/36/1038207736.db2.gz OVHSINYAJUXSLP-JTQLQIEISA-N 1 2 324.471 4.011 20 0 DIADLO COc1cccc(C[NH2+]Cc2c(Cl)cccc2Cl)c1F ZINC000669680950 1038211818 /nfs/dbraw/zinc/21/18/18/1038211818.db2.gz WVAGKRLKDUMWRN-UHFFFAOYSA-N 1 2 314.187 4.431 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CC=C(c3c[nH]c4ccccc43)CC2)s1 ZINC000933819240 1038230994 /nfs/dbraw/zinc/23/09/94/1038230994.db2.gz NAIZEOSKDHFSLW-GFCCVEGCSA-N 1 2 324.453 4.178 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CC=C(c3c[nH]c4ccccc43)CC2)s1 ZINC000933819240 1038231009 /nfs/dbraw/zinc/23/10/09/1038231009.db2.gz NAIZEOSKDHFSLW-GFCCVEGCSA-N 1 2 324.453 4.178 20 0 DIADLO CCn1ccnc1C[N@H+](C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000341809229 1038274458 /nfs/dbraw/zinc/27/44/58/1038274458.db2.gz NHVLFTZGPNICAQ-GFCCVEGCSA-N 1 2 311.351 4.115 20 0 DIADLO CCn1ccnc1C[N@@H+](C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000341809229 1038274475 /nfs/dbraw/zinc/27/44/75/1038274475.db2.gz NHVLFTZGPNICAQ-GFCCVEGCSA-N 1 2 311.351 4.115 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[NH2+][C@@H](C)c1cccc(O)c1 ZINC000341805640 1038274595 /nfs/dbraw/zinc/27/45/95/1038274595.db2.gz HPARUBZCWPGTKO-NSHDSACASA-N 1 2 314.410 4.268 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)c1cc(F)c(Cl)cc1Cl ZINC000603785219 1038281005 /nfs/dbraw/zinc/28/10/05/1038281005.db2.gz GCDMNRDQRCDGRN-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1ccc(C(F)(F)F)cn1 ZINC000341832969 1038289680 /nfs/dbraw/zinc/28/96/80/1038289680.db2.gz NOUKDRYWELWCND-UHFFFAOYSA-N 1 2 324.346 4.131 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1ccc(C(F)(F)F)cn1 ZINC000341832969 1038289690 /nfs/dbraw/zinc/28/96/90/1038289690.db2.gz NOUKDRYWELWCND-UHFFFAOYSA-N 1 2 324.346 4.131 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccccc2)no1)c1ccc(C2CC2)cc1 ZINC000581993225 1038293892 /nfs/dbraw/zinc/29/38/92/1038293892.db2.gz DEUOXKRBBQBXIW-CQSZACIVSA-N 1 2 319.408 4.465 20 0 DIADLO CCCc1ccc(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000024050742 1038296131 /nfs/dbraw/zinc/29/61/31/1038296131.db2.gz GSFQHKKVPVILMG-UHFFFAOYSA-N 1 2 305.381 4.077 20 0 DIADLO CCc1nnc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H](C)CC)o1 ZINC000341857942 1038299102 /nfs/dbraw/zinc/29/91/02/1038299102.db2.gz FRYHAHRTELQTGR-BZNIZROVSA-N 1 2 307.825 4.162 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Nc1cccc(Nc2ccccc2)c1 ZINC000603874096 1038311256 /nfs/dbraw/zinc/31/12/56/1038311256.db2.gz MQOZDASVFPFKPV-UHFFFAOYSA-N 1 2 320.396 4.046 20 0 DIADLO Cc1ccc([C@@H]2CCCCN2C(=O)Nc2cc(C)[nH+]cc2C)cc1 ZINC000535772771 1038333695 /nfs/dbraw/zinc/33/36/95/1038333695.db2.gz NJXZLFPRZGIBQE-IBGZPJMESA-N 1 2 323.440 4.188 20 0 DIADLO Fc1cccc(Cl)c1C[C@H]1CCC[N@@H+]1Cc1cscn1 ZINC000535796037 1038340830 /nfs/dbraw/zinc/34/08/30/1038340830.db2.gz QSKXQWLPKMRLSE-GFCCVEGCSA-N 1 2 310.825 4.143 20 0 DIADLO Fc1cccc(Cl)c1C[C@H]1CCC[N@H+]1Cc1cscn1 ZINC000535796037 1038340843 /nfs/dbraw/zinc/34/08/43/1038340843.db2.gz QSKXQWLPKMRLSE-GFCCVEGCSA-N 1 2 310.825 4.143 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccccc2C(F)(F)F)o1 ZINC000341992744 1038363649 /nfs/dbraw/zinc/36/36/49/1038363649.db2.gz COXPOMBUFNDXQT-UWVGGRQHSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)[NH2+]C1CC(F)(c2cccc(Cl)c2)C1 ZINC000684613321 1038386396 /nfs/dbraw/zinc/38/63/96/1038386396.db2.gz OKCKLOLXPATREX-BVDFTEHZSA-N 1 2 307.800 4.050 20 0 DIADLO Cc1c2ccccc2oc1CNc1cc(N2CCCCC2)nc[nH+]1 ZINC000604378270 1038407551 /nfs/dbraw/zinc/40/75/51/1038407551.db2.gz PRXZZFVQIYJOTK-UHFFFAOYSA-N 1 2 322.412 4.134 20 0 DIADLO Cc1c2ccccc2oc1CNc1cc(N2CCCCC2)[nH+]cn1 ZINC000604378270 1038407561 /nfs/dbraw/zinc/40/75/61/1038407561.db2.gz PRXZZFVQIYJOTK-UHFFFAOYSA-N 1 2 322.412 4.134 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(C(F)(F)F)c2)C(C)(C)CO1 ZINC000604389790 1038409604 /nfs/dbraw/zinc/40/96/04/1038409604.db2.gz UNGLSRJJNUJJIK-UHFFFAOYSA-N 1 2 301.352 4.095 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(C(F)(F)F)c2)C(C)(C)CO1 ZINC000604389790 1038409614 /nfs/dbraw/zinc/40/96/14/1038409614.db2.gz UNGLSRJJNUJJIK-UHFFFAOYSA-N 1 2 301.352 4.095 20 0 DIADLO Fc1ccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)cc1F ZINC000604395422 1038411410 /nfs/dbraw/zinc/41/14/10/1038411410.db2.gz YFHSQRGMOYEREF-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1ccc(C[N@H+]2CCSC[C@H]2c2ccccc2)cc1F ZINC000604395422 1038411415 /nfs/dbraw/zinc/41/14/15/1038411415.db2.gz YFHSQRGMOYEREF-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)o1 ZINC001232444210 1038418833 /nfs/dbraw/zinc/41/88/33/1038418833.db2.gz RQSWBPVPIVNEOO-MRVPVSSYSA-N 1 2 301.230 4.073 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)o1 ZINC001232444210 1038418838 /nfs/dbraw/zinc/41/88/38/1038418838.db2.gz RQSWBPVPIVNEOO-MRVPVSSYSA-N 1 2 301.230 4.073 20 0 DIADLO CCc1noc(C[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)n1 ZINC000657203808 1038434221 /nfs/dbraw/zinc/43/42/21/1038434221.db2.gz OMZLCOQLDFBHBJ-GOSISDBHSA-N 1 2 311.429 4.139 20 0 DIADLO CCc1noc(C[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)n1 ZINC000657203808 1038434223 /nfs/dbraw/zinc/43/42/23/1038434223.db2.gz OMZLCOQLDFBHBJ-GOSISDBHSA-N 1 2 311.429 4.139 20 0 DIADLO Clc1ccc(Cl)c(C[NH+]2CCC3(CCO3)CC2)c1Cl ZINC000669718322 1038436073 /nfs/dbraw/zinc/43/60/73/1038436073.db2.gz WYVMHOXEPSYRMR-UHFFFAOYSA-N 1 2 320.647 4.402 20 0 DIADLO C[C@@H](CC(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1cccc(F)c1 ZINC000604700102 1038437910 /nfs/dbraw/zinc/43/79/10/1038437910.db2.gz RMXGMZFLJUBVLC-AWEZNQCLSA-N 1 2 323.371 4.144 20 0 DIADLO CCCCn1c(SCC2CC=CC2)nnc1[C@H](CC)[NH+](C)C ZINC000657225517 1038442687 /nfs/dbraw/zinc/44/26/87/1038442687.db2.gz JZEPVALYQRQPSH-HNNXBMFYSA-N 1 2 322.522 4.149 20 0 DIADLO Cc1cc(N2CCC[C@@H](c3ccccc3)CC2)nc(C2CC2)[nH+]1 ZINC000604757602 1038448445 /nfs/dbraw/zinc/44/84/45/1038448445.db2.gz KNLDFRWVRWBEAB-QGZVFWFLSA-N 1 2 307.441 4.437 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@@H+]2Cc2nc3ccccc3o2)cc1 ZINC000604761527 1038448652 /nfs/dbraw/zinc/44/86/52/1038448652.db2.gz IWTALTVMIBJKKD-KRWDZBQOSA-N 1 2 324.449 4.426 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@H+]2Cc2nc3ccccc3o2)cc1 ZINC000604761527 1038448661 /nfs/dbraw/zinc/44/86/61/1038448661.db2.gz IWTALTVMIBJKKD-KRWDZBQOSA-N 1 2 324.449 4.426 20 0 DIADLO Cc1cc(N2CCC[C@@H]2Cc2ccccc2C)nc(C2CC2)[nH+]1 ZINC000604756584 1038449352 /nfs/dbraw/zinc/44/93/52/1038449352.db2.gz NEWUFEOOGZGHQN-GOSISDBHSA-N 1 2 307.441 4.182 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2c(Cl)n[nH]c2C2CC2)s1 ZINC000891991602 1038455626 /nfs/dbraw/zinc/45/56/26/1038455626.db2.gz DLSYGGLZQWRGHN-SECBINFHSA-N 1 2 324.881 4.207 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2c(Cl)n[nH]c2C2CC2)s1 ZINC000891991602 1038455630 /nfs/dbraw/zinc/45/56/30/1038455630.db2.gz DLSYGGLZQWRGHN-SECBINFHSA-N 1 2 324.881 4.207 20 0 DIADLO O=C(Nc1ccc(F)c(C2CC2)c1)c1cccc(-n2cc[nH+]c2)c1 ZINC000342166129 1038461315 /nfs/dbraw/zinc/46/13/15/1038461315.db2.gz OHXZXMJDCYHZAC-UHFFFAOYSA-N 1 2 321.355 4.141 20 0 DIADLO C[N@H+](CC/C=C/c1ccc(Br)cc1)CC(F)F ZINC000604998004 1038476232 /nfs/dbraw/zinc/47/62/32/1038476232.db2.gz ZBOXVRSBHMUUIT-DUXPYHPUSA-N 1 2 304.178 4.049 20 0 DIADLO C[N@@H+](CC/C=C/c1ccc(Br)cc1)CC(F)F ZINC000604998004 1038476234 /nfs/dbraw/zinc/47/62/34/1038476234.db2.gz ZBOXVRSBHMUUIT-DUXPYHPUSA-N 1 2 304.178 4.049 20 0 DIADLO CCCC[C@@H](CC)CC(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000605022208 1038479255 /nfs/dbraw/zinc/47/92/55/1038479255.db2.gz WVEIIMBDNTZNSC-MRXNPFEDSA-N 1 2 313.445 4.095 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2c(F)cncc2F)C1 ZINC001167503756 1038480424 /nfs/dbraw/zinc/48/04/24/1038480424.db2.gz DNUMUYXMYHAUHJ-APPDUMDISA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2c(F)cncc2F)C1 ZINC001167503756 1038480428 /nfs/dbraw/zinc/48/04/28/1038480428.db2.gz DNUMUYXMYHAUHJ-APPDUMDISA-N 1 2 306.331 4.082 20 0 DIADLO c1cc(C[N@@H+](CCSc2ccccc2)Cc2ccccc2)n[nH]1 ZINC000605150479 1038494662 /nfs/dbraw/zinc/49/46/62/1038494662.db2.gz WMDALCNOBPFCTE-UHFFFAOYSA-N 1 2 323.465 4.204 20 0 DIADLO c1cc(C[N@H+](CCSc2ccccc2)Cc2ccccc2)n[nH]1 ZINC000605150479 1038494665 /nfs/dbraw/zinc/49/46/65/1038494665.db2.gz WMDALCNOBPFCTE-UHFFFAOYSA-N 1 2 323.465 4.204 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CCCCC2)cs1)c1cncs1 ZINC000934194535 1038507113 /nfs/dbraw/zinc/50/71/13/1038507113.db2.gz XYKKBTMCTMQCAX-NSHDSACASA-N 1 2 307.488 4.498 20 0 DIADLO C[C@@H]1[C@H](C)SCC[N@@H+]1Cc1csc(Cc2ccccc2)n1 ZINC000605317126 1038509602 /nfs/dbraw/zinc/50/96/02/1038509602.db2.gz TUXVBEOLYMLKRE-KGLIPLIRSA-N 1 2 318.511 4.060 20 0 DIADLO C[C@@H]1[C@H](C)SCC[N@H+]1Cc1csc(Cc2ccccc2)n1 ZINC000605317126 1038509613 /nfs/dbraw/zinc/50/96/13/1038509613.db2.gz TUXVBEOLYMLKRE-KGLIPLIRSA-N 1 2 318.511 4.060 20 0 DIADLO COc1c(C)c[nH+]c(CSc2c(F)cc(F)cc2F)c1C ZINC000605446326 1038515838 /nfs/dbraw/zinc/51/58/38/1038515838.db2.gz MLWZHZYCZKIXJA-UHFFFAOYSA-N 1 2 313.344 4.417 20 0 DIADLO Cc1cnc(C2CC[NH+](Cc3csc(C4CC4)n3)CC2)s1 ZINC000277344673 1038516635 /nfs/dbraw/zinc/51/66/35/1038516635.db2.gz DJSJGUHOOYSFHH-UHFFFAOYSA-N 1 2 319.499 4.165 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC[C@@H](C)C[C@@H]1c1ccc(CC)o1 ZINC001167509767 1038524120 /nfs/dbraw/zinc/52/41/20/1038524120.db2.gz PVIDDMXOAHARIQ-HLLBOEOZSA-N 1 2 321.461 4.347 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CC[C@@H](C)C[C@@H]1c1ccc(CC)o1 ZINC001167509767 1038524123 /nfs/dbraw/zinc/52/41/23/1038524123.db2.gz PVIDDMXOAHARIQ-HLLBOEOZSA-N 1 2 321.461 4.347 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1nc(C2CCCC2)no1 ZINC000342356040 1038552908 /nfs/dbraw/zinc/55/29/08/1038552908.db2.gz FBRURTORWFDAEB-QGZVFWFLSA-N 1 2 311.429 4.064 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1nc(C2CCCC2)no1 ZINC000342356040 1038552922 /nfs/dbraw/zinc/55/29/22/1038552922.db2.gz FBRURTORWFDAEB-QGZVFWFLSA-N 1 2 311.429 4.064 20 0 DIADLO Clc1ccc(/C=C\C[N@@H+]2CCO[C@@H](c3ccco3)C2)cc1 ZINC000255161443 1038570543 /nfs/dbraw/zinc/57/05/43/1038570543.db2.gz PEYFCJAKEXIYLH-YKUAXSNGSA-N 1 2 303.789 4.020 20 0 DIADLO Clc1ccc(/C=C\C[N@H+]2CCO[C@@H](c3ccco3)C2)cc1 ZINC000255161443 1038570549 /nfs/dbraw/zinc/57/05/49/1038570549.db2.gz PEYFCJAKEXIYLH-YKUAXSNGSA-N 1 2 303.789 4.020 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1nc(C(C)C)ns1)C(C)(C)C ZINC000934285928 1038579686 /nfs/dbraw/zinc/57/96/86/1038579686.db2.gz ADLVJYVRQIRAPX-OAHLLOKOSA-N 1 2 318.490 4.242 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cc4ccc(C)cc4[nH]3)CCCCC2)no1 ZINC000657340772 1038583897 /nfs/dbraw/zinc/58/38/97/1038583897.db2.gz YCIFHXYZMZORON-UHFFFAOYSA-N 1 2 324.428 4.117 20 0 DIADLO Cc1ccc(OC2CCN(c3cc(C)[nH+]c(C4CC4)n3)CC2)cc1 ZINC000342416967 1038583912 /nfs/dbraw/zinc/58/39/12/1038583912.db2.gz HPMJHPGWRWMVII-UHFFFAOYSA-N 1 2 323.440 4.019 20 0 DIADLO F[C@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccc(Cl)cc1OC(F)(F)F ZINC001143437393 1038588638 /nfs/dbraw/zinc/58/86/38/1038588638.db2.gz ZXPFYCPFYUXELM-DLOVCJGASA-N 1 2 323.717 4.171 20 0 DIADLO F[C@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccc(Cl)cc1OC(F)(F)F ZINC001143437393 1038588648 /nfs/dbraw/zinc/58/86/48/1038588648.db2.gz ZXPFYCPFYUXELM-DLOVCJGASA-N 1 2 323.717 4.171 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000892194647 1038590197 /nfs/dbraw/zinc/59/01/97/1038590197.db2.gz WZSRNGFOGPTXRS-HNNXBMFYSA-N 1 2 301.434 4.038 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000892194647 1038590202 /nfs/dbraw/zinc/59/02/02/1038590202.db2.gz WZSRNGFOGPTXRS-HNNXBMFYSA-N 1 2 301.434 4.038 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000606432796 1038601643 /nfs/dbraw/zinc/60/16/43/1038601643.db2.gz MAGVMRXRKBUTHU-MOPGFXCFSA-N 1 2 317.379 4.489 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@H+]1CCO[C@H](c2cccc(F)c2)C1 ZINC000606432796 1038601645 /nfs/dbraw/zinc/60/16/45/1038601645.db2.gz MAGVMRXRKBUTHU-MOPGFXCFSA-N 1 2 317.379 4.489 20 0 DIADLO c1cn2c(cccc2CNc2ccc(Oc3cccnc3)cc2)[nH+]1 ZINC000342439107 1038603198 /nfs/dbraw/zinc/60/31/98/1038603198.db2.gz KQLRQWRYPZXJDR-UHFFFAOYSA-N 1 2 316.364 4.134 20 0 DIADLO CC[C@H](NC(=O)Nc1ccc2[nH+]c(C)cn2c1)C1CCCCC1 ZINC000606569709 1038615124 /nfs/dbraw/zinc/61/51/24/1038615124.db2.gz QOALRUAXDKLRNZ-INIZCTEOSA-N 1 2 314.433 4.123 20 0 DIADLO CC(C)C[C@@H](NC(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000606580350 1038615624 /nfs/dbraw/zinc/61/56/24/1038615624.db2.gz KZBBWWLKFDCPOY-QGZVFWFLSA-N 1 2 322.412 4.243 20 0 DIADLO CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606582822 1038616031 /nfs/dbraw/zinc/61/60/31/1038616031.db2.gz FOQFLDBEPUPAJO-GOSISDBHSA-N 1 2 322.412 4.195 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1ccc(F)c(F)c1F ZINC000657376931 1038619750 /nfs/dbraw/zinc/61/97/50/1038619750.db2.gz QNBKALRTDVQSKN-SECBINFHSA-N 1 2 313.294 4.102 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2ccc(F)c(F)c2F)on1 ZINC000657378196 1038620665 /nfs/dbraw/zinc/62/06/65/1038620665.db2.gz ZVOPTKJIPUZQSB-UHFFFAOYSA-N 1 2 312.335 4.285 20 0 DIADLO FC[C@H]([NH2+]Cc1cccnc1C(F)(F)F)c1ccc(F)cc1 ZINC000640155274 1038621218 /nfs/dbraw/zinc/62/12/18/1038621218.db2.gz SIUVKPPZWPTJMG-ZDUSSCGKSA-N 1 2 316.273 4.040 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2cccc(OC3CC3)c2F)s1 ZINC000657388184 1038628865 /nfs/dbraw/zinc/62/88/65/1038628865.db2.gz HEDQZSOBHCRCCI-UHFFFAOYSA-N 1 2 320.433 4.157 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)c1sccc1-c1ccccc1 ZINC000684820664 1038633032 /nfs/dbraw/zinc/63/30/32/1038633032.db2.gz LZJLXWNIKVBPSK-UHFFFAOYSA-N 1 2 319.389 4.315 20 0 DIADLO Cc1c[nH]c(C[NH2+]Cc2ccc(C)cc2O[C@@H](C)CC(C)C)n1 ZINC000657394979 1038634812 /nfs/dbraw/zinc/63/48/12/1038634812.db2.gz YAPPHKMYSBQIQZ-INIZCTEOSA-N 1 2 315.461 4.130 20 0 DIADLO CCCc1noc(C[N@@H+]2CCCCC[C@H]2c2ccc(CC)o2)n1 ZINC000606936244 1038644479 /nfs/dbraw/zinc/64/44/79/1038644479.db2.gz HIZFEMAICWTUEB-HNNXBMFYSA-N 1 2 317.433 4.295 20 0 DIADLO CCCc1noc(C[N@H+]2CCCCC[C@H]2c2ccc(CC)o2)n1 ZINC000606936244 1038644485 /nfs/dbraw/zinc/64/44/85/1038644485.db2.gz HIZFEMAICWTUEB-HNNXBMFYSA-N 1 2 317.433 4.295 20 0 DIADLO FC(F)(F)COc1ccc(CNc2cc3cc[nH]c3c[nH+]2)cc1 ZINC000684839034 1038647157 /nfs/dbraw/zinc/64/71/57/1038647157.db2.gz AQCSDEISPUZCCK-UHFFFAOYSA-N 1 2 321.302 4.116 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@H](C)c2cccc(C3CC3)c2)c[nH+]1 ZINC000582403526 1038658404 /nfs/dbraw/zinc/65/84/04/1038658404.db2.gz QBHRUNZRMCVFNC-OAHLLOKOSA-N 1 2 323.440 4.136 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(Br)ccc2F)C1(C)C ZINC001167572525 1038659390 /nfs/dbraw/zinc/65/93/90/1038659390.db2.gz OQUBKLLQIIUSPY-UHFFFAOYSA-N 1 2 300.215 4.209 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(Br)ccc2F)C1(C)C ZINC001167572525 1038659395 /nfs/dbraw/zinc/65/93/95/1038659395.db2.gz OQUBKLLQIIUSPY-UHFFFAOYSA-N 1 2 300.215 4.209 20 0 DIADLO CC1(C)CC[C@@H](c2nc(-c3ccccc3-n3cc[nH+]c3)no2)C1 ZINC001211544594 1038659552 /nfs/dbraw/zinc/65/95/52/1038659552.db2.gz CZWWZTUUGMEQEU-CYBMUJFWSA-N 1 2 308.385 4.216 20 0 DIADLO Cc1nc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)cs1 ZINC000277633321 1038680434 /nfs/dbraw/zinc/68/04/34/1038680434.db2.gz CNFNZPAGOJXMRL-UHFFFAOYSA-N 1 2 324.453 4.263 20 0 DIADLO CCCOc1cccc2c(N3CCC[C@@H](OC)CC3)cc[nH+]c12 ZINC000684891617 1038683268 /nfs/dbraw/zinc/68/32/68/1038683268.db2.gz YGCVBPBEMGSKDM-OAHLLOKOSA-N 1 2 314.429 4.029 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(Br)cc2)c(C)[nH+]1 ZINC000097039881 1038685151 /nfs/dbraw/zinc/68/51/51/1038685151.db2.gz CPNJKEFERYQRQM-UHFFFAOYSA-N 1 2 319.202 4.022 20 0 DIADLO Cc1ncsc1CNc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000277654793 1038687781 /nfs/dbraw/zinc/68/77/81/1038687781.db2.gz FXCAXSPOYQMWPB-UHFFFAOYSA-N 1 2 324.453 4.263 20 0 DIADLO C[C@H]1CCC[C@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1 ZINC000607484606 1038688108 /nfs/dbraw/zinc/68/81/08/1038688108.db2.gz HEOVNWLDFIPWEV-STQMWFEESA-N 1 2 317.820 4.291 20 0 DIADLO COCc1cnc(C[N@H+](Cc2ccc(C)s2)C(C)C)s1 ZINC000342625846 1038693144 /nfs/dbraw/zinc/69/31/44/1038693144.db2.gz TVGJGPTYLJZIGD-UHFFFAOYSA-N 1 2 310.488 4.070 20 0 DIADLO COCc1cnc(C[N@@H+](Cc2ccc(C)s2)C(C)C)s1 ZINC000342625846 1038693146 /nfs/dbraw/zinc/69/31/46/1038693146.db2.gz TVGJGPTYLJZIGD-UHFFFAOYSA-N 1 2 310.488 4.070 20 0 DIADLO Cc1nn(C(C)C)cc1CNc1[nH+]c2ccccc2n1C1CC1 ZINC000684904759 1038694729 /nfs/dbraw/zinc/69/47/29/1038694729.db2.gz XUHRPVKBSAMLHT-UHFFFAOYSA-N 1 2 309.417 4.069 20 0 DIADLO CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)[N@H+](C)Cc1ccoc1 ZINC000342639816 1038697700 /nfs/dbraw/zinc/69/77/00/1038697700.db2.gz OUAJKPIYCQJHID-HUUCEWRRSA-N 1 2 314.429 4.252 20 0 DIADLO CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccoc1 ZINC000342639816 1038697704 /nfs/dbraw/zinc/69/77/04/1038697704.db2.gz OUAJKPIYCQJHID-HUUCEWRRSA-N 1 2 314.429 4.252 20 0 DIADLO C[C@H](c1ccco1)[N@H+](Cc1nc2ccc(F)cc2o1)C1CC1 ZINC000119938878 1038714062 /nfs/dbraw/zinc/71/40/62/1038714062.db2.gz PJWYXZKELCIPKZ-LLVKDONJSA-N 1 2 300.333 4.286 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](Cc1nc2ccc(F)cc2o1)C1CC1 ZINC000119938878 1038714070 /nfs/dbraw/zinc/71/40/70/1038714070.db2.gz PJWYXZKELCIPKZ-LLVKDONJSA-N 1 2 300.333 4.286 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ncc(-c2cccs2)o1 ZINC000607748064 1038721845 /nfs/dbraw/zinc/72/18/45/1038721845.db2.gz KSTAJZIJQVHHOT-ZDUSSCGKSA-N 1 2 310.422 4.350 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ncc(-c2cccs2)o1 ZINC000607748064 1038721852 /nfs/dbraw/zinc/72/18/52/1038721852.db2.gz KSTAJZIJQVHHOT-ZDUSSCGKSA-N 1 2 310.422 4.350 20 0 DIADLO CC[C@@H](C)[C@@H](C(=O)Nc1cccc2[nH+]ccn21)c1ccccc1 ZINC000607714937 1038725928 /nfs/dbraw/zinc/72/59/28/1038725928.db2.gz NXDPMUCYMCBHDU-RDTXWAMCSA-N 1 2 307.397 4.103 20 0 DIADLO COCc1cnc(C[N@H+](C)[C@@H](C)c2cc3ccccc3o2)s1 ZINC000342710324 1038732832 /nfs/dbraw/zinc/73/28/32/1038732832.db2.gz GSIJUFPWWAWGPD-LBPRGKRZSA-N 1 2 316.426 4.229 20 0 DIADLO COCc1cnc(C[N@@H+](C)[C@@H](C)c2cc3ccccc3o2)s1 ZINC000342710324 1038732837 /nfs/dbraw/zinc/73/28/37/1038732837.db2.gz GSIJUFPWWAWGPD-LBPRGKRZSA-N 1 2 316.426 4.229 20 0 DIADLO Cc1ccc(OCCC(=O)Nc2c(C)cc(C)[nH+]c2C)c(C)c1 ZINC000097214176 1038737210 /nfs/dbraw/zinc/73/72/10/1038737210.db2.gz XZABKIPLWWSEJV-UHFFFAOYSA-N 1 2 312.413 4.031 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@H]2CCCc3cccnc32)n1 ZINC000684955485 1038738822 /nfs/dbraw/zinc/73/88/22/1038738822.db2.gz NZZIANNDKBIOAU-ZDUSSCGKSA-N 1 2 301.459 4.003 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2nc(C3CC3)cs2)cc1 ZINC000342766928 1038763585 /nfs/dbraw/zinc/76/35/85/1038763585.db2.gz YULMLUXSVUVECM-INIZCTEOSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2nc(C3CC3)cs2)cc1 ZINC000342766928 1038763593 /nfs/dbraw/zinc/76/35/93/1038763593.db2.gz YULMLUXSVUVECM-INIZCTEOSA-N 1 2 302.418 4.497 20 0 DIADLO Cc1c[nH+]c(CN(C)[C@@H](C)c2ccc(Cl)cc2Cl)n1C ZINC000342775311 1038770903 /nfs/dbraw/zinc/77/09/03/1038770903.db2.gz FDEQEQYLTLNXOU-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO c1ccc([C@H](CC2CC2)Nc2cc(N3CCCCC3)nc[nH+]2)cc1 ZINC000608090659 1038772058 /nfs/dbraw/zinc/77/20/58/1038772058.db2.gz SICNXAZFZVCNCM-SFHVURJKSA-N 1 2 322.456 4.420 20 0 DIADLO c1ccc([C@H](CC2CC2)Nc2cc(N3CCCCC3)[nH+]cn2)cc1 ZINC000608090659 1038772065 /nfs/dbraw/zinc/77/20/65/1038772065.db2.gz SICNXAZFZVCNCM-SFHVURJKSA-N 1 2 322.456 4.420 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)n1C ZINC000342797687 1038795539 /nfs/dbraw/zinc/79/55/39/1038795539.db2.gz HQYYTEVTTKQGKW-SFHVURJKSA-N 1 2 319.452 4.492 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)n1C ZINC000342797687 1038795557 /nfs/dbraw/zinc/79/55/57/1038795557.db2.gz HQYYTEVTTKQGKW-SFHVURJKSA-N 1 2 319.452 4.492 20 0 DIADLO Cc1c[nH+]c(CN(Cc2ccccc2)[C@@H](C)c2ccccc2)n1C ZINC000342797687 1038795571 /nfs/dbraw/zinc/79/55/71/1038795571.db2.gz HQYYTEVTTKQGKW-SFHVURJKSA-N 1 2 319.452 4.492 20 0 DIADLO O=C(c1ccc(-n2cc[nH+]c2)cc1)N(CC1CC1)C1CCCCC1 ZINC000075560419 1038805408 /nfs/dbraw/zinc/80/54/08/1038805408.db2.gz SROCGIFPTPYGQC-UHFFFAOYSA-N 1 2 323.440 4.057 20 0 DIADLO COc1cccc(F)c1CNc1cc2cc(F)ccc2c[nH+]1 ZINC001167606581 1038805659 /nfs/dbraw/zinc/80/56/59/1038805659.db2.gz MRDBNKKQZFNEAL-UHFFFAOYSA-N 1 2 300.308 4.134 20 0 DIADLO COCc1nc(C[N@H+](C)Cc2cccc3ccccc32)cs1 ZINC000075639891 1038808029 /nfs/dbraw/zinc/80/80/29/1038808029.db2.gz MJHPRQQRUFVRRP-UHFFFAOYSA-N 1 2 312.438 4.075 20 0 DIADLO COCc1nc(C[N@@H+](C)Cc2cccc3ccccc32)cs1 ZINC000075639891 1038808057 /nfs/dbraw/zinc/80/80/57/1038808057.db2.gz MJHPRQQRUFVRRP-UHFFFAOYSA-N 1 2 312.438 4.075 20 0 DIADLO COCc1nc(C[N@H+](C)[C@H](C)c2cc(C)ccc2C)cs1 ZINC000075674491 1038812823 /nfs/dbraw/zinc/81/28/23/1038812823.db2.gz FJQQGCAWDXLJSR-CQSZACIVSA-N 1 2 304.459 4.099 20 0 DIADLO COCc1nc(C[N@@H+](C)[C@H](C)c2cc(C)ccc2C)cs1 ZINC000075674491 1038812849 /nfs/dbraw/zinc/81/28/49/1038812849.db2.gz FJQQGCAWDXLJSR-CQSZACIVSA-N 1 2 304.459 4.099 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)n1 ZINC000075900503 1038817624 /nfs/dbraw/zinc/81/76/24/1038817624.db2.gz FHPFQCGIKUYCPV-KBXCAEBGSA-N 1 2 301.409 4.186 20 0 DIADLO CC(C)n1ccc(C[N@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)n1 ZINC000075900503 1038817653 /nfs/dbraw/zinc/81/76/53/1038817653.db2.gz FHPFQCGIKUYCPV-KBXCAEBGSA-N 1 2 301.409 4.186 20 0 DIADLO Cc1ccc(-c2nc(C[NH+]3C[C@@H](C)S[C@H](C)C3)cs2)o1 ZINC000075891756 1038818894 /nfs/dbraw/zinc/81/88/94/1038818894.db2.gz RLWACAJGFMHEBS-VXGBXAGGSA-N 1 2 308.472 4.037 20 0 DIADLO COCc1nc(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccc(F)c2)cs1 ZINC000075842847 1038827304 /nfs/dbraw/zinc/82/73/04/1038827304.db2.gz GZSZPTDPMOBKMY-LRDDRELGSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@H+]2C[C@@H](C)C[C@H]2c2cccc(F)c2)cs1 ZINC000075842847 1038827335 /nfs/dbraw/zinc/82/73/35/1038827335.db2.gz GZSZPTDPMOBKMY-LRDDRELGSA-N 1 2 320.433 4.012 20 0 DIADLO Cc1ccc(C)c([C@@H]2C[N@H+](CCC(F)(F)F)[C@H](C)CO2)c1 ZINC000075837069 1038829550 /nfs/dbraw/zinc/82/95/50/1038829550.db2.gz XKDGPTXYPCSUBJ-HIFRSBDPSA-N 1 2 301.352 4.018 20 0 DIADLO Cc1ccc(C)c([C@@H]2C[N@@H+](CCC(F)(F)F)[C@H](C)CO2)c1 ZINC000075837069 1038829576 /nfs/dbraw/zinc/82/95/76/1038829576.db2.gz XKDGPTXYPCSUBJ-HIFRSBDPSA-N 1 2 301.352 4.018 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@@H]2Cc2c(F)cccc2Cl)[nH]c1C ZINC000628144383 1038861027 /nfs/dbraw/zinc/86/10/27/1038861027.db2.gz AGGVUCYDQVOKOS-CYBMUJFWSA-N 1 2 321.827 4.026 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@@H]2Cc2c(F)cccc2Cl)[nH]c1C ZINC000628144383 1038861044 /nfs/dbraw/zinc/86/10/44/1038861044.db2.gz AGGVUCYDQVOKOS-CYBMUJFWSA-N 1 2 321.827 4.026 20 0 DIADLO Cc1[nH]c(CN2CCC[C@@H]2Cc2c(F)cccc2Cl)[nH+]c1C ZINC000628144383 1038861050 /nfs/dbraw/zinc/86/10/50/1038861050.db2.gz AGGVUCYDQVOKOS-CYBMUJFWSA-N 1 2 321.827 4.026 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@@H](C)OC[C@H]2c2ccccc2)cc1 ZINC000608511014 1038871769 /nfs/dbraw/zinc/87/17/69/1038871769.db2.gz LVUDWJCJRPTZRO-BEFAXECRSA-N 1 2 313.466 4.371 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@@H](C)OC[C@H]2c2ccccc2)cc1 ZINC000608511014 1038871786 /nfs/dbraw/zinc/87/17/86/1038871786.db2.gz LVUDWJCJRPTZRO-BEFAXECRSA-N 1 2 313.466 4.371 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1cc(Br)co1 ZINC001232850151 1038903496 /nfs/dbraw/zinc/90/34/96/1038903496.db2.gz JURCEIDNSMOMPS-NSHDSACASA-N 1 2 306.203 4.161 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(Br)co1 ZINC001232850151 1038903511 /nfs/dbraw/zinc/90/35/11/1038903511.db2.gz JURCEIDNSMOMPS-NSHDSACASA-N 1 2 306.203 4.161 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2csc(-c3ccccc3)n2)c1 ZINC000048810840 1038912006 /nfs/dbraw/zinc/91/20/06/1038912006.db2.gz OCXGLLDPETZEFY-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2csc(-c3ccccc3)n2)c1 ZINC000048810840 1038912011 /nfs/dbraw/zinc/91/20/11/1038912011.db2.gz OCXGLLDPETZEFY-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc3ccccc23)C[C@@H](C(F)(F)F)O1 ZINC000608750522 1038912556 /nfs/dbraw/zinc/91/25/56/1038912556.db2.gz RUPUXMNHMNXZNW-HZMBPMFUSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc3ccccc23)C[C@@H](C(F)(F)F)O1 ZINC000608750522 1038912562 /nfs/dbraw/zinc/91/25/62/1038912562.db2.gz RUPUXMNHMNXZNW-HZMBPMFUSA-N 1 2 315.360 4.053 20 0 DIADLO Cc1cccc(Oc2ccc(NC(=O)CCn3cc[nH+]c3)cc2)c1 ZINC000078345728 1038925791 /nfs/dbraw/zinc/92/57/91/1038925791.db2.gz KVGMXPCELOTMIC-UHFFFAOYSA-N 1 2 321.380 4.013 20 0 DIADLO COc1cccc(CNc2[nH+]c3ccccc3n2C2CC2)c1F ZINC000669775188 1038985567 /nfs/dbraw/zinc/98/55/67/1038985567.db2.gz UMRRUCRPTGOXFF-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)Cc2c(C)cccc2C)n1 ZINC000342908798 1038999640 /nfs/dbraw/zinc/99/96/40/1038999640.db2.gz JGUBXZQYLBSXFY-AWEZNQCLSA-N 1 2 319.474 4.133 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)Cc2c(C)cccc2C)n1 ZINC000342908798 1038999656 /nfs/dbraw/zinc/99/96/56/1038999656.db2.gz JGUBXZQYLBSXFY-AWEZNQCLSA-N 1 2 319.474 4.133 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+]Cc2ccc(-c3ccc(CC)cc3)o2)[nH]1 ZINC000534236330 1039011580 /nfs/dbraw/zinc/01/15/80/1039011580.db2.gz SUFNGIHPECRQIA-CYBMUJFWSA-N 1 2 324.428 4.040 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)c(C)c[nH+]1 ZINC000534299881 1039022194 /nfs/dbraw/zinc/02/21/94/1039022194.db2.gz JEHAQUSRSQLXMI-RBUKOAKNSA-N 1 2 316.404 4.016 20 0 DIADLO CC(=O)c1ccnc(Cl)c1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213086227 1039024811 /nfs/dbraw/zinc/02/48/11/1039024811.db2.gz KEEFINCEVXCIHP-UHFFFAOYSA-N 1 2 312.760 4.071 20 0 DIADLO COCc1cnc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccc(F)c2)s1 ZINC000342935220 1039028573 /nfs/dbraw/zinc/02/85/73/1039028573.db2.gz RZALUXHAWODDAW-WBMJQRKESA-N 1 2 320.433 4.012 20 0 DIADLO COCc1cnc(C[N@H+]2C[C@H](C)C[C@H]2c2cccc(F)c2)s1 ZINC000342935220 1039028591 /nfs/dbraw/zinc/02/85/91/1039028591.db2.gz RZALUXHAWODDAW-WBMJQRKESA-N 1 2 320.433 4.012 20 0 DIADLO COCc1cnc(C[N@@H+]2CC[C@@H](C)[C@@H]2c2cccc(F)c2)s1 ZINC000342954941 1039050847 /nfs/dbraw/zinc/05/08/47/1039050847.db2.gz ZOPKUERPPNTUKF-SJKOYZFVSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1cnc(C[N@H+]2CC[C@@H](C)[C@@H]2c2cccc(F)c2)s1 ZINC000342954941 1039050866 /nfs/dbraw/zinc/05/08/66/1039050866.db2.gz ZOPKUERPPNTUKF-SJKOYZFVSA-N 1 2 320.433 4.012 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2nc3ccccc3nc2C)c1 ZINC000444743051 1039076828 /nfs/dbraw/zinc/07/68/28/1039076828.db2.gz XWRIUTKPMCSBLM-UHFFFAOYSA-N 1 2 309.388 4.018 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2nc3ccccc3nc2C)c1 ZINC000444743051 1039076847 /nfs/dbraw/zinc/07/68/47/1039076847.db2.gz XWRIUTKPMCSBLM-UHFFFAOYSA-N 1 2 309.388 4.018 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2Br)cn1 ZINC000153739279 1039108092 /nfs/dbraw/zinc/10/80/92/1039108092.db2.gz VTVQUGURRXAUKP-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)c2ccccc2Br)cn1 ZINC000153739279 1039108096 /nfs/dbraw/zinc/10/80/96/1039108096.db2.gz VTVQUGURRXAUKP-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2ccccc2Br)s1 ZINC000122889620 1039127227 /nfs/dbraw/zinc/12/72/27/1039127227.db2.gz NAXORBSUCGPKBJ-SNVBAGLBSA-N 1 2 311.248 4.065 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+]2CCC[C@H]2c2ccncc2)o1 ZINC000153915639 1039148867 /nfs/dbraw/zinc/14/88/67/1039148867.db2.gz ZFVVYBUKFYKBQP-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+]2CCC[C@H]2c2ccncc2)o1 ZINC000153915639 1039148872 /nfs/dbraw/zinc/14/88/72/1039148872.db2.gz ZFVVYBUKFYKBQP-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1coc(-c2cccs2)n1 ZINC000525638610 1039151128 /nfs/dbraw/zinc/15/11/28/1039151128.db2.gz UGOWDNKVNWGOGS-ZDUSSCGKSA-N 1 2 310.422 4.350 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1coc(-c2cccs2)n1 ZINC000525638610 1039151139 /nfs/dbraw/zinc/15/11/39/1039151139.db2.gz UGOWDNKVNWGOGS-ZDUSSCGKSA-N 1 2 310.422 4.350 20 0 DIADLO COc1cc(C)[nH+]c(CN(C)[C@@H](C)c2cc3ccccc3o2)c1 ZINC000535279256 1039168369 /nfs/dbraw/zinc/16/83/69/1039168369.db2.gz CWFZAQZBWGFFNN-AWEZNQCLSA-N 1 2 310.397 4.338 20 0 DIADLO COc1cc(C)[nH+]c(CN(C)[C@H](C)c2cccc(Cl)c2)c1 ZINC000535279105 1039175777 /nfs/dbraw/zinc/17/57/77/1039175777.db2.gz ASTSCEGWIDUMOD-CYBMUJFWSA-N 1 2 304.821 4.245 20 0 DIADLO Cc1ccc(C[N@H+](C)CN2c3cccc4cccc(c34)C2=O)cc1 ZINC000032506718 1039212336 /nfs/dbraw/zinc/21/23/36/1039212336.db2.gz WTGRWRPEAKKZNN-UHFFFAOYSA-N 1 2 316.404 4.198 20 0 DIADLO Cc1ccc(C[N@@H+](C)CN2c3cccc4cccc(c34)C2=O)cc1 ZINC000032506718 1039212347 /nfs/dbraw/zinc/21/23/47/1039212347.db2.gz WTGRWRPEAKKZNN-UHFFFAOYSA-N 1 2 316.404 4.198 20 0 DIADLO CC[C@@H]([NH2+]Cc1csc(C)n1)c1cc(Cl)ccc1OC ZINC000126551846 1039277608 /nfs/dbraw/zinc/27/76/08/1039277608.db2.gz BIFBSLTYBSZXDK-CQSZACIVSA-N 1 2 310.850 4.354 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1nc(-c2cccs2)no1)c1ccsc1 ZINC000669828928 1039284610 /nfs/dbraw/zinc/28/46/10/1039284610.db2.gz UYIXAFSIXGIMKU-NXEZZACHSA-N 1 2 305.428 4.271 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1nc(-c2cccs2)no1)c1ccsc1 ZINC000669828929 1039284850 /nfs/dbraw/zinc/28/48/50/1039284850.db2.gz UYIXAFSIXGIMKU-UWVGGRQHSA-N 1 2 305.428 4.271 20 0 DIADLO CCCc1nc(C)c(C[N@@H+]2CC[C@@](F)(c3ccccc3F)C2)o1 ZINC000428939215 1039298550 /nfs/dbraw/zinc/29/85/50/1039298550.db2.gz MDQNNVSUCDQBCZ-SFHVURJKSA-N 1 2 320.383 4.145 20 0 DIADLO CCCc1nc(C)c(C[N@H+]2CC[C@@](F)(c3ccccc3F)C2)o1 ZINC000428939215 1039298556 /nfs/dbraw/zinc/29/85/56/1039298556.db2.gz MDQNNVSUCDQBCZ-SFHVURJKSA-N 1 2 320.383 4.145 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1cc2n(n1)CCCC2)c1ccc(F)cc1F ZINC000647289866 1039309569 /nfs/dbraw/zinc/30/95/69/1039309569.db2.gz MKDHLRCAOKQZFU-SJKOYZFVSA-N 1 2 319.399 4.300 20 0 DIADLO CC[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cccc(OC)c1 ZINC000539658020 1039313685 /nfs/dbraw/zinc/31/36/85/1039313685.db2.gz KBKJDXUWKDEYSL-SFHVURJKSA-N 1 2 311.429 4.254 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000525640957 1039319015 /nfs/dbraw/zinc/31/90/15/1039319015.db2.gz LRNKJZDEMKTWBB-CYBMUJFWSA-N 1 2 300.471 4.387 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000525640957 1039319000 /nfs/dbraw/zinc/31/90/00/1039319000.db2.gz LRNKJZDEMKTWBB-CYBMUJFWSA-N 1 2 300.471 4.387 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@@]3(CCOC3)C2)c(Cl)s1 ZINC000449679481 1039344256 /nfs/dbraw/zinc/34/42/56/1039344256.db2.gz HVBPVEGUUPXDTO-CYBMUJFWSA-N 1 2 306.258 4.057 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@@]3(CCOC3)C2)c(Cl)s1 ZINC000449679481 1039344266 /nfs/dbraw/zinc/34/42/66/1039344266.db2.gz HVBPVEGUUPXDTO-CYBMUJFWSA-N 1 2 306.258 4.057 20 0 DIADLO Cc1ccc(-c2cccc(C[N@@H+]3CCC[C@H]3c3ncon3)c2)cc1 ZINC000539816226 1039345867 /nfs/dbraw/zinc/34/58/67/1039345867.db2.gz BDPQWMBCYDAANC-IBGZPJMESA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccc(-c2cccc(C[N@H+]3CCC[C@H]3c3ncon3)c2)cc1 ZINC000539816226 1039345881 /nfs/dbraw/zinc/34/58/81/1039345881.db2.gz BDPQWMBCYDAANC-IBGZPJMESA-N 1 2 319.408 4.382 20 0 DIADLO COc1ccccc1[C@H](C)CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000343272200 1039361391 /nfs/dbraw/zinc/36/13/91/1039361391.db2.gz TVEHOMQAFOZMSM-GFCCVEGCSA-N 1 2 323.396 4.012 20 0 DIADLO CCCOc1ccc(C[N@@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000539849955 1039368064 /nfs/dbraw/zinc/36/80/64/1039368064.db2.gz RXWNKBWKKSPWJC-GOSISDBHSA-N 1 2 317.454 4.110 20 0 DIADLO CCCOc1ccc(C[N@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000539849955 1039368085 /nfs/dbraw/zinc/36/80/85/1039368085.db2.gz RXWNKBWKKSPWJC-GOSISDBHSA-N 1 2 317.454 4.110 20 0 DIADLO CCn1c(C[N@H+](C)Cc2cc3ccccc3o2)nc2ccccc21 ZINC000539851081 1039368279 /nfs/dbraw/zinc/36/82/79/1039368279.db2.gz XZGRDGFEMWZBLN-UHFFFAOYSA-N 1 2 319.408 4.434 20 0 DIADLO CCn1c(C[N@@H+](C)Cc2cc3ccccc3o2)nc2ccccc21 ZINC000539851081 1039368288 /nfs/dbraw/zinc/36/82/88/1039368288.db2.gz XZGRDGFEMWZBLN-UHFFFAOYSA-N 1 2 319.408 4.434 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)cc1F ZINC000539851016 1039375257 /nfs/dbraw/zinc/37/52/57/1039375257.db2.gz WHUDBEGTZFOYPG-SUMWQHHRSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)cc1F ZINC000539851016 1039375272 /nfs/dbraw/zinc/37/52/72/1039375272.db2.gz WHUDBEGTZFOYPG-SUMWQHHRSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)nc1 ZINC000539896744 1039383891 /nfs/dbraw/zinc/38/38/91/1039383891.db2.gz ZCBRQMCEIWDRAK-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)nc1 ZINC000539896744 1039383906 /nfs/dbraw/zinc/38/39/06/1039383906.db2.gz ZCBRQMCEIWDRAK-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1cc(N2CCCO[C@H](c3ccccc3)C2)nc(C2CCC2)[nH+]1 ZINC000892345966 1039401987 /nfs/dbraw/zinc/40/19/87/1039401987.db2.gz PTAISEITQHVRQN-SFHVURJKSA-N 1 2 323.440 4.021 20 0 DIADLO COc1ccc(F)c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1F ZINC001213089849 1039417467 /nfs/dbraw/zinc/41/74/67/1039417467.db2.gz HUPWXJDOLKMIJL-UHFFFAOYSA-N 1 2 301.296 4.107 20 0 DIADLO COC(=O)c1cc(C)c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(C)c1 ZINC001213090168 1039422892 /nfs/dbraw/zinc/42/28/92/1039422892.db2.gz XHFIXXRKIFXNIS-UHFFFAOYSA-N 1 2 321.380 4.224 20 0 DIADLO COc1cc(C[N@H+](C)[C@H](C)c2ccccc2F)c(Cl)cc1O ZINC001205077780 1039427563 /nfs/dbraw/zinc/42/75/63/1039427563.db2.gz SJVRETPBTNOWDV-LLVKDONJSA-N 1 2 323.795 4.386 20 0 DIADLO COc1cc(C[N@@H+](C)[C@H](C)c2ccccc2F)c(Cl)cc1O ZINC001205077780 1039427572 /nfs/dbraw/zinc/42/75/72/1039427572.db2.gz SJVRETPBTNOWDV-LLVKDONJSA-N 1 2 323.795 4.386 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C2CC2)ccc1F)c1cc2n(n1)CCCC2 ZINC000647305354 1039435783 /nfs/dbraw/zinc/43/57/83/1039435783.db2.gz HBJMNXMYJHYRIE-ZDUSSCGKSA-N 1 2 313.420 4.087 20 0 DIADLO Cl/C=C(/Cl)C[NH2+]C1(c2ccc(Br)cc2)CC1 ZINC000309516893 1039438781 /nfs/dbraw/zinc/43/87/81/1039438781.db2.gz RZJCRCJFRGTPQD-YRNVUSSQSA-N 1 2 321.045 4.347 20 0 DIADLO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1csc(C(F)(F)F)c1 ZINC000926530627 1039471116 /nfs/dbraw/zinc/47/11/16/1039471116.db2.gz BPNMLKZZNGNBOD-YWVKMMECSA-N 1 2 315.364 4.320 20 0 DIADLO O=C1CCCc2cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)ccc2N1 ZINC001213090827 1039480444 /nfs/dbraw/zinc/48/04/44/1039480444.db2.gz IEXJQWDDSWHENI-UHFFFAOYSA-N 1 2 318.380 4.095 20 0 DIADLO Cc1nc(-c2ccc([C@H](C)[NH2+]Cc3ncc(C)cn3)cc2)cs1 ZINC000540378665 1039485985 /nfs/dbraw/zinc/48/59/85/1039485985.db2.gz BGNMZDCPZPOGFG-ZDUSSCGKSA-N 1 2 324.453 4.068 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2nnc(C3CC3)o2)C2CCC2)cc1 ZINC000540403218 1039486246 /nfs/dbraw/zinc/48/62/46/1039486246.db2.gz CNJGWMSSBNMMPW-MRXNPFEDSA-N 1 2 317.820 4.231 20 0 DIADLO Cc1cc(C[NH2+][C@H](COCc2ccccc2)c2ccccc2)on1 ZINC000540459887 1039496800 /nfs/dbraw/zinc/49/68/00/1039496800.db2.gz TUWULGMRQPAGPK-HXUWFJFHSA-N 1 2 322.408 4.031 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](c2ccn(C)n2)c2ccc(F)cc2)c(C)c1 ZINC000540475628 1039502509 /nfs/dbraw/zinc/50/25/09/1039502509.db2.gz RSEVANAPZOJQMK-HXUWFJFHSA-N 1 2 323.415 4.055 20 0 DIADLO FC1(F)CC12CC[NH+](Cc1nc(Cl)ccc1Cl)CC2 ZINC000405171708 1039511896 /nfs/dbraw/zinc/51/18/96/1039511896.db2.gz VPVBGCQNRADAKJ-UHFFFAOYSA-N 1 2 307.171 4.010 20 0 DIADLO c1[nH]c(-c2ccccc2)nc1C[NH2+][C@H]1CSc2ccccc21 ZINC000540599329 1039523702 /nfs/dbraw/zinc/52/37/02/1039523702.db2.gz ASUBGOZZQLUBAV-INIZCTEOSA-N 1 2 307.422 4.013 20 0 DIADLO Fc1ccc2c(c1)CC[C@H]2[NH2+]Cc1ncc(C(F)(F)F)s1 ZINC000278562731 1039547374 /nfs/dbraw/zinc/54/73/74/1039547374.db2.gz CQJVIXJJAZEQEB-LLVKDONJSA-N 1 2 316.323 4.078 20 0 DIADLO C[C@@H](Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccc(F)cc1F ZINC000540832596 1039580551 /nfs/dbraw/zinc/58/05/51/1039580551.db2.gz GVJWVZBAZDVAFE-LLVKDONJSA-N 1 2 317.314 4.463 20 0 DIADLO CC(C)C[C@@H]1CCCC[N@@H+]1Cc1ncc(Br)s1 ZINC000541236557 1039644241 /nfs/dbraw/zinc/64/42/41/1039644241.db2.gz QAVTYVDRZAOPGB-NSHDSACASA-N 1 2 317.296 4.306 20 0 DIADLO CC(C)C[C@@H]1CCCC[N@H+]1Cc1ncc(Br)s1 ZINC000541236557 1039644244 /nfs/dbraw/zinc/64/42/44/1039644244.db2.gz QAVTYVDRZAOPGB-NSHDSACASA-N 1 2 317.296 4.306 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)Cc1cccc(O)c1 ZINC000080924823 1039688913 /nfs/dbraw/zinc/68/89/13/1039688913.db2.gz ISKRMSGVKTYDTI-UHFFFAOYSA-N 1 2 314.410 4.049 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)Cc1cccc(O)c1 ZINC000080924823 1039688921 /nfs/dbraw/zinc/68/89/21/1039688921.db2.gz ISKRMSGVKTYDTI-UHFFFAOYSA-N 1 2 314.410 4.049 20 0 DIADLO Brc1ccc([C@H]2CCC[N@@H+]2Cc2ccco2)s1 ZINC000541555284 1039702250 /nfs/dbraw/zinc/70/22/50/1039702250.db2.gz VBJIOZGBOVSOSV-LLVKDONJSA-N 1 2 312.232 4.441 20 0 DIADLO Brc1ccc([C@H]2CCC[N@H+]2Cc2ccco2)s1 ZINC000541555284 1039702268 /nfs/dbraw/zinc/70/22/68/1039702268.db2.gz VBJIOZGBOVSOSV-LLVKDONJSA-N 1 2 312.232 4.441 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+]C[C@@H](C)Cc1ccccc1 ZINC000541588178 1039714832 /nfs/dbraw/zinc/71/48/32/1039714832.db2.gz VEQWVXZNUBGJHB-KRWDZBQOSA-N 1 2 324.468 4.122 20 0 DIADLO Clc1cc(NCc2cnc(C3CC3)o2)ccc1-n1cc[nH+]c1 ZINC000628196164 1039717752 /nfs/dbraw/zinc/71/77/52/1039717752.db2.gz DLANOOWNBZYVCX-UHFFFAOYSA-N 1 2 314.776 4.003 20 0 DIADLO Cc1ccc(-c2nnc(C[N@H+]3C[C@@H](C)[C@@H]3c3ccccc3)o2)cc1 ZINC000081573662 1039720303 /nfs/dbraw/zinc/72/03/03/1039720303.db2.gz QJMAHCSCFXLYDC-DNVCBOLYSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccc(-c2nnc(C[N@@H+]3C[C@@H](C)[C@@H]3c3ccccc3)o2)cc1 ZINC000081573662 1039720314 /nfs/dbraw/zinc/72/03/14/1039720314.db2.gz QJMAHCSCFXLYDC-DNVCBOLYSA-N 1 2 319.408 4.238 20 0 DIADLO CCc1nnc([C@H](C)[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)o1 ZINC000083422612 1039735141 /nfs/dbraw/zinc/73/51/41/1039735141.db2.gz RNVFFQOEGRAYKI-LBPRGKRZSA-N 1 2 317.820 4.136 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)o1 ZINC000083422612 1039735151 /nfs/dbraw/zinc/73/51/51/1039735151.db2.gz RNVFFQOEGRAYKI-LBPRGKRZSA-N 1 2 317.820 4.136 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@@H](Cc1ccccc1)c1ccc(C)c(C)c1 ZINC000084674877 1039747117 /nfs/dbraw/zinc/74/71/17/1039747117.db2.gz SCYHYRDHILSTRK-NRFANRHFSA-N 1 2 319.452 4.409 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@H](C)c2cccc(N3CCCC3)c2)[nH+]1 ZINC000088758905 1039768887 /nfs/dbraw/zinc/76/88/87/1039768887.db2.gz TTWHSNOIOZXUMN-CYBMUJFWSA-N 1 2 321.428 4.040 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(-c2ccncc2)cs1)c1ccccn1 ZINC000090045762 1039789674 /nfs/dbraw/zinc/78/96/74/1039789674.db2.gz FSHJEKYXQLANJL-OLZOCXBDSA-N 1 2 310.426 4.012 20 0 DIADLO CC(C)c1cc(NCc2cn3ccsc3n2)nc(C(C)C)[nH+]1 ZINC000090068750 1039791169 /nfs/dbraw/zinc/79/11/69/1039791169.db2.gz YQXSXUJKIZMAHI-UHFFFAOYSA-N 1 2 315.446 4.045 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2Cl)c(C)n1 ZINC000090180300 1039793173 /nfs/dbraw/zinc/79/31/73/1039793173.db2.gz RMHZJJLCOMZEJG-MWLCHTKSSA-N 1 2 307.800 4.298 20 0 DIADLO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1nc3c(s1)CCCC3)CO2 ZINC000090452314 1039797738 /nfs/dbraw/zinc/79/77/38/1039797738.db2.gz MVXGHHNKJDBXSX-WFASDCNBSA-N 1 2 314.454 4.115 20 0 DIADLO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cc1ncc(Br)s1 ZINC000542156135 1039801749 /nfs/dbraw/zinc/80/17/49/1039801749.db2.gz XKRLGKSOEFFMFW-MNOVXSKESA-N 1 2 317.296 4.306 20 0 DIADLO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1ncc(Br)s1 ZINC000542156135 1039801764 /nfs/dbraw/zinc/80/17/64/1039801764.db2.gz XKRLGKSOEFFMFW-MNOVXSKESA-N 1 2 317.296 4.306 20 0 DIADLO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@@H](C)c1ccc(F)cn1 ZINC000090118352 1039804849 /nfs/dbraw/zinc/80/48/49/1039804849.db2.gz GQQWHJNITGRBDR-STQMWFEESA-N 1 2 312.392 4.002 20 0 DIADLO CCCCCc1ccc([C@@H]([NH2+]Cc2ncn(C)n2)C(C)C)cc1 ZINC000091409862 1039849057 /nfs/dbraw/zinc/84/90/57/1039849057.db2.gz WLQWDGNZJASDOD-IBGZPJMESA-N 1 2 314.477 4.035 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nnc(-c2ccc(C)cc2)o1 ZINC000092224077 1039863393 /nfs/dbraw/zinc/86/33/93/1039863393.db2.gz UQGIVVIIQSGEKV-QGZVFWFLSA-N 1 2 322.412 4.023 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nnc(-c2ccc(C)cc2)o1 ZINC000092224077 1039863405 /nfs/dbraw/zinc/86/34/05/1039863405.db2.gz UQGIVVIIQSGEKV-QGZVFWFLSA-N 1 2 322.412 4.023 20 0 DIADLO CCc1nnc([C@H](C)[N@H+]2CC=C(c3cc(C)cc(C)c3)CC2)o1 ZINC000092428111 1039869999 /nfs/dbraw/zinc/86/99/99/1039869999.db2.gz FLIPPTXDQZWOFW-HNNXBMFYSA-N 1 2 311.429 4.099 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+]2CC=C(c3cc(C)cc(C)c3)CC2)o1 ZINC000092428111 1039870022 /nfs/dbraw/zinc/87/00/22/1039870022.db2.gz FLIPPTXDQZWOFW-HNNXBMFYSA-N 1 2 311.429 4.099 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2cccc(Cl)c2)no1)c1ccsc1 ZINC000669937748 1039870687 /nfs/dbraw/zinc/87/06/87/1039870687.db2.gz QXSHULORQLZJPF-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nnc(-c2cccs2)o1)c1ccsc1 ZINC000669937939 1039875095 /nfs/dbraw/zinc/87/50/95/1039875095.db2.gz YFPOJBJFIQDWMH-ZJUUUORDSA-N 1 2 305.428 4.271 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cn1)c1nc(C(C)(C)C)cs1 ZINC000092747199 1039884149 /nfs/dbraw/zinc/88/41/49/1039884149.db2.gz JCOFYWDAFDOJNW-WDEREUQCSA-N 1 2 307.438 4.387 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ccc(C)c(C)n1)c1ncccc1Cl ZINC000926570686 1039905923 /nfs/dbraw/zinc/90/59/23/1039905923.db2.gz YBNWVGLFKVLALQ-MRXNPFEDSA-N 1 2 303.837 4.378 20 0 DIADLO Cc1cc(C[NH2+]C(C)(C)c2cc(C(F)(F)F)on2)c(C)s1 ZINC000492047093 1039910038 /nfs/dbraw/zinc/91/00/38/1039910038.db2.gz NUHZZPADSQZRIX-UHFFFAOYSA-N 1 2 318.364 4.397 20 0 DIADLO CC(C)[N@H+](Cc1nnc(C2CC2)o1)Cc1cccc(Cl)c1 ZINC000138344286 1039930073 /nfs/dbraw/zinc/93/00/73/1039930073.db2.gz SEZMMQDCEDWCEF-UHFFFAOYSA-N 1 2 305.809 4.011 20 0 DIADLO CC(C)[N@@H+](Cc1nnc(C2CC2)o1)Cc1cccc(Cl)c1 ZINC000138344286 1039930099 /nfs/dbraw/zinc/93/00/99/1039930099.db2.gz SEZMMQDCEDWCEF-UHFFFAOYSA-N 1 2 305.809 4.011 20 0 DIADLO CCCOc1cccc2c(NCc3scnc3C)cc[nH+]c12 ZINC000492212085 1039935972 /nfs/dbraw/zinc/93/59/72/1039935972.db2.gz XVAYJKSMHHHPQY-UHFFFAOYSA-N 1 2 313.426 4.401 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2ccc(C(F)F)nc2)o1 ZINC000657885854 1039996080 /nfs/dbraw/zinc/99/60/80/1039996080.db2.gz CNJGTUOOOWGOLL-ABAIWWIYSA-N 1 2 324.371 4.213 20 0 DIADLO O=C(Nc1cccc(C(F)F)c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000170636003 1040020924 /nfs/dbraw/zinc/02/09/24/1040020924.db2.gz XVLJMXHHCQAVDB-UHFFFAOYSA-N 1 2 313.307 4.062 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1nc2c(s1)CCC2 ZINC000685472876 1040072226 /nfs/dbraw/zinc/07/22/26/1040072226.db2.gz HJSBSGPMJABCCZ-OAHLLOKOSA-N 1 2 316.470 4.224 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1nc2c(s1)CCC2 ZINC000685472876 1040072241 /nfs/dbraw/zinc/07/22/41/1040072241.db2.gz HJSBSGPMJABCCZ-OAHLLOKOSA-N 1 2 316.470 4.224 20 0 DIADLO CCCN(C(=O)/C=C/c1[nH]cc[nH+]1)[C@@H](C)c1cc2ccccc2o1 ZINC000493067419 1040077295 /nfs/dbraw/zinc/07/72/95/1040077295.db2.gz AQBCPKZNSBDFKT-VFNNOXKTSA-N 1 2 323.396 4.169 20 0 DIADLO O=C(C[C@H]1CCC[N@H+]1Cc1cccnc1Cl)c1cccs1 ZINC000176909879 1040101055 /nfs/dbraw/zinc/10/10/55/1040101055.db2.gz RZOVPPFAIRRSBH-CYBMUJFWSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@H]1CCC[N@@H+]1Cc1cccnc1Cl)c1cccs1 ZINC000176909879 1040101061 /nfs/dbraw/zinc/10/10/61/1040101061.db2.gz RZOVPPFAIRRSBH-CYBMUJFWSA-N 1 2 320.845 4.034 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1ccccc1Br ZINC000171944439 1040103411 /nfs/dbraw/zinc/10/34/11/1040103411.db2.gz YKWZRAXVQZBJJY-LBPRGKRZSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccccc1Br ZINC000171944439 1040103418 /nfs/dbraw/zinc/10/34/18/1040103418.db2.gz YKWZRAXVQZBJJY-LBPRGKRZSA-N 1 2 305.219 4.037 20 0 DIADLO Cc1nc(C)c(C[N@@H+](C)[C@H](C)c2ccccc2Br)o1 ZINC000685561791 1040129071 /nfs/dbraw/zinc/12/90/71/1040129071.db2.gz XDCOFWHPRLUNEK-LLVKDONJSA-N 1 2 323.234 4.247 20 0 DIADLO Cc1nc(C)c(C[N@H+](C)[C@H](C)c2ccccc2Br)o1 ZINC000685561791 1040129080 /nfs/dbraw/zinc/12/90/80/1040129080.db2.gz XDCOFWHPRLUNEK-LLVKDONJSA-N 1 2 323.234 4.247 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cc(C(C)(C)C)on1 ZINC000685571945 1040135498 /nfs/dbraw/zinc/13/54/98/1040135498.db2.gz BZZOQMWBDCZSOZ-WDEREUQCSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cc(C(C)(C)C)on1 ZINC000685571945 1040135509 /nfs/dbraw/zinc/13/55/09/1040135509.db2.gz BZZOQMWBDCZSOZ-WDEREUQCSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cn2c(n1)CCCC2)c1ccccc1Cl ZINC000924524189 1040198141 /nfs/dbraw/zinc/19/81/41/1040198141.db2.gz JQOHNSAELLZWPM-OLZOCXBDSA-N 1 2 303.837 4.285 20 0 DIADLO Clc1cc(C[NH2+]Cc2cccc3c2OCO3)c(Cl)s1 ZINC000312594979 1040205910 /nfs/dbraw/zinc/20/59/10/1040205910.db2.gz DFHMLKMMXLCKBE-UHFFFAOYSA-N 1 2 316.209 4.073 20 0 DIADLO CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+][C@@H]1C[C@H](C)n2ncnc21 ZINC000658104124 1040314103 /nfs/dbraw/zinc/31/41/03/1040314103.db2.gz ZUSHNLYVMZDULF-HEHGZKQESA-N 1 2 324.428 4.252 20 0 DIADLO CCSc1ccccc1[C@H](C)[NH2+]Cc1nccc(OC)c1F ZINC000658229033 1040369744 /nfs/dbraw/zinc/36/97/44/1040369744.db2.gz YLQQFTBVCKBTBX-LBPRGKRZSA-N 1 2 320.433 4.192 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H]2CCc3ccc(O)cc32)cs1 ZINC000658237491 1040381756 /nfs/dbraw/zinc/38/17/56/1040381756.db2.gz MQDFXIRLMXYQSC-IAQYHMDHSA-N 1 2 302.443 4.310 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c21)c1nccn1C ZINC000658336184 1040428310 /nfs/dbraw/zinc/42/83/10/1040428310.db2.gz OTUHXQIJFOZCGU-TVQRCGJNSA-N 1 2 310.228 4.065 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)/C=C/c3ccsc3)c2)[nH+]c1C ZINC000749582848 1040459002 /nfs/dbraw/zinc/45/90/02/1040459002.db2.gz NSGYWIYBHHMVEX-VOTSOKGWSA-N 1 2 323.421 4.407 20 0 DIADLO COc1cccc(/C(C)=C\C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000255755460 1040462476 /nfs/dbraw/zinc/46/24/76/1040462476.db2.gz LAAAVUOQCRLEGQ-BENRWUELSA-N 1 2 310.397 4.057 20 0 DIADLO Cc1cc(NC(=O)c2ccc(-c3ccsc3)nc2C)cc[nH+]1 ZINC000101947982 1040467477 /nfs/dbraw/zinc/46/74/77/1040467477.db2.gz YWZIHMRZCHXABF-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1cc(C(C)(C)C)on1)C(C)C ZINC000278784250 1040516056 /nfs/dbraw/zinc/51/60/56/1040516056.db2.gz ZRBWOXSMQLMLOQ-MRXNPFEDSA-N 1 2 301.434 4.162 20 0 DIADLO NC(=[NH+]OCc1csc(C2CCCCC2)n1)c1ccccc1 ZINC000065947483 1040619481 /nfs/dbraw/zinc/61/94/81/1040619481.db2.gz DABNMRZONBRCSX-UHFFFAOYSA-N 1 2 315.442 4.028 20 0 DIADLO Clc1ccc(-c2nc(C[NH2+]Cc3ccco3)cs2)cc1 ZINC000612912996 1040734334 /nfs/dbraw/zinc/73/43/34/1040734334.db2.gz IEPBCGGYCBPDKJ-UHFFFAOYSA-N 1 2 304.802 4.346 20 0 DIADLO Clc1ccc(C[N@@H+]2CCCc3ccccc3C2)c(Cl)n1 ZINC000236055682 1040758128 /nfs/dbraw/zinc/75/81/28/1040758128.db2.gz ODRQQAKEBLDXIB-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO Clc1ccc(C[N@H+]2CCCc3ccccc3C2)c(Cl)n1 ZINC000236055682 1040758143 /nfs/dbraw/zinc/75/81/43/1040758143.db2.gz ODRQQAKEBLDXIB-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO Cc1cn[nH]c1C[N@H+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000685838911 1040778214 /nfs/dbraw/zinc/77/82/14/1040778214.db2.gz MFEPIXPBBXKJKS-UHFFFAOYSA-N 1 2 321.346 4.026 20 0 DIADLO Cc1cn[nH]c1C[N@@H+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000685838911 1040778221 /nfs/dbraw/zinc/77/82/21/1040778221.db2.gz MFEPIXPBBXKJKS-UHFFFAOYSA-N 1 2 321.346 4.026 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@@H](C)c2ccn(C)n2)c2ccccc2)cc1 ZINC000414060652 1040804597 /nfs/dbraw/zinc/80/45/97/1040804597.db2.gz YBMBNSNXUZDBFN-OXJNMPFZSA-N 1 2 305.425 4.169 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c21)c1ccn(C)n1 ZINC000414188465 1040970216 /nfs/dbraw/zinc/97/02/16/1040970216.db2.gz QSLQZOMVGYSZQL-LKFCYVNXSA-N 1 2 310.228 4.065 20 0 DIADLO CCn1ccc(C[NH2+][C@@H](c2ccccc2)c2ccc(C)cc2)n1 ZINC000414216337 1041013242 /nfs/dbraw/zinc/01/32/42/1041013242.db2.gz ZQBAVAIMQDVGQA-FQEVSTJZSA-N 1 2 305.425 4.091 20 0 DIADLO O[C@H](c1ccccc1)[C@@H]([NH2+]C/C(Cl)=C/Cl)c1ccccc1 ZINC000808789400 1041027871 /nfs/dbraw/zinc/02/78/71/1041027871.db2.gz PORJMFTZQJDUNA-CZAONCGOSA-N 1 2 322.235 4.370 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@]23CCCc2ccccc23)c(C)[nH+]1 ZINC000175102240 1041032218 /nfs/dbraw/zinc/03/22/18/1041032218.db2.gz XNYAOQCQVHCUKB-RXVVDRJESA-N 1 2 320.436 4.240 20 0 DIADLO CC(C)c1ccc([C@@H](C)[NH2+]Cc2nccc(C(F)(F)F)n2)cc1 ZINC000414236682 1041037245 /nfs/dbraw/zinc/03/72/45/1041037245.db2.gz IHIFXLDTODHDLI-GFCCVEGCSA-N 1 2 323.362 4.470 20 0 DIADLO C[C@@H]1CC[C@@H]([NH2+]Cc2nccc(C(F)(F)F)n2)c2ccccc21 ZINC000414238212 1041041022 /nfs/dbraw/zinc/04/10/22/1041041022.db2.gz JVPQSFMLIQBTHI-BXUZGUMPSA-N 1 2 321.346 4.224 20 0 DIADLO Nc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000647513903 1041058644 /nfs/dbraw/zinc/05/86/44/1041058644.db2.gz QEPKQRDUWWBCPA-OAHLLOKOSA-N 1 2 322.239 4.138 20 0 DIADLO Nc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000647513903 1041058660 /nfs/dbraw/zinc/05/86/60/1041058660.db2.gz QEPKQRDUWWBCPA-OAHLLOKOSA-N 1 2 322.239 4.138 20 0 DIADLO COc1ccc([C@@H](C)CC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000175726986 1041095383 /nfs/dbraw/zinc/09/53/83/1041095383.db2.gz DZYMJHRRZFBIPS-LBPRGKRZSA-N 1 2 312.413 4.148 20 0 DIADLO Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]Cc1nnc(C(C)C)s1 ZINC000892608181 1041107126 /nfs/dbraw/zinc/10/71/26/1041107126.db2.gz NLPNISWHYJQYTF-CYBMUJFWSA-N 1 2 319.474 4.366 20 0 DIADLO Cc1ccc(C[NH2+]Cc2csc(C(F)(F)F)n2)c(C)c1 ZINC000892615293 1041129407 /nfs/dbraw/zinc/12/94/07/1041129407.db2.gz AHLMLYAFTPXBCG-UHFFFAOYSA-N 1 2 300.349 4.069 20 0 DIADLO CCSc1ccccc1[C@H](C)[NH2+]Cc1nnc(C2CC2)s1 ZINC000414329530 1041136569 /nfs/dbraw/zinc/13/65/69/1041136569.db2.gz QTGPLKPBWBISLR-NSHDSACASA-N 1 2 319.499 4.378 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@](C)(F)C2)c(C(F)(F)F)c1 ZINC001143472679 1041161923 /nfs/dbraw/zinc/16/19/23/1041161923.db2.gz DMYJODNCQIAICE-AWEZNQCLSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@](C)(F)C2)c(C(F)(F)F)c1 ZINC001143472679 1041161928 /nfs/dbraw/zinc/16/19/28/1041161928.db2.gz DMYJODNCQIAICE-AWEZNQCLSA-N 1 2 305.315 4.038 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2csc(C(F)(F)F)n2)cc1 ZINC000892632997 1041166760 /nfs/dbraw/zinc/16/67/60/1041166760.db2.gz XVHTYTJDQOXOBU-SNVBAGLBSA-N 1 2 300.349 4.321 20 0 DIADLO CCc1ncc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)cn1 ZINC000414366913 1041181966 /nfs/dbraw/zinc/18/19/66/1041181966.db2.gz CXJYSKPLWFBOQU-UHFFFAOYSA-N 1 2 321.424 4.143 20 0 DIADLO CCc1ncc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)cn1 ZINC000414366913 1041181977 /nfs/dbraw/zinc/18/19/77/1041181977.db2.gz CXJYSKPLWFBOQU-UHFFFAOYSA-N 1 2 321.424 4.143 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC(F)(F)[C@@H](C)C1 ZINC000685921718 1041184019 /nfs/dbraw/zinc/18/40/19/1041184019.db2.gz OJVQNEDMYXQOBP-LBPRGKRZSA-N 1 2 306.356 4.033 20 0 DIADLO Clc1nc(C[N@@H+]2CC[C@H](CSc3ccccc3)C2)cs1 ZINC000809574229 1041186577 /nfs/dbraw/zinc/18/65/77/1041186577.db2.gz HGCMPKKMUDKYHH-LBPRGKRZSA-N 1 2 324.902 4.411 20 0 DIADLO Clc1nc(C[N@H+]2CC[C@H](CSc3ccccc3)C2)cs1 ZINC000809574229 1041186580 /nfs/dbraw/zinc/18/65/80/1041186580.db2.gz HGCMPKKMUDKYHH-LBPRGKRZSA-N 1 2 324.902 4.411 20 0 DIADLO Cc1cccn2cc(C[S@](=O)c3ccc(C(C)C)cc3)[nH+]c12 ZINC000176639385 1041192691 /nfs/dbraw/zinc/19/26/91/1041192691.db2.gz ZUZHBNJHQBHPDY-QFIPXVFZSA-N 1 2 312.438 4.074 20 0 DIADLO COc1cccc2c(NCc3nccc4ccccc43)cc[nH+]c12 ZINC001167702752 1041204864 /nfs/dbraw/zinc/20/48/64/1041204864.db2.gz HMCZLYVDUFUPHZ-UHFFFAOYSA-N 1 2 315.376 4.404 20 0 DIADLO Fc1cccc2c1SCC[C@@H]2Nc1ccc2c(c1)CC[NH2+]2 ZINC000423220560 1041208188 /nfs/dbraw/zinc/20/81/88/1041208188.db2.gz VPWTUUZJDPYDFM-INIZCTEOSA-N 1 2 300.402 4.443 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000176896309 1041218430 /nfs/dbraw/zinc/21/84/30/1041218430.db2.gz PKGQBXBOGZICHT-CQSZACIVSA-N 1 2 303.475 4.116 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000176896309 1041218453 /nfs/dbraw/zinc/21/84/53/1041218453.db2.gz PKGQBXBOGZICHT-CQSZACIVSA-N 1 2 303.475 4.116 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1occc1Br ZINC000809764227 1041251615 /nfs/dbraw/zinc/25/16/15/1041251615.db2.gz CPAUNXVMZZMJMH-CYBMUJFWSA-N 1 2 309.207 4.020 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1occc1Br ZINC000809764227 1041251627 /nfs/dbraw/zinc/25/16/27/1041251627.db2.gz CPAUNXVMZZMJMH-CYBMUJFWSA-N 1 2 309.207 4.020 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)s1 ZINC000177380015 1041260820 /nfs/dbraw/zinc/26/08/20/1041260820.db2.gz RKFGKHUETKDARF-SFHVURJKSA-N 1 2 312.413 4.470 20 0 DIADLO C[C@@H]1CCCN(c2cc[nH+]c3c(Br)cccc23)C1 ZINC000588158999 1041285548 /nfs/dbraw/zinc/28/55/48/1041285548.db2.gz KZVIMVAPUKLDAC-LLVKDONJSA-N 1 2 305.219 4.234 20 0 DIADLO Cl/C=C(/Cl)C[N@H+]1CC[C@H](Oc2ccc(Cl)cc2)C1 ZINC001170594939 1041299228 /nfs/dbraw/zinc/29/92/28/1041299228.db2.gz ZGRMENSAQSCEBQ-HJTPGIPUSA-N 1 2 306.620 4.112 20 0 DIADLO Cl/C=C(/Cl)C[N@@H+]1CC[C@H](Oc2ccc(Cl)cc2)C1 ZINC001170594939 1041299216 /nfs/dbraw/zinc/29/92/16/1041299216.db2.gz ZGRMENSAQSCEBQ-HJTPGIPUSA-N 1 2 306.620 4.112 20 0 DIADLO C[C@@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1cnn(C2CCC2)c1 ZINC000926810639 1041311911 /nfs/dbraw/zinc/31/19/11/1041311911.db2.gz UNEJWOKCCNSMEV-PXAZEXFGSA-N 1 2 305.372 4.109 20 0 DIADLO CCCCCC[C@@H](CC)[N@@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001170600060 1041331416 /nfs/dbraw/zinc/33/14/16/1041331416.db2.gz QRURDTRRJXPHAA-HZPDHXFCSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCCC[C@@H](CC)[N@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001170600060 1041331425 /nfs/dbraw/zinc/33/14/25/1041331425.db2.gz QRURDTRRJXPHAA-HZPDHXFCSA-N 1 2 307.482 4.155 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nnc(C(F)(F)F)s1)c1ccccc1 ZINC000659824455 1041381104 /nfs/dbraw/zinc/38/11/04/1041381104.db2.gz CFNJCEQQGBPVKD-GFCCVEGCSA-N 1 2 315.364 4.044 20 0 DIADLO Cc1[nH]c2ccc(C[NH2+]Cc3nnc(C(C)C)s3)cc2c1C ZINC000892731202 1041388990 /nfs/dbraw/zinc/38/89/90/1041388990.db2.gz LIPJRYWOPQGVFH-UHFFFAOYSA-N 1 2 314.458 4.049 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCCO2)c1ccc(-n2cc[nH+]c2)cc1 ZINC000183071478 1041390015 /nfs/dbraw/zinc/39/00/15/1041390015.db2.gz PLGAKFNGRMTCAN-OAHLLOKOSA-N 1 2 319.408 4.370 20 0 DIADLO C[C@@H]([NH2+]Cc1nccn1C1CC1)c1cc(Cl)ccc1Cl ZINC000892734498 1041391932 /nfs/dbraw/zinc/39/19/32/1041391932.db2.gz ZWBJCAQNXRJJDK-SNVBAGLBSA-N 1 2 310.228 4.376 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2csc(C(F)(F)F)n2)cc1 ZINC000892743898 1041393931 /nfs/dbraw/zinc/39/39/31/1041393931.db2.gz VJKPYHJUWHMBSW-VIFPVBQESA-N 1 2 316.348 4.021 20 0 DIADLO Cc1c2ccccc2oc1C[NH2+]Cc1nnc(C(C)C)s1 ZINC000892955951 1041439506 /nfs/dbraw/zinc/43/95/06/1041439506.db2.gz CBVJGMRVHAMQDM-UHFFFAOYSA-N 1 2 301.415 4.006 20 0 DIADLO COc1ccc2ccc(NC[C@H](C)c3c(C)noc3C)[nH+]c2c1 ZINC000892953417 1041439656 /nfs/dbraw/zinc/43/96/56/1041439656.db2.gz XHSRQTFDZMKXLD-NSHDSACASA-N 1 2 311.385 4.064 20 0 DIADLO CC[C@@H](CC(F)F)C[N@@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000659849749 1041445384 /nfs/dbraw/zinc/44/53/84/1041445384.db2.gz JOGARSIFZUFUIM-WCQYABFASA-N 1 2 313.392 4.155 20 0 DIADLO CC[C@@H](CC(F)F)C[N@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000659849749 1041445390 /nfs/dbraw/zinc/44/53/90/1041445390.db2.gz JOGARSIFZUFUIM-WCQYABFASA-N 1 2 313.392 4.155 20 0 DIADLO CC[N@H+](Cc1nc(C)oc1C)Cc1cccc(Br)c1 ZINC000659857967 1041462802 /nfs/dbraw/zinc/46/28/02/1041462802.db2.gz RLMVACADZHUGBQ-UHFFFAOYSA-N 1 2 323.234 4.076 20 0 DIADLO CC[N@@H+](Cc1nc(C)oc1C)Cc1cccc(Br)c1 ZINC000659857967 1041462805 /nfs/dbraw/zinc/46/28/05/1041462805.db2.gz RLMVACADZHUGBQ-UHFFFAOYSA-N 1 2 323.234 4.076 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)[nH]c1C ZINC000565242764 1041468129 /nfs/dbraw/zinc/46/81/29/1041468129.db2.gz SBBHQGDPZUHILR-INIZCTEOSA-N 1 2 307.388 4.182 20 0 DIADLO Cc1[nH]c(CN[C@@H](c2ccc(F)cc2F)C(C)(C)C)[nH+]c1C ZINC000565242764 1041468134 /nfs/dbraw/zinc/46/81/34/1041468134.db2.gz SBBHQGDPZUHILR-INIZCTEOSA-N 1 2 307.388 4.182 20 0 DIADLO CC(C)(C)[C@H]([NH2+]Cc1nccn1C1CC1)c1ccc(F)cc1F ZINC000893111731 1041490787 /nfs/dbraw/zinc/49/07/87/1041490787.db2.gz BPYCOBRHCLRJCE-QGZVFWFLSA-N 1 2 319.399 4.373 20 0 DIADLO Cc1cc(N2C[C@H](C)C[C@H]2c2cccnc2)nc(C2CCC2)[nH+]1 ZINC000893155390 1041507396 /nfs/dbraw/zinc/50/73/96/1041507396.db2.gz HSESGVQDNNTBKQ-DYVFJYSZSA-N 1 2 308.429 4.035 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2c(F)c(F)cc(F)c2F)cs1 ZINC000651268146 1041515293 /nfs/dbraw/zinc/51/52/93/1041515293.db2.gz MKAQPMXKZQFLAB-MRVPVSSYSA-N 1 2 303.324 4.464 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+]C(C)(C)c2cccc(C)c2)n1 ZINC000179584286 1041515601 /nfs/dbraw/zinc/51/56/01/1041515601.db2.gz WJCXLWCYNAMKIB-ZDUSSCGKSA-N 1 2 319.474 4.217 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2cc3cc(C)c(C)cc3o2)[nH]1 ZINC000271460822 1041517489 /nfs/dbraw/zinc/51/74/89/1041517489.db2.gz HGNPJLOFZLPVCR-STQMWFEESA-N 1 2 312.417 4.142 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)Cc1cscc1C(F)(F)F ZINC000811456226 1041519640 /nfs/dbraw/zinc/51/96/40/1041519640.db2.gz ILMCIKGOEHWWCR-UHFFFAOYSA-N 1 2 304.337 4.004 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)Cc1cscc1C(F)(F)F ZINC000811456226 1041519643 /nfs/dbraw/zinc/51/96/43/1041519643.db2.gz ILMCIKGOEHWWCR-UHFFFAOYSA-N 1 2 304.337 4.004 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccnc(Cl)c1Cl ZINC000811498564 1041525747 /nfs/dbraw/zinc/52/57/47/1041525747.db2.gz YRIUKDXKQPJLIC-APPZFPTMSA-N 1 2 313.150 4.161 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccnc(Cl)c1Cl ZINC000811498564 1041525751 /nfs/dbraw/zinc/52/57/51/1041525751.db2.gz YRIUKDXKQPJLIC-APPZFPTMSA-N 1 2 313.150 4.161 20 0 DIADLO Cc1nc(C[N@@H+]2Cc3ccccc3C[C@H]2c2ccccc2)co1 ZINC000659962219 1041561899 /nfs/dbraw/zinc/56/18/99/1041561899.db2.gz URXVCAPQGUHIPE-FQEVSTJZSA-N 1 2 304.393 4.283 20 0 DIADLO Cc1nc(C[N@H+]2Cc3ccccc3C[C@H]2c2ccccc2)co1 ZINC000659962219 1041561909 /nfs/dbraw/zinc/56/19/09/1041561909.db2.gz URXVCAPQGUHIPE-FQEVSTJZSA-N 1 2 304.393 4.283 20 0 DIADLO COc1ccc(C[NH2+][C@H](CC(F)(F)F)c2ccc(F)cc2)o1 ZINC000893230249 1041568860 /nfs/dbraw/zinc/56/88/60/1041568860.db2.gz NDQRDQAJQQORNP-CYBMUJFWSA-N 1 2 317.282 4.211 20 0 DIADLO CCCC1(c2noc(-c3cccc(Cn4cc[nH+]c4)c3)n2)CCC1 ZINC000643135521 1041583708 /nfs/dbraw/zinc/58/37/08/1041583708.db2.gz BAWBKOAKJJHWSX-UHFFFAOYSA-N 1 2 322.412 4.203 20 0 DIADLO CC(C)=C[C@H]1[C@H](C(=O)Nc2ccccc2-n2cc[nH+]c2)C1(C)C ZINC000613709507 1041585879 /nfs/dbraw/zinc/58/58/79/1041585879.db2.gz BESGCRMUJAPHGU-WMLDXEAASA-N 1 2 309.413 4.049 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cccc(C(C)C)c3)CCCCC2)no1 ZINC000660036096 1041588572 /nfs/dbraw/zinc/58/85/72/1041588572.db2.gz IUMABKQAHKHOIA-UHFFFAOYSA-N 1 2 313.445 4.451 20 0 DIADLO CCOc1ccc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)o1 ZINC000893258975 1041591070 /nfs/dbraw/zinc/59/10/70/1041591070.db2.gz AFTPTBLTELGCTR-UHFFFAOYSA-N 1 2 307.340 4.126 20 0 DIADLO CCc1nocc1C[N@@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000660101587 1041613696 /nfs/dbraw/zinc/61/36/96/1041613696.db2.gz NLIRXYZVDADVDR-MRXNPFEDSA-N 1 2 311.385 4.105 20 0 DIADLO CCc1nocc1C[N@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000660101587 1041613701 /nfs/dbraw/zinc/61/37/01/1041613701.db2.gz NLIRXYZVDADVDR-MRXNPFEDSA-N 1 2 311.385 4.105 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)c2cc(Cl)ccc2C)c1C ZINC001170681183 1041634161 /nfs/dbraw/zinc/63/41/61/1041634161.db2.gz LSSVLLWQADHXHE-UHFFFAOYSA-N 1 2 304.821 4.305 20 0 DIADLO Nc1ccc(Nc2cc[nH+]c3cc(Cl)ccc23)cc1[N+](=O)[O-] ZINC000196388835 1041635114 /nfs/dbraw/zinc/63/51/14/1041635114.db2.gz FMIOGBDGLUYNJU-UHFFFAOYSA-N 1 2 314.732 4.122 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@H+]1Cc1cc(C2CC2)no1 ZINC000660163400 1041639719 /nfs/dbraw/zinc/63/97/19/1041639719.db2.gz GUMUTYYPWWTYNV-NWDGAFQWSA-N 1 2 300.377 4.199 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@@H+]1Cc1cc(C2CC2)no1 ZINC000660163400 1041639727 /nfs/dbraw/zinc/63/97/27/1041639727.db2.gz GUMUTYYPWWTYNV-NWDGAFQWSA-N 1 2 300.377 4.199 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1Cc1cc(C2CC2)no1 ZINC000660163402 1041640445 /nfs/dbraw/zinc/64/04/45/1041640445.db2.gz GUMUTYYPWWTYNV-VXGBXAGGSA-N 1 2 300.377 4.199 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1Cc1cc(C2CC2)no1 ZINC000660163402 1041640449 /nfs/dbraw/zinc/64/04/49/1041640449.db2.gz GUMUTYYPWWTYNV-VXGBXAGGSA-N 1 2 300.377 4.199 20 0 DIADLO Cc1cccc([C@H](C)[NH2+]Cc2nnc(C(F)(F)F)s2)c1C ZINC000660197609 1041661786 /nfs/dbraw/zinc/66/17/86/1041661786.db2.gz RONOTZTYBQIJJM-JTQLQIEISA-N 1 2 315.364 4.025 20 0 DIADLO COc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nc(C)oc1C ZINC000660200012 1041663048 /nfs/dbraw/zinc/66/30/48/1041663048.db2.gz GGANBWCJMAIWTR-MRXNPFEDSA-N 1 2 302.418 4.177 20 0 DIADLO COc1cccc(C[NH2+][C@@H](C)c2c(F)cccc2OC)c1Cl ZINC000660200164 1041664042 /nfs/dbraw/zinc/66/40/42/1041664042.db2.gz PJIPRPUARWAYFF-NSHDSACASA-N 1 2 323.795 4.347 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccc(OCC3CC3)c(F)c2)c(C)o1 ZINC000660201152 1041665409 /nfs/dbraw/zinc/66/54/09/1041665409.db2.gz UIDSBADEDZVYQF-LLVKDONJSA-N 1 2 318.392 4.070 20 0 DIADLO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H](C)C(F)(F)c1ccccc1 ZINC000925603677 1041670077 /nfs/dbraw/zinc/67/00/77/1041670077.db2.gz CRCCKKDRJVSTSX-FZMZJTMJSA-N 1 2 308.372 4.165 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)[nH]1 ZINC000660238192 1041683687 /nfs/dbraw/zinc/68/36/87/1041683687.db2.gz HYJMDWYLHBBDAW-ZUZCIYMTSA-N 1 2 324.831 4.208 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2nsc3ccccc23)C2CC2)s1 ZINC000660254062 1041692217 /nfs/dbraw/zinc/69/22/17/1041692217.db2.gz PRASKDPRNOMEHF-HNNXBMFYSA-N 1 2 315.467 4.302 20 0 DIADLO COc1cccc(C[NH2+]C2(c3nc(C)cs3)CCC2)c1Cl ZINC000660262491 1041696413 /nfs/dbraw/zinc/69/64/13/1041696413.db2.gz ICPVORHVWGVKSS-UHFFFAOYSA-N 1 2 322.861 4.283 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cccc(F)c2OC(F)F)s1 ZINC000660269160 1041697970 /nfs/dbraw/zinc/69/79/70/1041697970.db2.gz LTDRHYSSGSKTMJ-SECBINFHSA-N 1 2 316.348 4.043 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ccco2)Cc2cccs2)cn1 ZINC000189282648 1041700712 /nfs/dbraw/zinc/70/07/12/1041700712.db2.gz OMGDYCBCANAOFH-UHFFFAOYSA-N 1 2 302.374 4.078 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ccco2)Cc2cccs2)cn1 ZINC000189282648 1041700721 /nfs/dbraw/zinc/70/07/21/1041700721.db2.gz OMGDYCBCANAOFH-UHFFFAOYSA-N 1 2 302.374 4.078 20 0 DIADLO COc1cc(C[NH2+]C(c2ccccc2C)c2ccccc2C)on1 ZINC000660280453 1041702259 /nfs/dbraw/zinc/70/22/59/1041702259.db2.gz QNSQPBOLAZOSLT-UHFFFAOYSA-N 1 2 322.408 4.179 20 0 DIADLO C[C@H](c1nc(C(C)(C)c2ccc3ccccc3c2)no1)[NH+](C)C ZINC000924146243 1041717040 /nfs/dbraw/zinc/71/70/40/1041717040.db2.gz ZZLPNIKJZBWUBU-CYBMUJFWSA-N 1 2 309.413 4.171 20 0 DIADLO CC[C@H](CC(F)F)C[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000660331777 1041719034 /nfs/dbraw/zinc/71/90/34/1041719034.db2.gz XRGLFPFUZCGZPM-ABAIWWIYSA-N 1 2 319.342 4.020 20 0 DIADLO CC[C@H](CC(F)F)C[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000660331777 1041719038 /nfs/dbraw/zinc/71/90/38/1041719038.db2.gz XRGLFPFUZCGZPM-ABAIWWIYSA-N 1 2 319.342 4.020 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCC1(F)F)c1cccc(Br)c1 ZINC000397955189 1041740886 /nfs/dbraw/zinc/74/08/86/1041740886.db2.gz MPNJWRCTZDZINH-SKDRFNHKSA-N 1 2 304.178 4.288 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](c2ccccc2)[C@@H](O)c2ccccc2)no1 ZINC000813876737 1041741660 /nfs/dbraw/zinc/74/16/60/1041741660.db2.gz ZHYAZEQHAGJXLR-YSGRDPCXSA-N 1 2 322.408 4.109 20 0 DIADLO C[C@@H]1CCC[C@H]([N@H+](C)Cn2nc(-c3ccccc3)[nH]c2=S)C1 ZINC000025484844 1041752743 /nfs/dbraw/zinc/75/27/43/1041752743.db2.gz XXTGBNQVAWSGIW-HIFRSBDPSA-N 1 2 316.474 4.076 20 0 DIADLO C[C@@H]1CCC[C@H]([N@@H+](C)Cn2nc(-c3ccccc3)[nH]c2=S)C1 ZINC000025484844 1041752747 /nfs/dbraw/zinc/75/27/47/1041752747.db2.gz XXTGBNQVAWSGIW-HIFRSBDPSA-N 1 2 316.474 4.076 20 0 DIADLO Cc1cccc2ncc(C[NH2+][C@H](c3ccco3)c3ccccc3)n21 ZINC000364388972 1041771623 /nfs/dbraw/zinc/77/16/23/1041771623.db2.gz SORKXBZJPNFUFQ-FQEVSTJZSA-N 1 2 317.392 4.115 20 0 DIADLO C[C@H](Nc1ccn2cc(N)[nH+]c2c1)c1ccccc1C(F)(F)F ZINC001170737451 1041805259 /nfs/dbraw/zinc/80/52/59/1041805259.db2.gz KZXTUMVDINIFMA-JTQLQIEISA-N 1 2 320.318 4.108 20 0 DIADLO Cc1ccccc1-n1cnn(C[N@@H+](C)[C@H](C)C(C)(C)C)c1=S ZINC000026630238 1041842310 /nfs/dbraw/zinc/84/23/10/1041842310.db2.gz QUBNZXFPIUXNRI-CQSZACIVSA-N 1 2 318.490 4.036 20 0 DIADLO Cc1ccccc1-n1cnn(C[N@H+](C)[C@H](C)C(C)(C)C)c1=S ZINC000026630238 1041842312 /nfs/dbraw/zinc/84/23/12/1041842312.db2.gz QUBNZXFPIUXNRI-CQSZACIVSA-N 1 2 318.490 4.036 20 0 DIADLO Cc1cncc(C[N@@H+](C)[C@H](C)c2nc3cc(Cl)ccc3[nH]2)c1 ZINC000660708014 1041855592 /nfs/dbraw/zinc/85/55/92/1041855592.db2.gz LFTFWLTYNQOUAC-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1cncc(C[N@H+](C)[C@H](C)c2nc3cc(Cl)ccc3[nH]2)c1 ZINC000660708014 1041855596 /nfs/dbraw/zinc/85/55/96/1041855596.db2.gz LFTFWLTYNQOUAC-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO C[C@@H](C[N@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1)C1CCCCC1 ZINC000660767892 1041860984 /nfs/dbraw/zinc/86/09/84/1041860984.db2.gz OQHIFVHWHGXBHS-MAUKXSAKSA-N 1 2 312.461 4.042 20 0 DIADLO C[C@@H](C[N@@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1)C1CCCCC1 ZINC000660767892 1041860987 /nfs/dbraw/zinc/86/09/87/1041860987.db2.gz OQHIFVHWHGXBHS-MAUKXSAKSA-N 1 2 312.461 4.042 20 0 DIADLO C[C@@H]1c2cc(F)cc(F)c2CC[N@H+]1Cc1cc2cnccc2o1 ZINC000651650337 1041865590 /nfs/dbraw/zinc/86/55/90/1041865590.db2.gz KJRSHKPIBVODSW-LLVKDONJSA-N 1 2 314.335 4.225 20 0 DIADLO C[C@@H]1c2cc(F)cc(F)c2CC[N@@H+]1Cc1cc2cnccc2o1 ZINC000651650337 1041865595 /nfs/dbraw/zinc/86/55/95/1041865595.db2.gz KJRSHKPIBVODSW-LLVKDONJSA-N 1 2 314.335 4.225 20 0 DIADLO c1sc(COc2ccccc2)nc1C[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660932017 1041872508 /nfs/dbraw/zinc/87/25/08/1041872508.db2.gz WKNKJDXKIPYLGW-YOEHRIQHSA-N 1 2 314.454 4.097 20 0 DIADLO c1sc(COc2ccccc2)nc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660932017 1041872510 /nfs/dbraw/zinc/87/25/10/1041872510.db2.gz WKNKJDXKIPYLGW-YOEHRIQHSA-N 1 2 314.454 4.097 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[NH+]1CCC(c2ccco2)CC1 ZINC000661161767 1041897683 /nfs/dbraw/zinc/89/76/83/1041897683.db2.gz XWVYZSLXWRFOLL-CQSZACIVSA-N 1 2 323.396 4.270 20 0 DIADLO C[C@@H]([NH2+][C@@H](CCO)c1ccco1)c1ccc(-c2ccccc2)cn1 ZINC000651764157 1041906898 /nfs/dbraw/zinc/90/68/98/1041906898.db2.gz HOOCYGMJBJLOKO-BEFAXECRSA-N 1 2 322.408 4.116 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccnc(Br)c2)[C@@H]1c1ccccc1 ZINC000815058065 1041907312 /nfs/dbraw/zinc/90/73/12/1041907312.db2.gz MESJDZQHFROTTQ-LRDDRELGSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccnc(Br)c2)[C@@H]1c1ccccc1 ZINC000815058065 1041907316 /nfs/dbraw/zinc/90/73/16/1041907316.db2.gz MESJDZQHFROTTQ-LRDDRELGSA-N 1 2 317.230 4.037 20 0 DIADLO CC(C)(C)c1ncc(C[NH2+]Cc2c(F)cc(F)cc2F)s1 ZINC000815151764 1041919708 /nfs/dbraw/zinc/91/97/08/1041919708.db2.gz CHYAAOUNUCLLLP-UHFFFAOYSA-N 1 2 314.376 4.148 20 0 DIADLO Fc1cc(Cl)cc(C[NH2+]Cc2c(F)cc(F)cc2F)c1 ZINC000815152589 1041921294 /nfs/dbraw/zinc/92/12/94/1041921294.db2.gz RMQHPPBTOFMKAW-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO CC(C)Oc1ccc(C[NH2+][C@H](C)c2cscn2)cc1Cl ZINC000661419345 1041934744 /nfs/dbraw/zinc/93/47/44/1041934744.db2.gz OQPGKHSUJVSHAW-LLVKDONJSA-N 1 2 310.850 4.435 20 0 DIADLO CCOc1ccc(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccco2)nc1 ZINC000661444966 1041938104 /nfs/dbraw/zinc/93/81/04/1041938104.db2.gz CZZUJFPECQKGOF-GOSISDBHSA-N 1 2 312.413 4.191 20 0 DIADLO CCOc1ccc(C[N@H+]2CC3(CCCC3)[C@H]2c2ccco2)nc1 ZINC000661444966 1041938108 /nfs/dbraw/zinc/93/81/08/1041938108.db2.gz CZZUJFPECQKGOF-GOSISDBHSA-N 1 2 312.413 4.191 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccccc1F ZINC000661484554 1041944058 /nfs/dbraw/zinc/94/40/58/1041944058.db2.gz LVBTYIPFGHTHGS-OAHLLOKOSA-N 1 2 305.422 4.042 20 0 DIADLO CC(C)c1cc(NCc2ccc3c(c2)CCO3)nc(C(C)C)[nH+]1 ZINC001167781023 1041961675 /nfs/dbraw/zinc/96/16/75/1041961675.db2.gz BLTUCDNAXRCJAX-UHFFFAOYSA-N 1 2 311.429 4.270 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC[C@@H](C(C)(C)C)CC2)c(C)[nH+]1 ZINC001126115471 1041963386 /nfs/dbraw/zinc/96/33/86/1041963386.db2.gz VKBDNFXBYOQHJD-MRXNPFEDSA-N 1 2 302.462 4.295 20 0 DIADLO COC(=O)CCC[C@@H]1CCC[C@@H](Nc2ccc([NH+](C)C)cc2)C1 ZINC000815610898 1041974194 /nfs/dbraw/zinc/97/41/94/1041974194.db2.gz XYYIWIMYUQHQKL-DOTOQJQBSA-N 1 2 318.461 4.067 20 0 DIADLO COC(=O)CCC[C@@H]1CCC[C@@H]([NH2+]c2ccc(N(C)C)cc2)C1 ZINC000815610898 1041974197 /nfs/dbraw/zinc/97/41/97/1041974197.db2.gz XYYIWIMYUQHQKL-DOTOQJQBSA-N 1 2 318.461 4.067 20 0 DIADLO COc1ccsc1[C@@H](C)[NH2+]Cc1c(F)cc(F)cc1F ZINC000815650026 1041984023 /nfs/dbraw/zinc/98/40/23/1041984023.db2.gz GFCMQGWLMRMCPU-MRVPVSSYSA-N 1 2 301.333 4.025 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccnc(Cl)c1 ZINC000815649790 1041985516 /nfs/dbraw/zinc/98/55/16/1041985516.db2.gz ZELNCUJIQIHNFM-MRVPVSSYSA-N 1 2 300.711 4.003 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2C[C@H](C)Sc3sccc32)c1 ZINC000652330612 1042010022 /nfs/dbraw/zinc/01/00/22/1042010022.db2.gz KYMLWUJFROVNIV-GWCFXTLKSA-N 1 2 306.456 4.327 20 0 DIADLO C[C@@H]1COCC[C@H]1Nc1[nH+]ccc2cccc(C(F)(F)F)c21 ZINC001170820966 1042042463 /nfs/dbraw/zinc/04/24/63/1042042463.db2.gz QFMXXHUUONSZKW-ZWNOBZJWSA-N 1 2 310.319 4.091 20 0 DIADLO CC[N@H+](Cc1cc(C)n(C)n1)Cc1ccc(Cl)c(Cl)c1 ZINC000487371809 1042043018 /nfs/dbraw/zinc/04/30/18/1042043018.db2.gz YGUDCWCWYCKAIO-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO CC[N@@H+](Cc1cc(C)n(C)n1)Cc1ccc(Cl)c(Cl)c1 ZINC000487371809 1042043023 /nfs/dbraw/zinc/04/30/23/1042043023.db2.gz YGUDCWCWYCKAIO-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO COCc1nc(C[N@@H+]2CCCC[C@H]2c2ccc(C)cc2)cs1 ZINC000075767200 1042047656 /nfs/dbraw/zinc/04/76/56/1042047656.db2.gz WPUDPKIGCYCNDR-KRWDZBQOSA-N 1 2 316.470 4.325 20 0 DIADLO COCc1nc(C[N@H+]2CCCC[C@H]2c2ccc(C)cc2)cs1 ZINC000075767200 1042047665 /nfs/dbraw/zinc/04/76/65/1042047665.db2.gz WPUDPKIGCYCNDR-KRWDZBQOSA-N 1 2 316.470 4.325 20 0 DIADLO C[C@@H]1COCC[C@H]1Nc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1 ZINC001170823736 1042051508 /nfs/dbraw/zinc/05/15/08/1042051508.db2.gz GNZDTTYBPIQQNN-CZUORRHYSA-N 1 2 307.397 4.067 20 0 DIADLO CCC[N@H+](Cc1cnn(C)c1Cl)[C@H](C)c1ccccc1OC ZINC000816488531 1042056964 /nfs/dbraw/zinc/05/69/64/1042056964.db2.gz XDSWMGUBCBFSJM-CYBMUJFWSA-N 1 2 321.852 4.055 20 0 DIADLO CCC[N@@H+](Cc1cnn(C)c1Cl)[C@H](C)c1ccccc1OC ZINC000816488531 1042056970 /nfs/dbraw/zinc/05/69/70/1042056970.db2.gz XDSWMGUBCBFSJM-CYBMUJFWSA-N 1 2 321.852 4.055 20 0 DIADLO Cc1ccc(NC(=O)c2c[nH+]ccc2Nc2ccccc2)cc1C ZINC001135588209 1042058266 /nfs/dbraw/zinc/05/82/66/1042058266.db2.gz QUTSSIPOHURXIF-UHFFFAOYSA-N 1 2 317.392 4.116 20 0 DIADLO CC(C)(C)Oc1ccc(C[NH2+]Cc2c(F)ccc(O)c2F)cc1 ZINC000816542074 1042063513 /nfs/dbraw/zinc/06/35/13/1042063513.db2.gz CBWPPRMZKXVLQS-UHFFFAOYSA-N 1 2 321.367 4.138 20 0 DIADLO Cc1cc([NH2+][C@@H]2CC=C(C)CC2)ccc1N1CCSCC1 ZINC000816526026 1042066625 /nfs/dbraw/zinc/06/66/25/1042066625.db2.gz QQLXMZVJNJOJLX-MRXNPFEDSA-N 1 2 302.487 4.459 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000816630588 1042070247 /nfs/dbraw/zinc/07/02/47/1042070247.db2.gz KECINWNSRLWZSK-INIZCTEOSA-N 1 2 315.848 4.109 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000816630588 1042070249 /nfs/dbraw/zinc/07/02/49/1042070249.db2.gz KECINWNSRLWZSK-INIZCTEOSA-N 1 2 315.848 4.109 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2)[C@H](C)Cc2ccccc2)no1 ZINC000662154519 1042073455 /nfs/dbraw/zinc/07/34/55/1042073455.db2.gz JQQUGIDCVMCBIW-MRXNPFEDSA-N 1 2 321.424 4.011 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2)[C@H](C)Cc2ccccc2)no1 ZINC000662154519 1042073463 /nfs/dbraw/zinc/07/34/63/1042073463.db2.gz JQQUGIDCVMCBIW-MRXNPFEDSA-N 1 2 321.424 4.011 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(C(F)F)cc2)C[C@H](CC(F)(F)F)O1 ZINC000662238966 1042096409 /nfs/dbraw/zinc/09/64/09/1042096409.db2.gz XEZWYVMHAGZCSW-MFKMUULPSA-N 1 2 323.305 4.166 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(C(F)F)cc2)C[C@H](CC(F)(F)F)O1 ZINC000662238966 1042096417 /nfs/dbraw/zinc/09/64/17/1042096417.db2.gz XEZWYVMHAGZCSW-MFKMUULPSA-N 1 2 323.305 4.166 20 0 DIADLO Cc1nnc(C[N@@H+](C)Cc2c(C)c(C)c(C)c(C)c2C)s1 ZINC000662260713 1042100505 /nfs/dbraw/zinc/10/05/05/1042100505.db2.gz PJLZJGKOXZQXLM-UHFFFAOYSA-N 1 2 303.475 4.021 20 0 DIADLO Cc1nnc(C[N@H+](C)Cc2c(C)c(C)c(C)c(C)c2C)s1 ZINC000662260713 1042100509 /nfs/dbraw/zinc/10/05/09/1042100509.db2.gz PJLZJGKOXZQXLM-UHFFFAOYSA-N 1 2 303.475 4.021 20 0 DIADLO C[C@H]([NH2+]Cc1nn(C)cc1Cl)c1csc2ccccc21 ZINC000817276170 1042101009 /nfs/dbraw/zinc/10/10/09/1042101009.db2.gz UBTSLBNNLMAZSF-JTQLQIEISA-N 1 2 305.834 4.139 20 0 DIADLO Cc1cc(Cl)cc(Cl)c1CNc1ccn2cc(N)[nH+]c2c1 ZINC001167795188 1042101642 /nfs/dbraw/zinc/10/16/42/1042101642.db2.gz ATVTULXKMUMBSF-UHFFFAOYSA-N 1 2 321.211 4.144 20 0 DIADLO CC(C)n1ccn(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)c1=S ZINC000817366407 1042105906 /nfs/dbraw/zinc/10/59/06/1042105906.db2.gz WLYGTEZPTXMJGE-LBPRGKRZSA-N 1 2 321.412 4.222 20 0 DIADLO CC(C)n1ccn(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c1=S ZINC000817366407 1042105910 /nfs/dbraw/zinc/10/59/10/1042105910.db2.gz WLYGTEZPTXMJGE-LBPRGKRZSA-N 1 2 321.412 4.222 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@@H](C)c2cc(F)c(F)c(F)c2)n1 ZINC000162347033 1042124638 /nfs/dbraw/zinc/12/46/38/1042124638.db2.gz UIIAGCZPLHDSQU-IUCAKERBSA-N 1 2 300.349 4.281 20 0 DIADLO CCOc1ccc(NCc2c[nH+]cn2C(C)C)c2ncccc12 ZINC000818203783 1042143031 /nfs/dbraw/zinc/14/30/31/1042143031.db2.gz LDYZFBIBKHAQBC-UHFFFAOYSA-N 1 2 310.401 4.023 20 0 DIADLO COc1c(Cl)cc(NCc2c[nH+]cn2C(C)C)cc1Cl ZINC000818195940 1042143749 /nfs/dbraw/zinc/14/37/49/1042143749.db2.gz FEXQKVOSTJBQSU-UHFFFAOYSA-N 1 2 314.216 4.392 20 0 DIADLO C[N@H+](Cn1sc2ccccc2c1=O)[C@@H]1CCCc2ccccc21 ZINC000818260155 1042144689 /nfs/dbraw/zinc/14/46/89/1042144689.db2.gz VKQQVDVOSJPNLW-QGZVFWFLSA-N 1 2 324.449 4.030 20 0 DIADLO C[N@@H+](Cn1sc2ccccc2c1=O)[C@@H]1CCCc2ccccc21 ZINC000818260155 1042144696 /nfs/dbraw/zinc/14/46/96/1042144696.db2.gz VKQQVDVOSJPNLW-QGZVFWFLSA-N 1 2 324.449 4.030 20 0 DIADLO Clc1ccccc1-c1ccc(C[N@@H+]2CCO[C@H]3C[C@H]32)s1 ZINC000644837590 1042145810 /nfs/dbraw/zinc/14/58/10/1042145810.db2.gz KWTYRBHOROUDAI-CABCVRRESA-N 1 2 305.830 4.042 20 0 DIADLO Clc1ccccc1-c1ccc(C[N@H+]2CCO[C@H]3C[C@H]32)s1 ZINC000644837590 1042145813 /nfs/dbraw/zinc/14/58/13/1042145813.db2.gz KWTYRBHOROUDAI-CABCVRRESA-N 1 2 305.830 4.042 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)/C(F)=C/C1CCCCC1 ZINC001136134786 1042147508 /nfs/dbraw/zinc/14/75/08/1042147508.db2.gz BZKHVTFZKKAUNO-ATVHPVEESA-N 1 2 313.376 4.245 20 0 DIADLO Cc1cc(C)c(CNc2ccc(C(F)F)cc2[N+](=O)[O-])c[nH+]1 ZINC000397032290 1042165152 /nfs/dbraw/zinc/16/51/52/1042165152.db2.gz YEQGNQYPQYKNHV-UHFFFAOYSA-N 1 2 307.300 4.156 20 0 DIADLO C[C@@H](c1nc2ccccc2n1C(F)F)[N@@H+]1CC[C@H](C(F)F)C1 ZINC000663463832 1042176745 /nfs/dbraw/zinc/17/67/45/1042176745.db2.gz KQXLOVPBBMOQRJ-UWVGGRQHSA-N 1 2 315.314 4.079 20 0 DIADLO C[C@@H](c1nc2ccccc2n1C(F)F)[N@H+]1CC[C@H](C(F)F)C1 ZINC000663463832 1042176749 /nfs/dbraw/zinc/17/67/49/1042176749.db2.gz KQXLOVPBBMOQRJ-UWVGGRQHSA-N 1 2 315.314 4.079 20 0 DIADLO COc1cc(OC)cc([C@H](C)Nc2ccc(-n3cccc3)c[nH+]2)c1 ZINC001170930929 1042189270 /nfs/dbraw/zinc/18/92/70/1042189270.db2.gz VHJGEACHDHCENE-AWEZNQCLSA-N 1 2 323.396 4.063 20 0 DIADLO C=Cn1cc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)cn1 ZINC000278917690 1042211652 /nfs/dbraw/zinc/21/16/52/1042211652.db2.gz UJWOZOUISXISKT-UHFFFAOYSA-N 1 2 308.212 4.069 20 0 DIADLO COC(=O)[C@H]1CC[C@H](Nc2cc(-c3ccc(C)cc3)cc[nH+]2)CC1 ZINC001167827812 1042220613 /nfs/dbraw/zinc/22/06/13/1042220613.db2.gz KRQRVPGZEPTHHC-SAABIXHNSA-N 1 2 324.424 4.201 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2ccccc2OC(F)(F)F)n1 ZINC000080274330 1042243123 /nfs/dbraw/zinc/24/31/23/1042243123.db2.gz XUTUXPKGGAROGN-SNVBAGLBSA-N 1 2 316.348 4.201 20 0 DIADLO CCOc1ccccc1[C@@H](C)Nc1ccc(N2CCCC2)[nH+]c1 ZINC000319766695 1042248855 /nfs/dbraw/zinc/24/88/55/1042248855.db2.gz WSVIKZDLLMPOEG-OAHLLOKOSA-N 1 2 311.429 4.254 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1sccc1C(F)F ZINC001136459303 1042255178 /nfs/dbraw/zinc/25/51/78/1042255178.db2.gz PJMKZCVFVBMBHV-UHFFFAOYSA-N 1 2 319.336 4.328 20 0 DIADLO Cc1nccc(C[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)n1 ZINC000038037735 1042268261 /nfs/dbraw/zinc/26/82/61/1042268261.db2.gz DNZJMVYJBRKJBE-QMMMGPOBSA-N 1 2 314.191 4.082 20 0 DIADLO Cc1[nH+]cc(CNc2ccc(Cl)nc2C)n1-c1ccccc1 ZINC000318461159 1042273830 /nfs/dbraw/zinc/27/38/30/1042273830.db2.gz DARLUKHHCQPYLF-UHFFFAOYSA-N 1 2 312.804 4.150 20 0 DIADLO C[C@@H]1C[N@H+](CC[C@H]2CC2(Cl)Cl)C[C@H](c2ccsc2)O1 ZINC000822686090 1042297977 /nfs/dbraw/zinc/29/79/77/1042297977.db2.gz OCNCMXAOYLRVHS-KGYLQXTDSA-N 1 2 320.285 4.094 20 0 DIADLO C[C@@H]1C[N@@H+](CC[C@H]2CC2(Cl)Cl)C[C@H](c2ccsc2)O1 ZINC000822686090 1042297981 /nfs/dbraw/zinc/29/79/81/1042297981.db2.gz OCNCMXAOYLRVHS-KGYLQXTDSA-N 1 2 320.285 4.094 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)sc1C ZINC001136624686 1042299596 /nfs/dbraw/zinc/29/95/96/1042299596.db2.gz FUCKVLHFUFKDPN-UHFFFAOYSA-N 1 2 311.410 4.111 20 0 DIADLO Cc1cc(NC(=O)c2ccsc2Cl)ccc1-n1cc[nH+]c1 ZINC001136625312 1042300819 /nfs/dbraw/zinc/30/08/19/1042300819.db2.gz FQKXVFACUUNJCV-UHFFFAOYSA-N 1 2 317.801 4.148 20 0 DIADLO CCCCC[C@@H]([NH2+]Cc1nc(C(F)F)no1)c1ccccc1 ZINC000822818092 1042302008 /nfs/dbraw/zinc/30/20/08/1042302008.db2.gz JPUPJIISZCTIEO-CYBMUJFWSA-N 1 2 309.360 4.418 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893686283 1042305095 /nfs/dbraw/zinc/30/50/95/1042305095.db2.gz XKXLOPHEKIDKKL-GHMZBOCLSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893686283 1042305099 /nfs/dbraw/zinc/30/50/99/1042305099.db2.gz XKXLOPHEKIDKKL-GHMZBOCLSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893686286 1042305509 /nfs/dbraw/zinc/30/55/09/1042305509.db2.gz XKXLOPHEKIDKKL-WDEREUQCSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893686286 1042305511 /nfs/dbraw/zinc/30/55/11/1042305511.db2.gz XKXLOPHEKIDKKL-WDEREUQCSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H](c1nc(-c2ccccc2)no1)[N@H+](C)Cc1cccc(F)c1 ZINC000096966314 1042314070 /nfs/dbraw/zinc/31/40/70/1042314070.db2.gz JHISRCWMRLLNGE-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1nc(-c2ccccc2)no1)[N@@H+](C)Cc1cccc(F)c1 ZINC000096966314 1042314076 /nfs/dbraw/zinc/31/40/76/1042314076.db2.gz JHISRCWMRLLNGE-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2Cc2ccccc2)cc[nH+]1 ZINC000010163253 1042321020 /nfs/dbraw/zinc/32/10/20/1042321020.db2.gz PBSQPYCKIWMMOB-UHFFFAOYSA-N 1 2 302.377 4.233 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@@H+]1Cc1cc(F)ncc1F ZINC000823436665 1042325321 /nfs/dbraw/zinc/32/53/21/1042325321.db2.gz BOKYMPOTNKALDJ-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1cc(F)ncc1F ZINC000823436665 1042325326 /nfs/dbraw/zinc/32/53/26/1042325326.db2.gz BOKYMPOTNKALDJ-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO CC(C)n1ncnc1C[NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000279662601 1042329677 /nfs/dbraw/zinc/32/96/77/1042329677.db2.gz DBMMJMPXDCALOA-MRXNPFEDSA-N 1 2 322.403 4.014 20 0 DIADLO CC(C)n1ncnc1C[NH2+][C@H](c1ccccc1F)C1CCCC1 ZINC000279794247 1042344149 /nfs/dbraw/zinc/34/41/49/1042344149.db2.gz VYVZZHLWZICGKL-SFHVURJKSA-N 1 2 316.424 4.019 20 0 DIADLO Clc1nc2ccccc2cc1C[N@@H+]1CCOc2ccccc2C1 ZINC000108090530 1042351124 /nfs/dbraw/zinc/35/11/24/1042351124.db2.gz HFISAGMMAGLEPL-UHFFFAOYSA-N 1 2 324.811 4.283 20 0 DIADLO Clc1nc2ccccc2cc1C[N@H+]1CCOc2ccccc2C1 ZINC000108090530 1042351126 /nfs/dbraw/zinc/35/11/26/1042351126.db2.gz HFISAGMMAGLEPL-UHFFFAOYSA-N 1 2 324.811 4.283 20 0 DIADLO Cc1ccc(Br)c(Nc2cc(C3CC3)c[nH+]c2C)n1 ZINC001213491246 1042366981 /nfs/dbraw/zinc/36/69/81/1042366981.db2.gz DSPINXNMLMPJQF-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1cncc(COc2ccc(-c3[nH+]cc4n3CCCC4)cc2)c1 ZINC000419011382 1042371528 /nfs/dbraw/zinc/37/15/28/1042371528.db2.gz RXTMDOKRYAZWHX-UHFFFAOYSA-N 1 2 319.408 4.169 20 0 DIADLO CC[N@@H+](Cc1csc(C2CCCCC2)n1)C[C@H]1CCCO1 ZINC000051555028 1042377896 /nfs/dbraw/zinc/37/78/96/1042377896.db2.gz ZJMAXTLERQNGIF-MRXNPFEDSA-N 1 2 308.491 4.192 20 0 DIADLO CC[N@H+](Cc1csc(C2CCCCC2)n1)C[C@H]1CCCO1 ZINC000051555028 1042377900 /nfs/dbraw/zinc/37/79/00/1042377900.db2.gz ZJMAXTLERQNGIF-MRXNPFEDSA-N 1 2 308.491 4.192 20 0 DIADLO Cc1ccccc1C[N@H+](C)Cc1cscc1Br ZINC000709880438 1042383844 /nfs/dbraw/zinc/38/38/44/1042383844.db2.gz HOLIAUYDVHSZBM-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO Cc1ccccc1C[N@@H+](C)Cc1cscc1Br ZINC000709880438 1042383850 /nfs/dbraw/zinc/38/38/50/1042383850.db2.gz HOLIAUYDVHSZBM-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO Cc1noc2ncc(C[N@@H+](C)[C@@H](C)c3cc(F)ccc3F)cc12 ZINC000893931985 1042396493 /nfs/dbraw/zinc/39/64/93/1042396493.db2.gz NOKHPCXBJQXLBP-NSHDSACASA-N 1 2 317.339 4.002 20 0 DIADLO Cc1noc2ncc(C[N@H+](C)[C@@H](C)c3cc(F)ccc3F)cc12 ZINC000893931985 1042396494 /nfs/dbraw/zinc/39/64/94/1042396494.db2.gz NOKHPCXBJQXLBP-NSHDSACASA-N 1 2 317.339 4.002 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2csc(C(C)(C)C)n2)cc1 ZINC000048060849 1042397773 /nfs/dbraw/zinc/39/77/73/1042397773.db2.gz PTGZCONEXWMTLO-UHFFFAOYSA-N 1 2 304.459 4.081 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2csc(C(C)(C)C)n2)cc1 ZINC000048060849 1042397777 /nfs/dbraw/zinc/39/77/77/1042397777.db2.gz PTGZCONEXWMTLO-UHFFFAOYSA-N 1 2 304.459 4.081 20 0 DIADLO COc1cccc(C(F)(F)F)c1Nc1[nH+]c2ccccc2n1C ZINC001213339543 1042403650 /nfs/dbraw/zinc/40/36/50/1042403650.db2.gz OQJPJZWFPAXJSH-UHFFFAOYSA-N 1 2 321.302 4.344 20 0 DIADLO Cc1noc2ncc(C[N@@H+]3CC[C@@H]3c3ccc(Cl)cc3)cc12 ZINC000894059721 1042405703 /nfs/dbraw/zinc/40/57/03/1042405703.db2.gz SQWYKCIUHKWQCH-MRXNPFEDSA-N 1 2 313.788 4.132 20 0 DIADLO Cc1noc2ncc(C[N@H+]3CC[C@@H]3c3ccc(Cl)cc3)cc12 ZINC000894059721 1042405706 /nfs/dbraw/zinc/40/57/06/1042405706.db2.gz SQWYKCIUHKWQCH-MRXNPFEDSA-N 1 2 313.788 4.132 20 0 DIADLO Cc1[nH]ncc1[C@H](C)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000246005837 1042407741 /nfs/dbraw/zinc/40/77/41/1042407741.db2.gz SKFDTHSCAOSZHQ-CABCVRRESA-N 1 2 312.461 4.266 20 0 DIADLO Cc1[nH]ncc1[C@H](C)Nc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000246005837 1042407743 /nfs/dbraw/zinc/40/77/43/1042407743.db2.gz SKFDTHSCAOSZHQ-CABCVRRESA-N 1 2 312.461 4.266 20 0 DIADLO c1ccc2c(c1)ccnc2CNc1ccc([NH+]2CCCC2)cc1 ZINC000894101591 1042418243 /nfs/dbraw/zinc/41/82/43/1042418243.db2.gz SANDMXNTNFCJFB-UHFFFAOYSA-N 1 2 303.409 4.447 20 0 DIADLO CCOc1cc(F)c(F)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001211797166 1042453564 /nfs/dbraw/zinc/45/35/64/1042453564.db2.gz WAMJGRHJHCXHLV-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO COc1cc(F)c(Nc2ccc[nH+]c2N2CCCC2)cc1Cl ZINC001214058415 1042455864 /nfs/dbraw/zinc/45/58/64/1042455864.db2.gz UFJDOXVAERVVOH-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO CCc1ccc(C[N@@H+]2CCC[C@@H]2c2nc3cc(C)ccc3[nH]2)nc1 ZINC000411734989 1042460560 /nfs/dbraw/zinc/46/05/60/1042460560.db2.gz VBEJUYHZVSBIBY-LJQANCHMSA-N 1 2 320.440 4.166 20 0 DIADLO CCc1ccc(C[N@H+]2CCC[C@@H]2c2nc3cc(C)ccc3[nH]2)nc1 ZINC000411734989 1042460564 /nfs/dbraw/zinc/46/05/64/1042460564.db2.gz VBEJUYHZVSBIBY-LJQANCHMSA-N 1 2 320.440 4.166 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+][C@H]1CCCc2scnc21 ZINC000623866870 1042480966 /nfs/dbraw/zinc/48/09/66/1042480966.db2.gz IPWLFDAGSZVAOB-MFKMUULPSA-N 1 2 306.406 4.019 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(F)cc(Br)c2)CCC1(F)F ZINC000571366990 1042482675 /nfs/dbraw/zinc/48/26/75/1042482675.db2.gz ZJIFRKFOQJJMLQ-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(F)cc(Br)c2)CCC1(F)F ZINC000571366990 1042482679 /nfs/dbraw/zinc/48/26/79/1042482679.db2.gz ZJIFRKFOQJJMLQ-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO CCc1nc(C)c(C[NH2+][C@H](C)c2ccccc2Br)o1 ZINC000291813636 1042487633 /nfs/dbraw/zinc/48/76/33/1042487633.db2.gz CWUZAKMLFPGBOE-SNVBAGLBSA-N 1 2 323.234 4.159 20 0 DIADLO O=C(C[N@@H+]1CCC[C@H]1c1ccsc1)Nc1ccccc1Cl ZINC000052803121 1042517878 /nfs/dbraw/zinc/51/78/78/1042517878.db2.gz BTPLORQMZREEAV-HNNXBMFYSA-N 1 2 320.845 4.177 20 0 DIADLO O=C(C[N@H+]1CCC[C@H]1c1ccsc1)Nc1ccccc1Cl ZINC000052803121 1042517882 /nfs/dbraw/zinc/51/78/82/1042517882.db2.gz BTPLORQMZREEAV-HNNXBMFYSA-N 1 2 320.845 4.177 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1C ZINC000513391437 1042537842 /nfs/dbraw/zinc/53/78/42/1042537842.db2.gz BWYAMMNMYAQLTF-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1C ZINC000513391437 1042537847 /nfs/dbraw/zinc/53/78/47/1042537847.db2.gz BWYAMMNMYAQLTF-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO CCCn1c(C[N@H+](C)Cc2ccc(C)s2)nc2ccccc21 ZINC000513429498 1042540218 /nfs/dbraw/zinc/54/02/18/1042540218.db2.gz GSKRUWYBQQVVCD-UHFFFAOYSA-N 1 2 313.470 4.448 20 0 DIADLO CCCn1c(C[N@@H+](C)Cc2ccc(C)s2)nc2ccccc21 ZINC000513429498 1042540221 /nfs/dbraw/zinc/54/02/21/1042540221.db2.gz GSKRUWYBQQVVCD-UHFFFAOYSA-N 1 2 313.470 4.448 20 0 DIADLO Cc1sc2[nH]c([C@H](C)[N@@H+]3CCC(C)=C(C)C3)nc(=O)c2c1C ZINC000280671263 1042577918 /nfs/dbraw/zinc/57/79/18/1042577918.db2.gz FXGZGOYTTKPNKA-LBPRGKRZSA-N 1 2 317.458 4.117 20 0 DIADLO Cc1sc2[nH]c([C@H](C)[N@H+]3CCC(C)=C(C)C3)nc(=O)c2c1C ZINC000280671263 1042577919 /nfs/dbraw/zinc/57/79/19/1042577919.db2.gz FXGZGOYTTKPNKA-LBPRGKRZSA-N 1 2 317.458 4.117 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420939599 1042617112 /nfs/dbraw/zinc/61/71/12/1042617112.db2.gz BVCUYLLGQHBQEP-QWRGUYRKSA-N 1 2 319.371 4.093 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420939599 1042617115 /nfs/dbraw/zinc/61/71/15/1042617115.db2.gz BVCUYLLGQHBQEP-QWRGUYRKSA-N 1 2 319.371 4.093 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+]2CCC[C@H](CC(F)(F)F)C2)n1 ZINC000420956425 1042618095 /nfs/dbraw/zinc/61/80/95/1042618095.db2.gz YEQWPJDNDJFURZ-VXGBXAGGSA-N 1 2 319.371 4.138 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+]2CCC[C@H](CC(F)(F)F)C2)n1 ZINC000420956425 1042618097 /nfs/dbraw/zinc/61/80/97/1042618097.db2.gz YEQWPJDNDJFURZ-VXGBXAGGSA-N 1 2 319.371 4.138 20 0 DIADLO CC(C)Cc1noc(C[N@H+](C(C)C)[C@H](C)c2ccsc2)n1 ZINC000421005458 1042620670 /nfs/dbraw/zinc/62/06/70/1042620670.db2.gz JIFRCYNYPXJNHP-CYBMUJFWSA-N 1 2 307.463 4.301 20 0 DIADLO CC(C)Cc1noc(C[N@@H+](C(C)C)[C@H](C)c2ccsc2)n1 ZINC000421005458 1042620674 /nfs/dbraw/zinc/62/06/74/1042620674.db2.gz JIFRCYNYPXJNHP-CYBMUJFWSA-N 1 2 307.463 4.301 20 0 DIADLO CC(C)[N@H+](Cc1nnc2n1CCCCC2)[C@@H](C)c1ccsc1 ZINC000421004114 1042620801 /nfs/dbraw/zinc/62/08/01/1042620801.db2.gz HTKWBVQIZZBWAU-AWEZNQCLSA-N 1 2 318.490 4.038 20 0 DIADLO CC(C)[N@@H+](Cc1nnc2n1CCCCC2)[C@@H](C)c1ccsc1 ZINC000421004114 1042620805 /nfs/dbraw/zinc/62/08/05/1042620805.db2.gz HTKWBVQIZZBWAU-AWEZNQCLSA-N 1 2 318.490 4.038 20 0 DIADLO CCO[C@H](C)c1noc(C[N@H+](C(C)C)[C@@H](C)c2ccsc2)n1 ZINC000421004881 1042620966 /nfs/dbraw/zinc/62/09/66/1042620966.db2.gz ITJNAJYDWCNFNB-QWHCGFSZSA-N 1 2 323.462 4.200 20 0 DIADLO CCO[C@H](C)c1noc(C[N@@H+](C(C)C)[C@@H](C)c2ccsc2)n1 ZINC000421004881 1042620969 /nfs/dbraw/zinc/62/09/69/1042620969.db2.gz ITJNAJYDWCNFNB-QWHCGFSZSA-N 1 2 323.462 4.200 20 0 DIADLO CC[C@@H]1C[C@@H](C)C[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000072698382 1042641890 /nfs/dbraw/zinc/64/18/90/1042641890.db2.gz YJLFWDZFTREGAK-GHMZBOCLSA-N 1 2 315.244 4.052 20 0 DIADLO CC[C@@H]1C[C@@H](C)C[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000072698382 1042641893 /nfs/dbraw/zinc/64/18/93/1042641893.db2.gz YJLFWDZFTREGAK-GHMZBOCLSA-N 1 2 315.244 4.052 20 0 DIADLO Cc1cc(CNC(=O)C[C@H](c2ccccc2)C(C)C)cc(C)[nH+]1 ZINC000421574882 1042644548 /nfs/dbraw/zinc/64/45/48/1042644548.db2.gz HZVHXSRDBSBFNF-IBGZPJMESA-N 1 2 310.441 4.145 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2nc(-c3ccccc3)no2)o1 ZINC000513758588 1042652187 /nfs/dbraw/zinc/65/21/87/1042652187.db2.gz ABKOHXBIXZHCPL-QGZVFWFLSA-N 1 2 323.396 4.365 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@@H]2c2nc(-c3ccccc3)no2)o1 ZINC000513758588 1042652189 /nfs/dbraw/zinc/65/21/89/1042652189.db2.gz ABKOHXBIXZHCPL-QGZVFWFLSA-N 1 2 323.396 4.365 20 0 DIADLO CCc1nc(C[NH2+][C@@H](c2ccc(OC)cc2F)C2CC2)cs1 ZINC000421828098 1042654664 /nfs/dbraw/zinc/65/46/64/1042654664.db2.gz BAPKAIJGFGRFQL-QGZVFWFLSA-N 1 2 320.433 4.094 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccncc1Cl ZINC000421839994 1042658933 /nfs/dbraw/zinc/65/89/33/1042658933.db2.gz ZHBJLAOPOPOUQS-CYBMUJFWSA-N 1 2 316.836 4.293 20 0 DIADLO Cc1[nH]c2nc[nH+]c(N3CC4(CCCC4)[C@@H]3c3ccco3)c2c1C ZINC000664276104 1042664763 /nfs/dbraw/zinc/66/47/63/1042664763.db2.gz MQMIVBMDNGWZEE-INIZCTEOSA-N 1 2 322.412 4.289 20 0 DIADLO CCCCc1nc(C[NH2+]C2(c3cccc(OC)c3)CC2)cs1 ZINC000271713705 1042666658 /nfs/dbraw/zinc/66/66/58/1042666658.db2.gz OKJCJLZNLCYQSB-UHFFFAOYSA-N 1 2 316.470 4.273 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](CC(C)(C)C)c2ccccc2)n1 ZINC000271749423 1042667197 /nfs/dbraw/zinc/66/71/97/1042667197.db2.gz KIXHJRZWQOWYOB-OAHLLOKOSA-N 1 2 301.434 4.460 20 0 DIADLO Cc1cc([C@H]([NH2+]Cc2nc(C(C)(C)C)no2)C2CC2)ccc1F ZINC000271771735 1042667722 /nfs/dbraw/zinc/66/77/22/1042667722.db2.gz ACLAEICJUTYAIZ-MRXNPFEDSA-N 1 2 317.408 4.056 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1cccc(N2CCCC2)c1 ZINC000271763283 1042667930 /nfs/dbraw/zinc/66/79/30/1042667930.db2.gz GRUZINUFNDNJQK-AWEZNQCLSA-N 1 2 311.429 4.003 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](CC(C)(C)C)c2ccccc2)o1 ZINC000271779721 1042668169 /nfs/dbraw/zinc/66/81/69/1042668169.db2.gz OWFPXPNAPFKHDZ-HNNXBMFYSA-N 1 2 301.434 4.460 20 0 DIADLO Cc1csc(C2([NH2+][C@H](C)c3cccc(F)c3F)CCC2)n1 ZINC000271921303 1042672192 /nfs/dbraw/zinc/67/21/92/1042672192.db2.gz BHICZLAHCXQPNZ-LLVKDONJSA-N 1 2 308.397 4.460 20 0 DIADLO CCC(CC)N(CC(C)C)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC000422216110 1042682056 /nfs/dbraw/zinc/68/20/56/1042682056.db2.gz VDTRHCFIQFBWJU-UHFFFAOYSA-N 1 2 305.466 4.055 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(OC(F)F)cc1 ZINC000423212933 1042700405 /nfs/dbraw/zinc/70/04/05/1042700405.db2.gz JHDZQSWOFJSZKQ-LLVKDONJSA-N 1 2 304.340 4.429 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc3c(c2)CC[NH2+]3)c(C)c1OC ZINC000423220868 1042700922 /nfs/dbraw/zinc/70/09/22/1042700922.db2.gz WCCCJSOUQPQKPJ-ZDUSSCGKSA-N 1 2 312.413 4.153 20 0 DIADLO Cc1nc(-c2cccc(NCc3c[nH+]cn3C(C)C)c2)oc1C ZINC000424155051 1042727577 /nfs/dbraw/zinc/72/75/77/1042727577.db2.gz NDFBWOYURKSWPK-UHFFFAOYSA-N 1 2 310.401 4.348 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2ccc(OC)cc2Cl)s1 ZINC000424313207 1042734004 /nfs/dbraw/zinc/73/40/04/1042734004.db2.gz NJHPEUWUXUMMFZ-SNVBAGLBSA-N 1 2 310.850 4.218 20 0 DIADLO CC[C@@H]([NH2+]Cc1occc1C)c1nc(C(F)(F)F)cs1 ZINC000072926815 1042741483 /nfs/dbraw/zinc/74/14/83/1042741483.db2.gz LRCJVPFDKFNWOQ-SECBINFHSA-N 1 2 304.337 4.304 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cccc2c1OCO2 ZINC000924971826 1042746129 /nfs/dbraw/zinc/74/61/29/1042746129.db2.gz YZQLQVRNVDKSMI-LLVKDONJSA-N 1 2 318.442 4.020 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(C3CCC3)s2)[C@@H]1c1cccnc1 ZINC000430111736 1042780056 /nfs/dbraw/zinc/78/00/56/1042780056.db2.gz UGIZMSUJBAFBPV-MRXNPFEDSA-N 1 2 313.470 4.389 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(C3CCC3)s2)[C@@H]1c1cccnc1 ZINC000430111736 1042780060 /nfs/dbraw/zinc/78/00/60/1042780060.db2.gz UGIZMSUJBAFBPV-MRXNPFEDSA-N 1 2 313.470 4.389 20 0 DIADLO CC(C)n1cncc1C[N@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000425319282 1042791194 /nfs/dbraw/zinc/79/11/94/1042791194.db2.gz AQOJMTHZHCACBP-RDTXWAMCSA-N 1 2 313.445 4.345 20 0 DIADLO CC(C)n1cncc1C[N@@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000425319282 1042791198 /nfs/dbraw/zinc/79/11/98/1042791198.db2.gz AQOJMTHZHCACBP-RDTXWAMCSA-N 1 2 313.445 4.345 20 0 DIADLO CC(C)n1cncc1C[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000425324211 1042791515 /nfs/dbraw/zinc/79/15/15/1042791515.db2.gz KAUALGSXMXIICL-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1cncc1C[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000425324211 1042791522 /nfs/dbraw/zinc/79/15/22/1042791522.db2.gz KAUALGSXMXIICL-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1cncc1C[N@@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC000425340753 1042794517 /nfs/dbraw/zinc/79/45/17/1042794517.db2.gz WBXIPDVKYDSKLF-UHFFFAOYSA-N 1 2 321.424 4.282 20 0 DIADLO CC(C)n1cncc1C[N@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC000425340753 1042794523 /nfs/dbraw/zinc/79/45/23/1042794523.db2.gz WBXIPDVKYDSKLF-UHFFFAOYSA-N 1 2 321.424 4.282 20 0 DIADLO CS[C@H]1CC[C@H]1Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000425353621 1042794857 /nfs/dbraw/zinc/79/48/57/1042794857.db2.gz IUBVOJKGDIKRNV-SJORKVTESA-N 1 2 313.470 4.192 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC([C@@H]3CCCCO3)CC2)c1 ZINC000664483425 1042796223 /nfs/dbraw/zinc/79/62/23/1042796223.db2.gz XSGZRGDRMSXDKH-SFHVURJKSA-N 1 2 314.404 4.159 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC[C@H]([C@H]3CCCCO3)C2)c1 ZINC000664489377 1042802708 /nfs/dbraw/zinc/80/27/08/1042802708.db2.gz WSHNIFUQRWDCKZ-MAUKXSAKSA-N 1 2 314.404 4.159 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC[C@@H]([C@H]3CCCCO3)C2)c1 ZINC000664489376 1042802794 /nfs/dbraw/zinc/80/27/94/1042802794.db2.gz WSHNIFUQRWDCKZ-CRAIPNDOSA-N 1 2 314.404 4.159 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)o1 ZINC000515163385 1042810161 /nfs/dbraw/zinc/81/01/61/1042810161.db2.gz LFINWGKBHUXCST-ZDUSSCGKSA-N 1 2 324.346 4.424 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)o1 ZINC000515163385 1042810165 /nfs/dbraw/zinc/81/01/65/1042810165.db2.gz LFINWGKBHUXCST-ZDUSSCGKSA-N 1 2 324.346 4.424 20 0 DIADLO Cc1cccc([C@H]2CCCC[N@@H+]2Cc2nc(C(F)F)no2)c1C ZINC000425418026 1042819167 /nfs/dbraw/zinc/81/91/67/1042819167.db2.gz KUMMGDLXKIUBQB-CQSZACIVSA-N 1 2 321.371 4.351 20 0 DIADLO Cc1cccc([C@H]2CCCC[N@H+]2Cc2nc(C(F)F)no2)c1C ZINC000425418026 1042819172 /nfs/dbraw/zinc/81/91/72/1042819172.db2.gz KUMMGDLXKIUBQB-CQSZACIVSA-N 1 2 321.371 4.351 20 0 DIADLO FC(F)c1noc(C[NH2+][C@@H](CC2CCC2)c2ccccc2)n1 ZINC000425452822 1042825657 /nfs/dbraw/zinc/82/56/57/1042825657.db2.gz DLGZZZKMMGWNOY-ZDUSSCGKSA-N 1 2 307.344 4.028 20 0 DIADLO Cc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nc(C(F)F)no1 ZINC000425462322 1042827289 /nfs/dbraw/zinc/82/72/89/1042827289.db2.gz UHGFAYBKXMUVQQ-ZDUSSCGKSA-N 1 2 309.360 4.193 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)c1cccc(Cl)c1 ZINC000638289910 1042842295 /nfs/dbraw/zinc/84/22/95/1042842295.db2.gz BZMXUQUPHZTGPK-BLLLJJGKSA-N 1 2 318.852 4.430 20 0 DIADLO CCCc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)cc1 ZINC000516751272 1042852646 /nfs/dbraw/zinc/85/26/46/1042852646.db2.gz VJKDZKIBVHOUII-UHFFFAOYSA-N 1 2 323.371 4.216 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1cccc(F)c1F ZINC000516933768 1042860361 /nfs/dbraw/zinc/86/03/61/1042860361.db2.gz YXYYBBRPJIPCRN-XPTSAGLGSA-N 1 2 309.743 4.403 20 0 DIADLO CC(=O)c1ccc(NCc2c[nH+]cn2Cc2ccccc2)cc1C ZINC000438299236 1042891200 /nfs/dbraw/zinc/89/12/00/1042891200.db2.gz GHXACPBCELHQDL-UHFFFAOYSA-N 1 2 319.408 4.055 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2nc(C(C)(C)C)no2)C(C)C)s1 ZINC000517853453 1042900358 /nfs/dbraw/zinc/90/03/58/1042900358.db2.gz HCPRDRQZMDTATN-UHFFFAOYSA-N 1 2 307.463 4.148 20 0 DIADLO Cc1ccc(C[N@H+](Cc2nc(C(C)(C)C)no2)C(C)C)s1 ZINC000517853453 1042900360 /nfs/dbraw/zinc/90/03/60/1042900360.db2.gz HCPRDRQZMDTATN-UHFFFAOYSA-N 1 2 307.463 4.148 20 0 DIADLO Cc1cc(C[NH2+]Cc2ccc(Oc3cc(C)ccc3C)nc2)no1 ZINC000518117825 1042907793 /nfs/dbraw/zinc/90/77/93/1042907793.db2.gz HHIJYPYJZAAOFL-UHFFFAOYSA-N 1 2 323.396 4.077 20 0 DIADLO Cc1ccc(C[C@H](C)[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)s1 ZINC000638661185 1042933666 /nfs/dbraw/zinc/93/36/66/1042933666.db2.gz YPSJJLUXQKKEJI-BLLLJJGKSA-N 1 2 318.490 4.017 20 0 DIADLO C[C@@H](CC(=O)N1CCC[C@@H]1CCC1CCCCC1)n1cc[nH+]c1 ZINC000519161747 1042935502 /nfs/dbraw/zinc/93/55/02/1042935502.db2.gz MUAHNLBNEVRTDU-FUHWJXTLSA-N 1 2 317.477 4.186 20 0 DIADLO CC(C)[C@@H](C)NC(=O)C[N@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000519193073 1042937423 /nfs/dbraw/zinc/93/74/23/1042937423.db2.gz YMCFYBGNAOCSGX-ZIAGYGMSSA-N 1 2 322.880 4.026 20 0 DIADLO CC(C)[C@@H](C)NC(=O)C[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000519193073 1042937425 /nfs/dbraw/zinc/93/74/25/1042937425.db2.gz YMCFYBGNAOCSGX-ZIAGYGMSSA-N 1 2 322.880 4.026 20 0 DIADLO Cc1nn(C(C)C)c(C)c1C[N@@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000894584181 1042969499 /nfs/dbraw/zinc/96/94/99/1042969499.db2.gz GVFYUOWSUAUFLS-SFHVURJKSA-N 1 2 312.461 4.059 20 0 DIADLO Cc1nn(C(C)C)c(C)c1C[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000894584181 1042969503 /nfs/dbraw/zinc/96/95/03/1042969503.db2.gz GVFYUOWSUAUFLS-SFHVURJKSA-N 1 2 312.461 4.059 20 0 DIADLO CCOc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)c(F)c1 ZINC001143575160 1042974427 /nfs/dbraw/zinc/97/44/27/1042974427.db2.gz PXGWYCVQFRCGNC-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccncc2)c(F)c1 ZINC001143575160 1042974432 /nfs/dbraw/zinc/97/44/32/1042974432.db2.gz PXGWYCVQFRCGNC-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CC[C@H](NC(=O)C[C@H](C)n1cc[nH+]c1)c1cccc2ccccc21 ZINC000894850897 1042987039 /nfs/dbraw/zinc/98/70/39/1042987039.db2.gz KKMWQKWAHJVSGW-KXBFYZLASA-N 1 2 321.424 4.255 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1cc(-c3cccs3)on1)C2 ZINC000729479028 1042994737 /nfs/dbraw/zinc/99/47/37/1042994737.db2.gz ATUNDEGGFRJPRF-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1cc(-c3cccs3)on1)C2 ZINC000729479028 1042994739 /nfs/dbraw/zinc/99/47/39/1042994739.db2.gz ATUNDEGGFRJPRF-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO CCOc1nnc(C[N@@H+]2CCCCC[C@H]2c2ccccc2)s1 ZINC000519904098 1043009062 /nfs/dbraw/zinc/00/90/62/1043009062.db2.gz SUWXBFYWVNNAGY-HNNXBMFYSA-N 1 2 317.458 4.054 20 0 DIADLO CCOc1nnc(C[N@H+]2CCCCC[C@H]2c2ccccc2)s1 ZINC000519904098 1043009065 /nfs/dbraw/zinc/00/90/65/1043009065.db2.gz SUWXBFYWVNNAGY-HNNXBMFYSA-N 1 2 317.458 4.054 20 0 DIADLO C[N@H+](Cc1nc(-c2ccccc2)c[nH]1)[C@@H]1CCc2ccc(F)cc21 ZINC000441028022 1043016809 /nfs/dbraw/zinc/01/68/09/1043016809.db2.gz KXEUXPPEAWTVOP-LJQANCHMSA-N 1 2 321.399 4.335 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccccc2)c[nH]1)[C@@H]1CCc2ccc(F)cc21 ZINC000441028022 1043016814 /nfs/dbraw/zinc/01/68/14/1043016814.db2.gz KXEUXPPEAWTVOP-LJQANCHMSA-N 1 2 321.399 4.335 20 0 DIADLO CCCc1noc(C[N@@H+](CCC)[C@H](C)c2ccccc2OC)n1 ZINC000520172297 1043020749 /nfs/dbraw/zinc/02/07/49/1043020749.db2.gz ALPZTXLAXBINCP-CQSZACIVSA-N 1 2 317.433 4.004 20 0 DIADLO CCCc1noc(C[N@H+](CCC)[C@H](C)c2ccccc2OC)n1 ZINC000520172297 1043020754 /nfs/dbraw/zinc/02/07/54/1043020754.db2.gz ALPZTXLAXBINCP-CQSZACIVSA-N 1 2 317.433 4.004 20 0 DIADLO CC(C)[N@@H+](Cc1coc(-c2ccc(F)cc2)n1)Cc1ccco1 ZINC000520175069 1043021488 /nfs/dbraw/zinc/02/14/88/1043021488.db2.gz SHRYZWURHRRNHD-UHFFFAOYSA-N 1 2 314.360 4.484 20 0 DIADLO CC(C)[N@H+](Cc1coc(-c2ccc(F)cc2)n1)Cc1ccco1 ZINC000520175069 1043021494 /nfs/dbraw/zinc/02/14/94/1043021494.db2.gz SHRYZWURHRRNHD-UHFFFAOYSA-N 1 2 314.360 4.484 20 0 DIADLO CC(C)[N@H+](Cc1cc(-c2ccco2)on1)Cc1ccccc1F ZINC000520173636 1043021823 /nfs/dbraw/zinc/02/18/23/1043021823.db2.gz TXMKTQGHGYZFDT-UHFFFAOYSA-N 1 2 314.360 4.484 20 0 DIADLO CC(C)[N@@H+](Cc1cc(-c2ccco2)on1)Cc1ccccc1F ZINC000520173636 1043021827 /nfs/dbraw/zinc/02/18/27/1043021827.db2.gz TXMKTQGHGYZFDT-UHFFFAOYSA-N 1 2 314.360 4.484 20 0 DIADLO COCC[N@H+](Cc1ncc(C(C)(C)C)o1)[C@H](C)c1ccccc1 ZINC000520183384 1043023443 /nfs/dbraw/zinc/02/34/43/1043023443.db2.gz WLZXUQHNIFFVEY-OAHLLOKOSA-N 1 2 316.445 4.182 20 0 DIADLO COCC[N@@H+](Cc1ncc(C(C)(C)C)o1)[C@H](C)c1ccccc1 ZINC000520183384 1043023446 /nfs/dbraw/zinc/02/34/46/1043023446.db2.gz WLZXUQHNIFFVEY-OAHLLOKOSA-N 1 2 316.445 4.182 20 0 DIADLO CCc1nc(C[N@@H+]2CCCCC[C@H]2/C=C\c2ccccc2)no1 ZINC000441171801 1043024760 /nfs/dbraw/zinc/02/47/60/1043024760.db2.gz SINSDRQKBIVKQS-QOHRORDFSA-N 1 2 311.429 4.090 20 0 DIADLO CCc1nc(C[N@H+]2CCCCC[C@H]2/C=C\c2ccccc2)no1 ZINC000441171801 1043024762 /nfs/dbraw/zinc/02/47/62/1043024762.db2.gz SINSDRQKBIVKQS-QOHRORDFSA-N 1 2 311.429 4.090 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000441174521 1043025420 /nfs/dbraw/zinc/02/54/20/1043025420.db2.gz SGVFNZPSSHKTBQ-WBVHZDCISA-N 1 2 305.805 4.458 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000441174521 1043025423 /nfs/dbraw/zinc/02/54/23/1043025423.db2.gz SGVFNZPSSHKTBQ-WBVHZDCISA-N 1 2 305.805 4.458 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000520383641 1043040945 /nfs/dbraw/zinc/04/09/45/1043040945.db2.gz JKVNLWULWLKAAN-PJIJBLCYSA-N 1 2 317.379 4.488 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000520383641 1043040948 /nfs/dbraw/zinc/04/09/48/1043040948.db2.gz JKVNLWULWLKAAN-PJIJBLCYSA-N 1 2 317.379 4.488 20 0 DIADLO Cc1ccccc1[C@H](C)[NH2+][C@H](C)c1nc(Cc2ccccc2)no1 ZINC000173806706 1043053832 /nfs/dbraw/zinc/05/38/32/1043053832.db2.gz INHLRZJCIWJFRU-JKSUJKDBSA-N 1 2 321.424 4.381 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nc(C3CCCCC3)no2)s1 ZINC000173864974 1043055152 /nfs/dbraw/zinc/05/51/52/1043055152.db2.gz KBLVFYVWERBMAD-GFCCVEGCSA-N 1 2 305.447 4.338 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)n1 ZINC000894974578 1043057303 /nfs/dbraw/zinc/05/73/03/1043057303.db2.gz GNDXKHTXBLXQQG-NSHDSACASA-N 1 2 304.356 4.137 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)n1 ZINC000894974578 1043057311 /nfs/dbraw/zinc/05/73/11/1043057311.db2.gz GNDXKHTXBLXQQG-NSHDSACASA-N 1 2 304.356 4.137 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc3[nH]c(=O)oc3c2)nc(C2CCC2)[nH+]1 ZINC000894981851 1043060432 /nfs/dbraw/zinc/06/04/32/1043060432.db2.gz UWADIBUJCYZJGP-LLVKDONJSA-N 1 2 324.384 4.072 20 0 DIADLO Cc1cc(CNc2ccc3cc[nH]c(=O)c3c2)c2c([nH+]1)CCCC2 ZINC000895020094 1043066435 /nfs/dbraw/zinc/06/64/35/1043066435.db2.gz RNIYLJIOCUOOGR-UHFFFAOYSA-N 1 2 319.408 4.135 20 0 DIADLO CC(C)(C)c1cn(Cc2coc(-c3c(F)cccc3F)n2)c[nH+]1 ZINC000865376480 1043089078 /nfs/dbraw/zinc/08/90/78/1043089078.db2.gz OTWTVRWNXHLAQK-UHFFFAOYSA-N 1 2 317.339 4.162 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+]C(C)(C)c1ncc(C)s1 ZINC000175980239 1043092352 /nfs/dbraw/zinc/09/23/52/1043092352.db2.gz BGMGHPOHZMLVPV-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO CCOc1ccccc1C[NH2+]Cc1c(Cl)cncc1Cl ZINC000865426558 1043095956 /nfs/dbraw/zinc/09/59/56/1043095956.db2.gz UGDHSSYGPTZJPX-UHFFFAOYSA-N 1 2 311.212 4.077 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1C ZINC000330653691 1043096082 /nfs/dbraw/zinc/09/60/82/1043096082.db2.gz RUPRWKIINGNZRU-KGLIPLIRSA-N 1 2 301.434 4.396 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]Cc2cccc(Cl)c2C)cs1 ZINC000865487142 1043104210 /nfs/dbraw/zinc/10/42/10/1043104210.db2.gz LJKXJIWUCJPDLV-NSHDSACASA-N 1 2 310.850 4.102 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2cccc(OC(C)(C)C)c2)s1 ZINC000865488792 1043104431 /nfs/dbraw/zinc/10/44/31/1043104431.db2.gz QQHMYEQMDWOCBJ-UHFFFAOYSA-N 1 2 319.474 4.129 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3ccc(C(F)F)nc3)ccc21 ZINC000865499981 1043106215 /nfs/dbraw/zinc/10/62/15/1043106215.db2.gz NSCHFOOUOJFXMV-UHFFFAOYSA-N 1 2 303.356 4.014 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3ccc(C(F)F)nc3)ccc21 ZINC000865499981 1043106220 /nfs/dbraw/zinc/10/62/20/1043106220.db2.gz NSCHFOOUOJFXMV-UHFFFAOYSA-N 1 2 303.356 4.014 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2ccccc2Cl)cs1 ZINC000177637142 1043109979 /nfs/dbraw/zinc/10/99/79/1043109979.db2.gz LYDRYOCQOJOHKL-QWRGUYRKSA-N 1 2 310.850 4.355 20 0 DIADLO CC(C)([NH2+]Cc1cccnc1Br)c1ccccc1F ZINC000865577050 1043115317 /nfs/dbraw/zinc/11/53/17/1043115317.db2.gz DWEBRLVOCKARBX-UHFFFAOYSA-N 1 2 323.209 4.008 20 0 DIADLO CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000331292444 1043117710 /nfs/dbraw/zinc/11/77/10/1043117710.db2.gz QEFYMTUUKDPWKR-JLZZUVOBSA-N 1 2 318.461 4.319 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1sccc1Br ZINC000178064737 1043119992 /nfs/dbraw/zinc/11/99/92/1043119992.db2.gz FLJTUSURLIDJRT-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1sccc1Br ZINC000178064737 1043119996 /nfs/dbraw/zinc/11/99/96/1043119996.db2.gz FLJTUSURLIDJRT-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO CCS[C@H]1CCC[C@H](NC(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000334087124 1043120911 /nfs/dbraw/zinc/12/09/11/1043120911.db2.gz KSHYKEVLDADAMD-GJZGRUSLSA-N 1 2 321.490 4.193 20 0 DIADLO Cc1cc2cc(C[NH2+]Cc3nn(C)cc3C(F)F)oc2cc1C ZINC000865809208 1043134338 /nfs/dbraw/zinc/13/43/38/1043134338.db2.gz YZSFSPAOXFGSSA-UHFFFAOYSA-N 1 2 319.355 4.011 20 0 DIADLO C[C@H]([NH2+]Cc1csc(CCc2ccccc2)n1)c1ccccn1 ZINC000179475487 1043146957 /nfs/dbraw/zinc/14/69/57/1043146957.db2.gz YSFNFHLTMFMUSO-HNNXBMFYSA-N 1 2 323.465 4.174 20 0 DIADLO Cc1nnc(C[NH2+][C@H](CC(C)(C)C)c2ccc(Cl)cc2)o1 ZINC000179711132 1043150021 /nfs/dbraw/zinc/15/00/21/1043150021.db2.gz PMGLDQDSKPLJDR-CQSZACIVSA-N 1 2 307.825 4.299 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C)c(C)o1)c1ccccc1OC(F)F ZINC000179722895 1043150209 /nfs/dbraw/zinc/15/02/09/1043150209.db2.gz NGEDFFBJZWXUKR-ZDUSSCGKSA-N 1 2 310.344 4.134 20 0 DIADLO c1cc(-c2nc(C[NH2+][C@@H](c3ccccc3)C3CC3)no2)cs1 ZINC000179689116 1043150968 /nfs/dbraw/zinc/15/09/68/1043150968.db2.gz HEWILJMSKISNHK-INIZCTEOSA-N 1 2 311.410 4.039 20 0 DIADLO c1cc(-c2nc(C[NH2+][C@H](c3ccccc3)C3CC3)no2)cs1 ZINC000179689130 1043151160 /nfs/dbraw/zinc/15/11/60/1043151160.db2.gz HEWILJMSKISNHK-MRXNPFEDSA-N 1 2 311.410 4.039 20 0 DIADLO CCc1nnc(C[NH2+][C@H](c2oc3ccccc3c2C)C(C)C)o1 ZINC000183255907 1043158673 /nfs/dbraw/zinc/15/86/73/1043158673.db2.gz SCULGMUIKNEJCB-KRWDZBQOSA-N 1 2 313.401 4.174 20 0 DIADLO F[C@@H]1COc2ccccc2[C@H]1[NH2+][C@@H]1CCSc2ccccc21 ZINC000866233236 1043163962 /nfs/dbraw/zinc/16/39/62/1043163962.db2.gz UBYWYXHXXHAFKB-IIDMSEBBSA-N 1 2 315.413 4.285 20 0 DIADLO CCC[C@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1cc(C)ccn1 ZINC000866249503 1043166037 /nfs/dbraw/zinc/16/60/37/1043166037.db2.gz KLZGRQISZPXURC-IBGZPJMESA-N 1 2 320.440 4.207 20 0 DIADLO OC[C@@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1ccccc1 ZINC000183667241 1043168461 /nfs/dbraw/zinc/16/84/61/1043168461.db2.gz NEPCJZFWSXJNEN-QGZVFWFLSA-N 1 2 316.470 4.014 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2coc(-c3cccs3)n2)c(C)o1 ZINC000183784907 1043170366 /nfs/dbraw/zinc/17/03/66/1043170366.db2.gz HBACIVRVRDQPEY-LLVKDONJSA-N 1 2 302.399 4.464 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)s1 ZINC000866275255 1043171402 /nfs/dbraw/zinc/17/14/02/1043171402.db2.gz ZMHJNMHJVRFERU-VIFPVBQESA-N 1 2 321.833 4.351 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@H](C)c2cc3ccccc3s2)n1 ZINC000184357041 1043182190 /nfs/dbraw/zinc/18/21/90/1043182190.db2.gz AZBPZTZDBHEOEG-GFCCVEGCSA-N 1 2 315.442 4.334 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1cc2ccccc2s1 ZINC000184365661 1043182554 /nfs/dbraw/zinc/18/25/54/1043182554.db2.gz NHSZHLHHYIURJC-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO Cc1cc2cc(C[NH2+][C@@H]3c4ccccc4OC[C@H]3F)ccc2[nH]1 ZINC000866356511 1043187691 /nfs/dbraw/zinc/18/76/91/1043187691.db2.gz MICYCKZGCYJLLE-VQIMIIECSA-N 1 2 310.372 4.038 20 0 DIADLO Clc1ccc([C@@H]2C[N@H+](CC3CCC3)CCO2)cc1Cl ZINC000441499453 1043194570 /nfs/dbraw/zinc/19/45/70/1043194570.db2.gz MRUBFUNXXWIZNM-HNNXBMFYSA-N 1 2 300.229 4.167 20 0 DIADLO Clc1ccc([C@@H]2C[N@@H+](CC3CCC3)CCO2)cc1Cl ZINC000441499453 1043194576 /nfs/dbraw/zinc/19/45/76/1043194576.db2.gz MRUBFUNXXWIZNM-HNNXBMFYSA-N 1 2 300.229 4.167 20 0 DIADLO Cc1nn(C(C)(C)C)cc1[C@@H](C)Nc1[nH+]c2ccccc2n1C ZINC000185316637 1043198678 /nfs/dbraw/zinc/19/86/78/1043198678.db2.gz QKVUKGFXVPMKTG-GFCCVEGCSA-N 1 2 311.433 4.006 20 0 DIADLO CCc1noc(CC)c1C[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000186379813 1043223499 /nfs/dbraw/zinc/22/34/99/1043223499.db2.gz JGISBTBRPSGQDO-NSHDSACASA-N 1 2 307.463 4.230 20 0 DIADLO CC(C)CC[C@@H]([NH2+]Cc1nn(C)cc1C(F)F)c1ccoc1 ZINC000866565738 1043223515 /nfs/dbraw/zinc/22/35/15/1043223515.db2.gz PZLZVXRCRAWBCA-CQSZACIVSA-N 1 2 311.376 4.218 20 0 DIADLO CC(C)(C)OCc1cc(C[NH2+]Cc2ccc3ccccc3c2)no1 ZINC000186421939 1043225601 /nfs/dbraw/zinc/22/56/01/1043225601.db2.gz ALEJIPOETRFJQF-UHFFFAOYSA-N 1 2 324.424 4.433 20 0 DIADLO C[C@H]([NH2+][C@H](CCO)c1ccco1)c1cc(Cl)ccc1Cl ZINC000186558237 1043229292 /nfs/dbraw/zinc/22/92/92/1043229292.db2.gz GVKMGOKNPWHBSJ-IINYFYTJSA-N 1 2 314.212 4.361 20 0 DIADLO C[C@@H]([NH2+][C@H](CCO)c1ccco1)c1cc(Cl)ccc1Cl ZINC000186558254 1043229348 /nfs/dbraw/zinc/22/93/48/1043229348.db2.gz GVKMGOKNPWHBSJ-QMTHXVAHSA-N 1 2 314.212 4.361 20 0 DIADLO O=C(Nc1ccsc1Cl)[C@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000186928042 1043238320 /nfs/dbraw/zinc/23/83/20/1043238320.db2.gz NYUYMRWPRDCQLU-CQSZACIVSA-N 1 2 320.845 4.005 20 0 DIADLO O=C(Nc1ccsc1Cl)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000186928042 1043238328 /nfs/dbraw/zinc/23/83/28/1043238328.db2.gz NYUYMRWPRDCQLU-CQSZACIVSA-N 1 2 320.845 4.005 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1ccccc1Cl ZINC000680040804 1043254251 /nfs/dbraw/zinc/25/42/51/1043254251.db2.gz AVQMLRIPINVYIS-OTYXRUKQSA-N 1 2 309.743 4.403 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](Cc1cocn1)C1CC1 ZINC000191926190 1043264343 /nfs/dbraw/zinc/26/43/43/1043264343.db2.gz NNENDKKIWSUOKV-NSHDSACASA-N 1 2 310.319 4.419 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](Cc1cocn1)C1CC1 ZINC000191926190 1043264352 /nfs/dbraw/zinc/26/43/52/1043264352.db2.gz NNENDKKIWSUOKV-NSHDSACASA-N 1 2 310.319 4.419 20 0 DIADLO CC/C=C(\F)C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000867976204 1043268841 /nfs/dbraw/zinc/26/88/41/1043268841.db2.gz GKMGLIYIYPHOKR-CHHVJCJISA-N 1 2 313.376 4.088 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@H]1CCCc2occc21)c1ccco1 ZINC000192795757 1043274126 /nfs/dbraw/zinc/27/41/26/1043274126.db2.gz GUEGMCCTHFOZFZ-JKSUJKDBSA-N 1 2 303.402 4.254 20 0 DIADLO Fc1cc(Br)c(Nc2ccn3cc[nH+]c3c2)cc1F ZINC001204978490 1043286693 /nfs/dbraw/zinc/28/66/93/1043286693.db2.gz SLHKPDWQHJKJPH-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Cc1cnc([C@H](C)SCc2ccc(-n3cc[nH+]c3)cc2C)cn1 ZINC000427664256 1043294744 /nfs/dbraw/zinc/29/47/44/1043294744.db2.gz HWOPXWCHDZDROC-HNNXBMFYSA-N 1 2 324.453 4.274 20 0 DIADLO CCc1ccc([C@@H]2CCN(C(=O)c3c(C)cc(C)[nH+]c3C)C2)cc1 ZINC001274275178 1043302715 /nfs/dbraw/zinc/30/27/15/1043302715.db2.gz UKYINYQYKFKKDP-LJQANCHMSA-N 1 2 322.452 4.199 20 0 DIADLO COc1cc(F)c([C@H](C)[NH2+][C@@H](C)c2csc(C)n2)cc1OC ZINC000268840262 1043335386 /nfs/dbraw/zinc/33/53/86/1043335386.db2.gz AONJWTOFARHNMD-UWVGGRQHSA-N 1 2 324.421 4.020 20 0 DIADLO Clc1ccc(-c2ccc(C[N@@H+]3CCn4cncc4C3)cc2)cc1 ZINC000520906693 1043340650 /nfs/dbraw/zinc/34/06/50/1043340650.db2.gz QGMNUDFLSUSAIH-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Clc1ccc(-c2ccc(C[N@H+]3CCn4cncc4C3)cc2)cc1 ZINC000520906693 1043340658 /nfs/dbraw/zinc/34/06/58/1043340658.db2.gz QGMNUDFLSUSAIH-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1nc(C(F)(F)F)cs1 ZINC000268974775 1043346611 /nfs/dbraw/zinc/34/66/11/1043346611.db2.gz JATQLEBQMVIXSI-VIFPVBQESA-N 1 2 316.348 4.021 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(-c3ccccc3)no2)cc1 ZINC000269043460 1043353573 /nfs/dbraw/zinc/35/35/73/1043353573.db2.gz DOEXFDRTHJHRRI-KBPBESRZSA-N 1 2 323.396 4.157 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCOC2(CCCC2)C1 ZINC000269051240 1043354981 /nfs/dbraw/zinc/35/49/81/1043354981.db2.gz RCLUIUKRWIHBTK-HNNXBMFYSA-N 1 2 312.413 4.048 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCOC2(CCCC2)C1 ZINC000269051240 1043354994 /nfs/dbraw/zinc/35/49/94/1043354994.db2.gz RCLUIUKRWIHBTK-HNNXBMFYSA-N 1 2 312.413 4.048 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCOC2(CCCC2)C1 ZINC000269051247 1043355679 /nfs/dbraw/zinc/35/56/79/1043355679.db2.gz RCLUIUKRWIHBTK-OAHLLOKOSA-N 1 2 312.413 4.048 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCOC2(CCCC2)C1 ZINC000269051247 1043355692 /nfs/dbraw/zinc/35/56/92/1043355692.db2.gz RCLUIUKRWIHBTK-OAHLLOKOSA-N 1 2 312.413 4.048 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccc(F)cc2C(F)(F)F)cs1 ZINC000269388355 1043363233 /nfs/dbraw/zinc/36/32/33/1043363233.db2.gz BSCLDKIRNMLBLG-MRVPVSSYSA-N 1 2 318.339 4.460 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2cc(C)ccc2OC(F)F)cs1 ZINC000269411435 1043365567 /nfs/dbraw/zinc/36/55/67/1043365567.db2.gz JKIOUEBXTRAEPJ-JTQLQIEISA-N 1 2 312.385 4.212 20 0 DIADLO CCC(CC)n1ccc(C[N@H+](C)[C@@H](C)c2cccc(O)c2)n1 ZINC000269615113 1043370909 /nfs/dbraw/zinc/37/09/09/1043370909.db2.gz GODGGAYWOWVURB-AWEZNQCLSA-N 1 2 301.434 4.143 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)n1 ZINC000269615113 1043370923 /nfs/dbraw/zinc/37/09/23/1043370923.db2.gz GODGGAYWOWVURB-AWEZNQCLSA-N 1 2 301.434 4.143 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H]2CCc3c2c(F)ccc3F)cs1 ZINC000269812265 1043373103 /nfs/dbraw/zinc/37/31/03/1043373103.db2.gz HFCLAGRSWKRBIB-NOZJJQNGSA-N 1 2 308.397 4.322 20 0 DIADLO CC[N@H+](Cc1noc(-c2ccsc2)n1)Cc1ccc(C)cc1 ZINC000521222765 1043376230 /nfs/dbraw/zinc/37/62/30/1043376230.db2.gz SNLSEWWUZZKTHA-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO CC[N@@H+](Cc1noc(-c2ccsc2)n1)Cc1ccc(C)cc1 ZINC000521222765 1043376240 /nfs/dbraw/zinc/37/62/40/1043376240.db2.gz SNLSEWWUZZKTHA-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO CC(C)c1csc(C[NH2+][C@H]2CCc3c2c(F)ccc3F)n1 ZINC000269941282 1043377666 /nfs/dbraw/zinc/37/76/66/1043377666.db2.gz RTZKOTMVTBRVBS-ZDUSSCGKSA-N 1 2 308.397 4.322 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)c(C)[nH+]1 ZINC000521344175 1043389048 /nfs/dbraw/zinc/38/90/48/1043389048.db2.gz LCUDWNYGXINAPO-QWHCGFSZSA-N 1 2 314.351 4.314 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2ncc(C3CC3)o2)[C@H]1c1ccccc1 ZINC000270618816 1043390316 /nfs/dbraw/zinc/39/03/16/1043390316.db2.gz OOFQCXYKBPDYIL-FZKQIMNGSA-N 1 2 314.454 4.231 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2ncc(C3CC3)o2)[C@H]1c1ccccc1 ZINC000270618816 1043390327 /nfs/dbraw/zinc/39/03/27/1043390327.db2.gz OOFQCXYKBPDYIL-FZKQIMNGSA-N 1 2 314.454 4.231 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2ncc(C3CC3)o2)[C@@H]1c1ccccc1 ZINC000270618819 1043391396 /nfs/dbraw/zinc/39/13/96/1043391396.db2.gz OOFQCXYKBPDYIL-UGSOOPFHSA-N 1 2 314.454 4.231 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2ncc(C3CC3)o2)[C@@H]1c1ccccc1 ZINC000270618819 1043391405 /nfs/dbraw/zinc/39/14/05/1043391405.db2.gz OOFQCXYKBPDYIL-UGSOOPFHSA-N 1 2 314.454 4.231 20 0 DIADLO COCc1ccc(C[NH2+][C@@H](c2cccc(C)c2)c2ccccn2)o1 ZINC000270782182 1043397400 /nfs/dbraw/zinc/39/74/00/1043397400.db2.gz DCYIPRKSESIUPZ-FQEVSTJZSA-N 1 2 322.408 4.009 20 0 DIADLO O=C(CCCC1CCCCC1)NCCCCNc1cccc[nH+]1 ZINC000521444501 1043398250 /nfs/dbraw/zinc/39/82/50/1043398250.db2.gz HKZZEGXWYTWZHB-UHFFFAOYSA-N 1 2 317.477 4.141 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)on1 ZINC000925265086 1043406000 /nfs/dbraw/zinc/40/60/00/1043406000.db2.gz QLXKCHXNSGGETQ-MGPLVRAMSA-N 1 2 324.371 4.399 20 0 DIADLO CCCCOc1ccc(C[NH2+][C@@H](C)c2cscn2)cc1OC ZINC000271201984 1043407057 /nfs/dbraw/zinc/40/70/57/1043407057.db2.gz ZJWFEZAMTFNCLF-ZDUSSCGKSA-N 1 2 320.458 4.181 20 0 DIADLO CCc1cccc2c1OCC[C@@H]2[NH2+][C@H]1CCCc2oc(C)nc21 ZINC000925359700 1043413167 /nfs/dbraw/zinc/41/31/67/1043413167.db2.gz CVBFCNWJJKUOIF-HOTGVXAUSA-N 1 2 312.413 4.036 20 0 DIADLO CCC(CC)n1ccc(C[N@H+](C)[C@@H](CC)c2ccncc2)n1 ZINC000271401233 1043413735 /nfs/dbraw/zinc/41/37/35/1043413735.db2.gz NTMYQAUDWGANOX-SFHVURJKSA-N 1 2 300.450 4.222 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+](C)[C@@H](CC)c2ccncc2)n1 ZINC000271401233 1043413747 /nfs/dbraw/zinc/41/37/47/1043413747.db2.gz NTMYQAUDWGANOX-SFHVURJKSA-N 1 2 300.450 4.222 20 0 DIADLO CC[C@@H]([NH2+][C@@H]1CCCc2oc(C)nc21)c1cc(F)ccc1F ZINC000925453650 1043418897 /nfs/dbraw/zinc/41/88/97/1043418897.db2.gz OLVMJHWSJIUIFR-HUUCEWRRSA-N 1 2 306.356 4.380 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(C(F)(F)F)n[nH]2)cc1 ZINC000442803579 1043427098 /nfs/dbraw/zinc/42/70/98/1043427098.db2.gz USCILITUIBHNLG-AWEZNQCLSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc(C(F)(F)F)n[nH]2)cc1 ZINC000442803579 1043427103 /nfs/dbraw/zinc/42/71/03/1043427103.db2.gz USCILITUIBHNLG-AWEZNQCLSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(C(F)(F)F)n[nH]2)cc1 ZINC000442803582 1043427120 /nfs/dbraw/zinc/42/71/20/1043427120.db2.gz USCILITUIBHNLG-CQSZACIVSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc(C(F)(F)F)n[nH]2)cc1 ZINC000442803582 1043427128 /nfs/dbraw/zinc/42/71/28/1043427128.db2.gz USCILITUIBHNLG-CQSZACIVSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(C(F)(F)F)n[nH]2)c1 ZINC000442814700 1043429645 /nfs/dbraw/zinc/42/96/45/1043429645.db2.gz UCPMRVZJCBDIHE-AWEZNQCLSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc(C(F)(F)F)n[nH]2)c1 ZINC000442814700 1043429651 /nfs/dbraw/zinc/42/96/51/1043429651.db2.gz UCPMRVZJCBDIHE-AWEZNQCLSA-N 1 2 309.335 4.074 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@H](C)C1(Cl)CC1)c1ccco1 ZINC000925566705 1043430640 /nfs/dbraw/zinc/43/06/40/1043430640.db2.gz FNVKALMAJDFEFG-MLGOLLRUSA-N 1 2 305.805 4.127 20 0 DIADLO CSc1ccccc1[C@H](C)[NH2+][C@H](CO)c1c(F)cccc1F ZINC000442848780 1043432253 /nfs/dbraw/zinc/43/22/53/1043432253.db2.gz BFASENCKXUQRNZ-XHDPSFHLSA-N 1 2 323.408 4.071 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1cnccc1C)c1ccco1 ZINC000271561414 1043436233 /nfs/dbraw/zinc/43/62/33/1043436233.db2.gz WVPAAJULFPHVHI-FOIQADDNSA-N 1 2 322.408 4.432 20 0 DIADLO Cc1csc(C2([NH2+][C@H](C)c3cccc(O)c3F)CCC2)n1 ZINC000872054850 1043437397 /nfs/dbraw/zinc/43/73/97/1043437397.db2.gz CJMYOMUHLMISTM-LLVKDONJSA-N 1 2 306.406 4.026 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(Cc2ccccc2C)no1)c1ccccc1 ZINC000271661753 1043446011 /nfs/dbraw/zinc/44/60/11/1043446011.db2.gz LHIUCTQLPSINQZ-SFHVURJKSA-N 1 2 321.424 4.210 20 0 DIADLO CSc1cccc(F)c1C[NH2+][C@@H](C)c1cccc(O)c1F ZINC000872069157 1043447717 /nfs/dbraw/zinc/44/77/17/1043447717.db2.gz LPIYHVKHQIXESU-JTQLQIEISA-N 1 2 309.381 4.243 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)o1 ZINC000271661082 1043447850 /nfs/dbraw/zinc/44/78/50/1043447850.db2.gz AESPVXIUUVUHLT-UHFFFAOYSA-N 1 2 308.372 4.275 20 0 DIADLO COc1cccc(C2([NH2+]Cc3ncc(-c4ccccc4)o3)CC2)c1 ZINC000271690606 1043450683 /nfs/dbraw/zinc/45/06/83/1043450683.db2.gz IQRPTQHDTAPEMZ-UHFFFAOYSA-N 1 2 320.392 4.129 20 0 DIADLO C[N@H+](CCc1ccccc1O)Cc1csc(C2CCCC2)n1 ZINC000558181957 1043452451 /nfs/dbraw/zinc/45/24/51/1043452451.db2.gz GOOPVISACDMATF-UHFFFAOYSA-N 1 2 316.470 4.181 20 0 DIADLO C[N@@H+](CCc1ccccc1O)Cc1csc(C2CCCC2)n1 ZINC000558181957 1043452457 /nfs/dbraw/zinc/45/24/57/1043452457.db2.gz GOOPVISACDMATF-UHFFFAOYSA-N 1 2 316.470 4.181 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCOc2c(F)cccc2C1 ZINC000339137469 1043453741 /nfs/dbraw/zinc/45/37/41/1043453741.db2.gz VHMDAMQVOAEYNB-UHFFFAOYSA-N 1 2 314.404 4.047 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCOc2c(F)cccc2C1 ZINC000339137469 1043453752 /nfs/dbraw/zinc/45/37/52/1043453752.db2.gz VHMDAMQVOAEYNB-UHFFFAOYSA-N 1 2 314.404 4.047 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1nnc(-c2ccccc2)[nH]1)c1ccccc1 ZINC000777572660 1043457140 /nfs/dbraw/zinc/45/71/40/1043457140.db2.gz MSUFNSKJQHMUTD-SFHVURJKSA-N 1 2 320.440 4.349 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1nc(-c2ccccc2)n[nH]1)c1ccccc1 ZINC000777572660 1043457151 /nfs/dbraw/zinc/45/71/51/1043457151.db2.gz MSUFNSKJQHMUTD-SFHVURJKSA-N 1 2 320.440 4.349 20 0 DIADLO C[C@@H](Nc1ccc([NH+]2CCCC2)cc1)c1ccnn1C1CCC1 ZINC000925728795 1043457504 /nfs/dbraw/zinc/45/75/04/1043457504.db2.gz WDCJKCJTHNMEHZ-OAHLLOKOSA-N 1 2 310.445 4.381 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(-c2ccccc2)[nH]1)c1ccc(C)cc1 ZINC000777574130 1043460438 /nfs/dbraw/zinc/46/04/38/1043460438.db2.gz HCYGEBIFAZZMKV-KRWDZBQOSA-N 1 2 306.413 4.021 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(-c2ccccc2)n[nH]1)c1ccc(C)cc1 ZINC000777574130 1043460445 /nfs/dbraw/zinc/46/04/45/1043460445.db2.gz HCYGEBIFAZZMKV-KRWDZBQOSA-N 1 2 306.413 4.021 20 0 DIADLO Fc1cc2c(cc1Cl)[C@H]([NH2+]Cc1ncc(Cl)s1)CC2 ZINC000872111902 1043462766 /nfs/dbraw/zinc/46/27/66/1043462766.db2.gz GCXAIFQWRJPMTD-LLVKDONJSA-N 1 2 317.216 4.366 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@@H](COC)c2ccccc2)on1 ZINC000558243879 1043469783 /nfs/dbraw/zinc/46/97/83/1043469783.db2.gz JRPAOGIYNWTHKO-SFHVURJKSA-N 1 2 302.418 4.056 20 0 DIADLO CCCc1ccc([C@@H](C)[NH2+]Cc2nnc(-c3ccccc3)[nH]2)cc1 ZINC000777575406 1043472822 /nfs/dbraw/zinc/47/28/22/1043472822.db2.gz QLTAKQNWEKBHKJ-OAHLLOKOSA-N 1 2 320.440 4.275 20 0 DIADLO Cc1noc([C@@H]2CCCC[N@@H+]2Cc2ccc(-c3ccccc3)o2)n1 ZINC000348847233 1043475275 /nfs/dbraw/zinc/47/52/75/1043475275.db2.gz IMFZHQXAZZOOJJ-KRWDZBQOSA-N 1 2 323.396 4.365 20 0 DIADLO Cc1noc([C@@H]2CCCC[N@H+]2Cc2ccc(-c3ccccc3)o2)n1 ZINC000348847233 1043475290 /nfs/dbraw/zinc/47/52/90/1043475290.db2.gz IMFZHQXAZZOOJJ-KRWDZBQOSA-N 1 2 323.396 4.365 20 0 DIADLO Cc1csc(C2([NH2+][C@H]3CCc4c3nccc4Cl)CCC2)n1 ZINC000925804560 1043475996 /nfs/dbraw/zinc/47/59/96/1043475996.db2.gz JRIOWZGDZKZRDH-ZDUSSCGKSA-N 1 2 319.861 4.156 20 0 DIADLO FC(F)(F)Oc1ccccc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000348918294 1043479815 /nfs/dbraw/zinc/47/98/15/1043479815.db2.gz BLCGVRNGGABTGQ-HNNXBMFYSA-N 1 2 322.330 4.317 20 0 DIADLO FC(F)(F)Oc1ccccc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000348918294 1043479822 /nfs/dbraw/zinc/47/98/22/1043479822.db2.gz BLCGVRNGGABTGQ-HNNXBMFYSA-N 1 2 322.330 4.317 20 0 DIADLO FC(F)(F)Oc1ccccc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000348918295 1043480114 /nfs/dbraw/zinc/48/01/14/1043480114.db2.gz BLCGVRNGGABTGQ-OAHLLOKOSA-N 1 2 322.330 4.317 20 0 DIADLO FC(F)(F)Oc1ccccc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000348918295 1043480120 /nfs/dbraw/zinc/48/01/20/1043480120.db2.gz BLCGVRNGGABTGQ-OAHLLOKOSA-N 1 2 322.330 4.317 20 0 DIADLO C[C@H]1CC[C@H]([NH2+]Cc2nnc(-c3ccccc3)[nH]2)c2ccccc21 ZINC000777576627 1043482268 /nfs/dbraw/zinc/48/22/68/1043482268.db2.gz XFTDJAFKKBSSSW-KSSFIOAISA-N 1 2 318.424 4.200 20 0 DIADLO Cc1noc(C)c1C[N@H+](Cc1cccnc1)Cc1ccccc1C ZINC000349038516 1043488416 /nfs/dbraw/zinc/48/84/16/1043488416.db2.gz VKETUVMEGLZKGM-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1noc(C)c1C[N@@H+](Cc1cccnc1)Cc1ccccc1C ZINC000349038516 1043488420 /nfs/dbraw/zinc/48/84/20/1043488420.db2.gz VKETUVMEGLZKGM-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@H]1CCCOc2cc(F)ccc21 ZINC000925970559 1043501658 /nfs/dbraw/zinc/50/16/58/1043501658.db2.gz VZCDNJGYVYIMPK-GJZGRUSLSA-N 1 2 316.376 4.003 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1ccc(Cl)cn1 ZINC000558408299 1043503013 /nfs/dbraw/zinc/50/30/13/1043503013.db2.gz FIZKCJAIDDXCOZ-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1ccc(Cl)cn1 ZINC000558408299 1043503029 /nfs/dbraw/zinc/50/30/29/1043503029.db2.gz FIZKCJAIDDXCOZ-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)Cc1ccc(Cl)s1 ZINC000349614124 1043513021 /nfs/dbraw/zinc/51/30/21/1043513021.db2.gz HWZGYGKFGVOSOJ-UHFFFAOYSA-N 1 2 311.863 4.051 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)Cc1ccc(Cl)s1 ZINC000349614124 1043513029 /nfs/dbraw/zinc/51/30/29/1043513029.db2.gz HWZGYGKFGVOSOJ-UHFFFAOYSA-N 1 2 311.863 4.051 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1c[nH]nc1-c1cccs1 ZINC000124369091 1043514621 /nfs/dbraw/zinc/51/46/21/1043514621.db2.gz ANNSGLZVVWATHS-UHFFFAOYSA-N 1 2 312.442 4.125 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1cnc(C2CCC2)s1 ZINC000349700613 1043518763 /nfs/dbraw/zinc/51/87/63/1043518763.db2.gz RXMPCTOILQUHGX-UHFFFAOYSA-N 1 2 316.470 4.441 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1cnc(C2CCC2)s1 ZINC000349700613 1043518771 /nfs/dbraw/zinc/51/87/71/1043518771.db2.gz RXMPCTOILQUHGX-UHFFFAOYSA-N 1 2 316.470 4.441 20 0 DIADLO CC(C)[N@H+](Cc1ccco1)Cc1nc2ccc(Cl)cc2n1C ZINC000349839613 1043526436 /nfs/dbraw/zinc/52/64/36/1043526436.db2.gz LIWOZCRUZIPQDZ-UHFFFAOYSA-N 1 2 317.820 4.230 20 0 DIADLO CC(C)[N@@H+](Cc1ccco1)Cc1nc2ccc(Cl)cc2n1C ZINC000349839613 1043526441 /nfs/dbraw/zinc/52/64/41/1043526441.db2.gz LIWOZCRUZIPQDZ-UHFFFAOYSA-N 1 2 317.820 4.230 20 0 DIADLO CC(C)[C@H]([NH2+][C@H]1C[C@H](C)n2ncnc21)c1ccc(Cl)cc1F ZINC000926127890 1043532857 /nfs/dbraw/zinc/53/28/57/1043532857.db2.gz KRHJLQCXVGAGIO-LKTVYLICSA-N 1 2 322.815 4.063 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+]C(c1ccccc1C)c1ccccc1C ZINC000926169671 1043538777 /nfs/dbraw/zinc/53/87/77/1043538777.db2.gz OBOYEWDGXXQLTP-HNNXBMFYSA-N 1 2 321.424 4.435 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cnn(-c3ccc(Cl)cc3)c2)o1 ZINC000350089626 1043540387 /nfs/dbraw/zinc/54/03/87/1043540387.db2.gz WKWCQCYKTHLVEV-UHFFFAOYSA-N 1 2 315.804 4.059 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cnn(-c3ccc(Cl)cc3)c2)o1 ZINC000350089626 1043540392 /nfs/dbraw/zinc/54/03/92/1043540392.db2.gz WKWCQCYKTHLVEV-UHFFFAOYSA-N 1 2 315.804 4.059 20 0 DIADLO Cc1ccc(C)n1C1CC[NH+](Cc2c(Cl)ccnc2F)CC1 ZINC001204763323 1043540665 /nfs/dbraw/zinc/54/06/65/1043540665.db2.gz MCZPFFOGNDOENL-UHFFFAOYSA-N 1 2 321.827 4.130 20 0 DIADLO CCCOc1cccc2c(N(C)Cc3ccccn3)cc[nH+]c12 ZINC000350313120 1043541425 /nfs/dbraw/zinc/54/14/25/1043541425.db2.gz XIHFNNJNDIWVTR-UHFFFAOYSA-N 1 2 307.397 4.055 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@H](C)c1cn(C)cn1 ZINC000926299696 1043559848 /nfs/dbraw/zinc/55/98/48/1043559848.db2.gz ZWSXABWCYVRAHR-OCCSQVGLSA-N 1 2 311.351 4.073 20 0 DIADLO CCc1nc(C[N@H+](C)C[C@@H]2CCC3(CCCCC3)O2)cs1 ZINC000558679368 1043572554 /nfs/dbraw/zinc/57/25/54/1043572554.db2.gz ZPUURMWLUKDUQD-HNNXBMFYSA-N 1 2 308.491 4.019 20 0 DIADLO CCc1nc(C[N@@H+](C)C[C@@H]2CCC3(CCCCC3)O2)cs1 ZINC000558679368 1043572567 /nfs/dbraw/zinc/57/25/67/1043572567.db2.gz ZPUURMWLUKDUQD-HNNXBMFYSA-N 1 2 308.491 4.019 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1ccc(C2CC2)cc1F ZINC000926469284 1043583211 /nfs/dbraw/zinc/58/32/11/1043583211.db2.gz KCTPVCAUCIGVLA-INIZCTEOSA-N 1 2 300.377 4.167 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(c3ccc(C)cc3)C(C)C)ccn12 ZINC000888652088 1043596084 /nfs/dbraw/zinc/59/60/84/1043596084.db2.gz MCYINSHFBPLHQK-UHFFFAOYSA-N 1 2 307.397 4.006 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+](C)Cc3scnc3C)s2)o1 ZINC000353286317 1043597033 /nfs/dbraw/zinc/59/70/33/1043597033.db2.gz KYNFBVCHSMHYOJ-UHFFFAOYSA-N 1 2 319.455 4.108 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+](C)Cc3scnc3C)s2)o1 ZINC000353286317 1043597044 /nfs/dbraw/zinc/59/70/44/1043597044.db2.gz KYNFBVCHSMHYOJ-UHFFFAOYSA-N 1 2 319.455 4.108 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2ccnn2CC(C)C)s1 ZINC000648009931 1043597564 /nfs/dbraw/zinc/59/75/64/1043597564.db2.gz CXDPUKRBYVZFJQ-AWEZNQCLSA-N 1 2 320.506 4.059 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccnn2CC(C)C)s1 ZINC000648009931 1043597573 /nfs/dbraw/zinc/59/75/73/1043597573.db2.gz CXDPUKRBYVZFJQ-AWEZNQCLSA-N 1 2 320.506 4.059 20 0 DIADLO O=C(Nc1ccccc1C(F)F)c1ccc(-n2cc[nH+]c2)cc1 ZINC001299752753 1043599380 /nfs/dbraw/zinc/59/93/80/1043599380.db2.gz GZCWCMCSWFNHKA-UHFFFAOYSA-N 1 2 313.307 4.062 20 0 DIADLO C[C@H](c1ccccc1)N(C(=O)Nc1ccn2cc[nH+]c2c1)C1CC1 ZINC000353324964 1043600360 /nfs/dbraw/zinc/60/03/60/1043600360.db2.gz YBEJJQMNBSSAFY-CQSZACIVSA-N 1 2 320.396 4.092 20 0 DIADLO C[NH+](C)c1ccc(N[C@@H](C[C@H]2CCOC2)c2ccccc2)cc1 ZINC000777602308 1043602045 /nfs/dbraw/zinc/60/20/45/1043602045.db2.gz KHYLQAIVNVJALG-UZLBHIALSA-N 1 2 310.441 4.332 20 0 DIADLO C[C@@H]([NH2+]Cc1nccc(C(F)(F)F)n1)c1coc2ccccc21 ZINC000926585754 1043604703 /nfs/dbraw/zinc/60/47/03/1043604703.db2.gz NFXZYFLNGYSIEF-SNVBAGLBSA-N 1 2 321.302 4.092 20 0 DIADLO CCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(C)on2)cc1OC ZINC000353427022 1043605875 /nfs/dbraw/zinc/60/58/75/1043605875.db2.gz OBRYJTLNLWFXOR-ZIAGYGMSSA-N 1 2 318.417 4.192 20 0 DIADLO Clc1ccc([C@@H]2C[N@@H+](C3CCCC3)CCO2)cc1Cl ZINC000535655693 1043608372 /nfs/dbraw/zinc/60/83/72/1043608372.db2.gz UXVBAJLDQIAQRV-HNNXBMFYSA-N 1 2 300.229 4.309 20 0 DIADLO Clc1ccc([C@@H]2C[N@H+](C3CCCC3)CCO2)cc1Cl ZINC000535655693 1043608381 /nfs/dbraw/zinc/60/83/81/1043608381.db2.gz UXVBAJLDQIAQRV-HNNXBMFYSA-N 1 2 300.229 4.309 20 0 DIADLO CC[C@H](Nc1ccc([NH+](C)C)cc1)c1ccc2c(c1)OCCO2 ZINC000777602555 1043622464 /nfs/dbraw/zinc/62/24/64/1043622464.db2.gz QXLUDWBHRZFVQL-KRWDZBQOSA-N 1 2 312.413 4.087 20 0 DIADLO CC[N@H+](Cc1coc(-c2ccc(C)cc2)n1)Cc1ccccn1 ZINC000353609278 1043623287 /nfs/dbraw/zinc/62/32/87/1043623287.db2.gz KQXAFXZCOQZNGS-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO CC[N@@H+](Cc1coc(-c2ccc(C)cc2)n1)Cc1ccccn1 ZINC000353609278 1043623293 /nfs/dbraw/zinc/62/32/93/1043623293.db2.gz KQXAFXZCOQZNGS-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO CC(C)[N@H+](Cc1nc(C2CCCC2)no1)Cc1ccc(F)cc1 ZINC000443631621 1043629174 /nfs/dbraw/zinc/62/91/74/1043629174.db2.gz MAHCUQKSEYTWBR-UHFFFAOYSA-N 1 2 317.408 4.277 20 0 DIADLO CC(C)[N@@H+](Cc1nc(C2CCCC2)no1)Cc1ccc(F)cc1 ZINC000443631621 1043629183 /nfs/dbraw/zinc/62/91/83/1043629183.db2.gz MAHCUQKSEYTWBR-UHFFFAOYSA-N 1 2 317.408 4.277 20 0 DIADLO c1cc2c(s1)C[N@H+](Cc1nc(-c3ccccc3)cs1)CC2 ZINC000353676189 1043631597 /nfs/dbraw/zinc/63/15/97/1043631597.db2.gz VSJNHRORMLKAFV-UHFFFAOYSA-N 1 2 312.463 4.430 20 0 DIADLO c1cc2c(s1)C[N@@H+](Cc1nc(-c3ccccc3)cs1)CC2 ZINC000353676189 1043631603 /nfs/dbraw/zinc/63/16/03/1043631603.db2.gz VSJNHRORMLKAFV-UHFFFAOYSA-N 1 2 312.463 4.430 20 0 DIADLO C[C@@H](Nc1ccc(F)c(C(F)F)c1)c1cn2c([nH+]1)CCCC2 ZINC000926794434 1043633313 /nfs/dbraw/zinc/63/33/13/1043633313.db2.gz JVLIEYNTUUVAIZ-SNVBAGLBSA-N 1 2 309.335 4.469 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)s1 ZINC000353699748 1043633513 /nfs/dbraw/zinc/63/35/13/1043633513.db2.gz UAVVETAQPBAJRR-HNNXBMFYSA-N 1 2 301.459 4.245 20 0 DIADLO CC(C)c1ncc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)s1 ZINC000353699748 1043633521 /nfs/dbraw/zinc/63/35/21/1043633521.db2.gz UAVVETAQPBAJRR-HNNXBMFYSA-N 1 2 301.459 4.245 20 0 DIADLO C[C@H](Nc1ccc(F)c(C(F)F)c1)c1cn2c([nH+]1)CCCC2 ZINC000926794433 1043634125 /nfs/dbraw/zinc/63/41/25/1043634125.db2.gz JVLIEYNTUUVAIZ-JTQLQIEISA-N 1 2 309.335 4.469 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(C3CCC3)s2)[C@@H]1c1ccncc1 ZINC000353697165 1043634379 /nfs/dbraw/zinc/63/43/79/1043634379.db2.gz FJDCBWKLMIYLFR-MRXNPFEDSA-N 1 2 313.470 4.389 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(C3CCC3)s2)[C@@H]1c1ccncc1 ZINC000353697165 1043634385 /nfs/dbraw/zinc/63/43/85/1043634385.db2.gz FJDCBWKLMIYLFR-MRXNPFEDSA-N 1 2 313.470 4.389 20 0 DIADLO CCn1ccnc1C[N@@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000353743234 1043638302 /nfs/dbraw/zinc/63/83/02/1043638302.db2.gz BXWDHKVOIYGBAC-HXUWFJFHSA-N 1 2 317.436 4.203 20 0 DIADLO CCn1ccnc1C[N@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000353743234 1043638311 /nfs/dbraw/zinc/63/83/11/1043638311.db2.gz BXWDHKVOIYGBAC-HXUWFJFHSA-N 1 2 317.436 4.203 20 0 DIADLO C[C@]12CC[N@H+](Cc3ccc(F)c(F)c3F)C[C@H]1C2(Cl)Cl ZINC000825823952 1043639409 /nfs/dbraw/zinc/63/94/09/1043639409.db2.gz CUEVLIYOYUSWHI-MFKMUULPSA-N 1 2 324.173 4.120 20 0 DIADLO C[C@]12CC[N@@H+](Cc3ccc(F)c(F)c3F)C[C@H]1C2(Cl)Cl ZINC000825823952 1043639416 /nfs/dbraw/zinc/63/94/16/1043639416.db2.gz CUEVLIYOYUSWHI-MFKMUULPSA-N 1 2 324.173 4.120 20 0 DIADLO c1csc(C[N@@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)n1 ZINC000353748363 1043640885 /nfs/dbraw/zinc/64/08/85/1043640885.db2.gz RJKUJULRQRVVCX-GOSISDBHSA-N 1 2 306.434 4.443 20 0 DIADLO c1csc(C[N@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)n1 ZINC000353748363 1043640890 /nfs/dbraw/zinc/64/08/90/1043640890.db2.gz RJKUJULRQRVVCX-GOSISDBHSA-N 1 2 306.434 4.443 20 0 DIADLO CC(C)Cc1ncc(C[N@H+]2CC=C(C(F)(F)F)CC2)s1 ZINC000353749629 1043641063 /nfs/dbraw/zinc/64/10/63/1043641063.db2.gz WFIVIYNDYGOJPE-UHFFFAOYSA-N 1 2 304.381 4.036 20 0 DIADLO CC(C)Cc1ncc(C[N@@H+]2CC=C(C(F)(F)F)CC2)s1 ZINC000353749629 1043641065 /nfs/dbraw/zinc/64/10/65/1043641065.db2.gz WFIVIYNDYGOJPE-UHFFFAOYSA-N 1 2 304.381 4.036 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@H]1[NH2+][C@H]1CCc2c1nccc2Cl ZINC000926859785 1043644282 /nfs/dbraw/zinc/64/42/82/1043644282.db2.gz CTKJNWTZCILVGU-IXDOHACOSA-N 1 2 316.807 4.338 20 0 DIADLO Cc1cc(N[C@@H](C)c2cccc(Br)n2)c[nH+]c1C ZINC000926856509 1043644650 /nfs/dbraw/zinc/64/46/50/1043644650.db2.gz VFNPBVRYNAWSCP-NSHDSACASA-N 1 2 306.207 4.029 20 0 DIADLO C[C@H]([NH2+][C@H]1c2ccccc2OC[C@H]1F)c1cc2ccccc2[nH]1 ZINC000926889289 1043648866 /nfs/dbraw/zinc/64/88/66/1043648866.db2.gz NUJDWUFQGVTDKB-HGQUKEQDSA-N 1 2 310.372 4.290 20 0 DIADLO Clc1cccc2c1[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)COC2 ZINC000926895825 1043650371 /nfs/dbraw/zinc/65/03/71/1043650371.db2.gz YBRAKCAERWLWFA-FUHWJXTLSA-N 1 2 314.816 4.047 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1ccc(F)cc1Cl ZINC000353879757 1043653190 /nfs/dbraw/zinc/65/31/90/1043653190.db2.gz IDORXMMYVVHVMO-MEBBXXQBSA-N 1 2 307.800 4.015 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1nc(C)sc1C ZINC000443671474 1043654521 /nfs/dbraw/zinc/65/45/21/1043654521.db2.gz CBPUUHHKGREITI-UHFFFAOYSA-N 1 2 300.880 4.497 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1nc(C)sc1C ZINC000443671474 1043654528 /nfs/dbraw/zinc/65/45/28/1043654528.db2.gz CBPUUHHKGREITI-UHFFFAOYSA-N 1 2 300.880 4.497 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1cnc2ccsc2c1 ZINC000353931735 1043660129 /nfs/dbraw/zinc/66/01/29/1043660129.db2.gz JRKCMCHJJRSLKE-NXEZZACHSA-N 1 2 319.380 4.381 20 0 DIADLO COCc1nc(C[N@@H+]2CC[C@H](C)[C@H]2c2cccc(F)c2)cs1 ZINC000353969921 1043667281 /nfs/dbraw/zinc/66/72/81/1043667281.db2.gz AFRGSGBBPUAHRN-SJCJKPOMSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@H+]2CC[C@H](C)[C@H]2c2cccc(F)c2)cs1 ZINC000353969921 1043667287 /nfs/dbraw/zinc/66/72/87/1043667287.db2.gz AFRGSGBBPUAHRN-SJCJKPOMSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@@H+]2CC[C@@H](C)[C@@H]2c2cccc(F)c2)cs1 ZINC000353969922 1043667588 /nfs/dbraw/zinc/66/75/88/1043667588.db2.gz AFRGSGBBPUAHRN-SJKOYZFVSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@H+]2CC[C@@H](C)[C@@H]2c2cccc(F)c2)cs1 ZINC000353969922 1043667593 /nfs/dbraw/zinc/66/75/93/1043667593.db2.gz AFRGSGBBPUAHRN-SJKOYZFVSA-N 1 2 320.433 4.012 20 0 DIADLO FC1(F)C[C@@]2(CCN(c3[nH+]ccc4ccccc43)C2)C1(F)F ZINC000895385073 1043668912 /nfs/dbraw/zinc/66/89/12/1043668912.db2.gz DZYBECGUPMUAOZ-CQSZACIVSA-N 1 2 310.294 4.106 20 0 DIADLO Cn1nc(C[NH2+]C2c3ccccc3-c3ccccc32)cc1C1CC1 ZINC000927107693 1043688963 /nfs/dbraw/zinc/68/89/63/1043688963.db2.gz IIMIZLYWMQMFJB-UHFFFAOYSA-N 1 2 315.420 4.157 20 0 DIADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2nnc(-c3ccccc3)o2)c1 ZINC000052455602 1043690067 /nfs/dbraw/zinc/69/00/67/1043690067.db2.gz XONWETNYZNXPBF-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2nnc(-c3ccccc3)o2)c1 ZINC000052455602 1043690071 /nfs/dbraw/zinc/69/00/71/1043690071.db2.gz XONWETNYZNXPBF-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C/C=C/c3ccc(F)cc3)cc2[nH+]1 ZINC000354326223 1043695380 /nfs/dbraw/zinc/69/53/80/1043695380.db2.gz CDZNYJBCIXIZTJ-NSCUHMNNSA-N 1 2 309.344 4.052 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cc(Cl)cc2c1OCC2)c1nccs1 ZINC000927139094 1043696978 /nfs/dbraw/zinc/69/69/78/1043696978.db2.gz GATYUDDCGZWQJM-UWVGGRQHSA-N 1 2 308.834 4.143 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@H](C)c2cc(Cl)cc3c2OCC3)n1 ZINC000927140394 1043698061 /nfs/dbraw/zinc/69/80/61/1043698061.db2.gz NQXGEQYKGZYZEB-MNOVXSKESA-N 1 2 322.861 4.452 20 0 DIADLO COCC[N@H+](Cc1nc(Cl)cs1)[C@H](C)c1ccccc1 ZINC000876599967 1043700264 /nfs/dbraw/zinc/70/02/64/1043700264.db2.gz BQHLFCOXTHVPRR-GFCCVEGCSA-N 1 2 310.850 4.006 20 0 DIADLO COCC[N@@H+](Cc1nc(Cl)cs1)[C@H](C)c1ccccc1 ZINC000876599967 1043700281 /nfs/dbraw/zinc/70/02/81/1043700281.db2.gz BQHLFCOXTHVPRR-GFCCVEGCSA-N 1 2 310.850 4.006 20 0 DIADLO CC(C)c1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)s1 ZINC000354467055 1043701121 /nfs/dbraw/zinc/70/11/21/1043701121.db2.gz KDDPULJLQSKSIV-UHFFFAOYSA-N 1 2 311.410 4.310 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)[C@H]2C=CCCCCC2)n1 ZINC000559113656 1043701664 /nfs/dbraw/zinc/70/16/64/1043701664.db2.gz XBYZSPUUOHRQDS-KGLIPLIRSA-N 1 2 309.479 4.204 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)[C@H]2C=CCCCCC2)n1 ZINC000559113656 1043701668 /nfs/dbraw/zinc/70/16/68/1043701668.db2.gz XBYZSPUUOHRQDS-KGLIPLIRSA-N 1 2 309.479 4.204 20 0 DIADLO Clc1cncc(Cl)c1C[NH+]1CCC(c2ccccn2)CC1 ZINC000876636063 1043703149 /nfs/dbraw/zinc/70/31/49/1043703149.db2.gz BCFPVIQMBDQMJH-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO C[N@H+](CCc1cccc(Cl)c1)Cc1ncc(Cl)s1 ZINC001137110019 1043706606 /nfs/dbraw/zinc/70/66/06/1043706606.db2.gz GRXHFJBEROMFOT-UHFFFAOYSA-N 1 2 301.242 4.124 20 0 DIADLO C[N@@H+](CCc1cccc(Cl)c1)Cc1ncc(Cl)s1 ZINC001137110019 1043706617 /nfs/dbraw/zinc/70/66/17/1043706617.db2.gz GRXHFJBEROMFOT-UHFFFAOYSA-N 1 2 301.242 4.124 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2ccc(Cl)nn2)o1 ZINC000876797492 1043710219 /nfs/dbraw/zinc/71/02/19/1043710219.db2.gz RDJKEVOIPDVPTN-SMDDNHRTSA-N 1 2 305.809 4.005 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2ccc(Cl)nn2)o1 ZINC000876797492 1043710228 /nfs/dbraw/zinc/71/02/28/1043710228.db2.gz RDJKEVOIPDVPTN-SMDDNHRTSA-N 1 2 305.809 4.005 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2ccc(Cl)nn2)o1 ZINC000876797490 1043711049 /nfs/dbraw/zinc/71/10/49/1043711049.db2.gz RDJKEVOIPDVPTN-FZMZJTMJSA-N 1 2 305.809 4.005 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2ccc(Cl)nn2)o1 ZINC000876797490 1043711061 /nfs/dbraw/zinc/71/10/61/1043711061.db2.gz RDJKEVOIPDVPTN-FZMZJTMJSA-N 1 2 305.809 4.005 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)c1ccc(C2=CCCC2)cc1 ZINC000354638580 1043713017 /nfs/dbraw/zinc/71/30/17/1043713017.db2.gz KMLSELSNUIUTOU-UHFFFAOYSA-N 1 2 303.365 4.154 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)Nc1ccc([NH+](C)C)cc1C ZINC000876817601 1043713865 /nfs/dbraw/zinc/71/38/65/1043713865.db2.gz CGCYRYGKFXETRR-QKKBWIMNSA-N 1 2 312.394 4.196 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)[NH2+]c1ccc(N(C)C)cc1C ZINC000876817601 1043713875 /nfs/dbraw/zinc/71/38/75/1043713875.db2.gz CGCYRYGKFXETRR-QKKBWIMNSA-N 1 2 312.394 4.196 20 0 DIADLO CC(C)c1cc(NCc2cc(C(F)F)on2)nc(C(C)C)[nH+]1 ZINC000895605233 1043713770 /nfs/dbraw/zinc/71/37/70/1043713770.db2.gz LDFYBOBFGJCOSD-UHFFFAOYSA-N 1 2 310.348 4.261 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccc(-c3cnc(C)o3)cc2)c1C ZINC000876841375 1043717116 /nfs/dbraw/zinc/71/71/16/1043717116.db2.gz QJZROKAKTMOSHV-UHFFFAOYSA-N 1 2 323.396 4.283 20 0 DIADLO CCO[P@@](C)(=O)CC[C@H](C)[NH2+]c1ccc(N(C)C)c(C)c1 ZINC000876845306 1043717737 /nfs/dbraw/zinc/71/77/37/1043717737.db2.gz QONSVOJSEMATBO-LHSJRXKWSA-N 1 2 312.394 4.196 20 0 DIADLO CCO[P@@](C)(=O)CC[C@H](C)Nc1ccc([NH+](C)C)c(C)c1 ZINC000876845306 1043717745 /nfs/dbraw/zinc/71/77/45/1043717745.db2.gz QONSVOJSEMATBO-LHSJRXKWSA-N 1 2 312.394 4.196 20 0 DIADLO COc1cccc2c(NCc3cc(C(F)F)on3)c(C)c[nH+]c12 ZINC000895606543 1043717730 /nfs/dbraw/zinc/71/77/30/1043717730.db2.gz XUFQNMCJAPZCMO-UHFFFAOYSA-N 1 2 319.311 4.090 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccc(C)c(-c3ncco3)c2)c1C ZINC000876868446 1043719678 /nfs/dbraw/zinc/71/96/78/1043719678.db2.gz DAKPWSCSTRERPP-UHFFFAOYSA-N 1 2 323.396 4.283 20 0 DIADLO Fc1cccc2c1SCC[C@H]2[NH2+]Cc1nc(Cl)cs1 ZINC000876911512 1043722838 /nfs/dbraw/zinc/72/28/38/1043722838.db2.gz FYALHLNCIQOJJQ-SNVBAGLBSA-N 1 2 314.838 4.262 20 0 DIADLO COc1cc([C@H](C)Nc2ccc([NH+](C)C)c(C)c2)ccc1F ZINC000777643581 1043725099 /nfs/dbraw/zinc/72/50/99/1043725099.db2.gz PVQMLDSJTGWOAV-ZDUSSCGKSA-N 1 2 302.393 4.382 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc3c(c2)CCC(=O)N3)ccc1[NH+](C)C ZINC000777643626 1043725273 /nfs/dbraw/zinc/72/52/73/1043725273.db2.gz RYYXRDMNYUUUKJ-CQSZACIVSA-N 1 2 323.440 4.119 20 0 DIADLO Clc1csc(C[NH2+][C@H]2CCOc3c(Cl)cccc32)n1 ZINC000876964934 1043727825 /nfs/dbraw/zinc/72/78/25/1043727825.db2.gz VRYNBQCTFSSWDE-JTQLQIEISA-N 1 2 315.225 4.063 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccnc(Cl)c1 ZINC000777658482 1043730144 /nfs/dbraw/zinc/73/01/44/1043730144.db2.gz ZCBDXGBOAMHENX-GFCCVEGCSA-N 1 2 301.821 4.291 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccnc(Cl)c1 ZINC000777658482 1043730154 /nfs/dbraw/zinc/73/01/54/1043730154.db2.gz ZCBDXGBOAMHENX-GFCCVEGCSA-N 1 2 301.821 4.291 20 0 DIADLO C[C@H]([NH2+]c1ccc(N2CCCC2)c(Cl)c1)C1CCOCC1 ZINC000777660573 1043730348 /nfs/dbraw/zinc/73/03/48/1043730348.db2.gz PZVQEZBVOAKSKD-ZDUSSCGKSA-N 1 2 308.853 4.167 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2cc3c(ccnc3Cl)o2)cs1 ZINC000877045631 1043737967 /nfs/dbraw/zinc/73/79/67/1043737967.db2.gz DCXPMHCITRIMGU-SECBINFHSA-N 1 2 321.833 4.351 20 0 DIADLO CC(C)(C)c1ccc([C@H]2CCC[N@@H+]2Cc2nnc(C3CC3)[nH]2)cc1 ZINC000355028004 1043739059 /nfs/dbraw/zinc/73/90/59/1043739059.db2.gz FQEXOYHHKJJTPF-QGZVFWFLSA-N 1 2 324.472 4.317 20 0 DIADLO CC(C)(C)c1ccc([C@H]2CCC[N@H+]2Cc2nnc(C3CC3)[nH]2)cc1 ZINC000355028004 1043739081 /nfs/dbraw/zinc/73/90/81/1043739081.db2.gz FQEXOYHHKJJTPF-QGZVFWFLSA-N 1 2 324.472 4.317 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](C)Cc2cc(C)ccc2C)cs1 ZINC000355141264 1043746604 /nfs/dbraw/zinc/74/66/04/1043746604.db2.gz XHBHJEKPTUVAHP-CQSZACIVSA-N 1 2 304.459 4.099 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](C)Cc2cc(C)ccc2C)cs1 ZINC000355141264 1043746617 /nfs/dbraw/zinc/74/66/17/1043746617.db2.gz XHBHJEKPTUVAHP-CQSZACIVSA-N 1 2 304.459 4.099 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1csc([C@@H](C)OC)n1 ZINC000474365538 1043752544 /nfs/dbraw/zinc/75/25/44/1043752544.db2.gz KGDDYWVIKGVZBA-LLVKDONJSA-N 1 2 324.877 4.356 20 0 DIADLO CC(C)=CCC[C@H](C)[NH2+]c1ccc(N2CCOC[C@@H]2C)cc1 ZINC000777691819 1043755383 /nfs/dbraw/zinc/75/53/83/1043755383.db2.gz GHEFNQFCPWNVJZ-IRXDYDNUSA-N 1 2 302.462 4.459 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000355333736 1043761504 /nfs/dbraw/zinc/76/15/04/1043761504.db2.gz HUMONEIELDRPGA-UHFFFAOYSA-N 1 2 323.444 4.053 20 0 DIADLO CC(C)CCn1cccc1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000355326826 1043762362 /nfs/dbraw/zinc/76/23/62/1043762362.db2.gz XCICPCXNXVSZCE-UHFFFAOYSA-N 1 2 308.429 4.332 20 0 DIADLO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1nc(Cl)cs1 ZINC000877464404 1043763968 /nfs/dbraw/zinc/76/39/68/1043763968.db2.gz LRBDMGXJYINVNN-UHFFFAOYSA-N 1 2 305.834 4.300 20 0 DIADLO CC[N@H+](Cc1c[nH]c2ccccc12)Cc1nc(Cl)cs1 ZINC000877464404 1043763975 /nfs/dbraw/zinc/76/39/75/1043763975.db2.gz LRBDMGXJYINVNN-UHFFFAOYSA-N 1 2 305.834 4.300 20 0 DIADLO CCc1ccc(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)o1 ZINC000355550488 1043775148 /nfs/dbraw/zinc/77/51/48/1043775148.db2.gz ABDRSGMLKZKPOU-UHFFFAOYSA-N 1 2 301.777 4.293 20 0 DIADLO CCC[N@H+](Cc1nnc(CC)o1)[C@H](C)c1cc2ccccc2o1 ZINC000053728489 1043778605 /nfs/dbraw/zinc/77/86/05/1043778605.db2.gz QMIUATYJRLGJHM-CYBMUJFWSA-N 1 2 313.401 4.351 20 0 DIADLO CCC[N@@H+](Cc1nnc(CC)o1)[C@H](C)c1cc2ccccc2o1 ZINC000053728489 1043778610 /nfs/dbraw/zinc/77/86/10/1043778610.db2.gz QMIUATYJRLGJHM-CYBMUJFWSA-N 1 2 313.401 4.351 20 0 DIADLO Cc1nnsc1[C@@H](C)[N@H+](C)Cc1ccccc1C(F)(F)F ZINC000929166774 1043796168 /nfs/dbraw/zinc/79/61/68/1043796168.db2.gz VPPPRYWCFJMCJY-SNVBAGLBSA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nnsc1[C@@H](C)[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC000929166774 1043796181 /nfs/dbraw/zinc/79/61/81/1043796181.db2.gz VPPPRYWCFJMCJY-SNVBAGLBSA-N 1 2 315.364 4.058 20 0 DIADLO CC(C)c1cc([C@H]2CCC[N@H+](Cc3nc(Cl)cs3)C2)[nH]n1 ZINC000877783884 1043796188 /nfs/dbraw/zinc/79/61/88/1043796188.db2.gz JNHIJKJQAKCLPN-NSHDSACASA-N 1 2 324.881 4.023 20 0 DIADLO CC(C)c1cc([C@H]2CCC[N@@H+](Cc3nc(Cl)cs3)C2)[nH]n1 ZINC000877783884 1043796197 /nfs/dbraw/zinc/79/61/97/1043796197.db2.gz JNHIJKJQAKCLPN-NSHDSACASA-N 1 2 324.881 4.023 20 0 DIADLO Cc1cc(C)c(NC(=O)CCOc2ccc(C)c(C)c2)c(C)[nH+]1 ZINC000097214162 1043797957 /nfs/dbraw/zinc/79/79/57/1043797957.db2.gz SZMOLYZOTRGZJM-UHFFFAOYSA-N 1 2 312.413 4.031 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(Cl)cs1)c1ccc(C(F)(F)F)nc1 ZINC000877827564 1043803340 /nfs/dbraw/zinc/80/33/40/1043803340.db2.gz BPYFKZWXLBGTJV-SSDOTTSWSA-N 1 2 321.755 4.061 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)SCc2ccccc2)c(C)[nH+]1 ZINC000097403306 1043808612 /nfs/dbraw/zinc/80/86/12/1043808612.db2.gz MKSGXQAVMCXKKP-HNNXBMFYSA-N 1 2 314.454 4.267 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1nccn1CC(F)F ZINC000877892483 1043816609 /nfs/dbraw/zinc/81/66/09/1043816609.db2.gz YMDUOWZWQVCJEP-GFCCVEGCSA-N 1 2 319.355 4.087 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nccn1CC(F)F ZINC000877892483 1043816624 /nfs/dbraw/zinc/81/66/24/1043816624.db2.gz YMDUOWZWQVCJEP-GFCCVEGCSA-N 1 2 319.355 4.087 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)c[nH+]1)C1CCSCC1 ZINC000474595377 1043841075 /nfs/dbraw/zinc/84/10/75/1043841075.db2.gz AWYKDIDFFQHHNX-AWEZNQCLSA-N 1 2 305.491 4.016 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1c(C)cccc1Cl ZINC000878036568 1043843540 /nfs/dbraw/zinc/84/35/40/1043843540.db2.gz NVAIKTCQXSOYAA-ZDUSSCGKSA-N 1 2 320.820 4.091 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1c(C)cccc1Cl ZINC000878036568 1043843558 /nfs/dbraw/zinc/84/35/58/1043843558.db2.gz NVAIKTCQXSOYAA-ZDUSSCGKSA-N 1 2 320.820 4.091 20 0 DIADLO C[C@@H](c1ccsc1)c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000356597620 1043850693 /nfs/dbraw/zinc/85/06/93/1043850693.db2.gz NIEGMVNFBQKHGL-LBPRGKRZSA-N 1 2 322.393 4.136 20 0 DIADLO CC(C)c1nsc(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)n1 ZINC000929966883 1043860025 /nfs/dbraw/zinc/86/00/25/1043860025.db2.gz KZTBZAONWCNFOT-UHFFFAOYSA-N 1 2 321.877 4.484 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@@H]2c2ccncc2)s1 ZINC000289660171 1043860754 /nfs/dbraw/zinc/86/07/54/1043860754.db2.gz CTHYEKOBZDMDFK-CQSZACIVSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@@H]2c2ccncc2)s1 ZINC000289660171 1043860773 /nfs/dbraw/zinc/86/07/73/1043860773.db2.gz CTHYEKOBZDMDFK-CQSZACIVSA-N 1 2 301.459 4.173 20 0 DIADLO CC1(C)CCc2onc(C[NH2+]C3(c4ccc(F)cc4)CC3)c2C1 ZINC000878239477 1043862909 /nfs/dbraw/zinc/86/29/09/1043862909.db2.gz HMROULDJBPSZIT-UHFFFAOYSA-N 1 2 314.404 4.108 20 0 DIADLO Cc1ccc(C[NH2+]C2(c3nccs3)CCCC2)nc1Cl ZINC000878261667 1043866060 /nfs/dbraw/zinc/86/60/60/1043866060.db2.gz LFHRGXIVZPFJGC-UHFFFAOYSA-N 1 2 307.850 4.059 20 0 DIADLO C[C@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccc(OC(F)F)cc1 ZINC000878351964 1043876770 /nfs/dbraw/zinc/87/67/70/1043876770.db2.gz XBGNXYJWLOAOJE-NSHDSACASA-N 1 2 322.355 4.006 20 0 DIADLO Cc1conc1C[NH2+][C@H](C)c1ccccc1OCc1ccccc1 ZINC000878354697 1043877304 /nfs/dbraw/zinc/87/73/04/1043877304.db2.gz BHEBMWYEXPNXIJ-MRXNPFEDSA-N 1 2 322.408 4.413 20 0 DIADLO C[C@@H]([NH2+]Cc1scnc1Cl)c1c(F)cccc1Cl ZINC000878372075 1043879511 /nfs/dbraw/zinc/87/95/11/1043879511.db2.gz ZSDYDAZUFYGHLK-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2cc(C(F)(F)F)co2)C2CC2)n1 ZINC000878378613 1043883575 /nfs/dbraw/zinc/88/35/75/1043883575.db2.gz OOOASEJTCAWFJP-LBPRGKRZSA-N 1 2 316.348 4.304 20 0 DIADLO CC[C@@H]([NH2+]Cc1noc2c1CC(C)(C)CC2)c1c(C)noc1C ZINC000878414504 1043886305 /nfs/dbraw/zinc/88/63/05/1043886305.db2.gz QXOQMGRIIZFRNC-CQSZACIVSA-N 1 2 317.433 4.035 20 0 DIADLO C[C@H]1CCC[N@@H+]1Cc1c(Cl)ccc(Br)c1F ZINC001141887292 1043887409 /nfs/dbraw/zinc/88/74/09/1043887409.db2.gz BLORMHORGQOYPJ-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@H]1CCC[N@H+]1Cc1c(Cl)ccc(Br)c1F ZINC001141887292 1043887432 /nfs/dbraw/zinc/88/74/32/1043887432.db2.gz BLORMHORGQOYPJ-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO C[NH+](C)C1(c2nc(C(C)(C)c3cccc4ccccc43)no2)CC1 ZINC000896327965 1043891932 /nfs/dbraw/zinc/89/19/32/1043891932.db2.gz IXJSLEGDJCLWPR-UHFFFAOYSA-N 1 2 321.424 4.099 20 0 DIADLO CCC[N@@H+](Cc1ccccc1)Cn1nc(C(C)(C)C)[nH]c1=S ZINC000022756940 1043897856 /nfs/dbraw/zinc/89/78/56/1043897856.db2.gz UIIRRDMQSOTKOU-UHFFFAOYSA-N 1 2 318.490 4.108 20 0 DIADLO CCC[N@H+](Cc1ccccc1)Cn1nc(C(C)(C)C)[nH]c1=S ZINC000022756940 1043897869 /nfs/dbraw/zinc/89/78/69/1043897869.db2.gz UIIRRDMQSOTKOU-UHFFFAOYSA-N 1 2 318.490 4.108 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1nc(C)c(C(C)(C)C)s1 ZINC000930223590 1043898356 /nfs/dbraw/zinc/89/83/56/1043898356.db2.gz VHDNXIJVXNBFOJ-VIFPVBQESA-N 1 2 307.463 4.205 20 0 DIADLO CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000426107486 1043901559 /nfs/dbraw/zinc/90/15/59/1043901559.db2.gz YPMDUANFZIYKKD-CJNGLKHVSA-N 1 2 314.433 4.075 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+]Cc1nc2c(o1)CCCC2 ZINC000878556111 1043902761 /nfs/dbraw/zinc/90/27/61/1043902761.db2.gz BLOVMILQWLPBGQ-GFCCVEGCSA-N 1 2 302.443 4.126 20 0 DIADLO CSc1ccc([C@H](C)[NH2+]Cc2nc3c(o2)CCCC3)cc1 ZINC000878549059 1043902819 /nfs/dbraw/zinc/90/28/19/1043902819.db2.gz DNYBLIUSKJHNKW-LBPRGKRZSA-N 1 2 302.443 4.126 20 0 DIADLO COc1ccccc1[C@@H](CC(C)C)[NH2+][C@H](C)c1cc(C)on1 ZINC000290035780 1043912315 /nfs/dbraw/zinc/91/23/15/1043912315.db2.gz BEUFQHXIEDBNQD-RHSMWYFYSA-N 1 2 302.418 4.430 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2cc3cc(C)c(C)cc3o2)s1 ZINC000290257501 1043933513 /nfs/dbraw/zinc/93/35/13/1043933513.db2.gz UUJGCMZABCVPCU-GFCCVEGCSA-N 1 2 315.442 4.314 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC000290368285 1043945659 /nfs/dbraw/zinc/94/56/59/1043945659.db2.gz HGWHDCBFVKNRFE-SFHVURJKSA-N 1 2 306.413 4.055 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC000290368285 1043945667 /nfs/dbraw/zinc/94/56/67/1043945667.db2.gz HGWHDCBFVKNRFE-SFHVURJKSA-N 1 2 306.413 4.055 20 0 DIADLO CC[N@H+](Cc1csc(-c2ccccn2)n1)[C@@H](C)c1cccnc1 ZINC000290420055 1043950039 /nfs/dbraw/zinc/95/00/39/1043950039.db2.gz KRKKUWUCJXCAGZ-AWEZNQCLSA-N 1 2 324.453 4.183 20 0 DIADLO CC[N@@H+](Cc1csc(-c2ccccn2)n1)[C@@H](C)c1cccnc1 ZINC000290420055 1043950045 /nfs/dbraw/zinc/95/00/45/1043950045.db2.gz KRKKUWUCJXCAGZ-AWEZNQCLSA-N 1 2 324.453 4.183 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)c2c(F)cccc2F)c(C)[nH+]1 ZINC000179232021 1043950490 /nfs/dbraw/zinc/95/04/90/1043950490.db2.gz FGKXEZFVFWVDDV-NSHDSACASA-N 1 2 304.340 4.027 20 0 DIADLO Cc1cc(NCc2ccn3cc[nH+]c3c2)c2ccc(F)c(F)c2n1 ZINC000357430368 1043950740 /nfs/dbraw/zinc/95/07/40/1043950740.db2.gz AMCMYZZSBUPFSQ-UHFFFAOYSA-N 1 2 324.334 4.081 20 0 DIADLO Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC000290575074 1043964135 /nfs/dbraw/zinc/96/41/35/1043964135.db2.gz FNCKQJIMWWKKEX-KRWDZBQOSA-N 1 2 320.396 4.012 20 0 DIADLO Cc1ccc(-n2cc[nH+]c2)c(C(=O)Nc2ccc(Cl)cc2)c1 ZINC000357600537 1043966302 /nfs/dbraw/zinc/96/63/02/1043966302.db2.gz RYKGJMWSTZKLER-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1ccc(C2([NH2+]Cc3nc(C(C)C)ns3)CCC2)cc1 ZINC000930824579 1043968765 /nfs/dbraw/zinc/96/87/65/1043968765.db2.gz DVOAGSXZZKDMTG-UHFFFAOYSA-N 1 2 301.459 4.139 20 0 DIADLO Cc1nc(C[N@@H+]2CCSC[C@@H]2c2ccc(C)cc2)sc1C ZINC000357704336 1043976061 /nfs/dbraw/zinc/97/60/61/1043976061.db2.gz GUEFBLAJRGBHHJ-MRXNPFEDSA-N 1 2 318.511 4.358 20 0 DIADLO Cc1nc(C[N@H+]2CCSC[C@@H]2c2ccc(C)cc2)sc1C ZINC000357704336 1043976071 /nfs/dbraw/zinc/97/60/71/1043976071.db2.gz GUEFBLAJRGBHHJ-MRXNPFEDSA-N 1 2 318.511 4.358 20 0 DIADLO CC(F)(F)CCC[N@@H+]1CCC[C@@H]1c1nccc(C(F)(F)F)n1 ZINC000930970601 1043978413 /nfs/dbraw/zinc/97/84/13/1043978413.db2.gz DNLHWZOHSWDCNG-SNVBAGLBSA-N 1 2 323.309 4.068 20 0 DIADLO CC(F)(F)CCC[N@H+]1CCC[C@@H]1c1nccc(C(F)(F)F)n1 ZINC000930970601 1043978422 /nfs/dbraw/zinc/97/84/22/1043978422.db2.gz DNLHWZOHSWDCNG-SNVBAGLBSA-N 1 2 323.309 4.068 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+](C)Cc2ccc3cc[nH]c3c2)n1 ZINC000879728378 1043983950 /nfs/dbraw/zinc/98/39/50/1043983950.db2.gz ROLRJRQQDWCTOM-CYBMUJFWSA-N 1 2 312.417 4.087 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+](C)Cc2ccc3cc[nH]c3c2)n1 ZINC000879728378 1043983963 /nfs/dbraw/zinc/98/39/63/1043983963.db2.gz ROLRJRQQDWCTOM-CYBMUJFWSA-N 1 2 312.417 4.087 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2nccc3ccccc32)[nH]1 ZINC000290790171 1043984936 /nfs/dbraw/zinc/98/49/36/1043984936.db2.gz UPFBDDQUVFENAM-MJBXVCDLSA-N 1 2 323.444 4.278 20 0 DIADLO Cc1cncc([C@H]2CCC[N@@H+]2Cc2ccn(C3CCCC3)n2)c1 ZINC000879750251 1043986133 /nfs/dbraw/zinc/98/61/33/1043986133.db2.gz OSTJRQDLCAEFIL-LJQANCHMSA-N 1 2 310.445 4.039 20 0 DIADLO Cc1cncc([C@H]2CCC[N@H+]2Cc2ccn(C3CCCC3)n2)c1 ZINC000879750251 1043986148 /nfs/dbraw/zinc/98/61/48/1043986148.db2.gz OSTJRQDLCAEFIL-LJQANCHMSA-N 1 2 310.445 4.039 20 0 DIADLO CCCc1nc(C[N@@H+]2CCC[C@@H]2c2cncc(C)c2)cs1 ZINC000879749051 1043987722 /nfs/dbraw/zinc/98/77/22/1043987722.db2.gz SRJCBQSXKBFTLD-MRXNPFEDSA-N 1 2 301.459 4.136 20 0 DIADLO CCCc1nc(C[N@H+]2CCC[C@@H]2c2cncc(C)c2)cs1 ZINC000879749051 1043987736 /nfs/dbraw/zinc/98/77/36/1043987736.db2.gz SRJCBQSXKBFTLD-MRXNPFEDSA-N 1 2 301.459 4.136 20 0 DIADLO Cc1cncc([C@H]2CCC[N@@H+]2Cc2ncccc2C(F)(F)F)c1 ZINC000879752757 1043990052 /nfs/dbraw/zinc/99/00/52/1043990052.db2.gz WEZZLGCXQAKKBJ-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cncc([C@H]2CCC[N@H+]2Cc2ncccc2C(F)(F)F)c1 ZINC000879752757 1043990063 /nfs/dbraw/zinc/99/00/63/1043990063.db2.gz WEZZLGCXQAKKBJ-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO C[C@@H]([C@H](C)[NH2+][C@@H](c1nnc[nH]1)c1ccccc1)C1CCCCC1 ZINC000474937964 1043991613 /nfs/dbraw/zinc/99/16/13/1043991613.db2.gz CBWMCQMOFCHQOL-RLFYNMQTSA-N 1 2 312.461 4.089 20 0 DIADLO Fc1cc(C[N@@H+]2CC3CCC2CC3)c(F)cc1Br ZINC001141915597 1044015168 /nfs/dbraw/zinc/01/51/68/1044015168.db2.gz IOWHHRJODTWXAH-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(C[N@H+]2CC3CCC2CC3)c(F)cc1Br ZINC001141915597 1044015174 /nfs/dbraw/zinc/01/51/74/1044015174.db2.gz IOWHHRJODTWXAH-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Cn1ccnc1C[N@H+]1CC=C(c2ccc(Cl)c(Cl)c2)CC1 ZINC000358072909 1044016071 /nfs/dbraw/zinc/01/60/71/1044016071.db2.gz KZEAHTWZIIOEIE-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1ccnc1C[N@@H+]1CC=C(c2ccc(Cl)c(Cl)c2)CC1 ZINC000358072909 1044016082 /nfs/dbraw/zinc/01/60/82/1044016082.db2.gz KZEAHTWZIIOEIE-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc3ccccc23)C[C@H](C(F)(F)F)O1 ZINC000608750527 1044027761 /nfs/dbraw/zinc/02/77/61/1044027761.db2.gz RUPUXMNHMNXZNW-QMTHXVAHSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc3ccccc23)C[C@H](C(F)(F)F)O1 ZINC000608750527 1044027776 /nfs/dbraw/zinc/02/77/76/1044027776.db2.gz RUPUXMNHMNXZNW-QMTHXVAHSA-N 1 2 315.360 4.053 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc(C4CC4)oc3C3CC3)ccc2[nH+]1 ZINC000931467092 1044030539 /nfs/dbraw/zinc/03/05/39/1044030539.db2.gz HGMDQCYELMOBJA-UHFFFAOYSA-N 1 2 321.380 4.243 20 0 DIADLO Fc1ccccc1C[NH2+]Cc1c(F)cccc1Br ZINC000192451850 1044032361 /nfs/dbraw/zinc/03/23/61/1044032361.db2.gz DIYHDXZEOIRUHO-UHFFFAOYSA-N 1 2 312.157 4.017 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCO[C@@H](c3ccccc3)C2)cc1F ZINC000561945964 1044033541 /nfs/dbraw/zinc/03/35/41/1044033541.db2.gz ZVWGIMXEJYKZSG-VZSQWMKGSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCO[C@@H](c3ccccc3)C2)cc1F ZINC000561945964 1044033556 /nfs/dbraw/zinc/03/35/56/1044033556.db2.gz ZVWGIMXEJYKZSG-VZSQWMKGSA-N 1 2 315.363 4.052 20 0 DIADLO CC[N@H+](Cc1nc([C@@H](c2cccc(C)c2)C(C)C)no1)C1CC1 ZINC000561943315 1044034624 /nfs/dbraw/zinc/03/46/24/1044034624.db2.gz PZVXCEDHOIULJC-GOSISDBHSA-N 1 2 313.445 4.150 20 0 DIADLO CC[N@@H+](Cc1nc([C@@H](c2cccc(C)c2)C(C)C)no1)C1CC1 ZINC000561943315 1044034639 /nfs/dbraw/zinc/03/46/39/1044034639.db2.gz PZVXCEDHOIULJC-GOSISDBHSA-N 1 2 313.445 4.150 20 0 DIADLO COC(=O)c1ccccc1C[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000561961806 1044037252 /nfs/dbraw/zinc/03/72/52/1044037252.db2.gz OAWFHBIXFAKRPX-MRXNPFEDSA-N 1 2 315.438 4.118 20 0 DIADLO COC(=O)c1ccccc1C[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000561961806 1044037269 /nfs/dbraw/zinc/03/72/69/1044037269.db2.gz OAWFHBIXFAKRPX-MRXNPFEDSA-N 1 2 315.438 4.118 20 0 DIADLO Cc1cccc(NC(=O)C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)c1 ZINC000561962526 1044039628 /nfs/dbraw/zinc/03/96/28/1044039628.db2.gz ANTCXNNOTJVURK-KRWDZBQOSA-N 1 2 314.454 4.078 20 0 DIADLO Cc1cccc(NC(=O)C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)c1 ZINC000561962526 1044039646 /nfs/dbraw/zinc/03/96/46/1044039646.db2.gz ANTCXNNOTJVURK-KRWDZBQOSA-N 1 2 314.454 4.078 20 0 DIADLO CCn1c(C[N@H+](CC)[C@@H](C)c2cccnc2)nc2ccccc21 ZINC000561984431 1044044109 /nfs/dbraw/zinc/04/41/09/1044044109.db2.gz YUGLMAJZXUIFGE-HNNXBMFYSA-N 1 2 308.429 4.034 20 0 DIADLO CCn1c(C[N@@H+](CC)[C@@H](C)c2cccnc2)nc2ccccc21 ZINC000561984431 1044044121 /nfs/dbraw/zinc/04/41/21/1044044121.db2.gz YUGLMAJZXUIFGE-HNNXBMFYSA-N 1 2 308.429 4.034 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc(F)c(C(F)F)c2)cc(C)[nH+]1 ZINC000880691559 1044059410 /nfs/dbraw/zinc/05/94/10/1044059410.db2.gz QDMNEHUFTYFJLY-UHFFFAOYSA-N 1 2 323.318 4.097 20 0 DIADLO CC[C@@H](C)CN(CC)C(=O)C[N@H+](CC)Cc1ccccc1Cl ZINC001137158744 1044060332 /nfs/dbraw/zinc/06/03/32/1044060332.db2.gz GCDLGBAGZPWUPC-OAHLLOKOSA-N 1 2 324.896 4.057 20 0 DIADLO CC[C@@H](C)CN(CC)C(=O)C[N@@H+](CC)Cc1ccccc1Cl ZINC001137158744 1044060347 /nfs/dbraw/zinc/06/03/47/1044060347.db2.gz GCDLGBAGZPWUPC-OAHLLOKOSA-N 1 2 324.896 4.057 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1csc(-c2ccccc2F)n1)c1cn[nH]c1 ZINC000291383508 1044068479 /nfs/dbraw/zinc/06/84/79/1044068479.db2.gz ZPVHCWLVTDSVKC-QWRGUYRKSA-N 1 2 316.405 4.084 20 0 DIADLO Cc1csc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)c1Cl ZINC000358490281 1044077048 /nfs/dbraw/zinc/07/70/48/1044077048.db2.gz ABROTGQHJLQGPW-UHFFFAOYSA-N 1 2 317.801 4.148 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2ccc3c(c2)COC3)c1C ZINC000778044709 1044082268 /nfs/dbraw/zinc/08/22/68/1044082268.db2.gz IAIHJQCJVFHQEV-UHFFFAOYSA-N 1 2 315.438 4.171 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(F)cc(C(F)(F)F)c2)CCC1(F)F ZINC000562206540 1044084784 /nfs/dbraw/zinc/08/47/84/1044084784.db2.gz FLQVGYOLHKEMJK-VIFPVBQESA-N 1 2 311.269 4.322 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(F)cc(C(F)(F)F)c2)CCC1(F)F ZINC000562206540 1044084799 /nfs/dbraw/zinc/08/47/99/1044084799.db2.gz FLQVGYOLHKEMJK-VIFPVBQESA-N 1 2 311.269 4.322 20 0 DIADLO c1cc2c(s1)CCC[C@H]2[NH2+][C@@H](c1nnc[nH]1)C1CCCCC1 ZINC000562340373 1044103882 /nfs/dbraw/zinc/10/38/82/1044103882.db2.gz FIUYKRZNCRZMME-GDBMZVCRSA-N 1 2 316.474 4.155 20 0 DIADLO Brc1cnc(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)s1 ZINC000713672981 1044115139 /nfs/dbraw/zinc/11/51/39/1044115139.db2.gz LYAYASSVSVDIFD-WDEREUQCSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1cnc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)s1 ZINC000713672981 1044115144 /nfs/dbraw/zinc/11/51/44/1044115144.db2.gz LYAYASSVSVDIFD-WDEREUQCSA-N 1 2 315.280 4.060 20 0 DIADLO Cc1nnsc1C[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000562479173 1044117951 /nfs/dbraw/zinc/11/79/51/1044117951.db2.gz UVTBBTZDOOTLIA-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO CCOc1ccc(C[N@H+](Cc2nc(C(C)C)no2)C(C)C)cc1 ZINC000346642317 1044126851 /nfs/dbraw/zinc/12/68/51/1044126851.db2.gz NIBKPASETINTNO-UHFFFAOYSA-N 1 2 317.433 4.002 20 0 DIADLO CCOc1ccc(C[N@@H+](Cc2nc(C(C)C)no2)C(C)C)cc1 ZINC000346642317 1044126858 /nfs/dbraw/zinc/12/68/58/1044126858.db2.gz NIBKPASETINTNO-UHFFFAOYSA-N 1 2 317.433 4.002 20 0 DIADLO Brc1cnc(C[NH+]2CCCCCCCC2)s1 ZINC000713686585 1044132090 /nfs/dbraw/zinc/13/20/90/1044132090.db2.gz WZIFETRSLCRJDX-UHFFFAOYSA-N 1 2 303.269 4.062 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@@H](C)c2ccc(F)cc2C)n1 ZINC000932565695 1044143689 /nfs/dbraw/zinc/14/36/89/1044143689.db2.gz VKCCYILSMYIGGG-NWDGAFQWSA-N 1 2 323.437 4.182 20 0 DIADLO CCc1nc(C)c(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)o1 ZINC000292170893 1044145530 /nfs/dbraw/zinc/14/55/30/1044145530.db2.gz DSYDIUKLVPUCTP-UHFFFAOYSA-N 1 2 302.422 4.194 20 0 DIADLO CC[C@](C)([NH2+]Cc1cnc(C(F)(F)F)s1)c1nccs1 ZINC000443982837 1044145710 /nfs/dbraw/zinc/14/57/10/1044145710.db2.gz BQJATRBBCDSUCR-NSHDSACASA-N 1 2 321.393 4.033 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C/C=C\c3cccc(F)c3)cc2[nH+]1 ZINC000359297749 1044151731 /nfs/dbraw/zinc/15/17/31/1044151731.db2.gz FLBJQAMGAMVXIO-HYXAFXHYSA-N 1 2 309.344 4.052 20 0 DIADLO Cc1ccc(C[S@@](=O)Cc2cccc(C(F)F)c2)c(C)[nH+]1 ZINC000359345030 1044157895 /nfs/dbraw/zinc/15/78/95/1044157895.db2.gz YOIZNXXLNYEQFP-NRFANRHFSA-N 1 2 309.381 4.085 20 0 DIADLO CC(C)c1[nH]c2c([nH+]1)CC[C@H](C(=O)Nc1ccc3ccoc3c1)C2 ZINC000562823410 1044161980 /nfs/dbraw/zinc/16/19/80/1044161980.db2.gz MKSCRMFHOXQHSA-ZDUSSCGKSA-N 1 2 323.396 4.023 20 0 DIADLO CC(C)c1[nH]c2c([nH+]1)C[C@@H](C(=O)Nc1ccc3ccoc3c1)CC2 ZINC000562823410 1044161985 /nfs/dbraw/zinc/16/19/85/1044161985.db2.gz MKSCRMFHOXQHSA-ZDUSSCGKSA-N 1 2 323.396 4.023 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3n2C)o1 ZINC000562853065 1044168976 /nfs/dbraw/zinc/16/89/76/1044168976.db2.gz LNVUWOKDDMXZCR-GOSISDBHSA-N 1 2 309.413 4.202 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3n2C)o1 ZINC000562853065 1044168988 /nfs/dbraw/zinc/16/89/88/1044168988.db2.gz LNVUWOKDDMXZCR-GOSISDBHSA-N 1 2 309.413 4.202 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+]2CCC[C@H]2c2cccnc2)n1 ZINC000346977642 1044177754 /nfs/dbraw/zinc/17/77/54/1044177754.db2.gz KIIDYWPXGFQGIB-AWEZNQCLSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1csc(C[N@H+]2CCC[C@H]2c2cccnc2)n1 ZINC000346977642 1044177756 /nfs/dbraw/zinc/17/77/56/1044177756.db2.gz KIIDYWPXGFQGIB-AWEZNQCLSA-N 1 2 301.459 4.173 20 0 DIADLO C[C@@H]1CC[C@@]2(CC[N@H+](Cc3nc(C(F)(F)F)cs3)C2)C1 ZINC000359568939 1044178373 /nfs/dbraw/zinc/17/83/73/1044178373.db2.gz YMIHFYUOGYBNQS-ZWNOBZJWSA-N 1 2 304.381 4.174 20 0 DIADLO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3nc(C(F)(F)F)cs3)C2)C1 ZINC000359568939 1044178379 /nfs/dbraw/zinc/17/83/79/1044178379.db2.gz YMIHFYUOGYBNQS-ZWNOBZJWSA-N 1 2 304.381 4.174 20 0 DIADLO C[C@@H]1CC[C@@]2(CC[N@H+](Cc3noc(C4CCCCC4)n3)C2)C1 ZINC000359570596 1044178756 /nfs/dbraw/zinc/17/87/56/1044178756.db2.gz ZWNDSPKTIZTSQS-RDTXWAMCSA-N 1 2 303.450 4.129 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+]2CCC[C@@H]2c2cccnc2)o1 ZINC000346963876 1044178541 /nfs/dbraw/zinc/17/85/41/1044178541.db2.gz AJZYOXUBTHWWGL-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+]2CCC[C@@H]2c2cccnc2)o1 ZINC000346963876 1044178544 /nfs/dbraw/zinc/17/85/44/1044178544.db2.gz AJZYOXUBTHWWGL-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3noc(C4CCCCC4)n3)C2)C1 ZINC000359570596 1044178764 /nfs/dbraw/zinc/17/87/64/1044178764.db2.gz ZWNDSPKTIZTSQS-RDTXWAMCSA-N 1 2 303.450 4.129 20 0 DIADLO c1csc(-c2cc(C[N@@H+]3CCC[C@H]3c3cccnc3)no2)c1 ZINC000346982534 1044180668 /nfs/dbraw/zinc/18/06/68/1044180668.db2.gz MPAURODNKKBSSS-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2cc(C[N@H+]3CCC[C@H]3c3cccnc3)no2)c1 ZINC000346982534 1044180672 /nfs/dbraw/zinc/18/06/72/1044180672.db2.gz MPAURODNKKBSSS-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO Fc1cccc(-c2nc(C[N@@H+]3CCC[C@@H]3c3cccnc3)co2)c1 ZINC000346984314 1044180875 /nfs/dbraw/zinc/18/08/75/1044180875.db2.gz ONJKEURKEOINJX-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1cccc(-c2nc(C[N@H+]3CCC[C@@H]3c3cccnc3)co2)c1 ZINC000346984314 1044180881 /nfs/dbraw/zinc/18/08/81/1044180881.db2.gz ONJKEURKEOINJX-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO CCC[C@H]1C[N@H+](Cc2ccc(SC(F)F)cc2)CCO1 ZINC000759419530 1044196901 /nfs/dbraw/zinc/19/69/01/1044196901.db2.gz ICQJNMRUHFXBKF-ZDUSSCGKSA-N 1 2 301.402 4.002 20 0 DIADLO CCC[C@H]1C[N@@H+](Cc2ccc(SC(F)F)cc2)CCO1 ZINC000759419530 1044196903 /nfs/dbraw/zinc/19/69/03/1044196903.db2.gz ICQJNMRUHFXBKF-ZDUSSCGKSA-N 1 2 301.402 4.002 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)CCO2)c1ncc(C(C)(C)C)o1 ZINC000933491717 1044199496 /nfs/dbraw/zinc/19/94/96/1044199496.db2.gz RYIDBIJVEYFEAJ-CHWSQXEVSA-N 1 2 314.429 4.319 20 0 DIADLO Fc1ccc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)cn1 ZINC000778177262 1044200316 /nfs/dbraw/zinc/20/03/16/1044200316.db2.gz SVBSYJPJCUUXNK-UHFFFAOYSA-N 1 2 311.187 4.306 20 0 DIADLO COCc1cnc(C[NH2+][C@H](C)c2oc3ccccc3c2C)s1 ZINC000359790482 1044201553 /nfs/dbraw/zinc/20/15/53/1044201553.db2.gz CFNRKGSALKUMIL-GFCCVEGCSA-N 1 2 316.426 4.195 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+]Cc2ccc(Oc3ccccc3)nc2)n1 ZINC000882946272 1044207112 /nfs/dbraw/zinc/20/71/12/1044207112.db2.gz BXPOAQOTVJGIQA-UHFFFAOYSA-N 1 2 322.412 4.010 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cn1cc(C)cnc1=S ZINC000130791955 1044216336 /nfs/dbraw/zinc/21/63/36/1044216336.db2.gz ZSGGSDNFBMHDNK-UHFFFAOYSA-N 1 2 313.879 4.116 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cn1cc(C)cnc1=S ZINC000130791955 1044216348 /nfs/dbraw/zinc/21/63/48/1044216348.db2.gz ZSGGSDNFBMHDNK-UHFFFAOYSA-N 1 2 313.879 4.116 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+][C@@H]2CC(C)(C)Oc3ccc(F)cc32)n1 ZINC000883158135 1044227617 /nfs/dbraw/zinc/22/76/17/1044227617.db2.gz VKHGRUVLINRIOU-CQSZACIVSA-N 1 2 317.408 4.064 20 0 DIADLO Cc1cc(C[NH2+]C2(c3c(Cl)cccc3Cl)CCC2)ncn1 ZINC000292974337 1044237600 /nfs/dbraw/zinc/23/76/00/1044237600.db2.gz WYOLGDFHSLZAPQ-UHFFFAOYSA-N 1 2 322.239 4.261 20 0 DIADLO CC[C@H]([NH2+]Cc1csc(COC)n1)c1sccc1Cl ZINC000883223575 1044238273 /nfs/dbraw/zinc/23/82/73/1044238273.db2.gz RTBMCUIULFNAMN-NSHDSACASA-N 1 2 316.879 4.245 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](CC)c2sccc2Cl)s1 ZINC000883223782 1044238487 /nfs/dbraw/zinc/23/84/87/1044238487.db2.gz XCMILLRGTMQSBU-VIFPVBQESA-N 1 2 301.868 4.056 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C2CC2)s1)c1sccc1Cl ZINC000883230004 1044239966 /nfs/dbraw/zinc/23/99/66/1044239966.db2.gz VIJLCOGWRAIZFV-SNVBAGLBSA-N 1 2 313.879 4.371 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccccc2F)C2CCCC2)[nH]1 ZINC000293106102 1044248993 /nfs/dbraw/zinc/24/89/93/1044248993.db2.gz JOXXZRGOIDGTDB-KRWDZBQOSA-N 1 2 316.424 4.088 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C)[C@@H](c3ccccc3)C(C)C)ccn12 ZINC000563382923 1044253957 /nfs/dbraw/zinc/25/39/57/1044253957.db2.gz LQVGFGFQQCCLED-LJQANCHMSA-N 1 2 321.424 4.112 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(Cl)cc1OC(C)C ZINC000883267967 1044255326 /nfs/dbraw/zinc/25/53/26/1044255326.db2.gz YWKPOOGGNGBZQT-CYBMUJFWSA-N 1 2 321.852 4.194 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+][C@H](C)c1cscn1 ZINC000883267156 1044255354 /nfs/dbraw/zinc/25/53/54/1044255354.db2.gz UZSGTZOZBKLZCI-LLVKDONJSA-N 1 2 310.850 4.435 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1Cl)c1cnn(CC2CCC2)c1 ZINC000934552850 1044256192 /nfs/dbraw/zinc/25/61/92/1044256192.db2.gz XCSNLEUUIYLXJT-LBPRGKRZSA-N 1 2 321.827 4.327 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCn2ccnc21)c1cc(Cl)ccc1Cl ZINC000655704144 1044258585 /nfs/dbraw/zinc/25/85/85/1044258585.db2.gz QSOXPULAMUTYEV-IINYFYTJSA-N 1 2 310.228 4.376 20 0 DIADLO COc1cc([C@H](C)[NH2+]Cc2nc(C)c(C)o2)cc2ccccc21 ZINC000934630539 1044262962 /nfs/dbraw/zinc/26/29/62/1044262962.db2.gz BERBRWFGFAVUKK-ZDUSSCGKSA-N 1 2 310.397 4.304 20 0 DIADLO Cc1onc(-c2ccccc2)c1C[N@@H+]1Cc2cccc(F)c2C1 ZINC001141988308 1044280833 /nfs/dbraw/zinc/28/08/33/1044280833.db2.gz PPNIOEPQYWCEDR-UHFFFAOYSA-N 1 2 308.356 4.305 20 0 DIADLO Cc1onc(-c2ccccc2)c1C[N@H+]1Cc2cccc(F)c2C1 ZINC001141988308 1044280845 /nfs/dbraw/zinc/28/08/45/1044280845.db2.gz PPNIOEPQYWCEDR-UHFFFAOYSA-N 1 2 308.356 4.305 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc([C@@H](F)C(F)(F)F)cc1 ZINC000883368511 1044284968 /nfs/dbraw/zinc/28/49/68/1044284968.db2.gz SCMXAFLCUWVSJP-CYBMUJFWSA-N 1 2 301.287 4.088 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+][C@@H]1c2ccccc2CC[C@@H]1F ZINC000883376457 1044290759 /nfs/dbraw/zinc/29/07/59/1044290759.db2.gz LHMCIEOIJUVRCX-GEWABHDNSA-N 1 2 302.393 4.222 20 0 DIADLO CC(C)c1ncc(C[NH2+][C@H]2c3ccccc3CC[C@@H]2F)s1 ZINC000883383104 1044295288 /nfs/dbraw/zinc/29/52/88/1044295288.db2.gz TWZJBRSIBUWVDK-HOTGVXAUSA-N 1 2 304.434 4.382 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1cnc(C2CC2)s1 ZINC000883382960 1044295417 /nfs/dbraw/zinc/29/54/17/1044295417.db2.gz QSGFAZMAWYGLNU-CVEARBPZSA-N 1 2 302.418 4.136 20 0 DIADLO CCc1nnc([C@H](C)[N@H+]2CC=C(c3cccc(Cl)c3)CC2)o1 ZINC000360725511 1044304505 /nfs/dbraw/zinc/30/45/05/1044304505.db2.gz LGDXULCVDABWOX-LBPRGKRZSA-N 1 2 317.820 4.136 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)o1 ZINC000360725511 1044304516 /nfs/dbraw/zinc/30/45/16/1044304516.db2.gz LGDXULCVDABWOX-LBPRGKRZSA-N 1 2 317.820 4.136 20 0 DIADLO Cc1ccc2c(Nc3nc4c(s3)C(=O)CCC4)cccc2[nH+]1 ZINC001212794884 1044312396 /nfs/dbraw/zinc/31/23/96/1044312396.db2.gz BBXKIAOIQSEQKZ-UHFFFAOYSA-N 1 2 309.394 4.262 20 0 DIADLO CCc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1c(F)cncc1F ZINC000293676309 1044312542 /nfs/dbraw/zinc/31/25/42/1044312542.db2.gz VCYYILJPSDWCSU-LBPRGKRZSA-N 1 2 319.399 4.291 20 0 DIADLO Cc1ccc2c(Nc3ccnc(OC(F)F)c3)cccc2[nH+]1 ZINC001212795781 1044321769 /nfs/dbraw/zinc/32/17/69/1044321769.db2.gz AWKQHXLTMBAKDU-UHFFFAOYSA-N 1 2 301.296 4.283 20 0 DIADLO O=C(Nc1cccc(C2CCC2)c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000360894352 1044325308 /nfs/dbraw/zinc/32/53/08/1044325308.db2.gz TWCGODVDNJGNFL-UHFFFAOYSA-N 1 2 317.392 4.392 20 0 DIADLO C[C@@H]1C[N@H+](Cc2sccc2Oc2ccccc2)[C@@H](C)CO1 ZINC001142003584 1044331835 /nfs/dbraw/zinc/33/18/35/1044331835.db2.gz UHAHVORXQPNGQW-UONOGXRCSA-N 1 2 303.427 4.150 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2sccc2Oc2ccccc2)[C@@H](C)CO1 ZINC001142003584 1044331852 /nfs/dbraw/zinc/33/18/52/1044331852.db2.gz UHAHVORXQPNGQW-UONOGXRCSA-N 1 2 303.427 4.150 20 0 DIADLO CCn1cnc(Cl)c1C[NH2+][C@@H](C)c1ccc(F)cc1Cl ZINC001202554669 1044334900 /nfs/dbraw/zinc/33/49/00/1044334900.db2.gz NXNZVGLBBLTPGX-VIFPVBQESA-N 1 2 316.207 4.200 20 0 DIADLO CCn1c2ccccc2nc1[C@H]1CCC[N@@H+]1Cc1ccc(C)nc1 ZINC000360976117 1044338461 /nfs/dbraw/zinc/33/84/61/1044338461.db2.gz RSDWANWZFCTAPQ-LJQANCHMSA-N 1 2 320.440 4.097 20 0 DIADLO CCn1c2ccccc2nc1[C@H]1CCC[N@H+]1Cc1ccc(C)nc1 ZINC000360976117 1044338476 /nfs/dbraw/zinc/33/84/76/1044338476.db2.gz RSDWANWZFCTAPQ-LJQANCHMSA-N 1 2 320.440 4.097 20 0 DIADLO Cc1ccc2c(Nc3cn(CC(F)(F)F)cn3)cccc2[nH+]1 ZINC001212796761 1044340820 /nfs/dbraw/zinc/34/08/20/1044340820.db2.gz BCPNLGQBBUFCRD-UHFFFAOYSA-N 1 2 306.291 4.046 20 0 DIADLO CCc1ccc(-c2noc(C[NH2+][C@H](C)c3ccccc3)n2)cc1 ZINC000102676839 1044347312 /nfs/dbraw/zinc/34/73/12/1044347312.db2.gz IXYXMNMAXBVQRG-CQSZACIVSA-N 1 2 307.397 4.150 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2csc(-c3ccccn3)n2)s1 ZINC000102773656 1044347463 /nfs/dbraw/zinc/34/74/63/1044347463.db2.gz IYECVMRVWBMQGU-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2csc(-c3ccccn3)n2)s1 ZINC000102773656 1044347482 /nfs/dbraw/zinc/34/74/82/1044347482.db2.gz IYECVMRVWBMQGU-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(-c2ccncc2)cc1 ZINC000361033091 1044348418 /nfs/dbraw/zinc/34/84/18/1044348418.db2.gz SDUVGBSVMVDIGU-AWEZNQCLSA-N 1 2 319.408 4.465 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2cc(Cl)cc3c2OCC3)n1 ZINC000361045369 1044351823 /nfs/dbraw/zinc/35/18/23/1044351823.db2.gz LEIMMBKPJTWGAI-UHFFFAOYSA-N 1 2 322.861 4.065 20 0 DIADLO Cc1cccc2ncc(C[N@@H+](C)[C@H](C)c3ccccc3Cl)n21 ZINC001137198915 1044355613 /nfs/dbraw/zinc/35/56/13/1044355613.db2.gz SGNBPTUNVYEMGC-CQSZACIVSA-N 1 2 313.832 4.489 20 0 DIADLO Cc1cccc2ncc(C[N@H+](C)[C@H](C)c3ccccc3Cl)n21 ZINC001137198915 1044355623 /nfs/dbraw/zinc/35/56/23/1044355623.db2.gz SGNBPTUNVYEMGC-CQSZACIVSA-N 1 2 313.832 4.489 20 0 DIADLO CC(C)N(Cc1ccccc1)C(=O)C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000361086051 1044358017 /nfs/dbraw/zinc/35/80/17/1044358017.db2.gz HKPIQRVPUDGAGL-QGZVFWFLSA-N 1 2 322.452 4.000 20 0 DIADLO CC(C)N(Cc1ccccc1)C(=O)C[N@H+]1Cc2ccccc2[C@H]1C ZINC000361086051 1044358033 /nfs/dbraw/zinc/35/80/33/1044358033.db2.gz HKPIQRVPUDGAGL-QGZVFWFLSA-N 1 2 322.452 4.000 20 0 DIADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1ncc(-c2cccs2)o1 ZINC000361120072 1044362683 /nfs/dbraw/zinc/36/26/83/1044362683.db2.gz PNDZPRZSJJURBD-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO CCn1nc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)c2ccccc21 ZINC000293994937 1044364002 /nfs/dbraw/zinc/36/40/02/1044364002.db2.gz SHDHXCXPTFADFT-IBGZPJMESA-N 1 2 320.440 4.034 20 0 DIADLO CCn1nc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)c2ccccc21 ZINC000293994937 1044364015 /nfs/dbraw/zinc/36/40/15/1044364015.db2.gz SHDHXCXPTFADFT-IBGZPJMESA-N 1 2 320.440 4.034 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000935760200 1044367459 /nfs/dbraw/zinc/36/74/59/1044367459.db2.gz WSCDHTASXYSFDF-CWRNSKLLSA-N 1 2 309.413 4.150 20 0 DIADLO CCC[C@@H]([NH2+][C@H]1CCOc2c(F)ccc(F)c21)c1ccccn1 ZINC000361185746 1044372897 /nfs/dbraw/zinc/37/28/97/1044372897.db2.gz HUTAEVDCBZYSFV-CVEARBPZSA-N 1 2 318.367 4.314 20 0 DIADLO Cc1cc2ncn(C[N@@H+](C)[C@H]3CCc4ccccc43)c2cc1C ZINC000029307842 1044372684 /nfs/dbraw/zinc/37/26/84/1044372684.db2.gz QIUHHCGUCDRDKR-IBGZPJMESA-N 1 2 305.425 4.230 20 0 DIADLO Cc1cc2ncn(C[N@H+](C)[C@H]3CCc4ccccc43)c2cc1C ZINC000029307842 1044372695 /nfs/dbraw/zinc/37/26/95/1044372695.db2.gz QIUHHCGUCDRDKR-IBGZPJMESA-N 1 2 305.425 4.230 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+][C@@H]1CCOc2c(F)ccc(F)c21 ZINC000361185829 1044373021 /nfs/dbraw/zinc/37/30/21/1044373021.db2.gz IUQWMQWSWJVROF-IAQYHMDHSA-N 1 2 319.351 4.148 20 0 DIADLO CC(C)c1ncc(C[NH2+][C@H]2CCOc3c(F)ccc(F)c32)s1 ZINC000361236165 1044377854 /nfs/dbraw/zinc/37/78/54/1044377854.db2.gz HRMHPUJBMINFPZ-ZDUSSCGKSA-N 1 2 324.396 4.158 20 0 DIADLO Fc1ccc(F)c2c1OCC[C@H]2[NH2+]Cc1cc2ccccc2o1 ZINC000361237028 1044380305 /nfs/dbraw/zinc/38/03/05/1044380305.db2.gz MIHRWAUGJDOPFT-OAHLLOKOSA-N 1 2 315.319 4.324 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1cncc(C(F)(F)F)c1 ZINC000361310977 1044389423 /nfs/dbraw/zinc/38/94/23/1044389423.db2.gz VNIPWSPIBDWROR-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1cncc(C(F)(F)F)c1 ZINC000361310977 1044389440 /nfs/dbraw/zinc/38/94/40/1044389440.db2.gz VNIPWSPIBDWROR-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Cc1cc([C@H](C)[NH2+]C(c2ccccc2)c2ccccc2)nn1C ZINC000281995372 1044391717 /nfs/dbraw/zinc/39/17/17/1044391717.db2.gz CQSNPDLPHODDPB-INIZCTEOSA-N 1 2 305.425 4.169 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2nc(C3CCC3)no2)C2CC2)cc1 ZINC000639561387 1044394841 /nfs/dbraw/zinc/39/48/41/1044394841.db2.gz GNKUVVRGLZQWHM-MRXNPFEDSA-N 1 2 317.820 4.231 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)Cc1cnccc1C ZINC000361438048 1044403827 /nfs/dbraw/zinc/40/38/27/1044403827.db2.gz TVUUYRGUPAZHRG-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)Cc1cnccc1C ZINC000361438048 1044403833 /nfs/dbraw/zinc/40/38/33/1044403833.db2.gz TVUUYRGUPAZHRG-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccc(OC(F)F)c([C@H](C)[NH2+]Cc2ccn(C(C)C)n2)c1 ZINC000564825770 1044405931 /nfs/dbraw/zinc/40/59/31/1044405931.db2.gz VHTNIYKNNNIOHX-ZDUSSCGKSA-N 1 2 323.387 4.225 20 0 DIADLO CC[C@](C)(NCc1ccc(-n2cc[nH+]c2)cc1C)C(F)(F)F ZINC000564834021 1044405999 /nfs/dbraw/zinc/40/59/99/1044405999.db2.gz LZFRYHCHNLDNIN-HNNXBMFYSA-N 1 2 311.351 4.001 20 0 DIADLO c1coc(C[N@H+](Cc2nccn2-c2ccccc2)C2CCCC2)c1 ZINC000361502905 1044411539 /nfs/dbraw/zinc/41/15/39/1044411539.db2.gz ZKBXMBLCPXHTBG-UHFFFAOYSA-N 1 2 321.424 4.410 20 0 DIADLO c1coc(C[N@@H+](Cc2nccn2-c2ccccc2)C2CCCC2)c1 ZINC000361502905 1044411544 /nfs/dbraw/zinc/41/15/44/1044411544.db2.gz ZKBXMBLCPXHTBG-UHFFFAOYSA-N 1 2 321.424 4.410 20 0 DIADLO Cc1ccc([C@H](C)C[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)cc1 ZINC000565131387 1044416259 /nfs/dbraw/zinc/41/62/59/1044416259.db2.gz CFHIUXWWDKGOFB-QAPCUYQASA-N 1 2 312.461 4.128 20 0 DIADLO Cc1ccc([C@@H](C)C[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)cc1 ZINC000565131389 1044416555 /nfs/dbraw/zinc/41/65/55/1044416555.db2.gz CFHIUXWWDKGOFB-YJBOKZPZSA-N 1 2 312.461 4.128 20 0 DIADLO C[C@H]1C[N@H+](Cc2nccn2-c2ccccc2)[C@@H]1c1ccccc1 ZINC000361573279 1044419303 /nfs/dbraw/zinc/41/93/03/1044419303.db2.gz YSEPUHBSFFHLLM-JXFKEZNVSA-N 1 2 303.409 4.065 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nccn2-c2ccccc2)[C@@H]1c1ccccc1 ZINC000361573279 1044419310 /nfs/dbraw/zinc/41/93/10/1044419310.db2.gz YSEPUHBSFFHLLM-JXFKEZNVSA-N 1 2 303.409 4.065 20 0 DIADLO CC(C)n1ccnc1C[N@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000361579956 1044419984 /nfs/dbraw/zinc/41/99/84/1044419984.db2.gz YLSVEALRQPWTCO-OLZOCXBDSA-N 1 2 303.372 4.017 20 0 DIADLO CC(C)n1ccnc1C[N@@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000361579956 1044419990 /nfs/dbraw/zinc/41/99/90/1044419990.db2.gz YLSVEALRQPWTCO-OLZOCXBDSA-N 1 2 303.372 4.017 20 0 DIADLO CC(C)COc1ccccc1C[N@@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000361586902 1044421801 /nfs/dbraw/zinc/42/18/01/1044421801.db2.gz NAXIYXULHUHVKM-KRWDZBQOSA-N 1 2 313.445 4.172 20 0 DIADLO CC(C)COc1ccccc1C[N@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000361586902 1044421809 /nfs/dbraw/zinc/42/18/09/1044421809.db2.gz NAXIYXULHUHVKM-KRWDZBQOSA-N 1 2 313.445 4.172 20 0 DIADLO Cc1ccc(C)c([C@H]2CCC[N@H+]2Cc2ncc(Cl)n2C)c1 ZINC000133620639 1044430727 /nfs/dbraw/zinc/43/07/27/1044430727.db2.gz KRBDNFHOUDNKEK-OAHLLOKOSA-N 1 2 303.837 4.027 20 0 DIADLO Cc1ccc(C)c([C@H]2CCC[N@@H+]2Cc2ncc(Cl)n2C)c1 ZINC000133620639 1044430729 /nfs/dbraw/zinc/43/07/29/1044430729.db2.gz KRBDNFHOUDNKEK-OAHLLOKOSA-N 1 2 303.837 4.027 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1cccnc1Cl)CCC2 ZINC000111310714 1044432503 /nfs/dbraw/zinc/43/25/03/1044432503.db2.gz UUPQBTXNJDGWSS-CYBMUJFWSA-N 1 2 307.850 4.009 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1cccnc1Cl)CCC2 ZINC000111310714 1044432508 /nfs/dbraw/zinc/43/25/08/1044432508.db2.gz UUPQBTXNJDGWSS-CYBMUJFWSA-N 1 2 307.850 4.009 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1ncc(C(C)(C)C)o1)CCC2 ZINC000111311768 1044432830 /nfs/dbraw/zinc/43/28/30/1044432830.db2.gz PDBXDTRMIPJVCT-CYBMUJFWSA-N 1 2 319.474 4.246 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ncc(C(C)(C)C)o1)CCC2 ZINC000111311768 1044432838 /nfs/dbraw/zinc/43/28/38/1044432838.db2.gz PDBXDTRMIPJVCT-CYBMUJFWSA-N 1 2 319.474 4.246 20 0 DIADLO CC(C)n1ccnc1C[NH2+][C@H](c1ccccc1)c1ccc(F)cc1 ZINC000111241980 1044432927 /nfs/dbraw/zinc/43/29/27/1044432927.db2.gz LESWRYZZBQVDHA-HXUWFJFHSA-N 1 2 323.415 4.482 20 0 DIADLO CCCc1nc(C)c(C[NH2+]C2(c3nc(C)cs3)CCCC2)o1 ZINC000428348757 1044438752 /nfs/dbraw/zinc/43/87/52/1044438752.db2.gz PVEOHGXDAFGLAY-UHFFFAOYSA-N 1 2 319.474 4.260 20 0 DIADLO CC(C)C[C@H]1CCC[C@@H](Nc2ccc(Cn3cc[nH+]c3)cn2)C1 ZINC000565565737 1044444317 /nfs/dbraw/zinc/44/43/17/1044444317.db2.gz GTOXVGRGEVHBJN-SJLPKXTDSA-N 1 2 312.461 4.343 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2cc(C)ccc2[nH]1)c1cc(F)ccc1F ZINC000361802735 1044446427 /nfs/dbraw/zinc/44/64/27/1044446427.db2.gz BHZDWJVTPAQYGZ-HNNXBMFYSA-N 1 2 315.367 4.390 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2ccc(C)cc2[nH]1)c1cc(F)ccc1F ZINC000361802735 1044446428 /nfs/dbraw/zinc/44/64/28/1044446428.db2.gz BHZDWJVTPAQYGZ-HNNXBMFYSA-N 1 2 315.367 4.390 20 0 DIADLO Cc1ccc2c(Nc3ccc4oc(=O)ccc4c3)cccc2[nH+]1 ZINC001212798682 1044452675 /nfs/dbraw/zinc/45/26/75/1044452675.db2.gz MXWJJJJUGWZRQI-UHFFFAOYSA-N 1 2 302.333 4.393 20 0 DIADLO FC(F)(F)c1ccc([C@H]2CCCC[N@@H+]2Cc2ncccn2)cc1 ZINC000361861578 1044454047 /nfs/dbraw/zinc/45/40/47/1044454047.db2.gz CUCOCYXFZJUFJF-OAHLLOKOSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1ccc([C@H]2CCCC[N@H+]2Cc2ncccn2)cc1 ZINC000361861578 1044454051 /nfs/dbraw/zinc/45/40/51/1044454051.db2.gz CUCOCYXFZJUFJF-OAHLLOKOSA-N 1 2 321.346 4.223 20 0 DIADLO Cc1ccc2c(Nc3cc(F)ccc3OC3COC3)cccc2[nH+]1 ZINC001212798909 1044455591 /nfs/dbraw/zinc/45/55/91/1044455591.db2.gz ZECRHHFGBIWULF-UHFFFAOYSA-N 1 2 324.355 4.204 20 0 DIADLO Fc1ccc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)nc1 ZINC000362126459 1044479257 /nfs/dbraw/zinc/47/92/57/1044479257.db2.gz RZEPLZLWKTVVNF-UHFFFAOYSA-N 1 2 312.310 4.175 20 0 DIADLO Fc1ccc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)nc1 ZINC000362126459 1044479263 /nfs/dbraw/zinc/47/92/63/1044479263.db2.gz RZEPLZLWKTVVNF-UHFFFAOYSA-N 1 2 312.310 4.175 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)cc1OC ZINC000566393727 1044486771 /nfs/dbraw/zinc/48/67/71/1044486771.db2.gz DMIGXIPUSDBROK-INIZCTEOSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)cc1OC ZINC000566393727 1044486779 /nfs/dbraw/zinc/48/67/79/1044486779.db2.gz DMIGXIPUSDBROK-INIZCTEOSA-N 1 2 317.816 4.304 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nccn1-c1ccccc1)c1ccc(F)cn1 ZINC000348313228 1044489003 /nfs/dbraw/zinc/48/90/03/1044489003.db2.gz GNNMUMHZZWMPEO-RHSMWYFYSA-N 1 2 324.403 4.208 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N3C[C@H](C(C)C)c4ccccc43)ccn12 ZINC000566453826 1044492305 /nfs/dbraw/zinc/49/23/05/1044492305.db2.gz XBZITYJQIBRMPM-QGZVFWFLSA-N 1 2 319.408 4.043 20 0 DIADLO CCCCC[N@H+](Cc1nnc(C)o1)Cc1ccc(Cl)cc1 ZINC000119602470 1044496528 /nfs/dbraw/zinc/49/65/28/1044496528.db2.gz GPDCOFCNKIACMK-UHFFFAOYSA-N 1 2 307.825 4.224 20 0 DIADLO CCCCC[N@@H+](Cc1nnc(C)o1)Cc1ccc(Cl)cc1 ZINC000119602470 1044496536 /nfs/dbraw/zinc/49/65/36/1044496536.db2.gz GPDCOFCNKIACMK-UHFFFAOYSA-N 1 2 307.825 4.224 20 0 DIADLO Clc1ccc([C@H]2CC[N@@H+]2Cc2cccc3c2OCO3)cc1 ZINC000566627031 1044504749 /nfs/dbraw/zinc/50/47/49/1044504749.db2.gz WBUSDWSVGXARIR-OAHLLOKOSA-N 1 2 301.773 4.016 20 0 DIADLO Clc1ccc([C@H]2CC[N@H+]2Cc2cccc3c2OCO3)cc1 ZINC000566627031 1044504763 /nfs/dbraw/zinc/50/47/63/1044504763.db2.gz WBUSDWSVGXARIR-OAHLLOKOSA-N 1 2 301.773 4.016 20 0 DIADLO CCc1nnc(C[N@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)o1 ZINC000362382783 1044505307 /nfs/dbraw/zinc/50/53/07/1044505307.db2.gz BSNSPYHKHNWVME-HNNXBMFYSA-N 1 2 321.424 4.492 20 0 DIADLO CCc1nnc(C[N@@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)o1 ZINC000362382783 1044505314 /nfs/dbraw/zinc/50/53/14/1044505314.db2.gz BSNSPYHKHNWVME-HNNXBMFYSA-N 1 2 321.424 4.492 20 0 DIADLO COCc1ccc(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)o1 ZINC000120497553 1044507340 /nfs/dbraw/zinc/50/73/40/1044507340.db2.gz FPUHCJORDXPBGU-LBPRGKRZSA-N 1 2 316.426 4.229 20 0 DIADLO COCc1ccc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)o1 ZINC000120497553 1044507353 /nfs/dbraw/zinc/50/73/53/1044507353.db2.gz FPUHCJORDXPBGU-LBPRGKRZSA-N 1 2 316.426 4.229 20 0 DIADLO O=C(/C=C\c1ccc(Cl)cc1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000215018532 1044518646 /nfs/dbraw/zinc/51/86/46/1044518646.db2.gz KCFPCZKMDQHFNG-KMKOMSMNSA-N 1 2 323.783 4.382 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@H](C)c2cccnc2Cl)on1 ZINC000121155075 1044520234 /nfs/dbraw/zinc/52/02/34/1044520234.db2.gz STPIKKMUVIEBAG-LLVKDONJSA-N 1 2 307.825 4.477 20 0 DIADLO COc1c(C[NH2+][C@@H](C)c2nc(C)cs2)oc2ccccc21 ZINC000623968717 1044531762 /nfs/dbraw/zinc/53/17/62/1044531762.db2.gz LIUFKFHJDBKHQK-NSHDSACASA-N 1 2 302.399 4.057 20 0 DIADLO Cc1cnc([C@@H](C)[NH+]2CCC(c3c(F)cccc3F)CC2)o1 ZINC000362588967 1044532618 /nfs/dbraw/zinc/53/26/18/1044532618.db2.gz GTEMIFXXQKZWTD-GFCCVEGCSA-N 1 2 306.356 4.202 20 0 DIADLO Cc1ccc2nc(C[N@H+](C)Cc3nc4ccccc4o3)ccc2c1 ZINC001137217227 1044562588 /nfs/dbraw/zinc/56/25/88/1044562588.db2.gz OVQUQLAEQLEUOR-UHFFFAOYSA-N 1 2 317.392 4.316 20 0 DIADLO Cc1ccc2nc(C[N@@H+](C)Cc3nc4ccccc4o3)ccc2c1 ZINC001137217227 1044562600 /nfs/dbraw/zinc/56/26/00/1044562600.db2.gz OVQUQLAEQLEUOR-UHFFFAOYSA-N 1 2 317.392 4.316 20 0 DIADLO Fc1ccc2cc(CNc3ccc(-n4cc[nH+]c4)c(F)c3)[nH]c2c1 ZINC000362924948 1044564023 /nfs/dbraw/zinc/56/40/23/1044564023.db2.gz AXUUZJADLZTJCQ-UHFFFAOYSA-N 1 2 324.334 4.244 20 0 DIADLO Fc1cc(-c2ccco2)ccc1NCc1cccc2[nH+]ccn21 ZINC000362958670 1044570344 /nfs/dbraw/zinc/57/03/44/1044570344.db2.gz RCYLFWIDXHUJME-UHFFFAOYSA-N 1 2 307.328 4.346 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2nncn2-c2ccccc2)c1 ZINC000444590696 1044570463 /nfs/dbraw/zinc/57/04/63/1044570463.db2.gz MGHSKBKFYHLQCK-KRWDZBQOSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2nncn2-c2ccccc2)c1 ZINC000444590696 1044570479 /nfs/dbraw/zinc/57/04/79/1044570479.db2.gz MGHSKBKFYHLQCK-KRWDZBQOSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2nncn2-c2ccccc2)c(C)c1 ZINC000444591314 1044571114 /nfs/dbraw/zinc/57/11/14/1044571114.db2.gz NONCCNISVUKAGT-QGZVFWFLSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nncn2-c2ccccc2)c(C)c1 ZINC000444591314 1044571125 /nfs/dbraw/zinc/57/11/25/1044571125.db2.gz NONCCNISVUKAGT-QGZVFWFLSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cncc(OCc3ccccc3)c2)o1 ZINC000362965495 1044572514 /nfs/dbraw/zinc/57/25/14/1044572514.db2.gz CCWPXOUPMNSFTH-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cncc(OCc3ccccc3)c2)o1 ZINC000362965495 1044572531 /nfs/dbraw/zinc/57/25/31/1044572531.db2.gz CCWPXOUPMNSFTH-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO C[N@@H+](Cc1nc(C2CCCCC2)cs1)C[C@@H]1CCCCO1 ZINC000444597820 1044577044 /nfs/dbraw/zinc/57/70/44/1044577044.db2.gz QBCGETYYPXPXJX-HNNXBMFYSA-N 1 2 308.491 4.192 20 0 DIADLO C[N@H+](Cc1nc(C2CCCCC2)cs1)C[C@@H]1CCCCO1 ZINC000444597820 1044577049 /nfs/dbraw/zinc/57/70/49/1044577049.db2.gz QBCGETYYPXPXJX-HNNXBMFYSA-N 1 2 308.491 4.192 20 0 DIADLO FC(F)(F)c1sccc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000631657445 1044579161 /nfs/dbraw/zinc/57/91/61/1044579161.db2.gz WKLZUOFEFFJYII-SECBINFHSA-N 1 2 318.389 4.391 20 0 DIADLO Cc1cnc(C[N@@H+]2CCC[C@H]2c2ccccc2C(F)(F)F)o1 ZINC000363169056 1044590680 /nfs/dbraw/zinc/59/06/80/1044590680.db2.gz JPTYZJZKEDEDNL-AWEZNQCLSA-N 1 2 310.319 4.339 20 0 DIADLO COc1cc(C)cc(C[NH2+][C@H](C)c2c(F)cccc2F)c1OC ZINC000885927392 1044590678 /nfs/dbraw/zinc/59/06/78/1044590678.db2.gz RPZOEKMHYASNCX-GFCCVEGCSA-N 1 2 321.367 4.141 20 0 DIADLO Cc1cnc(C[N@H+]2CCC[C@H]2c2ccccc2C(F)(F)F)o1 ZINC000363169056 1044590699 /nfs/dbraw/zinc/59/06/99/1044590699.db2.gz JPTYZJZKEDEDNL-AWEZNQCLSA-N 1 2 310.319 4.339 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000296135392 1044592089 /nfs/dbraw/zinc/59/20/89/1044592089.db2.gz VYBJBPKRRDKEJA-BEFAXECRSA-N 1 2 323.415 4.482 20 0 DIADLO Cc1coc(C[NH2+][C@H](C)c2nc3ccccc3n2C(F)F)c1 ZINC000885917648 1044592686 /nfs/dbraw/zinc/59/26/86/1044592686.db2.gz PJKQVIFSWQIMJZ-LLVKDONJSA-N 1 2 305.328 4.184 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)c2nccn21 ZINC000296186198 1044596480 /nfs/dbraw/zinc/59/64/80/1044596480.db2.gz YGHOSUYRCUKWGM-ZMYBRWDISA-N 1 2 321.399 4.407 20 0 DIADLO Fc1cccc(C[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)c1F ZINC000568024488 1044597267 /nfs/dbraw/zinc/59/72/67/1044597267.db2.gz NHRBDDSVXBDSEP-GFCCVEGCSA-N 1 2 313.269 4.159 20 0 DIADLO Cc1ccc2c(c1)nc(C[NH2+]Cc1ccc(C)cc1Cl)n2C ZINC000568033340 1044599679 /nfs/dbraw/zinc/59/96/79/1044599679.db2.gz JNHZKFSZXROFPP-UHFFFAOYSA-N 1 2 313.832 4.133 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)cs1 ZINC000444689197 1044602479 /nfs/dbraw/zinc/60/24/79/1044602479.db2.gz FMDCIIUUFRISLA-GHMZBOCLSA-N 1 2 322.396 4.015 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)cs1 ZINC000444689197 1044602488 /nfs/dbraw/zinc/60/24/88/1044602488.db2.gz FMDCIIUUFRISLA-GHMZBOCLSA-N 1 2 322.396 4.015 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)cs1 ZINC000444689198 1044603325 /nfs/dbraw/zinc/60/33/25/1044603325.db2.gz FMDCIIUUFRISLA-MNOVXSKESA-N 1 2 322.396 4.015 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)cs1 ZINC000444689198 1044603334 /nfs/dbraw/zinc/60/33/34/1044603334.db2.gz FMDCIIUUFRISLA-MNOVXSKESA-N 1 2 322.396 4.015 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+](C)Cc1cc(F)cc(F)c1 ZINC000444693883 1044605039 /nfs/dbraw/zinc/60/50/39/1044605039.db2.gz AWBOEOVPJSMCNO-NSHDSACASA-N 1 2 302.324 4.299 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+](C)Cc1cc(F)cc(F)c1 ZINC000444693883 1044605045 /nfs/dbraw/zinc/60/50/45/1044605045.db2.gz AWBOEOVPJSMCNO-NSHDSACASA-N 1 2 302.324 4.299 20 0 DIADLO C[C@H]([NH2+]Cc1csc(Cl)n1)c1ccc(OC(F)F)cc1 ZINC000296296715 1044605501 /nfs/dbraw/zinc/60/55/01/1044605501.db2.gz MIQRQVIILFHSCH-QMMMGPOBSA-N 1 2 318.776 4.249 20 0 DIADLO CCCc1csc(C[NH2+][C@@H](CC)c2nc3ccccc3[nH]2)n1 ZINC000568236838 1044610206 /nfs/dbraw/zinc/61/02/06/1044610206.db2.gz WAWLAOJFGXAZHE-ZDUSSCGKSA-N 1 2 314.458 4.213 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)cs1 ZINC000444711133 1044610571 /nfs/dbraw/zinc/61/05/71/1044610571.db2.gz UAODSERWOVSDIM-SNVBAGLBSA-N 1 2 306.397 4.215 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)cs1 ZINC000444711133 1044610582 /nfs/dbraw/zinc/61/05/82/1044610582.db2.gz UAODSERWOVSDIM-SNVBAGLBSA-N 1 2 306.397 4.215 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(Cl)c2)C[N@@H+]1C[C@@H]1CCC(C)(C)O1 ZINC000444712655 1044611105 /nfs/dbraw/zinc/61/11/05/1044611105.db2.gz WPHHOZMJOJGIAZ-XOKHGSTOSA-N 1 2 323.864 4.059 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(Cl)c2)C[N@H+]1C[C@@H]1CCC(C)(C)O1 ZINC000444712655 1044611110 /nfs/dbraw/zinc/61/11/10/1044611110.db2.gz WPHHOZMJOJGIAZ-XOKHGSTOSA-N 1 2 323.864 4.059 20 0 DIADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@H](CC1CCCCC1)C(C)(C)C ZINC000568199256 1044611208 /nfs/dbraw/zinc/61/12/08/1044611208.db2.gz RJLRLVIGZRNDNL-WMLDXEAASA-N 1 2 319.493 4.090 20 0 DIADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@H](CC1CCCCC1)C(C)(C)C ZINC000568199256 1044611214 /nfs/dbraw/zinc/61/12/14/1044611214.db2.gz RJLRLVIGZRNDNL-WMLDXEAASA-N 1 2 319.493 4.090 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(Cl)c2)C[N@@H+]1C[C@@H]1CCC(C)(C)O1 ZINC000444712651 1044611462 /nfs/dbraw/zinc/61/14/62/1044611462.db2.gz WPHHOZMJOJGIAZ-COXVUDFISA-N 1 2 323.864 4.059 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(Cl)c2)C[N@H+]1C[C@@H]1CCC(C)(C)O1 ZINC000444712651 1044611468 /nfs/dbraw/zinc/61/14/68/1044611468.db2.gz WPHHOZMJOJGIAZ-COXVUDFISA-N 1 2 323.864 4.059 20 0 DIADLO Cc1cc(C)c(C(=O)Nc2cccc(-c3[nH]c(C)c(C)[nH+]3)c2)o1 ZINC000363421858 1044617051 /nfs/dbraw/zinc/61/70/51/1044617051.db2.gz JROXVVZCGQYGNQ-UHFFFAOYSA-N 1 2 309.369 4.156 20 0 DIADLO Cc1ccc(-c2cnc(C[NH2+][C@@H](C)c3cccc(O)c3)o2)cc1 ZINC000444746940 1044618882 /nfs/dbraw/zinc/61/88/82/1044618882.db2.gz GQZTWVRTSOAPLU-AWEZNQCLSA-N 1 2 308.381 4.206 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)c1ncco1 ZINC000886273863 1044629784 /nfs/dbraw/zinc/62/97/84/1044629784.db2.gz HZCGTHNNAMHBGU-MRVPVSSYSA-N 1 2 304.699 4.198 20 0 DIADLO CC(C)([NH2+]Cc1csc(C2CC2)n1)c1ccc(F)cc1F ZINC000886349989 1044633494 /nfs/dbraw/zinc/63/34/94/1044633494.db2.gz GNYAWPMZLRCZTM-UHFFFAOYSA-N 1 2 308.397 4.324 20 0 DIADLO CCCCCCOc1ccc(C[NH2+][C@@H](C)c2csnn2)cc1 ZINC000840969794 1044634699 /nfs/dbraw/zinc/63/46/99/1044634699.db2.gz KGKABROSRFLURP-AWEZNQCLSA-N 1 2 319.474 4.348 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)Cc3ccc(F)cc3)c2)[nH+]c1C ZINC000363628702 1044639531 /nfs/dbraw/zinc/63/95/31/1044639531.db2.gz QCIIIBLDZVEILZ-UHFFFAOYSA-N 1 2 323.371 4.014 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)[nH]1 ZINC000296656092 1044640253 /nfs/dbraw/zinc/64/02/53/1044640253.db2.gz ZIXHECWMPHZWJF-JTQLQIEISA-N 1 2 318.808 4.179 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N3CCCC[C@H]3c3ccccc3)ccn12 ZINC000568649252 1044640966 /nfs/dbraw/zinc/64/09/66/1044640966.db2.gz CZFAAXINNGKHPJ-SFHVURJKSA-N 1 2 319.408 4.010 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]C(c2cccs2)c2cccs2)c2nccn21 ZINC000296760085 1044646207 /nfs/dbraw/zinc/64/62/07/1044646207.db2.gz KCCALCZFILEECS-NWDGAFQWSA-N 1 2 315.467 4.391 20 0 DIADLO FC1CC[NH+](Cc2cccc(Cl)c2Br)CC1 ZINC000719506519 1044655419 /nfs/dbraw/zinc/65/54/19/1044655419.db2.gz QHLZDSDJHQOTGB-UHFFFAOYSA-N 1 2 306.606 4.036 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nccn2CC(F)(F)F)[C@H]1c1ccccc1 ZINC000886545288 1044659147 /nfs/dbraw/zinc/65/91/47/1044659147.db2.gz KFMGBNYXRXCZIP-CZUORRHYSA-N 1 2 323.362 4.029 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nccn2CC(F)(F)F)[C@H]1c1ccccc1 ZINC000886545288 1044659165 /nfs/dbraw/zinc/65/91/65/1044659165.db2.gz KFMGBNYXRXCZIP-CZUORRHYSA-N 1 2 323.362 4.029 20 0 DIADLO COc1ccc([C@@H]([NH2+][C@@H]2CCc3cccnc32)c2ccco2)cc1 ZINC000886622442 1044670053 /nfs/dbraw/zinc/67/00/53/1044670053.db2.gz SRCBOHBENUQGDM-YLJYHZDGSA-N 1 2 320.392 4.050 20 0 DIADLO Fc1ccc(C[NH2+][C@@H]2CCCc3cn[nH]c32)c(Cl)c1Cl ZINC000365325809 1044686092 /nfs/dbraw/zinc/68/60/92/1044686092.db2.gz KZUQHDCGGDZWGV-LLVKDONJSA-N 1 2 314.191 4.023 20 0 DIADLO Fc1ccc(C[NH2+][C@@H]2CCCc3c[nH]nc32)c(Cl)c1Cl ZINC000365325809 1044686095 /nfs/dbraw/zinc/68/60/95/1044686095.db2.gz KZUQHDCGGDZWGV-LLVKDONJSA-N 1 2 314.191 4.023 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@H](C)c2ccccn2)c2ccccn2)cc1 ZINC000366276931 1044718463 /nfs/dbraw/zinc/71/84/63/1044718463.db2.gz ZYKZLRQNMFPPBD-UZLBHIALSA-N 1 2 303.409 4.225 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2c1cccc2F)c1nc(-c2ccccc2)no1 ZINC000886925090 1044719597 /nfs/dbraw/zinc/71/95/97/1044719597.db2.gz DZDAKVSTCNWRRZ-YVEFUNNKSA-N 1 2 323.371 4.214 20 0 DIADLO CCCCSCCC(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000366542633 1044723204 /nfs/dbraw/zinc/72/32/04/1044723204.db2.gz YHFVOFNETGGFNL-UHFFFAOYSA-N 1 2 317.458 4.247 20 0 DIADLO Clc1ccncc1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC001137236494 1044729471 /nfs/dbraw/zinc/72/94/71/1044729471.db2.gz FLSUUANXYUTMJZ-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccncc1C[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC001137236494 1044729489 /nfs/dbraw/zinc/72/94/89/1044729489.db2.gz FLSUUANXYUTMJZ-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+]([C@H](C)c2ccco2)C2CC2)c(C)c1 ZINC000086233024 1044731838 /nfs/dbraw/zinc/73/18/38/1044731838.db2.gz BFOXFMNAMLQPFX-OAHLLOKOSA-N 1 2 312.413 4.061 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+]([C@H](C)c2ccco2)C2CC2)c(C)c1 ZINC000086233024 1044731854 /nfs/dbraw/zinc/73/18/54/1044731854.db2.gz BFOXFMNAMLQPFX-OAHLLOKOSA-N 1 2 312.413 4.061 20 0 DIADLO CC(C)n1cc(C[N@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)nn1 ZINC000570246267 1044744243 /nfs/dbraw/zinc/74/42/43/1044744243.db2.gz DPODLXSLQFTTGB-CYBMUJFWSA-N 1 2 318.852 4.238 20 0 DIADLO CC(C)n1cc(C[N@@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)nn1 ZINC000570246267 1044744257 /nfs/dbraw/zinc/74/42/57/1044744257.db2.gz DPODLXSLQFTTGB-CYBMUJFWSA-N 1 2 318.852 4.238 20 0 DIADLO C[C@H]([NH2+]Cc1cc2cccnc2o1)c1nc(C(C)(C)C)cs1 ZINC000570275999 1044744534 /nfs/dbraw/zinc/74/45/34/1044744534.db2.gz QBBHNOLMRGFBPU-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO CC(C)[C@@H](C)[N@H+](C)Cn1nc2sc3ccccc3n2c1=S ZINC000029541603 1044751751 /nfs/dbraw/zinc/75/17/51/1044751751.db2.gz ZRXIFFMGRNQPBW-LLVKDONJSA-N 1 2 320.487 4.014 20 0 DIADLO CC(C)[C@@H](C)[N@@H+](C)Cn1nc2sc3ccccc3n2c1=S ZINC000029541603 1044751763 /nfs/dbraw/zinc/75/17/63/1044751763.db2.gz ZRXIFFMGRNQPBW-LLVKDONJSA-N 1 2 320.487 4.014 20 0 DIADLO C[C@@H]([NH2+]Cc1sccc1Cl)c1nccn1-c1ccccc1 ZINC000367969706 1044760473 /nfs/dbraw/zinc/76/04/73/1044760473.db2.gz DEHGXQNJYBGQHP-GFCCVEGCSA-N 1 2 317.845 4.438 20 0 DIADLO C[N@H+](Cc1nc(-c2coc3ccccc23)no1)Cc1ccccc1 ZINC000445586283 1044761187 /nfs/dbraw/zinc/76/11/87/1044761187.db2.gz YUTLAHSESWMMQH-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO C[N@@H+](Cc1nc(-c2coc3ccccc23)no1)Cc1ccccc1 ZINC000445586283 1044761202 /nfs/dbraw/zinc/76/12/02/1044761202.db2.gz YUTLAHSESWMMQH-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@@H](c1cccs1)c1ccc(Cl)cc1 ZINC000368059278 1044764589 /nfs/dbraw/zinc/76/45/89/1044764589.db2.gz YCOMQXSUFSZSFV-MRXNPFEDSA-N 1 2 317.845 4.312 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@@H](c1cccs1)c1ccc(Cl)cc1 ZINC000368059278 1044764598 /nfs/dbraw/zinc/76/45/98/1044764598.db2.gz YCOMQXSUFSZSFV-MRXNPFEDSA-N 1 2 317.845 4.312 20 0 DIADLO COc1cccc(SCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000445602881 1044767743 /nfs/dbraw/zinc/76/77/43/1044767743.db2.gz ZBKRKRGTJYUMLU-UHFFFAOYSA-N 1 2 310.422 4.232 20 0 DIADLO c1[nH+]c(-c2cccc(N[C@@H]3CC[C@@H]3C3CC3)c2)n2c1CCCC2 ZINC000570748364 1044778457 /nfs/dbraw/zinc/77/84/57/1044778457.db2.gz FETCVPPKUACAOU-RTBURBONSA-N 1 2 307.441 4.487 20 0 DIADLO Cc1cccc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)c1 ZINC000524308985 1044795061 /nfs/dbraw/zinc/79/50/61/1044795061.db2.gz GNCSWBBWGMLBLT-GOSISDBHSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1cccc(C[N@H+]2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)c1 ZINC000524308985 1044795078 /nfs/dbraw/zinc/79/50/78/1044795078.db2.gz GNCSWBBWGMLBLT-GOSISDBHSA-N 1 2 319.807 4.361 20 0 DIADLO Fc1cccc(F)c1C1CC[NH+](Cc2ncc(C3CC3)o2)CC1 ZINC000369964920 1044820938 /nfs/dbraw/zinc/82/09/38/1044820938.db2.gz WBQFCFJZELUZOS-UHFFFAOYSA-N 1 2 318.367 4.210 20 0 DIADLO CCOc1ccc(C[N@H+](Cc2nnc(C(C)C)o2)C(C)C)cc1 ZINC000263727693 1044821244 /nfs/dbraw/zinc/82/12/44/1044821244.db2.gz GIKIYWBFNDYZMA-UHFFFAOYSA-N 1 2 317.433 4.002 20 0 DIADLO CCOc1ccc(C[N@@H+](Cc2nnc(C(C)C)o2)C(C)C)cc1 ZINC000263727693 1044821268 /nfs/dbraw/zinc/82/12/68/1044821268.db2.gz GIKIYWBFNDYZMA-UHFFFAOYSA-N 1 2 317.433 4.002 20 0 DIADLO Fc1ccc2c(c1)CCCN2Cc1c[nH+]cn1Cc1ccccc1 ZINC000445814583 1044827157 /nfs/dbraw/zinc/82/71/57/1044827157.db2.gz ZPPGHFQCBLYHGD-UHFFFAOYSA-N 1 2 321.399 4.023 20 0 DIADLO CC[N@H+](Cc1nnc(C(C)C)o1)Cc1ccc2ccccc2c1 ZINC000263798275 1044827940 /nfs/dbraw/zinc/82/79/40/1044827940.db2.gz SGQPQSOALGYZNP-UHFFFAOYSA-N 1 2 309.413 4.368 20 0 DIADLO CC[N@@H+](Cc1nnc(C(C)C)o1)Cc1ccc2ccccc2c1 ZINC000263798275 1044827962 /nfs/dbraw/zinc/82/79/62/1044827962.db2.gz SGQPQSOALGYZNP-UHFFFAOYSA-N 1 2 309.413 4.368 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000370242661 1044831118 /nfs/dbraw/zinc/83/11/18/1044831118.db2.gz KKTXSJIUGQBJFA-QGZVFWFLSA-N 1 2 317.477 4.112 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000370242661 1044831142 /nfs/dbraw/zinc/83/11/42/1044831142.db2.gz KKTXSJIUGQBJFA-QGZVFWFLSA-N 1 2 317.477 4.112 20 0 DIADLO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1noc(C2CCCCC2)n1 ZINC000445880826 1044840760 /nfs/dbraw/zinc/84/07/60/1044840760.db2.gz PTFZDDHMJRUEMN-LBPRGKRZSA-N 1 2 319.371 4.184 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](C)Cc1cscn1 ZINC000264004261 1044842408 /nfs/dbraw/zinc/84/24/08/1044842408.db2.gz GTLJFFUHWFHKBB-JTQLQIEISA-N 1 2 300.349 4.355 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)Cc1cscn1 ZINC000264004261 1044842417 /nfs/dbraw/zinc/84/24/17/1044842417.db2.gz GTLJFFUHWFHKBB-JTQLQIEISA-N 1 2 300.349 4.355 20 0 DIADLO c1nc(C[N@H+](Cc2cccc(-c3cccnc3)c2)C2CC2)cs1 ZINC000129913596 1044852989 /nfs/dbraw/zinc/85/29/89/1044852989.db2.gz JMQHIKUMPLZYMG-UHFFFAOYSA-N 1 2 321.449 4.370 20 0 DIADLO c1nc(C[N@@H+](Cc2cccc(-c3cccnc3)c2)C2CC2)cs1 ZINC000129913596 1044853016 /nfs/dbraw/zinc/85/30/16/1044853016.db2.gz JMQHIKUMPLZYMG-UHFFFAOYSA-N 1 2 321.449 4.370 20 0 DIADLO Cc1cnn(CC[N@@H+]2CCc3cc(Cl)c(Cl)cc3[C@H]2C)c1 ZINC000572504211 1044861079 /nfs/dbraw/zinc/86/10/79/1044861079.db2.gz FUKJDHWIJOGUMT-GFCCVEGCSA-N 1 2 324.255 4.118 20 0 DIADLO Cc1cnn(CC[N@H+]2CCc3cc(Cl)c(Cl)cc3[C@H]2C)c1 ZINC000572504211 1044861103 /nfs/dbraw/zinc/86/11/03/1044861103.db2.gz FUKJDHWIJOGUMT-GFCCVEGCSA-N 1 2 324.255 4.118 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@@](F)(c3ccccc3C)C2)sc1C ZINC000337377525 1044885335 /nfs/dbraw/zinc/88/53/35/1044885335.db2.gz AWUYIAWFKMKHDP-KRWDZBQOSA-N 1 2 304.434 4.139 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@@](F)(c3ccccc3C)C2)sc1C ZINC000337377525 1044885352 /nfs/dbraw/zinc/88/53/52/1044885352.db2.gz AWUYIAWFKMKHDP-KRWDZBQOSA-N 1 2 304.434 4.139 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2cn(-c3ccccc3)nc2C(C)C)no1 ZINC000337555475 1044919075 /nfs/dbraw/zinc/91/90/75/1044919075.db2.gz VTZMURGZUJEDBL-HNNXBMFYSA-N 1 2 324.428 4.143 20 0 DIADLO CC(C)c1nc(C[N@H+](C)C[C@@H]2OCCc3ccccc32)cs1 ZINC000337646727 1044935094 /nfs/dbraw/zinc/93/50/94/1044935094.db2.gz IXTAIIVUBBPNED-KRWDZBQOSA-N 1 2 316.470 4.012 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)C[C@@H]2OCCc3ccccc32)cs1 ZINC000337646727 1044935112 /nfs/dbraw/zinc/93/51/12/1044935112.db2.gz IXTAIIVUBBPNED-KRWDZBQOSA-N 1 2 316.470 4.012 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000373056610 1044938953 /nfs/dbraw/zinc/93/89/53/1044938953.db2.gz KUWNUXURWJJKKY-DLBZAZTESA-N 1 2 319.493 4.123 20 0 DIADLO Cc1cccn2cc(Cc3noc([C@@H](C)CC(C)(C)C)n3)[nH+]c12 ZINC000574556761 1044960988 /nfs/dbraw/zinc/96/09/88/1044960988.db2.gz ZIRRNDYZNWABOT-ZDUSSCGKSA-N 1 2 312.417 4.156 20 0 DIADLO Cc1ccc(C[NH2+]Cc2nc(-c3ccccc3F)cs2)o1 ZINC000373351091 1044968224 /nfs/dbraw/zinc/96/82/24/1044968224.db2.gz RZHATXHLHIOLEB-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO CCC[N@H+](Cc1ccc(F)cc1)[C@@H](C)c1nc(C2CC2)no1 ZINC000411204204 1044983921 /nfs/dbraw/zinc/98/39/21/1044983921.db2.gz UXJHCZWSQPVFCP-LBPRGKRZSA-N 1 2 303.381 4.059 20 0 DIADLO CCC[N@@H+](Cc1ccc(F)cc1)[C@@H](C)c1nc(C2CC2)no1 ZINC000411204204 1044983938 /nfs/dbraw/zinc/98/39/38/1044983938.db2.gz UXJHCZWSQPVFCP-LBPRGKRZSA-N 1 2 303.381 4.059 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cc(F)c(F)cc1F)c1nc(C)cs1 ZINC000136217604 1044986419 /nfs/dbraw/zinc/98/64/19/1044986419.db2.gz QQSWAPSVUVILKW-OAHLLOKOSA-N 1 2 314.376 4.284 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@]3(C)C[C@@H]3c3ccccc3)cc2[nH+]1 ZINC000411240114 1044986785 /nfs/dbraw/zinc/98/67/85/1044986785.db2.gz SEIFCRQQPTXXKR-BEFAXECRSA-N 1 2 305.381 4.004 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@@H+]2[C@H](C)c2nc(C3CC3)no2)o1 ZINC000265375524 1044991733 /nfs/dbraw/zinc/99/17/33/1044991733.db2.gz BJQKUIFVYJJLBU-RISCZKNCSA-N 1 2 301.390 4.001 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@H+]2[C@H](C)c2nc(C3CC3)no2)o1 ZINC000265375524 1044991748 /nfs/dbraw/zinc/99/17/48/1044991748.db2.gz BJQKUIFVYJJLBU-RISCZKNCSA-N 1 2 301.390 4.001 20 0 DIADLO Cc1ccc2ncc(C[N@@H+]3CCO[C@@H](c4ccsc4)C3)cc2c1 ZINC000411314609 1044995275 /nfs/dbraw/zinc/99/52/75/1044995275.db2.gz FBFLETSVZSXROA-LJQANCHMSA-N 1 2 324.449 4.178 20 0 DIADLO Cc1ccc2ncc(C[N@H+]3CCO[C@@H](c4ccsc4)C3)cc2c1 ZINC000411314609 1044995291 /nfs/dbraw/zinc/99/52/91/1044995291.db2.gz FBFLETSVZSXROA-LJQANCHMSA-N 1 2 324.449 4.178 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccccc2Oc2ccccc2C)[nH]c1C ZINC000575331055 1044996263 /nfs/dbraw/zinc/99/62/63/1044996263.db2.gz JONOKAXRKMCRIO-UHFFFAOYSA-N 1 2 321.424 4.417 20 0 DIADLO Cc1ccc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)cc1F ZINC000373691355 1045000471 /nfs/dbraw/zinc/00/04/71/1045000471.db2.gz ABCHEOUNTGIESR-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)CCc1cccs1 ZINC000373700883 1045002827 /nfs/dbraw/zinc/00/28/27/1045002827.db2.gz KCISFMIGJVTKOA-UHFFFAOYSA-N 1 2 311.410 4.018 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cc2ccccc2o1 ZINC000373701297 1045003914 /nfs/dbraw/zinc/00/39/14/1045003914.db2.gz LLJMKORDZBMNJJ-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)/C=C/c1ccsc1 ZINC000373694646 1045004072 /nfs/dbraw/zinc/00/40/72/1045004072.db2.gz HOIMNAHTMDASQU-HWKANZROSA-N 1 2 309.394 4.099 20 0 DIADLO Fc1cc(-c2ncco2)ccc1C[N@H+](Cc1cccnc1)C1CC1 ZINC000411425658 1045004919 /nfs/dbraw/zinc/00/49/19/1045004919.db2.gz XVRPMLHTBRIZHQ-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1cc(-c2ncco2)ccc1C[N@@H+](Cc1cccnc1)C1CC1 ZINC000411425658 1045004926 /nfs/dbraw/zinc/00/49/26/1045004926.db2.gz XVRPMLHTBRIZHQ-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)s1 ZINC000575943546 1045020934 /nfs/dbraw/zinc/02/09/34/1045020934.db2.gz ZAWUZESOAWUBIY-HNNXBMFYSA-N 1 2 315.486 4.419 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)s1 ZINC000575943546 1045020940 /nfs/dbraw/zinc/02/09/40/1045020940.db2.gz ZAWUZESOAWUBIY-HNNXBMFYSA-N 1 2 315.486 4.419 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)[nH]1 ZINC000411824574 1045031292 /nfs/dbraw/zinc/03/12/92/1045031292.db2.gz QRNPTFGHFCLLQA-RHSMWYFYSA-N 1 2 310.445 4.182 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)[nH]1 ZINC000411824574 1045031305 /nfs/dbraw/zinc/03/13/05/1045031305.db2.gz QRNPTFGHFCLLQA-RHSMWYFYSA-N 1 2 310.445 4.182 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CCSC3(CCC3)CC2)n1 ZINC000411874364 1045031833 /nfs/dbraw/zinc/03/18/33/1045031833.db2.gz ZXTRBLDEYBVZKF-UHFFFAOYSA-N 1 2 322.421 4.024 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CCSC3(CCC3)CC2)n1 ZINC000411874364 1045031846 /nfs/dbraw/zinc/03/18/46/1045031846.db2.gz ZXTRBLDEYBVZKF-UHFFFAOYSA-N 1 2 322.421 4.024 20 0 DIADLO CC1(C)CCC[C@H]1c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000576146146 1045036351 /nfs/dbraw/zinc/03/63/51/1045036351.db2.gz KHQOGEWOBUEPGC-HNNXBMFYSA-N 1 2 308.385 4.216 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](CCSCc1ccccc1)C2 ZINC000411930657 1045038172 /nfs/dbraw/zinc/03/81/72/1045038172.db2.gz BIUUUDUVVPPWLB-UHFFFAOYSA-N 1 2 311.450 4.138 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](CCSCc1ccccc1)C2 ZINC000411930657 1045038184 /nfs/dbraw/zinc/03/81/84/1045038184.db2.gz BIUUUDUVVPPWLB-UHFFFAOYSA-N 1 2 311.450 4.138 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2ccccc2F)c2ccco2)cc1 ZINC000576192593 1045040540 /nfs/dbraw/zinc/04/05/40/1045040540.db2.gz KSRHABWXJPCHDJ-IBGZPJMESA-N 1 2 311.356 4.307 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](c2ccc(CC(C)C)cc2)C2CC2)o1 ZINC000152635857 1045043328 /nfs/dbraw/zinc/04/33/28/1045043328.db2.gz ZSMMRSUACKYCRW-IBGZPJMESA-N 1 2 313.445 4.071 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@@H](C)c1cnn(C(C)C)c1)c1ccco1 ZINC000152630628 1045043619 /nfs/dbraw/zinc/04/36/19/1045043619.db2.gz IMLPCORZOZSPKF-RDJZCZTQSA-N 1 2 319.449 4.122 20 0 DIADLO CC[N@H+](Cc1occc1C)Cc1ccc(Oc2ccccc2)nn1 ZINC000412023592 1045049486 /nfs/dbraw/zinc/04/94/86/1045049486.db2.gz CTNANRQUKYOAEO-UHFFFAOYSA-N 1 2 323.396 4.192 20 0 DIADLO CC[N@@H+](Cc1occc1C)Cc1ccc(Oc2ccccc2)nn1 ZINC000412023592 1045049498 /nfs/dbraw/zinc/04/94/98/1045049498.db2.gz CTNANRQUKYOAEO-UHFFFAOYSA-N 1 2 323.396 4.192 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1scnc1C1CC1)CC2 ZINC000459712918 1045051123 /nfs/dbraw/zinc/05/11/23/1045051123.db2.gz SAGVHELRUCZGQF-UHFFFAOYSA-N 1 2 304.846 4.232 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1scnc1C1CC1)CC2 ZINC000459712918 1045051135 /nfs/dbraw/zinc/05/11/35/1045051135.db2.gz SAGVHELRUCZGQF-UHFFFAOYSA-N 1 2 304.846 4.232 20 0 DIADLO CCC(CC)[C@@H](NC(=O)C[C@H](C)n1cc[nH+]c1)c1ccccc1 ZINC000576588626 1045065492 /nfs/dbraw/zinc/06/54/92/1045065492.db2.gz VIHJIRWARKDKCJ-HNAYVOBHSA-N 1 2 313.445 4.128 20 0 DIADLO CC(=O)Nc1ccccc1C[N@H+](C)Cc1cc(Cl)ccc1F ZINC000446976741 1045080408 /nfs/dbraw/zinc/08/04/08/1045080408.db2.gz XZFMNTLYZDDGLC-UHFFFAOYSA-N 1 2 320.795 4.070 20 0 DIADLO CC(=O)Nc1ccccc1C[N@@H+](C)Cc1cc(Cl)ccc1F ZINC000446976741 1045080421 /nfs/dbraw/zinc/08/04/21/1045080421.db2.gz XZFMNTLYZDDGLC-UHFFFAOYSA-N 1 2 320.795 4.070 20 0 DIADLO C[N@H+](Cc1cc(C(C)(C)C)n[nH]1)Cc1ccc(F)c(Cl)c1 ZINC000447063569 1045091516 /nfs/dbraw/zinc/09/15/16/1045091516.db2.gz NQPGNJCGRTXLHQ-UHFFFAOYSA-N 1 2 309.816 4.132 20 0 DIADLO C[N@@H+](Cc1cc(C(C)(C)C)n[nH]1)Cc1ccc(F)c(Cl)c1 ZINC000447063569 1045091532 /nfs/dbraw/zinc/09/15/32/1045091532.db2.gz NQPGNJCGRTXLHQ-UHFFFAOYSA-N 1 2 309.816 4.132 20 0 DIADLO C[NH+](C)[C@@H](c1nc(C2CCC(C)(C)CC2)no1)c1ccccc1 ZINC000576984898 1045092252 /nfs/dbraw/zinc/09/22/52/1045092252.db2.gz XSPHMQOUUNSODQ-MRXNPFEDSA-N 1 2 313.445 4.404 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@@H](c2ccccc2)O[C@@H](C)C1 ZINC000428469346 1045099324 /nfs/dbraw/zinc/09/93/24/1045099324.db2.gz JKMGVDFNSTWNEY-KSSFIOAISA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@@H](c2ccccc2)O[C@@H](C)C1 ZINC000428469346 1045099336 /nfs/dbraw/zinc/09/93/36/1045099336.db2.gz JKMGVDFNSTWNEY-KSSFIOAISA-N 1 2 314.429 4.068 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@H](c3ccccc3)[C@@H](C)C2)no1 ZINC000525638875 1045103185 /nfs/dbraw/zinc/10/31/85/1045103185.db2.gz HAVLIIYOQGUPRE-RDJZCZTQSA-N 1 2 313.445 4.038 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@H](c3ccccc3)[C@@H](C)C2)no1 ZINC000525638875 1045103196 /nfs/dbraw/zinc/10/31/96/1045103196.db2.gz HAVLIIYOQGUPRE-RDJZCZTQSA-N 1 2 313.445 4.038 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cc(-c2cccs2)on1 ZINC000525637047 1045104367 /nfs/dbraw/zinc/10/43/67/1045104367.db2.gz WWGSEWOPBLVVOE-CYBMUJFWSA-N 1 2 310.422 4.350 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cc(-c2cccs2)on1 ZINC000525637047 1045104377 /nfs/dbraw/zinc/10/43/77/1045104377.db2.gz WWGSEWOPBLVVOE-CYBMUJFWSA-N 1 2 310.422 4.350 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC=C(c3ccccn3)C2)cs1 ZINC000577258753 1045110568 /nfs/dbraw/zinc/11/05/68/1045110568.db2.gz DJOASHHMLCJQIV-UHFFFAOYSA-N 1 2 313.470 4.170 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC=C(c3ccccn3)C2)cs1 ZINC000577258753 1045110572 /nfs/dbraw/zinc/11/05/72/1045110572.db2.gz DJOASHHMLCJQIV-UHFFFAOYSA-N 1 2 313.470 4.170 20 0 DIADLO Cc1cccc(C)c1NC(=O)[C@H](C)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000361057994 1045112991 /nfs/dbraw/zinc/11/29/91/1045112991.db2.gz AWNOJVOTIGPALW-CVEARBPZSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1cccc(C)c1NC(=O)[C@H](C)[N@H+]1Cc2ccccc2[C@H]1C ZINC000361057994 1045112995 /nfs/dbraw/zinc/11/29/95/1045112995.db2.gz AWNOJVOTIGPALW-CVEARBPZSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1cc(NCc2ccc(Br)cc2)nc(C(C)C)[nH+]1 ZINC000048019519 1045123047 /nfs/dbraw/zinc/12/30/47/1045123047.db2.gz DVQNBZMRCSGANW-UHFFFAOYSA-N 1 2 320.234 4.283 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2nc(C(C)(C)C)cs2)cc1C ZINC000447379009 1045125887 /nfs/dbraw/zinc/12/58/87/1045125887.db2.gz FTXBZZDSDFDPSW-UHFFFAOYSA-N 1 2 318.486 4.390 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2nc(C(C)(C)C)cs2)cc1C ZINC000447379009 1045125889 /nfs/dbraw/zinc/12/58/89/1045125889.db2.gz FTXBZZDSDFDPSW-UHFFFAOYSA-N 1 2 318.486 4.390 20 0 DIADLO CSc1ccc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)cc1 ZINC000430035518 1045130768 /nfs/dbraw/zinc/13/07/68/1045130768.db2.gz MUTIWTFMSOXIDE-UHFFFAOYSA-N 1 2 315.335 4.255 20 0 DIADLO CC(C)(C)c1ccc(-c2noc([C@@H]3C[C@H]3c3c[nH]c[nH+]3)n2)cc1 ZINC000924043900 1045146800 /nfs/dbraw/zinc/14/68/00/1045146800.db2.gz FNXRXURYQVMGRA-ZIAGYGMSSA-N 1 2 308.385 4.028 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)s1 ZINC000577689041 1045157132 /nfs/dbraw/zinc/15/71/32/1045157132.db2.gz NYPWPOVAQKXXFL-QGZVFWFLSA-N 1 2 323.408 4.162 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)s1 ZINC000577689041 1045157142 /nfs/dbraw/zinc/15/71/42/1045157142.db2.gz NYPWPOVAQKXXFL-QGZVFWFLSA-N 1 2 323.408 4.162 20 0 DIADLO CCn1nc(C)c([C@H](C)[NH2+]C(c2ccccc2)c2ccccc2)n1 ZINC000924526436 1045173755 /nfs/dbraw/zinc/17/37/55/1045173755.db2.gz DUSWOBDXBQVXLB-HNNXBMFYSA-N 1 2 320.440 4.047 20 0 DIADLO C=Cn1cc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000447793867 1045178024 /nfs/dbraw/zinc/17/80/24/1045178024.db2.gz GDWBYABBFLYNKX-ZDUSSCGKSA-N 1 2 301.821 4.363 20 0 DIADLO C=Cn1cc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000447793867 1045178031 /nfs/dbraw/zinc/17/80/31/1045178031.db2.gz GDWBYABBFLYNKX-ZDUSSCGKSA-N 1 2 301.821 4.363 20 0 DIADLO Cc1csc(C[NH2+][C@H](Cc2ccccc2C)c2ccco2)n1 ZINC000924614320 1045183259 /nfs/dbraw/zinc/18/32/59/1045183259.db2.gz JETZIFJCXZMEDB-MRXNPFEDSA-N 1 2 312.438 4.427 20 0 DIADLO Cc1cccc(COc2ccc(C[NH2+][C@@H](C)c3ncco3)cc2)c1 ZINC000924653040 1045187555 /nfs/dbraw/zinc/18/75/55/1045187555.db2.gz NPWLFORWSOEHBE-INIZCTEOSA-N 1 2 322.408 4.413 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@@H]1CCSc2c(F)cccc21 ZINC000924650597 1045187842 /nfs/dbraw/zinc/18/78/42/1045187842.db2.gz ZYNNCNDKXBLWJH-KGLIPLIRSA-N 1 2 318.417 4.326 20 0 DIADLO CCO[C@@H]1C[C@H](Nc2ccc([NH+]3CCCC3)cc2)C12CCCC2 ZINC000320737131 1045188439 /nfs/dbraw/zinc/18/84/39/1045188439.db2.gz MZJKCSUCXDXTJL-RBUKOAKNSA-N 1 2 314.473 4.437 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cnn(C2CCC2)c1 ZINC000924720687 1045194602 /nfs/dbraw/zinc/19/46/02/1045194602.db2.gz KFSLTCKIBBTRTC-RYUDHWBXSA-N 1 2 305.372 4.298 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2csc(C(F)(F)F)c2)cs1 ZINC000924723640 1045194631 /nfs/dbraw/zinc/19/46/31/1045194631.db2.gz SVOBGWSZASSDBV-ZETCQYMHSA-N 1 2 306.378 4.383 20 0 DIADLO Clc1ccc([C@@H](CNc2cccc[nH+]2)OCC2CC2)cc1 ZINC000577972050 1045195533 /nfs/dbraw/zinc/19/55/33/1045195533.db2.gz IDMDXBORENFIPG-MRXNPFEDSA-N 1 2 302.805 4.315 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(Cl)ccc(F)c1Cl)c1ccnnc1 ZINC000924719908 1045195535 /nfs/dbraw/zinc/19/55/35/1045195535.db2.gz BGIKKHFBHONXEQ-RKDXNWHRSA-N 1 2 314.191 4.334 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H](C)c2ncco2)ccc1OCC(C)C ZINC000924815409 1045200908 /nfs/dbraw/zinc/20/09/08/1045200908.db2.gz QEDQDGGBYWZXRH-KBPBESRZSA-N 1 2 318.417 4.130 20 0 DIADLO CC[C@@H](C)Oc1ccc(NC(=O)c2ccn3c(C)c[nH+]c3c2)cc1 ZINC000578081050 1045204867 /nfs/dbraw/zinc/20/48/67/1045204867.db2.gz KBPZFPCSEXIHTO-CQSZACIVSA-N 1 2 323.396 4.072 20 0 DIADLO C[N@H+](Cc1cc(Br)ccc1Cl)CC1(F)CC1 ZINC000527237327 1045205830 /nfs/dbraw/zinc/20/58/30/1045205830.db2.gz OTCGTFPAXFUZCI-UHFFFAOYSA-N 1 2 306.606 4.036 20 0 DIADLO C[N@@H+](Cc1cc(Br)ccc1Cl)CC1(F)CC1 ZINC000527237327 1045205835 /nfs/dbraw/zinc/20/58/35/1045205835.db2.gz OTCGTFPAXFUZCI-UHFFFAOYSA-N 1 2 306.606 4.036 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)C[C@H](C2CC2)O1 ZINC000527239215 1045206697 /nfs/dbraw/zinc/20/66/97/1045206697.db2.gz VGZJINVDUTVURM-CXAGYDPISA-N 1 2 320.502 4.190 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)C[C@H](C2CC2)O1 ZINC000527239215 1045206708 /nfs/dbraw/zinc/20/67/08/1045206708.db2.gz VGZJINVDUTVURM-CXAGYDPISA-N 1 2 320.502 4.190 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1cnn(C2CCC2)c1 ZINC000924897264 1045208995 /nfs/dbraw/zinc/20/89/95/1045208995.db2.gz GLNCAHIKGDRYLR-CQSZACIVSA-N 1 2 322.412 4.114 20 0 DIADLO CC[C@@H]([NH2+][C@H]1CCCc2oc(C)nc21)c1ccc(F)cc1F ZINC000925099849 1045226450 /nfs/dbraw/zinc/22/64/50/1045226450.db2.gz UKKFNJPYIQZBTQ-CABCVRRESA-N 1 2 306.356 4.380 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@@H](C)c2csc(C(F)(F)F)c2)n1 ZINC000925108361 1045228221 /nfs/dbraw/zinc/22/82/21/1045228221.db2.gz VQBJGDNMQQRVDD-JTQLQIEISA-N 1 2 317.380 4.395 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(F)c1F)c1nccn1-c1ccccc1 ZINC000578294979 1045229224 /nfs/dbraw/zinc/22/92/24/1045229224.db2.gz ZDDSCHZLDJBPFL-ZDUSSCGKSA-N 1 2 313.351 4.001 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+]Cc2ccc(C(F)F)cc2)s1 ZINC000527528822 1045234368 /nfs/dbraw/zinc/23/43/68/1045234368.db2.gz LSKCHPNCEDGJJA-UHFFFAOYSA-N 1 2 311.401 4.063 20 0 DIADLO CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@@H](C)c1nonc1C ZINC000925207935 1045235398 /nfs/dbraw/zinc/23/53/98/1045235398.db2.gz NZOYZBFDERVEKG-BBRMVZONSA-N 1 2 317.433 4.215 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@H+](Cc2nc3ccccc3s2)C1 ZINC000578455125 1045244120 /nfs/dbraw/zinc/24/41/20/1045244120.db2.gz RFBVYBBDBNQGEZ-SFHVURJKSA-N 1 2 312.413 4.367 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@@H+](Cc2nc3ccccc3s2)C1 ZINC000578455125 1045244127 /nfs/dbraw/zinc/24/41/27/1045244127.db2.gz RFBVYBBDBNQGEZ-SFHVURJKSA-N 1 2 312.413 4.367 20 0 DIADLO CCC[C@H](Cc1ccccc1)Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000578470826 1045245706 /nfs/dbraw/zinc/24/57/06/1045245706.db2.gz UXJUFLWKDFTDJY-LJQANCHMSA-N 1 2 320.440 4.150 20 0 DIADLO Cc1cc(C)c(NC(=O)CCCc2ccc(F)cc2)c(C)[nH+]1 ZINC000578519298 1045250388 /nfs/dbraw/zinc/25/03/88/1045250388.db2.gz VLRZHVGGFYMKBN-UHFFFAOYSA-N 1 2 300.377 4.107 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@@H]1C[C@H]1C1CC1 ZINC000527681685 1045253530 /nfs/dbraw/zinc/25/35/30/1045253530.db2.gz CCGABQFZRLSHSG-WBAXXEDZSA-N 1 2 319.452 4.448 20 0 DIADLO Cc1csc(C[NH2+]C(C)(C)c2nc3ccccc3s2)n1 ZINC000527745454 1045257988 /nfs/dbraw/zinc/25/79/88/1045257988.db2.gz QPYFRDBPZJIJQN-UHFFFAOYSA-N 1 2 303.456 4.086 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@H]2c2ccccn2)cc(C(F)(F)F)c1 ZINC000578704496 1045266942 /nfs/dbraw/zinc/26/69/42/1045266942.db2.gz DKNSNVBWRZUBPX-INIZCTEOSA-N 1 2 322.330 4.143 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@H]2c2ccccn2)cc(C(F)(F)F)c1 ZINC000578704496 1045266952 /nfs/dbraw/zinc/26/69/52/1045266952.db2.gz DKNSNVBWRZUBPX-INIZCTEOSA-N 1 2 322.330 4.143 20 0 DIADLO CC(C)c1nnc([C@H](C)[NH2+][C@H]2CCc3cc(F)c(Cl)cc32)[nH]1 ZINC000527875445 1045276120 /nfs/dbraw/zinc/27/61/20/1045276120.db2.gz DACQAXIQKJBIFM-XPTSAGLGSA-N 1 2 322.815 4.059 20 0 DIADLO CCC(C)(CC)C(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC000681090909 1045277125 /nfs/dbraw/zinc/27/71/25/1045277125.db2.gz RZKBHODIXXXIOD-ZDUSSCGKSA-N 1 2 323.506 4.140 20 0 DIADLO CCC(C)(CC)C(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC000681090909 1045277133 /nfs/dbraw/zinc/27/71/33/1045277133.db2.gz RZKBHODIXXXIOD-ZDUSSCGKSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1cnc(C2CCN(c3[nH+]ccc4ccccc43)CC2)s1 ZINC000527979450 1045287818 /nfs/dbraw/zinc/28/78/18/1045287818.db2.gz HCTQXGVNTCORDZ-UHFFFAOYSA-N 1 2 309.438 4.384 20 0 DIADLO c1ccc2c(c1)CO[C@@]21CCCN(c2[nH+]ccc3ccccc32)C1 ZINC000527967734 1045289659 /nfs/dbraw/zinc/28/96/59/1045289659.db2.gz RFTBIYCORXNLHA-OAQYLSRUSA-N 1 2 316.404 4.261 20 0 DIADLO COc1cc(Cl)ccc1[C@@H](C)[NH2+][C@@H](C)c1ncccc1F ZINC000528037951 1045296041 /nfs/dbraw/zinc/29/60/41/1045296041.db2.gz NCZUJHVBPFDXSM-MNOVXSKESA-N 1 2 308.784 4.295 20 0 DIADLO COc1ccc(C2CCN(c3[nH+]ccc4ccccc43)CC2)nc1 ZINC000528043633 1045297614 /nfs/dbraw/zinc/29/76/14/1045297614.db2.gz QQOTUKKSWUQIJA-UHFFFAOYSA-N 1 2 319.408 4.022 20 0 DIADLO Clc1cnc(C2CCN(c3[nH+]ccc4ccccc43)CC2)nc1 ZINC000528044265 1045299185 /nfs/dbraw/zinc/29/91/85/1045299185.db2.gz VZGDIFLKWDDIFN-UHFFFAOYSA-N 1 2 324.815 4.062 20 0 DIADLO Clc1cccc2c(NCc3noc4c3CCCC4)cc[nH+]c12 ZINC000579279997 1045304600 /nfs/dbraw/zinc/30/46/00/1045304600.db2.gz FUKNAAZJVAWSPW-UHFFFAOYSA-N 1 2 313.788 4.367 20 0 DIADLO O=C(c1cccc(-n2cc[nH+]c2)c1)N1CCC2(CCCCC2)CC1 ZINC000117644763 1045310759 /nfs/dbraw/zinc/31/07/59/1045310759.db2.gz IIDXHZZRRJCLDM-UHFFFAOYSA-N 1 2 323.440 4.059 20 0 DIADLO C=C(C)[C@H]([NH2+]Cc1cnc(Cl)s1)c1ccc(F)c(F)c1 ZINC000187767270 1045330965 /nfs/dbraw/zinc/33/09/65/1045330965.db2.gz ZAHFFGKKNMQSJL-ZDUSSCGKSA-N 1 2 314.788 4.482 20 0 DIADLO Fc1c(Br)cccc1C[NH+]1CCC(C(F)F)CC1 ZINC000449028511 1045335504 /nfs/dbraw/zinc/33/55/04/1045335504.db2.gz LZWOPBBOENYFSF-UHFFFAOYSA-N 1 2 322.168 4.065 20 0 DIADLO COc1cc2ccccc2cc1C[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000449038115 1045337161 /nfs/dbraw/zinc/33/71/61/1045337161.db2.gz ROQDBLRFFZEDSI-FQEVSTJZSA-N 1 2 323.392 4.015 20 0 DIADLO COc1cc2ccccc2cc1C[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000449038115 1045337162 /nfs/dbraw/zinc/33/71/62/1045337162.db2.gz ROQDBLRFFZEDSI-FQEVSTJZSA-N 1 2 323.392 4.015 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCC34CCCC4)cc2)CCO1 ZINC000189213327 1045343580 /nfs/dbraw/zinc/34/35/80/1045343580.db2.gz ZYFHQLXCLHHGKC-CRAIPNDOSA-N 1 2 300.446 4.046 20 0 DIADLO Fc1ccc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)cn1 ZINC000779166266 1045348742 /nfs/dbraw/zinc/34/87/42/1045348742.db2.gz YCCYHMNTXRGMNM-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Fc1ccc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)cn1 ZINC000779166266 1045348744 /nfs/dbraw/zinc/34/87/44/1045348744.db2.gz YCCYHMNTXRGMNM-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO CC(C)(C)c1csc(C[NH2+]Cc2ccnn2C2CCCC2)n1 ZINC000449132274 1045349839 /nfs/dbraw/zinc/34/98/39/1045349839.db2.gz TXOYGIAKHKZPOS-UHFFFAOYSA-N 1 2 318.490 4.042 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1cccnc1C(F)(F)F ZINC000528400916 1045351093 /nfs/dbraw/zinc/35/10/93/1045351093.db2.gz SXPJJFCQEFRSRB-OAHLLOKOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1cccnc1C(F)(F)F ZINC000528400916 1045351097 /nfs/dbraw/zinc/35/10/97/1045351097.db2.gz SXPJJFCQEFRSRB-OAHLLOKOSA-N 1 2 323.362 4.166 20 0 DIADLO Clc1ccccc1O[C@H]1CC[N@@H+](Cc2ncccc2Cl)C1 ZINC000528420082 1045352941 /nfs/dbraw/zinc/35/29/41/1045352941.db2.gz JIXGSIZXJZRQRI-LBPRGKRZSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccccc1O[C@H]1CC[N@H+](Cc2ncccc2Cl)C1 ZINC000528420082 1045352946 /nfs/dbraw/zinc/35/29/46/1045352946.db2.gz JIXGSIZXJZRQRI-LBPRGKRZSA-N 1 2 323.223 4.042 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2nc3cc(C)ccc3s2)n1 ZINC000528419479 1045353580 /nfs/dbraw/zinc/35/35/80/1045353580.db2.gz YLEBCQFQODEIPV-UHFFFAOYSA-N 1 2 317.483 4.395 20 0 DIADLO OCCCC1CC[NH+](Cc2cc(Cl)sc2Cl)CC1 ZINC000449231848 1045365711 /nfs/dbraw/zinc/36/57/11/1045365711.db2.gz FWYYSNTUODDPQM-UHFFFAOYSA-N 1 2 308.274 4.039 20 0 DIADLO COc1cnccc1[C@H](C)[NH2+]Cc1cc(Cl)sc1Cl ZINC000449268980 1045369863 /nfs/dbraw/zinc/36/98/63/1045369863.db2.gz KUTAJDUBXNAFMB-QMMMGPOBSA-N 1 2 317.241 4.309 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1cccc(C)c1F ZINC000449297538 1045372212 /nfs/dbraw/zinc/37/22/12/1045372212.db2.gz DGUICXSOCDLZRG-INIZCTEOSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1cccc(C)c1F ZINC000449297538 1045372217 /nfs/dbraw/zinc/37/22/17/1045372217.db2.gz DGUICXSOCDLZRG-INIZCTEOSA-N 1 2 301.409 4.078 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1ccnn1C1CCCC1 ZINC000449292539 1045374495 /nfs/dbraw/zinc/37/44/95/1045374495.db2.gz DGLVSBPSMWONSH-UHFFFAOYSA-N 1 2 315.486 4.352 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1ccnn1C1CCCC1 ZINC000449292539 1045374500 /nfs/dbraw/zinc/37/45/00/1045374500.db2.gz DGLVSBPSMWONSH-UHFFFAOYSA-N 1 2 315.486 4.352 20 0 DIADLO COc1cc2ccccc2cc1C[NH2+]Cc1noc2c1CCCC2 ZINC000449327259 1045375335 /nfs/dbraw/zinc/37/53/35/1045375335.db2.gz CHEKZTALAJAUGW-UHFFFAOYSA-N 1 2 322.408 4.005 20 0 DIADLO c1cn(Cc2ccc(N[C@H]3CCCC34CCCCC4)nc2)c[nH+]1 ZINC000449320959 1045377683 /nfs/dbraw/zinc/37/76/83/1045377683.db2.gz QGYWIFSHQRUJLP-KRWDZBQOSA-N 1 2 310.445 4.241 20 0 DIADLO COc1c(O)cccc1C[NH2+][C@H](C)c1ccc(F)cc1Cl ZINC000449348658 1045379004 /nfs/dbraw/zinc/37/90/04/1045379004.db2.gz MWKGGPBZLNOAHM-SNVBAGLBSA-N 1 2 309.768 4.044 20 0 DIADLO Cc1oc2ccccc2c1C[N@@H+]1CC(C)(C)[C@@H]1c1nccn1C ZINC000449413448 1045388518 /nfs/dbraw/zinc/38/85/18/1045388518.db2.gz IXUSPXPROBRBSQ-KRWDZBQOSA-N 1 2 309.413 4.058 20 0 DIADLO Cc1oc2ccccc2c1C[N@H+]1CC(C)(C)[C@@H]1c1nccn1C ZINC000449413448 1045388522 /nfs/dbraw/zinc/38/85/22/1045388522.db2.gz IXUSPXPROBRBSQ-KRWDZBQOSA-N 1 2 309.413 4.058 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC2CC1(c1nc(C)no1)C2 ZINC000528630532 1045390594 /nfs/dbraw/zinc/39/05/94/1045390594.db2.gz FAJHTVPQDYPUKI-VXKCQOAXSA-N 1 2 317.820 4.104 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CC2CC1(c1nc(C)no1)C2 ZINC000528630532 1045390596 /nfs/dbraw/zinc/39/05/96/1045390596.db2.gz FAJHTVPQDYPUKI-VXKCQOAXSA-N 1 2 317.820 4.104 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](c2ccccn2)C2CCC2)cs1 ZINC000528652276 1045393295 /nfs/dbraw/zinc/39/32/95/1045393295.db2.gz UDJLFBKZPCNGJA-QGZVFWFLSA-N 1 2 301.459 4.122 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000449459825 1045395405 /nfs/dbraw/zinc/39/54/05/1045395405.db2.gz MDSSVTKERIQBLI-KOLCDFICSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1csc(C2CC2)n1 ZINC000449459825 1045395408 /nfs/dbraw/zinc/39/54/08/1045395408.db2.gz MDSSVTKERIQBLI-KOLCDFICSA-N 1 2 304.381 4.183 20 0 DIADLO Cc1ccnc(C[N@H+]2CC=C(c3ccc(Cl)cc3C)CC2)n1 ZINC000528742346 1045408110 /nfs/dbraw/zinc/40/81/10/1045408110.db2.gz UVMIQYPXBVKYGX-UHFFFAOYSA-N 1 2 313.832 4.036 20 0 DIADLO Cc1ccnc(C[N@@H+]2CC=C(c3ccc(Cl)cc3C)CC2)n1 ZINC000528742346 1045408114 /nfs/dbraw/zinc/40/81/14/1045408114.db2.gz UVMIQYPXBVKYGX-UHFFFAOYSA-N 1 2 313.832 4.036 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1csc(-c2cccs2)n1 ZINC000528762404 1045408767 /nfs/dbraw/zinc/40/87/67/1045408767.db2.gz LWGRXHKXYGKVBR-SNVBAGLBSA-N 1 2 314.426 4.491 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1csc(-c2cccs2)n1 ZINC000528762404 1045408769 /nfs/dbraw/zinc/40/87/69/1045408769.db2.gz LWGRXHKXYGKVBR-SNVBAGLBSA-N 1 2 314.426 4.491 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1CC(=O)Nc1ccccc1C(C)(C)C ZINC000528769478 1045411682 /nfs/dbraw/zinc/41/16/82/1045411682.db2.gz QLSOMAPQBBDVGR-CYBMUJFWSA-N 1 2 324.415 4.042 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1CC(=O)Nc1ccccc1C(C)(C)C ZINC000528769478 1045411683 /nfs/dbraw/zinc/41/16/83/1045411683.db2.gz QLSOMAPQBBDVGR-CYBMUJFWSA-N 1 2 324.415 4.042 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(-c2ccccc2F)o1 ZINC000449563943 1045414758 /nfs/dbraw/zinc/41/47/58/1045414758.db2.gz ZWSBDWDKQLDYCA-ZDUSSCGKSA-N 1 2 313.376 4.153 20 0 DIADLO Cc1cnc(C[N@@H+]2CCCC[C@@H]2c2ccc(Cl)cc2)cn1 ZINC000449570757 1045415583 /nfs/dbraw/zinc/41/55/83/1045415583.db2.gz KHXXXYIJSATNQQ-QGZVFWFLSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1cnc(C[N@H+]2CCCC[C@@H]2c2ccc(Cl)cc2)cn1 ZINC000449570757 1045415586 /nfs/dbraw/zinc/41/55/86/1045415586.db2.gz KHXXXYIJSATNQQ-QGZVFWFLSA-N 1 2 301.821 4.166 20 0 DIADLO COc1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)c(OC)c1 ZINC000449630986 1045422345 /nfs/dbraw/zinc/42/23/45/1045422345.db2.gz JPGCCOFTZPEINL-SFHVURJKSA-N 1 2 313.397 4.024 20 0 DIADLO COc1ccc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)c(OC)c1 ZINC000449630986 1045422348 /nfs/dbraw/zinc/42/23/48/1045422348.db2.gz JPGCCOFTZPEINL-SFHVURJKSA-N 1 2 313.397 4.024 20 0 DIADLO COc1ccc(OC)c(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)c1 ZINC000449634792 1045423866 /nfs/dbraw/zinc/42/38/66/1045423866.db2.gz RYKBOLVGAUDAEZ-GOSISDBHSA-N 1 2 313.397 4.024 20 0 DIADLO COc1ccc(OC)c(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)c1 ZINC000449634792 1045423867 /nfs/dbraw/zinc/42/38/67/1045423867.db2.gz RYKBOLVGAUDAEZ-GOSISDBHSA-N 1 2 313.397 4.024 20 0 DIADLO COc1cccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1OC ZINC000449637347 1045424253 /nfs/dbraw/zinc/42/42/53/1045424253.db2.gz ZDKLRSFMDNLDMH-SFHVURJKSA-N 1 2 313.397 4.024 20 0 DIADLO COc1cccc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1OC ZINC000449637347 1045424256 /nfs/dbraw/zinc/42/42/56/1045424256.db2.gz ZDKLRSFMDNLDMH-SFHVURJKSA-N 1 2 313.397 4.024 20 0 DIADLO CC[N@H+](Cc1nnc(C(C)(C)C)o1)[C@@H](C)c1ccc(F)cc1 ZINC000054341016 1045474779 /nfs/dbraw/zinc/47/47/79/1045474779.db2.gz QDFQNINRAPSXIO-LBPRGKRZSA-N 1 2 305.397 4.089 20 0 DIADLO CC[N@@H+](Cc1nnc(C(C)(C)C)o1)[C@@H](C)c1ccc(F)cc1 ZINC000054341016 1045474783 /nfs/dbraw/zinc/47/47/83/1045474783.db2.gz QDFQNINRAPSXIO-LBPRGKRZSA-N 1 2 305.397 4.089 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1ccc(C(C)=O)cc1 ZINC000450214778 1045476364 /nfs/dbraw/zinc/47/63/64/1045476364.db2.gz ZIYZWMCHCHQPEC-UHFFFAOYSA-N 1 2 317.816 4.183 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1ccc(C(C)=O)cc1 ZINC000450214778 1045476369 /nfs/dbraw/zinc/47/63/69/1045476369.db2.gz ZIYZWMCHCHQPEC-UHFFFAOYSA-N 1 2 317.816 4.183 20 0 DIADLO Cc1c([C@H](C)Nc2cc[nH+]c3cc(F)c(Cl)cc23)cnn1C ZINC000450242640 1045477766 /nfs/dbraw/zinc/47/77/66/1045477766.db2.gz PDWGXVFOOHMOIO-VIFPVBQESA-N 1 2 318.783 4.242 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nnc(C3CC3)s2)cc1C ZINC000450283638 1045484081 /nfs/dbraw/zinc/48/40/81/1045484081.db2.gz DPDUPRAQWPVMMW-MRXNPFEDSA-N 1 2 313.470 4.369 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2nnc(C3CC3)s2)cc1C ZINC000450283638 1045484088 /nfs/dbraw/zinc/48/40/88/1045484088.db2.gz DPDUPRAQWPVMMW-MRXNPFEDSA-N 1 2 313.470 4.369 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2nnc(C3CC3)s2)c(C)c1 ZINC000450289791 1045485099 /nfs/dbraw/zinc/48/50/99/1045485099.db2.gz SNDAYQAXFXPNEN-ZDUSSCGKSA-N 1 2 301.459 4.225 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2nnc(C3CC3)s2)c(C)c1 ZINC000450289791 1045485100 /nfs/dbraw/zinc/48/51/00/1045485100.db2.gz SNDAYQAXFXPNEN-ZDUSSCGKSA-N 1 2 301.459 4.225 20 0 DIADLO CC(C)C[N@H+](Cc1nnc(C2CC2)s1)Cc1ccccc1 ZINC000450310500 1045486643 /nfs/dbraw/zinc/48/66/43/1045486643.db2.gz DVFZPJCDNQBVJN-UHFFFAOYSA-N 1 2 301.459 4.074 20 0 DIADLO CC(C)C[N@@H+](Cc1nnc(C2CC2)s1)Cc1ccccc1 ZINC000450310500 1045486646 /nfs/dbraw/zinc/48/66/46/1045486646.db2.gz DVFZPJCDNQBVJN-UHFFFAOYSA-N 1 2 301.459 4.074 20 0 DIADLO CC[N@H+](Cc1cnns1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000450311424 1045486788 /nfs/dbraw/zinc/48/67/88/1045486788.db2.gz ZCPCPGGFVIEUIO-JTQLQIEISA-N 1 2 315.364 4.140 20 0 DIADLO CC[N@@H+](Cc1cnns1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000450311424 1045486792 /nfs/dbraw/zinc/48/67/92/1045486792.db2.gz ZCPCPGGFVIEUIO-JTQLQIEISA-N 1 2 315.364 4.140 20 0 DIADLO CCOc1cc(C[N@H+](C)[C@H](C)c2ccco2)c(F)cc1OC ZINC000529521538 1045489353 /nfs/dbraw/zinc/48/93/53/1045489353.db2.gz ABZJODIQAIOCFV-GFCCVEGCSA-N 1 2 307.365 4.019 20 0 DIADLO CCOc1cc(C[N@@H+](C)[C@H](C)c2ccco2)c(F)cc1OC ZINC000529521538 1045489357 /nfs/dbraw/zinc/48/93/57/1045489357.db2.gz ABZJODIQAIOCFV-GFCCVEGCSA-N 1 2 307.365 4.019 20 0 DIADLO CN(C[C@@H]1CCCOC1)c1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000450326751 1045490243 /nfs/dbraw/zinc/49/02/43/1045490243.db2.gz ZMYZAHBZICKYDE-LBPRGKRZSA-N 1 2 324.346 4.116 20 0 DIADLO Brc1sccc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000529521623 1045490375 /nfs/dbraw/zinc/49/03/75/1045490375.db2.gz CXHFKOLOAGVCEY-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1sccc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000529521623 1045490376 /nfs/dbraw/zinc/49/03/76/1045490376.db2.gz CXHFKOLOAGVCEY-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO CC(=O)c1ccc(C[N@@H+]2CCCC[C@H]2c2nc(C)cs2)cc1 ZINC000450335323 1045494060 /nfs/dbraw/zinc/49/40/60/1045494060.db2.gz KTYSGSCUZQHHKO-KRWDZBQOSA-N 1 2 314.454 4.381 20 0 DIADLO CC(=O)c1ccc(C[N@H+]2CCCC[C@H]2c2nc(C)cs2)cc1 ZINC000450335323 1045494063 /nfs/dbraw/zinc/49/40/63/1045494063.db2.gz KTYSGSCUZQHHKO-KRWDZBQOSA-N 1 2 314.454 4.381 20 0 DIADLO FC(F)(F)c1ccc2c(cc[nH+]c2N2CCO[C@H]3CCC[C@H]32)c1 ZINC000450368705 1045497441 /nfs/dbraw/zinc/49/74/41/1045497441.db2.gz JHRHMJSGMKQPPA-CABCVRRESA-N 1 2 322.330 4.011 20 0 DIADLO CC1(C)C[N@H+](Cc2ccsc2C(F)(F)F)[C@@H]1[C@H]1CCCO1 ZINC000529570486 1045497595 /nfs/dbraw/zinc/49/75/95/1045497595.db2.gz BKUVBFZNMDXYHW-VXGBXAGGSA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccsc2C(F)(F)F)[C@@H]1[C@H]1CCCO1 ZINC000529570486 1045497598 /nfs/dbraw/zinc/49/75/98/1045497598.db2.gz BKUVBFZNMDXYHW-VXGBXAGGSA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@H+](Cc2ccsc2C(F)(F)F)[C@@H]1[C@@H]1CCCO1 ZINC000529570484 1045498019 /nfs/dbraw/zinc/49/80/19/1045498019.db2.gz BKUVBFZNMDXYHW-NWDGAFQWSA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccsc2C(F)(F)F)[C@@H]1[C@@H]1CCCO1 ZINC000529570484 1045498023 /nfs/dbraw/zinc/49/80/23/1045498023.db2.gz BKUVBFZNMDXYHW-NWDGAFQWSA-N 1 2 319.392 4.156 20 0 DIADLO Clc1ccc([C@H]2CCCCC[N@@H+]2Cc2cnns2)cc1 ZINC000450424609 1045501989 /nfs/dbraw/zinc/50/19/89/1045501989.db2.gz ZHDSIJJGIFSLNO-OAHLLOKOSA-N 1 2 307.850 4.309 20 0 DIADLO Clc1ccc([C@H]2CCCCC[N@H+]2Cc2cnns2)cc1 ZINC000450424609 1045501994 /nfs/dbraw/zinc/50/19/94/1045501994.db2.gz ZHDSIJJGIFSLNO-OAHLLOKOSA-N 1 2 307.850 4.309 20 0 DIADLO CC(=O)c1ccc(C[N@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)cc1 ZINC000450440213 1045506108 /nfs/dbraw/zinc/50/61/08/1045506108.db2.gz PBMQBNWSSHPRGB-HRAATJIYSA-N 1 2 323.436 4.160 20 0 DIADLO CC(=O)c1ccc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)cc1 ZINC000450440213 1045506110 /nfs/dbraw/zinc/50/61/10/1045506110.db2.gz PBMQBNWSSHPRGB-HRAATJIYSA-N 1 2 323.436 4.160 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nnc(C3CC3)s2)[C@H]1c1cccc(F)c1 ZINC000450458870 1045509010 /nfs/dbraw/zinc/50/90/10/1045509010.db2.gz YYUXPGRFIXCHMH-BDJLRTHQSA-N 1 2 317.433 4.138 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nnc(C3CC3)s2)[C@H]1c1cccc(F)c1 ZINC000450458870 1045509019 /nfs/dbraw/zinc/50/90/19/1045509019.db2.gz YYUXPGRFIXCHMH-BDJLRTHQSA-N 1 2 317.433 4.138 20 0 DIADLO COc1ccc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)c(F)c1OC ZINC001119507887 1045516638 /nfs/dbraw/zinc/51/66/38/1045516638.db2.gz SQBLUHZLJZUAPW-LBPRGKRZSA-N 1 2 319.376 4.162 20 0 DIADLO COc1ccc(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)c(F)c1OC ZINC001119507887 1045516646 /nfs/dbraw/zinc/51/66/46/1045516646.db2.gz SQBLUHZLJZUAPW-LBPRGKRZSA-N 1 2 319.376 4.162 20 0 DIADLO Cc1nn(C[NH2+][C@H](c2ccccc2)C(C)(C)C)c(=S)s1 ZINC000077433873 1045519671 /nfs/dbraw/zinc/51/96/71/1045519671.db2.gz AKNBVFRAEJFMER-CYBMUJFWSA-N 1 2 307.488 4.317 20 0 DIADLO Cc1[nH]c(CN(Cc2ccccc2)Cc2ccccc2)[nH+]c1C ZINC000628118852 1045525306 /nfs/dbraw/zinc/52/53/06/1045525306.db2.gz NQTYIXISNDCKJX-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO CN(c1nc(C[N@@H+]2CCC[C@@H]2c2ccsc2)cs1)C1CC1 ZINC000121222914 1045525704 /nfs/dbraw/zinc/52/57/04/1045525704.db2.gz XGFSGNMTYHQNTG-OAHLLOKOSA-N 1 2 319.499 4.140 20 0 DIADLO CN(c1nc(C[N@H+]2CCC[C@@H]2c2ccsc2)cs1)C1CC1 ZINC000121222914 1045525716 /nfs/dbraw/zinc/52/57/16/1045525716.db2.gz XGFSGNMTYHQNTG-OAHLLOKOSA-N 1 2 319.499 4.140 20 0 DIADLO Cc1nc(C[N@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)[nH]c1C ZINC000628130310 1045525982 /nfs/dbraw/zinc/52/59/82/1045525982.db2.gz SMBMNEFTLLEKLR-UHFFFAOYSA-N 1 2 320.440 4.106 20 0 DIADLO Cc1nc(C[N@@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)[nH]c1C ZINC000628130310 1045525985 /nfs/dbraw/zinc/52/59/85/1045525985.db2.gz SMBMNEFTLLEKLR-UHFFFAOYSA-N 1 2 320.440 4.106 20 0 DIADLO Cc1[nH]c(CN2CC=C(c3c(C)[nH]c4ccccc43)CC2)[nH+]c1C ZINC000628130310 1045525998 /nfs/dbraw/zinc/52/59/98/1045525998.db2.gz SMBMNEFTLLEKLR-UHFFFAOYSA-N 1 2 320.440 4.106 20 0 DIADLO Cc1[nH]c(CN(Cc2cccs2)Cc2cccs2)[nH+]c1C ZINC000628121901 1045526860 /nfs/dbraw/zinc/52/68/60/1045526860.db2.gz APDAUZAKZQJBGJ-UHFFFAOYSA-N 1 2 317.483 4.352 20 0 DIADLO Cc1c[nH]c(C[N@@H+]([C@@H](C)c2cccc(C(F)(F)F)c2)C2CC2)n1 ZINC000628131388 1045527872 /nfs/dbraw/zinc/52/78/72/1045527872.db2.gz XMIQDRQOCDFYKL-LBPRGKRZSA-N 1 2 323.362 4.463 20 0 DIADLO Cc1c[nH]c(C[N@H+]([C@@H](C)c2cccc(C(F)(F)F)c2)C2CC2)n1 ZINC000628131388 1045527882 /nfs/dbraw/zinc/52/78/82/1045527882.db2.gz XMIQDRQOCDFYKL-LBPRGKRZSA-N 1 2 323.362 4.463 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2cnc(C3CC3)o2)C2CC2)o1 ZINC000628131295 1045529432 /nfs/dbraw/zinc/52/94/32/1045529432.db2.gz VXPAEULGFSDPKC-SJKOYZFVSA-N 1 2 312.413 4.433 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cnc(C3CC3)o2)C2CC2)o1 ZINC000628131295 1045529443 /nfs/dbraw/zinc/52/94/43/1045529443.db2.gz VXPAEULGFSDPKC-SJKOYZFVSA-N 1 2 312.413 4.433 20 0 DIADLO CC(C)Cc1ccc([C@@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc1 ZINC000450653150 1045537384 /nfs/dbraw/zinc/53/73/84/1045537384.db2.gz SBBFZTCMSDVPNY-CYBMUJFWSA-N 1 2 315.486 4.465 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccc(F)c(Cl)c1 ZINC000450679613 1045542543 /nfs/dbraw/zinc/54/25/43/1045542543.db2.gz XAXMGLOOYPLMQH-QMMMGPOBSA-N 1 2 311.813 4.059 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2cnc(C)o2)c2ccc(C)cc2)cc1 ZINC000628209501 1045543849 /nfs/dbraw/zinc/54/38/49/1045543849.db2.gz HXCGVGUKLVRMBQ-FQEVSTJZSA-N 1 2 322.408 4.179 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccsc2C(F)(F)F)cs1 ZINC000628213317 1045547281 /nfs/dbraw/zinc/54/72/81/1045547281.db2.gz GRQJDLKRYQVTBA-ZETCQYMHSA-N 1 2 306.378 4.383 20 0 DIADLO Cc1cc(N2CCO[C@H](c3ccccc3)CC2)nc(C2CCC2)[nH+]1 ZINC001120912362 1045549926 /nfs/dbraw/zinc/54/99/26/1045549926.db2.gz NTCXRJFGNHKVCZ-SFHVURJKSA-N 1 2 323.440 4.021 20 0 DIADLO C(=C/c1ccccc1)\CC[N@@H+]1CCSC[C@@H]1c1nccs1 ZINC000450761143 1045564745 /nfs/dbraw/zinc/56/47/45/1045564745.db2.gz QUDLSFPLBFGANN-KZJSRBBCSA-N 1 2 316.495 4.337 20 0 DIADLO C(=C/c1ccccc1)\CC[N@H+]1CCSC[C@@H]1c1nccs1 ZINC000450761143 1045564755 /nfs/dbraw/zinc/56/47/55/1045564755.db2.gz QUDLSFPLBFGANN-KZJSRBBCSA-N 1 2 316.495 4.337 20 0 DIADLO Cc1ccc(OC(=O)c2ccc(-n3cc[nH+]c3)cc2)c(Cl)c1 ZINC001122713941 1045569852 /nfs/dbraw/zinc/56/98/52/1045569852.db2.gz PFSIZIIBCIZUIE-UHFFFAOYSA-N 1 2 312.756 4.053 20 0 DIADLO C[N@H+](CC(=O)Nc1ccc2ccccc2c1)Cc1cccc(F)c1 ZINC000016585386 1045570451 /nfs/dbraw/zinc/57/04/51/1045570451.db2.gz WOMUBQGCXXSZLP-UHFFFAOYSA-N 1 2 322.383 4.049 20 0 DIADLO C[N@@H+](CC(=O)Nc1ccc2ccccc2c1)Cc1cccc(F)c1 ZINC000016585386 1045570456 /nfs/dbraw/zinc/57/04/56/1045570456.db2.gz WOMUBQGCXXSZLP-UHFFFAOYSA-N 1 2 322.383 4.049 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2cc3cccc(F)c3o2)s1 ZINC000450835242 1045571443 /nfs/dbraw/zinc/57/14/43/1045571443.db2.gz NPQAQQWYBQZLPO-JTQLQIEISA-N 1 2 319.405 4.398 20 0 DIADLO Cc1cn2c(cccc2NC(=O)Nc2ccc(C)c(Cl)c2)[nH+]1 ZINC001202802186 1045580190 /nfs/dbraw/zinc/58/01/90/1045580190.db2.gz QJEQHWQMBGEBDE-UHFFFAOYSA-N 1 2 314.776 4.249 20 0 DIADLO COc1cccc(C[NH2+][C@H](C)c2nc3ccccc3s2)c1F ZINC000800237526 1045591257 /nfs/dbraw/zinc/59/12/57/1045591257.db2.gz HRVKELRQBYQUII-LLVKDONJSA-N 1 2 316.401 4.295 20 0 DIADLO C[C@H]1C[C@]1([NH2+]Cc1nnc(C2CC2)s1)c1ccc(Cl)cc1 ZINC000450929642 1045594196 /nfs/dbraw/zinc/59/41/96/1045594196.db2.gz VBGJJQXDXCLIPI-MGPLVRAMSA-N 1 2 319.861 4.094 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@]2(c3ccc(Cl)cc3)C[C@@H]2C)s1 ZINC000450931938 1045594233 /nfs/dbraw/zinc/59/42/33/1045594233.db2.gz YYLQAJIZAZNZJG-ZBEGNZNMSA-N 1 2 321.877 4.340 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H](C)c3ccccc3)c2)[nH+]c1C ZINC000751443502 1045605189 /nfs/dbraw/zinc/60/51/89/1045605189.db2.gz VSLLWPDRKYZRKI-CYBMUJFWSA-N 1 2 319.408 4.436 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@@H](CCc2ccccc2)C(F)F)s1 ZINC000779345864 1045615435 /nfs/dbraw/zinc/61/54/35/1045615435.db2.gz FSSRVXLSDUNTFX-AWEZNQCLSA-N 1 2 310.413 4.116 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2cccc(Cl)n2)C1 ZINC000800472942 1045622968 /nfs/dbraw/zinc/62/29/68/1045622968.db2.gz FXBXWTXOBLYQCQ-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2cccc(Cl)n2)C1 ZINC000800472942 1045622974 /nfs/dbraw/zinc/62/29/74/1045622974.db2.gz FXBXWTXOBLYQCQ-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO CC(C)(C)c1ncc(CNc2ccc(-n3cc[nH+]c3)cc2)s1 ZINC000121592600 1045623710 /nfs/dbraw/zinc/62/37/10/1045623710.db2.gz RWLUNVOLQJERHR-UHFFFAOYSA-N 1 2 312.442 4.238 20 0 DIADLO CC(C)(C)[C@H](Cn1cc[nH+]c1)NC(=O)C[C@@H]1CCCCC1(C)C ZINC000751686518 1045625985 /nfs/dbraw/zinc/62/59/85/1045625985.db2.gz FKZPCNGEFOLGLN-HOTGVXAUSA-N 1 2 319.493 4.021 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCC34CCC4)cc2)C[C@H](C)O1 ZINC000800487439 1045628418 /nfs/dbraw/zinc/62/84/18/1045628418.db2.gz CTEBRFGKGLDNRZ-RVKKMQEKSA-N 1 2 300.446 4.045 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2c(O)ccc(Cl)c2F)cs1 ZINC000191006459 1045642940 /nfs/dbraw/zinc/64/29/40/1045642940.db2.gz YHPYSFVIBZUROK-QMMMGPOBSA-N 1 2 314.813 4.054 20 0 DIADLO CCCC[N@H+](C)c1ccc(Nc2nc([C@@H](C)OC)ns2)cc1 ZINC000800850408 1045658633 /nfs/dbraw/zinc/65/86/33/1045658633.db2.gz NZPYQJFAKSPXGW-GFCCVEGCSA-N 1 2 320.462 4.225 20 0 DIADLO CCCC[N@@H+](C)c1ccc(Nc2nc([C@@H](C)OC)ns2)cc1 ZINC000800850408 1045658636 /nfs/dbraw/zinc/65/86/36/1045658636.db2.gz NZPYQJFAKSPXGW-GFCCVEGCSA-N 1 2 320.462 4.225 20 0 DIADLO c1cc(N2CCSCC2)ccc1[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000800982399 1045675625 /nfs/dbraw/zinc/67/56/25/1045675625.db2.gz RYDFPCNKIYWAJE-ZWKOTPCHSA-N 1 2 302.487 4.230 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+][C@@H]2CCC[C@H]2CCCF)cc1 ZINC000800982168 1045676066 /nfs/dbraw/zinc/67/60/66/1045676066.db2.gz OLGLXGKHWSKBQH-JTDSTZFVSA-N 1 2 320.452 4.242 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1nc(C2CC2)cs1 ZINC000451412162 1045679645 /nfs/dbraw/zinc/67/96/45/1045679645.db2.gz WKNBLJPXMQUWCO-GXSJLCMTSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1nc(C2CC2)cs1 ZINC000451412162 1045679652 /nfs/dbraw/zinc/67/96/52/1045679652.db2.gz WKNBLJPXMQUWCO-GXSJLCMTSA-N 1 2 304.381 4.183 20 0 DIADLO Clc1ccc(C[NH2+][C@@H](c2ccccc2)c2cccnc2)nc1 ZINC000779414933 1045680862 /nfs/dbraw/zinc/68/08/62/1045680862.db2.gz AOPADNULFGYGNZ-SFHVURJKSA-N 1 2 309.800 4.009 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000191348130 1045682601 /nfs/dbraw/zinc/68/26/01/1045682601.db2.gz OGMDOIPCHOAGHT-JTQLQIEISA-N 1 2 309.768 4.083 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000191348144 1045683007 /nfs/dbraw/zinc/68/30/07/1045683007.db2.gz OGMDOIPCHOAGHT-SNVBAGLBSA-N 1 2 309.768 4.083 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2nc3ccccc3o2)s1 ZINC000122076745 1045703841 /nfs/dbraw/zinc/70/38/41/1045703841.db2.gz VFOSQZLPTWXBSQ-LBPRGKRZSA-N 1 2 315.442 4.348 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2nc3ccccc3o2)s1 ZINC000122076745 1045703855 /nfs/dbraw/zinc/70/38/55/1045703855.db2.gz VFOSQZLPTWXBSQ-LBPRGKRZSA-N 1 2 315.442 4.348 20 0 DIADLO COc1cc(C)ccc1-c1ccc([C@@H]2CC(=O)CC[N@@H+]2C)cc1 ZINC000629754315 1045710205 /nfs/dbraw/zinc/71/02/05/1045710205.db2.gz NDGSNYXLEWBPEB-IBGZPJMESA-N 1 2 309.409 4.006 20 0 DIADLO COc1cc(C)ccc1-c1ccc([C@@H]2CC(=O)CC[N@H+]2C)cc1 ZINC000629754315 1045710219 /nfs/dbraw/zinc/71/02/19/1045710219.db2.gz NDGSNYXLEWBPEB-IBGZPJMESA-N 1 2 309.409 4.006 20 0 DIADLO CCCN(Cc1ccc(C)cc1)C(=O)c1c(C)cc(C)[nH+]c1C ZINC001124528247 1045714590 /nfs/dbraw/zinc/71/45/90/1045714590.db2.gz LBQYANBCMODTOC-UHFFFAOYSA-N 1 2 310.441 4.368 20 0 DIADLO CC(C)c1ccoc1-c1noc(-c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000752903954 1045714846 /nfs/dbraw/zinc/71/48/46/1045714846.db2.gz DTKXIXHFVONMHS-UHFFFAOYSA-N 1 2 320.352 4.306 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000191493173 1045715755 /nfs/dbraw/zinc/71/57/55/1045715755.db2.gz IZXJGTHESDNNLP-ABAIWWIYSA-N 1 2 320.795 4.163 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000191493173 1045715766 /nfs/dbraw/zinc/71/57/66/1045715766.db2.gz IZXJGTHESDNNLP-ABAIWWIYSA-N 1 2 320.795 4.163 20 0 DIADLO Cc1cc(COc2ccccc2-n2cc[nH+]c2)c2ccccc2n1 ZINC000530717652 1045716792 /nfs/dbraw/zinc/71/67/92/1045716792.db2.gz SAQDMLMIXYMTQB-UHFFFAOYSA-N 1 2 315.376 4.308 20 0 DIADLO Cc1cn(C)nc1C[NH2+]C(c1cccc(C)c1)c1cccc(C)c1 ZINC000901391520 1045718889 /nfs/dbraw/zinc/71/88/89/1045718889.db2.gz ISIVUSQTUPEJLG-UHFFFAOYSA-N 1 2 319.452 4.225 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)s1 ZINC000530723814 1045719051 /nfs/dbraw/zinc/71/90/51/1045719051.db2.gz GCDBRGGGSJIFOV-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@@H]2c2ccccn2)s1 ZINC000530723814 1045719068 /nfs/dbraw/zinc/71/90/68/1045719068.db2.gz GCDBRGGGSJIFOV-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO C[C@H]([N@H+](C)Cn1nc(-c2ccccc2)sc1=S)C1(C)CC1 ZINC000753113667 1045727979 /nfs/dbraw/zinc/72/79/79/1045727979.db2.gz ZAKNVRCKIRKFSF-LBPRGKRZSA-N 1 2 319.499 4.419 20 0 DIADLO C[C@H]([N@@H+](C)Cn1nc(-c2ccccc2)sc1=S)C1(C)CC1 ZINC000753113667 1045727990 /nfs/dbraw/zinc/72/79/90/1045727990.db2.gz ZAKNVRCKIRKFSF-LBPRGKRZSA-N 1 2 319.499 4.419 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)nc2Cl)cc1 ZINC000801520988 1045729399 /nfs/dbraw/zinc/72/93/99/1045729399.db2.gz DIJJSNLIRUDSDT-AWEZNQCLSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)nc2Cl)cc1 ZINC000801520988 1045729412 /nfs/dbraw/zinc/72/94/12/1045729412.db2.gz DIJJSNLIRUDSDT-AWEZNQCLSA-N 1 2 323.223 4.431 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3[nH]2)c(C)n1 ZINC000451878923 1045738921 /nfs/dbraw/zinc/73/89/21/1045738921.db2.gz OQMNKKQONJFVRF-LJQANCHMSA-N 1 2 320.440 4.302 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3[nH]2)c(C)n1 ZINC000451878923 1045738928 /nfs/dbraw/zinc/73/89/28/1045738928.db2.gz OQMNKKQONJFVRF-LJQANCHMSA-N 1 2 320.440 4.302 20 0 DIADLO Cc1cccc(C[N@@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)n1 ZINC000347358500 1045741206 /nfs/dbraw/zinc/74/12/06/1045741206.db2.gz KZQOGUWLEBBBRQ-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cccc(C[N@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)n1 ZINC000347358500 1045741221 /nfs/dbraw/zinc/74/12/21/1045741221.db2.gz KZQOGUWLEBBBRQ-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@@H+]1Cc1cn2ccsc2n1 ZINC000451972930 1045758594 /nfs/dbraw/zinc/75/85/94/1045758594.db2.gz PRBZAFPJDTZVTJ-MRXNPFEDSA-N 1 2 315.417 4.180 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@H+]1Cc1cn2ccsc2n1 ZINC000451972930 1045758606 /nfs/dbraw/zinc/75/86/06/1045758606.db2.gz PRBZAFPJDTZVTJ-MRXNPFEDSA-N 1 2 315.417 4.180 20 0 DIADLO CCCCC[N@@H+]1CCO[C@H](c2ccccc2Br)C1 ZINC000078775074 1045769865 /nfs/dbraw/zinc/76/98/65/1045769865.db2.gz FZUYQRNLTYADMR-HNNXBMFYSA-N 1 2 312.251 4.013 20 0 DIADLO CCCCC[N@H+]1CCO[C@H](c2ccccc2Br)C1 ZINC000078775074 1045769870 /nfs/dbraw/zinc/76/98/70/1045769870.db2.gz FZUYQRNLTYADMR-HNNXBMFYSA-N 1 2 312.251 4.013 20 0 DIADLO Cc1cccc([C@H](C)[NH2+]Cc2nnc(Cc3ccccc3C)o2)c1 ZINC000452086436 1045771352 /nfs/dbraw/zinc/77/13/52/1045771352.db2.gz MVOYHCUDRHRAAM-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO C[C@@H]1CC/C(=C/C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1 ZINC000753597805 1045773264 /nfs/dbraw/zinc/77/32/64/1045773264.db2.gz COCWBOMAVPVFIV-FNWMBBJUSA-N 1 2 315.804 4.211 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2cc(C)oc2C)c2ccco2)cc1 ZINC000753680336 1045788545 /nfs/dbraw/zinc/78/85/45/1045788545.db2.gz ZVGVYPNUEVGRQM-IBGZPJMESA-N 1 2 311.381 4.377 20 0 DIADLO CCOc1ccc([C@H]([NH2+]Cc2cc(C)no2)c2ccccc2)cc1 ZINC000631044731 1045799907 /nfs/dbraw/zinc/79/99/07/1045799907.db2.gz ICBJQBDYUYJPHA-HXUWFJFHSA-N 1 2 322.408 4.261 20 0 DIADLO CC(C)COC[C@@H]([NH2+]Cc1ccc(C(F)F)nc1)c1ccco1 ZINC000631058640 1045803545 /nfs/dbraw/zinc/80/35/45/1045803545.db2.gz TTXHZIZHKUKFBT-OAHLLOKOSA-N 1 2 324.371 4.116 20 0 DIADLO CCc1noc(C[NH2+]C(CC)(CC)c2ccc(Cl)cc2)n1 ZINC000102181907 1045816482 /nfs/dbraw/zinc/81/64/82/1045816482.db2.gz DXTNAJJJGZTVOO-UHFFFAOYSA-N 1 2 307.825 4.091 20 0 DIADLO C[C@@H](C[NH2+]c1ccc(N2CCOC[C@H]2C)cc1)Cc1ccccc1 ZINC000753969401 1045826534 /nfs/dbraw/zinc/82/65/34/1045826534.db2.gz SOEUGWZQTKVCTH-QZTJIDSGSA-N 1 2 324.468 4.202 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1cnc2ccccc2c1 ZINC000754063600 1045839214 /nfs/dbraw/zinc/83/92/14/1045839214.db2.gz JSCPRXWETMHJQL-UHFFFAOYSA-N 1 2 307.397 4.419 20 0 DIADLO Fc1cccc(-c2nc(C[N@@H+]3CCC[C@H]3c3ccccn3)co2)c1 ZINC000531440119 1045844914 /nfs/dbraw/zinc/84/49/14/1045844914.db2.gz QNGOYHJUFUXSMD-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1cccc(-c2nc(C[N@H+]3CCC[C@H]3c3ccccn3)co2)c1 ZINC000531440119 1045844928 /nfs/dbraw/zinc/84/49/28/1045844928.db2.gz QNGOYHJUFUXSMD-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO CC(C)C1CC([NH2+]c2ccc(N3C[C@H](C)O[C@@H](C)C3)cc2)C1 ZINC000754099112 1045845716 /nfs/dbraw/zinc/84/57/16/1045845716.db2.gz BOXNOZOALWWNKK-WMTDPASSSA-N 1 2 302.462 4.147 20 0 DIADLO Fc1ccc(-c2cnc(C[N@@H+]3CCC[C@H]3c3ccccn3)o2)cc1 ZINC000531439673 1045846245 /nfs/dbraw/zinc/84/62/45/1045846245.db2.gz QVZQRKGPSBHECF-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(-c2cnc(C[N@H+]3CCC[C@H]3c3ccccn3)o2)cc1 ZINC000531439673 1045846260 /nfs/dbraw/zinc/84/62/60/1045846260.db2.gz QVZQRKGPSBHECF-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC001125083274 1045847884 /nfs/dbraw/zinc/84/78/84/1045847884.db2.gz BCHDORDBPDEBGC-YESZJQIVSA-N 1 2 323.440 4.417 20 0 DIADLO CC(C)(C)c1ccc(CNc2cc3ccccc3c[nH+]2)c(=O)[nH]1 ZINC000631423408 1045855931 /nfs/dbraw/zinc/85/59/31/1045855931.db2.gz ATQWXKSTTUNNAL-UHFFFAOYSA-N 1 2 307.397 4.245 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nc(C)c2ccccc2n1)c1cc(C)ccn1 ZINC000631574394 1045875378 /nfs/dbraw/zinc/87/53/78/1045875378.db2.gz DJJGWTWYWMNKNF-GOSISDBHSA-N 1 2 320.440 4.273 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccccc2Cl)C[C@H](c2ccsc2)O1 ZINC000531588441 1045875841 /nfs/dbraw/zinc/87/58/41/1045875841.db2.gz XJEFAISLAOPCBD-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccccc2Cl)C[C@H](c2ccsc2)O1 ZINC000531588441 1045875851 /nfs/dbraw/zinc/87/58/51/1045875851.db2.gz XJEFAISLAOPCBD-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO CC1=CC[C@](C)(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)CC1 ZINC001125233395 1045878604 /nfs/dbraw/zinc/87/86/04/1045878604.db2.gz RYDJZYUDMATTGC-SFHVURJKSA-N 1 2 313.376 4.086 20 0 DIADLO CC(C)(CCC(=O)OCc1cccc2[nH+]ccn21)c1ccccc1 ZINC000754554563 1045898506 /nfs/dbraw/zinc/89/85/06/1045898506.db2.gz SAUDRGKUDRURNW-UHFFFAOYSA-N 1 2 322.408 4.136 20 0 DIADLO FC(F)(F)c1sccc1C[NH2+][C@H]1CCCc2scnc21 ZINC000631657448 1045898370 /nfs/dbraw/zinc/89/83/70/1045898370.db2.gz WKLZUOFEFFJYII-VIFPVBQESA-N 1 2 318.389 4.391 20 0 DIADLO C[N@H+](CCc1ccc(F)cc1)Cc1c(Cl)cncc1Cl ZINC001137609133 1045906379 /nfs/dbraw/zinc/90/63/79/1045906379.db2.gz IKVXQQNZOJUKOD-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1ccc(F)cc1)Cc1c(Cl)cncc1Cl ZINC001137609133 1045906385 /nfs/dbraw/zinc/90/63/85/1045906385.db2.gz IKVXQQNZOJUKOD-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2noc(-c3ccccc3C)n2)s1 ZINC000754664955 1045908073 /nfs/dbraw/zinc/90/80/73/1045908073.db2.gz UMCLYVOZVRMDEH-ZDUSSCGKSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@](C)(F)C2)ccc1Br ZINC001137613287 1045909059 /nfs/dbraw/zinc/90/90/59/1045909059.db2.gz SEJKAJALDVZRJQ-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@](C)(F)C2)ccc1Br ZINC001137613287 1045909067 /nfs/dbraw/zinc/90/90/67/1045909067.db2.gz SEJKAJALDVZRJQ-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO C[C@H]([NH2+]Cc1cc[nH]n1)c1ccc2ccccc2c1OC(F)F ZINC000531719660 1045910125 /nfs/dbraw/zinc/91/01/25/1045910125.db2.gz YMQCMVOZQREIRO-NSHDSACASA-N 1 2 317.339 4.015 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(Cl)n1)c1nc2ccccc2s1 ZINC000754711266 1045916442 /nfs/dbraw/zinc/91/64/42/1045916442.db2.gz KXLDJRKIHPBDQT-JTQLQIEISA-N 1 2 303.818 4.196 20 0 DIADLO C[C@H]([NH2+]Cc1c(Cl)cccc1OC(F)F)c1ccccn1 ZINC000631772849 1045917284 /nfs/dbraw/zinc/91/72/84/1045917284.db2.gz QWPCHYCGCYFILQ-JTQLQIEISA-N 1 2 312.747 4.187 20 0 DIADLO COc1ccc2c(c1F)CC[C@H]2[NH2+][C@@H](CF)c1ccc(F)cc1 ZINC000631797397 1045918962 /nfs/dbraw/zinc/91/89/62/1045918962.db2.gz AKKOOAPDQKOFPH-CVEARBPZSA-N 1 2 321.342 4.261 20 0 DIADLO Cc1c([C@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)cnn1C(C)C ZINC000631798519 1045919051 /nfs/dbraw/zinc/91/90/51/1045919051.db2.gz UMXNVTCPLRMKFY-SJCJKPOMSA-N 1 2 307.388 4.273 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)cc1F ZINC000631795517 1045919259 /nfs/dbraw/zinc/91/92/59/1045919259.db2.gz KJXGXFYCKICZKD-BZNIZROVSA-N 1 2 309.331 4.335 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)c(OC)c1 ZINC000631795968 1045920417 /nfs/dbraw/zinc/92/04/17/1045920417.db2.gz QFCBZJRSUNFBBZ-SJCJKPOMSA-N 1 2 321.367 4.204 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)ccc1F ZINC000631798427 1045920502 /nfs/dbraw/zinc/92/05/02/1045920502.db2.gz SLHPHKVNWUIYGB-MEDUHNTESA-N 1 2 309.331 4.335 20 0 DIADLO COc1ccc2c(c1F)CC[C@@H]2[NH2+][C@H](CF)c1ccc(F)cc1 ZINC000631797403 1045920557 /nfs/dbraw/zinc/92/05/57/1045920557.db2.gz AKKOOAPDQKOFPH-JKSUJKDBSA-N 1 2 321.342 4.261 20 0 DIADLO CCCc1noc(C[NH2+][C@H](C)c2csc3ccccc23)n1 ZINC000754744175 1045922787 /nfs/dbraw/zinc/92/27/87/1045922787.db2.gz QFBOJQFFTUPJTJ-LLVKDONJSA-N 1 2 301.415 4.088 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2cc(Cl)nc(Cl)c2)cs1 ZINC000754789786 1045927018 /nfs/dbraw/zinc/92/70/18/1045927018.db2.gz GDFLUYFUOGLJPT-QMMMGPOBSA-N 1 2 316.257 4.258 20 0 DIADLO CC(C)[N@H+](Cc1cncnc1)Cc1ccc(Cl)cc1Cl ZINC001137670476 1045928066 /nfs/dbraw/zinc/92/80/66/1045928066.db2.gz UHXJMVQQYUMYFL-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO CC(C)[N@@H+](Cc1cncnc1)Cc1ccc(Cl)cc1Cl ZINC001137670476 1045928068 /nfs/dbraw/zinc/92/80/68/1045928068.db2.gz UHXJMVQQYUMYFL-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO C[C@H]([NH2+]c1ccc(N2CCOCC2)cc1)[C@@H]1C[C@H]1c1ccccc1 ZINC000802304500 1045948100 /nfs/dbraw/zinc/94/81/00/1045948100.db2.gz HSOVLMGCBUFVFM-NDXORKPFSA-N 1 2 322.452 4.127 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](Cc1cccc(C)c1C)C1CC1 ZINC001137752730 1045955952 /nfs/dbraw/zinc/95/59/52/1045955952.db2.gz IHMKZWHNNVPYMQ-UHFFFAOYSA-N 1 2 317.864 4.163 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](Cc1cccc(C)c1C)C1CC1 ZINC001137752730 1045955963 /nfs/dbraw/zinc/95/59/63/1045955963.db2.gz IHMKZWHNNVPYMQ-UHFFFAOYSA-N 1 2 317.864 4.163 20 0 DIADLO C[C@H](c1ccc2ccccc2c1)[N@@H+]1CCc2cc(Cl)nnc2C1 ZINC000829136651 1045958288 /nfs/dbraw/zinc/95/82/88/1045958288.db2.gz MZJLXWSOKOXZHK-CYBMUJFWSA-N 1 2 323.827 4.403 20 0 DIADLO C[C@H](c1ccc2ccccc2c1)[N@H+]1CCc2cc(Cl)nnc2C1 ZINC000829136651 1045958297 /nfs/dbraw/zinc/95/82/97/1045958297.db2.gz MZJLXWSOKOXZHK-CYBMUJFWSA-N 1 2 323.827 4.403 20 0 DIADLO Brc1csc(C[NH+]2CCC3(CCCC3)CC2)n1 ZINC001137775701 1045963723 /nfs/dbraw/zinc/96/37/23/1045963723.db2.gz SYOBIUYSHRCCNH-UHFFFAOYSA-N 1 2 315.280 4.062 20 0 DIADLO C[NH+](C)c1ccc(N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000193118640 1045969456 /nfs/dbraw/zinc/96/94/56/1045969456.db2.gz GCRINLADWBVOFO-GOSISDBHSA-N 1 2 311.385 4.150 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@](C)(F)C2)c(Br)c1 ZINC001137802656 1045971145 /nfs/dbraw/zinc/97/11/45/1045971145.db2.gz FNEAEUWBDMIGQH-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@](C)(F)C2)c(Br)c1 ZINC001137802656 1045971156 /nfs/dbraw/zinc/97/11/56/1045971156.db2.gz FNEAEUWBDMIGQH-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@@H](F)C2)c(Br)c1 ZINC001137802935 1045971358 /nfs/dbraw/zinc/97/13/58/1045971358.db2.gz QDAGIRVWABGIGX-CYBMUJFWSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@@H](F)C2)c(Br)c1 ZINC001137802935 1045971363 /nfs/dbraw/zinc/97/13/63/1045971363.db2.gz QDAGIRVWABGIGX-CYBMUJFWSA-N 1 2 300.215 4.082 20 0 DIADLO CC[N@@H+](Cc1scnc1Cl)Cc1ccc(Cl)cc1 ZINC001137823328 1045974464 /nfs/dbraw/zinc/97/44/64/1045974464.db2.gz BVWREDSKYSYXOU-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC[N@H+](Cc1scnc1Cl)Cc1ccc(Cl)cc1 ZINC001137823328 1045974454 /nfs/dbraw/zinc/97/44/54/1045974454.db2.gz BVWREDSKYSYXOU-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO COc1ccc(C2=CC[N@H+](Cc3scnc3Cl)CC2)cc1 ZINC001137824850 1045974783 /nfs/dbraw/zinc/97/47/83/1045974783.db2.gz LFSQPYWOJIWVEH-UHFFFAOYSA-N 1 2 320.845 4.094 20 0 DIADLO COc1ccc(C2=CC[N@@H+](Cc3scnc3Cl)CC2)cc1 ZINC001137824850 1045974793 /nfs/dbraw/zinc/97/47/93/1045974793.db2.gz LFSQPYWOJIWVEH-UHFFFAOYSA-N 1 2 320.845 4.094 20 0 DIADLO CC[N@H+](Cc1scnc1Cl)Cc1cccc(Cl)c1 ZINC001137824793 1045976102 /nfs/dbraw/zinc/97/61/02/1045976102.db2.gz IKAREQIVFWXMLY-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC[N@@H+](Cc1scnc1Cl)Cc1cccc(Cl)c1 ZINC001137824793 1045976112 /nfs/dbraw/zinc/97/61/12/1045976112.db2.gz IKAREQIVFWXMLY-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO C[C@H]1CC[C@H]([NH2+]Cc2ncn(-c3ccccc3)n2)c2sccc21 ZINC000453214591 1045985982 /nfs/dbraw/zinc/98/59/82/1045985982.db2.gz BWKVIIAHSHCKPI-BBRMVZONSA-N 1 2 324.453 4.057 20 0 DIADLO Cc1ccccc1O[C@@H]1CC[N@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137872225 1045995557 /nfs/dbraw/zinc/99/55/57/1045995557.db2.gz HPMKXSBIKVXBFY-OAHLLOKOSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1ccccc1O[C@@H]1CC[N@@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137872225 1045995566 /nfs/dbraw/zinc/99/55/66/1045995566.db2.gz HPMKXSBIKVXBFY-OAHLLOKOSA-N 1 2 321.342 4.066 20 0 DIADLO CC1(C)C[N@H+](Cc2c(F)ccc(Cl)c2F)CCC1(F)F ZINC001137878154 1045996420 /nfs/dbraw/zinc/99/64/20/1045996420.db2.gz LMMQORBBAHRKMS-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(F)ccc(Cl)c2F)CCC1(F)F ZINC001137878154 1045996438 /nfs/dbraw/zinc/99/64/38/1045996438.db2.gz LMMQORBBAHRKMS-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO Cc1ccc2nc(Cl)c(C[N@H+]3CCOC[C@@H]3C(C)C)cc2c1 ZINC001137922600 1046016417 /nfs/dbraw/zinc/01/64/17/1046016417.db2.gz DBBNQMMEGSNNMU-QGZVFWFLSA-N 1 2 318.848 4.053 20 0 DIADLO Cc1ccc2nc(Cl)c(C[N@@H+]3CCOC[C@@H]3C(C)C)cc2c1 ZINC001137922600 1046016432 /nfs/dbraw/zinc/01/64/32/1046016432.db2.gz DBBNQMMEGSNNMU-QGZVFWFLSA-N 1 2 318.848 4.053 20 0 DIADLO Cc1ccc2nc(Cl)c(C[N@@H+]3CCn4cccc4C3)cc2c1 ZINC001137922893 1046018298 /nfs/dbraw/zinc/01/82/98/1046018298.db2.gz QDBDBGBDEJYEDB-UHFFFAOYSA-N 1 2 311.816 4.014 20 0 DIADLO Cc1ccc2nc(Cl)c(C[N@H+]3CCn4cccc4C3)cc2c1 ZINC001137922893 1046018315 /nfs/dbraw/zinc/01/83/15/1046018315.db2.gz QDBDBGBDEJYEDB-UHFFFAOYSA-N 1 2 311.816 4.014 20 0 DIADLO C[C@@H]([NH2+][C@H](C)C(C)(F)F)c1ccc(OCC(F)(F)F)cc1 ZINC000453296088 1046019118 /nfs/dbraw/zinc/01/91/18/1046019118.db2.gz QVAWWYMZIIUVFM-NXEZZACHSA-N 1 2 311.294 4.322 20 0 DIADLO CC1(C)CCC2(CC[NH+](Cc3c(F)ccc(F)c3F)CC2)O1 ZINC001137933763 1046021708 /nfs/dbraw/zinc/02/17/08/1046021708.db2.gz TZDUPOQGNXSKIJ-UHFFFAOYSA-N 1 2 313.363 4.028 20 0 DIADLO Cc1ccccc1O[C@H]1CC[N@H+](Cc2c(F)ccc(F)c2F)C1 ZINC001137930161 1046023357 /nfs/dbraw/zinc/02/33/57/1046023357.db2.gz DQMOCHMHTRWTKT-ZDUSSCGKSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1ccccc1O[C@H]1CC[N@@H+](Cc2c(F)ccc(F)c2F)C1 ZINC001137930161 1046023372 /nfs/dbraw/zinc/02/33/72/1046023372.db2.gz DQMOCHMHTRWTKT-ZDUSSCGKSA-N 1 2 321.342 4.066 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2c(F)ccc(F)c2F)c1 ZINC001137931973 1046023444 /nfs/dbraw/zinc/02/34/44/1046023444.db2.gz CWOJEEAAEFWIOF-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2c(F)ccc(F)c2F)c1 ZINC001137931973 1046023457 /nfs/dbraw/zinc/02/34/57/1046023457.db2.gz CWOJEEAAEFWIOF-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)ccc(F)c2F)cc1 ZINC001137930234 1046023726 /nfs/dbraw/zinc/02/37/26/1046023726.db2.gz HSBXDJKGPDPCGQ-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)ccc(F)c2F)cc1 ZINC001137930234 1046023734 /nfs/dbraw/zinc/02/37/34/1046023734.db2.gz HSBXDJKGPDPCGQ-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)cc(Cl)n1 ZINC000802656187 1046027273 /nfs/dbraw/zinc/02/72/73/1046027273.db2.gz GQKADVRLWIDPHK-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@@](F)(c3ccccc3)C2)cc(Cl)n1 ZINC000802656187 1046027286 /nfs/dbraw/zinc/02/72/86/1046027286.db2.gz GQKADVRLWIDPHK-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cn1nc(C(F)(F)F)c(C[N@@H+]2CCC23CCCCC3)c1Cl ZINC001137944306 1046029073 /nfs/dbraw/zinc/02/90/73/1046029073.db2.gz OERWPNMOBGMHLZ-UHFFFAOYSA-N 1 2 321.774 4.001 20 0 DIADLO Cn1nc(C(F)(F)F)c(C[N@H+]2CCC23CCCCC3)c1Cl ZINC001137944306 1046029082 /nfs/dbraw/zinc/02/90/82/1046029082.db2.gz OERWPNMOBGMHLZ-UHFFFAOYSA-N 1 2 321.774 4.001 20 0 DIADLO CC[C@@H]1CC[N@H+](Cn2nc(-c3ccccc3)sc2=S)C1 ZINC000755920555 1046030456 /nfs/dbraw/zinc/03/04/56/1046030456.db2.gz AIRQBTIHQVJOQR-GFCCVEGCSA-N 1 2 305.472 4.030 20 0 DIADLO CC[C@@H]1CC[N@@H+](Cn2nc(-c3ccccc3)sc2=S)C1 ZINC000755920555 1046030468 /nfs/dbraw/zinc/03/04/68/1046030468.db2.gz AIRQBTIHQVJOQR-GFCCVEGCSA-N 1 2 305.472 4.030 20 0 DIADLO CCC1(CC)CC[N@H+](Cn2nc(C3CC3)n(C3CC3)c2=S)C1 ZINC000755929122 1046030833 /nfs/dbraw/zinc/03/08/33/1046030833.db2.gz ADBIUJWKZGXLJS-UHFFFAOYSA-N 1 2 320.506 4.096 20 0 DIADLO CCC1(CC)CC[N@@H+](Cn2nc(C3CC3)n(C3CC3)c2=S)C1 ZINC000755929122 1046030838 /nfs/dbraw/zinc/03/08/38/1046030838.db2.gz ADBIUJWKZGXLJS-UHFFFAOYSA-N 1 2 320.506 4.096 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(c3ccccc3)[C@@H](C)C3CC3)ccn12 ZINC000633848742 1046036983 /nfs/dbraw/zinc/03/69/83/1046036983.db2.gz ZHXZBDPMSWFOSZ-HNNXBMFYSA-N 1 2 319.408 4.088 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccccc1Cl ZINC000453333581 1046040265 /nfs/dbraw/zinc/04/02/65/1046040265.db2.gz ZYWCMWMTPWBERF-HNNXBMFYSA-N 1 2 312.244 4.214 20 0 DIADLO Fc1c(Cl)ccc(C(F)(F)F)c1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC001137984198 1046045043 /nfs/dbraw/zinc/04/50/43/1046045043.db2.gz DXBOYXHEGFURRU-DTWKUNHWSA-N 1 2 307.718 4.482 20 0 DIADLO COCc1nc(COc2cc(C)[nH+]c3ccc(C)cc32)cs1 ZINC000902694909 1046045143 /nfs/dbraw/zinc/04/51/43/1046045143.db2.gz SBJSKZQDWYXFDA-UHFFFAOYSA-N 1 2 314.410 4.034 20 0 DIADLO Fc1c(Cl)ccc(C(F)(F)F)c1C[N@H+]1C[C@H]2CC[C@@H]1C2 ZINC001137984198 1046045057 /nfs/dbraw/zinc/04/50/57/1046045057.db2.gz DXBOYXHEGFURRU-DTWKUNHWSA-N 1 2 307.718 4.482 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(F)ccc(F)c2Cl)CCC1(F)F ZINC001137999634 1046051360 /nfs/dbraw/zinc/05/13/60/1046051360.db2.gz QKZZJBWISDXPTK-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO CC1(C)C[N@H+](Cc2c(F)ccc(F)c2Cl)CCC1(F)F ZINC001137999634 1046051343 /nfs/dbraw/zinc/05/13/43/1046051343.db2.gz QKZZJBWISDXPTK-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1cccc(C(F)(F)F)c1F ZINC001138011012 1046053667 /nfs/dbraw/zinc/05/36/67/1046053667.db2.gz JYAZEWYZOVOXOR-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1cccc(C(F)(F)F)c1F ZINC001138011012 1046053680 /nfs/dbraw/zinc/05/36/80/1046053680.db2.gz JYAZEWYZOVOXOR-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO Fc1c(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)cccc1C(F)(F)F ZINC001138006971 1046054580 /nfs/dbraw/zinc/05/45/80/1046054580.db2.gz PKKWFLYQUSLRJW-PHIMTYICSA-N 1 2 323.280 4.322 20 0 DIADLO Fc1c(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)cccc1C(F)(F)F ZINC001138006971 1046054593 /nfs/dbraw/zinc/05/45/93/1046054593.db2.gz PKKWFLYQUSLRJW-PHIMTYICSA-N 1 2 323.280 4.322 20 0 DIADLO CCSCc1cc[nH+]c(NCc2ccc(C(C)(C)O)cc2)c1 ZINC000830327310 1046060245 /nfs/dbraw/zinc/06/02/45/1046060245.db2.gz RBDPEDWCDIRIKG-UHFFFAOYSA-N 1 2 316.470 4.174 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1ccc(C(C)(C)O)cc1 ZINC000830321796 1046060567 /nfs/dbraw/zinc/06/05/67/1046060567.db2.gz BXFMWNWNJOYUOC-UHFFFAOYSA-N 1 2 314.429 4.098 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H]3C[C@H]2[C@H](C(F)(F)F)O3)c2ccccc12 ZINC001138016681 1046060914 /nfs/dbraw/zinc/06/09/14/1046060914.db2.gz MTBOWZLVYZKWCX-RRQGHBQHSA-N 1 2 321.342 4.052 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H]3C[C@H]2[C@H](C(F)(F)F)O3)c2ccccc12 ZINC001138016681 1046060930 /nfs/dbraw/zinc/06/09/30/1046060930.db2.gz MTBOWZLVYZKWCX-RRQGHBQHSA-N 1 2 321.342 4.052 20 0 DIADLO COc1cccnc1C[NH2+][C@H](C)c1cccc(Cl)c1Cl ZINC000453361894 1046064670 /nfs/dbraw/zinc/06/46/70/1046064670.db2.gz LKRIGTKSUKMNPJ-SNVBAGLBSA-N 1 2 311.212 4.248 20 0 DIADLO C[C@@H]1C[C@H]([NH2+][C@H]2CCc3cc(Cl)cc(Cl)c32)c2nccn21 ZINC000453370640 1046071117 /nfs/dbraw/zinc/07/11/17/1046071117.db2.gz VPLJPWHYLJZVFR-IIMNLJJBSA-N 1 2 322.239 4.473 20 0 DIADLO COc1cccnc1C[NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000453375868 1046072004 /nfs/dbraw/zinc/07/20/04/1046072004.db2.gz UEIMVJNMDIPGDH-CYBMUJFWSA-N 1 2 323.223 4.174 20 0 DIADLO CC(=O)[C@H]1CCC[N@H+](Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC001138052077 1046074370 /nfs/dbraw/zinc/07/43/70/1046074370.db2.gz SSCVUQIKOUHJJS-LBPRGKRZSA-N 1 2 319.754 4.160 20 0 DIADLO CC(=O)[C@H]1CCC[N@@H+](Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC001138052077 1046074385 /nfs/dbraw/zinc/07/43/85/1046074385.db2.gz SSCVUQIKOUHJJS-LBPRGKRZSA-N 1 2 319.754 4.160 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(C)ns1)c1nc(C(F)(F)F)cs1 ZINC000634532960 1046074401 /nfs/dbraw/zinc/07/44/01/1046074401.db2.gz XVVQDLACJQFSQA-SECBINFHSA-N 1 2 321.393 4.168 20 0 DIADLO CC(C)Cn1ccnc1C[NH2+][C@@H](c1ccc(F)cc1F)C(C)C ZINC000634680182 1046084010 /nfs/dbraw/zinc/08/40/10/1046084010.db2.gz NEKYAXMYBWDMKJ-GOSISDBHSA-N 1 2 321.415 4.304 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(OCc3ccccc3)c2)CCC1=O ZINC001138080230 1046085321 /nfs/dbraw/zinc/08/53/21/1046085321.db2.gz RFFSMOQUMGZWAK-UHFFFAOYSA-N 1 2 323.436 4.067 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(OCc3ccccc3)c2)CCC1=O ZINC001138080230 1046085335 /nfs/dbraw/zinc/08/53/35/1046085335.db2.gz RFFSMOQUMGZWAK-UHFFFAOYSA-N 1 2 323.436 4.067 20 0 DIADLO C/C(=C\C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CC1 ZINC000193995342 1046088649 /nfs/dbraw/zinc/08/86/49/1046088649.db2.gz UFZJNHLKIYVACX-WYMLVPIESA-N 1 2 321.424 4.181 20 0 DIADLO Cc1cc(Br)c(C[N@H+](C)Cc2ccco2)s1 ZINC000453559148 1046088781 /nfs/dbraw/zinc/08/87/81/1046088781.db2.gz FNYOZBABKNOMIK-UHFFFAOYSA-N 1 2 300.221 4.044 20 0 DIADLO Cc1cc(Br)c(C[N@@H+](C)Cc2ccco2)s1 ZINC000453559148 1046088795 /nfs/dbraw/zinc/08/87/95/1046088795.db2.gz FNYOZBABKNOMIK-UHFFFAOYSA-N 1 2 300.221 4.044 20 0 DIADLO CC[NH+](CC)[C@@H](C(=O)Oc1ccc2cc[nH]c2c1)c1ccccc1 ZINC000802963098 1046093126 /nfs/dbraw/zinc/09/31/26/1046093126.db2.gz PZWVJNLSJGIDAX-LJQANCHMSA-N 1 2 322.408 4.156 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Cl)cc2)C[C@H](c2ccsc2)O1 ZINC000532098067 1046098556 /nfs/dbraw/zinc/09/85/56/1046098556.db2.gz FIXZMCXYJJVQKK-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Cl)cc2)C[C@H](c2ccsc2)O1 ZINC000532098067 1046098567 /nfs/dbraw/zinc/09/85/67/1046098567.db2.gz FIXZMCXYJJVQKK-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ncc(Cl)n1C ZINC000194984971 1046111167 /nfs/dbraw/zinc/11/11/67/1046111167.db2.gz ZHXBTWXYZJBXDX-ZDUSSCGKSA-N 1 2 312.244 4.310 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ncc(Cl)n1C ZINC000194984971 1046111171 /nfs/dbraw/zinc/11/11/71/1046111171.db2.gz ZHXBTWXYZJBXDX-ZDUSSCGKSA-N 1 2 312.244 4.310 20 0 DIADLO Fc1cc(C[NH+]2CCC(C(F)F)CC2)ccc1Br ZINC000532237428 1046123324 /nfs/dbraw/zinc/12/33/24/1046123324.db2.gz HYBYRFMWQXGHST-UHFFFAOYSA-N 1 2 322.168 4.065 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@@H](c2cccc(O)c2)C1 ZINC000532236132 1046124174 /nfs/dbraw/zinc/12/41/74/1046124174.db2.gz YGGFZYSCISGQMD-SCLBCKFNSA-N 1 2 317.816 4.180 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@@H](c2cccc(O)c2)C1 ZINC000532236132 1046124182 /nfs/dbraw/zinc/12/41/82/1046124182.db2.gz YGGFZYSCISGQMD-SCLBCKFNSA-N 1 2 317.816 4.180 20 0 DIADLO COC(=O)c1sccc1C[N@@H+]1CCCCC[C@H]1c1ccco1 ZINC000532291612 1046127908 /nfs/dbraw/zinc/12/79/08/1046127908.db2.gz NTKXOTBJNXULOE-AWEZNQCLSA-N 1 2 319.426 4.245 20 0 DIADLO COC(=O)c1sccc1C[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000532291612 1046127919 /nfs/dbraw/zinc/12/79/19/1046127919.db2.gz NTKXOTBJNXULOE-AWEZNQCLSA-N 1 2 319.426 4.245 20 0 DIADLO CC(C)c1ccc([C@@H](C)[N@H+](C)Cc2ncc(Cl)n2C)cc1 ZINC000195732485 1046133927 /nfs/dbraw/zinc/13/39/27/1046133927.db2.gz VSFUMVQAOYOIFE-CYBMUJFWSA-N 1 2 305.853 4.390 20 0 DIADLO CC(C)c1ccc([C@@H](C)[N@@H+](C)Cc2ncc(Cl)n2C)cc1 ZINC000195732485 1046133930 /nfs/dbraw/zinc/13/39/30/1046133930.db2.gz VSFUMVQAOYOIFE-CYBMUJFWSA-N 1 2 305.853 4.390 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1nncn1C)C(C)C)c1cccc(Cl)c1F ZINC000903066850 1046153240 /nfs/dbraw/zinc/15/32/40/1046153240.db2.gz XVCASZZRODMGTD-DZGCQCFKSA-N 1 2 324.831 4.046 20 0 DIADLO COc1ccc(F)cc1C[N@@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001138376963 1046160087 /nfs/dbraw/zinc/16/00/87/1046160087.db2.gz ZDTMWUQBTOCYBQ-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)cc1C[N@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001138376963 1046160090 /nfs/dbraw/zinc/16/00/90/1046160090.db2.gz ZDTMWUQBTOCYBQ-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(F)c1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001138385069 1046161530 /nfs/dbraw/zinc/16/15/30/1046161530.db2.gz ZVNXTBMIMRZHPK-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(F)c1C[N@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001138385069 1046161534 /nfs/dbraw/zinc/16/15/34/1046161534.db2.gz ZVNXTBMIMRZHPK-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2ccc(C(F)(F)F)s2)s1 ZINC000717957849 1046163548 /nfs/dbraw/zinc/16/35/48/1046163548.db2.gz PKMWRJNHRRVKHB-SSDOTTSWSA-N 1 2 321.393 4.032 20 0 DIADLO CCc1cccc(Cl)c1C[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000475708371 1046167616 /nfs/dbraw/zinc/16/76/16/1046167616.db2.gz WSAJBQKAVAHNBX-KRWDZBQOSA-N 1 2 305.805 4.069 20 0 DIADLO CCc1cccc(Cl)c1C[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000475708371 1046167627 /nfs/dbraw/zinc/16/76/27/1046167627.db2.gz WSAJBQKAVAHNBX-KRWDZBQOSA-N 1 2 305.805 4.069 20 0 DIADLO Fc1cccc2c1CC[N@H+](Cc1cc(-c3ccccc3)no1)C2 ZINC000757144787 1046168744 /nfs/dbraw/zinc/16/87/44/1046168744.db2.gz ALNZAMXHFUXSCF-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1cccc2c1CC[N@@H+](Cc1cc(-c3ccccc3)no1)C2 ZINC000757144787 1046168752 /nfs/dbraw/zinc/16/87/52/1046168752.db2.gz ALNZAMXHFUXSCF-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Cc1c(C[N@H+](C)Cc2cnc(Cl)s2)[nH]c2ccc(F)cc12 ZINC001138410168 1046168953 /nfs/dbraw/zinc/16/89/53/1046168953.db2.gz UPPWMXDPFUMTQJ-UHFFFAOYSA-N 1 2 323.824 4.357 20 0 DIADLO Cc1c(C[N@@H+](C)Cc2cnc(Cl)s2)[nH]c2ccc(F)cc12 ZINC001138410168 1046168962 /nfs/dbraw/zinc/16/89/62/1046168962.db2.gz UPPWMXDPFUMTQJ-UHFFFAOYSA-N 1 2 323.824 4.357 20 0 DIADLO COc1c(Cl)cc(C[N@H+](C)Cc2cncs2)cc1Cl ZINC001138481433 1046196479 /nfs/dbraw/zinc/19/64/79/1046196479.db2.gz OTWOCXFCRBSISI-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO COc1c(Cl)cc(C[N@@H+](C)Cc2cncs2)cc1Cl ZINC001138481433 1046196484 /nfs/dbraw/zinc/19/64/84/1046196484.db2.gz OTWOCXFCRBSISI-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1ccc(-c2ccc[nH]2)cc1)n1cc[nH+]c1 ZINC000635768133 1046204912 /nfs/dbraw/zinc/20/49/12/1046204912.db2.gz YGFVSZRCJGRKBD-SFHVURJKSA-N 1 2 322.412 4.104 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2C/C=C\c2ccc(F)cc2F)no1 ZINC000757733429 1046208533 /nfs/dbraw/zinc/20/85/33/1046208533.db2.gz UVERJLQSEFPCCQ-MMTGSJLXSA-N 1 2 304.340 4.112 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2C/C=C\c2ccc(F)cc2F)no1 ZINC000757733429 1046208544 /nfs/dbraw/zinc/20/85/44/1046208544.db2.gz UVERJLQSEFPCCQ-MMTGSJLXSA-N 1 2 304.340 4.112 20 0 DIADLO CCc1nc(C)c([C@H](C)[NH2+][C@H]2c3ccccc3OC[C@H]2F)s1 ZINC000903270380 1046214920 /nfs/dbraw/zinc/21/49/20/1046214920.db2.gz DKOMICPRRXIUKH-GHJWDPDVSA-N 1 2 320.433 4.136 20 0 DIADLO COc1cc(Nc2cc(C)c(O)c(C)c2)[nH+]cc1C(F)(F)F ZINC001211911441 1046227333 /nfs/dbraw/zinc/22/73/33/1046227333.db2.gz LRANIPTYGPNRQB-UHFFFAOYSA-N 1 2 312.291 4.175 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2CC[C@@H]2c2ccc(F)cc2)c(C)[nH+]1 ZINC000636581470 1046230327 /nfs/dbraw/zinc/23/03/27/1046230327.db2.gz CHWHBYSEILUGAJ-IAGOWNOFSA-N 1 2 312.388 4.278 20 0 DIADLO COc1cccc2c1CCC[C@H]2[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000903313296 1046235318 /nfs/dbraw/zinc/23/53/18/1046235318.db2.gz MVEXOVLTXBVLRJ-OAHLLOKOSA-N 1 2 314.429 4.148 20 0 DIADLO Cc1cccc(C[N@@H+](C)[C@@H](C)c2ccccc2Br)n1 ZINC000347365998 1046235653 /nfs/dbraw/zinc/23/56/53/1046235653.db2.gz QNFLBDAJYYPFNU-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cccc(C[N@H+](C)[C@@H](C)c2ccccc2Br)n1 ZINC000347365998 1046235657 /nfs/dbraw/zinc/23/56/57/1046235657.db2.gz QNFLBDAJYYPFNU-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@H](C)c2ccccc2F)c(C)[nH+]1 ZINC000102602858 1046235927 /nfs/dbraw/zinc/23/59/27/1046235927.db2.gz ORYGJKRIRKEREE-NSHDSACASA-N 1 2 300.377 4.278 20 0 DIADLO CC[C@@H]([NH2+][C@H](c1ncccn1)C1CC1)c1cccc(Cl)c1F ZINC000903327473 1046242068 /nfs/dbraw/zinc/24/20/68/1046242068.db2.gz UKIVQBDYFLOUQK-ZBFHGGJFSA-N 1 2 319.811 4.461 20 0 DIADLO C[C@H]([NH2+][C@H](c1ncccn1)C1CC1)c1ccc(Cl)c(F)c1 ZINC000903327625 1046242151 /nfs/dbraw/zinc/24/21/51/1046242151.db2.gz WUNJQNILBYDANY-BONVTDFDSA-N 1 2 305.784 4.071 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ncccn1)C1CC1)c1ccc(F)c(Cl)c1 ZINC000903331901 1046244160 /nfs/dbraw/zinc/24/41/60/1046244160.db2.gz KPAQQVCDHHNLSP-MEBBXXQBSA-N 1 2 305.784 4.071 20 0 DIADLO Cc1ncc(CSCc2ccc(-n3cc[nH+]c3)cc2C)s1 ZINC000190943174 1046254498 /nfs/dbraw/zinc/25/44/98/1046254498.db2.gz SSSBQCLRJCCNAF-UHFFFAOYSA-N 1 2 315.467 4.379 20 0 DIADLO CCSc1ncc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cn1 ZINC001138655004 1046258336 /nfs/dbraw/zinc/25/83/36/1046258336.db2.gz PCRSVMXRZXZZBM-MRXNPFEDSA-N 1 2 317.433 4.065 20 0 DIADLO CCSc1ncc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)cn1 ZINC001138655004 1046258346 /nfs/dbraw/zinc/25/83/46/1046258346.db2.gz PCRSVMXRZXZZBM-MRXNPFEDSA-N 1 2 317.433 4.065 20 0 DIADLO CCSc1ncc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)cn1 ZINC001138655003 1046258618 /nfs/dbraw/zinc/25/86/18/1046258618.db2.gz PCRSVMXRZXZZBM-INIZCTEOSA-N 1 2 317.433 4.065 20 0 DIADLO CCSc1ncc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)cn1 ZINC001138655003 1046258623 /nfs/dbraw/zinc/25/86/23/1046258623.db2.gz PCRSVMXRZXZZBM-INIZCTEOSA-N 1 2 317.433 4.065 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC[C@@H]2COCc2ccccc2)c1 ZINC001138674364 1046262038 /nfs/dbraw/zinc/26/20/38/1046262038.db2.gz STNXCLLKJVXDFY-QGZVFWFLSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC[C@@H]2COCc2ccccc2)c1 ZINC001138674364 1046262048 /nfs/dbraw/zinc/26/20/48/1046262048.db2.gz STNXCLLKJVXDFY-QGZVFWFLSA-N 1 2 319.807 4.270 20 0 DIADLO FC(F)(F)c1ccc(C[NH2+]Cc2csc(C3CC3)n2)s1 ZINC000758337773 1046262666 /nfs/dbraw/zinc/26/26/66/1046262666.db2.gz NVZCDTNJROTZKI-UHFFFAOYSA-N 1 2 318.389 4.391 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001138682565 1046264745 /nfs/dbraw/zinc/26/47/45/1046264745.db2.gz UKJPKVIATJVGFI-ROUUACIJSA-N 1 2 305.343 4.375 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001138682565 1046264752 /nfs/dbraw/zinc/26/47/52/1046264752.db2.gz UKJPKVIATJVGFI-ROUUACIJSA-N 1 2 305.343 4.375 20 0 DIADLO NC(=[NH+]OCc1csc(C2CC2)n1)c1cccc2ccccc21 ZINC000758418633 1046268494 /nfs/dbraw/zinc/26/84/94/1046268494.db2.gz JDEUEZRSBRJLDF-UHFFFAOYSA-N 1 2 323.421 4.220 20 0 DIADLO F[C@@H]1C[N@H+](Cc2c(Cl)[nH]c3ccccc32)CCCC1(F)F ZINC001138686560 1046269431 /nfs/dbraw/zinc/26/94/31/1046269431.db2.gz QKADCRDKYXSRDA-CYBMUJFWSA-N 1 2 316.754 4.391 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2c(Cl)[nH]c3ccccc32)CCCC1(F)F ZINC001138686560 1046269437 /nfs/dbraw/zinc/26/94/37/1046269437.db2.gz QKADCRDKYXSRDA-CYBMUJFWSA-N 1 2 316.754 4.391 20 0 DIADLO CSc1ncc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)cn1 ZINC001138705705 1046273387 /nfs/dbraw/zinc/27/33/87/1046273387.db2.gz ZFLGMUDQTBCCKR-HNNXBMFYSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1ncc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)cn1 ZINC001138705705 1046273397 /nfs/dbraw/zinc/27/33/97/1046273397.db2.gz ZFLGMUDQTBCCKR-HNNXBMFYSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1ncc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)cn1 ZINC001138705693 1046273939 /nfs/dbraw/zinc/27/39/39/1046273939.db2.gz YYTZLDLTYNAAOS-OAHLLOKOSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1ncc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)cn1 ZINC001138705693 1046273947 /nfs/dbraw/zinc/27/39/47/1046273947.db2.gz YYTZLDLTYNAAOS-OAHLLOKOSA-N 1 2 319.861 4.189 20 0 DIADLO Nc1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000637913340 1046286763 /nfs/dbraw/zinc/28/67/63/1046286763.db2.gz NPWPGWLSFPNKOV-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000637913340 1046286772 /nfs/dbraw/zinc/28/67/72/1046286772.db2.gz NPWPGWLSFPNKOV-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO C[C@H](CSC(C)(C)C)[NH2+]c1ccc(N2CCOC[C@H]2C)cc1 ZINC000246052566 1046296910 /nfs/dbraw/zinc/29/69/10/1046296910.db2.gz AQRMKJLOBFUZTI-HUUCEWRRSA-N 1 2 322.518 4.244 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2c[nH]c3c2cccc3Cl)no1 ZINC001138830401 1046303948 /nfs/dbraw/zinc/30/39/48/1046303948.db2.gz KZKCJIVRIJDGFT-INIZCTEOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2c[nH]c3c2cccc3Cl)no1 ZINC001138830401 1046303963 /nfs/dbraw/zinc/30/39/63/1046303963.db2.gz KZKCJIVRIJDGFT-INIZCTEOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3Cl)C2)nn1C ZINC001138830783 1046304901 /nfs/dbraw/zinc/30/49/01/1046304901.db2.gz NQGOFFSQKQQUAG-GFCCVEGCSA-N 1 2 324.255 4.025 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3Cl)C2)nn1C ZINC001138830783 1046304909 /nfs/dbraw/zinc/30/49/09/1046304909.db2.gz NQGOFFSQKQQUAG-GFCCVEGCSA-N 1 2 324.255 4.025 20 0 DIADLO F[C@H]1C[N@H+](Cc2c[nH]c3c2cccc3Cl)CCCC1(F)F ZINC001138830152 1046305594 /nfs/dbraw/zinc/30/55/94/1046305594.db2.gz GFDZSANFVOYLLU-ZDUSSCGKSA-N 1 2 316.754 4.391 20 0 DIADLO F[C@H]1C[N@@H+](Cc2c[nH]c3c2cccc3Cl)CCCC1(F)F ZINC001138830152 1046305608 /nfs/dbraw/zinc/30/56/08/1046305608.db2.gz GFDZSANFVOYLLU-ZDUSSCGKSA-N 1 2 316.754 4.391 20 0 DIADLO CC[C@@H](Nc1cccc(C[N@H+](C)Cc2cscn2)c1)C1CC1 ZINC000638256468 1046306511 /nfs/dbraw/zinc/30/65/11/1046306511.db2.gz OVCREULRZCNLFB-GOSISDBHSA-N 1 2 315.486 4.376 20 0 DIADLO CC[C@@H](Nc1cccc(C[N@@H+](C)Cc2cscn2)c1)C1CC1 ZINC000638256468 1046306517 /nfs/dbraw/zinc/30/65/17/1046306517.db2.gz OVCREULRZCNLFB-GOSISDBHSA-N 1 2 315.486 4.376 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)cc1 ZINC000638291965 1046308114 /nfs/dbraw/zinc/30/81/14/1046308114.db2.gz CLKBKTRJRAOCNZ-KDOFPFPSSA-N 1 2 312.461 4.339 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)cc1 ZINC000638291960 1046308987 /nfs/dbraw/zinc/30/89/87/1046308987.db2.gz CLKBKTRJRAOCNZ-KBXCAEBGSA-N 1 2 312.461 4.339 20 0 DIADLO C[C@H]([NH2+][C@H](c1nnc[nH]1)C1CCCCC1)c1ccc(Cl)cc1 ZINC000638290300 1046310160 /nfs/dbraw/zinc/31/01/60/1046310160.db2.gz FFMPLJBMXWGDAH-LRDDRELGSA-N 1 2 318.852 4.430 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nnc[nH]1)C1CCCCC1)c1cccc(Cl)c1 ZINC000638289919 1046310201 /nfs/dbraw/zinc/31/02/01/1046310201.db2.gz BZMXUQUPHZTGPK-WBMJQRKESA-N 1 2 318.852 4.430 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1ccsc1)c1ccccn1 ZINC000089797021 1046313429 /nfs/dbraw/zinc/31/34/29/1046313429.db2.gz SNPPFCQKVKLFPY-SFHVURJKSA-N 1 2 310.422 4.031 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1ccc(F)cc1)c1ccccn1 ZINC000089797124 1046315696 /nfs/dbraw/zinc/31/56/96/1046315696.db2.gz IOXUAFRONGQYAA-FQEVSTJZSA-N 1 2 322.383 4.109 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccc(OCc3cccc(C)c3)cc2)o1 ZINC000638360391 1046316103 /nfs/dbraw/zinc/31/61/03/1046316103.db2.gz QSCBKXCOVANPIS-UHFFFAOYSA-N 1 2 322.408 4.160 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](OCc3ccccc3)C2)cs1 ZINC001138887055 1046319166 /nfs/dbraw/zinc/31/91/66/1046319166.db2.gz NDEOLOHTQNGMGH-QGZVFWFLSA-N 1 2 316.470 4.058 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@@H](OCc3ccccc3)C2)cs1 ZINC001138887055 1046319184 /nfs/dbraw/zinc/31/91/84/1046319184.db2.gz NDEOLOHTQNGMGH-QGZVFWFLSA-N 1 2 316.470 4.058 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nc2ccccc2o1)c1nc2ccccc2[nH]1 ZINC000638441897 1046321306 /nfs/dbraw/zinc/32/13/06/1046321306.db2.gz KOIJTJLCHXIDSB-GOSISDBHSA-N 1 2 320.396 4.191 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(F)cnc1Cl ZINC001138895886 1046321706 /nfs/dbraw/zinc/32/17/06/1046321706.db2.gz MCTHEHPHTIPQBD-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc(F)cnc1Cl ZINC001138895886 1046321714 /nfs/dbraw/zinc/32/17/14/1046321714.db2.gz MCTHEHPHTIPQBD-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO Brc1ccc(C[N@H+]2CC=C(c3ccccc3)CC2)o1 ZINC001138906173 1046323776 /nfs/dbraw/zinc/32/37/76/1046323776.db2.gz IOWHIDFGEVEKPU-UHFFFAOYSA-N 1 2 318.214 4.331 20 0 DIADLO Brc1ccc(C[N@@H+]2CC=C(c3ccccc3)CC2)o1 ZINC001138906173 1046323789 /nfs/dbraw/zinc/32/37/89/1046323789.db2.gz IOWHIDFGEVEKPU-UHFFFAOYSA-N 1 2 318.214 4.331 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)cc1C ZINC000638446786 1046324885 /nfs/dbraw/zinc/32/48/85/1046324885.db2.gz ZBCNDDPNWBUHGS-QAPCUYQASA-N 1 2 312.461 4.394 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2ccc3ccc(F)c(F)c3n2)n1 ZINC000638504568 1046326175 /nfs/dbraw/zinc/32/61/75/1046326175.db2.gz XPLOTGUJQZBDJM-JTQLQIEISA-N 1 2 319.380 4.129 20 0 DIADLO Cc1cc(C)cc([C@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000638530650 1046327135 /nfs/dbraw/zinc/32/71/35/1046327135.db2.gz BCSJATYGSFKUAW-MAUKXSAKSA-N 1 2 312.461 4.394 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@@H]3CC[C@@H](C)C3)c2)[nH+]c1C ZINC000759164449 1046327823 /nfs/dbraw/zinc/32/78/23/1046327823.db2.gz YDWLDMKSMVIDMB-IUODEOHRSA-N 1 2 311.429 4.458 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cc(Br)cnc1Cl ZINC001138942354 1046331861 /nfs/dbraw/zinc/33/18/61/1046331861.db2.gz YXFQNOCEEAORIZ-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Br)cnc2Cl)[C@H](C)C1 ZINC001138945259 1046332966 /nfs/dbraw/zinc/33/29/66/1046332966.db2.gz XQDBVDPLFINOTI-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Br)cnc2Cl)[C@H](C)C1 ZINC001138945259 1046332980 /nfs/dbraw/zinc/33/29/80/1046332980.db2.gz XQDBVDPLFINOTI-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1ccc(C[C@H](C)[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)s1 ZINC000638661189 1046333735 /nfs/dbraw/zinc/33/37/35/1046333735.db2.gz YPSJJLUXQKKEJI-LRDDRELGSA-N 1 2 318.490 4.017 20 0 DIADLO CC1(C)CC[NH+](Cc2cc(Br)cnc2Cl)CC1 ZINC001138945049 1046335353 /nfs/dbraw/zinc/33/53/53/1046335353.db2.gz PMYBVJHGAKBFLA-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccc3ccc(F)c(F)c3n2)s1 ZINC000638726270 1046337504 /nfs/dbraw/zinc/33/75/04/1046337504.db2.gz PVKQXYWSRCXOCR-SNVBAGLBSA-N 1 2 319.380 4.129 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cc(Cl)cc(Cl)c2N)s1 ZINC000638726973 1046338622 /nfs/dbraw/zinc/33/86/22/1046338622.db2.gz ZFFQTJLXQZOYAS-MRVPVSSYSA-N 1 2 316.257 4.191 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)cc1F ZINC000638762202 1046340879 /nfs/dbraw/zinc/34/08/79/1046340879.db2.gz BWKVNCBXPIPBOY-GUYCJALGSA-N 1 2 316.424 4.224 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1cccc(OC(C)C)c1)CC2 ZINC001138985759 1046348307 /nfs/dbraw/zinc/34/83/07/1046348307.db2.gz GSSWOFZDWSNVHF-UHFFFAOYSA-N 1 2 323.436 4.235 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1cccc(OC(C)C)c1)CC2 ZINC001138985759 1046348314 /nfs/dbraw/zinc/34/83/14/1046348314.db2.gz GSSWOFZDWSNVHF-UHFFFAOYSA-N 1 2 323.436 4.235 20 0 DIADLO COc1ccc([C@H]([NH2+][C@@H](C)c2nc(C(C)C)no2)C2CC2)cc1 ZINC000170874217 1046348433 /nfs/dbraw/zinc/34/84/33/1046348433.db2.gz ARTNYNYIZWDVRS-BLLLJJGKSA-N 1 2 315.417 4.004 20 0 DIADLO c1nnc([C@@H](Nc2cccc3cc[nH+]cc32)C2CCCCC2)[nH]1 ZINC000638887120 1046349422 /nfs/dbraw/zinc/34/94/22/1046349422.db2.gz TYDPLGMBTCIVNQ-KRWDZBQOSA-N 1 2 307.401 4.086 20 0 DIADLO CCCOc1ccccc1C[N@@H+]1CCC[C@H]1c1cc(C)on1 ZINC001138995778 1046352430 /nfs/dbraw/zinc/35/24/30/1046352430.db2.gz TWOYVRBCDXYKDE-KRWDZBQOSA-N 1 2 300.402 4.109 20 0 DIADLO CCCOc1ccccc1C[N@H+]1CCC[C@H]1c1cc(C)on1 ZINC001138995778 1046352443 /nfs/dbraw/zinc/35/24/43/1046352443.db2.gz TWOYVRBCDXYKDE-KRWDZBQOSA-N 1 2 300.402 4.109 20 0 DIADLO CCOc1ccc(Br)cc1C[NH+]1CC2(C1)CCCC2 ZINC001138991970 1046353467 /nfs/dbraw/zinc/35/34/67/1046353467.db2.gz ZLNMBADGFDSFJY-UHFFFAOYSA-N 1 2 324.262 4.224 20 0 DIADLO c1csc(-c2ccc(C[NH+]3CC4(C3)CCCCO4)s2)c1 ZINC001139017203 1046359997 /nfs/dbraw/zinc/35/99/97/1046359997.db2.gz LBDMMVWJKKWWNY-UHFFFAOYSA-N 1 2 305.468 4.232 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)Cc1cccc(F)c1 ZINC000666494132 1046365798 /nfs/dbraw/zinc/36/57/98/1046365798.db2.gz FDSBHFMFEQYVRV-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)Cc1cccc(F)c1 ZINC000666494132 1046365810 /nfs/dbraw/zinc/36/58/10/1046365810.db2.gz FDSBHFMFEQYVRV-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Fc1cc(Cl)cc(F)c1C[N@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001139051144 1046370525 /nfs/dbraw/zinc/37/05/25/1046370525.db2.gz ZIVOYVVPRMLUSX-KCJUWKMLSA-N 1 2 307.718 4.095 20 0 DIADLO Fc1cc(Cl)cc(F)c1C[N@@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001139051144 1046370537 /nfs/dbraw/zinc/37/05/37/1046370537.db2.gz ZIVOYVVPRMLUSX-KCJUWKMLSA-N 1 2 307.718 4.095 20 0 DIADLO O=C(/C=C\c1ccccc1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000748517717 1046380173 /nfs/dbraw/zinc/38/01/73/1046380173.db2.gz ZTHWKPMJNQORFJ-TWGQIWQCSA-N 1 2 323.783 4.178 20 0 DIADLO Clc1cc(C[N@@H+]2CC[C@@H]2c2ccccc2)cc2c1OCO2 ZINC001139076166 1046380879 /nfs/dbraw/zinc/38/08/79/1046380879.db2.gz HQEBFWUCWNHSSC-OAHLLOKOSA-N 1 2 301.773 4.016 20 0 DIADLO Clc1cc(C[N@H+]2CC[C@@H]2c2ccccc2)cc2c1OCO2 ZINC001139076166 1046380894 /nfs/dbraw/zinc/38/08/94/1046380894.db2.gz HQEBFWUCWNHSSC-OAHLLOKOSA-N 1 2 301.773 4.016 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1ccc(Br)nc1Cl ZINC001139112024 1046386956 /nfs/dbraw/zinc/38/69/56/1046386956.db2.gz HLQFZCBJGJAZDK-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1ccc(Br)nc1Cl ZINC001139112024 1046386966 /nfs/dbraw/zinc/38/69/66/1046386966.db2.gz HLQFZCBJGJAZDK-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2ccc(Br)nc2Cl)[C@H]1C ZINC001139112598 1046389350 /nfs/dbraw/zinc/38/93/50/1046389350.db2.gz SDKKHKBWHWNMEN-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2ccc(Br)nc2Cl)[C@H]1C ZINC001139112598 1046389365 /nfs/dbraw/zinc/38/93/65/1046389365.db2.gz SDKKHKBWHWNMEN-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCCCC[N@@H+]1Cc1ccc(Br)nc1Cl ZINC001139112321 1046390869 /nfs/dbraw/zinc/39/08/69/1046390869.db2.gz DWSIKKXLMWKBOJ-JTQLQIEISA-N 1 2 317.658 4.262 20 0 DIADLO C[C@H]1CCCCC[N@H+]1Cc1ccc(Br)nc1Cl ZINC001139112321 1046390882 /nfs/dbraw/zinc/39/08/82/1046390882.db2.gz DWSIKKXLMWKBOJ-JTQLQIEISA-N 1 2 317.658 4.262 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+](C)Cc1cscn1 ZINC000171065017 1046410045 /nfs/dbraw/zinc/41/00/45/1046410045.db2.gz GLEPUAORJAECFJ-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+](C)Cc1cscn1 ZINC000171065017 1046410051 /nfs/dbraw/zinc/41/00/51/1046410051.db2.gz GLEPUAORJAECFJ-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO c1ccc([C@@H](CC2CCC2)[NH2+]Cc2nc(C3CCC3)no2)cc1 ZINC000639573157 1046412714 /nfs/dbraw/zinc/41/27/14/1046412714.db2.gz YHHNPULURVPYTK-QGZVFWFLSA-N 1 2 311.429 4.358 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C2CCC2)no1)c1ccc(Cl)s1 ZINC000639578195 1046412998 /nfs/dbraw/zinc/41/29/98/1046412998.db2.gz OXGOGMODPQEIGQ-SNVBAGLBSA-N 1 2 311.838 4.293 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(Oc3ccccc3)nc2)C[C@H]1F ZINC001139243977 1046418419 /nfs/dbraw/zinc/41/84/19/1046418419.db2.gz KAIQMGPQYFUXLK-RHSMWYFYSA-N 1 2 300.377 4.054 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(Oc3ccccc3)nc2)C[C@H]1F ZINC001139243977 1046418422 /nfs/dbraw/zinc/41/84/22/1046418422.db2.gz KAIQMGPQYFUXLK-RHSMWYFYSA-N 1 2 300.377 4.054 20 0 DIADLO Clc1cccc(Oc2ccccc2C[N@@H+]2C[C@@H]3C[C@H]2CO3)c1 ZINC001139262122 1046419947 /nfs/dbraw/zinc/41/99/47/1046419947.db2.gz MRBKNZZVICVOEZ-RDJZCZTQSA-N 1 2 315.800 4.105 20 0 DIADLO Clc1cccc(Oc2ccccc2C[N@H+]2C[C@@H]3C[C@H]2CO3)c1 ZINC001139262122 1046419950 /nfs/dbraw/zinc/41/99/50/1046419950.db2.gz MRBKNZZVICVOEZ-RDJZCZTQSA-N 1 2 315.800 4.105 20 0 DIADLO CC(=O)C[N@@H+](C)Cc1ccccc1Oc1cccc(Cl)c1 ZINC001139259457 1046421016 /nfs/dbraw/zinc/42/10/16/1046421016.db2.gz BTDOGIUXCLGWBQ-UHFFFAOYSA-N 1 2 303.789 4.153 20 0 DIADLO CC(=O)C[N@H+](C)Cc1ccccc1Oc1cccc(Cl)c1 ZINC001139259457 1046421021 /nfs/dbraw/zinc/42/10/21/1046421021.db2.gz BTDOGIUXCLGWBQ-UHFFFAOYSA-N 1 2 303.789 4.153 20 0 DIADLO COc1ccc(-c2ccc(C[N@@H+]3Cc4cccnc4C3)s2)cc1 ZINC001139284082 1046424481 /nfs/dbraw/zinc/42/44/81/1046424481.db2.gz HORAKNVHYFMARX-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO COc1ccc(-c2ccc(C[N@H+]3Cc4cccnc4C3)s2)cc1 ZINC001139284082 1046424485 /nfs/dbraw/zinc/42/44/85/1046424485.db2.gz HORAKNVHYFMARX-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO Clc1nc(-c2ccccc2)[nH]c1C[NH+]1CC2(C1)CCCCC2 ZINC001139284932 1046425971 /nfs/dbraw/zinc/42/59/71/1046425971.db2.gz MPJZLTWAWZEYRR-UHFFFAOYSA-N 1 2 315.848 4.496 20 0 DIADLO c1n[nH]cc1[C@@H]1CCC[N@H+]1Cc1nc(C2CCCCC2)cs1 ZINC000639777692 1046426719 /nfs/dbraw/zinc/42/67/19/1046426719.db2.gz MZXPIIPLXOUBQQ-INIZCTEOSA-N 1 2 316.474 4.251 20 0 DIADLO c1n[nH]cc1[C@@H]1CCC[N@@H+]1Cc1nc(C2CCCCC2)cs1 ZINC000639777692 1046426724 /nfs/dbraw/zinc/42/67/24/1046426724.db2.gz MZXPIIPLXOUBQQ-INIZCTEOSA-N 1 2 316.474 4.251 20 0 DIADLO C[N@H+](Cc1cncnc1)Cc1ccccc1Oc1ccc(F)cc1 ZINC001139303407 1046428097 /nfs/dbraw/zinc/42/80/97/1046428097.db2.gz UCISREFWXCHWGT-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[N@@H+](Cc1cncnc1)Cc1ccccc1Oc1ccc(F)cc1 ZINC001139303407 1046428101 /nfs/dbraw/zinc/42/81/01/1046428101.db2.gz UCISREFWXCHWGT-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2sccc2Br)C1 ZINC001139309408 1046429230 /nfs/dbraw/zinc/42/92/30/1046429230.db2.gz WUZDRRAMUPHSMT-GFCCVEGCSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2sccc2Br)C1 ZINC001139309408 1046429236 /nfs/dbraw/zinc/42/92/36/1046429236.db2.gz WUZDRRAMUPHSMT-GFCCVEGCSA-N 1 2 306.244 4.225 20 0 DIADLO Clc1cc2cccnc2c(C[N@@H+]2CCC[C@H]2c2ncccn2)c1 ZINC000639843355 1046432498 /nfs/dbraw/zinc/43/24/98/1046432498.db2.gz QAVWGDUHSSBXGP-INIZCTEOSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1cc2cccnc2c(C[N@H+]2CCC[C@H]2c2ncccn2)c1 ZINC000639843355 1046432502 /nfs/dbraw/zinc/43/25/02/1046432502.db2.gz QAVWGDUHSSBXGP-INIZCTEOSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1ccc2cccnc2c1C[N@@H+]1CCC[C@@H]1c1ncccn1 ZINC000639844167 1046432526 /nfs/dbraw/zinc/43/25/26/1046432526.db2.gz XPIZBNLVYPZIPZ-MRXNPFEDSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1ccc2cccnc2c1C[N@H+]1CCC[C@@H]1c1ncccn1 ZINC000639844167 1046432530 /nfs/dbraw/zinc/43/25/30/1046432530.db2.gz XPIZBNLVYPZIPZ-MRXNPFEDSA-N 1 2 324.815 4.015 20 0 DIADLO CN(Cc1ccc(-n2cc[nH+]c2)cc1)[C@H](C1CCC1)C(F)(F)F ZINC001139361887 1046437810 /nfs/dbraw/zinc/43/78/10/1046437810.db2.gz CXFAZCAXEBSGOX-MRXNPFEDSA-N 1 2 323.362 4.035 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc(C2CCCC2)no1)c1ccc(F)cc1 ZINC000639928182 1046438405 /nfs/dbraw/zinc/43/84/05/1046438405.db2.gz KGFMNBXYRZPLBN-GOSISDBHSA-N 1 2 317.408 4.281 20 0 DIADLO CC1(C)CN(Cc2c[nH+]cn2Cc2ccccc2)[C@@H]1c1ccco1 ZINC000639927184 1046438595 /nfs/dbraw/zinc/43/85/95/1046438595.db2.gz DECJYKAPPBJAPE-LJQANCHMSA-N 1 2 321.424 4.108 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc(C2CCCC2)no1)c1ccc(F)cc1 ZINC000639928183 1046438747 /nfs/dbraw/zinc/43/87/47/1046438747.db2.gz KGFMNBXYRZPLBN-SFHVURJKSA-N 1 2 317.408 4.281 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2csc(-c3ccoc3)n2)s1 ZINC000639994827 1046441538 /nfs/dbraw/zinc/44/15/38/1046441538.db2.gz NDQALUNQKVDQHI-VIFPVBQESA-N 1 2 305.428 4.019 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@H](c2ccc(CC(C)C)cc2)C2CC2)n1 ZINC000676842791 1046441612 /nfs/dbraw/zinc/44/16/12/1046441612.db2.gz DGRMICLXDBRUGZ-SCLBCKFNSA-N 1 2 313.445 4.378 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCC(=O)[C@H](C)C23CCCC3)c1 ZINC001137267388 1046444250 /nfs/dbraw/zinc/44/42/50/1046444250.db2.gz YMKIGJMIADZSFM-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCC(=O)[C@H](C)C23CCCC3)c1 ZINC001137267388 1046444252 /nfs/dbraw/zinc/44/42/52/1046444252.db2.gz YMKIGJMIADZSFM-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO Cc1sc(/C=C/c2c[nH+]c3ccc(Cl)cn23)cc1C=O ZINC000760263256 1046446624 /nfs/dbraw/zinc/44/66/24/1046446624.db2.gz GCQORRROLIALBB-ONEGZZNKSA-N 1 2 302.786 4.341 20 0 DIADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC001139415078 1046447426 /nfs/dbraw/zinc/44/74/26/1046447426.db2.gz KVQMAPZXCRQUPU-GFCCVEGCSA-N 1 2 303.789 4.153 20 0 DIADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC001139415078 1046447431 /nfs/dbraw/zinc/44/74/31/1046447431.db2.gz KVQMAPZXCRQUPU-GFCCVEGCSA-N 1 2 303.789 4.153 20 0 DIADLO FC[C@H]([NH2+]Cc1ccccc1OC(F)F)c1ccc(F)cc1 ZINC000640152119 1046450682 /nfs/dbraw/zinc/45/06/82/1046450682.db2.gz BVJMBBHSOGFXSJ-AWEZNQCLSA-N 1 2 313.294 4.228 20 0 DIADLO Clc1ccnc(Cl)c1C[N@@H+]1CCC[C@@H](c2ccccn2)C1 ZINC001139479454 1046454647 /nfs/dbraw/zinc/45/46/47/1046454647.db2.gz JOOPAOWQOITYGT-GFCCVEGCSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1ccnc(Cl)c1C[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC001139479454 1046454649 /nfs/dbraw/zinc/45/46/49/1046454649.db2.gz JOOPAOWQOITYGT-GFCCVEGCSA-N 1 2 322.239 4.163 20 0 DIADLO CCC[C@@]1(C)CCC[N@H+](Cn2nc(C3CCC3)n(C)c2=S)C1 ZINC000781566169 1046457040 /nfs/dbraw/zinc/45/70/40/1046457040.db2.gz NZGOKRLJEZDCBM-KRWDZBQOSA-N 1 2 322.522 4.078 20 0 DIADLO CCC[C@@]1(C)CCC[N@@H+](Cn2nc(C3CCC3)n(C)c2=S)C1 ZINC000781566169 1046457045 /nfs/dbraw/zinc/45/70/45/1046457045.db2.gz NZGOKRLJEZDCBM-KRWDZBQOSA-N 1 2 322.522 4.078 20 0 DIADLO C[C@@H]1CC[C@@]2(CC[N@H+](Cn3nc(C4CC4)sc3=S)C2)C1 ZINC000781588963 1046458651 /nfs/dbraw/zinc/45/86/51/1046458651.db2.gz YWOBZSQOUWNPOY-IAQYHMDHSA-N 1 2 309.504 4.021 20 0 DIADLO C[C@@H]1CC[C@@]2(CC[N@@H+](Cn3nc(C4CC4)sc3=S)C2)C1 ZINC000781588963 1046458661 /nfs/dbraw/zinc/45/86/61/1046458661.db2.gz YWOBZSQOUWNPOY-IAQYHMDHSA-N 1 2 309.504 4.021 20 0 DIADLO Fc1ccc(Cl)cc1C[NH2+][C@H]1COc2c1cccc2Cl ZINC000677128833 1046465935 /nfs/dbraw/zinc/46/59/35/1046465935.db2.gz DVEHOHZYOIBLFV-AWEZNQCLSA-N 1 2 312.171 4.356 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2cccnc2)cnc1Cl ZINC001139543509 1046469175 /nfs/dbraw/zinc/46/91/75/1046469175.db2.gz ALTPHTPCOMBGTE-INIZCTEOSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2cccnc2)cnc1Cl ZINC001139543509 1046469176 /nfs/dbraw/zinc/46/91/76/1046469176.db2.gz ALTPHTPCOMBGTE-INIZCTEOSA-N 1 2 301.821 4.166 20 0 DIADLO Clc1ccnc(C[N@H+](Cc2ccccc2)Cc2ccccn2)c1 ZINC001139559665 1046472940 /nfs/dbraw/zinc/47/29/40/1046472940.db2.gz MGZHEKAJMPANDY-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1ccnc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)c1 ZINC001139559665 1046472947 /nfs/dbraw/zinc/47/29/47/1046472947.db2.gz MGZHEKAJMPANDY-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO CCC[N@H+](Cc1noc(-c2ccsc2)n1)Cc1ccccc1 ZINC000127178426 1046480088 /nfs/dbraw/zinc/48/00/88/1046480088.db2.gz IYLGZICHRZMZCU-UHFFFAOYSA-N 1 2 313.426 4.210 20 0 DIADLO CCC[N@@H+](Cc1noc(-c2ccsc2)n1)Cc1ccccc1 ZINC000127178426 1046480096 /nfs/dbraw/zinc/48/00/96/1046480096.db2.gz IYLGZICHRZMZCU-UHFFFAOYSA-N 1 2 313.426 4.210 20 0 DIADLO Cc1cnc(Cl)c(C[N@@H+]2CCC[C@H]2c2ccc(C)nc2)c1 ZINC001139595350 1046480361 /nfs/dbraw/zinc/48/03/61/1046480361.db2.gz LPDZXBOGRRNXRP-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cnc(Cl)c(C[N@H+]2CCC[C@H]2c2ccc(C)nc2)c1 ZINC001139595350 1046480370 /nfs/dbraw/zinc/48/03/70/1046480370.db2.gz LPDZXBOGRRNXRP-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cc(Cl)ncc1Br ZINC001139806176 1046522591 /nfs/dbraw/zinc/52/25/91/1046522591.db2.gz PHDUCGISNYWYSO-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO COc1cc(C[N@@H+]2CCC(=O)[C@@H](C)C23CCCC3)ccc1Cl ZINC001139616462 1046485884 /nfs/dbraw/zinc/48/58/84/1046485884.db2.gz JZHVCWCTUICEBB-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO COc1cc(C[N@H+]2CCC(=O)[C@@H](C)C23CCCC3)ccc1Cl ZINC001139616462 1046485890 /nfs/dbraw/zinc/48/58/90/1046485890.db2.gz JZHVCWCTUICEBB-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO COc1cc(C[N@@H+]2CCc3c(F)cccc3C2)ccc1Cl ZINC001139615052 1046486028 /nfs/dbraw/zinc/48/60/28/1046486028.db2.gz XNVJFHCWJUTMLC-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(C[N@H+]2CCc3c(F)cccc3C2)ccc1Cl ZINC001139615052 1046486034 /nfs/dbraw/zinc/48/60/34/1046486034.db2.gz XNVJFHCWJUTMLC-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1cccnc1Cl)[C@H]2C ZINC000781928195 1046487998 /nfs/dbraw/zinc/48/79/98/1046487998.db2.gz UQGICAOKFASTST-STQMWFEESA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1cccnc1Cl)[C@H]2C ZINC000781928195 1046488002 /nfs/dbraw/zinc/48/80/02/1046488002.db2.gz UQGICAOKFASTST-STQMWFEESA-N 1 2 316.832 4.251 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CCC(C)(C)C3)c2)[nH+]c1C ZINC000781950817 1046489370 /nfs/dbraw/zinc/48/93/70/1046489370.db2.gz JWNDUMRATINKLU-OAHLLOKOSA-N 1 2 311.429 4.458 20 0 DIADLO COc1ccc(C[N@H+](C)CC(=O)c2ccccc2)cc1C(C)C ZINC001139624607 1046490068 /nfs/dbraw/zinc/49/00/68/1046490068.db2.gz OXJFJOLEBQXJRK-UHFFFAOYSA-N 1 2 311.425 4.133 20 0 DIADLO COc1ccc(C[N@@H+](C)CC(=O)c2ccccc2)cc1C(C)C ZINC001139624607 1046490073 /nfs/dbraw/zinc/49/00/73/1046490073.db2.gz OXJFJOLEBQXJRK-UHFFFAOYSA-N 1 2 311.425 4.133 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1cccc(Cl)n1)[C@@H]2C ZINC000782097337 1046494464 /nfs/dbraw/zinc/49/44/64/1046494464.db2.gz JCLJGUOYXCWUIC-QWHCGFSZSA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1cccc(Cl)n1)[C@@H]2C ZINC000782097337 1046494469 /nfs/dbraw/zinc/49/44/69/1046494469.db2.gz JCLJGUOYXCWUIC-QWHCGFSZSA-N 1 2 316.832 4.251 20 0 DIADLO Fc1c(Cl)nccc1C[NH+]1CCC(c2cccs2)CC1 ZINC001139663708 1046496555 /nfs/dbraw/zinc/49/65/55/1046496555.db2.gz VKKUWKZCLIKWJH-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cccc([C@@H]3CCCOC3)c2)c(C)[nH+]1 ZINC000536578043 1046500551 /nfs/dbraw/zinc/50/05/51/1046500551.db2.gz BEKXCGCZECNSSW-GOSISDBHSA-N 1 2 324.424 4.153 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nc(-c2cccc(C)c2)no1 ZINC000130269871 1046510266 /nfs/dbraw/zinc/51/02/66/1046510266.db2.gz QIWXCQQCGYMQFZ-QGZVFWFLSA-N 1 2 322.412 4.023 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nc(-c2cccc(C)c2)no1 ZINC000130269871 1046510275 /nfs/dbraw/zinc/51/02/75/1046510275.db2.gz QIWXCQQCGYMQFZ-QGZVFWFLSA-N 1 2 322.412 4.023 20 0 DIADLO CSc1ccc(C[NH2+]Cc2cc(F)ccc2OC(F)F)o1 ZINC000641774936 1046514266 /nfs/dbraw/zinc/51/42/66/1046514266.db2.gz QEFGEJCWRHAYCC-UHFFFAOYSA-N 1 2 317.332 4.032 20 0 DIADLO FC(F)[C@@H]1CC[N@@H+](Cc2ccc(Br)cc2Cl)C1 ZINC000677733981 1046517244 /nfs/dbraw/zinc/51/72/44/1046517244.db2.gz MODGMWIWIKCEOU-SECBINFHSA-N 1 2 324.596 4.190 20 0 DIADLO FC(F)[C@@H]1CC[N@H+](Cc2ccc(Br)cc2Cl)C1 ZINC000677733981 1046517237 /nfs/dbraw/zinc/51/72/37/1046517237.db2.gz MODGMWIWIKCEOU-SECBINFHSA-N 1 2 324.596 4.190 20 0 DIADLO Fc1cc2c(cc1F)C[N@H+](Cc1ccccc1C(F)F)CC2 ZINC001139802281 1046520606 /nfs/dbraw/zinc/52/06/06/1046520606.db2.gz NBPTVBNITPHHKD-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO Fc1cc2c(cc1F)C[N@@H+](Cc1ccccc1C(F)F)CC2 ZINC001139802281 1046520617 /nfs/dbraw/zinc/52/06/17/1046520617.db2.gz NBPTVBNITPHHKD-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000641959456 1046532846 /nfs/dbraw/zinc/53/28/46/1046532846.db2.gz CSYKSFWZFPVEOV-KBXCAEBGSA-N 1 2 301.817 4.475 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000641959456 1046532858 /nfs/dbraw/zinc/53/28/58/1046532858.db2.gz CSYKSFWZFPVEOV-KBXCAEBGSA-N 1 2 301.817 4.475 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1C[N@H+](C)Cc1nccs1 ZINC001139886167 1046546279 /nfs/dbraw/zinc/54/62/79/1046546279.db2.gz DCUUEWMYBIZLPI-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1C[N@@H+](C)Cc1nccs1 ZINC001139886167 1046546286 /nfs/dbraw/zinc/54/62/86/1046546286.db2.gz DCUUEWMYBIZLPI-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1nn(C[N@H+]2C[C@H](c3ccc(C)cc3)C[C@@H]2C)c(=S)s1 ZINC000782951565 1046547866 /nfs/dbraw/zinc/54/78/66/1046547866.db2.gz CULSFTPVNXDFHL-SWLSCSKDSA-N 1 2 319.499 4.126 20 0 DIADLO Cc1nn(C[N@@H+]2C[C@H](c3ccc(C)cc3)C[C@@H]2C)c(=S)s1 ZINC000782951565 1046547878 /nfs/dbraw/zinc/54/78/78/1046547878.db2.gz CULSFTPVNXDFHL-SWLSCSKDSA-N 1 2 319.499 4.126 20 0 DIADLO C[N@H+](CCc1ccc(F)cc1)Cc1sc(Cl)nc1Cl ZINC001139957336 1046558499 /nfs/dbraw/zinc/55/84/99/1046558499.db2.gz QQXQFNMCPZCJMG-UHFFFAOYSA-N 1 2 319.232 4.264 20 0 DIADLO C[N@@H+](CCc1ccc(F)cc1)Cc1sc(Cl)nc1Cl ZINC001139957336 1046558512 /nfs/dbraw/zinc/55/85/12/1046558512.db2.gz QQXQFNMCPZCJMG-UHFFFAOYSA-N 1 2 319.232 4.264 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1C(C)C ZINC000055057980 1046558602 /nfs/dbraw/zinc/55/86/02/1046558602.db2.gz VXGIVQIPMGRWPZ-AWEZNQCLSA-N 1 2 314.429 4.170 20 0 DIADLO Cc1occc1C[N@H+](C)[C@@H](C)C(=O)Nc1ccccc1C(C)C ZINC000055057980 1046558616 /nfs/dbraw/zinc/55/86/16/1046558616.db2.gz VXGIVQIPMGRWPZ-AWEZNQCLSA-N 1 2 314.429 4.170 20 0 DIADLO CCO[C@@H]1CCC[N@H+](Cc2cc(Cl)c(OC)cc2Cl)C1 ZINC000678118337 1046559317 /nfs/dbraw/zinc/55/93/17/1046559317.db2.gz QLYCMKVPNTZXCK-GFCCVEGCSA-N 1 2 318.244 4.003 20 0 DIADLO CCO[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(OC)cc2Cl)C1 ZINC000678118337 1046559330 /nfs/dbraw/zinc/55/93/30/1046559330.db2.gz QLYCMKVPNTZXCK-GFCCVEGCSA-N 1 2 318.244 4.003 20 0 DIADLO OC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1c(Cl)ccc(Cl)c1Cl ZINC000678133012 1046560414 /nfs/dbraw/zinc/56/04/14/1046560414.db2.gz RVLDCXOSSQIBDF-ULKQDVFKSA-N 1 2 320.647 4.135 20 0 DIADLO OC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1c(Cl)ccc(Cl)c1Cl ZINC000678133012 1046560428 /nfs/dbraw/zinc/56/04/28/1046560428.db2.gz RVLDCXOSSQIBDF-ULKQDVFKSA-N 1 2 320.647 4.135 20 0 DIADLO C[N@H+](CCc1ccccc1Cl)Cc1csc(Cl)n1 ZINC001139978257 1046561677 /nfs/dbraw/zinc/56/16/77/1046561677.db2.gz PUEHBWZXKTUOTN-UHFFFAOYSA-N 1 2 301.242 4.124 20 0 DIADLO C[N@@H+](CCc1ccccc1Cl)Cc1csc(Cl)n1 ZINC001139978257 1046561688 /nfs/dbraw/zinc/56/16/88/1046561688.db2.gz PUEHBWZXKTUOTN-UHFFFAOYSA-N 1 2 301.242 4.124 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1nn(C)c2ccccc12 ZINC000678136744 1046567341 /nfs/dbraw/zinc/56/73/41/1046567341.db2.gz HODZIRAMXVWZFJ-CYBMUJFWSA-N 1 2 313.832 4.420 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1nn(C)c2ccccc12 ZINC000678136744 1046567355 /nfs/dbraw/zinc/56/73/55/1046567355.db2.gz HODZIRAMXVWZFJ-CYBMUJFWSA-N 1 2 313.832 4.420 20 0 DIADLO C[N@H+](CC/C=C/c1cccnc1)Cc1c(Cl)ccnc1Cl ZINC001139481384 1046570775 /nfs/dbraw/zinc/57/07/75/1046570775.db2.gz WVYJCRJHWOEPHG-GORDUTHDSA-N 1 2 322.239 4.319 20 0 DIADLO C[N@@H+](CC/C=C/c1cccnc1)Cc1c(Cl)ccnc1Cl ZINC001139481384 1046570789 /nfs/dbraw/zinc/57/07/89/1046570789.db2.gz WVYJCRJHWOEPHG-GORDUTHDSA-N 1 2 322.239 4.319 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2cnc(Br)cc2Cl)[C@H]1C ZINC001140077710 1046586873 /nfs/dbraw/zinc/58/68/73/1046586873.db2.gz MVJYTEYJCXTPFU-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2cnc(Br)cc2Cl)[C@H]1C ZINC001140077710 1046586887 /nfs/dbraw/zinc/58/68/87/1046586887.db2.gz MVJYTEYJCXTPFU-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CCCC[C@H]2c2ccccc2F)c1 ZINC001140048481 1046574482 /nfs/dbraw/zinc/57/44/82/1046574482.db2.gz GXCDIKHXRVCIIE-SFHVURJKSA-N 1 2 303.352 4.398 20 0 DIADLO Oc1ccc(F)c(C[N@H+]2CCCC[C@H]2c2ccccc2F)c1 ZINC001140048481 1046574492 /nfs/dbraw/zinc/57/44/92/1046574492.db2.gz GXCDIKHXRVCIIE-SFHVURJKSA-N 1 2 303.352 4.398 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1cnc(Br)cc1Cl ZINC001140073559 1046580533 /nfs/dbraw/zinc/58/05/33/1046580533.db2.gz BIBIAXYJYFDCFY-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO COc1c(Cl)cccc1C[N@@H+]1CCc2c(F)cccc2C1 ZINC001140062344 1046581466 /nfs/dbraw/zinc/58/14/66/1046581466.db2.gz UBDDBTCKZJQZTR-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1c(Cl)cccc1C[N@H+]1CCc2c(F)cccc2C1 ZINC001140062344 1046581479 /nfs/dbraw/zinc/58/14/79/1046581479.db2.gz UBDDBTCKZJQZTR-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@H+]1Cc1cnc(C(C)(C)C)s1 ZINC000678196701 1046582556 /nfs/dbraw/zinc/58/25/56/1046582556.db2.gz BFUAQSUBSQTFBC-ZDUSSCGKSA-N 1 2 316.470 4.396 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1cnc(C(C)(C)C)s1 ZINC000678196701 1046582567 /nfs/dbraw/zinc/58/25/67/1046582567.db2.gz BFUAQSUBSQTFBC-ZDUSSCGKSA-N 1 2 316.470 4.396 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cnc(Br)cc2Cl)[C@H](C)C1 ZINC001140078508 1046585000 /nfs/dbraw/zinc/58/50/00/1046585000.db2.gz IPPRBSRQGXSSSB-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cnc(Br)cc2Cl)[C@H](C)C1 ZINC001140078508 1046585006 /nfs/dbraw/zinc/58/50/06/1046585006.db2.gz IPPRBSRQGXSSSB-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1cc(C(F)(F)F)ccn1 ZINC001140104365 1046589236 /nfs/dbraw/zinc/58/92/36/1046589236.db2.gz LZYPRDXBEJWKGZ-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(C(F)(F)F)ccn1 ZINC001140104365 1046589250 /nfs/dbraw/zinc/58/92/50/1046589250.db2.gz LZYPRDXBEJWKGZ-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[N@H+](Cc1cc(C(F)(F)F)ccn1)Cc1ccccc1Cl ZINC001140106262 1046591493 /nfs/dbraw/zinc/59/14/93/1046591493.db2.gz CYEZIYZNAPSSLA-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1cc(C(F)(F)F)ccn1)Cc1ccccc1Cl ZINC001140106262 1046591503 /nfs/dbraw/zinc/59/15/03/1046591503.db2.gz CYEZIYZNAPSSLA-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(C(F)(F)F)ccn2)cn1 ZINC001140108947 1046593064 /nfs/dbraw/zinc/59/30/64/1046593064.db2.gz UPXMBBNWZLPAQA-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc(C(F)(F)F)ccn2)cn1 ZINC001140108947 1046593079 /nfs/dbraw/zinc/59/30/79/1046593079.db2.gz UPXMBBNWZLPAQA-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1cc(C(F)(F)F)ccc1F ZINC000678234058 1046593950 /nfs/dbraw/zinc/59/39/50/1046593950.db2.gz QQOJZBKYSAEURT-UHFFFAOYSA-N 1 2 301.283 4.460 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1cc(C(F)(F)F)ccc1F ZINC000678234058 1046593963 /nfs/dbraw/zinc/59/39/63/1046593963.db2.gz QQOJZBKYSAEURT-UHFFFAOYSA-N 1 2 301.283 4.460 20 0 DIADLO Oc1ccc(C[N@H+](Cc2ccccc2)Cc2ccccn2)c(F)c1 ZINC001140124868 1046594711 /nfs/dbraw/zinc/59/47/11/1046594711.db2.gz WNBLRHUFDRJOAJ-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO Oc1ccc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)c(F)c1 ZINC001140124868 1046594722 /nfs/dbraw/zinc/59/47/22/1046594722.db2.gz WNBLRHUFDRJOAJ-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c(F)c1 ZINC001140129754 1046597870 /nfs/dbraw/zinc/59/78/70/1046597870.db2.gz MEWSIUGRSCDIJY-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)c(F)c1 ZINC001140129754 1046597887 /nfs/dbraw/zinc/59/78/87/1046597887.db2.gz MEWSIUGRSCDIJY-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO Clc1ccc(C[NH2+]Cc2nc3c(s2)CCC3)c(Cl)c1 ZINC000093052655 1046603151 /nfs/dbraw/zinc/60/31/51/1046603151.db2.gz AHBLUSJFMVRNBH-UHFFFAOYSA-N 1 2 313.253 4.228 20 0 DIADLO CCCOc1ccc(NCc2c[nH+]cn2Cc2ccccc2)cc1 ZINC000783565982 1046609228 /nfs/dbraw/zinc/60/92/28/1046609228.db2.gz AAZBTEFUAFGVKX-UHFFFAOYSA-N 1 2 321.424 4.332 20 0 DIADLO CCN(CC)c1ncc(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)s1 ZINC000678283279 1046610898 /nfs/dbraw/zinc/61/08/98/1046610898.db2.gz HNJSIMCPJYRCCR-MRXNPFEDSA-N 1 2 319.449 4.075 20 0 DIADLO CCN(CC)c1ncc(C[N@H+]2CC[C@@H]2c2cccc(F)c2)s1 ZINC000678283279 1046610901 /nfs/dbraw/zinc/61/09/01/1046610901.db2.gz HNJSIMCPJYRCCR-MRXNPFEDSA-N 1 2 319.449 4.075 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3ccccc3s2)C[C@H](C(F)(F)F)O1 ZINC000678282369 1046612116 /nfs/dbraw/zinc/61/21/16/1046612116.db2.gz ZRCAQQUXWGJZHA-QMTHXVAHSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3ccccc3s2)C[C@H](C(F)(F)F)O1 ZINC000678282369 1046612113 /nfs/dbraw/zinc/61/21/13/1046612113.db2.gz ZRCAQQUXWGJZHA-QMTHXVAHSA-N 1 2 315.360 4.053 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2csc(C(C)C)n2)c(C)cc1O ZINC001140201387 1046614251 /nfs/dbraw/zinc/61/42/51/1046614251.db2.gz JQWYQFFCCILSCM-UHFFFAOYSA-N 1 2 304.459 4.221 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2csc(C(C)C)n2)c(C)cc1O ZINC001140201387 1046614256 /nfs/dbraw/zinc/61/42/56/1046614256.db2.gz JQWYQFFCCILSCM-UHFFFAOYSA-N 1 2 304.459 4.221 20 0 DIADLO Cc1ccc(-c2ccc(C[N@@H+]3CCO[C@H](c4ccco4)C3)o2)cc1 ZINC000678295011 1046615151 /nfs/dbraw/zinc/61/51/51/1046615151.db2.gz VDMRHJFYKRZPFH-FQEVSTJZSA-N 1 2 323.392 4.422 20 0 DIADLO Cc1ccc(-c2ccc(C[N@H+]3CCO[C@H](c4ccco4)C3)o2)cc1 ZINC000678295011 1046615155 /nfs/dbraw/zinc/61/51/55/1046615155.db2.gz VDMRHJFYKRZPFH-FQEVSTJZSA-N 1 2 323.392 4.422 20 0 DIADLO Fc1ccccc1C=C1CC[NH+](Cc2n[nH]c3ccccc32)CC1 ZINC000678338578 1046621038 /nfs/dbraw/zinc/62/10/38/1046621038.db2.gz WFDXIRKFHOQCQG-UHFFFAOYSA-N 1 2 321.399 4.381 20 0 DIADLO Cc1cccn2c(CNc3ccc(Br)cc3)c[nH+]c12 ZINC000678349030 1046622954 /nfs/dbraw/zinc/62/29/54/1046622954.db2.gz GMUIIUXTVFMAAU-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H]2COc3c2ccc(C)c3C)c(C)s1 ZINC000678344653 1046623262 /nfs/dbraw/zinc/62/32/62/1046623262.db2.gz ATARLKQMKVUJAY-IAQYHMDHSA-N 1 2 302.443 4.161 20 0 DIADLO C[C@H](C(=O)Nc1cccc2ccccc21)[N@H+](C)CCC(F)(F)F ZINC000533034073 1046641556 /nfs/dbraw/zinc/64/15/56/1046641556.db2.gz SSSFRNXTNFSSSY-GFCCVEGCSA-N 1 2 324.346 4.051 20 0 DIADLO C[C@H](C(=O)Nc1cccc2ccccc21)[N@@H+](C)CCC(F)(F)F ZINC000533034073 1046641570 /nfs/dbraw/zinc/64/15/70/1046641570.db2.gz SSSFRNXTNFSSSY-GFCCVEGCSA-N 1 2 324.346 4.051 20 0 DIADLO CCc1nnc(C[NH2+]Cc2ccc(-c3cccc(C)c3)cc2)s1 ZINC000783884321 1046641736 /nfs/dbraw/zinc/64/17/36/1046641736.db2.gz NADMUYALUSLVHN-UHFFFAOYSA-N 1 2 323.465 4.366 20 0 DIADLO Clc1cccc(C[NH2+]Cc2nc3c(s2)CCC3)c1Cl ZINC000678499502 1046650512 /nfs/dbraw/zinc/65/05/12/1046650512.db2.gz ILRJELMFEGEFGA-UHFFFAOYSA-N 1 2 313.253 4.228 20 0 DIADLO C[C@H]1CC[C@@H](c2ccccc2)[N@H+](Cn2ncsc2=S)C1 ZINC000795707355 1046651711 /nfs/dbraw/zinc/65/17/11/1046651711.db2.gz WRPWTNMMYUBOEA-JSGCOSHPSA-N 1 2 305.472 4.105 20 0 DIADLO C[C@H]1CC[C@@H](c2ccccc2)[N@@H+](Cn2ncsc2=S)C1 ZINC000795707355 1046651716 /nfs/dbraw/zinc/65/17/16/1046651716.db2.gz WRPWTNMMYUBOEA-JSGCOSHPSA-N 1 2 305.472 4.105 20 0 DIADLO CCC[N@H+](Cc1nc(C2CCCC2)no1)Cc1ccc(C)cc1 ZINC000533096489 1046652347 /nfs/dbraw/zinc/65/23/47/1046652347.db2.gz FDFLLUPGCZDOJY-UHFFFAOYSA-N 1 2 313.445 4.448 20 0 DIADLO CCC[N@@H+](Cc1nc(C2CCCC2)no1)Cc1ccc(C)cc1 ZINC000533096489 1046652352 /nfs/dbraw/zinc/65/23/52/1046652352.db2.gz FDFLLUPGCZDOJY-UHFFFAOYSA-N 1 2 313.445 4.448 20 0 DIADLO C[C@H]([NH2+]C1(c2ccccc2)CC1)c1nc(Br)cs1 ZINC000834718421 1046654927 /nfs/dbraw/zinc/65/49/27/1046654927.db2.gz VDHHYDSNBPZWBG-JTQLQIEISA-N 1 2 323.259 4.246 20 0 DIADLO Cc1c[nH+]c(NC2=CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1 ZINC001203025236 1046656322 /nfs/dbraw/zinc/65/63/22/1046656322.db2.gz XMWFIIRXSHNKTG-UHFFFAOYSA-N 1 2 317.433 4.025 20 0 DIADLO C[C@H]1COCCN1c1ccc([NH2+][C@H]2CCC23CCCC3)cc1 ZINC000249035579 1046659709 /nfs/dbraw/zinc/65/97/09/1046659709.db2.gz GAEZPSVLJWSFPX-YJBOKZPZSA-N 1 2 300.446 4.046 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@@H+]1Cc1ccncn1 ZINC001140349825 1046669938 /nfs/dbraw/zinc/66/99/38/1046669938.db2.gz UTHBFMZUGQNPJV-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@H+]1Cc1ccncn1 ZINC001140349825 1046669945 /nfs/dbraw/zinc/66/99/45/1046669945.db2.gz UTHBFMZUGQNPJV-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO Clc1cc2c(c(Cl)c1)[C@H]([NH2+][C@H]1CCCc3cn[nH]c31)CC2 ZINC000678598344 1046672755 /nfs/dbraw/zinc/67/27/55/1046672755.db2.gz FWADYMRRZPQFPH-KGLIPLIRSA-N 1 2 322.239 4.371 20 0 DIADLO Clc1cc2c(c(Cl)c1)[C@H]([NH2+][C@H]1CCCc3c[nH]nc31)CC2 ZINC000678598344 1046672760 /nfs/dbraw/zinc/67/27/60/1046672760.db2.gz FWADYMRRZPQFPH-KGLIPLIRSA-N 1 2 322.239 4.371 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2nc(C)c3ccccc3n2)cc1 ZINC000533224718 1046673867 /nfs/dbraw/zinc/67/38/67/1046673867.db2.gz GNHPCFUEUVYELK-UHFFFAOYSA-N 1 2 305.425 4.133 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2nc(C)c3ccccc3n2)cc1 ZINC000533224718 1046673872 /nfs/dbraw/zinc/67/38/72/1046673872.db2.gz GNHPCFUEUVYELK-UHFFFAOYSA-N 1 2 305.425 4.133 20 0 DIADLO Cc1cc(CNc2[nH+]c3cc(Cl)ccc3n2C)cc(Cl)n1 ZINC000795783983 1046677380 /nfs/dbraw/zinc/67/73/80/1046677380.db2.gz RELYJEDDSPJFIW-UHFFFAOYSA-N 1 2 321.211 4.196 20 0 DIADLO Cc1cc(CNc2[nH+]c3ccccc3n2C2CC2)cc(Cl)n1 ZINC000795791312 1046679303 /nfs/dbraw/zinc/67/93/03/1046679303.db2.gz XWVGLMZPCMJZTO-UHFFFAOYSA-N 1 2 312.804 4.340 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@H](c3cccnc3)C3CCC3)ccc21 ZINC000795809552 1046682564 /nfs/dbraw/zinc/68/25/64/1046682564.db2.gz MKLHMJJDDNYGEH-FQEVSTJZSA-N 1 2 307.441 4.417 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@H](c3cccnc3)C3CCC3)ccc21 ZINC000795809552 1046682572 /nfs/dbraw/zinc/68/25/72/1046682572.db2.gz MKLHMJJDDNYGEH-FQEVSTJZSA-N 1 2 307.441 4.417 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@H+](C)Cc1nc2c(s1)CCCC2 ZINC000533308681 1046688935 /nfs/dbraw/zinc/68/89/35/1046688935.db2.gz UZQHRQXGLAXPMU-GFCCVEGCSA-N 1 2 304.434 4.354 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@@H+](C)Cc1nc2c(s1)CCCC2 ZINC000533308681 1046688942 /nfs/dbraw/zinc/68/89/42/1046688942.db2.gz UZQHRQXGLAXPMU-GFCCVEGCSA-N 1 2 304.434 4.354 20 0 DIADLO C[C@@H]1CCC[N@H+](Cn2c3ccccc3n(C(F)F)c2=S)C1 ZINC000834874257 1046691626 /nfs/dbraw/zinc/69/16/26/1046691626.db2.gz CNKYENCOIHBJTA-LLVKDONJSA-N 1 2 311.401 4.257 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cn2c3ccccc3n(C(F)F)c2=S)C1 ZINC000834874257 1046691631 /nfs/dbraw/zinc/69/16/31/1046691631.db2.gz CNKYENCOIHBJTA-LLVKDONJSA-N 1 2 311.401 4.257 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1nc(-c2ccccc2)oc1C ZINC000678805587 1046704001 /nfs/dbraw/zinc/70/40/01/1046704001.db2.gz ZIWWWBKAYXSASZ-NSHDSACASA-N 1 2 311.385 4.106 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1nc(-c2ccccc2)oc1C ZINC000678805586 1046705150 /nfs/dbraw/zinc/70/51/50/1046705150.db2.gz ZIWWWBKAYXSASZ-LLVKDONJSA-N 1 2 311.385 4.106 20 0 DIADLO C[C@@H](c1nc2ccccc2n1C(F)F)[N@H+](C)CCC(F)(F)F ZINC000533356499 1046705153 /nfs/dbraw/zinc/70/51/53/1046705153.db2.gz KGVCXTZNYGUCRR-VIFPVBQESA-N 1 2 321.293 4.377 20 0 DIADLO C[C@@H](c1nc2ccccc2n1C(F)F)[N@@H+](C)CCC(F)(F)F ZINC000533356499 1046705166 /nfs/dbraw/zinc/70/51/66/1046705166.db2.gz KGVCXTZNYGUCRR-VIFPVBQESA-N 1 2 321.293 4.377 20 0 DIADLO CCc1nn(C)cc1C[N@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000678813865 1046706351 /nfs/dbraw/zinc/70/63/51/1046706351.db2.gz NSYHQUSLDFZFNM-UHFFFAOYSA-N 1 2 323.440 4.086 20 0 DIADLO CCc1nn(C)cc1C[N@@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000678813865 1046706363 /nfs/dbraw/zinc/70/63/63/1046706363.db2.gz NSYHQUSLDFZFNM-UHFFFAOYSA-N 1 2 323.440 4.086 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1ccccc1Br ZINC000533377408 1046707581 /nfs/dbraw/zinc/70/75/81/1046707581.db2.gz QTODLWZXMIKUOZ-LBPRGKRZSA-N 1 2 320.230 4.348 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ccccc1Br ZINC000533377408 1046707596 /nfs/dbraw/zinc/70/75/96/1046707596.db2.gz QTODLWZXMIKUOZ-LBPRGKRZSA-N 1 2 320.230 4.348 20 0 DIADLO CCc1nc(C[NH2+][C@H](c2ccccc2F)C2CCCC2)co1 ZINC000834899156 1046710506 /nfs/dbraw/zinc/71/05/06/1046710506.db2.gz OWZSMHDQRHUDQA-SFHVURJKSA-N 1 2 302.393 4.397 20 0 DIADLO Cc1oc(-c2ccccc2)c(C(=O)OCCCn2cc[nH+]c2)c1C ZINC000784851219 1046713403 /nfs/dbraw/zinc/71/34/03/1046713403.db2.gz VXFTUWKZBFCEFM-UHFFFAOYSA-N 1 2 324.380 4.007 20 0 DIADLO c1n[nH]c([C@@H]([NH2+]CCCCc2ccccc2)C2CCCCC2)n1 ZINC000644532500 1046719901 /nfs/dbraw/zinc/71/99/01/1046719901.db2.gz FTJFAXJSNMZXGL-SFHVURJKSA-N 1 2 312.461 4.039 20 0 DIADLO CC(C)n1ccn(C[N@H+](C)Cc2cccc(Cl)c2)c1=S ZINC000834956883 1046725703 /nfs/dbraw/zinc/72/57/03/1046725703.db2.gz CXABEDGMULNQCO-UHFFFAOYSA-N 1 2 309.866 4.343 20 0 DIADLO CC(C)n1ccn(C[N@@H+](C)Cc2cccc(Cl)c2)c1=S ZINC000834956883 1046725720 /nfs/dbraw/zinc/72/57/20/1046725720.db2.gz CXABEDGMULNQCO-UHFFFAOYSA-N 1 2 309.866 4.343 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)n1 ZINC000678900268 1046730893 /nfs/dbraw/zinc/73/08/93/1046730893.db2.gz YDKNPVAOCQTBAQ-ANGCBRKESA-N 1 2 305.809 4.079 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc(-c2cccnc2)cc1 ZINC000796778165 1046731359 /nfs/dbraw/zinc/73/13/59/1046731359.db2.gz GBAGMQVJTFRNET-IFXJQAMLSA-N 1 2 318.424 4.200 20 0 DIADLO c1snnc1C[NH2+][C@@H](CC1CCCCC1)c1ccccc1 ZINC000678929151 1046734923 /nfs/dbraw/zinc/73/49/23/1046734923.db2.gz BAVITWMTTJETHZ-KRWDZBQOSA-N 1 2 301.459 4.339 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](Cc2ccccc2)c2ccccc2)n1 ZINC000533480442 1046736198 /nfs/dbraw/zinc/73/61/98/1046736198.db2.gz ZMJSDJRZOZAHFT-SFHVURJKSA-N 1 2 321.424 4.267 20 0 DIADLO Cc1c2ccccc2oc1[C@@H]([NH2+]Cc1csnn1)C(C)C ZINC000678929808 1046737474 /nfs/dbraw/zinc/73/74/74/1046737474.db2.gz OCZFNOAVLAZOLG-HNNXBMFYSA-N 1 2 301.415 4.080 20 0 DIADLO Clc1cccc([C@@H]([NH2+]Cc2csnn2)C2CCCC2)c1 ZINC000678938673 1046739112 /nfs/dbraw/zinc/73/91/12/1046739112.db2.gz GYMDZHHOVHTXGE-HNNXBMFYSA-N 1 2 307.850 4.213 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1csnn1)c1ccc(C(F)(F)F)cc1 ZINC000678938125 1046739924 /nfs/dbraw/zinc/73/99/24/1046739924.db2.gz BBXHHYGDJBPRLT-CYBMUJFWSA-N 1 2 315.364 4.044 20 0 DIADLO Clc1ccc(C[NH+]2CC3(CCC3)C2)c(Br)c1 ZINC001140482772 1046742376 /nfs/dbraw/zinc/74/23/76/1046742376.db2.gz ZBCSADZWHMFOIP-UHFFFAOYSA-N 1 2 300.627 4.088 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1nc2c(s1)CCCC2 ZINC000678949252 1046742648 /nfs/dbraw/zinc/74/26/48/1046742648.db2.gz VODVMRCDALMRMH-LLVKDONJSA-N 1 2 304.484 4.203 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1nc2c(s1)CCCC2 ZINC000678949252 1046742664 /nfs/dbraw/zinc/74/26/64/1046742664.db2.gz VODVMRCDALMRMH-LLVKDONJSA-N 1 2 304.484 4.203 20 0 DIADLO c1csc(C2([NH2+]Cc3nc4c(s3)CCCC4)CCCC2)n1 ZINC000678955114 1046745546 /nfs/dbraw/zinc/74/55/46/1046745546.db2.gz HMMOXZBBKQZIQU-UHFFFAOYSA-N 1 2 319.499 4.038 20 0 DIADLO Clc1ccc(C[N@@H+]2CCC[C@H]3C[C@H]32)c(Br)c1 ZINC001140486293 1046745783 /nfs/dbraw/zinc/74/57/83/1046745783.db2.gz HDIGKFFMRSNAKJ-TVQRCGJNSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1ccc(C[N@H+]2CCC[C@H]3C[C@H]32)c(Br)c1 ZINC001140486293 1046745795 /nfs/dbraw/zinc/74/57/95/1046745795.db2.gz HDIGKFFMRSNAKJ-TVQRCGJNSA-N 1 2 300.627 4.087 20 0 DIADLO C[N@H+](Cc1nc(-c2ccccc2)c[nH]1)Cc1ccc(Cl)cc1 ZINC000533537498 1046745943 /nfs/dbraw/zinc/74/59/43/1046745943.db2.gz MEWCXPMLBLGASG-UHFFFAOYSA-N 1 2 311.816 4.362 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccccc2)c[nH]1)Cc1ccc(Cl)cc1 ZINC000533537498 1046745956 /nfs/dbraw/zinc/74/59/56/1046745956.db2.gz MEWCXPMLBLGASG-UHFFFAOYSA-N 1 2 311.816 4.362 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc2c(s1)CCCC2)c1nc(C)cs1 ZINC000678955285 1046746269 /nfs/dbraw/zinc/74/62/69/1046746269.db2.gz LTOQKXNGNLOBJT-INIZCTEOSA-N 1 2 321.515 4.202 20 0 DIADLO CSC1CC[NH+](Cc2c(Cl)ccc(F)c2Cl)CC1 ZINC001137358604 1046748422 /nfs/dbraw/zinc/74/84/22/1046748422.db2.gz UWBWXNGHZDZDTM-UHFFFAOYSA-N 1 2 308.249 4.460 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](Cc1nc2c(s1)CCCC2)C1CC1 ZINC000678972902 1046750658 /nfs/dbraw/zinc/75/06/58/1046750658.db2.gz XFWYBVMARUARAD-LBPRGKRZSA-N 1 2 302.443 4.341 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cc1Cl ZINC000533555650 1046750858 /nfs/dbraw/zinc/75/08/58/1046750858.db2.gz ORNCLFCPBIVROH-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cc1Cl ZINC000533555650 1046750873 /nfs/dbraw/zinc/75/08/73/1046750873.db2.gz ORNCLFCPBIVROH-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](Cc1nc2c(s1)CCCC2)C1CC1 ZINC000678972902 1046750672 /nfs/dbraw/zinc/75/06/72/1046750672.db2.gz XFWYBVMARUARAD-LBPRGKRZSA-N 1 2 302.443 4.341 20 0 DIADLO C[N@H+](Cc1cc2ccccc2[nH]1)Cc1nc2c(s1)CCCC2 ZINC000678992817 1046751022 /nfs/dbraw/zinc/75/10/22/1046751022.db2.gz OWHBTPDZWIUCCX-UHFFFAOYSA-N 1 2 311.454 4.135 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2[nH]1)Cc1nc2c(s1)CCCC2 ZINC000678992817 1046751037 /nfs/dbraw/zinc/75/10/37/1046751037.db2.gz OWHBTPDZWIUCCX-UHFFFAOYSA-N 1 2 311.454 4.135 20 0 DIADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)C1=CCCCC1 ZINC000644965066 1046751526 /nfs/dbraw/zinc/75/15/26/1046751526.db2.gz UELQDCZNJJISIG-UHFFFAOYSA-N 1 2 321.424 4.325 20 0 DIADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)[C@H]1CC12CCC2 ZINC000644965551 1046752346 /nfs/dbraw/zinc/75/23/46/1046752346.db2.gz OJMHHFRXFQIZGT-MRXNPFEDSA-N 1 2 321.424 4.015 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)o1)c1nc2ccc(Cl)cc2n1C ZINC000678998582 1046752177 /nfs/dbraw/zinc/75/21/77/1046752177.db2.gz WFENIMFSVVVLDC-VIFPVBQESA-N 1 2 324.211 4.324 20 0 DIADLO COc1ncc(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)cc1Cl ZINC000533558635 1046753975 /nfs/dbraw/zinc/75/39/75/1046753975.db2.gz XPHKMLSVVWTIMU-IUODEOHRSA-N 1 2 320.820 4.310 20 0 DIADLO COc1ncc(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)cc1Cl ZINC000533558635 1046753990 /nfs/dbraw/zinc/75/39/90/1046753990.db2.gz XPHKMLSVVWTIMU-IUODEOHRSA-N 1 2 320.820 4.310 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CCC[C@H]2c2ccccc2)c(C)[nH+]1 ZINC000455476118 1046769210 /nfs/dbraw/zinc/76/92/10/1046769210.db2.gz LNWPBXSFAUSUGJ-ZWKOTPCHSA-N 1 2 323.440 4.465 20 0 DIADLO CCN(CCc1cccs1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455477877 1046769328 /nfs/dbraw/zinc/76/93/28/1046769328.db2.gz MECOPILJOAFHMD-UHFFFAOYSA-N 1 2 317.458 4.165 20 0 DIADLO CSc1cc(O)ccc1NC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455494617 1046770225 /nfs/dbraw/zinc/77/02/25/1046770225.db2.gz DYGJKUZIUGSWLO-UHFFFAOYSA-N 1 2 317.414 4.078 20 0 DIADLO CCc1cccc2c1OCC[C@@H]2[NH2+]Cc1cccc(O)c1Cl ZINC000645154319 1046770937 /nfs/dbraw/zinc/77/09/37/1046770937.db2.gz ZPSPODVRSHRGEF-HNNXBMFYSA-N 1 2 317.816 4.221 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@@]3(CC=CCC3)C2)c(C)[nH+]1 ZINC000455479093 1046771461 /nfs/dbraw/zinc/77/14/61/1046771461.db2.gz NOVIGRZCIJNPIV-IBGZPJMESA-N 1 2 313.445 4.361 20 0 DIADLO Cc1ccn2cc(C[N@@H+](C)Cc3cc(F)cc(Cl)c3)nc2c1 ZINC001140540560 1046772573 /nfs/dbraw/zinc/77/25/73/1046772573.db2.gz ATIIHLYMJXSOIU-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1ccn2cc(C[N@H+](C)Cc3cc(F)cc(Cl)c3)nc2c1 ZINC001140540560 1046772585 /nfs/dbraw/zinc/77/25/85/1046772585.db2.gz ATIIHLYMJXSOIU-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455497100 1046772937 /nfs/dbraw/zinc/77/29/37/1046772937.db2.gz PSBHPTPOYKKHTR-MLGOLLRUSA-N 1 2 303.450 4.439 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCCO[C@H](c3ccccc3)C2)c1 ZINC000645158283 1046773785 /nfs/dbraw/zinc/77/37/85/1046773785.db2.gz JYEIZMYEJDMZHV-IBGZPJMESA-N 1 2 322.383 4.342 20 0 DIADLO CC[N@H+](Cc1ccccc1)Cc1cccc(O)c1Br ZINC001140547652 1046777612 /nfs/dbraw/zinc/77/76/12/1046777612.db2.gz ZAQWVARLURKLKW-UHFFFAOYSA-N 1 2 320.230 4.177 20 0 DIADLO CC[N@@H+](Cc1ccccc1)Cc1cccc(O)c1Br ZINC001140547652 1046777624 /nfs/dbraw/zinc/77/76/24/1046777624.db2.gz ZAQWVARLURKLKW-UHFFFAOYSA-N 1 2 320.230 4.177 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@H](C)C2CCCCC2)c(C)[nH+]1 ZINC000455518646 1046778125 /nfs/dbraw/zinc/77/81/25/1046778125.db2.gz LQCOJOCFOYXJMU-OAHLLOKOSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)c(C)[nH+]1 ZINC000455504381 1046778358 /nfs/dbraw/zinc/77/83/58/1046778358.db2.gz WNMGFMNFBSIYAI-YVEFUNNKSA-N 1 2 324.428 4.017 20 0 DIADLO CCC[C@H](C)[C@@H]1CCCN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455507196 1046779224 /nfs/dbraw/zinc/77/92/24/1046779224.db2.gz YRFSUMHIMZVNQQ-LRDDRELGSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@]3(CC[C@@H](C)C3)C2)c(C)[nH+]1 ZINC000455508397 1046780250 /nfs/dbraw/zinc/78/02/50/1046780250.db2.gz ZSUGGNWECREOMB-XIKOKIGWSA-N 1 2 301.434 4.051 20 0 DIADLO COc1cc(C)c(NC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1C ZINC000455524548 1046780782 /nfs/dbraw/zinc/78/07/82/1046780782.db2.gz OPAGVJPDJPYEDX-UHFFFAOYSA-N 1 2 313.401 4.276 20 0 DIADLO CC[C@@H](C)n1ncc(NC(=O)Nc2c(C)cc(C)[nH+]c2C)c1C ZINC000455533911 1046781332 /nfs/dbraw/zinc/78/13/32/1046781332.db2.gz UNTFYVSSBYZZLI-GFCCVEGCSA-N 1 2 315.421 4.127 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)cc2Cl)cc1 ZINC000679134754 1046783601 /nfs/dbraw/zinc/78/36/01/1046783601.db2.gz XQYQIXJLCAIZTJ-INIZCTEOSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@H+]2Cc2ncc(Cl)cc2Cl)cc1 ZINC000679134754 1046783609 /nfs/dbraw/zinc/78/36/09/1046783609.db2.gz XQYQIXJLCAIZTJ-INIZCTEOSA-N 1 2 323.223 4.431 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1nc2ccccc2c(C)c1Cl ZINC000679186263 1046789469 /nfs/dbraw/zinc/78/94/69/1046789469.db2.gz GQXBONPHGSKTEG-OCCSQVGLSA-N 1 2 318.848 4.196 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1nc2ccccc2c(C)c1Cl ZINC000679186263 1046789481 /nfs/dbraw/zinc/78/94/81/1046789481.db2.gz GQXBONPHGSKTEG-OCCSQVGLSA-N 1 2 318.848 4.196 20 0 DIADLO COc1ccc(-c2cnc(C[N@H+](C)[C@@H](C)c3ccco3)o2)cc1 ZINC000069065039 1046791651 /nfs/dbraw/zinc/79/16/51/1046791651.db2.gz YMBALUAIRHQULD-ZDUSSCGKSA-N 1 2 312.369 4.136 20 0 DIADLO COc1ccc(-c2cnc(C[N@@H+](C)[C@@H](C)c3ccco3)o2)cc1 ZINC000069065039 1046791662 /nfs/dbraw/zinc/79/16/62/1046791662.db2.gz YMBALUAIRHQULD-ZDUSSCGKSA-N 1 2 312.369 4.136 20 0 DIADLO F[C@@H]1COC2(C1)CC[NH+](Cc1cc(Cl)sc1Cl)CC2 ZINC001140589650 1046796921 /nfs/dbraw/zinc/79/69/21/1046796921.db2.gz PRVYMURWCFNXLD-JTQLQIEISA-N 1 2 324.248 4.148 20 0 DIADLO CCCOC1CC[NH+](Cc2cc(Cl)sc2Cl)CC1 ZINC001140589223 1046797126 /nfs/dbraw/zinc/79/71/26/1046797126.db2.gz YPESSIHIAIBPIY-UHFFFAOYSA-N 1 2 308.274 4.446 20 0 DIADLO COCCC1CC[NH+](Cc2cc(Cl)sc2Cl)CC1 ZINC001140588800 1046798210 /nfs/dbraw/zinc/79/82/10/1046798210.db2.gz MPMHXMAGMMBZII-UHFFFAOYSA-N 1 2 308.274 4.303 20 0 DIADLO CC(C)COc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1c[nH]cn1 ZINC000072756896 1046799390 /nfs/dbraw/zinc/79/93/90/1046799390.db2.gz DDBRBRZEUQYKQP-GOSISDBHSA-N 1 2 315.461 4.322 20 0 DIADLO Cc1nc(C[N@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)sc1C ZINC000246460788 1046803355 /nfs/dbraw/zinc/80/33/55/1046803355.db2.gz YWZMDBYLWXRIMM-SUMWQHHRSA-N 1 2 316.470 4.030 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@@H]2C)sc1C ZINC000246460788 1046803377 /nfs/dbraw/zinc/80/33/77/1046803377.db2.gz YWZMDBYLWXRIMM-SUMWQHHRSA-N 1 2 316.470 4.030 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)ncc2F)cc1 ZINC001140607538 1046810055 /nfs/dbraw/zinc/81/00/55/1046810055.db2.gz NIZVSXZNGFMXOQ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(Cl)ncc2F)cc1 ZINC001140607538 1046810071 /nfs/dbraw/zinc/81/00/71/1046810071.db2.gz NIZVSXZNGFMXOQ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO Fc1cnc(Cl)cc1C[NH+]1CCC(c2cccs2)CC1 ZINC001140607759 1046810678 /nfs/dbraw/zinc/81/06/78/1046810678.db2.gz VLTINHJRDKMABL-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO Cc1nc(C[N@H+]2CCS[C@H](C)[C@H]2c2ccccc2)cs1 ZINC000246680634 1046816005 /nfs/dbraw/zinc/81/60/05/1046816005.db2.gz DCUBXVOYTLKZHS-WBMJQRKESA-N 1 2 304.484 4.130 20 0 DIADLO Cc1nc(C[N@@H+]2CCS[C@H](C)[C@H]2c2ccccc2)cs1 ZINC000246680634 1046816022 /nfs/dbraw/zinc/81/60/22/1046816022.db2.gz DCUBXVOYTLKZHS-WBMJQRKESA-N 1 2 304.484 4.130 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)[C@H](C)c2ccc(C)cc2)n1 ZINC000247966829 1046833555 /nfs/dbraw/zinc/83/35/55/1046833555.db2.gz GXQUYEXWQSTOEQ-ZIAGYGMSSA-N 1 2 319.474 4.385 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2)n1 ZINC000247966829 1046833579 /nfs/dbraw/zinc/83/35/79/1046833579.db2.gz GXQUYEXWQSTOEQ-ZIAGYGMSSA-N 1 2 319.474 4.385 20 0 DIADLO COc1ccc(F)cc1C[NH2+]C1(c2ccccc2Cl)CC1 ZINC000645976863 1046835294 /nfs/dbraw/zinc/83/52/94/1046835294.db2.gz ZQKFGJLVGAYHII-UHFFFAOYSA-N 1 2 305.780 4.267 20 0 DIADLO Cc1cc(-c2nnc(C[NH2+]C3(c4ccccc4C)CC3)o2)c(C)o1 ZINC000645979105 1046838377 /nfs/dbraw/zinc/83/83/77/1046838377.db2.gz WMRNJQQUOCXHKB-UHFFFAOYSA-N 1 2 323.396 4.034 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2cc(F)ccc2Cl)CC1 ZINC000646001475 1046842448 /nfs/dbraw/zinc/84/24/48/1046842448.db2.gz LVILBRVRKBNFIZ-UHFFFAOYSA-N 1 2 305.780 4.267 20 0 DIADLO Cc1cccc(C2([NH2+]Cc3noc(-c4ccccc4)n3)CCC2)c1 ZINC000646021099 1046843382 /nfs/dbraw/zinc/84/33/82/1046843382.db2.gz NKVPIZRIXYULRD-UHFFFAOYSA-N 1 2 319.408 4.214 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccn(C3CCCC3)n2)CC2CC2)cn1 ZINC000646019433 1046844919 /nfs/dbraw/zinc/84/49/19/1046844919.db2.gz DFGHXRIWMFUIDQ-UHFFFAOYSA-N 1 2 324.472 4.114 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccn(C3CCCC3)n2)CC2CC2)cn1 ZINC000646019433 1046844937 /nfs/dbraw/zinc/84/49/37/1046844937.db2.gz DFGHXRIWMFUIDQ-UHFFFAOYSA-N 1 2 324.472 4.114 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2nc(C)c(C)o2)o1 ZINC000076145154 1046845076 /nfs/dbraw/zinc/84/50/76/1046845076.db2.gz QEZHNPOKZBFHJI-MLGOLLRUSA-N 1 2 302.418 4.420 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2nc(C)c(C)o2)o1 ZINC000076145154 1046845096 /nfs/dbraw/zinc/84/50/96/1046845096.db2.gz QEZHNPOKZBFHJI-MLGOLLRUSA-N 1 2 302.418 4.420 20 0 DIADLO CC(C)c1cc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)on1 ZINC000679481883 1046846574 /nfs/dbraw/zinc/84/65/74/1046846574.db2.gz HEAWOGGHFULDKV-UHFFFAOYSA-N 1 2 312.369 4.473 20 0 DIADLO C[N@H+](Cc1ccc(CO)o1)Cc1sc2ccccc2c1Cl ZINC001140681828 1046849062 /nfs/dbraw/zinc/84/90/62/1046849062.db2.gz FKBPZVORUHAYIZ-UHFFFAOYSA-N 1 2 321.829 4.272 20 0 DIADLO C[N@@H+](Cc1ccc(CO)o1)Cc1sc2ccccc2c1Cl ZINC001140681828 1046849085 /nfs/dbraw/zinc/84/90/85/1046849085.db2.gz FKBPZVORUHAYIZ-UHFFFAOYSA-N 1 2 321.829 4.272 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)CCc2ccccc2F)cs1 ZINC000076729290 1046866184 /nfs/dbraw/zinc/86/61/84/1046866184.db2.gz JIZYOLWNMAOPBM-ZDUSSCGKSA-N 1 2 322.449 4.054 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)CCc2ccccc2F)cs1 ZINC000076729290 1046866199 /nfs/dbraw/zinc/86/61/99/1046866199.db2.gz JIZYOLWNMAOPBM-ZDUSSCGKSA-N 1 2 322.449 4.054 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000679547997 1046866897 /nfs/dbraw/zinc/86/68/97/1046866897.db2.gz SUZGCTGHIIVHOY-NWDGAFQWSA-N 1 2 324.346 4.013 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000679547997 1046866913 /nfs/dbraw/zinc/86/69/13/1046866913.db2.gz SUZGCTGHIIVHOY-NWDGAFQWSA-N 1 2 324.346 4.013 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccc(Sc3ccccn3)o2)C[C@@H]1F ZINC000646153399 1046868389 /nfs/dbraw/zinc/86/83/89/1046868389.db2.gz XBBYZRNWEAOJSV-JSGCOSHPSA-N 1 2 306.406 4.006 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccc(Sc3ccccn3)o2)C[C@@H]1F ZINC000646153399 1046868405 /nfs/dbraw/zinc/86/84/05/1046868405.db2.gz XBBYZRNWEAOJSV-JSGCOSHPSA-N 1 2 306.406 4.006 20 0 DIADLO CCCc1nc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)cs1 ZINC000679545030 1046868724 /nfs/dbraw/zinc/86/87/24/1046868724.db2.gz UWVFQEVLQMFVBE-QWRGUYRKSA-N 1 2 306.397 4.258 20 0 DIADLO CCCc1nc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)cs1 ZINC000679545030 1046868748 /nfs/dbraw/zinc/86/87/48/1046868748.db2.gz UWVFQEVLQMFVBE-QWRGUYRKSA-N 1 2 306.397 4.258 20 0 DIADLO c1ccc([C@H]2[N@H+](Cc3nc4c(s3)CCC4)CC23CCC3)cc1 ZINC000646228169 1046874884 /nfs/dbraw/zinc/87/48/84/1046874884.db2.gz SYQOBFJBNZGCNL-GOSISDBHSA-N 1 2 310.466 4.359 20 0 DIADLO c1ccc([C@H]2[N@@H+](Cc3nc4c(s3)CCC4)CC23CCC3)cc1 ZINC000646228169 1046874899 /nfs/dbraw/zinc/87/48/99/1046874899.db2.gz SYQOBFJBNZGCNL-GOSISDBHSA-N 1 2 310.466 4.359 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1c(Cl)ncc2ccccc21 ZINC001140722320 1046875072 /nfs/dbraw/zinc/87/50/72/1046875072.db2.gz STPBRZGFRAAAPN-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1c(Cl)ncc2ccccc21 ZINC001140722320 1046875085 /nfs/dbraw/zinc/87/50/85/1046875085.db2.gz STPBRZGFRAAAPN-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2c(Cl)ncc3ccccc32)cn1 ZINC001140726709 1046877537 /nfs/dbraw/zinc/87/75/37/1046877537.db2.gz RTUUSVYEXSFJDR-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2c(Cl)ncc3ccccc32)cn1 ZINC001140726709 1046877547 /nfs/dbraw/zinc/87/75/47/1046877547.db2.gz RTUUSVYEXSFJDR-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO FC(F)O[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2Cl)C1 ZINC000679676700 1046890830 /nfs/dbraw/zinc/89/08/30/1046890830.db2.gz MQQVOXGMCOXAJQ-NSHDSACASA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2Cl)C1 ZINC000679676700 1046890841 /nfs/dbraw/zinc/89/08/41/1046890841.db2.gz MQQVOXGMCOXAJQ-NSHDSACASA-N 1 2 310.171 4.197 20 0 DIADLO Cc1cc(F)ccc1C[NH+](Cc1ccccn1)Cc1ccccn1 ZINC001140777967 1046892568 /nfs/dbraw/zinc/89/25/68/1046892568.db2.gz QNQMOMIIPCRSEA-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2ccc(C)c(C)c2Cl)c[nH+]1 ZINC000646429886 1046900201 /nfs/dbraw/zinc/90/02/01/1046900201.db2.gz XTFJUTYWQZOFFT-UHFFFAOYSA-N 1 2 317.820 4.290 20 0 DIADLO CC[N@H+](Cc1cn(C)nn1)Cc1ccc(C(C)C)cc1C(C)C ZINC000679833788 1046907421 /nfs/dbraw/zinc/90/74/21/1046907421.db2.gz JESNVPGUJNOTAH-UHFFFAOYSA-N 1 2 314.477 4.084 20 0 DIADLO CC[N@@H+](Cc1cn(C)nn1)Cc1ccc(C(C)C)cc1C(C)C ZINC000679833788 1046907431 /nfs/dbraw/zinc/90/74/31/1046907431.db2.gz JESNVPGUJNOTAH-UHFFFAOYSA-N 1 2 314.477 4.084 20 0 DIADLO Fc1ccc(F)c([C@@H]2CCC[N@@H+]2Cc2c[nH]c3ccncc23)c1 ZINC001140807034 1046911480 /nfs/dbraw/zinc/91/14/80/1046911480.db2.gz IXIALAPKSSDPFV-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc(F)c([C@@H]2CCC[N@H+]2Cc2c[nH]c3ccncc23)c1 ZINC001140807034 1046911491 /nfs/dbraw/zinc/91/14/91/1046911491.db2.gz IXIALAPKSSDPFV-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO Cc1ccccc1-c1noc([C@@H](C)[NH2+][C@H](C)c2cnccc2C)n1 ZINC000679943643 1046915322 /nfs/dbraw/zinc/91/53/22/1046915322.db2.gz XGDAARGNXDKATC-HUUCEWRRSA-N 1 2 322.412 4.160 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCc3ccccc3[C@@H]2C)c(F)c1 ZINC001140823979 1046915505 /nfs/dbraw/zinc/91/55/05/1046915505.db2.gz UUIQFAOHGZUXEZ-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCc3ccccc3[C@@H]2C)c(F)c1 ZINC001140823979 1046915515 /nfs/dbraw/zinc/91/55/15/1046915515.db2.gz UUIQFAOHGZUXEZ-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+]Cc1ncc(-c2cccc(F)c2)o1 ZINC000679943566 1046916024 /nfs/dbraw/zinc/91/60/24/1046916024.db2.gz DLXUKQDWPPHBGL-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[NH2+][C@@H](C)c3cnccc3C)o2)cc1 ZINC000679940344 1046916339 /nfs/dbraw/zinc/91/63/39/1046916339.db2.gz PFRNWDRCPOTTJD-LSDHHAIUSA-N 1 2 322.412 4.160 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+]Cc1csc(C2CCCC2)n1 ZINC000679942610 1046916467 /nfs/dbraw/zinc/91/64/67/1046916467.db2.gz QEKVCSZVNZSFCP-CYBMUJFWSA-N 1 2 301.459 4.355 20 0 DIADLO Cc1ccccc1-c1noc([C@H](C)[NH2+][C@@H](C)c2cnccc2C)n1 ZINC000679943642 1046916745 /nfs/dbraw/zinc/91/67/45/1046916745.db2.gz XGDAARGNXDKATC-GJZGRUSLSA-N 1 2 322.412 4.160 20 0 DIADLO Cc1ccccc1-c1noc([C@@H](C)[NH2+][C@@H](C)c2cnccc2C)n1 ZINC000679943644 1046917199 /nfs/dbraw/zinc/91/71/99/1046917199.db2.gz XGDAARGNXDKATC-LSDHHAIUSA-N 1 2 322.412 4.160 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C[C@H]1CCC(F)(F)C1 ZINC000798004074 1046920085 /nfs/dbraw/zinc/92/00/85/1046920085.db2.gz BJGYPZURUSWNPN-GFCCVEGCSA-N 1 2 319.355 4.149 20 0 DIADLO CCc1ccc(-c2ccc(-c3noc(C[NH+]4CCC4)n3)cc2)cc1 ZINC001212095345 1046933911 /nfs/dbraw/zinc/93/39/11/1046933911.db2.gz CRUHGSZZRXBFNN-UHFFFAOYSA-N 1 2 319.408 4.172 20 0 DIADLO C[N@H+](Cn1nc(-c2cccc(Cl)c2)oc1=S)C1CCCC1 ZINC000798193289 1046936564 /nfs/dbraw/zinc/93/65/64/1046936564.db2.gz JPJVFHDODGUKRI-UHFFFAOYSA-N 1 2 323.849 4.358 20 0 DIADLO C[N@@H+](Cn1nc(-c2cccc(Cl)c2)oc1=S)C1CCCC1 ZINC000798193289 1046936576 /nfs/dbraw/zinc/93/65/76/1046936576.db2.gz JPJVFHDODGUKRI-UHFFFAOYSA-N 1 2 323.849 4.358 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@@H+]2Cc2ccc(Cl)nc2)cc1 ZINC000303611494 1046936658 /nfs/dbraw/zinc/93/66/58/1046936658.db2.gz BQVRDUQXKTUTTM-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@H+]2Cc2ccc(Cl)nc2)cc1 ZINC000303611494 1046936671 /nfs/dbraw/zinc/93/66/71/1046936671.db2.gz BQVRDUQXKTUTTM-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccccc1[C@H](C)CC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000261455028 1046941477 /nfs/dbraw/zinc/94/14/77/1046941477.db2.gz QWBKKIDXBGHSEY-MRXNPFEDSA-N 1 2 319.408 4.313 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCC[C@@H]2c2ccc(C)cc2)s1 ZINC000680055078 1046941570 /nfs/dbraw/zinc/94/15/70/1046941570.db2.gz NUTARZOIPPHRTD-OAHLLOKOSA-N 1 2 301.459 4.136 20 0 DIADLO CCc1nnc(C[N@H+]2CCCC[C@@H]2c2ccc(C)cc2)s1 ZINC000680055078 1046941576 /nfs/dbraw/zinc/94/15/76/1046941576.db2.gz NUTARZOIPPHRTD-OAHLLOKOSA-N 1 2 301.459 4.136 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nnc(CC)s2)o1 ZINC000680053599 1046942532 /nfs/dbraw/zinc/94/25/32/1046942532.db2.gz SVQVETJBPXIZGI-AWEZNQCLSA-N 1 2 319.474 4.373 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@H+]2Cc2nnc(CC)s2)o1 ZINC000680053599 1046942537 /nfs/dbraw/zinc/94/25/37/1046942537.db2.gz SVQVETJBPXIZGI-AWEZNQCLSA-N 1 2 319.474 4.373 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(O)c(F)c2F)c1 ZINC001140893704 1046943919 /nfs/dbraw/zinc/94/39/19/1046943919.db2.gz ZICMJYGSHGZGDP-HNNXBMFYSA-N 1 2 319.351 4.016 20 0 DIADLO COCC[C@@H](Cc1ccco1)Nc1[nH+]c2ccccc2cc1C ZINC000680065651 1046944374 /nfs/dbraw/zinc/94/43/74/1046944374.db2.gz XCILOFVDEQUTOX-INIZCTEOSA-N 1 2 310.397 4.196 20 0 DIADLO CCCOc1cccc2c(NC3CCC(C)(O)CC3)cc[nH+]c12 ZINC000798392522 1046951020 /nfs/dbraw/zinc/95/10/20/1046951020.db2.gz AUCLTLCGPABZCN-UHFFFAOYSA-N 1 2 314.429 4.129 20 0 DIADLO Cc1cc(C[N@@H+]2[C@@H]3Cc4ccccc4[C@@]2(C)c2ccccc23)[nH]n1 ZINC001203080650 1046953474 /nfs/dbraw/zinc/95/34/74/1046953474.db2.gz AGDJAOBWUQKMBU-RTWAWAEBSA-N 1 2 315.420 4.095 20 0 DIADLO Cc1cc(C[N@H+]2[C@@H]3Cc4ccccc4[C@@]2(C)c2ccccc23)[nH]n1 ZINC001203080650 1046953482 /nfs/dbraw/zinc/95/34/82/1046953482.db2.gz AGDJAOBWUQKMBU-RTWAWAEBSA-N 1 2 315.420 4.095 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@@H+]1Cc1cnco1 ZINC001140933602 1046953675 /nfs/dbraw/zinc/95/36/75/1046953675.db2.gz YZTNTLIIXSGFNW-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@H+]1Cc1cnco1 ZINC001140933602 1046953686 /nfs/dbraw/zinc/95/36/86/1046953686.db2.gz YZTNTLIIXSGFNW-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2ncc(C(F)(F)F)s2)CC1 ZINC000647224294 1046956086 /nfs/dbraw/zinc/95/60/86/1046956086.db2.gz ACYMWDGIQYPZEQ-UHFFFAOYSA-N 1 2 312.360 4.249 20 0 DIADLO Cc1cccn2c(CNc3ccccc3NC(C)(C)C)c[nH+]c12 ZINC000798500130 1046958299 /nfs/dbraw/zinc/95/82/99/1046958299.db2.gz QKGRVODIJBWBOL-UHFFFAOYSA-N 1 2 308.429 4.465 20 0 DIADLO CC[C@H](C)CCCCC(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000680221651 1046958698 /nfs/dbraw/zinc/95/86/98/1046958698.db2.gz YPIDSVHKGCWTJB-INIZCTEOSA-N 1 2 313.445 4.095 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2nc3c(s2)CCCC3)CCC1 ZINC000647237374 1046959363 /nfs/dbraw/zinc/95/93/63/1046959363.db2.gz VWPHUECDFURCDK-UHFFFAOYSA-N 1 2 316.445 4.330 20 0 DIADLO CN(C)c1cc[nH+]c(NC(=O)c2sccc2-c2ccccc2)c1 ZINC000680256154 1046960894 /nfs/dbraw/zinc/96/08/94/1046960894.db2.gz XOLNLKRKGXNTPU-UHFFFAOYSA-N 1 2 323.421 4.128 20 0 DIADLO CC(C)[C@H]1C[C@@H]1C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000476006387 1046961098 /nfs/dbraw/zinc/96/10/98/1046961098.db2.gz GMPPRTBKKBEJLS-MSOLQXFVSA-N 1 2 323.440 4.117 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1cc2n(n1)CCCC2 ZINC000647279994 1046964238 /nfs/dbraw/zinc/96/42/38/1046964238.db2.gz LSUJDDODQWKNHK-QWHCGFSZSA-N 1 2 303.837 4.285 20 0 DIADLO Cc1cc(C[NH+]2CCC(c3csc4ccccc34)CC2)n[nH]1 ZINC001203082911 1046964878 /nfs/dbraw/zinc/96/48/78/1046964878.db2.gz BYVJBCDJUWGDIG-UHFFFAOYSA-N 1 2 311.454 4.312 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)s1 ZINC000680334148 1046965987 /nfs/dbraw/zinc/96/59/87/1046965987.db2.gz IIXRHEWPWFLTJF-QWRGUYRKSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1cnc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)s1 ZINC000680334148 1046965993 /nfs/dbraw/zinc/96/59/93/1046965993.db2.gz IIXRHEWPWFLTJF-QWRGUYRKSA-N 1 2 306.397 4.429 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2ccccc2)o1)c1cc2n(n1)CCCC2 ZINC000647283767 1046967673 /nfs/dbraw/zinc/96/76/73/1046967673.db2.gz MQNNWFHXURNVST-HNNXBMFYSA-N 1 2 321.424 4.330 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1cc2n(n1)CCCC2 ZINC000647289842 1046968635 /nfs/dbraw/zinc/96/86/35/1046968635.db2.gz LIYTYXSPGIBVCQ-RYUDHWBXSA-N 1 2 321.827 4.424 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H]1COc2cc(F)cc(F)c21 ZINC000680354868 1046971457 /nfs/dbraw/zinc/97/14/57/1046971457.db2.gz JNEZORZGWKDHJS-IAQYHMDHSA-N 1 2 319.351 4.066 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+][C@@H]1COc2cc(F)cc(F)c21 ZINC000680355275 1046972232 /nfs/dbraw/zinc/97/22/32/1046972232.db2.gz ULWLRYZCLUXWKQ-IAQYHMDHSA-N 1 2 319.351 4.148 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1cc2n(n1)CCCC2 ZINC000647304437 1046973710 /nfs/dbraw/zinc/97/37/10/1046973710.db2.gz NCFBGGYVAJEQGQ-CYBMUJFWSA-N 1 2 313.420 4.087 20 0 DIADLO CC1(C)Cc2occc2[C@@H]([NH2+][C@H]2COc3cc(F)cc(F)c32)C1 ZINC000680355376 1046973913 /nfs/dbraw/zinc/97/39/13/1046973913.db2.gz OPLJPSHIVSCINS-KBPBESRZSA-N 1 2 319.351 4.295 20 0 DIADLO C[C@H]([NH2+]C1(c2ccccc2Cl)CC1)c1cc2n(n1)CCCC2 ZINC000647315598 1046975002 /nfs/dbraw/zinc/97/50/02/1046975002.db2.gz UVLMBQMFODCDEE-ZDUSSCGKSA-N 1 2 315.848 4.213 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1ccc(-c3ccccn3)s1)C2 ZINC001141002291 1046975112 /nfs/dbraw/zinc/97/51/12/1046975112.db2.gz SAIZFPYUBJMDSN-UHFFFAOYSA-N 1 2 310.397 4.465 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1ccc(-c3ccccn3)s1)C2 ZINC001141002291 1046975122 /nfs/dbraw/zinc/97/51/22/1046975122.db2.gz SAIZFPYUBJMDSN-UHFFFAOYSA-N 1 2 310.397 4.465 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc(-c3ccccn3)s1)C2 ZINC001141006867 1046976484 /nfs/dbraw/zinc/97/64/84/1046976484.db2.gz NMVDDBKCQAAALB-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc(-c3ccccn3)s1)C2 ZINC001141006867 1046976490 /nfs/dbraw/zinc/97/64/90/1046976490.db2.gz NMVDDBKCQAAALB-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1ccc(-c2ccccn2)s1 ZINC001141006786 1046977478 /nfs/dbraw/zinc/97/74/78/1046977478.db2.gz KGOUCMXZIIVVRO-UHFFFAOYSA-N 1 2 322.433 4.125 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1ccc(-c2ccccn2)s1 ZINC001141006786 1046977484 /nfs/dbraw/zinc/97/74/84/1046977484.db2.gz KGOUCMXZIIVVRO-UHFFFAOYSA-N 1 2 322.433 4.125 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1nc(-c2cccs2)oc1C ZINC000680381998 1046977755 /nfs/dbraw/zinc/97/77/55/1046977755.db2.gz CTBAYWBABLBUJZ-SECBINFHSA-N 1 2 317.414 4.167 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1csc(C2CCCC2)n1 ZINC000680381049 1046978032 /nfs/dbraw/zinc/97/80/32/1046978032.db2.gz KVDFIECMXYGIEA-JTQLQIEISA-N 1 2 305.447 4.256 20 0 DIADLO Oc1cccc2ccc(C[N@@H+]3CCc4ccc(Cl)cc4C3)nc12 ZINC001141019021 1046980598 /nfs/dbraw/zinc/98/05/98/1046980598.db2.gz UPVOZSWNYJHGEZ-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1cccc2ccc(C[N@H+]3CCc4ccc(Cl)cc4C3)nc12 ZINC001141019021 1046980605 /nfs/dbraw/zinc/98/06/05/1046980605.db2.gz UPVOZSWNYJHGEZ-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Cc1ccncc1C[N@@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001141036355 1046986013 /nfs/dbraw/zinc/98/60/13/1046986013.db2.gz XAPJLXQTEXESKH-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccncc1C[N@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001141036355 1046986024 /nfs/dbraw/zinc/98/60/24/1046986024.db2.gz XAPJLXQTEXESKH-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO CCN(Cc1ccn2cc[nH+]c2c1)Cc1c(F)cccc1Cl ZINC001141046754 1046990788 /nfs/dbraw/zinc/99/07/88/1046990788.db2.gz NLSBWATYXBJGBO-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO CCCCCC[C@H](CC)C(=O)Nc1nc2c(s1)C[N@H+](C)CC2 ZINC000303839894 1046993522 /nfs/dbraw/zinc/99/35/22/1046993522.db2.gz MSUTXBVFVIBHKS-ZDUSSCGKSA-N 1 2 323.506 4.066 20 0 DIADLO CCCCCC[C@H](CC)C(=O)Nc1nc2c(s1)C[N@@H+](C)CC2 ZINC000303839894 1046993528 /nfs/dbraw/zinc/99/35/28/1046993528.db2.gz MSUTXBVFVIBHKS-ZDUSSCGKSA-N 1 2 323.506 4.066 20 0 DIADLO COc1ccc2nc(Cl)c(C[N@@H+]3CCCC[C@H](F)C3)cc2c1 ZINC001141062255 1046993896 /nfs/dbraw/zinc/99/38/96/1046993896.db2.gz BEQJCYFTIVTQRU-AWEZNQCLSA-N 1 2 322.811 4.221 20 0 DIADLO COc1ccc2nc(Cl)c(C[N@H+]3CCCC[C@H](F)C3)cc2c1 ZINC001141062255 1046993906 /nfs/dbraw/zinc/99/39/06/1046993906.db2.gz BEQJCYFTIVTQRU-AWEZNQCLSA-N 1 2 322.811 4.221 20 0 DIADLO CCCCc1nc(C[NH+]2CCC(c3ccccc3F)CC2)c[nH]1 ZINC001141070328 1046997057 /nfs/dbraw/zinc/99/70/57/1046997057.db2.gz VAVZZJLAUFMCBK-UHFFFAOYSA-N 1 2 315.436 4.271 20 0 DIADLO CCCCc1ncc(C[NH+]2CCC(c3ccccc3F)CC2)[nH]1 ZINC001141070328 1046997060 /nfs/dbraw/zinc/99/70/60/1046997060.db2.gz VAVZZJLAUFMCBK-UHFFFAOYSA-N 1 2 315.436 4.271 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ccsc2)c1Br ZINC001141092398 1047007516 /nfs/dbraw/zinc/00/75/16/1047007516.db2.gz QZHLBPYHVMIQDY-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ccsc2)c1Br ZINC001141092398 1047007527 /nfs/dbraw/zinc/00/75/27/1047007527.db2.gz QZHLBPYHVMIQDY-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)nn1C ZINC000282070260 1047001371 /nfs/dbraw/zinc/00/13/71/1047001371.db2.gz HBPFYKUFEPVDPT-SJCJKPOMSA-N 1 2 321.415 4.445 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124887 1047002790 /nfs/dbraw/zinc/00/27/90/1047002790.db2.gz AIGMTJNXTVKFIS-WFASDCNBSA-N 1 2 319.836 4.259 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124887 1047002804 /nfs/dbraw/zinc/00/28/04/1047002804.db2.gz AIGMTJNXTVKFIS-WFASDCNBSA-N 1 2 319.836 4.259 20 0 DIADLO Cc1cccc(C[N@@H+]2CCC[C@@](C)(F)C2)c1Br ZINC001141089298 1047005855 /nfs/dbraw/zinc/00/58/55/1047005855.db2.gz QMRODYIIGWPOCN-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cccc(C[N@H+]2CCC[C@@](C)(F)C2)c1Br ZINC001141089298 1047005872 /nfs/dbraw/zinc/00/58/72/1047005872.db2.gz QMRODYIIGWPOCN-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1noc(C)c1CC[N@@H+](C)Cc1c(Cl)cccc1Cl ZINC000533750685 1047007802 /nfs/dbraw/zinc/00/78/02/1047007802.db2.gz JHEUUJNKCJFKRJ-UHFFFAOYSA-N 1 2 313.228 4.273 20 0 DIADLO Cc1noc(C)c1CC[N@H+](C)Cc1c(Cl)cccc1Cl ZINC000533750685 1047007817 /nfs/dbraw/zinc/00/78/17/1047007817.db2.gz JHEUUJNKCJFKRJ-UHFFFAOYSA-N 1 2 313.228 4.273 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ncc(Cl)nc1Cl ZINC001141134276 1047022668 /nfs/dbraw/zinc/02/26/68/1047022668.db2.gz WQFOCSHSIIYNDQ-AWEZNQCLSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1ncc(Cl)nc1Cl ZINC001141134276 1047022686 /nfs/dbraw/zinc/02/26/86/1047022686.db2.gz WQFOCSHSIIYNDQ-AWEZNQCLSA-N 1 2 322.239 4.429 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1coc(-c2c(F)cccc2F)n1 ZINC000152182103 1047029369 /nfs/dbraw/zinc/02/93/69/1047029369.db2.gz JQIIGCXLDXWFBX-UHFFFAOYSA-N 1 2 318.323 4.235 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1coc(-c2c(F)cccc2F)n1 ZINC000152182103 1047029380 /nfs/dbraw/zinc/02/93/80/1047029380.db2.gz JQIIGCXLDXWFBX-UHFFFAOYSA-N 1 2 318.323 4.235 20 0 DIADLO C[N@H+](Cc1cncnc1)Cc1cc(F)ccc1Oc1ccccc1 ZINC001137669409 1047051015 /nfs/dbraw/zinc/05/10/15/1047051015.db2.gz RXCCMTOGXRCMNI-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[N@@H+](Cc1cncnc1)Cc1cc(F)ccc1Oc1ccccc1 ZINC001137669409 1047051028 /nfs/dbraw/zinc/05/10/28/1047051028.db2.gz RXCCMTOGXRCMNI-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO COc1cccc(CNc2[nH+]c3ccccc3n2C2CC2)c1OC ZINC000680852709 1047055268 /nfs/dbraw/zinc/05/52/68/1047055268.db2.gz QOUYLPSOIKPRLL-UHFFFAOYSA-N 1 2 323.396 4.001 20 0 DIADLO Oc1cccc(C[N@@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000536680893 1047060694 /nfs/dbraw/zinc/06/06/94/1047060694.db2.gz GQCSSLQJHNPMCT-QGZVFWFLSA-N 1 2 319.857 4.336 20 0 DIADLO Oc1cccc(C[N@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000536680893 1047060710 /nfs/dbraw/zinc/06/07/10/1047060710.db2.gz GQCSSLQJHNPMCT-QGZVFWFLSA-N 1 2 319.857 4.336 20 0 DIADLO CN(Cc1cccc(-n2cc[nH+]c2)c1)[C@H](C1CCC1)C(F)(F)F ZINC001141243913 1047062270 /nfs/dbraw/zinc/06/22/70/1047062270.db2.gz CGIUPJJFKQAFSV-MRXNPFEDSA-N 1 2 323.362 4.035 20 0 DIADLO Cc1cc(C[N@H+]2CCC(=O)C[C@H]2C)ccc1OCc1ccccc1 ZINC001141251043 1047064323 /nfs/dbraw/zinc/06/43/23/1047064323.db2.gz IVHUROYRRZUKIH-QGZVFWFLSA-N 1 2 323.436 4.127 20 0 DIADLO Cc1cc(C[N@@H+]2CCC(=O)C[C@H]2C)ccc1OCc1ccccc1 ZINC001141251043 1047064334 /nfs/dbraw/zinc/06/43/34/1047064334.db2.gz IVHUROYRRZUKIH-QGZVFWFLSA-N 1 2 323.436 4.127 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2nc3c(s2)CCCC3)ccc1F ZINC000536674245 1047065320 /nfs/dbraw/zinc/06/53/20/1047065320.db2.gz TVBCMOXXNNEUBP-UHFFFAOYSA-N 1 2 304.434 4.101 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2nc3c(s2)CCCC3)ccc1F ZINC000536674245 1047065327 /nfs/dbraw/zinc/06/53/27/1047065327.db2.gz TVBCMOXXNNEUBP-UHFFFAOYSA-N 1 2 304.434 4.101 20 0 DIADLO Clc1csc(C[N@@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)c1 ZINC000827495520 1047071246 /nfs/dbraw/zinc/07/12/46/1047071246.db2.gz XSTYRDXTTZXTQW-HNNXBMFYSA-N 1 2 323.845 4.348 20 0 DIADLO Clc1csc(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)c1 ZINC000827495520 1047071260 /nfs/dbraw/zinc/07/12/60/1047071260.db2.gz XSTYRDXTTZXTQW-HNNXBMFYSA-N 1 2 323.845 4.348 20 0 DIADLO CC[C@@H](CC(F)F)C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC000837362245 1047073841 /nfs/dbraw/zinc/07/38/41/1047073841.db2.gz IZYHLOBTSXZSOF-LBPRGKRZSA-N 1 2 321.371 4.313 20 0 DIADLO C[C@H](O)[C@H]1CCC[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC000681082747 1047091615 /nfs/dbraw/zinc/09/16/15/1047091615.db2.gz OQAFHGJDAVQRPH-UWVGGRQHSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H](O)[C@H]1CCC[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC000681082747 1047091629 /nfs/dbraw/zinc/09/16/29/1047091629.db2.gz OQAFHGJDAVQRPH-UWVGGRQHSA-N 1 2 322.663 4.240 20 0 DIADLO COc1cc(Cl)ncc1C[N@H+](C)Cc1cccc(Cl)c1 ZINC001141340897 1047099678 /nfs/dbraw/zinc/09/96/78/1047099678.db2.gz LRHVONFYZJFEMF-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cc(Cl)ncc1C[N@@H+](C)Cc1cccc(Cl)c1 ZINC001141340897 1047099691 /nfs/dbraw/zinc/09/96/91/1047099691.db2.gz LRHVONFYZJFEMF-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO CC(C)([NH2+]Cc1nc2c(s1)CCC2)c1cccc(Cl)c1F ZINC000681136068 1047101555 /nfs/dbraw/zinc/10/15/55/1047101555.db2.gz LVAHWXPLLRTMLW-UHFFFAOYSA-N 1 2 324.852 4.449 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](CO)c2c(F)cccc2F)cc(C)c1F ZINC000536869710 1047116601 /nfs/dbraw/zinc/11/66/01/1047116601.db2.gz MCRGNVDZTGRMLY-MLGOLLRUSA-N 1 2 323.358 4.105 20 0 DIADLO CC[NH+](CC)c1ccc(Nc2cc(-c3ccccn3)no2)cc1 ZINC001212969008 1047116753 /nfs/dbraw/zinc/11/67/53/1047116753.db2.gz GVKVWBVRMMUMQD-UHFFFAOYSA-N 1 2 308.385 4.326 20 0 DIADLO Cc1cccc(-c2nnc(SCc3ccc(C)[nH+]c3C)o2)c1 ZINC000681362724 1047117373 /nfs/dbraw/zinc/11/73/73/1047117373.db2.gz DHTZRBWTLXIJEM-UHFFFAOYSA-N 1 2 311.410 4.349 20 0 DIADLO Fc1cc2[nH+]ccc(N3CCC4(CCOC4)CC3)c2cc1Cl ZINC000649355421 1047121778 /nfs/dbraw/zinc/12/17/78/1047121778.db2.gz PLGBOKYIGXVBLF-UHFFFAOYSA-N 1 2 320.795 4.034 20 0 DIADLO CCc1nnc(C[NH+]2CCC(c3ccc(Cl)cc3)CC2)s1 ZINC000681472104 1047126462 /nfs/dbraw/zinc/12/64/62/1047126462.db2.gz MOLATKWGQNKBNM-UHFFFAOYSA-N 1 2 321.877 4.134 20 0 DIADLO COc1ccc(C2([NH2+]Cc3csc(C(C)C)n3)CC2)cc1 ZINC000537059257 1047133616 /nfs/dbraw/zinc/13/36/16/1047133616.db2.gz XYOXFNGRSIRRLG-UHFFFAOYSA-N 1 2 302.443 4.054 20 0 DIADLO CCCCc1nc(C[NH2+]C2(c3ccc(OC)cc3)CC2)cs1 ZINC000537058700 1047133857 /nfs/dbraw/zinc/13/38/57/1047133857.db2.gz RVDGFLNNKGRWFY-UHFFFAOYSA-N 1 2 316.470 4.273 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1nccn1C(C)C ZINC000537024807 1047133888 /nfs/dbraw/zinc/13/38/88/1047133888.db2.gz ZPTYYDMLDDXNAH-HNNXBMFYSA-N 1 2 301.434 4.102 20 0 DIADLO FC(F)C(F)(F)C[N@@H+]1CCC[C@H]1CCCc1ccccc1 ZINC001459768939 1047133990 /nfs/dbraw/zinc/13/39/90/1047133990.db2.gz QLNJZXWWBBWFEG-CQSZACIVSA-N 1 2 303.343 4.374 20 0 DIADLO FC(F)C(F)(F)C[N@H+]1CCC[C@H]1CCCc1ccccc1 ZINC001459768939 1047133995 /nfs/dbraw/zinc/13/39/95/1047133995.db2.gz QLNJZXWWBBWFEG-CQSZACIVSA-N 1 2 303.343 4.374 20 0 DIADLO CC1(C)CCC[N@@H+]1Cc1c(F)cc(Br)cc1F ZINC001141554624 1047182222 /nfs/dbraw/zinc/18/22/22/1047182222.db2.gz DMGHBRKZSHDNID-UHFFFAOYSA-N 1 2 304.178 4.102 20 0 DIADLO CC1(C)CCC[N@H+]1Cc1c(F)cc(Br)cc1F ZINC001141554624 1047182226 /nfs/dbraw/zinc/18/22/26/1047182226.db2.gz DMGHBRKZSHDNID-UHFFFAOYSA-N 1 2 304.178 4.102 20 0 DIADLO CC(=O)c1ccc(CNc2cc(C)c3ccccc3[nH+]2)nc1C ZINC001116493725 1047148054 /nfs/dbraw/zinc/14/80/54/1047148054.db2.gz WMVARYSCCNELDC-UHFFFAOYSA-N 1 2 305.381 4.061 20 0 DIADLO COc1c(C)c[nH+]c(CSC[C@H]2CC2(Cl)Cl)c1C ZINC001116493266 1047148399 /nfs/dbraw/zinc/14/83/99/1047148399.db2.gz MHAHWROIDQUVQY-SNVBAGLBSA-N 1 2 306.258 4.134 20 0 DIADLO Fc1nc(Cl)ccc1C[NH+]1CCC(c2cccs2)CC1 ZINC001137476685 1047152171 /nfs/dbraw/zinc/15/21/71/1047152171.db2.gz NVXRJCOHWKMLPC-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2noc(-c3ccccc3)n2)CCC1 ZINC000649645995 1047156964 /nfs/dbraw/zinc/15/69/64/1047156964.db2.gz PIGXFSHTPHSDGZ-UHFFFAOYSA-N 1 2 319.408 4.214 20 0 DIADLO CC(C)c1nnc(C[N@H+](C)[C@@H](C)CSc2ccccc2)s1 ZINC000649666224 1047161296 /nfs/dbraw/zinc/16/12/96/1047161296.db2.gz JWYKTQZMMMEQCU-ZDUSSCGKSA-N 1 2 321.515 4.274 20 0 DIADLO CC(C)c1nnc(C[N@@H+](C)[C@@H](C)CSc2ccccc2)s1 ZINC000649666224 1047161302 /nfs/dbraw/zinc/16/13/02/1047161302.db2.gz JWYKTQZMMMEQCU-ZDUSSCGKSA-N 1 2 321.515 4.274 20 0 DIADLO CC(C)c1nnc(C[N@H+](C)[C@H](C)CSc2ccccc2)s1 ZINC000649666223 1047161505 /nfs/dbraw/zinc/16/15/05/1047161505.db2.gz JWYKTQZMMMEQCU-CYBMUJFWSA-N 1 2 321.515 4.274 20 0 DIADLO CC(C)c1nnc(C[N@@H+](C)[C@H](C)CSc2ccccc2)s1 ZINC000649666223 1047161514 /nfs/dbraw/zinc/16/15/14/1047161514.db2.gz JWYKTQZMMMEQCU-CYBMUJFWSA-N 1 2 321.515 4.274 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC001141525881 1047162959 /nfs/dbraw/zinc/16/29/59/1047162959.db2.gz QSLUXTKFZMPYQD-YESZJQIVSA-N 1 2 323.440 4.417 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@@H+]([C@@H](C)c2ccc(F)c(F)c2)C1 ZINC000682038362 1047163845 /nfs/dbraw/zinc/16/38/45/1047163845.db2.gz CWUXTTLHGCXSLN-HZMBPMFUSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@H+]([C@@H](C)c2ccc(F)c(F)c2)C1 ZINC000682038362 1047163847 /nfs/dbraw/zinc/16/38/47/1047163847.db2.gz CWUXTTLHGCXSLN-HZMBPMFUSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@@H+]([C@@H](C)c2cc(F)ccc2F)C1 ZINC000682041822 1047164106 /nfs/dbraw/zinc/16/41/06/1047164106.db2.gz NDAYCEVXIRXKLQ-HZMBPMFUSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@H+]([C@@H](C)c2cc(F)ccc2F)C1 ZINC000682041822 1047164110 /nfs/dbraw/zinc/16/41/10/1047164110.db2.gz NDAYCEVXIRXKLQ-HZMBPMFUSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@@H+]([C@H](C)c2c(F)cccc2F)C1 ZINC000682038641 1047164456 /nfs/dbraw/zinc/16/44/56/1047164456.db2.gz DYUQCZIYXSRUTR-YGRLFVJLSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@H+]([C@H](C)c2c(F)cccc2F)C1 ZINC000682038641 1047164461 /nfs/dbraw/zinc/16/44/61/1047164461.db2.gz DYUQCZIYXSRUTR-YGRLFVJLSA-N 1 2 323.305 4.069 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2cccc(C(F)(F)F)c2)[nH]n1 ZINC001116648196 1047165543 /nfs/dbraw/zinc/16/55/43/1047165543.db2.gz JFGQHHNCLWJBJZ-INIZCTEOSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2cccc(C(F)(F)F)c2)[nH]n1 ZINC001116648196 1047165549 /nfs/dbraw/zinc/16/55/49/1047165549.db2.gz JFGQHHNCLWJBJZ-INIZCTEOSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1ccc(-c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)c(F)c1 ZINC000460144232 1047166751 /nfs/dbraw/zinc/16/67/51/1047166751.db2.gz UVSBRMFATKWRRL-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1ncc(-c2ccccc2C)o1 ZINC000649721575 1047167163 /nfs/dbraw/zinc/16/71/63/1047167163.db2.gz ZXIVFEGFXSNDHH-CVEARBPZSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1ncc(-c2ccccc2C)o1 ZINC000649721575 1047167168 /nfs/dbraw/zinc/16/71/68/1047167168.db2.gz ZXIVFEGFXSNDHH-CVEARBPZSA-N 1 2 314.429 4.039 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C3CC4(CCC4)C3)cc2)C[C@@H](C)O1 ZINC000838878488 1047168498 /nfs/dbraw/zinc/16/84/98/1047168498.db2.gz LLGWNNHGCGSPEC-HUUCEWRRSA-N 1 2 300.446 4.045 20 0 DIADLO COCc1ccc(SCc2c[nH+]cn2Cc2ccccc2)cc1 ZINC000682079419 1047170561 /nfs/dbraw/zinc/17/05/61/1047170561.db2.gz BUZKYAHFUQUGTK-UHFFFAOYSA-N 1 2 324.449 4.370 20 0 DIADLO C[N@@H+](CCC(F)(F)F)Cc1ccc(Cl)nc1C(F)(F)F ZINC001116723574 1047172122 /nfs/dbraw/zinc/17/21/22/1047172122.db2.gz DLTNCVZMDROKOC-UHFFFAOYSA-N 1 2 320.664 4.138 20 0 DIADLO C[N@H+](CCC(F)(F)F)Cc1ccc(Cl)nc1C(F)(F)F ZINC001116723574 1047172116 /nfs/dbraw/zinc/17/21/16/1047172116.db2.gz DLTNCVZMDROKOC-UHFFFAOYSA-N 1 2 320.664 4.138 20 0 DIADLO C[C@@H]1CC[C@@H](C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C1 ZINC000537344061 1047173409 /nfs/dbraw/zinc/17/34/09/1047173409.db2.gz FZCDRGCRTKVCLU-GDBMZVCRSA-N 1 2 323.440 4.261 20 0 DIADLO c1cn(-c2ccccc2CNc2nccc3sccc32)c[nH+]1 ZINC000682394097 1047189951 /nfs/dbraw/zinc/18/99/51/1047189951.db2.gz DGOPLMUQBMXWLH-UHFFFAOYSA-N 1 2 306.394 4.094 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cc2c(s1)CCC2 ZINC000537456678 1047194972 /nfs/dbraw/zinc/19/49/72/1047194972.db2.gz VXKKJSXCQACOPL-ZDUSSCGKSA-N 1 2 313.470 4.405 20 0 DIADLO F[C@@H]1C[N@H+](Cc2c[nH]c3cc(Cl)ccc23)CCC1(F)F ZINC001141579791 1047201984 /nfs/dbraw/zinc/20/19/84/1047201984.db2.gz NYOITEQUBNKELA-CYBMUJFWSA-N 1 2 302.727 4.000 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2c[nH]c3cc(Cl)ccc23)CCC1(F)F ZINC001141579791 1047201993 /nfs/dbraw/zinc/20/19/93/1047201993.db2.gz NYOITEQUBNKELA-CYBMUJFWSA-N 1 2 302.727 4.000 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1c[nH]c3cc(Cl)ccc13)C2 ZINC001141585718 1047205025 /nfs/dbraw/zinc/20/50/25/1047205025.db2.gz AUCVCHQXWBUFPJ-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1c[nH]c3cc(Cl)ccc13)C2 ZINC001141585718 1047205033 /nfs/dbraw/zinc/20/50/33/1047205033.db2.gz AUCVCHQXWBUFPJ-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO C[NH+](C)Cc1nnc(C2(c3cccc(Cl)c3)CCCCC2)o1 ZINC001117260072 1047223365 /nfs/dbraw/zinc/22/33/65/1047223365.db2.gz CYQAKAOOOIXALM-UHFFFAOYSA-N 1 2 319.836 4.035 20 0 DIADLO COCc1cc[nH+]c(NCc2cccc(OC3CCCC3)c2)c1 ZINC000650243981 1047225245 /nfs/dbraw/zinc/22/52/45/1047225245.db2.gz XTJIJQYSRCKPMD-UHFFFAOYSA-N 1 2 312.413 4.162 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc3cccnc3cc2F)no1 ZINC001141620577 1047230405 /nfs/dbraw/zinc/23/04/05/1047230405.db2.gz BFSDIJNOZMCOJU-GOSISDBHSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cc3cccnc3cc2F)no1 ZINC001141620577 1047230412 /nfs/dbraw/zinc/23/04/12/1047230412.db2.gz BFSDIJNOZMCOJU-GOSISDBHSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3cccc(C)c3F)c2)[nH+]c1C ZINC000760437311 1047235075 /nfs/dbraw/zinc/23/50/75/1047235075.db2.gz CXHOKNGDIYHOOS-UHFFFAOYSA-N 1 2 323.371 4.393 20 0 DIADLO Fc1cc2ncccc2cc1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC001141631030 1047238521 /nfs/dbraw/zinc/23/85/21/1047238521.db2.gz IKKHTECEPFFQGQ-MRXNPFEDSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1cc2ncccc2cc1C[N@H+]1CCC[C@@H]1c1nccs1 ZINC001141631030 1047238529 /nfs/dbraw/zinc/23/85/29/1047238529.db2.gz IKKHTECEPFFQGQ-MRXNPFEDSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1ccc2c(c1)CC[N@@H+](Cc1cc3cccnc3cc1F)C2 ZINC001141634864 1047240564 /nfs/dbraw/zinc/24/05/64/1047240564.db2.gz UTTZFNZLSLEZNA-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1ccc2c(c1)CC[N@H+](Cc1cc3cccnc3cc1F)C2 ZINC001141634864 1047240566 /nfs/dbraw/zinc/24/05/66/1047240566.db2.gz UTTZFNZLSLEZNA-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO C[N@H+](Cc1cc2ccccc2[nH]1)Cc1cccc(O)c1Cl ZINC001117760178 1047242041 /nfs/dbraw/zinc/24/20/41/1047242041.db2.gz QDROGGMOYCYUQV-UHFFFAOYSA-N 1 2 300.789 4.159 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2[nH]1)Cc1cccc(O)c1Cl ZINC001117760178 1047242046 /nfs/dbraw/zinc/24/20/46/1047242046.db2.gz QDROGGMOYCYUQV-UHFFFAOYSA-N 1 2 300.789 4.159 20 0 DIADLO CCCC(C)(C)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000650536604 1047248290 /nfs/dbraw/zinc/24/82/90/1047248290.db2.gz UYYVZVNYNDSUCS-UHFFFAOYSA-N 1 2 310.401 4.059 20 0 DIADLO C[N@H+](Cc1nc2ccccc2o1)Cc1ccc2cc(F)ccc2n1 ZINC001141650717 1047248168 /nfs/dbraw/zinc/24/81/68/1047248168.db2.gz FBBRXQLPWGLVSJ-UHFFFAOYSA-N 1 2 321.355 4.147 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2o1)Cc1ccc2cc(F)ccc2n1 ZINC001141650717 1047248174 /nfs/dbraw/zinc/24/81/74/1047248174.db2.gz FBBRXQLPWGLVSJ-UHFFFAOYSA-N 1 2 321.355 4.147 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)n1 ZINC001141765232 1047286667 /nfs/dbraw/zinc/28/66/67/1047286667.db2.gz NPFVZPLKRLXSAY-PHIMTYICSA-N 1 2 324.371 4.249 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)n1 ZINC001141765232 1047286682 /nfs/dbraw/zinc/28/66/82/1047286682.db2.gz NPFVZPLKRLXSAY-PHIMTYICSA-N 1 2 324.371 4.249 20 0 DIADLO C[C@@H](CC[NH2+]c1ccc(N2CCOCC2)cc1)c1ccccc1 ZINC000390269927 1047295356 /nfs/dbraw/zinc/29/53/56/1047295356.db2.gz JLRKXVFMQKZQIC-KRWDZBQOSA-N 1 2 310.441 4.129 20 0 DIADLO COc1ccc(OC)c([C@H](C)Nc2ccc([NH+](C)C)cc2C)c1 ZINC000390286489 1047295940 /nfs/dbraw/zinc/29/59/40/1047295940.db2.gz NMFPIMXJSPXPMO-AWEZNQCLSA-N 1 2 314.429 4.251 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2coc3ccc(F)cc23)no1 ZINC001141846526 1047298613 /nfs/dbraw/zinc/29/86/13/1047298613.db2.gz BHRRXASLFFMINT-INIZCTEOSA-N 1 2 300.333 4.205 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2coc3ccc(F)cc23)no1 ZINC001141846526 1047298625 /nfs/dbraw/zinc/29/86/25/1047298625.db2.gz BHRRXASLFFMINT-INIZCTEOSA-N 1 2 300.333 4.205 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1ncc(-c2ccccc2)n1C ZINC000651229814 1047304545 /nfs/dbraw/zinc/30/45/45/1047304545.db2.gz OQKAUDSGQCMPEL-JSGCOSHPSA-N 1 2 324.428 4.104 20 0 DIADLO C[C@@H](Nc1ccc([NH+]2CCCC2)cc1)c1ccc2c(c1)OCCO2 ZINC000392135030 1047305229 /nfs/dbraw/zinc/30/52/29/1047305229.db2.gz OEDLVZMCFOXBMW-OAHLLOKOSA-N 1 2 324.424 4.231 20 0 DIADLO Fc1ccc(F)c([C@@H]2CCC[N@@H+]2Cc2cccc3c2OCO3)c1 ZINC001141956419 1047317744 /nfs/dbraw/zinc/31/77/44/1047317744.db2.gz CBMZSRMVZUSNFP-INIZCTEOSA-N 1 2 317.335 4.031 20 0 DIADLO Fc1ccc(F)c([C@@H]2CCC[N@H+]2Cc2cccc3c2OCO3)c1 ZINC001141956419 1047317758 /nfs/dbraw/zinc/31/77/58/1047317758.db2.gz CBMZSRMVZUSNFP-INIZCTEOSA-N 1 2 317.335 4.031 20 0 DIADLO Fc1cccc(Cl)c1CC1C[NH+](Cc2cnc(C3CC3)o2)C1 ZINC001118945061 1047319181 /nfs/dbraw/zinc/31/91/81/1047319181.db2.gz YBNOJHDMDHODON-UHFFFAOYSA-N 1 2 320.795 4.019 20 0 DIADLO FC(F)(F)c1cnc(C[NH+]2CC3(C2)CCCC3)c(Cl)c1 ZINC001142538117 1047321265 /nfs/dbraw/zinc/32/12/65/1047321265.db2.gz CVHDYJVYQLWHPC-UHFFFAOYSA-N 1 2 304.743 4.130 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2ncc(C(F)(F)F)cc2Cl)C1 ZINC001142539355 1047321839 /nfs/dbraw/zinc/32/18/39/1047321839.db2.gz ZFBVBEFRFULCFX-ZDUSSCGKSA-N 1 2 324.749 4.468 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2ncc(C(F)(F)F)cc2Cl)C1 ZINC001142539355 1047321847 /nfs/dbraw/zinc/32/18/47/1047321847.db2.gz ZFBVBEFRFULCFX-ZDUSSCGKSA-N 1 2 324.749 4.468 20 0 DIADLO c1csc(-c2nc(C[NH+]3CC(Cc4ccoc4)C3)cs2)c1 ZINC000898160792 1047322737 /nfs/dbraw/zinc/32/27/37/1047322737.db2.gz UNCIKEICEGGNLX-UHFFFAOYSA-N 1 2 316.451 4.139 20 0 DIADLO CCCc1ccc([C@H](Nc2[nH+]cnc3c2cnn3C)C(C)C)cc1 ZINC000651960714 1047337164 /nfs/dbraw/zinc/33/71/64/1047337164.db2.gz SRPHFMZUHBMMHN-QGZVFWFLSA-N 1 2 323.444 4.125 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2ccc(SC)c(F)c2)c1 ZINC000652067772 1047341868 /nfs/dbraw/zinc/34/18/68/1047341868.db2.gz GURUEJQNZFPWGM-NSHDSACASA-N 1 2 306.406 4.262 20 0 DIADLO C[C@H]([NH2+][C@H]1CC(C)(C)Oc2ccc(F)cc21)c1cscn1 ZINC000652266703 1047350064 /nfs/dbraw/zinc/35/00/64/1047350064.db2.gz JNOOJFSJZUKWRE-GWCFXTLKSA-N 1 2 306.406 4.235 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H]2CC(C)(C)Oc3ccc(F)cc32)no1 ZINC000652267590 1047350993 /nfs/dbraw/zinc/35/09/93/1047350993.db2.gz XERZMXVETCNXMS-XHDPSFHLSA-N 1 2 304.365 4.075 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@@H](Cc2ccccc2)c2nccn2C)o1 ZINC000652274427 1047351793 /nfs/dbraw/zinc/35/17/93/1047351793.db2.gz NQDSCBPPPCTZMX-YJBOKZPZSA-N 1 2 323.440 4.210 20 0 DIADLO Clc1cnc(C[N@@H+]2CC[C@@H]2Cc2ccccc2)c(Cl)c1 ZINC000537516667 1047351838 /nfs/dbraw/zinc/35/18/38/1047351838.db2.gz CWEYVFVFTSSJNK-CQSZACIVSA-N 1 2 307.224 4.205 20 0 DIADLO Clc1cnc(C[N@H+]2CC[C@@H]2Cc2ccccc2)c(Cl)c1 ZINC000537516667 1047351854 /nfs/dbraw/zinc/35/18/54/1047351854.db2.gz CWEYVFVFTSSJNK-CQSZACIVSA-N 1 2 307.224 4.205 20 0 DIADLO Clc1cnc(C[N@@H+]2CCCc3ccccc3C2)c(Cl)c1 ZINC000537522757 1047353093 /nfs/dbraw/zinc/35/30/93/1047353093.db2.gz BFRNEOVECHOREP-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO Clc1cnc(C[N@H+]2CCCc3ccccc3C2)c(Cl)c1 ZINC000537522757 1047353104 /nfs/dbraw/zinc/35/31/04/1047353104.db2.gz BFRNEOVECHOREP-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO COc1ccc(C2([NH2+]Cc3ncc(Cl)cc3Cl)CC2)cc1 ZINC000537524616 1047354279 /nfs/dbraw/zinc/35/42/79/1047354279.db2.gz GQWSTBCYHQCLTQ-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO CC[C@@H](Nc1cc(COC)cc[nH+]1)c1cc(Cl)ccc1OC ZINC000652330241 1047354896 /nfs/dbraw/zinc/35/48/96/1047354896.db2.gz ADCNIRLPUMZYSU-OAHLLOKOSA-N 1 2 320.820 4.453 20 0 DIADLO COCc1cc[nH+]c(N[C@H](c2ccc(OC)cc2F)C(C)C)c1 ZINC000652331695 1047356989 /nfs/dbraw/zinc/35/69/89/1047356989.db2.gz PRVQLJILXXQYCK-SFHVURJKSA-N 1 2 318.392 4.185 20 0 DIADLO C[C@H](Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1cccc(F)c1F ZINC000537534628 1047358641 /nfs/dbraw/zinc/35/86/41/1047358641.db2.gz ZKKXTAVTBFWEBH-NSHDSACASA-N 1 2 317.314 4.463 20 0 DIADLO COc1ccc(Cl)cc1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000841037886 1047372935 /nfs/dbraw/zinc/37/29/35/1047372935.db2.gz ZEVJGCYXWFXZLH-UHFFFAOYSA-N 1 2 302.805 4.319 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[NH+]3CCC(F)(F)CC3)o2)cc1C ZINC000796543091 1047382977 /nfs/dbraw/zinc/38/29/77/1047382977.db2.gz PHVPDBSBFHDOAT-ZDUSSCGKSA-N 1 2 321.371 4.146 20 0 DIADLO Oc1cc(Cl)c(C[NH+]2CCC(C(F)F)CC2)c(Cl)c1 ZINC001142114871 1047382853 /nfs/dbraw/zinc/38/28/53/1047382853.db2.gz QVOWKMSVUJKHDA-UHFFFAOYSA-N 1 2 310.171 4.176 20 0 DIADLO FC1(F)CC[NH+](Cc2coc(-c3cccc(Cl)c3)n2)CC1 ZINC000796540312 1047384273 /nfs/dbraw/zinc/38/42/73/1047384273.db2.gz RXQKKNQBHFEAJE-UHFFFAOYSA-N 1 2 312.747 4.226 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc(C3CC3)cnc2Cl)c(C)[nH+]1 ZINC000796558499 1047387381 /nfs/dbraw/zinc/38/73/81/1047387381.db2.gz UEIKYIZXHIKKAO-UHFFFAOYSA-N 1 2 315.804 4.185 20 0 DIADLO Nc1ccc(Nc2[nH+]cccc2N2CCCCC2)cc1Cl ZINC001212111020 1047390296 /nfs/dbraw/zinc/39/02/96/1047390296.db2.gz UFKKRHIBCSXAFZ-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO Cc1cn2cc(NC(=O)/C=C/c3ccc(Cl)s3)ccc2[nH+]1 ZINC000726948685 1047394534 /nfs/dbraw/zinc/39/45/34/1047394534.db2.gz ZRZSNDIVHCDVGJ-QPJJXVBHSA-N 1 2 317.801 4.010 20 0 DIADLO CC(C)(O)Cc1ccc(-c2cc(F)cc(Cn3cc[nH+]c3)c2)cc1 ZINC000653511498 1047395150 /nfs/dbraw/zinc/39/51/50/1047395150.db2.gz IPGPKUHPQMERPJ-UHFFFAOYSA-N 1 2 324.399 4.051 20 0 DIADLO C[N@H+](Cc1nc2ccccc2[nH]1)Cc1ccc(C(F)(F)F)cc1 ZINC000726949640 1047395286 /nfs/dbraw/zinc/39/52/86/1047395286.db2.gz CCPVXMKMILQPHT-UHFFFAOYSA-N 1 2 319.330 4.214 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2[nH]1)Cc1ccc(C(F)(F)F)cc1 ZINC000726949640 1047395297 /nfs/dbraw/zinc/39/52/97/1047395297.db2.gz CCPVXMKMILQPHT-UHFFFAOYSA-N 1 2 319.330 4.214 20 0 DIADLO CCCC[N@H+](Cc1cc(C(C)=O)no1)[C@@H](C)c1ccc(C)o1 ZINC000653522934 1047396164 /nfs/dbraw/zinc/39/61/64/1047396164.db2.gz XBGWWVOIXBRAHC-ZDUSSCGKSA-N 1 2 304.390 4.142 20 0 DIADLO CCCC[N@@H+](Cc1cc(C(C)=O)no1)[C@@H](C)c1ccc(C)o1 ZINC000653522934 1047396172 /nfs/dbraw/zinc/39/61/72/1047396172.db2.gz XBGWWVOIXBRAHC-ZDUSSCGKSA-N 1 2 304.390 4.142 20 0 DIADLO COC[C@@H]([NH2+]Cc1cc(C(C)C)ccc1OC)c1ccc(C)o1 ZINC000653613564 1047407884 /nfs/dbraw/zinc/40/78/84/1047407884.db2.gz RHVJGKPAXOEBQM-QGZVFWFLSA-N 1 2 317.429 4.197 20 0 DIADLO COc1ccc(C(C)C)cc1C[NH2+][C@H](C)c1ncc(C)s1 ZINC000653616283 1047408612 /nfs/dbraw/zinc/40/86/12/1047408612.db2.gz OPQMMTZMXDPHEO-CYBMUJFWSA-N 1 2 304.459 4.434 20 0 DIADLO CCCCC1CC[NH+](Cc2cnc(SC)nc2Cl)CC1 ZINC001142411718 1047440869 /nfs/dbraw/zinc/44/08/69/1047440869.db2.gz BTCKIWRMUUJASG-UHFFFAOYSA-N 1 2 313.898 4.254 20 0 DIADLO C/C(=C\C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1)c1ccco1 ZINC001142247277 1047415418 /nfs/dbraw/zinc/41/54/18/1047415418.db2.gz RYWCPLFLPKIDKC-ZRDIBKRKSA-N 1 2 321.380 4.329 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@@H+](Cc1ccnc(Cl)c1)C2 ZINC000749463640 1047420968 /nfs/dbraw/zinc/42/09/68/1047420968.db2.gz OVSDAEJTCRRVBT-UHFFFAOYSA-N 1 2 316.832 4.082 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@H+](Cc1ccnc(Cl)c1)C2 ZINC000749463640 1047420970 /nfs/dbraw/zinc/42/09/70/1047420970.db2.gz OVSDAEJTCRRVBT-UHFFFAOYSA-N 1 2 316.832 4.082 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)c(Cl)c1 ZINC001142276672 1047421319 /nfs/dbraw/zinc/42/13/19/1047421319.db2.gz CAWVGVGRIFTZEA-VIFPVBQESA-N 1 2 324.198 4.479 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CCC(F)(F)[C@@H](C)C2)c(Cl)c1 ZINC001142276672 1047421325 /nfs/dbraw/zinc/42/13/25/1047421325.db2.gz CAWVGVGRIFTZEA-VIFPVBQESA-N 1 2 324.198 4.479 20 0 DIADLO Cc1ccc(-c2ccc(C[N@@H+](C)Cc3ncccn3)cc2)cc1 ZINC001142300136 1047426079 /nfs/dbraw/zinc/42/60/79/1047426079.db2.gz GGHPXKPDSNMDHI-UHFFFAOYSA-N 1 2 303.409 4.084 20 0 DIADLO Cc1ccc(-c2ccc(C[N@H+](C)Cc3ncccn3)cc2)cc1 ZINC001142300136 1047426086 /nfs/dbraw/zinc/42/60/86/1047426086.db2.gz GGHPXKPDSNMDHI-UHFFFAOYSA-N 1 2 303.409 4.084 20 0 DIADLO CCCc1ccc(C[NH+]2Cc3cc(OC)c(OC)cc3C2)cc1 ZINC001142372284 1047438070 /nfs/dbraw/zinc/43/80/70/1047438070.db2.gz YJUXOZVIFQKEKL-UHFFFAOYSA-N 1 2 311.425 4.172 20 0 DIADLO Cc1cccc(C)c1NC(=O)C[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000119163373 1047444475 /nfs/dbraw/zinc/44/44/75/1047444475.db2.gz YAQAAKDFPJCOSC-HNNXBMFYSA-N 1 2 312.413 4.061 20 0 DIADLO Cc1cccc(C)c1NC(=O)C[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000119163373 1047444488 /nfs/dbraw/zinc/44/44/88/1047444488.db2.gz YAQAAKDFPJCOSC-HNNXBMFYSA-N 1 2 312.413 4.061 20 0 DIADLO Cc1c2cccc(C)c2oc1C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC000749983257 1047451862 /nfs/dbraw/zinc/45/18/62/1047451862.db2.gz IWVQWPQRMCZXSG-UHFFFAOYSA-N 1 2 323.396 4.071 20 0 DIADLO Clc1nccc(C[N@@H+]2CCSC[C@@H]2C2CCC2)c1Cl ZINC000841893111 1047461355 /nfs/dbraw/zinc/46/13/55/1047461355.db2.gz FMRZLCUEDORPSV-GFCCVEGCSA-N 1 2 317.285 4.106 20 0 DIADLO Clc1nccc(C[N@H+]2CCSC[C@@H]2C2CCC2)c1Cl ZINC000841893111 1047461363 /nfs/dbraw/zinc/46/13/63/1047461363.db2.gz FMRZLCUEDORPSV-GFCCVEGCSA-N 1 2 317.285 4.106 20 0 DIADLO CCC1(CNc2ccc3[nH]c(-c4ccccc4)[nH+]c3c2)COC1 ZINC001168330995 1047471216 /nfs/dbraw/zinc/47/12/16/1047471216.db2.gz SOLCEOKPSPAIGR-UHFFFAOYSA-N 1 2 307.397 4.068 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(-c2ccccc2)cs1)c1cnccn1 ZINC000089553650 1047484040 /nfs/dbraw/zinc/48/40/40/1047484040.db2.gz MQJGVRKMCMBMQL-OLZOCXBDSA-N 1 2 310.426 4.012 20 0 DIADLO Clc1ccc(OCCSCCn2cc[nH+]c2)c(Cl)c1 ZINC000090199324 1047499326 /nfs/dbraw/zinc/49/93/26/1047499326.db2.gz UGYGOEZEMRMVFC-UHFFFAOYSA-N 1 2 317.241 4.002 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccccn2)s1 ZINC000090399677 1047502155 /nfs/dbraw/zinc/50/21/55/1047502155.db2.gz YZJFFSVCBOMSOT-ACJLOTCBSA-N 1 2 309.438 4.287 20 0 DIADLO Cc1ncc([C@H](C)[NH2+][C@@H](c2ccccc2)c2ccccn2)s1 ZINC000090399678 1047502747 /nfs/dbraw/zinc/50/27/47/1047502747.db2.gz YZJFFSVCBOMSOT-UGSOOPFHSA-N 1 2 309.438 4.287 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@@H](C)c2ccccn2)c2ccccn2)c1 ZINC000090946165 1047514071 /nfs/dbraw/zinc/51/40/71/1047514071.db2.gz WNVHKVCPSAJYTM-OXJNMPFZSA-N 1 2 303.409 4.225 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1occc1Br ZINC001143116955 1047533806 /nfs/dbraw/zinc/53/38/06/1047533806.db2.gz YMXIAAPULQOULC-LLVKDONJSA-N 1 2 306.203 4.161 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1occc1Br ZINC001143116955 1047533811 /nfs/dbraw/zinc/53/38/11/1047533811.db2.gz YMXIAAPULQOULC-LLVKDONJSA-N 1 2 306.203 4.161 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1occc1Br ZINC001143116956 1047534099 /nfs/dbraw/zinc/53/40/99/1047534099.db2.gz YMXIAAPULQOULC-NSHDSACASA-N 1 2 306.203 4.161 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1occc1Br ZINC001143116956 1047534104 /nfs/dbraw/zinc/53/41/04/1047534104.db2.gz YMXIAAPULQOULC-NSHDSACASA-N 1 2 306.203 4.161 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1c(OC)cc(C)cc1OC ZINC001143144078 1047535243 /nfs/dbraw/zinc/53/52/43/1047535243.db2.gz FRYPTHPYXYFPKJ-UHFFFAOYSA-N 1 2 317.404 4.173 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1c(OC)cc(C)cc1OC ZINC001143144078 1047535245 /nfs/dbraw/zinc/53/52/45/1047535245.db2.gz FRYPTHPYXYFPKJ-UHFFFAOYSA-N 1 2 317.404 4.173 20 0 DIADLO Cc1c[nH+]c(CCSC[C@@H]2OCCc3ccccc32)c(C)c1 ZINC000843301494 1047539806 /nfs/dbraw/zinc/53/98/06/1047539806.db2.gz BCEQBZNFEVWEDZ-IBGZPJMESA-N 1 2 313.466 4.288 20 0 DIADLO COc1cccc(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)c1OC ZINC000122300099 1047544931 /nfs/dbraw/zinc/54/49/31/1047544931.db2.gz VMSJWUQBESPBKB-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1cccc(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)c1OC ZINC000122300099 1047544936 /nfs/dbraw/zinc/54/49/36/1047544936.db2.gz VMSJWUQBESPBKB-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO Fc1cc(C[NH+]2Cc3ccccc3C2)cc(OC(F)(F)F)c1 ZINC001143256078 1047545041 /nfs/dbraw/zinc/54/50/41/1047545041.db2.gz CTSATZKRWICRFL-UHFFFAOYSA-N 1 2 311.278 4.240 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccccc2)cs1)Cc1ccccn1 ZINC000093338788 1047545255 /nfs/dbraw/zinc/54/52/55/1047545255.db2.gz IIGMQLQRXOIIDB-UHFFFAOYSA-N 1 2 309.438 4.227 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccccc2)cs1)Cc1ccccn1 ZINC000093338788 1047545260 /nfs/dbraw/zinc/54/52/60/1047545260.db2.gz IIGMQLQRXOIIDB-UHFFFAOYSA-N 1 2 309.438 4.227 20 0 DIADLO COc1cccc(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)c1OC ZINC000122299869 1047545414 /nfs/dbraw/zinc/54/54/14/1047545414.db2.gz VMSJWUQBESPBKB-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1cccc(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)c1OC ZINC000122299869 1047545415 /nfs/dbraw/zinc/54/54/15/1047545415.db2.gz VMSJWUQBESPBKB-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO CCOc1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c(F)c1F ZINC001143278367 1047547337 /nfs/dbraw/zinc/54/73/37/1047547337.db2.gz GFDVWUGUPMQXHL-OAHLLOKOSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)c(F)c1F ZINC001143278367 1047547348 /nfs/dbraw/zinc/54/73/48/1047547348.db2.gz GFDVWUGUPMQXHL-OAHLLOKOSA-N 1 2 303.352 4.311 20 0 DIADLO FC(F)(F)c1cccc(Cl)c1C[N@@H+]1CCC[C@]2(CCO2)C1 ZINC001143288867 1047550355 /nfs/dbraw/zinc/55/03/55/1047550355.db2.gz ZWUDDLQNDQDJEX-AWEZNQCLSA-N 1 2 319.754 4.114 20 0 DIADLO FC(F)(F)c1cccc(Cl)c1C[N@H+]1CCC[C@]2(CCO2)C1 ZINC001143288867 1047550359 /nfs/dbraw/zinc/55/03/59/1047550359.db2.gz ZWUDDLQNDQDJEX-AWEZNQCLSA-N 1 2 319.754 4.114 20 0 DIADLO C1=CCC2(C[N@@H+](Cc3coc(C4CC4)n3)[C@@H]2c2ccccc2)C1 ZINC000843435175 1047551540 /nfs/dbraw/zinc/55/15/40/1047551540.db2.gz KFJVMEGXGHSMOY-GOSISDBHSA-N 1 2 306.409 4.445 20 0 DIADLO C1=CCC2(C[N@H+](Cc3coc(C4CC4)n3)[C@@H]2c2ccccc2)C1 ZINC000843435175 1047551542 /nfs/dbraw/zinc/55/15/42/1047551542.db2.gz KFJVMEGXGHSMOY-GOSISDBHSA-N 1 2 306.409 4.445 20 0 DIADLO COc1c(F)ccc(C[N@@H+]2CCc3ccccc3[C@H]2C)c1F ZINC001143320547 1047552744 /nfs/dbraw/zinc/55/27/44/1047552744.db2.gz KKMFEEFYTQZCKR-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(F)ccc(C[N@H+]2CCc3ccccc3[C@H]2C)c1F ZINC001143320547 1047552749 /nfs/dbraw/zinc/55/27/49/1047552749.db2.gz KKMFEEFYTQZCKR-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(F)ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c1F ZINC001143321189 1047553509 /nfs/dbraw/zinc/55/35/09/1047553509.db2.gz WRTQILQHAIOICI-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c1F ZINC001143321189 1047553519 /nfs/dbraw/zinc/55/35/19/1047553519.db2.gz WRTQILQHAIOICI-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(C[N@@H+]2CCC[C@@H]2c2ccc(C)nc2)c1F ZINC001143329024 1047554052 /nfs/dbraw/zinc/55/40/52/1047554052.db2.gz HQVZLUMOGNPVBS-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO COc1c(F)ccc(C[N@H+]2CCC[C@@H]2c2ccc(C)nc2)c1F ZINC001143329024 1047554060 /nfs/dbraw/zinc/55/40/60/1047554060.db2.gz HQVZLUMOGNPVBS-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO CCC(CC)CCCN(C)C(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001149125967 1047555409 /nfs/dbraw/zinc/55/54/09/1047555409.db2.gz LJLSUSZZKAEJFV-KRWDZBQOSA-N 1 2 307.482 4.145 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncc(C)s1)c1cc(Cl)ccc1OC ZINC000122879676 1047556399 /nfs/dbraw/zinc/55/63/99/1047556399.db2.gz BJWPGJHZOAXFFQ-CYBMUJFWSA-N 1 2 310.850 4.354 20 0 DIADLO Cc1[nH]ncc1C[N@@H+]1CC[C@@H](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000537654477 1047569012 /nfs/dbraw/zinc/56/90/12/1047569012.db2.gz AOINWNHZMSMLEK-BDJLRTHQSA-N 1 2 323.362 4.320 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@H](Cc3ccccc3)C(C)C)cc2[nH+]1 ZINC001150106954 1047574133 /nfs/dbraw/zinc/57/41/33/1047574133.db2.gz VAQCRKKVUDIIGU-QGZVFWFLSA-N 1 2 321.424 4.325 20 0 DIADLO Cc1c[nH+]c2c(c1)N(C(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1)CCN2 ZINC001150485958 1047577664 /nfs/dbraw/zinc/57/76/64/1047577664.db2.gz MIXUMNYZTIEDMD-HIFRSBDPSA-N 1 2 315.461 4.001 20 0 DIADLO Cc1cc2cc(C(=O)Nc3ccc(-n4cc[nH+]c4)cc3)ccc2o1 ZINC001150738597 1047582365 /nfs/dbraw/zinc/58/23/65/1047582365.db2.gz QVRLMUSQNDJDII-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO CC(C)(C)O[C@H]1C[C@H](Nc2c[nH+]cc3c2CCCC3)C1(C)C ZINC001206636603 1047587802 /nfs/dbraw/zinc/58/78/02/1047587802.db2.gz PWQGMROATHDZNV-IRXDYDNUSA-N 1 2 302.462 4.355 20 0 DIADLO CC(C)(C)O[C@@H]1C[C@H](Nc2c[nH+]cc3c2CCCC3)C1(C)C ZINC001206636601 1047587966 /nfs/dbraw/zinc/58/79/66/1047587966.db2.gz PWQGMROATHDZNV-DLBZAZTESA-N 1 2 302.462 4.355 20 0 DIADLO Cc1sccc1NC(=O)[C@H]1CC[C@@H](Nc2cccc[nH+]2)CC1 ZINC001151424725 1047595344 /nfs/dbraw/zinc/59/53/44/1047595344.db2.gz GTUAXVONTGOQKW-OKILXGFUSA-N 1 2 315.442 4.061 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ccn(C3CCCC3)n2)C2CC2)cc1 ZINC000477160244 1047599618 /nfs/dbraw/zinc/59/96/18/1047599618.db2.gz FVJVSRVTOGTQQT-UHFFFAOYSA-N 1 2 313.420 4.302 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ccn(C3CCCC3)n2)C2CC2)cc1 ZINC000477160244 1047599622 /nfs/dbraw/zinc/59/96/22/1047599622.db2.gz FVJVSRVTOGTQQT-UHFFFAOYSA-N 1 2 313.420 4.302 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ccn(C3CCCC3)n2)cc1 ZINC000477173813 1047603003 /nfs/dbraw/zinc/60/30/03/1047603003.db2.gz ZCYSZPROFDTGOK-UHFFFAOYSA-N 1 2 313.445 4.029 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ccn(C3CCCC3)n2)cc1 ZINC000477173813 1047603006 /nfs/dbraw/zinc/60/30/06/1047603006.db2.gz ZCYSZPROFDTGOK-UHFFFAOYSA-N 1 2 313.445 4.029 20 0 DIADLO CCCCN(Cc1ccccc1)C(=O)c1c[nH]c2cc[nH+]cc21 ZINC001152976192 1047617922 /nfs/dbraw/zinc/61/79/22/1047617922.db2.gz FBHYQAFGKBBVCI-UHFFFAOYSA-N 1 2 307.397 4.005 20 0 DIADLO Cc1ccc(Nc2cc(Br)cc(F)c2O)c(C)[nH+]1 ZINC001203376514 1047618943 /nfs/dbraw/zinc/61/89/43/1047618943.db2.gz NCKYXTNYZVVHQK-UHFFFAOYSA-N 1 2 311.154 4.049 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H](C)C3CCCC3)cc2)[nH+]c1C ZINC001153554332 1047627654 /nfs/dbraw/zinc/62/76/54/1047627654.db2.gz BPGZJBLBWCOWLX-GFCCVEGCSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3C[C@@H]4C[C@@H]4C[C@@H]3C)cc2)[nH+]c1C ZINC001153554969 1047627802 /nfs/dbraw/zinc/62/78/02/1047627802.db2.gz HXPYFWSHATWIIS-TWUUUVDRSA-N 1 2 323.440 4.314 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+]2CCC[C@H](Oc3ccccc3Cl)C2)o1 ZINC000537850779 1047640189 /nfs/dbraw/zinc/64/01/89/1047640189.db2.gz CCKJAMHPNBLLAM-KBPBESRZSA-N 1 2 320.820 4.241 20 0 DIADLO Cc1cnc([C@H](C)[N@H+]2CCC[C@H](Oc3ccccc3Cl)C2)o1 ZINC000537850779 1047640191 /nfs/dbraw/zinc/64/01/91/1047640191.db2.gz CCKJAMHPNBLLAM-KBPBESRZSA-N 1 2 320.820 4.241 20 0 DIADLO O=C(Nc1cccc(-c2cccs2)c1)c1cccc2[nH+]ccn21 ZINC001154524627 1047650446 /nfs/dbraw/zinc/65/04/46/1047650446.db2.gz ZDLUJIYXGLWUOX-UHFFFAOYSA-N 1 2 319.389 4.315 20 0 DIADLO COc1ccc2[nH+]c(NCc3nc4ccccc4o3)c(C)cc2c1 ZINC001154647547 1047653671 /nfs/dbraw/zinc/65/36/71/1047653671.db2.gz XYBLKTZVPXOSMB-UHFFFAOYSA-N 1 2 319.364 4.305 20 0 DIADLO CC[C@H]([NH2+]Cc1ncccc1C(F)(F)F)c1nc(C)cs1 ZINC000152562735 1047656543 /nfs/dbraw/zinc/65/65/43/1047656543.db2.gz AOMLQGKMDOMSLO-NSHDSACASA-N 1 2 315.364 4.106 20 0 DIADLO Cc1cc(NC(=O)N(CC(C)(C)C)CC(C)(C)C)c(C)c[nH+]1 ZINC000538156869 1047660598 /nfs/dbraw/zinc/66/05/98/1047660598.db2.gz VFHVBUWIOKPXKH-UHFFFAOYSA-N 1 2 305.466 4.046 20 0 DIADLO FC(F)(F)c1ccncc1CNc1cc2ccccc2c[nH+]1 ZINC001154899919 1047661307 /nfs/dbraw/zinc/66/13/07/1047661307.db2.gz MCYYVLMTQOPDED-UHFFFAOYSA-N 1 2 303.287 4.261 20 0 DIADLO C[C@H]([NH2+][C@@H](c1cccs1)c1ccc(F)cc1)c1nccn1C ZINC000538210955 1047663756 /nfs/dbraw/zinc/66/37/56/1047663756.db2.gz OVLNNYRDUSRIGW-BLLLJJGKSA-N 1 2 315.417 4.061 20 0 DIADLO COc1ccc2[nH+]c(NC[C@H]3CCC(F)(F)C3)c(C)cc2c1 ZINC001155166419 1047669527 /nfs/dbraw/zinc/66/95/27/1047669527.db2.gz LIDKNRZHNDUQKY-LBPRGKRZSA-N 1 2 306.356 4.399 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)/C(F)=C\C2CCCCC2)[nH+]c1C ZINC001155183205 1047671029 /nfs/dbraw/zinc/67/10/29/1047671029.db2.gz CHMVHRQBSPAGAZ-RBFDBLARSA-N 1 2 319.424 4.124 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1cnc(Cl)nc1Oc1ccccc1 ZINC001155181631 1047671089 /nfs/dbraw/zinc/67/10/89/1047671089.db2.gz NJBGCSIVADEBGA-UHFFFAOYSA-N 1 2 304.781 4.358 20 0 DIADLO CCSc1cc[nH+]c(NCc2ccc(C(F)(F)F)n2C)c1 ZINC001155247595 1047673553 /nfs/dbraw/zinc/67/35/53/1047673553.db2.gz BYFSCFAYJDPRBY-UHFFFAOYSA-N 1 2 315.364 4.163 20 0 DIADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1cccc(Nc2cccc(C)c2)c1C ZINC001155398558 1047678705 /nfs/dbraw/zinc/67/87/05/1047678705.db2.gz FQOQQPBRQWKLJY-LJQANCHMSA-N 1 2 323.440 4.080 20 0 DIADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1cccc(Nc2cccc(C)c2)c1C ZINC001155398558 1047678711 /nfs/dbraw/zinc/67/87/11/1047678711.db2.gz FQOQQPBRQWKLJY-LJQANCHMSA-N 1 2 323.440 4.080 20 0 DIADLO CC(C)c1ccc(N2CCC(CC(=O)OC(C)(C)C)CC2)[nH+]c1 ZINC001155494981 1047682485 /nfs/dbraw/zinc/68/24/85/1047682485.db2.gz DJXGMRZNFZNDAX-UHFFFAOYSA-N 1 2 318.461 4.153 20 0 DIADLO C[C@H]1CN(c2ccc(Cl)c(N)[nH+]2)CCc2ccc(Cl)cc21 ZINC001155471543 1047682748 /nfs/dbraw/zinc/68/27/48/1047682748.db2.gz XTFMNSULLVOORJ-JTQLQIEISA-N 1 2 322.239 4.137 20 0 DIADLO COc1ccccc1[C@@H](C)Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000538526624 1047685320 /nfs/dbraw/zinc/68/53/20/1047685320.db2.gz QPAGKWKUGCLWBI-OAHLLOKOSA-N 1 2 311.429 4.254 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC(C)(C)CC(F)(F)F)c(C)[nH+]1 ZINC000667117849 1047692938 /nfs/dbraw/zinc/69/29/38/1047692938.db2.gz FBICUDCVBKJQAL-UHFFFAOYSA-N 1 2 317.355 4.107 20 0 DIADLO Cc1nc(Cl)cc(NC(=[NH2+])C23CC4CC(CC(C4)C2)C3)n1 ZINC001155955669 1047692998 /nfs/dbraw/zinc/69/29/98/1047692998.db2.gz BCBFLDXPASEXPL-UHFFFAOYSA-N 1 2 304.825 4.044 20 0 DIADLO CSc1cccnc1NC(=[NH2+])C12CC3CC(CC(C3)C1)C2 ZINC001155960727 1047693656 /nfs/dbraw/zinc/69/36/56/1047693656.db2.gz ZFQHAHLOJVCWQS-UHFFFAOYSA-N 1 2 301.459 4.409 20 0 DIADLO CN(CCC(=O)c1cccs1)c1ccc(C(C)(C)C)c[nH+]1 ZINC001155963473 1047693694 /nfs/dbraw/zinc/69/36/94/1047693694.db2.gz GDXKJMLFWRPDGG-UHFFFAOYSA-N 1 2 302.443 4.150 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CC[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC000667119186 1047695648 /nfs/dbraw/zinc/69/56/48/1047695648.db2.gz LDZTUWONKVKPNN-IAGOWNOFSA-N 1 2 309.413 4.075 20 0 DIADLO CSCc1ccc(NCCCOc2ccccc2C)[nH+]c1 ZINC001156038254 1047697480 /nfs/dbraw/zinc/69/74/80/1047697480.db2.gz IGUMZVWXXLAWOR-UHFFFAOYSA-N 1 2 302.443 4.134 20 0 DIADLO OC12C[C@@H]3C[C@H](C1)CC(Nc1cc(-c4ccccc4)cc[nH+]1)(C3)C2 ZINC001156112726 1047701264 /nfs/dbraw/zinc/70/12/64/1047701264.db2.gz JYGVEDLXUBHJLK-XBLGPDGASA-N 1 2 320.436 4.244 20 0 DIADLO COc1ccccc1/C=C\C[N@@H+]1CCO[C@@H](c2ccccc2C)C1 ZINC000538729122 1047701575 /nfs/dbraw/zinc/70/15/75/1047701575.db2.gz RVBZLCFPYUGICP-PWYGHMFVSA-N 1 2 323.436 4.090 20 0 DIADLO COc1ccccc1/C=C\C[N@H+]1CCO[C@@H](c2ccccc2C)C1 ZINC000538729122 1047701580 /nfs/dbraw/zinc/70/15/80/1047701580.db2.gz RVBZLCFPYUGICP-PWYGHMFVSA-N 1 2 323.436 4.090 20 0 DIADLO CC(C)C[C@@H]1COCC[N@@H+]1Cc1cnc(-c2cccs2)s1 ZINC000538734635 1047703244 /nfs/dbraw/zinc/70/32/44/1047703244.db2.gz SPYVETCPBIBWIS-CYBMUJFWSA-N 1 2 322.499 4.119 20 0 DIADLO CC(C)C[C@@H]1COCC[N@H+]1Cc1cnc(-c2cccs2)s1 ZINC000538734635 1047703247 /nfs/dbraw/zinc/70/32/47/1047703247.db2.gz SPYVETCPBIBWIS-CYBMUJFWSA-N 1 2 322.499 4.119 20 0 DIADLO Cc1ccc(OCc2nc(C[N@@H+]3CCC3(C)C)cs2)cc1 ZINC000538735907 1047705151 /nfs/dbraw/zinc/70/51/51/1047705151.db2.gz LUOTULQWFJBDMV-UHFFFAOYSA-N 1 2 302.443 4.015 20 0 DIADLO Cc1ccc(OCc2nc(C[N@H+]3CCC3(C)C)cs2)cc1 ZINC000538735907 1047705161 /nfs/dbraw/zinc/70/51/61/1047705161.db2.gz LUOTULQWFJBDMV-UHFFFAOYSA-N 1 2 302.443 4.015 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)cc1 ZINC000538752832 1047709053 /nfs/dbraw/zinc/70/90/53/1047709053.db2.gz PBFXWOOLZOUQGB-SUMWQHHRSA-N 1 2 319.495 4.432 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)cc1 ZINC000538752832 1047709057 /nfs/dbraw/zinc/70/90/57/1047709057.db2.gz PBFXWOOLZOUQGB-SUMWQHHRSA-N 1 2 319.495 4.432 20 0 DIADLO C[C@@H]1C[N@H+](C/C=C/c2ccc(F)cc2)C[C@@H](c2ccsc2)O1 ZINC000538750903 1047709363 /nfs/dbraw/zinc/70/93/63/1047709363.db2.gz GAECQPFUWKRNMM-RNYZBBNUSA-N 1 2 317.429 4.362 20 0 DIADLO C[C@@H]1C[N@@H+](C/C=C/c2ccc(F)cc2)C[C@@H](c2ccsc2)O1 ZINC000538750903 1047709367 /nfs/dbraw/zinc/70/93/67/1047709367.db2.gz GAECQPFUWKRNMM-RNYZBBNUSA-N 1 2 317.429 4.362 20 0 DIADLO CSCc1cc[nH+]c(N(C)C(C)(C)Cc2ccccc2)c1 ZINC001156515235 1047715457 /nfs/dbraw/zinc/71/54/57/1047715457.db2.gz BVPVPZHQLMSNSU-UHFFFAOYSA-N 1 2 300.471 4.402 20 0 DIADLO COC(=O)/C=C/c1cc(C)c[nH+]c1NCc1ccccc1C1CC1 ZINC001156542050 1047716978 /nfs/dbraw/zinc/71/69/78/1047716978.db2.gz NGDISYDADDNNBC-MDZDMXLPSA-N 1 2 322.408 4.066 20 0 DIADLO CN(Cc1ccc(-n2ccnc2)cc1)c1[nH+]ccc2ccccc21 ZINC001156775220 1047721990 /nfs/dbraw/zinc/72/19/90/1047721990.db2.gz DPOYJZMCOCBJCU-UHFFFAOYSA-N 1 2 314.392 4.057 20 0 DIADLO Cc1cc(Cl)c(C)c(NC2CC(C)(C)N(O)C(C)(C)C2)[nH+]1 ZINC001156888699 1047726622 /nfs/dbraw/zinc/72/66/22/1047726622.db2.gz OGELUDYZZLTMQH-UHFFFAOYSA-N 1 2 311.857 4.175 20 0 DIADLO Cc1cc(NC2CC(C)(C)N(O)C(C)(C)C2)[nH+]c2ccccc12 ZINC001156887344 1047726872 /nfs/dbraw/zinc/72/68/72/1047726872.db2.gz SIXPLDSZTNNWPK-UHFFFAOYSA-N 1 2 313.445 4.366 20 0 DIADLO Cc1nc(NC2(c3ccccn3)CC2)cc(C2CCCCC2)[nH+]1 ZINC001157374090 1047742264 /nfs/dbraw/zinc/74/22/64/1047742264.db2.gz NQAYXERYUXIKKP-UHFFFAOYSA-N 1 2 308.429 4.329 20 0 DIADLO Cc1ccnc(C[NH2+][C@@H](C)c2ccccc2Oc2ccccc2)n1 ZINC000539257133 1047743810 /nfs/dbraw/zinc/74/38/10/1047743810.db2.gz OMSLRFQAVANOBM-INIZCTEOSA-N 1 2 319.408 4.428 20 0 DIADLO CCc1cnc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)o1 ZINC000539357511 1047748445 /nfs/dbraw/zinc/74/84/45/1047748445.db2.gz LCYIFHCICMYOCP-UHFFFAOYSA-N 1 2 324.346 4.425 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+][C@H](C)c1cn(C(C)C)nn1 ZINC000924692739 1047749412 /nfs/dbraw/zinc/74/94/12/1047749412.db2.gz RJFUHIPFKLDDAI-LSDHHAIUSA-N 1 2 316.449 4.058 20 0 DIADLO CSc1nc(NCc2ccc(F)c(Cl)c2F)cc(C)[nH+]1 ZINC001157708830 1047750112 /nfs/dbraw/zinc/75/01/12/1047750112.db2.gz CIJKOZQCVVMJOY-UHFFFAOYSA-N 1 2 315.776 4.051 20 0 DIADLO Cc1cc(NCc2ccc(F)c(Cl)c2F)nc(C2CC2)[nH+]1 ZINC001157710597 1047750534 /nfs/dbraw/zinc/75/05/34/1047750534.db2.gz GNIRBQPBMMCCJR-UHFFFAOYSA-N 1 2 309.747 4.206 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)N(C)c1cc2[nH]ccc2c[nH+]1 ZINC001157755714 1047752328 /nfs/dbraw/zinc/75/23/28/1047752328.db2.gz HMLRFUSTKLCYDS-QGZVFWFLSA-N 1 2 307.397 4.051 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H]3CCCc4cccnc43)c(C)cc2c1 ZINC001157839068 1047758482 /nfs/dbraw/zinc/75/84/82/1047758482.db2.gz FILBISWQSFIFGM-GOSISDBHSA-N 1 2 319.408 4.436 20 0 DIADLO CC(C)OCCCNc1cc(-c2ccnc(Cl)c2)cc[nH+]1 ZINC001157867430 1047760168 /nfs/dbraw/zinc/76/01/68/1047760168.db2.gz IOZLEAJHRSZLHR-UHFFFAOYSA-N 1 2 305.809 4.024 20 0 DIADLO CSCc1cc[nH+]c(NCc2c(Cl)cncc2Cl)c1 ZINC001158302281 1047774493 /nfs/dbraw/zinc/77/44/93/1047774493.db2.gz AFQIQYIEFOTFFF-UHFFFAOYSA-N 1 2 314.241 4.259 20 0 DIADLO COc1ccc2[nH+]c(NCc3cc(C(C)C)no3)cc(C)c2c1 ZINC001157992877 1047766896 /nfs/dbraw/zinc/76/68/96/1047766896.db2.gz HJCMUXWBSSOMJO-UHFFFAOYSA-N 1 2 311.385 4.275 20 0 DIADLO O=C(CCNc1cc(-c2ccccc2)cc[nH+]1)Nc1ccccc1 ZINC001158121257 1047769647 /nfs/dbraw/zinc/76/96/47/1047769647.db2.gz NESBTOLPLFESBN-UHFFFAOYSA-N 1 2 317.392 4.189 20 0 DIADLO COc1cc2ccc(N[C@@H]3CCCC(F)(F)C3)[nH+]c2cc1OC ZINC001158334896 1047775132 /nfs/dbraw/zinc/77/51/32/1047775132.db2.gz CFXUVFSWEPXIHB-GFCCVEGCSA-N 1 2 322.355 4.242 20 0 DIADLO COC(=O)c1ccc2cc[nH+]c(N[C@H]3CCCC(F)(F)C3)c2c1 ZINC001158332158 1047775159 /nfs/dbraw/zinc/77/51/59/1047775159.db2.gz CNECRYWIAWOXLA-ZDUSSCGKSA-N 1 2 320.339 4.011 20 0 DIADLO C[C@@H]1C[C@H](Nc2cc(N3CCCCC3)nc[nH+]2)c2ccccc21 ZINC001158474913 1047784254 /nfs/dbraw/zinc/78/42/54/1047784254.db2.gz WEQFUHADPYGAOR-PBHICJAKSA-N 1 2 308.429 4.127 20 0 DIADLO C[C@@H]1C[C@H](Nc2cc(N3CCCCC3)[nH+]cn2)c2ccccc21 ZINC001158474913 1047784258 /nfs/dbraw/zinc/78/42/58/1047784258.db2.gz WEQFUHADPYGAOR-PBHICJAKSA-N 1 2 308.429 4.127 20 0 DIADLO COc1cc2c(cc1OC)CN(c1[nH+]ccc3c(C)cccc31)C2 ZINC001158609059 1047791625 /nfs/dbraw/zinc/79/16/25/1047791625.db2.gz LLSWPLITXSHUEI-UHFFFAOYSA-N 1 2 320.392 4.081 20 0 DIADLO Cc1cccc2c(C)cc(N[C@H]3CCc4ccccc4[C@@H]3O)[nH+]c12 ZINC001158674313 1047793526 /nfs/dbraw/zinc/79/35/26/1047793526.db2.gz FKKSHKJTADYRII-RXVVDRJESA-N 1 2 318.420 4.312 20 0 DIADLO Cc1cc(N[C@H]2CCc3ccccc3[C@@H]2O)[nH+]c2ccccc12 ZINC001158686070 1047794223 /nfs/dbraw/zinc/79/42/23/1047794223.db2.gz WBGPEMSTJMBCCB-ICSRJNTNSA-N 1 2 304.393 4.004 20 0 DIADLO Cc1cc(NCc2ccc(-c3ccccn3)cc2)nc(C2CC2)[nH+]1 ZINC001158912788 1047803876 /nfs/dbraw/zinc/80/38/76/1047803876.db2.gz VMVSYZFDJHBNCC-UHFFFAOYSA-N 1 2 316.408 4.337 20 0 DIADLO Cc1cccc2c(C)cc(NC[C@H](CO)Cc3ccccc3)[nH+]c12 ZINC001158915118 1047804033 /nfs/dbraw/zinc/80/40/33/1047804033.db2.gz BWEWNDCJUSCGTI-GOSISDBHSA-N 1 2 320.436 4.115 20 0 DIADLO Cc1cccc2c(C)cc(NC[C@@H](CO)Cc3ccccc3)[nH+]c12 ZINC001158915120 1047804234 /nfs/dbraw/zinc/80/42/34/1047804234.db2.gz BWEWNDCJUSCGTI-SFHVURJKSA-N 1 2 320.436 4.115 20 0 DIADLO COCc1cc[nH+]c(NC/C(=C/F)CCc2ccc(F)cc2)c1 ZINC001159049036 1047808527 /nfs/dbraw/zinc/80/85/27/1047808527.db2.gz BQZACDWWUPRSFK-LFIBNONCSA-N 1 2 318.367 4.265 20 0 DIADLO Cc1nc(NCc2nc(-c3ccccc3)cs2)c2c([nH+]1)CCC2 ZINC001159213424 1047820843 /nfs/dbraw/zinc/82/08/43/1047820843.db2.gz FAVPFLPBPAZNOX-UHFFFAOYSA-N 1 2 322.437 4.009 20 0 DIADLO Clc1cccc2c(N3CCC[C@@]4(CCCOC4)C3)cc[nH+]c12 ZINC000553155107 1047824918 /nfs/dbraw/zinc/82/49/18/1047824918.db2.gz YFVJHOCXNQIYBH-GOSISDBHSA-N 1 2 316.832 4.285 20 0 DIADLO CNc1ccc(Nc2cnc(Oc3ccccc3)cc2C)c[nH+]1 ZINC001159271460 1047825515 /nfs/dbraw/zinc/82/55/15/1047825515.db2.gz APCNIPKMNYEJRO-UHFFFAOYSA-N 1 2 306.369 4.363 20 0 DIADLO CC(C)Oc1ccc(Nc2ccc(N)[nH+]c2)c(C(F)(F)F)c1 ZINC001159281912 1047825982 /nfs/dbraw/zinc/82/59/82/1047825982.db2.gz IVLUXLUGOCNXSU-UHFFFAOYSA-N 1 2 311.307 4.213 20 0 DIADLO Cc1ccc(C)c([C@@H]2CCCN2c2cc(N3CCCC3)[nH+]cn2)c1 ZINC000553149751 1047827362 /nfs/dbraw/zinc/82/73/62/1047827362.db2.gz KNPJSSCESNCWOG-SFHVURJKSA-N 1 2 322.456 4.035 20 0 DIADLO Cc1ccc(C)c([C@@H]2CCCN2c2cc(N3CCCC3)nc[nH+]2)c1 ZINC000553149751 1047827368 /nfs/dbraw/zinc/82/73/68/1047827368.db2.gz KNPJSSCESNCWOG-SFHVURJKSA-N 1 2 322.456 4.035 20 0 DIADLO Cc1cc(C[NH2+]Cc2c(OC(C)C)ccc3ccccc32)no1 ZINC000553316266 1047836867 /nfs/dbraw/zinc/83/68/67/1047836867.db2.gz MTQQYRHCWNFQIR-UHFFFAOYSA-N 1 2 310.397 4.213 20 0 DIADLO CCS(=O)(=O)c1ccc(Nc2c(C)cc[nH+]c2C(C)C)cc1 ZINC001174462804 1047844110 /nfs/dbraw/zinc/84/41/10/1047844110.db2.gz DFNAVBREJWRLQA-UHFFFAOYSA-N 1 2 318.442 4.051 20 0 DIADLO Nc1cc(Cl)cc(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174525338 1047854472 /nfs/dbraw/zinc/85/44/72/1047854472.db2.gz UVKPOIPKMQNCJO-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO COc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)cc(F)c1F ZINC001174525431 1047855332 /nfs/dbraw/zinc/85/53/32/1047855332.db2.gz YSCRYNCUGPZCRJ-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H]1CCc2c1c(F)ccc2F ZINC000479283640 1047859566 /nfs/dbraw/zinc/85/95/66/1047859566.db2.gz MJQOAEJPRPAUGW-HNNXBMFYSA-N 1 2 323.770 4.404 20 0 DIADLO Clc1cccc2c(N3CCC[C@H]([C@@H]4CCOC4)C3)cc[nH+]c12 ZINC000553494974 1047860924 /nfs/dbraw/zinc/86/09/24/1047860924.db2.gz QROXUXGYHJVIRI-UONOGXRCSA-N 1 2 316.832 4.141 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2Cc2cccc(C(F)(F)F)c2)[nH+]c1C ZINC001197711578 1047873364 /nfs/dbraw/zinc/87/33/64/1047873364.db2.gz WBQAOQWPTAUDSV-OAHLLOKOSA-N 1 2 323.362 4.382 20 0 DIADLO CCCC(CCC)C(=O)N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC001183019175 1047881855 /nfs/dbraw/zinc/88/18/55/1047881855.db2.gz VSSQPKCXPZKARJ-HNNXBMFYSA-N 1 2 313.445 4.266 20 0 DIADLO CC(C)(C)C[N@H+](CC(=O)OC(C)(C)C)Cc1cccn1C1CC1 ZINC001183023870 1047882195 /nfs/dbraw/zinc/88/21/95/1047882195.db2.gz JLXUKEGQLKDNEH-UHFFFAOYSA-N 1 2 320.477 4.013 20 0 DIADLO CC(C)(C)C[N@@H+](CC(=O)OC(C)(C)C)Cc1cccn1C1CC1 ZINC001183023870 1047882211 /nfs/dbraw/zinc/88/22/11/1047882211.db2.gz JLXUKEGQLKDNEH-UHFFFAOYSA-N 1 2 320.477 4.013 20 0 DIADLO Cc1cc(Cl)ncc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523745 1047884261 /nfs/dbraw/zinc/88/42/61/1047884261.db2.gz YXNYGDVMRJYYBY-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO COc1cc(F)c(F)cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523579 1047885616 /nfs/dbraw/zinc/88/56/16/1047885616.db2.gz PLAVYOHKPQXARG-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO c1cc(C2CCC2)ncc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174522695 1047886112 /nfs/dbraw/zinc/88/61/12/1047886112.db2.gz UTRPLWBPUOCFJA-UHFFFAOYSA-N 1 2 308.429 4.478 20 0 DIADLO c1cc(Nc2ccc(N3CCCCC3)[nH+]c2)c2c(c1)OCCC2 ZINC001174525239 1047886684 /nfs/dbraw/zinc/88/66/84/1047886684.db2.gz TUWKGNNAUNQFMG-UHFFFAOYSA-N 1 2 309.413 4.141 20 0 DIADLO c1cc2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc2cn1 ZINC001174524223 1047886941 /nfs/dbraw/zinc/88/69/41/1047886941.db2.gz JCRTYRVBDGXSGA-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO Fc1cc(F)c(F)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174524917 1047887813 /nfs/dbraw/zinc/88/78/13/1047887813.db2.gz VYYHCKQRNBLVNH-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO Oc1ccc(Cl)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174523900 1047887942 /nfs/dbraw/zinc/88/79/42/1047887942.db2.gz XMEPQVTVBSMELJ-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO COc1c(F)cc(Nc2ccc(N3CCCCC3)[nH+]c2)cc1F ZINC001174523916 1047887995 /nfs/dbraw/zinc/88/79/95/1047887995.db2.gz YCSWGJHZXDZYIB-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO Nc1cc(F)c(Cl)cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174524915 1047888303 /nfs/dbraw/zinc/88/83/03/1047888303.db2.gz VNUUMUZBZJEPSK-UHFFFAOYSA-N 1 2 320.799 4.190 20 0 DIADLO c1ncc(-c2ccccc2Nc2ccc(N3CCCCC3)[nH+]c2)o1 ZINC001174524442 1047888576 /nfs/dbraw/zinc/88/85/76/1047888576.db2.gz KHQSLCYWAZUOPN-UHFFFAOYSA-N 1 2 320.396 4.471 20 0 DIADLO Fc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)cc(F)c1F ZINC001174524498 1047888665 /nfs/dbraw/zinc/88/86/65/1047888665.db2.gz LYEVEOJRJZTTII-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO CCOC[C@H]1CCC[C@H]1Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000479428200 1047891832 /nfs/dbraw/zinc/89/18/32/1047891832.db2.gz UHNKVDISCQVZMT-CZUORRHYSA-N 1 2 319.836 4.143 20 0 DIADLO Cc1ccc(NC(=S)Nc2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001197923088 1047902207 /nfs/dbraw/zinc/90/22/07/1047902207.db2.gz IWCUGUBQELLLFQ-UHFFFAOYSA-N 1 2 322.437 4.049 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)cc1Cl ZINC001183156293 1047903142 /nfs/dbraw/zinc/90/31/42/1047903142.db2.gz NNAQULYYSPWUGI-APIJFGDWSA-N 1 2 320.864 4.023 20 0 DIADLO CCCN(Cc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1F ZINC001174561867 1047905696 /nfs/dbraw/zinc/90/56/96/1047905696.db2.gz BFXSTOGMUTYPQK-UHFFFAOYSA-N 1 2 309.388 4.428 20 0 DIADLO CCn1cc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)cn1 ZINC001174565938 1047906841 /nfs/dbraw/zinc/90/68/41/1047906841.db2.gz DFLGSQBFTHZFKB-UHFFFAOYSA-N 1 2 306.291 4.214 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)N(C)Cc1c[nH+]c2n1CCC2 ZINC000667499724 1047910273 /nfs/dbraw/zinc/91/02/73/1047910273.db2.gz SWVIOSQMWHMJCQ-NSHDSACASA-N 1 2 324.255 4.329 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1c[nH+]c2n1CCC2 ZINC000667508936 1047922387 /nfs/dbraw/zinc/92/23/87/1047922387.db2.gz SCRLFKXUYNMYNF-LLVKDONJSA-N 1 2 324.255 4.329 20 0 DIADLO CCc1ccc(F)cc1C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC001183350493 1047922976 /nfs/dbraw/zinc/92/29/76/1047922976.db2.gz SRAZVTHPTJHMAJ-UHFFFAOYSA-N 1 2 323.371 4.339 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2F)CC2CC2)c(C)s1 ZINC001174680692 1047932090 /nfs/dbraw/zinc/93/20/90/1047932090.db2.gz NCFNNOOAYQVJAR-UHFFFAOYSA-N 1 2 304.434 4.311 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2F)CC2CC2)c(C)s1 ZINC001174680692 1047932102 /nfs/dbraw/zinc/93/21/02/1047932102.db2.gz NCFNNOOAYQVJAR-UHFFFAOYSA-N 1 2 304.434 4.311 20 0 DIADLO Cn1c2ccccc2nc1[C@@H]1CCCC[N@@H+]1Cc1cccc(F)c1 ZINC000553761733 1047935192 /nfs/dbraw/zinc/93/51/92/1047935192.db2.gz WQCHLNITVXTLNZ-IBGZPJMESA-N 1 2 323.415 4.440 20 0 DIADLO Cn1c2ccccc2nc1[C@@H]1CCCC[N@H+]1Cc1cccc(F)c1 ZINC000553761733 1047935199 /nfs/dbraw/zinc/93/51/99/1047935199.db2.gz WQCHLNITVXTLNZ-IBGZPJMESA-N 1 2 323.415 4.440 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@@H]2CCc3ccc(O)cc3C2)[nH+]1 ZINC001159892974 1047942596 /nfs/dbraw/zinc/94/25/96/1047942596.db2.gz JSVRFWGWLSDAQE-CQSZACIVSA-N 1 2 302.805 4.027 20 0 DIADLO CCO[C@@H](C)n1cc(Nc2ccc([NH+]3CCCCC3)cc2)cn1 ZINC001174700668 1047943810 /nfs/dbraw/zinc/94/38/10/1047943810.db2.gz WHQSPJJUZUZZFR-HNNXBMFYSA-N 1 2 314.433 4.172 20 0 DIADLO FC(F)(F)c1cncc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001174743206 1047947200 /nfs/dbraw/zinc/94/72/00/1047947200.db2.gz AWSPYBZDYGVDKM-UHFFFAOYSA-N 1 2 318.302 4.089 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2cncc(Cl)c2Cl)C1 ZINC001183672460 1047952890 /nfs/dbraw/zinc/95/28/90/1047952890.db2.gz LUJPMQMZYBSQTD-NSHDSACASA-N 1 2 313.150 4.163 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2cncc(Cl)c2Cl)C1 ZINC001183672460 1047952893 /nfs/dbraw/zinc/95/28/93/1047952893.db2.gz LUJPMQMZYBSQTD-NSHDSACASA-N 1 2 313.150 4.163 20 0 DIADLO O=C(Nc1cc2ccccc2s1)[C@@H]1CC[N@@H+]1Cc1ccccc1 ZINC001183748831 1047962984 /nfs/dbraw/zinc/96/29/84/1047962984.db2.gz SCGLICDKQFPHEU-INIZCTEOSA-N 1 2 322.433 4.114 20 0 DIADLO O=C(Nc1cc2ccccc2s1)[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC001183748831 1047962991 /nfs/dbraw/zinc/96/29/91/1047962991.db2.gz SCGLICDKQFPHEU-INIZCTEOSA-N 1 2 322.433 4.114 20 0 DIADLO CC(C)c1ccccc1NC(=O)[C@@H]1CC[N@@H+]1Cc1ccccc1 ZINC001183744650 1047963360 /nfs/dbraw/zinc/96/33/60/1047963360.db2.gz JROLBPWYWXYJLU-IBGZPJMESA-N 1 2 308.425 4.023 20 0 DIADLO CC(C)c1ccccc1NC(=O)[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC001183744650 1047963370 /nfs/dbraw/zinc/96/33/70/1047963370.db2.gz JROLBPWYWXYJLU-IBGZPJMESA-N 1 2 308.425 4.023 20 0 DIADLO CC(C)(C)OC(=O)C1([NH2+]CCc2cccc(F)c2)CCCCC1 ZINC001198491478 1047963514 /nfs/dbraw/zinc/96/35/14/1047963514.db2.gz RHSRJKUTODNMQO-UHFFFAOYSA-N 1 2 321.436 4.002 20 0 DIADLO COc1ccc([C@@H](C)CC(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)cc1 ZINC000479782339 1047972751 /nfs/dbraw/zinc/97/27/51/1047972751.db2.gz UQRONDSVAIPXHR-LBPRGKRZSA-N 1 2 323.396 4.012 20 0 DIADLO FC(F)(F)c1cncc(Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001174744033 1047974007 /nfs/dbraw/zinc/97/40/07/1047974007.db2.gz YDHGBHDBGFSDOZ-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO CNc1ccc(Nc2cccc(Br)c2Cl)c[nH+]1 ZINC001160035124 1047976104 /nfs/dbraw/zinc/97/61/04/1047976104.db2.gz TYPNNIVZJVFYML-UHFFFAOYSA-N 1 2 312.598 4.283 20 0 DIADLO COC(=O)c1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)s1 ZINC000553986883 1047978759 /nfs/dbraw/zinc/97/87/59/1047978759.db2.gz GFQUBEQSIQGRFR-CQSZACIVSA-N 1 2 321.467 4.179 20 0 DIADLO COC(=O)c1ccc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)s1 ZINC000553986883 1047978762 /nfs/dbraw/zinc/97/87/62/1047978762.db2.gz GFQUBEQSIQGRFR-CQSZACIVSA-N 1 2 321.467 4.179 20 0 DIADLO CC[C@@H](N[C@@H](C[NH+](C)C)c1ccc(F)cc1)c1ccc(C)cc1 ZINC000554086866 1048006448 /nfs/dbraw/zinc/00/64/48/1048006448.db2.gz RLJDZXNKWYFFCC-UXHICEINSA-N 1 2 314.448 4.478 20 0 DIADLO c1cn(Cc2cccc(Nc3cccc4ncccc43)c2)c[nH+]1 ZINC001174907197 1048019591 /nfs/dbraw/zinc/01/95/91/1048019591.db2.gz BJKJPJCWBMDVCD-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO CCOC(=O)[C@H](c1ccccc1)[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000554172173 1048025701 /nfs/dbraw/zinc/02/57/01/1048025701.db2.gz UVMFDZBJIFXKNC-WBVHZDCISA-N 1 2 315.438 4.189 20 0 DIADLO CCOC(=O)[C@H](c1ccccc1)[N@H+]1CCC[C@@H]1c1cccs1 ZINC000554172173 1048025710 /nfs/dbraw/zinc/02/57/10/1048025710.db2.gz UVMFDZBJIFXKNC-WBVHZDCISA-N 1 2 315.438 4.189 20 0 DIADLO Cc1ccc(Nc2ccc(N(C)C3CCCCC3)[nH+]c2)cc1N ZINC001160329018 1048033495 /nfs/dbraw/zinc/03/34/95/1048033495.db2.gz FPPFMUPOKFDEBQ-UHFFFAOYSA-N 1 2 310.445 4.485 20 0 DIADLO Cc1cc(Nc2ccc(O[C@@H]3CC[NH2+]CC3(F)F)cc2)c(C)o1 ZINC001160350411 1048039938 /nfs/dbraw/zinc/03/99/38/1048039938.db2.gz LPNBQGFUWJKECF-MRXNPFEDSA-N 1 2 322.355 4.016 20 0 DIADLO C[C@]12C[C@@H]3C[C@](C(=O)Nc4cccc5[nH+]ccn54)(C1)C[C@@](C)(C3)C2 ZINC001184495147 1048041573 /nfs/dbraw/zinc/04/15/73/1048041573.db2.gz VMTNAGNHOUREOF-UFUCFOROSA-N 1 2 323.440 4.269 20 0 DIADLO CSc1ncc(Cl)c(CNc2cc3ccccc3c[nH+]2)n1 ZINC001160441941 1048049842 /nfs/dbraw/zinc/04/98/42/1048049842.db2.gz ILRGJBDZKXXPGG-UHFFFAOYSA-N 1 2 316.817 4.012 20 0 DIADLO COc1ccc([C@@H]2CCCN2c2cc(C)[nH+]c(C3CCC3)n2)cc1 ZINC001184563378 1048056510 /nfs/dbraw/zinc/05/65/10/1048056510.db2.gz HTHZIHIFLDPRTK-SFHVURJKSA-N 1 2 323.440 4.403 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](c2ccccc2)c2ccc(O)cc2)c1 ZINC001160495571 1048057859 /nfs/dbraw/zinc/05/78/59/1048057859.db2.gz VQAPPDLMNJZBSF-FQEVSTJZSA-N 1 2 320.392 4.135 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@@H]2CCc3ccccc3C2)c(C)[nH+]1 ZINC000480125813 1048060185 /nfs/dbraw/zinc/06/01/85/1048060185.db2.gz QSOVHKOAIPDFPR-MRXNPFEDSA-N 1 2 308.425 4.141 20 0 DIADLO Cc1cccc(C(C)(C)C)c1NC(=O)Nc1cc[nH+]c2c1CCC2 ZINC001184583260 1048062251 /nfs/dbraw/zinc/06/22/51/1048062251.db2.gz SXMKHIITXKCQLD-UHFFFAOYSA-N 1 2 323.440 4.242 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)cc1 ZINC000554309829 1048064833 /nfs/dbraw/zinc/06/48/33/1048064833.db2.gz WUZITCCPYUIPNC-QGZVFWFLSA-N 1 2 314.454 4.078 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+]2CC(C)(C)[C@H]2c2cccs2)cc1 ZINC000554309829 1048064848 /nfs/dbraw/zinc/06/48/48/1048064848.db2.gz WUZITCCPYUIPNC-QGZVFWFLSA-N 1 2 314.454 4.078 20 0 DIADLO CCOc1cc(F)cc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001175006919 1048068815 /nfs/dbraw/zinc/06/88/15/1048068815.db2.gz XWMBEHJYFMEDMK-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO Cc1cn2c(cccc2NC(=O)Nc2cccc(Cl)c2C)[nH+]1 ZINC001184645194 1048071778 /nfs/dbraw/zinc/07/17/78/1048071778.db2.gz NTGSCLXWPAWREW-UHFFFAOYSA-N 1 2 314.776 4.249 20 0 DIADLO Cc1cc2c(ncnc2N[C@@H](C)c2c[nH+]c3c(C)cccn23)s1 ZINC001160683686 1048077122 /nfs/dbraw/zinc/07/71/22/1048077122.db2.gz SVAWFZAEUPCTQH-LBPRGKRZSA-N 1 2 323.425 4.129 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3nc(Cl)ccc3F)c[nH+]c12 ZINC001160682938 1048077246 /nfs/dbraw/zinc/07/72/46/1048077246.db2.gz HZKSDCDSYIGVMH-JTQLQIEISA-N 1 2 304.756 4.003 20 0 DIADLO COc1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)c(F)c1F ZINC001175021606 1048077227 /nfs/dbraw/zinc/07/72/27/1048077227.db2.gz VPOBKHBKFBNCGK-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3nccc(C)c3Cl)c[nH+]c12 ZINC001160682979 1048078389 /nfs/dbraw/zinc/07/83/89/1048078389.db2.gz JUNYSRLRTXFXOZ-LBPRGKRZSA-N 1 2 300.793 4.173 20 0 DIADLO Cc1ccc(Cl)c(N[C@@H](C)c2c[nH+]c3c(C)cccn23)n1 ZINC001160684161 1048078909 /nfs/dbraw/zinc/07/89/09/1048078909.db2.gz XRAOXMFAFPPWLM-LBPRGKRZSA-N 1 2 300.793 4.173 20 0 DIADLO CCOc1cc(CNc2cc(C)c3ccccc3[nH+]2)ccc1O ZINC001160784969 1048085120 /nfs/dbraw/zinc/08/51/20/1048085120.db2.gz HQZRBNPDCWLEAA-UHFFFAOYSA-N 1 2 308.381 4.260 20 0 DIADLO CCc1cc(NCCSc2ccc(C)cc2)nc(CC)[nH+]1 ZINC001184839626 1048096519 /nfs/dbraw/zinc/09/65/19/1048096519.db2.gz NMPQAIGCEXOBLZ-UHFFFAOYSA-N 1 2 301.459 4.114 20 0 DIADLO COc1ccc(F)cc1[C@H](C)Nc1cc(C)[nH+]c(C2CCC2)n1 ZINC001184892666 1048096988 /nfs/dbraw/zinc/09/69/88/1048096988.db2.gz INSQIJCFPQVEQR-LBPRGKRZSA-N 1 2 315.392 4.373 20 0 DIADLO c1sc(C2CC2)nc1C[NH2+][C@@H](c1ccccc1)[C@@H]1CCCO1 ZINC001199783850 1048101402 /nfs/dbraw/zinc/10/14/02/1048101402.db2.gz LSOMWJDPSKQYLV-IRXDYDNUSA-N 1 2 314.454 4.030 20 0 DIADLO c1sc(C2CC2)nc1C[NH2+][C@H](c1ccccc1)[C@H]1CCCO1 ZINC001199783848 1048102143 /nfs/dbraw/zinc/10/21/43/1048102143.db2.gz LSOMWJDPSKQYLV-IAGOWNOFSA-N 1 2 314.454 4.030 20 0 DIADLO Clc1ncc(Br)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213028059 1048102498 /nfs/dbraw/zinc/10/24/98/1048102498.db2.gz HFIWNOKXQFJCGF-UHFFFAOYSA-N 1 2 323.581 4.117 20 0 DIADLO Cn1c2ccccc2nc1C(C)(C)[NH2+]Cc1ccsc1Cl ZINC000480250968 1048103649 /nfs/dbraw/zinc/10/36/49/1048103649.db2.gz IQBMNFVYLFDYLC-UHFFFAOYSA-N 1 2 319.861 4.313 20 0 DIADLO CCc1nc(N2CCC[C@@H]2c2cccc(Cl)c2)cc(C)[nH+]1 ZINC001184926759 1048105466 /nfs/dbraw/zinc/10/54/66/1048105466.db2.gz IXUNRGDWNSBVTP-OAHLLOKOSA-N 1 2 301.821 4.342 20 0 DIADLO c1ncc(-c2ccccc2Nc2ccc[nH+]c2N2CCCC2)o1 ZINC001184969016 1048106996 /nfs/dbraw/zinc/10/69/96/1048106996.db2.gz VHGYNQKZGHOEOV-UHFFFAOYSA-N 1 2 306.369 4.080 20 0 DIADLO Oc1ccc2ccccc2c1Nc1ccc[nH+]c1N1CCCC1 ZINC001184968032 1048107849 /nfs/dbraw/zinc/10/78/49/1048107849.db2.gz KHTHUYCVVBRPLD-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO Oc1ccc2cccc(Nc3ccc[nH+]c3N3CCCC3)c2c1 ZINC001184967544 1048108180 /nfs/dbraw/zinc/10/81/80/1048108180.db2.gz GCCSULLCSDYLOW-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO C/C=C/C[C@@H]1CCC[N@@H+]([C@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001175054488 1048111653 /nfs/dbraw/zinc/11/16/53/1048111653.db2.gz SBNOYSFOXMCRCA-FHPLJQIUSA-N 1 2 321.848 4.232 20 0 DIADLO C/C=C/C[C@@H]1CCC[N@H+]([C@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001175054488 1048111654 /nfs/dbraw/zinc/11/16/54/1048111654.db2.gz SBNOYSFOXMCRCA-FHPLJQIUSA-N 1 2 321.848 4.232 20 0 DIADLO CCOc1cc(F)c(Nc2cc(Cl)c3[nH+]ccn3c2)cc1F ZINC001175054362 1048112572 /nfs/dbraw/zinc/11/25/72/1048112572.db2.gz OIOYWMMDSXOHRB-UHFFFAOYSA-N 1 2 323.730 4.408 20 0 DIADLO Fc1ccc(Nc2cccc3[nH+]c[nH]c32)c(Br)c1 ZINC001213030422 1048113664 /nfs/dbraw/zinc/11/36/64/1048113664.db2.gz AWODEDXLBFZYBZ-UHFFFAOYSA-N 1 2 306.138 4.208 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccccc2Oc2ccccc2)[nH]c1C ZINC001199874114 1048114062 /nfs/dbraw/zinc/11/40/62/1048114062.db2.gz FSTXQJXQZGSCGV-UHFFFAOYSA-N 1 2 307.397 4.109 20 0 DIADLO COc1ccc(C(F)(F)F)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213030853 1048115431 /nfs/dbraw/zinc/11/54/31/1048115431.db2.gz URGPRHKBSYRMLI-UHFFFAOYSA-N 1 2 307.275 4.334 20 0 DIADLO COc1ccc(Nc2cccc3[nH+]c[nH]c32)c(Br)c1 ZINC001213031514 1048118809 /nfs/dbraw/zinc/11/88/09/1048118809.db2.gz DENYDBGXBJWNTB-UHFFFAOYSA-N 1 2 318.174 4.078 20 0 DIADLO COc1ccc(C2(Nc3cc(CSC)cc[nH+]3)CC2)cc1 ZINC001161264018 1048118892 /nfs/dbraw/zinc/11/88/92/1048118892.db2.gz LEJZUYQFLZILNT-UHFFFAOYSA-N 1 2 300.427 4.054 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2cn(C3CCC3)nn2)o1 ZINC000667657946 1048119732 /nfs/dbraw/zinc/11/97/32/1048119732.db2.gz UOOBLBKGCIXKQW-QGZVFWFLSA-N 1 2 314.433 4.022 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2cn(C3CCC3)nn2)o1 ZINC000667657946 1048119743 /nfs/dbraw/zinc/11/97/43/1048119743.db2.gz UOOBLBKGCIXKQW-QGZVFWFLSA-N 1 2 314.433 4.022 20 0 DIADLO COCc1ccc(CNc2ccc3ccc(OC)cc3[nH+]2)cc1 ZINC001161327046 1048123157 /nfs/dbraw/zinc/12/31/57/1048123157.db2.gz IRTGQBHTYBNHMD-UHFFFAOYSA-N 1 2 308.381 4.002 20 0 DIADLO COc1cc(Nc2ccc([NH+]3CCCCC3)cc2)cc(OC)c1 ZINC001175111590 1048123121 /nfs/dbraw/zinc/12/31/21/1048123121.db2.gz RLXKHWMITYPAEW-UHFFFAOYSA-N 1 2 312.413 4.438 20 0 DIADLO Cc1nc(NCC(C)(C)c2ccc(Cl)c(Cl)c2)cc[nH+]1 ZINC001185097763 1048127445 /nfs/dbraw/zinc/12/74/45/1048127445.db2.gz CRZRDQBQPDHSRQ-UHFFFAOYSA-N 1 2 310.228 4.482 20 0 DIADLO COC(=O)c1cccc2c(Nc3cccc4[nH+]c[nH]c43)cccc12 ZINC001213033518 1048136640 /nfs/dbraw/zinc/13/66/40/1048136640.db2.gz KNEKRKBHKDUXOW-UHFFFAOYSA-N 1 2 317.348 4.246 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1c(Cl)cc(Cl)nc1Cl ZINC001161563188 1048139095 /nfs/dbraw/zinc/13/90/95/1048139095.db2.gz RRUWRGSWGZSWME-UHFFFAOYSA-N 1 2 319.623 4.431 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc2c(Cl)ccc(F)c2n1 ZINC001161569076 1048140355 /nfs/dbraw/zinc/14/03/55/1048140355.db2.gz BINYKHCYZKJOAW-UHFFFAOYSA-N 1 2 318.783 4.417 20 0 DIADLO CCCCOc1cnc(NCc2c[nH+]cn2C(C)C)c(Cl)c1 ZINC001161570520 1048140563 /nfs/dbraw/zinc/14/05/63/1048140563.db2.gz ZHMKQGKZTNWDSX-UHFFFAOYSA-N 1 2 322.840 4.303 20 0 DIADLO C[C@H](CNc1nc2ccccc2n2c[nH+]cc12)c1ccc(F)cc1 ZINC001185149876 1048143908 /nfs/dbraw/zinc/14/39/08/1048143908.db2.gz VVGPAHCIWKWENU-CYBMUJFWSA-N 1 2 320.371 4.237 20 0 DIADLO C[C@@H](CNc1nc2ccccc2n2c[nH+]cc12)c1ccc(F)cc1 ZINC001185149878 1048144051 /nfs/dbraw/zinc/14/40/51/1048144051.db2.gz VVGPAHCIWKWENU-ZDUSSCGKSA-N 1 2 320.371 4.237 20 0 DIADLO CCCC[C@H]1CCC[C@@H]1Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001185241242 1048150582 /nfs/dbraw/zinc/15/05/82/1048150582.db2.gz HHGJIDXHKOVRCT-ZFWWWQNUSA-N 1 2 315.465 4.352 20 0 DIADLO CCSc1cc[nH+]c(NCC(C)(C)c2cccc(C)n2)c1 ZINC001161644468 1048151720 /nfs/dbraw/zinc/15/17/20/1048151720.db2.gz YHTYUGUSYWKTTK-UHFFFAOYSA-N 1 2 301.459 4.287 20 0 DIADLO Cc1ccc(F)c(NC(=O)Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001185255159 1048152558 /nfs/dbraw/zinc/15/25/58/1048152558.db2.gz ICYRBZNMOYWJCE-UHFFFAOYSA-N 1 2 324.359 4.023 20 0 DIADLO Cc1ccc(F)c(NC(=O)Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001185255288 1048154180 /nfs/dbraw/zinc/15/41/80/1048154180.db2.gz LOHUCPXJJHPNMR-UHFFFAOYSA-N 1 2 324.359 4.023 20 0 DIADLO Fc1cc(Nc2cccc3[nH+]c[nH]c32)cc(F)c1OCC1CC1 ZINC001213034677 1048155542 /nfs/dbraw/zinc/15/55/42/1048155542.db2.gz XABBUHRQDIXPAJ-UHFFFAOYSA-N 1 2 315.323 4.374 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3CCO[C@H](c4ccsc4)C3)cc21 ZINC000667681031 1048155573 /nfs/dbraw/zinc/15/55/73/1048155573.db2.gz ZIDPQGDYADOJIM-SFHVURJKSA-N 1 2 312.438 4.111 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3CCO[C@H](c4ccsc4)C3)cc21 ZINC000667681031 1048155579 /nfs/dbraw/zinc/15/55/79/1048155579.db2.gz ZIDPQGDYADOJIM-SFHVURJKSA-N 1 2 312.438 4.111 20 0 DIADLO CCCC[N@H+](C)c1ccc(Nc2ncc(SC)cn2)cc1 ZINC001185299161 1048159768 /nfs/dbraw/zinc/15/97/68/1048159768.db2.gz OLRYIIMHNLAASY-UHFFFAOYSA-N 1 2 302.447 4.178 20 0 DIADLO CCCC[N@@H+](C)c1ccc(Nc2ncc(SC)cn2)cc1 ZINC001185299161 1048159775 /nfs/dbraw/zinc/15/97/75/1048159775.db2.gz OLRYIIMHNLAASY-UHFFFAOYSA-N 1 2 302.447 4.178 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2Cl)C[N@@H+]1C[C@@H]1CCC(C)(C)O1 ZINC000480522509 1048161259 /nfs/dbraw/zinc/16/12/59/1048161259.db2.gz DAGPRBJQKUTIFD-KEYYUXOJSA-N 1 2 323.864 4.059 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2Cl)C[N@H+]1C[C@@H]1CCC(C)(C)O1 ZINC000480522509 1048161270 /nfs/dbraw/zinc/16/12/70/1048161270.db2.gz DAGPRBJQKUTIFD-KEYYUXOJSA-N 1 2 323.864 4.059 20 0 DIADLO Cc1nc(NCC(C)(C)c2ccc(OCC(C)C)cc2)cc[nH+]1 ZINC001185304488 1048162057 /nfs/dbraw/zinc/16/20/57/1048162057.db2.gz CDWWBUMCBIXWNT-UHFFFAOYSA-N 1 2 313.445 4.210 20 0 DIADLO FC(F)(F)C1(c2ccc(NC3Cc4ccccc4C3)[nH+]c2)CC1 ZINC001161758299 1048166229 /nfs/dbraw/zinc/16/62/29/1048166229.db2.gz QCCVZVBSJLNFEP-UHFFFAOYSA-N 1 2 318.342 4.255 20 0 DIADLO Nc1[nH+]c(N[C@@H](CC2CC2)c2ccccc2F)ccc1Cl ZINC001161778193 1048171577 /nfs/dbraw/zinc/17/15/77/1048171577.db2.gz XLCUJXSSJFBJMK-AWEZNQCLSA-N 1 2 305.784 4.410 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H](c2cccnc2OC)C2CC2)c1 ZINC001161794024 1048173532 /nfs/dbraw/zinc/17/35/32/1048173532.db2.gz NOEFMQGLBYRVLF-MRXNPFEDSA-N 1 2 315.442 4.160 20 0 DIADLO Cc1cc(N2C[C@@H](c3ccccc3)C[C@@H]2C)nc(C2CCC2)[nH+]1 ZINC001185367773 1048174378 /nfs/dbraw/zinc/17/43/78/1048174378.db2.gz ZHKIJPYUCVJZKA-YJBOKZPZSA-N 1 2 307.441 4.435 20 0 DIADLO CSCc1cc[nH+]c(N[C@@H](c2cncc(F)c2)C2CC2)c1 ZINC001161818836 1048177310 /nfs/dbraw/zinc/17/73/10/1048177310.db2.gz RDILKGDDQQVYGA-MRXNPFEDSA-N 1 2 303.406 4.042 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CC[C@H](C(F)(F)F)[C@H]1C ZINC000480564300 1048181800 /nfs/dbraw/zinc/18/18/00/1048181800.db2.gz RVMFLCYXUGSATQ-YPMHNXCESA-N 1 2 324.346 4.329 20 0 DIADLO CCOC(=O)/C=C/c1ccc[nH+]c1NC(C)(C)CC1CCC1 ZINC001161846898 1048184530 /nfs/dbraw/zinc/18/45/30/1048184530.db2.gz DYZVMOXSQZSCPJ-ZHACJKMWSA-N 1 2 302.418 4.039 20 0 DIADLO Cc1cc(N[C@@H](c2ccnc(F)c2)C2CC2)nc(C(C)C)[nH+]1 ZINC001161844334 1048185234 /nfs/dbraw/zinc/18/52/34/1048185234.db2.gz BHIJSWDVCLHWTH-MRXNPFEDSA-N 1 2 300.381 4.006 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cccc(O[C@@H]2CCCCO2)c1 ZINC001175184399 1048187407 /nfs/dbraw/zinc/18/74/07/1048187407.db2.gz UNNANGXYBCWJLB-GOSISDBHSA-N 1 2 314.385 4.129 20 0 DIADLO CCc1cc(NC[C@H](C)c2ccc(F)cc2F)nc(CC)[nH+]1 ZINC001185507054 1048188344 /nfs/dbraw/zinc/18/83/44/1048188344.db2.gz DXFZMQPYKGNQQI-NSHDSACASA-N 1 2 305.372 4.095 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cccc(O[C@H]4CCCCO4)c3)ccc21 ZINC001175186483 1048190600 /nfs/dbraw/zinc/19/06/00/1048190600.db2.gz HYJQRUSWZYEZPY-IBGZPJMESA-N 1 2 323.396 4.222 20 0 DIADLO COc1cc(Nc2cccc(O[C@@H]3CCCCO3)c2)cc(C)[nH+]1 ZINC001175188637 1048191871 /nfs/dbraw/zinc/19/18/71/1048191871.db2.gz WVJUVGICCBQOSK-GOSISDBHSA-N 1 2 314.385 4.048 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CCN2c2cc(CC)[nH+]c(C)n2)o1 ZINC001185526382 1048192299 /nfs/dbraw/zinc/19/22/99/1048192299.db2.gz AKAMQJXLHLOTRN-GUYCJALGSA-N 1 2 313.445 4.480 20 0 DIADLO CC(=O)c1ccc(Nc2ccc[nH+]c2N2CCCCC2)cc1F ZINC001175228041 1048204915 /nfs/dbraw/zinc/20/49/15/1048204915.db2.gz TYWLMQXHDLFXMH-UHFFFAOYSA-N 1 2 313.376 4.157 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccc(Cl)cn1 ZINC000480662075 1048205009 /nfs/dbraw/zinc/20/50/09/1048205009.db2.gz LPKXNJXJFKWIPO-CYBMUJFWSA-N 1 2 316.836 4.293 20 0 DIADLO Clc1ccc(CCNc2nc3ccccc3n3c[nH+]cc23)cc1 ZINC001161979894 1048206706 /nfs/dbraw/zinc/20/67/06/1048206706.db2.gz MRJRWRBWJDOIBI-UHFFFAOYSA-N 1 2 322.799 4.191 20 0 DIADLO CSCc1cc[nH+]c(NCCc2cccc(Cl)c2F)c1 ZINC001161985661 1048208354 /nfs/dbraw/zinc/20/83/54/1048208354.db2.gz MQMCTCFAICWVTI-UHFFFAOYSA-N 1 2 310.825 4.392 20 0 DIADLO CCCC[C@@H](CCC)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001185620180 1048210664 /nfs/dbraw/zinc/21/06/64/1048210664.db2.gz FMMPXBIOQASXHN-CYBMUJFWSA-N 1 2 303.454 4.352 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2ccccc21)c1nc(C2CCCCC2)no1 ZINC000554864541 1048215267 /nfs/dbraw/zinc/21/52/67/1048215267.db2.gz APWKRVSCOFVLII-SUMWQHHRSA-N 1 2 311.429 4.455 20 0 DIADLO C[C@H](Nc1ccc(Cn2cc[nH+]c2)cn1)[C@@H](C)C1CCCCC1 ZINC000554878249 1048218750 /nfs/dbraw/zinc/21/87/50/1048218750.db2.gz HFELXUPSQQOFFO-CVEARBPZSA-N 1 2 312.461 4.343 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nc2ccccc2n1CC ZINC000554890474 1048220175 /nfs/dbraw/zinc/22/01/75/1048220175.db2.gz OHYKWTIQNPXQST-QGZVFWFLSA-N 1 2 308.429 4.034 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nc2ccccc2n1CC ZINC000554890474 1048220189 /nfs/dbraw/zinc/22/01/89/1048220189.db2.gz OHYKWTIQNPXQST-QGZVFWFLSA-N 1 2 308.429 4.034 20 0 DIADLO Cc1nc(N(C)Cc2cccc(Cl)c2Cl)c(C)c(C)[nH+]1 ZINC001185745626 1048221986 /nfs/dbraw/zinc/22/19/86/1048221986.db2.gz LPTBZHXHKGPTNB-UHFFFAOYSA-N 1 2 310.228 4.345 20 0 DIADLO Nc1ccc(Nc2c(Br)ccc3ccccc32)c[nH+]1 ZINC001201283845 1048225758 /nfs/dbraw/zinc/22/57/58/1048225758.db2.gz HCWVDFNIFYMSRE-UHFFFAOYSA-N 1 2 314.186 4.323 20 0 DIADLO Nc1ccc(Nc2c(C(F)(F)F)cccc2C(F)(F)F)c[nH+]1 ZINC001201286007 1048226514 /nfs/dbraw/zinc/22/65/14/1048226514.db2.gz UQWOXTKLHUXYAS-UHFFFAOYSA-N 1 2 321.224 4.445 20 0 DIADLO Nc1ccc(-c2cc3cc(Nc4ccc(N)[nH+]c4)ccc3o2)cc1 ZINC001201291997 1048227932 /nfs/dbraw/zinc/22/79/32/1048227932.db2.gz SMCQEKWQFQRDHF-UHFFFAOYSA-N 1 2 316.364 4.403 20 0 DIADLO Nc1ccc(N(c2ccc(Cl)cc2)c2ccccc2N)c[nH+]1 ZINC001201291768 1048228249 /nfs/dbraw/zinc/22/82/49/1048228249.db2.gz BVGFNYIAKWVFQS-UHFFFAOYSA-N 1 2 310.788 4.369 20 0 DIADLO CC(C)(C)OC(=O)n1ccc2c1cccc2Nc1ccc(N)[nH+]c1 ZINC001201291172 1048228517 /nfs/dbraw/zinc/22/85/17/1048228517.db2.gz DDPJMOMQJKQFFA-UHFFFAOYSA-N 1 2 324.384 4.145 20 0 DIADLO Nc1ccc(Nc2cc(Cl)c(F)c(C(F)(F)F)c2)c[nH+]1 ZINC001201293027 1048228662 /nfs/dbraw/zinc/22/86/62/1048228662.db2.gz WBEFLYQUTPFFHH-UHFFFAOYSA-N 1 2 305.662 4.219 20 0 DIADLO Cc1cc(Cl)cc(Br)c1Nc1ccc(N)[nH+]c1 ZINC001201291074 1048229345 /nfs/dbraw/zinc/22/93/45/1048229345.db2.gz ABAANPBEBVCXBO-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO Nc1ccc(Nc2ccc(OC3CCCCC3)c(F)c2)c[nH+]1 ZINC001201291856 1048229663 /nfs/dbraw/zinc/22/96/63/1048229663.db2.gz GCMFYOOERDRSGG-UHFFFAOYSA-N 1 2 301.365 4.258 20 0 DIADLO Cc1sc(Nc2ccc(N)[nH+]c2)c(C(=O)c2ccccc2)c1C ZINC001201275392 1048230405 /nfs/dbraw/zinc/23/04/05/1048230405.db2.gz DPUNPPMLLUPPKP-UHFFFAOYSA-N 1 2 323.421 4.317 20 0 DIADLO Cc1ccccc1-n1nc(C(C)(C)C)cc1Nc1ccc(N)[nH+]c1 ZINC001201278258 1048230561 /nfs/dbraw/zinc/23/05/61/1048230561.db2.gz GTWIWSYHAJGOBI-UHFFFAOYSA-N 1 2 321.428 4.199 20 0 DIADLO Nc1ccc(Nc2cc(-c3ccc(C(F)(F)F)cc3)no2)c[nH+]1 ZINC001201278197 1048230714 /nfs/dbraw/zinc/23/07/14/1048230714.db2.gz FHPLAADBVYJGNJ-UHFFFAOYSA-N 1 2 320.274 4.081 20 0 DIADLO Cc1cccc(-n2nc(C(C)(C)C)cc2Nc2ccc(N)[nH+]c2)c1 ZINC001201279155 1048230859 /nfs/dbraw/zinc/23/08/59/1048230859.db2.gz QDXITONPASADRR-UHFFFAOYSA-N 1 2 321.428 4.199 20 0 DIADLO Nc1ccc(Nc2cccc3cccc(Br)c32)c[nH+]1 ZINC001201299153 1048231943 /nfs/dbraw/zinc/23/19/43/1048231943.db2.gz DGDFTNCYZALIJN-UHFFFAOYSA-N 1 2 314.186 4.323 20 0 DIADLO Nc1ccc(Nc2cc(F)ccc2OC2CCCCC2)c[nH+]1 ZINC001201295898 1048232083 /nfs/dbraw/zinc/23/20/83/1048232083.db2.gz WQOPYUZJYFEUSH-UHFFFAOYSA-N 1 2 301.365 4.258 20 0 DIADLO Cc1ncc(CNc2cc[nH+]c(OCc3ccccc3)c2)s1 ZINC001162160144 1048233532 /nfs/dbraw/zinc/23/35/32/1048233532.db2.gz XKIGHHJDNZAWQM-UHFFFAOYSA-N 1 2 311.410 4.038 20 0 DIADLO Cc1ccc(C(=O)CC[N@H+]2C[C@@H](c3ccccc3)OC[C@H]2C)cc1 ZINC000480773495 1048242137 /nfs/dbraw/zinc/24/21/37/1048242137.db2.gz XPZOJSMSEZBKNC-UTKZUKDTSA-N 1 2 323.436 4.030 20 0 DIADLO Cc1ccc(C(=O)CC[N@@H+]2C[C@@H](c3ccccc3)OC[C@H]2C)cc1 ZINC000480773495 1048242148 /nfs/dbraw/zinc/24/21/48/1048242148.db2.gz XPZOJSMSEZBKNC-UTKZUKDTSA-N 1 2 323.436 4.030 20 0 DIADLO CC(C)OC(=O)c1ccc(Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC001175259522 1048241998 /nfs/dbraw/zinc/24/19/98/1048241998.db2.gz ONMZOCCPXPPLAG-UHFFFAOYSA-N 1 2 321.380 4.181 20 0 DIADLO CCC(CC)N(CC(C)C)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000554988372 1048243552 /nfs/dbraw/zinc/24/35/52/1048243552.db2.gz RGUGEGWGCOKEFM-UHFFFAOYSA-N 1 2 302.422 4.013 20 0 DIADLO Cc1cc(NCc2coc(-c3ccc(F)cc3)n2)nc(C2CC2)[nH+]1 ZINC001162213162 1048243554 /nfs/dbraw/zinc/24/35/54/1048243554.db2.gz VASOUISEWTYIMR-UHFFFAOYSA-N 1 2 324.359 4.069 20 0 DIADLO c1ccc(-c2[nH]c3ccc(NCCC4CCOCC4)cc3[nH+]2)cc1 ZINC001162222858 1048245641 /nfs/dbraw/zinc/24/56/41/1048245641.db2.gz SBOGQEUCEGCXAU-UHFFFAOYSA-N 1 2 321.424 4.459 20 0 DIADLO Cc1cc(C)nc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)c1 ZINC001175268634 1048246675 /nfs/dbraw/zinc/24/66/75/1048246675.db2.gz RYSMVMOVWQLBAG-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C)nc(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)c1 ZINC001175268634 1048246682 /nfs/dbraw/zinc/24/66/82/1048246682.db2.gz RYSMVMOVWQLBAG-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO CN(C)c1ccc(Nc2ccc(OC(F)F)c(Cl)c2)c[nH+]1 ZINC001175344105 1048249935 /nfs/dbraw/zinc/24/99/35/1048249935.db2.gz UNEFCGWCUMJARK-UHFFFAOYSA-N 1 2 313.735 4.146 20 0 DIADLO CN(C)c1ccc(Nc2ccc3c(c2)Cc2cc(N)ccc2-3)c[nH+]1 ZINC001175343357 1048250018 /nfs/dbraw/zinc/25/00/18/1048250018.db2.gz GOHNYQPIWLHXHY-UHFFFAOYSA-N 1 2 316.408 4.045 20 0 DIADLO CN(C)c1ccc(Nc2ccc(Oc3ccncc3)cc2)c[nH+]1 ZINC001175341812 1048250286 /nfs/dbraw/zinc/25/02/86/1048250286.db2.gz LRGLDUFKLSWVKU-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO CN(C)c1ccc(Nc2ccc(-c3cccc(O)c3)cc2)c[nH+]1 ZINC001175343575 1048250933 /nfs/dbraw/zinc/25/09/33/1048250933.db2.gz IXGJFCDOURJJKT-UHFFFAOYSA-N 1 2 305.381 4.264 20 0 DIADLO COC(OC)c1cc(C)c[nH+]c1NCC(C)(C)CC(F)(F)F ZINC001162249908 1048251733 /nfs/dbraw/zinc/25/17/33/1048251733.db2.gz WQZGTPSTAAAQGD-UHFFFAOYSA-N 1 2 320.355 4.072 20 0 DIADLO CC(C)(C)c1cc(Nc2ccc(N3CCCC3)[nH+]c2)sn1 ZINC001175347887 1048252010 /nfs/dbraw/zinc/25/20/10/1048252010.db2.gz VYCMANVHJZUJOM-UHFFFAOYSA-N 1 2 302.447 4.179 20 0 DIADLO Cc1cccc2c(C)cc(NCc3cc4ccccn4n3)[nH+]c12 ZINC001162283577 1048255511 /nfs/dbraw/zinc/25/55/11/1048255511.db2.gz DWEJQFPKTZPQKE-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO Cc1cc(NCc2cnccc2C(F)(F)F)ccc1[NH+](C)C ZINC001162293722 1048257443 /nfs/dbraw/zinc/25/74/43/1048257443.db2.gz VBMKWACOBWMSOX-UHFFFAOYSA-N 1 2 309.335 4.087 20 0 DIADLO Cc1cc(NCCC2CC(OC(C)(C)C)C2)nc(C2CCC2)[nH+]1 ZINC001186113043 1048264815 /nfs/dbraw/zinc/26/48/15/1048264815.db2.gz PRNOZAANJIAZLS-UHFFFAOYSA-N 1 2 317.477 4.448 20 0 DIADLO C[C@@]1(O)CC[C@@H](Nc2[nH+]ccc3cccc(C(F)(F)F)c32)CC1 ZINC001162354804 1048265843 /nfs/dbraw/zinc/26/58/43/1048265843.db2.gz OCTHMJWITFAOHQ-YGUOUDRMSA-N 1 2 324.346 4.359 20 0 DIADLO Nc1cccc(C(F)(F)F)c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175350388 1048270679 /nfs/dbraw/zinc/27/06/79/1048270679.db2.gz WZRLZNAVNYQOCM-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO Cc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1OC(F)F ZINC001175349595 1048272041 /nfs/dbraw/zinc/27/20/41/1048272041.db2.gz AEGWRDBRWBTWTC-UHFFFAOYSA-N 1 2 319.355 4.335 20 0 DIADLO CC(C)(C)c1ccc(N)c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175351498 1048272357 /nfs/dbraw/zinc/27/23/57/1048272357.db2.gz NXQLWSMXIUQOBW-UHFFFAOYSA-N 1 2 310.445 4.305 20 0 DIADLO Cc1nc(C[N@H+](C)CCSc2ccc(Cl)cc2)cs1 ZINC000065301529 1048287331 /nfs/dbraw/zinc/28/73/31/1048287331.db2.gz RJBVUFUGYOLIRD-UHFFFAOYSA-N 1 2 312.891 4.329 20 0 DIADLO C[C@@H]1c2ncc(COCC3CCCC3)n2CC[N@H+]1CC(C)(C)C ZINC001201435748 1048272865 /nfs/dbraw/zinc/27/28/65/1048272865.db2.gz WOOZHMIGXNVSAD-OAHLLOKOSA-N 1 2 319.493 4.013 20 0 DIADLO C[C@@H]1c2ncc(COCC3CCCC3)n2CC[N@@H+]1CC(C)(C)C ZINC001201435748 1048272877 /nfs/dbraw/zinc/27/28/77/1048272877.db2.gz WOOZHMIGXNVSAD-OAHLLOKOSA-N 1 2 319.493 4.013 20 0 DIADLO Cc1nc(C[N@@H+](C)CCSc2ccc(Cl)cc2)cs1 ZINC000065301529 1048287341 /nfs/dbraw/zinc/28/73/41/1048287341.db2.gz RJBVUFUGYOLIRD-UHFFFAOYSA-N 1 2 312.891 4.329 20 0 DIADLO Cc1cc(OC(F)F)ccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175352466 1048273211 /nfs/dbraw/zinc/27/32/11/1048273211.db2.gz PNCOOORZGYKBQO-UHFFFAOYSA-N 1 2 319.355 4.335 20 0 DIADLO Nc1cc(Nc2ccc(N3CCCC3)[nH+]c2)cc(C(F)(F)F)c1 ZINC001175353083 1048274039 /nfs/dbraw/zinc/27/40/39/1048274039.db2.gz YPQXLWLBVISRRJ-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO c1ccc(-c2cccnc2)c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175352975 1048274129 /nfs/dbraw/zinc/27/41/29/1048274129.db2.gz SQIVTWCOBURTIR-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Nc1cc(Cl)c(Cl)cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175352673 1048274189 /nfs/dbraw/zinc/27/41/89/1048274189.db2.gz ZTOICNQVZQCJGL-UHFFFAOYSA-N 1 2 323.227 4.314 20 0 DIADLO Fc1cc(Cl)cc(F)c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175352647 1048274239 /nfs/dbraw/zinc/27/42/39/1048274239.db2.gz YVKFHGINMDMRFG-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO Cc1nc(N[C@H]2CCOc3c(F)cc(F)cc32)cc(C(C)C)[nH+]1 ZINC001162399595 1048274989 /nfs/dbraw/zinc/27/49/89/1048274989.db2.gz IZTBEVKJDMACTK-AWEZNQCLSA-N 1 2 319.355 4.122 20 0 DIADLO Cc1nc(NCC(C)(C)c2ccc(F)cc2)c2c([nH+]1)CCCC2 ZINC001162430748 1048279495 /nfs/dbraw/zinc/27/94/95/1048279495.db2.gz JYRRLIDXKLABGX-UHFFFAOYSA-N 1 2 313.420 4.193 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(NCCCCCCC(=O)OC)c1 ZINC001162434435 1048280390 /nfs/dbraw/zinc/28/03/90/1048280390.db2.gz RIGSFJAJADBHEM-UHFFFAOYSA-N 1 2 320.477 4.377 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cnc3cc(C4CC4)nn3c2)cc1 ZINC001201491614 1048282224 /nfs/dbraw/zinc/28/22/24/1048282224.db2.gz QXROFPHMYDXPKQ-UHFFFAOYSA-N 1 2 307.401 4.171 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2ccc3nnc(C4CC4)n3c2)cc1 ZINC001201492232 1048282555 /nfs/dbraw/zinc/28/25/55/1048282555.db2.gz XNDYCFZLBOEAOE-UHFFFAOYSA-N 1 2 307.401 4.171 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2ccc3nnc(C(C)C)n3c2)cc1 ZINC001201490531 1048282774 /nfs/dbraw/zinc/28/27/74/1048282774.db2.gz GCVSFESUBNDSGF-UHFFFAOYSA-N 1 2 309.417 4.417 20 0 DIADLO c1cnc2ccc(Nc3ccc[nH+]c3N3CCCCC3)cc2c1 ZINC001175374961 1048285182 /nfs/dbraw/zinc/28/51/82/1048285182.db2.gz YCCREUKWWFPFAX-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO c1cnc2ccc(Nc3[nH+]cccc3N3CCCCC3)cc2c1 ZINC001175375643 1048286249 /nfs/dbraw/zinc/28/62/49/1048286249.db2.gz PWSPDPLUEWPMES-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO CCCCn1c(S[C@H](C)CCC)nnc1[C@@H](CC)[NH+](C)C ZINC000481049856 1048299696 /nfs/dbraw/zinc/29/96/96/1048299696.db2.gz AJXWLOCTNFCFNU-ZIAGYGMSSA-N 1 2 312.527 4.372 20 0 DIADLO C[C@@H](Nc1nc2ccccc2n2c[nH+]cc12)c1ccc(Cl)cn1 ZINC001186381014 1048299860 /nfs/dbraw/zinc/29/98/60/1048299860.db2.gz PRMXYRMGVCBFBO-LLVKDONJSA-N 1 2 323.787 4.104 20 0 DIADLO Cc1nc(N[C@H]2CCC[C@@H]2Cc2ccccc2)c2c([nH+]1)CCCC2 ZINC001162584981 1048308168 /nfs/dbraw/zinc/30/81/68/1048308168.db2.gz VSLKABRLJKSZJS-MJGOQNOKSA-N 1 2 321.468 4.487 20 0 DIADLO Cc1ccc2c(Nc3cc(F)cc(C(=O)N(C)C)c3)cccc2[nH+]1 ZINC001201527102 1048311052 /nfs/dbraw/zinc/31/10/52/1048311052.db2.gz VEVXYIKTTMNCHR-UHFFFAOYSA-N 1 2 323.371 4.128 20 0 DIADLO CCCC[C@H](CC)C[N@@H+]1Cc2cc(Br)cnc2C1 ZINC001201567988 1048321119 /nfs/dbraw/zinc/32/11/19/1048321119.db2.gz MKXWPXLEFHAKPF-LBPRGKRZSA-N 1 2 311.267 4.376 20 0 DIADLO CCCC[C@H](CC)C[N@H+]1Cc2cc(Br)cnc2C1 ZINC001201567988 1048321133 /nfs/dbraw/zinc/32/11/33/1048321133.db2.gz MKXWPXLEFHAKPF-LBPRGKRZSA-N 1 2 311.267 4.376 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@](F)(c3ccccc3)C2)sc1C ZINC001175492690 1048325959 /nfs/dbraw/zinc/32/59/59/1048325959.db2.gz QMKOZNXPPFHWPG-QGZVFWFLSA-N 1 2 304.434 4.221 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@](F)(c3ccccc3)C2)sc1C ZINC001175492690 1048325974 /nfs/dbraw/zinc/32/59/74/1048325974.db2.gz QMKOZNXPPFHWPG-QGZVFWFLSA-N 1 2 304.434 4.221 20 0 DIADLO CC(C)c1cc(NCCOCC2CCCC2)nc(C(C)C)[nH+]1 ZINC001186648359 1048328251 /nfs/dbraw/zinc/32/82/51/1048328251.db2.gz YOFONZURQHHCRR-UHFFFAOYSA-N 1 2 305.466 4.342 20 0 DIADLO CCSc1cc[nH+]c(NC[C@H](O)c2cc3ccccc3o2)c1 ZINC001162697889 1048336421 /nfs/dbraw/zinc/33/64/21/1048336421.db2.gz PNGWMTAGDQBFMY-AWEZNQCLSA-N 1 2 314.410 4.085 20 0 DIADLO CCSc1cc[nH+]c(NC[C@@H](O)c2cc3ccccc3o2)c1 ZINC001162697890 1048337023 /nfs/dbraw/zinc/33/70/23/1048337023.db2.gz PNGWMTAGDQBFMY-CQSZACIVSA-N 1 2 314.410 4.085 20 0 DIADLO Clc1ccccc1[C@@H]1COCC[N@@H+]1CCCc1ccccc1 ZINC001201671828 1048338403 /nfs/dbraw/zinc/33/84/03/1048338403.db2.gz OSGSDHAWWVVKRG-IBGZPJMESA-N 1 2 315.844 4.346 20 0 DIADLO Clc1ccccc1[C@@H]1COCC[N@H+]1CCCc1ccccc1 ZINC001201671828 1048338418 /nfs/dbraw/zinc/33/84/18/1048338418.db2.gz OSGSDHAWWVVKRG-IBGZPJMESA-N 1 2 315.844 4.346 20 0 DIADLO Cc1ccc(CC(C)(C)Nc2nc(C)[nH+]c3c2CCCC3)cc1 ZINC001186747551 1048338512 /nfs/dbraw/zinc/33/85/12/1048338512.db2.gz JRGMEZCHXGVMKM-UHFFFAOYSA-N 1 2 309.457 4.405 20 0 DIADLO Clc1ccccc1[C@H]1COCC[N@@H+]1CCCc1ccccc1 ZINC001201671829 1048339397 /nfs/dbraw/zinc/33/93/97/1048339397.db2.gz OSGSDHAWWVVKRG-LJQANCHMSA-N 1 2 315.844 4.346 20 0 DIADLO Clc1ccccc1[C@H]1COCC[N@H+]1CCCc1ccccc1 ZINC001201671829 1048339413 /nfs/dbraw/zinc/33/94/13/1048339413.db2.gz OSGSDHAWWVVKRG-LJQANCHMSA-N 1 2 315.844 4.346 20 0 DIADLO Cc1csc([C@H]2COCC[N@H+]2C[C@H](C)C2CCCCC2)n1 ZINC000555427950 1048345577 /nfs/dbraw/zinc/34/55/77/1048345577.db2.gz XGHKABMBXCZODS-XJKSGUPXSA-N 1 2 308.491 4.041 20 0 DIADLO Cc1csc([C@H]2COCC[N@@H+]2C[C@H](C)C2CCCCC2)n1 ZINC000555427950 1048345593 /nfs/dbraw/zinc/34/55/93/1048345593.db2.gz XGHKABMBXCZODS-XJKSGUPXSA-N 1 2 308.491 4.041 20 0 DIADLO Cn1c(CNc2cc3cc(F)ccc3c[nH+]2)ccc1C(F)(F)F ZINC001162752340 1048347956 /nfs/dbraw/zinc/34/79/56/1048347956.db2.gz PRXSOVIWTIMDKB-UHFFFAOYSA-N 1 2 323.293 4.343 20 0 DIADLO Cc1cc([NH2+]C[C@H](C)c2ccccc2)ccc1N1CCOCC1 ZINC000775053612 1048348384 /nfs/dbraw/zinc/34/83/84/1048348384.db2.gz HQJPNMJFSRRWNO-KRWDZBQOSA-N 1 2 310.441 4.047 20 0 DIADLO CCC1(C(=O)Nc2ccc3[nH+]c(C)cn3c2)CCC(F)(F)CC1 ZINC000667861073 1048356287 /nfs/dbraw/zinc/35/62/87/1048356287.db2.gz GINNQKYFHSYAQM-UHFFFAOYSA-N 1 2 321.371 4.187 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1ccccc1OC ZINC000775082393 1048369256 /nfs/dbraw/zinc/36/92/56/1048369256.db2.gz XVMRVUVBJHFIHH-AWEZNQCLSA-N 1 2 314.360 4.216 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2nc(F)cc(C(F)(F)F)c2F)c1 ZINC001203654317 1048371533 /nfs/dbraw/zinc/37/15/33/1048371533.db2.gz HBBQCQOTQZJTOE-UHFFFAOYSA-N 1 2 303.234 4.134 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cnc(Cl)c(Br)c2)c1 ZINC001203654974 1048377916 /nfs/dbraw/zinc/37/79/16/1048377916.db2.gz VVCGEHGABOVTHO-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1nc(N2CCC[C@H](c3ccc(F)c(F)c3)C2)c(C)c(C)[nH+]1 ZINC001187130117 1048377837 /nfs/dbraw/zinc/37/78/37/1048377837.db2.gz HLATYSZGIVXRDQ-HNNXBMFYSA-N 1 2 317.383 4.064 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(Br)nc2Cl)c1 ZINC001203655237 1048382259 /nfs/dbraw/zinc/38/22/59/1048382259.db2.gz ZBDJJDYHRLSEIP-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO CCc1cc(Br)ncc1Nc1cc(C)c[nH+]c1C ZINC001203656892 1048384563 /nfs/dbraw/zinc/38/45/63/1048384563.db2.gz BQYGNQKETJHKKN-UHFFFAOYSA-N 1 2 306.207 4.162 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cncc(OCc3ccccc3)c2)c1 ZINC001203657280 1048386090 /nfs/dbraw/zinc/38/60/90/1048386090.db2.gz KTTLJZFAZRZVKL-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO Cc1cc(N[C@H]2CCc3c2c(F)ccc3F)nc(C(C)C)[nH+]1 ZINC001162937992 1048391557 /nfs/dbraw/zinc/39/15/57/1048391557.db2.gz HFSSQFRURNCOGR-AWEZNQCLSA-N 1 2 303.356 4.286 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc(C(=O)NC4CC4)cc3)ccc12 ZINC001175607625 1048391798 /nfs/dbraw/zinc/39/17/98/1048391798.db2.gz NDBUPQLXMAGSCT-UHFFFAOYSA-N 1 2 317.392 4.179 20 0 DIADLO CSCc1cc[nH+]c(N[C@@H]2CCc3c2c(F)ccc3F)c1 ZINC001162938292 1048392179 /nfs/dbraw/zinc/39/21/79/1048392179.db2.gz LQMUAGXLVDJNRM-CQSZACIVSA-N 1 2 306.381 4.322 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@H](c3ccc(F)cc3)CC2)no1 ZINC000481404341 1048392613 /nfs/dbraw/zinc/39/26/13/1048392613.db2.gz HQBCRRDRAORWCZ-AWEZNQCLSA-N 1 2 317.408 4.102 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@H](c3ccc(F)cc3)CC2)no1 ZINC000481404341 1048392626 /nfs/dbraw/zinc/39/26/26/1048392626.db2.gz HQBCRRDRAORWCZ-AWEZNQCLSA-N 1 2 317.408 4.102 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(Nc3ccc(F)c(C(F)F)c3)c12 ZINC001187380436 1048394039 /nfs/dbraw/zinc/39/40/39/1048394039.db2.gz OYYZWDBWMWTDOD-UHFFFAOYSA-N 1 2 306.291 4.341 20 0 DIADLO CCC(CC)[C@@H]1C[C@H](Nc2cc(C)[nH+]c(C3CCC3)n2)CCO1 ZINC001162942220 1048394193 /nfs/dbraw/zinc/39/41/93/1048394193.db2.gz CKXXCMXKCUHJSC-SJORKVTESA-N 1 2 317.477 4.448 20 0 DIADLO Cc1nc(N[C@@H](C)c2cc(Cl)ccc2OC(F)F)cc[nH+]1 ZINC001162972788 1048397193 /nfs/dbraw/zinc/39/71/93/1048397193.db2.gz OLILTKXAKNUUIW-QMMMGPOBSA-N 1 2 313.735 4.213 20 0 DIADLO CC(C)c1cc(NC[C@@H]2CCC3(CCC3)O2)nc(C(C)C)[nH+]1 ZINC001187430798 1048399965 /nfs/dbraw/zinc/39/99/65/1048399965.db2.gz PRLPAGDLXKAFBN-AWEZNQCLSA-N 1 2 303.450 4.237 20 0 DIADLO CCOC(=O)c1ccc(Nc2cc(C)c[nH+]c2C)cc1Cl ZINC001203663909 1048407202 /nfs/dbraw/zinc/40/72/02/1048407202.db2.gz YPEBPJAMMCLSFD-UHFFFAOYSA-N 1 2 304.777 4.272 20 0 DIADLO Fc1ccc2oc(C[NH2+][C@@H]3COc4cc(F)cc(F)c43)cc2c1 ZINC001201963954 1048413620 /nfs/dbraw/zinc/41/36/20/1048413620.db2.gz YKLWYGILJDSCQR-CQSZACIVSA-N 1 2 319.282 4.073 20 0 DIADLO CCc1ccccc1NC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC001187604931 1048414877 /nfs/dbraw/zinc/41/48/77/1048414877.db2.gz IMRCIWZSERCKLY-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO Cc1cc(NCCOc2cccc3ccoc32)nc(C(C)C)[nH+]1 ZINC001163078262 1048415536 /nfs/dbraw/zinc/41/55/36/1048415536.db2.gz YSEDXIVICCGKDZ-UHFFFAOYSA-N 1 2 311.385 4.146 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H]2CCOc3ccc(F)cc32)s1 ZINC001202009889 1048416835 /nfs/dbraw/zinc/41/68/35/1048416835.db2.gz LRUOLRVLRFQJGQ-ZDUSSCGKSA-N 1 2 306.406 4.019 20 0 DIADLO Cc1nc(NC2(Cc3ccccc3)CCC2)c2c([nH+]1)CCCC2 ZINC001163112826 1048417474 /nfs/dbraw/zinc/41/74/74/1048417474.db2.gz MGPFVSVMGXVNJQ-UHFFFAOYSA-N 1 2 307.441 4.241 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@H](c2ccccc2)c2cccnn2)[nH+]1 ZINC001163105992 1048417759 /nfs/dbraw/zinc/41/77/59/1048417759.db2.gz XWSCFKLQWVLSBK-QGZVFWFLSA-N 1 2 324.815 4.343 20 0 DIADLO Cc1nc2ccc(Nc3c[nH+]c(N)cc3C(F)(F)F)cc2s1 ZINC001175712866 1048418779 /nfs/dbraw/zinc/41/87/79/1048418779.db2.gz KKRIVBDXCDLJLB-UHFFFAOYSA-N 1 2 324.331 4.344 20 0 DIADLO Clc1ccc2ccnc(NCc3ccc4[nH+]ccn4c3)c2c1 ZINC001163136201 1048418901 /nfs/dbraw/zinc/41/89/01/1048418901.db2.gz BNDXEXXECCPQSN-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1cnc(N)cc1C(F)(F)F ZINC001175713028 1048419268 /nfs/dbraw/zinc/41/92/68/1048419268.db2.gz YEAQQOQHJUARDM-UHFFFAOYSA-N 1 2 310.323 4.253 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccccc2C(F)(F)F)c[nH+]1 ZINC001175712796 1048419579 /nfs/dbraw/zinc/41/95/79/1048419579.db2.gz RSTAOGDABCKTCJ-UHFFFAOYSA-N 1 2 321.224 4.445 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(F)c(Cl)c2)c[nH+]1 ZINC001175712426 1048419708 /nfs/dbraw/zinc/41/97/08/1048419708.db2.gz AOGDCFFOYVGORA-UHFFFAOYSA-N 1 2 305.662 4.219 20 0 DIADLO Cc1ccc2cccnc2c1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175713274 1048421040 /nfs/dbraw/zinc/42/10/40/1048421040.db2.gz ZZZIONUJEFWFPV-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO CC(C)c1nc(NCc2ccc3[nH+]ccn3c2)cc(C(C)(C)C)n1 ZINC001163140843 1048421191 /nfs/dbraw/zinc/42/11/91/1048421191.db2.gz NOYIIAXWYFTFQC-UHFFFAOYSA-N 1 2 323.444 4.157 20 0 DIADLO c1cn2cc(CNc3cc(-c4ccccc4)ccn3)ccc2[nH+]1 ZINC001163136417 1048421500 /nfs/dbraw/zinc/42/15/00/1048421500.db2.gz GMYBCNWPDQKZAG-UHFFFAOYSA-N 1 2 300.365 4.008 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc(F)cc(F)c2Cl)c[nH+]1 ZINC001175713564 1048421443 /nfs/dbraw/zinc/42/14/43/1048421443.db2.gz DOGDLOIORMLZGH-UHFFFAOYSA-N 1 2 323.652 4.358 20 0 DIADLO Cc1cc(F)c(Nc2c[nH+]c(N)cc2C(F)(F)F)cc1F ZINC001175713488 1048421519 /nfs/dbraw/zinc/42/15/19/1048421519.db2.gz AQHGTQKLXKNDSJ-UHFFFAOYSA-N 1 2 303.234 4.013 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc3cc(O)ccc32)c[nH+]1 ZINC001175715549 1048421760 /nfs/dbraw/zinc/42/17/60/1048421760.db2.gz OKAJQWOQEKLJTK-UHFFFAOYSA-N 1 2 319.286 4.285 20 0 DIADLO CC(C)(C)c1ccc(N)c(Nc2c[nH+]c(N)cc2C(F)(F)F)c1 ZINC001175714857 1048421771 /nfs/dbraw/zinc/42/17/71/1048421771.db2.gz WTPUHLKHCJSFTO-UHFFFAOYSA-N 1 2 324.350 4.306 20 0 DIADLO Cc1cc(NC(C)(C)c2cc(Cl)ccn2)nc(C(C)(C)C)[nH+]1 ZINC001163144810 1048422743 /nfs/dbraw/zinc/42/27/43/1048422743.db2.gz NYOVPAQSMYKIHA-UHFFFAOYSA-N 1 2 318.852 4.478 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc3ncsc32)c[nH+]1 ZINC001175717962 1048422729 /nfs/dbraw/zinc/42/27/29/1048422729.db2.gz ZLPNFJMISQFWGJ-UHFFFAOYSA-N 1 2 310.304 4.036 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(F)c(Cl)c2F)c[nH+]1 ZINC001175717879 1048423077 /nfs/dbraw/zinc/42/30/77/1048423077.db2.gz VKSFKGHQSPDNLI-UHFFFAOYSA-N 1 2 323.652 4.358 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc3ccccc3cc2O)c[nH+]1 ZINC001175717894 1048423595 /nfs/dbraw/zinc/42/35/95/1048423595.db2.gz WEILQGFOLSTYQK-UHFFFAOYSA-N 1 2 319.286 4.285 20 0 DIADLO Cc1cc(N[C@H](C)COCC2CCCCC2)nc(C2CCC2)[nH+]1 ZINC001187677883 1048424137 /nfs/dbraw/zinc/42/41/37/1048424137.db2.gz PMESRWPDHYIPBM-OAHLLOKOSA-N 1 2 317.477 4.450 20 0 DIADLO CCc1cc(N2CCC[C@@H]2[C@H](C)c2ccccc2)nc(CC)[nH+]1 ZINC001187686084 1048425550 /nfs/dbraw/zinc/42/55/50/1048425550.db2.gz JACYIHIUHSURLF-CRAIPNDOSA-N 1 2 309.457 4.374 20 0 DIADLO Fc1cccc(C[N@@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)c1 ZINC000555739645 1048430703 /nfs/dbraw/zinc/43/07/03/1048430703.db2.gz FPMBLWOLECWSTB-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1cccc(C[N@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)c1 ZINC000555739645 1048430711 /nfs/dbraw/zinc/43/07/11/1048430711.db2.gz FPMBLWOLECWSTB-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO CCOC(=O)Cc1ccc(Cl)c(Nc2cc(C)c[nH+]c2C)c1 ZINC001203668216 1048435943 /nfs/dbraw/zinc/43/59/43/1048435943.db2.gz CGXJUZCQJFYCNX-UHFFFAOYSA-N 1 2 318.804 4.201 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc(C3CCCC3)no2)c[nH+]1 ZINC001175710205 1048437707 /nfs/dbraw/zinc/43/77/07/1048437707.db2.gz YPILTSKEFOONCU-UHFFFAOYSA-N 1 2 312.295 4.072 20 0 DIADLO CCC[C@@H](C)c1cc(Nc2c[nH+]c(N)cc2C(F)(F)F)on1 ZINC001175709411 1048437722 /nfs/dbraw/zinc/43/77/22/1048437722.db2.gz AEDMAQLRLVCNNC-MRVPVSSYSA-N 1 2 314.311 4.318 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cnc3cc(F)ccc3c2)c[nH+]1 ZINC001175710942 1048438037 /nfs/dbraw/zinc/43/80/37/1048438037.db2.gz PATJKRGYRBRHMR-UHFFFAOYSA-N 1 2 322.265 4.114 20 0 DIADLO CCOc1ccc[nH+]c1NCCC(C(F)(F)F)C(F)(F)F ZINC001163235991 1048443447 /nfs/dbraw/zinc/44/34/47/1048443447.db2.gz DOIJQQOFRCSOAS-UHFFFAOYSA-N 1 2 316.245 4.023 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc3c(c2)C(C)(C)CC(=O)N3C)c1 ZINC001203669095 1048446536 /nfs/dbraw/zinc/44/65/36/1048446536.db2.gz MSEIBRFSSZOKPR-UHFFFAOYSA-N 1 2 309.413 4.086 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)Nc1c(Cl)cccc1Cl ZINC001202093735 1048449079 /nfs/dbraw/zinc/44/90/79/1048449079.db2.gz FLMMZGMNTWWUQN-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO c1nn(-c2ccccc2)cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001175790668 1048453621 /nfs/dbraw/zinc/45/36/21/1048453621.db2.gz DOOLVWZVFFEQAC-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO Cc1ccc2c(Nc3ccc4c(c3)OCCN4C)cccc2[nH+]1 ZINC001213045776 1048460985 /nfs/dbraw/zinc/46/09/85/1048460985.db2.gz YVRNYHZHMLPLHW-UHFFFAOYSA-N 1 2 305.381 4.115 20 0 DIADLO Clc1cc(Nc2cnn(C3CCCCC3)c2)cn2cc[nH+]c12 ZINC001175878356 1048469575 /nfs/dbraw/zinc/46/95/75/1048469575.db2.gz KCDGESVILQETCR-UHFFFAOYSA-N 1 2 315.808 4.433 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000481770597 1048483086 /nfs/dbraw/zinc/48/30/86/1048483086.db2.gz YEWWGZIDNMZZNQ-XJKSGUPXSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000481770597 1048483089 /nfs/dbraw/zinc/48/30/89/1048483089.db2.gz YEWWGZIDNMZZNQ-XJKSGUPXSA-N 1 2 323.362 4.035 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@@H](C(F)(F)F)CC1 ZINC001175873071 1048487258 /nfs/dbraw/zinc/48/72/58/1048487258.db2.gz MCNVJDSYTZHWQQ-ZIAGYGMSSA-N 1 2 323.305 4.069 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@H+]1CCO[C@@H](C(F)(F)F)CC1 ZINC001175873071 1048487265 /nfs/dbraw/zinc/48/72/65/1048487265.db2.gz MCNVJDSYTZHWQQ-ZIAGYGMSSA-N 1 2 323.305 4.069 20 0 DIADLO Cc1nc(N[C@@H](C)C2CCC(F)(F)CC2)c2c([nH+]1)CCCC2 ZINC001163618751 1048494394 /nfs/dbraw/zinc/49/43/94/1048494394.db2.gz WSLUHXZUHFSLHI-NSHDSACASA-N 1 2 309.404 4.290 20 0 DIADLO O=C(Nc1cccc(Cl)c1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001202247915 1048504599 /nfs/dbraw/zinc/50/45/99/1048504599.db2.gz ROJCJDFUWKKKCQ-UHFFFAOYSA-N 1 2 312.760 4.170 20 0 DIADLO Fc1ccc(CNc2[nH+]c3ccccc3n2-c2ccccc2)cn1 ZINC000775177340 1048521384 /nfs/dbraw/zinc/52/13/84/1048521384.db2.gz RJJAIFXZZSPJST-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO CCSc1cc[nH+]c(N2CC[C@H](c3ccccc3OC)C2)c1 ZINC001163810503 1048528201 /nfs/dbraw/zinc/52/82/01/1048528201.db2.gz ZHVQYBYGIDNMKA-AWEZNQCLSA-N 1 2 314.454 4.196 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)Nc1ccc2ccccc2c1 ZINC001188589781 1048531896 /nfs/dbraw/zinc/53/18/96/1048531896.db2.gz MUUBJCGKHJQACL-UHFFFAOYSA-N 1 2 302.337 4.132 20 0 DIADLO FC(F)Oc1ccccc1Nc1ccccc1-n1cc[nH+]c1 ZINC001176011673 1048534261 /nfs/dbraw/zinc/53/42/61/1048534261.db2.gz NPXOHNVWZYBIOD-UHFFFAOYSA-N 1 2 301.296 4.217 20 0 DIADLO CCc1cc(Cl)nnc1NC(=[NH2+])C12CC3CC(CC(C3)C1)C2 ZINC001163841541 1048536461 /nfs/dbraw/zinc/53/64/61/1048536461.db2.gz PNIVFUVPUOZTCS-UHFFFAOYSA-N 1 2 318.852 4.298 20 0 DIADLO c1ccc(-c2ccc(Nc3ccc[nH+]c3N3CCCC3)cc2)nc1 ZINC001176037754 1048539224 /nfs/dbraw/zinc/53/92/24/1048539224.db2.gz WNQIRCKESFZWNG-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Cc1cc(NCc2cc3ccccc3n2C)cc(OC(F)F)[nH+]1 ZINC001163950151 1048555159 /nfs/dbraw/zinc/55/51/59/1048555159.db2.gz HPTZVWBKIAEYKN-UHFFFAOYSA-N 1 2 317.339 4.095 20 0 DIADLO COc1cccc2[nH]c(Nc3cc(Cl)c4[nH+]ccn4c3)cc21 ZINC001176061722 1048556403 /nfs/dbraw/zinc/55/64/03/1048556403.db2.gz NHIRRNLBYABLHG-UHFFFAOYSA-N 1 2 312.760 4.221 20 0 DIADLO COc1cccc2[nH]c(Nc3ccc(-n4cc[nH+]c4)cc3)cc21 ZINC001176062349 1048557711 /nfs/dbraw/zinc/55/77/11/1048557711.db2.gz UNARHEJVLYHEKS-UHFFFAOYSA-N 1 2 304.353 4.106 20 0 DIADLO CC(C)(C)C(=O)CNc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1 ZINC001164005294 1048566702 /nfs/dbraw/zinc/56/67/02/1048566702.db2.gz QXDOTQGONQMPIK-UHFFFAOYSA-N 1 2 307.397 4.257 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(-c2ccccc2)nn1C1CCC1 ZINC001176119661 1048573292 /nfs/dbraw/zinc/57/32/92/1048573292.db2.gz YCSVCTLGSLUCKY-UHFFFAOYSA-N 1 2 320.396 4.422 20 0 DIADLO COc1cc[nH+]cc1Nc1cnc2ccccc2c1C(F)(F)F ZINC001176119605 1048573878 /nfs/dbraw/zinc/57/38/78/1048573878.db2.gz VYQFFMHQNFKTKY-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO F[C@H]1CCCN(c2[nH+]ccc3cc(Cl)ccc32)CC1(F)F ZINC001164059366 1048574182 /nfs/dbraw/zinc/57/41/82/1048574182.db2.gz GTCDZEDHMLFBCU-ZDUSSCGKSA-N 1 2 314.738 4.462 20 0 DIADLO COc1cc[nH+]cc1Nc1ccn2cc(-c3ccccc3)nc2c1 ZINC001176120912 1048575194 /nfs/dbraw/zinc/57/51/94/1048575194.db2.gz AWLWSVVYRBFNGG-UHFFFAOYSA-N 1 2 316.364 4.149 20 0 DIADLO COc1cc[nH+]cc1Nc1cccc2c(Cl)ncc(F)c12 ZINC001176124608 1048576054 /nfs/dbraw/zinc/57/60/54/1048576054.db2.gz RXWXYMPQMUSSRC-UHFFFAOYSA-N 1 2 303.724 4.175 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(-c2nc3ncccc3o2)cc1 ZINC001176124381 1048576076 /nfs/dbraw/zinc/57/60/76/1048576076.db2.gz LUFODAVFPXRWKZ-UHFFFAOYSA-N 1 2 318.336 4.037 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(OC(F)(F)Cl)cc1 ZINC001176125277 1048576240 /nfs/dbraw/zinc/57/62/40/1048576240.db2.gz XVDFMNXTGWQQMY-UHFFFAOYSA-N 1 2 300.692 4.002 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(OC(F)F)c(Cl)c1 ZINC001176121526 1048576787 /nfs/dbraw/zinc/57/67/87/1048576787.db2.gz WVZPFNIYFCCZJY-UHFFFAOYSA-N 1 2 300.692 4.089 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(F)c(C(F)(F)F)c(F)c1 ZINC001176124029 1048577114 /nfs/dbraw/zinc/57/71/14/1048577114.db2.gz MTOHTZIGBJVLDT-UHFFFAOYSA-N 1 2 304.218 4.131 20 0 DIADLO CCc1cc(N(C)[C@H](C)c2ccc(Cl)cc2)nc(CC)[nH+]1 ZINC001164086626 1048580894 /nfs/dbraw/zinc/58/08/94/1048580894.db2.gz ZXROCFXWCNMDSO-GFCCVEGCSA-N 1 2 303.837 4.452 20 0 DIADLO Cc1cccc2c(C)cc(N3CC[C@@H](CF)C(F)(F)C3)[nH+]c12 ZINC001164093068 1048581505 /nfs/dbraw/zinc/58/15/05/1048581505.db2.gz XXVDUTCKGQBSBC-ZDUSSCGKSA-N 1 2 308.347 4.283 20 0 DIADLO CC(C)C[C@@H](C(=O)N1CCC[C@H]1CC1CCCC1)n1cc[nH+]c1 ZINC001164104817 1048583414 /nfs/dbraw/zinc/58/34/14/1048583414.db2.gz KHXCTBWMLWEJMK-ROUUACIJSA-N 1 2 317.477 4.042 20 0 DIADLO COc1cc2cc[nH+]c(N3CC[C@@H](C)C(F)(F)CC3)c2cc1F ZINC001164118803 1048587872 /nfs/dbraw/zinc/58/78/72/1048587872.db2.gz ZVZKZVQCLYTTER-LLVKDONJSA-N 1 2 324.346 4.254 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3CC[C@@H]4C[C@@H]4CC3)cc2)[nH+]c1C ZINC001176219705 1048607261 /nfs/dbraw/zinc/60/72/61/1048607261.db2.gz NCMHSOWHWHQVHH-BJWYYQGGSA-N 1 2 323.440 4.458 20 0 DIADLO Fc1ccc2c[nH+]c(NCCSCc3ccco3)cc2c1 ZINC001164220109 1048608895 /nfs/dbraw/zinc/60/88/95/1048608895.db2.gz FNDJUYKKWKXJAM-UHFFFAOYSA-N 1 2 302.374 4.312 20 0 DIADLO Cc1cc(N2CC[C@@](CF)(C(F)(F)F)C2)[nH+]c2ccccc12 ZINC001164266675 1048615493 /nfs/dbraw/zinc/61/54/93/1048615493.db2.gz OKVMHJNEBRMRSD-HNNXBMFYSA-N 1 2 312.310 4.272 20 0 DIADLO CC(C)(C)c1ccc(N2CC[C@](CF)(C(F)(F)F)C2)[nH+]c1 ZINC001164271578 1048615617 /nfs/dbraw/zinc/61/56/17/1048615617.db2.gz DAZRTQQRBFNSLC-CQSZACIVSA-N 1 2 304.331 4.107 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)s1 ZINC000482500655 1048618881 /nfs/dbraw/zinc/61/88/81/1048618881.db2.gz AZYBLAHBIMENDQ-GHMZBOCLSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)s1 ZINC000482500655 1048618889 /nfs/dbraw/zinc/61/88/89/1048618889.db2.gz AZYBLAHBIMENDQ-GHMZBOCLSA-N 1 2 306.397 4.429 20 0 DIADLO CCCOc1ccc(NCc2[nH]c(C)c(C)[nH+]2)cc1OCCC ZINC000850201450 1048622110 /nfs/dbraw/zinc/62/21/10/1048622110.db2.gz QQIQEBVOZPKOHC-UHFFFAOYSA-N 1 2 317.433 4.216 20 0 DIADLO Cc1cnccc1SCc1c[nH+]c(N(C)C)c2ccccc12 ZINC001189392056 1048624224 /nfs/dbraw/zinc/62/42/24/1048624224.db2.gz WUFODWYOGXULOU-UHFFFAOYSA-N 1 2 309.438 4.297 20 0 DIADLO Cc1ccn2cc(C[NH2+][C@H](C)c3ccc(F)cc3Cl)nc2c1 ZINC000482513772 1048625825 /nfs/dbraw/zinc/62/58/25/1048625825.db2.gz SUENREKETUORBU-GFCCVEGCSA-N 1 2 317.795 4.286 20 0 DIADLO CCc1ccc(C[N@H+](Cc2ccccc2)Cc2ccccn2)o1 ZINC001204389904 1048626840 /nfs/dbraw/zinc/62/68/40/1048626840.db2.gz YUKKCIIKAWQFDL-UHFFFAOYSA-N 1 2 306.409 4.439 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)o1 ZINC001204389904 1048626846 /nfs/dbraw/zinc/62/68/46/1048626846.db2.gz YUKKCIIKAWQFDL-UHFFFAOYSA-N 1 2 306.409 4.439 20 0 DIADLO Cc1[nH]c(CNc2cc(Cl)ccc2OCC2CCC2)[nH+]c1C ZINC000850270033 1048628259 /nfs/dbraw/zinc/62/82/59/1048628259.db2.gz FWPTWAWQZAAUDW-UHFFFAOYSA-N 1 2 319.836 4.471 20 0 DIADLO Cc1[nH]c(CNc2ccc(OCCC(C)C)cc2F)[nH+]c1C ZINC000850339554 1048634928 /nfs/dbraw/zinc/63/49/28/1048634928.db2.gz OYZLCXAKZGRPKV-UHFFFAOYSA-N 1 2 305.397 4.203 20 0 DIADLO Fc1cc(F)c(Nc2cccc(-n3cc[nH+]c3)c2)c(F)c1F ZINC001176348921 1048635730 /nfs/dbraw/zinc/63/57/30/1048635730.db2.gz NIHHMDNUBJOWKJ-UHFFFAOYSA-N 1 2 307.250 4.172 20 0 DIADLO COc1cc(Cl)cc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001176344681 1048635787 /nfs/dbraw/zinc/63/57/87/1048635787.db2.gz PPRWRLAYZJDWFK-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO CC(C)(C)c1ccccc1NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001189563626 1048637879 /nfs/dbraw/zinc/63/78/79/1048637879.db2.gz JBYGUXUWHMLMQQ-UHFFFAOYSA-N 1 2 308.385 4.276 20 0 DIADLO c1cn2cccc(Nc3ccc(OCc4ccccc4)nc3)c2[nH+]1 ZINC001176299970 1048639355 /nfs/dbraw/zinc/63/93/55/1048639355.db2.gz DCEMORQBTXQYDB-UHFFFAOYSA-N 1 2 316.364 4.052 20 0 DIADLO Cc1ccc(Nc2cccc(-c3nc(CO)cs3)c2)c(C)[nH+]1 ZINC001203381394 1048650645 /nfs/dbraw/zinc/65/06/45/1048650645.db2.gz WLZLNQGZAUGZSB-UHFFFAOYSA-N 1 2 311.410 4.058 20 0 DIADLO CC(=O)OCc1cccc(Cl)c1Nc1c[nH+]c(C)cc1C ZINC001212774890 1048657992 /nfs/dbraw/zinc/65/79/92/1048657992.db2.gz GTPPDVJLQGBXLW-UHFFFAOYSA-N 1 2 304.777 4.159 20 0 DIADLO CCc1cccc(CC)c1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001189747618 1048658587 /nfs/dbraw/zinc/65/85/87/1048658587.db2.gz WJFMQPSABPNSER-UHFFFAOYSA-N 1 2 308.385 4.103 20 0 DIADLO CCc1ccc(C[N@H+](Cc2cc(C)no2)Cc2ccccc2)o1 ZINC001204395541 1048665233 /nfs/dbraw/zinc/66/52/33/1048665233.db2.gz SVCGPBJRQUYMNX-UHFFFAOYSA-N 1 2 310.397 4.341 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2cc(C)no2)Cc2ccccc2)o1 ZINC001204395541 1048665245 /nfs/dbraw/zinc/66/52/45/1048665245.db2.gz SVCGPBJRQUYMNX-UHFFFAOYSA-N 1 2 310.397 4.341 20 0 DIADLO c1[nH+]c2cc(NC[C@@H]3CCCCO3)ccc2n1-c1ccccc1 ZINC001165229720 1048668035 /nfs/dbraw/zinc/66/80/35/1048668035.db2.gz LCCWLEBLSNLPOX-KRWDZBQOSA-N 1 2 307.397 4.007 20 0 DIADLO CN(Cc1ncccc1C(F)(F)F)c1ccc(C(C)(C)C)c[nH+]1 ZINC001165225226 1048668843 /nfs/dbraw/zinc/66/88/43/1048668843.db2.gz PSAAURMDWBGRBV-UHFFFAOYSA-N 1 2 323.362 4.429 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cc(F)cc(N4CCCC4)c3)ccc21 ZINC001176421477 1048684528 /nfs/dbraw/zinc/68/45/28/1048684528.db2.gz RTDCCTMNCOQRKD-UHFFFAOYSA-N 1 2 310.376 4.056 20 0 DIADLO Cc1cc([C@@H]2CCCC[N@@H+]2CCCc2c(F)cccc2F)n[nH]1 ZINC001176485501 1048695096 /nfs/dbraw/zinc/69/50/96/1048695096.db2.gz PAUQIUGDGXVAHL-SFHVURJKSA-N 1 2 319.399 4.156 20 0 DIADLO Cc1cc([C@@H]2CCCC[N@H+]2CCCc2c(F)cccc2F)n[nH]1 ZINC001176485501 1048695099 /nfs/dbraw/zinc/69/50/99/1048695099.db2.gz PAUQIUGDGXVAHL-SFHVURJKSA-N 1 2 319.399 4.156 20 0 DIADLO c1cn(-c2ccc(Nc3cccc(OCC4CC4)c3)cc2)c[nH+]1 ZINC001176491797 1048696421 /nfs/dbraw/zinc/69/64/21/1048696421.db2.gz NXXWHYHHMIVACE-UHFFFAOYSA-N 1 2 305.381 4.405 20 0 DIADLO O=C(c1cccc(C[N@H+](Cc2ccoc2)C2CC2)c1)C(F)(F)F ZINC001176505506 1048702442 /nfs/dbraw/zinc/70/24/42/1048702442.db2.gz NWCFUVCIUUELMQ-UHFFFAOYSA-N 1 2 323.314 4.189 20 0 DIADLO O=C(c1cccc(C[N@@H+](Cc2ccoc2)C2CC2)c1)C(F)(F)F ZINC001176505506 1048702455 /nfs/dbraw/zinc/70/24/55/1048702455.db2.gz NWCFUVCIUUELMQ-UHFFFAOYSA-N 1 2 323.314 4.189 20 0 DIADLO CN(C)c1[nH+]cc(COc2cc(F)ccc2F)c2ccccc21 ZINC001165663928 1048705356 /nfs/dbraw/zinc/70/53/56/1048705356.db2.gz NKXQATAFRYTQOC-UHFFFAOYSA-N 1 2 314.335 4.158 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000482939163 1048706888 /nfs/dbraw/zinc/70/68/88/1048706888.db2.gz XDVLVKGOKPDLIK-IBGZPJMESA-N 1 2 309.409 4.235 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000482939163 1048706898 /nfs/dbraw/zinc/70/68/98/1048706898.db2.gz XDVLVKGOKPDLIK-IBGZPJMESA-N 1 2 309.409 4.235 20 0 DIADLO Fc1cccc(-c2cnc(C[N@@H+]3CC[C@H]3c3ccccc3)o2)c1 ZINC000482949787 1048706960 /nfs/dbraw/zinc/70/69/60/1048706960.db2.gz RREBZUDMADFUFW-KRWDZBQOSA-N 1 2 308.356 4.428 20 0 DIADLO Fc1cccc(-c2cnc(C[N@H+]3CC[C@H]3c3ccccc3)o2)c1 ZINC000482949787 1048706975 /nfs/dbraw/zinc/70/69/75/1048706975.db2.gz RREBZUDMADFUFW-KRWDZBQOSA-N 1 2 308.356 4.428 20 0 DIADLO Oc1cc(Cl)cnc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203717688 1048712915 /nfs/dbraw/zinc/71/29/15/1048712915.db2.gz LKOHIPOFNPWKIN-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO C[C@H]([NH2+]Cc1nc2c(s1)CCCC2)c1cccc(F)c1F ZINC000776492250 1048715848 /nfs/dbraw/zinc/71/58/48/1048715848.db2.gz UMQBAZPJZRQFIT-JTQLQIEISA-N 1 2 308.397 4.151 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@H]3CCCSCC3)cc2)c1C ZINC000668183974 1048717962 /nfs/dbraw/zinc/71/79/62/1048717962.db2.gz WKRBLSIFNVRMES-HNNXBMFYSA-N 1 2 301.459 4.187 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc(SC(F)F)cc1 ZINC000109577361 1048718245 /nfs/dbraw/zinc/71/82/45/1048718245.db2.gz HZWORTUAARYGKU-GFCCVEGCSA-N 1 2 308.397 4.380 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccc(SC(F)F)cc1 ZINC000109577361 1048718258 /nfs/dbraw/zinc/71/82/58/1048718258.db2.gz HZWORTUAARYGKU-GFCCVEGCSA-N 1 2 308.397 4.380 20 0 DIADLO Cn1cc(Nc2ccccc2-n2cc[nH+]c2)c(-c2ccccc2)n1 ZINC001176568181 1048727154 /nfs/dbraw/zinc/72/71/54/1048727154.db2.gz CXYOKMWTWILHNX-UHFFFAOYSA-N 1 2 315.380 4.016 20 0 DIADLO CC(C)(C)OC(=O)Cc1ccc[nH+]c1NC/C=C/c1ccccc1 ZINC001166097489 1048734953 /nfs/dbraw/zinc/73/49/53/1048734953.db2.gz WZNHVBZAMWRFRZ-YRNVUSSQSA-N 1 2 324.424 4.091 20 0 DIADLO FC(F)(F)Oc1ccc(Nc2[nH+]cccc2N2CCCC2)cc1 ZINC001176641050 1048745917 /nfs/dbraw/zinc/74/59/17/1048745917.db2.gz BQEXKFRMYVGHPT-UHFFFAOYSA-N 1 2 323.318 4.324 20 0 DIADLO CC[N@H+](Cc1nnc(C(C)(C)C)[nH]1)Cc1ccc2ccccc2c1 ZINC001190519457 1048747934 /nfs/dbraw/zinc/74/79/34/1048747934.db2.gz MNZOTDKVTFUZOX-UHFFFAOYSA-N 1 2 322.456 4.278 20 0 DIADLO CC[N@@H+](Cc1nnc(C(C)(C)C)[nH]1)Cc1ccc2ccccc2c1 ZINC001190519457 1048747948 /nfs/dbraw/zinc/74/79/48/1048747948.db2.gz MNZOTDKVTFUZOX-UHFFFAOYSA-N 1 2 322.456 4.278 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1cc(Cl)ccc1OC(C)C ZINC001176644987 1048748492 /nfs/dbraw/zinc/74/84/92/1048748492.db2.gz NHERJXVOOCDFQM-UHFFFAOYSA-N 1 2 315.804 4.357 20 0 DIADLO CCC[C@]1(C)CCC[N@H+](Cc2nc([C@H](C)SCC)no2)C1 ZINC000483214332 1048758919 /nfs/dbraw/zinc/75/89/19/1048758919.db2.gz DKINZVWUAQCYIG-XJKSGUPXSA-N 1 2 311.495 4.286 20 0 DIADLO CCC[C@]1(C)CCC[N@@H+](Cc2nc([C@H](C)SCC)no2)C1 ZINC000483214332 1048758930 /nfs/dbraw/zinc/75/89/30/1048758930.db2.gz DKINZVWUAQCYIG-XJKSGUPXSA-N 1 2 311.495 4.286 20 0 DIADLO Cn1ncc(C2CCC2)c1C[N@@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000668225579 1048759907 /nfs/dbraw/zinc/75/99/07/1048759907.db2.gz QJFLATCBMIZEQW-GOSISDBHSA-N 1 2 311.429 4.008 20 0 DIADLO Cn1ncc(C2CCC2)c1C[N@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000668225579 1048759924 /nfs/dbraw/zinc/75/99/24/1048759924.db2.gz QJFLATCBMIZEQW-GOSISDBHSA-N 1 2 311.429 4.008 20 0 DIADLO CSCc1cc[nH+]c(N(C)C23CC4CC(CC(C4)C2)C3)c1 ZINC001166592778 1048766851 /nfs/dbraw/zinc/76/68/51/1048766851.db2.gz JPBGYWRIZVLEFZ-UHFFFAOYSA-N 1 2 302.487 4.350 20 0 DIADLO CCCOc1ccc(OCCn2c[nH+]c(C(C)(C)C)c2)cc1 ZINC001166619370 1048773902 /nfs/dbraw/zinc/77/39/02/1048773902.db2.gz OEBJHKJMRFHOLX-UHFFFAOYSA-N 1 2 302.418 4.048 20 0 DIADLO Cc1cc(C(F)(F)F)ncc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176742877 1048776063 /nfs/dbraw/zinc/77/60/63/1048776063.db2.gz AFNJDYKWBLPEKJ-UHFFFAOYSA-N 1 2 322.334 4.148 20 0 DIADLO Cc1cccc2sc(Nc3ccc[nH+]c3N3CCCC3)nc21 ZINC001176743231 1048776723 /nfs/dbraw/zinc/77/67/23/1048776723.db2.gz GXLCFRCRYZJZJW-UHFFFAOYSA-N 1 2 310.426 4.344 20 0 DIADLO Cc1ccc2cccc(Nc3ccc[nH+]c3N3CCCC3)c2n1 ZINC001176751029 1048777751 /nfs/dbraw/zinc/77/77/51/1048777751.db2.gz SIROXGDQMHNHRL-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO Cc1ccc(Nc2ccc[nH+]c2N2CCCC2)c2cccnc12 ZINC001176750417 1048778859 /nfs/dbraw/zinc/77/88/59/1048778859.db2.gz GUUAUHPGLWZYFB-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1CC[C@@H]1COCc1ccccc1 ZINC001166669805 1048779260 /nfs/dbraw/zinc/77/92/60/1048779260.db2.gz CYTRVORALUQUIF-GOSISDBHSA-N 1 2 318.420 4.339 20 0 DIADLO c1ccc(COC[C@@H]2CCN2c2cc3ccccc3c[nH+]2)cc1 ZINC001166669129 1048779290 /nfs/dbraw/zinc/77/92/90/1048779290.db2.gz KJNNIANXVIFXEO-IBGZPJMESA-N 1 2 304.393 4.030 20 0 DIADLO Cc1nc2cc(Nc3ccc[nH+]c3N3CCCC3)ccc2s1 ZINC001176749118 1048779451 /nfs/dbraw/zinc/77/94/51/1048779451.db2.gz VQPSANRHRUIWJK-UHFFFAOYSA-N 1 2 310.426 4.344 20 0 DIADLO Cc1cccc2c(C)cc(N3CCO[C@H](c4ccccc4)C3)[nH+]c12 ZINC001166677431 1048780671 /nfs/dbraw/zinc/78/06/71/1048780671.db2.gz RVJSVRCFNOBXMA-IBGZPJMESA-N 1 2 318.420 4.430 20 0 DIADLO CCCCc1oc2ccccc2c1C[NH2+][C@H](C)c1nc(C)no1 ZINC000483342951 1048783005 /nfs/dbraw/zinc/78/30/05/1048783005.db2.gz QOGBLUVRCZYIIX-GFCCVEGCSA-N 1 2 313.401 4.318 20 0 DIADLO Brc1ccc2[nH]c(NCCc3ccsc3)[nH+]c2c1 ZINC001166803014 1048797024 /nfs/dbraw/zinc/79/70/24/1048797024.db2.gz JIWCNNYWJAPVNS-UHFFFAOYSA-N 1 2 322.231 4.042 20 0 DIADLO Brc1ccc2[nH+]c(NCCc3ccsc3)[nH]c2c1 ZINC001166803014 1048797035 /nfs/dbraw/zinc/79/70/35/1048797035.db2.gz JIWCNNYWJAPVNS-UHFFFAOYSA-N 1 2 322.231 4.042 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ncccc2C)sc1C(C)(C)C ZINC001176896780 1048806509 /nfs/dbraw/zinc/80/65/09/1048806509.db2.gz JBWSRJHOXZCNRR-LBPRGKRZSA-N 1 2 303.475 4.303 20 0 DIADLO Cc1cccnc1[C@@H](C)[NH2+]Cc1c(F)cccc1Br ZINC001176896459 1048808378 /nfs/dbraw/zinc/80/83/78/1048808378.db2.gz GIUPQNPBMNSRGI-LLVKDONJSA-N 1 2 323.209 4.142 20 0 DIADLO COc1cccc(C[NH2+][C@H](C)c2c(F)cccc2F)c1Cl ZINC000851894994 1048808523 /nfs/dbraw/zinc/80/85/23/1048808523.db2.gz SSJGNGPAKDYUKN-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO COc1cccc(C[NH2+][C@@H](C)c2c(F)cccc2F)c1Cl ZINC000851894993 1048808749 /nfs/dbraw/zinc/80/87/49/1048808749.db2.gz SSJGNGPAKDYUKN-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO OCc1ccc2c(c1)CC[N@@H+](Cc1cccc(Cl)c1Cl)C2 ZINC001204181621 1048809860 /nfs/dbraw/zinc/80/98/60/1048809860.db2.gz VSOXZIGEEKMHMJ-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO OCc1ccc2c(c1)CC[N@H+](Cc1cccc(Cl)c1Cl)C2 ZINC001204181621 1048809866 /nfs/dbraw/zinc/80/98/66/1048809866.db2.gz VSOXZIGEEKMHMJ-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO C[C@@H]([NH2+]CC=C(Cl)Cl)c1nc2ccccc2n1C(F)F ZINC000851966683 1048815975 /nfs/dbraw/zinc/81/59/75/1048815975.db2.gz QKWNHKBPGUHUQP-MRVPVSSYSA-N 1 2 320.170 4.401 20 0 DIADLO COc1ccccc1Cc1cn(Cc2cc(C)ccc2C)c[nH+]1 ZINC001166964600 1048817957 /nfs/dbraw/zinc/81/79/57/1048817957.db2.gz QPYRVYYDJGPOGW-UHFFFAOYSA-N 1 2 306.409 4.148 20 0 DIADLO c1nn(C2CCN(c3cccc(C4CC4)[nH+]3)CC2)c2ccccc12 ZINC001167019683 1048828888 /nfs/dbraw/zinc/82/88/88/1048828888.db2.gz QYBMMQWKEMQYFU-UHFFFAOYSA-N 1 2 318.424 4.150 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001167016328 1048829688 /nfs/dbraw/zinc/82/96/88/1048829688.db2.gz LETWGAUODWNFAQ-IAQYHMDHSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001167016328 1048829710 /nfs/dbraw/zinc/82/97/10/1048829710.db2.gz LETWGAUODWNFAQ-IAQYHMDHSA-N 1 2 302.245 4.035 20 0 DIADLO Cc1cc(C[N@H+]2C[C@@H](C)O[C@@H](c3ccccc3)C2)cc(Cl)n1 ZINC000797590037 1048831983 /nfs/dbraw/zinc/83/19/83/1048831983.db2.gz JEAFEUUGFXJKSU-RHSMWYFYSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cc(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccccc3)C2)cc(Cl)n1 ZINC000797590037 1048832001 /nfs/dbraw/zinc/83/20/01/1048832001.db2.gz JEAFEUUGFXJKSU-RHSMWYFYSA-N 1 2 316.832 4.005 20 0 DIADLO Fc1cc2[nH]ccc2c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001203733805 1048832884 /nfs/dbraw/zinc/83/28/84/1048832884.db2.gz MQLBJCMNYOEIJD-UHFFFAOYSA-N 1 2 306.344 4.295 20 0 DIADLO COc1nscc1C[N@H+](Cc1cccc(Cl)c1)C(C)C ZINC001167038090 1048836604 /nfs/dbraw/zinc/83/66/04/1048836604.db2.gz KXKBWWUUYUJTNJ-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO COc1nscc1C[N@@H+](Cc1cccc(Cl)c1)C(C)C ZINC001167038090 1048836617 /nfs/dbraw/zinc/83/66/17/1048836617.db2.gz KXKBWWUUYUJTNJ-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO C[C@@H]([NH2+]Cc1cnon1)c1ccc(O[C@H](C)c2ccccc2)cc1 ZINC000852441187 1048839963 /nfs/dbraw/zinc/83/99/63/1048839963.db2.gz YBTZJIDDRVVVDG-HUUCEWRRSA-N 1 2 323.396 4.060 20 0 DIADLO C[NH+](C)c1ccc(NCc2cnc(C3CCCC3)s2)cc1 ZINC000157685144 1048844044 /nfs/dbraw/zinc/84/40/44/1048844044.db2.gz LNJXFAZUKAEAEE-UHFFFAOYSA-N 1 2 301.459 4.479 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccnc(Cl)c2)cc1F ZINC000852520434 1048848180 /nfs/dbraw/zinc/84/81/80/1048848180.db2.gz DSFBEECUHGVATP-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccnc(Cl)c2)cc1F ZINC000852520434 1048848208 /nfs/dbraw/zinc/84/82/08/1048848208.db2.gz DSFBEECUHGVATP-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc(Cl)n2)cc1F ZINC000852521847 1048849498 /nfs/dbraw/zinc/84/94/98/1048849498.db2.gz VGMYCDQGFIODOJ-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cccc(Cl)n2)cc1F ZINC000852521847 1048849512 /nfs/dbraw/zinc/84/95/12/1048849512.db2.gz VGMYCDQGFIODOJ-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](CCSC(F)(F)F)[C@H](C)CO1 ZINC001191085857 1048862577 /nfs/dbraw/zinc/86/25/77/1048862577.db2.gz URXFSDIEQWSXBC-OCCSQVGLSA-N 1 2 319.392 4.010 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](CCSC(F)(F)F)[C@H](C)CO1 ZINC001191085857 1048862597 /nfs/dbraw/zinc/86/25/97/1048862597.db2.gz URXFSDIEQWSXBC-OCCSQVGLSA-N 1 2 319.392 4.010 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@@H](C)c3cc(F)cc(F)c3)[nH]c2c1 ZINC000483868236 1048873637 /nfs/dbraw/zinc/87/36/37/1048873637.db2.gz VVKURXBGYZRFJU-NSHDSACASA-N 1 2 301.340 4.000 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cccc(C(=O)C(F)(F)F)c3)ccc21 ZINC001203344186 1048875337 /nfs/dbraw/zinc/87/53/37/1048875337.db2.gz FCMIGADHCFQUSO-UHFFFAOYSA-N 1 2 319.286 4.062 20 0 DIADLO Cc1cc(CNc2cc(NC(=O)C(C)C)ccc2C)cc(C)[nH+]1 ZINC001177425576 1048880464 /nfs/dbraw/zinc/88/04/64/1048880464.db2.gz ZKYDAVRIKIKODD-UHFFFAOYSA-N 1 2 311.429 4.213 20 0 DIADLO COc1ccccc1/C=C/CNc1ccc(-n2cc[nH+]c2)cc1 ZINC001177387430 1048880590 /nfs/dbraw/zinc/88/05/90/1048880590.db2.gz MLIPEBVRHQZXLJ-GQCTYLIASA-N 1 2 305.381 4.006 20 0 DIADLO CC(=O)N1CC(C)(C)c2ccc(Nc3ccc(C)[nH+]c3C)cc21 ZINC001203374329 1048885949 /nfs/dbraw/zinc/88/59/49/1048885949.db2.gz HPAKRQGEENAZMQ-UHFFFAOYSA-N 1 2 309.413 4.086 20 0 DIADLO C[C@@]1(c2ccc(F)cc2)C[N@H+](Cc2ccccc2Cl)CCO1 ZINC001203385174 1048886211 /nfs/dbraw/zinc/88/62/11/1048886211.db2.gz MMPPFTRXTDUZQW-SFHVURJKSA-N 1 2 319.807 4.227 20 0 DIADLO C[C@@]1(c2ccc(F)cc2)C[N@@H+](Cc2ccccc2Cl)CCO1 ZINC001203385174 1048886234 /nfs/dbraw/zinc/88/62/34/1048886234.db2.gz MMPPFTRXTDUZQW-SFHVURJKSA-N 1 2 319.807 4.227 20 0 DIADLO FC[C@@]1(C(F)(F)F)CC[N@H+](Cc2c(F)cccc2Cl)C1 ZINC001203399445 1048889817 /nfs/dbraw/zinc/88/98/17/1048889817.db2.gz ZUSGDOOTONCBHZ-LBPRGKRZSA-N 1 2 313.697 4.203 20 0 DIADLO FC[C@@]1(C(F)(F)F)CC[N@@H+](Cc2c(F)cccc2Cl)C1 ZINC001203399445 1048889836 /nfs/dbraw/zinc/88/98/36/1048889836.db2.gz ZUSGDOOTONCBHZ-LBPRGKRZSA-N 1 2 313.697 4.203 20 0 DIADLO Cc1ccc(C[NH2+]Cc2c(Cl)cncc2Cl)c(Cl)n1 ZINC001203496438 1048914917 /nfs/dbraw/zinc/91/49/17/1048914917.db2.gz HHJNIWKGEUCISH-UHFFFAOYSA-N 1 2 316.619 4.035 20 0 DIADLO Fc1ccc(C[N@H+]2CC=C(c3ccc(Cl)nc3)CC2)c(F)c1 ZINC000773670386 1048904089 /nfs/dbraw/zinc/90/40/89/1048904089.db2.gz OUDUBAZLNNTEDB-UHFFFAOYSA-N 1 2 320.770 4.303 20 0 DIADLO Fc1ccc(C[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)c(F)c1 ZINC000773670386 1048904094 /nfs/dbraw/zinc/90/40/94/1048904094.db2.gz OUDUBAZLNNTEDB-UHFFFAOYSA-N 1 2 320.770 4.303 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1ccc(OC)c(F)c1 ZINC001203463699 1048908984 /nfs/dbraw/zinc/90/89/84/1048908984.db2.gz GJWVUHIVGDHKRN-UHFFFAOYSA-N 1 2 306.406 4.095 20 0 DIADLO CCC(CC)CCC[N@H+](C)Cn1c(=O)scc1C(F)(F)F ZINC000853590207 1048909928 /nfs/dbraw/zinc/90/99/28/1048909928.db2.gz SYUAFZWLFIFUAU-UHFFFAOYSA-N 1 2 324.412 4.034 20 0 DIADLO CCC(CC)CCC[N@@H+](C)Cn1c(=O)scc1C(F)(F)F ZINC000853590207 1048909948 /nfs/dbraw/zinc/90/99/48/1048909948.db2.gz SYUAFZWLFIFUAU-UHFFFAOYSA-N 1 2 324.412 4.034 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2cc3n(n2)CCCC3)o1 ZINC001191276917 1048913385 /nfs/dbraw/zinc/91/33/85/1048913385.db2.gz GTXCJHXMJOTPMI-KSSFIOAISA-N 1 2 313.445 4.094 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2cc3n(n2)CCCC3)o1 ZINC001191276917 1048913396 /nfs/dbraw/zinc/91/33/96/1048913396.db2.gz GTXCJHXMJOTPMI-KSSFIOAISA-N 1 2 313.445 4.094 20 0 DIADLO CCOc1ccc(CNc2[nH+]c3ccccc3n2C(C)(C)C)o1 ZINC001203517327 1048916684 /nfs/dbraw/zinc/91/66/84/1048916684.db2.gz RGDPFYVMLCMPMM-UHFFFAOYSA-N 1 2 313.401 4.395 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1ccccc1OC ZINC001203529879 1048925325 /nfs/dbraw/zinc/92/53/25/1048925325.db2.gz MHXMESFNMLRNJC-UHFFFAOYSA-N 1 2 315.804 4.330 20 0 DIADLO COc1cccc2[nH]c(NCc3ccc(F)c4ccccc34)[nH+]c21 ZINC001203548935 1048926331 /nfs/dbraw/zinc/92/63/31/1048926331.db2.gz VOXMNFDANZUSBV-UHFFFAOYSA-N 1 2 321.355 4.476 20 0 DIADLO COc1cccc2[nH]c(NCc3ccc4c(c3)CCCC4)[nH+]c21 ZINC001203548699 1048926832 /nfs/dbraw/zinc/92/68/32/1048926832.db2.gz TVZKQBWXIIPNGM-UHFFFAOYSA-N 1 2 307.397 4.062 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cncc(Oc2ccccc2)c1 ZINC001203556798 1048927106 /nfs/dbraw/zinc/92/71/06/1048927106.db2.gz QLQSRMWEIFOVEF-UHFFFAOYSA-N 1 2 307.353 4.411 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cccnc3-c3ccccc3)ccc21 ZINC001203648187 1048946809 /nfs/dbraw/zinc/94/68/09/1048946809.db2.gz QSUSDGQEABOGRU-UHFFFAOYSA-N 1 2 300.365 4.379 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cccc(C(=O)Nc3cccnc3)c2)c1 ZINC001203663231 1048953628 /nfs/dbraw/zinc/95/36/28/1048953628.db2.gz FQHQCKSAZRJYLL-UHFFFAOYSA-N 1 2 318.380 4.089 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)c(F)c(F)c(F)c1F)c1cccs1 ZINC000776722182 1048954920 /nfs/dbraw/zinc/95/49/20/1048954920.db2.gz FLKJSPKFGBMDHY-LURJTMIESA-N 1 2 307.287 4.294 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2c(F)cccc2OC[C@H]2CCCO2)c1 ZINC001203667474 1048956295 /nfs/dbraw/zinc/95/62/95/1048956295.db2.gz MJMFGVWNTRBFLZ-CQSZACIVSA-N 1 2 316.376 4.139 20 0 DIADLO CCCCCCOc1ccc(NC(=O)[C@@H](C)n2cc[nH+]c2)cc1 ZINC001177925313 1048962117 /nfs/dbraw/zinc/96/21/17/1048962117.db2.gz GUPTYZQDMNBETE-OAHLLOKOSA-N 1 2 315.417 4.042 20 0 DIADLO COc1ccc(OC)c(C[NH2+][C@@H](C)c2c(F)cccc2Cl)c1 ZINC001177962817 1048963430 /nfs/dbraw/zinc/96/34/30/1048963430.db2.gz SWXWOBCHKLDMSK-NSHDSACASA-N 1 2 323.795 4.347 20 0 DIADLO CCCOc1ccc(Nc2ccc3c(c2)[nH+]cn3C)c(F)c1F ZINC001203696602 1048966671 /nfs/dbraw/zinc/96/66/71/1048966671.db2.gz IZTTWAXEEAEWNR-UHFFFAOYSA-N 1 2 317.339 4.384 20 0 DIADLO CCC[C@@H](C)c1noc([C@H]([NH3+])c2ccccc2C(F)(F)F)n1 ZINC000904090357 1048970170 /nfs/dbraw/zinc/97/01/70/1048970170.db2.gz WANWOUVORBLNAD-BXKDBHETSA-N 1 2 313.323 4.040 20 0 DIADLO CC(C)(C)c1nc(Nc2ccc([NH+]3CCCCC3)cc2)no1 ZINC001203712524 1048973405 /nfs/dbraw/zinc/97/34/05/1048973405.db2.gz IPVRIZVSDOBGEW-UHFFFAOYSA-N 1 2 300.406 4.101 20 0 DIADLO c1ccc2nc(Nc3ccc([NH+]4CCCCC4)cc3)ncc2c1 ZINC001203712102 1048973733 /nfs/dbraw/zinc/97/37/33/1048973733.db2.gz CTWCDIWHKVMMGT-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO Oc1cc(F)cc(F)c1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718852 1048975587 /nfs/dbraw/zinc/97/55/87/1048975587.db2.gz DXYLGNSVGYVIMZ-UHFFFAOYSA-N 1 2 304.340 4.404 20 0 DIADLO c1nc(Nc2ccc([NH+]3CCCCC3)cc2)cn1CC1CCC1 ZINC001203718929 1048975604 /nfs/dbraw/zinc/97/56/04/1048975604.db2.gz NFMYZSWWUXVZHQ-UHFFFAOYSA-N 1 2 310.445 4.417 20 0 DIADLO Nc1ccc(N(c2ccc([NH+]3CCCCC3)cc2)C2CCC2)nc1 ZINC001203718360 1048976251 /nfs/dbraw/zinc/97/62/51/1048976251.db2.gz DYDFWKVGINTMTM-UHFFFAOYSA-N 1 2 322.456 4.345 20 0 DIADLO Cc1nc(Cl)ncc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203717888 1048976894 /nfs/dbraw/zinc/97/68/94/1048976894.db2.gz NWWLYHXYYLVQDD-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO FC(F)Oc1cccnc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718247 1048977129 /nfs/dbraw/zinc/97/71/29/1048977129.db2.gz XQUOCQMFFDDNDN-UHFFFAOYSA-N 1 2 319.355 4.417 20 0 DIADLO FC(F)(F)c1cnnc(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001203718972 1048977346 /nfs/dbraw/zinc/97/73/46/1048977346.db2.gz OALHMHXVPJJSCS-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO O=C1OCc2cccc(Nc3ccc([NH+]4CCCCC4)cc3)c21 ZINC001203723903 1048978150 /nfs/dbraw/zinc/97/81/50/1048978150.db2.gz CJBYNFYPFQXNHP-UHFFFAOYSA-N 1 2 308.381 4.091 20 0 DIADLO O=c1ccc2cc(Nc3ccc([NH+]4CCCCC4)cc3)ccc2[nH]1 ZINC001203719546 1048979657 /nfs/dbraw/zinc/97/96/57/1048979657.db2.gz PFVVLNBBBIMALH-UHFFFAOYSA-N 1 2 319.408 4.262 20 0 DIADLO OCc1ccc(F)cc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203724370 1048981307 /nfs/dbraw/zinc/98/13/07/1048981307.db2.gz LGIBJHAJAFPTBL-UHFFFAOYSA-N 1 2 300.377 4.052 20 0 DIADLO Cc1cc(CNC(=O)c2ccc(-c3ccc(F)cc3)o2)cc(C)[nH+]1 ZINC001276417485 1048986359 /nfs/dbraw/zinc/98/63/59/1048986359.db2.gz AQVFZILORBRQPH-UHFFFAOYSA-N 1 2 324.355 4.028 20 0 DIADLO CC(C)(C)n1cc(CNc2[nH+]c3ccccc3n2CC2CC2)cn1 ZINC001203739398 1048987392 /nfs/dbraw/zinc/98/73/92/1048987392.db2.gz GQGCECJAVKSFGN-UHFFFAOYSA-N 1 2 323.444 4.010 20 0 DIADLO Cc1ccc(C)c(C[N@@H+]2Cc3cnc(-c4ccccc4)nc3C2)c1 ZINC001203751966 1048990221 /nfs/dbraw/zinc/99/02/21/1048990221.db2.gz NYLYQQKJCOMBOG-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1ccc(C)c(C[N@H+]2Cc3cnc(-c4ccccc4)nc3C2)c1 ZINC001203751966 1048990233 /nfs/dbraw/zinc/99/02/33/1048990233.db2.gz NYLYQQKJCOMBOG-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO COc1ccc(CNc2ccc(-n3cc[nH+]c3)c(C)c2)c(C)c1 ZINC001178138764 1048990883 /nfs/dbraw/zinc/99/08/83/1048990883.db2.gz HXSFDALMZJWEMF-UHFFFAOYSA-N 1 2 307.397 4.110 20 0 DIADLO CCSc1ccccc1C[N@H+](Cc1nnc(C)o1)C(C)(C)C ZINC001191731481 1048991888 /nfs/dbraw/zinc/99/18/88/1048991888.db2.gz SJMVBBRAGFYOOG-UHFFFAOYSA-N 1 2 319.474 4.291 20 0 DIADLO CCSc1ccccc1C[N@@H+](Cc1nnc(C)o1)C(C)(C)C ZINC001191731481 1048991896 /nfs/dbraw/zinc/99/18/96/1048991896.db2.gz SJMVBBRAGFYOOG-UHFFFAOYSA-N 1 2 319.474 4.291 20 0 DIADLO Cc1ccc2c(C(=O)NCc3cc(C)[nH+]c(C)c3)csc2c1 ZINC001276418349 1048992011 /nfs/dbraw/zinc/99/20/11/1048992011.db2.gz LBLFLFYXQYGMSH-UHFFFAOYSA-N 1 2 310.422 4.152 20 0 DIADLO Cc1cccn2c(CNc3ccccc3Br)c[nH+]c12 ZINC001178123324 1048993508 /nfs/dbraw/zinc/99/35/08/1048993508.db2.gz QLGOQEDIJKVGSU-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO C[C@@H](N[C@H](C)c1c(F)cccc1Cl)c1cn2c([nH+]1)CCCC2 ZINC000925488521 1048995256 /nfs/dbraw/zinc/99/52/56/1048995256.db2.gz KEZVAJFJLYGMLJ-VXGBXAGGSA-N 1 2 321.827 4.424 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1cccc(F)c1Br ZINC000158020390 1048997159 /nfs/dbraw/zinc/99/71/59/1048997159.db2.gz BSNQKRARAWSPTC-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1cccc(F)c1Br ZINC000158020390 1048997173 /nfs/dbraw/zinc/99/71/73/1048997173.db2.gz BSNQKRARAWSPTC-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2cccc(F)c2)on1 ZINC001203788957 1048997218 /nfs/dbraw/zinc/99/72/18/1048997218.db2.gz FUZVFOCINRSOQB-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2cccc(F)c2)on1 ZINC001203788957 1048997237 /nfs/dbraw/zinc/99/72/37/1048997237.db2.gz FUZVFOCINRSOQB-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccc(F)cc1OC(C)(C)C ZINC001178196060 1048997532 /nfs/dbraw/zinc/99/75/32/1048997532.db2.gz MPFFFERWCZXPGQ-UHFFFAOYSA-N 1 2 305.397 4.222 20 0 DIADLO Cc1cnn(-c2ccc(C)cc2NCc2cc(C)[nH+]c(C)c2)c1 ZINC001178196114 1048998056 /nfs/dbraw/zinc/99/80/56/1048998056.db2.gz OAKICKYWEKGMSM-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO COc1cc(NCc2c[nH+]c3ccc(C)cn23)cc2ccccc21 ZINC001203810781 1049003891 /nfs/dbraw/zinc/00/38/91/1049003891.db2.gz WVQXWLYURJGANT-UHFFFAOYSA-N 1 2 317.392 4.417 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1noc([C@@H]2CCC[C@H]2c2ccccc2)n1 ZINC000904263482 1049008619 /nfs/dbraw/zinc/00/86/19/1049008619.db2.gz ZUDUPSIEPRSFKS-JKSUJKDBSA-N 1 2 320.396 4.074 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1noc(-c2cc(C3CC3)oc2C2CC2)n1 ZINC000904264926 1049010385 /nfs/dbraw/zinc/01/03/85/1049010385.db2.gz DAVCBQSBMCZSTC-UHFFFAOYSA-N 1 2 322.368 4.037 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1noc([C@@H]2CC[C@@H](c3ccccc3)C2)n1 ZINC000904264869 1049010580 /nfs/dbraw/zinc/01/05/80/1049010580.db2.gz BHWVKQUGCYCHBW-HUUCEWRRSA-N 1 2 320.396 4.074 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1noc([C@H](F)CC2CCCCC2)n1 ZINC000904261792 1049014144 /nfs/dbraw/zinc/01/41/44/1049014144.db2.gz OCSIKPGUHWRZPP-CYBMUJFWSA-N 1 2 304.369 4.003 20 0 DIADLO Oc1cccc(C[N@@H+]2CCSC[C@@H]2c2cccc(Cl)c2)c1 ZINC001203862214 1049017398 /nfs/dbraw/zinc/01/73/98/1049017398.db2.gz BNBDLIHQVGYXCS-QGZVFWFLSA-N 1 2 319.857 4.336 20 0 DIADLO Oc1cccc(C[N@H+]2CCSC[C@@H]2c2cccc(Cl)c2)c1 ZINC001203862214 1049017408 /nfs/dbraw/zinc/01/74/08/1049017408.db2.gz BNBDLIHQVGYXCS-QGZVFWFLSA-N 1 2 319.857 4.336 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)cc1O ZINC001203870065 1049018830 /nfs/dbraw/zinc/01/88/30/1049018830.db2.gz OEVSAHLLYJODGF-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)cc1O ZINC001203870065 1049018838 /nfs/dbraw/zinc/01/88/38/1049018838.db2.gz OEVSAHLLYJODGF-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO C[NH+](C)[C@H](c1nc(-c2cccs2)no1)c1ccc(Cl)cc1 ZINC000904279434 1049019210 /nfs/dbraw/zinc/01/92/10/1049019210.db2.gz PKNHPZADTACODH-ZDUSSCGKSA-N 1 2 319.817 4.103 20 0 DIADLO Cc1cc(NC(=O)c2ccc(SC(F)(F)F)cc2)cc[nH+]1 ZINC000010165196 1049024583 /nfs/dbraw/zinc/02/45/83/1049024583.db2.gz QRQPTMYWUOZVPT-UHFFFAOYSA-N 1 2 312.316 4.254 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CC[C@@H]2SCCS[C@H]12 ZINC000776803127 1049027979 /nfs/dbraw/zinc/02/79/79/1049027979.db2.gz SKDSAKPVYCPMOX-IXDOHACOSA-N 1 2 320.527 4.078 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccc(Cl)cc1OC(F)F ZINC001178426205 1049038874 /nfs/dbraw/zinc/03/88/74/1049038874.db2.gz WDRGTCRNHGJPBN-UHFFFAOYSA-N 1 2 315.751 4.160 20 0 DIADLO CC(C)(C)OC(=O)[C@H]([NH2+][C@@H](c1ccccc1)C1CCC1)C1CC1 ZINC001192157697 1049044235 /nfs/dbraw/zinc/04/42/35/1049044235.db2.gz IXFLUVWYPPZIIT-ZWKOTPCHSA-N 1 2 315.457 4.238 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H](C)c2ccc3ncsc3c2)o1 ZINC000776814877 1049044712 /nfs/dbraw/zinc/04/47/12/1049044712.db2.gz FMIVFYMHLVZERZ-LLVKDONJSA-N 1 2 301.415 4.259 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@@H](CC(C)C)C1 ZINC001192197879 1049051956 /nfs/dbraw/zinc/05/19/56/1049051956.db2.gz HGKCCODHDFYVCU-WMLDXEAASA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H](CC(C)C)C1 ZINC001192197879 1049051968 /nfs/dbraw/zinc/05/19/68/1049051968.db2.gz HGKCCODHDFYVCU-WMLDXEAASA-N 1 2 323.864 4.312 20 0 DIADLO CC(C)C[N@H+](Cc1ncsc1Br)CC(C)(C)C ZINC001192222569 1049061656 /nfs/dbraw/zinc/06/16/56/1049061656.db2.gz AMJCPFYZXBJORB-UHFFFAOYSA-N 1 2 319.312 4.410 20 0 DIADLO CC(C)C[N@@H+](Cc1ncsc1Br)CC(C)(C)C ZINC001192222569 1049061667 /nfs/dbraw/zinc/06/16/67/1049061667.db2.gz AMJCPFYZXBJORB-UHFFFAOYSA-N 1 2 319.312 4.410 20 0 DIADLO FC(F)(F)c1cccc(OC2C[NH+](Cc3cccs3)C2)c1 ZINC001204015538 1049062997 /nfs/dbraw/zinc/06/29/97/1049062997.db2.gz WOCJEWGTHBJWBY-UHFFFAOYSA-N 1 2 313.344 4.030 20 0 DIADLO CCc1cc(NCc2c[nH+]c(C)n2-c2ccccc2)ccc1F ZINC001178688579 1049075558 /nfs/dbraw/zinc/07/55/58/1049075558.db2.gz JVCJLGTUIZMCFQ-UHFFFAOYSA-N 1 2 309.388 4.494 20 0 DIADLO c1cn(-c2ccccc2)nc1C[N@H+](Cc1ccccc1)C1CC1 ZINC000338986129 1049075874 /nfs/dbraw/zinc/07/58/74/1049075874.db2.gz QWBDMYYCENJKSL-UHFFFAOYSA-N 1 2 303.409 4.037 20 0 DIADLO c1cn(-c2ccccc2)nc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000338986129 1049075886 /nfs/dbraw/zinc/07/58/86/1049075886.db2.gz QWBDMYYCENJKSL-UHFFFAOYSA-N 1 2 303.409 4.037 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1csc(-c2ccccc2)n1 ZINC000113957413 1049077324 /nfs/dbraw/zinc/07/73/24/1049077324.db2.gz PGADETIYOJHISR-LLVKDONJSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1cncc(Cl)c1 ZINC001192301871 1049081905 /nfs/dbraw/zinc/08/19/05/1049081905.db2.gz CWGOTUBBVXYXTD-RYUDHWBXSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1cncc(Cl)c1 ZINC001192301871 1049081915 /nfs/dbraw/zinc/08/19/15/1049081915.db2.gz CWGOTUBBVXYXTD-RYUDHWBXSA-N 1 2 304.796 4.382 20 0 DIADLO Cn1cc(Cl)c(C[NH2+]Cc2ccc(-c3cccs3)cc2)n1 ZINC001178758886 1049083858 /nfs/dbraw/zinc/08/38/58/1049083858.db2.gz MHFCWTRSIXTLET-UHFFFAOYSA-N 1 2 317.845 4.092 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1nc(C(C)(C)C)co1 ZINC001204090485 1049084373 /nfs/dbraw/zinc/08/43/73/1049084373.db2.gz XVQWKGVZQPFQSM-UHFFFAOYSA-N 1 2 316.380 4.093 20 0 DIADLO FC1(F)[C@H]2CC[N@H+](Cc3nc(C4CCCCC4)cs3)C[C@H]21 ZINC001192390725 1049085665 /nfs/dbraw/zinc/08/56/65/1049085665.db2.gz OACOCENSIXBFAU-QWHCGFSZSA-N 1 2 312.429 4.278 20 0 DIADLO FC1(F)[C@H]2CC[N@@H+](Cc3nc(C4CCCCC4)cs3)C[C@H]21 ZINC001192390725 1049085675 /nfs/dbraw/zinc/08/56/75/1049085675.db2.gz OACOCENSIXBFAU-QWHCGFSZSA-N 1 2 312.429 4.278 20 0 DIADLO C[C@H](c1nc(-c2cccs2)no1)[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000484926757 1049086665 /nfs/dbraw/zinc/08/66/65/1049086665.db2.gz MIYTVPSTZXTJKM-TZMCWYRMSA-N 1 2 311.410 4.306 20 0 DIADLO C[C@H](c1nc(-c2cccs2)no1)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000484926757 1049086679 /nfs/dbraw/zinc/08/66/79/1049086679.db2.gz MIYTVPSTZXTJKM-TZMCWYRMSA-N 1 2 311.410 4.306 20 0 DIADLO CCCN(C(=O)c1cccc2[nH+]ccn21)c1ccc(Cl)cc1 ZINC000776908553 1049113887 /nfs/dbraw/zinc/11/38/87/1049113887.db2.gz IBRWRFGLWGIREV-UHFFFAOYSA-N 1 2 313.788 4.045 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cc(F)cc(F)c1 ZINC001204232250 1049116354 /nfs/dbraw/zinc/11/63/54/1049116354.db2.gz HXKMPIXXEYRUFI-GOSISDBHSA-N 1 2 317.379 4.448 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cc(F)cc(F)c1 ZINC001204232250 1049116360 /nfs/dbraw/zinc/11/63/60/1049116360.db2.gz HXKMPIXXEYRUFI-GOSISDBHSA-N 1 2 317.379 4.448 20 0 DIADLO Fc1cc(F)cc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC001204234691 1049116983 /nfs/dbraw/zinc/11/69/83/1049116983.db2.gz VKMZMRDJGUPZEJ-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1cc(F)cc(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC001204234691 1049116993 /nfs/dbraw/zinc/11/69/93/1049116993.db2.gz VKMZMRDJGUPZEJ-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO CC[N@H+](Cc1nc(Cl)cs1)Cc1ccc(Cl)cc1 ZINC001204269678 1049125179 /nfs/dbraw/zinc/12/51/79/1049125179.db2.gz ATTJAJUIBBKUSH-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC[N@@H+](Cc1nc(Cl)cs1)Cc1ccc(Cl)cc1 ZINC001204269678 1049125185 /nfs/dbraw/zinc/12/51/85/1049125185.db2.gz ATTJAJUIBBKUSH-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC[C@H]([NH2+]CC(=O)c1ccccc1F)c1ccc(F)cc1F ZINC001192689594 1049131112 /nfs/dbraw/zinc/13/11/12/1049131112.db2.gz JHGJUALGLMOJPO-INIZCTEOSA-N 1 2 307.315 4.028 20 0 DIADLO CCCCCCOc1ccccc1C[N@H+](C)Cc1cnccn1 ZINC001204294476 1049132847 /nfs/dbraw/zinc/13/28/47/1049132847.db2.gz PPWOXYUWPLZMAH-UHFFFAOYSA-N 1 2 313.445 4.068 20 0 DIADLO CCCCCCOc1ccccc1C[N@@H+](C)Cc1cnccn1 ZINC001204294476 1049132851 /nfs/dbraw/zinc/13/28/51/1049132851.db2.gz PPWOXYUWPLZMAH-UHFFFAOYSA-N 1 2 313.445 4.068 20 0 DIADLO COc1ccc(Cl)cc1CNc1c[nH+]cc2c1CCCC2 ZINC001179148046 1049136889 /nfs/dbraw/zinc/13/68/89/1049136889.db2.gz MKIVDQOSJHHIDR-UHFFFAOYSA-N 1 2 302.805 4.235 20 0 DIADLO CC(C)(C)CCO[C@H]1CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC001224725748 1049146735 /nfs/dbraw/zinc/14/67/35/1049146735.db2.gz WYMBHYQNWGUYLL-LBPRGKRZSA-N 1 2 316.898 4.214 20 0 DIADLO CC(C)(C)CCO[C@H]1CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC001224725748 1049146742 /nfs/dbraw/zinc/14/67/42/1049146742.db2.gz WYMBHYQNWGUYLL-LBPRGKRZSA-N 1 2 316.898 4.214 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(CCC(C)C)no1)c1ccc(C)c(F)c1 ZINC001192909176 1049146958 /nfs/dbraw/zinc/14/69/58/1049146958.db2.gz GFWDUTRJOCSWNQ-INIZCTEOSA-N 1 2 319.424 4.347 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@H+]1CCCN(C)c1ccccc1 ZINC001192945932 1049150292 /nfs/dbraw/zinc/15/02/92/1049150292.db2.gz GGZQMYHQLISOGG-HNNXBMFYSA-N 1 2 317.864 4.045 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@@H+]1CCCN(C)c1ccccc1 ZINC001192945932 1049150298 /nfs/dbraw/zinc/15/02/98/1049150298.db2.gz GGZQMYHQLISOGG-HNNXBMFYSA-N 1 2 317.864 4.045 20 0 DIADLO Clc1ccccc1CC[N@@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001193002118 1049160050 /nfs/dbraw/zinc/16/00/50/1049160050.db2.gz KGWHWDBYKKYIBF-UHFFFAOYSA-N 1 2 310.828 4.422 20 0 DIADLO Clc1ccccc1CC[N@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001193002118 1049160054 /nfs/dbraw/zinc/16/00/54/1049160054.db2.gz KGWHWDBYKKYIBF-UHFFFAOYSA-N 1 2 310.828 4.422 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCO[C@@H](c3ccccc3Cl)C2)cc1 ZINC001204449719 1049163693 /nfs/dbraw/zinc/16/36/93/1049163693.db2.gz NIKPZIKTGWAJOM-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc(CC[N@H+]2CCO[C@@H](c3ccccc3Cl)C2)cc1 ZINC001204449719 1049163696 /nfs/dbraw/zinc/16/36/96/1049163696.db2.gz NIKPZIKTGWAJOM-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO CC(C)c1ccc([C@@H]2CCCC[N@@H+]2Cc2nncs2)cc1 ZINC001192975884 1049164335 /nfs/dbraw/zinc/16/43/35/1049164335.db2.gz IGRIPBQBSMSWGZ-INIZCTEOSA-N 1 2 301.459 4.389 20 0 DIADLO CC(C)c1ccc([C@@H]2CCCC[N@H+]2Cc2nncs2)cc1 ZINC001192975884 1049164340 /nfs/dbraw/zinc/16/43/40/1049164340.db2.gz IGRIPBQBSMSWGZ-INIZCTEOSA-N 1 2 301.459 4.389 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2F)cn1 ZINC001204471190 1049170609 /nfs/dbraw/zinc/17/06/09/1049170609.db2.gz MABBRLCTTXGFSO-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2F)cn1 ZINC001204471190 1049170611 /nfs/dbraw/zinc/17/06/11/1049170611.db2.gz MABBRLCTTXGFSO-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NCC(C)(C)c1ccccc1 ZINC001179489937 1049172514 /nfs/dbraw/zinc/17/25/14/1049172514.db2.gz XBBJXJDCWPVETR-UHFFFAOYSA-N 1 2 323.440 4.072 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+]Cc3cc4cccnc4o3)co2)cc1 ZINC001179562523 1049177831 /nfs/dbraw/zinc/17/78/31/1049177831.db2.gz CJEDYRKTPONXRZ-UHFFFAOYSA-N 1 2 319.364 4.081 20 0 DIADLO CCCOc1ccc(C[NH2+][C@H]2c3ccccc3OC[C@H]2F)cc1 ZINC001179578859 1049178790 /nfs/dbraw/zinc/17/87/90/1049178790.db2.gz AQTVYSODUMGRQZ-MJGOQNOKSA-N 1 2 315.388 4.037 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)nc1)c1ncc(-c2ccccc2)o1 ZINC001193103621 1049179087 /nfs/dbraw/zinc/17/90/87/1049179087.db2.gz JZECCRDGIMZBQZ-STQMWFEESA-N 1 2 311.360 4.288 20 0 DIADLO CC[N@H+](Cc1cc(F)c(F)c(F)c1)Cc1cccc(F)c1F ZINC001204531134 1049182249 /nfs/dbraw/zinc/18/22/49/1049182249.db2.gz PCNOMRGCVMLQKO-UHFFFAOYSA-N 1 2 315.285 4.404 20 0 DIADLO CC[N@@H+](Cc1cc(F)c(F)c(F)c1)Cc1cccc(F)c1F ZINC001204531134 1049182252 /nfs/dbraw/zinc/18/22/52/1049182252.db2.gz PCNOMRGCVMLQKO-UHFFFAOYSA-N 1 2 315.285 4.404 20 0 DIADLO Clc1ccccc1C[N@@H+]1CCO[C@H](CCc2ccccc2)C1 ZINC001193198609 1049186064 /nfs/dbraw/zinc/18/60/64/1049186064.db2.gz RVRYOTYVUBKOIK-GOSISDBHSA-N 1 2 315.844 4.174 20 0 DIADLO Clc1ccccc1C[N@H+]1CCO[C@H](CCc2ccccc2)C1 ZINC001193198609 1049186072 /nfs/dbraw/zinc/18/60/72/1049186072.db2.gz RVRYOTYVUBKOIK-GOSISDBHSA-N 1 2 315.844 4.174 20 0 DIADLO CCCOc1ccc(C[N@H+](C)Cc2ncc(CC)s2)cc1C ZINC001204592838 1049194937 /nfs/dbraw/zinc/19/49/37/1049194937.db2.gz OMSGVJSPYFHHPT-UHFFFAOYSA-N 1 2 318.486 4.435 20 0 DIADLO CCCOc1ccc(C[N@@H+](C)Cc2ncc(CC)s2)cc1C ZINC001204592838 1049194940 /nfs/dbraw/zinc/19/49/40/1049194940.db2.gz OMSGVJSPYFHHPT-UHFFFAOYSA-N 1 2 318.486 4.435 20 0 DIADLO COc1cccc(C[N@@H+]2Cc3ccccc3OC[C@H]2C)c1Cl ZINC001193311593 1049196465 /nfs/dbraw/zinc/19/64/65/1049196465.db2.gz RVTZCIUPWHGFDJ-CYBMUJFWSA-N 1 2 317.816 4.132 20 0 DIADLO COc1cccc(C[N@H+]2Cc3ccccc3OC[C@H]2C)c1Cl ZINC001193311593 1049196474 /nfs/dbraw/zinc/19/64/74/1049196474.db2.gz RVTZCIUPWHGFDJ-CYBMUJFWSA-N 1 2 317.816 4.132 20 0 DIADLO c1csc(C[NH2+][C@@H]2C[C@@H](c3ccccc3)Oc3ccccc32)n1 ZINC001179712851 1049198196 /nfs/dbraw/zinc/19/81/96/1049198196.db2.gz LAFNXVQZMRLUFZ-AEFFLSMTSA-N 1 2 322.433 4.498 20 0 DIADLO Cc1ccc2cc(C[N@H+]3C[C@H](C)OC[C@H]3c3ccccc3)[nH]c2c1 ZINC001204615838 1049200064 /nfs/dbraw/zinc/20/00/64/1049200064.db2.gz MFQBRSLZBZTRRG-KKSFZXQISA-N 1 2 320.436 4.438 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3C[C@H](C)OC[C@H]3c3ccccc3)[nH]c2c1 ZINC001204615838 1049200068 /nfs/dbraw/zinc/20/00/68/1049200068.db2.gz MFQBRSLZBZTRRG-KKSFZXQISA-N 1 2 320.436 4.438 20 0 DIADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000857865655 1049205296 /nfs/dbraw/zinc/20/52/96/1049205296.db2.gz PPSXSGNGBXKEFW-HUUCEWRRSA-N 1 2 323.362 4.379 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2ccc(Cl)nc21)c1c(F)cccc1F ZINC000857902899 1049207248 /nfs/dbraw/zinc/20/72/48/1049207248.db2.gz WUNDMYUSTSFODY-TVQRCGJNSA-N 1 2 308.759 4.351 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](C/C=C\c2ccc(F)cc2)CCO1 ZINC001204648905 1049211361 /nfs/dbraw/zinc/21/13/61/1049211361.db2.gz XTVLVMGQWHTFHI-RDBXKPKDSA-N 1 2 311.400 4.221 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](C/C=C\c2ccc(F)cc2)CCO1 ZINC001204648905 1049211370 /nfs/dbraw/zinc/21/13/70/1049211370.db2.gz XTVLVMGQWHTFHI-RDBXKPKDSA-N 1 2 311.400 4.221 20 0 DIADLO CCCCCC[C@@](C)(CCC)C(=O)N[C@@H]1CCn2c[nH+]cc2C1 ZINC000857948925 1049212364 /nfs/dbraw/zinc/21/23/64/1049212364.db2.gz UATBZEJSBOTYGL-VQIMIIECSA-N 1 2 319.493 4.091 20 0 DIADLO Brc1sccc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001179845065 1049214219 /nfs/dbraw/zinc/21/42/19/1049214219.db2.gz JGNVAQFRIKSNMA-CYBMUJFWSA-N 1 2 308.244 4.458 20 0 DIADLO Brc1sccc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC001179845065 1049214231 /nfs/dbraw/zinc/21/42/31/1049214231.db2.gz JGNVAQFRIKSNMA-CYBMUJFWSA-N 1 2 308.244 4.458 20 0 DIADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001204695555 1049230554 /nfs/dbraw/zinc/23/05/54/1049230554.db2.gz UCJLDEXEXSOCSY-LBPRGKRZSA-N 1 2 303.789 4.153 20 0 DIADLO C[C@H]1CC(=O)CC[N@H+]1Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001204695555 1049230566 /nfs/dbraw/zinc/23/05/66/1049230566.db2.gz UCJLDEXEXSOCSY-LBPRGKRZSA-N 1 2 303.789 4.153 20 0 DIADLO CCCn1c[nH+]cc1CN(Cc1ccco1)Cc1cccc(C)c1 ZINC001179942676 1049232819 /nfs/dbraw/zinc/23/28/19/1049232819.db2.gz SCCLRYVKGXIJOR-UHFFFAOYSA-N 1 2 323.440 4.397 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1Cl ZINC000195444840 1049233645 /nfs/dbraw/zinc/23/36/45/1049233645.db2.gz FGORGMFZMIOPTR-NSHDSACASA-N 1 2 307.825 4.180 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1cccnc1N ZINC001204721163 1049240708 /nfs/dbraw/zinc/24/07/08/1049240708.db2.gz JGOYEPWOXXVHIQ-JTQLQIEISA-N 1 2 310.228 4.164 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1cccnc1N ZINC001204721163 1049240716 /nfs/dbraw/zinc/24/07/16/1049240716.db2.gz JGOYEPWOXXVHIQ-JTQLQIEISA-N 1 2 310.228 4.164 20 0 DIADLO Cc1[nH]c(CNc2cccc(SC(F)(F)F)c2)[nH+]c1C ZINC000858317950 1049240868 /nfs/dbraw/zinc/24/08/68/1049240868.db2.gz JBDGRYLNUMJOHF-UHFFFAOYSA-N 1 2 301.337 4.251 20 0 DIADLO CCc1cnccc1[C@H](C)[C@H](c1[nH+]ccn1C)c1cccc(F)c1 ZINC000485432934 1049243990 /nfs/dbraw/zinc/24/39/90/1049243990.db2.gz CDXKLPSSAVEYHS-LIRRHRJNSA-N 1 2 323.415 4.452 20 0 DIADLO C[N@H+](Cc1ccno1)Cc1ccc(-c2ccccc2Cl)o1 ZINC001204746330 1049251401 /nfs/dbraw/zinc/25/14/01/1049251401.db2.gz XWUHDPVWTNVHJF-UHFFFAOYSA-N 1 2 302.761 4.220 20 0 DIADLO C[N@@H+](Cc1ccno1)Cc1ccc(-c2ccccc2Cl)o1 ZINC001204746330 1049251413 /nfs/dbraw/zinc/25/14/13/1049251413.db2.gz XWUHDPVWTNVHJF-UHFFFAOYSA-N 1 2 302.761 4.220 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2ccc(F)cc2C(F)(F)F)co1 ZINC000858423851 1049256063 /nfs/dbraw/zinc/25/60/63/1049256063.db2.gz PBVMQXKFDXVKSZ-VIFPVBQESA-N 1 2 316.298 4.246 20 0 DIADLO c1cc(-c2ccccc2)sc1C[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000858445434 1049260637 /nfs/dbraw/zinc/26/06/37/1049260637.db2.gz JMPAAKPEBQFABX-MRXNPFEDSA-N 1 2 309.438 4.305 20 0 DIADLO Fc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1nc2ccccc2[nH]1 ZINC001204780358 1049263224 /nfs/dbraw/zinc/26/32/24/1049263224.db2.gz VITCMQCJMBQAEY-SFHVURJKSA-N 1 2 309.388 4.429 20 0 DIADLO Fc1ccccc1[C@@H]1CCCC[N@H+]1Cc1nc2ccccc2[nH]1 ZINC001204780358 1049263235 /nfs/dbraw/zinc/26/32/35/1049263235.db2.gz VITCMQCJMBQAEY-SFHVURJKSA-N 1 2 309.388 4.429 20 0 DIADLO CCC(CC)([NH2+]Cc1ccc(Cl)c2ccccc12)C(=O)OC ZINC001193840206 1049264004 /nfs/dbraw/zinc/26/40/04/1049264004.db2.gz XLADBVMWENGKSE-UHFFFAOYSA-N 1 2 319.832 4.315 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@@H+]1CCOc3cccc(F)c3C1)CCC2 ZINC001193799005 1049266239 /nfs/dbraw/zinc/26/62/39/1049266239.db2.gz XBVWSCULZIXAET-SFHVURJKSA-N 1 2 315.363 4.237 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@H+]1CCOc3cccc(F)c3C1)CCC2 ZINC001193799005 1049266251 /nfs/dbraw/zinc/26/62/51/1049266251.db2.gz XBVWSCULZIXAET-SFHVURJKSA-N 1 2 315.363 4.237 20 0 DIADLO FC(F)C[N@@H+](Cc1ccccc1)C[C@@H]1CCc2ccccc21 ZINC001180071609 1049272125 /nfs/dbraw/zinc/27/21/25/1049272125.db2.gz DCEPTIZIDHCZSK-KRWDZBQOSA-N 1 2 301.380 4.484 20 0 DIADLO FC(F)C[N@H+](Cc1ccccc1)C[C@@H]1CCc2ccccc21 ZINC001180071609 1049272136 /nfs/dbraw/zinc/27/21/36/1049272136.db2.gz DCEPTIZIDHCZSK-KRWDZBQOSA-N 1 2 301.380 4.484 20 0 DIADLO Cc1nn(C)c2ccc(Nc3cc[nH+]c4ccc(Cl)cc34)cc12 ZINC001204839799 1049282307 /nfs/dbraw/zinc/28/23/07/1049282307.db2.gz HCGGPFGTBVXXMM-UHFFFAOYSA-N 1 2 322.799 4.249 20 0 DIADLO CNc1cc(-c2ccc(OC)cc2OCc2ccccc2)cc[nH+]1 ZINC001204860873 1049287777 /nfs/dbraw/zinc/28/77/77/1049287777.db2.gz HKYRHJZJNZXUBX-UHFFFAOYSA-N 1 2 320.392 4.378 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)cc(C)n1 ZINC001180112556 1049288562 /nfs/dbraw/zinc/28/85/62/1049288562.db2.gz LTEWGWFBTGWFFG-ZDUSSCGKSA-N 1 2 302.368 4.096 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)cc(C)n1 ZINC001180112556 1049288569 /nfs/dbraw/zinc/28/85/69/1049288569.db2.gz LTEWGWFBTGWFFG-ZDUSSCGKSA-N 1 2 302.368 4.096 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@H]2C)cc(C)n1 ZINC001180112555 1049289795 /nfs/dbraw/zinc/28/97/95/1049289795.db2.gz LTEWGWFBTGWFFG-CYBMUJFWSA-N 1 2 302.368 4.096 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(F)cc(F)cc3[C@H]2C)cc(C)n1 ZINC001180112555 1049289807 /nfs/dbraw/zinc/28/98/07/1049289807.db2.gz LTEWGWFBTGWFFG-CYBMUJFWSA-N 1 2 302.368 4.096 20 0 DIADLO C[C@@H]1C[N@H+](CCc2c(Cl)cccc2Cl)C[C@@H](C2CC2)O1 ZINC001193976905 1049290637 /nfs/dbraw/zinc/29/06/37/1049290637.db2.gz NBFRJLFEGDDBQN-BZNIZROVSA-N 1 2 314.256 4.035 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)C[C@@H](C2CC2)O1 ZINC001193976905 1049290650 /nfs/dbraw/zinc/29/06/50/1049290650.db2.gz NBFRJLFEGDDBQN-BZNIZROVSA-N 1 2 314.256 4.035 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC000339013378 1049290758 /nfs/dbraw/zinc/29/07/58/1049290758.db2.gz XZWAYNRMZQXOLB-HXUWFJFHSA-N 1 2 310.441 4.087 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC000339013378 1049290774 /nfs/dbraw/zinc/29/07/74/1049290774.db2.gz XZWAYNRMZQXOLB-HXUWFJFHSA-N 1 2 310.441 4.087 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@H](C)c3ccco3)c2)[nH+]c1C ZINC000858739559 1049291613 /nfs/dbraw/zinc/29/16/13/1049291613.db2.gz HWXHQMBBUZVMDU-LBPRGKRZSA-N 1 2 323.396 4.419 20 0 DIADLO CCCC[C@H](CC)COC(=O)NCc1c[nH+]cn1CC1CCC1 ZINC001193983745 1049292815 /nfs/dbraw/zinc/29/28/15/1049292815.db2.gz LGSVYHVOLNNWHJ-HNNXBMFYSA-N 1 2 321.465 4.126 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](C/C=C/c2cccc(F)c2)CCO1 ZINC001180121326 1049292951 /nfs/dbraw/zinc/29/29/51/1049292951.db2.gz QNPKIDYPGBSUSM-MUPIXQSSSA-N 1 2 311.400 4.221 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](C/C=C/c2cccc(F)c2)CCO1 ZINC001180121326 1049292961 /nfs/dbraw/zinc/29/29/61/1049292961.db2.gz QNPKIDYPGBSUSM-MUPIXQSSSA-N 1 2 311.400 4.221 20 0 DIADLO C[N@H+](CCc1ccccc1F)Cc1c(F)ccc(F)c1Cl ZINC001180173886 1049294048 /nfs/dbraw/zinc/29/40/48/1049294048.db2.gz HRQUKACOSPXRGE-UHFFFAOYSA-N 1 2 313.750 4.432 20 0 DIADLO C[N@@H+](CCc1ccccc1F)Cc1c(F)ccc(F)c1Cl ZINC001180173886 1049294062 /nfs/dbraw/zinc/29/40/62/1049294062.db2.gz HRQUKACOSPXRGE-UHFFFAOYSA-N 1 2 313.750 4.432 20 0 DIADLO CC(C)([NH2+]Cc1ccc(CSC(F)F)o1)c1nccs1 ZINC000116379950 1049296421 /nfs/dbraw/zinc/29/64/21/1049296421.db2.gz WRKQULDICBUESK-UHFFFAOYSA-N 1 2 318.414 4.217 20 0 DIADLO C[N@H+](Cc1ccoc1)Cc1ccc(Oc2ccc(F)cc2)nc1 ZINC001180157760 1049302728 /nfs/dbraw/zinc/30/27/28/1049302728.db2.gz PDLXXRZWFVNCNE-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO C[N@@H+](Cc1ccoc1)Cc1ccc(Oc2ccc(F)cc2)nc1 ZINC001180157760 1049302737 /nfs/dbraw/zinc/30/27/37/1049302737.db2.gz PDLXXRZWFVNCNE-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO CNc1cc(-c2ccc(OCc3ccccc3)cc2OC)cc[nH+]1 ZINC001204895453 1049303859 /nfs/dbraw/zinc/30/38/59/1049303859.db2.gz JOGDKPJDZJFPEI-UHFFFAOYSA-N 1 2 320.392 4.378 20 0 DIADLO CC[C@H]1C[N@H+](Cc2ccc(Oc3ccccc3)o2)C[C@@H](C)O1 ZINC001204898928 1049304497 /nfs/dbraw/zinc/30/44/97/1049304497.db2.gz NIUFUMVMHLAOFJ-CABCVRRESA-N 1 2 301.386 4.071 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)o2)C[C@@H](C)O1 ZINC001204898928 1049304506 /nfs/dbraw/zinc/30/45/06/1049304506.db2.gz NIUFUMVMHLAOFJ-CABCVRRESA-N 1 2 301.386 4.071 20 0 DIADLO Cc1cc2cc(Nc3ccc(N4CCCCC4)[nH+]c3)cnc2[nH]1 ZINC001204897617 1049304548 /nfs/dbraw/zinc/30/45/48/1049304548.db2.gz YMUWXJLDSQSRKI-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)Oc1ccc(Cl)cc1 ZINC001194055361 1049308842 /nfs/dbraw/zinc/30/88/42/1049308842.db2.gz BQYBNXNWINIUHQ-UHFFFAOYSA-N 1 2 313.744 4.137 20 0 DIADLO Cc1cc2cc(Nc3[nH+]cccc3N3CCCCC3)cnc2[nH]1 ZINC001204911570 1049308926 /nfs/dbraw/zinc/30/89/26/1049308926.db2.gz UWQADCQFFYKUQO-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c(F)c1 ZINC001204928173 1049313217 /nfs/dbraw/zinc/31/32/17/1049313217.db2.gz HHNQSFXPVKVNBG-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)c(F)c1 ZINC001204928173 1049313222 /nfs/dbraw/zinc/31/32/22/1049313222.db2.gz HHNQSFXPVKVNBG-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO CCc1ccc([N@H+](CC[C@@H]2COC(C)(C)O2)CC(C)C)cc1 ZINC001194066751 1049314348 /nfs/dbraw/zinc/31/43/48/1049314348.db2.gz PVGXBGCHBGVXLP-GOSISDBHSA-N 1 2 305.462 4.253 20 0 DIADLO CCc1ccc([N@@H+](CC[C@@H]2COC(C)(C)O2)CC(C)C)cc1 ZINC001194066751 1049314357 /nfs/dbraw/zinc/31/43/57/1049314357.db2.gz PVGXBGCHBGVXLP-GOSISDBHSA-N 1 2 305.462 4.253 20 0 DIADLO CC[C@H]1CCC[N@H+](Cc2c(F)cc(Br)cc2F)C1 ZINC001180199833 1049315325 /nfs/dbraw/zinc/31/53/25/1049315325.db2.gz ZFOVAWYLKUUXJA-JTQLQIEISA-N 1 2 318.205 4.349 20 0 DIADLO CC[C@H]1CCC[N@@H+](Cc2c(F)cc(Br)cc2F)C1 ZINC001180199833 1049315333 /nfs/dbraw/zinc/31/53/33/1049315333.db2.gz ZFOVAWYLKUUXJA-JTQLQIEISA-N 1 2 318.205 4.349 20 0 DIADLO FC(F)(F)c1cnc(Nc2ccn3cc[nH+]c3c2)c(Cl)c1 ZINC001204942968 1049316905 /nfs/dbraw/zinc/31/69/05/1049316905.db2.gz DLWYRHJJIQRACF-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2ccc(F)c(C(F)(F)F)c2)[C@H]1C ZINC001180199061 1049317273 /nfs/dbraw/zinc/31/72/73/1049317273.db2.gz OSHFLXMWDRSJEB-VHSXEESVSA-N 1 2 307.356 4.170 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2ccc(F)c(C(F)(F)F)c2)[C@H]1C ZINC001180199061 1049317284 /nfs/dbraw/zinc/31/72/84/1049317284.db2.gz OSHFLXMWDRSJEB-VHSXEESVSA-N 1 2 307.356 4.170 20 0 DIADLO c1cn2ccc(Nc3ncccc3Oc3ccccc3)cc2[nH+]1 ZINC001204951559 1049319243 /nfs/dbraw/zinc/31/92/43/1049319243.db2.gz VNPVXPQRRKBITE-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO Clc1ccc(-c2cc(Nc3ccn4cc[nH+]c4c3)on2)cc1 ZINC001204950911 1049319690 /nfs/dbraw/zinc/31/96/90/1049319690.db2.gz GXRAMESIVGHRMC-UHFFFAOYSA-N 1 2 310.744 4.386 20 0 DIADLO CC[C@H]1COCC[N@@H+]1Cc1cnc(-c2ccc(C)c(C)c2)s1 ZINC001180239091 1049319804 /nfs/dbraw/zinc/31/98/04/1049319804.db2.gz FSLGUUJXQTXYMP-INIZCTEOSA-N 1 2 316.470 4.038 20 0 DIADLO CC[C@H]1COCC[N@H+]1Cc1cnc(-c2ccc(C)c(C)c2)s1 ZINC001180239091 1049319810 /nfs/dbraw/zinc/31/98/10/1049319810.db2.gz FSLGUUJXQTXYMP-INIZCTEOSA-N 1 2 316.470 4.038 20 0 DIADLO Fc1ccc(Oc2ccc(Nc3ccn4cc[nH+]c4c3)cn2)cc1 ZINC001204958833 1049322634 /nfs/dbraw/zinc/32/26/34/1049322634.db2.gz CGOQMVAZQKRRBF-UHFFFAOYSA-N 1 2 320.327 4.404 20 0 DIADLO Cc1cc(Br)cc(Nc2ccn3cc[nH+]c3c2)c1 ZINC001204977723 1049327714 /nfs/dbraw/zinc/32/77/14/1049327714.db2.gz JOWGXYYRUAHLPN-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO Fc1cc(Nc2ccn3cc[nH+]c3c2)c(F)cc1Br ZINC001204977660 1049329610 /nfs/dbraw/zinc/32/96/10/1049329610.db2.gz IHARNBFGKFRBFY-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc(Cl)ccc2Cl)C[C@H](C)C1(F)F ZINC000859415644 1049332744 /nfs/dbraw/zinc/33/27/44/1049332744.db2.gz SVIVTNLMZYIOED-DTORHVGOSA-N 1 2 309.187 4.112 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc(Cl)ccc2Cl)C[C@H](C)C1(F)F ZINC000859415644 1049332751 /nfs/dbraw/zinc/33/27/51/1049332751.db2.gz SVIVTNLMZYIOED-DTORHVGOSA-N 1 2 309.187 4.112 20 0 DIADLO Fc1ccc(Nc2ccn3cc[nH+]c3c2)c(F)c1Br ZINC001204997623 1049335553 /nfs/dbraw/zinc/33/55/53/1049335553.db2.gz KNAGZHSXGLFKGZ-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2cc(C(F)(F)F)n[nH]2)cc1 ZINC001180296463 1049336597 /nfs/dbraw/zinc/33/65/97/1049336597.db2.gz IFKDJBKAUJPBEM-HNNXBMFYSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2cc(C(F)(F)F)n[nH]2)cc1 ZINC001180296463 1049336607 /nfs/dbraw/zinc/33/66/07/1049336607.db2.gz IFKDJBKAUJPBEM-HNNXBMFYSA-N 1 2 323.362 4.464 20 0 DIADLO Oc1cccc(-c2ccc(Nc3ccn4cc[nH+]c4c3)cc2)c1 ZINC001205006348 1049340528 /nfs/dbraw/zinc/34/05/28/1049340528.db2.gz WOMBLCSRXLZDRY-UHFFFAOYSA-N 1 2 301.349 4.451 20 0 DIADLO Cc1c(F)nccc1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC001180359247 1049341607 /nfs/dbraw/zinc/34/16/07/1049341607.db2.gz DMVOTXQXWIRAHX-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1c(F)nccc1C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC001180359247 1049341619 /nfs/dbraw/zinc/34/16/19/1049341619.db2.gz DMVOTXQXWIRAHX-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1cnc(Cl)n1[C@H]1CCCCO1 ZINC001205038432 1049350393 /nfs/dbraw/zinc/35/03/93/1049350393.db2.gz HZLFVJHOQDFVAY-CQSZACIVSA-N 1 2 320.824 4.245 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1ccnn1CC1CCC1 ZINC001180393234 1049353224 /nfs/dbraw/zinc/35/32/24/1049353224.db2.gz MGYMBJUBXFZGPJ-AWEZNQCLSA-N 1 2 301.409 4.015 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccnn1CC1CCC1 ZINC001180393234 1049353238 /nfs/dbraw/zinc/35/32/38/1049353238.db2.gz MGYMBJUBXFZGPJ-AWEZNQCLSA-N 1 2 301.409 4.015 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)cc1F ZINC001203794004 1049360579 /nfs/dbraw/zinc/36/05/79/1049360579.db2.gz UYQUZXGKDFREKU-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)cc1F ZINC001203794004 1049360591 /nfs/dbraw/zinc/36/05/91/1049360591.db2.gz UYQUZXGKDFREKU-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+](C)[C@@H](C)c2ccco2)c(Br)c1 ZINC000569221876 1049365869 /nfs/dbraw/zinc/36/58/69/1049365869.db2.gz JZMTZLDFAHHVFM-NSHDSACASA-N 1 2 324.218 4.244 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccco2)c(Br)c1 ZINC000569221876 1049365882 /nfs/dbraw/zinc/36/58/82/1049365882.db2.gz JZMTZLDFAHHVFM-NSHDSACASA-N 1 2 324.218 4.244 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)cc1Cl ZINC001180540983 1049378744 /nfs/dbraw/zinc/37/87/44/1049378744.db2.gz YAQPVHPAKZNFGA-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)cc1Cl ZINC001180540983 1049378758 /nfs/dbraw/zinc/37/87/58/1049378758.db2.gz YAQPVHPAKZNFGA-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Oc1ccc(-c2ccc(Nc3cccc4[nH+]ccn43)cc2)cc1 ZINC001205128651 1049388977 /nfs/dbraw/zinc/38/89/77/1049388977.db2.gz FWEQCFBSLJNWAQ-UHFFFAOYSA-N 1 2 301.349 4.451 20 0 DIADLO Cc1cccc(N2CC[NH+](Cc3ccc(Cl)cc3F)CC2)c1 ZINC001205131052 1049390282 /nfs/dbraw/zinc/39/02/82/1049390282.db2.gz ZIILESPZCUGGOZ-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO Cc1ccc([C@@H]2CCCN2c2cc(N3CCCCC3)[nH+]cn2)cc1 ZINC000486151407 1049393258 /nfs/dbraw/zinc/39/32/58/1049393258.db2.gz AFXRTCFUWLBDBS-SFHVURJKSA-N 1 2 322.456 4.117 20 0 DIADLO Cc1ccc([C@@H]2CCCN2c2cc(N3CCCCC3)nc[nH+]2)cc1 ZINC000486151407 1049393269 /nfs/dbraw/zinc/39/32/69/1049393269.db2.gz AFXRTCFUWLBDBS-SFHVURJKSA-N 1 2 322.456 4.117 20 0 DIADLO Cc1ccc([C@H]2CCCN2c2cc(N3CCCCC3)[nH+]cn2)cc1 ZINC000486151406 1049393789 /nfs/dbraw/zinc/39/37/89/1049393789.db2.gz AFXRTCFUWLBDBS-GOSISDBHSA-N 1 2 322.456 4.117 20 0 DIADLO Cc1ccc([C@H]2CCCN2c2cc(N3CCCCC3)nc[nH+]2)cc1 ZINC000486151406 1049393803 /nfs/dbraw/zinc/39/38/03/1049393803.db2.gz AFXRTCFUWLBDBS-GOSISDBHSA-N 1 2 322.456 4.117 20 0 DIADLO Cc1cc(CN2CCc3c2cccc3Cl)c2c([nH+]1)CCCC2 ZINC001180750778 1049401716 /nfs/dbraw/zinc/40/17/16/1049401716.db2.gz GLGJFFJNHMDPQL-UHFFFAOYSA-N 1 2 312.844 4.485 20 0 DIADLO COc1ccccc1OCCOc1cc(C)[nH+]c2ccccc21 ZINC000486233710 1049403433 /nfs/dbraw/zinc/40/34/33/1049403433.db2.gz XIYLYWZYGCXKLR-UHFFFAOYSA-N 1 2 309.365 4.010 20 0 DIADLO Cc1cc(OCc2cc(-c3ccco3)on2)c2ccccc2[nH+]1 ZINC000486216229 1049403574 /nfs/dbraw/zinc/40/35/74/1049403574.db2.gz NYHCLHDWWPIHNU-UHFFFAOYSA-N 1 2 306.321 4.370 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2c(F)cc(F)c(F)c2F)cc1 ZINC001205185044 1049403923 /nfs/dbraw/zinc/40/39/23/1049403923.db2.gz FYOQFBLIKAIBDN-UHFFFAOYSA-N 1 2 306.262 4.311 20 0 DIADLO Cc1cc(C[N@H+](Cc2cccnc2)Cc2ccccn2)ccc1F ZINC001205186946 1049405668 /nfs/dbraw/zinc/40/56/68/1049405668.db2.gz HLSKEEKGZXBNSU-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cc(C[N@@H+](Cc2cccnc2)Cc2ccccn2)ccc1F ZINC001205186946 1049405673 /nfs/dbraw/zinc/40/56/73/1049405673.db2.gz HLSKEEKGZXBNSU-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(O)c(F)c1F)c1cc2ccccc2o1 ZINC001180908796 1049417005 /nfs/dbraw/zinc/41/70/05/1049417005.db2.gz ZZEFSYLWLSIUKA-JTQLQIEISA-N 1 2 303.308 4.267 20 0 DIADLO CC(C)Oc1ccc[nH+]c1N[C@@H]1CCOC2(CCCCC2)C1 ZINC001180952060 1049423016 /nfs/dbraw/zinc/42/30/16/1049423016.db2.gz KWQXCGZYYLBADP-OAHLLOKOSA-N 1 2 304.434 4.163 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000339021751 1049422962 /nfs/dbraw/zinc/42/29/62/1049422962.db2.gz LUNFMHNJXZEJIB-KRWDZBQOSA-N 1 2 316.470 4.148 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000339021751 1049422969 /nfs/dbraw/zinc/42/29/69/1049422969.db2.gz LUNFMHNJXZEJIB-KRWDZBQOSA-N 1 2 316.470 4.148 20 0 DIADLO CC(C)Oc1ccc[nH+]c1N[C@H]1CCOC2(CCCCC2)C1 ZINC001180952055 1049423458 /nfs/dbraw/zinc/42/34/58/1049423458.db2.gz KWQXCGZYYLBADP-HNNXBMFYSA-N 1 2 304.434 4.163 20 0 DIADLO Cc1ccc(C[N@@H+]2Cc3ccccc3OC(C)(C)C2)c(Cl)n1 ZINC001194816906 1049434150 /nfs/dbraw/zinc/43/41/50/1049434150.db2.gz MIIZRHCFEVYZBM-UHFFFAOYSA-N 1 2 316.832 4.217 20 0 DIADLO Cc1ccc(C[N@H+]2Cc3ccccc3OC(C)(C)C2)c(Cl)n1 ZINC001194816906 1049434152 /nfs/dbraw/zinc/43/41/52/1049434152.db2.gz MIIZRHCFEVYZBM-UHFFFAOYSA-N 1 2 316.832 4.217 20 0 DIADLO C[C@H](c1nc(-c2cccs2)no1)[N@H+](C)Cc1ccsc1 ZINC000152925573 1049450117 /nfs/dbraw/zinc/45/01/17/1049450117.db2.gz IPSJYDUEILGQLV-SNVBAGLBSA-N 1 2 305.428 4.053 20 0 DIADLO C[C@H](c1nc(-c2cccs2)no1)[N@@H+](C)Cc1ccsc1 ZINC000152925573 1049450126 /nfs/dbraw/zinc/45/01/26/1049450126.db2.gz IPSJYDUEILGQLV-SNVBAGLBSA-N 1 2 305.428 4.053 20 0 DIADLO Cc1c(-c2ccc(Oc3ccccc3)nc2)ccc2[nH+]ccn21 ZINC001205367797 1049452551 /nfs/dbraw/zinc/45/25/51/1049452551.db2.gz RDDOPOYHMRKCCL-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO Cc1nn(C[N@H+](CC2CCCCC2)C2CC2)c(=S)n1C1CC1 ZINC000101536346 1049457515 /nfs/dbraw/zinc/45/75/15/1049457515.db2.gz WEYZPANKYGNDES-UHFFFAOYSA-N 1 2 320.506 4.060 20 0 DIADLO Cc1nn(C[N@@H+](CC2CCCCC2)C2CC2)c(=S)n1C1CC1 ZINC000101536346 1049457518 /nfs/dbraw/zinc/45/75/18/1049457518.db2.gz WEYZPANKYGNDES-UHFFFAOYSA-N 1 2 320.506 4.060 20 0 DIADLO CCOc1ccccc1N(C)Cc1cc(C)[nH+]c2c1CCCC2 ZINC001205412022 1049463731 /nfs/dbraw/zinc/46/37/31/1049463731.db2.gz WAICDTQHGJTHLN-UHFFFAOYSA-N 1 2 310.441 4.304 20 0 DIADLO C[N@H+](Cc1ccc(C(F)(F)F)nc1)Cc1ccc(F)cc1F ZINC001205444112 1049472770 /nfs/dbraw/zinc/47/27/70/1049472770.db2.gz OLXAVGFOVHFQQZ-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO C[N@@H+](Cc1ccc(C(F)(F)F)nc1)Cc1ccc(F)cc1F ZINC001205444112 1049472778 /nfs/dbraw/zinc/47/27/78/1049472778.db2.gz OLXAVGFOVHFQQZ-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO CC(C)C1(C)CC[NH+](Cc2nc(Br)cs2)CC1 ZINC001205486195 1049483021 /nfs/dbraw/zinc/48/30/21/1049483021.db2.gz JPKCYKXNHIHEEC-UHFFFAOYSA-N 1 2 317.296 4.164 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@@H+]1CC[C@@](F)(c2ccccc2C)C1 ZINC001205517642 1049491507 /nfs/dbraw/zinc/49/15/07/1049491507.db2.gz UASRQBUKZXSLQE-KRWDZBQOSA-N 1 2 321.827 4.005 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@H+]1CC[C@@](F)(c2ccccc2C)C1 ZINC001205517642 1049491512 /nfs/dbraw/zinc/49/15/12/1049491512.db2.gz UASRQBUKZXSLQE-KRWDZBQOSA-N 1 2 321.827 4.005 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccnc(Cl)c2Cl)C[C@H](C)C1(F)F ZINC000862438341 1049493830 /nfs/dbraw/zinc/49/38/30/1049493830.db2.gz ADYMXDWPNSBFIA-DTORHVGOSA-N 1 2 309.187 4.112 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccnc(Cl)c2Cl)C[C@H](C)C1(F)F ZINC000862438341 1049493834 /nfs/dbraw/zinc/49/38/34/1049493834.db2.gz ADYMXDWPNSBFIA-DTORHVGOSA-N 1 2 309.187 4.112 20 0 DIADLO CC(C)(C)C[C@H]1CC[N@H+](Cc2ncsc2Br)C1 ZINC001195213916 1049497860 /nfs/dbraw/zinc/49/78/60/1049497860.db2.gz MAGXDKHXOIWRAB-SNVBAGLBSA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)(C)C[C@H]1CC[N@@H+](Cc2ncsc2Br)C1 ZINC001195213916 1049497865 /nfs/dbraw/zinc/49/78/65/1049497865.db2.gz MAGXDKHXOIWRAB-SNVBAGLBSA-N 1 2 317.296 4.164 20 0 DIADLO Clc1nccc(C[NH+]2CC(Cc3cccs3)C2)c1Cl ZINC000862538633 1049501268 /nfs/dbraw/zinc/50/12/68/1049501268.db2.gz BPOQPRKPNKLSEO-UHFFFAOYSA-N 1 2 313.253 4.124 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCC[C@H](C3CCC3)C2)s1 ZINC000668719054 1049502711 /nfs/dbraw/zinc/50/27/11/1049502711.db2.gz RXPYHAISWVWJMJ-NSHDSACASA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCC[C@H](C3CCC3)C2)s1 ZINC000668719054 1049502722 /nfs/dbraw/zinc/50/27/22/1049502722.db2.gz RXPYHAISWVWJMJ-NSHDSACASA-N 1 2 304.381 4.174 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ncco2)cc1OC ZINC000924820625 1049506023 /nfs/dbraw/zinc/50/60/23/1049506023.db2.gz QQOVHPXAPPZUNV-ZIAGYGMSSA-N 1 2 318.417 4.274 20 0 DIADLO C[C@@H]1CCC[C@@H]([NH2+]c2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC001205619795 1049514317 /nfs/dbraw/zinc/51/43/17/1049514317.db2.gz AXGSOLZSRNAMRI-XLMAVXFVSA-N 1 2 302.462 4.291 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@H+]1C[C@@H]1CCC2(CCCC2)O1 ZINC000794446378 1049514954 /nfs/dbraw/zinc/51/49/54/1049514954.db2.gz RYLRKFFMFYXNQR-KBPBESRZSA-N 1 2 308.853 4.010 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@@H+]1C[C@@H]1CCC2(CCCC2)O1 ZINC000794446378 1049514966 /nfs/dbraw/zinc/51/49/66/1049514966.db2.gz RYLRKFFMFYXNQR-KBPBESRZSA-N 1 2 308.853 4.010 20 0 DIADLO Cc1cc(C[NH+]2CC(Cc3ccccc3Cl)C2)cc(Cl)n1 ZINC001205706580 1049536770 /nfs/dbraw/zinc/53/67/70/1049536770.db2.gz OMFFPVWSPASDPC-UHFFFAOYSA-N 1 2 321.251 4.371 20 0 DIADLO C[C@@H]([NH2+][C@@H](Cc1ccccc1)c1ncco1)c1cccc(F)c1 ZINC001195558036 1049540983 /nfs/dbraw/zinc/54/09/83/1049540983.db2.gz MKWWGBUVUBXDKV-KDOFPFPSSA-N 1 2 310.372 4.448 20 0 DIADLO C[C@@H]([NH2+][C@H](Cc1ccccc1)c1ncco1)c1cccc(F)c1 ZINC001195558040 1049541753 /nfs/dbraw/zinc/54/17/53/1049541753.db2.gz MKWWGBUVUBXDKV-RDTXWAMCSA-N 1 2 310.372 4.448 20 0 DIADLO COc1nsc(C[N@@H+]2CCC=C(c3ccccc3)C2)c1Cl ZINC001205750952 1049552762 /nfs/dbraw/zinc/55/27/62/1049552762.db2.gz UINCENOYIAJXBN-UHFFFAOYSA-N 1 2 320.845 4.094 20 0 DIADLO COc1nsc(C[N@H+]2CCC=C(c3ccccc3)C2)c1Cl ZINC001205750952 1049552774 /nfs/dbraw/zinc/55/27/74/1049552774.db2.gz UINCENOYIAJXBN-UHFFFAOYSA-N 1 2 320.845 4.094 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]C/C=C\c1ccncc1)c1ccco1 ZINC000487326796 1049554118 /nfs/dbraw/zinc/55/41/18/1049554118.db2.gz SHNGCGODMUXQEA-RDBXKPKDSA-N 1 2 320.392 4.076 20 0 DIADLO COc1ccc(-c2ccccc2C)cc1C[N@H+](C1CC1)C1COC1 ZINC001181988359 1049555898 /nfs/dbraw/zinc/55/58/98/1049555898.db2.gz ZMLDERRBQUJHIW-UHFFFAOYSA-N 1 2 323.436 4.034 20 0 DIADLO COc1ccc(-c2ccccc2C)cc1C[N@@H+](C1CC1)C1COC1 ZINC001181988359 1049555907 /nfs/dbraw/zinc/55/59/07/1049555907.db2.gz ZMLDERRBQUJHIW-UHFFFAOYSA-N 1 2 323.436 4.034 20 0 DIADLO C[C@@H]1C[N@H+](CCc2c(Cl)cccc2Cl)CC2(CCC2)O1 ZINC001195756703 1049563202 /nfs/dbraw/zinc/56/32/02/1049563202.db2.gz JAUPBOWJISZJJZ-GFCCVEGCSA-N 1 2 314.256 4.179 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)CC2(CCC2)O1 ZINC001195756703 1049563210 /nfs/dbraw/zinc/56/32/10/1049563210.db2.gz JAUPBOWJISZJJZ-GFCCVEGCSA-N 1 2 314.256 4.179 20 0 DIADLO CCOc1c(F)c(F)ccc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001205783054 1049563181 /nfs/dbraw/zinc/56/31/81/1049563181.db2.gz SSEIEOIGAVFNMB-UHFFFAOYSA-N 1 2 318.245 4.027 20 0 DIADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1cccc(C(F)(F)F)c1 ZINC001195861574 1049577204 /nfs/dbraw/zinc/57/72/04/1049577204.db2.gz JMWAVVNTLDXADY-CQSZACIVSA-N 1 2 301.352 4.095 20 0 DIADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1cccc(C(F)(F)F)c1 ZINC001195861574 1049577212 /nfs/dbraw/zinc/57/72/12/1049577212.db2.gz JMWAVVNTLDXADY-CQSZACIVSA-N 1 2 301.352 4.095 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2CC=C(Cl)Cl)cc1F ZINC001195939032 1049585047 /nfs/dbraw/zinc/58/50/47/1049585047.db2.gz WAJGYWPQLYLRMG-LBPRGKRZSA-N 1 2 304.192 4.290 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2CC=C(Cl)Cl)cc1F ZINC001195939032 1049585060 /nfs/dbraw/zinc/58/50/60/1049585060.db2.gz WAJGYWPQLYLRMG-LBPRGKRZSA-N 1 2 304.192 4.290 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1ncc(Cl)cc1Cl ZINC000488006939 1049590629 /nfs/dbraw/zinc/59/06/29/1049590629.db2.gz HEYHTKHORJLJHE-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1ncc(Cl)cc1Cl ZINC000488006939 1049590636 /nfs/dbraw/zinc/59/06/36/1049590636.db2.gz HEYHTKHORJLJHE-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO CC[N@H+](Cc1ccc(C(F)F)cc1)[C@H](C)C(=O)OC(C)(C)C ZINC001196056564 1049605958 /nfs/dbraw/zinc/60/59/58/1049605958.db2.gz LPRWMAIKDPMHDG-GFCCVEGCSA-N 1 2 313.388 4.176 20 0 DIADLO CC[N@@H+](Cc1ccc(C(F)F)cc1)[C@H](C)C(=O)OC(C)(C)C ZINC001196056564 1049605962 /nfs/dbraw/zinc/60/59/62/1049605962.db2.gz LPRWMAIKDPMHDG-GFCCVEGCSA-N 1 2 313.388 4.176 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)cn1 ZINC001205931658 1049606362 /nfs/dbraw/zinc/60/63/62/1049606362.db2.gz GZQJUOVTOYFMKB-IBGZPJMESA-N 1 2 309.457 4.258 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)cn1 ZINC001205931658 1049606364 /nfs/dbraw/zinc/60/63/64/1049606364.db2.gz GZQJUOVTOYFMKB-IBGZPJMESA-N 1 2 309.457 4.258 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H](C)c1ccc(C(C)(C)O)cc1 ZINC000863983851 1049607184 /nfs/dbraw/zinc/60/71/84/1049607184.db2.gz WKXWSGLULYKAEG-OAHLLOKOSA-N 1 2 312.457 4.462 20 0 DIADLO COc1cccc2c1OCCC[C@@H]2Nc1ccc([NH+](C)C)cc1 ZINC000863986063 1049608587 /nfs/dbraw/zinc/60/85/87/1049608587.db2.gz XKRAOGHIUVMENC-KRWDZBQOSA-N 1 2 312.413 4.087 20 0 DIADLO C[C@@]1(F)CCC[N@H+](Cc2ccc(Oc3ccc(F)cc3)nc2)C1 ZINC001205959433 1049611454 /nfs/dbraw/zinc/61/14/54/1049611454.db2.gz DYFIMYUSGGAJOV-GOSISDBHSA-N 1 2 318.367 4.337 20 0 DIADLO C[C@@]1(F)CCC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)nc2)C1 ZINC001205959433 1049611464 /nfs/dbraw/zinc/61/14/64/1049611464.db2.gz DYFIMYUSGGAJOV-GOSISDBHSA-N 1 2 318.367 4.337 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2cnn(C3CCC3)c2)c(F)c1 ZINC001182344355 1049629751 /nfs/dbraw/zinc/62/97/51/1049629751.db2.gz INIHFUDOMBADRM-GOSISDBHSA-N 1 2 317.383 4.223 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2cnn(C3CCC3)c2)c(F)c1 ZINC001182344355 1049629759 /nfs/dbraw/zinc/62/97/59/1049629759.db2.gz INIHFUDOMBADRM-GOSISDBHSA-N 1 2 317.383 4.223 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cc(Cl)ccc2F)c(OC)c1 ZINC001206027511 1049632660 /nfs/dbraw/zinc/63/26/60/1049632660.db2.gz AWDMZOANSFMFCJ-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2F)c(OC)c1 ZINC001206027511 1049632664 /nfs/dbraw/zinc/63/26/64/1049632664.db2.gz AWDMZOANSFMFCJ-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO CC(C)SCC[N@@H+]1CCO[C@@H](c2cccc(Cl)c2)[C@@H]1C ZINC001196253272 1049633594 /nfs/dbraw/zinc/63/35/94/1049633594.db2.gz ALQXWYMUJUGYQT-XJKSGUPXSA-N 1 2 313.894 4.243 20 0 DIADLO CC(C)SCC[N@H+]1CCO[C@@H](c2cccc(Cl)c2)[C@@H]1C ZINC001196253272 1049633597 /nfs/dbraw/zinc/63/35/97/1049633597.db2.gz ALQXWYMUJUGYQT-XJKSGUPXSA-N 1 2 313.894 4.243 20 0 DIADLO C[N@H+](CCC(=O)c1cccs1)Cc1cc(Cl)ccc1F ZINC001206035494 1049636122 /nfs/dbraw/zinc/63/61/22/1049636122.db2.gz PSSNZVSCMULZNA-UHFFFAOYSA-N 1 2 311.809 4.245 20 0 DIADLO C[N@@H+](CCC(=O)c1cccs1)Cc1cc(Cl)ccc1F ZINC001206035494 1049636124 /nfs/dbraw/zinc/63/61/24/1049636124.db2.gz PSSNZVSCMULZNA-UHFFFAOYSA-N 1 2 311.809 4.245 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3ccc(F)cc3[nH]2)[C@@H](c2ccccc2)CO1 ZINC000488339758 1049637311 /nfs/dbraw/zinc/63/73/11/1049637311.db2.gz XOJBKPHIVKNGOW-VBKZILBWSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3ccc(F)cc3[nH]2)[C@@H](c2ccccc2)CO1 ZINC000488339758 1049637315 /nfs/dbraw/zinc/63/73/15/1049637315.db2.gz XOJBKPHIVKNGOW-VBKZILBWSA-N 1 2 324.399 4.269 20 0 DIADLO Fc1ccc2cc(C[N@@H+]3CCCC[C@H]3c3nccs3)[nH]c2c1 ZINC000488322545 1049637426 /nfs/dbraw/zinc/63/74/26/1049637426.db2.gz ABEUWYVSSUEZAU-INIZCTEOSA-N 1 2 315.417 4.491 20 0 DIADLO Fc1ccc2cc(C[N@H+]3CCCC[C@H]3c3nccs3)[nH]c2c1 ZINC000488322545 1049637433 /nfs/dbraw/zinc/63/74/33/1049637433.db2.gz ABEUWYVSSUEZAU-INIZCTEOSA-N 1 2 315.417 4.491 20 0 DIADLO Cl/C=C(/Cl)C[NH+]1CCC2(CCc3ccccc3O2)CC1 ZINC001196284647 1049638798 /nfs/dbraw/zinc/63/87/98/1049638798.db2.gz CTPALQCAEYGCBQ-SDNWHVSQSA-N 1 2 312.240 4.165 20 0 DIADLO CC(C)(C)[C@@H]1C[C@H](Nc2cccc(-n3cc[nH+]c3)c2)CS1 ZINC000488358875 1049641256 /nfs/dbraw/zinc/64/12/56/1049641256.db2.gz YNWPITRCCBJFJZ-HOCLYGCPSA-N 1 2 301.459 4.204 20 0 DIADLO CC(C)(C)[C@@H]1C[C@@H](Nc2cccc(-n3cc[nH+]c3)c2)CS1 ZINC000488358876 1049641364 /nfs/dbraw/zinc/64/13/64/1049641364.db2.gz YNWPITRCCBJFJZ-ZBFHGGJFSA-N 1 2 301.459 4.204 20 0 DIADLO CC[N@@H+]1CCCC[C@@H]1C(=O)O[C@@H](C)c1sc(C(C)C)nc1C ZINC000774304529 1049644845 /nfs/dbraw/zinc/64/48/45/1049644845.db2.gz NJIRRBBDGBDQFE-UONOGXRCSA-N 1 2 324.490 4.054 20 0 DIADLO CC[N@H+]1CCCC[C@@H]1C(=O)O[C@@H](C)c1sc(C(C)C)nc1C ZINC000774304529 1049644850 /nfs/dbraw/zinc/64/48/50/1049644850.db2.gz NJIRRBBDGBDQFE-UONOGXRCSA-N 1 2 324.490 4.054 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@H]3C[C@@]3(c3ccc(Cl)c(Cl)c3)C2)co1 ZINC001206080738 1049648693 /nfs/dbraw/zinc/64/86/93/1049648693.db2.gz GFOYQEBBRPGSFB-WBMJQRKESA-N 1 2 323.223 4.063 20 0 DIADLO Cc1nc(C[N@H+]2C[C@H]3C[C@@]3(c3ccc(Cl)c(Cl)c3)C2)co1 ZINC001206080738 1049648699 /nfs/dbraw/zinc/64/86/99/1049648699.db2.gz GFOYQEBBRPGSFB-WBMJQRKESA-N 1 2 323.223 4.063 20 0 DIADLO CCSc1nn(C[N@H+](C)[C@@H]2CCC(C)(C)C2)c(=S)s1 ZINC000794683419 1049654103 /nfs/dbraw/zinc/65/41/03/1049654103.db2.gz FABNPVHBEUBJPQ-SNVBAGLBSA-N 1 2 317.549 4.254 20 0 DIADLO CCSc1nn(C[N@@H+](C)[C@@H]2CCC(C)(C)C2)c(=S)s1 ZINC000794683419 1049654104 /nfs/dbraw/zinc/65/41/04/1049654104.db2.gz FABNPVHBEUBJPQ-SNVBAGLBSA-N 1 2 317.549 4.254 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(C(F)(F)F)c2)CN1c1cccc[nH+]1 ZINC000488490590 1049664527 /nfs/dbraw/zinc/66/45/27/1049664527.db2.gz QXZXHSZQOOJUMX-DOMZBBRYSA-N 1 2 322.330 4.067 20 0 DIADLO Cc1ccccc1C1CC(Nc2ccc(N3CCCC3)c[nH+]2)C1 ZINC001182501102 1049679426 /nfs/dbraw/zinc/67/94/26/1049679426.db2.gz YTLKQFCVCRNYOM-UHFFFAOYSA-N 1 2 307.441 4.348 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3cccc(Cl)c3C2)cc1F ZINC001206232304 1049685120 /nfs/dbraw/zinc/68/51/20/1049685120.db2.gz IOHLMKQIXZAXGZ-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3cccc(Cl)c3C2)cc1F ZINC001206232304 1049685128 /nfs/dbraw/zinc/68/51/28/1049685128.db2.gz IOHLMKQIXZAXGZ-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2cnc(Cl)n2C)o1 ZINC001204346521 1049685444 /nfs/dbraw/zinc/68/54/44/1049685444.db2.gz ACQOOVQIPFPNQA-IUODEOHRSA-N 1 2 321.852 4.202 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2cnc(Cl)n2C)o1 ZINC001204346521 1049685453 /nfs/dbraw/zinc/68/54/53/1049685453.db2.gz ACQOOVQIPFPNQA-IUODEOHRSA-N 1 2 321.852 4.202 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2cnc(Cl)n2C)o1 ZINC001204346520 1049686211 /nfs/dbraw/zinc/68/62/11/1049686211.db2.gz ACQOOVQIPFPNQA-DOMZBBRYSA-N 1 2 321.852 4.202 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2cnc(Cl)n2C)o1 ZINC001204346520 1049686216 /nfs/dbraw/zinc/68/62/16/1049686216.db2.gz ACQOOVQIPFPNQA-DOMZBBRYSA-N 1 2 321.852 4.202 20 0 DIADLO COc1cc(C)c(Br)cc1C[NH+]1CC2(C1)CCCC2 ZINC001250078609 1049697443 /nfs/dbraw/zinc/69/74/43/1049697443.db2.gz ACSRQZIXLZQWSV-UHFFFAOYSA-N 1 2 324.262 4.142 20 0 DIADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1ccc(C(F)(F)F)s1 ZINC001182756123 1049706222 /nfs/dbraw/zinc/70/62/22/1049706222.db2.gz WRBDSWNWNRUERA-JTQLQIEISA-N 1 2 307.381 4.156 20 0 DIADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1ccc(C(F)(F)F)s1 ZINC001182756123 1049706231 /nfs/dbraw/zinc/70/62/31/1049706231.db2.gz WRBDSWNWNRUERA-JTQLQIEISA-N 1 2 307.381 4.156 20 0 DIADLO CC(C)(C)C[C@H]1CC[N@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001206313785 1049707633 /nfs/dbraw/zinc/70/76/33/1049707633.db2.gz LJHOIAPIPYSCDF-SNVBAGLBSA-N 1 2 306.397 4.420 20 0 DIADLO CC(C)(C)C[C@H]1CC[N@@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001206313785 1049707644 /nfs/dbraw/zinc/70/76/44/1049707644.db2.gz LJHOIAPIPYSCDF-SNVBAGLBSA-N 1 2 306.397 4.420 20 0 DIADLO CC(C)c1nnc(C[NH+]2CC(c3ccccc3)(C(C)C)C2)s1 ZINC001206320306 1049711405 /nfs/dbraw/zinc/71/14/05/1049711405.db2.gz JPLVHCPNKBWXRA-UHFFFAOYSA-N 1 2 315.486 4.071 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1sccc1Br)C2 ZINC001206351011 1049717979 /nfs/dbraw/zinc/71/79/79/1049717979.db2.gz QJHZDHVDCXPSNT-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1sccc1Br)C2 ZINC001206351011 1049717984 /nfs/dbraw/zinc/71/79/84/1049717984.db2.gz QJHZDHVDCXPSNT-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCC[C@](F)(c3ccccc3)C2)c1 ZINC001197075928 1049718426 /nfs/dbraw/zinc/71/84/26/1049718426.db2.gz AQLOKTAHZUACAN-GOSISDBHSA-N 1 2 305.343 4.426 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCC[C@](F)(c3ccccc3)C2)c1 ZINC001197075928 1049718436 /nfs/dbraw/zinc/71/84/36/1049718436.db2.gz AQLOKTAHZUACAN-GOSISDBHSA-N 1 2 305.343 4.426 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCC[C@@](F)(c3ccccc3)C2)c1 ZINC001197075929 1049719504 /nfs/dbraw/zinc/71/95/04/1049719504.db2.gz AQLOKTAHZUACAN-SFHVURJKSA-N 1 2 305.343 4.426 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCC[C@@](F)(c3ccccc3)C2)c1 ZINC001197075929 1049719512 /nfs/dbraw/zinc/71/95/12/1049719512.db2.gz AQLOKTAHZUACAN-SFHVURJKSA-N 1 2 305.343 4.426 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2csc(C(C)(C)C)n2)cc1C ZINC000489062575 1049725064 /nfs/dbraw/zinc/72/50/64/1049725064.db2.gz NAUKQSFDSWFVBN-UHFFFAOYSA-N 1 2 318.486 4.390 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2csc(C(C)(C)C)n2)cc1C ZINC000489062575 1049725073 /nfs/dbraw/zinc/72/50/73/1049725073.db2.gz NAUKQSFDSWFVBN-UHFFFAOYSA-N 1 2 318.486 4.390 20 0 DIADLO CC(C)(C[NH+]1Cc2cc(F)c(F)cc2C1)Oc1ccccc1 ZINC001206455859 1049735816 /nfs/dbraw/zinc/73/58/16/1049735816.db2.gz IIKWJARUCDGGIE-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO Cc1cccc2c1C[N@H+]([C@@H](C)c1noc(-c3ccccc3)n1)CC2 ZINC000671243747 1049736503 /nfs/dbraw/zinc/73/65/03/1049736503.db2.gz UGKBCFMJIICYPM-HNNXBMFYSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1cccc2c1C[N@@H+]([C@@H](C)c1noc(-c3ccccc3)n1)CC2 ZINC000671243747 1049736510 /nfs/dbraw/zinc/73/65/10/1049736510.db2.gz UGKBCFMJIICYPM-HNNXBMFYSA-N 1 2 319.408 4.164 20 0 DIADLO CC[N@H+](Cc1ccccn1)[C@H](C)c1ccccc1Br ZINC000489334223 1049744392 /nfs/dbraw/zinc/74/43/92/1049744392.db2.gz SFQVYUSIKZOXRL-CYBMUJFWSA-N 1 2 319.246 4.427 20 0 DIADLO CC[N@@H+](Cc1ccccn1)[C@H](C)c1ccccc1Br ZINC000489334223 1049744401 /nfs/dbraw/zinc/74/44/01/1049744401.db2.gz SFQVYUSIKZOXRL-CYBMUJFWSA-N 1 2 319.246 4.427 20 0 DIADLO Clc1ccc(/C=C\C[N@@H+]2CCCC[C@H]2c2ncccn2)cc1 ZINC001197450755 1049753361 /nfs/dbraw/zinc/75/33/61/1049753361.db2.gz SLJQXAWFFIOCPL-IVZVJUQRSA-N 1 2 313.832 4.370 20 0 DIADLO Clc1ccc(/C=C\C[N@H+]2CCCC[C@H]2c2ncccn2)cc1 ZINC001197450755 1049753373 /nfs/dbraw/zinc/75/33/73/1049753373.db2.gz SLJQXAWFFIOCPL-IVZVJUQRSA-N 1 2 313.832 4.370 20 0 DIADLO CCc1nc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2(C)C)no1 ZINC001197480623 1049753827 /nfs/dbraw/zinc/75/38/27/1049753827.db2.gz DSFRVHUOHBNPCC-AWEZNQCLSA-N 1 2 319.836 4.054 20 0 DIADLO CCc1nc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2(C)C)no1 ZINC001197480623 1049753832 /nfs/dbraw/zinc/75/38/32/1049753832.db2.gz DSFRVHUOHBNPCC-AWEZNQCLSA-N 1 2 319.836 4.054 20 0 DIADLO Cc1ccc2ncc(C[N@@H+]3CCCC[C@@H]3c3ncccn3)cc2c1 ZINC001197451867 1049754311 /nfs/dbraw/zinc/75/43/11/1049754311.db2.gz ZDHZBZJWKNSIGH-LJQANCHMSA-N 1 2 318.424 4.060 20 0 DIADLO Cc1ccc2ncc(C[N@H+]3CCCC[C@@H]3c3ncccn3)cc2c1 ZINC001197451867 1049754320 /nfs/dbraw/zinc/75/43/20/1049754320.db2.gz ZDHZBZJWKNSIGH-LJQANCHMSA-N 1 2 318.424 4.060 20 0 DIADLO COc1ncccc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)s1 ZINC001206585190 1049762456 /nfs/dbraw/zinc/76/24/56/1049762456.db2.gz RPRRLGVUCLBMOH-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ncccc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)s1 ZINC001206585190 1049762464 /nfs/dbraw/zinc/76/24/64/1049762464.db2.gz RPRRLGVUCLBMOH-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO CCCn1c[nH+]cc1CN1CCc2ccc(Cl)c(Cl)c2C1 ZINC001206589593 1049764574 /nfs/dbraw/zinc/76/45/74/1049764574.db2.gz HEINKKUCICNZRU-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO Cc1cc(-c2ccc3cnn([C@H]4CCCCO4)c3c2)cc(C)[nH+]1 ZINC001206643009 1049775200 /nfs/dbraw/zinc/77/52/00/1049775200.db2.gz NAOHIDQSKRENLF-LJQANCHMSA-N 1 2 307.397 4.414 20 0 DIADLO CCC(C)(C)OC1C[NH+](Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC001206692020 1049780014 /nfs/dbraw/zinc/78/00/14/1049780014.db2.gz VSVROURNRCMROM-UHFFFAOYSA-N 1 2 317.404 4.475 20 0 DIADLO Cc1ccc(-c2ccc(C[NH+]3CCOCC3)cc2F)c2cc[nH]c21 ZINC001206734137 1049786631 /nfs/dbraw/zinc/78/66/31/1049786631.db2.gz SKNFQSFZBPVITF-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1Nc1ccc(Cl)c(Cl)c1O ZINC001206748380 1049791021 /nfs/dbraw/zinc/79/10/21/1049791021.db2.gz GHNVGFFMYHPNCJ-UHFFFAOYSA-N 1 2 312.200 4.212 20 0 DIADLO CCSc1nn(C[N@H+](C)CC2CCCCC2)c(=S)s1 ZINC000912787472 1049793048 /nfs/dbraw/zinc/79/30/48/1049793048.db2.gz WDRIGJVMLDTKRG-UHFFFAOYSA-N 1 2 317.549 4.256 20 0 DIADLO CCSc1nn(C[N@@H+](C)CC2CCCCC2)c(=S)s1 ZINC000912787472 1049793056 /nfs/dbraw/zinc/79/30/56/1049793056.db2.gz WDRIGJVMLDTKRG-UHFFFAOYSA-N 1 2 317.549 4.256 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3Cl)C2)no1 ZINC001206819988 1049806761 /nfs/dbraw/zinc/80/67/61/1049806761.db2.gz WPUHGBVTFXICMR-NSHDSACASA-N 1 2 311.212 4.279 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@H](c3cccc(Cl)c3Cl)C2)no1 ZINC001206819988 1049806770 /nfs/dbraw/zinc/80/67/70/1049806770.db2.gz WPUHGBVTFXICMR-NSHDSACASA-N 1 2 311.212 4.279 20 0 DIADLO c1c(C[N@@H+]2CCSc3ccccc3C2)noc1-c1ccccc1 ZINC001206848366 1049813359 /nfs/dbraw/zinc/81/33/59/1049813359.db2.gz XRRZUORPLHAZEF-UHFFFAOYSA-N 1 2 322.433 4.450 20 0 DIADLO c1c(C[N@H+]2CCSc3ccccc3C2)noc1-c1ccccc1 ZINC001206848366 1049813362 /nfs/dbraw/zinc/81/33/62/1049813362.db2.gz XRRZUORPLHAZEF-UHFFFAOYSA-N 1 2 322.433 4.450 20 0 DIADLO COc1cncc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)s2)c1 ZINC001206997043 1049818692 /nfs/dbraw/zinc/81/86/92/1049818692.db2.gz NULXUKQXTNPVTC-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cncc(C[N@H+]2CCC[C@H]2c2ccc(Cl)s2)c1 ZINC001206997043 1049818703 /nfs/dbraw/zinc/81/87/03/1049818703.db2.gz NULXUKQXTNPVTC-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1cccc(C2([NH2+]Cc3nnc(C(C)C)s3)CCC2)c1 ZINC000646022436 1049821733 /nfs/dbraw/zinc/82/17/33/1049821733.db2.gz DRJVMMIEOMVZQA-UHFFFAOYSA-N 1 2 301.459 4.139 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+](C)Cc1ncccc1F ZINC001207036955 1049822456 /nfs/dbraw/zinc/82/24/56/1049822456.db2.gz JDXZWYQBMIQOER-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+](C)Cc1ncccc1F ZINC001207036955 1049822465 /nfs/dbraw/zinc/82/24/65/1049822465.db2.gz JDXZWYQBMIQOER-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO COc1c(O)cccc1C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000490354609 1049824806 /nfs/dbraw/zinc/82/48/06/1049824806.db2.gz LQUMLPLNLCDMLQ-OAHLLOKOSA-N 1 2 303.789 4.001 20 0 DIADLO COc1c(O)cccc1C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000490354609 1049824824 /nfs/dbraw/zinc/82/48/24/1049824824.db2.gz LQUMLPLNLCDMLQ-OAHLLOKOSA-N 1 2 303.789 4.001 20 0 DIADLO Fc1cccc(OC(F)F)c1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC001207111673 1049836664 /nfs/dbraw/zinc/83/66/64/1049836664.db2.gz LZLNEPJZHRATCW-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(OC(F)F)c1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC001207111673 1049836674 /nfs/dbraw/zinc/83/66/74/1049836674.db2.gz LZLNEPJZHRATCW-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO CC(C)(C[N@H+]1C[C@@H](F)[C@@H](F)C1)Sc1ccc(Cl)cc1 ZINC001207295169 1049878128 /nfs/dbraw/zinc/87/81/28/1049878128.db2.gz KCZXEUCUFDJRRD-BETUJISGSA-N 1 2 305.821 4.203 20 0 DIADLO CC(C)(C[N@@H+]1C[C@@H](F)[C@@H](F)C1)Sc1ccc(Cl)cc1 ZINC001207295169 1049878133 /nfs/dbraw/zinc/87/81/33/1049878133.db2.gz KCZXEUCUFDJRRD-BETUJISGSA-N 1 2 305.821 4.203 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](CCc1cccc(Br)c1)C2 ZINC001207509668 1049901232 /nfs/dbraw/zinc/90/12/32/1049901232.db2.gz NUFIZZMXGZVNIF-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](CCc1cccc(Br)c1)C2 ZINC001207509668 1049901235 /nfs/dbraw/zinc/90/12/35/1049901235.db2.gz NUFIZZMXGZVNIF-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO c1nn(-c2ccccc2)c2c1C[N@@H+](CCCCc1ccccc1)C2 ZINC001207615119 1049918641 /nfs/dbraw/zinc/91/86/41/1049918641.db2.gz OIORRQHLIVRKRS-UHFFFAOYSA-N 1 2 317.436 4.211 20 0 DIADLO c1nn(-c2ccccc2)c2c1C[N@H+](CCCCc1ccccc1)C2 ZINC001207615119 1049918647 /nfs/dbraw/zinc/91/86/47/1049918647.db2.gz OIORRQHLIVRKRS-UHFFFAOYSA-N 1 2 317.436 4.211 20 0 DIADLO CC1(C)CCc2ccccc2[C@@H]([NH2+]Cc2nnsc2Cl)C1 ZINC000571267340 1049928449 /nfs/dbraw/zinc/92/84/49/1049928449.db2.gz XDSSDRKSZKDYSE-ZDUSSCGKSA-N 1 2 321.877 4.385 20 0 DIADLO CCOc1ccc(C[N@@H+]2CC[C@H]2c2ccc(F)cc2)cc1F ZINC001207724140 1049930577 /nfs/dbraw/zinc/93/05/77/1049930577.db2.gz UQXVOJYEBSOCMT-KRWDZBQOSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1ccc(C[N@H+]2CC[C@H]2c2ccc(F)cc2)cc1F ZINC001207724140 1049930584 /nfs/dbraw/zinc/93/05/84/1049930584.db2.gz UQXVOJYEBSOCMT-KRWDZBQOSA-N 1 2 303.352 4.311 20 0 DIADLO CCCCCC[N@H+](Cc1ccco1)Cc1ccnc(OC)c1F ZINC001207747904 1049933785 /nfs/dbraw/zinc/93/37/85/1049933785.db2.gz CYGZWQKRQDDVIN-UHFFFAOYSA-N 1 2 320.408 4.405 20 0 DIADLO CCCCCC[N@@H+](Cc1ccco1)Cc1ccnc(OC)c1F ZINC001207747904 1049933792 /nfs/dbraw/zinc/93/37/92/1049933792.db2.gz CYGZWQKRQDDVIN-UHFFFAOYSA-N 1 2 320.408 4.405 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000571531862 1049938656 /nfs/dbraw/zinc/93/86/56/1049938656.db2.gz PBHCSPPRZPWQOT-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO Cc1ccc(CCC[N@@H+]2Cc3cccc(Br)c3C2)o1 ZINC001207947560 1049963451 /nfs/dbraw/zinc/96/34/51/1049963451.db2.gz IAXNOWJRQIXGRX-UHFFFAOYSA-N 1 2 320.230 4.299 20 0 DIADLO Cc1ccc(CCC[N@H+]2Cc3cccc(Br)c3C2)o1 ZINC001207947560 1049963454 /nfs/dbraw/zinc/96/34/54/1049963454.db2.gz IAXNOWJRQIXGRX-UHFFFAOYSA-N 1 2 320.230 4.299 20 0 DIADLO c1cc2c(ncnc2Nc2ccc(NC3CCCC3)[nH+]c2)s1 ZINC000588163060 1049964538 /nfs/dbraw/zinc/96/45/38/1049964538.db2.gz JUCMVOYLIITCBL-UHFFFAOYSA-N 1 2 311.414 4.184 20 0 DIADLO CC(C)c1nc(C[N@H+](C)CCc2c(F)cccc2F)cs1 ZINC001208116488 1049974634 /nfs/dbraw/zinc/97/46/34/1049974634.db2.gz DBJDGQKNJGFDOD-UHFFFAOYSA-N 1 2 310.413 4.219 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)CCc2c(F)cccc2F)cs1 ZINC001208116488 1049974639 /nfs/dbraw/zinc/97/46/39/1049974639.db2.gz DBJDGQKNJGFDOD-UHFFFAOYSA-N 1 2 310.413 4.219 20 0 DIADLO Cc1ccc([C@H](C)CC[N@@H+]2Cc3cnn(-c4ccccc4)c3C2)o1 ZINC001208169752 1049981201 /nfs/dbraw/zinc/98/12/01/1049981201.db2.gz VCMRIGXULVYECQ-OAHLLOKOSA-N 1 2 321.424 4.283 20 0 DIADLO Cc1ccc([C@H](C)CC[N@H+]2Cc3cnn(-c4ccccc4)c3C2)o1 ZINC001208169752 1049981205 /nfs/dbraw/zinc/98/12/05/1049981205.db2.gz VCMRIGXULVYECQ-OAHLLOKOSA-N 1 2 321.424 4.283 20 0 DIADLO COc1cccc(/C=[NH+]/CCc2ccc3ccccc3c2)c1O ZINC000032074350 1050002390 /nfs/dbraw/zinc/00/23/90/1050002390.db2.gz FRYOROASXXJCSS-KGENOOAVSA-N 1 2 305.377 4.216 20 0 DIADLO CC/C=C\CCN1CCC[C@]2(CC[N@@H+]2Cc2cccc(F)c2)C1 ZINC001208729001 1050006793 /nfs/dbraw/zinc/00/67/93/1050006793.db2.gz YJLSJPJZJRUNBH-XQQSMPNESA-N 1 2 316.464 4.222 20 0 DIADLO CC/C=C\CCN1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001208729001 1050006796 /nfs/dbraw/zinc/00/67/96/1050006796.db2.gz YJLSJPJZJRUNBH-XQQSMPNESA-N 1 2 316.464 4.222 20 0 DIADLO Cc1csc(-c2ccc(Nc3[nH+]cnc4[nH]ccc43)cc2)n1 ZINC000588897403 1050011200 /nfs/dbraw/zinc/01/12/00/1050011200.db2.gz CWPFGWJRLJLDHK-UHFFFAOYSA-N 1 2 307.382 4.133 20 0 DIADLO CCCC[N@H+](Cc1nnc(C(C)C)o1)[C@H](C)c1ccc(C)o1 ZINC000588937988 1050013742 /nfs/dbraw/zinc/01/37/42/1050013742.db2.gz RXNSNESNNINIIS-CQSZACIVSA-N 1 2 305.422 4.458 20 0 DIADLO CCCC[N@@H+](Cc1nnc(C(C)C)o1)[C@H](C)c1ccc(C)o1 ZINC000588937988 1050013747 /nfs/dbraw/zinc/01/37/47/1050013747.db2.gz RXNSNESNNINIIS-CQSZACIVSA-N 1 2 305.422 4.458 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+][C@H]1CCCc2oc(C)nc21 ZINC000924858801 1050035630 /nfs/dbraw/zinc/03/56/30/1050035630.db2.gz NHMFHWVQXYVXKI-WFASDCNBSA-N 1 2 300.402 4.110 20 0 DIADLO Cc1nc([C@@H]([NH2+]C[C@@H](C)CC(C)C)c2ccc(Cl)cc2)no1 ZINC000572646784 1050039263 /nfs/dbraw/zinc/03/92/63/1050039263.db2.gz KSEZENFXDUQZPW-LRDDRELGSA-N 1 2 321.852 4.393 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1cccc(Cl)c1 ZINC000589605358 1050048252 /nfs/dbraw/zinc/04/82/52/1050048252.db2.gz XCGNDYNAKOFFQL-KDOFPFPSSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1cccc(Cl)c1 ZINC000589605358 1050048255 /nfs/dbraw/zinc/04/82/55/1050048255.db2.gz XCGNDYNAKOFFQL-KDOFPFPSSA-N 1 2 301.817 4.302 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@H](c3ccccc3)CC2)no1 ZINC000589610216 1050049289 /nfs/dbraw/zinc/04/92/89/1050049289.db2.gz VHUPLCLTEHZXOV-INIZCTEOSA-N 1 2 313.445 4.137 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@H](c3ccccc3)CC2)no1 ZINC000589610216 1050049296 /nfs/dbraw/zinc/04/92/96/1050049296.db2.gz VHUPLCLTEHZXOV-INIZCTEOSA-N 1 2 313.445 4.137 20 0 DIADLO C[C@]1(F)CC[N@H+](CCc2ccccc2C(F)(F)F)C[C@H]1F ZINC001209278769 1050049406 /nfs/dbraw/zinc/04/94/06/1050049406.db2.gz XMCNHSDTEYOCGO-KGLIPLIRSA-N 1 2 307.306 4.020 20 0 DIADLO C[C@]1(F)CC[N@@H+](CCc2ccccc2C(F)(F)F)C[C@H]1F ZINC001209278769 1050049411 /nfs/dbraw/zinc/04/94/11/1050049411.db2.gz XMCNHSDTEYOCGO-KGLIPLIRSA-N 1 2 307.306 4.020 20 0 DIADLO c1coc([C@H]([NH2+]Cc2[nH]nc3ccccc32)c2ccccc2)c1 ZINC000589638157 1050051083 /nfs/dbraw/zinc/05/10/83/1050051083.db2.gz MGAMIFGEZLKBKU-LJQANCHMSA-N 1 2 303.365 4.035 20 0 DIADLO CCSCc1cc[nH+]c(NCc2ccc(COC)cc2)c1 ZINC000090228353 1050051481 /nfs/dbraw/zinc/05/14/81/1050051481.db2.gz PPUHQIOICWWTKD-UHFFFAOYSA-N 1 2 302.443 4.093 20 0 DIADLO CCCn1c(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)nc2ccccc21 ZINC000589833993 1050060326 /nfs/dbraw/zinc/06/03/26/1050060326.db2.gz NBZLZGBDOROTLQ-GOEBONIOSA-N 1 2 323.440 4.453 20 0 DIADLO CCc1ccc([C@@H](C)C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000589899927 1050065894 /nfs/dbraw/zinc/06/58/94/1050065894.db2.gz ROEDUSMCPRUMDX-OAHLLOKOSA-N 1 2 319.408 4.177 20 0 DIADLO CC(C)[N@H+](CCC(=O)c1ccc2ccccc2c1)Cc1ccon1 ZINC001209567865 1050068117 /nfs/dbraw/zinc/06/81/17/1050068117.db2.gz MTPYLJXQNZXWFY-UHFFFAOYSA-N 1 2 322.408 4.311 20 0 DIADLO CC(C)[N@@H+](CCC(=O)c1ccc2ccccc2c1)Cc1ccon1 ZINC001209567865 1050068124 /nfs/dbraw/zinc/06/81/24/1050068124.db2.gz MTPYLJXQNZXWFY-UHFFFAOYSA-N 1 2 322.408 4.311 20 0 DIADLO Cc1[nH]ncc1C[NH+]1CCC(c2ccc3ccccc3c2)CC1 ZINC001209556096 1050068531 /nfs/dbraw/zinc/06/85/31/1050068531.db2.gz WVUBWAIKEGLJOR-UHFFFAOYSA-N 1 2 305.425 4.251 20 0 DIADLO Cc1[nH]ncc1C[NH+]1CCC(CCc2ccc(Cl)cc2)CC1 ZINC001209555884 1050068631 /nfs/dbraw/zinc/06/86/31/1050068631.db2.gz NKABNOOXDAQFTC-UHFFFAOYSA-N 1 2 317.864 4.216 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@@H]2c2cccc(Cl)c2)[nH]1 ZINC001209574493 1050069161 /nfs/dbraw/zinc/06/91/61/1050069161.db2.gz NYNBUUHJRMWPPL-MRXNPFEDSA-N 1 2 306.862 4.267 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@@H]2c2cccc(Cl)c2)[nH]1 ZINC001209574493 1050069167 /nfs/dbraw/zinc/06/91/67/1050069167.db2.gz NYNBUUHJRMWPPL-MRXNPFEDSA-N 1 2 306.862 4.267 20 0 DIADLO Clc1cnc2[nH]cc(C[N@@H+]3CCC[C@H]3c3nccs3)c2c1 ZINC001209598887 1050071700 /nfs/dbraw/zinc/07/17/00/1050071700.db2.gz DSNFBNZDVNHBDD-ZDUSSCGKSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1cnc2[nH]cc(C[N@H+]3CCC[C@H]3c3nccs3)c2c1 ZINC001209598887 1050071706 /nfs/dbraw/zinc/07/17/06/1050071706.db2.gz DSNFBNZDVNHBDD-ZDUSSCGKSA-N 1 2 318.833 4.010 20 0 DIADLO COc1cc(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c(F)cc1Cl ZINC001209662644 1050074609 /nfs/dbraw/zinc/07/46/09/1050074609.db2.gz OIARDQBFHOQGTK-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO COc1cc(C[N@H+]2CCC(F)(F)C(C)(C)C2)c(F)cc1Cl ZINC001209662644 1050074611 /nfs/dbraw/zinc/07/46/11/1050074611.db2.gz OIARDQBFHOQGTK-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c(F)cc1Cl ZINC001209665436 1050074833 /nfs/dbraw/zinc/07/48/33/1050074833.db2.gz ZODZQUKWGZROKN-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccccn2)c(F)cc1Cl ZINC001209665436 1050074838 /nfs/dbraw/zinc/07/48/38/1050074838.db2.gz ZODZQUKWGZROKN-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1cc(OC)c(Cl)cc1F ZINC001209663677 1050075429 /nfs/dbraw/zinc/07/54/29/1050075429.db2.gz GRHQLELJVNGBNU-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1cc(OC)c(Cl)cc1F ZINC001209663677 1050075435 /nfs/dbraw/zinc/07/54/35/1050075435.db2.gz GRHQLELJVNGBNU-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cc(C[NH+]2CC(c3ccccc3)C2)c(F)cc1Cl ZINC001209667798 1050075840 /nfs/dbraw/zinc/07/58/40/1050075840.db2.gz NXBZABSVJMDJEI-UHFFFAOYSA-N 1 2 305.780 4.087 20 0 DIADLO O=C1CC[N@@H+](Cc2cc3cc(Cl)ccc3[nH]2)[C@H]2CCCC[C@@H]12 ZINC001209717997 1050078262 /nfs/dbraw/zinc/07/82/62/1050078262.db2.gz IUSZSJNISJTMQP-WBVHZDCISA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2cc3cc(Cl)ccc3[nH]2)[C@H]2CCCC[C@@H]12 ZINC001209717997 1050078268 /nfs/dbraw/zinc/07/82/68/1050078268.db2.gz IUSZSJNISJTMQP-WBVHZDCISA-N 1 2 316.832 4.155 20 0 DIADLO CCCCOC(=O)Nc1ccc(Nc2[nH+]cc(O)cc2C)cc1 ZINC001209912982 1050105253 /nfs/dbraw/zinc/10/52/53/1050105253.db2.gz GVEQCWIJXIPATC-UHFFFAOYSA-N 1 2 315.373 4.188 20 0 DIADLO COc1ccc2c(c1)CCC[N@@H+](Cc1csc(C(C)C)n1)C2 ZINC000590788734 1050107201 /nfs/dbraw/zinc/10/72/01/1050107201.db2.gz AHMGXHWYHHTMGB-UHFFFAOYSA-N 1 2 316.470 4.224 20 0 DIADLO COc1ccc2c(c1)CCC[N@H+](Cc1csc(C(C)C)n1)C2 ZINC000590788734 1050107205 /nfs/dbraw/zinc/10/72/05/1050107205.db2.gz AHMGXHWYHHTMGB-UHFFFAOYSA-N 1 2 316.470 4.224 20 0 DIADLO c1c(Nc2ccccc2C[NH+]2CCOCC2)cc2cccccc1-2 ZINC001209926276 1050107957 /nfs/dbraw/zinc/10/79/57/1050107957.db2.gz SSQLGFHCEPJBMU-UHFFFAOYSA-N 1 2 318.420 4.367 20 0 DIADLO c1ccc(Nc2ccccc2C2CC2)c(C[NH+]2CCOCC2)c1 ZINC001209927186 1050108230 /nfs/dbraw/zinc/10/82/30/1050108230.db2.gz NFIROUHPJVKTPG-UHFFFAOYSA-N 1 2 308.425 4.140 20 0 DIADLO CO[C@@H](C)c1cccc(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001209949324 1050110165 /nfs/dbraw/zinc/11/01/65/1050110165.db2.gz IQASVDZBZCMFPC-NSHDSACASA-N 1 2 301.777 4.439 20 0 DIADLO CCOc1cccc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000068839564 1050111342 /nfs/dbraw/zinc/11/13/42/1050111342.db2.gz WJIUUWJQBCOXSV-STQMWFEESA-N 1 2 317.433 4.178 20 0 DIADLO CCOc1cccc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000068839563 1050111449 /nfs/dbraw/zinc/11/14/49/1050111449.db2.gz WJIUUWJQBCOXSV-OLZOCXBDSA-N 1 2 317.433 4.178 20 0 DIADLO C=C(Br)C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000057753204 1050113501 /nfs/dbraw/zinc/11/35/01/1050113501.db2.gz KBNUFCBDDBMWSB-UHFFFAOYSA-N 1 2 323.278 4.017 20 0 DIADLO C=C(Br)C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000057753204 1050113504 /nfs/dbraw/zinc/11/35/04/1050113504.db2.gz KBNUFCBDDBMWSB-UHFFFAOYSA-N 1 2 323.278 4.017 20 0 DIADLO Oc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1C(F)(F)F ZINC001209984981 1050116786 /nfs/dbraw/zinc/11/67/86/1050116786.db2.gz ZNKLTBJFZYKVNP-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO Oc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)cc1C(F)(F)F ZINC001209985988 1050117643 /nfs/dbraw/zinc/11/76/43/1050117643.db2.gz OSCIANQFECMGDS-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc4c(c3)OCCCO4)ccc12 ZINC001210006206 1050121162 /nfs/dbraw/zinc/12/11/62/1050121162.db2.gz LIQDIWVOJXGHQA-UHFFFAOYSA-N 1 2 306.365 4.448 20 0 DIADLO Cc1cc(Nc2ccc3ncnc(Cl)c3c2)ccc1[NH+](C)C ZINC001210043234 1050127645 /nfs/dbraw/zinc/12/76/45/1050127645.db2.gz BLDVVBYFYXQIAY-UHFFFAOYSA-N 1 2 312.804 4.401 20 0 DIADLO Nc1cc(Cl)c(Cl)nc1Nc1ccc2c[nH+]ccc2c1 ZINC001210047188 1050129082 /nfs/dbraw/zinc/12/90/82/1050129082.db2.gz PCXQYVBDVVKFAX-UHFFFAOYSA-N 1 2 305.168 4.262 20 0 DIADLO Fc1ccc(Br)c(Nc2ccc3c[nH+]ccc3c2)n1 ZINC001210046910 1050129425 /nfs/dbraw/zinc/12/94/25/1050129425.db2.gz YVELTQNLEQZOOJ-UHFFFAOYSA-N 1 2 318.149 4.275 20 0 DIADLO C[C@@H]([NH2+]Cc1noc(-c2ccccc2)n1)c1ccc(C2CC2)cc1 ZINC000573191262 1050139773 /nfs/dbraw/zinc/13/97/73/1050139773.db2.gz SOVFFIKBRAXYQT-CQSZACIVSA-N 1 2 319.408 4.465 20 0 DIADLO CCCC[N@@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000591384543 1050141062 /nfs/dbraw/zinc/14/10/62/1050141062.db2.gz OVYZNUCOVDSZEZ-UHFFFAOYSA-N 1 2 307.235 4.089 20 0 DIADLO CCCC[N@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000591384543 1050141067 /nfs/dbraw/zinc/14/10/67/1050141067.db2.gz OVYZNUCOVDSZEZ-UHFFFAOYSA-N 1 2 307.235 4.089 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ncc(-c2ccccc2)s1 ZINC000573283231 1050153789 /nfs/dbraw/zinc/15/37/89/1050153789.db2.gz DMZWQEFKLCHORP-DJJJIMSYSA-N 1 2 322.433 4.422 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N([C@@H](C)c3ccccc3)C3CC3)ccn12 ZINC000573264064 1050156421 /nfs/dbraw/zinc/15/64/21/1050156421.db2.gz SGRKVTUWVWYKQI-HNNXBMFYSA-N 1 2 319.408 4.009 20 0 DIADLO ClC1(Cl)C[C@H]1C[N@@H+]1CCCn2c(cc3ccccc32)C1 ZINC000805842044 1050159992 /nfs/dbraw/zinc/15/99/92/1050159992.db2.gz ZVXPPIRCAISABK-ZDUSSCGKSA-N 1 2 309.240 4.041 20 0 DIADLO ClC1(Cl)C[C@H]1C[N@H+]1CCCn2c(cc3ccccc32)C1 ZINC000805842044 1050159999 /nfs/dbraw/zinc/15/99/99/1050159999.db2.gz ZVXPPIRCAISABK-ZDUSSCGKSA-N 1 2 309.240 4.041 20 0 DIADLO Cc1cc(Nc2cccc3cc[nH+]cc32)n(C(=O)OC(C)(C)C)n1 ZINC001210222572 1050165775 /nfs/dbraw/zinc/16/57/75/1050165775.db2.gz OVIFAIXZGSJFNR-UHFFFAOYSA-N 1 2 324.384 4.267 20 0 DIADLO CCN(Cc1ccc2ccccc2c1)C(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000573328783 1050165824 /nfs/dbraw/zinc/16/58/24/1050165824.db2.gz YMGWQZDYPNRZQI-MRXNPFEDSA-N 1 2 321.424 4.036 20 0 DIADLO O=c1cc(C(F)(F)F)[nH]cc1Nc1cccc2cc[nH+]cc21 ZINC001210224633 1050168193 /nfs/dbraw/zinc/16/81/93/1050168193.db2.gz TZXNQRIGKKWPEN-UHFFFAOYSA-N 1 2 305.259 4.098 20 0 DIADLO Fc1cccc(-n2nccc2Nc2cccc3cc[nH+]cc32)c1 ZINC001210226465 1050168516 /nfs/dbraw/zinc/16/85/16/1050168516.db2.gz XMQCBZNUUNKXLP-UHFFFAOYSA-N 1 2 304.328 4.303 20 0 DIADLO COc1ccccc1-n1nccc1Nc1cccc2cc[nH+]cc21 ZINC001210225183 1050168576 /nfs/dbraw/zinc/16/85/76/1050168576.db2.gz FESNNEJOXLKXKK-UHFFFAOYSA-N 1 2 316.364 4.173 20 0 DIADLO COC(=O)c1ccc(Nc2cccc3cc[nH+]cc32)c(Cl)c1 ZINC001210233403 1050171659 /nfs/dbraw/zinc/17/16/59/1050171659.db2.gz XZYVVYXCONMCJP-UHFFFAOYSA-N 1 2 312.756 4.418 20 0 DIADLO FC(F)(F)c1ncccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001210234448 1050172287 /nfs/dbraw/zinc/17/22/87/1050172287.db2.gz PQWGAXPOGLOBGH-UHFFFAOYSA-N 1 2 318.302 4.089 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2cc(C)on2)cc1OCC ZINC000282669635 1050172330 /nfs/dbraw/zinc/17/23/30/1050172330.db2.gz JAYHGSZYAAASRM-UONOGXRCSA-N 1 2 318.417 4.192 20 0 DIADLO O=C1CCOc2c(Nc3cccc4cc[nH+]cc43)ccc(F)c21 ZINC001210233398 1050172486 /nfs/dbraw/zinc/17/24/86/1050172486.db2.gz XUHCRRQCDQJRMS-UHFFFAOYSA-N 1 2 308.312 4.083 20 0 DIADLO COc1ccc2oc([C@@H](C)[NH2+][C@H](C)c3cc(C)on3)c(C)c2c1 ZINC000282654649 1050175322 /nfs/dbraw/zinc/17/53/22/1050175322.db2.gz IFRSCHRRJKFZJG-CHWSQXEVSA-N 1 2 314.385 4.458 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)o1 ZINC000770616683 1050179457 /nfs/dbraw/zinc/17/94/57/1050179457.db2.gz WTUKQOZPYFIXQN-WDEREUQCSA-N 1 2 314.307 4.293 20 0 DIADLO Cc1ccc(Nc2[nH+]cccc2N)cc1OCc1ccccc1 ZINC001210252105 1050181361 /nfs/dbraw/zinc/18/13/61/1050181361.db2.gz JHOVEDOICRWNCQ-UHFFFAOYSA-N 1 2 305.381 4.295 20 0 DIADLO Cc1[nH+]cc(Nc2cc(-c3ccccc3)nn2C(C)(C)C)cc1N ZINC001210289088 1050191023 /nfs/dbraw/zinc/19/10/23/1050191023.db2.gz UICRFUVETFTJRK-UHFFFAOYSA-N 1 2 321.428 4.334 20 0 DIADLO CSc1ccc(Nc2c[nH+]c(C)c(N)c2)cc1Br ZINC001210290998 1050191589 /nfs/dbraw/zinc/19/15/89/1050191589.db2.gz IUIKWOZGJBRRFQ-UHFFFAOYSA-N 1 2 324.247 4.200 20 0 DIADLO COc1ccc(-c2ccc(Nc3c[nH+]c(C)c(N)c3)cc2)cc1 ZINC001210289399 1050191613 /nfs/dbraw/zinc/19/16/13/1050191613.db2.gz JSEOFKJDVVLHSQ-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO Cc1[nH+]cc(Nc2cccc3c(Cl)ncc(F)c23)cc1N ZINC001210291070 1050191981 /nfs/dbraw/zinc/19/19/81/1050191981.db2.gz JOBQHQQYMYZHEH-UHFFFAOYSA-N 1 2 302.740 4.057 20 0 DIADLO Cc1[nH+]cc(Nc2nc(Cl)c(Cl)cc2Cl)cc1N ZINC001210288124 1050192084 /nfs/dbraw/zinc/19/20/84/1050192084.db2.gz BAGDPKSUHUHNAO-UHFFFAOYSA-N 1 2 303.580 4.071 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(OCC(C)(C)C)c(F)c2)cc1N ZINC001210291132 1050192199 /nfs/dbraw/zinc/19/21/99/1050192199.db2.gz KMFZGXGLXMLUIN-UHFFFAOYSA-N 1 2 303.381 4.280 20 0 DIADLO Cc1[nH+]cc(Nc2ccccc2OCc2ccccc2)cc1N ZINC001210287739 1050192551 /nfs/dbraw/zinc/19/25/51/1050192551.db2.gz CGZJGBYMFGDSJK-UHFFFAOYSA-N 1 2 305.381 4.295 20 0 DIADLO Cc1[nH+]cc(Nc2cc(C(F)(F)F)nc3ccccc32)cc1N ZINC001210289130 1050192631 /nfs/dbraw/zinc/19/26/31/1050192631.db2.gz VXAVQRDDUFBUMJ-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO FC(F)Oc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001210327925 1050205660 /nfs/dbraw/zinc/20/56/60/1050205660.db2.gz UXSPRJKWLVRKBH-UHFFFAOYSA-N 1 2 301.296 4.217 20 0 DIADLO CCc1cccc(Nc2ccc3c(cnn3[C@@H]3CCCCO3)c2)[nH+]1 ZINC001210333681 1050207362 /nfs/dbraw/zinc/20/73/62/1050207362.db2.gz KLSLXIWSKWYWQQ-IBGZPJMESA-N 1 2 322.412 4.436 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)[C@H](C)CC2CCCC2)n1 ZINC000733952191 1050207886 /nfs/dbraw/zinc/20/78/86/1050207886.db2.gz XVSNIIVLCQFPJG-CYBMUJFWSA-N 1 2 323.506 4.140 20 0 DIADLO CC(C)(C)c1nn(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)c(=S)o1 ZINC000733993123 1050210401 /nfs/dbraw/zinc/21/04/01/1050210401.db2.gz XFYQQIFEBJVEBG-QGZVFWFLSA-N 1 2 321.490 4.283 20 0 DIADLO CC(C)(C)c1nn(C[N@H+]2CCC[C@]3(CC=CCC3)C2)c(=S)o1 ZINC000733993123 1050210419 /nfs/dbraw/zinc/21/04/19/1050210419.db2.gz XFYQQIFEBJVEBG-QGZVFWFLSA-N 1 2 321.490 4.283 20 0 DIADLO Fc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1cn2ccccc2n1 ZINC001136879575 1050215493 /nfs/dbraw/zinc/21/54/93/1050215493.db2.gz KLOWHJMKHYZVMM-SFHVURJKSA-N 1 2 309.388 4.201 20 0 DIADLO Fc1ccccc1[C@@H]1CCCC[N@H+]1Cc1cn2ccccc2n1 ZINC001136879575 1050215504 /nfs/dbraw/zinc/21/55/04/1050215504.db2.gz KLOWHJMKHYZVMM-SFHVURJKSA-N 1 2 309.388 4.201 20 0 DIADLO Cc1ccc(F)c(-c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)c1 ZINC000771195356 1050225078 /nfs/dbraw/zinc/22/50/78/1050225078.db2.gz CGQJQGVBMAEXEN-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+][C@H]1CCc2ccc(Cl)nc21 ZINC000771174906 1050225095 /nfs/dbraw/zinc/22/50/95/1050225095.db2.gz CMCWHUSFNYGPEI-MFKMUULPSA-N 1 2 320.795 4.221 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+][C@@H]1CCc2ccc(Cl)nc21 ZINC000771174904 1050226295 /nfs/dbraw/zinc/22/62/95/1050226295.db2.gz CMCWHUSFNYGPEI-GXFFZTMASA-N 1 2 320.795 4.221 20 0 DIADLO Cc1c(C)n(-c2ccc(-c3[nH+]ccn3C)cc2)c2c1cccc2N ZINC001210434569 1050245279 /nfs/dbraw/zinc/24/52/79/1050245279.db2.gz BBMCCOMPSHNJJJ-UHFFFAOYSA-N 1 2 316.408 4.230 20 0 DIADLO C[C@@H]1C(=O)CC[N@H+](Cc2nc3ccccc3s2)C12CCCC2 ZINC001136957551 1050255145 /nfs/dbraw/zinc/25/51/45/1050255145.db2.gz IOULLMOMUAIVIA-CYBMUJFWSA-N 1 2 314.454 4.020 20 0 DIADLO C[C@@H]1C(=O)CC[N@@H+](Cc2nc3ccccc3s2)C12CCCC2 ZINC001136957551 1050255157 /nfs/dbraw/zinc/25/51/57/1050255157.db2.gz IOULLMOMUAIVIA-CYBMUJFWSA-N 1 2 314.454 4.020 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cccc(OCC(F)(F)F)c3)ccc21 ZINC001212170754 1050264233 /nfs/dbraw/zinc/26/42/33/1050264233.db2.gz GOTDZBCSZLHHKZ-UHFFFAOYSA-N 1 2 321.302 4.258 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccc(SC(F)(F)F)cc2)co1 ZINC000825050090 1050268998 /nfs/dbraw/zinc/26/89/98/1050268998.db2.gz HOGTYKAEIAJDME-UHFFFAOYSA-N 1 2 316.348 4.139 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(C)cc1C(F)(F)F ZINC001210525606 1050282157 /nfs/dbraw/zinc/28/21/57/1050282157.db2.gz IQFNDZOGEZGJAV-UHFFFAOYSA-N 1 2 305.303 4.243 20 0 DIADLO Cc1cc(NC[C@@H](O)c2c(Cl)cccc2Cl)c[nH+]c1C ZINC001170033862 1050286624 /nfs/dbraw/zinc/28/66/24/1050286624.db2.gz QTSMJGOTSZDUKB-CQSZACIVSA-N 1 2 311.212 4.151 20 0 DIADLO CCc1nc(C[N@@H+]2CCCC[C@H]2c2ccccc2OC)cs1 ZINC000592331619 1050289046 /nfs/dbraw/zinc/28/90/46/1050289046.db2.gz PPSRQNDULOKVPL-INIZCTEOSA-N 1 2 316.470 4.441 20 0 DIADLO CCc1nc(C[N@H+]2CCCC[C@H]2c2ccccc2OC)cs1 ZINC000592331619 1050289058 /nfs/dbraw/zinc/28/90/58/1050289058.db2.gz PPSRQNDULOKVPL-INIZCTEOSA-N 1 2 316.470 4.441 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)s2)cn1 ZINC001137036344 1050309142 /nfs/dbraw/zinc/30/91/42/1050309142.db2.gz FSEVRGXCPINISC-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)s2)cn1 ZINC001137036344 1050309157 /nfs/dbraw/zinc/30/91/57/1050309157.db2.gz FSEVRGXCPINISC-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cccnc3OC(F)F)ccc12 ZINC001210628477 1050318930 /nfs/dbraw/zinc/31/89/30/1050318930.db2.gz BOOQNIFVBXHWIK-UHFFFAOYSA-N 1 2 301.296 4.283 20 0 DIADLO Cc1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@@](C)(F)[C@@H](F)C2)c1 ZINC001143672623 1050332166 /nfs/dbraw/zinc/33/21/66/1050332166.db2.gz NSWVHVRTCANQTQ-UONOGXRCSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@](C)(F)[C@@H](F)C2)c1 ZINC001143672623 1050332172 /nfs/dbraw/zinc/33/21/72/1050332172.db2.gz NSWVHVRTCANQTQ-UONOGXRCSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1occc1Br)C(C)C ZINC000735321585 1050371748 /nfs/dbraw/zinc/37/17/48/1050371748.db2.gz XJWKRFUYAUSBTB-AWEZNQCLSA-N 1 2 323.234 4.232 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CCCC3(C)C)c2)[nH+]c1C ZINC000772363938 1050355418 /nfs/dbraw/zinc/35/54/18/1050355418.db2.gz CERCZUUCMFBHIL-INIZCTEOSA-N 1 2 311.429 4.458 20 0 DIADLO CCCC[C@H](CC)CC(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000735250770 1050361417 /nfs/dbraw/zinc/36/14/17/1050361417.db2.gz LJAPCMUTGNETMO-INIZCTEOSA-N 1 2 313.445 4.095 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(Cl)cc(Cl)cc2Cl)CC[C@]1(C)O ZINC001143797047 1050361905 /nfs/dbraw/zinc/36/19/05/1050361905.db2.gz DFVCGZOAXBVACD-OTYXRUKQSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(Cl)cc(Cl)cc2Cl)CC[C@]1(C)O ZINC001143797047 1050361914 /nfs/dbraw/zinc/36/19/14/1050361914.db2.gz DFVCGZOAXBVACD-OTYXRUKQSA-N 1 2 322.663 4.240 20 0 DIADLO FC[C@H]1[C@@H]2C[N@H+](Cc3c(Cl)cc(Cl)cc3Cl)C[C@H]12 ZINC001143800400 1050364125 /nfs/dbraw/zinc/36/41/25/1050364125.db2.gz HOAQMCLHHSROBP-OWUUHHOZSA-N 1 2 308.611 4.294 20 0 DIADLO FC[C@H]1[C@@H]2C[N@@H+](Cc3c(Cl)cc(Cl)cc3Cl)C[C@H]12 ZINC001143800400 1050364137 /nfs/dbraw/zinc/36/41/37/1050364137.db2.gz HOAQMCLHHSROBP-OWUUHHOZSA-N 1 2 308.611 4.294 20 0 DIADLO CCOc1c(Cl)ccc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)c1F ZINC001143824327 1050367234 /nfs/dbraw/zinc/36/72/34/1050367234.db2.gz ADEWJKLNAGDLBO-JTQLQIEISA-N 1 2 321.770 4.355 20 0 DIADLO CCOc1c(Cl)ccc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)c1F ZINC001143824327 1050367239 /nfs/dbraw/zinc/36/72/39/1050367239.db2.gz ADEWJKLNAGDLBO-JTQLQIEISA-N 1 2 321.770 4.355 20 0 DIADLO COc1cc(Nc2ccc3c(c2)Cc2cc(N)ccc2-3)cc(C)[nH+]1 ZINC001210780551 1050369291 /nfs/dbraw/zinc/36/92/91/1050369291.db2.gz DWSFQSJXTRGZSC-UHFFFAOYSA-N 1 2 317.392 4.296 20 0 DIADLO Cc1csc(C[NH2+][C@H](c2cccnc2)c2cc(C)cc(C)c2)n1 ZINC000735321540 1050369804 /nfs/dbraw/zinc/36/98/04/1050369804.db2.gz VFDUVEPKWBKEDA-LJQANCHMSA-N 1 2 323.465 4.343 20 0 DIADLO CCC[C@@H]([NH2+]Cc1occc1Br)c1ccccn1 ZINC000735322090 1050371300 /nfs/dbraw/zinc/37/13/00/1050371300.db2.gz CRBPRWVISWYUFA-GFCCVEGCSA-N 1 2 309.207 4.068 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCC[C@@H]2c2ccncc2)cc1Cl ZINC001143847778 1050376683 /nfs/dbraw/zinc/37/66/83/1050376683.db2.gz ZLEKQILPJODFAA-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCC[C@@H]2c2ccncc2)cc1Cl ZINC001143847778 1050376686 /nfs/dbraw/zinc/37/66/86/1050376686.db2.gz ZLEKQILPJODFAA-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO c1cn(Cc2ccc(Nc3ccc4ccccc4n3)cc2)c[nH+]1 ZINC001210818024 1050376789 /nfs/dbraw/zinc/37/67/89/1050376789.db2.gz WEGWRWAHFNETMK-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCc3ccccc3C2)cc1Cl ZINC001143836830 1050376895 /nfs/dbraw/zinc/37/68/95/1050376895.db2.gz COCQZTORIFTSST-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCc3ccccc3C2)cc1Cl ZINC001143836830 1050376905 /nfs/dbraw/zinc/37/69/05/1050376905.db2.gz COCQZTORIFTSST-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CCCO[C@@H]1CC[N@H+](Cc2c(F)ccc(Cl)c2Cl)C1 ZINC001143859991 1050378964 /nfs/dbraw/zinc/37/89/64/1050378964.db2.gz GEECNNOFBDKUFU-SNVBAGLBSA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@@H]1CC[N@@H+](Cc2c(F)ccc(Cl)c2Cl)C1 ZINC001143859991 1050378971 /nfs/dbraw/zinc/37/89/71/1050378971.db2.gz GEECNNOFBDKUFU-SNVBAGLBSA-N 1 2 306.208 4.133 20 0 DIADLO c1ccc(OC2CC2)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001210835428 1050385835 /nfs/dbraw/zinc/38/58/35/1050385835.db2.gz QGYHDKXHNGXRRA-UHFFFAOYSA-N 1 2 309.413 4.357 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2c(F)ccc(Cl)c2Cl)[C@@H](C)C1 ZINC001143867378 1050387458 /nfs/dbraw/zinc/38/74/58/1050387458.db2.gz AEPDPVNHUSVBDT-VHSXEESVSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2c(F)ccc(Cl)c2Cl)[C@@H](C)C1 ZINC001143867378 1050387467 /nfs/dbraw/zinc/38/74/67/1050387467.db2.gz AEPDPVNHUSVBDT-VHSXEESVSA-N 1 2 306.208 4.132 20 0 DIADLO Cc1cc(C(C)(C)C)cc(C)c1Cc1noc([C@H](C)[NH+](C)C)n1 ZINC000785578444 1050396976 /nfs/dbraw/zinc/39/69/76/1050396976.db2.gz ILQLUFDFHUUOSH-AWEZNQCLSA-N 1 2 315.461 4.197 20 0 DIADLO COc1ccc(C[N@H+]2Cc3ccccc3[C@H](C)C2)c(F)c1F ZINC001143902927 1050399403 /nfs/dbraw/zinc/39/94/03/1050399403.db2.gz OASDKSNBRRCGCP-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c(F)c1F ZINC001143902927 1050399414 /nfs/dbraw/zinc/39/94/14/1050399414.db2.gz OASDKSNBRRCGCP-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO CCc1[nH]nc2ncc(Nc3cc[nH+]c4cc(Cl)ccc34)cc12 ZINC001210887846 1050407305 /nfs/dbraw/zinc/40/73/05/1050407305.db2.gz QSDSQXJIMRFZBE-UHFFFAOYSA-N 1 2 323.787 4.466 20 0 DIADLO CCOc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2ccccn2)c1F ZINC001143937306 1050410889 /nfs/dbraw/zinc/41/08/89/1050410889.db2.gz IRVKPUNXXCDGNB-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(F)c(C[N@H+]2CCC[C@H]2c2ccccn2)c1F ZINC001143937306 1050410895 /nfs/dbraw/zinc/41/08/95/1050410895.db2.gz IRVKPUNXXCDGNB-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(F)c(C[N@H+](C)[C@@H]2CCc3ccccc32)c1F ZINC001143945910 1050412120 /nfs/dbraw/zinc/41/21/20/1050412120.db2.gz LCZGYBUKJMWGBB-QGZVFWFLSA-N 1 2 317.379 4.483 20 0 DIADLO CCOc1ccc(F)c(C[N@@H+](C)[C@@H]2CCc3ccccc32)c1F ZINC001143945910 1050412124 /nfs/dbraw/zinc/41/21/24/1050412124.db2.gz LCZGYBUKJMWGBB-QGZVFWFLSA-N 1 2 317.379 4.483 20 0 DIADLO CCOc1ccc(F)c(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c1F ZINC001143930197 1050412847 /nfs/dbraw/zinc/41/28/47/1050412847.db2.gz CGQLOXNJGGWEOC-UHFFFAOYSA-N 1 2 319.342 4.231 20 0 DIADLO CCOc1ccc(F)c(C[N@H+]2CCC(F)(F)C(C)(C)C2)c1F ZINC001143930197 1050412856 /nfs/dbraw/zinc/41/28/56/1050412856.db2.gz CGQLOXNJGGWEOC-UHFFFAOYSA-N 1 2 319.342 4.231 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c1F ZINC001143971258 1050415328 /nfs/dbraw/zinc/41/53/28/1050415328.db2.gz RABMQJLJNIVRRM-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c1F ZINC001143971258 1050415333 /nfs/dbraw/zinc/41/53/33/1050415333.db2.gz RABMQJLJNIVRRM-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO CCCCC[C@@H](NC(=O)C[C@H](C)n1cc[nH+]c1)c1ccccc1 ZINC000844376946 1050415508 /nfs/dbraw/zinc/41/55/08/1050415508.db2.gz URBFSPMJABGWOO-FUHWJXTLSA-N 1 2 313.445 4.272 20 0 DIADLO Cc1cn2cc(Nc3cc(Cl)c(O)c(Cl)c3)ccc2[nH+]1 ZINC001210926518 1050415846 /nfs/dbraw/zinc/41/58/46/1050415846.db2.gz LHUZYHXPZJUMOU-UHFFFAOYSA-N 1 2 308.168 4.399 20 0 DIADLO COc1ccc(F)c(C[N@H+](C)[C@@H]2CCc3ccccc32)c1F ZINC001143984810 1050421186 /nfs/dbraw/zinc/42/11/86/1050421186.db2.gz JWQRDCIZMGEROJ-MRXNPFEDSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(F)c(C[N@@H+](C)[C@@H]2CCc3ccccc32)c1F ZINC001143984810 1050421196 /nfs/dbraw/zinc/42/11/96/1050421196.db2.gz JWQRDCIZMGEROJ-MRXNPFEDSA-N 1 2 303.352 4.093 20 0 DIADLO FC1(F)C[C@@]12CCC[N@H+](Cc1csc(C3CCCC3)n1)C2 ZINC000844440378 1050423250 /nfs/dbraw/zinc/42/32/50/1050423250.db2.gz SOJKSVNQDIFZDP-OAHLLOKOSA-N 1 2 312.429 4.422 20 0 DIADLO FC1(F)C[C@@]12CCC[N@@H+](Cc1csc(C3CCCC3)n1)C2 ZINC000844440378 1050423262 /nfs/dbraw/zinc/42/32/62/1050423262.db2.gz SOJKSVNQDIFZDP-OAHLLOKOSA-N 1 2 312.429 4.422 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2ccc(Cl)nc2)[C@H]1c1ccccc1 ZINC000735742814 1050424419 /nfs/dbraw/zinc/42/44/19/1050424419.db2.gz ATXJSZZXRBPAKQ-CXAGYDPISA-N 1 2 318.873 4.414 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2ccc(Cl)nc2)[C@H]1c1ccccc1 ZINC000735742814 1050424426 /nfs/dbraw/zinc/42/44/26/1050424426.db2.gz ATXJSZZXRBPAKQ-CXAGYDPISA-N 1 2 318.873 4.414 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2ccc(C)nc2)c1F ZINC001143981064 1050426178 /nfs/dbraw/zinc/42/61/78/1050426178.db2.gz YUVZIQHXODWFJU-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2ccc(C)nc2)c1F ZINC001143981064 1050426186 /nfs/dbraw/zinc/42/61/86/1050426186.db2.gz YUVZIQHXODWFJU-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(OC(F)(F)F)cc1C[NH+]1Cc2ccccc2C1 ZINC001143996630 1050434605 /nfs/dbraw/zinc/43/46/05/1050434605.db2.gz OIZCAXHLEOPPQY-UHFFFAOYSA-N 1 2 323.314 4.110 20 0 DIADLO CC(C)[C@@H](OC(=O)C[C@@H](C)n1cc[nH+]c1)c1ccc(F)c(F)c1 ZINC000844465400 1050435695 /nfs/dbraw/zinc/43/56/95/1050435695.db2.gz YWPJTUOXKOQVDU-SJKOYZFVSA-N 1 2 322.355 4.053 20 0 DIADLO CC(C)Oc1ccc(COc2ccccc2-n2cc[nH+]c2)cc1 ZINC000735917740 1050436949 /nfs/dbraw/zinc/43/69/49/1050436949.db2.gz ODPBMQIUZCGQEI-UHFFFAOYSA-N 1 2 308.381 4.239 20 0 DIADLO Cc1cc(Nc2cccc(C3CCC3)[nH+]2)ccc1N1CCOCC1 ZINC001210973808 1050438350 /nfs/dbraw/zinc/43/83/50/1050438350.db2.gz XIYZBPYONUBDGV-UHFFFAOYSA-N 1 2 323.440 4.238 20 0 DIADLO COc1cc(C[N@H+](Cc2ccco2)Cc2cccnc2)ccc1C ZINC000574306138 1050439322 /nfs/dbraw/zinc/43/93/22/1050439322.db2.gz BRRPLYHLLYAXSV-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1cc(C[N@@H+](Cc2ccco2)Cc2cccnc2)ccc1C ZINC000574306138 1050439342 /nfs/dbraw/zinc/43/93/42/1050439342.db2.gz BRRPLYHLLYAXSV-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO CCOc1cc(Nc2ccc(C)c[nH+]2)ccc1Br ZINC001211013118 1050446353 /nfs/dbraw/zinc/44/63/53/1050446353.db2.gz RBHKDWNSHOSUDT-UHFFFAOYSA-N 1 2 307.191 4.295 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(Cl)c(F)cc2F)CCC1(F)F ZINC001144125536 1050475221 /nfs/dbraw/zinc/47/52/21/1050475221.db2.gz MJVNDYQTUHJJNB-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(Cl)c(F)cc2F)CCC1(F)F ZINC001144125536 1050475231 /nfs/dbraw/zinc/47/52/31/1050475231.db2.gz MJVNDYQTUHJJNB-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO Cc1ccc2ccccc2c1Nc1[nH+]cccc1N1CCOCC1 ZINC001211120710 1050483963 /nfs/dbraw/zinc/48/39/63/1050483963.db2.gz RTODAESJAAQCSL-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO FC(F)C[C@@H]1COCC[N@@H+]1Cc1ccc(C2CCCC2)cc1 ZINC000574507899 1050492573 /nfs/dbraw/zinc/49/25/73/1050492573.db2.gz DDBXEXNGSPOTFK-QGZVFWFLSA-N 1 2 309.400 4.200 20 0 DIADLO FC(F)C[C@@H]1COCC[N@H+]1Cc1ccc(C2CCCC2)cc1 ZINC000574507899 1050492582 /nfs/dbraw/zinc/49/25/82/1050492582.db2.gz DDBXEXNGSPOTFK-QGZVFWFLSA-N 1 2 309.400 4.200 20 0 DIADLO Cc1cc(Br)cc(C[N@@H+]2CCCC[C@@H](F)C2)c1 ZINC001144212843 1050495922 /nfs/dbraw/zinc/49/59/22/1050495922.db2.gz MIFYMXWUSMAHPY-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cc(Br)cc(C[N@H+]2CCCC[C@@H](F)C2)c1 ZINC001144212843 1050495924 /nfs/dbraw/zinc/49/59/24/1050495924.db2.gz MIFYMXWUSMAHPY-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO FC(F)(F)c1ccc(Nc2cccc3[nH+]ccn32)c(Cl)n1 ZINC001211197555 1050512119 /nfs/dbraw/zinc/51/21/19/1050512119.db2.gz DPSWYXMMYPJDOE-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2cnccc2Cl)cc[nH+]1 ZINC001211207898 1050517938 /nfs/dbraw/zinc/51/79/38/1050517938.db2.gz FJEMFHUAKJPLQA-UHFFFAOYSA-N 1 2 320.780 4.221 20 0 DIADLO CC[N@H+](Cn1nc(-c2ccccc2C)oc1=S)C1CCC1 ZINC000738051581 1050521409 /nfs/dbraw/zinc/52/14/09/1050521409.db2.gz ANVMNZSNGRLDOC-UHFFFAOYSA-N 1 2 303.431 4.013 20 0 DIADLO CC[N@@H+](Cn1nc(-c2ccccc2C)oc1=S)C1CCC1 ZINC000738051581 1050521422 /nfs/dbraw/zinc/52/14/22/1050521422.db2.gz ANVMNZSNGRLDOC-UHFFFAOYSA-N 1 2 303.431 4.013 20 0 DIADLO COc1cccc(Nc2ccc(Oc3cc[nH+]c(C)c3)cc2)n1 ZINC001211302522 1050540688 /nfs/dbraw/zinc/54/06/88/1050540688.db2.gz GVRDEKQGJOPIDJ-UHFFFAOYSA-N 1 2 307.353 4.330 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1ccc(Cl)nc1C(F)(F)F ZINC000787186869 1050571701 /nfs/dbraw/zinc/57/17/01/1050571701.db2.gz PBXMJPURRVGYMR-UHFFFAOYSA-N 1 2 318.726 4.287 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1ccc(Cl)nc1C(F)(F)F ZINC000787186869 1050571714 /nfs/dbraw/zinc/57/17/14/1050571714.db2.gz PBXMJPURRVGYMR-UHFFFAOYSA-N 1 2 318.726 4.287 20 0 DIADLO FC(F)(F)Oc1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)ccn1 ZINC001213088243 1050582085 /nfs/dbraw/zinc/58/20/85/1050582085.db2.gz XNNMRQMSQMNZEA-UHFFFAOYSA-N 1 2 320.274 4.114 20 0 DIADLO Cc1nc(Cl)c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(Cl)n1 ZINC001213086588 1050583338 /nfs/dbraw/zinc/58/33/38/1050583338.db2.gz SSCYISXLXSSART-UHFFFAOYSA-N 1 2 320.183 4.226 20 0 DIADLO Fc1cccc(-n2nccc2Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213087201 1050583524 /nfs/dbraw/zinc/58/35/24/1050583524.db2.gz LQQQCVXCLOMDSI-UHFFFAOYSA-N 1 2 319.343 4.145 20 0 DIADLO Nc1cc(Cl)c(Cl)nc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213088203 1050583873 /nfs/dbraw/zinc/58/38/73/1050583873.db2.gz VUZMWIYTLZTNBF-UHFFFAOYSA-N 1 2 320.183 4.104 20 0 DIADLO FC(F)(F)Oc1cncc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213088171 1050584282 /nfs/dbraw/zinc/58/42/82/1050584282.db2.gz UETMGCCNYPBQHC-UHFFFAOYSA-N 1 2 320.274 4.114 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCCC3(CCCCC3)C2)c(C)[nH+]1 ZINC001144443739 1050584278 /nfs/dbraw/zinc/58/42/78/1050584278.db2.gz KETLSEKVMAHWPK-UHFFFAOYSA-N 1 2 300.446 4.193 20 0 DIADLO CP(C)(=O)c1ccccc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213089771 1050584920 /nfs/dbraw/zinc/58/49/20/1050584920.db2.gz DDDABLNMUZUKPO-UHFFFAOYSA-N 1 2 311.325 4.068 20 0 DIADLO Nc1cc(Cl)cc2c1ccn2-c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213090927 1050585111 /nfs/dbraw/zinc/58/51/11/1050585111.db2.gz NHSFNZDJDUAIIL-UHFFFAOYSA-N 1 2 308.772 4.256 20 0 DIADLO COc1c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)ccc(F)c1F ZINC001213092060 1050586939 /nfs/dbraw/zinc/58/69/39/1050586939.db2.gz ZDVWUSBHSJEBBP-UHFFFAOYSA-N 1 2 301.296 4.107 20 0 DIADLO CC(C)OC(=O)c1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001213088985 1050586978 /nfs/dbraw/zinc/58/69/78/1050586978.db2.gz NRGOQYDNAXOUQR-UHFFFAOYSA-N 1 2 321.380 4.386 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c(F)c1 ZINC001144541629 1050610997 /nfs/dbraw/zinc/61/09/97/1050610997.db2.gz IEXLGTMVEUIJJG-KRWDZBQOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c(F)c1 ZINC001144541629 1050611009 /nfs/dbraw/zinc/61/10/09/1050611009.db2.gz IEXLGTMVEUIJJG-KRWDZBQOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)c(C[NH+]2CCC(c3cccs3)CC2)c(F)c1 ZINC001144554759 1050612209 /nfs/dbraw/zinc/61/22/09/1050612209.db2.gz GMIDKHQDOCAHAZ-UHFFFAOYSA-N 1 2 309.381 4.112 20 0 DIADLO COc1ccc2nc(/C=C\c3c[nH+]c4ccccn34)sc2c1 ZINC000740666531 1050617926 /nfs/dbraw/zinc/61/79/26/1050617926.db2.gz QRTJTMXMSBWTOT-YVMONPNESA-N 1 2 307.378 4.123 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2c(F)cc(O)cc2F)c1 ZINC001144559618 1050618888 /nfs/dbraw/zinc/61/88/88/1050618888.db2.gz OPABUXCKTUHTGC-SFHVURJKSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2c(F)cc(O)cc2F)c1 ZINC001144559618 1050618893 /nfs/dbraw/zinc/61/88/93/1050618893.db2.gz OPABUXCKTUHTGC-SFHVURJKSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1cc(C[N@@H+]2CCCCC23CC3)c(F)cc1Br ZINC001144590498 1050624064 /nfs/dbraw/zinc/62/40/64/1050624064.db2.gz JJODFXRZMFKLOS-UHFFFAOYSA-N 1 2 312.226 4.415 20 0 DIADLO Cc1cc(C[N@H+]2CCCCC23CC3)c(F)cc1Br ZINC001144590498 1050624068 /nfs/dbraw/zinc/62/40/68/1050624068.db2.gz JJODFXRZMFKLOS-UHFFFAOYSA-N 1 2 312.226 4.415 20 0 DIADLO Cc1cc(C[NH+]2CC3(C2)CCCC3)c(F)cc1Br ZINC001144584105 1050624092 /nfs/dbraw/zinc/62/40/92/1050624092.db2.gz RCKJYMDPKAFWAJ-UHFFFAOYSA-N 1 2 312.226 4.273 20 0 DIADLO c1[nH+]c(CN(Cc2ccccn2)C2CCCCC2)c2ccccn12 ZINC001144624697 1050627698 /nfs/dbraw/zinc/62/76/98/1050627698.db2.gz QTBZRPDQSARJRQ-UHFFFAOYSA-N 1 2 320.440 4.064 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](C)[C@H]1CCc2c1cccc2Cl ZINC000788007847 1050634866 /nfs/dbraw/zinc/63/48/66/1050634866.db2.gz ZQROKZCXGOCQSC-HNNXBMFYSA-N 1 2 324.255 4.155 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](C)[C@H]1CCc2c1cccc2Cl ZINC000788007847 1050634880 /nfs/dbraw/zinc/63/48/80/1050634880.db2.gz ZQROKZCXGOCQSC-HNNXBMFYSA-N 1 2 324.255 4.155 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccccc2F)cc1F ZINC001144666115 1050646079 /nfs/dbraw/zinc/64/60/79/1050646079.db2.gz GTBNLFXKEXECHX-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccccc2F)cc1F ZINC001144666115 1050646082 /nfs/dbraw/zinc/64/60/82/1050646082.db2.gz GTBNLFXKEXECHX-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1nc(F)ccc1Br ZINC001213494915 1050669528 /nfs/dbraw/zinc/66/95/28/1050669528.db2.gz MJRGRWBPQFKQJR-UHFFFAOYSA-N 1 2 322.181 4.308 20 0 DIADLO COc1ncc(Nc2cc(C3CC3)c[nH+]c2C)cc1C(F)(F)F ZINC001213494866 1050669703 /nfs/dbraw/zinc/66/97/03/1050669703.db2.gz JZNLAAJKVITCDJ-UHFFFAOYSA-N 1 2 323.318 4.433 20 0 DIADLO Cc1nc(Nc2cc(C3CC3)c[nH+]c2C)ccc1Br ZINC001213488943 1050669862 /nfs/dbraw/zinc/66/98/62/1050669862.db2.gz HKMHZSPDERQLHG-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1cnc(Br)c(Nc2cc(C3CC3)c[nH+]c2C)c1 ZINC001213491399 1050670202 /nfs/dbraw/zinc/67/02/02/1050670202.db2.gz JBHDKNOWMQTQAA-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cccc(Br)n1 ZINC001213490081 1050670743 /nfs/dbraw/zinc/67/07/43/1050670743.db2.gz YXSWFMQHOGCCJH-UHFFFAOYSA-N 1 2 304.191 4.169 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cc(Br)ccc1O ZINC001213499481 1050672607 /nfs/dbraw/zinc/67/26/07/1050672607.db2.gz LCGBCEWFPWSGMW-UHFFFAOYSA-N 1 2 319.202 4.479 20 0 DIADLO Cc1cc(C)c(Nc2cnc(Br)c(Cl)c2)c[nH+]1 ZINC001213507714 1050676146 /nfs/dbraw/zinc/67/61/46/1050676146.db2.gz CKNYZUKJQLHAOO-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO CO[C@@H]1CCOc2c(Nc3cc(C4CC4)c[nH+]c3C)cccc21 ZINC001213500918 1050674877 /nfs/dbraw/zinc/67/48/77/1050674877.db2.gz CMKBPBNUACLHSO-GOSISDBHSA-N 1 2 310.397 4.481 20 0 DIADLO CCOC(=O)Cc1ccccc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213503573 1050674906 /nfs/dbraw/zinc/67/49/06/1050674906.db2.gz NBLWKPSQDNJPDP-UHFFFAOYSA-N 1 2 310.397 4.117 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(-c2ccncn2)cc1 ZINC001213501332 1050675066 /nfs/dbraw/zinc/67/50/66/1050675066.db2.gz SWRFZHSBFDFDPJ-UHFFFAOYSA-N 1 2 302.381 4.468 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2c(c1)C(C)(C)CNC2=O ZINC001213503545 1050675156 /nfs/dbraw/zinc/67/51/56/1050675156.db2.gz LWXBYBLQXSFFDF-UHFFFAOYSA-N 1 2 321.424 4.032 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cc(OC(F)(F)F)ccc1N ZINC001213501099 1050675214 /nfs/dbraw/zinc/67/52/14/1050675214.db2.gz HWPMWXRBFRUGQJ-UHFFFAOYSA-N 1 2 323.318 4.492 20 0 DIADLO C[N@H+](CCC(=O)c1ccccc1)Cc1cc(F)c(F)cc1Cl ZINC001144726162 1050675223 /nfs/dbraw/zinc/67/52/23/1050675223.db2.gz HDZCVNHUSCJJTA-UHFFFAOYSA-N 1 2 323.770 4.323 20 0 DIADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1cc(F)c(F)cc1Cl ZINC001144726162 1050675230 /nfs/dbraw/zinc/67/52/30/1050675230.db2.gz HDZCVNHUSCJJTA-UHFFFAOYSA-N 1 2 323.770 4.323 20 0 DIADLO Cc1cc(C)c(Nc2nc3cc(Br)ccc3o2)c[nH+]1 ZINC001213505628 1050675337 /nfs/dbraw/zinc/67/53/37/1050675337.db2.gz KWJHRTBIPNDVQX-UHFFFAOYSA-N 1 2 318.174 4.346 20 0 DIADLO Cc1noc(-c2ccc(Nc3cc(C4CC4)c[nH+]c3C)cc2)n1 ZINC001213501375 1050675438 /nfs/dbraw/zinc/67/54/38/1050675438.db2.gz VRYJZBQLKOMYRE-UHFFFAOYSA-N 1 2 306.369 4.369 20 0 DIADLO Cc1cc(C)c(Nc2cc(Br)cnc2Cl)c[nH+]1 ZINC001213508251 1050676126 /nfs/dbraw/zinc/67/61/26/1050676126.db2.gz OCWJLUJZCXXYJH-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO CCOC(=O)c1cnc2c(cccc2Nc2c[nH+]c(C)cc2C)c1 ZINC001213518418 1050676230 /nfs/dbraw/zinc/67/62/30/1050676230.db2.gz NCXIQZRWTZXWEC-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO COc1ccc(Nc2c[nH+]c(C)cc2C)cc1Br ZINC001213513471 1050676559 /nfs/dbraw/zinc/67/65/59/1050676559.db2.gz MMRNYUUCTROQLU-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO CC(=O)N1CC(C)(C)c2ccc(Nc3c[nH+]c(C)cc3C)cc21 ZINC001213515726 1050676814 /nfs/dbraw/zinc/67/68/14/1050676814.db2.gz HGRGMVNLRQZGNQ-UHFFFAOYSA-N 1 2 309.413 4.086 20 0 DIADLO Cc1cc(C)c(Nc2cccc(C(=O)Nc3cccnc3)c2)c[nH+]1 ZINC001213518356 1050677352 /nfs/dbraw/zinc/67/73/52/1050677352.db2.gz JSVDVZMSZSMCTI-UHFFFAOYSA-N 1 2 318.380 4.089 20 0 DIADLO Cc1cc(C)c(Nc2cc(Cl)cc(Br)n2)c[nH+]1 ZINC001213510583 1050677674 /nfs/dbraw/zinc/67/76/74/1050677674.db2.gz FPWHMKMZRDMRGQ-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1cc(C)c(Nc2c(F)cccc2OC2CCOCC2)c[nH+]1 ZINC001213521166 1050679059 /nfs/dbraw/zinc/67/90/59/1050679059.db2.gz XKCCPDNFYUFFFN-UHFFFAOYSA-N 1 2 316.376 4.139 20 0 DIADLO COC(=O)c1c(F)ccc(Nc2c[nH+]c(C)cc2C)c1Cl ZINC001213521153 1050679484 /nfs/dbraw/zinc/67/94/84/1050679484.db2.gz WRLDLQNOPHRUQX-UHFFFAOYSA-N 1 2 308.740 4.021 20 0 DIADLO COc1cccc(C(=O)C(F)(F)F)c1Nc1c[nH+]c(C)cc1C ZINC001213520877 1050679645 /nfs/dbraw/zinc/67/96/45/1050679645.db2.gz KPEIUSVAHCIZRL-UHFFFAOYSA-N 1 2 324.302 4.196 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(OC[C@@H]3CCCO3)c(F)c2)c1C ZINC001213530856 1050681319 /nfs/dbraw/zinc/68/13/19/1050681319.db2.gz OLXFXHJCPCCROL-HNNXBMFYSA-N 1 2 316.376 4.139 20 0 DIADLO COCc1ccc(Br)c(Nc2c[nH+]cc(C)c2C)c1 ZINC001213536911 1050681420 /nfs/dbraw/zinc/68/14/20/1050681420.db2.gz RVSNPUUCNOGMKI-UHFFFAOYSA-N 1 2 321.218 4.351 20 0 DIADLO Cc1c[nH+]cc(Nc2c(F)cccc2OC2CCOCC2)c1C ZINC001213534113 1050681658 /nfs/dbraw/zinc/68/16/58/1050681658.db2.gz NBCZLEQKVAARLY-UHFFFAOYSA-N 1 2 316.376 4.139 20 0 DIADLO CCOC(=O)c1ccc2c(cccc2Nc2c[nH+]cc(C)c2C)n1 ZINC001213534310 1050681749 /nfs/dbraw/zinc/68/17/49/1050681749.db2.gz WLNSHDLJCFAKSX-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(OCc3ccncc3)cc2)c1C ZINC001213532449 1050682171 /nfs/dbraw/zinc/68/21/71/1050682171.db2.gz IUOASOBFSQHXFF-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO CNc1ccc(Br)cc1Nc1c[nH+]cc(C)c1C ZINC001213537221 1050682443 /nfs/dbraw/zinc/68/24/43/1050682443.db2.gz XJQWEQLZPXGMFV-UHFFFAOYSA-N 1 2 306.207 4.246 20 0 DIADLO Fc1cc(Cl)c(C[NH+]2CCC(C(F)(F)F)CC2)cc1F ZINC001144722154 1050684754 /nfs/dbraw/zinc/68/47/54/1050684754.db2.gz PRGNZQRYYLXFDZ-UHFFFAOYSA-N 1 2 313.697 4.393 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2cnc(Cl)cn2)C2CC2)o1 ZINC000788471862 1050686113 /nfs/dbraw/zinc/68/61/13/1050686113.db2.gz VOPHORGDVHEFBX-IAQYHMDHSA-N 1 2 317.820 4.011 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cnc(Cl)cn2)C2CC2)o1 ZINC000788471862 1050686118 /nfs/dbraw/zinc/68/61/18/1050686118.db2.gz VOPHORGDVHEFBX-IAQYHMDHSA-N 1 2 317.820 4.011 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@@H+]2Cc2cnc(Cl)cn2)o1 ZINC000788480019 1050687370 /nfs/dbraw/zinc/68/73/70/1050687370.db2.gz FOSVPJIDIFFABM-HNNXBMFYSA-N 1 2 319.836 4.403 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@H+]2Cc2cnc(Cl)cn2)o1 ZINC000788480019 1050687382 /nfs/dbraw/zinc/68/73/82/1050687382.db2.gz FOSVPJIDIFFABM-HNNXBMFYSA-N 1 2 319.836 4.403 20 0 DIADLO Clc1ccccc1C[NH2+][C@@H]1COCc2cccc(Cl)c21 ZINC000788497057 1050690097 /nfs/dbraw/zinc/69/00/97/1050690097.db2.gz CXCYZFXMNVMPDM-OAHLLOKOSA-N 1 2 308.208 4.355 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[N@H+](C)Cc1cnc(Cl)cn1 ZINC000788484540 1050690588 /nfs/dbraw/zinc/69/05/88/1050690588.db2.gz ANAFBXRFNWYQAU-NSHDSACASA-N 1 2 324.881 4.211 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)Cc1cnc(Cl)cn1 ZINC000788484540 1050690595 /nfs/dbraw/zinc/69/05/95/1050690595.db2.gz ANAFBXRFNWYQAU-NSHDSACASA-N 1 2 324.881 4.211 20 0 DIADLO CC(C)([NH2+]Cc1cc2ccccc2c(Cl)n1)c1nccs1 ZINC000788492097 1050691159 /nfs/dbraw/zinc/69/11/59/1050691159.db2.gz APDHPZPBVMTGLD-UHFFFAOYSA-N 1 2 317.845 4.370 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001144749884 1050699262 /nfs/dbraw/zinc/69/92/62/1050699262.db2.gz SSHSLPWNLVWBFF-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001144749884 1050699268 /nfs/dbraw/zinc/69/92/68/1050699268.db2.gz SSHSLPWNLVWBFF-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO CCn1cnnc1C[NH2+][C@@H](C)c1ccccc1SC(C)(C)C ZINC000788525910 1050703159 /nfs/dbraw/zinc/70/31/59/1050703159.db2.gz GDQQYOIAOSHNSP-ZDUSSCGKSA-N 1 2 318.490 4.039 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H](C)c3ccco3)c2)[nH+]c1C ZINC000741670405 1050722653 /nfs/dbraw/zinc/72/26/53/1050722653.db2.gz ALWIDTMENIYWOZ-LLVKDONJSA-N 1 2 309.369 4.029 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3CCC[C@H](C)C3)c2)[nH+]c1C ZINC000741673430 1050725781 /nfs/dbraw/zinc/72/57/81/1050725781.db2.gz TWCSTXMKWADYHO-LRDDRELGSA-N 1 2 311.429 4.458 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@@H+]1CC[C@H](CC(C)(C)C)C1 ZINC001171229967 1050726620 /nfs/dbraw/zinc/72/66/20/1050726620.db2.gz LPLKZTXJICOTDK-CJNGLKHVSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@H+]1CC[C@H](CC(C)(C)C)C1 ZINC001171229967 1050726635 /nfs/dbraw/zinc/72/66/35/1050726635.db2.gz LPLKZTXJICOTDK-CJNGLKHVSA-N 1 2 323.864 4.312 20 0 DIADLO CCN(CC)c1ccc(NCc2cnc3ccccc3c2)c[nH+]1 ZINC000772941154 1050727367 /nfs/dbraw/zinc/72/73/67/1050727367.db2.gz ZLENZDUBDMJBTF-UHFFFAOYSA-N 1 2 306.413 4.088 20 0 DIADLO O=c1ccc2cc(Nc3cc[nH+]c4cc(Cl)ccc34)ccc2[nH]1 ZINC001213769774 1050735003 /nfs/dbraw/zinc/73/50/03/1050735003.db2.gz NVGZLVNPYYIZIO-UHFFFAOYSA-N 1 2 321.767 4.473 20 0 DIADLO Cc1cc(N[C@@H]2CCc3ccc(Cl)nc32)ccc1[NH+](C)C ZINC000788729144 1050734870 /nfs/dbraw/zinc/73/48/70/1050734870.db2.gz QQSTVAPYILROGV-CQSZACIVSA-N 1 2 301.821 4.209 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1ccc2[nH]c(=O)ccc2c1 ZINC001213771898 1050735407 /nfs/dbraw/zinc/73/54/07/1050735407.db2.gz LBKQAZVGGYJIBR-UHFFFAOYSA-N 1 2 307.397 4.174 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000741783894 1050739943 /nfs/dbraw/zinc/73/99/43/1050739943.db2.gz DHNWKQHIENWLQS-KBXCAEBGSA-N 1 2 314.429 4.037 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000741783894 1050739951 /nfs/dbraw/zinc/73/99/51/1050739951.db2.gz DHNWKQHIENWLQS-KBXCAEBGSA-N 1 2 314.429 4.037 20 0 DIADLO CCn1ncnc1C[NH2+][C@H](C)c1ccccc1SC(C)(C)C ZINC000788803831 1050748086 /nfs/dbraw/zinc/74/80/86/1050748086.db2.gz HPKLTBVQZRPFBP-CYBMUJFWSA-N 1 2 318.490 4.039 20 0 DIADLO CC(C)(C)Oc1ccc(-c2cccc(Cn3cc[nH+]c3)c2)cn1 ZINC000846780371 1050750134 /nfs/dbraw/zinc/75/01/34/1050750134.db2.gz VBIIDAXOYDRNKZ-UHFFFAOYSA-N 1 2 307.397 4.171 20 0 DIADLO O[C@@H](c1ccc(-c2cccc(Cn3cc[nH+]c3)c2)cc1)C1CCC1 ZINC000846781083 1050751730 /nfs/dbraw/zinc/75/17/30/1050751730.db2.gz ZOPNUZFSOZRFGV-OAQYLSRUSA-N 1 2 318.420 4.432 20 0 DIADLO Cc1ncc(C(F)(F)F)cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001213828757 1050755124 /nfs/dbraw/zinc/75/51/24/1050755124.db2.gz VHRRIOCOTOAZRA-UHFFFAOYSA-N 1 2 322.334 4.148 20 0 DIADLO Cc1ncc(C(F)(F)F)cc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001213830888 1050756064 /nfs/dbraw/zinc/75/60/64/1050756064.db2.gz PHNTWSLONLAKKF-UHFFFAOYSA-N 1 2 318.302 4.338 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(N3CCCC3)cc2F)[nH+]1 ZINC001213844339 1050761973 /nfs/dbraw/zinc/76/19/73/1050761973.db2.gz YWQSCOINIHSLJR-UHFFFAOYSA-N 1 2 310.376 4.126 20 0 DIADLO CC(=O)C1CC[NH+](Cc2ccc(C)c(Cl)c2Cl)CC1 ZINC001231667451 1050764485 /nfs/dbraw/zinc/76/44/85/1050764485.db2.gz OKSYBLSZTHGOPN-UHFFFAOYSA-N 1 2 300.229 4.103 20 0 DIADLO CC(C)(C)C[C@H]([NH2+]Cc1cnsn1)c1ccc(Cl)cc1 ZINC000846844728 1050769792 /nfs/dbraw/zinc/76/97/92/1050769792.db2.gz DZYZUDRDRZKZKW-AWEZNQCLSA-N 1 2 309.866 4.459 20 0 DIADLO c1cc(N2CCCC2)ccc1[NH2+][C@@H]1CCCC[C@@H]1[C@@H]1CCOC1 ZINC000788986672 1050771498 /nfs/dbraw/zinc/77/14/98/1050771498.db2.gz YPTBAIIFKSVNES-NSISKUIASA-N 1 2 314.473 4.294 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CCCC[C@@H]1[C@@H]1CCOC1 ZINC000788986672 1050771510 /nfs/dbraw/zinc/77/15/10/1050771510.db2.gz YPTBAIIFKSVNES-NSISKUIASA-N 1 2 314.473 4.294 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCC34CCCC4)cc2)C[C@@H](C)O1 ZINC000788986692 1050771763 /nfs/dbraw/zinc/77/17/63/1050771763.db2.gz YSRSGMWDOKQZGU-GPMSIDNRSA-N 1 2 314.473 4.435 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CCC34CCCC4)cc2)C[C@@H](C)O1 ZINC000788986696 1050772344 /nfs/dbraw/zinc/77/23/44/1050772344.db2.gz YSRSGMWDOKQZGU-MDZRGWNJSA-N 1 2 314.473 4.435 20 0 DIADLO Fc1ccc(Cl)c(Nc2ccc(N3CCCC3)[nH+]c2)c1F ZINC001213947419 1050787495 /nfs/dbraw/zinc/78/74/95/1050787495.db2.gz XZHZUGORYSOGRU-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO O=c1ccc2c(Nc3ccc[nH+]c3N3CCCCC3)cccc2[nH]1 ZINC001213967420 1050793156 /nfs/dbraw/zinc/79/31/56/1050793156.db2.gz CEOAZWTZMJGBIG-UHFFFAOYSA-N 1 2 320.396 4.069 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cn2ccc(C(F)(F)F)n2)c1C ZINC000742153570 1050807929 /nfs/dbraw/zinc/80/79/29/1050807929.db2.gz SRKJSJQCPXZCRF-OAHLLOKOSA-N 1 2 323.362 4.313 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cn2ccc(C(F)(F)F)n2)c1C ZINC000742153570 1050807933 /nfs/dbraw/zinc/80/79/33/1050807933.db2.gz SRKJSJQCPXZCRF-OAHLLOKOSA-N 1 2 323.362 4.313 20 0 DIADLO CC[C@@H](Cc1ccc(C)cc1)[N@H+](CC)Cn1ncsc1=S ZINC000742178656 1050809484 /nfs/dbraw/zinc/80/94/84/1050809484.db2.gz YQBQDLUSAQBWJD-HNNXBMFYSA-N 1 2 321.515 4.283 20 0 DIADLO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](CC)Cn1ncsc1=S ZINC000742178656 1050809493 /nfs/dbraw/zinc/80/94/93/1050809493.db2.gz YQBQDLUSAQBWJD-HNNXBMFYSA-N 1 2 321.515 4.283 20 0 DIADLO OCc1cc(F)c(Nc2ccc([NH+]3CCCCC3)cc2)c(F)c1 ZINC001214096863 1050818291 /nfs/dbraw/zinc/81/82/91/1050818291.db2.gz NXWJARHUKXLUOE-UHFFFAOYSA-N 1 2 318.367 4.191 20 0 DIADLO CCCC[C@@H]([NH2+][C@H](C)c1cn[nH]c1C)c1ccc(OC)cc1 ZINC000180424675 1050834597 /nfs/dbraw/zinc/83/45/97/1050834597.db2.gz HJEGYCKPCVICIT-FZKQIMNGSA-N 1 2 301.434 4.309 20 0 DIADLO Cc1ccc(Nc2cc[nH+]c(NC(=O)OC(C)(C)C)c2)c(N)c1 ZINC001214176234 1050841271 /nfs/dbraw/zinc/84/12/71/1050841271.db2.gz YVNAFHMAVDBFQR-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO CCCCC[C@H](C)CC(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000742590644 1050896336 /nfs/dbraw/zinc/89/63/36/1050896336.db2.gz SBERZDTZNXIFEB-INIZCTEOSA-N 1 2 313.445 4.095 20 0 DIADLO CCCCC[C@H](C)CC(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC000742597262 1050900755 /nfs/dbraw/zinc/90/07/55/1050900755.db2.gz RVHQERGOZSJDHQ-AWEZNQCLSA-N 1 2 320.477 4.272 20 0 DIADLO CCCCCC[C@@](C)(CC)C(=O)N1CC(Oc2cc[nH+]cc2)C1 ZINC000742627196 1050905159 /nfs/dbraw/zinc/90/51/59/1050905159.db2.gz HAOUVTIIVQNUJC-LJQANCHMSA-N 1 2 318.461 4.058 20 0 DIADLO C[C@H]1CN(c2ccc([NH2+]C[C@@H]3CCc4ccccc43)cc2)CCO1 ZINC000790054154 1050908590 /nfs/dbraw/zinc/90/85/90/1050908590.db2.gz GXXIZZMDQXPGQS-WMZOPIPTSA-N 1 2 322.452 4.054 20 0 DIADLO CC(=O)Nc1cc(Nc2c(F)ccc(Cl)c2Cl)cc[nH+]1 ZINC001214505266 1050928470 /nfs/dbraw/zinc/92/84/70/1050928470.db2.gz QWKZKERVUDYOGC-UHFFFAOYSA-N 1 2 314.147 4.230 20 0 DIADLO Cc1nc(SCc2ccc(-n3cc[nH+]c3)cc2)sc1C ZINC000790268525 1050939099 /nfs/dbraw/zinc/93/90/99/1050939099.db2.gz LVHBRZNPVKCKMV-UHFFFAOYSA-N 1 2 301.440 4.238 20 0 DIADLO OCc1c(F)cccc1Nc1cc[nH+]c2cc(Cl)ccc12 ZINC001214609768 1050961073 /nfs/dbraw/zinc/96/10/73/1050961073.db2.gz BERLPBHDNUUQTE-UHFFFAOYSA-N 1 2 302.736 4.263 20 0 DIADLO Cn1nccc1[C@@H]1CCC[C@@H](Nc2ccc([NH+]3CCCC3)cc2)C1 ZINC000790493461 1050965083 /nfs/dbraw/zinc/96/50/83/1050965083.db2.gz ADCRYYLULGPXBD-SJLPKXTDSA-N 1 2 324.472 4.159 20 0 DIADLO Cn1nccc1[C@@H]1CCC[C@@H]([NH2+]c2ccc(N3CCCC3)cc2)C1 ZINC000790493461 1050965090 /nfs/dbraw/zinc/96/50/90/1050965090.db2.gz ADCRYYLULGPXBD-SJLPKXTDSA-N 1 2 324.472 4.159 20 0 DIADLO COc1ccc(C)c(F)c1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001214629879 1050965489 /nfs/dbraw/zinc/96/54/89/1050965489.db2.gz YJZQNNMDOFYWNS-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO CC(=O)c1ccc(F)c(Nc2cc(Cl)c3[nH+]ccn3c2)c1F ZINC001214757956 1050993861 /nfs/dbraw/zinc/99/38/61/1050993861.db2.gz DEBNMUOZJHJFGT-UHFFFAOYSA-N 1 2 321.714 4.212 20 0 DIADLO CCSCc1cc[nH+]c(N[C@H]2CCCC23CCOCC3)c1 ZINC000282750590 1050997224 /nfs/dbraw/zinc/99/72/24/1050997224.db2.gz NSWIMZBGMJMDIN-HNNXBMFYSA-N 1 2 306.475 4.096 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2cc3ccccc3s2)o1 ZINC000348190050 1051004240 /nfs/dbraw/zinc/00/42/40/1051004240.db2.gz ZUVWRZUISODPCB-MNOVXSKESA-N 1 2 301.415 4.259 20 0 DIADLO Oc1c(Cl)ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1F ZINC001214799389 1051004598 /nfs/dbraw/zinc/00/45/98/1051004598.db2.gz VIWRDODIPDIEOU-UHFFFAOYSA-N 1 2 317.751 4.173 20 0 DIADLO COc1ccc(NC(=[NH2+])c2cccnc2Cl)cc1C(C)C ZINC001171351326 1051011998 /nfs/dbraw/zinc/01/19/98/1051011998.db2.gz GKPQQJCSMYPTAD-UHFFFAOYSA-N 1 2 303.793 4.304 20 0 DIADLO CCCC[N@H+](Cc1ccccc1Cl)Cn1cc[nH]c1=S ZINC000743358850 1051017941 /nfs/dbraw/zinc/01/79/41/1051017941.db2.gz FWDYHNMAWZGUTC-UHFFFAOYSA-N 1 2 309.866 4.085 20 0 DIADLO CCCC[N@@H+](Cc1ccccc1Cl)Cn1cc[nH]c1=S ZINC000743358850 1051017933 /nfs/dbraw/zinc/01/79/33/1051017933.db2.gz FWDYHNMAWZGUTC-UHFFFAOYSA-N 1 2 309.866 4.085 20 0 DIADLO Cc1ccc2c(Nc3ccc(CO)c(F)c3F)cccc2[nH+]1 ZINC001215041326 1051058861 /nfs/dbraw/zinc/05/88/61/1051058861.db2.gz PVOOGLBGEXXBBB-UHFFFAOYSA-N 1 2 300.308 4.057 20 0 DIADLO Clc1ccccc1-c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001215116660 1051079669 /nfs/dbraw/zinc/07/96/69/1051079669.db2.gz AOJGUPIXPRKDNA-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO Cc1cccc([C@H]2CCCC[N@H+]2Cc2ncc(Cl)n2C)c1C ZINC000743862800 1051087628 /nfs/dbraw/zinc/08/76/28/1051087628.db2.gz KTTAHOFPHRXQLQ-MRXNPFEDSA-N 1 2 317.864 4.418 20 0 DIADLO Cc1cccc([C@H]2CCCC[N@@H+]2Cc2ncc(Cl)n2C)c1C ZINC000743862800 1051087634 /nfs/dbraw/zinc/08/76/34/1051087634.db2.gz KTTAHOFPHRXQLQ-MRXNPFEDSA-N 1 2 317.864 4.418 20 0 DIADLO Clc1cccc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)c1 ZINC001215170073 1051098124 /nfs/dbraw/zinc/09/81/24/1051098124.db2.gz BYHJRKFYYVXLMX-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO Cc1ccc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)cc1F ZINC001215170091 1051099097 /nfs/dbraw/zinc/09/90/97/1051099097.db2.gz DCZGPLJAPMBUDD-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Cc1cc[nH+]cc1NCCc1ccc(OCc2ccccn2)cc1 ZINC001171425445 1051113242 /nfs/dbraw/zinc/11/32/42/1051113242.db2.gz FYTLLPXSENRPIO-UHFFFAOYSA-N 1 2 319.408 4.019 20 0 DIADLO COC(=O)Cc1ccc(Nc2ccc3c(C)cc[nH+]c3c2)cc1 ZINC001212621329 1051145328 /nfs/dbraw/zinc/14/53/28/1051145328.db2.gz YEVVDEIAUJLUFR-UHFFFAOYSA-N 1 2 306.365 4.002 20 0 DIADLO CCC(C)(C)c1ccc(C[N@H+](C)[C@@H](C)c2nc(C)no2)cc1 ZINC001171591702 1051162125 /nfs/dbraw/zinc/16/21/25/1051162125.db2.gz NVNGUWDRQLKAEB-ZDUSSCGKSA-N 1 2 301.434 4.259 20 0 DIADLO CCC(C)(C)c1ccc(C[N@@H+](C)[C@@H](C)c2nc(C)no2)cc1 ZINC001171591702 1051162132 /nfs/dbraw/zinc/16/21/32/1051162132.db2.gz NVNGUWDRQLKAEB-ZDUSSCGKSA-N 1 2 301.434 4.259 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC001170254802 1051175827 /nfs/dbraw/zinc/17/58/27/1051175827.db2.gz WZMBJULYJBZNFI-KBPBESRZSA-N 1 2 318.219 4.276 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC001170254802 1051175831 /nfs/dbraw/zinc/17/58/31/1051175831.db2.gz WZMBJULYJBZNFI-KBPBESRZSA-N 1 2 318.219 4.276 20 0 DIADLO Cc1c[nH+]cc(NCc2ccc(C3(C(F)(F)F)N=N3)cc2)c1C ZINC001170291766 1051175993 /nfs/dbraw/zinc/17/59/93/1051175993.db2.gz DZYJVUQSDDRZIF-UHFFFAOYSA-N 1 2 320.318 4.491 20 0 DIADLO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cn1nc(-c2sccc2C)oc1=S ZINC000744439658 1051177117 /nfs/dbraw/zinc/17/71/17/1051177117.db2.gz BPHBUOIHAAMAEC-ZYHUDNBSSA-N 1 2 323.487 4.320 20 0 DIADLO CC[C@@H]1C[C@@H](C)C[N@H+]1Cn1nc(-c2sccc2C)oc1=S ZINC000744439658 1051177118 /nfs/dbraw/zinc/17/71/18/1051177118.db2.gz BPHBUOIHAAMAEC-ZYHUDNBSSA-N 1 2 323.487 4.320 20 0 DIADLO COc1cccc2[nH+]c(NC3CC(C)(C)OC(C)(C)C3)ccc21 ZINC001170360474 1051189800 /nfs/dbraw/zinc/18/98/00/1051189800.db2.gz WDSIXAWMJWVTIK-UHFFFAOYSA-N 1 2 314.429 4.392 20 0 DIADLO Cc1ccc(OCc2ccccc2)cc1Nc1[nH+]cccc1N ZINC001215406656 1051191121 /nfs/dbraw/zinc/19/11/21/1051191121.db2.gz AAVRWCLPRXWDNT-UHFFFAOYSA-N 1 2 305.381 4.295 20 0 DIADLO C[N@@H+]1CCC=C(c2c(C(F)(F)F)cccc2C(F)(F)F)C1 ZINC001241569804 1051197759 /nfs/dbraw/zinc/19/77/59/1051197759.db2.gz QSOCEROCGRBCHG-UHFFFAOYSA-N 1 2 309.253 4.443 20 0 DIADLO C[N@H+]1CCC=C(c2c(C(F)(F)F)cccc2C(F)(F)F)C1 ZINC001241569804 1051197767 /nfs/dbraw/zinc/19/77/67/1051197767.db2.gz QSOCEROCGRBCHG-UHFFFAOYSA-N 1 2 309.253 4.443 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(C2CC2)n1C1CC1)c1ccc(Cl)s1 ZINC000183000141 1051213447 /nfs/dbraw/zinc/21/34/47/1051213447.db2.gz SDTQRJYVHMPLEY-SECBINFHSA-N 1 2 322.865 4.056 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+][C@H](C)c1nc(C)sc1C ZINC000037089646 1051219378 /nfs/dbraw/zinc/21/93/78/1051219378.db2.gz CNKPNBSETLEZNN-VHSXEESVSA-N 1 2 308.422 4.319 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)O[C@@H](C)c1ccccc1F)c1ccccc1 ZINC000745097592 1051221805 /nfs/dbraw/zinc/22/18/05/1051221805.db2.gz GVTVEQCKVWUOIS-KSSFIOAISA-N 1 2 315.388 4.123 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)O[C@@H](C)c1ccccc1F)c1ccccc1 ZINC000745097592 1051221812 /nfs/dbraw/zinc/22/18/12/1051221812.db2.gz GVTVEQCKVWUOIS-KSSFIOAISA-N 1 2 315.388 4.123 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)O[C@@H](C)c1ccccc1F)c1ccccc1 ZINC000745097590 1051221893 /nfs/dbraw/zinc/22/18/93/1051221893.db2.gz GVTVEQCKVWUOIS-KBXCAEBGSA-N 1 2 315.388 4.123 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)O[C@@H](C)c1ccccc1F)c1ccccc1 ZINC000745097590 1051221902 /nfs/dbraw/zinc/22/19/02/1051221902.db2.gz GVTVEQCKVWUOIS-KBXCAEBGSA-N 1 2 315.388 4.123 20 0 DIADLO CCC1(CC)CCC[N@@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001171953919 1051241941 /nfs/dbraw/zinc/24/19/41/1051241941.db2.gz ATQKVSBBCYJJAD-MRXNPFEDSA-N 1 2 323.864 4.456 20 0 DIADLO CCC1(CC)CCC[N@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001171953919 1051241946 /nfs/dbraw/zinc/24/19/46/1051241946.db2.gz ATQKVSBBCYJJAD-MRXNPFEDSA-N 1 2 323.864 4.456 20 0 DIADLO Cc1cc[nH+]c(Nc2ccc3cnn([C@@H]4CCCCO4)c3c2)c1 ZINC001215559940 1051244347 /nfs/dbraw/zinc/24/43/47/1051244347.db2.gz XTLPRBXRZGJTQS-SFHVURJKSA-N 1 2 308.385 4.182 20 0 DIADLO Cc1ccccc1Nc1nc(C[NH2+][C@H](C)c2ccccn2)cs1 ZINC000182399672 1051248493 /nfs/dbraw/zinc/24/84/93/1051248493.db2.gz HJNJYBMEHVZZCX-CQSZACIVSA-N 1 2 324.453 4.441 20 0 DIADLO COCCOc1ccccc1Nc1c(C)cc[nH+]c1C(C)C ZINC001212638466 1051272207 /nfs/dbraw/zinc/27/22/07/1051272207.db2.gz RNSADLVWDFWHEX-UHFFFAOYSA-N 1 2 300.402 4.282 20 0 DIADLO Cc1ccc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)c(F)c1 ZINC001215623210 1051278712 /nfs/dbraw/zinc/27/87/12/1051278712.db2.gz LRYMZRBXZMIAKQ-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO COc1ncc([C@H](C)Nc2ccc([NH+](C)C)c(C)c2)cc1Cl ZINC000793542320 1051313906 /nfs/dbraw/zinc/31/39/06/1051313906.db2.gz INMVONHCNIZZLL-LBPRGKRZSA-N 1 2 319.836 4.291 20 0 DIADLO Cc1cc([C@H](C)[NH2+]C2(c3c(Cl)cccc3Cl)CC2)n(C)n1 ZINC000793547092 1051316000 /nfs/dbraw/zinc/31/60/00/1051316000.db2.gz JZZPSJUSIUVEAC-NSHDSACASA-N 1 2 324.255 4.375 20 0 DIADLO COc1cc(C)cc(F)c1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001215709277 1051317006 /nfs/dbraw/zinc/31/70/06/1051317006.db2.gz LTVBRPBNGDCZSW-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@H+](C)[C@@H](C)c2ccco2)cc1 ZINC000746124453 1051324400 /nfs/dbraw/zinc/32/44/00/1051324400.db2.gz LWRCDQBQBJUNIW-CABCVRRESA-N 1 2 314.429 4.425 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@@H+](C)[C@@H](C)c2ccco2)cc1 ZINC000746124453 1051324415 /nfs/dbraw/zinc/32/44/15/1051324415.db2.gz LWRCDQBQBJUNIW-CABCVRRESA-N 1 2 314.429 4.425 20 0 DIADLO CCCNc1ccc(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000193358004 1051371808 /nfs/dbraw/zinc/37/18/08/1051371808.db2.gz PEJAQAXGSQXELN-IBGZPJMESA-N 1 2 320.440 4.111 20 0 DIADLO COc1cnc(F)cc1Nc1cc[nH+]c2cc(Cl)ccc12 ZINC001215804636 1051380317 /nfs/dbraw/zinc/38/03/17/1051380317.db2.gz DIVYQWMIRHDNNG-UHFFFAOYSA-N 1 2 303.724 4.175 20 0 DIADLO CC[C@@H](CC(C)C)[N@@H+]1CCCC[C@H]1c1noc(C(F)(F)F)n1 ZINC001172406166 1051381087 /nfs/dbraw/zinc/38/10/87/1051381087.db2.gz GFGQLMYOXLKPIM-RYUDHWBXSA-N 1 2 319.371 4.440 20 0 DIADLO CC[C@@H](CC(C)C)[N@H+]1CCCC[C@H]1c1noc(C(F)(F)F)n1 ZINC001172406166 1051381094 /nfs/dbraw/zinc/38/10/94/1051381094.db2.gz GFGQLMYOXLKPIM-RYUDHWBXSA-N 1 2 319.371 4.440 20 0 DIADLO O[C@H](CNc1cc[nH+]c2c(Cl)cccc12)c1cccc(F)c1 ZINC000804378723 1051386867 /nfs/dbraw/zinc/38/68/67/1051386867.db2.gz BNVAKLDSWDFHSU-MRXNPFEDSA-N 1 2 316.763 4.173 20 0 DIADLO CCO[C@H]1C[C@@H](Nc2cccc(-n3cc[nH+]c3)c2)C12CCCC2 ZINC000390962233 1051405742 /nfs/dbraw/zinc/40/57/42/1051405742.db2.gz ZUJJCSPEPJTFDH-MSOLQXFVSA-N 1 2 311.429 4.022 20 0 DIADLO Cc1nc(-c2cc([C@H](C)[NH2+]Cc3ccon3)cs2)cs1 ZINC000766418716 1051418936 /nfs/dbraw/zinc/41/89/36/1051418936.db2.gz JYVLMDWDIYGCQM-VIFPVBQESA-N 1 2 305.428 4.019 20 0 DIADLO Cc1nn(C[N@H+]2C[C@H](c3ccccc3C)C[C@H]2C)c(=S)s1 ZINC000738054892 1051419322 /nfs/dbraw/zinc/41/93/22/1051419322.db2.gz QGNAIHXVBANVLT-TZMCWYRMSA-N 1 2 319.499 4.126 20 0 DIADLO Cc1nn(C[N@@H+]2C[C@H](c3ccccc3C)C[C@H]2C)c(=S)s1 ZINC000738054892 1051419332 /nfs/dbraw/zinc/41/93/32/1051419332.db2.gz QGNAIHXVBANVLT-TZMCWYRMSA-N 1 2 319.499 4.126 20 0 DIADLO CC(C)c1ccc(NC(=O)C[N@@H+]2CC[C@H]2c2ccccc2)cc1 ZINC000746458364 1051422707 /nfs/dbraw/zinc/42/27/07/1051422707.db2.gz XTJWFCJZPUMAPT-IBGZPJMESA-N 1 2 308.425 4.196 20 0 DIADLO CC(C)c1ccc(NC(=O)C[N@H+]2CC[C@H]2c2ccccc2)cc1 ZINC000746458364 1051422719 /nfs/dbraw/zinc/42/27/19/1051422719.db2.gz XTJWFCJZPUMAPT-IBGZPJMESA-N 1 2 308.425 4.196 20 0 DIADLO COc1ccc2cc(NCCCCc3ccccn3)[nH+]cc2c1 ZINC001168793119 1051423343 /nfs/dbraw/zinc/42/33/43/1051423343.db2.gz IQJJYHWUCWAEPK-UHFFFAOYSA-N 1 2 307.397 4.073 20 0 DIADLO C[C@H]([NH2+][C@@H]1CC[C@@H](c2ccccc2)C1)C(=O)OCc1ccccc1 ZINC001172551195 1051434451 /nfs/dbraw/zinc/43/44/51/1051434451.db2.gz NWYKRVDGUGUHCM-PWIZWCRZSA-N 1 2 323.436 4.044 20 0 DIADLO COc1cccc2c(NCCCCc3ccccn3)cc[nH+]c12 ZINC001168798160 1051437988 /nfs/dbraw/zinc/43/79/88/1051437988.db2.gz KARSVKPSPOCVTR-UHFFFAOYSA-N 1 2 307.397 4.073 20 0 DIADLO CSc1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)c(C)n1 ZINC001215906600 1051446430 /nfs/dbraw/zinc/44/64/30/1051446430.db2.gz DGGDTVLCGWYOSX-UHFFFAOYSA-N 1 2 304.806 4.157 20 0 DIADLO CC(C)c1cc(CNc2cc[nH+]c3[nH]cc(C(F)(F)F)c32)on1 ZINC001168829604 1051448345 /nfs/dbraw/zinc/44/83/45/1051448345.db2.gz ZRSUWFWUHRXMHO-UHFFFAOYSA-N 1 2 324.306 4.305 20 0 DIADLO CC(C)c1cc(CNc2cc3c4c(c2)CCC[NH+]4CCC3)on1 ZINC001168828772 1051448661 /nfs/dbraw/zinc/44/86/61/1051448661.db2.gz FKYNDLPURAEURG-UHFFFAOYSA-N 1 2 311.429 4.109 20 0 DIADLO CSc1ncc(Cl)cc1Nc1cccc2[nH+]c(C)cn21 ZINC001215914291 1051451279 /nfs/dbraw/zinc/45/12/79/1051451279.db2.gz DXWIMZAYSOFFQY-UHFFFAOYSA-N 1 2 304.806 4.157 20 0 DIADLO C[C@H]([NH2+][C@H]1CCC[C@@H](c2ccccc2)C1)C(=O)OC(C)(C)C ZINC001172538263 1051452071 /nfs/dbraw/zinc/45/20/71/1051452071.db2.gz NXSLZTNBCDCKCN-UAGQMJEPSA-N 1 2 303.446 4.033 20 0 DIADLO CC(C)Oc1ccc2cc(N(C)c3[nH+]cccc3N)ccc2c1 ZINC001215921365 1051457879 /nfs/dbraw/zinc/45/78/79/1051457879.db2.gz DFPZVAGCRMRDMO-UHFFFAOYSA-N 1 2 307.397 4.372 20 0 DIADLO COc1c(Cl)ccc(Nc2cccc3[nH+]c(C)cn32)c1F ZINC001212582584 1051469692 /nfs/dbraw/zinc/46/96/92/1051469692.db2.gz RCUCKOFQOCUDDZ-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO FC[C@@H]1C[N@H+](Cc2cc(Cl)ccc2F)C[C@H]1C(F)(F)F ZINC001205998714 1051503267 /nfs/dbraw/zinc/50/32/67/1051503267.db2.gz GQMJILKPBLCCDM-MWLCHTKSSA-N 1 2 313.697 4.059 20 0 DIADLO FC[C@@H]1C[N@@H+](Cc2cc(Cl)ccc2F)C[C@H]1C(F)(F)F ZINC001205998714 1051503279 /nfs/dbraw/zinc/50/32/79/1051503279.db2.gz GQMJILKPBLCCDM-MWLCHTKSSA-N 1 2 313.697 4.059 20 0 DIADLO CCC[N@H+](CC(=O)OC(C)(C)C)Cc1cccc(C(F)F)c1 ZINC001169091344 1051518404 /nfs/dbraw/zinc/51/84/04/1051518404.db2.gz NQYXDPFDFDYJLZ-UHFFFAOYSA-N 1 2 313.388 4.178 20 0 DIADLO CCC[N@@H+](CC(=O)OC(C)(C)C)Cc1cccc(C(F)F)c1 ZINC001169091344 1051518419 /nfs/dbraw/zinc/51/84/19/1051518419.db2.gz NQYXDPFDFDYJLZ-UHFFFAOYSA-N 1 2 313.388 4.178 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(Cl)c2ccccc12)c1noc(C)n1 ZINC001169122834 1051522504 /nfs/dbraw/zinc/52/25/04/1051522504.db2.gz DTFIBPHRUNSWKA-MRXNPFEDSA-N 1 2 315.804 4.426 20 0 DIADLO CSc1cc(Nc2cc(OC(F)(F)F)ccc2N)cc[nH+]1 ZINC001216015511 1051524347 /nfs/dbraw/zinc/52/43/47/1051524347.db2.gz NYMXCZYKNLSRBJ-UHFFFAOYSA-N 1 2 315.320 4.028 20 0 DIADLO C[C@@H](Cc1c(F)cccc1Cl)[N@@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001172847472 1051534445 /nfs/dbraw/zinc/53/44/45/1051534445.db2.gz MRFXZBAIWFNYEN-HZMBPMFUSA-N 1 2 323.761 4.479 20 0 DIADLO C[C@@H](Cc1c(F)cccc1Cl)[N@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001172847472 1051534454 /nfs/dbraw/zinc/53/44/54/1051534454.db2.gz MRFXZBAIWFNYEN-HZMBPMFUSA-N 1 2 323.761 4.479 20 0 DIADLO CC(C)c1cccc(Nc2ccc(N)c(OC(F)(F)F)c2)[nH+]1 ZINC001216030638 1051535880 /nfs/dbraw/zinc/53/58/80/1051535880.db2.gz HMQHGESTMXJYIY-UHFFFAOYSA-N 1 2 311.307 4.429 20 0 DIADLO COc1cccnc1CNc1cc(-c2ccc(C)cc2)cc[nH+]1 ZINC001169204234 1051541885 /nfs/dbraw/zinc/54/18/85/1051541885.db2.gz ARCVRKJDVVSOSI-UHFFFAOYSA-N 1 2 305.381 4.073 20 0 DIADLO CCOc1cc(Nc2ccc(N)c(C(F)(F)F)c2)cc(C)[nH+]1 ZINC001216050409 1051549139 /nfs/dbraw/zinc/54/91/39/1051549139.db2.gz LVQYZLLHGVIAQD-UHFFFAOYSA-N 1 2 311.307 4.133 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(N(C)C)c(Cl)c2)[nH+]1 ZINC001216059131 1051554993 /nfs/dbraw/zinc/55/49/93/1051554993.db2.gz BGMKGRMQCVLNPG-UHFFFAOYSA-N 1 2 300.793 4.106 20 0 DIADLO CN(C)c1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1Cl ZINC001216060815 1051556284 /nfs/dbraw/zinc/55/62/84/1051556284.db2.gz JVYIHUWWTUFNHS-UHFFFAOYSA-N 1 2 316.836 4.145 20 0 DIADLO C[C@H](CSc1ccc(Cl)cc1)[N@@H+]1CCC(F)(F)[C@H](F)C1 ZINC001172874424 1051559017 /nfs/dbraw/zinc/55/90/17/1051559017.db2.gz AYQCYKLBMKDGFM-ZWNOBZJWSA-N 1 2 323.811 4.500 20 0 DIADLO C[C@H](CSc1ccc(Cl)cc1)[N@H+]1CCC(F)(F)[C@H](F)C1 ZINC001172874424 1051559021 /nfs/dbraw/zinc/55/90/21/1051559021.db2.gz AYQCYKLBMKDGFM-ZWNOBZJWSA-N 1 2 323.811 4.500 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cc(-c2ccccc2)cnc1F ZINC001216070021 1051559695 /nfs/dbraw/zinc/55/96/95/1051559695.db2.gz HLWJEUWSJVZVSJ-UHFFFAOYSA-N 1 2 309.344 4.425 20 0 DIADLO CC[C@]1(C)C[N@H+](CCc2c(Cl)cccc2Cl)CCO1 ZINC001169343458 1051586501 /nfs/dbraw/zinc/58/65/01/1051586501.db2.gz UPNYXNVOBGOMKE-OAHLLOKOSA-N 1 2 302.245 4.037 20 0 DIADLO CC[C@]1(C)C[N@@H+](CCc2c(Cl)cccc2Cl)CCO1 ZINC001169343458 1051586511 /nfs/dbraw/zinc/58/65/11/1051586511.db2.gz UPNYXNVOBGOMKE-OAHLLOKOSA-N 1 2 302.245 4.037 20 0 DIADLO CCn1ccc(C[N@H+](C)Cc2nc(C)c(C(C)(C)C)s2)c1 ZINC001169253706 1051563545 /nfs/dbraw/zinc/56/35/45/1051563545.db2.gz ZNCKPZAZCHFOMX-UHFFFAOYSA-N 1 2 305.491 4.202 20 0 DIADLO CCn1ccc(C[N@@H+](C)Cc2nc(C)c(C(C)(C)C)s2)c1 ZINC001169253706 1051563560 /nfs/dbraw/zinc/56/35/60/1051563560.db2.gz ZNCKPZAZCHFOMX-UHFFFAOYSA-N 1 2 305.491 4.202 20 0 DIADLO C[C@@H](CSc1ccc(Cl)cc1)[N@H+](C)Cc1cscn1 ZINC001172880244 1051564274 /nfs/dbraw/zinc/56/42/74/1051564274.db2.gz BDJPIOHSEYSBQF-NSHDSACASA-N 1 2 312.891 4.409 20 0 DIADLO C[C@@H](CSc1ccc(Cl)cc1)[N@@H+](C)Cc1cscn1 ZINC001172880244 1051564283 /nfs/dbraw/zinc/56/42/83/1051564283.db2.gz BDJPIOHSEYSBQF-NSHDSACASA-N 1 2 312.891 4.409 20 0 DIADLO C[C@H](CSc1ccc(Cl)cc1)[N@@H+]1Cc2ccncc2C1 ZINC001172883408 1051566024 /nfs/dbraw/zinc/56/60/24/1051566024.db2.gz UJFWHUCFPHNOOI-GFCCVEGCSA-N 1 2 304.846 4.231 20 0 DIADLO C[C@H](CSc1ccc(Cl)cc1)[N@H+]1Cc2ccncc2C1 ZINC001172883408 1051566036 /nfs/dbraw/zinc/56/60/36/1051566036.db2.gz UJFWHUCFPHNOOI-GFCCVEGCSA-N 1 2 304.846 4.231 20 0 DIADLO Cc1cc(Nc2ccc[nH+]c2N2CCCC2)cc(Cl)c1O ZINC001216083505 1051569125 /nfs/dbraw/zinc/56/91/25/1051569125.db2.gz JJVUPYCOLNKMSH-UHFFFAOYSA-N 1 2 303.793 4.093 20 0 DIADLO Cc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)cc(Cl)c1O ZINC001216083854 1051571156 /nfs/dbraw/zinc/57/11/56/1051571156.db2.gz MTVVTHCVKVDUJO-UHFFFAOYSA-N 1 2 317.820 4.483 20 0 DIADLO Fc1ccc(N[C@H](C2CCC2)C(F)(F)F)cc1-n1cc[nH+]c1 ZINC001169286841 1051571687 /nfs/dbraw/zinc/57/16/87/1051571687.db2.gz BPWRWKXIIXWYMC-CQSZACIVSA-N 1 2 313.298 4.154 20 0 DIADLO COc1ccc(-c2nc(C[NH2+]Cc3occc3C)cs2)cc1 ZINC000072924044 1051576671 /nfs/dbraw/zinc/57/66/71/1051576671.db2.gz QXVWRULQACCDHK-UHFFFAOYSA-N 1 2 314.410 4.010 20 0 DIADLO CC(C)(C)c1csc(Nc2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC001212692166 1051581077 /nfs/dbraw/zinc/58/10/77/1051581077.db2.gz DXPVRPGTTPBBLD-UHFFFAOYSA-N 1 2 312.442 4.429 20 0 DIADLO Clc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(Cl)cn1 ZINC001212694329 1051582360 /nfs/dbraw/zinc/58/23/60/1051582360.db2.gz VHKDZPJZAHPNJO-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO Fc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c2ccncc12 ZINC001212699107 1051584382 /nfs/dbraw/zinc/58/43/82/1051584382.db2.gz NZKBOVNWOMXTGN-UHFFFAOYSA-N 1 2 318.355 4.362 20 0 DIADLO Cc1nc2c(cccc2Nc2ccc(Cn3cc[nH+]c3)cc2)o1 ZINC001212696638 1051584433 /nfs/dbraw/zinc/58/44/33/1051584433.db2.gz BOLBEEYUQNGSFM-UHFFFAOYSA-N 1 2 304.353 4.125 20 0 DIADLO CCSCC[NH2+]c1ccc(N2CCc3sccc3C2)cc1 ZINC000761515400 1051587853 /nfs/dbraw/zinc/58/78/53/1051587853.db2.gz KHBGNRZCLGSAOO-UHFFFAOYSA-N 1 2 318.511 4.476 20 0 DIADLO CC(=O)c1cc(C)ccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212700201 1051588035 /nfs/dbraw/zinc/58/80/35/1051588035.db2.gz YTGRFZWFWYYEPF-UHFFFAOYSA-N 1 2 305.381 4.186 20 0 DIADLO COc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(Cl)c1 ZINC001212697804 1051588187 /nfs/dbraw/zinc/58/81/87/1051588187.db2.gz UOWAEAHCAFQTQP-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO CN1CCCc2ccc(Nc3ccc(Cn4cc[nH+]c4)cc3)cc21 ZINC001212697869 1051588497 /nfs/dbraw/zinc/58/84/97/1051588497.db2.gz YDRBAXZPUXKPCG-UHFFFAOYSA-N 1 2 318.424 4.057 20 0 DIADLO CCn1cc2cc(Nc3ccc(Cn4cc[nH+]c4)cc3)ccc2n1 ZINC001212697762 1051588782 /nfs/dbraw/zinc/58/87/82/1051588782.db2.gz RLIZIPOQAMRRKZ-UHFFFAOYSA-N 1 2 317.396 4.045 20 0 DIADLO Fc1cnc2cccc(Nc3ccc(Cn4cc[nH+]c4)cc3)c2c1 ZINC001212699007 1051588836 /nfs/dbraw/zinc/58/88/36/1051588836.db2.gz IROCGYNGENAWLP-UHFFFAOYSA-N 1 2 318.355 4.362 20 0 DIADLO CCOC(=O)CCc1ccc[nH+]c1N[C@H]1C[C@@H](C)c2ccccc21 ZINC001169371917 1051593333 /nfs/dbraw/zinc/59/33/33/1051593333.db2.gz DHMINFPUGJVHLJ-KDOFPFPSSA-N 1 2 324.424 4.238 20 0 DIADLO COC(=O)c1cc2[nH+]c[nH]c2c(N[C@H]2C[C@@H](C)c3ccccc32)c1 ZINC001169371131 1051593718 /nfs/dbraw/zinc/59/37/18/1051593718.db2.gz CGALCBQHNNYWRN-ABAIWWIYSA-N 1 2 321.380 4.010 20 0 DIADLO COC(=O)c1cc2[nH+]c[nH]c2c(N[C@H]2C[C@H](C)c3ccccc32)c1 ZINC001169371135 1051593812 /nfs/dbraw/zinc/59/38/12/1051593812.db2.gz CGALCBQHNNYWRN-NHYWBVRUSA-N 1 2 321.380 4.010 20 0 DIADLO C[C@H]1C[C@H](Nc2cc[nH+]c(OC3CCOCC3)c2)c2ccccc21 ZINC001169381442 1051600525 /nfs/dbraw/zinc/60/05/25/1051600525.db2.gz SIECRQGWDQLKAB-LIRRHRJNSA-N 1 2 324.424 4.300 20 0 DIADLO COc1cc[nH+]cc1NCCCc1ccc(C(F)(F)F)cc1 ZINC001169355510 1051603025 /nfs/dbraw/zinc/60/30/25/1051603025.db2.gz CJISPPUEUXEWNY-UHFFFAOYSA-N 1 2 310.319 4.154 20 0 DIADLO CN(C)c1cc(F)cc(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001216160671 1051606226 /nfs/dbraw/zinc/60/62/26/1051606226.db2.gz MDPAMOMCGJATHO-UHFFFAOYSA-N 1 2 314.408 4.021 20 0 DIADLO OCC[C@H](Nc1cc2cc[nH]c2c[nH+]1)c1cccc2ccccc21 ZINC001169416981 1051607615 /nfs/dbraw/zinc/60/76/15/1051607615.db2.gz ANNDOBCPWMVHSP-SFHVURJKSA-N 1 2 317.392 4.252 20 0 DIADLO Cc1ccsc1C[N@@H+]1Cc2cnc(-c3ccccc3)nc2C1 ZINC001204025564 1051609847 /nfs/dbraw/zinc/60/98/47/1051609847.db2.gz XCKNIMLLIXXKBH-UHFFFAOYSA-N 1 2 307.422 4.029 20 0 DIADLO Cc1ccsc1C[N@H+]1Cc2cnc(-c3ccccc3)nc2C1 ZINC001204025564 1051609850 /nfs/dbraw/zinc/60/98/50/1051609850.db2.gz XCKNIMLLIXXKBH-UHFFFAOYSA-N 1 2 307.422 4.029 20 0 DIADLO Fc1cc(Nc2cccc3[nH+]ccn32)cc(N2CCCCC2)c1 ZINC001216177942 1051613030 /nfs/dbraw/zinc/61/30/30/1051613030.db2.gz OFNPVMSQBOWSGO-UHFFFAOYSA-N 1 2 310.376 4.207 20 0 DIADLO C[C@@H]([NH2+]Cc1cn2cc(Cl)ccc2n1)c1ccccc1Cl ZINC000006996481 1051623794 /nfs/dbraw/zinc/62/37/94/1051623794.db2.gz RGXQKEKCXOHKIP-LLVKDONJSA-N 1 2 320.223 4.492 20 0 DIADLO Cc1cc(NC[C@@H](C)c2ccc(O)cc2)[nH+]cc1C(F)(F)F ZINC001169534402 1051637161 /nfs/dbraw/zinc/63/71/61/1051637161.db2.gz WHZXSUIVIVLNGR-LLVKDONJSA-N 1 2 310.319 4.330 20 0 DIADLO COc1ccc2cc(NC[C@@H](C)c3ccc(O)cc3)[nH+]cc2c1 ZINC001169537273 1051637467 /nfs/dbraw/zinc/63/74/67/1051637467.db2.gz ZZSJLAAYWDVIMR-CYBMUJFWSA-N 1 2 308.381 4.165 20 0 DIADLO COc1cc(Nc2ccc3c(c2)[nH+]cn3C)ccc1OC(C)C ZINC001216247840 1051655123 /nfs/dbraw/zinc/65/51/23/1051655123.db2.gz WVNQAZRPQLTHOL-UHFFFAOYSA-N 1 2 311.385 4.113 20 0 DIADLO Cc1ccc2cc(N[C@H]3CCc4ccccc4[C@H]3O)[nH+]cc2c1 ZINC001169623524 1051657390 /nfs/dbraw/zinc/65/73/90/1051657390.db2.gz SLMKILCKTKYRAL-AZUAARDMSA-N 1 2 304.393 4.004 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(N[C@H]2CCc3ccccc3[C@@H]2O)c1 ZINC001169629203 1051659706 /nfs/dbraw/zinc/65/97/06/1051659706.db2.gz RKAKGJODQYCLIC-FPOVZHCZSA-N 1 2 324.468 4.302 20 0 DIADLO CCCC[C@H](CC(C)C)[N@@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001173259708 1051660694 /nfs/dbraw/zinc/66/06/94/1051660694.db2.gz JSJWPMLLXPWLGS-DLBZAZTESA-N 1 2 321.509 4.401 20 0 DIADLO CCCC[C@H](CC(C)C)[N@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001173259708 1051660707 /nfs/dbraw/zinc/66/07/07/1051660707.db2.gz JSJWPMLLXPWLGS-DLBZAZTESA-N 1 2 321.509 4.401 20 0 DIADLO Cc1cc(Cl)ncc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001216277779 1051670206 /nfs/dbraw/zinc/67/02/06/1051670206.db2.gz DDQSNUPTIZUDNT-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO COc1ccc2c(c1)OCC[N@H+]([C@@H](C)c1cccc(Cl)c1)C2 ZINC001169706131 1051679505 /nfs/dbraw/zinc/67/95/05/1051679505.db2.gz YXAMYWDHZUFSCS-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc2c(c1)OCC[N@@H+]([C@@H](C)c1cccc(Cl)c1)C2 ZINC001169706131 1051679510 /nfs/dbraw/zinc/67/95/10/1051679510.db2.gz YXAMYWDHZUFSCS-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO Clc1ccnc(Cl)c1Nc1ccccc1-n1cc[nH+]c1 ZINC001216302512 1051684810 /nfs/dbraw/zinc/68/48/10/1051684810.db2.gz SSLKDNQPRPSBFD-UHFFFAOYSA-N 1 2 305.168 4.318 20 0 DIADLO Clc1ccnc(Cl)c1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001216302152 1051684904 /nfs/dbraw/zinc/68/49/04/1051684904.db2.gz ASSYXHCVQCMPQA-UHFFFAOYSA-N 1 2 305.168 4.318 20 0 DIADLO CCCc1csc(C[NH2+]C2(c3nccs3)CCCC2)n1 ZINC000494087924 1051687531 /nfs/dbraw/zinc/68/75/31/1051687531.db2.gz IKILGSZXUVDJAS-UHFFFAOYSA-N 1 2 307.488 4.111 20 0 DIADLO Cc1cc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)[nH+]c2cc[nH]c21 ZINC001169763433 1051696314 /nfs/dbraw/zinc/69/63/14/1051696314.db2.gz LPKPGXHRXHVULD-NVXWUHKLSA-N 1 2 307.397 4.204 20 0 DIADLO c1ccc(CSc2cc[nH+]c(NC[C@H]3CCCCO3)c2)cc1 ZINC001156377875 1051697240 /nfs/dbraw/zinc/69/72/40/1051697240.db2.gz RNJVUTQTFVAWCD-MRXNPFEDSA-N 1 2 314.454 4.355 20 0 DIADLO CCOc1ccccc1OCCNc1cc2ccc(C)cc2c[nH+]1 ZINC001169788153 1051702259 /nfs/dbraw/zinc/70/22/59/1051702259.db2.gz YOCLQAJYJPQIFI-UHFFFAOYSA-N 1 2 322.408 4.433 20 0 DIADLO Cc1c(Cl)c(Nc2ccccc2-n2cc[nH+]c2)ccc1CO ZINC001216329264 1051702846 /nfs/dbraw/zinc/70/28/46/1051702846.db2.gz VISYCXOYDDBRAK-UHFFFAOYSA-N 1 2 313.788 4.070 20 0 DIADLO CC(C)c1nnc2n1CC[N@H+]([C@@H]1CCCC3(CCCCC3)C1)C2 ZINC001173344332 1051703437 /nfs/dbraw/zinc/70/34/37/1051703437.db2.gz VESSATIILYZKKS-MRXNPFEDSA-N 1 2 316.493 4.110 20 0 DIADLO CC(C)c1nnc2n1CC[N@@H+]([C@@H]1CCCC3(CCCCC3)C1)C2 ZINC001173344332 1051703444 /nfs/dbraw/zinc/70/34/44/1051703444.db2.gz VESSATIILYZKKS-MRXNPFEDSA-N 1 2 316.493 4.110 20 0 DIADLO COc1cc(-c2ccccc2)ccc1C[NH2+]Cc1nc(C)cs1 ZINC000183044760 1051708522 /nfs/dbraw/zinc/70/85/22/1051708522.db2.gz NEADMZMUFDQTBD-UHFFFAOYSA-N 1 2 324.449 4.417 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nnc(-c2ccccc2)s1)c1ccccn1 ZINC000766852055 1051710342 /nfs/dbraw/zinc/71/03/42/1051710342.db2.gz JQMHDCVIOLRHLX-QGZVFWFLSA-N 1 2 324.453 4.087 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@H+](Cc2ccc(C(F)F)cc2)CCO1 ZINC000183934966 1051722763 /nfs/dbraw/zinc/72/27/63/1051722763.db2.gz VADLVRGBBOHAKJ-KRWDZBQOSA-N 1 2 321.342 4.337 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@@H+](Cc2ccc(C(F)F)cc2)CCO1 ZINC000183934966 1051722779 /nfs/dbraw/zinc/72/27/79/1051722779.db2.gz VADLVRGBBOHAKJ-KRWDZBQOSA-N 1 2 321.342 4.337 20 0 DIADLO Cn1c[nH+]c2ccc(NCc3ccc(-c4ccccn4)cc3)cc21 ZINC001169894916 1051723966 /nfs/dbraw/zinc/72/39/66/1051723966.db2.gz RPLYOVYUQAMFGZ-UHFFFAOYSA-N 1 2 314.392 4.247 20 0 DIADLO c1ccc(COc2ccc[nH+]c2NCCCc2ccncc2)cc1 ZINC001156407933 1051731927 /nfs/dbraw/zinc/73/19/27/1051731927.db2.gz AFELBGWLRXRYCG-UHFFFAOYSA-N 1 2 319.408 4.100 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1nccn1-c1ccccc1 ZINC000806175853 1051747942 /nfs/dbraw/zinc/74/79/42/1051747942.db2.gz GOPZQHJMBYVNDE-UONOGXRCSA-N 1 2 324.428 4.143 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H]1CCc2nc(Cl)ccc21 ZINC000806151561 1051756355 /nfs/dbraw/zinc/75/63/55/1051756355.db2.gz IJLGXJAIHHJEPC-OAHLLOKOSA-N 1 2 301.821 4.209 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2c(F)ccc(F)c2F)cc1 ZINC001137932448 1051770242 /nfs/dbraw/zinc/77/02/42/1051770242.db2.gz YGBAEZDURMQASH-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2c(F)ccc(F)c2F)cc1 ZINC001137932448 1051770252 /nfs/dbraw/zinc/77/02/52/1051770252.db2.gz YGBAEZDURMQASH-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO Cc1cccc(Nc2ccc(C(=O)N(C)c3ccccc3)cc2)[nH+]1 ZINC001216467068 1051779102 /nfs/dbraw/zinc/77/91/02/1051779102.db2.gz GKTXPUCWADCMMN-UHFFFAOYSA-N 1 2 317.392 4.410 20 0 DIADLO CCOC(=O)/C=C/c1ccc(Nc2cc[nH+]c(SC)c2)cc1 ZINC001216475119 1051779712 /nfs/dbraw/zinc/77/97/12/1051779712.db2.gz ABSHJJMFGYSBDK-RMKNXTFCSA-N 1 2 314.410 4.123 20 0 DIADLO Cc1cccc2c1CC(C)(C)[N@H+](Cc1c(F)cncc1F)C2 ZINC001170506621 1051790230 /nfs/dbraw/zinc/79/02/30/1051790230.db2.gz JDJDQKDJPGPTKK-UHFFFAOYSA-N 1 2 302.368 4.005 20 0 DIADLO Cc1cccc2c1CC(C)(C)[N@@H+](Cc1c(F)cncc1F)C2 ZINC001170506621 1051790239 /nfs/dbraw/zinc/79/02/39/1051790239.db2.gz JDJDQKDJPGPTKK-UHFFFAOYSA-N 1 2 302.368 4.005 20 0 DIADLO Cc1cc(CNc2cccc3c2CN(c2cccc[nH+]2)C3)c(C)o1 ZINC000767394005 1051803112 /nfs/dbraw/zinc/80/31/12/1051803112.db2.gz XELOZVYSZBJGBI-UHFFFAOYSA-N 1 2 319.408 4.424 20 0 DIADLO Cc1nc([C@H]([NH2+][C@@H](C)CCC2CC2)c2ccc(Cl)cc2)no1 ZINC000186471926 1051817893 /nfs/dbraw/zinc/81/78/93/1051817893.db2.gz LDRBPZHPBALCGY-MEDUHNTESA-N 1 2 319.836 4.289 20 0 DIADLO Cc1ccc2c(Nc3cncc(OCC4CC4)c3)cccc2[nH+]1 ZINC001216599232 1051835645 /nfs/dbraw/zinc/83/56/45/1051835645.db2.gz CJXNHGLJZMNSDU-UHFFFAOYSA-N 1 2 305.381 4.471 20 0 DIADLO Fc1ccc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)cn1 ZINC000767726994 1051841370 /nfs/dbraw/zinc/84/13/70/1051841370.db2.gz FRPZKGTWYFAVNN-UHFFFAOYSA-N 1 2 322.387 4.033 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1cccc(Cl)c1F)c1ccc(C)o1 ZINC000187487278 1051848810 /nfs/dbraw/zinc/84/88/10/1051848810.db2.gz QTHSYYWDHKFRTG-RISCZKNCSA-N 1 2 311.784 4.419 20 0 DIADLO CC(=O)Nc1cccc(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001173834021 1051851594 /nfs/dbraw/zinc/85/15/94/1051851594.db2.gz UKMWHVFSCAULJG-UHFFFAOYSA-N 1 2 309.413 4.379 20 0 DIADLO Cc1ccc(-c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)cc1C ZINC001216657478 1051854485 /nfs/dbraw/zinc/85/44/85/1051854485.db2.gz AUCABDNFLJLBHT-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO C[C@@H](SCc1cc[nH+]c(N(C)C)c1)c1cc(F)ccc1F ZINC000767872459 1051861116 /nfs/dbraw/zinc/86/11/16/1051861116.db2.gz VKFVJYZGINADBL-LLVKDONJSA-N 1 2 308.397 4.420 20 0 DIADLO CN(C)c1cc(CSCc2cccc3cccnc32)cc[nH+]1 ZINC000767873506 1051861184 /nfs/dbraw/zinc/86/11/84/1051861184.db2.gz DHYQYMMXNQCVKU-UHFFFAOYSA-N 1 2 309.438 4.129 20 0 DIADLO CC(C)c1nc(C[N@H+](C)CCOc2ccc(Cl)cc2)cs1 ZINC000613392233 1051866745 /nfs/dbraw/zinc/86/67/45/1051866745.db2.gz LIIJSYDTDCVFKR-UHFFFAOYSA-N 1 2 324.877 4.431 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)CCOc2ccc(Cl)cc2)cs1 ZINC000613392233 1051866754 /nfs/dbraw/zinc/86/67/54/1051866754.db2.gz LIIJSYDTDCVFKR-UHFFFAOYSA-N 1 2 324.877 4.431 20 0 DIADLO COc1cc(Nc2ccc3c(C)cc[nH+]c3c2)cc(OC)c1OC ZINC001173905548 1051868827 /nfs/dbraw/zinc/86/88/27/1051868827.db2.gz KNMARKPMPOIZPA-UHFFFAOYSA-N 1 2 324.380 4.313 20 0 DIADLO Fc1cc(F)cc(Nc2cc(Br)cn3cc[nH+]c23)c1 ZINC001173913146 1051872013 /nfs/dbraw/zinc/87/20/13/1051872013.db2.gz ZKXSODRBRAQIQZ-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Clc1ccc(-c2noc(-c3ccccc3-n3cc[nH+]c3)n2)cc1 ZINC001216755656 1051873705 /nfs/dbraw/zinc/87/37/05/1051873705.db2.gz XHSYPGWDZQNIFZ-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO Cc1cccc(-c2noc(-c3ccccc3-n3cc[nH+]c3)n2)c1F ZINC001216755228 1051874124 /nfs/dbraw/zinc/87/41/24/1051874124.db2.gz HITMRGVBEZDSTP-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ncc(Br)cc2Cl)c1 ZINC000404497022 1051874403 /nfs/dbraw/zinc/87/44/03/1051874403.db2.gz ACSMVFGUZNWOGI-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1c([C@@H](C)[NH2+][C@@H](C)c2cscn2)cnn1-c1ccccc1 ZINC000768099453 1051876192 /nfs/dbraw/zinc/87/61/92/1051876192.db2.gz NGZLBRLPPYITKJ-OLZOCXBDSA-N 1 2 312.442 4.049 20 0 DIADLO Cc1c([C@H](C)[NH2+][C@H](C)c2cscn2)cnn1-c1ccccc1 ZINC000768099458 1051876942 /nfs/dbraw/zinc/87/69/42/1051876942.db2.gz NGZLBRLPPYITKJ-QWHCGFSZSA-N 1 2 312.442 4.049 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@@H](C)c1ccccc1F)c1ccco1 ZINC000152562435 1051881645 /nfs/dbraw/zinc/88/16/45/1051881645.db2.gz YYXIQDCFHMEWCE-YOEHRIQHSA-N 1 2 305.393 4.483 20 0 DIADLO C[N@H+](Cc1c(Cl)nc2ccccn21)Cc1ccc(Cl)cc1 ZINC000768170335 1051892756 /nfs/dbraw/zinc/89/27/56/1051892756.db2.gz ORNAKFYOSMDIDC-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1c(Cl)nc2ccccn21)Cc1ccc(Cl)cc1 ZINC000768170335 1051892763 /nfs/dbraw/zinc/89/27/63/1051892763.db2.gz ORNAKFYOSMDIDC-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[C@H]1C[N@H+](Cc2ncccc2C(F)(F)F)Cc2ccccc21 ZINC000768194848 1051900121 /nfs/dbraw/zinc/90/01/21/1051900121.db2.gz GPSOXURPGHEVPW-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ncccc2C(F)(F)F)Cc2ccccc21 ZINC000768194848 1051900131 /nfs/dbraw/zinc/90/01/31/1051900131.db2.gz GPSOXURPGHEVPW-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO c1coc(C[NH+](Cc2ccco2)Cc2ccc3c(c2)COC3)c1 ZINC000768192049 1051900522 /nfs/dbraw/zinc/90/05/22/1051900522.db2.gz NHUOHQKICVARJF-UHFFFAOYSA-N 1 2 309.365 4.105 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1occc1Br ZINC000768215478 1051904373 /nfs/dbraw/zinc/90/43/73/1051904373.db2.gz IFQQYAWHSPITSL-JTQLQIEISA-N 1 2 312.182 4.374 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1occc1Br ZINC000768215478 1051904381 /nfs/dbraw/zinc/90/43/81/1051904381.db2.gz IFQQYAWHSPITSL-JTQLQIEISA-N 1 2 312.182 4.374 20 0 DIADLO C[N@H+](Cc1occc1Br)[C@@H]1CCc2ccccc21 ZINC000768233673 1051906162 /nfs/dbraw/zinc/90/61/62/1051906162.db2.gz NOBVJSLZQRQBFW-CQSZACIVSA-N 1 2 306.203 4.161 20 0 DIADLO C[N@@H+](Cc1occc1Br)[C@@H]1CCc2ccccc21 ZINC000768233673 1051906171 /nfs/dbraw/zinc/90/61/71/1051906171.db2.gz NOBVJSLZQRQBFW-CQSZACIVSA-N 1 2 306.203 4.161 20 0 DIADLO Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C[N@@H+](C)C1CC1 ZINC000768334374 1051919599 /nfs/dbraw/zinc/91/95/99/1051919599.db2.gz GHLMZDSPKHVOSR-UHFFFAOYSA-N 1 2 324.255 4.141 20 0 DIADLO Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C[N@H+](C)C1CC1 ZINC000768334374 1051919611 /nfs/dbraw/zinc/91/96/11/1051919611.db2.gz GHLMZDSPKHVOSR-UHFFFAOYSA-N 1 2 324.255 4.141 20 0 DIADLO CC[N@H+](Cc1c(Cl)nc(Cl)n1C)Cc1ccccc1C ZINC000768336808 1051920127 /nfs/dbraw/zinc/92/01/27/1051920127.db2.gz YBBCKKSONJNUTI-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO CC[N@@H+](Cc1c(Cl)nc(Cl)n1C)Cc1ccccc1C ZINC000768336808 1051920129 /nfs/dbraw/zinc/92/01/29/1051920129.db2.gz YBBCKKSONJNUTI-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO C=Cc1cccc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)c1 ZINC001216973483 1051922771 /nfs/dbraw/zinc/92/27/71/1051922771.db2.gz XXFUNMOFQBFNQO-UHFFFAOYSA-N 1 2 314.348 4.232 20 0 DIADLO CC(=O)Nc1ccccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001173994391 1051923333 /nfs/dbraw/zinc/92/33/33/1051923333.db2.gz OVBHUBXZZFQPQR-UHFFFAOYSA-N 1 2 309.413 4.379 20 0 DIADLO Cc1cnc(C[NH2+][C@H](CC(F)(F)F)c2ccccc2)s1 ZINC000223669704 1051951122 /nfs/dbraw/zinc/95/11/22/1051951122.db2.gz OKFKRSQIRXYDCO-GFCCVEGCSA-N 1 2 300.349 4.235 20 0 DIADLO CC(C)C[N@H+](Cc1coc(C2CC2)n1)Cc1ccccc1F ZINC000768670873 1051952243 /nfs/dbraw/zinc/95/22/43/1051952243.db2.gz RARPTTSPSRUHCV-UHFFFAOYSA-N 1 2 302.393 4.349 20 0 DIADLO CC(C)C[N@@H+](Cc1coc(C2CC2)n1)Cc1ccccc1F ZINC000768670873 1051952250 /nfs/dbraw/zinc/95/22/50/1051952250.db2.gz RARPTTSPSRUHCV-UHFFFAOYSA-N 1 2 302.393 4.349 20 0 DIADLO C[N@H+](CCCOc1cccc(Cl)c1)Cc1coc(C2CC2)n1 ZINC000768919743 1051980382 /nfs/dbraw/zinc/98/03/82/1051980382.db2.gz BYBCJWTUUJULSC-UHFFFAOYSA-N 1 2 320.820 4.106 20 0 DIADLO C[N@@H+](CCCOc1cccc(Cl)c1)Cc1coc(C2CC2)n1 ZINC000768919743 1051980390 /nfs/dbraw/zinc/98/03/90/1051980390.db2.gz BYBCJWTUUJULSC-UHFFFAOYSA-N 1 2 320.820 4.106 20 0 DIADLO C[N@H+](CCCOc1ccc(Cl)cc1)Cc1coc(C2CC2)n1 ZINC000768922600 1051980954 /nfs/dbraw/zinc/98/09/54/1051980954.db2.gz SKQRMRWCLBCJMA-UHFFFAOYSA-N 1 2 320.820 4.106 20 0 DIADLO C[N@@H+](CCCOc1ccc(Cl)cc1)Cc1coc(C2CC2)n1 ZINC000768922600 1051980969 /nfs/dbraw/zinc/98/09/69/1051980969.db2.gz SKQRMRWCLBCJMA-UHFFFAOYSA-N 1 2 320.820 4.106 20 0 DIADLO CC(C)n1ccn(C[N@H+](C)Cc2cc3ccccc3o2)c1=S ZINC000747469375 1051990083 /nfs/dbraw/zinc/99/00/83/1051990083.db2.gz FLSNSYFWLSARAQ-UHFFFAOYSA-N 1 2 315.442 4.436 20 0 DIADLO CC(C)n1ccn(C[N@@H+](C)Cc2cc3ccccc3o2)c1=S ZINC000747469375 1051990095 /nfs/dbraw/zinc/99/00/95/1051990095.db2.gz FLSNSYFWLSARAQ-UHFFFAOYSA-N 1 2 315.442 4.436 20 0 DIADLO c1oc(C2CC2)nc1C[NH+]1CCC(OCC2CCCCC2)CC1 ZINC000769192382 1052002180 /nfs/dbraw/zinc/00/21/80/1052002180.db2.gz PYYBPJYJJNQLBY-UHFFFAOYSA-N 1 2 318.461 4.113 20 0 DIADLO c1c[nH]c([C@H]2CCCC[N@H+]2Cc2ccccc2N2CCCCC2)n1 ZINC000769211355 1052009588 /nfs/dbraw/zinc/00/95/88/1052009588.db2.gz UTGVOMVYKANBTB-LJQANCHMSA-N 1 2 324.472 4.127 20 0 DIADLO c1c[nH]c([C@H]2CCCC[N@@H+]2Cc2ccccc2N2CCCCC2)n1 ZINC000769211355 1052009597 /nfs/dbraw/zinc/00/95/97/1052009597.db2.gz UTGVOMVYKANBTB-LJQANCHMSA-N 1 2 324.472 4.127 20 0 DIADLO c1nn(Cc2ccccc2)cc1Nc1cccc2cc[nH+]cc21 ZINC001174133417 1052010529 /nfs/dbraw/zinc/01/05/29/1052010529.db2.gz NTTHZXLIVVLWKE-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO CCCCCCc1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000761653755 1052013546 /nfs/dbraw/zinc/01/35/46/1052013546.db2.gz RFPMMBRHLWVHAC-UHFFFAOYSA-N 1 2 310.401 4.104 20 0 DIADLO Cc1ccc(Nc2ccc(C(=O)N3CCC(C)CC3)cc2)c(C)[nH+]1 ZINC001174158237 1052024534 /nfs/dbraw/zinc/02/45/34/1052024534.db2.gz CPCLKXGGFAIXEU-UHFFFAOYSA-N 1 2 323.440 4.314 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccccc2)[C@H](O)c2ccccc2)cs1 ZINC000808450768 1052025753 /nfs/dbraw/zinc/02/57/53/1052025753.db2.gz VLPIUMDWNNCJFB-RBUKOAKNSA-N 1 2 324.449 4.016 20 0 DIADLO C[C@@H]1CC[C@](C)(/C=C/C(=O)Nc2ccc3[nH+]ccn3c2)C1(C)C ZINC001131309662 1052027799 /nfs/dbraw/zinc/02/77/99/1052027799.db2.gz UFCPPEATNKTKIB-YFZXRXBPSA-N 1 2 311.429 4.291 20 0 DIADLO CCCCCCOc1ccc(C[N@H+](C)Cc2cc[nH]n2)cc1 ZINC000769384376 1052037380 /nfs/dbraw/zinc/03/73/80/1052037380.db2.gz OAVYWUUPMVBMSH-UHFFFAOYSA-N 1 2 301.434 4.001 20 0 DIADLO CCCCCCOc1ccc(C[N@@H+](C)Cc2cc[nH]n2)cc1 ZINC000769384376 1052037393 /nfs/dbraw/zinc/03/73/93/1052037393.db2.gz OAVYWUUPMVBMSH-UHFFFAOYSA-N 1 2 301.434 4.001 20 0 DIADLO C[C@H](CCC1CC1)[NH2+]c1ccc(N2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000769417080 1052043802 /nfs/dbraw/zinc/04/38/02/1052043802.db2.gz PKGOEUHMVWDELM-PMPSAXMXSA-N 1 2 302.462 4.291 20 0 DIADLO CCc1cccc(Nc2cccc(C(=O)NC3CCCC3)c2)[nH+]1 ZINC001174196340 1052045678 /nfs/dbraw/zinc/04/56/78/1052045678.db2.gz IHIULVMZWJVUTA-UHFFFAOYSA-N 1 2 309.413 4.060 20 0 DIADLO Cc1ccc(Nc2cccc(C(=O)N3CCC(C)CC3)c2)[nH+]c1 ZINC001174202883 1052046696 /nfs/dbraw/zinc/04/66/96/1052046696.db2.gz SZXUXTKTTZSSBH-UHFFFAOYSA-N 1 2 309.413 4.006 20 0 DIADLO Cc1c(Cl)cccc1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000195359275 1052046985 /nfs/dbraw/zinc/04/69/85/1052046985.db2.gz TZZHMZIIDFZTQC-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1cccc(Nc2cccc(C(=O)Nc3ccccc3)c2)[nH+]1 ZINC001174204582 1052047930 /nfs/dbraw/zinc/04/79/30/1052047930.db2.gz IYTJMRFYUNTDKR-UHFFFAOYSA-N 1 2 303.365 4.386 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2coc(C3CC3)n2)[C@H]1c1ccccc1 ZINC000769463520 1052060622 /nfs/dbraw/zinc/06/06/22/1052060622.db2.gz PPNFLSWFRXIJLP-CXAGYDPISA-N 1 2 314.454 4.231 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2coc(C3CC3)n2)[C@H]1c1ccccc1 ZINC000769463520 1052060627 /nfs/dbraw/zinc/06/06/27/1052060627.db2.gz PPNFLSWFRXIJLP-CXAGYDPISA-N 1 2 314.454 4.231 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458697 1052061596 /nfs/dbraw/zinc/06/15/96/1052061596.db2.gz YNHISGJGRKFUPH-SJKOYZFVSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458697 1052061607 /nfs/dbraw/zinc/06/16/07/1052061607.db2.gz YNHISGJGRKFUPH-SJKOYZFVSA-N 1 2 300.377 4.274 20 0 DIADLO CCCCCC(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000195623356 1052068031 /nfs/dbraw/zinc/06/80/31/1052068031.db2.gz JAOIRFSDJJWWDW-UHFFFAOYSA-N 1 2 311.429 4.405 20 0 DIADLO CCCC[C@@H](C)[C@@H](C)[NH2+]c1ccc(N2CCC(O)CC2)cc1 ZINC000808710018 1052071989 /nfs/dbraw/zinc/07/19/89/1052071989.db2.gz WQABUKCPNWHKMC-HZPDHXFCSA-N 1 2 304.478 4.274 20 0 DIADLO COc1ccc2c(c1F)CC[C@H]2Nc1ccc([NH+](C)C)c(C)c1 ZINC000808712335 1052073664 /nfs/dbraw/zinc/07/36/64/1052073664.db2.gz CUKIXYDTVCJZRN-MRXNPFEDSA-N 1 2 314.404 4.308 20 0 DIADLO Cc1cc(Cl)ccc1-c1noc(-c2cccc3[nH+]ccn32)n1 ZINC001217499503 1052074028 /nfs/dbraw/zinc/07/40/28/1052074028.db2.gz JARIMEWARXPJFO-UHFFFAOYSA-N 1 2 310.744 4.013 20 0 DIADLO c1cnn(-c2cccc(Nc3ccc(N4CCCCC4)[nH+]c3)c2)c1 ZINC001174298539 1052074606 /nfs/dbraw/zinc/07/46/06/1052074606.db2.gz DLKKONHOQNXMCF-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1occc1Br ZINC000769536532 1052078401 /nfs/dbraw/zinc/07/84/01/1052078401.db2.gz ATFDFMXELLQRKY-AWEZNQCLSA-N 1 2 323.234 4.108 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1occc1Br ZINC000769536532 1052078420 /nfs/dbraw/zinc/07/84/20/1052078420.db2.gz ATFDFMXELLQRKY-AWEZNQCLSA-N 1 2 323.234 4.108 20 0 DIADLO C[C@@H]1C[N@H+](Cc2occc2Br)[C@H]1c1ccccc1 ZINC000769541954 1052078937 /nfs/dbraw/zinc/07/89/37/1052078937.db2.gz XIODTTMOZXBDLI-IAQYHMDHSA-N 1 2 306.203 4.235 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2occc2Br)[C@H]1c1ccccc1 ZINC000769541954 1052078945 /nfs/dbraw/zinc/07/89/45/1052078945.db2.gz XIODTTMOZXBDLI-IAQYHMDHSA-N 1 2 306.203 4.235 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2coc(C3CC3)n2)o1 ZINC000769549526 1052080590 /nfs/dbraw/zinc/08/05/90/1052080590.db2.gz NLMFOZFWKUVRGS-MLGOLLRUSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2coc(C3CC3)n2)o1 ZINC000769549526 1052080601 /nfs/dbraw/zinc/08/06/01/1052080601.db2.gz NLMFOZFWKUVRGS-MLGOLLRUSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@H]3CCC[C@H]3C)c2)[nH+]c1C ZINC000769560355 1052082676 /nfs/dbraw/zinc/08/26/76/1052082676.db2.gz PNAVBAPCUGCIRU-IUODEOHRSA-N 1 2 311.429 4.458 20 0 DIADLO c1cc(C[NH2+]Cc2nc3c(s2)C[C@@H](c2ccccc2)CC3)co1 ZINC000769689987 1052093651 /nfs/dbraw/zinc/09/36/51/1052093651.db2.gz RKBFRRHFTIJBGS-INIZCTEOSA-N 1 2 324.449 4.298 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1C[C@H](C)OC2(CCCCC2)C1 ZINC000653905836 1052119500 /nfs/dbraw/zinc/11/95/00/1052119500.db2.gz JIHZYZCDFPAGEO-LSDHHAIUSA-N 1 2 320.477 4.457 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1C[C@H](C)OC2(CCCCC2)C1 ZINC000653905836 1052119506 /nfs/dbraw/zinc/11/95/06/1052119506.db2.gz JIHZYZCDFPAGEO-LSDHHAIUSA-N 1 2 320.477 4.457 20 0 DIADLO FC(F)(F)c1cc(Nc2ccc[nH+]c2N2CCCCC2)ccn1 ZINC001174359976 1052126576 /nfs/dbraw/zinc/12/65/76/1052126576.db2.gz OUQMYXYGCYXDCO-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO CCC[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(Cl)cc1 ZINC000393355974 1052127222 /nfs/dbraw/zinc/12/72/22/1052127222.db2.gz SNKAKJHVKIQOPP-AWEZNQCLSA-N 1 2 312.244 4.358 20 0 DIADLO Cn1cc(-c2ccc(Nc3ccccc3-n3cc[nH+]c3)cc2)cn1 ZINC001174377982 1052135313 /nfs/dbraw/zinc/13/53/13/1052135313.db2.gz NDRIETOXVSOSJT-UHFFFAOYSA-N 1 2 315.380 4.016 20 0 DIADLO Cn1cc(-c2ccc(Nc3ccc(-n4cc[nH+]c4)cc3)cc2)cn1 ZINC001174377961 1052135380 /nfs/dbraw/zinc/13/53/80/1052135380.db2.gz MKPLZAMYPMFQHC-UHFFFAOYSA-N 1 2 315.380 4.016 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4nn(C)cc4c3)ccc21 ZINC001174381167 1052138876 /nfs/dbraw/zinc/13/88/76/1052138876.db2.gz ITDMFDVSNMLHQU-UHFFFAOYSA-N 1 2 305.385 4.248 20 0 DIADLO Cc1nc(Cl)c(Nc2ccc3c(c2)[nH+]cn3C(C)C)nc1C ZINC001174381232 1052138916 /nfs/dbraw/zinc/13/89/16/1052138916.db2.gz BSBXZDSYMYPTSO-UHFFFAOYSA-N 1 2 315.808 4.421 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3c(Cl)cnnc3Cl)ccc21 ZINC001174381224 1052139106 /nfs/dbraw/zinc/13/91/06/1052139106.db2.gz BOGBCVNNHQLVGY-UHFFFAOYSA-N 1 2 322.199 4.458 20 0 DIADLO Cc1cnc(Nc2ccc3c(c2)[nH+]cn3C(C)C)c(Cl)n1 ZINC001174381745 1052140153 /nfs/dbraw/zinc/14/01/53/1052140153.db2.gz PLDDMJHKYOBEEK-UHFFFAOYSA-N 1 2 301.781 4.113 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3c[nH]c(Cl)cc3=O)ccc21 ZINC001174382116 1052140614 /nfs/dbraw/zinc/14/06/14/1052140614.db2.gz YXYPZMNLDXSKSP-UHFFFAOYSA-N 1 2 302.765 4.115 20 0 DIADLO CC(=O)c1cc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cnc1C ZINC001174382204 1052140734 /nfs/dbraw/zinc/14/07/34/1052140734.db2.gz DSSNKTAMHARMLL-UHFFFAOYSA-N 1 2 308.385 4.267 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc(-c4nnco4)c3)ccc21 ZINC001174382009 1052141023 /nfs/dbraw/zinc/14/10/23/1052141023.db2.gz ZJWSBDHYWHSRDC-UHFFFAOYSA-N 1 2 319.368 4.411 20 0 DIADLO Cc1cnn(CC2CC2)c1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174382173 1052141276 /nfs/dbraw/zinc/14/12/76/1052141276.db2.gz CCTXODLYJLLDGY-UHFFFAOYSA-N 1 2 309.417 4.276 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(c3)C(=O)CC4)ccc21 ZINC001174381820 1052141563 /nfs/dbraw/zinc/14/15/63/1052141563.db2.gz UXIXAHFDPXJJIQ-UHFFFAOYSA-N 1 2 305.381 4.490 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc[nH]c(=O)c3Cl)ccc21 ZINC001174382217 1052141608 /nfs/dbraw/zinc/14/16/08/1052141608.db2.gz FCHGNFDGIQUJST-UHFFFAOYSA-N 1 2 302.765 4.115 20 0 DIADLO CCOc1ccc(N)cc1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174383814 1052142277 /nfs/dbraw/zinc/14/22/77/1052142277.db2.gz VKRVWWLVWPKCLE-UHFFFAOYSA-N 1 2 310.401 4.342 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ncccc3N3CCCC3)ccc21 ZINC001174382368 1052142583 /nfs/dbraw/zinc/14/25/83/1052142583.db2.gz MSFJPELVTYZALB-UHFFFAOYSA-N 1 2 321.428 4.356 20 0 DIADLO Cc1cnc(Cl)c(Nc2ccc3c(c2)[nH+]cn3C(C)C)c1N ZINC001174382618 1052142776 /nfs/dbraw/zinc/14/27/76/1052142776.db2.gz YZKQNIFWTAGVNJ-UHFFFAOYSA-N 1 2 315.808 4.300 20 0 DIADLO CC(C)n1c[nH+]c2cc(N3CCCc4ccc(N)cc43)ccc21 ZINC001174383264 1052143636 /nfs/dbraw/zinc/14/36/36/1052143636.db2.gz LOHAMLDCQWOOEM-UHFFFAOYSA-N 1 2 306.413 4.284 20 0 DIADLO CC(=O)c1ccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cc1O ZINC001174382714 1052143844 /nfs/dbraw/zinc/14/38/44/1052143844.db2.gz CMWUHRAGFFETGF-UHFFFAOYSA-N 1 2 309.369 4.269 20 0 DIADLO CCOC(=O)c1ccc(Nc2cc[nH+]c3[nH]ccc32)cc1Cl ZINC001174411611 1052165426 /nfs/dbraw/zinc/16/54/26/1052165426.db2.gz FXHHEQINMKUVKI-UHFFFAOYSA-N 1 2 315.760 4.088 20 0 DIADLO Clc1cc(Nc2cccc(N3CCCC3)c2)cn2cc[nH+]c12 ZINC001174487134 1052172897 /nfs/dbraw/zinc/17/28/97/1052172897.db2.gz JOOZXNCLTIJQBK-UHFFFAOYSA-N 1 2 312.804 4.332 20 0 DIADLO c1c[nH+]c(Nc2cccc(N3CCCC3)c2)c(N2CCCC2)c1 ZINC001174488735 1052173690 /nfs/dbraw/zinc/17/36/90/1052173690.db2.gz UJJSWXSZSYBDNT-UHFFFAOYSA-N 1 2 308.429 4.026 20 0 DIADLO C[C@H](Oc1cc(N)cc[nH+]1)c1c(Cl)ccc(F)c1Cl ZINC001217967827 1052178610 /nfs/dbraw/zinc/17/86/10/1052178610.db2.gz FLKMGHMCAXWEKU-ZETCQYMHSA-N 1 2 301.148 4.250 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1cc(Cl)cs1 ZINC000494941857 1052181135 /nfs/dbraw/zinc/18/11/35/1052181135.db2.gz YQNFPODYXMGZEZ-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1cc(Cl)cs1 ZINC000494941857 1052181138 /nfs/dbraw/zinc/18/11/38/1052181138.db2.gz YQNFPODYXMGZEZ-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H](c1ccccc1)c1ccccc1O[C@@H]1CC[NH2+]CC1(F)F ZINC001218011432 1052184964 /nfs/dbraw/zinc/18/49/64/1052184964.db2.gz HOQUCNFZEFPTAO-KBXCAEBGSA-N 1 2 317.379 4.214 20 0 DIADLO Clc1csc(C[N@@H+]2CCO[C@@]3(CCc4ccccc43)C2)c1 ZINC000494987204 1052190287 /nfs/dbraw/zinc/19/02/87/1052190287.db2.gz SRMPNGGVLCGJSO-KRWDZBQOSA-N 1 2 319.857 4.075 20 0 DIADLO Clc1csc(C[N@H+]2CCO[C@@]3(CCc4ccccc43)C2)c1 ZINC000494987204 1052190290 /nfs/dbraw/zinc/19/02/90/1052190290.db2.gz SRMPNGGVLCGJSO-KRWDZBQOSA-N 1 2 319.857 4.075 20 0 DIADLO C[C@H]1CCC[C@@H](c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)C1 ZINC000761797957 1052201838 /nfs/dbraw/zinc/20/18/38/1052201838.db2.gz XQQQISZLDPMAFD-DZGCQCFKSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@@H]1CCC[C@@H](c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)C1 ZINC000761797961 1052202302 /nfs/dbraw/zinc/20/23/02/1052202302.db2.gz XQQQISZLDPMAFD-UKRRQHHQSA-N 1 2 308.385 4.216 20 0 DIADLO Nc1cc[nH+]c(OC(c2ccc(F)cc2)c2ccc(F)cc2)c1 ZINC001218197822 1052206758 /nfs/dbraw/zinc/20/67/58/1052206758.db2.gz VZSBUXXUSIVPMS-UHFFFAOYSA-N 1 2 312.319 4.110 20 0 DIADLO Oc1cccc(C[NH2+][C@H](c2cccc(Cl)c2)c2ccccn2)c1 ZINC000153306643 1052213658 /nfs/dbraw/zinc/21/36/58/1052213658.db2.gz BDRSLPMVJMMXOY-LJQANCHMSA-N 1 2 324.811 4.320 20 0 DIADLO Cc1cc(O[C@@H]2C[NH2+]CC(F)(F)C2)c(C(C)C)cc1Cl ZINC001218273252 1052216291 /nfs/dbraw/zinc/21/62/91/1052216291.db2.gz JGBSMFWQUARFSO-NSHDSACASA-N 1 2 303.780 4.148 20 0 DIADLO O=C(C/C=C/c1ccccc1F)Nc1ccccc1-n1cc[nH+]c1 ZINC000495170471 1052245831 /nfs/dbraw/zinc/24/58/31/1052245831.db2.gz VYVPLIXLQFOMAJ-FNORWQNLSA-N 1 2 321.355 4.053 20 0 DIADLO O=C(C/C=C\c1ccccc1F)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000495184564 1052249597 /nfs/dbraw/zinc/24/95/97/1052249597.db2.gz PDMBBZIEFXQLQF-HYXAFXHYSA-N 1 2 321.355 4.053 20 0 DIADLO CCCC[N@H+](Cn1nc(-c2ccc(F)cc2)oc1=S)C1CC1 ZINC000914784000 1052251303 /nfs/dbraw/zinc/25/13/03/1052251303.db2.gz PPLVBHMMUKGXPS-UHFFFAOYSA-N 1 2 321.421 4.234 20 0 DIADLO CCCC[N@@H+](Cn1nc(-c2ccc(F)cc2)oc1=S)C1CC1 ZINC000914784000 1052251311 /nfs/dbraw/zinc/25/13/11/1052251311.db2.gz PPLVBHMMUKGXPS-UHFFFAOYSA-N 1 2 321.421 4.234 20 0 DIADLO CCSc1nn(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)c(=S)s1 ZINC000914785166 1052251711 /nfs/dbraw/zinc/25/17/11/1052251711.db2.gz RBZBMMNUHZERJG-GHMZBOCLSA-N 1 2 317.549 4.254 20 0 DIADLO CCSc1nn(C[N@@H+](C)[C@@H]2CCC[C@@H](C)C2)c(=S)s1 ZINC000914785166 1052251722 /nfs/dbraw/zinc/25/17/22/1052251722.db2.gz RBZBMMNUHZERJG-GHMZBOCLSA-N 1 2 317.549 4.254 20 0 DIADLO Cc1cc(C)c(NC(=O)NC[C@@H]2CCC[C@@H](C)[C@@H]2C)c(C)[nH+]1 ZINC001219009524 1052267504 /nfs/dbraw/zinc/26/75/04/1052267504.db2.gz CZFDPNGWMDLQTL-WPGHFRTFSA-N 1 2 303.450 4.201 20 0 DIADLO COc1ccc[nH+]c1NCc1ccccc1OCc1ccccc1 ZINC000310450781 1052267990 /nfs/dbraw/zinc/26/79/90/1052267990.db2.gz SFWXSVBTRLIHDA-UHFFFAOYSA-N 1 2 320.392 4.281 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nnc2n1CCCCC2)c1csc(Cl)c1 ZINC000230407777 1052267982 /nfs/dbraw/zinc/26/79/82/1052267982.db2.gz IEWAQKRLQKQDEU-MNOVXSKESA-N 1 2 324.881 4.131 20 0 DIADLO CN(C(=O)Nc1ccc2[nH+]ccn2c1)[C@H]1CCC[C@H]1C(C)(C)C ZINC001219557062 1052293793 /nfs/dbraw/zinc/29/37/93/1052293793.db2.gz PDVHUIFOKQLNBA-CABCVRRESA-N 1 2 314.433 4.013 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2nc(CC(C)C)no2)o1 ZINC000303746253 1052341200 /nfs/dbraw/zinc/34/12/00/1052341200.db2.gz KBSAOHRWJSWWDZ-HNNXBMFYSA-N 1 2 317.433 4.287 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nc(CC(C)C)no2)o1 ZINC000303746253 1052341206 /nfs/dbraw/zinc/34/12/06/1052341206.db2.gz KBSAOHRWJSWWDZ-HNNXBMFYSA-N 1 2 317.433 4.287 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@H](C)c2ccc(C)s2)n1 ZINC000754672075 1052369127 /nfs/dbraw/zinc/36/91/27/1052369127.db2.gz HICXKQRMQLXVOT-MNOVXSKESA-N 1 2 311.476 4.104 20 0 DIADLO CCCCCC[C@](C)(CC)c1nc(Cc2c[nH+]cn2C)no1 ZINC000762412321 1052378866 /nfs/dbraw/zinc/37/88/66/1052378866.db2.gz VSQSFPYXAGNPOP-KRWDZBQOSA-N 1 2 304.438 4.032 20 0 DIADLO O=c1c2ccccc2sn1C[N@@H+]1CCCC[C@@H]1c1ccccc1 ZINC000762469597 1052387640 /nfs/dbraw/zinc/38/76/40/1052387640.db2.gz YMNMOMJSZMOVLO-QGZVFWFLSA-N 1 2 324.449 4.248 20 0 DIADLO O=c1c2ccccc2sn1C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000762469597 1052387649 /nfs/dbraw/zinc/38/76/49/1052387649.db2.gz YMNMOMJSZMOVLO-QGZVFWFLSA-N 1 2 324.449 4.248 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cc(OC(C)C)ccc3C)nn2)c1C ZINC001222137515 1052448432 /nfs/dbraw/zinc/44/84/32/1052448432.db2.gz GSMILTHUWUAVJJ-UHFFFAOYSA-N 1 2 322.412 4.042 20 0 DIADLO Clc1cccc([C@@H](OCCn2cc[nH+]c2)c2ccccc2)c1 ZINC001222134841 1052448546 /nfs/dbraw/zinc/44/85/46/1052448546.db2.gz PVNUBAVPRNPJIY-SFHVURJKSA-N 1 2 312.800 4.343 20 0 DIADLO COc1ccc2cc(CC[C@@H](C)OCCn3cc[nH+]c3)ccc2c1 ZINC001222138873 1052449495 /nfs/dbraw/zinc/44/94/95/1052449495.db2.gz LCMVAWFRFJYGLO-MRXNPFEDSA-N 1 2 324.424 4.083 20 0 DIADLO Cc1ccc(C(OCc2c[nH+]cn2C)c2ccc(C)cc2)cc1 ZINC001222594695 1052514738 /nfs/dbraw/zinc/51/47/38/1052514738.db2.gz IVDREGYQGXYEEG-UHFFFAOYSA-N 1 2 306.409 4.343 20 0 DIADLO Cn1c[nH+]cc1CO[C@@H](c1ccccc1)C(Cl)(Cl)Cl ZINC001222595239 1052514879 /nfs/dbraw/zinc/51/48/79/1052514879.db2.gz UUGUUHCTHZREMG-LBPRGKRZSA-N 1 2 319.619 4.048 20 0 DIADLO S=c1sc(-c2ccccc2)nn1C[N@@H+]1CC[C@H](C2CC2)C1 ZINC000763334740 1052564737 /nfs/dbraw/zinc/56/47/37/1052564737.db2.gz UYXOQOILZWWSSJ-AWEZNQCLSA-N 1 2 317.483 4.030 20 0 DIADLO S=c1sc(-c2ccccc2)nn1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000763334740 1052564741 /nfs/dbraw/zinc/56/47/41/1052564741.db2.gz UYXOQOILZWWSSJ-AWEZNQCLSA-N 1 2 317.483 4.030 20 0 DIADLO Cc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1noc(-c2ccccc2)n1 ZINC000124281977 1052639008 /nfs/dbraw/zinc/63/90/08/1052639008.db2.gz YVSXEBXOXTTXCU-KDOFPFPSSA-N 1 2 319.408 4.383 20 0 DIADLO CC(C)c1csc(C[NH2+]Cc2cccc3c2OC(C)(C)C3)n1 ZINC000125626338 1052650385 /nfs/dbraw/zinc/65/03/85/1052650385.db2.gz WKOVWAMBVXCHQS-UHFFFAOYSA-N 1 2 316.470 4.270 20 0 DIADLO FC(F)(F)[C@@H]1CCC[C@@H](Nc2ccc(N3CCCC3)[nH+]c2)C1 ZINC000125977855 1052661795 /nfs/dbraw/zinc/66/17/95/1052661795.db2.gz GUODZZYAFWUADY-CHWSQXEVSA-N 1 2 313.367 4.215 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cnc2ccsc2c1 ZINC000126489605 1052671707 /nfs/dbraw/zinc/67/17/07/1052671707.db2.gz QSQODGQADNCBBJ-CYBMUJFWSA-N 1 2 324.453 4.465 20 0 DIADLO Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]Cc1nccs1)CCCO2 ZINC000126580859 1052671736 /nfs/dbraw/zinc/67/17/36/1052671736.db2.gz DYIHCWLFJFXKCP-ZDUSSCGKSA-N 1 2 308.834 4.108 20 0 DIADLO COCc1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)o1 ZINC000127576524 1052698082 /nfs/dbraw/zinc/69/80/82/1052698082.db2.gz KGJVUPNUOZUEHY-LLVKDONJSA-N 1 2 308.447 4.031 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2nnc(-c3ccc(C)cc3)o2)o1 ZINC000127992368 1052706798 /nfs/dbraw/zinc/70/67/98/1052706798.db2.gz LNZXNWAVRALSFB-CQSZACIVSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)c2nnc(-c3ccc(C)cc3)o2)o1 ZINC000127992368 1052706804 /nfs/dbraw/zinc/70/68/04/1052706804.db2.gz LNZXNWAVRALSFB-CQSZACIVSA-N 1 2 311.385 4.139 20 0 DIADLO CCc1ccc2ccccc2c1C[NH2+]C(C)(C)c1noc(C)n1 ZINC000929967441 1052713926 /nfs/dbraw/zinc/71/39/26/1052713926.db2.gz BCUOYCKCEYRFMS-UHFFFAOYSA-N 1 2 309.413 4.119 20 0 DIADLO CC1CCC([N@H+](Cn2[nH]c(C(C)(C)C)nc2=S)C2CC2)CC1 ZINC000917438308 1052727091 /nfs/dbraw/zinc/72/70/91/1052727091.db2.gz UKCHIZPOSXVBGM-UHFFFAOYSA-N 1 2 322.522 4.239 20 0 DIADLO CC1CCC([N@@H+](Cn2[nH]c(C(C)(C)C)nc2=S)C2CC2)CC1 ZINC000917438308 1052727095 /nfs/dbraw/zinc/72/70/95/1052727095.db2.gz UKCHIZPOSXVBGM-UHFFFAOYSA-N 1 2 322.522 4.239 20 0 DIADLO CCOC(=[NH2+])CCCCOCc1ccc(OC(C)C)c(C)c1 ZINC001224966435 1052738923 /nfs/dbraw/zinc/73/89/23/1052738923.db2.gz QYZGOFNYAKZRMI-UHFFFAOYSA-N 1 2 307.434 4.483 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@@H]([C@@H]3CCCC3(C)C)C2)c(C)[nH+]1 ZINC001277024933 1052756242 /nfs/dbraw/zinc/75/62/42/1052756242.db2.gz VJPRFCNNWNBYPO-SJORKVTESA-N 1 2 314.473 4.295 20 0 DIADLO FC(F)(F)c1ccc(N2CCC(Oc3cc[nH+]cc3)CC2)cc1 ZINC001225290862 1052769707 /nfs/dbraw/zinc/76/97/07/1052769707.db2.gz KQFGDCXBJITWQW-UHFFFAOYSA-N 1 2 322.330 4.148 20 0 DIADLO O=C(/C=C/c1ccc(Cl)cc1)Nc1ccccc1-n1cc[nH+]c1 ZINC000918066227 1052777333 /nfs/dbraw/zinc/77/73/33/1052777333.db2.gz PBJRGLUIJNQFLT-JXMROGBWSA-N 1 2 323.783 4.178 20 0 DIADLO Cc1cc(C)c(NC(=O)C[N@@H+](C)[C@@H](C)c2ccco2)c(Cl)c1 ZINC000069069854 1052779372 /nfs/dbraw/zinc/77/93/72/1052779372.db2.gz DZBHEDPBUDGIKD-ZDUSSCGKSA-N 1 2 320.820 4.181 20 0 DIADLO Cc1cc(C)c(NC(=O)C[N@H+](C)[C@@H](C)c2ccco2)c(Cl)c1 ZINC000069069854 1052779376 /nfs/dbraw/zinc/77/93/76/1052779376.db2.gz DZBHEDPBUDGIKD-ZDUSSCGKSA-N 1 2 320.820 4.181 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)CC(=O)Nc1cccc2ccccc21 ZINC000069069841 1052779601 /nfs/dbraw/zinc/77/96/01/1052779601.db2.gz DMPVMHBSBPFXCP-CQSZACIVSA-N 1 2 308.381 4.064 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)CC(=O)Nc1cccc2ccccc21 ZINC000069069841 1052779605 /nfs/dbraw/zinc/77/96/05/1052779605.db2.gz DMPVMHBSBPFXCP-CQSZACIVSA-N 1 2 308.381 4.064 20 0 DIADLO Cc1cc(C)c(NC(=O)C[N@@H+](C)[C@H](C)c2ccco2)c(Cl)c1 ZINC000069069855 1052779641 /nfs/dbraw/zinc/77/96/41/1052779641.db2.gz DZBHEDPBUDGIKD-CYBMUJFWSA-N 1 2 320.820 4.181 20 0 DIADLO Cc1cc(C)c(NC(=O)C[N@H+](C)[C@H](C)c2ccco2)c(Cl)c1 ZINC000069069855 1052779647 /nfs/dbraw/zinc/77/96/47/1052779647.db2.gz DZBHEDPBUDGIKD-CYBMUJFWSA-N 1 2 320.820 4.181 20 0 DIADLO C[C@@H](CC[NH2+][C@@H](c1nnc[nH]1)c1ccc(F)cc1)CC(C)(C)C ZINC000556178688 1052817286 /nfs/dbraw/zinc/81/72/86/1052817286.db2.gz LKHOURISVKAQQQ-XJKSGUPXSA-N 1 2 318.440 4.085 20 0 DIADLO CC[C@H]1CCCC[C@@H]1c1noc(-c2cc(-n3cc[nH+]c3)ccn2)n1 ZINC000556386095 1052845182 /nfs/dbraw/zinc/84/51/82/1052845182.db2.gz GTBZBFAOEJPJTG-ZFWWWQNUSA-N 1 2 323.400 4.001 20 0 DIADLO CC(C)C[C@H](c1nc(-c2ccccc2Cl)no1)n1cc[nH+]c1 ZINC000923759335 1052846864 /nfs/dbraw/zinc/84/68/64/1052846864.db2.gz RAFOULPEAXVSGW-CQSZACIVSA-N 1 2 316.792 4.222 20 0 DIADLO C[C@@H](CC(=O)Nc1ccccc1Oc1ccccc1)n1cc[nH+]c1 ZINC000556687816 1052875882 /nfs/dbraw/zinc/87/58/82/1052875882.db2.gz BRNNUHYBJYPIGH-HNNXBMFYSA-N 1 2 321.380 4.265 20 0 DIADLO C[N@H+](CCCOc1ccc2ccccc2c1)Cc1cscn1 ZINC000170777297 1052879731 /nfs/dbraw/zinc/87/97/31/1052879731.db2.gz HQKPDKKJMYTMQB-UHFFFAOYSA-N 1 2 312.438 4.197 20 0 DIADLO C[N@@H+](CCCOc1ccc2ccccc2c1)Cc1cscn1 ZINC000170777297 1052879738 /nfs/dbraw/zinc/87/97/38/1052879738.db2.gz HQKPDKKJMYTMQB-UHFFFAOYSA-N 1 2 312.438 4.197 20 0 DIADLO CNc1ccc(Nc2ccc(C3(C(F)(F)F)CC3)cc2)c[nH+]1 ZINC001203454750 1052880122 /nfs/dbraw/zinc/88/01/22/1052880122.db2.gz LJFIEVXHFRYUSG-UHFFFAOYSA-N 1 2 307.319 4.461 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2c(F)cccc2F)cc2cccnc12 ZINC000556940566 1052903255 /nfs/dbraw/zinc/90/32/55/1052903255.db2.gz AWZQHKQKUSHLNX-UHFFFAOYSA-N 1 2 312.363 4.453 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2c(F)cccc2F)cc2cccnc12 ZINC000556940566 1052903257 /nfs/dbraw/zinc/90/32/57/1052903257.db2.gz AWZQHKQKUSHLNX-UHFFFAOYSA-N 1 2 312.363 4.453 20 0 DIADLO CC1(C)C[N@H+](CN2C(=O)C[C@@H]2c2ccccc2)[C@@H]1c1ccccc1 ZINC000919949461 1052904737 /nfs/dbraw/zinc/90/47/37/1052904737.db2.gz VWIJNSYYUZZDLN-UYAOXDASSA-N 1 2 320.436 4.001 20 0 DIADLO CC1(C)C[N@@H+](CN2C(=O)C[C@@H]2c2ccccc2)[C@@H]1c1ccccc1 ZINC000919949461 1052904741 /nfs/dbraw/zinc/90/47/41/1052904741.db2.gz VWIJNSYYUZZDLN-UYAOXDASSA-N 1 2 320.436 4.001 20 0 DIADLO CC1(C)C[N@H+](CN2C(=O)C[C@H]2c2ccccc2)[C@@H]1c1ccccc1 ZINC000919949458 1052904786 /nfs/dbraw/zinc/90/47/86/1052904786.db2.gz VWIJNSYYUZZDLN-AZUAARDMSA-N 1 2 320.436 4.001 20 0 DIADLO CC1(C)C[N@@H+](CN2C(=O)C[C@H]2c2ccccc2)[C@@H]1c1ccccc1 ZINC000919949458 1052904791 /nfs/dbraw/zinc/90/47/91/1052904791.db2.gz VWIJNSYYUZZDLN-AZUAARDMSA-N 1 2 320.436 4.001 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cc(Cl)nc(Cl)c2)C2CC2)o1 ZINC000920086223 1052917492 /nfs/dbraw/zinc/91/74/92/1052917492.db2.gz JNCJDTWIYIRRCB-UHFFFAOYSA-N 1 2 311.212 4.454 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cc(Cl)nc(Cl)c2)C2CC2)o1 ZINC000920086223 1052917497 /nfs/dbraw/zinc/91/74/97/1052917497.db2.gz JNCJDTWIYIRRCB-UHFFFAOYSA-N 1 2 311.212 4.454 20 0 DIADLO CCC/C(C)=C\C(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC000920220405 1052929338 /nfs/dbraw/zinc/92/93/38/1052929338.db2.gz PRROEFBKRMENDL-RNQWEJQRSA-N 1 2 321.490 4.060 20 0 DIADLO CCC/C(C)=C\C(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000920220405 1052929341 /nfs/dbraw/zinc/92/93/41/1052929341.db2.gz PRROEFBKRMENDL-RNQWEJQRSA-N 1 2 321.490 4.060 20 0 DIADLO Cc1ccc(C(=O)Nc2cccc(-c3[nH]c(C)c(C)[nH+]3)c2)s1 ZINC000920251267 1052930688 /nfs/dbraw/zinc/93/06/88/1052930688.db2.gz IHVUITHUXOPOSQ-UHFFFAOYSA-N 1 2 311.410 4.316 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccn(-c3ccccc3)n2)c(C)s1 ZINC000920409973 1052937439 /nfs/dbraw/zinc/93/74/39/1052937439.db2.gz KUXOXHLVQFNCFN-UHFFFAOYSA-N 1 2 311.454 4.183 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccn(-c3ccccc3)n2)c(C)s1 ZINC000920409973 1052937444 /nfs/dbraw/zinc/93/74/44/1052937444.db2.gz KUXOXHLVQFNCFN-UHFFFAOYSA-N 1 2 311.454 4.183 20 0 DIADLO CC(C)C[C@H](c1nc(-c2ccc(Cl)cc2)no1)n1cc[nH+]c1 ZINC000923761788 1052945979 /nfs/dbraw/zinc/94/59/79/1052945979.db2.gz SXHZFPRYPIYZQQ-CQSZACIVSA-N 1 2 316.792 4.222 20 0 DIADLO CCC1CCC([N@H+](C)Cn2[nH]c(C(C)(C)C)nc2=S)CC1 ZINC000921046339 1052960777 /nfs/dbraw/zinc/96/07/77/1052960777.db2.gz NXTPDQUYMGVTJZ-UHFFFAOYSA-N 1 2 310.511 4.096 20 0 DIADLO CCC1CCC([N@@H+](C)Cn2[nH]c(C(C)(C)C)nc2=S)CC1 ZINC000921046339 1052960779 /nfs/dbraw/zinc/96/07/79/1052960779.db2.gz NXTPDQUYMGVTJZ-UHFFFAOYSA-N 1 2 310.511 4.096 20 0 DIADLO CCC1CCC([N@H+](C)Cn2nc(C3CC3)n(CC)c2=S)CC1 ZINC000921045886 1052961063 /nfs/dbraw/zinc/96/10/63/1052961063.db2.gz HCJOUNYOHBXKPL-UHFFFAOYSA-N 1 2 322.522 4.169 20 0 DIADLO CCC1CCC([N@@H+](C)Cn2nc(C3CC3)n(CC)c2=S)CC1 ZINC000921045886 1052961065 /nfs/dbraw/zinc/96/10/65/1052961065.db2.gz HCJOUNYOHBXKPL-UHFFFAOYSA-N 1 2 322.522 4.169 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@H]2CCSc3ccccc32)n1 ZINC000921489159 1052973275 /nfs/dbraw/zinc/97/32/75/1052973275.db2.gz XTPPTNOKAFNFJJ-ZDUSSCGKSA-N 1 2 302.443 4.299 20 0 DIADLO CC[C@@H]1CCC[C@@H](Nc2nc(C)[nH+]c(C)c2Br)C1 ZINC000322905163 1052974561 /nfs/dbraw/zinc/97/45/61/1052974561.db2.gz QVNTZILCUINZIQ-VXGBXAGGSA-N 1 2 312.255 4.237 20 0 DIADLO FC(F)Sc1ccc(C[N@@H+]2CCC[C@@H](c3ccn[nH]3)C2)cc1 ZINC000064557471 1052993073 /nfs/dbraw/zinc/99/30/73/1052993073.db2.gz UPIGDMDCILIZLY-CYBMUJFWSA-N 1 2 323.412 4.104 20 0 DIADLO FC(F)Sc1ccc(C[N@H+]2CCC[C@@H](c3ccn[nH]3)C2)cc1 ZINC000064557471 1052993075 /nfs/dbraw/zinc/99/30/75/1052993075.db2.gz UPIGDMDCILIZLY-CYBMUJFWSA-N 1 2 323.412 4.104 20 0 DIADLO C[N@H+](CCCC(=O)OC(C)(C)C)Cc1c(F)cccc1Cl ZINC000610002882 1053002064 /nfs/dbraw/zinc/00/20/64/1053002064.db2.gz LQDGSAITSHPWNU-UHFFFAOYSA-N 1 2 315.816 4.033 20 0 DIADLO C[N@@H+](CCCC(=O)OC(C)(C)C)Cc1c(F)cccc1Cl ZINC000610002882 1053002068 /nfs/dbraw/zinc/00/20/68/1053002068.db2.gz LQDGSAITSHPWNU-UHFFFAOYSA-N 1 2 315.816 4.033 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2nc(C(C)(C)C)no2)c(C)c1 ZINC000615463395 1053019379 /nfs/dbraw/zinc/01/93/79/1053019379.db2.gz GNFLJDMXGCFFMR-AWEZNQCLSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2nc(C(C)(C)C)no2)c(C)c1 ZINC000615463395 1053019382 /nfs/dbraw/zinc/01/93/82/1053019382.db2.gz GNFLJDMXGCFFMR-AWEZNQCLSA-N 1 2 301.434 4.177 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2cccc(Cl)c2O)cc1 ZINC000179664584 1053022245 /nfs/dbraw/zinc/02/22/45/1053022245.db2.gz DIPPTLBMOUFIFU-LBPRGKRZSA-N 1 2 305.805 4.247 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2cccc(Cl)c2O)cc1 ZINC000179664584 1053022250 /nfs/dbraw/zinc/02/22/50/1053022250.db2.gz DIPPTLBMOUFIFU-LBPRGKRZSA-N 1 2 305.805 4.247 20 0 DIADLO c1ccc(C[NH+]2CC(Oc3ccc(-c4ccccn4)cc3)C2)cc1 ZINC001227906687 1053028196 /nfs/dbraw/zinc/02/81/96/1053028196.db2.gz LGVICXFPNDWYKZ-UHFFFAOYSA-N 1 2 316.404 4.012 20 0 DIADLO COc1cc2c(cc1O[C@@H]1CCc3c1cccc3C)C=[NH+]CC2 ZINC001228087536 1053042840 /nfs/dbraw/zinc/04/28/40/1053042840.db2.gz MMUGADCIPMHKOM-GOSISDBHSA-N 1 2 307.393 4.045 20 0 DIADLO C[C@@H](c1nc(C2CC(C)(C)CC(C)(C)C2)no1)n1cc[nH+]c1 ZINC001350513910 1053072430 /nfs/dbraw/zinc/07/24/30/1053072430.db2.gz FZAFDEOTSUILCP-LBPRGKRZSA-N 1 2 302.422 4.195 20 0 DIADLO Cc1[nH]c2ccc(O[C@@H]3CCCc4c(Cl)ccnc43)cc2[nH+]1 ZINC001228329941 1053075342 /nfs/dbraw/zinc/07/53/42/1053075342.db2.gz SLIBSNYVJAUVQS-MRXNPFEDSA-N 1 2 313.788 4.376 20 0 DIADLO Fc1ccc([C@H]([NH2+][C@H]2CCCc3[nH]ncc32)C2CCCC2)cc1 ZINC000353383912 1053078147 /nfs/dbraw/zinc/07/81/47/1053078147.db2.gz HKALQQXXHQVUBV-PKOBYXMFSA-N 1 2 313.420 4.447 20 0 DIADLO CC1(C)CCC(CC(=O)Nc2cccc(-n3cc[nH+]c3)c2)CC1 ZINC001350615389 1053089487 /nfs/dbraw/zinc/08/94/87/1053089487.db2.gz DGGNWFILPPCGKN-UHFFFAOYSA-N 1 2 311.429 4.417 20 0 DIADLO COc1ccnc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC001350932904 1053118495 /nfs/dbraw/zinc/11/84/95/1053118495.db2.gz RGNZZJKBGKEKJE-RYUDHWBXSA-N 1 2 319.474 4.256 20 0 DIADLO Cc1cc(NCCCn2cnc3ccccc32)[nH+]c2ccccc12 ZINC001317698284 1053126490 /nfs/dbraw/zinc/12/64/90/1053126490.db2.gz MKVYQNQDQHWMBS-UHFFFAOYSA-N 1 2 316.408 4.395 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@H+](C)Cc1ccc(F)cc1 ZINC001236598484 1053143830 /nfs/dbraw/zinc/14/38/30/1053143830.db2.gz IUVDWHYXIBFDCL-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[N@@H+](C)Cc1ccc(F)cc1 ZINC001236598484 1053143835 /nfs/dbraw/zinc/14/38/35/1053143835.db2.gz IUVDWHYXIBFDCL-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Fc1cc(C[NH+]2CCC(=Cc3ccccc3F)CC2)ccn1 ZINC001351373426 1053171563 /nfs/dbraw/zinc/17/15/63/1053171563.db2.gz FUUXSAGLZZUTOS-UHFFFAOYSA-N 1 2 300.352 4.039 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)c1ccc(-c2ccccc2)s1 ZINC001318701851 1053184674 /nfs/dbraw/zinc/18/46/74/1053184674.db2.gz BYDKIIQEKSNTJV-UHFFFAOYSA-N 1 2 319.389 4.315 20 0 DIADLO Cc1cc(NC[C@@H]2CCc3ccccc3N2)[nH+]c2ccccc12 ZINC001318780909 1053191707 /nfs/dbraw/zinc/19/17/07/1053191707.db2.gz WBWNOYXYRFVPKU-INIZCTEOSA-N 1 2 303.409 4.382 20 0 DIADLO CC(C)Cc1cccc([C@@H](C)C(=O)Nc2cccc3[nH+]ccn32)c1 ZINC001360225704 1053200796 /nfs/dbraw/zinc/20/07/96/1053200796.db2.gz WHIBSGJJICYPGN-OAHLLOKOSA-N 1 2 321.424 4.275 20 0 DIADLO C[C@H](Nc1ccc([NH+]2CCCC2)cc1)c1nc2ccccc2n1C ZINC000324853564 1053214509 /nfs/dbraw/zinc/21/45/09/1053214509.db2.gz MSJRPOXINXQRDL-HNNXBMFYSA-N 1 2 320.440 4.347 20 0 DIADLO Cc1sccc1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001351766287 1053220841 /nfs/dbraw/zinc/22/08/41/1053220841.db2.gz GFHDVENROXUDFC-UHFFFAOYSA-N 1 2 317.801 4.148 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)c1cc(Cl)c(F)cc1Cl ZINC001360441029 1053228304 /nfs/dbraw/zinc/22/83/04/1053228304.db2.gz BRYKFSPRYRWUOY-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)c(C)s1 ZINC001319426037 1053243270 /nfs/dbraw/zinc/24/32/70/1053243270.db2.gz SDNKMTALRKOLFR-INIZCTEOSA-N 1 2 308.397 4.375 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)c(C)s1 ZINC001319426037 1053243276 /nfs/dbraw/zinc/24/32/76/1053243276.db2.gz SDNKMTALRKOLFR-INIZCTEOSA-N 1 2 308.397 4.375 20 0 DIADLO C[S@@](=O)c1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccccc2)cc1 ZINC001319706130 1053264266 /nfs/dbraw/zinc/26/42/66/1053264266.db2.gz VTCAIVKJDQPJHM-PGRDOPGGSA-N 1 2 313.466 4.007 20 0 DIADLO C[S@@](=O)c1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2ccccc2)cc1 ZINC001319706130 1053264278 /nfs/dbraw/zinc/26/42/78/1053264278.db2.gz VTCAIVKJDQPJHM-PGRDOPGGSA-N 1 2 313.466 4.007 20 0 DIADLO COCC[N@H+](Cc1ncoc1C(C)C)[C@@H](C)c1ccccc1 ZINC001319753428 1053270044 /nfs/dbraw/zinc/27/00/44/1053270044.db2.gz KEKVYPOINPGZOM-HNNXBMFYSA-N 1 2 302.418 4.008 20 0 DIADLO COCC[N@@H+](Cc1ncoc1C(C)C)[C@@H](C)c1ccccc1 ZINC001319753428 1053270058 /nfs/dbraw/zinc/27/00/58/1053270058.db2.gz KEKVYPOINPGZOM-HNNXBMFYSA-N 1 2 302.418 4.008 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@@H](C)c1cc(O)ccc1F)CCC2 ZINC001352083958 1053276498 /nfs/dbraw/zinc/27/64/98/1053276498.db2.gz IAKPQUBMMDIZBR-YVEFUNNKSA-N 1 2 317.408 4.037 20 0 DIADLO Cc1cc(NC(=O)c2ccc3c(c2)C(C)(C)CCC3(C)C)cc[nH+]1 ZINC001127645087 1053276677 /nfs/dbraw/zinc/27/66/77/1053276677.db2.gz WOYZQSPQWQEGFB-UHFFFAOYSA-N 1 2 322.452 4.413 20 0 DIADLO CN(C)c1cccc(Cl)c1C[N@H+](C)Cc1ccc(Cl)nc1 ZINC001320058744 1053300563 /nfs/dbraw/zinc/30/05/63/1053300563.db2.gz LCSHQNHINAXITO-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1cccc(Cl)c1C[N@@H+](C)Cc1ccc(Cl)nc1 ZINC001320058744 1053300577 /nfs/dbraw/zinc/30/05/77/1053300577.db2.gz LCSHQNHINAXITO-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO C[C@@H](c1nc(-c2ccc(-c3ccccc3)cc2)no1)n1cc[nH+]c1 ZINC001320182059 1053312960 /nfs/dbraw/zinc/31/29/60/1053312960.db2.gz NLOBVUGFVQKZIB-AWEZNQCLSA-N 1 2 316.364 4.209 20 0 DIADLO C[C@H](SCc1cc[nH+]c(N(C)C)c1)c1ncc(C(C)(C)C)o1 ZINC001320278583 1053321879 /nfs/dbraw/zinc/32/18/79/1053321879.db2.gz OEPDCAJGLWOWHB-LBPRGKRZSA-N 1 2 319.474 4.428 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+]Cc1ccc([C@H]3C[C@H]3C)o1)CCC2 ZINC001320370982 1053328415 /nfs/dbraw/zinc/32/84/15/1053328415.db2.gz FRIZDKZFVKEPDA-COXVUDFISA-N 1 2 313.445 4.348 20 0 DIADLO O=C(CC(C1CCC1)C1CCC1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001352516286 1053340678 /nfs/dbraw/zinc/34/06/78/1053340678.db2.gz DGBNIAVQLZKTPQ-UHFFFAOYSA-N 1 2 323.440 4.417 20 0 DIADLO Clc1ccnc(Cl)c1C[NH2+]Cc1coc2ccccc12 ZINC001560848760 1053352834 /nfs/dbraw/zinc/35/28/34/1053352834.db2.gz MXOCLJKBOJUSCC-UHFFFAOYSA-N 1 2 307.180 4.424 20 0 DIADLO CCc1cccc(CC)c1NC(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000847368503 1053358342 /nfs/dbraw/zinc/35/83/42/1053358342.db2.gz BYMSMJXYJYFIJE-UHFFFAOYSA-N 1 2 307.397 4.020 20 0 DIADLO CCC[N@H+](Cc1nc(CC)no1)[C@@H](C)c1cc2ccccc2o1 ZINC000618763825 1053364117 /nfs/dbraw/zinc/36/41/17/1053364117.db2.gz VTOUJLQNLXCVCV-ZDUSSCGKSA-N 1 2 313.401 4.351 20 0 DIADLO CCC[N@@H+](Cc1nc(CC)no1)[C@@H](C)c1cc2ccccc2o1 ZINC000618763825 1053364125 /nfs/dbraw/zinc/36/41/25/1053364125.db2.gz VTOUJLQNLXCVCV-ZDUSSCGKSA-N 1 2 313.401 4.351 20 0 DIADLO Cc1cccnc1CNc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC001320869066 1053370079 /nfs/dbraw/zinc/37/00/79/1053370079.db2.gz ITFQLCGRPHPNDF-UHFFFAOYSA-N 1 2 318.424 4.202 20 0 DIADLO C[NH+](C)c1ccc(N[C@H]2CCCOc3cc(F)ccc32)cc1 ZINC000182210934 1053375037 /nfs/dbraw/zinc/37/50/37/1053375037.db2.gz NOBANQOXZVQSAG-KRWDZBQOSA-N 1 2 300.377 4.218 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2ccc(C)c(Cl)c2)c(C)[nH+]1 ZINC001434892427 1053379822 /nfs/dbraw/zinc/37/98/22/1053379822.db2.gz XITCSOQUKJGONM-UHFFFAOYSA-N 1 2 302.805 4.150 20 0 DIADLO CC[C@H]1CCC[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001434922242 1053388138 /nfs/dbraw/zinc/38/81/38/1053388138.db2.gz VUUSWYUBIGDGKX-GXTWGEPZSA-N 1 2 317.820 4.291 20 0 DIADLO CC(C)n1c[nH+]cc1CNC(=S)Nc1cccc2ccccc21 ZINC001200113609 1053391819 /nfs/dbraw/zinc/39/18/19/1053391819.db2.gz OBIFDNYNVVHCFB-UHFFFAOYSA-N 1 2 324.453 4.104 20 0 DIADLO Cc1cn2cc(NC(=O)C3CC(C)(C)CC(C)(C)C3)ccc2[nH+]1 ZINC001434943539 1053395303 /nfs/dbraw/zinc/39/53/03/1053395303.db2.gz HUAAOKDKQZZHJL-UHFFFAOYSA-N 1 2 313.445 4.434 20 0 DIADLO CN(C)c1cc(CSCCOC2CCCCCC2)cc[nH+]1 ZINC001321215198 1053401150 /nfs/dbraw/zinc/40/11/50/1053401150.db2.gz OUKXELUDFPUGNG-UHFFFAOYSA-N 1 2 308.491 4.120 20 0 DIADLO CC[N@H+](Cc1cn2cc(Cl)ccc2n1)Cc1ccccc1F ZINC001321452345 1053412550 /nfs/dbraw/zinc/41/25/50/1053412550.db2.gz QGVYPWHZDDBDLO-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO CC[N@@H+](Cc1cn2cc(Cl)ccc2n1)Cc1ccccc1F ZINC001321452345 1053412560 /nfs/dbraw/zinc/41/25/60/1053412560.db2.gz QGVYPWHZDDBDLO-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCC1Cc2ccccc2C1 ZINC001474761897 1053429995 /nfs/dbraw/zinc/42/99/95/1053429995.db2.gz FIPBZNCCPZJGIJ-UHFFFAOYSA-N 1 2 305.425 4.444 20 0 DIADLO Cc1cc(C)c(/C=C\C[NH+]2CC(Oc3ccccc3)C2)c(C)c1 ZINC001474762670 1053431789 /nfs/dbraw/zinc/43/17/89/1053431789.db2.gz UHHHUESCHXRNEB-YFHOEESVSA-N 1 2 307.437 4.388 20 0 DIADLO CCOc1ccc([C@H](C)Oc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001229954553 1053438128 /nfs/dbraw/zinc/43/81/28/1053438128.db2.gz QZQWTCOJILOBHX-HNNXBMFYSA-N 1 2 308.381 4.411 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccc(N2CCCC2=O)cc1 ZINC000182494484 1053455990 /nfs/dbraw/zinc/45/59/90/1053455990.db2.gz ZCFUXOIZHHBAET-OAHLLOKOSA-N 1 2 323.440 4.053 20 0 DIADLO Clc1ccc([C@@H]2C[N@@H+]([C@H]3CCc4ccccc43)CCO2)s1 ZINC001322173727 1053466987 /nfs/dbraw/zinc/46/69/87/1053466987.db2.gz BNCVKRJHSVZGSZ-GJZGRUSLSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc([C@@H]2C[N@H+]([C@H]3CCc4ccccc43)CCO2)s1 ZINC001322173727 1053466994 /nfs/dbraw/zinc/46/69/94/1053466994.db2.gz BNCVKRJHSVZGSZ-GJZGRUSLSA-N 1 2 319.857 4.462 20 0 DIADLO CCC1(CC)CCCN(C(=O)NCc2c[nH+]c(C)cc2C)CC1 ZINC001230062807 1053469415 /nfs/dbraw/zinc/46/94/15/1053469415.db2.gz LCOLIXGPFRKGSU-UHFFFAOYSA-N 1 2 317.477 4.200 20 0 DIADLO Cc1cc(N2CCC(OC3CCCC3)CC2)[nH+]c2ccccc12 ZINC001322223509 1053470169 /nfs/dbraw/zinc/47/01/69/1053470169.db2.gz UFDDBYBEHLKLKK-UHFFFAOYSA-N 1 2 310.441 4.471 20 0 DIADLO CC[C@H](NC(=O)c1c(C)cc(C)[nH+]c1C)c1ccc(F)cc1F ZINC001435212358 1053473636 /nfs/dbraw/zinc/47/36/36/1053473636.db2.gz IDJPTHUAYYBWDM-INIZCTEOSA-N 1 2 318.367 4.166 20 0 DIADLO Cc1ccc(OC2CC[NH+](C/C(Cl)=C\Cl)CC2)cc1 ZINC000763565092 1053474968 /nfs/dbraw/zinc/47/49/68/1053474968.db2.gz YLITXBIQWIXQIW-JLHYYAGUSA-N 1 2 300.229 4.157 20 0 DIADLO CC(C)Sc1ccc(Cl)cc1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001322508765 1053515702 /nfs/dbraw/zinc/51/57/02/1053515702.db2.gz FVEFVJNJUDAPHN-NSHDSACASA-N 1 2 323.849 4.237 20 0 DIADLO Cc1cc(N[C@H](C)c2ccnn2-c2ccccc2)ccc1[NH+](C)C ZINC001322576913 1053522818 /nfs/dbraw/zinc/52/28/18/1053522818.db2.gz VNGFNLFVZJHWLK-MRXNPFEDSA-N 1 2 320.440 4.420 20 0 DIADLO C[C@@H]([NH2+]c1ccc(N(C)Cc2ccccc2)cc1)[C@@H]1CCOC1 ZINC000182901149 1053545732 /nfs/dbraw/zinc/54/57/32/1053545732.db2.gz SXCOGZYLBVRNNW-SJLPKXTDSA-N 1 2 310.441 4.160 20 0 DIADLO CC(C)SCC[N@@H+]1CCc2sc(Br)cc2C1 ZINC000619780803 1053558045 /nfs/dbraw/zinc/55/80/45/1053558045.db2.gz CWWAYCDMWXTUIS-UHFFFAOYSA-N 1 2 320.321 4.010 20 0 DIADLO CC(C)SCC[N@H+]1CCc2sc(Br)cc2C1 ZINC000619780803 1053558053 /nfs/dbraw/zinc/55/80/53/1053558053.db2.gz CWWAYCDMWXTUIS-UHFFFAOYSA-N 1 2 320.321 4.010 20 0 DIADLO c1cn(-c2ccc(NCc3ccccc3N3CCCC3)cc2)c[nH+]1 ZINC001323345581 1053574420 /nfs/dbraw/zinc/57/44/20/1053574420.db2.gz HVFVQESXNUZZIO-UHFFFAOYSA-N 1 2 318.424 4.085 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@H](F)CC1CCCCC1 ZINC001353483528 1053586967 /nfs/dbraw/zinc/58/69/67/1053586967.db2.gz XNHZSKYFRGXXPA-QGZVFWFLSA-N 1 2 315.392 4.119 20 0 DIADLO CC(C)=CCC[C@@H](C)[NH2+]c1ccc(N2CCC(O)CC2)cc1 ZINC000183097379 1053589013 /nfs/dbraw/zinc/58/90/13/1053589013.db2.gz QAPPVQLFYVAKNP-MRXNPFEDSA-N 1 2 302.462 4.195 20 0 DIADLO CC(C)=CCC[C@@H](C)Nc1ccc([NH+]2CCC(O)CC2)cc1 ZINC000183097379 1053589026 /nfs/dbraw/zinc/58/90/26/1053589026.db2.gz QAPPVQLFYVAKNP-MRXNPFEDSA-N 1 2 302.462 4.195 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2ccnc(Cl)c2)c1C ZINC001323648330 1053593058 /nfs/dbraw/zinc/59/30/58/1053593058.db2.gz NADIEQCJALEUMQ-UHFFFAOYSA-N 1 2 308.834 4.189 20 0 DIADLO Cc1ccc(N[C@@H](C)c2cc(Br)ncc2F)c(C)[nH+]1 ZINC001323931692 1053610870 /nfs/dbraw/zinc/61/08/70/1053610870.db2.gz WCJIUYMAXMBRQW-VIFPVBQESA-N 1 2 324.197 4.168 20 0 DIADLO Oc1cc2c(cc1O[C@H]1Cc3cccc4cccc1c34)CC[NH+]=C2 ZINC001230920905 1053625279 /nfs/dbraw/zinc/62/52/79/1053625279.db2.gz XJJZVCFDHMFRII-IBGZPJMESA-N 1 2 315.372 4.197 20 0 DIADLO Cc1cc(NC[C@@]2(CO)C[C@H]2c2ccccc2)[nH+]c2ccccc12 ZINC001324234600 1053636396 /nfs/dbraw/zinc/63/63/96/1053636396.db2.gz HTPLJYRZHNKQCX-GHTZIAJQSA-N 1 2 318.420 4.121 20 0 DIADLO Cc1cc(Nc2ccnc(C3CC3)n2)c[nH+]c1N1CCCC[C@H]1C ZINC000503296629 1053652318 /nfs/dbraw/zinc/65/23/18/1053652318.db2.gz SMSHPVXOESAXET-CQSZACIVSA-N 1 2 323.444 4.180 20 0 DIADLO OC1CC[NH+](c2ccc(NCc3cccc4ccoc43)cc2)CC1 ZINC001324425562 1053652482 /nfs/dbraw/zinc/65/24/82/1053652482.db2.gz RVLZSFRXKSIXAC-UHFFFAOYSA-N 1 2 322.408 4.006 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Nc1ccccc1-c1cccs1 ZINC000620410594 1053658023 /nfs/dbraw/zinc/65/80/23/1053658023.db2.gz AHDWAKWLGYWXAK-UHFFFAOYSA-N 1 2 311.410 4.031 20 0 DIADLO Cc1cc(NC(=O)c2csc(C3CCCCC3)c2)cc[nH+]1 ZINC001435757989 1053667472 /nfs/dbraw/zinc/66/74/72/1053667472.db2.gz PTGJQTANLRUBOT-UHFFFAOYSA-N 1 2 300.427 4.173 20 0 DIADLO FC(F)(F)[C@@H](Oc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccnc1 ZINC001231080205 1053668653 /nfs/dbraw/zinc/66/86/53/1053668653.db2.gz AHOPFIYZCMNSGU-AWEZNQCLSA-N 1 2 319.286 4.154 20 0 DIADLO Cc1cccc2c1[C@H](Oc1ccc(-c3c[nH+]cn3C)cc1)CC2 ZINC001231078678 1053669095 /nfs/dbraw/zinc/66/90/95/1053669095.db2.gz CVUOOKCGFDOPDL-LJQANCHMSA-N 1 2 304.393 4.462 20 0 DIADLO COc1ccc([C@H](C)Oc2ccc(-c3c[nH+]cn3C)cc2)cc1 ZINC001231082310 1053671166 /nfs/dbraw/zinc/67/11/66/1053671166.db2.gz PBKGHWQPZVCKML-AWEZNQCLSA-N 1 2 308.381 4.236 20 0 DIADLO c1c[nH+]c(-c2ccc(O[C@@H]3CCCN(c4ccccc4)C3)cc2)[nH]1 ZINC001231082073 1053671914 /nfs/dbraw/zinc/67/19/14/1053671914.db2.gz QYHUBXVIIVSVOR-LJQANCHMSA-N 1 2 319.408 4.125 20 0 DIADLO c1c[nH+]c(-c2ccc(O[C@@H]3C[C@@H](OCc4ccccc4)C3)cc2)[nH]1 ZINC001231083670 1053672356 /nfs/dbraw/zinc/67/23/56/1053672356.db2.gz FXOALIDLUQYOEJ-WGSAOQKQSA-N 1 2 320.392 4.203 20 0 DIADLO Cc1ccc(N[C@@H](C)c2cnn(Cc3ccccc3)c2)c(C)[nH+]1 ZINC001324964611 1053690510 /nfs/dbraw/zinc/69/05/10/1053690510.db2.gz DMHPSULKVQAIPW-HNNXBMFYSA-N 1 2 306.413 4.116 20 0 DIADLO Cc1cc(NCc2ccc(Cl)o2)[nH+]c(C)c1Br ZINC001325114187 1053700645 /nfs/dbraw/zinc/70/06/45/1053700645.db2.gz PTDLIKIFKUNIQB-UHFFFAOYSA-N 1 2 315.598 4.319 20 0 DIADLO Cc1cc(C)c(C(=O)N(C)Cc2ccc(F)c(Cl)c2)c(C)[nH+]1 ZINC001435889262 1053713383 /nfs/dbraw/zinc/71/33/83/1053713383.db2.gz CNJKPUKCZGRRSH-UHFFFAOYSA-N 1 2 320.795 4.072 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+](C)CCOCc1ccccc1 ZINC000154611428 1053741957 /nfs/dbraw/zinc/74/19/57/1053741957.db2.gz YWGINDJIGZWQNN-HNNXBMFYSA-N 1 2 316.445 4.182 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)CCOCc1ccccc1 ZINC000154611428 1053741971 /nfs/dbraw/zinc/74/19/71/1053741971.db2.gz YWGINDJIGZWQNN-HNNXBMFYSA-N 1 2 316.445 4.182 20 0 DIADLO Cc1ccc([C@H]2CCC[C@@H]2OC(=O)c2cccc3[nH+]ccn32)cc1 ZINC001435985481 1053745076 /nfs/dbraw/zinc/74/50/76/1053745076.db2.gz UZURNTKTAMCJAQ-AEFFLSMTSA-N 1 2 320.392 4.136 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2c(F)ccc(F)c2OC)cc1 ZINC001231413778 1053747112 /nfs/dbraw/zinc/74/71/12/1053747112.db2.gz BRHFDWWNTJHXRP-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2c(F)ccc(F)c2OC)cc1 ZINC001231413778 1053747120 /nfs/dbraw/zinc/74/71/20/1053747120.db2.gz BRHFDWWNTJHXRP-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccc(C)c(Cl)c1)CC2 ZINC001231424425 1053748394 /nfs/dbraw/zinc/74/83/94/1053748394.db2.gz SQSLPPZITPEYTM-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1ccc(C)c(Cl)c1)CC2 ZINC001231424425 1053748401 /nfs/dbraw/zinc/74/84/01/1053748401.db2.gz SQSLPPZITPEYTM-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccc(Br)c(Cl)c1 ZINC001231437982 1053750700 /nfs/dbraw/zinc/75/07/00/1053750700.db2.gz WEEPJJWGEYFMRD-OUJBWJOFSA-N 1 2 318.617 4.035 20 0 DIADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccc(Br)c(Cl)c1 ZINC001231437982 1053750713 /nfs/dbraw/zinc/75/07/13/1053750713.db2.gz WEEPJJWGEYFMRD-OUJBWJOFSA-N 1 2 318.617 4.035 20 0 DIADLO Cc1ccccc1C[N@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155067732 1053760695 /nfs/dbraw/zinc/76/06/95/1053760695.db2.gz HYEQVJGUOYUAPB-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1ccccc1C[N@@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155067732 1053760701 /nfs/dbraw/zinc/76/07/01/1053760701.db2.gz HYEQVJGUOYUAPB-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155079518 1053761695 /nfs/dbraw/zinc/76/16/95/1053761695.db2.gz IZIWMCBSCOPHRH-CQSZACIVSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155079518 1053761712 /nfs/dbraw/zinc/76/17/12/1053761712.db2.gz IZIWMCBSCOPHRH-CQSZACIVSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@H]1C[N@H+](Cc2nnc(-c3ccccc3)s2)[C@@H]1c1ccccc1 ZINC000155310360 1053774901 /nfs/dbraw/zinc/77/49/01/1053774901.db2.gz WWEYFILDEVPHEE-KSSFIOAISA-N 1 2 321.449 4.398 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nnc(-c3ccccc3)s2)[C@@H]1c1ccccc1 ZINC000155310360 1053774914 /nfs/dbraw/zinc/77/49/14/1053774914.db2.gz WWEYFILDEVPHEE-KSSFIOAISA-N 1 2 321.449 4.398 20 0 DIADLO C[C@H]1C[NH+](Cc2ccc(F)c(Oc3ccccc3)c2)C[C@H](C)O1 ZINC001231536249 1053779133 /nfs/dbraw/zinc/77/91/33/1053779133.db2.gz GATDSCNOALCYNK-GJZGRUSLSA-N 1 2 315.388 4.227 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2ccc(O)c(C(F)(F)F)c2)C1 ZINC001231523882 1053779264 /nfs/dbraw/zinc/77/92/64/1053779264.db2.gz IDJHAQVJYZJWPI-AWEZNQCLSA-N 1 2 305.315 4.125 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2ccc(O)c(C(F)(F)F)c2)C1 ZINC001231523882 1053779277 /nfs/dbraw/zinc/77/92/77/1053779277.db2.gz IDJHAQVJYZJWPI-AWEZNQCLSA-N 1 2 305.315 4.125 20 0 DIADLO Clc1cc(Cl)c(Cl)c(C[N@@H+]2CCCC3(COC3)C2)c1 ZINC001231597691 1053795403 /nfs/dbraw/zinc/79/54/03/1053795403.db2.gz HBFBHAXIVDXJAG-UHFFFAOYSA-N 1 2 320.647 4.259 20 0 DIADLO Clc1cc(Cl)c(Cl)c(C[N@H+]2CCCC3(COC3)C2)c1 ZINC001231597691 1053795411 /nfs/dbraw/zinc/79/54/11/1053795411.db2.gz HBFBHAXIVDXJAG-UHFFFAOYSA-N 1 2 320.647 4.259 20 0 DIADLO C[C@H]1CC[C@H](CO)C[N@@H+]1Cc1cc(Cl)cc(Cl)c1Cl ZINC001231597612 1053796624 /nfs/dbraw/zinc/79/66/24/1053796624.db2.gz FEWAHDZLGUJJAW-UWVGGRQHSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1CC[C@H](CO)C[N@H+]1Cc1cc(Cl)cc(Cl)c1Cl ZINC001231597612 1053796639 /nfs/dbraw/zinc/79/66/39/1053796639.db2.gz FEWAHDZLGUJJAW-UWVGGRQHSA-N 1 2 322.663 4.240 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)o1 ZINC000620934840 1053797258 /nfs/dbraw/zinc/79/72/58/1053797258.db2.gz SPXMUBSJVXDCGB-HNNXBMFYSA-N 1 2 300.402 4.015 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)o1 ZINC000620934840 1053797262 /nfs/dbraw/zinc/79/72/62/1053797262.db2.gz SPXMUBSJVXDCGB-HNNXBMFYSA-N 1 2 300.402 4.015 20 0 DIADLO COc1cc(F)ccc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001231608887 1053802142 /nfs/dbraw/zinc/80/21/42/1053802142.db2.gz RHWOHQONJVURSW-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)ccc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001231608887 1053802159 /nfs/dbraw/zinc/80/21/59/1053802159.db2.gz RHWOHQONJVURSW-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO CC(C)(C)c1cnc(C[NH+]2CC(c3ccc(F)cc3)C2)s1 ZINC001326787719 1053803120 /nfs/dbraw/zinc/80/31/20/1053803120.db2.gz UHFNMKWFSRPKEC-UHFFFAOYSA-N 1 2 304.434 4.179 20 0 DIADLO COc1cc(C)c(C[N@@H+]2CCC(F)(F)[C@H](F)C2)cc1C(C)C ZINC001231624140 1053805049 /nfs/dbraw/zinc/80/50/49/1053805049.db2.gz BHFIPQMVVVLBRM-MRXNPFEDSA-N 1 2 315.379 4.306 20 0 DIADLO COc1cc(C)c(C[N@H+]2CCC(F)(F)[C@H](F)C2)cc1C(C)C ZINC001231624140 1053805065 /nfs/dbraw/zinc/80/50/65/1053805065.db2.gz BHFIPQMVVVLBRM-MRXNPFEDSA-N 1 2 315.379 4.306 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2cc(Cl)ccc2OC)cs1 ZINC000156468595 1053810589 /nfs/dbraw/zinc/81/05/89/1053810589.db2.gz UATLDUOYAQJJMI-JTQLQIEISA-N 1 2 310.850 4.218 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2cc(Cl)ccc2OC)cs1 ZINC000156468705 1053810937 /nfs/dbraw/zinc/81/09/37/1053810937.db2.gz UATLDUOYAQJJMI-SNVBAGLBSA-N 1 2 310.850 4.218 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(CC)cn1 ZINC001231647482 1053816574 /nfs/dbraw/zinc/81/65/74/1053816574.db2.gz XRKXKMSQJNOLPX-IBGZPJMESA-N 1 2 310.441 4.127 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(CC)cn1 ZINC001231647482 1053816594 /nfs/dbraw/zinc/81/65/94/1053816594.db2.gz XRKXKMSQJNOLPX-IBGZPJMESA-N 1 2 310.441 4.127 20 0 DIADLO Oc1ccc2c(c1)CC[N@@H+](Cc1nc(-c3ccccc3)cs1)C2 ZINC001231682787 1053833603 /nfs/dbraw/zinc/83/36/03/1053833603.db2.gz ZEJIDSSWHDDWRS-UHFFFAOYSA-N 1 2 322.433 4.074 20 0 DIADLO Oc1ccc2c(c1)CC[N@H+](Cc1nc(-c3ccccc3)cs1)C2 ZINC001231682787 1053833611 /nfs/dbraw/zinc/83/36/11/1053833611.db2.gz ZEJIDSSWHDDWRS-UHFFFAOYSA-N 1 2 322.433 4.074 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccc(F)cn1 ZINC000312883225 1053834304 /nfs/dbraw/zinc/83/43/04/1053834304.db2.gz WOHWKMALNHYPEV-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO CC(C)Oc1ccc(C[NH+]2CC3(CCC3)C2)cc1Br ZINC001231724678 1053842163 /nfs/dbraw/zinc/84/21/63/1053842163.db2.gz ZMQTXRNWFDBBKK-UHFFFAOYSA-N 1 2 324.262 4.222 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001327240500 1053843246 /nfs/dbraw/zinc/84/32/46/1053843246.db2.gz ZHEVABBPQBZAKE-HNNXBMFYSA-N 1 2 321.380 4.184 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2oc3ccccc3c2CC)s1 ZINC000273359586 1053844843 /nfs/dbraw/zinc/84/48/43/1053844843.db2.gz CHKHKUBQOZXPFL-NSHDSACASA-N 1 2 315.442 4.260 20 0 DIADLO C/C(=C\C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1)C(C)(C)C ZINC001436379781 1053859837 /nfs/dbraw/zinc/85/98/37/1053859837.db2.gz BRZADEQMAAEXPL-ACCUITESSA-N 1 2 311.429 4.232 20 0 DIADLO CCn1nc(CNc2ccc([NH+]3CCCC3)cc2)c2ccccc21 ZINC000274412142 1053861776 /nfs/dbraw/zinc/86/17/76/1053861776.db2.gz IIKRGKIAHKDWDJ-UHFFFAOYSA-N 1 2 320.440 4.269 20 0 DIADLO COc1cccc2cc(C[NH2+][C@H](C)c3csc(C)n3)oc21 ZINC001327625287 1053867675 /nfs/dbraw/zinc/86/76/75/1053867675.db2.gz NTGHRCARVGMXOD-SNVBAGLBSA-N 1 2 302.399 4.057 20 0 DIADLO C[C@H](Cc1ccccc1F)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000157858605 1053871515 /nfs/dbraw/zinc/87/15/15/1053871515.db2.gz QPRMPFNROFJFTB-CYBMUJFWSA-N 1 2 323.371 4.033 20 0 DIADLO CC(C)n1ccnc1C[NH2+]C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000649886356 1053871554 /nfs/dbraw/zinc/87/15/54/1053871554.db2.gz YGVQEKHKWWJGOY-UHFFFAOYSA-N 1 2 323.362 4.262 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1coc(C(C)(C)C)n1 ZINC001354498611 1053884823 /nfs/dbraw/zinc/88/48/23/1053884823.db2.gz HQPPIFHWVSVMDH-MNOVXSKESA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1coc(C(C)(C)C)n1 ZINC001354498611 1053884837 /nfs/dbraw/zinc/88/48/37/1053884837.db2.gz HQPPIFHWVSVMDH-MNOVXSKESA-N 1 2 304.356 4.135 20 0 DIADLO Cc1cc(OCc2ccccc2)ccc1C[N@H+](C)Cc1ccon1 ZINC001231850074 1053889287 /nfs/dbraw/zinc/88/92/87/1053889287.db2.gz GEOXYTCJXZWUCR-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1cc(OCc2ccccc2)ccc1C[N@@H+](C)Cc1ccon1 ZINC001231850074 1053889302 /nfs/dbraw/zinc/88/93/02/1053889302.db2.gz GEOXYTCJXZWUCR-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1cc(N(C)C[C@@H]2OCCc3ccccc32)[nH+]c2ccccc12 ZINC001327954730 1053900085 /nfs/dbraw/zinc/90/00/85/1053900085.db2.gz ZDWXEPXZTGCLCE-FQEVSTJZSA-N 1 2 318.420 4.293 20 0 DIADLO c1ccc(-c2cccc(C[NH2+]Cc3nnc(C4CC4)s3)c2)cc1 ZINC000414552804 1053901490 /nfs/dbraw/zinc/90/14/90/1053901490.db2.gz HQDFXZLRNGSZTN-UHFFFAOYSA-N 1 2 321.449 4.372 20 0 DIADLO Cc1cc(NCc2c(C3CCC3)cnn2C)[nH+]c2ccccc12 ZINC001328056700 1053904569 /nfs/dbraw/zinc/90/45/69/1053904569.db2.gz PTWSLEARCPLHMN-UHFFFAOYSA-N 1 2 306.413 4.156 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+]C[C@@H]2CCSC2)C(F)F)c1 ZINC000671123174 1053918143 /nfs/dbraw/zinc/91/81/43/1053918143.db2.gz PHEMTEMAQLBLBI-WFASDCNBSA-N 1 2 315.429 4.123 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2ccc3ccnc(Cl)c3c2)C[C@H]1F ZINC001231976355 1053926814 /nfs/dbraw/zinc/92/68/14/1053926814.db2.gz OERDHBRFWALRKT-GDBMZVCRSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2ccc3ccnc(Cl)c3c2)C[C@H]1F ZINC001231976355 1053926822 /nfs/dbraw/zinc/92/68/22/1053926822.db2.gz OERDHBRFWALRKT-GDBMZVCRSA-N 1 2 310.775 4.160 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001231985931 1053930506 /nfs/dbraw/zinc/93/05/06/1053930506.db2.gz WBAJVPSIDDKXGY-OAHLLOKOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(F)ncc1C[N@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001231985931 1053930518 /nfs/dbraw/zinc/93/05/18/1053930518.db2.gz WBAJVPSIDDKXGY-OAHLLOKOSA-N 1 2 306.331 4.144 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)cnc2F)c1 ZINC001231994014 1053932447 /nfs/dbraw/zinc/93/24/47/1053932447.db2.gz ACKQFORZYAJIKI-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2cc(Cl)cnc2F)c1 ZINC001231994014 1053932458 /nfs/dbraw/zinc/93/24/58/1053932458.db2.gz ACKQFORZYAJIKI-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2cc(Cl)cnc2F)cc1 ZINC001231995606 1053933382 /nfs/dbraw/zinc/93/33/82/1053933382.db2.gz SXIPTESXZBAPLR-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2cc(Cl)cnc2F)cc1 ZINC001231995606 1053933392 /nfs/dbraw/zinc/93/33/92/1053933392.db2.gz SXIPTESXZBAPLR-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(Cl)cnc1F ZINC001231999304 1053933460 /nfs/dbraw/zinc/93/34/60/1053933460.db2.gz YXCITKQUMDYPOW-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc(Cl)cnc1F ZINC001231999304 1053933463 /nfs/dbraw/zinc/93/34/63/1053933463.db2.gz YXCITKQUMDYPOW-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO Fc1ccc(C2CC[NH+](Cc3cc(Cl)cnc3F)CC2)cc1 ZINC001231991893 1053934261 /nfs/dbraw/zinc/93/42/61/1053934261.db2.gz GWCHHWBELKPRBZ-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO C[N@@H+](Cc1cccc2cccnc21)Cc1cc(Cl)cnc1F ZINC001231992682 1053934509 /nfs/dbraw/zinc/93/45/09/1053934509.db2.gz MNBBUPPUAYIGOB-UHFFFAOYSA-N 1 2 315.779 4.054 20 0 DIADLO C[N@H+](Cc1cccc2cccnc21)Cc1cc(Cl)cnc1F ZINC001231992682 1053934513 /nfs/dbraw/zinc/93/45/13/1053934513.db2.gz MNBBUPPUAYIGOB-UHFFFAOYSA-N 1 2 315.779 4.054 20 0 DIADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)cc(C)n1 ZINC001231995212 1053934520 /nfs/dbraw/zinc/93/45/20/1053934520.db2.gz IZFBXXYVVWDZMI-NRFANRHFSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1cc(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)cc(C)n1 ZINC001231995212 1053934525 /nfs/dbraw/zinc/93/45/25/1053934525.db2.gz IZFBXXYVVWDZMI-NRFANRHFSA-N 1 2 317.436 4.105 20 0 DIADLO FC(F)(F)c1cnc(Cl)c(C[N@@H+]2CCC23CCCC3)c1 ZINC001232007606 1053938407 /nfs/dbraw/zinc/93/84/07/1053938407.db2.gz IPRKRVSRFNZWMH-UHFFFAOYSA-N 1 2 304.743 4.272 20 0 DIADLO FC(F)(F)c1cnc(Cl)c(C[N@H+]2CCC23CCCC3)c1 ZINC001232007606 1053938414 /nfs/dbraw/zinc/93/84/14/1053938414.db2.gz IPRKRVSRFNZWMH-UHFFFAOYSA-N 1 2 304.743 4.272 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cc(C(F)(F)F)cnc1Cl ZINC001232009940 1053940030 /nfs/dbraw/zinc/94/00/30/1053940030.db2.gz WMTREAUSQKVHDF-VHSXEESVSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cc(C(F)(F)F)cnc1Cl ZINC001232009940 1053940048 /nfs/dbraw/zinc/94/00/48/1053940048.db2.gz WMTREAUSQKVHDF-VHSXEESVSA-N 1 2 306.759 4.374 20 0 DIADLO C[N@H+](Cc1cncc(O)c1)Cc1ccccc1Oc1ccccc1 ZINC001232045428 1053948056 /nfs/dbraw/zinc/94/80/56/1053948056.db2.gz WKLCFCJFBDENIZ-UHFFFAOYSA-N 1 2 320.392 4.212 20 0 DIADLO C[N@@H+](Cc1cncc(O)c1)Cc1ccccc1Oc1ccccc1 ZINC001232045428 1053948074 /nfs/dbraw/zinc/94/80/74/1053948074.db2.gz WKLCFCJFBDENIZ-UHFFFAOYSA-N 1 2 320.392 4.212 20 0 DIADLO CCCC[N@H+](Cc1nc(C2CC2)no1)[C@H](C)c1ccc(C)o1 ZINC000621317423 1053956788 /nfs/dbraw/zinc/95/67/88/1053956788.db2.gz BSIJCILUMWJHPJ-CYBMUJFWSA-N 1 2 303.406 4.212 20 0 DIADLO CCCC[N@@H+](Cc1nc(C2CC2)no1)[C@H](C)c1ccc(C)o1 ZINC000621317423 1053956795 /nfs/dbraw/zinc/95/67/95/1053956795.db2.gz BSIJCILUMWJHPJ-CYBMUJFWSA-N 1 2 303.406 4.212 20 0 DIADLO Cc1cc(C)c(CNC(=O)CCc2cccc3ccccc32)c[nH+]1 ZINC001436734952 1053959649 /nfs/dbraw/zinc/95/96/49/1053959649.db2.gz BIRNSLWXPCWMNS-UHFFFAOYSA-N 1 2 318.420 4.101 20 0 DIADLO CC(C)OC1CC[NH+](Cc2c(F)cc(F)cc2Cl)CC1 ZINC001232101686 1053961331 /nfs/dbraw/zinc/96/13/31/1053961331.db2.gz LOUOCCQRWMGHKF-UHFFFAOYSA-N 1 2 303.780 4.008 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CCC[N@@H+]1Cc1cc2ccncc2[nH]1 ZINC001232097993 1053962059 /nfs/dbraw/zinc/96/20/59/1053962059.db2.gz XGSSFXHENLUNKV-KRWDZBQOSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CCC[N@H+]1Cc1cc2ccncc2[nH]1 ZINC001232097993 1053962071 /nfs/dbraw/zinc/96/20/71/1053962071.db2.gz XGSSFXHENLUNKV-KRWDZBQOSA-N 1 2 313.351 4.178 20 0 DIADLO FC(F)(F)CC[N@@H+](Cc1nc(-c2ccccc2)c[nH]1)CC1CC1 ZINC001329061935 1053962098 /nfs/dbraw/zinc/96/20/98/1053962098.db2.gz OBHXIIVEZJPNKE-UHFFFAOYSA-N 1 2 323.362 4.241 20 0 DIADLO FC(F)(F)CC[N@H+](Cc1nc(-c2ccccc2)c[nH]1)CC1CC1 ZINC001329061935 1053962104 /nfs/dbraw/zinc/96/21/04/1053962104.db2.gz OBHXIIVEZJPNKE-UHFFFAOYSA-N 1 2 323.362 4.241 20 0 DIADLO COc1ccc2c(c1)OCC[C@@H]2[NH2+]Cc1c(F)cccc1Cl ZINC001200775686 1053964959 /nfs/dbraw/zinc/96/49/59/1053964959.db2.gz YEXOCDHEWHLANP-INIZCTEOSA-N 1 2 321.779 4.101 20 0 DIADLO C[C@H](Nc1ccc([NH+]2CCCC2)cc1)c1cn2ccccc2n1 ZINC001329114047 1053967611 /nfs/dbraw/zinc/96/76/11/1053967611.db2.gz MWIFJAWYWRUOKB-HNNXBMFYSA-N 1 2 306.413 4.108 20 0 DIADLO COc1ccnc(Cl)c1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001232153524 1053976343 /nfs/dbraw/zinc/97/63/43/1053976343.db2.gz PVQAKMWBCPWBAR-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccnc(Cl)c1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001232153524 1053976359 /nfs/dbraw/zinc/97/63/59/1053976359.db2.gz PVQAKMWBCPWBAR-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Fc1ccc(C2CC[NH+](Cc3nc(Cl)ccc3F)CC2)cc1 ZINC001232159584 1053976889 /nfs/dbraw/zinc/97/68/89/1053976889.db2.gz RYEFUAMOFVFDNS-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Cn1cc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)c(C2CC2)n1 ZINC001232167649 1053979656 /nfs/dbraw/zinc/97/96/56/1053979656.db2.gz KIMYMSADKNIQEC-UHFFFAOYSA-N 1 2 324.255 4.236 20 0 DIADLO Cn1cc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)c(C2CC2)n1 ZINC001232167649 1053979661 /nfs/dbraw/zinc/97/96/61/1053979661.db2.gz KIMYMSADKNIQEC-UHFFFAOYSA-N 1 2 324.255 4.236 20 0 DIADLO Cc1cc(CNC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)cc(C)[nH+]1 ZINC001436878947 1053982622 /nfs/dbraw/zinc/98/26/22/1053982622.db2.gz DUNTWLUVZZERHL-WOJBJXKFSA-N 1 2 322.452 4.289 20 0 DIADLO Cc1scnc1C[NH+]1CCC(Oc2cccc(Cl)c2)CC1 ZINC001232204040 1053987485 /nfs/dbraw/zinc/98/74/85/1053987485.db2.gz OUEJYCFVTSHQCU-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO CC[C@@]1(C)CC(=O)N(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)C1 ZINC001329441990 1053990136 /nfs/dbraw/zinc/99/01/36/1053990136.db2.gz CZZACRJQEYKXDC-WMZOPIPTSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@@]1(C)CC(=O)N(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)C1 ZINC001329441990 1053990148 /nfs/dbraw/zinc/99/01/48/1053990148.db2.gz CZZACRJQEYKXDC-WMZOPIPTSA-N 1 2 320.864 4.083 20 0 DIADLO Cc1scnc1C[N@@H+]1CCc2cc(C(F)(F)F)ccc2C1 ZINC001232212353 1053990796 /nfs/dbraw/zinc/99/07/96/1053990796.db2.gz NMIOGPJDCDTUSX-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1scnc1C[N@H+]1CCc2cc(C(F)(F)F)ccc2C1 ZINC001232212353 1053990807 /nfs/dbraw/zinc/99/08/07/1053990807.db2.gz NMIOGPJDCDTUSX-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccnc(C(F)(F)F)c2)cn1 ZINC001232240979 1054001441 /nfs/dbraw/zinc/00/14/41/1054001441.db2.gz YIWZRWZBGMIAJC-OAHLLOKOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccnc(C(F)(F)F)c2)cn1 ZINC001232240979 1054001453 /nfs/dbraw/zinc/00/14/53/1054001453.db2.gz YIWZRWZBGMIAJC-OAHLLOKOSA-N 1 2 321.346 4.141 20 0 DIADLO FC(F)[C@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1ccc(Br)cc1 ZINC000621764735 1054011183 /nfs/dbraw/zinc/01/11/83/1054011183.db2.gz LNQWCGXHZZWGTD-LYIQGSDWSA-N 1 2 316.189 4.143 20 0 DIADLO Cc1sc(C[NH+]2CCC(F)(F)CC2)cc1Br ZINC001232290307 1054018002 /nfs/dbraw/zinc/01/80/02/1054018002.db2.gz UIMWCDNVSKVZBR-UHFFFAOYSA-N 1 2 310.207 4.050 20 0 DIADLO COCc1ccc(C[N@H+](C)Cc2csc(C(C)C)n2)cc1 ZINC001232301458 1054017007 /nfs/dbraw/zinc/01/70/07/1054017007.db2.gz CMZZDYXZVHSPGQ-UHFFFAOYSA-N 1 2 304.459 4.045 20 0 DIADLO COCc1ccc(C[N@@H+](C)Cc2csc(C(C)C)n2)cc1 ZINC001232301458 1054017021 /nfs/dbraw/zinc/01/70/21/1054017021.db2.gz CMZZDYXZVHSPGQ-UHFFFAOYSA-N 1 2 304.459 4.045 20 0 DIADLO Fc1c(Cl)cccc1C[NH2+]Cc1c(Cl)cncc1Cl ZINC001200830864 1054017403 /nfs/dbraw/zinc/01/74/03/1054017403.db2.gz ROGHGXZGTUGNPR-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nccc(C)c2Br)c(C)o1 ZINC001330600172 1054042458 /nfs/dbraw/zinc/04/24/58/1054042458.db2.gz BTAZXUZVXXRKOQ-LLVKDONJSA-N 1 2 323.234 4.213 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCCC[C@H]2c2cccnc2)o1 ZINC001232444245 1054046776 /nfs/dbraw/zinc/04/67/76/1054046776.db2.gz SBADGKXQISCHMO-AWEZNQCLSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCCC[C@H]2c2cccnc2)o1 ZINC001232444245 1054046783 /nfs/dbraw/zinc/04/67/83/1054046783.db2.gz SBADGKXQISCHMO-AWEZNQCLSA-N 1 2 310.319 4.421 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(C(F)(F)F)o2)cn1 ZINC001232446243 1054047579 /nfs/dbraw/zinc/04/75/79/1054047579.db2.gz JQDHSRCVEBADLK-AWEZNQCLSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(C(F)(F)F)o2)cn1 ZINC001232446243 1054047592 /nfs/dbraw/zinc/04/75/92/1054047592.db2.gz JQDHSRCVEBADLK-AWEZNQCLSA-N 1 2 310.319 4.339 20 0 DIADLO Clc1ccnc2[nH]cc(C[N@@H+]3CCC[C@@H]3c3nccs3)c21 ZINC001232463407 1054048329 /nfs/dbraw/zinc/04/83/29/1054048329.db2.gz JPANXUYGKXBLIP-GFCCVEGCSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1ccnc2[nH]cc(C[N@H+]3CCC[C@@H]3c3nccs3)c21 ZINC001232463407 1054048343 /nfs/dbraw/zinc/04/83/43/1054048343.db2.gz JPANXUYGKXBLIP-GFCCVEGCSA-N 1 2 318.833 4.010 20 0 DIADLO Nc1ccc(F)cc1C[N@@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001232512202 1054061825 /nfs/dbraw/zinc/06/18/25/1054061825.db2.gz YLLHYSXHHVJONG-INIZCTEOSA-N 1 2 306.331 4.023 20 0 DIADLO Nc1ccc(F)cc1C[N@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001232512202 1054061835 /nfs/dbraw/zinc/06/18/35/1054061835.db2.gz YLLHYSXHHVJONG-INIZCTEOSA-N 1 2 306.331 4.023 20 0 DIADLO FCc1cccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)n1 ZINC001232537177 1054067823 /nfs/dbraw/zinc/06/78/23/1054067823.db2.gz BCMDAPQCQOPNEP-MRXNPFEDSA-N 1 2 306.331 4.166 20 0 DIADLO FCc1cccc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)n1 ZINC001232537177 1054067832 /nfs/dbraw/zinc/06/78/32/1054067832.db2.gz BCMDAPQCQOPNEP-MRXNPFEDSA-N 1 2 306.331 4.166 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2cc(F)cc(F)c2)o1 ZINC000165269922 1054073208 /nfs/dbraw/zinc/07/32/08/1054073208.db2.gz CKZFVMWVMKAQHD-MEDUHNTESA-N 1 2 309.356 4.159 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2cc(C)ccc2OC)o1 ZINC000165253108 1054073752 /nfs/dbraw/zinc/07/37/52/1054073752.db2.gz HODBNSMCYKIUAQ-YOEHRIQHSA-N 1 2 317.429 4.197 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2cc(C)c(F)c(C)c2)cs1 ZINC000165281295 1054074012 /nfs/dbraw/zinc/07/40/12/1054074012.db2.gz FYWYNGHUGCCSJB-CHWSQXEVSA-N 1 2 322.449 4.457 20 0 DIADLO COc1cccc(C)c1C[N@H+](C)Cc1nc2ccccc2s1 ZINC001232621182 1054086676 /nfs/dbraw/zinc/08/66/76/1054086676.db2.gz YQVGHWDCOMEKDB-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO COc1cccc(C)c1C[N@@H+](C)Cc1nc2ccccc2s1 ZINC001232621182 1054086682 /nfs/dbraw/zinc/08/66/82/1054086682.db2.gz YQVGHWDCOMEKDB-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO F[C@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ncccc1C(F)(F)F ZINC001331933066 1054101313 /nfs/dbraw/zinc/10/13/13/1054101313.db2.gz LTLUZKFUIOGAJT-GOEBONIOSA-N 1 2 324.321 4.216 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(F)c(Cl)cc2Cl)CCCO1 ZINC001232700465 1054104029 /nfs/dbraw/zinc/10/40/29/1054104029.db2.gz KFNDRSMEDDVPLL-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(F)c(Cl)cc2Cl)CCCO1 ZINC001232700465 1054104034 /nfs/dbraw/zinc/10/40/34/1054104034.db2.gz KFNDRSMEDDVPLL-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2Cl)[C@H](C)C1 ZINC001232704224 1054104329 /nfs/dbraw/zinc/10/43/29/1054104329.db2.gz WGSKVHKTGJTGBF-MWLCHTKSSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2Cl)[C@H](C)C1 ZINC001232704224 1054104335 /nfs/dbraw/zinc/10/43/35/1054104335.db2.gz WGSKVHKTGJTGBF-MWLCHTKSSA-N 1 2 306.208 4.132 20 0 DIADLO Fc1cc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c(Cl)cc1Cl ZINC001232700820 1054105261 /nfs/dbraw/zinc/10/52/61/1054105261.db2.gz QZUJZSOFHSTJHJ-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1cc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c(Cl)cc1Cl ZINC001232700820 1054105266 /nfs/dbraw/zinc/10/52/66/1054105266.db2.gz QZUJZSOFHSTJHJ-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO O=C1CC[N@@H+](Cc2cc3ccc(Cl)cc3[nH]2)[C@H]2CCCC[C@H]12 ZINC001232726724 1054108098 /nfs/dbraw/zinc/10/80/98/1054108098.db2.gz JOENYJCSFCBINC-RDJZCZTQSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2cc3ccc(Cl)cc3[nH]2)[C@H]2CCCC[C@H]12 ZINC001232726724 1054108113 /nfs/dbraw/zinc/10/81/13/1054108113.db2.gz JOENYJCSFCBINC-RDJZCZTQSA-N 1 2 316.832 4.155 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cc3ccc(Cl)cc3[nH]1)C2 ZINC001232732518 1054109591 /nfs/dbraw/zinc/10/95/91/1054109591.db2.gz UYAKRMIPXYXHAB-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cc3ccc(Cl)cc3[nH]1)C2 ZINC001232732518 1054109598 /nfs/dbraw/zinc/10/95/98/1054109598.db2.gz UYAKRMIPXYXHAB-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1c(C)c[nH+]c(CSC2CC(CF)(CF)C2)c1C ZINC001332269406 1054113405 /nfs/dbraw/zinc/11/34/05/1054113405.db2.gz ITCFVQJXAQEPBU-UHFFFAOYSA-N 1 2 301.402 4.028 20 0 DIADLO CCCn1cnc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)c1 ZINC001232799358 1054121418 /nfs/dbraw/zinc/12/14/18/1054121418.db2.gz HPXJHHYBGVOAFW-KRWDZBQOSA-N 1 2 303.837 4.284 20 0 DIADLO CCCn1cnc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)c1 ZINC001232799358 1054121424 /nfs/dbraw/zinc/12/14/24/1054121424.db2.gz HPXJHHYBGVOAFW-KRWDZBQOSA-N 1 2 303.837 4.284 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cccc(O)c1Cl ZINC001232788559 1054121471 /nfs/dbraw/zinc/12/14/71/1054121471.db2.gz CFYOBWFGNWPZEB-GFCCVEGCSA-N 1 2 305.805 4.247 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1cccc(O)c1Cl ZINC001232788559 1054121472 /nfs/dbraw/zinc/12/14/72/1054121472.db2.gz CFYOBWFGNWPZEB-GFCCVEGCSA-N 1 2 305.805 4.247 20 0 DIADLO CCCn1cnc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)c1 ZINC001232799029 1054122087 /nfs/dbraw/zinc/12/20/87/1054122087.db2.gz UHQYHACOCLHKCP-QGZVFWFLSA-N 1 2 303.837 4.284 20 0 DIADLO CCCn1cnc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)c1 ZINC001232799029 1054122099 /nfs/dbraw/zinc/12/20/99/1054122099.db2.gz UHQYHACOCLHKCP-QGZVFWFLSA-N 1 2 303.837 4.284 20 0 DIADLO Oc1cccc(C[N@@H+]2CCSc3ccccc3C2)c1Cl ZINC001232789529 1054122659 /nfs/dbraw/zinc/12/26/59/1054122659.db2.gz LMMGCXIHXIEFMU-UHFFFAOYSA-N 1 2 305.830 4.154 20 0 DIADLO Oc1cccc(C[N@H+]2CCSc3ccccc3C2)c1Cl ZINC001232789529 1054122661 /nfs/dbraw/zinc/12/26/61/1054122661.db2.gz LMMGCXIHXIEFMU-UHFFFAOYSA-N 1 2 305.830 4.154 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2ccc(-c3cccc(F)c3)nc2)C[C@@H]1F ZINC001232884375 1054138109 /nfs/dbraw/zinc/13/81/09/1054138109.db2.gz FVLMCUOSKYPRGE-ROUUACIJSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2ccc(-c3cccc(F)c3)nc2)C[C@@H]1F ZINC001232884375 1054138112 /nfs/dbraw/zinc/13/81/12/1054138112.db2.gz FVLMCUOSKYPRGE-ROUUACIJSA-N 1 2 320.358 4.160 20 0 DIADLO CCCC[N@H+](CCC)Cc1nc(C)sc1Br ZINC001233157545 1054191302 /nfs/dbraw/zinc/19/13/02/1054191302.db2.gz WAWXFJKFCVGAKS-UHFFFAOYSA-N 1 2 305.285 4.226 20 0 DIADLO CCCC[N@@H+](CCC)Cc1nc(C)sc1Br ZINC001233157545 1054191306 /nfs/dbraw/zinc/19/13/06/1054191306.db2.gz WAWXFJKFCVGAKS-UHFFFAOYSA-N 1 2 305.285 4.226 20 0 DIADLO Fc1cc(OCc2ccccc2)ccc1C[NH+]1CC(C(F)F)C1 ZINC001232922385 1054149134 /nfs/dbraw/zinc/14/91/34/1054149134.db2.gz KCUJQGSPZRMKSJ-UHFFFAOYSA-N 1 2 321.342 4.102 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc(F)c(O)c1F ZINC001232933559 1054149550 /nfs/dbraw/zinc/14/95/50/1054149550.db2.gz LCABXTIMMDWIJJ-MRXNPFEDSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(F)c(O)c2F)c1 ZINC001232930920 1054150575 /nfs/dbraw/zinc/15/05/75/1054150575.db2.gz GRPOBKCVLIRXES-MRXNPFEDSA-N 1 2 303.352 4.316 20 0 DIADLO CC1=C(C)C[C@](C)(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)CC1 ZINC001355482088 1054151786 /nfs/dbraw/zinc/15/17/86/1054151786.db2.gz JAXDDTQTWNGKDZ-LJQANCHMSA-N 1 2 309.413 4.337 20 0 DIADLO Cc1ncsc1CNc1[nH+]c2ccccc2n1C(C)(C)C ZINC001333556680 1054158243 /nfs/dbraw/zinc/15/82/43/1054158243.db2.gz HKINCSMOJKMXAD-UHFFFAOYSA-N 1 2 300.431 4.168 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(Cl)cnc1Br ZINC001232960560 1054158703 /nfs/dbraw/zinc/15/87/03/1054158703.db2.gz ZQQBOZCMUWWCQK-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cc(Cl)cnc1Br ZINC001232960560 1054158711 /nfs/dbraw/zinc/15/87/11/1054158711.db2.gz ZQQBOZCMUWWCQK-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO COc1ccsc1CNc1[nH+]c2ccccc2n1C(C)(C)C ZINC001333558384 1054159686 /nfs/dbraw/zinc/15/96/86/1054159686.db2.gz XYJKXNQYJWIUGZ-UHFFFAOYSA-N 1 2 315.442 4.474 20 0 DIADLO Oc1cc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)cc(F)c1F ZINC001232973288 1054161102 /nfs/dbraw/zinc/16/11/02/1054161102.db2.gz SDEQFTUCZBADKV-CYBMUJFWSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)cc(F)c1F ZINC001232973288 1054161110 /nfs/dbraw/zinc/16/11/10/1054161110.db2.gz SDEQFTUCZBADKV-CYBMUJFWSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)cc(F)c1F ZINC001232970191 1054161367 /nfs/dbraw/zinc/16/13/67/1054161367.db2.gz BBJKKCPDAQETJY-HNNXBMFYSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)cc(F)c1F ZINC001232970191 1054161378 /nfs/dbraw/zinc/16/13/78/1054161378.db2.gz BBJKKCPDAQETJY-HNNXBMFYSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)cc(F)c1F ZINC001232973127 1054161603 /nfs/dbraw/zinc/16/16/03/1054161603.db2.gz NWZQECLVXKSTQW-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(C[N@H+]2CC[C@H](c3ccccc3Cl)C2)cc(F)c1F ZINC001232973127 1054161621 /nfs/dbraw/zinc/16/16/21/1054161621.db2.gz NWZQECLVXKSTQW-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2nc(C)sc2C)cc1F ZINC001333617202 1054164636 /nfs/dbraw/zinc/16/46/36/1054164636.db2.gz UKDONPCCDPNDHA-MRXNPFEDSA-N 1 2 320.433 4.245 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2nc(C)sc2C)cc1F ZINC001333617202 1054164642 /nfs/dbraw/zinc/16/46/42/1054164642.db2.gz UKDONPCCDPNDHA-MRXNPFEDSA-N 1 2 320.433 4.245 20 0 DIADLO Cc1ncc(F)cc1C[N@H+](Cc1ccccc1)Cc1ccncc1 ZINC001232986800 1054164988 /nfs/dbraw/zinc/16/49/88/1054164988.db2.gz SQEXQQHHMHKBCL-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ncc(F)cc1C[N@@H+](Cc1ccccc1)Cc1ccncc1 ZINC001232986800 1054164996 /nfs/dbraw/zinc/16/49/96/1054164996.db2.gz SQEXQQHHMHKBCL-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ncc(F)cc1C[N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001232991516 1054169062 /nfs/dbraw/zinc/16/90/62/1054169062.db2.gz CNUGEWGKBISOFQ-QGZVFWFLSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1ncc(F)cc1C[N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001232991516 1054169068 /nfs/dbraw/zinc/16/90/68/1054169068.db2.gz CNUGEWGKBISOFQ-QGZVFWFLSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1C[C@@H](C)O[C@@H](CC(F)(F)F)C1 ZINC001333741715 1054170558 /nfs/dbraw/zinc/17/05/58/1054170558.db2.gz TVSQGMSPEPWGQB-OLZOCXBDSA-N 1 2 324.346 4.089 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)cn1 ZINC001233009046 1054171222 /nfs/dbraw/zinc/17/12/22/1054171222.db2.gz ZYSULBBTVUNETB-OAQYLSRUSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)cn1 ZINC001233009046 1054171225 /nfs/dbraw/zinc/17/12/25/1054171225.db2.gz ZYSULBBTVUNETB-OAQYLSRUSA-N 1 2 317.436 4.105 20 0 DIADLO Cc1cc(C)c(C[N@H+](C)Cc2ccccc2Br)cn1 ZINC001233008824 1054171817 /nfs/dbraw/zinc/17/18/17/1054171817.db2.gz TXRJLXQOZMWELC-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cc(C)c(C[N@@H+](C)Cc2ccccc2Br)cn1 ZINC001233008824 1054171834 /nfs/dbraw/zinc/17/18/34/1054171834.db2.gz TXRJLXQOZMWELC-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1ccc(Cl)c(Br)n1 ZINC001233093773 1054185509 /nfs/dbraw/zinc/18/55/09/1054185509.db2.gz YXBUMFJHGYJBAU-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1ccc(Cl)c(Br)n1 ZINC001233093773 1054185514 /nfs/dbraw/zinc/18/55/14/1054185514.db2.gz YXBUMFJHGYJBAU-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO CCOC(=O)c1ccsc1C[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC001233017924 1054174235 /nfs/dbraw/zinc/17/42/35/1054174235.db2.gz LWYGTYLMOLTIAA-CYBMUJFWSA-N 1 2 315.438 4.044 20 0 DIADLO CCOC(=O)c1ccsc1C[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC001233017924 1054174242 /nfs/dbraw/zinc/17/42/42/1054174242.db2.gz LWYGTYLMOLTIAA-CYBMUJFWSA-N 1 2 315.438 4.044 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1ccon1 ZINC000671191448 1054180101 /nfs/dbraw/zinc/18/01/01/1054180101.db2.gz RQJNHKARDPZGRR-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1cccc(F)c1)c1cnccn1 ZINC000168544148 1054180510 /nfs/dbraw/zinc/18/05/10/1054180510.db2.gz YPVIRQBPUAJLEQ-KUHUBIRLSA-N 1 2 307.372 4.056 20 0 DIADLO CC1(C)CC[NH+](Cc2ccc(Cl)c(Br)n2)CC1 ZINC001233092663 1054186430 /nfs/dbraw/zinc/18/64/30/1054186430.db2.gz RQKYFADABHPWGI-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO CC[N@H+](Cc1nc(C)sc1Br)C1CCCCC1 ZINC001233150302 1054191377 /nfs/dbraw/zinc/19/13/77/1054191377.db2.gz GAJGYPMRACWCRV-UHFFFAOYSA-N 1 2 317.296 4.369 20 0 DIADLO CC[N@@H+](Cc1nc(C)sc1Br)C1CCCCC1 ZINC001233150302 1054191379 /nfs/dbraw/zinc/19/13/79/1054191379.db2.gz GAJGYPMRACWCRV-UHFFFAOYSA-N 1 2 317.296 4.369 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)cnc1C ZINC001233162021 1054193774 /nfs/dbraw/zinc/19/37/74/1054193774.db2.gz OKKPWKSTHMBRCD-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)cnc1C ZINC001233162021 1054193784 /nfs/dbraw/zinc/19/37/84/1054193784.db2.gz OKKPWKSTHMBRCD-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO CCOc1ncc(Cl)cc1C[N@H+](C)C/C=C/c1ccccc1 ZINC001233173625 1054196338 /nfs/dbraw/zinc/19/63/38/1054196338.db2.gz YKPOISUBAXGUFH-JXMROGBWSA-N 1 2 316.832 4.279 20 0 DIADLO CCOc1ncc(Cl)cc1C[N@@H+](C)C/C=C/c1ccccc1 ZINC001233173625 1054196344 /nfs/dbraw/zinc/19/63/44/1054196344.db2.gz YKPOISUBAXGUFH-JXMROGBWSA-N 1 2 316.832 4.279 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1CCc2nc(C(C)C)ncc2C1 ZINC001334856932 1054202925 /nfs/dbraw/zinc/20/29/25/1054202925.db2.gz CJGCRUOXZOHVAG-UHFFFAOYSA-N 1 2 318.424 4.019 20 0 DIADLO CCc1nnc(C[N@@H+]2C[C@H]3CCCC[C@]32c2ccccc2)s1 ZINC001334885415 1054204194 /nfs/dbraw/zinc/20/41/94/1054204194.db2.gz ODLFRLCJAJZQNC-QAPCUYQASA-N 1 2 313.470 4.002 20 0 DIADLO CCc1nnc(C[N@H+]2C[C@H]3CCCC[C@]32c2ccccc2)s1 ZINC001334885415 1054204204 /nfs/dbraw/zinc/20/42/04/1054204204.db2.gz ODLFRLCJAJZQNC-QAPCUYQASA-N 1 2 313.470 4.002 20 0 DIADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2csc(-c3ccc(F)cc3)n2)C1 ZINC001233240677 1054212928 /nfs/dbraw/zinc/21/29/28/1054212928.db2.gz KNNBJPOBLGKLNA-NHYWBVRUSA-N 1 2 308.397 4.129 20 0 DIADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2csc(-c3ccc(F)cc3)n2)C1 ZINC001233240677 1054212937 /nfs/dbraw/zinc/21/29/37/1054212937.db2.gz KNNBJPOBLGKLNA-NHYWBVRUSA-N 1 2 308.397 4.129 20 0 DIADLO COc1c(O)cccc1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001233256559 1054216180 /nfs/dbraw/zinc/21/61/80/1054216180.db2.gz JBRXUDXOLUGRQU-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO COc1c(O)cccc1C[N@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001233256559 1054216192 /nfs/dbraw/zinc/21/61/92/1054216192.db2.gz JBRXUDXOLUGRQU-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ccncc2)sn1 ZINC001233310084 1054226239 /nfs/dbraw/zinc/22/62/39/1054226239.db2.gz PXTBFOPSSFCQEP-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2ccncc2)sn1 ZINC001233310084 1054226247 /nfs/dbraw/zinc/22/62/47/1054226247.db2.gz PXTBFOPSSFCQEP-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cc(Cl)cc(Cl)c2)sn1 ZINC001233313903 1054229420 /nfs/dbraw/zinc/22/94/20/1054229420.db2.gz ULVRHIVZTRHBBE-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cc(Cl)cc(Cl)c2)sn1 ZINC001233313903 1054229435 /nfs/dbraw/zinc/22/94/35/1054229435.db2.gz ULVRHIVZTRHBBE-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1cnsc1C[N@@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001233321161 1054231268 /nfs/dbraw/zinc/23/12/68/1054231268.db2.gz CGYPJPATUVPMDR-CQSZACIVSA-N 1 2 324.902 4.395 20 0 DIADLO Cc1cnsc1C[N@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001233321161 1054231273 /nfs/dbraw/zinc/23/12/73/1054231273.db2.gz CGYPJPATUVPMDR-CQSZACIVSA-N 1 2 324.902 4.395 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(Br)ncc2Cl)[C@@H](C)C1 ZINC001233428151 1054270183 /nfs/dbraw/zinc/27/01/83/1054270183.db2.gz ZMGIVKJBSDCQAZ-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(Br)ncc2Cl)[C@@H](C)C1 ZINC001233428151 1054270192 /nfs/dbraw/zinc/27/01/92/1054270192.db2.gz ZMGIVKJBSDCQAZ-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO COc1cc(F)c(C[N@H+](C)Cc2cccc(Cl)c2)cc1F ZINC001233342889 1054237321 /nfs/dbraw/zinc/23/73/21/1054237321.db2.gz RQKHBRSJFFQIIF-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(F)c(C[N@@H+](C)Cc2cccc(Cl)c2)cc1F ZINC001233342889 1054237336 /nfs/dbraw/zinc/23/73/36/1054237336.db2.gz RQKHBRSJFFQIIF-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1F ZINC001233340939 1054238246 /nfs/dbraw/zinc/23/82/46/1054238246.db2.gz WZIWMYGASXCAEA-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1F ZINC001233340939 1054238254 /nfs/dbraw/zinc/23/82/54/1054238254.db2.gz WZIWMYGASXCAEA-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)Nc1[nH+]cccc1OC(C)C ZINC001336741768 1054245108 /nfs/dbraw/zinc/24/51/08/1054245108.db2.gz CKOTZTXAIBAEFJ-ASSNKEHSSA-N 1 2 314.366 4.004 20 0 DIADLO FC1(F)CC[C@@H](C[N@@H+]2CCO[C@@H](c3ccc(Cl)s3)C2)C1 ZINC001336756923 1054245379 /nfs/dbraw/zinc/24/53/79/1054245379.db2.gz NTVUXQFRDOGSJE-GHMZBOCLSA-N 1 2 321.820 4.210 20 0 DIADLO FC1(F)CC[C@@H](C[N@H+]2CCO[C@@H](c3ccc(Cl)s3)C2)C1 ZINC001336756923 1054245385 /nfs/dbraw/zinc/24/53/85/1054245385.db2.gz NTVUXQFRDOGSJE-GHMZBOCLSA-N 1 2 321.820 4.210 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+]1CCc2c(O)cccc2C1 ZINC001233350468 1054245447 /nfs/dbraw/zinc/24/54/47/1054245447.db2.gz INYGDAGAIBAUSV-UHFFFAOYSA-N 1 2 319.857 4.326 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+]1CCc2c(O)cccc2C1 ZINC001233350468 1054245463 /nfs/dbraw/zinc/24/54/63/1054245463.db2.gz INYGDAGAIBAUSV-UHFFFAOYSA-N 1 2 319.857 4.326 20 0 DIADLO CCO[P@@](C)(=O)CC[C@@H](C)Nc1[nH+]cccc1OC(C)C ZINC001336741769 1054245485 /nfs/dbraw/zinc/24/54/85/1054245485.db2.gz CKOTZTXAIBAEFJ-LRTDBIEQSA-N 1 2 314.366 4.004 20 0 DIADLO Fc1cc2c(cc1F)C[N@H+](Cc1cc3cccnc3s1)CC2 ZINC001233350057 1054245565 /nfs/dbraw/zinc/24/55/65/1054245565.db2.gz SQYXOCQPYLBLJC-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO Fc1cc2c(cc1F)C[N@@H+](Cc1cc3cccnc3s1)CC2 ZINC001233350057 1054245572 /nfs/dbraw/zinc/24/55/72/1054245572.db2.gz SQYXOCQPYLBLJC-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+]1CCC[C@H]1c1cnccn1 ZINC001233352431 1054245598 /nfs/dbraw/zinc/24/55/98/1054245598.db2.gz FDZBATJATUFCEP-HNNXBMFYSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+]1CCC[C@H]1c1cnccn1 ZINC001233352431 1054245606 /nfs/dbraw/zinc/24/56/06/1054245606.db2.gz FDZBATJATUFCEP-HNNXBMFYSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+]1CCC(=O)[C@@H]2CCCC[C@H]21 ZINC001233350934 1054245948 /nfs/dbraw/zinc/24/59/48/1054245948.db2.gz ZTSFSABWZKNMTD-IUODEOHRSA-N 1 2 323.889 4.396 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+]1CCC(=O)[C@@H]2CCCC[C@H]21 ZINC001233350934 1054245956 /nfs/dbraw/zinc/24/59/56/1054245956.db2.gz ZTSFSABWZKNMTD-IUODEOHRSA-N 1 2 323.889 4.396 20 0 DIADLO CC[C@H]([NH2+]Cc1ncoc1C(C)C)c1cccc(OC)c1OC ZINC001336807015 1054246229 /nfs/dbraw/zinc/24/62/29/1054246229.db2.gz DDQFKRLCOIQBDP-AWEZNQCLSA-N 1 2 318.417 4.056 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+](C)Cc1cccc(O)c1 ZINC001233350363 1054246324 /nfs/dbraw/zinc/24/63/24/1054246324.db2.gz DXMUGMSOOPXPKV-UHFFFAOYSA-N 1 2 307.846 4.400 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+](C)Cc1cccc(O)c1 ZINC001233350363 1054246335 /nfs/dbraw/zinc/24/63/35/1054246335.db2.gz DXMUGMSOOPXPKV-UHFFFAOYSA-N 1 2 307.846 4.400 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+]1CCc2cccnc2C1 ZINC001233353532 1054247862 /nfs/dbraw/zinc/24/78/62/1054247862.db2.gz ZMENEGLJEXNMLD-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+]1CCc2cccnc2C1 ZINC001233353532 1054247867 /nfs/dbraw/zinc/24/78/67/1054247867.db2.gz ZMENEGLJEXNMLD-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)CSc1ccc2ccccc2c1 ZINC001439223950 1054250210 /nfs/dbraw/zinc/25/02/10/1054250210.db2.gz LHXHIVMROCXAFV-UHFFFAOYSA-N 1 2 322.433 4.004 20 0 DIADLO Nc1ccc(C[N@@H+]2CCc3c(Cl)cccc3C2)c(Cl)c1 ZINC001233376383 1054252051 /nfs/dbraw/zinc/25/20/51/1054252051.db2.gz GPVNPIMBXNVNLQ-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1ccc(C[N@H+]2CCc3c(Cl)cccc3C2)c(Cl)c1 ZINC001233376383 1054252063 /nfs/dbraw/zinc/25/20/63/1054252063.db2.gz GPVNPIMBXNVNLQ-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1ccc(N)cc1Cl ZINC001233376348 1054253454 /nfs/dbraw/zinc/25/34/54/1054253454.db2.gz DSOGLLKVUVQNAM-UHFFFAOYSA-N 1 2 316.832 4.016 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1ccc(N)cc1Cl ZINC001233376348 1054253460 /nfs/dbraw/zinc/25/34/60/1054253460.db2.gz DSOGLLKVUVQNAM-UHFFFAOYSA-N 1 2 316.832 4.016 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)c1F ZINC001233395641 1054258562 /nfs/dbraw/zinc/25/85/62/1054258562.db2.gz HGLGYUGXBCJLNB-NSHDSACASA-N 1 2 323.770 4.313 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CCCC[C@H]2c2ccccc2)c1F ZINC001233393464 1054259889 /nfs/dbraw/zinc/25/98/89/1054259889.db2.gz WDMKNEDSDGJLEI-INIZCTEOSA-N 1 2 303.352 4.398 20 0 DIADLO COc1cc(F)c([C@@H](C)Nc2ccc(C)[nH+]c2C)cc1OC ZINC001337320398 1054263185 /nfs/dbraw/zinc/26/31/85/1054263185.db2.gz HQADGCJUCJPJBO-LLVKDONJSA-N 1 2 304.365 4.028 20 0 DIADLO Clc1cccn2cc(C[N@H+]3CC=C(c4ccccc4)CC3)nc12 ZINC001233423825 1054265841 /nfs/dbraw/zinc/26/58/41/1054265841.db2.gz NEJAITOUYDUHMH-UHFFFAOYSA-N 1 2 323.827 4.277 20 0 DIADLO Clc1cccn2cc(C[N@@H+]3CC=C(c4ccccc4)CC3)nc12 ZINC001233423825 1054265851 /nfs/dbraw/zinc/26/58/51/1054265851.db2.gz NEJAITOUYDUHMH-UHFFFAOYSA-N 1 2 323.827 4.277 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2csc(Br)c2)C1 ZINC001233412523 1054268568 /nfs/dbraw/zinc/26/85/68/1054268568.db2.gz GWMJUCAGUNQTAA-LBPRGKRZSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2csc(Br)c2)C1 ZINC001233412523 1054268577 /nfs/dbraw/zinc/26/85/77/1054268577.db2.gz GWMJUCAGUNQTAA-LBPRGKRZSA-N 1 2 306.244 4.225 20 0 DIADLO C[N@H+](Cc1ccn(C(=O)OC(C)(C)C)c1)Cc1ccccc1F ZINC001233431680 1054269881 /nfs/dbraw/zinc/26/98/81/1054269881.db2.gz IAEJJTUTROOMJI-UHFFFAOYSA-N 1 2 318.392 4.042 20 0 DIADLO C[N@@H+](Cc1ccn(C(=O)OC(C)(C)C)c1)Cc1ccccc1F ZINC001233431680 1054269890 /nfs/dbraw/zinc/26/98/90/1054269890.db2.gz IAEJJTUTROOMJI-UHFFFAOYSA-N 1 2 318.392 4.042 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1ncoc1C(C)C)[C@H]2C ZINC001337548130 1054273053 /nfs/dbraw/zinc/27/30/53/1054273053.db2.gz DLXLGKFESDBQRW-KBPBESRZSA-N 1 2 314.429 4.314 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1ncoc1C(C)C)[C@H]2C ZINC001337548130 1054273064 /nfs/dbraw/zinc/27/30/64/1054273064.db2.gz DLXLGKFESDBQRW-KBPBESRZSA-N 1 2 314.429 4.314 20 0 DIADLO Fc1cc(Cl)c(Br)cc1C[N@H+]1C[C@H]2CC[C@@H]1C2 ZINC001233440780 1054274352 /nfs/dbraw/zinc/27/43/52/1054274352.db2.gz CEXOHVKNFKSXJF-WCBMZHEXSA-N 1 2 318.617 4.226 20 0 DIADLO Fc1cc(Cl)c(Br)cc1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC001233440780 1054274347 /nfs/dbraw/zinc/27/43/47/1054274347.db2.gz CEXOHVKNFKSXJF-WCBMZHEXSA-N 1 2 318.617 4.226 20 0 DIADLO Clc1cncc(C[NH+]2CCC(c3ccccc3Cl)CC2)n1 ZINC001233450039 1054276658 /nfs/dbraw/zinc/27/66/58/1054276658.db2.gz CROSONRJHCEUCE-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Cc1nc(Cl)c(C[N@H+]2CCCC[C@@H]2C)cc1Br ZINC001233465159 1054280487 /nfs/dbraw/zinc/28/04/87/1054280487.db2.gz WTZWXROWGWOBAC-VIFPVBQESA-N 1 2 317.658 4.180 20 0 DIADLO Cc1nc(Cl)c(C[N@@H+]2CCCC[C@@H]2C)cc1Br ZINC001233465159 1054280499 /nfs/dbraw/zinc/28/04/99/1054280499.db2.gz WTZWXROWGWOBAC-VIFPVBQESA-N 1 2 317.658 4.180 20 0 DIADLO Cn1c(Cl)ncc1C[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000848882195 1054282848 /nfs/dbraw/zinc/28/28/48/1054282848.db2.gz MQRUSGLXWCOGSV-UHFFFAOYSA-N 1 2 318.635 4.012 20 0 DIADLO Cn1c(Cl)ncc1C[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000848882195 1054282857 /nfs/dbraw/zinc/28/28/57/1054282857.db2.gz MQRUSGLXWCOGSV-UHFFFAOYSA-N 1 2 318.635 4.012 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cn3c(cccc3Cl)n2)Cc2ccccc21 ZINC001233552811 1054294886 /nfs/dbraw/zinc/29/48/86/1054294886.db2.gz ZGZOHOVNBWUWNK-CYBMUJFWSA-N 1 2 311.816 4.107 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cn3c(cccc3Cl)n2)Cc2ccccc21 ZINC001233552811 1054294899 /nfs/dbraw/zinc/29/48/99/1054294899.db2.gz ZGZOHOVNBWUWNK-CYBMUJFWSA-N 1 2 311.816 4.107 20 0 DIADLO CCC[C@@H](C)CC(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001338443095 1054305877 /nfs/dbraw/zinc/30/58/77/1054305877.db2.gz HXIKEYPJXOWASS-HZPDHXFCSA-N 1 2 319.493 4.170 20 0 DIADLO Clc1cccc2nc(C[N@H+]3CC=C(c4ccccc4)CC3)cn21 ZINC001233600555 1054307719 /nfs/dbraw/zinc/30/77/19/1054307719.db2.gz ZXWQRGGRVWPKLP-UHFFFAOYSA-N 1 2 323.827 4.277 20 0 DIADLO Clc1cccc2nc(C[N@@H+]3CC=C(c4ccccc4)CC3)cn21 ZINC001233600555 1054307722 /nfs/dbraw/zinc/30/77/22/1054307722.db2.gz ZXWQRGGRVWPKLP-UHFFFAOYSA-N 1 2 323.827 4.277 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCc1ncccc1C ZINC001338917846 1054315537 /nfs/dbraw/zinc/31/55/37/1054315537.db2.gz CLLSXEWHJLZOHQ-UHFFFAOYSA-N 1 2 309.438 4.318 20 0 DIADLO CC1(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CCCCC1 ZINC001356316063 1054317418 /nfs/dbraw/zinc/31/74/18/1054317418.db2.gz DXPOVTCMTYLBQJ-UHFFFAOYSA-N 1 2 317.820 4.435 20 0 DIADLO COc1cccc2c(C(=O)Nc3c(C)cc(C)[nH+]c3C)coc21 ZINC001356376787 1054325628 /nfs/dbraw/zinc/32/56/28/1054325628.db2.gz MANZVZVFICJZNK-UHFFFAOYSA-N 1 2 310.353 4.014 20 0 DIADLO Cc1ccccc1[C@@H]1CN(c2cc(C)c3ccccc3[nH+]2)CCO1 ZINC001339512053 1054341051 /nfs/dbraw/zinc/34/10/51/1054341051.db2.gz JQXIXNKJHSXEDZ-FQEVSTJZSA-N 1 2 318.420 4.430 20 0 DIADLO C[C@@H]([NH2+]Cc1c[nH]cn1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000171129725 1054348474 /nfs/dbraw/zinc/34/84/74/1054348474.db2.gz KFPHAJFPAOJIEA-CYBMUJFWSA-N 1 2 311.360 4.192 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc([S@](C)=O)cc2)[nH+]c2ccccc12 ZINC001341155288 1054377693 /nfs/dbraw/zinc/37/76/93/1054377693.db2.gz NFSVEDGBUGDJQW-PSLXWICFSA-N 1 2 324.449 4.454 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(F)c(F)c2)nc2ccccc12 ZINC000171982054 1054401519 /nfs/dbraw/zinc/40/15/19/1054401519.db2.gz VPUXBZYQWLHZBR-NSHDSACASA-N 1 2 313.351 4.067 20 0 DIADLO COc1cc(C)[nH+]c(CSc2ncc(Cl)cc2Cl)c1 ZINC001341850910 1054411155 /nfs/dbraw/zinc/41/11/55/1054411155.db2.gz VUCAKWNEGIEREQ-UHFFFAOYSA-N 1 2 315.225 4.393 20 0 DIADLO Cc1cc(N[C@@H](C)[C@H]2OCCc3sccc32)nc(C(C)C)[nH+]1 ZINC000488741964 1054433334 /nfs/dbraw/zinc/43/33/34/1054433334.db2.gz CPNKLISYGSTLAF-BLLLJJGKSA-N 1 2 317.458 4.084 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]Cc2cc(C(C)(C)C)oc2C)cs1 ZINC001342977130 1054434943 /nfs/dbraw/zinc/43/49/43/1054434943.db2.gz CAHKSYPIWYPKCT-LBPRGKRZSA-N 1 2 322.474 4.339 20 0 DIADLO C[N@H+](Cc1ncc(-c2ccccc2F)o1)Cc1ccc(F)cc1 ZINC000172733620 1054448785 /nfs/dbraw/zinc/44/87/85/1054448785.db2.gz PLPLRMAUTXPNOD-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1ncc(-c2ccccc2F)o1)Cc1ccc(F)cc1 ZINC000172733620 1054448790 /nfs/dbraw/zinc/44/87/90/1054448790.db2.gz PLPLRMAUTXPNOD-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO FC(F)C[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000671249006 1054461024 /nfs/dbraw/zinc/46/10/24/1054461024.db2.gz ODKJGSQSAZSDHU-CQSZACIVSA-N 1 2 323.305 4.028 20 0 DIADLO CC(C)CC[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C(C)(C)C ZINC001444081811 1054468502 /nfs/dbraw/zinc/46/85/02/1054468502.db2.gz HEXPJEJYDOZAJL-MRXNPFEDSA-N 1 2 301.434 4.144 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ncc(Cl)n1C ZINC000194984986 1054472441 /nfs/dbraw/zinc/47/24/41/1054472441.db2.gz ZHXBTWXYZJBXDX-CYBMUJFWSA-N 1 2 312.244 4.310 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ncc(Cl)n1C ZINC000194984986 1054472454 /nfs/dbraw/zinc/47/24/54/1054472454.db2.gz ZHXBTWXYZJBXDX-CYBMUJFWSA-N 1 2 312.244 4.310 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@@H]1CCC[C@@H]2CCCC[C@@H]12 ZINC001357549325 1054497902 /nfs/dbraw/zinc/49/79/02/1054497902.db2.gz DPQRHVOERJBWHR-KFKAGJAMSA-N 1 2 323.440 4.417 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)Cc2c(C)cccc2C)cs1 ZINC000174007431 1054500814 /nfs/dbraw/zinc/50/08/14/1054500814.db2.gz JPTASOFFXUHSTE-OAHLLOKOSA-N 1 2 318.486 4.489 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)Cc2c(C)cccc2C)cs1 ZINC000174007431 1054500833 /nfs/dbraw/zinc/50/08/33/1054500833.db2.gz JPTASOFFXUHSTE-OAHLLOKOSA-N 1 2 318.486 4.489 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000174566733 1054512464 /nfs/dbraw/zinc/51/24/64/1054512464.db2.gz JPTHQVCADJXPPC-DYEKYZERSA-N 1 2 303.377 4.402 20 0 DIADLO CCCc1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000174663673 1054515336 /nfs/dbraw/zinc/51/53/36/1054515336.db2.gz CTAGPXCRDUVDJS-ZDUSSCGKSA-N 1 2 301.434 4.170 20 0 DIADLO Cc1cc(N2CCC3(CC2)C(F)(F)C3(F)F)[nH+]c2ccccc12 ZINC001346182130 1054530100 /nfs/dbraw/zinc/53/01/00/1054530100.db2.gz MRQBUSCRDVLRDX-UHFFFAOYSA-N 1 2 324.321 4.414 20 0 DIADLO CC[N@H+](CCC(F)(F)F)CC(=O)Nc1cccc2ccccc21 ZINC000623121979 1054534079 /nfs/dbraw/zinc/53/40/79/1054534079.db2.gz YGCFYESTVITYHF-UHFFFAOYSA-N 1 2 324.346 4.053 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)CC(=O)Nc1cccc2ccccc21 ZINC000623121979 1054534092 /nfs/dbraw/zinc/53/40/92/1054534092.db2.gz YGCFYESTVITYHF-UHFFFAOYSA-N 1 2 324.346 4.053 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1nc(-c2ccccc2)oc1C ZINC000623121301 1054535672 /nfs/dbraw/zinc/53/56/72/1054535672.db2.gz VCOUNFLQDIBKOI-UHFFFAOYSA-N 1 2 312.335 4.424 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1nc(-c2ccccc2)oc1C ZINC000623121301 1054535690 /nfs/dbraw/zinc/53/56/90/1054535690.db2.gz VCOUNFLQDIBKOI-UHFFFAOYSA-N 1 2 312.335 4.424 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2cccc(Cl)c2Cl)nc(C)n1 ZINC000671302912 1054542147 /nfs/dbraw/zinc/54/21/47/1054542147.db2.gz IHZFGHLHUICTGG-SNVBAGLBSA-N 1 2 310.228 4.251 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@@H](C)COc2cccc(C)c2)cc1 ZINC001234589248 1054551155 /nfs/dbraw/zinc/55/11/55/1054551155.db2.gz YDOAQJRJYFEEEJ-HNNXBMFYSA-N 1 2 313.397 4.203 20 0 DIADLO CCC(CC)[C@@H](NC(=O)CCCn1cc[nH+]c1)c1cccs1 ZINC000623275048 1054553735 /nfs/dbraw/zinc/55/37/35/1054553735.db2.gz NJGFURSCEITWRY-QGZVFWFLSA-N 1 2 319.474 4.019 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](CC(C)C)c2ccccc2)n1 ZINC000192567830 1054562684 /nfs/dbraw/zinc/56/26/84/1054562684.db2.gz ODJPIXLGRXFFFR-MRXNPFEDSA-N 1 2 301.434 4.289 20 0 DIADLO Cc1[nH]c(CN(C)Cc2ccc(Oc3ccccc3)cc2)c(C)[nH+]1 ZINC001234645983 1054566681 /nfs/dbraw/zinc/56/66/81/1054566681.db2.gz XKFDHZSPXAOZTM-UHFFFAOYSA-N 1 2 321.424 4.451 20 0 DIADLO CC(C)=C(C)CC(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001347574950 1054573062 /nfs/dbraw/zinc/57/30/62/1054573062.db2.gz GWLCFAIGADFKTQ-INIZCTEOSA-N 1 2 317.477 4.091 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1cccn1C1CC1)c1ccco1 ZINC001347782603 1054581879 /nfs/dbraw/zinc/58/18/79/1054581879.db2.gz RBZMYNLNYFJSIE-FQEVSTJZSA-N 1 2 322.408 4.304 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CCC23CCCC3)c(Br)c1 ZINC001234742214 1054586179 /nfs/dbraw/zinc/58/61/79/1054586179.db2.gz KCAFYHDCAWUQPC-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CCC23CCCC3)c(Br)c1 ZINC001234742214 1054586190 /nfs/dbraw/zinc/58/61/90/1054586190.db2.gz KCAFYHDCAWUQPC-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO CCC1(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CCCC1 ZINC001358056289 1054590113 /nfs/dbraw/zinc/59/01/13/1054590113.db2.gz OZJQSBQIZOCOQE-UHFFFAOYSA-N 1 2 317.820 4.435 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ccn(-c3ccccc3)n2)C2CC2)cc1 ZINC000623433286 1054594002 /nfs/dbraw/zinc/59/40/02/1054594002.db2.gz QYFIWHDECSBHME-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ccn(-c3ccccc3)n2)C2CC2)cc1 ZINC000623433286 1054594015 /nfs/dbraw/zinc/59/40/15/1054594015.db2.gz QYFIWHDECSBHME-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO C[C@@H](CC(=O)Nc1ccccc1-c1ccccc1)n1cc[nH+]c1 ZINC001348068002 1054610974 /nfs/dbraw/zinc/61/09/74/1054610974.db2.gz ZASCNIONGWWPPR-HNNXBMFYSA-N 1 2 305.381 4.140 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CC3CCC(F)(F)CC3)cc2[nH+]1 ZINC000623623497 1054631006 /nfs/dbraw/zinc/63/10/06/1054631006.db2.gz QEZHEJVXMNETMR-UHFFFAOYSA-N 1 2 307.344 4.025 20 0 DIADLO Cc1cc(Cl)c(NC(=O)[C@H](CC(C)C)n2cc[nH+]c2)cc1C ZINC001450026572 1054634812 /nfs/dbraw/zinc/63/48/12/1054634812.db2.gz YXJZOCAVQVVNGB-INIZCTEOSA-N 1 2 319.836 4.379 20 0 DIADLO CCCCOc1cccc(NC(=O)c2ccn3c(C)c[nH+]c3c2)c1 ZINC001358353444 1054663796 /nfs/dbraw/zinc/66/37/96/1054663796.db2.gz SJZNGVIWKYSZML-UHFFFAOYSA-N 1 2 323.396 4.074 20 0 DIADLO Cc1cc(Cl)c(C[NH+]2CC(c3cccnc3)C2)c(Cl)c1 ZINC001235167420 1054669984 /nfs/dbraw/zinc/66/99/84/1054669984.db2.gz DYOOTYDLAFRBID-UHFFFAOYSA-N 1 2 307.224 4.296 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC3(CCCC3)[C@H]2C(C)C)c(C)[nH+]1 ZINC001451391021 1054677234 /nfs/dbraw/zinc/67/72/34/1054677234.db2.gz RVWKJXMJFRSQEX-QGZVFWFLSA-N 1 2 300.446 4.048 20 0 DIADLO Cc1cc(F)c(C[N@@H+]2CC[C@H]2COCc2ccccc2)c(F)c1 ZINC001235196321 1054681780 /nfs/dbraw/zinc/68/17/80/1054681780.db2.gz BQEWTJJAWOXZQE-INIZCTEOSA-N 1 2 317.379 4.064 20 0 DIADLO Cc1cc(F)c(C[N@H+]2CC[C@H]2COCc2ccccc2)c(F)c1 ZINC001235196321 1054681786 /nfs/dbraw/zinc/68/17/86/1054681786.db2.gz BQEWTJJAWOXZQE-INIZCTEOSA-N 1 2 317.379 4.064 20 0 DIADLO Cc1cc(F)c(C[N@@H+]2CC[C@@H]2COCc2ccccc2)c(F)c1 ZINC001235196331 1054682245 /nfs/dbraw/zinc/68/22/45/1054682245.db2.gz BQEWTJJAWOXZQE-MRXNPFEDSA-N 1 2 317.379 4.064 20 0 DIADLO Cc1cc(F)c(C[N@H+]2CC[C@@H]2COCc2ccccc2)c(F)c1 ZINC001235196331 1054682249 /nfs/dbraw/zinc/68/22/49/1054682249.db2.gz BQEWTJJAWOXZQE-MRXNPFEDSA-N 1 2 317.379 4.064 20 0 DIADLO Cc1cc(F)c(C[N@H+](C)Cc2cccc3cccnc32)c(F)c1 ZINC001235200361 1054684419 /nfs/dbraw/zinc/68/44/19/1054684419.db2.gz DXCXKNVCDUGQIC-UHFFFAOYSA-N 1 2 312.363 4.453 20 0 DIADLO Cc1cc(F)c(C[N@@H+](C)Cc2cccc3cccnc32)c(F)c1 ZINC001235200361 1054684428 /nfs/dbraw/zinc/68/44/28/1054684428.db2.gz DXCXKNVCDUGQIC-UHFFFAOYSA-N 1 2 312.363 4.453 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2c(F)cc(C)cc2F)cc1 ZINC001235203934 1054685011 /nfs/dbraw/zinc/68/50/11/1054685011.db2.gz YOPURLLVNHLXBH-ZDUSSCGKSA-N 1 2 305.368 4.475 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2c(F)cc(C)cc2F)cc1 ZINC001235203934 1054685020 /nfs/dbraw/zinc/68/50/20/1054685020.db2.gz YOPURLLVNHLXBH-ZDUSSCGKSA-N 1 2 305.368 4.475 20 0 DIADLO C[N@H+](Cc1cc2cccc(F)c2[nH]1)Cc1cnc(Cl)s1 ZINC001235236792 1054686427 /nfs/dbraw/zinc/68/64/27/1054686427.db2.gz HWKBHHRZJVHZHE-UHFFFAOYSA-N 1 2 309.797 4.049 20 0 DIADLO C[N@@H+](Cc1cc2cccc(F)c2[nH]1)Cc1cnc(Cl)s1 ZINC001235236792 1054686432 /nfs/dbraw/zinc/68/64/32/1054686432.db2.gz HWKBHHRZJVHZHE-UHFFFAOYSA-N 1 2 309.797 4.049 20 0 DIADLO F[C@@H]1CCC[N@H+](Cc2nc(Cl)ccc2C(F)(F)F)CC1 ZINC001235223047 1054687852 /nfs/dbraw/zinc/68/78/52/1054687852.db2.gz KOUXLHVKDMPDPL-SECBINFHSA-N 1 2 310.722 4.078 20 0 DIADLO F[C@@H]1CCC[N@@H+](Cc2nc(Cl)ccc2C(F)(F)F)CC1 ZINC001235223047 1054687856 /nfs/dbraw/zinc/68/78/56/1054687856.db2.gz KOUXLHVKDMPDPL-SECBINFHSA-N 1 2 310.722 4.078 20 0 DIADLO Cc1nc(C[NH2+]C(C)(C)c2cccc(F)c2)nc2ccccc12 ZINC000179575222 1054688193 /nfs/dbraw/zinc/68/81/93/1054688193.db2.gz URBLTVHMNRKWGQ-UHFFFAOYSA-N 1 2 309.388 4.102 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1nc(Cl)ccc1C(F)(F)F ZINC001235238785 1054690266 /nfs/dbraw/zinc/69/02/66/1054690266.db2.gz TZYXSXBBLWNPAM-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1nc(Cl)ccc1C(F)(F)F ZINC001235238785 1054690276 /nfs/dbraw/zinc/69/02/76/1054690276.db2.gz TZYXSXBBLWNPAM-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1ccc(F)cc1F ZINC000179623494 1054692020 /nfs/dbraw/zinc/69/20/20/1054692020.db2.gz HIXQZYXZNOKVNB-AWEZNQCLSA-N 1 2 320.314 4.486 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2ccccc2o1)c1ccc(F)cc1F ZINC000179631438 1054692121 /nfs/dbraw/zinc/69/21/21/1054692121.db2.gz FWRVLAQEMCSOCA-AWEZNQCLSA-N 1 2 302.324 4.347 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+]Cc1nc2ccccc2o1 ZINC000179746075 1054698672 /nfs/dbraw/zinc/69/86/72/1054698672.db2.gz OJRLCTCTFAVLCV-HNNXBMFYSA-N 1 2 310.397 4.467 20 0 DIADLO COc1cc(C[N@H+](C)Cc2ccc3ccccc3c2)c(F)cn1 ZINC001235324220 1054699412 /nfs/dbraw/zinc/69/94/12/1054699412.db2.gz RPMSEQUKEXZFTN-UHFFFAOYSA-N 1 2 310.372 4.015 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2ccc3ccccc3c2)c(F)cn1 ZINC001235324220 1054699420 /nfs/dbraw/zinc/69/94/20/1054699420.db2.gz RPMSEQUKEXZFTN-UHFFFAOYSA-N 1 2 310.372 4.015 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@H]2c2ccccc2F)c(F)cn1 ZINC001235315603 1054700858 /nfs/dbraw/zinc/70/08/58/1054700858.db2.gz IFPVAGGAUYUULS-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@H]2c2ccccc2F)c(F)cn1 ZINC001235315603 1054700875 /nfs/dbraw/zinc/70/08/75/1054700875.db2.gz IFPVAGGAUYUULS-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(F)c(F)c(F)c2F)CCC1(F)F ZINC001235343563 1054704302 /nfs/dbraw/zinc/70/43/02/1054704302.db2.gz WWAWIDJPFZZQJY-QMMMGPOBSA-N 1 2 311.269 4.110 20 0 DIADLO C[N@H+](Cc1ccc(F)cc1)Cc1cc(F)c(F)c(F)c1F ZINC001235339459 1054704169 /nfs/dbraw/zinc/70/41/69/1054704169.db2.gz ISHYIEPHNYWPKG-UHFFFAOYSA-N 1 2 301.258 4.014 20 0 DIADLO C[N@@H+](Cc1ccc(F)cc1)Cc1cc(F)c(F)c(F)c1F ZINC001235339459 1054704183 /nfs/dbraw/zinc/70/41/83/1054704183.db2.gz ISHYIEPHNYWPKG-UHFFFAOYSA-N 1 2 301.258 4.014 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(F)c(F)c(F)c2F)CCC1(F)F ZINC001235343563 1054704316 /nfs/dbraw/zinc/70/43/16/1054704316.db2.gz WWAWIDJPFZZQJY-QMMMGPOBSA-N 1 2 311.269 4.110 20 0 DIADLO Fc1cc(C[NH+]2CCC(c3cccnc3)CC2)c(F)c(F)c1F ZINC001235352658 1054707047 /nfs/dbraw/zinc/70/70/47/1054707047.db2.gz WBHPHZSQXJLWOZ-UHFFFAOYSA-N 1 2 324.321 4.018 20 0 DIADLO Cc1cc(NCCOc2ccccc2C(C)C)nc(C2CC2)[nH+]1 ZINC000604756398 1054707493 /nfs/dbraw/zinc/70/74/93/1054707493.db2.gz CNFYCKJDZUTVJI-UHFFFAOYSA-N 1 2 311.429 4.277 20 0 DIADLO Cc1cc(NCc2ccc(OC(C)(C)C)cc2)nc(C2CC2)[nH+]1 ZINC000604758524 1054707858 /nfs/dbraw/zinc/70/78/58/1054707858.db2.gz DWAOIFWTPKTLBA-UHFFFAOYSA-N 1 2 311.429 4.452 20 0 DIADLO COc1cc2c(cc1F)CC[C@@H]2Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000509474909 1054708607 /nfs/dbraw/zinc/70/86/07/1054708607.db2.gz DDXJBHIDALNRRG-HNNXBMFYSA-N 1 2 315.392 4.156 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2csc(Nc3ccccc3)n2)[C@H]1C ZINC000605335701 1054709878 /nfs/dbraw/zinc/70/98/78/1054709878.db2.gz PUVOWCDJEXBKRD-STQMWFEESA-N 1 2 319.499 4.213 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2csc(Nc3ccccc3)n2)[C@H]1C ZINC000605335701 1054709894 /nfs/dbraw/zinc/70/98/94/1054709894.db2.gz PUVOWCDJEXBKRD-STQMWFEESA-N 1 2 319.499 4.213 20 0 DIADLO CCOc1cc(O)cc(C[N@@H+]2CCc3cc(Cl)ccc3C2)c1 ZINC001235411360 1054714817 /nfs/dbraw/zinc/71/48/17/1054714817.db2.gz WPVPMOHULWOXNP-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1cc(O)cc(C[N@H+]2CCc3cc(Cl)ccc3C2)c1 ZINC001235411360 1054714833 /nfs/dbraw/zinc/71/48/33/1054714833.db2.gz WPVPMOHULWOXNP-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1cc(C[NH+]2CC3(C2)CCCC3)ccc1Br ZINC001235438590 1054722902 /nfs/dbraw/zinc/72/29/02/1054722902.db2.gz OWHCJVROASMYEF-UHFFFAOYSA-N 1 2 324.262 4.224 20 0 DIADLO COc1cncc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c1C ZINC001235474486 1054727762 /nfs/dbraw/zinc/72/77/62/1054727762.db2.gz QLTVMUFUFWWGEN-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cncc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)c1C ZINC001235474486 1054727777 /nfs/dbraw/zinc/72/77/77/1054727777.db2.gz QLTVMUFUFWWGEN-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cncc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1C ZINC001235465667 1054730331 /nfs/dbraw/zinc/73/03/31/1054730331.db2.gz TVCBIBRYJVKARK-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cncc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1C ZINC001235465667 1054730344 /nfs/dbraw/zinc/73/03/44/1054730344.db2.gz TVCBIBRYJVKARK-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(Nc3ccccc3)n2)C[C@H](C)S1 ZINC000608502136 1054732541 /nfs/dbraw/zinc/73/25/41/1054732541.db2.gz ACHGZPHSWMWCSX-BETUJISGSA-N 1 2 319.499 4.213 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(Nc3ccccc3)n2)C[C@H](C)S1 ZINC000608502136 1054732554 /nfs/dbraw/zinc/73/25/54/1054732554.db2.gz ACHGZPHSWMWCSX-BETUJISGSA-N 1 2 319.499 4.213 20 0 DIADLO CO[C@H](C)C1C[NH+](Cc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC001235597529 1054751186 /nfs/dbraw/zinc/75/11/86/1054751186.db2.gz LYYVBHAUEZXJQX-MRVPVSSYSA-N 1 2 308.636 4.114 20 0 DIADLO FC(F)(F)c1ccc(CNc2ccc(N3CCCC3)c[nH+]2)cc1 ZINC000513053971 1054744220 /nfs/dbraw/zinc/74/42/20/1054744220.db2.gz HAWJIODINKEQFN-UHFFFAOYSA-N 1 2 321.346 4.313 20 0 DIADLO COC[C@@H]1CCC[N@@H+]1Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235589797 1054747090 /nfs/dbraw/zinc/74/70/90/1054747090.db2.gz DWOLXQIZNVOAMH-JTQLQIEISA-N 1 2 308.636 4.258 20 0 DIADLO COC[C@@H]1CCC[N@H+]1Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235589797 1054747104 /nfs/dbraw/zinc/74/71/04/1054747104.db2.gz DWOLXQIZNVOAMH-JTQLQIEISA-N 1 2 308.636 4.258 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nccc(C)c2Cl)cn1 ZINC001235589723 1054748602 /nfs/dbraw/zinc/74/86/02/1054748602.db2.gz XSXZJVVMTVIUKL-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2nccc(C)c2Cl)cn1 ZINC001235589723 1054748616 /nfs/dbraw/zinc/74/86/16/1054748616.db2.gz XSXZJVVMTVIUKL-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO COC[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1ccc(F)c(F)c1 ZINC000180363942 1054752340 /nfs/dbraw/zinc/75/23/40/1054752340.db2.gz YSCLRGQYQQXJFS-YLVFBTJISA-N 1 2 321.367 4.159 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccccc2-c2ccncc2)CC1(F)F ZINC001235611178 1054752618 /nfs/dbraw/zinc/75/26/18/1054752618.db2.gz HBHOPHXTLDCPJB-AWEZNQCLSA-N 1 2 302.368 4.226 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccccc2-c2ccncc2)CC1(F)F ZINC001235611178 1054752636 /nfs/dbraw/zinc/75/26/36/1054752636.db2.gz HBHOPHXTLDCPJB-AWEZNQCLSA-N 1 2 302.368 4.226 20 0 DIADLO CCC1(O)CC[NH+](Cc2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC001235599950 1054755481 /nfs/dbraw/zinc/75/54/81/1054755481.db2.gz ZEGVIJBWXFMFDD-UHFFFAOYSA-N 1 2 322.663 4.384 20 0 DIADLO C[N@H+](Cc1cccn1C(=O)OC(C)(C)C)Cc1cccc(F)c1 ZINC001235623068 1054757793 /nfs/dbraw/zinc/75/77/93/1054757793.db2.gz DLMBSAVTELRHAG-UHFFFAOYSA-N 1 2 318.392 4.042 20 0 DIADLO C[N@@H+](Cc1cccn1C(=O)OC(C)(C)C)Cc1cccc(F)c1 ZINC001235623068 1054757805 /nfs/dbraw/zinc/75/78/05/1054757805.db2.gz DLMBSAVTELRHAG-UHFFFAOYSA-N 1 2 318.392 4.042 20 0 DIADLO Cc1ccc(NC(=O)C[C@@H](C)n2cc[nH+]c2)c(Cl)c1Cl ZINC001349499331 1054758991 /nfs/dbraw/zinc/75/89/91/1054758991.db2.gz LJWUTNOERUOALQ-SNVBAGLBSA-N 1 2 312.200 4.088 20 0 DIADLO CC(C)c1cccc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001349615698 1054775319 /nfs/dbraw/zinc/77/53/19/1054775319.db2.gz NDOKBQPUDVICSA-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO Cc1nc(NCc2ccccc2Oc2cccc(F)c2)cc[nH+]1 ZINC000525192235 1054782675 /nfs/dbraw/zinc/78/26/75/1054782675.db2.gz DIEKIQSIBMBTMP-UHFFFAOYSA-N 1 2 309.344 4.329 20 0 DIADLO Cc1ccc(C)c(Oc2ccc(CNc3cc[nH+]c(C)n3)cn2)c1 ZINC000524689720 1054783410 /nfs/dbraw/zinc/78/34/10/1054783410.db2.gz JYWAHIFNELXTKV-UHFFFAOYSA-N 1 2 320.396 4.201 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)cc1Cl ZINC001235703267 1054786183 /nfs/dbraw/zinc/78/61/83/1054786183.db2.gz ZVBYPOLBPGXPIL-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@@H]2c2ccccc2F)cc1Cl ZINC001235703267 1054786196 /nfs/dbraw/zinc/78/61/96/1054786196.db2.gz ZVBYPOLBPGXPIL-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1nn(C(C)C)cc1C[NH2+]C1(c2c(F)cccc2F)CCC1 ZINC000623844424 1054789528 /nfs/dbraw/zinc/78/95/28/1054789528.db2.gz VUPXSXUBCVOZAZ-UHFFFAOYSA-N 1 2 319.399 4.220 20 0 DIADLO Nc1ccc(CNC(=O)Nc2cccc(C3CCCCC3)c2)c[nH+]1 ZINC000529153633 1054797694 /nfs/dbraw/zinc/79/76/94/1054797694.db2.gz AKOPPSVCAFULOL-UHFFFAOYSA-N 1 2 324.428 4.033 20 0 DIADLO CC(C)Oc1ccccc1C[NH2+][C@H]1CCCc2scnc21 ZINC000623870376 1054804372 /nfs/dbraw/zinc/80/43/72/1054804372.db2.gz XXBZLBCJPVQOGY-AWEZNQCLSA-N 1 2 302.443 4.098 20 0 DIADLO Cc1cc(-c2ccc(C(F)(F)F)cc2OC(C)C)c[nH+]c1N ZINC001235773587 1054804163 /nfs/dbraw/zinc/80/41/63/1054804163.db2.gz XIERRJBRVXJZIR-UHFFFAOYSA-N 1 2 310.319 4.445 20 0 DIADLO CC(=O)Nc1ccccc1CNc1[nH+]c2ccccc2cc1C ZINC000532015099 1054808942 /nfs/dbraw/zinc/80/89/42/1054808942.db2.gz PJWZDOBUCJQQKZ-UHFFFAOYSA-N 1 2 305.381 4.114 20 0 DIADLO CCC[N@H+](CC(=O)OC(C)(C)C)Cc1ccc(Cl)c(C)c1 ZINC001474426224 1054810018 /nfs/dbraw/zinc/81/00/18/1054810018.db2.gz SSBPWWQUWLHAKJ-UHFFFAOYSA-N 1 2 311.853 4.202 20 0 DIADLO CCC[N@@H+](CC(=O)OC(C)(C)C)Cc1ccc(Cl)c(C)c1 ZINC001474426224 1054810034 /nfs/dbraw/zinc/81/00/34/1054810034.db2.gz SSBPWWQUWLHAKJ-UHFFFAOYSA-N 1 2 311.853 4.202 20 0 DIADLO COc1ccc(OC)c(CNc2[nH+]c3ccccc3cc2C)c1 ZINC000532015301 1054810993 /nfs/dbraw/zinc/81/09/93/1054810993.db2.gz NDNSBGQCQPYLJS-UHFFFAOYSA-N 1 2 308.381 4.173 20 0 DIADLO C[C@H](Nc1[nH+]c2ccccc2n1C)c1cccc(N2CCCC2)c1 ZINC000534977450 1054818446 /nfs/dbraw/zinc/81/84/46/1054818446.db2.gz UGOXYOOPHMJEEA-HNNXBMFYSA-N 1 2 320.440 4.347 20 0 DIADLO COc1nccc(C[N@@H+]2CCC[C@H]2c2ccccc2F)c1Cl ZINC001235841970 1054818554 /nfs/dbraw/zinc/81/85/54/1054818554.db2.gz JSWBGWHNWLXMSS-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(C[N@H+]2CCC[C@H]2c2ccccc2F)c1Cl ZINC001235841970 1054818559 /nfs/dbraw/zinc/81/85/59/1054818559.db2.gz JSWBGWHNWLXMSS-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO O=C(CC1CCC(F)(F)CC1)Nc1ccccc1-n1cc[nH+]c1 ZINC000623929233 1054818887 /nfs/dbraw/zinc/81/88/87/1054818887.db2.gz TXGVFBAYBMOBJC-UHFFFAOYSA-N 1 2 319.355 4.026 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc3sc(C)nc3c2)no1 ZINC001235850860 1054821268 /nfs/dbraw/zinc/82/12/68/1054821268.db2.gz QGVRFQHXEAFCQM-MRXNPFEDSA-N 1 2 313.426 4.238 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc3sc(C)nc3c2)no1 ZINC001235850860 1054821280 /nfs/dbraw/zinc/82/12/80/1054821280.db2.gz QGVRFQHXEAFCQM-MRXNPFEDSA-N 1 2 313.426 4.238 20 0 DIADLO c1nc2c(s1)CCC[C@@H]2Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000623932175 1054823584 /nfs/dbraw/zinc/82/35/84/1054823584.db2.gz CMKPFGDYCQRJSV-AWEZNQCLSA-N 1 2 314.458 4.018 20 0 DIADLO CCOc1cc(Cl)ccc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000623923988 1054828386 /nfs/dbraw/zinc/82/83/86/1054828386.db2.gz QNRJLZOLZVGUJT-CYBMUJFWSA-N 1 2 322.861 4.362 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1nc(C)cs1)c1cccc(Cl)c1 ZINC000623985030 1054839965 /nfs/dbraw/zinc/83/99/65/1054839965.db2.gz BVWQQDZPLFCGBP-SMDDNHRTSA-N 1 2 310.850 4.143 20 0 DIADLO C[C@H]([NH2+][C@@H]1CC=CCC1)c1cc(Br)cc(F)c1O ZINC000186057021 1054873673 /nfs/dbraw/zinc/87/36/73/1054873673.db2.gz GBNTZZCLQCLYCC-GXSJLCMTSA-N 1 2 314.198 4.053 20 0 DIADLO CCC(F)(F)C[NH2+][C@H](C)c1sc(-c2cccnc2)nc1C ZINC000624147928 1054890588 /nfs/dbraw/zinc/89/05/88/1054890588.db2.gz PGBFUUXALDRFOT-SNVBAGLBSA-N 1 2 311.401 4.209 20 0 DIADLO CCC(F)(F)C[NH2+][C@@H](C)c1sc(-c2cccnc2)nc1C ZINC000624147927 1054890898 /nfs/dbraw/zinc/89/08/98/1054890898.db2.gz PGBFUUXALDRFOT-JTQLQIEISA-N 1 2 311.401 4.209 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](c2cccc(F)c2)C2CCCC2)n1 ZINC000181004076 1054896692 /nfs/dbraw/zinc/89/66/92/1054896692.db2.gz APBBBJROFIMREJ-KRWDZBQOSA-N 1 2 317.408 4.353 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2cccc(F)c2)C2CCCC2)o1 ZINC000181005439 1054896834 /nfs/dbraw/zinc/89/68/34/1054896834.db2.gz LMCMWXZBFBCEIS-KRWDZBQOSA-N 1 2 317.408 4.353 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](c2cccc(F)c2)C2CCCC2)n1 ZINC000181004057 1054897218 /nfs/dbraw/zinc/89/72/18/1054897218.db2.gz APBBBJROFIMREJ-QGZVFWFLSA-N 1 2 317.408 4.353 20 0 DIADLO Fc1cccc([C@@H]([NH2+]Cc2nc(C3CC3)no2)C2CCCC2)c1 ZINC000181007362 1054898070 /nfs/dbraw/zinc/89/80/70/1054898070.db2.gz AOHJTFHNRBGFKK-KRWDZBQOSA-N 1 2 315.392 4.107 20 0 DIADLO Fc1cccc([C@H]([NH2+]Cc2nc(C3CC3)no2)C2CCCC2)c1 ZINC000181007346 1054898094 /nfs/dbraw/zinc/89/80/94/1054898094.db2.gz AOHJTFHNRBGFKK-QGZVFWFLSA-N 1 2 315.392 4.107 20 0 DIADLO CCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1cc(C)on1 ZINC000181265888 1054908827 /nfs/dbraw/zinc/90/88/27/1054908827.db2.gz UDVGZGBSOZHFTC-KRWDZBQOSA-N 1 2 302.418 4.259 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(-c2ccc(F)cc2)o1)c1cccc(O)c1 ZINC000181499681 1054917591 /nfs/dbraw/zinc/91/75/91/1054917591.db2.gz ZRQVBVZPVRZCHN-GFCCVEGCSA-N 1 2 312.344 4.037 20 0 DIADLO OCc1ccc(C(F)(F)F)cc1-c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001236056643 1054918937 /nfs/dbraw/zinc/91/89/37/1054918937.db2.gz JUEQPKIEXSNDOU-UHFFFAOYSA-N 1 2 318.298 4.255 20 0 DIADLO CC[C@H](NC(=O)c1ccn2c(C)c[nH+]c2c1)c1cc(C)ccc1C ZINC001535395312 1054920803 /nfs/dbraw/zinc/92/08/03/1054920803.db2.gz CHFKLVJOLAMPDI-SFHVURJKSA-N 1 2 321.424 4.141 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1ccc(F)cc1F ZINC000181580375 1054922299 /nfs/dbraw/zinc/92/22/99/1054922299.db2.gz CQQDCONNXXBHMO-SECBINFHSA-N 1 2 306.287 4.096 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nccn1C(C)C)c1ccc(F)cc1F ZINC000181643015 1054926053 /nfs/dbraw/zinc/92/60/53/1054926053.db2.gz FQZTYCKQUGMHBT-KRWDZBQOSA-N 1 2 307.388 4.229 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1ccc(C)cc1 ZINC000181684617 1054929639 /nfs/dbraw/zinc/92/96/39/1054929639.db2.gz DMLKHPZPCSRLGU-DZGCQCFKSA-N 1 2 301.434 4.477 20 0 DIADLO CCC[C@H]([NH2+]Cc1nc(Cc2ccccc2)no1)c1ccccc1 ZINC000181778831 1054936593 /nfs/dbraw/zinc/93/65/93/1054936593.db2.gz FNRVCDMOQRJTJN-SFHVURJKSA-N 1 2 321.424 4.291 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1ccc(OC)cc1 ZINC000181813677 1054938513 /nfs/dbraw/zinc/93/85/13/1054938513.db2.gz CBAKLFKVGYDLBN-WFASDCNBSA-N 1 2 317.433 4.178 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)c1ccc(OC)cc1 ZINC000181813738 1054938689 /nfs/dbraw/zinc/93/86/89/1054938689.db2.gz CBAKLFKVGYDLBN-IUODEOHRSA-N 1 2 317.433 4.178 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)c1ccc(OC)cc1 ZINC000181813716 1054939915 /nfs/dbraw/zinc/93/99/15/1054939915.db2.gz CBAKLFKVGYDLBN-DOMZBBRYSA-N 1 2 317.433 4.178 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+]Cc2nc(CC(C)C)no2)cc1 ZINC000182124450 1054963503 /nfs/dbraw/zinc/96/35/03/1054963503.db2.gz NRXRSZSSHZBTLJ-ZDUSSCGKSA-N 1 2 319.474 4.231 20 0 DIADLO Nc1nccc(Cl)c1C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001236152649 1054969766 /nfs/dbraw/zinc/96/97/66/1054969766.db2.gz WAUQRKUCOXTXRV-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nccc(Cl)c1C[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001236152649 1054969778 /nfs/dbraw/zinc/96/97/78/1054969778.db2.gz WAUQRKUCOXTXRV-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccc(Cl)nc1C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001236152507 1054971451 /nfs/dbraw/zinc/97/14/51/1054971451.db2.gz RDLQJSVPJYRNGC-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccc(Cl)nc1C[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001236152507 1054971461 /nfs/dbraw/zinc/97/14/61/1054971461.db2.gz RDLQJSVPJYRNGC-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO COc1cc(-c2cc[nH+]c(N3CCCCC3)c2)cc(C)c1F ZINC001236190551 1054987179 /nfs/dbraw/zinc/98/71/79/1054987179.db2.gz MVKDIUCEGHUBQG-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO CC(C)CCn1ccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000183052060 1055026814 /nfs/dbraw/zinc/02/68/14/1055026814.db2.gz FBMPSMLTNCPZQL-INIZCTEOSA-N 1 2 323.444 4.288 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)s1 ZINC000183117170 1055030245 /nfs/dbraw/zinc/03/02/45/1055030245.db2.gz ZKYDETDDCZDRHY-OAHLLOKOSA-N 1 2 303.475 4.332 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CCCC[C@@H]2c2cccn2C)s1 ZINC000183117170 1055030258 /nfs/dbraw/zinc/03/02/58/1055030258.db2.gz ZKYDETDDCZDRHY-OAHLLOKOSA-N 1 2 303.475 4.332 20 0 DIADLO CC(C)C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccccn1 ZINC000183146860 1055032061 /nfs/dbraw/zinc/03/20/61/1055032061.db2.gz XPPXSNRGGHFZLC-SFHVURJKSA-N 1 2 310.445 4.276 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](c2ccccc2C)C(C)C)no1 ZINC000183219419 1055035580 /nfs/dbraw/zinc/03/55/80/1055035580.db2.gz WJSNFLARDUTHTC-GOSISDBHSA-N 1 2 301.434 4.208 20 0 DIADLO Cc1[nH+]cn(-c2ccc(C3=CC[C@@H](C(F)(F)F)CC3)nn2)c1C ZINC001236252447 1055036467 /nfs/dbraw/zinc/03/64/67/1055036467.db2.gz QLNYKMFQVABRCN-CYBMUJFWSA-N 1 2 322.334 4.025 20 0 DIADLO Cc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nc(CC(C)C)no1 ZINC000183246889 1055037144 /nfs/dbraw/zinc/03/71/44/1055037144.db2.gz JHMIJIVZVXBCSA-KRWDZBQOSA-N 1 2 315.461 4.454 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](c2ccccc2Cl)C(C)C)n1C1CC1 ZINC000183692304 1055054766 /nfs/dbraw/zinc/05/47/66/1055054766.db2.gz GRJQFURYJQUITE-QGZVFWFLSA-N 1 2 318.852 4.062 20 0 DIADLO Nc1ccc(-c2ccc(F)c(C(F)(F)C(F)(F)F)c2)c[nH+]1 ZINC001236318056 1055055223 /nfs/dbraw/zinc/05/52/23/1055055223.db2.gz WVCWTQPOUXSKFR-UHFFFAOYSA-N 1 2 306.209 4.124 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H]3CCC[C@H]3c3ccccc3)ccc2[nH+]1 ZINC001536223073 1055061744 /nfs/dbraw/zinc/06/17/44/1055061744.db2.gz IWHMZWDQHPMZFC-ZWKOTPCHSA-N 1 2 319.408 4.165 20 0 DIADLO COC[C@H]([NH2+]C1c2ccccc2-c2ccccc21)c1ccco1 ZINC000184582234 1055078737 /nfs/dbraw/zinc/07/87/37/1055078737.db2.gz LOLPJYWEKJNHIT-SFHVURJKSA-N 1 2 305.377 4.327 20 0 DIADLO Cc1c(-c2ccccc2Cn2cc[nH+]c2)cnn1-c1ccccc1 ZINC001236402260 1055093349 /nfs/dbraw/zinc/09/33/49/1055093349.db2.gz JEAPLVIGFLLUBU-UHFFFAOYSA-N 1 2 314.392 4.093 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c(C)s1 ZINC000193133573 1055099033 /nfs/dbraw/zinc/09/90/33/1055099033.db2.gz GDGXFLGKJJEKRR-GHMZBOCLSA-N 1 2 307.463 4.457 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)n1 ZINC000193310049 1055101309 /nfs/dbraw/zinc/10/13/09/1055101309.db2.gz MRTWXECKIAGGHN-HNNXBMFYSA-N 1 2 305.809 4.087 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2nc(-c3ccccc3)c[nH]2)C2CC2)s1 ZINC000194339725 1055121937 /nfs/dbraw/zinc/12/19/37/1055121937.db2.gz PCODTYOHKSKTLA-QGZVFWFLSA-N 1 2 324.453 4.083 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cscn2)cc(C)c1OC(C)C ZINC001238751318 1055141354 /nfs/dbraw/zinc/14/13/54/1055141354.db2.gz DQDCKCPKMPUHRZ-UHFFFAOYSA-N 1 2 304.459 4.179 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cscn2)cc(C)c1OC(C)C ZINC001238751318 1055141361 /nfs/dbraw/zinc/14/13/61/1055141361.db2.gz DQDCKCPKMPUHRZ-UHFFFAOYSA-N 1 2 304.459 4.179 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)c1ccc(F)cc1 ZINC000195032439 1055142675 /nfs/dbraw/zinc/14/26/75/1055142675.db2.gz SNEHPGJGHLJMOF-RISCZKNCSA-N 1 2 305.397 4.308 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3c(C)cc(Cl)cc3C)ccn12 ZINC001127743373 1055143846 /nfs/dbraw/zinc/14/38/46/1055143846.db2.gz DZJFMNIOXPBWBX-UHFFFAOYSA-N 1 2 313.788 4.165 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cncc(OCc2ccccc2)c1 ZINC001236568444 1055190492 /nfs/dbraw/zinc/19/04/92/1055190492.db2.gz HAVYQNNGCLWGPG-UHFFFAOYSA-N 1 2 319.408 4.097 20 0 DIADLO Cc1cc(-c2cncc(OCc3ccccc3)c2)cn2cc[nH+]c12 ZINC001236572708 1055194968 /nfs/dbraw/zinc/19/49/68/1055194968.db2.gz CZPFGFLZYPDCPL-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO CCC(CC)[N@H+](C)Cc1c(Br)ccnc1Cl ZINC001236592691 1055202049 /nfs/dbraw/zinc/20/20/49/1055202049.db2.gz WYXSEROPLWDATM-UHFFFAOYSA-N 1 2 305.647 4.118 20 0 DIADLO CCC(CC)[N@@H+](C)Cc1c(Br)ccnc1Cl ZINC001236592691 1055202058 /nfs/dbraw/zinc/20/20/58/1055202058.db2.gz WYXSEROPLWDATM-UHFFFAOYSA-N 1 2 305.647 4.118 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC001236635423 1055207776 /nfs/dbraw/zinc/20/77/76/1055207776.db2.gz MHZVYAUIMBGGQZ-UWVGGRQHSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC001236635423 1055207785 /nfs/dbraw/zinc/20/77/85/1055207785.db2.gz MHZVYAUIMBGGQZ-UWVGGRQHSA-N 1 2 306.759 4.374 20 0 DIADLO CCCO[C@@H]1CC[N@H+](Cc2cc(Cl)c(F)c(Cl)c2)C1 ZINC001236652698 1055211162 /nfs/dbraw/zinc/21/11/62/1055211162.db2.gz BBLPHCHPSDXOAG-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@@H]1CC[N@@H+](Cc2cc(Cl)c(F)c(Cl)c2)C1 ZINC001236652698 1055211171 /nfs/dbraw/zinc/21/11/71/1055211171.db2.gz BBLPHCHPSDXOAG-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO CC[N@H+](Cc1cc(Cl)cc(C)n1)Cc1cccc(F)c1F ZINC001236649605 1055213032 /nfs/dbraw/zinc/21/30/32/1055213032.db2.gz BVGSBURBVQAGNP-UHFFFAOYSA-N 1 2 310.775 4.344 20 0 DIADLO CC[N@@H+](Cc1cc(Cl)cc(C)n1)Cc1cccc(F)c1F ZINC001236649605 1055213039 /nfs/dbraw/zinc/21/30/39/1055213039.db2.gz BVGSBURBVQAGNP-UHFFFAOYSA-N 1 2 310.775 4.344 20 0 DIADLO COc1ccc2sc(C[N@@H+]3Cc4cnc(C)cc4C3)cc2c1 ZINC001236668560 1055220405 /nfs/dbraw/zinc/22/04/05/1055220405.db2.gz VYSJGUDNSPRWTH-UHFFFAOYSA-N 1 2 310.422 4.129 20 0 DIADLO COc1ccc2sc(C[N@H+]3Cc4cnc(C)cc4C3)cc2c1 ZINC001236668560 1055220418 /nfs/dbraw/zinc/22/04/18/1055220418.db2.gz VYSJGUDNSPRWTH-UHFFFAOYSA-N 1 2 310.422 4.129 20 0 DIADLO COc1cccc(Br)c1C[N@H+](C)Cc1ccccc1 ZINC001236670055 1055221976 /nfs/dbraw/zinc/22/19/76/1055221976.db2.gz OBTOAAMTAQYPMH-UHFFFAOYSA-N 1 2 320.230 4.090 20 0 DIADLO COc1cccc(Br)c1C[N@@H+](C)Cc1ccccc1 ZINC001236670055 1055221989 /nfs/dbraw/zinc/22/19/89/1055221989.db2.gz OBTOAAMTAQYPMH-UHFFFAOYSA-N 1 2 320.230 4.090 20 0 DIADLO COc1cc2ccccc2cc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC001236679524 1055224209 /nfs/dbraw/zinc/22/42/09/1055224209.db2.gz KEHYOWYPXFPFMM-HNNXBMFYSA-N 1 2 306.409 4.227 20 0 DIADLO COc1cc2ccccc2cc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC001236679524 1055224217 /nfs/dbraw/zinc/22/42/17/1055224217.db2.gz KEHYOWYPXFPFMM-HNNXBMFYSA-N 1 2 306.409 4.227 20 0 DIADLO CCOc1ncc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)cc1F ZINC001236696165 1055234578 /nfs/dbraw/zinc/23/45/78/1055234578.db2.gz HZSHDLQSFTXSNH-LBPRGKRZSA-N 1 2 322.811 4.466 20 0 DIADLO CCOc1ncc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)cc1F ZINC001236696165 1055234585 /nfs/dbraw/zinc/23/45/85/1055234585.db2.gz HZSHDLQSFTXSNH-LBPRGKRZSA-N 1 2 322.811 4.466 20 0 DIADLO COC(=O)c1cc(Cl)cc(C[N@@H+]2CC[C@H]2c2ccccc2)c1 ZINC001236777013 1055254877 /nfs/dbraw/zinc/25/48/77/1055254877.db2.gz ZXGLNTAUQXKRPD-KRWDZBQOSA-N 1 2 315.800 4.074 20 0 DIADLO COC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@H]2c2ccccc2)c1 ZINC001236777013 1055254894 /nfs/dbraw/zinc/25/48/94/1055254894.db2.gz ZXGLNTAUQXKRPD-KRWDZBQOSA-N 1 2 315.800 4.074 20 0 DIADLO COc1cc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c(F)cc1F ZINC001236817917 1055273798 /nfs/dbraw/zinc/27/37/98/1055273798.db2.gz OWOBDQUPZNQPPE-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(C[N@H+]2CCc3ccccc3[C@@H]2C)c(F)cc1F ZINC001236817917 1055273811 /nfs/dbraw/zinc/27/38/11/1055273811.db2.gz OWOBDQUPZNQPPE-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(C)nc2)c(F)cc1F ZINC001236833221 1055282758 /nfs/dbraw/zinc/28/27/58/1055282758.db2.gz ZOBKQHMEQNIOMD-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(C)nc2)c(F)cc1F ZINC001236833221 1055282767 /nfs/dbraw/zinc/28/27/67/1055282767.db2.gz ZOBKQHMEQNIOMD-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c(F)cc1F ZINC001236833293 1055285295 /nfs/dbraw/zinc/28/52/95/1055285295.db2.gz FWBQCUCRYTUWPY-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2F)c(F)cc1F ZINC001236833293 1055285307 /nfs/dbraw/zinc/28/53/07/1055285307.db2.gz FWBQCUCRYTUWPY-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO CCOc1cncc(C[N@H+](C)[C@H](C)c2ccccc2Cl)c1 ZINC001236840606 1055287501 /nfs/dbraw/zinc/28/75/01/1055287501.db2.gz GTBYBHSXRYYWHR-CYBMUJFWSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1cncc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)c1 ZINC001236840606 1055287516 /nfs/dbraw/zinc/28/75/16/1055287516.db2.gz GTBYBHSXRYYWHR-CYBMUJFWSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1cncc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1 ZINC001236846198 1055289415 /nfs/dbraw/zinc/28/94/15/1055289415.db2.gz UORIHGPBSJKBJF-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cncc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1 ZINC001236846198 1055289435 /nfs/dbraw/zinc/28/94/35/1055289435.db2.gz UORIHGPBSJKBJF-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1cc(F)c(F)c(Br)c1 ZINC001236848186 1055293577 /nfs/dbraw/zinc/29/35/77/1055293577.db2.gz LPPUBLSHMDPGNU-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1cc(F)c(F)c(Br)c1 ZINC001236848186 1055293583 /nfs/dbraw/zinc/29/35/83/1055293583.db2.gz LPPUBLSHMDPGNU-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)CCC2 ZINC000764939855 1055294042 /nfs/dbraw/zinc/29/40/42/1055294042.db2.gz MNKWTLZSJVVDAJ-YVEFUNNKSA-N 1 2 319.399 4.470 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@@H](C)c1cc(F)ccc1F)CCC2 ZINC000764939187 1055295631 /nfs/dbraw/zinc/29/56/31/1055295631.db2.gz JOPZZUAFYDSLIE-YVEFUNNKSA-N 1 2 319.399 4.470 20 0 DIADLO Oc1cccc2c1CC[N@H+](Cc1nc3ccccc3cc1Cl)C2 ZINC001236870212 1055298009 /nfs/dbraw/zinc/29/80/09/1055298009.db2.gz INJVNUNRESPQCV-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1cccc2c1CC[N@@H+](Cc1nc3ccccc3cc1Cl)C2 ZINC001236870212 1055298026 /nfs/dbraw/zinc/29/80/26/1055298026.db2.gz INJVNUNRESPQCV-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Clc1cc2ccccc2nc1C[N@@H+]1CCOc2ccccc2C1 ZINC001236873197 1055299970 /nfs/dbraw/zinc/29/99/70/1055299970.db2.gz DWCYGATVWFILFT-UHFFFAOYSA-N 1 2 324.811 4.283 20 0 DIADLO Clc1cc2ccccc2nc1C[N@H+]1CCOc2ccccc2C1 ZINC001236873197 1055299982 /nfs/dbraw/zinc/29/99/82/1055299982.db2.gz DWCYGATVWFILFT-UHFFFAOYSA-N 1 2 324.811 4.283 20 0 DIADLO Fc1ccc(C[N@@H+]2CCOC[C@@H]2c2ccccc2)c2occc21 ZINC001236890222 1055301401 /nfs/dbraw/zinc/30/14/01/1055301401.db2.gz IQDGJIQTOCQBFH-GOSISDBHSA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccc(C[N@H+]2CCOC[C@@H]2c2ccccc2)c2occc21 ZINC001236890222 1055301417 /nfs/dbraw/zinc/30/14/17/1055301417.db2.gz IQDGJIQTOCQBFH-GOSISDBHSA-N 1 2 311.356 4.145 20 0 DIADLO Cc1cc(C(=O)Nc2cc[nH+]c(C)c2)sc1-c1ccccc1 ZINC001537535854 1055352169 /nfs/dbraw/zinc/35/21/69/1055352169.db2.gz YIGUDPHCNVHJAZ-UHFFFAOYSA-N 1 2 308.406 4.101 20 0 DIADLO CCOc1ccc(CNc2ccc([NH+]3CCCC3)cc2)cc1F ZINC000785432311 1055378822 /nfs/dbraw/zinc/37/88/22/1055378822.db2.gz WHTBXUCWVKXFFN-UHFFFAOYSA-N 1 2 314.404 4.437 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2ccnc3c(Cl)cccc23)C[C@H]1F ZINC001237151731 1055387774 /nfs/dbraw/zinc/38/77/74/1055387774.db2.gz ZTSCOVLQKBUZCG-ZBFHGGJFSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2ccnc3c(Cl)cccc23)C[C@H]1F ZINC001237151731 1055387782 /nfs/dbraw/zinc/38/77/82/1055387782.db2.gz ZTSCOVLQKBUZCG-ZBFHGGJFSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1sc(=O)[nH]c1Cl ZINC001237169408 1055392588 /nfs/dbraw/zinc/39/25/88/1055392588.db2.gz NIVBYGLQEWZBGX-MRVPVSSYSA-N 1 2 317.241 4.349 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1sc(=O)[nH]c1Cl ZINC001237169408 1055392601 /nfs/dbraw/zinc/39/26/01/1055392601.db2.gz NIVBYGLQEWZBGX-MRVPVSSYSA-N 1 2 317.241 4.349 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)cc1 ZINC000921514197 1055401002 /nfs/dbraw/zinc/40/10/02/1055401002.db2.gz TXNXNDGJPWHGSQ-ZDUSSCGKSA-N 1 2 302.418 4.222 20 0 DIADLO COc1cccc(C[N@H+](C)CCC(=O)c2cccs2)c1Cl ZINC001237198589 1055401304 /nfs/dbraw/zinc/40/13/04/1055401304.db2.gz VCVSFVKSRXREAS-UHFFFAOYSA-N 1 2 323.845 4.115 20 0 DIADLO COc1cccc(C[N@@H+](C)CCC(=O)c2cccs2)c1Cl ZINC001237198589 1055401311 /nfs/dbraw/zinc/40/13/11/1055401311.db2.gz VCVSFVKSRXREAS-UHFFFAOYSA-N 1 2 323.845 4.115 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc3sc4ccccc4c3c2)CCC1=O ZINC001237195036 1055402713 /nfs/dbraw/zinc/40/27/13/1055402713.db2.gz IBEHKYRPPNPQPC-CYBMUJFWSA-N 1 2 309.434 4.465 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc3sc4ccccc4c3c2)CCC1=O ZINC001237195036 1055402716 /nfs/dbraw/zinc/40/27/16/1055402716.db2.gz IBEHKYRPPNPQPC-CYBMUJFWSA-N 1 2 309.434 4.465 20 0 DIADLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc2sc3ccccc3c2c1 ZINC001237201559 1055404391 /nfs/dbraw/zinc/40/43/91/1055404391.db2.gz YKDZWOGSMYYKIH-GFCCVEGCSA-N 1 2 313.422 4.048 20 0 DIADLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc2sc3ccccc3c2c1 ZINC001237201559 1055404396 /nfs/dbraw/zinc/40/43/96/1055404396.db2.gz YKDZWOGSMYYKIH-GFCCVEGCSA-N 1 2 313.422 4.048 20 0 DIADLO Cc1cc(F)ccc1C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC001587980836 1055407739 /nfs/dbraw/zinc/40/77/39/1055407739.db2.gz WKSJVDBYOSWGFQ-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO Cc1cnc2c(c1)C[N@@H+](Cc1ccc3nccc(Cl)c3c1)CC2 ZINC001237274547 1055412940 /nfs/dbraw/zinc/41/29/40/1055412940.db2.gz FABXQMVSBUPGHN-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1cnc2c(c1)C[N@H+](Cc1ccc3nccc(Cl)c3c1)CC2 ZINC001237274547 1055412946 /nfs/dbraw/zinc/41/29/46/1055412946.db2.gz FABXQMVSBUPGHN-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)COc3ccc(C(C)C)cc3)cc2[nH+]1 ZINC000010896383 1055421806 /nfs/dbraw/zinc/42/18/06/1055421806.db2.gz TWMNRYMFOVMZEC-UHFFFAOYSA-N 1 2 323.396 4.012 20 0 DIADLO CC(C)c1cccc(NC(=O)C[N@H+](C)Cc2cccc(F)c2)c1 ZINC000011202663 1055424348 /nfs/dbraw/zinc/42/43/48/1055424348.db2.gz WJZJFTKIPPMIOG-UHFFFAOYSA-N 1 2 314.404 4.020 20 0 DIADLO CC(C)c1cccc(NC(=O)C[N@@H+](C)Cc2cccc(F)c2)c1 ZINC000011202663 1055424354 /nfs/dbraw/zinc/42/43/54/1055424354.db2.gz WJZJFTKIPPMIOG-UHFFFAOYSA-N 1 2 314.404 4.020 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cnccc2Br)cc1C ZINC001237389711 1055444903 /nfs/dbraw/zinc/44/49/03/1055444903.db2.gz QMFYAXCRNFTSGD-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cnccc2Br)cc1C ZINC001237389711 1055444910 /nfs/dbraw/zinc/44/49/10/1055444910.db2.gz QMFYAXCRNFTSGD-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1nc(-c2ccc(F)cc2)no1 ZINC000016434838 1055455899 /nfs/dbraw/zinc/45/58/99/1055455899.db2.gz HVYMFDNMUQENHW-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1nc(-c2ccc(F)cc2)no1 ZINC000016434838 1055455903 /nfs/dbraw/zinc/45/59/03/1055455903.db2.gz HVYMFDNMUQENHW-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1nc(-c2ccsc2)no1 ZINC000016434999 1055456177 /nfs/dbraw/zinc/45/61/77/1055456177.db2.gz GGTHUXJQPYCUEW-JTQLQIEISA-N 1 2 305.428 4.053 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1nc(-c2ccsc2)no1 ZINC000016434999 1055456184 /nfs/dbraw/zinc/45/61/84/1055456184.db2.gz GGTHUXJQPYCUEW-JTQLQIEISA-N 1 2 305.428 4.053 20 0 DIADLO Cc1cc(C)c(C(=O)NCCCc2ccc(C(C)C)cc2)c(C)[nH+]1 ZINC001537850927 1055459101 /nfs/dbraw/zinc/45/91/01/1055459101.db2.gz MKBYTKCNJSAYTE-UHFFFAOYSA-N 1 2 324.468 4.493 20 0 DIADLO COc1c(C)cccc1C[N@H+](C)Cc1nc2ccccc2s1 ZINC001237501739 1055462167 /nfs/dbraw/zinc/46/21/67/1055462167.db2.gz VHVNYKONUIBRHR-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO COc1c(C)cccc1C[N@@H+](C)Cc1nc2ccccc2s1 ZINC001237501739 1055462174 /nfs/dbraw/zinc/46/21/74/1055462174.db2.gz VHVNYKONUIBRHR-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO Cc1cc(F)cc(NC(=O)C[C@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC001588281296 1055464093 /nfs/dbraw/zinc/46/40/93/1055464093.db2.gz JYWFXSWOAXIEFF-KRWDZBQOSA-N 1 2 323.371 4.018 20 0 DIADLO Cc1ncc(-c2ccc(NCc3c[nH+]c4c(C)cccn34)cc2)o1 ZINC001620842541 1055470839 /nfs/dbraw/zinc/47/08/39/1055470839.db2.gz BZTBBAFDQRHQOA-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO CNc1ccccc1C[NH2+][C@H](c1ccco1)c1ccccc1OC ZINC001620844275 1055472577 /nfs/dbraw/zinc/47/25/77/1055472577.db2.gz KOVMAVLPKVIGAZ-FQEVSTJZSA-N 1 2 322.408 4.209 20 0 DIADLO COC[C@H]1CCCC[N@@H+]1Cc1c(Cl)cc(F)cc1Cl ZINC001237590680 1055479466 /nfs/dbraw/zinc/47/94/66/1055479466.db2.gz AWIJUDNIYQGPGU-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO COC[C@H]1CCCC[N@H+]1Cc1c(Cl)cc(F)cc1Cl ZINC001237590680 1055479475 /nfs/dbraw/zinc/47/94/75/1055479475.db2.gz AWIJUDNIYQGPGU-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO F[C@@H]1CC[N@H+](Cc2sc3ccccc3c2Br)C1 ZINC001237585171 1055480439 /nfs/dbraw/zinc/48/04/39/1055480439.db2.gz IZBFWUROGQFWNE-SECBINFHSA-N 1 2 314.223 4.208 20 0 DIADLO F[C@@H]1CC[N@@H+](Cc2sc3ccccc3c2Br)C1 ZINC001237585171 1055480445 /nfs/dbraw/zinc/48/04/45/1055480445.db2.gz IZBFWUROGQFWNE-SECBINFHSA-N 1 2 314.223 4.208 20 0 DIADLO C[N@@H+](Cc1c(Cl)cc(F)cc1Cl)C[C@H]1CCCCO1 ZINC001237595435 1055482326 /nfs/dbraw/zinc/48/23/26/1055482326.db2.gz BEUJNZOSDCEJHC-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO C[N@H+](Cc1c(Cl)cc(F)cc1Cl)C[C@H]1CCCCO1 ZINC001237595435 1055482328 /nfs/dbraw/zinc/48/23/28/1055482328.db2.gz BEUJNZOSDCEJHC-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO Cc1cc(NCc2nccc3ccccc32)ccc1-n1cc[nH+]c1 ZINC001620854064 1055482774 /nfs/dbraw/zinc/48/27/74/1055482774.db2.gz OMXYVDJOEICFHK-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO CCCn1nc(C)c(CNc2ccc(-n3cc[nH+]c3)c(C)c2)c1C ZINC001620853974 1055482946 /nfs/dbraw/zinc/48/29/46/1055482946.db2.gz KWTWHINJMDXVGR-UHFFFAOYSA-N 1 2 323.444 4.016 20 0 DIADLO Cc1cc(CNc2ccc(N(C)C)[nH+]c2)ccc1C(F)(F)F ZINC001620854407 1055483367 /nfs/dbraw/zinc/48/33/67/1055483367.db2.gz FRPPCNIHAXELAH-UHFFFAOYSA-N 1 2 309.335 4.087 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2c(Cl)cc(F)cc2Cl)[C@H](C)C1 ZINC001237603596 1055485104 /nfs/dbraw/zinc/48/51/04/1055485104.db2.gz UCRFCRYSAQZBFX-MWLCHTKSSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2c(Cl)cc(F)cc2Cl)[C@H](C)C1 ZINC001237603596 1055485106 /nfs/dbraw/zinc/48/51/06/1055485106.db2.gz UCRFCRYSAQZBFX-MWLCHTKSSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2c(Cl)cc(F)cc2Cl)[C@@H](C)C1 ZINC001237603597 1055485146 /nfs/dbraw/zinc/48/51/46/1055485146.db2.gz UCRFCRYSAQZBFX-ONGXEEELSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2c(Cl)cc(F)cc2Cl)[C@@H](C)C1 ZINC001237603597 1055485151 /nfs/dbraw/zinc/48/51/51/1055485151.db2.gz UCRFCRYSAQZBFX-ONGXEEELSA-N 1 2 306.208 4.132 20 0 DIADLO C[N@H+](Cc1ccon1)Cc1ccc(-c2ccc(F)cc2F)cc1 ZINC001237667813 1055499262 /nfs/dbraw/zinc/49/92/62/1055499262.db2.gz VRLZEBCKQJRLGA-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1ccon1)Cc1ccc(-c2ccc(F)cc2F)cc1 ZINC001237667813 1055499269 /nfs/dbraw/zinc/49/92/69/1055499269.db2.gz VRLZEBCKQJRLGA-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO Cc1ccc(F)c(C[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)c1 ZINC001620873359 1055501737 /nfs/dbraw/zinc/50/17/37/1055501737.db2.gz YHBYXHYFORYXSD-QGZVFWFLSA-N 1 2 301.409 4.079 20 0 DIADLO CC(=O)c1c(C)cc(C)c(C[N@@H+]2CCn3cccc3[C@H]2C)c1C ZINC000023706856 1055503782 /nfs/dbraw/zinc/50/37/82/1055503782.db2.gz GLRQACFOCKPUNK-MRXNPFEDSA-N 1 2 310.441 4.193 20 0 DIADLO CC(=O)c1c(C)cc(C)c(C[N@H+]2CCn3cccc3[C@H]2C)c1C ZINC000023706856 1055503797 /nfs/dbraw/zinc/50/37/97/1055503797.db2.gz GLRQACFOCKPUNK-MRXNPFEDSA-N 1 2 310.441 4.193 20 0 DIADLO CC(C)(C)c1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000023889510 1055506184 /nfs/dbraw/zinc/50/61/84/1055506184.db2.gz QOHALQUJPAJHMX-UHFFFAOYSA-N 1 2 319.408 4.422 20 0 DIADLO CC1(F)CC[NH+](Cc2c(F)cc(C(F)(F)F)cc2F)CC1 ZINC001237703888 1055510539 /nfs/dbraw/zinc/51/05/39/1055510539.db2.gz CTLHDCXOHVWAIZ-UHFFFAOYSA-N 1 2 311.269 4.308 20 0 DIADLO COc1cc(C)ccc1CNc1c[nH+]ccc1OC(C)(C)C ZINC001620887031 1055511033 /nfs/dbraw/zinc/51/10/33/1055511033.db2.gz JGDMKFHPSVJOHA-UHFFFAOYSA-N 1 2 300.402 4.188 20 0 DIADLO Cc1cc2cc(C[NH2+][C@H](C)c3nnc(C(C)C)[nH]3)oc2cc1C ZINC001620890675 1055514976 /nfs/dbraw/zinc/51/49/76/1055514976.db2.gz XOEFEOHBSSPHAS-CYBMUJFWSA-N 1 2 312.417 4.142 20 0 DIADLO Cc1cc(C[N@H+](C)CC(=O)c2ccccc2)ccc1OC(C)C ZINC001237725571 1055515867 /nfs/dbraw/zinc/51/58/67/1055515867.db2.gz ALRJANCSPFNBTD-UHFFFAOYSA-N 1 2 311.425 4.097 20 0 DIADLO Cc1cc(C[N@@H+](C)CC(=O)c2ccccc2)ccc1OC(C)C ZINC001237725571 1055515875 /nfs/dbraw/zinc/51/58/75/1055515875.db2.gz ALRJANCSPFNBTD-UHFFFAOYSA-N 1 2 311.425 4.097 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)c1ccccc1-c1ccccc1 ZINC001538057926 1055516102 /nfs/dbraw/zinc/51/61/02/1055516102.db2.gz FXMXZOGFNFIJDP-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(Br)cc1C(C)C ZINC001237734816 1055519180 /nfs/dbraw/zinc/51/91/80/1055519180.db2.gz APJCBAKEUBKPJO-INIZCTEOSA-N 1 2 324.262 4.126 20 0 DIADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(Br)cc1C(C)C ZINC001237734816 1055519191 /nfs/dbraw/zinc/51/91/91/1055519191.db2.gz APJCBAKEUBKPJO-INIZCTEOSA-N 1 2 324.262 4.126 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2cc3cc(C)c(C)cc3o2)s1 ZINC001620895589 1055520729 /nfs/dbraw/zinc/52/07/29/1055520729.db2.gz HSZKVIYYYMXQII-NSHDSACASA-N 1 2 301.415 4.060 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c(Cl)n1 ZINC001237804412 1055531833 /nfs/dbraw/zinc/53/18/33/1055531833.db2.gz URVYTENSUZOAFX-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2F)c(Cl)n1 ZINC001237804412 1055531841 /nfs/dbraw/zinc/53/18/41/1055531841.db2.gz URVYTENSUZOAFX-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO CCOC(=O)c1ccccc1C[N@H+](C)Cc1ccccc1Cl ZINC001237888110 1055550635 /nfs/dbraw/zinc/55/06/35/1055550635.db2.gz PBRIJDPYMBSCGV-UHFFFAOYSA-N 1 2 317.816 4.149 20 0 DIADLO CCOC(=O)c1ccccc1C[N@@H+](C)Cc1ccccc1Cl ZINC001237888110 1055550645 /nfs/dbraw/zinc/55/06/45/1055550645.db2.gz PBRIJDPYMBSCGV-UHFFFAOYSA-N 1 2 317.816 4.149 20 0 DIADLO CCOc1cc(F)cc(C[N@H+](C)Cc2cccc(F)c2F)c1 ZINC001237924007 1055561072 /nfs/dbraw/zinc/56/10/72/1055561072.db2.gz PJLKJRPWYGIXPZ-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CCOc1cc(F)cc(C[N@@H+](C)Cc2cccc(F)c2F)c1 ZINC001237924007 1055561087 /nfs/dbraw/zinc/56/10/87/1055561087.db2.gz PJLKJRPWYGIXPZ-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO Oc1c(F)cc(C[N@@H+]2CC[C@H](c3ccccc3)C2)cc1Cl ZINC001237984498 1055574113 /nfs/dbraw/zinc/57/41/13/1055574113.db2.gz QKAPNHKHRKDJHB-AWEZNQCLSA-N 1 2 305.780 4.174 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CC[C@H](c3ccccc3)C2)cc1Cl ZINC001237984498 1055574122 /nfs/dbraw/zinc/57/41/22/1055574122.db2.gz QKAPNHKHRKDJHB-AWEZNQCLSA-N 1 2 305.780 4.174 20 0 DIADLO Oc1c(F)cc(C[N@@H+]2CC[C@H](c3ccccc3F)C2)cc1Cl ZINC001237989954 1055578893 /nfs/dbraw/zinc/57/88/93/1055578893.db2.gz PMWYFMNGYYIZHS-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CC[C@H](c3ccccc3F)C2)cc1Cl ZINC001237989954 1055578904 /nfs/dbraw/zinc/57/89/04/1055578904.db2.gz PMWYFMNGYYIZHS-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO Cc1cc(C[NH2+]C2(C(F)F)CCCC2)ccc1Br ZINC001620956018 1055579836 /nfs/dbraw/zinc/57/98/36/1055579836.db2.gz CCNGPLFGVMKSIM-UHFFFAOYSA-N 1 2 318.205 4.425 20 0 DIADLO Clc1cncc(C[NH+]2CCC(c3ccncc3)CC2)c1Cl ZINC001238007815 1055580618 /nfs/dbraw/zinc/58/06/18/1055580618.db2.gz DQKIFQLBCMXASR-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO C[N@H+](Cc1[nH]nc2cc(Cl)ccc21)Cc1cccc(F)c1F ZINC001238006001 1055582528 /nfs/dbraw/zinc/58/25/28/1055582528.db2.gz WXEXWFUNMXLUCM-UHFFFAOYSA-N 1 2 321.758 4.127 20 0 DIADLO C[N@@H+](Cc1[nH]nc2cc(Cl)ccc21)Cc1cccc(F)c1F ZINC001238006001 1055582535 /nfs/dbraw/zinc/58/25/35/1055582535.db2.gz WXEXWFUNMXLUCM-UHFFFAOYSA-N 1 2 321.758 4.127 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)n1 ZINC000921614081 1055582850 /nfs/dbraw/zinc/58/28/50/1055582850.db2.gz MGLHTVRFYITLMU-CQSZACIVSA-N 1 2 304.821 4.403 20 0 DIADLO Clc1cncc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c1Cl ZINC001238010412 1055583716 /nfs/dbraw/zinc/58/37/16/1055583716.db2.gz ZUTHXYPKVKGCCE-AWEZNQCLSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cncc(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c1Cl ZINC001238010412 1055583731 /nfs/dbraw/zinc/58/37/31/1055583731.db2.gz ZUTHXYPKVKGCCE-AWEZNQCLSA-N 1 2 323.223 4.042 20 0 DIADLO Fc1cc(Cl)c(C[NH+]2CCC(c3ccccc3F)CC2)cn1 ZINC001238023378 1055587120 /nfs/dbraw/zinc/58/71/20/1055587120.db2.gz HWSIXDKOPMOHCK-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Cc1ccc(-c2nnc(C[N@@H+](C)[C@@H](C)c3cccs3)o2)cc1 ZINC000025931422 1055588237 /nfs/dbraw/zinc/58/82/37/1055588237.db2.gz ZVIRVYUFOOSNTG-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(-c2nnc(C[N@H+](C)[C@@H](C)c3cccs3)o2)cc1 ZINC000025931422 1055588250 /nfs/dbraw/zinc/58/82/50/1055588250.db2.gz ZVIRVYUFOOSNTG-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO COc1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@@](C)(F)C2)c1 ZINC001238047356 1055592621 /nfs/dbraw/zinc/59/26/21/1055592621.db2.gz FVKXZLFSTOECJN-CQSZACIVSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@](C)(F)C2)c1 ZINC001238047356 1055592635 /nfs/dbraw/zinc/59/26/35/1055592635.db2.gz FVKXZLFSTOECJN-CQSZACIVSA-N 1 2 305.315 4.038 20 0 DIADLO Fc1cc(Br)c(F)c(C[NH+]2CCCCCC2)c1 ZINC001238075558 1055601111 /nfs/dbraw/zinc/60/11/11/1055601111.db2.gz POASYMHAQCNVTN-UHFFFAOYSA-N 1 2 304.178 4.103 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2ncccn2)cc(C)c1Cl ZINC001238091791 1055606273 /nfs/dbraw/zinc/60/62/73/1055606273.db2.gz IQAJCFAIJZWNJU-HNNXBMFYSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2ncccn2)cc(C)c1Cl ZINC001238091791 1055606279 /nfs/dbraw/zinc/60/62/79/1055606279.db2.gz IQAJCFAIJZWNJU-HNNXBMFYSA-N 1 2 301.821 4.084 20 0 DIADLO COc1cnc(F)c(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)c1 ZINC001238126710 1055608177 /nfs/dbraw/zinc/60/81/77/1055608177.db2.gz QLLDWLGRTOTSBJ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cnc(F)c(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)c1 ZINC001238126710 1055608184 /nfs/dbraw/zinc/60/81/84/1055608184.db2.gz QLLDWLGRTOTSBJ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO C[N@H+](Cc1cc(Cl)c(O)cc1F)[C@H]1CCc2ccccc21 ZINC001238151256 1055611275 /nfs/dbraw/zinc/61/12/75/1055611275.db2.gz AKTFQCUOMWSNRX-INIZCTEOSA-N 1 2 305.780 4.304 20 0 DIADLO C[N@@H+](Cc1cc(Cl)c(O)cc1F)[C@H]1CCc2ccccc21 ZINC001238151256 1055611282 /nfs/dbraw/zinc/61/12/82/1055611282.db2.gz AKTFQCUOMWSNRX-INIZCTEOSA-N 1 2 305.780 4.304 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1cncc(C2CC2)c1 ZINC001238187423 1055615977 /nfs/dbraw/zinc/61/59/77/1055615977.db2.gz APMUXZFQEDJIMH-UHFFFAOYSA-N 1 2 308.425 4.052 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1cncc(C2CC2)c1 ZINC001238187423 1055615982 /nfs/dbraw/zinc/61/59/82/1055615982.db2.gz APMUXZFQEDJIMH-UHFFFAOYSA-N 1 2 308.425 4.052 20 0 DIADLO CC(C)(C)[C@H](CO)Nc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1 ZINC001168561814 1055619043 /nfs/dbraw/zinc/61/90/43/1055619043.db2.gz BQAGUNQKSMWZES-KRWDZBQOSA-N 1 2 309.413 4.049 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2cccc(-c3cccs3)n2)C[C@@H]1F ZINC001238211860 1055621299 /nfs/dbraw/zinc/62/12/99/1055621299.db2.gz SVJWYHHZZSQIEW-HOTGVXAUSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2cccc(-c3cccs3)n2)C[C@@H]1F ZINC001238211860 1055621308 /nfs/dbraw/zinc/62/13/08/1055621308.db2.gz SVJWYHHZZSQIEW-HOTGVXAUSA-N 1 2 308.397 4.082 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCc4ccccc4C3)cs2)o1 ZINC000029692014 1055623278 /nfs/dbraw/zinc/62/32/78/1055623278.db2.gz ZHVRDUGREDMRIY-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCc4ccccc4C3)cs2)o1 ZINC000029692014 1055623283 /nfs/dbraw/zinc/62/32/83/1055623283.db2.gz ZHVRDUGREDMRIY-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1csc2ccccc12 ZINC000029912402 1055624954 /nfs/dbraw/zinc/62/49/54/1055624954.db2.gz LJDZIESRLLCUPN-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@H+](C)Cc2ccco2)c(Cl)c1 ZINC000030277022 1055627034 /nfs/dbraw/zinc/62/70/34/1055627034.db2.gz WQWWPWFICJHCLG-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)[N@@H+](C)Cc2ccco2)c(Cl)c1 ZINC000030277022 1055627040 /nfs/dbraw/zinc/62/70/40/1055627040.db2.gz WQWWPWFICJHCLG-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO C[C@H]1CC[N@@H+]1Cc1c(F)c(F)ccc1OCc1ccccc1 ZINC001238301254 1055636189 /nfs/dbraw/zinc/63/61/89/1055636189.db2.gz TWKPTYJOODLBTP-ZDUSSCGKSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@H]1CC[N@H+]1Cc1c(F)c(F)ccc1OCc1ccccc1 ZINC001238301254 1055636196 /nfs/dbraw/zinc/63/61/96/1055636196.db2.gz TWKPTYJOODLBTP-ZDUSSCGKSA-N 1 2 303.352 4.138 20 0 DIADLO CCCCC[C@H]1CCCN1C(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001595874052 1055643591 /nfs/dbraw/zinc/64/35/91/1055643591.db2.gz IZKSQFQEHOBNDO-IRXDYDNUSA-N 1 2 305.466 4.042 20 0 DIADLO COc1c(Cl)ccc(F)c1C[NH+]1CC(c2ccccc2)C1 ZINC001238346769 1055643654 /nfs/dbraw/zinc/64/36/54/1055643654.db2.gz QRLIUNQDZJRLDI-UHFFFAOYSA-N 1 2 305.780 4.087 20 0 DIADLO CCC1CC[NH+](Cc2c(Cl)cncc2Br)CC1 ZINC001238387487 1055648802 /nfs/dbraw/zinc/64/88/02/1055648802.db2.gz RKFMYQCAGKXWER-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO Cc1cc(C[N@@H+](CC(=O)c2ccccc2)C(C)C)ncc1Cl ZINC001238424119 1055655221 /nfs/dbraw/zinc/65/52/21/1055655221.db2.gz VRHOIVNUTURXGC-UHFFFAOYSA-N 1 2 316.832 4.137 20 0 DIADLO Cc1cc(C[N@H+](CC(=O)c2ccccc2)C(C)C)ncc1Cl ZINC001238424119 1055655227 /nfs/dbraw/zinc/65/52/27/1055655227.db2.gz VRHOIVNUTURXGC-UHFFFAOYSA-N 1 2 316.832 4.137 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1ncc(C)cc1C ZINC001238436490 1055660409 /nfs/dbraw/zinc/66/04/09/1055660409.db2.gz VWOWJACFXKRKHP-IBGZPJMESA-N 1 2 310.441 4.182 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ncc(C)cc1C ZINC001238436490 1055660416 /nfs/dbraw/zinc/66/04/16/1055660416.db2.gz VWOWJACFXKRKHP-IBGZPJMESA-N 1 2 310.441 4.182 20 0 DIADLO CC(C)Oc1ccc(C[N@H+](C)Cc2ccccc2F)c(F)c1 ZINC001238450961 1055661043 /nfs/dbraw/zinc/66/10/43/1055661043.db2.gz GEAHVGLTWZIGBV-UHFFFAOYSA-N 1 2 305.368 4.384 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+](C)Cc2ccccc2F)c(F)c1 ZINC001238450961 1055661052 /nfs/dbraw/zinc/66/10/52/1055661052.db2.gz GEAHVGLTWZIGBV-UHFFFAOYSA-N 1 2 305.368 4.384 20 0 DIADLO C[C@@H]1CC[N@@H+]1Cc1c(F)ccc(OCc2ccccc2)c1F ZINC001238471593 1055666777 /nfs/dbraw/zinc/66/67/77/1055666777.db2.gz ATBKCUYHVDOKMO-CYBMUJFWSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@@H]1CC[N@H+]1Cc1c(F)ccc(OCc2ccccc2)c1F ZINC001238471593 1055666778 /nfs/dbraw/zinc/66/67/78/1055666778.db2.gz ATBKCUYHVDOKMO-CYBMUJFWSA-N 1 2 303.352 4.138 20 0 DIADLO COc1cnc(C[N@@H+]2Cc3ccccc3C(C)(C)C2)c(Cl)c1 ZINC001238494526 1055671838 /nfs/dbraw/zinc/67/18/38/1055671838.db2.gz OMLGCWURKYNKDA-UHFFFAOYSA-N 1 2 316.832 4.037 20 0 DIADLO COc1cnc(C[N@H+]2Cc3ccccc3C(C)(C)C2)c(Cl)c1 ZINC001238494526 1055671845 /nfs/dbraw/zinc/67/18/45/1055671845.db2.gz OMLGCWURKYNKDA-UHFFFAOYSA-N 1 2 316.832 4.037 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1ccc(F)c(C2CC2)c1 ZINC001238497269 1055673470 /nfs/dbraw/zinc/67/34/70/1055673470.db2.gz BXAIQGUISGWALK-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1ccc(F)c(C2CC2)c1 ZINC001238497269 1055673474 /nfs/dbraw/zinc/67/34/74/1055673474.db2.gz BXAIQGUISGWALK-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO O=C1CC[N@@H+](Cc2ccc(F)c(C3CC3)c2)[C@@H]2CCCC[C@@H]12 ZINC001238496975 1055674205 /nfs/dbraw/zinc/67/42/05/1055674205.db2.gz AXSKIRZBRBGVHW-CRAIPNDOSA-N 1 2 301.405 4.037 20 0 DIADLO O=C1CC[N@H+](Cc2ccc(F)c(C3CC3)c2)[C@@H]2CCCC[C@@H]12 ZINC001238496975 1055674207 /nfs/dbraw/zinc/67/42/07/1055674207.db2.gz AXSKIRZBRBGVHW-CRAIPNDOSA-N 1 2 301.405 4.037 20 0 DIADLO Cc1c(Cl)ccc(C[N@H+](C)Cc2ccc(Cl)nc2)c1F ZINC001238518566 1055678278 /nfs/dbraw/zinc/67/82/78/1055678278.db2.gz UGHIFQFPGXBRBB-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1c(Cl)ccc(C[N@@H+](C)Cc2ccc(Cl)nc2)c1F ZINC001238518566 1055678284 /nfs/dbraw/zinc/67/82/84/1055678284.db2.gz UGHIFQFPGXBRBB-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO CC(C)c1ccccc1NC(=O)[C@H](C)[N@H+](C)CCC(F)(F)F ZINC000104678116 1055678698 /nfs/dbraw/zinc/67/86/98/1055678698.db2.gz RWSHDDFNMQEPIR-LBPRGKRZSA-N 1 2 316.367 4.021 20 0 DIADLO CC(C)c1ccccc1NC(=O)[C@H](C)[N@@H+](C)CCC(F)(F)F ZINC000104678116 1055678701 /nfs/dbraw/zinc/67/87/01/1055678701.db2.gz RWSHDDFNMQEPIR-LBPRGKRZSA-N 1 2 316.367 4.021 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1cc(C)ccc1Cl)CC2 ZINC001238568487 1055688865 /nfs/dbraw/zinc/68/88/65/1055688865.db2.gz HKEQSAGCJVNMQP-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1cc(C)ccc1Cl)CC2 ZINC001238568487 1055688871 /nfs/dbraw/zinc/68/88/71/1055688871.db2.gz HKEQSAGCJVNMQP-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO Cc1cnc(-c2ccccc2)c(C[N@@H+]2CCC(F)(F)[C@@H](F)C2)c1 ZINC001238615925 1055696171 /nfs/dbraw/zinc/69/61/71/1055696171.db2.gz ACAQCHGEFKHOMN-INIZCTEOSA-N 1 2 320.358 4.236 20 0 DIADLO Cc1cnc(-c2ccccc2)c(C[N@H+]2CCC(F)(F)[C@@H](F)C2)c1 ZINC001238615925 1055696179 /nfs/dbraw/zinc/69/61/79/1055696179.db2.gz ACAQCHGEFKHOMN-INIZCTEOSA-N 1 2 320.358 4.236 20 0 DIADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@H]2C)cnc1-c1ccccc1 ZINC001238614646 1055698206 /nfs/dbraw/zinc/69/82/06/1055698206.db2.gz JWEMDNYPEWTMIV-QGZVFWFLSA-N 1 2 317.436 4.435 20 0 DIADLO Cc1cc(C[N@H+]2CCn3cccc3[C@H]2C)cnc1-c1ccccc1 ZINC001238614646 1055698212 /nfs/dbraw/zinc/69/82/12/1055698212.db2.gz JWEMDNYPEWTMIV-QGZVFWFLSA-N 1 2 317.436 4.435 20 0 DIADLO C[C@@H]1CC[C@@](C)(/C=C/C(=O)Nc2ccn3cc[nH+]c3c2)C1(C)C ZINC001596391617 1055704339 /nfs/dbraw/zinc/70/43/39/1055704339.db2.gz MAJPKGRZVLFSET-UEIMZZDVSA-N 1 2 311.429 4.291 20 0 DIADLO FC(F)C1C[NH+](Cc2cc(-c3ccccc3)ncc2Cl)C1 ZINC001238635079 1055707470 /nfs/dbraw/zinc/70/74/70/1055707470.db2.gz ZADCZIXWJLLCDV-UHFFFAOYSA-N 1 2 308.759 4.099 20 0 DIADLO CCc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)s1 ZINC001565581272 1055711914 /nfs/dbraw/zinc/71/19/14/1055711914.db2.gz BTIUEIPSJDJQMP-UHFFFAOYSA-N 1 2 311.410 4.057 20 0 DIADLO CC(C)Oc1cc(F)ccc1C[N@@H+]1CCc2sccc2C1 ZINC001238696691 1055726040 /nfs/dbraw/zinc/72/60/40/1055726040.db2.gz ZYQKJZKIDUNJAT-UHFFFAOYSA-N 1 2 305.418 4.233 20 0 DIADLO CC(C)Oc1cc(F)ccc1C[N@H+]1CCc2sccc2C1 ZINC001238696691 1055726051 /nfs/dbraw/zinc/72/60/51/1055726051.db2.gz ZYQKJZKIDUNJAT-UHFFFAOYSA-N 1 2 305.418 4.233 20 0 DIADLO CCn1c(C)cc2c1CCC[C@@H]2[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000921638680 1055727135 /nfs/dbraw/zinc/72/71/35/1055727135.db2.gz DZABDSUUKPIXTJ-HNNXBMFYSA-N 1 2 315.461 4.269 20 0 DIADLO CC[C@H](C)c1ccccc1Nc1ccc[nH+]c1N1CCOCC1 ZINC001212358230 1055729653 /nfs/dbraw/zinc/72/96/53/1055729653.db2.gz ABIWGBRDWCZQDZ-HNNXBMFYSA-N 1 2 311.429 4.175 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1cc(C)cnc1SC ZINC001238719444 1055732179 /nfs/dbraw/zinc/73/21/79/1055732179.db2.gz ZKFHWTFLDZQRRU-UHFFFAOYSA-N 1 2 304.434 4.273 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1cc(C)cnc1SC ZINC001238719444 1055732190 /nfs/dbraw/zinc/73/21/90/1055732190.db2.gz ZKFHWTFLDZQRRU-UHFFFAOYSA-N 1 2 304.434 4.273 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccc(C(C)C)nc2Cl)cc1 ZINC001238721112 1055733963 /nfs/dbraw/zinc/73/39/63/1055733963.db2.gz FGZYEPHOGQEPLR-UHFFFAOYSA-N 1 2 318.848 4.499 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccc(C(C)C)nc2Cl)cc1 ZINC001238721112 1055733974 /nfs/dbraw/zinc/73/39/74/1055733974.db2.gz FGZYEPHOGQEPLR-UHFFFAOYSA-N 1 2 318.848 4.499 20 0 DIADLO CC(C)c1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)c(Cl)n1 ZINC001238729911 1055734766 /nfs/dbraw/zinc/73/47/66/1055734766.db2.gz YQQWVNQHXZZFBQ-NSHDSACASA-N 1 2 306.759 4.243 20 0 DIADLO CC(C)c1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C2)c(Cl)n1 ZINC001238729911 1055734775 /nfs/dbraw/zinc/73/47/75/1055734775.db2.gz YQQWVNQHXZZFBQ-NSHDSACASA-N 1 2 306.759 4.243 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2nccs2)cc(C)c1OC(C)C ZINC001238751946 1055739467 /nfs/dbraw/zinc/73/94/67/1055739467.db2.gz OUFSZDPGUNQMHI-UHFFFAOYSA-N 1 2 304.459 4.179 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2nccs2)cc(C)c1OC(C)C ZINC001238751946 1055739480 /nfs/dbraw/zinc/73/94/80/1055739480.db2.gz OUFSZDPGUNQMHI-UHFFFAOYSA-N 1 2 304.459 4.179 20 0 DIADLO COc1cc(C)c(C)cc1C[N@@H+](C)Cc1cnc(Cl)s1 ZINC001238760209 1055742246 /nfs/dbraw/zinc/74/22/46/1055742246.db2.gz SHVLCYKRJKGTGI-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COc1cc(C)c(C)cc1C[N@H+](C)Cc1cnc(Cl)s1 ZINC001238760209 1055742237 /nfs/dbraw/zinc/74/22/37/1055742237.db2.gz SHVLCYKRJKGTGI-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@@H](C)c3ccc(Cl)cc3)ccn12 ZINC001596757111 1055743498 /nfs/dbraw/zinc/74/34/98/1055743498.db2.gz HYVAUFNPJWKRMY-LBPRGKRZSA-N 1 2 314.772 4.214 20 0 DIADLO CCc1cccc(C)c1NC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000047239410 1055754345 /nfs/dbraw/zinc/75/43/45/1055754345.db2.gz YAOXUEZXKRSWHS-UHFFFAOYSA-N 1 2 319.408 4.055 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H]3CC[C@H]3c3ccc(F)cc3)cc2[nH+]1 ZINC001566329602 1055762409 /nfs/dbraw/zinc/76/24/09/1055762409.db2.gz DGNRKQIYCKPJIW-JKSUJKDBSA-N 1 2 323.371 4.143 20 0 DIADLO CNc1cc(-c2cnc(OCc3ccccc3)cc2C)cc[nH+]1 ZINC001238875535 1055775213 /nfs/dbraw/zinc/77/52/13/1055775213.db2.gz ITZZTSLUSCZDTK-UHFFFAOYSA-N 1 2 305.381 4.073 20 0 DIADLO CC(C)Oc1cnc(F)c(-c2cc(F)c(C[NH+](C)C)c(F)c2)c1 ZINC001238906821 1055787331 /nfs/dbraw/zinc/78/73/31/1055787331.db2.gz GJKZLWMIMAALEA-UHFFFAOYSA-N 1 2 324.346 4.015 20 0 DIADLO CC(C)Oc1cnc(F)c(-c2ccc(-c3c[nH+]cn3C)cc2)c1 ZINC001238904377 1055787494 /nfs/dbraw/zinc/78/74/94/1055787494.db2.gz OMFXCIPGUNWMOT-UHFFFAOYSA-N 1 2 311.360 4.075 20 0 DIADLO Cc1cccc2cccc(Nc3ccc[nH+]c3N3CCOCC3)c12 ZINC001212368605 1055788614 /nfs/dbraw/zinc/78/86/14/1055788614.db2.gz GOPSJVDYCUMPAV-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO COc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1OC(C)C ZINC001238931859 1055794749 /nfs/dbraw/zinc/79/47/49/1055794749.db2.gz PBXZXWMGWBNCFG-UHFFFAOYSA-N 1 2 322.408 4.394 20 0 DIADLO C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001567346140 1055800024 /nfs/dbraw/zinc/80/00/24/1055800024.db2.gz OAPWLADBDAUABQ-BFUOFWGJSA-N 1 2 319.408 4.006 20 0 DIADLO Cc1ccc(-c2cccc(Cl)c2F)c(C[NH+]2CCOCC2)c1 ZINC001238960499 1055804478 /nfs/dbraw/zinc/80/44/78/1055804478.db2.gz QSLYMVRQZCVJMS-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC001539234538 1055806532 /nfs/dbraw/zinc/80/65/32/1055806532.db2.gz NXMRRLDUQABMIL-CQSZACIVSA-N 1 2 321.380 4.019 20 0 DIADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC001539234538 1055806541 /nfs/dbraw/zinc/80/65/41/1055806541.db2.gz NXMRRLDUQABMIL-CQSZACIVSA-N 1 2 321.380 4.019 20 0 DIADLO C[C@@H](CCNC(=O)c1ccc(-n2cc[nH+]c2)cc1)CC(C)(C)C ZINC001567622363 1055811130 /nfs/dbraw/zinc/81/11/30/1055811130.db2.gz XSSBKTWLSYIROT-HNNXBMFYSA-N 1 2 313.445 4.065 20 0 DIADLO Cc1cc(-c2ccc(OC(C)C)c(C(F)(F)F)c2)c[nH+]c1N ZINC001238999535 1055817781 /nfs/dbraw/zinc/81/77/81/1055817781.db2.gz VGCBBSVKCUHXKH-UHFFFAOYSA-N 1 2 310.319 4.445 20 0 DIADLO C[C@@H]1CCCC[C@@H]1OCC[NH+](Cc1ccco1)Cc1ccco1 ZINC000058932462 1055820845 /nfs/dbraw/zinc/82/08/45/1055820845.db2.gz AHOWQXWCBVWERP-APWZRJJASA-N 1 2 317.429 4.470 20 0 DIADLO Cc1cc(C)c(CNC(=O)CCc2ccc3ccccc3c2)c[nH+]1 ZINC001597403513 1055824972 /nfs/dbraw/zinc/82/49/72/1055824972.db2.gz TUGGJAGAQVZMGH-UHFFFAOYSA-N 1 2 318.420 4.101 20 0 DIADLO Cc1cc(C)c(CNC(=O)/C=C\[C@]2(C)CC[C@H](C)C2(C)C)c[nH+]1 ZINC001597403831 1055826880 /nfs/dbraw/zinc/82/68/80/1055826880.db2.gz YUGXUPPJZJOHFD-OWWRJGHASA-N 1 2 314.473 4.333 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000060467346 1055837908 /nfs/dbraw/zinc/83/79/08/1055837908.db2.gz UHRKDHCHAASKTF-RDTXWAMCSA-N 1 2 301.817 4.475 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000060467346 1055837912 /nfs/dbraw/zinc/83/79/12/1055837912.db2.gz UHRKDHCHAASKTF-RDTXWAMCSA-N 1 2 301.817 4.475 20 0 DIADLO CC(C)C[C@H](C(=O)NC1CC(C)(C)CC(C)(C)C1)n1cc[nH+]c1 ZINC001597807031 1055878516 /nfs/dbraw/zinc/87/85/16/1055878516.db2.gz XJMUMWZIZLWLJK-MRXNPFEDSA-N 1 2 319.493 4.191 20 0 DIADLO CC(C)CCc1noc(C[N@H+](C)Cc2cccc3ccccc32)n1 ZINC000063507241 1055894517 /nfs/dbraw/zinc/89/45/17/1055894517.db2.gz VVOSLYMSDSFAQW-UHFFFAOYSA-N 1 2 323.440 4.443 20 0 DIADLO CC(C)CCc1noc(C[N@@H+](C)Cc2cccc3ccccc32)n1 ZINC000063507241 1055894528 /nfs/dbraw/zinc/89/45/28/1055894528.db2.gz VVOSLYMSDSFAQW-UHFFFAOYSA-N 1 2 323.440 4.443 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2ccc(F)c3cccnc23)cs1 ZINC000063604328 1055898287 /nfs/dbraw/zinc/89/82/87/1055898287.db2.gz WHQFOOUWUVHSTQ-UHFFFAOYSA-N 1 2 315.417 4.025 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2ccc(F)c3cccnc23)cs1 ZINC000063604328 1055898289 /nfs/dbraw/zinc/89/82/89/1055898289.db2.gz WHQFOOUWUVHSTQ-UHFFFAOYSA-N 1 2 315.417 4.025 20 0 DIADLO Cc1cccc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c1 ZINC001239492035 1055905799 /nfs/dbraw/zinc/90/57/99/1055905799.db2.gz OJUOAFPMDRDYBI-UHFFFAOYSA-N 1 2 304.393 4.305 20 0 DIADLO Cc1cccc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c1 ZINC001239492035 1055905812 /nfs/dbraw/zinc/90/58/12/1055905812.db2.gz OJUOAFPMDRDYBI-UHFFFAOYSA-N 1 2 304.393 4.305 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2csc(C3CCCC3)n2)cc1 ZINC000063993153 1055908561 /nfs/dbraw/zinc/90/85/61/1055908561.db2.gz NPJXYBMOCYMODL-UHFFFAOYSA-N 1 2 316.470 4.441 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2csc(C3CCCC3)n2)cc1 ZINC000063993153 1055908570 /nfs/dbraw/zinc/90/85/70/1055908570.db2.gz NPJXYBMOCYMODL-UHFFFAOYSA-N 1 2 316.470 4.441 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cc(F)cc2ccoc21 ZINC001598078297 1055912693 /nfs/dbraw/zinc/91/26/93/1055912693.db2.gz XJHFPHSHMPXDML-UHFFFAOYSA-N 1 2 321.311 4.214 20 0 DIADLO c1ccc2c(c1)cccc2[C@@H]1CCC[N@H+]1Cc1noc(C2CC2)n1 ZINC000064637259 1055922517 /nfs/dbraw/zinc/92/25/17/1055922517.db2.gz XNHKZFKKLGYPFJ-SFHVURJKSA-N 1 2 319.408 4.437 20 0 DIADLO c1ccc2c(c1)cccc2[C@@H]1CCC[N@@H+]1Cc1noc(C2CC2)n1 ZINC000064637259 1055922525 /nfs/dbraw/zinc/92/25/25/1055922525.db2.gz XNHKZFKKLGYPFJ-SFHVURJKSA-N 1 2 319.408 4.437 20 0 DIADLO CCc1cnc(C[N@H+](C)C[C@H]2CC[C@@H](c3ccccc3)O2)s1 ZINC001615743778 1055933428 /nfs/dbraw/zinc/93/34/28/1055933428.db2.gz HBYXFWUJXCCKNQ-WBVHZDCISA-N 1 2 316.470 4.058 20 0 DIADLO CCc1cnc(C[N@@H+](C)C[C@H]2CC[C@@H](c3ccccc3)O2)s1 ZINC001615743778 1055933437 /nfs/dbraw/zinc/93/34/37/1055933437.db2.gz HBYXFWUJXCCKNQ-WBVHZDCISA-N 1 2 316.470 4.058 20 0 DIADLO Cc1ccccc1Oc1cccc(NC(=O)CCc2[nH]cc[nH+]2)c1 ZINC001598372721 1055943279 /nfs/dbraw/zinc/94/32/79/1055943279.db2.gz HIVBYIDACSMYGZ-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1ccc2ccc(-c3ccc(C[NH+]4CCOCC4)nc3)cc2c1 ZINC001239590347 1055967584 /nfs/dbraw/zinc/96/75/84/1055967584.db2.gz ACXKEPOOQGSGNA-UHFFFAOYSA-N 1 2 318.420 4.042 20 0 DIADLO C[C@@H]1CCN(C(=O)CCC2CCCCCC2)C[C@@H]1n1cc[nH+]c1 ZINC000654893793 1055985961 /nfs/dbraw/zinc/98/59/61/1055985961.db2.gz UGDMQTKEXFETKS-AEFFLSMTSA-N 1 2 317.477 4.043 20 0 DIADLO Cc1cc(NCc2cccc3[nH+]ccn32)ccc1Br ZINC001620732905 1055988983 /nfs/dbraw/zinc/98/89/83/1055988983.db2.gz IRINZDWUFSSPRR-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO CCOc1cc(F)cc(C[NH2+][C@@H](CF)c2ccc(F)cc2)c1 ZINC001621040237 1056000905 /nfs/dbraw/zinc/00/09/05/1056000905.db2.gz PSKSEMCTJOUPKM-KRWDZBQOSA-N 1 2 309.331 4.164 20 0 DIADLO F[C@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1nccc2c1CCCC2 ZINC001621043504 1056004032 /nfs/dbraw/zinc/00/40/32/1056004032.db2.gz IXCMEKCZWWPOIA-ICSRJNTNSA-N 1 2 310.416 4.076 20 0 DIADLO COc1cccc(Cn2c3ccccc3[nH+]c2NCC(C)C)c1 ZINC001621050970 1056010108 /nfs/dbraw/zinc/01/01/08/1056010108.db2.gz IEFUXSABFSZKMD-UHFFFAOYSA-N 1 2 309.413 4.161 20 0 DIADLO CC(C)CCn1c2ccccc2[nH+]c1NCc1cncs1 ZINC001621051993 1056010507 /nfs/dbraw/zinc/01/05/07/1056010507.db2.gz BQPRKJRJJFRWSL-UHFFFAOYSA-N 1 2 300.431 4.151 20 0 DIADLO O=C(Nc1cccc(CNc2cccc[nH+]2)c1)C1CCCCC1 ZINC000068999112 1056019611 /nfs/dbraw/zinc/01/96/11/1056019611.db2.gz NZPPQGMIDLBCSY-UHFFFAOYSA-N 1 2 309.413 4.213 20 0 DIADLO CCc1cc(C[NH2+]Cc2ccc(-c3ccc(CC)cc3)o2)on1 ZINC000072922996 1056034198 /nfs/dbraw/zinc/03/41/98/1056034198.db2.gz ASTJXKZARMUJMY-UHFFFAOYSA-N 1 2 310.397 4.349 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000073712953 1056045936 /nfs/dbraw/zinc/04/59/36/1056045936.db2.gz IUWCFIYCTUWMCX-INIZCTEOSA-N 1 2 307.825 4.162 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000073712951 1056046748 /nfs/dbraw/zinc/04/67/48/1056046748.db2.gz IUWCFIYCTUWMCX-MRXNPFEDSA-N 1 2 307.825 4.162 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cncc(Oc2ccccc2)c1 ZINC001239751856 1056057414 /nfs/dbraw/zinc/05/74/14/1056057414.db2.gz OKOXDXGICKHIDZ-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3CCCC[C@H]3C)c2)[nH+]c1C ZINC001583354568 1056069381 /nfs/dbraw/zinc/06/93/81/1056069381.db2.gz GAIZPNSMDBZJFK-PXAZEXFGSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CCCC[C@@H]3C)c2)[nH+]c1C ZINC001583354571 1056069609 /nfs/dbraw/zinc/06/96/09/1056069609.db2.gz GAIZPNSMDBZJFK-YVEFUNNKSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2noc(-c3ccsc3)n2)cc1 ZINC000127145469 1056083507 /nfs/dbraw/zinc/08/35/07/1056083507.db2.gz FJFZRIFXGCHKHO-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2noc(-c3ccsc3)n2)cc1 ZINC000127145469 1056083521 /nfs/dbraw/zinc/08/35/21/1056083521.db2.gz FJFZRIFXGCHKHO-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO C/C(=C\C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1C ZINC001541009420 1056088905 /nfs/dbraw/zinc/08/89/05/1056088905.db2.gz HXWRUNSYXMJRJJ-FOWTUZBSSA-N 1 2 317.392 4.223 20 0 DIADLO c1ccc(COc2ccccc2-c2cc[nH+]c3c2CCN3)cc1 ZINC001239832346 1056099551 /nfs/dbraw/zinc/09/95/51/1056099551.db2.gz YITVCHWLYVBZHV-UHFFFAOYSA-N 1 2 302.377 4.296 20 0 DIADLO Cc1cc(C)c(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)s1 ZINC001611250836 1056129983 /nfs/dbraw/zinc/12/99/83/1056129983.db2.gz BWDREXCZDWMBJB-UHFFFAOYSA-N 1 2 311.410 4.316 20 0 DIADLO CC(C)CNC(=O)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001239914117 1056155203 /nfs/dbraw/zinc/15/52/03/1056155203.db2.gz RYOWFYBSEKADJK-UHFFFAOYSA-N 1 2 319.408 4.130 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@@H](C)c1cccnc1Cl)CCC2 ZINC000765812451 1056158057 /nfs/dbraw/zinc/15/80/57/1056158057.db2.gz AXYBMZCQHZBJRQ-SWLSCSKDSA-N 1 2 318.852 4.241 20 0 DIADLO Cc1cc[nH+]c(C)c1-c1ccc(C(=O)NC2CCCCC2)cc1 ZINC001239918189 1056158941 /nfs/dbraw/zinc/15/89/41/1056158941.db2.gz XUUYRCJFFXDEET-UHFFFAOYSA-N 1 2 308.425 4.428 20 0 DIADLO Cc1cccc([C@@H](C)C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)c1 ZINC001542875386 1056161016 /nfs/dbraw/zinc/16/10/16/1056161016.db2.gz FAFWWDVHLURMBG-MRXNPFEDSA-N 1 2 319.408 4.231 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3CCC(F)(F)C3)cc2)[nH+]c1C ZINC000921657784 1056168531 /nfs/dbraw/zinc/16/85/31/1056168531.db2.gz AUZISXWGIVYYBQ-ZDUSSCGKSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3cc(C(C)C)on3)cc2)[nH+]c1C ZINC000921664356 1056172642 /nfs/dbraw/zinc/17/26/42/1056172642.db2.gz ZHONQGGMMZVWBD-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO Cc1nc(NCCc2ccc3ccccc3c2)c2c([nH+]1)CCCC2 ZINC001611783298 1056190020 /nfs/dbraw/zinc/19/00/20/1056190020.db2.gz KPRBNOSEIVNKJO-UHFFFAOYSA-N 1 2 317.436 4.472 20 0 DIADLO CC[N@H+](C/C=C/Cl)Cc1cc(Br)ccc1F ZINC000058397335 1056191477 /nfs/dbraw/zinc/19/14/77/1056191477.db2.gz MGMBOZWWDYBELI-ZZXKWVIFSA-N 1 2 306.606 4.163 20 0 DIADLO CC[N@@H+](C/C=C/Cl)Cc1cc(Br)ccc1F ZINC000058397335 1056191482 /nfs/dbraw/zinc/19/14/82/1056191482.db2.gz MGMBOZWWDYBELI-ZZXKWVIFSA-N 1 2 306.606 4.163 20 0 DIADLO CC[C@@H](CNc1cc(C)[nH+]c(C2CC2)n1)Oc1cccc(C)c1 ZINC001611815121 1056193060 /nfs/dbraw/zinc/19/30/60/1056193060.db2.gz QKOCYSKMISUTSY-INIZCTEOSA-N 1 2 311.429 4.240 20 0 DIADLO CCCOc1ccc(-c2cc(C)cn3cc[nH+]c23)c(F)c1F ZINC001239968706 1056205533 /nfs/dbraw/zinc/20/55/33/1056205533.db2.gz FUPXHPDZLRMGEB-UHFFFAOYSA-N 1 2 302.324 4.377 20 0 DIADLO CCc1cc(NCCCCOCc2ccccc2)nc(CC)[nH+]1 ZINC001611900667 1056206576 /nfs/dbraw/zinc/20/65/76/1056206576.db2.gz LEWDRQCLHVOBNO-UHFFFAOYSA-N 1 2 313.445 4.010 20 0 DIADLO CCCCc1cc(Nc2ccc(NC3CCCC3)[nH+]c2)ncn1 ZINC001611912044 1056208046 /nfs/dbraw/zinc/20/80/46/1056208046.db2.gz AATOAURMKFZUBP-UHFFFAOYSA-N 1 2 311.433 4.312 20 0 DIADLO CCc1ccc(N(CC)C(=O)[C@@H](CC(C)C)n2cc[nH+]c2)cc1 ZINC001543400725 1056213629 /nfs/dbraw/zinc/21/36/29/1056213629.db2.gz RESSNINSJDJNHI-GOSISDBHSA-N 1 2 313.445 4.086 20 0 DIADLO CCCCNC(=O)c1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001239985021 1056222784 /nfs/dbraw/zinc/22/27/84/1056222784.db2.gz AGSVNTQFPRDDNX-UHFFFAOYSA-N 1 2 319.408 4.069 20 0 DIADLO CCc1cc2c(nc(C)nc2Nc2ccc3c(c2)[nH+]cn3C)s1 ZINC001612042330 1056227770 /nfs/dbraw/zinc/22/77/70/1056227770.db2.gz BYLCNLXAJHRDII-UHFFFAOYSA-N 1 2 323.425 4.192 20 0 DIADLO CCc1cc(N(C)[C@@H](CC)Cc2ccc(C)cc2)nc(CC)[nH+]1 ZINC001612043893 1056228726 /nfs/dbraw/zinc/22/87/26/1056228726.db2.gz YEWSEZSFZKBQSR-SFHVURJKSA-N 1 2 311.473 4.367 20 0 DIADLO CCc1ccc(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)cn1 ZINC000347634902 1056233805 /nfs/dbraw/zinc/23/38/05/1056233805.db2.gz JNMIXVAILLZJFJ-CYBMUJFWSA-N 1 2 311.454 4.447 20 0 DIADLO CCc1ccc(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)cn1 ZINC000347634902 1056233822 /nfs/dbraw/zinc/23/38/22/1056233822.db2.gz JNMIXVAILLZJFJ-CYBMUJFWSA-N 1 2 311.454 4.447 20 0 DIADLO Cc1cc(NC(=O)C2(c3ccc(C(C)C)cc3)CCCC2)cc[nH+]1 ZINC001584004444 1056235435 /nfs/dbraw/zinc/23/54/35/1056235435.db2.gz CESRTBRLMUVAOK-UHFFFAOYSA-N 1 2 322.452 4.386 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(S[C@@H]3CCOc4ccccc43)c12 ZINC001612112298 1056239702 /nfs/dbraw/zinc/23/97/02/1056239702.db2.gz KPQDEJGPFBZSOM-CQSZACIVSA-N 1 2 311.410 4.136 20 0 DIADLO CCN(Cc1ccccc1C)c1nc2ccccc2n2c[nH+]cc12 ZINC001612115209 1056241613 /nfs/dbraw/zinc/24/16/13/1056241613.db2.gz XEGJIGIAWXLFFI-UHFFFAOYSA-N 1 2 316.408 4.217 20 0 DIADLO Cc1cc(N[C@@H]2CCOC3(CCCCC3)C2)nc(C2CCC2)[nH+]1 ZINC001612135487 1056245578 /nfs/dbraw/zinc/24/55/78/1056245578.db2.gz GUHQVJBNQHMJSN-MRXNPFEDSA-N 1 2 315.461 4.346 20 0 DIADLO Cc1cc(NCC2(Cc3ccccc3)CC2)nc(C2CCC2)[nH+]1 ZINC001612157878 1056246515 /nfs/dbraw/zinc/24/65/15/1056246515.db2.gz DCOWUJMHURKIAS-UHFFFAOYSA-N 1 2 307.441 4.487 20 0 DIADLO CC[C@@H](C)[C@@H]1CCCCN1c1nc2ccccc2n2c[nH+]cc12 ZINC001612199774 1056253262 /nfs/dbraw/zinc/25/32/62/1056253262.db2.gz IGIDVEZXTOGMOM-ZBFHGGJFSA-N 1 2 308.429 4.288 20 0 DIADLO Cc1cc(NCCC2C[C@@H](C)O[C@H](C)C2)nc(C2CCC2)[nH+]1 ZINC001612294818 1056268434 /nfs/dbraw/zinc/26/84/34/1056268434.db2.gz SNVYSUJUSZVDTO-ZIAGYGMSSA-N 1 2 303.450 4.058 20 0 DIADLO CCc1cc(N2C[C@H](c3ccccc3)[C@@H]3CCC[C@H]32)nc(CC)[nH+]1 ZINC001612357205 1056276636 /nfs/dbraw/zinc/27/66/36/1056276636.db2.gz CTWPQODKVJLXTD-IPMKNSEASA-N 1 2 321.468 4.374 20 0 DIADLO CCc1cc(N2C[C@H](c3ccccc3)[C@H]3CCC[C@@H]32)nc(CC)[nH+]1 ZINC001612357207 1056277028 /nfs/dbraw/zinc/27/70/28/1056277028.db2.gz CTWPQODKVJLXTD-QRVBRYPASA-N 1 2 321.468 4.374 20 0 DIADLO Cc1cc(CNC(=O)/C=C\[C@]2(C)CC[C@H](C)C2(C)C)cc(C)[nH+]1 ZINC001584183453 1056279998 /nfs/dbraw/zinc/27/99/98/1056279998.db2.gz GPBMNVFYUAMREO-VVUZVMFYSA-N 1 2 314.473 4.333 20 0 DIADLO Cc1c[nH+]c(CCNc2nc3ccc(F)cc3s2)c(C)c1 ZINC001612545656 1056304089 /nfs/dbraw/zinc/30/40/89/1056304089.db2.gz ZUSBIJMAPCVTOY-UHFFFAOYSA-N 1 2 301.390 4.102 20 0 DIADLO Cc1cc(-c2cccc(C(=O)NCc3ccccc3)c2)cc(C)[nH+]1 ZINC001240075768 1056305103 /nfs/dbraw/zinc/30/51/03/1056305103.db2.gz AHLAESMGITWWGM-UHFFFAOYSA-N 1 2 316.404 4.295 20 0 DIADLO CCCCNC(=O)c1cccc(-c2ccc(C(=[NH2+])OCC)cc2)c1 ZINC001240087750 1056314445 /nfs/dbraw/zinc/31/44/45/1056314445.db2.gz PHMSGYYMGQETBS-UHFFFAOYSA-N 1 2 324.424 4.245 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2cccc(C(=O)NCC(C)C)c2)c1 ZINC001240093530 1056319427 /nfs/dbraw/zinc/31/94/27/1056319427.db2.gz STFOPDRRIRMHRO-UHFFFAOYSA-N 1 2 324.424 4.101 20 0 DIADLO O=C(Nc1ccccc1)c1cccc(-c2ccn3cc[nH+]c3c2)c1 ZINC001240112753 1056334842 /nfs/dbraw/zinc/33/48/42/1056334842.db2.gz OHRVAQZFZSFPLD-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO CCc1cc(N[C@@H]2CC3(CCC3)Oc3ccccc32)nc(CC)[nH+]1 ZINC001612894086 1056336903 /nfs/dbraw/zinc/33/69/03/1056336903.db2.gz KDYIPTRLPHUIHK-MRXNPFEDSA-N 1 2 323.440 4.460 20 0 DIADLO CCc1cc(N[C@H]2CC3(CCC3)Oc3ccccc32)nc(CC)[nH+]1 ZINC001612894085 1056336958 /nfs/dbraw/zinc/33/69/58/1056336958.db2.gz KDYIPTRLPHUIHK-INIZCTEOSA-N 1 2 323.440 4.460 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2c2nc3c(cccc3C)s2)[nH+]c1C ZINC001612903240 1056339023 /nfs/dbraw/zinc/33/90/23/1056339023.db2.gz JONCLCUQKIMTSL-ZDUSSCGKSA-N 1 2 312.442 4.286 20 0 DIADLO CC(C)c1[nH]cc(CNc2ncc(C(F)(F)F)cc2Cl)[nH+]1 ZINC001612974435 1056343404 /nfs/dbraw/zinc/34/34/04/1056343404.db2.gz QXJSHMQJSZESBA-UHFFFAOYSA-N 1 2 318.730 4.212 20 0 DIADLO CC(C)c1[nH]c(CNc2ncc(C(F)(F)F)cc2Cl)c[nH+]1 ZINC001612974435 1056343421 /nfs/dbraw/zinc/34/34/21/1056343421.db2.gz QXJSHMQJSZESBA-UHFFFAOYSA-N 1 2 318.730 4.212 20 0 DIADLO COC(=O)c1cc(C[N@H+](C)[C@H](C)c2ccccc2Cl)oc1C ZINC000302875723 1056363708 /nfs/dbraw/zinc/36/37/08/1056363708.db2.gz KXPPDQNDFCQRQP-LLVKDONJSA-N 1 2 321.804 4.221 20 0 DIADLO COC(=O)c1cc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)oc1C ZINC000302875723 1056363715 /nfs/dbraw/zinc/36/37/15/1056363715.db2.gz KXPPDQNDFCQRQP-LLVKDONJSA-N 1 2 321.804 4.221 20 0 DIADLO CC(C)(C)c1cc(-c2ccc3[nH+]ccn3c2)nc(C(C)(C)C)n1 ZINC001240216123 1056373528 /nfs/dbraw/zinc/37/35/28/1056373528.db2.gz CRGWCFCPFTVNJP-UHFFFAOYSA-N 1 2 308.429 4.386 20 0 DIADLO CSc1ccc(C(F)(F)F)nc1-c1ccc2[nH+]ccn2c1 ZINC001240215559 1056373865 /nfs/dbraw/zinc/37/38/65/1056373865.db2.gz ZBPPELLJMSDSTJ-UHFFFAOYSA-N 1 2 309.316 4.137 20 0 DIADLO COC(=O)c1cc2cccc(-c3ccc4[nH+]ccn4c3)c2s1 ZINC001240217903 1056374706 /nfs/dbraw/zinc/37/47/06/1056374706.db2.gz QDQATWZMKMIUDL-UHFFFAOYSA-N 1 2 308.362 4.003 20 0 DIADLO c1cn2cc(-c3ccc(-c4cn5ccsc5n4)cc3)ccc2[nH+]1 ZINC001240218398 1056377206 /nfs/dbraw/zinc/37/72/06/1056377206.db2.gz MJPHQUKOEGRZTA-UHFFFAOYSA-N 1 2 316.389 4.378 20 0 DIADLO Cc1nc2c(cc(-c3ccc4[nH+]ccn4c3)cc2F)n1C(C)C ZINC001240219885 1056378695 /nfs/dbraw/zinc/37/86/95/1056378695.db2.gz YVHCIEWXIYBNAQ-UHFFFAOYSA-N 1 2 308.360 4.379 20 0 DIADLO Cc1cc(OCc2ccccc2)ncc1-c1ccc2[nH+]ccn2c1 ZINC001240222089 1056378821 /nfs/dbraw/zinc/37/88/21/1056378821.db2.gz XBZUNJOFCANVMB-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO Fc1ccc(COc2ccc(-c3ccc4[nH+]ccn4c3)cn2)cc1 ZINC001240222084 1056379369 /nfs/dbraw/zinc/37/93/69/1056379369.db2.gz WXMQBPMASGRZOX-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cc(C)cnc3Cl)CCCC2)n1 ZINC000921738357 1056418584 /nfs/dbraw/zinc/41/85/84/1056418584.db2.gz SAXNNRLQZMZJOH-UHFFFAOYSA-N 1 2 321.877 4.367 20 0 DIADLO Cc1cccc(C[NH2+]Cc2cc(C(C)C)no2)c1Br ZINC000921740943 1056435814 /nfs/dbraw/zinc/43/58/14/1056435814.db2.gz ROAGKCZHNIYWJI-UHFFFAOYSA-N 1 2 323.234 4.159 20 0 DIADLO CCCCS[C@@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001614764094 1056449396 /nfs/dbraw/zinc/44/93/96/1056449396.db2.gz QMSLGPGASFKGHP-AWEZNQCLSA-N 1 2 317.458 4.041 20 0 DIADLO Cc1cc(NC(=O)c2sccc2C2CC2)ccc1-n1cc[nH+]c1 ZINC001614764411 1056449922 /nfs/dbraw/zinc/44/99/22/1056449922.db2.gz YISJJVGYXJHUIZ-UHFFFAOYSA-N 1 2 323.421 4.372 20 0 DIADLO CC[N@H+](Cc1csc(COc2ccc(Cl)cc2)n1)C1CC1 ZINC000061193544 1056495758 /nfs/dbraw/zinc/49/57/58/1056495758.db2.gz KYAKRQVJYAZPJI-UHFFFAOYSA-N 1 2 322.861 4.360 20 0 DIADLO CC[N@@H+](Cc1csc(COc2ccc(Cl)cc2)n1)C1CC1 ZINC000061193544 1056495764 /nfs/dbraw/zinc/49/57/64/1056495764.db2.gz KYAKRQVJYAZPJI-UHFFFAOYSA-N 1 2 322.861 4.360 20 0 DIADLO Cc1c(-c2ccc(C(=O)OC(C)(C)C)cc2)ccc2[nH+]ccn21 ZINC001240441068 1056510923 /nfs/dbraw/zinc/51/09/23/1056510923.db2.gz CEFUEBQFHGRDLB-UHFFFAOYSA-N 1 2 308.381 4.265 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@@H](CC)CC1 ZINC001615496970 1056519464 /nfs/dbraw/zinc/51/94/64/1056519464.db2.gz QBUJTFDCWDBSHV-PBHICJAKSA-N 1 2 323.864 4.456 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H](CC)CC1 ZINC001615496970 1056519476 /nfs/dbraw/zinc/51/94/76/1056519476.db2.gz QBUJTFDCWDBSHV-PBHICJAKSA-N 1 2 323.864 4.456 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2cncc(Cl)c2)[C@@H]1c1ccccc1 ZINC001615524684 1056526736 /nfs/dbraw/zinc/52/67/36/1056526736.db2.gz XGMKJFBPZTVSBK-DYVFJYSZSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2cncc(Cl)c2)[C@@H]1c1ccccc1 ZINC001615524684 1056526739 /nfs/dbraw/zinc/52/67/39/1056526739.db2.gz XGMKJFBPZTVSBK-DYVFJYSZSA-N 1 2 318.873 4.414 20 0 DIADLO CC[C@H]1C[N@H+](CCc2c(Cl)cccc2Cl)C[C@H](C)O1 ZINC001615535387 1056531112 /nfs/dbraw/zinc/53/11/12/1056531112.db2.gz DNSLHXRWLQZNPB-RYUDHWBXSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)C[C@H](C)O1 ZINC001615535387 1056531128 /nfs/dbraw/zinc/53/11/28/1056531128.db2.gz DNSLHXRWLQZNPB-RYUDHWBXSA-N 1 2 302.245 4.035 20 0 DIADLO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1c(F)c(F)c(F)c(F)c1F ZINC001615544801 1056532830 /nfs/dbraw/zinc/53/28/30/1056532830.db2.gz ZZOJITSHPVTIBI-DTWKUNHWSA-N 1 2 307.306 4.393 20 0 DIADLO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1c(F)c(F)c(F)c(F)c1F ZINC001615544801 1056532844 /nfs/dbraw/zinc/53/28/44/1056532844.db2.gz ZZOJITSHPVTIBI-DTWKUNHWSA-N 1 2 307.306 4.393 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2c(F)c(F)c(F)c(F)c2F)C1 ZINC001615544807 1056534856 /nfs/dbraw/zinc/53/48/56/1056534856.db2.gz ZZOJITSHPVTIBI-RKDXNWHRSA-N 1 2 307.306 4.393 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2c(F)c(F)c(F)c(F)c2F)C1 ZINC001615544807 1056534868 /nfs/dbraw/zinc/53/48/68/1056534868.db2.gz ZZOJITSHPVTIBI-RKDXNWHRSA-N 1 2 307.306 4.393 20 0 DIADLO CSc1cnc(-c2ccn3cc[nH+]c3c2)c(C(F)(F)F)c1 ZINC001240496885 1056539109 /nfs/dbraw/zinc/53/91/09/1056539109.db2.gz KSKHXIGJTIJSGK-UHFFFAOYSA-N 1 2 309.316 4.137 20 0 DIADLO Cc1sccc1-c1ccc(-c2ccc(-n3cc[nH+]c3)cc2)nn1 ZINC001240500702 1056540003 /nfs/dbraw/zinc/54/00/03/1056540003.db2.gz OGGZQDYUSCWPKM-UHFFFAOYSA-N 1 2 318.405 4.366 20 0 DIADLO Cc1sccc1-c1ccc(-c2nc3c(o2)CC[N@@H+](C)C3)cc1 ZINC001240504426 1056541677 /nfs/dbraw/zinc/54/16/77/1056541677.db2.gz ZHGRFFYJEFGHOI-UHFFFAOYSA-N 1 2 310.422 4.366 20 0 DIADLO Cc1sccc1-c1ccc(-c2nc3c(o2)CC[N@H+](C)C3)cc1 ZINC001240504426 1056541689 /nfs/dbraw/zinc/54/16/89/1056541689.db2.gz ZHGRFFYJEFGHOI-UHFFFAOYSA-N 1 2 310.422 4.366 20 0 DIADLO CC(C)OCCCNc1ccc2c(c1)[nH+]cn2-c1ccccc1 ZINC001168681322 1056542209 /nfs/dbraw/zinc/54/22/09/1056542209.db2.gz VWVWOYXSKWYPPY-UHFFFAOYSA-N 1 2 309.413 4.253 20 0 DIADLO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cc1ncsc1Br ZINC001615600715 1056543981 /nfs/dbraw/zinc/54/39/81/1056543981.db2.gz NFLKYFVLFSFMKN-JQWIXIFHSA-N 1 2 317.296 4.306 20 0 DIADLO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1ncsc1Br ZINC001615600715 1056543991 /nfs/dbraw/zinc/54/39/91/1056543991.db2.gz NFLKYFVLFSFMKN-JQWIXIFHSA-N 1 2 317.296 4.306 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@@H+]2Cc2ccc(Cl)nn2)o1 ZINC001615584925 1056544280 /nfs/dbraw/zinc/54/42/80/1056544280.db2.gz ZCYNRTIHVRZTAB-OAHLLOKOSA-N 1 2 319.836 4.403 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@H+]2Cc2ccc(Cl)nn2)o1 ZINC001615584925 1056544288 /nfs/dbraw/zinc/54/42/88/1056544288.db2.gz ZCYNRTIHVRZTAB-OAHLLOKOSA-N 1 2 319.836 4.403 20 0 DIADLO Fc1ncc(-c2ccn3cc[nH+]c3c2)cc1OCc1ccccc1 ZINC001240510327 1056544846 /nfs/dbraw/zinc/54/48/46/1056544846.db2.gz HWXOPJQNIUXWKF-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO COc1c(F)cc(-c2ccn3cc[nH+]c3c2)cc1C(F)(F)F ZINC001240513088 1056546670 /nfs/dbraw/zinc/54/66/70/1056546670.db2.gz FWXNNNKIDLXBKQ-UHFFFAOYSA-N 1 2 310.250 4.168 20 0 DIADLO Fc1ccc(CNc2cc3cc[nH]c3c[nH+]2)cc1Br ZINC000672195460 1056561599 /nfs/dbraw/zinc/56/15/99/1056561599.db2.gz UIALKABRGPMAFJ-UHFFFAOYSA-N 1 2 320.165 4.077 20 0 DIADLO Clc1ccc(-n2cc(CNc3cc4cc[nH]c4c[nH+]3)cn2)cc1 ZINC000672219023 1056571425 /nfs/dbraw/zinc/57/14/25/1056571425.db2.gz IIGFEKWLAJQWFK-UHFFFAOYSA-N 1 2 323.787 4.014 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)no1 ZINC000111305500 1056574577 /nfs/dbraw/zinc/57/45/77/1056574577.db2.gz GTTCTQMIJIYBIU-CYBMUJFWSA-N 1 2 319.836 4.010 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)no1 ZINC000111305500 1056574582 /nfs/dbraw/zinc/57/45/82/1056574582.db2.gz GTTCTQMIJIYBIU-CYBMUJFWSA-N 1 2 319.836 4.010 20 0 DIADLO c1cc(-c2cccc(-c3cc[nH+]c(N4CCCCC4)c3)c2)n[nH]1 ZINC001240561408 1056576845 /nfs/dbraw/zinc/57/68/45/1056576845.db2.gz AEYUESWPTQHBGX-UHFFFAOYSA-N 1 2 304.397 4.129 20 0 DIADLO Cc1ccc(OC(F)F)c(CNc2cc3cc[nH]c3c[nH+]2)c1 ZINC000672234799 1056581122 /nfs/dbraw/zinc/58/11/22/1056581122.db2.gz AWCAJCUBRLDXAR-UHFFFAOYSA-N 1 2 303.312 4.085 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1ncc(-c2ccccc2C)o1 ZINC000075681422 1056585568 /nfs/dbraw/zinc/58/55/68/1056585568.db2.gz IXVARCIVSNKRLC-UHFFFAOYSA-N 1 2 312.335 4.424 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1ncc(-c2ccccc2C)o1 ZINC000075681422 1056585582 /nfs/dbraw/zinc/58/55/82/1056585582.db2.gz IXVARCIVSNKRLC-UHFFFAOYSA-N 1 2 312.335 4.424 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1ncc(-c2ccc(C)cc2)o1 ZINC000075681360 1056585952 /nfs/dbraw/zinc/58/59/52/1056585952.db2.gz FAMLCUYMCMXFPM-UHFFFAOYSA-N 1 2 312.335 4.424 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1ncc(-c2ccc(C)cc2)o1 ZINC000075681360 1056585964 /nfs/dbraw/zinc/58/59/64/1056585964.db2.gz FAMLCUYMCMXFPM-UHFFFAOYSA-N 1 2 312.335 4.424 20 0 DIADLO Clc1cccc2c(N3CC[C@@H](Cc4ccncc4)C3)cc[nH+]c12 ZINC000672250081 1056588570 /nfs/dbraw/zinc/58/85/70/1056588570.db2.gz UWHSDVHMSMQIKD-HNNXBMFYSA-N 1 2 323.827 4.352 20 0 DIADLO Clc1cccc2c(N3CC[C@H](Cc4ccncc4)C3)cc[nH+]c12 ZINC000672250082 1056589177 /nfs/dbraw/zinc/58/91/77/1056589177.db2.gz UWHSDVHMSMQIKD-OAHLLOKOSA-N 1 2 323.827 4.352 20 0 DIADLO FC(F)O[C@@H]1CCCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000672249936 1056589586 /nfs/dbraw/zinc/58/95/86/1056589586.db2.gz QWYYQFXZNPVNIV-SNVBAGLBSA-N 1 2 312.747 4.096 20 0 DIADLO CCOC(=O)C1([N@H+](C)Cc2c(C)cccc2Cl)CCCCC1 ZINC001615960587 1056601104 /nfs/dbraw/zinc/60/11/04/1056601104.db2.gz IRQMRWQJEVCWGI-UHFFFAOYSA-N 1 2 323.864 4.346 20 0 DIADLO CCOC(=O)C1([N@@H+](C)Cc2c(C)cccc2Cl)CCCCC1 ZINC001615960587 1056601119 /nfs/dbraw/zinc/60/11/19/1056601119.db2.gz IRQMRWQJEVCWGI-UHFFFAOYSA-N 1 2 323.864 4.346 20 0 DIADLO CCCCC[N@H+](Cc1cnns1)Cc1ccc(Cl)cc1 ZINC001615976361 1056601226 /nfs/dbraw/zinc/60/12/26/1056601226.db2.gz UFLSSGNIZLGYCB-UHFFFAOYSA-N 1 2 309.866 4.384 20 0 DIADLO CCCCC[N@@H+](Cc1cnns1)Cc1ccc(Cl)cc1 ZINC001615976361 1056601239 /nfs/dbraw/zinc/60/12/39/1056601239.db2.gz UFLSSGNIZLGYCB-UHFFFAOYSA-N 1 2 309.866 4.384 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc(C(C)C)cc3)CCCCC2)no1 ZINC000253608866 1056602885 /nfs/dbraw/zinc/60/28/85/1056602885.db2.gz ZYBVFYGBZPFEKA-UHFFFAOYSA-N 1 2 313.445 4.451 20 0 DIADLO O=C(C[C@@H]1CCC[N@H+]1CC=C(Cl)Cl)c1cccs1 ZINC001615995540 1056604187 /nfs/dbraw/zinc/60/41/87/1056604187.db2.gz URVMUQSWLPJAMH-JTQLQIEISA-N 1 2 304.242 4.104 20 0 DIADLO O=C(C[C@@H]1CCC[N@@H+]1CC=C(Cl)Cl)c1cccs1 ZINC001615995540 1056604192 /nfs/dbraw/zinc/60/41/92/1056604192.db2.gz URVMUQSWLPJAMH-JTQLQIEISA-N 1 2 304.242 4.104 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2ccccc2Br)cn1 ZINC000347673543 1056613172 /nfs/dbraw/zinc/61/31/72/1056613172.db2.gz KIRSJLJLOUBDCP-UHFFFAOYSA-N 1 2 319.246 4.039 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2ccccc2Br)cn1 ZINC000347673543 1056613179 /nfs/dbraw/zinc/61/31/79/1056613179.db2.gz KIRSJLJLOUBDCP-UHFFFAOYSA-N 1 2 319.246 4.039 20 0 DIADLO CC(C)CC[N@@H+]1CCc2[nH]c3c(cccc3Br)c2C1 ZINC001616158452 1056613738 /nfs/dbraw/zinc/61/37/38/1056613738.db2.gz GLNOFLGEXFDHSN-UHFFFAOYSA-N 1 2 321.262 4.335 20 0 DIADLO CC(C)CC[N@H+]1CCc2[nH]c3c(cccc3Br)c2C1 ZINC001616158452 1056613746 /nfs/dbraw/zinc/61/37/46/1056613746.db2.gz GLNOFLGEXFDHSN-UHFFFAOYSA-N 1 2 321.262 4.335 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc(-c3ccccc3C)no2)s1 ZINC000076342662 1056623344 /nfs/dbraw/zinc/62/33/44/1056623344.db2.gz XKTZVGPDBSRUAH-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc(-c3ccccc3C)no2)s1 ZINC000076342662 1056623351 /nfs/dbraw/zinc/62/33/51/1056623351.db2.gz XKTZVGPDBSRUAH-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2cccc(-c3ccccn3)c2)n1 ZINC000921925429 1056631720 /nfs/dbraw/zinc/63/17/20/1056631720.db2.gz OMPXEUIAROABIP-UHFFFAOYSA-N 1 2 321.424 4.324 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cnn([C@@H]3CCCCO3)c2)c1 ZINC001240681821 1056638424 /nfs/dbraw/zinc/63/84/24/1056638424.db2.gz PZZMTXAHAJDLJX-IBGZPJMESA-N 1 2 313.445 4.404 20 0 DIADLO Cc1nc(C[N@@H+]2[C@H](C)Cc3cc(F)ccc3[C@H]2C)c(C)s1 ZINC001616403535 1056649872 /nfs/dbraw/zinc/64/98/72/1056649872.db2.gz SLNWTGRVLKSHPG-GHMZBOCLSA-N 1 2 304.434 4.407 20 0 DIADLO Cc1nc(C[N@H+]2[C@H](C)Cc3cc(F)ccc3[C@H]2C)c(C)s1 ZINC001616403535 1056649880 /nfs/dbraw/zinc/64/98/80/1056649880.db2.gz SLNWTGRVLKSHPG-GHMZBOCLSA-N 1 2 304.434 4.407 20 0 DIADLO Cc1nc(C[N@H+]2[C@H](C)c3ccc(F)cc3C[C@@H]2C)c(C)s1 ZINC001616403547 1056651919 /nfs/dbraw/zinc/65/19/19/1056651919.db2.gz SLNWTGRVLKSHPG-WDEREUQCSA-N 1 2 304.434 4.407 20 0 DIADLO Cc1nc(C[N@@H+]2[C@H](C)c3ccc(F)cc3C[C@@H]2C)c(C)s1 ZINC001616403547 1056651923 /nfs/dbraw/zinc/65/19/23/1056651923.db2.gz SLNWTGRVLKSHPG-WDEREUQCSA-N 1 2 304.434 4.407 20 0 DIADLO Fc1cccc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)n1 ZINC001616417713 1056653148 /nfs/dbraw/zinc/65/31/48/1056653148.db2.gz FNLRJYYTSNKJGF-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Fc1cccc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)n1 ZINC001616417713 1056653154 /nfs/dbraw/zinc/65/31/54/1056653154.db2.gz FNLRJYYTSNKJGF-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO CC(C)c1cc(N[C@@H](C)CCCC(C)(C)O)nc(C(C)C)[nH+]1 ZINC001168697245 1056653377 /nfs/dbraw/zinc/65/33/77/1056653377.db2.gz AFLDNOGFTAEPPE-AWEZNQCLSA-N 1 2 307.482 4.465 20 0 DIADLO COc1c(F)ccc(F)c1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001240724348 1056662095 /nfs/dbraw/zinc/66/20/95/1056662095.db2.gz ATKDZMDESXKFST-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO CCCCOC(=O)[C@@H](C)[NH2+][C@H](CC)C(C)(C)c1ccccc1 ZINC001616645833 1056693960 /nfs/dbraw/zinc/69/39/60/1056693960.db2.gz NICRJEFUHRAVBY-NVXWUHKLSA-N 1 2 305.462 4.064 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2coc(C3CC3)n2)C2CC2)c(F)c1 ZINC001616654217 1056696113 /nfs/dbraw/zinc/69/61/13/1056696113.db2.gz PVIMAEUZHGAPMB-MRXNPFEDSA-N 1 2 304.340 4.071 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(OC(C)C)nc1 ZINC001240811209 1056712160 /nfs/dbraw/zinc/71/21/60/1056712160.db2.gz QFWRPERQYZGYKO-UHFFFAOYSA-N 1 2 311.429 4.230 20 0 DIADLO COCCC[C@H]([NH2+][C@@H]1CCCC1(F)F)c1ccc(F)cc1 ZINC000672622278 1056738064 /nfs/dbraw/zinc/73/80/64/1056738064.db2.gz VMWVKLQWBTULAA-LSDHHAIUSA-N 1 2 301.352 4.071 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCCC2(F)F)cc1OCC ZINC000672621749 1056740911 /nfs/dbraw/zinc/74/09/11/1056740911.db2.gz HYAHFVOPYISMAE-MLGOLLRUSA-N 1 2 313.388 4.322 20 0 DIADLO C[C@@H]1CCCC[C@@H]1OCC[N@@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001616935966 1056744514 /nfs/dbraw/zinc/74/45/14/1056744514.db2.gz WDTXECOSDWYHAE-QRWLVFNGSA-N 1 2 312.457 4.121 20 0 DIADLO C[C@@H]1CCCC[C@@H]1OCC[N@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001616935966 1056744525 /nfs/dbraw/zinc/74/45/25/1056744525.db2.gz WDTXECOSDWYHAE-QRWLVFNGSA-N 1 2 312.457 4.121 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC[C@](C)(c3ccccc3)C2)c(C)[nH+]1 ZINC001616970634 1056748317 /nfs/dbraw/zinc/74/83/17/1056748317.db2.gz WCIMNVYWJVTWKR-NRFANRHFSA-N 1 2 322.452 4.201 20 0 DIADLO CCc1cccc(C[N@@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)c1 ZINC001617013511 1056758710 /nfs/dbraw/zinc/75/87/10/1056758710.db2.gz DQWAWOKQDVHKGP-LJQANCHMSA-N 1 2 315.844 4.476 20 0 DIADLO CCc1cccc(C[N@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)c1 ZINC001617013511 1056758718 /nfs/dbraw/zinc/75/87/18/1056758718.db2.gz DQWAWOKQDVHKGP-LJQANCHMSA-N 1 2 315.844 4.476 20 0 DIADLO CC(C)OC(=O)c1cccc(-c2cc[nH+]c(N3CCCCC3)c2)c1 ZINC001240947477 1056774855 /nfs/dbraw/zinc/77/48/55/1056774855.db2.gz GQPMBDVTPMQALT-UHFFFAOYSA-N 1 2 324.424 4.304 20 0 DIADLO COc1cc(F)c(-c2c[nH+]c(N3CCCCC3)cc2C)cc1F ZINC001240958563 1056784478 /nfs/dbraw/zinc/78/44/78/1056784478.db2.gz IRLYRPXNYXDESI-UHFFFAOYSA-N 1 2 318.367 4.334 20 0 DIADLO CCc1ccc([C@@H]2C[N@H+](Cc3ccc(C)c(F)c3)CCO2)cc1 ZINC001617215265 1056795308 /nfs/dbraw/zinc/79/53/08/1056795308.db2.gz FNNHNHNXHFSUKL-FQEVSTJZSA-N 1 2 313.416 4.270 20 0 DIADLO CCc1ccc([C@@H]2C[N@@H+](Cc3ccc(C)c(F)c3)CCO2)cc1 ZINC001617215265 1056795314 /nfs/dbraw/zinc/79/53/14/1056795314.db2.gz FNNHNHNXHFSUKL-FQEVSTJZSA-N 1 2 313.416 4.270 20 0 DIADLO Cc1ccc(-c2ccc(C[NH+]3CCOCC3)nc2)c2ccccc12 ZINC001241006027 1056810081 /nfs/dbraw/zinc/81/00/81/1056810081.db2.gz BKDPGRCYJSDAIS-UHFFFAOYSA-N 1 2 318.420 4.042 20 0 DIADLO CSCc1ccc(C[NH2+]Cc2nc(C(C)(C)C)co2)cc1 ZINC000922124731 1056827059 /nfs/dbraw/zinc/82/70/59/1056827059.db2.gz ZEYXBKBGICZZLL-UHFFFAOYSA-N 1 2 304.459 4.125 20 0 DIADLO COc1cc(F)cc(-c2c[nH+]c(N3CCCCC3)cc2C)c1 ZINC001241029360 1056831194 /nfs/dbraw/zinc/83/11/94/1056831194.db2.gz QYCMBNCBZQCPHX-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO CN(C(=O)c1cccc2[nH+]ccn21)C1CC(C)(C)CC(C)(C)C1 ZINC001586962765 1056839926 /nfs/dbraw/zinc/83/99/26/1056839926.db2.gz GTGCHNZWFDMIAN-UHFFFAOYSA-N 1 2 313.445 4.011 20 0 DIADLO CCN(Cc1[nH+]cc(C)c(OC)c1C)c1ccccc1Cl ZINC001617498230 1056841595 /nfs/dbraw/zinc/84/15/95/1056841595.db2.gz FEQNGLFRQCZVEN-UHFFFAOYSA-N 1 2 304.821 4.387 20 0 DIADLO COc1ccc2c(c1)OCC[N@H+]([C@@H](C)c1ccccc1Cl)C2 ZINC001617498525 1056842296 /nfs/dbraw/zinc/84/22/96/1056842296.db2.gz KQVXDUODGKOGRW-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc2c(c1)OCC[N@@H+]([C@@H](C)c1ccccc1Cl)C2 ZINC001617498525 1056842306 /nfs/dbraw/zinc/84/23/06/1056842306.db2.gz KQVXDUODGKOGRW-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3cc(F)cc(C)c3C2)cc1Cl ZINC001617499784 1056842564 /nfs/dbraw/zinc/84/25/64/1056842564.db2.gz ZQUXKOQNPSRZCK-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO COc1ccc(C[N@H+]2CCc3cc(F)cc(C)c3C2)cc1Cl ZINC001617499784 1056842570 /nfs/dbraw/zinc/84/25/70/1056842570.db2.gz ZQUXKOQNPSRZCK-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO Clc1cccc(CC[N@@H+]2CCC[C@H]2c2cc[nH]n2)c1Cl ZINC001617554387 1056847870 /nfs/dbraw/zinc/84/78/70/1056847870.db2.gz DRCHFZKWVMLCMF-AWEZNQCLSA-N 1 2 310.228 4.096 20 0 DIADLO Clc1cccc(CC[N@H+]2CCC[C@H]2c2cc[nH]n2)c1Cl ZINC001617554387 1056847878 /nfs/dbraw/zinc/84/78/78/1056847878.db2.gz DRCHFZKWVMLCMF-AWEZNQCLSA-N 1 2 310.228 4.096 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1CC(=O)Nc1cc(Cl)ccc1Cl ZINC000009997675 1056856533 /nfs/dbraw/zinc/85/65/33/1056856533.db2.gz NLQCOEJSLUJKEL-QWRGUYRKSA-N 1 2 315.244 4.195 20 0 DIADLO CCOc1cc(F)c(-c2ccc(-n3cc[nH+]c3)cc2)cc1F ZINC001241074106 1056866108 /nfs/dbraw/zinc/86/61/08/1056866108.db2.gz FPLFWOJLYGBSCC-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO Fc1ccc([C@H]([NH2+][C@H]2CCCc3[nH]ncc32)C2CC2)cc1Cl ZINC000453309396 1056879250 /nfs/dbraw/zinc/87/92/50/1056879250.db2.gz DURHFSFYGPPSIF-DOTOQJQBSA-N 1 2 319.811 4.321 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3cc(C)c(Cl)c(C)c3)ccn12 ZINC001128409636 1056879600 /nfs/dbraw/zinc/87/96/00/1056879600.db2.gz JCJIJUSKLUDNCW-UHFFFAOYSA-N 1 2 313.788 4.165 20 0 DIADLO FC(F)(F)[C@@H]1CC[C@H](C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)O1 ZINC001617868247 1056893501 /nfs/dbraw/zinc/89/35/01/1056893501.db2.gz NDBAUHGAGHDSFU-MCIONIFRSA-N 1 2 319.754 4.197 20 0 DIADLO FC(F)(F)[C@@H]1CC[C@H](C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)O1 ZINC001617868247 1056893494 /nfs/dbraw/zinc/89/34/94/1056893494.db2.gz NDBAUHGAGHDSFU-MCIONIFRSA-N 1 2 319.754 4.197 20 0 DIADLO FC(F)(F)[C@@H]1CC[C@@H](C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)O1 ZINC001617868248 1056893719 /nfs/dbraw/zinc/89/37/19/1056893719.db2.gz NDBAUHGAGHDSFU-MJBXVCDLSA-N 1 2 319.754 4.197 20 0 DIADLO FC(F)(F)[C@@H]1CC[C@@H](C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)O1 ZINC001617868248 1056893724 /nfs/dbraw/zinc/89/37/24/1056893724.db2.gz NDBAUHGAGHDSFU-MJBXVCDLSA-N 1 2 319.754 4.197 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cc(F)c(F)cc2F)cc1F ZINC001241111426 1056900603 /nfs/dbraw/zinc/90/06/03/1056900603.db2.gz FCYLSJNGZLTEPR-UHFFFAOYSA-N 1 2 301.258 4.111 20 0 DIADLO Cc1cn(C)nc1C[N@@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001617925791 1056903620 /nfs/dbraw/zinc/90/36/20/1056903620.db2.gz LQZXTYRKEJBTKW-KRWDZBQOSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1cn(C)nc1C[N@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001617925791 1056903628 /nfs/dbraw/zinc/90/36/28/1056903628.db2.gz LQZXTYRKEJBTKW-KRWDZBQOSA-N 1 2 303.837 4.109 20 0 DIADLO CCCCOCC[N@H+](C)[C@@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC001618012986 1056914324 /nfs/dbraw/zinc/91/43/24/1056914324.db2.gz UVKSTAWTZVXKDE-LBPRGKRZSA-N 1 2 309.841 4.026 20 0 DIADLO CCCCOCC[N@@H+](C)[C@@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC001618012986 1056914334 /nfs/dbraw/zinc/91/43/34/1056914334.db2.gz UVKSTAWTZVXKDE-LBPRGKRZSA-N 1 2 309.841 4.026 20 0 DIADLO COc1ccc(F)c(-c2cccc(-c3c[nH+]cn3C)c2)c1F ZINC001241140961 1056921738 /nfs/dbraw/zinc/92/17/38/1056921738.db2.gz GYOVRVQASMKKLA-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cccnc2OC(C)(C)C)cc1 ZINC001241149599 1056927855 /nfs/dbraw/zinc/92/78/55/1056927855.db2.gz DASBKDOVNHZYQW-UHFFFAOYSA-N 1 2 307.397 4.326 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Cl)c(F)c2)Cc2ccccc2O1 ZINC001618249436 1056939953 /nfs/dbraw/zinc/93/99/53/1056939953.db2.gz FYHJDYTVVYBAEJ-GFCCVEGCSA-N 1 2 305.780 4.262 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Cl)c(F)c2)Cc2ccccc2O1 ZINC001618249436 1056939960 /nfs/dbraw/zinc/93/99/60/1056939960.db2.gz FYHJDYTVVYBAEJ-GFCCVEGCSA-N 1 2 305.780 4.262 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)cs1 ZINC000115612844 1056943960 /nfs/dbraw/zinc/94/39/60/1056943960.db2.gz XYSGKKFBYMZSAV-UHFFFAOYSA-N 1 2 320.364 4.280 20 0 DIADLO Nc1cc[nH+]c(-c2c(F)cc(OCc3ccccc3)cc2F)c1 ZINC001241173512 1056946312 /nfs/dbraw/zinc/94/63/12/1056946312.db2.gz DSSXNRZSSZCRII-UHFFFAOYSA-N 1 2 312.319 4.188 20 0 DIADLO CCOc1ccc(-c2ccccc2Cn2cc[nH+]c2)c(F)c1F ZINC001241180000 1056949424 /nfs/dbraw/zinc/94/94/24/1056949424.db2.gz SCFCKMNXJRMOEJ-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO c1cc(O[C@@H]2CCCCO2)cc(-c2cc[nH+]c(N3CCCC3)c2)c1 ZINC001241212032 1056961592 /nfs/dbraw/zinc/96/15/92/1056961592.db2.gz JULLMNVWESMFRQ-HXUWFJFHSA-N 1 2 324.424 4.254 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ncnc2sc3ccccc3c21 ZINC001241240336 1056976512 /nfs/dbraw/zinc/97/65/12/1056976512.db2.gz LWILMWAJKSNQIB-UHFFFAOYSA-N 1 2 320.421 4.281 20 0 DIADLO CCOc1ccc(OC)cc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001241241338 1056976669 /nfs/dbraw/zinc/97/66/69/1056976669.db2.gz FEOSZYWZWMLQHB-UHFFFAOYSA-N 1 2 312.344 4.086 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H]2CCSc3c(F)cccc32)s1 ZINC000358285957 1056982018 /nfs/dbraw/zinc/98/20/18/1056982018.db2.gz KEJMPLIMSAMJRU-GFCCVEGCSA-N 1 2 323.462 4.127 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(C(F)(F)F)s2)c(C)[nH+]1 ZINC000673460591 1056997510 /nfs/dbraw/zinc/99/75/10/1056997510.db2.gz OBIULMKPPWETFR-UHFFFAOYSA-N 1 2 314.332 4.339 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2c(Cl)n[nH]c2C2CC2)o1 ZINC000922317102 1057006108 /nfs/dbraw/zinc/00/61/08/1057006108.db2.gz JKAPOLBMDXTMKZ-UHFFFAOYSA-N 1 2 307.825 4.121 20 0 DIADLO FC(F)(F)c1ncc(C[N@H+]2CC=C(c3ccccc3)CC2)s1 ZINC000447796571 1057009716 /nfs/dbraw/zinc/00/97/16/1057009716.db2.gz XIFAGSITJYGEDC-UHFFFAOYSA-N 1 2 324.371 4.451 20 0 DIADLO FC(F)(F)c1ncc(C[N@@H+]2CC=C(c3ccccc3)CC2)s1 ZINC000447796571 1057009719 /nfs/dbraw/zinc/00/97/19/1057009719.db2.gz XIFAGSITJYGEDC-UHFFFAOYSA-N 1 2 324.371 4.451 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1ccc(CC(C)C)cc1 ZINC001241325849 1057014096 /nfs/dbraw/zinc/01/40/96/1057014096.db2.gz IKNSBNURSUWUEX-UHFFFAOYSA-N 1 2 310.441 4.092 20 0 DIADLO C[C@H](CC(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccccc1F ZINC000338856307 1057025249 /nfs/dbraw/zinc/02/52/49/1057025249.db2.gz JHUMBXOZHKZUGF-CQSZACIVSA-N 1 2 323.371 4.144 20 0 DIADLO Cc1ccc2cc(C[NH2+][C@H]3c4ccccc4OC[C@H]3F)ccc2n1 ZINC000922520085 1057029285 /nfs/dbraw/zinc/02/92/85/1057029285.db2.gz KCXNHTVVUFVRAO-XLIONFOSSA-N 1 2 322.383 4.105 20 0 DIADLO Cc1ccc2cc(C[NH2+][C@@H]3c4ccccc4OC[C@H]3F)[nH]c2c1 ZINC000922521984 1057029951 /nfs/dbraw/zinc/02/99/51/1057029951.db2.gz OXELBRZJQPIPQO-VQIMIIECSA-N 1 2 310.372 4.038 20 0 DIADLO Fc1ccc(-c2ccc(C[NH2+][C@H](c3ncccn3)C3CC3)o2)cc1 ZINC000922583207 1057034824 /nfs/dbraw/zinc/03/48/24/1057034824.db2.gz QYSSATZRLAVPGX-SFHVURJKSA-N 1 2 323.371 4.117 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+][C@@H](c2ccccn2)C2CC2)s1 ZINC000922584435 1057035021 /nfs/dbraw/zinc/03/50/21/1057035021.db2.gz KLZSNNGANOHSQP-MRXNPFEDSA-N 1 2 301.459 4.077 20 0 DIADLO c1coc(-c2nc(C[NH2+][C@@H](c3ccccn3)C3CC3)cs2)c1 ZINC000922586008 1057036526 /nfs/dbraw/zinc/03/65/26/1057036526.db2.gz JEXCJJXHPJLSKH-MRXNPFEDSA-N 1 2 311.410 4.039 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2c(F)c(F)c(F)c(F)c2F)c1 ZINC001241408411 1057044112 /nfs/dbraw/zinc/04/41/12/1057044112.db2.gz BXJWCPBVBSTFSE-UHFFFAOYSA-N 1 2 324.252 4.450 20 0 DIADLO Cc1ccc2n[nH]cc2c1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001241520618 1057083823 /nfs/dbraw/zinc/08/38/23/1057083823.db2.gz ARBASPLGBYARST-UHFFFAOYSA-N 1 2 306.413 4.232 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1cnc(C2CCC2)s1 ZINC000158914946 1057085792 /nfs/dbraw/zinc/08/57/92/1057085792.db2.gz LBIOCYOLGZMQMS-UHFFFAOYSA-N 1 2 312.442 4.392 20 0 DIADLO C[N@H+](CCc1cccc2ccccc21)Cc1noc(C2CCC2)n1 ZINC000625126850 1057090305 /nfs/dbraw/zinc/09/03/05/1057090305.db2.gz GRKCWUJIHVXTON-UHFFFAOYSA-N 1 2 321.424 4.165 20 0 DIADLO C[N@@H+](CCc1cccc2ccccc21)Cc1noc(C2CCC2)n1 ZINC000625126850 1057090312 /nfs/dbraw/zinc/09/03/12/1057090312.db2.gz GRKCWUJIHVXTON-UHFFFAOYSA-N 1 2 321.424 4.165 20 0 DIADLO CCCCC1CCC(C(=O)N2CCC(c3[nH]cc[nH+]3)CC2)CC1 ZINC000625206718 1057100933 /nfs/dbraw/zinc/10/09/33/1057100933.db2.gz FDSSWDMOBIBOGL-UHFFFAOYSA-N 1 2 317.477 4.112 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1cc(O)ccc1Cl ZINC000625299173 1057120943 /nfs/dbraw/zinc/12/09/43/1057120943.db2.gz UOCJIXIBLIQCBE-SNVBAGLBSA-N 1 2 309.768 4.044 20 0 DIADLO CCCC[N@H+](Cc1nc([C@@H](C)OC)no1)[C@H](C)c1ccc(C)o1 ZINC000673856972 1057143562 /nfs/dbraw/zinc/14/35/62/1057143562.db2.gz ZBIHXEAVTSENQL-ZIAGYGMSSA-N 1 2 321.421 4.042 20 0 DIADLO CCCC[N@@H+](Cc1nc([C@@H](C)OC)no1)[C@H](C)c1ccc(C)o1 ZINC000673856972 1057143566 /nfs/dbraw/zinc/14/35/66/1057143566.db2.gz ZBIHXEAVTSENQL-ZIAGYGMSSA-N 1 2 321.421 4.042 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](CC(=O)OC(C)(C)C)C(C)C)c1 ZINC001307585529 1057164415 /nfs/dbraw/zinc/16/44/15/1057164415.db2.gz IULVPVRAZZBHJK-UHFFFAOYSA-N 1 2 321.461 4.026 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](CC(=O)OC(C)(C)C)C(C)C)c1 ZINC001307585529 1057164419 /nfs/dbraw/zinc/16/44/19/1057164419.db2.gz IULVPVRAZZBHJK-UHFFFAOYSA-N 1 2 321.461 4.026 20 0 DIADLO COc1cc(C(F)(F)F)ccc1-c1ccc2[nH+]c(C)cn2c1 ZINC001241804644 1057170006 /nfs/dbraw/zinc/17/00/06/1057170006.db2.gz GHGFHMRWELLLQF-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO CC(C)Oc1ccc(-c2c[nH+]c3c(c2)CCCN3)cc1Cl ZINC001241826358 1057178445 /nfs/dbraw/zinc/17/84/45/1057178445.db2.gz OZBHSMOMTBROQH-UHFFFAOYSA-N 1 2 302.805 4.190 20 0 DIADLO COc1cc(C)[nH+]cc1-c1cccnc1OCc1ccccc1 ZINC001241830706 1057180498 /nfs/dbraw/zinc/18/04/98/1057180498.db2.gz JPZPDUUHTWGRDC-UHFFFAOYSA-N 1 2 306.365 4.040 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ncc(Cl)cc2Cl)C[C@H](C)C1(F)F ZINC000625656078 1057185103 /nfs/dbraw/zinc/18/51/03/1057185103.db2.gz YZLZPCGUXNXSNR-DTORHVGOSA-N 1 2 309.187 4.112 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ncc(Cl)cc2Cl)C[C@H](C)C1(F)F ZINC000625656078 1057185106 /nfs/dbraw/zinc/18/51/06/1057185106.db2.gz YZLZPCGUXNXSNR-DTORHVGOSA-N 1 2 309.187 4.112 20 0 DIADLO Cc1cc(-c2ccc(F)c3ccccc32)c[nH+]c1N1CCOCC1 ZINC001241902475 1057205351 /nfs/dbraw/zinc/20/53/51/1057205351.db2.gz ZFKOMSTUWOKRST-UHFFFAOYSA-N 1 2 322.383 4.186 20 0 DIADLO COc1cc(C[NH2+]C2(C(F)F)CCCC2)ccc1SC ZINC000674143887 1057210718 /nfs/dbraw/zinc/21/07/18/1057210718.db2.gz BYNWZYADEGFKFK-UHFFFAOYSA-N 1 2 301.402 4.085 20 0 DIADLO CCOC(=O)c1ncoc1-c1cccc(-c2cc(C)[nH+]c(C)c2)c1 ZINC001241994487 1057233885 /nfs/dbraw/zinc/23/38/85/1057233885.db2.gz VBYHWPYHJODSKT-UHFFFAOYSA-N 1 2 322.364 4.197 20 0 DIADLO COc1cccc([C@H](C)[NH2+]Cc2c(F)c(F)cc(F)c2F)c1 ZINC000674376316 1057236121 /nfs/dbraw/zinc/23/61/21/1057236121.db2.gz SCPLVTMOHZAWSR-VIFPVBQESA-N 1 2 313.294 4.102 20 0 DIADLO COc1cccc2[nH]c(-c3cc(F)c(C[NH+](C)C)c(F)c3)cc21 ZINC001242002179 1057237318 /nfs/dbraw/zinc/23/73/18/1057237318.db2.gz WNHNSYMTLXMKSD-UHFFFAOYSA-N 1 2 316.351 4.183 20 0 DIADLO CCOc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2)nc1 ZINC000674387778 1057238071 /nfs/dbraw/zinc/23/80/71/1057238071.db2.gz MHKKEDBQKXTCBK-UHFFFAOYSA-N 1 2 322.408 4.276 20 0 DIADLO CCOc1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2)nc1 ZINC000674387778 1057238079 /nfs/dbraw/zinc/23/80/79/1057238079.db2.gz MHKKEDBQKXTCBK-UHFFFAOYSA-N 1 2 322.408 4.276 20 0 DIADLO C[N@H+](Cc1noc2c1CCCC2)Cc1cccc(C(F)(F)F)c1 ZINC000171733628 1057239461 /nfs/dbraw/zinc/23/94/61/1057239461.db2.gz UYBXCSSXIVDCLO-UHFFFAOYSA-N 1 2 324.346 4.204 20 0 DIADLO C[N@@H+](Cc1noc2c1CCCC2)Cc1cccc(C(F)(F)F)c1 ZINC000171733628 1057239465 /nfs/dbraw/zinc/23/94/65/1057239465.db2.gz UYBXCSSXIVDCLO-UHFFFAOYSA-N 1 2 324.346 4.204 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1ncnc2scc(-c3ccccc3)c21 ZINC001242070812 1057254871 /nfs/dbraw/zinc/25/48/71/1057254871.db2.gz MHVWALPSDOYPJQ-UHFFFAOYSA-N 1 2 318.405 4.311 20 0 DIADLO Cc1cc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)ccc1O ZINC001242125989 1057271515 /nfs/dbraw/zinc/27/15/15/1057271515.db2.gz DXZXRUWGTXKFKH-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO Cc1cc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)ccc1O ZINC001242125989 1057271519 /nfs/dbraw/zinc/27/15/19/1057271519.db2.gz DXZXRUWGTXKFKH-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO Oc1ccc(C(F)(F)F)cc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001242140145 1057277098 /nfs/dbraw/zinc/27/70/98/1057277098.db2.gz YUQAGWUMFQGBCG-UHFFFAOYSA-N 1 2 318.298 4.323 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc(OC(C)C)c(F)c1 ZINC001242200892 1057291369 /nfs/dbraw/zinc/29/13/69/1057291369.db2.gz XRQMFGAEVAYQBP-UHFFFAOYSA-N 1 2 300.333 4.165 20 0 DIADLO Cc1cc(Cl)cc(-c2ccc(Cn3cc[nH+]c3)cn2)c1F ZINC001242225915 1057300467 /nfs/dbraw/zinc/30/04/67/1057300467.db2.gz CKKGGKXIHYFYEX-UHFFFAOYSA-N 1 2 301.752 4.094 20 0 DIADLO Cc1cccc(-c2cc(F)cc(C)c2C[NH+]2CCOCC2)c1F ZINC001242238818 1057306847 /nfs/dbraw/zinc/30/68/47/1057306847.db2.gz MSQRHPWFFOWPRQ-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cnccc1C(F)(F)F ZINC001242279952 1057317980 /nfs/dbraw/zinc/31/79/80/1057317980.db2.gz VHALDGJJNRECEZ-UHFFFAOYSA-N 1 2 321.346 4.461 20 0 DIADLO Fc1c(Cl)cccc1C[NH2+][C@H]1COc2c1cccc2Cl ZINC000675347024 1057343930 /nfs/dbraw/zinc/34/39/30/1057343930.db2.gz SMCVAPUJYBQDAV-ZDUSSCGKSA-N 1 2 312.171 4.356 20 0 DIADLO CCOc1cc(Nc2ccccc2-n2cc[nH+]c2)ccc1OC ZINC001212541613 1057350259 /nfs/dbraw/zinc/35/02/59/1057350259.db2.gz NQBLTHGYABUWCR-UHFFFAOYSA-N 1 2 309.369 4.023 20 0 DIADLO Clc1nc2ccccc2cc1C[N@@H+]1CCOC2(CCCC2)C1 ZINC000766122573 1057359724 /nfs/dbraw/zinc/35/97/24/1057359724.db2.gz KHOOFSRUPLRHLJ-UHFFFAOYSA-N 1 2 316.832 4.033 20 0 DIADLO Clc1nc2ccccc2cc1C[N@H+]1CCOC2(CCCC2)C1 ZINC000766122573 1057359732 /nfs/dbraw/zinc/35/97/32/1057359732.db2.gz KHOOFSRUPLRHLJ-UHFFFAOYSA-N 1 2 316.832 4.033 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(C(F)(F)F)c(C)c1 ZINC001242424538 1057364149 /nfs/dbraw/zinc/36/41/49/1057364149.db2.gz JHMUEMJDZZFKMX-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO c1cn2ccc(-c3ccc4c(cnn4[C@H]4CCCCO4)c3)cc2[nH+]1 ZINC001242445653 1057370329 /nfs/dbraw/zinc/37/03/29/1057370329.db2.gz FCHNJKFNQUTMLR-LJQANCHMSA-N 1 2 318.380 4.050 20 0 DIADLO CCc1ccc(-c2noc([C@@H](C)[NH2+][C@@H](C)c3ccncc3)n2)cc1 ZINC000675446456 1057370610 /nfs/dbraw/zinc/37/06/10/1057370610.db2.gz WQCYOOQBTWQSBT-UONOGXRCSA-N 1 2 322.412 4.106 20 0 DIADLO Clc1ccc(C[NH2+]Cc2c(Cl)cccc2Cl)nc1 ZINC000703886089 1057384934 /nfs/dbraw/zinc/38/49/34/1057384934.db2.gz IZAXQPSTNLBSOR-UHFFFAOYSA-N 1 2 301.604 4.332 20 0 DIADLO Cn1ccnc1-c1ccc(-c2cccc(-c3c[nH+]cn3C)c2)cc1 ZINC001242496576 1057385746 /nfs/dbraw/zinc/38/57/46/1057385746.db2.gz LSULPGUANSZIFC-UHFFFAOYSA-N 1 2 314.392 4.155 20 0 DIADLO Cc1nc(N2CCC(c3ccc(F)c(F)c3)CC2)c(C)c(C)[nH+]1 ZINC000675548519 1057387018 /nfs/dbraw/zinc/38/70/18/1057387018.db2.gz SWYJUZWUAHIQAI-UHFFFAOYSA-N 1 2 317.383 4.064 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc(F)c1Cl ZINC001242574678 1057410996 /nfs/dbraw/zinc/41/09/96/1057410996.db2.gz FHCBJTAPCFSFCL-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cncc(N2CCCC2)c1 ZINC001242620020 1057425233 /nfs/dbraw/zinc/42/52/33/1057425233.db2.gz QEEYOTSEWVSRGM-UHFFFAOYSA-N 1 2 322.456 4.043 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[NH+]1CC(c2nc3ccccc3[nH]2)C1 ZINC000675976233 1057441477 /nfs/dbraw/zinc/44/14/77/1057441477.db2.gz KVIANYMTJBBAQL-LBPRGKRZSA-N 1 2 324.428 4.009 20 0 DIADLO C[N@H+](CCOC(C)(C)C)Cc1csc(Nc2ccccc2)n1 ZINC000676043139 1057445937 /nfs/dbraw/zinc/44/59/37/1057445937.db2.gz UBFLYEAPFBLXIO-UHFFFAOYSA-N 1 2 319.474 4.134 20 0 DIADLO C[N@@H+](CCOC(C)(C)C)Cc1csc(Nc2ccccc2)n1 ZINC000676043139 1057445941 /nfs/dbraw/zinc/44/59/41/1057445941.db2.gz UBFLYEAPFBLXIO-UHFFFAOYSA-N 1 2 319.474 4.134 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)n(C)n1)c1ccc(Cl)cc1Cl ZINC000706198976 1057462926 /nfs/dbraw/zinc/46/29/26/1057462926.db2.gz JUJYBUFKTBANTL-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO Oc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)cc(C(F)(F)F)c1 ZINC001242782736 1057474024 /nfs/dbraw/zinc/47/40/24/1057474024.db2.gz XTIMJAMERJIMPO-UHFFFAOYSA-N 1 2 318.298 4.323 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cc(O)cc(C(F)(F)F)c2)cc1 ZINC001242783216 1057474973 /nfs/dbraw/zinc/47/49/73/1057474973.db2.gz DYROVZRFARMPFU-UHFFFAOYSA-N 1 2 318.298 4.479 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccccc1OC1CC1 ZINC001242795598 1057479058 /nfs/dbraw/zinc/47/90/58/1057479058.db2.gz XRMCNDOLSCDDQG-UHFFFAOYSA-N 1 2 306.365 4.089 20 0 DIADLO CCc1cccc(C)c1-c1cc(C[NH+]2CCOCC2)ccc1F ZINC001242817734 1057490867 /nfs/dbraw/zinc/49/08/67/1057490867.db2.gz ATJZXMQMBORIAN-UHFFFAOYSA-N 1 2 313.416 4.196 20 0 DIADLO Cc1nc2c(cc(-c3cccc4[nH+]ccn43)cc2F)n1C(C)C ZINC001242847706 1057496195 /nfs/dbraw/zinc/49/61/95/1057496195.db2.gz SNWXZELWUKVSPY-UHFFFAOYSA-N 1 2 308.360 4.379 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F)c1cn(C)cn1 ZINC000710070025 1057502826 /nfs/dbraw/zinc/50/28/26/1057502826.db2.gz FBQLLVXCWPFPAA-IUCAKERBSA-N 1 2 316.207 4.278 20 0 DIADLO O=C1CCCc2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)cc21 ZINC001242858217 1057503077 /nfs/dbraw/zinc/50/30/77/1057503077.db2.gz ZCLIWSALYGEBKN-UHFFFAOYSA-N 1 2 302.377 4.117 20 0 DIADLO Sc1cccc(-c2ccc3c(c2)ncn3[C@H]2CCC[NH2+]CC2)c1 ZINC001242863727 1057504825 /nfs/dbraw/zinc/50/48/25/1057504825.db2.gz HIDLOIIPALBKLP-INIZCTEOSA-N 1 2 323.465 4.307 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@@H](C)c2ccc(OCC)cc2)n1 ZINC000073637375 1057509443 /nfs/dbraw/zinc/50/94/43/1057509443.db2.gz DGWLPDBAPBPUFB-KBPBESRZSA-N 1 2 317.433 4.223 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000073637381 1057509831 /nfs/dbraw/zinc/50/98/31/1057509831.db2.gz PMNBVBLNEAGLBI-QWHCGFSZSA-N 1 2 317.433 4.178 20 0 DIADLO CCc1onc(C)c1C[NH2+]Cc1csc(-c2cccs2)n1 ZINC000922988832 1057519510 /nfs/dbraw/zinc/51/95/10/1057519510.db2.gz UWIRYFDUTBRMMX-UHFFFAOYSA-N 1 2 319.455 4.020 20 0 DIADLO CCSc1nn(C[N@H+](C2CC2)C2CCCC2)c(=S)s1 ZINC000075666835 1057538939 /nfs/dbraw/zinc/53/89/39/1057538939.db2.gz OBMKRLBXPXLMTF-UHFFFAOYSA-N 1 2 315.533 4.151 20 0 DIADLO CCSc1nn(C[N@@H+](C2CC2)C2CCCC2)c(=S)s1 ZINC000075666835 1057538944 /nfs/dbraw/zinc/53/89/44/1057538944.db2.gz OBMKRLBXPXLMTF-UHFFFAOYSA-N 1 2 315.533 4.151 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1cccc(F)c1OC(F)F ZINC000625981500 1057545106 /nfs/dbraw/zinc/54/51/06/1057545106.db2.gz VOWNSWPVXRPWNZ-VIFPVBQESA-N 1 2 309.278 4.047 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1cccc(F)c1OC(F)F ZINC000625981500 1057545111 /nfs/dbraw/zinc/54/51/11/1057545111.db2.gz VOWNSWPVXRPWNZ-VIFPVBQESA-N 1 2 309.278 4.047 20 0 DIADLO Cc1c(-c2ccc(C(F)(F)F)nc2Cl)ccc2[nH+]ccn21 ZINC001243038680 1057554387 /nfs/dbraw/zinc/55/43/87/1057554387.db2.gz UWMZXEBRVWPZQN-UHFFFAOYSA-N 1 2 311.694 4.377 20 0 DIADLO C=Cc1ccc(F)cc1-c1cc(F)ccc1C[NH+]1CCOCC1 ZINC001243088641 1057567239 /nfs/dbraw/zinc/56/72/39/1057567239.db2.gz XWJXJUJSFILOIP-UHFFFAOYSA-N 1 2 315.363 4.107 20 0 DIADLO Cc1cc(-c2cc(F)ccc2C[NH+]2CCOCC2)cc2cc[nH]c21 ZINC001243101774 1057573113 /nfs/dbraw/zinc/57/31/13/1057573113.db2.gz YZYXZPJQPPQNHN-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1scnc1C1CC1 ZINC000487565183 1057575399 /nfs/dbraw/zinc/57/53/99/1057575399.db2.gz YKDIHTFCWXLFMY-UHFFFAOYSA-N 1 2 303.431 4.205 20 0 DIADLO COc1cc(-c2cn3cc[nH+]c3cc2C)cc(C(F)(F)F)c1 ZINC001243120074 1057578624 /nfs/dbraw/zinc/57/86/24/1057578624.db2.gz WJRLOHVBPKGRQM-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO COc1c(F)cc(-c2ccc(-c3c[nH+]cn3C)cc2)cc1F ZINC001243225342 1057612845 /nfs/dbraw/zinc/61/28/45/1057612845.db2.gz MYHHWMOUFXTVDC-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO CCCCOc1ccc(F)cc1-c1c[nH+]c2c(c1)CCCN2 ZINC001243240221 1057618225 /nfs/dbraw/zinc/61/82/25/1057618225.db2.gz YKBPTFKVHJKEHB-UHFFFAOYSA-N 1 2 300.377 4.067 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1scnc1C1CC1 ZINC000495078177 1057622322 /nfs/dbraw/zinc/62/23/22/1057622322.db2.gz IJUZTHLOHSFKGD-JTQLQIEISA-N 1 2 308.397 4.492 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1scnc1C1CC1 ZINC000495078177 1057622327 /nfs/dbraw/zinc/62/23/27/1057622327.db2.gz IJUZTHLOHSFKGD-JTQLQIEISA-N 1 2 308.397 4.492 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncc[nH]1)c1ccccc1OCc1ccccc1 ZINC000513684456 1057623570 /nfs/dbraw/zinc/62/35/70/1057623570.db2.gz RQTGPXSSLFLDCK-CVEARBPZSA-N 1 2 321.424 4.401 20 0 DIADLO COc1ccc([C@@H]([NH2+][C@H](C)c2ncc[nH]2)c2ccc(C)cc2)cc1 ZINC000513713730 1057623788 /nfs/dbraw/zinc/62/37/88/1057623788.db2.gz SJHXBWLENBOKBP-BEFAXECRSA-N 1 2 321.424 4.167 20 0 DIADLO CCCCOc1cccc(F)c1-c1cc(-n2cc[nH+]c2)ccn1 ZINC001243271910 1057630302 /nfs/dbraw/zinc/63/03/02/1057630302.db2.gz ILZNWHIRSLQNMI-UHFFFAOYSA-N 1 2 311.360 4.252 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cc(Cl)cc3n[nH]cc32)cc1F ZINC001243322170 1057645478 /nfs/dbraw/zinc/64/54/78/1057645478.db2.gz WVAAKBICWZGQMX-UHFFFAOYSA-N 1 2 321.758 4.223 20 0 DIADLO C[C@H]([NH2+]Cc1coc(C2CC2)n1)c1ccc(OC(F)F)cc1 ZINC000727465755 1057654764 /nfs/dbraw/zinc/65/47/64/1057654764.db2.gz REQXGYJIWAKPPF-JTQLQIEISA-N 1 2 308.328 4.004 20 0 DIADLO CNc1cc(-c2ccccc2-c2c(OC)cccc2OC)cc[nH+]1 ZINC001243348372 1057655019 /nfs/dbraw/zinc/65/50/19/1057655019.db2.gz MPAQTAPKZQGSIO-UHFFFAOYSA-N 1 2 320.392 4.475 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1coc(C2CC2)n1 ZINC000727467463 1057655588 /nfs/dbraw/zinc/65/55/88/1057655588.db2.gz ZYJZJFSLQCOWBW-ZDUSSCGKSA-N 1 2 300.402 4.190 20 0 DIADLO C[C@H]([NH2+]Cc1coc(C2CC2)n1)c1ccccc1C(F)(F)F ZINC000727467930 1057655682 /nfs/dbraw/zinc/65/56/82/1057655682.db2.gz CCRJDBABUWXBLZ-JTQLQIEISA-N 1 2 310.319 4.422 20 0 DIADLO FC(F)Oc1cccc(-c2cc[nH+]c(N3CCCCC3)c2)c1 ZINC001243358493 1057657535 /nfs/dbraw/zinc/65/75/35/1057657535.db2.gz YWOZFUTUTDKGRE-UHFFFAOYSA-N 1 2 304.340 4.340 20 0 DIADLO FC(F)Oc1cccc(-c2ccccc2Cn2cc[nH+]c2)c1 ZINC001243359369 1057658522 /nfs/dbraw/zinc/65/85/22/1057658522.db2.gz IWQKKXQDUAKLFQ-UHFFFAOYSA-N 1 2 300.308 4.200 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc(OC(F)F)c1 ZINC001243360046 1057658979 /nfs/dbraw/zinc/65/89/79/1057658979.db2.gz SLLPQPCHJDHXJA-UHFFFAOYSA-N 1 2 316.307 4.149 20 0 DIADLO COc1ccc[nH+]c1N[C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000526983651 1057660081 /nfs/dbraw/zinc/66/00/81/1057660081.db2.gz HPCZKRYZOPUOMH-VOMCLLRMSA-N 1 2 302.340 4.259 20 0 DIADLO Clc1cc(-c2ccccc2Cn2cc[nH+]c2)cc(Cl)n1 ZINC001243369481 1057661903 /nfs/dbraw/zinc/66/19/03/1057661903.db2.gz IFJYSMHXDDFQBT-UHFFFAOYSA-N 1 2 304.180 4.300 20 0 DIADLO Cc1cn2cc(-c3cccc(OCC(F)(F)F)c3)ccc2[nH+]1 ZINC001243390298 1057668188 /nfs/dbraw/zinc/66/81/88/1057668188.db2.gz SSMYPNWCBXKMCB-UHFFFAOYSA-N 1 2 306.287 4.251 20 0 DIADLO CCC[N@H+](CC)Cn1ncn(-c2ccc(C)c(Cl)c2)c1=S ZINC000727821267 1057676258 /nfs/dbraw/zinc/67/62/58/1057676258.db2.gz IADNAXAUDSPGQA-UHFFFAOYSA-N 1 2 324.881 4.055 20 0 DIADLO CCC[N@@H+](CC)Cn1ncn(-c2ccc(C)c(Cl)c2)c1=S ZINC000727821267 1057676261 /nfs/dbraw/zinc/67/62/61/1057676261.db2.gz IADNAXAUDSPGQA-UHFFFAOYSA-N 1 2 324.881 4.055 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccnc(Cl)c1Cl ZINC001243418121 1057677248 /nfs/dbraw/zinc/67/72/48/1057677248.db2.gz LHPJAISKVXLXTC-UHFFFAOYSA-N 1 2 320.179 4.250 20 0 DIADLO CC[C@H]1CCC[N@@H+]1Cn1nc(-c2ccccc2Cl)oc1=S ZINC000727824216 1057677827 /nfs/dbraw/zinc/67/78/27/1057677827.db2.gz OLKZIVNFSILLOO-NSHDSACASA-N 1 2 323.849 4.358 20 0 DIADLO CC[C@H]1CCC[N@H+]1Cn1nc(-c2ccccc2Cl)oc1=S ZINC000727824216 1057677832 /nfs/dbraw/zinc/67/78/32/1057677832.db2.gz OLKZIVNFSILLOO-NSHDSACASA-N 1 2 323.849 4.358 20 0 DIADLO CC[C@H]1CCC[N@@H+]1Cn1[nH]c(-c2ccc(Cl)cc2)nc1=S ZINC000727823847 1057678099 /nfs/dbraw/zinc/67/80/99/1057678099.db2.gz LQLPHPJTUVUBGX-ZDUSSCGKSA-N 1 2 322.865 4.093 20 0 DIADLO CC[C@H]1CCC[N@H+]1Cn1[nH]c(-c2ccc(Cl)cc2)nc1=S ZINC000727823847 1057678102 /nfs/dbraw/zinc/67/81/02/1057678102.db2.gz LQLPHPJTUVUBGX-ZDUSSCGKSA-N 1 2 322.865 4.093 20 0 DIADLO Nc1[nH+]cccc1-c1cncc(-c2ccc(C(F)(F)F)cc2)c1 ZINC001243477329 1057691144 /nfs/dbraw/zinc/69/11/44/1057691144.db2.gz KLSVSZJJLPQGKH-UHFFFAOYSA-N 1 2 315.298 4.412 20 0 DIADLO c1cc(-c2ccc(C3CCCC3)cc2)ncc1C[NH+]1CCOCC1 ZINC001243491661 1057694881 /nfs/dbraw/zinc/69/48/81/1057694881.db2.gz HJMZXWUOFVLQSN-UHFFFAOYSA-N 1 2 322.452 4.238 20 0 DIADLO CCC[NH+](CCC)Cn1nc(-c2ccccc2)sc1=S ZINC000729982138 1057699994 /nfs/dbraw/zinc/69/99/94/1057699994.db2.gz RDKYNSGRTWKJDO-UHFFFAOYSA-N 1 2 307.488 4.421 20 0 DIADLO CC[C@@H]1CCC[N@@H+]1Cn1nc(-c2ccccc2)sc1=S ZINC000729982767 1057700146 /nfs/dbraw/zinc/70/01/46/1057700146.db2.gz HHSOPLIGLFTBAI-CYBMUJFWSA-N 1 2 305.472 4.173 20 0 DIADLO CC[C@@H]1CCC[N@H+]1Cn1nc(-c2ccccc2)sc1=S ZINC000729982767 1057700149 /nfs/dbraw/zinc/70/01/49/1057700149.db2.gz HHSOPLIGLFTBAI-CYBMUJFWSA-N 1 2 305.472 4.173 20 0 DIADLO CC(C)C[N@H+](Cn1nc(-c2ccccc2)sc1=S)C1CC1 ZINC000729981803 1057700312 /nfs/dbraw/zinc/70/03/12/1057700312.db2.gz MFWWRZLTIJCMBC-UHFFFAOYSA-N 1 2 319.499 4.419 20 0 DIADLO CC(C)C[N@@H+](Cn1nc(-c2ccccc2)sc1=S)C1CC1 ZINC000729981803 1057700318 /nfs/dbraw/zinc/70/03/18/1057700318.db2.gz MFWWRZLTIJCMBC-UHFFFAOYSA-N 1 2 319.499 4.419 20 0 DIADLO CCOc1c(F)cccc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001243536952 1057706752 /nfs/dbraw/zinc/70/67/52/1057706752.db2.gz UDTJZRZUWVTXFT-UHFFFAOYSA-N 1 2 309.331 4.231 20 0 DIADLO CCCOc1c(F)cc(F)c(-c2ccn3cc[nH+]c3c2)c1F ZINC001243621333 1057736322 /nfs/dbraw/zinc/73/63/22/1057736322.db2.gz HJHCLPGYQRLRCK-UHFFFAOYSA-N 1 2 306.287 4.207 20 0 DIADLO CCCOc1c(F)cc(F)c(-c2ccc3[nH+]ccn3c2)c1F ZINC001243621293 1057736363 /nfs/dbraw/zinc/73/63/63/1057736363.db2.gz DRSXGDUMSLZGCD-UHFFFAOYSA-N 1 2 306.287 4.207 20 0 DIADLO CSc1ncc(Cl)cc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001243626332 1057738705 /nfs/dbraw/zinc/73/87/05/1057738705.db2.gz HUUFTCKHTBNOFH-UHFFFAOYSA-N 1 2 301.802 4.310 20 0 DIADLO c1csc(-c2cncc(-c3ccc(Cn4cc[nH+]c4)cc3)n2)c1 ZINC001243656019 1057745583 /nfs/dbraw/zinc/74/55/83/1057745583.db2.gz KECSQFJZKHFRTA-UHFFFAOYSA-N 1 2 318.405 4.117 20 0 DIADLO Fc1ccc2c(c1)nccc2-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243657021 1057745809 /nfs/dbraw/zinc/74/58/09/1057745809.db2.gz JCZMKZMCZVEARP-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO Fc1cc2ccncc2cc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243658093 1057746080 /nfs/dbraw/zinc/74/60/80/1057746080.db2.gz CLDQLDFYUJWRLU-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO COc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)cc2[nH]ccc21 ZINC001243658116 1057746173 /nfs/dbraw/zinc/74/61/73/1057746173.db2.gz CXMNFLHDAWMLQL-UHFFFAOYSA-N 1 2 303.365 4.088 20 0 DIADLO COc1ccc2[nH]ccc2c1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243658459 1057746223 /nfs/dbraw/zinc/74/62/23/1057746223.db2.gz QZXBRCRGAKWHAS-UHFFFAOYSA-N 1 2 303.365 4.088 20 0 DIADLO Fc1ccc2cccnc2c1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243658467 1057746258 /nfs/dbraw/zinc/74/62/58/1057746258.db2.gz RBYZZSOWYCNYFK-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO Cc1sc2ncnc(-c3ccc(Cn4cc[nH+]c4)cc3)c2c1C ZINC001243657708 1057746748 /nfs/dbraw/zinc/74/67/48/1057746748.db2.gz UDJXMBJWHOGJHO-UHFFFAOYSA-N 1 2 320.421 4.220 20 0 DIADLO Fc1cnc2cc(-c3ccc(Cn4cc[nH+]c4)cc3)ccc2c1 ZINC001243661494 1057748096 /nfs/dbraw/zinc/74/80/96/1057748096.db2.gz DPZJMAIBBWIFSX-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO CC(=O)Nc1c(C)cc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1C ZINC001243662435 1057748670 /nfs/dbraw/zinc/74/86/70/1057748670.db2.gz PRUXZANZMKYVOD-UHFFFAOYSA-N 1 2 319.408 4.174 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+]C2(c3ccc(F)cc3)CCCC2)o1 ZINC000731666287 1057751195 /nfs/dbraw/zinc/75/11/95/1057751195.db2.gz KJWWRXDYJWEORY-UHFFFAOYSA-N 1 2 317.408 4.065 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1cccc(F)c1F ZINC000731893971 1057758361 /nfs/dbraw/zinc/75/83/61/1057758361.db2.gz WMBMXRGOYJBSPI-LPMFXHHGSA-N 1 2 317.379 4.315 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1cccc(F)c1F ZINC000731893971 1057758364 /nfs/dbraw/zinc/75/83/64/1057758364.db2.gz WMBMXRGOYJBSPI-LPMFXHHGSA-N 1 2 317.379 4.315 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1cccc(F)c1F ZINC000731893972 1057758411 /nfs/dbraw/zinc/75/84/11/1057758411.db2.gz WMBMXRGOYJBSPI-PJIJBLCYSA-N 1 2 317.379 4.315 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1cccc(F)c1F ZINC000731893972 1057758414 /nfs/dbraw/zinc/75/84/14/1057758414.db2.gz WMBMXRGOYJBSPI-PJIJBLCYSA-N 1 2 317.379 4.315 20 0 DIADLO CC(=O)OCc1cccc(C)c1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001243718704 1057761075 /nfs/dbraw/zinc/76/10/75/1057761075.db2.gz DQCBZAYMVJASIF-UHFFFAOYSA-N 1 2 324.355 4.050 20 0 DIADLO CC[C@H](C)C[N@H+](C)Cn1nc(-c2sccc2C)oc1=S ZINC000732181898 1057769654 /nfs/dbraw/zinc/76/96/54/1057769654.db2.gz BVPNUVXXEDDXEB-JTQLQIEISA-N 1 2 311.476 4.178 20 0 DIADLO CC[C@H](C)C[N@@H+](C)Cn1nc(-c2sccc2C)oc1=S ZINC000732181898 1057769657 /nfs/dbraw/zinc/76/96/57/1057769657.db2.gz BVPNUVXXEDDXEB-JTQLQIEISA-N 1 2 311.476 4.178 20 0 DIADLO CCn1c2ccccc2c2cc(C[N@H+](C)Cc3ncc[nH]3)ccc21 ZINC000732198552 1057770934 /nfs/dbraw/zinc/77/09/34/1057770934.db2.gz WPJKXMHNPMSHRE-UHFFFAOYSA-N 1 2 318.424 4.170 20 0 DIADLO CCn1c2ccccc2c2cc(C[N@@H+](C)Cc3ncc[nH]3)ccc21 ZINC000732198552 1057770939 /nfs/dbraw/zinc/77/09/39/1057770939.db2.gz WPJKXMHNPMSHRE-UHFFFAOYSA-N 1 2 318.424 4.170 20 0 DIADLO Cc1cn2c(cccc2-c2cccc(NC(=O)OC(C)(C)C)n2)[nH+]1 ZINC001243755739 1057772020 /nfs/dbraw/zinc/77/20/20/1057772020.db2.gz UERSJZMDRYWZGD-UHFFFAOYSA-N 1 2 324.384 4.052 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2nc3ccccc3o2)cc1F ZINC000732989513 1057795695 /nfs/dbraw/zinc/79/56/95/1057795695.db2.gz RLUFCDNXTZPXKM-MRXNPFEDSA-N 1 2 314.335 4.443 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2nc3ccccc3o2)cc1F ZINC000732989513 1057795699 /nfs/dbraw/zinc/79/56/99/1057795699.db2.gz RLUFCDNXTZPXKM-MRXNPFEDSA-N 1 2 314.335 4.443 20 0 DIADLO COc1c(C)cc(C[N@H+](C)Cc2ncc(C(C)C)o2)cc1C ZINC000733309413 1057811961 /nfs/dbraw/zinc/81/19/61/1057811961.db2.gz NLBQWLPBHCGGHQ-UHFFFAOYSA-N 1 2 302.418 4.055 20 0 DIADLO COc1c(C)cc(C[N@@H+](C)Cc2ncc(C(C)C)o2)cc1C ZINC000733309413 1057811965 /nfs/dbraw/zinc/81/19/65/1057811965.db2.gz NLBQWLPBHCGGHQ-UHFFFAOYSA-N 1 2 302.418 4.055 20 0 DIADLO Clc1ccccc1C[NH2+]Cc1nc(-c2ccncc2)cs1 ZINC000733331436 1057814110 /nfs/dbraw/zinc/81/41/10/1057814110.db2.gz MXFFCGPZVNDIEM-UHFFFAOYSA-N 1 2 315.829 4.148 20 0 DIADLO Cc1nc2scc(-c3cccs3)c2c(C2=C[NH2+]CCC2)n1 ZINC001243949768 1057817358 /nfs/dbraw/zinc/81/73/58/1057817358.db2.gz YHMIAAMSLIOVGH-UHFFFAOYSA-N 1 2 313.451 4.453 20 0 DIADLO Cc1nc2ccc(-c3cc(F)c(C[NH+](C)C)c(F)c3)cc2o1 ZINC001243961011 1057820797 /nfs/dbraw/zinc/82/07/97/1057820797.db2.gz BKVIACVTNJRNDP-UHFFFAOYSA-N 1 2 302.324 4.143 20 0 DIADLO CSc1ncc2cc(-c3ccc(-c4[nH]cc[nH+]4)cc3)ccc2n1 ZINC001243977078 1057826382 /nfs/dbraw/zinc/82/63/82/1057826382.db2.gz ZVAIKZVZLUIBND-UHFFFAOYSA-N 1 2 318.405 4.409 20 0 DIADLO CC[C@@H](C(=O)OC)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001243975880 1057826538 /nfs/dbraw/zinc/82/65/38/1057826538.db2.gz FCRDNPFIBOKVRZ-GOSISDBHSA-N 1 2 320.392 4.410 20 0 DIADLO COC(=O)[C@H](C)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001243976009 1057826614 /nfs/dbraw/zinc/82/66/14/1057826614.db2.gz GAJIUQSSFJQMIA-CYBMUJFWSA-N 1 2 306.365 4.020 20 0 DIADLO CCOC(=O)c1cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)ccc1F ZINC001243977935 1057827038 /nfs/dbraw/zinc/82/70/38/1057827038.db2.gz BLMZFZXRBXUEOO-UHFFFAOYSA-N 1 2 310.328 4.060 20 0 DIADLO COc1ccc2ccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)cc2n1 ZINC001243977519 1057827063 /nfs/dbraw/zinc/82/70/63/1057827063.db2.gz KTEGSPLXXCYBBK-UHFFFAOYSA-N 1 2 301.349 4.301 20 0 DIADLO CCOc1c(F)cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1F ZINC001243978159 1057827143 /nfs/dbraw/zinc/82/71/43/1057827143.db2.gz KGPUIOAFPYIYAF-UHFFFAOYSA-N 1 2 300.308 4.421 20 0 DIADLO CCOC(=O)c1ccc(C)c(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001243978142 1057827424 /nfs/dbraw/zinc/82/74/24/1057827424.db2.gz JLWRJHCGKFCMBD-UHFFFAOYSA-N 1 2 306.365 4.229 20 0 DIADLO COC(=O)c1cc(C)c(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1C ZINC001243981351 1057828223 /nfs/dbraw/zinc/82/82/23/1057828223.db2.gz SSNSQAPBCMAKGN-UHFFFAOYSA-N 1 2 306.365 4.147 20 0 DIADLO CCOc1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c(OC)c1 ZINC001244005278 1057835926 /nfs/dbraw/zinc/83/59/26/1057835926.db2.gz ODZBBSIIUDFILU-UHFFFAOYSA-N 1 2 312.344 4.086 20 0 DIADLO COc1ccc(-c2ccc(-n3cc[nH+]c3)cc2OC)c(C)c1C ZINC001244004155 1057836082 /nfs/dbraw/zinc/83/60/82/1057836082.db2.gz RKOKLNDNQUDNMC-UHFFFAOYSA-N 1 2 308.381 4.173 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccnc(C(C)(C)C)c2)cc1F ZINC001244028637 1057843504 /nfs/dbraw/zinc/84/35/04/1057843504.db2.gz TVMCCVNXLDQPOD-UHFFFAOYSA-N 1 2 304.384 4.386 20 0 DIADLO CCOc1ccc(-c2ccn3cc(N)[nH+]c3c2)c(C(F)(F)F)c1 ZINC001244045286 1057847973 /nfs/dbraw/zinc/84/79/73/1057847973.db2.gz SLUPDGLPTZLRHI-UHFFFAOYSA-N 1 2 321.302 4.001 20 0 DIADLO FC(F)COc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001244067731 1057856010 /nfs/dbraw/zinc/85/60/10/1057856010.db2.gz VIAUPJRQXAJLIB-UHFFFAOYSA-N 1 2 300.308 4.183 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc(F)c(O)c(F)c1 ZINC001244094508 1057866839 /nfs/dbraw/zinc/86/68/39/1057866839.db2.gz TYPVQRUEDNASFE-UHFFFAOYSA-N 1 2 304.340 4.031 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cc(F)c(OC(C)C)c(F)c1 ZINC001244110348 1057872737 /nfs/dbraw/zinc/87/27/37/1057872737.db2.gz JLIRTGHLPPDTJX-UHFFFAOYSA-N 1 2 318.323 4.075 20 0 DIADLO CSc1ncc(-c2ccccc2Cn2cc[nH+]c2)cc1Cl ZINC001244248968 1057909969 /nfs/dbraw/zinc/90/99/69/1057909969.db2.gz UQRPILIKHTXGOY-UHFFFAOYSA-N 1 2 315.829 4.369 20 0 DIADLO Cc1ncc(C(F)(F)F)cc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001244262926 1057915152 /nfs/dbraw/zinc/91/51/52/1057915152.db2.gz RWGMUWAXTZTRQG-UHFFFAOYSA-N 1 2 317.314 4.476 20 0 DIADLO Fc1ccc(-c2ccc(CC(F)(F)F)nc2)cc1-n1cc[nH+]c1 ZINC001244295625 1057925711 /nfs/dbraw/zinc/92/57/11/1057925711.db2.gz CXQOGCQMVPIWPR-UHFFFAOYSA-N 1 2 321.277 4.178 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cccc3[nH]c(=O)ccc32)cc1 ZINC001244317994 1057933348 /nfs/dbraw/zinc/93/33/48/1057933348.db2.gz OLDUOHXBPMXXBB-UHFFFAOYSA-N 1 2 301.349 4.008 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2ccc(N(C)C)c(Cl)c2)cc1 ZINC001244414383 1057954013 /nfs/dbraw/zinc/95/40/13/1057954013.db2.gz MCDJFEILGXYGTA-UHFFFAOYSA-N 1 2 302.805 4.435 20 0 DIADLO CNc1cc(-c2cc(Cl)cc(OC(F)(F)F)c2)cc[nH+]1 ZINC001244522627 1057984756 /nfs/dbraw/zinc/98/47/56/1057984756.db2.gz DLUZQKOBGXVTDD-UHFFFAOYSA-N 1 2 302.683 4.342 20 0 DIADLO COc1ccc(C)c(F)c1-c1cc(N2CCCCC2)cc[nH+]1 ZINC001244565663 1057996588 /nfs/dbraw/zinc/99/65/88/1057996588.db2.gz BMWIZGLZVWAMPK-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO COc1c(F)cc(-c2cccc3[nH+]c(C)cn32)cc1C(F)(F)F ZINC001244571216 1057998918 /nfs/dbraw/zinc/99/89/18/1057998918.db2.gz DWSILXRODFDGCG-UHFFFAOYSA-N 1 2 324.277 4.476 20 0 DIADLO CC(=O)c1ccc(F)c(-c2ccc(C[NH+](C)C)c(F)c2)c1F ZINC001244624051 1058012579 /nfs/dbraw/zinc/01/25/79/1058012579.db2.gz ITQDTVZJYPAZMJ-UHFFFAOYSA-N 1 2 307.315 4.035 20 0 DIADLO c1ccc(CNc2ccc(-c3c[nH+]c4c(c3)CCCN4)cc2)cc1 ZINC001244644460 1058018821 /nfs/dbraw/zinc/01/88/21/1058018821.db2.gz HYGXLAOTDQSJJR-UHFFFAOYSA-N 1 2 315.420 4.362 20 0 DIADLO Cc1cc(C2=CC[C@H](OC(=O)c3ccccc3)CC2)c(C)c[nH+]1 ZINC001244806850 1058050544 /nfs/dbraw/zinc/05/05/44/1058050544.db2.gz UFBNQXXAGDBURX-SFHVURJKSA-N 1 2 307.393 4.491 20 0 DIADLO CCOc1ccc(C)c(-c2cc(F)c(C[NH+](C)C)c(F)c2)c1 ZINC001244874982 1058062427 /nfs/dbraw/zinc/06/24/27/1058062427.db2.gz URLREYOHWSSSRB-UHFFFAOYSA-N 1 2 305.368 4.401 20 0 DIADLO Cc1c(O)cccc1-c1ccc(-c2nc3c(o2)CC[N@@H+](C)C3)cc1 ZINC001244959758 1058081000 /nfs/dbraw/zinc/08/10/00/1058081000.db2.gz APGXEDWPAAICHR-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO Cc1c(O)cccc1-c1ccc(-c2nc3c(o2)CC[N@H+](C)C3)cc1 ZINC001244959758 1058081002 /nfs/dbraw/zinc/08/10/02/1058081002.db2.gz APGXEDWPAAICHR-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO CNc1cc(-c2ccc3[nH]cc(C(=O)OC(C)(C)C)c3c2)cc[nH+]1 ZINC001244971408 1058083940 /nfs/dbraw/zinc/08/39/40/1058083940.db2.gz GEKQTRROCJLORL-UHFFFAOYSA-N 1 2 323.396 4.227 20 0 DIADLO CNc1cc(-c2cccc3ncc(C(F)(F)F)cc32)cc[nH+]1 ZINC001244975940 1058084091 /nfs/dbraw/zinc/08/40/91/1058084091.db2.gz KHNGEPVPNOBEOC-UHFFFAOYSA-N 1 2 303.287 4.357 20 0 DIADLO CNc1cc(-c2ccc(C(F)(F)F)c3ncccc23)cc[nH+]1 ZINC001244977333 1058084703 /nfs/dbraw/zinc/08/47/03/1058084703.db2.gz YTQIKHRETJKQQQ-UHFFFAOYSA-N 1 2 303.287 4.357 20 0 DIADLO Cc1cc(-c2c(Cl)cc(CO)cc2Cl)c2[nH+]ccn2c1 ZINC001245007002 1058090703 /nfs/dbraw/zinc/09/07/03/1058090703.db2.gz FERFRMMPZCJYGJ-UHFFFAOYSA-N 1 2 307.180 4.109 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1c(Cl)cc(CO)cc1Cl ZINC001245008542 1058091203 /nfs/dbraw/zinc/09/12/03/1058091203.db2.gz RVRHGUQHXCQMTJ-UHFFFAOYSA-N 1 2 307.180 4.109 20 0 DIADLO Cc1cc(OC(C)C)c(-c2cc(-n3ccnc3)cc[nH+]2)cc1C ZINC001245028908 1058097996 /nfs/dbraw/zinc/09/79/96/1058097996.db2.gz HICHZFUHGVLYPF-UHFFFAOYSA-N 1 2 307.397 4.338 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3c(C)cc(F)cc3Cl)nn2)c1C ZINC001245057394 1058104508 /nfs/dbraw/zinc/10/45/08/1058104508.db2.gz LFLPXZANQZVMQA-UHFFFAOYSA-N 1 2 316.767 4.047 20 0 DIADLO Cc1c(-c2cccc(OC(F)(F)F)c2F)ccc2[nH+]ccn21 ZINC001245176790 1058124324 /nfs/dbraw/zinc/12/43/24/1058124324.db2.gz CALNXFNWDRNVER-UHFFFAOYSA-N 1 2 310.250 4.347 20 0 DIADLO FC(F)Oc1cccc(-c2c[nH+]cn2Cc2ccccc2)c1 ZINC001245197837 1058126437 /nfs/dbraw/zinc/12/64/37/1058126437.db2.gz CIRFYCIDYJPSBE-UHFFFAOYSA-N 1 2 300.308 4.200 20 0 DIADLO CC(C)[S@@](=O)c1ccc(-c2c[nH+]cn2Cc2ccccc2)cc1 ZINC001245197171 1058126514 /nfs/dbraw/zinc/12/65/14/1058126514.db2.gz PWQPHRFZVDJCQV-HSZRJFAPSA-N 1 2 324.449 4.114 20 0 DIADLO Fc1cc(-c2c[nH+]cn2Cc2ccccc2)ccc1OC(F)F ZINC001245197170 1058126520 /nfs/dbraw/zinc/12/65/20/1058126520.db2.gz PVJPRELZPTYHKB-UHFFFAOYSA-N 1 2 318.298 4.339 20 0 DIADLO COc1ccc2cc(-c3c[nH+]cn3Cc3ccccc3)ccc2n1 ZINC001245198142 1058126956 /nfs/dbraw/zinc/12/69/56/1058126956.db2.gz QXQNFYJVMAOATK-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO CC(C)COc1cc(-c2c[nH+]cn2Cc2ccccc2)ccn1 ZINC001245201790 1058127490 /nfs/dbraw/zinc/12/74/90/1058127490.db2.gz QQWQBWTWRXVJEL-UHFFFAOYSA-N 1 2 307.397 4.028 20 0 DIADLO CCn1ncc2cc(-c3cccc(-c4c[nH+]cn4C)c3)ccc21 ZINC001245235920 1058132137 /nfs/dbraw/zinc/13/21/37/1058132137.db2.gz QJVRLPKEHSQPBT-UHFFFAOYSA-N 1 2 302.381 4.124 20 0 DIADLO COc1c(-c2ccc3[nH+]c(C)cn3c2)cccc1C(F)(F)F ZINC001245276043 1058138458 /nfs/dbraw/zinc/13/84/58/1058138458.db2.gz WENXIDCOPKFHJW-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO COc1c(-c2cc(C)c3[nH+]ccn3c2)cccc1C(F)(F)F ZINC001245275708 1058138465 /nfs/dbraw/zinc/13/84/65/1058138465.db2.gz SISXOWLUGRZADE-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cccc(Br)c1F ZINC001245483784 1058177491 /nfs/dbraw/zinc/17/74/91/1058177491.db2.gz JTYWJXVLYBGSFM-UHFFFAOYSA-N 1 2 305.150 4.211 20 0 DIADLO Cc1cc(NC(=O)[C@@H](CC(C)C)c2ccc(Cl)cc2)cc[nH+]1 ZINC001527656152 1058198055 /nfs/dbraw/zinc/19/80/55/1058198055.db2.gz QIMZKPARUJDBHA-KRWDZBQOSA-N 1 2 316.832 4.234 20 0 DIADLO CC(C)COc1ncc(-c2cc3[nH]ccc3c[nH+]2)cc1Cl ZINC001245530634 1058208444 /nfs/dbraw/zinc/20/84/44/1058208444.db2.gz TUZVMGNGIXHDAR-UHFFFAOYSA-N 1 2 301.777 4.313 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cnc(OCC(C)C)c(Cl)c1 ZINC001245533204 1058212922 /nfs/dbraw/zinc/21/29/22/1058212922.db2.gz LPTXNFDQBFJQKN-UHFFFAOYSA-N 1 2 315.804 4.393 20 0 DIADLO COC(=O)c1ccc(-c2ccc(-c3c[nH+]c(N)c(C)c3)cc2)cc1 ZINC001245538066 1058215392 /nfs/dbraw/zinc/21/53/92/1058215392.db2.gz WAUMJUKUFWMRBO-UHFFFAOYSA-N 1 2 318.376 4.093 20 0 DIADLO COC(=O)C1(c2ccc(-c3c[nH+]c(N)c(C)c3)cc2)CCCCC1 ZINC001245538986 1058219846 /nfs/dbraw/zinc/21/98/46/1058219846.db2.gz BPCGGCJTOGJQAN-UHFFFAOYSA-N 1 2 324.424 4.014 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(F)c(C)cc1F ZINC001245544968 1058222442 /nfs/dbraw/zinc/22/24/42/1058222442.db2.gz PCTJQRQQCDTASS-UHFFFAOYSA-N 1 2 300.308 4.135 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@@H](C)c3cc4ccccc4o3)ccn12 ZINC001517045824 1058223358 /nfs/dbraw/zinc/22/33/58/1058223358.db2.gz MHPXZGWBMXIQLP-ZDUSSCGKSA-N 1 2 320.348 4.307 20 0 DIADLO Cc1ccc2[nH]c(-c3cc(C[NH+]4CCOCC4)ccc3F)cc2c1 ZINC001245573163 1058241436 /nfs/dbraw/zinc/24/14/36/1058241436.db2.gz YFIPMDFIEGESKD-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Cc1oc(-c2ccccc2)cc1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001527999517 1058294548 /nfs/dbraw/zinc/29/45/48/1058294548.db2.gz HFMBNRGWTSNBIJ-UHFFFAOYSA-N 1 2 317.348 4.155 20 0 DIADLO CC(C)Cc1cccc([C@@H](C)C(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC001527999860 1058294607 /nfs/dbraw/zinc/29/46/07/1058294607.db2.gz MDJYBDZOARURFS-OAHLLOKOSA-N 1 2 321.424 4.275 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc(O)c(F)c(F)c1F ZINC001245637247 1058301683 /nfs/dbraw/zinc/30/16/83/1058301683.db2.gz NZBNHLQJYSOGCF-UHFFFAOYSA-N 1 2 322.330 4.170 20 0 DIADLO C[NH+](C)Cc1nc(CNc2ccc3c(c2)CCCCC3)cs1 ZINC001550127422 1058319227 /nfs/dbraw/zinc/31/92/27/1058319227.db2.gz QMKQOHSFPKQMHU-UHFFFAOYSA-N 1 2 315.486 4.086 20 0 DIADLO Oc1cc(F)c(-c2ccc(C[NH+]3CCCCC3)cn2)cc1Cl ZINC001245673406 1058334231 /nfs/dbraw/zinc/33/42/31/1058334231.db2.gz GIJOUISDYUCDJY-UHFFFAOYSA-N 1 2 320.795 4.233 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)CC[C@H]3CC3(F)F)cc2)[nH+]c1C ZINC001550420008 1058339884 /nfs/dbraw/zinc/33/98/84/1058339884.db2.gz OUJZRUVLUPXGKH-ZDUSSCGKSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3CCCC3(F)F)cc2)[nH+]c1C ZINC001550420149 1058340236 /nfs/dbraw/zinc/34/02/36/1058340236.db2.gz FIBPLFHFVXKXKN-AWEZNQCLSA-N 1 2 319.355 4.067 20 0 DIADLO C[C@H]([NH2+][C@H]1CC(C)(C)Oc2ccc(F)cc21)c1ncccc1F ZINC001550704093 1058354891 /nfs/dbraw/zinc/35/48/91/1058354891.db2.gz OKIYUODMBNYDPN-NHYWBVRUSA-N 1 2 318.367 4.313 20 0 DIADLO CSC1(CNC(=O)Nc2c(C)cc(C)[nH+]c2C)CCCCC1 ZINC001562901624 1058357758 /nfs/dbraw/zinc/35/77/58/1058357758.db2.gz XBOYBNPWYLLXAT-UHFFFAOYSA-N 1 2 321.490 4.194 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CC[C@H]3CCCC[C@@H]3C2)c(C)[nH+]1 ZINC001562900835 1058358187 /nfs/dbraw/zinc/35/81/87/1058358187.db2.gz SUDCASITPGQGAS-BRWVUGGUSA-N 1 2 315.461 4.487 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001528347073 1058398422 /nfs/dbraw/zinc/39/84/22/1058398422.db2.gz IQZVATQKPAICJY-UHFFFAOYSA-N 1 2 300.402 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@@H]3CCCC[C@H]23)[nH+]c1C ZINC001551740617 1058408123 /nfs/dbraw/zinc/40/81/23/1058408123.db2.gz NRSJKHJJTSRRNF-YQQAZPJKSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2CCCC[C@H]2C)[nH+]c1C ZINC001551737382 1058408950 /nfs/dbraw/zinc/40/89/50/1058408950.db2.gz DEUQRMAOEUOBGS-DOMZBBRYSA-N 1 2 311.429 4.458 20 0 DIADLO CC[C@@H]1CCC[C@@H]1C(=O)Nc1ccccc1-c1[nH]c(C)c(C)[nH+]1 ZINC001551738636 1058409249 /nfs/dbraw/zinc/40/92/49/1058409249.db2.gz IDXMGXFPHOADLM-CABCVRRESA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C2CC3(CCC3)C2)[nH+]c1C ZINC001551738071 1058409378 /nfs/dbraw/zinc/40/93/78/1058409378.db2.gz GSTRDTIOOPKFCQ-UHFFFAOYSA-N 1 2 309.413 4.212 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H](C)C2CCCC2)[nH+]c1C ZINC001551744207 1058411768 /nfs/dbraw/zinc/41/17/68/1058411768.db2.gz ZDQVCWIEEVAPAJ-LBPRGKRZSA-N 1 2 311.429 4.458 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)NCc1c[nH+]c(C)cc1C ZINC001528520911 1058443361 /nfs/dbraw/zinc/44/33/61/1058443361.db2.gz DOCPCYDRVRDNKY-KRWDZBQOSA-N 1 2 302.462 4.311 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@@H]2C[C@H](C)CC[C@H]2C(C)C)c(C)[nH+]1 ZINC001519675453 1058457502 /nfs/dbraw/zinc/45/75/02/1058457502.db2.gz UKPQHESUXKBGGM-BVGQSLNGSA-N 1 2 316.489 4.445 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)c2c(C)oc(C)c2C)[nH+]c1C ZINC001553986632 1058510914 /nfs/dbraw/zinc/51/09/14/1058510914.db2.gz DMELFBAQRWECCI-UHFFFAOYSA-N 1 2 323.396 4.464 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H](C)Cc2ccco2)[nH+]c1C ZINC001553987717 1058511919 /nfs/dbraw/zinc/51/19/19/1058511919.db2.gz JIAPSEQMKPOTRS-LBPRGKRZSA-N 1 2 323.396 4.104 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1noc([C@@H]2CC[C@H](c3ccccc3)C2)n1 ZINC001554098286 1058518813 /nfs/dbraw/zinc/51/88/13/1058518813.db2.gz BHWVKQUGCYCHBW-LSDHHAIUSA-N 1 2 320.396 4.074 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1noc([C@H]2CC[C@H](c3ccccc3)C2)n1 ZINC001554099454 1058518881 /nfs/dbraw/zinc/51/88/81/1058518881.db2.gz RYFBKVRGIQGTPQ-GJZGRUSLSA-N 1 2 320.396 4.074 20 0 DIADLO CCOc1c(F)cc(-c2cc3[nH]c[nH+]c3cc2OC)cc1Cl ZINC001245824175 1058520099 /nfs/dbraw/zinc/52/00/99/1058520099.db2.gz XAXPYFZESFXPOP-UHFFFAOYSA-N 1 2 320.751 4.430 20 0 DIADLO CSc1c(Cl)c(C)ccc1-c1ccn2cc(N)[nH+]c2c1 ZINC001245833095 1058535512 /nfs/dbraw/zinc/53/55/12/1058535512.db2.gz CVYMHBHSGYNYCJ-UHFFFAOYSA-N 1 2 303.818 4.267 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3cccc4ccsc43)ccn12 ZINC001520174856 1058556885 /nfs/dbraw/zinc/55/68/85/1058556885.db2.gz JMAAHICWAPHSTA-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO COc1cc(-c2cc3[nH]ccc3c(C)[nH+]2)c(F)c(F)c1Cl ZINC001245856640 1058563759 /nfs/dbraw/zinc/56/37/59/1058563759.db2.gz DXXILXOPWVLJRX-UHFFFAOYSA-N 1 2 308.715 4.479 20 0 DIADLO CC[C@H](C)c1ccc(C(=O)Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC001528983005 1058569426 /nfs/dbraw/zinc/56/94/26/1058569426.db2.gz JJNMYZUDEXPTGR-ZDUSSCGKSA-N 1 2 307.397 4.409 20 0 DIADLO Cc1cn2cc(NC(=O)/C(F)=C\C3CCCCC3)ccc2[nH+]1 ZINC001528984334 1058569843 /nfs/dbraw/zinc/56/98/43/1058569843.db2.gz ZVJZAYIJYHYMAD-OQLLNIDSSA-N 1 2 301.365 4.015 20 0 DIADLO Cc1cn2cc(NC(=O)/C(F)=C/C3CCCCC3)ccc2[nH+]1 ZINC001528984333 1058570147 /nfs/dbraw/zinc/57/01/47/1058570147.db2.gz ZVJZAYIJYHYMAD-DHDCSXOGSA-N 1 2 301.365 4.015 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(CO)c(F)c2Cl)c1 ZINC001245880610 1058587788 /nfs/dbraw/zinc/58/77/88/1058587788.db2.gz AXHAIFASMLWTEH-UHFFFAOYSA-N 1 2 316.763 4.039 20 0 DIADLO Cc1cccc(Oc2ccccc2C(=O)Nc2cc[nH+]c(C)c2)c1 ZINC001520753652 1058675584 /nfs/dbraw/zinc/67/55/84/1058675584.db2.gz OQJXBEOEOCQLQB-UHFFFAOYSA-N 1 2 318.376 4.165 20 0 DIADLO CC(C)(C)C1CCC(=CC(=O)Nc2cccc3[nH+]ccn32)CC1 ZINC001529432895 1058712464 /nfs/dbraw/zinc/71/24/64/1058712464.db2.gz QXZDDIBLKOJTJA-UHFFFAOYSA-N 1 2 311.429 4.436 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N[C@@H](c3ccccc3C)C(C)C)ccn12 ZINC001521311122 1058817802 /nfs/dbraw/zinc/81/78/02/1058817802.db2.gz DDQQNZZWYHOKSE-LJQANCHMSA-N 1 2 321.424 4.078 20 0 DIADLO C/C(=C/C(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1)c1ccco1 ZINC001558136089 1058840792 /nfs/dbraw/zinc/84/07/92/1058840792.db2.gz XXOMRSICPVUKRF-QXMHVHEDSA-N 1 2 321.380 4.329 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H](C)c1ccccc1C ZINC001558975827 1058933344 /nfs/dbraw/zinc/93/33/44/1058933344.db2.gz PDFWIOPYRJNRMG-OAHLLOKOSA-N 1 2 319.408 4.436 20 0 DIADLO c1cc2c(nc[nH+]c2Nc2cccc(Oc3ccccc3)c2)[nH]1 ZINC001559053140 1058952142 /nfs/dbraw/zinc/95/21/42/1058952142.db2.gz WPRJVOWTNJUICU-UHFFFAOYSA-N 1 2 302.337 4.494 20 0 DIADLO CCc1nc(N(Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)cc(C)[nH+]1 ZINC001559067002 1058961692 /nfs/dbraw/zinc/96/16/92/1058961692.db2.gz SMARECDWHQMHEK-BLLLJJGKSA-N 1 2 311.429 4.233 20 0 DIADLO Cc1cc(N[C@@H](C)Cc2ccccc2Cl)nc(C2CC2)[nH+]1 ZINC001559071339 1058964748 /nfs/dbraw/zinc/96/47/48/1058964748.db2.gz MXNAWWZQUFSZEL-NSHDSACASA-N 1 2 301.821 4.359 20 0 DIADLO CCO[C@@H]1C[C@@H](Nc2cc(C)[nH+]c(C3CC3)n2)C12CCCCC2 ZINC001559105641 1058990404 /nfs/dbraw/zinc/99/04/04/1058990404.db2.gz XEHRBWJAHZPPEQ-HZPDHXFCSA-N 1 2 315.461 4.202 20 0 DIADLO CCc1nc([C@H](C)Nc2cc(C)[nH+]c(C3CCC3)n2)cs1 ZINC001559108222 1058996082 /nfs/dbraw/zinc/99/60/82/1058996082.db2.gz FIASZGNGYZLWKY-NSHDSACASA-N 1 2 302.447 4.245 20 0 DIADLO CCc1cc(N2C[C@@H](c3ccccc3C)C[C@@H]2C)nc(CC)[nH+]1 ZINC001559114326 1059000065 /nfs/dbraw/zinc/00/00/65/1059000065.db2.gz PMUAODXQETZRHY-HOTGVXAUSA-N 1 2 309.457 4.292 20 0 DIADLO Cc1nc(N2CCc3cc(-c4ccccc4)oc3C2)c(C)c(C)[nH+]1 ZINC001559123974 1059012154 /nfs/dbraw/zinc/01/21/54/1059012154.db2.gz SWMUUBUUHMCLHD-UHFFFAOYSA-N 1 2 319.408 4.225 20 0 DIADLO CO[C@@]1(C)C[C@@H](N(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)C1(C)C ZINC001559125173 1059014815 /nfs/dbraw/zinc/01/48/15/1059014815.db2.gz FRHQXHKPJDHPOL-BEFAXECRSA-N 1 2 319.493 4.363 20 0 DIADLO Cc1ccc(CNc2cc(C)[nH+]c(C3CC3)n2)c(OCC2CC2)c1 ZINC001559132339 1059021106 /nfs/dbraw/zinc/02/11/06/1059021106.db2.gz LEVFGQLKEJICLL-UHFFFAOYSA-N 1 2 323.440 4.372 20 0 DIADLO CC(C)c1cc(N[C@H](C2CC2)C2CCOCC2)nc(C(C)C)[nH+]1 ZINC001559227529 1059104602 /nfs/dbraw/zinc/10/46/02/1059104602.db2.gz UFADSSONNWDBFR-GOSISDBHSA-N 1 2 317.477 4.341 20 0 DIADLO Cc1cc(NCCSCCC(F)(F)F)nc(C2CCC2)[nH+]1 ZINC001559258731 1059127608 /nfs/dbraw/zinc/12/76/08/1059127608.db2.gz QSYJSXMPGRRHLP-UHFFFAOYSA-N 1 2 319.396 4.150 20 0 DIADLO FC1(F)CCC[C@@H]1CCNc1nc2ccccc2n2c[nH+]cc12 ZINC001559266549 1059131043 /nfs/dbraw/zinc/13/10/43/1059131043.db2.gz FALNFBRBIQJMAU-GFCCVEGCSA-N 1 2 316.355 4.120 20 0 DIADLO CC(C)c1cc(NC[C@H]2CCC(C)(C)CO2)nc(C(C)C)[nH+]1 ZINC001559268093 1059131466 /nfs/dbraw/zinc/13/14/66/1059131466.db2.gz QPKRAIOXDHBCSD-CQSZACIVSA-N 1 2 305.466 4.341 20 0 DIADLO Cc1ccc2sc(NCc3[nH]c4c([nH+]3)CCCC4)nc2c1C ZINC001559288006 1059144359 /nfs/dbraw/zinc/14/43/59/1059144359.db2.gz LYMUBZWSBRBMLT-UHFFFAOYSA-N 1 2 312.442 4.127 20 0 DIADLO Cc1cc(NCC[C@@H]2OCCc3ccccc32)nc(C2CCC2)[nH+]1 ZINC001559288740 1059144831 /nfs/dbraw/zinc/14/48/31/1059144831.db2.gz QHOZRKNUKGINTE-SFHVURJKSA-N 1 2 323.440 4.169 20 0 DIADLO Cc1nc(N2C[C@H](c3ccccc3)CC2(C)C)c2c([nH+]1)CCCC2 ZINC001559293016 1059146355 /nfs/dbraw/zinc/14/63/55/1059146355.db2.gz NHOREGIRHIFXLH-QGZVFWFLSA-N 1 2 321.468 4.436 20 0 DIADLO Cc1ccc(SCc2cccc(C[NH+]3CCOCC3)c2)s1 ZINC001559426344 1059224787 /nfs/dbraw/zinc/22/47/87/1059224787.db2.gz OYCNKBAQOQXJRO-UHFFFAOYSA-N 1 2 319.495 4.181 20 0 DIADLO [NH3+][C@H](c1nc2ccc(Oc3ccccc3)cc2[nH]1)c1ccccc1 ZINC001247012648 1059243136 /nfs/dbraw/zinc/24/31/36/1059243136.db2.gz QMEHVRSMATXABK-IBGZPJMESA-N 1 2 315.376 4.403 20 0 DIADLO CC[C@@H]([NH3+])c1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1 ZINC001247017538 1059246595 /nfs/dbraw/zinc/24/65/95/1059246595.db2.gz NUIMLNXIYYMWKE-SSDOTTSWSA-N 1 2 311.229 4.010 20 0 DIADLO c1cc(N2CCCC2)cc2[nH+]c(-c3ccc4c(c3)CCCN4)[nH]c12 ZINC001247015527 1059247032 /nfs/dbraw/zinc/24/70/32/1059247032.db2.gz SMBBTMHBQYUCKM-UHFFFAOYSA-N 1 2 318.424 4.188 20 0 DIADLO CC(C)(C)c1ccc(/C=C\C(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC001531286242 1059269874 /nfs/dbraw/zinc/26/98/74/1059269874.db2.gz RQZGYKDKKDCFDE-XFXZXTDPSA-N 1 2 319.408 4.284 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](Cc1cnn(CCF)c1)C1CC1 ZINC001559525242 1059323776 /nfs/dbraw/zinc/32/37/76/1059323776.db2.gz FXKCOWCWLNLNMX-ZDUSSCGKSA-N 1 2 321.827 4.232 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](Cc1cnn(CCF)c1)C1CC1 ZINC001559525242 1059323793 /nfs/dbraw/zinc/32/37/93/1059323793.db2.gz FXKCOWCWLNLNMX-ZDUSSCGKSA-N 1 2 321.827 4.232 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](Cc1cnn(CCF)c1)C1CC1 ZINC001559525241 1059325490 /nfs/dbraw/zinc/32/54/90/1059325490.db2.gz FXKCOWCWLNLNMX-CYBMUJFWSA-N 1 2 321.827 4.232 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](Cc1cnn(CCF)c1)C1CC1 ZINC001559525241 1059325510 /nfs/dbraw/zinc/32/55/10/1059325510.db2.gz FXKCOWCWLNLNMX-CYBMUJFWSA-N 1 2 321.827 4.232 20 0 DIADLO C(=C/c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1)\c1ccsc1 ZINC001247177111 1059327591 /nfs/dbraw/zinc/32/75/91/1059327591.db2.gz JQKSEIVFQAWXFM-LZCJLJQNSA-N 1 2 320.377 4.154 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2ncccc2Cl)[C@@H]1c1ccccc1 ZINC001559543529 1059343723 /nfs/dbraw/zinc/34/37/23/1059343723.db2.gz XJVAMUROZJEPIC-DYVFJYSZSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2ncccc2Cl)[C@@H]1c1ccccc1 ZINC001559543529 1059343739 /nfs/dbraw/zinc/34/37/39/1059343739.db2.gz XJVAMUROZJEPIC-DYVFJYSZSA-N 1 2 318.873 4.414 20 0 DIADLO Cc1cccc(-c2noc([C@H]3CCC[N@@H+]3Cc3ccco3)n2)c1C ZINC001247226878 1059353253 /nfs/dbraw/zinc/35/32/53/1059353253.db2.gz YCBASIJJZJFHDL-QGZVFWFLSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cccc(-c2noc([C@H]3CCC[N@H+]3Cc3ccco3)n2)c1C ZINC001247226878 1059353276 /nfs/dbraw/zinc/35/32/76/1059353276.db2.gz YCBASIJJZJFHDL-QGZVFWFLSA-N 1 2 323.396 4.284 20 0 DIADLO CCc1ccc(NC(=S)Nc2cccc3[nH+]c(C)cn32)cc1 ZINC001247281558 1059367460 /nfs/dbraw/zinc/36/74/60/1059367460.db2.gz AWRGQDHNGYOIIQ-UHFFFAOYSA-N 1 2 310.426 4.014 20 0 DIADLO c1cn(-c2ccccc2-c2noc(C34CCC(CC3)CC4)n2)c[nH+]1 ZINC001247359006 1059397899 /nfs/dbraw/zinc/39/78/99/1059397899.db2.gz IAEDMFWHZMRUJV-UHFFFAOYSA-N 1 2 320.396 4.144 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1noc2c1CC(C)(C)CC2 ZINC001559576151 1059407534 /nfs/dbraw/zinc/40/75/34/1059407534.db2.gz UBZZZFPTJPZCMZ-CQSZACIVSA-N 1 2 310.441 4.136 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1noc2c1CC(C)(C)CC2 ZINC001559576151 1059407542 /nfs/dbraw/zinc/40/75/42/1059407542.db2.gz UBZZZFPTJPZCMZ-CQSZACIVSA-N 1 2 310.441 4.136 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCc3c(F)ccc(F)c3C2)cc1 ZINC001559584215 1059415546 /nfs/dbraw/zinc/41/55/46/1059415546.db2.gz FYMRYIPUZCORDH-UHFFFAOYSA-N 1 2 301.380 4.476 20 0 DIADLO CCCc1ccc(C[N@H+]2CCc3c(F)ccc(F)c3C2)cc1 ZINC001559584215 1059415549 /nfs/dbraw/zinc/41/55/49/1059415549.db2.gz FYMRYIPUZCORDH-UHFFFAOYSA-N 1 2 301.380 4.476 20 0 DIADLO CC1(C)CC[C@@H](C[N@@H+]2CCc3cc(Cl)cc(Cl)c3C2)O1 ZINC001559590127 1059424267 /nfs/dbraw/zinc/42/42/67/1059424267.db2.gz IHNYRLVGFMKCGV-ZDUSSCGKSA-N 1 2 314.256 4.309 20 0 DIADLO CC1(C)CC[C@@H](C[N@H+]2CCc3cc(Cl)cc(Cl)c3C2)O1 ZINC001559590127 1059424275 /nfs/dbraw/zinc/42/42/75/1059424275.db2.gz IHNYRLVGFMKCGV-ZDUSSCGKSA-N 1 2 314.256 4.309 20 0 DIADLO CC(C)CN(Cc1cc[nH+]c(N(C)C)c1)c1ccc(Cl)cc1 ZINC001559601476 1059434802 /nfs/dbraw/zinc/43/48/02/1059434802.db2.gz CDAZCLMKBKHGEI-UHFFFAOYSA-N 1 2 317.864 4.464 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC001559603283 1059438022 /nfs/dbraw/zinc/43/80/22/1059438022.db2.gz QCVVCWCIEQTYJO-CHWSQXEVSA-N 1 2 309.837 4.207 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC001559603283 1059438030 /nfs/dbraw/zinc/43/80/30/1059438030.db2.gz QCVVCWCIEQTYJO-CHWSQXEVSA-N 1 2 309.837 4.207 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CCC[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC001531873657 1059440393 /nfs/dbraw/zinc/44/03/93/1059440393.db2.gz YTZHPHKUTCDAFP-QZTJIDSGSA-N 1 2 308.425 4.073 20 0 DIADLO OC[C@H]1c2ccccc2CC[N@H+]1Cc1cc(Cl)cc(Cl)c1 ZINC001559624697 1059453040 /nfs/dbraw/zinc/45/30/40/1059453040.db2.gz SNOPJKMGUSQJSV-KRWDZBQOSA-N 1 2 322.235 4.085 20 0 DIADLO OC[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(Cl)cc(Cl)c1 ZINC001559624697 1059453047 /nfs/dbraw/zinc/45/30/47/1059453047.db2.gz SNOPJKMGUSQJSV-KRWDZBQOSA-N 1 2 322.235 4.085 20 0 DIADLO CCc1ncc(C[N@@H+]2CCc3cc(-c4ccccc4)oc3C2)o1 ZINC001559632310 1059460187 /nfs/dbraw/zinc/46/01/87/1059460187.db2.gz FIATYBVPNSHSEB-UHFFFAOYSA-N 1 2 308.381 4.055 20 0 DIADLO CCc1ncc(C[N@H+]2CCc3cc(-c4ccccc4)oc3C2)o1 ZINC001559632310 1059460200 /nfs/dbraw/zinc/46/02/00/1059460200.db2.gz FIATYBVPNSHSEB-UHFFFAOYSA-N 1 2 308.381 4.055 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CN1CCCc2cccc(F)c21 ZINC001559639275 1059465940 /nfs/dbraw/zinc/46/59/40/1059465940.db2.gz GUHKLHFHSVAJJS-UHFFFAOYSA-N 1 2 321.399 4.273 20 0 DIADLO CCCCC[N@H+](C)[C@@H](C(=O)OC)c1ccc(Cl)c(Cl)c1 ZINC001559643501 1059468240 /nfs/dbraw/zinc/46/82/40/1059468240.db2.gz BBQFFEWTFPFXOC-CQSZACIVSA-N 1 2 318.244 4.330 20 0 DIADLO CCCCC[N@@H+](C)[C@@H](C(=O)OC)c1ccc(Cl)c(Cl)c1 ZINC001559643501 1059468248 /nfs/dbraw/zinc/46/82/48/1059468248.db2.gz BBQFFEWTFPFXOC-CQSZACIVSA-N 1 2 318.244 4.330 20 0 DIADLO Cn1c2ccccc2nc1C[N@H+](Cc1ccccc1F)C1CCC1 ZINC001559651130 1059479957 /nfs/dbraw/zinc/47/99/57/1059479957.db2.gz YSFQSEJFYAVSAJ-UHFFFAOYSA-N 1 2 323.415 4.267 20 0 DIADLO Cn1c2ccccc2nc1C[N@@H+](Cc1ccccc1F)C1CCC1 ZINC001559651130 1059480002 /nfs/dbraw/zinc/48/00/02/1059480002.db2.gz YSFQSEJFYAVSAJ-UHFFFAOYSA-N 1 2 323.415 4.267 20 0 DIADLO c1cn(-c2ccccc2-c2noc(C3CCCCCC3)n2)c[nH+]1 ZINC001247539451 1059525150 /nfs/dbraw/zinc/52/51/50/1059525150.db2.gz RVJGQKNOAKTKGD-UHFFFAOYSA-N 1 2 308.385 4.360 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC001559721944 1059553119 /nfs/dbraw/zinc/55/31/19/1059553119.db2.gz FOBJEVCITDEOHX-UHFFFAOYSA-N 1 2 319.754 4.433 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC001559721944 1059553137 /nfs/dbraw/zinc/55/31/37/1059553137.db2.gz FOBJEVCITDEOHX-UHFFFAOYSA-N 1 2 319.754 4.433 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)ccc(C)c2F)o1 ZINC001559726623 1059557599 /nfs/dbraw/zinc/55/75/99/1059557599.db2.gz VNQMDRDMPGSVBX-MRXNPFEDSA-N 1 2 321.367 4.350 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2c(F)ccc(C)c2F)o1 ZINC001559726623 1059557615 /nfs/dbraw/zinc/55/76/15/1059557615.db2.gz VNQMDRDMPGSVBX-MRXNPFEDSA-N 1 2 321.367 4.350 20 0 DIADLO Fc1cccc(F)c1C[N@H+](C[C@H]1CCC2(CCC2)CO1)C1CC1 ZINC001559746114 1059579175 /nfs/dbraw/zinc/57/91/75/1059579175.db2.gz NJKIJJAJDGNAHS-OAHLLOKOSA-N 1 2 321.411 4.279 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](C[C@H]1CCC2(CCC2)CO1)C1CC1 ZINC001559746114 1059579191 /nfs/dbraw/zinc/57/91/91/1059579191.db2.gz NJKIJJAJDGNAHS-OAHLLOKOSA-N 1 2 321.411 4.279 20 0 DIADLO C[C@H](CC(=O)OCCCc1cccc2ccccc21)n1cc[nH+]c1 ZINC001532286163 1059580013 /nfs/dbraw/zinc/58/00/13/1059580013.db2.gz HTIUECJGNIEAMZ-MRXNPFEDSA-N 1 2 322.408 4.163 20 0 DIADLO [NH3+][C@H](c1nc(-c2cc(Cl)ccc2Cl)no1)c1ccccc1 ZINC001247649853 1059587288 /nfs/dbraw/zinc/58/72/88/1059587288.db2.gz CTNCPMMDSDUIMV-ZDUSSCGKSA-N 1 2 320.179 4.092 20 0 DIADLO Cc1ccc(-c2noc([C@@H]([NH3+])c3ccccc3)n2)c2ccccc12 ZINC001247651937 1059589825 /nfs/dbraw/zinc/58/98/25/1059589825.db2.gz QANBSOBAXVZTET-SFHVURJKSA-N 1 2 315.376 4.246 20 0 DIADLO [NH3+][C@@H](c1nc(-c2ccc(Cl)cc2Cl)no1)c1ccccc1 ZINC001247652733 1059589858 /nfs/dbraw/zinc/58/98/58/1059589858.db2.gz YNTXCUFTMFKFNQ-CYBMUJFWSA-N 1 2 320.179 4.092 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@@H]1CCCC[C@@H]1C1CC1 ZINC001532353891 1059601157 /nfs/dbraw/zinc/60/11/57/1059601157.db2.gz VBVRVNQKALYYKS-QZTJIDSGSA-N 1 2 309.413 4.027 20 0 DIADLO C[C@H]1CCCC[C@@H]1c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001247733939 1059604392 /nfs/dbraw/zinc/60/43/92/1059604392.db2.gz HJMLQYSSWNJAON-BBRMVZONSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@H](c1ccsc1)N1CC[NH+]([C@@H](C)c2ccccc2F)CC1 ZINC001559771994 1059610400 /nfs/dbraw/zinc/61/04/00/1059610400.db2.gz LALAKXPOCIEBMT-CABCVRRESA-N 1 2 318.461 4.327 20 0 DIADLO FC1(c2nc(-c3ccccc3-n3cc[nH+]c3)no2)CCCCC1 ZINC001247780455 1059623849 /nfs/dbraw/zinc/62/38/49/1059623849.db2.gz KLMGWYJYCNSJNE-UHFFFAOYSA-N 1 2 312.348 4.051 20 0 DIADLO CCC(C)(C)C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001532429505 1059627473 /nfs/dbraw/zinc/62/74/73/1059627473.db2.gz BHMBYAGUQFFMPW-UHFFFAOYSA-N 1 2 312.413 4.228 20 0 DIADLO C[C@@H]1C[N@H+](CCc2cccc(Cl)c2Cl)C[C@H](C2CC2)O1 ZINC001559802216 1059640996 /nfs/dbraw/zinc/64/09/96/1059640996.db2.gz ULQZTRLHZLYRQL-IAQYHMDHSA-N 1 2 314.256 4.035 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)C[C@H](C2CC2)O1 ZINC001559802216 1059641009 /nfs/dbraw/zinc/64/10/09/1059641009.db2.gz ULQZTRLHZLYRQL-IAQYHMDHSA-N 1 2 314.256 4.035 20 0 DIADLO CC(C)Cc1ccccc1C[N@@H+]1C[C@@H](C(F)(F)F)OC[C@@H]1C ZINC001559825075 1059657889 /nfs/dbraw/zinc/65/78/89/1059657889.db2.gz DHRMGGJSUULJMK-BBRMVZONSA-N 1 2 315.379 4.037 20 0 DIADLO CC(C)Cc1ccccc1C[N@H+]1C[C@@H](C(F)(F)F)OC[C@@H]1C ZINC001559825075 1059657896 /nfs/dbraw/zinc/65/78/96/1059657896.db2.gz DHRMGGJSUULJMK-BBRMVZONSA-N 1 2 315.379 4.037 20 0 DIADLO CC(C)Cc1ccccc1C[N@@H+]1C[C@H](C(F)(F)F)OC[C@@H]1C ZINC001559825078 1059659223 /nfs/dbraw/zinc/65/92/23/1059659223.db2.gz DHRMGGJSUULJMK-XJKSGUPXSA-N 1 2 315.379 4.037 20 0 DIADLO CC(C)Cc1ccccc1C[N@H+]1C[C@H](C(F)(F)F)OC[C@@H]1C ZINC001559825078 1059659235 /nfs/dbraw/zinc/65/92/35/1059659235.db2.gz DHRMGGJSUULJMK-XJKSGUPXSA-N 1 2 315.379 4.037 20 0 DIADLO C[C@H](c1nc2ccc(Cl)cc2[nH]1)[N@H+](C)CCOCC1CCC1 ZINC001559846477 1059673613 /nfs/dbraw/zinc/67/36/13/1059673613.db2.gz IBIWOGRTGNRPSE-GFCCVEGCSA-N 1 2 321.852 4.026 20 0 DIADLO C[C@H](c1nc2ccc(Cl)cc2[nH]1)[N@@H+](C)CCOCC1CCC1 ZINC001559846477 1059673624 /nfs/dbraw/zinc/67/36/24/1059673624.db2.gz IBIWOGRTGNRPSE-GFCCVEGCSA-N 1 2 321.852 4.026 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc3ccccc3c2)C[C@@H](C(F)(F)F)O1 ZINC001559858849 1059679731 /nfs/dbraw/zinc/67/97/31/1059679731.db2.gz MDSBMHOZZLQEBS-INIZCTEOSA-N 1 2 323.358 4.382 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc3ccccc3c2)C[C@@H](C(F)(F)F)O1 ZINC001559858849 1059679741 /nfs/dbraw/zinc/67/97/41/1059679741.db2.gz MDSBMHOZZLQEBS-INIZCTEOSA-N 1 2 323.358 4.382 20 0 DIADLO COC(=O)[C@@H](c1ccsc1)[NH+]1CCC(C)(CC(C)C)CC1 ZINC001559884138 1059703449 /nfs/dbraw/zinc/70/34/49/1059703449.db2.gz LLOPZBQQWFVIOJ-OAHLLOKOSA-N 1 2 309.475 4.110 20 0 DIADLO CCCc1ccc(C[N@H+]([C@@H](C)C(=O)OC(C)(C)C)C2CC2)cc1 ZINC001559901225 1059717432 /nfs/dbraw/zinc/71/74/32/1059717432.db2.gz MWNXYPPEAJZPCJ-HNNXBMFYSA-N 1 2 317.473 4.334 20 0 DIADLO CCCc1ccc(C[N@@H+]([C@@H](C)C(=O)OC(C)(C)C)C2CC2)cc1 ZINC001559901225 1059717454 /nfs/dbraw/zinc/71/74/54/1059717454.db2.gz MWNXYPPEAJZPCJ-HNNXBMFYSA-N 1 2 317.473 4.334 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3Cc4ccccc4C[N@H+]3C)n2)c(C)c1 ZINC001248119660 1059733162 /nfs/dbraw/zinc/73/31/62/1059733162.db2.gz LPEUXAYYYDJEKV-SFHVURJKSA-N 1 2 319.408 4.083 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3Cc4ccccc4C[N@@H+]3C)n2)c(C)c1 ZINC001248119660 1059733180 /nfs/dbraw/zinc/73/31/80/1059733180.db2.gz LPEUXAYYYDJEKV-SFHVURJKSA-N 1 2 319.408 4.083 20 0 DIADLO Cc1cccc(-c2noc([C@H]3Cc4ccccc4C[N@H+]3C)n2)c1C ZINC001248121396 1059734909 /nfs/dbraw/zinc/73/49/09/1059734909.db2.gz WNXKLYNFJJNVEA-GOSISDBHSA-N 1 2 319.408 4.083 20 0 DIADLO Cc1cccc(-c2noc([C@H]3Cc4ccccc4C[N@@H+]3C)n2)c1C ZINC001248121396 1059734930 /nfs/dbraw/zinc/73/49/30/1059734930.db2.gz WNXKLYNFJJNVEA-GOSISDBHSA-N 1 2 319.408 4.083 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2)[C@@H]1C(=O)OC(C)(C)C ZINC001559929600 1059739646 /nfs/dbraw/zinc/73/96/46/1059739646.db2.gz OJHSKCWCSGZEDN-BBRMVZONSA-N 1 2 323.864 4.282 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2)[C@@H]1C(=O)OC(C)(C)C ZINC001559929600 1059739666 /nfs/dbraw/zinc/73/96/66/1059739666.db2.gz OJHSKCWCSGZEDN-BBRMVZONSA-N 1 2 323.864 4.282 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Br)cc(F)c2F)[C@H](C)C1 ZINC001559929961 1059744158 /nfs/dbraw/zinc/74/41/58/1059744158.db2.gz YBJQXBXOBQBFMA-NXEZZACHSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2F)[C@H](C)C1 ZINC001559929961 1059744174 /nfs/dbraw/zinc/74/41/74/1059744174.db2.gz YBJQXBXOBQBFMA-NXEZZACHSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@@H](c1ccc2ccccc2c1)[N@@H+]1Cc2ccccc2NC(=O)C1 ZINC001559945101 1059757261 /nfs/dbraw/zinc/75/72/61/1059757261.db2.gz HDINIAIHSNVMOC-HNNXBMFYSA-N 1 2 316.404 4.355 20 0 DIADLO C[C@@H](c1ccc2ccccc2c1)[N@H+]1Cc2ccccc2NC(=O)C1 ZINC001559945101 1059757278 /nfs/dbraw/zinc/75/72/78/1059757278.db2.gz HDINIAIHSNVMOC-HNNXBMFYSA-N 1 2 316.404 4.355 20 0 DIADLO Oc1ccc(Cl)c(C[NH2+]C2(c3ccccc3F)CCC2)c1 ZINC001559940962 1059759219 /nfs/dbraw/zinc/75/92/19/1059759219.db2.gz GSPQMRVRWDIFFG-UHFFFAOYSA-N 1 2 305.780 4.354 20 0 DIADLO Cc1noc([C@H](C)[N@H+](C)Cc2c(C)c(C)c(C)c(C)c2C)n1 ZINC001559949011 1059759887 /nfs/dbraw/zinc/75/98/87/1059759887.db2.gz LGBSUDCEZIBABC-HNNXBMFYSA-N 1 2 301.434 4.113 20 0 DIADLO Cc1noc([C@H](C)[N@@H+](C)Cc2c(C)c(C)c(C)c(C)c2C)n1 ZINC001559949011 1059759901 /nfs/dbraw/zinc/75/99/01/1059759901.db2.gz LGBSUDCEZIBABC-HNNXBMFYSA-N 1 2 301.434 4.113 20 0 DIADLO c1cc2cc(-c3noc(C[NH2+]Cc4ccccc4)n3)ccc2s1 ZINC001248302851 1059780206 /nfs/dbraw/zinc/78/02/06/1059780206.db2.gz RHWDMOOADQHQGL-UHFFFAOYSA-N 1 2 321.405 4.241 20 0 DIADLO C[C@@H](c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1)c1ccccc1 ZINC001248330278 1059781411 /nfs/dbraw/zinc/78/14/11/1059781411.db2.gz CZARUECNIKGFIN-CQSZACIVSA-N 1 2 316.364 4.074 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3oc(-c4ccccc4)cc3C2)sn1 ZINC001559975442 1059783864 /nfs/dbraw/zinc/78/38/64/1059783864.db2.gz OQYWYQWLJBUUPT-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1cc(C[N@H+]2CCc3oc(-c4ccccc4)cc3C2)sn1 ZINC001559975442 1059783877 /nfs/dbraw/zinc/78/38/77/1059783877.db2.gz OQYWYQWLJBUUPT-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO COc1cccc(C[N@@H+]2CC[C@@H]2c2ccc(F)cc2)c1Cl ZINC001559984193 1059789465 /nfs/dbraw/zinc/78/94/65/1059789465.db2.gz VIHXFBKSEWOGEF-OAHLLOKOSA-N 1 2 305.780 4.435 20 0 DIADLO COc1cccc(C[N@H+]2CC[C@@H]2c2ccc(F)cc2)c1Cl ZINC001559984193 1059789478 /nfs/dbraw/zinc/78/94/78/1059789478.db2.gz VIHXFBKSEWOGEF-OAHLLOKOSA-N 1 2 305.780 4.435 20 0 DIADLO Fc1cccc([C@H]2COCC[N@@H+]2C[C@@H]2CCCCC2(F)F)c1 ZINC001560001715 1059806244 /nfs/dbraw/zinc/80/62/44/1059806244.db2.gz GEGCZCJPFQYKEF-GOEBONIOSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1cccc([C@H]2COCC[N@H+]2C[C@@H]2CCCCC2(F)F)c1 ZINC001560001715 1059806271 /nfs/dbraw/zinc/80/62/71/1059806271.db2.gz GEGCZCJPFQYKEF-GOEBONIOSA-N 1 2 313.363 4.025 20 0 DIADLO Cc1ccc(F)cc1C[N@H+](CC(=O)OC(C)(C)C)CC(C)(C)C ZINC001560020675 1059834103 /nfs/dbraw/zinc/83/41/03/1059834103.db2.gz JAWWRHLODKBLLV-UHFFFAOYSA-N 1 2 323.452 4.324 20 0 DIADLO Cc1ccc(F)cc1C[N@@H+](CC(=O)OC(C)(C)C)CC(C)(C)C ZINC001560020675 1059834132 /nfs/dbraw/zinc/83/41/32/1059834132.db2.gz JAWWRHLODKBLLV-UHFFFAOYSA-N 1 2 323.452 4.324 20 0 DIADLO C[N@H+](Cc1cccc(F)c1F)Cc1c2ccoc2ccc1F ZINC001248545901 1059878967 /nfs/dbraw/zinc/87/89/67/1059878967.db2.gz TWRIITXSDSWOLF-UHFFFAOYSA-N 1 2 305.299 4.482 20 0 DIADLO C[N@@H+](Cc1cccc(F)c1F)Cc1c2ccoc2ccc1F ZINC001248545901 1059878994 /nfs/dbraw/zinc/87/89/94/1059878994.db2.gz TWRIITXSDSWOLF-UHFFFAOYSA-N 1 2 305.299 4.482 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@H+](Cc2noc3c2CCCC3)C1 ZINC001560081764 1059892086 /nfs/dbraw/zinc/89/20/86/1059892086.db2.gz MMNKWHVTEIUWTE-IBGZPJMESA-N 1 2 314.404 4.014 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@@H+](Cc2noc3c2CCCC3)C1 ZINC001560081764 1059892113 /nfs/dbraw/zinc/89/21/13/1059892113.db2.gz MMNKWHVTEIUWTE-IBGZPJMESA-N 1 2 314.404 4.014 20 0 DIADLO CCCOC(=O)[C@H](C)[NH2+][C@H]1CCC(C)(C)C[C@@H]1c1ccccc1 ZINC001560092854 1059902686 /nfs/dbraw/zinc/90/26/86/1059902686.db2.gz QTQNRWPTXSMUIB-JQHSSLGASA-N 1 2 317.473 4.280 20 0 DIADLO COc1c(C[N@H+](C)Cc2ccncc2)ccc(Cl)c1Cl ZINC001248628377 1059917400 /nfs/dbraw/zinc/91/74/00/1059917400.db2.gz OUEAYOUJIFDUAU-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1c(C[N@@H+](C)Cc2ccncc2)ccc(Cl)c1Cl ZINC001248628377 1059917417 /nfs/dbraw/zinc/91/74/17/1059917417.db2.gz OUEAYOUJIFDUAU-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1nccc(Cl)c1C[N@@H+]1CCC[C@H]1c1cccs1 ZINC001248794600 1059978815 /nfs/dbraw/zinc/97/88/15/1059978815.db2.gz USRKCYGYWQOOTD-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO COc1nccc(Cl)c1C[N@H+]1CCC[C@H]1c1cccs1 ZINC001248794600 1059978834 /nfs/dbraw/zinc/97/88/34/1059978834.db2.gz USRKCYGYWQOOTD-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ncc(C(F)(F)F)cc1F ZINC001248790083 1059980258 /nfs/dbraw/zinc/98/02/58/1059980258.db2.gz AONJCUITZNZXBS-LLVKDONJSA-N 1 2 324.321 4.186 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ncc(C(F)(F)F)cc1F ZINC001248790083 1059980283 /nfs/dbraw/zinc/98/02/83/1059980283.db2.gz AONJCUITZNZXBS-LLVKDONJSA-N 1 2 324.321 4.186 20 0 DIADLO Fc1cc(C(F)(F)F)cnc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001248790216 1059980588 /nfs/dbraw/zinc/98/05/88/1059980588.db2.gz IANWSWLZDLNONR-OAHLLOKOSA-N 1 2 310.294 4.187 20 0 DIADLO Fc1cc(C(F)(F)F)cnc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC001248790216 1059980612 /nfs/dbraw/zinc/98/06/12/1059980612.db2.gz IANWSWLZDLNONR-OAHLLOKOSA-N 1 2 310.294 4.187 20 0 DIADLO Clc1cc(-c2ccccc2)ccc1C[N@@H+]1CCCC12COC2 ZINC001248820287 1059996739 /nfs/dbraw/zinc/99/67/39/1059996739.db2.gz FRBDGPHLSJLMOZ-UHFFFAOYSA-N 1 2 313.828 4.372 20 0 DIADLO Clc1cc(-c2ccccc2)ccc1C[N@H+]1CCCC12COC2 ZINC001248820287 1059996765 /nfs/dbraw/zinc/99/67/65/1059996765.db2.gz FRBDGPHLSJLMOZ-UHFFFAOYSA-N 1 2 313.828 4.372 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2coc(-c3ccc(F)cc3)n2)C1 ZINC001248853167 1060021449 /nfs/dbraw/zinc/02/14/49/1060021449.db2.gz OAZUXIQBCQPPHY-QGZVFWFLSA-N 1 2 306.356 4.195 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2coc(-c3ccc(F)cc3)n2)C1 ZINC001248853167 1060021470 /nfs/dbraw/zinc/02/14/70/1060021470.db2.gz OAZUXIQBCQPPHY-QGZVFWFLSA-N 1 2 306.356 4.195 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nc3cccc(Br)c3o2)[C@@H](C)C1 ZINC001248851355 1060024080 /nfs/dbraw/zinc/02/40/80/1060024080.db2.gz IEQHUINXKCMPIL-QWRGUYRKSA-N 1 2 323.234 4.211 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nc3cccc(Br)c3o2)[C@@H](C)C1 ZINC001248851355 1060024095 /nfs/dbraw/zinc/02/40/95/1060024095.db2.gz IEQHUINXKCMPIL-QWRGUYRKSA-N 1 2 323.234 4.211 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)c(C)n2)cn1 ZINC001248877017 1060031912 /nfs/dbraw/zinc/03/19/12/1060031912.db2.gz ZQVVMFDJBRYMDK-KRWDZBQOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)c(C)n2)cn1 ZINC001248877017 1060031928 /nfs/dbraw/zinc/03/19/28/1060031928.db2.gz ZQVVMFDJBRYMDK-KRWDZBQOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1ccc(OC(F)F)c(F)c1 ZINC001560277017 1060052897 /nfs/dbraw/zinc/05/28/97/1060052897.db2.gz DYNWGXZGEFAKFJ-UHFFFAOYSA-N 1 2 324.346 4.414 20 0 DIADLO Cc1cc(C)nc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)n1 ZINC001248977535 1060098193 /nfs/dbraw/zinc/09/81/93/1060098193.db2.gz MTBCTBRWEIRCDU-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C)nc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)n1 ZINC001248977535 1060098210 /nfs/dbraw/zinc/09/82/10/1060098210.db2.gz MTBCTBRWEIRCDU-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO CC[C@@H]([NH2+]Cc1cnc(-c2ccccc2)[nH]1)c1nc(C)cs1 ZINC001560323187 1060110024 /nfs/dbraw/zinc/11/00/24/1060110024.db2.gz JUTSLYHZCVVXFS-OAHLLOKOSA-N 1 2 312.442 4.083 20 0 DIADLO COc1c(Cl)cc(NCc2cccc3[nH+]ccn32)cc1Cl ZINC001560384240 1060170486 /nfs/dbraw/zinc/17/04/86/1060170486.db2.gz NRLDBWYZZKTGCI-UHFFFAOYSA-N 1 2 322.195 4.262 20 0 DIADLO CC(C)c1cnc(CNc2ccc(-n3cc[nH+]c3)c(F)c2)s1 ZINC001560386915 1060174223 /nfs/dbraw/zinc/17/42/23/1060174223.db2.gz LBIHTNXATCFTJS-UHFFFAOYSA-N 1 2 316.405 4.203 20 0 DIADLO CCCCc1ccc(N(C)C(=O)c2ccn3c(C)c[nH+]c3c2)cc1 ZINC001534202150 1060176228 /nfs/dbraw/zinc/17/62/28/1060176228.db2.gz MRTLAEAXRZPQGN-UHFFFAOYSA-N 1 2 321.424 4.262 20 0 DIADLO CC(C)c1nc(CNc2ccc([NH+]3CCCC3)cc2)cs1 ZINC001560390945 1060176879 /nfs/dbraw/zinc/17/68/79/1060176879.db2.gz YUUNWYAYVJQXFR-UHFFFAOYSA-N 1 2 301.459 4.479 20 0 DIADLO c1cn(-c2cccc(NCc3cc4ccncc4s3)c2)c[nH+]1 ZINC001560392261 1060178342 /nfs/dbraw/zinc/17/83/42/1060178342.db2.gz WPIUOEVXAHNARM-UHFFFAOYSA-N 1 2 306.394 4.094 20 0 DIADLO C/C(=C/c1ccc(Cl)cc1)CNc1ccc(N(C)C)[nH+]c1 ZINC001560392438 1060178882 /nfs/dbraw/zinc/17/88/82/1060178882.db2.gz GRPFNVNFJBPMQD-RAXLEYEMSA-N 1 2 301.821 4.316 20 0 DIADLO CCOc1ccccc1CNc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001560392230 1060179329 /nfs/dbraw/zinc/17/93/29/1060179329.db2.gz UROFOXOAVXYEAA-UHFFFAOYSA-N 1 2 307.397 4.192 20 0 DIADLO CCn1ccc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)n1 ZINC001560397049 1060182942 /nfs/dbraw/zinc/18/29/42/1060182942.db2.gz GYKKJGXYCTUERR-MRXNPFEDSA-N 1 2 307.388 4.058 20 0 DIADLO CCOc1ccc(CNc2ccc(N(CC)CC)[nH+]c2)c(C)c1 ZINC001560407381 1060192886 /nfs/dbraw/zinc/19/28/86/1060192886.db2.gz XKUHLDUQTLQBPF-UHFFFAOYSA-N 1 2 313.445 4.247 20 0 DIADLO COc1cc[nH+]cc1NCc1ccc(OCCC(C)C)cc1 ZINC001560407718 1060193540 /nfs/dbraw/zinc/19/35/40/1060193540.db2.gz AATGHYQFNUTIEB-UHFFFAOYSA-N 1 2 300.402 4.127 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N[C@@H](C)c3cccc(C4CC4)c3)ccn12 ZINC001534263875 1060200301 /nfs/dbraw/zinc/20/03/01/1060200301.db2.gz FNMRBWQDIYQRFL-AWEZNQCLSA-N 1 2 319.408 4.011 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc(F)cc3OC(C)C)n2c1 ZINC001560419899 1060205389 /nfs/dbraw/zinc/20/53/89/1060205389.db2.gz LNCKTJCDMAUXQD-UHFFFAOYSA-N 1 2 313.376 4.181 20 0 DIADLO Cc1cc(-c2noc([C@@H]3CC[N@@H+]3Cc3ccccc3)n2)ccc1F ZINC001249253006 1060206028 /nfs/dbraw/zinc/20/60/28/1060206028.db2.gz FOQNMOAKDHUREU-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cc(-c2noc([C@@H]3CC[N@H+]3Cc3ccccc3)n2)ccc1F ZINC001249253006 1060206044 /nfs/dbraw/zinc/20/60/44/1060206044.db2.gz FOQNMOAKDHUREU-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1N[C@@H]1CCc2cccnc2CC1 ZINC001560425697 1060213574 /nfs/dbraw/zinc/21/35/74/1060213574.db2.gz WJGQXLFCTGQSPZ-OAHLLOKOSA-N 1 2 311.429 4.013 20 0 DIADLO c1sc(-c2ccncc2)nc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001249297976 1060215443 /nfs/dbraw/zinc/21/54/43/1060215443.db2.gz DRXFRGWXUDVSAR-QGZVFWFLSA-N 1 2 307.422 4.152 20 0 DIADLO c1sc(-c2ccncc2)nc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC001249297976 1060215464 /nfs/dbraw/zinc/21/54/64/1060215464.db2.gz DRXFRGWXUDVSAR-QGZVFWFLSA-N 1 2 307.422 4.152 20 0 DIADLO Cc1cc([C@@H](C)NC(=O)c2c(C)cc(C)[nH+]c2C)c(C)s1 ZINC001526468272 1060229324 /nfs/dbraw/zinc/22/93/24/1060229324.db2.gz GVGDHNGSVQWBEW-GFCCVEGCSA-N 1 2 302.443 4.176 20 0 DIADLO Cc1oc(Br)nc1C[NH+]1CCC(C(C)(C)C)CC1 ZINC001249386949 1060234840 /nfs/dbraw/zinc/23/48/40/1060234840.db2.gz KWQGSCKLBAOIQP-UHFFFAOYSA-N 1 2 315.255 4.004 20 0 DIADLO CC[C@@H](C)c1nn(C)cc1C[N@@H+]1CCc2c(Cl)cccc2C1 ZINC001249408340 1060238052 /nfs/dbraw/zinc/23/80/52/1060238052.db2.gz BKOMZGZLVUQOED-CYBMUJFWSA-N 1 2 317.864 4.145 20 0 DIADLO CC[C@@H](C)c1nn(C)cc1C[N@H+]1CCc2c(Cl)cccc2C1 ZINC001249408340 1060238073 /nfs/dbraw/zinc/23/80/73/1060238073.db2.gz BKOMZGZLVUQOED-CYBMUJFWSA-N 1 2 317.864 4.145 20 0 DIADLO COc1ccc2nc(C[N@@H+]3CCC[C@@H]3c3ccc(C)cc3)[nH]c2c1 ZINC001249413718 1060242944 /nfs/dbraw/zinc/24/29/44/1060242944.db2.gz CUIGYMYELSSUNF-LJQANCHMSA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccc2nc(C[N@H+]3CCC[C@@H]3c3ccc(C)cc3)[nH]c2c1 ZINC001249413718 1060242966 /nfs/dbraw/zinc/24/29/66/1060242966.db2.gz CUIGYMYELSSUNF-LJQANCHMSA-N 1 2 321.424 4.217 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+]2Cc3ccccc3C[C@@H]2C)cn1 ZINC001249515698 1060271212 /nfs/dbraw/zinc/27/12/12/1060271212.db2.gz MRESPRDMAMGUHU-ZDUSSCGKSA-N 1 2 320.358 4.356 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+]2Cc3ccccc3C[C@@H]2C)cn1 ZINC001249515698 1060271225 /nfs/dbraw/zinc/27/12/25/1060271225.db2.gz MRESPRDMAMGUHU-ZDUSSCGKSA-N 1 2 320.358 4.356 20 0 DIADLO CC1(C)CCc2cc(C[NH2+]C3(C(F)F)CCCC3)ccc2O1 ZINC001560490594 1060286510 /nfs/dbraw/zinc/28/65/10/1060286510.db2.gz BJXTTZASKHWDJF-UHFFFAOYSA-N 1 2 309.400 4.458 20 0 DIADLO Cc1c[nH]nc1CNc1ccc2[nH]c(-c3ccc(F)cc3)[nH+]c2c1 ZINC001560496870 1060294747 /nfs/dbraw/zinc/29/47/47/1060294747.db2.gz NSOVLQUZJWRMLM-UHFFFAOYSA-N 1 2 321.359 4.013 20 0 DIADLO Fc1cccc(-c2cc(Nc3cc[nH+]cc3C(F)(F)F)on2)c1 ZINC001249586338 1060303588 /nfs/dbraw/zinc/30/35/88/1060303588.db2.gz OKFAXGZYRZHZKV-UHFFFAOYSA-N 1 2 323.249 4.060 20 0 DIADLO Fc1ccc(/C=C/CNc2c[nH+]cc3c2CCCC3)cc1F ZINC001560531785 1060335066 /nfs/dbraw/zinc/33/50/66/1060335066.db2.gz NHZUPYMBKODEQR-ONEGZZNKSA-N 1 2 300.352 4.364 20 0 DIADLO Cn1c2ccccc2[nH+]c1Nc1cccc(Br)c1F ZINC001249686284 1060346376 /nfs/dbraw/zinc/34/63/76/1060346376.db2.gz OECZCJHTMCTBRT-UHFFFAOYSA-N 1 2 320.165 4.219 20 0 DIADLO Cc1cn2c(cccc2NC(=S)Nc2c(C)cc(C)cc2C)[nH+]1 ZINC001249718564 1060368034 /nfs/dbraw/zinc/36/80/34/1060368034.db2.gz BVEVJVINIWMUBB-UHFFFAOYSA-N 1 2 324.453 4.377 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccc(N2CCCCC2)c(F)c1 ZINC001560568194 1060379040 /nfs/dbraw/zinc/37/90/40/1060379040.db2.gz GBWVSRXOOSTOOL-UHFFFAOYSA-N 1 2 316.424 4.035 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1cccc2c1OCCO2 ZINC001560575010 1060389212 /nfs/dbraw/zinc/38/92/12/1060389212.db2.gz WEMWLHHSAKYLBV-UHFFFAOYSA-N 1 2 323.396 4.001 20 0 DIADLO Cc1ccc(C[NH2+]Cc2noc3c2CC(C)(C)CC3)c(Cl)c1 ZINC001560577043 1060391411 /nfs/dbraw/zinc/39/14/11/1060391411.db2.gz WUDCCPVTUDQRLE-UHFFFAOYSA-N 1 2 318.848 4.441 20 0 DIADLO COc1ccc2nc(C[NH2+]Cc3cscc3Cl)sc2c1 ZINC001560591046 1060404771 /nfs/dbraw/zinc/40/47/71/1060404771.db2.gz NPPKWIFGANCPOC-UHFFFAOYSA-N 1 2 324.858 4.310 20 0 DIADLO CCn1c2cc(F)ccc2[nH+]c1NCc1cccc(O)c1Cl ZINC001560621040 1060432841 /nfs/dbraw/zinc/43/28/41/1060432841.db2.gz BHLCYFLCRVWZLI-UHFFFAOYSA-N 1 2 319.767 4.166 20 0 DIADLO COc1ccc2[nH]c(Nc3ccc(Cn4cc[nH+]c4)cc3)cc2c1 ZINC001249885384 1060447978 /nfs/dbraw/zinc/44/79/78/1060447978.db2.gz KXCJEVGIWIFFDT-UHFFFAOYSA-N 1 2 318.380 4.165 20 0 DIADLO CC(C)[C@@](C)(Cc1ccccc1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001535115889 1060463564 /nfs/dbraw/zinc/46/35/64/1060463564.db2.gz ODSVKCFKSBCVKY-HXUWFJFHSA-N 1 2 321.424 4.178 20 0 DIADLO Cc1[nH]nc(C[N@@H+]2CCCCC[C@H]2/C=C\c2ccccc2)c1C ZINC001560649053 1060474434 /nfs/dbraw/zinc/47/44/34/1060474434.db2.gz YZHXIVVIPPADDD-HSNDNRACSA-N 1 2 309.457 4.485 20 0 DIADLO Cc1[nH]nc(C[N@H+]2CCCCC[C@H]2/C=C\c2ccccc2)c1C ZINC001560649053 1060474445 /nfs/dbraw/zinc/47/44/45/1060474445.db2.gz YZHXIVVIPPADDD-HSNDNRACSA-N 1 2 309.457 4.485 20 0 DIADLO CC(C)(C)c1ccc2c(c1)CC[N@@H+](Cc1nccn1C1CC1)C2 ZINC001560650888 1060474535 /nfs/dbraw/zinc/47/45/35/1060474535.db2.gz ARDKOTGNFFAVBR-UHFFFAOYSA-N 1 2 309.457 4.074 20 0 DIADLO CC(C)(C)c1ccc2c(c1)CC[N@H+](Cc1nccn1C1CC1)C2 ZINC001560650888 1060474541 /nfs/dbraw/zinc/47/45/41/1060474541.db2.gz ARDKOTGNFFAVBR-UHFFFAOYSA-N 1 2 309.457 4.074 20 0 DIADLO Cc1[nH]nc(C[N@@H+]2CCCCC[C@@H]2/C=C\c2ccccc2)c1C ZINC001560649056 1060474995 /nfs/dbraw/zinc/47/49/95/1060474995.db2.gz YZHXIVVIPPADDD-SYGIOELKSA-N 1 2 309.457 4.485 20 0 DIADLO Cc1[nH]nc(C[N@H+]2CCCCC[C@@H]2/C=C\c2ccccc2)c1C ZINC001560649056 1060475001 /nfs/dbraw/zinc/47/50/01/1060475001.db2.gz YZHXIVVIPPADDD-SYGIOELKSA-N 1 2 309.457 4.485 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)nc1C ZINC001249914466 1060476848 /nfs/dbraw/zinc/47/68/48/1060476848.db2.gz UWFJJCGHXKJCTC-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)nc1C ZINC001249914466 1060476856 /nfs/dbraw/zinc/47/68/56/1060476856.db2.gz UWFJJCGHXKJCTC-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C[N@H+](C)Cc2ccccc2Cl)cnc1Cl ZINC001249929384 1060485638 /nfs/dbraw/zinc/48/56/38/1060485638.db2.gz YWVHDHKMASMQKD-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2ccccc2Cl)cnc1Cl ZINC001249929384 1060485649 /nfs/dbraw/zinc/48/56/49/1060485649.db2.gz YWVHDHKMASMQKD-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO CSC1CC[NH+](Cc2cc(Cl)cc(Cl)c2F)CC1 ZINC001249944811 1060495660 /nfs/dbraw/zinc/49/56/60/1060495660.db2.gz FBQHIJWCAVNHHW-UHFFFAOYSA-N 1 2 308.249 4.460 20 0 DIADLO CC/C(=C\C(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccc(C)cc1 ZINC001527354373 1060499037 /nfs/dbraw/zinc/49/90/37/1060499037.db2.gz BUUCHXYJPGZIAX-LFIBNONCSA-N 1 2 319.408 4.383 20 0 DIADLO Cc1occc1C[N@H+]1Cc2cc(Br)ccc2C[C@@H]1C ZINC001560674675 1060507966 /nfs/dbraw/zinc/50/79/66/1060507966.db2.gz HTSBPJKWIVWADZ-NSHDSACASA-N 1 2 320.230 4.297 20 0 DIADLO Cc1occc1C[N@@H+]1Cc2cc(Br)ccc2C[C@@H]1C ZINC001560674675 1060507990 /nfs/dbraw/zinc/50/79/90/1060507990.db2.gz HTSBPJKWIVWADZ-NSHDSACASA-N 1 2 320.230 4.297 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](C)Cc2cccc(O)c2Cl)c1 ZINC001560676132 1060512518 /nfs/dbraw/zinc/51/25/18/1060512518.db2.gz SOBSZCXUHOVFJR-UHFFFAOYSA-N 1 2 319.832 4.465 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2cccc(O)c2Cl)c1 ZINC001560676132 1060512538 /nfs/dbraw/zinc/51/25/38/1060512538.db2.gz SOBSZCXUHOVFJR-UHFFFAOYSA-N 1 2 319.832 4.465 20 0 DIADLO Oc1cc(F)c(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1Cl ZINC001250022864 1060546277 /nfs/dbraw/zinc/54/62/77/1060546277.db2.gz XABOTUXOFSGYTJ-UHFFFAOYSA-N 1 2 317.751 4.173 20 0 DIADLO Oc1cc(F)c(Nc2cc(Cl)c3[nH+]ccn3c2)cc1Cl ZINC001250023582 1060548605 /nfs/dbraw/zinc/54/86/05/1060548605.db2.gz QAUQBZDLOGJBMN-UHFFFAOYSA-N 1 2 312.131 4.229 20 0 DIADLO Fc1ccc(CCNc2cccc(-n3cc[nH+]c3)c2)c(Cl)c1 ZINC001560703949 1060561140 /nfs/dbraw/zinc/56/11/40/1060561140.db2.gz SDZNLHIFYKJEIB-UHFFFAOYSA-N 1 2 315.779 4.319 20 0 DIADLO CCCCC[N@H+](Cc1c(Cl)cnn1C)Cc1ccc(F)cc1 ZINC001560719414 1060581292 /nfs/dbraw/zinc/58/12/92/1060581292.db2.gz GVFYXFHUZFPWCM-UHFFFAOYSA-N 1 2 323.843 4.405 20 0 DIADLO CCCCC[N@@H+](Cc1c(Cl)cnn1C)Cc1ccc(F)cc1 ZINC001560719414 1060581312 /nfs/dbraw/zinc/58/13/12/1060581312.db2.gz GVFYXFHUZFPWCM-UHFFFAOYSA-N 1 2 323.843 4.405 20 0 DIADLO Nc1cc(C(F)(F)F)c(Cc2ccc3ccccc3c2)c[nH+]1 ZINC001250073587 1060587190 /nfs/dbraw/zinc/58/71/90/1060587190.db2.gz ODZHHRCKTIMLGG-UHFFFAOYSA-N 1 2 302.299 4.427 20 0 DIADLO CCn1ccc(C[N@H+](C)[C@@H](c2ccccc2)c2ccc(F)cc2)n1 ZINC001560728558 1060594858 /nfs/dbraw/zinc/59/48/58/1060594858.db2.gz XFLNGNFYJDHFII-FQEVSTJZSA-N 1 2 323.415 4.264 20 0 DIADLO CCn1ccc(C[N@@H+](C)[C@@H](c2ccccc2)c2ccc(F)cc2)n1 ZINC001560728558 1060594870 /nfs/dbraw/zinc/59/48/70/1060594870.db2.gz XFLNGNFYJDHFII-FQEVSTJZSA-N 1 2 323.415 4.264 20 0 DIADLO FC(F)(F)c1ccccc1Cc1ccc(N2CCCC2)[nH+]c1 ZINC001250100512 1060608853 /nfs/dbraw/zinc/60/88/53/1060608853.db2.gz WPNRJCYKRHKAQU-UHFFFAOYSA-N 1 2 306.331 4.291 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)C(=O)OC(C)(C)C)C1(c2ccccc2)CCCC1 ZINC001560763866 1060629994 /nfs/dbraw/zinc/62/99/94/1060629994.db2.gz PMFDQVSHFSIURW-JKSUJKDBSA-N 1 2 317.473 4.207 20 0 DIADLO CSc1cnc(F)c(Nc2ccc[nH+]c2N2CCCCC2)c1 ZINC001250137080 1060639561 /nfs/dbraw/zinc/63/95/61/1060639561.db2.gz KQCUKTBCXDQTDH-UHFFFAOYSA-N 1 2 318.421 4.072 20 0 DIADLO Fc1c(Cl)cc(Br)c(F)c1CC[NH+]1CCCC1 ZINC001250167024 1060655287 /nfs/dbraw/zinc/65/52/87/1060655287.db2.gz ZVAKLYVEPRVFQP-UHFFFAOYSA-N 1 2 324.596 4.019 20 0 DIADLO COc1c(F)c(Cl)ccc1Nc1ccc2c(c1)[nH+]cn2C ZINC001250194241 1060672702 /nfs/dbraw/zinc/67/27/02/1060672702.db2.gz IEQXCULCPCDULY-UHFFFAOYSA-N 1 2 305.740 4.118 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ncccn2)c(C)c1Cl ZINC001250207282 1060686207 /nfs/dbraw/zinc/68/62/07/1060686207.db2.gz SKDQCCCFJBFONG-OAHLLOKOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ncccn2)c(C)c1Cl ZINC001250207282 1060686210 /nfs/dbraw/zinc/68/62/10/1060686210.db2.gz SKDQCCCFJBFONG-OAHLLOKOSA-N 1 2 301.821 4.084 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccccc2C(C)(F)F)c1C ZINC001560840865 1060698265 /nfs/dbraw/zinc/69/82/65/1060698265.db2.gz CNVKXYHKJOISKM-UHFFFAOYSA-N 1 2 306.356 4.431 20 0 DIADLO C[N@H+](C/C=C\c1ccc(F)cc1F)Cc1c(F)cccc1F ZINC001560846617 1060703266 /nfs/dbraw/zinc/70/32/66/1060703266.db2.gz BLPAPFDPESIBBT-ARJAWSKDSA-N 1 2 309.306 4.388 20 0 DIADLO C[N@@H+](C/C=C\c1ccc(F)cc1F)Cc1c(F)cccc1F ZINC001560846617 1060703277 /nfs/dbraw/zinc/70/32/77/1060703277.db2.gz BLPAPFDPESIBBT-ARJAWSKDSA-N 1 2 309.306 4.388 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@@](C)(F)C2)c(C)c1Br ZINC001560848882 1060706427 /nfs/dbraw/zinc/70/64/27/1060706427.db2.gz LWHOBAWTXQJSMP-OAHLLOKOSA-N 1 2 314.242 4.390 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@@](C)(F)C2)c(C)c1Br ZINC001560848882 1060706443 /nfs/dbraw/zinc/70/64/43/1060706443.db2.gz LWHOBAWTXQJSMP-OAHLLOKOSA-N 1 2 314.242 4.390 20 0 DIADLO Fc1cccc(C(F)(F)F)c1Cc1ccc(N2CCCC2)[nH+]c1 ZINC001250230601 1060711159 /nfs/dbraw/zinc/71/11/59/1060711159.db2.gz YWIWLOWSCVEDCZ-UHFFFAOYSA-N 1 2 324.321 4.431 20 0 DIADLO Cc1cc(C[N@@H+]2CCCn3c(cc4ccccc43)C2)cc(C)n1 ZINC001560861084 1060720216 /nfs/dbraw/zinc/72/02/16/1060720216.db2.gz DJRZMXLNICEGOX-UHFFFAOYSA-N 1 2 305.425 4.059 20 0 DIADLO Cc1cc(C[N@H+]2CCCn3c(cc4ccccc43)C2)cc(C)n1 ZINC001560861084 1060720223 /nfs/dbraw/zinc/72/02/23/1060720223.db2.gz DJRZMXLNICEGOX-UHFFFAOYSA-N 1 2 305.425 4.059 20 0 DIADLO Cc1[nH]c(CN2CCCSc3ccc(Cl)cc32)[nH+]c1C ZINC001560865941 1060726064 /nfs/dbraw/zinc/72/60/64/1060726064.db2.gz QIHBUZPRNGSAQU-UHFFFAOYSA-N 1 2 307.850 4.182 20 0 DIADLO c1cn(Cc2ccc(CCCOCc3ccccc3)cc2)c[nH+]1 ZINC001250245302 1060726348 /nfs/dbraw/zinc/72/63/48/1060726348.db2.gz BGUKVIUANOANQD-UHFFFAOYSA-N 1 2 306.409 4.081 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1c(F)ccc(C)c1OC ZINC001250251486 1060731962 /nfs/dbraw/zinc/73/19/62/1060731962.db2.gz RHUIISWGQMFPAI-CQSZACIVSA-N 1 2 317.404 4.344 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1c(F)ccc(C)c1OC ZINC001250251486 1060731972 /nfs/dbraw/zinc/73/19/72/1060731972.db2.gz RHUIISWGQMFPAI-CQSZACIVSA-N 1 2 317.404 4.344 20 0 DIADLO Cc1ccc(-c2ccccc2C[NH+]2CC(OC(F)F)C2)c(C)c1 ZINC001560876642 1060737798 /nfs/dbraw/zinc/73/77/98/1060737798.db2.gz TUXOZULQEQXNOC-UHFFFAOYSA-N 1 2 317.379 4.394 20 0 DIADLO Cc1ccc2c(Nc3c(F)ccc(CO)c3F)cccc2[nH+]1 ZINC001250260053 1060737801 /nfs/dbraw/zinc/73/78/01/1060737801.db2.gz WWVQEROVKHIRIH-UHFFFAOYSA-N 1 2 300.308 4.057 20 0 DIADLO Fc1ccccc1OCCCc1ccc(Cn2cc[nH+]c2)cc1 ZINC001250274853 1060749182 /nfs/dbraw/zinc/74/91/82/1060749182.db2.gz RXLFBOFNGUGTGD-UHFFFAOYSA-N 1 2 310.372 4.082 20 0 DIADLO C[C@H]1CC(C)(C)C[N@@H+]1Cc1nc(Cl)ccc1Br ZINC001560889987 1060751019 /nfs/dbraw/zinc/75/10/19/1060751019.db2.gz XEPDTMDTLXHKQX-VIFPVBQESA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC(C)(C)C[N@H+]1Cc1nc(Cl)ccc1Br ZINC001560889987 1060751032 /nfs/dbraw/zinc/75/10/32/1060751032.db2.gz XEPDTMDTLXHKQX-VIFPVBQESA-N 1 2 317.658 4.118 20 0 DIADLO CCOc1ccc(Cl)cc1C[NH+]1C[C@H](CC)O[C@@H](CC)C1 ZINC001560894313 1060757065 /nfs/dbraw/zinc/75/70/65/1060757065.db2.gz IDRWGMYMDCDLBM-HOTGVXAUSA-N 1 2 311.853 4.128 20 0 DIADLO CCOc1cc(C[N@H+](C)Cc2ccc(C)cc2)c(Cl)cn1 ZINC001250317011 1060775633 /nfs/dbraw/zinc/77/56/33/1060775633.db2.gz HHXAMSYNBYALKC-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCOc1cc(C[N@@H+](C)Cc2ccc(C)cc2)c(Cl)cn1 ZINC001250317011 1060775641 /nfs/dbraw/zinc/77/56/41/1060775641.db2.gz HHXAMSYNBYALKC-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)[C@@H](C)c1ccc(Cl)cc1)C(=O)OC(C)(C)C ZINC001560926180 1060791009 /nfs/dbraw/zinc/79/10/09/1060791009.db2.gz GTNZINUPFKQWNY-FRRDWIJNSA-N 1 2 311.853 4.152 20 0 DIADLO Cc1cccc(Cc2ccc(N(C)Cc3ccccc3)[nH+]c2)n1 ZINC001250424552 1060797412 /nfs/dbraw/zinc/79/74/12/1060797412.db2.gz OSOIRWUUTVKTNH-UHFFFAOYSA-N 1 2 303.409 4.012 20 0 DIADLO Fc1cc2[nH]c(-c3ccc4c(c3)CCC4)nc2cc1-n1cc[nH+]c1 ZINC001250438907 1060801450 /nfs/dbraw/zinc/80/14/50/1060801450.db2.gz ZMXZKXYFNXHFRS-UHFFFAOYSA-N 1 2 318.355 4.043 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(C3CC3)cc2)C[C@@H](CC(F)(F)F)O1 ZINC001560941002 1060803902 /nfs/dbraw/zinc/80/39/02/1060803902.db2.gz BZQGOVFFSAKEJA-MLGOLLRUSA-N 1 2 313.363 4.106 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(C3CC3)cc2)C[C@@H](CC(F)(F)F)O1 ZINC001560941002 1060803925 /nfs/dbraw/zinc/80/39/25/1060803925.db2.gz BZQGOVFFSAKEJA-MLGOLLRUSA-N 1 2 313.363 4.106 20 0 DIADLO COc1nc(C)cc(C)c1C[N@H+](C)Cc1cc2c(cccc2C)[nH]1 ZINC001560948144 1060814397 /nfs/dbraw/zinc/81/43/97/1060814397.db2.gz OTQXWTSMEYJITQ-UHFFFAOYSA-N 1 2 323.440 4.129 20 0 DIADLO COc1nc(C)cc(C)c1C[N@@H+](C)Cc1cc2c(cccc2C)[nH]1 ZINC001560948144 1060814411 /nfs/dbraw/zinc/81/44/11/1060814411.db2.gz OTQXWTSMEYJITQ-UHFFFAOYSA-N 1 2 323.440 4.129 20 0 DIADLO Cc1[nH]nc(C[N@@H+]2CCC[C@@]2(C)Cc2ccccc2Cl)c1C ZINC001560951988 1060820464 /nfs/dbraw/zinc/82/04/64/1060820464.db2.gz XEOHNHXBNVBPFA-SFHVURJKSA-N 1 2 317.864 4.277 20 0 DIADLO Cc1[nH]nc(C[N@H+]2CCC[C@@]2(C)Cc2ccccc2Cl)c1C ZINC001560951988 1060820475 /nfs/dbraw/zinc/82/04/75/1060820475.db2.gz XEOHNHXBNVBPFA-SFHVURJKSA-N 1 2 317.864 4.277 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@]2(C)C(=O)OC(C)(C)C)c1 ZINC001560957194 1060821293 /nfs/dbraw/zinc/82/12/93/1060821293.db2.gz YHYLYUFUVINTPB-GOSISDBHSA-N 1 2 323.864 4.345 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCC[C@]2(C)C(=O)OC(C)(C)C)c1 ZINC001560957194 1060821302 /nfs/dbraw/zinc/82/13/02/1060821302.db2.gz YHYLYUFUVINTPB-GOSISDBHSA-N 1 2 323.864 4.345 20 0 DIADLO CCOc1ccc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)cc1 ZINC001250471013 1060830339 /nfs/dbraw/zinc/83/03/39/1060830339.db2.gz CZARPBYMUMMYSK-UHFFFAOYSA-N 1 2 307.397 4.229 20 0 DIADLO c1[nH]c2ccccc2c1-c1[nH]c2ccc(N3CCCC3)cc2[nH+]1 ZINC001250473724 1060833651 /nfs/dbraw/zinc/83/36/51/1060833651.db2.gz SDECHJXGXNZBFR-UHFFFAOYSA-N 1 2 302.381 4.311 20 0 DIADLO CCSc1ccc(C[NH2+]Cc2c(F)ccc(O)c2F)cc1 ZINC001560985014 1060849301 /nfs/dbraw/zinc/84/93/01/1060849301.db2.gz OPXFSKPQMIRVPX-UHFFFAOYSA-N 1 2 309.381 4.072 20 0 DIADLO c1cc2c(cccc2-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)[nH]1 ZINC001250501541 1060855437 /nfs/dbraw/zinc/85/54/37/1060855437.db2.gz WAJICUIBWLVHNP-UHFFFAOYSA-N 1 2 302.381 4.311 20 0 DIADLO CCc1cccc2cc(C[NH2+]Cc3nc4ccccc4o3)oc21 ZINC001561014921 1060873794 /nfs/dbraw/zinc/87/37/94/1060873794.db2.gz GJRGTRAOETXZQZ-UHFFFAOYSA-N 1 2 306.365 4.426 20 0 DIADLO Cc1ccccc1-c1cccc(Cl)c1C[NH+]1CCOCC1 ZINC001250545406 1060885631 /nfs/dbraw/zinc/88/56/31/1060885631.db2.gz UKALNDUTJPTPFJ-UHFFFAOYSA-N 1 2 301.817 4.148 20 0 DIADLO Fc1ccc([C@@H]2CC[N@@H+]2Cc2cc(Cl)cc3c2OCC3)cc1 ZINC001561035343 1060889448 /nfs/dbraw/zinc/88/94/48/1060889448.db2.gz UOWMTWUWBAGOTL-KRWDZBQOSA-N 1 2 317.791 4.361 20 0 DIADLO Fc1ccc([C@@H]2CC[N@H+]2Cc2cc(Cl)cc3c2OCC3)cc1 ZINC001561035343 1060889457 /nfs/dbraw/zinc/88/94/57/1060889457.db2.gz UOWMTWUWBAGOTL-KRWDZBQOSA-N 1 2 317.791 4.361 20 0 DIADLO CCn1c(CCc2ccccc2F)[nH+]c2ccc(F)c(F)c21 ZINC001250553355 1060891468 /nfs/dbraw/zinc/89/14/68/1060891468.db2.gz UUDLORNXXOOSSV-UHFFFAOYSA-N 1 2 304.315 4.259 20 0 DIADLO CS[C@H](C)Cc1[nH]c2ccc(OCc3ccccc3)cc2[nH+]1 ZINC001250566627 1060902967 /nfs/dbraw/zinc/90/29/67/1060902967.db2.gz KYRWZSVMVPJETC-CYBMUJFWSA-N 1 2 312.438 4.436 20 0 DIADLO COc1cc2[nH+]c(Cc3ccc(Cl)cc3)[nH]c2cc1Cl ZINC001250578913 1060915177 /nfs/dbraw/zinc/91/51/77/1060915177.db2.gz NWXZBHXRIAHPOT-UHFFFAOYSA-N 1 2 307.180 4.469 20 0 DIADLO COc1ccc2c(c1)[nH+]c(CCc1ccccc1Cl)n2C ZINC001250585278 1060920529 /nfs/dbraw/zinc/92/05/29/1060920529.db2.gz FWTXNLVVRILCPH-UHFFFAOYSA-N 1 2 300.789 4.021 20 0 DIADLO Cc1cccc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)c1F ZINC001250668350 1061000647 /nfs/dbraw/zinc/00/06/47/1061000647.db2.gz YVSWQZYPWYLUMI-UHFFFAOYSA-N 1 2 310.307 4.002 20 0 DIADLO Cc1ccccc1C[N@H+](Cc1ccns1)Cc1cccnc1 ZINC001462189155 1061009063 /nfs/dbraw/zinc/00/90/63/1061009063.db2.gz FNEPNYXMRBHGIZ-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1ccccc1C[N@@H+](Cc1ccns1)Cc1cccnc1 ZINC001462189155 1061009085 /nfs/dbraw/zinc/00/90/85/1061009085.db2.gz FNEPNYXMRBHGIZ-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO COc1cc(NCc2cc(C)[nH+]c(C)c2)ccc1C(F)(F)F ZINC001462189694 1061011044 /nfs/dbraw/zinc/01/10/44/1061011044.db2.gz JSYPKESVCSOBPF-UHFFFAOYSA-N 1 2 310.319 4.338 20 0 DIADLO FC(F)n1cccc1C[NH+]1CC(Cc2ccccc2Cl)C1 ZINC001462205134 1061023888 /nfs/dbraw/zinc/02/38/88/1061023888.db2.gz DGIKJTPPFQNSSG-UHFFFAOYSA-N 1 2 310.775 4.211 20 0 DIADLO Cc1cn2cc(NC(=O)N3CCCCC[C@H]3C(C)C)ccc2[nH+]1 ZINC001562322702 1061028579 /nfs/dbraw/zinc/02/85/79/1061028579.db2.gz HADPVZLOFBWEPA-INIZCTEOSA-N 1 2 314.433 4.075 20 0 DIADLO C[N@H+](CC(=O)OC(C)(C)C)C1c2ccccc2-c2ccccc21 ZINC001473260707 1061038511 /nfs/dbraw/zinc/03/85/11/1061038511.db2.gz NFZXMOCSHFYCFL-UHFFFAOYSA-N 1 2 309.409 4.030 20 0 DIADLO C[N@@H+](CC(=O)OC(C)(C)C)C1c2ccccc2-c2ccccc21 ZINC001473260707 1061038530 /nfs/dbraw/zinc/03/85/30/1061038530.db2.gz NFZXMOCSHFYCFL-UHFFFAOYSA-N 1 2 309.409 4.030 20 0 DIADLO CCCn1cc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c(C)n1 ZINC001462229230 1061043773 /nfs/dbraw/zinc/04/37/73/1061043773.db2.gz ZCWGGUVZMAQTCO-QGZVFWFLSA-N 1 2 303.837 4.202 20 0 DIADLO CCCn1cc(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)c(C)n1 ZINC001462229230 1061043783 /nfs/dbraw/zinc/04/37/83/1061043783.db2.gz ZCWGGUVZMAQTCO-QGZVFWFLSA-N 1 2 303.837 4.202 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)CCOCc1ccccc1 ZINC001473280900 1061051673 /nfs/dbraw/zinc/05/16/73/1061051673.db2.gz XPYVUCMGGSLJAX-AWEZNQCLSA-N 1 2 305.368 4.174 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)CCOCc1ccccc1 ZINC001473280900 1061051683 /nfs/dbraw/zinc/05/16/83/1061051683.db2.gz XPYVUCMGGSLJAX-AWEZNQCLSA-N 1 2 305.368 4.174 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@H+]([C@@H]1CCc3c1cccc3F)CC2 ZINC001473295973 1061062414 /nfs/dbraw/zinc/06/24/14/1061062414.db2.gz HCSIGHIDGXHUNI-GOSISDBHSA-N 1 2 303.327 4.150 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@@H+]([C@@H]1CCc3c1cccc3F)CC2 ZINC001473295973 1061062429 /nfs/dbraw/zinc/06/24/29/1061062429.db2.gz HCSIGHIDGXHUNI-GOSISDBHSA-N 1 2 303.327 4.150 20 0 DIADLO c1cn(-c2ccc(-c3nc4ccccc4n3C3CC3)cc2)c[nH+]1 ZINC001250771908 1061062786 /nfs/dbraw/zinc/06/27/86/1061062786.db2.gz HTGOUMXXHOJSIV-UHFFFAOYSA-N 1 2 300.365 4.224 20 0 DIADLO FC(F)c1ccc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3)nc2c1 ZINC001250772156 1061062917 /nfs/dbraw/zinc/06/29/17/1061062917.db2.gz OVAHHFHYLCEETG-UHFFFAOYSA-N 1 2 310.307 4.353 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccc(-c4ccccc4)nc3)[nH+]c2c1 ZINC001250786031 1061068244 /nfs/dbraw/zinc/06/82/44/1061068244.db2.gz PMPIXAZWLGYAKV-UHFFFAOYSA-N 1 2 314.392 4.358 20 0 DIADLO CCSc1ccc(C[N@H+]2CC=CCC2)c(Br)c1 ZINC001473308301 1061073476 /nfs/dbraw/zinc/07/34/76/1061073476.db2.gz SWIFEBAPDZFRIS-UHFFFAOYSA-N 1 2 312.276 4.323 20 0 DIADLO CCSc1ccc(C[N@@H+]2CC=CCC2)c(Br)c1 ZINC001473308301 1061073489 /nfs/dbraw/zinc/07/34/89/1061073489.db2.gz SWIFEBAPDZFRIS-UHFFFAOYSA-N 1 2 312.276 4.323 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2ncccc2Cl)C2CC2)c(F)c1 ZINC001473316352 1061082271 /nfs/dbraw/zinc/08/22/71/1061082271.db2.gz VZTYCCUSMIABRJ-INIZCTEOSA-N 1 2 308.759 4.254 20 0 DIADLO CC1(C)C[N@H+](Cc2ccnn2CC2CCC2)[C@H]1c1cccs1 ZINC001462308848 1061096124 /nfs/dbraw/zinc/09/61/24/1061096124.db2.gz UVDBTALYZDSRKK-KRWDZBQOSA-N 1 2 315.486 4.328 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccnn2CC2CCC2)[C@H]1c1cccs1 ZINC001462308848 1061096140 /nfs/dbraw/zinc/09/61/40/1061096140.db2.gz UVDBTALYZDSRKK-KRWDZBQOSA-N 1 2 315.486 4.328 20 0 DIADLO CC(C)(C[NH2+]CC(F)(F)c1ccccc1)Oc1ccccc1 ZINC001462317008 1061102171 /nfs/dbraw/zinc/10/21/71/1061102171.db2.gz JRDIYHDADHVBPZ-UHFFFAOYSA-N 1 2 305.368 4.226 20 0 DIADLO C[C@H]([NH2+]Cc1cncc(Cl)c1)c1ncc(-c2ccccc2)o1 ZINC001473356542 1061111248 /nfs/dbraw/zinc/11/12/48/1061111248.db2.gz APBHPZLBSFEOCQ-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO C[C@@H]([NH2+]Cc1cncc(Cl)c1)c1ncc(-c2ccccc2)o1 ZINC001473356541 1061112119 /nfs/dbraw/zinc/11/21/19/1061112119.db2.gz APBHPZLBSFEOCQ-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CC[C@H](C)C(C)(C)C1 ZINC001473364694 1061114112 /nfs/dbraw/zinc/11/41/12/1061114112.db2.gz CIXLARLHBXWWNU-XJKSGUPXSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CC[C@H](C)C(C)(C)C1 ZINC001473364694 1061114121 /nfs/dbraw/zinc/11/41/21/1061114121.db2.gz CIXLARLHBXWWNU-XJKSGUPXSA-N 1 2 323.864 4.312 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](C/C=C/c1cccc(F)c1)C1CC1 ZINC001462339267 1061115446 /nfs/dbraw/zinc/11/54/46/1061115446.db2.gz XQEBEHRQHHEXNY-OWNNVSBGSA-N 1 2 319.420 4.034 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](C/C=C/c1cccc(F)c1)C1CC1 ZINC001462339267 1061115452 /nfs/dbraw/zinc/11/54/52/1061115452.db2.gz XQEBEHRQHHEXNY-OWNNVSBGSA-N 1 2 319.420 4.034 20 0 DIADLO COC(=O)[C@H]1CCCCC[N@@H+]1Cc1c(Cl)oc2ccccc21 ZINC001473370704 1061116164 /nfs/dbraw/zinc/11/61/64/1061116164.db2.gz NDDFQJYGSRFJDU-CQSZACIVSA-N 1 2 321.804 4.004 20 0 DIADLO COC(=O)[C@H]1CCCCC[N@H+]1Cc1c(Cl)oc2ccccc21 ZINC001473370704 1061116172 /nfs/dbraw/zinc/11/61/72/1061116172.db2.gz NDDFQJYGSRFJDU-CQSZACIVSA-N 1 2 321.804 4.004 20 0 DIADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1cccc(F)c1Cl ZINC001473372666 1061118724 /nfs/dbraw/zinc/11/87/24/1061118724.db2.gz BZXQZKQIJKUEJV-LBPRGKRZSA-N 1 2 305.780 4.262 20 0 DIADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1cccc(F)c1Cl ZINC001473372666 1061118731 /nfs/dbraw/zinc/11/87/31/1061118731.db2.gz BZXQZKQIJKUEJV-LBPRGKRZSA-N 1 2 305.780 4.262 20 0 DIADLO Fc1nccc(Cl)c1C[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC001462354271 1061125390 /nfs/dbraw/zinc/12/53/90/1061125390.db2.gz IFDXJLMQZVCMMS-SECBINFHSA-N 1 2 310.722 4.039 20 0 DIADLO Fc1nccc(Cl)c1C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC001462354271 1061125401 /nfs/dbraw/zinc/12/54/01/1061125401.db2.gz IFDXJLMQZVCMMS-SECBINFHSA-N 1 2 310.722 4.039 20 0 DIADLO CC(C)C1(c2ccccc2)C[NH+](Cc2c(Cl)ccnc2F)C1 ZINC001462355644 1061125708 /nfs/dbraw/zinc/12/57/08/1061125708.db2.gz LSIDJWVBVSURPR-UHFFFAOYSA-N 1 2 318.823 4.284 20 0 DIADLO CCCn1c2ccc(F)cc2nc1-c1cccc(-n2cc[nH+]c2)c1 ZINC001250940075 1061135940 /nfs/dbraw/zinc/13/59/40/1061135940.db2.gz DHMJQAGOHPOGGU-UHFFFAOYSA-N 1 2 320.371 4.438 20 0 DIADLO FC(F)(F)c1nc(C[N@@H+]2CC[C@H](C3CCCC3)C2)cs1 ZINC001462385337 1061141626 /nfs/dbraw/zinc/14/16/26/1061141626.db2.gz MZNOARUVOAWNCE-NSHDSACASA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1nc(C[N@H+]2CC[C@H](C3CCCC3)C2)cs1 ZINC001462385337 1061141632 /nfs/dbraw/zinc/14/16/32/1061141632.db2.gz MZNOARUVOAWNCE-NSHDSACASA-N 1 2 304.381 4.174 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(F)cc(Cl)c2)CC2(CCCCC2)O1 ZINC001462391219 1061145676 /nfs/dbraw/zinc/14/56/76/1061145676.db2.gz LGHAFKQXRJNEPA-ZDUSSCGKSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(F)cc(Cl)c2)CC2(CCCCC2)O1 ZINC001462391219 1061145687 /nfs/dbraw/zinc/14/56/87/1061145687.db2.gz LGHAFKQXRJNEPA-ZDUSSCGKSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc(Cl)cs2)CCc2ccc(F)cc21 ZINC001462393290 1061146359 /nfs/dbraw/zinc/14/63/59/1061146359.db2.gz CGXJBFIRQWPYMF-SNVBAGLBSA-N 1 2 310.825 4.097 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc(Cl)cs2)CCc2ccc(F)cc21 ZINC001462393290 1061146364 /nfs/dbraw/zinc/14/63/64/1061146364.db2.gz CGXJBFIRQWPYMF-SNVBAGLBSA-N 1 2 310.825 4.097 20 0 DIADLO C[C@@H]1[C@@H](C)[S@](=O)CC[N@@H+]1Cc1ccc(C2CCCCC2)cc1 ZINC001473429656 1061155450 /nfs/dbraw/zinc/15/54/50/1061155450.db2.gz XTVOGGBOWNWLQK-XCGNWRKASA-N 1 2 319.514 4.076 20 0 DIADLO C[C@@H]1[C@@H](C)[S@](=O)CC[N@H+]1Cc1ccc(C2CCCCC2)cc1 ZINC001473429656 1061155464 /nfs/dbraw/zinc/15/54/64/1061155464.db2.gz XTVOGGBOWNWLQK-XCGNWRKASA-N 1 2 319.514 4.076 20 0 DIADLO CCCn1c(-c2ccc3[nH+]ccn3c2)nc2ccc(F)c(F)c21 ZINC001250978575 1061157617 /nfs/dbraw/zinc/15/76/17/1061157617.db2.gz LXTYBQMGGIQUGN-UHFFFAOYSA-N 1 2 312.323 4.039 20 0 DIADLO Clc1cncc(C[NH+]2CCC(c3ccco3)CC2)c1Cl ZINC001462412479 1061157752 /nfs/dbraw/zinc/15/77/52/1061157752.db2.gz GBYIGMNIOWZBBS-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO Cc1ccc(-c2nc3cc(Cl)ccc3n2C(C)C)c(N)[nH+]1 ZINC001250982013 1061159567 /nfs/dbraw/zinc/15/95/67/1061159567.db2.gz MTKKCWLFWLRUAC-UHFFFAOYSA-N 1 2 300.793 4.223 20 0 DIADLO CCCn1c(-c2ccc(C)[nH+]c2N)nc2cccc(Cl)c21 ZINC001250981729 1061159705 /nfs/dbraw/zinc/15/97/05/1061159705.db2.gz INBXMPNGGMFBRQ-UHFFFAOYSA-N 1 2 300.793 4.052 20 0 DIADLO Cc1ccc(-c2nc3c(cccc3Oc3ccccc3)[nH]2)c(N)[nH+]1 ZINC001250981362 1061159860 /nfs/dbraw/zinc/15/98/60/1061159860.db2.gz CDGTYOLLPWOMCN-UHFFFAOYSA-N 1 2 316.364 4.308 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](c2ccc(C)cc2)c2ccccn2)nc1 ZINC001473443297 1061160899 /nfs/dbraw/zinc/16/08/99/1061160899.db2.gz DJBJDISPXQXDNR-NRFANRHFSA-N 1 2 317.436 4.227 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1cc(Cl)cc(Cl)c1N)CC2 ZINC001462416211 1061161182 /nfs/dbraw/zinc/16/11/82/1061161182.db2.gz HNOVRUMOJNERFI-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1cc(Cl)cc(Cl)c1N)CC2 ZINC001462416211 1061161187 /nfs/dbraw/zinc/16/11/87/1061161187.db2.gz HNOVRUMOJNERFI-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO Cc1cc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)cc(C)c1F ZINC001250984599 1061162693 /nfs/dbraw/zinc/16/26/93/1061162693.db2.gz KPKSAOJUMKGRKZ-UHFFFAOYSA-N 1 2 324.334 4.311 20 0 DIADLO C[C@H]1CO[C@H](C(F)(F)F)C[N@@H+]1CCc1ccc2ccccc2c1 ZINC001473460962 1061172502 /nfs/dbraw/zinc/17/25/02/1061172502.db2.gz JKRFWECWLYDBBZ-GUYCJALGSA-N 1 2 323.358 4.034 20 0 DIADLO C[C@H]1CO[C@H](C(F)(F)F)C[N@H+]1CCc1ccc2ccccc2c1 ZINC001473460962 1061172510 /nfs/dbraw/zinc/17/25/10/1061172510.db2.gz JKRFWECWLYDBBZ-GUYCJALGSA-N 1 2 323.358 4.034 20 0 DIADLO c1nc2cc(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)ccc2s1 ZINC001251011072 1061180963 /nfs/dbraw/zinc/18/09/63/1061180963.db2.gz VYLHDOQDJNRGJC-UHFFFAOYSA-N 1 2 320.421 4.440 20 0 DIADLO COc1cccc(CCC[N@@H+]2CCn3c(cc4ccccc43)C2)c1 ZINC001473511121 1061203651 /nfs/dbraw/zinc/20/36/51/1061203651.db2.gz JWJZHUHBKSRHRD-UHFFFAOYSA-N 1 2 320.436 4.098 20 0 DIADLO COc1cccc(CCC[N@H+]2CCn3c(cc4ccccc43)C2)c1 ZINC001473511121 1061203670 /nfs/dbraw/zinc/20/36/70/1061203670.db2.gz JWJZHUHBKSRHRD-UHFFFAOYSA-N 1 2 320.436 4.098 20 0 DIADLO COc1ccccc1CCC[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC001473511809 1061205427 /nfs/dbraw/zinc/20/54/27/1061205427.db2.gz OUQDJHMTYINDQW-UHFFFAOYSA-N 1 2 320.436 4.098 20 0 DIADLO COc1ccccc1CCC[N@H+]1CCn2c(cc3ccccc32)C1 ZINC001473511809 1061205443 /nfs/dbraw/zinc/20/54/43/1061205443.db2.gz OUQDJHMTYINDQW-UHFFFAOYSA-N 1 2 320.436 4.098 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)/C=C3\CC[C@H](C)C3)cc2)[nH+]c1C ZINC001455244744 1061212974 /nfs/dbraw/zinc/21/29/74/1061212974.db2.gz ALIYUMROTZTJBQ-YGRGUWMTSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C=C3CC[C@H](C)C3)cc2)[nH+]c1C ZINC001455244744 1061212992 /nfs/dbraw/zinc/21/29/92/1061212992.db2.gz ALIYUMROTZTJBQ-YGRGUWMTSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3cc(F)ccc3C)cc2)[nH+]c1C ZINC001455244976 1061215076 /nfs/dbraw/zinc/21/50/76/1061215076.db2.gz BXUHZUHILFMDOL-UHFFFAOYSA-N 1 2 323.371 4.393 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)CCC2CCCCC2)[nH+]c1C ZINC001455762686 1061234510 /nfs/dbraw/zinc/23/45/10/1061234510.db2.gz LJQLVWVMVILJRA-MRXNPFEDSA-N 1 2 303.450 4.051 20 0 DIADLO CCCCC[C@H](C)CC(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001455770333 1061234883 /nfs/dbraw/zinc/23/48/83/1061234883.db2.gz MBSXGQGOGWHLKO-XJKSGUPXSA-N 1 2 305.466 4.297 20 0 DIADLO CCSCc1ccc[nH+]c1N[C@H](C)CCc1cccnc1 ZINC001462527578 1061238107 /nfs/dbraw/zinc/23/81/07/1061238107.db2.gz MNUVWDWCVNCOOA-CQSZACIVSA-N 1 2 301.459 4.163 20 0 DIADLO CC(C)(C)Oc1cccc(C[NH2+]Cc2c(Cl)ccnc2F)c1 ZINC001462554663 1061255335 /nfs/dbraw/zinc/25/53/35/1061255335.db2.gz HOZROHZDVIWKPN-UHFFFAOYSA-N 1 2 322.811 4.341 20 0 DIADLO Cc1c(Cl)nccc1-c1[nH]c2ccc(N3CCCC3)cc2[nH+]1 ZINC001251194465 1061265611 /nfs/dbraw/zinc/26/56/11/1061265611.db2.gz LBGWZPODGXPMNS-UHFFFAOYSA-N 1 2 312.804 4.187 20 0 DIADLO CCCCOC(=O)C(C)(C)[NH2+]CCc1ccc2ccccc2c1 ZINC001473591722 1061274663 /nfs/dbraw/zinc/27/46/63/1061274663.db2.gz KWZLODMJMKVZSL-UHFFFAOYSA-N 1 2 313.441 4.094 20 0 DIADLO CCC(C)(C)N1CC[NH+]([C@H](C)CCSc2ccccc2)CC1 ZINC001473594417 1061275921 /nfs/dbraw/zinc/27/59/21/1061275921.db2.gz GGHPDWWTALBZPU-QGZVFWFLSA-N 1 2 320.546 4.364 20 0 DIADLO C[C@H](CC1CCOCC1)[NH2+][C@@H](c1cccc(Cl)c1)C(F)F ZINC001462589231 1061282364 /nfs/dbraw/zinc/28/23/64/1061282364.db2.gz VILBHBFYHCETMR-ABAIWWIYSA-N 1 2 317.807 4.441 20 0 DIADLO Fc1cccc(Cl)c1[C@@H]1C[N@H+](CC23CCC(CC2)C3)CCO1 ZINC001473615762 1061292693 /nfs/dbraw/zinc/29/26/93/1061292693.db2.gz ABJOXZQQWMBIHW-MNQCNDSGSA-N 1 2 323.839 4.433 20 0 DIADLO Fc1cccc(Cl)c1[C@@H]1C[N@@H+](CC23CCC(CC2)C3)CCO1 ZINC001473615762 1061292708 /nfs/dbraw/zinc/29/27/08/1061292708.db2.gz ABJOXZQQWMBIHW-MNQCNDSGSA-N 1 2 323.839 4.433 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CC3(CCC3)OC[C@H]2C)cc1Cl ZINC001473621770 1061296253 /nfs/dbraw/zinc/29/62/53/1061296253.db2.gz PNSVTXBPQJZREV-CQSZACIVSA-N 1 2 323.864 4.271 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CC3(CCC3)OC[C@H]2C)cc1Cl ZINC001473621770 1061296270 /nfs/dbraw/zinc/29/62/70/1061296270.db2.gz PNSVTXBPQJZREV-CQSZACIVSA-N 1 2 323.864 4.271 20 0 DIADLO Clc1ccc2[nH]c(-c3cccc4[nH+]ccn43)nc2c1Cl ZINC001251326817 1061316609 /nfs/dbraw/zinc/31/66/09/1061316609.db2.gz YUFUTXYREDJMIX-UHFFFAOYSA-N 1 2 303.152 4.184 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@@H+]1C[C@@H](C)O[C@H](CC(F)(F)F)C1 ZINC001473661658 1061323750 /nfs/dbraw/zinc/32/37/50/1061323750.db2.gz UGOLIHHXUDTKHJ-KCPJHIHWSA-N 1 2 319.342 4.319 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@H+]1C[C@@H](C)O[C@H](CC(F)(F)F)C1 ZINC001473661658 1061323766 /nfs/dbraw/zinc/32/37/66/1061323766.db2.gz UGOLIHHXUDTKHJ-KCPJHIHWSA-N 1 2 319.342 4.319 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@@](C)(C(F)F)C1 ZINC001473661933 1061325810 /nfs/dbraw/zinc/32/58/10/1061325810.db2.gz ANFRXPNPENKZFU-DZGCQCFKSA-N 1 2 303.780 4.147 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@@](C)(C(F)F)C1 ZINC001473661933 1061325831 /nfs/dbraw/zinc/32/58/31/1061325831.db2.gz ANFRXPNPENKZFU-DZGCQCFKSA-N 1 2 303.780 4.147 20 0 DIADLO CO[C@@H](CNc1[nH+]c2ccccc2n1CC1CC1)C1CCCC1 ZINC001462680287 1061334263 /nfs/dbraw/zinc/33/42/63/1061334263.db2.gz FFDPMTUXQPEOEV-SFHVURJKSA-N 1 2 313.445 4.063 20 0 DIADLO FC(F)[C@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccccc1 ZINC001462680269 1061334732 /nfs/dbraw/zinc/33/47/32/1061334732.db2.gz DWJZHNINRRWCEO-JKSUJKDBSA-N 1 2 309.400 4.464 20 0 DIADLO CO[C@@H](CC(C)C)C[N@H+](C)[C@@H](CCc1ccccc1)C(F)F ZINC001473691274 1061349052 /nfs/dbraw/zinc/34/90/52/1061349052.db2.gz GBVZMTQEVBQWIL-IRXDYDNUSA-N 1 2 313.432 4.246 20 0 DIADLO CO[C@@H](CC(C)C)C[N@@H+](C)[C@@H](CCc1ccccc1)C(F)F ZINC001473691274 1061349070 /nfs/dbraw/zinc/34/90/70/1061349070.db2.gz GBVZMTQEVBQWIL-IRXDYDNUSA-N 1 2 313.432 4.246 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2ccccc2F)n1)c1ccns1 ZINC001473695055 1061352628 /nfs/dbraw/zinc/35/26/28/1061352628.db2.gz ZSSBXTZKFKGGJQ-JTQLQIEISA-N 1 2 319.430 4.257 20 0 DIADLO CC(C)[C@@H](C)N(C(=O)c1cccc2[nH+]ccn21)c1ccccc1 ZINC001462771200 1061355254 /nfs/dbraw/zinc/35/52/54/1061355254.db2.gz WLPWZBMYKGEVLD-OAHLLOKOSA-N 1 2 307.397 4.026 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@H](C(=O)OC(C)(C)C)C2CC2)C(C)C)c1 ZINC001473702968 1061356862 /nfs/dbraw/zinc/35/68/62/1061356862.db2.gz VCNPELCIBGAZED-ROUUACIJSA-N 1 2 317.473 4.402 20 0 DIADLO CO[C@H]1CC[C@@H](C)[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001473713744 1061364473 /nfs/dbraw/zinc/36/44/73/1061364473.db2.gz XDPASIVAQGBTRP-SKDRFNHKSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[C@@H](C)[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001473713744 1061364491 /nfs/dbraw/zinc/36/44/91/1061364491.db2.gz XDPASIVAQGBTRP-SKDRFNHKSA-N 1 2 306.208 4.132 20 0 DIADLO COc1ccc2[nH]c(-c3ccc(-n4cc[nH+]c4)c(Cl)c3)nc2c1 ZINC001251507543 1061384877 /nfs/dbraw/zinc/38/48/77/1061384877.db2.gz LVDYRAUBTMPXMX-UHFFFAOYSA-N 1 2 324.771 4.078 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(Cl)c(F)c1)c1c(F)cccc1F ZINC001473812446 1061417876 /nfs/dbraw/zinc/41/78/76/1061417876.db2.gz KGKHFUXVGKZHRP-QMMMGPOBSA-N 1 2 300.711 4.003 20 0 DIADLO Cc1ccc2c(cccc2-c2[nH]c3ccc(N(C)C)cc3[nH+]2)n1 ZINC001251779077 1061482211 /nfs/dbraw/zinc/48/22/11/1061482211.db2.gz XWSQXUOUIXMPQE-UHFFFAOYSA-N 1 2 302.381 4.153 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1nc2c(s1)C[C@@H](C)CC2 ZINC001473943621 1061486755 /nfs/dbraw/zinc/48/67/55/1061486755.db2.gz GFFDUAAEDHOBKK-LBPRGKRZSA-N 1 2 315.486 4.254 20 0 DIADLO CC(C)(C)c1c[nH]c(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)c1 ZINC001251824259 1061501289 /nfs/dbraw/zinc/50/12/89/1061501289.db2.gz RTDHSHPREDIXGR-UHFFFAOYSA-N 1 2 323.375 4.180 20 0 DIADLO Cc1cc(C)c(CNC(=O)N2c3ccccc3C(C)(C)[C@@H]2C)c[nH+]1 ZINC001251861704 1061515244 /nfs/dbraw/zinc/51/52/44/1061515244.db2.gz ICPQUIFNEMDZPS-HNNXBMFYSA-N 1 2 323.440 4.094 20 0 DIADLO CCC[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccccn1 ZINC001473982569 1061526565 /nfs/dbraw/zinc/52/65/65/1061526565.db2.gz UPRKMXIYDBUHGR-QGZVFWFLSA-N 1 2 307.397 4.368 20 0 DIADLO CCOc1ccc(Cl)cc1C[NH2+]Cc1cc(C(C)C)no1 ZINC001473999167 1061540995 /nfs/dbraw/zinc/54/09/95/1061540995.db2.gz NJLQAAQYGQNVIS-UHFFFAOYSA-N 1 2 308.809 4.140 20 0 DIADLO Cc1cc(N(C)Cc2cccc(Cl)c2)nc(C2CCC2)[nH+]1 ZINC001458051914 1061546189 /nfs/dbraw/zinc/54/61/89/1061546189.db2.gz BGRKGMFNFRVXDS-UHFFFAOYSA-N 1 2 301.821 4.342 20 0 DIADLO Cc1cc(CNC(=O)N2CC[C@H](C(C)(C)C)C[C@@H]2C)cc(C)[nH+]1 ZINC001252029594 1061559435 /nfs/dbraw/zinc/55/94/35/1061559435.db2.gz ZPFFWXITHJIMID-RDJZCZTQSA-N 1 2 317.477 4.055 20 0 DIADLO Cc1ccc(CNc2nc(C)[nH+]c(C)c2Br)c(C)c1 ZINC001458110243 1061573373 /nfs/dbraw/zinc/57/33/73/1061573373.db2.gz GXAGDIYLUJABRS-UHFFFAOYSA-N 1 2 320.234 4.085 20 0 DIADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccccc1Oc1c(C)cccc1C ZINC001464391030 1061585751 /nfs/dbraw/zinc/58/57/51/1061585751.db2.gz YHHQXTLZKKUNQB-QGZVFWFLSA-N 1 2 324.424 4.128 20 0 DIADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccccc1Oc1c(C)cccc1C ZINC001464391030 1061585771 /nfs/dbraw/zinc/58/57/71/1061585771.db2.gz YHHQXTLZKKUNQB-QGZVFWFLSA-N 1 2 324.424 4.128 20 0 DIADLO CCc1cc(N[C@@H]2CCCOc3ccc(F)cc32)nc(CC)[nH+]1 ZINC001458133196 1061588154 /nfs/dbraw/zinc/58/81/54/1061588154.db2.gz KWGWSGFJPYJKMX-OAHLLOKOSA-N 1 2 315.392 4.066 20 0 DIADLO Cc1cc(N2CC[C@H](c3ccccc3C)C2)nc(C2CCC2)[nH+]1 ZINC001458139415 1061594987 /nfs/dbraw/zinc/59/49/87/1061594987.db2.gz GWXFLUFDRIISGJ-KRWDZBQOSA-N 1 2 307.441 4.355 20 0 DIADLO Fc1cccc2oc(Nc3ccc(NC4CCCC4)[nH+]c3)nc21 ZINC001458143848 1061596570 /nfs/dbraw/zinc/59/65/70/1061596570.db2.gz FIVDXGKROXMROO-UHFFFAOYSA-N 1 2 312.348 4.460 20 0 DIADLO CN(C)c1ccc(NCc2ccc(-c3cccs3)cc2)[nH+]c1 ZINC001474053291 1061600389 /nfs/dbraw/zinc/60/03/89/1061600389.db2.gz QXBHZEBQVMBYHD-UHFFFAOYSA-N 1 2 309.438 4.488 20 0 DIADLO Cc1cc([C@](C)(O)CNc2cc(C)c3ccccc3[nH+]2)c(C)o1 ZINC001252164675 1061602494 /nfs/dbraw/zinc/60/24/94/1061602494.db2.gz NJKXOQALNCWEGG-LJQANCHMSA-N 1 2 310.397 4.073 20 0 DIADLO CCc1cc(NCC2(c3ccc(Cl)cc3)CC2)nc(CC)[nH+]1 ZINC001458157320 1061603968 /nfs/dbraw/zinc/60/39/68/1061603968.db2.gz OTQRRQDVOHLODW-UHFFFAOYSA-N 1 2 315.848 4.399 20 0 DIADLO CCOc1ccccc1CCNc1cc(C)[nH+]c(C2CCC2)n1 ZINC001458164768 1061609537 /nfs/dbraw/zinc/60/95/37/1061609537.db2.gz XVCIBNOZJAVHBG-UHFFFAOYSA-N 1 2 311.429 4.106 20 0 DIADLO CC(C)[C@H]1CC[C@@H](C)C[C@H]1CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001464603605 1061612136 /nfs/dbraw/zinc/61/21/36/1061612136.db2.gz HCEKHSPVBDZCTL-IJEWVQPXSA-N 1 2 313.445 4.001 20 0 DIADLO CCS[C@H]1CC[C@H](N(C)c2cc(C)[nH+]c(C3CCC3)n2)C1 ZINC001458202217 1061627699 /nfs/dbraw/zinc/62/76/99/1061627699.db2.gz ANZLLBXPVORADK-GJZGRUSLSA-N 1 2 305.491 4.163 20 0 DIADLO CCC[C@@H]1[C@@H](C)CCCN1c1nc2ccccc2n2c[nH+]cc12 ZINC001458210043 1061632761 /nfs/dbraw/zinc/63/27/61/1061632761.db2.gz CUIMATXITPYEIF-GOEBONIOSA-N 1 2 308.429 4.288 20 0 DIADLO Cc1cc(NC(=O)c2ccc(Cl)s2)ccc1-n1cc[nH+]c1 ZINC001464824432 1061637000 /nfs/dbraw/zinc/63/70/00/1061637000.db2.gz GZKFNPGPSXTVRS-UHFFFAOYSA-N 1 2 317.801 4.148 20 0 DIADLO CC[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001464831397 1061640939 /nfs/dbraw/zinc/64/09/39/1061640939.db2.gz RRLJRKKZZQYVLO-RDJZCZTQSA-N 1 2 311.429 4.336 20 0 DIADLO CCc1cc(N2C[C@@H](C)C[C@@H]2c2ccccc2F)nc(CC)[nH+]1 ZINC001458223219 1061641941 /nfs/dbraw/zinc/64/19/41/1061641941.db2.gz BZUPFYLPXYIMAJ-SUMWQHHRSA-N 1 2 313.420 4.328 20 0 DIADLO CCc1c(NCc2cc(C)[nH+]c(C)c2)cnn1CCC(C)C ZINC001474112236 1061661949 /nfs/dbraw/zinc/66/19/49/1061661949.db2.gz XTLZLPDIJKRBQY-UHFFFAOYSA-N 1 2 300.450 4.116 20 0 DIADLO C(=C/c1ccccc1)\CNc1nc2ccccc2n2c[nH+]cc12 ZINC001458278819 1061675060 /nfs/dbraw/zinc/67/50/60/1061675060.db2.gz CVTYUXSOPDJFNA-RMKNXTFCSA-N 1 2 300.365 4.008 20 0 DIADLO CCc1cc(N[C@@H]2CCCOc3cc(F)ccc32)nc(CC)[nH+]1 ZINC001458292006 1061681550 /nfs/dbraw/zinc/68/15/50/1061681550.db2.gz SZMBJYWJZOSUBH-OAHLLOKOSA-N 1 2 315.392 4.066 20 0 DIADLO Cc1ccccc1C1CCN(c2nc(C)[nH+]c3c2CCCC3)CC1 ZINC001458309060 1061690553 /nfs/dbraw/zinc/69/05/53/1061690553.db2.gz HCXAYRSYROGEOE-UHFFFAOYSA-N 1 2 321.468 4.356 20 0 DIADLO CCc1cc(N2CCC(c3ccsc3)CC2)nc(CC)[nH+]1 ZINC001458330648 1061702851 /nfs/dbraw/zinc/70/28/51/1061702851.db2.gz OPZSTRGKMQGUFN-UHFFFAOYSA-N 1 2 301.459 4.047 20 0 DIADLO FC(F)Oc1ccccc1NCc1cc(-n2cc[nH+]c2)cs1 ZINC001474175502 1061720477 /nfs/dbraw/zinc/72/04/77/1061720477.db2.gz OBIYAFOAFKNMCF-UHFFFAOYSA-N 1 2 321.352 4.147 20 0 DIADLO Cc1cccc(CCCNc2cnc3cc(Cl)ccc3n2)[nH+]1 ZINC001458370066 1061726174 /nfs/dbraw/zinc/72/61/74/1061726174.db2.gz PTCOERSGBFKNME-UHFFFAOYSA-N 1 2 312.804 4.031 20 0 DIADLO CC(C)(C)c1ccc(-c2nnc(-c3cccc4[nH+]ccn43)o2)cc1 ZINC001252809211 1061726919 /nfs/dbraw/zinc/72/69/19/1061726919.db2.gz SHBZOEWJDFPCAK-UHFFFAOYSA-N 1 2 318.380 4.349 20 0 DIADLO CC(C)(C)c1ccc(C2=NNC(=c3ccnc4c3=CC=[NH+]4)O2)cc1 ZINC001252823026 1061731216 /nfs/dbraw/zinc/73/12/16/1061731216.db2.gz KMJXFRCDHQTUES-HNNXBMFYSA-N 1 2 318.380 4.054 20 0 DIADLO CC(C)=CCC[C@@H](C)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001458389007 1061734680 /nfs/dbraw/zinc/73/46/80/1061734680.db2.gz RXTHKOSBYTVINI-CYBMUJFWSA-N 1 2 301.438 4.128 20 0 DIADLO CO[C@H]1C[C@H](Nc2cc(C(C)C)[nH+]c(C(C)C)n2)C12CCC2 ZINC001458428239 1061756212 /nfs/dbraw/zinc/75/62/12/1061756212.db2.gz IORPJUAEYUYNRT-GJZGRUSLSA-N 1 2 303.450 4.093 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)Nc1nc(C)[nH+]c2c1CCCC2 ZINC001458434475 1061761415 /nfs/dbraw/zinc/76/14/15/1061761415.db2.gz XFWHXPXUAWJRAJ-CYBMUJFWSA-N 1 2 311.429 4.154 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2cc3c[nH+]ccc3[nH]2)o1 ZINC001465476482 1061762549 /nfs/dbraw/zinc/76/25/49/1061762549.db2.gz ITJDOFZMPWJGEZ-SJCJKPOMSA-N 1 2 323.396 4.078 20 0 DIADLO CC[C@@H](Nc1[nH+]cnc2c1cnn2-c1ccccc1)[C@H]1CC1(C)C ZINC001458442588 1061765812 /nfs/dbraw/zinc/76/58/12/1061765812.db2.gz CNLYQOCKUBGZRU-HZPDHXFCSA-N 1 2 321.428 4.052 20 0 DIADLO CC[C@H](Nc1[nH+]cnc2c1cnn2-c1ccccc1)[C@@H]1CC1(C)C ZINC001458442585 1061765890 /nfs/dbraw/zinc/76/58/90/1061765890.db2.gz CNLYQOCKUBGZRU-HOTGVXAUSA-N 1 2 321.428 4.052 20 0 DIADLO Cc1ccc(F)cc1C[NH2+][C@@H](CCc1ccccc1)C(F)F ZINC001474211552 1061769553 /nfs/dbraw/zinc/76/95/53/1061769553.db2.gz SNCUHVPUTYWONK-KRWDZBQOSA-N 1 2 307.359 4.490 20 0 DIADLO CCCCCC(C)(C)CNC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001465532086 1061772516 /nfs/dbraw/zinc/77/25/16/1061772516.db2.gz QLVXATCIGSRIPD-UHFFFAOYSA-N 1 2 316.449 4.371 20 0 DIADLO CCc1ccc(-c2nnc([C@H]3CC[N@@H+]3Cc3ccccc3)o2)cc1 ZINC001252981817 1061772299 /nfs/dbraw/zinc/77/22/99/1061772299.db2.gz NFMGAYMYZQUFES-GOSISDBHSA-N 1 2 319.408 4.246 20 0 DIADLO CCc1ccc(-c2nnc([C@H]3CC[N@H+]3Cc3ccccc3)o2)cc1 ZINC001252981817 1061772323 /nfs/dbraw/zinc/77/23/23/1061772323.db2.gz NFMGAYMYZQUFES-GOSISDBHSA-N 1 2 319.408 4.246 20 0 DIADLO Cc1ccc(C[NH2+]Cc2c(C)nn(-c3ccccc3)c2Cl)o1 ZINC001474224434 1061785436 /nfs/dbraw/zinc/78/54/36/1061785436.db2.gz RJLPIJYMSXZLJL-UHFFFAOYSA-N 1 2 315.804 4.025 20 0 DIADLO CCCSc1cccc(NCc2c[nH+]c3c(C)cccn23)n1 ZINC001474232608 1061793790 /nfs/dbraw/zinc/79/37/90/1061793790.db2.gz OOORMHWOHACRLY-UHFFFAOYSA-N 1 2 312.442 4.152 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1ccncc1Cl ZINC001474252341 1061819308 /nfs/dbraw/zinc/81/93/08/1061819308.db2.gz NFBYAVIVZDTZGO-UHFFFAOYSA-N 1 2 321.211 4.370 20 0 DIADLO Nc1c(Cl)cccc1CNc1[nH]c2ccc(Cl)cc2[nH+]1 ZINC001474256270 1061822020 /nfs/dbraw/zinc/82/20/20/1061822020.db2.gz JNHVPIXKUVJOIA-UHFFFAOYSA-N 1 2 307.184 4.064 20 0 DIADLO Clc1ccc2[nH]c(NCc3ccnn3-c3ccccc3)[nH+]c2c1 ZINC001474255870 1061823473 /nfs/dbraw/zinc/82/34/73/1061823473.db2.gz ATWWHEBUNFLYQI-UHFFFAOYSA-N 1 2 323.787 4.014 20 0 DIADLO Clc1ccc2[nH+]c(NCc3ccnn3-c3ccccc3)[nH]c2c1 ZINC001474255870 1061823497 /nfs/dbraw/zinc/82/34/97/1061823497.db2.gz ATWWHEBUNFLYQI-UHFFFAOYSA-N 1 2 323.787 4.014 20 0 DIADLO COc1ccccc1/C=C/CNc1[nH]c2ccc(Cl)cc2[nH+]1 ZINC001474255892 1061823602 /nfs/dbraw/zinc/82/36/02/1061823602.db2.gz BLVUTDQRVMVPCQ-GQCTYLIASA-N 1 2 313.788 4.350 20 0 DIADLO Clc1ccc2[nH]c(NCc3cnc(C4CC4)s3)[nH+]c2c1 ZINC001474257224 1061827104 /nfs/dbraw/zinc/82/71/04/1061827104.db2.gz HYXKYNHVPVREKT-UHFFFAOYSA-N 1 2 304.806 4.162 20 0 DIADLO Clc1ccc2[nH+]c(NCc3cnc(C4CC4)s3)[nH]c2c1 ZINC001474257224 1061827127 /nfs/dbraw/zinc/82/71/27/1061827127.db2.gz HYXKYNHVPVREKT-UHFFFAOYSA-N 1 2 304.806 4.162 20 0 DIADLO CC(C)Oc1ccc(C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)cc1 ZINC001474266069 1061831983 /nfs/dbraw/zinc/83/19/83/1061831983.db2.gz LOEZIYVGIJTWGV-PKOBYXMFSA-N 1 2 315.388 4.035 20 0 DIADLO CC(C)Cc1ccc(NC(=O)[C@@H](CC(C)C)n2cc[nH+]c2)cc1 ZINC001465898224 1061833095 /nfs/dbraw/zinc/83/30/95/1061833095.db2.gz NGJCQFWZIUCGOZ-GOSISDBHSA-N 1 2 313.445 4.308 20 0 DIADLO CC(C)Oc1ccc(C[NH2+][C@H]2c3ccccc3OC[C@H]2F)cc1 ZINC001474266068 1061833328 /nfs/dbraw/zinc/83/33/28/1061833328.db2.gz LOEZIYVGIJTWGV-MJGOQNOKSA-N 1 2 315.388 4.035 20 0 DIADLO CCc1cc(N2CCC[C@]2(C)Cc2cccs2)nc(CC)[nH+]1 ZINC001458662016 1061867807 /nfs/dbraw/zinc/86/78/07/1061867807.db2.gz BPTOSRDABFJVRX-GOSISDBHSA-N 1 2 315.486 4.265 20 0 DIADLO CC(C)c1cc(NC[C@]23C[C@H]2COC32CCC2)nc(C(C)C)[nH+]1 ZINC001458677656 1061871753 /nfs/dbraw/zinc/87/17/53/1061871753.db2.gz UXJDOQQFYQXCHG-KBXCAEBGSA-N 1 2 315.461 4.095 20 0 DIADLO CCNc1ccc(Nc2ncnc3ccc(C(C)C)cc32)c[nH+]1 ZINC001458737659 1061888369 /nfs/dbraw/zinc/88/83/69/1061888369.db2.gz ZHVYIYKHRJQEIP-UHFFFAOYSA-N 1 2 307.401 4.324 20 0 DIADLO CCCCCn1c2ccccc2nc1SCCn1cc[nH+]c1 ZINC001458749496 1061891760 /nfs/dbraw/zinc/89/17/60/1061891760.db2.gz FKIGUQLPLYKLRQ-UHFFFAOYSA-N 1 2 314.458 4.215 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2cnn(C)c2Cl)o1 ZINC001474326436 1061915386 /nfs/dbraw/zinc/91/53/86/1061915386.db2.gz DQQOPWXIVFBRLC-DOMZBBRYSA-N 1 2 321.852 4.202 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2cnn(C)c2Cl)o1 ZINC001474326436 1061915398 /nfs/dbraw/zinc/91/53/98/1061915398.db2.gz DQQOPWXIVFBRLC-DOMZBBRYSA-N 1 2 321.852 4.202 20 0 DIADLO Cc1cc(N)nc(SCc2ccccc2Oc2ccccc2)[nH+]1 ZINC001458863680 1061924125 /nfs/dbraw/zinc/92/41/25/1061924125.db2.gz YMWYEIINWTUIGY-UHFFFAOYSA-N 1 2 323.421 4.452 20 0 DIADLO C[C@@H]1C[C@@H]1C[N@@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001474343767 1061944538 /nfs/dbraw/zinc/94/45/38/1061944538.db2.gz UKVLYZNDZIOTLC-HCKVZZMMSA-N 1 2 300.229 4.023 20 0 DIADLO C[C@@H]1C[C@@H]1C[N@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001474343767 1061944545 /nfs/dbraw/zinc/94/45/45/1061944545.db2.gz UKVLYZNDZIOTLC-HCKVZZMMSA-N 1 2 300.229 4.023 20 0 DIADLO C[C@@H]1C[C@@H]1C[N@@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001474343769 1061948244 /nfs/dbraw/zinc/94/82/44/1061948244.db2.gz UKVLYZNDZIOTLC-IXPVHAAZSA-N 1 2 300.229 4.023 20 0 DIADLO C[C@@H]1C[C@@H]1C[N@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001474343769 1061948267 /nfs/dbraw/zinc/94/82/67/1061948267.db2.gz UKVLYZNDZIOTLC-IXPVHAAZSA-N 1 2 300.229 4.023 20 0 DIADLO Cc1cc(Oc2ccc(NC[C@@H](O)C(C)(C)C)cc2)cc[nH+]1 ZINC001253734864 1061966731 /nfs/dbraw/zinc/96/67/31/1061966731.db2.gz IXYVLZRGSHSJQI-QGZVFWFLSA-N 1 2 300.402 4.001 20 0 DIADLO Clc1ccccc1[C@H]1CCC[N@@H+]1Cc1nccn1C1CC1 ZINC001474358334 1061981984 /nfs/dbraw/zinc/98/19/84/1061981984.db2.gz PYNOHKALWPBOQZ-MRXNPFEDSA-N 1 2 301.821 4.209 20 0 DIADLO Clc1ccccc1[C@H]1CCC[N@H+]1Cc1nccn1C1CC1 ZINC001474358334 1061982003 /nfs/dbraw/zinc/98/20/03/1061982003.db2.gz PYNOHKALWPBOQZ-MRXNPFEDSA-N 1 2 301.821 4.209 20 0 DIADLO Cc1ccc(Br)c(F)c1C[N@H+](C)Cc1ccoc1 ZINC001474362116 1061986647 /nfs/dbraw/zinc/98/66/47/1061986647.db2.gz JNKOCPJRAKXGQL-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccc(Br)c(F)c1C[N@@H+](C)Cc1ccoc1 ZINC001474362116 1061986666 /nfs/dbraw/zinc/98/66/66/1061986666.db2.gz JNKOCPJRAKXGQL-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO CON(C[C@@H]1CCC[C@@H](C)C1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001466755258 1061999688 /nfs/dbraw/zinc/99/96/88/1061999688.db2.gz NYRSUJVHFSOETE-MLGOLLRUSA-N 1 2 319.449 4.228 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C)C2CCCCCC2)c(C)[nH+]1 ZINC001466755639 1062001049 /nfs/dbraw/zinc/00/10/49/1062001049.db2.gz UGOBVLJBLIZINT-AWEZNQCLSA-N 1 2 303.450 4.487 20 0 DIADLO Cc1ccc(C2=CC[N@H+](Cc3cnc(Cl)c(F)c3)CC2)cc1 ZINC001474367606 1062002054 /nfs/dbraw/zinc/00/20/54/1062002054.db2.gz IUQYNSIYIIAZHJ-UHFFFAOYSA-N 1 2 316.807 4.472 20 0 DIADLO Cc1ccc(C2=CC[N@@H+](Cc3cnc(Cl)c(F)c3)CC2)cc1 ZINC001474367606 1062002079 /nfs/dbraw/zinc/00/20/79/1062002079.db2.gz IUQYNSIYIIAZHJ-UHFFFAOYSA-N 1 2 316.807 4.472 20 0 DIADLO C[N@H+](Cc1ccccc1)[C@@H](c1nnc(C2CC2)o1)c1ccccc1 ZINC001254082247 1062022286 /nfs/dbraw/zinc/02/22/86/1062022286.db2.gz PRMFIRJYFCXPMG-GOSISDBHSA-N 1 2 319.408 4.168 20 0 DIADLO C[N@@H+](Cc1ccccc1)[C@@H](c1nnc(C2CC2)o1)c1ccccc1 ZINC001254082247 1062022309 /nfs/dbraw/zinc/02/23/09/1062022309.db2.gz PRMFIRJYFCXPMG-GOSISDBHSA-N 1 2 319.408 4.168 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(Oc3ccc(F)cc3)nc2)C[C@H]1F ZINC001474393286 1062046349 /nfs/dbraw/zinc/04/63/49/1062046349.db2.gz NCJWDRKTGPOTBS-CXAGYDPISA-N 1 2 318.367 4.193 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)nc2)C[C@H]1F ZINC001474393286 1062046370 /nfs/dbraw/zinc/04/63/70/1062046370.db2.gz NCJWDRKTGPOTBS-CXAGYDPISA-N 1 2 318.367 4.193 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)C(=O)OC(C)(C)C)[C@@H](C)c1ccc(Cl)cc1 ZINC001474396161 1062054450 /nfs/dbraw/zinc/05/44/50/1062054450.db2.gz GTNZINUPFKQWNY-UPJWGTAASA-N 1 2 311.853 4.152 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(Oc2ccccc2)o1 ZINC001474411634 1062076637 /nfs/dbraw/zinc/07/66/37/1062076637.db2.gz DDZYRCIPZYNBOH-HUUCEWRRSA-N 1 2 301.386 4.071 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ccc(Oc2ccccc2)o1 ZINC001474411634 1062076647 /nfs/dbraw/zinc/07/66/47/1062076647.db2.gz DDZYRCIPZYNBOH-HUUCEWRRSA-N 1 2 301.386 4.071 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccc(F)c(F)c1F ZINC001474437548 1062114924 /nfs/dbraw/zinc/11/49/24/1062114924.db2.gz ZYIPJUBQKBQDRK-SCZZXKLOSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccc(F)c(F)c1F ZINC001474437548 1062114930 /nfs/dbraw/zinc/11/49/30/1062114930.db2.gz ZYIPJUBQKBQDRK-SCZZXKLOSA-N 1 2 311.269 4.267 20 0 DIADLO Oc1cccc2sc(C[N@@H+]3CCC=C(Br)C3)cc21 ZINC001474474013 1062150763 /nfs/dbraw/zinc/15/07/63/1062150763.db2.gz IIMFWQMNZSULFE-UHFFFAOYSA-N 1 2 324.243 4.091 20 0 DIADLO Oc1cccc2sc(C[N@H+]3CCC=C(Br)C3)cc21 ZINC001474474013 1062150781 /nfs/dbraw/zinc/15/07/81/1062150781.db2.gz IIMFWQMNZSULFE-UHFFFAOYSA-N 1 2 324.243 4.091 20 0 DIADLO CCO[C@H]1C[C@@H](Nc2[nH+]cccc2OC(C)C)C12CCCCC2 ZINC001474451259 1062129212 /nfs/dbraw/zinc/12/92/12/1062129212.db2.gz GZPAJYGMSGAMCZ-SJORKVTESA-N 1 2 318.461 4.409 20 0 DIADLO C[C@@H]1COCC[N@@H+]1Cc1ccc(-c2ccccc2)c(Cl)c1 ZINC001474478446 1062158667 /nfs/dbraw/zinc/15/86/67/1062158667.db2.gz CDORWVUIDDNQLB-CQSZACIVSA-N 1 2 301.817 4.228 20 0 DIADLO C[C@@H]1COCC[N@H+]1Cc1ccc(-c2ccccc2)c(Cl)c1 ZINC001474478446 1062158677 /nfs/dbraw/zinc/15/86/77/1062158677.db2.gz CDORWVUIDDNQLB-CQSZACIVSA-N 1 2 301.817 4.228 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2sc(N(C)C)nc2Cl)c1 ZINC001474495770 1062176377 /nfs/dbraw/zinc/17/63/77/1062176377.db2.gz OUKNPGQUYQACCY-UHFFFAOYSA-N 1 2 323.893 4.111 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2sc(N(C)C)nc2Cl)c1 ZINC001474495770 1062176394 /nfs/dbraw/zinc/17/63/94/1062176394.db2.gz OUKNPGQUYQACCY-UHFFFAOYSA-N 1 2 323.893 4.111 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1nc(Cl)cs1 ZINC001474500832 1062180859 /nfs/dbraw/zinc/18/08/59/1062180859.db2.gz KUZBUILTWCEMMA-ZDUSSCGKSA-N 1 2 310.850 4.388 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1nc(Cl)cs1 ZINC001474500832 1062180866 /nfs/dbraw/zinc/18/08/66/1062180866.db2.gz KUZBUILTWCEMMA-ZDUSSCGKSA-N 1 2 310.850 4.388 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@@H+]2Cc2ccccc2C2CC2)o1 ZINC001459536822 1062192092 /nfs/dbraw/zinc/19/20/92/1062192092.db2.gz SATFEQVWBCAIPF-IBGZPJMESA-N 1 2 311.425 4.293 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@H+]2Cc2ccccc2C2CC2)o1 ZINC001459536822 1062192111 /nfs/dbraw/zinc/19/21/11/1062192111.db2.gz SATFEQVWBCAIPF-IBGZPJMESA-N 1 2 311.425 4.293 20 0 DIADLO Cn1ncc(C[N@@H+]2CCCC[C@H]2c2ccc(Cl)cc2)c1Cl ZINC001474524350 1062208283 /nfs/dbraw/zinc/20/82/83/1062208283.db2.gz VOSZDZYTYJICAH-HNNXBMFYSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1ncc(C[N@H+]2CCCC[C@H]2c2ccc(Cl)cc2)c1Cl ZINC001474524350 1062208304 /nfs/dbraw/zinc/20/83/04/1062208304.db2.gz VOSZDZYTYJICAH-HNNXBMFYSA-N 1 2 324.255 4.454 20 0 DIADLO C[N@H+](Cc1ccc2c(c1)CCCC2)Cc1c(F)cccc1F ZINC001474536979 1062226334 /nfs/dbraw/zinc/22/63/34/1062226334.db2.gz BCIRNYNOUFYTMA-UHFFFAOYSA-N 1 2 301.380 4.476 20 0 DIADLO C[N@@H+](Cc1ccc2c(c1)CCCC2)Cc1c(F)cccc1F ZINC001474536979 1062226350 /nfs/dbraw/zinc/22/63/50/1062226350.db2.gz BCIRNYNOUFYTMA-UHFFFAOYSA-N 1 2 301.380 4.476 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@@H+]1CCc3c(F)ccc(F)c3C1)CC2 ZINC001459613104 1062243503 /nfs/dbraw/zinc/24/35/03/1062243503.db2.gz KGCJPBLRYLAGCJ-GOSISDBHSA-N 1 2 303.327 4.150 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@H+]1CCc3c(F)ccc(F)c3C1)CC2 ZINC001459613104 1062243523 /nfs/dbraw/zinc/24/35/23/1062243523.db2.gz KGCJPBLRYLAGCJ-GOSISDBHSA-N 1 2 303.327 4.150 20 0 DIADLO CCC1(C)C[NH+](Cc2cc(Cl)cc(Br)c2)C1 ZINC001474569683 1062275807 /nfs/dbraw/zinc/27/58/07/1062275807.db2.gz FUDIIILWHARRJG-UHFFFAOYSA-N 1 2 302.643 4.334 20 0 DIADLO CN(C)c1cc(CSCc2ccc3ccccc3n2)cc[nH+]1 ZINC001254981810 1062294740 /nfs/dbraw/zinc/29/47/40/1062294740.db2.gz SPANNXYRNKIXRM-UHFFFAOYSA-N 1 2 309.438 4.129 20 0 DIADLO CCc1nnc([C@@H](c2ccc(Cl)cc2)[NH+]2CCCCCC2)o1 ZINC001255091512 1062311008 /nfs/dbraw/zinc/31/10/08/1062311008.db2.gz QTAFVTJHNJMKSY-MRXNPFEDSA-N 1 2 319.836 4.251 20 0 DIADLO CC(C)O[C@@H]1CCC[N@H+](Cc2c(F)ccc(F)c2Cl)C1 ZINC001474613387 1062330696 /nfs/dbraw/zinc/33/06/96/1062330696.db2.gz CSISVWHQTLFADP-LLVKDONJSA-N 1 2 303.780 4.008 20 0 DIADLO CC(C)O[C@@H]1CCC[N@@H+](Cc2c(F)ccc(F)c2Cl)C1 ZINC001474613387 1062330715 /nfs/dbraw/zinc/33/07/15/1062330715.db2.gz CSISVWHQTLFADP-LLVKDONJSA-N 1 2 303.780 4.008 20 0 DIADLO Oc1ccc(C[NH2+]Cc2cc(Cl)cc(Cl)c2)c(F)c1F ZINC001474623535 1062347012 /nfs/dbraw/zinc/34/70/12/1062347012.db2.gz UQAJWNFXOQIXTB-UHFFFAOYSA-N 1 2 318.150 4.267 20 0 DIADLO Cc1cccc(CC2C[NH+](Cc3ccc(F)c(F)c3F)C2)c1 ZINC001474641425 1062365712 /nfs/dbraw/zinc/36/57/12/1062365712.db2.gz LZSCUWWDRGBZKW-UHFFFAOYSA-N 1 2 305.343 4.087 20 0 DIADLO CC(C)C[C@@H]1CCC[N@H+](Cc2ncsc2Br)C1 ZINC001459770237 1062382679 /nfs/dbraw/zinc/38/26/79/1062382679.db2.gz UJCROXPISPIWPO-NSHDSACASA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)C[C@@H]1CCC[N@@H+](Cc2ncsc2Br)C1 ZINC001459770237 1062382703 /nfs/dbraw/zinc/38/27/03/1062382703.db2.gz UJCROXPISPIWPO-NSHDSACASA-N 1 2 317.296 4.164 20 0 DIADLO C/C=C\C[C@@H]1CCC[N@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001474652029 1062384295 /nfs/dbraw/zinc/38/42/95/1062384295.db2.gz AZYZZGPPTJZQRS-OTDNITJGSA-N 1 2 304.381 4.340 20 0 DIADLO C/C=C\C[C@@H]1CCC[N@@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001474652029 1062384318 /nfs/dbraw/zinc/38/43/18/1062384318.db2.gz AZYZZGPPTJZQRS-OTDNITJGSA-N 1 2 304.381 4.340 20 0 DIADLO Fc1ccc(F)c(C[NH+]2CC(Cc3cccs3)C2)c1Cl ZINC001474654866 1062386338 /nfs/dbraw/zinc/38/63/38/1062386338.db2.gz APRZVIDFVGIQSP-UHFFFAOYSA-N 1 2 313.800 4.354 20 0 DIADLO C[C@H]([NH2+]CC1(c2cccc(Cl)c2)CCC1)C(=O)OC(C)(C)C ZINC001474672223 1062403224 /nfs/dbraw/zinc/40/32/24/1062403224.db2.gz SEVCMQZDFWWDBH-ZDUSSCGKSA-N 1 2 323.864 4.082 20 0 DIADLO FC[C@@H]([NH2+]Cc1cc2c(ccnc2Cl)o1)c1ccc(F)cc1 ZINC001474674908 1062405458 /nfs/dbraw/zinc/40/54/58/1062405458.db2.gz KTNZVGKUABFPLB-CQSZACIVSA-N 1 2 322.742 4.421 20 0 DIADLO COc1ccc([C@@H](C)[C@H](C)Nc2c[nH+]c(C)c(C)c2)cc1OC ZINC001474683821 1062416455 /nfs/dbraw/zinc/41/64/55/1062416455.db2.gz BYNJRFHQRGIJIO-ZFWWWQNUSA-N 1 2 314.429 4.320 20 0 DIADLO FC(F)[C@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1cccc(Cl)c1 ZINC001474707004 1062431884 /nfs/dbraw/zinc/43/18/84/1062431884.db2.gz ODEVXCRDQHJBEZ-UONOGXRCSA-N 1 2 315.791 4.338 20 0 DIADLO CC[C@@H](c1ccccc1)[N@H+](CC(=O)OC)Cc1csc(C)c1 ZINC001459832325 1062433508 /nfs/dbraw/zinc/43/35/08/1062433508.db2.gz IKVAMSYUAGQGIQ-KRWDZBQOSA-N 1 2 317.454 4.183 20 0 DIADLO CC[C@@H](c1ccccc1)[N@@H+](CC(=O)OC)Cc1csc(C)c1 ZINC001459832325 1062433514 /nfs/dbraw/zinc/43/35/14/1062433514.db2.gz IKVAMSYUAGQGIQ-KRWDZBQOSA-N 1 2 317.454 4.183 20 0 DIADLO CC(C)(C)OC(=O)[C@H](Cc1ccccc1)[NH2+][C@@H]1CCC(C)(C)C1 ZINC001474725316 1062446775 /nfs/dbraw/zinc/44/67/75/1062446775.db2.gz CTCWOFNMWKBKAO-SJORKVTESA-N 1 2 317.473 4.108 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@@H](Cc2ccccc2)C1 ZINC001459868151 1062459908 /nfs/dbraw/zinc/45/99/08/1062459908.db2.gz HCXCTXLEMLMHPU-KXBFYZLASA-N 1 2 315.844 4.345 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@@H](Cc2ccccc2)C1 ZINC001459868151 1062459914 /nfs/dbraw/zinc/45/99/14/1062459914.db2.gz HCXCTXLEMLMHPU-KXBFYZLASA-N 1 2 315.844 4.345 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@H](Cc2ccccc2)C1 ZINC001459867427 1062460059 /nfs/dbraw/zinc/46/00/59/1062460059.db2.gz HCXCTXLEMLMHPU-HNAYVOBHSA-N 1 2 315.844 4.345 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@H](Cc2ccccc2)C1 ZINC001459867427 1062460071 /nfs/dbraw/zinc/46/00/71/1062460071.db2.gz HCXCTXLEMLMHPU-HNAYVOBHSA-N 1 2 315.844 4.345 20 0 DIADLO COc1cc(C)ccc1C[N@H+](C)Cc1cc(-c2ccccc2)n[nH]1 ZINC001474743737 1062460654 /nfs/dbraw/zinc/46/06/54/1062460654.db2.gz UFTJJZHYBVZVTN-UHFFFAOYSA-N 1 2 321.424 4.026 20 0 DIADLO COc1cc(C)ccc1C[N@@H+](C)Cc1cc(-c2ccccc2)n[nH]1 ZINC001474743737 1062460666 /nfs/dbraw/zinc/46/06/66/1062460666.db2.gz UFTJJZHYBVZVTN-UHFFFAOYSA-N 1 2 321.424 4.026 20 0 DIADLO C[C@@H]([NH2+]Cc1csnn1)c1ccc(Oc2ccccc2)cc1 ZINC001459873273 1062463607 /nfs/dbraw/zinc/46/36/07/1062463607.db2.gz BRVHRXVVFAGYIF-CYBMUJFWSA-N 1 2 311.410 4.181 20 0 DIADLO CCCOc1ccc(C[NH+]2CC(Oc3ccccc3)C2)cc1C ZINC001474762271 1062468928 /nfs/dbraw/zinc/46/89/28/1062468928.db2.gz PPTKBSQDLVSWLG-UHFFFAOYSA-N 1 2 311.425 4.047 20 0 DIADLO CCC1(CC)C[N@H+](Cc2c(Cl)cncc2Cl)CCS1 ZINC001459901440 1062484175 /nfs/dbraw/zinc/48/41/75/1062484175.db2.gz NXVBVVPCOIMZPB-UHFFFAOYSA-N 1 2 319.301 4.496 20 0 DIADLO CCC1(CC)C[N@@H+](Cc2c(Cl)cncc2Cl)CCS1 ZINC001459901440 1062484181 /nfs/dbraw/zinc/48/41/81/1062484181.db2.gz NXVBVVPCOIMZPB-UHFFFAOYSA-N 1 2 319.301 4.496 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC001459911619 1062492659 /nfs/dbraw/zinc/49/26/59/1062492659.db2.gz HKJRQHOKDVJMBU-LJQANCHMSA-N 1 2 315.844 4.476 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC001459911619 1062492668 /nfs/dbraw/zinc/49/26/68/1062492668.db2.gz HKJRQHOKDVJMBU-LJQANCHMSA-N 1 2 315.844 4.476 20 0 DIADLO Fc1cccc(F)c1C[N@H+](CCOCc1ccccc1)C1CC1 ZINC001459939387 1062512156 /nfs/dbraw/zinc/51/21/56/1062512156.db2.gz CDKRMQBGFJFTMA-UHFFFAOYSA-N 1 2 317.379 4.146 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](CCOCc1ccccc1)C1CC1 ZINC001459939387 1062512178 /nfs/dbraw/zinc/51/21/78/1062512178.db2.gz CDKRMQBGFJFTMA-UHFFFAOYSA-N 1 2 317.379 4.146 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@@H+]1CCCC2(CCCC2)C1 ZINC001459969636 1062535830 /nfs/dbraw/zinc/53/58/30/1062535830.db2.gz OZJVPPCLYSMTBH-INIZCTEOSA-N 1 2 321.848 4.210 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@H+]1CCCC2(CCCC2)C1 ZINC001459969636 1062535849 /nfs/dbraw/zinc/53/58/49/1062535849.db2.gz OZJVPPCLYSMTBH-INIZCTEOSA-N 1 2 321.848 4.210 20 0 DIADLO FC(F)(F)c1cccc([C@@]2(F)CC[N@H+](C/C=C\Cl)C2)c1 ZINC001460003213 1062559354 /nfs/dbraw/zinc/55/93/54/1062559354.db2.gz NWUXPZCXCZJUFS-IUAZIXFQSA-N 1 2 307.718 4.328 20 0 DIADLO FC(F)(F)c1cccc([C@@]2(F)CC[N@@H+](C/C=C\Cl)C2)c1 ZINC001460003213 1062559375 /nfs/dbraw/zinc/55/93/75/1062559375.db2.gz NWUXPZCXCZJUFS-IUAZIXFQSA-N 1 2 307.718 4.328 20 0 DIADLO Clc1ccc2c(c1)CCCN2Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001460002855 1062559784 /nfs/dbraw/zinc/55/97/84/1062559784.db2.gz BUYOODRZXMAREM-UHFFFAOYSA-N 1 2 323.827 4.479 20 0 DIADLO C[C@@H](CSc1ccc(F)cc1)[N@H+](C)CC(=O)c1ccccc1 ZINC001255745800 1062567618 /nfs/dbraw/zinc/56/76/18/1062567618.db2.gz AEKFMZNAYODLCX-AWEZNQCLSA-N 1 2 317.429 4.121 20 0 DIADLO C[C@@H](CSc1ccc(F)cc1)[N@@H+](C)CC(=O)c1ccccc1 ZINC001255745800 1062567635 /nfs/dbraw/zinc/56/76/35/1062567635.db2.gz AEKFMZNAYODLCX-AWEZNQCLSA-N 1 2 317.429 4.121 20 0 DIADLO CCOC(=O)[C@@H](CC)[NH2+][C@@H]1CC(C)(C)CCc2ccccc21 ZINC001460009215 1062569321 /nfs/dbraw/zinc/56/93/21/1062569321.db2.gz WWVUDXXFOGWBQO-IAGOWNOFSA-N 1 2 303.446 4.022 20 0 DIADLO Cc1cn(C)nc1C[N@@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC001460033172 1062586539 /nfs/dbraw/zinc/58/65/39/1062586539.db2.gz WTMDZSHLXQUDAQ-QGZVFWFLSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1cn(C)nc1C[N@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC001460033172 1062586560 /nfs/dbraw/zinc/58/65/60/1062586560.db2.gz WTMDZSHLXQUDAQ-QGZVFWFLSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1cc(NC(=O)N2CCCC(C)(C)c3ccccc32)c(C)c[nH+]1 ZINC001476303726 1062628202 /nfs/dbraw/zinc/62/82/02/1062628202.db2.gz RLGHQZQAALSUGF-UHFFFAOYSA-N 1 2 323.440 4.230 20 0 DIADLO Cc1cc(NC(=O)NC2CCC3(CCCCC3)CC2)c(C)c[nH+]1 ZINC001476303109 1062628364 /nfs/dbraw/zinc/62/83/64/1062628364.db2.gz AGJPCNFEYSKYHB-UHFFFAOYSA-N 1 2 315.461 4.135 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccc(C(C)C)cc2)c(N(C)C)[nH+]1 ZINC001476315992 1062632701 /nfs/dbraw/zinc/63/27/01/1062632701.db2.gz ILQDZVXJDNGOMM-UHFFFAOYSA-N 1 2 312.417 4.223 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1c(F)cncc1F)C(C)(C)C2 ZINC001460144481 1062661600 /nfs/dbraw/zinc/66/16/00/1062661600.db2.gz KCDYOJLQSDMEQY-UHFFFAOYSA-N 1 2 302.368 4.005 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1c(F)cncc1F)C(C)(C)C2 ZINC001460144481 1062661615 /nfs/dbraw/zinc/66/16/15/1062661615.db2.gz KCDYOJLQSDMEQY-UHFFFAOYSA-N 1 2 302.368 4.005 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@@H+]1CCC[C@@](C)(F)C1 ZINC001460145524 1062662796 /nfs/dbraw/zinc/66/27/96/1062662796.db2.gz QROPPGKICAUGRK-BXUZGUMPSA-N 1 2 300.215 4.334 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@H+]1CCC[C@@](C)(F)C1 ZINC001460145524 1062662805 /nfs/dbraw/zinc/66/28/05/1062662805.db2.gz QROPPGKICAUGRK-BXUZGUMPSA-N 1 2 300.215 4.334 20 0 DIADLO CC(C)C[C@@H](C(=O)NC[C@]1(C)CC[C@H](C)C1(C)C)n1cc[nH+]c1 ZINC001469941723 1062666866 /nfs/dbraw/zinc/66/68/66/1062666866.db2.gz VCHBMFUGBUMSON-BXWFABGCSA-N 1 2 319.493 4.049 20 0 DIADLO Cc1ccc(F)cc1C[N@@H+]1CCc2c(Cl)cc(F)cc2C1 ZINC001460176712 1062681322 /nfs/dbraw/zinc/68/13/22/1062681322.db2.gz HSBHVZWBDOIDNM-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO Cc1ccc(F)cc1C[N@H+]1CCc2c(Cl)cc(F)cc2C1 ZINC001460176712 1062681331 /nfs/dbraw/zinc/68/13/31/1062681331.db2.gz HSBHVZWBDOIDNM-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2CCC[C@@H](C(C)C)C2)c(C)[nH+]1 ZINC001476697591 1062702996 /nfs/dbraw/zinc/70/29/96/1062702996.db2.gz BNQJFZVICJFCPW-CVEARBPZSA-N 1 2 303.450 4.343 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2cccc(C(F)F)c2)c(C)[nH+]1 ZINC001476697605 1062703337 /nfs/dbraw/zinc/70/33/37/1062703337.db2.gz BWPZDMRWBIQHDB-UHFFFAOYSA-N 1 2 319.355 4.266 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2c(C)cc(C)[nH+]c2C)c(C)c1 ZINC001476697571 1062705113 /nfs/dbraw/zinc/70/51/13/1062705113.db2.gz ASHJDYZYKMWOPX-UHFFFAOYSA-N 1 2 311.429 4.254 20 0 DIADLO CCCCC[C@H]1CCCCN1C(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001470393932 1062769439 /nfs/dbraw/zinc/76/94/39/1062769439.db2.gz JFRLDYUEPUNKNJ-ZWKOTPCHSA-N 1 2 319.493 4.432 20 0 DIADLO CCCCC[C@@H]1CCCCN1C(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001470393929 1062770465 /nfs/dbraw/zinc/77/04/65/1062770465.db2.gz JFRLDYUEPUNKNJ-MSOLQXFVSA-N 1 2 319.493 4.432 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1cccc(C(F)F)c1 ZINC001460334723 1062788134 /nfs/dbraw/zinc/78/81/34/1062788134.db2.gz QOGFOIQAOWADQJ-AWEZNQCLSA-N 1 2 313.388 4.176 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC001460334723 1062788146 /nfs/dbraw/zinc/78/81/46/1062788146.db2.gz QOGFOIQAOWADQJ-AWEZNQCLSA-N 1 2 313.388 4.176 20 0 DIADLO CCc1ncc(C[N@@H+]2CCc3oc(-c4ccccc4)cc3C2)o1 ZINC001460355410 1062803562 /nfs/dbraw/zinc/80/35/62/1062803562.db2.gz COJFWEBENQVRFC-UHFFFAOYSA-N 1 2 308.381 4.055 20 0 DIADLO CCc1ncc(C[N@H+]2CCc3oc(-c4ccccc4)cc3C2)o1 ZINC001460355410 1062803584 /nfs/dbraw/zinc/80/35/84/1062803584.db2.gz COJFWEBENQVRFC-UHFFFAOYSA-N 1 2 308.381 4.055 20 0 DIADLO CCCCOCC[N@@H+]1CCc2ccc(Cl)c(Cl)c2C1 ZINC001460365487 1062812661 /nfs/dbraw/zinc/81/26/61/1062812661.db2.gz RBGYITKYNVUXAK-UHFFFAOYSA-N 1 2 302.245 4.168 20 0 DIADLO CCCCOCC[N@H+]1CCc2ccc(Cl)c(Cl)c2C1 ZINC001460365487 1062812690 /nfs/dbraw/zinc/81/26/90/1062812690.db2.gz RBGYITKYNVUXAK-UHFFFAOYSA-N 1 2 302.245 4.168 20 0 DIADLO COc1ccc2c(c1)CC[N@H+]([C@H](C)c1ccc(F)cc1F)C2 ZINC001460441214 1062857300 /nfs/dbraw/zinc/85/73/00/1062857300.db2.gz FHIMZGHGHNOMKW-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc2c(c1)CC[N@@H+]([C@H](C)c1ccc(F)cc1F)C2 ZINC001460441214 1062857329 /nfs/dbraw/zinc/85/73/29/1062857329.db2.gz FHIMZGHGHNOMKW-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC001460470293 1062868972 /nfs/dbraw/zinc/86/89/72/1062868972.db2.gz VKUCBLZIDBTRJQ-JRPNMDOOSA-N 1 2 303.780 4.146 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC001460470293 1062868989 /nfs/dbraw/zinc/86/89/89/1062868989.db2.gz VKUCBLZIDBTRJQ-JRPNMDOOSA-N 1 2 303.780 4.146 20 0 DIADLO Cc1ccc(N2CC[NH+](Cc3ccsc3Cl)CC2)c(C)c1 ZINC001460485810 1062876494 /nfs/dbraw/zinc/87/64/94/1062876494.db2.gz KVWYLQYZPLPSTB-UHFFFAOYSA-N 1 2 320.889 4.341 20 0 DIADLO CC(C)(C)OC(=O)[C@]1(C)CCC[N@@H+]1Cc1ccc(Cl)cc1 ZINC001460500207 1062884974 /nfs/dbraw/zinc/88/49/74/1062884974.db2.gz JBYCUNRUVJGRAV-KRWDZBQOSA-N 1 2 309.837 4.036 20 0 DIADLO CC(C)(C)OC(=O)[C@]1(C)CCC[N@H+]1Cc1ccc(Cl)cc1 ZINC001460500207 1062884992 /nfs/dbraw/zinc/88/49/92/1062884992.db2.gz JBYCUNRUVJGRAV-KRWDZBQOSA-N 1 2 309.837 4.036 20 0 DIADLO CC(C)(C)[C@@H]1CSCC[N@@H+]1Cc1nc(Cl)ccc1Cl ZINC001460687056 1062987639 /nfs/dbraw/zinc/98/76/39/1062987639.db2.gz CPNBABKCORAMPV-LBPRGKRZSA-N 1 2 319.301 4.352 20 0 DIADLO CC(C)(C)[C@@H]1CSCC[N@H+]1Cc1nc(Cl)ccc1Cl ZINC001460687056 1062987659 /nfs/dbraw/zinc/98/76/59/1062987659.db2.gz CPNBABKCORAMPV-LBPRGKRZSA-N 1 2 319.301 4.352 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC001460730123 1063023303 /nfs/dbraw/zinc/02/33/03/1063023303.db2.gz NVARAESVFDZFNV-ISTVAULSSA-N 1 2 323.305 4.068 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC001460730123 1063023321 /nfs/dbraw/zinc/02/33/21/1063023321.db2.gz NVARAESVFDZFNV-ISTVAULSSA-N 1 2 323.305 4.068 20 0 DIADLO FC(F)[C@H]1C[N@H+](Cc2ccc(C3CCCCC3)cc2)CCO1 ZINC001460749018 1063034638 /nfs/dbraw/zinc/03/46/38/1063034638.db2.gz ZZRSVGMBADINKD-QGZVFWFLSA-N 1 2 309.400 4.200 20 0 DIADLO FC(F)[C@H]1C[N@@H+](Cc2ccc(C3CCCCC3)cc2)CCO1 ZINC001460749018 1063034644 /nfs/dbraw/zinc/03/46/44/1063034644.db2.gz ZZRSVGMBADINKD-QGZVFWFLSA-N 1 2 309.400 4.200 20 0 DIADLO CC(C)C[C@@H](C)CC(=O)N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC001472532984 1063096154 /nfs/dbraw/zinc/09/61/54/1063096154.db2.gz OFAWVQZYURTMBZ-HZPDHXFCSA-N 1 2 313.445 4.122 20 0 DIADLO c1cn(-c2ccccc2-c2nnc(CC3CCCCC3)o2)c[nH+]1 ZINC001257076017 1063103432 /nfs/dbraw/zinc/10/34/32/1063103432.db2.gz CWWUOVNQTZKAOX-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO Clc1ccc(CNc2nc3ccccc3n3c[nH+]cc23)s1 ZINC001472648272 1063119972 /nfs/dbraw/zinc/11/99/72/1063119972.db2.gz DJBLPJYXXCEDEI-UHFFFAOYSA-N 1 2 314.801 4.210 20 0 DIADLO Cc1nc(N(C)Cc2cccc3ccccc32)c2c([nH+]1)CCCC2 ZINC001472661633 1063128953 /nfs/dbraw/zinc/12/89/53/1063128953.db2.gz HBVCPMWKUNMUDS-UHFFFAOYSA-N 1 2 317.436 4.453 20 0 DIADLO COc1ccc2cc(CC[C@@H](C)[NH2+][C@@H]3CC3(F)F)ccc2c1 ZINC001257267921 1063170121 /nfs/dbraw/zinc/17/01/21/1063170121.db2.gz CRPWQQWCEQPAKN-SJKOYZFVSA-N 1 2 305.368 4.167 20 0 DIADLO Cc1ccccc1CC(C)(C)Nc1nc(C)[nH+]c2c1CCCC2 ZINC001472720659 1063179336 /nfs/dbraw/zinc/17/93/36/1063179336.db2.gz SQSGBUJUIBUKLE-UHFFFAOYSA-N 1 2 309.457 4.405 20 0 DIADLO Cc1cc(CNC(=O)c2cc(F)ccc2-c2ccoc2)cc(C)[nH+]1 ZINC001461005172 1063180348 /nfs/dbraw/zinc/18/03/48/1063180348.db2.gz CDIJHGJZKKIOTJ-UHFFFAOYSA-N 1 2 324.355 4.028 20 0 DIADLO Cc1ccc(CNc2cc[nH+]c(C)n2)c(Oc2ccccc2)c1 ZINC001472724303 1063185151 /nfs/dbraw/zinc/18/51/51/1063185151.db2.gz YTQVLXJQCFHSHN-UHFFFAOYSA-N 1 2 305.381 4.498 20 0 DIADLO CCc1cc(NCCc2csc(C(C)(C)C)n2)nc(CC)[nH+]1 ZINC001472746891 1063202568 /nfs/dbraw/zinc/20/25/68/1063202568.db2.gz HASKMVSKQLCRSV-UHFFFAOYSA-N 1 2 318.490 4.010 20 0 DIADLO Cc1csc([C@H](C)CNc2cc(C)[nH+]c(C3CCC3)n2)n1 ZINC001472754392 1063207314 /nfs/dbraw/zinc/20/73/14/1063207314.db2.gz QBTOCDMTQVIQLX-SNVBAGLBSA-N 1 2 302.447 4.033 20 0 DIADLO CCCC(CCC)[NH2+][C@H](c1nnc(C)o1)c1ccccc1OC ZINC001257332985 1063214387 /nfs/dbraw/zinc/21/43/87/1063214387.db2.gz CBAQBEVETAZSRB-KRWDZBQOSA-N 1 2 317.433 4.034 20 0 DIADLO CCOc1cccc(F)c1C[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC001461063647 1063229349 /nfs/dbraw/zinc/22/93/49/1063229349.db2.gz JWOICYSDKBMOGJ-JSGCOSHPSA-N 1 2 303.377 4.231 20 0 DIADLO Clc1ccc(CNc2ccc(N3CCCCC3)c[nH+]2)cc1 ZINC001461079919 1063239424 /nfs/dbraw/zinc/23/94/24/1063239424.db2.gz UTNVHUMETDLOIM-UHFFFAOYSA-N 1 2 301.821 4.337 20 0 DIADLO CCCCCC[C@H](C)[N@H+]1Cc2nnc(C(F)(F)F)n2[C@@H](C)C1 ZINC001257373988 1063241114 /nfs/dbraw/zinc/24/11/14/1063241114.db2.gz XVKDIRVIUJHBBH-RYUDHWBXSA-N 1 2 318.387 4.032 20 0 DIADLO CCCCCC[C@H](C)[N@@H+]1Cc2nnc(C(F)(F)F)n2[C@@H](C)C1 ZINC001257373988 1063241136 /nfs/dbraw/zinc/24/11/36/1063241136.db2.gz XVKDIRVIUJHBBH-RYUDHWBXSA-N 1 2 318.387 4.032 20 0 DIADLO CCc1cc(N2CCC[C@@]2(C)Cc2ccc(F)cc2)nc(C)[nH+]1 ZINC001472811040 1063257498 /nfs/dbraw/zinc/25/74/98/1063257498.db2.gz HFEZKNQCSOBNBG-IBGZPJMESA-N 1 2 313.420 4.088 20 0 DIADLO Cc1c[nH+]c(CCNc2nc(-c3ccccc3C)ns2)c(C)c1 ZINC001472818982 1063261641 /nfs/dbraw/zinc/26/16/41/1063261641.db2.gz ICKSGQVUUPQILX-UHFFFAOYSA-N 1 2 324.453 4.180 20 0 DIADLO CC(C)c1cc(NCCC2SCCS2)nc(C(C)C)[nH+]1 ZINC001472840404 1063278589 /nfs/dbraw/zinc/27/85/89/1063278589.db2.gz LJVNVMGFDJEJQN-UHFFFAOYSA-N 1 2 311.520 4.332 20 0 DIADLO Cc1cc(C)c(CNC(=O)N(CCC(C)C)CCC(C)C)c[nH+]1 ZINC001478814530 1063297283 /nfs/dbraw/zinc/29/72/83/1063297283.db2.gz SUMWERLFUGSCCH-UHFFFAOYSA-N 1 2 319.493 4.302 20 0 DIADLO Cc1cc(C)c(CNC(=O)N2CC[C@H](C(C)(C)C)C[C@H]2C)c[nH+]1 ZINC001478814048 1063297563 /nfs/dbraw/zinc/29/75/63/1063297563.db2.gz IPENVQIQUMJECF-WBVHZDCISA-N 1 2 317.477 4.055 20 0 DIADLO CCC[C@@H](C)CC[C@@H](C)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001257483877 1063305194 /nfs/dbraw/zinc/30/51/94/1063305194.db2.gz YOCRQLSOTABRTB-CHWSQXEVSA-N 1 2 317.399 4.322 20 0 DIADLO CCC[C@@H](C)CC[C@@H](C)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001257483877 1063305213 /nfs/dbraw/zinc/30/52/13/1063305213.db2.gz YOCRQLSOTABRTB-CHWSQXEVSA-N 1 2 317.399 4.322 20 0 DIADLO CC(C)c1cc(NC2([C@@H]3CCCO3)CCC2)nc(C(C)C)[nH+]1 ZINC001472901951 1063309204 /nfs/dbraw/zinc/30/92/04/1063309204.db2.gz BHXXPLHCAOHATJ-HNNXBMFYSA-N 1 2 303.450 4.237 20 0 DIADLO CC(C)c1cc(N(C)C[C@]23CCC[C@H]2OCC3)nc(C(C)C)[nH+]1 ZINC001472902588 1063309553 /nfs/dbraw/zinc/30/95/53/1063309553.db2.gz QEKOFFHHYAWQFO-VQIMIIECSA-N 1 2 317.477 4.119 20 0 DIADLO Cc1cnc(C[NH2+]Cc2cc3cccc(C)c3nc2Cl)s1 ZINC001461214776 1063338033 /nfs/dbraw/zinc/33/80/33/1063338033.db2.gz GCUUNPFYZRASOE-UHFFFAOYSA-N 1 2 317.845 4.251 20 0 DIADLO Cc1[nH]c(CNc2cccc(CSc3ccccn3)c2)[nH+]c1C ZINC001461295303 1063398720 /nfs/dbraw/zinc/39/87/20/1063398720.db2.gz NNRQAUHMJCUPTD-UHFFFAOYSA-N 1 2 324.453 4.326 20 0 DIADLO C[C@@H]1CCCC[C@@H]1CNc1ccccc1OCCn1cc[nH+]c1 ZINC001461324783 1063419382 /nfs/dbraw/zinc/41/93/82/1063419382.db2.gz PESQMQJKGUJFSH-IAGOWNOFSA-N 1 2 313.445 4.200 20 0 DIADLO FC(F)(F)CCc1cccc(NCc2cccc3[nH+]ccn32)c1 ZINC001461346024 1063433010 /nfs/dbraw/zinc/43/30/10/1063433010.db2.gz ORUIEMSPXHNGKK-UHFFFAOYSA-N 1 2 319.330 4.441 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1ccc(-c2ncco2)cc1F ZINC001473142275 1063448981 /nfs/dbraw/zinc/44/89/81/1063448981.db2.gz FXKXZNAXJWCKEK-UHFFFAOYSA-N 1 2 300.333 4.096 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1ccc(-c2ncco2)cc1F ZINC001473142275 1063448992 /nfs/dbraw/zinc/44/89/92/1063448992.db2.gz FXKXZNAXJWCKEK-UHFFFAOYSA-N 1 2 300.333 4.096 20 0 DIADLO CCOc1cc(CNc2ccc(C)[nH+]c2C)cc(Cl)c1OC ZINC001461367484 1063449143 /nfs/dbraw/zinc/44/91/43/1063449143.db2.gz UUPXGPCAXKHFNQ-UHFFFAOYSA-N 1 2 320.820 4.371 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](CC[C@@H]3C[C@H]3C3CC3)CCO2)cc1Cl ZINC001473144969 1063449778 /nfs/dbraw/zinc/44/97/78/1063449778.db2.gz NUVCGYWPVGTQPH-XUWXXGDYSA-N 1 2 323.839 4.289 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](CC[C@@H]3C[C@H]3C3CC3)CCO2)cc1Cl ZINC001473144969 1063449783 /nfs/dbraw/zinc/44/97/83/1063449783.db2.gz NUVCGYWPVGTQPH-XUWXXGDYSA-N 1 2 323.839 4.289 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@@H+]1Cc2ccc(C(=O)OC)cc2C1 ZINC001473153351 1063456701 /nfs/dbraw/zinc/45/67/01/1063456701.db2.gz CMYLXYSEASMUOV-SFHVURJKSA-N 1 2 313.372 4.079 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@H+]1Cc2ccc(C(=O)OC)cc2C1 ZINC001473153351 1063456709 /nfs/dbraw/zinc/45/67/09/1063456709.db2.gz CMYLXYSEASMUOV-SFHVURJKSA-N 1 2 313.372 4.079 20 0 DIADLO Oc1ccc(Cl)c(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC001473168983 1063472106 /nfs/dbraw/zinc/47/21/06/1063472106.db2.gz UJFXBHHXXSQAOP-QGZVFWFLSA-N 1 2 319.857 4.336 20 0 DIADLO Oc1ccc(Cl)c(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC001473168983 1063472130 /nfs/dbraw/zinc/47/21/30/1063472130.db2.gz UJFXBHHXXSQAOP-QGZVFWFLSA-N 1 2 319.857 4.336 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc(OC(C)C)cc3F)n2c1 ZINC001461406457 1063477018 /nfs/dbraw/zinc/47/70/18/1063477018.db2.gz PTFFALLQLBDXAJ-UHFFFAOYSA-N 1 2 313.376 4.181 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2c(F)cncc2F)o1 ZINC001473183215 1063490941 /nfs/dbraw/zinc/49/09/41/1063490941.db2.gz UJNWEQAZRKTXAA-INIZCTEOSA-N 1 2 306.356 4.379 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2c(F)cncc2F)o1 ZINC001473183215 1063490953 /nfs/dbraw/zinc/49/09/53/1063490953.db2.gz UJNWEQAZRKTXAA-INIZCTEOSA-N 1 2 306.356 4.379 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2cc(Br)cc(F)c2F)[C@H]1C ZINC001473185499 1063494500 /nfs/dbraw/zinc/49/45/00/1063494500.db2.gz JFRBXOTVJIEJJZ-UWVGGRQHSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2cc(Br)cc(F)c2F)[C@H]1C ZINC001473185499 1063494509 /nfs/dbraw/zinc/49/45/09/1063494509.db2.gz JFRBXOTVJIEJJZ-UWVGGRQHSA-N 1 2 318.205 4.348 20 0 DIADLO CCOC(=O)[C@H](Cc1ccc(F)cc1)[NH2+][C@@H](C)CCC=C(C)C ZINC001258082999 1063504770 /nfs/dbraw/zinc/50/47/70/1063504770.db2.gz HFDIUSVKLFHWNI-YJBOKZPZSA-N 1 2 321.436 4.024 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(F)c2ccccc21 ZINC001461554763 1063579498 /nfs/dbraw/zinc/57/94/98/1063579498.db2.gz UIBCTPVNQBYAIN-LLVKDONJSA-N 1 2 317.795 4.217 20 0 DIADLO Cc1cc(CNc2cc3cc[nH]c3c[nH+]2)cc(C)c1OC(F)F ZINC001461607675 1063609456 /nfs/dbraw/zinc/60/94/56/1063609456.db2.gz MBASFROCUXCDJL-UHFFFAOYSA-N 1 2 317.339 4.393 20 0 DIADLO Fc1cccc(C(F)(F)C[NH2+]Cc2cccc3cnccc32)c1 ZINC001461619809 1063616912 /nfs/dbraw/zinc/61/69/12/1063616912.db2.gz VGXRFTJJECYBAV-UHFFFAOYSA-N 1 2 316.326 4.256 20 0 DIADLO CC(C)Cc1ncc(C[NH2+][C@H]2c3ccccc3CC[C@H]2F)s1 ZINC001461707755 1063671880 /nfs/dbraw/zinc/67/18/80/1063671880.db2.gz COGYEEMQFZSEOW-AEFFLSMTSA-N 1 2 318.461 4.457 20 0 DIADLO Cc1cc(F)c(CNc2[nH]c3ccc(Cl)cc3[nH+]2)c(F)c1 ZINC001461733611 1063685815 /nfs/dbraw/zinc/68/58/15/1063685815.db2.gz NSRZEXOPEPEFMO-UHFFFAOYSA-N 1 2 307.731 4.415 20 0 DIADLO Cc1cc(F)c(CNc2[nH]c3cc(Cl)ccc3[nH+]2)c(F)c1 ZINC001461733611 1063685825 /nfs/dbraw/zinc/68/58/25/1063685825.db2.gz NSRZEXOPEPEFMO-UHFFFAOYSA-N 1 2 307.731 4.415 20 0 DIADLO Cc1cc(C)c2cc(NCc3cc(C(F)(F)F)n[nH]3)ccc2[nH+]1 ZINC001461753703 1063697975 /nfs/dbraw/zinc/69/79/75/1063697975.db2.gz WHQNOHCYVMWRGZ-UHFFFAOYSA-N 1 2 320.318 4.206 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3cccc4c3OC(C)(C)CC4)n2c1 ZINC001461769763 1063707424 /nfs/dbraw/zinc/70/74/24/1063707424.db2.gz YQZWDVPNXPJLOR-UHFFFAOYSA-N 1 2 321.424 4.358 20 0 DIADLO CCCCC[C@@H](CCC)[N@@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001258668869 1063738896 /nfs/dbraw/zinc/73/88/96/1063738896.db2.gz FXROTSOHLAREQP-HZPDHXFCSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCC[C@@H](CCC)[N@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001258668869 1063738904 /nfs/dbraw/zinc/73/89/04/1063738904.db2.gz FXROTSOHLAREQP-HZPDHXFCSA-N 1 2 307.482 4.155 20 0 DIADLO Fc1ccc(C[N@@H+]2CCc3ccccc3C2)c(C(F)(F)F)c1 ZINC001461848048 1063749982 /nfs/dbraw/zinc/74/99/82/1063749982.db2.gz YQZXDESUZIITTO-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Fc1ccc(C[N@H+]2CCc3ccccc3C2)c(C(F)(F)F)c1 ZINC001461848048 1063749996 /nfs/dbraw/zinc/74/99/96/1063749996.db2.gz YQZXDESUZIITTO-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO CCCCC[C@@H]1CCC[N@@H+]1Cc1nc(Br)cs1 ZINC001461865387 1063759487 /nfs/dbraw/zinc/75/94/87/1063759487.db2.gz UJSXNZGCRIJPEJ-LLVKDONJSA-N 1 2 317.296 4.450 20 0 DIADLO CCCCC[C@@H]1CCC[N@H+]1Cc1nc(Br)cs1 ZINC001461865387 1063759504 /nfs/dbraw/zinc/75/95/04/1063759504.db2.gz UJSXNZGCRIJPEJ-LLVKDONJSA-N 1 2 317.296 4.450 20 0 DIADLO C[C@H](Cc1cccc(Cl)c1)[NH2+]CC(F)(F)c1ccccn1 ZINC001258740854 1063791117 /nfs/dbraw/zinc/79/11/17/1063791117.db2.gz CAXGIDSNEFXTLB-GFCCVEGCSA-N 1 2 310.775 4.048 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2[C@@H](C)Cc2cccc(Cl)c2)no1 ZINC001258750159 1063798394 /nfs/dbraw/zinc/79/83/94/1063798394.db2.gz PYHGDCALJYBRTG-LRDDRELGSA-N 1 2 319.836 4.190 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2[C@@H](C)Cc2cccc(Cl)c2)no1 ZINC001258750159 1063798406 /nfs/dbraw/zinc/79/84/06/1063798406.db2.gz PYHGDCALJYBRTG-LRDDRELGSA-N 1 2 319.836 4.190 20 0 DIADLO CCCC[C@@H](CCC)[N@@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001258761477 1063807241 /nfs/dbraw/zinc/80/72/41/1063807241.db2.gz MDDWOWLMALMGFU-JKSUJKDBSA-N 1 2 307.482 4.155 20 0 DIADLO CCCC[C@@H](CCC)[N@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001258761477 1063807255 /nfs/dbraw/zinc/80/72/55/1063807255.db2.gz MDDWOWLMALMGFU-JKSUJKDBSA-N 1 2 307.482 4.155 20 0 DIADLO CC[C@@H](C)C[C@@H](CC)[N@@H+]1Cc2cc(Br)cnc2C1 ZINC001258798442 1063834084 /nfs/dbraw/zinc/83/40/84/1063834084.db2.gz UBSQEKSRHRSBEO-BXUZGUMPSA-N 1 2 311.267 4.375 20 0 DIADLO CC[C@@H](C)C[C@@H](CC)[N@H+]1Cc2cc(Br)cnc2C1 ZINC001258798442 1063834096 /nfs/dbraw/zinc/83/40/96/1063834096.db2.gz UBSQEKSRHRSBEO-BXUZGUMPSA-N 1 2 311.267 4.375 20 0 DIADLO CCC[N@H+](Cc1cnc(C2CC2)nc1)Cc1ccc(F)cc1F ZINC001461969592 1063847674 /nfs/dbraw/zinc/84/76/74/1063847674.db2.gz JTEXLNYAKGAASB-UHFFFAOYSA-N 1 2 317.383 4.044 20 0 DIADLO CCC[N@@H+](Cc1cnc(C2CC2)nc1)Cc1ccc(F)cc1F ZINC001461969592 1063847686 /nfs/dbraw/zinc/84/76/86/1063847686.db2.gz JTEXLNYAKGAASB-UHFFFAOYSA-N 1 2 317.383 4.044 20 0 DIADLO COc1nc2ccccc2cc1C[N@H+](Cc1ccc(C)o1)C1CC1 ZINC001462018053 1063881061 /nfs/dbraw/zinc/88/10/61/1063881061.db2.gz IXLHMEWCXBUURY-UHFFFAOYSA-N 1 2 322.408 4.309 20 0 DIADLO COc1nc2ccccc2cc1C[N@@H+](Cc1ccc(C)o1)C1CC1 ZINC001462018053 1063881075 /nfs/dbraw/zinc/88/10/75/1063881075.db2.gz IXLHMEWCXBUURY-UHFFFAOYSA-N 1 2 322.408 4.309 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC001462021249 1063884220 /nfs/dbraw/zinc/88/42/20/1063884220.db2.gz WTEVMWHDCSOCSZ-BLLLJJGKSA-N 1 2 301.386 4.169 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC001462021249 1063884237 /nfs/dbraw/zinc/88/42/37/1063884237.db2.gz WTEVMWHDCSOCSZ-BLLLJJGKSA-N 1 2 301.386 4.169 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)o1 ZINC001462021252 1063884705 /nfs/dbraw/zinc/88/47/05/1063884705.db2.gz WTEVMWHDCSOCSZ-WBMJQRKESA-N 1 2 301.386 4.169 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)o1 ZINC001462021252 1063884714 /nfs/dbraw/zinc/88/47/14/1063884714.db2.gz WTEVMWHDCSOCSZ-WBMJQRKESA-N 1 2 301.386 4.169 20 0 DIADLO COc1ccc([C@@H](C)SCc2cc[nH+]c(N(C)C)c2)cc1 ZINC001307292637 1063891877 /nfs/dbraw/zinc/89/18/77/1063891877.db2.gz IERHLFIWQQVPTM-CYBMUJFWSA-N 1 2 302.443 4.151 20 0 DIADLO C[C@@H](C[N@@H+]1CCc2cc(Br)ccc2C1)C(F)(F)F ZINC000484004442 1063897806 /nfs/dbraw/zinc/89/78/06/1063897806.db2.gz AKVCRYBKNHZHKV-VIFPVBQESA-N 1 2 322.168 4.006 20 0 DIADLO C[C@@H](C[N@H+]1CCc2cc(Br)ccc2C1)C(F)(F)F ZINC000484004442 1063897815 /nfs/dbraw/zinc/89/78/15/1063897815.db2.gz AKVCRYBKNHZHKV-VIFPVBQESA-N 1 2 322.168 4.006 20 0 DIADLO C[C@H]1C[C@@H]([N@@H+]2CCC[C@H]2c2ncc[nH]2)c2ccsc2S1 ZINC001462061672 1063909576 /nfs/dbraw/zinc/90/95/76/1063909576.db2.gz QTFCFCBAPKCASM-WCFLWFBJSA-N 1 2 305.472 4.234 20 0 DIADLO C[C@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ncc[nH]2)c2ccsc2S1 ZINC001462061672 1063909580 /nfs/dbraw/zinc/90/95/80/1063909580.db2.gz QTFCFCBAPKCASM-WCFLWFBJSA-N 1 2 305.472 4.234 20 0 DIADLO Fc1ccc2c(c1)CC[N@@H+](Cc1cccc(OC3CC3)c1F)C2 ZINC001462077081 1063918047 /nfs/dbraw/zinc/91/80/47/1063918047.db2.gz SMHQPDRHLOBNBN-UHFFFAOYSA-N 1 2 315.363 4.064 20 0 DIADLO Fc1ccc2c(c1)CC[N@H+](Cc1cccc(OC3CC3)c1F)C2 ZINC001462077081 1063918052 /nfs/dbraw/zinc/91/80/52/1063918052.db2.gz SMHQPDRHLOBNBN-UHFFFAOYSA-N 1 2 315.363 4.064 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2c(C)cc(Cl)cc2C)c[nH+]1 ZINC001261285135 1063918849 /nfs/dbraw/zinc/91/88/49/1063918849.db2.gz RURDXGZGPDXEAV-UHFFFAOYSA-N 1 2 317.820 4.290 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccc(Cl)c(F)c1 ZINC001262013764 1063953175 /nfs/dbraw/zinc/95/31/75/1063953175.db2.gz MBDHLIXHKIBXCK-SNVBAGLBSA-N 1 2 308.784 4.197 20 0 DIADLO O=c1[nH]c2ccc(CNc3cc[nH+]c4c(Cl)cccc34)cc2[nH]1 ZINC001262672966 1063970579 /nfs/dbraw/zinc/97/05/79/1063970579.db2.gz SYPKXWOEZAKZPU-UHFFFAOYSA-N 1 2 324.771 4.082 20 0 DIADLO COc1cc2[nH+]c(CCc3ccccc3F)[nH]c2cc1Cl ZINC000587148642 1063996108 /nfs/dbraw/zinc/99/61/08/1063996108.db2.gz CVUCRLCHYHHDME-UHFFFAOYSA-N 1 2 304.752 4.149 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001264340260 1064079497 /nfs/dbraw/zinc/07/94/97/1064079497.db2.gz NXTVIVADEYXQKT-GVDBMIGSSA-N 1 2 323.440 4.417 20 0 DIADLO Brc1sccc1C[NH+]1CC2(C1)CCCCC2 ZINC000388541785 1064111469 /nfs/dbraw/zinc/11/14/69/1064111469.db2.gz XREDPCDUIFTRHO-UHFFFAOYSA-N 1 2 300.265 4.277 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccccc3C3CCC3)ccc2[nH+]1 ZINC001264857996 1064151344 /nfs/dbraw/zinc/15/13/44/1064151344.db2.gz PLPSJJXBTWPAMO-UHFFFAOYSA-N 1 2 305.381 4.163 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1ccc(Br)c(F)c1F ZINC000701283709 1064245247 /nfs/dbraw/zinc/24/52/47/1064245247.db2.gz SFNMCKRQGDUOOZ-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1ccc(Br)c(F)c1F ZINC000701283709 1064245252 /nfs/dbraw/zinc/24/52/52/1064245252.db2.gz SFNMCKRQGDUOOZ-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO Fc1cc(Br)ccc1C[N@@H+]1CCCC(F)(F)CC1 ZINC000702827084 1064322938 /nfs/dbraw/zinc/32/29/38/1064322938.db2.gz JPGGBAAZPGKOPK-UHFFFAOYSA-N 1 2 322.168 4.209 20 0 DIADLO Fc1cc(Br)ccc1C[N@H+]1CCCC(F)(F)CC1 ZINC000702827084 1064322953 /nfs/dbraw/zinc/32/29/53/1064322953.db2.gz JPGGBAAZPGKOPK-UHFFFAOYSA-N 1 2 322.168 4.209 20 0 DIADLO Cc1nnsc1[C@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC001332854354 1064415619 /nfs/dbraw/zinc/41/56/19/1064415619.db2.gz QXCXKILUGGLLMF-WCBMZHEXSA-N 1 2 310.492 4.012 20 0 DIADLO CC1(C)CCCC[C@@H]1CC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC001290763834 1064710190 /nfs/dbraw/zinc/71/01/90/1064710190.db2.gz QOJUDYBYYPHKRD-OAHLLOKOSA-N 1 2 311.429 4.417 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3C[C@H]3C3CCCC3)c2)[nH+]c1C ZINC001292074514 1064759164 /nfs/dbraw/zinc/75/91/64/1064759164.db2.gz ZACBLTIZTNAAGI-ZWKOTPCHSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3C[C@@H]3C3CCCC3)c2)[nH+]c1C ZINC001292074509 1064759201 /nfs/dbraw/zinc/75/92/01/1064759201.db2.gz ZACBLTIZTNAAGI-QZTJIDSGSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1cc(NC(=O)c2ccoc2C(C)C)ccc1-n1cc[nH+]c1 ZINC001292865006 1064792232 /nfs/dbraw/zinc/79/22/32/1064792232.db2.gz NDJZUXOPDUNJRQ-UHFFFAOYSA-N 1 2 309.369 4.149 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)Cc3ccc(C(C)(C)C)cc3)cc2[nH+]1 ZINC001294769506 1064884943 /nfs/dbraw/zinc/88/49/43/1064884943.db2.gz WRQQHOBGCBTVAC-UHFFFAOYSA-N 1 2 321.424 4.350 20 0 DIADLO CCc1cc(N2CC[C@@H](c3ccc(C)cc3)C2(C)C)nc(C)[nH+]1 ZINC001307193553 1064912453 /nfs/dbraw/zinc/91/24/53/1064912453.db2.gz FWZZHFUZEWMFJF-SFHVURJKSA-N 1 2 309.457 4.428 20 0 DIADLO Cc1nc(N2CC[C@@H](C)[C@@H]2c2ccccc2)c2c([nH+]1)CCCC2 ZINC001307208048 1064937833 /nfs/dbraw/zinc/93/78/33/1064937833.db2.gz SVGFQIPKTXYBAE-AUUYWEPGSA-N 1 2 307.441 4.251 20 0 DIADLO CC[N@H+](CC(=O)N[C@@H](C)CC(C)(C)C)Cc1ccccc1Cl ZINC001299072344 1065031716 /nfs/dbraw/zinc/03/17/16/1065031716.db2.gz GMBFYLKNYFIJTN-AWEZNQCLSA-N 1 2 324.896 4.103 20 0 DIADLO CC[N@@H+](CC(=O)N[C@@H](C)CC(C)(C)C)Cc1ccccc1Cl ZINC001299072344 1065031723 /nfs/dbraw/zinc/03/17/23/1065031723.db2.gz GMBFYLKNYFIJTN-AWEZNQCLSA-N 1 2 324.896 4.103 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C[C@@H]3CCC[C@@H]3C)cc2)[nH+]c1C ZINC001303121481 1065107763 /nfs/dbraw/zinc/10/77/63/1065107763.db2.gz ADXZPVRPUVRFET-LRDDRELGSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)c2cc3c(cccc3C)o2)[nH+]c1C ZINC001303608657 1065119017 /nfs/dbraw/zinc/11/90/17/1065119017.db2.gz JTSVXDRAQJDFFC-OAHLLOKOSA-N 1 2 323.396 4.058 20 0 DIADLO C/C(=C\c1ccc(C)cc1)C(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001303608612 1065119979 /nfs/dbraw/zinc/11/99/79/1065119979.db2.gz JGTOEPFJAVGUKK-SZEUEKNRSA-N 1 2 323.440 4.102 20 0 DIADLO Cc1nc(NCC2(c3cccc(Cl)c3)CCCC2)cc[nH+]1 ZINC001306942333 1065213988 /nfs/dbraw/zinc/21/39/88/1065213988.db2.gz RTNAJPVEGYIKPN-UHFFFAOYSA-N 1 2 301.821 4.362 20 0 DIADLO COc1ccc(CCCNc2cc(C)[nH+]c(C3CCC3)n2)cc1 ZINC001306941203 1065214251 /nfs/dbraw/zinc/21/42/51/1065214251.db2.gz WCFISCGQLFVMBW-UHFFFAOYSA-N 1 2 311.429 4.106 20 0 DIADLO CCc1cc(N2CC[C@](C)(CCc3ccccc3)C2)nc(CC)[nH+]1 ZINC001306989484 1065238566 /nfs/dbraw/zinc/23/85/66/1065238566.db2.gz MALUGMYUYAPDCL-NRFANRHFSA-N 1 2 323.484 4.451 20 0 DIADLO CC[C@@H]1CN(c2nc(C)[nH+]c(C)c2C)CC[C@@H]1c1ccccc1 ZINC001306989453 1065238797 /nfs/dbraw/zinc/23/87/97/1065238797.db2.gz LFWFSLVMXPDAPT-MJGOQNOKSA-N 1 2 309.457 4.422 20 0 DIADLO C[C@@H](Nc1nc2ccccc2n2c[nH+]cc12)c1cccc(F)c1F ZINC001307074951 1065250307 /nfs/dbraw/zinc/25/03/07/1065250307.db2.gz LRCQFHCRRUACOK-LLVKDONJSA-N 1 2 324.334 4.334 20 0 DIADLO CCc1ccc2c(c1)[C@@H](Nc1nc(C)[nH+]c3c1CCCC3)CCO2 ZINC001307088943 1065256623 /nfs/dbraw/zinc/25/66/23/1065256623.db2.gz HGNQZJGUCGRRGF-SFHVURJKSA-N 1 2 323.440 4.162 20 0 DIADLO CCc1ccc2c(c1)[C@H](Nc1nc(C)[nH+]c3c1CCCC3)CCO2 ZINC001307088941 1065256851 /nfs/dbraw/zinc/25/68/51/1065256851.db2.gz HGNQZJGUCGRRGF-GOSISDBHSA-N 1 2 323.440 4.162 20 0 DIADLO COc1ccc(F)cc1CNc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC001307104145 1065264395 /nfs/dbraw/zinc/26/43/95/1065264395.db2.gz QLBRQGHPMFASEJ-UHFFFAOYSA-N 1 2 317.408 4.483 20 0 DIADLO Cc1nc(N2CC=C(c3cccc(Cl)c3)CC2)c(C)c(C)[nH+]1 ZINC001307108991 1065266402 /nfs/dbraw/zinc/26/64/02/1065266402.db2.gz CSHSKDCVQLKSMZ-UHFFFAOYSA-N 1 2 313.832 4.349 20 0 DIADLO CCc1cc(N2CC3(CCCCC3)[C@H]2C(C)C)nc(CC)[nH+]1 ZINC001307140279 1065281396 /nfs/dbraw/zinc/28/13/96/1065281396.db2.gz XTDBNKMDKFSCBV-GOSISDBHSA-N 1 2 301.478 4.397 20 0 DIADLO FC1(F)CC[C@@H](CCNc2nc3ccccc3n3c[nH+]cc23)C1 ZINC001307229786 1065309841 /nfs/dbraw/zinc/30/98/41/1065309841.db2.gz VYIHZHVYUZFQHC-LBPRGKRZSA-N 1 2 316.355 4.120 20 0 DIADLO c1[nH+]c(SC[C@H]2CCCC23CCOCC3)n2ccccc12 ZINC001307252968 1065314592 /nfs/dbraw/zinc/31/45/92/1065314592.db2.gz IXXDRPONUSWETG-CQSZACIVSA-N 1 2 302.443 4.023 20 0 DIADLO COc1c(C)c[nH+]c(CS[C@H]2CCOc3ccccc32)c1C ZINC001307316915 1065337464 /nfs/dbraw/zinc/33/74/64/1065337464.db2.gz TXQSFBMVMLKEJL-KRWDZBQOSA-N 1 2 315.438 4.464 20 0 DIADLO CC(C)(C)c1cn(CCc2ccccc2Br)c[nH+]1 ZINC001307381731 1065363431 /nfs/dbraw/zinc/36/34/31/1065363431.db2.gz REXPIHICZMRWMB-UHFFFAOYSA-N 1 2 307.235 4.186 20 0 DIADLO Cc1ccnc(SCc2c[nH+]c(N(C)C)c3ccccc23)c1 ZINC001307396126 1065368227 /nfs/dbraw/zinc/36/82/27/1065368227.db2.gz YHAUGZSKSZZBMF-UHFFFAOYSA-N 1 2 309.438 4.297 20 0 DIADLO COc1nscc1C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC001307421690 1065383246 /nfs/dbraw/zinc/38/32/46/1065383246.db2.gz WAQUOUVPBOOFPY-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COc1nscc1C[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC001307421690 1065383251 /nfs/dbraw/zinc/38/32/51/1065383251.db2.gz WAQUOUVPBOOFPY-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COC(=O)C[N@H+](CCC(C)C)Cc1ccc(Cl)c(Cl)c1 ZINC001307424378 1065386315 /nfs/dbraw/zinc/38/63/15/1065386315.db2.gz UVAABYNAPBXSKI-UHFFFAOYSA-N 1 2 318.244 4.015 20 0 DIADLO COC(=O)C[N@@H+](CCC(C)C)Cc1ccc(Cl)c(Cl)c1 ZINC001307424378 1065386324 /nfs/dbraw/zinc/38/63/24/1065386324.db2.gz UVAABYNAPBXSKI-UHFFFAOYSA-N 1 2 318.244 4.015 20 0 DIADLO Fc1ccc(C(F)(F)C[N@@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC001307432871 1065394637 /nfs/dbraw/zinc/39/46/37/1065394637.db2.gz BKDHOBCYJQKHBE-OAHLLOKOSA-N 1 2 305.343 4.407 20 0 DIADLO Fc1ccc(C(F)(F)C[N@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC001307432871 1065394650 /nfs/dbraw/zinc/39/46/50/1065394650.db2.gz BKDHOBCYJQKHBE-OAHLLOKOSA-N 1 2 305.343 4.407 20 0 DIADLO CC(C)[N@H+](Cc1nc2c(o1)CCCC2)Cc1ccc(F)cc1 ZINC001307435315 1065396325 /nfs/dbraw/zinc/39/63/25/1065396325.db2.gz WQPZLHQHDHUPFQ-UHFFFAOYSA-N 1 2 302.393 4.103 20 0 DIADLO CC(C)[N@@H+](Cc1nc2c(o1)CCCC2)Cc1ccc(F)cc1 ZINC001307435315 1065396333 /nfs/dbraw/zinc/39/63/33/1065396333.db2.gz WQPZLHQHDHUPFQ-UHFFFAOYSA-N 1 2 302.393 4.103 20 0 DIADLO Cc1cnc(C[N@@H+]2CCc3cc(C(C)(C)C)ccc3C2)s1 ZINC001307443942 1065404471 /nfs/dbraw/zinc/40/44/71/1065404471.db2.gz INCWBEYIGDJIDK-UHFFFAOYSA-N 1 2 300.471 4.307 20 0 DIADLO Cc1cnc(C[N@H+]2CCc3cc(C(C)(C)C)ccc3C2)s1 ZINC001307443942 1065404475 /nfs/dbraw/zinc/40/44/75/1065404475.db2.gz INCWBEYIGDJIDK-UHFFFAOYSA-N 1 2 300.471 4.307 20 0 DIADLO Cc1ccc(C[N@H+](CC(=O)OCc2ccccc2)C2CC2)cc1C ZINC001307490281 1065434560 /nfs/dbraw/zinc/43/45/60/1065434560.db2.gz NDBMWTXMNBUIDA-UHFFFAOYSA-N 1 2 323.436 4.011 20 0 DIADLO Cc1ccc(C[N@@H+](CC(=O)OCc2ccccc2)C2CC2)cc1C ZINC001307490281 1065434565 /nfs/dbraw/zinc/43/45/65/1065434565.db2.gz NDBMWTXMNBUIDA-UHFFFAOYSA-N 1 2 323.436 4.011 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1noc2c1CC(C)(C)CC2 ZINC001307521714 1065459614 /nfs/dbraw/zinc/45/96/14/1065459614.db2.gz MANURQIAMQBNPV-AWEZNQCLSA-N 1 2 310.441 4.309 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1noc2c1CC(C)(C)CC2 ZINC001307521714 1065459616 /nfs/dbraw/zinc/45/96/16/1065459616.db2.gz MANURQIAMQBNPV-AWEZNQCLSA-N 1 2 310.441 4.309 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CCCCC[C@H]2/C=C/c2ccccc2)[nH]1 ZINC001307582354 1065496400 /nfs/dbraw/zinc/49/64/00/1065496400.db2.gz GPUNNHNXUFDRQD-HHNLSAEISA-N 1 2 324.472 4.386 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CCCCC[C@H]2/C=C/c2ccccc2)[nH]1 ZINC001307582354 1065496408 /nfs/dbraw/zinc/49/64/08/1065496408.db2.gz GPUNNHNXUFDRQD-HHNLSAEISA-N 1 2 324.472 4.386 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2cccc(Cl)c2)c2ccccn2)ccn1 ZINC001307599180 1065507772 /nfs/dbraw/zinc/50/77/72/1065507772.db2.gz GVTGXCIPLNUXEF-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO CCNc1nc(C[NH2+][C@H](CC)c2ccc(F)cc2F)cs1 ZINC001307624103 1065524905 /nfs/dbraw/zinc/52/49/05/1065524905.db2.gz BCZTZOZMXZYTHV-CQSZACIVSA-N 1 2 311.401 4.094 20 0 DIADLO C[C@@H]([NH2+]Cc1nsc2ccccc12)c1ccc(F)cc1F ZINC001307634613 1065530522 /nfs/dbraw/zinc/53/05/22/1065530522.db2.gz DWSNIXIZZJLELY-SNVBAGLBSA-N 1 2 304.365 4.425 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2ccccc2OCc2ccccc2)no1 ZINC001307647570 1065538345 /nfs/dbraw/zinc/53/83/45/1065538345.db2.gz LCNYEYSMSXTDRW-INIZCTEOSA-N 1 2 322.408 4.413 20 0 DIADLO C[N@@H+]1CCN(CCSC2CCCCC2)[C@H](c2ccccc2)C1 ZINC001307654264 1065545155 /nfs/dbraw/zinc/54/51/55/1065545155.db2.gz GGWZWNIVHALFTG-IBGZPJMESA-N 1 2 318.530 4.041 20 0 DIADLO C[N@H+]1CCN(CCSC2CCCCC2)[C@H](c2ccccc2)C1 ZINC001307654264 1065545166 /nfs/dbraw/zinc/54/51/66/1065545166.db2.gz GGWZWNIVHALFTG-IBGZPJMESA-N 1 2 318.530 4.041 20 0 DIADLO CC(C)[C@@H]1CCc2ccccc2N1Cc1cc[nH+]c(N(C)C)c1 ZINC001307654974 1065545476 /nfs/dbraw/zinc/54/54/76/1065545476.db2.gz IRESJUPWXQIQJD-SFHVURJKSA-N 1 2 309.457 4.125 20 0 DIADLO COc1cc(C)[nH+]c(CN2c3ccccc3CC[C@H]2C(C)C)c1 ZINC001307654890 1065545623 /nfs/dbraw/zinc/54/56/23/1065545623.db2.gz HKMUOCUONLNJGT-IBGZPJMESA-N 1 2 310.441 4.376 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCC[N@@H+]2CC2=NOCC2)c1 ZINC001307711325 1065579199 /nfs/dbraw/zinc/57/91/99/1065579199.db2.gz ZBYGOTYJNLSSHW-HNNXBMFYSA-N 1 2 312.335 4.009 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCC[N@H+]2CC2=NOCC2)c1 ZINC001307711325 1065579208 /nfs/dbraw/zinc/57/92/08/1065579208.db2.gz ZBYGOTYJNLSSHW-HNNXBMFYSA-N 1 2 312.335 4.009 20 0 DIADLO COc1ccc2c(c1)OCC[N@H+]([C@@H](C)c1ccc(Cl)cc1)C2 ZINC001307717138 1065583940 /nfs/dbraw/zinc/58/39/40/1065583940.db2.gz ZZHKBBXJOMQQFC-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc2c(c1)OCC[N@@H+]([C@@H](C)c1ccc(Cl)cc1)C2 ZINC001307717138 1065583946 /nfs/dbraw/zinc/58/39/46/1065583946.db2.gz ZZHKBBXJOMQQFC-ZDUSSCGKSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+](C)Cc1cc(C)ccc1F ZINC001307728788 1065589591 /nfs/dbraw/zinc/58/95/91/1065589591.db2.gz VEUPYUJFAMYETJ-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+](C)Cc1cc(C)ccc1F ZINC001307728788 1065589600 /nfs/dbraw/zinc/58/96/00/1065589600.db2.gz VEUPYUJFAMYETJ-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO CCCC[C@H](CC)C[NH2+][C@@](CC)(C(=O)OC)c1ccccc1 ZINC001307759590 1065608842 /nfs/dbraw/zinc/60/88/42/1065608842.db2.gz AGDKVLPHUFIZGK-QFBILLFUSA-N 1 2 305.462 4.271 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1nc3cc(C)ccc3s1)CC2 ZINC001307772698 1065613584 /nfs/dbraw/zinc/61/35/84/1065613584.db2.gz FYLWCQFJQOPCOS-UHFFFAOYSA-N 1 2 324.449 4.172 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1nc3cc(C)ccc3s1)CC2 ZINC001307772698 1065613590 /nfs/dbraw/zinc/61/35/90/1065613590.db2.gz FYLWCQFJQOPCOS-UHFFFAOYSA-N 1 2 324.449 4.172 20 0 DIADLO CO[C@@H](C[N@@H+]1CCn2c(cc3ccccc32)C1)C1CCCCC1 ZINC001307803157 1065629844 /nfs/dbraw/zinc/62/98/44/1065629844.db2.gz ICQYMYIUWDYKRX-FQEVSTJZSA-N 1 2 312.457 4.052 20 0 DIADLO CO[C@@H](C[N@H+]1CCn2c(cc3ccccc32)C1)C1CCCCC1 ZINC001307803157 1065629846 /nfs/dbraw/zinc/62/98/46/1065629846.db2.gz ICQYMYIUWDYKRX-FQEVSTJZSA-N 1 2 312.457 4.052 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](Cc1cc2ccccc2o1)C1CC1 ZINC001307833665 1065643782 /nfs/dbraw/zinc/64/37/82/1065643782.db2.gz PICRJYRFDZBQMQ-ZDUSSCGKSA-N 1 2 315.413 4.127 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](Cc1cc2ccccc2o1)C1CC1 ZINC001307833665 1065643789 /nfs/dbraw/zinc/64/37/89/1065643789.db2.gz PICRJYRFDZBQMQ-ZDUSSCGKSA-N 1 2 315.413 4.127 20 0 DIADLO C[C@@H]1C[N@H+](CCc2cccc(Cl)c2Cl)CC2(CCC2)O1 ZINC001307894622 1065671972 /nfs/dbraw/zinc/67/19/72/1065671972.db2.gz KRGFDLDHFYYBEB-GFCCVEGCSA-N 1 2 314.256 4.179 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)CC2(CCC2)O1 ZINC001307894622 1065671976 /nfs/dbraw/zinc/67/19/76/1065671976.db2.gz KRGFDLDHFYYBEB-GFCCVEGCSA-N 1 2 314.256 4.179 20 0 DIADLO CC(F)(F)CCC[N@@H+]1CCc2sc(Br)cc2C1 ZINC001307933323 1065689017 /nfs/dbraw/zinc/68/90/17/1065689017.db2.gz BVADNPALASDNNE-UHFFFAOYSA-N 1 2 324.234 4.304 20 0 DIADLO CC(F)(F)CCC[N@H+]1CCc2sc(Br)cc2C1 ZINC001307933323 1065689022 /nfs/dbraw/zinc/68/90/22/1065689022.db2.gz BVADNPALASDNNE-UHFFFAOYSA-N 1 2 324.234 4.304 20 0 DIADLO COC/C(C)=C\C[N@@H+]1C[C@@H](c2cccc(Cl)c2)OCC1(C)C ZINC001307935034 1065689149 /nfs/dbraw/zinc/68/91/49/1065689149.db2.gz QLBHWXWJAOUQRA-QHIITQONSA-N 1 2 323.864 4.085 20 0 DIADLO COC/C(C)=C\C[N@H+]1C[C@@H](c2cccc(Cl)c2)OCC1(C)C ZINC001307935034 1065689156 /nfs/dbraw/zinc/68/91/56/1065689156.db2.gz QLBHWXWJAOUQRA-QHIITQONSA-N 1 2 323.864 4.085 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC001307947720 1065695024 /nfs/dbraw/zinc/69/50/24/1065695024.db2.gz SZZGBFIBQKHFOS-MRXNPFEDSA-N 1 2 303.450 4.129 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@H+]1CCC[C@@H](C2CCC2)C1 ZINC001307947720 1065695029 /nfs/dbraw/zinc/69/50/29/1065695029.db2.gz SZZGBFIBQKHFOS-MRXNPFEDSA-N 1 2 303.450 4.129 20 0 DIADLO Fc1ccccc1C[N@@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001307998055 1065717581 /nfs/dbraw/zinc/71/75/81/1065717581.db2.gz XPDQRGWDOXTZHE-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Fc1ccccc1C[N@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001307998055 1065717593 /nfs/dbraw/zinc/71/75/93/1065717593.db2.gz XPDQRGWDOXTZHE-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@H+](Cc2cccnc2Cl)C1 ZINC001308014502 1065725197 /nfs/dbraw/zinc/72/51/97/1065725197.db2.gz HMYNCNTUBRKWFO-KRWDZBQOSA-N 1 2 304.796 4.196 20 0 DIADLO F[C@@]1(c2ccccc2)CCC[N@@H+](Cc2cccnc2Cl)C1 ZINC001308014502 1065725207 /nfs/dbraw/zinc/72/52/07/1065725207.db2.gz HMYNCNTUBRKWFO-KRWDZBQOSA-N 1 2 304.796 4.196 20 0 DIADLO CCOC(=O)[C@H](CCCC(C)C)[NH2+]C[C@@H]1CCCCC1(F)F ZINC001308063158 1065748571 /nfs/dbraw/zinc/74/85/71/1065748571.db2.gz DRODJJYENMVVKD-GJZGRUSLSA-N 1 2 319.436 4.160 20 0 DIADLO CC[C@H](C)[C@H]([NH2+][C@@H](CC)c1cccc2ccccc21)C(=O)OC ZINC001308084221 1065754882 /nfs/dbraw/zinc/75/48/82/1065754882.db2.gz DPXFMSKPJGLSMC-JVPBZIDWSA-N 1 2 313.441 4.468 20 0 DIADLO C[C@@H]1CSCCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1F ZINC001308140177 1065777157 /nfs/dbraw/zinc/77/71/57/1065777157.db2.gz FHTRWDXKSJHFIP-SECBINFHSA-N 1 2 308.249 4.460 20 0 DIADLO C[C@@H]1CSCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1F ZINC001308140177 1065777167 /nfs/dbraw/zinc/77/71/67/1065777167.db2.gz FHTRWDXKSJHFIP-SECBINFHSA-N 1 2 308.249 4.460 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@@H+](Cc1noc3c1CCCC3)C2 ZINC001308174822 1065790250 /nfs/dbraw/zinc/79/02/50/1065790250.db2.gz OPLMGAMWUNOZLU-UHFFFAOYSA-N 1 2 310.441 4.235 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@H+](Cc1noc3c1CCCC3)C2 ZINC001308174822 1065790258 /nfs/dbraw/zinc/79/02/58/1065790258.db2.gz OPLMGAMWUNOZLU-UHFFFAOYSA-N 1 2 310.441 4.235 20 0 DIADLO CCC[C@@H]([NH2+]Cc1csc(-c2ccccn2)n1)c1ccccn1 ZINC001308247779 1065851202 /nfs/dbraw/zinc/85/12/02/1065851202.db2.gz ADVHIJNMBQMZAV-OAHLLOKOSA-N 1 2 324.453 4.231 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccc2oc(C(F)(F)F)nc2c1 ZINC001308321690 1065911449 /nfs/dbraw/zinc/91/14/49/1065911449.db2.gz NGUGRZDPQXGBDP-UHFFFAOYSA-N 1 2 324.306 4.065 20 0 DIADLO CC(C)c1ncc(CNc2ccc([NH+]3CCCC3)cc2)s1 ZINC001308324296 1065912967 /nfs/dbraw/zinc/91/29/67/1065912967.db2.gz HZCAAURSDGLFDA-UHFFFAOYSA-N 1 2 301.459 4.479 20 0 DIADLO CCOc1ccc(CNc2ccc(-n3cc[nH+]c3)c(C)c2)cc1 ZINC001308324497 1065913412 /nfs/dbraw/zinc/91/34/12/1065913412.db2.gz KCAURXIALDEYHR-UHFFFAOYSA-N 1 2 307.397 4.192 20 0 DIADLO Cc1cc(NCc2nc(C(C)(C)C)co2)ccc1-n1cc[nH+]c1 ZINC001308325092 1065914947 /nfs/dbraw/zinc/91/49/47/1065914947.db2.gz URTXUUNBDDHPCY-UHFFFAOYSA-N 1 2 310.401 4.078 20 0 DIADLO CC(C)C1CCC(CNc2cc(CSCCO)cc[nH+]2)CC1 ZINC001308362813 1065941076 /nfs/dbraw/zinc/94/10/76/1065941076.db2.gz SYJFKBPJRGEKHS-UHFFFAOYSA-N 1 2 322.518 4.181 20 0 DIADLO CC[C@@H](C)c1nnc([C@H](C)[NH2+]Cc2cc(C(C)(C)C)oc2C)[nH]1 ZINC001308394460 1065961126 /nfs/dbraw/zinc/96/11/26/1065961126.db2.gz PONOZRHLCACGDM-NEPJUHHUSA-N 1 2 318.465 4.368 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nccn2-c2ccccc2)c(F)c1 ZINC001308420965 1065976124 /nfs/dbraw/zinc/97/61/24/1065976124.db2.gz MWWVQODIAHZJPN-OAHLLOKOSA-N 1 2 309.388 4.171 20 0 DIADLO Oc1ccc(Cl)c(C[NH2+]Cc2cc(Cl)ccc2F)c1 ZINC001308503186 1066031725 /nfs/dbraw/zinc/03/17/25/1066031725.db2.gz NODUJMRDTUATBG-UHFFFAOYSA-N 1 2 300.160 4.128 20 0 DIADLO Cc1cc(NCc2ccc(C(=O)OC(C)(C)C)s2)c[nH+]c1C ZINC001308503006 1066032452 /nfs/dbraw/zinc/03/24/52/1066032452.db2.gz CVWYXJRVVJOIJL-UHFFFAOYSA-N 1 2 318.442 4.327 20 0 DIADLO CCc1ncc(CNc2[nH+]c3cc(Cl)ccc3n2CC)s1 ZINC001308506848 1066034344 /nfs/dbraw/zinc/03/43/44/1066034344.db2.gz DFJAJRLEGMRUDM-UHFFFAOYSA-N 1 2 320.849 4.341 20 0 DIADLO CC[C@@H]1CCC[C@H](CNc2[nH+]c3ccccc3n2CCOC)C1 ZINC001308506933 1066034504 /nfs/dbraw/zinc/03/45/04/1066034504.db2.gz FXOKHVCTIACHTK-CVEARBPZSA-N 1 2 315.461 4.311 20 0 DIADLO CC(C)[C@H]1CCC[N@H+](Cc2csc(C(F)(F)F)n2)CC1 ZINC001308572952 1066085539 /nfs/dbraw/zinc/08/55/39/1066085539.db2.gz AZBKNRYRLVWMBV-NSHDSACASA-N 1 2 306.397 4.420 20 0 DIADLO CC(C)[C@H]1CCC[N@@H+](Cc2csc(C(F)(F)F)n2)CC1 ZINC001308572952 1066085551 /nfs/dbraw/zinc/08/55/51/1066085551.db2.gz AZBKNRYRLVWMBV-NSHDSACASA-N 1 2 306.397 4.420 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308574426 1066086917 /nfs/dbraw/zinc/08/69/17/1066086917.db2.gz VSZLETLKCNGSAN-ABAIWWIYSA-N 1 2 321.342 4.393 20 0 DIADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308574426 1066086931 /nfs/dbraw/zinc/08/69/31/1066086931.db2.gz VSZLETLKCNGSAN-ABAIWWIYSA-N 1 2 321.342 4.393 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2F)[N@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308573636 1066088140 /nfs/dbraw/zinc/08/81/40/1066088140.db2.gz PUKYYWPIJGGMNN-IAQYHMDHSA-N 1 2 321.342 4.393 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308573636 1066088154 /nfs/dbraw/zinc/08/81/54/1066088154.db2.gz PUKYYWPIJGGMNN-IAQYHMDHSA-N 1 2 321.342 4.393 20 0 DIADLO COC(=O)c1cnc([C@H](C)[NH+]2CCC(CCC(C)C)CC2)s1 ZINC001308604859 1066113598 /nfs/dbraw/zinc/11/35/98/1066113598.db2.gz XRSJJNMRHLWWQR-ZDUSSCGKSA-N 1 2 324.490 4.139 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@H+](C)Cc1scnc1C ZINC001308619647 1066121967 /nfs/dbraw/zinc/12/19/67/1066121967.db2.gz NRFJFFZXUBPOEM-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@@H+](C)Cc1scnc1C ZINC001308619647 1066121970 /nfs/dbraw/zinc/12/19/70/1066121970.db2.gz NRFJFFZXUBPOEM-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CCCC[N@H+](Cc1cn(C)nc1Cl)[C@H](C)c1ccc(C)o1 ZINC001308624204 1066123670 /nfs/dbraw/zinc/12/36/70/1066123670.db2.gz KXNJMACQAASLAQ-CYBMUJFWSA-N 1 2 309.841 4.338 20 0 DIADLO CCCC[N@@H+](Cc1cn(C)nc1Cl)[C@H](C)c1ccc(C)o1 ZINC001308624204 1066123672 /nfs/dbraw/zinc/12/36/72/1066123672.db2.gz KXNJMACQAASLAQ-CYBMUJFWSA-N 1 2 309.841 4.338 20 0 DIADLO Cc1ccc([C@@H](C)C[NH2+]c2ccc(N3CCOCC3)c(C)c2)cc1 ZINC001308635102 1066130408 /nfs/dbraw/zinc/13/04/08/1066130408.db2.gz KLXYMWSBIGQVDA-SFHVURJKSA-N 1 2 324.468 4.356 20 0 DIADLO Cc1ccc(C[N@H+](Cc2c(C)nc3scc(C)n23)C2CC2)o1 ZINC001308649694 1066135999 /nfs/dbraw/zinc/13/59/99/1066135999.db2.gz HRRQDOFASPZWQY-UHFFFAOYSA-N 1 2 315.442 4.079 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2c(C)nc3scc(C)n23)C2CC2)o1 ZINC001308649694 1066136003 /nfs/dbraw/zinc/13/60/03/1066136003.db2.gz HRRQDOFASPZWQY-UHFFFAOYSA-N 1 2 315.442 4.079 20 0 DIADLO COc1nc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)ccc1C ZINC001308649044 1066137033 /nfs/dbraw/zinc/13/70/33/1066137033.db2.gz GYSRZHBHYNGAEQ-ZDUSSCGKSA-N 1 2 304.821 4.245 20 0 DIADLO COc1nc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)ccc1C ZINC001308649044 1066137036 /nfs/dbraw/zinc/13/70/36/1066137036.db2.gz GYSRZHBHYNGAEQ-ZDUSSCGKSA-N 1 2 304.821 4.245 20 0 DIADLO Fc1ccc(C[N@H+](Cc2cccn2C2CC2)C2CC2)c(F)c1 ZINC001308664117 1066145048 /nfs/dbraw/zinc/14/50/48/1066145048.db2.gz XMCUGHJYJYYVDA-UHFFFAOYSA-N 1 2 302.368 4.266 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2cccn2C2CC2)C2CC2)c(F)c1 ZINC001308664117 1066145049 /nfs/dbraw/zinc/14/50/49/1066145049.db2.gz XMCUGHJYJYYVDA-UHFFFAOYSA-N 1 2 302.368 4.266 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1snc(OC)c1Cl ZINC001308665819 1066145056 /nfs/dbraw/zinc/14/50/56/1066145056.db2.gz GEPNNROPDZOARA-ZDUSSCGKSA-N 1 2 322.861 4.142 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1snc(OC)c1Cl ZINC001308665819 1066145057 /nfs/dbraw/zinc/14/50/57/1066145057.db2.gz GEPNNROPDZOARA-ZDUSSCGKSA-N 1 2 322.861 4.142 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(Br)o1 ZINC001308666661 1066145863 /nfs/dbraw/zinc/14/58/63/1066145863.db2.gz VVHCSLABWYEYSO-AWEZNQCLSA-N 1 2 320.230 4.379 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1ccc(Br)o1 ZINC001308666661 1066145868 /nfs/dbraw/zinc/14/58/68/1066145868.db2.gz VVHCSLABWYEYSO-AWEZNQCLSA-N 1 2 320.230 4.379 20 0 DIADLO CC[C@@](C)(CNc1cccc(-c2[nH+]cc3n2CCCC3)c1)OC ZINC001308720762 1066199061 /nfs/dbraw/zinc/19/90/61/1066199061.db2.gz BFFJQVTZLNLJPC-IBGZPJMESA-N 1 2 313.445 4.113 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1c(Cl)n[nH]c1C1CC1 ZINC001308731412 1066206793 /nfs/dbraw/zinc/20/67/93/1066206793.db2.gz MMCNERUCPHRPNR-UHFFFAOYSA-N 1 2 321.877 4.294 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1c(Cl)n[nH]c1C1CC1 ZINC001308731412 1066206804 /nfs/dbraw/zinc/20/68/04/1066206804.db2.gz MMCNERUCPHRPNR-UHFFFAOYSA-N 1 2 321.877 4.294 20 0 DIADLO Cc1[nH+]c(NCc2coc3ccccc23)ccc1-c1cnn(C)c1 ZINC001308779680 1066252826 /nfs/dbraw/zinc/25/28/26/1066252826.db2.gz QVYKFAWIWWEJQY-UHFFFAOYSA-N 1 2 318.380 4.149 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(F)c2OC(F)(F)F)[C@H]1C1CC1 ZINC001308799821 1066276594 /nfs/dbraw/zinc/27/65/94/1066276594.db2.gz AIDAWSOTSLOJNR-AWEZNQCLSA-N 1 2 317.326 4.345 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(F)c2OC(F)(F)F)[C@H]1C1CC1 ZINC001308799821 1066276607 /nfs/dbraw/zinc/27/66/07/1066276607.db2.gz AIDAWSOTSLOJNR-AWEZNQCLSA-N 1 2 317.326 4.345 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2CCc3cccc(Cl)c3C2)cn1 ZINC001308808571 1066283638 /nfs/dbraw/zinc/28/36/38/1066283638.db2.gz HIOGWMASFXKDIK-UHFFFAOYSA-N 1 2 314.860 4.492 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2CCc3cccc(Cl)c3C2)cn1 ZINC001308808571 1066283650 /nfs/dbraw/zinc/28/36/50/1066283650.db2.gz HIOGWMASFXKDIK-UHFFFAOYSA-N 1 2 314.860 4.492 20 0 DIADLO Fc1cccc(C[NH+]2CC3(C2)CCCCC3)c1OC(F)(F)F ZINC001308807603 1066283909 /nfs/dbraw/zinc/28/39/09/1066283909.db2.gz RPBYMYREMQSXMU-UHFFFAOYSA-N 1 2 317.326 4.490 20 0 DIADLO CCCCCOC1C[NH+](Cc2cc3ccccc3cc2OC)C1 ZINC001308806975 1066284009 /nfs/dbraw/zinc/28/40/09/1066284009.db2.gz FVBVIGWNKCEDSA-UHFFFAOYSA-N 1 2 313.441 4.239 20 0 DIADLO CCC1(C)C[NH+](Cc2cccc(Br)c2Cl)C1 ZINC001308811493 1066287408 /nfs/dbraw/zinc/28/74/08/1066287408.db2.gz PDEUHUDYOIIJBH-UHFFFAOYSA-N 1 2 302.643 4.334 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)o1 ZINC001308817201 1066294739 /nfs/dbraw/zinc/29/47/39/1066294739.db2.gz CALSLEGNUWGNNP-INIZCTEOSA-N 1 2 307.340 4.294 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)o1 ZINC001308817201 1066294750 /nfs/dbraw/zinc/29/47/50/1066294750.db2.gz CALSLEGNUWGNNP-INIZCTEOSA-N 1 2 307.340 4.294 20 0 DIADLO CC1(C)CCC[C@@H](C[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC001308820991 1066296154 /nfs/dbraw/zinc/29/61/54/1066296154.db2.gz TUHUSUPQHMAFPK-ZBFHGGJFSA-N 1 2 304.482 4.232 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1c(Cl)ccc3cccnc31)C2 ZINC001308837707 1066315551 /nfs/dbraw/zinc/31/55/51/1066315551.db2.gz KNTRUSJTNGBWKV-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1c(Cl)ccc3cccnc31)C2 ZINC001308837707 1066315566 /nfs/dbraw/zinc/31/55/66/1066315566.db2.gz KNTRUSJTNGBWKV-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO C[C@]1(C(F)F)C[N@H+](Cc2ccc(C3CC3)c(C3CC3)c2)CCO1 ZINC001308871432 1066351039 /nfs/dbraw/zinc/35/10/39/1066351039.db2.gz JAMSEJLCPPGBQS-LJQANCHMSA-N 1 2 321.411 4.297 20 0 DIADLO C[C@]1(C(F)F)C[N@@H+](Cc2ccc(C3CC3)c(C3CC3)c2)CCO1 ZINC001308871432 1066351047 /nfs/dbraw/zinc/35/10/47/1066351047.db2.gz JAMSEJLCPPGBQS-LJQANCHMSA-N 1 2 321.411 4.297 20 0 DIADLO CCSc1cccc(C[N@@H+]2CCOc3cc(F)ccc3C2)c1 ZINC001308888150 1066368678 /nfs/dbraw/zinc/36/86/78/1066368678.db2.gz LZORWAJGWWJMDG-UHFFFAOYSA-N 1 2 317.429 4.332 20 0 DIADLO CCSc1cccc(C[N@H+]2CCOc3cc(F)ccc3C2)c1 ZINC001308888150 1066368697 /nfs/dbraw/zinc/36/86/97/1066368697.db2.gz LZORWAJGWWJMDG-UHFFFAOYSA-N 1 2 317.429 4.332 20 0 DIADLO CCSCc1ccc[nH+]c1N[C@@H]1Cc2[nH]c3ccccc3c2C1 ZINC001308916699 1066393942 /nfs/dbraw/zinc/39/39/42/1066393942.db2.gz YPHQKAGQQFMUAO-AWEZNQCLSA-N 1 2 323.465 4.395 20 0 DIADLO CCSCc1ccc[nH+]c1N[C@H]1Cc2[nH]c3ccccc3c2C1 ZINC001308916700 1066395304 /nfs/dbraw/zinc/39/53/04/1066395304.db2.gz YPHQKAGQQFMUAO-CQSZACIVSA-N 1 2 323.465 4.395 20 0 DIADLO COC(=O)c1cc(CNc2ccc3[nH+]c(C)cc(C)c3c2)c(C)o1 ZINC001308938462 1066408454 /nfs/dbraw/zinc/40/84/54/1066408454.db2.gz CYYLYFXNAOQJFQ-UHFFFAOYSA-N 1 2 324.380 4.152 20 0 DIADLO Cc1cc(F)c(C[NH2+]Cc2cc3c(ccnc3Cl)o2)c(F)c1 ZINC001308952817 1066416882 /nfs/dbraw/zinc/41/68/82/1066416882.db2.gz SUWYKGFBEPFGHV-UHFFFAOYSA-N 1 2 322.742 4.358 20 0 DIADLO Cc1csc2nc(C)c(C[N@@H+]3CC[C@H]3c3ccc(F)cc3)n12 ZINC001308966925 1066423105 /nfs/dbraw/zinc/42/31/05/1066423105.db2.gz FFHORGRDRFNUKY-HNNXBMFYSA-N 1 2 315.417 4.099 20 0 DIADLO Cc1csc2nc(C)c(C[N@H+]3CC[C@H]3c3ccc(F)cc3)n12 ZINC001308966925 1066423110 /nfs/dbraw/zinc/42/31/10/1066423110.db2.gz FFHORGRDRFNUKY-HNNXBMFYSA-N 1 2 315.417 4.099 20 0 DIADLO Cc1cc(NC(=O)NCC[C@H]2C[C@@H](C)CC(C)(C)C2)c(C)c[nH+]1 ZINC001310450370 1066525245 /nfs/dbraw/zinc/52/52/45/1066525245.db2.gz FQOPJQSPORMBBV-CJNGLKHVSA-N 1 2 317.477 4.094 20 0 DIADLO Cc1ccc(NC(=O)NC(CC(C)C)CC(C)C)c(N(C)C)[nH+]1 ZINC001310464251 1066526310 /nfs/dbraw/zinc/52/63/10/1066526310.db2.gz UTLFLUCTZMMGCK-UHFFFAOYSA-N 1 2 320.481 4.038 20 0 DIADLO CC(C)(CNC(=O)Nc1ccn2cc[nH+]c2c1)C1CCCCC1 ZINC001310674622 1066550450 /nfs/dbraw/zinc/55/04/50/1066550450.db2.gz GZOHTACSCIRBCS-UHFFFAOYSA-N 1 2 314.433 4.062 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2c3ccccc3CC[C@H]2C)c(C)[nH+]1 ZINC001310833686 1066566747 /nfs/dbraw/zinc/56/67/47/1066566747.db2.gz CWOALOUKQWIKKN-BLVKFPJESA-N 1 2 323.440 4.452 20 0 DIADLO CC1(C)CCC(C)(CNC(=O)Nc2ccc3[nH+]ccn3c2)CC1 ZINC001311026746 1066588221 /nfs/dbraw/zinc/58/82/21/1066588221.db2.gz NCOAVMISONMDAN-UHFFFAOYSA-N 1 2 314.433 4.062 20 0 DIADLO CCCN(CC1CCCCC1)C(=O)NCc1c[nH+]c(C)cc1C ZINC001312856996 1066870201 /nfs/dbraw/zinc/87/02/01/1066870201.db2.gz QILGGLNOEHOFAF-UHFFFAOYSA-N 1 2 317.477 4.200 20 0 DIADLO Cc1cc(CNC(=O)N2CCCCC[C@H]2CC(C)C)cc(C)[nH+]1 ZINC001312891026 1066878571 /nfs/dbraw/zinc/87/85/71/1066878571.db2.gz NSWIBLUWGCKJQR-SFHVURJKSA-N 1 2 317.477 4.199 20 0 DIADLO CC[C@H](Nc1cc(C)c(Br)c(C)c1)c1[nH+]ccn1C ZINC000190326190 334927959 /nfs/dbraw/zinc/92/79/59/334927959.db2.gz WUAORKMAJBZQIB-ZDUSSCGKSA-N 1 2 322.250 4.363 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000090572442 185304495 /nfs/dbraw/zinc/30/44/95/185304495.db2.gz QYFLUAFKCVJRMG-HNNXBMFYSA-N 1 2 313.445 4.166 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2cccc(C3CC3)c2)s1 ZINC000340254653 534986629 /nfs/dbraw/zinc/98/66/29/534986629.db2.gz LPNXMQHIHDZWGF-GFCCVEGCSA-N 1 2 301.459 4.390 20 0 DIADLO C[C@H](CCNC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1)CC(C)(C)C ZINC000190980296 334964978 /nfs/dbraw/zinc/96/49/78/334964978.db2.gz NZSHLPKRNNAZKX-CABCVRRESA-N 1 2 320.481 4.109 20 0 DIADLO CC[C@](C)([NH2+]Cc1csc(-c2ccoc2)n1)c1nccs1 ZINC000072683012 191214655 /nfs/dbraw/zinc/21/46/55/191214655.db2.gz AJNBQBMIWSZUIY-HNNXBMFYSA-N 1 2 319.455 4.275 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]C1(c2nccs2)CCCC1 ZINC000081594650 192299212 /nfs/dbraw/zinc/29/92/12/192299212.db2.gz QASJXFLVSKIVLB-UHFFFAOYSA-N 1 2 310.825 4.495 20 0 DIADLO COc1cc(C[N@H+](C)Cc2nc(C)c(C)s2)ccc1SC ZINC000081668885 192309255 /nfs/dbraw/zinc/30/92/55/192309255.db2.gz JGSRNBHXNBLRSW-UHFFFAOYSA-N 1 2 322.499 4.122 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2nc(C)c(C)s2)ccc1SC ZINC000081668885 192309257 /nfs/dbraw/zinc/30/92/57/192309257.db2.gz JGSRNBHXNBLRSW-UHFFFAOYSA-N 1 2 322.499 4.122 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2nc3ccccc3n2C)cs1 ZINC000091337253 193043407 /nfs/dbraw/zinc/04/34/07/193043407.db2.gz CXHJPIIYNONTAQ-NWDGAFQWSA-N 1 2 314.458 4.004 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1nc2ccccc2n1C ZINC000091409479 193051994 /nfs/dbraw/zinc/05/19/94/193051994.db2.gz GXMIHXPIYABVET-RYUDHWBXSA-N 1 2 315.367 4.263 20 0 DIADLO CC(C)CCc1nc(C[N@H+](C)[C@H](C)c2ccccn2)cs1 ZINC000091702307 193093753 /nfs/dbraw/zinc/09/37/53/193093753.db2.gz ILGDJMDMHFVSKH-CQSZACIVSA-N 1 2 303.475 4.320 20 0 DIADLO CC(C)CCc1nc(C[N@@H+](C)[C@H](C)c2ccccn2)cs1 ZINC000091702307 193093755 /nfs/dbraw/zinc/09/37/55/193093755.db2.gz ILGDJMDMHFVSKH-CQSZACIVSA-N 1 2 303.475 4.320 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000091701970 193093951 /nfs/dbraw/zinc/09/39/51/193093951.db2.gz OHDBIJVBHTVHLH-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)[C@H](C)c1ccccn1 ZINC000091701970 193093954 /nfs/dbraw/zinc/09/39/54/193093954.db2.gz OHDBIJVBHTVHLH-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2nc3c(s2)CCCC3)cs1 ZINC000091723600 193096677 /nfs/dbraw/zinc/09/66/77/193096677.db2.gz IXMTUTXFDQPLHB-WDEREUQCSA-N 1 2 321.515 4.453 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(Oc3cccnc3)c(C)c2)no1 ZINC000092254502 193182320 /nfs/dbraw/zinc/18/23/20/193182320.db2.gz YWYFHXGSEXXZHQ-UHFFFAOYSA-N 1 2 323.396 4.111 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(Oc3cccnc3)c(C)c2)no1 ZINC000092254502 193182322 /nfs/dbraw/zinc/18/23/22/193182322.db2.gz YWYFHXGSEXXZHQ-UHFFFAOYSA-N 1 2 323.396 4.111 20 0 DIADLO CC(C)CCc1nc(C[N@H+](C)[C@H](C)c2cccnc2)cs1 ZINC000093234263 193220213 /nfs/dbraw/zinc/22/02/13/193220213.db2.gz QJTHYKPRYBUKHA-CQSZACIVSA-N 1 2 303.475 4.320 20 0 DIADLO CC(C)CCc1nc(C[N@@H+](C)[C@H](C)c2cccnc2)cs1 ZINC000093234263 193220215 /nfs/dbraw/zinc/22/02/15/193220215.db2.gz QJTHYKPRYBUKHA-CQSZACIVSA-N 1 2 303.475 4.320 20 0 DIADLO CC(C)[C@@H]([NH2+][C@H](C)c1nccs1)c1nc2ccccc2[nH]1 ZINC000093401139 193244172 /nfs/dbraw/zinc/24/41/72/193244172.db2.gz SDLGIHOORJGQLM-BXUZGUMPSA-N 1 2 300.431 4.067 20 0 DIADLO Cc1ccc(NC(=O)NC[C@H](C)Sc2ccccc2)c(C)[nH+]1 ZINC000152363700 335023351 /nfs/dbraw/zinc/02/33/51/335023351.db2.gz KYZCXGKQHBEDFH-ZDUSSCGKSA-N 1 2 315.442 4.001 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)C12CC3CC(CC(C3)C1)C2 ZINC000023889530 182370065 /nfs/dbraw/zinc/37/00/65/182370065.db2.gz WZKDAVQQYSRXTL-UHFFFAOYSA-N 1 2 321.424 4.027 20 0 DIADLO CCCCc1noc(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)n1 ZINC000104707357 194028806 /nfs/dbraw/zinc/02/88/06/194028806.db2.gz SOGDJOLGZALAOG-UHFFFAOYSA-N 1 2 319.836 4.235 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[NH+]1Cc2ccccc2C1 ZINC000106305387 194194599 /nfs/dbraw/zinc/19/45/99/194194599.db2.gz DRUMCOXTPJANMY-UHFFFAOYSA-N 1 2 308.425 4.073 20 0 DIADLO CCCC[C@@H]1CCC[C@H]1NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000106558569 194231637 /nfs/dbraw/zinc/23/16/37/194231637.db2.gz HWHXDGQKVHEMRC-BZUAXINKSA-N 1 2 318.465 4.005 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1nccn1CC(F)(F)F ZINC000057873172 184059493 /nfs/dbraw/zinc/05/94/93/184059493.db2.gz DPYZZQHVWRVDLD-OAHLLOKOSA-N 1 2 323.362 4.091 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1nccn1CC(F)(F)F ZINC000057873172 184059494 /nfs/dbraw/zinc/05/94/94/184059494.db2.gz DPYZZQHVWRVDLD-OAHLLOKOSA-N 1 2 323.362 4.091 20 0 DIADLO Cc1nc(SCc2cn3ccccc3[nH+]2)n(CC(C)C)c1C ZINC000060713928 184155229 /nfs/dbraw/zinc/15/52/29/184155229.db2.gz VBGPZXXZCSMIRC-UHFFFAOYSA-N 1 2 314.458 4.096 20 0 DIADLO Cc1cc(C)c(NC(=O)c2scnc2C2CCCC2)c(C)[nH+]1 ZINC000183919028 335049217 /nfs/dbraw/zinc/04/92/17/335049217.db2.gz VTWADYOSFUHFOO-UHFFFAOYSA-N 1 2 315.442 4.373 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cc(-c2ccco2)on1 ZINC000272413371 130028667 /nfs/dbraw/zinc/02/86/67/130028667.db2.gz GTBQCZWQQLYPFK-ZDUSSCGKSA-N 1 2 312.369 4.102 20 0 DIADLO Brc1cccc(C[N@@H+]2CCC[C@@H]2c2cccs2)n1 ZINC000272426075 130029031 /nfs/dbraw/zinc/02/90/31/130029031.db2.gz PECYYVPTWUXTNZ-GFCCVEGCSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cccc(C[N@H+]2CCC[C@@H]2c2cccs2)n1 ZINC000272426075 130029033 /nfs/dbraw/zinc/02/90/33/130029033.db2.gz PECYYVPTWUXTNZ-GFCCVEGCSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H]2CCCOc3c(F)cccc32)cs1 ZINC000272672239 130050830 /nfs/dbraw/zinc/05/08/30/130050830.db2.gz TZJMVVMAYQSGIL-YGRLFVJLSA-N 1 2 306.406 4.155 20 0 DIADLO CC(=O)Nc1ccc([C@H](C)Nc2ccc([NH+](C)C)cc2C)cc1 ZINC000272794111 130063438 /nfs/dbraw/zinc/06/34/38/130063438.db2.gz YCPAZNSYKMAHGB-AWEZNQCLSA-N 1 2 311.429 4.193 20 0 DIADLO CC(=O)Nc1ccc([C@@H](C)Nc2ccc([NH+](C)C)cc2C)cc1 ZINC000272794114 130063575 /nfs/dbraw/zinc/06/35/75/130063575.db2.gz YCPAZNSYKMAHGB-CQSZACIVSA-N 1 2 311.429 4.193 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](c2ccccc2)c2ccc(C)cc2)s1 ZINC000272981280 130078908 /nfs/dbraw/zinc/07/89/08/130078908.db2.gz AWPHFSANDZXCKN-IBGZPJMESA-N 1 2 323.465 4.288 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1nc(Cl)ccc1Cl ZINC000273217141 130098397 /nfs/dbraw/zinc/09/83/97/130098397.db2.gz YFLZMBMSCXTWMR-JTQLQIEISA-N 1 2 311.212 4.287 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1nc(Cl)ccc1Cl ZINC000273217141 130098398 /nfs/dbraw/zinc/09/83/98/130098398.db2.gz YFLZMBMSCXTWMR-JTQLQIEISA-N 1 2 311.212 4.287 20 0 DIADLO CC[C@@H]([NH2+]Cc1occc1C(=O)OC)c1ccc(Cl)s1 ZINC000273481849 130126081 /nfs/dbraw/zinc/12/60/81/130126081.db2.gz IJBOXUOTKMUGFN-SNVBAGLBSA-N 1 2 313.806 4.022 20 0 DIADLO Cc1ccc(Cc2noc(CC[C@@H](C)c3ccccc3)n2)c[nH+]1 ZINC000273884069 130182609 /nfs/dbraw/zinc/18/26/09/130182609.db2.gz HGYXSMYKBVQLAU-CQSZACIVSA-N 1 2 307.397 4.100 20 0 DIADLO Cc1ccc(Cc2noc([C@H](C)c3ccc(Cl)s3)n2)c[nH+]1 ZINC000273947039 130190410 /nfs/dbraw/zinc/19/04/10/130190410.db2.gz NQHLFWRQSMFEFO-SNVBAGLBSA-N 1 2 319.817 4.231 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nnc(C)s1)c1cccc(Cl)c1F ZINC000274029126 130198701 /nfs/dbraw/zinc/19/87/01/130198701.db2.gz GWDBQAYEIRAYLD-PELKAZGASA-N 1 2 313.829 4.441 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nc(Cl)ccc1Cl ZINC000274311693 130226235 /nfs/dbraw/zinc/22/62/35/130226235.db2.gz MMRKIGSHBWACCU-AWEZNQCLSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nc(Cl)ccc1Cl ZINC000274311693 130226238 /nfs/dbraw/zinc/22/62/38/130226238.db2.gz MMRKIGSHBWACCU-AWEZNQCLSA-N 1 2 310.228 4.367 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1F)c1nc(C(F)(F)F)cs1 ZINC000274337328 130227276 /nfs/dbraw/zinc/22/72/76/130227276.db2.gz AATKZMGESHXHJL-MRVPVSSYSA-N 1 2 304.312 4.152 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CCC[C@H]2c2ccncc2)n1 ZINC000274356562 130228856 /nfs/dbraw/zinc/22/88/56/130228856.db2.gz YKKHZUZESYAYTR-AWEZNQCLSA-N 1 2 308.212 4.121 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CCC[C@H]2c2ccncc2)n1 ZINC000274356562 130228858 /nfs/dbraw/zinc/22/88/58/130228858.db2.gz YKKHZUZESYAYTR-AWEZNQCLSA-N 1 2 308.212 4.121 20 0 DIADLO CCn1nc(C[NH2+][C@@H](C)c2ccc(F)cc2F)c2ccccc21 ZINC000274433480 130233581 /nfs/dbraw/zinc/23/35/81/130233581.db2.gz MYDACMSBDYEEQK-LBPRGKRZSA-N 1 2 315.367 4.185 20 0 DIADLO COCC[C@H]([NH2+][C@@H](C)c1csc(C(C)C)n1)c1ccco1 ZINC000274428578 130234515 /nfs/dbraw/zinc/23/45/15/130234515.db2.gz JMWIXBWRPKNXIQ-STQMWFEESA-N 1 2 308.447 4.288 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+][C@H](C)c1nc(C(F)(F)F)cs1 ZINC000274616191 130251136 /nfs/dbraw/zinc/25/11/36/130251136.db2.gz OOMRQEWHFAVTEH-NXEZZACHSA-N 1 2 315.364 4.277 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)cc1F)c1nc(C(F)(F)F)cs1 ZINC000274663923 130253495 /nfs/dbraw/zinc/25/34/95/130253495.db2.gz WUKRMXZQEFMENJ-SSDOTTSWSA-N 1 2 322.302 4.291 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccc(Cl)cn1 ZINC000274886395 130270322 /nfs/dbraw/zinc/27/03/22/130270322.db2.gz INXGJTXNDPZSHP-SNVBAGLBSA-N 1 2 309.866 4.340 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccc(Cl)cn1 ZINC000274886392 130270617 /nfs/dbraw/zinc/27/06/17/130270617.db2.gz INXGJTXNDPZSHP-JTQLQIEISA-N 1 2 309.866 4.340 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[NH+]1CCC(C(=O)C(F)(F)F)CC1 ZINC000275010333 130283012 /nfs/dbraw/zinc/28/30/12/130283012.db2.gz RHLQFVWUCRXQDO-SNVBAGLBSA-N 1 2 319.754 4.244 20 0 DIADLO CC(C)n1ncnc1C[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000280022207 130777019 /nfs/dbraw/zinc/77/70/19/130777019.db2.gz MOJBSUJAJHLRDQ-UHFFFAOYSA-N 1 2 320.440 4.061 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2OC)cs1 ZINC000280280717 130794775 /nfs/dbraw/zinc/79/47/75/130794775.db2.gz SFBJCXPSOCZAGJ-SNVBAGLBSA-N 1 2 310.850 4.218 20 0 DIADLO Cn1cc[nH+]c1CN1CCCC[C@H]1c1ccccc1C(F)(F)F ZINC000340184892 131017121 /nfs/dbraw/zinc/01/71/21/131017121.db2.gz GOWAGWKTIBUKJT-HNNXBMFYSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1ccnc1C[N@@H+]1CCCC[C@H]1c1ccccc1C(F)(F)F ZINC000340184892 131017123 /nfs/dbraw/zinc/01/71/23/131017123.db2.gz GOWAGWKTIBUKJT-HNNXBMFYSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1ccnc1C[N@H+]1CCCC[C@H]1c1ccccc1C(F)(F)F ZINC000340184892 131017125 /nfs/dbraw/zinc/01/71/25/131017125.db2.gz GOWAGWKTIBUKJT-HNNXBMFYSA-N 1 2 323.362 4.166 20 0 DIADLO Cc1noc(C(C)(C)[NH2+]Cc2cccc(Oc3ccccc3)c2)n1 ZINC000284171954 131056280 /nfs/dbraw/zinc/05/62/80/131056280.db2.gz XANOUFFNVJCXAU-UHFFFAOYSA-N 1 2 323.396 4.195 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2OCCC(C)C)no1 ZINC000285445616 131169820 /nfs/dbraw/zinc/16/98/20/131169820.db2.gz ZFUSWGSJFYCHQO-OAHLLOKOSA-N 1 2 302.418 4.259 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1cc(F)c(F)c(F)c1 ZINC000285729141 131197562 /nfs/dbraw/zinc/19/75/62/131197562.db2.gz QSMMRIZNUXYWGQ-HTQZYQBOSA-N 1 2 316.273 4.189 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1coc(-c2cccs2)n1 ZINC000285780171 131201351 /nfs/dbraw/zinc/20/13/51/131201351.db2.gz UCTBPXPXCFDIGI-UHFFFAOYSA-N 1 2 317.414 4.033 20 0 DIADLO Cc1noc([C@@H]2CCCC[N@@H+]2Cc2ccc(C(F)F)cc2)n1 ZINC000285820394 131204418 /nfs/dbraw/zinc/20/44/18/131204418.db2.gz WICOQDHSCAOKHE-AWEZNQCLSA-N 1 2 307.344 4.043 20 0 DIADLO Cc1noc([C@@H]2CCCC[N@H+]2Cc2ccc(C(F)F)cc2)n1 ZINC000285820394 131204419 /nfs/dbraw/zinc/20/44/19/131204419.db2.gz WICOQDHSCAOKHE-AWEZNQCLSA-N 1 2 307.344 4.043 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1csc(C2CCCC2)n1 ZINC000285848610 131204879 /nfs/dbraw/zinc/20/48/79/131204879.db2.gz XSTYERRSXDEZRH-UHFFFAOYSA-N 1 2 319.474 4.430 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)c1c(F)cncc1F ZINC000285836025 131205453 /nfs/dbraw/zinc/20/54/53/131205453.db2.gz YCMXMUTWNIZAMZ-RYUDHWBXSA-N 1 2 306.356 4.089 20 0 DIADLO Fc1ccc(F)c(C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)c1 ZINC000285933593 131211473 /nfs/dbraw/zinc/21/14/73/131211473.db2.gz FJSWYRUHYNGSQY-MRXNPFEDSA-N 1 2 305.372 4.099 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000286681178 131246537 /nfs/dbraw/zinc/24/65/37/131246537.db2.gz CHKWIVPDNPIAMW-ZWNOBZJWSA-N 1 2 303.431 4.153 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000286681178 131246540 /nfs/dbraw/zinc/24/65/40/131246540.db2.gz CHKWIVPDNPIAMW-ZWNOBZJWSA-N 1 2 303.431 4.153 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000286947666 131257407 /nfs/dbraw/zinc/25/74/07/131257407.db2.gz CSKPKONJWAZGKH-ZHALLVOQSA-N 1 2 321.424 4.190 20 0 DIADLO CSc1ccc([C@@H](C)NC(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000286977438 131258934 /nfs/dbraw/zinc/25/89/34/131258934.db2.gz BTFQYYPMCGNZBP-GFCCVEGCSA-N 1 2 315.442 4.303 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@H](C)c2nccn2-c2ccccc2)o1 ZINC000287053927 131261497 /nfs/dbraw/zinc/26/14/97/131261497.db2.gz NBZXZBMXKMQPFG-LSDHHAIUSA-N 1 2 309.413 4.440 20 0 DIADLO Fc1ccccc1C[N@@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000287381002 131277581 /nfs/dbraw/zinc/27/75/81/131277581.db2.gz MXPHFCQPOJVYBR-INIZCTEOSA-N 1 2 315.392 4.203 20 0 DIADLO Fc1ccccc1C[N@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000287381002 131277583 /nfs/dbraw/zinc/27/75/83/131277583.db2.gz MXPHFCQPOJVYBR-INIZCTEOSA-N 1 2 315.392 4.203 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000287459997 131281574 /nfs/dbraw/zinc/28/15/74/131281574.db2.gz IQDVRYAHVKJEPK-LBPRGKRZSA-N 1 2 319.355 4.202 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@H]1c1cccc(F)c1 ZINC000287458029 131281594 /nfs/dbraw/zinc/28/15/94/131281594.db2.gz IPAIFXJWKUNIEW-INIZCTEOSA-N 1 2 313.376 4.207 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@@H](Cc2ccccc2)[C@@H]1C ZINC000287490455 131283298 /nfs/dbraw/zinc/28/32/98/131283298.db2.gz KSUKFRCDYRPEPN-WMZOPIPTSA-N 1 2 323.440 4.183 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@H](Cc2ccccc2)[C@H]1C ZINC000287490449 131283356 /nfs/dbraw/zinc/28/33/56/131283356.db2.gz KSUKFRCDYRPEPN-SJLPKXTDSA-N 1 2 323.440 4.183 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCc1ccc(C(F)(F)F)cc1 ZINC000287605812 131289884 /nfs/dbraw/zinc/28/98/84/131289884.db2.gz SMAMKDAVFGJJAB-UHFFFAOYSA-N 1 2 323.318 4.039 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@H]1c1cccs1 ZINC000287629092 131290907 /nfs/dbraw/zinc/29/09/07/131290907.db2.gz UTHHDIRXVHEAGL-ZDUSSCGKSA-N 1 2 301.415 4.129 20 0 DIADLO Cc1ccccc1C1CCN(C(=O)Nc2c(C)cc[nH+]c2C)CC1 ZINC000287642543 131292529 /nfs/dbraw/zinc/29/25/29/131292529.db2.gz VVAOMLIQPDSFQT-UHFFFAOYSA-N 1 2 323.440 4.418 20 0 DIADLO Cc1cc([C@@H](C)NC(=O)Nc2c(C)cc[nH+]c2C)c(C)s1 ZINC000287655341 131293528 /nfs/dbraw/zinc/29/35/28/131293528.db2.gz WPSSNFVCTRCHKW-LLVKDONJSA-N 1 2 303.431 4.259 20 0 DIADLO CCCN(CCc1cccs1)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287660769 131293751 /nfs/dbraw/zinc/29/37/51/131293751.db2.gz XAPGCHQXZFFNNC-UHFFFAOYSA-N 1 2 317.458 4.247 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCCC[C@@H]1Cc1ccccc1 ZINC000287687431 131294882 /nfs/dbraw/zinc/29/48/82/131294882.db2.gz YSUVNDSOXYQCCY-GOSISDBHSA-N 1 2 323.440 4.328 20 0 DIADLO c1cc(Oc2ccccc2)oc1C[NH2+]Cc1noc2c1CCCC2 ZINC000288553647 131329822 /nfs/dbraw/zinc/32/98/22/131329822.db2.gz XZOZCCIBYSROIN-UHFFFAOYSA-N 1 2 324.380 4.229 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CCC=C(c2cccnc2)C1 ZINC000289252787 131369692 /nfs/dbraw/zinc/36/96/92/131369692.db2.gz CLDPXDBAGZHMHL-CQSZACIVSA-N 1 2 311.429 4.217 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCC=C(c2cccnc2)C1 ZINC000289252787 131369694 /nfs/dbraw/zinc/36/96/94/131369694.db2.gz CLDPXDBAGZHMHL-CQSZACIVSA-N 1 2 311.429 4.217 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(Oc3cccnc3)cc2)oc1C ZINC000289389623 131381769 /nfs/dbraw/zinc/38/17/69/131381769.db2.gz JXZFBYGHAMLUES-AWEZNQCLSA-N 1 2 323.396 4.330 20 0 DIADLO Cc1csc(C[N@H+](Cc2cccnc2)Cc2ccccc2C)n1 ZINC000289512004 131392621 /nfs/dbraw/zinc/39/26/21/131392621.db2.gz USTSAYGPQWWTRL-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO Cc1csc(C[N@@H+](Cc2cccnc2)Cc2ccccc2C)n1 ZINC000289512004 131392624 /nfs/dbraw/zinc/39/26/24/131392624.db2.gz USTSAYGPQWWTRL-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2sc(C(C)(C)C)nc2C)s1 ZINC000289576512 131397093 /nfs/dbraw/zinc/39/70/93/131397093.db2.gz AFYAMXKXTCICND-SECBINFHSA-N 1 2 324.519 4.014 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cn(C(C)C)nn1)c1ccc(Cl)cc1F ZINC000290060350 131449625 /nfs/dbraw/zinc/44/96/25/131449625.db2.gz HEBSYVMLCZUTOS-MRXNPFEDSA-N 1 2 324.831 4.138 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@@H]2CC=C(C)CC2)c2ccc(Cl)cc2)no1 ZINC000293553028 131745475 /nfs/dbraw/zinc/74/54/75/131745475.db2.gz HGYZSXXBDUXWOB-CVEARBPZSA-N 1 2 317.820 4.209 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2csc(Cl)n2)cc1 ZINC000296256234 131952709 /nfs/dbraw/zinc/95/27/09/131952709.db2.gz JDEBHEHQLLTTNF-NSHDSACASA-N 1 2 310.850 4.435 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(C(F)(F)F)n1)c1cc(F)ccc1F ZINC000296629060 131977490 /nfs/dbraw/zinc/97/74/90/131977490.db2.gz XIVQLRPENUYAIL-SECBINFHSA-N 1 2 316.273 4.229 20 0 DIADLO Cc1cc(NC(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)cc[nH+]1 ZINC000297673186 132028182 /nfs/dbraw/zinc/02/81/82/132028182.db2.gz GFWGLAQGJRCZNO-KRWDZBQOSA-N 1 2 307.397 4.149 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1[C@H](C)C[C@@H](c2ccccc2)[C@@H]1C ZINC000297831644 132036011 /nfs/dbraw/zinc/03/60/11/132036011.db2.gz RIDVJZHSCXBNPV-HLLBOEOZSA-N 1 2 309.413 4.188 20 0 DIADLO Cc1ccc(C[NH2+][C@H]2C[C@H](C)n3ccnc32)c(OC(C)(C)C)c1 ZINC000297834136 132036113 /nfs/dbraw/zinc/03/61/13/132036113.db2.gz SAFKQOORAOSABO-HOCLYGCPSA-N 1 2 313.445 4.164 20 0 DIADLO Cc1ccc(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)c(OC(C)(C)C)c1 ZINC000297834140 132036126 /nfs/dbraw/zinc/03/61/26/132036126.db2.gz SAFKQOORAOSABO-ZBFHGGJFSA-N 1 2 313.445 4.164 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@@H+]2Cc2cc(COC)on2)o1 ZINC000297990231 132043149 /nfs/dbraw/zinc/04/31/49/132043149.db2.gz YRFHTKFNFCTDMW-QGZVFWFLSA-N 1 2 318.417 4.094 20 0 DIADLO CCc1ccc([C@H]2CCCCC[N@H+]2Cc2cc(COC)on2)o1 ZINC000297990231 132043151 /nfs/dbraw/zinc/04/31/51/132043151.db2.gz YRFHTKFNFCTDMW-QGZVFWFLSA-N 1 2 318.417 4.094 20 0 DIADLO Cc1noc(C)c1C[N@@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000298448974 132063434 /nfs/dbraw/zinc/06/34/34/132063434.db2.gz UNNMFCULZQYOLG-BDJLRTHQSA-N 1 2 300.402 4.172 20 0 DIADLO Cc1noc(C)c1C[N@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000298448974 132063436 /nfs/dbraw/zinc/06/34/36/132063436.db2.gz UNNMFCULZQYOLG-BDJLRTHQSA-N 1 2 300.402 4.172 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCC[C@@H]3c3ccsc3)no2)cs1 ZINC000298470859 132064081 /nfs/dbraw/zinc/06/40/81/132064081.db2.gz CCCIMNCWUMBLJD-CYBMUJFWSA-N 1 2 317.439 4.197 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCC[C@@H]3c3ccsc3)no2)cs1 ZINC000298470859 132064083 /nfs/dbraw/zinc/06/40/83/132064083.db2.gz CCCIMNCWUMBLJD-CYBMUJFWSA-N 1 2 317.439 4.197 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nc(Cc2ccccc2)no1)c1ccccc1 ZINC000298729543 132075551 /nfs/dbraw/zinc/07/55/51/132075551.db2.gz OHIDORJWKAVFBR-FQEVSTJZSA-N 1 2 321.424 4.147 20 0 DIADLO FC(F)(F)c1ccc(CSCc2cn3ccccc3[nH+]2)nc1 ZINC000340620133 132093759 /nfs/dbraw/zinc/09/37/59/132093759.db2.gz FXHAPGRYZGGYRB-UHFFFAOYSA-N 1 2 323.343 4.182 20 0 DIADLO CC(C)[N@H+](Cc1cccs1)Cc1noc(-c2ccsc2)n1 ZINC000299204375 132094014 /nfs/dbraw/zinc/09/40/14/132094014.db2.gz QDCAEWAYYXYIMX-UHFFFAOYSA-N 1 2 319.455 4.270 20 0 DIADLO CC(C)[N@@H+](Cc1cccs1)Cc1noc(-c2ccsc2)n1 ZINC000299204375 132094015 /nfs/dbraw/zinc/09/40/15/132094015.db2.gz QDCAEWAYYXYIMX-UHFFFAOYSA-N 1 2 319.455 4.270 20 0 DIADLO Cc1cnc(C[N@H+]2CC=C(c3cccc4ccccc43)CC2)nc1 ZINC000340672137 132140092 /nfs/dbraw/zinc/14/00/92/132140092.db2.gz SUXFCDLXXXDBLC-UHFFFAOYSA-N 1 2 315.420 4.228 20 0 DIADLO Cc1cnc(C[N@@H+]2CC=C(c3cccc4ccccc43)CC2)nc1 ZINC000340672137 132140094 /nfs/dbraw/zinc/14/00/94/132140094.db2.gz SUXFCDLXXXDBLC-UHFFFAOYSA-N 1 2 315.420 4.228 20 0 DIADLO CCOc1ccc(C2=CCN(c3cc[nH+]c(C4CC4)n3)CC2)cc1 ZINC000121244453 132152666 /nfs/dbraw/zinc/15/26/66/132152666.db2.gz ZZAJUDVHVJEKCC-UHFFFAOYSA-N 1 2 321.424 4.046 20 0 DIADLO COc1cccc(C=C2CC[NH+](Cc3csc(C)n3)CC2)c1 ZINC000340688276 132154520 /nfs/dbraw/zinc/15/45/20/132154520.db2.gz GKSLYMGGVBMBJO-UHFFFAOYSA-N 1 2 314.454 4.140 20 0 DIADLO C[C@@H]1CC=CC[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000340749493 132177227 /nfs/dbraw/zinc/17/72/27/132177227.db2.gz IAAZDFKQBAXPIA-OCCSQVGLSA-N 1 2 315.804 4.067 20 0 DIADLO Fc1ccc2[nH]c3c(c2c1)C[N@H+](C/C=C\c1ccccc1)CC3 ZINC000514099243 335067751 /nfs/dbraw/zinc/06/77/51/335067751.db2.gz KBZFUBNVYJLDFM-DAXSKMNVSA-N 1 2 306.384 4.379 20 0 DIADLO Fc1ccc2[nH]c3c(c2c1)C[N@@H+](C/C=C\c1ccccc1)CC3 ZINC000514099243 335067753 /nfs/dbraw/zinc/06/77/53/335067753.db2.gz KBZFUBNVYJLDFM-DAXSKMNVSA-N 1 2 306.384 4.379 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2Cl)c1nc(C(C)(C)C)no1 ZINC000194524606 335074491 /nfs/dbraw/zinc/07/44/91/335074491.db2.gz JQDUDHWNWOVLQQ-QMTHXVAHSA-N 1 2 319.836 4.359 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@H](C)C(C)(F)F)cc1Br ZINC000389474874 336394739 /nfs/dbraw/zinc/39/47/39/336394739.db2.gz XRKJGQJEQGRHBT-RKDXNWHRSA-N 1 2 322.193 4.152 20 0 DIADLO CCc1nc([C@@H](C)Nc2[nH+]c(C3CC3)nc3[nH]ccc32)cs1 ZINC000631115333 435401215 /nfs/dbraw/zinc/40/12/15/435401215.db2.gz KTUZJOBQLOWCDR-SECBINFHSA-N 1 2 313.430 4.027 20 0 DIADLO Cc1cccc2cc(C(=O)N[C@H](c3[nH]cc[nH+]3)C(C)C)sc21 ZINC000574962581 332896206 /nfs/dbraw/zinc/89/62/06/332896206.db2.gz SYIDVILFBIUKGF-AWEZNQCLSA-N 1 2 313.426 4.060 20 0 DIADLO O=C(C/C=C/c1ccccc1F)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000175580011 332897206 /nfs/dbraw/zinc/89/72/06/332897206.db2.gz AHQXOEMYXAZIEL-ZZXKWVIFSA-N 1 2 321.355 4.053 20 0 DIADLO CC(C)c1noc(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)n1 ZINC000170920672 332901617 /nfs/dbraw/zinc/90/16/17/332901617.db2.gz ASPMSWKKWCLWRG-UHFFFAOYSA-N 1 2 305.809 4.015 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)C1(Cc2ccccc2)CC1 ZINC000175813198 332909596 /nfs/dbraw/zinc/90/95/96/332909596.db2.gz RXJFAARKCAHNPN-UHFFFAOYSA-N 1 2 317.392 4.038 20 0 DIADLO C[C@@H](CCOc1ccccc1-n1cc[nH+]c1)OCc1ccccc1 ZINC000530489173 331494631 /nfs/dbraw/zinc/49/46/31/331494631.db2.gz QRKTTYMFUAZZCA-KRWDZBQOSA-N 1 2 322.408 4.247 20 0 DIADLO CCC1CC[NH+](CC(=O)Nc2ccc(Cl)cc2Cl)CC1 ZINC000533416815 331523099 /nfs/dbraw/zinc/52/30/99/331523099.db2.gz CWFKDBMKLAXWSW-UHFFFAOYSA-N 1 2 315.244 4.054 20 0 DIADLO CCCCc1nc(C[NH2+]C2(c3ccc(F)cc3)CC2)cs1 ZINC000533527080 331572630 /nfs/dbraw/zinc/57/26/30/331572630.db2.gz SODIICUDNYUQNV-UHFFFAOYSA-N 1 2 304.434 4.404 20 0 DIADLO Cc1ccc([C@H]([NH2+]C[C@H]2CCC[C@H](O)C2)c2ccccc2)cc1 ZINC000180621388 331574454 /nfs/dbraw/zinc/57/44/54/331574454.db2.gz LDBATNFITRFNNK-DZFGPLHGSA-N 1 2 309.453 4.225 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000530695121 331619659 /nfs/dbraw/zinc/61/96/59/331619659.db2.gz YOTPJIAYHCWZTO-SECBINFHSA-N 1 2 314.282 4.421 20 0 DIADLO CC(C)Oc1ccccc1CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000530934062 331637349 /nfs/dbraw/zinc/63/73/49/331637349.db2.gz PRUBSCALZVKHBB-UHFFFAOYSA-N 1 2 310.319 4.500 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1)c1csnn1 ZINC000398313428 331688488 /nfs/dbraw/zinc/68/84/88/331688488.db2.gz CXBGXPWXFMYSNX-YUMQZZPRSA-N 1 2 302.230 4.257 20 0 DIADLO Cn1c2ccc(NC(=O)[C@@H]3CC=CCC3)cc2[nH+]c1C(C)(C)C ZINC000536319850 331696846 /nfs/dbraw/zinc/69/68/46/331696846.db2.gz LXYFUJVAYPDTRP-CYBMUJFWSA-N 1 2 311.429 4.166 20 0 DIADLO CN(Cc1cccc2[nH+]ccn21)Cc1c(Cl)cccc1Cl ZINC000539407941 331699819 /nfs/dbraw/zinc/69/98/19/331699819.db2.gz SERITKYTZMPACG-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)CSc2ccc(F)cc2)c(C)[nH+]1 ZINC000176191521 332927354 /nfs/dbraw/zinc/92/73/54/332927354.db2.gz AVNGIZFQWTUAFY-NSHDSACASA-N 1 2 318.417 4.204 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+][C@@H](C)c1c(F)cncc1F ZINC000556915630 331753212 /nfs/dbraw/zinc/75/32/12/331753212.db2.gz NRBGEYSBUYCLRR-RYUDHWBXSA-N 1 2 306.356 4.170 20 0 DIADLO c1[nH+]c(-c2cccc(N[C@@H]3CCC[C@H]4C[C@H]43)c2)n2c1CCCC2 ZINC000556934208 331755950 /nfs/dbraw/zinc/75/59/50/331755950.db2.gz QQWCYECVMYQOPS-GDIGMMSISA-N 1 2 307.441 4.487 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccc(F)c(Cl)c1 ZINC000158405227 331761401 /nfs/dbraw/zinc/76/14/01/331761401.db2.gz NAGQAXJWXAWTSO-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO Cc1ccc(NC(=O)c2cnc(-c3ccccc3)s2)c(C)[nH+]1 ZINC000176189674 332927040 /nfs/dbraw/zinc/92/70/40/332927040.db2.gz PTSIFAXOMHXOBS-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO Clc1cccc2c(N3CCC[C@H]3[C@H]3CCCO3)cc[nH+]c12 ZINC000557672117 331807611 /nfs/dbraw/zinc/80/76/11/331807611.db2.gz FREFFUOLYGHDKM-JKSUJKDBSA-N 1 2 302.805 4.036 20 0 DIADLO COc1cc2ccccc2cc1C[NH2+]C(C)(C)c1nccs1 ZINC000449144300 331899018 /nfs/dbraw/zinc/89/90/18/331899018.db2.gz SOEMGFNNRIFLNI-UHFFFAOYSA-N 1 2 312.438 4.330 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc([C@H]2CCCC2(C)C)n1 ZINC000558375903 331900493 /nfs/dbraw/zinc/90/04/93/331900493.db2.gz LNVIYSHADSNGOL-CYBMUJFWSA-N 1 2 324.428 4.324 20 0 DIADLO C[C@H](CC(=O)N1C[C@@H](C(C)(C)C)c2ccccc21)n1cc[nH+]c1 ZINC000521051486 331971320 /nfs/dbraw/zinc/97/13/20/331971320.db2.gz DBUHXPVJDRQUGN-GDBMZVCRSA-N 1 2 311.429 4.011 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@@H](c2ccco2)c2ccccc2)c1 ZINC000559234277 331997977 /nfs/dbraw/zinc/99/79/77/331997977.db2.gz LGKNOYAZHCNLAX-LJQANCHMSA-N 1 2 311.356 4.307 20 0 DIADLO CCc1nc(CSCc2cn3cccc(C)c3[nH+]2)cs1 ZINC000084495516 332003195 /nfs/dbraw/zinc/00/31/95/332003195.db2.gz XETTYSJKKWMUPE-UHFFFAOYSA-N 1 2 303.456 4.095 20 0 DIADLO CSCc1cnc(C[NH2+]C2(c3cccc(Cl)c3)CC2)s1 ZINC000559273293 332012064 /nfs/dbraw/zinc/01/20/64/332012064.db2.gz NAMNHHQXOUVMJW-UHFFFAOYSA-N 1 2 324.902 4.438 20 0 DIADLO c1cn(-c2ccc(CNc3ccc4ncccc4c3)cc2)c[nH+]1 ZINC000128515922 332012754 /nfs/dbraw/zinc/01/27/54/332012754.db2.gz TZQCUWFZHWSITN-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO CC(F)(F)C[NH2+]CC1=Cc2cc(Cl)cc(Cl)c2OC1 ZINC000559323612 332025366 /nfs/dbraw/zinc/02/53/66/332025366.db2.gz UUQKPLYDFGMTBS-UHFFFAOYSA-N 1 2 308.155 4.014 20 0 DIADLO Clc1ccc(C[N@@H+]2CCC23CCC3)c(Br)c1 ZINC000531416788 333350383 /nfs/dbraw/zinc/35/03/83/333350383.db2.gz CIBYWHXDKGOLTJ-UHFFFAOYSA-N 1 2 300.627 4.231 20 0 DIADLO Clc1ccc(C[N@H+]2CCC23CCC3)c(Br)c1 ZINC000531416788 333350384 /nfs/dbraw/zinc/35/03/84/333350384.db2.gz CIBYWHXDKGOLTJ-UHFFFAOYSA-N 1 2 300.627 4.231 20 0 DIADLO COc1c(C)cnc(C[N@H+](C)[C@H](C)c2ccccc2F)c1C ZINC000409447075 332031248 /nfs/dbraw/zinc/03/12/48/332031248.db2.gz ZRSUQJHIIXVZIC-CQSZACIVSA-N 1 2 302.393 4.039 20 0 DIADLO COc1c(C)cnc(C[N@@H+](C)[C@H](C)c2ccccc2F)c1C ZINC000409447075 332031249 /nfs/dbraw/zinc/03/12/49/332031249.db2.gz ZRSUQJHIIXVZIC-CQSZACIVSA-N 1 2 302.393 4.039 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)o1 ZINC000409446928 332031294 /nfs/dbraw/zinc/03/12/94/332031294.db2.gz IFMWAGLVSWXRQV-SNVBAGLBSA-N 1 2 304.356 4.135 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)o1 ZINC000409446928 332031295 /nfs/dbraw/zinc/03/12/95/332031295.db2.gz IFMWAGLVSWXRQV-SNVBAGLBSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1CC[C@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)CC1 ZINC000569382142 332071093 /nfs/dbraw/zinc/07/10/93/332071093.db2.gz QTJDHPBHWILIQT-SHTZXODSSA-N 1 2 310.397 4.182 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)s1 ZINC000569438165 332082822 /nfs/dbraw/zinc/08/28/22/332082822.db2.gz QPERHBSGQVNBKP-KRWDZBQOSA-N 1 2 304.434 4.337 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC[C@@](F)(c3ccccc3)C2)s1 ZINC000569438165 332082824 /nfs/dbraw/zinc/08/28/24/332082824.db2.gz QPERHBSGQVNBKP-KRWDZBQOSA-N 1 2 304.434 4.337 20 0 DIADLO FC(F)C[N@H+](CCCCC1CCOCC1)Cc1ccccc1 ZINC000410394597 332122009 /nfs/dbraw/zinc/12/20/09/332122009.db2.gz CAMZGIGXOIXDBS-UHFFFAOYSA-N 1 2 311.416 4.351 20 0 DIADLO FC(F)C[N@@H+](CCCCC1CCOCC1)Cc1ccccc1 ZINC000410394597 332122011 /nfs/dbraw/zinc/12/20/11/332122011.db2.gz CAMZGIGXOIXDBS-UHFFFAOYSA-N 1 2 311.416 4.351 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccccc2OCc2ccccc2)no1 ZINC000092254396 332122836 /nfs/dbraw/zinc/12/28/36/332122836.db2.gz MEKTVAISGLRGGD-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccccc2OCc2ccccc2)no1 ZINC000092254396 332122837 /nfs/dbraw/zinc/12/28/37/332122837.db2.gz MEKTVAISGLRGGD-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+]2CCCc3occc3C2)o1 ZINC000569527279 332124306 /nfs/dbraw/zinc/12/43/06/332124306.db2.gz AENDAOFNSZOZII-UHFFFAOYSA-N 1 2 308.381 4.191 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+]2CCCc3occc3C2)o1 ZINC000569527279 332124308 /nfs/dbraw/zinc/12/43/08/332124308.db2.gz AENDAOFNSZOZII-UHFFFAOYSA-N 1 2 308.381 4.191 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCO[C@@H](c3ccsc3)C2)cc1F ZINC000569529795 332126822 /nfs/dbraw/zinc/12/68/22/332126822.db2.gz BCEJGJZZZLFGOD-NLVOMGJBSA-N 1 2 321.392 4.113 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCO[C@@H](c3ccsc3)C2)cc1F ZINC000569529795 332126824 /nfs/dbraw/zinc/12/68/24/332126824.db2.gz BCEJGJZZZLFGOD-NLVOMGJBSA-N 1 2 321.392 4.113 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2cc(F)ccc2F)o1 ZINC000165216155 332133369 /nfs/dbraw/zinc/13/33/69/332133369.db2.gz KHMRJZODDKAEPS-BZNIZROVSA-N 1 2 309.356 4.159 20 0 DIADLO Cc1cccnc1C[N@H+]1C[C@H](c2ccccc2Cl)OC[C@@H]1C ZINC000093173511 332135048 /nfs/dbraw/zinc/13/50/48/332135048.db2.gz WXYUABJLHXNUML-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cccnc1C[N@@H+]1C[C@H](c2ccccc2Cl)OC[C@@H]1C ZINC000093173511 332135049 /nfs/dbraw/zinc/13/50/49/332135049.db2.gz WXYUABJLHXNUML-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO CC(C)CN(C(=O)C[C@@H](C)n1cc[nH+]c1)c1ccccc1Cl ZINC000569581964 332144396 /nfs/dbraw/zinc/14/43/96/332144396.db2.gz OLVVLRZSORORCR-CQSZACIVSA-N 1 2 319.836 4.177 20 0 DIADLO CCC[C@@H](CC1CCCCC1)C(=O)N(C)CCCn1cc[nH+]c1 ZINC000427105909 332167782 /nfs/dbraw/zinc/16/77/82/332167782.db2.gz BDZPTXXCNQWTIZ-SFHVURJKSA-N 1 2 319.493 4.118 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cc(C)cc(F)c2)[nH+]1 ZINC000427181857 332182224 /nfs/dbraw/zinc/18/22/24/332182224.db2.gz JWMITQUMEGMSAO-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@H](C)c2cccc(Cl)c2)n1 ZINC000181412704 332193935 /nfs/dbraw/zinc/19/39/35/332193935.db2.gz KWILTIIAZYKDAT-GFCCVEGCSA-N 1 2 307.825 4.162 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2c(F)cccc2Cl)C2CC2)n1 ZINC000181596977 332201423 /nfs/dbraw/zinc/20/14/23/332201423.db2.gz IPSUNEUYRQRENR-CQSZACIVSA-N 1 2 310.825 4.485 20 0 DIADLO CC[N@H+](CC(=O)c1cc(C)n(C)c1C)Cc1ccc(Cl)s1 ZINC000531016560 332211362 /nfs/dbraw/zinc/21/13/62/332211362.db2.gz LPWMGPKDPZDZIH-UHFFFAOYSA-N 1 2 324.877 4.062 20 0 DIADLO CC[N@@H+](CC(=O)c1cc(C)n(C)c1C)Cc1ccc(Cl)s1 ZINC000531016560 332211364 /nfs/dbraw/zinc/21/13/64/332211364.db2.gz LPWMGPKDPZDZIH-UHFFFAOYSA-N 1 2 324.877 4.062 20 0 DIADLO CCc1ccccc1[C@@H]1C[C@H]1c1nc(Cc2ccc[nH+]c2C)no1 ZINC000563876483 335095896 /nfs/dbraw/zinc/09/58/96/335095896.db2.gz OUCSSENHJFEYSE-ZWKOTPCHSA-N 1 2 319.408 4.197 20 0 DIADLO FC(F)[C@H]1CCCCN1CCCC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000554567362 332236387 /nfs/dbraw/zinc/23/63/87/332236387.db2.gz DCZKDSJIMYJONT-ZIAGYGMSSA-N 1 2 324.406 4.006 20 0 DIADLO FC(F)[C@H]1CCCCN1CCCC[N@H+]1CCCC[C@@H]1C(F)F ZINC000554567362 332236388 /nfs/dbraw/zinc/23/63/88/332236388.db2.gz DCZKDSJIMYJONT-ZIAGYGMSSA-N 1 2 324.406 4.006 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3ccc(Cl)cc3C2)nc2ccccc12 ZINC000536415971 332240787 /nfs/dbraw/zinc/24/07/87/332240787.db2.gz KRSPVBCWJHTGQM-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1nc(C[N@H+]2CCc3ccc(Cl)cc3C2)nc2ccccc12 ZINC000536415971 332240789 /nfs/dbraw/zinc/24/07/89/332240789.db2.gz KRSPVBCWJHTGQM-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO CN(Cc1ccc(F)cc1F)c1cc(C(F)(F)F)cc[nH+]1 ZINC000531065372 332243530 /nfs/dbraw/zinc/24/35/30/332243530.db2.gz WRIBVTHPRUPVOS-UHFFFAOYSA-N 1 2 302.246 4.015 20 0 DIADLO C[N@H+](Cc1ccn(C2CCCC2)n1)Cc1ccc(Cl)c(F)c1 ZINC000536487337 332251845 /nfs/dbraw/zinc/25/18/45/332251845.db2.gz AXLQGGNNUMXSGI-UHFFFAOYSA-N 1 2 321.827 4.423 20 0 DIADLO C[N@@H+](Cc1ccn(C2CCCC2)n1)Cc1ccc(Cl)c(F)c1 ZINC000536487337 332251846 /nfs/dbraw/zinc/25/18/46/332251846.db2.gz AXLQGGNNUMXSGI-UHFFFAOYSA-N 1 2 321.827 4.423 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+][C@@H](C)c3nnc(C(C)C)[nH]3)o2)cc1 ZINC000536498905 332253160 /nfs/dbraw/zinc/25/31/60/332253160.db2.gz PAZRLOVOXJIABD-AWEZNQCLSA-N 1 2 324.428 4.347 20 0 DIADLO C[C@@H]([NH2+]Cc1ccsc1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000371058175 332268880 /nfs/dbraw/zinc/26/88/80/332268880.db2.gz ZYNUUOWZHGXSFG-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO CCCn1nc(C)c(C[N@H+](C)Cc2cc(Cl)ccc2F)c1C ZINC000559958442 332296997 /nfs/dbraw/zinc/29/69/97/332296997.db2.gz HIKKBHLQMNARAO-UHFFFAOYSA-N 1 2 323.843 4.334 20 0 DIADLO CCCn1nc(C)c(C[N@@H+](C)Cc2cc(Cl)ccc2F)c1C ZINC000559958442 332296998 /nfs/dbraw/zinc/29/69/98/332296998.db2.gz HIKKBHLQMNARAO-UHFFFAOYSA-N 1 2 323.843 4.334 20 0 DIADLO COC1CCC(N(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)CC1 ZINC000560075043 332309047 /nfs/dbraw/zinc/30/90/47/332309047.db2.gz AHPZJROQYYGWEX-UHFFFAOYSA-N 1 2 305.466 4.117 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)C[C@H](C)O1 ZINC000560258120 332325289 /nfs/dbraw/zinc/32/52/89/332325289.db2.gz SSPCMGIULWFUTR-TXEJJXNPSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)C[C@H](C)O1 ZINC000560258120 332325291 /nfs/dbraw/zinc/32/52/91/332325291.db2.gz SSPCMGIULWFUTR-TXEJJXNPSA-N 1 2 322.861 4.073 20 0 DIADLO Clc1ccc(-c2ccc(CN3CCn4cc[nH+]c4C3)cc2)cc1 ZINC000560257877 332325386 /nfs/dbraw/zinc/32/53/86/332325386.db2.gz DSIHWRKTOUURLY-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)n1 ZINC000114747051 332328871 /nfs/dbraw/zinc/32/88/71/332328871.db2.gz XMTCVRHSNMNXMO-NXEZZACHSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3ccc(C4CCC4)cc3)ccc2n1C ZINC000583356670 332349149 /nfs/dbraw/zinc/34/91/49/332349149.db2.gz ZHBKTXZPLFAFDE-UHFFFAOYSA-N 1 2 319.408 4.402 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@H](C)Cc3ccc(O)cc3)cc2)c1C ZINC000560533268 332353616 /nfs/dbraw/zinc/35/36/16/332353616.db2.gz AGZCNSHFYBJAGR-CQSZACIVSA-N 1 2 321.424 4.238 20 0 DIADLO CCc1ccc(CCC(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)cc1 ZINC000560585776 332365444 /nfs/dbraw/zinc/36/54/44/332365444.db2.gz VXIODXGGHZQBSS-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO CC[C@]1(C)C[C@H]1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000425566751 335103412 /nfs/dbraw/zinc/10/34/12/335103412.db2.gz IFLOLWNYEGQTIU-OXJNMPFZSA-N 1 2 323.440 4.261 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)CCc1cccc(F)c1 ZINC000425585912 335107081 /nfs/dbraw/zinc/10/70/81/335107081.db2.gz JGWMHMYZTSOOGQ-CYBMUJFWSA-N 1 2 300.377 4.045 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)CCc1cccc(F)c1 ZINC000425585914 335107151 /nfs/dbraw/zinc/10/71/51/335107151.db2.gz JGWMHMYZTSOOGQ-ZDUSSCGKSA-N 1 2 300.377 4.045 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)CCOc1ccc(C(C)C)cc1 ZINC000425586421 335107205 /nfs/dbraw/zinc/10/72/05/335107205.db2.gz KTKIIKTXDKHWJZ-UHFFFAOYSA-N 1 2 312.413 4.229 20 0 DIADLO CCCOc1ccc(CCC(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000425588443 335107576 /nfs/dbraw/zinc/10/75/76/335107576.db2.gz QCANBJISCRAJII-UHFFFAOYSA-N 1 2 312.413 4.059 20 0 DIADLO Cc1cc(NC(=O)c2cscc2-c2ccccc2)c(C)c[nH+]1 ZINC000564697143 332385238 /nfs/dbraw/zinc/38/52/38/332385238.db2.gz OKXLFVPTHGMWFX-UHFFFAOYSA-N 1 2 308.406 4.101 20 0 DIADLO CCCN(CC)c1ccc(C(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000425589513 335108106 /nfs/dbraw/zinc/10/81/06/335108106.db2.gz SVUWJRQBNKAJRL-UHFFFAOYSA-N 1 2 311.429 4.187 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@H](C)c1cncs1)c1ccco1 ZINC000560917282 332394071 /nfs/dbraw/zinc/39/40/71/332394071.db2.gz GFJPAQLBNZLKPM-PXAZEXFGSA-N 1 2 314.410 4.185 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1cncs1)c1ccco1 ZINC000560917289 332394148 /nfs/dbraw/zinc/39/41/48/332394148.db2.gz GFJPAQLBNZLKPM-SJKOYZFVSA-N 1 2 314.410 4.185 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1cc(C2CC2)nc2ccccc21 ZINC000425590839 335108536 /nfs/dbraw/zinc/10/85/36/335108536.db2.gz XZZVPLBCJJKTJL-UHFFFAOYSA-N 1 2 317.392 4.376 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000425590796 335108599 /nfs/dbraw/zinc/10/85/99/335108599.db2.gz XVOUHPYYRMFODP-NWDGAFQWSA-N 1 2 300.324 4.006 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000425583456 335106642 /nfs/dbraw/zinc/10/66/42/335106642.db2.gz ABBVYROISFXOHU-RYUDHWBXSA-N 1 2 318.779 4.233 20 0 DIADLO CCCc1ncc(C[NH2+]Cc2csc(-c3ccsc3)n2)o1 ZINC000449614850 332449717 /nfs/dbraw/zinc/44/97/17/332449717.db2.gz XIGSVFQSDMJWFJ-UHFFFAOYSA-N 1 2 319.455 4.102 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc(C3CCC3)cc2)cc(C)[nH+]1 ZINC000561482246 332455235 /nfs/dbraw/zinc/45/52/35/332455235.db2.gz MIKRNAKZKLFOLW-UHFFFAOYSA-N 1 2 309.413 4.288 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+]Cc2cccc(Cl)c2F)o1 ZINC000150993917 332472889 /nfs/dbraw/zinc/47/28/89/332472889.db2.gz JRPGMTMLPFZMFC-CQSZACIVSA-N 1 2 311.784 4.112 20 0 DIADLO CCCc1nc(C)c(C[NH2+][C@H](COCC(C)C)c2ccco2)o1 ZINC000428353778 332521582 /nfs/dbraw/zinc/52/15/82/332521582.db2.gz WPFARCWYWGQAFM-OAHLLOKOSA-N 1 2 320.433 4.032 20 0 DIADLO c1c(-c2ccc(N[C@H]3CC[C@@H]3C3CC3)cc2)[nH+]c2n1CCCC2 ZINC000562079276 332543452 /nfs/dbraw/zinc/54/34/52/332543452.db2.gz GCCBNIRVCURMEG-MSOLQXFVSA-N 1 2 307.441 4.487 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccn(C(C)C)n1)c1cccc(Cl)c1F ZINC000562266225 332566029 /nfs/dbraw/zinc/56/60/29/332566029.db2.gz MBWMOVQTMJNKNR-OAHLLOKOSA-N 1 2 309.816 4.497 20 0 DIADLO C[C@@H](NC(=O)c1ccc2[nH+]ccn2c1)c1cc2ccccc2s1 ZINC000171726241 332650817 /nfs/dbraw/zinc/65/08/17/332650817.db2.gz NUBKFVHLKOLSJO-GFCCVEGCSA-N 1 2 321.405 4.040 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+][C@H]2CC[C@@H](F)C2)C(F)F)c1 ZINC000570224817 332727660 /nfs/dbraw/zinc/72/76/60/332727660.db2.gz GTKLQBDGDQNNDF-IPYPFGDCSA-N 1 2 301.352 4.260 20 0 DIADLO Cc1ccccc1-c1cnc(C[NH2+][C@@H](C)c2cccc(O)c2)o1 ZINC000580152505 332965600 /nfs/dbraw/zinc/96/56/00/332965600.db2.gz RWGWOLWBHPNZHM-AWEZNQCLSA-N 1 2 308.381 4.206 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2cccc(F)c2)n1)c1cccc(O)c1 ZINC000181539896 333031137 /nfs/dbraw/zinc/03/11/37/333031137.db2.gz UOXJORRSCHYPOP-GFCCVEGCSA-N 1 2 312.344 4.037 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[NH2+][C@@H](C)c3cccc(O)c3)o2)cc1 ZINC000181550799 333031165 /nfs/dbraw/zinc/03/11/65/333031165.db2.gz OIEWPWCZULVALD-KBPBESRZSA-N 1 2 323.396 4.162 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CCCC2)no1)c1cc2ccccc2o1 ZINC000182627766 333043795 /nfs/dbraw/zinc/04/37/95/333043795.db2.gz VFSHXDTXSOKTCP-GFCCVEGCSA-N 1 2 311.385 4.324 20 0 DIADLO COC(=O)c1sccc1C[N@H+](C)[C@H](C)c1ccc(Cl)cc1 ZINC000378678477 333044474 /nfs/dbraw/zinc/04/44/74/333044474.db2.gz QSNDQVBAPFJTLO-LLVKDONJSA-N 1 2 323.845 4.381 20 0 DIADLO COC(=O)c1sccc1C[N@@H+](C)[C@H](C)c1ccc(Cl)cc1 ZINC000378678477 333044475 /nfs/dbraw/zinc/04/44/75/333044475.db2.gz QSNDQVBAPFJTLO-LLVKDONJSA-N 1 2 323.845 4.381 20 0 DIADLO CC(C)c1cc(N2CCC=C(c3ccncc3)C2)nc(C(C)C)[nH+]1 ZINC000580344576 335118302 /nfs/dbraw/zinc/11/83/02/335118302.db2.gz MUFRWMRALMNLMG-UHFFFAOYSA-N 1 2 322.456 4.412 20 0 DIADLO Cc1oncc1C[NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl ZINC000189316689 333072329 /nfs/dbraw/zinc/07/23/29/333072329.db2.gz JEGZSEPYXOXFCL-ZETCQYMHSA-N 1 2 303.164 4.280 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1OC(F)F)c1c(F)cccc1F ZINC000314106122 333087755 /nfs/dbraw/zinc/08/77/55/333087755.db2.gz BYYCYINHPFTFTR-SNVBAGLBSA-N 1 2 313.294 4.417 20 0 DIADLO CC(C)(C)c1[nH]c2ccc(NC(=O)[C@@H]3Cc4ccccc43)cc2[nH+]1 ZINC000460695565 333125906 /nfs/dbraw/zinc/12/59/06/333125906.db2.gz HUALHLKBRXBCKM-OAHLLOKOSA-N 1 2 319.408 4.139 20 0 DIADLO CCC1(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)CCCCC1 ZINC000460720300 333128548 /nfs/dbraw/zinc/12/85/48/333128548.db2.gz SUKSSEJUDQGSEO-UHFFFAOYSA-N 1 2 311.429 4.386 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc([C@H]2CCC[C@H](C)C2)n1 ZINC000460747844 333133605 /nfs/dbraw/zinc/13/36/05/333133605.db2.gz JBZMCRHRPBIWRU-KBPBESRZSA-N 1 2 324.428 4.324 20 0 DIADLO CCC(=Cc1nc(CCn2c(C)[nH+]c3ccccc32)no1)CC ZINC000460825336 333144728 /nfs/dbraw/zinc/14/47/28/333144728.db2.gz STBJOQNUPLVLIQ-UHFFFAOYSA-N 1 2 310.401 4.174 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2ccccn2)c(Br)c1 ZINC000182066022 333148612 /nfs/dbraw/zinc/14/86/12/333148612.db2.gz ABKQRPKGPSQQGT-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccccn2)c(Br)c1 ZINC000182066022 333148613 /nfs/dbraw/zinc/14/86/13/333148613.db2.gz ABKQRPKGPSQQGT-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO CCc1noc(CC)c1C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000180739685 333165044 /nfs/dbraw/zinc/16/50/44/333165044.db2.gz ZTPCJMPRAVHXAI-FQEVSTJZSA-N 1 2 321.424 4.074 20 0 DIADLO CCn1c[nH+]cc1CN(Cc1ccco1)Cc1ccc(C)s1 ZINC000417764549 335125966 /nfs/dbraw/zinc/12/59/66/335125966.db2.gz XDKJBKMUIIKBSJ-UHFFFAOYSA-N 1 2 315.442 4.068 20 0 DIADLO Clc1ccc(C[NH2+]Cc2nc3cc(Cl)ccc3s2)o1 ZINC000518779422 333168548 /nfs/dbraw/zinc/16/85/48/333168548.db2.gz PPLIMLSOBVTSDR-UHFFFAOYSA-N 1 2 313.209 4.486 20 0 DIADLO CC[C@H](C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1)c1ccc(F)cc1 ZINC000460857590 333170121 /nfs/dbraw/zinc/17/01/21/333170121.db2.gz HSQUYHWCKKGHSF-HNNXBMFYSA-N 1 2 311.360 4.143 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2ccsc2Br)n1 ZINC000388726924 333171076 /nfs/dbraw/zinc/17/10/76/333171076.db2.gz BTOKJMDNMOEORF-MRVPVSSYSA-N 1 2 317.277 4.126 20 0 DIADLO Cn1ccnc1C[N@@H+]1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000522711521 333172677 /nfs/dbraw/zinc/17/26/77/333172677.db2.gz CLYVMKGAPMDGKO-INIZCTEOSA-N 1 2 303.837 4.191 20 0 DIADLO Cn1ccnc1C[N@H+]1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000522711521 333172679 /nfs/dbraw/zinc/17/26/79/333172679.db2.gz CLYVMKGAPMDGKO-INIZCTEOSA-N 1 2 303.837 4.191 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3ccc(C(C)C)cc3)ccc2n1C ZINC000525724636 333191550 /nfs/dbraw/zinc/19/15/50/333191550.db2.gz IIZWGAZCAXNANH-UHFFFAOYSA-N 1 2 307.397 4.257 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3ccc(C(C)(C)C)cc3)ccc2n1C ZINC000525731057 333201612 /nfs/dbraw/zinc/20/16/12/333201612.db2.gz IQDLZXMVVOMVTR-UHFFFAOYSA-N 1 2 321.424 4.432 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+](C)Cc1cccc(F)c1 ZINC000216272935 333204366 /nfs/dbraw/zinc/20/43/66/333204366.db2.gz ADSRRILISIGCBQ-UHFFFAOYSA-N 1 2 315.388 4.059 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+](C)Cc1cccc(F)c1 ZINC000216272935 333204367 /nfs/dbraw/zinc/20/43/67/333204367.db2.gz ADSRRILISIGCBQ-UHFFFAOYSA-N 1 2 315.388 4.059 20 0 DIADLO Cc1cc(C)cc(C[NH2+][C@@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000185403284 333208368 /nfs/dbraw/zinc/20/83/68/333208368.db2.gz PVZPOKFYKHYKEX-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO COc1cncc(/C=C/CC[NH2+][C@@H](C(C)(C)C)C(F)(F)F)c1 ZINC000581187852 333240811 /nfs/dbraw/zinc/24/08/11/333240811.db2.gz IXDDTQABHKLSEP-DYLGSBMWSA-N 1 2 316.367 4.060 20 0 DIADLO CCCCc1nc(C[N@H+](C)[C@@H](c2ccccc2)C(C)C)no1 ZINC000497385026 333243592 /nfs/dbraw/zinc/24/35/92/333243592.db2.gz FXPUYXWEKATYSK-GOSISDBHSA-N 1 2 301.434 4.241 20 0 DIADLO CCCCc1nc(C[N@@H+](C)[C@@H](c2ccccc2)C(C)C)no1 ZINC000497385026 333243593 /nfs/dbraw/zinc/24/35/93/333243593.db2.gz FXPUYXWEKATYSK-GOSISDBHSA-N 1 2 301.434 4.241 20 0 DIADLO CCCCOc1ccc(CNc2cccc[nH+]2)cc1OCC ZINC000019778026 333245716 /nfs/dbraw/zinc/24/57/16/333245716.db2.gz GCWBGPWLMNQUOR-UHFFFAOYSA-N 1 2 300.402 4.271 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000497590511 333266236 /nfs/dbraw/zinc/26/62/36/333266236.db2.gz IRSLCDMLYNZWHI-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000497590511 333266238 /nfs/dbraw/zinc/26/62/38/333266238.db2.gz IRSLCDMLYNZWHI-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO CCCc1noc(C[NH2+]C(C)(C)c2ccc(C(C)(C)C)cc2)n1 ZINC000540407475 333274180 /nfs/dbraw/zinc/27/41/80/333274180.db2.gz ZODRUVRYOXJJBI-UHFFFAOYSA-N 1 2 315.461 4.345 20 0 DIADLO C[C@H](CC(=O)N1CCC[C@H]1c1[nH]c2c([nH+]1)CCCC2)C(C)(C)C ZINC000497670672 333276446 /nfs/dbraw/zinc/27/64/46/333276446.db2.gz HNRICHZJPFVNKD-CJNGLKHVSA-N 1 2 317.477 4.024 20 0 DIADLO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1nc2c(s1)CCC2 ZINC000497694775 333279207 /nfs/dbraw/zinc/27/92/07/333279207.db2.gz YWDBDFHDSWYBMV-MDZLAQPJSA-N 1 2 302.443 4.199 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1nc2c(s1)CCC2 ZINC000497710504 333280919 /nfs/dbraw/zinc/28/09/19/333280919.db2.gz JYPHUNGKZHFIOH-UWVGGRQHSA-N 1 2 308.397 4.322 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@H](c3ccccc3)C3CC3)cc2[nH+]1 ZINC000497897169 333306629 /nfs/dbraw/zinc/30/66/29/333306629.db2.gz YGKPFOZZWDFAAM-GOSISDBHSA-N 1 2 305.381 4.004 20 0 DIADLO CCCCN(C(=O)CCc1[nH]cc[nH+]1)[C@H](CC)c1ccccc1 ZINC000498012698 333320669 /nfs/dbraw/zinc/32/06/69/333320669.db2.gz MEEJNVZXNZTVFS-QGZVFWFLSA-N 1 2 313.445 4.122 20 0 DIADLO c1csc(-c2cnc(C[N@@H+]3CCC[C@@H]3c3ccccn3)o2)c1 ZINC000531201742 333330784 /nfs/dbraw/zinc/33/07/84/333330784.db2.gz BWQBNPAFMFKHAO-CQSZACIVSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2cnc(C[N@H+]3CCC[C@@H]3c3ccccn3)o2)c1 ZINC000531201742 333330785 /nfs/dbraw/zinc/33/07/85/333330785.db2.gz BWQBNPAFMFKHAO-CQSZACIVSA-N 1 2 311.410 4.135 20 0 DIADLO CCN(C(=O)Cn1c(C)[nH+]c2ccccc21)c1cc(C)cc(C)c1 ZINC000531368083 333346577 /nfs/dbraw/zinc/34/65/77/333346577.db2.gz AXRWVWBJKBOGSK-UHFFFAOYSA-N 1 2 321.424 4.015 20 0 DIADLO Clc1ccc(Cl)c(CC[N@@H+]2CCC[C@@H]2c2ncc[nH]2)c1 ZINC000488123353 333362767 /nfs/dbraw/zinc/36/27/67/333362767.db2.gz IIHVZRBNCIOXDH-CQSZACIVSA-N 1 2 310.228 4.096 20 0 DIADLO Clc1ccc(Cl)c(CC[N@H+]2CCC[C@@H]2c2ncc[nH]2)c1 ZINC000488123353 333362768 /nfs/dbraw/zinc/36/27/68/333362768.db2.gz IIHVZRBNCIOXDH-CQSZACIVSA-N 1 2 310.228 4.096 20 0 DIADLO O=C(CCCC1CCCC1)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000463283047 333369749 /nfs/dbraw/zinc/36/97/49/333369749.db2.gz NILJMLVXIRBPHW-UHFFFAOYSA-N 1 2 315.392 4.310 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCCCC[C@@H]2c2ccccc2)no1 ZINC000521426133 333381208 /nfs/dbraw/zinc/38/12/08/333381208.db2.gz CUFUDPSRDAGLRJ-MRXNPFEDSA-N 1 2 313.445 4.484 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCCCC[C@@H]2c2ccccc2)no1 ZINC000521426133 333381210 /nfs/dbraw/zinc/38/12/10/333381210.db2.gz CUFUDPSRDAGLRJ-MRXNPFEDSA-N 1 2 313.445 4.484 20 0 DIADLO Clc1ccc([C@@H]2CCC[N@@H+]2Cc2cnccn2)cc1Cl ZINC000563090481 333386470 /nfs/dbraw/zinc/38/64/70/333386470.db2.gz TXPKZHNBTCGQOY-HNNXBMFYSA-N 1 2 308.212 4.121 20 0 DIADLO Clc1ccc([C@@H]2CCC[N@H+]2Cc2cnccn2)cc1Cl ZINC000563090481 333386471 /nfs/dbraw/zinc/38/64/71/333386471.db2.gz TXPKZHNBTCGQOY-HNNXBMFYSA-N 1 2 308.212 4.121 20 0 DIADLO Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)Nc1cc[nH+]cc1C ZINC000121462144 333386474 /nfs/dbraw/zinc/38/64/74/333386474.db2.gz RWCAQISKTLHWAY-HNNXBMFYSA-N 1 2 313.401 4.127 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@@H+]1Cc1cnccn1 ZINC000563090915 333386824 /nfs/dbraw/zinc/38/68/24/333386824.db2.gz IGBIYFNOTNWMOS-MRXNPFEDSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@H+]1Cc1cnccn1 ZINC000563090915 333386825 /nfs/dbraw/zinc/38/68/25/333386825.db2.gz IGBIYFNOTNWMOS-MRXNPFEDSA-N 1 2 321.346 4.223 20 0 DIADLO Cc1cccc2[nH+]c(CN(C)[C@H](C)c3c(F)cccc3F)cn21 ZINC000337496769 333450329 /nfs/dbraw/zinc/45/03/29/333450329.db2.gz GGCMNSVMEOTJBM-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO CCn1c[nH+]cc1CN(Cc1cc(F)ccc1F)C1CCCC1 ZINC000417779728 335142542 /nfs/dbraw/zinc/14/25/42/335142542.db2.gz HCOBSEWUXLWICU-UHFFFAOYSA-N 1 2 319.399 4.126 20 0 DIADLO Cn1c2ccccc2[nH+]c1N1CC[C@H](CSc2ccccc2)C1 ZINC000534235604 333568355 /nfs/dbraw/zinc/56/83/55/333568355.db2.gz OHRSYTLWSBYEGW-HNNXBMFYSA-N 1 2 323.465 4.192 20 0 DIADLO C[C@H]([NH2+][C@@H](CC(F)(F)F)c1ccccc1)c1cscn1 ZINC000534329622 333577649 /nfs/dbraw/zinc/57/76/49/333577649.db2.gz REZWGTZBEBEVDO-JQWIXIFHSA-N 1 2 300.349 4.487 20 0 DIADLO Cc1cccc([C@@H](c2noc(C[C@H](C)n3cc[nH+]c3)n2)C(C)C)c1 ZINC000571170728 333676011 /nfs/dbraw/zinc/67/60/11/333676011.db2.gz IXDUMCOKWCMNNN-YJBOKZPZSA-N 1 2 324.428 4.166 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2c1cc(Cl)cc2Cl)c1csnn1 ZINC000412036502 333725128 /nfs/dbraw/zinc/72/51/28/333725128.db2.gz IHCJSEBEVPGDJH-MADCSZMMSA-N 1 2 314.241 4.183 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1Cl)N1CCn2cc[nH+]c2C1 ZINC000445250375 333761629 /nfs/dbraw/zinc/76/16/29/333761629.db2.gz QCEYHZBXYFZIFZ-CQSZACIVSA-N 1 2 310.228 4.157 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)o1 ZINC000343380604 335160539 /nfs/dbraw/zinc/16/05/39/335160539.db2.gz KYFHIRXFECQPNA-YHYOWMERSA-N 1 2 319.836 4.333 20 0 DIADLO CC[C@@H](C)CS[C@H](C)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000413002853 333824915 /nfs/dbraw/zinc/82/49/15/333824915.db2.gz VGKMUNAHMAEVEM-CHWSQXEVSA-N 1 2 317.458 4.183 20 0 DIADLO CC[C@@H](CC(C)C)C(=O)N(C)[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000413818395 333875189 /nfs/dbraw/zinc/87/51/89/333875189.db2.gz NVYRLQAIXPDMGE-RDJZCZTQSA-N 1 2 313.445 4.030 20 0 DIADLO C[C@@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)c1cc2n(n1)CCC2 ZINC000414083397 333893190 /nfs/dbraw/zinc/89/31/90/333893190.db2.gz WPSVUCUVDSOFIA-MLGOLLRUSA-N 1 2 323.362 4.174 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCC[S@](=O)CC(C)(C)C ZINC000414247525 333919859 /nfs/dbraw/zinc/91/98/59/333919859.db2.gz UEJWSQOCRSYAJY-QFIPXVFZSA-N 1 2 320.502 4.310 20 0 DIADLO CCn1ccc(C[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)n1 ZINC000414211239 333922100 /nfs/dbraw/zinc/92/21/00/333922100.db2.gz PQASRCHHOPIJRH-VIFPVBQESA-N 1 2 316.207 4.200 20 0 DIADLO Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]Cc1nccc(C(F)(F)F)n1 ZINC000414258660 333928725 /nfs/dbraw/zinc/92/87/25/333928725.db2.gz PMOVXFVUIGTIJD-AAEUAGOBSA-N 1 2 321.346 4.142 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(OC(C)(C)C)cc1)c1csnn1 ZINC000414292239 333934566 /nfs/dbraw/zinc/93/45/66/333934566.db2.gz BVWJDUCAWNVRJS-RYUDHWBXSA-N 1 2 305.447 4.127 20 0 DIADLO CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H](C)c1csnn1)CCC2 ZINC000414305251 333943975 /nfs/dbraw/zinc/94/39/75/333943975.db2.gz PUEAENVSDXVTHN-MLGOLLRUSA-N 1 2 301.459 4.390 20 0 DIADLO CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1csnn1)CCC2 ZINC000414305254 333943980 /nfs/dbraw/zinc/94/39/80/333943980.db2.gz PUEAENVSDXVTHN-WBMJQRKESA-N 1 2 301.459 4.390 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+](Cc1ccccc1F)C1CC1 ZINC000343500459 335169824 /nfs/dbraw/zinc/16/98/24/335169824.db2.gz AMLHOPJLEUPRNK-UHFFFAOYSA-N 1 2 301.409 4.076 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+](Cc1ccccc1F)C1CC1 ZINC000343500459 335169825 /nfs/dbraw/zinc/16/98/25/335169825.db2.gz AMLHOPJLEUPRNK-UHFFFAOYSA-N 1 2 301.409 4.076 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1Cl)c1csnn1 ZINC000414546451 334014959 /nfs/dbraw/zinc/01/49/59/334014959.db2.gz GIIZVBVQYJJZEN-ZETCQYMHSA-N 1 2 321.755 4.061 20 0 DIADLO CSc1ccc(C)c(NC2CCN(c3cccc[nH+]3)CC2)c1 ZINC000272046533 334030356 /nfs/dbraw/zinc/03/03/56/334030356.db2.gz RBHHLKGCLIKUGF-UHFFFAOYSA-N 1 2 313.470 4.193 20 0 DIADLO CCS[C@H](C)c1noc([C@@H]2CCC[N@@H+]2Cc2ccccc2)n1 ZINC000274005394 334053838 /nfs/dbraw/zinc/05/38/38/334053838.db2.gz RQPMUOZHSMKUKB-HIFRSBDPSA-N 1 2 317.458 4.221 20 0 DIADLO CCS[C@H](C)c1noc([C@@H]2CCC[N@H+]2Cc2ccccc2)n1 ZINC000274005394 334053839 /nfs/dbraw/zinc/05/38/39/334053839.db2.gz RQPMUOZHSMKUKB-HIFRSBDPSA-N 1 2 317.458 4.221 20 0 DIADLO Cc1cccc(C[NH2+][C@@H](C)c2cscn2)c1Br ZINC000276542153 334081346 /nfs/dbraw/zinc/08/13/46/334081346.db2.gz OXOXXRWZCKIJBL-JTQLQIEISA-N 1 2 311.248 4.065 20 0 DIADLO CC[C@H](C(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccc(F)cc1 ZINC000414787314 334096443 /nfs/dbraw/zinc/09/64/43/334096443.db2.gz MOKPCYVUNYXRPO-INIZCTEOSA-N 1 2 300.377 4.278 20 0 DIADLO Cc1ccoc1C[N@@H+]1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000438296347 334101144 /nfs/dbraw/zinc/10/11/44/334101144.db2.gz XJEGZMSHLPLKBD-HNNXBMFYSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1ccoc1C[N@H+]1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000438296347 334101146 /nfs/dbraw/zinc/10/11/46/334101146.db2.gz XJEGZMSHLPLKBD-HNNXBMFYSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1ccoc1C[N@@H+]1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000438296347 334101147 /nfs/dbraw/zinc/10/11/47/334101147.db2.gz XJEGZMSHLPLKBD-HNNXBMFYSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1ccoc1C[N@H+]1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000438296347 334101149 /nfs/dbraw/zinc/10/11/49/334101149.db2.gz XJEGZMSHLPLKBD-HNNXBMFYSA-N 1 2 315.804 4.455 20 0 DIADLO Clc1oc2ccccc2c1C[N@@H+]1CCc2ncsc2C1 ZINC000438375309 334108726 /nfs/dbraw/zinc/10/87/26/334108726.db2.gz NBWQPDGKMULUSJ-UHFFFAOYSA-N 1 2 304.802 4.101 20 0 DIADLO Clc1oc2ccccc2c1C[N@H+]1CCc2ncsc2C1 ZINC000438375309 334108727 /nfs/dbraw/zinc/10/87/27/334108727.db2.gz NBWQPDGKMULUSJ-UHFFFAOYSA-N 1 2 304.802 4.101 20 0 DIADLO Brc1ccsc1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000414843111 334113120 /nfs/dbraw/zinc/11/31/20/334113120.db2.gz BXHVJBBYNCQWCR-UHFFFAOYSA-N 1 2 323.259 4.481 20 0 DIADLO CC(C)Cc1ncc(CNc2ccc3c(c2)CCC[NH2+]3)s1 ZINC000414851206 334124351 /nfs/dbraw/zinc/12/43/51/334124351.db2.gz NSALCZWFGDUFLV-UHFFFAOYSA-N 1 2 301.459 4.312 20 0 DIADLO C[C@H]1CCc2nc(CNc3ccc4c(c3)CCC[NH2+]4)sc2C1 ZINC000414852523 334126600 /nfs/dbraw/zinc/12/66/00/334126600.db2.gz QDGFQOWYDBYKSY-LBPRGKRZSA-N 1 2 313.470 4.238 20 0 DIADLO CSCC(C)(C)C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000281832231 334128784 /nfs/dbraw/zinc/12/87/84/334128784.db2.gz HLRLQFLUWZLMTO-UHFFFAOYSA-N 1 2 316.426 4.202 20 0 DIADLO CCn1cc[nH+]c1CN(Cc1ccco1)c1cccc(Cl)c1 ZINC000343671366 335181661 /nfs/dbraw/zinc/18/16/61/335181661.db2.gz PXEOYKQAKHZIOP-UHFFFAOYSA-N 1 2 315.804 4.356 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2oc3ccccc3c2C)s1 ZINC000293671891 334200496 /nfs/dbraw/zinc/20/04/96/334200496.db2.gz UVOVITFSEWEHGH-UHFFFAOYSA-N 1 2 318.467 4.351 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2cc(COC(C)(C)C)on2)cs1 ZINC000296272938 334231254 /nfs/dbraw/zinc/23/12/54/334231254.db2.gz CGKOTHHATBZYFY-GFCCVEGCSA-N 1 2 308.447 4.210 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)Nc1ccc(C)c(Br)c1 ZINC000296347076 334232500 /nfs/dbraw/zinc/23/25/00/334232500.db2.gz HGTWSPMMOWGPGU-LLVKDONJSA-N 1 2 308.223 4.147 20 0 DIADLO Cc1ccnc(C[NH2+]C(C)(C)c2ccc(Cl)c(Cl)c2)n1 ZINC000534470912 334266707 /nfs/dbraw/zinc/26/67/07/334266707.db2.gz ZJQBTPZUTLWMOI-UHFFFAOYSA-N 1 2 310.228 4.117 20 0 DIADLO C[C@@H](c1ccccc1Cl)[NH+]1CCN(Cc2ccsc2)CC1 ZINC000534521399 334278675 /nfs/dbraw/zinc/27/86/75/334278675.db2.gz DBSIUWQOTVFKQO-AWEZNQCLSA-N 1 2 320.889 4.280 20 0 DIADLO COc1cc(C)[nH+]c(CN(C)[C@@H](C)c2ccc(Cl)cc2)c1 ZINC000534545184 334282649 /nfs/dbraw/zinc/28/26/49/334282649.db2.gz OSWAERZNWHIRNN-ZDUSSCGKSA-N 1 2 304.821 4.245 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3cc(C)cc(Cl)c3)ccc2n1C ZINC000531910849 334286696 /nfs/dbraw/zinc/28/66/96/334286696.db2.gz KUUVYPNXHDJHHK-UHFFFAOYSA-N 1 2 313.788 4.096 20 0 DIADLO Clc1ccc(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)s1 ZINC000187862034 334296171 /nfs/dbraw/zinc/29/61/71/334296171.db2.gz CAECOIIVJWNKDI-AWEZNQCLSA-N 1 2 303.818 4.004 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)cc1 ZINC000531943822 334299974 /nfs/dbraw/zinc/29/99/74/334299974.db2.gz CLMSFQLFOUURCE-VQIMIIECSA-N 1 2 305.425 4.169 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1n[nH]cc1Br)c1ccccc1 ZINC000531968799 334330546 /nfs/dbraw/zinc/33/05/46/334330546.db2.gz IOOGZYOOPYJCCE-CQSZACIVSA-N 1 2 322.250 4.049 20 0 DIADLO Cc1cc(NC(=O)N[C@@H](c2ccccc2)C(C)(C)C)c(C)c[nH+]1 ZINC000535061129 334361889 /nfs/dbraw/zinc/36/18/89/334361889.db2.gz VVAKHCUWNYSPRG-KRWDZBQOSA-N 1 2 311.429 4.029 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1OC1CCCC1)c1cscn1 ZINC000535064982 334362341 /nfs/dbraw/zinc/36/23/41/334362341.db2.gz OEMVBAJEGIQUFG-ZDUSSCGKSA-N 1 2 302.443 4.315 20 0 DIADLO CCCn1c2ccccc2nc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000535067606 334363154 /nfs/dbraw/zinc/36/31/54/334363154.db2.gz RGHUBZNZJKOTSS-SFHVURJKSA-N 1 2 320.440 4.178 20 0 DIADLO CCCn1c2ccccc2nc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000535067606 334363155 /nfs/dbraw/zinc/36/31/55/334363155.db2.gz RGHUBZNZJKOTSS-SFHVURJKSA-N 1 2 320.440 4.178 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1nc2ccccc2n1CC ZINC000535080932 334365923 /nfs/dbraw/zinc/36/59/23/334365923.db2.gz FKQOKMMGLGOHRB-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1nc2ccccc2n1CC ZINC000535080932 334365924 /nfs/dbraw/zinc/36/59/24/334365924.db2.gz FKQOKMMGLGOHRB-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO C[C@@H]1C[NH+](Cc2csc(-c3cccs3)n2)C[C@@H](C)S1 ZINC000535085459 334367037 /nfs/dbraw/zinc/36/70/37/334367037.db2.gz UPAFZBUJQOSRHL-GHMZBOCLSA-N 1 2 310.513 4.197 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@H](c3ccccc3)[C@@H](C)C2)c(C)[nH+]1 ZINC000152281897 334367555 /nfs/dbraw/zinc/36/75/55/334367555.db2.gz YXYFHKMIXZUZHI-KSSFIOAISA-N 1 2 323.440 4.356 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1ncc(Br)s1 ZINC000340945309 334395616 /nfs/dbraw/zinc/39/56/16/334395616.db2.gz HJSQKFDCPXRVKJ-QMMMGPOBSA-N 1 2 317.277 4.160 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1ncc(Br)s1 ZINC000340945309 334395618 /nfs/dbraw/zinc/39/56/18/334395618.db2.gz HJSQKFDCPXRVKJ-QMMMGPOBSA-N 1 2 317.277 4.160 20 0 DIADLO O=C(NC[C@H]1CC=CCC1)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000112211641 334373854 /nfs/dbraw/zinc/37/38/54/334373854.db2.gz XYQMPBQQKMLKOT-HNNXBMFYSA-N 1 2 323.396 4.352 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1coc2ccccc12 ZINC000113161431 334388709 /nfs/dbraw/zinc/38/87/09/334388709.db2.gz XFYIQHLBHKXTLM-UHFFFAOYSA-N 1 2 303.321 4.075 20 0 DIADLO Brc1cnc(C[N@@H+]2CCC[C@@H]2c2ccccc2)s1 ZINC000340905505 334396630 /nfs/dbraw/zinc/39/66/30/334396630.db2.gz CDVPJJDTKCJODU-GFCCVEGCSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cnc(C[N@H+]2CCC[C@@H]2c2ccccc2)s1 ZINC000340905505 334396632 /nfs/dbraw/zinc/39/66/32/334396632.db2.gz CDVPJJDTKCJODU-GFCCVEGCSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccccc2Oc2cccc(C)c2)n1C ZINC000341007930 334399344 /nfs/dbraw/zinc/39/93/44/334399344.db2.gz JLLQQLKQCPAFDE-UHFFFAOYSA-N 1 2 321.424 4.119 20 0 DIADLO Cc1c[nH+]c(CNCc2ccccc2Oc2cccc(C)c2)n1C ZINC000341007930 334399345 /nfs/dbraw/zinc/39/93/45/334399345.db2.gz JLLQQLKQCPAFDE-UHFFFAOYSA-N 1 2 321.424 4.119 20 0 DIADLO Cc1c[nH+]c(CNc2ccccc2COCc2ccccc2)n1C ZINC000341143960 334412985 /nfs/dbraw/zinc/41/29/85/334412985.db2.gz JLUDVHDQEARYLI-UHFFFAOYSA-N 1 2 321.424 4.057 20 0 DIADLO Cc1ccccc1[C@H](C)CC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000341184375 334416557 /nfs/dbraw/zinc/41/65/57/334416557.db2.gz XCENJVDMDIQSMV-MRXNPFEDSA-N 1 2 319.408 4.313 20 0 DIADLO CCC(C)(C)OCc1ccccc1NCc1[nH+]cc(C)n1C ZINC000341274208 334427624 /nfs/dbraw/zinc/42/76/24/334427624.db2.gz DZBVQTALEDTUGA-UHFFFAOYSA-N 1 2 301.434 4.046 20 0 DIADLO CCc1nc(C[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)no1 ZINC000341452505 334441724 /nfs/dbraw/zinc/44/17/24/334441724.db2.gz ISLLNMJWKRDEOO-CQSZACIVSA-N 1 2 305.397 4.038 20 0 DIADLO Cc1cc(F)ccc1NC(=O)C[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000341463122 334443175 /nfs/dbraw/zinc/44/31/75/334443175.db2.gz VSRZJNSZOKQHST-MRXNPFEDSA-N 1 2 323.371 4.018 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nc(C)no1)c1ccc(Cl)c(Cl)c1 ZINC000341659783 334463589 /nfs/dbraw/zinc/46/35/89/334463589.db2.gz RFJOTBFTPPBNHG-CYBMUJFWSA-N 1 2 314.216 4.316 20 0 DIADLO CCC[C@H]([NH2+]Cc1nc(C)no1)c1ccc(Cl)c(Cl)c1 ZINC000341660530 334463595 /nfs/dbraw/zinc/46/35/95/334463595.db2.gz RFJOTBFTPPBNHG-ZDUSSCGKSA-N 1 2 314.216 4.316 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)s1 ZINC000341803276 334483816 /nfs/dbraw/zinc/48/38/16/334483816.db2.gz ZFSCXXPMURNGMV-NSHDSACASA-N 1 2 307.488 4.198 20 0 DIADLO Clc1cccc2c1[C@@H]([NH2+]Cc1cnc(C3CCC3)s1)CO2 ZINC000342454399 334543198 /nfs/dbraw/zinc/54/31/98/334543198.db2.gz VTYOZIKDTHOXCY-ZDUSSCGKSA-N 1 2 320.845 4.287 20 0 DIADLO CCSc1cccc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000343174212 334620021 /nfs/dbraw/zinc/62/00/21/334620021.db2.gz IADZDXLULQKQIP-UHFFFAOYSA-N 1 2 323.421 4.237 20 0 DIADLO CN(C(=O)c1ccc2[nH+]ccn2c1)C1CCC(C(C)(C)C)CC1 ZINC000343187262 334643976 /nfs/dbraw/zinc/64/39/76/334643976.db2.gz ACYBLFSMKODRHZ-UHFFFAOYSA-N 1 2 313.445 4.011 20 0 DIADLO Cc1nccnc1[C@@H](C)[NH2+][C@@H](c1ccccc1)c1cccc(F)c1 ZINC000188136548 334655793 /nfs/dbraw/zinc/65/57/93/334655793.db2.gz NRKYNQGXQKETCM-QRWLVFNGSA-N 1 2 321.399 4.364 20 0 DIADLO Cc1ccc(C[S@](=O)Cc2c(C)cccc2Cl)c(C)[nH+]1 ZINC000417166993 334697931 /nfs/dbraw/zinc/69/79/31/334697931.db2.gz WARXDXFZCFVOLA-FQEVSTJZSA-N 1 2 307.846 4.109 20 0 DIADLO Cc1cc(C)cc(C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)c1 ZINC000535525720 334738240 /nfs/dbraw/zinc/73/82/40/334738240.db2.gz WLKRFMHEPCZWHF-UHFFFAOYSA-N 1 2 319.408 4.320 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)c1c(C)c(C)oc1-c1ccccc1 ZINC000444034992 338467493 /nfs/dbraw/zinc/46/74/93/338467493.db2.gz WCOYXPNFTFBGNE-UHFFFAOYSA-N 1 2 320.392 4.195 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)CO[C@@H]1C[C@H](C)CC[C@H]1C(C)C ZINC000331233475 334848900 /nfs/dbraw/zinc/84/89/00/334848900.db2.gz BQFGIYBBPHASMB-XOKHGSTOSA-N 1 2 318.461 4.114 20 0 DIADLO CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)Nc1c(C)cc[nH+]c1C ZINC000331239305 334849731 /nfs/dbraw/zinc/84/97/31/334849731.db2.gz JZLQBYHGFLIGNO-KCXAZCMYSA-N 1 2 304.434 4.011 20 0 DIADLO C[C@@H](Nc1cc[nH+]c2ccncc12)c1ccccc1C(F)(F)F ZINC000444079787 338467947 /nfs/dbraw/zinc/46/79/47/338467947.db2.gz ZFCZFWSWRTXSTQ-LLVKDONJSA-N 1 2 317.314 4.244 20 0 DIADLO c1ccc([C@H]2CCCN(c3cc[nH+]c4ccncc43)CC2)cc1 ZINC000444089741 338468163 /nfs/dbraw/zinc/46/81/63/338468163.db2.gz YCEQNPCXBUJXNW-KRWDZBQOSA-N 1 2 303.409 4.404 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1F ZINC000126625197 334861386 /nfs/dbraw/zinc/86/13/86/334861386.db2.gz YIRFFOCCXPFFEK-NEPJUHHUSA-N 1 2 305.397 4.226 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2cc(F)ccc2Cl)C2CC2)s1 ZINC000189437491 334894848 /nfs/dbraw/zinc/89/48/48/334894848.db2.gz VQODMGOJZARHNV-CQSZACIVSA-N 1 2 310.825 4.485 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1nc(C2CC2)cs1 ZINC000343619179 335182059 /nfs/dbraw/zinc/18/20/59/335182059.db2.gz UVAROXVXADUTGJ-INIZCTEOSA-N 1 2 301.459 4.086 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1nc(C2CC2)cs1 ZINC000343619179 335182061 /nfs/dbraw/zinc/18/20/61/335182061.db2.gz UVAROXVXADUTGJ-INIZCTEOSA-N 1 2 301.459 4.086 20 0 DIADLO CCc1nnc(C[NH2+][C@H](c2ccccc2Cl)C(C)C)s1 ZINC000343699709 335189113 /nfs/dbraw/zinc/18/91/13/335189113.db2.gz VCIYHQGXEHSNBV-HNNXBMFYSA-N 1 2 309.866 4.241 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+]Cc2nnc(CC)s2)cc1 ZINC000343749025 335190566 /nfs/dbraw/zinc/19/05/66/335190566.db2.gz IRRQAUGZFITIJP-NSHDSACASA-N 1 2 307.488 4.063 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)n1 ZINC000343845646 335196740 /nfs/dbraw/zinc/19/67/40/335196740.db2.gz YFCSFICQMXACHE-JGVFFNPUSA-N 1 2 321.393 4.339 20 0 DIADLO C[C@@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1ccc2n[nH]cc2c1 ZINC000343992525 335206288 /nfs/dbraw/zinc/20/62/88/335206288.db2.gz YAQHDHLHMBMTNE-SECBINFHSA-N 1 2 306.291 4.150 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)o1 ZINC000344084175 335216496 /nfs/dbraw/zinc/21/64/96/335216496.db2.gz GCEPDRLBHZNLNN-LBPRGKRZSA-N 1 2 313.376 4.336 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H]2CCCOc3ccc(F)cc32)s1 ZINC000344134329 335220342 /nfs/dbraw/zinc/22/03/42/335220342.db2.gz RATPFXVGRXOMOR-AWEZNQCLSA-N 1 2 320.433 4.409 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(F)c2ccccc21 ZINC000344105436 335223696 /nfs/dbraw/zinc/22/36/96/335223696.db2.gz PNLYVHNRYJGEEE-LLVKDONJSA-N 1 2 311.360 4.090 20 0 DIADLO COc1ccc(CSCc2c[nH+]ccc2OC)cc1Cl ZINC000344159906 335226226 /nfs/dbraw/zinc/22/62/26/335226226.db2.gz DHVSEFLRXQKNDF-UHFFFAOYSA-N 1 2 309.818 4.186 20 0 DIADLO c1cc2c(o1)CCC[N@@H+](Cc1nc(-c3ccccc3)cs1)C2 ZINC000344241241 335231497 /nfs/dbraw/zinc/23/14/97/335231497.db2.gz WUIVIPWJZPQJAC-UHFFFAOYSA-N 1 2 310.422 4.352 20 0 DIADLO c1cc2c(o1)CCC[N@H+](Cc1nc(-c3ccccc3)cs1)C2 ZINC000344241241 335231498 /nfs/dbraw/zinc/23/14/98/335231498.db2.gz WUIVIPWJZPQJAC-UHFFFAOYSA-N 1 2 310.422 4.352 20 0 DIADLO Brc1cc(C[N@@H+]2CCCc3occc3C2)cs1 ZINC000344275485 335235442 /nfs/dbraw/zinc/23/54/42/335235442.db2.gz NCENTBQMESNHIP-UHFFFAOYSA-N 1 2 312.232 4.052 20 0 DIADLO Brc1cc(C[N@H+]2CCCc3occc3C2)cs1 ZINC000344275485 335235443 /nfs/dbraw/zinc/23/54/43/335235443.db2.gz NCENTBQMESNHIP-UHFFFAOYSA-N 1 2 312.232 4.052 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2ccc(-c3ccccc3)o2)s1 ZINC000344662266 335269531 /nfs/dbraw/zinc/26/95/31/335269531.db2.gz GRBUHCNJQRASPP-UHFFFAOYSA-N 1 2 313.426 4.211 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC[C@@H]1c1cccnc1 ZINC000344932943 335286437 /nfs/dbraw/zinc/28/64/37/335286437.db2.gz GKAIMEJDYUOMCK-QGZVFWFLSA-N 1 2 319.408 4.288 20 0 DIADLO CO[C@@H](CCNc1cc(C)[nH+]c2c(F)cccc12)C(F)(F)F ZINC000345004420 335290617 /nfs/dbraw/zinc/29/06/17/335290617.db2.gz AOZKEIBGWHXDIJ-ZDUSSCGKSA-N 1 2 316.298 4.062 20 0 DIADLO C[C@H]1CCc2nc(C[NH2+]Cc3ccc4ccccc4n3)sc2C1 ZINC000345814165 335353099 /nfs/dbraw/zinc/35/30/99/335353099.db2.gz GHYVDXCDGFFEEX-ZDUSSCGKSA-N 1 2 323.465 4.106 20 0 DIADLO CC1(C)CCC([S@](=O)Cc2cn3cc(Cl)ccc3[nH+]2)CC1 ZINC000346062198 335371947 /nfs/dbraw/zinc/37/19/47/335371947.db2.gz JNUYWNPVUGUWGH-OAQYLSRUSA-N 1 2 324.877 4.205 20 0 DIADLO COc1ccccc1C[N@H+](Cc1ncc(C(C)C)s1)C1CC1 ZINC000346144344 335381428 /nfs/dbraw/zinc/38/14/28/335381428.db2.gz FIBNCQATVJERQE-UHFFFAOYSA-N 1 2 316.470 4.440 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1ncc(C(C)C)s1)C1CC1 ZINC000346144344 335381429 /nfs/dbraw/zinc/38/14/29/335381429.db2.gz FIBNCQATVJERQE-UHFFFAOYSA-N 1 2 316.470 4.440 20 0 DIADLO C[C@H](Nc1ccccc1COCc1ccccc1)c1[nH+]ccn1C ZINC000346239190 335387351 /nfs/dbraw/zinc/38/73/51/335387351.db2.gz PBNVVHULDCJRRV-INIZCTEOSA-N 1 2 321.424 4.310 20 0 DIADLO CCCCn1ncc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1C ZINC000347325181 335489989 /nfs/dbraw/zinc/48/99/89/335489989.db2.gz ADJKSRJDDKHQHV-OAHLLOKOSA-N 1 2 323.444 4.350 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@H](c2ncc(C)s2)C2CC2)n1 ZINC000347972768 335542807 /nfs/dbraw/zinc/54/28/07/335542807.db2.gz ZAPIPDHACOEYED-INIZCTEOSA-N 1 2 318.490 4.250 20 0 DIADLO Cc1cc(Br)c(C[NH2+][C@H](C)c2cscn2)s1 ZINC000583511266 335637904 /nfs/dbraw/zinc/63/79/04/335637904.db2.gz WHYLZBOZNYZCHJ-MRVPVSSYSA-N 1 2 317.277 4.126 20 0 DIADLO CCn1c[nH+]cc1CNc1ccccc1OCCc1ccccc1 ZINC000417822116 335642519 /nfs/dbraw/zinc/64/25/19/335642519.db2.gz JEGHTZYIVGVZTQ-UHFFFAOYSA-N 1 2 321.424 4.137 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1F)c1nccs1 ZINC000113338857 335706126 /nfs/dbraw/zinc/70/61/26/335706126.db2.gz MVOQPMQKSVNHQR-QMMMGPOBSA-N 1 2 304.312 4.152 20 0 DIADLO CC(C)(c1noc(Cc2cn3ccccc3[nH+]2)n1)C1CCCCC1 ZINC000445505460 338497454 /nfs/dbraw/zinc/49/74/54/338497454.db2.gz RYUHMUKEAMVZLD-UHFFFAOYSA-N 1 2 324.428 4.166 20 0 DIADLO Cc1ccc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)c(Cl)c1 ZINC000191544381 335763247 /nfs/dbraw/zinc/76/32/47/335763247.db2.gz DWIKFGNCOWRXCW-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1ccc2oc(C(=O)Nc3ccc(-c4c[nH]c[nH+]4)cc3)cc2c1 ZINC000519059616 335791439 /nfs/dbraw/zinc/79/14/39/335791439.db2.gz GTOKICQXFYFMPI-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO Cc1cc(NC(=O)C2(c3cccs3)CCCCC2)c(C)c[nH+]1 ZINC000536575059 335840611 /nfs/dbraw/zinc/84/06/11/335840611.db2.gz WCZDPFAAXGGOFQ-UHFFFAOYSA-N 1 2 314.454 4.022 20 0 DIADLO O=C(C[C@@H]1CC[C@@H]2C[C@@H]21)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000519521165 335869970 /nfs/dbraw/zinc/86/99/70/335869970.db2.gz QUQIAQZFACGFOO-GLJUWKHASA-N 1 2 308.381 4.249 20 0 DIADLO Cc1nc([C@@](C)([NH2+]Cc2ccc(C3CCC3)cc2)C2CC2)no1 ZINC000519576056 335879001 /nfs/dbraw/zinc/87/90/01/335879001.db2.gz OIKTUXSHFOQRDJ-IBGZPJMESA-N 1 2 311.429 4.061 20 0 DIADLO CCC(CC)c1nc(Cn2c3ccccc3[nH+]c2C(C)C)no1 ZINC000445656117 338504753 /nfs/dbraw/zinc/50/47/53/338504753.db2.gz IBCFAGLMGKQHBD-UHFFFAOYSA-N 1 2 312.417 4.495 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc([C@H]2CC2(C)C)n1 ZINC000445661280 338504922 /nfs/dbraw/zinc/50/49/22/338504922.db2.gz DBZRBVOTYYEBBY-GFCCVEGCSA-N 1 2 310.401 4.105 20 0 DIADLO O=C(CCCc1cccs1)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000520615653 335995703 /nfs/dbraw/zinc/99/57/03/335995703.db2.gz MUDLUYOBJPTPHA-UHFFFAOYSA-N 1 2 311.410 4.100 20 0 DIADLO CC(C)C[N@H+](Cc1cocn1)Cc1ccccc1Br ZINC000191948743 336012749 /nfs/dbraw/zinc/01/27/49/336012749.db2.gz HZOXVGWEMXMZRT-UHFFFAOYSA-N 1 2 323.234 4.095 20 0 DIADLO CC(C)C[N@@H+](Cc1cocn1)Cc1ccccc1Br ZINC000191948743 336012750 /nfs/dbraw/zinc/01/27/50/336012750.db2.gz HZOXVGWEMXMZRT-UHFFFAOYSA-N 1 2 323.234 4.095 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2cocn2)c2cccs2)cc1 ZINC000192287896 336027072 /nfs/dbraw/zinc/02/70/72/336027072.db2.gz BHKLQCYUMUTILG-OAHLLOKOSA-N 1 2 304.802 4.269 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)c1ccoc1Cl ZINC000192297518 336027587 /nfs/dbraw/zinc/02/75/87/336027587.db2.gz LUPKEGXXWGKHDE-UHFFFAOYSA-N 1 2 322.151 4.024 20 0 DIADLO Cc1nn(C)cc1[C@@H](C)Nc1cc(C(C)(C)C)[nH+]c(C(C)C)n1 ZINC000192302369 336027853 /nfs/dbraw/zinc/02/78/53/336027853.db2.gz RWVDSIBXXMWKDG-GFCCVEGCSA-N 1 2 315.465 4.113 20 0 DIADLO CCN(Cc1c[nH+]cn1Cc1ccccc1)c1ccc(F)cc1 ZINC000445814128 338511084 /nfs/dbraw/zinc/51/10/84/338511084.db2.gz RSNCITDDHXRHMI-UHFFFAOYSA-N 1 2 309.388 4.097 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2ccon2)ccc1Oc1cccnc1 ZINC000351577337 336046626 /nfs/dbraw/zinc/04/66/26/336046626.db2.gz FKLQUJTXMIEKGD-CQSZACIVSA-N 1 2 309.369 4.021 20 0 DIADLO Cc1nc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)c(C)c2)c(C)o1 ZINC000351660015 336055737 /nfs/dbraw/zinc/05/57/37/336055737.db2.gz WSVMZVKAZKUZFE-UHFFFAOYSA-N 1 2 323.352 4.039 20 0 DIADLO Cc1nn(C)cc1C[N@H+](Cc1ccccc1)Cc1ccccc1F ZINC000351661357 336055825 /nfs/dbraw/zinc/05/58/25/336055825.db2.gz JOXZNVNQOQLRSF-UHFFFAOYSA-N 1 2 323.415 4.070 20 0 DIADLO Cc1nn(C)cc1C[N@@H+](Cc1ccccc1)Cc1ccccc1F ZINC000351661357 336055826 /nfs/dbraw/zinc/05/58/26/336055826.db2.gz JOXZNVNQOQLRSF-UHFFFAOYSA-N 1 2 323.415 4.070 20 0 DIADLO Cc1ncc(C[N@H+](Cc2ccccc2)Cc2ccccc2F)cn1 ZINC000351662418 336056121 /nfs/dbraw/zinc/05/61/21/336056121.db2.gz XNKPWPJAWTXAKU-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2ccccc2)Cc2ccccc2F)cn1 ZINC000351662418 336056122 /nfs/dbraw/zinc/05/61/22/336056122.db2.gz XNKPWPJAWTXAKU-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cccc(OC(C)(C)C)n1)c1nccs1 ZINC000351703750 336060320 /nfs/dbraw/zinc/06/03/20/336060320.db2.gz QRCBAZDRHQCOGJ-QGZVFWFLSA-N 1 2 319.474 4.130 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)[C@@H](C)c3ccccn3)cs2)o1 ZINC000351759319 336065539 /nfs/dbraw/zinc/06/55/39/336065539.db2.gz SBEIWQOSVQXJNI-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)[C@@H](C)c3ccccn3)cs2)o1 ZINC000351759319 336065541 /nfs/dbraw/zinc/06/55/41/336065541.db2.gz SBEIWQOSVQXJNI-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO CN(Cc1ccoc1)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000351895234 336110910 /nfs/dbraw/zinc/11/09/10/336110910.db2.gz ZDYUGYUWHONIGY-UHFFFAOYSA-N 1 2 323.352 4.131 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2[C@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331405987 336135059 /nfs/dbraw/zinc/13/50/59/336135059.db2.gz OCZQKWFWINJASN-CHWSQXEVSA-N 1 2 303.406 4.167 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2[C@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331405987 336135061 /nfs/dbraw/zinc/13/50/61/336135061.db2.gz OCZQKWFWINJASN-CHWSQXEVSA-N 1 2 303.406 4.167 20 0 DIADLO CCc1ccc(NC(=O)N2CCCC[C@@H]2c2[nH]cc[nH+]2)cc1C ZINC000331977052 336154787 /nfs/dbraw/zinc/15/47/87/336154787.db2.gz APKUXONJNDBARJ-MRXNPFEDSA-N 1 2 312.417 4.040 20 0 DIADLO Cc1nc(C2CCCC2)sc1C(=O)Nc1c(C)cc[nH+]c1C ZINC000331996643 336155500 /nfs/dbraw/zinc/15/55/00/336155500.db2.gz XBXNKSAVQSZLMH-UHFFFAOYSA-N 1 2 315.442 4.373 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1scnc1C1CCCC1 ZINC000332053469 336157032 /nfs/dbraw/zinc/15/70/32/336157032.db2.gz YALOYUKHKCPUPI-UHFFFAOYSA-N 1 2 301.415 4.065 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](C)c1cc2ccccc2o1 ZINC000351922940 336178933 /nfs/dbraw/zinc/17/89/33/336178933.db2.gz MYTULZAOOVYYRA-LBPRGKRZSA-N 1 2 309.369 4.327 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@H](C)c1cc(F)ccc1F ZINC000351931364 336180514 /nfs/dbraw/zinc/18/05/14/336180514.db2.gz QDKROOXPZKHFEK-GFCCVEGCSA-N 1 2 319.355 4.202 20 0 DIADLO Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)c1ccc2[nH+]ccn2c1 ZINC000351956300 336182699 /nfs/dbraw/zinc/18/26/99/336182699.db2.gz NGTCRPAJQUEZMB-LJQANCHMSA-N 1 2 321.424 4.112 20 0 DIADLO CCOc1cc(C[N@H+](CC)Cc2c(F)cccc2F)ccc1O ZINC000351964379 336183765 /nfs/dbraw/zinc/18/37/65/336183765.db2.gz MAKMLJXOKHDAPP-UHFFFAOYSA-N 1 2 321.367 4.091 20 0 DIADLO CCOc1cc(C[N@@H+](CC)Cc2c(F)cccc2F)ccc1O ZINC000351964379 336183766 /nfs/dbraw/zinc/18/37/66/336183766.db2.gz MAKMLJXOKHDAPP-UHFFFAOYSA-N 1 2 321.367 4.091 20 0 DIADLO Clc1cnc(C[NH+]2CCC(OC3CCCCC3)CC2)s1 ZINC000351996199 336187151 /nfs/dbraw/zinc/18/71/51/336187151.db2.gz NFFCQSZMBKJDJT-UHFFFAOYSA-N 1 2 314.882 4.110 20 0 DIADLO Cc1nc(C[N@H+]2CC=C(c3c(F)cccc3F)CC2)c(C)s1 ZINC000352023392 336190088 /nfs/dbraw/zinc/19/00/88/336190088.db2.gz XGTAUEQYAUXPOS-UHFFFAOYSA-N 1 2 320.408 4.327 20 0 DIADLO Cc1nc(C[N@@H+]2CC=C(c3c(F)cccc3F)CC2)c(C)s1 ZINC000352023392 336190090 /nfs/dbraw/zinc/19/00/90/336190090.db2.gz XGTAUEQYAUXPOS-UHFFFAOYSA-N 1 2 320.408 4.327 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000352028594 336190517 /nfs/dbraw/zinc/19/05/17/336190517.db2.gz QOPGRUKDWKIRPE-AWEZNQCLSA-N 1 2 324.415 4.034 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)C[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000352028594 336190519 /nfs/dbraw/zinc/19/05/19/336190519.db2.gz QOPGRUKDWKIRPE-AWEZNQCLSA-N 1 2 324.415 4.034 20 0 DIADLO c1c[nH]c([C@H]([NH2+]Cc2cc3c(s2)CCCC3)c2ccccc2)n1 ZINC000526117241 336199386 /nfs/dbraw/zinc/19/93/86/336199386.db2.gz DFKNEUZLIVSWDX-GOSISDBHSA-N 1 2 323.465 4.229 20 0 DIADLO Fc1cc2cccnc2c(C[NH2+]C2(C(F)F)CCCCC2)c1 ZINC000352186464 336201294 /nfs/dbraw/zinc/20/12/94/336201294.db2.gz MESLCFIORXWOTD-UHFFFAOYSA-N 1 2 308.347 4.432 20 0 DIADLO Clc1cc(Cl)c2nc(C[N@@H+]3CCCC4(CC4)C3)cn2c1 ZINC000352264045 336208357 /nfs/dbraw/zinc/20/83/57/336208357.db2.gz ASYJAIAPVQXDCV-UHFFFAOYSA-N 1 2 310.228 4.017 20 0 DIADLO Clc1cc(Cl)c2nc(C[N@H+]3CCCC4(CC4)C3)cn2c1 ZINC000352264045 336208358 /nfs/dbraw/zinc/20/83/58/336208358.db2.gz ASYJAIAPVQXDCV-UHFFFAOYSA-N 1 2 310.228 4.017 20 0 DIADLO Cc1ccc(-c2noc([C@]3(C)CC=CCC3)n2)c(N2CCCC2)[nH+]1 ZINC000333851753 336211227 /nfs/dbraw/zinc/21/12/27/336211227.db2.gz POMLLDYKFJWOMX-LJQANCHMSA-N 1 2 324.428 4.038 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+]3C[C@H](C)O[C@H](C)[C@H]3C)n2)cc1 ZINC000352413887 336216923 /nfs/dbraw/zinc/21/69/23/336216923.db2.gz RERRPNQHJCCCSA-RRFJBIMHSA-N 1 2 316.470 4.116 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+]3C[C@H](C)O[C@H](C)[C@H]3C)n2)cc1 ZINC000352413887 336216924 /nfs/dbraw/zinc/21/69/24/336216924.db2.gz RERRPNQHJCCCSA-RRFJBIMHSA-N 1 2 316.470 4.116 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)cs1 ZINC000352431639 336218254 /nfs/dbraw/zinc/21/82/54/336218254.db2.gz MLVVLKHWPKGFNM-WBVHZDCISA-N 1 2 320.502 4.019 20 0 DIADLO CCCCc1nc(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)cs1 ZINC000352431639 336218255 /nfs/dbraw/zinc/21/82/55/336218255.db2.gz MLVVLKHWPKGFNM-WBVHZDCISA-N 1 2 320.502 4.019 20 0 DIADLO Fc1ccc(Cl)cc1C[N@@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000352440300 336218907 /nfs/dbraw/zinc/21/89/07/336218907.db2.gz NECIVLUGUBJEGM-CVEARBPZSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)cc1C[N@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000352440300 336218908 /nfs/dbraw/zinc/21/89/08/336218908.db2.gz NECIVLUGUBJEGM-CVEARBPZSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)cc1C[N@@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000352440303 336218911 /nfs/dbraw/zinc/21/89/11/336218911.db2.gz NECIVLUGUBJEGM-JKSUJKDBSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)cc1C[N@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000352440303 336218912 /nfs/dbraw/zinc/21/89/12/336218912.db2.gz NECIVLUGUBJEGM-JKSUJKDBSA-N 1 2 309.812 4.013 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2nc(-c3cccs3)no2)c(C)s1 ZINC000352550235 336224053 /nfs/dbraw/zinc/22/40/53/336224053.db2.gz LOUCLVGOXHKCMI-UHFFFAOYSA-N 1 2 319.455 4.108 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2nc(-c3cccs3)no2)c(C)s1 ZINC000352550235 336224054 /nfs/dbraw/zinc/22/40/54/336224054.db2.gz LOUCLVGOXHKCMI-UHFFFAOYSA-N 1 2 319.455 4.108 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cc(-c3ccco3)on2)c1 ZINC000352673957 336229769 /nfs/dbraw/zinc/22/97/69/336229769.db2.gz AHUVJBVOEVWXRS-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cc(-c3ccco3)on2)c1 ZINC000352673957 336229770 /nfs/dbraw/zinc/22/97/70/336229770.db2.gz AHUVJBVOEVWXRS-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1cc(-c2ccco2)on1 ZINC000352675543 336229871 /nfs/dbraw/zinc/22/98/71/336229871.db2.gz RHLJQVOUYPEMQL-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1cc(-c2ccco2)on1 ZINC000352675543 336229872 /nfs/dbraw/zinc/22/98/72/336229872.db2.gz RHLJQVOUYPEMQL-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO CCC(C)(C)C1CCC2(C[C@@H]2C(=O)N(C)Cc2[nH]cc[nH+]2)CC1 ZINC000352726531 336232664 /nfs/dbraw/zinc/23/26/64/336232664.db2.gz UONBKNDHFQUNRS-XAUUPUKJSA-N 1 2 317.477 4.001 20 0 DIADLO CC[C@H](Cc1ccccc1)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000532440669 336247359 /nfs/dbraw/zinc/24/73/59/336247359.db2.gz XJUWJRLBPWIJEM-OAHLLOKOSA-N 1 2 307.397 4.079 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CC/C=C/c3ccccc3)cc2[nH+]1 ZINC000532440309 336247368 /nfs/dbraw/zinc/24/73/68/336247368.db2.gz VPGNGZXRXRCTSG-WEVVVXLNSA-N 1 2 305.381 4.303 20 0 DIADLO C[C@H]1C[N@H+](Cc2nc3ccccc3s2)C[C@@H](c2ccccc2)O1 ZINC000532483634 336251624 /nfs/dbraw/zinc/25/16/24/336251624.db2.gz ITYFIERCZQPVHK-YOEHRIQHSA-N 1 2 324.449 4.258 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nc3ccccc3s2)C[C@@H](c2ccccc2)O1 ZINC000532483634 336251625 /nfs/dbraw/zinc/25/16/25/336251625.db2.gz ITYFIERCZQPVHK-YOEHRIQHSA-N 1 2 324.449 4.258 20 0 DIADLO Cc1nn(-c2ccccc2)c(C)c1NCc1ccc(C)[nH+]c1C ZINC000192646204 336253063 /nfs/dbraw/zinc/25/30/63/336253063.db2.gz NQGNTNIIRHNZTM-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](Cc1nnc(C2CC2)n1C1CC1)C1CC1 ZINC000352817460 336253365 /nfs/dbraw/zinc/25/33/65/336253365.db2.gz QMKUBVYGAFQNDH-CQSZACIVSA-N 1 2 322.456 4.216 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](Cc1nnc(C2CC2)n1C1CC1)C1CC1 ZINC000352817460 336253366 /nfs/dbraw/zinc/25/33/66/336253366.db2.gz QMKUBVYGAFQNDH-CQSZACIVSA-N 1 2 322.456 4.216 20 0 DIADLO CC1(C)CC[NH+](CC(=O)Nc2ccc(Cl)cc2Cl)CC1 ZINC000532524692 336254285 /nfs/dbraw/zinc/25/42/85/336254285.db2.gz WNIFSQPPEFFLHA-UHFFFAOYSA-N 1 2 315.244 4.054 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc(F)c(F)c1 ZINC000192751560 336260489 /nfs/dbraw/zinc/26/04/89/336260489.db2.gz AAHSFRMQDYWALE-GFCCVEGCSA-N 1 2 303.356 4.133 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1sccc1Br ZINC000043501887 336263521 /nfs/dbraw/zinc/26/35/21/336263521.db2.gz DAGCIOJSBOETRF-UHFFFAOYSA-N 1 2 302.262 4.204 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1sccc1Br ZINC000043501887 336263522 /nfs/dbraw/zinc/26/35/22/336263522.db2.gz DAGCIOJSBOETRF-UHFFFAOYSA-N 1 2 302.262 4.204 20 0 DIADLO Fc1ccc(Br)c(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000104674925 336263567 /nfs/dbraw/zinc/26/35/67/336263567.db2.gz BGXRHCQBMIKTEK-HNNXBMFYSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1ccc(Br)c(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000104674925 336263568 /nfs/dbraw/zinc/26/35/68/336263568.db2.gz BGXRHCQBMIKTEK-HNNXBMFYSA-N 1 2 323.209 4.253 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1csc(C)n1 ZINC000167824295 336264209 /nfs/dbraw/zinc/26/42/09/336264209.db2.gz OLIFOSYIQIHPRT-UHFFFAOYSA-N 1 2 306.822 4.087 20 0 DIADLO COc1cccc(CSCc2[nH+]ccn2Cc2ccccc2)c1 ZINC000064374979 336269110 /nfs/dbraw/zinc/26/91/10/336269110.db2.gz NXQXEPKWYWEIJX-UHFFFAOYSA-N 1 2 324.449 4.373 20 0 DIADLO CCn1c[nH+]cc1CNc1cc(Cl)ccc1OC(F)(F)F ZINC000328520007 336269789 /nfs/dbraw/zinc/26/97/89/336269789.db2.gz REZDAEWWQNXZRI-UHFFFAOYSA-N 1 2 319.714 4.067 20 0 DIADLO COc1ccc(-c2ccccc2)cc1C[NH2+]Cc1ncccc1F ZINC000526991421 336278099 /nfs/dbraw/zinc/27/80/99/336278099.db2.gz NCXYUQXBDGWAFO-UHFFFAOYSA-N 1 2 322.383 4.186 20 0 DIADLO Fc1cccc2c1CCCN2Cc1c[nH+]cn1Cc1ccccc1 ZINC000527075276 336282658 /nfs/dbraw/zinc/28/26/58/336282658.db2.gz BOGMOJXHLPNCJT-UHFFFAOYSA-N 1 2 321.399 4.023 20 0 DIADLO FC(F)(F)c1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)nc1 ZINC000301085563 336289141 /nfs/dbraw/zinc/28/91/41/336289141.db2.gz LFPUTXFXEHQFCC-UHFFFAOYSA-N 1 2 318.302 4.089 20 0 DIADLO c1cnn(-c2ccc(CNc3ccc4ccccc4[nH+]3)cc2)c1 ZINC000301088712 336289339 /nfs/dbraw/zinc/28/93/39/336289339.db2.gz LCCRPDVUHWTBAL-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO c1cn(-c2ccccc2)nc1CNc1ccc2ccccc2[nH+]1 ZINC000301088426 336289391 /nfs/dbraw/zinc/28/93/91/336289391.db2.gz GZHRLFUFRSUGNU-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO Cc1cc(N[C@H](C)Cc2ccccc2F)nc(-c2cccnc2)[nH+]1 ZINC000301099315 336289896 /nfs/dbraw/zinc/28/98/96/336289896.db2.gz QLDCOXKNGOBITD-CYBMUJFWSA-N 1 2 322.387 4.029 20 0 DIADLO c1sc(NCCc2cn3ccccc3[nH+]2)nc1-c1ccccc1 ZINC000301104442 336290281 /nfs/dbraw/zinc/29/02/81/336290281.db2.gz OXARLQUPMPRELC-UHFFFAOYSA-N 1 2 320.421 4.112 20 0 DIADLO c1cnn(Cc2cccc(CNc3ccc4ccccc4[nH+]3)c2)c1 ZINC000301122573 336291167 /nfs/dbraw/zinc/29/11/67/336291167.db2.gz SQQOIKBZOUUAKT-UHFFFAOYSA-N 1 2 314.392 4.092 20 0 DIADLO CCc1ccc(CNc2cc(CC)[nH+]c(-c3ccncc3)n2)s1 ZINC000301172824 336293209 /nfs/dbraw/zinc/29/32/09/336293209.db2.gz KYWRUTIGXQGAGC-UHFFFAOYSA-N 1 2 324.453 4.337 20 0 DIADLO CCc1ccc(CNc2nc(-c3ccncc3)[nH+]c(C)c2C)s1 ZINC000301234932 336296145 /nfs/dbraw/zinc/29/61/45/336296145.db2.gz CNIIJZUAIWFUOI-UHFFFAOYSA-N 1 2 324.453 4.391 20 0 DIADLO CCc1cc(N(C)[C@@H](C)c2cccs2)nc(-c2ccncc2)[nH+]1 ZINC000301254926 336297056 /nfs/dbraw/zinc/29/70/56/336297056.db2.gz KBJDLXDYKHOXDF-ZDUSSCGKSA-N 1 2 324.453 4.360 20 0 DIADLO Cc1cc([C@H](C)Nc2cc(N3CCC[C@@H](C)C3)nc[nH+]2)c(C)o1 ZINC000301265565 336297594 /nfs/dbraw/zinc/29/75/94/336297594.db2.gz UBIHPYXJXDEZHI-OCCSQVGLSA-N 1 2 314.433 4.096 20 0 DIADLO Cc1cc([C@H](C)Nc2cc(N3CCC[C@@H](C)C3)[nH+]cn2)c(C)o1 ZINC000301265565 336297595 /nfs/dbraw/zinc/29/75/95/336297595.db2.gz UBIHPYXJXDEZHI-OCCSQVGLSA-N 1 2 314.433 4.096 20 0 DIADLO Cc1cc(N[C@@H]2c3ccccc3C[C@H]2C)nc(-c2cccnc2)[nH+]1 ZINC000301266791 336297733 /nfs/dbraw/zinc/29/77/33/336297733.db2.gz WQBMSIJABHNUTN-YJYMSZOUSA-N 1 2 316.408 4.192 20 0 DIADLO CC(C)Oc1ccc([C@@H](O)CNc2ccc3ccccc3[nH+]2)cc1 ZINC000301323099 336300527 /nfs/dbraw/zinc/30/05/27/336300527.db2.gz VHNNYUUETNKVFL-IBGZPJMESA-N 1 2 322.408 4.168 20 0 DIADLO c1cc(Nc2ccc3nccnc3n2)cc([NH+]2CCCCCC2)c1 ZINC000301381553 336303626 /nfs/dbraw/zinc/30/36/26/336303626.db2.gz YUWPNYRQLUCVNL-UHFFFAOYSA-N 1 2 319.412 4.149 20 0 DIADLO COc1ccc(-c2ccc(CNc3cc(C)[nH+]cn3)cc2)cc1 ZINC000301416036 336305199 /nfs/dbraw/zinc/30/51/99/336305199.db2.gz AQENKDABMVGIBV-UHFFFAOYSA-N 1 2 305.381 4.073 20 0 DIADLO CN(Cc1nc2ccccc2s1)c1cc(C(F)(F)F)cc[nH+]1 ZINC000301422454 336305715 /nfs/dbraw/zinc/30/57/15/336305715.db2.gz ABVXDIHVUIDDDH-UHFFFAOYSA-N 1 2 323.343 4.347 20 0 DIADLO CCC(CC)c1cc(CNc2cc(C)[nH+]c(C(C)C)n2)on1 ZINC000301457491 336307993 /nfs/dbraw/zinc/30/79/93/336307993.db2.gz NDWPZGLUXLVODC-UHFFFAOYSA-N 1 2 302.422 4.412 20 0 DIADLO COc1ccc(-c2csc(CNc3cc(C)[nH+]cn3)c2)cc1 ZINC000301458324 336308060 /nfs/dbraw/zinc/30/80/60/336308060.db2.gz CRNYYSUWRKFVHW-UHFFFAOYSA-N 1 2 311.410 4.134 20 0 DIADLO COc1ccccc1O[C@@H](C)CNc1ccc2ccccc2[nH+]1 ZINC000301485761 336309771 /nfs/dbraw/zinc/30/97/71/336309771.db2.gz ZKNIHTZYMUVBIM-AWEZNQCLSA-N 1 2 308.381 4.123 20 0 DIADLO C[C@@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1cccc(-n2cccn2)c1 ZINC000301502790 336310806 /nfs/dbraw/zinc/31/08/06/336310806.db2.gz BMGZFEZATUSUJG-CQSZACIVSA-N 1 2 321.428 4.133 20 0 DIADLO C[C@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1ccc2c(c1)OCO2 ZINC000301502196 336310908 /nfs/dbraw/zinc/31/09/08/336310908.db2.gz BIKRAFUNFGCRPP-VIFPVBQESA-N 1 2 310.275 4.002 20 0 DIADLO CN(Cc1ccc(F)c(F)c1)c1cc(C(F)(F)F)cc[nH+]1 ZINC000301506571 336311282 /nfs/dbraw/zinc/31/12/82/336311282.db2.gz JCVVTISHPARKTG-UHFFFAOYSA-N 1 2 302.246 4.015 20 0 DIADLO CC(C)c1nc(CCNc2cc[nH+]c(C(C)(C)C)n2)cs1 ZINC000301523790 336312273 /nfs/dbraw/zinc/31/22/73/336312273.db2.gz MLTBIIVBPUXEAW-UHFFFAOYSA-N 1 2 304.463 4.009 20 0 DIADLO COc1cc(Cl)ccc1CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000301524365 336312360 /nfs/dbraw/zinc/31/23/60/336312360.db2.gz PCODAJLQMAIVNI-UHFFFAOYSA-N 1 2 316.710 4.375 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CC[C@H](Cc3ccccc3)C2)c1 ZINC000301525504 336312534 /nfs/dbraw/zinc/31/25/34/336312534.db2.gz FXQQVWOTOUQTKN-CQSZACIVSA-N 1 2 306.331 4.169 20 0 DIADLO COc1ccc([C@@H](C)N(C)c2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000301535879 336313055 /nfs/dbraw/zinc/31/30/55/336313055.db2.gz UBAIEYDJOUYXIY-LLVKDONJSA-N 1 2 310.319 4.306 20 0 DIADLO COc1ccccc1[C@@H]1CCCN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000301550236 336314173 /nfs/dbraw/zinc/31/41/73/336314173.db2.gz QILCNJQNCSLIJE-AWEZNQCLSA-N 1 2 322.330 4.451 20 0 DIADLO C[C@@H](CNc1cc(C(F)(F)F)cc[nH+]1)Oc1ccccc1F ZINC000301581042 336316213 /nfs/dbraw/zinc/31/62/13/336316213.db2.gz URDZDVCJEORGCR-JTQLQIEISA-N 1 2 314.282 4.119 20 0 DIADLO C[C@H](CNc1cc(C(F)(F)F)cc[nH+]1)Oc1ccccc1F ZINC000301581043 336316299 /nfs/dbraw/zinc/31/62/99/336316299.db2.gz URDZDVCJEORGCR-SNVBAGLBSA-N 1 2 314.282 4.119 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000301586516 336316590 /nfs/dbraw/zinc/31/65/90/336316590.db2.gz VTVGXFBBHODWQM-LJQANCHMSA-N 1 2 322.383 4.260 20 0 DIADLO Fc1ccc([C@H]2CCN(c3cc(C(F)(F)F)cc[nH+]3)C2)cc1 ZINC000301589273 336316780 /nfs/dbraw/zinc/31/67/80/336316780.db2.gz XWDWJFPIXDEYLZ-LBPRGKRZSA-N 1 2 310.294 4.233 20 0 DIADLO CC[C@@H](Nc1cc(C)[nH+]c(C(C)C)n1)c1nc2ccccc2[nH]1 ZINC000301623314 336318894 /nfs/dbraw/zinc/31/88/94/336318894.db2.gz GDTOBIYNGLOLFN-CYBMUJFWSA-N 1 2 309.417 4.348 20 0 DIADLO Cc1cc(N[C@H](CCO)c2cccs2)c2cccc(F)c2[nH+]1 ZINC000301645627 336320401 /nfs/dbraw/zinc/32/04/01/336320401.db2.gz CUINUEYUPSDYLU-CQSZACIVSA-N 1 2 316.401 4.279 20 0 DIADLO Cc1nc(Nc2cccc(OCc3ccccn3)c2)c(C)c(C)[nH+]1 ZINC000301681105 336323108 /nfs/dbraw/zinc/32/31/08/336323108.db2.gz JPIIQJJSINQJKB-UHFFFAOYSA-N 1 2 320.396 4.119 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NC[C@H](CCO)c1ccccc1 ZINC000301713016 336325106 /nfs/dbraw/zinc/32/51/06/336325106.db2.gz IPUFRFIZOFHKRS-SFHVURJKSA-N 1 2 306.409 4.121 20 0 DIADLO Cc1ncsc1CNc1cc(C(C)(C)C)[nH+]c(C(C)(C)C)n1 ZINC000301718066 336325387 /nfs/dbraw/zinc/32/53/87/336325387.db2.gz IARWALQPPNBLGP-UHFFFAOYSA-N 1 2 318.490 4.449 20 0 DIADLO C[C@@H](C[C@@H](O)c1ccccc1)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000301753518 336327780 /nfs/dbraw/zinc/32/77/80/336327780.db2.gz WCJGAVQCVCQQGT-SMDDNHRTSA-N 1 2 310.319 4.025 20 0 DIADLO CC(C)Cn1cc[nH+]c1CNc1nc(-c2ccccc2)cs1 ZINC000301758646 336328158 /nfs/dbraw/zinc/32/81/58/336328158.db2.gz LPSDQMGAICRLKN-UHFFFAOYSA-N 1 2 312.442 4.275 20 0 DIADLO Cc1cc(N[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)c2cccc(F)c2[nH+]1 ZINC000301795960 336330473 /nfs/dbraw/zinc/33/04/73/336330473.db2.gz ACIZFMJWYQHCBL-MORSLUCNSA-N 1 2 312.388 4.052 20 0 DIADLO CN(Cc1nccs1)c1cc(C(C)(C)C)[nH+]c(C(C)(C)C)n1 ZINC000301795636 336330514 /nfs/dbraw/zinc/33/05/14/336330514.db2.gz YLMQYPZMAALPHO-UHFFFAOYSA-N 1 2 318.490 4.165 20 0 DIADLO CC(C)c1cc(N2CC[C@H](Nc3ccccc3)C2)nc(C(C)C)[nH+]1 ZINC000301797775 336330542 /nfs/dbraw/zinc/33/05/42/336330542.db2.gz AUMTXJRHFIZWBJ-KRWDZBQOSA-N 1 2 324.472 4.414 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CCS[C@H](c3ccccc3)C2)c1 ZINC000301802738 336331013 /nfs/dbraw/zinc/33/10/13/336331013.db2.gz UBUWXXFCCCVMPW-AWEZNQCLSA-N 1 2 324.371 4.395 20 0 DIADLO Cc1cnc(CCN(C)c2cc(C)[nH+]c3c(F)cccc23)s1 ZINC000301814991 336331996 /nfs/dbraw/zinc/33/19/96/336331996.db2.gz CZBGVWGDMYQMMJ-UHFFFAOYSA-N 1 2 315.417 4.126 20 0 DIADLO Cc1ccc([C@H](C)N(C)c2[nH+]cnc3c2cnn3C(C)(C)C)cc1 ZINC000301856285 336334530 /nfs/dbraw/zinc/33/45/30/336334530.db2.gz CECBKJMVDHGCJN-AWEZNQCLSA-N 1 2 323.444 4.087 20 0 DIADLO Cc1nc(C)c(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)s1 ZINC000301866537 336335066 /nfs/dbraw/zinc/33/50/66/336335066.db2.gz NCBJUCVTJLMYJK-UHFFFAOYSA-N 1 2 304.463 4.409 20 0 DIADLO CC(C)c1cc(N[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)nc(C(C)C)[nH+]1 ZINC000301875380 336335723 /nfs/dbraw/zinc/33/57/23/336335723.db2.gz RQOPFXAIXBHOMP-XYPHTWIQSA-N 1 2 315.461 4.093 20 0 DIADLO Clc1ccc2[nH]c3c(c2c1)CN(c1[nH]c2ccccc2[nH+]1)CC3 ZINC000301882488 336335923 /nfs/dbraw/zinc/33/59/23/336335923.db2.gz MXBXSSAMEOBPGS-UHFFFAOYSA-N 1 2 322.799 4.260 20 0 DIADLO C[C@@H](Nc1[nH+]cnc2c1cnn2C(C)(C)C)[C@@H](C)c1ccccc1 ZINC000301891151 336336508 /nfs/dbraw/zinc/33/65/08/336336508.db2.gz OBTSYFMNAWJFPQ-ZIAGYGMSSA-N 1 2 323.444 4.185 20 0 DIADLO Cc1cc(N2CCC(c3ccc(C(F)(F)F)cc3)CC2)nc[nH+]1 ZINC000301957357 336339909 /nfs/dbraw/zinc/33/99/09/336339909.db2.gz MSRDZXMNYHRQBL-UHFFFAOYSA-N 1 2 321.346 4.188 20 0 DIADLO Cc1cc(N[C@H]2CCc3c2cccc3O)c2cccc(F)c2[nH+]1 ZINC000301999965 336342323 /nfs/dbraw/zinc/34/23/23/336342323.db2.gz RKAFETSOXGKUOF-INIZCTEOSA-N 1 2 308.356 4.487 20 0 DIADLO Cc1nc2c(s1)[C@@H](Nc1cc(C(F)(F)F)cc[nH+]1)CCC2 ZINC000302043876 336345136 /nfs/dbraw/zinc/34/51/36/336345136.db2.gz SPDYAWWGBYYSIZ-NSHDSACASA-N 1 2 313.348 4.355 20 0 DIADLO CSc1cccc(N(C)Cc2[nH+]ccn2Cc2ccccc2)c1 ZINC000514103319 336345880 /nfs/dbraw/zinc/34/58/80/336345880.db2.gz BTUDUXXNRLZXCJ-UHFFFAOYSA-N 1 2 323.465 4.290 20 0 DIADLO Cc1nc(Nc2ccc(NC(=O)C(C)C)cc2)c2c([nH+]1)CCCC2 ZINC000302069035 336346757 /nfs/dbraw/zinc/34/67/57/336346757.db2.gz XGKKRVWWXPFBGQ-UHFFFAOYSA-N 1 2 324.428 4.002 20 0 DIADLO CC(C)c1nc(N[C@@H]2CCCOc3cc(F)ccc32)cc[nH+]1 ZINC000302074751 336347156 /nfs/dbraw/zinc/34/71/56/336347156.db2.gz XFEPKVAMLUQKKO-CQSZACIVSA-N 1 2 301.365 4.065 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)N(c2cc(C(F)(F)F)cc[nH+]2)C1 ZINC000302112719 336349109 /nfs/dbraw/zinc/34/91/09/336349109.db2.gz BCSGHEOZZAAAII-RISCZKNCSA-N 1 2 307.319 4.083 20 0 DIADLO CC(C)c1cc(NC[C@@H](C)c2nccs2)nc(C(C)C)[nH+]1 ZINC000302130843 336349952 /nfs/dbraw/zinc/34/99/52/336349952.db2.gz KGCJUSOOYQWAMX-GFCCVEGCSA-N 1 2 304.463 4.396 20 0 DIADLO Cc1nc(NCc2ccc(C(F)F)cc2)c2c([nH+]1)CCCC2 ZINC000302150962 336351076 /nfs/dbraw/zinc/35/10/76/336351076.db2.gz BLAJZTIPQJRFDF-UHFFFAOYSA-N 1 2 303.356 4.214 20 0 DIADLO Cc1cnc([C@@H](C)CNc2cc(C(F)(F)F)cc[nH+]2)s1 ZINC000302159072 336351367 /nfs/dbraw/zinc/35/13/67/336351367.db2.gz XLPCKXWXOSLAEN-QMMMGPOBSA-N 1 2 301.337 4.081 20 0 DIADLO COc1ccc2[nH+]c(NC[C@@H](C)c3ncc(C)s3)ccc2c1 ZINC000302160921 336351561 /nfs/dbraw/zinc/35/15/61/336351561.db2.gz YHWGVJCIDTXDKL-LLVKDONJSA-N 1 2 313.426 4.224 20 0 DIADLO c1cc2c(s1)CCC[C@H]2Nc1cc(N2CCCCC2)nc[nH+]1 ZINC000302190598 336353243 /nfs/dbraw/zinc/35/32/43/336353243.db2.gz BGOURGUBCNARQY-CQSZACIVSA-N 1 2 314.458 4.018 20 0 DIADLO c1cc2c(s1)CCC[C@H]2Nc1cc(N2CCCCC2)[nH+]cn1 ZINC000302190598 336353244 /nfs/dbraw/zinc/35/32/44/336353244.db2.gz BGOURGUBCNARQY-CQSZACIVSA-N 1 2 314.458 4.018 20 0 DIADLO Cc1cc(N2CC[C@@H](c3c(F)cccc3F)C2)nc(C(C)C)[nH+]1 ZINC000302208942 336353972 /nfs/dbraw/zinc/35/39/72/336353972.db2.gz BNMOTIQAVBXCMO-CYBMUJFWSA-N 1 2 317.383 4.181 20 0 DIADLO COc1ccc2[nH+]c(NCc3cc(F)ccc3OC)ccc2c1 ZINC000302375808 336357814 /nfs/dbraw/zinc/35/78/14/336357814.db2.gz AUZBQYNRTGYEFK-UHFFFAOYSA-N 1 2 312.344 4.003 20 0 DIADLO CC[C@@H](Nc1cc(C)[nH+]cn1)c1cc(F)cc(Br)c1 ZINC000302437461 336358801 /nfs/dbraw/zinc/35/88/01/336358801.db2.gz LSVSABAGQZKWDR-CYBMUJFWSA-N 1 2 324.197 4.250 20 0 DIADLO COc1cccc2c(NC[C@H](OC)c3ccccc3)cc[nH+]c12 ZINC000302439470 336358833 /nfs/dbraw/zinc/35/88/33/336358833.db2.gz MWCRNZSIQWVLOV-SFHVURJKSA-N 1 2 308.381 4.043 20 0 DIADLO CCSc1cc(CNc2cc(C)[nH+]c(C(C)C)n2)ccn1 ZINC000302449189 336358937 /nfs/dbraw/zinc/35/89/37/336358937.db2.gz RULOADWWYWSWAI-UHFFFAOYSA-N 1 2 302.447 4.028 20 0 DIADLO Cc1nc([C@@H]2CCCN2c2cc(C)[nH+]c(C(C)C)n2)cs1 ZINC000302459511 336359198 /nfs/dbraw/zinc/35/91/98/336359198.db2.gz UIJAAAXUBGIKRA-AWEZNQCLSA-N 1 2 302.447 4.015 20 0 DIADLO CC(C)C[C@H]1OCCC[C@H]1Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000302507414 336360371 /nfs/dbraw/zinc/36/03/71/336360371.db2.gz WMSUDWACYDMLJO-CHWSQXEVSA-N 1 2 302.340 4.106 20 0 DIADLO COc1cccc2c(N[C@@H](C)C[C@@H](O)c3ccccc3)cc[nH+]c12 ZINC000302516060 336360560 /nfs/dbraw/zinc/36/05/60/336360560.db2.gz HHEAFIBPSYJZMF-KBXCAEBGSA-N 1 2 322.408 4.168 20 0 DIADLO Cc1ccc(Br)cc1CNc1cc[nH+]c(C2CC2)n1 ZINC000302518003 336360697 /nfs/dbraw/zinc/36/06/97/336360697.db2.gz AYZBKFGDKANHMR-UHFFFAOYSA-N 1 2 318.218 4.037 20 0 DIADLO COc1cccc2c(N3C[C@H](C)C[C@@H]3c3cccnc3)cc[nH+]c12 ZINC000302523737 336360847 /nfs/dbraw/zinc/36/08/47/336360847.db2.gz JJXHLECGOACUMA-RDTXWAMCSA-N 1 2 319.408 4.226 20 0 DIADLO COc1cccc2c(NCCC[C@H]3CCCCO3)cc[nH+]c12 ZINC000302536006 336361109 /nfs/dbraw/zinc/36/11/09/336361109.db2.gz MLOIAJLLBKMHQG-CQSZACIVSA-N 1 2 300.402 4.005 20 0 DIADLO Brc1ccccc1C1CCN(c2cccc[nH+]2)CC1 ZINC000302585609 336362024 /nfs/dbraw/zinc/36/20/24/336362024.db2.gz VCSXLAUMTUCPEM-UHFFFAOYSA-N 1 2 317.230 4.228 20 0 DIADLO CCc1nc(CNc2cc(C)[nH+]c3c(F)cccc23)cs1 ZINC000302634956 336363191 /nfs/dbraw/zinc/36/31/91/336363191.db2.gz HHIZWGHPIJVSKD-UHFFFAOYSA-N 1 2 301.390 4.313 20 0 DIADLO Fc1cccc2c(NCc3ccccc3-n3cc[nH+]c3)ccnc12 ZINC000302654922 336363629 /nfs/dbraw/zinc/36/36/29/336363629.db2.gz HIRHDOPWVKRGJH-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO CC(C)c1nc(N2CC[C@@H](C(F)(F)F)C(C)(C)C2)cc[nH+]1 ZINC000302701442 336365558 /nfs/dbraw/zinc/36/55/58/336365558.db2.gz IBJFOFKLHZCYBD-LLVKDONJSA-N 1 2 301.356 4.015 20 0 DIADLO Cc1cc(N2CC[C@@H](C(F)(F)F)C(C)(C)C2)nc(C(C)C)[nH+]1 ZINC000302712187 336366086 /nfs/dbraw/zinc/36/60/86/336366086.db2.gz LAHDWWFVPGOIPZ-GFCCVEGCSA-N 1 2 315.383 4.323 20 0 DIADLO Cc1cc(NCCc2ccc(C)[nH+]c2)c2ccc(F)c(F)c2n1 ZINC000302740572 336367397 /nfs/dbraw/zinc/36/73/97/336367397.db2.gz RAQDSBQOTITKBV-UHFFFAOYSA-N 1 2 313.351 4.179 20 0 DIADLO Cc1cc(NCCc2cc[nH+]cc2C)c2ccc(F)c(F)c2n1 ZINC000302752348 336367789 /nfs/dbraw/zinc/36/77/89/336367789.db2.gz VRGHAHSZEOUKDL-UHFFFAOYSA-N 1 2 313.351 4.179 20 0 DIADLO CC(C)c1ccc([C@H]2CCCN2c2nc[nH+]c(N)c2Cl)cc1 ZINC000302850634 336371928 /nfs/dbraw/zinc/37/19/28/336371928.db2.gz PQTSWCXXHKUUIG-CQSZACIVSA-N 1 2 316.836 4.177 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)s1 ZINC000352947185 336378707 /nfs/dbraw/zinc/37/87/07/336378707.db2.gz OXRKORWMDYQZBJ-KOLCDFICSA-N 1 2 324.437 4.169 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)s1 ZINC000352947185 336378708 /nfs/dbraw/zinc/37/87/08/336378708.db2.gz OXRKORWMDYQZBJ-KOLCDFICSA-N 1 2 324.437 4.169 20 0 DIADLO CCc1[nH]ccc1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000352971575 336380260 /nfs/dbraw/zinc/38/02/60/336380260.db2.gz FVVPBUHCKRRSGK-UHFFFAOYSA-N 1 2 307.353 4.017 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Br)o1)c1ccc(F)cc1F ZINC000035010808 336390663 /nfs/dbraw/zinc/39/06/63/336390663.db2.gz XJXAGBYUBZJDJP-QMMMGPOBSA-N 1 2 316.145 4.171 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1ccc(Cl)cc1OC ZINC000482638142 336392787 /nfs/dbraw/zinc/39/27/87/336392787.db2.gz DGQWROIXTMAPQY-NSHDSACASA-N 1 2 323.795 4.347 20 0 DIADLO CCn1c[nH+]cc1CNc1ccccc1CN(C)c1ccccc1 ZINC000418029803 336392993 /nfs/dbraw/zinc/39/29/93/336392993.db2.gz LUFQSHLMILZQEU-UHFFFAOYSA-N 1 2 320.440 4.152 20 0 DIADLO Fc1cccc2c1SCC[C@@H]2Nc1cc[nH+]c(C2CC2)n1 ZINC000110124225 336395836 /nfs/dbraw/zinc/39/58/36/336395836.db2.gz ALLIAQXZWKCHLF-ZDUSSCGKSA-N 1 2 301.390 4.142 20 0 DIADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1cccc(OC(F)F)c1 ZINC000110209725 336395996 /nfs/dbraw/zinc/39/59/96/336395996.db2.gz RSXGAGWZQNUEKP-SNVBAGLBSA-N 1 2 305.328 4.129 20 0 DIADLO CCOc1ccccc1C1=CCN(c2cc[nH+]c(C3CC3)n2)CC1 ZINC000110333514 336396150 /nfs/dbraw/zinc/39/61/50/336396150.db2.gz DSNRESGXESIHHQ-UHFFFAOYSA-N 1 2 321.424 4.046 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+][C@@H]1COCc2ccccc21 ZINC000418101834 336400919 /nfs/dbraw/zinc/40/09/19/336400919.db2.gz SOEMARKMRYTMGP-MRXNPFEDSA-N 1 2 308.208 4.355 20 0 DIADLO Cc1ccc(NCc2c[nH]nc2-c2cccc(Cl)c2)c(C)[nH+]1 ZINC000353184862 336405922 /nfs/dbraw/zinc/40/59/22/336405922.db2.gz CBCDFOAZGJODPW-UHFFFAOYSA-N 1 2 312.804 4.354 20 0 DIADLO CCn1cc[nH+]c1CN(Cc1c(F)cccc1F)C1CCCC1 ZINC000353329509 336412030 /nfs/dbraw/zinc/41/20/30/336412030.db2.gz ILHJQHPROHNOSP-UHFFFAOYSA-N 1 2 319.399 4.126 20 0 DIADLO Fc1cc(-c2ccncc2)ccc1C[NH+]1Cc2ccccc2C1 ZINC000353408714 336416002 /nfs/dbraw/zinc/41/60/02/336416002.db2.gz UYFRQWARPRKSHE-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO CCCOc1ccc([C@H](C)[NH2+][C@H](C)c2cc(C)on2)cc1OC ZINC000353427021 336417278 /nfs/dbraw/zinc/41/72/78/336417278.db2.gz OBRYJTLNLWFXOR-UONOGXRCSA-N 1 2 318.417 4.192 20 0 DIADLO CCSc1ccccc1[C@@H](C)[NH2+]Cc1csc(COC)n1 ZINC000353632122 336430372 /nfs/dbraw/zinc/43/03/72/336430372.db2.gz RQAOYCXBGCCKKA-GFCCVEGCSA-N 1 2 322.499 4.252 20 0 DIADLO O=C(C/C=C\c1ccc(F)cc1)Nc1ccccc1-n1cc[nH+]c1 ZINC000353740765 336437404 /nfs/dbraw/zinc/43/74/04/336437404.db2.gz RXVQMGLYUVIFDK-ARJAWSKDSA-N 1 2 321.355 4.053 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)[C@@H]1CC12CCCC2 ZINC000353820359 336442484 /nfs/dbraw/zinc/44/24/84/336442484.db2.gz YLIRQCLHINUSCQ-ZDUSSCGKSA-N 1 2 315.804 4.045 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(CN(c2cc[nH+]c(C3CC3)n2)C2CC2)o1 ZINC000354050990 336456392 /nfs/dbraw/zinc/45/63/92/336456392.db2.gz CHAATGWAZKYCHE-BLLLJJGKSA-N 1 2 309.413 4.239 20 0 DIADLO CO[C@@H](CNc1[nH+]ccc2ccc(F)cc21)c1ccc(F)cc1 ZINC000354556373 336474647 /nfs/dbraw/zinc/47/46/47/336474647.db2.gz CXGFPTSUWWAIGU-KRWDZBQOSA-N 1 2 314.335 4.313 20 0 DIADLO CC(C)(C)c1nnc(CNc2[nH+]ccc3ccc(F)cc32)s1 ZINC000354881984 336486398 /nfs/dbraw/zinc/48/63/98/336486398.db2.gz RNIFMPYIXHNDQH-UHFFFAOYSA-N 1 2 316.405 4.135 20 0 DIADLO CN(Cc1cc(-n2cc[nH+]c2)cs1)c1ccc2cc[nH]c2c1 ZINC000355293159 336503032 /nfs/dbraw/zinc/50/30/32/336503032.db2.gz QMGRRZJRIGKENZ-UHFFFAOYSA-N 1 2 308.410 4.052 20 0 DIADLO CC1(C)C(c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)C1(C)C ZINC000355994255 336531371 /nfs/dbraw/zinc/53/13/71/336531371.db2.gz SPSMLLZFHXWIKH-UHFFFAOYSA-N 1 2 322.412 4.131 20 0 DIADLO C/C(=C\c1nc(Cc2ccc(C)[nH+]c2)no1)c1ccc(F)cc1 ZINC000356118135 336536682 /nfs/dbraw/zinc/53/66/82/336536682.db2.gz XRPULJBBXFPZRP-FMIVXFBMSA-N 1 2 309.344 4.063 20 0 DIADLO CSC1(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)CCC1 ZINC000356134115 336537790 /nfs/dbraw/zinc/53/77/90/336537790.db2.gz KGIHNUJDSZGFAD-UHFFFAOYSA-N 1 2 307.850 4.223 20 0 DIADLO FC1(F)CCC12C[NH+](Cc1ncc(-c3ccccc3)s1)C2 ZINC000356516706 336552720 /nfs/dbraw/zinc/55/27/20/336552720.db2.gz FHEOWAMRHPNRFY-UHFFFAOYSA-N 1 2 306.381 4.041 20 0 DIADLO COCc1cc(N(C)Cc2cccs2)c2cc(F)ccc2[nH+]1 ZINC000357326820 336580823 /nfs/dbraw/zinc/58/08/23/336580823.db2.gz RBPPMOQHDGBPFI-UHFFFAOYSA-N 1 2 316.401 4.218 20 0 DIADLO C[C@H]([NH2+]Cc1nc2cc(Cl)ccc2s1)c1nccs1 ZINC000357780121 336597956 /nfs/dbraw/zinc/59/79/56/336597956.db2.gz UIDGCATUZAQVLM-QMMMGPOBSA-N 1 2 309.847 4.257 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](c2ccccc2)c2ccc(C)cc2)s1 ZINC000358503669 336632430 /nfs/dbraw/zinc/63/24/30/336632430.db2.gz DKXGYZVAANIVOX-SFHVURJKSA-N 1 2 309.438 4.034 20 0 DIADLO Cc1nnc(C[NH2+]C(C)(C)c2ccc(Cl)c(Cl)c2)s1 ZINC000358621647 336637104 /nfs/dbraw/zinc/63/71/04/336637104.db2.gz YRIHXJPDPMKYTE-UHFFFAOYSA-N 1 2 316.257 4.178 20 0 DIADLO Clc1cnc(CSCc2ccc(-n3cc[nH+]c3)cc2)s1 ZINC000358663201 336638655 /nfs/dbraw/zinc/63/86/55/336638655.db2.gz QPJIHUOBQVOEIK-UHFFFAOYSA-N 1 2 321.858 4.416 20 0 DIADLO COC(=O)c1ccc(F)c(CSCc2ccc(C)[nH+]c2C)c1 ZINC000358667315 336638935 /nfs/dbraw/zinc/63/89/35/336638935.db2.gz ZPLDHWPOHIOMLL-UHFFFAOYSA-N 1 2 319.401 4.058 20 0 DIADLO c1c[nH+]c([C@H](Nc2csc3ccccc23)c2cccnc2)[nH]1 ZINC000359006518 336652819 /nfs/dbraw/zinc/65/28/19/336652819.db2.gz SGXUVUBOYKLGFO-MRXNPFEDSA-N 1 2 306.394 4.221 20 0 DIADLO COCc1cccc(CSCc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000359061078 336655760 /nfs/dbraw/zinc/65/57/60/336655760.db2.gz XHFIJEGPJUWAII-UHFFFAOYSA-N 1 2 324.449 4.452 20 0 DIADLO COCCCSCCCCCn1c(C)[nH+]c2ccccc21 ZINC000359518010 336675755 /nfs/dbraw/zinc/67/57/55/336675755.db2.gz OUDVVWYDKZEYPA-UHFFFAOYSA-N 1 2 306.475 4.285 20 0 DIADLO CC(C)[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)c1nc(C2CC2)no1 ZINC000359633829 336681016 /nfs/dbraw/zinc/68/10/16/336681016.db2.gz LMLQFDNNEYUGLA-IINYFYTJSA-N 1 2 320.824 4.043 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)nc1 ZINC000359642893 336681497 /nfs/dbraw/zinc/68/14/97/336681497.db2.gz YZRDUSPRPVOQBU-MRXNPFEDSA-N 1 2 307.800 4.064 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccc(Cl)cn1 ZINC000359647194 336681743 /nfs/dbraw/zinc/68/17/43/336681743.db2.gz UTWMLLFYADECOG-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO C[C@H]([NH2+]Cc1nccn1-c1ccccc1)c1c(F)cccc1F ZINC000359959738 336695537 /nfs/dbraw/zinc/69/55/37/336695537.db2.gz UVHRDJIVLLXXIT-ZDUSSCGKSA-N 1 2 313.351 4.001 20 0 DIADLO CCC(CC)N(CC(C)C)C(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000360343628 336709260 /nfs/dbraw/zinc/70/92/60/336709260.db2.gz CMTFKXDNOAEHFM-UHFFFAOYSA-N 1 2 313.445 4.159 20 0 DIADLO COc1ccc(F)cc1C[NH2+]Cc1nc(C(C)C)c(C)s1 ZINC000360983413 336730734 /nfs/dbraw/zinc/73/07/34/336730734.db2.gz MOWQPQSVDINJQQ-UHFFFAOYSA-N 1 2 308.422 4.012 20 0 DIADLO C[C@H]([NH2+]Cc1nccs1)c1csc(-c2ccccc2F)n1 ZINC000361096026 336738249 /nfs/dbraw/zinc/73/82/49/336738249.db2.gz KZVGGBFMVSYNCB-JTQLQIEISA-N 1 2 319.430 4.257 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCOc2c(F)ccc(F)c21)c1ccccc1F ZINC000361177771 336742563 /nfs/dbraw/zinc/74/25/63/336742563.db2.gz JTDJFFDVSOZNIQ-MEBBXXQBSA-N 1 2 307.315 4.278 20 0 DIADLO CC[C@@H]([NH2+][C@H]1CCOc2c(F)ccc(F)c21)c1ccc(F)cn1 ZINC000361181404 336742640 /nfs/dbraw/zinc/74/26/40/336742640.db2.gz MAHIWZXGINVSHR-HIFRSBDPSA-N 1 2 322.330 4.063 20 0 DIADLO CC(C)c1ncc(C[NH2+][C@@H]2CCOc3c(F)ccc(F)c32)s1 ZINC000361236164 336745802 /nfs/dbraw/zinc/74/58/02/336745802.db2.gz HRMHPUJBMINFPZ-CYBMUJFWSA-N 1 2 324.396 4.158 20 0 DIADLO COc1ccc(CN(Cc2ccccc2)c2cc[nH+]c(C)n2)cc1 ZINC000362129340 336785174 /nfs/dbraw/zinc/78/51/74/336785174.db2.gz LLONBPISOZNNKP-UHFFFAOYSA-N 1 2 319.408 4.000 20 0 DIADLO Cc1ccc(CCC(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)s1 ZINC000362745829 336810543 /nfs/dbraw/zinc/81/05/43/336810543.db2.gz QSVBFASZZWZSCC-UHFFFAOYSA-N 1 2 311.410 4.018 20 0 DIADLO CC(C)N(C)c1ccc(CNc2ccc3scnc3c2)c[nH+]1 ZINC000362990818 336817151 /nfs/dbraw/zinc/81/71/51/336817151.db2.gz PZUWNJBWEMIAQD-UHFFFAOYSA-N 1 2 312.442 4.148 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)N1CCC[C@H]1C1CC1 ZINC000363065659 336818200 /nfs/dbraw/zinc/81/82/00/336818200.db2.gz DEYPJRYKUZKCIW-SFHVURJKSA-N 1 2 323.396 4.280 20 0 DIADLO COc1ccccc1C[NH2+][C@@H](c1ccc(C)cc1)c1ccccn1 ZINC000369545513 336866720 /nfs/dbraw/zinc/86/67/20/336866720.db2.gz HXHKMNZKKGMKSB-NRFANRHFSA-N 1 2 318.420 4.278 20 0 DIADLO CCOc1ccc(C(=O)Nc2ccccc2-c2[nH]cc(C)[nH+]2)cc1 ZINC000371246516 336898355 /nfs/dbraw/zinc/89/83/55/336898355.db2.gz DZYUECIFDYNJRK-UHFFFAOYSA-N 1 2 321.380 4.036 20 0 DIADLO CCn1c(C)cc(C(=O)Nc2ccccc2-c2[nH]cc(C)[nH+]2)c1C ZINC000371246727 336898381 /nfs/dbraw/zinc/89/83/81/336898381.db2.gz GQRFBJKQIRGBNB-UHFFFAOYSA-N 1 2 322.412 4.076 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)CCCc2ccccc2)[nH+]1 ZINC000371246744 336898450 /nfs/dbraw/zinc/89/84/50/336898450.db2.gz GVZSEGVNNFSVOL-UHFFFAOYSA-N 1 2 319.408 4.347 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cccc(Cl)c2)[nH+]1 ZINC000371246778 336898534 /nfs/dbraw/zinc/89/85/34/336898534.db2.gz HBLOEPOMKUNDKA-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)NC(=O)Nc1cc[nH+]cc1C ZINC000121610081 336968769 /nfs/dbraw/zinc/96/87/69/336968769.db2.gz WSUUENNPJKVBRQ-CYBMUJFWSA-N 1 2 309.369 4.327 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1CCC[C@@H]1c1cccc(Cl)c1 ZINC000121786053 336977572 /nfs/dbraw/zinc/97/75/72/336977572.db2.gz CHLDPNIWFRQRFV-MRXNPFEDSA-N 1 2 315.804 4.412 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@@H](C)c1ccc(F)cc1Cl ZINC000121846639 336981494 /nfs/dbraw/zinc/98/14/94/336981494.db2.gz OMSOMHGPSUQJKK-JTQLQIEISA-N 1 2 307.756 4.065 20 0 DIADLO Cc1nn(C(C)C)cc1C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000374277677 336985749 /nfs/dbraw/zinc/98/57/49/336985749.db2.gz NAHKRURJQWEIMS-IBGZPJMESA-N 1 2 309.413 4.245 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1C[C@@H]2CCCC[C@@]21c1ccccc1 ZINC000122143060 336996029 /nfs/dbraw/zinc/99/60/29/336996029.db2.gz YEFAYTAIJLSOFC-FXAWDEMLSA-N 1 2 321.424 4.323 20 0 DIADLO COc1cccc2c(N[C@@H](CCCO)c3ccccc3)cc[nH+]c12 ZINC000193484013 337008374 /nfs/dbraw/zinc/00/83/74/337008374.db2.gz MXUXVEOQHWIESE-KRWDZBQOSA-N 1 2 322.408 4.169 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3cc[nH]c3C(C)C)c2)[nH+]c1C ZINC000375603467 337014327 /nfs/dbraw/zinc/01/43/27/337014327.db2.gz ABKWBFSHDXPWKJ-UHFFFAOYSA-N 1 2 322.412 4.397 20 0 DIADLO C[C@@H]1C[C@@H]1[C@@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc(Cl)cc1 ZINC000375782966 337019474 /nfs/dbraw/zinc/01/94/74/337019474.db2.gz PIKNWWXNVWQXBK-TZJWZKGTSA-N 1 2 315.848 4.427 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+][C@@H]2COc3c2ccc(Cl)c3Cl)c1 ZINC000375800643 337019796 /nfs/dbraw/zinc/01/97/96/337019796.db2.gz CITHVXSOHVIQIX-IINYFYTJSA-N 1 2 323.223 4.481 20 0 DIADLO C[C@H](Nc1cccc(-c2cn3c([nH+]2)CCCC3)c1)c1cccnc1 ZINC000376168805 337028860 /nfs/dbraw/zinc/02/88/60/337028860.db2.gz YICRJPDEWXJDKW-HNNXBMFYSA-N 1 2 318.424 4.455 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cccc1F)c1nccn1-c1ccccc1 ZINC000376607584 337037885 /nfs/dbraw/zinc/03/78/85/337037885.db2.gz YZOXPMPKEKPNGL-CYBMUJFWSA-N 1 2 313.351 4.001 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC(C2CCCC2)CC1 ZINC000376639176 337038762 /nfs/dbraw/zinc/03/87/62/337038762.db2.gz DJSQEYLZSWHECV-UHFFFAOYSA-N 1 2 301.434 4.133 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1cncc(F)c1 ZINC000123283627 337041986 /nfs/dbraw/zinc/04/19/86/337041986.db2.gz KEGHRQYLGRJIGH-BLLLJJGKSA-N 1 2 313.401 4.117 20 0 DIADLO c1coc([C@@H]([NH2+]Cc2ccc(-c3cc[nH]n3)o2)c2ccccc2)c1 ZINC000377105427 337046900 /nfs/dbraw/zinc/04/69/00/337046900.db2.gz VLBHBJCZHVNVII-IBGZPJMESA-N 1 2 319.364 4.142 20 0 DIADLO O=C([C@@H]1CCC[C@@H]2CCCC[C@H]12)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000377155234 337047739 /nfs/dbraw/zinc/04/77/39/337047739.db2.gz PZHKQJZUYORHDC-MWDXBVQZSA-N 1 2 315.461 4.070 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H]2c3ccc(F)cc3O[C@@H]2C)s1 ZINC000377384686 337051444 /nfs/dbraw/zinc/05/14/44/337051444.db2.gz XRUVBLOBTPCHRV-QLJPJBMISA-N 1 2 306.406 4.017 20 0 DIADLO Cc1ccc([C@H]2CCCN2C(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC000377752616 337060145 /nfs/dbraw/zinc/06/01/45/337060145.db2.gz VPZBIHZTBARZRP-QGZVFWFLSA-N 1 2 320.396 4.012 20 0 DIADLO Cc1csc(C[NH2+]Cc2nc(-c3ccccc3F)cs2)n1 ZINC000378127533 337066778 /nfs/dbraw/zinc/06/67/78/337066778.db2.gz HQBPYDWDHUJPJP-UHFFFAOYSA-N 1 2 319.430 4.004 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1ccccn1 ZINC000378477940 337073809 /nfs/dbraw/zinc/07/38/09/337073809.db2.gz XLWQMPUVIANFLE-OAHLLOKOSA-N 1 2 316.408 4.170 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+]([C@H](C)c2nc3ccccc3o2)CCO1 ZINC000378483560 337073840 /nfs/dbraw/zinc/07/38/40/337073840.db2.gz ITALRBGTRWUBOZ-DNVCBOLYSA-N 1 2 322.408 4.271 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+]([C@H](C)c2nc3ccccc3o2)CCO1 ZINC000378483560 337073841 /nfs/dbraw/zinc/07/38/41/337073841.db2.gz ITALRBGTRWUBOZ-DNVCBOLYSA-N 1 2 322.408 4.271 20 0 DIADLO O=C(C[C@H]1CCC[N@H+]1Cc1ccc(Cl)cn1)c1cccs1 ZINC000378480374 337073925 /nfs/dbraw/zinc/07/39/25/337073925.db2.gz ATVZWJNNAKFLTP-CQSZACIVSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@H]1CCC[N@@H+]1Cc1ccc(Cl)cn1)c1cccs1 ZINC000378480374 337073926 /nfs/dbraw/zinc/07/39/26/337073926.db2.gz ATVZWJNNAKFLTP-CQSZACIVSA-N 1 2 320.845 4.034 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000170781933 337083028 /nfs/dbraw/zinc/08/30/28/337083028.db2.gz UXJYBUJSHPPCMI-JKSUJKDBSA-N 1 2 305.466 4.460 20 0 DIADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1nccn1Cc1ccccc1 ZINC000170956065 337085545 /nfs/dbraw/zinc/08/55/45/337085545.db2.gz OLWDMISDLLDIHU-KRWDZBQOSA-N 1 2 317.436 4.051 20 0 DIADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1nccn1Cc1ccccc1 ZINC000170956065 337085546 /nfs/dbraw/zinc/08/55/46/337085546.db2.gz OLWDMISDLLDIHU-KRWDZBQOSA-N 1 2 317.436 4.051 20 0 DIADLO Fc1ccc(C(F)(F)C[NH2+]Cc2scnc2C2CC2)cc1 ZINC000583704789 337092485 /nfs/dbraw/zinc/09/24/85/337092485.db2.gz RDIPBAXYOTVGKL-UHFFFAOYSA-N 1 2 312.360 4.041 20 0 DIADLO CN(C)c1ccccc1C[N@H+](C)Cc1ncc(Cl)cc1Cl ZINC000582509884 337099645 /nfs/dbraw/zinc/09/96/45/337099645.db2.gz PFAIFEBUYYTKEZ-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1ccccc1C[N@@H+](C)Cc1ncc(Cl)cc1Cl ZINC000582509884 337099646 /nfs/dbraw/zinc/09/96/46/337099646.db2.gz PFAIFEBUYYTKEZ-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO Cc1cc(C[NH+]2CC3(CCC3(F)F)C2)sc1Br ZINC000582518504 337099995 /nfs/dbraw/zinc/09/99/95/337099995.db2.gz RZGOKWVCBABTLR-UHFFFAOYSA-N 1 2 322.218 4.050 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2ccc(Oc3cccnc3)cc2)o1 ZINC000582629174 337116251 /nfs/dbraw/zinc/11/62/51/337116251.db2.gz DGXDQLLFMMUWFC-CQSZACIVSA-N 1 2 323.396 4.275 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccn3cc[nH+]c3c2)cc1OC(C)C ZINC000582637007 337116535 /nfs/dbraw/zinc/11/65/35/337116535.db2.gz SAPKXRHOGRWUFM-UHFFFAOYSA-N 1 2 324.384 4.074 20 0 DIADLO Cc1ccc([C@H]2CCCCN2C(=O)c2ccc3[nH+]ccn3c2)cc1 ZINC000172665145 337129408 /nfs/dbraw/zinc/12/94/08/337129408.db2.gz WUQNOKPKVLBZBW-GOSISDBHSA-N 1 2 319.408 4.010 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1cc(-c2ccco2)on1 ZINC000023355941 337130607 /nfs/dbraw/zinc/13/06/07/337130607.db2.gz WSWMXQCHJKZIKV-NSHDSACASA-N 1 2 318.323 4.406 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1cc(-c2ccco2)on1 ZINC000023355941 337130608 /nfs/dbraw/zinc/13/06/08/337130608.db2.gz WSWMXQCHJKZIKV-NSHDSACASA-N 1 2 318.323 4.406 20 0 DIADLO CCc1ccc([C@H]2CCCC[N@@H+]2Cc2nc(C(C)C)no2)o1 ZINC000172871218 337131736 /nfs/dbraw/zinc/13/17/36/337131736.db2.gz MJWVAZHCBKNVQM-CQSZACIVSA-N 1 2 303.406 4.076 20 0 DIADLO CCc1ccc([C@H]2CCCC[N@H+]2Cc2nc(C(C)C)no2)o1 ZINC000172871218 337131737 /nfs/dbraw/zinc/13/17/37/337131737.db2.gz MJWVAZHCBKNVQM-CQSZACIVSA-N 1 2 303.406 4.076 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1csc(-c2ccccn2)n1 ZINC000172994868 337132812 /nfs/dbraw/zinc/13/28/12/337132812.db2.gz JWYZPPZXOHUEMS-AWEZNQCLSA-N 1 2 321.449 4.152 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1csc(-c2ccccn2)n1 ZINC000172994868 337132813 /nfs/dbraw/zinc/13/28/13/337132813.db2.gz JWYZPPZXOHUEMS-AWEZNQCLSA-N 1 2 321.449 4.152 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1 ZINC000425596759 337133629 /nfs/dbraw/zinc/13/36/29/337133629.db2.gz PBTOCTBYCKFGLD-AWEZNQCLSA-N 1 2 324.424 4.279 20 0 DIADLO CCOCCSCCCCCn1c(C)[nH+]c2ccccc21 ZINC000460879921 337134787 /nfs/dbraw/zinc/13/47/87/337134787.db2.gz XZKIMRLTJSJWSM-UHFFFAOYSA-N 1 2 306.475 4.285 20 0 DIADLO O=C(c1cccc(Oc2cc[nH+]cc2)c1)N1CCC2(CCCC2)C1 ZINC000173768748 337138219 /nfs/dbraw/zinc/13/82/19/337138219.db2.gz QOIXPUKQHRTPSG-UHFFFAOYSA-N 1 2 322.408 4.280 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)cc1F)c1ncc(-c2ccccc2)o1 ZINC000174014622 337140594 /nfs/dbraw/zinc/14/05/94/337140594.db2.gz XUAJNMDVCPEWIM-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO Cc1cccc(C[NH2+][C@@H](C)c2nc(-c3cccc(F)c3)no2)c1 ZINC000174668876 337142974 /nfs/dbraw/zinc/14/29/74/337142974.db2.gz NWMWCDNMAKBPIS-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000175122432 337144476 /nfs/dbraw/zinc/14/44/76/337144476.db2.gz JBACTIAHJUGRRY-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000175122432 337144477 /nfs/dbraw/zinc/14/44/77/337144477.db2.gz JBACTIAHJUGRRY-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1cc(-c2ccco2)on1 ZINC000175144102 337144699 /nfs/dbraw/zinc/14/46/99/337144699.db2.gz LGDSTDIPXDAUMX-INIZCTEOSA-N 1 2 311.385 4.000 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1cc(-c2ccco2)on1 ZINC000175144102 337144700 /nfs/dbraw/zinc/14/47/00/337144700.db2.gz LGDSTDIPXDAUMX-INIZCTEOSA-N 1 2 311.385 4.000 20 0 DIADLO C[C@H](c1ccc([S@@](C)=O)cc1)[N@H+](C)Cc1ccccc1Cl ZINC000175391048 337145660 /nfs/dbraw/zinc/14/56/60/337145660.db2.gz FGDOKJDHVYWCAK-LRTDBIEQSA-N 1 2 321.873 4.270 20 0 DIADLO C[C@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)Cc1ccccc1Cl ZINC000175391048 337145661 /nfs/dbraw/zinc/14/56/61/337145661.db2.gz FGDOKJDHVYWCAK-LRTDBIEQSA-N 1 2 321.873 4.270 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cnc(Cl)s1 ZINC000175425833 337147206 /nfs/dbraw/zinc/14/72/06/337147206.db2.gz UAQFZSWUFTWAOK-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1cnc(Cl)s1 ZINC000175425833 337147207 /nfs/dbraw/zinc/14/72/07/337147207.db2.gz UAQFZSWUFTWAOK-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO C[C@H](C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1)c1cc2ccccc2o1 ZINC000176218942 337149719 /nfs/dbraw/zinc/14/97/19/337149719.db2.gz CYZVQLRIORGBIG-DZGCQCFKSA-N 1 2 323.396 4.013 20 0 DIADLO CCCC[C@H](CCC)NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000175997112 337149984 /nfs/dbraw/zinc/14/99/84/337149984.db2.gz QLVMZQDLWUISEX-GJZGRUSLSA-N 1 2 306.454 4.005 20 0 DIADLO CCCC[C@@H](CCC)NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000175997058 337149997 /nfs/dbraw/zinc/14/99/97/337149997.db2.gz QLVMZQDLWUISEX-HUUCEWRRSA-N 1 2 306.454 4.005 20 0 DIADLO CCCC[C@H](CCC)NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000175997075 337150043 /nfs/dbraw/zinc/15/00/43/337150043.db2.gz QLVMZQDLWUISEX-LSDHHAIUSA-N 1 2 306.454 4.005 20 0 DIADLO CSc1cc(C)ccc1CNC(=O)Nc1ccc(C)[nH+]c1C ZINC000176501787 337151550 /nfs/dbraw/zinc/15/15/50/337151550.db2.gz VXRDEXMSOOJGGY-UHFFFAOYSA-N 1 2 315.442 4.050 20 0 DIADLO Cc1cc([C@H](C)NC(=O)Nc2ccc(C)[nH+]c2C)c(C)s1 ZINC000176723540 337151737 /nfs/dbraw/zinc/15/17/37/337151737.db2.gz VVGUFUSRWGBOFZ-NSHDSACASA-N 1 2 303.431 4.259 20 0 DIADLO C[C@H]1CC(CC[S@@](=O)Cc2cn3ccccc3[nH+]2)C[C@H](C)C1 ZINC000176987117 337154017 /nfs/dbraw/zinc/15/40/17/337154017.db2.gz NKKIEWNQFSIPQC-DOQJBMMISA-N 1 2 318.486 4.045 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)Cc2ccc(CC)cc2)n1 ZINC000178276402 337161914 /nfs/dbraw/zinc/16/19/14/337161914.db2.gz SWVPLECDBTXLGM-ZDUSSCGKSA-N 1 2 319.474 4.078 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)Cc2ccc(CC)cc2)n1 ZINC000178276402 337161915 /nfs/dbraw/zinc/16/19/15/337161915.db2.gz SWVPLECDBTXLGM-ZDUSSCGKSA-N 1 2 319.474 4.078 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)Cc2ccc(CC)cc2)n1 ZINC000178276382 337161937 /nfs/dbraw/zinc/16/19/37/337161937.db2.gz SWVPLECDBTXLGM-CYBMUJFWSA-N 1 2 319.474 4.078 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)Cc2ccc(CC)cc2)n1 ZINC000178276382 337161938 /nfs/dbraw/zinc/16/19/38/337161938.db2.gz SWVPLECDBTXLGM-CYBMUJFWSA-N 1 2 319.474 4.078 20 0 DIADLO CC(=O)Nc1ccc(CNc2cc(C)[nH+]c3c(F)cccc23)cc1 ZINC000178162194 337162674 /nfs/dbraw/zinc/16/26/74/337162674.db2.gz OTGMJBUIYMCBKP-UHFFFAOYSA-N 1 2 323.371 4.253 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1)c1noc(-c2ccccc2)n1 ZINC000178486628 337163071 /nfs/dbraw/zinc/16/30/71/337163071.db2.gz KQCIOQYSHYBUJF-STQMWFEESA-N 1 2 311.360 4.288 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2cnc(-c3cccs3)s2)s1 ZINC000179382956 337167572 /nfs/dbraw/zinc/16/75/72/337167572.db2.gz MOFWJVQLIRKCFO-UHFFFAOYSA-N 1 2 321.496 4.269 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2cnc(-c3cccs3)s2)s1 ZINC000179382956 337167573 /nfs/dbraw/zinc/16/75/73/337167573.db2.gz MOFWJVQLIRKCFO-UHFFFAOYSA-N 1 2 321.496 4.269 20 0 DIADLO CSCCC[NH2+][C@H](c1cccc(OC(C)C)c1)C(F)F ZINC000582796782 337169520 /nfs/dbraw/zinc/16/95/20/337169520.db2.gz ZLCGZPGPPIFHPH-CQSZACIVSA-N 1 2 303.418 4.123 20 0 DIADLO Cc1scc(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)c1C ZINC000179781053 337171757 /nfs/dbraw/zinc/17/17/57/337171757.db2.gz GLPYMMUULLCNKH-UHFFFAOYSA-N 1 2 311.410 4.018 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)Cc1ccc(Cl)cc1 ZINC000425599137 337179025 /nfs/dbraw/zinc/17/90/25/337179025.db2.gz ZCHCPVWKFKUXGP-LBPRGKRZSA-N 1 2 302.805 4.169 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2nnc(C3CCC3)n2C)cc1 ZINC000181376239 337181785 /nfs/dbraw/zinc/18/17/85/337181785.db2.gz LTAZMVYGUHVCMD-SFHVURJKSA-N 1 2 324.472 4.118 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2nnc(C3CCC3)n2C)cc1 ZINC000181376239 337181786 /nfs/dbraw/zinc/18/17/86/337181786.db2.gz LTAZMVYGUHVCMD-SFHVURJKSA-N 1 2 324.472 4.118 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(-c2ccccc2F)o1)c1cccc(O)c1 ZINC000181518220 337182769 /nfs/dbraw/zinc/18/27/69/337182769.db2.gz DDSRLQCSEDGLBB-GFCCVEGCSA-N 1 2 312.344 4.037 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cccc(O)c1)c1ncc(-c2ccccc2)o1 ZINC000181579792 337183171 /nfs/dbraw/zinc/18/31/71/337183171.db2.gz QDTOGCRLBKHUDY-KBPBESRZSA-N 1 2 308.381 4.459 20 0 DIADLO CC[C@@H]([NH2+]Cc1noc(-c2ccsc2)n1)c1ccc(C)cc1 ZINC000181707611 337183899 /nfs/dbraw/zinc/18/38/99/337183899.db2.gz HBVYMSVHTXJYSU-OAHLLOKOSA-N 1 2 313.426 4.347 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)cc2Cl)n1 ZINC000182473360 337186379 /nfs/dbraw/zinc/18/63/79/337186379.db2.gz XCMKHUVDCJADET-INIZCTEOSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ncc(Cl)cc2Cl)n1 ZINC000182473360 337186380 /nfs/dbraw/zinc/18/63/80/337186380.db2.gz XCMKHUVDCJADET-INIZCTEOSA-N 1 2 322.239 4.429 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2cccc(Cl)c2)n1)c1cccnc1 ZINC000182892009 337190670 /nfs/dbraw/zinc/19/06/70/337190670.db2.gz GWDCWEUTNKNQRN-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1ccc(C)c(C[N@H+](C)Cc2noc(-c3ccsc3)n2)c1 ZINC000429287332 337191608 /nfs/dbraw/zinc/19/16/08/337191608.db2.gz SZDLIZLJYLHOPO-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccc(C)c(C[N@@H+](C)Cc2noc(-c3ccsc3)n2)c1 ZINC000429287332 337191609 /nfs/dbraw/zinc/19/16/09/337191609.db2.gz SZDLIZLJYLHOPO-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2sc(C)nc2C(F)(F)F)n1 ZINC000183670825 337194074 /nfs/dbraw/zinc/19/40/74/337194074.db2.gz FMLOOPIKSOQKIR-SSDOTTSWSA-N 1 2 321.393 4.086 20 0 DIADLO Cc1cc(C)cc([C@H]2CCN(C(=O)Nc3cc[nH+]cc3C)C2)c1 ZINC000183962676 337195897 /nfs/dbraw/zinc/19/58/97/337195897.db2.gz JLBFWGCGNUYUFB-INIZCTEOSA-N 1 2 309.413 4.028 20 0 DIADLO COc1ccc(OC(C)C)c(NCc2ccc(C)[nH+]c2C)c1 ZINC000184444520 337197291 /nfs/dbraw/zinc/19/72/91/337197291.db2.gz OGSGRMGYNDPASA-UHFFFAOYSA-N 1 2 300.402 4.106 20 0 DIADLO FC(F)(F)C[C@@H]([NH2+]Cc1nc2ccccc2[nH]1)c1ccccc1 ZINC000321092649 337197341 /nfs/dbraw/zinc/19/73/41/337197341.db2.gz KKMKJMHFBQVUQM-OAHLLOKOSA-N 1 2 319.330 4.346 20 0 DIADLO Cc1ccc(SC[C@@H](C)NC(=O)Nc2cc[nH+]cc2C)cc1 ZINC000184581563 337198650 /nfs/dbraw/zinc/19/86/50/337198650.db2.gz RIGDEGPTWQKMHT-CQSZACIVSA-N 1 2 315.442 4.001 20 0 DIADLO Cc1ccc(CNc2ccn(-c3ccccc3Cl)n2)c(C)[nH+]1 ZINC000184491089 337199044 /nfs/dbraw/zinc/19/90/44/337199044.db2.gz KUJKRKBFAIMYMJ-UHFFFAOYSA-N 1 2 312.804 4.150 20 0 DIADLO CSc1cccc(N(C)Cc2ccc(N3CCCC3)[nH+]c2)c1 ZINC000184750257 337199269 /nfs/dbraw/zinc/19/92/69/337199269.db2.gz ZQGIMGYIRCYMPD-UHFFFAOYSA-N 1 2 313.470 4.040 20 0 DIADLO Cc1ccc(CSCc2nc(CCC(C)C)no2)c(C)[nH+]1 ZINC000184819867 337200457 /nfs/dbraw/zinc/20/04/57/337200457.db2.gz RTEQCLYYIOKPIV-UHFFFAOYSA-N 1 2 305.447 4.103 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1N(C)C)c1ncc(-c2ccccc2)o1 ZINC000184857807 337200639 /nfs/dbraw/zinc/20/06/39/337200639.db2.gz XXXSNOHZVAPWSH-OAHLLOKOSA-N 1 2 321.424 4.258 20 0 DIADLO Cc1ccc(CS(=O)(=O)[C@@H](C)c2cccc(Cl)c2)c(C)[nH+]1 ZINC000185197916 337202649 /nfs/dbraw/zinc/20/26/49/337202649.db2.gz PCIOQSDIIAPDNU-ZDUSSCGKSA-N 1 2 323.845 4.028 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(Cl)c2F)[C@H]1c1ccncc1 ZINC000583159574 337247946 /nfs/dbraw/zinc/24/79/46/337247946.db2.gz GEGNJAGWVSQWCQ-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(Cl)c2F)[C@H]1c1ccncc1 ZINC000583159574 337247947 /nfs/dbraw/zinc/24/79/47/337247947.db2.gz GEGNJAGWVSQWCQ-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc(-c3ccccc3Cl)cs2)C[C@H](C)O1 ZINC000186459141 337256330 /nfs/dbraw/zinc/25/63/30/337256330.db2.gz OMCLQMGJSRHYOZ-TXEJJXNPSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc(-c3ccccc3Cl)cs2)C[C@H](C)O1 ZINC000186459141 337256331 /nfs/dbraw/zinc/25/63/31/337256331.db2.gz OMCLQMGJSRHYOZ-TXEJJXNPSA-N 1 2 322.861 4.073 20 0 DIADLO CCc1cc(NCCCCCSC)nc(-c2ccncc2)[nH+]1 ZINC000186364470 337256808 /nfs/dbraw/zinc/25/68/08/337256808.db2.gz UBKKKFVXZYYORC-UHFFFAOYSA-N 1 2 316.474 4.046 20 0 DIADLO Cc1ccc(CSc2nnc(-c3cccs3)o2)c(C)[nH+]1 ZINC000186399780 337257072 /nfs/dbraw/zinc/25/70/72/337257072.db2.gz IUNHHHABFDAEPO-UHFFFAOYSA-N 1 2 303.412 4.102 20 0 DIADLO Clc1ccccc1CC[N@@H+]1CCSC[C@@H]1c1nccs1 ZINC000187050260 337261339 /nfs/dbraw/zinc/26/13/39/337261339.db2.gz XBNDOIGKOKPREN-CQSZACIVSA-N 1 2 324.902 4.129 20 0 DIADLO Clc1ccccc1CC[N@H+]1CCSC[C@@H]1c1nccs1 ZINC000187050260 337261340 /nfs/dbraw/zinc/26/13/40/337261340.db2.gz XBNDOIGKOKPREN-CQSZACIVSA-N 1 2 324.902 4.129 20 0 DIADLO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1ncc(C(C)C)s1 ZINC000188875931 337275923 /nfs/dbraw/zinc/27/59/23/337275923.db2.gz KEQFYFQOORRURY-CQSZACIVSA-N 1 2 302.443 4.188 20 0 DIADLO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1csc(C(C)(C)C)n1 ZINC000188878829 337275993 /nfs/dbraw/zinc/27/59/93/337275993.db2.gz GTGJVSHWHFXSJK-OAHLLOKOSA-N 1 2 316.470 4.362 20 0 DIADLO Cc1ccc2cc(C[NH2+][C@H](C)c3nc(C(C)(C)C)no3)ccc2n1 ZINC000189367517 337278971 /nfs/dbraw/zinc/27/89/71/337278971.db2.gz PMUXTGIDUMKUAX-CYBMUJFWSA-N 1 2 324.428 4.075 20 0 DIADLO CCOc1ccccc1C[N@@H+]1CCC[C@H]1c1csc(C)n1 ZINC000189765745 337282583 /nfs/dbraw/zinc/28/25/83/337282583.db2.gz FZJMMVMZYIFGCU-INIZCTEOSA-N 1 2 302.443 4.187 20 0 DIADLO CCOc1ccccc1C[N@H+]1CCC[C@H]1c1csc(C)n1 ZINC000189765745 337282584 /nfs/dbraw/zinc/28/25/84/337282584.db2.gz FZJMMVMZYIFGCU-INIZCTEOSA-N 1 2 302.443 4.187 20 0 DIADLO CCN(C)c1ccc(CNc2ccc(C)c3ncccc23)c[nH+]1 ZINC000191379205 337296419 /nfs/dbraw/zinc/29/64/19/337296419.db2.gz UNPDLPBAMXNOHY-UHFFFAOYSA-N 1 2 306.413 4.006 20 0 DIADLO CO[C@@H](C)c1cccc(NCc2ccc(N(C)C(C)C)[nH+]c2)c1 ZINC000191423950 337296814 /nfs/dbraw/zinc/29/68/14/337296814.db2.gz DKMVJPKUKARJSO-HNNXBMFYSA-N 1 2 313.445 4.246 20 0 DIADLO Cc1csc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)n1 ZINC000191781149 337300092 /nfs/dbraw/zinc/30/00/92/337300092.db2.gz FQPGQHXZCDOECG-UHFFFAOYSA-N 1 2 314.376 4.406 20 0 DIADLO Cc1csc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)n1 ZINC000191781149 337300093 /nfs/dbraw/zinc/30/00/93/337300093.db2.gz FQPGQHXZCDOECG-UHFFFAOYSA-N 1 2 314.376 4.406 20 0 DIADLO CCCCc1oc2ccccc2c1C[N@H+](C)Cc1ncccn1 ZINC000191875768 337300776 /nfs/dbraw/zinc/30/07/76/337300776.db2.gz FMFCVPWSYGADRG-UHFFFAOYSA-N 1 2 309.413 4.197 20 0 DIADLO CCCCc1oc2ccccc2c1C[N@@H+](C)Cc1ncccn1 ZINC000191875768 337300777 /nfs/dbraw/zinc/30/07/77/337300777.db2.gz FMFCVPWSYGADRG-UHFFFAOYSA-N 1 2 309.413 4.197 20 0 DIADLO CC(C)c1cccc2c1CC[N@@H+]([C@H](C)c1nc(C3CC3)no1)C2 ZINC000191890775 337300927 /nfs/dbraw/zinc/30/09/27/337300927.db2.gz UUGBQGWKWWUPNE-CYBMUJFWSA-N 1 2 311.429 4.190 20 0 DIADLO CC(C)c1cccc2c1CC[N@H+]([C@H](C)c1nc(C3CC3)no1)C2 ZINC000191890775 337300928 /nfs/dbraw/zinc/30/09/28/337300928.db2.gz UUGBQGWKWWUPNE-CYBMUJFWSA-N 1 2 311.429 4.190 20 0 DIADLO CCC(CC)n1ccc(C[NH+]2CCC(CC(F)(F)F)CC2)n1 ZINC000583278181 337301858 /nfs/dbraw/zinc/30/18/58/337301858.db2.gz HNBWLZMWDGJWKW-UHFFFAOYSA-N 1 2 317.399 4.409 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000532917461 337302742 /nfs/dbraw/zinc/30/27/42/337302742.db2.gz IWVJKFYDIJTOCM-YPMHNXCESA-N 1 2 305.447 4.327 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@H]1c1ccsc1 ZINC000532917461 337302743 /nfs/dbraw/zinc/30/27/43/337302743.db2.gz IWVJKFYDIJTOCM-YPMHNXCESA-N 1 2 305.447 4.327 20 0 DIADLO CCC[C@H]([NH2+]Cc1ncccn1)c1cccc(C(F)(F)F)c1 ZINC000192155483 337303453 /nfs/dbraw/zinc/30/34/53/337303453.db2.gz HAJIMLYEYJWSHN-AWEZNQCLSA-N 1 2 309.335 4.126 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccn1)c1ccc(Oc2ccccc2)cc1 ZINC000192155455 337303488 /nfs/dbraw/zinc/30/34/88/337303488.db2.gz MNTUTOOOYYFODB-OAHLLOKOSA-N 1 2 305.381 4.120 20 0 DIADLO Oc1cccc2c1CCC[C@@H]2[NH2+]Cc1ncc(-c2ccccc2)o1 ZINC000192346548 337304711 /nfs/dbraw/zinc/30/47/11/337304711.db2.gz CTMVNYXXDDWRNV-KRWDZBQOSA-N 1 2 320.392 4.214 20 0 DIADLO Cc1cc(C)cc(NC(=O)C[N@@H+](C)[C@H](C)c2ccccc2F)c1 ZINC000532919524 337305617 /nfs/dbraw/zinc/30/56/17/337305617.db2.gz IHGLGQJDDMGJKN-OAHLLOKOSA-N 1 2 314.404 4.074 20 0 DIADLO Cc1cc(C)cc(NC(=O)C[N@H+](C)[C@H](C)c2ccccc2F)c1 ZINC000532919524 337305618 /nfs/dbraw/zinc/30/56/18/337305618.db2.gz IHGLGQJDDMGJKN-OAHLLOKOSA-N 1 2 314.404 4.074 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc2ccccc2s1)C(=O)OC(C)(C)C ZINC000525952556 337308984 /nfs/dbraw/zinc/30/89/84/337308984.db2.gz RWPCCBRQXSTBHX-NWDGAFQWSA-N 1 2 305.443 4.282 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)n1 ZINC000193215044 337309382 /nfs/dbraw/zinc/30/93/82/337309382.db2.gz SPSQAQPCGMYLPM-SNVBAGLBSA-N 1 2 313.323 4.063 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CCCC2)no1)c1cccc(C2CC2)c1 ZINC000583303890 337312324 /nfs/dbraw/zinc/31/23/24/337312324.db2.gz QDKIMUZBVPKGDG-CYBMUJFWSA-N 1 2 311.429 4.455 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CCCC2)no1)c1cccc(C2CC2)c1 ZINC000583303891 337312375 /nfs/dbraw/zinc/31/23/75/337312375.db2.gz QDKIMUZBVPKGDG-ZDUSSCGKSA-N 1 2 311.429 4.455 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)[C@H]1CCC(C)=C(C)C1 ZINC000583755503 337330081 /nfs/dbraw/zinc/33/00/81/337330081.db2.gz SEPGAEOTZGRJEJ-IRXDYDNUSA-N 1 2 315.461 4.093 20 0 DIADLO Cc1ccc(NC(=O)NC[C@H](c2ccccc2)C2CC2)c(C)[nH+]1 ZINC000583789926 337333460 /nfs/dbraw/zinc/33/34/60/337333460.db2.gz CFFKPSPGHCUKRH-QGZVFWFLSA-N 1 2 309.413 4.014 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2ccc(C3CCC3)cc2)c[nH+]1 ZINC000583795831 337334197 /nfs/dbraw/zinc/33/41/97/337334197.db2.gz XXTSEYVDHLFPFF-UHFFFAOYSA-N 1 2 309.413 4.288 20 0 DIADLO C[C@H](C(=O)Nc1cccc(Cl)c1Cl)[NH+]1CCC(C)CC1 ZINC000021848148 337338605 /nfs/dbraw/zinc/33/86/05/337338605.db2.gz MRXIBZADUPQPSG-LLVKDONJSA-N 1 2 315.244 4.052 20 0 DIADLO Cc1cccn2c(CN3CC[C@@H]3c3ccc(Cl)cc3)c[nH+]c12 ZINC000583887988 337384227 /nfs/dbraw/zinc/38/42/27/337384227.db2.gz NCEIJEJKOUICKD-QGZVFWFLSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1cccn2c(C[N@@H+]3CC[C@@H]3c3ccc(Cl)cc3)cnc12 ZINC000583887988 337384228 /nfs/dbraw/zinc/38/42/28/337384228.db2.gz NCEIJEJKOUICKD-QGZVFWFLSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1cccn2c(C[N@H+]3CC[C@@H]3c3ccc(Cl)cc3)cnc12 ZINC000583887988 337384229 /nfs/dbraw/zinc/38/42/29/337384229.db2.gz NCEIJEJKOUICKD-QGZVFWFLSA-N 1 2 311.816 4.243 20 0 DIADLO CC(C)c1nc2n(n1)CCC[C@H]2[NH2+][C@@H](C)c1ccccc1Cl ZINC000126128535 337415513 /nfs/dbraw/zinc/41/55/13/337415513.db2.gz VMZCUZPFPRCFFY-SWLSCSKDSA-N 1 2 318.852 4.241 20 0 DIADLO Cc1nc(-c2cc([C@H](C)[NH2+]Cc3cscn3)cs2)cs1 ZINC000127340619 337420291 /nfs/dbraw/zinc/42/02/91/337420291.db2.gz YOQQPMIAJPQKOL-VIFPVBQESA-N 1 2 321.496 4.487 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)[C@H]1CCCc2sccc21 ZINC000128629553 337426173 /nfs/dbraw/zinc/42/61/73/337426173.db2.gz QWGIZZNQBJXNCX-HNNXBMFYSA-N 1 2 323.421 4.197 20 0 DIADLO Brc1ccc([C@@H]2CCCN2c2cccc[nH+]2)cc1 ZINC000152499346 337449926 /nfs/dbraw/zinc/44/99/26/337449926.db2.gz MNWBHPAYFAPGIF-AWEZNQCLSA-N 1 2 303.203 4.186 20 0 DIADLO COc1ccc(C[NH2+]C2(C(F)F)CCCCC2)c(C)c1OC ZINC000564123725 337471087 /nfs/dbraw/zinc/47/10/87/337471087.db2.gz SCUJBXFYGNPBHL-UHFFFAOYSA-N 1 2 313.388 4.070 20 0 DIADLO Cc1cc(=O)c2sccc2n1Cc1ccc(C(C)C)[nH+]c1C ZINC000418957248 337473210 /nfs/dbraw/zinc/47/32/10/337473210.db2.gz UFJBBXZZZWZCSD-UHFFFAOYSA-N 1 2 312.438 4.247 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2cccc(C(C)=O)c2)c1C ZINC000419453314 337485139 /nfs/dbraw/zinc/48/51/39/337485139.db2.gz JHHBCKQERPBURN-UHFFFAOYSA-N 1 2 315.438 4.343 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2cccc(C(C)=O)c2)c1 ZINC000419454802 337485153 /nfs/dbraw/zinc/48/51/53/337485153.db2.gz MZCFCDGNBHLYIB-UHFFFAOYSA-N 1 2 301.411 4.035 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](CC(F)F)c1ccccc1 ZINC000421107489 337521747 /nfs/dbraw/zinc/52/17/47/337521747.db2.gz ITTZEWNEFDTAOK-AWEZNQCLSA-N 1 2 319.355 4.216 20 0 DIADLO C[C@H]1C[C@H](CC[S@@](=O)Cc2cn3ccccc3[nH+]2)C[C@@H](C)C1 ZINC000246235957 337523841 /nfs/dbraw/zinc/52/38/41/337523841.db2.gz NKKIEWNQFSIPQC-TWJGEFDFSA-N 1 2 318.486 4.045 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000067922577 337544074 /nfs/dbraw/zinc/54/40/74/337544074.db2.gz DQFDGTDTWXOALS-INIZCTEOSA-N 1 2 305.466 4.043 20 0 DIADLO C[C@@H](Cc1noc([C@@H](c2ccccc2)[NH+](C)C)n1)c1ccccc1 ZINC000571840270 337578690 /nfs/dbraw/zinc/57/86/90/337578690.db2.gz RNLUOIKBELQROT-HNAYVOBHSA-N 1 2 321.424 4.067 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccccc1Br)c1nccs1 ZINC000078004157 337588621 /nfs/dbraw/zinc/58/86/21/337588621.db2.gz HVQUUMHEZAUTBU-GFCCVEGCSA-N 1 2 311.248 4.147 20 0 DIADLO CC(C)COC[C@@H]([NH2+]Cc1cc(F)cc(F)c1)c1ccco1 ZINC000161610122 337593953 /nfs/dbraw/zinc/59/39/53/337593953.db2.gz IBOANBYEOGXJOX-MRXNPFEDSA-N 1 2 309.356 4.061 20 0 DIADLO CCc1cnc(C[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)o1 ZINC000572200604 337596575 /nfs/dbraw/zinc/59/65/75/337596575.db2.gz CVDWRLGQDROIOK-UHFFFAOYSA-N 1 2 311.212 4.323 20 0 DIADLO C(=C\c1ccc(-n2cc[nH+]c2)cc1)\c1nc(-c2ccsc2)no1 ZINC000255437199 337602121 /nfs/dbraw/zinc/60/21/21/337602121.db2.gz NNWTUCVMIJGIHJ-UTCJRWHESA-N 1 2 320.377 4.154 20 0 DIADLO Cc1sc(C[NH2+][C@H](C)c2ccncc2Cl)nc1C(C)C ZINC000421828636 337647008 /nfs/dbraw/zinc/64/70/08/337647008.db2.gz DQIDQACIXYYOIH-SNVBAGLBSA-N 1 2 309.866 4.474 20 0 DIADLO COc1cc(N[C@@H]2CCc3ccc[nH+]c3CC2)ccc1Cl ZINC000421855753 337650552 /nfs/dbraw/zinc/65/05/52/337650552.db2.gz NTIIHZFYLCMVHD-CYBMUJFWSA-N 1 2 302.805 4.103 20 0 DIADLO Cc1csc(C2([NH2+][C@H](C)c3ccncc3Cl)CCC2)n1 ZINC000421837516 337652633 /nfs/dbraw/zinc/65/26/33/337652633.db2.gz RGACEWPCMCFLMQ-LLVKDONJSA-N 1 2 307.850 4.230 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccncc1Cl ZINC000421846419 337654373 /nfs/dbraw/zinc/65/43/73/337654373.db2.gz SIUVCJKOFLAKNZ-YMTOWFKASA-N 1 2 309.196 4.173 20 0 DIADLO Cc1cc(N2CCC[C@@H]2[C@H]2CCCOC2)c2cccc(F)c2[nH+]1 ZINC000580427051 337673441 /nfs/dbraw/zinc/67/34/41/337673441.db2.gz YDYWVQNLCZUQNC-WMLDXEAASA-N 1 2 314.404 4.078 20 0 DIADLO Cc1cccnc1[C@H]1CCC[C@H]([NH2+]c2ccc3c(c2)CCN3)C1 ZINC000423209868 337704225 /nfs/dbraw/zinc/70/42/25/337704225.db2.gz FNHQQIXYNWIJRX-IRXDYDNUSA-N 1 2 307.441 4.496 20 0 DIADLO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccn(-c2ccccc2)n1 ZINC000536859879 337746508 /nfs/dbraw/zinc/74/65/08/337746508.db2.gz VWFFOPGJLLJRAS-INIZCTEOSA-N 1 2 321.424 4.040 20 0 DIADLO C[C@@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1cc2ccccc2o1 ZINC000536870862 337751487 /nfs/dbraw/zinc/75/14/87/337751487.db2.gz QOBZBKZUIBLUJG-IAQYHMDHSA-N 1 2 317.335 4.095 20 0 DIADLO CC(C)CC(=O)Nc1ccc(NCc2c[nH+]cn2C(C)C)cc1 ZINC000424143802 337767468 /nfs/dbraw/zinc/76/74/68/337767468.db2.gz GFXKBAVYDLCMSW-UHFFFAOYSA-N 1 2 314.433 4.061 20 0 DIADLO CC[C@H](C)c1ccc([C@H](C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000527905950 337770253 /nfs/dbraw/zinc/77/02/53/337770253.db2.gz SYPCBEUDZSLBON-STQMWFEESA-N 1 2 305.853 4.438 20 0 DIADLO COCCC1CC[NH+]([C@@H](CCc2ccccc2)C(F)F)CC1 ZINC000527935618 337776997 /nfs/dbraw/zinc/77/69/97/337776997.db2.gz MNUUKDOTWYLKMP-KRWDZBQOSA-N 1 2 311.416 4.001 20 0 DIADLO COc1cc(Cl)ccc1[C@H](C)[NH2+][C@@H](C)c1ncccc1F ZINC000528037953 337782733 /nfs/dbraw/zinc/78/27/33/337782733.db2.gz NCZUJHVBPFDXSM-QWRGUYRKSA-N 1 2 308.784 4.295 20 0 DIADLO CC(C)c1cc(NCc2c[nH+]cn2C(C)C)n(-c2ccccc2)n1 ZINC000424181076 337800413 /nfs/dbraw/zinc/80/04/13/337800413.db2.gz QRPHQXAPLONGDU-UHFFFAOYSA-N 1 2 323.444 4.385 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H]2COc3ccc(F)cc32)c(Cl)c1 ZINC000424286455 337815425 /nfs/dbraw/zinc/81/54/25/337815425.db2.gz WCDRGTHXWXOZIN-MGPLVRAMSA-N 1 2 321.779 4.272 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2ccc(OC)cc2Cl)cs1 ZINC000424291509 337816312 /nfs/dbraw/zinc/81/63/12/337816312.db2.gz BRADSCUVAZDSJP-JTQLQIEISA-N 1 2 310.850 4.218 20 0 DIADLO Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2cc[nH+]cc2C)c1 ZINC000107292683 337828371 /nfs/dbraw/zinc/82/83/71/337828371.db2.gz JIMOQHVBPXMGNA-OAHLLOKOSA-N 1 2 312.413 4.228 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1 ZINC000107293418 337828424 /nfs/dbraw/zinc/82/84/24/337828424.db2.gz GDFDWHYSMXZXCZ-CQSZACIVSA-N 1 2 312.413 4.094 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)COc1ccccc1-c1ccccc1 ZINC000107289641 337828486 /nfs/dbraw/zinc/82/84/86/337828486.db2.gz HQBBNQHZWYCDJS-UHFFFAOYSA-N 1 2 318.376 4.075 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)CSc2ccccc2)c(C)[nH+]1 ZINC000119087595 337854309 /nfs/dbraw/zinc/85/43/09/337854309.db2.gz MGLFOZCHZXRDHZ-LBPRGKRZSA-N 1 2 300.427 4.065 20 0 DIADLO Cc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)c(C)[nH+]1 ZINC000119157431 337854761 /nfs/dbraw/zinc/85/47/61/337854761.db2.gz UDNORRDTOTWDFT-UHFFFAOYSA-N 1 2 316.404 4.469 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccccc2C)[C@@H]2CCC[C@@H](C)C2)no1 ZINC000537059507 337883925 /nfs/dbraw/zinc/88/39/25/337883925.db2.gz LERJMVIKNGCGOM-NRXGSXMXSA-N 1 2 313.445 4.344 20 0 DIADLO Cc1ccc(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)c(C)n1 ZINC000121513423 337894529 /nfs/dbraw/zinc/89/45/29/337894529.db2.gz SXIRQGPWPCJRST-UHFFFAOYSA-N 1 2 319.364 4.138 20 0 DIADLO CC(C)C[C@H](C)Oc1cc(C[NH2+][C@H](C)c2nccs2)ccn1 ZINC000091723136 337894857 /nfs/dbraw/zinc/89/48/57/337894857.db2.gz KAHPEEAPFOXLGD-UONOGXRCSA-N 1 2 319.474 4.202 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nccs2)c(OCC2CC2)c1 ZINC000091735213 337894971 /nfs/dbraw/zinc/89/49/71/337894971.db2.gz ZRWDMETXQQJSGJ-ZDUSSCGKSA-N 1 2 302.443 4.091 20 0 DIADLO COc1cc(CNc2cccc[nH+]2)c(-c2ccccc2)cc1OC ZINC000121576998 337895711 /nfs/dbraw/zinc/89/57/11/337895711.db2.gz AIBZUYMVQZQXOO-UHFFFAOYSA-N 1 2 320.392 4.378 20 0 DIADLO Cc1nc([C@H]([NH2+]C[C@H]2CC=CCC2)c2ccc(Cl)cc2)no1 ZINC000092441402 337904357 /nfs/dbraw/zinc/90/43/57/337904357.db2.gz IJFODXIQWWKVEH-XJKSGUPXSA-N 1 2 317.820 4.067 20 0 DIADLO C[C@H]([NH2+]Cc1csc(CCc2ccccc2)n1)c1cccnc1 ZINC000092766992 337908080 /nfs/dbraw/zinc/90/80/80/337908080.db2.gz NRLYNGRNWWTBQB-HNNXBMFYSA-N 1 2 323.465 4.174 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@H](C)[C@H](C)OC)c1 ZINC000537537398 337941465 /nfs/dbraw/zinc/94/14/65/337941465.db2.gz ROUJPWFNPCOYCL-CABCVRRESA-N 1 2 301.434 4.186 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)[C@@H]1CCC[C@H](F)C1 ZINC000424658628 337944216 /nfs/dbraw/zinc/94/42/16/337944216.db2.gz FCWWMBGLVFSCIF-KGLIPLIRSA-N 1 2 314.360 4.341 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)[C@]2(C)C[C@H]2F)c1 ZINC000424742751 337958111 /nfs/dbraw/zinc/95/81/11/337958111.db2.gz UYVVXYZGQQBUAP-CRAIPNDOSA-N 1 2 315.392 4.037 20 0 DIADLO COc1ccc([C@H](Cc2ccccc2)Nc2cc(C)[nH+]cn2)cc1 ZINC000514763537 337970432 /nfs/dbraw/zinc/97/04/32/337970432.db2.gz LNRWLJNYRYPDCR-IBGZPJMESA-N 1 2 319.408 4.190 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@H](C)c2ccc(Cl)s2)n1 ZINC000515623281 337994062 /nfs/dbraw/zinc/99/40/62/337994062.db2.gz CGDKOIWGUCRMQD-SECBINFHSA-N 1 2 319.817 4.231 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@@H]2CCC[C@@H]2c2ccccc2)n1 ZINC000516169331 338007036 /nfs/dbraw/zinc/00/70/36/338007036.db2.gz OWZJTXIQEBUVFO-QZTJIDSGSA-N 1 2 319.408 4.415 20 0 DIADLO Cc1ccc([C@H](C)c2noc([C@H](c3ccccc3)[NH+](C)C)n2)cc1 ZINC000516345964 338010342 /nfs/dbraw/zinc/01/03/42/338010342.db2.gz ZUXJRIOZZIQZEU-YJBOKZPZSA-N 1 2 321.424 4.181 20 0 DIADLO Cc1ccc(NC(=O)N2CCc3sc(Cl)cc3C2)c(C)[nH+]1 ZINC000516463836 338012924 /nfs/dbraw/zinc/01/29/24/338012924.db2.gz WERNXCRELOGWQU-UHFFFAOYSA-N 1 2 321.833 4.004 20 0 DIADLO Cc1ccc(NC(=O)NCc2cccc(-c3[nH]cc[nH+]3)c2)cc1C ZINC000426086426 338020356 /nfs/dbraw/zinc/02/03/56/338020356.db2.gz SJIWOIFDFPRRPN-UHFFFAOYSA-N 1 2 320.396 4.015 20 0 DIADLO CC1(C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)CCC1 ZINC000426151491 338021380 /nfs/dbraw/zinc/02/13/80/338021380.db2.gz WPYDNPCHYOSNJY-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2ccccc2)cc1F)c1cnccn1 ZINC000426300477 338025583 /nfs/dbraw/zinc/02/55/83/338025583.db2.gz GGTNISVMRZYWDR-AWEZNQCLSA-N 1 2 307.372 4.134 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2)cc1F)c1cnccn1 ZINC000426300478 338025647 /nfs/dbraw/zinc/02/56/47/338025647.db2.gz GGTNISVMRZYWDR-CQSZACIVSA-N 1 2 307.372 4.134 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2ccccc2)cc1F)c1nccn1C ZINC000426305293 338025924 /nfs/dbraw/zinc/02/59/24/338025924.db2.gz WCXAQFYVQVXTKH-AWEZNQCLSA-N 1 2 309.388 4.077 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cccc(-c3cccnc3)c2)CC1(F)F ZINC000426377326 338029583 /nfs/dbraw/zinc/02/95/83/338029583.db2.gz MNZJCYTYRJKPDG-AWEZNQCLSA-N 1 2 302.368 4.226 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cccc(-c3cccnc3)c2)CC1(F)F ZINC000426377326 338029584 /nfs/dbraw/zinc/02/95/84/338029584.db2.gz MNZJCYTYRJKPDG-AWEZNQCLSA-N 1 2 302.368 4.226 20 0 DIADLO Cc1nc2ccc(C[N@@H+]3CCOC[C@H]3c3ccccc3)cc2s1 ZINC000426403345 338030843 /nfs/dbraw/zinc/03/08/43/338030843.db2.gz VVTKGEIHBKMQOA-SFHVURJKSA-N 1 2 324.449 4.178 20 0 DIADLO Cc1nc2ccc(C[N@H+]3CCOC[C@H]3c3ccccc3)cc2s1 ZINC000426403345 338030844 /nfs/dbraw/zinc/03/08/44/338030844.db2.gz VVTKGEIHBKMQOA-SFHVURJKSA-N 1 2 324.449 4.178 20 0 DIADLO CCCc1csc(C[N@@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)n1 ZINC000426415101 338031371 /nfs/dbraw/zinc/03/13/71/338031371.db2.gz CUDUGEBHRWJDHE-YOEHRIQHSA-N 1 2 316.470 4.058 20 0 DIADLO CCCc1csc(C[N@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)n1 ZINC000426415101 338031372 /nfs/dbraw/zinc/03/13/72/338031372.db2.gz CUDUGEBHRWJDHE-YOEHRIQHSA-N 1 2 316.470 4.058 20 0 DIADLO CCCc1csc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)n1 ZINC000426417584 338031497 /nfs/dbraw/zinc/03/14/97/338031497.db2.gz BORZCBLAPHOMBK-PBHICJAKSA-N 1 2 316.470 4.058 20 0 DIADLO CCCc1csc(C[N@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)n1 ZINC000426417584 338031498 /nfs/dbraw/zinc/03/14/98/338031498.db2.gz BORZCBLAPHOMBK-PBHICJAKSA-N 1 2 316.470 4.058 20 0 DIADLO CCCc1csc(C[N@H+](C)[C@@H](C)c2sc(C)nc2C)n1 ZINC000426421604 338031793 /nfs/dbraw/zinc/03/17/93/338031793.db2.gz SNNKDKUZMVNOND-NSHDSACASA-N 1 2 309.504 4.362 20 0 DIADLO CCCc1csc(C[N@@H+](C)[C@@H](C)c2sc(C)nc2C)n1 ZINC000426421604 338031794 /nfs/dbraw/zinc/03/17/94/338031794.db2.gz SNNKDKUZMVNOND-NSHDSACASA-N 1 2 309.504 4.362 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2oc(C(C)C)nc2C)C2CC2)n1 ZINC000428317033 338046991 /nfs/dbraw/zinc/04/69/91/338046991.db2.gz BKKVFBRKKPJJGE-CQSZACIVSA-N 1 2 305.447 4.112 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1oc(C(C)C)nc1C ZINC000428328681 338047547 /nfs/dbraw/zinc/04/75/47/338047547.db2.gz IWXKOVSDYXAEIS-LLVKDONJSA-N 1 2 306.381 4.105 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1oc(C(C)C)nc1C ZINC000428328682 338047549 /nfs/dbraw/zinc/04/75/49/338047549.db2.gz IWXKOVSDYXAEIS-NSHDSACASA-N 1 2 306.381 4.105 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000428363815 338048767 /nfs/dbraw/zinc/04/87/67/338048767.db2.gz MDLMOWFYCNTYOD-LRDDRELGSA-N 1 2 320.458 4.130 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000428363815 338048768 /nfs/dbraw/zinc/04/87/68/338048768.db2.gz MDLMOWFYCNTYOD-LRDDRELGSA-N 1 2 320.458 4.130 20 0 DIADLO CCc1ccc(C[NH2+]Cc2nc(-c3ccccc3F)cs2)o1 ZINC000428474465 338054512 /nfs/dbraw/zinc/05/45/12/338054512.db2.gz SECWZTVSLGDBCQ-UHFFFAOYSA-N 1 2 316.401 4.394 20 0 DIADLO CCCc1nc(C)c(C[N@H+](C)[C@@H](C)c2c(F)cccc2F)o1 ZINC000428486901 338054811 /nfs/dbraw/zinc/05/48/11/338054811.db2.gz PIMLBAANAUUEJO-LBPRGKRZSA-N 1 2 308.372 4.407 20 0 DIADLO CCCc1nc(C)c(C[N@@H+](C)[C@@H](C)c2c(F)cccc2F)o1 ZINC000428486901 338054812 /nfs/dbraw/zinc/05/48/12/338054812.db2.gz PIMLBAANAUUEJO-LBPRGKRZSA-N 1 2 308.372 4.407 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)CC(C)(F)F)c1 ZINC000428505081 338055094 /nfs/dbraw/zinc/05/50/94/338055094.db2.gz YNERCDVEKKUGAD-UHFFFAOYSA-N 1 2 321.371 4.334 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@H]3CCC[C@@H]32)cc1Oc1cc[nH+]cc1 ZINC000428538838 338055773 /nfs/dbraw/zinc/05/57/73/338055773.db2.gz YGWRILYFERKLSP-QAPCUYQASA-N 1 2 322.408 4.197 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@H]3CCC[C@H]32)cc1Oc1cc[nH+]cc1 ZINC000428538836 338055809 /nfs/dbraw/zinc/05/58/09/338055809.db2.gz YGWRILYFERKLSP-CRAIPNDOSA-N 1 2 322.408 4.197 20 0 DIADLO Cc1cccc(C[N@@H+](C)[C@@H](C)c2nc(C(C)(C)C)no2)c1C ZINC000428713330 338059258 /nfs/dbraw/zinc/05/92/58/338059258.db2.gz VPZGTVFVACQEPP-AWEZNQCLSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1cccc(C[N@H+](C)[C@@H](C)c2nc(C(C)(C)C)no2)c1C ZINC000428713330 338059259 /nfs/dbraw/zinc/05/92/59/338059259.db2.gz VPZGTVFVACQEPP-AWEZNQCLSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1nc([C@@H](C)[NH+]2CCC(Cc3ccc(C)c(C)c3)CC2)no1 ZINC000428718462 338059327 /nfs/dbraw/zinc/05/93/27/338059327.db2.gz HTRAKJOYALDPSM-OAHLLOKOSA-N 1 2 313.445 4.011 20 0 DIADLO Cn1ccc(C[NH+]2CCC(c3ccc(Cl)cc3Cl)CC2)n1 ZINC000428726417 338059736 /nfs/dbraw/zinc/05/97/36/338059736.db2.gz VGGSSCUXTVBFFJ-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO CCCCc1nc(C[N@H+](C(C)C)[C@H](C)c2ccccc2)no1 ZINC000428841090 338061894 /nfs/dbraw/zinc/06/18/94/338061894.db2.gz PAFJDBMIKMCCGF-OAHLLOKOSA-N 1 2 301.434 4.384 20 0 DIADLO CCCCc1nc(C[N@@H+](C(C)C)[C@H](C)c2ccccc2)no1 ZINC000428841090 338061895 /nfs/dbraw/zinc/06/18/95/338061895.db2.gz PAFJDBMIKMCCGF-OAHLLOKOSA-N 1 2 301.434 4.384 20 0 DIADLO CC(C)[N@H+](Cc1ncn(-c2ccccc2)n1)[C@@H](C)c1ccccc1 ZINC000428857762 338062648 /nfs/dbraw/zinc/06/26/48/338062648.db2.gz APQZYHJEBAGCMA-KRWDZBQOSA-N 1 2 320.440 4.239 20 0 DIADLO CC(C)[N@@H+](Cc1ncn(-c2ccccc2)n1)[C@@H](C)c1ccccc1 ZINC000428857762 338062649 /nfs/dbraw/zinc/06/26/49/338062649.db2.gz APQZYHJEBAGCMA-KRWDZBQOSA-N 1 2 320.440 4.239 20 0 DIADLO CSc1ccc(NCc2ccc(C(F)(F)F)s2)[nH+]c1 ZINC000428860853 338062818 /nfs/dbraw/zinc/06/28/18/338062818.db2.gz IKHZKGIUDCRYNP-UHFFFAOYSA-N 1 2 304.362 4.496 20 0 DIADLO CC(C)c1csc(C[NH2+]Cc2nc3ccc(F)cc3s2)n1 ZINC000428880780 338064343 /nfs/dbraw/zinc/06/43/43/338064343.db2.gz KYDLAWVOKRFEPG-UHFFFAOYSA-N 1 2 321.446 4.305 20 0 DIADLO Cc1ccc(OC(F)F)c(C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)c1 ZINC000428943594 338065878 /nfs/dbraw/zinc/06/58/78/338065878.db2.gz PSXKWJFKAGVDJU-OAHLLOKOSA-N 1 2 321.371 4.047 20 0 DIADLO Cc1ccc(OC(F)F)c(C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)c1 ZINC000428943594 338065879 /nfs/dbraw/zinc/06/58/79/338065879.db2.gz PSXKWJFKAGVDJU-OAHLLOKOSA-N 1 2 321.371 4.047 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc3ccccc3s2)Cc2ccccc2O1 ZINC000429170433 338072519 /nfs/dbraw/zinc/07/25/19/338072519.db2.gz KMEGIVRKZFRMHE-CYBMUJFWSA-N 1 2 310.422 4.079 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc3ccccc3s2)Cc2ccccc2O1 ZINC000429170433 338072520 /nfs/dbraw/zinc/07/25/20/338072520.db2.gz KMEGIVRKZFRMHE-CYBMUJFWSA-N 1 2 310.422 4.079 20 0 DIADLO Cc1nc(C[NH+]2CCC(c3ncccc3Cl)CC2)c(C)s1 ZINC000429216969 338073491 /nfs/dbraw/zinc/07/34/91/338073491.db2.gz VDLJWHOBVASXTP-UHFFFAOYSA-N 1 2 321.877 4.188 20 0 DIADLO Cc1ccc(C)c(C[N@H+](C)Cc2nnc(-c3ccccc3)s2)c1 ZINC000429299313 338077059 /nfs/dbraw/zinc/07/70/59/338077059.db2.gz XSYKGORZVQVBRU-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Cc1ccc(C)c(C[N@@H+](C)Cc2nnc(-c3ccccc3)s2)c1 ZINC000429299313 338077060 /nfs/dbraw/zinc/07/70/60/338077060.db2.gz XSYKGORZVQVBRU-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Cc1ccoc1C[N@@H+](C)CC(=O)Nc1c(C)cccc1C(C)C ZINC000429374887 338079084 /nfs/dbraw/zinc/07/90/84/338079084.db2.gz APTPRPOEBHGGPV-UHFFFAOYSA-N 1 2 314.429 4.090 20 0 DIADLO Cc1ccoc1C[N@H+](C)CC(=O)Nc1c(C)cccc1C(C)C ZINC000429374887 338079085 /nfs/dbraw/zinc/07/90/85/338079085.db2.gz APTPRPOEBHGGPV-UHFFFAOYSA-N 1 2 314.429 4.090 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000429404252 338079671 /nfs/dbraw/zinc/07/96/71/338079671.db2.gz LWMYOTUTPYAXFM-AWEZNQCLSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000429404252 338079672 /nfs/dbraw/zinc/07/96/72/338079672.db2.gz LWMYOTUTPYAXFM-AWEZNQCLSA-N 1 2 311.385 4.139 20 0 DIADLO CC[C@](C)([NH2+]Cc1c(Cl)cccc1OC)c1nccs1 ZINC000429682644 338087366 /nfs/dbraw/zinc/08/73/66/338087366.db2.gz ZNXZBFCSYMMWDX-HNNXBMFYSA-N 1 2 310.850 4.220 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)no1 ZINC000429689259 338087519 /nfs/dbraw/zinc/08/75/19/338087519.db2.gz FLTLTGHRFLZIMI-UHFFFAOYSA-N 1 2 314.429 4.090 20 0 DIADLO CC(C)(C)c1cc(C[N@H+](Cc2cccc(O)c2)CC2CC2)no1 ZINC000429689259 338087520 /nfs/dbraw/zinc/08/75/20/338087520.db2.gz FLTLTGHRFLZIMI-UHFFFAOYSA-N 1 2 314.429 4.090 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H](c1ncc(C)s1)C1CC1 ZINC000429697117 338087586 /nfs/dbraw/zinc/08/75/86/338087586.db2.gz JWRVFMOUTHMJHA-HNNXBMFYSA-N 1 2 322.861 4.354 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1cccc(F)c1 ZINC000429780127 338089773 /nfs/dbraw/zinc/08/97/73/338089773.db2.gz CDMAQDKVELRLBY-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO CCc1cccc(F)c1C[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000430019311 338093575 /nfs/dbraw/zinc/09/35/75/338093575.db2.gz MLDFIGLFECHUTI-UHFFFAOYSA-N 1 2 315.285 4.234 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2sccc2Cl)c(F)c1F ZINC000430032413 338093952 /nfs/dbraw/zinc/09/39/52/338093952.db2.gz CBNPVUIDFSYYEJ-UHFFFAOYSA-N 1 2 309.715 4.248 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)o1 ZINC000430032082 338093956 /nfs/dbraw/zinc/09/39/56/338093956.db2.gz FENQCDDTDCLUBF-SCZZXKLOSA-N 1 2 313.294 4.249 20 0 DIADLO Fc1ccc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)c(Cl)c1 ZINC000430036045 338094185 /nfs/dbraw/zinc/09/41/85/338094185.db2.gz CXSYOQQCUUPGKG-UHFFFAOYSA-N 1 2 321.676 4.325 20 0 DIADLO Fc1ccc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)cc1Cl ZINC000430039373 338094214 /nfs/dbraw/zinc/09/42/14/338094214.db2.gz ZLJNWBBPCKROEE-UHFFFAOYSA-N 1 2 321.676 4.325 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CC(C)(C)[C@H]2c2cccnc2)s1 ZINC000430102523 338096709 /nfs/dbraw/zinc/09/67/09/338096709.db2.gz QRZUZPRBPFAOCY-OAHLLOKOSA-N 1 2 315.486 4.419 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)s1 ZINC000430102523 338096710 /nfs/dbraw/zinc/09/67/10/338096710.db2.gz QRZUZPRBPFAOCY-OAHLLOKOSA-N 1 2 315.486 4.419 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccnc2)s1 ZINC000430102521 338096734 /nfs/dbraw/zinc/09/67/34/338096734.db2.gz QRZUZPRBPFAOCY-HNNXBMFYSA-N 1 2 315.486 4.419 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)s1 ZINC000430102521 338096735 /nfs/dbraw/zinc/09/67/35/338096735.db2.gz QRZUZPRBPFAOCY-HNNXBMFYSA-N 1 2 315.486 4.419 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(F)cc(Cl)c2)[C@H]1c1cccnc1 ZINC000430108696 338097244 /nfs/dbraw/zinc/09/72/44/338097244.db2.gz UPRSOSHRRWQQBR-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(F)cc(Cl)c2)[C@H]1c1cccnc1 ZINC000430108696 338097245 /nfs/dbraw/zinc/09/72/45/338097245.db2.gz UPRSOSHRRWQQBR-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000430110508 338097292 /nfs/dbraw/zinc/09/72/92/338097292.db2.gz ZDHYSYDIEDNAEG-QGZVFWFLSA-N 1 2 316.832 4.327 20 0 DIADLO COc1cccc(Cl)c1C[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000430110508 338097293 /nfs/dbraw/zinc/09/72/93/338097293.db2.gz ZDHYSYDIEDNAEG-QGZVFWFLSA-N 1 2 316.832 4.327 20 0 DIADLO C[C@H]1C[N@H+](Cc2ncc(C(C)(C)C)s2)Cc2ccccc2O1 ZINC000430120773 338097933 /nfs/dbraw/zinc/09/79/33/338097933.db2.gz FVCGUCBHHVJFGY-ZDUSSCGKSA-N 1 2 316.470 4.224 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ncc(C(C)(C)C)s2)Cc2ccccc2O1 ZINC000430120773 338097934 /nfs/dbraw/zinc/09/79/34/338097934.db2.gz FVCGUCBHHVJFGY-ZDUSSCGKSA-N 1 2 316.470 4.224 20 0 DIADLO C[C@@H]1C[C@@H](Nc2cccc(C[N@H+](C)Cc3cscn3)c2)[C@@H]1C ZINC000430228512 338102137 /nfs/dbraw/zinc/10/21/37/338102137.db2.gz QVOWFBHDQSNFIG-HBUWYVDXSA-N 1 2 315.486 4.232 20 0 DIADLO C[C@@H]1C[C@@H](Nc2cccc(C[N@@H+](C)Cc3cscn3)c2)[C@@H]1C ZINC000430228512 338102138 /nfs/dbraw/zinc/10/21/38/338102138.db2.gz QVOWFBHDQSNFIG-HBUWYVDXSA-N 1 2 315.486 4.232 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3ccoc3CC)cc2[nH+]1 ZINC000430395231 338106187 /nfs/dbraw/zinc/10/61/87/338106187.db2.gz QOIBJIOGMAELMD-UHFFFAOYSA-N 1 2 311.385 4.313 20 0 DIADLO CCCCC1CCC(C(=O)N(C)c2ccc[nH+]c2N(C)C)CC1 ZINC000430465126 338107641 /nfs/dbraw/zinc/10/76/41/338107641.db2.gz OXPDJNNZLQPLTI-UHFFFAOYSA-N 1 2 317.477 4.107 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000430726761 338112598 /nfs/dbraw/zinc/11/25/98/338112598.db2.gz FLUBFSWJMOGTCP-SECBINFHSA-N 1 2 312.310 4.051 20 0 DIADLO CCc1occc1C(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000430808964 338115676 /nfs/dbraw/zinc/11/56/76/338115676.db2.gz FQIDLRYKIRWJTP-UHFFFAOYSA-N 1 2 322.408 4.496 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1ccc(C)c(F)c1 ZINC000430862035 338117274 /nfs/dbraw/zinc/11/72/74/338117274.db2.gz CODFKNJEUPNLAI-QGZVFWFLSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1ccc(C)c(F)c1 ZINC000430862035 338117275 /nfs/dbraw/zinc/11/72/75/338117275.db2.gz CODFKNJEUPNLAI-QGZVFWFLSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1cc(F)cc(Cl)c1 ZINC000430871473 338117642 /nfs/dbraw/zinc/11/76/42/338117642.db2.gz XSJQBQUVKLDNPZ-INIZCTEOSA-N 1 2 321.827 4.423 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1cc(F)c(F)c(F)c1 ZINC000430870044 338117650 /nfs/dbraw/zinc/11/76/50/338117650.db2.gz RUZSXHIHJCEUSE-HNNXBMFYSA-N 1 2 323.362 4.048 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1cc(C)ccc1F ZINC000430872985 338117699 /nfs/dbraw/zinc/11/76/99/338117699.db2.gz NZKODHLZAJLNMK-QGZVFWFLSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1cc(C)ccc1F ZINC000430872985 338117700 /nfs/dbraw/zinc/11/77/00/338117700.db2.gz NZKODHLZAJLNMK-QGZVFWFLSA-N 1 2 301.409 4.078 20 0 DIADLO Cn1c2cc(F)ccc2[nH+]c1N1CCC[C@H]1c1ccsc1 ZINC000431030187 338120887 /nfs/dbraw/zinc/12/08/87/338120887.db2.gz KELNIDPEQKAPAP-AWEZNQCLSA-N 1 2 301.390 4.115 20 0 DIADLO Cn1c2cc(F)ccc2[nH+]c1N1CCC[C@@H]1c1cccc(F)c1 ZINC000431038382 338120991 /nfs/dbraw/zinc/12/09/91/338120991.db2.gz NOCGDQNJBKBMKX-MRXNPFEDSA-N 1 2 313.351 4.193 20 0 DIADLO C[C@@H]1CCN(c2[nH+]c3ccc(F)cc3n2C)[C@@H](c2ccco2)C1 ZINC000431425014 338130458 /nfs/dbraw/zinc/13/04/58/338130458.db2.gz ARSUOXAHQQNGDI-MLGOLLRUSA-N 1 2 313.376 4.283 20 0 DIADLO Clc1ccccc1-c1csc(COc2cc[nH+]cc2)n1 ZINC000431487251 338132007 /nfs/dbraw/zinc/13/20/07/338132007.db2.gz YGSFHDFNZDOSSB-UHFFFAOYSA-N 1 2 302.786 4.438 20 0 DIADLO CC[C@H]1CCC[C@@H]1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000162836219 338137590 /nfs/dbraw/zinc/13/75/90/338137590.db2.gz DQLRFDHXHKGEIS-KSSFIOAISA-N 1 2 310.397 4.182 20 0 DIADLO Fc1ccc([C@@H]2CCCCN2c2cc[nH+]c(C3CC3)n2)c(F)c1 ZINC000432054669 338144559 /nfs/dbraw/zinc/14/45/59/338144559.db2.gz MIRAXRWBHSABAB-INIZCTEOSA-N 1 2 315.367 4.364 20 0 DIADLO c1cn(-c2cccc(Oc3ncncc3-c3ccccc3)c2)c[nH+]1 ZINC000432149964 338147263 /nfs/dbraw/zinc/14/72/63/338147263.db2.gz ACJKDPVWKSCJOM-UHFFFAOYSA-N 1 2 314.348 4.122 20 0 DIADLO Cc1cc[nH+]c(NCCc2cccc(C(F)(F)F)n2)c1Cl ZINC000432167195 338147771 /nfs/dbraw/zinc/14/77/71/338147771.db2.gz UYRQTNLJTJEAIH-UHFFFAOYSA-N 1 2 315.726 4.112 20 0 DIADLO Fc1ccc(C[NH2+]Cc2nccn2C(F)F)c(Cl)c1Cl ZINC000432236580 338149686 /nfs/dbraw/zinc/14/96/86/338149686.db2.gz BBRRCAHPTDJAKH-UHFFFAOYSA-N 1 2 324.133 4.014 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2csc(Cl)c2Cl)s1 ZINC000432259299 338151720 /nfs/dbraw/zinc/15/17/20/338151720.db2.gz RIICIIKCINQDAI-YFKPBYRVSA-N 1 2 308.259 4.066 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@@H+]1Cc1cocn1 ZINC000432739339 338165181 /nfs/dbraw/zinc/16/51/81/338165181.db2.gz QHFNVWXAPMMTDH-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@H+]1Cc1cocn1 ZINC000432739339 338165182 /nfs/dbraw/zinc/16/51/82/338165182.db2.gz QHFNVWXAPMMTDH-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@@H+]1Cc1cocn1 ZINC000432739340 338165219 /nfs/dbraw/zinc/16/52/19/338165219.db2.gz QHFNVWXAPMMTDH-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@H+]1Cc1cocn1 ZINC000432739340 338165220 /nfs/dbraw/zinc/16/52/20/338165220.db2.gz QHFNVWXAPMMTDH-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO C[N@H+](Cc1nc2ccc(F)cc2s1)Cc1cccc(F)c1 ZINC000432742796 338165738 /nfs/dbraw/zinc/16/57/38/338165738.db2.gz VFVAYAKPGZQYCT-UHFFFAOYSA-N 1 2 304.365 4.207 20 0 DIADLO C[N@@H+](Cc1nc2ccc(F)cc2s1)Cc1cccc(F)c1 ZINC000432742796 338165739 /nfs/dbraw/zinc/16/57/39/338165739.db2.gz VFVAYAKPGZQYCT-UHFFFAOYSA-N 1 2 304.365 4.207 20 0 DIADLO CC[N@H+](Cc1csc(Cl)c1Cl)Cc1ccccn1 ZINC000432750775 338166292 /nfs/dbraw/zinc/16/62/92/338166292.db2.gz NUGZDOHVOPDOGV-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC[N@@H+](Cc1csc(Cl)c1Cl)Cc1ccccn1 ZINC000432750775 338166293 /nfs/dbraw/zinc/16/62/93/338166293.db2.gz NUGZDOHVOPDOGV-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@H]3c3ccc[nH]3)sc2c1 ZINC000432754350 338166714 /nfs/dbraw/zinc/16/67/14/338166714.db2.gz YVUIWCXOYRVULF-AWEZNQCLSA-N 1 2 301.390 4.101 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@H]3c3ccc[nH]3)sc2c1 ZINC000432754350 338166715 /nfs/dbraw/zinc/16/67/15/338166715.db2.gz YVUIWCXOYRVULF-AWEZNQCLSA-N 1 2 301.390 4.101 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nnc(C(C)(C)C)[nH]2)o1 ZINC000432816382 338168910 /nfs/dbraw/zinc/16/89/10/338168910.db2.gz PJLAIAZZRZEHDW-AWEZNQCLSA-N 1 2 316.449 4.121 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2nnc(C(C)(C)C)[nH]2)o1 ZINC000432816382 338168911 /nfs/dbraw/zinc/16/89/11/338168911.db2.gz PJLAIAZZRZEHDW-AWEZNQCLSA-N 1 2 316.449 4.121 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)c1c(Cl)cc(F)cc1Cl ZINC000432937797 338174145 /nfs/dbraw/zinc/17/41/45/338174145.db2.gz LXCCMHOMGSQUAG-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO FC(F)[C@@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1ccccc1 ZINC000433059920 338179233 /nfs/dbraw/zinc/17/92/33/338179233.db2.gz FKTAMFNQOLFDKC-CVEARBPZSA-N 1 2 309.400 4.464 20 0 DIADLO CC(C)[C@H](c1ccc(F)cc1)[N@H+](C)Cc1nnc(C(C)(C)C)[nH]1 ZINC000433199220 338185363 /nfs/dbraw/zinc/18/53/63/338185363.db2.gz KFRVWBGRBLPLMB-MRXNPFEDSA-N 1 2 318.440 4.070 20 0 DIADLO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1nnc(C(C)(C)C)[nH]1 ZINC000433199220 338185364 /nfs/dbraw/zinc/18/53/64/338185364.db2.gz KFRVWBGRBLPLMB-MRXNPFEDSA-N 1 2 318.440 4.070 20 0 DIADLO COc1cc(NCc2cc(-n3cc[nH+]c3)cs2)ccc1Cl ZINC000433199356 338185614 /nfs/dbraw/zinc/18/56/14/338185614.db2.gz BYRGQFOCPQLRRQ-UHFFFAOYSA-N 1 2 319.817 4.208 20 0 DIADLO COC(=O)c1cc([C@H](C)[N@H+](C)Cc2cc(C)ccc2F)oc1C ZINC000433202400 338185825 /nfs/dbraw/zinc/18/58/25/338185825.db2.gz QHNNFZIPKONNIB-LBPRGKRZSA-N 1 2 319.376 4.015 20 0 DIADLO COC(=O)c1cc([C@H](C)[N@@H+](C)Cc2cc(C)ccc2F)oc1C ZINC000433202400 338185826 /nfs/dbraw/zinc/18/58/26/338185826.db2.gz QHNNFZIPKONNIB-LBPRGKRZSA-N 1 2 319.376 4.015 20 0 DIADLO C[N@H+](Cc1ncc(C(C)(C)C)o1)Cc1ccc(F)c(Cl)c1 ZINC000433237661 338187273 /nfs/dbraw/zinc/18/72/73/338187273.db2.gz YZKBTWNOKZKLSY-UHFFFAOYSA-N 1 2 310.800 4.397 20 0 DIADLO C[N@@H+](Cc1ncc(C(C)(C)C)o1)Cc1ccc(F)c(Cl)c1 ZINC000433237661 338187274 /nfs/dbraw/zinc/18/72/74/338187274.db2.gz YZKBTWNOKZKLSY-UHFFFAOYSA-N 1 2 310.800 4.397 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)no1 ZINC000433286675 338189426 /nfs/dbraw/zinc/18/94/26/338189426.db2.gz JSVNOLBAYCWCFS-AWEZNQCLSA-N 1 2 319.836 4.055 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)no1 ZINC000433286675 338189427 /nfs/dbraw/zinc/18/94/27/338189427.db2.gz JSVNOLBAYCWCFS-AWEZNQCLSA-N 1 2 319.836 4.055 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ncc(C(F)(F)F)s2)c(C)o1 ZINC000433312873 338191598 /nfs/dbraw/zinc/19/15/98/338191598.db2.gz NPVLWQNJKYGPRO-MRVPVSSYSA-N 1 2 304.337 4.223 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2cc[nH]n2)o1)c1c(F)cccc1Cl ZINC000433340907 338193370 /nfs/dbraw/zinc/19/33/70/338193370.db2.gz GBJWYBAOVNNDRW-JTQLQIEISA-N 1 2 319.767 4.313 20 0 DIADLO Cc1cc(N2CCc3cc(Cl)cc(Cl)c3[C@H]2C)nc[nH+]1 ZINC000433620906 338198417 /nfs/dbraw/zinc/19/84/17/338198417.db2.gz CMNKVHIWRGRAOH-SNVBAGLBSA-N 1 2 308.212 4.216 20 0 DIADLO Cc1nc2[nH]ccc2c(N2CCC[C@@H]2c2cccc(Cl)c2)[nH+]1 ZINC000433782155 338201770 /nfs/dbraw/zinc/20/17/70/338201770.db2.gz ZJDXNRMXYLNJLV-OAHLLOKOSA-N 1 2 312.804 4.261 20 0 DIADLO CC(C)c1noc([C@H](C)[NH+]2CCC(F)(c3ccccc3)CC2)n1 ZINC000434499678 338218641 /nfs/dbraw/zinc/21/86/41/338218641.db2.gz ZWYMIWKAYFQSLD-AWEZNQCLSA-N 1 2 317.408 4.215 20 0 DIADLO CCCCc1noc(C[N@H+](C)[C@H](c2ccc(F)cc2)C(C)C)n1 ZINC000434612271 338220972 /nfs/dbraw/zinc/22/09/72/338220972.db2.gz QANXJNOZGLFNEV-SFHVURJKSA-N 1 2 319.424 4.380 20 0 DIADLO CCCCc1noc(C[N@@H+](C)[C@H](c2ccc(F)cc2)C(C)C)n1 ZINC000434612271 338220973 /nfs/dbraw/zinc/22/09/73/338220973.db2.gz QANXJNOZGLFNEV-SFHVURJKSA-N 1 2 319.424 4.380 20 0 DIADLO Cc1cccc([C@H](C)[S@](=O)Cc2[nH+]ccn2-c2ccccc2)c1 ZINC000434629880 338221892 /nfs/dbraw/zinc/22/18/92/338221892.db2.gz ROXPTVAJUMIHIU-QMHKHESXSA-N 1 2 324.449 4.191 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@H](C)C(=O)Nc1cccc2ccccc21 ZINC000434717041 338224044 /nfs/dbraw/zinc/22/40/44/338224044.db2.gz IOLYSAPFHPCZNB-CQSZACIVSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1occc1C[N@H+](C)[C@H](C)C(=O)Nc1cccc2ccccc21 ZINC000434717041 338224045 /nfs/dbraw/zinc/22/40/45/338224045.db2.gz IOLYSAPFHPCZNB-CQSZACIVSA-N 1 2 322.408 4.200 20 0 DIADLO Fc1cccc(Cl)c1NCc1c[nH+]cn1Cc1ccccc1 ZINC000434733832 338224200 /nfs/dbraw/zinc/22/42/00/338224200.db2.gz CYCYBJPAASYYMW-UHFFFAOYSA-N 1 2 315.779 4.336 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2ncc(C(F)(F)F)s2)c1 ZINC000434985130 338228670 /nfs/dbraw/zinc/22/86/70/338228670.db2.gz GKDBWCBRWVWOSV-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2ncc(C(F)(F)F)s2)c1 ZINC000434985130 338228671 /nfs/dbraw/zinc/22/86/71/338228671.db2.gz GKDBWCBRWVWOSV-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO C/C(=C/c1ccccc1)C[NH2+]Cc1noc(-c2ccccc2F)n1 ZINC000435023868 338229794 /nfs/dbraw/zinc/22/97/94/338229794.db2.gz OPKZVIDXZXNOSX-KAMYIIQDSA-N 1 2 323.371 4.069 20 0 DIADLO O=C(c1ccc(F)cc1)C1CC[NH+](Cc2ccc(Cl)o2)CC1 ZINC000435046674 338230801 /nfs/dbraw/zinc/23/08/01/338230801.db2.gz VQKSAIKDGXEUII-UHFFFAOYSA-N 1 2 321.779 4.167 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+](Cc2ccccc2)C2CC2)s1 ZINC000435127977 338232655 /nfs/dbraw/zinc/23/26/55/338232655.db2.gz YVRPCPOPIGBKTJ-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+](Cc2ccccc2)C2CC2)s1 ZINC000435127977 338232656 /nfs/dbraw/zinc/23/26/56/338232656.db2.gz YVRPCPOPIGBKTJ-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO Cc1ccc2c(Nc3ccc(N4CCCCC4)[nH+]c3)ccnc2n1 ZINC000435478051 338240932 /nfs/dbraw/zinc/24/09/32/338240932.db2.gz RVJIDVSPDPMNOL-UHFFFAOYSA-N 1 2 319.412 4.067 20 0 DIADLO CCc1occc1C(=O)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1 ZINC000435614152 338243495 /nfs/dbraw/zinc/24/34/95/338243495.db2.gz DQOJUSNXRUUULX-UHFFFAOYSA-N 1 2 309.369 4.238 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)C[C@@H](C)C(C)(C)C ZINC000435991969 338255321 /nfs/dbraw/zinc/25/53/21/338255321.db2.gz JNGFNLRVNQARJR-CABCVRRESA-N 1 2 305.466 4.029 20 0 DIADLO O=C(C[C@@H]1C=CCC1)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436178207 338260786 /nfs/dbraw/zinc/26/07/86/338260786.db2.gz SIIGEPQULFCEDX-OAHLLOKOSA-N 1 2 321.424 4.181 20 0 DIADLO CC[C@]1(C)C[C@H]1C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436188708 338261248 /nfs/dbraw/zinc/26/12/48/338261248.db2.gz RZMNJRXHCBEAOR-FXAWDEMLSA-N 1 2 323.440 4.261 20 0 DIADLO COc1cc[nH+]cc1NC(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000436373832 338269937 /nfs/dbraw/zinc/26/99/37/338269937.db2.gz URCHPTNOKDJMFP-UHFFFAOYSA-N 1 2 312.156 4.041 20 0 DIADLO Cc1c2ccccc2oc1CNC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000436492932 338274183 /nfs/dbraw/zinc/27/41/83/338274183.db2.gz KKSUELYDYRIQAH-UHFFFAOYSA-N 1 2 323.396 4.383 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2ccc(F)c(Cl)c2)c(C)[nH+]1 ZINC000436497924 338274327 /nfs/dbraw/zinc/27/43/27/338274327.db2.gz TYSSHTWYAUOSIO-UHFFFAOYSA-N 1 2 321.783 4.121 20 0 DIADLO CCCCCc1ccc([C@@H](CC)[NH2+][C@H](C)c2ncn(C)n2)cc1 ZINC000437057672 338298994 /nfs/dbraw/zinc/29/89/94/338298994.db2.gz VOSDSRKDTGHLTC-CRAIPNDOSA-N 1 2 314.477 4.350 20 0 DIADLO Fc1cccc2c1OCC[C@H]2[NH2+][C@@H](Cc1ccccc1)C(F)F ZINC000437076858 338299631 /nfs/dbraw/zinc/29/96/31/338299631.db2.gz NCNXNFVBUSUBMA-CVEARBPZSA-N 1 2 321.342 4.115 20 0 DIADLO COc1cnccc1[C@H](C)[NH2+][C@H](CCc1ccccc1)C(F)F ZINC000437087409 338300186 /nfs/dbraw/zinc/30/01/86/338300186.db2.gz IZDLBOFEARGKCL-XJKSGUPXSA-N 1 2 320.383 4.007 20 0 DIADLO Cc1ccc(NC(=O)c2cc(-c3ccccc3)ns2)c(C)[nH+]1 ZINC000437108137 338301291 /nfs/dbraw/zinc/30/12/91/338301291.db2.gz DKYNBDFTZBHYDV-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO FC(F)(F)Cn1cc[nH+]c1CSC/C=C\c1ccccc1 ZINC000437267199 338305361 /nfs/dbraw/zinc/30/53/61/338305361.db2.gz MXTFKAFKIKYOGN-DAXSKMNVSA-N 1 2 312.360 4.392 20 0 DIADLO C1=CC[C@]2(CC1)CCC[N@@H+](Cc1noc(C3CCCCC3)n1)C2 ZINC000437542545 338313175 /nfs/dbraw/zinc/31/31/75/338313175.db2.gz UOCUPTSQBJBJNT-IBGZPJMESA-N 1 2 315.461 4.440 20 0 DIADLO C1=CC[C@]2(CC1)CCC[N@H+](Cc1noc(C3CCCCC3)n1)C2 ZINC000437542545 338313176 /nfs/dbraw/zinc/31/31/76/338313176.db2.gz UOCUPTSQBJBJNT-IBGZPJMESA-N 1 2 315.461 4.440 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCCC[C@H]2c2cccn2C)n1 ZINC000437577696 338314183 /nfs/dbraw/zinc/31/41/83/338314183.db2.gz KKQKXIQPBCJZAE-IBGZPJMESA-N 1 2 314.477 4.310 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCCC[C@H]2c2cccn2C)n1 ZINC000437577696 338314184 /nfs/dbraw/zinc/31/41/84/338314184.db2.gz KKQKXIQPBCJZAE-IBGZPJMESA-N 1 2 314.477 4.310 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000437604236 338315988 /nfs/dbraw/zinc/31/59/88/338315988.db2.gz NVHMXXFEADTJTP-VBKZILBWSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000437604236 338315989 /nfs/dbraw/zinc/31/59/89/338315989.db2.gz NVHMXXFEADTJTP-VBKZILBWSA-N 1 2 324.399 4.269 20 0 DIADLO Cc1ccc(Cl)c(OCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000437616579 338316186 /nfs/dbraw/zinc/31/61/86/338316186.db2.gz WAIUTAWHLDBIJQ-UHFFFAOYSA-N 1 2 312.800 4.472 20 0 DIADLO CC(=O)c1ccc(C)cc1OCc1c[nH+]cn1Cc1ccccc1 ZINC000437624409 338316505 /nfs/dbraw/zinc/31/65/05/338316505.db2.gz JEKOSYLECZFSLW-UHFFFAOYSA-N 1 2 320.392 4.021 20 0 DIADLO CC[N@H+](Cc1c(Cl)cnn1C)[C@H](C)c1cc2ccccc2o1 ZINC000437684555 338318176 /nfs/dbraw/zinc/31/81/76/338318176.db2.gz BAVBEKPVJWSVQO-GFCCVEGCSA-N 1 2 317.820 4.403 20 0 DIADLO CC[N@@H+](Cc1c(Cl)cnn1C)[C@H](C)c1cc2ccccc2o1 ZINC000437684555 338318177 /nfs/dbraw/zinc/31/81/77/338318177.db2.gz BAVBEKPVJWSVQO-GFCCVEGCSA-N 1 2 317.820 4.403 20 0 DIADLO Cc1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]3c3ncc[nH]3)o2)cc1 ZINC000437985178 338327352 /nfs/dbraw/zinc/32/73/52/338327352.db2.gz LGXKVYGNNZFPFE-QGZVFWFLSA-N 1 2 307.397 4.315 20 0 DIADLO Cc1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3c3ncc[nH]3)o2)cc1 ZINC000437985178 338327353 /nfs/dbraw/zinc/32/73/53/338327353.db2.gz LGXKVYGNNZFPFE-QGZVFWFLSA-N 1 2 307.397 4.315 20 0 DIADLO Cc1cccn2cc(-c3ccc(NCC[C@H]4CCOC4)cc3)[nH+]c12 ZINC000438087742 338330711 /nfs/dbraw/zinc/33/07/11/338330711.db2.gz HCPXPMDZPYAUTJ-INIZCTEOSA-N 1 2 321.424 4.148 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3c(cccc3F)[nH]2)[C@H](c2ccccc2)CO1 ZINC000438091159 338331063 /nfs/dbraw/zinc/33/10/63/338331063.db2.gz AGOPDLMDHXSDJS-XOBRGWDASA-N 1 2 324.399 4.269 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3c(cccc3F)[nH]2)[C@H](c2ccccc2)CO1 ZINC000438091159 338331064 /nfs/dbraw/zinc/33/10/64/338331064.db2.gz AGOPDLMDHXSDJS-XOBRGWDASA-N 1 2 324.399 4.269 20 0 DIADLO FC(F)C[N@@H+](Cc1c[nH]nc1-c1ccsc1)CC1CCC1 ZINC000438099387 338331297 /nfs/dbraw/zinc/33/12/97/338331297.db2.gz WLGCKJQOCHJJKR-UHFFFAOYSA-N 1 2 311.401 4.005 20 0 DIADLO FC(F)C[N@H+](Cc1c[nH]nc1-c1ccsc1)CC1CCC1 ZINC000438099387 338331298 /nfs/dbraw/zinc/33/12/98/338331298.db2.gz WLGCKJQOCHJJKR-UHFFFAOYSA-N 1 2 311.401 4.005 20 0 DIADLO CCc1cccc(C)c1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438330435 338339902 /nfs/dbraw/zinc/33/99/02/338339902.db2.gz UXTODDDUQCKKRE-UHFFFAOYSA-N 1 2 305.425 4.414 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3C[C@H](C)O[C@@H](C)[C@H]3C)cs2)cc1 ZINC000438366081 338341566 /nfs/dbraw/zinc/34/15/66/338341566.db2.gz UNKXVJWWARSZEY-ZNMIVQPWSA-N 1 2 316.470 4.116 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3C[C@H](C)O[C@@H](C)[C@H]3C)cs2)cc1 ZINC000438366081 338341567 /nfs/dbraw/zinc/34/15/67/338341567.db2.gz UNKXVJWWARSZEY-ZNMIVQPWSA-N 1 2 316.470 4.116 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@H](c3cccc(Cl)c3)OC[C@H]2C)o1 ZINC000438555351 338347935 /nfs/dbraw/zinc/34/79/35/338347935.db2.gz QVPFOOZVLHRQRQ-SJKOYZFVSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@H](c3cccc(Cl)c3)OC[C@H]2C)o1 ZINC000438555351 338347936 /nfs/dbraw/zinc/34/79/36/338347936.db2.gz QVPFOOZVLHRQRQ-SJKOYZFVSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@H](c3cccc(Cl)c3)OC[C@@H]2C)o1 ZINC000438555352 338347944 /nfs/dbraw/zinc/34/79/44/338347944.db2.gz QVPFOOZVLHRQRQ-YVEFUNNKSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@H](c3cccc(Cl)c3)OC[C@@H]2C)o1 ZINC000438555352 338347945 /nfs/dbraw/zinc/34/79/45/338347945.db2.gz QVPFOOZVLHRQRQ-YVEFUNNKSA-N 1 2 305.805 4.203 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@H](c3cccc(F)c3)C2)s1 ZINC000438854805 338354099 /nfs/dbraw/zinc/35/40/99/338354099.db2.gz XEGRNMZDTHLMPV-HNNXBMFYSA-N 1 2 323.458 4.183 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@H](c3cccc(F)c3)C2)s1 ZINC000438854805 338354100 /nfs/dbraw/zinc/35/41/00/338354100.db2.gz XEGRNMZDTHLMPV-HNNXBMFYSA-N 1 2 323.458 4.183 20 0 DIADLO Oc1ccc(F)c(CNc2ccc(-c3ccccc3)c[nH+]2)c1F ZINC000438932494 338356290 /nfs/dbraw/zinc/35/62/90/338356290.db2.gz QYFDYKMPUUZBIP-UHFFFAOYSA-N 1 2 312.319 4.345 20 0 DIADLO Cc1[nH]c(C(=O)N[C@H](CC(C)(C)C)c2ccc(Cl)cc2)c[nH+]1 ZINC000439315131 338366872 /nfs/dbraw/zinc/36/68/72/338366872.db2.gz HTHZQWXNYQPKDC-CQSZACIVSA-N 1 2 319.836 4.279 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2)CC[N@@H+]1Cc1noc(C(C)(C)C)n1 ZINC000439324865 338367238 /nfs/dbraw/zinc/36/72/38/338367238.db2.gz JCIBJIOZSPYBGU-HOCLYGCPSA-N 1 2 313.445 4.135 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2)CC[N@H+]1Cc1noc(C(C)(C)C)n1 ZINC000439324865 338367239 /nfs/dbraw/zinc/36/72/39/338367239.db2.gz JCIBJIOZSPYBGU-HOCLYGCPSA-N 1 2 313.445 4.135 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2)CC[N@@H+]1Cc1noc(C(C)(C)C)n1 ZINC000439324861 338367285 /nfs/dbraw/zinc/36/72/85/338367285.db2.gz JCIBJIOZSPYBGU-GDBMZVCRSA-N 1 2 313.445 4.135 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1Cc1noc(C(C)(C)C)n1 ZINC000439324861 338367286 /nfs/dbraw/zinc/36/72/86/338367286.db2.gz JCIBJIOZSPYBGU-GDBMZVCRSA-N 1 2 313.445 4.135 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@@H](c3ccccc3)C[C@H]2C)c(C)[nH+]1 ZINC000439447770 338369749 /nfs/dbraw/zinc/36/97/49/338369749.db2.gz FXUFIJKLJJTJEB-CRAIPNDOSA-N 1 2 323.440 4.498 20 0 DIADLO CSc1ccc([C@H](C)NC(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000439447122 338369778 /nfs/dbraw/zinc/36/97/78/338369778.db2.gz DOYHKWZTJRDIAE-LBPRGKRZSA-N 1 2 315.442 4.303 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+]1CCCc2c3cccc(F)c3[nH]c2C1 ZINC000439475495 338370876 /nfs/dbraw/zinc/37/08/76/338370876.db2.gz YNVLXMDPCIMAJR-CYBMUJFWSA-N 1 2 309.388 4.211 20 0 DIADLO C[C@H](c1cccnc1)[N@H+]1CCCc2c3cccc(F)c3[nH]c2C1 ZINC000439475495 338370877 /nfs/dbraw/zinc/37/08/77/338370877.db2.gz YNVLXMDPCIMAJR-CYBMUJFWSA-N 1 2 309.388 4.211 20 0 DIADLO CCc1nnc(C[N@H+](CC=C(C)C)Cc2ccc(Cl)cc2)o1 ZINC000439478087 338371004 /nfs/dbraw/zinc/37/10/04/338371004.db2.gz NGOGNZWTSZJHST-UHFFFAOYSA-N 1 2 319.836 4.254 20 0 DIADLO CCc1nnc(C[N@@H+](CC=C(C)C)Cc2ccc(Cl)cc2)o1 ZINC000439478087 338371005 /nfs/dbraw/zinc/37/10/05/338371005.db2.gz NGOGNZWTSZJHST-UHFFFAOYSA-N 1 2 319.836 4.254 20 0 DIADLO CC[C@H]1C[N@H+](Cc2csc(C3CCCCC3)n2)CCCO1 ZINC000439480793 338371278 /nfs/dbraw/zinc/37/12/78/338371278.db2.gz FRMPUXOJEYRTPH-INIZCTEOSA-N 1 2 308.491 4.192 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2csc(C3CCCCC3)n2)CCCO1 ZINC000439480793 338371279 /nfs/dbraw/zinc/37/12/79/338371279.db2.gz FRMPUXOJEYRTPH-INIZCTEOSA-N 1 2 308.491 4.192 20 0 DIADLO Cn1c[nH+]cc1CNc1ccccc1Oc1ccccc1Cl ZINC000439625480 338374970 /nfs/dbraw/zinc/37/49/70/338374970.db2.gz NHWRRYQFIUQSGW-UHFFFAOYSA-N 1 2 313.788 4.478 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@H+](C)Cc1cnc(C(C)C)nc1 ZINC000440475126 338388164 /nfs/dbraw/zinc/38/81/64/338388164.db2.gz SBTLMBAGAPAKPM-QGZVFWFLSA-N 1 2 319.399 4.461 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@@H+](C)Cc1cnc(C(C)C)nc1 ZINC000440475126 338388165 /nfs/dbraw/zinc/38/81/65/338388165.db2.gz SBTLMBAGAPAKPM-QGZVFWFLSA-N 1 2 319.399 4.461 20 0 DIADLO CC[C@H](F)C[N@@H+]1CCC[C@@H]1c1ccc(Br)s1 ZINC000440489001 338388343 /nfs/dbraw/zinc/38/83/43/338388343.db2.gz CLZDXQHJBFAKAU-VHSXEESVSA-N 1 2 306.244 4.396 20 0 DIADLO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1ccc(Br)s1 ZINC000440489001 338388344 /nfs/dbraw/zinc/38/83/44/338388344.db2.gz CLZDXQHJBFAKAU-VHSXEESVSA-N 1 2 306.244 4.396 20 0 DIADLO COc1cccc2c(N[C@@H]3CCCC[C@H]3n3cccn3)cc[nH+]c12 ZINC000440661885 338394664 /nfs/dbraw/zinc/39/46/64/338394664.db2.gz RBUADLSPTFTLCR-IAGOWNOFSA-N 1 2 322.412 4.036 20 0 DIADLO Cc1nc(N2CCC[C@@H]2c2ccc(F)cc2)c2c([nH+]1)CCCC2 ZINC000440721580 338396022 /nfs/dbraw/zinc/39/60/22/338396022.db2.gz JIQIXESSDZMDHY-GOSISDBHSA-N 1 2 311.404 4.144 20 0 DIADLO Cc1ccc(Cl)c(N(Cc2[nH]cc[nH+]2)C(=O)C2=CCCC2)c1 ZINC000440889835 338399403 /nfs/dbraw/zinc/39/94/03/338399403.db2.gz OZFMXLRSRZNQNW-UHFFFAOYSA-N 1 2 315.804 4.015 20 0 DIADLO FC(F)(F)CCc1cccc(Nc2[nH+]cnc3[nH]ccc32)c1 ZINC000441801200 338419181 /nfs/dbraw/zinc/41/91/81/338419181.db2.gz MDPHWPSXMZHWLL-UHFFFAOYSA-N 1 2 306.291 4.196 20 0 DIADLO C=Cn1cc(CNc2cccc(-c3cccc(OCC)c3)[nH+]2)cn1 ZINC000446901901 338539988 /nfs/dbraw/zinc/53/99/88/338539988.db2.gz GEXVCDSZQATADQ-UHFFFAOYSA-N 1 2 320.396 4.056 20 0 DIADLO Cc1ccc(C[S@@](=O)Cc2ccc(C3CCC3)cc2)c(C)[nH+]1 ZINC000447111006 338545681 /nfs/dbraw/zinc/54/56/81/338545681.db2.gz CWMUSLLSXWLRPC-QFIPXVFZSA-N 1 2 313.466 4.415 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H](c2ccccc2C)C2CC2)c(C)[nH+]1 ZINC000447166618 338546706 /nfs/dbraw/zinc/54/67/06/338546706.db2.gz LOUXIVUESZOJKF-GOSISDBHSA-N 1 2 309.413 4.280 20 0 DIADLO Cc1ccc(NC(=O)N2CCCC[C@H]2Cc2ccccc2)c(C)[nH+]1 ZINC000447192215 338547297 /nfs/dbraw/zinc/54/72/97/338547297.db2.gz JFRDUKFUBACNNE-SFHVURJKSA-N 1 2 323.440 4.328 20 0 DIADLO COCCC[C@@H](C)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000447571484 338557892 /nfs/dbraw/zinc/55/78/92/338557892.db2.gz KIRCCJFKFGUAEE-OAHLLOKOSA-N 1 2 313.445 4.113 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+]CC[C@H](C)c1ccccc1 ZINC000447731741 338564951 /nfs/dbraw/zinc/56/49/51/338564951.db2.gz UIGDDPSFUCBNMD-KRWDZBQOSA-N 1 2 324.468 4.437 20 0 DIADLO C=Cn1cc(CNc2cccc(-c3[nH+]ccn3CCCC)c2)cn1 ZINC000447819632 338567789 /nfs/dbraw/zinc/56/77/89/338567789.db2.gz BLZKNMJWMSAHKE-UHFFFAOYSA-N 1 2 321.428 4.259 20 0 DIADLO Cc1cccc(CN(C)Cc2[nH+]ccn2Cc2ccccc2)c1F ZINC000449030901 338585555 /nfs/dbraw/zinc/58/55/55/338585555.db2.gz VUMFPZYFXLVSDO-UHFFFAOYSA-N 1 2 323.415 4.011 20 0 DIADLO Clc1cc(CN2CCC[C@H]2c2[nH]cc[nH+]2)c(Cl)s1 ZINC000449236401 338605231 /nfs/dbraw/zinc/60/52/31/338605231.db2.gz JYHMIDKPFKXGPT-VIFPVBQESA-N 1 2 302.230 4.115 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(F)cc1Cl ZINC000449348306 338615956 /nfs/dbraw/zinc/61/59/56/338615956.db2.gz LSXZZHZQZTYKJR-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO CC[C@H]([NH2+]Cc1cnc(-c2ccccc2F)s1)C(F)F ZINC000449361732 338617553 /nfs/dbraw/zinc/61/75/53/338617553.db2.gz LHPOYISDIBOHLZ-LBPRGKRZSA-N 1 2 300.349 4.083 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3cn(C)nc3C3CCCCC3)n2c1 ZINC000449371509 338618636 /nfs/dbraw/zinc/61/86/36/338618636.db2.gz VTBYMZIUGLIJNI-UHFFFAOYSA-N 1 2 323.444 4.036 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(-c2c(F)cccc2F)s1)C(C)(F)F ZINC000449413394 338622173 /nfs/dbraw/zinc/62/21/73/338622173.db2.gz IJXOZIIJMYTPHH-MRVPVSSYSA-N 1 2 318.339 4.222 20 0 DIADLO Cc1cc2[nH]c(CN3CC(C)(C)[C@H]3c3[nH+]ccn3C)cc2c(C)c1 ZINC000449417488 338622685 /nfs/dbraw/zinc/62/26/85/338622685.db2.gz YIPOAHDHENOXFT-GOSISDBHSA-N 1 2 322.456 4.101 20 0 DIADLO CC(C)CC(CC(C)C)C(=O)N1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000450110144 338667542 /nfs/dbraw/zinc/66/75/42/338667542.db2.gz DJESCOHOEJMNSE-AEFFLSMTSA-N 1 2 319.493 4.001 20 0 DIADLO FC(F)(F)c1ccc2c(cc[nH+]c2N2CCCSCC2)c1 ZINC000450252492 338673506 /nfs/dbraw/zinc/67/35/06/338673506.db2.gz IPJOLPUEQLTQCI-UHFFFAOYSA-N 1 2 312.360 4.197 20 0 DIADLO Cc1sccc1C(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000450292836 338675850 /nfs/dbraw/zinc/67/58/50/338675850.db2.gz YXGDDWCALDYFEA-UHFFFAOYSA-N 1 2 311.410 4.073 20 0 DIADLO CC[C@@H](O)CCCNc1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000450346654 338679107 /nfs/dbraw/zinc/67/91/07/338679107.db2.gz FKWZCSJGVWCDKK-CYBMUJFWSA-N 1 2 312.335 4.217 20 0 DIADLO COc1cccc2c1cc[nH+]c2N1CCC(C(F)(F)F)CC1 ZINC000450362686 338680034 /nfs/dbraw/zinc/68/00/34/338680034.db2.gz RVAYMJMSTRBMCK-UHFFFAOYSA-N 1 2 310.319 4.022 20 0 DIADLO COc1ccnc(C[NH2+][C@H](CC(C)C)c2ccc(Cl)cc2)n1 ZINC000450686928 338699191 /nfs/dbraw/zinc/69/91/91/338699191.db2.gz YSRGZVOLGIFDAM-OAHLLOKOSA-N 1 2 319.836 4.016 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H](C)c1csnn1)c1ccc(Cl)cc1F ZINC000450709915 338700321 /nfs/dbraw/zinc/70/03/21/338700321.db2.gz BWZYBJJYJDGLDV-XPTSAGLGSA-N 1 2 313.829 4.379 20 0 DIADLO CCOc1cccc2cc([C@H](C)[NH2+][C@@H](C)c3csnn3)oc21 ZINC000450722522 338701310 /nfs/dbraw/zinc/70/13/10/338701310.db2.gz CIVZZMXAMSFLFB-QWRGUYRKSA-N 1 2 317.414 4.095 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc3ncsc3c2)s1 ZINC000450760063 338704020 /nfs/dbraw/zinc/70/40/20/338704020.db2.gz LCVYVSDOQWXZGR-JTQLQIEISA-N 1 2 318.471 4.122 20 0 DIADLO CC(=O)c1cccc(C(F)(F)F)c1OCc1ccc(C)[nH+]c1C ZINC000450931332 338712999 /nfs/dbraw/zinc/71/29/99/338712999.db2.gz PCJDQGWLHSWTBM-UHFFFAOYSA-N 1 2 323.314 4.499 20 0 DIADLO COC[C@@H]1CCCN(c2cc[nH+]c3c(Cl)cccc23)CC1 ZINC000450941625 338713565 /nfs/dbraw/zinc/71/35/65/338713565.db2.gz FNEAXEAGHYBGJM-CYBMUJFWSA-N 1 2 304.821 4.141 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccoc2)no1)c1cccc(C2CC2)c1 ZINC000451116940 338721918 /nfs/dbraw/zinc/72/19/18/338721918.db2.gz SVPUVSVAIUTRAN-LBPRGKRZSA-N 1 2 309.369 4.058 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)no1 ZINC000451355107 338730944 /nfs/dbraw/zinc/73/09/44/338730944.db2.gz OZPZTCKFKSAYOU-INIZCTEOSA-N 1 2 323.799 4.056 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@@H]2CCn3ccnc32)c2ccccc2)cc1 ZINC000453054601 338788041 /nfs/dbraw/zinc/78/80/41/338788041.db2.gz HTISBGQFVHAMAP-MOPGFXCFSA-N 1 2 303.409 4.016 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+][C@H](CC(F)(F)F)c2ccccc2)c2nccn21 ZINC000453057130 338788370 /nfs/dbraw/zinc/78/83/70/338788370.db2.gz GZCMMKLEXUMNSU-MRVWCRGKSA-N 1 2 309.335 4.172 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]C2c3ccccc3-c3ccccc32)c2nccn21 ZINC000453075331 338790831 /nfs/dbraw/zinc/79/08/31/338790831.db2.gz HLWYHBBXPVCUMB-FZKQIMNGSA-N 1 2 301.393 4.249 20 0 DIADLO CCc1c(N[C@@H](C)c2[nH+]ccn2CC)cnn1C(CC)CC ZINC000453202252 338807172 /nfs/dbraw/zinc/80/71/72/338807172.db2.gz DIENZPVFDGIWTN-ZDUSSCGKSA-N 1 2 303.454 4.196 20 0 DIADLO COc1cc(N[C@@H]2C[C@H](C)n3cc[nH+]c32)cc(OC)c1C(C)C ZINC000453202679 338807294 /nfs/dbraw/zinc/80/72/94/338807294.db2.gz ZFYJWUYGFVYGLB-GXTWGEPZSA-N 1 2 315.417 4.142 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1ccc(OC)c(Br)c1)C(F)F ZINC000453231979 338811568 /nfs/dbraw/zinc/81/15/68/338811568.db2.gz FVTCPEPJLJAXLD-KCJUWKMLSA-N 1 2 322.193 4.152 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+][C@H](CC)C(F)F)cc1OCC ZINC000453246113 338813568 /nfs/dbraw/zinc/81/35/68/338813568.db2.gz MEMYVXYLEAACTN-DGCLKSJQSA-N 1 2 301.377 4.178 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2ncc(C(F)(F)F)cc21)C(C)(F)F ZINC000453293883 338819933 /nfs/dbraw/zinc/81/99/33/338819933.db2.gz PISVLGHVOGHTLK-QPUJVOFHSA-N 1 2 308.294 4.111 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C(F)(F)F)cn1)c1cccc(C2CC2)c1 ZINC000453301366 338821081 /nfs/dbraw/zinc/82/10/81/338821081.db2.gz BCQDHQKOUJKPST-NSHDSACASA-N 1 2 321.346 4.224 20 0 DIADLO C[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccccc1C(C)(C)C ZINC000453325808 338825248 /nfs/dbraw/zinc/82/52/48/338825248.db2.gz SEYJOSGDKHIWPQ-LBPRGKRZSA-N 1 2 305.853 4.222 20 0 DIADLO CC(C)[C@H]1CCN1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000454774837 338871672 /nfs/dbraw/zinc/87/16/72/338871672.db2.gz FGKMQUOFZDXBET-QGZVFWFLSA-N 1 2 311.385 4.136 20 0 DIADLO CCN(CCc1ccccc1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455473875 338895660 /nfs/dbraw/zinc/89/56/60/338895660.db2.gz KCFVXTKHABOVQQ-UHFFFAOYSA-N 1 2 311.429 4.103 20 0 DIADLO CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455492816 338896483 /nfs/dbraw/zinc/89/64/83/338896483.db2.gz LLPUCMYMPWRZJY-MLGOLLRUSA-N 1 2 303.450 4.439 20 0 DIADLO CC[C@H](C)n1ncc(NC(=O)Nc2c(C)cc(C)[nH+]c2C)c1C ZINC000455533914 338898107 /nfs/dbraw/zinc/89/81/07/338898107.db2.gz UNTFYVSSBYZZLI-LBPRGKRZSA-N 1 2 315.421 4.127 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000456363367 338927751 /nfs/dbraw/zinc/92/77/51/338927751.db2.gz UPRJUNKHGOKKEU-GDBMZVCRSA-N 1 2 305.466 4.077 20 0 DIADLO C[C@H]1C[C@@H](NC(=O)CC2CCC(C(C)(C)C)CC2)c2[nH+]ccn21 ZINC000456423762 338929557 /nfs/dbraw/zinc/92/95/57/338929557.db2.gz PBJCEPIZQWXTGF-SLTXQBBLSA-N 1 2 317.477 4.248 20 0 DIADLO CCC(C)(C)c1ccc(C(=O)N[C@H]2C[C@H](C)n3cc[nH+]c32)cc1 ZINC000456439142 338930030 /nfs/dbraw/zinc/93/00/30/338930030.db2.gz XYNOGLVHGULRJR-BBRMVZONSA-N 1 2 311.429 4.007 20 0 DIADLO Cc1cc(C)c(CNC(=O)CCc2ccc(C(C)C)cc2)c[nH+]1 ZINC000456839744 338943379 /nfs/dbraw/zinc/94/33/79/338943379.db2.gz DJTHMAUIBPBHJX-UHFFFAOYSA-N 1 2 310.441 4.071 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)C2CC(C(C)(C)C)C2)[nH+]1 ZINC000457682892 338974807 /nfs/dbraw/zinc/97/48/07/338974807.db2.gz WQHBAFXQMMEOIC-UHFFFAOYSA-N 1 2 311.429 4.396 20 0 DIADLO CC(C)CCCCC(=O)N1CCC(CCCn2cc[nH+]c2)CC1 ZINC000457702037 338975661 /nfs/dbraw/zinc/97/56/61/338975661.db2.gz DKJXPNSMQOWVJZ-UHFFFAOYSA-N 1 2 319.493 4.118 20 0 DIADLO CCCCCN(C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21)[C@H](C)CCC ZINC000459106225 339013805 /nfs/dbraw/zinc/01/38/05/339013805.db2.gz IVDXNBZQIWYTRM-BZUAXINKSA-N 1 2 320.481 4.279 20 0 DIADLO C[N@H+](Cc1cnc(C2CC2)nc1)Cc1cccc(Cl)c1Cl ZINC000459304850 339020491 /nfs/dbraw/zinc/02/04/91/339020491.db2.gz YWGHZXYDWRAFHK-UHFFFAOYSA-N 1 2 322.239 4.293 20 0 DIADLO C[N@@H+](Cc1cnc(C2CC2)nc1)Cc1cccc(Cl)c1Cl ZINC000459304850 339020492 /nfs/dbraw/zinc/02/04/92/339020492.db2.gz YWGHZXYDWRAFHK-UHFFFAOYSA-N 1 2 322.239 4.293 20 0 DIADLO Cc1cc(C[NH2+]Cc2ccc(OCc3cccc(C)c3)cc2)no1 ZINC000459368328 339025023 /nfs/dbraw/zinc/02/50/23/339025023.db2.gz FEMABZPPTUHMDG-UHFFFAOYSA-N 1 2 322.408 4.160 20 0 DIADLO C[C@@]1(NC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)CC=CCC1 ZINC000459396219 339026852 /nfs/dbraw/zinc/02/68/52/339026852.db2.gz BZKFRQISIJZGLC-LJQANCHMSA-N 1 2 323.396 4.494 20 0 DIADLO Cc1nc2scc(C3CC3)n2c1CNc1ccc(C)[nH+]c1C ZINC000459445456 339029667 /nfs/dbraw/zinc/02/96/67/339029667.db2.gz HFOXVPCZSFKPJO-UHFFFAOYSA-N 1 2 312.442 4.206 20 0 DIADLO CC(C)c1noc(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)n1 ZINC000459566579 339036146 /nfs/dbraw/zinc/03/61/46/339036146.db2.gz HKURUSHELUDRRE-QGZVFWFLSA-N 1 2 311.429 4.310 20 0 DIADLO CC(C)c1noc(C[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)n1 ZINC000459566579 339036147 /nfs/dbraw/zinc/03/61/47/339036147.db2.gz HKURUSHELUDRRE-QGZVFWFLSA-N 1 2 311.429 4.310 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)o1 ZINC000459567713 339036359 /nfs/dbraw/zinc/03/63/59/339036359.db2.gz AECNHWIYEGIPCR-PBHICJAKSA-N 1 2 311.429 4.310 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)o1 ZINC000459567713 339036360 /nfs/dbraw/zinc/03/63/60/339036360.db2.gz AECNHWIYEGIPCR-PBHICJAKSA-N 1 2 311.429 4.310 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)o1 ZINC000459573238 339036692 /nfs/dbraw/zinc/03/66/92/339036692.db2.gz IHFQLCBSMSOWDB-QGZVFWFLSA-N 1 2 311.429 4.310 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)o1 ZINC000459573238 339036693 /nfs/dbraw/zinc/03/66/93/339036693.db2.gz IHFQLCBSMSOWDB-QGZVFWFLSA-N 1 2 311.429 4.310 20 0 DIADLO C[C@@H]1CCc2nc(C[NH+]3CC(C)(CC(F)(F)F)C3)sc2C1 ZINC000459630910 339039378 /nfs/dbraw/zinc/03/93/78/339039378.db2.gz BLJIEODDWKIPPS-SNVBAGLBSA-N 1 2 318.408 4.042 20 0 DIADLO Cc1nc([C@@H](C)[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)no1 ZINC000459744837 339045758 /nfs/dbraw/zinc/04/57/58/339045758.db2.gz MKELKERVYMLGNF-PBHICJAKSA-N 1 2 311.429 4.446 20 0 DIADLO Cc1nc([C@@H](C)[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)no1 ZINC000459744837 339045759 /nfs/dbraw/zinc/04/57/59/339045759.db2.gz MKELKERVYMLGNF-PBHICJAKSA-N 1 2 311.429 4.446 20 0 DIADLO Cc1c(C(=O)Nc2cccc3[nH+]ccn32)oc2c1c(C)ccc2C ZINC000460333533 339055582 /nfs/dbraw/zinc/05/55/82/339055582.db2.gz WGXONFCWLQYVBL-UHFFFAOYSA-N 1 2 319.364 4.258 20 0 DIADLO CC[C@@H](CC(=O)Nc1cccc2[nH+]ccn21)c1ccc(C)cc1 ZINC000460338456 339055667 /nfs/dbraw/zinc/05/56/67/339055667.db2.gz IPBUFGBWUBVNHS-HNNXBMFYSA-N 1 2 307.397 4.165 20 0 DIADLO FC(F)(F)c1nn(C[C@@H]2C[C@H]2c2ccccc2)c2cc[nH+]cc21 ZINC000461041503 339058238 /nfs/dbraw/zinc/05/82/38/339058238.db2.gz HLXVPELKDUZZHC-STQMWFEESA-N 1 2 317.314 4.254 20 0 DIADLO Cc1cccn2cc(CNc3ccc(CC(F)(F)F)cc3)[nH+]c12 ZINC000462240110 339074885 /nfs/dbraw/zinc/07/48/85/339074885.db2.gz UUHLZMNZHIADHU-UHFFFAOYSA-N 1 2 319.330 4.360 20 0 DIADLO CCOc1ccc([C@@H](Nc2cc[nH+]c(C)n2)c2ccccc2)cc1 ZINC000462373153 339077255 /nfs/dbraw/zinc/07/72/55/339077255.db2.gz VHYYFXRIRQJOGC-FQEVSTJZSA-N 1 2 319.408 4.385 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccc(C)cc2OC(C)C)cs1 ZINC000462805907 339090308 /nfs/dbraw/zinc/09/03/08/339090308.db2.gz WBEXUUMJNKSBRZ-CYBMUJFWSA-N 1 2 304.459 4.398 20 0 DIADLO Cc1ccc2[nH+]c(CN[C@H](c3ccccc3)C(F)(F)F)cn2c1 ZINC000462810513 339090892 /nfs/dbraw/zinc/09/08/92/339090892.db2.gz DBDJLCDFNHLYFP-MRXNPFEDSA-N 1 2 319.330 4.036 20 0 DIADLO Oc1ccc2c(c1)[C@H](Nc1ccc(N3CCCCC3)c[nH+]1)CCC2 ZINC000462813976 339091343 /nfs/dbraw/zinc/09/13/43/339091343.db2.gz CHLGQPZITUWNPP-LJQANCHMSA-N 1 2 323.440 4.267 20 0 DIADLO COC1(CNc2ccc(-n3c[nH+]c(C)c3C)cc2)CCCCC1 ZINC000463026776 339101400 /nfs/dbraw/zinc/10/14/00/339101400.db2.gz ADZJLXPZDCQWPM-UHFFFAOYSA-N 1 2 313.445 4.250 20 0 DIADLO C[C@H](c1ccsc1)[NH+]1CCN(C(=O)CCCC(C)(C)C)CC1 ZINC000463032801 339101935 /nfs/dbraw/zinc/10/19/35/339101935.db2.gz IICNLLSOHHZGJL-OAHLLOKOSA-N 1 2 322.518 4.170 20 0 DIADLO CCCC(CCC)C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000463035681 339102188 /nfs/dbraw/zinc/10/21/88/339102188.db2.gz IVXFGDMMEOBVTR-HNNXBMFYSA-N 1 2 322.518 4.170 20 0 DIADLO CCC(CC)[C@H](C)C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000463039506 339102523 /nfs/dbraw/zinc/10/25/23/339102523.db2.gz BTWIEGPOKXKIFJ-GJZGRUSLSA-N 1 2 322.518 4.026 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@H](C)C3CCSCC3)cc2)c1C ZINC000463041239 339102619 /nfs/dbraw/zinc/10/26/19/339102619.db2.gz GSPQNSUSZHPBIY-CQSZACIVSA-N 1 2 315.486 4.433 20 0 DIADLO CC(C)(C)c1nc(C[NH+]2CC(c3ccccc3F)C2)cs1 ZINC000463044756 339102820 /nfs/dbraw/zinc/10/28/20/339102820.db2.gz SATVHQYEXAOOGX-UHFFFAOYSA-N 1 2 304.434 4.179 20 0 DIADLO CCC[C@]1(C)CCCN(c2cc(C)[nH+]c(-c3ccncc3)n2)C1 ZINC000463070044 339104025 /nfs/dbraw/zinc/10/40/25/339104025.db2.gz QTVLKMFOFQFNIF-LJQANCHMSA-N 1 2 310.445 4.254 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CCC(F)(F)[C@H](CO)C1 ZINC000463227466 339110433 /nfs/dbraw/zinc/11/04/33/339110433.db2.gz AXRDUUIUDZEZQW-KOLCDFICSA-N 1 2 324.198 4.004 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCC(F)(F)[C@H](CO)C1 ZINC000463227466 339110434 /nfs/dbraw/zinc/11/04/34/339110434.db2.gz AXRDUUIUDZEZQW-KOLCDFICSA-N 1 2 324.198 4.004 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@H](c3ccccc3)C(C)C)cc2[nH+]1 ZINC000463308237 339114439 /nfs/dbraw/zinc/11/44/39/339114439.db2.gz PZRZLQJKYKQZDS-SFHVURJKSA-N 1 2 307.397 4.250 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)[C@H](C)C(F)(F)F)cc2[nH+]1 ZINC000463501496 339119792 /nfs/dbraw/zinc/11/97/92/339119792.db2.gz BVMNBYRKPRKJOV-VIFPVBQESA-N 1 2 313.323 4.042 20 0 DIADLO CCc1ccc(-c2ccc(C(=O)Nc3cc[nH+]cc3CC)o2)cc1 ZINC000463830339 339126874 /nfs/dbraw/zinc/12/68/74/339126874.db2.gz YVUMJSRMYGLHSM-UHFFFAOYSA-N 1 2 320.392 4.141 20 0 DIADLO CC[C@@H](C)C[C@@H](C)NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000463912471 339128832 /nfs/dbraw/zinc/12/88/32/339128832.db2.gz AKAAIHVSPJKOHA-HUUCEWRRSA-N 1 2 312.413 4.428 20 0 DIADLO Fc1cccc(C=C2CCN(c3cc[nH+]c4ccncc43)CC2)c1 ZINC000464745098 339150884 /nfs/dbraw/zinc/15/08/84/339150884.db2.gz SZTUBUYWDPGUMM-UHFFFAOYSA-N 1 2 319.383 4.453 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nc(-c3ccccc3)no2)[C@H](c2ccco2)C1 ZINC000464854257 339158158 /nfs/dbraw/zinc/15/81/58/339158158.db2.gz OENDRKBKKUYXAM-HOCLYGCPSA-N 1 2 323.396 4.303 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nc(-c3ccccc3)no2)[C@H](c2ccco2)C1 ZINC000464854257 339158159 /nfs/dbraw/zinc/15/81/59/339158159.db2.gz OENDRKBKKUYXAM-HOCLYGCPSA-N 1 2 323.396 4.303 20 0 DIADLO CSCCC[N@@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000464865429 339158991 /nfs/dbraw/zinc/15/89/91/339158991.db2.gz GGZQFRLJNDQUBZ-CQSZACIVSA-N 1 2 320.285 4.120 20 0 DIADLO CSCCC[N@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000464865429 339158992 /nfs/dbraw/zinc/15/89/92/339158992.db2.gz GGZQFRLJNDQUBZ-CQSZACIVSA-N 1 2 320.285 4.120 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1cc(F)cc(Cl)c1 ZINC000464987532 339164611 /nfs/dbraw/zinc/16/46/11/339164611.db2.gz UPNOBGMRJPTLAN-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO Cc1cc(NC[C@]2(C)CCO[C@@H]2C2CC2)c2cccc(F)c2[nH+]1 ZINC000466630781 339210989 /nfs/dbraw/zinc/21/09/89/339210989.db2.gz KMIXRWIIRNVZTR-MOPGFXCFSA-N 1 2 314.404 4.299 20 0 DIADLO Cc1cc(NC[C@]2(C)CCO[C@H]2C2CC2)c2cccc(F)c2[nH+]1 ZINC000466630782 339211046 /nfs/dbraw/zinc/21/10/46/339211046.db2.gz KMIXRWIIRNVZTR-OALUTQOASA-N 1 2 314.404 4.299 20 0 DIADLO c1ccc(-c2ccc[nH+]c2NCc2cccc3c2OCCO3)cc1 ZINC000466634740 339211195 /nfs/dbraw/zinc/21/11/95/339211195.db2.gz LDXYQWXVNBOBIS-UHFFFAOYSA-N 1 2 318.376 4.132 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1ccn(-c2ccc(Cl)cc2)n1 ZINC000466839789 339218799 /nfs/dbraw/zinc/21/87/99/339218799.db2.gz CYQSSOXVPMMACC-CYBMUJFWSA-N 1 2 315.804 4.312 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1ccn(-c2ccc(Cl)cc2)n1 ZINC000466839789 339218800 /nfs/dbraw/zinc/21/88/00/339218800.db2.gz CYQSSOXVPMMACC-CYBMUJFWSA-N 1 2 315.804 4.312 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+]1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000467180124 339227394 /nfs/dbraw/zinc/22/73/94/339227394.db2.gz JEJWSOBACMJQCB-KSSFIOAISA-N 1 2 301.817 4.475 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+]1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000467180124 339227395 /nfs/dbraw/zinc/22/73/95/339227395.db2.gz JEJWSOBACMJQCB-KSSFIOAISA-N 1 2 301.817 4.475 20 0 DIADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@@H](Nc2cn(C)nc2C(C)C)C1 ZINC000467365398 339234313 /nfs/dbraw/zinc/23/43/13/339234313.db2.gz PRMGSJOMMGCKBN-HZPDHXFCSA-N 1 2 312.461 4.385 20 0 DIADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@H](Nc2cccc3c2CCO3)C1 ZINC000467374893 339235151 /nfs/dbraw/zinc/23/51/51/339235151.db2.gz BYKDTZRILXICEH-CVEARBPZSA-N 1 2 308.425 4.463 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cccc3c2CCC3)[nH+]1 ZINC000467456835 339239739 /nfs/dbraw/zinc/23/97/39/339239739.db2.gz IYHSQHYZPCIJIS-UHFFFAOYSA-N 1 2 317.392 4.126 20 0 DIADLO Cc1cc(COc2cccc(-n3cc[nH+]c3)c2)c2ccccc2n1 ZINC000467798490 339246828 /nfs/dbraw/zinc/24/68/28/339246828.db2.gz MKQOIQQCNMEZGD-UHFFFAOYSA-N 1 2 315.376 4.308 20 0 DIADLO Clc1ccccc1CC[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000468135744 339255103 /nfs/dbraw/zinc/25/51/03/339255103.db2.gz GIHZEEIEJKUHLO-INIZCTEOSA-N 1 2 307.846 4.018 20 0 DIADLO Clc1ccccc1CC[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000468135744 339255104 /nfs/dbraw/zinc/25/51/04/339255104.db2.gz GIHZEEIEJKUHLO-INIZCTEOSA-N 1 2 307.846 4.018 20 0 DIADLO Clc1ccccc1CC[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000468135745 339255193 /nfs/dbraw/zinc/25/51/93/339255193.db2.gz GIHZEEIEJKUHLO-MRXNPFEDSA-N 1 2 307.846 4.018 20 0 DIADLO Clc1ccccc1CC[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000468135745 339255194 /nfs/dbraw/zinc/25/51/94/339255194.db2.gz GIHZEEIEJKUHLO-MRXNPFEDSA-N 1 2 307.846 4.018 20 0 DIADLO O=C(Nc1ccc2c(c1)[nH+]c1n2CCCCC1)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000468246497 339257505 /nfs/dbraw/zinc/25/75/05/339257505.db2.gz YGGGJGVAPAEZGE-QWHZDKJVSA-N 1 2 323.440 4.137 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000468408894 339262178 /nfs/dbraw/zinc/26/21/78/339262178.db2.gz QIWGTYCOBMMZKE-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000468408894 339262179 /nfs/dbraw/zinc/26/21/79/339262179.db2.gz QIWGTYCOBMMZKE-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(N2CCC[C@@H](CC(C)C)C2)nc(-c2ccncc2)[nH+]1 ZINC000468844270 339272481 /nfs/dbraw/zinc/27/24/81/339272481.db2.gz GLGSYVHGMSXQTP-INIZCTEOSA-N 1 2 310.445 4.110 20 0 DIADLO COc1ccc(CC[C@H](C)[NH2+][C@@H](C(C)C)C(F)(F)F)cc1 ZINC000468984061 339276768 /nfs/dbraw/zinc/27/67/68/339276768.db2.gz MFDZZBWOSVJTRZ-WFASDCNBSA-N 1 2 303.368 4.193 20 0 DIADLO CC1(C)C(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)C1(C)C ZINC000469071241 339279225 /nfs/dbraw/zinc/27/92/25/339279225.db2.gz VISFGCWXRQNYHJ-UHFFFAOYSA-N 1 2 310.397 4.495 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1csc(Cl)c1 ZINC000469234655 339283762 /nfs/dbraw/zinc/28/37/62/339283762.db2.gz YIUSMUHGJMXEAE-GFCCVEGCSA-N 1 2 317.845 4.438 20 0 DIADLO COc1cccc2c(NCc3ccc(Cl)cn3)c(C)c[nH+]c12 ZINC000469339498 339286443 /nfs/dbraw/zinc/28/64/43/339286443.db2.gz MXGNXRDOZGNJRV-UHFFFAOYSA-N 1 2 313.788 4.212 20 0 DIADLO Fc1cc(Cl)cc(CNc2[nH+]cccc2OC(F)F)c1 ZINC000469470992 339290747 /nfs/dbraw/zinc/29/07/47/339290747.db2.gz RYHCLTGZWABDQM-UHFFFAOYSA-N 1 2 302.683 4.088 20 0 DIADLO Fc1cc(CNc2[nH+]cccc2OC(F)F)ccc1Cl ZINC000469473029 339290806 /nfs/dbraw/zinc/29/08/06/339290806.db2.gz UMPLXEHDGMUYKV-UHFFFAOYSA-N 1 2 302.683 4.088 20 0 DIADLO Fc1ccc(-c2c[nH]c(SCc3c[nH+]c4ccccn34)n2)cc1 ZINC000469808778 339301511 /nfs/dbraw/zinc/30/15/11/339301511.db2.gz RBZCOAKNIPTCLL-UHFFFAOYSA-N 1 2 324.384 4.156 20 0 DIADLO CC1(C)OCc2cc(CNc3c[nH+]c4c(c3)CCCC4)ccc2O1 ZINC000470296843 339316546 /nfs/dbraw/zinc/31/65/46/339316546.db2.gz FXSNOKVECLVYTK-UHFFFAOYSA-N 1 2 324.424 4.218 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000470944822 339332149 /nfs/dbraw/zinc/33/21/49/339332149.db2.gz LKNJGUCXMNWZAP-ONGXEEELSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000470944822 339332150 /nfs/dbraw/zinc/33/21/50/339332150.db2.gz LKNJGUCXMNWZAP-ONGXEEELSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000470953594 339332578 /nfs/dbraw/zinc/33/25/78/339332578.db2.gz QNJAUGZJHSPYPG-AXFHLTTASA-N 1 2 304.356 4.306 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000470953594 339332579 /nfs/dbraw/zinc/33/25/79/339332579.db2.gz QNJAUGZJHSPYPG-AXFHLTTASA-N 1 2 304.356 4.306 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1csc(-c2ccoc2)n1 ZINC000470954387 339332718 /nfs/dbraw/zinc/33/27/18/339332718.db2.gz YQNHZUYFSMYXEA-JOYOIKCWSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1csc(-c2ccoc2)n1 ZINC000470954387 339332719 /nfs/dbraw/zinc/33/27/19/339332719.db2.gz YQNHZUYFSMYXEA-JOYOIKCWSA-N 1 2 316.348 4.176 20 0 DIADLO CSc1ccccc1C[N@H+](C)[C@H](C)c1nc(C(C)(C)C)no1 ZINC000471022848 339334727 /nfs/dbraw/zinc/33/47/27/339334727.db2.gz QKDTWSDKRWCLLO-GFCCVEGCSA-N 1 2 319.474 4.282 20 0 DIADLO CSc1ccccc1C[N@@H+](C)[C@H](C)c1nc(C(C)(C)C)no1 ZINC000471022848 339334728 /nfs/dbraw/zinc/33/47/28/339334728.db2.gz QKDTWSDKRWCLLO-GFCCVEGCSA-N 1 2 319.474 4.282 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000471181940 339339691 /nfs/dbraw/zinc/33/96/91/339339691.db2.gz OYAWAZWLQNXEED-MRXNPFEDSA-N 1 2 309.388 4.142 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000471181940 339339692 /nfs/dbraw/zinc/33/96/92/339339692.db2.gz OYAWAZWLQNXEED-MRXNPFEDSA-N 1 2 309.388 4.142 20 0 DIADLO Cc1cc(Cl)ccc1NC(=O)C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000471187328 339339854 /nfs/dbraw/zinc/33/98/54/339339854.db2.gz PNDCNWOVUYVYMW-QGZVFWFLSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1cc(Cl)ccc1NC(=O)C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000471187328 339339855 /nfs/dbraw/zinc/33/98/55/339339855.db2.gz PNDCNWOVUYVYMW-QGZVFWFLSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1cccn2cc(-c3ccc(NC(=O)C4=CCCC4)cc3)[nH+]c12 ZINC000471205185 339340055 /nfs/dbraw/zinc/34/00/55/339340055.db2.gz RZQQUNIPQGSNCF-UHFFFAOYSA-N 1 2 317.392 4.359 20 0 DIADLO Clc1cnccc1C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000471699741 339351439 /nfs/dbraw/zinc/35/14/39/339351439.db2.gz CDCSFDSEKFUQIY-SFHVURJKSA-N 1 2 309.800 4.009 20 0 DIADLO COc1cccc(C=C2CCN(c3cc[nH+]c(C(C)C)n3)CC2)c1 ZINC000471743335 339352870 /nfs/dbraw/zinc/35/28/70/339352870.db2.gz CWJWSEYLBUTXST-UHFFFAOYSA-N 1 2 323.440 4.292 20 0 DIADLO Cc1cc(C(=O)Nc2c(C)cc(C)[nH+]c2C)c(C(F)(F)F)o1 ZINC000471788240 339353967 /nfs/dbraw/zinc/35/39/67/339353967.db2.gz NUGSKTWMQWFDCA-UHFFFAOYSA-N 1 2 312.291 4.179 20 0 DIADLO C[NH+](C)[C@@H](c1nc(C2CCCC2)no1)c1cccc(Cl)c1 ZINC000504286769 339358595 /nfs/dbraw/zinc/35/85/95/339358595.db2.gz UOQAUSSPXMYFIZ-CQSZACIVSA-N 1 2 305.809 4.032 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cc4c(ccc(C)c4C)[nH]3)CCCC2)no1 ZINC000472065057 339361859 /nfs/dbraw/zinc/36/18/59/339361859.db2.gz WAVJDLVXOJNAQY-UHFFFAOYSA-N 1 2 324.428 4.035 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2noc(C(C)C)n2)CC[C@H]1c1ccccc1 ZINC000472247738 339367625 /nfs/dbraw/zinc/36/76/25/339367625.db2.gz SRIOKZDLPZZKAM-NVXWUHKLSA-N 1 2 313.445 4.209 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2noc(C(C)C)n2)CC[C@H]1c1ccccc1 ZINC000472247738 339367626 /nfs/dbraw/zinc/36/76/26/339367626.db2.gz SRIOKZDLPZZKAM-NVXWUHKLSA-N 1 2 313.445 4.209 20 0 DIADLO CC[C@H]1C[N@H+](Cc2noc(C(C)C)n2)CC[C@H]1c1ccccc1 ZINC000472247737 339367637 /nfs/dbraw/zinc/36/76/37/339367637.db2.gz SRIOKZDLPZZKAM-DOTOQJQBSA-N 1 2 313.445 4.209 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2noc(C(C)C)n2)CC[C@H]1c1ccccc1 ZINC000472247737 339367638 /nfs/dbraw/zinc/36/76/38/339367638.db2.gz SRIOKZDLPZZKAM-DOTOQJQBSA-N 1 2 313.445 4.209 20 0 DIADLO CCCCc1noc(C[N@@H+]2CC[C@H](C)[C@@H]2c2cccc(F)c2)n1 ZINC000472312448 339369624 /nfs/dbraw/zinc/36/96/24/339369624.db2.gz DTXQMAQINVGADI-SCLBCKFNSA-N 1 2 317.408 4.134 20 0 DIADLO CCCCc1noc(C[N@H+]2CC[C@H](C)[C@@H]2c2cccc(F)c2)n1 ZINC000472312448 339369625 /nfs/dbraw/zinc/36/96/25/339369625.db2.gz DTXQMAQINVGADI-SCLBCKFNSA-N 1 2 317.408 4.134 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cn3ccsc3n2)[C@@H]1c1cccc(F)c1 ZINC000472353384 339370622 /nfs/dbraw/zinc/37/06/22/339370622.db2.gz RNGLSWDFNWDFJI-LRDDRELGSA-N 1 2 315.417 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cn3ccsc3n2)[C@@H]1c1cccc(F)c1 ZINC000472353384 339370623 /nfs/dbraw/zinc/37/06/23/339370623.db2.gz RNGLSWDFNWDFJI-LRDDRELGSA-N 1 2 315.417 4.118 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCSC[C@@H]2c2nccs2)c(C)c1 ZINC000473075696 339380985 /nfs/dbraw/zinc/38/09/85/339380985.db2.gz NKWKYJLTDVLTBM-MRXNPFEDSA-N 1 2 318.511 4.358 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCSC[C@@H]2c2nccs2)c(C)c1 ZINC000473075696 339380986 /nfs/dbraw/zinc/38/09/86/339380986.db2.gz NKWKYJLTDVLTBM-MRXNPFEDSA-N 1 2 318.511 4.358 20 0 DIADLO Clc1cnc(C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)s1 ZINC000473119504 339381349 /nfs/dbraw/zinc/38/13/49/339381349.db2.gz CLQFCBCRAKEAMN-QIAWRQBBSA-N 1 2 304.846 4.474 20 0 DIADLO Clc1cnc(C[N@H+]2CCC[C@@H]2/C=C\c2ccccc2)s1 ZINC000473119504 339381350 /nfs/dbraw/zinc/38/13/50/339381350.db2.gz CLQFCBCRAKEAMN-QIAWRQBBSA-N 1 2 304.846 4.474 20 0 DIADLO CC[N@H+](Cc1ncc(Cl)s1)[C@@H](C)c1cccc(OC)c1 ZINC000473130688 339381688 /nfs/dbraw/zinc/38/16/88/339381688.db2.gz CSBKLPIWDHETIQ-NSHDSACASA-N 1 2 310.850 4.388 20 0 DIADLO CC[N@@H+](Cc1ncc(Cl)s1)[C@@H](C)c1cccc(OC)c1 ZINC000473130688 339381689 /nfs/dbraw/zinc/38/16/89/339381689.db2.gz CSBKLPIWDHETIQ-NSHDSACASA-N 1 2 310.850 4.388 20 0 DIADLO CCc1[nH+]c(C)ccc1OCc1ncc(-c2ccc(OC)cc2)o1 ZINC000473678020 339390169 /nfs/dbraw/zinc/39/01/69/339390169.db2.gz DHRVAMASPZGBSE-UHFFFAOYSA-N 1 2 324.380 4.195 20 0 DIADLO CCC[C@H](CC1CCCCC1)C(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000473871929 339393860 /nfs/dbraw/zinc/39/38/60/339393860.db2.gz CIQZUFIFDSRGTA-SJLPKXTDSA-N 1 2 319.493 4.022 20 0 DIADLO CCC[C@@H](CC1CCCCC1)C(=O)NC[C@@H](C)Cn1cc[nH+]c1 ZINC000473871927 339393941 /nfs/dbraw/zinc/39/39/41/339393941.db2.gz CIQZUFIFDSRGTA-AEFFLSMTSA-N 1 2 319.493 4.022 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1nc2c(cccc2C)[nH]1 ZINC000473986603 339396272 /nfs/dbraw/zinc/39/62/72/339396272.db2.gz JRUCYOKGXZNQQX-UHFFFAOYSA-N 1 2 313.832 4.377 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1nc2cccc(C)c2[nH]1 ZINC000473986603 339396273 /nfs/dbraw/zinc/39/62/73/339396273.db2.gz JRUCYOKGXZNQQX-UHFFFAOYSA-N 1 2 313.832 4.377 20 0 DIADLO C[C@H](Nc1cccc(-n2cc[nH+]c2)c1)C1CCC(F)(F)CC1 ZINC000474054985 339399563 /nfs/dbraw/zinc/39/95/63/339399563.db2.gz GCOWKYSBMHEIBN-ZDUSSCGKSA-N 1 2 305.372 4.498 20 0 DIADLO Cc1ccc(CCCNc2ccccc2OCC(F)(F)F)c[nH+]1 ZINC000474381753 339411751 /nfs/dbraw/zinc/41/17/51/339411751.db2.gz YZXQMNPQJNMYKY-UHFFFAOYSA-N 1 2 324.346 4.376 20 0 DIADLO Cc1nc(N2CC[C@H](c3ccc(Cl)cc3)C2)c(C)c(C)[nH+]1 ZINC000474779487 339425723 /nfs/dbraw/zinc/42/57/23/339425723.db2.gz IUXIXJUUJFLGNB-HNNXBMFYSA-N 1 2 301.821 4.049 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@H](C)c2cc3cccc(F)c3o2)n1 ZINC000475716021 339460201 /nfs/dbraw/zinc/46/02/01/339460201.db2.gz NZVMYBAYRRGSLT-GFCCVEGCSA-N 1 2 301.365 4.200 20 0 DIADLO CC(C)[C@]1(C)C[C@@H]1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000476385094 339475756 /nfs/dbraw/zinc/47/57/56/339475756.db2.gz HCXMZDIBCCEQFZ-MJGOQNOKSA-N 1 2 310.397 4.495 20 0 DIADLO Clc1ccc(N2CC[C@H](Nc3cccc[nH+]3)C2)cc1Cl ZINC000477136225 339487721 /nfs/dbraw/zinc/48/77/21/339487721.db2.gz KKROLZORHJGKSK-NSHDSACASA-N 1 2 308.212 4.079 20 0 DIADLO CCCCC1CCC(C(=O)N[C@@H](c2[nH]cc[nH+]2)C(C)C)CC1 ZINC000477176363 339488611 /nfs/dbraw/zinc/48/86/11/339488611.db2.gz KVXJRDTXNBAECK-UYSNPLJNSA-N 1 2 305.466 4.220 20 0 DIADLO CCc1cc(C)c(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)o1 ZINC000477994305 339506825 /nfs/dbraw/zinc/50/68/25/339506825.db2.gz CNRNTPKZTBKMFO-UHFFFAOYSA-N 1 2 309.369 4.101 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cccc2c1CCC2 ZINC000478000233 339506934 /nfs/dbraw/zinc/50/69/34/339506934.db2.gz KQFHNOVMKYXGKW-UHFFFAOYSA-N 1 2 317.392 4.126 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1nc2c(s1)CCC2 ZINC000479295739 339530697 /nfs/dbraw/zinc/53/06/97/339530697.db2.gz LWDFRQVILVMGMP-JTQLQIEISA-N 1 2 322.861 4.145 20 0 DIADLO Cc1cccc(C(=O)N(Cc2[nH]cc[nH+]2)c2cccc(F)c2)c1C ZINC000479401169 339533243 /nfs/dbraw/zinc/53/32/43/339533243.db2.gz VSEWZBHYAWMSCN-UHFFFAOYSA-N 1 2 323.371 4.013 20 0 DIADLO CCOC[C@@H]1CCC[C@@H]1Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000479428198 339534675 /nfs/dbraw/zinc/53/46/75/339534675.db2.gz UHNKVDISCQVZMT-BBRMVZONSA-N 1 2 319.836 4.143 20 0 DIADLO Cn1cc2c(n1)CCC[C@H]2Nc1cccc([NH+]2CCCCCC2)c1 ZINC000479432711 339534870 /nfs/dbraw/zinc/53/48/70/339534870.db2.gz RZRSURUGNPVYQI-LJQANCHMSA-N 1 2 324.472 4.290 20 0 DIADLO CC(C)=CC[NH2+][C@@H](c1nc(-c2ccccc2)no1)c1ccccc1 ZINC000479466480 339536696 /nfs/dbraw/zinc/53/66/96/339536696.db2.gz UXYRJHOBHVOJHR-GOSISDBHSA-N 1 2 319.408 4.382 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1ccc2ncsc2c1)C(=O)OC(C)(C)C ZINC000479486615 339537618 /nfs/dbraw/zinc/53/76/18/339537618.db2.gz BWYXVXWPRZLKOG-AAEUAGOBSA-N 1 2 320.458 4.067 20 0 DIADLO Cc1cc(N2CCC[C@H](C(F)(F)F)[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000480291206 339567400 /nfs/dbraw/zinc/56/74/00/339567400.db2.gz LQEHTGLGVBXBDT-RYUDHWBXSA-N 1 2 301.356 4.076 20 0 DIADLO CC(C)[C@@H]1N(C(=O)c2ccccc2Oc2cc[nH+]cc2)CC1(C)C ZINC000480379566 339571353 /nfs/dbraw/zinc/57/13/53/339571353.db2.gz VQPAPPNMYUTGIW-SFHVURJKSA-N 1 2 324.424 4.381 20 0 DIADLO Cc1cc(N[C@@H](c2ccccc2)C(C)C)nc(-c2ccncc2)[nH+]1 ZINC000480402128 339572329 /nfs/dbraw/zinc/57/23/29/339572329.db2.gz IATQGPRVKVSEJN-LJQANCHMSA-N 1 2 318.424 4.078 20 0 DIADLO Cc1cc(N2CCC[C@H](C(C)(C)C)C2)nc(-c2ccncc2)[nH+]1 ZINC000481068339 339594819 /nfs/dbraw/zinc/59/48/19/339594819.db2.gz FXNWTJFAIQPORS-INIZCTEOSA-N 1 2 310.445 4.110 20 0 DIADLO Cc1[nH+]c2ccccc2n1C[C@@H](O)Cc1ccc2ccccc2c1 ZINC000481718069 339610910 /nfs/dbraw/zinc/61/09/10/339610910.db2.gz LZVXCZVBRVACOJ-IBGZPJMESA-N 1 2 316.404 4.102 20 0 DIADLO CCC[C@H](C(=O)Nc1nc(C[NH+]2CCCCC2)cs1)C(C)C ZINC000481947769 339617820 /nfs/dbraw/zinc/61/78/20/339617820.db2.gz SJWTWCCGPAPLMW-HNNXBMFYSA-N 1 2 323.506 4.140 20 0 DIADLO CCc1cccc(C[NH2+][C@@H](CO)c2c(Cl)cccc2Cl)c1 ZINC000483239588 339657383 /nfs/dbraw/zinc/65/73/83/339657383.db2.gz GBXXOCNVGISIKY-INIZCTEOSA-N 1 2 324.251 4.379 20 0 DIADLO CCCCCN(C(=O)c1ccc2[nH+]ccn2c1)[C@H](C)CCC ZINC000483328967 339661784 /nfs/dbraw/zinc/66/17/84/339661784.db2.gz YFJIPCNIAOPNDZ-OAHLLOKOSA-N 1 2 301.434 4.155 20 0 DIADLO CCc1ccc(C(C)(C)NC(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000485608064 339707229 /nfs/dbraw/zinc/70/72/29/339707229.db2.gz SOMFRQCMLUWMRK-UHFFFAOYSA-N 1 2 311.429 4.318 20 0 DIADLO Cc1cc(C(=O)Nc2c3ccccc3[nH+]c(C)c2C(C)C)co1 ZINC000485662471 339708509 /nfs/dbraw/zinc/70/85/09/339708509.db2.gz OOWKYZFZMZKYCF-UHFFFAOYSA-N 1 2 308.381 4.242 20 0 DIADLO Fc1cccc(F)c1C1CC[NH+](Cc2ccncc2Cl)CC1 ZINC000485872297 339715203 /nfs/dbraw/zinc/71/52/03/339715203.db2.gz IMIJZVBIMDDRDF-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO c1coc(-c2ncc(CNc3c[nH+]c4c(c3)CCCC4)s2)c1 ZINC000485949010 339716881 /nfs/dbraw/zinc/71/68/81/339716881.db2.gz FLIKAWZVPBIFBO-UHFFFAOYSA-N 1 2 311.410 4.289 20 0 DIADLO COC[C@H](Nc1[nH+]c2ccccc2n1C)c1ccc(Cl)cc1 ZINC000486012647 339718564 /nfs/dbraw/zinc/71/85/64/339718564.db2.gz XVANVSDQMYCTJQ-HNNXBMFYSA-N 1 2 315.804 4.026 20 0 DIADLO COC[C@H](c1ccc(Cl)cc1)N(C)c1cc[nH+]c(C(C)C)n1 ZINC000486502755 339728518 /nfs/dbraw/zinc/72/85/18/339728518.db2.gz AKZMIPBWGJXDFI-OAHLLOKOSA-N 1 2 319.836 4.077 20 0 DIADLO Fc1cc(Cl)c(Cl)cc1NCc1cn2ccccc2[nH+]1 ZINC000486749772 339733214 /nfs/dbraw/zinc/73/32/14/339733214.db2.gz SKUIHWGQZPJQGL-UHFFFAOYSA-N 1 2 310.159 4.392 20 0 DIADLO COc1ccccc1[C@H]([NH2+]C/C=C/c1ccncc1)c1ccco1 ZINC000487326797 339751361 /nfs/dbraw/zinc/75/13/61/339751361.db2.gz SHNGCGODMUXQEA-XXIDSNJLSA-N 1 2 320.392 4.076 20 0 DIADLO Cc1cccc2[nH+]c(CNc3ccc(C(=O)C(C)(C)C)cc3)cn21 ZINC000487362193 339752088 /nfs/dbraw/zinc/75/20/88/339752088.db2.gz IIVJQUMUIVXCMN-UHFFFAOYSA-N 1 2 321.424 4.484 20 0 DIADLO C[C@H](CF)[NH2+][C@@H](C(=O)c1c[nH]c2ccccc12)c1ccccc1 ZINC000487855045 339764213 /nfs/dbraw/zinc/76/42/13/339764213.db2.gz LDCABVJZVDUZKR-FZKQIMNGSA-N 1 2 310.372 4.040 20 0 DIADLO CCc1cc(N2CC3(CCC3)[C@@H]2C(C)C)nc(-c2ccncc2)[nH+]1 ZINC000488492472 339785359 /nfs/dbraw/zinc/78/53/59/339785359.db2.gz FSJLJNQATIBDPI-SFHVURJKSA-N 1 2 322.456 4.116 20 0 DIADLO CSC[C@@H]1CCCN(c2cc(C(C)C)[nH+]c(C(C)C)n2)C1 ZINC000488925389 339796964 /nfs/dbraw/zinc/79/69/64/339796964.db2.gz KDPHUNOFRDZYJV-CQSZACIVSA-N 1 2 307.507 4.303 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC[C@@H](CSC)C1 ZINC000488986381 339799203 /nfs/dbraw/zinc/79/92/03/339799203.db2.gz RYYLKPVHNNMSRC-CQSZACIVSA-N 1 2 316.470 4.131 20 0 DIADLO CC(C)CN(Cc1[nH+]ccn1CC(F)(F)F)c1ccccc1 ZINC000489577260 339813271 /nfs/dbraw/zinc/81/32/71/339813271.db2.gz LMJJPSQIXATQPD-UHFFFAOYSA-N 1 2 311.351 4.108 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C/c2ccc3[nH]ccc3c2)c(C)[nH+]1 ZINC000492279594 339896306 /nfs/dbraw/zinc/89/63/06/339896306.db2.gz SSRPYUUZQYOCDQ-FNORWQNLSA-N 1 2 305.381 4.140 20 0 DIADLO CCCc1csc(C[NH2+][C@@H](c2ccccc2)c2cccnc2)n1 ZINC000494330423 339946799 /nfs/dbraw/zinc/94/67/99/339946799.db2.gz NZPJFZOGDCODML-IBGZPJMESA-N 1 2 323.465 4.370 20 0 DIADLO CCCc1csc(C[NH2+][C@H](COCC(C)C)c2ccco2)n1 ZINC000494331339 339946837 /nfs/dbraw/zinc/94/68/37/339946837.db2.gz QHKCKFLCYDHQMK-OAHLLOKOSA-N 1 2 322.474 4.192 20 0 DIADLO CCCc1csc(C[NH2+]C2(c3nc(C)cs3)CCC2)n1 ZINC000494364053 339947531 /nfs/dbraw/zinc/94/75/31/339947531.db2.gz DEVXKHUIFOKDMR-UHFFFAOYSA-N 1 2 307.488 4.030 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(C(F)F)n1)c1cc(Cl)ccc1Cl ZINC000494417219 339948670 /nfs/dbraw/zinc/94/86/70/339948670.db2.gz LJZGCPXFCDCHSY-MRVPVSSYSA-N 1 2 320.170 4.436 20 0 DIADLO C[C@H]1CCCC[C@@H]1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000494697325 339957901 /nfs/dbraw/zinc/95/79/01/339957901.db2.gz PAFITDSOHPCPIO-KSSFIOAISA-N 1 2 310.397 4.182 20 0 DIADLO CCN(CC)c1ccc(N[C@H](c2ccc(F)cn2)C(C)C)c[nH+]1 ZINC000498754502 340022668 /nfs/dbraw/zinc/02/26/68/340022668.db2.gz JFRTZWWIGLYZHE-SFHVURJKSA-N 1 2 316.424 4.271 20 0 DIADLO Cc1cc(N(C)[C@H](C)c2ccc(F)cc2)nc(-c2ccncc2)[nH+]1 ZINC000498825897 340024060 /nfs/dbraw/zinc/02/40/60/340024060.db2.gz VHRPFPZHWJBSEM-CQSZACIVSA-N 1 2 322.387 4.184 20 0 DIADLO c1ccc2c(c1)CCC[N@@H+](Cc1noc(C3CCCCC3)n1)C2 ZINC000498915053 340025758 /nfs/dbraw/zinc/02/57/58/340025758.db2.gz KXUWONRYECEXHN-UHFFFAOYSA-N 1 2 311.429 4.066 20 0 DIADLO c1ccc2c(c1)CCC[N@H+](Cc1noc(C3CCCCC3)n1)C2 ZINC000498915053 340025759 /nfs/dbraw/zinc/02/57/59/340025759.db2.gz KXUWONRYECEXHN-UHFFFAOYSA-N 1 2 311.429 4.066 20 0 DIADLO C[C@@H]([NH2+][C@@H](CO)c1cccc(Cl)c1F)c1ccccc1F ZINC000499946438 340047402 /nfs/dbraw/zinc/04/74/02/340047402.db2.gz LXLHBUVMPRHLSH-BMIGLBTASA-N 1 2 311.759 4.002 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@@H+]1Cc1ccc(Cl)cc1Cl ZINC000500385204 340056227 /nfs/dbraw/zinc/05/62/27/340056227.db2.gz QUXBAWBJABANKI-INIZCTEOSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@H+]1Cc1ccc(Cl)cc1Cl ZINC000500385204 340056228 /nfs/dbraw/zinc/05/62/28/340056228.db2.gz QUXBAWBJABANKI-INIZCTEOSA-N 1 2 324.255 4.454 20 0 DIADLO CCc1nc(C[NH2+][C@]2(c3ccc(Cl)cc3)C[C@H]2C)cs1 ZINC000500417582 340057606 /nfs/dbraw/zinc/05/76/06/340057606.db2.gz TZEZEKZHJLHVBS-BDJLRTHQSA-N 1 2 306.862 4.384 20 0 DIADLO CC(C)OC[C@@H](C)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000500437656 340058657 /nfs/dbraw/zinc/05/86/57/340058657.db2.gz DMRSQATYNYPPDM-OAHLLOKOSA-N 1 2 313.445 4.112 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CCCc1ccc(C(C)(C)C)cc1 ZINC000501223640 340076671 /nfs/dbraw/zinc/07/66/71/340076671.db2.gz GUGUCUPQOTVBQX-UHFFFAOYSA-N 1 2 310.441 4.071 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1 ZINC000501628076 340085351 /nfs/dbraw/zinc/08/53/51/340085351.db2.gz OXVBFRKHXLNRKT-LBPRGKRZSA-N 1 2 320.795 4.111 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1 ZINC000501628076 340085352 /nfs/dbraw/zinc/08/53/52/340085352.db2.gz OXVBFRKHXLNRKT-LBPRGKRZSA-N 1 2 320.795 4.111 20 0 DIADLO Clc1cccc(C[N@@H+]2CCc3c(cnn3-c3ccccc3)C2)c1 ZINC000502000189 340092461 /nfs/dbraw/zinc/09/24/61/340092461.db2.gz KRTWUFMZZVDUNP-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1cccc(C[N@H+]2CCc3c(cnn3-c3ccccc3)C2)c1 ZINC000502000189 340092462 /nfs/dbraw/zinc/09/24/62/340092462.db2.gz KRTWUFMZZVDUNP-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1cccc(F)c1F ZINC000502010817 340092844 /nfs/dbraw/zinc/09/28/44/340092844.db2.gz ACYAXVQPTNDQHI-ZJUUUORDSA-N 1 2 308.397 4.322 20 0 DIADLO CC[C@H]1C[C@]1([NH2+]Cc1nc(-c2ccoc2)no1)c1cccc(C)c1 ZINC000502483732 340105714 /nfs/dbraw/zinc/10/57/14/340105714.db2.gz JTIUTCZSGKRRDY-HNAYVOBHSA-N 1 2 323.396 4.053 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nc(C2CCCC2)no1)c1ccc(F)cc1 ZINC000502536324 340107251 /nfs/dbraw/zinc/10/72/51/340107251.db2.gz UVFWPESHBMEBRP-KRWDZBQOSA-N 1 2 317.408 4.353 20 0 DIADLO CCCCc1nc(C[NH2+][C@@]2(c3cccc(C)c3)C[C@@H]2CC)no1 ZINC000502552500 340107643 /nfs/dbraw/zinc/10/76/43/340107643.db2.gz QGEOPMROGPMNRW-KXBFYZLASA-N 1 2 313.445 4.136 20 0 DIADLO CC(C)c1ccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000502571824 340108115 /nfs/dbraw/zinc/10/81/15/340108115.db2.gz RVWNMZVSNCTKAK-UHFFFAOYSA-N 1 2 305.381 4.452 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2cn3cc(Cl)ccc3n2)oc1C ZINC000502685946 340110405 /nfs/dbraw/zinc/11/04/05/340110405.db2.gz LAMWRXNAHHHXSA-LLVKDONJSA-N 1 2 303.793 4.048 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](CN2CCCC2)c2ccccc2)oc1C ZINC000502694999 340110870 /nfs/dbraw/zinc/11/08/70/340110870.db2.gz CJGVIPWBRXOQPF-VQIMIIECSA-N 1 2 312.457 4.384 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2ccncc2Cl)C1 ZINC000502876660 340115360 /nfs/dbraw/zinc/11/53/60/340115360.db2.gz QTAOUEWLRQFNQB-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2ccncc2Cl)C1 ZINC000502876660 340115361 /nfs/dbraw/zinc/11/53/61/340115361.db2.gz QTAOUEWLRQFNQB-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+]([C@@H](C)c2nc(C(C)C)no2)C1 ZINC000502893861 340115801 /nfs/dbraw/zinc/11/58/01/340115801.db2.gz SRHSBEHKUGSWHW-KBXCAEBGSA-N 1 2 317.408 4.133 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+]([C@@H](C)c2nc(C(C)C)no2)C1 ZINC000502893861 340115802 /nfs/dbraw/zinc/11/58/02/340115802.db2.gz SRHSBEHKUGSWHW-KBXCAEBGSA-N 1 2 317.408 4.133 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+]([C@@H](C)c2nc(C(C)C)no2)C1 ZINC000502893864 340115816 /nfs/dbraw/zinc/11/58/16/340115816.db2.gz SRHSBEHKUGSWHW-KSSFIOAISA-N 1 2 317.408 4.133 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+]([C@@H](C)c2nc(C(C)C)no2)C1 ZINC000502893864 340115817 /nfs/dbraw/zinc/11/58/17/340115817.db2.gz SRHSBEHKUGSWHW-KSSFIOAISA-N 1 2 317.408 4.133 20 0 DIADLO c1ccc2sc([C@H]3COCC[N@H+]3CC3CCCCC3)nc2c1 ZINC000502937219 340117127 /nfs/dbraw/zinc/11/71/27/340117127.db2.gz WNBVFSJUPWOCKH-MRXNPFEDSA-N 1 2 316.470 4.250 20 0 DIADLO c1ccc2sc([C@H]3COCC[N@@H+]3CC3CCCCC3)nc2c1 ZINC000502937219 340117128 /nfs/dbraw/zinc/11/71/28/340117128.db2.gz WNBVFSJUPWOCKH-MRXNPFEDSA-N 1 2 316.470 4.250 20 0 DIADLO FC(F)[C@@H]1CCCC[N@@H+]1Cc1cccc(-c2ccccn2)c1 ZINC000503107564 340121124 /nfs/dbraw/zinc/12/11/24/340121124.db2.gz YYNDSFVOALUSHW-KRWDZBQOSA-N 1 2 302.368 4.368 20 0 DIADLO FC(F)[C@@H]1CCCC[N@H+]1Cc1cccc(-c2ccccn2)c1 ZINC000503107564 340121125 /nfs/dbraw/zinc/12/11/25/340121125.db2.gz YYNDSFVOALUSHW-KRWDZBQOSA-N 1 2 302.368 4.368 20 0 DIADLO CCCC[C@H](C)C(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC000503130628 340121668 /nfs/dbraw/zinc/12/16/68/340121668.db2.gz LAYONKMDGXOZHQ-KGLIPLIRSA-N 1 2 323.506 4.140 20 0 DIADLO CCCC[C@H](C)C(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000503130628 340121669 /nfs/dbraw/zinc/12/16/69/340121669.db2.gz LAYONKMDGXOZHQ-KGLIPLIRSA-N 1 2 323.506 4.140 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1cc(-c2ccccc2)on1 ZINC000503202655 340123212 /nfs/dbraw/zinc/12/32/12/340123212.db2.gz YIJILJBODSTMOD-AWEZNQCLSA-N 1 2 308.381 4.240 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1cc(-c2ccccc2)on1 ZINC000503202655 340123213 /nfs/dbraw/zinc/12/32/13/340123213.db2.gz YIJILJBODSTMOD-AWEZNQCLSA-N 1 2 308.381 4.240 20 0 DIADLO CCc1ccc(NC(=O)CCn2c(C)[nH+]c3ccccc32)cc1C ZINC000503635547 340132757 /nfs/dbraw/zinc/13/27/57/340132757.db2.gz FTJXXEAWEVKLOC-UHFFFAOYSA-N 1 2 321.424 4.244 20 0 DIADLO C[C@H]([NH2+]C1(C(F)F)CC1)c1ccc(Br)c(F)c1 ZINC000503858193 340135278 /nfs/dbraw/zinc/13/52/78/340135278.db2.gz RBTYAWRAWZQUQA-ZETCQYMHSA-N 1 2 308.141 4.037 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ncnn1C(C)(C)C)c1ccccc1Cl ZINC000503899401 340136047 /nfs/dbraw/zinc/13/60/47/340136047.db2.gz BFPHQQBECYTFPM-INIZCTEOSA-N 1 2 320.868 4.173 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@H]2c2ccc(C(C)C)cc2)cc[nH+]1 ZINC000504148063 340141723 /nfs/dbraw/zinc/14/17/23/340141723.db2.gz AGWSYMMVDBJKAT-IBGZPJMESA-N 1 2 323.440 4.304 20 0 DIADLO Cc1cc(NC(=O)N2CCCC[C@H]2c2cccc(C)c2C)cc[nH+]1 ZINC000504150205 340141777 /nfs/dbraw/zinc/14/17/77/340141777.db2.gz HQGXHWBQNOQTID-IBGZPJMESA-N 1 2 323.440 4.188 20 0 DIADLO Cc1cc(NC(=O)N[C@H](C)c2ccc(Cl)c(Cl)c2)cc[nH+]1 ZINC000504157535 340142108 /nfs/dbraw/zinc/14/21/08/340142108.db2.gz RKDBGIIRWSYNHV-SNVBAGLBSA-N 1 2 324.211 4.001 20 0 DIADLO Cc1[nH+]cccc1Cc1nc(-c2cccc3ccccc32)no1 ZINC000504244798 340143815 /nfs/dbraw/zinc/14/38/15/340143815.db2.gz BQYKIHOWWWHBOR-UHFFFAOYSA-N 1 2 301.349 4.184 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1csc(-c2ccc(C)cc2)n1 ZINC000505596727 340172261 /nfs/dbraw/zinc/17/22/61/340172261.db2.gz NFQBNQRIXZVDGX-RHSMWYFYSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1csc(-c2ccc(C)cc2)n1 ZINC000505596727 340172262 /nfs/dbraw/zinc/17/22/62/340172262.db2.gz NFQBNQRIXZVDGX-RHSMWYFYSA-N 1 2 316.470 4.118 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2nccn2Cc2ccccc2)cc1 ZINC000505598302 340172328 /nfs/dbraw/zinc/17/23/28/340172328.db2.gz WEDDDHHBENJKDJ-UHFFFAOYSA-N 1 2 319.452 4.126 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2nccn2Cc2ccccc2)cc1 ZINC000505598302 340172329 /nfs/dbraw/zinc/17/23/29/340172329.db2.gz WEDDDHHBENJKDJ-UHFFFAOYSA-N 1 2 319.452 4.126 20 0 DIADLO Fc1cccc(F)c1C[NH+]1CC(c2nc3ccccc3s2)C1 ZINC000505598207 340172426 /nfs/dbraw/zinc/17/24/26/340172426.db2.gz YHGIYLSCSRARGI-UHFFFAOYSA-N 1 2 316.376 4.174 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1cnc(C2CCCC2)s1 ZINC000505614507 340173119 /nfs/dbraw/zinc/17/31/19/340173119.db2.gz YFCZZGXNMOHOBK-UHFFFAOYSA-N 1 2 316.470 4.441 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1cnc(C2CCCC2)s1 ZINC000505614507 340173120 /nfs/dbraw/zinc/17/31/20/340173120.db2.gz YFCZZGXNMOHOBK-UHFFFAOYSA-N 1 2 316.470 4.441 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+]3CCn4cccc4[C@@H]3C)s2)o1 ZINC000505636694 340173801 /nfs/dbraw/zinc/17/38/01/340173801.db2.gz NSLPHMIUMDZIQV-ZDUSSCGKSA-N 1 2 313.426 4.090 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+]3CCn4cccc4[C@@H]3C)s2)o1 ZINC000505636694 340173802 /nfs/dbraw/zinc/17/38/02/340173802.db2.gz NSLPHMIUMDZIQV-ZDUSSCGKSA-N 1 2 313.426 4.090 20 0 DIADLO Clc1ccc(C[NH2+][C@@H]2CCCc3cn(C4CCCC4)nc32)o1 ZINC000505991282 340182734 /nfs/dbraw/zinc/18/27/34/340182734.db2.gz HZRMSOOHUAPGCN-OAHLLOKOSA-N 1 2 319.836 4.412 20 0 DIADLO C[C@@H]1CCc2nc(C[N@H+](C)Cc3ccc(F)c(F)c3)sc2C1 ZINC000506203758 340188690 /nfs/dbraw/zinc/18/86/90/340188690.db2.gz HCCLFNGLWUTMBT-LLVKDONJSA-N 1 2 322.424 4.178 20 0 DIADLO C[C@@H]1CCc2nc(C[N@@H+](C)Cc3ccc(F)c(F)c3)sc2C1 ZINC000506203758 340188691 /nfs/dbraw/zinc/18/86/91/340188691.db2.gz HCCLFNGLWUTMBT-LLVKDONJSA-N 1 2 322.424 4.178 20 0 DIADLO Clc1ccc(C[N@H+](Cc2nc3ccccc3[nH]2)C2CC2)cc1 ZINC000506593796 340197237 /nfs/dbraw/zinc/19/72/37/340197237.db2.gz KPTMOQMTNUCMSM-UHFFFAOYSA-N 1 2 311.816 4.381 20 0 DIADLO Clc1ccc(C[N@@H+](Cc2nc3ccccc3[nH]2)C2CC2)cc1 ZINC000506593796 340197238 /nfs/dbraw/zinc/19/72/38/340197238.db2.gz KPTMOQMTNUCMSM-UHFFFAOYSA-N 1 2 311.816 4.381 20 0 DIADLO Fc1cc(C[N@@H+]2CCc3sccc3C2)ccc1OC(F)F ZINC000506649732 340198504 /nfs/dbraw/zinc/19/85/04/340198504.db2.gz UMNKNXGCYAOYMQ-UHFFFAOYSA-N 1 2 313.344 4.047 20 0 DIADLO Fc1cc(C[N@H+]2CCc3sccc3C2)ccc1OC(F)F ZINC000506649732 340198505 /nfs/dbraw/zinc/19/85/05/340198505.db2.gz UMNKNXGCYAOYMQ-UHFFFAOYSA-N 1 2 313.344 4.047 20 0 DIADLO CCCn1c(C[N@@H+]2CCc3sccc3C2)nc2ccccc21 ZINC000506668421 340199073 /nfs/dbraw/zinc/19/90/73/340199073.db2.gz JACYFOZZEOCUGG-UHFFFAOYSA-N 1 2 311.454 4.066 20 0 DIADLO CCCn1c(C[N@H+]2CCc3sccc3C2)nc2ccccc21 ZINC000506668421 340199074 /nfs/dbraw/zinc/19/90/74/340199074.db2.gz JACYFOZZEOCUGG-UHFFFAOYSA-N 1 2 311.454 4.066 20 0 DIADLO CCCn1cc(C[N@H+](C)Cc2cccc(Cl)c2Cl)cn1 ZINC000506745980 340200665 /nfs/dbraw/zinc/20/06/65/340200665.db2.gz AUCGGOCUWYBMDY-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO CCCn1cc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)cn1 ZINC000506745980 340200666 /nfs/dbraw/zinc/20/06/66/340200666.db2.gz AUCGGOCUWYBMDY-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO CCCn1c2ccccc2nc1C[N@H+](C)Cc1ccc(F)cc1 ZINC000506750011 340200762 /nfs/dbraw/zinc/20/07/62/340200762.db2.gz DTWPBTWKYQWVPG-UHFFFAOYSA-N 1 2 311.404 4.217 20 0 DIADLO CCCn1c2ccccc2nc1C[N@@H+](C)Cc1ccc(F)cc1 ZINC000506750011 340200763 /nfs/dbraw/zinc/20/07/63/340200763.db2.gz DTWPBTWKYQWVPG-UHFFFAOYSA-N 1 2 311.404 4.217 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@H]2/C=C/c2ccccc2)c(C)[nH+]1 ZINC000506782138 340201648 /nfs/dbraw/zinc/20/16/48/340201648.db2.gz VEIZDAJWHGWWTQ-DXRVJIQQSA-N 1 2 321.424 4.408 20 0 DIADLO C[C@@H]1CCc2nc(C[N@@H+]3CCC[C@@H](C(F)(F)F)C3)sc2C1 ZINC000506803352 340202155 /nfs/dbraw/zinc/20/21/55/340202155.db2.gz GJSISBIGQZBBGZ-GHMZBOCLSA-N 1 2 318.408 4.042 20 0 DIADLO C[C@@H]1CCc2nc(C[N@H+]3CCC[C@@H](C(F)(F)F)C3)sc2C1 ZINC000506803352 340202156 /nfs/dbraw/zinc/20/21/56/340202156.db2.gz GJSISBIGQZBBGZ-GHMZBOCLSA-N 1 2 318.408 4.042 20 0 DIADLO C[N@H+](Cc1conc1Cc1ccccc1)Cc1ccccc1F ZINC000506959570 340204340 /nfs/dbraw/zinc/20/43/40/340204340.db2.gz DBZVIMWNMSKHLX-UHFFFAOYSA-N 1 2 310.372 4.037 20 0 DIADLO C[N@@H+](Cc1conc1Cc1ccccc1)Cc1ccccc1F ZINC000506959570 340204341 /nfs/dbraw/zinc/20/43/41/340204341.db2.gz DBZVIMWNMSKHLX-UHFFFAOYSA-N 1 2 310.372 4.037 20 0 DIADLO CC[N@H+](Cc1nc2ccccc2n1C)Cc1ccccc1Cl ZINC000507123207 340208395 /nfs/dbraw/zinc/20/83/95/340208395.db2.gz XFWNQVHEABVMDJ-UHFFFAOYSA-N 1 2 313.832 4.249 20 0 DIADLO CC[N@@H+](Cc1nc2ccccc2n1C)Cc1ccccc1Cl ZINC000507123207 340208396 /nfs/dbraw/zinc/20/83/96/340208396.db2.gz XFWNQVHEABVMDJ-UHFFFAOYSA-N 1 2 313.832 4.249 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@H+](C)Cc1nccn1Cc1ccccc1 ZINC000507134067 340209036 /nfs/dbraw/zinc/20/90/36/340209036.db2.gz IKAGWIMMERHXAN-MRXNPFEDSA-N 1 2 323.415 4.264 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@@H+](C)Cc1nccn1Cc1ccccc1 ZINC000507134067 340209037 /nfs/dbraw/zinc/20/90/37/340209037.db2.gz IKAGWIMMERHXAN-MRXNPFEDSA-N 1 2 323.415 4.264 20 0 DIADLO CCc1nocc1C[N@@H+](CC)Cc1ccccc1Br ZINC000507241539 340214982 /nfs/dbraw/zinc/21/49/82/340214982.db2.gz AAYGFBLZQAOGFI-UHFFFAOYSA-N 1 2 323.234 4.022 20 0 DIADLO CCc1nocc1C[N@H+](CC)Cc1ccccc1Br ZINC000507241539 340214983 /nfs/dbraw/zinc/21/49/83/340214983.db2.gz AAYGFBLZQAOGFI-UHFFFAOYSA-N 1 2 323.234 4.022 20 0 DIADLO CCn1nccc1C[N@H+](C)[C@H](C)c1cc(Cl)ccc1Cl ZINC000507222437 340214479 /nfs/dbraw/zinc/21/44/79/340214479.db2.gz URVKKWXMBLQUNF-LLVKDONJSA-N 1 2 312.244 4.403 20 0 DIADLO CCn1nccc1C[N@@H+](C)[C@H](C)c1cc(Cl)ccc1Cl ZINC000507222437 340214480 /nfs/dbraw/zinc/21/44/80/340214480.db2.gz URVKKWXMBLQUNF-LLVKDONJSA-N 1 2 312.244 4.403 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c1F ZINC000507227061 340214571 /nfs/dbraw/zinc/21/45/71/340214571.db2.gz HSEZLNXRVFZXAB-OAHLLOKOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c1F ZINC000507227061 340214572 /nfs/dbraw/zinc/21/45/72/340214572.db2.gz HSEZLNXRVFZXAB-OAHLLOKOSA-N 1 2 307.315 4.147 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1cnn(C(C)(C)C)c1 ZINC000507243523 340215186 /nfs/dbraw/zinc/21/51/86/340215186.db2.gz MRQSTQBFSPNBFP-CYBMUJFWSA-N 1 2 305.853 4.485 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1cnn(C(C)(C)C)c1 ZINC000507243523 340215187 /nfs/dbraw/zinc/21/51/87/340215187.db2.gz MRQSTQBFSPNBFP-CYBMUJFWSA-N 1 2 305.853 4.485 20 0 DIADLO Cc1cccc2[nH+]cc(CN(C)[C@H](C)c3c(F)cccc3F)n21 ZINC000507247896 340215417 /nfs/dbraw/zinc/21/54/17/340215417.db2.gz RJSSAVRBNNAPFX-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+](C)CC1=Cc2ccccc2OC1 ZINC000507246914 340215423 /nfs/dbraw/zinc/21/54/23/340215423.db2.gz KUFJYNPKUOWJAD-CYBMUJFWSA-N 1 2 315.363 4.434 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)CC1=Cc2ccccc2OC1 ZINC000507246914 340215424 /nfs/dbraw/zinc/21/54/24/340215424.db2.gz KUFJYNPKUOWJAD-CYBMUJFWSA-N 1 2 315.363 4.434 20 0 DIADLO Fc1cccc(C[NH+](Cc2cccc(F)c2F)C2CC2)c1F ZINC000507346771 340217658 /nfs/dbraw/zinc/21/76/58/340217658.db2.gz NMFKDIPIPVUTJZ-UHFFFAOYSA-N 1 2 309.306 4.408 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](Cc3ccccc3Cl)CCO2)cc1 ZINC000507357797 340217873 /nfs/dbraw/zinc/21/78/73/340217873.db2.gz KXXVAUQVCUMLFJ-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](Cc3ccccc3Cl)CCO2)cc1 ZINC000507357797 340217874 /nfs/dbraw/zinc/21/78/74/340217874.db2.gz KXXVAUQVCUMLFJ-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000507362392 340218113 /nfs/dbraw/zinc/21/81/13/340218113.db2.gz YQGPIDFJAOSDFW-SNDJDQCESA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000507362392 340218114 /nfs/dbraw/zinc/21/81/14/340218114.db2.gz YQGPIDFJAOSDFW-SNDJDQCESA-N 1 2 315.363 4.052 20 0 DIADLO CC[C@H](C)CCC(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC000507433822 340219366 /nfs/dbraw/zinc/21/93/66/340219366.db2.gz NQXWBCYOGOWULT-UONOGXRCSA-N 1 2 323.506 4.140 20 0 DIADLO CC[C@H](C)CCC(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000507433822 340219367 /nfs/dbraw/zinc/21/93/67/340219367.db2.gz NQXWBCYOGOWULT-UONOGXRCSA-N 1 2 323.506 4.140 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+][C@H](COCC(C)C)c1ccco1 ZINC000507469177 340221256 /nfs/dbraw/zinc/22/12/56/340221256.db2.gz JSAHYTXQSADDEP-NVXWUHKLSA-N 1 2 316.445 4.302 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000507474631 340221598 /nfs/dbraw/zinc/22/15/98/340221598.db2.gz YBRYTUGDZZQRLO-IERDGZPVSA-N 1 2 317.436 4.479 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+][C@H](C)c1c(F)cccc1OC ZINC000507499782 340222900 /nfs/dbraw/zinc/22/29/00/340222900.db2.gz ZUASVLSWLSEYII-CHWSQXEVSA-N 1 2 302.393 4.204 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+]Cc1c(F)cccc1OC(F)F ZINC000507497779 340222909 /nfs/dbraw/zinc/22/29/09/340222909.db2.gz SQTJVANPBRJDIS-NSHDSACASA-N 1 2 324.346 4.235 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1ncoc1-c1ccccc1 ZINC000507511417 340223499 /nfs/dbraw/zinc/22/34/99/340223499.db2.gz ODMCEQOSJRTMTO-CQSZACIVSA-N 1 2 307.397 4.150 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+][C@H]1CCc2c1c(F)ccc2F ZINC000507794803 340231770 /nfs/dbraw/zinc/23/17/70/340231770.db2.gz QSOKFCDXSWYBAM-BMIGLBTASA-N 1 2 321.342 4.451 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@@H](c3cccs3)C2)ccc1Cl ZINC000507814493 340232852 /nfs/dbraw/zinc/23/28/52/340232852.db2.gz MHHDRLKSMNHSOJ-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@@H](c3cccs3)C2)ccc1Cl ZINC000507814493 340232853 /nfs/dbraw/zinc/23/28/53/340232853.db2.gz MHHDRLKSMNHSOJ-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO CC(C)c1nc(C[N@H+](Cc2ccccc2)CC(C)(C)C)no1 ZINC000507819387 340233162 /nfs/dbraw/zinc/23/31/62/340233162.db2.gz SSIUYEWFXNCIIF-UHFFFAOYSA-N 1 2 301.434 4.241 20 0 DIADLO CC(C)c1nc(C[N@@H+](Cc2ccccc2)CC(C)(C)C)no1 ZINC000507819387 340233163 /nfs/dbraw/zinc/23/31/63/340233163.db2.gz SSIUYEWFXNCIIF-UHFFFAOYSA-N 1 2 301.434 4.241 20 0 DIADLO CCc1ccc(C[NH2+][C@H]2CCCc3cn(C4CCCC4)nc32)o1 ZINC000507905739 340235579 /nfs/dbraw/zinc/23/55/79/340235579.db2.gz ZIRUNQXFHXEJTF-SFHVURJKSA-N 1 2 313.445 4.321 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1cccc(O)c1Cl ZINC000508171142 340240058 /nfs/dbraw/zinc/24/00/58/340240058.db2.gz CZSVIZISECDXDT-CXAGYDPISA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1cccc(O)c1Cl ZINC000508171142 340240059 /nfs/dbraw/zinc/24/00/59/340240059.db2.gz CZSVIZISECDXDT-CXAGYDPISA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1cccc(O)c1Cl ZINC000508171143 340240089 /nfs/dbraw/zinc/24/00/89/340240089.db2.gz CZSVIZISECDXDT-DYVFJYSZSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1cccc(O)c1Cl ZINC000508171143 340240090 /nfs/dbraw/zinc/24/00/90/340240090.db2.gz CZSVIZISECDXDT-DYVFJYSZSA-N 1 2 317.816 4.008 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)ccc(O)c2F)s1 ZINC000508234001 340241111 /nfs/dbraw/zinc/24/11/11/340241111.db2.gz FJSPJABUOXVXRN-CYBMUJFWSA-N 1 2 309.381 4.377 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2c(F)ccc(O)c2F)s1 ZINC000508234001 340241112 /nfs/dbraw/zinc/24/11/12/340241112.db2.gz FJSPJABUOXVXRN-CYBMUJFWSA-N 1 2 309.381 4.377 20 0 DIADLO CCc1nocc1C[N@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000508237153 340241234 /nfs/dbraw/zinc/24/12/34/340241234.db2.gz RPGNITBUIYOVJA-UHFFFAOYSA-N 1 2 320.383 4.460 20 0 DIADLO CCc1nocc1C[N@@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000508237153 340241235 /nfs/dbraw/zinc/24/12/35/340241235.db2.gz RPGNITBUIYOVJA-UHFFFAOYSA-N 1 2 320.383 4.460 20 0 DIADLO CC[C@@H](C)[C@@H](C(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000508520340 340245594 /nfs/dbraw/zinc/24/55/94/340245594.db2.gz GMVOACXBIWJMTH-AUUYWEPGSA-N 1 2 321.424 4.411 20 0 DIADLO COc1ccc(C[N@H+](Cc2cscn2)Cc2ccccc2)cc1 ZINC000508775835 340252852 /nfs/dbraw/zinc/25/28/52/340252852.db2.gz YXSOXABYJSDPBK-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO COc1ccc(C[N@@H+](Cc2cscn2)Cc2ccccc2)cc1 ZINC000508775835 340252853 /nfs/dbraw/zinc/25/28/53/340252853.db2.gz YXSOXABYJSDPBK-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO O=C(NCCC1=CCCCC1)c1ccccc1Oc1cc[nH+]cc1 ZINC000509026560 340258628 /nfs/dbraw/zinc/25/86/28/340258628.db2.gz MEDZJESUQATFEW-UHFFFAOYSA-N 1 2 322.408 4.494 20 0 DIADLO CO[C@@H](Cn1c[nH+]c2cc(F)c(F)cc21)c1ccc(Cl)cc1 ZINC000509100558 340261259 /nfs/dbraw/zinc/26/12/59/340261259.db2.gz RLZQUTOHLRMNTG-INIZCTEOSA-N 1 2 322.742 4.356 20 0 DIADLO C[C@@H]1CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C[C@@H](C)C1 ZINC000509189768 340263444 /nfs/dbraw/zinc/26/34/44/340263444.db2.gz IBLVDFPJBSIEBR-CVEARBPZSA-N 1 2 324.424 4.382 20 0 DIADLO C[C@@H]1CC[C@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)C[C@H]1C ZINC000509305137 340265779 /nfs/dbraw/zinc/26/57/79/340265779.db2.gz SQEHPACBTYSYRG-OAGGEKHMSA-N 1 2 324.424 4.428 20 0 DIADLO C[C@@H]1CC[C@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)[C@H](C)C1 ZINC000509430033 340269259 /nfs/dbraw/zinc/26/92/59/340269259.db2.gz NQMYDBPVTNCPRT-RKVPGOIHSA-N 1 2 324.424 4.428 20 0 DIADLO COC(=O)c1cccc(Cl)c1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000509639791 340275238 /nfs/dbraw/zinc/27/52/38/340275238.db2.gz DTYQVZQLEMGZCL-KRWDZBQOSA-N 1 2 315.800 4.074 20 0 DIADLO COC(=O)c1cccc(Cl)c1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000509639791 340275239 /nfs/dbraw/zinc/27/52/39/340275239.db2.gz DTYQVZQLEMGZCL-KRWDZBQOSA-N 1 2 315.800 4.074 20 0 DIADLO CC(C)CN(Cc1cn2cc(Cl)ccc2[nH+]1)CC(F)(F)F ZINC000509751044 340278329 /nfs/dbraw/zinc/27/83/29/340278329.db2.gz ONBDYJHIDCHEEU-UHFFFAOYSA-N 1 2 319.758 4.008 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Oc2ccccc2)o1)c1ccncc1F ZINC000509988446 340284764 /nfs/dbraw/zinc/28/47/64/340284764.db2.gz FNMLJNXPHGVXEE-ZDUSSCGKSA-N 1 2 312.344 4.457 20 0 DIADLO C[C@H](CC1CCCCC1)C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000510034000 340285869 /nfs/dbraw/zinc/28/58/69/340285869.db2.gz QTGLRFIIMQLFLP-OAHLLOKOSA-N 1 2 311.429 4.417 20 0 DIADLO C[C@@H](CC1CCCC1)C(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000510069281 340287125 /nfs/dbraw/zinc/28/71/25/340287125.db2.gz GUCIALHKTIPKBQ-AWEZNQCLSA-N 1 2 311.429 4.242 20 0 DIADLO Cc1[nH]ncc1C[N@H+](Cc1ccc(Cl)c(Cl)c1)C(C)C ZINC000510185979 340291944 /nfs/dbraw/zinc/29/19/44/340291944.db2.gz QJWSHTGMOXIKER-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO Cc1[nH]ncc1C[N@@H+](Cc1ccc(Cl)c(Cl)c1)C(C)C ZINC000510185979 340291945 /nfs/dbraw/zinc/29/19/45/340291945.db2.gz QJWSHTGMOXIKER-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2CCC[C@H]2c2nc3ccccc3n2C)c1 ZINC000510405258 340298264 /nfs/dbraw/zinc/29/82/64/340298264.db2.gz ZGSAGHDMXGVVDQ-IBGZPJMESA-N 1 2 323.415 4.358 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2nc3ccccc3n2C)c1 ZINC000510405258 340298265 /nfs/dbraw/zinc/29/82/65/340298265.db2.gz ZGSAGHDMXGVVDQ-IBGZPJMESA-N 1 2 323.415 4.358 20 0 DIADLO Cc1cccc([C@@H](NCc2cn3ccccc3[nH+]2)C(F)(F)F)c1 ZINC000510435857 340299371 /nfs/dbraw/zinc/29/93/71/340299371.db2.gz WVELRXHZORIQHK-MRXNPFEDSA-N 1 2 319.330 4.036 20 0 DIADLO C[C@@H]1CCC[C@@H]1CNC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000510751002 340309631 /nfs/dbraw/zinc/30/96/31/340309631.db2.gz MWFGZNIHOQFADM-HUUCEWRRSA-N 1 2 310.397 4.040 20 0 DIADLO C[C@H]1CCC[C@H]1CNC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000510751001 340309664 /nfs/dbraw/zinc/30/96/64/340309664.db2.gz MWFGZNIHOQFADM-GJZGRUSLSA-N 1 2 310.397 4.040 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2cccc(C)c2)c2cccc(F)c2)on1 ZINC000510754721 340309844 /nfs/dbraw/zinc/30/98/44/340309844.db2.gz NSVMGYOHRNVIAI-IBGZPJMESA-N 1 2 310.372 4.310 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2cccc(C)c2)c2cccc(F)c2)on1 ZINC000510754723 340309901 /nfs/dbraw/zinc/30/99/01/340309901.db2.gz NSVMGYOHRNVIAI-LJQANCHMSA-N 1 2 310.372 4.310 20 0 DIADLO Fc1ccc(Cl)cc1C[N@@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000511648938 340333839 /nfs/dbraw/zinc/33/38/39/340333839.db2.gz QKKRKXNYSXCKOY-MRXNPFEDSA-N 1 2 323.795 4.253 20 0 DIADLO Fc1ccc(Cl)cc1C[N@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000511648938 340333840 /nfs/dbraw/zinc/33/38/40/340333840.db2.gz QKKRKXNYSXCKOY-MRXNPFEDSA-N 1 2 323.795 4.253 20 0 DIADLO CCCOc1cc(C)ccc1C[NH2+]Cc1c(F)ccc(O)c1F ZINC000511666114 340334710 /nfs/dbraw/zinc/33/47/10/340334710.db2.gz LLBIRACYOPGENK-UHFFFAOYSA-N 1 2 321.367 4.057 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccon2)sc1Br ZINC000511969130 340344039 /nfs/dbraw/zinc/34/40/39/340344039.db2.gz BHXKJMKLPQQPJW-DTWKUNHWSA-N 1 2 315.236 4.219 20 0 DIADLO Cc1ccc2c(c1)C[N@H+]([C@@H](C)c1ncc(C(C)(C)C)o1)CCO2 ZINC000512162891 340350510 /nfs/dbraw/zinc/35/05/10/340350510.db2.gz DQGYFYSWSSCZSS-AWEZNQCLSA-N 1 2 314.429 4.236 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+]([C@@H](C)c1ncc(C(C)(C)C)o1)CCO2 ZINC000512162891 340350511 /nfs/dbraw/zinc/35/05/11/340350511.db2.gz DQGYFYSWSSCZSS-AWEZNQCLSA-N 1 2 314.429 4.236 20 0 DIADLO C[C@H]1CC[C@H](c2ccccc2)[N@H+](Cc2noc(C(C)(C)C)n2)C1 ZINC000512188550 340351560 /nfs/dbraw/zinc/35/15/60/340351560.db2.gz ZYKWXLWWOHWDMY-GOEBONIOSA-N 1 2 313.445 4.340 20 0 DIADLO C[C@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2noc(C(C)(C)C)n2)C1 ZINC000512188550 340351561 /nfs/dbraw/zinc/35/15/61/340351561.db2.gz ZYKWXLWWOHWDMY-GOEBONIOSA-N 1 2 313.445 4.340 20 0 DIADLO Clc1ccc(/C=C/C[N@@H+]2CCO[C@@H](c3cccs3)C2)cc1 ZINC000512240559 340353518 /nfs/dbraw/zinc/35/35/18/340353518.db2.gz DUHCNGUORQNBBR-BCMPFUBYSA-N 1 2 319.857 4.488 20 0 DIADLO Clc1ccc(/C=C/C[N@H+]2CCO[C@@H](c3cccs3)C2)cc1 ZINC000512240559 340353519 /nfs/dbraw/zinc/35/35/19/340353519.db2.gz DUHCNGUORQNBBR-BCMPFUBYSA-N 1 2 319.857 4.488 20 0 DIADLO c1c[nH]c([C@H]2CCCC[N@H+]2Cc2ccc(-c3ccccc3)o2)n1 ZINC000512521197 340365476 /nfs/dbraw/zinc/36/54/76/340365476.db2.gz ANTJCJNLVUISHW-QGZVFWFLSA-N 1 2 307.397 4.397 20 0 DIADLO c1c[nH]c([C@H]2CCCC[N@@H+]2Cc2ccc(-c3ccccc3)o2)n1 ZINC000512521197 340365477 /nfs/dbraw/zinc/36/54/77/340365477.db2.gz ANTJCJNLVUISHW-QGZVFWFLSA-N 1 2 307.397 4.397 20 0 DIADLO Clc1ccc(CN2CCCC[C@@H]2c2[nH]cc[nH+]2)c(Cl)c1 ZINC000512527349 340365642 /nfs/dbraw/zinc/36/56/42/340365642.db2.gz QTPXFFMTASAAST-CQSZACIVSA-N 1 2 310.228 4.444 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000512536470 340365963 /nfs/dbraw/zinc/36/59/63/340365963.db2.gz IVWREELTXUUWGV-MRXNPFEDSA-N 1 2 303.837 4.407 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000512536470 340365964 /nfs/dbraw/zinc/36/59/64/340365964.db2.gz IVWREELTXUUWGV-MRXNPFEDSA-N 1 2 303.837 4.407 20 0 DIADLO Cc1sccc1C[N@@H+]1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000512595404 340368270 /nfs/dbraw/zinc/36/82/70/340368270.db2.gz OQNJUTNZTPIGHA-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1sccc1C[N@H+]1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000512595404 340368271 /nfs/dbraw/zinc/36/82/71/340368271.db2.gz OQNJUTNZTPIGHA-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO FC(F)C1([NH2+]Cc2ccc(Br)o2)CCCCC1 ZINC000512885086 340382501 /nfs/dbraw/zinc/38/25/01/340382501.db2.gz KJUFWPPEZVOJQZ-UHFFFAOYSA-N 1 2 308.166 4.100 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)CCC(F)(F)F)cc2[nH+]1 ZINC000173882333 340376811 /nfs/dbraw/zinc/37/68/11/340376811.db2.gz KYSCLKCQDMORKX-UHFFFAOYSA-N 1 2 313.323 4.187 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000512907600 340383536 /nfs/dbraw/zinc/38/35/36/340383536.db2.gz SCELFCCPFVWBTL-QWQRMKEZSA-N 1 2 317.379 4.488 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000512907600 340383537 /nfs/dbraw/zinc/38/35/37/340383537.db2.gz SCELFCCPFVWBTL-QWQRMKEZSA-N 1 2 317.379 4.488 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)c(F)c1)c1c(F)cncc1F ZINC000513074591 340392215 /nfs/dbraw/zinc/39/22/15/340392215.db2.gz IGJKYSYDEKXLTP-MRVPVSSYSA-N 1 2 300.711 4.003 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2)o1)c1c(F)cncc1F ZINC000513089332 340392870 /nfs/dbraw/zinc/39/28/70/340392870.db2.gz MYXHRVNFHGYTGU-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(C(F)(F)F)s1)c1c(F)cncc1F ZINC000513112206 340393756 /nfs/dbraw/zinc/39/37/56/340393756.db2.gz VGMRIRNZDCOWOF-ZETCQYMHSA-N 1 2 322.302 4.291 20 0 DIADLO C[C@H](c1cccc(Cl)c1F)[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000513123902 340394264 /nfs/dbraw/zinc/39/42/64/340394264.db2.gz XTDYIOJSBRJWNJ-LLVKDONJSA-N 1 2 321.779 4.140 20 0 DIADLO C[C@H](c1cccc(Cl)c1F)[N@H+]1CCOc2cc(O)ccc2C1 ZINC000513123902 340394265 /nfs/dbraw/zinc/39/42/65/340394265.db2.gz XTDYIOJSBRJWNJ-LLVKDONJSA-N 1 2 321.779 4.140 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1Cl)c1c(F)cncc1F ZINC000513232115 340398675 /nfs/dbraw/zinc/39/86/75/340398675.db2.gz LVRJEBQJUJEHSO-QMMMGPOBSA-N 1 2 300.711 4.003 20 0 DIADLO Cc1cccc(OC(F)F)c1NCc1cn2c(cccc2C)[nH+]1 ZINC000177224470 340437799 /nfs/dbraw/zinc/43/77/99/340437799.db2.gz YIUIMYRRHBDSID-UHFFFAOYSA-N 1 2 317.339 4.165 20 0 DIADLO CC(C)[C@@H](NC(=O)c1ccc(C2CCCC2)cc1)c1[nH]cc[nH+]1 ZINC000516898842 340458316 /nfs/dbraw/zinc/45/83/16/340458316.db2.gz JYYUOPHMLBJXMA-QGZVFWFLSA-N 1 2 311.429 4.194 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1cccc(F)c1F ZINC000516933766 340459053 /nfs/dbraw/zinc/45/90/53/340459053.db2.gz YXYYBBRPJIPCRN-LKFCYVNXSA-N 1 2 309.743 4.403 20 0 DIADLO COc1ccc([C@H](Nc2cc(C)[nH+]cn2)c2ccc(C)cc2)cc1 ZINC000517648365 340474477 /nfs/dbraw/zinc/47/44/77/340474477.db2.gz BFMRJGIFAVKIAN-HXUWFJFHSA-N 1 2 319.408 4.304 20 0 DIADLO C[C@H](C(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C)c1ccccc1 ZINC000183221142 340486882 /nfs/dbraw/zinc/48/68/82/340486882.db2.gz CELSDANHYNJVTC-ZDUSSCGKSA-N 1 2 319.408 4.193 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1nc(C(C)(C)C)no1 ZINC000183569584 340488377 /nfs/dbraw/zinc/48/83/77/340488377.db2.gz STEDVUZFVQIXTG-GFCCVEGCSA-N 1 2 313.401 4.273 20 0 DIADLO Cc1ccc(CSc2nnc(-c3ccccc3C)o2)c(C)[nH+]1 ZINC000186340350 340511393 /nfs/dbraw/zinc/51/13/93/340511393.db2.gz KXAYXTTURBKUAB-UHFFFAOYSA-N 1 2 311.410 4.349 20 0 DIADLO CC(C)(C)n1cc(C[NH2+]Cc2c(Cl)cccc2Cl)cn1 ZINC000521833888 340535513 /nfs/dbraw/zinc/53/55/13/340535513.db2.gz GYLDIJOXHGEWBJ-UHFFFAOYSA-N 1 2 312.244 4.235 20 0 DIADLO CO[C@@H](C)CCC(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000191957977 340560592 /nfs/dbraw/zinc/56/05/92/340560592.db2.gz JQZXKLKGNRMJCH-ZDUSSCGKSA-N 1 2 314.429 4.420 20 0 DIADLO C[C@H](Cc1cccc(F)c1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000195178320 340575594 /nfs/dbraw/zinc/57/55/94/340575594.db2.gz WUWDAZRLKSIWAM-CYBMUJFWSA-N 1 2 323.371 4.033 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](COC)c2ccc(Cl)cc2)cs1 ZINC000194037250 340588400 /nfs/dbraw/zinc/58/84/00/340588400.db2.gz AZGDGAIXVBBPSB-SMDDNHRTSA-N 1 2 324.877 4.397 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(Cl)cc1 ZINC000393355976 340595450 /nfs/dbraw/zinc/59/54/50/340595450.db2.gz SNKAKJHVKIQOPP-CQSZACIVSA-N 1 2 312.244 4.358 20 0 DIADLO CCCc1ccc(C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)cc1 ZINC000522862504 340608355 /nfs/dbraw/zinc/60/83/55/340608355.db2.gz SGVIQYHDTCOOKR-UHFFFAOYSA-N 1 2 305.381 4.282 20 0 DIADLO CC[C@H](C)[C@@H](C)NC(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000523147189 340616815 /nfs/dbraw/zinc/61/68/15/340616815.db2.gz SGNDCNBSMNSGPH-DZGCQCFKSA-N 1 2 312.413 4.347 20 0 DIADLO CC[C@@H](C)[C@@H](C)NC(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000523147191 340616823 /nfs/dbraw/zinc/61/68/23/340616823.db2.gz SGNDCNBSMNSGPH-UKRRQHHQSA-N 1 2 312.413 4.347 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2ccc(Cl)c3cccnc23)o1 ZINC000230641867 340620443 /nfs/dbraw/zinc/62/04/43/340620443.db2.gz XZVIRKLCGHIGFM-NSHDSACASA-N 1 2 301.777 4.035 20 0 DIADLO CCCCc1ccc(CC(=O)Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC000523392732 340623127 /nfs/dbraw/zinc/62/31/27/340623127.db2.gz MXFISRDWBZDFTP-UHFFFAOYSA-N 1 2 321.424 4.167 20 0 DIADLO C[C@H]1C[C@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)C[C@@H](C)C1 ZINC000523542962 340628170 /nfs/dbraw/zinc/62/81/70/340628170.db2.gz QUMHJCLVUUXIPB-QLPKVWCKSA-N 1 2 324.424 4.428 20 0 DIADLO CCC[C@H](NC(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000524128299 340648092 /nfs/dbraw/zinc/64/80/92/340648092.db2.gz KNUYGWJCOZGCLO-KRWDZBQOSA-N 1 2 322.412 4.306 20 0 DIADLO CCC[C@@H](NC(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000524128300 340648097 /nfs/dbraw/zinc/64/80/97/340648097.db2.gz KNUYGWJCOZGCLO-QGZVFWFLSA-N 1 2 322.412 4.306 20 0 DIADLO C[C@@H]([NH2+]C/C=C/c1ccccc1)c1nc(Cc2ccccc2)no1 ZINC000237388978 340670512 /nfs/dbraw/zinc/67/05/12/340670512.db2.gz ZCFSRSZDBPTWGG-WDBUWWRISA-N 1 2 319.408 4.024 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1nnc2n1CCCCC2 ZINC000315934016 340677468 /nfs/dbraw/zinc/67/74/68/340677468.db2.gz WEFJSGRVNBZNNV-QWHCGFSZSA-N 1 2 318.852 4.070 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[NH2+][C@@H](C)c1ncccc1F ZINC000528824654 340735983 /nfs/dbraw/zinc/73/59/83/340735983.db2.gz MYPUJLDTTKMLNA-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCC(C1CCC1)C1CCC1 ZINC000529095846 340744885 /nfs/dbraw/zinc/74/48/85/340744885.db2.gz YHWPVZHMYWGKLJ-UHFFFAOYSA-N 1 2 301.434 4.036 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](c2ccccn2)C2CCC2)c(C)[nH+]1 ZINC000529102770 340745037 /nfs/dbraw/zinc/74/50/37/340745037.db2.gz JTPMDLBQIOKIQB-GOSISDBHSA-N 1 2 324.428 4.065 20 0 DIADLO CC(C)c1cc(Cl)ccc1NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000529849427 340771654 /nfs/dbraw/zinc/77/16/54/340771654.db2.gz PUJNWBQGVTUBCU-LBPRGKRZSA-N 1 2 305.809 4.250 20 0 DIADLO FC(F)n1ccnc1C[NH+]1CCC(CCc2ccccc2)CC1 ZINC000124919825 340801588 /nfs/dbraw/zinc/80/15/88/340801588.db2.gz USKNIEJHLXKENM-UHFFFAOYSA-N 1 2 319.399 4.123 20 0 DIADLO CC(C)[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1cccnc1 ZINC000538527127 340831515 /nfs/dbraw/zinc/83/15/15/340831515.db2.gz RWLRWODLEXENRG-LJQANCHMSA-N 1 2 310.445 4.276 20 0 DIADLO C[NH+](Cc1cc(F)c(F)c(F)c1)Cc1cc(F)c(F)c(F)c1 ZINC000538570248 340833826 /nfs/dbraw/zinc/83/38/26/340833826.db2.gz ODECURGYURGBGR-UHFFFAOYSA-N 1 2 319.248 4.153 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccc2c(c1)COC2 ZINC000538637723 340836424 /nfs/dbraw/zinc/83/64/24/340836424.db2.gz JWSYGSSZUUGCPI-HNNXBMFYSA-N 1 2 323.440 4.275 20 0 DIADLO Fc1ccc2cc[nH+]c(NC[C@@H]3CCc4ccccc4N3)c2c1 ZINC000538757739 340848467 /nfs/dbraw/zinc/84/84/67/340848467.db2.gz CQRMWHBTNPQQTF-INIZCTEOSA-N 1 2 307.372 4.213 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H]2CCc3c2cccc3Cl)s1 ZINC000539058818 340869000 /nfs/dbraw/zinc/86/90/00/340869000.db2.gz HDAYZFAQGPLFTD-ZDUSSCGKSA-N 1 2 307.850 4.092 20 0 DIADLO Fc1cccc([C@@H]([NH2+]Cc2nnc(C3CC3)o2)C2CCCC2)c1 ZINC000539333652 340881403 /nfs/dbraw/zinc/88/14/03/340881403.db2.gz BCHZADRPJUTEFV-KRWDZBQOSA-N 1 2 315.392 4.107 20 0 DIADLO c1ccc2c(c1)OCCC[C@H]2Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000539626520 340893383 /nfs/dbraw/zinc/89/33/83/340893383.db2.gz SUHPQNXBBIRPQS-GOSISDBHSA-N 1 2 323.440 4.398 20 0 DIADLO COc1cc([C@@H](C)Nc2ccc(N3CCCC3)[nH+]c2)ccc1F ZINC000128564298 340897028 /nfs/dbraw/zinc/89/70/28/340897028.db2.gz HEKYWUQQHJETCY-CYBMUJFWSA-N 1 2 315.392 4.003 20 0 DIADLO COc1cc(C)[nH+]c(CNc2ccc3c4c(cccc42)CC3)c1 ZINC000539856149 340906743 /nfs/dbraw/zinc/90/67/43/340906743.db2.gz INEFIPFGRUQJRL-UHFFFAOYSA-N 1 2 304.393 4.263 20 0 DIADLO CCCc1ccc([C@@H](C)[NH2+][C@@H](CO)c2c(F)cccc2F)cc1 ZINC000540181183 340921141 /nfs/dbraw/zinc/92/11/41/340921141.db2.gz FKBDXSOKGBDJKF-ACJLOTCBSA-N 1 2 319.395 4.302 20 0 DIADLO CCCc1ccc([C@@H](C)[NH2+][C@H](CO)c2c(F)cccc2F)cc1 ZINC000540181185 340921254 /nfs/dbraw/zinc/92/12/54/340921254.db2.gz FKBDXSOKGBDJKF-FZKQIMNGSA-N 1 2 319.395 4.302 20 0 DIADLO CCOc1cccc([C@@H](C)[NH2+]Cc2ncc(C(C)(C)C)o2)c1 ZINC000540379760 340928895 /nfs/dbraw/zinc/92/88/95/340928895.db2.gz KFFQNRORKWRDNM-CYBMUJFWSA-N 1 2 302.418 4.222 20 0 DIADLO CCCOc1cccc2c(NCc3cccc(C)n3)cc[nH+]c12 ZINC000540870267 340949120 /nfs/dbraw/zinc/94/91/20/340949120.db2.gz YABNRYMHNUFQEO-UHFFFAOYSA-N 1 2 307.397 4.339 20 0 DIADLO Clc1cccc2[nH]c(-c3cc(-n4cc[nH+]c4)cs3)nc21 ZINC000541268270 340964616 /nfs/dbraw/zinc/96/46/16/340964616.db2.gz FKDARHXQEYLXBH-UHFFFAOYSA-N 1 2 300.774 4.131 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+]C[C@H](C)Cc1ccccc1 ZINC000541588179 340976244 /nfs/dbraw/zinc/97/62/44/340976244.db2.gz VEQWVXZNUBGJHB-QGZVFWFLSA-N 1 2 324.468 4.122 20 0 DIADLO CCOc1ccc([C@H]2CCCN2c2cc(CC)[nH+]c(C)n2)cc1 ZINC000542019022 340993425 /nfs/dbraw/zinc/99/34/25/340993425.db2.gz AFTANNYHXUVHIN-GOSISDBHSA-N 1 2 311.429 4.088 20 0 DIADLO Cc1nc2[nH]ccc2c(N2CC[C@H](c3ccccc3)C[C@H]2C)[nH+]1 ZINC000542137834 340996894 /nfs/dbraw/zinc/99/68/94/340996894.db2.gz GJNGJNDUTUYAAG-CJNGLKHVSA-N 1 2 306.413 4.039 20 0 DIADLO CCCCS(=O)(=O)Nc1ccc([NH2+][C@@H](C)[C@@H](C)CC)cc1 ZINC000542165750 340998172 /nfs/dbraw/zinc/99/81/72/340998172.db2.gz IUZALTIXYYBVTL-KBPBESRZSA-N 1 2 312.479 4.075 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ncc(-c2cccs2)o1 ZINC000130174891 341005011 /nfs/dbraw/zinc/00/50/11/341005011.db2.gz BWKMWVPWXRDDDO-AWEZNQCLSA-N 1 2 313.426 4.381 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ncc(-c2cccs2)o1 ZINC000130174891 341005012 /nfs/dbraw/zinc/00/50/12/341005012.db2.gz BWKMWVPWXRDDDO-AWEZNQCLSA-N 1 2 313.426 4.381 20 0 DIADLO CCc1cnc(C[N@@H+]2CCS[C@H](C)[C@H]2c2ccccc2)s1 ZINC000542464748 341008192 /nfs/dbraw/zinc/00/81/92/341008192.db2.gz HTGXALUCKFVKLW-DYVFJYSZSA-N 1 2 318.511 4.384 20 0 DIADLO CCc1cnc(C[N@H+]2CCS[C@H](C)[C@H]2c2ccccc2)s1 ZINC000542464748 341008193 /nfs/dbraw/zinc/00/81/93/341008193.db2.gz HTGXALUCKFVKLW-DYVFJYSZSA-N 1 2 318.511 4.384 20 0 DIADLO COc1c(C)cnc(C[N@H+](C)Cc2ccc([C@H]3C[C@@H]3C)o2)c1C ZINC000542693507 341017472 /nfs/dbraw/zinc/01/74/72/341017472.db2.gz FHYBLPVEWZWFIW-LRDDRELGSA-N 1 2 314.429 4.055 20 0 DIADLO COc1c(C)cnc(C[N@@H+](C)Cc2ccc([C@H]3C[C@@H]3C)o2)c1C ZINC000542693507 341017473 /nfs/dbraw/zinc/01/74/73/341017473.db2.gz FHYBLPVEWZWFIW-LRDDRELGSA-N 1 2 314.429 4.055 20 0 DIADLO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+]1CCOC(C)(C)C1 ZINC000130464943 341022409 /nfs/dbraw/zinc/02/24/09/341022409.db2.gz DSEYIVYKAXNTNP-LBPRGKRZSA-N 1 2 320.820 4.167 20 0 DIADLO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1CCOC(C)(C)C1 ZINC000130464943 341022410 /nfs/dbraw/zinc/02/24/10/341022410.db2.gz DSEYIVYKAXNTNP-LBPRGKRZSA-N 1 2 320.820 4.167 20 0 DIADLO c1csc([C@H]2CCC[N@H+]2Cc2nc(C3CCCC3)no2)c1 ZINC000130549736 341027661 /nfs/dbraw/zinc/02/76/61/341027661.db2.gz FPNYUOJHPNWSBZ-CYBMUJFWSA-N 1 2 303.431 4.126 20 0 DIADLO c1csc([C@H]2CCC[N@@H+]2Cc2nc(C3CCCC3)no2)c1 ZINC000130549736 341027662 /nfs/dbraw/zinc/02/76/62/341027662.db2.gz FPNYUOJHPNWSBZ-CYBMUJFWSA-N 1 2 303.431 4.126 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](CCCc3ccsc3)CCO2)cc1F ZINC000543030135 341028605 /nfs/dbraw/zinc/02/86/05/341028605.db2.gz KHZOGMUYZUTIKQ-KRWDZBQOSA-N 1 2 323.408 4.032 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](CCCc3ccsc3)CCO2)cc1F ZINC000543030135 341028606 /nfs/dbraw/zinc/02/86/06/341028606.db2.gz KHZOGMUYZUTIKQ-KRWDZBQOSA-N 1 2 323.408 4.032 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000543063134 341030006 /nfs/dbraw/zinc/03/00/06/341030006.db2.gz YOHAVOYVKMHMLW-ZDUSSCGKSA-N 1 2 314.816 4.164 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000543063134 341030007 /nfs/dbraw/zinc/03/00/07/341030007.db2.gz YOHAVOYVKMHMLW-ZDUSSCGKSA-N 1 2 314.816 4.164 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)[C@H]3CCCCS3)cc2[nH+]1 ZINC000543092450 341031543 /nfs/dbraw/zinc/03/15/43/341031543.db2.gz DKEHVNDFCHUXTM-OAHLLOKOSA-N 1 2 317.458 4.130 20 0 DIADLO Fc1ccc2nc(-c3cc(-n4cc[nH+]c4)cs3)n(C3CC3)c2c1 ZINC000543126084 341033114 /nfs/dbraw/zinc/03/31/14/341033114.db2.gz IBBVCXAGBPSSDO-UHFFFAOYSA-N 1 2 324.384 4.425 20 0 DIADLO CCc1cnc(C[N@@H+]2CCSC[C@H]2c2ccc(C)cc2)s1 ZINC000543394575 341041847 /nfs/dbraw/zinc/04/18/47/341041847.db2.gz UFLOSRXIQQSPEO-INIZCTEOSA-N 1 2 318.511 4.304 20 0 DIADLO CCc1cnc(C[N@H+]2CCSC[C@H]2c2ccc(C)cc2)s1 ZINC000543394575 341041848 /nfs/dbraw/zinc/04/18/48/341041848.db2.gz UFLOSRXIQQSPEO-INIZCTEOSA-N 1 2 318.511 4.304 20 0 DIADLO CSc1cc(C[NH2+][C@H](c2ccco2)c2ccccc2)ccn1 ZINC000543400666 341042363 /nfs/dbraw/zinc/04/23/63/341042363.db2.gz IKULSMJIYMLPEH-SFHVURJKSA-N 1 2 310.422 4.276 20 0 DIADLO CCc1cnc(C[N@@H+]2[C@H](C)Cc3cc(OC)ccc3[C@@H]2C)s1 ZINC000543415000 341043210 /nfs/dbraw/zinc/04/32/10/341043210.db2.gz VLMZBUTXPKFBGA-OLZOCXBDSA-N 1 2 316.470 4.222 20 0 DIADLO CCc1cnc(C[N@H+]2[C@H](C)Cc3cc(OC)ccc3[C@@H]2C)s1 ZINC000543415000 341043211 /nfs/dbraw/zinc/04/32/11/341043211.db2.gz VLMZBUTXPKFBGA-OLZOCXBDSA-N 1 2 316.470 4.222 20 0 DIADLO c1csc([C@@H]([NH2+]Cc2noc(-c3ccsc3)n2)C2CC2)c1 ZINC000543438666 341044545 /nfs/dbraw/zinc/04/45/45/341044545.db2.gz LQNPSNDRFVEVRB-AWEZNQCLSA-N 1 2 317.439 4.101 20 0 DIADLO Cc1ccc(-c2cnc(C[NH2+][C@@H](C)c3cnn(C(C)C)c3)o2)cc1 ZINC000543504905 341047706 /nfs/dbraw/zinc/04/77/06/341047706.db2.gz DVZQXROPVPWUIG-HNNXBMFYSA-N 1 2 324.428 4.278 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)c2ncc(C(C)(C)C)o2)cn1 ZINC000543504463 341047781 /nfs/dbraw/zinc/04/77/81/341047781.db2.gz UPMJQZPWMIIFRC-OLZOCXBDSA-N 1 2 304.438 4.161 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@@H](c2ccccc2)c2cncnc2)o1 ZINC000543600159 341050631 /nfs/dbraw/zinc/05/06/31/341050631.db2.gz CDCUMKLXDDXVNE-DJKXOVBDSA-N 1 2 319.408 4.072 20 0 DIADLO Cc1cc(F)ccc1-c1ccc(C[NH2+][C@@H](C)c2ccon2)o1 ZINC000543635929 341052464 /nfs/dbraw/zinc/05/24/64/341052464.db2.gz PFXWRGRDQQUDQI-LBPRGKRZSA-N 1 2 300.333 4.233 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CC[C@H](COc3ccccc3)C2)c1 ZINC000543726976 341055429 /nfs/dbraw/zinc/05/54/29/341055429.db2.gz QSSPLEPEEVBMBM-ZDUSSCGKSA-N 1 2 322.330 4.006 20 0 DIADLO CCOc1c(C[N@H+](C)[C@H](C)c2ccco2)c(C)nn1CC(C)C ZINC000131026575 341056672 /nfs/dbraw/zinc/05/66/72/341056672.db2.gz GTORMGSZWZDDLQ-OAHLLOKOSA-N 1 2 319.449 4.032 20 0 DIADLO CCOc1c(C[N@@H+](C)[C@H](C)c2ccco2)c(C)nn1CC(C)C ZINC000131026575 341056673 /nfs/dbraw/zinc/05/66/73/341056673.db2.gz GTORMGSZWZDDLQ-OAHLLOKOSA-N 1 2 319.449 4.032 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2F)o1 ZINC000131068927 341057713 /nfs/dbraw/zinc/05/77/13/341057713.db2.gz SGOKYAMNCLQLPK-INIZCTEOSA-N 1 2 307.340 4.041 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(F)cc2F)o1 ZINC000131068927 341057714 /nfs/dbraw/zinc/05/77/14/341057714.db2.gz SGOKYAMNCLQLPK-INIZCTEOSA-N 1 2 307.340 4.041 20 0 DIADLO CCc1ccc([C@@H](CO)[NH2+]Cc2c(Cl)cccc2Cl)cc1 ZINC000543842826 341061263 /nfs/dbraw/zinc/06/12/63/341061263.db2.gz NEZBQBHGFZPEBP-QGZVFWFLSA-N 1 2 324.251 4.379 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2ncc(C3CC3)o2)C2CC2)cc1 ZINC000543991370 341065441 /nfs/dbraw/zinc/06/54/41/341065441.db2.gz TVPJHWLYFJDEDT-KRWDZBQOSA-N 1 2 302.805 4.446 20 0 DIADLO Cc1nn(C)cc1C[N@@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000131211976 341065938 /nfs/dbraw/zinc/06/59/38/341065938.db2.gz LKDQEYQAUIXVEF-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO Cc1nn(C)cc1C[N@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000131211976 341065939 /nfs/dbraw/zinc/06/59/39/341065939.db2.gz LKDQEYQAUIXVEF-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO Clc1ccc2[nH]c(-c3cc(-n4cc[nH+]c4)cs3)nc2c1 ZINC000544055643 341068366 /nfs/dbraw/zinc/06/83/66/341068366.db2.gz XHCVDIODJTZZPG-UHFFFAOYSA-N 1 2 300.774 4.131 20 0 DIADLO Cc1ccc(CCCn2nc(C(F)(F)F)c3c[nH+]ccc32)cc1 ZINC000544081163 341069661 /nfs/dbraw/zinc/06/96/61/341069661.db2.gz SMRCQFJTPIUSHB-UHFFFAOYSA-N 1 2 319.330 4.391 20 0 DIADLO CC[C@@H](Cc1nc(Cc2ccc(C)[nH+]c2)no1)c1ccc(C)cc1 ZINC000544134500 341071628 /nfs/dbraw/zinc/07/16/28/341071628.db2.gz XAWDVKJOAQTFEA-KRWDZBQOSA-N 1 2 321.424 4.409 20 0 DIADLO CCCCc1ccc(Cc2nc(Cc3ccc(C)[nH+]c3)no2)cc1 ZINC000544170828 341072758 /nfs/dbraw/zinc/07/27/58/341072758.db2.gz XBTFNFIXMYJJRR-UHFFFAOYSA-N 1 2 321.424 4.297 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@H](c3cc(C)cc(C)c3)C2)no1 ZINC000544190200 341073945 /nfs/dbraw/zinc/07/39/45/341073945.db2.gz HIAPRZRTYIVRIO-INIZCTEOSA-N 1 2 313.445 4.019 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@H](c3cc(C)cc(C)c3)C2)no1 ZINC000544190200 341073946 /nfs/dbraw/zinc/07/39/46/341073946.db2.gz HIAPRZRTYIVRIO-INIZCTEOSA-N 1 2 313.445 4.019 20 0 DIADLO CCCCn1cc(C[NH2+][C@H](c2ccco2)c2ccccc2)c(C)n1 ZINC000544381706 341079381 /nfs/dbraw/zinc/07/93/81/341079381.db2.gz GCZKAWVDTFMEGB-FQEVSTJZSA-N 1 2 323.440 4.464 20 0 DIADLO CC(C)C[C@@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1cccs1 ZINC000544448154 341082549 /nfs/dbraw/zinc/08/25/49/341082549.db2.gz BCEBKSNWRLVCQM-WCQYABFASA-N 1 2 305.447 4.447 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2ccc(Cl)cc21)c1nc(C(C)(C)C)no1 ZINC000544511170 341084583 /nfs/dbraw/zinc/08/45/83/341084583.db2.gz UYNJDJMYCULASX-IINYFYTJSA-N 1 2 319.836 4.359 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000544562720 341085658 /nfs/dbraw/zinc/08/56/58/341085658.db2.gz MPOMMJGFMRAFGJ-KSSFIOAISA-N 1 2 314.429 4.170 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000544562720 341085659 /nfs/dbraw/zinc/08/56/59/341085659.db2.gz MPOMMJGFMRAFGJ-KSSFIOAISA-N 1 2 314.429 4.170 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000544562724 341085753 /nfs/dbraw/zinc/08/57/53/341085753.db2.gz MPOMMJGFMRAFGJ-RDTXWAMCSA-N 1 2 314.429 4.170 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000544562724 341085754 /nfs/dbraw/zinc/08/57/54/341085754.db2.gz MPOMMJGFMRAFGJ-RDTXWAMCSA-N 1 2 314.429 4.170 20 0 DIADLO CCC[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1cccnc1 ZINC000544601903 341088071 /nfs/dbraw/zinc/08/80/71/341088071.db2.gz DSZCBIZLCHOXBL-SFHVURJKSA-N 1 2 310.445 4.420 20 0 DIADLO CCc1oc(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)cc1C ZINC000544723922 341092115 /nfs/dbraw/zinc/09/21/15/341092115.db2.gz LMMDLUBFWAUGMA-UHFFFAOYSA-N 1 2 320.352 4.053 20 0 DIADLO CCCc1noc(C[N@H+](C2CC2)[C@H]2CCCc3ccccc32)n1 ZINC000072580373 341092167 /nfs/dbraw/zinc/09/21/67/341092167.db2.gz CXCBCKZQAIWACX-KRWDZBQOSA-N 1 2 311.429 4.064 20 0 DIADLO CCCc1noc(C[N@@H+](C2CC2)[C@H]2CCCc3ccccc32)n1 ZINC000072580373 341092168 /nfs/dbraw/zinc/09/21/68/341092168.db2.gz CXCBCKZQAIWACX-KRWDZBQOSA-N 1 2 311.429 4.064 20 0 DIADLO Cc1ccc([C@H](c2noc(Cc3ccc[nH+]c3C)n2)C(C)C)cc1 ZINC000564281405 341093863 /nfs/dbraw/zinc/09/38/63/341093863.db2.gz FOFLYBLZTUAPPE-LJQANCHMSA-N 1 2 321.424 4.460 20 0 DIADLO CC(C)c1ccc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)s1 ZINC000544824026 341094920 /nfs/dbraw/zinc/09/49/20/341094920.db2.gz DRWAPDIZZMZZPG-UHFFFAOYSA-N 1 2 311.410 4.310 20 0 DIADLO CC(C)OCCCCNc1[nH+]cccc1OCc1ccccc1 ZINC000544845704 341096057 /nfs/dbraw/zinc/09/60/57/341096057.db2.gz IFYAAUPJMBJEPO-UHFFFAOYSA-N 1 2 314.429 4.278 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2c(C)cccc2C)n1 ZINC000544895643 341097875 /nfs/dbraw/zinc/09/78/75/341097875.db2.gz KAZWWJBOGMJYPP-CABCVRRESA-N 1 2 301.434 4.441 20 0 DIADLO Cc1cc(NC(=O)c2cc(C3CC3)nc3ccccc32)cc[nH+]1 ZINC000072710083 341100476 /nfs/dbraw/zinc/10/04/76/341100476.db2.gz UFYIBTVHIXAVTI-UHFFFAOYSA-N 1 2 303.365 4.068 20 0 DIADLO CC[C@@H](Cc1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1)C(C)C ZINC000544954781 341101110 /nfs/dbraw/zinc/10/11/10/341101110.db2.gz QLNSNHMKSLPSAH-INIZCTEOSA-N 1 2 324.428 4.206 20 0 DIADLO COc1ccc2c(c1)[nH+]ccc2OCc1ncc(C(C)(C)C)o1 ZINC000131746354 341110632 /nfs/dbraw/zinc/11/06/32/341110632.db2.gz YSWGJOVTFWPNLK-UHFFFAOYSA-N 1 2 312.369 4.108 20 0 DIADLO C[C@H](C(=O)Nc1c[nH+]ccc1OC(C)(C)C)c1ccccc1F ZINC000131829123 341112349 /nfs/dbraw/zinc/11/23/49/341112349.db2.gz BPHSCZSKQCFWMB-LBPRGKRZSA-N 1 2 316.376 4.140 20 0 DIADLO Brc1ccc2[nH+]c(CSCc3ccco3)cn2c1 ZINC000073753286 341120806 /nfs/dbraw/zinc/12/08/06/341120806.db2.gz SFFGDRPHODTHPV-UHFFFAOYSA-N 1 2 323.215 4.123 20 0 DIADLO CC[C@@H](C)c1csc([C@H]2C[N@H+](Cc3ccccc3)CCO2)n1 ZINC000132507432 341125110 /nfs/dbraw/zinc/12/51/10/341125110.db2.gz XPMQDJUTZBNVNP-RHSMWYFYSA-N 1 2 316.470 4.230 20 0 DIADLO CC[C@@H](C)c1csc([C@H]2C[N@@H+](Cc3ccccc3)CCO2)n1 ZINC000132507432 341125111 /nfs/dbraw/zinc/12/51/11/341125111.db2.gz XPMQDJUTZBNVNP-RHSMWYFYSA-N 1 2 316.470 4.230 20 0 DIADLO CC[C@H](C)c1csc([C@H]2C[N@H+](Cc3ccccc3)CCO2)n1 ZINC000132507638 341125134 /nfs/dbraw/zinc/12/51/34/341125134.db2.gz XPMQDJUTZBNVNP-WMLDXEAASA-N 1 2 316.470 4.230 20 0 DIADLO CC[C@H](C)c1csc([C@H]2C[N@@H+](Cc3ccccc3)CCO2)n1 ZINC000132507638 341125135 /nfs/dbraw/zinc/12/51/35/341125135.db2.gz XPMQDJUTZBNVNP-WMLDXEAASA-N 1 2 316.470 4.230 20 0 DIADLO Cc1ccc(Cc2noc(Cc3ccc(C(C)(C)C)cc3)n2)c[nH+]1 ZINC000545634440 341134073 /nfs/dbraw/zinc/13/40/73/341134073.db2.gz CBBIVGSRRAGTPP-UHFFFAOYSA-N 1 2 321.424 4.252 20 0 DIADLO Cc1ccc(Cc2noc(-c3ccc(Cl)cc3Cl)n2)c[nH+]1 ZINC000545634301 341134090 /nfs/dbraw/zinc/13/40/90/341134090.db2.gz ZKSFHKVVXCFBHF-UHFFFAOYSA-N 1 2 320.179 4.338 20 0 DIADLO Cc1ccc(Cc2noc(C3(c4ccccc4)CCCC3)n2)c[nH+]1 ZINC000545634112 341134133 /nfs/dbraw/zinc/13/41/33/341134133.db2.gz VICHFKMPCXSMAY-UHFFFAOYSA-N 1 2 319.408 4.224 20 0 DIADLO Cc1ccc(Cc2noc([C@@H]3CC[C@H]4CCCC[C@@H]4C3)n2)c[nH+]1 ZINC000545636715 341134302 /nfs/dbraw/zinc/13/43/02/341134302.db2.gz MVZLDZIBDUFBGP-BRWVUGGUSA-N 1 2 311.429 4.438 20 0 DIADLO Cc1ccc(Cc2noc(C[C@H](c3ccccc3)C(C)C)n2)c[nH+]1 ZINC000545638488 341134389 /nfs/dbraw/zinc/13/43/89/341134389.db2.gz PISSEFKDTLSOAV-SFHVURJKSA-N 1 2 321.424 4.346 20 0 DIADLO CCCc1[nH+]c2ccccc2n1CCc1nc([C@H](C)C2CC2)no1 ZINC000545806274 341141861 /nfs/dbraw/zinc/14/18/61/341141861.db2.gz PZHUTTTXSBIZQS-CYBMUJFWSA-N 1 2 324.428 4.128 20 0 DIADLO Fc1cccc(-c2cnc(C[N@@H+]3CCc4ccsc4C3)o2)c1 ZINC000132716984 341143348 /nfs/dbraw/zinc/14/33/48/341143348.db2.gz FBPJQLVKKZAQHR-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1cccc(-c2cnc(C[N@H+]3CCc4ccsc4C3)o2)c1 ZINC000132716984 341143349 /nfs/dbraw/zinc/14/33/49/341143349.db2.gz FBPJQLVKKZAQHR-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@H](C)CCOC)c1 ZINC000545954422 341148306 /nfs/dbraw/zinc/14/83/06/341148306.db2.gz PMMWTAHPIRVERQ-OAHLLOKOSA-N 1 2 301.434 4.187 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)c(C)[nH+]1 ZINC000132901680 341149010 /nfs/dbraw/zinc/14/90/10/341149010.db2.gz VSWBKIIUZPROAA-DZGCQCFKSA-N 1 2 316.351 4.027 20 0 DIADLO Cc1cc(N[C@H](C)c2c(C)cccc2C)nc(-c2ccncc2)[nH+]1 ZINC000546172751 341155839 /nfs/dbraw/zinc/15/58/39/341155839.db2.gz LJKZUALOSLRYPG-MRXNPFEDSA-N 1 2 318.424 4.059 20 0 DIADLO Cc1ccnc(C[NH2+]C(c2ccccc2C)c2ccccc2C)n1 ZINC000546180213 341156264 /nfs/dbraw/zinc/15/62/64/341156264.db2.gz QNZJGTJIFCMROJ-UHFFFAOYSA-N 1 2 317.436 4.281 20 0 DIADLO c1ccc(COc2ccc[nH+]c2N[C@H]2CCOC3(CCC3)C2)cc1 ZINC000546180898 341156416 /nfs/dbraw/zinc/15/64/16/341156416.db2.gz AWMIAWVAWGRBII-KRWDZBQOSA-N 1 2 324.424 4.174 20 0 DIADLO Cc1nc([C@H]([NH2+]CC2CCC(C)CC2)c2ccccc2F)no1 ZINC000133128316 341156466 /nfs/dbraw/zinc/15/64/66/341156466.db2.gz FTUSMYZURZOSDW-MKTAYPAQSA-N 1 2 317.408 4.022 20 0 DIADLO Cc1ccc(Cc2noc(CCC(C)(C)c3ccccc3)n2)c[nH+]1 ZINC000546345800 341164451 /nfs/dbraw/zinc/16/44/51/341164451.db2.gz VHDAUWMKZDPBDR-UHFFFAOYSA-N 1 2 321.424 4.274 20 0 DIADLO Cc1ccc(Cc2noc([C@H](c3ccccc3)C(C)C)n2)c[nH+]1 ZINC000546346620 341164493 /nfs/dbraw/zinc/16/44/93/341164493.db2.gz NYURUWSDDKQCES-SFHVURJKSA-N 1 2 307.397 4.152 20 0 DIADLO Cc1cccn2cc(Cc3noc(/C=C/C4CCCCC4)n3)[nH+]c12 ZINC000546391294 341166380 /nfs/dbraw/zinc/16/63/80/341166380.db2.gz YBLCVRHNWKRHFL-MDZDMXLPSA-N 1 2 322.412 4.210 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc([C@@H]2CCCC[C@@H]2C)no1 ZINC000546397755 341166611 /nfs/dbraw/zinc/16/66/11/341166611.db2.gz KKEYWMKMFAFUCJ-GXTWGEPZSA-N 1 2 310.401 4.070 20 0 DIADLO C[C@H]1CCCC[C@@H]1c1noc(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC000546396896 341166621 /nfs/dbraw/zinc/16/66/21/341166621.db2.gz ITLPTLVZTKZJBG-YOEHRIQHSA-N 1 2 322.412 4.275 20 0 DIADLO c1coc([C@H]([NH2+]Cc2cnc(C3CC3)s2)c2ccccc2)c1 ZINC000133667794 341181154 /nfs/dbraw/zinc/18/11/54/341181154.db2.gz MSSKBTPILIYFBU-QGZVFWFLSA-N 1 2 310.422 4.493 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2ccncc2Cl)[C@H](C)CO1 ZINC000075785273 341182724 /nfs/dbraw/zinc/18/27/24/341182724.db2.gz MDNXYYIZPUUAMI-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2ccncc2Cl)[C@H](C)CO1 ZINC000075785273 341182725 /nfs/dbraw/zinc/18/27/25/341182725.db2.gz MDNXYYIZPUUAMI-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO CCCCc1noc(COc2cc(C)[nH+]c3c(C)cccc23)n1 ZINC000546885628 341185498 /nfs/dbraw/zinc/18/54/98/341185498.db2.gz RBCPUXJRRNXQMV-UHFFFAOYSA-N 1 2 311.385 4.156 20 0 DIADLO C[C@@H](CCC(C)(C)C)c1nc(Cc2cn3ccccc3[nH+]2)no1 ZINC000547018554 341191761 /nfs/dbraw/zinc/19/17/61/341191761.db2.gz PJRVVMGERXDYEV-ZDUSSCGKSA-N 1 2 312.417 4.238 20 0 DIADLO Cc1ccc(Cc2noc(/C=C/c3ccc(Cl)s3)n2)c[nH+]1 ZINC000547051950 341193772 /nfs/dbraw/zinc/19/37/72/341193772.db2.gz ZTRLPTUZOXWGFZ-FNORWQNLSA-N 1 2 317.801 4.249 20 0 DIADLO Cc1cccn2cc(Cc3noc([C@H]4CC45CCCCC5)n3)[nH+]c12 ZINC000547090662 341195515 /nfs/dbraw/zinc/19/55/15/341195515.db2.gz ZRGUACACABAXCT-OAHLLOKOSA-N 1 2 322.412 4.054 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1ncc(-c3ccccc3)o1)CC2 ZINC000133999293 341204205 /nfs/dbraw/zinc/20/42/05/341204205.db2.gz WCSIPQQUBKNTDL-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1ncc(-c3ccccc3)o1)CC2 ZINC000133999293 341204206 /nfs/dbraw/zinc/20/42/06/341204206.db2.gz WCSIPQQUBKNTDL-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Cc1oc2ccccc2c1C(=O)Nc1ccc2c(c1)[nH+]c(C)n2C ZINC000547352815 341208058 /nfs/dbraw/zinc/20/80/58/341208058.db2.gz QBGPVOOUZGSUJK-UHFFFAOYSA-N 1 2 319.364 4.189 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@@H](COCC(C)C)c2ccco2)o1 ZINC000152641881 341214082 /nfs/dbraw/zinc/21/40/82/341214082.db2.gz SXDFYXLVJURABI-HOCLYGCPSA-N 1 2 305.418 4.500 20 0 DIADLO COc1ccc(C[NH2+][C@@H](C)c2csc(C(C)C)n2)cc1F ZINC000076900202 341215445 /nfs/dbraw/zinc/21/54/45/341215445.db2.gz MZJSRLRARLYJJT-NSHDSACASA-N 1 2 308.422 4.265 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1ccc(Br)cn1 ZINC000134538328 341217521 /nfs/dbraw/zinc/21/75/21/341217521.db2.gz KHYYYOIZPHGFST-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccc(Br)cn1 ZINC000134538328 341217522 /nfs/dbraw/zinc/21/75/22/341217522.db2.gz KHYYYOIZPHGFST-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)nc2ccccc12 ZINC000547517969 341219857 /nfs/dbraw/zinc/21/98/57/341219857.db2.gz KAMVIORZSRORDG-OCCSQVGLSA-N 1 2 323.362 4.101 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)nc2ccccc12 ZINC000547517969 341219858 /nfs/dbraw/zinc/21/98/58/341219858.db2.gz KAMVIORZSRORDG-OCCSQVGLSA-N 1 2 323.362 4.101 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](CCCc3ccsc3)CCO2)c(F)c1 ZINC000547649072 341224993 /nfs/dbraw/zinc/22/49/93/341224993.db2.gz JJCPAQQGTHXREB-KRWDZBQOSA-N 1 2 323.408 4.032 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](CCCc3ccsc3)CCO2)c(F)c1 ZINC000547649072 341224994 /nfs/dbraw/zinc/22/49/94/341224994.db2.gz JJCPAQQGTHXREB-KRWDZBQOSA-N 1 2 323.408 4.032 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](C/C=C/c3ccccc3)CCO2)c(F)c1 ZINC000547647695 341225052 /nfs/dbraw/zinc/22/50/52/341225052.db2.gz DDQBZKQNEQGNBV-ZLHKHBAESA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](C/C=C/c3ccccc3)CCO2)c(F)c1 ZINC000547647695 341225053 /nfs/dbraw/zinc/22/50/53/341225053.db2.gz DDQBZKQNEQGNBV-ZLHKHBAESA-N 1 2 315.363 4.052 20 0 DIADLO FC(F)(F)c1ccccc1C[N@H+](Cc1nccs1)C1CC1 ZINC000134994402 341228273 /nfs/dbraw/zinc/22/82/73/341228273.db2.gz HHBGKZUOFDHHER-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO FC(F)(F)c1ccccc1C[N@@H+](Cc1nccs1)C1CC1 ZINC000134994402 341228274 /nfs/dbraw/zinc/22/82/74/341228274.db2.gz HHBGKZUOFDHHER-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C3CC3)no2)cc1 ZINC000079304744 341256435 /nfs/dbraw/zinc/25/64/35/341256435.db2.gz XHEXETYJZUEVNA-CHWSQXEVSA-N 1 2 315.417 4.146 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@@H+]2Cc2nc3ccccc3[nH]2)cc1 ZINC000548485136 341263293 /nfs/dbraw/zinc/26/32/93/341263293.db2.gz WAUZUDPFODBQBH-GOSISDBHSA-N 1 2 323.465 4.161 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@H+]2Cc2nc3ccccc3[nH]2)cc1 ZINC000548485136 341263294 /nfs/dbraw/zinc/26/32/94/341263294.db2.gz WAUZUDPFODBQBH-GOSISDBHSA-N 1 2 323.465 4.161 20 0 DIADLO Cc1cc(NC(=O)N2CCCC[C@@H]2c2[nH]cc[nH+]2)ccc1C1CC1 ZINC000548501094 341264345 /nfs/dbraw/zinc/26/43/45/341264345.db2.gz FLYCQEZTKGKBTA-QGZVFWFLSA-N 1 2 324.428 4.355 20 0 DIADLO Cc1cc(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)cc(C)c1F ZINC000136813451 341267652 /nfs/dbraw/zinc/26/76/52/341267652.db2.gz FUEBHNICRHEHHM-UHFFFAOYSA-N 1 2 323.371 4.095 20 0 DIADLO Cc1noc([C@@H](C)[N@H+](C)Cc2cccc(-c3ccccc3)c2)n1 ZINC000548779618 341275356 /nfs/dbraw/zinc/27/53/56/341275356.db2.gz CCVWADNBXZEDAV-CQSZACIVSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2cccc(-c3ccccc3)c2)n1 ZINC000548779618 341275357 /nfs/dbraw/zinc/27/53/57/341275357.db2.gz CCVWADNBXZEDAV-CQSZACIVSA-N 1 2 307.397 4.238 20 0 DIADLO CC[N@H+](Cc1nc(C)c2ccccc2n1)[C@@H](C)c1cccc(O)c1 ZINC000080931647 341276917 /nfs/dbraw/zinc/27/69/17/341276917.db2.gz FNBASAGEFPKWTR-HNNXBMFYSA-N 1 2 321.424 4.227 20 0 DIADLO CC[N@@H+](Cc1nc(C)c2ccccc2n1)[C@@H](C)c1cccc(O)c1 ZINC000080931647 341276918 /nfs/dbraw/zinc/27/69/18/341276918.db2.gz FNBASAGEFPKWTR-HNNXBMFYSA-N 1 2 321.424 4.227 20 0 DIADLO CCCCCC(=O)NCc1ccc2c(c1)[nH+]c(CC)n2C1CC1 ZINC000549019007 341283777 /nfs/dbraw/zinc/28/37/77/341283777.db2.gz UYVFBDCVXNELQX-UHFFFAOYSA-N 1 2 313.445 4.130 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nc(C(C)(C)C)no2)[C@H]1c1cccc(F)c1 ZINC000245409848 341291781 /nfs/dbraw/zinc/29/17/81/341291781.db2.gz OGDVOHSNIFZWCN-MLGOLLRUSA-N 1 2 317.408 4.089 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nc(C(C)(C)C)no2)[C@H]1c1cccc(F)c1 ZINC000245409848 341291782 /nfs/dbraw/zinc/29/17/82/341291782.db2.gz OGDVOHSNIFZWCN-MLGOLLRUSA-N 1 2 317.408 4.089 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2sccc2Cl)CCO1 ZINC000549352187 341292296 /nfs/dbraw/zinc/29/22/96/341292296.db2.gz YFKXHWPPLIDOQJ-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2sccc2Cl)CCO1 ZINC000549352187 341292297 /nfs/dbraw/zinc/29/22/97/341292297.db2.gz YFKXHWPPLIDOQJ-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO C[C@H]1C[N@H+](Cc2nc(-c3ccc(F)cc3)no2)[C@H]1c1ccccc1 ZINC000245422475 341292824 /nfs/dbraw/zinc/29/28/24/341292824.db2.gz IWCBXPZQXRUIQG-SCLBCKFNSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nc(-c3ccc(F)cc3)no2)[C@H]1c1ccccc1 ZINC000245422475 341292825 /nfs/dbraw/zinc/29/28/25/341292825.db2.gz IWCBXPZQXRUIQG-SCLBCKFNSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nccn2Cc2ccccc2)[C@H]1c1ccccc1 ZINC000245435873 341293817 /nfs/dbraw/zinc/29/38/17/341293817.db2.gz QQYRLQXCUXUZPU-DYESRHJHSA-N 1 2 317.436 4.124 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nccn2Cc2ccccc2)[C@H]1c1ccccc1 ZINC000245435873 341293818 /nfs/dbraw/zinc/29/38/18/341293818.db2.gz QQYRLQXCUXUZPU-DYESRHJHSA-N 1 2 317.436 4.124 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Br)cn2)[C@H]1c1ccccc1 ZINC000245441093 341294322 /nfs/dbraw/zinc/29/43/22/341294322.db2.gz VDGDKZXOGLICGW-MLGOLLRUSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Br)cn2)[C@H]1c1ccccc1 ZINC000245441093 341294323 /nfs/dbraw/zinc/29/43/23/341294323.db2.gz VDGDKZXOGLICGW-MLGOLLRUSA-N 1 2 317.230 4.037 20 0 DIADLO COc1ccc(F)c(C[NH2+]Cc2c(Cl)cccc2Cl)c1 ZINC000549727940 341301616 /nfs/dbraw/zinc/30/16/16/341301616.db2.gz GKIRQJDOJCGQDS-UHFFFAOYSA-N 1 2 314.187 4.431 20 0 DIADLO Cc1cc2[nH+]cn(CC(=O)c3c[nH]c4ccccc43)c2cc1C ZINC000549734423 341301817 /nfs/dbraw/zinc/30/18/17/341301817.db2.gz ZKQXRZFXMOJDHR-UHFFFAOYSA-N 1 2 303.365 4.017 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@H](c2ccccc2)c2cccnc2)c1 ZINC000549733975 341301825 /nfs/dbraw/zinc/30/18/25/341301825.db2.gz QHLYSBYFSYMWEB-HXUWFJFHSA-N 1 2 322.383 4.109 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2ccc(C(C)C)nc2C)cs1 ZINC000549770557 341302672 /nfs/dbraw/zinc/30/26/72/341302672.db2.gz MPSLTAIERKUFRI-UHFFFAOYSA-N 1 2 303.475 4.164 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2ccc(C(C)C)nc2C)cs1 ZINC000549770557 341302673 /nfs/dbraw/zinc/30/26/73/341302673.db2.gz MPSLTAIERKUFRI-UHFFFAOYSA-N 1 2 303.475 4.164 20 0 DIADLO CCCCCOc1cc(C[NH2+]CC(C)(F)F)ccc1OC ZINC000549865874 341305427 /nfs/dbraw/zinc/30/54/27/341305427.db2.gz FAUTVTNLEMEVIW-UHFFFAOYSA-N 1 2 301.377 4.009 20 0 DIADLO COc1ccc(C[NH2+]CC(C)(F)F)cc1OCc1ccccc1 ZINC000549865934 341305461 /nfs/dbraw/zinc/30/54/61/341305461.db2.gz GOWSNDOUJHMUCF-UHFFFAOYSA-N 1 2 321.367 4.019 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1ccc(F)cc1Cl ZINC000549999208 341308562 /nfs/dbraw/zinc/30/85/62/341308562.db2.gz WECSIELDJWAOFF-INIZCTEOSA-N 1 2 321.827 4.423 20 0 DIADLO Cc1ccc(Nc2nc(C[N@@H+]3CCC[C@H]3CF)cs2)cc1 ZINC000550410374 341316559 /nfs/dbraw/zinc/31/65/59/341316559.db2.gz SQFSBBZDSHARNB-HNNXBMFYSA-N 1 2 305.422 4.129 20 0 DIADLO Cc1ccc(Nc2nc(C[N@H+]3CCC[C@H]3CF)cs2)cc1 ZINC000550410374 341316560 /nfs/dbraw/zinc/31/65/60/341316560.db2.gz SQFSBBZDSHARNB-HNNXBMFYSA-N 1 2 305.422 4.129 20 0 DIADLO Fc1ccccc1C[N@@H+]1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000550444362 341317168 /nfs/dbraw/zinc/31/71/68/341317168.db2.gz RDRXQIKJLCDXDA-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccccc1C[N@H+]1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000550444362 341317169 /nfs/dbraw/zinc/31/71/69/341317169.db2.gz RDRXQIKJLCDXDA-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@@H+]1Cc2ccccc2C(C)(C)C1 ZINC000550645582 341320159 /nfs/dbraw/zinc/32/01/59/341320159.db2.gz DXJGMSIXRWORCN-CYBMUJFWSA-N 1 2 313.445 4.222 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@H+]1Cc2ccccc2C(C)(C)C1 ZINC000550645582 341320160 /nfs/dbraw/zinc/32/01/60/341320160.db2.gz DXJGMSIXRWORCN-CYBMUJFWSA-N 1 2 313.445 4.222 20 0 DIADLO CCCC[C@@H](CCC)C[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000550679987 341321236 /nfs/dbraw/zinc/32/12/36/341321236.db2.gz DUYBWRAZONQKTL-HIFRSBDPSA-N 1 2 306.479 4.152 20 0 DIADLO Cc1cc(N2[C@H](C)C[C@@H]3CCCC[C@@H]32)nc(-c2ccncc2)[nH+]1 ZINC000246121130 341327809 /nfs/dbraw/zinc/32/78/09/341327809.db2.gz IZBXKTVXPZRFDN-PVAVHDDUSA-N 1 2 308.429 4.004 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1cn2ccccc2n1 ZINC000551272999 341336472 /nfs/dbraw/zinc/33/64/72/341336472.db2.gz ZHWOAYLFHDYZLA-MGPUTAFESA-N 1 2 317.392 4.368 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1cn2ccccc2n1 ZINC000551277406 341336902 /nfs/dbraw/zinc/33/69/02/341336902.db2.gz DBVIMAFTRGQSRS-JTQLQIEISA-N 1 2 321.758 4.117 20 0 DIADLO FC(F)(F)CC1CC[NH+](Cc2cc(-c3ccco3)on2)CC1 ZINC000551405878 341340736 /nfs/dbraw/zinc/34/07/36/341340736.db2.gz DWFNNHDRQIPWGU-UHFFFAOYSA-N 1 2 314.307 4.099 20 0 DIADLO CC[C@H]1CCCC[C@H]1c1noc(Cn2c(C)[nH+]c3ccccc32)n1 ZINC000551536071 341344672 /nfs/dbraw/zinc/34/46/72/341344672.db2.gz PCTQYZVVROLLEC-LSDHHAIUSA-N 1 2 324.428 4.460 20 0 DIADLO CCOc1cc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)ccc1C ZINC000551572808 341346016 /nfs/dbraw/zinc/34/60/16/341346016.db2.gz KRKVSITYEXJBGH-GOSISDBHSA-N 1 2 307.397 4.318 20 0 DIADLO CC(C)c1cc(N2CCCC3(CCOCC3)C2)nc(C(C)C)[nH+]1 ZINC000551590186 341346712 /nfs/dbraw/zinc/34/67/12/341346712.db2.gz SYTCCDZRPXQAHP-UHFFFAOYSA-N 1 2 317.477 4.120 20 0 DIADLO Cc1ccc2[nH+]c(CNc3ccccc3Br)cn2c1 ZINC000551590922 341346774 /nfs/dbraw/zinc/34/67/74/341346774.db2.gz PNJNARHIWYJHRT-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO Cc1c(C[N@@H+](C)[C@@H](C)c2cc(Cl)ccc2Cl)cnn1C ZINC000551940666 341355734 /nfs/dbraw/zinc/35/57/34/341355734.db2.gz OZPZLRNELLQCOR-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO Cc1c(C[N@H+](C)[C@@H](C)c2cc(Cl)ccc2Cl)cnn1C ZINC000551940666 341355735 /nfs/dbraw/zinc/35/57/35/341355735.db2.gz OZPZLRNELLQCOR-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO Cc1cc(NC(=O)[C@H](C)c2ccc(Cl)c(Cl)c2)c(C)c[nH+]1 ZINC000551957993 341356080 /nfs/dbraw/zinc/35/60/80/341356080.db2.gz OQRDAEVSHJATLX-LLVKDONJSA-N 1 2 323.223 4.169 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC2CCC(O)CC2)c1 ZINC000552065348 341366679 /nfs/dbraw/zinc/36/66/79/341366679.db2.gz RRELGHHSPQUFLX-UHFFFAOYSA-N 1 2 313.445 4.066 20 0 DIADLO C[C@]1(c2ccccc2)CCC[N@H+](Cc2nnsc2Cl)CC1 ZINC000552092304 341369206 /nfs/dbraw/zinc/36/92/06/341369206.db2.gz SHMFYIFFTOYDQK-INIZCTEOSA-N 1 2 321.877 4.135 20 0 DIADLO C[C@]1(c2ccccc2)CCC[N@@H+](Cc2nnsc2Cl)CC1 ZINC000552092304 341369207 /nfs/dbraw/zinc/36/92/07/341369207.db2.gz SHMFYIFFTOYDQK-INIZCTEOSA-N 1 2 321.877 4.135 20 0 DIADLO Cc1ncc(C[N@H+]2C[C@@H](c3cc(C)ccc3C)OC[C@@H]2C)s1 ZINC000247709321 341369492 /nfs/dbraw/zinc/36/94/92/341369492.db2.gz ZSNAMJNQXBTIHL-KSSFIOAISA-N 1 2 316.470 4.030 20 0 DIADLO Cc1ncc(C[N@@H+]2C[C@@H](c3cc(C)ccc3C)OC[C@@H]2C)s1 ZINC000247709321 341369493 /nfs/dbraw/zinc/36/94/93/341369493.db2.gz ZSNAMJNQXBTIHL-KSSFIOAISA-N 1 2 316.470 4.030 20 0 DIADLO COc1ccc(SCc2[nH+]ccn2Cc2ccccc2)cc1 ZINC000247919116 341371215 /nfs/dbraw/zinc/37/12/15/341371215.db2.gz NPSZHQNSHOSQFK-UHFFFAOYSA-N 1 2 310.422 4.232 20 0 DIADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)c1cccs1 ZINC000552213329 341378731 /nfs/dbraw/zinc/37/87/31/341378731.db2.gz NZMNAXNSWNLBQC-UHFFFAOYSA-N 1 2 323.421 4.200 20 0 DIADLO Cc1cccc(C([NH2+][C@H](C)c2ncc[nH]2)c2cccc(C)c2)c1 ZINC000552244147 341380963 /nfs/dbraw/zinc/38/09/63/341380963.db2.gz WDAINXFTMWOHKW-MRXNPFEDSA-N 1 2 305.425 4.467 20 0 DIADLO Cc1cccc(COc2cccc(N[C@H](C)c3[nH]cc[nH+]3)c2)c1 ZINC000552283062 341384062 /nfs/dbraw/zinc/38/40/62/341384062.db2.gz WTFFCSQEMZPLGM-OAHLLOKOSA-N 1 2 307.397 4.470 20 0 DIADLO Cc1ccsc1C(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000089870211 341410228 /nfs/dbraw/zinc/41/02/28/341410228.db2.gz ZKIMJAUQNKESOQ-UHFFFAOYSA-N 1 2 311.410 4.073 20 0 DIADLO Cc1ccccc1C(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000089868930 341410317 /nfs/dbraw/zinc/41/03/17/341410317.db2.gz HSDPOMTZTLLDMQ-UHFFFAOYSA-N 1 2 305.381 4.011 20 0 DIADLO CO[C@]1(C)CCCN(c2cc[nH+]c3c(Cl)cccc23)CC1 ZINC000553561626 341431565 /nfs/dbraw/zinc/43/15/65/341431565.db2.gz AQALGNQEEKJXTG-QGZVFWFLSA-N 1 2 304.821 4.284 20 0 DIADLO CC(C)(C[NH2+][C@H](CCc1ccccc1)C(F)F)C(F)(F)F ZINC000554721459 341462090 /nfs/dbraw/zinc/46/20/90/341462090.db2.gz QWCKVXOSOKPMOY-GFCCVEGCSA-N 1 2 309.322 4.431 20 0 DIADLO Cc1cc[nH+]cc1CCCNc1ccccc1OCC(F)(F)F ZINC000554857925 341467005 /nfs/dbraw/zinc/46/70/05/341467005.db2.gz DCRJNWKNVGFGPW-UHFFFAOYSA-N 1 2 324.346 4.376 20 0 DIADLO C[C@@H](Nc1ccc(Cn2cc[nH+]c2)cn1)[C@@H](C)C1CCCCC1 ZINC000554878251 341467816 /nfs/dbraw/zinc/46/78/16/341467816.db2.gz HFELXUPSQQOFFO-HZPDHXFCSA-N 1 2 312.461 4.343 20 0 DIADLO CC(F)(F)C[NH2+][C@@H](c1ccc(Br)cc1)C1CC1 ZINC000556227000 341498211 /nfs/dbraw/zinc/49/82/11/341498211.db2.gz FTUSWFWCNGWTSC-GFCCVEGCSA-N 1 2 304.178 4.145 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@@H](C)c2ccncc2F)c2ccccn2)cc1 ZINC000556245064 341499107 /nfs/dbraw/zinc/49/91/07/341499107.db2.gz MAASNHIPWAJJSM-YWZLYKJASA-N 1 2 321.399 4.364 20 0 DIADLO CC(C)[C@@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)c1ccccc1Cl ZINC000565306524 341523241 /nfs/dbraw/zinc/52/32/41/341523241.db2.gz BMLZWYUGXUSAPK-CXAGYDPISA-N 1 2 319.836 4.001 20 0 DIADLO OCc1ccc(NCc2ccc(-c3ccc(F)cc3)s2)[nH+]c1 ZINC000565395365 341526056 /nfs/dbraw/zinc/52/60/56/341526056.db2.gz QZJYFMMDMQAJSA-UHFFFAOYSA-N 1 2 314.385 4.054 20 0 DIADLO CCC(CC)[C@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)c1cccs1 ZINC000565660595 341534365 /nfs/dbraw/zinc/53/43/65/341534365.db2.gz JLZCNEABEKQCGD-DYVFJYSZSA-N 1 2 319.474 4.189 20 0 DIADLO CCOc1cccc(Cl)c1C[NH2+][C@H](CCOC)c1ccco1 ZINC000565841359 341540010 /nfs/dbraw/zinc/54/00/10/341540010.db2.gz VOSJUJWQOGWLRG-OAHLLOKOSA-N 1 2 323.820 4.199 20 0 DIADLO CC(F)(F)C[NH2+]Cc1cnn(C2CCCC2)c1-c1ccccc1 ZINC000566077354 341547160 /nfs/dbraw/zinc/54/71/60/341547160.db2.gz KLTAMBYILWPYEQ-UHFFFAOYSA-N 1 2 319.399 4.410 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1cc(F)cc(F)c1 ZINC000163195029 341564609 /nfs/dbraw/zinc/56/46/09/341564609.db2.gz MXDKIPGUWHWNRI-ZDUSSCGKSA-N 1 2 313.351 4.001 20 0 DIADLO Cc1cc2[nH+]cn(Cc3ncc(-c4ccccc4F)o3)c2cc1C ZINC000154465320 341589606 /nfs/dbraw/zinc/58/96/06/341589606.db2.gz GUUWLFGSRQUGDC-UHFFFAOYSA-N 1 2 321.355 4.496 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2nn(-c3ccccc3)cc21)c1cscn1 ZINC000567250513 341591328 /nfs/dbraw/zinc/59/13/28/341591328.db2.gz NBZZLKFCUWPNPK-CZUORRHYSA-N 1 2 324.453 4.057 20 0 DIADLO Cc1ccccc1[C@H](CC(C)C)NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000567392444 341600897 /nfs/dbraw/zinc/60/08/97/341600897.db2.gz RBSLRJWBJPWQLG-AEFFLSMTSA-N 1 2 313.445 4.046 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CCCC2)no1)c1ccc(Cl)cc1 ZINC000155938838 341615246 /nfs/dbraw/zinc/61/52/46/341615246.db2.gz VOWURJVCBSJVSS-LLVKDONJSA-N 1 2 305.809 4.231 20 0 DIADLO Cc1ccc2cc([C@H](C)[NH2+]Cc3nnc(C4CC4)s3)oc2c1 ZINC000569199178 341693856 /nfs/dbraw/zinc/69/38/56/341693856.db2.gz XVMYQKNGEWOBIU-NSHDSACASA-N 1 2 313.426 4.321 20 0 DIADLO COc1cc[nH+]cc1CSC[C@@H]1CCC2(CCCCC2)O1 ZINC000572638679 341698674 /nfs/dbraw/zinc/69/86/74/341698674.db2.gz PWXMHBRCVYECCB-HNNXBMFYSA-N 1 2 307.459 4.205 20 0 DIADLO Fc1cncc([C@H]([NH2+]CC(F)(F)c2ccccc2)C2CC2)c1 ZINC000572805473 341704785 /nfs/dbraw/zinc/70/47/85/341704785.db2.gz SMWYHQBERBQIKM-MRXNPFEDSA-N 1 2 306.331 4.053 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@@H](c2ccccc2F)[C@H](C)O)cs1 ZINC000572967317 341711568 /nfs/dbraw/zinc/71/15/68/341711568.db2.gz YRTKWWZXXKKMTL-MQIPJXDCSA-N 1 2 322.449 4.178 20 0 DIADLO Cc1[nH+]cc(CNc2cc(F)c(F)c(F)c2)n1-c1ccccc1 ZINC000336868504 341809287 /nfs/dbraw/zinc/80/92/87/341809287.db2.gz UQRFBWZMDFXIOO-UHFFFAOYSA-N 1 2 317.314 4.210 20 0 DIADLO CC(C)Cn1ccc2cc(NC(=O)C[C@@H](C)n3cc[nH+]c3)ccc21 ZINC000576470223 341848045 /nfs/dbraw/zinc/84/80/45/341848045.db2.gz VRGQXXHKCUCQHG-OAHLLOKOSA-N 1 2 324.428 4.084 20 0 DIADLO Cc1cccc(CCC(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1 ZINC000576801072 341863921 /nfs/dbraw/zinc/86/39/21/341863921.db2.gz AEMPPGZPRNMJOI-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO C[C@H](CC(=O)N1c2ccccc2[C@@H](C)CC1(C)C)n1cc[nH+]c1 ZINC000580572230 341879137 /nfs/dbraw/zinc/87/91/37/341879137.db2.gz UUYPBEPYRGEQBH-LSDHHAIUSA-N 1 2 311.429 4.153 20 0 DIADLO Cc1nc(N2CC(C)(C)[C@H]2c2cccs2)c2c([nH+]1)CCCC2 ZINC000577317952 341903905 /nfs/dbraw/zinc/90/39/05/341903905.db2.gz PVYZRRSPQZXDOT-MRXNPFEDSA-N 1 2 313.470 4.313 20 0 DIADLO CC(C)(C)c1cc(C[NH+]2CCC(c3ccccc3F)CC2)no1 ZINC000577664357 341928120 /nfs/dbraw/zinc/92/81/20/341928120.db2.gz OCPCUHAUKAORIT-UHFFFAOYSA-N 1 2 316.420 4.491 20 0 DIADLO C[C@@H](c1ccccc1Br)[NH+]1CC(C(F)(F)F)C1 ZINC000578025065 341973699 /nfs/dbraw/zinc/97/36/99/341973699.db2.gz JPYVNZXDQGCSBO-QMMMGPOBSA-N 1 2 308.141 4.004 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@H](C)c2ccc(F)c3ccccc32)n1 ZINC000488007118 517872000 /nfs/dbraw/zinc/87/20/00/517872000.db2.gz ODQWJZXDKJKJGC-NEPJUHHUSA-N 1 2 313.376 4.336 20 0 DIADLO Cc1cc(N2C[C@H](c3ccccc3C)C[C@H]2C)nc(C2CC2)[nH+]1 ZINC000523086802 518187494 /nfs/dbraw/zinc/18/74/94/518187494.db2.gz XOMGALHULHNNNL-NVXWUHKLSA-N 1 2 307.441 4.353 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1ccc(C(C)C)nc1 ZINC000373660872 518188145 /nfs/dbraw/zinc/18/81/45/518188145.db2.gz RGTYILWVFHPOGI-UHFFFAOYSA-N 1 2 320.396 4.156 20 0 DIADLO Brc1cccc(C[N@H+](Cc2cscn2)C2CC2)c1 ZINC000338337362 518220383 /nfs/dbraw/zinc/22/03/83/518220383.db2.gz OQMIBYYVANBQDI-UHFFFAOYSA-N 1 2 323.259 4.070 20 0 DIADLO Brc1cccc(C[N@@H+](Cc2cscn2)C2CC2)c1 ZINC000338337362 518220393 /nfs/dbraw/zinc/22/03/93/518220393.db2.gz OQMIBYYVANBQDI-UHFFFAOYSA-N 1 2 323.259 4.070 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1cc2ccccc2[nH]c1=O ZINC000338329350 518898925 /nfs/dbraw/zinc/89/89/25/518898925.db2.gz HWBBQPWNNZEBRG-UHFFFAOYSA-N 1 2 323.396 4.125 20 0 DIADLO CC(C)(C)c1nc(NCc2csc(-c3ccco3)n2)cc[nH+]1 ZINC000154879678 519119052 /nfs/dbraw/zinc/11/90/52/519119052.db2.gz XKDIAGDWCNFYBD-UHFFFAOYSA-N 1 2 314.414 4.103 20 0 DIADLO CC(C)Oc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000338150387 519779846 /nfs/dbraw/zinc/77/98/46/519779846.db2.gz RQRUEVNDCQYGGJ-UHFFFAOYSA-N 1 2 307.397 4.272 20 0 DIADLO CC(C)Sc1c(Cl)cccc1NC(=O)CCn1cc[nH+]c1 ZINC000266031458 519787625 /nfs/dbraw/zinc/78/76/25/519787625.db2.gz ZTXQFMBGSDASLG-UHFFFAOYSA-N 1 2 323.849 4.066 20 0 DIADLO CC(C)[C@@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1ccc(F)cc1 ZINC000337379401 519799665 /nfs/dbraw/zinc/79/96/65/519799665.db2.gz CKDBYPLFFACUGD-XHDPSFHLSA-N 1 2 303.381 4.134 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1ccc(F)cc1 ZINC000337379400 519821432 /nfs/dbraw/zinc/82/14/32/519821432.db2.gz CKDBYPLFFACUGD-NHYWBVRUSA-N 1 2 303.381 4.134 20 0 DIADLO CC(C)[C@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1ccc(F)cc1 ZINC000337379398 519821526 /nfs/dbraw/zinc/82/15/26/519821526.db2.gz CKDBYPLFFACUGD-ABAIWWIYSA-N 1 2 303.381 4.134 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000181290318 519887709 /nfs/dbraw/zinc/88/77/09/519887709.db2.gz IOKLKJPRLAJDPR-AWEZNQCLSA-N 1 2 322.412 4.106 20 0 DIADLO CC(C)n1cc[nH+]c1CN(Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000337349984 520027115 /nfs/dbraw/zinc/02/71/15/520027115.db2.gz RBJMTFNFCMNSHQ-RHSMWYFYSA-N 1 2 313.445 4.345 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+]2CC[C@H]2c2ccccc2)cs1 ZINC000336842307 520480482 /nfs/dbraw/zinc/48/04/82/520480482.db2.gz RTPKLSKHGUMOBB-CJNGLKHVSA-N 1 2 302.443 4.188 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+]2CC[C@H]2c2ccccc2)cs1 ZINC000336842307 520480486 /nfs/dbraw/zinc/48/04/86/520480486.db2.gz RTPKLSKHGUMOBB-CJNGLKHVSA-N 1 2 302.443 4.188 20 0 DIADLO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000336828534 520628101 /nfs/dbraw/zinc/62/81/01/520628101.db2.gz AEWAXGIQYAPFJU-NSHDSACASA-N 1 2 304.381 4.183 20 0 DIADLO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1csc(C2CC2)n1 ZINC000336828534 520628110 /nfs/dbraw/zinc/62/81/10/520628110.db2.gz AEWAXGIQYAPFJU-NSHDSACASA-N 1 2 304.381 4.183 20 0 DIADLO CC1(C2CC2)CC[NH+](Cc2ncc(C(F)(F)F)s2)CC1 ZINC000356301166 520687159 /nfs/dbraw/zinc/68/71/59/520687159.db2.gz TXDKBLQZSCKRJB-UHFFFAOYSA-N 1 2 304.381 4.174 20 0 DIADLO CCCCOc1ccc(C[NH2+]Cc2cscn2)cc1Cl ZINC000189085822 520880440 /nfs/dbraw/zinc/88/04/40/520880440.db2.gz XHUJBJVPPPSPSQ-UHFFFAOYSA-N 1 2 310.850 4.265 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)[C@@H](C)c1nc(C2CC2)no1 ZINC000132116062 521313257 /nfs/dbraw/zinc/31/32/57/521313257.db2.gz NRSAORPDVYQERR-VIFPVBQESA-N 1 2 311.838 4.245 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)[C@@H](C)c1nc(C2CC2)no1 ZINC000132116062 521313265 /nfs/dbraw/zinc/31/32/65/521313265.db2.gz NRSAORPDVYQERR-VIFPVBQESA-N 1 2 311.838 4.245 20 0 DIADLO CCN(Cc1ccccc1Cl)C(=O)Nc1cc[nH+]c(C)c1 ZINC000119979392 521379651 /nfs/dbraw/zinc/37/96/51/521379651.db2.gz GHYCHFQTORMFKC-UHFFFAOYSA-N 1 2 303.793 4.097 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)n1 ZINC000180279078 521585503 /nfs/dbraw/zinc/58/55/03/521585503.db2.gz PHDAKXWPSOCEAY-GOSISDBHSA-N 1 2 317.408 4.182 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cc(OC)ccc2F)c1 ZINC000339332633 521719812 /nfs/dbraw/zinc/71/98/12/521719812.db2.gz RQZCQBHLJGIXRU-UHFFFAOYSA-N 1 2 306.406 4.095 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@@H](C)c2cc(C)cc(C)c2)n1 ZINC000182876828 521721746 /nfs/dbraw/zinc/72/17/46/521721746.db2.gz NFZORZDFXPKLRH-KBPBESRZSA-N 1 2 319.474 4.351 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+][C@H](C)c2nnc(C)s2)cc1 ZINC000338290160 521751152 /nfs/dbraw/zinc/75/11/52/521751152.db2.gz WAPXMEPMEBMVQG-WDEREUQCSA-N 1 2 307.488 4.370 20 0 DIADLO COCC[C@@H](C)[NH2+]c1ccc(N2CCc3sccc3C2)cc1 ZINC000183051798 521800808 /nfs/dbraw/zinc/80/08/08/521800808.db2.gz SLLMLMYPPKUAPU-CQSZACIVSA-N 1 2 316.470 4.148 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)CCc1c[nH]c2c1cccc2C ZINC000265979547 522079053 /nfs/dbraw/zinc/07/90/53/522079053.db2.gz YLTROCCBWJORAZ-UHFFFAOYSA-N 1 2 307.397 4.005 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1OC)c1ccc(C)o1 ZINC000156503404 522371534 /nfs/dbraw/zinc/37/15/34/522371534.db2.gz VXKPBMGEQXVNLO-SWLSCSKDSA-N 1 2 323.820 4.288 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1OC)c1ccc(C)o1 ZINC000156503655 522378902 /nfs/dbraw/zinc/37/89/02/522378902.db2.gz VXKPBMGEQXVNLO-IUODEOHRSA-N 1 2 323.820 4.288 20 0 DIADLO COC(=O)c1oc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2F)cc1C ZINC000181577189 522410769 /nfs/dbraw/zinc/41/07/69/522410769.db2.gz USAALIDTCDJGDL-QWRGUYRKSA-N 1 2 323.339 4.065 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(OC)cc2F)cs1 ZINC000162285432 522423761 /nfs/dbraw/zinc/42/37/61/522423761.db2.gz PAWKDFGYWLLSFT-WDEREUQCSA-N 1 2 308.422 4.265 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cc(C)ccc2OC)cs1 ZINC000162338437 522424118 /nfs/dbraw/zinc/42/41/18/522424118.db2.gz ITTUSBDUEXWSSJ-QWHCGFSZSA-N 1 2 304.459 4.434 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1OC)c1ccc(C)o1 ZINC000156503535 522759769 /nfs/dbraw/zinc/75/97/69/522759769.db2.gz VXKPBMGEQXVNLO-WFASDCNBSA-N 1 2 323.820 4.288 20 0 DIADLO CC[C@H](Nc1cccc(-c2nc(C)c(C)o2)c1)c1[nH+]ccn1C ZINC000183018465 522771381 /nfs/dbraw/zinc/77/13/81/522771381.db2.gz NKIWAWBXMJDOPK-INIZCTEOSA-N 1 2 310.401 4.255 20 0 DIADLO CCc1noc(C)c1C[NH2+]Cc1csc(Cl)c1Cl ZINC000339439299 522844911 /nfs/dbraw/zinc/84/49/11/522844911.db2.gz TXHFZBXOILSZAJ-UHFFFAOYSA-N 1 2 305.230 4.204 20 0 DIADLO CCc1noc([C@@H](C)[N@H+](C)Cc2c3ccccc3oc2CC)n1 ZINC000104667706 522902851 /nfs/dbraw/zinc/90/28/51/522902851.db2.gz HLPDRFYSUDKPNQ-GFCCVEGCSA-N 1 2 313.401 4.134 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+](C)Cc2c3ccccc3oc2CC)n1 ZINC000104667706 522902860 /nfs/dbraw/zinc/90/28/60/522902860.db2.gz HLPDRFYSUDKPNQ-GFCCVEGCSA-N 1 2 313.401 4.134 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3cccnc3)cc2)n1 ZINC000181314305 522907991 /nfs/dbraw/zinc/90/79/91/522907991.db2.gz MWFRGMGHZPVMJE-UONOGXRCSA-N 1 2 322.412 4.106 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nc(C(C)C)no1)c1ccc(OC)cc1 ZINC000181828278 522916229 /nfs/dbraw/zinc/91/62/29/522916229.db2.gz JFCFIUATQXQFCB-SWLSCSKDSA-N 1 2 303.406 4.004 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1c(Cl)ccc2cccnc21 ZINC000339604418 522929157 /nfs/dbraw/zinc/92/91/57/522929157.db2.gz ODUANMFIXYGQDK-UHFFFAOYSA-N 1 2 315.804 4.071 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1c(Cl)ccc2cccnc21 ZINC000339604418 522929163 /nfs/dbraw/zinc/92/91/63/522929163.db2.gz ODUANMFIXYGQDK-UHFFFAOYSA-N 1 2 315.804 4.071 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1ccccn1)c1nc(C(F)(F)F)cs1 ZINC000159275402 522938906 /nfs/dbraw/zinc/93/89/06/522938906.db2.gz CULJXNCLIPUWDR-NXEZZACHSA-N 1 2 315.364 4.359 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nc2ccccc2o1)c1nc(C)cs1 ZINC000182442764 522941271 /nfs/dbraw/zinc/94/12/71/522941271.db2.gz PXSXVNPNZDBAAH-VXGBXAGGSA-N 1 2 301.415 4.395 20 0 DIADLO CC[C@@H](Nc1cccc(-c2csc(C)n2)c1)c1[nH+]ccn1C ZINC000182804382 522960051 /nfs/dbraw/zinc/96/00/51/522960051.db2.gz JUOCCKFYZFUCFA-OAHLLOKOSA-N 1 2 312.442 4.415 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1coc(-c2cccs2)n1 ZINC000130084912 523121122 /nfs/dbraw/zinc/12/11/22/523121122.db2.gz MQGVHOYUAYCIGG-HNNXBMFYSA-N 1 2 313.426 4.381 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1coc(-c2cccs2)n1 ZINC000130084912 523121127 /nfs/dbraw/zinc/12/11/27/523121127.db2.gz MQGVHOYUAYCIGG-HNNXBMFYSA-N 1 2 313.426 4.381 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](Cc2cccs2)C(C)C)cs1 ZINC000267078310 523470373 /nfs/dbraw/zinc/47/03/73/523470373.db2.gz XHGDKWXXHOTGBI-LBPRGKRZSA-N 1 2 310.488 4.323 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](Cc2cccs2)C(C)C)cs1 ZINC000267078310 523470386 /nfs/dbraw/zinc/47/03/86/523470386.db2.gz XHGDKWXXHOTGBI-LBPRGKRZSA-N 1 2 310.488 4.323 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1ccc(Cl)cc1 ZINC000339154177 523551942 /nfs/dbraw/zinc/55/19/42/523551942.db2.gz WWPOAXGMRGAXDA-INIZCTEOSA-N 1 2 303.837 4.284 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1ccc(Cl)cc1 ZINC000339154177 523551949 /nfs/dbraw/zinc/55/19/49/523551949.db2.gz WWPOAXGMRGAXDA-INIZCTEOSA-N 1 2 303.837 4.284 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1nc(C(C)C)cs1 ZINC000128603634 523859226 /nfs/dbraw/zinc/85/92/26/523859226.db2.gz AVJWXVLXAZMWCS-ZDUSSCGKSA-N 1 2 304.459 4.434 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+]Cc2nc(C(C)(C)C)cs2)o1 ZINC000184779810 524032143 /nfs/dbraw/zinc/03/21/43/524032143.db2.gz AZQUFQAVGSSNNX-CYBMUJFWSA-N 1 2 322.474 4.073 20 0 DIADLO COc1cccc([C@@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000124341243 524092051 /nfs/dbraw/zinc/09/20/51/524092051.db2.gz QRSPRMOVRUPPJJ-ZIAGYGMSSA-N 1 2 323.396 4.157 20 0 DIADLO C[C@H]1CCCN1C(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000267818960 524117611 /nfs/dbraw/zinc/11/76/11/524117611.db2.gz XKQNPQBMMCOYSY-LBPRGKRZSA-N 1 2 316.788 4.152 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nc(Cc3ccccc3)no2)c(C)c1 ZINC000237483802 524605561 /nfs/dbraw/zinc/60/55/61/524605561.db2.gz IRQORIYITFBCCW-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1ccsc1C)c1ccccn1 ZINC000339332073 524741895 /nfs/dbraw/zinc/74/18/95/524741895.db2.gz ZXJFYOUTOHAEEJ-LJQANCHMSA-N 1 2 324.449 4.339 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2noc(C(C)C)n2)C(C)(C)C)c1 ZINC000180797532 524837822 /nfs/dbraw/zinc/83/78/22/524837822.db2.gz FJWIOKSDFFLSTE-MRXNPFEDSA-N 1 2 301.434 4.378 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2nnc(C(C)C)o2)C(C)(C)C)c1 ZINC000180792210 524838138 /nfs/dbraw/zinc/83/81/38/524838138.db2.gz VOPQIPOITOFMFP-MRXNPFEDSA-N 1 2 301.434 4.378 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2nc(C(C)C)no2)C(C)(C)C)c1 ZINC000180791131 524839193 /nfs/dbraw/zinc/83/91/93/524839193.db2.gz BUYQRRLILBQZOS-MRXNPFEDSA-N 1 2 301.434 4.378 20 0 DIADLO COc1ccc(OC)c([C@H](C)[NH2+]Cc2nc(C(C)C)cs2)c1 ZINC000128541547 524905409 /nfs/dbraw/zinc/90/54/09/524905409.db2.gz OIZLFYFJZWSMGD-LBPRGKRZSA-N 1 2 320.458 4.135 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@@H](C)C[C@H]2c2ccco2)c(C)[nH+]1 ZINC000162259695 525138719 /nfs/dbraw/zinc/13/87/19/525138719.db2.gz ONNPJIGAZWGUCE-WBMJQRKESA-N 1 2 313.401 4.297 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@@H](c3ccccc3C)C2)c(C)[nH+]1 ZINC000268050003 525141339 /nfs/dbraw/zinc/14/13/39/525141339.db2.gz ZTLMWDJGOZUUIH-MRXNPFEDSA-N 1 2 309.413 4.028 20 0 DIADLO C[C@@H]1COC[C@@H](c2ccccc2)[N@@H+]1Cc1cnc2ccccc2c1 ZINC000337178760 525146478 /nfs/dbraw/zinc/14/64/78/525146478.db2.gz KPQYLWYUEXBSQR-IERDGZPVSA-N 1 2 318.420 4.197 20 0 DIADLO C[C@@H]1COC[C@@H](c2ccccc2)[N@H+]1Cc1cnc2ccccc2c1 ZINC000337178760 525146485 /nfs/dbraw/zinc/14/64/85/525146485.db2.gz KPQYLWYUEXBSQR-IERDGZPVSA-N 1 2 318.420 4.197 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ncc(C(C)(C)C)o2)cc1 ZINC000267093628 525162517 /nfs/dbraw/zinc/16/25/17/525162517.db2.gz XQDVVJBLXRPRGU-CHWSQXEVSA-N 1 2 302.418 4.393 20 0 DIADLO C[C@@H](NC(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1)C1CC1 ZINC000265012835 525331744 /nfs/dbraw/zinc/33/17/44/525331744.db2.gz AVJISSBGNXMFMX-LLVKDONJSA-N 1 2 316.788 4.056 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cc(-c3ccccc3)on2)o1 ZINC000237371314 525343314 /nfs/dbraw/zinc/34/33/14/525343314.db2.gz WUFYGJLVLLXBCN-DYVFJYSZSA-N 1 2 308.381 4.348 20 0 DIADLO Cc1ccccc1[C@@H](C)[NH2+][C@H](c1nccn1C)c1cccc(F)c1 ZINC000128479005 525362453 /nfs/dbraw/zinc/36/24/53/525362453.db2.gz XJJAYBCIBGWXTA-BEFAXECRSA-N 1 2 323.415 4.308 20 0 DIADLO C[C@H]([NH2+]Cc1nccn1CCc1ccccc1)c1ccccc1F ZINC000164242399 525491397 /nfs/dbraw/zinc/49/13/97/525491397.db2.gz ZPXIPCLUMSAXLL-INIZCTEOSA-N 1 2 323.415 4.116 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2nc(C(F)(F)F)cs2)o1 ZINC000123273392 525510209 /nfs/dbraw/zinc/51/02/09/525510209.db2.gz WLNLGIHFNYKXNG-PSASIEDQSA-N 1 2 316.348 4.168 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)cc1F)c1nc2c(s1)CCCC2 ZINC000265457617 525522754 /nfs/dbraw/zinc/52/27/54/525522754.db2.gz DAIMNRQGWKQTSP-SNVBAGLBSA-N 1 2 308.397 4.151 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1F)c1nc(C2CCCCC2)no1 ZINC000237347375 525537944 /nfs/dbraw/zinc/53/79/44/525537944.db2.gz APVWERKZBYIZPH-GFCCVEGCSA-N 1 2 303.381 4.107 20 0 DIADLO C[C@@H]([NH2+]Cc1nccn1CCc1ccccc1)c1ccccc1F ZINC000164242502 525564319 /nfs/dbraw/zinc/56/43/19/525564319.db2.gz ZPXIPCLUMSAXLL-MRXNPFEDSA-N 1 2 323.415 4.116 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(Cc2ccccc2)no1)c1cccs1 ZINC000173811695 525621896 /nfs/dbraw/zinc/62/18/96/525621896.db2.gz XFZJFIGAXAADBI-OLZOCXBDSA-N 1 2 313.426 4.134 20 0 DIADLO COc1ccc2cc(C[N@H+](C)Cc3nccn3C(C)C)ccc2c1 ZINC000337327071 525625599 /nfs/dbraw/zinc/62/55/99/525625599.db2.gz PSPFATZKXDJOOA-UHFFFAOYSA-N 1 2 323.440 4.258 20 0 DIADLO COc1ccc2cc(C[N@@H+](C)Cc3nccn3C(C)C)ccc2c1 ZINC000337327071 525625601 /nfs/dbraw/zinc/62/56/01/525625601.db2.gz PSPFATZKXDJOOA-UHFFFAOYSA-N 1 2 323.440 4.258 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1noc(-c2ccccc2)n1 ZINC000124254030 525650501 /nfs/dbraw/zinc/65/05/01/525650501.db2.gz CPFBINPCOZNOQH-SJKOYZFVSA-N 1 2 323.371 4.214 20 0 DIADLO Cc1ccsc1C[NH2+][C@@H](C)c1nc(C2CCCCC2)no1 ZINC000237527090 525861060 /nfs/dbraw/zinc/86/10/60/525861060.db2.gz RTIWIQUEGDPIKK-LBPRGKRZSA-N 1 2 305.447 4.338 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2[C@@H](C)c2nc3ccccc3c(=O)[nH]2)o1 ZINC000265354101 526012431 /nfs/dbraw/zinc/01/24/31/526012431.db2.gz KTRFSMDZVZZTKR-XJKSGUPXSA-N 1 2 323.396 4.135 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2[C@@H](C)c2nc3ccccc3c(=O)[nH]2)o1 ZINC000265354101 526012439 /nfs/dbraw/zinc/01/24/39/526012439.db2.gz KTRFSMDZVZZTKR-XJKSGUPXSA-N 1 2 323.396 4.135 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@H](c2ccccc2)C(C)(C)C)no1 ZINC000299079885 534900775 /nfs/dbraw/zinc/90/07/75/534900775.db2.gz ROVQHLRECUYYGU-OAHLLOKOSA-N 1 2 301.434 4.244 20 0 DIADLO Cc1cc(-c2nnc(C[N@H+]3C[C@H](C)[C@H]3c3ccccc3)o2)c(C)o1 ZINC000336878259 526057278 /nfs/dbraw/zinc/05/72/78/526057278.db2.gz CRKOWEQIWMCALE-SGTLLEGYSA-N 1 2 323.396 4.139 20 0 DIADLO Cc1cc(-c2nnc(C[N@@H+]3C[C@H](C)[C@H]3c3ccccc3)o2)c(C)o1 ZINC000336878259 526057286 /nfs/dbraw/zinc/05/72/86/526057286.db2.gz CRKOWEQIWMCALE-SGTLLEGYSA-N 1 2 323.396 4.139 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[NH+]1CCC(C(=O)C(F)(F)F)CC1 ZINC000186059466 526078123 /nfs/dbraw/zinc/07/81/23/526078123.db2.gz REOILFAZRVWVIW-SNVBAGLBSA-N 1 2 319.754 4.244 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]C1(c2nc(C)cs2)CCC1 ZINC000338296097 526103053 /nfs/dbraw/zinc/10/30/53/526103053.db2.gz LTYRFGWHNASTMT-UHFFFAOYSA-N 1 2 322.861 4.283 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000127610035 526153376 /nfs/dbraw/zinc/15/33/76/526153376.db2.gz IKTQTEAKEPCHKG-LBPRGKRZSA-N 1 2 316.355 4.019 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000127610035 526153384 /nfs/dbraw/zinc/15/33/84/526153384.db2.gz IKTQTEAKEPCHKG-LBPRGKRZSA-N 1 2 316.355 4.019 20 0 DIADLO CSc1ccccc1[C@H](C)[NH2+]Cc1nc(C2CCCC2)no1 ZINC000337381770 526193862 /nfs/dbraw/zinc/19/38/62/526193862.db2.gz UYDNCDMIZSJOLW-LBPRGKRZSA-N 1 2 317.458 4.300 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@@H](C)Sc1ccccc1Cl ZINC000107293993 526240847 /nfs/dbraw/zinc/24/08/47/526240847.db2.gz DXDWMFFIUBPNQX-LLVKDONJSA-N 1 2 306.818 4.163 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2cnc(-c3ccco3)s2)c(F)c1 ZINC000339523682 526303098 /nfs/dbraw/zinc/30/30/98/526303098.db2.gz PPHHPULNGJAZPB-UHFFFAOYSA-N 1 2 324.327 4.110 20 0 DIADLO Cc1csc(C2([NH2+][C@@H](C)c3c(F)cccc3F)CCC2)n1 ZINC000264909322 526326591 /nfs/dbraw/zinc/32/65/91/526326591.db2.gz YOHBUVCEQUQPSX-NSHDSACASA-N 1 2 308.397 4.460 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc3cccc(F)c3o2)s1 ZINC000338350224 526397049 /nfs/dbraw/zinc/39/70/49/526397049.db2.gz DQTDWBOAONZDQV-DTWKUNHWSA-N 1 2 305.378 4.144 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)o1 ZINC000180264499 526397434 /nfs/dbraw/zinc/39/74/34/526397434.db2.gz CZCBCUOHHMYDDX-OTYXRUKQSA-N 1 2 311.788 4.218 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+](Cc2ccncc2)C2CC2)o1 ZINC000180755744 526405157 /nfs/dbraw/zinc/40/51/57/526405157.db2.gz SFESBDHGSQCKSL-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+](Cc2ccncc2)C2CC2)o1 ZINC000180755744 526405170 /nfs/dbraw/zinc/40/51/70/526405170.db2.gz SFESBDHGSQCKSL-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO c1cn(-c2ccc(NCc3ccc4ncccc4c3)cc2)c[nH+]1 ZINC000338144554 526522942 /nfs/dbraw/zinc/52/29/42/526522942.db2.gz ZIHBDPWSPHKOTP-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO Cc1nc(-c2cccc(N[C@H](c3[nH+]ccn3C)C3CC3)c2)oc1C ZINC000128746224 526594801 /nfs/dbraw/zinc/59/48/01/526594801.db2.gz QLSSUYWIHBOXBU-KRWDZBQOSA-N 1 2 322.412 4.255 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+](C)Cc1cnc(C(C)C)nc1 ZINC000339161614 526666642 /nfs/dbraw/zinc/66/66/42/526666642.db2.gz TTXFOXGCZVVOEH-UHFFFAOYSA-N 1 2 312.461 4.059 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+](C)Cc1cnc(C(C)C)nc1 ZINC000339161614 526666645 /nfs/dbraw/zinc/66/66/45/526666645.db2.gz TTXFOXGCZVVOEH-UHFFFAOYSA-N 1 2 312.461 4.059 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cc4ccccc4s3)CCCC2)no1 ZINC000131871352 526768221 /nfs/dbraw/zinc/76/82/21/526768221.db2.gz SDQXVXVAALQXKQ-UHFFFAOYSA-N 1 2 313.426 4.152 20 0 DIADLO Cc1nc(C[NH2+]C(C)(c2ccccc2)c2ccccc2)oc1C ZINC000182209449 526885299 /nfs/dbraw/zinc/88/52/99/526885299.db2.gz YONZXEQSALIVCN-UHFFFAOYSA-N 1 2 306.409 4.345 20 0 DIADLO Clc1ccc(C2([NH2+]Cc3csnn3)CCCCC2)cc1 ZINC000181379928 526942055 /nfs/dbraw/zinc/94/20/55/526942055.db2.gz OFBSJXAITNIMTH-UHFFFAOYSA-N 1 2 307.850 4.141 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@@H](C)CC(C)C)c2ccc(Cl)cc2)no1 ZINC000179897778 527038493 /nfs/dbraw/zinc/03/84/93/527038493.db2.gz PLQSVCZNWFJSKD-NHYWBVRUSA-N 1 2 307.825 4.145 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)COCC2CC2)c1C(C)C ZINC000191321806 527159324 /nfs/dbraw/zinc/15/93/24/527159324.db2.gz KSSVJNSAAWFEIG-UHFFFAOYSA-N 1 2 312.413 4.032 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000163212584 527404678 /nfs/dbraw/zinc/40/46/78/527404678.db2.gz QFWYYDDMGYCCAX-INIZCTEOSA-N 1 2 301.459 4.086 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1csc(C2CC2)n1 ZINC000163212584 527404683 /nfs/dbraw/zinc/40/46/83/527404683.db2.gz QFWYYDDMGYCCAX-INIZCTEOSA-N 1 2 301.459 4.086 20 0 DIADLO Cn1cc[nH+]c1[C@@H](Nc1ccc2nc(C3CC3)oc2c1)C1CC1 ZINC000128731424 527454528 /nfs/dbraw/zinc/45/45/28/527454528.db2.gz DEQGMSFWAPKPSK-INIZCTEOSA-N 1 2 308.385 4.002 20 0 DIADLO FC(F)(F)CCSCc1[nH+]ccn1Cc1ccccc1 ZINC000266690669 527665937 /nfs/dbraw/zinc/66/59/37/527665937.db2.gz ANBWGIWNZMJUAQ-UHFFFAOYSA-N 1 2 300.349 4.117 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cnc(C(C)(C)C)nc2)c1 ZINC000283782247 535695977 /nfs/dbraw/zinc/69/59/77/535695977.db2.gz FLXOPUOVSULWDY-UHFFFAOYSA-N 1 2 316.474 4.034 20 0 DIADLO CCN(Cc1ccc(Cl)s1)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287475503 535783235 /nfs/dbraw/zinc/78/32/35/535783235.db2.gz JTDOXJWUVABGKY-UHFFFAOYSA-N 1 2 323.849 4.467 20 0 DIADLO CCc1ccc2occ(C(=O)N3CCCC[C@@H]3c3[nH]cc[nH+]3)c2c1 ZINC000286181864 535834659 /nfs/dbraw/zinc/83/46/59/535834659.db2.gz ZJDRLCAFPPGYBT-MRXNPFEDSA-N 1 2 323.396 4.086 20 0 DIADLO CC[C@H](Oc1cccc(C)c1)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000273940687 536047801 /nfs/dbraw/zinc/04/78/01/536047801.db2.gz MYACGWYQNSEIOU-KRWDZBQOSA-N 1 2 323.396 4.202 20 0 DIADLO CCc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1nnc(C(C)C)[nH]1 ZINC000296583627 536083367 /nfs/dbraw/zinc/08/33/67/536083367.db2.gz UMMRWGPBLGRRCA-GFCCVEGCSA-N 1 2 312.417 4.088 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]Cc2ccc(Cl)cc2C)cs1 ZINC000274331159 536512708 /nfs/dbraw/zinc/51/27/08/536512708.db2.gz WHVRQZREZVPKIH-LLVKDONJSA-N 1 2 310.850 4.102 20 0 DIADLO COc1ccc([NH2+]C[C@@H]2CC(C)=C[C@H](C)C2)cc1NC(C)=O ZINC000289428074 536815732 /nfs/dbraw/zinc/81/57/32/536815732.db2.gz DJBNJSNAWRRBID-WFASDCNBSA-N 1 2 302.418 4.058 20 0 DIADLO FC(F)(F)CC1C[NH+](Cc2ccc(C(F)(F)F)s2)C1 ZINC000656688082 1037793967 /nfs/dbraw/zinc/79/39/67/1037793967.db2.gz FTWWPQACQHCZTO-UHFFFAOYSA-N 1 2 303.271 4.151 20 0 DIADLO COc1ccc(C[N@H+](C)[C@H](C)c2ccco2)c(Br)c1 ZINC000569221557 1044684342 /nfs/dbraw/zinc/68/43/42/1044684342.db2.gz JZMTZLDFAHHVFM-LLVKDONJSA-N 1 2 324.218 4.244 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@H](C)c2ccco2)c(Br)c1 ZINC000569221557 1044684350 /nfs/dbraw/zinc/68/43/50/1044684350.db2.gz JZMTZLDFAHHVFM-LLVKDONJSA-N 1 2 324.218 4.244 20 0 DIADLO COC1(C)CC[NH+](Cc2cc(F)c(Cl)cc2Cl)CC1 ZINC001232699262 1054103950 /nfs/dbraw/zinc/10/39/50/1054103950.db2.gz YKMDKSHLFGPYPI-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO c1cn(-c2ccc(-c3noc(C4(CC5CCC5)CC4)n3)cc2)c[nH+]1 ZINC001211490977 1035607843 /nfs/dbraw/zinc/60/78/43/1035607843.db2.gz ZOFBNVHSLQMXPH-UHFFFAOYSA-N 1 2 320.396 4.144 20 0 DIADLO Cc1ccc2cc([C@H](C)[NH2+]Cc3csc(N(C)C)n3)oc2c1 ZINC000683159784 1035630964 /nfs/dbraw/zinc/63/09/64/1035630964.db2.gz HMJYXKDHXOJJHN-LBPRGKRZSA-N 1 2 315.442 4.115 20 0 DIADLO Cc1cc(C)cc(Cn2nc(C(F)(F)F)c3c[nH+]ccc32)c1 ZINC000533372898 1035676842 /nfs/dbraw/zinc/67/68/42/1035676842.db2.gz JIYAQYQNMMUCSB-UHFFFAOYSA-N 1 2 305.303 4.115 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1ncc(-c2ccccc2F)o1 ZINC000607725299 1035698958 /nfs/dbraw/zinc/69/89/58/1035698958.db2.gz OSNQDDUKFCOEFN-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1ncc(-c2ccccc2F)o1 ZINC000607725299 1035698960 /nfs/dbraw/zinc/69/89/60/1035698960.db2.gz OSNQDDUKFCOEFN-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO COc1ccc(Nc2c[nH+]c(C)cc2C)c(Br)c1 ZINC001213513478 1035734723 /nfs/dbraw/zinc/73/47/23/1035734723.db2.gz NLWQZHKCRZHOEB-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc4ccccc4s3)ccc2[nH+]1 ZINC000624710652 1035807578 /nfs/dbraw/zinc/80/75/78/1035807578.db2.gz PTHWSYKVGSUJGE-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO CCC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001125300830 1035835823 /nfs/dbraw/zinc/83/58/23/1035835823.db2.gz FAOPAVUSUWMZLM-HIFRSBDPSA-N 1 2 315.392 4.166 20 0 DIADLO Cc1ncsc1C[N@@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000179428569 1035876096 /nfs/dbraw/zinc/87/60/96/1035876096.db2.gz UJSNLWZNCPKYRG-UHFFFAOYSA-N 1 2 318.339 4.241 20 0 DIADLO Cc1ncsc1C[N@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000179428569 1035876119 /nfs/dbraw/zinc/87/61/19/1035876119.db2.gz UJSNLWZNCPKYRG-UHFFFAOYSA-N 1 2 318.339 4.241 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)C[C@H](C)CC(C)(C)C ZINC000683256924 1035922252 /nfs/dbraw/zinc/92/22/52/1035922252.db2.gz RESPQCNTUBSOTK-INIZCTEOSA-N 1 2 321.509 4.147 20 0 DIADLO C[C@@H]1CCC[N@H+](CC(=O)Nc2c(Cl)cccc2Cl)CC1 ZINC000063309011 1035979663 /nfs/dbraw/zinc/97/96/63/1035979663.db2.gz YVWHITZHLUWRAA-LLVKDONJSA-N 1 2 315.244 4.054 20 0 DIADLO C[C@@H]1CCC[N@@H+](CC(=O)Nc2c(Cl)cccc2Cl)CC1 ZINC000063309011 1035979676 /nfs/dbraw/zinc/97/96/76/1035979676.db2.gz YVWHITZHLUWRAA-LLVKDONJSA-N 1 2 315.244 4.054 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(Cl)n1C)c1ccc(Cl)cc1Cl ZINC000037302062 1035999137 /nfs/dbraw/zinc/99/91/37/1035999137.db2.gz PLQZVWXYCHWRSN-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO CCCCOc1ncccc1C[NH2+][C@@H](C)c1cccnc1Cl ZINC000154747494 1036006218 /nfs/dbraw/zinc/00/62/18/1036006218.db2.gz JMXVVNRZBWXYRO-ZDUSSCGKSA-N 1 2 319.836 4.160 20 0 DIADLO Cc1cc2c(cn1)C[N@H+](CCc1ccc(Cl)cc1Cl)C2 ZINC001209081224 1036008644 /nfs/dbraw/zinc/00/86/44/1036008644.db2.gz LTEXLOAZDOIPSU-UHFFFAOYSA-N 1 2 307.224 4.255 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+](CCc1ccc(Cl)cc1Cl)C2 ZINC001209081224 1036008658 /nfs/dbraw/zinc/00/86/58/1036008658.db2.gz LTEXLOAZDOIPSU-UHFFFAOYSA-N 1 2 307.224 4.255 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@@H+]1CCc2ccc(O)cc2C1 ZINC000533530319 1036075796 /nfs/dbraw/zinc/07/57/96/1036075796.db2.gz LZKNHZYYXASMBD-GOSISDBHSA-N 1 2 303.352 4.180 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@H+]1CCc2ccc(O)cc2C1 ZINC000533530319 1036075814 /nfs/dbraw/zinc/07/58/14/1036075814.db2.gz LZKNHZYYXASMBD-GOSISDBHSA-N 1 2 303.352 4.180 20 0 DIADLO COc1cc(C)ccc1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000180760489 1036087086 /nfs/dbraw/zinc/08/70/86/1036087086.db2.gz JXRWQCHRGWWMMY-OAQYLSRUSA-N 1 2 318.420 4.278 20 0 DIADLO CCc1nc(N2CCC[C@H]2c2nc3ccccc3s2)cc(C)[nH+]1 ZINC000339969874 1036106615 /nfs/dbraw/zinc/10/66/15/1036106615.db2.gz VHWCACGXKQPHAD-AWEZNQCLSA-N 1 2 324.453 4.299 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1nnc(-c2ccccc2)s1 ZINC000155071211 1036117309 /nfs/dbraw/zinc/11/73/09/1036117309.db2.gz DYMBKIODDNJZAZ-UHFFFAOYSA-N 1 2 315.467 4.289 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1nnc(-c2ccccc2)s1 ZINC000155071211 1036117325 /nfs/dbraw/zinc/11/73/25/1036117325.db2.gz DYMBKIODDNJZAZ-UHFFFAOYSA-N 1 2 315.467 4.289 20 0 DIADLO CC[C@@H](c1ccccc1)N(C)c1[nH+]cc(C)cc1/C=C/C(=O)OC ZINC001167127695 1036143745 /nfs/dbraw/zinc/14/37/45/1036143745.db2.gz IGHCVROFBROXDM-DXRVJIQQSA-N 1 2 324.424 4.164 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C#N)ccc1F)c1nc2ccccc2s1 ZINC000090117900 1036185886 /nfs/dbraw/zinc/18/58/86/1036185886.db2.gz PUYWAHCPDGBBAH-NSHDSACASA-N 1 2 311.385 4.158 20 0 DIADLO Cc1cc(Cl)ncc1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC001209632726 1036235959 /nfs/dbraw/zinc/23/59/59/1036235959.db2.gz AWRHUSFVPOMYIA-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(Cl)ncc1C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC001209632726 1036235973 /nfs/dbraw/zinc/23/59/73/1036235973.db2.gz AWRHUSFVPOMYIA-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO COCC[N@H+](Cc1csc(C2CC2)n1)[C@H](C)c1ccccc1 ZINC000340144274 1036238908 /nfs/dbraw/zinc/23/89/08/1036238908.db2.gz PWPPDVYBOQHEIE-CQSZACIVSA-N 1 2 316.470 4.230 20 0 DIADLO COCC[N@@H+](Cc1csc(C2CC2)n1)[C@H](C)c1ccccc1 ZINC000340144274 1036238926 /nfs/dbraw/zinc/23/89/26/1036238926.db2.gz PWPPDVYBOQHEIE-CQSZACIVSA-N 1 2 316.470 4.230 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](c2ccccc2)C2CCCC2)no1 ZINC000109801164 1036260772 /nfs/dbraw/zinc/26/07/72/1036260772.db2.gz HIMIDMBQAYQRGE-IBGZPJMESA-N 1 2 313.445 4.433 20 0 DIADLO Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+][C@H](C)c1csnn1 ZINC000398265308 1036298578 /nfs/dbraw/zinc/29/85/78/1036298578.db2.gz CATFKTDAJJAQCB-RKDXNWHRSA-N 1 2 310.492 4.012 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cc(O)ccc1Cl)c1nc(C)cs1 ZINC000625256662 1036306713 /nfs/dbraw/zinc/30/67/13/1036306713.db2.gz HZFASWZFMWJZND-OAHLLOKOSA-N 1 2 310.850 4.226 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2cccc(F)n2)s1 ZINC001167248254 1036318486 /nfs/dbraw/zinc/31/84/86/1036318486.db2.gz KLHQIQCHJNSSCA-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2cccc(F)n2)s1 ZINC001167248254 1036318507 /nfs/dbraw/zinc/31/85/07/1036318507.db2.gz KLHQIQCHJNSSCA-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO FCCn1cc(C[NH+]2Cc3ccccc3-c3ccccc3C2)cn1 ZINC001167276397 1036359365 /nfs/dbraw/zinc/35/93/65/1036359365.db2.gz LLIFMZBTASBKIK-UHFFFAOYSA-N 1 2 321.399 4.035 20 0 DIADLO Cc1cc(Nc2ccnc(F)c2Br)ccc1[NH+](C)C ZINC001210042469 1036363301 /nfs/dbraw/zinc/36/33/01/1036363301.db2.gz GAXIXZSOUCXOTR-UHFFFAOYSA-N 1 2 324.197 4.101 20 0 DIADLO Cc1ccsc1C[N@H+](C)Cc1ccn(-c2ccccc2F)n1 ZINC000579914887 1036401428 /nfs/dbraw/zinc/40/14/28/1036401428.db2.gz NEASZEXUJLNJIM-UHFFFAOYSA-N 1 2 315.417 4.013 20 0 DIADLO Cc1ccsc1C[N@@H+](C)Cc1ccn(-c2ccccc2F)n1 ZINC000579914887 1036401449 /nfs/dbraw/zinc/40/14/49/1036401449.db2.gz NEASZEXUJLNJIM-UHFFFAOYSA-N 1 2 315.417 4.013 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1cnc(C3CCC3)s1)CCO2 ZINC000348634784 1036406823 /nfs/dbraw/zinc/40/68/23/1036406823.db2.gz MITRHNXGLQWRIS-UHFFFAOYSA-N 1 2 314.454 4.114 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1cnc(C3CCC3)s1)CCO2 ZINC000348634784 1036406830 /nfs/dbraw/zinc/40/68/30/1036406830.db2.gz MITRHNXGLQWRIS-UHFFFAOYSA-N 1 2 314.454 4.114 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2nc(-c3ccccc3C)no2)c1 ZINC000683524999 1036436985 /nfs/dbraw/zinc/43/69/85/1036436985.db2.gz MEDBVXMBYLREDU-UHFFFAOYSA-N 1 2 321.424 4.294 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2nc(-c3ccccc3C)no2)c1 ZINC000683524999 1036436996 /nfs/dbraw/zinc/43/69/96/1036436996.db2.gz MEDBVXMBYLREDU-UHFFFAOYSA-N 1 2 321.424 4.294 20 0 DIADLO Fc1ccc([C@@H]([NH2+][C@@H]2CCCn3ccnc32)c2ccccc2)cc1 ZINC000655701735 1036493528 /nfs/dbraw/zinc/49/35/28/1036493528.db2.gz YXGPAKSQINULTE-MOPGFXCFSA-N 1 2 321.399 4.236 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(O)ccc2Cl)o1 ZINC000625328042 1036505322 /nfs/dbraw/zinc/50/53/22/1036505322.db2.gz QKFKTLPSIJYDIO-INIZCTEOSA-N 1 2 321.804 4.122 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cc(O)ccc2Cl)o1 ZINC000625328042 1036505336 /nfs/dbraw/zinc/50/53/36/1036505336.db2.gz QKFKTLPSIJYDIO-INIZCTEOSA-N 1 2 321.804 4.122 20 0 DIADLO Cc1ccc(NC(=O)CC(C)(C)C2CCCCC2)c(N(C)C)[nH+]1 ZINC001266515601 1036581254 /nfs/dbraw/zinc/58/12/54/1036581254.db2.gz FIUAJDPGGSCOEX-UHFFFAOYSA-N 1 2 317.477 4.391 20 0 DIADLO Cc1[nH+]cc(Nc2cc(Cl)cc(C(F)(F)F)c2)cc1N ZINC001210287857 1036592944 /nfs/dbraw/zinc/59/29/44/1036592944.db2.gz DKUHSXXUQQKEMU-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Cc1[nH+]cc(Nc2cc(Cl)ccc2OC(F)(F)F)cc1N ZINC001210289969 1036594605 /nfs/dbraw/zinc/59/46/05/1036594605.db2.gz CLACTKPQPJUMHR-UHFFFAOYSA-N 1 2 317.698 4.268 20 0 DIADLO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2nnc(-c3ccccc3)o2)c1 ZINC000340431631 1036599869 /nfs/dbraw/zinc/59/98/69/1036599869.db2.gz VATXHPRZGHLERQ-KGLIPLIRSA-N 1 2 323.396 4.157 20 0 DIADLO CC[C@@H]1C[C@H](C[NH2+]c2ccc(N3CCCCC3)cc2)CCO1 ZINC001648856030 1036647988 /nfs/dbraw/zinc/64/79/88/1036647988.db2.gz QNPNWOJCISGICH-VQIMIIECSA-N 1 2 302.462 4.294 20 0 DIADLO COc1ccc(C)cc1CNc1ccc(N2CCCCC2)c[nH+]1 ZINC001648874093 1036667866 /nfs/dbraw/zinc/66/78/66/1036667866.db2.gz LPNVEYHOXJZXHG-UHFFFAOYSA-N 1 2 311.429 4.001 20 0 DIADLO FC1(F)CC2(C[NH+](CCc3cc(Cl)cc(Cl)c3)C2)C1 ZINC000683667295 1036669270 /nfs/dbraw/zinc/66/92/70/1036669270.db2.gz ATKWRODMZZFQOQ-UHFFFAOYSA-N 1 2 306.183 4.267 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1cccnc1)c1ccncc1F ZINC000340472261 1036693330 /nfs/dbraw/zinc/69/33/30/1036693330.db2.gz HPQZJHPZBHNSBG-LIRRHRJNSA-N 1 2 307.372 4.056 20 0 DIADLO Cc1csc(C[NH2+][C@@H](C)c2ccccc2Br)n1 ZINC000038090613 1036709260 /nfs/dbraw/zinc/70/92/60/1036709260.db2.gz AFXMVNNWBMJNJZ-JTQLQIEISA-N 1 2 311.248 4.065 20 0 DIADLO Cc1nc(C[NH2+][C@@H]2CCCOc3c(C)cc(Cl)cc32)cs1 ZINC000121982441 1036732566 /nfs/dbraw/zinc/73/25/66/1036732566.db2.gz BSWRQTDUJKBWNG-OAHLLOKOSA-N 1 2 322.861 4.417 20 0 DIADLO Fc1ccccc1-n1c2ccccc2[nH+]c1NCc1nccs1 ZINC000683723500 1036769540 /nfs/dbraw/zinc/76/95/40/1036769540.db2.gz GOGOJFYIEBNMOA-UHFFFAOYSA-N 1 2 324.384 4.233 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@H](C)c2ccc(C3CC3)cc2)c[nH+]1 ZINC000668396298 1036788505 /nfs/dbraw/zinc/78/85/05/1036788505.db2.gz DCHIACAYILSNSS-OAHLLOKOSA-N 1 2 323.440 4.136 20 0 DIADLO CCCC[C@@H]([NH2+]Cc1ncn(-c2ccccc2)n1)c1ccccc1 ZINC000340531105 1036796415 /nfs/dbraw/zinc/79/64/15/1036796415.db2.gz IVEUJVACNKHIDT-LJQANCHMSA-N 1 2 320.440 4.288 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@@H]2CCC[C@H]3C[C@H]32)no1)c1ccccc1 ZINC000656050844 1036848708 /nfs/dbraw/zinc/84/87/08/1036848708.db2.gz HXRXNWJRZKTTDA-YLFCFFPRSA-N 1 2 311.429 4.014 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@@H]2CCC[C@H]3C[C@H]32)no1)c1ccccc1 ZINC000656050844 1036848720 /nfs/dbraw/zinc/84/87/20/1036848720.db2.gz HXRXNWJRZKTTDA-YLFCFFPRSA-N 1 2 311.429 4.014 20 0 DIADLO c1cn(-c2ccc(NCc3ccc4cnccc4c3)cc2)c[nH+]1 ZINC000683766656 1036867470 /nfs/dbraw/zinc/86/74/70/1036867470.db2.gz QADLWPTYJSBNNQ-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO O=C(CCCn1cc[nH+]c1)N(c1ccsc1)C1CCCCC1 ZINC000683773585 1036886776 /nfs/dbraw/zinc/88/67/76/1036886776.db2.gz IWPOIVGCJGAOSC-UHFFFAOYSA-N 1 2 317.458 4.091 20 0 DIADLO COc1ccccc1C[N@H+](Cc1cccs1)Cc1ccncc1 ZINC000078719451 1036914933 /nfs/dbraw/zinc/91/49/33/1036914933.db2.gz SESPRRNBZNGXGC-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1cccs1)Cc1ccncc1 ZINC000078719451 1036914946 /nfs/dbraw/zinc/91/49/46/1036914946.db2.gz SESPRRNBZNGXGC-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO COC(=O)c1ccc2c(c1)C[N@@H+](Cc1cccc(C(C)(C)C)c1)C2 ZINC001167350642 1036941524 /nfs/dbraw/zinc/94/15/24/1036941524.db2.gz MSARPJIKTMFFRU-UHFFFAOYSA-N 1 2 323.436 4.287 20 0 DIADLO COC(=O)c1ccc2c(c1)C[N@H+](Cc1cccc(C(C)(C)C)c1)C2 ZINC001167350642 1036941538 /nfs/dbraw/zinc/94/15/38/1036941538.db2.gz MSARPJIKTMFFRU-UHFFFAOYSA-N 1 2 323.436 4.287 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1nc(C)sc1C)c1ccc(Cl)cc1 ZINC000683822478 1036973278 /nfs/dbraw/zinc/97/32/78/1036973278.db2.gz UWDLIWBSLDCAIJ-BONVTDFDSA-N 1 2 324.877 4.452 20 0 DIADLO Fc1cccc([C@@H]2CC[N@@H+]2Cc2cnc(-c3ccco3)s2)c1 ZINC000683832592 1036992910 /nfs/dbraw/zinc/99/29/10/1036992910.db2.gz KCIFHGZBDJSXPX-HNNXBMFYSA-N 1 2 314.385 4.489 20 0 DIADLO Fc1cccc([C@@H]2CC[N@H+]2Cc2cnc(-c3ccco3)s2)c1 ZINC000683832592 1036992919 /nfs/dbraw/zinc/99/29/19/1036992919.db2.gz KCIFHGZBDJSXPX-HNNXBMFYSA-N 1 2 314.385 4.489 20 0 DIADLO Oc1cc(F)cc(C[NH2+]Cc2cc(Cl)sc2Cl)c1 ZINC000312747961 1037008588 /nfs/dbraw/zinc/00/85/88/1037008588.db2.gz RGWXCAYNAPIVSG-UHFFFAOYSA-N 1 2 306.189 4.189 20 0 DIADLO Fc1cc(Nc2ccc[nH+]c2N2CCCC2)cc(F)c1Cl ZINC001210842009 1037009951 /nfs/dbraw/zinc/00/99/51/1037009951.db2.gz ZHNCVIXRNJWWBV-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO COc1ccc(F)cc1C[NH2+]Cc1cc(Cl)sc1Cl ZINC000312757947 1037024133 /nfs/dbraw/zinc/02/41/33/1037024133.db2.gz FEYCRZZOARZBJJ-UHFFFAOYSA-N 1 2 320.216 4.492 20 0 DIADLO Cc1nc(C)c(C[N@@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)o1 ZINC000683896980 1037075202 /nfs/dbraw/zinc/07/52/02/1037075202.db2.gz GXRHIWFTXQRLRH-BDJLRTHQSA-N 1 2 300.402 4.172 20 0 DIADLO Cc1nc(C)c(C[N@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)o1 ZINC000683896980 1037075209 /nfs/dbraw/zinc/07/52/09/1037075209.db2.gz GXRHIWFTXQRLRH-BDJLRTHQSA-N 1 2 300.402 4.172 20 0 DIADLO Cc1nc(C)c(C[N@@H+]2CCSC[C@H]2c2ccc(Cl)cc2)o1 ZINC000683899246 1037079309 /nfs/dbraw/zinc/07/93/09/1037079309.db2.gz ZQFWLOVFDDLOTI-HNNXBMFYSA-N 1 2 322.861 4.235 20 0 DIADLO Cc1nc(C)c(C[N@H+]2CCSC[C@H]2c2ccc(Cl)cc2)o1 ZINC000683899246 1037079328 /nfs/dbraw/zinc/07/93/28/1037079328.db2.gz ZQFWLOVFDDLOTI-HNNXBMFYSA-N 1 2 322.861 4.235 20 0 DIADLO Cc1ccc(Nc2ccc3ncc(Br)cc3c2)[nH+]c1 ZINC001211010612 1037089129 /nfs/dbraw/zinc/08/91/29/1037089129.db2.gz JTVMBTOLGGAMOQ-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO C[C@@H](CC(=O)NC(C)(C)CC1CCCCCC1)n1cc[nH+]c1 ZINC000580556996 1037201743 /nfs/dbraw/zinc/20/17/43/1037201743.db2.gz CDUDHLRPHKKHSZ-HNNXBMFYSA-N 1 2 305.466 4.090 20 0 DIADLO c1c2ccccc2[nH]c1C[N@@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000684019742 1037244516 /nfs/dbraw/zinc/24/45/16/1037244516.db2.gz PBXBNPJKQXUHSP-UHFFFAOYSA-N 1 2 301.393 4.208 20 0 DIADLO c1c2ccccc2[nH]c1C[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000684019742 1037244526 /nfs/dbraw/zinc/24/45/26/1037244526.db2.gz PBXBNPJKQXUHSP-UHFFFAOYSA-N 1 2 301.393 4.208 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3ccccc3[nH]2)C[C@@H](c2ccsc2)O1 ZINC000684020398 1037245010 /nfs/dbraw/zinc/24/50/10/1037245010.db2.gz CBCRLKRUWYWALJ-ACJLOTCBSA-N 1 2 312.438 4.191 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)C[C@@H](c2ccsc2)O1 ZINC000684020398 1037245019 /nfs/dbraw/zinc/24/50/19/1037245019.db2.gz CBCRLKRUWYWALJ-ACJLOTCBSA-N 1 2 312.438 4.191 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)c(C)[nH+]1 ZINC001125474086 1037301485 /nfs/dbraw/zinc/30/14/85/1037301485.db2.gz WCBBKVWVWSLSBO-SJORKVTESA-N 1 2 308.425 4.385 20 0 DIADLO Cc1c(C[N@H+](C)Cc2sc3ccccc3c2Cl)cnn1C ZINC000684105736 1037348050 /nfs/dbraw/zinc/34/80/50/1037348050.db2.gz HYJBTOXLWXICMH-UHFFFAOYSA-N 1 2 319.861 4.229 20 0 DIADLO Cc1c(C[N@@H+](C)Cc2sc3ccccc3c2Cl)cnn1C ZINC000684105736 1037348067 /nfs/dbraw/zinc/34/80/67/1037348067.db2.gz HYJBTOXLWXICMH-UHFFFAOYSA-N 1 2 319.861 4.229 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](Cc2cc(F)cc(F)c2)[C@H](C)CO1 ZINC001167438463 1037353360 /nfs/dbraw/zinc/35/33/60/1037353360.db2.gz ODFHIUDESVVKAH-AUUYWEPGSA-N 1 2 317.379 4.235 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2cc(F)cc(F)c2)[C@H](C)CO1 ZINC001167438463 1037353375 /nfs/dbraw/zinc/35/33/75/1037353375.db2.gz ODFHIUDESVVKAH-AUUYWEPGSA-N 1 2 317.379 4.235 20 0 DIADLO CCc1cc(Br)ncc1Nc1c[nH+]cc(C)c1C ZINC001213527229 1037396352 /nfs/dbraw/zinc/39/63/52/1037396352.db2.gz DASLBHNDZXQAOZ-UHFFFAOYSA-N 1 2 306.207 4.162 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)cc1Cl ZINC000581162990 1037459991 /nfs/dbraw/zinc/45/99/91/1037459991.db2.gz IMJIMTISLFZQKG-VIFPVBQESA-N 1 2 324.198 4.479 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CCC(F)(F)[C@@H](C)C2)cc1Cl ZINC000581162990 1037459996 /nfs/dbraw/zinc/45/99/96/1037459996.db2.gz IMJIMTISLFZQKG-VIFPVBQESA-N 1 2 324.198 4.479 20 0 DIADLO CN(C)C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)c1ccc(F)cc1 ZINC000581155334 1037457078 /nfs/dbraw/zinc/45/70/78/1037457078.db2.gz XGQLOHAKFNGFHC-QGZVFWFLSA-N 1 2 324.802 4.011 20 0 DIADLO Cc1nc(C[NH2+][C@@H](CC(F)(F)F)c2ccccc2)cs1 ZINC000040443788 1037536103 /nfs/dbraw/zinc/53/61/03/1037536103.db2.gz XGVFODKRZNCDKZ-ZDUSSCGKSA-N 1 2 300.349 4.235 20 0 DIADLO Cc1cc(N2CCCn3c(cc4ccccc43)C2)nc(C2CC2)[nH+]1 ZINC000340968241 1037536196 /nfs/dbraw/zinc/53/61/96/1037536196.db2.gz KBRKOWUOORHFEI-UHFFFAOYSA-N 1 2 318.424 4.027 20 0 DIADLO COc1cccc2c(N[C@@H]3COc4ccc(C)cc43)cc[nH+]c12 ZINC000581342673 1037544838 /nfs/dbraw/zinc/54/48/38/1037544838.db2.gz BNRVQERRIPKDSM-MRXNPFEDSA-N 1 2 306.365 4.097 20 0 DIADLO C[N@H+](Cc1ncc(-c2ccccc2)s1)Cc1ccc(O)cc1 ZINC000349403541 1037579679 /nfs/dbraw/zinc/57/96/79/1037579679.db2.gz COHZWZKDPCQMMR-UHFFFAOYSA-N 1 2 310.422 4.148 20 0 DIADLO C[N@@H+](Cc1ncc(-c2ccccc2)s1)Cc1ccc(O)cc1 ZINC000349403541 1037579685 /nfs/dbraw/zinc/57/96/85/1037579685.db2.gz COHZWZKDPCQMMR-UHFFFAOYSA-N 1 2 310.422 4.148 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1)[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000565968917 1037582599 /nfs/dbraw/zinc/58/25/99/1037582599.db2.gz RYJDOPAOFFLMTC-XJKSGUPXSA-N 1 2 314.454 4.158 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000565968917 1037582610 /nfs/dbraw/zinc/58/26/10/1037582610.db2.gz RYJDOPAOFFLMTC-XJKSGUPXSA-N 1 2 314.454 4.158 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+]Cc1cc(F)cnc1Cl ZINC000834840881 1037601323 /nfs/dbraw/zinc/60/13/23/1037601323.db2.gz NKNDIJFPKYMAMY-NSHDSACASA-N 1 2 308.784 4.124 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@H](C)c2ccc(C)s2)n1 ZINC000754672070 1037605382 /nfs/dbraw/zinc/60/53/82/1037605382.db2.gz HICXKQRMQLXVOT-GHMZBOCLSA-N 1 2 311.476 4.104 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccccc2Oc2ccc(C)cc2)n1C ZINC000341025959 1037624785 /nfs/dbraw/zinc/62/47/85/1037624785.db2.gz ZTYHPENSTFASAR-UHFFFAOYSA-N 1 2 321.424 4.119 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2nc(-c3ccccc3C)no2)cc1 ZINC000061760785 1037684628 /nfs/dbraw/zinc/68/46/28/1037684628.db2.gz ACCZWPYVGYBMJI-UHFFFAOYSA-N 1 2 321.424 4.239 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2nc(-c3ccccc3C)no2)cc1 ZINC000061760785 1037684633 /nfs/dbraw/zinc/68/46/33/1037684633.db2.gz ACCZWPYVGYBMJI-UHFFFAOYSA-N 1 2 321.424 4.239 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+]1CCC[C@H]1c1ccccc1F ZINC001143394619 1037696607 /nfs/dbraw/zinc/69/66/07/1037696607.db2.gz JSPCDTPTMJDWJZ-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+]1CCC[C@H]1c1ccccc1F ZINC001143394619 1037696613 /nfs/dbraw/zinc/69/66/13/1037696613.db2.gz JSPCDTPTMJDWJZ-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2cccc(-c3ccccc3)c2)no1 ZINC000581515917 1037705103 /nfs/dbraw/zinc/70/51/03/1037705103.db2.gz ONFJPUSUNDGVIV-IBGZPJMESA-N 1 2 319.408 4.382 20 0 DIADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2cccc(-c3ccccc3)c2)no1 ZINC000581515917 1037705124 /nfs/dbraw/zinc/70/51/24/1037705124.db2.gz ONFJPUSUNDGVIV-IBGZPJMESA-N 1 2 319.408 4.382 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001143394873 1037706288 /nfs/dbraw/zinc/70/62/88/1037706288.db2.gz UAOQJDOOJWOPPR-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001143394873 1037706308 /nfs/dbraw/zinc/70/63/08/1037706308.db2.gz UAOQJDOOJWOPPR-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1ccc(F)cc1 ZINC000090228741 1037760798 /nfs/dbraw/zinc/76/07/98/1037760798.db2.gz WWHRWZDJPCLBOL-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1c(F)c(F)cc(F)c1F ZINC000090228314 1037763819 /nfs/dbraw/zinc/76/38/19/1037763819.db2.gz WHGWNTOYYGDMRJ-SECBINFHSA-N 1 2 313.294 4.102 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(CCc2ccccc2)no1)c1ccccc1 ZINC000341230857 1037770311 /nfs/dbraw/zinc/77/03/11/1037770311.db2.gz SXJJHFAOZZKFED-SFHVURJKSA-N 1 2 321.424 4.096 20 0 DIADLO COCc1nc(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)cs1 ZINC000341258411 1037817149 /nfs/dbraw/zinc/81/71/49/1037817149.db2.gz XBZZCKIXLREXMS-UHFFFAOYSA-N 1 2 322.861 4.112 20 0 DIADLO CCOc1cc(NCc2ccc(-n3cc[nH+]c3)cc2)ccc1C ZINC000341269660 1037827360 /nfs/dbraw/zinc/82/73/60/1037827360.db2.gz MBPUNCVRBGLFIA-UHFFFAOYSA-N 1 2 307.397 4.192 20 0 DIADLO CC(C)Cn1nccc1CNc1[nH+]c2ccccc2n1C(C)C ZINC000656781015 1037861964 /nfs/dbraw/zinc/86/19/64/1037861964.db2.gz DCNNKFNNKVSJPX-UHFFFAOYSA-N 1 2 311.433 4.082 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2c(C)oc3ccccc32)s1 ZINC000926162253 1037862305 /nfs/dbraw/zinc/86/23/05/1037862305.db2.gz ANUKKIKFTBKUJR-ZJUUUORDSA-N 1 2 301.415 4.313 20 0 DIADLO c1nc(-c2ccncc2)sc1CNc1c[nH+]cc2c1CCCC2 ZINC000656776945 1037866035 /nfs/dbraw/zinc/86/60/35/1037866035.db2.gz VYJLCEMCVRWFFG-UHFFFAOYSA-N 1 2 322.437 4.091 20 0 DIADLO Cc1ccc(C[N@H+](Cc2nccn2C(F)F)C2CC2)cc1C ZINC000077361036 1037884366 /nfs/dbraw/zinc/88/43/66/1037884366.db2.gz JWYKEJPGFLNNRL-UHFFFAOYSA-N 1 2 305.372 4.060 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2nccn2C(F)F)C2CC2)cc1C ZINC000077361036 1037884377 /nfs/dbraw/zinc/88/43/77/1037884377.db2.gz JWYKEJPGFLNNRL-UHFFFAOYSA-N 1 2 305.372 4.060 20 0 DIADLO Cc1cc(C[NH2+]Cc2c(Cl)cccc2SC(C)C)ncn1 ZINC000684390029 1037924304 /nfs/dbraw/zinc/92/43/04/1037924304.db2.gz RXOGLSMPEZNCGP-UHFFFAOYSA-N 1 2 321.877 4.229 20 0 DIADLO Cc1ccc(Cl)nc1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC001140448334 1037945068 /nfs/dbraw/zinc/94/50/68/1037945068.db2.gz WNUKZBDKOFWGRM-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(Cl)nc1C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC001140448334 1037945083 /nfs/dbraw/zinc/94/50/83/1037945083.db2.gz WNUKZBDKOFWGRM-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO CC(C)([NH2+]Cc1ccc(-n2cnc3ccccc32)cc1)C(F)F ZINC000684413573 1037962033 /nfs/dbraw/zinc/96/20/33/1037962033.db2.gz PULDVNIEHXEGOO-UHFFFAOYSA-N 1 2 315.367 4.159 20 0 DIADLO C[C@H](CC(=O)N1C[C@H](C(C)(C)C)c2ccccc21)n1cc[nH+]c1 ZINC000521051494 1037980283 /nfs/dbraw/zinc/98/02/83/1037980283.db2.gz DBUHXPVJDRQUGN-ZBFHGGJFSA-N 1 2 311.429 4.011 20 0 DIADLO Fc1cccc(F)c1C[N@H+](Cc1cncs1)C1CCCC1 ZINC000093103956 1037981070 /nfs/dbraw/zinc/98/10/70/1037981070.db2.gz ZNHLRAVYHKYQOR-UHFFFAOYSA-N 1 2 308.397 4.366 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](Cc1cncs1)C1CCCC1 ZINC000093103956 1037981090 /nfs/dbraw/zinc/98/10/90/1037981090.db2.gz ZNHLRAVYHKYQOR-UHFFFAOYSA-N 1 2 308.397 4.366 20 0 DIADLO Cn1ncc(C[N@H+](Cc2ccco2)Cc2ccccc2)c1C1CC1 ZINC000891486684 1037984153 /nfs/dbraw/zinc/98/41/53/1037984153.db2.gz CPWSJCNZQSIUMI-UHFFFAOYSA-N 1 2 321.424 4.093 20 0 DIADLO Cn1ncc(C[N@@H+](Cc2ccco2)Cc2ccccc2)c1C1CC1 ZINC000891486684 1037984163 /nfs/dbraw/zinc/98/41/63/1037984163.db2.gz CPWSJCNZQSIUMI-UHFFFAOYSA-N 1 2 321.424 4.093 20 0 DIADLO Cc1c(C[N@H+](C)Cc2ccc(-c3ccccc3)cc2F)cnn1C ZINC000581864420 1038039553 /nfs/dbraw/zinc/03/95/53/1038039553.db2.gz ONTOVGOPBXMGDT-UHFFFAOYSA-N 1 2 323.415 4.167 20 0 DIADLO Cc1c(C[N@@H+](C)Cc2ccc(-c3ccccc3)cc2F)cnn1C ZINC000581864420 1038039570 /nfs/dbraw/zinc/03/95/70/1038039570.db2.gz ONTOVGOPBXMGDT-UHFFFAOYSA-N 1 2 323.415 4.167 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000602572513 1038041092 /nfs/dbraw/zinc/04/10/92/1038041092.db2.gz MEMCMCXGBHRUST-PWSUYJOCSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000602572513 1038041115 /nfs/dbraw/zinc/04/11/15/1038041115.db2.gz MEMCMCXGBHRUST-PWSUYJOCSA-N 1 2 323.305 4.069 20 0 DIADLO Cc1cc(N(C)Cc2ccc(F)cc2Cl)nc(C2CC2)[nH+]1 ZINC000341515748 1038061633 /nfs/dbraw/zinc/06/16/33/1038061633.db2.gz YDRAZKMZKKMNRJ-UHFFFAOYSA-N 1 2 305.784 4.091 20 0 DIADLO Clc1cc2cccnc2c(CSCCn2cc[nH+]c2)c1 ZINC000341508974 1038065383 /nfs/dbraw/zinc/06/53/83/1038065383.db2.gz GMVSSKBZHLEIHJ-UHFFFAOYSA-N 1 2 303.818 4.018 20 0 DIADLO CCC[N@H+](Cc1nccn1C1CC1)[C@H](C)c1ccccc1OC ZINC000891652008 1038107286 /nfs/dbraw/zinc/10/72/86/1038107286.db2.gz ALRFLCZRVHSRKZ-OAHLLOKOSA-N 1 2 313.445 4.200 20 0 DIADLO CCC[N@@H+](Cc1nccn1C1CC1)[C@H](C)c1ccccc1OC ZINC000891652008 1038107291 /nfs/dbraw/zinc/10/72/91/1038107291.db2.gz ALRFLCZRVHSRKZ-OAHLLOKOSA-N 1 2 313.445 4.200 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2coc(-c3ccc(C)cc3)n2)s1 ZINC000090418552 1038115173 /nfs/dbraw/zinc/11/51/73/1038115173.db2.gz AQOPQAOLOLEBHA-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nccn2-c2ccccc2)[C@@H](c2ccco2)C1 ZINC001167490732 1038164071 /nfs/dbraw/zinc/16/40/71/1038164071.db2.gz HHVLQDJXLSVRGH-FUHWJXTLSA-N 1 2 321.424 4.439 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nccn2-c2ccccc2)[C@@H](c2ccco2)C1 ZINC001167490732 1038164078 /nfs/dbraw/zinc/16/40/78/1038164078.db2.gz HHVLQDJXLSVRGH-FUHWJXTLSA-N 1 2 321.424 4.439 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nccn2-c2ccccc2)[C@H](c2ccco2)C1 ZINC001167490731 1038164951 /nfs/dbraw/zinc/16/49/51/1038164951.db2.gz HHVLQDJXLSVRGH-AEFFLSMTSA-N 1 2 321.424 4.439 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nccn2-c2ccccc2)[C@H](c2ccco2)C1 ZINC001167490731 1038164960 /nfs/dbraw/zinc/16/49/60/1038164960.db2.gz HHVLQDJXLSVRGH-AEFFLSMTSA-N 1 2 321.424 4.439 20 0 DIADLO CCc1ccc(-c2noc([C@@H](C)[NH2+]Cc3ccsc3)n2)cc1 ZINC000276746653 1038179249 /nfs/dbraw/zinc/17/92/49/1038179249.db2.gz JYEPFZIIRPDTND-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO Cc1noc(C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)n1 ZINC000341633463 1038193188 /nfs/dbraw/zinc/19/31/88/1038193188.db2.gz FKHJANSZVVDDMC-ZDUSSCGKSA-N 1 2 309.369 4.021 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@H]3C[C@@H]3c3ccccc3)cc2[nH+]1 ZINC000341641566 1038198466 /nfs/dbraw/zinc/19/84/66/1038198466.db2.gz UXWVADVXGJWACZ-GDBMZVCRSA-N 1 2 305.381 4.004 20 0 DIADLO Cc1cc(NC(=O)C=Cc2ccc(F)c3ccccc23)c(C)c[nH+]1 ZINC001266899542 1038205397 /nfs/dbraw/zinc/20/53/97/1038205397.db2.gz HAWMOIHORBGCFC-CSKARUKUSA-N 1 2 320.367 4.065 20 0 DIADLO CSCc1cnc(C[NH2+][C@H](c2ccccn2)C2CCC2)s1 ZINC000598993872 1038211194 /nfs/dbraw/zinc/21/11/94/1038211194.db2.gz SXGIZMJIVHKJGC-INIZCTEOSA-N 1 2 319.499 4.032 20 0 DIADLO c1nc(C[N@H+]2CC=C(c3c[nH]c4ccccc43)CC2)oc1C1CC1 ZINC000933818924 1038230856 /nfs/dbraw/zinc/23/08/56/1038230856.db2.gz LJMOKSFLMXXVQJ-UHFFFAOYSA-N 1 2 319.408 4.323 20 0 DIADLO c1nc(C[N@@H+]2CC=C(c3c[nH]c4ccccc43)CC2)oc1C1CC1 ZINC000933818924 1038230866 /nfs/dbraw/zinc/23/08/66/1038230866.db2.gz LJMOKSFLMXXVQJ-UHFFFAOYSA-N 1 2 319.408 4.323 20 0 DIADLO CC[C@]1(C)CCC[N@@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001167493546 1038234825 /nfs/dbraw/zinc/23/48/25/1038234825.db2.gz ZODYZKXDIVEPKD-DOTOQJQBSA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@]1(C)CCC[N@H+]([C@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001167493546 1038234835 /nfs/dbraw/zinc/23/48/35/1038234835.db2.gz ZODYZKXDIVEPKD-DOTOQJQBSA-N 1 2 309.837 4.066 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001143412117 1038252447 /nfs/dbraw/zinc/25/24/47/1038252447.db2.gz HWQMCQZJUUBHOV-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001143412117 1038252463 /nfs/dbraw/zinc/25/24/63/1038252463.db2.gz HWQMCQZJUUBHOV-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+]1CCC[C@@H]1c1ccccc1F ZINC001143411986 1038253044 /nfs/dbraw/zinc/25/30/44/1038253044.db2.gz CAMXFNOTSOPYDT-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+]1CCC[C@@H]1c1ccccc1F ZINC001143411986 1038253051 /nfs/dbraw/zinc/25/30/51/1038253051.db2.gz CAMXFNOTSOPYDT-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO CCn1ccnc1C[N@H+](C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000341829009 1038285286 /nfs/dbraw/zinc/28/52/86/1038285286.db2.gz MERMQARMNGKGRU-LBPRGKRZSA-N 1 2 311.351 4.115 20 0 DIADLO CCn1ccnc1C[N@@H+](C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000341829009 1038285292 /nfs/dbraw/zinc/28/52/92/1038285292.db2.gz MERMQARMNGKGRU-LBPRGKRZSA-N 1 2 311.351 4.115 20 0 DIADLO COC(=O)c1oc(C[N@H+](C)[C@H](C)c2ccccc2Cl)cc1C ZINC000603856609 1038301629 /nfs/dbraw/zinc/30/16/29/1038301629.db2.gz LLGJSSXUOBOZFM-GFCCVEGCSA-N 1 2 321.804 4.221 20 0 DIADLO COC(=O)c1oc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)cc1C ZINC000603856609 1038301643 /nfs/dbraw/zinc/30/16/43/1038301643.db2.gz LLGJSSXUOBOZFM-GFCCVEGCSA-N 1 2 321.804 4.221 20 0 DIADLO CCCc1nc(C[NH+]2CCC(Cc3nccs3)CC2)cs1 ZINC000639986167 1038303057 /nfs/dbraw/zinc/30/30/57/1038303057.db2.gz OZIMMWOFEJJWCY-UHFFFAOYSA-N 1 2 321.515 4.007 20 0 DIADLO C[C@]12CC3CC(C(=O)Nc4ccc5[nH+]ccn5c4)(C1)C[C@@](C)(C3)C2 ZINC000603884042 1038312332 /nfs/dbraw/zinc/31/23/32/1038312332.db2.gz OURWCABXOKXBHV-ODNNXGBQSA-N 1 2 323.440 4.269 20 0 DIADLO CCc1nnc([C@H](C)[N@H+](C)Cc2c3ccccc3oc2CC)o1 ZINC000535720152 1038323305 /nfs/dbraw/zinc/32/33/05/1038323305.db2.gz CRKMDDQOTAMHMM-LBPRGKRZSA-N 1 2 313.401 4.134 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+](C)Cc2c3ccccc3oc2CC)o1 ZINC000535720152 1038323315 /nfs/dbraw/zinc/32/33/15/1038323315.db2.gz CRKMDDQOTAMHMM-LBPRGKRZSA-N 1 2 313.401 4.134 20 0 DIADLO COc1ccc(C[N@H+](C)[C@@H](C)c2c(F)cccc2F)cc1OC ZINC000535785820 1038335717 /nfs/dbraw/zinc/33/57/17/1038335717.db2.gz HQFOAZMUKTYFSI-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@@H](C)c2c(F)cccc2F)cc1OC ZINC000535785820 1038335728 /nfs/dbraw/zinc/33/57/28/1038335728.db2.gz HQFOAZMUKTYFSI-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO Fc1ccc(C[N@H+](CC(F)F)CC2CCC2)c2ncccc12 ZINC000535800127 1038341969 /nfs/dbraw/zinc/34/19/69/1038341969.db2.gz RPKRVSTYQZNDGN-UHFFFAOYSA-N 1 2 308.347 4.241 20 0 DIADLO Fc1ccc(C[N@@H+](CC(F)F)CC2CCC2)c2ncccc12 ZINC000535800127 1038341986 /nfs/dbraw/zinc/34/19/86/1038341986.db2.gz RPKRVSTYQZNDGN-UHFFFAOYSA-N 1 2 308.347 4.241 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2csc(-c3ccoc3)n2)c1 ZINC000341928764 1038356119 /nfs/dbraw/zinc/35/61/19/1038356119.db2.gz GUJZNOBOSOIWKB-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2csc(-c3ccoc3)n2)c1 ZINC000341928764 1038356135 /nfs/dbraw/zinc/35/61/35/1038356135.db2.gz GUJZNOBOSOIWKB-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO c1ccc(C2=CCC[N@@H+](Cc3nc(C4CCCC4)no3)C2)cc1 ZINC000341988385 1038360580 /nfs/dbraw/zinc/36/05/80/1038360580.db2.gz ISGBYAVPVQKWPW-UHFFFAOYSA-N 1 2 309.413 4.017 20 0 DIADLO c1ccc(C2=CCC[N@H+](Cc3nc(C4CCCC4)no3)C2)cc1 ZINC000341988385 1038360589 /nfs/dbraw/zinc/36/05/89/1038360589.db2.gz ISGBYAVPVQKWPW-UHFFFAOYSA-N 1 2 309.413 4.017 20 0 DIADLO FC(F)(F)CC1CC[NH+](Cc2csc(C3CC3)n2)CC1 ZINC000341996080 1038363360 /nfs/dbraw/zinc/36/33/60/1038363360.db2.gz VARTWVVDQROHFE-UHFFFAOYSA-N 1 2 304.381 4.185 20 0 DIADLO Clc1ccc(Cl)c(C[NH+]2CCC(c3ccncc3)CC2)n1 ZINC000277114516 1038370657 /nfs/dbraw/zinc/37/06/57/1038370657.db2.gz HIUDWRJTSHRYTR-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC000342048889 1038381602 /nfs/dbraw/zinc/38/16/02/1038381602.db2.gz NKHHEHMOJLPXMM-ZIAGYGMSSA-N 1 2 322.412 4.106 20 0 DIADLO Cc1cccn2c(CNc3ccccc3OCC3CC3)c[nH+]c12 ZINC000535834785 1038390692 /nfs/dbraw/zinc/39/06/92/1038390692.db2.gz SZSWCRRZTNUKCT-UHFFFAOYSA-N 1 2 307.397 4.044 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)n1 ZINC000097079403 1038410285 /nfs/dbraw/zinc/41/02/85/1038410285.db2.gz MJVBUJGNSVYUSY-MRXNPFEDSA-N 1 2 305.397 4.038 20 0 DIADLO Cc1ccc([C@H](C)NC[C@H](c2cccs2)[NH+]2CCCC2)o1 ZINC000150908646 1038424499 /nfs/dbraw/zinc/42/44/99/1038424499.db2.gz NNJOVTGGXFOOQK-LSDHHAIUSA-N 1 2 304.459 4.137 20 0 DIADLO Fc1cc(Br)ccc1CCCNc1cccc[nH+]1 ZINC000604758411 1038449679 /nfs/dbraw/zinc/44/96/79/1038449679.db2.gz QQMSMDUYYQVICP-UHFFFAOYSA-N 1 2 309.182 4.028 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)cs1 ZINC000151620530 1038455596 /nfs/dbraw/zinc/45/55/96/1038455596.db2.gz FBKBCNPNOLJOSR-OAHLLOKOSA-N 1 2 314.454 4.242 20 0 DIADLO Cc1nc(Cl)cc(Nc2ccc([NH+]3CCCCC3)cc2)n1 ZINC000061803446 1038457325 /nfs/dbraw/zinc/45/73/25/1038457325.db2.gz PMUHDWGEVAQJHN-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO CCc1noc(C[N@@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)n1 ZINC000605000248 1038476473 /nfs/dbraw/zinc/47/64/73/1038476473.db2.gz APLOZFQKWHUBHJ-HNNXBMFYSA-N 1 2 319.836 4.403 20 0 DIADLO CCc1noc(C[N@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)n1 ZINC000605000248 1038476478 /nfs/dbraw/zinc/47/64/78/1038476478.db2.gz APLOZFQKWHUBHJ-HNNXBMFYSA-N 1 2 319.836 4.403 20 0 DIADLO CC(C)(Cc1ccccc1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000605124867 1038488631 /nfs/dbraw/zinc/48/86/31/1038488631.db2.gz YRBXUIYYETWQEC-UHFFFAOYSA-N 1 2 319.408 4.284 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)c(C)n1 ZINC000684677782 1038496004 /nfs/dbraw/zinc/49/60/04/1038496004.db2.gz OCEOOBYVOMYLPR-VIFPVBQESA-N 1 2 312.310 4.106 20 0 DIADLO Clc1ccc(-c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)cc1 ZINC000605257897 1038496534 /nfs/dbraw/zinc/49/65/34/1038496534.db2.gz IBIPWDUKOWABER-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2cc(F)cc(F)c2)[nH]1 ZINC000277311760 1038500604 /nfs/dbraw/zinc/50/06/04/1038500604.db2.gz SOSQEOLEBOGIKC-DCAQKATOSA-N 1 2 308.376 4.008 20 0 DIADLO CCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1ncc(C)cn1 ZINC000342248608 1038500707 /nfs/dbraw/zinc/50/07/07/1038500707.db2.gz VZOJQQBJWGDWNR-KRWDZBQOSA-N 1 2 313.445 4.061 20 0 DIADLO Clc1ncccc1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC000172010704 1038523978 /nfs/dbraw/zinc/52/39/78/1038523978.db2.gz WONHVUWICIZXIA-OAHLLOKOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ncccc1C[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC000172010704 1038523983 /nfs/dbraw/zinc/52/39/83/1038523983.db2.gz WONHVUWICIZXIA-OAHLLOKOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)ccn1 ZINC000172010797 1038524475 /nfs/dbraw/zinc/52/44/75/1038524475.db2.gz BFGUEKSHLJMTOR-OAHLLOKOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cc(C[N@H+]2CCSC[C@@H]2c2ccccc2)ccn1 ZINC000172010797 1038524485 /nfs/dbraw/zinc/52/44/85/1038524485.db2.gz BFGUEKSHLJMTOR-OAHLLOKOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ncccc1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC000172010702 1038524529 /nfs/dbraw/zinc/52/45/29/1038524529.db2.gz WONHVUWICIZXIA-HNNXBMFYSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ncccc1C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC000172010702 1038524540 /nfs/dbraw/zinc/52/45/40/1038524540.db2.gz WONHVUWICIZXIA-HNNXBMFYSA-N 1 2 304.846 4.025 20 0 DIADLO Cc1cnc(C2CC[NH+](Cc3ncc(C(C)(C)C)o3)CC2)s1 ZINC000277402079 1038543364 /nfs/dbraw/zinc/54/33/64/1038543364.db2.gz JBFRMMFVOZFIJU-UHFFFAOYSA-N 1 2 319.474 4.117 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2cc(-c3ccco3)on2)cc1 ZINC000025361273 1038547110 /nfs/dbraw/zinc/54/71/10/1038547110.db2.gz INCFRVRSSZFMGS-MRXNPFEDSA-N 1 2 312.344 4.411 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2cc(-c3ccco3)on2)cc1 ZINC000025361273 1038547119 /nfs/dbraw/zinc/54/71/19/1038547119.db2.gz INCFRVRSSZFMGS-MRXNPFEDSA-N 1 2 312.344 4.411 20 0 DIADLO FC(F)(F)Oc1cc(Cl)ccc1C[NH+]1C2CCC1CC2 ZINC001143433077 1038550935 /nfs/dbraw/zinc/55/09/35/1038550935.db2.gz NMDVDLHZXITTGZ-UHFFFAOYSA-N 1 2 305.727 4.365 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2Nc2ccccc2)cc[nH+]1 ZINC000010163042 1038569937 /nfs/dbraw/zinc/56/99/37/1038569937.db2.gz HONPFEMTGUUQQL-UHFFFAOYSA-N 1 2 303.365 4.386 20 0 DIADLO Cc1cc(NC(=O)C[C@@H](c2[nH]cc[nH+]2)c2ccccc2)ccc1F ZINC000342408140 1038574850 /nfs/dbraw/zinc/57/48/50/1038574850.db2.gz AQRDPUOMWNSNPK-MRXNPFEDSA-N 1 2 323.371 4.018 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1ncc(Cl)s1)C(C)(C)C ZINC000934289608 1038578502 /nfs/dbraw/zinc/57/85/02/1038578502.db2.gz PJKVQWVFRLQAFG-AWEZNQCLSA-N 1 2 309.866 4.377 20 0 DIADLO CC[C@@H](CC(=O)Nc1ccc2[nH+]ccn2c1)c1ccc(C)cc1 ZINC000606198493 1038584519 /nfs/dbraw/zinc/58/45/19/1038584519.db2.gz GPGAQCLTNCJYLV-HNNXBMFYSA-N 1 2 307.397 4.165 20 0 DIADLO O=C(CC/C=C/c1ccccc1)Nc1ccccc1-n1cc[nH+]c1 ZINC000606350436 1038593465 /nfs/dbraw/zinc/59/34/65/1038593465.db2.gz BHUDBMPTFOWLFH-ONNFQVAWSA-N 1 2 317.392 4.304 20 0 DIADLO C[C@@H]1c2ccc(F)cc2CC[N@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000606448935 1038603205 /nfs/dbraw/zinc/60/32/05/1038603205.db2.gz JZVHSBUXTLLTEI-CYBMUJFWSA-N 1 2 322.383 4.109 20 0 DIADLO C[C@@H]1c2ccc(F)cc2CC[N@@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000606448935 1038603206 /nfs/dbraw/zinc/60/32/06/1038603206.db2.gz JZVHSBUXTLLTEI-CYBMUJFWSA-N 1 2 322.383 4.109 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3cccc(F)c3[C@H]2C)cc1F ZINC000606450849 1038603433 /nfs/dbraw/zinc/60/34/33/1038603433.db2.gz ULDUYXJYDHHLKM-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(C[N@H+]2CCc3cccc(F)c3[C@H]2C)cc1F ZINC000606450849 1038603436 /nfs/dbraw/zinc/60/34/36/1038603436.db2.gz ULDUYXJYDHHLKM-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO CCCc1nc(C[N@@H+]2CCC[C@H](C)[C@H]2c2ccc(C)cc2)no1 ZINC000606452252 1038605120 /nfs/dbraw/zinc/60/51/20/1038605120.db2.gz QBYGSSRPBRVIJE-KXBFYZLASA-N 1 2 313.445 4.304 20 0 DIADLO CCCc1nc(C[N@H+]2CCC[C@H](C)[C@H]2c2ccc(C)cc2)no1 ZINC000606452252 1038605122 /nfs/dbraw/zinc/60/51/22/1038605122.db2.gz QBYGSSRPBRVIJE-KXBFYZLASA-N 1 2 313.445 4.304 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2cccc(OC3CC3)c2F)n1 ZINC000657364387 1038609291 /nfs/dbraw/zinc/60/92/91/1038609291.db2.gz ZMKJKOCDGZGSHL-UHFFFAOYSA-N 1 2 320.433 4.157 20 0 DIADLO Cc1[nH]c(CNc2ccc(Br)c(Cl)c2)[nH+]c1C ZINC000582192152 1038610536 /nfs/dbraw/zinc/61/05/36/1038610536.db2.gz AACGFRACSJFGJL-UHFFFAOYSA-N 1 2 314.614 4.055 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1Sc1ccccc1)n1cc[nH+]c1 ZINC000053898703 1038620652 /nfs/dbraw/zinc/62/06/52/1038620652.db2.gz JQRUXRYHOJXBMD-CQSZACIVSA-N 1 2 323.421 4.234 20 0 DIADLO CCc1cccc2cc(C[NH2+][C@@H](COC)c3ccc(C)o3)oc21 ZINC000657384052 1038626799 /nfs/dbraw/zinc/62/67/99/1038626799.db2.gz RINJMIHOVDJEAD-KRWDZBQOSA-N 1 2 313.397 4.374 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@@H]2c2ccccn2)s1 ZINC000582340912 1038635330 /nfs/dbraw/zinc/63/53/30/1038635330.db2.gz YRLWHHLYJAJTIA-CQSZACIVSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@@H]2c2ccccn2)s1 ZINC000582340912 1038635333 /nfs/dbraw/zinc/63/53/33/1038635333.db2.gz YRLWHHLYJAJTIA-CQSZACIVSA-N 1 2 301.459 4.173 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@@H](c2cccs2)C2CC2)n1 ZINC000342516756 1038646242 /nfs/dbraw/zinc/64/62/42/1038646242.db2.gz XBIVKVCSCMJOLT-QMTHXVAHSA-N 1 2 323.487 4.186 20 0 DIADLO CCc1cccc2cc(C[NH2+][C@@H](C)c3nnc(C)s3)oc21 ZINC000657434163 1038672576 /nfs/dbraw/zinc/67/25/76/1038672576.db2.gz HEBUDEBAGGDAOM-JTQLQIEISA-N 1 2 301.415 4.006 20 0 DIADLO C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1c(Cl)cccc1Cl ZINC000607358640 1038675458 /nfs/dbraw/zinc/67/54/58/1038675458.db2.gz BLEXJQIVZYOXTD-CYBMUJFWSA-N 1 2 324.251 4.376 20 0 DIADLO C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1c(Cl)cccc1Cl ZINC000607358640 1038675464 /nfs/dbraw/zinc/67/54/64/1038675464.db2.gz BLEXJQIVZYOXTD-CYBMUJFWSA-N 1 2 324.251 4.376 20 0 DIADLO Cc1[nH]c(CNc2ccc(C(F)(F)C(F)(F)F)cc2)[nH+]c1C ZINC000657438104 1038677228 /nfs/dbraw/zinc/67/72/28/1038677228.db2.gz IPQXWRLYGCLXQN-UHFFFAOYSA-N 1 2 319.277 4.293 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccn(-c3cccc(F)c3)n2)[C@H]1c1ccccc1 ZINC001167577683 1038678585 /nfs/dbraw/zinc/67/85/85/1038678585.db2.gz VCYQXDRIHUYZPA-FOIQADDNSA-N 1 2 321.399 4.204 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccn(-c3cccc(F)c3)n2)[C@H]1c1ccccc1 ZINC001167577683 1038678587 /nfs/dbraw/zinc/67/85/87/1038678587.db2.gz VCYQXDRIHUYZPA-FOIQADDNSA-N 1 2 321.399 4.204 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@@H]2c2cccc(F)c2F)c(C)[nH+]1 ZINC000607454910 1038678726 /nfs/dbraw/zinc/67/87/26/1038678726.db2.gz AAGUMXVDVRPREJ-KGLIPLIRSA-N 1 2 316.351 4.027 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@H+](C)Cc2ccoc2)c(Cl)c1 ZINC000342646094 1038699648 /nfs/dbraw/zinc/69/96/48/1038699648.db2.gz SQFXAVBWENAGNB-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@@H+](C)Cc2ccoc2)c(Cl)c1 ZINC000342646094 1038699653 /nfs/dbraw/zinc/69/96/53/1038699653.db2.gz SQFXAVBWENAGNB-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ncsc1-c1ccc(C[NH2+][C@H]2CCCC2(F)F)cc1 ZINC000657467450 1038704998 /nfs/dbraw/zinc/70/49/98/1038704998.db2.gz MMYCFPHTMNTQSH-AWEZNQCLSA-N 1 2 308.397 4.396 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](Cc1nc2ccc(F)cc2o1)C1CC1 ZINC000119938738 1038714138 /nfs/dbraw/zinc/71/41/38/1038714138.db2.gz PJWYXZKELCIPKZ-NSHDSACASA-N 1 2 300.333 4.286 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](Cc1nc2ccc(F)cc2o1)C1CC1 ZINC000119938738 1038714146 /nfs/dbraw/zinc/71/41/46/1038714146.db2.gz PJWYXZKELCIPKZ-NSHDSACASA-N 1 2 300.333 4.286 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2nc(CC(C)C)no2)cc1 ZINC000607741730 1038719437 /nfs/dbraw/zinc/71/94/37/1038719437.db2.gz OCPCSKTWKXUVRB-QGZVFWFLSA-N 1 2 313.445 4.304 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2nc(CC(C)C)no2)cc1 ZINC000607741730 1038719440 /nfs/dbraw/zinc/71/94/40/1038719440.db2.gz OCPCSKTWKXUVRB-QGZVFWFLSA-N 1 2 313.445 4.304 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2nc(CC(C)C)no2)cc1 ZINC000607741729 1038719909 /nfs/dbraw/zinc/71/99/09/1038719909.db2.gz OCPCSKTWKXUVRB-KRWDZBQOSA-N 1 2 313.445 4.304 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2nc(CC(C)C)no2)cc1 ZINC000607741729 1038719920 /nfs/dbraw/zinc/71/99/20/1038719920.db2.gz OCPCSKTWKXUVRB-KRWDZBQOSA-N 1 2 313.445 4.304 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1csc(-c2ccco2)n1 ZINC000607747420 1038721100 /nfs/dbraw/zinc/72/11/00/1038721100.db2.gz ABZHLXNAJAYDOD-ZDUSSCGKSA-N 1 2 310.422 4.350 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1csc(-c2ccco2)n1 ZINC000607747420 1038721110 /nfs/dbraw/zinc/72/11/10/1038721110.db2.gz ABZHLXNAJAYDOD-ZDUSSCGKSA-N 1 2 310.422 4.350 20 0 DIADLO COCc1cnc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2C)s1 ZINC000342686450 1038722776 /nfs/dbraw/zinc/72/27/76/1038722776.db2.gz DERKUTVOQIJQIQ-AWEZNQCLSA-N 1 2 304.459 4.099 20 0 DIADLO COCc1cnc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2C)s1 ZINC000342686450 1038722783 /nfs/dbraw/zinc/72/27/83/1038722783.db2.gz DERKUTVOQIJQIQ-AWEZNQCLSA-N 1 2 304.459 4.099 20 0 DIADLO CCCC[C@H](C)[NH2+][C@@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000133077135 1038725683 /nfs/dbraw/zinc/72/56/83/1038725683.db2.gz LZALKVKWZRNXDF-XHDPSFHLSA-N 1 2 307.825 4.289 20 0 DIADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2nc(C3CC3)cs2)c1 ZINC000342701380 1038727189 /nfs/dbraw/zinc/72/71/89/1038727189.db2.gz YIGYDGJQNKULLQ-MRXNPFEDSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2nc(C3CC3)cs2)c1 ZINC000342701380 1038727200 /nfs/dbraw/zinc/72/72/00/1038727200.db2.gz YIGYDGJQNKULLQ-MRXNPFEDSA-N 1 2 302.418 4.497 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3cc(Cc4ccccc4)no3)cc2)[nH]1 ZINC001213085210 1038752062 /nfs/dbraw/zinc/75/20/62/1038752062.db2.gz AKCOJAMVCIBXPD-UHFFFAOYSA-N 1 2 316.364 4.399 20 0 DIADLO C[N@H+](Cc1ccco1)Cc1c(Cl)cccc1N1CCCC1 ZINC000342737493 1038753047 /nfs/dbraw/zinc/75/30/47/1038753047.db2.gz YLEBRSLCGUIHPM-UHFFFAOYSA-N 1 2 304.821 4.165 20 0 DIADLO C[N@@H+](Cc1ccco1)Cc1c(Cl)cccc1N1CCCC1 ZINC000342737493 1038753056 /nfs/dbraw/zinc/75/30/56/1038753056.db2.gz YLEBRSLCGUIHPM-UHFFFAOYSA-N 1 2 304.821 4.165 20 0 DIADLO c1c[nH]c(-c2ccc(Nc3ccc[nH+]c3N3CCCCC3)cc2)n1 ZINC001213085318 1038786694 /nfs/dbraw/zinc/78/66/94/1038786694.db2.gz CAAHOFQLTGJGDE-UHFFFAOYSA-N 1 2 319.412 4.206 20 0 DIADLO Cc1nnc(C[N@@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)o1 ZINC000075955790 1038816929 /nfs/dbraw/zinc/81/69/29/1038816929.db2.gz PZEAOXMMQUVPMU-CQSZACIVSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1nnc(C[N@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)o1 ZINC000075955790 1038816956 /nfs/dbraw/zinc/81/69/56/1038816956.db2.gz PZEAOXMMQUVPMU-CQSZACIVSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1noc(C[N@@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC000075955987 1038819199 /nfs/dbraw/zinc/81/91/99/1038819199.db2.gz ICSGZVGVWLPIDI-AWEZNQCLSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1noc(C[N@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC000075955987 1038819221 /nfs/dbraw/zinc/81/92/21/1038819221.db2.gz ICSGZVGVWLPIDI-AWEZNQCLSA-N 1 2 307.397 4.238 20 0 DIADLO C[C@H](Nc1cccc[nH+]1)c1ccc(OCc2cccnc2)cc1 ZINC000076720505 1038852643 /nfs/dbraw/zinc/85/26/43/1038852643.db2.gz DVTDHLLHLMEJBA-HNNXBMFYSA-N 1 2 305.381 4.229 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1csc2ccccc12 ZINC000077030238 1038860756 /nfs/dbraw/zinc/86/07/56/1038860756.db2.gz QXHGACKOYGYXIJ-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO COCC[N@H+](Cc1ccc(C)cc1C)Cc1ccncc1Cl ZINC000608493666 1038862182 /nfs/dbraw/zinc/86/21/82/1038862182.db2.gz CBFMUFCSEVHYQT-UHFFFAOYSA-N 1 2 318.848 4.000 20 0 DIADLO COCC[N@@H+](Cc1ccc(C)cc1C)Cc1ccncc1Cl ZINC000608493666 1038862203 /nfs/dbraw/zinc/86/22/03/1038862203.db2.gz CBFMUFCSEVHYQT-UHFFFAOYSA-N 1 2 318.848 4.000 20 0 DIADLO C[C@@H]1C[N@H+](CCc2ccc3ccccc3c2)C[C@H](C(F)(F)F)O1 ZINC000608751719 1038911456 /nfs/dbraw/zinc/91/14/56/1038911456.db2.gz VXEFCXQPTQCIFF-CXAGYDPISA-N 1 2 323.358 4.034 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2ccc3ccccc3c2)C[C@H](C(F)(F)F)O1 ZINC000608751719 1038911471 /nfs/dbraw/zinc/91/14/71/1038911471.db2.gz VXEFCXQPTQCIFF-CXAGYDPISA-N 1 2 323.358 4.034 20 0 DIADLO C[C@@H]1C[N@H+](CCc2ccc3ccccc3c2)C[C@@H](C(F)(F)F)O1 ZINC000608751720 1038911509 /nfs/dbraw/zinc/91/15/09/1038911509.db2.gz VXEFCXQPTQCIFF-DYVFJYSZSA-N 1 2 323.358 4.034 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2ccc3ccccc3c2)C[C@@H](C(F)(F)F)O1 ZINC000608751720 1038911521 /nfs/dbraw/zinc/91/15/21/1038911521.db2.gz VXEFCXQPTQCIFF-DYVFJYSZSA-N 1 2 323.358 4.034 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H](c2ccccc2F)C(C)C)nn1C ZINC000657614875 1038911762 /nfs/dbraw/zinc/91/17/62/1038911762.db2.gz TYGCBDJYKFIESE-INIZCTEOSA-N 1 2 309.816 4.008 20 0 DIADLO Cc1ncc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)o1 ZINC000628163464 1038948697 /nfs/dbraw/zinc/94/86/97/1038948697.db2.gz DALNGJQLEOQAIJ-UHFFFAOYSA-N 1 2 306.356 4.206 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)o1 ZINC000628163464 1038948707 /nfs/dbraw/zinc/94/87/07/1038948707.db2.gz DALNGJQLEOQAIJ-UHFFFAOYSA-N 1 2 306.356 4.206 20 0 DIADLO COc1cccc2c(N3C[C@H](C(F)(F)F)CC[C@@H]3C)cc[nH+]c12 ZINC000685039670 1038985605 /nfs/dbraw/zinc/98/56/05/1038985605.db2.gz YYAWFIOQZUPSTJ-NWDGAFQWSA-N 1 2 324.346 4.411 20 0 DIADLO Cc1ncsc1CN(C)c1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC000534145905 1038990305 /nfs/dbraw/zinc/99/03/05/1038990305.db2.gz ZJIBGMOFMAKCIC-UHFFFAOYSA-N 1 2 304.463 4.125 20 0 DIADLO Clc1ncc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)s1 ZINC000078668716 1039004273 /nfs/dbraw/zinc/00/42/73/1039004273.db2.gz HCPZTCYABAOKPH-HNNXBMFYSA-N 1 2 315.829 4.071 20 0 DIADLO Cc1cc(NC(=O)[C@H]2C[C@@H]2c2ccc3ccccc3c2)c(C)c[nH+]1 ZINC000534299874 1039021878 /nfs/dbraw/zinc/02/18/78/1039021878.db2.gz JEHAQUSRSQLXMI-MOPGFXCFSA-N 1 2 316.404 4.016 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Oc2ccccc2)nc1)c1cscn1 ZINC000534329238 1039028748 /nfs/dbraw/zinc/02/87/48/1039028748.db2.gz YFOCPOKNYXOUTN-ZDUSSCGKSA-N 1 2 311.410 4.181 20 0 DIADLO COCc1cnc(C[N@@H+]2CCCCC[C@@H]2c2ccc(C)o2)s1 ZINC000342936600 1039033946 /nfs/dbraw/zinc/03/39/46/1039033946.db2.gz DBMOMXPXTPIMMG-OAHLLOKOSA-N 1 2 320.458 4.308 20 0 DIADLO COCc1cnc(C[N@H+]2CCCCC[C@@H]2c2ccc(C)o2)s1 ZINC000342936600 1039033964 /nfs/dbraw/zinc/03/39/64/1039033964.db2.gz DBMOMXPXTPIMMG-OAHLLOKOSA-N 1 2 320.458 4.308 20 0 DIADLO C[N@H+](Cc1scnc1C1CC1)Cc1cc(Cl)ccc1F ZINC000425990253 1039044710 /nfs/dbraw/zinc/04/47/10/1039044710.db2.gz XVQXHYYPBRWDHH-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO C[N@@H+](Cc1scnc1C1CC1)Cc1cc(Cl)ccc1F ZINC000425990253 1039044722 /nfs/dbraw/zinc/04/47/22/1039044722.db2.gz XVQXHYYPBRWDHH-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO Cc1cc(C[NH+]2CC3(C2)CC(F)(F)C3)cc(C(F)(F)F)c1 ZINC001143448558 1039075511 /nfs/dbraw/zinc/07/55/11/1039075511.db2.gz PJKPXXLYIGTBRS-UHFFFAOYSA-N 1 2 305.290 4.245 20 0 DIADLO CC[C@@H](CC(=O)NCc1c[nH+]c(C)cc1C)c1ccc(C)cc1 ZINC000456844614 1039083456 /nfs/dbraw/zinc/08/34/56/1039083456.db2.gz RBIBEYIVIDXVLP-KRWDZBQOSA-N 1 2 310.441 4.207 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccc(C)c(Cl)c2Cl)c[nH+]1 ZINC000456842529 1039085012 /nfs/dbraw/zinc/08/50/12/1039085012.db2.gz PQSZWJKQOKRMFN-UHFFFAOYSA-N 1 2 323.223 4.244 20 0 DIADLO Cc1ccc(CCCCC(=O)NCc2c[nH+]c(C)cc2C)cc1 ZINC000456866220 1039088201 /nfs/dbraw/zinc/08/82/01/1039088201.db2.gz UURBIVWQJLGURT-UHFFFAOYSA-N 1 2 310.441 4.036 20 0 DIADLO CCOC1CC[NH+](Cc2cc(Cl)cc(Cl)c2OC)CC1 ZINC000091678284 1039102064 /nfs/dbraw/zinc/10/20/64/1039102064.db2.gz DKJKLLWYHDZASQ-UHFFFAOYSA-N 1 2 318.244 4.003 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000728539907 1039105449 /nfs/dbraw/zinc/10/54/49/1039105449.db2.gz ZRGIQQIPZIQCPN-IRXDYDNUSA-N 1 2 305.466 4.043 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc(C(C)(F)F)cc3)cc2[nH+]1 ZINC000343061474 1039144711 /nfs/dbraw/zinc/14/47/11/1039144711.db2.gz BBHYALUJQIXMQC-UHFFFAOYSA-N 1 2 315.323 4.235 20 0 DIADLO COc1cc(C)[nH+]c(CN2C[C@H](C)C[C@H]2c2ccccc2F)c1 ZINC000535281338 1039167768 /nfs/dbraw/zinc/16/77/68/1039167768.db2.gz RVQZLRDYLPRRCY-YJYMSZOUSA-N 1 2 314.404 4.121 20 0 DIADLO CCCCN(C(=O)CCCn1cc[nH+]c1)[C@H](C)c1ccccc1 ZINC000122190260 1039239879 /nfs/dbraw/zinc/23/98/79/1039239879.db2.gz MOHJNEFPBNXGQS-QGZVFWFLSA-N 1 2 313.445 4.053 20 0 DIADLO Cc1ccccc1-c1nn(C[N@@H+]2CCC[C@@H]2C2CC2)c(=S)o1 ZINC000728562023 1039274584 /nfs/dbraw/zinc/27/45/84/1039274584.db2.gz CQHOILZCOLCUGQ-OAHLLOKOSA-N 1 2 315.442 4.013 20 0 DIADLO Cc1ccccc1-c1nn(C[N@H+]2CCC[C@@H]2C2CC2)c(=S)o1 ZINC000728562023 1039274595 /nfs/dbraw/zinc/27/45/95/1039274595.db2.gz CQHOILZCOLCUGQ-OAHLLOKOSA-N 1 2 315.442 4.013 20 0 DIADLO Cc1cnn(CC2CCC2)c1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213087924 1039287083 /nfs/dbraw/zinc/28/70/83/1039287083.db2.gz HOBOCCSNUCYRDE-UHFFFAOYSA-N 1 2 307.401 4.125 20 0 DIADLO COc1ccc2c(c1)[C@H](Nc1ccc(N3CCCCC3)c[nH+]1)CC2 ZINC000539627291 1039306074 /nfs/dbraw/zinc/30/60/74/1039306074.db2.gz PNINWUCJULBHOC-LJQANCHMSA-N 1 2 323.440 4.180 20 0 DIADLO CCOc1cccc2cc([C@@H](C)[NH2+]Cc3nc(C)c(C)[nH]3)oc21 ZINC000583451897 1039329480 /nfs/dbraw/zinc/32/94/80/1039329480.db2.gz MDDAOOMZZCZPOY-CYBMUJFWSA-N 1 2 313.401 4.022 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2cccc(Cl)c2F)o1 ZINC000150993961 1039333123 /nfs/dbraw/zinc/33/31/23/1039333123.db2.gz JRPGMTMLPFZMFC-AWEZNQCLSA-N 1 2 311.784 4.112 20 0 DIADLO c1cc(N2CCCCC2)ccc1[NH2+][C@@H]1CCCC12CCOCC2 ZINC000324004185 1039336498 /nfs/dbraw/zinc/33/64/98/1039336498.db2.gz JSFVBLYIZKZFHK-LJQANCHMSA-N 1 2 314.473 4.438 20 0 DIADLO c1nc([C@@H]2CCC[N@H+]2Cc2cccc(-c3ccccc3)c2)no1 ZINC000539816604 1039345703 /nfs/dbraw/zinc/34/57/03/1039345703.db2.gz USLHLRWSBKORML-SFHVURJKSA-N 1 2 305.381 4.074 20 0 DIADLO c1nc([C@@H]2CCC[N@@H+]2Cc2cccc(-c3ccccc3)c2)no1 ZINC000539816604 1039345712 /nfs/dbraw/zinc/34/57/12/1039345712.db2.gz USLHLRWSBKORML-SFHVURJKSA-N 1 2 305.381 4.074 20 0 DIADLO CCCn1nc(C)c(C[N@H+](C)Cc2ccc(F)cc2Cl)c1C ZINC000539836043 1039361504 /nfs/dbraw/zinc/36/15/04/1039361504.db2.gz UOCAHYSHLYQCJQ-UHFFFAOYSA-N 1 2 323.843 4.334 20 0 DIADLO CCCn1nc(C)c(C[N@@H+](C)Cc2ccc(F)cc2Cl)c1C ZINC000539836043 1039361508 /nfs/dbraw/zinc/36/15/08/1039361508.db2.gz UOCAHYSHLYQCJQ-UHFFFAOYSA-N 1 2 323.843 4.334 20 0 DIADLO C[N@H+](Cc1cc[nH]n1)Cc1cccc(OCC2CCCCC2)c1 ZINC000539833358 1039361929 /nfs/dbraw/zinc/36/19/29/1039361929.db2.gz UFRIAGADGLFGRW-UHFFFAOYSA-N 1 2 313.445 4.001 20 0 DIADLO C[N@@H+](Cc1cc[nH]n1)Cc1cccc(OCC2CCCCC2)c1 ZINC000539833358 1039361948 /nfs/dbraw/zinc/36/19/48/1039361948.db2.gz UFRIAGADGLFGRW-UHFFFAOYSA-N 1 2 313.445 4.001 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000728569933 1039369983 /nfs/dbraw/zinc/36/99/83/1039369983.db2.gz VJGVYPFCFQNZRQ-CQSZACIVSA-N 1 2 323.415 4.315 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000728569933 1039369996 /nfs/dbraw/zinc/36/99/96/1039369996.db2.gz VJGVYPFCFQNZRQ-CQSZACIVSA-N 1 2 323.415 4.315 20 0 DIADLO CC(C)n1cnnc1C[N@H+](C)[C@@H](C)c1cccc2ccccc21 ZINC000583601188 1039394586 /nfs/dbraw/zinc/39/45/86/1039394586.db2.gz JKCRICZTCKCAHW-HNNXBMFYSA-N 1 2 308.429 4.205 20 0 DIADLO CC(C)n1cnnc1C[N@@H+](C)[C@@H](C)c1cccc2ccccc21 ZINC000583601188 1039394597 /nfs/dbraw/zinc/39/45/97/1039394597.db2.gz JKCRICZTCKCAHW-HNNXBMFYSA-N 1 2 308.429 4.205 20 0 DIADLO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)Nc1cc[nH+]c(C)n1 ZINC000462848611 1039405395 /nfs/dbraw/zinc/40/53/95/1039405395.db2.gz UHWNJLJVJIWQKR-GFCCVEGCSA-N 1 2 324.453 4.698 20 0 DIADLO Cc1cnc([C@@H](C)[NH+]2CCC(=Cc3ccccc3F)CC2)o1 ZINC000540052582 1039410023 /nfs/dbraw/zinc/41/00/23/1039410023.db2.gz ABZAORBVDOHJAF-CQSZACIVSA-N 1 2 300.377 4.363 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2cnc3ccsc3c2)s1 ZINC000540158898 1039429191 /nfs/dbraw/zinc/42/91/91/1039429191.db2.gz RGQGWSFKWDFJPO-SNVBAGLBSA-N 1 2 318.471 4.122 20 0 DIADLO C[C@H]([NH2+][C@H](C(=O)Nc1ccccc1)c1ccccc1)c1ccco1 ZINC000540175567 1039440408 /nfs/dbraw/zinc/44/04/08/1039440408.db2.gz KBPDISHAFNLIGA-KXBFYZLASA-N 1 2 320.392 4.310 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1cc(F)ccc1F ZINC000540165134 1039442981 /nfs/dbraw/zinc/44/29/81/1039442981.db2.gz WXJCKFVTGFMAMM-PSLIRLAXSA-N 1 2 309.743 4.403 20 0 DIADLO Cc1nc(Cl)c(C[N@@H+]2CCCC2(C)C)cc1Br ZINC001233465909 1039450668 /nfs/dbraw/zinc/45/06/68/1039450668.db2.gz YMTDDHAXUPBYJA-UHFFFAOYSA-N 1 2 317.658 4.180 20 0 DIADLO Cc1nc(Cl)c(C[N@H+]2CCCC2(C)C)cc1Br ZINC001233465909 1039450671 /nfs/dbraw/zinc/45/06/71/1039450671.db2.gz YMTDDHAXUPBYJA-UHFFFAOYSA-N 1 2 317.658 4.180 20 0 DIADLO COc1ccc(C(C)=O)c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213090831 1039479697 /nfs/dbraw/zinc/47/96/97/1039479697.db2.gz IHPLEFNRIVGQOC-UHFFFAOYSA-N 1 2 307.353 4.032 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1csc(C(F)(F)F)c1 ZINC000926534325 1039485047 /nfs/dbraw/zinc/48/50/47/1039485047.db2.gz YHQALLHVNUPNMY-NXEZZACHSA-N 1 2 317.380 4.395 20 0 DIADLO Cc1ccc(C[NH2+]Cc2nc(C(C)C)n3ccccc23)cc1F ZINC000583938676 1039515681 /nfs/dbraw/zinc/51/56/81/1039515681.db2.gz HWDZVCDZEYLCLE-UHFFFAOYSA-N 1 2 311.404 4.195 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccc2c(c1)COC2 ZINC000540727031 1039554050 /nfs/dbraw/zinc/55/40/50/1039554050.db2.gz CJRWOPSOVQCRSX-OAHLLOKOSA-N 1 2 323.440 4.275 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccc2c(c1)CCO2 ZINC000540726844 1039554334 /nfs/dbraw/zinc/55/43/34/1039554334.db2.gz INIXDUVWWPAEQI-HNNXBMFYSA-N 1 2 323.440 4.180 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1cscn1 ZINC000540790588 1039566290 /nfs/dbraw/zinc/56/62/90/1039566290.db2.gz WUWMUXDOMPOGTE-ZDUSSCGKSA-N 1 2 322.437 4.231 20 0 DIADLO Cc1nnc(C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)s1 ZINC000540952988 1039599602 /nfs/dbraw/zinc/59/96/02/1039599602.db2.gz CVZKQTWATFODIL-MRVPVSSYSA-N 1 2 307.806 4.097 20 0 DIADLO CC[N@H+](Cc1cc(C(C)(C)C)on1)[C@H](C)c1cccc(O)c1 ZINC000278644702 1039615074 /nfs/dbraw/zinc/61/50/74/1039615074.db2.gz PGVQJDHGEOTTNY-CYBMUJFWSA-N 1 2 302.418 4.261 20 0 DIADLO CC[N@@H+](Cc1cc(C(C)(C)C)on1)[C@H](C)c1cccc(O)c1 ZINC000278644702 1039615081 /nfs/dbraw/zinc/61/50/81/1039615081.db2.gz PGVQJDHGEOTTNY-CYBMUJFWSA-N 1 2 302.418 4.261 20 0 DIADLO CCc1nc(C[N@H+](C)[C@@H]2CCc3ccc(Cl)cc32)cs1 ZINC000541281528 1039658427 /nfs/dbraw/zinc/65/84/27/1039658427.db2.gz BJWGSSWFDKLTEJ-OAHLLOKOSA-N 1 2 306.862 4.478 20 0 DIADLO CCc1nc(C[N@@H+](C)[C@@H]2CCc3ccc(Cl)cc32)cs1 ZINC000541281528 1039658432 /nfs/dbraw/zinc/65/84/32/1039658432.db2.gz BJWGSSWFDKLTEJ-OAHLLOKOSA-N 1 2 306.862 4.478 20 0 DIADLO C[C@H]1C[N@H+](CCc2cccc(F)c2F)C[C@H](c2ccsc2)O1 ZINC000541349600 1039671166 /nfs/dbraw/zinc/67/11/66/1039671166.db2.gz NLUAQKGQVIMFJH-BLLLJJGKSA-N 1 2 323.408 4.031 20 0 DIADLO C[C@H]1C[N@@H+](CCc2cccc(F)c2F)C[C@H](c2ccsc2)O1 ZINC000541349600 1039671175 /nfs/dbraw/zinc/67/11/75/1039671175.db2.gz NLUAQKGQVIMFJH-BLLLJJGKSA-N 1 2 323.408 4.031 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@@H](C)c2ncc(-c3ccccc3)o2)[nH+]1 ZINC000081002619 1039697640 /nfs/dbraw/zinc/69/76/40/1039697640.db2.gz QLJUEZAKFQVZIQ-NSHDSACASA-N 1 2 319.368 4.094 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2c(C)cc(C(C)(C)C)cc2C)n1 ZINC000541651769 1039727549 /nfs/dbraw/zinc/72/75/49/1039727549.db2.gz YLOISXSHSYPHAF-CYBMUJFWSA-N 1 2 301.434 4.143 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@H](Cc1ccccc1)c1ccc(C)c(C)c1 ZINC000084674876 1039747395 /nfs/dbraw/zinc/74/73/95/1039747395.db2.gz SCYHYRDHILSTRK-OAQYLSRUSA-N 1 2 319.452 4.409 20 0 DIADLO O=C(c1cccs1)C1CC[NH+](Cc2ccc(F)cc2F)CC1 ZINC000084864574 1039751172 /nfs/dbraw/zinc/75/11/72/1039751172.db2.gz PIHDQVRLQHOKLN-UHFFFAOYSA-N 1 2 321.392 4.121 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccccn1)c1nc(-c2ccncc2)cs1 ZINC000090045763 1039789504 /nfs/dbraw/zinc/78/95/04/1039789504.db2.gz FSHJEKYXQLANJL-QWHCGFSZSA-N 1 2 310.426 4.012 20 0 DIADLO CCC[N@H+](Cc1nnc(C2CC2)n1C1CC1)Cc1ccc(C)cc1 ZINC000542091139 1039789970 /nfs/dbraw/zinc/78/99/70/1039789970.db2.gz ZCSLVBTXLLIOBX-UHFFFAOYSA-N 1 2 324.472 4.211 20 0 DIADLO CCC[N@@H+](Cc1nnc(C2CC2)n1C1CC1)Cc1ccc(C)cc1 ZINC000542091139 1039789986 /nfs/dbraw/zinc/78/99/86/1039789986.db2.gz ZCSLVBTXLLIOBX-UHFFFAOYSA-N 1 2 324.472 4.211 20 0 DIADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1ncc(-c2ccc(C)cc2)o1 ZINC000542122662 1039793941 /nfs/dbraw/zinc/79/39/41/1039793941.db2.gz FGVMIEWARDQFMO-OAHLLOKOSA-N 1 2 321.424 4.458 20 0 DIADLO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1nc3c(s1)CCCC3)CO2 ZINC000090452315 1039796278 /nfs/dbraw/zinc/79/62/78/1039796278.db2.gz MVXGHHNKJDBXSX-IUODEOHRSA-N 1 2 314.454 4.115 20 0 DIADLO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@H](C)c1ccc(F)cn1 ZINC000090118357 1039803514 /nfs/dbraw/zinc/80/35/14/1039803514.db2.gz GQQWHJNITGRBDR-CHWSQXEVSA-N 1 2 312.392 4.002 20 0 DIADLO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@H](C)c1ccc(F)cn1 ZINC000090118366 1039805151 /nfs/dbraw/zinc/80/51/51/1039805151.db2.gz GQQWHJNITGRBDR-OLZOCXBDSA-N 1 2 312.392 4.002 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncccc1F)c1ccccc1OC(F)F ZINC000090720119 1039817117 /nfs/dbraw/zinc/81/71/17/1039817117.db2.gz QMVMZVBXTUUZCE-CYBMUJFWSA-N 1 2 310.319 4.063 20 0 DIADLO O=C(/C=C/Sc1ccccc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000029914859 1039843323 /nfs/dbraw/zinc/84/33/23/1039843323.db2.gz MWXUVAPIMOJYRX-JLHYYAGUSA-N 1 2 321.405 4.117 20 0 DIADLO O=C(/C=C/c1ccccc1Cl)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000029951525 1039852338 /nfs/dbraw/zinc/85/23/38/1039852338.db2.gz PTEDLAREENKQDH-BJMVGYQFSA-N 1 2 323.783 4.178 20 0 DIADLO Fc1cc(C2CC2)ccc1C[NH2+]Cc1nc(-c2ccccc2)c[nH]1 ZINC000491594931 1039863859 /nfs/dbraw/zinc/86/38/59/1039863859.db2.gz VMQILURAUFZPKP-UHFFFAOYSA-N 1 2 321.399 4.383 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccc(F)cn1 ZINC000092720085 1039876219 /nfs/dbraw/zinc/87/62/19/1039876219.db2.gz LGGNYWOLMXGRKW-KUHUBIRLSA-N 1 2 307.372 4.056 20 0 DIADLO CC(C)([NH2+]Cc1nccn1-c1ccccc1)c1ccccc1F ZINC000492003675 1039902526 /nfs/dbraw/zinc/90/25/26/1039902526.db2.gz VWSLBSXOQBFBOK-UHFFFAOYSA-N 1 2 309.388 4.036 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(C(F)F)nc2)cs1 ZINC000657877867 1039986851 /nfs/dbraw/zinc/98/68/51/1039986851.db2.gz KUGGHOHJTVGBLT-NXEZZACHSA-N 1 2 311.401 4.450 20 0 DIADLO CC(C)(C)n1cc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)cn1 ZINC000685473605 1040071846 /nfs/dbraw/zinc/07/18/46/1040071846.db2.gz UMBAENAXPBMMSS-HNNXBMFYSA-N 1 2 303.475 4.283 20 0 DIADLO CC(C)(C)n1cc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)cn1 ZINC000685473605 1040071858 /nfs/dbraw/zinc/07/18/58/1040071858.db2.gz UMBAENAXPBMMSS-HNNXBMFYSA-N 1 2 303.475 4.283 20 0 DIADLO CCC[C@H]([NH2+][C@@H]1COCc2ccccc21)c1ncccc1Cl ZINC000926600908 1040114151 /nfs/dbraw/zinc/11/41/51/1040114151.db2.gz MFNBMOVJLTZEDV-DLBZAZTESA-N 1 2 316.832 4.437 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000685614129 1040155152 /nfs/dbraw/zinc/15/51/52/1040155152.db2.gz NSGBIHDHEAWEAS-SFHVURJKSA-N 1 2 311.816 4.251 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000685614129 1040155165 /nfs/dbraw/zinc/15/51/65/1040155165.db2.gz NSGBIHDHEAWEAS-SFHVURJKSA-N 1 2 311.816 4.251 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000685625269 1040163930 /nfs/dbraw/zinc/16/39/30/1040163930.db2.gz JDAXJXUQRWHMGQ-OAHLLOKOSA-N 1 2 310.228 4.266 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000685625269 1040163940 /nfs/dbraw/zinc/16/39/40/1040163940.db2.gz JDAXJXUQRWHMGQ-OAHLLOKOSA-N 1 2 310.228 4.266 20 0 DIADLO C/C(=C\c1ccccc1OC(F)F)C[NH2+][C@@H]1CCCC1(F)F ZINC000685623519 1040167284 /nfs/dbraw/zinc/16/72/84/1040167284.db2.gz MSDZZEJRIAFEBP-CFRMROPGSA-N 1 2 317.326 4.469 20 0 DIADLO CC(C)Oc1c(F)cc(Nc2cccc3[nH+]ccn32)cc1F ZINC001213417161 1040276031 /nfs/dbraw/zinc/27/60/31/1040276031.db2.gz AEGOSKOHHKDPER-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO Cc1ccccc1C(F)(F)C[NH2+][C@H](C)Cc1ccn(C(C)C)n1 ZINC000658315956 1040416296 /nfs/dbraw/zinc/41/62/96/1040416296.db2.gz YDBMOERFYPXBHU-OAHLLOKOSA-N 1 2 321.415 4.085 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@H](C)c2nccn2C)c2cccc(F)c2)c1 ZINC000658337382 1040428621 /nfs/dbraw/zinc/42/86/21/1040428621.db2.gz DEDUCPDYZTVVCM-DNVCBOLYSA-N 1 2 323.415 4.308 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000924540748 1040572291 /nfs/dbraw/zinc/57/22/91/1040572291.db2.gz GKDOXENAUGERTE-HTQZYQBOSA-N 1 2 300.189 4.097 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC000926672119 1040603802 /nfs/dbraw/zinc/60/38/02/1040603802.db2.gz LJEDNTKIUCZKBU-ZDUSSCGKSA-N 1 2 311.212 4.457 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cn2ccc(C(F)(F)F)n2)cc1C ZINC000065942074 1040610163 /nfs/dbraw/zinc/61/01/63/1040610163.db2.gz BEJTYXJXGQPETP-OAHLLOKOSA-N 1 2 323.362 4.313 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cn2ccc(C(F)(F)F)n2)cc1C ZINC000065942074 1040610177 /nfs/dbraw/zinc/61/01/77/1040610177.db2.gz BEJTYXJXGQPETP-OAHLLOKOSA-N 1 2 323.362 4.313 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cn2ccc(C(F)(F)F)n2)cc1 ZINC000065941194 1040610516 /nfs/dbraw/zinc/61/05/16/1040610516.db2.gz RYQDQUKGPLGGQD-CQSZACIVSA-N 1 2 309.335 4.005 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cn2ccc(C(F)(F)F)n2)cc1 ZINC000065941194 1040610527 /nfs/dbraw/zinc/61/05/27/1040610527.db2.gz RYQDQUKGPLGGQD-CQSZACIVSA-N 1 2 309.335 4.005 20 0 DIADLO CC(C)=C[C@H]1[C@@H](C(=O)Nc2cccc(-n3cc[nH+]c3)c2)C1(C)C ZINC000612504015 1040616968 /nfs/dbraw/zinc/61/69/68/1040616968.db2.gz FJSJTWXWSDHTJU-IRXDYDNUSA-N 1 2 309.413 4.049 20 0 DIADLO CCCCc1ccc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000612504021 1040617064 /nfs/dbraw/zinc/61/70/64/1040617064.db2.gz LGDXCVPCCJEVAS-UHFFFAOYSA-N 1 2 319.408 4.467 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1ccc(C(C)(C)C)c(Cl)c1 ZINC001625884204 1040721971 /nfs/dbraw/zinc/72/19/71/1040721971.db2.gz LDCBADZTXFYRMW-UHFFFAOYSA-N 1 2 316.832 4.324 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+][C@@H]1COCc2cccc(Cl)c21 ZINC000924560519 1040731936 /nfs/dbraw/zinc/73/19/36/1040731936.db2.gz XOOQOOSERDXIAC-BLLLJJGKSA-N 1 2 317.816 4.271 20 0 DIADLO Cc1c[nH]nc1C[N@@H+](Cc1ccccc1Cl)C1CCCC1 ZINC000685836069 1040772354 /nfs/dbraw/zinc/77/23/54/1040772354.db2.gz CLHIATFZLMNYQH-UHFFFAOYSA-N 1 2 303.837 4.316 20 0 DIADLO Cc1cn[nH]c1C[N@H+](Cc1ccccc1Cl)C1CCCC1 ZINC000685836069 1040772363 /nfs/dbraw/zinc/77/23/63/1040772363.db2.gz CLHIATFZLMNYQH-UHFFFAOYSA-N 1 2 303.837 4.316 20 0 DIADLO Cc1cn[nH]c1C[N@@H+](Cc1ccccc1Cl)C1CCCC1 ZINC000685836069 1040772381 /nfs/dbraw/zinc/77/23/81/1040772381.db2.gz CLHIATFZLMNYQH-UHFFFAOYSA-N 1 2 303.837 4.316 20 0 DIADLO CC[N@H+](Cc1[nH]ncc1C)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000685836163 1040772949 /nfs/dbraw/zinc/77/29/49/1040772949.db2.gz SDUFPOOJYBAFGR-FQEVSTJZSA-N 1 2 323.415 4.469 20 0 DIADLO CC[N@@H+](Cc1[nH]ncc1C)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000685836163 1040772984 /nfs/dbraw/zinc/77/29/84/1040772984.db2.gz SDUFPOOJYBAFGR-FQEVSTJZSA-N 1 2 323.415 4.469 20 0 DIADLO Cc1cn[nH]c1C[N@@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000685837977 1040777390 /nfs/dbraw/zinc/77/73/90/1040777390.db2.gz RVPWLEWXHTWMLK-HXUWFJFHSA-N 1 2 303.409 4.018 20 0 DIADLO Cc1cn[nH]c1C[N@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000685837977 1040777399 /nfs/dbraw/zinc/77/73/99/1040777399.db2.gz RVPWLEWXHTWMLK-HXUWFJFHSA-N 1 2 303.409 4.018 20 0 DIADLO FC(F)Oc1ccc(C[NH+]2CC3(CCC3(F)F)C2)cc1Cl ZINC000685850659 1040799590 /nfs/dbraw/zinc/79/95/90/1040799590.db2.gz RLMZSNBDIXSEEP-UHFFFAOYSA-N 1 2 323.717 4.173 20 0 DIADLO CC(C)(C)c1n[nH]cc1C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000570706462 1040806068 /nfs/dbraw/zinc/80/60/68/1040806068.db2.gz XBDXIHYQJQQFPC-HNNXBMFYSA-N 1 2 303.837 4.308 20 0 DIADLO CC(C)(C)c1n[nH]cc1C[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000570706462 1040806085 /nfs/dbraw/zinc/80/60/85/1040806085.db2.gz XBDXIHYQJQQFPC-HNNXBMFYSA-N 1 2 303.837 4.308 20 0 DIADLO C[C@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)c1cc2n(n1)CCC2 ZINC000414083373 1040837678 /nfs/dbraw/zinc/83/76/78/1040837678.db2.gz WPSVUCUVDSOFIA-BLLLJJGKSA-N 1 2 323.362 4.174 20 0 DIADLO CCCCCOc1cc(C)ccc1C[NH2+][C@@H](C)c1ccn(C)n1 ZINC000414091653 1040844113 /nfs/dbraw/zinc/84/41/13/1040844113.db2.gz DSYSBKQIKXDPQB-INIZCTEOSA-N 1 2 315.461 4.148 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc2n(n1)CCC2)c1ccc(F)cc1Cl ZINC000414130533 1040903354 /nfs/dbraw/zinc/90/33/54/1040903354.db2.gz WQAXRGAFQNSOFA-MNOVXSKESA-N 1 2 307.800 4.034 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1ccc(Cl)cn1 ZINC000414155351 1040931923 /nfs/dbraw/zinc/93/19/23/1040931923.db2.gz NDLUXCAPUCUNPF-ZJUUUORDSA-N 1 2 307.850 4.092 20 0 DIADLO CC[N@H+](Cc1nccn1C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000171109726 1040967266 /nfs/dbraw/zinc/96/72/66/1040967266.db2.gz MLVQMZPDXXYLRK-LBPRGKRZSA-N 1 2 311.351 4.022 20 0 DIADLO CC[N@@H+](Cc1nccn1C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000171109726 1040967289 /nfs/dbraw/zinc/96/72/89/1040967289.db2.gz MLVQMZPDXXYLRK-LBPRGKRZSA-N 1 2 311.351 4.022 20 0 DIADLO Cc1cc(C)c([C@@H](C)[NH2+]Cc2nccc(C(F)(F)F)n2)cc1C ZINC000414231007 1041032409 /nfs/dbraw/zinc/03/24/09/1041032409.db2.gz BNDBUCXXQZQWGE-CYBMUJFWSA-N 1 2 323.362 4.271 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@@]23CCCc2ccccc23)c(C)[nH+]1 ZINC000175102205 1041032719 /nfs/dbraw/zinc/03/27/19/1041032719.db2.gz XNYAOQCQVHCUKB-GHTZIAJQSA-N 1 2 320.436 4.240 20 0 DIADLO CC(C)(CNc1cccc[nH+]1)c1ccc(Br)cc1 ZINC000613511304 1041046870 /nfs/dbraw/zinc/04/68/70/1041046870.db2.gz ZEJNSHMBFWYRPT-UHFFFAOYSA-N 1 2 305.219 4.234 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000170838318 1041053263 /nfs/dbraw/zinc/05/32/63/1041053263.db2.gz AZHFDQUSHCLLRV-INIZCTEOSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000170838318 1041053279 /nfs/dbraw/zinc/05/32/79/1041053279.db2.gz AZHFDQUSHCLLRV-INIZCTEOSA-N 1 2 303.837 4.455 20 0 DIADLO Cc1ccccc1Cc1noc(C[N@@H+](C)[C@H](C)c2ccccc2)n1 ZINC000175561991 1041077410 /nfs/dbraw/zinc/07/74/10/1041077410.db2.gz FIPFNTDNJJZDJS-MRXNPFEDSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1ccccc1Cc1noc(C[N@H+](C)[C@H](C)c2ccccc2)n1 ZINC000175561991 1041077422 /nfs/dbraw/zinc/07/74/22/1041077422.db2.gz FIPFNTDNJJZDJS-MRXNPFEDSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1cc2c(cc1C)[C@H]([NH2+][C@@H](C)c1csnn1)CCS2 ZINC000414293546 1041086457 /nfs/dbraw/zinc/08/64/57/1041086457.db2.gz CZYDITYEINNVIS-WCQYABFASA-N 1 2 305.472 4.043 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](C)c2csnn2)c2ccccc12 ZINC000414308353 1041104510 /nfs/dbraw/zinc/10/45/10/1041104510.db2.gz SSRQUIXDTUOLMS-RYUDHWBXSA-N 1 2 313.426 4.112 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c(C)s1 ZINC000193133591 1041110917 /nfs/dbraw/zinc/11/09/17/1041110917.db2.gz GDGXFLGKJJEKRR-WDEREUQCSA-N 1 2 307.463 4.457 20 0 DIADLO Cn1ccnc1[C@@H]([NH2+][C@@H]1CCCC[C@H]1F)c1ccc(Cl)cc1 ZINC000414313618 1041111393 /nfs/dbraw/zinc/11/13/93/1041111393.db2.gz PAFKXHGEKZCCSF-OAGGEKHMSA-N 1 2 321.827 4.033 20 0 DIADLO CC(C)Cc1cccc([C@@H](C)[NH2+]Cc2nnc(C3CC3)s2)c1 ZINC000414320737 1041124649 /nfs/dbraw/zinc/12/46/49/1041124649.db2.gz CKKVKEFVMHFIDC-CYBMUJFWSA-N 1 2 315.486 4.465 20 0 DIADLO CCSc1ccccc1[C@@H](C)[NH2+]Cc1nnc(C2CC2)s1 ZINC000414329528 1041137374 /nfs/dbraw/zinc/13/73/74/1041137374.db2.gz QTGPLKPBWBISLR-LLVKDONJSA-N 1 2 319.499 4.378 20 0 DIADLO CCC[C@H](Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1cccnc1 ZINC000186422240 1041139642 /nfs/dbraw/zinc/13/96/42/1041139642.db2.gz DBHNGKDQUNSAOY-KRWDZBQOSA-N 1 2 310.376 4.360 20 0 DIADLO CCCCn1c(S[C@@H]2C=CCCC2)nnc1[C@H](CC)[NH+](C)C ZINC000176537534 1041184431 /nfs/dbraw/zinc/18/44/31/1041184431.db2.gz CLNVFUSWUCASFP-CABCVRRESA-N 1 2 322.522 4.292 20 0 DIADLO CCCCn1c(S[C@H]2C=CCCC2)nnc1[C@@H](CC)[NH+](C)C ZINC000176537486 1041184719 /nfs/dbraw/zinc/18/47/19/1041184719.db2.gz CLNVFUSWUCASFP-LSDHHAIUSA-N 1 2 322.522 4.292 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(C)cn1)c1nc(C(F)(F)F)cs1 ZINC000134381627 1041189765 /nfs/dbraw/zinc/18/97/65/1041189765.db2.gz TWEADVNKPWEWJD-NSHDSACASA-N 1 2 315.364 4.106 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H]1CCCc2oc(C)nc21 ZINC000924582481 1041217738 /nfs/dbraw/zinc/21/77/38/1041217738.db2.gz RJIDIGNUCFHAQY-IUODEOHRSA-N 1 2 300.402 4.028 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1ccsc1C(F)(F)F ZINC000926781348 1041221842 /nfs/dbraw/zinc/22/18/42/1041221842.db2.gz UTAMXFDXVIGCMY-SNVBAGLBSA-N 1 2 316.348 4.231 20 0 DIADLO C[NH+](C)c1ccc(NCc2cc(O)cc(C(F)(F)F)c2)cc1 ZINC000810147897 1041324262 /nfs/dbraw/zinc/32/42/62/1041324262.db2.gz ACZGRTSHMXYUIT-UHFFFAOYSA-N 1 2 310.319 4.089 20 0 DIADLO C=C(Cl)C[N@@H+](Cc1ccc(OC(F)F)c(OC)c1)C1CC1 ZINC000053137811 1041341544 /nfs/dbraw/zinc/34/15/44/1041341544.db2.gz IVDMYCRWFHROIK-UHFFFAOYSA-N 1 2 317.763 4.014 20 0 DIADLO C=C(Cl)C[N@H+](Cc1ccc(OC(F)F)c(OC)c1)C1CC1 ZINC000053137811 1041341558 /nfs/dbraw/zinc/34/15/58/1041341558.db2.gz IVDMYCRWFHROIK-UHFFFAOYSA-N 1 2 317.763 4.014 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@H](c3ccccc3)CC2)no1 ZINC000589609758 1041343905 /nfs/dbraw/zinc/34/39/05/1041343905.db2.gz OMVHUNWYWWBDEN-KRWDZBQOSA-N 1 2 313.445 4.182 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@H](c3ccccc3)CC2)no1 ZINC000589609758 1041343916 /nfs/dbraw/zinc/34/39/16/1041343916.db2.gz OMVHUNWYWWBDEN-KRWDZBQOSA-N 1 2 313.445 4.182 20 0 DIADLO COC[C@H](Nc1ccc([NH+](C)C)cc1)c1cccc(Cl)c1 ZINC000810233771 1041344921 /nfs/dbraw/zinc/34/49/21/1041344921.db2.gz OVMBLPXXKBAWFH-KRWDZBQOSA-N 1 2 304.821 4.206 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccccc2s1)c1cccc(F)c1F ZINC000181949205 1041372099 /nfs/dbraw/zinc/37/20/99/1041372099.db2.gz DIRPLIYXOKAQQQ-SNVBAGLBSA-N 1 2 304.365 4.425 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cc(C3CC3)no2)C2CC2)o1 ZINC000659814942 1041375579 /nfs/dbraw/zinc/37/55/79/1041375579.db2.gz WOCZSDCEHITIEE-SJCJKPOMSA-N 1 2 312.413 4.433 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cc(C3CC3)no2)C2CC2)o1 ZINC000659814942 1041375588 /nfs/dbraw/zinc/37/55/88/1041375588.db2.gz WOCZSDCEHITIEE-SJCJKPOMSA-N 1 2 312.413 4.433 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2cc(C3CC3)no2)C2CC2)o1 ZINC000659814944 1041375809 /nfs/dbraw/zinc/37/58/09/1041375809.db2.gz WOCZSDCEHITIEE-SJKOYZFVSA-N 1 2 312.413 4.433 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cc(C3CC3)no2)C2CC2)o1 ZINC000659814944 1041375820 /nfs/dbraw/zinc/37/58/20/1041375820.db2.gz WOCZSDCEHITIEE-SJKOYZFVSA-N 1 2 312.413 4.433 20 0 DIADLO c1cc2cnccc2c(CNc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC000378916961 1041401065 /nfs/dbraw/zinc/40/10/65/1041401065.db2.gz WPNSTYSXESUNAJ-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO CC(C)Cc1ccc(C[NH2+]Cc2cc(-c3ccccc3)on2)cn1 ZINC000892787635 1041402023 /nfs/dbraw/zinc/40/20/23/1041402023.db2.gz UJHDGGRNIFRKES-UHFFFAOYSA-N 1 2 321.424 4.225 20 0 DIADLO Cc1nn(C(C)C)c(C)c1C[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000892787780 1041402612 /nfs/dbraw/zinc/40/26/12/1041402612.db2.gz YZTBDFAIXKXEMZ-UHFFFAOYSA-N 1 2 324.428 4.026 20 0 DIADLO C[N@H+](Cc1nccn1C(F)F)Cc1cccc(C(C)(C)C)c1 ZINC000659837419 1041404869 /nfs/dbraw/zinc/40/48/69/1041404869.db2.gz FNJQCOITTBJCAR-UHFFFAOYSA-N 1 2 307.388 4.208 20 0 DIADLO C[N@@H+](Cc1nccn1C(F)F)Cc1cccc(C(C)(C)C)c1 ZINC000659837419 1041404875 /nfs/dbraw/zinc/40/48/75/1041404875.db2.gz FNJQCOITTBJCAR-UHFFFAOYSA-N 1 2 307.388 4.208 20 0 DIADLO Cc1cccc([C@@H]2CCCN2c2cc(C)[nH+]c(C3CCC3)n2)n1 ZINC000892943752 1041431228 /nfs/dbraw/zinc/43/12/28/1041431228.db2.gz ZNSBJAFSSLYUEV-KRWDZBQOSA-N 1 2 308.429 4.097 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1ccc(Br)cn1 ZINC000695221565 1041431753 /nfs/dbraw/zinc/43/17/53/1041431753.db2.gz QQDCDCKMXKHTJM-NSHDSACASA-N 1 2 320.234 4.083 20 0 DIADLO Cc1nn(C(C)C)c(C)c1C[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000892955637 1041439697 /nfs/dbraw/zinc/43/96/97/1041439697.db2.gz KSOSUIMTCMBFFQ-UHFFFAOYSA-N 1 2 324.428 4.026 20 0 DIADLO CC[C@@H](CC(F)F)C[N@@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000659849746 1041447146 /nfs/dbraw/zinc/44/71/46/1041447146.db2.gz JOGARSIFZUFUIM-AAEUAGOBSA-N 1 2 313.392 4.155 20 0 DIADLO CC[C@@H](CC(F)F)C[N@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000659849746 1041447151 /nfs/dbraw/zinc/44/71/51/1041447151.db2.gz JOGARSIFZUFUIM-AAEUAGOBSA-N 1 2 313.392 4.155 20 0 DIADLO FC(F)(F)c1nnc(C[N@H+](CC2CCCCC2)C2CC2)s1 ZINC000659849948 1041450687 /nfs/dbraw/zinc/45/06/87/1041450687.db2.gz UWXHCDXLMPNGNG-UHFFFAOYSA-N 1 2 319.396 4.102 20 0 DIADLO FC(F)(F)c1nnc(C[N@@H+](CC2CCCCC2)C2CC2)s1 ZINC000659849948 1041450692 /nfs/dbraw/zinc/45/06/92/1041450692.db2.gz UWXHCDXLMPNGNG-UHFFFAOYSA-N 1 2 319.396 4.102 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)NC[C@@H]1c2ccccc2C[N@H+]1C ZINC001132625165 1041482912 /nfs/dbraw/zinc/48/29/12/1041482912.db2.gz ZIUXDCKJHNBGMA-VQIMIIECSA-N 1 2 316.489 4.286 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)NC[C@@H]1c2ccccc2C[N@@H+]1C ZINC001132625165 1041482920 /nfs/dbraw/zinc/48/29/20/1041482920.db2.gz ZIUXDCKJHNBGMA-VQIMIIECSA-N 1 2 316.489 4.286 20 0 DIADLO CCSc1ccccc1C[NH2+][C@@H](C)c1c(F)cncc1F ZINC000930474614 1041492484 /nfs/dbraw/zinc/49/24/84/1041492484.db2.gz SRDYKALQDVPRFU-NSHDSACASA-N 1 2 308.397 4.323 20 0 DIADLO C[C@H]1CCC[C@@]1(C)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000651201701 1041500255 /nfs/dbraw/zinc/50/02/55/1041500255.db2.gz XOSRJKYTVQCZIM-IFXJQAMLSA-N 1 2 322.412 4.059 20 0 DIADLO Cc1cc(N2C[C@H](C)C[C@@H]2c2cccnc2)nc(C2CCC2)[nH+]1 ZINC000893155389 1041507769 /nfs/dbraw/zinc/50/77/69/1041507769.db2.gz HSESGVQDNNTBKQ-CXAGYDPISA-N 1 2 308.429 4.035 20 0 DIADLO CC(C)[C@H]1CC[C@@H]1[NH2+]c1ccc(N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000796976397 1041516797 /nfs/dbraw/zinc/51/67/97/1041516797.db2.gz IGDSNQHDZRHJEN-OHQAAIJDSA-N 1 2 302.462 4.147 20 0 DIADLO Clc1nccc(CNc2cccc(-n3cc[nH+]c3)c2)c1Cl ZINC000811453229 1041518549 /nfs/dbraw/zinc/51/85/49/1041518549.db2.gz RQHCOAVSLDNFBJ-UHFFFAOYSA-N 1 2 319.195 4.186 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1ccnc(Cl)c1Cl ZINC000811476232 1041527916 /nfs/dbraw/zinc/52/79/16/1041527916.db2.gz GTNZEZIOTNUGRL-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@H](c1ccc(F)cc1)C1CCCC1 ZINC000180322599 1041528988 /nfs/dbraw/zinc/52/89/88/1041528988.db2.gz WASJJEVKXUFYPW-XIKOKIGWSA-N 1 2 301.409 4.439 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2noc3c2CCCC3)c1C ZINC000180383969 1041531418 /nfs/dbraw/zinc/53/14/18/1041531418.db2.gz YDFROLZUCXUULO-UHFFFAOYSA-N 1 2 318.442 4.007 20 0 DIADLO Cc1cc(Cl)nc(C[NH2+]Cc2ccnc(Cl)c2Cl)c1 ZINC000811500854 1041531962 /nfs/dbraw/zinc/53/19/62/1041531962.db2.gz MSOXAMKLIZYNDU-UHFFFAOYSA-N 1 2 316.619 4.035 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H](Cc1ccccc1)c1cccs1 ZINC000180903841 1041539377 /nfs/dbraw/zinc/53/93/77/1041539377.db2.gz KGFBUHHPYVBECN-GUYCJALGSA-N 1 2 311.454 4.414 20 0 DIADLO c1coc(COCc2cccc(Nc3[nH+]cnc4[nH]ccc43)c2)c1 ZINC000339131429 1041548990 /nfs/dbraw/zinc/54/89/90/1041548990.db2.gz IGMXHSVKBUVBOA-UHFFFAOYSA-N 1 2 320.352 4.011 20 0 DIADLO Cc1nc(C[N@H+](CCc2ccc(C)cc2)Cc2ccco2)co1 ZINC000659965170 1041561820 /nfs/dbraw/zinc/56/18/20/1041561820.db2.gz YJBOPHZETRKMTC-UHFFFAOYSA-N 1 2 310.397 4.129 20 0 DIADLO Cc1nc(C[N@@H+](CCc2ccc(C)cc2)Cc2ccco2)co1 ZINC000659965170 1041561826 /nfs/dbraw/zinc/56/18/26/1041561826.db2.gz YJBOPHZETRKMTC-UHFFFAOYSA-N 1 2 310.397 4.129 20 0 DIADLO COc1ccc(C[NH2+][C@@H](CC(F)(F)F)c2ccc(F)cc2)o1 ZINC000893230252 1041568694 /nfs/dbraw/zinc/56/86/94/1041568694.db2.gz NDQRDQAJQQORNP-ZDUSSCGKSA-N 1 2 317.282 4.211 20 0 DIADLO c1n[nH]c([C@H]([NH2+]CC[C@H]2CCc3ccccc32)C2CCCCC2)n1 ZINC000651376275 1041571311 /nfs/dbraw/zinc/57/13/11/1041571311.db2.gz ZDLVHUGNJIZSRV-VQIMIIECSA-N 1 2 324.472 4.136 20 0 DIADLO CCCCc1ccc(C(=O)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC000613708032 1041584011 /nfs/dbraw/zinc/58/40/11/1041584011.db2.gz LIAYRNACFRUNRP-UHFFFAOYSA-N 1 2 319.408 4.467 20 0 DIADLO CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]Cc1nnc(C2CC2)[nH]1 ZINC000651390355 1041586856 /nfs/dbraw/zinc/58/68/56/1041586856.db2.gz SAIQVQDETGFJKK-GFCCVEGCSA-N 1 2 324.428 4.150 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cccc(OC)c1Cl)c1nccs1 ZINC000660079355 1041603493 /nfs/dbraw/zinc/60/34/93/1041603493.db2.gz HSHLIHCINYTUIR-OAHLLOKOSA-N 1 2 310.850 4.220 20 0 DIADLO CC(C)[N@H+](Cc1ccccc1)Cc1ncc(Cl)nc1Cl ZINC001141131835 1041612050 /nfs/dbraw/zinc/61/20/50/1041612050.db2.gz MGAGOULJLAUVLK-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO CC(C)[N@@H+](Cc1ccccc1)Cc1ncc(Cl)nc1Cl ZINC001141131835 1041612059 /nfs/dbraw/zinc/61/20/59/1041612059.db2.gz MGAGOULJLAUVLK-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO CSc1ccc(C[NH2+]C2(c3nc(C)cs3)CCCC2)o1 ZINC000641719998 1041633934 /nfs/dbraw/zinc/63/39/34/1041633934.db2.gz KNQAEDPKBKLLFL-UHFFFAOYSA-N 1 2 308.472 4.326 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1ccccc1Br ZINC000660173534 1041648024 /nfs/dbraw/zinc/64/80/24/1041648024.db2.gz BURDTFZPZFUFSQ-SNVBAGLBSA-N 1 2 321.218 4.165 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C2CC2)no1)c1ccccc1Br ZINC000660173532 1041648194 /nfs/dbraw/zinc/64/81/94/1041648194.db2.gz BURDTFZPZFUFSQ-JTQLQIEISA-N 1 2 321.218 4.165 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)CCCc1ccc(CC(C)C)cc1 ZINC001133456018 1041652090 /nfs/dbraw/zinc/65/20/90/1041652090.db2.gz OYLVCCCIKXLFPU-UHFFFAOYSA-N 1 2 324.468 4.280 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cncc(C(F)(F)F)c2)n1 ZINC000812829337 1041652998 /nfs/dbraw/zinc/65/29/98/1041652998.db2.gz RXWJDLUXYXFHHR-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cncc(C(F)(F)F)c2)n1 ZINC000812829337 1041653002 /nfs/dbraw/zinc/65/30/02/1041653002.db2.gz RXWJDLUXYXFHHR-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C)oc1C)c1ccccc1OC(F)F ZINC000660185327 1041654143 /nfs/dbraw/zinc/65/41/43/1041654143.db2.gz OJFFDNOIELOTPD-ZDUSSCGKSA-N 1 2 310.344 4.134 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(F)cc3F)CCCC2)c(C)o1 ZINC000660203582 1041666940 /nfs/dbraw/zinc/66/69/40/1041666940.db2.gz SMIKPOMLMPNHLL-UHFFFAOYSA-N 1 2 306.356 4.129 20 0 DIADLO Cc1ccc(-c2cc[nH+]c(NC3(C4CCOCC4)CC3)c2)cc1 ZINC001167744536 1041685858 /nfs/dbraw/zinc/68/58/58/1041685858.db2.gz YUDYHCLPQNXQHE-UHFFFAOYSA-N 1 2 308.425 4.428 20 0 DIADLO CC[C@H]([NH2+]Cc1cccc(OC)c1Cl)c1nc(C)cs1 ZINC000660252036 1041691237 /nfs/dbraw/zinc/69/12/37/1041691237.db2.gz FURHYCUWPOCIDL-LBPRGKRZSA-N 1 2 310.850 4.354 20 0 DIADLO CC[C@@H](CC(F)F)C[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000660331784 1041719264 /nfs/dbraw/zinc/71/92/64/1041719264.db2.gz XRGLFPFUZCGZPM-XHDPSFHLSA-N 1 2 319.342 4.020 20 0 DIADLO CC[C@@H](CC(F)F)C[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000660331784 1041719269 /nfs/dbraw/zinc/71/92/69/1041719269.db2.gz XRGLFPFUZCGZPM-XHDPSFHLSA-N 1 2 319.342 4.020 20 0 DIADLO CCCOc1cccc2c(N3CC[C@@]4(CC4(F)F)C3)cc[nH+]c12 ZINC000651489542 1041746536 /nfs/dbraw/zinc/74/65/36/1041746536.db2.gz ZOWKLHDKKACDSU-QGZVFWFLSA-N 1 2 318.367 4.259 20 0 DIADLO COc1cccc2[nH+]c(NCc3ccc4oc(C)nc4c3)ccc21 ZINC001167755846 1041755450 /nfs/dbraw/zinc/75/54/50/1041755450.db2.gz CRMYQRUQPKHWRS-UHFFFAOYSA-N 1 2 319.364 4.305 20 0 DIADLO Cc1nc2cc(CNc3cc(-c4ccncc4)cc[nH+]3)ccc2o1 ZINC001167756752 1041759155 /nfs/dbraw/zinc/75/91/55/1041759155.db2.gz MXFYRCXVDCMNTI-UHFFFAOYSA-N 1 2 316.364 4.205 20 0 DIADLO Cc1ccc([C@H](C)Nc2cc(C3(C)OCCO3)cc[nH+]2)c(C)c1 ZINC001170723703 1041759938 /nfs/dbraw/zinc/75/99/38/1041759938.db2.gz XTMWOGUCWUASIC-HNNXBMFYSA-N 1 2 312.413 4.091 20 0 DIADLO COc1cccc2c(NCc3ccc4oc(C)nc4c3)cc[nH+]c12 ZINC001167757958 1041764033 /nfs/dbraw/zinc/76/40/33/1041764033.db2.gz ILDFJOLOABVCBB-UHFFFAOYSA-N 1 2 319.364 4.305 20 0 DIADLO C[C@@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ncco1 ZINC000925680780 1041768116 /nfs/dbraw/zinc/76/81/16/1041768116.db2.gz UHTOOFDTQNAVDO-YGRLFVJLSA-N 1 2 310.319 4.495 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1coc(C3CC3)n1)[C@@H]2C ZINC000781928231 1041773285 /nfs/dbraw/zinc/77/32/85/1041773285.db2.gz VIWZTUWAWNEZOA-CHWSQXEVSA-N 1 2 312.413 4.068 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1coc(C3CC3)n1)[C@@H]2C ZINC000781928231 1041773291 /nfs/dbraw/zinc/77/32/91/1041773291.db2.gz VIWZTUWAWNEZOA-CHWSQXEVSA-N 1 2 312.413 4.068 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1ccc(Cl)nc1)[C@H]2C ZINC000781928227 1041773301 /nfs/dbraw/zinc/77/33/01/1041773301.db2.gz VFXWFFDSHUEHAJ-OLZOCXBDSA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1ccc(Cl)nc1)[C@H]2C ZINC000781928227 1041773306 /nfs/dbraw/zinc/77/33/06/1041773306.db2.gz VFXWFFDSHUEHAJ-OLZOCXBDSA-N 1 2 316.832 4.251 20 0 DIADLO Cc1nnc(C[N@@H+](Cc2ccc(C(C)C)nc2C)C(C)(C)C)o1 ZINC001167760187 1041781218 /nfs/dbraw/zinc/78/12/18/1041781218.db2.gz QTCYDNDKCXBEIY-UHFFFAOYSA-N 1 2 316.449 4.006 20 0 DIADLO Cc1nnc(C[N@H+](Cc2ccc(C(C)C)nc2C)C(C)(C)C)o1 ZINC001167760187 1041781219 /nfs/dbraw/zinc/78/12/19/1041781219.db2.gz QTCYDNDKCXBEIY-UHFFFAOYSA-N 1 2 316.449 4.006 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ncccc2C(F)(F)F)n1 ZINC000093444977 1041782439 /nfs/dbraw/zinc/78/24/39/1041782439.db2.gz BSSZVEADQPMPEM-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2ncccc2C(F)(F)F)n1 ZINC000093444977 1041782443 /nfs/dbraw/zinc/78/24/43/1041782443.db2.gz BSSZVEADQPMPEM-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO CCC[C@H]([NH2+]Cc1ccc(Cl)cn1)c1ncccc1Cl ZINC000925695270 1041797469 /nfs/dbraw/zinc/79/74/69/1041797469.db2.gz VLEXOGNOPKOITL-AWEZNQCLSA-N 1 2 310.228 4.414 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2cccc(-c3ccccc3C)c2)n1 ZINC000557177073 1041824818 /nfs/dbraw/zinc/82/48/18/1041824818.db2.gz BEPWBNLLBXNAIJ-AWEZNQCLSA-N 1 2 307.397 4.204 20 0 DIADLO c1coc([C@@H]2C[N@H+](Cc3ccc(-c4ccccc4)o3)CCO2)c1 ZINC000093841129 1041825709 /nfs/dbraw/zinc/82/57/09/1041825709.db2.gz ZWJXLLUDYBKBMW-IBGZPJMESA-N 1 2 309.365 4.113 20 0 DIADLO c1coc([C@@H]2C[N@@H+](Cc3ccc(-c4ccccc4)o3)CCO2)c1 ZINC000093841129 1041825710 /nfs/dbraw/zinc/82/57/10/1041825710.db2.gz ZWJXLLUDYBKBMW-IBGZPJMESA-N 1 2 309.365 4.113 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)CC2 ZINC000429808329 1041851629 /nfs/dbraw/zinc/85/16/29/1041851629.db2.gz MBADOUVLXZKVBE-AWEZNQCLSA-N 1 2 313.269 4.159 20 0 DIADLO CC(C)CC[C@@H](NC(=O)Nc1ccn2cc[nH+]c2c1)C(C)(C)C ZINC001204647762 1041852257 /nfs/dbraw/zinc/85/22/57/1041852257.db2.gz CLHIVOBUWJFSSF-OAHLLOKOSA-N 1 2 316.449 4.307 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2nc3cc(Cl)ccc3[nH]2)nc1 ZINC000660710073 1041855516 /nfs/dbraw/zinc/85/55/16/1041855516.db2.gz JJVWZAGAQIJHOE-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)c2nc3cc(Cl)ccc3[nH]2)nc1 ZINC000660710073 1041855519 /nfs/dbraw/zinc/85/55/19/1041855519.db2.gz JJVWZAGAQIJHOE-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1ncccc1C[N@@H+](C)[C@@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660706896 1041855818 /nfs/dbraw/zinc/85/58/18/1041855818.db2.gz ABMNKAXGPGDQBC-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1ncccc1C[N@H+](C)[C@@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660706896 1041855823 /nfs/dbraw/zinc/85/58/23/1041855823.db2.gz ABMNKAXGPGDQBC-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(C3CC3)no2)c(F)c1 ZINC000660753535 1041859569 /nfs/dbraw/zinc/85/95/69/1041859569.db2.gz JJTFRBBPHFSYQA-KRWDZBQOSA-N 1 2 304.340 4.167 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2cc(C3CC3)no2)c(F)c1 ZINC000660753535 1041859577 /nfs/dbraw/zinc/85/95/77/1041859577.db2.gz JJTFRBBPHFSYQA-KRWDZBQOSA-N 1 2 304.340 4.167 20 0 DIADLO Brc1scnc1C[N@@H+]1CCCC[C@@H]1C1CCC1 ZINC000660906674 1041869697 /nfs/dbraw/zinc/86/96/97/1041869697.db2.gz KQIJESXNZWHJSK-GFCCVEGCSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1scnc1C[N@H+]1CCCC[C@@H]1C1CCC1 ZINC000660906674 1041869702 /nfs/dbraw/zinc/86/97/02/1041869702.db2.gz KQIJESXNZWHJSK-GFCCVEGCSA-N 1 2 315.280 4.060 20 0 DIADLO COc1ccsc1C[N@@H+]1CCSC[C@@H]1c1ccc(F)cc1 ZINC001141326805 1041884227 /nfs/dbraw/zinc/88/42/27/1041884227.db2.gz PGXUEYMSSYZBMY-CQSZACIVSA-N 1 2 323.458 4.186 20 0 DIADLO COc1ccsc1C[N@H+]1CCSC[C@@H]1c1ccc(F)cc1 ZINC001141326805 1041884233 /nfs/dbraw/zinc/88/42/33/1041884233.db2.gz PGXUEYMSSYZBMY-CQSZACIVSA-N 1 2 323.458 4.186 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CCc3ccc(F)c(Cl)c32)cs1 ZINC000651702358 1041885463 /nfs/dbraw/zinc/88/54/63/1041885463.db2.gz RGUVGKOPEDHFPT-LBPRGKRZSA-N 1 2 310.825 4.275 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1ccc(-c2ccccc2)cn1)c1ccco1 ZINC000651729195 1041895956 /nfs/dbraw/zinc/89/59/56/1041895956.db2.gz YWVFIAQHTTYPCG-BEFAXECRSA-N 1 2 322.408 4.380 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+]Cc2nccn2CCc2ccccc2)o1 ZINC000164316345 1041897432 /nfs/dbraw/zinc/89/74/32/1041897432.db2.gz IUNCCBXJSHLWFO-MRXNPFEDSA-N 1 2 323.440 4.132 20 0 DIADLO COC[C@H]([NH2+][C@H]1CCc2ccc(F)c(Cl)c21)c1ccc(C)o1 ZINC000651728645 1041897900 /nfs/dbraw/zinc/89/79/00/1041897900.db2.gz FVEUEIAEWNHBRB-KBPBESRZSA-N 1 2 323.795 4.345 20 0 DIADLO C[C@H]([NH2+][C@H](CCO)c1ccco1)c1ccc(-c2ccccc2)cn1 ZINC000651764159 1041906830 /nfs/dbraw/zinc/90/68/30/1041906830.db2.gz HOOCYGMJBJLOKO-HNAYVOBHSA-N 1 2 322.408 4.116 20 0 DIADLO C[C@H]([NH2+]Cc1cnn(C)c1Cl)c1cccc(Cl)c1Cl ZINC000815124715 1041916645 /nfs/dbraw/zinc/91/66/45/1041916645.db2.gz IVMFKHGASLWABU-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO CC1(C)Cc2cccc(C[NH2+]Cc3c(F)cc(F)cc3F)c2O1 ZINC000815152127 1041918800 /nfs/dbraw/zinc/91/88/00/1041918800.db2.gz IBYMSFGNVGKACZ-UHFFFAOYSA-N 1 2 321.342 4.107 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2ccc(Cl)c(F)c2)c(F)c1 ZINC000815152078 1041919758 /nfs/dbraw/zinc/91/97/58/1041919758.db2.gz MYVYQBHGEKOOKL-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO c1c2cnccc2oc1C[N@@H+]1CCCn2c(cc3ccccc32)C1 ZINC000651812212 1041921516 /nfs/dbraw/zinc/92/15/16/1041921516.db2.gz QASHMUUSEUGELD-UHFFFAOYSA-N 1 2 317.392 4.188 20 0 DIADLO c1c2cnccc2oc1C[N@H+]1CCCn2c(cc3ccccc32)C1 ZINC000651812212 1041921526 /nfs/dbraw/zinc/92/15/26/1041921526.db2.gz QASHMUUSEUGELD-UHFFFAOYSA-N 1 2 317.392 4.188 20 0 DIADLO CC(F)(F)C[NH2+]Cc1ccc(OCc2ccccc2F)cc1 ZINC000815146457 1041926637 /nfs/dbraw/zinc/92/66/37/1041926637.db2.gz CAHYGQUETFHZMW-UHFFFAOYSA-N 1 2 309.331 4.150 20 0 DIADLO CC/C(=C/C(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000728821012 1041941012 /nfs/dbraw/zinc/94/10/12/1041941012.db2.gz AECGJDNYXIAASO-PTNGSMBKSA-N 1 2 305.381 4.075 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](c2ccccc2F)C(C)C)cs1 ZINC000661489144 1041944042 /nfs/dbraw/zinc/94/40/42/1041944042.db2.gz ZXPFYWGJZCYKHH-MLGOLLRUSA-N 1 2 322.449 4.477 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cnc(-c2ccccc2)nc1 ZINC000613794603 1041945214 /nfs/dbraw/zinc/94/52/14/1041945214.db2.gz VRUFIVOCQNBDFY-OAHLLOKOSA-N 1 2 321.399 4.476 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cnc(-c2ccccc2)nc1 ZINC000613794603 1041945222 /nfs/dbraw/zinc/94/52/22/1041945222.db2.gz VRUFIVOCQNBDFY-OAHLLOKOSA-N 1 2 321.399 4.476 20 0 DIADLO Cc1nnc(C[N@@H+](C)[C@@H](C)c2ccc(Oc3ccccc3)cc2)o1 ZINC000661529160 1041949255 /nfs/dbraw/zinc/94/92/55/1041949255.db2.gz PLNIHNHMRUMCEL-AWEZNQCLSA-N 1 2 323.396 4.363 20 0 DIADLO Cc1nnc(C[N@H+](C)[C@@H](C)c2ccc(Oc3ccccc3)cc2)o1 ZINC000661529160 1041949260 /nfs/dbraw/zinc/94/92/60/1041949260.db2.gz PLNIHNHMRUMCEL-AWEZNQCLSA-N 1 2 323.396 4.363 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cc(F)cc(N)c2Cl)cc1F ZINC001245467922 1041949751 /nfs/dbraw/zinc/94/97/51/1041949751.db2.gz GXCPAXCWLLHMKP-UHFFFAOYSA-N 1 2 314.738 4.068 20 0 DIADLO Fc1c(Br)cccc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001245485191 1041955254 /nfs/dbraw/zinc/95/52/54/1041955254.db2.gz ZUQYJWBIHNYDEL-UHFFFAOYSA-N 1 2 317.161 4.441 20 0 DIADLO CC[N@H+](Cc1noc2c1CCCC2)Cc1cccc(Cl)c1 ZINC000595563795 1041960366 /nfs/dbraw/zinc/96/03/66/1041960366.db2.gz ZTRZPSBRDUJZEB-UHFFFAOYSA-N 1 2 304.821 4.229 20 0 DIADLO CC[N@@H+](Cc1noc2c1CCCC2)Cc1cccc(Cl)c1 ZINC000595563795 1041960371 /nfs/dbraw/zinc/96/03/71/1041960371.db2.gz ZTRZPSBRDUJZEB-UHFFFAOYSA-N 1 2 304.821 4.229 20 0 DIADLO Clc1ccccc1OCCSc1[nH+]cc2ccccn21 ZINC000047822509 1041971697 /nfs/dbraw/zinc/97/16/97/1041971697.db2.gz RLFHGFIELOMJJJ-UHFFFAOYSA-N 1 2 304.802 4.159 20 0 DIADLO CC[C@H](Nc1ccc([NH+](C)C)cc1)c1ccc(C(=O)OC)cc1 ZINC000815610241 1041972531 /nfs/dbraw/zinc/97/25/31/1041972531.db2.gz GGALOKCOCYRDJG-SFHVURJKSA-N 1 2 312.413 4.102 20 0 DIADLO C[C@@H]([NH2+]C1(c2ccccc2Cl)CCC1)c1cc2n(n1)CCC2 ZINC000652216711 1041977496 /nfs/dbraw/zinc/97/74/96/1041977496.db2.gz DJZRIPUATWAHGE-CYBMUJFWSA-N 1 2 315.848 4.213 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1c(F)cc(F)cc1F ZINC000815650606 1041985219 /nfs/dbraw/zinc/98/52/19/1041985219.db2.gz WSUKMCQASQYERS-LLVKDONJSA-N 1 2 309.331 4.272 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccc(F)cc1F ZINC000815650446 1041985364 /nfs/dbraw/zinc/98/53/64/1041985364.db2.gz RLBKBUGKFOOIOS-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO Fc1cc(F)c(C[NH2+][C@H]2CCc3c2c(F)ccc3F)c(F)c1 ZINC000815650531 1041985622 /nfs/dbraw/zinc/98/56/22/1041985622.db2.gz UCYGNVRDOJWDGY-HNNXBMFYSA-N 1 2 313.269 4.159 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1cc(F)cc(F)c1 ZINC000815650112 1041986064 /nfs/dbraw/zinc/98/60/64/1041986064.db2.gz IUXPDNNZKYACIG-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO Brc1nc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)cs1 ZINC001137583567 1041993460 /nfs/dbraw/zinc/99/34/60/1041993460.db2.gz ZHPCONMEMHRYSG-ZYHUDNBSSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1nc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)cs1 ZINC001137583567 1041993464 /nfs/dbraw/zinc/99/34/64/1041993464.db2.gz ZHPCONMEMHRYSG-ZYHUDNBSSA-N 1 2 315.280 4.060 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2csc(C3CCCCC3)n2)C[C@H](C)O1 ZINC000661855682 1042006990 /nfs/dbraw/zinc/00/69/90/1042006990.db2.gz BFIWWKLHOXRZQN-KGLIPLIRSA-N 1 2 308.491 4.190 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2csc(C3CCCCC3)n2)C[C@H](C)O1 ZINC000661855682 1042006996 /nfs/dbraw/zinc/00/69/96/1042006996.db2.gz BFIWWKLHOXRZQN-KGLIPLIRSA-N 1 2 308.491 4.190 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CCCOc3ccc(Cl)cc32)c1 ZINC000652330714 1042009851 /nfs/dbraw/zinc/00/98/51/1042009851.db2.gz NJXHXROOMFRRIV-OAHLLOKOSA-N 1 2 318.804 4.207 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2ccc(C(F)(F)F)cc2)c1 ZINC000652330898 1042009924 /nfs/dbraw/zinc/00/99/24/1042009924.db2.gz SCGKHDLVPOXLMX-NSHDSACASA-N 1 2 310.319 4.420 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CCCOc3cc4c(cc32)CCC4)c1 ZINC000652331135 1042013418 /nfs/dbraw/zinc/01/34/18/1042013418.db2.gz ZDOJZTIVJITNHJ-SFHVURJKSA-N 1 2 324.424 4.043 20 0 DIADLO CCCc1ccc(NC(=O)Cc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001135333479 1042016298 /nfs/dbraw/zinc/01/62/98/1042016298.db2.gz ZILQSILROVOTMK-UHFFFAOYSA-N 1 2 319.408 4.006 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ncc(-c3ccccc3)o2)cc1 ZINC000048811168 1042026965 /nfs/dbraw/zinc/02/69/65/1042026965.db2.gz RXQDDZPEDNIFRC-UHFFFAOYSA-N 1 2 322.408 4.372 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ncc(-c3ccccc3)o2)cc1 ZINC000048811168 1042026970 /nfs/dbraw/zinc/02/69/70/1042026970.db2.gz RXQDDZPEDNIFRC-UHFFFAOYSA-N 1 2 322.408 4.372 20 0 DIADLO CC(C)CCc1nc(C[NH+]2CCC(c3ccon3)CC2)cs1 ZINC000662046763 1042049153 /nfs/dbraw/zinc/04/91/53/1042049153.db2.gz NYJWIWYZJFAFRB-UHFFFAOYSA-N 1 2 319.474 4.099 20 0 DIADLO Clc1cc(C[NH+]2CCC(c3ccon3)CC2)c(Cl)s1 ZINC000662049316 1042050452 /nfs/dbraw/zinc/05/04/52/1042050452.db2.gz WVRSWBFMBFLERH-UHFFFAOYSA-N 1 2 317.241 4.423 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1cnn(C)c1Cl ZINC000816483941 1042055725 /nfs/dbraw/zinc/05/57/25/1042055725.db2.gz KZSFBKJDJCRERG-NSHDSACASA-N 1 2 303.793 4.013 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1cnn(C)c1Cl ZINC000816483941 1042055734 /nfs/dbraw/zinc/05/57/34/1042055734.db2.gz KZSFBKJDJCRERG-NSHDSACASA-N 1 2 303.793 4.013 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)Cc1cnn(C)c1Cl ZINC000816482326 1042056374 /nfs/dbraw/zinc/05/63/74/1042056374.db2.gz BSRHTDGKYWJIHB-UHFFFAOYSA-N 1 2 317.820 4.014 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)Cc1cnn(C)c1Cl ZINC000816482326 1042056381 /nfs/dbraw/zinc/05/63/81/1042056381.db2.gz BSRHTDGKYWJIHB-UHFFFAOYSA-N 1 2 317.820 4.014 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](Cc1cnn(C)c1Cl)C1CC1 ZINC000816484450 1042056541 /nfs/dbraw/zinc/05/65/41/1042056541.db2.gz CMYCIEPMHKJYJN-NSHDSACASA-N 1 2 324.255 4.453 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](Cc1cnn(C)c1Cl)C1CC1 ZINC000816484450 1042056546 /nfs/dbraw/zinc/05/65/46/1042056546.db2.gz CMYCIEPMHKJYJN-NSHDSACASA-N 1 2 324.255 4.453 20 0 DIADLO Cn1ncc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)c1Cl ZINC000816486680 1042057669 /nfs/dbraw/zinc/05/76/69/1042057669.db2.gz NREJZAZAYWACJD-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1ncc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)c1Cl ZINC000816486680 1042057677 /nfs/dbraw/zinc/05/76/77/1042057677.db2.gz NREJZAZAYWACJD-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO C[C@@H](Cc1ccccc1)[N@H+](Cc1csnn1)Cc1ccccc1 ZINC000662155700 1042074770 /nfs/dbraw/zinc/07/47/70/1042074770.db2.gz MYILLBDQWJUNCX-INIZCTEOSA-N 1 2 323.465 4.172 20 0 DIADLO C[C@@H](Cc1ccccc1)[N@@H+](Cc1csnn1)Cc1ccccc1 ZINC000662155700 1042074773 /nfs/dbraw/zinc/07/47/73/1042074773.db2.gz MYILLBDQWJUNCX-INIZCTEOSA-N 1 2 323.465 4.172 20 0 DIADLO c1cc2c(cc1Nc1ccc(N3CCCCC3)[nH+]c1)NCCC2 ZINC001159604130 1042094686 /nfs/dbraw/zinc/09/46/86/1042094686.db2.gz IGKFNCBJEKFUNX-UHFFFAOYSA-N 1 2 308.429 4.174 20 0 DIADLO CSc1ccc(F)c(-c2cc(N)c(C(F)(F)F)c[nH+]2)c1 ZINC001245747864 1042100413 /nfs/dbraw/zinc/10/04/13/1042100413.db2.gz ZKXJLWHANHHJHY-UHFFFAOYSA-N 1 2 302.296 4.211 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(Cl)s2)cs1 ZINC000165223239 1042115566 /nfs/dbraw/zinc/11/55/66/1042115566.db2.gz VWFHIAVZYWINSF-IUCAKERBSA-N 1 2 316.879 4.416 20 0 DIADLO CC1(C)C[C@@]1([NH2+]Cc1nc(-c2ccccc2)no1)c1ccccc1 ZINC000662342605 1042115589 /nfs/dbraw/zinc/11/55/89/1042115589.db2.gz BAFYCZAHOIGODX-HXUWFJFHSA-N 1 2 319.408 4.152 20 0 DIADLO CCC[C@H]1[C@H](C)CCC[N@@H+]1Cc1ncsc1Br ZINC001167798587 1042117270 /nfs/dbraw/zinc/11/72/70/1042117270.db2.gz NLEDIZIETMHCTI-PWSUYJOCSA-N 1 2 317.296 4.306 20 0 DIADLO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1ncsc1Br ZINC001167798587 1042117272 /nfs/dbraw/zinc/11/72/72/1042117272.db2.gz NLEDIZIETMHCTI-PWSUYJOCSA-N 1 2 317.296 4.306 20 0 DIADLO Cc1cc(CNC(=S)Nc2ccc(C(C)C)cc2)cc(C)[nH+]1 ZINC000817562051 1042119799 /nfs/dbraw/zinc/11/97/99/1042119799.db2.gz GLODYQUBNJYCDI-UHFFFAOYSA-N 1 2 313.470 4.308 20 0 DIADLO CC(C)(C)OC1CC[NH+](Cc2csc(C(C)(C)C)n2)CC1 ZINC000162573267 1042127212 /nfs/dbraw/zinc/12/72/12/1042127212.db2.gz ZXLVFLUULHGIJJ-UHFFFAOYSA-N 1 2 310.507 4.220 20 0 DIADLO Cc1ccc2nc(C[NH2+]Cc3ccc(Cl)cc3Cl)cn2c1 ZINC000066862964 1042140344 /nfs/dbraw/zinc/14/03/44/1042140344.db2.gz ALSPNEDKJVVXFA-UHFFFAOYSA-N 1 2 320.223 4.239 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1C[NH2+]Cc1ccc(Cl)o1 ZINC000603509970 1042151379 /nfs/dbraw/zinc/15/13/79/1042151379.db2.gz RFTDTEDXADREET-UHFFFAOYSA-N 1 2 307.674 4.381 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000051688988 1042162955 /nfs/dbraw/zinc/16/29/55/1042162955.db2.gz URMVHSULDPAKCH-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000051688988 1042162962 /nfs/dbraw/zinc/16/29/62/1042162962.db2.gz URMVHSULDPAKCH-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO CCCCOC(=O)c1ccc(NCc2c[nH+]cn2C(C)C)cc1 ZINC000819148080 1042172292 /nfs/dbraw/zinc/17/22/92/1042172292.db2.gz XQSMRKYUHGDQRJ-UHFFFAOYSA-N 1 2 315.417 4.033 20 0 DIADLO C/C=C(\CC)C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000819605200 1042189908 /nfs/dbraw/zinc/18/99/08/1042189908.db2.gz GQWGWVLKCHQUHG-LZWSPWQCSA-N 1 2 309.413 4.181 20 0 DIADLO COc1cc(OC)cc([C@H](C)Nc2[nH+]cccc2-n2cccc2)c1 ZINC001170931447 1042190373 /nfs/dbraw/zinc/19/03/73/1042190373.db2.gz YLQODEWOJNJNRR-AWEZNQCLSA-N 1 2 323.396 4.063 20 0 DIADLO COc1cc(OC)cc([C@H](C)Nc2cc[nH+]c(OC(C)C)c2)c1 ZINC001170934036 1042191112 /nfs/dbraw/zinc/19/11/12/1042191112.db2.gz QEEROVWCXHCFSY-ZDUSSCGKSA-N 1 2 316.401 4.059 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2nc3ccccc3c(C)c2Cl)C[C@@H](C)O1 ZINC000303429500 1042204148 /nfs/dbraw/zinc/20/41/48/1042204148.db2.gz BQDGYIVWJFSUJM-TZMCWYRMSA-N 1 2 318.848 4.196 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2nc3ccccc3c(C)c2Cl)C[C@@H](C)O1 ZINC000303429500 1042204156 /nfs/dbraw/zinc/20/41/56/1042204156.db2.gz BQDGYIVWJFSUJM-TZMCWYRMSA-N 1 2 318.848 4.196 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CCCCC2)cs1)c1ccccn1 ZINC000278916749 1042209120 /nfs/dbraw/zinc/20/91/20/1042209120.db2.gz WGLPZAIJUZNBSE-CYBMUJFWSA-N 1 2 301.459 4.437 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H]2CCc3ccc(Cl)nc32)cs1 ZINC000820810130 1042229368 /nfs/dbraw/zinc/22/93/68/1042229368.db2.gz PMOKIDVMCCNIAY-KOLCDFICSA-N 1 2 307.850 4.092 20 0 DIADLO CC(C)C[C@@H](C(=O)N(C)c1cccc(C(C)C)c1)n1cc[nH+]c1 ZINC001136387356 1042230213 /nfs/dbraw/zinc/23/02/13/1042230213.db2.gz GWNVOPBIWABNLX-SFHVURJKSA-N 1 2 313.445 4.257 20 0 DIADLO CCCC[N@H+](Cc1ccn(C(C)C)n1)Cc1ccccc1F ZINC000604884711 1042231578 /nfs/dbraw/zinc/23/15/78/1042231578.db2.gz FYHWPVUXILRRAU-UHFFFAOYSA-N 1 2 303.425 4.405 20 0 DIADLO CCCC[N@@H+](Cc1ccn(C(C)C)n1)Cc1ccccc1F ZINC000604884711 1042231583 /nfs/dbraw/zinc/23/15/83/1042231583.db2.gz FYHWPVUXILRRAU-UHFFFAOYSA-N 1 2 303.425 4.405 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)C(C)(C)c2ccccc2)n1 ZINC000585754508 1042242876 /nfs/dbraw/zinc/24/28/76/1042242876.db2.gz PVCRNKJFYOYKSM-CYBMUJFWSA-N 1 2 319.474 4.251 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)C(C)(C)c2ccccc2)n1 ZINC000585754508 1042242880 /nfs/dbraw/zinc/24/28/80/1042242880.db2.gz PVCRNKJFYOYKSM-CYBMUJFWSA-N 1 2 319.474 4.251 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cc(C)cc(C)c3)CCCCCC2)no1 ZINC000585817258 1042265459 /nfs/dbraw/zinc/26/54/59/1042265459.db2.gz XUYYZWDQWXZBIO-UHFFFAOYSA-N 1 2 313.445 4.334 20 0 DIADLO Cc1cc(NC(=O)c2sc3cccc(C)c3c2Cl)cc[nH+]1 ZINC000637229307 1042270070 /nfs/dbraw/zinc/27/00/70/1042270070.db2.gz SBGVRMISXCKLBT-UHFFFAOYSA-N 1 2 316.813 4.241 20 0 DIADLO FC(F)(F)c1nc(C[NH2+][C@@H]2CCCc3sccc32)cs1 ZINC000893640463 1042274279 /nfs/dbraw/zinc/27/42/79/1042274279.db2.gz MECQHQRXJLLIHJ-SNVBAGLBSA-N 1 2 318.389 4.391 20 0 DIADLO C[C@H]1CCN(c2[nH+]ccc3c(N)cccc32)[C@@H](c2ccco2)C1 ZINC000663674290 1042277295 /nfs/dbraw/zinc/27/72/95/1042277295.db2.gz HUBYXCBNCYQYAL-SUMWQHHRSA-N 1 2 307.397 4.388 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+]2CCC[C@@H]2c2ccccc2)n1 ZINC000169280827 1042289205 /nfs/dbraw/zinc/28/92/05/1042289205.db2.gz KTLRLVJEQRYDRW-DZGCQCFKSA-N 1 2 317.458 4.221 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+]2CCC[C@@H]2c2ccccc2)n1 ZINC000169280827 1042289209 /nfs/dbraw/zinc/28/92/09/1042289209.db2.gz KTLRLVJEQRYDRW-DZGCQCFKSA-N 1 2 317.458 4.221 20 0 DIADLO C/C(=C\C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1)c1ccccc1 ZINC001136624579 1042300065 /nfs/dbraw/zinc/30/00/65/1042300065.db2.gz AMOSLBDZZBGQRV-FYWRMAATSA-N 1 2 317.392 4.223 20 0 DIADLO Cc1ccccc1[C@H](C)[N@H+](C)Cc1ccncc1Br ZINC000625104535 1042322219 /nfs/dbraw/zinc/32/22/19/1042322219.db2.gz RHGBNZVUNFKXCP-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1ccncc1Br ZINC000625104535 1042322224 /nfs/dbraw/zinc/32/22/24/1042322224.db2.gz RHGBNZVUNFKXCP-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CCC[C@@H]4C[C@@H]43)c2)[nH+]c1C ZINC000823354031 1042322837 /nfs/dbraw/zinc/32/28/37/1042322837.db2.gz YBRWCQUDTHTIEF-XYPHTWIQSA-N 1 2 309.413 4.068 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H](C)Cc3ccco3)c2)[nH+]c1C ZINC000823352079 1042322906 /nfs/dbraw/zinc/32/29/06/1042322906.db2.gz DMRHSLSOUPBNHL-LBPRGKRZSA-N 1 2 323.396 4.104 20 0 DIADLO Fc1cccc(C[N@H+](Cc2ccnc(Cl)c2F)C2CC2)c1 ZINC000823400008 1042323787 /nfs/dbraw/zinc/32/37/87/1042323787.db2.gz WBBLDKXADOWQEX-UHFFFAOYSA-N 1 2 308.759 4.178 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2ccnc(Cl)c2F)C2CC2)c1 ZINC000823400008 1042323794 /nfs/dbraw/zinc/32/37/94/1042323794.db2.gz WBBLDKXADOWQEX-UHFFFAOYSA-N 1 2 308.759 4.178 20 0 DIADLO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)ncc2F)cc1 ZINC000823390961 1042323951 /nfs/dbraw/zinc/32/39/51/1042323951.db2.gz NFRZDCUFXMMKIP-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)ncc2F)cc1 ZINC000823390961 1042323957 /nfs/dbraw/zinc/32/39/57/1042323957.db2.gz NFRZDCUFXMMKIP-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO Fc1c(C[N@@H+]2CCS[C@H](c3ccccc3)C2)ccnc1Cl ZINC000823452567 1042326139 /nfs/dbraw/zinc/32/61/39/1042326139.db2.gz COARNGSMXJRDHT-AWEZNQCLSA-N 1 2 322.836 4.164 20 0 DIADLO Fc1c(C[N@H+]2CCS[C@H](c3ccccc3)C2)ccnc1Cl ZINC000823452567 1042326144 /nfs/dbraw/zinc/32/61/44/1042326144.db2.gz COARNGSMXJRDHT-AWEZNQCLSA-N 1 2 322.836 4.164 20 0 DIADLO C[N@H+](Cc1csc(Cc2ccccc2)n1)Cc1ccccc1 ZINC000051122449 1042328938 /nfs/dbraw/zinc/32/89/38/1042328938.db2.gz LDGJLDXUKZXXNY-UHFFFAOYSA-N 1 2 308.450 4.366 20 0 DIADLO C[N@@H+](Cc1csc(Cc2ccccc2)n1)Cc1ccccc1 ZINC000051122449 1042328944 /nfs/dbraw/zinc/32/89/44/1042328944.db2.gz LDGJLDXUKZXXNY-UHFFFAOYSA-N 1 2 308.450 4.366 20 0 DIADLO N#Cc1ccc(NCc2ccc(-n3cc[nH+]c3)cc2)c(Cl)c1 ZINC000319080991 1042333464 /nfs/dbraw/zinc/33/34/64/1042333464.db2.gz RGPPKZZOWIEWMK-UHFFFAOYSA-N 1 2 308.772 4.009 20 0 DIADLO C[C@H]1COCCN1c1ccc([NH2+][C@H]2CCCC23CCC3)cc1 ZINC000823554074 1042334318 /nfs/dbraw/zinc/33/43/18/1042334318.db2.gz GVUOFZZHWPYWLC-YJBOKZPZSA-N 1 2 300.446 4.046 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2csc(C(C)C)n2)cc1 ZINC000051352749 1042335979 /nfs/dbraw/zinc/33/59/79/1042335979.db2.gz MEAPJGVTGHHSAR-UHFFFAOYSA-N 1 2 304.459 4.297 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2csc(C(C)C)n2)cc1 ZINC000051352749 1042335989 /nfs/dbraw/zinc/33/59/89/1042335989.db2.gz MEAPJGVTGHHSAR-UHFFFAOYSA-N 1 2 304.459 4.297 20 0 DIADLO C[C@@H](c1cccc2ccccc21)[N@@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000606902519 1042336406 /nfs/dbraw/zinc/33/64/06/1042336406.db2.gz ZSOBEONHEHNALK-LRDDRELGSA-N 1 2 309.331 4.164 20 0 DIADLO C[C@@H](c1cccc2ccccc21)[N@H+]1CCO[C@H](C(F)(F)F)C1 ZINC000606902519 1042336411 /nfs/dbraw/zinc/33/64/11/1042336411.db2.gz ZSOBEONHEHNALK-LRDDRELGSA-N 1 2 309.331 4.164 20 0 DIADLO FC(F)c1cccc(C[N@@H+]2CCO[C@H](c3cccs3)C2)c1 ZINC000279790174 1042342946 /nfs/dbraw/zinc/34/29/46/1042342946.db2.gz VHBPEOYGGOFSHJ-AWEZNQCLSA-N 1 2 309.381 4.259 20 0 DIADLO FC(F)c1cccc(C[N@H+]2CCO[C@H](c3cccs3)C2)c1 ZINC000279790174 1042342954 /nfs/dbraw/zinc/34/29/54/1042342954.db2.gz VHBPEOYGGOFSHJ-AWEZNQCLSA-N 1 2 309.381 4.259 20 0 DIADLO CCCOc1ccccc1NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000236966681 1042354499 /nfs/dbraw/zinc/35/44/99/1042354499.db2.gz GLJQUBJFBOWFGC-UHFFFAOYSA-N 1 2 307.397 4.273 20 0 DIADLO COC(=O)c1ccoc1C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000339005216 1042364900 /nfs/dbraw/zinc/36/49/00/1042364900.db2.gz JERMUHVFRLXMGK-HNNXBMFYSA-N 1 2 319.788 4.057 20 0 DIADLO COC(=O)c1ccoc1C[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000339005216 1042364905 /nfs/dbraw/zinc/36/49/05/1042364905.db2.gz JERMUHVFRLXMGK-HNNXBMFYSA-N 1 2 319.788 4.057 20 0 DIADLO CC(C)Oc1ccccc1NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000125032854 1042365549 /nfs/dbraw/zinc/36/55/49/1042365549.db2.gz UAIOYAZTBMRMDK-UHFFFAOYSA-N 1 2 307.397 4.272 20 0 DIADLO Brc1cncc([C@H]2CCC[N@@H+]2Cc2ccsc2)c1 ZINC000932252611 1042384721 /nfs/dbraw/zinc/38/47/21/1042384721.db2.gz MTNVWTCAVZBPSY-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cncc([C@H]2CCC[N@H+]2Cc2ccsc2)c1 ZINC000932252611 1042384725 /nfs/dbraw/zinc/38/47/25/1042384725.db2.gz MTNVWTCAVZBPSY-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)CSc2ccccc2)c(C)[nH+]1 ZINC000110191608 1042400968 /nfs/dbraw/zinc/40/09/68/1042400968.db2.gz XMGCIOBIQLAGRG-ZDUSSCGKSA-N 1 2 314.454 4.374 20 0 DIADLO CCCc1nc(C[N@@H+]2CCC[C@@H]2c2ccccc2OC)cs1 ZINC000303222044 1042415362 /nfs/dbraw/zinc/41/53/62/1042415362.db2.gz VBMNOMJDTAMXDS-MRXNPFEDSA-N 1 2 316.470 4.441 20 0 DIADLO CCCc1nc(C[N@H+]2CCC[C@@H]2c2ccccc2OC)cs1 ZINC000303222044 1042415363 /nfs/dbraw/zinc/41/53/63/1042415363.db2.gz VBMNOMJDTAMXDS-MRXNPFEDSA-N 1 2 316.470 4.441 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)[C@H](C)c2ccccc2C)n1 ZINC000248217544 1042438647 /nfs/dbraw/zinc/43/86/47/1042438647.db2.gz ZYGZOJMSRTZMTI-KGLIPLIRSA-N 1 2 319.474 4.385 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)[C@H](C)c2ccccc2C)n1 ZINC000248217544 1042438649 /nfs/dbraw/zinc/43/86/49/1042438649.db2.gz ZYGZOJMSRTZMTI-KGLIPLIRSA-N 1 2 319.474 4.385 20 0 DIADLO CC(C)Cc1noc(C[N@H+](C)Cc2cccc3ccccc32)n1 ZINC000051992783 1042446666 /nfs/dbraw/zinc/44/66/66/1042446666.db2.gz DHBFPJGEWSYZHP-UHFFFAOYSA-N 1 2 309.413 4.053 20 0 DIADLO CC(C)Cc1noc(C[N@@H+](C)Cc2cccc3ccccc32)n1 ZINC000051992783 1042446668 /nfs/dbraw/zinc/44/66/68/1042446668.db2.gz DHBFPJGEWSYZHP-UHFFFAOYSA-N 1 2 309.413 4.053 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccccc2Oc2ccccc2)[nH]1 ZINC000411447078 1042446930 /nfs/dbraw/zinc/44/69/30/1042446930.db2.gz BJRXQSFERLJLQQ-ZIAGYGMSSA-N 1 2 322.412 4.317 20 0 DIADLO C[C@H]1CN(c2ccc([NH2+][C@H]3CCC34CCCC4)cc2)CCO1 ZINC000249161611 1042452188 /nfs/dbraw/zinc/45/21/88/1042452188.db2.gz ZYFHQLXCLHHGKC-YJBOKZPZSA-N 1 2 300.446 4.046 20 0 DIADLO Cc1cc(C(F)(F)F)cc(N2Cc3cc(F)c(F)cc3C2)[nH+]1 ZINC000664076638 1042472461 /nfs/dbraw/zinc/47/24/61/1042472461.db2.gz PZNSTPNIUZQHOY-UHFFFAOYSA-N 1 2 314.257 4.207 20 0 DIADLO C=C/C(C)=C/CC(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000614353130 1042475814 /nfs/dbraw/zinc/47/58/14/1042475814.db2.gz IDFBHDYKCXSOJD-RVDMUPIBSA-N 1 2 321.424 4.347 20 0 DIADLO c1csc([C@@H]([NH2+]Cc2cnc[nH]2)c2ccc3c(c2)CCCC3)c1 ZINC000894157091 1042476198 /nfs/dbraw/zinc/47/61/98/1042476198.db2.gz VIFQZJXUOLSXHA-IBGZPJMESA-N 1 2 323.465 4.229 20 0 DIADLO c1csc([C@H]([NH2+]Cc2cnc[nH]2)c2ccc3c(c2)CCCC3)c1 ZINC000894157093 1042476232 /nfs/dbraw/zinc/47/62/32/1042476232.db2.gz VIFQZJXUOLSXHA-LJQANCHMSA-N 1 2 323.465 4.229 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2cccc(Br)c2)on1 ZINC000052213905 1042477317 /nfs/dbraw/zinc/47/73/17/1042477317.db2.gz GHDUMDYGJSTPBQ-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2cccc(Br)c2)on1 ZINC000052213905 1042477320 /nfs/dbraw/zinc/47/73/20/1042477320.db2.gz GHDUMDYGJSTPBQ-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO c1cn(Cc2ccc(CNc3nc4ccccc4s3)cc2)c[nH+]1 ZINC000052384176 1042479080 /nfs/dbraw/zinc/47/90/80/1042479080.db2.gz PHTWRBVCKSXDRJ-UHFFFAOYSA-N 1 2 320.421 4.153 20 0 DIADLO CC1(C)CC[C@H]1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000614354383 1042480785 /nfs/dbraw/zinc/48/07/85/1042480785.db2.gz VUZBZKLIMVLLBT-INIZCTEOSA-N 1 2 323.440 4.261 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+](C)Cc1nc(-c2ccco2)no1 ZINC000052162043 1042483244 /nfs/dbraw/zinc/48/32/44/1042483244.db2.gz DUTVLYDKKFHVGL-NSHDSACASA-N 1 2 317.776 4.176 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1nc(-c2ccco2)no1 ZINC000052162043 1042483250 /nfs/dbraw/zinc/48/32/50/1042483250.db2.gz DUTVLYDKKFHVGL-NSHDSACASA-N 1 2 317.776 4.176 20 0 DIADLO Cc1ccc(C)c(Oc2ccc(CNc3cccc[nH+]3)cn2)c1 ZINC000052246230 1042485017 /nfs/dbraw/zinc/48/50/17/1042485017.db2.gz DYOZXVVCDYWVBH-UHFFFAOYSA-N 1 2 305.381 4.498 20 0 DIADLO CCOc1ccc(NCc2ccc(-n3cc[nH+]c3)cc2)c(C)c1 ZINC000237063476 1042487372 /nfs/dbraw/zinc/48/73/72/1042487372.db2.gz CZSGSKUQJWNVQR-UHFFFAOYSA-N 1 2 307.397 4.192 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2nc(-c3ccccc3)no2)c1 ZINC000052454911 1042489933 /nfs/dbraw/zinc/48/99/33/1042489933.db2.gz VPRYVJVSHWVBKV-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2nc(-c3ccccc3)no2)c1 ZINC000052454911 1042489935 /nfs/dbraw/zinc/48/99/35/1042489935.db2.gz VPRYVJVSHWVBKV-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1sccc1Br ZINC000336692222 1042490407 /nfs/dbraw/zinc/49/04/07/1042490407.db2.gz XCZAXRNMRZIXMU-UHFFFAOYSA-N 1 2 300.221 4.044 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1sccc1Br ZINC000336692222 1042490409 /nfs/dbraw/zinc/49/04/09/1042490409.db2.gz XCZAXRNMRZIXMU-UHFFFAOYSA-N 1 2 300.221 4.044 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@H](C)c1ccc(OCCC(C)C)cc1 ZINC000924889711 1042492385 /nfs/dbraw/zinc/49/23/85/1042492385.db2.gz MHDFZWFLFSCIPZ-ZIAGYGMSSA-N 1 2 317.433 4.215 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+][C@@H](C)c1cn(C(C)C)nn1 ZINC000924894879 1042508099 /nfs/dbraw/zinc/50/80/99/1042508099.db2.gz BIAWECYQIZQYOW-HOCLYGCPSA-N 1 2 316.449 4.060 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1nccc2ccccc21)c1ccco1 ZINC000894211245 1042525897 /nfs/dbraw/zinc/52/58/97/1042525897.db2.gz MQXOGRILGRYBHY-IBGZPJMESA-N 1 2 324.424 4.331 20 0 DIADLO CCOCCCCNc1[nH+]ccc2cc(Br)ccc21 ZINC000413071574 1042530689 /nfs/dbraw/zinc/53/06/89/1042530689.db2.gz NKNGYWGJIYWRQS-UHFFFAOYSA-N 1 2 323.234 4.226 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1cccc(O)c1Cl ZINC000513344089 1042535832 /nfs/dbraw/zinc/53/58/32/1042535832.db2.gz VCQYSWFPRDSRSK-UHFFFAOYSA-N 1 2 307.846 4.400 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1cccc(O)c1Cl ZINC000513344089 1042535835 /nfs/dbraw/zinc/53/58/35/1042535835.db2.gz VCQYSWFPRDSRSK-UHFFFAOYSA-N 1 2 307.846 4.400 20 0 DIADLO C(=C\c1ccccc1)\C[N@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000513442324 1042542253 /nfs/dbraw/zinc/54/22/53/1042542253.db2.gz GOHZMQKUYYKYRF-GHXNOFRVSA-N 1 2 303.409 4.125 20 0 DIADLO C(=C\c1ccccc1)\C[N@@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000513442324 1042542256 /nfs/dbraw/zinc/54/22/56/1042542256.db2.gz GOHZMQKUYYKYRF-GHXNOFRVSA-N 1 2 303.409 4.125 20 0 DIADLO CC[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@H]1C[C@@H]1C ZINC000414091332 1042553120 /nfs/dbraw/zinc/55/31/20/1042553120.db2.gz DGFBMZKBHJQTOI-ZVZYQTTQSA-N 1 2 307.441 4.448 20 0 DIADLO CCn1cc([C@@H](C)[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)cn1 ZINC000280292034 1042570145 /nfs/dbraw/zinc/57/01/45/1042570145.db2.gz ZHZJQTDFHREGRW-OXQOHEQNSA-N 1 2 320.440 4.047 20 0 DIADLO COc1ccccc1-c1ccc([C@H](C)[N@H+](C)Cc2cnc[nH]2)cc1 ZINC000280491926 1042574436 /nfs/dbraw/zinc/57/44/36/1042574436.db2.gz OXSUJWORDBHYNV-HNNXBMFYSA-N 1 2 321.424 4.278 20 0 DIADLO COc1ccccc1-c1ccc([C@H](C)[N@@H+](C)Cc2cnc[nH]2)cc1 ZINC000280491926 1042574443 /nfs/dbraw/zinc/57/44/43/1042574443.db2.gz OXSUJWORDBHYNV-HNNXBMFYSA-N 1 2 321.424 4.278 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2nnc(C(C)C)s2)c1C ZINC000419455577 1042582027 /nfs/dbraw/zinc/58/20/27/1042582027.db2.gz PLSJKGSMACPEJM-UHFFFAOYSA-N 1 2 323.487 4.115 20 0 DIADLO CC[C@@H]1C[NH+](Cc2nc(-c3ccccc3)oc2C)C[C@@H](CC)O1 ZINC000420951044 1042616228 /nfs/dbraw/zinc/61/62/28/1042616228.db2.gz QJAOUDKAUKFMKV-IAGOWNOFSA-N 1 2 314.429 4.039 20 0 DIADLO CCCc1nc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)cs1 ZINC000420952206 1042617056 /nfs/dbraw/zinc/61/70/56/1042617056.db2.gz RUKJRYUNAVENNK-LLVKDONJSA-N 1 2 306.397 4.260 20 0 DIADLO CCCc1nc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)cs1 ZINC000420952206 1042617059 /nfs/dbraw/zinc/61/70/59/1042617059.db2.gz RUKJRYUNAVENNK-LLVKDONJSA-N 1 2 306.397 4.260 20 0 DIADLO CC(C)[N@H+](Cc1nnc(C(C)(C)C)[nH]1)[C@@H](C)c1ccsc1 ZINC000421011911 1042620133 /nfs/dbraw/zinc/62/01/33/1042620133.db2.gz PQWXKIQLPAHGND-LBPRGKRZSA-N 1 2 306.479 4.135 20 0 DIADLO CC(C)[N@@H+](Cc1nnc(C(C)(C)C)[nH]1)[C@@H](C)c1ccsc1 ZINC000421011911 1042620137 /nfs/dbraw/zinc/62/01/37/1042620137.db2.gz PQWXKIQLPAHGND-LBPRGKRZSA-N 1 2 306.479 4.135 20 0 DIADLO Cc1cc(CNC(=O)Nc2c(Cl)ccc(C)c2C)cc(C)[nH+]1 ZINC000421115273 1042625481 /nfs/dbraw/zinc/62/54/81/1042625481.db2.gz WSGIADGBBSUXEP-UHFFFAOYSA-N 1 2 317.820 4.290 20 0 DIADLO CC(C)(C)c1nc(C[NH2+]Cc2cnccc2C(C)(C)C)cs1 ZINC000414500584 1042627087 /nfs/dbraw/zinc/62/70/87/1042627087.db2.gz QORXUEHIZXGIFP-UHFFFAOYSA-N 1 2 317.502 4.423 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)s1 ZINC000421360720 1042632597 /nfs/dbraw/zinc/63/25/97/1042632597.db2.gz JKWDXTINVJLKEA-SNVBAGLBSA-N 1 2 324.437 4.171 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)s1 ZINC000421360720 1042632599 /nfs/dbraw/zinc/63/25/99/1042632599.db2.gz JKWDXTINVJLKEA-SNVBAGLBSA-N 1 2 324.437 4.171 20 0 DIADLO O=C(Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)[C@]12C[C@H]1CCC2 ZINC000421437404 1042638476 /nfs/dbraw/zinc/63/84/76/1042638476.db2.gz SDVPIKCDJGQZNA-FOIQADDNSA-N 1 2 321.424 4.015 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2nc(-c3ccccc3)no2)o1 ZINC000513758586 1042652158 /nfs/dbraw/zinc/65/21/58/1042652158.db2.gz ABKOHXBIXZHCPL-KRWDZBQOSA-N 1 2 323.396 4.365 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H]2c2nc(-c3ccccc3)no2)o1 ZINC000513758586 1042652162 /nfs/dbraw/zinc/65/21/62/1042652162.db2.gz ABKOHXBIXZHCPL-KRWDZBQOSA-N 1 2 323.396 4.365 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@H](C)c1ccc(SC(C)C)cc1 ZINC000924938658 1042652796 /nfs/dbraw/zinc/65/27/96/1042652796.db2.gz NRRMMLRYYAACBJ-NEPJUHHUSA-N 1 2 305.447 4.290 20 0 DIADLO CCN(CC)c1ccc(N[C@@H](C)c2ccncc2Cl)c[nH+]1 ZINC000421834671 1042655491 /nfs/dbraw/zinc/65/54/91/1042655491.db2.gz KYSZTQRYWZARJG-LBPRGKRZSA-N 1 2 304.825 4.149 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccncc1Cl)c1nc2c(s1)CCC2 ZINC000421851722 1042657147 /nfs/dbraw/zinc/65/71/47/1042657147.db2.gz GDFYDGAEQPOLDX-UWVGGRQHSA-N 1 2 307.850 4.092 20 0 DIADLO C[C@H]([NH2+][C@@H]1c2ccc(F)cc2O[C@H]1C)c1ccncc1Cl ZINC000421861755 1042658483 /nfs/dbraw/zinc/65/84/83/1042658483.db2.gz WHBUZIWMJCWVMW-PUTJDCORSA-N 1 2 306.768 4.047 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(OC(F)F)cc1 ZINC000271750389 1042667267 /nfs/dbraw/zinc/66/72/67/1042667267.db2.gz KMZKDWGCUIYVQQ-NSHDSACASA-N 1 2 324.371 4.424 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1nncn1C)c1cc2c(ccc3ccccc23)o1 ZINC000271863409 1042670903 /nfs/dbraw/zinc/67/09/03/1042670903.db2.gz KUXBKWKEAOPMAN-CHWSQXEVSA-N 1 2 320.396 4.126 20 0 DIADLO CCC[C@H]([NH2+][C@@H]1COCc2cccc(Cl)c21)c1ccccn1 ZINC000924946111 1042677808 /nfs/dbraw/zinc/67/78/08/1042677808.db2.gz LKPVLZYIBUTFIN-DLBZAZTESA-N 1 2 316.832 4.437 20 0 DIADLO Cc1cccc(NC(=O)C[C@@H](C)[NH2+]c2ccc3c(c2)CCN3)c1C ZINC000423217272 1042701007 /nfs/dbraw/zinc/70/10/07/1042701007.db2.gz PURZPUYCKORGEI-CQSZACIVSA-N 1 2 323.440 4.101 20 0 DIADLO c1ccc([C@@H](C[C@@H]2CCOC2)Nc2ccc3c(c2)CC[NH2+]3)cc1 ZINC000423215536 1042701232 /nfs/dbraw/zinc/70/12/32/1042701232.db2.gz MYABNKPRYXVJRY-MGPUTAFESA-N 1 2 308.425 4.234 20 0 DIADLO COC[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1cccc(Cl)c1 ZINC000423219515 1042701519 /nfs/dbraw/zinc/70/15/19/1042701519.db2.gz UAOVXOXQFKOSOT-QGZVFWFLSA-N 1 2 302.805 4.108 20 0 DIADLO COc1cc(NCc2c[nH+]cn2C(C)C)cc(OC)c1C(C)C ZINC000424165494 1042728473 /nfs/dbraw/zinc/72/84/73/1042728473.db2.gz FTNPIECIEDMTMY-UHFFFAOYSA-N 1 2 317.433 4.217 20 0 DIADLO CC(C)Cn1ncc(NCc2c[nH+]cn2C(C)C)c1C(C)C ZINC000424171465 1042728670 /nfs/dbraw/zinc/72/86/70/1042728670.db2.gz LBCVLYPATYPSIQ-UHFFFAOYSA-N 1 2 303.454 4.052 20 0 DIADLO CC(C)(C)CCCC(=O)N1CC[NH2+][C@@H](c2cccc(Cl)c2)C1 ZINC000513997100 1042765478 /nfs/dbraw/zinc/76/54/78/1042765478.db2.gz OMHSSZXSGPJWJO-MRXNPFEDSA-N 1 2 322.880 4.029 20 0 DIADLO CS[C@@H]1CC[C@@H]1Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000425344947 1042794780 /nfs/dbraw/zinc/79/47/80/1042794780.db2.gz UVHFFIGLDQRMNX-DLBZAZTESA-N 1 2 313.470 4.192 20 0 DIADLO FC(F)CC1C[NH+](Cc2ccc(Cl)c(Br)c2)C1 ZINC000425368384 1042798788 /nfs/dbraw/zinc/79/87/88/1042798788.db2.gz WMZHDTZIMZUZAR-UHFFFAOYSA-N 1 2 324.596 4.190 20 0 DIADLO CC[N@H+](Cc1nc(C(F)F)no1)Cc1ccc2ccccc2c1 ZINC000425405616 1042812920 /nfs/dbraw/zinc/81/29/20/1042812920.db2.gz LKJAYFFWIGTDTA-UHFFFAOYSA-N 1 2 317.339 4.183 20 0 DIADLO CC[N@@H+](Cc1nc(C(F)F)no1)Cc1ccc2ccccc2c1 ZINC000425405616 1042812923 /nfs/dbraw/zinc/81/29/23/1042812923.db2.gz LKJAYFFWIGTDTA-UHFFFAOYSA-N 1 2 317.339 4.183 20 0 DIADLO FC(F)c1noc(C[N@H+](C2CC2)[C@H]2CCCc3ccccc32)n1 ZINC000425426448 1042821367 /nfs/dbraw/zinc/82/13/67/1042821367.db2.gz QTMIDSWLFSYASU-AWEZNQCLSA-N 1 2 319.355 4.049 20 0 DIADLO FC(F)c1noc(C[N@@H+](C2CC2)[C@H]2CCCc3ccccc32)n1 ZINC000425426448 1042821373 /nfs/dbraw/zinc/82/13/73/1042821373.db2.gz QTMIDSWLFSYASU-AWEZNQCLSA-N 1 2 319.355 4.049 20 0 DIADLO CC(C)(C)c1ccc(C(C)(C)[NH2+]Cc2nc(C(F)F)no2)cc1 ZINC000425453918 1042824681 /nfs/dbraw/zinc/82/46/81/1042824681.db2.gz GAMYVYFHSFJCLK-UHFFFAOYSA-N 1 2 323.387 4.330 20 0 DIADLO CCCCc1nc(C[N@H+](C)CCOc2ccc(C)cc2)cs1 ZINC000515542371 1042826361 /nfs/dbraw/zinc/82/63/61/1042826361.db2.gz WTXZQPGTBHEHOV-UHFFFAOYSA-N 1 2 318.486 4.305 20 0 DIADLO CCCCc1nc(C[N@@H+](C)CCOc2ccc(C)cc2)cs1 ZINC000515542371 1042826364 /nfs/dbraw/zinc/82/63/64/1042826364.db2.gz WTXZQPGTBHEHOV-UHFFFAOYSA-N 1 2 318.486 4.305 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(F)F)no1)c1cccc2ccccc21 ZINC000425461289 1042827559 /nfs/dbraw/zinc/82/75/59/1042827559.db2.gz RVCBQZUHMISOAC-JTQLQIEISA-N 1 2 303.312 4.011 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2nc(C(F)F)no2)C(C)(C)C)c1 ZINC000425465009 1042828301 /nfs/dbraw/zinc/82/83/01/1042828301.db2.gz YQGZXOLPPMXEIK-ZDUSSCGKSA-N 1 2 309.360 4.193 20 0 DIADLO CC(C)[N@H+](Cc1nc(C(F)F)no1)[C@H](C)c1ccsc1 ZINC000425487489 1042831821 /nfs/dbraw/zinc/83/18/21/1042831821.db2.gz YSAUVYBODDENHY-SECBINFHSA-N 1 2 301.362 4.040 20 0 DIADLO CC(C)[N@@H+](Cc1nc(C(F)F)no1)[C@H](C)c1ccsc1 ZINC000425487489 1042831824 /nfs/dbraw/zinc/83/18/24/1042831824.db2.gz YSAUVYBODDENHY-SECBINFHSA-N 1 2 301.362 4.040 20 0 DIADLO Cc1ccccc1[C@@H](C)[N@H+](C)Cc1nc(Cc2ccccc2)no1 ZINC000515772857 1042833831 /nfs/dbraw/zinc/83/38/31/1042833831.db2.gz GHNDNHFVVSBNET-MRXNPFEDSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1nc(Cc2ccccc2)no1 ZINC000515772857 1042833836 /nfs/dbraw/zinc/83/38/36/1042833836.db2.gz GHNDNHFVVSBNET-MRXNPFEDSA-N 1 2 321.424 4.162 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+](Cc2ccccc2)CC2CCC2)no1 ZINC000516744626 1042853307 /nfs/dbraw/zinc/85/33/07/1042853307.db2.gz NIUKDLUJEMQLSZ-UHFFFAOYSA-N 1 2 313.445 4.169 20 0 DIADLO CC(C)(C)c1nc(C[N@H+](Cc2ccccc2)CC2CCC2)no1 ZINC000516744626 1042853314 /nfs/dbraw/zinc/85/33/14/1042853314.db2.gz NIUKDLUJEMQLSZ-UHFFFAOYSA-N 1 2 313.445 4.169 20 0 DIADLO CN(CC1=CCSC1)c1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000664641075 1042864149 /nfs/dbraw/zinc/86/41/49/1042864149.db2.gz VCSOCBOKRKSRTC-UHFFFAOYSA-N 1 2 324.371 4.363 20 0 DIADLO Cc1ccc2[nH+]cc(CN(C)Cc3cc(Cl)ccc3F)n2c1 ZINC000517843059 1042900048 /nfs/dbraw/zinc/90/00/48/1042900048.db2.gz RXXBUOWSUHRROY-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccnn2C2CCC2)cs1 ZINC000925034526 1042902459 /nfs/dbraw/zinc/90/24/59/1042902459.db2.gz SZZRPYLODQBNHX-VXGBXAGGSA-N 1 2 304.463 4.039 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCC(F)(F)[C@H](C)C3)cs2)o1 ZINC000517956105 1042903630 /nfs/dbraw/zinc/90/36/30/1042903630.db2.gz XOELYOWKHKSFGJ-SNVBAGLBSA-N 1 2 312.385 4.189 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCC(F)(F)[C@H](C)C3)cs2)o1 ZINC000517956105 1042903633 /nfs/dbraw/zinc/90/36/33/1042903633.db2.gz XOELYOWKHKSFGJ-SNVBAGLBSA-N 1 2 312.385 4.189 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCC(F)(F)[C@@H](C)C3)cs2)o1 ZINC000517956104 1042903875 /nfs/dbraw/zinc/90/38/75/1042903875.db2.gz XOELYOWKHKSFGJ-JTQLQIEISA-N 1 2 312.385 4.189 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCC(F)(F)[C@@H](C)C3)cs2)o1 ZINC000517956104 1042903877 /nfs/dbraw/zinc/90/38/77/1042903877.db2.gz XOELYOWKHKSFGJ-JTQLQIEISA-N 1 2 312.385 4.189 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@@H](c1oc2ccccc2c1C)C(C)C ZINC000925038342 1042907806 /nfs/dbraw/zinc/90/78/06/1042907806.db2.gz TUDFRCYBQHGSFS-MLGOLLRUSA-N 1 2 313.401 4.481 20 0 DIADLO CSCc1cnc(C[N@H+](C)[C@H]2CCc3ccccc32)s1 ZINC000294912045 1042911315 /nfs/dbraw/zinc/91/13/15/1042911315.db2.gz NKKNKMHAGMZIEE-HNNXBMFYSA-N 1 2 304.484 4.125 20 0 DIADLO CSCc1cnc(C[N@@H+](C)[C@H]2CCc3ccccc32)s1 ZINC000294912045 1042911317 /nfs/dbraw/zinc/91/13/17/1042911317.db2.gz NKKNKMHAGMZIEE-HNNXBMFYSA-N 1 2 304.484 4.125 20 0 DIADLO CC(C)([NH2+][C@H](c1nnc[nH]1)C1CCCCC1)c1cccs1 ZINC000638608483 1042917009 /nfs/dbraw/zinc/91/70/09/1042917009.db2.gz IIJZQSMYSNWNTL-AWEZNQCLSA-N 1 2 304.463 4.013 20 0 DIADLO Cc1ccc2c(Cl)cc(Cl)c(OCc3c[nH+]cn3C)c2n1 ZINC000439547874 1042920770 /nfs/dbraw/zinc/92/07/70/1042920770.db2.gz ICYNVSLKWLBGLB-UHFFFAOYSA-N 1 2 322.195 4.163 20 0 DIADLO COc1nscc1C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000712889743 1042922673 /nfs/dbraw/zinc/92/26/73/1042922673.db2.gz MVPCMLIZKKGTTL-MRVPVSSYSA-N 1 2 317.241 4.309 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)CCOc1ccccc1F ZINC000519054600 1042931777 /nfs/dbraw/zinc/93/17/77/1042931777.db2.gz LPDMRLQRDYAUFB-LBPRGKRZSA-N 1 2 309.331 4.176 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)CCOc1ccccc1F ZINC000519054600 1042931780 /nfs/dbraw/zinc/93/17/80/1042931780.db2.gz LPDMRLQRDYAUFB-LBPRGKRZSA-N 1 2 309.331 4.176 20 0 DIADLO COc1ccnc([C@H](C)[NH2+][C@@H](C)c2nc3ccccc3s2)c1 ZINC000925068592 1042945680 /nfs/dbraw/zinc/94/56/80/1042945680.db2.gz DWOWGWDUZRWBSO-RYUDHWBXSA-N 1 2 313.426 4.112 20 0 DIADLO Cc1ccc(-c2ccc(C[N@@H+]3CCOC[C@@H]3CC(F)F)o2)cc1 ZINC000519477566 1042950228 /nfs/dbraw/zinc/95/02/28/1042950228.db2.gz WSZZLISDFKMPBM-HNNXBMFYSA-N 1 2 321.367 4.111 20 0 DIADLO Cc1ccc(-c2ccc(C[N@H+]3CCOC[C@@H]3CC(F)F)o2)cc1 ZINC000519477566 1042950231 /nfs/dbraw/zinc/95/02/31/1042950231.db2.gz WSZZLISDFKMPBM-HNNXBMFYSA-N 1 2 321.367 4.111 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1ccc(F)c(C(=O)N(C)C)c1 ZINC001211851119 1042961175 /nfs/dbraw/zinc/96/11/75/1042961175.db2.gz CKVNJJIOXYHIOB-UHFFFAOYSA-N 1 2 315.392 4.098 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H](C)c1nc2ccccc2n1C ZINC000319980146 1042979843 /nfs/dbraw/zinc/97/98/43/1042979843.db2.gz FNEZXKLBHDEMSQ-CQSZACIVSA-N 1 2 308.429 4.121 20 0 DIADLO Cc1ccc(C(=O)Nc2ccccc2-n2cc[nH+]c2)c(Cl)c1 ZINC000427509996 1042989576 /nfs/dbraw/zinc/98/95/76/1042989576.db2.gz SUOOPVOHDVLNSJ-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1coc(-c3cccs3)n1)C2 ZINC000729477614 1042993966 /nfs/dbraw/zinc/99/39/66/1042993966.db2.gz LEWXYBUQIDMWQY-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1coc(-c3cccs3)n1)C2 ZINC000729477614 1042993971 /nfs/dbraw/zinc/99/39/71/1042993971.db2.gz LEWXYBUQIDMWQY-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1nc([C@](C)([NH2+]Cc2c(C)ccc3ccccc32)C2CC2)no1 ZINC000519681755 1042999246 /nfs/dbraw/zinc/99/92/46/1042999246.db2.gz RBEOJBHXPMKTLA-HXUWFJFHSA-N 1 2 321.424 4.255 20 0 DIADLO Cc1nc([C@@](C)([NH2+]Cc2c(C)ccc3ccccc32)C2CC2)no1 ZINC000519681754 1042999655 /nfs/dbraw/zinc/99/96/55/1042999655.db2.gz RBEOJBHXPMKTLA-FQEVSTJZSA-N 1 2 321.424 4.255 20 0 DIADLO C[C@H](c1ccccc1Br)[N@@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000519957988 1043010954 /nfs/dbraw/zinc/01/09/54/1043010954.db2.gz OQXVDGLFKKRHBK-VXGBXAGGSA-N 1 2 312.251 4.009 20 0 DIADLO C[C@H](c1ccccc1Br)[N@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000519957988 1043010958 /nfs/dbraw/zinc/01/09/58/1043010958.db2.gz OQXVDGLFKKRHBK-VXGBXAGGSA-N 1 2 312.251 4.009 20 0 DIADLO CC[C@@H]([NH2+]Cc1nccn1CC(C)C)c1ccc(F)cc1F ZINC000164810084 1043017651 /nfs/dbraw/zinc/01/76/51/1043017651.db2.gz UYXDUUOQXQISJY-MRXNPFEDSA-N 1 2 307.388 4.058 20 0 DIADLO O=C(Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1=CCCCC1 ZINC000188257200 1043018411 /nfs/dbraw/zinc/01/84/11/1043018411.db2.gz FCAZTWMHCLQGAM-UHFFFAOYSA-N 1 2 321.424 4.325 20 0 DIADLO CCCN(C(=O)C[C@@H](C)n1cc[nH+]c1)c1cccc2ccccc21 ZINC000520235346 1043026365 /nfs/dbraw/zinc/02/63/65/1043026365.db2.gz YEIJMXDZLKQMRW-MRXNPFEDSA-N 1 2 321.424 4.431 20 0 DIADLO Cc1ccsc1C[N@H+](C)Cc1ccn(-c2ccc(F)cc2)n1 ZINC000441261424 1043030717 /nfs/dbraw/zinc/03/07/17/1043030717.db2.gz HCOYBYCTFCJCBZ-UHFFFAOYSA-N 1 2 315.417 4.013 20 0 DIADLO Cc1ccsc1C[N@@H+](C)Cc1ccn(-c2ccc(F)cc2)n1 ZINC000441261424 1043030719 /nfs/dbraw/zinc/03/07/19/1043030719.db2.gz HCOYBYCTFCJCBZ-UHFFFAOYSA-N 1 2 315.417 4.013 20 0 DIADLO Cc1cnc(C[N@H+](Cc2cccc(C(F)(F)F)c2)C(C)C)o1 ZINC000441278880 1043033359 /nfs/dbraw/zinc/03/33/59/1043033359.db2.gz SDSPVUHYCZASKM-UHFFFAOYSA-N 1 2 312.335 4.412 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2cccc(C(F)(F)F)c2)C(C)C)o1 ZINC000441278880 1043033361 /nfs/dbraw/zinc/03/33/61/1043033361.db2.gz SDSPVUHYCZASKM-UHFFFAOYSA-N 1 2 312.335 4.412 20 0 DIADLO Cc1cnc(C[N@@H+]2CCc3ccccc3[C@H]2c2ccccc2)o1 ZINC000441307392 1043034613 /nfs/dbraw/zinc/03/46/13/1043034613.db2.gz VSPHJNMUVZAIHQ-HXUWFJFHSA-N 1 2 304.393 4.131 20 0 DIADLO Cc1cnc(C[N@H+]2CCc3ccccc3[C@H]2c2ccccc2)o1 ZINC000441307392 1043034616 /nfs/dbraw/zinc/03/46/16/1043034616.db2.gz VSPHJNMUVZAIHQ-HXUWFJFHSA-N 1 2 304.393 4.131 20 0 DIADLO COC(=O)c1cc(C[N@H+](C)[C@H](C)c2ccccc2Cl)c(C)o1 ZINC000520353161 1043037329 /nfs/dbraw/zinc/03/73/29/1043037329.db2.gz PUCRFTWTBLNWBU-LLVKDONJSA-N 1 2 321.804 4.221 20 0 DIADLO COC(=O)c1cc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)c(C)o1 ZINC000520353161 1043037334 /nfs/dbraw/zinc/03/73/34/1043037334.db2.gz PUCRFTWTBLNWBU-LLVKDONJSA-N 1 2 321.804 4.221 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2cnc(C(C)(C)C)s2)o1 ZINC000174478241 1043066231 /nfs/dbraw/zinc/06/62/31/1043066231.db2.gz VTEGXLGEKOZZGU-AWEZNQCLSA-N 1 2 322.474 4.073 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CC[C@H](C)c3ccccc3)cc2[nH+]1 ZINC000441433457 1043090775 /nfs/dbraw/zinc/09/07/75/1043090775.db2.gz GMYNTEXVPRLZRS-ZDUSSCGKSA-N 1 2 307.397 4.394 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2ccc(F)c(F)c2)[C@@H](C)CO1 ZINC000441437883 1043103713 /nfs/dbraw/zinc/10/37/13/1043103713.db2.gz IHQMYSLOLALBCJ-LIRRHRJNSA-N 1 2 317.379 4.235 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2ccc(F)c(F)c2)[C@@H](C)CO1 ZINC000441437883 1043103718 /nfs/dbraw/zinc/10/37/18/1043103718.db2.gz IHQMYSLOLALBCJ-LIRRHRJNSA-N 1 2 317.379 4.235 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](C)Cc2cnc(Cl)s2)c1 ZINC000120594517 1043104608 /nfs/dbraw/zinc/10/46/08/1043104608.db2.gz BTCUHRXQIQDNJC-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2cnc(Cl)s2)c1 ZINC000120594517 1043104614 /nfs/dbraw/zinc/10/46/14/1043104614.db2.gz BTCUHRXQIQDNJC-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@H]2CCOc3c(F)cccc32)n1 ZINC000865539867 1043111454 /nfs/dbraw/zinc/11/14/54/1043111454.db2.gz ZNILFIWDKGUCMV-ZDUSSCGKSA-N 1 2 320.433 4.193 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000865572265 1043114953 /nfs/dbraw/zinc/11/49/53/1043114953.db2.gz MEJBIHGTXPEURD-MEDUHNTESA-N 1 2 302.443 4.052 20 0 DIADLO Clc1ccccc1C1([NH2+]Cc2cn(C3CC3)cn2)CCC1 ZINC000865614276 1043118223 /nfs/dbraw/zinc/11/82/23/1043118223.db2.gz CBTFVVNRPAJSSB-UHFFFAOYSA-N 1 2 301.821 4.040 20 0 DIADLO COc1c(C)cccc1C[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000865618843 1043119379 /nfs/dbraw/zinc/11/93/79/1043119379.db2.gz IHPSGFFWFJATNT-UHFFFAOYSA-N 1 2 304.459 4.047 20 0 DIADLO Cc1cnc(C[NH2+]Cc2cc(Cl)cc(Cl)c2F)s1 ZINC000865817423 1043136232 /nfs/dbraw/zinc/13/62/32/1043136232.db2.gz IJFOBJVIWPHSEX-UHFFFAOYSA-N 1 2 305.205 4.187 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000178804268 1043136757 /nfs/dbraw/zinc/13/67/57/1043136757.db2.gz WABMCHABKZVVJI-ZSEKCTLFSA-N 1 2 321.873 4.270 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000178804268 1043136767 /nfs/dbraw/zinc/13/67/67/1043136767.db2.gz WABMCHABKZVVJI-ZSEKCTLFSA-N 1 2 321.873 4.270 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000178804279 1043137199 /nfs/dbraw/zinc/13/71/99/1043137199.db2.gz WABMCHABKZVVJI-ASSNKEHSSA-N 1 2 321.873 4.270 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000178804279 1043137206 /nfs/dbraw/zinc/13/72/06/1043137206.db2.gz WABMCHABKZVVJI-ASSNKEHSSA-N 1 2 321.873 4.270 20 0 DIADLO CC(C)([NH2+]Cc1nc(-c2ccco2)no1)c1cccc(Cl)c1 ZINC000179602456 1043147447 /nfs/dbraw/zinc/14/74/47/1043147447.db2.gz ZPCWXJYJBLVJCE-UHFFFAOYSA-N 1 2 317.776 4.008 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc(Br)o2)o1 ZINC000189498096 1043155901 /nfs/dbraw/zinc/15/59/01/1043155901.db2.gz LDKLWZGWJMNZAX-SKDRFNHKSA-N 1 2 310.191 4.048 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](c2oc3ccccc3c2C)C(C)C)o1 ZINC000183255892 1043159659 /nfs/dbraw/zinc/15/96/59/1043159659.db2.gz SCULGMUIKNEJCB-QGZVFWFLSA-N 1 2 313.401 4.174 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2cccc(SC(F)(F)F)c2)no1 ZINC000866241422 1043163248 /nfs/dbraw/zinc/16/32/48/1043163248.db2.gz CDYAEVOVDAGKHT-JTQLQIEISA-N 1 2 316.348 4.446 20 0 DIADLO Cc1cc(NC(=O)CC2CCC(C(F)(F)F)CC2)cc[nH+]1 ZINC000183499179 1043164462 /nfs/dbraw/zinc/16/44/62/1043164462.db2.gz LFGKSBLZUPXASZ-UHFFFAOYSA-N 1 2 300.324 4.087 20 0 DIADLO Cc1nn(C(C)(C)C)cc1[C@H](C)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000130521986 1043177523 /nfs/dbraw/zinc/17/75/23/1043177523.db2.gz DFZSKKRQCCAQPK-ZDUSSCGKSA-N 1 2 315.465 4.341 20 0 DIADLO C[C@@H]([NH2+]Cc1cocn1)c1cccc(SC(F)(F)F)c1 ZINC000866322497 1043179757 /nfs/dbraw/zinc/17/97/57/1043179757.db2.gz WCAKKODOIQNHSI-SECBINFHSA-N 1 2 302.321 4.137 20 0 DIADLO Cc1cc2cc(C[NH2+][C@H]3c4ccccc4OC[C@H]3F)ccc2[nH]1 ZINC000866356508 1043187872 /nfs/dbraw/zinc/18/78/72/1043187872.db2.gz MICYCKZGCYJLLE-APWZRJJASA-N 1 2 310.372 4.038 20 0 DIADLO CC(=O)Nc1cccc(C[NH2+][C@H](C)c2csc(C(C)C)n2)c1 ZINC000184726511 1043189457 /nfs/dbraw/zinc/18/94/57/1043189457.db2.gz LMFDLXZQJMQWGR-GFCCVEGCSA-N 1 2 317.458 4.076 20 0 DIADLO Clc1ccc([C@H]2C[N@H+](CC3CCC3)CCO2)cc1Cl ZINC000441499455 1043194157 /nfs/dbraw/zinc/19/41/57/1043194157.db2.gz MRUBFUNXXWIZNM-OAHLLOKOSA-N 1 2 300.229 4.167 20 0 DIADLO Clc1ccc([C@H]2C[N@@H+](CC3CCC3)CCO2)cc1Cl ZINC000441499455 1043194161 /nfs/dbraw/zinc/19/41/61/1043194161.db2.gz MRUBFUNXXWIZNM-OAHLLOKOSA-N 1 2 300.229 4.167 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1cc2c(ccnc2Cl)o1 ZINC000866388500 1043194379 /nfs/dbraw/zinc/19/43/79/1043194379.db2.gz KCENOMOSWQLGDP-DTWKUNHWSA-N 1 2 307.806 4.350 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)CCc2cncc3ccccc32)c1 ZINC000866383893 1043195124 /nfs/dbraw/zinc/19/51/24/1043195124.db2.gz DPLOTFDJSAYBQL-HNNXBMFYSA-N 1 2 321.424 4.209 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@H](CCc2ccccc2)c2ccccc2)n1 ZINC000614573273 1043196409 /nfs/dbraw/zinc/19/64/09/1043196409.db2.gz BJORMYDKTCSGHP-HNAYVOBHSA-N 1 2 321.424 4.403 20 0 DIADLO Cc1noc([C@@H](C)[NH2+][C@H](CCc2ccccc2)c2ccccc2)n1 ZINC000614573270 1043196538 /nfs/dbraw/zinc/19/65/38/1043196538.db2.gz BJORMYDKTCSGHP-DNVCBOLYSA-N 1 2 321.424 4.403 20 0 DIADLO C[C@@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1cc2ccccc2o1 ZINC000190622260 1043198238 /nfs/dbraw/zinc/19/82/38/1043198238.db2.gz MQZMQZZARHSXJT-OAHLLOKOSA-N 1 2 317.392 4.469 20 0 DIADLO CC[C@@H]1[C@H](C)CC[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000185599751 1043204321 /nfs/dbraw/zinc/20/43/21/1043204321.db2.gz YVZCKXRJOYTZJY-ZWNOBZJWSA-N 1 2 315.244 4.052 20 0 DIADLO CC[C@@H]1[C@H](C)CC[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000185599751 1043204333 /nfs/dbraw/zinc/20/43/33/1043204333.db2.gz YVZCKXRJOYTZJY-ZWNOBZJWSA-N 1 2 315.244 4.052 20 0 DIADLO COc1ccsc1[C@H](C)[NH2+]Cc1coc(-c2cccs2)n1 ZINC000186126751 1043215735 /nfs/dbraw/zinc/21/57/35/1043215735.db2.gz FDOFDSXXEWAACD-JTQLQIEISA-N 1 2 320.439 4.324 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1csc(C(C)C)n1)c1ccccc1 ZINC000186405731 1043223198 /nfs/dbraw/zinc/22/31/98/1043223198.db2.gz WOVYGHRTQNYPPW-HIFRSBDPSA-N 1 2 304.459 4.305 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1csc(C(C)C)n1)c1ccccc1 ZINC000186405769 1043223771 /nfs/dbraw/zinc/22/37/71/1043223771.db2.gz WOVYGHRTQNYPPW-UKRRQHHQSA-N 1 2 304.459 4.305 20 0 DIADLO Cc1ccc2cc([C@@H](C)[NH2+]Cc3nn(C)cc3C(F)F)oc2c1 ZINC000866565612 1043224354 /nfs/dbraw/zinc/22/43/54/1043224354.db2.gz OCMATQZMNXREGZ-LLVKDONJSA-N 1 2 319.355 4.263 20 0 DIADLO COc1cc(F)cc(C[NH2+][C@H](C)c2csc(C(C)C)n2)c1 ZINC000186440559 1043225574 /nfs/dbraw/zinc/22/55/74/1043225574.db2.gz GZIZTAXZIDZJRJ-LLVKDONJSA-N 1 2 308.422 4.265 20 0 DIADLO C[C@@H]([NH2+][C@H](CCO)c1ccco1)c1cccc(Cl)c1Cl ZINC000186541850 1043227932 /nfs/dbraw/zinc/22/79/32/1043227932.db2.gz HNCOBQAGOPAXTR-ZWNOBZJWSA-N 1 2 314.212 4.361 20 0 DIADLO C[C@H]([NH2+][C@@H](CCO)c1ccco1)c1cc(Cl)ccc1Cl ZINC000186558203 1043228890 /nfs/dbraw/zinc/22/88/90/1043228890.db2.gz GVKMGOKNPWHBSJ-HZMBPMFUSA-N 1 2 314.212 4.361 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nc2ccccc2[nH]1)C1CCCCC1)c1ncc[nH]1 ZINC000866613521 1043236129 /nfs/dbraw/zinc/23/61/29/1043236129.db2.gz BXQLWZGBZJHFTL-DYVFJYSZSA-N 1 2 323.444 4.258 20 0 DIADLO FC(F)(F)c1csc(C[NH2+]Cc2cc(Cl)cs2)n1 ZINC000193120942 1043280729 /nfs/dbraw/zinc/28/07/29/1043280729.db2.gz IFQALHFTLPQRDN-UHFFFAOYSA-N 1 2 312.769 4.167 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@@H](C)c1nc2c(s1)CCCC2 ZINC000187597510 1043247238 /nfs/dbraw/zinc/24/72/38/1043247238.db2.gz WBOIULMRNAYGTC-NSHDSACASA-N 1 2 320.433 4.020 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2ccc(Cl)nc2Cl)n1 ZINC000141607137 1043262563 /nfs/dbraw/zinc/26/25/63/1043262563.db2.gz VAYDVMIAVOIJAP-QMMMGPOBSA-N 1 2 302.230 4.004 20 0 DIADLO CCCCCOc1ccc([C@H](C)[NH2+]Cc2cocn2)cc1OC ZINC000192287368 1043268493 /nfs/dbraw/zinc/26/84/93/1043268493.db2.gz NJLMBXFJDPQMRY-AWEZNQCLSA-N 1 2 318.417 4.103 20 0 DIADLO CCC[N@H+](Cc1ncnn1CC)[C@H](C)c1cc2ccccc2o1 ZINC000193316454 1043281401 /nfs/dbraw/zinc/28/14/01/1043281401.db2.gz PJQDQCJRTSDRSS-CQSZACIVSA-N 1 2 312.417 4.017 20 0 DIADLO CCC[N@@H+](Cc1ncnn1CC)[C@H](C)c1cc2ccccc2o1 ZINC000193316454 1043281412 /nfs/dbraw/zinc/28/14/12/1043281412.db2.gz PJQDQCJRTSDRSS-CQSZACIVSA-N 1 2 312.417 4.017 20 0 DIADLO COC[C@H]([NH2+]Cc1csc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000193279408 1043282414 /nfs/dbraw/zinc/28/24/14/1043282414.db2.gz KWPSRGJMIHWAJF-HNNXBMFYSA-N 1 2 322.861 4.151 20 0 DIADLO CC(C)[C@@H](O)Cc1ccccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC000665212127 1043286853 /nfs/dbraw/zinc/28/68/53/1043286853.db2.gz QHULGHSLDNJMAV-NRFANRHFSA-N 1 2 320.436 4.158 20 0 DIADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1cnc(-c2ccco2)s1 ZINC000194432614 1043293702 /nfs/dbraw/zinc/29/37/02/1043293702.db2.gz FHQDNQZMZCOUOL-UHFFFAOYSA-N 1 2 321.833 4.027 20 0 DIADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1cnc(-c2ccco2)s1 ZINC000194432614 1043293715 /nfs/dbraw/zinc/29/37/15/1043293715.db2.gz FHQDNQZMZCOUOL-UHFFFAOYSA-N 1 2 321.833 4.027 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@H+](Cc2cc(-c3ccccc3)on2)C1 ZINC000268198039 1043315529 /nfs/dbraw/zinc/31/55/29/1043315529.db2.gz FSFKWJQMIHELKA-ZDUSSCGKSA-N 1 2 310.319 4.116 20 0 DIADLO FC(F)(F)[C@H]1CCC[N@@H+](Cc2cc(-c3ccccc3)on2)C1 ZINC000268198039 1043315537 /nfs/dbraw/zinc/31/55/37/1043315537.db2.gz FSFKWJQMIHELKA-ZDUSSCGKSA-N 1 2 310.319 4.116 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C)c3cccc(C(C)C)c3)ccn12 ZINC000520834989 1043333853 /nfs/dbraw/zinc/33/38/53/1043333853.db2.gz UIVZGQVWWWVSFL-UHFFFAOYSA-N 1 2 307.397 4.043 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2cn(C(C)(C)C)nc2C)cs1 ZINC000268962054 1043346532 /nfs/dbraw/zinc/34/65/32/1043346532.db2.gz XOBDTAMOXQHAPW-CMPLNLGQSA-N 1 2 306.479 4.123 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+]Cc1csc([C@H](C)OC)n1 ZINC000269044234 1043352735 /nfs/dbraw/zinc/35/27/35/1043352735.db2.gz HDEZTPPVQQSCRK-OLZOCXBDSA-N 1 2 320.458 4.100 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2ccc(F)c(C)c2)cs1 ZINC000269076387 1043357656 /nfs/dbraw/zinc/35/76/56/1043357656.db2.gz NNZWYAFNOSGQPV-NEPJUHHUSA-N 1 2 308.422 4.149 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccc(C)cc2OCC2CC2)cs1 ZINC000269385906 1043362950 /nfs/dbraw/zinc/36/29/50/1043362950.db2.gz AZKYRZVVOKLWAW-CYBMUJFWSA-N 1 2 316.470 4.400 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccccc2OCC2CC2)cs1 ZINC000269414139 1043365363 /nfs/dbraw/zinc/36/53/63/1043365363.db2.gz JWHBZLWPLAEPSW-LBPRGKRZSA-N 1 2 302.443 4.091 20 0 DIADLO C[N@H+](Cc1nc(C(F)(F)F)cs1)[C@@H]1C[C@@H]1c1ccccc1 ZINC000269755774 1043372633 /nfs/dbraw/zinc/37/26/33/1043372633.db2.gz GSISLYPSLVMWIA-VXGBXAGGSA-N 1 2 312.360 4.150 20 0 DIADLO C[N@@H+](Cc1nc(C(F)(F)F)cs1)[C@@H]1C[C@@H]1c1ccccc1 ZINC000269755774 1043372639 /nfs/dbraw/zinc/37/26/39/1043372639.db2.gz GSISLYPSLVMWIA-VXGBXAGGSA-N 1 2 312.360 4.150 20 0 DIADLO Cc1csc(C2([NH2+][C@@H]3CCc4c3c(F)ccc4F)CCC2)n1 ZINC000269880038 1043375779 /nfs/dbraw/zinc/37/57/79/1043375779.db2.gz YDDRXVRECZUGFV-CQSZACIVSA-N 1 2 320.408 4.386 20 0 DIADLO CC(C)[N@H+](Cc1ncc(-c2cccs2)o1)Cc1ccccn1 ZINC000521343148 1043386100 /nfs/dbraw/zinc/38/61/00/1043386100.db2.gz URRPHWNTCLSPSX-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)[N@@H+](Cc1ncc(-c2cccs2)o1)Cc1ccccn1 ZINC000521343148 1043386113 /nfs/dbraw/zinc/38/61/13/1043386113.db2.gz URRPHWNTCLSPSX-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270593973 1043390849 /nfs/dbraw/zinc/39/08/49/1043390849.db2.gz KRCBATBJKHKOOW-LRDDRELGSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270593973 1043390856 /nfs/dbraw/zinc/39/08/56/1043390856.db2.gz KRCBATBJKHKOOW-LRDDRELGSA-N 1 2 300.377 4.274 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000925270125 1043405486 /nfs/dbraw/zinc/40/54/86/1043405486.db2.gz RRFBQEZDVCFLCF-JKSUJKDBSA-N 1 2 324.424 4.397 20 0 DIADLO CC(C)c1csc(C[NH2+][C@@H](C)c2ccnn2CC2CCC2)n1 ZINC000925283603 1043408014 /nfs/dbraw/zinc/40/80/14/1043408014.db2.gz RVULHDAAZLLJMD-ZDUSSCGKSA-N 1 2 318.490 4.114 20 0 DIADLO CCC(CC)n1ccc(C[N@H+](C)[C@H](CC)c2ccncc2)n1 ZINC000271401232 1043415124 /nfs/dbraw/zinc/41/51/24/1043415124.db2.gz NTMYQAUDWGANOX-GOSISDBHSA-N 1 2 300.450 4.222 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+](C)[C@H](CC)c2ccncc2)n1 ZINC000271401232 1043415132 /nfs/dbraw/zinc/41/51/32/1043415132.db2.gz NTMYQAUDWGANOX-GOSISDBHSA-N 1 2 300.450 4.222 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1cc(Cl)ccc1Cl ZINC000271446017 1043418553 /nfs/dbraw/zinc/41/85/53/1043418553.db2.gz CYGGKSIFRDVDEU-YMTOWFKASA-N 1 2 310.228 4.445 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1cc(Cl)ccc1Cl ZINC000271446017 1043418563 /nfs/dbraw/zinc/41/85/63/1043418563.db2.gz CYGGKSIFRDVDEU-YMTOWFKASA-N 1 2 310.228 4.445 20 0 DIADLO CCc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1csc(C)n1 ZINC000271458617 1043421977 /nfs/dbraw/zinc/42/19/77/1043421977.db2.gz JQKNRJYUFMQFPW-XHDPSFHLSA-N 1 2 302.443 4.188 20 0 DIADLO CC(C)c1nnc([C@@H](C)[NH2+][C@H]2C[C@H](C)Sc3sccc32)[nH]1 ZINC000271481574 1043424614 /nfs/dbraw/zinc/42/46/14/1043424614.db2.gz JSIZSZVWUDLCAE-UMNHJUIQSA-N 1 2 322.503 4.266 20 0 DIADLO CCSCc1cc[nH+]c(N[C@@H]2Cc3[nH]c4ccccc4c3C2)c1 ZINC000442825240 1043428633 /nfs/dbraw/zinc/42/86/33/1043428633.db2.gz LCLRVBKXSQPBBL-AWEZNQCLSA-N 1 2 323.465 4.395 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nnc(C(C)C)[nH]1)c1cc(C)ccc1OC ZINC000271557312 1043436923 /nfs/dbraw/zinc/43/69/23/1043436923.db2.gz SWLDZBYDMQUIAX-DZGCQCFKSA-N 1 2 316.449 4.047 20 0 DIADLO COC(=O)c1oc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)cc1C ZINC000271650408 1043444037 /nfs/dbraw/zinc/44/40/37/1043444037.db2.gz FCMSMGUWAUVQEO-QWRGUYRKSA-N 1 2 323.339 4.065 20 0 DIADLO CO[C@@H](C)c1noc(C[NH2+][C@@H](CC(C)(C)C)c2ccccc2)n1 ZINC000271639173 1043445147 /nfs/dbraw/zinc/44/51/47/1043445147.db2.gz CGRWCWMKOZXGMM-ZFWWWQNUSA-N 1 2 317.433 4.044 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[NH+]1CC(C)(C)OC(C)(C)C1 ZINC000442879272 1043447267 /nfs/dbraw/zinc/44/72/67/1043447267.db2.gz AJWKTHDVHGDOTJ-UHFFFAOYSA-N 1 2 320.458 4.101 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1cccc(O)c1F ZINC000872067060 1043447839 /nfs/dbraw/zinc/44/78/39/1043447839.db2.gz USNMNCHZAFJQKS-JTQLQIEISA-N 1 2 309.768 4.044 20 0 DIADLO Cn1cc(Cl)c(C[NH2+][C@@H]2CC(C)(C)Sc3ccccc32)n1 ZINC000872076394 1043452201 /nfs/dbraw/zinc/45/22/01/1043452201.db2.gz KUOLGAKCKFHCOB-CYBMUJFWSA-N 1 2 321.877 4.179 20 0 DIADLO C[C@H]([NH2+][C@@H]1CC(C)(C)Sc2ccccc21)c1csnn1 ZINC000872080861 1043452440 /nfs/dbraw/zinc/45/24/40/1043452440.db2.gz TZAHBNMDGUXBKV-CMPLNLGQSA-N 1 2 305.472 4.204 20 0 DIADLO C[C@H](Nc1ccc([NH+]2CCCC2)cc1)c1ccnn1CC1CCC1 ZINC000925729221 1043457387 /nfs/dbraw/zinc/45/73/87/1043457387.db2.gz ZERCWFHFXVPPPE-INIZCTEOSA-N 1 2 324.472 4.457 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000348547225 1043459704 /nfs/dbraw/zinc/45/97/04/1043459704.db2.gz FBXBLXMVFUUZLB-KRWDZBQOSA-N 1 2 303.837 4.373 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000348547225 1043459708 /nfs/dbraw/zinc/45/97/08/1043459708.db2.gz FBXBLXMVFUUZLB-KRWDZBQOSA-N 1 2 303.837 4.373 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+][C@H](C)c1nnc(C)s1 ZINC000283187704 1043463976 /nfs/dbraw/zinc/46/39/76/1043463976.db2.gz QKZNMAJWWCMOOO-RISCZKNCSA-N 1 2 305.447 4.047 20 0 DIADLO Cc1cc(C)c2c(c1)[C@@H]([NH2+]Cc1ncc(Cl)s1)CCCO2 ZINC000872117229 1043464510 /nfs/dbraw/zinc/46/45/10/1043464510.db2.gz ZSQYUDDOWSRSPG-ZDUSSCGKSA-N 1 2 322.861 4.417 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@@H]3c3cccnc3)sc2c1 ZINC000348908311 1043480454 /nfs/dbraw/zinc/48/04/54/1043480454.db2.gz ZCONMIPWZFIIIM-OAHLLOKOSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@@H]3c3cccnc3)sc2c1 ZINC000348908311 1043480459 /nfs/dbraw/zinc/48/04/59/1043480459.db2.gz ZCONMIPWZFIIIM-OAHLLOKOSA-N 1 2 313.401 4.168 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccccc2)cs1)Cc1ccncc1 ZINC000348922530 1043481114 /nfs/dbraw/zinc/48/11/14/1043481114.db2.gz QSFSMEYYNWNVNF-UHFFFAOYSA-N 1 2 309.438 4.227 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccccc2)cs1)Cc1ccncc1 ZINC000348922530 1043481120 /nfs/dbraw/zinc/48/11/20/1043481120.db2.gz QSFSMEYYNWNVNF-UHFFFAOYSA-N 1 2 309.438 4.227 20 0 DIADLO C[C@@H]([NH2+]Cc1cocn1)c1ccccc1SC(F)(F)F ZINC000925869338 1043483899 /nfs/dbraw/zinc/48/38/99/1043483899.db2.gz JTFFSGISZQPICR-SECBINFHSA-N 1 2 302.321 4.137 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]Cc1nnc(-c2ccccc2)[nH]1 ZINC000777578002 1043484944 /nfs/dbraw/zinc/48/49/44/1043484944.db2.gz GIVZZWHNKWMAQR-RHSMWYFYSA-N 1 2 318.424 4.118 20 0 DIADLO CCC[C@H](C)c1noc([C@@H]([NH3+])c2ccc(C(F)(F)F)cc2)n1 ZINC000872174907 1043485691 /nfs/dbraw/zinc/48/56/91/1043485691.db2.gz FYXAJTIBTHRXJN-CABZTGNLSA-N 1 2 313.323 4.040 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2noc(C(C)(C)C)n2)CC(C)C)c1 ZINC000521821694 1043486708 /nfs/dbraw/zinc/48/67/08/1043486708.db2.gz QSJSVFNVISWBJD-UHFFFAOYSA-N 1 2 315.461 4.334 20 0 DIADLO Cc1cccc(C[N@H+](Cc2noc(C(C)(C)C)n2)CC(C)C)c1 ZINC000521821694 1043486715 /nfs/dbraw/zinc/48/67/15/1043486715.db2.gz QSJSVFNVISWBJD-UHFFFAOYSA-N 1 2 315.461 4.334 20 0 DIADLO C[C@H]([NH2+]C1(c2cccc(C(F)(F)F)c2)CCC1)c1ncco1 ZINC000925893899 1043489448 /nfs/dbraw/zinc/48/94/48/1043489448.db2.gz RZDALGPYZCOLPB-NSHDSACASA-N 1 2 310.319 4.423 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1ccc2c(c1)CCC=C2 ZINC000349317268 1043501490 /nfs/dbraw/zinc/50/14/90/1043501490.db2.gz CZYFONCIZDXEPA-UHFFFAOYSA-N 1 2 315.376 4.084 20 0 DIADLO CC(C)[N@H+](Cc1ncc(C(C)(C)C)s1)Cc1cccnc1 ZINC000349291655 1043502463 /nfs/dbraw/zinc/50/24/63/1043502463.db2.gz ZXAFPGNRSUHKBZ-UHFFFAOYSA-N 1 2 303.475 4.246 20 0 DIADLO CC(C)[N@@H+](Cc1ncc(C(C)(C)C)s1)Cc1cccnc1 ZINC000349291655 1043502471 /nfs/dbraw/zinc/50/24/71/1043502471.db2.gz ZXAFPGNRSUHKBZ-UHFFFAOYSA-N 1 2 303.475 4.246 20 0 DIADLO C[C@H](Nc1ccc([NH+]2CCCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000320139413 1043510288 /nfs/dbraw/zinc/51/02/88/1043510288.db2.gz HZAXRQYKYYJZOU-AWEZNQCLSA-N 1 2 311.385 4.368 20 0 DIADLO CCOc1cccc(F)c1C[NH2+][C@@H](CC)c1nc(C)cs1 ZINC000873046229 1043512761 /nfs/dbraw/zinc/51/27/61/1043512761.db2.gz NDXOYGCJESRGNB-AWEZNQCLSA-N 1 2 308.422 4.230 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](C)Cc2cnn(-c3ccccc3)c2)o1 ZINC000349642267 1043517051 /nfs/dbraw/zinc/51/70/51/1043517051.db2.gz PTUKZFCHCROEKE-HNAYVOBHSA-N 1 2 321.424 4.221 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)o1 ZINC000349642267 1043517056 /nfs/dbraw/zinc/51/70/56/1043517056.db2.gz PTUKZFCHCROEKE-HNAYVOBHSA-N 1 2 321.424 4.221 20 0 DIADLO CC(C)c1ncc(C[NH2+]Cc2noc3c2CC(C)(C)CC3)s1 ZINC000873175713 1043524177 /nfs/dbraw/zinc/52/41/77/1043524177.db2.gz ZKHACEDTJISKEO-UHFFFAOYSA-N 1 2 319.474 4.059 20 0 DIADLO Cl/C=C(/Cl)C[NH+]1CCC(OCCc2ccccc2)CC1 ZINC000124436243 1043524376 /nfs/dbraw/zinc/52/43/76/1043524376.db2.gz FXMNMGZSGMUHIM-NTCAYCPXSA-N 1 2 314.256 4.029 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(C(F)(F)F)nc1 ZINC000873184376 1043524617 /nfs/dbraw/zinc/52/46/17/1043524617.db2.gz ABMHWAHXODWVGE-SSDOTTSWSA-N 1 2 321.755 4.061 20 0 DIADLO Cc1nccnc1[C@@H](C)[NH2+]Cc1ccc(F)c(Cl)c1Cl ZINC000873186727 1043526592 /nfs/dbraw/zinc/52/65/92/1043526592.db2.gz DQBIXCXAXBQKLA-SECBINFHSA-N 1 2 314.191 4.082 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2ccc3c(c2)CCC(C)(C)O3)cs1 ZINC000349987879 1043534082 /nfs/dbraw/zinc/53/40/82/1043534082.db2.gz BBTAEMFUEPMOKP-UHFFFAOYSA-N 1 2 316.470 4.187 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2ccc3c(c2)CCC(C)(C)O3)cs1 ZINC000349987879 1043534096 /nfs/dbraw/zinc/53/40/96/1043534096.db2.gz BBTAEMFUEPMOKP-UHFFFAOYSA-N 1 2 316.470 4.187 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2cc3cc(C)c(C)cc3o2)cs1 ZINC000349987854 1043534900 /nfs/dbraw/zinc/53/49/00/1043534900.db2.gz AWFAOFHTKUAVQR-UHFFFAOYSA-N 1 2 300.427 4.447 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2cc3cc(C)c(C)cc3o2)cs1 ZINC000349987854 1043534907 /nfs/dbraw/zinc/53/49/07/1043534907.db2.gz AWFAOFHTKUAVQR-UHFFFAOYSA-N 1 2 300.427 4.447 20 0 DIADLO C/C(=C/c1ccccc1OC(F)F)C[N@@H+](C)Cc1nccs1 ZINC000558566627 1043543311 /nfs/dbraw/zinc/54/33/11/1043543311.db2.gz KNSULCLMYCNECA-XFXZXTDPSA-N 1 2 324.396 4.280 20 0 DIADLO C/C(=C/c1ccccc1OC(F)F)C[N@H+](C)Cc1nccs1 ZINC000558566627 1043543319 /nfs/dbraw/zinc/54/33/19/1043543319.db2.gz KNSULCLMYCNECA-XFXZXTDPSA-N 1 2 324.396 4.280 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@H+](C)Cc1ccccn1 ZINC000350388763 1043544672 /nfs/dbraw/zinc/54/46/72/1043544672.db2.gz HFFIGGVQKYCNNY-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@@H+](C)Cc1ccccn1 ZINC000350388763 1043544685 /nfs/dbraw/zinc/54/46/85/1043544685.db2.gz HFFIGGVQKYCNNY-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000430748418 1043552616 /nfs/dbraw/zinc/55/26/16/1043552616.db2.gz DMSWAHZEVHBPQA-SECBINFHSA-N 1 2 313.294 4.102 20 0 DIADLO CC[C@H](c1nc(Cc2ccccc2)no1)[N@H+](C)Cc1ccccc1 ZINC000558596477 1043553241 /nfs/dbraw/zinc/55/32/41/1043553241.db2.gz PWJIRSIZKIZLRB-GOSISDBHSA-N 1 2 321.424 4.244 20 0 DIADLO CC[C@H](c1nc(Cc2ccccc2)no1)[N@@H+](C)Cc1ccccc1 ZINC000558596477 1043553253 /nfs/dbraw/zinc/55/32/53/1043553253.db2.gz PWJIRSIZKIZLRB-GOSISDBHSA-N 1 2 321.424 4.244 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H]1CCc2c1nccc2Cl ZINC000926267151 1043555169 /nfs/dbraw/zinc/55/51/69/1043555169.db2.gz XNVSLCGFIGKNKV-CQSZACIVSA-N 1 2 323.223 4.174 20 0 DIADLO CC(F)(F)CCC[N@@H+]1Cc2ccc(Br)cc2C1 ZINC000718589431 1043590870 /nfs/dbraw/zinc/59/08/70/1043590870.db2.gz XJSYPVPXWFVFPQ-UHFFFAOYSA-N 1 2 304.178 4.200 20 0 DIADLO CC(F)(F)CCC[N@H+]1Cc2ccc(Br)cc2C1 ZINC000718589431 1043590883 /nfs/dbraw/zinc/59/08/83/1043590883.db2.gz XJSYPVPXWFVFPQ-UHFFFAOYSA-N 1 2 304.178 4.200 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)cn1 ZINC001137079676 1043580736 /nfs/dbraw/zinc/58/07/36/1043580736.db2.gz ZTGSPBUKTKUFKI-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1cc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)cn1 ZINC001137079676 1043580744 /nfs/dbraw/zinc/58/07/44/1043580744.db2.gz ZTGSPBUKTKUFKI-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CCC[C@@H]([NH2+]Cc1oc(CC)nc1C)c1ncccc1Cl ZINC000926478437 1043581638 /nfs/dbraw/zinc/58/16/38/1043581638.db2.gz BWTIKAVFOQNGFU-CYBMUJFWSA-N 1 2 307.825 4.225 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1ccc(C2CC2)cc1F ZINC000926469287 1043583318 /nfs/dbraw/zinc/58/33/18/1043583318.db2.gz KCTPVCAUCIGVLA-MRXNPFEDSA-N 1 2 300.377 4.167 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1ccc(C(F)F)cc1 ZINC000558746755 1043588907 /nfs/dbraw/zinc/58/89/07/1043588907.db2.gz BIFAHEXBTNOASO-UHFFFAOYSA-N 1 2 301.340 4.606 20 0 DIADLO Cc1nn(-c2ccccc2)c(C)c1CNc1ccc([NH+](C)C)cc1 ZINC000125068592 1043589278 /nfs/dbraw/zinc/58/92/78/1043589278.db2.gz VXJPGKQMACCAJM-UHFFFAOYSA-N 1 2 320.440 4.167 20 0 DIADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1csc(C(F)(F)F)c1 ZINC000926530621 1043593771 /nfs/dbraw/zinc/59/37/71/1043593771.db2.gz BPNMLKZZNGNBOD-ATZCPNFKSA-N 1 2 315.364 4.320 20 0 DIADLO Cc1ccccc1C[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1ccco1 ZINC000926532341 1043595251 /nfs/dbraw/zinc/59/52/51/1043595251.db2.gz LJHBVOLXRSRZGH-NJAFHUGGSA-N 1 2 321.424 4.364 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](Cc1ccccc1C)c1ccco1 ZINC000926533517 1043595383 /nfs/dbraw/zinc/59/53/83/1043595383.db2.gz QKZZFLCKIGJMSN-WMZOPIPTSA-N 1 2 323.440 4.439 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@H](c3[nH]cc[nH+]3)C2)ccc1C1CC1 ZINC000558794304 1043603126 /nfs/dbraw/zinc/60/31/26/1043603126.db2.gz OANCSTPNRIDEPA-HNNXBMFYSA-N 1 2 324.428 4.007 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@@H]1CCCC[C@H]1F)c1ccccn1 ZINC000926587547 1043604173 /nfs/dbraw/zinc/60/41/73/1043604173.db2.gz NCNIPHPISQTKIM-GPMSIDNRSA-N 1 2 314.404 4.050 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2csc(C(F)(F)F)c2)c1 ZINC000926660582 1043614741 /nfs/dbraw/zinc/61/47/41/1043614741.db2.gz LCMGMCUOPWRBCL-SECBINFHSA-N 1 2 316.348 4.481 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1cc2ccccc2nc1Cl ZINC000125352758 1043619319 /nfs/dbraw/zinc/61/93/19/1043619319.db2.gz UUYSKBMNEGZJQB-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1cc2ccccc2nc1Cl ZINC000125352758 1043619323 /nfs/dbraw/zinc/61/93/23/1043619323.db2.gz UUYSKBMNEGZJQB-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO Cc1ccc(C(C)(C)[NH2+]Cc2ncc(-c3ccccc3)o2)cn1 ZINC000353567068 1043619375 /nfs/dbraw/zinc/61/93/75/1043619375.db2.gz FVHLZOQACXFZFX-UHFFFAOYSA-N 1 2 307.397 4.070 20 0 DIADLO F[C@@H]1CCC2(C1)CC[NH+](Cc1nc(C(F)(F)F)cs1)CC2 ZINC001141764132 1043631010 /nfs/dbraw/zinc/63/10/10/1043631010.db2.gz UPMQYLYACYDLJY-SNVBAGLBSA-N 1 2 322.371 4.266 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@@H]1CCCC[C@@H]1F)c1ccccn1 ZINC000926785768 1043634197 /nfs/dbraw/zinc/63/41/97/1043634197.db2.gz NCNIPHPISQTKIM-FRQCXROJSA-N 1 2 314.404 4.050 20 0 DIADLO C[C@@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1ccnn1CC1CCC1 ZINC000926810741 1043636002 /nfs/dbraw/zinc/63/60/02/1043636002.db2.gz WQSQBDZKHOEORN-DYVFJYSZSA-N 1 2 319.399 4.184 20 0 DIADLO CC1(C)C[N@H+](Cc2c[nH]nc2-c2ccsc2)[C@H]1c1ccncc1 ZINC000353713567 1043636214 /nfs/dbraw/zinc/63/62/14/1043636214.db2.gz KAJYWWQMGWLNCN-KRWDZBQOSA-N 1 2 324.453 4.116 20 0 DIADLO CC1(C)C[N@@H+](Cc2c[nH]nc2-c2ccsc2)[C@H]1c1ccncc1 ZINC000353713567 1043636222 /nfs/dbraw/zinc/63/62/22/1043636222.db2.gz KAJYWWQMGWLNCN-KRWDZBQOSA-N 1 2 324.453 4.116 20 0 DIADLO c1csc(C[N@@H+]2Cc3ccccc3C[C@H]2c2ccccc2)n1 ZINC000353748364 1043641139 /nfs/dbraw/zinc/64/11/39/1043641139.db2.gz RJKUJULRQRVVCX-SFHVURJKSA-N 1 2 306.434 4.443 20 0 DIADLO c1csc(C[N@H+]2Cc3ccccc3C[C@H]2c2ccccc2)n1 ZINC000353748364 1043641141 /nfs/dbraw/zinc/64/11/41/1043641141.db2.gz RJKUJULRQRVVCX-SFHVURJKSA-N 1 2 306.434 4.443 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(F)ccc(Br)c2F)C2(CC2)C1 ZINC001141778147 1043651626 /nfs/dbraw/zinc/65/16/26/1043651626.db2.gz IHEYMKMNNYOGPO-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c(F)ccc(Br)c2F)C2(CC2)C1 ZINC001141778147 1043651631 /nfs/dbraw/zinc/65/16/31/1043651631.db2.gz IHEYMKMNNYOGPO-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cnccn1)c1cc(Cl)cc(Cl)c1F ZINC000926903416 1043652924 /nfs/dbraw/zinc/65/29/24/1043652924.db2.gz VHCHXVBGRZBMIY-BDAKNGLRSA-N 1 2 314.191 4.334 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1ccccc1-n1cccn1)C2 ZINC001137101016 1043657654 /nfs/dbraw/zinc/65/76/54/1043657654.db2.gz XKICQZYDCMVKQS-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1ccccc1-n1cccn1)C2 ZINC001137101016 1043657663 /nfs/dbraw/zinc/65/76/63/1043657663.db2.gz XKICQZYDCMVKQS-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO C[N@H+](Cc1cnc(C2CCC2)s1)Cc1ccc(Cl)nc1 ZINC000125763500 1043658298 /nfs/dbraw/zinc/65/82/98/1043658298.db2.gz HSXDHYUQQGZRPX-UHFFFAOYSA-N 1 2 307.850 4.091 20 0 DIADLO C[N@@H+](Cc1cnc(C2CCC2)s1)Cc1ccc(Cl)nc1 ZINC000125763500 1043658305 /nfs/dbraw/zinc/65/83/05/1043658305.db2.gz HSXDHYUQQGZRPX-UHFFFAOYSA-N 1 2 307.850 4.091 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2nccn2CC)o1 ZINC000353934293 1043662554 /nfs/dbraw/zinc/66/25/54/1043662554.db2.gz PLAYVJHJYKKBQW-ZBFHGGJFSA-N 1 2 301.434 4.032 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2nccn2CC)o1 ZINC000353934293 1043662564 /nfs/dbraw/zinc/66/25/64/1043662564.db2.gz PLAYVJHJYKKBQW-ZBFHGGJFSA-N 1 2 301.434 4.032 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2nccn2CC)o1 ZINC000353934289 1043662837 /nfs/dbraw/zinc/66/28/37/1043662837.db2.gz PLAYVJHJYKKBQW-GOEBONIOSA-N 1 2 301.434 4.032 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2nccn2CC)o1 ZINC000353934289 1043662842 /nfs/dbraw/zinc/66/28/42/1043662842.db2.gz PLAYVJHJYKKBQW-GOEBONIOSA-N 1 2 301.434 4.032 20 0 DIADLO COCc1nc(C[N@@H+]2CC[C@@H](C)[C@H]2c2cccc(F)c2)cs1 ZINC000353969920 1043666242 /nfs/dbraw/zinc/66/62/42/1043666242.db2.gz AFRGSGBBPUAHRN-PXAZEXFGSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@H+]2CC[C@@H](C)[C@H]2c2cccc(F)c2)cs1 ZINC000353969920 1043666246 /nfs/dbraw/zinc/66/62/46/1043666246.db2.gz AFRGSGBBPUAHRN-PXAZEXFGSA-N 1 2 320.433 4.012 20 0 DIADLO Cc1cc(N2CC[C@@H](C)[C@@H]2c2cccc(F)c2)nc(C2CC2)[nH+]1 ZINC000474152958 1043667388 /nfs/dbraw/zinc/66/73/88/1043667388.db2.gz JOAVPKVLSCDVSA-KZULUSFZSA-N 1 2 311.404 4.389 20 0 DIADLO FC1(F)C[C@]2(CCN(c3[nH+]ccc4ccccc43)C2)C1(F)F ZINC000895385069 1043668791 /nfs/dbraw/zinc/66/87/91/1043668791.db2.gz DZYBECGUPMUAOZ-AWEZNQCLSA-N 1 2 310.294 4.106 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(F)cn1 ZINC000354027783 1043675035 /nfs/dbraw/zinc/67/50/35/1043675035.db2.gz CJHOKNWTFSOPOE-INIZCTEOSA-N 1 2 305.422 4.042 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)s1 ZINC000354123244 1043683393 /nfs/dbraw/zinc/68/33/93/1043683393.db2.gz UOKBNPANVLEUHC-UHFFFAOYSA-N 1 2 317.801 4.148 20 0 DIADLO Cc1ncoc1C[N@@H+](C)Cc1ccccc1OCc1ccccc1 ZINC000895441180 1043685014 /nfs/dbraw/zinc/68/50/14/1043685014.db2.gz YOFZIFXXAMDJRN-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1ncoc1C[N@H+](C)Cc1ccccc1OCc1ccccc1 ZINC000895441180 1043685024 /nfs/dbraw/zinc/68/50/24/1043685024.db2.gz YOFZIFXXAMDJRN-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1cc(Cl)ccc1Cl ZINC000927110818 1043688559 /nfs/dbraw/zinc/68/85/59/1043688559.db2.gz CPXGNAMVNOJDBO-JTQLQIEISA-N 1 2 324.255 4.455 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1ccc(-c2ccccc2)o1 ZINC000927111412 1043688659 /nfs/dbraw/zinc/68/86/59/1043688659.db2.gz BUFZZBAZYSIYRC-CQSZACIVSA-N 1 2 321.424 4.408 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1cccc(Cl)c1F ZINC000927107472 1043689718 /nfs/dbraw/zinc/68/97/18/1043689718.db2.gz GASWRJJIIHCZFQ-OAHLLOKOSA-N 1 2 321.827 4.331 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2nnc(-c3ccccc3)o2)c1 ZINC000052455604 1043689994 /nfs/dbraw/zinc/68/99/94/1043689994.db2.gz XONWETNYZNXPBF-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2nnc(-c3ccccc3)o2)c1 ZINC000052455604 1043689999 /nfs/dbraw/zinc/68/99/99/1043689999.db2.gz XONWETNYZNXPBF-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO CCc1onc(C)c1C[NH2+][C@H](c1cccc(C)c1)c1ccccn1 ZINC000927131291 1043695245 /nfs/dbraw/zinc/69/52/45/1043695245.db2.gz ITENSWUBNDCTAV-HXUWFJFHSA-N 1 2 321.424 4.128 20 0 DIADLO CCC[C@@H]([NH2+]Cc1c(C)noc1CC)c1ncccc1Cl ZINC000927133374 1043695361 /nfs/dbraw/zinc/69/53/61/1043695361.db2.gz CLWZDWFPPYNQDE-CQSZACIVSA-N 1 2 307.825 4.225 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1cc(Cl)cc2c1OCC2 ZINC000927139096 1043697861 /nfs/dbraw/zinc/69/78/61/1043697861.db2.gz GATYUDDCGZWQJM-ZJUUUORDSA-N 1 2 308.834 4.143 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1csc(-c3ccco3)n1)C2 ZINC000729543045 1043699727 /nfs/dbraw/zinc/69/97/27/1043699727.db2.gz DFSSFKXZGWVYHC-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1csc(-c3ccco3)n1)C2 ZINC000729543045 1043699736 /nfs/dbraw/zinc/69/97/36/1043699736.db2.gz DFSSFKXZGWVYHC-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1[nH+]ccn1CCCCNc1ccnc2cc(Cl)ccc21 ZINC000033968127 1043701411 /nfs/dbraw/zinc/70/14/11/1043701411.db2.gz USOXRKJPKGGQRO-UHFFFAOYSA-N 1 2 314.820 4.285 20 0 DIADLO CC(C)CO[C@H](C)c1noc(C[N@H+](C)[C@H]2C=CCCCCC2)n1 ZINC000559105525 1043701727 /nfs/dbraw/zinc/70/17/27/1043701727.db2.gz CEXRFWIDLVZGDT-CVEARBPZSA-N 1 2 321.465 4.124 20 0 DIADLO CC(C)CO[C@H](C)c1noc(C[N@@H+](C)[C@H]2C=CCCCCC2)n1 ZINC000559105525 1043701736 /nfs/dbraw/zinc/70/17/36/1043701736.db2.gz CEXRFWIDLVZGDT-CVEARBPZSA-N 1 2 321.465 4.124 20 0 DIADLO COc1cccc(C[NH2+][C@H](C)c2c(F)cccc2Cl)c1F ZINC000192692455 1043705533 /nfs/dbraw/zinc/70/55/33/1043705533.db2.gz PMZRQEUCBLLGIQ-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO COc1cccc(C[NH2+][C@@H](C)c2c(F)cccc2Cl)c1F ZINC000192692447 1043706317 /nfs/dbraw/zinc/70/63/17/1043706317.db2.gz PMZRQEUCBLLGIQ-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO FC(F)(F)C1=CC[N@H+](Cc2cc3c(ccnc3Cl)o2)CC1 ZINC000876764339 1043708962 /nfs/dbraw/zinc/70/89/62/1043708962.db2.gz OWUJPGGQXAYOSH-UHFFFAOYSA-N 1 2 316.710 4.176 20 0 DIADLO FC(F)(F)C1=CC[N@@H+](Cc2cc3c(ccnc3Cl)o2)CC1 ZINC000876764339 1043708977 /nfs/dbraw/zinc/70/89/77/1043708977.db2.gz OWUJPGGQXAYOSH-UHFFFAOYSA-N 1 2 316.710 4.176 20 0 DIADLO COc1c(C)c[nH+]c(CNc2cccc(COC(C)C)c2)c1C ZINC000876823189 1043713631 /nfs/dbraw/zinc/71/36/31/1043713631.db2.gz BCJYZMKQMAHAAG-UHFFFAOYSA-N 1 2 314.429 4.244 20 0 DIADLO CCO[P@@](C)(=O)CC[C@@H](C)[NH2+]c1ccc(N(C)C)c(C)c1 ZINC000876845308 1043718017 /nfs/dbraw/zinc/71/80/17/1043718017.db2.gz QONSVOJSEMATBO-SPLOXXLWSA-N 1 2 312.394 4.196 20 0 DIADLO CCO[P@@](C)(=O)CC[C@@H](C)Nc1ccc([NH+](C)C)c(C)c1 ZINC000876845308 1043718029 /nfs/dbraw/zinc/71/80/29/1043718029.db2.gz QONSVOJSEMATBO-SPLOXXLWSA-N 1 2 312.394 4.196 20 0 DIADLO C[C@H]([NH2+]Cc1nc(Cl)cs1)c1ccccc1OC(F)F ZINC000876909004 1043724014 /nfs/dbraw/zinc/72/40/14/1043724014.db2.gz SSNUXHIJNOFTQH-QMMMGPOBSA-N 1 2 318.776 4.249 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc([NH+](C)C)c(C)c2)c(F)c1 ZINC000777643258 1043726707 /nfs/dbraw/zinc/72/67/07/1043726707.db2.gz LQXOCJUMKWWCOB-ZDUSSCGKSA-N 1 2 302.393 4.382 20 0 DIADLO Clc1csc(C[NH2+]Cc2ccccc2OC2CCCC2)n1 ZINC000876945953 1043727056 /nfs/dbraw/zinc/72/70/56/1043727056.db2.gz DHTUDEQLESNWQN-UHFFFAOYSA-N 1 2 322.861 4.408 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@@H]3CCCOc4ccccc43)ccc21 ZINC000777653249 1043727971 /nfs/dbraw/zinc/72/79/71/1043727971.db2.gz JMGXGUHKMDUUBU-GOSISDBHSA-N 1 2 308.425 4.395 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@@H]3CCCOc4ccccc43)ccc21 ZINC000777653249 1043727978 /nfs/dbraw/zinc/72/79/78/1043727978.db2.gz JMGXGUHKMDUUBU-GOSISDBHSA-N 1 2 308.425 4.395 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccc2c(c1)COC2 ZINC000777655462 1043728614 /nfs/dbraw/zinc/72/86/14/1043728614.db2.gz KRTLABBCHKDGRR-CQSZACIVSA-N 1 2 308.425 4.272 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccc2c(c1)COC2 ZINC000777655462 1043728627 /nfs/dbraw/zinc/72/86/27/1043728627.db2.gz KRTLABBCHKDGRR-CQSZACIVSA-N 1 2 308.425 4.272 20 0 DIADLO Fc1ccccc1-c1ccc(C[NH2+]Cc2cc(C3CC3)no2)o1 ZINC000876990989 1043730411 /nfs/dbraw/zinc/73/04/11/1043730411.db2.gz HADKTAHUHBLCGI-UHFFFAOYSA-N 1 2 312.344 4.241 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1nc2ccccc2nc1C ZINC000895688004 1043733449 /nfs/dbraw/zinc/73/34/49/1043733449.db2.gz HODKNVAWXYECFY-UHFFFAOYSA-N 1 2 324.453 4.198 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2cc3c(ccnc3Cl)o2)cs1 ZINC000877045633 1043736829 /nfs/dbraw/zinc/73/68/29/1043736829.db2.gz DCXPMHCITRIMGU-VIFPVBQESA-N 1 2 321.833 4.351 20 0 DIADLO COc1c(C)c[nH+]c(CN[C@@H](c2ccco2)c2ccccc2)c1C ZINC000877143890 1043748450 /nfs/dbraw/zinc/74/84/50/1043748450.db2.gz XPXPNTIPXYELST-LJQANCHMSA-N 1 2 322.408 4.179 20 0 DIADLO CC(C)c1cc(N[C@@H](c2ncccn2)C2CC2)nc(C(C)C)[nH+]1 ZINC000895777381 1043751537 /nfs/dbraw/zinc/75/15/37/1043751537.db2.gz KGNVGYDKEBCQEB-MRXNPFEDSA-N 1 2 311.433 4.077 20 0 DIADLO Fc1c(C[N@@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)ccnc1Cl ZINC000895788253 1043752065 /nfs/dbraw/zinc/75/20/65/1043752065.db2.gz MVYWVTXDEHNQLT-GWCFXTLKSA-N 1 2 322.733 4.039 20 0 DIADLO Fc1c(C[N@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)ccnc1Cl ZINC000895788253 1043752073 /nfs/dbraw/zinc/75/20/73/1043752073.db2.gz MVYWVTXDEHNQLT-GWCFXTLKSA-N 1 2 322.733 4.039 20 0 DIADLO C[C@@H](Cc1ccsc1)[NH2+]c1ccc(N2CCOC[C@@H]2C)cc1 ZINC000777691603 1043755714 /nfs/dbraw/zinc/75/57/14/1043755714.db2.gz DBROEANEQOCOBU-GJZGRUSLSA-N 1 2 316.470 4.016 20 0 DIADLO CCc1ncc(C[NH2+][C@@H](c2ccc(C)cc2)c2ccccn2)s1 ZINC000355298690 1043760381 /nfs/dbraw/zinc/76/03/81/1043760381.db2.gz XDAFPWCGHSKPAT-IBGZPJMESA-N 1 2 323.465 4.288 20 0 DIADLO CC(C)c1cccc2c1CC[N@H+](Cc1nc(-c3ccoc3)no1)C2 ZINC000355386287 1043763176 /nfs/dbraw/zinc/76/31/76/1043763176.db2.gz UZWSOGLQLFEPSV-UHFFFAOYSA-N 1 2 323.396 4.011 20 0 DIADLO CC(C)c1cccc2c1CC[N@@H+](Cc1nc(-c3ccoc3)no1)C2 ZINC000355386287 1043763188 /nfs/dbraw/zinc/76/31/88/1043763188.db2.gz UZWSOGLQLFEPSV-UHFFFAOYSA-N 1 2 323.396 4.011 20 0 DIADLO CC(C)c1cccc2c1CC[N@H+](Cc1nc(-c3ccco3)no1)C2 ZINC000355378517 1043764125 /nfs/dbraw/zinc/76/41/25/1043764125.db2.gz FHLCCXLBYIMGFE-UHFFFAOYSA-N 1 2 323.396 4.011 20 0 DIADLO CC(C)c1cccc2c1CC[N@@H+](Cc1nc(-c3ccco3)no1)C2 ZINC000355378517 1043764131 /nfs/dbraw/zinc/76/41/31/1043764131.db2.gz FHLCCXLBYIMGFE-UHFFFAOYSA-N 1 2 323.396 4.011 20 0 DIADLO CC(C)c1cccc2c1CC[N@H+](Cc1nc3cccnc3s1)C2 ZINC000355369580 1043764576 /nfs/dbraw/zinc/76/45/76/1043764576.db2.gz AQLIOEFLHJXGMO-UHFFFAOYSA-N 1 2 323.465 4.373 20 0 DIADLO CC(C)c1cccc2c1CC[N@@H+](Cc1nc3cccnc3s1)C2 ZINC000355369580 1043764583 /nfs/dbraw/zinc/76/45/83/1043764583.db2.gz AQLIOEFLHJXGMO-UHFFFAOYSA-N 1 2 323.465 4.373 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CCC[C@@H]2c2ccc(C)cc2)cs1 ZINC000355666769 1043783792 /nfs/dbraw/zinc/78/37/92/1043783792.db2.gz XOYGJGVJDCAUJW-WMLDXEAASA-N 1 2 316.470 4.496 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CCC[C@@H]2c2ccc(C)cc2)cs1 ZINC000355666769 1043783802 /nfs/dbraw/zinc/78/38/02/1043783802.db2.gz XOYGJGVJDCAUJW-WMLDXEAASA-N 1 2 316.470 4.496 20 0 DIADLO FC(F)(F)c1cc(C[NH2+]Cc2nc(Cl)cs2)cs1 ZINC000877658227 1043786278 /nfs/dbraw/zinc/78/62/78/1043786278.db2.gz OLOLMNDVJMCQBR-UHFFFAOYSA-N 1 2 312.769 4.167 20 0 DIADLO CC(C)n1ccnc1C[NH2+][C@@H](C)c1cc2cccc(F)c2o1 ZINC000355768383 1043787708 /nfs/dbraw/zinc/78/77/08/1043787708.db2.gz GZBZRCAOHOHLPA-LBPRGKRZSA-N 1 2 301.365 4.200 20 0 DIADLO Cc1ncc(C[NH2+][C@@H](c2nc3ccccc3[nH]2)C2CCCCC2)o1 ZINC000877763793 1043795045 /nfs/dbraw/zinc/79/50/45/1043795045.db2.gz JTTRCVGRSSBYFN-GOSISDBHSA-N 1 2 324.428 4.271 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2c(Cl)cncc2Cl)C1 ZINC000877810256 1043798689 /nfs/dbraw/zinc/79/86/89/1043798689.db2.gz AWVLDNOKIRPFKJ-LLVKDONJSA-N 1 2 313.150 4.163 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2c(Cl)cncc2Cl)C1 ZINC000877810256 1043798675 /nfs/dbraw/zinc/79/86/75/1043798675.db2.gz AWVLDNOKIRPFKJ-LLVKDONJSA-N 1 2 313.150 4.163 20 0 DIADLO Cc1nnsc1[C@H](C)[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000929231663 1043802556 /nfs/dbraw/zinc/80/25/56/1043802556.db2.gz JIYIUOUIRMTHQH-VIFPVBQESA-N 1 2 316.257 4.346 20 0 DIADLO Cc1nnsc1[C@H](C)[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000929231663 1043802566 /nfs/dbraw/zinc/80/25/66/1043802566.db2.gz JIYIUOUIRMTHQH-VIFPVBQESA-N 1 2 316.257 4.346 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2nc(C)c(C(C)(C)C)s2)on1 ZINC000929288502 1043809316 /nfs/dbraw/zinc/80/93/16/1043809316.db2.gz QPIFHSJBRCXAIO-ZDUSSCGKSA-N 1 2 319.474 4.383 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2nc(C)c(C(C)(C)C)s2)on1 ZINC000929288502 1043809339 /nfs/dbraw/zinc/80/93/39/1043809339.db2.gz QPIFHSJBRCXAIO-ZDUSSCGKSA-N 1 2 319.474 4.383 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1ccc(Br)o1 ZINC000097489831 1043820843 /nfs/dbraw/zinc/82/08/43/1043820843.db2.gz DTSQYGURNBXNJG-JTQLQIEISA-N 1 2 312.182 4.374 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccc(Br)o1 ZINC000097489831 1043820856 /nfs/dbraw/zinc/82/08/56/1043820856.db2.gz DTSQYGURNBXNJG-JTQLQIEISA-N 1 2 312.182 4.374 20 0 DIADLO C[C@H](C1CC1)[N@@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000777792377 1043825332 /nfs/dbraw/zinc/82/53/32/1043825332.db2.gz XRWLTMQUECJFFC-SNVBAGLBSA-N 1 2 319.246 4.087 20 0 DIADLO C[C@H](C1CC1)[N@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000777792377 1043825348 /nfs/dbraw/zinc/82/53/48/1043825348.db2.gz XRWLTMQUECJFFC-SNVBAGLBSA-N 1 2 319.246 4.087 20 0 DIADLO Cc1cnn([C@@H]2CC[N@H+](Cc3csc(Cl)c3Cl)C2)c1 ZINC000356499071 1043842331 /nfs/dbraw/zinc/84/23/31/1043842331.db2.gz ASSMTQSPGNXETG-LLVKDONJSA-N 1 2 316.257 4.007 20 0 DIADLO Cc1cnn([C@@H]2CC[N@@H+](Cc3csc(Cl)c3Cl)C2)c1 ZINC000356499071 1043842348 /nfs/dbraw/zinc/84/23/48/1043842348.db2.gz ASSMTQSPGNXETG-LLVKDONJSA-N 1 2 316.257 4.007 20 0 DIADLO Cc1nnsc1[C@@H](C)[NH+]1CCC(=Cc2ccccc2F)CC1 ZINC000929828640 1043843980 /nfs/dbraw/zinc/84/39/80/1043843980.db2.gz YXUCOAXHRVNTIY-CYBMUJFWSA-N 1 2 317.433 4.226 20 0 DIADLO C[C@H](c1ccsc1)c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000356597619 1043851444 /nfs/dbraw/zinc/85/14/44/1043851444.db2.gz NIEGMVNFBQKHGL-GFCCVEGCSA-N 1 2 322.393 4.136 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cc(O)cc(C(F)(F)F)c2)s1 ZINC000289594223 1043852126 /nfs/dbraw/zinc/85/21/26/1043852126.db2.gz ULINXWXLLOCSBH-VIFPVBQESA-N 1 2 316.348 4.027 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cc(C(F)(F)F)co1)c1nc(C)cs1 ZINC000878261381 1043863952 /nfs/dbraw/zinc/86/39/52/1043863952.db2.gz INKSOEPORQWKGC-CYBMUJFWSA-N 1 2 318.364 4.478 20 0 DIADLO C[C@H]([NH2+]Cc1nc2c(o1)CCCC2)c1cccc(OC(F)F)c1 ZINC000878351121 1043875693 /nfs/dbraw/zinc/87/56/93/1043875693.db2.gz ORGNMZWHBCRMOM-NSHDSACASA-N 1 2 322.355 4.006 20 0 DIADLO Cc1conc1C[NH2+][C@@H](C)c1ccc(-c2csc(C)n2)cc1 ZINC000878354489 1043877265 /nfs/dbraw/zinc/87/72/65/1043877265.db2.gz NGOQERIWWIAQOO-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1conc1C[NH2+]C1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000878367624 1043879287 /nfs/dbraw/zinc/87/92/87/1043879287.db2.gz ACGFMOMDSCMKFZ-UHFFFAOYSA-N 1 2 310.319 4.171 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1ccc(C)c(Cl)n1 ZINC000878367075 1043880808 /nfs/dbraw/zinc/88/08/08/1043880808.db2.gz JOUUDVXNLBRGIN-LLVKDONJSA-N 1 2 308.784 4.042 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(F)(F)F)co1)c1cccc(F)c1F ZINC000878376232 1043883827 /nfs/dbraw/zinc/88/38/27/1043883827.db2.gz OCASDZUKGLJVRL-QMMMGPOBSA-N 1 2 305.246 4.427 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1nc2c(o1)CCCC2 ZINC000878416911 1043890005 /nfs/dbraw/zinc/89/00/05/1043890005.db2.gz UPSUFLWVLVHGKQ-CYBMUJFWSA-N 1 2 310.397 4.459 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cc(C(F)(F)F)co3)CCC2)n1 ZINC000878418300 1043890885 /nfs/dbraw/zinc/89/08/85/1043890885.db2.gz XHGMGHKZRAGQPT-UHFFFAOYSA-N 1 2 316.348 4.232 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(Cl)ccc(Br)c2F)C1 ZINC001141887607 1043891602 /nfs/dbraw/zinc/89/16/02/1043891602.db2.gz MRHZRUCCFXGZQE-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(Cl)ccc(Br)c2F)C1 ZINC001141887607 1043891620 /nfs/dbraw/zinc/89/16/20/1043891620.db2.gz MRHZRUCCFXGZQE-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO CC[C@@H](c1ccccc1)[N@H+](CC)Cc1ncn(-c2ccccc2)n1 ZINC000357004558 1043903644 /nfs/dbraw/zinc/90/36/44/1043903644.db2.gz PTVBKUFISBNCHX-IBGZPJMESA-N 1 2 320.440 4.241 20 0 DIADLO CC[C@@H](c1ccccc1)[N@@H+](CC)Cc1ncn(-c2ccccc2)n1 ZINC000357004558 1043903653 /nfs/dbraw/zinc/90/36/53/1043903653.db2.gz PTVBKUFISBNCHX-IBGZPJMESA-N 1 2 320.440 4.241 20 0 DIADLO CC(C)[C@H](c1ccccc1)[N@H+](C)Cc1ncn(-c2ccccc2)n1 ZINC000356992084 1043905041 /nfs/dbraw/zinc/90/50/41/1043905041.db2.gz VUTIJGTUYMUOKJ-HXUWFJFHSA-N 1 2 320.440 4.096 20 0 DIADLO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1ncn(-c2ccccc2)n1 ZINC000356992084 1043905043 /nfs/dbraw/zinc/90/50/43/1043905043.db2.gz VUTIJGTUYMUOKJ-HXUWFJFHSA-N 1 2 320.440 4.096 20 0 DIADLO C[C@@H](c1noc(-c2cccc(-n3cc[nH+]c3)c2)n1)c1cccs1 ZINC000357019633 1043906115 /nfs/dbraw/zinc/90/61/15/1043906115.db2.gz OTXXKVCVTHPKPY-GFCCVEGCSA-N 1 2 322.393 4.136 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001137134255 1043906438 /nfs/dbraw/zinc/90/64/38/1043906438.db2.gz MLIVYFVRYVUEMJ-OAHLLOKOSA-N 1 2 301.352 4.043 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001137134255 1043906447 /nfs/dbraw/zinc/90/64/47/1043906447.db2.gz MLIVYFVRYVUEMJ-OAHLLOKOSA-N 1 2 301.352 4.043 20 0 DIADLO C[C@H](NC(=O)[C@H]1CC12CCCCC2)c1cccc(-n2cc[nH+]c2)c1 ZINC000357011162 1043907464 /nfs/dbraw/zinc/90/74/64/1043907464.db2.gz JFDSTSDAUPDBOQ-MAUKXSAKSA-N 1 2 323.440 4.020 20 0 DIADLO Clc1cccc2c(N[C@@H]3[C@H]4CCO[C@@H]4C34CCC4)cc[nH+]c12 ZINC000561267241 1043916579 /nfs/dbraw/zinc/91/65/79/1043916579.db2.gz ABQLMMBFRXRSAW-JLZZUVOBSA-N 1 2 314.816 4.258 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2ccccc2OC2CC2)cs1 ZINC000290147050 1043921923 /nfs/dbraw/zinc/92/19/23/1043921923.db2.gz WIKLPRJWLQTJHD-LBPRGKRZSA-N 1 2 302.443 4.098 20 0 DIADLO COc1nnc(C[N@H+]([C@@H](C)c2ccccc2)C2CCCC2)s1 ZINC000930435403 1043926021 /nfs/dbraw/zinc/92/60/21/1043926021.db2.gz LOWBSLBRDRFKQA-ZDUSSCGKSA-N 1 2 317.458 4.053 20 0 DIADLO COc1nnc(C[N@@H+]([C@@H](C)c2ccccc2)C2CCCC2)s1 ZINC000930435403 1043926029 /nfs/dbraw/zinc/92/60/29/1043926029.db2.gz LOWBSLBRDRFKQA-ZDUSSCGKSA-N 1 2 317.458 4.053 20 0 DIADLO CC(C)(C)c1ncc(CNc2ccc(N3CCCC3)[nH+]c2)s1 ZINC000102826890 1043932854 /nfs/dbraw/zinc/93/28/54/1043932854.db2.gz UIRLIIQOCHTTQR-UHFFFAOYSA-N 1 2 316.474 4.048 20 0 DIADLO Clc1ccc2ccc(C[N@@H+]3CCC[C@H]3c3ncccn3)nc2c1 ZINC000878977842 1043932882 /nfs/dbraw/zinc/93/28/82/1043932882.db2.gz MGFFRCXHVNDOMI-KRWDZBQOSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1ccc2ccc(C[N@H+]3CCC[C@H]3c3ncccn3)nc2c1 ZINC000878977842 1043932892 /nfs/dbraw/zinc/93/28/92/1043932892.db2.gz MGFFRCXHVNDOMI-KRWDZBQOSA-N 1 2 324.815 4.015 20 0 DIADLO CCc1onc(C)c1C[N@@H+]1CCC[C@H]1c1nc2cc(C)ccc2[nH]1 ZINC000930486498 1043933022 /nfs/dbraw/zinc/93/30/22/1043933022.db2.gz MWEOLSUOSYMQJA-KRWDZBQOSA-N 1 2 324.428 4.067 20 0 DIADLO CCc1onc(C)c1C[N@H+]1CCC[C@H]1c1nc2cc(C)ccc2[nH]1 ZINC000930486498 1043933026 /nfs/dbraw/zinc/93/30/26/1043933026.db2.gz MWEOLSUOSYMQJA-KRWDZBQOSA-N 1 2 324.428 4.067 20 0 DIADLO CCc1onc(C)c1C[N@@H+]1CCC[C@H]1c1nc2ccc(C)cc2[nH]1 ZINC000930486498 1043933031 /nfs/dbraw/zinc/93/30/31/1043933031.db2.gz MWEOLSUOSYMQJA-KRWDZBQOSA-N 1 2 324.428 4.067 20 0 DIADLO CCc1onc(C)c1C[N@H+]1CCC[C@H]1c1nc2ccc(C)cc2[nH]1 ZINC000930486498 1043933041 /nfs/dbraw/zinc/93/30/41/1043933041.db2.gz MWEOLSUOSYMQJA-KRWDZBQOSA-N 1 2 324.428 4.067 20 0 DIADLO CCCC[C@@H](CC)[NH2+][C@@H](COC(C)(C)C)C(=O)OC(C)(C)C ZINC001257409270 1043936419 /nfs/dbraw/zinc/93/64/19/1043936419.db2.gz ZXRQMVOMGARIOF-CABCVRRESA-N 1 2 315.498 4.070 20 0 DIADLO Clc1cncc(Cl)c1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000879035244 1043938290 /nfs/dbraw/zinc/93/82/90/1043938290.db2.gz QJFZWCCCNZLOEW-INIZCTEOSA-N 1 2 322.239 4.414 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000290414534 1043949444 /nfs/dbraw/zinc/94/94/44/1043949444.db2.gz KHVBLBQBSLAUOC-CQSZACIVSA-N 1 2 303.475 4.419 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000290414534 1043949451 /nfs/dbraw/zinc/94/94/51/1043949451.db2.gz KHVBLBQBSLAUOC-CQSZACIVSA-N 1 2 303.475 4.419 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)c2c(F)cccc2F)c(C)[nH+]1 ZINC000179232031 1043949716 /nfs/dbraw/zinc/94/97/16/1043949716.db2.gz FGKXEZFVFWVDDV-LLVKDONJSA-N 1 2 304.340 4.027 20 0 DIADLO CC[N@H+](Cc1ncc(C(C)(C)C)s1)[C@@H](C)c1cccnc1 ZINC000290475360 1043953259 /nfs/dbraw/zinc/95/32/59/1043953259.db2.gz NTSJPPOTJMFRPA-ZDUSSCGKSA-N 1 2 303.475 4.419 20 0 DIADLO CC[N@@H+](Cc1ncc(C(C)(C)C)s1)[C@@H](C)c1cccnc1 ZINC000290475360 1043953264 /nfs/dbraw/zinc/95/32/64/1043953264.db2.gz NTSJPPOTJMFRPA-ZDUSSCGKSA-N 1 2 303.475 4.419 20 0 DIADLO CSc1ccc(NC(=O)c2cc(C)ccc2-n2cc[nH+]c2)cc1 ZINC000357595630 1043965810 /nfs/dbraw/zinc/96/58/10/1043965810.db2.gz HJEVCKSPLBARRO-UHFFFAOYSA-N 1 2 323.421 4.155 20 0 DIADLO CC(C)C[N@H+](Cc1nc(C(C)(C)C)co1)Cc1ccccn1 ZINC000896660656 1043974004 /nfs/dbraw/zinc/97/40/04/1043974004.db2.gz AZKMFVWUKVHSRZ-UHFFFAOYSA-N 1 2 301.434 4.025 20 0 DIADLO CC(C)C[N@@H+](Cc1nc(C(C)(C)C)co1)Cc1ccccn1 ZINC000896660656 1043974013 /nfs/dbraw/zinc/97/40/13/1043974013.db2.gz AZKMFVWUKVHSRZ-UHFFFAOYSA-N 1 2 301.434 4.025 20 0 DIADLO C[C@H](Cc1ccsc1)[N@H+](C)Cc1ncc(C(F)(F)F)s1 ZINC001308595308 1043981311 /nfs/dbraw/zinc/98/13/11/1043981311.db2.gz RDTXTQDPZNDQJV-SECBINFHSA-N 1 2 320.405 4.286 20 0 DIADLO C[C@H](Cc1ccsc1)[N@@H+](C)Cc1ncc(C(F)(F)F)s1 ZINC001308595308 1043981322 /nfs/dbraw/zinc/98/13/22/1043981322.db2.gz RDTXTQDPZNDQJV-SECBINFHSA-N 1 2 320.405 4.286 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2ccnc(Cl)c2Cl)CC1 ZINC000290771955 1043983371 /nfs/dbraw/zinc/98/33/71/1043983371.db2.gz BHUZVNJIQPNAOB-UHFFFAOYSA-N 1 2 311.187 4.306 20 0 DIADLO C[N@H+](Cc1ccn(C2CCCC2)n1)Cc1ccc2cc[nH]c2c1 ZINC000879726593 1043984173 /nfs/dbraw/zinc/98/41/73/1043984173.db2.gz PQVHUSFSHDBNAG-UHFFFAOYSA-N 1 2 308.429 4.112 20 0 DIADLO C[N@@H+](Cc1ccn(C2CCCC2)n1)Cc1ccc2cc[nH]c2c1 ZINC000879726593 1043984184 /nfs/dbraw/zinc/98/41/84/1043984184.db2.gz PQVHUSFSHDBNAG-UHFFFAOYSA-N 1 2 308.429 4.112 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000357786084 1043986607 /nfs/dbraw/zinc/98/66/07/1043986607.db2.gz VEACCKTUTFIRSY-WMLDXEAASA-N 1 2 309.438 4.287 20 0 DIADLO Cc1nc(-c2ccc(C[NH2+][C@H](C)c3nccs3)o2)cs1 ZINC000357786060 1043986849 /nfs/dbraw/zinc/98/68/49/1043986849.db2.gz UUTLLAMGUNRQFN-SECBINFHSA-N 1 2 305.428 4.019 20 0 DIADLO Cc1cncc([C@H]2CCC[N@@H+]2Cc2cc(C(F)(F)F)co2)c1 ZINC000879752326 1043988832 /nfs/dbraw/zinc/98/88/32/1043988832.db2.gz OVIMEKDJMBXTFT-OAHLLOKOSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1cncc([C@H]2CCC[N@H+]2Cc2cc(C(F)(F)F)co2)c1 ZINC000879752326 1043988837 /nfs/dbraw/zinc/98/88/37/1043988837.db2.gz OVIMEKDJMBXTFT-OAHLLOKOSA-N 1 2 310.319 4.339 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(-c3ccccc3)o2)[C@@H]1c1ccncc1 ZINC000931085294 1043989514 /nfs/dbraw/zinc/98/95/14/1043989514.db2.gz XQCKGKYSGGFFEK-GOSISDBHSA-N 1 2 319.408 4.320 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(-c3ccccc3)o2)[C@@H]1c1ccncc1 ZINC000931085294 1043989527 /nfs/dbraw/zinc/98/95/27/1043989527.db2.gz XQCKGKYSGGFFEK-GOSISDBHSA-N 1 2 319.408 4.320 20 0 DIADLO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2ccc(C)nc2Cl)c1 ZINC000879751421 1043990004 /nfs/dbraw/zinc/99/00/04/1043990004.db2.gz IIBQYJBMUMPEJG-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cncc([C@@H]2CCC[N@H+]2Cc2ccc(C)nc2Cl)c1 ZINC000879751421 1043990009 /nfs/dbraw/zinc/99/00/09/1043990009.db2.gz IIBQYJBMUMPEJG-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cccc2c(C[N@@H+]3CCc4cccc(Cl)c4C3)[nH]nc21 ZINC001137149012 1044003547 /nfs/dbraw/zinc/00/35/47/1044003547.db2.gz ANDOBDJHRWREPZ-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1cccc2c(C[N@H+]3CCc4cccc(Cl)c4C3)[nH]nc21 ZINC001137149012 1044003560 /nfs/dbraw/zinc/00/35/60/1044003560.db2.gz ANDOBDJHRWREPZ-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO CC(C)CC1(C)CC[NH+](CC(=O)Nc2c(F)cccc2F)CC1 ZINC000561782655 1044005684 /nfs/dbraw/zinc/00/56/84/1044005684.db2.gz AQJBEOQMXZPYNR-UHFFFAOYSA-N 1 2 324.415 4.052 20 0 DIADLO c1cn(Cc2cccc(-c3noc(C4CCCCCC4)n3)c2)c[nH+]1 ZINC000329566730 1044006807 /nfs/dbraw/zinc/00/68/07/1044006807.db2.gz KXQMWWGYCVBISX-UHFFFAOYSA-N 1 2 322.412 4.419 20 0 DIADLO Cc1nccnc1[C@@H](C)[NH2+]Cc1nc(C2CCCCC2)cs1 ZINC000880109301 1044013060 /nfs/dbraw/zinc/01/30/60/1044013060.db2.gz VXFGCBNYCUNYMZ-CYBMUJFWSA-N 1 2 316.474 4.140 20 0 DIADLO CC(C)Sc1ccc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)cc1 ZINC000358074745 1044013826 /nfs/dbraw/zinc/01/38/26/1044013826.db2.gz PDHLVLVBAZQDJA-INIZCTEOSA-N 1 2 301.459 4.247 20 0 DIADLO CC(C)Sc1ccc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)cc1 ZINC000358074745 1044013841 /nfs/dbraw/zinc/01/38/41/1044013841.db2.gz PDHLVLVBAZQDJA-INIZCTEOSA-N 1 2 301.459 4.247 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000358068461 1044014064 /nfs/dbraw/zinc/01/40/64/1044014064.db2.gz QGUKNPFOSQBVKD-OAHLLOKOSA-N 1 2 305.468 4.044 20 0 DIADLO CSc1ccccc1C[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000358068461 1044014079 /nfs/dbraw/zinc/01/40/79/1044014079.db2.gz QGUKNPFOSQBVKD-OAHLLOKOSA-N 1 2 305.468 4.044 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2csc(-c3ccccc3)n2)c(C)n1 ZINC000358122343 1044022035 /nfs/dbraw/zinc/02/20/35/1044022035.db2.gz FPJBVGKOIVIKII-LBPRGKRZSA-N 1 2 324.453 4.068 20 0 DIADLO CC[N@H+](Cc1[nH]nc2c1cccc2C)Cc1cccc(F)c1F ZINC001137150329 1044024943 /nfs/dbraw/zinc/02/49/43/1044024943.db2.gz CDLJEFWSYXCGAM-UHFFFAOYSA-N 1 2 315.367 4.172 20 0 DIADLO CC[N@@H+](Cc1[nH]nc2c1cccc2C)Cc1cccc(F)c1F ZINC001137150329 1044024954 /nfs/dbraw/zinc/02/49/54/1044024954.db2.gz CDLJEFWSYXCGAM-UHFFFAOYSA-N 1 2 315.367 4.172 20 0 DIADLO CCOc1ccccc1OCC[N@@H+]1Cc2cccc(Cl)c2C1 ZINC000561919543 1044026022 /nfs/dbraw/zinc/02/60/22/1044026022.db2.gz GCLBTESPRWLSIL-UHFFFAOYSA-N 1 2 317.816 4.133 20 0 DIADLO CCOc1ccccc1OCC[N@H+]1Cc2cccc(Cl)c2C1 ZINC000561919543 1044026032 /nfs/dbraw/zinc/02/60/32/1044026032.db2.gz GCLBTESPRWLSIL-UHFFFAOYSA-N 1 2 317.816 4.133 20 0 DIADLO Cc1ccc(C[S@](=O)CCC2C[C@@H](C)C[C@H](C)C2)c(C)[nH+]1 ZINC000358159105 1044026588 /nfs/dbraw/zinc/02/65/88/1044026588.db2.gz YBAVRQDIHGBEFB-DGCWBMGLSA-N 1 2 307.503 4.410 20 0 DIADLO CC1(C)C[N@H+](CC(=O)c2c[nH]c3ccccc23)[C@H]1c1cccs1 ZINC000561956258 1044036637 /nfs/dbraw/zinc/03/66/37/1044036637.db2.gz GANCQYTVIRTPKN-SFHVURJKSA-N 1 2 324.449 4.495 20 0 DIADLO CC1(C)C[N@@H+](CC(=O)c2c[nH]c3ccccc23)[C@H]1c1cccs1 ZINC000561956258 1044036649 /nfs/dbraw/zinc/03/66/49/1044036649.db2.gz GANCQYTVIRTPKN-SFHVURJKSA-N 1 2 324.449 4.495 20 0 DIADLO CCSc1ccccc1[C@@H](C)[NH2+][C@H](C)c1nnc(C(C)C)[nH]1 ZINC000358231687 1044037066 /nfs/dbraw/zinc/03/70/66/1044037066.db2.gz ADSFLPLKLORZSG-CHWSQXEVSA-N 1 2 318.490 4.452 20 0 DIADLO C[C@@H]1C[C@H](C[NH2+][C@@H](c2cccc(Cl)c2)C(F)F)CCO1 ZINC000880533965 1044045720 /nfs/dbraw/zinc/04/57/20/1044045720.db2.gz JRARTSRRTNOYIM-GYSYKLTISA-N 1 2 303.780 4.051 20 0 DIADLO C[C@@H]([NH2+]C/C=C\c1ccc(F)cc1F)c1nc(C(C)(C)C)no1 ZINC000562034004 1044051417 /nfs/dbraw/zinc/05/14/17/1044051417.db2.gz NULPTUXMSQPMJL-ISALQUGTSA-N 1 2 321.371 4.009 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc(C3CC3)cc2F)cc(C)[nH+]1 ZINC000880750465 1044071070 /nfs/dbraw/zinc/07/10/70/1044071070.db2.gz CWTIHHVLJGGWAG-UHFFFAOYSA-N 1 2 313.376 4.037 20 0 DIADLO CC[N@H+](Cc1cccc2nonc21)Cc1c(F)cccc1Cl ZINC001203139542 1044075639 /nfs/dbraw/zinc/07/56/39/1044075639.db2.gz HVEVYWDCIWQAKH-UHFFFAOYSA-N 1 2 319.767 4.037 20 0 DIADLO CC[N@@H+](Cc1cccc2nonc21)Cc1c(F)cccc1Cl ZINC001203139542 1044075654 /nfs/dbraw/zinc/07/56/54/1044075654.db2.gz HVEVYWDCIWQAKH-UHFFFAOYSA-N 1 2 319.767 4.037 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ccnc(Cl)c1Cl ZINC000291585544 1044086553 /nfs/dbraw/zinc/08/65/53/1044086553.db2.gz PFUNQOJXGWFKSD-ZDUSSCGKSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccnc(Cl)c1Cl ZINC000291585544 1044086563 /nfs/dbraw/zinc/08/65/63/1044086563.db2.gz PFUNQOJXGWFKSD-ZDUSSCGKSA-N 1 2 310.228 4.367 20 0 DIADLO CCOc1ccccc1OCCSCc1ccc(C)[nH+]c1C ZINC000358660692 1044091058 /nfs/dbraw/zinc/09/10/58/1044091058.db2.gz LPWMAQKHDNILQB-UHFFFAOYSA-N 1 2 317.454 4.409 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)N1CCCCC[C@@H]1c1ccco1 ZINC000281063067 1044091792 /nfs/dbraw/zinc/09/17/92/1044091792.db2.gz SBZSFBDOMRHXLE-OAHLLOKOSA-N 1 2 324.384 4.077 20 0 DIADLO FC(F)(F)C[C@@H]1CC[N@H+](Cc2ccnc(Cl)c2Cl)C1 ZINC000291690112 1044095228 /nfs/dbraw/zinc/09/52/28/1044095228.db2.gz XZWMTRUKWATXBC-QMMMGPOBSA-N 1 2 313.150 4.163 20 0 DIADLO FC(F)(F)C[C@@H]1CC[N@@H+](Cc2ccnc(Cl)c2Cl)C1 ZINC000291690112 1044095242 /nfs/dbraw/zinc/09/52/42/1044095242.db2.gz XZWMTRUKWATXBC-QMMMGPOBSA-N 1 2 313.150 4.163 20 0 DIADLO Cc1cccc([C@H](C)C[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)c1 ZINC000562340577 1044103457 /nfs/dbraw/zinc/10/34/57/1044103457.db2.gz KZFLUDRCUOMVSR-CRAIPNDOSA-N 1 2 312.461 4.128 20 0 DIADLO Cc1cc(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)ccc1C1CC1 ZINC000358887130 1044107065 /nfs/dbraw/zinc/10/70/65/1044107065.db2.gz NXFJGYAEFKMZQV-UHFFFAOYSA-N 1 2 317.392 4.310 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccn(Cc3ccccc3)c2)c(C)[nH+]1 ZINC000358871431 1044107526 /nfs/dbraw/zinc/10/75/26/1044107526.db2.gz GAGDRNRTXZGAMK-UHFFFAOYSA-N 1 2 319.408 4.109 20 0 DIADLO c1ccc2c(c1)OC1(CCC1)C[C@@H]2[NH2+]Cc1nc2c(o1)CCCC2 ZINC000932213570 1044110504 /nfs/dbraw/zinc/11/05/04/1044110504.db2.gz XPLGJLOEMUFNRK-INIZCTEOSA-N 1 2 324.424 4.090 20 0 DIADLO CC(C)c1ccccc1N(C)C(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000346517828 1044110838 /nfs/dbraw/zinc/11/08/38/1044110838.db2.gz HCBDRBLAHDUJIQ-UHFFFAOYSA-N 1 2 319.408 4.272 20 0 DIADLO Fc1ccccc1-c1cnc(C[NH2+][C@@H](c2ccccn2)C2CC2)o1 ZINC000932377053 1044121725 /nfs/dbraw/zinc/12/17/25/1044121725.db2.gz GYLYPLFGFWYDLI-LJQANCHMSA-N 1 2 323.371 4.117 20 0 DIADLO Cc1ccccc1-c1cnc(C[NH2+][C@@H](c2ccccn2)C2CC2)o1 ZINC000932380816 1044122346 /nfs/dbraw/zinc/12/23/46/1044122346.db2.gz WQJAFSSLPXJQRB-HXUWFJFHSA-N 1 2 319.408 4.286 20 0 DIADLO c1csc(-c2nc(C[NH2+][C@H](c3ccccn3)C3CC3)co2)c1 ZINC000932379653 1044122420 /nfs/dbraw/zinc/12/24/20/1044122420.db2.gz ISGHUFHHNJSEFM-INIZCTEOSA-N 1 2 311.410 4.039 20 0 DIADLO Cc1[nH+]cc(CNc2nccc3sccc32)n1-c1ccccc1 ZINC000359024133 1044122835 /nfs/dbraw/zinc/12/28/35/1044122835.db2.gz FZEAWUAKHQJKPV-UHFFFAOYSA-N 1 2 320.421 4.403 20 0 DIADLO CC(C)C[N@H+](Cc1ccn(C2CCCC2)n1)Cc1ccccn1 ZINC000932444551 1044129647 /nfs/dbraw/zinc/12/96/47/1044129647.db2.gz CGIINYNHUHTSMY-UHFFFAOYSA-N 1 2 312.461 4.051 20 0 DIADLO CC(C)C[N@@H+](Cc1ccn(C2CCCC2)n1)Cc1ccccn1 ZINC000932444551 1044129651 /nfs/dbraw/zinc/12/96/51/1044129651.db2.gz CGIINYNHUHTSMY-UHFFFAOYSA-N 1 2 312.461 4.051 20 0 DIADLO CC(C)C[N@H+](Cc1coc(C(C)(C)C)n1)Cc1ccccn1 ZINC000932447770 1044130649 /nfs/dbraw/zinc/13/06/49/1044130649.db2.gz VAFZFHSNECBYFU-UHFFFAOYSA-N 1 2 301.434 4.025 20 0 DIADLO CC(C)C[N@@H+](Cc1coc(C(C)(C)C)n1)Cc1ccccn1 ZINC000932447770 1044130652 /nfs/dbraw/zinc/13/06/52/1044130652.db2.gz VAFZFHSNECBYFU-UHFFFAOYSA-N 1 2 301.434 4.025 20 0 DIADLO Fc1ccc(C[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)cc1Cl ZINC000292065847 1044132421 /nfs/dbraw/zinc/13/24/21/1044132421.db2.gz HBKWLNDBCPOECQ-OAHLLOKOSA-N 1 2 322.815 4.008 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)ccc1Cl ZINC000292107720 1044137425 /nfs/dbraw/zinc/13/74/25/1044137425.db2.gz JYQILNZYBCSPMS-INIZCTEOSA-N 1 2 318.852 4.178 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(Cl)nc1 ZINC001137169758 1044141094 /nfs/dbraw/zinc/14/10/94/1044141094.db2.gz RTHJTYDOUZGPMF-MRXNPFEDSA-N 1 2 316.832 4.218 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(Cl)nc1 ZINC001137169758 1044141102 /nfs/dbraw/zinc/14/11/02/1044141102.db2.gz RTHJTYDOUZGPMF-MRXNPFEDSA-N 1 2 316.832 4.218 20 0 DIADLO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1nc(-c2cccs2)no1 ZINC000932556806 1044141966 /nfs/dbraw/zinc/14/19/66/1044141966.db2.gz WKQOFZUHACGRDR-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2C)n1 ZINC000932557130 1044142253 /nfs/dbraw/zinc/14/22/53/1044142253.db2.gz XPHLQYIPWABFCE-CHWSQXEVSA-N 1 2 305.397 4.272 20 0 DIADLO CCc1ccc(NC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000359272345 1044149077 /nfs/dbraw/zinc/14/90/77/1044149077.db2.gz QNLXIACTVCSLHM-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]C(C)(C)c2ccccc2F)cs1 ZINC000292218439 1044149973 /nfs/dbraw/zinc/14/99/73/1044149973.db2.gz UTLIYYZXDRRMQX-LLVKDONJSA-N 1 2 308.422 4.015 20 0 DIADLO FC(F)n1c2ccccc2nc1C[NH+]1CCC(F)(C2CC2)CC1 ZINC000932629845 1044150834 /nfs/dbraw/zinc/15/08/34/1044150834.db2.gz ICOWEJWUQFBDCC-UHFFFAOYSA-N 1 2 323.362 4.146 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C/C=C/c3cccc(F)c3)cc2[nH+]1 ZINC000359297746 1044152718 /nfs/dbraw/zinc/15/27/18/1044152718.db2.gz FLBJQAMGAMVXIO-HWKANZROSA-N 1 2 309.344 4.052 20 0 DIADLO CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000932655937 1044152891 /nfs/dbraw/zinc/15/28/91/1044152891.db2.gz WRFKCVAGNUEXCD-SFHVURJKSA-N 1 2 307.397 4.032 20 0 DIADLO Clc1cccc(C[N@@H+]2CCC[C@H]3C[C@H]32)c1Br ZINC001137621624 1044157763 /nfs/dbraw/zinc/15/77/63/1044157763.db2.gz BPUJXKPGUICIMN-JOYOIKCWSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1cccc(C[N@H+]2CCC[C@H]3C[C@H]32)c1Br ZINC001137621624 1044157769 /nfs/dbraw/zinc/15/77/69/1044157769.db2.gz BPUJXKPGUICIMN-JOYOIKCWSA-N 1 2 300.627 4.087 20 0 DIADLO Cc1[nH+]cc(CNc2ncc(Cl)cc2C)n1-c1ccccc1 ZINC000359473261 1044170280 /nfs/dbraw/zinc/17/02/80/1044170280.db2.gz PWHIKUZZWOTOMP-UHFFFAOYSA-N 1 2 312.804 4.150 20 0 DIADLO c1coc(-c2nc(C[N@@H+]3CCC[C@@H]3c3cccnc3)cs2)c1 ZINC000346977441 1044177847 /nfs/dbraw/zinc/17/78/47/1044177847.db2.gz TWPLCMHAJFSPHX-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO c1coc(-c2nc(C[N@H+]3CCC[C@@H]3c3cccnc3)cs2)c1 ZINC000346977441 1044177853 /nfs/dbraw/zinc/17/78/53/1044177853.db2.gz TWPLCMHAJFSPHX-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2nc(C[N@@H+]3CCC[C@H]3c3cccnc3)co2)c1 ZINC000346980378 1044177969 /nfs/dbraw/zinc/17/79/69/1044177969.db2.gz WAPFBYJDNNECOD-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2nc(C[N@H+]3CCC[C@H]3c3cccnc3)co2)c1 ZINC000346980378 1044177973 /nfs/dbraw/zinc/17/79/73/1044177973.db2.gz WAPFBYJDNNECOD-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO c1coc(-c2nc(C[N@@H+]3CCC[C@H]3c3cccnc3)cs2)c1 ZINC000346977438 1044178170 /nfs/dbraw/zinc/17/81/70/1044178170.db2.gz TWPLCMHAJFSPHX-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO c1coc(-c2nc(C[N@H+]3CCC[C@H]3c3cccnc3)cs2)c1 ZINC000346977438 1044178172 /nfs/dbraw/zinc/17/81/72/1044178172.db2.gz TWPLCMHAJFSPHX-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2nc(C[N@@H+]3CCC[C@@H]3c3cccnc3)co2)c1 ZINC000346980381 1044178579 /nfs/dbraw/zinc/17/85/79/1044178579.db2.gz WAPFBYJDNNECOD-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2nc(C[N@H+]3CCC[C@@H]3c3cccnc3)co2)c1 ZINC000346980381 1044178583 /nfs/dbraw/zinc/17/85/83/1044178583.db2.gz WAPFBYJDNNECOD-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2cnc(C[N@@H+]3CCC[C@@H]3c3cccnc3)o2)c1 ZINC000346991344 1044183168 /nfs/dbraw/zinc/18/31/68/1044183168.db2.gz IBUAFPSRRKFZSD-CQSZACIVSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2cnc(C[N@H+]3CCC[C@@H]3c3cccnc3)o2)c1 ZINC000346991344 1044183173 /nfs/dbraw/zinc/18/31/73/1044183173.db2.gz IBUAFPSRRKFZSD-CQSZACIVSA-N 1 2 311.410 4.135 20 0 DIADLO Cc1sc(C[NH2+][C@H](C)c2ccc(Cl)cn2)nc1C(C)C ZINC000359677970 1044188919 /nfs/dbraw/zinc/18/89/19/1044188919.db2.gz PDBDJWDIXYEIQY-SNVBAGLBSA-N 1 2 309.866 4.474 20 0 DIADLO Cc1cscc1-c1noc(-c2cccc(Cn3cc[nH+]c3)c2)n1 ZINC000347168866 1044203649 /nfs/dbraw/zinc/20/36/49/1044203649.db2.gz UZIBKZQDCUICAS-UHFFFAOYSA-N 1 2 322.393 4.018 20 0 DIADLO Cc1[nH+]cc(CNc2cnc3c(c2)CCCC3)n1-c1ccccc1 ZINC000359817939 1044205544 /nfs/dbraw/zinc/20/55/44/1044205544.db2.gz HZBQWXKZSJGAOR-UHFFFAOYSA-N 1 2 318.424 4.067 20 0 DIADLO Cc1ccc([C@H](Nc2nc(C)[nH+]c(C)c2C)c2ccccn2)cc1 ZINC000359899131 1044213098 /nfs/dbraw/zinc/21/30/98/1044213098.db2.gz LJVBKWZQMSIQBS-IBGZPJMESA-N 1 2 318.424 4.307 20 0 DIADLO Cc1ccc([C@@H](Nc2nc(C)[nH+]c(C)c2C)c2ccccn2)cc1 ZINC000359899132 1044213313 /nfs/dbraw/zinc/21/33/13/1044213313.db2.gz LJVBKWZQMSIQBS-LJQANCHMSA-N 1 2 318.424 4.307 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nccn1-c1ccccc1)c1c(C)noc1C ZINC000347252555 1044217632 /nfs/dbraw/zinc/21/76/32/1044217632.db2.gz QSCSKEJVMJWWKY-PBHICJAKSA-N 1 2 324.428 4.279 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+][C@@H]2CC(C)(C)Oc3cc(F)ccc32)n1 ZINC000883049820 1044218266 /nfs/dbraw/zinc/21/82/66/1044218266.db2.gz WDMWAAQEAZRPKC-CQSZACIVSA-N 1 2 317.408 4.064 20 0 DIADLO CC(C)c1csc(C[NH2+][C@H](c2ccc(F)cn2)C(C)C)n1 ZINC000354086698 1044223808 /nfs/dbraw/zinc/22/38/08/1044223808.db2.gz SPATUHLBSMRGHK-INIZCTEOSA-N 1 2 307.438 4.288 20 0 DIADLO C[N@H+](Cc1ccn(-c2ccccc2)n1)Cc1ccc(Cl)cc1 ZINC000522862914 1044226951 /nfs/dbraw/zinc/22/69/51/1044226951.db2.gz UTUPCOKGCUCZOD-UHFFFAOYSA-N 1 2 311.816 4.158 20 0 DIADLO C[N@@H+](Cc1ccn(-c2ccccc2)n1)Cc1ccc(Cl)cc1 ZINC000522862914 1044226964 /nfs/dbraw/zinc/22/69/64/1044226964.db2.gz UTUPCOKGCUCZOD-UHFFFAOYSA-N 1 2 311.816 4.158 20 0 DIADLO CC(C)(C)SCCCC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000131172244 1044229809 /nfs/dbraw/zinc/22/98/09/1044229809.db2.gz FYZYQDKZROZICX-UHFFFAOYSA-N 1 2 317.458 4.123 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(Cc2ccccc2)n1)c1cncs1 ZINC000934200800 1044230964 /nfs/dbraw/zinc/23/09/64/1044230964.db2.gz ICNHIYAABMVBEQ-GFCCVEGCSA-N 1 2 315.467 4.041 20 0 DIADLO c1nc(CNc2[nH+]c3ccccc3n2C2CCCC2)cn1C1CC1 ZINC000883214960 1044237802 /nfs/dbraw/zinc/23/78/02/1044237802.db2.gz PPIAMICCGLORML-UHFFFAOYSA-N 1 2 321.428 4.295 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C(C)(C)C)[nH]1)c1ccc(Cl)s1 ZINC000293000890 1044240201 /nfs/dbraw/zinc/24/02/01/1044240201.db2.gz STZDCYZJRARLCI-SECBINFHSA-N 1 2 312.870 4.058 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nnc(C(C)(C)C)[nH]1)c1ccc(F)cc1F ZINC000293046349 1044244227 /nfs/dbraw/zinc/24/42/27/1044244227.db2.gz XRFYXLJBESPWTC-CQSZACIVSA-N 1 2 322.403 4.011 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(Cl)cc1OC(C)C)c1nccn1C ZINC000883266978 1044254725 /nfs/dbraw/zinc/25/47/25/1044254725.db2.gz PJBLETZEUFHKKS-HNNXBMFYSA-N 1 2 321.852 4.102 20 0 DIADLO COc1ccc(C2CC2)cc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000883266583 1044255537 /nfs/dbraw/zinc/25/55/37/1044255537.db2.gz DQCNHSUZHNKPRX-OAHLLOKOSA-N 1 2 314.454 4.196 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(Cl)cc1OC(C)C)c1nccn1C ZINC000883266979 1044255803 /nfs/dbraw/zinc/25/58/03/1044255803.db2.gz PJBLETZEUFHKKS-OAHLLOKOSA-N 1 2 321.852 4.102 20 0 DIADLO CCOc1ccccc1C[NH2+]Cc1ncoc1-c1ccccc1 ZINC000360324400 1044259249 /nfs/dbraw/zinc/25/92/49/1044259249.db2.gz VPRLJWLRDURLPL-UHFFFAOYSA-N 1 2 308.381 4.030 20 0 DIADLO CSc1ccc([C@H](C)[NH2+]C2(c3ncccn3)CCC2)cc1F ZINC000883312362 1044265175 /nfs/dbraw/zinc/26/51/75/1044265175.db2.gz AWCJLRDCVZRSJY-LBPRGKRZSA-N 1 2 317.433 4.068 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+]C2(c3ncccn3)CCC2)cc1F ZINC000883312361 1044265548 /nfs/dbraw/zinc/26/55/48/1044265548.db2.gz AWCJLRDCVZRSJY-GFCCVEGCSA-N 1 2 317.433 4.068 20 0 DIADLO C[C@H]1C[C@H]([NH2+]C2(c3ncccn3)CCC2)c2ccsc2S1 ZINC000883312615 1044265752 /nfs/dbraw/zinc/26/57/52/1044265752.db2.gz IWAFJIKZUDWZLS-AAEUAGOBSA-N 1 2 317.483 4.133 20 0 DIADLO CC[C@H](Cc1ccccc1)N(CC)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000934648477 1044266349 /nfs/dbraw/zinc/26/63/49/1044266349.db2.gz QNYSIELDRAEBIU-QGZVFWFLSA-N 1 2 321.424 4.046 20 0 DIADLO Oc1cccc(C[NH2+][C@@H]2CCCOc3c(F)cccc32)c1Cl ZINC000293318710 1044271256 /nfs/dbraw/zinc/27/12/56/1044271256.db2.gz QVCSCYFUJVJRMJ-CQSZACIVSA-N 1 2 321.779 4.188 20 0 DIADLO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1cccc(O)c1Cl ZINC000293373687 1044275281 /nfs/dbraw/zinc/27/52/81/1044275281.db2.gz VMAAZDYNUFCWLQ-LLVKDONJSA-N 1 2 321.852 4.156 20 0 DIADLO COc1cccc2c1OCCC[C@@H]2[NH2+][C@H](C)c1csc(C)n1 ZINC000883330274 1044277208 /nfs/dbraw/zinc/27/72/08/1044277208.db2.gz BHAIAECKTVNOAV-RISCZKNCSA-N 1 2 318.442 4.025 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)c[nH+]c1C ZINC000883341914 1044277712 /nfs/dbraw/zinc/27/77/12/1044277712.db2.gz DSAOQHFPYFNWJT-CQSZACIVSA-N 1 2 324.428 4.155 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(OCc3ccccc3)cc2)no1 ZINC000063742456 1044280238 /nfs/dbraw/zinc/28/02/38/1044280238.db2.gz GKOOABMJTSPDBZ-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(OCc3ccccc3)cc2)no1 ZINC000063742456 1044280252 /nfs/dbraw/zinc/28/02/52/1044280252.db2.gz GKOOABMJTSPDBZ-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1sccc1C[NH2+][C@H](C)c1nc(C2CCCCC2)no1 ZINC000293427741 1044284085 /nfs/dbraw/zinc/28/40/85/1044284085.db2.gz AWYAYVNTJRYTIG-LLVKDONJSA-N 1 2 305.447 4.338 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc([C@H](F)C(F)(F)F)cc1 ZINC000883368512 1044285601 /nfs/dbraw/zinc/28/56/01/1044285601.db2.gz SCMXAFLCUWVSJP-ZDUSSCGKSA-N 1 2 301.287 4.088 20 0 DIADLO C[C@H]([NH2+][C@@H]1c2ccccc2CC[C@H]1F)c1ccc(Cl)cn1 ZINC000883375956 1044288055 /nfs/dbraw/zinc/28/80/55/1044288055.db2.gz CJOQKCZWOSWPOC-UXEPBGEESA-N 1 2 304.796 4.411 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cccc2c1CCOC2 ZINC000883377458 1044288876 /nfs/dbraw/zinc/28/88/76/1044288876.db2.gz IFPNJCQGXNAOSM-UHFFFAOYSA-N 1 2 314.454 4.020 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+][C@H]1c2ccccc2CC[C@@H]1F ZINC000883376458 1044290475 /nfs/dbraw/zinc/29/04/75/1044290475.db2.gz LHMCIEOIJUVRCX-GYOIFBIXSA-N 1 2 302.393 4.222 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@H]1[NH2+][C@@H]1CCc2ccc(Cl)nc21 ZINC000883377009 1044291002 /nfs/dbraw/zinc/29/10/02/1044291002.db2.gz XSXIQTQUJNVXTH-IIDMSEBBSA-N 1 2 316.807 4.338 20 0 DIADLO Cc1sccc1C[NH2+][C@H](C)c1nc(-c2cccc(F)c2)no1 ZINC000293528159 1044294305 /nfs/dbraw/zinc/29/43/05/1044294305.db2.gz JFFMLURVPHMOLL-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO CCCn1c2ccc(Cl)cc2nc1SCc1c[nH+]cn1C ZINC000360723733 1044303803 /nfs/dbraw/zinc/30/38/03/1044303803.db2.gz WDBRFFCQBDEUTB-UHFFFAOYSA-N 1 2 320.849 4.126 20 0 DIADLO CC1(C)Nc2ccccc2[C@H]1[NH2+]Cc1ncc(-c2ccccc2)o1 ZINC000883462842 1044308857 /nfs/dbraw/zinc/30/88/57/1044308857.db2.gz BDUXOQAJTQFSGG-LJQANCHMSA-N 1 2 319.408 4.377 20 0 DIADLO CCCc1nc(C)c(C[NH2+][C@H](COC)c2cccc(Cl)c2)o1 ZINC000293696531 1044314989 /nfs/dbraw/zinc/31/49/89/1044314989.db2.gz OBVXRSNRGSKUSZ-OAHLLOKOSA-N 1 2 322.836 4.066 20 0 DIADLO Cc1ccc2c(Nc3cnc(Cl)nc3Cl)cccc2[nH+]1 ZINC001212795192 1044319945 /nfs/dbraw/zinc/31/99/45/1044319945.db2.gz UBIONUVTUXQQFO-UHFFFAOYSA-N 1 2 305.168 4.384 20 0 DIADLO Cc1ccc2c(Nc3ncccc3OC(F)F)cccc2[nH+]1 ZINC001212795932 1044322121 /nfs/dbraw/zinc/32/21/21/1044322121.db2.gz JPGJOPZJABXRTL-UHFFFAOYSA-N 1 2 301.296 4.283 20 0 DIADLO c1cncc([C@H](Nc2ccc(N3CCCCC3)c[nH+]2)C2CCC2)c1 ZINC000360883695 1044323452 /nfs/dbraw/zinc/32/34/52/1044323452.db2.gz KYOSZUNLYPHUCA-HXUWFJFHSA-N 1 2 322.456 4.420 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1ccc(C(F)F)cc1)CCO2 ZINC000475209418 1044325781 /nfs/dbraw/zinc/32/57/81/1044325781.db2.gz CZFIIMQOWODUHP-UHFFFAOYSA-N 1 2 307.315 4.158 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1ccc(C(F)F)cc1)CCO2 ZINC000475209418 1044325790 /nfs/dbraw/zinc/32/57/90/1044325790.db2.gz CZFIIMQOWODUHP-UHFFFAOYSA-N 1 2 307.315 4.158 20 0 DIADLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1sccc1Oc1ccccc1 ZINC001142003623 1044332720 /nfs/dbraw/zinc/33/27/20/1044332720.db2.gz VNPZNHDUBNKLLU-HNNXBMFYSA-N 1 2 301.411 4.094 20 0 DIADLO CC(=O)[C@@H]1CCC[N@H+]1Cc1sccc1Oc1ccccc1 ZINC001142003623 1044332730 /nfs/dbraw/zinc/33/27/30/1044332730.db2.gz VNPZNHDUBNKLLU-HNNXBMFYSA-N 1 2 301.411 4.094 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2nnc(C3CC3)n2C2CC2)c1 ZINC000360966122 1044335906 /nfs/dbraw/zinc/33/59/06/1044335906.db2.gz MTYLTZGHLYWTMS-OAHLLOKOSA-N 1 2 324.472 4.300 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@@H+](C)Cc2nnc(C3CC3)n2C2CC2)c1 ZINC000360966122 1044335920 /nfs/dbraw/zinc/33/59/20/1044335920.db2.gz MTYLTZGHLYWTMS-OAHLLOKOSA-N 1 2 324.472 4.300 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2nnc(C3CC3)n2C2CC2)c1 ZINC000360966121 1044337397 /nfs/dbraw/zinc/33/73/97/1044337397.db2.gz MTYLTZGHLYWTMS-HNNXBMFYSA-N 1 2 324.472 4.300 20 0 DIADLO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2nnc(C3CC3)n2C2CC2)c1 ZINC000360966121 1044337409 /nfs/dbraw/zinc/33/74/09/1044337409.db2.gz MTYLTZGHLYWTMS-HNNXBMFYSA-N 1 2 324.472 4.300 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)cn1 ZINC000360966187 1044337434 /nfs/dbraw/zinc/33/74/34/1044337434.db2.gz LMJQTLMBQQNZFJ-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)cn1 ZINC000360966187 1044337446 /nfs/dbraw/zinc/33/74/46/1044337446.db2.gz LMJQTLMBQQNZFJ-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO C[C@@H](c1nnc(-c2ccccc2)o1)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000361075511 1044356435 /nfs/dbraw/zinc/35/64/35/1044356435.db2.gz ZHZMXNJKYOAWKF-KGLIPLIRSA-N 1 2 305.381 4.374 20 0 DIADLO C[C@@H](c1nnc(-c2ccccc2)o1)[N@H+]1Cc2ccccc2[C@H]1C ZINC000361075511 1044356446 /nfs/dbraw/zinc/35/64/46/1044356446.db2.gz ZHZMXNJKYOAWKF-KGLIPLIRSA-N 1 2 305.381 4.374 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1c[nH]nc1-c1ccccc1F)C2 ZINC000361114942 1044362270 /nfs/dbraw/zinc/36/22/70/1044362270.db2.gz VBCPSYCLKCPGAS-UHFFFAOYSA-N 1 2 307.372 4.040 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1c[nH]nc1-c1ccccc1F)C2 ZINC000361114942 1044362286 /nfs/dbraw/zinc/36/22/86/1044362286.db2.gz VBCPSYCLKCPGAS-UHFFFAOYSA-N 1 2 307.372 4.040 20 0 DIADLO CCc1cnccc1[C@@H](C)[NH2+][C@H](C)c1nnc(-c2ccccc2)o1 ZINC000361118259 1044363547 /nfs/dbraw/zinc/36/35/47/1044363547.db2.gz APFFGFSTZOJAGW-ZIAGYGMSSA-N 1 2 322.412 4.106 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1CC[C@@H]2C[C@@H]2CC1 ZINC000935760169 1044366980 /nfs/dbraw/zinc/36/69/80/1044366980.db2.gz WAACYQPDQGLBMF-QKDCVEJESA-N 1 2 309.413 4.150 20 0 DIADLO O=C(/C=C/c1ccc(Cl)cc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000029277325 1044368734 /nfs/dbraw/zinc/36/87/34/1044368734.db2.gz ILWIEZXCMKFJBK-XCVCLJGOSA-N 1 2 323.783 4.178 20 0 DIADLO CCc1ccc(CNc2ccc(-n3c[nH+]c(C)c3C)cc2)cn1 ZINC000361238791 1044379491 /nfs/dbraw/zinc/37/94/91/1044379491.db2.gz VVEJIYIRENILFH-UHFFFAOYSA-N 1 2 306.413 4.059 20 0 DIADLO Fc1ccc(F)c2c1OCC[C@@H]2[NH2+]Cc1sccc1Cl ZINC000361254602 1044380592 /nfs/dbraw/zinc/38/05/92/1044380592.db2.gz ZQTKQOGKHNOSNO-NSHDSACASA-N 1 2 315.772 4.293 20 0 DIADLO C[N@H+](Cc1cccnc1)Cc1cc(Cl)ccc1OCC1CC1 ZINC000361317210 1044390813 /nfs/dbraw/zinc/39/08/13/1044390813.db2.gz XXMMSAJWFFHUSQ-UHFFFAOYSA-N 1 2 316.832 4.156 20 0 DIADLO C[N@@H+](Cc1cccnc1)Cc1cc(Cl)ccc1OCC1CC1 ZINC000361317210 1044390828 /nfs/dbraw/zinc/39/08/28/1044390828.db2.gz XXMMSAJWFFHUSQ-UHFFFAOYSA-N 1 2 316.832 4.156 20 0 DIADLO C[C@H]([NH2+]Cc1nc(CC2CC2)no1)c1cccc2ccccc21 ZINC000639561617 1044394798 /nfs/dbraw/zinc/39/47/98/1044394798.db2.gz OOKYUAWXSBFTCP-ZDUSSCGKSA-N 1 2 307.397 4.026 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CCCC[C@@H]1c1ccc(F)cc1 ZINC000361372194 1044399202 /nfs/dbraw/zinc/39/92/02/1044399202.db2.gz LQSVBGKHOYHUQE-QGZVFWFLSA-N 1 2 301.409 4.330 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CCCC[C@@H]1c1ccc(F)cc1 ZINC000361372194 1044399214 /nfs/dbraw/zinc/39/92/14/1044399214.db2.gz LQSVBGKHOYHUQE-QGZVFWFLSA-N 1 2 301.409 4.330 20 0 DIADLO COc1cccc(CSCc2[nH+]cc(C)c(OC)c2C)c1 ZINC000609852061 1044404527 /nfs/dbraw/zinc/40/45/27/1044404527.db2.gz OHXFBJNTUYNATL-UHFFFAOYSA-N 1 2 303.427 4.149 20 0 DIADLO C[C@H](CC[NH2+][C@@H](c1cccs1)c1nnc[nH]1)CC(C)(C)C ZINC000294374604 1044412884 /nfs/dbraw/zinc/41/28/84/1044412884.db2.gz RCNFOKFSKYVSLP-OCCSQVGLSA-N 1 2 306.479 4.008 20 0 DIADLO Cc1ccc([C@@H](c2noc(C[C@@H](C)n3cc[nH+]c3)n2)C(C)C)cc1 ZINC000565063109 1044413304 /nfs/dbraw/zinc/41/33/04/1044413304.db2.gz RKIGLIZPLUPFQH-QAPCUYQASA-N 1 2 324.428 4.166 20 0 DIADLO C[C@H]1C[N@H+](Cc2nccn2-c2ccccc2)[C@H]1c1ccccc1 ZINC000361573280 1044420824 /nfs/dbraw/zinc/42/08/24/1044420824.db2.gz YSEPUHBSFFHLLM-OXJNMPFZSA-N 1 2 303.409 4.065 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nccn2-c2ccccc2)[C@H]1c1ccccc1 ZINC000361573280 1044420830 /nfs/dbraw/zinc/42/08/30/1044420830.db2.gz YSEPUHBSFFHLLM-OXJNMPFZSA-N 1 2 303.409 4.065 20 0 DIADLO Cc1ccccc1[C@@H](C)c1noc([C@H](c2ccccc2)[NH+](C)C)n1 ZINC000565330381 1044427441 /nfs/dbraw/zinc/42/74/41/1044427441.db2.gz GQLLDHFKSPKIRH-QAPCUYQASA-N 1 2 321.424 4.181 20 0 DIADLO CN(c1nc(C[N@@H+]2CCC[C@H]2c2ccsc2)cs1)C1CC1 ZINC000361658089 1044430357 /nfs/dbraw/zinc/43/03/57/1044430357.db2.gz XGFSGNMTYHQNTG-HNNXBMFYSA-N 1 2 319.499 4.140 20 0 DIADLO CN(c1nc(C[N@H+]2CCC[C@H]2c2ccsc2)cs1)C1CC1 ZINC000361658089 1044430364 /nfs/dbraw/zinc/43/03/64/1044430364.db2.gz XGFSGNMTYHQNTG-HNNXBMFYSA-N 1 2 319.499 4.140 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1cccnc1Cl)CCC2 ZINC000111310717 1044431939 /nfs/dbraw/zinc/43/19/39/1044431939.db2.gz UUPQBTXNJDGWSS-ZDUSSCGKSA-N 1 2 307.850 4.009 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cccnc1Cl)CCC2 ZINC000111310717 1044431945 /nfs/dbraw/zinc/43/19/45/1044431945.db2.gz UUPQBTXNJDGWSS-ZDUSSCGKSA-N 1 2 307.850 4.009 20 0 DIADLO CCC[C@](C)(CC)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000565447596 1044433625 /nfs/dbraw/zinc/43/36/25/1044433625.db2.gz LEIQNDRCSWZUKH-IBGZPJMESA-N 1 2 324.428 4.449 20 0 DIADLO CC(C)C[C@@H]1CCC[C@H](Nc2ccc(Cn3cc[nH+]c3)cn2)C1 ZINC000565565738 1044443543 /nfs/dbraw/zinc/44/35/43/1044443543.db2.gz GTOXVGRGEVHBJN-WMZOPIPTSA-N 1 2 312.461 4.343 20 0 DIADLO Cc1ccc2c(Nc3ccc4c(c3)CN(C)C(=O)N4)cccc2[nH+]1 ZINC001212798412 1044446010 /nfs/dbraw/zinc/44/60/10/1044446010.db2.gz GINUZFYXTACDTC-UHFFFAOYSA-N 1 2 318.380 4.264 20 0 DIADLO CCCCCC(C)(C)C[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000294689618 1044448135 /nfs/dbraw/zinc/44/81/35/1044448135.db2.gz IMMFFHKNBKLPPN-CQSZACIVSA-N 1 2 306.479 4.152 20 0 DIADLO Cc1ccc2c(Nc3cccc4c3CCC(=O)N4)cccc2[nH+]1 ZINC001212798815 1044450629 /nfs/dbraw/zinc/45/06/29/1044450629.db2.gz ULPHKMLQYYFLDP-UHFFFAOYSA-N 1 2 303.365 4.172 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ccc(Cl)cc1)c1nc(C2CC2)no1 ZINC000113357571 1044452011 /nfs/dbraw/zinc/45/20/11/1044452011.db2.gz QPWRPZFTKKEABG-AWEZNQCLSA-N 1 2 305.809 4.087 20 0 DIADLO Cc1cc(N2C[C@@H](c3ccccc3C)C[C@H]2C)nc(C2CC2)[nH+]1 ZINC000523086804 1044462715 /nfs/dbraw/zinc/46/27/15/1044462715.db2.gz XOMGALHULHNNNL-WBVHZDCISA-N 1 2 307.441 4.353 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]C2(c3nccs3)CCCC2)o1 ZINC000116374393 1044470538 /nfs/dbraw/zinc/47/05/38/1044470538.db2.gz VKJVXRWUXYNYBG-GXTWGEPZSA-N 1 2 302.443 4.419 20 0 DIADLO C[N@H+](Cc1ccco1)Cc1nc2cc(C(F)(F)F)ccc2o1 ZINC000118961081 1044487602 /nfs/dbraw/zinc/48/76/02/1044487602.db2.gz FTAQUPTUYAUNPW-UHFFFAOYSA-N 1 2 310.275 4.072 20 0 DIADLO C[N@@H+](Cc1ccco1)Cc1nc2cc(C(F)(F)F)ccc2o1 ZINC000118961081 1044487608 /nfs/dbraw/zinc/48/76/08/1044487608.db2.gz FTAQUPTUYAUNPW-UHFFFAOYSA-N 1 2 310.275 4.072 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2cccc3c2OC(C)(C)C3)cs1 ZINC000119185746 1044491188 /nfs/dbraw/zinc/49/11/88/1044491188.db2.gz HUPZQTVVADEDGP-GFCCVEGCSA-N 1 2 316.470 4.270 20 0 DIADLO C[N@H+](Cc1cc2ccccc2o1)Cc1nc(-c2ccccc2)c[nH]1 ZINC000362310036 1044498977 /nfs/dbraw/zinc/49/89/77/1044498977.db2.gz WBGPDWNZLHWUNZ-UHFFFAOYSA-N 1 2 317.392 4.455 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2o1)Cc1nc(-c2ccccc2)c[nH]1 ZINC000362310036 1044498980 /nfs/dbraw/zinc/49/89/80/1044498980.db2.gz WBGPDWNZLHWUNZ-UHFFFAOYSA-N 1 2 317.392 4.455 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+][C@H](C)c2nc(C3CC3)no2)c1 ZINC000120239750 1044503279 /nfs/dbraw/zinc/50/32/79/1044503279.db2.gz ZXDKTVODCBHTPT-QWHCGFSZSA-N 1 2 315.417 4.146 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2nc(CC(C)C)no2)o1 ZINC000362432269 1044509379 /nfs/dbraw/zinc/50/93/79/1044509379.db2.gz YQNJCXMIAAOABX-DZGCQCFKSA-N 1 2 317.433 4.143 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2nc(CC(C)C)no2)o1 ZINC000362432269 1044509389 /nfs/dbraw/zinc/50/93/89/1044509389.db2.gz YQNJCXMIAAOABX-DZGCQCFKSA-N 1 2 317.433 4.143 20 0 DIADLO COc1ccc2nc(C[N@@H+]3CC[C@@H]3c3ccccc3)sc2c1 ZINC000475573672 1044510587 /nfs/dbraw/zinc/51/05/87/1044510587.db2.gz MLQKQUJLPKGMIQ-MRXNPFEDSA-N 1 2 310.422 4.252 20 0 DIADLO COc1ccc2nc(C[N@H+]3CC[C@@H]3c3ccccc3)sc2c1 ZINC000475573672 1044510599 /nfs/dbraw/zinc/51/05/99/1044510599.db2.gz MLQKQUJLPKGMIQ-MRXNPFEDSA-N 1 2 310.422 4.252 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2cn3ccsc3n2)o1 ZINC000362436304 1044510890 /nfs/dbraw/zinc/51/08/90/1044510890.db2.gz ZWXPYRHYPLLPGT-IUODEOHRSA-N 1 2 315.442 4.270 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2cn3ccsc3n2)o1 ZINC000362436304 1044510902 /nfs/dbraw/zinc/51/09/02/1044510902.db2.gz ZWXPYRHYPLLPGT-IUODEOHRSA-N 1 2 315.442 4.270 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2nc(CC(C)C)no2)o1 ZINC000362432275 1044511104 /nfs/dbraw/zinc/51/11/04/1044511104.db2.gz YQNJCXMIAAOABX-ZFWWWQNUSA-N 1 2 317.433 4.143 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2nc(CC(C)C)no2)o1 ZINC000362432275 1044511115 /nfs/dbraw/zinc/51/11/15/1044511115.db2.gz YQNJCXMIAAOABX-ZFWWWQNUSA-N 1 2 317.433 4.143 20 0 DIADLO C[C@@H]([NH2+]Cc1ncnn1C(C)(C)C)c1ccc(-c2ccccc2)o1 ZINC000282915978 1044512324 /nfs/dbraw/zinc/51/23/24/1044512324.db2.gz XQIWPWGTULHGTQ-CQSZACIVSA-N 1 2 324.428 4.144 20 0 DIADLO CC[N@H+](Cc1ncc(-c2ccc(F)cc2)o1)Cc1occc1C ZINC000566960497 1044532282 /nfs/dbraw/zinc/53/22/82/1044532282.db2.gz BNBZSAIURLDDSP-UHFFFAOYSA-N 1 2 314.360 4.404 20 0 DIADLO CC[N@@H+](Cc1ncc(-c2ccc(F)cc2)o1)Cc1occc1C ZINC000566960497 1044532292 /nfs/dbraw/zinc/53/22/92/1044532292.db2.gz BNBZSAIURLDDSP-UHFFFAOYSA-N 1 2 314.360 4.404 20 0 DIADLO CC(C)n1ccc(C[NH+]2CCC(c3c(F)cccc3F)CC2)n1 ZINC000362605430 1044535126 /nfs/dbraw/zinc/53/51/26/1044535126.db2.gz FOZCQXCLFCLWGH-UHFFFAOYSA-N 1 2 319.399 4.122 20 0 DIADLO Cc1nsc(C)c1C[NH2+][C@H](c1ccc(C)cc1)c1ccccn1 ZINC000567058752 1044540497 /nfs/dbraw/zinc/54/04/97/1044540497.db2.gz CVUKSSWTIJIIMV-LJQANCHMSA-N 1 2 323.465 4.343 20 0 DIADLO COCCCC[N@H+](Cc1csc(Cl)n1)Cc1ccccc1 ZINC000295611350 1044546369 /nfs/dbraw/zinc/54/63/69/1044546369.db2.gz VIZWKAPKSQPBOB-UHFFFAOYSA-N 1 2 324.877 4.225 20 0 DIADLO COCCCC[N@@H+](Cc1csc(Cl)n1)Cc1ccccc1 ZINC000295611350 1044546385 /nfs/dbraw/zinc/54/63/85/1044546385.db2.gz VIZWKAPKSQPBOB-UHFFFAOYSA-N 1 2 324.877 4.225 20 0 DIADLO CCCC[C@H](CCC)C[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000567142184 1044547001 /nfs/dbraw/zinc/54/70/01/1044547001.db2.gz HVHUUNWULCFCSQ-DOTOQJQBSA-N 1 2 300.450 4.090 20 0 DIADLO Cc1cc(OCC(=O)Nc2c(C)cccc2C)c2ccccc2[nH+]1 ZINC000362747562 1044548341 /nfs/dbraw/zinc/54/83/41/1044548341.db2.gz LQGUIPAOKGWBTR-UHFFFAOYSA-N 1 2 320.392 4.178 20 0 DIADLO Clc1cccc2c(N3CCC[C@H](c4ncccn4)C3)cc[nH+]c12 ZINC000884712661 1044551447 /nfs/dbraw/zinc/55/14/47/1044551447.db2.gz XHYIWNWQXKTQAS-ZDUSSCGKSA-N 1 2 324.815 4.062 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2nn(-c3ccccc3)cc21)c1cscn1 ZINC000567250511 1044553477 /nfs/dbraw/zinc/55/34/77/1044553477.db2.gz NBZZLKFCUWPNPK-BBRMVZONSA-N 1 2 324.453 4.057 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc3cc(C)ccc3n1)C2 ZINC001137215754 1044559497 /nfs/dbraw/zinc/55/94/97/1044559497.db2.gz KHPJENBMFWZKNK-UHFFFAOYSA-N 1 2 304.393 4.068 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc3cc(C)ccc3n1)C2 ZINC001137215754 1044559508 /nfs/dbraw/zinc/55/95/08/1044559508.db2.gz KHPJENBMFWZKNK-UHFFFAOYSA-N 1 2 304.393 4.068 20 0 DIADLO CCc1nc(C[N@H+](C)C/C=C\c2ccc(F)c(F)c2)cs1 ZINC000567428687 1044565816 /nfs/dbraw/zinc/56/58/16/1044565816.db2.gz NKUINXWXULMCKS-PLNGDYQASA-N 1 2 308.397 4.129 20 0 DIADLO CCc1nc(C[N@@H+](C)C/C=C\c2ccc(F)c(F)c2)cs1 ZINC000567428687 1044565832 /nfs/dbraw/zinc/56/58/32/1044565832.db2.gz NKUINXWXULMCKS-PLNGDYQASA-N 1 2 308.397 4.129 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@@H](CC)c2cccc(OC)n2)on1 ZINC000925156929 1044565920 /nfs/dbraw/zinc/56/59/20/1044565920.db2.gz PMNICIIHADOUBX-HNNXBMFYSA-N 1 2 317.433 4.223 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+]Cc2cc3cc(F)ccc3o2)[nH]1 ZINC000362932869 1044566727 /nfs/dbraw/zinc/56/67/27/1044566727.db2.gz ZGFDKDJCJWZUBQ-WDEREUQCSA-N 1 2 316.380 4.054 20 0 DIADLO Cc1cc(Cl)nc(C[NH2+][C@@H](C)c2nc3c(s2)CCCC3)c1 ZINC000282937021 1044574154 /nfs/dbraw/zinc/57/41/54/1044574154.db2.gz YQGCECNKOOMLIK-NSHDSACASA-N 1 2 321.877 4.230 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cccc(C4CC4)c3)CCCCC2)no1 ZINC000567602437 1044576900 /nfs/dbraw/zinc/57/69/00/1044576900.db2.gz GIEHTFLTUIIPSN-UHFFFAOYSA-N 1 2 311.429 4.205 20 0 DIADLO CCc1noc(C)c1C[N@@H+]1CCC[C@@H]1c1nc2cc(C)ccc2[nH]1 ZINC000296013780 1044580940 /nfs/dbraw/zinc/58/09/40/1044580940.db2.gz QQCFGBHQWZAFLX-GOSISDBHSA-N 1 2 324.428 4.067 20 0 DIADLO CCc1noc(C)c1C[N@H+]1CCC[C@@H]1c1nc2cc(C)ccc2[nH]1 ZINC000296013780 1044580951 /nfs/dbraw/zinc/58/09/51/1044580951.db2.gz QQCFGBHQWZAFLX-GOSISDBHSA-N 1 2 324.428 4.067 20 0 DIADLO CCc1noc(C)c1C[N@@H+]1CCC[C@@H]1c1nc2ccc(C)cc2[nH]1 ZINC000296013780 1044580967 /nfs/dbraw/zinc/58/09/67/1044580967.db2.gz QQCFGBHQWZAFLX-GOSISDBHSA-N 1 2 324.428 4.067 20 0 DIADLO CCc1noc(C)c1C[N@H+]1CCC[C@@H]1c1nc2ccc(C)cc2[nH]1 ZINC000296013780 1044580981 /nfs/dbraw/zinc/58/09/81/1044580981.db2.gz QQCFGBHQWZAFLX-GOSISDBHSA-N 1 2 324.428 4.067 20 0 DIADLO c1ccc2c(c1)ncnc2Nc1ccc(NC2CCCC2)[nH+]c1 ZINC000523298088 1044584931 /nfs/dbraw/zinc/58/49/31/1044584931.db2.gz JWRWYXYMNHRASJ-UHFFFAOYSA-N 1 2 305.385 4.123 20 0 DIADLO CC(C)C1CCC(N(C)C(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC000567799874 1044585382 /nfs/dbraw/zinc/58/53/82/1044585382.db2.gz JMANRHRBWFDMTE-UHFFFAOYSA-N 1 2 314.433 4.013 20 0 DIADLO c1ccc2nc(Nc3ccc(NC4CCCC4)[nH+]c3)cnc2c1 ZINC000523298210 1044587119 /nfs/dbraw/zinc/58/71/19/1044587119.db2.gz UUGAPBYTTQHKBX-UHFFFAOYSA-N 1 2 305.385 4.123 20 0 DIADLO Oc1cccc2c1CC[N@H+](Cc1ccc3cccc(Cl)c3n1)C2 ZINC001137220331 1044589569 /nfs/dbraw/zinc/58/95/69/1044589569.db2.gz YJLDMUWETOQNHS-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1cccc2c1CC[N@@H+](Cc1ccc3cccc(Cl)c3n1)C2 ZINC001137220331 1044589584 /nfs/dbraw/zinc/58/95/84/1044589584.db2.gz YJLDMUWETOQNHS-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Cc1cnc(C[N@@H+]2CCC[C@@H]2c2ccccc2C(F)(F)F)o1 ZINC000363169057 1044591074 /nfs/dbraw/zinc/59/10/74/1044591074.db2.gz JPTYZJZKEDEDNL-CQSZACIVSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1cnc(C[N@H+]2CCC[C@@H]2c2ccccc2C(F)(F)F)o1 ZINC000363169057 1044591087 /nfs/dbraw/zinc/59/10/87/1044591087.db2.gz JPTYZJZKEDEDNL-CQSZACIVSA-N 1 2 310.319 4.339 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@H](c1ccccc1)c1ccc(F)cc1 ZINC000296135401 1044592140 /nfs/dbraw/zinc/59/21/40/1044592140.db2.gz VYBJBPKRRDKEJA-HNAYVOBHSA-N 1 2 323.415 4.482 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(C)co1)c1nc(C(F)(F)F)cs1 ZINC000886005669 1044599460 /nfs/dbraw/zinc/59/94/60/1044599460.db2.gz HMTLAWWMQFIZRW-JTQLQIEISA-N 1 2 304.337 4.304 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)cs1 ZINC000444689200 1044603844 /nfs/dbraw/zinc/60/38/44/1044603844.db2.gz FMDCIIUUFRISLA-WDEREUQCSA-N 1 2 322.396 4.015 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)cs1 ZINC000444689200 1044603849 /nfs/dbraw/zinc/60/38/49/1044603849.db2.gz FMDCIIUUFRISLA-WDEREUQCSA-N 1 2 322.396 4.015 20 0 DIADLO CCC[C@H]([NH2+]Cc1ncc(C(F)(F)F)cn1)c1ccsc1 ZINC000296304625 1044606079 /nfs/dbraw/zinc/60/60/79/1044606079.db2.gz GBMJSONMCPUZTR-LBPRGKRZSA-N 1 2 315.364 4.188 20 0 DIADLO CC(=O)Nc1cccc(C[N@@H+](C)Cc2cc(Cl)ccc2F)c1 ZINC000444695395 1044606360 /nfs/dbraw/zinc/60/63/60/1044606360.db2.gz RXZJPIWJHRSJKM-UHFFFAOYSA-N 1 2 320.795 4.070 20 0 DIADLO CC(=O)Nc1cccc(C[N@H+](C)Cc2cc(Cl)ccc2F)c1 ZINC000444695395 1044606367 /nfs/dbraw/zinc/60/63/67/1044606367.db2.gz RXZJPIWJHRSJKM-UHFFFAOYSA-N 1 2 320.795 4.070 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2nnc(C(C)C)[nH]2)c2ccccc2)cc1 ZINC000296313066 1044607934 /nfs/dbraw/zinc/60/79/34/1044607934.db2.gz GMMUOWUFVPGQQC-LJQANCHMSA-N 1 2 320.440 4.116 20 0 DIADLO Cc1nc2ccccn2c1C[N@@H+](C)Cc1cc(Cl)ccc1F ZINC000444710439 1044610162 /nfs/dbraw/zinc/61/01/62/1044610162.db2.gz VMULWCREXJUPPB-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1nc2ccccn2c1C[N@H+](C)Cc1cc(Cl)ccc1F ZINC000444710439 1044610178 /nfs/dbraw/zinc/61/01/78/1044610178.db2.gz VMULWCREXJUPPB-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(Cl)c2)C[N@@H+]1C[C@H]1CCC(C)(C)O1 ZINC000444712653 1044611845 /nfs/dbraw/zinc/61/18/45/1044611845.db2.gz WPHHOZMJOJGIAZ-KBRIMQKVSA-N 1 2 323.864 4.059 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(Cl)c2)C[N@H+]1C[C@H]1CCC(C)(C)O1 ZINC000444712653 1044611854 /nfs/dbraw/zinc/61/18/54/1044611854.db2.gz WPHHOZMJOJGIAZ-KBRIMQKVSA-N 1 2 323.864 4.059 20 0 DIADLO COCC[N@H+](Cc1cccs1)Cc1sccc1Cl ZINC000568287342 1044612991 /nfs/dbraw/zinc/61/29/91/1044612991.db2.gz IFKPLVNUCZQDEM-UHFFFAOYSA-N 1 2 301.864 4.112 20 0 DIADLO COCC[N@@H+](Cc1cccs1)Cc1sccc1Cl ZINC000568287342 1044613001 /nfs/dbraw/zinc/61/30/01/1044613001.db2.gz IFKPLVNUCZQDEM-UHFFFAOYSA-N 1 2 301.864 4.112 20 0 DIADLO Cc1cc2cc(C[NH2+][C@H](c3ncc[nH]3)c3ccccc3)ccc2[nH]1 ZINC000353800957 1044613652 /nfs/dbraw/zinc/61/36/52/1044613652.db2.gz BXMHJUDPJZJZJI-IBGZPJMESA-N 1 2 316.408 4.079 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2nnc(C(C)C)s2)c1 ZINC000296402225 1044614271 /nfs/dbraw/zinc/61/42/71/1044614271.db2.gz VWRKERHVJHPVKV-ZDUSSCGKSA-N 1 2 319.474 4.300 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2coc(-c3cccs3)n2)ccc1F ZINC000444728883 1044616014 /nfs/dbraw/zinc/61/60/14/1044616014.db2.gz CLZXLHLFBYVOFY-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2coc(-c3cccs3)n2)ccc1F ZINC000444728883 1044616021 /nfs/dbraw/zinc/61/60/21/1044616021.db2.gz CLZXLHLFBYVOFY-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Clc1cccc2ccc(C[N@@H+]3CCC[C@H]3c3cnccn3)nc12 ZINC001137225984 1044620954 /nfs/dbraw/zinc/62/09/54/1044620954.db2.gz JJKLBWYVHVYUNG-KRWDZBQOSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1cccc2ccc(C[N@H+]3CCC[C@H]3c3cnccn3)nc12 ZINC001137225984 1044620956 /nfs/dbraw/zinc/62/09/56/1044620956.db2.gz JJKLBWYVHVYUNG-KRWDZBQOSA-N 1 2 324.815 4.015 20 0 DIADLO Cc1cn2cc(NC(=O)c3cccc4ccccc43)ccc2[nH+]1 ZINC000523382516 1044622942 /nfs/dbraw/zinc/62/29/42/1044622942.db2.gz LFSBALLAQJLMEH-UHFFFAOYSA-N 1 2 301.349 4.048 20 0 DIADLO Fc1ccccc1[C@H]1C[N@H+](Cc2ccc3occc3c2)CCO1 ZINC000568447190 1044625407 /nfs/dbraw/zinc/62/54/07/1044625407.db2.gz HOBPEYXHFXYRGQ-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccccc1[C@H]1C[N@@H+](Cc2ccc3occc3c2)CCO1 ZINC000568447190 1044625417 /nfs/dbraw/zinc/62/54/17/1044625417.db2.gz HOBPEYXHFXYRGQ-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO Cn1cccc1C(=O)C[N@@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000444804148 1044628143 /nfs/dbraw/zinc/62/81/43/1044628143.db2.gz OZFMBOZMEJXXDA-INIZCTEOSA-N 1 2 316.832 4.088 20 0 DIADLO Cn1cccc1C(=O)C[N@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000444804148 1044628148 /nfs/dbraw/zinc/62/81/48/1044628148.db2.gz OZFMBOZMEJXXDA-INIZCTEOSA-N 1 2 316.832 4.088 20 0 DIADLO Cn1cccc1C(=O)C[N@@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000444804149 1044628219 /nfs/dbraw/zinc/62/82/19/1044628219.db2.gz OZFMBOZMEJXXDA-MRXNPFEDSA-N 1 2 316.832 4.088 20 0 DIADLO Cn1cccc1C(=O)C[N@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000444804149 1044628226 /nfs/dbraw/zinc/62/82/26/1044628226.db2.gz OZFMBOZMEJXXDA-MRXNPFEDSA-N 1 2 316.832 4.088 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1ccsc1 ZINC000296609715 1044634087 /nfs/dbraw/zinc/63/40/87/1044634087.db2.gz YKIQMQTVUZKNEO-HNNXBMFYSA-N 1 2 308.447 4.292 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000523443939 1044637534 /nfs/dbraw/zinc/63/75/34/1044637534.db2.gz KABNUULREZYQTK-CMPLNLGQSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000523443939 1044637527 /nfs/dbraw/zinc/63/75/27/1044637527.db2.gz KABNUULREZYQTK-CMPLNLGQSA-N 1 2 323.305 4.069 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@@H]1CCCc2c3cccc(Cl)c3[nH]c21 ZINC000886550413 1044657818 /nfs/dbraw/zinc/65/78/18/1044657818.db2.gz ZKMUXWKVAOJGMJ-OAHLLOKOSA-N 1 2 314.820 4.020 20 0 DIADLO Clc1cccc(C[NH+]2CC3(C2)CCCC3)c1Br ZINC000719574580 1044664399 /nfs/dbraw/zinc/66/43/99/1044664399.db2.gz ZHLFWGJJYBGPRE-UHFFFAOYSA-N 1 2 314.654 4.479 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000364642411 1044672303 /nfs/dbraw/zinc/67/23/03/1044672303.db2.gz RCVDWXOXUSQKQU-QAPCUYQASA-N 1 2 305.466 4.112 20 0 DIADLO C[C@H]([NH2+]Cc1ccc2c(n1)CCC2)c1c(F)cccc1Cl ZINC000569077930 1044674190 /nfs/dbraw/zinc/67/41/90/1044674190.db2.gz AJPGKXQHLALOMK-NSHDSACASA-N 1 2 304.796 4.214 20 0 DIADLO Cc1[nH]c(CN[C@H](C)c2nc(-c3ccccc3)cs2)[nH+]c1C ZINC000569120989 1044676157 /nfs/dbraw/zinc/67/61/57/1044676157.db2.gz YEHUMKLHZDSISA-CYBMUJFWSA-N 1 2 312.442 4.001 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1cc(C2CC2)no1 ZINC000886682855 1044680439 /nfs/dbraw/zinc/68/04/39/1044680439.db2.gz QJGHZYSOQSYDLK-NSHDSACASA-N 1 2 320.820 4.455 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2ccc([C@@H]3C[C@H]3C)o2)c(C)[nH+]1 ZINC000569201039 1044683742 /nfs/dbraw/zinc/68/37/42/1044683742.db2.gz LKSAQSAGPVSOHP-MEBBXXQBSA-N 1 2 313.401 4.045 20 0 DIADLO O=C(Nc1ccc(C2CCC2)cc1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000365343070 1044687170 /nfs/dbraw/zinc/68/71/70/1044687170.db2.gz KAIQGIPZKSHDHB-UHFFFAOYSA-N 1 2 324.428 4.089 20 0 DIADLO O=C(Nc1ccc(C2CCC2)cc1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000365343070 1044687175 /nfs/dbraw/zinc/68/71/75/1044687175.db2.gz KAIQGIPZKSHDHB-UHFFFAOYSA-N 1 2 324.428 4.089 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1cnccn1 ZINC000445227255 1044688984 /nfs/dbraw/zinc/68/89/84/1044688984.db2.gz FWMSXMWFISEQRI-HNNXBMFYSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1cnccn1 ZINC000445227255 1044688994 /nfs/dbraw/zinc/68/89/94/1044688994.db2.gz FWMSXMWFISEQRI-HNNXBMFYSA-N 1 2 310.228 4.367 20 0 DIADLO Cc1cnc2c(c1)C[N@@H+](Cc1ccc3cccc(Cl)c3n1)CC2 ZINC001137230162 1044695199 /nfs/dbraw/zinc/69/51/99/1044695199.db2.gz KAONTNDQEAFQSK-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1cnc2c(c1)C[N@H+](Cc1ccc3cccc(Cl)c3n1)CC2 ZINC001137230162 1044695204 /nfs/dbraw/zinc/69/52/04/1044695204.db2.gz KAONTNDQEAFQSK-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Fc1cc(NCc2cccc3cc[nH]c32)ccc1-n1cc[nH+]c1 ZINC000355490704 1044698847 /nfs/dbraw/zinc/69/88/47/1044698847.db2.gz KLYYRLBAQKJBRQ-UHFFFAOYSA-N 1 2 306.344 4.105 20 0 DIADLO Cc1cccc(C[NH2+][C@H](CO)c2c(Cl)cccc2Cl)c1 ZINC000475625289 1044699001 /nfs/dbraw/zinc/69/90/01/1044699001.db2.gz LJTOTXBBSNGETC-OAHLLOKOSA-N 1 2 310.224 4.125 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1ccc(OC(F)F)cc1 ZINC000078668392 1044709416 /nfs/dbraw/zinc/70/94/16/1044709416.db2.gz HNRHDYCUNBEYLR-UHFFFAOYSA-N 1 2 318.776 4.030 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1ccc(OC(F)F)cc1 ZINC000078668392 1044709433 /nfs/dbraw/zinc/70/94/33/1044709433.db2.gz HNRHDYCUNBEYLR-UHFFFAOYSA-N 1 2 318.776 4.030 20 0 DIADLO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000366097585 1044710446 /nfs/dbraw/zinc/71/04/46/1044710446.db2.gz UWMQSJXRWXYLMY-CQSZACIVSA-N 1 2 316.470 4.362 20 0 DIADLO CCCCC[N@H+](Cc1cc(C(C)=O)no1)Cc1ccc(F)cc1 ZINC000569821708 1044714306 /nfs/dbraw/zinc/71/43/06/1044714306.db2.gz BRVMLZIDNFCUQQ-UHFFFAOYSA-N 1 2 318.392 4.209 20 0 DIADLO CCCCC[N@@H+](Cc1cc(C(C)=O)no1)Cc1ccc(F)cc1 ZINC000569821708 1044714321 /nfs/dbraw/zinc/71/43/21/1044714321.db2.gz BRVMLZIDNFCUQQ-UHFFFAOYSA-N 1 2 318.392 4.209 20 0 DIADLO Fc1ccc(-c2cnc(C[N@@H+]3CCCc4occc4C3)o2)cc1 ZINC000569850218 1044717185 /nfs/dbraw/zinc/71/71/85/1044717185.db2.gz ODHXDEHSCRAPEQ-UHFFFAOYSA-N 1 2 312.344 4.022 20 0 DIADLO Fc1ccc(-c2cnc(C[N@H+]3CCCc4occc4C3)o2)cc1 ZINC000569850218 1044717193 /nfs/dbraw/zinc/71/71/93/1044717193.db2.gz ODHXDEHSCRAPEQ-UHFFFAOYSA-N 1 2 312.344 4.022 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](CC)c2cccc3ccccc32)no1 ZINC000886917455 1044717358 /nfs/dbraw/zinc/71/73/58/1044717358.db2.gz AKLHXKXTOSVYET-KRWDZBQOSA-N 1 2 309.413 4.416 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2c1cccc2F)c1ncc(C(C)(C)C)o1 ZINC000886922124 1044719174 /nfs/dbraw/zinc/71/91/74/1044719174.db2.gz STSKGKSPLOJBJN-NHYWBVRUSA-N 1 2 302.393 4.449 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cccc2cc[nH]c21 ZINC000366546001 1044723952 /nfs/dbraw/zinc/72/39/52/1044723952.db2.gz OOROLSJHYRXQKK-UHFFFAOYSA-N 1 2 316.364 4.119 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(F)cc2Br)CCC1(F)F ZINC000570032921 1044727876 /nfs/dbraw/zinc/72/78/76/1044727876.db2.gz CYUOFUGSMLQLMO-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(F)cc2Br)CCC1(F)F ZINC000570032921 1044727887 /nfs/dbraw/zinc/72/78/87/1044727887.db2.gz CYUOFUGSMLQLMO-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)[C@H](C)CO1 ZINC000570149269 1044735567 /nfs/dbraw/zinc/73/55/67/1044735567.db2.gz WXOMVNXSPZJGRH-VXGBXAGGSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)[C@H](C)CO1 ZINC000570149269 1044735584 /nfs/dbraw/zinc/73/55/84/1044735584.db2.gz WXOMVNXSPZJGRH-VXGBXAGGSA-N 1 2 322.861 4.073 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)s1 ZINC000367299279 1044736109 /nfs/dbraw/zinc/73/61/09/1044736109.db2.gz OTDXMWJSADRQNR-LLVKDONJSA-N 1 2 319.861 4.350 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)s1 ZINC000367299279 1044736091 /nfs/dbraw/zinc/73/60/91/1044736091.db2.gz OTDXMWJSADRQNR-LLVKDONJSA-N 1 2 319.861 4.350 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2cn3ccccc3n2)C2CC2)o1 ZINC000524143090 1044747364 /nfs/dbraw/zinc/74/73/64/1044747364.db2.gz HPNFDGIPUDAXNV-KBXCAEBGSA-N 1 2 321.424 4.215 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cn3ccccc3n2)C2CC2)o1 ZINC000524143090 1044747376 /nfs/dbraw/zinc/74/73/76/1044747376.db2.gz HPNFDGIPUDAXNV-KBXCAEBGSA-N 1 2 321.424 4.215 20 0 DIADLO C[N@H+](Cc1ccc(C(F)(F)F)cc1)Cc1cnccc1Cl ZINC001137238123 1044753753 /nfs/dbraw/zinc/75/37/53/1044753753.db2.gz ORVBEENOSDJYDY-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cc1cnccc1Cl ZINC001137238123 1044753767 /nfs/dbraw/zinc/75/37/67/1044753767.db2.gz ORVBEENOSDJYDY-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2Cc3ccccc3OC3(CCC3)C2)o1 ZINC000887150853 1044755541 /nfs/dbraw/zinc/75/55/41/1044755541.db2.gz AFNRDXDGNSWPJL-UHFFFAOYSA-N 1 2 312.413 4.115 20 0 DIADLO CC(C)c1cnc(C[N@H+]2Cc3ccccc3OC3(CCC3)C2)o1 ZINC000887150853 1044755549 /nfs/dbraw/zinc/75/55/49/1044755549.db2.gz AFNRDXDGNSWPJL-UHFFFAOYSA-N 1 2 312.413 4.115 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1nccn1Cc1ccccc1 ZINC000524164966 1044757360 /nfs/dbraw/zinc/75/73/60/1044757360.db2.gz FZHDPVSTJUPOKZ-INIZCTEOSA-N 1 2 323.415 4.264 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1nccn1Cc1ccccc1 ZINC000524164966 1044757376 /nfs/dbraw/zinc/75/73/76/1044757376.db2.gz FZHDPVSTJUPOKZ-INIZCTEOSA-N 1 2 323.415 4.264 20 0 DIADLO O=C(C[C@H]1CCC[N@H+]1Cc1cccc(Cl)n1)c1cccs1 ZINC000121771094 1044765421 /nfs/dbraw/zinc/76/54/21/1044765421.db2.gz OZMYICGMEOIFQN-CYBMUJFWSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@H]1CCC[N@@H+]1Cc1cccc(Cl)n1)c1cccs1 ZINC000121771094 1044765437 /nfs/dbraw/zinc/76/54/37/1044765437.db2.gz OZMYICGMEOIFQN-CYBMUJFWSA-N 1 2 320.845 4.034 20 0 DIADLO COCC[N@H+](Cc1cc(C(C)(C)C)on1)[C@H](C)c1ccccc1 ZINC000570609364 1044768444 /nfs/dbraw/zinc/76/84/44/1044768444.db2.gz XSPCBZNOQZANIF-OAHLLOKOSA-N 1 2 316.445 4.182 20 0 DIADLO COCC[N@@H+](Cc1cc(C(C)(C)C)on1)[C@H](C)c1ccccc1 ZINC000570609364 1044768458 /nfs/dbraw/zinc/76/84/58/1044768458.db2.gz XSPCBZNOQZANIF-OAHLLOKOSA-N 1 2 316.445 4.182 20 0 DIADLO Cc1nnc(C[N@@H+]([C@H](C)c2ccc3ccccc3c2)C2CC2)n1C ZINC000122007080 1044769669 /nfs/dbraw/zinc/76/96/69/1044769669.db2.gz URHPGHDAYXJVSS-CQSZACIVSA-N 1 2 320.440 4.002 20 0 DIADLO Cc1nnc(C[N@H+]([C@H](C)c2ccc3ccccc3c2)C2CC2)n1C ZINC000122007080 1044769681 /nfs/dbraw/zinc/76/96/81/1044769681.db2.gz URHPGHDAYXJVSS-CQSZACIVSA-N 1 2 320.440 4.002 20 0 DIADLO c1n[nH]c2c1[C@@H]([NH2+][C@@H](Cc1ccccc1)c1ccccc1)CCC2 ZINC000368608585 1044783330 /nfs/dbraw/zinc/78/33/30/1044783330.db2.gz QAPTVNSZOKXEKZ-FPOVZHCZSA-N 1 2 317.436 4.361 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)nc2ccccc12 ZINC000570828654 1044785763 /nfs/dbraw/zinc/78/57/63/1044785763.db2.gz WUWPHLMRBNGUQA-FQEVSTJZSA-N 1 2 321.399 4.009 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@@](F)(c3ccccc3)C2)nc2ccccc12 ZINC000570828654 1044785772 /nfs/dbraw/zinc/78/57/72/1044785772.db2.gz WUWPHLMRBNGUQA-FQEVSTJZSA-N 1 2 321.399 4.009 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(Cc3ccccc3)n2)CCC1(F)F ZINC000571007994 1044794697 /nfs/dbraw/zinc/79/46/97/1044794697.db2.gz GPOIBJXFBLWKNT-ZDUSSCGKSA-N 1 2 322.424 4.211 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(Cc3ccccc3)n2)CCC1(F)F ZINC000571007994 1044794707 /nfs/dbraw/zinc/79/47/07/1044794707.db2.gz GPOIBJXFBLWKNT-ZDUSSCGKSA-N 1 2 322.424 4.211 20 0 DIADLO C[C@H]([NH2+][C@@H](CO)c1c(Cl)cccc1Cl)c1ccccc1 ZINC000475633184 1044797579 /nfs/dbraw/zinc/79/75/79/1044797579.db2.gz GBDCVLAVUNEUQT-NHYWBVRUSA-N 1 2 310.224 4.378 20 0 DIADLO Cc1cc(C)cc(N(C)Cc2c[nH+]cn2Cc2ccccc2)c1 ZINC000445798813 1044831153 /nfs/dbraw/zinc/83/11/53/1044831153.db2.gz KEHBYTOJAXMGEC-UHFFFAOYSA-N 1 2 305.425 4.185 20 0 DIADLO c1nc2c(s1)C[N@H+](Cc1ccccc1Oc1ccccc1)CC2 ZINC000445858072 1044834487 /nfs/dbraw/zinc/83/44/87/1044834487.db2.gz STLONDGTUNCOPZ-UHFFFAOYSA-N 1 2 322.433 4.494 20 0 DIADLO c1nc2c(s1)C[N@@H+](Cc1ccccc1Oc1ccccc1)CC2 ZINC000445858072 1044834511 /nfs/dbraw/zinc/83/45/11/1044834511.db2.gz STLONDGTUNCOPZ-UHFFFAOYSA-N 1 2 322.433 4.494 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](Cc1nccn1CC(F)(F)F)C1CC1 ZINC000264118301 1044851383 /nfs/dbraw/zinc/85/13/83/1044851383.db2.gz UYZITISOCMXDTL-ZDUSSCGKSA-N 1 2 323.362 4.171 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](Cc1nccn1CC(F)(F)F)C1CC1 ZINC000264118301 1044851400 /nfs/dbraw/zinc/85/14/00/1044851400.db2.gz UYZITISOCMXDTL-ZDUSSCGKSA-N 1 2 323.362 4.171 20 0 DIADLO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2ncc(C3CC3)o2)cc1 ZINC000371183976 1044864085 /nfs/dbraw/zinc/86/40/85/1044864085.db2.gz LPWMJHIYGPTYNY-QGZVFWFLSA-N 1 2 312.413 4.288 20 0 DIADLO CCOc1ccc([C@H]2CCC[N@H+]2Cc2ncc(C3CC3)o2)cc1 ZINC000371183976 1044864109 /nfs/dbraw/zinc/86/41/09/1044864109.db2.gz LPWMJHIYGPTYNY-QGZVFWFLSA-N 1 2 312.413 4.288 20 0 DIADLO CC(C)c1csc(C[NH2+][C@H](C)c2cnn(C3CCCC3)c2)n1 ZINC000337495657 1044909490 /nfs/dbraw/zinc/90/94/90/1044909490.db2.gz YFAYVAIBWPRMGY-CYBMUJFWSA-N 1 2 318.490 4.429 20 0 DIADLO Fc1cccc(C=C2CC[NH+](Cc3cn4ccccc4n3)CC2)c1 ZINC000573764449 1044920947 /nfs/dbraw/zinc/92/09/47/1044920947.db2.gz WRYNBDJBXPWEIC-UHFFFAOYSA-N 1 2 321.399 4.153 20 0 DIADLO CC(C)c1nc(C[N@H+](C)C[C@H]2OCCc3ccccc32)cs1 ZINC000337646732 1044935258 /nfs/dbraw/zinc/93/52/58/1044935258.db2.gz IXTAIIVUBBPNED-QGZVFWFLSA-N 1 2 316.470 4.012 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)C[C@H]2OCCc3ccccc32)cs1 ZINC000337646732 1044935264 /nfs/dbraw/zinc/93/52/64/1044935264.db2.gz IXTAIIVUBBPNED-QGZVFWFLSA-N 1 2 316.470 4.012 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cscc1Br ZINC000574235369 1044946439 /nfs/dbraw/zinc/94/64/39/1044946439.db2.gz LFHBWKBRMLWUIK-LKFCYVNXSA-N 1 2 324.243 4.122 20 0 DIADLO Fc1ccc(C[NH+]2CC3(CCC3(F)F)C2)c(C(F)(F)F)c1 ZINC000574327650 1044948735 /nfs/dbraw/zinc/94/87/35/1044948735.db2.gz KRUBSRWLZPHDQU-UHFFFAOYSA-N 1 2 309.253 4.076 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2nc(-c3ccccc3)c[nH]2)o1 ZINC000574361630 1044950135 /nfs/dbraw/zinc/95/01/35/1044950135.db2.gz QGOIJKRRUGMQGN-CZUORRHYSA-N 1 2 307.397 4.083 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(-c2ccccc2)s1)c1ccncc1F ZINC000337947314 1044967780 /nfs/dbraw/zinc/96/77/80/1044967780.db2.gz QLHZHMVQBSIASD-GFCCVEGCSA-N 1 2 313.401 4.195 20 0 DIADLO CSc1ccc(C[N@H+](C)Cc2nc3c(s2)CCCC3)s1 ZINC000574732255 1044969135 /nfs/dbraw/zinc/96/91/35/1044969135.db2.gz NRDYWTUOAGYROL-UHFFFAOYSA-N 1 2 324.540 4.437 20 0 DIADLO CSc1ccc(C[N@@H+](C)Cc2nc3c(s2)CCCC3)s1 ZINC000574732255 1044969143 /nfs/dbraw/zinc/96/91/43/1044969143.db2.gz NRDYWTUOAGYROL-UHFFFAOYSA-N 1 2 324.540 4.437 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1ccc2c(c1)CCC(=O)N2C ZINC001213132569 1044985988 /nfs/dbraw/zinc/98/59/88/1044985988.db2.gz JYZVVZWQOWZVHF-UHFFFAOYSA-N 1 2 309.413 4.166 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](Cc2ccccc2Cl)CCO1 ZINC000525122937 1044987365 /nfs/dbraw/zinc/98/73/65/1044987365.db2.gz RCESMQPSGPBCSR-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2ccccc2Cl)CCO1 ZINC000525122937 1044987373 /nfs/dbraw/zinc/98/73/73/1044987373.db2.gz RCESMQPSGPBCSR-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO c1ccc(-c2nc(C[N@@H+]3CCCC[C@@H]3c3ccccc3)no2)cc1 ZINC000575172612 1044989970 /nfs/dbraw/zinc/98/99/70/1044989970.db2.gz SQIAOQYEIBKXBK-GOSISDBHSA-N 1 2 319.408 4.464 20 0 DIADLO c1ccc(-c2nc(C[N@H+]3CCCC[C@@H]3c3ccccc3)no2)cc1 ZINC000575172612 1044989980 /nfs/dbraw/zinc/98/99/80/1044989980.db2.gz SQIAOQYEIBKXBK-GOSISDBHSA-N 1 2 319.408 4.464 20 0 DIADLO C/C=C/c1ccc(NC(=O)[C@H]2CCc3[nH+]c(C(C)C)[nH]c3C2)cc1 ZINC000575210095 1044990065 /nfs/dbraw/zinc/99/00/65/1044990065.db2.gz UZJOFRHYYPIJQW-RGDDUWESSA-N 1 2 323.440 4.310 20 0 DIADLO CC=Cc1ccc(NC(=O)[C@H]2CCc3[nH]c(C(C)C)[nH+]c3C2)cc1 ZINC000575210095 1044990079 /nfs/dbraw/zinc/99/00/79/1044990079.db2.gz UZJOFRHYYPIJQW-RGDDUWESSA-N 1 2 323.440 4.310 20 0 DIADLO CCCC[N@H+](Cc1cnc(Cl)cn1)Cc1ccccc1F ZINC000799120660 1044996683 /nfs/dbraw/zinc/99/66/83/1044996683.db2.gz YXVIUBRBDAXEAK-UHFFFAOYSA-N 1 2 307.800 4.071 20 0 DIADLO CCCC[N@@H+](Cc1cnc(Cl)cn1)Cc1ccccc1F ZINC000799120660 1044996692 /nfs/dbraw/zinc/99/66/92/1044996692.db2.gz YXVIUBRBDAXEAK-UHFFFAOYSA-N 1 2 307.800 4.071 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cccn1C(C)C ZINC000373700473 1045003336 /nfs/dbraw/zinc/00/33/36/1045003336.db2.gz ZPOXJHZKUJXCKX-UHFFFAOYSA-N 1 2 308.385 4.020 20 0 DIADLO CCOc1cccc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1 ZINC000373704686 1045003437 /nfs/dbraw/zinc/00/34/37/1045003437.db2.gz FNVNNTRBXLWGNN-UHFFFAOYSA-N 1 2 321.380 4.036 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cc2sccc2[nH]1 ZINC000373700688 1045003567 /nfs/dbraw/zinc/00/35/67/1045003567.db2.gz JHWIYMVCSOGUNM-UHFFFAOYSA-N 1 2 322.393 4.180 20 0 DIADLO Cc1cc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)ccc1F ZINC000373704255 1045004198 /nfs/dbraw/zinc/00/41/98/1045004198.db2.gz BUHBEAORDVAVLH-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO Fc1c(Cl)cccc1C[NH2+]C1(c2nccs2)CCCC1 ZINC000150923471 1045010671 /nfs/dbraw/zinc/01/06/71/1045010671.db2.gz MWWFJACCPOKZKM-UHFFFAOYSA-N 1 2 310.825 4.495 20 0 DIADLO COc1cc(C)[nH+]c(CN[C@@H](c2cccc(C)c2)C(F)(F)F)c1 ZINC000411499369 1045012750 /nfs/dbraw/zinc/01/27/50/1045012750.db2.gz CQXONXLCCQIUSA-INIZCTEOSA-N 1 2 324.346 4.100 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+][C@@H]2CCOc3c(F)cccc32)s1 ZINC000373845977 1045015105 /nfs/dbraw/zinc/01/51/05/1045015105.db2.gz RHYKJSSXFNWDTM-CYBMUJFWSA-N 1 2 320.433 4.193 20 0 DIADLO COC(=O)c1sccc1C[N@@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000446779878 1045040892 /nfs/dbraw/zinc/04/08/92/1045040892.db2.gz DDXACYXTDIZSJI-TZMCWYRMSA-N 1 2 319.426 4.101 20 0 DIADLO COC(=O)c1sccc1C[N@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000446779878 1045040905 /nfs/dbraw/zinc/04/09/05/1045040905.db2.gz DDXACYXTDIZSJI-TZMCWYRMSA-N 1 2 319.426 4.101 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccc(F)cc1OC(F)F ZINC000576242407 1045045219 /nfs/dbraw/zinc/04/52/19/1045045219.db2.gz YKWVRBIZHHRPTE-BDAKNGLRSA-N 1 2 316.348 4.295 20 0 DIADLO CCc1nc(C[N@H+](C)[C@H]2CCCc3nc(CC)sc32)cs1 ZINC000152724313 1045045556 /nfs/dbraw/zinc/04/55/56/1045045556.db2.gz ADVYHIZRKJQCSW-ZDUSSCGKSA-N 1 2 321.515 4.234 20 0 DIADLO CCc1nc(C[N@@H+](C)[C@H]2CCCc3nc(CC)sc32)cs1 ZINC000152724313 1045045572 /nfs/dbraw/zinc/04/55/72/1045045572.db2.gz ADVYHIZRKJQCSW-ZDUSSCGKSA-N 1 2 321.515 4.234 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1cccnc1Cl)CCC2 ZINC000152734922 1045045973 /nfs/dbraw/zinc/04/59/73/1045045973.db2.gz GYYVUBSSPXYATN-CYBMUJFWSA-N 1 2 321.877 4.263 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1cccnc1Cl)CCC2 ZINC000152734922 1045045982 /nfs/dbraw/zinc/04/59/82/1045045982.db2.gz GYYVUBSSPXYATN-CYBMUJFWSA-N 1 2 321.877 4.263 20 0 DIADLO CC[N@H+](Cc1occc1C)[C@@H](C)c1nc(-c2cccs2)no1 ZINC000412025514 1045048719 /nfs/dbraw/zinc/04/87/19/1045048719.db2.gz IXUNPMNVYSILNW-LBPRGKRZSA-N 1 2 317.414 4.283 20 0 DIADLO CC[N@@H+](Cc1occc1C)[C@@H](C)c1nc(-c2cccs2)no1 ZINC000412025514 1045048731 /nfs/dbraw/zinc/04/87/31/1045048731.db2.gz IXUNPMNVYSILNW-LBPRGKRZSA-N 1 2 317.414 4.283 20 0 DIADLO CC[N@@H+](Cc1csc(-c2ccoc2)n1)Cc1occc1C ZINC000412026600 1045048996 /nfs/dbraw/zinc/04/89/96/1045048996.db2.gz MFUMXLYICCIEBE-UHFFFAOYSA-N 1 2 302.399 4.327 20 0 DIADLO CC[N@H+](Cc1csc(-c2ccoc2)n1)Cc1occc1C ZINC000412026600 1045049003 /nfs/dbraw/zinc/04/90/03/1045049003.db2.gz MFUMXLYICCIEBE-UHFFFAOYSA-N 1 2 302.399 4.327 20 0 DIADLO CC[N@H+](Cc1occc1C)[C@@H](C)c1nc(-c2ccccc2)no1 ZINC000412044547 1045051910 /nfs/dbraw/zinc/05/19/10/1045051910.db2.gz QRTWYBDJCMJLBD-AWEZNQCLSA-N 1 2 311.385 4.221 20 0 DIADLO CC[N@@H+](Cc1occc1C)[C@@H](C)c1nc(-c2ccccc2)no1 ZINC000412044547 1045051925 /nfs/dbraw/zinc/05/19/25/1045051925.db2.gz QRTWYBDJCMJLBD-AWEZNQCLSA-N 1 2 311.385 4.221 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(C2CCCCC2)cc1)c1csnn1 ZINC000412047944 1045052331 /nfs/dbraw/zinc/05/23/31/1045052331.db2.gz WLVBQXMYZJIEJD-ZDUSSCGKSA-N 1 2 301.459 4.437 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(OC(F)F)c(Cl)c1)c1cscn1 ZINC000576360226 1045053614 /nfs/dbraw/zinc/05/36/14/1045053614.db2.gz JYCCHHKUXAIZMV-MRVPVSSYSA-N 1 2 318.776 4.249 20 0 DIADLO CC(C)(C)OCC[N@@H+]1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000576572998 1045066795 /nfs/dbraw/zinc/06/67/95/1045066795.db2.gz DKJMYOBTXZIALM-HNNXBMFYSA-N 1 2 321.852 4.168 20 0 DIADLO CC(C)(C)OCC[N@H+]1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000576572998 1045066810 /nfs/dbraw/zinc/06/68/10/1045066810.db2.gz DKJMYOBTXZIALM-HNNXBMFYSA-N 1 2 321.852 4.168 20 0 DIADLO CCSCc1cc[nH+]c(NCc2ccc(C)c(OC)c2)c1 ZINC000446962759 1045076518 /nfs/dbraw/zinc/07/65/18/1045076518.db2.gz PFFMFBOIKRVXNW-UHFFFAOYSA-N 1 2 302.443 4.264 20 0 DIADLO C[N@H+](Cc1cnn(C(C)(C)C)c1)Cc1cc(Cl)ccc1F ZINC000446977058 1045080214 /nfs/dbraw/zinc/08/02/14/1045080214.db2.gz ZYOSLYYBKDKZHW-UHFFFAOYSA-N 1 2 309.816 4.063 20 0 DIADLO C[N@@H+](Cc1cnn(C(C)(C)C)c1)Cc1cc(Cl)ccc1F ZINC000446977058 1045080227 /nfs/dbraw/zinc/08/02/27/1045080227.db2.gz ZYOSLYYBKDKZHW-UHFFFAOYSA-N 1 2 309.816 4.063 20 0 DIADLO CCS[C@H]1CCCC[N@H+](Cc2noc(C3CCCCC3)n2)C1 ZINC000447041664 1045086148 /nfs/dbraw/zinc/08/61/48/1045086148.db2.gz ORIXVALJKALUBO-HNNXBMFYSA-N 1 2 323.506 4.225 20 0 DIADLO CCS[C@H]1CCCC[N@@H+](Cc2noc(C3CCCCC3)n2)C1 ZINC000447041664 1045086160 /nfs/dbraw/zinc/08/61/60/1045086160.db2.gz ORIXVALJKALUBO-HNNXBMFYSA-N 1 2 323.506 4.225 20 0 DIADLO CCn1nccc1C[NH2+]C1(c2c(Cl)cccc2Cl)CCC1 ZINC000447055520 1045089295 /nfs/dbraw/zinc/08/92/95/1045089295.db2.gz UUFLTCMGRUZKOH-UHFFFAOYSA-N 1 2 324.255 4.379 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cc(C(C)(C)C)n[nH]2)cc1Cl ZINC000447073873 1045094167 /nfs/dbraw/zinc/09/41/67/1045094167.db2.gz ZXDRUHVKJVVDFG-UHFFFAOYSA-N 1 2 321.852 4.001 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cc(C(C)(C)C)n[nH]2)cc1Cl ZINC000447073873 1045094187 /nfs/dbraw/zinc/09/41/87/1045094187.db2.gz ZXDRUHVKJVVDFG-UHFFFAOYSA-N 1 2 321.852 4.001 20 0 DIADLO CCCn1ncnc1C[N@@H+]1CCC[C@H]1c1ccc(C(C)C)cc1 ZINC000577144424 1045102731 /nfs/dbraw/zinc/10/27/31/1045102731.db2.gz ZPQPPEQPOSXLPU-SFHVURJKSA-N 1 2 312.461 4.149 20 0 DIADLO CCCn1ncnc1C[N@H+]1CCC[C@H]1c1ccc(C(C)C)cc1 ZINC000577144424 1045102738 /nfs/dbraw/zinc/10/27/38/1045102738.db2.gz ZPQPPEQPOSXLPU-SFHVURJKSA-N 1 2 312.461 4.149 20 0 DIADLO Cc1ccc([C@H](C)N(C)C(=O)Nc2ccn3cc[nH+]c3c2)c(C)c1 ZINC000577151559 1045105409 /nfs/dbraw/zinc/10/54/09/1045105409.db2.gz GKLRWCYEUMVKSM-HNNXBMFYSA-N 1 2 322.412 4.176 20 0 DIADLO CCCC[C@H](CC)C(=O)Nc1nc(C[NH+](CC)CC)cs1 ZINC000890223585 1045105362 /nfs/dbraw/zinc/10/53/62/1045105362.db2.gz LFSOEAGMRXQQTC-ZDUSSCGKSA-N 1 2 311.495 4.140 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1ccsc1C(=O)OC ZINC000447378609 1045126009 /nfs/dbraw/zinc/12/60/09/1045126009.db2.gz DJQQZSNPHKJNJY-CYBMUJFWSA-N 1 2 321.467 4.106 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccsc1C(=O)OC ZINC000447378609 1045126013 /nfs/dbraw/zinc/12/60/13/1045126013.db2.gz DJQQZSNPHKJNJY-CYBMUJFWSA-N 1 2 321.467 4.106 20 0 DIADLO CCc1nc(C)c(C[N@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)o1 ZINC000428484366 1045131864 /nfs/dbraw/zinc/13/18/64/1045131864.db2.gz LZNBFNGSYOXUEH-WBMJQRKESA-N 1 2 314.429 4.426 20 0 DIADLO CCc1nc(C)c(C[N@@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)o1 ZINC000428484366 1045131870 /nfs/dbraw/zinc/13/18/70/1045131870.db2.gz LZNBFNGSYOXUEH-WBMJQRKESA-N 1 2 314.429 4.426 20 0 DIADLO c1ccc(N2Cc3cccc(N[C@H]4CC[C@@H]4C4CC4)c3C2)[nH+]c1 ZINC000577525932 1045133698 /nfs/dbraw/zinc/13/36/98/1045133698.db2.gz WZVHKHMAYLRHFT-APWZRJJASA-N 1 2 305.425 4.202 20 0 DIADLO Cc1cc(F)ccc1-c1noc([C@@H](CC(C)C)n2cc[nH+]c2)n1 ZINC000923881357 1045144207 /nfs/dbraw/zinc/14/42/07/1045144207.db2.gz MSLRUCBGYBIXDM-OAHLLOKOSA-N 1 2 314.364 4.016 20 0 DIADLO Cc1cccc([C@@H](c2noc([C@@H]3C[C@H]3c3c[nH]c[nH+]3)n2)C(C)C)c1 ZINC000924067534 1045146667 /nfs/dbraw/zinc/14/66/67/1045146667.db2.gz BYPCKRQDNKQJNQ-INMHGKMJSA-N 1 2 322.412 4.160 20 0 DIADLO CSCCc1ccccc1NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000600858321 1045151060 /nfs/dbraw/zinc/15/10/60/1045151060.db2.gz NPPKJXKISBDUJA-UHFFFAOYSA-N 1 2 323.465 4.390 20 0 DIADLO Cc1ccccc1[C@H]([C@@H](C)N[C@@H]1CCCc2occc21)[NH+](C)C ZINC000447593661 1045155525 /nfs/dbraw/zinc/15/55/25/1045155525.db2.gz UHLXRAXLNGBTBK-ZTNFWEORSA-N 1 2 312.457 4.246 20 0 DIADLO C=Cn1cc(C[N@H+](Cc2ccccc2)Cc2ccccc2F)cn1 ZINC000447744047 1045172195 /nfs/dbraw/zinc/17/21/95/1045172195.db2.gz WQRASDCQTMHZEO-UHFFFAOYSA-N 1 2 321.399 4.325 20 0 DIADLO C=Cn1cc(C[N@@H+](Cc2ccccc2)Cc2ccccc2F)cn1 ZINC000447744047 1045172201 /nfs/dbraw/zinc/17/22/01/1045172201.db2.gz WQRASDCQTMHZEO-UHFFFAOYSA-N 1 2 321.399 4.325 20 0 DIADLO C[C@H](c1ccco1)[N@H+](Cc1cnc(C(F)(F)F)s1)C1CC1 ZINC000447747793 1045173198 /nfs/dbraw/zinc/17/31/98/1045173198.db2.gz UNXLRHCFTAAWOO-SECBINFHSA-N 1 2 316.348 4.481 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](Cc1cnc(C(F)(F)F)s1)C1CC1 ZINC000447747793 1045173203 /nfs/dbraw/zinc/17/32/03/1045173203.db2.gz UNXLRHCFTAAWOO-SECBINFHSA-N 1 2 316.348 4.481 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000924527456 1045173410 /nfs/dbraw/zinc/17/34/10/1045173410.db2.gz ZNGYRUZMDZQEQT-KBPBESRZSA-N 1 2 307.397 4.457 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000924527460 1045173438 /nfs/dbraw/zinc/17/34/38/1045173438.db2.gz ZNGYRUZMDZQEQT-KGLIPLIRSA-N 1 2 307.397 4.457 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2Cl)on1 ZINC000924545923 1045175540 /nfs/dbraw/zinc/17/55/40/1045175540.db2.gz DNHXECYDABDAJP-RKDXNWHRSA-N 1 2 315.200 4.402 20 0 DIADLO C[N@H+](Cc1cnc(C(F)(F)F)s1)Cc1ccc(Cl)cc1 ZINC000447798435 1045175883 /nfs/dbraw/zinc/17/58/83/1045175883.db2.gz WQFAGBHHJMAFLU-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1cnc(C(F)(F)F)s1)Cc1ccc(Cl)cc1 ZINC000447798435 1045175892 /nfs/dbraw/zinc/17/58/92/1045175892.db2.gz WQFAGBHHJMAFLU-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)on1 ZINC000924545922 1045176077 /nfs/dbraw/zinc/17/60/77/1045176077.db2.gz DNHXECYDABDAJP-IUCAKERBSA-N 1 2 315.200 4.402 20 0 DIADLO C=Cn1cc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000447793864 1045177988 /nfs/dbraw/zinc/17/79/88/1045177988.db2.gz GDWBYABBFLYNKX-CYBMUJFWSA-N 1 2 301.821 4.363 20 0 DIADLO C=Cn1cc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000447793864 1045177994 /nfs/dbraw/zinc/17/79/94/1045177994.db2.gz GDWBYABBFLYNKX-CYBMUJFWSA-N 1 2 301.821 4.363 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@H]1CCSc2c(F)cccc21 ZINC000924650596 1045187213 /nfs/dbraw/zinc/18/72/13/1045187213.db2.gz ZYNNCNDKXBLWJH-KBPBESRZSA-N 1 2 318.417 4.326 20 0 DIADLO CCO[C@H]1C[C@@H](Nc2ccc([NH+]3CCCC3)cc2)C12CCCC2 ZINC000320737128 1045187976 /nfs/dbraw/zinc/18/79/76/1045187976.db2.gz MZJKCSUCXDXTJL-MOPGFXCFSA-N 1 2 314.473 4.437 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000447936628 1045191628 /nfs/dbraw/zinc/19/16/28/1045191628.db2.gz QODPBDBXIIIRNO-GFCCVEGCSA-N 1 2 304.459 4.300 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+][C@H]2CSc3ccccc32)s1 ZINC000447934360 1045191891 /nfs/dbraw/zinc/19/18/91/1045191891.db2.gz XTTOJOCJILLSHT-LBPRGKRZSA-N 1 2 304.484 4.377 20 0 DIADLO Cc1nc(C[NH2+][C@H](Cc2ccccc2C)c2ccco2)cs1 ZINC000924723952 1045195523 /nfs/dbraw/zinc/19/55/23/1045195523.db2.gz VTFOAQMNSGJPBZ-QGZVFWFLSA-N 1 2 312.438 4.427 20 0 DIADLO CCn1nc(C)c([C@@H](C)[NH2+][C@H](C)c2oc3ccccc3c2C)n1 ZINC000924773330 1045197751 /nfs/dbraw/zinc/19/77/51/1045197751.db2.gz OTBUSEMMIUBFQN-TZMCWYRMSA-N 1 2 312.417 4.073 20 0 DIADLO C[C@H]([NH2+]Cc1ccon1)c1cccc(OCc2ccccc2)c1 ZINC000578052351 1045202083 /nfs/dbraw/zinc/20/20/83/1045202083.db2.gz FRJHNBFSMIYRNV-HNNXBMFYSA-N 1 2 308.381 4.104 20 0 DIADLO COc1ccccc1C[N@H+](Cc1cccs1)CC1(F)CC1 ZINC000527218929 1045203924 /nfs/dbraw/zinc/20/39/24/1045203924.db2.gz XFUUIJBSMBICAO-UHFFFAOYSA-N 1 2 305.418 4.261 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1cccs1)CC1(F)CC1 ZINC000527218929 1045203933 /nfs/dbraw/zinc/20/39/33/1045203933.db2.gz XFUUIJBSMBICAO-UHFFFAOYSA-N 1 2 305.418 4.261 20 0 DIADLO CC[C@H](C)Oc1ccc(NC(=O)c2ccn3c(C)c[nH+]c3c2)cc1 ZINC000578081049 1045204964 /nfs/dbraw/zinc/20/49/64/1045204964.db2.gz KBPZFPCSEXIHTO-AWEZNQCLSA-N 1 2 323.396 4.072 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+][C@@H]1CCCc2oc(C)nc21 ZINC000924858799 1045206037 /nfs/dbraw/zinc/20/60/37/1045206037.db2.gz NHMFHWVQXYVXKI-SWLSCSKDSA-N 1 2 300.402 4.110 20 0 DIADLO CC(C)(C)OCc1cc(C[NH2+]Cc2ccc(C(F)F)cc2)no1 ZINC000527233930 1045206208 /nfs/dbraw/zinc/20/62/08/1045206208.db2.gz DDCWPQMREJXCSD-UHFFFAOYSA-N 1 2 324.371 4.217 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@H]2CCCc3c(Cl)ccnc32)n1 ZINC000924925530 1045212055 /nfs/dbraw/zinc/21/20/55/1045212055.db2.gz MXDMPORQMNJLMB-MFKMUULPSA-N 1 2 307.850 4.228 20 0 DIADLO CC(C)c1ccc(NC(=O)[C@H](C)Cc2c[nH]c[nH+]2)c(C(C)C)c1 ZINC000578204725 1045219466 /nfs/dbraw/zinc/21/94/66/1045219466.db2.gz ZFOSVIQSOCIXFP-CQSZACIVSA-N 1 2 313.445 4.474 20 0 DIADLO CC(C)c1ccc(NC(=O)[C@H](C)Cc2c[nH+]c[nH]2)c(C(C)C)c1 ZINC000578204725 1045219475 /nfs/dbraw/zinc/21/94/75/1045219475.db2.gz ZFOSVIQSOCIXFP-CQSZACIVSA-N 1 2 313.445 4.474 20 0 DIADLO CCn1nc(C)c([C@@H](C)[NH2+][C@@H](c2ccccc2Cl)C(C)C)n1 ZINC000925076988 1045223560 /nfs/dbraw/zinc/22/35/60/1045223560.db2.gz QVRUVRFWDFUFRV-MLGOLLRUSA-N 1 2 320.868 4.308 20 0 DIADLO Clc1cccc2c1[C@H]([NH2+][C@H]1CSc3ccccc31)COC2 ZINC000925091866 1045226484 /nfs/dbraw/zinc/22/64/84/1045226484.db2.gz DCAYMEVYEHLYFW-CABCVRRESA-N 1 2 317.841 4.348 20 0 DIADLO CC1(C)C[N@H+](Cc2cscc2C(F)(F)F)[C@@H]1[C@@H]1CCCO1 ZINC000578288034 1045229153 /nfs/dbraw/zinc/22/91/53/1045229153.db2.gz HOJISHKJVXSMOE-QWHCGFSZSA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2cscc2C(F)(F)F)[C@@H]1[C@@H]1CCCO1 ZINC000578288034 1045229162 /nfs/dbraw/zinc/22/91/62/1045229162.db2.gz HOJISHKJVXSMOE-QWHCGFSZSA-N 1 2 319.392 4.156 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](c2ccc(C)cc2)c2cccnc2)s1 ZINC000925161511 1045230395 /nfs/dbraw/zinc/23/03/95/1045230395.db2.gz ASELATMNNIMPDI-IBGZPJMESA-N 1 2 323.465 4.288 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1ccc(C)nc1Cl ZINC001142140302 1045230953 /nfs/dbraw/zinc/23/09/53/1045230953.db2.gz WJUBIPNHICZPBP-ZDUSSCGKSA-N 1 2 304.821 4.245 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1ccc(C)nc1Cl ZINC001142140302 1045230957 /nfs/dbraw/zinc/23/09/57/1045230957.db2.gz WJUBIPNHICZPBP-ZDUSSCGKSA-N 1 2 304.821 4.245 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1cnn(C2CCC2)c1 ZINC000925152188 1045231558 /nfs/dbraw/zinc/23/15/58/1045231558.db2.gz GPIMTWVVPQQTHV-AWEZNQCLSA-N 1 2 322.412 4.114 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@H](C)c2ccccc2Br)ccn1 ZINC000527535002 1045231720 /nfs/dbraw/zinc/23/17/20/1045231720.db2.gz TUHYAKHTOQGSIR-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cc(C[N@H+](C)[C@H](C)c2ccccc2Br)ccn1 ZINC000527535002 1045231727 /nfs/dbraw/zinc/23/17/27/1045231727.db2.gz TUHYAKHTOQGSIR-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO CC(C)(C)[C@@H]1C[N@H+](Cc2cnc(-c3cccs3)s2)CCO1 ZINC000448356156 1045236119 /nfs/dbraw/zinc/23/61/19/1045236119.db2.gz QTBCZJXWNBJBGY-AWEZNQCLSA-N 1 2 322.499 4.119 20 0 DIADLO CC(C)(C)[C@@H]1C[N@@H+](Cc2cnc(-c3cccs3)s2)CCO1 ZINC000448356156 1045236126 /nfs/dbraw/zinc/23/61/26/1045236126.db2.gz QTBCZJXWNBJBGY-AWEZNQCLSA-N 1 2 322.499 4.119 20 0 DIADLO CC(C)(C)[C@H]1C[N@H+](Cc2cnc(-c3cccs3)s2)CCO1 ZINC000448356157 1045236468 /nfs/dbraw/zinc/23/64/68/1045236468.db2.gz QTBCZJXWNBJBGY-CQSZACIVSA-N 1 2 322.499 4.119 20 0 DIADLO CC(C)(C)[C@H]1C[N@@H+](Cc2cnc(-c3cccs3)s2)CCO1 ZINC000448356157 1045236476 /nfs/dbraw/zinc/23/64/76/1045236476.db2.gz QTBCZJXWNBJBGY-CQSZACIVSA-N 1 2 322.499 4.119 20 0 DIADLO CCC[C@H]([NH2+]Cc1c(CC)noc1CC)c1ncccc1Cl ZINC000925247740 1045239287 /nfs/dbraw/zinc/23/92/87/1045239287.db2.gz VAKZRLMIMHNKLT-HNNXBMFYSA-N 1 2 321.852 4.479 20 0 DIADLO Cc1cc(NC[C@H]2CCCO[C@H]2c2ccccc2)nc(C2CC2)[nH+]1 ZINC000116260297 1045240869 /nfs/dbraw/zinc/24/08/69/1045240869.db2.gz JVNDRNXBZNGUAJ-MJGOQNOKSA-N 1 2 323.440 4.242 20 0 DIADLO Cc1cc(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)ccn1 ZINC000527675177 1045247879 /nfs/dbraw/zinc/24/78/79/1045247879.db2.gz BVIHEWDNHMSQNN-UHFFFAOYSA-N 1 2 318.424 4.202 20 0 DIADLO CCc1noc(CC)c1C[NH2+]Cc1c(F)ccc(F)c1Cl ZINC000527675300 1045248012 /nfs/dbraw/zinc/24/80/12/1045248012.db2.gz RZSAONMZJDUMTO-UHFFFAOYSA-N 1 2 314.763 4.021 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CCC[C@H](C3CC3)C2)c(C)[nH+]1 ZINC000578662928 1045261617 /nfs/dbraw/zinc/26/16/17/1045261617.db2.gz BZEDMNGWGPXDLE-JKSUJKDBSA-N 1 2 301.434 4.097 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cncc(F)c1)c1cc(-c2ccccc2)n(C)n1 ZINC000527906857 1045279518 /nfs/dbraw/zinc/27/95/18/1045279518.db2.gz APHIKKNIXFPQEH-KBPBESRZSA-N 1 2 324.403 4.033 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](Cc2ccc(C)cc2)c2ccccn2)no1 ZINC000578916966 1045280632 /nfs/dbraw/zinc/28/06/32/1045280632.db2.gz IWEWMPDITKTJOJ-OXJNMPFZSA-N 1 2 321.424 4.321 20 0 DIADLO Cc1cocc1C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000527978393 1045288337 /nfs/dbraw/zinc/28/83/37/1045288337.db2.gz HXWOZHFEGGVZOO-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO CC1(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)CCC(F)(F)CC1 ZINC000528031143 1045294470 /nfs/dbraw/zinc/29/44/70/1045294470.db2.gz SGJBYXNUWLOSEH-UHFFFAOYSA-N 1 2 319.355 4.026 20 0 DIADLO C[C@@H](CC(=O)N[C@@H](CC(C)(C)C)c1ccccc1)n1cc[nH+]c1 ZINC000579115502 1045294799 /nfs/dbraw/zinc/29/47/99/1045294799.db2.gz OERLPSLSILIAJN-RDJZCZTQSA-N 1 2 313.445 4.128 20 0 DIADLO CCOC(=O)c1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)o1 ZINC000579153011 1045297399 /nfs/dbraw/zinc/29/73/99/1045297399.db2.gz IBNRVVHPAKRMRV-OAHLLOKOSA-N 1 2 319.426 4.101 20 0 DIADLO CCOC(=O)c1ccc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)o1 ZINC000579153011 1045297405 /nfs/dbraw/zinc/29/74/05/1045297405.db2.gz IBNRVVHPAKRMRV-OAHLLOKOSA-N 1 2 319.426 4.101 20 0 DIADLO FC1(F)CCC12C[NH+](Cc1cnc(C3CCCCC3)s1)C2 ZINC000579299230 1045307207 /nfs/dbraw/zinc/30/72/07/1045307207.db2.gz OOHCIRHFBMKUPW-UHFFFAOYSA-N 1 2 312.429 4.422 20 0 DIADLO Fc1ccc2oc(C[NH+]3CCC(CC(F)(F)F)CC3)nc2c1 ZINC000579574065 1045322920 /nfs/dbraw/zinc/32/29/20/1045322920.db2.gz VWDQUDFREXWPSH-UHFFFAOYSA-N 1 2 316.298 4.131 20 0 DIADLO Fc1cnccc1C[N@H+](Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000449010713 1045334519 /nfs/dbraw/zinc/33/45/19/1045334519.db2.gz MXQRPIYCGNXBAB-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO Fc1cnccc1C[N@@H+](Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000449010713 1045334525 /nfs/dbraw/zinc/33/45/25/1045334525.db2.gz MXQRPIYCGNXBAB-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[N@H+](C)Cc1ccncc1F ZINC000449035369 1045335658 /nfs/dbraw/zinc/33/56/58/1045335658.db2.gz GSUUSKUEMNIEPK-LBPRGKRZSA-N 1 2 307.438 4.302 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)Cc1ccncc1F ZINC000449035369 1045335663 /nfs/dbraw/zinc/33/56/63/1045335663.db2.gz GSUUSKUEMNIEPK-LBPRGKRZSA-N 1 2 307.438 4.302 20 0 DIADLO C/C=C(\CC)C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000188575081 1045337362 /nfs/dbraw/zinc/33/73/62/1045337362.db2.gz YAMCMBNXTZSLIH-LZWSPWQCSA-N 1 2 309.413 4.181 20 0 DIADLO Fc1cc2c(c(F)c1F)[C@H]([NH2+]Cc1ccc(Cl)o1)CC2 ZINC000449058780 1045337933 /nfs/dbraw/zinc/33/79/33/1045337933.db2.gz LWTVIIROHVYLSA-SNVBAGLBSA-N 1 2 301.695 4.127 20 0 DIADLO C[N@H+](Cc1ccccc1C(F)(F)F)Cc1ncccc1Cl ZINC000528338151 1045341051 /nfs/dbraw/zinc/34/10/51/1045341051.db2.gz GLMMFWQHRYCUPI-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccccc1C(F)(F)F)Cc1ncccc1Cl ZINC000528338151 1045341056 /nfs/dbraw/zinc/34/10/56/1045341056.db2.gz GLMMFWQHRYCUPI-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@H+](Cc1ccc(C(F)(F)F)cc1)Cc1ncccc1Cl ZINC000528340032 1045342025 /nfs/dbraw/zinc/34/20/25/1045342025.db2.gz SPZBWCICUUHJAL-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cc1ncccc1Cl ZINC000528340032 1045342029 /nfs/dbraw/zinc/34/20/29/1045342029.db2.gz SPZBWCICUUHJAL-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO Fc1ccc(C[NH+]2CCC(=Cc3ccccc3F)CC2)cn1 ZINC000779165196 1045348333 /nfs/dbraw/zinc/34/83/33/1045348333.db2.gz ZUBPUWSJBYNSSM-UHFFFAOYSA-N 1 2 300.352 4.039 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)n1 ZINC000449117050 1045349005 /nfs/dbraw/zinc/34/90/05/1045349005.db2.gz NFKSLNILUNEBNI-LDYMZIIASA-N 1 2 312.360 4.207 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccnc2C(F)(F)F)[C@H]1c1ccccc1 ZINC000528393829 1045349875 /nfs/dbraw/zinc/34/98/75/1045349875.db2.gz GYHAFSIHRAHULZ-SWLSCSKDSA-N 1 2 306.331 4.293 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccnc2C(F)(F)F)[C@H]1c1ccccc1 ZINC000528393829 1045349883 /nfs/dbraw/zinc/34/98/83/1045349883.db2.gz GYHAFSIHRAHULZ-SWLSCSKDSA-N 1 2 306.331 4.293 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccnc2C(F)(F)F)[C@@H]1c1ccccc1 ZINC000528393826 1045350276 /nfs/dbraw/zinc/35/02/76/1045350276.db2.gz GYHAFSIHRAHULZ-DOMZBBRYSA-N 1 2 306.331 4.293 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccnc2C(F)(F)F)[C@@H]1c1ccccc1 ZINC000528393826 1045350283 /nfs/dbraw/zinc/35/02/83/1045350283.db2.gz GYHAFSIHRAHULZ-DOMZBBRYSA-N 1 2 306.331 4.293 20 0 DIADLO c1csc([C@@H]2CSCC[N@H+]2Cc2cccc3ccoc32)n1 ZINC000449248332 1045369930 /nfs/dbraw/zinc/36/99/30/1045369930.db2.gz JIOGJXVBLZZLDN-AWEZNQCLSA-N 1 2 316.451 4.179 20 0 DIADLO c1csc([C@@H]2CSCC[N@@H+]2Cc2cccc3ccoc32)n1 ZINC000449248332 1045369935 /nfs/dbraw/zinc/36/99/35/1045369935.db2.gz JIOGJXVBLZZLDN-AWEZNQCLSA-N 1 2 316.451 4.179 20 0 DIADLO C[C@H]1CSC[C@@H]1Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000449281590 1045370998 /nfs/dbraw/zinc/37/09/98/1045370998.db2.gz DGLBGXKCRWLUSE-GUYCJALGSA-N 1 2 313.470 4.050 20 0 DIADLO CCCc1nc(C)c(C[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)o1 ZINC000449340219 1045377671 /nfs/dbraw/zinc/37/76/71/1045377671.db2.gz NFGZAPBUIRXHGU-GFCCVEGCSA-N 1 2 324.346 4.130 20 0 DIADLO Cn1cc(C[N@@H+]2CCC[C@@](C)(F)C2)c(-c2ccccc2Cl)n1 ZINC000449346883 1045378983 /nfs/dbraw/zinc/37/89/83/1045378983.db2.gz ARYHJKICXREIPT-QGZVFWFLSA-N 1 2 321.827 4.065 20 0 DIADLO Cn1cc(C[N@H+]2CCC[C@@](C)(F)C2)c(-c2ccccc2Cl)n1 ZINC000449346883 1045378990 /nfs/dbraw/zinc/37/89/90/1045378990.db2.gz ARYHJKICXREIPT-QGZVFWFLSA-N 1 2 321.827 4.065 20 0 DIADLO Cc1cc(C[NH2+]C(C)(C)c2cc(C(F)(F)F)on2)cs1 ZINC000449337739 1045382532 /nfs/dbraw/zinc/38/25/32/1045382532.db2.gz CFGCHNPXQOJMSL-UHFFFAOYSA-N 1 2 304.337 4.088 20 0 DIADLO CCOc1nnc(C[N@H+](Cc2ccc(C)cc2)C(C)(C)C)s1 ZINC000528594223 1045386240 /nfs/dbraw/zinc/38/62/40/1045386240.db2.gz QFENNCKMJGYDKJ-UHFFFAOYSA-N 1 2 319.474 4.046 20 0 DIADLO CCOc1nnc(C[N@@H+](Cc2ccc(C)cc2)C(C)(C)C)s1 ZINC000528594223 1045386242 /nfs/dbraw/zinc/38/62/42/1045386242.db2.gz QFENNCKMJGYDKJ-UHFFFAOYSA-N 1 2 319.474 4.046 20 0 DIADLO CC(C)n1ccc(C[NH2+]C(C)(C)c2nc3ccccc3s2)n1 ZINC000528612142 1045387855 /nfs/dbraw/zinc/38/78/55/1045387855.db2.gz JXFNEEUBHBZAHS-UHFFFAOYSA-N 1 2 314.458 4.099 20 0 DIADLO C[C@H](C[N@@H+]1CC(C)(C)[C@@H]1c1nccn1C)c1cccc(Cl)c1 ZINC000449414156 1045388930 /nfs/dbraw/zinc/38/89/30/1045388930.db2.gz LJOVMVDPULYWFS-CJNGLKHVSA-N 1 2 317.864 4.260 20 0 DIADLO C[C@H](C[N@H+]1CC(C)(C)[C@@H]1c1nccn1C)c1cccc(Cl)c1 ZINC000449414156 1045388931 /nfs/dbraw/zinc/38/89/31/1045388931.db2.gz LJOVMVDPULYWFS-CJNGLKHVSA-N 1 2 317.864 4.260 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000449459823 1045395414 /nfs/dbraw/zinc/39/54/14/1045395414.db2.gz MDSSVTKERIQBLI-GXSJLCMTSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1csc(C2CC2)n1 ZINC000449459823 1045395417 /nfs/dbraw/zinc/39/54/17/1045395417.db2.gz MDSSVTKERIQBLI-GXSJLCMTSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000449456533 1045396083 /nfs/dbraw/zinc/39/60/83/1045396083.db2.gz CZVMJWLKQAVGGP-JSGCOSHPSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000449456533 1045396085 /nfs/dbraw/zinc/39/60/85/1045396085.db2.gz CZVMJWLKQAVGGP-JSGCOSHPSA-N 1 2 323.362 4.240 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](c2cccc(C)c2)C(C)C)no1 ZINC000528767507 1045411583 /nfs/dbraw/zinc/41/15/83/1045411583.db2.gz OXXCWJAJSJRXAV-GOSISDBHSA-N 1 2 301.434 4.208 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+][C@H]3C[C@@H](C)n4ccnc43)o2)cc1 ZINC000449575295 1045415740 /nfs/dbraw/zinc/41/57/40/1045415740.db2.gz XPUHGSQBNOBIPY-PBHICJAKSA-N 1 2 307.397 4.247 20 0 DIADLO COc1ccc(OC)c(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1 ZINC000449634793 1045423744 /nfs/dbraw/zinc/42/37/44/1045423744.db2.gz RYKBOLVGAUDAEZ-SFHVURJKSA-N 1 2 313.397 4.024 20 0 DIADLO COc1ccc(OC)c(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1 ZINC000449634793 1045423746 /nfs/dbraw/zinc/42/37/46/1045423746.db2.gz RYKBOLVGAUDAEZ-SFHVURJKSA-N 1 2 313.397 4.024 20 0 DIADLO COc1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)cc1F ZINC000449632669 1045423830 /nfs/dbraw/zinc/42/38/30/1045423830.db2.gz NCDADEQDCHXENL-KRWDZBQOSA-N 1 2 301.361 4.155 20 0 DIADLO COc1ccc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)cc1F ZINC000449632669 1045423833 /nfs/dbraw/zinc/42/38/33/1045423833.db2.gz NCDADEQDCHXENL-KRWDZBQOSA-N 1 2 301.361 4.155 20 0 DIADLO COc1cc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)cc(OC)c1 ZINC000449634135 1045423906 /nfs/dbraw/zinc/42/39/06/1045423906.db2.gz QVRLRUONCPOUSA-SFHVURJKSA-N 1 2 313.397 4.024 20 0 DIADLO COc1cc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)cc(OC)c1 ZINC000449634135 1045423908 /nfs/dbraw/zinc/42/39/08/1045423908.db2.gz QVRLRUONCPOUSA-SFHVURJKSA-N 1 2 313.397 4.024 20 0 DIADLO COc1c(O)cccc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC000449729676 1045430309 /nfs/dbraw/zinc/43/03/09/1045430309.db2.gz BJLBXDFJTZGQPD-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1c(O)cccc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC000449729676 1045430311 /nfs/dbraw/zinc/43/03/11/1045430311.db2.gz BJLBXDFJTZGQPD-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO CC(C)c1nnc(C[NH+]2CCC(Cc3ccccc3)CC2)s1 ZINC000450214403 1045476176 /nfs/dbraw/zinc/47/61/76/1045476176.db2.gz IDWKFWWHSBBYIE-UHFFFAOYSA-N 1 2 315.486 4.116 20 0 DIADLO FC(F)(F)c1sccc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000529518011 1045487457 /nfs/dbraw/zinc/48/74/57/1045487457.db2.gz JIYQPRHJDGQUCD-GFCCVEGCSA-N 1 2 300.349 4.432 20 0 DIADLO FC(F)(F)c1sccc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000529518011 1045487460 /nfs/dbraw/zinc/48/74/60/1045487460.db2.gz JIYQPRHJDGQUCD-GFCCVEGCSA-N 1 2 300.349 4.432 20 0 DIADLO FC(F)(F)c1sccc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000529521541 1045489176 /nfs/dbraw/zinc/48/91/76/1045489176.db2.gz AEKOUQVOYOMHBG-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1sccc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000529521541 1045489178 /nfs/dbraw/zinc/48/91/78/1045489178.db2.gz AEKOUQVOYOMHBG-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO CC(C)OC1CC[NH+](Cc2c(F)ccc(F)c2Cl)CC1 ZINC000529525716 1045490303 /nfs/dbraw/zinc/49/03/03/1045490303.db2.gz AVHSIVFUIGXTOW-UHFFFAOYSA-N 1 2 303.780 4.008 20 0 DIADLO CC(=O)c1ccc(C[N@H+]2C[C@@H](c3ccccc3C)OC[C@@H]2C)cc1 ZINC000450440216 1045505774 /nfs/dbraw/zinc/50/57/74/1045505774.db2.gz PBMQBNWSSHPRGB-KKSFZXQISA-N 1 2 323.436 4.160 20 0 DIADLO CC(=O)c1ccc(C[N@@H+]2C[C@@H](c3ccccc3C)OC[C@@H]2C)cc1 ZINC000450440216 1045505781 /nfs/dbraw/zinc/50/57/81/1045505781.db2.gz PBMQBNWSSHPRGB-KKSFZXQISA-N 1 2 323.436 4.160 20 0 DIADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)Nc1cccc(C2CCCCC2)c1 ZINC000529650645 1045507634 /nfs/dbraw/zinc/50/76/34/1045507634.db2.gz XDGMOMJVRPNAKM-CQSZACIVSA-N 1 2 311.429 4.275 20 0 DIADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)Nc1cccc(C2CCCCC2)c1 ZINC000529650645 1045507637 /nfs/dbraw/zinc/50/76/37/1045507637.db2.gz XDGMOMJVRPNAKM-CQSZACIVSA-N 1 2 311.429 4.275 20 0 DIADLO CC(C)n1c[nH+]cc1CN1CCc2c(cccc2C(F)(F)F)C1 ZINC000529662266 1045510381 /nfs/dbraw/zinc/51/03/81/1045510381.db2.gz PJYLHGHVTUBVIW-UHFFFAOYSA-N 1 2 323.362 4.041 20 0 DIADLO CCC[C@@]1(C)CCC[N@@H+]([C@@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001307500716 1045511748 /nfs/dbraw/zinc/51/17/48/1045511748.db2.gz VVJGKFUOVXZQRO-AEFFLSMTSA-N 1 2 323.864 4.456 20 0 DIADLO CCC[C@@]1(C)CCC[N@H+]([C@@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001307500716 1045511756 /nfs/dbraw/zinc/51/17/56/1045511756.db2.gz VVJGKFUOVXZQRO-AEFFLSMTSA-N 1 2 323.864 4.456 20 0 DIADLO CCOC1(C)CCN(c2cc[nH+]c3cc(F)c(Cl)cc32)CC1 ZINC000450539133 1045518216 /nfs/dbraw/zinc/51/82/16/1045518216.db2.gz JNUWXMNXIDLGSP-UHFFFAOYSA-N 1 2 322.811 4.423 20 0 DIADLO C(=C/[C@@H]1CCCCC[N@H+]1Cc1nncs1)\c1cccs1 ZINC001119729336 1045522719 /nfs/dbraw/zinc/52/27/19/1045522719.db2.gz OEMRDTOMESDCBD-GWJCSSMESA-N 1 2 305.472 4.058 20 0 DIADLO C(=C/[C@@H]1CCCCC[N@@H+]1Cc1nncs1)\c1cccs1 ZINC001119729336 1045522724 /nfs/dbraw/zinc/52/27/24/1045522724.db2.gz OEMRDTOMESDCBD-GWJCSSMESA-N 1 2 305.472 4.058 20 0 DIADLO Cc1cnc(C2CC[NH+](Cc3coc(C(C)(C)C)n3)CC2)s1 ZINC001119851554 1045527120 /nfs/dbraw/zinc/52/71/20/1045527120.db2.gz MDLNYLOYPSMJPZ-UHFFFAOYSA-N 1 2 319.474 4.117 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cnc(C3CC3)o2)C2CC2)o1 ZINC000628131294 1045528006 /nfs/dbraw/zinc/52/80/06/1045528006.db2.gz VXPAEULGFSDPKC-SJCJKPOMSA-N 1 2 312.413 4.433 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cnc(C3CC3)o2)C2CC2)o1 ZINC000628131294 1045528022 /nfs/dbraw/zinc/52/80/22/1045528022.db2.gz VXPAEULGFSDPKC-SJCJKPOMSA-N 1 2 312.413 4.433 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C)sc1C)c1cc(F)ccc1OC ZINC001119845819 1045528001 /nfs/dbraw/zinc/52/80/01/1045528001.db2.gz HTQMENBHAXPSOJ-AWEZNQCLSA-N 1 2 308.422 4.149 20 0 DIADLO CCC[N@H+](Cc1nc(C)c(C)[nH]1)[C@H](C)c1ccccc1OC ZINC000628139303 1045528440 /nfs/dbraw/zinc/52/84/40/1045528440.db2.gz AQNARSZFMSZCOD-OAHLLOKOSA-N 1 2 301.434 4.008 20 0 DIADLO CCC[N@@H+](Cc1nc(C)c(C)[nH]1)[C@H](C)c1ccccc1OC ZINC000628139303 1045528451 /nfs/dbraw/zinc/52/84/51/1045528451.db2.gz AQNARSZFMSZCOD-OAHLLOKOSA-N 1 2 301.434 4.008 20 0 DIADLO CCCN(Cc1[nH]c(C)c(C)[nH+]1)[C@H](C)c1ccccc1OC ZINC000628139303 1045528460 /nfs/dbraw/zinc/52/84/60/1045528460.db2.gz AQNARSZFMSZCOD-OAHLLOKOSA-N 1 2 301.434 4.008 20 0 DIADLO Cc1c[nH]c(C[N@H+]2CC=C(c3cccc4ccccc43)CC2)n1 ZINC000628157784 1045534021 /nfs/dbraw/zinc/53/40/21/1045534021.db2.gz VIQVXHRQOILUGY-UHFFFAOYSA-N 1 2 303.409 4.161 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2CC=C(c3cccc4ccccc43)CC2)n1 ZINC000628157784 1045534028 /nfs/dbraw/zinc/53/40/28/1045534028.db2.gz VIQVXHRQOILUGY-UHFFFAOYSA-N 1 2 303.409 4.161 20 0 DIADLO COc1cc(NCc2cc(-n3cc[nH+]c3)cs2)c(C)cc1C ZINC000475667968 1045534070 /nfs/dbraw/zinc/53/40/70/1045534070.db2.gz ICLRPCIXHQFHIT-UHFFFAOYSA-N 1 2 313.426 4.171 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1CCC(Nc2ccccn2)CC1 ZINC001120059321 1045536184 /nfs/dbraw/zinc/53/61/84/1045536184.db2.gz KNQKKDOICUTLQK-UHFFFAOYSA-N 1 2 318.424 4.019 20 0 DIADLO Cc1[nH]c(CN2CCCC[C@@H]2c2ccc(F)cc2F)[nH+]c1C ZINC000628190404 1045537740 /nfs/dbraw/zinc/53/77/40/1045537740.db2.gz FHBMRUSMDYBATH-MRXNPFEDSA-N 1 2 305.372 4.032 20 0 DIADLO Fc1c(C[N@H+]2CC=C(c3ccccc3)CC2)ccnc1Cl ZINC001139664704 1045543087 /nfs/dbraw/zinc/54/30/87/1045543087.db2.gz ALMOGHJYNXNXGQ-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Fc1c(C[N@@H+]2CC=C(c3ccccc3)CC2)ccnc1Cl ZINC001139664704 1045543100 /nfs/dbraw/zinc/54/31/00/1045543100.db2.gz ALMOGHJYNXNXGQ-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1oc(C)nc1C)c1ccccc1 ZINC000628213864 1045545499 /nfs/dbraw/zinc/54/54/99/1045545499.db2.gz BBUFNFMLOVNPHJ-FQEVSTJZSA-N 1 2 322.408 4.179 20 0 DIADLO CS[C@@H]1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C1 ZINC000450687632 1045545862 /nfs/dbraw/zinc/54/58/62/1045545862.db2.gz WWYCUOOQWSLESH-GFCCVEGCSA-N 1 2 312.360 4.195 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccc(F)c(F)c1 ZINC000450684245 1045545993 /nfs/dbraw/zinc/54/59/93/1045545993.db2.gz RFRYKSZNQQNLDA-HNNXBMFYSA-N 1 2 323.412 4.181 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C)Cc3ccc(C(C)C)cc3)ccn12 ZINC000654385426 1045548179 /nfs/dbraw/zinc/54/81/79/1045548179.db2.gz HXWPDBPUMGFICH-UHFFFAOYSA-N 1 2 321.424 4.038 20 0 DIADLO Cc1[nH]c(CN2CCC[C@]2(c2ccccc2)C(F)(F)F)[nH+]c1C ZINC000628241459 1045553520 /nfs/dbraw/zinc/55/35/20/1045553520.db2.gz WKEHUUZZILSOJS-INIZCTEOSA-N 1 2 323.362 4.080 20 0 DIADLO Cc1[nH]c(CN2CCC[C@@]2(c2ccccc2)C(F)(F)F)[nH+]c1C ZINC000628241460 1045554495 /nfs/dbraw/zinc/55/44/95/1045554495.db2.gz WKEHUUZZILSOJS-MRXNPFEDSA-N 1 2 323.362 4.080 20 0 DIADLO FC1(F)CC[C@H](C[N@@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)C1 ZINC000450752588 1045562854 /nfs/dbraw/zinc/56/28/54/1045562854.db2.gz GCALIIDBKDSKTR-SWLSCSKDSA-N 1 2 315.791 4.149 20 0 DIADLO FC1(F)CC[C@H](C[N@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)C1 ZINC000450752588 1045562868 /nfs/dbraw/zinc/56/28/68/1045562868.db2.gz GCALIIDBKDSKTR-SWLSCSKDSA-N 1 2 315.791 4.149 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2ccc3ncsc3c2)s1 ZINC000450760064 1045565146 /nfs/dbraw/zinc/56/51/46/1045565146.db2.gz LCVYVSDOQWXZGR-SNVBAGLBSA-N 1 2 318.471 4.122 20 0 DIADLO c1nc(C2CC2)oc1C[N@@H+]1CCc2oc(-c3ccccc3)cc2C1 ZINC000628323741 1045567459 /nfs/dbraw/zinc/56/74/59/1045567459.db2.gz KMURXRRGLFAVAN-UHFFFAOYSA-N 1 2 320.392 4.370 20 0 DIADLO c1nc(C2CC2)oc1C[N@H+]1CCc2oc(-c3ccccc3)cc2C1 ZINC000628323741 1045567472 /nfs/dbraw/zinc/56/74/72/1045567472.db2.gz KMURXRRGLFAVAN-UHFFFAOYSA-N 1 2 320.392 4.370 20 0 DIADLO COc1cc(C[NH+]2CC(C)(CC(F)F)C2)cc(C(F)(F)F)c1 ZINC000628321924 1045569314 /nfs/dbraw/zinc/56/93/14/1045569314.db2.gz NNWHPTMIARIKFJ-UHFFFAOYSA-N 1 2 323.305 4.191 20 0 DIADLO C[C@H]1CO[C@@H](c2cccc(Cl)c2)C[N@@H+]1CC1CC(F)(F)C1 ZINC000450813222 1045569649 /nfs/dbraw/zinc/56/96/49/1045569649.db2.gz VINUGPAOMPWNAR-XHDPSFHLSA-N 1 2 315.791 4.147 20 0 DIADLO C[C@H]1CO[C@@H](c2cccc(Cl)c2)C[N@H+]1CC1CC(F)(F)C1 ZINC000450813222 1045569661 /nfs/dbraw/zinc/56/96/61/1045569661.db2.gz VINUGPAOMPWNAR-XHDPSFHLSA-N 1 2 315.791 4.147 20 0 DIADLO FC(F)(F)c1cc(C[NH+]2CC(Cc3ccco3)C2)cs1 ZINC000628433091 1045583575 /nfs/dbraw/zinc/58/35/75/1045583575.db2.gz FLRGYDKJYYAXIW-UHFFFAOYSA-N 1 2 301.333 4.034 20 0 DIADLO C[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1ccc(F)cc1F ZINC000190678901 1045598590 /nfs/dbraw/zinc/59/85/90/1045598590.db2.gz NRCZMDUYGKBCNT-QMMMGPOBSA-N 1 2 315.722 4.314 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC=C(c3cccnc3)C2)cs1 ZINC000451026542 1045616749 /nfs/dbraw/zinc/61/67/49/1045616749.db2.gz UBKGPYHXXPUOCQ-UHFFFAOYSA-N 1 2 313.470 4.125 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC=C(c3cccnc3)C2)cs1 ZINC000451026542 1045616758 /nfs/dbraw/zinc/61/67/58/1045616758.db2.gz UBKGPYHXXPUOCQ-UHFFFAOYSA-N 1 2 313.470 4.125 20 0 DIADLO Cc1cc(F)cc([C@]2(F)CC[N@H+](C[C@H]3CC3(Cl)Cl)C2)c1 ZINC000800473878 1045623928 /nfs/dbraw/zinc/62/39/28/1045623928.db2.gz COVZOEASRCFITM-OCCSQVGLSA-N 1 2 320.210 4.198 20 0 DIADLO Cc1cc(F)cc([C@]2(F)CC[N@@H+](C[C@H]3CC3(Cl)Cl)C2)c1 ZINC000800473878 1045623937 /nfs/dbraw/zinc/62/39/37/1045623937.db2.gz COVZOEASRCFITM-OCCSQVGLSA-N 1 2 320.210 4.198 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2cccnc2Cl)C1 ZINC000800473062 1045624174 /nfs/dbraw/zinc/62/41/74/1045624174.db2.gz JLTDYMPWZKWIPZ-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2cccnc2Cl)C1 ZINC000800473062 1045624178 /nfs/dbraw/zinc/62/41/78/1045624178.db2.gz JLTDYMPWZKWIPZ-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CCC34CCC4)cc2)C[C@H](C)O1 ZINC000800487433 1045628802 /nfs/dbraw/zinc/62/88/02/1045628802.db2.gz CTEBRFGKGLDNRZ-DAYGRLMNSA-N 1 2 300.446 4.045 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCC34CCC4)cc2)C[C@@H](C)O1 ZINC000800487435 1045628823 /nfs/dbraw/zinc/62/88/23/1045628823.db2.gz CTEBRFGKGLDNRZ-IIDMSEBBSA-N 1 2 300.446 4.045 20 0 DIADLO Cc1cc(Cl)nc(C[NH2+][C@H](c2ccccc2)c2ccccn2)c1 ZINC000800494071 1045632433 /nfs/dbraw/zinc/63/24/33/1045632433.db2.gz CLOUJDYWJYCYER-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO CC1(C)CCC(=CC(=O)NCc2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC000751752765 1045632844 /nfs/dbraw/zinc/63/28/44/1045632844.db2.gz NWNPCEMAZPENIO-UHFFFAOYSA-N 1 2 323.440 4.015 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001460794120 1045641361 /nfs/dbraw/zinc/64/13/61/1045641361.db2.gz XOXYPVKKPFKEOQ-JOYOIKCWSA-N 1 2 309.784 4.381 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001460794120 1045641367 /nfs/dbraw/zinc/64/13/67/1045641367.db2.gz XOXYPVKKPFKEOQ-JOYOIKCWSA-N 1 2 309.784 4.381 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@@H](c1ccccc1)C1CC1 ZINC000121741368 1045656798 /nfs/dbraw/zinc/65/67/98/1045656798.db2.gz FULYKKYWLMVTIH-IBGZPJMESA-N 1 2 317.392 4.005 20 0 DIADLO S=c1scnn1C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000800866629 1045659745 /nfs/dbraw/zinc/65/97/45/1045659745.db2.gz PXBXMOVTRLMSAM-QDMKHBRRSA-N 1 2 317.483 4.042 20 0 DIADLO S=c1scnn1C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000800866629 1045659753 /nfs/dbraw/zinc/65/97/53/1045659753.db2.gz PXBXMOVTRLMSAM-QDMKHBRRSA-N 1 2 317.483 4.042 20 0 DIADLO CC[C@@](C)([NH2+]Cc1c(O)ccc(Cl)c1F)c1nccs1 ZINC000191157311 1045661061 /nfs/dbraw/zinc/66/10/61/1045661061.db2.gz NBHLRDZJBJYYRM-CQSZACIVSA-N 1 2 314.813 4.056 20 0 DIADLO CCOc1c(Cl)cc(CNc2ccc([NH2+]C)cc2)cc1OC ZINC000629389610 1045664230 /nfs/dbraw/zinc/66/42/30/1045664230.db2.gz OWLKMQNGLUZTES-UHFFFAOYSA-N 1 2 320.820 4.401 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CC[C@H]3C3CCC3)cc2)C[C@@H](C)O1 ZINC000800981090 1045676118 /nfs/dbraw/zinc/67/61/18/1045676118.db2.gz KBFMNCJEXVXSNM-XWYPRVOQSA-N 1 2 314.473 4.291 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+][C@H]2CCC[C@H]2CCCF)cc1 ZINC000800982165 1045676785 /nfs/dbraw/zinc/67/67/85/1045676785.db2.gz OLGLXGKHWSKBQH-GJYPPUQNSA-N 1 2 320.452 4.242 20 0 DIADLO CCC1(CC)CN(C(=O)c2cccc3[nH+]ccn32)c2ccccc21 ZINC000752409953 1045678157 /nfs/dbraw/zinc/67/81/57/1045678157.db2.gz VHDFBVFPNVQBED-UHFFFAOYSA-N 1 2 319.408 4.053 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nc(C2CC2)cs1 ZINC000451412168 1045680162 /nfs/dbraw/zinc/68/01/62/1045680162.db2.gz WKNBLJPXMQUWCO-ONGXEEELSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1nc(C2CC2)cs1 ZINC000451412168 1045680167 /nfs/dbraw/zinc/68/01/67/1045680167.db2.gz WKNBLJPXMQUWCO-ONGXEEELSA-N 1 2 304.381 4.183 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2coc3ccccc23)cs1 ZINC000925234545 1045684099 /nfs/dbraw/zinc/68/40/99/1045684099.db2.gz ANILKMINSZUDMA-RYUDHWBXSA-N 1 2 316.426 4.448 20 0 DIADLO CC[N@H+](Cc1csc([C@@H](C)OC)n1)Cc1ccc(C)cc1 ZINC000530627914 1045702118 /nfs/dbraw/zinc/70/21/18/1045702118.db2.gz IXDZTEMSIMCIRU-CQSZACIVSA-N 1 2 304.459 4.181 20 0 DIADLO CC[N@@H+](Cc1csc([C@@H](C)OC)n1)Cc1ccc(C)cc1 ZINC000530627914 1045702133 /nfs/dbraw/zinc/70/21/33/1045702133.db2.gz IXDZTEMSIMCIRU-CQSZACIVSA-N 1 2 304.459 4.181 20 0 DIADLO COC(C)(C)c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC000629741837 1045707424 /nfs/dbraw/zinc/70/74/24/1045707424.db2.gz FCLSKKJEOQQJQM-UHFFFAOYSA-N 1 2 306.409 4.480 20 0 DIADLO c1oc(-c2ccccc2)nc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000530724413 1045719141 /nfs/dbraw/zinc/71/91/41/1045719141.db2.gz FVSGGWRVHOVYJI-SFHVURJKSA-N 1 2 305.381 4.074 20 0 DIADLO c1oc(-c2ccccc2)nc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000530724413 1045719149 /nfs/dbraw/zinc/71/91/49/1045719149.db2.gz FVSGGWRVHOVYJI-SFHVURJKSA-N 1 2 305.381 4.074 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(Br)n2)[C@@H]1c1ccccc1 ZINC000779436143 1045726990 /nfs/dbraw/zinc/72/69/90/1045726990.db2.gz BXYQDDLVAXZQAU-WBMJQRKESA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(Br)n2)[C@@H]1c1ccccc1 ZINC000779436143 1045726996 /nfs/dbraw/zinc/72/69/96/1045726996.db2.gz BXYQDDLVAXZQAU-WBMJQRKESA-N 1 2 317.230 4.037 20 0 DIADLO CCCc1nc(C)c(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)o1 ZINC000451836457 1045734384 /nfs/dbraw/zinc/73/43/84/1045734384.db2.gz ASPXMCKAWPQYRT-QGZVFWFLSA-N 1 2 300.402 4.256 20 0 DIADLO CCCc1nc(C)c(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)o1 ZINC000451836457 1045734396 /nfs/dbraw/zinc/73/43/96/1045734396.db2.gz ASPXMCKAWPQYRT-QGZVFWFLSA-N 1 2 300.402 4.256 20 0 DIADLO Cc1ncsc1C[N@@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC000451880617 1045739609 /nfs/dbraw/zinc/73/96/09/1045739609.db2.gz XCTSVOMQFLTVER-HNNXBMFYSA-N 1 2 312.442 4.055 20 0 DIADLO Cc1ncsc1C[N@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC000451880617 1045739620 /nfs/dbraw/zinc/73/96/20/1045739620.db2.gz XCTSVOMQFLTVER-HNNXBMFYSA-N 1 2 312.442 4.055 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@H]2c2ccccn2)cs1 ZINC000530963475 1045759367 /nfs/dbraw/zinc/75/93/67/1045759367.db2.gz ULEAUICODJVXGQ-INIZCTEOSA-N 1 2 301.459 4.218 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@H]2c2ccccn2)cs1 ZINC000530963475 1045759375 /nfs/dbraw/zinc/75/93/75/1045759375.db2.gz ULEAUICODJVXGQ-INIZCTEOSA-N 1 2 301.459 4.218 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2nc(C(C)(C)C)no2)cc1C ZINC000452037476 1045764855 /nfs/dbraw/zinc/76/48/55/1045764855.db2.gz BFQRQBFJMYBDBU-AWEZNQCLSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2nc(C(C)(C)C)no2)cc1C ZINC000452037476 1045764870 /nfs/dbraw/zinc/76/48/70/1045764870.db2.gz BFQRQBFJMYBDBU-AWEZNQCLSA-N 1 2 301.434 4.177 20 0 DIADLO C[C@H]1CC/C(=C/C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1 ZINC000753597809 1045772428 /nfs/dbraw/zinc/77/24/28/1045772428.db2.gz COCWBOMAVPVFIV-VWLVURMCSA-N 1 2 315.804 4.211 20 0 DIADLO C[C@H]([NH2+]c1ccc(N2CCC(O)CC2)cc1)C1CCCCCC1 ZINC000753701997 1045791623 /nfs/dbraw/zinc/79/16/23/1045791623.db2.gz CBQZRKZBWDAKKZ-INIZCTEOSA-N 1 2 316.489 4.419 20 0 DIADLO Cc1cc(CSCc2c[nH+]c(N(C)C)c3ccccc23)no1 ZINC000901711763 1045795448 /nfs/dbraw/zinc/79/54/48/1045795448.db2.gz MCNKGZCPFDDBRE-UHFFFAOYSA-N 1 2 313.426 4.031 20 0 DIADLO c1coc([C@H]([NH2+]Cc2ccnn2CC2CCC2)c2ccccc2)c1 ZINC000631036693 1045799783 /nfs/dbraw/zinc/79/97/83/1045799783.db2.gz HTUJXYONSVCSBG-HXUWFJFHSA-N 1 2 321.424 4.155 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)C1CCCCCCC1 ZINC000192261202 1045802164 /nfs/dbraw/zinc/80/21/64/1045802164.db2.gz ZRQPTJXVIIQYTG-UHFFFAOYSA-N 1 2 319.493 4.045 20 0 DIADLO CC[N@H+](Cc1ccncc1)[C@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000754052918 1045839685 /nfs/dbraw/zinc/83/96/85/1045839685.db2.gz DFBPPXYDUBVGLL-OAHLLOKOSA-N 1 2 322.412 4.023 20 0 DIADLO CC[N@@H+](Cc1ccncc1)[C@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000754052918 1045839704 /nfs/dbraw/zinc/83/97/04/1045839704.db2.gz DFBPPXYDUBVGLL-OAHLLOKOSA-N 1 2 322.412 4.023 20 0 DIADLO CC1(C)CC[C@@H]1C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001125053129 1045842849 /nfs/dbraw/zinc/84/28/49/1045842849.db2.gz WYPIYVUZFAELBC-QGZVFWFLSA-N 1 2 323.440 4.261 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)CCSC(C)(C)C)cs1 ZINC000801923512 1045843501 /nfs/dbraw/zinc/84/35/01/1045843501.db2.gz JHSNRGYSOPSWAS-LBPRGKRZSA-N 1 2 316.536 4.204 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)CCSC(C)(C)C)cs1 ZINC000801923512 1045843521 /nfs/dbraw/zinc/84/35/21/1045843521.db2.gz JHSNRGYSOPSWAS-LBPRGKRZSA-N 1 2 316.536 4.204 20 0 DIADLO FC[C@H]([NH2+]Cc1cccc(OC(F)F)c1)c1ccc(F)cc1 ZINC000631282834 1045846177 /nfs/dbraw/zinc/84/61/77/1045846177.db2.gz DXAMSDCDTZCBDT-HNNXBMFYSA-N 1 2 313.294 4.228 20 0 DIADLO C[C@H]1CN(c2ccc([NH2+]C3CCC4(CC4)CC3)cc2)C[C@H](C)O1 ZINC000754100169 1045846565 /nfs/dbraw/zinc/84/65/65/1045846565.db2.gz IRRROLWWBHNKHZ-HOTGVXAUSA-N 1 2 314.473 4.435 20 0 DIADLO COc1ccc(C[NH2+][C@H](CF)c2ccc(F)cc2)cc1Cl ZINC000631285147 1045847763 /nfs/dbraw/zinc/84/77/63/1045847763.db2.gz YEMAGRYKJQPELU-OAHLLOKOSA-N 1 2 311.759 4.288 20 0 DIADLO CC(C)[C@H]1C[C@@H]([NH2+]c2ccc(N3CCSCC3)cc2)CS1 ZINC000754130810 1045852072 /nfs/dbraw/zinc/85/20/72/1045852072.db2.gz RUGVWFAYOIGDDC-NVXWUHKLSA-N 1 2 322.543 4.182 20 0 DIADLO c1csc([C@@H]([NH2+][C@H]2CCCc3ncccc32)c2ccccc2)n1 ZINC000631577614 1045873607 /nfs/dbraw/zinc/87/36/07/1045873607.db2.gz RHGFRXHRARDWHK-ROUUACIJSA-N 1 2 321.449 4.295 20 0 DIADLO c1csc([C@@H]([NH2+][C@@H]2CCCc3ncccc32)c2ccccc2)n1 ZINC000631577600 1045874024 /nfs/dbraw/zinc/87/40/24/1045874024.db2.gz RHGFRXHRARDWHK-MSOLQXFVSA-N 1 2 321.449 4.295 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)c1 ZINC000531688395 1045892772 /nfs/dbraw/zinc/89/27/72/1045892772.db2.gz SDFNEMVRJITFPK-QFBILLFUSA-N 1 2 305.425 4.169 20 0 DIADLO c1cn(C2CC2)c(CNc2[nH+]c3ccccc3n2C2CCCC2)n1 ZINC000902037785 1045895130 /nfs/dbraw/zinc/89/51/30/1045895130.db2.gz PDNHSGULFMQHHB-UHFFFAOYSA-N 1 2 321.428 4.295 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2cnc(Cl)s2)s1 ZINC000079321056 1045904254 /nfs/dbraw/zinc/90/42/54/1045904254.db2.gz FRBDNZUGDLHQCS-QMMMGPOBSA-N 1 2 301.868 4.063 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2cnc(Cl)s2)s1 ZINC000079321056 1045904263 /nfs/dbraw/zinc/90/42/63/1045904263.db2.gz FRBDNZUGDLHQCS-QMMMGPOBSA-N 1 2 301.868 4.063 20 0 DIADLO Cc1[nH]c(CNc2ncccc2O[C@@H](C)c2ccccc2)[nH+]c1C ZINC000902066714 1045905377 /nfs/dbraw/zinc/90/53/77/1045905377.db2.gz RRAAFMSSOWNTJR-HNNXBMFYSA-N 1 2 322.412 4.174 20 0 DIADLO Fc1cccc(C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)c1F ZINC000631725895 1045909078 /nfs/dbraw/zinc/90/90/78/1045909078.db2.gz KMMGHBOSGBNYCO-INIZCTEOSA-N 1 2 305.372 4.099 20 0 DIADLO C[C@]1(C[N@@H+]2CCc3c4ccccc4[nH]c3C2)CC1(Cl)Cl ZINC000828505316 1045912846 /nfs/dbraw/zinc/91/28/46/1045912846.db2.gz NGKIGEUQCZLUQS-OAHLLOKOSA-N 1 2 309.240 4.110 20 0 DIADLO C[C@]1(C[N@H+]2CCc3c4ccccc4[nH]c3C2)CC1(Cl)Cl ZINC000828505316 1045912856 /nfs/dbraw/zinc/91/28/56/1045912856.db2.gz NGKIGEUQCZLUQS-OAHLLOKOSA-N 1 2 309.240 4.110 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2cc(Cl)nc(Cl)c2)n1 ZINC000754719996 1045917785 /nfs/dbraw/zinc/91/77/85/1045917785.db2.gz HCSSHHUAKJETHU-MRVPVSSYSA-N 1 2 302.230 4.004 20 0 DIADLO Oc1cccc2c1CCC[C@@H]2[NH2+][C@@H](CF)c1ccc(F)cc1 ZINC000631798182 1045919822 /nfs/dbraw/zinc/91/98/22/1045919822.db2.gz OBZPXIWVMUVODF-IRXDYDNUSA-N 1 2 303.352 4.209 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](C)c2csc3ccccc23)n1 ZINC000754738283 1045922851 /nfs/dbraw/zinc/92/28/51/1045922851.db2.gz ZYERSIRJZGSLRP-LLVKDONJSA-N 1 2 301.415 4.259 20 0 DIADLO Cc1cccc(C[N@H+]2CCO[C@](C)(c3ccc(F)cc3)C2)c1F ZINC001137678603 1045929994 /nfs/dbraw/zinc/92/99/94/1045929994.db2.gz PGUBGJSAESRMEE-IBGZPJMESA-N 1 2 317.379 4.021 20 0 DIADLO Cc1cccc(C[N@@H+]2CCO[C@](C)(c3ccc(F)cc3)C2)c1F ZINC001137678603 1045929990 /nfs/dbraw/zinc/92/99/90/1045929990.db2.gz PGUBGJSAESRMEE-IBGZPJMESA-N 1 2 317.379 4.021 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccncc2Br)cc1C ZINC001137697405 1045938291 /nfs/dbraw/zinc/93/82/91/1045938291.db2.gz RYBZGZRFSPUCMR-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccncc2Br)cc1C ZINC001137697405 1045938305 /nfs/dbraw/zinc/93/83/05/1045938305.db2.gz RYBZGZRFSPUCMR-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO C[C@@H]([NH2+]c1ccc(N2CCOCC2)cc1)[C@@H]1C[C@H]1c1ccccc1 ZINC000802304499 1045947672 /nfs/dbraw/zinc/94/76/72/1045947672.db2.gz HSOVLMGCBUFVFM-CZAAIQMYSA-N 1 2 322.452 4.127 20 0 DIADLO COc1ccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1OC ZINC000192901763 1045953200 /nfs/dbraw/zinc/95/32/00/1045953200.db2.gz WPXXEHUMVNTRJF-CQSZACIVSA-N 1 2 323.396 4.063 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1cccc(-c3cncnc3)c1)C2 ZINC001137771517 1045963692 /nfs/dbraw/zinc/96/36/92/1045963692.db2.gz IHPXTOSQEMVNJO-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1cccc(-c3cncnc3)c1)C2 ZINC001137771517 1045963698 /nfs/dbraw/zinc/96/36/98/1045963698.db2.gz IHPXTOSQEMVNJO-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Nc1cc(CSc2nc(-c3ccc(F)cc3)cs2)cc[nH+]1 ZINC000193048579 1045965319 /nfs/dbraw/zinc/96/53/19/1045965319.db2.gz DNBMMPCTGWDRKB-UHFFFAOYSA-N 1 2 317.414 4.219 20 0 DIADLO CCC[N@H+](Cc1ccccc1)Cc1cccnc1Br ZINC001137797832 1045968097 /nfs/dbraw/zinc/96/80/97/1045968097.db2.gz GSCPDJHQKPWBOY-UHFFFAOYSA-N 1 2 319.246 4.256 20 0 DIADLO CCC[N@@H+](Cc1ccccc1)Cc1cccnc1Br ZINC001137797832 1045968115 /nfs/dbraw/zinc/96/81/15/1045968115.db2.gz GSCPDJHQKPWBOY-UHFFFAOYSA-N 1 2 319.246 4.256 20 0 DIADLO CC(C)[N@H+](Cc1ccccc1)Cc1cccnc1Br ZINC001137792708 1045968486 /nfs/dbraw/zinc/96/84/86/1045968486.db2.gz OMRHXAOGRGHOLM-UHFFFAOYSA-N 1 2 319.246 4.255 20 0 DIADLO CC(C)[N@@H+](Cc1ccccc1)Cc1cccnc1Br ZINC001137792708 1045968495 /nfs/dbraw/zinc/96/84/95/1045968495.db2.gz OMRHXAOGRGHOLM-UHFFFAOYSA-N 1 2 319.246 4.255 20 0 DIADLO Cc1cc(NCc2cnc(-c3ccco3)s2)ccc1[NH+](C)C ZINC000193160410 1045973374 /nfs/dbraw/zinc/97/33/74/1045973374.db2.gz DIGAVWIITYELLV-UHFFFAOYSA-N 1 2 313.426 4.390 20 0 DIADLO CC1(F)CC[NH+](Cc2cc(Br)ccc2Cl)CC1 ZINC001137827320 1045975394 /nfs/dbraw/zinc/97/53/94/1045975394.db2.gz LCNBJLFFPQGMBR-UHFFFAOYSA-N 1 2 320.633 4.427 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cc(F)cc(F)c1F)CCC2 ZINC001137875035 1045994059 /nfs/dbraw/zinc/99/40/59/1045994059.db2.gz GESDNHYMKRXXAS-UHFFFAOYSA-N 1 2 321.342 4.061 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cc(F)cc(F)c1F)CCC2 ZINC001137875035 1045994065 /nfs/dbraw/zinc/99/40/65/1045994065.db2.gz GESDNHYMKRXXAS-UHFFFAOYSA-N 1 2 321.342 4.061 20 0 DIADLO Cc1ccccc1O[C@H]1CC[N@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137872224 1045994191 /nfs/dbraw/zinc/99/41/91/1045994191.db2.gz HPMKXSBIKVXBFY-HNNXBMFYSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1ccccc1O[C@H]1CC[N@@H+](Cc2cc(F)cc(F)c2F)C1 ZINC001137872224 1045994200 /nfs/dbraw/zinc/99/42/00/1045994200.db2.gz HPMKXSBIKVXBFY-HNNXBMFYSA-N 1 2 321.342 4.066 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(F)cc(F)c1F ZINC001137872610 1045995296 /nfs/dbraw/zinc/99/52/96/1045995296.db2.gz XORLKOQJHUNOBC-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1cc(F)cc(F)c1F ZINC001137872610 1045995314 /nfs/dbraw/zinc/99/53/14/1045995314.db2.gz XORLKOQJHUNOBC-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(F)F ZINC000453252764 1046005471 /nfs/dbraw/zinc/00/54/71/1046005471.db2.gz VQGWIBFODQTOKK-JOYOIKCWSA-N 1 2 311.294 4.322 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1csc(N)n1)c1ccc(Cl)cc1F ZINC000902497851 1046007516 /nfs/dbraw/zinc/00/75/16/1046007516.db2.gz ANDYAHKWENCXIG-ZDUSSCGKSA-N 1 2 313.829 4.005 20 0 DIADLO Clc1cc(C[N@@H+]2CCC=C(c3cccnc3)C2)cc(Cl)n1 ZINC000829893623 1046024141 /nfs/dbraw/zinc/02/41/41/1046024141.db2.gz XRJLXONTRIIXFM-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1cc(C[N@H+]2CCC=C(c3cccnc3)C2)cc(Cl)n1 ZINC000829893623 1046024147 /nfs/dbraw/zinc/02/41/47/1046024147.db2.gz XRJLXONTRIIXFM-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)nc1 ZINC000755945699 1046029845 /nfs/dbraw/zinc/02/98/45/1046029845.db2.gz SEJFWFRXLJNITL-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)nc1 ZINC000755945699 1046029854 /nfs/dbraw/zinc/02/98/54/1046029854.db2.gz SEJFWFRXLJNITL-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CC(C)[C@H]1C[C@@H]([NH2+]Cc2nn(C)cc2Cl)c2ccccc21 ZINC000453309899 1046030620 /nfs/dbraw/zinc/03/06/20/1046030620.db2.gz FARCKCWSCTZDPB-GDBMZVCRSA-N 1 2 303.837 4.048 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(OC(C)(C)C)cc1 ZINC000453312539 1046031826 /nfs/dbraw/zinc/03/18/26/1046031826.db2.gz HIJDZJFQUZVRAE-GFCCVEGCSA-N 1 2 321.852 4.102 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2cccc(Cl)c2F)c1OC ZINC001137962638 1046035381 /nfs/dbraw/zinc/03/53/81/1046035381.db2.gz UUKJGLMKRDHIIW-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2cccc(Cl)c2F)c1OC ZINC001137962638 1046035395 /nfs/dbraw/zinc/03/53/95/1046035395.db2.gz UUKJGLMKRDHIIW-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO Cn1cc(Cl)c(C[NH2+][C@H]2CCCCc3ccc(Cl)cc32)n1 ZINC000453319471 1046035465 /nfs/dbraw/zinc/03/54/65/1046035465.db2.gz LAQTWTSXQFDXIZ-HNNXBMFYSA-N 1 2 324.255 4.284 20 0 DIADLO Fc1c(Cl)cccc1C[N@@H+]1CC[C@@H]1COCc1ccccc1 ZINC001137961535 1046036780 /nfs/dbraw/zinc/03/67/80/1046036780.db2.gz QAQPUJVSWYWORE-MRXNPFEDSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1c(Cl)cccc1C[N@H+]1CC[C@@H]1COCc1ccccc1 ZINC001137961535 1046036787 /nfs/dbraw/zinc/03/67/87/1046036787.db2.gz QAQPUJVSWYWORE-MRXNPFEDSA-N 1 2 319.807 4.270 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2cccnc2)c(F)c1F ZINC001137968971 1046037662 /nfs/dbraw/zinc/03/76/62/1046037662.db2.gz ZUIUBZUZKRTYSY-INIZCTEOSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H]2c2cccnc2)c(F)c1F ZINC001137968971 1046037676 /nfs/dbraw/zinc/03/76/76/1046037676.db2.gz ZUIUBZUZKRTYSY-INIZCTEOSA-N 1 2 302.368 4.395 20 0 DIADLO CCC[C@@H]1CCCC[C@@H]1C[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000453339385 1046042019 /nfs/dbraw/zinc/04/20/19/1046042019.db2.gz BKYWFSJAOVPZSJ-IIAWOOMASA-N 1 2 318.490 4.152 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c1 ZINC001137997499 1046048922 /nfs/dbraw/zinc/04/89/22/1046048922.db2.gz MFJFMQOBLALZNS-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)c1 ZINC001137997499 1046048932 /nfs/dbraw/zinc/04/89/32/1046048932.db2.gz MFJFMQOBLALZNS-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1ccc(F)c(C[NH+]2CCC(c3ccncc3)CC2)c1Cl ZINC001138003881 1046051654 /nfs/dbraw/zinc/05/16/54/1046051654.db2.gz LQISNURVOIGMQV-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Cc1ccc(C[N@@H+]2CCOC[C@H]2c2cccnc2)c2ccccc12 ZINC001138017956 1046061114 /nfs/dbraw/zinc/06/11/14/1046061114.db2.gz CFTNXLMBDXEZLO-NRFANRHFSA-N 1 2 318.420 4.117 20 0 DIADLO Cc1ccc(C[N@H+]2CCOC[C@H]2c2cccnc2)c2ccccc12 ZINC001138017956 1046061127 /nfs/dbraw/zinc/06/11/27/1046061127.db2.gz CFTNXLMBDXEZLO-NRFANRHFSA-N 1 2 318.420 4.117 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+][C@@H]1C[C@H](C)n2ccnc21 ZINC000453378647 1046073662 /nfs/dbraw/zinc/07/36/62/1046073662.db2.gz ZIIMFHDYXNXHOU-SLEUVZQESA-N 1 2 319.836 4.292 20 0 DIADLO CC(C)c1cc(C[NH2+][C@H](C)c2ccc(C(F)(F)F)cn2)on1 ZINC000902804298 1046073902 /nfs/dbraw/zinc/07/39/02/1046073902.db2.gz OBOKQQOQGJAOTO-SNVBAGLBSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1cccc2c1CC(C)(C)[N@H+](Cc1nnc(C(C)(C)C)o1)C2 ZINC000830750303 1046095436 /nfs/dbraw/zinc/09/54/36/1046095436.db2.gz HULFSKKTRQOHTE-UHFFFAOYSA-N 1 2 313.445 4.012 20 0 DIADLO Cc1cccc2c1CC(C)(C)[N@@H+](Cc1nnc(C(C)(C)C)o1)C2 ZINC000830750303 1046095452 /nfs/dbraw/zinc/09/54/52/1046095452.db2.gz HULFSKKTRQOHTE-UHFFFAOYSA-N 1 2 313.445 4.012 20 0 DIADLO CC(C)c1nc(C[N@H+](C)Cc2ccc3ncccc3c2)cs1 ZINC001138111456 1046098560 /nfs/dbraw/zinc/09/85/60/1046098560.db2.gz AGNUKXJSCHWYPF-UHFFFAOYSA-N 1 2 311.454 4.447 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)Cc2ccc3ncccc3c2)cs1 ZINC001138111456 1046098572 /nfs/dbraw/zinc/09/85/72/1046098572.db2.gz AGNUKXJSCHWYPF-UHFFFAOYSA-N 1 2 311.454 4.447 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2CC[C@@H]2COCc2ccccc2)c1F ZINC001138118543 1046100610 /nfs/dbraw/zinc/10/06/10/1046100610.db2.gz NQASTQIOQVHFRR-MRXNPFEDSA-N 1 2 317.379 4.064 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2CC[C@@H]2COCc2ccccc2)c1F ZINC001138118543 1046100617 /nfs/dbraw/zinc/10/06/17/1046100617.db2.gz NQASTQIOQVHFRR-MRXNPFEDSA-N 1 2 317.379 4.064 20 0 DIADLO CC[N@H+](Cc1noc(-c2ccccc2C)n1)Cc1ccc(C)cc1 ZINC000532124391 1046102397 /nfs/dbraw/zinc/10/23/97/1046102397.db2.gz IFXUHFHXQLHLRD-UHFFFAOYSA-N 1 2 321.424 4.376 20 0 DIADLO CC[N@@H+](Cc1noc(-c2ccccc2C)n1)Cc1ccc(C)cc1 ZINC000532124391 1046102409 /nfs/dbraw/zinc/10/24/09/1046102409.db2.gz IFXUHFHXQLHLRD-UHFFFAOYSA-N 1 2 321.424 4.376 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@H](C)c3cccc(F)c3)cc2[nH+]1 ZINC000532186027 1046107404 /nfs/dbraw/zinc/10/74/04/1046107404.db2.gz GVXSXMPOXAIREB-NSHDSACASA-N 1 2 311.360 4.143 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1cc(C)ccc1OC(F)F ZINC000925253171 1046108042 /nfs/dbraw/zinc/10/80/42/1046108042.db2.gz CQLHVNHEUBMHOU-ZDUSSCGKSA-N 1 2 322.355 4.060 20 0 DIADLO CCc1cc(C[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)on1 ZINC000532231948 1046121958 /nfs/dbraw/zinc/12/19/58/1046121958.db2.gz BMMXMAHOBOWRQP-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO CCc1cc(C[NH2+][C@H](CC)c2ccccc2Br)on1 ZINC000532232675 1046122322 /nfs/dbraw/zinc/12/23/22/1046122322.db2.gz WQUOMYFULSYRHR-OAHLLOKOSA-N 1 2 323.234 4.240 20 0 DIADLO CC/C(C)=C\C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000831181559 1046123024 /nfs/dbraw/zinc/12/30/24/1046123024.db2.gz PVDBULZJAIJRMA-KAMYIIQDSA-N 1 2 309.413 4.181 20 0 DIADLO CC(C)([NH2+]Cc1nc(CC2CC2)no1)c1ccc2ccccc2c1 ZINC000639897267 1046138405 /nfs/dbraw/zinc/13/84/05/1046138405.db2.gz NDMQRMZTGJSMGM-UHFFFAOYSA-N 1 2 321.424 4.200 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2ccc(C(F)(F)F)s2)c1 ZINC000903042787 1046147561 /nfs/dbraw/zinc/14/75/61/1046147561.db2.gz ICIGGQKPZRXZOE-VIFPVBQESA-N 1 2 316.348 4.481 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[NH2+]Cc1nc(C)cs1 ZINC000903067397 1046154614 /nfs/dbraw/zinc/15/46/14/1046154614.db2.gz PHCNLTWCZCRSSJ-CYBMUJFWSA-N 1 2 322.861 4.281 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(F)c1F)c1ccc(C(F)(F)F)cn1 ZINC000903077048 1046156259 /nfs/dbraw/zinc/15/62/59/1046156259.db2.gz FCWMTILXNRGULH-VIFPVBQESA-N 1 2 316.273 4.229 20 0 DIADLO Cn1c2ccccc2nc1C[N@@H+]1CCC[C@H]1c1ccccc1F ZINC001138379476 1046160436 /nfs/dbraw/zinc/16/04/36/1046160436.db2.gz XOJQLDOSZVBCAY-KRWDZBQOSA-N 1 2 309.388 4.050 20 0 DIADLO Cn1c2ccccc2nc1C[N@H+]1CCC[C@H]1c1ccccc1F ZINC001138379476 1046160442 /nfs/dbraw/zinc/16/04/42/1046160442.db2.gz XOJQLDOSZVBCAY-KRWDZBQOSA-N 1 2 309.388 4.050 20 0 DIADLO COc1ccc2c(c1Cl)[C@@H]([NH2+]Cc1ncc(C)s1)CCC2 ZINC000903102731 1046163008 /nfs/dbraw/zinc/16/30/08/1046163008.db2.gz BLGRXVPLMFSUQP-LBPRGKRZSA-N 1 2 322.861 4.281 20 0 DIADLO COc1ccc(CNc2ccc([NH+](C)C)cc2C)cc1Cl ZINC000086584360 1046164607 /nfs/dbraw/zinc/16/46/07/1046164607.db2.gz UBPOGEDWDOYHQE-UHFFFAOYSA-N 1 2 304.821 4.335 20 0 DIADLO Fc1ccc2oc(C[NH2+]Cc3cc(C4CC4)ccc3F)nc2c1 ZINC000634982460 1046170157 /nfs/dbraw/zinc/17/01/57/1046170157.db2.gz MBSCFLBWKVVOKT-UHFFFAOYSA-N 1 2 314.335 4.273 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3C[C@H](C)OC[C@@H]3c3ccccc3)cc2c1 ZINC001138420937 1046174448 /nfs/dbraw/zinc/17/44/48/1046174448.db2.gz VDPRPOWHSDDRBW-HRAATJIYSA-N 1 2 320.436 4.438 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3C[C@H](C)OC[C@@H]3c3ccccc3)cc2c1 ZINC001138420937 1046174451 /nfs/dbraw/zinc/17/44/51/1046174451.db2.gz VDPRPOWHSDDRBW-HRAATJIYSA-N 1 2 320.436 4.438 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCCC[C@H]2c2cccnc2)cc1F ZINC001138424470 1046176987 /nfs/dbraw/zinc/17/69/87/1046176987.db2.gz WWDRIBDYSBQRCJ-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCCC[C@H]2c2cccnc2)cc1F ZINC001138424470 1046176990 /nfs/dbraw/zinc/17/69/90/1046176990.db2.gz WWDRIBDYSBQRCJ-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CC[N@H+](CC(=O)Nc1ccccc1C(C)(C)C)Cc1ccoc1 ZINC000102408460 1046179460 /nfs/dbraw/zinc/17/94/60/1046179460.db2.gz AJAFGRDXUZIEHW-UHFFFAOYSA-N 1 2 314.429 4.038 20 0 DIADLO CC[N@@H+](CC(=O)Nc1ccccc1C(C)(C)C)Cc1ccoc1 ZINC000102408460 1046179468 /nfs/dbraw/zinc/17/94/68/1046179468.db2.gz AJAFGRDXUZIEHW-UHFFFAOYSA-N 1 2 314.429 4.038 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1nc(-c2cccs2)oc1C ZINC000102407980 1046179655 /nfs/dbraw/zinc/17/96/55/1046179655.db2.gz OHZDPZSYWMBYFT-UHFFFAOYSA-N 1 2 302.399 4.327 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1nc(-c2cccs2)oc1C ZINC000102407980 1046179662 /nfs/dbraw/zinc/17/96/62/1046179662.db2.gz OHZDPZSYWMBYFT-UHFFFAOYSA-N 1 2 302.399 4.327 20 0 DIADLO CCOc1ccc2ccccc2c1C[N@@H+]1CCC(F)(F)[C@H](F)C1 ZINC001138440061 1046183178 /nfs/dbraw/zinc/18/31/78/1046183178.db2.gz OIKQXPUXSQVTHZ-QGZVFWFLSA-N 1 2 323.358 4.418 20 0 DIADLO CCOc1ccc2ccccc2c1C[N@H+]1CCC(F)(F)[C@H](F)C1 ZINC001138440061 1046183184 /nfs/dbraw/zinc/18/31/84/1046183184.db2.gz OIKQXPUXSQVTHZ-QGZVFWFLSA-N 1 2 323.358 4.418 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CCCc3c(OC)ccc(Cl)c32)co1 ZINC000903188348 1046187060 /nfs/dbraw/zinc/18/70/60/1046187060.db2.gz ZCPFRRACFDIHSI-CQSZACIVSA-N 1 2 320.820 4.066 20 0 DIADLO Fc1ccc2c(c1Cl)[C@H]([NH2+]Cc1nc3c(s1)CCC3)CC2 ZINC000903191262 1046189912 /nfs/dbraw/zinc/18/99/12/1046189912.db2.gz RMZLMMKVNRXFCM-GFCCVEGCSA-N 1 2 322.836 4.201 20 0 DIADLO Cc1c2ccccc2sc1C[N@@H+]1CCOC[C@H]1c1cccnc1 ZINC001138464021 1046192190 /nfs/dbraw/zinc/19/21/90/1046192190.db2.gz PHIYEYXGIOTELM-KRWDZBQOSA-N 1 2 324.449 4.178 20 0 DIADLO Cc1c2ccccc2sc1C[N@H+]1CCOC[C@H]1c1cccnc1 ZINC001138464021 1046192196 /nfs/dbraw/zinc/19/21/96/1046192196.db2.gz PHIYEYXGIOTELM-KRWDZBQOSA-N 1 2 324.449 4.178 20 0 DIADLO CC(C)c1nc(C[N@H+](C)[C@@H](C)[C@@H](C)c2ccc(Cl)cc2)no1 ZINC000475744949 1046192671 /nfs/dbraw/zinc/19/26/71/1046192671.db2.gz SNVJGFKXVNMKPE-OLZOCXBDSA-N 1 2 321.852 4.470 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)[C@@H](C)[C@@H](C)c2ccc(Cl)cc2)no1 ZINC000475744949 1046192677 /nfs/dbraw/zinc/19/26/77/1046192677.db2.gz SNVJGFKXVNMKPE-OLZOCXBDSA-N 1 2 321.852 4.470 20 0 DIADLO CC(C)c1nc(C[N@H+](C)[C@H](C)[C@H](C)c2ccc(Cl)cc2)no1 ZINC000475744950 1046193239 /nfs/dbraw/zinc/19/32/39/1046193239.db2.gz SNVJGFKXVNMKPE-QWHCGFSZSA-N 1 2 321.852 4.470 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)[C@H](C)[C@H](C)c2ccc(Cl)cc2)no1 ZINC000475744950 1046193241 /nfs/dbraw/zinc/19/32/41/1046193241.db2.gz SNVJGFKXVNMKPE-QWHCGFSZSA-N 1 2 321.852 4.470 20 0 DIADLO COc1c(Cl)cc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)cc1Cl ZINC001138473380 1046194751 /nfs/dbraw/zinc/19/47/51/1046194751.db2.gz XGQRIDUZZYKCKR-SECBINFHSA-N 1 2 324.198 4.479 20 0 DIADLO COc1c(Cl)cc(C[N@H+]2CCC(F)(F)[C@H](C)C2)cc1Cl ZINC001138473380 1046194753 /nfs/dbraw/zinc/19/47/53/1046194753.db2.gz XGQRIDUZZYKCKR-SECBINFHSA-N 1 2 324.198 4.479 20 0 DIADLO COc1ccnc(C[N@H+](C)[C@H](C)[C@H](C)c2ccc(Cl)cc2)c1 ZINC000475745778 1046195022 /nfs/dbraw/zinc/19/50/22/1046195022.db2.gz WZUQGNGWJMNINS-UONOGXRCSA-N 1 2 318.848 4.368 20 0 DIADLO COc1ccnc(C[N@@H+](C)[C@H](C)[C@H](C)c2ccc(Cl)cc2)c1 ZINC000475745778 1046195030 /nfs/dbraw/zinc/19/50/30/1046195030.db2.gz WZUQGNGWJMNINS-UONOGXRCSA-N 1 2 318.848 4.368 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CCCO1 ZINC001204695694 1046195189 /nfs/dbraw/zinc/19/51/89/1046195189.db2.gz YTHOWSFKNYZQGH-ZDUSSCGKSA-N 1 2 305.805 4.211 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CCCO1 ZINC001204695694 1046195197 /nfs/dbraw/zinc/19/51/97/1046195197.db2.gz YTHOWSFKNYZQGH-ZDUSSCGKSA-N 1 2 305.805 4.211 20 0 DIADLO C[C@@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1cnn(CC2CCC2)c1 ZINC000903214759 1046195940 /nfs/dbraw/zinc/19/59/40/1046195940.db2.gz XFMAUPNQPNUJRF-ACJLOTCBSA-N 1 2 319.399 4.184 20 0 DIADLO C[C@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1cnn(CC2CCC2)c1 ZINC000903214761 1046196230 /nfs/dbraw/zinc/19/62/30/1046196230.db2.gz XFMAUPNQPNUJRF-SCLBCKFNSA-N 1 2 319.399 4.184 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1cc(OC)no1 ZINC000925262598 1046199788 /nfs/dbraw/zinc/19/97/88/1046199788.db2.gz NOWDAUDWHHOKHP-UONOGXRCSA-N 1 2 318.417 4.020 20 0 DIADLO c1oc(C2CC2)nc1C[NH2+][C@H]1CC2(CCC2)Oc2ccccc21 ZINC000757701983 1046203330 /nfs/dbraw/zinc/20/33/30/1046203330.db2.gz CWTLOJKQQWXGDQ-INIZCTEOSA-N 1 2 310.397 4.088 20 0 DIADLO COc1ccc(-c2ccc(C[N@@H+]3Cc4cccnc4C3)cc2)cc1 ZINC001138514678 1046207140 /nfs/dbraw/zinc/20/71/40/1046207140.db2.gz CDNBGVJUDFKWEN-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccc(-c2ccc(C[N@H+]3Cc4cccnc4C3)cc2)cc1 ZINC001138514678 1046207146 /nfs/dbraw/zinc/20/71/46/1046207146.db2.gz CDNBGVJUDFKWEN-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2C/C=C/c2ccc(F)cc2F)no1 ZINC000757733432 1046208484 /nfs/dbraw/zinc/20/84/84/1046208484.db2.gz UVERJLQSEFPCCQ-NKEDHYFDSA-N 1 2 304.340 4.112 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2C/C=C/c2ccc(F)cc2F)no1 ZINC000757733432 1046208499 /nfs/dbraw/zinc/20/84/99/1046208499.db2.gz UVERJLQSEFPCCQ-NKEDHYFDSA-N 1 2 304.340 4.112 20 0 DIADLO COc1ccc(-c2ccc(C[N@H+](C)Cc3nccs3)cc2)cc1 ZINC001138517244 1046208781 /nfs/dbraw/zinc/20/87/81/1046208781.db2.gz AEPMXYJRKDMDRJ-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1ccc(-c2ccc(C[N@@H+](C)Cc3nccs3)cc2)cc1 ZINC001138517244 1046208793 /nfs/dbraw/zinc/20/87/93/1046208793.db2.gz AEPMXYJRKDMDRJ-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO CC(C)C[C@H]([NH2+][C@@H]1c2ccccc2OC[C@@H]1F)c1ccncc1 ZINC000903266282 1046214050 /nfs/dbraw/zinc/21/40/50/1046214050.db2.gz MPJYCCGTKHRPDG-JENIJYKNSA-N 1 2 314.404 4.230 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2CC[C@H]2c2ccc(F)cc2)c(C)[nH+]1 ZINC000636581471 1046231269 /nfs/dbraw/zinc/23/12/69/1046231269.db2.gz CHWHBYSEILUGAJ-IRXDYDNUSA-N 1 2 312.388 4.278 20 0 DIADLO COc1cccc2c1CCC[C@@H]2[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000903313295 1046234931 /nfs/dbraw/zinc/23/49/31/1046234931.db2.gz MVEXOVLTXBVLRJ-HNNXBMFYSA-N 1 2 314.429 4.148 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1cnc2ccsc2c1 ZINC000903312981 1046235696 /nfs/dbraw/zinc/23/56/96/1046235696.db2.gz FBICKJNEMYDVDE-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1cnn(-c3ccccc3)c1)CC2 ZINC001138603104 1046238825 /nfs/dbraw/zinc/23/88/25/1046238825.db2.gz DGSFKVIXCLDTRL-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1cnn(-c3ccccc3)c1)CC2 ZINC001138603104 1046238829 /nfs/dbraw/zinc/23/88/29/1046238829.db2.gz DGSFKVIXCLDTRL-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@@H](c1ncccc1C)C(C)(C)C ZINC000903328044 1046242097 /nfs/dbraw/zinc/24/20/97/1046242097.db2.gz DDKLFZAGDBDUPV-KDOFPFPSSA-N 1 2 313.445 4.441 20 0 DIADLO C[C@H]1C[C@@H]([NH2+][C@@H](c2ncccn2)C2CC2)c2ccsc2S1 ZINC000903327611 1046242251 /nfs/dbraw/zinc/24/22/51/1046242251.db2.gz WRRSZXIHXLRNCC-ZLKJLUDKSA-N 1 2 317.483 4.204 20 0 DIADLO C[C@H]([NH2+][C@H](c1ncccn1)C1CC1)c1ccc(F)c(Cl)c1 ZINC000903331900 1046243922 /nfs/dbraw/zinc/24/39/22/1046243922.db2.gz KPAQQVCDHHNLSP-BONVTDFDSA-N 1 2 305.784 4.071 20 0 DIADLO CCSc1ncc(C[N@H+](C)[C@H](C)c2ccccc2Cl)cn1 ZINC001138657379 1046256849 /nfs/dbraw/zinc/25/68/49/1046256849.db2.gz AOCPXRLYVDHXIH-GFCCVEGCSA-N 1 2 321.877 4.435 20 0 DIADLO CCSc1ncc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)cn1 ZINC001138657379 1046256861 /nfs/dbraw/zinc/25/68/61/1046256861.db2.gz AOCPXRLYVDHXIH-GFCCVEGCSA-N 1 2 321.877 4.435 20 0 DIADLO CCSc1ncc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)cn1 ZINC001138657380 1046256962 /nfs/dbraw/zinc/25/69/62/1046256962.db2.gz AOCPXRLYVDHXIH-LBPRGKRZSA-N 1 2 321.877 4.435 20 0 DIADLO CCSc1ncc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)cn1 ZINC001138657380 1046256969 /nfs/dbraw/zinc/25/69/69/1046256969.db2.gz AOCPXRLYVDHXIH-LBPRGKRZSA-N 1 2 321.877 4.435 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1csc(C)n1)c1cc(F)ccc1OC ZINC000903370125 1046257870 /nfs/dbraw/zinc/25/78/70/1046257870.db2.gz CQJNILZQYLXSKN-IINYFYTJSA-N 1 2 308.422 4.401 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H]2CCCc3[nH]ncc32)cc2ccccc21 ZINC000903413302 1046269907 /nfs/dbraw/zinc/26/99/07/1046269907.db2.gz KGFVAWNKDYIYFG-SCLBCKFNSA-N 1 2 321.424 4.300 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1Cl)Cc1cccnc1NC ZINC001138695185 1046271290 /nfs/dbraw/zinc/27/12/90/1046271290.db2.gz YECHXQOYTOUFOS-UHFFFAOYSA-N 1 2 324.255 4.452 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)cc1Cl)Cc1cccnc1NC ZINC001138695185 1046271301 /nfs/dbraw/zinc/27/13/01/1046271301.db2.gz YECHXQOYTOUFOS-UHFFFAOYSA-N 1 2 324.255 4.452 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+]2CCCC[C@](C)(F)C2)c1OC ZINC001138741806 1046286366 /nfs/dbraw/zinc/28/63/66/1046286366.db2.gz BIFNNEJOUXSYBK-INIZCTEOSA-N 1 2 315.816 4.071 20 0 DIADLO COc1cc(Cl)cc(C[N@H+]2CCCC[C@](C)(F)C2)c1OC ZINC001138741806 1046286377 /nfs/dbraw/zinc/28/63/77/1046286377.db2.gz BIFNNEJOUXSYBK-INIZCTEOSA-N 1 2 315.816 4.071 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1coc(-c2cccs2)n1 ZINC000170751871 1046287873 /nfs/dbraw/zinc/28/78/73/1046287873.db2.gz HJWVRDRQOCLUBI-OAHLLOKOSA-N 1 2 313.426 4.079 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1coc(-c2cccs2)n1 ZINC000170751871 1046287886 /nfs/dbraw/zinc/28/78/86/1046287886.db2.gz HJWVRDRQOCLUBI-OAHLLOKOSA-N 1 2 313.426 4.079 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cc3cc(Cl)cnc3o2)s1 ZINC000648468838 1046290076 /nfs/dbraw/zinc/29/00/76/1046290076.db2.gz PFWJXWMYTGXAMZ-SECBINFHSA-N 1 2 307.806 4.097 20 0 DIADLO C[N@H+](Cc1ccc(C(F)F)nc1)Cc1ccc(F)cc1Cl ZINC000638054831 1046291890 /nfs/dbraw/zinc/29/18/90/1046291890.db2.gz IHOLDAJTKYTMBZ-UHFFFAOYSA-N 1 2 314.738 4.444 20 0 DIADLO C[N@@H+](Cc1ccc(C(F)F)nc1)Cc1ccc(F)cc1Cl ZINC000638054831 1046291902 /nfs/dbraw/zinc/29/19/02/1046291902.db2.gz IHOLDAJTKYTMBZ-UHFFFAOYSA-N 1 2 314.738 4.444 20 0 DIADLO CC[N@H+](Cc1cccc(C(F)(F)F)c1)Cc1cccnc1F ZINC001138791145 1046294155 /nfs/dbraw/zinc/29/41/55/1046294155.db2.gz RKOCNJYRBUEMNP-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1cccc(C(F)(F)F)c1)Cc1cccnc1F ZINC001138791145 1046294168 /nfs/dbraw/zinc/29/41/68/1046294168.db2.gz RKOCNJYRBUEMNP-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO Cc1ncc([C@H](C)[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c(C)n1 ZINC000638120953 1046294533 /nfs/dbraw/zinc/29/45/33/1046294533.db2.gz HCRCZQXEDUIYMZ-SJCJKPOMSA-N 1 2 301.821 4.255 20 0 DIADLO Cc1ncc([C@H](C)[N@H+]2CC[C@H]2c2ccc(Cl)cc2)c(C)n1 ZINC000638120953 1046294544 /nfs/dbraw/zinc/29/45/44/1046294544.db2.gz HCRCZQXEDUIYMZ-SJCJKPOMSA-N 1 2 301.821 4.255 20 0 DIADLO O=C1CC[N@@H+](Cc2c[nH]c3c2cccc3Cl)[C@H]2CCCC[C@H]12 ZINC001138830415 1046305741 /nfs/dbraw/zinc/30/57/41/1046305741.db2.gz LQUFSLYYXKQNGV-HOCLYGCPSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c[nH]c3c2cccc3Cl)[C@H]2CCCC[C@H]12 ZINC001138830415 1046305758 /nfs/dbraw/zinc/30/57/58/1046305758.db2.gz LQUFSLYYXKQNGV-HOCLYGCPSA-N 1 2 316.832 4.155 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)c1ccc(Cl)cc1 ZINC000638290299 1046309485 /nfs/dbraw/zinc/30/94/85/1046309485.db2.gz FFMPLJBMXWGDAH-BLLLJJGKSA-N 1 2 318.852 4.430 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)c(C)s1 ZINC000638336629 1046314790 /nfs/dbraw/zinc/31/47/90/1046314790.db2.gz WRVTTWDVXNZMSJ-MLGOLLRUSA-N 1 2 318.490 4.455 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1cnc2ccccc2n1 ZINC001138867020 1046315678 /nfs/dbraw/zinc/31/56/78/1046315678.db2.gz BBPJRBAVKFQAGB-CYBMUJFWSA-N 1 2 311.816 4.476 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1cnc2ccccc2n1 ZINC001138867020 1046315693 /nfs/dbraw/zinc/31/56/93/1046315693.db2.gz BBPJRBAVKFQAGB-CYBMUJFWSA-N 1 2 311.816 4.476 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2ccc3ccc(F)c(F)c3n2)n1 ZINC000638504572 1046326353 /nfs/dbraw/zinc/32/63/53/1046326353.db2.gz XPLOTGUJQZBDJM-SNVBAGLBSA-N 1 2 319.380 4.129 20 0 DIADLO CCC(=CC(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1)CC ZINC000759161732 1046327550 /nfs/dbraw/zinc/32/75/50/1046327550.db2.gz LUROUKFNGVLJRQ-CYBMUJFWSA-N 1 2 321.490 4.060 20 0 DIADLO CCC(=CC(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1)CC ZINC000759161732 1046327556 /nfs/dbraw/zinc/32/75/56/1046327556.db2.gz LUROUKFNGVLJRQ-CYBMUJFWSA-N 1 2 321.490 4.060 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)c1C ZINC000638599610 1046330467 /nfs/dbraw/zinc/33/04/67/1046330467.db2.gz LQEXSTGOQWKPBT-CRAIPNDOSA-N 1 2 312.461 4.394 20 0 DIADLO Cc1nsc(C)c1C[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000653615655 1046334846 /nfs/dbraw/zinc/33/48/46/1046334846.db2.gz SLBROMSONGFTBS-JTQLQIEISA-N 1 2 309.504 4.365 20 0 DIADLO C[N@H+](Cc1ccc(F)cc1F)Cc1c2cc[nH]c2ncc1Cl ZINC001138951513 1046335843 /nfs/dbraw/zinc/33/58/43/1046335843.db2.gz DNYFJTJDMTTWHO-UHFFFAOYSA-N 1 2 321.758 4.078 20 0 DIADLO C[N@@H+](Cc1ccc(F)cc1F)Cc1c2cc[nH]c2ncc1Cl ZINC001138951513 1046335853 /nfs/dbraw/zinc/33/58/53/1046335853.db2.gz DNYFJTJDMTTWHO-UHFFFAOYSA-N 1 2 321.758 4.078 20 0 DIADLO CC(C)Oc1ccc(Cl)cc1C[NH+]1CCC(F)(F)CC1 ZINC001138957831 1046337215 /nfs/dbraw/zinc/33/72/15/1046337215.db2.gz ONOBGJMXIRQQIQ-UHFFFAOYSA-N 1 2 303.780 4.358 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)ccc1F ZINC000638742168 1046338678 /nfs/dbraw/zinc/33/86/78/1046338678.db2.gz XWOUIHKMYBKNHX-DYVFJYSZSA-N 1 2 316.424 4.224 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)cc1F ZINC000638762200 1046340458 /nfs/dbraw/zinc/34/04/58/1046340458.db2.gz BWKVNCBXPIPBOY-DYVFJYSZSA-N 1 2 316.424 4.224 20 0 DIADLO C[C@@H](Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)[C@@H]1CC1(F)F ZINC000639123294 1046362571 /nfs/dbraw/zinc/36/25/71/1046362571.db2.gz IJEBJTTXQMKTCJ-WBMJQRKESA-N 1 2 317.383 4.342 20 0 DIADLO CC(C)COCC[N@@H+]1CCc2c(Cl)cc(Cl)cc2C1 ZINC001168194052 1046379557 /nfs/dbraw/zinc/37/95/57/1046379557.db2.gz XUCXIAWICFZPKJ-UHFFFAOYSA-N 1 2 302.245 4.024 20 0 DIADLO CC(C)COCC[N@H+]1CCc2c(Cl)cc(Cl)cc2C1 ZINC001168194052 1046379569 /nfs/dbraw/zinc/37/95/69/1046379569.db2.gz XUCXIAWICFZPKJ-UHFFFAOYSA-N 1 2 302.245 4.024 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1)[N@@H+]1Cc2cnc(Cl)cc2C1 ZINC001168194224 1046382431 /nfs/dbraw/zinc/38/24/31/1046382431.db2.gz UOEHQMMSJANFOP-LLVKDONJSA-N 1 2 307.224 4.335 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1)[N@H+]1Cc2cnc(Cl)cc2C1 ZINC001168194224 1046382444 /nfs/dbraw/zinc/38/24/44/1046382444.db2.gz UOEHQMMSJANFOP-LLVKDONJSA-N 1 2 307.224 4.335 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(Br)nc2Cl)[C@H](C)C1 ZINC001139112022 1046387320 /nfs/dbraw/zinc/38/73/20/1046387320.db2.gz HLQFZCBJGJAZDK-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(Br)nc2Cl)[C@H](C)C1 ZINC001139112022 1046387336 /nfs/dbraw/zinc/38/73/36/1046387336.db2.gz HLQFZCBJGJAZDK-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO O=C(CCCn1cc[nH+]c1)OCc1ccc(-c2ccccc2)cc1 ZINC000748605623 1046387810 /nfs/dbraw/zinc/38/78/10/1046387810.db2.gz DXNDDFAHFLQJCT-UHFFFAOYSA-N 1 2 320.392 4.074 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1C[NH2+][C@H](CF)c1ccc(F)cc1 ZINC000639395625 1046390196 /nfs/dbraw/zinc/39/01/96/1046390196.db2.gz RBZASWHICXEOOQ-QGZVFWFLSA-N 1 2 321.415 4.194 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000780593724 1046394913 /nfs/dbraw/zinc/39/49/13/1046394913.db2.gz WVEILHVZPMCVAY-WMZOPIPTSA-N 1 2 305.466 4.043 20 0 DIADLO c1coc(C[NH+](Cc2ccco2)Cc2cccc3c2CCOC3)c1 ZINC000639432831 1046400117 /nfs/dbraw/zinc/40/01/17/1046400117.db2.gz KUXAHSVVTWBLKW-UHFFFAOYSA-N 1 2 323.392 4.148 20 0 DIADLO COc1cccc(-c2nc(C[N@H+](C)[C@H](C)c3ccco3)co2)c1 ZINC000639461994 1046403810 /nfs/dbraw/zinc/40/38/10/1046403810.db2.gz LEQMSZZVRQMRPP-CYBMUJFWSA-N 1 2 312.369 4.136 20 0 DIADLO COc1cccc(-c2nc(C[N@@H+](C)[C@H](C)c3ccco3)co2)c1 ZINC000639461994 1046403819 /nfs/dbraw/zinc/40/38/19/1046403819.db2.gz LEQMSZZVRQMRPP-CYBMUJFWSA-N 1 2 312.369 4.136 20 0 DIADLO c1coc([C@@H]2CCCCC[N@H+]2Cc2nc(C3CCC3)no2)c1 ZINC000639499269 1046407488 /nfs/dbraw/zinc/40/74/88/1046407488.db2.gz GJSYMSZLRFFSEP-AWEZNQCLSA-N 1 2 301.390 4.047 20 0 DIADLO c1coc([C@@H]2CCCCC[N@@H+]2Cc2nc(C3CCC3)no2)c1 ZINC000639499269 1046407492 /nfs/dbraw/zinc/40/74/92/1046407492.db2.gz GJSYMSZLRFFSEP-AWEZNQCLSA-N 1 2 301.390 4.047 20 0 DIADLO CC(C)(C)C[C@@H]([NH2+]Cc1nc(CC2CC2)no1)c1ccccc1 ZINC000639562893 1046411160 /nfs/dbraw/zinc/41/11/60/1046411160.db2.gz YALVVQSBDKXDAK-MRXNPFEDSA-N 1 2 313.445 4.289 20 0 DIADLO CC/C(C)=C(/C)C(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC000780905747 1046411560 /nfs/dbraw/zinc/41/15/60/1046411560.db2.gz ZJETURNGDNZQJF-JOLOJFPGSA-N 1 2 321.490 4.060 20 0 DIADLO CC/C(C)=C(/C)C(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC000780905747 1046411568 /nfs/dbraw/zinc/41/15/68/1046411568.db2.gz ZJETURNGDNZQJF-JOLOJFPGSA-N 1 2 321.490 4.060 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2oc(-c3ccccc3)nc2C)s1 ZINC000639584084 1046415570 /nfs/dbraw/zinc/41/55/70/1046415570.db2.gz JKHUHYBFJZZYIH-ZDUSSCGKSA-N 1 2 313.426 4.266 20 0 DIADLO CC(C)c1ccc(NC(=O)Nc2cc[nH+]c(N3CCCC3)c2)cc1 ZINC001202916575 1046422760 /nfs/dbraw/zinc/42/27/60/1046422760.db2.gz UWUUTIXNKKJPFD-UHFFFAOYSA-N 1 2 324.428 4.449 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2[nH]c(-c3ccccc3)nc2Cl)C1 ZINC001139279599 1046423461 /nfs/dbraw/zinc/42/34/61/1046423461.db2.gz OFXXTEHGPAJFIH-KRWDZBQOSA-N 1 2 321.827 4.444 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2[nH]c(-c3ccccc3)nc2Cl)C1 ZINC001139279599 1046423467 /nfs/dbraw/zinc/42/34/67/1046423467.db2.gz OFXXTEHGPAJFIH-KRWDZBQOSA-N 1 2 321.827 4.444 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CC=C(c2cc(C)cc(C)c2)CC1 ZINC001168222040 1046432435 /nfs/dbraw/zinc/43/24/35/1046432435.db2.gz CCMRPKAJRVGKSC-KRWDZBQOSA-N 1 2 315.457 4.124 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC=C(c2cc(C)cc(C)c2)CC1 ZINC001168222040 1046432444 /nfs/dbraw/zinc/43/24/44/1046432444.db2.gz CCMRPKAJRVGKSC-KRWDZBQOSA-N 1 2 315.457 4.124 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1ccncc1Cl ZINC001168234636 1046435344 /nfs/dbraw/zinc/43/53/44/1046435344.db2.gz NGSLAGCLMROULC-RYUDHWBXSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1ccncc1Cl ZINC001168234636 1046435348 /nfs/dbraw/zinc/43/53/48/1046435348.db2.gz NGSLAGCLMROULC-RYUDHWBXSA-N 1 2 304.796 4.382 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1cc(Cl)cnc1Cl ZINC001139356319 1046436473 /nfs/dbraw/zinc/43/64/73/1046436473.db2.gz FLAITDFTOJCAEP-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1cc(Cl)cnc1Cl ZINC001139356319 1046436480 /nfs/dbraw/zinc/43/64/80/1046436480.db2.gz FLAITDFTOJCAEP-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccccc2OC(C)C)c(C)s1 ZINC000676838893 1046439510 /nfs/dbraw/zinc/43/95/10/1046439510.db2.gz HMRVCZYIWOIZDV-LBPRGKRZSA-N 1 2 304.459 4.398 20 0 DIADLO Fc1ccc(C[NH2+]Cc2nc3c(s2)CCCC3)c(Cl)c1 ZINC000719526597 1046440118 /nfs/dbraw/zinc/44/01/18/1046440118.db2.gz BGGXLATVLJVADE-UHFFFAOYSA-N 1 2 310.825 4.104 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2coc(-c3cccc(F)c3)n2)s1 ZINC000639995894 1046441960 /nfs/dbraw/zinc/44/19/60/1046441960.db2.gz ZYQPQMHKXTYWJB-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2csc(CCC(C)C)n2)s1 ZINC000639993411 1046442191 /nfs/dbraw/zinc/44/21/91/1046442191.db2.gz AXRTUCTZPXHXAF-NSHDSACASA-N 1 2 309.504 4.347 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2ccccc2C(F)(F)F)c[nH+]1 ZINC000454176627 1046443704 /nfs/dbraw/zinc/44/37/04/1046443704.db2.gz XLOVLTLRHJHEJU-UHFFFAOYSA-N 1 2 323.318 4.039 20 0 DIADLO Cc1sc(/C=C\c2c[nH+]c3ccc(Cl)cn23)cc1C=O ZINC000760263255 1046446498 /nfs/dbraw/zinc/44/64/98/1046446498.db2.gz GCQORRROLIALBB-ARJAWSKDSA-N 1 2 302.786 4.341 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2nc3ccccc3s2)sc1C ZINC000719618753 1046446742 /nfs/dbraw/zinc/44/67/42/1046446742.db2.gz XZHKCWACMMCENE-SNVBAGLBSA-N 1 2 303.456 4.220 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3occ4c3CCC4)c2)[nH+]c1C ZINC000795516804 1046448356 /nfs/dbraw/zinc/44/83/56/1046448356.db2.gz PUHXFJFYGYSUJU-UHFFFAOYSA-N 1 2 321.380 4.028 20 0 DIADLO CSc1cc(F)ccc1NCc1ccc(-n2cc[nH+]c2)cc1 ZINC001202938183 1046450163 /nfs/dbraw/zinc/45/01/63/1046450163.db2.gz DXVLBSJGJQYHGT-UHFFFAOYSA-N 1 2 313.401 4.345 20 0 DIADLO Cc1nc(C(C)C)ccc1C[NH2+][C@H](CF)c1ccc(F)cc1 ZINC000640155821 1046450773 /nfs/dbraw/zinc/45/07/73/1046450773.db2.gz ZBMLOOMAHXFARY-GOSISDBHSA-N 1 2 304.384 4.453 20 0 DIADLO C[C@H]1CC[C@]2(CC[N@H+](Cn3nc(C4CC4)sc3=S)C2)C1 ZINC000781588965 1046458912 /nfs/dbraw/zinc/45/89/12/1046458912.db2.gz YWOBZSQOUWNPOY-NHYWBVRUSA-N 1 2 309.504 4.021 20 0 DIADLO C[C@H]1CC[C@]2(CC[N@@H+](Cn3nc(C4CC4)sc3=S)C2)C1 ZINC000781588965 1046458917 /nfs/dbraw/zinc/45/89/17/1046458917.db2.gz YWOBZSQOUWNPOY-NHYWBVRUSA-N 1 2 309.504 4.021 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCC[C@H]3c3ccncc3)cs2)co1 ZINC000125380073 1046466595 /nfs/dbraw/zinc/46/65/95/1046466595.db2.gz WSTPEEJIEWHWGE-INIZCTEOSA-N 1 2 311.410 4.135 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCC[C@H]3c3ccncc3)cs2)co1 ZINC000125380073 1046466600 /nfs/dbraw/zinc/46/66/00/1046466600.db2.gz WSTPEEJIEWHWGE-INIZCTEOSA-N 1 2 311.410 4.135 20 0 DIADLO Cc1cc(C[N@@H+]2CCSc3ccccc3C2)cnc1Cl ZINC001139547928 1046468486 /nfs/dbraw/zinc/46/84/86/1046468486.db2.gz OQBRAOCJVOPYIL-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO Cc1cc(C[N@H+]2CCSc3ccccc3C2)cnc1Cl ZINC001139547928 1046468492 /nfs/dbraw/zinc/46/84/92/1046468492.db2.gz OQBRAOCJVOPYIL-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO c1csc(-c2cnc(C[N@@H+]3CCC[C@@H]3c3ccncc3)o2)c1 ZINC000125463234 1046468621 /nfs/dbraw/zinc/46/86/21/1046468621.db2.gz LIZYDRBPLLXAGQ-CQSZACIVSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2cnc(C[N@H+]3CCC[C@@H]3c3ccncc3)o2)c1 ZINC000125463234 1046468630 /nfs/dbraw/zinc/46/86/30/1046468630.db2.gz LIZYDRBPLLXAGQ-CQSZACIVSA-N 1 2 311.410 4.135 20 0 DIADLO Cc1cc(C[N@@H+](CC(=O)c2ccccc2)C(C)C)cnc1Cl ZINC001139545971 1046468907 /nfs/dbraw/zinc/46/89/07/1046468907.db2.gz AYRRAGACNNJWAO-UHFFFAOYSA-N 1 2 316.832 4.137 20 0 DIADLO Cc1cc(C[N@H+](CC(=O)c2ccccc2)C(C)C)cnc1Cl ZINC001139545971 1046468913 /nfs/dbraw/zinc/46/89/13/1046468913.db2.gz AYRRAGACNNJWAO-UHFFFAOYSA-N 1 2 316.832 4.137 20 0 DIADLO CC(C)[N@H+](Cc1coc(-c2cccs2)n1)Cc1cccnc1 ZINC000125633030 1046470417 /nfs/dbraw/zinc/47/04/17/1046470417.db2.gz JCVGNAYVSZEITA-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)[N@@H+](Cc1coc(-c2cccs2)n1)Cc1cccnc1 ZINC000125633030 1046470420 /nfs/dbraw/zinc/47/04/20/1046470420.db2.gz JCVGNAYVSZEITA-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)c1noc([C@H](C)[NH+]2CCC(OC3CCCCC3)CC2)n1 ZINC000125633971 1046470546 /nfs/dbraw/zinc/47/05/46/1046470546.db2.gz QXVIUSSZUWMFOT-AWEZNQCLSA-N 1 2 321.465 4.068 20 0 DIADLO Cc1cc(C)c(NC(=O)Nc2cc[nH+]c(N3CCCC3)c2)c(C)c1 ZINC001202950278 1046478967 /nfs/dbraw/zinc/47/89/67/1046478967.db2.gz DXEBGHMPNCUGIG-UHFFFAOYSA-N 1 2 324.428 4.251 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2cnc(Cl)s2)ccc1Cl ZINC001139611661 1046484379 /nfs/dbraw/zinc/48/43/79/1046484379.db2.gz ARYKVHVBQWSSLW-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO COc1cc(C[N@H+](C)Cc2cnc(Cl)s2)ccc1Cl ZINC001139611661 1046484370 /nfs/dbraw/zinc/48/43/70/1046484370.db2.gz ARYKVHVBQWSSLW-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1cccnc1Cl)[C@@H]2C ZINC000781928194 1046487315 /nfs/dbraw/zinc/48/73/15/1046487315.db2.gz UQGICAOKFASTST-QWHCGFSZSA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1cccnc1Cl)[C@@H]2C ZINC000781928194 1046487322 /nfs/dbraw/zinc/48/73/22/1046487322.db2.gz UQGICAOKFASTST-QWHCGFSZSA-N 1 2 316.832 4.251 20 0 DIADLO Cc1csc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c1Cl ZINC001137291347 1046489419 /nfs/dbraw/zinc/48/94/19/1046489419.db2.gz PCFICFIJTSBRPN-CQSZACIVSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1csc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)c1Cl ZINC001137291347 1046489423 /nfs/dbraw/zinc/48/94/23/1046489423.db2.gz PCFICFIJTSBRPN-CQSZACIVSA-N 1 2 307.846 4.283 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1ccc(-c2cccnc2)cc1 ZINC001139644927 1046492334 /nfs/dbraw/zinc/49/23/34/1046492334.db2.gz VSBPNGVQRKYONN-UHFFFAOYSA-N 1 2 316.404 4.063 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1ccc(-c2cccnc2)cc1 ZINC001139644927 1046492337 /nfs/dbraw/zinc/49/23/37/1046492337.db2.gz VSBPNGVQRKYONN-UHFFFAOYSA-N 1 2 316.404 4.063 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1ncc(C(C)C)o1)[C@H]2C ZINC000782096775 1046494297 /nfs/dbraw/zinc/49/42/97/1046494297.db2.gz GCCDTRFZCMETTG-KBPBESRZSA-N 1 2 314.429 4.314 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1ncc(C(C)C)o1)[C@H]2C ZINC000782096775 1046494302 /nfs/dbraw/zinc/49/43/02/1046494302.db2.gz GCCDTRFZCMETTG-KBPBESRZSA-N 1 2 314.429 4.314 20 0 DIADLO C[C@H](N[C@@H]1C[N@H+](C)Cc2ccccc21)c1ccccc1Cl ZINC000677413604 1046494346 /nfs/dbraw/zinc/49/43/46/1046494346.db2.gz KXEXYSCSDYLLLZ-SCLBCKFNSA-N 1 2 300.833 4.177 20 0 DIADLO C[C@H](N[C@@H]1C[N@@H+](C)Cc2ccccc21)c1ccccc1Cl ZINC000677413604 1046494350 /nfs/dbraw/zinc/49/43/50/1046494350.db2.gz KXEXYSCSDYLLLZ-SCLBCKFNSA-N 1 2 300.833 4.177 20 0 DIADLO CN(C)c1cc(CSc2ccc(Br)cc2)cc[nH+]1 ZINC000782111275 1046496056 /nfs/dbraw/zinc/49/60/56/1046496056.db2.gz QRRWCWAXRWIDTJ-UHFFFAOYSA-N 1 2 323.259 4.202 20 0 DIADLO CN(C)c1cc(CSc2nc3ccccc3s2)cc[nH+]1 ZINC000782111784 1046496294 /nfs/dbraw/zinc/49/62/94/1046496294.db2.gz UOQDHLGXXVBDSV-UHFFFAOYSA-N 1 2 301.440 4.050 20 0 DIADLO Clc1ccc2c(c1)CC[C@H]2[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000782180936 1046497241 /nfs/dbraw/zinc/49/72/41/1046497241.db2.gz LFXFWNDCWDDKCA-HZPDHXFCSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)CC[C@H]2[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000782180936 1046497245 /nfs/dbraw/zinc/49/72/45/1046497245.db2.gz LFXFWNDCWDDKCA-HZPDHXFCSA-N 1 2 319.857 4.462 20 0 DIADLO COc1ccc(F)cc1C[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000188734684 1046498508 /nfs/dbraw/zinc/49/85/08/1046498508.db2.gz GEWAPQIUJMNPDN-NSHDSACASA-N 1 2 308.422 4.265 20 0 DIADLO Cc1nc2cc(C)ccn2c1C[N@@H+](C)Cc1ccccc1Cl ZINC001139680854 1046499658 /nfs/dbraw/zinc/49/96/58/1046499658.db2.gz PHSJLCJDUXADJB-UHFFFAOYSA-N 1 2 313.832 4.237 20 0 DIADLO Cc1nc2cc(C)ccn2c1C[N@H+](C)Cc1ccccc1Cl ZINC001139680854 1046499662 /nfs/dbraw/zinc/49/96/62/1046499662.db2.gz PHSJLCJDUXADJB-UHFFFAOYSA-N 1 2 313.832 4.237 20 0 DIADLO Cc1nc2c(o1)CC[N@H+](Cc1ccc3oc4ccccc4c3c1)C2 ZINC001139752212 1046511181 /nfs/dbraw/zinc/51/11/81/1046511181.db2.gz AAVMEEOJNOWEIG-UHFFFAOYSA-N 1 2 318.376 4.441 20 0 DIADLO Cc1nc2c(o1)CC[N@@H+](Cc1ccc3oc4ccccc4c3c1)C2 ZINC001139752212 1046511185 /nfs/dbraw/zinc/51/11/85/1046511185.db2.gz AAVMEEOJNOWEIG-UHFFFAOYSA-N 1 2 318.376 4.441 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2C[C@@H](c3ccccc3)OC[C@H]2C)s1 ZINC000130619306 1046513269 /nfs/dbraw/zinc/51/32/69/1046513269.db2.gz VRPCTSZQPMXHJP-PBHICJAKSA-N 1 2 316.470 4.229 20 0 DIADLO CC(C)c1ncc(C[N@H+]2C[C@@H](c3ccccc3)OC[C@H]2C)s1 ZINC000130619306 1046513270 /nfs/dbraw/zinc/51/32/70/1046513270.db2.gz VRPCTSZQPMXHJP-PBHICJAKSA-N 1 2 316.470 4.229 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)s1 ZINC000130619923 1046513446 /nfs/dbraw/zinc/51/34/46/1046513446.db2.gz VRPCTSZQPMXHJP-WMLDXEAASA-N 1 2 316.470 4.229 20 0 DIADLO CC(C)c1ncc(C[N@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)s1 ZINC000130619923 1046513458 /nfs/dbraw/zinc/51/34/58/1046513458.db2.gz VRPCTSZQPMXHJP-WMLDXEAASA-N 1 2 316.470 4.229 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC000093315772 1046517161 /nfs/dbraw/zinc/51/71/61/1046517161.db2.gz VQUWSPIMPCXQJB-STQMWFEESA-N 1 2 316.470 4.167 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC000093315772 1046517170 /nfs/dbraw/zinc/51/71/70/1046517170.db2.gz VQUWSPIMPCXQJB-STQMWFEESA-N 1 2 316.470 4.167 20 0 DIADLO C[C@H](c1ccccc1Br)[NH+]1CC2(C1)CC(F)(F)C2 ZINC000677733642 1046517618 /nfs/dbraw/zinc/51/76/18/1046517618.db2.gz VPBLHKGSZREUCQ-SNVBAGLBSA-N 1 2 316.189 4.241 20 0 DIADLO C[N@@H+](Cc1cccc2c3ccccc3sc21)Cc1ncccn1 ZINC001139843303 1046532539 /nfs/dbraw/zinc/53/25/39/1046532539.db2.gz RBRCBBMGIQSUKU-UHFFFAOYSA-N 1 2 319.433 4.477 20 0 DIADLO C[N@H+](Cc1cccc2c3ccccc3sc21)Cc1ncccn1 ZINC001139843303 1046532544 /nfs/dbraw/zinc/53/25/44/1046532544.db2.gz RBRCBBMGIQSUKU-UHFFFAOYSA-N 1 2 319.433 4.477 20 0 DIADLO O=C1CCC[N@@H+](Cc2cccc3c4ccccc4oc32)C[C@@H]1F ZINC001139857898 1046533665 /nfs/dbraw/zinc/53/36/65/1046533665.db2.gz RHVVRLGPLFRTTO-INIZCTEOSA-N 1 2 311.356 4.089 20 0 DIADLO O=C1CCC[N@H+](Cc2cccc3c4ccccc4oc32)C[C@@H]1F ZINC001139857898 1046533673 /nfs/dbraw/zinc/53/36/73/1046533673.db2.gz RHVVRLGPLFRTTO-INIZCTEOSA-N 1 2 311.356 4.089 20 0 DIADLO CC[C@H](NC(=O)Nc1cc(C)[nH+]cc1C)c1cccc(Cl)c1 ZINC000536618631 1046533736 /nfs/dbraw/zinc/53/37/36/1046533736.db2.gz PNGZEJGZRQAFAN-HNNXBMFYSA-N 1 2 317.820 4.047 20 0 DIADLO CCSCC[C@@H](C)[N@H+](C)Cc1noc(-c2ccccc2C)n1 ZINC000132648492 1046535521 /nfs/dbraw/zinc/53/55/21/1046535521.db2.gz GTYHGCWBRXOFJI-CQSZACIVSA-N 1 2 319.474 4.009 20 0 DIADLO CCSCC[C@@H](C)[N@@H+](C)Cc1noc(-c2ccccc2C)n1 ZINC000132648492 1046535532 /nfs/dbraw/zinc/53/55/32/1046535532.db2.gz GTYHGCWBRXOFJI-CQSZACIVSA-N 1 2 319.474 4.009 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1C[N@@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001139888051 1046545418 /nfs/dbraw/zinc/54/54/18/1046545418.db2.gz JEJNSYHZPVKJNP-KGLIPLIRSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1C[N@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001139888051 1046545429 /nfs/dbraw/zinc/54/54/29/1046545429.db2.gz JEJNSYHZPVKJNP-KGLIPLIRSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1cccc(-c2nnc([C@@H](C)[NH2+][C@@H](C)c3cnccc3C)o2)c1 ZINC000783001380 1046550920 /nfs/dbraw/zinc/55/09/20/1046550920.db2.gz FWJADSPOOBOEMG-LSDHHAIUSA-N 1 2 322.412 4.160 20 0 DIADLO Cc1ccc(CC[N@H+](Cc2ccco2)Cc2nccs2)cc1 ZINC000135107531 1046552238 /nfs/dbraw/zinc/55/22/38/1046552238.db2.gz UFPDJDOTQFGLSM-UHFFFAOYSA-N 1 2 312.438 4.289 20 0 DIADLO Cc1ccc(CC[N@@H+](Cc2ccco2)Cc2nccs2)cc1 ZINC000135107531 1046552246 /nfs/dbraw/zinc/55/22/46/1046552246.db2.gz UFPDJDOTQFGLSM-UHFFFAOYSA-N 1 2 312.438 4.289 20 0 DIADLO CC(C)COC1CC[NH+](Cc2csc(C(C)(C)C)n2)CC1 ZINC000054327608 1046557208 /nfs/dbraw/zinc/55/72/08/1046557208.db2.gz JTDQSAHPXJGFTM-UHFFFAOYSA-N 1 2 310.507 4.078 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1C(C)C ZINC000055057981 1046559880 /nfs/dbraw/zinc/55/98/80/1046559880.db2.gz VXGIVQIPMGRWPZ-CQSZACIVSA-N 1 2 314.429 4.170 20 0 DIADLO Cc1occc1C[N@H+](C)[C@H](C)C(=O)Nc1ccccc1C(C)C ZINC000055057981 1046559892 /nfs/dbraw/zinc/55/98/92/1046559892.db2.gz VXGIVQIPMGRWPZ-CQSZACIVSA-N 1 2 314.429 4.170 20 0 DIADLO NC(Cc1cccc(F)c1)=[NH+]OCCc1ccc2ccccc2c1 ZINC000783147482 1046561006 /nfs/dbraw/zinc/56/10/06/1046561006.db2.gz IICFGDFBDDJNMI-UHFFFAOYSA-N 1 2 322.383 4.263 20 0 DIADLO CC1(c2ccccc2)CC[NH+](Cc2csc(Cl)n2)CC1 ZINC001139984148 1046561545 /nfs/dbraw/zinc/56/15/45/1046561545.db2.gz AXFDSFSOHMNXHY-UHFFFAOYSA-N 1 2 306.862 4.350 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+](Cc3csc(Cl)n3)C2)c1 ZINC001139984418 1046563103 /nfs/dbraw/zinc/56/31/03/1046563103.db2.gz JUWBGYQLWKSQHB-ZDUSSCGKSA-N 1 2 322.861 4.185 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+](Cc3csc(Cl)n3)C2)c1 ZINC001139984418 1046563114 /nfs/dbraw/zinc/56/31/14/1046563114.db2.gz JUWBGYQLWKSQHB-ZDUSSCGKSA-N 1 2 322.861 4.185 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ncccc2C(F)(F)F)C2CC2)o1 ZINC000678135734 1046564561 /nfs/dbraw/zinc/56/45/61/1046564561.db2.gz SIXNZWAAOXJCQI-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ncccc2C(F)(F)F)C2CC2)o1 ZINC000678135734 1046564574 /nfs/dbraw/zinc/56/45/74/1046564574.db2.gz SIXNZWAAOXJCQI-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2[nH]nc3ccccc32)C2CC2)o1 ZINC000678135461 1046567013 /nfs/dbraw/zinc/56/70/13/1046567013.db2.gz NNGQUYUSOMXMKV-CXAGYDPISA-N 1 2 321.424 4.444 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2[nH]nc3ccccc32)C2CC2)o1 ZINC000678135461 1046567033 /nfs/dbraw/zinc/56/70/33/1046567033.db2.gz NNGQUYUSOMXMKV-CXAGYDPISA-N 1 2 321.424 4.444 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2n[nH]c3ccccc32)C2CC2)o1 ZINC000678135461 1046567047 /nfs/dbraw/zinc/56/70/47/1046567047.db2.gz NNGQUYUSOMXMKV-CXAGYDPISA-N 1 2 321.424 4.444 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2n[nH]c3ccccc32)C2CC2)o1 ZINC000678135461 1046567053 /nfs/dbraw/zinc/56/70/53/1046567053.db2.gz NNGQUYUSOMXMKV-CXAGYDPISA-N 1 2 321.424 4.444 20 0 DIADLO CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)[N@H+](C)Cc1ccco1 ZINC000057875891 1046571149 /nfs/dbraw/zinc/57/11/49/1046571149.db2.gz ISQIVNKMERRUCJ-CABCVRRESA-N 1 2 314.429 4.252 20 0 DIADLO CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccco1 ZINC000057875891 1046571160 /nfs/dbraw/zinc/57/11/60/1046571160.db2.gz ISQIVNKMERRUCJ-CABCVRRESA-N 1 2 314.429 4.252 20 0 DIADLO COc1ccccc1C[N@@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000678172445 1046576437 /nfs/dbraw/zinc/57/64/37/1046576437.db2.gz YWSURRZSBIEHDW-UHFFFAOYSA-N 1 2 306.409 4.043 20 0 DIADLO COc1ccccc1C[N@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000678172445 1046576445 /nfs/dbraw/zinc/57/64/45/1046576445.db2.gz YWSURRZSBIEHDW-UHFFFAOYSA-N 1 2 306.409 4.043 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+]1CCOc2ccccc2[C@@H]1C ZINC000678196809 1046580222 /nfs/dbraw/zinc/58/02/22/1046580222.db2.gz IKJMPJQFYCWUBA-HNNXBMFYSA-N 1 2 321.424 4.012 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+]1CCOc2ccccc2[C@@H]1C ZINC000678196809 1046580236 /nfs/dbraw/zinc/58/02/36/1046580236.db2.gz IKJMPJQFYCWUBA-HNNXBMFYSA-N 1 2 321.424 4.012 20 0 DIADLO COc1c(Cl)cccc1C[N@H+](C)Cc1cccc(F)c1F ZINC001140063335 1046580391 /nfs/dbraw/zinc/58/03/91/1046580391.db2.gz QNZOBSAQQRDSQA-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1c(Cl)cccc1C[N@@H+](C)Cc1cccc(F)c1F ZINC001140063335 1046580403 /nfs/dbraw/zinc/58/04/03/1046580403.db2.gz QNZOBSAQQRDSQA-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CC(C)c1csc(C[NH2+][C@@H]2CCCc3c(Cl)ccnc32)n1 ZINC000925283854 1046583395 /nfs/dbraw/zinc/58/33/95/1046583395.db2.gz UZKLPVAJQLCFSC-CYBMUJFWSA-N 1 2 321.877 4.482 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cnc(Br)cc2Cl)[C@@H](C)C1 ZINC001140078511 1046586128 /nfs/dbraw/zinc/58/61/28/1046586128.db2.gz IPPRBSRQGXSSSB-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cnc(Br)cc2Cl)[C@@H](C)C1 ZINC001140078511 1046586142 /nfs/dbraw/zinc/58/61/42/1046586142.db2.gz IPPRBSRQGXSSSB-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO CCCCc1nc(C[N@H+](C)CCOc2ccccc2C)cs1 ZINC000642252275 1046588038 /nfs/dbraw/zinc/58/80/38/1046588038.db2.gz XAJNQHGEODXUIB-UHFFFAOYSA-N 1 2 318.486 4.305 20 0 DIADLO CCCCc1nc(C[N@@H+](C)CCOc2ccccc2C)cs1 ZINC000642252275 1046588054 /nfs/dbraw/zinc/58/80/54/1046588054.db2.gz XAJNQHGEODXUIB-UHFFFAOYSA-N 1 2 318.486 4.305 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cscc2Cl)C[C@H](c2ccccc2)O1 ZINC000678213751 1046589291 /nfs/dbraw/zinc/58/92/91/1046589291.db2.gz CZXXPPMHLXOBKQ-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cscc2Cl)C[C@H](c2ccccc2)O1 ZINC000678213751 1046589305 /nfs/dbraw/zinc/58/93/05/1046589305.db2.gz CZXXPPMHLXOBKQ-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@H+](Cc2cscc2Cl)C[C@@H](c2ccccc2)O1 ZINC000678213650 1046591378 /nfs/dbraw/zinc/59/13/78/1046591378.db2.gz CZXXPPMHLXOBKQ-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cscc2Cl)C[C@@H](c2ccccc2)O1 ZINC000678213650 1046591392 /nfs/dbraw/zinc/59/13/92/1046591392.db2.gz CZXXPPMHLXOBKQ-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c(F)c1 ZINC001140129210 1046593495 /nfs/dbraw/zinc/59/34/95/1046593495.db2.gz WODLMNSMBHGQLE-KRWDZBQOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)c(F)c1 ZINC001140129210 1046593506 /nfs/dbraw/zinc/59/35/06/1046593506.db2.gz WODLMNSMBHGQLE-KRWDZBQOSA-N 1 2 307.315 4.147 20 0 DIADLO OCC[C@@H]1CCC[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC000678240714 1046598794 /nfs/dbraw/zinc/59/87/94/1046598794.db2.gz YEGWKCXKFKNUOZ-JTQLQIEISA-N 1 2 322.663 4.241 20 0 DIADLO OCC[C@@H]1CCC[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC000678240714 1046598807 /nfs/dbraw/zinc/59/88/07/1046598807.db2.gz YEGWKCXKFKNUOZ-JTQLQIEISA-N 1 2 322.663 4.241 20 0 DIADLO Cc1cn(C(C)(C)C(=O)Nc2cccc(-c3ccccc3)c2)c[nH+]1 ZINC001140151469 1046602396 /nfs/dbraw/zinc/60/23/96/1046602396.db2.gz HLSRWBZIMFDHET-UHFFFAOYSA-N 1 2 319.408 4.232 20 0 DIADLO C[N@H+](Cc1nc2c(s1)CCCC2)Cc1nccc2ccccc21 ZINC000678261164 1046603017 /nfs/dbraw/zinc/60/30/17/1046603017.db2.gz XACDCAWLDZUGLO-UHFFFAOYSA-N 1 2 323.465 4.202 20 0 DIADLO C[N@@H+](Cc1nc2c(s1)CCCC2)Cc1nccc2ccccc21 ZINC000678261164 1046603025 /nfs/dbraw/zinc/60/30/25/1046603025.db2.gz XACDCAWLDZUGLO-UHFFFAOYSA-N 1 2 323.465 4.202 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CCC[C@H]2c2ccccc2)cs1 ZINC000245464991 1046605499 /nfs/dbraw/zinc/60/54/99/1046605499.db2.gz IFWUKWKAGLSVEM-BBRMVZONSA-N 1 2 302.443 4.188 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CCC[C@H]2c2ccccc2)cs1 ZINC000245464991 1046605507 /nfs/dbraw/zinc/60/55/07/1046605507.db2.gz IFWUKWKAGLSVEM-BBRMVZONSA-N 1 2 302.443 4.188 20 0 DIADLO FC1(F)CCCC[N@H+](Cc2ccc(-c3ccncc3)cc2)C1 ZINC001140168176 1046605986 /nfs/dbraw/zinc/60/59/86/1046605986.db2.gz SNXCNMFAMLADCZ-UHFFFAOYSA-N 1 2 302.368 4.370 20 0 DIADLO FC1(F)CCCC[N@@H+](Cc2ccc(-c3ccncc3)cc2)C1 ZINC001140168176 1046605994 /nfs/dbraw/zinc/60/59/94/1046605994.db2.gz SNXCNMFAMLADCZ-UHFFFAOYSA-N 1 2 302.368 4.370 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1c[nH]nc1-c1ccsc1 ZINC000783574984 1046610287 /nfs/dbraw/zinc/61/02/87/1046610287.db2.gz FZXJQLKTKWCACP-UHFFFAOYSA-N 1 2 312.442 4.125 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cn3cccc(F)c3n2)[C@@H](c2ccco2)C1 ZINC000678285962 1046613543 /nfs/dbraw/zinc/61/35/43/1046613543.db2.gz QXESUJCTLADFEG-CZUORRHYSA-N 1 2 313.376 4.040 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cn3cccc(F)c3n2)[C@@H](c2ccco2)C1 ZINC000678285962 1046613548 /nfs/dbraw/zinc/61/35/48/1046613548.db2.gz QXESUJCTLADFEG-CZUORRHYSA-N 1 2 313.376 4.040 20 0 DIADLO Fc1ccc2c(c1F)C[N@@H+](Cc1nccc3ccccc31)CC2 ZINC000678338921 1046620811 /nfs/dbraw/zinc/62/08/11/1046620811.db2.gz IYRIIZXJMWZIOF-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1ccc2c(c1F)C[N@H+](Cc1nccc3ccccc31)CC2 ZINC000678338921 1046620823 /nfs/dbraw/zinc/62/08/23/1046620823.db2.gz IYRIIZXJMWZIOF-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H]2COc3c2ccc(C)c3C)c(C)s1 ZINC000678344655 1046623746 /nfs/dbraw/zinc/62/37/46/1046623746.db2.gz ATARLKQMKVUJAY-XHDPSFHLSA-N 1 2 302.443 4.161 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@@H](C)c2cc3ccccc3o2)c[nH+]1 ZINC000454507425 1046625348 /nfs/dbraw/zinc/62/53/48/1046625348.db2.gz AMXIYBFQPXKDEE-AWEZNQCLSA-N 1 2 323.396 4.005 20 0 DIADLO Cc1ccc(C)c([C@H]([NH2+][C@H]2CCn3ccnc32)c2ccccc2)c1 ZINC000834547368 1046628850 /nfs/dbraw/zinc/62/88/50/1046628850.db2.gz AXURUTFSRMGCKI-VQTJNVASSA-N 1 2 317.436 4.324 20 0 DIADLO CCOc1ccc2[nH]cc(C[N@@H+]3Cc4ccc(F)cc4C3)c2c1 ZINC001140270709 1046635158 /nfs/dbraw/zinc/63/51/58/1046635158.db2.gz OQIDYSDSSOXPFL-UHFFFAOYSA-N 1 2 310.372 4.222 20 0 DIADLO CCOc1ccc2[nH]cc(C[N@H+]3Cc4ccc(F)cc4C3)c2c1 ZINC001140270709 1046635163 /nfs/dbraw/zinc/63/51/63/1046635163.db2.gz OQIDYSDSSOXPFL-UHFFFAOYSA-N 1 2 310.372 4.222 20 0 DIADLO CC(C)(C)OC(=O)Nc1nc(C[N@@H+]2CCCCC23CC3)cs1 ZINC001140311918 1046649848 /nfs/dbraw/zinc/64/98/48/1046649848.db2.gz NFHFKHCWFLEAAX-UHFFFAOYSA-N 1 2 323.462 4.009 20 0 DIADLO CC(C)(C)OC(=O)Nc1nc(C[N@H+]2CCCCC23CC3)cs1 ZINC001140311918 1046649856 /nfs/dbraw/zinc/64/98/56/1046649856.db2.gz NFHFKHCWFLEAAX-UHFFFAOYSA-N 1 2 323.462 4.009 20 0 DIADLO Cc1ccc2n[nH]c(C[N@@H+]3CCc4ccc(Cl)cc4C3)c2c1 ZINC001140328215 1046656655 /nfs/dbraw/zinc/65/66/55/1046656655.db2.gz XWVLFEZLVLKZLI-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1ccc2n[nH]c(C[N@H+]3CCc4ccc(Cl)cc4C3)c2c1 ZINC001140328215 1046656658 /nfs/dbraw/zinc/65/66/58/1046656658.db2.gz XWVLFEZLVLKZLI-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H]2CCOc3ccc(F)cc32)c(C)s1 ZINC000678584015 1046662318 /nfs/dbraw/zinc/66/23/18/1046662318.db2.gz KWUOJCCDPUZPCY-YMTOWFKASA-N 1 2 306.406 4.073 20 0 DIADLO Cc1nc(C)c([C@H](C)[NH2+]Cc2c(F)c(F)cc(F)c2F)s1 ZINC000678594367 1046667877 /nfs/dbraw/zinc/66/78/77/1046667877.db2.gz BOYQOEOCKDJPQY-LURJTMIESA-N 1 2 318.339 4.167 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[NH2+]Cc1c(F)c(F)cc(F)c1F ZINC000678594650 1046669569 /nfs/dbraw/zinc/66/95/69/1046669569.db2.gz FNBCMUHQWCLMAY-AWEZNQCLSA-N 1 2 313.269 4.159 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1ccc(-c2ccccn2)cc1 ZINC001140381729 1046680663 /nfs/dbraw/zinc/68/06/63/1046680663.db2.gz KUFCNVOBAXGOEQ-UHFFFAOYSA-N 1 2 316.404 4.063 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1ccc(-c2ccccn2)cc1 ZINC001140381729 1046680675 /nfs/dbraw/zinc/68/06/75/1046680675.db2.gz KUFCNVOBAXGOEQ-UHFFFAOYSA-N 1 2 316.404 4.063 20 0 DIADLO FC1(F)CCC[C@@H]1[NH2+][C@H](Cc1ccncc1)c1cccs1 ZINC000643894509 1046689237 /nfs/dbraw/zinc/68/92/37/1046689237.db2.gz XJVPCMHOGSRNNZ-HIFRSBDPSA-N 1 2 308.397 4.204 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+]Cc2ncc(C(C)(C)C)o2)cc1 ZINC000678734955 1046691004 /nfs/dbraw/zinc/69/10/04/1046691004.db2.gz NJASAESHYIURND-ZDUSSCGKSA-N 1 2 302.418 4.222 20 0 DIADLO CCc1noc(C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)n1 ZINC000678762826 1046695053 /nfs/dbraw/zinc/69/50/53/1046695053.db2.gz PIWIYWKKXLISTF-CQSZACIVSA-N 1 2 323.396 4.275 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2ccc(Cl)cc2)o1)c1nccn1C ZINC000678765087 1046695218 /nfs/dbraw/zinc/69/52/18/1046695218.db2.gz XBWGUANYWQBFIA-LBPRGKRZSA-N 1 2 315.804 4.184 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2[nH]nc3ccccc32)c(F)c1 ZINC001137351064 1046702216 /nfs/dbraw/zinc/70/22/16/1046702216.db2.gz NTZYICSEMLGSPA-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2[nH]nc3ccccc32)c(F)c1 ZINC001137351064 1046702230 /nfs/dbraw/zinc/70/22/30/1046702230.db2.gz NTZYICSEMLGSPA-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2n[nH]c3ccccc32)c(F)c1 ZINC001137351064 1046702245 /nfs/dbraw/zinc/70/22/45/1046702245.db2.gz NTZYICSEMLGSPA-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2n[nH]c3ccccc32)c(F)c1 ZINC001137351064 1046702260 /nfs/dbraw/zinc/70/22/60/1046702260.db2.gz NTZYICSEMLGSPA-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO C[C@H](c1nc2ccccc2n1C(F)F)[N@H+](C)CCC(F)(F)F ZINC000533356498 1046705265 /nfs/dbraw/zinc/70/52/65/1046705265.db2.gz KGVCXTZNYGUCRR-SECBINFHSA-N 1 2 321.293 4.377 20 0 DIADLO C[C@H](c1nc2ccccc2n1C(F)F)[N@@H+](C)CCC(F)(F)F ZINC000533356498 1046705277 /nfs/dbraw/zinc/70/52/77/1046705277.db2.gz KGVCXTZNYGUCRR-SECBINFHSA-N 1 2 321.293 4.377 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CCSc3ccc(Cl)cc32)co1 ZINC000834901349 1046710908 /nfs/dbraw/zinc/71/09/08/1046710908.db2.gz SLLBVFWEROABTM-CYBMUJFWSA-N 1 2 308.834 4.217 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc3ccc(Cl)cn23)Cc2ccccc21 ZINC001140426389 1046718777 /nfs/dbraw/zinc/71/87/77/1046718777.db2.gz LCSBVEBJMRGHAH-ZDUSSCGKSA-N 1 2 311.816 4.107 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnc3ccc(Cl)cn23)Cc2ccccc21 ZINC001140426389 1046718786 /nfs/dbraw/zinc/71/87/86/1046718786.db2.gz LCSBVEBJMRGHAH-ZDUSSCGKSA-N 1 2 311.816 4.107 20 0 DIADLO Fc1ccc([C@H](C[C@@H]2CCOC2)[NH2+][C@@H]2CCCC2(F)F)cc1 ZINC000644547206 1046720300 /nfs/dbraw/zinc/72/03/00/1046720300.db2.gz GUUFBECBTHXIOT-VBNZEHGJSA-N 1 2 313.363 4.071 20 0 DIADLO COC1(C)CC[NH+](Cc2c(Cl)ccc(F)c2Cl)CC1 ZINC001137353600 1046720690 /nfs/dbraw/zinc/72/06/90/1046720690.db2.gz RYTSXOSRVZHDBY-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO O=C1CC[N@@H+](Cc2c[nH]c3cccc(Cl)c23)[C@H]2CCCC[C@H]12 ZINC001140433200 1046722494 /nfs/dbraw/zinc/72/24/94/1046722494.db2.gz SIEPFCZVUDXGRZ-BBRMVZONSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c[nH]c3cccc(Cl)c23)[C@H]2CCCC[C@H]12 ZINC001140433200 1046722509 /nfs/dbraw/zinc/72/25/09/1046722509.db2.gz SIEPFCZVUDXGRZ-BBRMVZONSA-N 1 2 316.832 4.155 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccc1C(F)(F)F)c1ccc(F)cc1F ZINC000678871232 1046724326 /nfs/dbraw/zinc/72/43/26/1046724326.db2.gz AJVIWYGATJLEJT-SECBINFHSA-N 1 2 316.273 4.229 20 0 DIADLO CC(C)CC[C@H]([NH2+]Cc1csnn1)c1ccc(Cl)cc1 ZINC000678898529 1046728528 /nfs/dbraw/zinc/72/85/28/1046728528.db2.gz PHOIHSDAVKRGMW-HNNXBMFYSA-N 1 2 309.866 4.459 20 0 DIADLO CCC[C@@H]([NH2+]Cc1csnn1)c1cccc(C(F)(F)F)c1 ZINC000678921540 1046732273 /nfs/dbraw/zinc/73/22/73/1046732273.db2.gz DEXIFWJBMZLCML-CYBMUJFWSA-N 1 2 315.364 4.188 20 0 DIADLO Cc1ccc(Nc2nc(C[NH2+][C@H](C)c3ccccn3)cs2)cc1 ZINC000678932815 1046739793 /nfs/dbraw/zinc/73/97/93/1046739793.db2.gz XQXVXJWSVPCSDH-CQSZACIVSA-N 1 2 324.453 4.441 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@@H+]1CCc2ccc(O)cc2C1 ZINC000533530320 1046744614 /nfs/dbraw/zinc/74/46/14/1046744614.db2.gz LZKNHZYYXASMBD-SFHVURJKSA-N 1 2 303.352 4.180 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@H+]1CCc2ccc(O)cc2C1 ZINC000533530320 1046744617 /nfs/dbraw/zinc/74/46/17/1046744617.db2.gz LZKNHZYYXASMBD-SFHVURJKSA-N 1 2 303.352 4.180 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c1Cl ZINC001137358536 1046748642 /nfs/dbraw/zinc/74/86/42/1046748642.db2.gz RRYNBHLWVYBPEZ-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c1Cl ZINC001137358536 1046748656 /nfs/dbraw/zinc/74/86/56/1046748656.db2.gz RRYNBHLWVYBPEZ-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO CC(C)c1ccc(C(C)(C)[NH2+]Cc2nc(C(F)F)no2)cc1 ZINC000644926817 1046749267 /nfs/dbraw/zinc/74/92/67/1046749267.db2.gz NDSFIVSVGISZKV-UHFFFAOYSA-N 1 2 309.360 4.156 20 0 DIADLO FC(F)Oc1c(Br)cccc1C[NH+]1CCCCC1 ZINC000533558388 1046750939 /nfs/dbraw/zinc/75/09/39/1046750939.db2.gz KDJMDAQUSIWGOB-UHFFFAOYSA-N 1 2 320.177 4.036 20 0 DIADLO COc1ncc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccco2)cc1Cl ZINC000533558634 1046752724 /nfs/dbraw/zinc/75/27/24/1046752724.db2.gz XPHKMLSVVWTIMU-DOMZBBRYSA-N 1 2 320.820 4.310 20 0 DIADLO COc1ncc(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccco2)cc1Cl ZINC000533558634 1046752739 /nfs/dbraw/zinc/75/27/39/1046752739.db2.gz XPHKMLSVVWTIMU-DOMZBBRYSA-N 1 2 320.820 4.310 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2c(Cl)ccc(F)c2Cl)[C@@H](C)C1 ZINC001137358771 1046755016 /nfs/dbraw/zinc/75/50/16/1046755016.db2.gz CULIOBYDGJZLJT-VHSXEESVSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2c(Cl)ccc(F)c2Cl)[C@@H](C)C1 ZINC001137358771 1046755029 /nfs/dbraw/zinc/75/50/29/1046755029.db2.gz CULIOBYDGJZLJT-VHSXEESVSA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)n1ccn(C[N@@H+]2CCc3sccc3[C@H]2C)c1=S ZINC000835083872 1046756263 /nfs/dbraw/zinc/75/62/63/1046756263.db2.gz GSIJKGZZHNYIGW-GFCCVEGCSA-N 1 2 307.488 4.238 20 0 DIADLO CC(C)n1ccn(C[N@H+]2CCc3sccc3[C@H]2C)c1=S ZINC000835083872 1046756275 /nfs/dbraw/zinc/75/62/75/1046756275.db2.gz GSIJKGZZHNYIGW-GFCCVEGCSA-N 1 2 307.488 4.238 20 0 DIADLO Cc1ccccc1COc1ccc([C@@H](C)[NH2+]Cc2cocn2)cc1 ZINC000679047143 1046763047 /nfs/dbraw/zinc/76/30/47/1046763047.db2.gz BFOMAVIGEZHTOG-MRXNPFEDSA-N 1 2 322.408 4.413 20 0 DIADLO CCc1ccc(CN(C)C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000455475075 1046768326 /nfs/dbraw/zinc/76/83/26/1046768326.db2.gz KPFHERZULRGPOU-UHFFFAOYSA-N 1 2 311.429 4.233 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2c(F)cc(F)cc2F)cc1 ZINC001140533607 1046769241 /nfs/dbraw/zinc/76/92/41/1046769241.db2.gz AKMAWWFSHNMLIZ-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2c(F)cc(F)cc2F)cc1 ZINC001140533607 1046769251 /nfs/dbraw/zinc/76/92/51/1046769251.db2.gz AKMAWWFSHNMLIZ-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@H](C(C)(C)C)C2)c(C)[nH+]1 ZINC000455495286 1046769931 /nfs/dbraw/zinc/76/99/31/1046769931.db2.gz FXZCCPVRNCAAAN-HNNXBMFYSA-N 1 2 303.450 4.297 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H](C(C)(C)C)C2)c(C)[nH+]1 ZINC000455495287 1046772002 /nfs/dbraw/zinc/77/20/02/1046772002.db2.gz FXZCCPVRNCAAAN-OAHLLOKOSA-N 1 2 303.450 4.297 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C)c2cccc(F)c2F)c(C)[nH+]1 ZINC000455492799 1046774224 /nfs/dbraw/zinc/77/42/24/1046774224.db2.gz LLDIHBUNKPXGKI-NSHDSACASA-N 1 2 319.355 4.168 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1cccc(O)c1Cl ZINC000645176864 1046774779 /nfs/dbraw/zinc/77/47/79/1046774779.db2.gz JWGYIWHLZQTPOH-UHFFFAOYSA-N 1 2 317.772 4.090 20 0 DIADLO CCN(C(=O)Nc1c(C)cc(C)[nH+]c1C)[C@@H](C)c1cccnc1 ZINC000455488335 1046775902 /nfs/dbraw/zinc/77/59/02/1046775902.db2.gz UQLZSICUZZSNDR-HNNXBMFYSA-N 1 2 312.417 4.017 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](C)c2ccc(F)c(C)c2)c(C)[nH+]1 ZINC000455499340 1046777839 /nfs/dbraw/zinc/77/78/39/1046777839.db2.gz SHTOWMYCSWPXIE-CYBMUJFWSA-N 1 2 315.392 4.337 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3nc4cc(C)cc(C)c4o3)n2c1 ZINC000679121569 1046777922 /nfs/dbraw/zinc/77/79/22/1046777922.db2.gz FYTWTGRZEINNSJ-UHFFFAOYSA-N 1 2 306.369 4.013 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC(C)(C3CC3)CC2)c(C)[nH+]1 ZINC000455509710 1046779697 /nfs/dbraw/zinc/77/96/97/1046779697.db2.gz GUZKCFSANDBWDB-UHFFFAOYSA-N 1 2 301.434 4.051 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)Cc2ccc(C)c(C)c2)c(C)[nH+]1 ZINC000455510787 1046779778 /nfs/dbraw/zinc/77/97/78/1046779778.db2.gz HIJFEIKFBOIXLU-UHFFFAOYSA-N 1 2 311.429 4.288 20 0 DIADLO CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455507198 1046780145 /nfs/dbraw/zinc/78/01/45/1046780145.db2.gz YRFSUMHIMZVNQQ-WBMJQRKESA-N 1 2 303.450 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@@]2(C)CC(C)C)c(C)[nH+]1 ZINC000455511647 1046780469 /nfs/dbraw/zinc/78/04/69/1046780469.db2.gz HQYKIEXPGSLCMW-SFHVURJKSA-N 1 2 303.450 4.439 20 0 DIADLO Fc1cccc(C[N@@H+]2CC[C@H]2COCc2ccccc2)c1Cl ZINC001140563513 1046783651 /nfs/dbraw/zinc/78/36/51/1046783651.db2.gz ZQSMIPQUKRJSPD-INIZCTEOSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1cccc(C[N@H+]2CC[C@H]2COCc2ccccc2)c1Cl ZINC001140563513 1046783661 /nfs/dbraw/zinc/78/36/61/1046783661.db2.gz ZQSMIPQUKRJSPD-INIZCTEOSA-N 1 2 319.807 4.270 20 0 DIADLO C[N@H+](CCC(=O)c1cccs1)Cc1cccc(F)c1Cl ZINC001140567569 1046785064 /nfs/dbraw/zinc/78/50/64/1046785064.db2.gz BRLGJPQLLHIZMZ-UHFFFAOYSA-N 1 2 311.809 4.245 20 0 DIADLO C[N@@H+](CCC(=O)c1cccs1)Cc1cccc(F)c1Cl ZINC001140567569 1046785078 /nfs/dbraw/zinc/78/50/78/1046785078.db2.gz BRLGJPQLLHIZMZ-UHFFFAOYSA-N 1 2 311.809 4.245 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cc(Cl)ccc2C)o1 ZINC000070786660 1046793909 /nfs/dbraw/zinc/79/39/09/1046793909.db2.gz GIGKNCYKCYZEBK-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2cc(Cl)ccc2C)o1 ZINC000070786660 1046793916 /nfs/dbraw/zinc/79/39/16/1046793916.db2.gz GIGKNCYKCYZEBK-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO CC[N@H+](Cc1cnc(Cl)c(C)c1)Cc1cccc(F)c1F ZINC001139545685 1046806392 /nfs/dbraw/zinc/80/63/92/1046806392.db2.gz AAAZKLRGBILWSU-UHFFFAOYSA-N 1 2 310.775 4.344 20 0 DIADLO CC[N@@H+](Cc1cnc(Cl)c(C)c1)Cc1cccc(F)c1F ZINC001139545685 1046806403 /nfs/dbraw/zinc/80/64/03/1046806403.db2.gz AAAZKLRGBILWSU-UHFFFAOYSA-N 1 2 310.775 4.344 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(Cl)ncc1F ZINC001140607843 1046808348 /nfs/dbraw/zinc/80/83/48/1046808348.db2.gz YATXWAUFGMJGGW-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc(Cl)ncc1F ZINC001140607843 1046808361 /nfs/dbraw/zinc/80/83/61/1046808361.db2.gz YATXWAUFGMJGGW-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(Cl)ncc1F ZINC001140607844 1046809571 /nfs/dbraw/zinc/80/95/71/1046809571.db2.gz YATXWAUFGMJGGW-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1cc(Cl)ncc1F ZINC001140607844 1046809585 /nfs/dbraw/zinc/80/95/85/1046809585.db2.gz YATXWAUFGMJGGW-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1nc(C[N@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)cs1 ZINC000246680614 1046815254 /nfs/dbraw/zinc/81/52/54/1046815254.db2.gz DCUBXVOYTLKZHS-LRDDRELGSA-N 1 2 304.484 4.130 20 0 DIADLO Cc1nc(C[N@@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)cs1 ZINC000246680614 1046815276 /nfs/dbraw/zinc/81/52/76/1046815276.db2.gz DCUBXVOYTLKZHS-LRDDRELGSA-N 1 2 304.484 4.130 20 0 DIADLO CN(C)c1nc(C[NH2+]C(c2ccccc2)c2ccccc2)cs1 ZINC000679344821 1046819898 /nfs/dbraw/zinc/81/98/98/1046819898.db2.gz FOHRUMALLBQWFX-UHFFFAOYSA-N 1 2 323.465 4.088 20 0 DIADLO CN(C)c1nc(C[NH2+]C2c3ccccc3-c3ccccc32)cs1 ZINC000679388053 1046834301 /nfs/dbraw/zinc/83/43/01/1046834301.db2.gz KMJOIWFOXQIKEJ-UHFFFAOYSA-N 1 2 321.449 4.069 20 0 DIADLO CCO[C@H](C)c1nc(C[NH2+]C2(c3ccccc3C)CC2)cs1 ZINC000645980011 1046837008 /nfs/dbraw/zinc/83/70/08/1046837008.db2.gz ZCQHNNOVCRUSTN-CQSZACIVSA-N 1 2 316.470 4.328 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+]2CCC[C@H]2c2ccccc2)n1 ZINC000248005335 1046837808 /nfs/dbraw/zinc/83/78/08/1046837808.db2.gz KTLRLVJEQRYDRW-ZFWWWQNUSA-N 1 2 317.458 4.221 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+]2CCC[C@H]2c2ccccc2)n1 ZINC000248005335 1046837829 /nfs/dbraw/zinc/83/78/29/1046837829.db2.gz KTLRLVJEQRYDRW-ZFWWWQNUSA-N 1 2 317.458 4.221 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2nc(C(C)(C)C)cs2)CC1 ZINC000646000749 1046839540 /nfs/dbraw/zinc/83/95/40/1046839540.db2.gz RXUNWFYUHJHLEM-UHFFFAOYSA-N 1 2 316.470 4.228 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2cccc(F)c2Cl)CC1 ZINC000646001126 1046839947 /nfs/dbraw/zinc/83/99/47/1046839947.db2.gz BJZIAFCFYCDINS-UHFFFAOYSA-N 1 2 305.780 4.267 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2cc(-c3ccccc3)no2)CC1 ZINC000645998578 1046842518 /nfs/dbraw/zinc/84/25/18/1046842518.db2.gz GKUYZTACOIWWOL-UHFFFAOYSA-N 1 2 320.392 4.129 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2csc(C(C)C)n2)c(C)c1 ZINC001140676999 1046846377 /nfs/dbraw/zinc/84/63/77/1046846377.db2.gz VHHXTHXNCCFWAT-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2csc(C(C)C)n2)c(C)c1 ZINC001140676999 1046846392 /nfs/dbraw/zinc/84/63/92/1046846392.db2.gz VHHXTHXNCCFWAT-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@H+]1Cc1cccc(O)c1Cl ZINC000646064433 1046853340 /nfs/dbraw/zinc/85/33/40/1046853340.db2.gz HMZWHSIWSLYTSP-LBPRGKRZSA-N 1 2 303.789 4.001 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1cccc(O)c1Cl ZINC000646064433 1046853363 /nfs/dbraw/zinc/85/33/63/1046853363.db2.gz HMZWHSIWSLYTSP-LBPRGKRZSA-N 1 2 303.789 4.001 20 0 DIADLO C[C@@H]1[C@@H](c2cccc(F)c2)OCC[N@@H+]1CCCCC(F)(F)F ZINC000646063798 1046853910 /nfs/dbraw/zinc/85/39/10/1046853910.db2.gz AZNKGADTEJOHJR-DOMZBBRYSA-N 1 2 319.342 4.320 20 0 DIADLO C[C@@H]1[C@@H](c2cccc(F)c2)OCC[N@H+]1CCCCC(F)(F)F ZINC000646063798 1046853934 /nfs/dbraw/zinc/85/39/34/1046853934.db2.gz AZNKGADTEJOHJR-DOMZBBRYSA-N 1 2 319.342 4.320 20 0 DIADLO Fc1cccc([C@@H]2CC[N@@H+]2Cc2conc2Cc2ccccc2)c1 ZINC000646094933 1046857211 /nfs/dbraw/zinc/85/72/11/1046857211.db2.gz MNDXIWVNWKNXKH-FQEVSTJZSA-N 1 2 322.383 4.352 20 0 DIADLO Fc1cccc([C@@H]2CC[N@H+]2Cc2conc2Cc2ccccc2)c1 ZINC000646094933 1046857226 /nfs/dbraw/zinc/85/72/26/1046857226.db2.gz MNDXIWVNWKNXKH-FQEVSTJZSA-N 1 2 322.383 4.352 20 0 DIADLO FC(F)Oc1cccc(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001212061053 1046859173 /nfs/dbraw/zinc/85/91/73/1046859173.db2.gz RPPGOFCFQYTOTM-UHFFFAOYSA-N 1 2 315.323 4.276 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)o1 ZINC000646117171 1046860325 /nfs/dbraw/zinc/86/03/25/1046860325.db2.gz RMZOGDNGGIBLME-WMLDXEAASA-N 1 2 309.413 4.086 20 0 DIADLO CCc1nnc([C@H](C)[N@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)o1 ZINC000646117171 1046860348 /nfs/dbraw/zinc/86/03/48/1046860348.db2.gz RMZOGDNGGIBLME-WMLDXEAASA-N 1 2 309.413 4.086 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[N@@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646116850 1046861953 /nfs/dbraw/zinc/86/19/53/1046861953.db2.gz HJERXXJRSBAQJM-RHSMWYFYSA-N 1 2 321.424 4.401 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[N@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646116850 1046861974 /nfs/dbraw/zinc/86/19/74/1046861974.db2.gz HJERXXJRSBAQJM-RHSMWYFYSA-N 1 2 321.424 4.401 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)s1 ZINC000646119461 1046862377 /nfs/dbraw/zinc/86/23/77/1046862377.db2.gz UUWKOBJTVNGSJW-CZUORRHYSA-N 1 2 311.454 4.301 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)s1 ZINC000646119461 1046862396 /nfs/dbraw/zinc/86/23/96/1046862396.db2.gz UUWKOBJTVNGSJW-CZUORRHYSA-N 1 2 311.454 4.301 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000679546303 1046866346 /nfs/dbraw/zinc/86/63/46/1046866346.db2.gz OOHYZROFSLAGAN-WDEREUQCSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000679546303 1046866364 /nfs/dbraw/zinc/86/63/64/1046866364.db2.gz OOHYZROFSLAGAN-WDEREUQCSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(Sc3ccccn3)o2)C[C@H]1F ZINC000646153401 1046867962 /nfs/dbraw/zinc/86/79/62/1046867962.db2.gz XBBYZRNWEAOJSV-TZMCWYRMSA-N 1 2 306.406 4.006 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(Sc3ccccn3)o2)C[C@H]1F ZINC000646153401 1046867976 /nfs/dbraw/zinc/86/79/76/1046867976.db2.gz XBBYZRNWEAOJSV-TZMCWYRMSA-N 1 2 306.406 4.006 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000679547996 1046868679 /nfs/dbraw/zinc/86/86/79/1046868679.db2.gz SUZGCTGHIIVHOY-NEPJUHHUSA-N 1 2 324.346 4.013 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1CC(=O)c1c[nH]c2ccccc12 ZINC000679547996 1046868694 /nfs/dbraw/zinc/86/86/94/1046868694.db2.gz SUZGCTGHIIVHOY-NEPJUHHUSA-N 1 2 324.346 4.013 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1ccc(C(C)(C)C)[nH]1 ZINC001137377573 1046872015 /nfs/dbraw/zinc/87/20/15/1046872015.db2.gz CTYTXOHZZMLGIS-UHFFFAOYSA-N 1 2 312.457 4.406 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1ccc(C(C)(C)C)[nH]1 ZINC001137377573 1046872028 /nfs/dbraw/zinc/87/20/28/1046872028.db2.gz CTYTXOHZZMLGIS-UHFFFAOYSA-N 1 2 312.457 4.406 20 0 DIADLO C[N@H+](Cc1cccc(O)c1)Cc1c(Cl)ncc2ccccc21 ZINC001140721038 1046873790 /nfs/dbraw/zinc/87/37/90/1046873790.db2.gz GRUPMKSEEBHIPQ-UHFFFAOYSA-N 1 2 312.800 4.226 20 0 DIADLO C[N@@H+](Cc1cccc(O)c1)Cc1c(Cl)ncc2ccccc21 ZINC001140721038 1046873799 /nfs/dbraw/zinc/87/37/99/1046873799.db2.gz GRUPMKSEEBHIPQ-UHFFFAOYSA-N 1 2 312.800 4.226 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000679584119 1046875784 /nfs/dbraw/zinc/87/57/84/1046875784.db2.gz KZQUZGPSDYMMTR-WCBMZHEXSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000679584119 1046875801 /nfs/dbraw/zinc/87/58/01/1046875801.db2.gz KZQUZGPSDYMMTR-WCBMZHEXSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000679584135 1046876192 /nfs/dbraw/zinc/87/61/92/1046876192.db2.gz LLPWNKZQVJVUSW-WCBMZHEXSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cc(F)c(F)cc1F ZINC000679584135 1046876204 /nfs/dbraw/zinc/87/62/04/1046876204.db2.gz LLPWNKZQVJVUSW-WCBMZHEXSA-N 1 2 311.269 4.267 20 0 DIADLO c1ccc([C@@H]2[N@H+](Cc3nc4c(s3)CCC4)CC23CCC3)cc1 ZINC000646228170 1046876449 /nfs/dbraw/zinc/87/64/49/1046876449.db2.gz SYQOBFJBNZGCNL-SFHVURJKSA-N 1 2 310.466 4.359 20 0 DIADLO c1ccc([C@@H]2[N@@H+](Cc3nc4c(s3)CCC4)CC23CCC3)cc1 ZINC000646228170 1046876463 /nfs/dbraw/zinc/87/64/63/1046876463.db2.gz SYQOBFJBNZGCNL-SFHVURJKSA-N 1 2 310.466 4.359 20 0 DIADLO COc1cccc(Cl)c1C[N@H+](C)CCC(=O)c1ccccc1 ZINC001140728532 1046877210 /nfs/dbraw/zinc/87/72/10/1046877210.db2.gz CNLWRBAKTIJHFB-UHFFFAOYSA-N 1 2 317.816 4.053 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+](C)CCC(=O)c1ccccc1 ZINC001140728532 1046877233 /nfs/dbraw/zinc/87/72/33/1046877233.db2.gz CNLWRBAKTIJHFB-UHFFFAOYSA-N 1 2 317.816 4.053 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000679584122 1046877460 /nfs/dbraw/zinc/87/74/60/1046877460.db2.gz KZQUZGPSDYMMTR-WPRPVWTQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000679584122 1046877468 /nfs/dbraw/zinc/87/74/68/1046877468.db2.gz KZQUZGPSDYMMTR-WPRPVWTQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000679584136 1046877636 /nfs/dbraw/zinc/87/76/36/1046877636.db2.gz LLPWNKZQVJVUSW-WPRPVWTQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cc(F)c(F)cc1F ZINC000679584136 1046877642 /nfs/dbraw/zinc/87/76/42/1046877642.db2.gz LLPWNKZQVJVUSW-WPRPVWTQSA-N 1 2 311.269 4.267 20 0 DIADLO Cc1ccc(Br)c(C[N@@H+](C)Cc2ccsc2)c1 ZINC001137384648 1046889615 /nfs/dbraw/zinc/88/96/15/1046889615.db2.gz IYGFZAZGJJEVMG-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO Cc1ccc(Br)c(C[N@H+](C)Cc2ccsc2)c1 ZINC001137384648 1046889596 /nfs/dbraw/zinc/88/95/96/1046889596.db2.gz IYGFZAZGJJEVMG-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO Cc1cc(C)c(NC(=O)NC2(c3ccccc3C)CC2)c(C)[nH+]1 ZINC000646408432 1046896899 /nfs/dbraw/zinc/89/68/99/1046896899.db2.gz OZCDPQJFEGTYKQ-UHFFFAOYSA-N 1 2 309.413 4.126 20 0 DIADLO Oc1cc(Cl)cc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC001140794248 1046901554 /nfs/dbraw/zinc/90/15/54/1046901554.db2.gz FOUCGQKFJYMPSO-QGZVFWFLSA-N 1 2 319.857 4.336 20 0 DIADLO Oc1cc(Cl)cc(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC001140794248 1046901563 /nfs/dbraw/zinc/90/15/63/1046901563.db2.gz FOUCGQKFJYMPSO-QGZVFWFLSA-N 1 2 319.857 4.336 20 0 DIADLO C[N@H+](Cc1nc2ccccc2s1)Cc1cc(O)cc(Cl)c1 ZINC001140788033 1046901804 /nfs/dbraw/zinc/90/18/04/1046901804.db2.gz YMAHWEQENKAIIN-UHFFFAOYSA-N 1 2 318.829 4.287 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2s1)Cc1cc(O)cc(Cl)c1 ZINC001140788033 1046901816 /nfs/dbraw/zinc/90/18/16/1046901816.db2.gz YMAHWEQENKAIIN-UHFFFAOYSA-N 1 2 318.829 4.287 20 0 DIADLO Cc1ccc(-c2cnc(C[NH2+][C@@H](C)c3cnccc3C)o2)cc1 ZINC000679943686 1046915120 /nfs/dbraw/zinc/91/51/20/1046915120.db2.gz XQDOKWHSCAWHHL-HNNXBMFYSA-N 1 2 307.397 4.204 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+]Cc1csc(Cc2ccccc2)n1 ZINC000679941395 1046915954 /nfs/dbraw/zinc/91/59/54/1046915954.db2.gz CBAOCJSWKDNKIW-OAHLLOKOSA-N 1 2 323.465 4.288 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[NH2+][C@H](C)c3cnccc3C)o2)cc1 ZINC000679940342 1046917243 /nfs/dbraw/zinc/91/72/43/1046917243.db2.gz PFRNWDRCPOTTJD-HUUCEWRRSA-N 1 2 322.412 4.160 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1)Cc1c(F)cc(OC)cc1F ZINC001140827665 1046919133 /nfs/dbraw/zinc/91/91/33/1046919133.db2.gz HJIBZPLKPAGDIK-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1)Cc1c(F)cc(OC)cc1F ZINC001140827665 1046919143 /nfs/dbraw/zinc/91/91/43/1046919143.db2.gz HJIBZPLKPAGDIK-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C[C@@H]1CCC(F)(F)C1 ZINC000798004075 1046919570 /nfs/dbraw/zinc/91/95/70/1046919570.db2.gz BJGYPZURUSWNPN-LBPRGKRZSA-N 1 2 319.355 4.149 20 0 DIADLO C=C(C)[C@@H]([NH2+]Cc1cnc(Cl)s1)c1ccc(F)c(F)c1 ZINC000187767281 1046921314 /nfs/dbraw/zinc/92/13/14/1046921314.db2.gz ZAHFFGKKNMQSJL-CYBMUJFWSA-N 1 2 314.788 4.482 20 0 DIADLO Clc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc(Cl)n1 ZINC001212096277 1046933371 /nfs/dbraw/zinc/93/33/71/1046933371.db2.gz AFLTZLOOJVETLC-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO Cc1cc(C[N@H+](Cc2[nH]cc(C)c2C)Cc2ccccc2)on1 ZINC001140861909 1046934272 /nfs/dbraw/zinc/93/42/72/1046934272.db2.gz SXCFHRAQZUKCJS-UHFFFAOYSA-N 1 2 309.413 4.130 20 0 DIADLO Cc1cc(C[N@@H+](Cc2[nH]cc(C)c2C)Cc2ccccc2)on1 ZINC001140861909 1046934283 /nfs/dbraw/zinc/93/42/83/1046934283.db2.gz SXCFHRAQZUKCJS-UHFFFAOYSA-N 1 2 309.413 4.130 20 0 DIADLO CCOc1ccccc1C[NH2+][C@H]1COCc2cccc(Cl)c21 ZINC000798180191 1046934244 /nfs/dbraw/zinc/93/42/44/1046934244.db2.gz BLWGPHFJTIZWJZ-INIZCTEOSA-N 1 2 317.816 4.100 20 0 DIADLO Clc1cc(Nc2cccc(-n3cc[nH+]c3)c2)cc(Cl)n1 ZINC001212094544 1046936454 /nfs/dbraw/zinc/93/64/54/1046936454.db2.gz UXXRNJWBDRSDBJ-UHFFFAOYSA-N 1 2 305.168 4.318 20 0 DIADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2cc(F)c(C(F)(F)F)c(F)c2)C1 ZINC001140879143 1046940068 /nfs/dbraw/zinc/94/00/68/1046940068.db2.gz RKINRRHLRXCQGB-WPRPVWTQSA-N 1 2 311.269 4.164 20 0 DIADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2cc(F)c(C(F)(F)F)c(F)c2)C1 ZINC001140879143 1046940077 /nfs/dbraw/zinc/94/00/77/1046940077.db2.gz RKINRRHLRXCQGB-WPRPVWTQSA-N 1 2 311.269 4.164 20 0 DIADLO CCc1nnc(C[N@H+](Cc2ccccc2)CC(C)(C)C)s1 ZINC000680050100 1046941850 /nfs/dbraw/zinc/94/18/50/1046941850.db2.gz NIECJEQSBSGEBB-UHFFFAOYSA-N 1 2 303.475 4.149 20 0 DIADLO CCc1nnc(C[N@@H+](Cc2ccccc2)CC(C)(C)C)s1 ZINC000680050100 1046941857 /nfs/dbraw/zinc/94/18/57/1046941857.db2.gz NIECJEQSBSGEBB-UHFFFAOYSA-N 1 2 303.475 4.149 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCCC[C@@H]2c2ccc(C)o2)s1 ZINC000680052866 1046942881 /nfs/dbraw/zinc/94/28/81/1046942881.db2.gz BHKQXFOPMWIDTE-CYBMUJFWSA-N 1 2 305.447 4.119 20 0 DIADLO CCc1nnc(C[N@H+]2CCCCC[C@@H]2c2ccc(C)o2)s1 ZINC000680052866 1046942889 /nfs/dbraw/zinc/94/28/89/1046942889.db2.gz BHKQXFOPMWIDTE-CYBMUJFWSA-N 1 2 305.447 4.119 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(O)c(F)c2F)cc1 ZINC001140893079 1046943218 /nfs/dbraw/zinc/94/32/18/1046943218.db2.gz FFFRMWHTXZQASG-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(O)c(F)c2F)c1 ZINC001140889818 1046943269 /nfs/dbraw/zinc/94/32/69/1046943269.db2.gz LRHKAKBQCXPWPI-OAHLLOKOSA-N 1 2 303.352 4.316 20 0 DIADLO CCc1nnc(C[N@H+](C2CC2)[C@H]2CCCc3ccccc32)s1 ZINC000680062453 1046944083 /nfs/dbraw/zinc/94/40/83/1046944083.db2.gz NZYLMLALJNPLPI-INIZCTEOSA-N 1 2 313.470 4.143 20 0 DIADLO CCc1nnc(C[N@@H+](C2CC2)[C@H]2CCCc3ccccc32)s1 ZINC000680062453 1046944095 /nfs/dbraw/zinc/94/40/95/1046944095.db2.gz NZYLMLALJNPLPI-INIZCTEOSA-N 1 2 313.470 4.143 20 0 DIADLO CCc1nnc(C[N@H+](Cc2ccc(F)cc2)C(C)(C)C)s1 ZINC000680061247 1046945137 /nfs/dbraw/zinc/94/51/37/1046945137.db2.gz UEAHJECPBHEKQV-UHFFFAOYSA-N 1 2 307.438 4.040 20 0 DIADLO CCc1nnc(C[N@@H+](Cc2ccc(F)cc2)C(C)(C)C)s1 ZINC000680061247 1046945141 /nfs/dbraw/zinc/94/51/41/1046945141.db2.gz UEAHJECPBHEKQV-UHFFFAOYSA-N 1 2 307.438 4.040 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2ccc(-c3cccnc3)cc2)s1 ZINC000680075885 1046946279 /nfs/dbraw/zinc/94/62/79/1046946279.db2.gz PWZUZGQJQLCOJG-ZDUSSCGKSA-N 1 2 324.453 4.013 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cnccc2C(F)(F)F)cn1 ZINC001140919716 1046951909 /nfs/dbraw/zinc/95/19/09/1046951909.db2.gz AMOFKYIZHJCJPU-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cnccc2C(F)(F)F)cn1 ZINC001140919716 1046951919 /nfs/dbraw/zinc/95/19/19/1046951919.db2.gz AMOFKYIZHJCJPU-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Fc1ccc(C[NH+](Cc2cnco2)Cc2ccc(F)cc2)cc1 ZINC001140933808 1046952819 /nfs/dbraw/zinc/95/28/19/1046952819.db2.gz JSPOCVVBUDTEKO-UHFFFAOYSA-N 1 2 314.335 4.155 20 0 DIADLO CC[C@@H](C)CCCCC(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC000680189075 1046954838 /nfs/dbraw/zinc/95/48/38/1046954838.db2.gz FKBMEAZVGGVZQU-CQSZACIVSA-N 1 2 320.477 4.272 20 0 DIADLO Cn1nc(C[NH2+]C2(c3ccccc3Cl)CC2)c2ccccc21 ZINC000647224130 1046956152 /nfs/dbraw/zinc/95/61/52/1046956152.db2.gz RTUBAEPGOAHEPV-UHFFFAOYSA-N 1 2 311.816 4.006 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2ccccc2C(F)(F)F)[nH]n1 ZINC001203082951 1046965199 /nfs/dbraw/zinc/96/51/99/1046965199.db2.gz DRUJQZHFMGKTFF-INIZCTEOSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2ccccc2C(F)(F)F)[nH]n1 ZINC001203082951 1046965205 /nfs/dbraw/zinc/96/52/05/1046965205.db2.gz DRUJQZHFMGKTFF-INIZCTEOSA-N 1 2 323.362 4.464 20 0 DIADLO COc1ccc(C2=CC[N@H+](Cc3cnc(Cl)s3)CC2)cc1 ZINC000079316601 1046968364 /nfs/dbraw/zinc/96/83/64/1046968364.db2.gz YFSCDTSTUQMVKS-UHFFFAOYSA-N 1 2 320.845 4.094 20 0 DIADLO COc1ccc(C2=CC[N@@H+](Cc3cnc(Cl)s3)CC2)cc1 ZINC000079316601 1046968373 /nfs/dbraw/zinc/96/83/73/1046968373.db2.gz YFSCDTSTUQMVKS-UHFFFAOYSA-N 1 2 320.845 4.094 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1COC(=O)c1ccoc1C1CC1 ZINC000798704307 1046969354 /nfs/dbraw/zinc/96/93/54/1046969354.db2.gz WBSXUJMIQMZDEV-UHFFFAOYSA-N 1 2 322.364 4.008 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1cc2n(n1)CCCC2)c1cc(F)ccc1F ZINC000647293321 1046969612 /nfs/dbraw/zinc/96/96/12/1046969612.db2.gz AFWYCAYRTQCRDG-SJCJKPOMSA-N 1 2 319.399 4.300 20 0 DIADLO Fc1cc2c(c(F)c1)[C@H]([NH2+][C@@H]1CCSc3ccccc31)CO2 ZINC000680354887 1046971016 /nfs/dbraw/zinc/97/10/16/1046971016.db2.gz KCIAXVHCJHWPPE-ZIAGYGMSSA-N 1 2 319.376 4.225 20 0 DIADLO C[N@H+](CCC(c1ccccc1)c1ccccc1)Cc1csnn1 ZINC001140997274 1046973684 /nfs/dbraw/zinc/97/36/84/1046973684.db2.gz LEMZZVNUKCFYPN-UHFFFAOYSA-N 1 2 323.465 4.192 20 0 DIADLO C[N@@H+](CCC(c1ccccc1)c1ccccc1)Cc1csnn1 ZINC001140997274 1046973694 /nfs/dbraw/zinc/97/36/94/1046973694.db2.gz LEMZZVNUKCFYPN-UHFFFAOYSA-N 1 2 323.465 4.192 20 0 DIADLO CSCCCCCCNC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000836632872 1046977631 /nfs/dbraw/zinc/97/76/31/1046977631.db2.gz RFEJLPXYTUDXLO-UHFFFAOYSA-N 1 2 309.479 4.052 20 0 DIADLO C[C@H]([NH2+]C1(c2ccccc2F)CCC1)c1cc2n(n1)CCCC2 ZINC000647332874 1046980089 /nfs/dbraw/zinc/98/00/89/1046980089.db2.gz GTDLCWXIEQQFPR-AWEZNQCLSA-N 1 2 313.420 4.089 20 0 DIADLO Oc1cccc2ccc(C[N@@H+]3CCc4cc(Cl)ccc4C3)nc12 ZINC001141022385 1046981674 /nfs/dbraw/zinc/98/16/74/1046981674.db2.gz SVTNAVBQDRJBIX-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1cccc2ccc(C[N@H+]3CCc4cc(Cl)ccc4C3)nc12 ZINC001141022385 1046981680 /nfs/dbraw/zinc/98/16/80/1046981680.db2.gz SVTNAVBQDRJBIX-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO C[N@H+](Cc1ccn2ccnc2c1)Cc1ccc(Cl)cc1Cl ZINC001141042433 1046989134 /nfs/dbraw/zinc/98/91/34/1046989134.db2.gz QNSKLNHJXJQEGU-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1ccn2ccnc2c1)Cc1ccc(Cl)cc1Cl ZINC001141042433 1046989140 /nfs/dbraw/zinc/98/91/40/1046989140.db2.gz QNSKLNHJXJQEGU-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO CCCCc1ncc(C[N@H+](CC)Cc2cccc(Cl)c2)[nH]1 ZINC001141071342 1046999008 /nfs/dbraw/zinc/99/90/08/1046999008.db2.gz KXYBCAGBARLWGJ-UHFFFAOYSA-N 1 2 305.853 4.428 20 0 DIADLO CCCCc1ncc(C[N@@H+](CC)Cc2cccc(Cl)c2)[nH]1 ZINC001141071342 1046999023 /nfs/dbraw/zinc/99/90/23/1046999023.db2.gz KXYBCAGBARLWGJ-UHFFFAOYSA-N 1 2 305.853 4.428 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124913 1047004088 /nfs/dbraw/zinc/00/40/88/1047004088.db2.gz BFNFYSMMBXTYEU-BXUZGUMPSA-N 1 2 305.809 4.005 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124913 1047004102 /nfs/dbraw/zinc/00/41/02/1047004102.db2.gz BFNFYSMMBXTYEU-BXUZGUMPSA-N 1 2 305.809 4.005 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1cccc(C)c1Br ZINC001141092429 1047007865 /nfs/dbraw/zinc/00/78/65/1047007865.db2.gz STVLLNRZESQPAP-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1cccc(C)c1Br ZINC001141092429 1047007879 /nfs/dbraw/zinc/00/78/79/1047007879.db2.gz STVLLNRZESQPAP-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO Cc1nc2c(o1)CC[N@H+](Cc1ccccc1-c1cccs1)C2 ZINC001141097740 1047011587 /nfs/dbraw/zinc/01/15/87/1047011587.db2.gz XQPXOTJBGKPPIN-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1nc2c(o1)CC[N@@H+](Cc1ccccc1-c1cccs1)C2 ZINC001141097740 1047011603 /nfs/dbraw/zinc/01/16/03/1047011603.db2.gz XQPXOTJBGKPPIN-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3cocn3)CC2)cc1Cl ZINC000432924242 1047015228 /nfs/dbraw/zinc/01/52/28/1047015228.db2.gz KKAKKCBKKIDZIT-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3cocn3)CC2)cc1Cl ZINC000432924242 1047015237 /nfs/dbraw/zinc/01/52/37/1047015237.db2.gz KKAKKCBKKIDZIT-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO C[C@H]1CCCC[C@H]1c1noc(-c2cccc(Cn3cc[nH+]c3)c2)n1 ZINC000680740277 1047025293 /nfs/dbraw/zinc/02/52/93/1047025293.db2.gz LSBQQAIOTQLSJF-WMLDXEAASA-N 1 2 322.412 4.275 20 0 DIADLO Cc1nc(C[N@H+](Cc2cccc(-c3cccnc3)c2)C2CC2)co1 ZINC000647969460 1047025939 /nfs/dbraw/zinc/02/59/39/1047025939.db2.gz ZNIBNJPQXPKUET-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1nc(C[N@@H+](Cc2cccc(-c3cccnc3)c2)C2CC2)co1 ZINC000647969460 1047025955 /nfs/dbraw/zinc/02/59/55/1047025955.db2.gz ZNIBNJPQXPKUET-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)C1(c2ccccc2)CCC1 ZINC000162798234 1047038039 /nfs/dbraw/zinc/03/80/39/1047038039.db2.gz QZRWINMWHXXPHD-UHFFFAOYSA-N 1 2 317.392 4.137 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1ccc2c(c1)CCC(C)(C)O2 ZINC001141184939 1047037961 /nfs/dbraw/zinc/03/79/61/1047037961.db2.gz SLEPPKDGYNDZPM-UHFFFAOYSA-N 1 2 323.436 4.105 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1ccc2c(c1)CCC(C)(C)O2 ZINC001141184939 1047037968 /nfs/dbraw/zinc/03/79/68/1047037968.db2.gz SLEPPKDGYNDZPM-UHFFFAOYSA-N 1 2 323.436 4.105 20 0 DIADLO COc1cc(CNc2[nH+]c3ccccc3n2C2CC2)cc(OC)c1 ZINC000680852775 1047055453 /nfs/dbraw/zinc/05/54/53/1047055453.db2.gz WFLGVNLCXFFEQO-UHFFFAOYSA-N 1 2 323.396 4.001 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@H]3Cc4[nH]c5ccccc5c4C3)ccc21 ZINC000799724073 1047057877 /nfs/dbraw/zinc/05/78/77/1047057877.db2.gz CUXJCFPSMTWAPO-MRXNPFEDSA-N 1 2 317.436 4.130 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@H]3Cc4[nH]c5ccccc5c4C3)ccc21 ZINC000799724073 1047057885 /nfs/dbraw/zinc/05/78/85/1047057885.db2.gz CUXJCFPSMTWAPO-MRXNPFEDSA-N 1 2 317.436 4.130 20 0 DIADLO CC(C)C[C@@H]1COCC[N@@H+]1Cc1nc(-c2ccccc2)cs1 ZINC000536671993 1047063567 /nfs/dbraw/zinc/06/35/67/1047063567.db2.gz YULKXBIKDVLVPH-MRXNPFEDSA-N 1 2 316.470 4.057 20 0 DIADLO CC(C)C[C@@H]1COCC[N@H+]1Cc1nc(-c2ccccc2)cs1 ZINC000536671993 1047063576 /nfs/dbraw/zinc/06/35/76/1047063576.db2.gz YULKXBIKDVLVPH-MRXNPFEDSA-N 1 2 316.470 4.057 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2Cl)C[N@@H+]1Cc1cccs1 ZINC000536673007 1047064547 /nfs/dbraw/zinc/06/45/47/1047064547.db2.gz ICBYHBWQHKGDEG-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2Cl)C[N@H+]1Cc1cccs1 ZINC000536673007 1047064560 /nfs/dbraw/zinc/06/45/60/1047064560.db2.gz ICBYHBWQHKGDEG-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccon2)ccc1OCc1ccccc1 ZINC001141254203 1047065491 /nfs/dbraw/zinc/06/54/91/1047065491.db2.gz FPYWVNQIVRWCRS-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccon2)ccc1OCc1ccccc1 ZINC001141254203 1047065505 /nfs/dbraw/zinc/06/55/05/1047065505.db2.gz FPYWVNQIVRWCRS-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2nc3c(s2)CCCC3)s1 ZINC000536674036 1047067411 /nfs/dbraw/zinc/06/74/11/1047067411.db2.gz KYPVZASFSQZHMD-UHFFFAOYSA-N 1 2 306.500 4.278 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2nc3c(s2)CCCC3)s1 ZINC000536674036 1047067426 /nfs/dbraw/zinc/06/74/26/1047067426.db2.gz KYPVZASFSQZHMD-UHFFFAOYSA-N 1 2 306.500 4.278 20 0 DIADLO Clc1csc(C[N@@H+]2CC3(CCOCC3)[C@H]2c2ccco2)c1 ZINC000827495521 1047072507 /nfs/dbraw/zinc/07/25/07/1047072507.db2.gz XSTYRDXTTZXTQW-OAHLLOKOSA-N 1 2 323.845 4.348 20 0 DIADLO Clc1csc(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccco2)c1 ZINC000827495521 1047072519 /nfs/dbraw/zinc/07/25/19/1047072519.db2.gz XSTYRDXTTZXTQW-OAHLLOKOSA-N 1 2 323.845 4.348 20 0 DIADLO CC[C@H](C)Oc1cc(C[NH2+][C@@H](CC)C(F)F)ccc1OC ZINC000648619214 1047073867 /nfs/dbraw/zinc/07/38/67/1047073867.db2.gz DTALWRLTGZFBDK-AAEUAGOBSA-N 1 2 301.377 4.006 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)o1 ZINC000536698024 1047076566 /nfs/dbraw/zinc/07/65/66/1047076566.db2.gz MONQHZVVDROILG-XGIHMFCUSA-N 1 2 317.454 4.427 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)o1 ZINC000536698024 1047076580 /nfs/dbraw/zinc/07/65/80/1047076580.db2.gz MONQHZVVDROILG-XGIHMFCUSA-N 1 2 317.454 4.427 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Oc3ccc(F)cc3)cc2)CCC1=O ZINC001141314975 1047086723 /nfs/dbraw/zinc/08/67/23/1047086723.db2.gz KLPXWVVQPZVFFG-CQSZACIVSA-N 1 2 313.372 4.029 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Oc3ccc(F)cc3)cc2)CCC1=O ZINC001141314975 1047086739 /nfs/dbraw/zinc/08/67/39/1047086739.db2.gz KLPXWVVQPZVFFG-CQSZACIVSA-N 1 2 313.372 4.029 20 0 DIADLO COc1cc(Cl)ncc1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001141344837 1047100367 /nfs/dbraw/zinc/10/03/67/1047100367.db2.gz PTRYNPFFOLFHPM-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1cc(Cl)ncc1C[N@@H+]1CC=C(c2ccccc2)CC1 ZINC001141344837 1047100371 /nfs/dbraw/zinc/10/03/71/1047100371.db2.gz PTRYNPFFOLFHPM-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1cccc2cc(CNc3cc(C)[nH+]c(C4CC4)n3)oc21 ZINC001116075423 1047106752 /nfs/dbraw/zinc/10/67/52/1047106752.db2.gz KOXUOBYCTSRSSF-UHFFFAOYSA-N 1 2 309.369 4.029 20 0 DIADLO C[C@@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1cc2ccccc2o1 ZINC000536870844 1047116750 /nfs/dbraw/zinc/11/67/50/1047116750.db2.gz QOBZBKZUIBLUJG-ABAIWWIYSA-N 1 2 317.335 4.095 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@@H+]2CCCCc2ccccc2)no1 ZINC000681400600 1047120635 /nfs/dbraw/zinc/12/06/35/1047120635.db2.gz RYXURKKAFNKOCM-KRWDZBQOSA-N 1 2 313.445 4.182 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@H+]2CCCCc2ccccc2)no1 ZINC000681400600 1047120642 /nfs/dbraw/zinc/12/06/42/1047120642.db2.gz RYXURKKAFNKOCM-KRWDZBQOSA-N 1 2 313.445 4.182 20 0 DIADLO Cc1nc(N2CCC(c3ccc(C(F)(F)F)cc3)CC2)cc[nH+]1 ZINC000536892728 1047121090 /nfs/dbraw/zinc/12/10/90/1047121090.db2.gz HPCJCHHLZONAQD-UHFFFAOYSA-N 1 2 321.346 4.188 20 0 DIADLO Fc1cc2[nH+]ccc(N3CC[C@@H](C(F)F)C3)c2cc1Cl ZINC000649355428 1047121339 /nfs/dbraw/zinc/12/13/39/1047121339.db2.gz RFLILQPPIMYSQT-MRVPVSSYSA-N 1 2 300.711 4.119 20 0 DIADLO C[C@H](c1cccc(Cl)c1F)[N@@H+]1CCC[C@H](OC(F)F)C1 ZINC000681410740 1047121978 /nfs/dbraw/zinc/12/19/78/1047121978.db2.gz XTEAEBOBOLODKT-ZJUUUORDSA-N 1 2 307.743 4.244 20 0 DIADLO C[C@H](c1cccc(Cl)c1F)[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000681410740 1047121980 /nfs/dbraw/zinc/12/19/80/1047121980.db2.gz XTEAEBOBOLODKT-ZJUUUORDSA-N 1 2 307.743 4.244 20 0 DIADLO CC(C)[C@@H]1c2ccccc2CC[N@H+]1Cc1nnc(C2CC2)s1 ZINC000649353351 1047122092 /nfs/dbraw/zinc/12/20/92/1047122092.db2.gz JNLZBHSYOJWLKS-QGZVFWFLSA-N 1 2 313.470 4.171 20 0 DIADLO CC(C)[C@@H]1c2ccccc2CC[N@@H+]1Cc1nnc(C2CC2)s1 ZINC000649353351 1047122095 /nfs/dbraw/zinc/12/20/95/1047122095.db2.gz JNLZBHSYOJWLKS-QGZVFWFLSA-N 1 2 313.470 4.171 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(-c2ccc(F)cc2)[nH]1)c1ccc(C)cc1 ZINC000536909231 1047124885 /nfs/dbraw/zinc/12/48/85/1047124885.db2.gz LADHLVXWHMQWFR-QGZVFWFLSA-N 1 2 324.403 4.160 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(-c2ccc(F)cc2)n[nH]1)c1ccc(C)cc1 ZINC000536909231 1047124886 /nfs/dbraw/zinc/12/48/86/1047124886.db2.gz LADHLVXWHMQWFR-QGZVFWFLSA-N 1 2 324.403 4.160 20 0 DIADLO Cc1cc(N2CCc3c(F)ccc(F)c3C2)[nH+]c2ccccc12 ZINC001116274634 1047125992 /nfs/dbraw/zinc/12/59/92/1047125992.db2.gz SIDOWAJUEZFVHU-UHFFFAOYSA-N 1 2 310.347 4.384 20 0 DIADLO c1c(C[NH+](Cc2ccccc2)Cc2ccccc2)nn2c1CCC2 ZINC000649480744 1047136065 /nfs/dbraw/zinc/13/60/65/1047136065.db2.gz RJGSEWYOLCFYHO-UHFFFAOYSA-N 1 2 317.436 4.032 20 0 DIADLO COc1cc(C)c([C@@H](C)[N@H+](C)Cc2nccn2C(F)F)cc1C ZINC000681664766 1047137712 /nfs/dbraw/zinc/13/77/12/1047137712.db2.gz MJGBFLOVVBOQGP-CYBMUJFWSA-N 1 2 323.387 4.097 20 0 DIADLO COc1cc(C)c([C@@H](C)[N@@H+](C)Cc2nccn2C(F)F)cc1C ZINC000681664766 1047137721 /nfs/dbraw/zinc/13/77/21/1047137721.db2.gz MJGBFLOVVBOQGP-CYBMUJFWSA-N 1 2 323.387 4.097 20 0 DIADLO C[C@@H]([NH2+]Cc1ccon1)c1ccccc1OCc1ccccc1 ZINC000537132550 1047140321 /nfs/dbraw/zinc/14/03/21/1047140321.db2.gz HCAKHZADPSXCFR-OAHLLOKOSA-N 1 2 308.381 4.104 20 0 DIADLO COc1cccc2c(NC3CCC(OC(F)F)CC3)cc[nH+]c12 ZINC000649524006 1047140733 /nfs/dbraw/zinc/14/07/33/1047140733.db2.gz RRIFCMCLTPUZAV-UHFFFAOYSA-N 1 2 322.355 4.206 20 0 DIADLO c1c(C[N@@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)nn2c1CCC2 ZINC000649559644 1047143848 /nfs/dbraw/zinc/14/38/48/1047143848.db2.gz KQIQYAOHWRJULQ-HXUWFJFHSA-N 1 2 320.440 4.038 20 0 DIADLO c1c(C[N@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)nn2c1CCC2 ZINC000649559644 1047143851 /nfs/dbraw/zinc/14/38/51/1047143851.db2.gz KQIQYAOHWRJULQ-HXUWFJFHSA-N 1 2 320.440 4.038 20 0 DIADLO Fc1ccc(CC[NH2+]c2ccc(N3CCSCC3)cc2)cc1 ZINC001116507968 1047149704 /nfs/dbraw/zinc/14/97/04/1047149704.db2.gz WSKVBHYYYLRHSR-UHFFFAOYSA-N 1 2 316.445 4.034 20 0 DIADLO CCCCN(C(=O)C[C@@H](C)n1cc[nH+]c1)[C@H](C)c1ccccc1 ZINC000649590200 1047150225 /nfs/dbraw/zinc/15/02/25/1047150225.db2.gz PEGCNLLNQIRODC-IAGOWNOFSA-N 1 2 313.445 4.224 20 0 DIADLO COc1cccc(CNc2cc(C)c(Br)c(C)[nH+]2)c1 ZINC001116522613 1047151233 /nfs/dbraw/zinc/15/12/33/1047151233.db2.gz SQSGVSQYKOSNOC-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1ncccc1C)c1ccccc1 ZINC001116529351 1047153365 /nfs/dbraw/zinc/15/33/65/1047153365.db2.gz PYJRQNQYHNSKFE-NRFANRHFSA-N 1 2 318.420 4.278 20 0 DIADLO CC[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1cccc(Cl)c1 ZINC001141514856 1047154545 /nfs/dbraw/zinc/15/45/45/1047154545.db2.gz GSHUSEQCQXJRBM-CQSZACIVSA-N 1 2 313.788 4.097 20 0 DIADLO Cc1ccc(CC2CC[NH+](Cc3nccn3C(F)F)CC2)cc1 ZINC001116540845 1047155265 /nfs/dbraw/zinc/15/52/65/1047155265.db2.gz RNJXACCGYQBCPY-UHFFFAOYSA-N 1 2 319.399 4.041 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@@H+]([C@@H](C)c2c(F)cccc2F)C1 ZINC000682038636 1047163854 /nfs/dbraw/zinc/16/38/54/1047163854.db2.gz DYUQCZIYXSRUTR-HZMBPMFUSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@@]1(C(F)(F)F)CCC[N@H+]([C@@H](C)c2c(F)cccc2F)C1 ZINC000682038636 1047163856 /nfs/dbraw/zinc/16/38/56/1047163856.db2.gz DYUQCZIYXSRUTR-HZMBPMFUSA-N 1 2 323.305 4.069 20 0 DIADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1nc(-c2ccsc2)oc1C ZINC000649716083 1047166738 /nfs/dbraw/zinc/16/67/38/1047166738.db2.gz SFQBZWSFMWNBRR-CQSZACIVSA-N 1 2 320.458 4.101 20 0 DIADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1nc(-c2ccsc2)oc1C ZINC000649716083 1047166747 /nfs/dbraw/zinc/16/67/47/1047166747.db2.gz SFQBZWSFMWNBRR-CQSZACIVSA-N 1 2 320.458 4.101 20 0 DIADLO CCc1cnc(C[N@@H+](C)[C@H](CC)c2ccccc2OC)s1 ZINC000682070262 1047167401 /nfs/dbraw/zinc/16/74/01/1047167401.db2.gz CFJINAAZORGJIU-OAHLLOKOSA-N 1 2 304.459 4.297 20 0 DIADLO CCc1cnc(C[N@H+](C)[C@H](CC)c2ccccc2OC)s1 ZINC000682070262 1047167407 /nfs/dbraw/zinc/16/74/07/1047167407.db2.gz CFJINAAZORGJIU-OAHLLOKOSA-N 1 2 304.459 4.297 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2ccc(C)nc2Cl)C2CC2)s1 ZINC000838930713 1047175455 /nfs/dbraw/zinc/17/54/55/1047175455.db2.gz ZGKDKTKVLJPXNL-CYBMUJFWSA-N 1 2 307.850 4.049 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2ccc(C)nc2Cl)C2CC2)s1 ZINC000838930714 1047175610 /nfs/dbraw/zinc/17/56/10/1047175610.db2.gz ZGKDKTKVLJPXNL-ZDUSSCGKSA-N 1 2 307.850 4.049 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(C)nc2Cl)o1 ZINC000838932557 1047177919 /nfs/dbraw/zinc/17/79/19/1047177919.db2.gz KXITZGHKNZJUIB-HNNXBMFYSA-N 1 2 320.820 4.120 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(C)nc2Cl)o1 ZINC000838932557 1047177922 /nfs/dbraw/zinc/17/79/22/1047177922.db2.gz KXITZGHKNZJUIB-HNNXBMFYSA-N 1 2 320.820 4.120 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)cs1 ZINC000649885465 1047184776 /nfs/dbraw/zinc/18/47/76/1047184776.db2.gz RFNOLNKPPLFXIX-UHFFFAOYSA-N 1 2 312.360 4.249 20 0 DIADLO Fc1ccc(C[C@H]2CC[N@H+](Cc3csc(Cl)n3)C2)cc1 ZINC000827859816 1047186972 /nfs/dbraw/zinc/18/69/72/1047186972.db2.gz ONVYOILRUCWQCG-GFCCVEGCSA-N 1 2 310.825 4.000 20 0 DIADLO Fc1ccc(C[C@H]2CC[N@@H+](Cc3csc(Cl)n3)C2)cc1 ZINC000827859816 1047186984 /nfs/dbraw/zinc/18/69/84/1047186984.db2.gz ONVYOILRUCWQCG-GFCCVEGCSA-N 1 2 310.825 4.000 20 0 DIADLO Cc1cc(NC2CCN(c3nccs3)CC2)[nH+]c2ccccc12 ZINC001116897335 1047188693 /nfs/dbraw/zinc/18/86/93/1047188693.db2.gz FOWMFHHYRSYPIP-UHFFFAOYSA-N 1 2 324.453 4.081 20 0 DIADLO C[C@H]1CO[C@@H](c2cccc(Cl)c2)C[N@@H+]1Cc1ccc(O)cc1 ZINC000682407309 1047192535 /nfs/dbraw/zinc/19/25/35/1047192535.db2.gz WZRIJGAJFBUDIZ-SCLBCKFNSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@H]1CO[C@@H](c2cccc(Cl)c2)C[N@H+]1Cc1ccc(O)cc1 ZINC000682407309 1047192538 /nfs/dbraw/zinc/19/25/38/1047192538.db2.gz WZRIJGAJFBUDIZ-SCLBCKFNSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cc2c(s1)CCC2 ZINC000537456677 1047194897 /nfs/dbraw/zinc/19/48/97/1047194897.db2.gz VXKKJSXCQACOPL-CYBMUJFWSA-N 1 2 313.470 4.405 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CC[C@@H](c2ccco2)C1 ZINC000682463128 1047199522 /nfs/dbraw/zinc/19/95/22/1047199522.db2.gz RTUFSMTZVIEBSQ-CQSZACIVSA-N 1 2 308.381 4.139 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccc(Sc3ccccc3)cc2)o1 ZINC000682780981 1047223487 /nfs/dbraw/zinc/22/34/87/1047223487.db2.gz QYUPFVRVYRZISS-UHFFFAOYSA-N 1 2 310.422 4.424 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cc(C(F)(F)F)ccc2F)nc1 ZINC000682786885 1047224066 /nfs/dbraw/zinc/22/40/66/1047224066.db2.gz DDCXDTRABCDQOO-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cc(C(F)(F)F)ccc2F)nc1 ZINC000682786885 1047224076 /nfs/dbraw/zinc/22/40/76/1047224076.db2.gz DDCXDTRABCDQOO-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc3cccnc3cc2F)no1 ZINC001141620578 1047230163 /nfs/dbraw/zinc/23/01/63/1047230163.db2.gz BFSDIJNOZMCOJU-SFHVURJKSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc3cccnc3cc2F)no1 ZINC001141620578 1047230167 /nfs/dbraw/zinc/23/01/67/1047230167.db2.gz BFSDIJNOZMCOJU-SFHVURJKSA-N 1 2 311.360 4.007 20 0 DIADLO Fc1cc2ncccc2cc1C[N@@H+]1CCC[C@H]1c1nccs1 ZINC001141631029 1047238137 /nfs/dbraw/zinc/23/81/37/1047238137.db2.gz IKKHTECEPFFQGQ-INIZCTEOSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1cc2ncccc2cc1C[N@H+]1CCC[C@H]1c1nccs1 ZINC001141631029 1047238141 /nfs/dbraw/zinc/23/81/41/1047238141.db2.gz IKKHTECEPFFQGQ-INIZCTEOSA-N 1 2 313.401 4.168 20 0 DIADLO Cc1cc(C[N@@H+]2CCn3c(Cl)ccc3[C@H]2C)cc(Cl)n1 ZINC000839529691 1047243366 /nfs/dbraw/zinc/24/33/66/1047243366.db2.gz VEXBDMNOZPQUBE-LLVKDONJSA-N 1 2 310.228 4.075 20 0 DIADLO Cc1cc(C[N@H+]2CCn3c(Cl)ccc3[C@H]2C)cc(Cl)n1 ZINC000839529691 1047243376 /nfs/dbraw/zinc/24/33/76/1047243376.db2.gz VEXBDMNOZPQUBE-LLVKDONJSA-N 1 2 310.228 4.075 20 0 DIADLO CCCC[N@H+](Cc1cn(C(C)(C)C)nn1)[C@@H](C)c1ccc(C)o1 ZINC000682994061 1047248270 /nfs/dbraw/zinc/24/82/70/1047248270.db2.gz LITNDSSZANPEIV-HNNXBMFYSA-N 1 2 318.465 4.298 20 0 DIADLO CCCC[N@@H+](Cc1cn(C(C)(C)C)nn1)[C@@H](C)c1ccc(C)o1 ZINC000682994061 1047248275 /nfs/dbraw/zinc/24/82/75/1047248275.db2.gz LITNDSSZANPEIV-HNNXBMFYSA-N 1 2 318.465 4.298 20 0 DIADLO Cc1cccnc1CNc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001117944029 1047249312 /nfs/dbraw/zinc/24/93/12/1047249312.db2.gz CVKARTFSLVCGDC-UHFFFAOYSA-N 1 2 318.424 4.202 20 0 DIADLO COc1cc(C[N@H+](Cc2cscc2Cl)C2CC2)ccc1O ZINC000682999766 1047253116 /nfs/dbraw/zinc/25/31/16/1047253116.db2.gz SLKARVRORWLLGC-UHFFFAOYSA-N 1 2 323.845 4.280 20 0 DIADLO COc1cc(C[N@@H+](Cc2cscc2Cl)C2CC2)ccc1O ZINC000682999766 1047253129 /nfs/dbraw/zinc/25/31/29/1047253129.db2.gz SLKARVRORWLLGC-UHFFFAOYSA-N 1 2 323.845 4.280 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[NH+]1CC2CC(C2)C1 ZINC001141698093 1047270331 /nfs/dbraw/zinc/27/03/31/1047270331.db2.gz PPNKMIQFEWWOON-UHFFFAOYSA-N 1 2 318.617 4.083 20 0 DIADLO C[C@H]1CC[C@@H](c2ccccc2)[N@H+](Cc2ncc(Cl)n2C)C1 ZINC000796436866 1047280626 /nfs/dbraw/zinc/28/06/26/1047280626.db2.gz ZANVGDFEJOYAMS-ZFWWWQNUSA-N 1 2 303.837 4.047 20 0 DIADLO C[C@H]1CC[C@@H](c2ccccc2)[N@@H+](Cc2ncc(Cl)n2C)C1 ZINC000796436866 1047280640 /nfs/dbraw/zinc/28/06/40/1047280640.db2.gz ZANVGDFEJOYAMS-ZFWWWQNUSA-N 1 2 303.837 4.047 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Br)c(F)c2F)C2(CC2)C1 ZINC001141752069 1047285843 /nfs/dbraw/zinc/28/58/43/1047285843.db2.gz WNTNPYSGSUASIT-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Br)c(F)c2F)C2(CC2)C1 ZINC001141752069 1047285860 /nfs/dbraw/zinc/28/58/60/1047285860.db2.gz WNTNPYSGSUASIT-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO CC[N@H+](Cn1nc(C2CC2)n(C2CC2)c1=S)C1CC(C)(C)C1 ZINC000840184633 1047291264 /nfs/dbraw/zinc/29/12/64/1047291264.db2.gz ROISERWXAJPOHP-UHFFFAOYSA-N 1 2 320.506 4.094 20 0 DIADLO CC[N@@H+](Cn1nc(C2CC2)n(C2CC2)c1=S)C1CC(C)(C)C1 ZINC000840184633 1047291268 /nfs/dbraw/zinc/29/12/68/1047291268.db2.gz ROISERWXAJPOHP-UHFFFAOYSA-N 1 2 320.506 4.094 20 0 DIADLO C[C@@H]1CCC[C@]1(C)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000651201702 1047300234 /nfs/dbraw/zinc/30/02/34/1047300234.db2.gz XOSRJKYTVQCZIM-KUHUBIRLSA-N 1 2 322.412 4.059 20 0 DIADLO Cc1nc2ccc(C[NH2+]Cc3nc(C(C)(C)C)co3)cc2s1 ZINC000897944129 1047304802 /nfs/dbraw/zinc/30/48/02/1047304802.db2.gz JHMLEVKMDMMOKA-UHFFFAOYSA-N 1 2 315.442 4.180 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@@H]2CSCCc3ccccc32)n1 ZINC000897943958 1047305853 /nfs/dbraw/zinc/30/58/53/1047305853.db2.gz CHKQOGARUBYWPL-OAHLLOKOSA-N 1 2 316.470 4.092 20 0 DIADLO C[C@H](Nc1ccc([NH+]2CCCC2)cc1)c1ccc2c(c1)OCCO2 ZINC000392135027 1047306472 /nfs/dbraw/zinc/30/64/72/1047306472.db2.gz OEDLVZMCFOXBMW-HNNXBMFYSA-N 1 2 324.424 4.231 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CCC[N@@H+]1Cc1cccc2c1OCO2 ZINC001141960350 1047316819 /nfs/dbraw/zinc/31/68/19/1047316819.db2.gz KHQFXSVOSNOVGE-HNNXBMFYSA-N 1 2 317.335 4.031 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CCC[N@H+]1Cc1cccc2c1OCO2 ZINC001141960350 1047316830 /nfs/dbraw/zinc/31/68/30/1047316830.db2.gz KHQFXSVOSNOVGE-HNNXBMFYSA-N 1 2 317.335 4.031 20 0 DIADLO CC(C)([NH2+]Cc1c(F)c(F)c(F)c(F)c1F)c1ccccc1 ZINC000725799539 1047317837 /nfs/dbraw/zinc/31/78/37/1047317837.db2.gz NMYXAPVDSRPKAR-UHFFFAOYSA-N 1 2 315.285 4.407 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccccc2)c[nH]1)[C@@H](C)c1cccc(O)c1 ZINC001118938984 1047319286 /nfs/dbraw/zinc/31/92/86/1047319286.db2.gz STWOEKXYWKBDSS-HNNXBMFYSA-N 1 2 321.424 4.365 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccccc2)c[nH]1)[C@@H](C)c1cccc(O)c1 ZINC001118938984 1047319301 /nfs/dbraw/zinc/31/93/01/1047319301.db2.gz STWOEKXYWKBDSS-HNNXBMFYSA-N 1 2 321.424 4.365 20 0 DIADLO C[NH+](C)c1ccc(NCc2c(F)cccc2Br)cc1 ZINC000395029025 1047323201 /nfs/dbraw/zinc/32/32/01/1047323201.db2.gz WBNPPLIECYFAGB-UHFFFAOYSA-N 1 2 323.209 4.266 20 0 DIADLO CC(C)n1nccc1CNc1[nH+]c2ccccc2n1C(C)(C)C ZINC001119282156 1047325866 /nfs/dbraw/zinc/32/58/66/1047325866.db2.gz CYBDKPKZVZIWNT-UHFFFAOYSA-N 1 2 311.433 4.181 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccc(C(F)(F)F)nc2)c(C)s1 ZINC001119269405 1047326292 /nfs/dbraw/zinc/32/62/92/1047326292.db2.gz ZXSOWNKDMCDNPA-MRVPVSSYSA-N 1 2 315.364 4.025 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1cc(F)c(F)cc1Br ZINC001142003138 1047341190 /nfs/dbraw/zinc/34/11/90/1047341190.db2.gz JKYSQABCGLGQKD-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1cc(F)c(F)cc1Br ZINC001142003138 1047341206 /nfs/dbraw/zinc/34/12/06/1047341206.db2.gz JKYSQABCGLGQKD-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]C1(c2ccccc2Cl)CCC1 ZINC000652216731 1047348185 /nfs/dbraw/zinc/34/81/85/1047348185.db2.gz DWXGECNMSZDLCM-ZDUSSCGKSA-N 1 2 303.837 4.286 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]C2(c3ccccc3Cl)CCC2)c2nccn21 ZINC000652216948 1047348622 /nfs/dbraw/zinc/34/86/22/1047348622.db2.gz KGWAHVVRXJRPPL-SWLSCSKDSA-N 1 2 301.821 4.211 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H]2CC(C)(C)Oc3ccc(F)cc32)no1 ZINC000652267587 1047350226 /nfs/dbraw/zinc/35/02/26/1047350226.db2.gz XERZMXVETCNXMS-ABAIWWIYSA-N 1 2 304.365 4.075 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2ccccc2Br)c1 ZINC000652330142 1047354409 /nfs/dbraw/zinc/35/44/09/1047354409.db2.gz WHHLMFBGADMWHO-LLVKDONJSA-N 1 2 321.218 4.164 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2cc3cccc(OC)c3o2)c1 ZINC000652330383 1047355679 /nfs/dbraw/zinc/35/56/79/1047355679.db2.gz DYIRHUDOBZTQSA-LBPRGKRZSA-N 1 2 312.369 4.156 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](c2ccc(F)c(F)c2)C(C)C)c1 ZINC000652330496 1047356104 /nfs/dbraw/zinc/35/61/04/1047356104.db2.gz HYKNGXVDACEHEX-QGZVFWFLSA-N 1 2 306.356 4.315 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CCSc3cc(C)c(C)cc32)c1 ZINC000652330308 1047356930 /nfs/dbraw/zinc/35/69/30/1047356930.db2.gz CCWVKIWWLLPWFA-MRXNPFEDSA-N 1 2 314.454 4.494 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](c2ccc(OC)cc2F)C(C)C)c1 ZINC000652331694 1047356954 /nfs/dbraw/zinc/35/69/54/1047356954.db2.gz PRVQLJILXXQYCK-GOSISDBHSA-N 1 2 318.392 4.185 20 0 DIADLO O=c1c2ccccc2sn1C[NH+]1CCC2(CCCCC2)CC1 ZINC000726592480 1047367284 /nfs/dbraw/zinc/36/72/84/1047367284.db2.gz NDOITMOVHVGXGN-UHFFFAOYSA-N 1 2 316.470 4.067 20 0 DIADLO CC[N@H+](Cc1c(F)ccc(Br)c1Cl)C1CC1 ZINC001142080589 1047369534 /nfs/dbraw/zinc/36/95/34/1047369534.db2.gz JNAYYQKTPJMGMF-UHFFFAOYSA-N 1 2 306.606 4.226 20 0 DIADLO CC[N@@H+](Cc1c(F)ccc(Br)c1Cl)C1CC1 ZINC001142080589 1047369550 /nfs/dbraw/zinc/36/95/50/1047369550.db2.gz JNAYYQKTPJMGMF-UHFFFAOYSA-N 1 2 306.606 4.226 20 0 DIADLO Cc1cc(NCc2ccc(=O)[nH]c2)[nH+]c2c1cccc2C(C)C ZINC001168300294 1047369964 /nfs/dbraw/zinc/36/99/64/1047369964.db2.gz JPAFLCRXRKVREK-UHFFFAOYSA-N 1 2 307.397 4.379 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000726693022 1047375183 /nfs/dbraw/zinc/37/51/83/1047375183.db2.gz PUAIFMLCCFWSOV-CQSZACIVSA-N 1 2 311.385 4.221 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000726693022 1047375195 /nfs/dbraw/zinc/37/51/95/1047375195.db2.gz PUAIFMLCCFWSOV-CQSZACIVSA-N 1 2 311.385 4.221 20 0 DIADLO Oc1cc(Cl)c(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c(Cl)c1 ZINC001142105494 1047380300 /nfs/dbraw/zinc/38/03/00/1047380300.db2.gz BWQQISWNEOKUKO-DTORHVGOSA-N 1 2 322.182 4.176 20 0 DIADLO C[C@H](C(=O)Nc1ccc(C(C)(C)C)cc1)[NH+]1CCC(F)(F)CC1 ZINC000796540050 1047383242 /nfs/dbraw/zinc/38/32/42/1047383242.db2.gz PFMMBISJWCFKAL-CYBMUJFWSA-N 1 2 324.415 4.042 20 0 DIADLO CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(F)(F)CC1 ZINC000796540176 1047383527 /nfs/dbraw/zinc/38/35/27/1047383527.db2.gz HHPBTSRBTUZGKC-ZIAGYGMSSA-N 1 2 324.415 4.258 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(C)nc2Cl)cn1 ZINC001142144176 1047389811 /nfs/dbraw/zinc/38/98/11/1047389811.db2.gz YYFWVSRPRXKAQK-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccc(C)nc2Cl)cn1 ZINC001142144176 1047389823 /nfs/dbraw/zinc/38/98/23/1047389823.db2.gz YYFWVSRPRXKAQK-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cn2cc(NC(=O)/C=C\c3ccc(Cl)s3)ccc2[nH+]1 ZINC000726948677 1047395393 /nfs/dbraw/zinc/39/53/93/1047395393.db2.gz ZRZSNDIVHCDVGJ-DAXSKMNVSA-N 1 2 317.801 4.010 20 0 DIADLO COc1ccc(Nc2[nH+]cnc3[nH]ccc32)cc1OC1CCCC1 ZINC000726965993 1047397382 /nfs/dbraw/zinc/39/73/82/1047397382.db2.gz UPQQZSLSEXLBIU-UHFFFAOYSA-N 1 2 324.384 4.032 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ccc(C)cc3F)c2)[nH+]c1C ZINC000749355219 1047413956 /nfs/dbraw/zinc/41/39/56/1047413956.db2.gz KPEODVYBLHCQOX-UHFFFAOYSA-N 1 2 323.371 4.393 20 0 DIADLO CC[C@H]1CCC[C@H]1C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC001142247386 1047415652 /nfs/dbraw/zinc/41/56/52/1047415652.db2.gz XELYNCLWGQWVFI-WMLDXEAASA-N 1 2 311.429 4.458 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CCC(F)(F)[C@H](C)C2)c(Cl)c1 ZINC001142276671 1047421870 /nfs/dbraw/zinc/42/18/70/1047421870.db2.gz CAWVGVGRIFTZEA-SECBINFHSA-N 1 2 324.198 4.479 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CCC(F)(F)[C@H](C)C2)c(Cl)c1 ZINC001142276671 1047421874 /nfs/dbraw/zinc/42/18/74/1047421874.db2.gz CAWVGVGRIFTZEA-SECBINFHSA-N 1 2 324.198 4.479 20 0 DIADLO C[N@H+](Cc1csc(-c2ccco2)n1)Cc1ccc(F)cc1 ZINC000055472333 1047423357 /nfs/dbraw/zinc/42/33/57/1047423357.db2.gz HXDDXAINFBDNTB-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1csc(-c2ccco2)n1)Cc1ccc(F)cc1 ZINC000055472333 1047423362 /nfs/dbraw/zinc/42/33/62/1047423362.db2.gz HXDDXAINFBDNTB-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO COc1ccc(C)cc1C[NH2+][C@H](Cc1ccccc1)c1ncco1 ZINC000653910003 1047432140 /nfs/dbraw/zinc/43/21/40/1047432140.db2.gz SKAQRFZHUXCNPZ-GOSISDBHSA-N 1 2 322.408 4.065 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1C[C@@H](C)OC2(CCCCC2)C1 ZINC000653905833 1047432846 /nfs/dbraw/zinc/43/28/46/1047432846.db2.gz JIHZYZCDFPAGEO-CABCVRRESA-N 1 2 320.477 4.457 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1C[C@@H](C)OC2(CCCCC2)C1 ZINC000653905833 1047432853 /nfs/dbraw/zinc/43/28/53/1047432853.db2.gz JIHZYZCDFPAGEO-CABCVRRESA-N 1 2 320.477 4.457 20 0 DIADLO Oc1ccc2c(c1)[C@H](Nc1ccc([NH+]3CCCC3)cc1)CCC2 ZINC000322999052 1047440392 /nfs/dbraw/zinc/44/03/92/1047440392.db2.gz FECLAFNSWTZENL-HXUWFJFHSA-N 1 2 308.425 4.482 20 0 DIADLO Cc1ccc(COc2ccc(C[N@H+](C)Cc3ccon3)cc2)cc1 ZINC000537615766 1047455787 /nfs/dbraw/zinc/45/57/87/1047455787.db2.gz BNIIJAGCLRTMTP-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1ccc(COc2ccc(C[N@@H+](C)Cc3ccon3)cc2)cc1 ZINC000537615766 1047455789 /nfs/dbraw/zinc/45/57/89/1047455789.db2.gz BNIIJAGCLRTMTP-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO CCCOc1ccc(NCc2c[nH+]cn2CC)cc1OCCC ZINC000841850223 1047459239 /nfs/dbraw/zinc/45/92/39/1047459239.db2.gz FQDQZWVPROXGIO-UHFFFAOYSA-N 1 2 317.433 4.093 20 0 DIADLO CC(C)(C)Sc1ccccc1NC(=O)[C@@H]1CC2CC[NH+]1CC2 ZINC001142632573 1047473902 /nfs/dbraw/zinc/47/39/02/1047473902.db2.gz FLYSYHKDOHHTFE-HNNXBMFYSA-N 1 2 318.486 4.000 20 0 DIADLO CCO[C@@H](C)c1noc(C[NH2+][C@@H](c2ccccc2)C(C)(C)C)n1 ZINC000120510525 1047493284 /nfs/dbraw/zinc/49/32/84/1047493284.db2.gz JWCTYHYHPMYLKN-BBRMVZONSA-N 1 2 317.433 4.044 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2occc2Br)CC1 ZINC000842732224 1047500467 /nfs/dbraw/zinc/50/04/67/1047500467.db2.gz JEQCXHRXGONJSV-UHFFFAOYSA-N 1 2 306.203 4.129 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3occc3Br)CCC2)c1 ZINC000842743218 1047502013 /nfs/dbraw/zinc/50/20/13/1047502013.db2.gz AOQFKWCOLACNGY-UHFFFAOYSA-N 1 2 324.193 4.350 20 0 DIADLO Cc1cc(CNc2cccc[nH+]2)cc(C)c1OCc1ccccn1 ZINC000121576665 1047522411 /nfs/dbraw/zinc/52/24/11/1047522411.db2.gz BARJDPSTWQVWFB-UHFFFAOYSA-N 1 2 319.408 4.285 20 0 DIADLO CC[C@H](NC(=O)[C@H](CC(C)C)n1cc[nH+]c1)c1ccc(C)cc1 ZINC001143084292 1047529981 /nfs/dbraw/zinc/52/99/81/1047529981.db2.gz TZPKPYZGXQWGDN-ROUUACIJSA-N 1 2 313.445 4.046 20 0 DIADLO CC(C)c1ncc(C[N@@H+](Cc2ccco2)C[C@@H]2CCCO2)s1 ZINC000092436248 1047534090 /nfs/dbraw/zinc/53/40/90/1047534090.db2.gz LLAFWNDOWKPSFD-HNNXBMFYSA-N 1 2 320.458 4.041 20 0 DIADLO CC(C)c1ncc(C[N@H+](Cc2ccco2)C[C@@H]2CCCO2)s1 ZINC000092436248 1047534094 /nfs/dbraw/zinc/53/40/94/1047534094.db2.gz LLAFWNDOWKPSFD-HNNXBMFYSA-N 1 2 320.458 4.041 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1c(F)cccc1F)CCC2 ZINC000093365221 1047544645 /nfs/dbraw/zinc/54/46/45/1047544645.db2.gz LUWNHYKIPAUWBS-HNNXBMFYSA-N 1 2 308.397 4.239 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1c(F)cccc1F)CCC2 ZINC000093365221 1047544651 /nfs/dbraw/zinc/54/46/51/1047544651.db2.gz LUWNHYKIPAUWBS-HNNXBMFYSA-N 1 2 308.397 4.239 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c(F)c1F ZINC001143276272 1047546960 /nfs/dbraw/zinc/54/69/60/1047546960.db2.gz LOQBFTFQGPPZQV-OAHLLOKOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2ccccn2)c(F)c1F ZINC001143276272 1047546963 /nfs/dbraw/zinc/54/69/63/1047546963.db2.gz LOQBFTFQGPPZQV-OAHLLOKOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1ccc(C[NH2+][C@H](CCc2ccccc2)C(F)F)cc1 ZINC001203136484 1047546994 /nfs/dbraw/zinc/54/69/94/1047546994.db2.gz PORJYOGEMRMKIO-QGZVFWFLSA-N 1 2 305.368 4.051 20 0 DIADLO Clc1nccc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c1Cl ZINC000843415525 1047548763 /nfs/dbraw/zinc/54/87/63/1047548763.db2.gz IFUPXWILYASQJQ-AWEZNQCLSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1nccc(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c1Cl ZINC000843415525 1047548773 /nfs/dbraw/zinc/54/87/73/1047548773.db2.gz IFUPXWILYASQJQ-AWEZNQCLSA-N 1 2 323.223 4.042 20 0 DIADLO CCCCCC[C@@](C)(CCC)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC001149404612 1047562117 /nfs/dbraw/zinc/56/21/17/1047562117.db2.gz MAHVTDDHVASIBN-GOSISDBHSA-N 1 2 307.482 4.420 20 0 DIADLO CC(C)C[C@@H](c1nc(-c2cccc3[nH]ccc32)no1)n1cc[nH+]c1 ZINC000923826745 1047562309 /nfs/dbraw/zinc/56/23/09/1047562309.db2.gz DCJGRSWCFRTYEL-INIZCTEOSA-N 1 2 321.384 4.050 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001204375754 1047569122 /nfs/dbraw/zinc/56/91/22/1047569122.db2.gz TXRWFCRUCRMBKN-AWEZNQCLSA-N 1 2 307.800 4.033 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001204375754 1047569128 /nfs/dbraw/zinc/56/91/28/1047569128.db2.gz TXRWFCRUCRMBKN-AWEZNQCLSA-N 1 2 307.800 4.033 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H](Cc3ccccc3)C(C)C)cc2[nH+]1 ZINC001150106953 1047573794 /nfs/dbraw/zinc/57/37/94/1047573794.db2.gz VAQCRKKVUDIIGU-KRWDZBQOSA-N 1 2 321.424 4.325 20 0 DIADLO Cc1c[nH+]c2c(c1)N(C(=O)C[C@H]1C[C@H](C)CC(C)(C)C1)CCN2 ZINC001150485957 1047577385 /nfs/dbraw/zinc/57/73/85/1047577385.db2.gz MIXUMNYZTIEDMD-DZGCQCFKSA-N 1 2 315.461 4.001 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)[C@H](CC)c2ccccc2)n1 ZINC000123265720 1047579890 /nfs/dbraw/zinc/57/98/90/1047579890.db2.gz GWIXINJFGDTDKU-UKRRQHHQSA-N 1 2 319.474 4.467 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)[C@H](CC)c2ccccc2)n1 ZINC000123265720 1047579895 /nfs/dbraw/zinc/57/98/95/1047579895.db2.gz GWIXINJFGDTDKU-UKRRQHHQSA-N 1 2 319.474 4.467 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2nc3c(s2)CCCC3)c(F)c1 ZINC000926918098 1047601809 /nfs/dbraw/zinc/60/18/09/1047601809.db2.gz GOGFMXQIAQTECE-NSHDSACASA-N 1 2 320.433 4.020 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cccc(OC)c2F)c1 ZINC000192705341 1047603046 /nfs/dbraw/zinc/60/30/46/1047603046.db2.gz FGAADCKWJYBQSO-UHFFFAOYSA-N 1 2 306.406 4.095 20 0 DIADLO CC(=O)c1ccc(Nc2ccc(C)[nH+]c2C)c(Br)c1 ZINC001203375115 1047605421 /nfs/dbraw/zinc/60/54/21/1047605421.db2.gz SPDVDZFQFVXHPK-UHFFFAOYSA-N 1 2 319.202 4.407 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3CC[C@@H]4C[C@@H]4C3)cc2)[nH+]c1C ZINC001153557332 1047627676 /nfs/dbraw/zinc/62/76/76/1047627676.db2.gz WJUKLFXCLJLXNQ-BZUAXINKSA-N 1 2 309.413 4.068 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C3C(C)(C)C3(C)C)cc2)[nH+]c1C ZINC001153557042 1047627754 /nfs/dbraw/zinc/62/77/54/1047627754.db2.gz TUUFGJMAEXCSFZ-UHFFFAOYSA-N 1 2 311.429 4.314 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@]3(C)CCC[C@H]3C)cc2)[nH+]c1C ZINC001153557066 1047627812 /nfs/dbraw/zinc/62/78/12/1047627812.db2.gz TXTOKUHVBLOFHB-CWTRNNRKSA-N 1 2 311.429 4.458 20 0 DIADLO CCc1ccc(C2=CC[N@H+](Cc3nc(C(C)C)no3)CC2)cc1 ZINC000537858117 1047641287 /nfs/dbraw/zinc/64/12/87/1047641287.db2.gz UDTBKIUZWVKHJC-UHFFFAOYSA-N 1 2 311.429 4.045 20 0 DIADLO CCc1ccc(C2=CC[N@@H+](Cc3nc(C(C)C)no3)CC2)cc1 ZINC000537858117 1047641289 /nfs/dbraw/zinc/64/12/89/1047641289.db2.gz UDTBKIUZWVKHJC-UHFFFAOYSA-N 1 2 311.429 4.045 20 0 DIADLO COc1ccc2[nH+]c(NCc3nc4ccccc4o3)cc(C)c2c1 ZINC001154651113 1047653595 /nfs/dbraw/zinc/65/35/95/1047653595.db2.gz ZQLVRYHTEJJUBI-UHFFFAOYSA-N 1 2 319.364 4.305 20 0 DIADLO C=Cc1ccc(NCCCc2cncc(C(F)(F)F)c2)[nH+]c1 ZINC001154713928 1047654956 /nfs/dbraw/zinc/65/49/56/1047654956.db2.gz ZPFICYVXNIVWST-UHFFFAOYSA-N 1 2 307.319 4.183 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncccc1C(F)(F)F)c1nc(C)cs1 ZINC000152562831 1047656410 /nfs/dbraw/zinc/65/64/10/1047656410.db2.gz AOMLQGKMDOMSLO-LLVKDONJSA-N 1 2 315.364 4.106 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)nc1 ZINC000538152699 1047660253 /nfs/dbraw/zinc/66/02/53/1047660253.db2.gz IDQKUMSFFGQZEB-INIZCTEOSA-N 1 2 319.408 4.428 20 0 DIADLO F[C@@H]1CCCC[C@H]1Nc1cc(-c2ccnc(Cl)c2)cc[nH+]1 ZINC001155058892 1047666146 /nfs/dbraw/zinc/66/61/46/1047666146.db2.gz DWQDVJCSEZTQQD-ZIAGYGMSSA-N 1 2 305.784 4.490 20 0 DIADLO Cc1ccc2c(c1)[C@H](Nc1cc(C)c3cccc(C)c3[nH+]1)C(=O)N2 ZINC001155106467 1047667977 /nfs/dbraw/zinc/66/79/77/1047667977.db2.gz AAQIWPLMRHYZQO-IBGZPJMESA-N 1 2 317.392 4.265 20 0 DIADLO FC(F)(F)c1ccc(CCNc2cc3ccccc3c[nH+]2)cn1 ZINC001155137526 1047668706 /nfs/dbraw/zinc/66/87/06/1047668706.db2.gz KJTFYCOCALXYRR-UHFFFAOYSA-N 1 2 317.314 4.303 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1ncnc2[nH]c3ccc(Cl)cc3c21 ZINC001155179575 1047671079 /nfs/dbraw/zinc/67/10/79/1047671079.db2.gz ARBQUKZIFSMTRO-UHFFFAOYSA-N 1 2 301.781 4.200 20 0 DIADLO COCc1cccc(CSCc2[nH+]cc(C)c(OC)c2C)c1 ZINC000538525871 1047683283 /nfs/dbraw/zinc/68/32/83/1047683283.db2.gz UKPFAXAKAIVIIN-UHFFFAOYSA-N 1 2 317.454 4.287 20 0 DIADLO CC(C)(C)OC(=O)CCNc1[nH+]ccc2cc(Cl)ccc21 ZINC001155679789 1047686591 /nfs/dbraw/zinc/68/65/91/1047686591.db2.gz XUVYFSWVGNBGBC-UHFFFAOYSA-N 1 2 306.793 4.032 20 0 DIADLO C[C@@H]1Cc2ccc(F)cc2[C@@H]1Nc1ccc(N2CCCC2)[nH+]c1 ZINC000538558430 1047687923 /nfs/dbraw/zinc/68/79/23/1047687923.db2.gz AZLUIEGMKSNUML-BFUOFWGJSA-N 1 2 311.404 4.166 20 0 DIADLO COc1cccc(CCNc2[nH+]c3ccccc3cc2C)c1OC ZINC001155859502 1047689632 /nfs/dbraw/zinc/68/96/32/1047689632.db2.gz MXKKGAORKOIVDI-UHFFFAOYSA-N 1 2 322.408 4.215 20 0 DIADLO Cc1cc(N(C)CCC(=O)c2cccs2)[nH+]c2ccccc12 ZINC001155954829 1047692577 /nfs/dbraw/zinc/69/25/77/1047692577.db2.gz FMKACMJFCHEWLJ-UHFFFAOYSA-N 1 2 310.422 4.314 20 0 DIADLO CSc1nc(C)cc(NC(=[NH2+])C23CC4CC(CC(C4)C2)C3)n1 ZINC001155956200 1047692787 /nfs/dbraw/zinc/69/27/87/1047692787.db2.gz NDGWGOLZNOSNPA-UHFFFAOYSA-N 1 2 316.474 4.112 20 0 DIADLO CC(C)(C)c1cc(NC(=[NH2+])C23CC4CC(CC(C4)C2)C3)ncn1 ZINC001155962535 1047693857 /nfs/dbraw/zinc/69/38/57/1047693857.db2.gz RTUPZCVEVFUATP-UHFFFAOYSA-N 1 2 312.461 4.380 20 0 DIADLO c1ccc(-c2cc[nH+]c(NC[C@H]3Cc4ccccc4O3)c2)cc1 ZINC001155969388 1047694568 /nfs/dbraw/zinc/69/45/68/1047694568.db2.gz BHTRUJQQCBPQLQ-GOSISDBHSA-N 1 2 302.377 4.164 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@H](C3CCCCC3)C2)c(C)[nH+]1 ZINC000667118911 1047694694 /nfs/dbraw/zinc/69/46/94/1047694694.db2.gz BGQJPLJDDTVHCN-QGZVFWFLSA-N 1 2 315.461 4.441 20 0 DIADLO CC(=O)c1cc(Nc2ccc(N3CCCCC3)[nH+]c2)cs1 ZINC001214773844 1047698999 /nfs/dbraw/zinc/69/89/99/1047698999.db2.gz WDGIJLZRFVJCDK-UHFFFAOYSA-N 1 2 301.415 4.080 20 0 DIADLO CSc1cc[nH+]c(NCCCOc2ccc(Cl)cc2)c1 ZINC001156196636 1047705250 /nfs/dbraw/zinc/70/52/50/1047705250.db2.gz BEEXZVLKHKOBMY-UHFFFAOYSA-N 1 2 308.834 4.338 20 0 DIADLO CCOc1ccccc1C[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000538752856 1047708515 /nfs/dbraw/zinc/70/85/15/1047708515.db2.gz REJWCOIALWAZQE-RDTXWAMCSA-N 1 2 317.454 4.109 20 0 DIADLO CCOc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000538752856 1047708518 /nfs/dbraw/zinc/70/85/18/1047708518.db2.gz REJWCOIALWAZQE-RDTXWAMCSA-N 1 2 317.454 4.109 20 0 DIADLO Cc1ccc(Nc2ccc(-c3ccc(N)c(O)c3)cc2O)c(C)[nH+]1 ZINC001203376869 1047709087 /nfs/dbraw/zinc/70/90/87/1047709087.db2.gz VTHVJICYFZOPMH-UHFFFAOYSA-N 1 2 321.380 4.102 20 0 DIADLO CCOc1ccccc1C[N@H+]1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000538752855 1047709192 /nfs/dbraw/zinc/70/91/92/1047709192.db2.gz REJWCOIALWAZQE-KSSFIOAISA-N 1 2 317.454 4.109 20 0 DIADLO CCOc1ccccc1C[N@@H+]1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000538752855 1047709199 /nfs/dbraw/zinc/70/91/99/1047709199.db2.gz REJWCOIALWAZQE-KSSFIOAISA-N 1 2 317.454 4.109 20 0 DIADLO CC1(C)CCC[C@@H]1[N@H+](Cc1csnn1)Cc1ccccc1 ZINC000538791057 1047712541 /nfs/dbraw/zinc/71/25/41/1047712541.db2.gz FDDQBOVAXQINJN-INIZCTEOSA-N 1 2 301.459 4.119 20 0 DIADLO CC1(C)CCC[C@@H]1[N@@H+](Cc1csnn1)Cc1ccccc1 ZINC000538791057 1047712550 /nfs/dbraw/zinc/71/25/50/1047712550.db2.gz FDDQBOVAXQINJN-INIZCTEOSA-N 1 2 301.459 4.119 20 0 DIADLO Cc1cccc2c(C)cc(NCC3(c4ccccc4)COC3)[nH+]c12 ZINC001156586666 1047718450 /nfs/dbraw/zinc/71/84/50/1047718450.db2.gz TYRBRGDSZWGFAG-UHFFFAOYSA-N 1 2 318.420 4.232 20 0 DIADLO Clc1ccc([C@H]2COCCN2c2cc3ccccc3c[nH+]2)cc1 ZINC001156713260 1047720800 /nfs/dbraw/zinc/72/08/00/1047720800.db2.gz DYDIYUBWCMZYRT-GOSISDBHSA-N 1 2 324.811 4.466 20 0 DIADLO Cc1nc(NC2(C3CCOCC3)CC2)cc(C2CCCCC2)[nH+]1 ZINC001156919721 1047727796 /nfs/dbraw/zinc/72/77/96/1047727796.db2.gz PQBCGOURPBHSFM-UHFFFAOYSA-N 1 2 315.461 4.204 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[NH2+]Cc2nnc(-c3ccc(F)cc3)[nH]2)c1 ZINC000539056647 1047729706 /nfs/dbraw/zinc/72/97/06/1047729706.db2.gz UBSSAOPZXFQRQF-CQSZACIVSA-N 1 2 324.403 4.078 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[NH2+]Cc2nc(-c3ccc(F)cc3)n[nH]2)c1 ZINC000539056647 1047729711 /nfs/dbraw/zinc/72/97/11/1047729711.db2.gz UBSSAOPZXFQRQF-CQSZACIVSA-N 1 2 324.403 4.078 20 0 DIADLO Clc1ccc2c(cc[nH+]c2NCc2ccc3c(c2)CCO3)c1 ZINC001156968720 1047731269 /nfs/dbraw/zinc/73/12/69/1047731269.db2.gz URSLHIOSKAMVNS-UHFFFAOYSA-N 1 2 310.784 4.435 20 0 DIADLO c1ccc(-c2cc[nH+]c(NCc3ccc4c(c3)CCO4)c2)cc1 ZINC001156968594 1047731296 /nfs/dbraw/zinc/73/12/96/1047731296.db2.gz RXKVCNBHCVFJIZ-UHFFFAOYSA-N 1 2 302.377 4.296 20 0 DIADLO Cc1cc(N[C@@H]2C[C@H]2c2ccc(F)c(F)c2)nc(C(C)C)[nH+]1 ZINC001157301325 1047739079 /nfs/dbraw/zinc/73/90/79/1047739079.db2.gz FCYSPCRYZCUJFB-SWLSCSKDSA-N 1 2 303.356 4.155 20 0 DIADLO CC(C)c1ccc(N2CCc3c([nH]nc3C(F)(F)F)C2)[nH+]c1 ZINC001157343596 1047739814 /nfs/dbraw/zinc/73/98/14/1047739814.db2.gz VBEPWPAFTJKKLM-AWEZNQCLSA-N 1 2 310.323 4.066 20 0 DIADLO CC(C)(C)c1ccc(N2CCc3c([nH]nc3C(F)(F)F)C2)[nH+]c1 ZINC001157351313 1047739880 /nfs/dbraw/zinc/73/98/80/1047739880.db2.gz VGGMEGISPZJNCV-AWEZNQCLSA-N 1 2 324.350 4.240 20 0 DIADLO Cc1cc(Cl)c(C)c(N2CCC(c3cccc(O)c3)CC2)[nH+]1 ZINC001157572111 1047745935 /nfs/dbraw/zinc/74/59/35/1047745935.db2.gz MGCBXPDSCLUEDQ-UHFFFAOYSA-N 1 2 316.832 4.441 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nccn2C)c(OCCC(C)C)c1 ZINC000539319365 1047746329 /nfs/dbraw/zinc/74/63/29/1047746329.db2.gz IZTPKODLWSCMKN-INIZCTEOSA-N 1 2 315.461 4.004 20 0 DIADLO CC1(C)C[C@@H](CNc2cc(SCc3ccccc3)cc[nH+]2)O1 ZINC001157663819 1047748222 /nfs/dbraw/zinc/74/82/22/1047748222.db2.gz MNWMJGIRFVLPAT-HNNXBMFYSA-N 1 2 314.454 4.353 20 0 DIADLO CC1(C)C[C@H](CNc2cc(SCc3ccccc3)cc[nH+]2)O1 ZINC001157663820 1047748484 /nfs/dbraw/zinc/74/84/84/1047748484.db2.gz MNWMJGIRFVLPAT-OAHLLOKOSA-N 1 2 314.454 4.353 20 0 DIADLO CC(C)(C)c1ccc(N2CCC(c3ccc(N)cc3)CC2)[nH+]c1 ZINC001157706537 1047749961 /nfs/dbraw/zinc/74/99/61/1047749961.db2.gz JFOVQUMTQGSFRL-UHFFFAOYSA-N 1 2 309.457 4.345 20 0 DIADLO Cc1cc(N[C@H](c2ccccn2)C(F)(F)F)nc(C(C)C)[nH+]1 ZINC001157686896 1047750203 /nfs/dbraw/zinc/75/02/03/1047750203.db2.gz OYIAWDOGCWJKJZ-CYBMUJFWSA-N 1 2 310.323 4.019 20 0 DIADLO Cc1cccc(NC(=O)C[NH2+][C@@H](C)c2c(F)cccc2Cl)c1 ZINC000539378609 1047750867 /nfs/dbraw/zinc/75/08/67/1047750867.db2.gz BEXVNTNWCDCTHC-LBPRGKRZSA-N 1 2 320.795 4.077 20 0 DIADLO COc1ccc(C2=CCN(c3cc(C(C)C)[nH+]c(C)n3)CC2)cc1 ZINC001157723425 1047750825 /nfs/dbraw/zinc/75/08/25/1047750825.db2.gz QAPXKBUPDQPTES-UHFFFAOYSA-N 1 2 323.440 4.211 20 0 DIADLO CSCc1cc[nH+]c(NCc2ccc(F)c(Cl)c2F)c1 ZINC001157711065 1047751005 /nfs/dbraw/zinc/75/10/05/1047751005.db2.gz PFKAZBYNLSFXRB-UHFFFAOYSA-N 1 2 314.788 4.488 20 0 DIADLO CCOc1ccc[nH+]c1NCc1cccc(C(F)(F)F)c1C ZINC001157737145 1047751443 /nfs/dbraw/zinc/75/14/43/1047751443.db2.gz RKZKPRALQCBACJ-UHFFFAOYSA-N 1 2 310.319 4.420 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)N(C)c1[nH+]ccc2[nH]ccc21 ZINC001157744883 1047752420 /nfs/dbraw/zinc/75/24/20/1047752420.db2.gz HDZHRAJFNNKKNI-KRWDZBQOSA-N 1 2 307.397 4.051 20 0 DIADLO Clc1ccc2nc(NCCc3cn4ccccc4[nH+]3)ccc2c1 ZINC001158142831 1047770068 /nfs/dbraw/zinc/77/00/68/1047770068.db2.gz SAHYLOFCWHPPJS-UHFFFAOYSA-N 1 2 322.799 4.191 20 0 DIADLO Clc1ccc2ccnc(NCCc3cn4ccccc4[nH+]3)c2c1 ZINC001158145962 1047770077 /nfs/dbraw/zinc/77/00/77/1047770077.db2.gz UAHHGVJJIOZOBG-UHFFFAOYSA-N 1 2 322.799 4.191 20 0 DIADLO CSc1cc[nH+]c(NCc2ccsc2Br)c1 ZINC001158194784 1047771388 /nfs/dbraw/zinc/77/13/88/1047771388.db2.gz XOKAPYFBXGWFDE-UHFFFAOYSA-N 1 2 315.261 4.240 20 0 DIADLO COc1cccnc1C[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC001206666810 1047774377 /nfs/dbraw/zinc/77/43/77/1047774377.db2.gz UJYQQBXRMNEBIQ-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cccnc1C[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC001206666810 1047774380 /nfs/dbraw/zinc/77/43/80/1047774380.db2.gz UJYQQBXRMNEBIQ-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1ccnc(CCNc2cc(-c3ccnc(Cl)c3)cc[nH+]2)c1 ZINC001158432132 1047779378 /nfs/dbraw/zinc/77/93/78/1047779378.db2.gz CSFSFSKXDBWKNU-UHFFFAOYSA-N 1 2 324.815 4.155 20 0 DIADLO COC(=O)/C=C/c1cc(C)c[nH+]c1N[C@H]1C[C@H](C)c2ccccc21 ZINC001158472937 1047783285 /nfs/dbraw/zinc/78/32/85/1047783285.db2.gz OHUZXMSIHOOYHA-KGYPOUGPSA-N 1 2 322.408 4.237 20 0 DIADLO COC(=O)/C=C/c1cc(C)c[nH+]c1N[C@H]1C[C@@H](C)c2ccccc21 ZINC001158472941 1047783412 /nfs/dbraw/zinc/78/34/12/1047783412.db2.gz OHUZXMSIHOOYHA-MHMSXWKFSA-N 1 2 322.408 4.237 20 0 DIADLO COCCCNc1cccc(F)c1Nc1ccc(C)[nH+]c1C ZINC001203380777 1047792322 /nfs/dbraw/zinc/79/23/22/1047792322.db2.gz NHDPOTHWHQXJNL-UHFFFAOYSA-N 1 2 303.381 4.030 20 0 DIADLO Cc1cccc2c(C)cc(N[C@@H]3CCc4ccccc4[C@H]3O)[nH+]c12 ZINC001158674314 1047793408 /nfs/dbraw/zinc/79/34/08/1047793408.db2.gz FKKSHKJTADYRII-WIYYLYMNSA-N 1 2 318.420 4.312 20 0 DIADLO O[C@@H]1c2ccccc2CC[C@H]1Nc1[nH+]ccc2cc(Cl)ccc21 ZINC001158686857 1047794056 /nfs/dbraw/zinc/79/40/56/1047794056.db2.gz YXRDTRDFCSZPDA-QZTJIDSGSA-N 1 2 324.811 4.349 20 0 DIADLO CCOc1ccccc1OCCNc1cc(SCC)cc[nH+]1 ZINC001158823365 1047800075 /nfs/dbraw/zinc/80/00/75/1047800075.db2.gz CANYNNWDQRJULD-UHFFFAOYSA-N 1 2 318.442 4.083 20 0 DIADLO COc1cc2ccc(N[C@@H]3C[C@H]3c3ccccc3)[nH+]c2cc1OC ZINC001158840513 1047801769 /nfs/dbraw/zinc/80/17/69/1047801769.db2.gz RWBVSHYBQIZAQU-DOTOQJQBSA-N 1 2 320.392 4.220 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(NCc2ccccc2)cc1 ZINC001159186143 1047818990 /nfs/dbraw/zinc/81/89/90/1047818990.db2.gz OEBOJPCKJJUBDK-UHFFFAOYSA-N 1 2 305.381 4.446 20 0 DIADLO Cc1cc(C)c(Nc2cccc(NC(=O)OC(C)(C)C)n2)c[nH+]1 ZINC001159203930 1047820875 /nfs/dbraw/zinc/82/08/75/1047820875.db2.gz LZWRTCXSKGCIOT-UHFFFAOYSA-N 1 2 314.389 4.184 20 0 DIADLO Cc1cc(NCc2nc(-c3ccccc3)cs2)nc(C2CC2)[nH+]1 ZINC001159214025 1047822048 /nfs/dbraw/zinc/82/20/48/1047822048.db2.gz VBXFEPHOVAZTQD-UHFFFAOYSA-N 1 2 322.437 4.398 20 0 DIADLO Nc1ccc(Nc2cc(C(F)(F)F)ccc2C(F)(F)F)c[nH+]1 ZINC001159281934 1047825435 /nfs/dbraw/zinc/82/54/35/1047825435.db2.gz JILZMXYYZHSNDQ-UHFFFAOYSA-N 1 2 321.224 4.445 20 0 DIADLO CC(C)Oc1ccc(Nc2ccc(N)[nH+]c2)cc1C(F)(F)F ZINC001159281812 1047825756 /nfs/dbraw/zinc/82/57/56/1047825756.db2.gz BWPDITFFVSBPAV-UHFFFAOYSA-N 1 2 311.307 4.213 20 0 DIADLO Nc1ccc(Nc2cc(F)ccc2OCc2ccccc2)c[nH+]1 ZINC001159281200 1047826015 /nfs/dbraw/zinc/82/60/15/1047826015.db2.gz REFZAZZTOVEHQZ-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO Fc1cccc2oc(Nc3cc([C@@H]4CCCC[NH2+]4)no3)cc21 ZINC001159311652 1047830396 /nfs/dbraw/zinc/83/03/96/1047830396.db2.gz NHIWXCPFINVNOC-LBPRGKRZSA-N 1 2 301.321 4.118 20 0 DIADLO COC[C@@H](C)CNc1ccc(Nc2cccc(SC)c2)c[nH+]1 ZINC001182781644 1047845330 /nfs/dbraw/zinc/84/53/30/1047845330.db2.gz MPERKNOAFAOITL-ZDUSSCGKSA-N 1 2 317.458 4.242 20 0 DIADLO c1cncc([C@@H]2CCC[C@H](Nc3c[nH+]cc4c3CCCC4)C2)c1 ZINC001182844938 1047847118 /nfs/dbraw/zinc/84/71/18/1047847118.db2.gz PKCYDVHUVVRIMC-QAPCUYQASA-N 1 2 307.441 4.494 20 0 DIADLO Cc1cccc(NC(=O)C[C@@H](C)Nc2c[nH+]cc3c2CCCC3)c1 ZINC001182843695 1047848367 /nfs/dbraw/zinc/84/83/67/1047848367.db2.gz FWZUQRJAJFZVAX-OAHLLOKOSA-N 1 2 323.440 4.098 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC000924719035 1047852924 /nfs/dbraw/zinc/85/29/24/1047852924.db2.gz WZVUCNBUMAYXFM-MRXNPFEDSA-N 1 2 308.381 4.410 20 0 DIADLO c1cn(Cc2cccc(Nc3ccc(N4CCCC4)cc3)c2)c[nH+]1 ZINC001174526202 1047854965 /nfs/dbraw/zinc/85/49/65/1047854965.db2.gz KTSNRJZVQJSYTJ-UHFFFAOYSA-N 1 2 318.424 4.275 20 0 DIADLO Clc1ccc(C[N@@H+]2Cc3ccccc3OC3(CCC3)C2)nc1 ZINC001197682553 1047867741 /nfs/dbraw/zinc/86/77/41/1047867741.db2.gz PYHMFIXVUTUWNG-UHFFFAOYSA-N 1 2 314.816 4.052 20 0 DIADLO Clc1ccc(C[N@H+]2Cc3ccccc3OC3(CCC3)C2)nc1 ZINC001197682553 1047867764 /nfs/dbraw/zinc/86/77/64/1047867764.db2.gz PYHMFIXVUTUWNG-UHFFFAOYSA-N 1 2 314.816 4.052 20 0 DIADLO c1cc(-c2cccc(Nc3cccc(Cn4cc[nH+]c4)c3)c2)n[nH]1 ZINC001174508379 1047872404 /nfs/dbraw/zinc/87/24/04/1047872404.db2.gz GTUFTGDBUITVAX-UHFFFAOYSA-N 1 2 315.380 4.065 20 0 DIADLO c1cc(-c2cccc(Nc3ccc(Cn4cc[nH+]c4)cc3)c2)n[nH]1 ZINC001174508030 1047873329 /nfs/dbraw/zinc/87/33/29/1047873329.db2.gz FOYAZWIAHDDEFD-UHFFFAOYSA-N 1 2 315.380 4.065 20 0 DIADLO Clc1cncc(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c1Cl ZINC001182979475 1047877483 /nfs/dbraw/zinc/87/74/83/1047877483.db2.gz ZUTHXYPKVKGCCE-CQSZACIVSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cncc(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c1Cl ZINC001182979475 1047877501 /nfs/dbraw/zinc/87/75/01/1047877501.db2.gz ZUTHXYPKVKGCCE-CQSZACIVSA-N 1 2 323.223 4.042 20 0 DIADLO Cc1ccc(Nc2ccccc2C(=O)Nc2cccnc2)c(C)[nH+]1 ZINC001203374602 1047880907 /nfs/dbraw/zinc/88/09/07/1047880907.db2.gz LQXGMNQEVZRQLQ-UHFFFAOYSA-N 1 2 318.380 4.089 20 0 DIADLO FC(F)Oc1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)cc1 ZINC001174522679 1047883969 /nfs/dbraw/zinc/88/39/69/1047883969.db2.gz SVLYZILSHIWVCJ-UHFFFAOYSA-N 1 2 319.355 4.417 20 0 DIADLO CC(C)c1ncsc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174522703 1047884120 /nfs/dbraw/zinc/88/41/20/1047884120.db2.gz VBPIEBDIYGZRNH-UHFFFAOYSA-N 1 2 302.447 4.395 20 0 DIADLO FC(F)(F)c1ccncc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523034 1047884988 /nfs/dbraw/zinc/88/49/88/1047884988.db2.gz DJLAAADNZJWYSW-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO Fc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)c(Cl)c(F)n1 ZINC001174523408 1047885106 /nfs/dbraw/zinc/88/51/06/1047885106.db2.gz MGQOSJYFMJIBAA-UHFFFAOYSA-N 1 2 324.762 4.142 20 0 DIADLO Cc1cnc(Cl)cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174522979 1047885391 /nfs/dbraw/zinc/88/53/91/1047885391.db2.gz BWRLHCMJYVCEMZ-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO Cc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)n(C2CCC2)n1 ZINC001174522794 1047885428 /nfs/dbraw/zinc/88/54/28/1047885428.db2.gz XMPRWIWGZJKVEB-UHFFFAOYSA-N 1 2 311.433 4.045 20 0 DIADLO CCNC(=O)Nc1ccc(Nc2ccc([N@H+](C)CC)cc2)cc1 ZINC001174522154 1047885567 /nfs/dbraw/zinc/88/55/67/1047885567.db2.gz TXBDVCXLHOOJTN-UHFFFAOYSA-N 1 2 312.417 4.028 20 0 DIADLO CCNC(=O)Nc1ccc(Nc2ccc([N@@H+](C)CC)cc2)cc1 ZINC001174522154 1047885577 /nfs/dbraw/zinc/88/55/77/1047885577.db2.gz TXBDVCXLHOOJTN-UHFFFAOYSA-N 1 2 312.417 4.028 20 0 DIADLO Cc1cc(Cl)nc(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174521926 1047885644 /nfs/dbraw/zinc/88/56/44/1047885644.db2.gz BRLBWPVUAHZOEY-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO Cc1c2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc2nn1C ZINC001174524068 1047887377 /nfs/dbraw/zinc/88/73/77/1047887377.db2.gz BUMHOQXPPNAEDI-UHFFFAOYSA-N 1 2 321.428 4.011 20 0 DIADLO COC(OC)c1cc(C)c[nH+]c1N[C@@H](C)c1ccc(C)cc1C ZINC001159632696 1047888263 /nfs/dbraw/zinc/88/82/63/1047888263.db2.gz FLYWCVPUBXCBJD-HNNXBMFYSA-N 1 2 314.429 4.471 20 0 DIADLO COC(=O)/C=C/c1cc(C)c[nH+]c1N[C@@H](C)c1ccc(C)cc1C ZINC001159632765 1047888550 /nfs/dbraw/zinc/88/85/50/1047888550.db2.gz JPRIYOHAWORQEX-DYLHUKMJSA-N 1 2 324.424 4.366 20 0 DIADLO FC(F)Oc1ccccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174524075 1047888985 /nfs/dbraw/zinc/88/89/85/1047888985.db2.gz CCYVWAILWBQOPR-UHFFFAOYSA-N 1 2 319.355 4.417 20 0 DIADLO c1cn2ccc(Nc3cncc(Oc4ccccc4)c3)cc2[nH+]1 ZINC001203560649 1047902085 /nfs/dbraw/zinc/90/20/85/1047902085.db2.gz OGCGHJADGXQXHV-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO C[C@H](c1ccccc1Cl)N(Cc1c[nH+]c2n1CCC2)C1CC1 ZINC000667497563 1047906758 /nfs/dbraw/zinc/90/67/58/1047906758.db2.gz GVSHTEUTIGHCHJ-CYBMUJFWSA-N 1 2 315.848 4.208 20 0 DIADLO Cc1[nH+]cc(CN(Cc2ccc3ccccc3c2)C2CC2)n1C ZINC000667498426 1047908297 /nfs/dbraw/zinc/90/82/97/1047908297.db2.gz IISQYBMSMNNBRT-UHFFFAOYSA-N 1 2 305.425 4.046 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3C[C@]3(C)C(C)C)c2)[nH+]c1C ZINC000775817803 1047925294 /nfs/dbraw/zinc/92/52/94/1047925294.db2.gz HNBSAJIENRVEFA-QFBILLFUSA-N 1 2 311.429 4.314 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3C[C@]3(C)C(C)C)c2)[nH+]c1C ZINC000775817804 1047925350 /nfs/dbraw/zinc/92/53/50/1047925350.db2.gz HNBSAJIENRVEFA-VQIMIIECSA-N 1 2 311.429 4.314 20 0 DIADLO Cc1csc2sc(C[N@@H+]3C[C@H](C)CC[C@@H]3C[NH3+])c(C)c12 ZINC001205827267 1047927586 /nfs/dbraw/zinc/92/75/86/1047927586.db2.gz GDPNZMBPDORKPO-ZWNOBZJWSA-N 1 2 308.516 4.139 20 0 DIADLO Cc1csc2sc(C[N@H+]3C[C@H](C)CC[C@@H]3C[NH3+])c(C)c12 ZINC001205827267 1047927595 /nfs/dbraw/zinc/92/75/95/1047927595.db2.gz GDPNZMBPDORKPO-ZWNOBZJWSA-N 1 2 308.516 4.139 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(-c3scnc3C)cc2)no1 ZINC000667518110 1047927758 /nfs/dbraw/zinc/92/77/58/1047927758.db2.gz OULHBQXICYZSHA-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(-c3scnc3C)cc2)no1 ZINC000667518110 1047927766 /nfs/dbraw/zinc/92/77/66/1047927766.db2.gz OULHBQXICYZSHA-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@H+](Cc1ccnn1C1CCC1)CC2 ZINC001183455896 1047931451 /nfs/dbraw/zinc/93/14/51/1047931451.db2.gz YSYXRPWOKWRKDO-UHFFFAOYSA-N 1 2 315.848 4.128 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@@H+](Cc1ccnn1C1CCC1)CC2 ZINC001183455896 1047931460 /nfs/dbraw/zinc/93/14/60/1047931460.db2.gz YSYXRPWOKWRKDO-UHFFFAOYSA-N 1 2 315.848 4.128 20 0 DIADLO Clc1ccnc(C[NH2+][C@H](c2ccccn2)C2CCC2)c1Cl ZINC001174691323 1047934430 /nfs/dbraw/zinc/93/44/30/1047934430.db2.gz QIYSOQCRZJSZNN-INIZCTEOSA-N 1 2 322.239 4.414 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N[C@H]1CCc2ccc(O)cc2C1 ZINC001159893302 1047943628 /nfs/dbraw/zinc/94/36/28/1047943628.db2.gz XZRIXFNUOUWWMB-KRWDZBQOSA-N 1 2 304.393 4.218 20 0 DIADLO C[N@H+](Cc1c(Cl)cccc1Cl)[C@@H](CO)c1ccccc1 ZINC000479640681 1047945799 /nfs/dbraw/zinc/94/57/99/1047945799.db2.gz QLIGBTQYWMHIPI-INIZCTEOSA-N 1 2 310.224 4.159 20 0 DIADLO C[N@@H+](Cc1c(Cl)cccc1Cl)[C@@H](CO)c1ccccc1 ZINC000479640681 1047945805 /nfs/dbraw/zinc/94/58/05/1047945805.db2.gz QLIGBTQYWMHIPI-INIZCTEOSA-N 1 2 310.224 4.159 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1ccc(N2CCOCC2)cc1 ZINC001174707179 1047946898 /nfs/dbraw/zinc/94/68/98/1047946898.db2.gz DZDVCKOBSLJOJJ-UHFFFAOYSA-N 1 2 311.429 4.094 20 0 DIADLO c1cn(Cc2cccc(Nc3ccc4c(c3)CCCO4)c2)c[nH+]1 ZINC001174721555 1047954939 /nfs/dbraw/zinc/95/49/39/1047954939.db2.gz RZEIJCWLIMLRTE-UHFFFAOYSA-N 1 2 305.381 4.000 20 0 DIADLO c1cn(Cc2ccc(Nc3ccc4c(c3)CCCO4)cc2)c[nH+]1 ZINC001174721144 1047955218 /nfs/dbraw/zinc/95/52/18/1047955218.db2.gz HCSZDOGGFZASPD-UHFFFAOYSA-N 1 2 305.381 4.000 20 0 DIADLO FC(F)(F)c1cncc(Nc2ccc[nH+]c2N2CCCCC2)c1 ZINC001174740285 1047959973 /nfs/dbraw/zinc/95/99/73/1047959973.db2.gz VKJNHMFHPDHGDS-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@H](C)c3ccc(Cl)s3)cc2[nH+]1 ZINC000479775041 1047967723 /nfs/dbraw/zinc/96/77/23/1047967723.db2.gz LUMJHXFRMZYHPC-MRVPVSSYSA-N 1 2 319.817 4.328 20 0 DIADLO COc1ccc(C(F)(F)F)cc1Nc1cccn2cc[nH+]c12 ZINC001174776453 1047968854 /nfs/dbraw/zinc/96/88/54/1047968854.db2.gz RAUBWTNWDNVDEU-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO CC(C)C[C@H](c1nc(-c2ccc3[nH]ccc3c2)no1)n1cc[nH+]c1 ZINC000923810348 1047969102 /nfs/dbraw/zinc/96/91/02/1047969102.db2.gz JYTXZXCMZOQGKP-MRXNPFEDSA-N 1 2 321.384 4.050 20 0 DIADLO CC[C@@H](Nc1cc(N2CCCCC2)nc[nH+]1)c1ccccc1C ZINC001160037938 1047975639 /nfs/dbraw/zinc/97/56/39/1047975639.db2.gz FEIRWXUPIYVKNO-QGZVFWFLSA-N 1 2 310.445 4.339 20 0 DIADLO CC[C@@H](Nc1cc(N2CCCCC2)[nH+]cn1)c1ccccc1C ZINC001160037938 1047975650 /nfs/dbraw/zinc/97/56/50/1047975650.db2.gz FEIRWXUPIYVKNO-QGZVFWFLSA-N 1 2 310.445 4.339 20 0 DIADLO C[C@@H]1CC(C)(C)c2cccc(NC(=O)CCc3ccc(N)[nH+]c3)c21 ZINC001183933885 1047978743 /nfs/dbraw/zinc/97/87/43/1047978743.db2.gz AOCROZOHSAAUIY-CYBMUJFWSA-N 1 2 323.440 4.020 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CCO[C@@H](c4cccs4)C3)[nH]c2c1 ZINC000667562210 1047979072 /nfs/dbraw/zinc/97/90/72/1047979072.db2.gz WLNULKNULHUZBK-QGZVFWFLSA-N 1 2 312.438 4.111 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CCO[C@@H](c4cccs4)C3)[nH]c2c1 ZINC000667562210 1047979087 /nfs/dbraw/zinc/97/90/87/1047979087.db2.gz WLNULKNULHUZBK-QGZVFWFLSA-N 1 2 312.438 4.111 20 0 DIADLO COC(=O)c1cc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)c(C)o1 ZINC000553991831 1047979523 /nfs/dbraw/zinc/97/95/23/1047979523.db2.gz MHHDUCVRNIRYAF-OAHLLOKOSA-N 1 2 319.426 4.019 20 0 DIADLO COC(=O)c1cc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)c(C)o1 ZINC000553991831 1047979533 /nfs/dbraw/zinc/97/95/33/1047979533.db2.gz MHHDUCVRNIRYAF-OAHLLOKOSA-N 1 2 319.426 4.019 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3CCO[C@@H](c4cccs4)C3)cc21 ZINC000667561834 1047981239 /nfs/dbraw/zinc/98/12/39/1047981239.db2.gz JIBXJZNRRREJBY-QGZVFWFLSA-N 1 2 312.438 4.111 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3CCO[C@@H](c4cccs4)C3)cc21 ZINC000667561834 1047981250 /nfs/dbraw/zinc/98/12/50/1047981250.db2.gz JIBXJZNRRREJBY-QGZVFWFLSA-N 1 2 312.438 4.111 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc(F)c2Cl)nc1 ZINC001198596147 1047981909 /nfs/dbraw/zinc/98/19/09/1047981909.db2.gz KIRSMSSPXAHFKO-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cccc(F)c2Cl)nc1 ZINC001198596147 1047981921 /nfs/dbraw/zinc/98/19/21/1047981921.db2.gz KIRSMSSPXAHFKO-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H]1C[C@@H](C(C)(C)C)CC[N@@H+]1CC(=O)Nc1c(F)cccc1F ZINC000553987973 1047983563 /nfs/dbraw/zinc/98/35/63/1047983563.db2.gz UUPXNRRITUCWLM-OLZOCXBDSA-N 1 2 324.415 4.050 20 0 DIADLO C[C@@H]1C[C@@H](C(C)(C)C)CC[N@H+]1CC(=O)Nc1c(F)cccc1F ZINC000553987973 1047983566 /nfs/dbraw/zinc/98/35/66/1047983566.db2.gz UUPXNRRITUCWLM-OLZOCXBDSA-N 1 2 324.415 4.050 20 0 DIADLO CCc1ccc([C@@H](C)NC[C@H](c2cccs2)[NH+]2CCCC2)o1 ZINC000479847646 1047987565 /nfs/dbraw/zinc/98/75/65/1047987565.db2.gz CJMMZMUARBJFJZ-GDBMZVCRSA-N 1 2 318.486 4.391 20 0 DIADLO CNc1ccc(Nc2cccc(F)c2OC2CCCC2)c[nH+]1 ZINC001160187771 1047994544 /nfs/dbraw/zinc/99/45/44/1047994544.db2.gz UHVBOUUVXCFFSD-UHFFFAOYSA-N 1 2 301.365 4.327 20 0 DIADLO Cc1cc(Nc2ccc(N(C)C3CCCCC3)[nH+]c2)ccc1N ZINC001160212574 1047998701 /nfs/dbraw/zinc/99/87/01/1047998701.db2.gz XXUZQNQXKLKILH-UHFFFAOYSA-N 1 2 310.445 4.485 20 0 DIADLO CC(C)(C)[C@@H]1CC[N@H+](Cc2csc(C3CCCC3)n2)CCO1 ZINC001198790953 1048003443 /nfs/dbraw/zinc/00/34/43/1048003443.db2.gz QOYOFNHMOHGQCL-INIZCTEOSA-N 1 2 322.518 4.438 20 0 DIADLO CC(C)(C)[C@@H]1CC[N@@H+](Cc2csc(C3CCCC3)n2)CCO1 ZINC001198790953 1048003458 /nfs/dbraw/zinc/00/34/58/1048003458.db2.gz QOYOFNHMOHGQCL-INIZCTEOSA-N 1 2 322.518 4.438 20 0 DIADLO CCc1cc(OC)ccc1C[N@@H+]1Cc2cccc(Cl)c2C1 ZINC001184187621 1048004000 /nfs/dbraw/zinc/00/40/00/1048004000.db2.gz HYYMDLQYBXHLLX-UHFFFAOYSA-N 1 2 301.817 4.427 20 0 DIADLO CCc1cc(OC)ccc1C[N@H+]1Cc2cccc(Cl)c2C1 ZINC001184187621 1048004017 /nfs/dbraw/zinc/00/40/17/1048004017.db2.gz HYYMDLQYBXHLLX-UHFFFAOYSA-N 1 2 301.817 4.427 20 0 DIADLO C(c1noc(C2CCC2)n1)[N@@H+]1CCC[C@H](C2CCCCC2)C1 ZINC001174862550 1048005371 /nfs/dbraw/zinc/00/53/71/1048005371.db2.gz BEYWQSYTNFUZIW-INIZCTEOSA-N 1 2 303.450 4.129 20 0 DIADLO C(c1noc(C2CCC2)n1)[N@H+]1CCC[C@H](C2CCCCC2)C1 ZINC001174862550 1048005386 /nfs/dbraw/zinc/00/53/86/1048005386.db2.gz BEYWQSYTNFUZIW-INIZCTEOSA-N 1 2 303.450 4.129 20 0 DIADLO Cc1cc(C)c2c(c1)CC[N@@H+](Cc1nccn1-c1ccccc1)C2 ZINC001198853368 1048011788 /nfs/dbraw/zinc/01/17/88/1048011788.db2.gz WYILKGKOXGUTML-UHFFFAOYSA-N 1 2 317.436 4.047 20 0 DIADLO Cc1cc(C)c2c(c1)CC[N@H+](Cc1nccn1-c1ccccc1)C2 ZINC001198853368 1048011800 /nfs/dbraw/zinc/01/18/00/1048011800.db2.gz WYILKGKOXGUTML-UHFFFAOYSA-N 1 2 317.436 4.047 20 0 DIADLO C[C@@]1(c2ccc(F)cc2)C[N@H+](Cc2ccc(Cl)cc2)CCO1 ZINC001203923392 1048021949 /nfs/dbraw/zinc/02/19/49/1048021949.db2.gz NQLWOHYRJYATSV-SFHVURJKSA-N 1 2 319.807 4.227 20 0 DIADLO C[C@@]1(c2ccc(F)cc2)C[N@@H+](Cc2ccc(Cl)cc2)CCO1 ZINC001203923392 1048021962 /nfs/dbraw/zinc/02/19/62/1048021962.db2.gz NQLWOHYRJYATSV-SFHVURJKSA-N 1 2 319.807 4.227 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NC[C@H](C)C1CCCCC1 ZINC001184278853 1048024362 /nfs/dbraw/zinc/02/43/62/1048024362.db2.gz WEKGXRWWABOXLA-HNNXBMFYSA-N 1 2 315.461 4.311 20 0 DIADLO Nc1c(Cl)cccc1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC001199068590 1048027567 /nfs/dbraw/zinc/02/75/67/1048027567.db2.gz MXWCMHRFIGFSHK-GOSISDBHSA-N 1 2 312.800 4.394 20 0 DIADLO Cc1csc(C[NH2+]Cc2ccc(C)cc2OCCC(C)C)n1 ZINC000153505614 1048028138 /nfs/dbraw/zinc/02/81/38/1048028138.db2.gz ZPOICMCQNNYQCM-UHFFFAOYSA-N 1 2 318.486 4.475 20 0 DIADLO Cc1ccc(Nc2ccc(N(C)Cc3ccccc3)[nH+]c2)c(N)c1 ZINC001160337915 1048036668 /nfs/dbraw/zinc/03/66/68/1048036668.db2.gz BXJSBJBVOLHQQO-UHFFFAOYSA-N 1 2 318.424 4.352 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1cc(F)ncc1F ZINC001184452267 1048040965 /nfs/dbraw/zinc/04/09/65/1048040965.db2.gz OWKGXXQETBUACL-UHFFFAOYSA-N 1 2 316.355 4.077 20 0 DIADLO C[C@H](Nc1[nH+]c2ccccc2n1C)c1nccc2ccccc21 ZINC001184452615 1048041916 /nfs/dbraw/zinc/04/19/16/1048041916.db2.gz QSLFYMIXSXZSFN-ZDUSSCGKSA-N 1 2 302.381 4.295 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(N)c(Br)c1 ZINC001160377201 1048042779 /nfs/dbraw/zinc/04/27/79/1048042779.db2.gz KJTFTDOJWAAOSE-UHFFFAOYSA-N 1 2 318.218 4.356 20 0 DIADLO COc1c(C)cnc(CNc2[nH+]c3ccccc3n2C2CC2)c1C ZINC001184463163 1048043637 /nfs/dbraw/zinc/04/36/37/1048043637.db2.gz XZTQYOKXAGKBOH-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Fc1cc(Nc2cccc(Cn3cc[nH+]c3)c2)cc(F)c1F ZINC001174959839 1048050239 /nfs/dbraw/zinc/05/02/39/1048050239.db2.gz NBJPCIVBLASLIY-UHFFFAOYSA-N 1 2 303.287 4.092 20 0 DIADLO COc1ccc(CN(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)cc1 ZINC001184516323 1048055942 /nfs/dbraw/zinc/05/59/42/1048055942.db2.gz PXLGLRWTDUIZOH-UHFFFAOYSA-N 1 2 313.445 4.368 20 0 DIADLO COc1ccc([C@H]2CCCN2c2cc(C)[nH+]c(C3CCC3)n2)cc1 ZINC001184563377 1048056647 /nfs/dbraw/zinc/05/66/47/1048056647.db2.gz HTHZIHIFLDPRTK-GOSISDBHSA-N 1 2 323.440 4.403 20 0 DIADLO Cc1c(F)cc[nH+]c1N[C@@H](c1ccccc1)c1ccc(O)cc1 ZINC001160494555 1048057940 /nfs/dbraw/zinc/05/79/40/1048057940.db2.gz CCFGXQGYUZBDRG-SFHVURJKSA-N 1 2 308.356 4.436 20 0 DIADLO COC(=O)C[C@H](Nc1cc2ccccc2c[nH+]1)C1CCCCC1 ZINC001160557734 1048066951 /nfs/dbraw/zinc/06/69/51/1048066951.db2.gz KPDASTOPAUIUDC-KRWDZBQOSA-N 1 2 312.413 4.159 20 0 DIADLO CCC1(C[NH2+]c2ccc(N3CCCCC3)cc2)CCOCC1 ZINC001199498155 1048071530 /nfs/dbraw/zinc/07/15/30/1048071530.db2.gz IHBWOKDSDSHKJV-UHFFFAOYSA-N 1 2 302.462 4.296 20 0 DIADLO CCOc1cc(F)cc(CNc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001199530175 1048074146 /nfs/dbraw/zinc/07/41/46/1048074146.db2.gz AKYHVKFKIBPXCV-UHFFFAOYSA-N 1 2 311.360 4.022 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1ccc(Cl)cn1 ZINC000480169242 1048075699 /nfs/dbraw/zinc/07/56/99/1048075699.db2.gz WVHJYZMZRGFBJG-MNOVXSKESA-N 1 2 308.784 4.295 20 0 DIADLO Cc1cc(N[C@@H](C)c2c[nH+]c3c(C)cccn23)nc2[nH]ccc21 ZINC001160686614 1048076787 /nfs/dbraw/zinc/07/67/87/1048076787.db2.gz KGBKJNIMBVKUNE-ZDUSSCGKSA-N 1 2 305.385 4.001 20 0 DIADLO Cc1cc2cccnc2c(N[C@@H](C)c2c[nH+]c3c(C)cccn23)n1 ZINC001160687118 1048077053 /nfs/dbraw/zinc/07/70/53/1048077053.db2.gz BYGVTVZWSROURU-AWEZNQCLSA-N 1 2 317.396 4.067 20 0 DIADLO CCc1cc(NCCCO[C@@H](C)c2ccccc2)nc(CC)[nH+]1 ZINC001184666468 1048077097 /nfs/dbraw/zinc/07/70/97/1048077097.db2.gz NANJUZLRHZANLB-HNNXBMFYSA-N 1 2 313.445 4.181 20 0 DIADLO Cc1cccn2c([C@H](C)N[C@H](F)c3ccnc(Cl)c3)c[nH+]c12 ZINC001160682272 1048078303 /nfs/dbraw/zinc/07/83/03/1048078303.db2.gz AJGBBGBHIXCLER-NHYWBVRUSA-N 1 2 318.783 4.010 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3ncc(Cl)cc3F)c[nH+]c12 ZINC001160684031 1048078595 /nfs/dbraw/zinc/07/85/95/1048078595.db2.gz VQKJLSJCCBUASI-JTQLQIEISA-N 1 2 304.756 4.003 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3[nH+]ccc4ccccc43)cnc12 ZINC001160683353 1048078802 /nfs/dbraw/zinc/07/88/02/1048078802.db2.gz MOYQFEVDPDEOCP-AWEZNQCLSA-N 1 2 302.381 4.364 20 0 DIADLO CCc1cc(N[C@H](C)c2ccccc2OC(F)F)nc(CC)[nH+]1 ZINC001184720319 1048081270 /nfs/dbraw/zinc/08/12/70/1048081270.db2.gz PWWLXMOZGDMVBC-LLVKDONJSA-N 1 2 321.371 4.376 20 0 DIADLO CCOc1cc(F)c(Nc2cccc(-n3cc[nH+]c3)c2)cc1F ZINC001175056865 1048083040 /nfs/dbraw/zinc/08/30/40/1048083040.db2.gz UQFQOWWTAFXEGG-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO Cc1noc2ccc(CNc3[nH+]c(C)cc(Cl)c3C)cc12 ZINC001160865323 1048093050 /nfs/dbraw/zinc/09/30/50/1048093050.db2.gz WESGXYMSGFYYHR-UHFFFAOYSA-N 1 2 301.777 4.414 20 0 DIADLO CC(C)c1ccc2ncnc(NCCCNc3cccc[nH+]3)c2c1 ZINC001184892901 1048097076 /nfs/dbraw/zinc/09/70/76/1048097076.db2.gz LINJYBNJZYPFOA-UHFFFAOYSA-N 1 2 321.428 4.062 20 0 DIADLO CCOc1ccc(F)c(Nc2cccc3[nH+]c(C)cn32)c1F ZINC001175039491 1048104000 /nfs/dbraw/zinc/10/40/00/1048104000.db2.gz AUOVWPCYOKUSJQ-UHFFFAOYSA-N 1 2 303.312 4.063 20 0 DIADLO CC(C)n1ncc2cc(Nc3ccc[nH+]c3N3CCCC3)ccc21 ZINC001184964687 1048105097 /nfs/dbraw/zinc/10/50/97/1048105097.db2.gz PWOMTBYARDTBAP-UHFFFAOYSA-N 1 2 321.428 4.356 20 0 DIADLO Oc1cccc(C(F)(F)F)c1Nc1ccc[nH+]c1N1CCCC1 ZINC001184964280 1048105529 /nfs/dbraw/zinc/10/55/29/1048105529.db2.gz KQHBJLDFEVPLGO-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO Cc1cc(Nc2cccc3[nH+]c[nH]c32)n(-c2ccc(Cl)cc2)n1 ZINC001213029173 1048107171 /nfs/dbraw/zinc/10/71/71/1048107171.db2.gz HHOGEFSPILNJDB-UHFFFAOYSA-N 1 2 323.787 4.454 20 0 DIADLO COc1ccc(Nc2ccc[nH+]c2N2CCCC2)c(Cl)c1 ZINC001184969314 1048107393 /nfs/dbraw/zinc/10/73/93/1048107393.db2.gz ZCWBFTUNBPXTME-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO Oc1ccc(Nc2ccc[nH+]c2N2CCCC2)c2ccccc12 ZINC001184968956 1048107486 /nfs/dbraw/zinc/10/74/86/1048107486.db2.gz RARYXPOJNMNREV-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO Nc1cc(Cl)c(Nc2ccc[nH+]c2N2CCCC2)cc1Cl ZINC001184965455 1048107716 /nfs/dbraw/zinc/10/77/16/1048107716.db2.gz VQGOJXHUMIYNOE-UHFFFAOYSA-N 1 2 323.227 4.314 20 0 DIADLO c1c[nH+]c(N2CCCC2)c(Nc2cccc(-c3ccncc3)c2)c1 ZINC001184968985 1048107727 /nfs/dbraw/zinc/10/77/27/1048107727.db2.gz SLWFDFNWSILRBZ-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Cc1cnn(-c2ccccc2C)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213029949 1048111493 /nfs/dbraw/zinc/11/14/93/1048111493.db2.gz ZSWKWUDXOZFFCD-UHFFFAOYSA-N 1 2 303.369 4.109 20 0 DIADLO Cc1ccccc1-c1cc(Nc2cccc3[nH+]c[nH]c32)n(C)n1 ZINC001213030664 1048112297 /nfs/dbraw/zinc/11/22/97/1048112297.db2.gz LMNLJXFELYMABY-UHFFFAOYSA-N 1 2 303.369 4.015 20 0 DIADLO Nc1ccc2c(c1)Cc1cc(Nc3cccc4[nH+]c[nH]c43)ccc1-2 ZINC001213031575 1048118754 /nfs/dbraw/zinc/11/87/54/1048118754.db2.gz GYEHSSVNLZVMKB-UHFFFAOYSA-N 1 2 312.376 4.460 20 0 DIADLO CC(C)(C)c1ccc(NC2(c3ccccc3Cl)COC2)[nH+]c1 ZINC001161269779 1048119512 /nfs/dbraw/zinc/11/95/12/1048119512.db2.gz AOZZJUYHWQWCHT-UHFFFAOYSA-N 1 2 316.832 4.370 20 0 DIADLO Cc1cc(NCc2cccc3cccnc32)nc(C2CCC2)[nH+]1 ZINC001185098343 1048127297 /nfs/dbraw/zinc/12/72/97/1048127297.db2.gz LIHJIKZCPRSJHX-UHFFFAOYSA-N 1 2 304.397 4.213 20 0 DIADLO CSc1ccnc(Cl)c1NCc1c[nH+]cn1CC1CCC1 ZINC001161533322 1048136410 /nfs/dbraw/zinc/13/64/10/1048136410.db2.gz MHLZLJFZEQBRGX-UHFFFAOYSA-N 1 2 322.865 4.066 20 0 DIADLO Cc1ccc2nc(NCc3c[nH+]cn3CC3CCC3)ccc2c1 ZINC001161529310 1048136776 /nfs/dbraw/zinc/13/67/76/1048136776.db2.gz GIHGBUAVNGTWIR-UHFFFAOYSA-N 1 2 306.413 4.152 20 0 DIADLO Cc1cccc2c(C)cc(NCc3ccnc(OC(C)C)n3)[nH+]c12 ZINC001161603141 1048142183 /nfs/dbraw/zinc/14/21/83/1048142183.db2.gz VNYIADWEMWZGGM-UHFFFAOYSA-N 1 2 322.412 4.041 20 0 DIADLO C[C@@H](CCc1ccccc1)Nc1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001161615674 1048144256 /nfs/dbraw/zinc/14/42/56/1048144256.db2.gz HJKPZSJYIBVGBI-HNNXBMFYSA-N 1 2 309.388 4.445 20 0 DIADLO C[C@H](CCc1ccccc1)Nc1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001161615675 1048144452 /nfs/dbraw/zinc/14/44/52/1048144452.db2.gz HJKPZSJYIBVGBI-OAHLLOKOSA-N 1 2 309.388 4.445 20 0 DIADLO Fc1ccc(Br)c(Nc2cccc3[nH+]c[nH]c32)c1F ZINC001213034466 1048150964 /nfs/dbraw/zinc/15/09/64/1048150964.db2.gz LTOVPLIAGQHPRH-UHFFFAOYSA-N 1 2 324.128 4.347 20 0 DIADLO COc1cc(NCCCn2cc[nH+]c2)ccc1-c1ccccc1 ZINC001161688236 1048155821 /nfs/dbraw/zinc/15/58/21/1048155821.db2.gz MOFQGZBWFZEIIC-UHFFFAOYSA-N 1 2 307.397 4.061 20 0 DIADLO Fc1cc(F)c(Nc2ccc[nH+]c2N2CCCCC2)c(F)c1 ZINC001175144016 1048167009 /nfs/dbraw/zinc/16/70/09/1048167009.db2.gz KWUWFCRFEFBIAF-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO COc1ncccc1[C@H](Nc1cc2ccccc2c[nH+]1)C1CC1 ZINC001161787167 1048172007 /nfs/dbraw/zinc/17/20/07/1048172007.db2.gz YOCOYOWJEYZMTO-GOSISDBHSA-N 1 2 305.381 4.202 20 0 DIADLO CC(C)Cn1cnc(CNc2[nH+]ccc3cc(Cl)ccc32)c1 ZINC001161793755 1048173222 /nfs/dbraw/zinc/17/32/22/1048173222.db2.gz GPHRBVDHVUPGBP-UHFFFAOYSA-N 1 2 314.820 4.353 20 0 DIADLO Cc1nc(N[C@H](c2ccnc(F)c2)C2CC2)cc(C(C)C)[nH+]1 ZINC001161841257 1048182599 /nfs/dbraw/zinc/18/25/99/1048182599.db2.gz NMMDVHYOBCURDG-KRWDZBQOSA-N 1 2 300.381 4.006 20 0 DIADLO CCOc1cccc(CNc2cc(C)c3cccc(C)c3[nH+]2)n1 ZINC001161886513 1048189087 /nfs/dbraw/zinc/18/90/87/1048189087.db2.gz JCEOXXOTHOAVJT-UHFFFAOYSA-N 1 2 307.397 4.257 20 0 DIADLO CCOc1cccc(CNc2[nH+]ccc3cc(Cl)ccc32)n1 ZINC001161886808 1048189440 /nfs/dbraw/zinc/18/94/40/1048189440.db2.gz SWFQVRHNYXGDMC-UHFFFAOYSA-N 1 2 313.788 4.294 20 0 DIADLO CN(Cc1ccccc1Cl)c1nc2ccccc2n2c[nH+]cc12 ZINC001161947480 1048196399 /nfs/dbraw/zinc/19/63/99/1048196399.db2.gz GQLXEWOFSGJNKU-UHFFFAOYSA-N 1 2 322.799 4.172 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ncc(C(C)C)o2)cc1 ZINC000774899148 1048203010 /nfs/dbraw/zinc/20/30/10/1048203010.db2.gz FUBBPOZDOWTEBR-CQSZACIVSA-N 1 2 302.418 4.436 20 0 DIADLO Cc1cc(CNc2cccc(-n3cccn3)c2)c2c([nH+]1)CCCC2 ZINC001201160486 1048206359 /nfs/dbraw/zinc/20/63/59/1048206359.db2.gz VLLUXFZKQFBMSN-UHFFFAOYSA-N 1 2 318.424 4.067 20 0 DIADLO Cc1cc(NCc2cccc(OC(F)F)c2)[nH+]c2cc[nH]c21 ZINC001161990283 1048209512 /nfs/dbraw/zinc/20/95/12/1048209512.db2.gz CPJTWSOJTFYOIH-UHFFFAOYSA-N 1 2 303.312 4.085 20 0 DIADLO Cc1nccnc1CNc1cc(SCc2ccccc2)cc[nH+]1 ZINC001162004016 1048211418 /nfs/dbraw/zinc/21/14/18/1048211418.db2.gz RBTONBSHCMDFMG-UHFFFAOYSA-N 1 2 322.437 4.084 20 0 DIADLO CSc1nc(NCC2(C)CCC(F)(F)CC2)cc(C)[nH+]1 ZINC001162028010 1048216332 /nfs/dbraw/zinc/21/63/32/1048216332.db2.gz ZAKYKBVWJSRDEZ-UHFFFAOYSA-N 1 2 301.406 4.134 20 0 DIADLO Cc1[nH+]c2c(NC(=S)Nc3cc(C)cc(C)c3)cccn2c1C ZINC001201198622 1048216537 /nfs/dbraw/zinc/21/65/37/1048216537.db2.gz DBMJQDHXUXEFNB-UHFFFAOYSA-N 1 2 324.453 4.377 20 0 DIADLO C[C@@H](c1ccc(F)cc1)N(C)c1nc2ccccc2n2c[nH+]cc12 ZINC001162032228 1048217086 /nfs/dbraw/zinc/21/70/86/1048217086.db2.gz KFZIFCFZSSNDIG-ZDUSSCGKSA-N 1 2 320.371 4.219 20 0 DIADLO Cc1cc2sc(NCc3ccn4cc[nH+]c4c3)nc2c(C)c1 ZINC001185755366 1048221553 /nfs/dbraw/zinc/22/15/53/1048221553.db2.gz DIBQCTUAJRCJDC-UHFFFAOYSA-N 1 2 308.410 4.173 20 0 DIADLO CC(C)c1ccc(Nc2ccc(N)[nH+]c2)c(Br)c1 ZINC001201283661 1048225891 /nfs/dbraw/zinc/22/58/91/1048225891.db2.gz BWNCADNKABEFKV-UHFFFAOYSA-N 1 2 306.207 4.293 20 0 DIADLO CCc1cc(Br)cc(CC)c1Nc1ccc(N)[nH+]c1 ZINC001201286978 1048227523 /nfs/dbraw/zinc/22/75/23/1048227523.db2.gz LOOYEZAHORVZPT-UHFFFAOYSA-N 1 2 320.234 4.295 20 0 DIADLO CCOc1ccc(F)c(F)c1Nc1cccc2[nH+]c(C)cn21 ZINC001175279638 1048227560 /nfs/dbraw/zinc/22/75/60/1048227560.db2.gz BUTNWONZMIYVFE-UHFFFAOYSA-N 1 2 303.312 4.063 20 0 DIADLO COCc1cc[nH+]c(NCC(C)(C)Cc2ccccc2F)c1 ZINC001162132733 1048228771 /nfs/dbraw/zinc/22/87/71/1048228771.db2.gz DEBKSLFEISEORA-UHFFFAOYSA-N 1 2 302.393 4.048 20 0 DIADLO CCOc1ccc(F)c(F)c1Nc1cccn2cc(C)[nH+]c12 ZINC001175281968 1048229318 /nfs/dbraw/zinc/22/93/18/1048229318.db2.gz VKLOUDYVXNAUCB-UHFFFAOYSA-N 1 2 303.312 4.063 20 0 DIADLO Cc1c(F)cc(OCc2ccccc2)cc1Nc1ccc(N)[nH+]c1 ZINC001201291992 1048229468 /nfs/dbraw/zinc/22/94/68/1048229468.db2.gz SBQQGMRWJNOXGG-UHFFFAOYSA-N 1 2 323.371 4.434 20 0 DIADLO CC(C)(C)n1nc(-c2ccccc2)cc1Nc1ccc(N)[nH+]c1 ZINC001201279224 1048230178 /nfs/dbraw/zinc/23/01/78/1048230178.db2.gz MHNQZDHONQPGSX-UHFFFAOYSA-N 1 2 307.401 4.026 20 0 DIADLO CCc1coc(CNc2ccc3c(c2)[nH+]cn3-c2ccccc2)n1 ZINC001162137665 1048230659 /nfs/dbraw/zinc/23/06/59/1048230659.db2.gz HJAFIJZFVOVTDV-UHFFFAOYSA-N 1 2 318.380 4.188 20 0 DIADLO Nc1ccc(Nc2cc(Br)c3ccccc3c2)c[nH+]1 ZINC001201294752 1048232036 /nfs/dbraw/zinc/23/20/36/1048232036.db2.gz HLBMLEZNJBHJJN-UHFFFAOYSA-N 1 2 314.186 4.323 20 0 DIADLO CC(C)c1cc(Br)ccc1Nc1ccc(N)[nH+]c1 ZINC001201295932 1048232164 /nfs/dbraw/zinc/23/21/64/1048232164.db2.gz YHLHUCACJXAHNJ-UHFFFAOYSA-N 1 2 306.207 4.293 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(NC(=O)c2ccccc2)cc1 ZINC001201306956 1048233811 /nfs/dbraw/zinc/23/38/11/1048233811.db2.gz CMWNYXHHOGDWPV-UHFFFAOYSA-N 1 2 319.364 4.086 20 0 DIADLO Cc1ncc(CNc2ccc(C3(C(F)(F)F)CC3)c[nH+]2)s1 ZINC001162159616 1048234208 /nfs/dbraw/zinc/23/42/08/1048234208.db2.gz HLDPMDVDOMUWBA-UHFFFAOYSA-N 1 2 313.348 4.053 20 0 DIADLO Cc1ccc(C(=O)CC[N@H+]2C[C@H](c3ccccc3)OC[C@H]2C)cc1 ZINC000480773491 1048242548 /nfs/dbraw/zinc/24/25/48/1048242548.db2.gz XPZOJSMSEZBKNC-DYESRHJHSA-N 1 2 323.436 4.030 20 0 DIADLO Cc1ccc(C(=O)CC[N@@H+]2C[C@H](c3ccccc3)OC[C@H]2C)cc1 ZINC000480773491 1048242560 /nfs/dbraw/zinc/24/25/60/1048242560.db2.gz XPZOJSMSEZBKNC-DYESRHJHSA-N 1 2 323.436 4.030 20 0 DIADLO CCCCn1c(S[C@@H]2CC[C@@H](C)C2)nnc1[C@@H](CC)[NH+](C)C ZINC000554969174 1048242804 /nfs/dbraw/zinc/24/28/04/1048242804.db2.gz FVMSHFFUYWTUJX-RBSFLKMASA-N 1 2 324.538 4.372 20 0 DIADLO COc1cc(Nc2ccc(N(C)C)[nH+]c2)c(Cl)cc1Cl ZINC001175342451 1048250900 /nfs/dbraw/zinc/25/09/00/1048250900.db2.gz PYOOSOOMXMXHIP-UHFFFAOYSA-N 1 2 312.200 4.207 20 0 DIADLO CN(C)c1ccc(Nc2c(F)cccc2N2CCCCC2)c[nH+]1 ZINC001175345387 1048252828 /nfs/dbraw/zinc/25/28/28/1048252828.db2.gz AKFYKHAFFZXBFO-UHFFFAOYSA-N 1 2 314.408 4.021 20 0 DIADLO Cc1oncc1CNc1[nH+]ccc2cccc(C(F)(F)F)c21 ZINC001162269607 1048254114 /nfs/dbraw/zinc/25/41/14/1048254114.db2.gz QASZTFJMPFZDTD-UHFFFAOYSA-N 1 2 307.275 4.162 20 0 DIADLO Cc1ccc(C(=O)CC[N@@H+]2[C@H](C)COC[C@H]2c2ccccc2)cc1 ZINC000480842671 1048255798 /nfs/dbraw/zinc/25/57/98/1048255798.db2.gz KPHUGXOASHWWSJ-XLIONFOSSA-N 1 2 323.436 4.030 20 0 DIADLO Cc1ccc(C(=O)CC[N@H+]2[C@H](C)COC[C@H]2c2ccccc2)cc1 ZINC000480842671 1048255808 /nfs/dbraw/zinc/25/58/08/1048255808.db2.gz KPHUGXOASHWWSJ-XLIONFOSSA-N 1 2 323.436 4.030 20 0 DIADLO Cc1nc(N(C)Cc2cccc(C(F)(F)F)c2)c(C)c(C)[nH+]1 ZINC001162326943 1048262221 /nfs/dbraw/zinc/26/22/21/1048262221.db2.gz OSNWADFBBWSLMY-UHFFFAOYSA-N 1 2 309.335 4.057 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)cn1)c1nc2ccccc2s1 ZINC000776168239 1048266018 /nfs/dbraw/zinc/26/60/18/1048266018.db2.gz AKBYGJLEAUKIEF-SNVBAGLBSA-N 1 2 303.818 4.196 20 0 DIADLO CN(C)c1ccc(Nc2ncccc2Oc2ccccc2)c[nH+]1 ZINC001175339026 1048270363 /nfs/dbraw/zinc/27/03/63/1048270363.db2.gz UHQPWZIZDBITHN-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO Cc1ccc2c(Nc3ccc(N4CCCC4)nc3)cccc2[nH+]1 ZINC001175351414 1048270966 /nfs/dbraw/zinc/27/09/66/1048270966.db2.gz LECWIJATEOKJDV-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO c1cc(-c2ccc(Nc3ccc(N4CCCC4)[nH+]c3)cc2)ccn1 ZINC001175351679 1048271568 /nfs/dbraw/zinc/27/15/68/1048271568.db2.gz LCVYAPNGKJCFDS-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO O=C1CCCCc2cc(Nc3ccc(N4CCCC4)[nH+]c3)ccc21 ZINC001175350886 1048271590 /nfs/dbraw/zinc/27/15/90/1048271590.db2.gz IYCWDBTYDVOMBN-UHFFFAOYSA-N 1 2 321.424 4.335 20 0 DIADLO FC(F)Oc1cccc(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175350732 1048271655 /nfs/dbraw/zinc/27/16/55/1048271655.db2.gz BNNRVLMMWKALSF-UHFFFAOYSA-N 1 2 305.328 4.027 20 0 DIADLO Cc1nc2cc(Nc3ccc(N4CCCC4)[nH+]c3)ccc2s1 ZINC001175349780 1048271830 /nfs/dbraw/zinc/27/18/30/1048271830.db2.gz DNCCLTPAANINMK-UHFFFAOYSA-N 1 2 310.426 4.344 20 0 DIADLO COc1nc(C(C)C)ccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001201438359 1048273928 /nfs/dbraw/zinc/27/39/28/1048273928.db2.gz SRELKNQBLGUYSZ-UHFFFAOYSA-N 1 2 322.412 4.202 20 0 DIADLO c1ncc(-c2cccc(Nc3ccc(N4CCCC4)[nH+]c3)c2)o1 ZINC001175352892 1048273973 /nfs/dbraw/zinc/27/39/73/1048273973.db2.gz WHOAPZBMXKLOTH-UHFFFAOYSA-N 1 2 306.369 4.080 20 0 DIADLO Cc1ccc2cccnc2c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175352893 1048274486 /nfs/dbraw/zinc/27/44/86/1048274486.db2.gz WICUWUWWMWQJKH-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO Cc1nc(N[C@@H]2CCOc3c(F)cc(F)cc32)cc(C(C)C)[nH+]1 ZINC001162399596 1048274420 /nfs/dbraw/zinc/27/44/20/1048274420.db2.gz IZTBEVKJDMACTK-CQSZACIVSA-N 1 2 319.355 4.122 20 0 DIADLO CC(=O)c1cccc(Cl)c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175353237 1048274518 /nfs/dbraw/zinc/27/45/18/1048274518.db2.gz YCYOIXKQMYEACS-UHFFFAOYSA-N 1 2 315.804 4.281 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cnc3c(C(C)C)cnn3c2)cc1 ZINC001201490006 1048279800 /nfs/dbraw/zinc/27/98/00/1048279800.db2.gz ACMKZLVYYVLGQU-UHFFFAOYSA-N 1 2 309.417 4.417 20 0 DIADLO CCCCc1noc(C[N@H+](Cc2ccc(C)s2)C(C)C)n1 ZINC000065161841 1048279783 /nfs/dbraw/zinc/27/97/83/1048279783.db2.gz WYOIJSZDZPWUJX-UHFFFAOYSA-N 1 2 307.463 4.193 20 0 DIADLO CCCCc1noc(C[N@@H+](Cc2ccc(C)s2)C(C)C)n1 ZINC000065161841 1048279789 /nfs/dbraw/zinc/27/97/89/1048279789.db2.gz WYOIJSZDZPWUJX-UHFFFAOYSA-N 1 2 307.463 4.193 20 0 DIADLO COC(=O)CCCCCCNc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC001162427836 1048279903 /nfs/dbraw/zinc/27/99/03/1048279903.db2.gz OKXCAEYHNMQASA-UHFFFAOYSA-N 1 2 321.465 4.259 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2ccc(Br)[nH]c2=O)cc1 ZINC001201489152 1048280761 /nfs/dbraw/zinc/28/07/61/1048280761.db2.gz LSYQASRHYVGBHE-UHFFFAOYSA-N 1 2 322.206 4.114 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cnc3cc(C(C)C)nn3c2)cc1 ZINC001201490652 1048282513 /nfs/dbraw/zinc/28/25/13/1048282513.db2.gz IRZYSRXMOSNYHU-UHFFFAOYSA-N 1 2 309.417 4.417 20 0 DIADLO COC(=O)c1cc(Nc2ccc([NH2+]C(C)C)cc2)cnc1Cl ZINC001201491607 1048282816 /nfs/dbraw/zinc/28/28/16/1048282816.db2.gz QPOXLCVONPKKAQ-UHFFFAOYSA-N 1 2 319.792 4.086 20 0 DIADLO CC[C@@H](Nc1nc(C)[nH+]c2c1CCC2)c1ccc(F)c(F)c1 ZINC001162462571 1048284830 /nfs/dbraw/zinc/28/48/30/1048284830.db2.gz CCPOQVNWVXUQEO-OAHLLOKOSA-N 1 2 303.356 4.115 20 0 DIADLO CC[C@@H](Nc1cc(C)[nH+]c(SC)n1)c1ccc(F)c(F)c1 ZINC001162462967 1048284977 /nfs/dbraw/zinc/28/49/77/1048284977.db2.gz BHGZWQWVEFBLAR-CYBMUJFWSA-N 1 2 309.385 4.348 20 0 DIADLO COCCCN(c1ccc([NH2+]C(C)C)cc1)c1ccccc1N ZINC001201499835 1048288004 /nfs/dbraw/zinc/28/80/04/1048288004.db2.gz QEKBJSVVPGKSDE-UHFFFAOYSA-N 1 2 313.445 4.264 20 0 DIADLO CCCCOc1ccc(Nc2[nH+]cccc2CCO)cc1Cl ZINC001201479457 1048296300 /nfs/dbraw/zinc/29/63/00/1048296300.db2.gz BMZFOMGMIIFMGB-UHFFFAOYSA-N 1 2 320.820 4.192 20 0 DIADLO CC(C)c1cc(N2CCCCC[C@@H]2C[C@H](C)O)nc(C(C)C)[nH+]1 ZINC001186406847 1048297337 /nfs/dbraw/zinc/29/73/37/1048297337.db2.gz WLXRGUMZMKOFLA-JKSUJKDBSA-N 1 2 319.493 4.243 20 0 DIADLO CC[C@@H]1CCC[C@@H]1CNc1nc(C)[nH+]c(C)c1Br ZINC001186478809 1048307576 /nfs/dbraw/zinc/30/75/76/1048307576.db2.gz GIPIZCJZTXLLII-VXGBXAGGSA-N 1 2 312.255 4.094 20 0 DIADLO CC1CC[NH+](c2ccc(Nc3ncncc3Cl)cc2)CC1 ZINC001162584172 1048308034 /nfs/dbraw/zinc/30/80/34/1048308034.db2.gz DNYGYMZFVCFUDA-UHFFFAOYSA-N 1 2 302.809 4.110 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+]1CCOC2(C1)CCCCCC2 ZINC000481106111 1048311155 /nfs/dbraw/zinc/31/11/55/1048311155.db2.gz LLXAXNJMFHTJAW-HNNXBMFYSA-N 1 2 314.429 4.314 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+]1CCOC2(C1)CCCCCC2 ZINC000481106111 1048311170 /nfs/dbraw/zinc/31/11/70/1048311170.db2.gz LLXAXNJMFHTJAW-HNNXBMFYSA-N 1 2 314.429 4.314 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1ccc([S@@](C)=O)cc1 ZINC001175473970 1048316015 /nfs/dbraw/zinc/31/60/15/1048316015.db2.gz JMUXGNYYLCVZDD-OAQYLSRUSA-N 1 2 302.443 4.070 20 0 DIADLO Cc1nc(N[C@@H](C)c2ccccc2Cl)c2c([nH+]1)CCCC2 ZINC001186556630 1048316029 /nfs/dbraw/zinc/31/60/29/1048316029.db2.gz HNSGAINJUMFDGO-NSHDSACASA-N 1 2 301.821 4.490 20 0 DIADLO C[S@@](=O)c1ccc(Nc2cc[nH+]c3cc(Cl)ccc23)cc1 ZINC001175473896 1048316415 /nfs/dbraw/zinc/31/64/15/1048316415.db2.gz CLPOMXVABZTPCX-OAQYLSRUSA-N 1 2 316.813 4.369 20 0 DIADLO CCc1cc(N2[C@H](C)C[C@@H](c3ccccc3)[C@@H]2C)nc(CC)[nH+]1 ZINC001186572203 1048318534 /nfs/dbraw/zinc/31/85/34/1048318534.db2.gz SMQANSRSRBWTKF-RVKKMQEKSA-N 1 2 309.457 4.372 20 0 DIADLO Cc1cc(N[C@H]2CCCc3c(F)cc(F)cc32)nc(C2CC2)[nH+]1 ZINC001186577971 1048320502 /nfs/dbraw/zinc/32/05/02/1048320502.db2.gz HCCPGXWTYBFZGI-INIZCTEOSA-N 1 2 315.367 4.430 20 0 DIADLO Cc1cc(NCCc2ccc(Cl)c(C)c2)nc(C2CC2)[nH+]1 ZINC001186549674 1048321353 /nfs/dbraw/zinc/32/13/53/1048321353.db2.gz CSXZDMDKXRHILT-UHFFFAOYSA-N 1 2 301.821 4.279 20 0 DIADLO Cc1ccc(CC2CCN(c3nc(C)[nH+]c(C)c3C)CC2)cc1C ZINC001186633010 1048327271 /nfs/dbraw/zinc/32/72/71/1048327271.db2.gz LWQJSBLWDMSNGX-UHFFFAOYSA-N 1 2 323.484 4.478 20 0 DIADLO CCS(=O)(=O)c1cccc(Nc2c(C)cc[nH+]c2C(C)C)c1 ZINC001175449674 1048330283 /nfs/dbraw/zinc/33/02/83/1048330283.db2.gz CKFMHCUDZLCRAE-UHFFFAOYSA-N 1 2 318.442 4.051 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1nc(-c2cccnc2)nc2sccc21 ZINC001162662464 1048331275 /nfs/dbraw/zinc/33/12/75/1048331275.db2.gz VIVLQEYGYKBNAY-UHFFFAOYSA-N 1 2 311.414 4.189 20 0 DIADLO C[C@H](Cc1ccsc1)N(C)c1nc2ccccc2n2c[nH+]cc12 ZINC001162686115 1048334861 /nfs/dbraw/zinc/33/48/61/1048334861.db2.gz NSLHXMNOQYMYDF-CYBMUJFWSA-N 1 2 322.437 4.011 20 0 DIADLO CCc1ccc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)nc1 ZINC000555404272 1048336597 /nfs/dbraw/zinc/33/65/97/1048336597.db2.gz DJINUTGDHJWZSS-NRFANRHFSA-N 1 2 317.436 4.051 20 0 DIADLO CCc1ccc(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)nc1 ZINC000555404272 1048336611 /nfs/dbraw/zinc/33/66/11/1048336611.db2.gz DJINUTGDHJWZSS-NRFANRHFSA-N 1 2 317.436 4.051 20 0 DIADLO CCCCO[C@@H]1C[C@@H](N(C)c2cc(C)[nH+]c(C3CC3)n2)C1(C)C ZINC001162711274 1048340223 /nfs/dbraw/zinc/34/02/23/1048340223.db2.gz GKWIXWPQAGAFQP-HZPDHXFCSA-N 1 2 317.477 4.082 20 0 DIADLO Cc1cc(Cl)c(C)c(NC2(Cc3ccc(O)cc3)CC2)[nH+]1 ZINC001162734714 1048343740 /nfs/dbraw/zinc/34/37/40/1048343740.db2.gz HUOVZMSGYOERHO-UHFFFAOYSA-N 1 2 302.805 4.245 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2cccc(F)c2Cl)C2CC2)n1 ZINC000555422207 1048343823 /nfs/dbraw/zinc/34/38/23/1048343823.db2.gz NJEYKIGWGBDVMK-AWEZNQCLSA-N 1 2 310.825 4.485 20 0 DIADLO Cc1cc(N2CCC[C@H](Nc3ccccc3)C2)nc(C2CCC2)[nH+]1 ZINC001162732669 1048344440 /nfs/dbraw/zinc/34/44/40/1048344440.db2.gz SNHZNFKAUYHPIP-SFHVURJKSA-N 1 2 322.456 4.133 20 0 DIADLO FC(F)(F)c1cc(CNc2cc3ccccc3c[nH+]2)ccn1 ZINC001162735155 1048345171 /nfs/dbraw/zinc/34/51/71/1048345171.db2.gz KOSPANINVJBLQU-UHFFFAOYSA-N 1 2 303.287 4.261 20 0 DIADLO Cc1csc([C@@H]2COCC[N@H+]2C[C@@H](C)C2CCCCC2)n1 ZINC000555427948 1048345444 /nfs/dbraw/zinc/34/54/44/1048345444.db2.gz XGHKABMBXCZODS-CJNGLKHVSA-N 1 2 308.491 4.041 20 0 DIADLO Cc1csc([C@@H]2COCC[N@@H+]2C[C@@H](C)C2CCCCC2)n1 ZINC000555427948 1048345456 /nfs/dbraw/zinc/34/54/56/1048345456.db2.gz XGHKABMBXCZODS-CJNGLKHVSA-N 1 2 308.491 4.041 20 0 DIADLO C[C@@H](Nc1ccc(Cl)c(N)[nH+]1)c1cccc(F)c1Cl ZINC001162895303 1048378733 /nfs/dbraw/zinc/37/87/33/1048378733.db2.gz RLGVAIFRVMEDPR-SSDOTTSWSA-N 1 2 300.164 4.283 20 0 DIADLO Fc1ccc2c(c1)[nH]c1nc[nH+]c(N[C@H]3CCc4sccc43)c21 ZINC001162770194 1048355885 /nfs/dbraw/zinc/35/58/85/1048355885.db2.gz SJPGAKUZUZEAFT-LBPRGKRZSA-N 1 2 324.384 4.411 20 0 DIADLO Cc1c[nH+]c(CCNc2ncnc3ccc(C(C)C)cc32)c(C)c1 ZINC001186864331 1048355960 /nfs/dbraw/zinc/35/59/60/1048355960.db2.gz FZRLQYZQAYQYMQ-UHFFFAOYSA-N 1 2 320.440 4.420 20 0 DIADLO Cc1cc(N2CCc3ccccc3[C@H](C)C2)nc(C2CCC2)[nH+]1 ZINC001186923339 1048360491 /nfs/dbraw/zinc/36/04/91/1048360491.db2.gz UQDJIJDAZJYMLT-CQSZACIVSA-N 1 2 307.441 4.219 20 0 DIADLO Cc1ccn2c(CNc3cc4ccc(C)cc4c[nH+]3)cnc2c1 ZINC001162816506 1048363462 /nfs/dbraw/zinc/36/34/62/1048363462.db2.gz XPLXVMJPGYOHNW-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO Cc1cc(NCc2ccc(C(=O)OC(C)(C)C)cc2)c[nH+]c1C ZINC001162839308 1048371850 /nfs/dbraw/zinc/37/18/50/1048371850.db2.gz GVXWFJWTEVPPRM-UHFFFAOYSA-N 1 2 312.413 4.266 20 0 DIADLO CCc1cc(N(Cc2ccccc2F)CC2CC2)nc(CC)[nH+]1 ZINC001187082458 1048372188 /nfs/dbraw/zinc/37/21/88/1048372188.db2.gz ZMQJIOVFTYMQTM-UHFFFAOYSA-N 1 2 313.420 4.157 20 0 DIADLO Cc1cccc([C@H](C)Nc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001162900710 1048380627 /nfs/dbraw/zinc/38/06/27/1048380627.db2.gz WLYYPWIHSVRYJJ-AWEZNQCLSA-N 1 2 302.381 4.364 20 0 DIADLO Cc1cc(NCC2([C@H]3CCCCO3)CCC2)nc(C2CCC2)[nH+]1 ZINC001187183134 1048381298 /nfs/dbraw/zinc/38/12/98/1048381298.db2.gz WNTZTSJQKSQJNQ-MRXNPFEDSA-N 1 2 315.461 4.204 20 0 DIADLO CCc1nc(N2CCC[C@]2(C)Cc2cccc(C)c2)cc(C)[nH+]1 ZINC001187198609 1048381326 /nfs/dbraw/zinc/38/13/26/1048381326.db2.gz HCPBMAGFZLAQTH-HXUWFJFHSA-N 1 2 309.457 4.257 20 0 DIADLO CCNC(=O)c1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1 ZINC001175632690 1048383061 /nfs/dbraw/zinc/38/30/61/1048383061.db2.gz HQMDSYBISYEXBT-UHFFFAOYSA-N 1 2 323.440 4.170 20 0 DIADLO Cc1ccccc1[C@@H](C)N(C)c1nc2ccccc2n2c[nH+]cc12 ZINC001187199330 1048383587 /nfs/dbraw/zinc/38/35/87/1048383587.db2.gz RHYFOYCFRJXGOF-OAHLLOKOSA-N 1 2 316.408 4.388 20 0 DIADLO Cc1nc(N[C@H](C)c2nc3cc(Cl)c(Cl)cc3[nH]2)cc[nH+]1 ZINC001187281330 1048386283 /nfs/dbraw/zinc/38/62/83/1048386283.db2.gz PNMIXAAGSKOVHR-SSDOTTSWSA-N 1 2 322.199 4.141 20 0 DIADLO CC(=O)c1cc(Cl)nc(Cl)c1Nc1cc(C)c[nH+]c1C ZINC001203656049 1048387179 /nfs/dbraw/zinc/38/71/79/1048387179.db2.gz JAPHNQQBLYFMAS-UHFFFAOYSA-N 1 2 310.184 4.346 20 0 DIADLO Cc1cccc(C2=CCN(c3cc(C)[nH+]c(C4CC4)n3)CC2)c1 ZINC001162929386 1048390893 /nfs/dbraw/zinc/39/08/93/1048390893.db2.gz KJHYZFLYGJXGCZ-UHFFFAOYSA-N 1 2 305.425 4.265 20 0 DIADLO COc1ccc2[nH+]c(N[C@H](CO)c3ccc(C)cc3)cc(C)c2c1 ZINC001162947289 1048393171 /nfs/dbraw/zinc/39/31/71/1048393171.db2.gz ZPMNFDWTYZXJSW-LJQANCHMSA-N 1 2 322.408 4.006 20 0 DIADLO CCC(CC)[C@@H]1C[C@@H](Nc2nc(C)[nH+]c3c2CCCC3)CCO1 ZINC001162944024 1048393592 /nfs/dbraw/zinc/39/35/92/1048393592.db2.gz WOLIRRGMJXKDPS-YJBOKZPZSA-N 1 2 317.477 4.060 20 0 DIADLO Cc1nc(N2CCC[C@]2(C)Cc2ccccc2)c2c([nH+]1)CCCC2 ZINC001162994486 1048401645 /nfs/dbraw/zinc/40/16/45/1048401645.db2.gz HBYISGHTTPYJOT-OAQYLSRUSA-N 1 2 321.468 4.265 20 0 DIADLO CC(C)c1ccc(CN2CC[NH+]([C@H](C)c3ccccn3)CC2)cc1 ZINC000555605881 1048404997 /nfs/dbraw/zinc/40/49/97/1048404997.db2.gz SXWSKAIUNQILSR-GOSISDBHSA-N 1 2 323.484 4.084 20 0 DIADLO Cc1cc(N[C@H](CC(F)(F)F)C(C)C)nc(C2CCC2)[nH+]1 ZINC001163076444 1048413032 /nfs/dbraw/zinc/41/30/32/1048413032.db2.gz QIMDAHVUSHYFMC-GFCCVEGCSA-N 1 2 301.356 4.441 20 0 DIADLO CCSc1cc[nH+]c(NCCOc2cccc3ccoc32)c1 ZINC001163077861 1048413376 /nfs/dbraw/zinc/41/33/76/1048413376.db2.gz NGFAYFWQPPRMDX-UHFFFAOYSA-N 1 2 314.410 4.431 20 0 DIADLO Cc1nc2cc(Nc3c[nH+]c(N)cc3C(F)(F)F)ccc2s1 ZINC001175712851 1048419348 /nfs/dbraw/zinc/41/93/48/1048419348.db2.gz UYUCUHTYPINBEM-UHFFFAOYSA-N 1 2 324.331 4.344 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc(Cl)c2F)c[nH+]1 ZINC001175713075 1048419729 /nfs/dbraw/zinc/41/97/29/1048419729.db2.gz OZOBFONWGYJEIZ-UHFFFAOYSA-N 1 2 305.662 4.219 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc(-c3cnco3)c2)c[nH+]1 ZINC001175713149 1048419837 /nfs/dbraw/zinc/41/98/37/1048419837.db2.gz SCEMOHPFMLXCPP-UHFFFAOYSA-N 1 2 320.274 4.081 20 0 DIADLO CCC(=O)c1cccc(Nc2c[nH+]c(N)cc2C(F)(F)F)c1 ZINC001175714393 1048420672 /nfs/dbraw/zinc/42/06/72/1048420672.db2.gz UZYJEOWGJHNNKR-UHFFFAOYSA-N 1 2 309.291 4.019 20 0 DIADLO Clc1ccc2ccc(NCc3ccc4[nH+]ccn4c3)nc2c1 ZINC001163138873 1048420972 /nfs/dbraw/zinc/42/09/72/1048420972.db2.gz BVTMLQAVKATOFU-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO Cc1ccc(F)c2cc(C)c(NCc3ccc4[nH+]ccn4c3)nc12 ZINC001163139544 1048421123 /nfs/dbraw/zinc/42/11/23/1048421123.db2.gz PYVBEBMMGJNAFU-UHFFFAOYSA-N 1 2 320.371 4.251 20 0 DIADLO CC(C)Oc1cccc(Nc2c[nH+]c(N)cc2C(F)(F)F)c1 ZINC001175713266 1048421298 /nfs/dbraw/zinc/42/12/98/1048421298.db2.gz ZJGSYWANIRYBAD-UHFFFAOYSA-N 1 2 311.307 4.213 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2c(F)ccc(Cl)c2F)c[nH+]1 ZINC001175713530 1048421360 /nfs/dbraw/zinc/42/13/60/1048421360.db2.gz CLTNDVANDWCWMI-UHFFFAOYSA-N 1 2 323.652 4.358 20 0 DIADLO Cc1c(F)cc(Nc2c[nH+]c(N)cc2C(F)(F)F)cc1F ZINC001175714249 1048421400 /nfs/dbraw/zinc/42/14/00/1048421400.db2.gz KVVZHKSNSTZVDL-UHFFFAOYSA-N 1 2 303.234 4.013 20 0 DIADLO Cc1cc(NCc2ccc3[nH+]ccn3c2)nc2cc(Cl)ccc12 ZINC001163139661 1048421417 /nfs/dbraw/zinc/42/14/17/1048421417.db2.gz UQVNSIWXCNFIBW-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO C[C@@H](Nc1nc2ccccc2n2c[nH+]cc12)c1c(F)cccc1F ZINC001187670000 1048422461 /nfs/dbraw/zinc/42/24/61/1048422461.db2.gz XFOFDKYOCXMFBL-LLVKDONJSA-N 1 2 324.334 4.334 20 0 DIADLO Cc1cc(Cl)c(C)c(NCc2cccc(C(F)(F)F)n2)[nH+]1 ZINC001163183956 1048429456 /nfs/dbraw/zinc/42/94/56/1048429456.db2.gz WGVUSVJYZVEKFE-UHFFFAOYSA-N 1 2 315.726 4.378 20 0 DIADLO COc1ccc2[nH+]c(NC3(c4ccc(N)cc4)CC3)c(C)cc2c1 ZINC001163198217 1048434235 /nfs/dbraw/zinc/43/42/35/1048434235.db2.gz ISGCJDPCZNXDPG-UHFFFAOYSA-N 1 2 319.408 4.235 20 0 DIADLO c1cn(Cc2cccc(Nc3ccc4ccncc4c3)c2)c[nH+]1 ZINC001175705861 1048436485 /nfs/dbraw/zinc/43/64/85/1048436485.db2.gz UREDBEOBXZDANZ-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO Cc1ccc2sc(Nc3c[nH+]c(N)cc3C(F)(F)F)nc2c1 ZINC001175709430 1048437526 /nfs/dbraw/zinc/43/75/26/1048437526.db2.gz BFXDYKWAHOOTEI-UHFFFAOYSA-N 1 2 324.331 4.344 20 0 DIADLO COc1cc(Nc2ccc[nH+]c2N2CCCCC2)ccc1Cl ZINC001175773744 1048448484 /nfs/dbraw/zinc/44/84/84/1048448484.db2.gz JAHMSCIZVWWYMD-UHFFFAOYSA-N 1 2 317.820 4.478 20 0 DIADLO Cc1ccc(NC(=O)Nc2cccc(Cn3cc[nH+]c3)c2)cc1F ZINC001187985303 1048457680 /nfs/dbraw/zinc/45/76/80/1048457680.db2.gz BEYOZTSZQYWIHK-UHFFFAOYSA-N 1 2 324.359 4.023 20 0 DIADLO C[C@@H]1c2sccc2CC[N@H+]1Cc1nccn1Cc1ccccc1 ZINC001175832364 1048458089 /nfs/dbraw/zinc/45/80/89/1048458089.db2.gz YSMVMGOKUYRZAU-OAHLLOKOSA-N 1 2 323.465 4.112 20 0 DIADLO C[C@@H]1c2sccc2CC[N@@H+]1Cc1nccn1Cc1ccccc1 ZINC001175832364 1048458095 /nfs/dbraw/zinc/45/80/95/1048458095.db2.gz YSMVMGOKUYRZAU-OAHLLOKOSA-N 1 2 323.465 4.112 20 0 DIADLO COc1cnccc1[C@H](Nc1[nH+]c(C)cc(Cl)c1C)C1CC1 ZINC001163397513 1048466136 /nfs/dbraw/zinc/46/61/36/1048466136.db2.gz GKHYLIWZEAZTSW-MRXNPFEDSA-N 1 2 317.820 4.319 20 0 DIADLO COc1cnccc1[C@H](Nc1ccc(C(C)(C)C)c[nH+]1)C1CC1 ZINC001163401837 1048467720 /nfs/dbraw/zinc/46/77/20/1048467720.db2.gz YVCRANJGIDTBLY-GOSISDBHSA-N 1 2 311.429 4.346 20 0 DIADLO Clc1ccc2nc(C[N@@H+]3Cc4ccccc4C4(CC4)C3)cn2c1 ZINC000481762872 1048483072 /nfs/dbraw/zinc/48/30/72/1048483072.db2.gz UJDDURPPVPRIDE-UHFFFAOYSA-N 1 2 323.827 4.035 20 0 DIADLO Clc1ccc2nc(C[N@H+]3Cc4ccccc4C4(CC4)C3)cn2c1 ZINC000481762872 1048483076 /nfs/dbraw/zinc/48/30/76/1048483076.db2.gz UJDDURPPVPRIDE-UHFFFAOYSA-N 1 2 323.827 4.035 20 0 DIADLO COc1cc2ccc(N3[C@H](C)CCC[C@@H]3C)[nH+]c2cc1OC ZINC001163544183 1048486148 /nfs/dbraw/zinc/48/61/48/1048486148.db2.gz DCTDLQAOPHOROK-BETUJISGSA-N 1 2 300.402 4.019 20 0 DIADLO Cc1cc(C)c(Nc2cccnc2OCc2ccccc2)c[nH+]1 ZINC001175872179 1048487559 /nfs/dbraw/zinc/48/75/59/1048487559.db2.gz NBIXWOFVNWZJER-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO COc1ccc(Nc2cccc3[nH+]c(C)cn32)c(C(F)(F)F)c1 ZINC001213046664 1048495946 /nfs/dbraw/zinc/49/59/46/1048495946.db2.gz TXWFXHAZUHOXCR-UHFFFAOYSA-N 1 2 321.302 4.414 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cccc(-c3nnc(C)o3)c2)cc1 ZINC001175995377 1048523060 /nfs/dbraw/zinc/52/30/60/1048523060.db2.gz BWPQAQPHVVODDC-UHFFFAOYSA-N 1 2 308.385 4.245 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cccc(-c3nnc(C)o3)c2)cc1 ZINC001175995377 1048523069 /nfs/dbraw/zinc/52/30/69/1048523069.db2.gz BWPQAQPHVVODDC-UHFFFAOYSA-N 1 2 308.385 4.245 20 0 DIADLO Cc1cc2[nH]c(C[N@@H+]3CCO[C@H](c4ccccc4)C3)cc2c(C)c1 ZINC000481923147 1048525945 /nfs/dbraw/zinc/52/59/45/1048525945.db2.gz NJKAJTLLIGDPRB-NRFANRHFSA-N 1 2 320.436 4.358 20 0 DIADLO Cc1cc2[nH]c(C[N@H+]3CCO[C@H](c4ccccc4)C3)cc2c(C)c1 ZINC000481923147 1048525957 /nfs/dbraw/zinc/52/59/57/1048525957.db2.gz NJKAJTLLIGDPRB-NRFANRHFSA-N 1 2 320.436 4.358 20 0 DIADLO COc1ccc(Nc2cccn3cc[nH+]c23)c(C(F)(F)F)c1 ZINC001213047617 1048527958 /nfs/dbraw/zinc/52/79/58/1048527958.db2.gz SVKXKSSEIJERFL-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO FC(F)C1CC(Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)C1 ZINC000775182316 1048528467 /nfs/dbraw/zinc/52/84/67/1048528467.db2.gz SSJPJRWUJJBYTF-UHFFFAOYSA-N 1 2 317.383 4.342 20 0 DIADLO CCc1nc(Cl)cc(NC(=[NH2+])C23CC4CC(CC(C4)C2)C3)n1 ZINC001163841287 1048533292 /nfs/dbraw/zinc/53/32/92/1048533292.db2.gz MTEHNUZOOAKPOP-UHFFFAOYSA-N 1 2 318.852 4.298 20 0 DIADLO FC(F)Oc1ccccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001176012976 1048534142 /nfs/dbraw/zinc/53/41/42/1048534142.db2.gz TWOROBHDEGROPG-UHFFFAOYSA-N 1 2 315.323 4.276 20 0 DIADLO CC(C)Oc1cccnc1NC(=[NH2+])C12CC3CC(CC(C3)C1)C2 ZINC001163848533 1048537818 /nfs/dbraw/zinc/53/78/18/1048537818.db2.gz QBDNUWGWAZEWMS-UHFFFAOYSA-N 1 2 313.445 4.474 20 0 DIADLO Cc1nc(NCCc2ccccc2OCc2ccccc2)cc[nH+]1 ZINC001163868168 1048541663 /nfs/dbraw/zinc/54/16/63/1048541663.db2.gz QASXRRCUFAKJTM-UHFFFAOYSA-N 1 2 319.408 4.019 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(-c3ccccn3)cc2)c[nH+]1 ZINC001176038272 1048541932 /nfs/dbraw/zinc/54/19/32/1048541932.db2.gz JNMZHXLULFLGNE-UHFFFAOYSA-N 1 2 304.397 4.343 20 0 DIADLO CC(C)c1cc(NC[C@@H]2CCC23CCOCC3)nc(C(C)C)[nH+]1 ZINC001163942377 1048553409 /nfs/dbraw/zinc/55/34/09/1048553409.db2.gz VNWZTCZBSYWKAU-HNNXBMFYSA-N 1 2 317.477 4.342 20 0 DIADLO COc1cccc2[nH]c([N@H+]3c4ccc(N)cc4CC[C@@H]3C)cc21 ZINC001176064419 1048558712 /nfs/dbraw/zinc/55/87/12/1048558712.db2.gz RJTNNHJSVGNWNP-LBPRGKRZSA-N 1 2 307.397 4.232 20 0 DIADLO COc1cccc2[nH]c([N@@H+]3c4ccc(N)cc4CC[C@@H]3C)cc21 ZINC001176064419 1048558725 /nfs/dbraw/zinc/55/87/25/1048558725.db2.gz RJTNNHJSVGNWNP-LBPRGKRZSA-N 1 2 307.397 4.232 20 0 DIADLO CCN(CC)C(=O)c1ccc(F)c(Nc2c[nH+]c(C)cc2C)c1 ZINC001176067103 1048561747 /nfs/dbraw/zinc/56/17/47/1048561747.db2.gz LGHKGMDGHVIPDV-UHFFFAOYSA-N 1 2 315.392 4.063 20 0 DIADLO COc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)c(F)cc1F ZINC001176106849 1048566297 /nfs/dbraw/zinc/56/62/97/1048566297.db2.gz JXKXUAHTYWNMPE-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO F[C@@H]1CCCN(c2cc(-c3ccccc3)cc[nH+]2)CC1(F)F ZINC001164059588 1048573268 /nfs/dbraw/zinc/57/32/68/1048573268.db2.gz JPPFDXSCPUYGHT-OAHLLOKOSA-N 1 2 306.331 4.322 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(-c2ccc(Cl)cc2)no1 ZINC001176117286 1048573427 /nfs/dbraw/zinc/57/34/27/1048573427.db2.gz ZMNNLJIUYMVRBP-UHFFFAOYSA-N 1 2 301.733 4.142 20 0 DIADLO Cn1c[nH+]c2ccc(N[C@H](c3ccccc3)c3ccncc3)cc21 ZINC001164074754 1048577375 /nfs/dbraw/zinc/57/73/75/1048577375.db2.gz NGNOLRIXXWYKGG-HXUWFJFHSA-N 1 2 314.392 4.170 20 0 DIADLO CC(C)=CCC[C@@H](C)CC[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000482254901 1048579568 /nfs/dbraw/zinc/57/95/68/1048579568.db2.gz VCVWERJOIBTLRA-SJLPKXTDSA-N 1 2 312.461 4.256 20 0 DIADLO C[C@@H](Nc1ccn2cc[nH+]c2c1)c1ccc(Br)s1 ZINC001164088617 1048580374 /nfs/dbraw/zinc/58/03/74/1048580374.db2.gz IICXBBWFGGTTHF-SECBINFHSA-N 1 2 322.231 4.331 20 0 DIADLO Cc1noc(C)c1Nc1cc[nH+]c2cc(Br)ccc12 ZINC001176176395 1048580781 /nfs/dbraw/zinc/58/07/81/1048580781.db2.gz JFVPRUSLNJLLIN-UHFFFAOYSA-N 1 2 318.174 4.346 20 0 DIADLO FC[C@H]1CCN(c2[nH+]ccc3cc(Cl)ccc32)CC1(F)F ZINC001164093315 1048581456 /nfs/dbraw/zinc/58/14/56/1048581456.db2.gz BROVHRQQQMQMJA-LLVKDONJSA-N 1 2 314.738 4.319 20 0 DIADLO FC[C@@H]1CCN(c2[nH+]ccc3cc(Cl)ccc32)CC1(F)F ZINC001164093318 1048581569 /nfs/dbraw/zinc/58/15/69/1048581569.db2.gz BROVHRQQQMQMJA-NSHDSACASA-N 1 2 314.738 4.319 20 0 DIADLO C[C@H](Nc1ccc2c([nH+]1)CCOC2)c1ccc2ccccc2c1 ZINC001164145776 1048592076 /nfs/dbraw/zinc/59/20/76/1048592076.db2.gz QMKXFPGZTDJVKR-AWEZNQCLSA-N 1 2 304.393 4.481 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1ccc(C(=O)N(C)C)cc1F ZINC001176203005 1048603018 /nfs/dbraw/zinc/60/30/18/1048603018.db2.gz ZWEUPSFXWJGONH-UHFFFAOYSA-N 1 2 315.392 4.098 20 0 DIADLO Cc1[nH]c(C2CCN(Cc3ccc(Cl)cc3F)CC2)[nH+]c1C ZINC001176203047 1048603145 /nfs/dbraw/zinc/60/31/45/1048603145.db2.gz TYZBHORMDIAQTP-UHFFFAOYSA-N 1 2 321.827 4.199 20 0 DIADLO Cc1cc(-c2nnc(C[N@@H+](C)[C@@H](C)c3cccs3)o2)c(C)o1 ZINC000158655722 1048603647 /nfs/dbraw/zinc/60/36/47/1048603647.db2.gz GPKKYKFRBOASBI-NSHDSACASA-N 1 2 317.414 4.201 20 0 DIADLO Cc1cc(-c2nnc(C[N@H+](C)[C@@H](C)c3cccs3)o2)c(C)o1 ZINC000158655722 1048603653 /nfs/dbraw/zinc/60/36/53/1048603653.db2.gz GPKKYKFRBOASBI-NSHDSACASA-N 1 2 317.414 4.201 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(-c2ccccc2)c[nH]1)c1nc(C)cs1 ZINC000194297368 1048605960 /nfs/dbraw/zinc/60/59/60/1048605960.db2.gz KVIRUFCLHZENIC-AWEZNQCLSA-N 1 2 312.442 4.083 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(NCc2cnc3ccccc3c2)c1 ZINC001164204336 1048606743 /nfs/dbraw/zinc/60/67/43/1048606743.db2.gz UEEAIPKZTFGANJ-UHFFFAOYSA-N 1 2 314.392 4.247 20 0 DIADLO Clc1ccc(-c2cccc(C[NH2+]Cc3csnn3)c2)cc1 ZINC001203283296 1048607855 /nfs/dbraw/zinc/60/78/55/1048607855.db2.gz QCJCLMYHERTTAF-UHFFFAOYSA-N 1 2 315.829 4.148 20 0 DIADLO Cc1cc(N2CCC[C@@H]2/C=C/c2ccccc2)nc(C2CC2)[nH+]1 ZINC001164260967 1048614636 /nfs/dbraw/zinc/61/46/36/1048614636.db2.gz JYTYHZHXYCSFDA-ZPHJMFTNSA-N 1 2 305.425 4.345 20 0 DIADLO Cc1cc(Cl)c(C)c(N2CC[C@](CF)(C(F)(F)F)C2)[nH+]1 ZINC001164265931 1048616103 /nfs/dbraw/zinc/61/61/03/1048616103.db2.gz DOXKHRHAGILWDZ-GFCCVEGCSA-N 1 2 310.722 4.080 20 0 DIADLO Cc1cc(N2CCC[C@]2(C)Cc2cccs2)nc(C2CC2)[nH+]1 ZINC001164265047 1048616153 /nfs/dbraw/zinc/61/61/53/1048616153.db2.gz MVUULLSANVHTJN-GOSISDBHSA-N 1 2 313.470 4.326 20 0 DIADLO C[C@@H](CCC1CCCCC1)[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000482500554 1048617548 /nfs/dbraw/zinc/61/75/48/1048617548.db2.gz ILJJRXSYQMGVOU-YJBOKZPZSA-N 1 2 312.461 4.233 20 0 DIADLO C[C@H](CCC1CCCCC1)[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000482500546 1048617816 /nfs/dbraw/zinc/61/78/16/1048617816.db2.gz ILJJRXSYQMGVOU-QAPCUYQASA-N 1 2 312.461 4.233 20 0 DIADLO COc1ccc(Nc2cc[nH+]c3cc(Cl)ccc23)cc1O ZINC001176252987 1048624049 /nfs/dbraw/zinc/62/40/49/1048624049.db2.gz OMOVBLGJHVUVAP-UHFFFAOYSA-N 1 2 300.745 4.346 20 0 DIADLO CSc1cc(Nc2ccc(O)cc2C(F)(F)F)cc[nH+]1 ZINC001176338806 1048631211 /nfs/dbraw/zinc/63/12/11/1048631211.db2.gz LSUKVOHFEBUELZ-UHFFFAOYSA-N 1 2 300.305 4.272 20 0 DIADLO Cc1[nH]c(CNc2ccc(OC(F)(F)F)c(Cl)c2)[nH+]c1C ZINC000850337755 1048634611 /nfs/dbraw/zinc/63/46/11/1048634611.db2.gz XCGAVSSGGXBIKQ-UHFFFAOYSA-N 1 2 319.714 4.191 20 0 DIADLO CC(C)(C)c1ccccc1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001189565234 1048640314 /nfs/dbraw/zinc/64/03/14/1048640314.db2.gz PROZEURVWLHPMO-UHFFFAOYSA-N 1 2 308.385 4.276 20 0 DIADLO c1cn2ccc(Nc3ccc(OCc4ccccc4)nc3)cc2[nH+]1 ZINC001176305395 1048640832 /nfs/dbraw/zinc/64/08/32/1048640832.db2.gz CFOCPSCBRQEWHO-UHFFFAOYSA-N 1 2 316.364 4.052 20 0 DIADLO CCCOc1ccc(-n2c(C)[nH+]c3ccc(N)cc32)cc1Cl ZINC001176306628 1048643343 /nfs/dbraw/zinc/64/33/43/1048643343.db2.gz AJKCFAZMVDYZRD-UHFFFAOYSA-N 1 2 315.804 4.358 20 0 DIADLO COc1c(Cl)cc(Nc2cccn3cc[nH+]c23)cc1Cl ZINC001176307791 1048644353 /nfs/dbraw/zinc/64/43/53/1048644353.db2.gz OYEWKLXJYFGYJC-UHFFFAOYSA-N 1 2 308.168 4.393 20 0 DIADLO O=C(c1cccc(C2CCCC2)c1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000668089623 1048645604 /nfs/dbraw/zinc/64/56/04/1048645604.db2.gz YHZPUVVVWUBEFO-GOSISDBHSA-N 1 2 323.440 4.087 20 0 DIADLO Cc1cc(C)c(Nc2cccc3c2cnn3[C@@H]2CCCCO2)c[nH+]1 ZINC001176319866 1048649917 /nfs/dbraw/zinc/64/99/17/1048649917.db2.gz UDXFVKTYGXXMSG-IBGZPJMESA-N 1 2 322.412 4.491 20 0 DIADLO Oc1ccc2cc(Nc3ccc(N4CCCC4)[nH+]c3)ccc2c1 ZINC001176386671 1048651821 /nfs/dbraw/zinc/65/18/21/1048651821.db2.gz DPHKMOSOPPNJFA-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO Oc1ccc2cc(Nc3ccccc3-n3cc[nH+]c3)ccc2c1 ZINC001176387499 1048653494 /nfs/dbraw/zinc/65/34/94/1048653494.db2.gz RUWSMNREFDUFSG-UHFFFAOYSA-N 1 2 301.349 4.475 20 0 DIADLO C[C@H]([NH2+]Cc1csc(C(C)(C)C)n1)c1cc2cnccc2o1 ZINC000850430419 1048654529 /nfs/dbraw/zinc/65/45/29/1048654529.db2.gz PWWGTYSILITKQG-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO CCc1cccc(CC)c1NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001189745794 1048656810 /nfs/dbraw/zinc/65/68/10/1048656810.db2.gz WGRODGVXYLSSFJ-UHFFFAOYSA-N 1 2 308.385 4.103 20 0 DIADLO COC(=O)CC(C)(C)C[C@H](C)Nc1ccc([NH+]2CCCC2)cc1 ZINC000850450649 1048661480 /nfs/dbraw/zinc/66/14/80/1048661480.db2.gz RTAOAZLBPDCOTA-HNNXBMFYSA-N 1 2 318.461 4.067 20 0 DIADLO COC(=O)CC(C)(C)C[C@H](C)[NH2+]c1ccc(N2CCCC2)cc1 ZINC000850450649 1048661486 /nfs/dbraw/zinc/66/14/86/1048661486.db2.gz RTAOAZLBPDCOTA-HNNXBMFYSA-N 1 2 318.461 4.067 20 0 DIADLO CCCCC[C@@H]([NH2+]Cc1nnc(OCC)s1)c1ccccc1 ZINC000775318993 1048662755 /nfs/dbraw/zinc/66/27/55/1048662755.db2.gz AVCNBCUOOMVQRN-OAHLLOKOSA-N 1 2 319.474 4.348 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1cc2cnccc2o1 ZINC000850459155 1048665971 /nfs/dbraw/zinc/66/59/71/1048665971.db2.gz RTCIIEOXXHJZHY-ZDUSSCGKSA-N 1 2 307.397 4.383 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1cc2cnccc2o1 ZINC000850459155 1048665981 /nfs/dbraw/zinc/66/59/81/1048665981.db2.gz RTCIIEOXXHJZHY-ZDUSSCGKSA-N 1 2 307.397 4.383 20 0 DIADLO COc1ccc2cc[nH+]c(N3Cc4ccccc4[C@@H](C)C3)c2c1 ZINC001165216801 1048666895 /nfs/dbraw/zinc/66/68/95/1048666895.db2.gz FCMTZZVVQBAQHR-AWEZNQCLSA-N 1 2 304.393 4.367 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)N1CCc2c([nH+]cn2CC)C1 ZINC001176431641 1048670150 /nfs/dbraw/zinc/67/01/50/1048670150.db2.gz HTHYJCSAUWHCRS-MRXNPFEDSA-N 1 2 303.837 4.066 20 0 DIADLO C[C@H]([NH2+]Cc1ncccn1)c1ccccc1SC(C)(C)C ZINC000850553429 1048689698 /nfs/dbraw/zinc/68/96/98/1048689698.db2.gz YRQBDFXCOBKWOF-ZDUSSCGKSA-N 1 2 301.459 4.218 20 0 DIADLO CC(C)Oc1cc(Nc2cc(Cl)c3[nH+]ccn3c2)c(F)cn1 ZINC001176481081 1048692584 /nfs/dbraw/zinc/69/25/84/1048692584.db2.gz BYGNCRMTNCAGTC-UHFFFAOYSA-N 1 2 320.755 4.053 20 0 DIADLO CC(C)(C)Oc1cccc(C[N@H+](Cc2ccoc2)C2CC2)n1 ZINC001176494667 1048698718 /nfs/dbraw/zinc/69/87/18/1048698718.db2.gz CBRRCKSZOMRTCR-UHFFFAOYSA-N 1 2 300.402 4.017 20 0 DIADLO CC(C)(C)Oc1cccc(C[N@@H+](Cc2ccoc2)C2CC2)n1 ZINC001176494667 1048698730 /nfs/dbraw/zinc/69/87/30/1048698730.db2.gz CBRRCKSZOMRTCR-UHFFFAOYSA-N 1 2 300.402 4.017 20 0 DIADLO Fc1ccc([C@H]2CCCC[N@@H+]2Cc2cn3ccsc3n2)cc1 ZINC000482926253 1048704050 /nfs/dbraw/zinc/70/40/50/1048704050.db2.gz IXGITWCOUOMTAK-MRXNPFEDSA-N 1 2 315.417 4.262 20 0 DIADLO Fc1ccc([C@H]2CCCC[N@H+]2Cc2cn3ccsc3n2)cc1 ZINC000482926253 1048704062 /nfs/dbraw/zinc/70/40/62/1048704062.db2.gz IXGITWCOUOMTAK-MRXNPFEDSA-N 1 2 315.417 4.262 20 0 DIADLO CCc1ccc[nH+]c1Nc1ccc(F)c(C(=O)N(CC)CC)c1 ZINC001176513965 1048704557 /nfs/dbraw/zinc/70/45/57/1048704557.db2.gz GZHBDVRYRZCCFT-UHFFFAOYSA-N 1 2 315.392 4.009 20 0 DIADLO Cc1sc(NC(=O)C[N@@H+]2CC[C@@H]2c2ccccc2)c(C)c1C ZINC000482950348 1048707255 /nfs/dbraw/zinc/70/72/55/1048707255.db2.gz SIAAZTCOSVYMKW-MRXNPFEDSA-N 1 2 314.454 4.059 20 0 DIADLO Cc1sc(NC(=O)C[N@H+]2CC[C@@H]2c2ccccc2)c(C)c1C ZINC000482950348 1048707267 /nfs/dbraw/zinc/70/72/67/1048707267.db2.gz SIAAZTCOSVYMKW-MRXNPFEDSA-N 1 2 314.454 4.059 20 0 DIADLO COC[C@@]12CCC[C@@H]1CN(c1cc(C)c3cccc(C)c3[nH+]1)C2 ZINC001165926571 1048724439 /nfs/dbraw/zinc/72/44/39/1048724439.db2.gz WJMYRQIMMNXKDS-UZLBHIALSA-N 1 2 310.441 4.105 20 0 DIADLO Cc1[nH+]cc(NC(=O)Nc2ccc(Oc3ccccc3)cc2)n1C ZINC001190399935 1048729551 /nfs/dbraw/zinc/72/95/51/1048729551.db2.gz NPWODJXQGHHSTN-UHFFFAOYSA-N 1 2 322.368 4.165 20 0 DIADLO c1ccc2cc(N3C[C@H]4[C@@H](C3)CCC[C@@H]4OCC3CC3)[nH+]cc2c1 ZINC001166114581 1048735710 /nfs/dbraw/zinc/73/57/10/1048735710.db2.gz RJKQQNNLNUFHCS-AABGKKOBSA-N 1 2 322.452 4.266 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@@](C)(CC)c2ccccc2)n1 ZINC000775386364 1048736170 /nfs/dbraw/zinc/73/61/70/1048736170.db2.gz CWONEWHNICRNKI-GUYCJALGSA-N 1 2 319.474 4.299 20 0 DIADLO Cc1cn2cccc(Nc3ccc(OC(F)(F)F)cc3)c2[nH+]1 ZINC001176639715 1048742506 /nfs/dbraw/zinc/74/25/06/1048742506.db2.gz DTUNBTFOACSGQL-UHFFFAOYSA-N 1 2 307.275 4.285 20 0 DIADLO CC[C@@](C)([NH2+]Cc1noc(-c2ccccc2C)n1)c1ccccc1 ZINC000775392795 1048749889 /nfs/dbraw/zinc/74/98/89/1048749889.db2.gz CVPAAVGLSIHPIO-HXUWFJFHSA-N 1 2 321.424 4.460 20 0 DIADLO Cc1cc(N2CCCC[C@H]2c2cccnc2)nc(C(C)(C)C)[nH+]1 ZINC001166576946 1048765855 /nfs/dbraw/zinc/76/58/55/1048765855.db2.gz GSRJIOCLCNCVRC-INIZCTEOSA-N 1 2 310.445 4.209 20 0 DIADLO C[N@@H+](Cc1ccoc1)Cc1cc(Br)c(Cl)s1 ZINC000483260987 1048766377 /nfs/dbraw/zinc/76/63/77/1048766377.db2.gz RCRDHOJIENCKOK-UHFFFAOYSA-N 1 2 320.639 4.389 20 0 DIADLO C[N@H+](Cc1ccoc1)Cc1cc(Br)c(Cl)s1 ZINC000483260987 1048766391 /nfs/dbraw/zinc/76/63/91/1048766391.db2.gz RCRDHOJIENCKOK-UHFFFAOYSA-N 1 2 320.639 4.389 20 0 DIADLO c1ccc(Nc2cccc(C3CC3)c2)c(C[NH+]2CCOCC2)c1 ZINC001176723611 1048771013 /nfs/dbraw/zinc/77/10/13/1048771013.db2.gz AHVOOEZHSNKARI-UHFFFAOYSA-N 1 2 308.425 4.140 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2ccc(OCC3CC3)cc2)s1 ZINC000483290034 1048772972 /nfs/dbraw/zinc/77/29/72/1048772972.db2.gz FYJZUUIOIYULCY-UHFFFAOYSA-N 1 2 316.470 4.126 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2ccc(OCC3CC3)cc2)s1 ZINC000483290034 1048772985 /nfs/dbraw/zinc/77/29/85/1048772985.db2.gz FYJZUUIOIYULCY-UHFFFAOYSA-N 1 2 316.470 4.126 20 0 DIADLO COc1cc(C[N@@H+]2CCc3cc(C(C)(C)C)ccc3C2)sn1 ZINC001190698845 1048773370 /nfs/dbraw/zinc/77/33/70/1048773370.db2.gz BIHSCUIFWYNXJB-UHFFFAOYSA-N 1 2 316.470 4.008 20 0 DIADLO COc1cc(C[N@H+]2CCc3cc(C(C)(C)C)ccc3C2)sn1 ZINC001190698845 1048773380 /nfs/dbraw/zinc/77/33/80/1048773380.db2.gz BIHSCUIFWYNXJB-UHFFFAOYSA-N 1 2 316.470 4.008 20 0 DIADLO Cc1ccc2sc(Nc3ccc[nH+]c3N3CCCC3)nc2c1 ZINC001176742873 1048775255 /nfs/dbraw/zinc/77/52/55/1048775255.db2.gz ABEPTFSQCCVOIQ-UHFFFAOYSA-N 1 2 310.426 4.344 20 0 DIADLO CC(C)(C)c1cc2n(n1)CC[N@H+](Cc1ccccc1C1CC1)C2 ZINC001176735447 1048776136 /nfs/dbraw/zinc/77/61/36/1048776136.db2.gz XBBXQCTYCWNLOA-UHFFFAOYSA-N 1 2 309.457 4.074 20 0 DIADLO CC(C)(C)c1cc2n(n1)CC[N@@H+](Cc1ccccc1C1CC1)C2 ZINC001176735447 1048776145 /nfs/dbraw/zinc/77/61/45/1048776145.db2.gz XBBXQCTYCWNLOA-UHFFFAOYSA-N 1 2 309.457 4.074 20 0 DIADLO Clc1cc(Cl)nc(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001176744276 1048777421 /nfs/dbraw/zinc/77/74/21/1048777421.db2.gz RVMPWPJYUTZOTJ-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO COc1cc(Nc2ccc[nH+]c2N2CCCC2)ccc1SC ZINC001176748834 1048777597 /nfs/dbraw/zinc/77/75/97/1048777597.db2.gz DAMDEFRMIAEWFA-UHFFFAOYSA-N 1 2 315.442 4.156 20 0 DIADLO Cc1nc2ccc(Nc3ccc[nH+]c3N3CCCC3)cc2s1 ZINC001176751133 1048777797 /nfs/dbraw/zinc/77/77/97/1048777797.db2.gz WFWNUKMYBCSSMV-UHFFFAOYSA-N 1 2 310.426 4.344 20 0 DIADLO FC(F)Oc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1 ZINC001176749070 1048778382 /nfs/dbraw/zinc/77/83/82/1048778382.db2.gz RVRCERYCFZTMPM-UHFFFAOYSA-N 1 2 305.328 4.027 20 0 DIADLO Cc1ccc2nc(Nc3ccc[nH+]c3N3CCCC3)ccc2c1 ZINC001176744305 1048778994 /nfs/dbraw/zinc/77/89/94/1048778994.db2.gz SLEKZNJAABYIRK-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO c1ccc(COC[C@H]2CCN2c2cc3ccccc3c[nH+]2)cc1 ZINC001166669130 1048778990 /nfs/dbraw/zinc/77/89/90/1048778990.db2.gz KJNNIANXVIFXEO-LJQANCHMSA-N 1 2 304.393 4.030 20 0 DIADLO CC(C)(C)Cc1cc(Nc2ccc[nH+]c2N2CCCC2)on1 ZINC001176744189 1048779132 /nfs/dbraw/zinc/77/91/32/1048779132.db2.gz QGPOIQVVKQNQOP-UHFFFAOYSA-N 1 2 300.406 4.002 20 0 DIADLO Nc1ccc(Nc2ccc[nH+]c2N2CCCC2)c(C(F)(F)F)c1 ZINC001176751176 1048779175 /nfs/dbraw/zinc/77/91/75/1048779175.db2.gz XXMRRYVLUDHMEV-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO COc1ccc(Cl)c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001176748833 1048779342 /nfs/dbraw/zinc/77/93/42/1048779342.db2.gz CWOBUYOUXSFCPE-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO Nc1ccc(C(F)(F)F)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176751070 1048779383 /nfs/dbraw/zinc/77/93/83/1048779383.db2.gz VVONORVCZBAPQD-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO Clc1ccc2nccc(Nc3ccc[nH+]c3N3CCCC3)c2c1 ZINC001176744476 1048779403 /nfs/dbraw/zinc/77/94/03/1048779403.db2.gz VXRBLLNVWQVSEO-UHFFFAOYSA-N 1 2 324.815 4.049 20 0 DIADLO Clc1cncc(Nc2ccc[nH+]c2N2CCCC2)c1Cl ZINC001176749564 1048779475 /nfs/dbraw/zinc/77/94/75/1048779475.db2.gz HCWPLXRGIZSFLM-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@@H+]2CCC(C)=C(C)C2)c(Cl)c1 ZINC000483355594 1048780026 /nfs/dbraw/zinc/78/00/26/1048780026.db2.gz VZSMUHWVIFNHSO-AWEZNQCLSA-N 1 2 306.837 4.018 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@H+]2CCC(C)=C(C)C2)c(Cl)c1 ZINC000483355594 1048780037 /nfs/dbraw/zinc/78/00/37/1048780037.db2.gz VZSMUHWVIFNHSO-AWEZNQCLSA-N 1 2 306.837 4.018 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@@H+]2CCC(C)=C(C)C2)c(Cl)c1 ZINC000483355596 1048780549 /nfs/dbraw/zinc/78/05/49/1048780549.db2.gz VZSMUHWVIFNHSO-CQSZACIVSA-N 1 2 306.837 4.018 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@H+]2CCC(C)=C(C)C2)c(Cl)c1 ZINC000483355596 1048780564 /nfs/dbraw/zinc/78/05/64/1048780564.db2.gz VZSMUHWVIFNHSO-CQSZACIVSA-N 1 2 306.837 4.018 20 0 DIADLO COc1ccc2[nH+]c(N3CCc4ccsc4C3)cc(C)c2c1 ZINC001166683185 1048781649 /nfs/dbraw/zinc/78/16/49/1048781649.db2.gz VFMNEMROWKXVMW-UHFFFAOYSA-N 1 2 310.422 4.176 20 0 DIADLO COc1cc(C)c[nH+]c1N(C)Cc1cccc(C(F)(F)F)c1 ZINC001166683935 1048781850 /nfs/dbraw/zinc/78/18/50/1048781850.db2.gz KHWJDRBCRXAZTE-UHFFFAOYSA-N 1 2 310.319 4.054 20 0 DIADLO COCOc1ccc(F)cc1Nc1c(C)cc[nH+]c1C(C)C ZINC001176718127 1048784895 /nfs/dbraw/zinc/78/48/95/1048784895.db2.gz CYPCQCMFOQZBHR-UHFFFAOYSA-N 1 2 304.365 4.379 20 0 DIADLO C[N@H+](Cc1ncsc1Br)C1CCCCCCC1 ZINC001190780260 1048786635 /nfs/dbraw/zinc/78/66/35/1048786635.db2.gz LIPGBHAQSJOXDK-UHFFFAOYSA-N 1 2 317.296 4.450 20 0 DIADLO C[N@@H+](Cc1ncsc1Br)C1CCCCCCC1 ZINC001190780260 1048786644 /nfs/dbraw/zinc/78/66/44/1048786644.db2.gz LIPGBHAQSJOXDK-UHFFFAOYSA-N 1 2 317.296 4.450 20 0 DIADLO Cc1ccc(C[NH+](Cc2ccccn2)Cc2ccccn2)c(C)c1 ZINC001203726831 1048786964 /nfs/dbraw/zinc/78/69/64/1048786964.db2.gz LEZBEZXFHINQEL-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO C[N@H+](CC(=O)Nc1ccc(C(C)(C)C)cc1)Cc1ccsc1 ZINC000007926858 1048789059 /nfs/dbraw/zinc/78/90/59/1048789059.db2.gz XFUIHIMNAVYADQ-UHFFFAOYSA-N 1 2 316.470 4.116 20 0 DIADLO C[N@@H+](CC(=O)Nc1ccc(C(C)(C)C)cc1)Cc1ccsc1 ZINC000007926858 1048789071 /nfs/dbraw/zinc/78/90/71/1048789071.db2.gz XFUIHIMNAVYADQ-UHFFFAOYSA-N 1 2 316.470 4.116 20 0 DIADLO CCc1cn(CC(=O)c2ccc(Oc3ccccc3)cc2)c[nH+]1 ZINC001166822987 1048800648 /nfs/dbraw/zinc/80/06/48/1048800648.db2.gz PQVYPAHQIRNRPV-UHFFFAOYSA-N 1 2 306.365 4.121 20 0 DIADLO c1c(C[N@@H+]2CCc3cc(-c4ccccc4)oc3C2)onc1C1CC1 ZINC000851851126 1048802918 /nfs/dbraw/zinc/80/29/18/1048802918.db2.gz GLNRTHFFWBDIHE-UHFFFAOYSA-N 1 2 320.392 4.370 20 0 DIADLO c1c(C[N@H+]2CCc3cc(-c4ccccc4)oc3C2)onc1C1CC1 ZINC000851851126 1048802933 /nfs/dbraw/zinc/80/29/33/1048802933.db2.gz GLNRTHFFWBDIHE-UHFFFAOYSA-N 1 2 320.392 4.370 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ncccc2C)sc1C(C)(C)C ZINC001176896779 1048807162 /nfs/dbraw/zinc/80/71/62/1048807162.db2.gz JBWSRJHOXZCNRR-GFCCVEGCSA-N 1 2 303.475 4.303 20 0 DIADLO COc1cccc(C[NH2+]C2(c3ccccc3F)CC2)c1Cl ZINC000851903439 1048810564 /nfs/dbraw/zinc/81/05/64/1048810564.db2.gz OLHSSMFERHSLBZ-UHFFFAOYSA-N 1 2 305.780 4.267 20 0 DIADLO c1cc(C2CC2)[nH+]c(N2CCC(Sc3ccncc3)CC2)c1 ZINC001166989896 1048823853 /nfs/dbraw/zinc/82/38/53/1048823853.db2.gz OAKUZQJCGPNSLD-UHFFFAOYSA-N 1 2 311.454 4.115 20 0 DIADLO CCCCCCO[C@H]1CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC001224670513 1048826619 /nfs/dbraw/zinc/82/66/19/1048826619.db2.gz UTRJYAFTSZXSDI-ZDUSSCGKSA-N 1 2 316.898 4.358 20 0 DIADLO CCCCCCO[C@H]1CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC001224670513 1048826635 /nfs/dbraw/zinc/82/66/35/1048826635.db2.gz UTRJYAFTSZXSDI-ZDUSSCGKSA-N 1 2 316.898 4.358 20 0 DIADLO Cc1cc(N(C)Cc2csc(C(C)C)n2)nc(C(C)C)[nH+]1 ZINC001167009520 1048830743 /nfs/dbraw/zinc/83/07/43/1048830743.db2.gz TYTNWRZFGQPEIP-UHFFFAOYSA-N 1 2 304.463 4.125 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1csc(-c3ccco3)n1)C2 ZINC000483655389 1048836691 /nfs/dbraw/zinc/83/66/91/1048836691.db2.gz PWZXPKDUVLMWEZ-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1csc(-c3ccco3)n1)C2 ZINC000483655389 1048836716 /nfs/dbraw/zinc/83/67/16/1048836716.db2.gz PWZXPKDUVLMWEZ-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccccc2)[C@H]2COC(C)(C)C2)s1 ZINC000852342622 1048838757 /nfs/dbraw/zinc/83/87/57/1048838757.db2.gz HIJBLKIUDKNRMW-MRXNPFEDSA-N 1 2 316.470 4.021 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccccc2)[C@H]2COC(C)(C)C2)s1 ZINC000852342622 1048838773 /nfs/dbraw/zinc/83/87/73/1048838773.db2.gz HIJBLKIUDKNRMW-MRXNPFEDSA-N 1 2 316.470 4.021 20 0 DIADLO Clc1ccc(C[NH2+]Cc2coc(-c3ccccc3)n2)s1 ZINC001177162284 1048839670 /nfs/dbraw/zinc/83/96/70/1048839670.db2.gz KGXDBLFIIPHMGP-UHFFFAOYSA-N 1 2 304.802 4.346 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccnc(Cl)c2)cc1F ZINC000852520435 1048846995 /nfs/dbraw/zinc/84/69/95/1048846995.db2.gz DSFBEECUHGVATP-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ccnc(Cl)c2)cc1F ZINC000852520435 1048847011 /nfs/dbraw/zinc/84/70/11/1048847011.db2.gz DSFBEECUHGVATP-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)nc2)cc1F ZINC000852519036 1048847325 /nfs/dbraw/zinc/84/73/25/1048847325.db2.gz SWCBSTIIYLWKAK-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)nc2)cc1F ZINC000852519036 1048847338 /nfs/dbraw/zinc/84/73/38/1048847338.db2.gz SWCBSTIIYLWKAK-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO CCC[C@@](C)([NH2+]Cc1c(CC)ccc2ccccc21)C(=O)OC ZINC001191099882 1048849312 /nfs/dbraw/zinc/84/93/12/1048849312.db2.gz QGCRDKXWRAMVGJ-HXUWFJFHSA-N 1 2 313.441 4.224 20 0 DIADLO CCc1ccc([C@H]2COCC[N@@H+]2CC2CCC(F)(F)CC2)o1 ZINC001191120349 1048858457 /nfs/dbraw/zinc/85/84/57/1048858457.db2.gz FDMVZZAXOUXUHV-OAHLLOKOSA-N 1 2 313.388 4.041 20 0 DIADLO CCc1ccc([C@H]2COCC[N@H+]2CC2CCC(F)(F)CC2)o1 ZINC001191120349 1048858465 /nfs/dbraw/zinc/85/84/65/1048858465.db2.gz FDMVZZAXOUXUHV-OAHLLOKOSA-N 1 2 313.388 4.041 20 0 DIADLO CCc1ccc([C@H]2COCC[N@@H+]2C[C@@H]2CCCCC2(F)F)o1 ZINC001191122945 1048858683 /nfs/dbraw/zinc/85/86/83/1048858683.db2.gz UKHGNWJOMUNXFD-DZGCQCFKSA-N 1 2 313.388 4.041 20 0 DIADLO CCc1ccc([C@H]2COCC[N@H+]2C[C@@H]2CCCCC2(F)F)o1 ZINC001191122945 1048858700 /nfs/dbraw/zinc/85/87/00/1048858700.db2.gz UKHGNWJOMUNXFD-DZGCQCFKSA-N 1 2 313.388 4.041 20 0 DIADLO Cc1cccn2c(CNc3ccc(OC(F)(F)F)cc3)c[nH+]c12 ZINC001177370678 1048874953 /nfs/dbraw/zinc/87/49/53/1048874953.db2.gz KKTMDRHBJVRCLD-UHFFFAOYSA-N 1 2 321.302 4.153 20 0 DIADLO Fc1c(F)c(F)c(C[NH+]2C[C@@H]3CCCC[C@H]3C2)c(F)c1F ZINC001203360664 1048880037 /nfs/dbraw/zinc/88/00/37/1048880037.db2.gz GNRZMIDIOGOADT-IUCAKERBSA-N 1 2 305.290 4.004 20 0 DIADLO Cc1scc(CNc2ccc(N3CCCCC3)c[nH+]2)c1C ZINC001177403796 1048884967 /nfs/dbraw/zinc/88/49/67/1048884967.db2.gz BSFYXODNEHQRMB-UHFFFAOYSA-N 1 2 301.459 4.362 20 0 DIADLO CCOC(=O)CCc1ccc(Nc2ccc(C)[nH+]c2C)cc1F ZINC001203380514 1048888341 /nfs/dbraw/zinc/88/83/41/1048888341.db2.gz KDJFJBICNCKLQM-UHFFFAOYSA-N 1 2 316.376 4.077 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1coc(-c3cccc(F)c3)n1)C2 ZINC000483999222 1048888734 /nfs/dbraw/zinc/88/87/34/1048888734.db2.gz BCDDBFCULQGHHH-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1coc(-c3cccc(F)c3)n1)C2 ZINC000483999222 1048888756 /nfs/dbraw/zinc/88/87/56/1048888756.db2.gz BCDDBFCULQGHHH-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO C[C@H]1CO[C@H](c2cccc(Cl)c2)C[N@@H+]1Cc1cccs1 ZINC000483975572 1048890833 /nfs/dbraw/zinc/89/08/33/1048890833.db2.gz GZDPKILUUSRVMO-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@H](c2cccc(Cl)c2)C[N@H+]1Cc1cccs1 ZINC000483975572 1048890836 /nfs/dbraw/zinc/89/08/36/1048890836.db2.gz GZDPKILUUSRVMO-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1cc(NCc2ccc(N(C)c3ccccc3)nc2)c[nH+]c1C ZINC001203486278 1048912133 /nfs/dbraw/zinc/91/21/33/1048912133.db2.gz YKISFRAITSBCRI-UHFFFAOYSA-N 1 2 318.424 4.473 20 0 DIADLO Cc1ccsc1C[NH2+]CC(F)(F)c1cc(F)cc(F)c1 ZINC001203511110 1048913923 /nfs/dbraw/zinc/91/39/23/1048913923.db2.gz MKUYZIFCBBDANF-UHFFFAOYSA-N 1 2 303.324 4.216 20 0 DIADLO CCOCCCn1c2ccccc2[nH+]c1NCc1cccc(C)c1 ZINC001203517560 1048915916 /nfs/dbraw/zinc/91/59/16/1048915916.db2.gz WBYRUZVFYQEWDY-UHFFFAOYSA-N 1 2 323.440 4.383 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2cccc(F)c2O)c[nH+]1 ZINC001203518365 1048916036 /nfs/dbraw/zinc/91/60/36/1048916036.db2.gz GFFCUYMWSBYOOH-UHFFFAOYSA-N 1 2 323.371 4.306 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2cc(N)ccc2F)c[nH+]1 ZINC001203518314 1048916140 /nfs/dbraw/zinc/91/61/40/1048916140.db2.gz CHUXTWYPIPUAOF-UHFFFAOYSA-N 1 2 322.387 4.183 20 0 DIADLO Cc1cc(Nc2ccc(N(C)Cc3ccccc3)[nH+]c2)cnc1F ZINC001203513524 1048916358 /nfs/dbraw/zinc/91/63/58/1048916358.db2.gz MYIJUWOTGSYQCB-UHFFFAOYSA-N 1 2 322.387 4.304 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2ccc(F)c(O)c2)c[nH+]1 ZINC001203518721 1048916605 /nfs/dbraw/zinc/91/66/05/1048916605.db2.gz NFKHLRLSTURCCR-UHFFFAOYSA-N 1 2 323.371 4.306 20 0 DIADLO Cc1cc(F)ncc1Nc1ccc(N(C)Cc2ccccc2)[nH+]c1 ZINC001203512490 1048916706 /nfs/dbraw/zinc/91/67/06/1048916706.db2.gz AVJJJYXLMTYFMC-UHFFFAOYSA-N 1 2 322.387 4.304 20 0 DIADLO Cc1ccc(N)cc1Nc1ccc(N(C)Cc2ccccc2)[nH+]c1 ZINC001203518587 1048916921 /nfs/dbraw/zinc/91/69/21/1048916921.db2.gz LISMISNCIQSKKX-UHFFFAOYSA-N 1 2 318.424 4.352 20 0 DIADLO Cc1cc(N)ccc1Nc1ccc(N(C)Cc2ccccc2)[nH+]c1 ZINC001203518336 1048917113 /nfs/dbraw/zinc/91/71/13/1048917113.db2.gz DIRKTMFVNDMWMI-UHFFFAOYSA-N 1 2 318.424 4.352 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1ccc2[nH]cnc2c1 ZINC001203522519 1048919934 /nfs/dbraw/zinc/91/99/34/1048919934.db2.gz RFPYVNRNPKYHJG-UHFFFAOYSA-N 1 2 305.385 4.106 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1ccc2nc[nH]c2c1 ZINC001203522519 1048919948 /nfs/dbraw/zinc/91/99/48/1048919948.db2.gz RFPYVNRNPKYHJG-UHFFFAOYSA-N 1 2 305.385 4.106 20 0 DIADLO COc1c(C)c[nH+]c(CSCCC2SCCS2)c1C ZINC000853770310 1048922186 /nfs/dbraw/zinc/92/21/86/1048922186.db2.gz HHZCYVIJYOFUGJ-UHFFFAOYSA-N 1 2 315.529 4.136 20 0 DIADLO CCC[C@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)C(C)C ZINC000484339996 1048927697 /nfs/dbraw/zinc/92/76/97/1048927697.db2.gz YNVHJSQVZWVLQT-AWEZNQCLSA-N 1 2 303.381 4.022 20 0 DIADLO CC(C)(C)[C@H](NC(=O)C[N@@H+]1CC(C)(C)C1(C)C)c1cccs1 ZINC001191390766 1048929241 /nfs/dbraw/zinc/92/92/41/1048929241.db2.gz OYPJYLBFOFVIJS-OAHLLOKOSA-N 1 2 322.518 4.072 20 0 DIADLO CC(C)(C)[C@H](NC(=O)C[N@H+]1CC(C)(C)C1(C)C)c1cccs1 ZINC001191390766 1048929250 /nfs/dbraw/zinc/92/92/50/1048929250.db2.gz OYPJYLBFOFVIJS-OAHLLOKOSA-N 1 2 322.518 4.072 20 0 DIADLO CCc1ccc([C@@H]2C[N@@H+](CCCCC(F)(F)F)CCO2)cc1 ZINC000484351918 1048929701 /nfs/dbraw/zinc/92/97/01/1048929701.db2.gz AVNLUJGIHMKVLL-INIZCTEOSA-N 1 2 315.379 4.355 20 0 DIADLO CCc1ccc([C@@H]2C[N@H+](CCCCC(F)(F)F)CCO2)cc1 ZINC000484351918 1048929688 /nfs/dbraw/zinc/92/96/88/1048929688.db2.gz AVNLUJGIHMKVLL-INIZCTEOSA-N 1 2 315.379 4.355 20 0 DIADLO CC(C)c1nc([C@H]2CCCC[N@@H+]2C[C@@H]2CCC(F)(F)C2)no1 ZINC001191382011 1048931289 /nfs/dbraw/zinc/93/12/89/1048931289.db2.gz PAQDEHSHPYEQEI-CHWSQXEVSA-N 1 2 313.392 4.155 20 0 DIADLO CC(C)c1nc([C@H]2CCCC[N@H+]2C[C@@H]2CCC(F)(F)C2)no1 ZINC001191382011 1048931304 /nfs/dbraw/zinc/93/13/04/1048931304.db2.gz PAQDEHSHPYEQEI-CHWSQXEVSA-N 1 2 313.392 4.155 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cc(C(C)(C)C)nn2-c2cccnc2)c1 ZINC001203658018 1048950999 /nfs/dbraw/zinc/95/09/99/1048950999.db2.gz USGDWFXQKXXGEP-UHFFFAOYSA-N 1 2 321.428 4.320 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cccnc2OCc2ccccc2)c1 ZINC001203657495 1048951952 /nfs/dbraw/zinc/95/19/52/1048951952.db2.gz NWURSQUHMQQRGD-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccccc2C(=O)Nc2cccnc2)c1 ZINC001203663334 1048953962 /nfs/dbraw/zinc/95/39/62/1048953962.db2.gz NPASCOCTPPHZTF-UHFFFAOYSA-N 1 2 318.380 4.089 20 0 DIADLO COc1cc(Br)cc(Nc2cc(C)c[nH+]c2C)c1 ZINC001203663452 1048955332 /nfs/dbraw/zinc/95/53/32/1048955332.db2.gz KJIGIHYUQVFHPM-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cccc(-c3nc(CO)cs3)c2)c1 ZINC001203669418 1048956034 /nfs/dbraw/zinc/95/60/34/1048956034.db2.gz RVPFDRDXYMSAAQ-UHFFFAOYSA-N 1 2 311.410 4.058 20 0 DIADLO CNc1ccc(Br)cc1Nc1cc(C)c[nH+]c1C ZINC001203669422 1048956710 /nfs/dbraw/zinc/95/67/10/1048956710.db2.gz RXAYVJWYMRGAJH-UHFFFAOYSA-N 1 2 306.207 4.246 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2c(F)cccc2OC[C@@H]2CCCO2)c1 ZINC001203667472 1048957224 /nfs/dbraw/zinc/95/72/24/1048957224.db2.gz MJMFGVWNTRBFLZ-AWEZNQCLSA-N 1 2 316.376 4.139 20 0 DIADLO CCCOc1ccc(Nc2cccn3cc[nH+]c23)c(F)c1F ZINC001203690713 1048964609 /nfs/dbraw/zinc/96/46/09/1048964609.db2.gz MBWVIOZHPKYVFZ-UHFFFAOYSA-N 1 2 303.312 4.145 20 0 DIADLO O=C(CCc1[nH]cc[nH+]1)Nc1ccc(C2CC2)c2ccccc12 ZINC001177996910 1048970544 /nfs/dbraw/zinc/97/05/44/1048970544.db2.gz PHHWHHRTIQEQBQ-UHFFFAOYSA-N 1 2 305.381 4.012 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc([NH+]3CCCCC3)cc2)n1 ZINC001203712818 1048974415 /nfs/dbraw/zinc/97/44/15/1048974415.db2.gz PBTOMXGWXNKYEG-UHFFFAOYSA-N 1 2 306.413 4.377 20 0 DIADLO Cn1nc2c(c1Nc1ccc([NH+]3CCCCC3)cc1)CCCC2 ZINC001203717719 1048974876 /nfs/dbraw/zinc/97/48/76/1048974876.db2.gz MMVYOSRFOXVFEK-UHFFFAOYSA-N 1 2 310.445 4.033 20 0 DIADLO Oc1ccc(Nc2ccc([NH+]3CCCCC3)cc2)c(F)c1F ZINC001203719406 1048976413 /nfs/dbraw/zinc/97/64/13/1048976413.db2.gz VFGXRASOXJUXNX-UHFFFAOYSA-N 1 2 304.340 4.404 20 0 DIADLO CCNC(=O)c1ccccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203719230 1048977191 /nfs/dbraw/zinc/97/71/91/1048977191.db2.gz KGGVVCLIBJMSQD-UHFFFAOYSA-N 1 2 323.440 4.170 20 0 DIADLO CN(c1ccc([NH+]2CCCCC2)cc1)c1nc(Cl)ccc1N ZINC001203718149 1048977265 /nfs/dbraw/zinc/97/72/65/1048977265.db2.gz SJSSIDAZZAWHMR-UHFFFAOYSA-N 1 2 316.836 4.075 20 0 DIADLO c1cc2snnc2c(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001203724208 1048978264 /nfs/dbraw/zinc/97/82/64/1048978264.db2.gz IXRGGUKOTOKYKY-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO CC(=O)c1cc(Nc2ccc([NH+]3CCCCC3)cc2)ccc1O ZINC001203719556 1048978627 /nfs/dbraw/zinc/97/86/27/1048978627.db2.gz PUAAPXNPRRYSDG-UHFFFAOYSA-N 1 2 310.397 4.329 20 0 DIADLO c1ccc(C2OCCO2)c(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001203724119 1048979803 /nfs/dbraw/zinc/97/98/03/1048979803.db2.gz GGZAQINASGNHNG-UHFFFAOYSA-N 1 2 324.424 4.466 20 0 DIADLO CC[C@@H]1C[C@@H](CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)CCO1 ZINC001178068663 1048981033 /nfs/dbraw/zinc/98/10/33/1048981033.db2.gz SZPOBEGYCIFBIJ-DZGCQCFKSA-N 1 2 319.836 4.143 20 0 DIADLO c1ccc(OC2COC2)c(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001203724409 1048980992 /nfs/dbraw/zinc/98/09/92/1048980992.db2.gz MTYKIVRPZBQQJA-UHFFFAOYSA-N 1 2 324.424 4.198 20 0 DIADLO Fc1cc2[nH]ccc2c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001203727814 1048981047 /nfs/dbraw/zinc/98/10/47/1048981047.db2.gz ULRDNZWKDFQIGU-UHFFFAOYSA-N 1 2 310.376 4.436 20 0 DIADLO Fc1cc2[nH]ccc2c(Nc2ccc[nH+]c2N2CCCCC2)c1 ZINC001203726648 1048982158 /nfs/dbraw/zinc/98/21/58/1048982158.db2.gz DNCLZIRYRNKXCJ-UHFFFAOYSA-N 1 2 310.376 4.436 20 0 DIADLO CCO[C@H](c1noc([C@@H]2CC[N@@H+]2C2CCCC2)n1)C1CCCC1 ZINC000904136239 1048984057 /nfs/dbraw/zinc/98/40/57/1048984057.db2.gz JNTVGNXUJNNFOK-HOTGVXAUSA-N 1 2 319.449 4.027 20 0 DIADLO CCO[C@H](c1noc([C@@H]2CC[N@H+]2C2CCCC2)n1)C1CCCC1 ZINC000904136239 1048984070 /nfs/dbraw/zinc/98/40/70/1048984070.db2.gz JNTVGNXUJNNFOK-HOTGVXAUSA-N 1 2 319.449 4.027 20 0 DIADLO C[N@H+](Cc1ccccc1)Cc1cccc(F)c1Br ZINC000158009795 1048988699 /nfs/dbraw/zinc/98/86/99/1048988699.db2.gz GRLGOQACDPLMGL-UHFFFAOYSA-N 1 2 308.194 4.220 20 0 DIADLO C[N@@H+](Cc1ccccc1)Cc1cccc(F)c1Br ZINC000158009795 1048988709 /nfs/dbraw/zinc/98/87/09/1048988709.db2.gz GRLGOQACDPLMGL-UHFFFAOYSA-N 1 2 308.194 4.220 20 0 DIADLO COc1cc(C)ccc1CNc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001178138225 1048989165 /nfs/dbraw/zinc/98/91/65/1048989165.db2.gz BGJOBLVICWVTFH-UHFFFAOYSA-N 1 2 307.397 4.110 20 0 DIADLO Fc1cc(NC[C@@H]2C[C@H]2c2ccccc2)ccc1-n1cc[nH+]c1 ZINC001178094269 1048989263 /nfs/dbraw/zinc/98/92/63/1048989263.db2.gz BSRIYGBXKZIWCN-RDJZCZTQSA-N 1 2 307.372 4.227 20 0 DIADLO CCOc1cc(Cl)ccc1NCc1c[nH+]c2ccc(C)cn12 ZINC001178147831 1048989948 /nfs/dbraw/zinc/98/99/48/1048989948.db2.gz IEKSRMAYAXCILW-UHFFFAOYSA-N 1 2 315.804 4.307 20 0 DIADLO Cc1ccc2sc(C(=O)NCc3cc(C)[nH+]c(C)c3)cc2c1 ZINC001276418334 1048990550 /nfs/dbraw/zinc/99/05/50/1048990550.db2.gz KSTZUKBFMLXNCI-UHFFFAOYSA-N 1 2 310.422 4.152 20 0 DIADLO Cc1oc(-c2ccccc2)cc1C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001276418106 1048991445 /nfs/dbraw/zinc/99/14/45/1048991445.db2.gz JWCDRAMOEOCXMR-UHFFFAOYSA-N 1 2 320.392 4.197 20 0 DIADLO Cc1cc(CNc2ccc([NH+]3CCCC3)cc2)c2c(n1)CCCC2 ZINC001178124579 1048993477 /nfs/dbraw/zinc/99/34/77/1048993477.db2.gz KCZMLXUBOGFGQX-UHFFFAOYSA-N 1 2 321.468 4.481 20 0 DIADLO Cc1cc(CNC(=O)c2coc3ccc(Cl)cc23)cc(C)[nH+]1 ZINC001276419614 1048995831 /nfs/dbraw/zinc/99/58/31/1048995831.db2.gz XFMSEYPFSOIDBL-UHFFFAOYSA-N 1 2 314.772 4.028 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ccccn2)Cc2cccc(F)n2)c1 ZINC001191802771 1049003249 /nfs/dbraw/zinc/00/32/49/1049003249.db2.gz YXSNRGDXUCLMKT-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ccccn2)Cc2cccc(F)n2)c1 ZINC001191802771 1049003261 /nfs/dbraw/zinc/00/32/61/1049003261.db2.gz YXSNRGDXUCLMKT-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO c1cn(-c2ccc(CNc3cccc(-c4ccon4)c3)cc2)c[nH+]1 ZINC001203810390 1049004560 /nfs/dbraw/zinc/00/45/60/1049004560.db2.gz RIKDCZBJRDBPRV-UHFFFAOYSA-N 1 2 316.364 4.139 20 0 DIADLO C[NH+](C)[C@H](c1nc(-c2ccccc2)no1)c1ccc(Cl)cc1 ZINC000904238283 1049005619 /nfs/dbraw/zinc/00/56/19/1049005619.db2.gz KAMOFAMZAQCKNE-HNNXBMFYSA-N 1 2 313.788 4.041 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(Oc3ccccc3)c2)CCC1=O ZINC001203812742 1049007540 /nfs/dbraw/zinc/00/75/40/1049007540.db2.gz BOYUZYMQHFGZIX-UHFFFAOYSA-N 1 2 309.409 4.280 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(Oc3ccccc3)c2)CCC1=O ZINC001203812742 1049007556 /nfs/dbraw/zinc/00/75/56/1049007556.db2.gz BOYUZYMQHFGZIX-UHFFFAOYSA-N 1 2 309.409 4.280 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1noc([C@@H]2CCC[C@H]2c2ccccc2)n1 ZINC000904268628 1049010095 /nfs/dbraw/zinc/01/00/95/1049010095.db2.gz XJSMHQRLGSEYHO-LSDHHAIUSA-N 1 2 320.396 4.074 20 0 DIADLO COc1cc(C[N@@H+]2CCOc3ccccc3[C@H]2C)ccc1Cl ZINC001191871106 1049012174 /nfs/dbraw/zinc/01/21/74/1049012174.db2.gz MRCLEQZOFYVEOO-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(C[N@H+]2CCOc3ccccc3[C@H]2C)ccc1Cl ZINC001191871106 1049012191 /nfs/dbraw/zinc/01/21/91/1049012191.db2.gz MRCLEQZOFYVEOO-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1cccc(OC(F)F)c1 ZINC001178377334 1049023023 /nfs/dbraw/zinc/02/30/23/1049023023.db2.gz IGYUHSLNWJTEPZ-UHFFFAOYSA-N 1 2 322.355 4.472 20 0 DIADLO Cc1ccc(-c2n[nH]cc2CNc2ccc([NH+](C)C)c(C)c2)cc1 ZINC001178360641 1049026668 /nfs/dbraw/zinc/02/66/68/1049026668.db2.gz OAWCNUUJNNNSEI-UHFFFAOYSA-N 1 2 320.440 4.372 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CC[C@H]2SCCS[C@@H]12 ZINC000776803128 1049028539 /nfs/dbraw/zinc/02/85/39/1049028539.db2.gz SKDSAKPVYCPMOX-ZACQAIPSSA-N 1 2 320.527 4.078 20 0 DIADLO C=Cn1cc(CNc2[nH+]c3ccccc3n2C2CCCC2)cn1 ZINC000195003072 1049028748 /nfs/dbraw/zinc/02/87/48/1049028748.db2.gz JHLQYIHVMYJDSC-UHFFFAOYSA-N 1 2 307.401 4.061 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@@H+]1CCC[C@@H](CC(C)C)C1 ZINC001192197924 1049052918 /nfs/dbraw/zinc/05/29/18/1049052918.db2.gz HRYANOUCKNXONK-WMLDXEAASA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@H+]1CCC[C@@H](CC(C)C)C1 ZINC001192197924 1049052931 /nfs/dbraw/zinc/05/29/31/1049052931.db2.gz HRYANOUCKNXONK-WMLDXEAASA-N 1 2 323.864 4.312 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NCc1ccc(OC(F)F)cc1 ZINC001178504679 1049056445 /nfs/dbraw/zinc/05/64/45/1049056445.db2.gz DEUQXHLJVYYUCT-UHFFFAOYSA-N 1 2 308.328 4.082 20 0 DIADLO Cc1ccsc1C[N@@H+]1CCc2ncc(C(F)(F)F)cc2C1 ZINC001204021102 1049064313 /nfs/dbraw/zinc/06/43/13/1049064313.db2.gz GPWFAIJZTILZAH-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1ccsc1C[N@H+]1CCc2ncc(C(F)(F)F)cc2C1 ZINC001204021102 1049064326 /nfs/dbraw/zinc/06/43/26/1049064326.db2.gz GPWFAIJZTILZAH-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO c1cn2c(cccc2CNc2cccc(Oc3ccccc3)n2)[nH+]1 ZINC001204027361 1049066788 /nfs/dbraw/zinc/06/67/88/1049066788.db2.gz GARZIFTUGPOAFZ-UHFFFAOYSA-N 1 2 316.364 4.134 20 0 DIADLO Cc1ccc(C[NH2+]Cc2c(F)cccc2OC(F)F)c(F)c1 ZINC001178620729 1049066973 /nfs/dbraw/zinc/06/69/73/1049066973.db2.gz SWHGJWOUXPUKOQ-UHFFFAOYSA-N 1 2 313.294 4.164 20 0 DIADLO Brc1cccc2c1C[N@@H+](Cc1ccsc1)CC2 ZINC001204035191 1049069725 /nfs/dbraw/zinc/06/97/25/1049069725.db2.gz VPMPFPXBCLCCCZ-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1cccc2c1C[N@H+](Cc1ccsc1)CC2 ZINC001204035191 1049069712 /nfs/dbraw/zinc/06/97/12/1049069712.db2.gz VPMPFPXBCLCCCZ-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO COC(=O)c1ccoc1C[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC000338986199 1049075535 /nfs/dbraw/zinc/07/55/35/1049075535.db2.gz NEMCQUUYTKJMJS-HNNXBMFYSA-N 1 2 319.788 4.057 20 0 DIADLO COC(=O)c1ccoc1C[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000338986199 1049075548 /nfs/dbraw/zinc/07/55/48/1049075548.db2.gz NEMCQUUYTKJMJS-HNNXBMFYSA-N 1 2 319.788 4.057 20 0 DIADLO Cc1nnsc1[C@H](C)[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001192325696 1049077484 /nfs/dbraw/zinc/07/74/84/1049077484.db2.gz PGCWEHWPOGSGJU-LBPRGKRZSA-N 1 2 319.861 4.350 20 0 DIADLO Cc1nnsc1[C@H](C)[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001192325696 1049077488 /nfs/dbraw/zinc/07/74/88/1049077488.db2.gz PGCWEHWPOGSGJU-LBPRGKRZSA-N 1 2 319.861 4.350 20 0 DIADLO C[N@@H+]1CCCC[C@@H]1C(=O)Nc1ccccc1SC(C)(C)C ZINC001178697818 1049077915 /nfs/dbraw/zinc/07/79/15/1049077915.db2.gz OOHNTXRMKMJFLW-CQSZACIVSA-N 1 2 306.475 4.000 20 0 DIADLO C[N@H+]1CCCC[C@@H]1C(=O)Nc1ccccc1SC(C)(C)C ZINC001178697818 1049077931 /nfs/dbraw/zinc/07/79/31/1049077931.db2.gz OOHNTXRMKMJFLW-CQSZACIVSA-N 1 2 306.475 4.000 20 0 DIADLO CCc1nnc(C[NH2+]Cc2ccc(C3CCCCC3)cc2)s1 ZINC001178786479 1049087974 /nfs/dbraw/zinc/08/79/74/1049087974.db2.gz BWFPVFHRFHQHLJ-UHFFFAOYSA-N 1 2 315.486 4.438 20 0 DIADLO CCC1(CC)CN(Cc2cc[nH+]c(N(C)C)c2)c2ccccc21 ZINC001192411831 1049101011 /nfs/dbraw/zinc/10/10/11/1049101011.db2.gz BYBQDBQNZHNJBL-UHFFFAOYSA-N 1 2 309.457 4.226 20 0 DIADLO Clc1cncc(C[N@H+]2CC=C(c3ccc(Cl)nc3)CC2)c1 ZINC000856732888 1049101647 /nfs/dbraw/zinc/10/16/47/1049101647.db2.gz GOIKFMYUJJKUAE-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1cncc(C[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)c1 ZINC000856732888 1049101650 /nfs/dbraw/zinc/10/16/50/1049101650.db2.gz GOIKFMYUJJKUAE-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Cc1ccc(-c2cccc(C[NH2+][C@H](C)c3csnn3)c2)cc1 ZINC001178971698 1049115457 /nfs/dbraw/zinc/11/54/57/1049115457.db2.gz LSFPXSIZHQPVTJ-CQSZACIVSA-N 1 2 309.438 4.364 20 0 DIADLO Cc1ccccc1-c1cccc(C[NH2+][C@@H](C)c2csnn2)c1 ZINC001178971702 1049115800 /nfs/dbraw/zinc/11/58/00/1049115800.db2.gz LWFZAQCQXYEPNZ-AWEZNQCLSA-N 1 2 309.438 4.364 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cc(F)cc(F)c1 ZINC001204232251 1049115861 /nfs/dbraw/zinc/11/58/61/1049115861.db2.gz HXKMPIXXEYRUFI-SFHVURJKSA-N 1 2 317.379 4.448 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cc(F)cc(F)c1 ZINC001204232251 1049115864 /nfs/dbraw/zinc/11/58/64/1049115864.db2.gz HXKMPIXXEYRUFI-SFHVURJKSA-N 1 2 317.379 4.448 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC001192585415 1049119746 /nfs/dbraw/zinc/11/97/46/1049119746.db2.gz UUNFSJHCSUAUJZ-CJNGLKHVSA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC001192585415 1049119751 /nfs/dbraw/zinc/11/97/51/1049119751.db2.gz UUNFSJHCSUAUJZ-CJNGLKHVSA-N 1 2 321.848 4.066 20 0 DIADLO COc1ccc2c(c1)CC[N@@H+](Cc1ccc(F)c(Cl)c1)C2 ZINC001204283127 1049128171 /nfs/dbraw/zinc/12/81/71/1049128171.db2.gz ZXTZMVMPDHGIAP-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc2c(c1)CC[N@H+](Cc1ccc(F)c(Cl)c1)C2 ZINC001204283127 1049128177 /nfs/dbraw/zinc/12/81/77/1049128177.db2.gz ZXTZMVMPDHGIAP-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Cc1oc(-c2ccccc2)cc1C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001179091794 1049129967 /nfs/dbraw/zinc/12/99/67/1049129967.db2.gz DJXXHMQQSOCOMB-UHFFFAOYSA-N 1 2 323.396 4.032 20 0 DIADLO Cc1oc(-c2ccccc2)cc1C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001179091794 1049129972 /nfs/dbraw/zinc/12/99/72/1049129972.db2.gz DJXXHMQQSOCOMB-UHFFFAOYSA-N 1 2 323.396 4.032 20 0 DIADLO CCCCCCOc1ccccc1C[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC001204298541 1049131540 /nfs/dbraw/zinc/13/15/40/1049131540.db2.gz SWKNEUMRMQDFSP-HDICACEKSA-N 1 2 303.446 4.009 20 0 DIADLO CCCCCCOc1ccccc1C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC001204298541 1049131546 /nfs/dbraw/zinc/13/15/46/1049131546.db2.gz SWKNEUMRMQDFSP-HDICACEKSA-N 1 2 303.446 4.009 20 0 DIADLO CCCOc1ccc(C[N@@H+]2CCc3ccc(C(C)=O)cc3C2)cc1 ZINC001204307460 1049135713 /nfs/dbraw/zinc/13/57/13/1049135713.db2.gz KKXXIMCHBDIMPV-UHFFFAOYSA-N 1 2 323.436 4.236 20 0 DIADLO CCCOc1ccc(C[N@H+]2CCc3ccc(C(C)=O)cc3C2)cc1 ZINC001204307460 1049135718 /nfs/dbraw/zinc/13/57/18/1049135718.db2.gz KKXXIMCHBDIMPV-UHFFFAOYSA-N 1 2 323.436 4.236 20 0 DIADLO CCCOc1ccc(C[N@@H+]2CCOC[C@@H]2c2ccccc2)cc1 ZINC001204306061 1049136561 /nfs/dbraw/zinc/13/65/61/1049136561.db2.gz QJDCKPHRYDKSHP-HXUWFJFHSA-N 1 2 311.425 4.049 20 0 DIADLO CCCOc1ccc(C[N@H+]2CCOC[C@@H]2c2ccccc2)cc1 ZINC001204306061 1049136571 /nfs/dbraw/zinc/13/65/71/1049136571.db2.gz QJDCKPHRYDKSHP-HXUWFJFHSA-N 1 2 311.425 4.049 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](C)c2ccc(SC(F)F)cc2)s1 ZINC000775550298 1049140002 /nfs/dbraw/zinc/14/00/02/1049140002.db2.gz YJKICFYCVRJLKO-QMMMGPOBSA-N 1 2 315.414 4.012 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1cnccc1C(F)(F)F ZINC001179210376 1049141555 /nfs/dbraw/zinc/14/15/55/1049141555.db2.gz FKLNIPHDEPKYCH-UHFFFAOYSA-N 1 2 318.701 4.183 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C(C)C)s1)c1ccc(C)c(F)c1 ZINC001192909816 1049146436 /nfs/dbraw/zinc/14/64/36/1049146436.db2.gz MWGHPJLSDKOGHZ-AWEZNQCLSA-N 1 2 307.438 4.350 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@H+]1CCCN(C)c1ccccc1 ZINC001192945933 1049150809 /nfs/dbraw/zinc/15/08/09/1049150809.db2.gz GGZQMYHQLISOGG-OAHLLOKOSA-N 1 2 317.864 4.045 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@@H+]1CCCN(C)c1ccccc1 ZINC001192945933 1049150813 /nfs/dbraw/zinc/15/08/13/1049150813.db2.gz GGZQMYHQLISOGG-OAHLLOKOSA-N 1 2 317.864 4.045 20 0 DIADLO CCCCCCOc1ccc(C[N@H+]2CCC(=O)[C@H](F)CC2)cc1 ZINC001204365308 1049151722 /nfs/dbraw/zinc/15/17/22/1049151722.db2.gz QIKYLMFDJTUDKS-GOSISDBHSA-N 1 2 321.436 4.149 20 0 DIADLO CCCCCCOc1ccc(C[N@@H+]2CCC(=O)[C@H](F)CC2)cc1 ZINC001204365308 1049151730 /nfs/dbraw/zinc/15/17/30/1049151730.db2.gz QIKYLMFDJTUDKS-GOSISDBHSA-N 1 2 321.436 4.149 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)CCC2 ZINC000775555417 1049157151 /nfs/dbraw/zinc/15/71/51/1049157151.db2.gz MOQAXJHUXFTYEX-LRDDRELGSA-N 1 2 318.852 4.241 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@H](C)c1ccc(Cl)cn1)CCC2 ZINC000775555419 1049157429 /nfs/dbraw/zinc/15/74/29/1049157429.db2.gz MOQAXJHUXFTYEX-WBMJQRKESA-N 1 2 318.852 4.241 20 0 DIADLO COc1cccc(CNc2c[nH+]c(C)c(C)c2)c1OC(C)C ZINC001179447975 1049165176 /nfs/dbraw/zinc/16/51/76/1049165176.db2.gz UQUCSFJLXGMRFT-UHFFFAOYSA-N 1 2 300.402 4.106 20 0 DIADLO CCCCOc1ccc(CNc2c[nH+]c(C)c(C)c2)cc1OC ZINC001179447313 1049166276 /nfs/dbraw/zinc/16/62/76/1049166276.db2.gz BKFZBRVQSDXTMN-UHFFFAOYSA-N 1 2 314.429 4.498 20 0 DIADLO Cc1ncccc1C[N@@H+](C)Cc1ccc(C(F)(F)F)cc1F ZINC001204471508 1049169987 /nfs/dbraw/zinc/16/99/87/1049169987.db2.gz QOANDNOAMJGCBW-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ncccc1C[N@H+](C)Cc1ccc(C(F)(F)F)cc1F ZINC001204471508 1049169996 /nfs/dbraw/zinc/16/99/96/1049169996.db2.gz QOANDNOAMJGCBW-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO CC1(C)C[NH+](Cc2ccc(F)cc2C(F)(F)F)CC(C)(C)O1 ZINC001204485333 1049174649 /nfs/dbraw/zinc/17/46/49/1049174649.db2.gz SXWNPRIMYXFNAJ-UHFFFAOYSA-N 1 2 319.342 4.234 20 0 DIADLO CCCOc1ccc(C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)cc1 ZINC001179578858 1049178699 /nfs/dbraw/zinc/17/86/99/1049178699.db2.gz AQTVYSODUMGRQZ-IEBWSBKVSA-N 1 2 315.388 4.037 20 0 DIADLO Fc1cccc(CC[N@@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)c1 ZINC001193118125 1049179433 /nfs/dbraw/zinc/17/94/33/1049179433.db2.gz RXHYVTFWVLWUKI-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1cccc(CC[N@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)c1 ZINC001193118125 1049179437 /nfs/dbraw/zinc/17/94/37/1049179437.db2.gz RXHYVTFWVLWUKI-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO COC(=O)C[N@H+](CCCCC(C)C)Cc1ccc(Cl)cc1 ZINC001204516392 1049180409 /nfs/dbraw/zinc/18/04/09/1049180409.db2.gz UBDJUCCRGKXWJL-UHFFFAOYSA-N 1 2 311.853 4.141 20 0 DIADLO COC(=O)C[N@@H+](CCCCC(C)C)Cc1ccc(Cl)cc1 ZINC001204516392 1049180414 /nfs/dbraw/zinc/18/04/14/1049180414.db2.gz UBDJUCCRGKXWJL-UHFFFAOYSA-N 1 2 311.853 4.141 20 0 DIADLO Cc1cc(C)cc(C[NH+](Cc2ccccn2)Cc2ccccn2)c1 ZINC001204518226 1049181142 /nfs/dbraw/zinc/18/11/42/1049181142.db2.gz HWTHZEAQKNPYJN-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)oc1C ZINC001204531705 1049182425 /nfs/dbraw/zinc/18/24/25/1049182425.db2.gz MAWVWPXBGOXCSX-HXUWFJFHSA-N 1 2 306.409 4.303 20 0 DIADLO Cc1cc(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)oc1C ZINC001204531705 1049182427 /nfs/dbraw/zinc/18/24/27/1049182427.db2.gz MAWVWPXBGOXCSX-HXUWFJFHSA-N 1 2 306.409 4.303 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(F)c(F)c(F)c1 ZINC001204528133 1049183685 /nfs/dbraw/zinc/18/36/85/1049183685.db2.gz RBXCBITVKCEYAD-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1cc(F)c(F)c(F)c1 ZINC001204528133 1049183689 /nfs/dbraw/zinc/18/36/89/1049183689.db2.gz RBXCBITVKCEYAD-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO Oc1ccc2c(c1)CC[N@@H+](Cc1cc(Cl)ccc1Cl)C2 ZINC001204562258 1049189535 /nfs/dbraw/zinc/18/95/35/1049189535.db2.gz CXQWYKWHPADCQZ-UHFFFAOYSA-N 1 2 308.208 4.257 20 0 DIADLO Oc1ccc2c(c1)CC[N@H+](Cc1cc(Cl)ccc1Cl)C2 ZINC001204562258 1049189544 /nfs/dbraw/zinc/18/95/44/1049189544.db2.gz CXQWYKWHPADCQZ-UHFFFAOYSA-N 1 2 308.208 4.257 20 0 DIADLO COc1ccsc1CNc1[nH+]c2ccccc2n1CC1CC1 ZINC001179631613 1049191119 /nfs/dbraw/zinc/19/11/19/1049191119.db2.gz QRMUKFFIFCKDAQ-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO COC(=O)c1occc1C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000339006222 1049194001 /nfs/dbraw/zinc/19/40/01/1049194001.db2.gz YIZFPFMEFDZBSM-OAHLLOKOSA-N 1 2 319.788 4.057 20 0 DIADLO COC(=O)c1occc1C[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000339006222 1049194009 /nfs/dbraw/zinc/19/40/09/1049194009.db2.gz YIZFPFMEFDZBSM-OAHLLOKOSA-N 1 2 319.788 4.057 20 0 DIADLO COc1cc(C[N@@H+]2Cc3ccccc3OC[C@@H]2C)ccc1Cl ZINC001193310660 1049195806 /nfs/dbraw/zinc/19/58/06/1049195806.db2.gz OQFGOSURPUKICI-ZDUSSCGKSA-N 1 2 317.816 4.132 20 0 DIADLO COc1cc(C[N@H+]2Cc3ccccc3OC[C@@H]2C)ccc1Cl ZINC001193310660 1049195812 /nfs/dbraw/zinc/19/58/12/1049195812.db2.gz OQFGOSURPUKICI-ZDUSSCGKSA-N 1 2 317.816 4.132 20 0 DIADLO COc1cccc2c1CC[N@H+](Cc1nc3cc(C)ccc3s1)C2 ZINC001193293507 1049196143 /nfs/dbraw/zinc/19/61/43/1049196143.db2.gz MDHKPVUWBZGNJG-UHFFFAOYSA-N 1 2 324.449 4.172 20 0 DIADLO COc1cccc2c1CC[N@@H+](Cc1nc3cc(C)ccc3s1)C2 ZINC001193293507 1049196145 /nfs/dbraw/zinc/19/61/45/1049196145.db2.gz MDHKPVUWBZGNJG-UHFFFAOYSA-N 1 2 324.449 4.172 20 0 DIADLO O=C(c1cccc2[nH+]ccn21)N(c1ccccc1F)C1CCCC1 ZINC000776962025 1049196517 /nfs/dbraw/zinc/19/65/17/1049196517.db2.gz ICJCYTVIOFHADC-UHFFFAOYSA-N 1 2 323.371 4.063 20 0 DIADLO CC(C)(C)CN(C(=O)c1cccc2[nH+]ccn21)c1ccccc1 ZINC000776972110 1049198132 /nfs/dbraw/zinc/19/81/32/1049198132.db2.gz FFNOQMWNJGIAMU-UHFFFAOYSA-N 1 2 307.397 4.027 20 0 DIADLO CCCCCNC(=O)Nc1ccc(Oc2cc[nH+]c(C)c2)cc1 ZINC001193337334 1049199940 /nfs/dbraw/zinc/19/99/40/1049199940.db2.gz RPZMQOSSDCFIMP-UHFFFAOYSA-N 1 2 313.401 4.494 20 0 DIADLO Cc1ccc2cc(C[N@H+]3C[C@H](C)OC[C@@H]3c3ccccc3)[nH]c2c1 ZINC001204615835 1049200435 /nfs/dbraw/zinc/20/04/35/1049200435.db2.gz MFQBRSLZBZTRRG-HRAATJIYSA-N 1 2 320.436 4.438 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3C[C@H](C)OC[C@@H]3c3ccccc3)[nH]c2c1 ZINC001204615835 1049200450 /nfs/dbraw/zinc/20/04/50/1049200450.db2.gz MFQBRSLZBZTRRG-HRAATJIYSA-N 1 2 320.436 4.438 20 0 DIADLO CC(C)c1csc(C[NH2+][C@H]2CCc3ccc(Cl)nc32)n1 ZINC000857905413 1049208418 /nfs/dbraw/zinc/20/84/18/1049208418.db2.gz GANYJOBYCFZQBZ-NSHDSACASA-N 1 2 307.850 4.092 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@@H+](Cc1ncccc1C(F)(F)F)CC2 ZINC001193528652 1049223015 /nfs/dbraw/zinc/22/30/15/1049223015.db2.gz ULPDFAGBHPYMKZ-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@H+](Cc1ncccc1C(F)(F)F)CC2 ZINC001193528652 1049223023 /nfs/dbraw/zinc/22/30/23/1049223023.db2.gz ULPDFAGBHPYMKZ-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO CSCCCCCCC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000858230224 1049227865 /nfs/dbraw/zinc/22/78/65/1049227865.db2.gz SENIAMWWZNZTQO-UHFFFAOYSA-N 1 2 305.447 4.123 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3ccns3)cs2)cc1 ZINC000858316491 1049239669 /nfs/dbraw/zinc/23/96/69/1049239669.db2.gz DFBULSAQRNECHC-LBPRGKRZSA-N 1 2 315.467 4.426 20 0 DIADLO C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccc(-c2ccccc2Cl)o1 ZINC001204718112 1049240863 /nfs/dbraw/zinc/24/08/63/1049240863.db2.gz VPNBNYAKEGUAPT-GFCCVEGCSA-N 1 2 303.789 4.153 20 0 DIADLO C[C@@H]1CC(=O)CC[N@H+]1Cc1ccc(-c2ccccc2Cl)o1 ZINC001204718112 1049240871 /nfs/dbraw/zinc/24/08/71/1049240871.db2.gz VPNBNYAKEGUAPT-GFCCVEGCSA-N 1 2 303.789 4.153 20 0 DIADLO Cc1nn(-c2ccc(C)cc2)cc1C[NH+]1Cc2ccccc2C1 ZINC001180006331 1049254498 /nfs/dbraw/zinc/25/44/98/1049254498.db2.gz AEOYBSZCINUXJG-UHFFFAOYSA-N 1 2 303.409 4.005 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2ccc(F)cc2F)C1 ZINC001193796552 1049265227 /nfs/dbraw/zinc/26/52/27/1049265227.db2.gz GYTQXBBWTLOCDU-SFHVURJKSA-N 1 2 305.343 4.344 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2ccc(F)cc2F)C1 ZINC001193796552 1049265241 /nfs/dbraw/zinc/26/52/41/1049265241.db2.gz GYTQXBBWTLOCDU-SFHVURJKSA-N 1 2 305.343 4.344 20 0 DIADLO COc1cnc(F)c(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC001180129402 1049276981 /nfs/dbraw/zinc/27/69/81/1049276981.db2.gz QXEYSKBMSYJORC-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cnc(F)c(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC001180129402 1049276996 /nfs/dbraw/zinc/27/69/96/1049276996.db2.gz QXEYSKBMSYJORC-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1coc(C[N@H+]2Cc3cc(Br)ccc3C[C@@H]2C)c1 ZINC001180133203 1049280570 /nfs/dbraw/zinc/28/05/70/1049280570.db2.gz RNSRILLNVZRHNV-LBPRGKRZSA-N 1 2 320.230 4.297 20 0 DIADLO Cc1coc(C[N@@H+]2Cc3cc(Br)ccc3C[C@@H]2C)c1 ZINC001180133203 1049280583 /nfs/dbraw/zinc/28/05/83/1049280583.db2.gz RNSRILLNVZRHNV-LBPRGKRZSA-N 1 2 320.230 4.297 20 0 DIADLO COc1ccc(-c2c[nH+]c(N)c(C)c2)c(OCc2ccccc2)c1 ZINC001204853701 1049286565 /nfs/dbraw/zinc/28/65/65/1049286565.db2.gz VSKSPHMFNKBOHB-UHFFFAOYSA-N 1 2 320.392 4.227 20 0 DIADLO Fc1ccccc1C=C1CC[NH+](Cc2ncccc2F)CC1 ZINC001180107907 1049290028 /nfs/dbraw/zinc/29/00/28/1049290028.db2.gz KFIRXDWSRZXCOE-UHFFFAOYSA-N 1 2 300.352 4.039 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@@H](C)c3ccco3)c2)[nH+]c1C ZINC000858739558 1049291466 /nfs/dbraw/zinc/29/14/66/1049291466.db2.gz HWXHQMBBUZVMDU-GFCCVEGCSA-N 1 2 323.396 4.419 20 0 DIADLO C[C@H]1C[N@H+](CCc2c(Cl)cccc2Cl)C[C@H](C2CC2)O1 ZINC001193976906 1049292217 /nfs/dbraw/zinc/29/22/17/1049292217.db2.gz NBFRJLFEGDDBQN-MEDUHNTESA-N 1 2 314.256 4.035 20 0 DIADLO C[C@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)C[C@H](C2CC2)O1 ZINC001193976906 1049292228 /nfs/dbraw/zinc/29/22/28/1049292228.db2.gz NBFRJLFEGDDBQN-MEDUHNTESA-N 1 2 314.256 4.035 20 0 DIADLO c1cn2cc(-c3cccc4c3cnn4[C@@H]3CCCCO3)ccc2[nH+]1 ZINC001204882423 1049298177 /nfs/dbraw/zinc/29/81/77/1049298177.db2.gz PHZQAKBDRDLWOR-IBGZPJMESA-N 1 2 318.380 4.050 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(Oc3ccccc3)o2)C[C@@H](C)O1 ZINC001204898930 1049303220 /nfs/dbraw/zinc/30/32/20/1049303220.db2.gz NIUFUMVMHLAOFJ-HUUCEWRRSA-N 1 2 301.386 4.071 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)o2)C[C@@H](C)O1 ZINC001204898930 1049303232 /nfs/dbraw/zinc/30/32/32/1049303232.db2.gz NIUFUMVMHLAOFJ-HUUCEWRRSA-N 1 2 301.386 4.071 20 0 DIADLO Cc1cn2cc(-c3ccccc3OC[C@@H]3CCOC3)cc(C)c2[nH+]1 ZINC000906162453 1049304467 /nfs/dbraw/zinc/30/44/67/1049304467.db2.gz RDLGLEHSFUIVEG-MRXNPFEDSA-N 1 2 322.408 4.033 20 0 DIADLO C[N@H+](Cc1cc[nH]n1)Cc1ccc(-c2ccccc2)c(Cl)c1 ZINC001204914952 1049308160 /nfs/dbraw/zinc/30/81/60/1049308160.db2.gz HXKXEILKCXANMK-UHFFFAOYSA-N 1 2 311.816 4.362 20 0 DIADLO C[N@@H+](Cc1cc[nH]n1)Cc1ccc(-c2ccccc2)c(Cl)c1 ZINC001204914952 1049308171 /nfs/dbraw/zinc/30/81/71/1049308171.db2.gz HXKXEILKCXANMK-UHFFFAOYSA-N 1 2 311.816 4.362 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2ccnc(F)c2)C2CC2)o1 ZINC000859053272 1049308826 /nfs/dbraw/zinc/30/88/26/1049308826.db2.gz ZXVTZBRLPDDBHN-MLGOLLRUSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2ccnc(F)c2)C2CC2)o1 ZINC000859053272 1049308836 /nfs/dbraw/zinc/30/88/36/1049308836.db2.gz ZXVTZBRLPDDBHN-MLGOLLRUSA-N 1 2 300.377 4.102 20 0 DIADLO Cc1cccc(C[C@@H](C)[NH2+]c2ccc(N3CCOCC3)c(C)c2)c1 ZINC001204937112 1049315196 /nfs/dbraw/zinc/31/51/96/1049315196.db2.gz GGRWXUGTNOOWKL-GOSISDBHSA-N 1 2 324.468 4.183 20 0 DIADLO c1cn2ccc(Nc3ncccc3OCc3ccccc3)cc2[nH+]1 ZINC001204943793 1049317583 /nfs/dbraw/zinc/31/75/83/1049317583.db2.gz PIGCQVDTDMYKDQ-UHFFFAOYSA-N 1 2 316.364 4.052 20 0 DIADLO Cc1cc(Nc2ccn3cc[nH+]c3c2)n(-c2ccccc2Cl)n1 ZINC001204951044 1049319146 /nfs/dbraw/zinc/31/91/46/1049319146.db2.gz MGDTUAYVPIPOBU-UHFFFAOYSA-N 1 2 323.787 4.225 20 0 DIADLO Fc1cccc(C=C2CC[NH+](Cc3ccnc(F)c3)CC2)c1 ZINC000859199648 1049320587 /nfs/dbraw/zinc/32/05/87/1049320587.db2.gz SNCOAOJQJSBDDA-UHFFFAOYSA-N 1 2 300.352 4.039 20 0 DIADLO Fc1cc(Cl)cc(C[NH2+]Cc2cc(-c3ccccc3)on2)c1 ZINC000485700389 1049321341 /nfs/dbraw/zinc/32/13/41/1049321341.db2.gz XQNSQFSACAPDSR-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO Clc1cc(Cl)c(Nc2ccn3cc[nH+]c3c2)nc1Cl ZINC001204965845 1049326326 /nfs/dbraw/zinc/32/63/26/1049326326.db2.gz IHCIMNOJXHKLDW-UHFFFAOYSA-N 1 2 313.575 4.433 20 0 DIADLO CC[C@@H](Cc1ccccc1)[NH2+]c1ccc(N2CCOCC2)c(C)c1 ZINC001180301711 1049328241 /nfs/dbraw/zinc/32/82/41/1049328241.db2.gz QQMITADOGKLOPS-IBGZPJMESA-N 1 2 324.468 4.265 20 0 DIADLO COc1cc(Nc2ccn3cc[nH+]c3c2)ccc1C(F)(F)F ZINC001204978282 1049329147 /nfs/dbraw/zinc/32/91/47/1049329147.db2.gz RTIBUFVYNRBCLC-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO CCOC(=O)c1cc2cc(Nc3ccn4cc[nH+]c4c3)ccc2o1 ZINC001204977731 1049329435 /nfs/dbraw/zinc/32/94/35/1049329435.db2.gz JWUZUURTMURPEP-UHFFFAOYSA-N 1 2 321.336 4.001 20 0 DIADLO Cc1c(Br)cccc1Nc1ccn2cc[nH+]c2c1 ZINC001204978537 1049330714 /nfs/dbraw/zinc/33/07/14/1049330714.db2.gz UUBAUPZKMBJSPR-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO C[C@@H]1C[NH+](Cc2nc(Cl)ccc2Cl)C[C@@H](C)C1(F)F ZINC000859415648 1049331514 /nfs/dbraw/zinc/33/15/14/1049331514.db2.gz SVIVTNLMZYIOED-RKDXNWHRSA-N 1 2 309.187 4.112 20 0 DIADLO Clc1nc2cc(Nc3ccn4cc[nH+]c4c3)ccc2s1 ZINC001204983386 1049331745 /nfs/dbraw/zinc/33/17/45/1049331745.db2.gz ULXFKCCZZFEXMR-UHFFFAOYSA-N 1 2 300.774 4.341 20 0 DIADLO C[C@H]1C[NH+](Cc2ccc(Cl)nc2Cl)C[C@H](C)C1(F)F ZINC000859413775 1049331883 /nfs/dbraw/zinc/33/18/83/1049331883.db2.gz BRQAPZQMEVTWGB-IUCAKERBSA-N 1 2 309.187 4.112 20 0 DIADLO FC(F)(F)COc1ccc(Nc2ccn3cc[nH+]c3c2)cc1 ZINC001204990608 1049333083 /nfs/dbraw/zinc/33/30/83/1049333083.db2.gz BSJSTUCWKZXWJV-UHFFFAOYSA-N 1 2 307.275 4.019 20 0 DIADLO CC[C@H](c1ccc(Br)cc1)[N@@H+]1CCO[C@@H](C2CC2)C1 ZINC000485793164 1049338705 /nfs/dbraw/zinc/33/87/05/1049338705.db2.gz MQTJZNHPELNMCZ-HZPDHXFCSA-N 1 2 324.262 4.011 20 0 DIADLO CC[C@H](c1ccc(Br)cc1)[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000485793164 1049338714 /nfs/dbraw/zinc/33/87/14/1049338714.db2.gz MQTJZNHPELNMCZ-HZPDHXFCSA-N 1 2 324.262 4.011 20 0 DIADLO Fc1ccc(Br)c(Nc2ccn3cc[nH+]c3c2)c1F ZINC001205005837 1049339871 /nfs/dbraw/zinc/33/98/71/1049339871.db2.gz MCLMBVKXLAXQFZ-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO C[C@@]1(c2ccccc2)CCC[N@H+](CC(F)(F)C(F)F)CC1 ZINC001194262815 1049352312 /nfs/dbraw/zinc/35/23/12/1049352312.db2.gz RZPRBXLHIRDEAA-OAHLLOKOSA-N 1 2 303.343 4.331 20 0 DIADLO C[C@@]1(c2ccccc2)CCC[N@@H+](CC(F)(F)C(F)F)CC1 ZINC001194262815 1049352326 /nfs/dbraw/zinc/35/23/26/1049352326.db2.gz RZPRBXLHIRDEAA-OAHLLOKOSA-N 1 2 303.343 4.331 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@H+]([C@H](C)c1nc(C(C)(C)C)no1)CC2 ZINC000485876903 1049358403 /nfs/dbraw/zinc/35/84/03/1049358403.db2.gz PSYCCRDKUOZHSV-CQSZACIVSA-N 1 2 313.445 4.103 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@@H+]([C@H](C)c1nc(C(C)(C)C)no1)CC2 ZINC000485876903 1049358415 /nfs/dbraw/zinc/35/84/15/1049358415.db2.gz PSYCCRDKUOZHSV-CQSZACIVSA-N 1 2 313.445 4.103 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1CCCCC[C@H]1c1ccncc1 ZINC001180488403 1049363928 /nfs/dbraw/zinc/36/39/28/1049363928.db2.gz LWCYISWYRGHDJF-HNNXBMFYSA-N 1 2 318.852 4.069 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1CCCCC[C@H]1c1ccncc1 ZINC001180488403 1049363940 /nfs/dbraw/zinc/36/39/40/1049363940.db2.gz LWCYISWYRGHDJF-HNNXBMFYSA-N 1 2 318.852 4.069 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccccc2Br)cc(C)n1 ZINC001180488621 1049364516 /nfs/dbraw/zinc/36/45/16/1049364516.db2.gz RIGSAFRARPFEAS-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccccc2Br)cc(C)n1 ZINC001180488621 1049364524 /nfs/dbraw/zinc/36/45/24/1049364524.db2.gz RIGSAFRARPFEAS-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO C[C@H]([NH2+]Cc1csc(Cc2ccccc2)n1)c1ccns1 ZINC000860052524 1049366588 /nfs/dbraw/zinc/36/65/88/1049366588.db2.gz AUGJXZWQAHXQMF-LBPRGKRZSA-N 1 2 315.467 4.041 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3ccns3)cs2)o1 ZINC000860053296 1049367153 /nfs/dbraw/zinc/36/71/53/1049367153.db2.gz UXIPRBKMMOZDNC-SNVBAGLBSA-N 1 2 305.428 4.019 20 0 DIADLO Cc1cccc(C[N@@H+]2Cc3cnc(-c4ccccc4)nc3C2)c1C ZINC001205095282 1049372975 /nfs/dbraw/zinc/37/29/75/1049372975.db2.gz AJKJCHHPAXRQRP-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1cccc(C[N@H+]2Cc3cnc(-c4ccccc4)nc3C2)c1C ZINC001205095282 1049372990 /nfs/dbraw/zinc/37/29/90/1049372990.db2.gz AJKJCHHPAXRQRP-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[NH+]1CCC2(CCCC2)CC1 ZINC001194600805 1049397843 /nfs/dbraw/zinc/39/78/43/1049397843.db2.gz YLMYALXBSBRCKH-INIZCTEOSA-N 1 2 321.848 4.210 20 0 DIADLO Fc1ccc2ccc(C[N@@H+]3CCc4sccc4C3)nc2c1F ZINC001205171186 1049401816 /nfs/dbraw/zinc/40/18/16/1049401816.db2.gz WYGUOSNSBGVXOU-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO Fc1ccc2ccc(C[N@H+]3CCc4sccc4C3)nc2c1F ZINC001205171186 1049401828 /nfs/dbraw/zinc/40/18/28/1049401828.db2.gz WYGUOSNSBGVXOU-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO Cc1oc2ccccc2c1C[NH2+][C@H]1COc2cc(F)cc(F)c21 ZINC001180820634 1049406298 /nfs/dbraw/zinc/40/62/98/1049406298.db2.gz PRWQIEHCMFSJIC-HNNXBMFYSA-N 1 2 315.319 4.243 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc(F)c(Cl)c1)CC2 ZINC001204283110 1049415631 /nfs/dbraw/zinc/41/56/31/1049415631.db2.gz ZFTODZXLZJPAEL-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc(F)c(Cl)c1)CC2 ZINC001204283110 1049415637 /nfs/dbraw/zinc/41/56/37/1049415637.db2.gz ZFTODZXLZJPAEL-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COCc1ccc(C[N@@H+]2CCc3c(Cl)cc(F)cc3C2)cc1 ZINC001194754643 1049424819 /nfs/dbraw/zinc/42/48/19/1049424819.db2.gz HWYDZRPQQBJTIZ-UHFFFAOYSA-N 1 2 319.807 4.184 20 0 DIADLO COCc1ccc(C[N@H+]2CCc3c(Cl)cc(F)cc3C2)cc1 ZINC001194754643 1049424821 /nfs/dbraw/zinc/42/48/21/1049424821.db2.gz HWYDZRPQQBJTIZ-UHFFFAOYSA-N 1 2 319.807 4.184 20 0 DIADLO CC[C@H](CC1CCCCC1)[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC001205320991 1049437910 /nfs/dbraw/zinc/43/79/10/1049437910.db2.gz XPPURWTVBJDPRG-MSOLQXFVSA-N 1 2 312.461 4.233 20 0 DIADLO CC[C@@H](CC1CCCCC1)[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC001205321083 1049438004 /nfs/dbraw/zinc/43/80/04/1049438004.db2.gz XPPURWTVBJDPRG-ROUUACIJSA-N 1 2 312.461 4.233 20 0 DIADLO Cc1[nH]c(CNc2ccc(COc3ccccc3)cc2)[nH+]c1C ZINC001205373953 1049453829 /nfs/dbraw/zinc/45/38/29/1049453829.db2.gz ONLPSGFZZVSXGC-UHFFFAOYSA-N 1 2 307.397 4.218 20 0 DIADLO CCCn1c[nH+]cc1CNc1cccc(Oc2ccccn2)c1 ZINC001205374002 1049453901 /nfs/dbraw/zinc/45/39/01/1049453901.db2.gz QATJPZPTFORNPR-UHFFFAOYSA-N 1 2 308.385 4.093 20 0 DIADLO C[N@H+](CC(=O)OC(C)(C)C)Cc1cccc(C2CCCC2)c1 ZINC001181256522 1049461563 /nfs/dbraw/zinc/46/15/63/1049461563.db2.gz QCRBTCOIJHYMQK-UHFFFAOYSA-N 1 2 303.446 4.118 20 0 DIADLO C[N@@H+](CC(=O)OC(C)(C)C)Cc1cccc(C2CCCC2)c1 ZINC001181256522 1049461568 /nfs/dbraw/zinc/46/15/68/1049461568.db2.gz QCRBTCOIJHYMQK-UHFFFAOYSA-N 1 2 303.446 4.118 20 0 DIADLO COc1cccc([C@H](C)[N@@H+]2CCc3ccc(F)c(F)c3C2)c1 ZINC000486788070 1049469796 /nfs/dbraw/zinc/46/97/96/1049469796.db2.gz NUEJSOBHYFOCOK-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cccc([C@H](C)[N@H+]2CCc3ccc(F)c(F)c3C2)c1 ZINC000486788070 1049469799 /nfs/dbraw/zinc/46/97/99/1049469799.db2.gz NUEJSOBHYFOCOK-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1c(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)ccnc1F ZINC000862245520 1049480726 /nfs/dbraw/zinc/48/07/26/1049480726.db2.gz REGUQXHDYCLDBT-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1c(C[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)ccnc1F ZINC000862245520 1049480733 /nfs/dbraw/zinc/48/07/33/1049480733.db2.gz REGUQXHDYCLDBT-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2cnc(C3CC3)o2)cc1F ZINC000862245792 1049481077 /nfs/dbraw/zinc/48/10/77/1049481077.db2.gz XVOJKKSKNCNTNL-INIZCTEOSA-N 1 2 304.340 4.167 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2cnc(C3CC3)o2)cc1F ZINC000862245792 1049481082 /nfs/dbraw/zinc/48/10/82/1049481082.db2.gz XVOJKKSKNCNTNL-INIZCTEOSA-N 1 2 304.340 4.167 20 0 DIADLO Cc1scc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3F)C2)c1C ZINC001205475771 1049481403 /nfs/dbraw/zinc/48/14/03/1049481403.db2.gz WEXAAOKXVLRPJG-KRWDZBQOSA-N 1 2 323.408 4.217 20 0 DIADLO Cc1scc(C[N@H+]2CCO[C@H](c3ccc(F)cc3F)C2)c1C ZINC001205475771 1049481408 /nfs/dbraw/zinc/48/14/08/1049481408.db2.gz WEXAAOKXVLRPJG-KRWDZBQOSA-N 1 2 323.408 4.217 20 0 DIADLO Clc1ccccc1CC1C[NH+](Cc2nc3ccccc3o2)C1 ZINC001181543691 1049489296 /nfs/dbraw/zinc/48/92/96/1049489296.db2.gz HVLLODIGQBKYOL-UHFFFAOYSA-N 1 2 312.800 4.156 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)c1Cl ZINC000862402612 1049492827 /nfs/dbraw/zinc/49/28/27/1049492827.db2.gz JFFUYZKWVXKYNF-CYBMUJFWSA-N 1 2 307.718 4.239 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)c1Cl ZINC000862402612 1049492831 /nfs/dbraw/zinc/49/28/31/1049492831.db2.gz JFFUYZKWVXKYNF-CYBMUJFWSA-N 1 2 307.718 4.239 20 0 DIADLO Clc1scc(C[NH+]2CCC(c3ccon3)CC2)c1Cl ZINC000668717439 1049497152 /nfs/dbraw/zinc/49/71/52/1049497152.db2.gz BKNAPYUHRBRPJB-UHFFFAOYSA-N 1 2 317.241 4.423 20 0 DIADLO CC(C)n1c[nH+]cc1CN1CC[C@H](C)Sc2ccccc21 ZINC001181728417 1049506958 /nfs/dbraw/zinc/50/69/58/1049506958.db2.gz CYSMVNVSZJQRSB-AWEZNQCLSA-N 1 2 301.459 4.355 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)o1 ZINC000173474246 1049507462 /nfs/dbraw/zinc/50/74/62/1049507462.db2.gz WGCQWXAJOGTAHV-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)o1 ZINC000173474246 1049507469 /nfs/dbraw/zinc/50/74/69/1049507469.db2.gz WGCQWXAJOGTAHV-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO C[C@H](CC1CCCC1)Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001205601533 1049508915 /nfs/dbraw/zinc/50/89/15/1049508915.db2.gz XJFYAWPNNYZIBH-OAGGEKHMSA-N 1 2 317.477 4.076 20 0 DIADLO Cn1cc(C[N@H+]2CC=C(c3cccc(Cl)c3)CC2)c(Cl)n1 ZINC001205614255 1049512263 /nfs/dbraw/zinc/51/22/63/1049512263.db2.gz CWCHYQQGIBZORL-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1cc(C[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)c(Cl)n1 ZINC001205614255 1049512273 /nfs/dbraw/zinc/51/22/73/1049512273.db2.gz CWCHYQQGIBZORL-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO C[C@@H]1CCC[C@H]([NH2+]c2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC001205619789 1049513651 /nfs/dbraw/zinc/51/36/51/1049513651.db2.gz AXGSOLZSRNAMRI-CBZIJGRNSA-N 1 2 302.462 4.291 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCC[C@H](C)C3)cc2)C[C@H](C)O1 ZINC001205619793 1049515065 /nfs/dbraw/zinc/51/50/65/1049515065.db2.gz AXGSOLZSRNAMRI-LISAXSMJSA-N 1 2 302.462 4.291 20 0 DIADLO C[C@@]12c3ccccc3[C@@H](Cc3ccccc31)[N@H+]2Cc1cnoc1 ZINC001205724216 1049543002 /nfs/dbraw/zinc/54/30/02/1049543002.db2.gz JWBCRHDVVZTKBE-UXHICEINSA-N 1 2 302.377 4.051 20 0 DIADLO C[C@@]12c3ccccc3[C@@H](Cc3ccccc31)[N@@H+]2Cc1cnoc1 ZINC001205724216 1049543018 /nfs/dbraw/zinc/54/30/18/1049543018.db2.gz JWBCRHDVVZTKBE-UXHICEINSA-N 1 2 302.377 4.051 20 0 DIADLO CC[C@H](C)[C@H](C[NH2+]CC(F)(F)c1ccc(Cl)cc1)OC ZINC001205735357 1049546940 /nfs/dbraw/zinc/54/69/40/1049546940.db2.gz JNTRBEDIOBSVAA-FZMZJTMJSA-N 1 2 305.796 4.083 20 0 DIADLO Cc1cc(Nc2ccc(C)[nH+]c2C)n(Cc2ccccc2F)n1 ZINC001203368622 1049553668 /nfs/dbraw/zinc/55/36/68/1049553668.db2.gz BLMFXZQWMANXPD-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO COc1ccccc1[C@H]([NH2+]C/C=C\c1ccncc1)c1ccco1 ZINC000487326792 1049554504 /nfs/dbraw/zinc/55/45/04/1049554504.db2.gz SHNGCGODMUXQEA-MNBNYPOFSA-N 1 2 320.392 4.076 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@@H+]1Cc1cnoc1 ZINC001205764089 1049557133 /nfs/dbraw/zinc/55/71/33/1049557133.db2.gz ZCHJYAYNLUJKRN-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@H+]1Cc1cnoc1 ZINC001205764089 1049557143 /nfs/dbraw/zinc/55/71/43/1049557143.db2.gz ZCHJYAYNLUJKRN-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@@H+]1Cc1cnoc1 ZINC001205764092 1049557381 /nfs/dbraw/zinc/55/73/81/1049557381.db2.gz ZCHJYAYNLUJKRN-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1ccccc1[C@H]1CCCC[N@H+]1Cc1cnoc1 ZINC001205764092 1049557393 /nfs/dbraw/zinc/55/73/93/1049557393.db2.gz ZCHJYAYNLUJKRN-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO Cc1ccc(C[S@](=O)c2cccc(C(F)(F)F)c2)c(C)[nH+]1 ZINC000773972894 1049567221 /nfs/dbraw/zinc/56/72/21/1049567221.db2.gz PQAPPVONGZQFCF-NRFANRHFSA-N 1 2 313.344 4.025 20 0 DIADLO CCOc1c(F)c(F)ccc1-c1ccccc1Cn1cc[nH+]c1 ZINC001205809946 1049569578 /nfs/dbraw/zinc/56/95/78/1049569578.db2.gz AHRNRLOCDDXPGY-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO CC[NH+](CC)[C@H](C(=O)NC(C)(C)C1CC1)c1ccccc1Cl ZINC001182225992 1049593841 /nfs/dbraw/zinc/59/38/41/1049593841.db2.gz ZATARKKYDLOBQY-INIZCTEOSA-N 1 2 322.880 4.028 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@H]2c2ccc(F)cc2)cc1Cl ZINC001195954494 1049599660 /nfs/dbraw/zinc/59/96/60/1049599660.db2.gz KHJKWXJDVQBJCM-INIZCTEOSA-N 1 2 305.780 4.435 20 0 DIADLO COc1ccc(C[N@H+]2CC[C@H]2c2ccc(F)cc2)cc1Cl ZINC001195954494 1049599674 /nfs/dbraw/zinc/59/96/74/1049599674.db2.gz KHJKWXJDVQBJCM-INIZCTEOSA-N 1 2 305.780 4.435 20 0 DIADLO Cc1ccc(CNc2[nH+]cnc3[nH]c4cc(F)ccc4c32)cc1F ZINC000863999587 1049611585 /nfs/dbraw/zinc/61/15/85/1049611585.db2.gz FPHGTDKMTINUGK-UHFFFAOYSA-N 1 2 324.334 4.310 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2nc3c(s2)CCC3)cc1F ZINC000775697059 1049630283 /nfs/dbraw/zinc/63/02/83/1049630283.db2.gz SWWAMSXHWPZUJC-HNNXBMFYSA-N 1 2 320.408 4.247 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2nc3c(s2)CCC3)cc1F ZINC000775697059 1049630287 /nfs/dbraw/zinc/63/02/87/1049630287.db2.gz SWWAMSXHWPZUJC-HNNXBMFYSA-N 1 2 320.408 4.247 20 0 DIADLO Fc1ccc(Cl)cc1C[N@@H+]1CC[C@H]1COCc1ccccc1 ZINC001206020009 1049630799 /nfs/dbraw/zinc/63/07/99/1049630799.db2.gz DHOSMTIPNOKTSB-KRWDZBQOSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1ccc(Cl)cc1C[N@H+]1CC[C@H]1COCc1ccccc1 ZINC001206020009 1049630800 /nfs/dbraw/zinc/63/08/00/1049630800.db2.gz DHOSMTIPNOKTSB-KRWDZBQOSA-N 1 2 319.807 4.270 20 0 DIADLO O=c1[nH]cc(C[NH2+][C@H](C(F)F)C2CCCCC2)c2ccccc12 ZINC001196264754 1049635965 /nfs/dbraw/zinc/63/59/65/1049635965.db2.gz YYCXVYMPUPWPSX-INIZCTEOSA-N 1 2 320.383 4.244 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1)[C@@H](C)c1nc(C(C)C)no1 ZINC000488348476 1049639402 /nfs/dbraw/zinc/63/94/02/1049639402.db2.gz WESGUZXNICWSFX-LBPRGKRZSA-N 1 2 307.825 4.430 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)cc1)[C@@H](C)c1nc(C(C)C)no1 ZINC000488348476 1049639406 /nfs/dbraw/zinc/63/94/06/1049639406.db2.gz WESGUZXNICWSFX-LBPRGKRZSA-N 1 2 307.825 4.430 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSc1nccn1C1CC1 ZINC000794425421 1049652633 /nfs/dbraw/zinc/65/26/33/1049652633.db2.gz WXOWZOTUZDEFOD-UHFFFAOYSA-N 1 2 310.426 4.004 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nnc([C@@H](C)CC)[nH]1)c1ccccc1OC ZINC000488481784 1049661549 /nfs/dbraw/zinc/66/15/49/1049661549.db2.gz UAJUCVUNRLMHBP-GZBFAFLISA-N 1 2 316.449 4.129 20 0 DIADLO C[C@@H]1CCc2nc(C[N@@H+]3CCc4sccc4[C@@H]3C)sc2C1 ZINC001206128766 1049662604 /nfs/dbraw/zinc/66/26/04/1049662604.db2.gz ZYZBGGYEMUUPLD-NEPJUHHUSA-N 1 2 318.511 4.449 20 0 DIADLO C[C@@H]1CCc2nc(C[N@H+]3CCc4sccc4[C@@H]3C)sc2C1 ZINC001206128766 1049662608 /nfs/dbraw/zinc/66/26/08/1049662608.db2.gz ZYZBGGYEMUUPLD-NEPJUHHUSA-N 1 2 318.511 4.449 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+][C@H](C)c1nnc([C@H](C)CC)[nH]1 ZINC000488501984 1049662828 /nfs/dbraw/zinc/66/28/28/1049662828.db2.gz MCNFAAKVSNXJGN-HZSPNIEDSA-N 1 2 316.449 4.129 20 0 DIADLO Fc1ccc2c(c1)OCC[N@@H+](CCc1c(F)cccc1Cl)C2 ZINC001196606804 1049674195 /nfs/dbraw/zinc/67/41/95/1049674195.db2.gz YCHIURCHBKDRND-UHFFFAOYSA-N 1 2 323.770 4.055 20 0 DIADLO Fc1ccc2c(c1)OCC[N@H+](CCc1c(F)cccc1Cl)C2 ZINC001196606804 1049674211 /nfs/dbraw/zinc/67/42/11/1049674211.db2.gz YCHIURCHBKDRND-UHFFFAOYSA-N 1 2 323.770 4.055 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccc(-c2cccc(C)c2)cn1 ZINC001203188870 1049680866 /nfs/dbraw/zinc/68/08/66/1049680866.db2.gz ZRMKTTWFGVRSEM-UHFFFAOYSA-N 1 2 306.413 4.276 20 0 DIADLO Cn1cnc(C[N@@H+]2CCCC[C@H]2c2ccccc2C(F)(F)F)c1 ZINC001206257033 1049690997 /nfs/dbraw/zinc/69/09/97/1049690997.db2.gz MJOWBWYVYBZJBL-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1cnc(C[N@H+]2CCCC[C@H]2c2ccccc2C(F)(F)F)c1 ZINC001206257033 1049691005 /nfs/dbraw/zinc/69/10/05/1049691005.db2.gz MJOWBWYVYBZJBL-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Cc1ccc(C[S@](=O)[C@H]2CCc3cc(Cl)ccc32)c(C)[nH+]1 ZINC000794782603 1049692492 /nfs/dbraw/zinc/69/24/92/1049692492.db2.gz YTDSYGCILOJDPO-UWJYYQICSA-N 1 2 319.857 4.288 20 0 DIADLO CC[N@H+](Cc1occc1C)Cc1cc(OC)c(OC)cc1Cl ZINC001206321591 1049711980 /nfs/dbraw/zinc/71/19/80/1049711980.db2.gz URVZZVAYYCUNDA-UHFFFAOYSA-N 1 2 323.820 4.281 20 0 DIADLO CC[N@@H+](Cc1occc1C)Cc1cc(OC)c(OC)cc1Cl ZINC001206321591 1049711996 /nfs/dbraw/zinc/71/19/96/1049711996.db2.gz URVZZVAYYCUNDA-UHFFFAOYSA-N 1 2 323.820 4.281 20 0 DIADLO Cc1c(Cl)cccc1C[N@@H+]1[C@H](C)CC[C@@H]1C(=O)OC(C)(C)C ZINC001182764873 1049712979 /nfs/dbraw/zinc/71/29/79/1049712979.db2.gz QUGZNZNPXSJDCH-MLGOLLRUSA-N 1 2 323.864 4.343 20 0 DIADLO Cc1c(Cl)cccc1C[N@H+]1[C@H](C)CC[C@@H]1C(=O)OC(C)(C)C ZINC001182764873 1049712990 /nfs/dbraw/zinc/71/29/90/1049712990.db2.gz QUGZNZNPXSJDCH-MLGOLLRUSA-N 1 2 323.864 4.343 20 0 DIADLO CC(C)[N@H+](Cc1ccnn1C)Cc1ccc(Cl)cc1Cl ZINC001206365114 1049721257 /nfs/dbraw/zinc/72/12/57/1049721257.db2.gz IYDSNLZRPUSGJX-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO CC(C)[N@@H+](Cc1ccnn1C)Cc1ccc(Cl)cc1Cl ZINC001206365114 1049721263 /nfs/dbraw/zinc/72/12/63/1049721263.db2.gz IYDSNLZRPUSGJX-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2o1)c1cc2cnccc2o1 ZINC001197229099 1049730298 /nfs/dbraw/zinc/73/02/98/1049730298.db2.gz BLJKZGCMWKEEDW-NEPJUHHUSA-N 1 2 307.353 4.381 20 0 DIADLO CC(C)(C)[C@H]1CSCC[N@@H+]1Cc1cc(Cl)nc(Cl)c1 ZINC001197295368 1049734956 /nfs/dbraw/zinc/73/49/56/1049734956.db2.gz FYOYZHQYCLARGZ-LLVKDONJSA-N 1 2 319.301 4.352 20 0 DIADLO CC(C)(C)[C@H]1CSCC[N@H+]1Cc1cc(Cl)nc(Cl)c1 ZINC001197295368 1049734961 /nfs/dbraw/zinc/73/49/61/1049734961.db2.gz FYOYZHQYCLARGZ-LLVKDONJSA-N 1 2 319.301 4.352 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2C[C@H](C)OC3(CCCCC3)C2)s1 ZINC001206491311 1049742683 /nfs/dbraw/zinc/74/26/83/1049742683.db2.gz UEAISPIADVVLFD-AWEZNQCLSA-N 1 2 308.491 4.190 20 0 DIADLO CC(C)c1cnc(C[N@H+]2C[C@H](C)OC3(CCCCC3)C2)s1 ZINC001206491311 1049742690 /nfs/dbraw/zinc/74/26/90/1049742690.db2.gz UEAISPIADVVLFD-AWEZNQCLSA-N 1 2 308.491 4.190 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(Oc3ccccc3)o2)[C@H](C)CO1 ZINC001206523317 1049749630 /nfs/dbraw/zinc/74/96/30/1049749630.db2.gz JHJZCUCLTXULQU-HUUCEWRRSA-N 1 2 301.386 4.071 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)o2)[C@H](C)CO1 ZINC001206523317 1049749637 /nfs/dbraw/zinc/74/96/37/1049749637.db2.gz JHJZCUCLTXULQU-HUUCEWRRSA-N 1 2 301.386 4.071 20 0 DIADLO Cc1ccc(OCc2nc(C[N@@H+](C)[C@@H]3CC3(C)C)cs2)cc1 ZINC000489451789 1049758705 /nfs/dbraw/zinc/75/87/05/1049758705.db2.gz ZJFKDRDOFPZALA-MRXNPFEDSA-N 1 2 316.470 4.261 20 0 DIADLO Cc1ccc(OCc2nc(C[N@H+](C)[C@@H]3CC3(C)C)cs2)cc1 ZINC000489451789 1049758711 /nfs/dbraw/zinc/75/87/11/1049758711.db2.gz ZJFKDRDOFPZALA-MRXNPFEDSA-N 1 2 316.470 4.261 20 0 DIADLO c1cn2cccc(-c3ccc4cnn([C@@H]5CCCCO5)c4c3)c2[nH+]1 ZINC001206643769 1049774856 /nfs/dbraw/zinc/77/48/56/1049774856.db2.gz ZJVSGIYXGGEKQY-SFHVURJKSA-N 1 2 318.380 4.050 20 0 DIADLO c1cn2ccc(-c3ccc4cnn([C@H]5CCCCO5)c4c3)cc2[nH+]1 ZINC001206642777 1049775255 /nfs/dbraw/zinc/77/52/55/1049775255.db2.gz JYAZOKWNCOBTJR-LJQANCHMSA-N 1 2 318.380 4.050 20 0 DIADLO CC[N@H+](Cc1cnn(C)c1)[C@@H](C)c1cc(Cl)ccc1Cl ZINC000489682307 1049776974 /nfs/dbraw/zinc/77/69/74/1049776974.db2.gz WANOIMOCPIPBNU-NSHDSACASA-N 1 2 312.244 4.310 20 0 DIADLO CC[N@@H+](Cc1cnn(C)c1)[C@@H](C)c1cc(Cl)ccc1Cl ZINC000489682307 1049776981 /nfs/dbraw/zinc/77/69/81/1049776981.db2.gz WANOIMOCPIPBNU-NSHDSACASA-N 1 2 312.244 4.310 20 0 DIADLO CSc1ccccc1-c1ccc(C[NH+]2CCOCC2)cc1F ZINC001206704266 1049782275 /nfs/dbraw/zinc/78/22/75/1049782275.db2.gz URWCDSDIAYJXQJ-UHFFFAOYSA-N 1 2 317.429 4.047 20 0 DIADLO Fc1cc(C[NH+]2CCOCC2)ccc1-c1cccc2ccoc21 ZINC001206712322 1049782462 /nfs/dbraw/zinc/78/24/62/1049782462.db2.gz IKYFOLZNFWSLOE-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO Cc1c(F)ccc(-c2ccc(C[NH+]3CCOCC3)cc2F)c1C ZINC001206720121 1049783049 /nfs/dbraw/zinc/78/30/49/1049783049.db2.gz ZFYOSTCYJWCAFU-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO Cc1cc(-c2ccc(C[NH+]3CCOCC3)cc2F)cc2[nH]ccc21 ZINC001206734250 1049786686 /nfs/dbraw/zinc/78/66/86/1049786686.db2.gz YPHAISBMYLOYMU-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO CC(C)c1cc(N2CCC[C@H](OCC3CC3)C2)nc(C(C)C)[nH+]1 ZINC000489945836 1049793015 /nfs/dbraw/zinc/79/30/15/1049793015.db2.gz KEAZAFHTYATOQT-INIZCTEOSA-N 1 2 317.477 4.119 20 0 DIADLO OCc1ccc(C[N@@H+]2CCc3cc(Cl)cc(Cl)c3C2)cc1 ZINC000490087521 1049801790 /nfs/dbraw/zinc/80/17/90/1049801790.db2.gz JKSUMZRYIOTEGE-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO OCc1ccc(C[N@H+]2CCc3cc(Cl)cc(Cl)c3C2)cc1 ZINC000490087521 1049801801 /nfs/dbraw/zinc/80/18/01/1049801801.db2.gz JKSUMZRYIOTEGE-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO Fc1ccc(-c2cc(C[N@@H+]3CC[C@H]3c3ccccc3)no2)cc1 ZINC001206835807 1049811404 /nfs/dbraw/zinc/81/14/04/1049811404.db2.gz CULUUAKDZWFGPG-SFHVURJKSA-N 1 2 308.356 4.428 20 0 DIADLO Fc1ccc(-c2cc(C[N@H+]3CC[C@H]3c3ccccc3)no2)cc1 ZINC001206835807 1049811416 /nfs/dbraw/zinc/81/14/16/1049811416.db2.gz CULUUAKDZWFGPG-SFHVURJKSA-N 1 2 308.356 4.428 20 0 DIADLO C[N@H+](CCC(=O)c1ccccc1)Cc1cc(-c2ccccc2)on1 ZINC001206845719 1049813522 /nfs/dbraw/zinc/81/35/22/1049813522.db2.gz FRJJNILDEFMEIV-UHFFFAOYSA-N 1 2 320.392 4.046 20 0 DIADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1cc(-c2ccccc2)on1 ZINC001206845719 1049813533 /nfs/dbraw/zinc/81/35/33/1049813533.db2.gz FRJJNILDEFMEIV-UHFFFAOYSA-N 1 2 320.392 4.046 20 0 DIADLO Fc1cncc(F)c1C[N@@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC001206862608 1049814855 /nfs/dbraw/zinc/81/48/55/1049814855.db2.gz NPYNBZFEMCUQCR-LBPRGKRZSA-N 1 2 308.759 4.003 20 0 DIADLO Fc1cncc(F)c1C[N@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC001206862608 1049814861 /nfs/dbraw/zinc/81/48/61/1049814861.db2.gz NPYNBZFEMCUQCR-LBPRGKRZSA-N 1 2 308.759 4.003 20 0 DIADLO CC[C@@H]1CCCC[C@H]1C[NH2+][C@](CC)(C(=O)OC)c1ccccc1 ZINC001207049640 1049824718 /nfs/dbraw/zinc/82/47/18/1049824718.db2.gz MASKFZVRXNACMW-UWVAXJGDSA-N 1 2 317.473 4.271 20 0 DIADLO COc1cccc([C@H]2CCCC[N@@H+]2Cc2ncc(F)cc2F)c1 ZINC001207097457 1049835540 /nfs/dbraw/zinc/83/55/40/1049835540.db2.gz QSUUJSLYXLOJDW-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cccc([C@H]2CCCC[N@H+]2Cc2ncc(F)cc2F)c1 ZINC001207097457 1049835550 /nfs/dbraw/zinc/83/55/50/1049835550.db2.gz QSUUJSLYXLOJDW-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO Fc1cccc(OC(F)F)c1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC001207111672 1049838740 /nfs/dbraw/zinc/83/87/40/1049838740.db2.gz LZLNEPJZHRATCW-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(OC(F)F)c1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC001207111672 1049838769 /nfs/dbraw/zinc/83/87/69/1049838769.db2.gz LZLNEPJZHRATCW-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cc2c(cc1F)C[N@H+](Cc1cccc(C(F)F)c1)CC2 ZINC001207132451 1049842768 /nfs/dbraw/zinc/84/27/68/1049842768.db2.gz HQASLMLXZBSBFN-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO Fc1cc2c(cc1F)C[N@@H+](Cc1cccc(C(F)F)c1)CC2 ZINC001207132451 1049842769 /nfs/dbraw/zinc/84/27/69/1049842769.db2.gz HQASLMLXZBSBFN-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO CC(C)n1nccc1C[N@H+](Cc1ccccc1)Cc1ccncc1 ZINC001207170884 1049850077 /nfs/dbraw/zinc/85/00/77/1049850077.db2.gz GQOHWXGVSZUACK-UHFFFAOYSA-N 1 2 320.440 4.061 20 0 DIADLO CC(C)n1nccc1C[N@@H+](Cc1ccccc1)Cc1ccncc1 ZINC001207170884 1049850087 /nfs/dbraw/zinc/85/00/87/1049850087.db2.gz GQOHWXGVSZUACK-UHFFFAOYSA-N 1 2 320.440 4.061 20 0 DIADLO CC[N@H+](Cc1ccnc(C)n1)Cc1ccc(Cl)cc1Cl ZINC001207170759 1049850860 /nfs/dbraw/zinc/85/08/60/1049850860.db2.gz ZRZIWIDERQJPBC-UHFFFAOYSA-N 1 2 310.228 4.114 20 0 DIADLO CC[N@@H+](Cc1ccnc(C)n1)Cc1ccc(Cl)cc1Cl ZINC001207170759 1049850883 /nfs/dbraw/zinc/85/08/83/1049850883.db2.gz ZRZIWIDERQJPBC-UHFFFAOYSA-N 1 2 310.228 4.114 20 0 DIADLO c1ccc(COCC[N@@H+]2CCc3c4ccccc4oc3C2)cc1 ZINC001207236415 1049866574 /nfs/dbraw/zinc/86/65/74/1049866574.db2.gz HSRVJHUBGJDSAZ-UHFFFAOYSA-N 1 2 307.393 4.008 20 0 DIADLO c1ccc(COCC[N@H+]2CCc3c4ccccc4oc3C2)cc1 ZINC001207236415 1049866585 /nfs/dbraw/zinc/86/65/85/1049866585.db2.gz HSRVJHUBGJDSAZ-UHFFFAOYSA-N 1 2 307.393 4.008 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3ccc(Cl)c(C)c3C2)cnc1F ZINC001207243817 1049869207 /nfs/dbraw/zinc/86/92/07/1049869207.db2.gz QMVCYGKXMNGISI-UHFFFAOYSA-N 1 2 304.796 4.049 20 0 DIADLO Cc1cc(C[N@H+]2CCc3ccc(Cl)c(C)c3C2)cnc1F ZINC001207243817 1049869231 /nfs/dbraw/zinc/86/92/31/1049869231.db2.gz QMVCYGKXMNGISI-UHFFFAOYSA-N 1 2 304.796 4.049 20 0 DIADLO CC[N@H+](Cc1ccccc1Cl)Cc1cccc(O)c1OC ZINC000491090321 1049884429 /nfs/dbraw/zinc/88/44/29/1049884429.db2.gz OSVMKWVVRZLGMS-UHFFFAOYSA-N 1 2 305.805 4.076 20 0 DIADLO CC[N@@H+](Cc1ccccc1Cl)Cc1cccc(O)c1OC ZINC000491090321 1049884436 /nfs/dbraw/zinc/88/44/36/1049884436.db2.gz OSVMKWVVRZLGMS-UHFFFAOYSA-N 1 2 305.805 4.076 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](CCc1ccccc1Br)C2 ZINC001207529938 1049906837 /nfs/dbraw/zinc/90/68/37/1049906837.db2.gz CEJHUIQPMUAAHV-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](CCc1ccccc1Br)C2 ZINC001207529938 1049906851 /nfs/dbraw/zinc/90/68/51/1049906851.db2.gz CEJHUIQPMUAAHV-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO CCO[C@@H]1C[C@@H](Nc2ccc3[nH+]c(C)cc(C)c3c2)[C@H]1SC ZINC001207554341 1049908670 /nfs/dbraw/zinc/90/86/70/1049908670.db2.gz UDWRWFBHVOYOSA-KZNAEPCWSA-N 1 2 316.470 4.173 20 0 DIADLO CCC(CC)(CC)NC(=O)C[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000669173923 1049917896 /nfs/dbraw/zinc/91/78/96/1049917896.db2.gz RTPFDARRBIFJJX-INIZCTEOSA-N 1 2 313.445 4.017 20 0 DIADLO Cc1ccc(C2=CC[N@H+]([C@@H](C)c3nc(C(C)C)no3)CC2)cc1 ZINC000044586247 1049919473 /nfs/dbraw/zinc/91/94/73/1049919473.db2.gz VHHLADPJJQBLJV-HNNXBMFYSA-N 1 2 311.429 4.352 20 0 DIADLO Cc1ccc(C2=CC[N@@H+]([C@@H](C)c3nc(C(C)C)no3)CC2)cc1 ZINC000044586247 1049919477 /nfs/dbraw/zinc/91/94/77/1049919477.db2.gz VHHLADPJJQBLJV-HNNXBMFYSA-N 1 2 311.429 4.352 20 0 DIADLO Cc1cc(C[NH2+][C@H](COCC(C)C)c2ccco2)cnc1Cl ZINC000760664237 1049923915 /nfs/dbraw/zinc/92/39/15/1049923915.db2.gz QHBJQXVOEOVOSR-OAHLLOKOSA-N 1 2 322.836 4.140 20 0 DIADLO CC(C)=CCCC1=CC[C@H](C[N@@H+](C)Cc2noc(C)n2)CC1 ZINC001207940645 1049961832 /nfs/dbraw/zinc/96/18/32/1049961832.db2.gz MVZQHAWLLMHZTF-KRWDZBQOSA-N 1 2 303.450 4.283 20 0 DIADLO CC(C)=CCCC1=CC[C@H](C[N@H+](C)Cc2noc(C)n2)CC1 ZINC001207940645 1049961844 /nfs/dbraw/zinc/96/18/44/1049961844.db2.gz MVZQHAWLLMHZTF-KRWDZBQOSA-N 1 2 303.450 4.283 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)C[C@H](C)OCc2ccccc2)cs1 ZINC001208703218 1050002999 /nfs/dbraw/zinc/00/29/99/1050002999.db2.gz XWIFNLNAHAQMTF-HNNXBMFYSA-N 1 2 318.486 4.304 20 0 DIADLO CC(C)c1nc(C[N@H+](C)C[C@H](C)OCc2ccccc2)cs1 ZINC001208703218 1050003004 /nfs/dbraw/zinc/00/30/04/1050003004.db2.gz XWIFNLNAHAQMTF-HNNXBMFYSA-N 1 2 318.486 4.304 20 0 DIADLO C[C@H](C[N@@H+]1CC(F)(F)C[C@@]1(C)CO)c1cccc2ccccc21 ZINC001208704279 1050003515 /nfs/dbraw/zinc/00/35/15/1050003515.db2.gz JLMPTHJYAJFACU-KDOFPFPSSA-N 1 2 319.395 4.035 20 0 DIADLO C[C@H](C[N@H+]1CC(F)(F)C[C@@]1(C)CO)c1cccc2ccccc21 ZINC001208704279 1050003519 /nfs/dbraw/zinc/00/35/19/1050003519.db2.gz JLMPTHJYAJFACU-KDOFPFPSSA-N 1 2 319.395 4.035 20 0 DIADLO C[C@@H](C[N@@H+]1CC(F)(F)CC[C@@H]1CO)c1cccc2ccccc21 ZINC001208707426 1050004116 /nfs/dbraw/zinc/00/41/16/1050004116.db2.gz SSWDRDNXERNTPB-GOEBONIOSA-N 1 2 319.395 4.035 20 0 DIADLO C[C@@H](C[N@H+]1CC(F)(F)CC[C@@H]1CO)c1cccc2ccccc21 ZINC001208707426 1050004119 /nfs/dbraw/zinc/00/41/19/1050004119.db2.gz SSWDRDNXERNTPB-GOEBONIOSA-N 1 2 319.395 4.035 20 0 DIADLO C[N@H+](Cc1cn2ccccc2n1)Cc1ccc(Cl)c(Cl)c1 ZINC000588841912 1050005614 /nfs/dbraw/zinc/00/56/14/1050005614.db2.gz DWZWTPMFFQNNTN-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1cn2ccccc2n1)Cc1ccc(Cl)c(Cl)c1 ZINC000588841912 1050005620 /nfs/dbraw/zinc/00/56/20/1050005620.db2.gz DWZWTPMFFQNNTN-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO CCCCc1ccc(C(=O)Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC000588859907 1050006581 /nfs/dbraw/zinc/00/65/81/1050006581.db2.gz VVKVHJXCUBIKOQ-UHFFFAOYSA-N 1 2 307.397 4.238 20 0 DIADLO CC[N@H+](CC1=CSC(=C2SC=CS2)S1)C1COC1 ZINC001209092974 1050034378 /nfs/dbraw/zinc/03/43/78/1050034378.db2.gz ABKKAFAUAWLDES-UHFFFAOYSA-N 1 2 317.526 4.106 20 0 DIADLO CC[N@@H+](CC1=CSC(=C2SC=CS2)S1)C1COC1 ZINC001209092974 1050034380 /nfs/dbraw/zinc/03/43/80/1050034380.db2.gz ABKKAFAUAWLDES-UHFFFAOYSA-N 1 2 317.526 4.106 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(C2CC2)s1)c1cc2cccc(F)c2o1 ZINC000572711362 1050040618 /nfs/dbraw/zinc/04/06/18/1050040618.db2.gz GUHSRNYEPWCFKQ-VIFPVBQESA-N 1 2 317.389 4.152 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2n[nH]c3ccccc32)C(C)C)cc1 ZINC000589637837 1050050978 /nfs/dbraw/zinc/05/09/78/1050050978.db2.gz FLJRQJLJKYAJGD-IBGZPJMESA-N 1 2 309.413 4.058 20 0 DIADLO CCCn1c(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)nc2ccccc21 ZINC000589833992 1050060268 /nfs/dbraw/zinc/06/02/68/1050060268.db2.gz NBZLZGBDOROTLQ-GDBMZVCRSA-N 1 2 323.440 4.453 20 0 DIADLO Cc1ccccc1OC1CC[NH+](Cc2cnc(Cl)s2)CC1 ZINC001209460944 1050061180 /nfs/dbraw/zinc/06/11/80/1050061180.db2.gz FKVSWFGXYMMZSX-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@H]2c2cccc(Cl)c2)[nH]1 ZINC001209574492 1050069206 /nfs/dbraw/zinc/06/92/06/1050069206.db2.gz NYNBUUHJRMWPPL-INIZCTEOSA-N 1 2 306.862 4.267 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@H]2c2cccc(Cl)c2)[nH]1 ZINC001209574492 1050069211 /nfs/dbraw/zinc/06/92/11/1050069211.db2.gz NYNBUUHJRMWPPL-INIZCTEOSA-N 1 2 306.862 4.267 20 0 DIADLO CCc1ccc([C@@H](C)C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000589947394 1050069086 /nfs/dbraw/zinc/06/90/86/1050069086.db2.gz FIAUBYZKWCZLAO-CQSZACIVSA-N 1 2 319.408 4.381 20 0 DIADLO Cc1ccc(C[N@H+]2Cc3c(Br)cccc3C[C@H]2C)[nH]1 ZINC001209577031 1050069749 /nfs/dbraw/zinc/06/97/49/1050069749.db2.gz LLZISVHZIDEFMD-GFCCVEGCSA-N 1 2 319.246 4.032 20 0 DIADLO Cc1ccc(C[N@@H+]2Cc3c(Br)cccc3C[C@H]2C)[nH]1 ZINC001209577031 1050069754 /nfs/dbraw/zinc/06/97/54/1050069754.db2.gz LLZISVHZIDEFMD-GFCCVEGCSA-N 1 2 319.246 4.032 20 0 DIADLO COc1c(Cl)ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)c1F ZINC001209701090 1050077653 /nfs/dbraw/zinc/07/76/53/1050077653.db2.gz JAQHYGJBIPIFLD-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(Cl)ccc(C[N@H+]2CCC[C@H]2c2ccccn2)c1F ZINC001209701090 1050077658 /nfs/dbraw/zinc/07/76/58/1050077658.db2.gz JAQHYGJBIPIFLD-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(Cl)ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)c1F ZINC001209702419 1050077799 /nfs/dbraw/zinc/07/77/99/1050077799.db2.gz VLSOYSZLFWSYOV-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(Cl)ccc(C[N@H+]2CCC[C@H]2c2ccncc2)c1F ZINC001209702419 1050077802 /nfs/dbraw/zinc/07/78/02/1050077802.db2.gz VLSOYSZLFWSYOV-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1cccn2cc(C[N@@H+]3CCC[C@@H]3c3ccccc3F)nc12 ZINC001209739232 1050080808 /nfs/dbraw/zinc/08/08/08/1050080808.db2.gz KZBUTWQEOLJHID-GOSISDBHSA-N 1 2 309.388 4.119 20 0 DIADLO Cc1cccn2cc(C[N@H+]3CCC[C@@H]3c3ccccc3F)nc12 ZINC001209739232 1050080813 /nfs/dbraw/zinc/08/08/13/1050080813.db2.gz KZBUTWQEOLJHID-GOSISDBHSA-N 1 2 309.388 4.119 20 0 DIADLO FC(F)(F)COc1cccc(Nc2cccn3cc[nH+]c23)c1 ZINC001212164186 1050093943 /nfs/dbraw/zinc/09/39/43/1050093943.db2.gz BYWKZOVDDORZRX-UHFFFAOYSA-N 1 2 307.275 4.019 20 0 DIADLO CCCOc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)cc1 ZINC001209864956 1050097115 /nfs/dbraw/zinc/09/71/15/1050097115.db2.gz UYPIOSJFGUOZIO-UHFFFAOYSA-N 1 2 307.397 4.464 20 0 DIADLO Cc1c(F)ccc(Nc2ccccc2C[NH+]2CCOCC2)c1C ZINC001209931681 1050108039 /nfs/dbraw/zinc/10/80/39/1050108039.db2.gz BXRJOKUHTODYIY-UHFFFAOYSA-N 1 2 314.404 4.018 20 0 DIADLO Fc1cccc(Cl)c1Nc1ccccc1C[NH+]1CCOCC1 ZINC001209928355 1050108212 /nfs/dbraw/zinc/10/82/12/1050108212.db2.gz AFTNHTNYASVJAA-UHFFFAOYSA-N 1 2 320.795 4.055 20 0 DIADLO Cc1cc(Cl)ccc1Nc1ccccc1C[NH+]1CCOCC1 ZINC001209927254 1050108219 /nfs/dbraw/zinc/10/82/19/1050108219.db2.gz PAILEHPHLIKTSC-UHFFFAOYSA-N 1 2 316.832 4.224 20 0 DIADLO CO[C@H](C)c1cccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001209952508 1050111124 /nfs/dbraw/zinc/11/11/24/1050111124.db2.gz WABNJWUCEFZXIJ-OAHLLOKOSA-N 1 2 307.397 4.382 20 0 DIADLO Cc1cc(N)[nH+]cc1Nc1cc(Cl)c(Cl)c(Cl)c1O ZINC001209973436 1050114338 /nfs/dbraw/zinc/11/43/38/1050114338.db2.gz ZQRPHUUUQKGNFA-UHFFFAOYSA-N 1 2 318.591 4.382 20 0 DIADLO Oc1ccc(Nc2[nH+]cccc2N2CCCC2)cc1C(F)(F)F ZINC001209984888 1050116994 /nfs/dbraw/zinc/11/69/94/1050116994.db2.gz RXTRLHXHYVBKIP-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(C(C)(C)C)on1 ZINC000573047351 1050117158 /nfs/dbraw/zinc/11/71/58/1050117158.db2.gz GZFXDLRKSLJCGG-JQWIXIFHSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cc(C(C)(C)C)on1 ZINC000573047351 1050117161 /nfs/dbraw/zinc/11/71/61/1050117161.db2.gz GZFXDLRKSLJCGG-JQWIXIFHSA-N 1 2 304.356 4.135 20 0 DIADLO CC(C)Oc1ccc(Nc2[nH+]cccc2N2CCCC2)cc1F ZINC001209996003 1050118797 /nfs/dbraw/zinc/11/87/97/1050118797.db2.gz NHSMDBVVMKFGHC-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO Cc1ccc2c(Nc3ccc4c(c3)OCCCO4)cccc2[nH+]1 ZINC001210006510 1050121144 /nfs/dbraw/zinc/12/11/44/1050121144.db2.gz WLVRMOMFGMADNG-UHFFFAOYSA-N 1 2 306.365 4.448 20 0 DIADLO Cc1cc(Nc2cc(C(F)(F)F)ccc2N)ccc1[NH+](C)C ZINC001210042255 1050127531 /nfs/dbraw/zinc/12/75/31/1050127531.db2.gz YWHPBUALHRKJFV-UHFFFAOYSA-N 1 2 309.335 4.406 20 0 DIADLO Cc1cc(Nc2cccc3c2NC(=O)CC3(C)C)ccc1[NH+](C)C ZINC001210043450 1050127568 /nfs/dbraw/zinc/12/75/68/1050127568.db2.gz FYKVXJUZCPXFRC-UHFFFAOYSA-N 1 2 323.440 4.424 20 0 DIADLO Cc1cc(Nc2ccc3nc(C(C)(C)C)nn3c2)ccc1[NH+](C)C ZINC001210041831 1050127619 /nfs/dbraw/zinc/12/76/19/1050127619.db2.gz TUARELSJCFWMAL-UHFFFAOYSA-N 1 2 323.444 4.145 20 0 DIADLO Cc1ccc(Br)nc1Nc1ccc2c[nH+]ccc2c1 ZINC001210047121 1050129233 /nfs/dbraw/zinc/12/92/33/1050129233.db2.gz LLYDCWHCHYJHPN-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO FC(F)(F)c1ccncc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001210093322 1050135538 /nfs/dbraw/zinc/13/55/38/1050135538.db2.gz OMJOFIDJMJCPOY-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO Cn1c[nH+]c2cc(Nc3c(F)cccc3C(F)(F)F)ccc21 ZINC001210131111 1050142065 /nfs/dbraw/zinc/14/20/65/1050142065.db2.gz NDYPKJWCBPNSDM-UHFFFAOYSA-N 1 2 309.266 4.475 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@H+](CCOc1ccccc1F)CC3 ZINC000591381537 1050144316 /nfs/dbraw/zinc/14/43/16/1050144316.db2.gz GPLFNFNCFDEGHF-UHFFFAOYSA-N 1 2 324.399 4.053 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](CCOc1ccccc1F)CC3 ZINC000591381537 1050144320 /nfs/dbraw/zinc/14/43/20/1050144320.db2.gz GPLFNFNCFDEGHF-UHFFFAOYSA-N 1 2 324.399 4.053 20 0 DIADLO Nc1cc(Cl)nc(Cl)c1Nc1cccc2cc[nH+]cc21 ZINC001210224394 1050165333 /nfs/dbraw/zinc/16/53/33/1050165333.db2.gz ZGZFCGNFVOHOPS-UHFFFAOYSA-N 1 2 305.168 4.262 20 0 DIADLO Cn1nc(-c2ccccc2)cc1Nc1cccc2cc[nH+]cc21 ZINC001210224016 1050166091 /nfs/dbraw/zinc/16/60/91/1050166091.db2.gz NWIFSQIIUGWFBZ-UHFFFAOYSA-N 1 2 300.365 4.379 20 0 DIADLO c1nn2cc(Nc3cccc4cc[nH+]cc43)cnc2c1C1CCC1 ZINC001210226515 1050167949 /nfs/dbraw/zinc/16/79/49/1050167949.db2.gz ZZJYCWFRBFVIPH-UHFFFAOYSA-N 1 2 315.380 4.289 20 0 DIADLO Nc1cc(Cl)c(Cl)nc1Nc1cccc2cc[nH+]cc21 ZINC001210226488 1050168261 /nfs/dbraw/zinc/16/82/61/1050168261.db2.gz YLXQEMYMFYUJGN-UHFFFAOYSA-N 1 2 305.168 4.262 20 0 DIADLO Cc1c(Br)cncc1Nc1cccc2cc[nH+]cc21 ZINC001210224478 1050168619 /nfs/dbraw/zinc/16/86/19/1050168619.db2.gz OOGKONNCXGIXES-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO COC(=O)c1cccc(Nc2cccc3cc[nH+]cc32)c1Cl ZINC001210233150 1050171844 /nfs/dbraw/zinc/17/18/44/1050171844.db2.gz USLVQOYEUJKGFC-UHFFFAOYSA-N 1 2 312.756 4.418 20 0 DIADLO Cn1c2ccccc2nc1C[N@H+](C)Cc1cccc(C(F)F)c1 ZINC000348059689 1050176584 /nfs/dbraw/zinc/17/65/84/1050176584.db2.gz QZADTLWEOCHKFM-UHFFFAOYSA-N 1 2 315.367 4.143 20 0 DIADLO Cn1c2ccccc2nc1C[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC000348059689 1050176590 /nfs/dbraw/zinc/17/65/90/1050176590.db2.gz QZADTLWEOCHKFM-UHFFFAOYSA-N 1 2 315.367 4.143 20 0 DIADLO Cc1[nH+]cc(Nc2c(F)cccc2OC2CCCC2)cc1N ZINC001210291968 1050191326 /nfs/dbraw/zinc/19/13/26/1050191326.db2.gz WUOYPYLBBDXTEO-UHFFFAOYSA-N 1 2 301.365 4.176 20 0 DIADLO COc1ccc(-c2ccccc2)c(Nc2c[nH+]c(C)c(N)c2)c1 ZINC001210288913 1050191349 /nfs/dbraw/zinc/19/13/49/1050191349.db2.gz YPMPQEKMTWAHSS-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(Br)c(Cl)c2)cc1N ZINC001210288871 1050192124 /nfs/dbraw/zinc/19/21/24/1050192124.db2.gz XUGPAPFRSXMZQP-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO COc1cccc(-c2ccc(Nc3c[nH+]c(C)c(N)c3)cc2)c1 ZINC001210288556 1050192647 /nfs/dbraw/zinc/19/26/47/1050192647.db2.gz SKVFNRWDWDLDPK-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO Cc1[nH+]cc(Nc2cccc(F)c2OC2CCCC2)cc1N ZINC001210291728 1050192815 /nfs/dbraw/zinc/19/28/15/1050192815.db2.gz SANOXLOLGYDJAG-UHFFFAOYSA-N 1 2 301.365 4.176 20 0 DIADLO Oc1ccc2c(c1)CC[N@@H+](Cc1cc3c(cccc3Cl)[nH]1)C2 ZINC001136857475 1050198678 /nfs/dbraw/zinc/19/86/78/1050198678.db2.gz BKJBONRMJKANKR-UHFFFAOYSA-N 1 2 312.800 4.085 20 0 DIADLO Oc1ccc2c(c1)CC[N@H+](Cc1cc3c(cccc3Cl)[nH]1)C2 ZINC001136857475 1050198684 /nfs/dbraw/zinc/19/86/84/1050198684.db2.gz BKJBONRMJKANKR-UHFFFAOYSA-N 1 2 312.800 4.085 20 0 DIADLO CC(=O)c1ccc([C@H](C)Nc2nc(C)[nH+]c3c2CCCC3)cc1 ZINC001171053990 1050206124 /nfs/dbraw/zinc/20/61/24/1050206124.db2.gz OBZGQJSZOGLJBF-LBPRGKRZSA-N 1 2 309.413 4.040 20 0 DIADLO CC(C)(C)c1nc(=S)n(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)[nH]1 ZINC000733992748 1050209956 /nfs/dbraw/zinc/20/99/56/1050209956.db2.gz UMLRNLHTYZJVTD-QGZVFWFLSA-N 1 2 320.506 4.018 20 0 DIADLO CC(C)(C)c1nc(=S)n(C[N@H+]2CCC[C@]3(CC=CCC3)C2)[nH]1 ZINC000733992748 1050209969 /nfs/dbraw/zinc/20/99/69/1050209969.db2.gz UMLRNLHTYZJVTD-QGZVFWFLSA-N 1 2 320.506 4.018 20 0 DIADLO C/C(=C/C(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1Cl ZINC000733968818 1050210004 /nfs/dbraw/zinc/21/00/04/1050210004.db2.gz XPVFYUSDXZUFAI-BENRWUELSA-N 1 2 311.772 4.030 20 0 DIADLO CC(C)(C)c1nn(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)c(=S)o1 ZINC000733992899 1050210676 /nfs/dbraw/zinc/21/06/76/1050210676.db2.gz XFYQQIFEBJVEBG-KRWDZBQOSA-N 1 2 321.490 4.283 20 0 DIADLO CC(C)(C)c1nn(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)c(=S)o1 ZINC000733992899 1050210694 /nfs/dbraw/zinc/21/06/94/1050210694.db2.gz XFYQQIFEBJVEBG-KRWDZBQOSA-N 1 2 321.490 4.283 20 0 DIADLO Clc1ccc([C@@H]2CCC[N@@H+]2Cc2cn3ccccc3n2)s1 ZINC001136880930 1050215432 /nfs/dbraw/zinc/21/54/32/1050215432.db2.gz PJDKUSUGBJZPLY-ZDUSSCGKSA-N 1 2 317.845 4.386 20 0 DIADLO Clc1ccc([C@@H]2CCC[N@H+]2Cc2cn3ccccc3n2)s1 ZINC001136880930 1050215440 /nfs/dbraw/zinc/21/54/40/1050215440.db2.gz PJDKUSUGBJZPLY-ZDUSSCGKSA-N 1 2 317.845 4.386 20 0 DIADLO CC[C@@H]1C[N@H+](Cn2ncsc2=S)CC[C@@H]1c1ccccc1 ZINC000746379874 1050222514 /nfs/dbraw/zinc/22/25/14/1050222514.db2.gz BAGXVMDUPMCHFR-HIFRSBDPSA-N 1 2 319.499 4.147 20 0 DIADLO CC[C@@H]1C[N@@H+](Cn2ncsc2=S)CC[C@@H]1c1ccccc1 ZINC000746379874 1050222527 /nfs/dbraw/zinc/22/25/27/1050222527.db2.gz BAGXVMDUPMCHFR-HIFRSBDPSA-N 1 2 319.499 4.147 20 0 DIADLO Clc1ccc(C[N@H+](Cc2ccccc2)Cc2cccnc2)nc1 ZINC001136929621 1050238907 /nfs/dbraw/zinc/23/89/07/1050238907.db2.gz RJKGKFZTXCBFNF-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1ccc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)nc1 ZINC001136929621 1050238919 /nfs/dbraw/zinc/23/89/19/1050238919.db2.gz RJKGKFZTXCBFNF-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO FC(F)(F)c1ccccc1C=CNc1ccn2cc[nH+]c2c1 ZINC001210430216 1050242125 /nfs/dbraw/zinc/24/21/25/1050242125.db2.gz ZZAQPDDHMUNYRX-FNORWQNLSA-N 1 2 303.287 4.436 20 0 DIADLO Cn1ccnc1-c1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001210431148 1050243304 /nfs/dbraw/zinc/24/33/04/1050243304.db2.gz LHLPHYUCSVCPJK-UHFFFAOYSA-N 1 2 315.380 4.016 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2s1)c1ccc(F)cn1 ZINC000771392407 1050250327 /nfs/dbraw/zinc/25/03/27/1050250327.db2.gz WHHLSDWAUNHRMY-MNOVXSKESA-N 1 2 301.390 4.242 20 0 DIADLO COCOc1ccc(Nc2ccc([NH+]3CCCC3)cc2)c(C)c1 ZINC001210491335 1050266256 /nfs/dbraw/zinc/26/62/56/1050266256.db2.gz RZJQUOZICQVSOE-UHFFFAOYSA-N 1 2 312.413 4.322 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(OCOC)cc2C)cc1 ZINC001210500205 1050270182 /nfs/dbraw/zinc/27/01/82/1050270182.db2.gz QYLQPMOHOUMZPF-UHFFFAOYSA-N 1 2 300.402 4.177 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(OCOC)cc2C)cc1 ZINC001210500205 1050270201 /nfs/dbraw/zinc/27/02/01/1050270201.db2.gz QYLQPMOHOUMZPF-UHFFFAOYSA-N 1 2 300.402 4.177 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC000825214963 1050284833 /nfs/dbraw/zinc/28/48/33/1050284833.db2.gz BVZNTNKWNMMUIR-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(F)ccc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC000825214963 1050284847 /nfs/dbraw/zinc/28/48/47/1050284847.db2.gz BVZNTNKWNMMUIR-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO CSCc1cnc(C[NH2+]C2(c3ccccc3F)CCC2)s1 ZINC000592375915 1050290074 /nfs/dbraw/zinc/29/00/74/1050290074.db2.gz PHBVHJDDADHERQ-UHFFFAOYSA-N 1 2 322.474 4.314 20 0 DIADLO CC(C)CC[NH+](CCC(C)C)Cc1ncc(C(F)(F)F)[nH]1 ZINC001137019133 1050294042 /nfs/dbraw/zinc/29/40/42/1050294042.db2.gz SUMPDEZHPCAFSZ-UHFFFAOYSA-N 1 2 305.388 4.323 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cncc(N4CCCC4)c3)ccc12 ZINC001210610747 1050312959 /nfs/dbraw/zinc/31/29/59/1050312959.db2.gz ZLVQKOGLEOWHHT-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c1Cl ZINC001143362577 1050318030 /nfs/dbraw/zinc/31/80/30/1050318030.db2.gz FXHSFCRNRNGJBM-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC(F)(F)C(C)(C)C2)c1Cl ZINC001143362577 1050318044 /nfs/dbraw/zinc/31/80/44/1050318044.db2.gz FXHSFCRNRNGJBM-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@H](F)C2)cc1C(F)(F)F ZINC001143637083 1050323454 /nfs/dbraw/zinc/32/34/54/1050323454.db2.gz ZBIGUQSDUVLKMQ-LBPRGKRZSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@H](F)C2)cc1C(F)(F)F ZINC001143637083 1050323465 /nfs/dbraw/zinc/32/34/65/1050323465.db2.gz ZBIGUQSDUVLKMQ-LBPRGKRZSA-N 1 2 305.315 4.038 20 0 DIADLO Cc1ccc(C2=CCN(c3cc(C)[nH+]c(C4CC4)n3)CC2)cc1 ZINC000734835220 1050324075 /nfs/dbraw/zinc/32/40/75/1050324075.db2.gz RWRMUGFQSDMSAB-UHFFFAOYSA-N 1 2 305.425 4.265 20 0 DIADLO CCCOC1CC[NH+](Cc2ccc(F)c(Cl)c2F)CC1 ZINC001143626075 1050327197 /nfs/dbraw/zinc/32/71/97/1050327197.db2.gz GXGFNQHOKXFQRA-UHFFFAOYSA-N 1 2 303.780 4.009 20 0 DIADLO Fc1ccc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c(F)c1Cl ZINC001143626448 1050327911 /nfs/dbraw/zinc/32/79/11/1050327911.db2.gz VMPOYMDLQZGNNX-AWEZNQCLSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1ccc(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c(F)c1Cl ZINC001143626448 1050327921 /nfs/dbraw/zinc/32/79/21/1050327921.db2.gz VMPOYMDLQZGNNX-AWEZNQCLSA-N 1 2 323.770 4.272 20 0 DIADLO C[N@H+](CCC(=O)c1ccccc1)Cc1ccc(F)c(Cl)c1F ZINC001143626242 1050328492 /nfs/dbraw/zinc/32/84/92/1050328492.db2.gz NRKSKMUPVJEGGT-UHFFFAOYSA-N 1 2 323.770 4.323 20 0 DIADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1ccc(F)c(Cl)c1F ZINC001143626242 1050328503 /nfs/dbraw/zinc/32/85/03/1050328503.db2.gz NRKSKMUPVJEGGT-UHFFFAOYSA-N 1 2 323.770 4.323 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1cnc(C(F)(F)F)nc1 ZINC001210668528 1050333389 /nfs/dbraw/zinc/33/33/89/1050333389.db2.gz UHBFBOCJBPXHSW-UHFFFAOYSA-N 1 2 310.323 4.141 20 0 DIADLO CC(C)c1cccc(CNc2[nH+]cnc3c2cnn3C(C)(C)C)c1 ZINC000772231220 1050342369 /nfs/dbraw/zinc/34/23/69/1050342369.db2.gz MCUOLPXBUZHRGO-UHFFFAOYSA-N 1 2 323.444 4.317 20 0 DIADLO c1csc(-c2cc(C[N@@H+]3CCCc4sccc4C3)no2)c1 ZINC000592981557 1050351391 /nfs/dbraw/zinc/35/13/91/1050351391.db2.gz DNMNKPXVLQCODR-UHFFFAOYSA-N 1 2 316.451 4.413 20 0 DIADLO c1csc(-c2cc(C[N@H+]3CCCc4sccc4C3)no2)c1 ZINC000592981557 1050351414 /nfs/dbraw/zinc/35/14/14/1050351414.db2.gz DNMNKPXVLQCODR-UHFFFAOYSA-N 1 2 316.451 4.413 20 0 DIADLO Fc1cc(OC(F)(F)F)ccc1C[N@H+]1CCCC[C@@H](F)C1 ZINC001143780628 1050358080 /nfs/dbraw/zinc/35/80/80/1050358080.db2.gz BLNRMUPOANUVCR-LLVKDONJSA-N 1 2 309.278 4.048 20 0 DIADLO Fc1cc(OC(F)(F)F)ccc1C[N@@H+]1CCCC[C@@H](F)C1 ZINC001143780628 1050358091 /nfs/dbraw/zinc/35/80/91/1050358091.db2.gz BLNRMUPOANUVCR-LLVKDONJSA-N 1 2 309.278 4.048 20 0 DIADLO c1csc(-c2nc(C[N@@H+]3CCCc4sccc4C3)co2)c1 ZINC000592982049 1050358035 /nfs/dbraw/zinc/35/80/35/1050358035.db2.gz AXONUHOVOUNVMG-UHFFFAOYSA-N 1 2 316.451 4.413 20 0 DIADLO c1csc(-c2nc(C[N@H+]3CCCc4sccc4C3)co2)c1 ZINC000592982049 1050358047 /nfs/dbraw/zinc/35/80/47/1050358047.db2.gz AXONUHOVOUNVMG-UHFFFAOYSA-N 1 2 316.451 4.413 20 0 DIADLO COC(=O)c1cccc([C@@H](C)Nc2cc3cc(F)ccc3c[nH+]2)c1 ZINC001171103694 1050359999 /nfs/dbraw/zinc/35/99/99/1050359999.db2.gz UIRMVMRKSAEHPE-GFCCVEGCSA-N 1 2 324.355 4.334 20 0 DIADLO CCO[C@@H]1CC[N@H+](Cc2c(Cl)cc(Cl)cc2Cl)C1 ZINC001143800642 1050365683 /nfs/dbraw/zinc/36/56/83/1050365683.db2.gz NCLQJOYIJJZHNB-SNVBAGLBSA-N 1 2 308.636 4.258 20 0 DIADLO CCO[C@@H]1CC[N@@H+](Cc2c(Cl)cc(Cl)cc2Cl)C1 ZINC001143800642 1050365698 /nfs/dbraw/zinc/36/56/98/1050365698.db2.gz NCLQJOYIJJZHNB-SNVBAGLBSA-N 1 2 308.636 4.258 20 0 DIADLO C[C@@H]1CO[C@@H]2C[N@H+](Cc3c(Cl)cc(Cl)cc3Cl)C[C@H]12 ZINC001143800938 1050366459 /nfs/dbraw/zinc/36/64/59/1050366459.db2.gz OTHSIPSSWGDPAD-PJCOJXEDSA-N 1 2 320.647 4.114 20 0 DIADLO C[C@@H]1CO[C@@H]2C[N@@H+](Cc3c(Cl)cc(Cl)cc3Cl)C[C@H]12 ZINC001143800938 1050366473 /nfs/dbraw/zinc/36/64/73/1050366473.db2.gz OTHSIPSSWGDPAD-PJCOJXEDSA-N 1 2 320.647 4.114 20 0 DIADLO Clc1cc(Cl)c(C[NH+]2CCC3(CCO3)CC2)c(Cl)c1 ZINC001143800623 1050366702 /nfs/dbraw/zinc/36/67/02/1050366702.db2.gz MDXRUOYKKHERGY-UHFFFAOYSA-N 1 2 320.647 4.402 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCSC3(CCC3)CC2)c1 ZINC000574153964 1050370103 /nfs/dbraw/zinc/37/01/03/1050370103.db2.gz SAPGHLVUPPSMLQ-UHFFFAOYSA-N 1 2 302.418 4.240 20 0 DIADLO Brc1ccoc1C[NH2+]Cc1coc2ccccc12 ZINC000735321080 1050371774 /nfs/dbraw/zinc/37/17/74/1050371774.db2.gz IAXGGFSRGKVRTR-UHFFFAOYSA-N 1 2 306.159 4.078 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@@H](c1ccccc1F)C1CCCC1 ZINC000826626301 1050372493 /nfs/dbraw/zinc/37/24/93/1050372493.db2.gz HROUPYAZRLHLNN-APPDUMDISA-N 1 2 303.381 4.099 20 0 DIADLO CC(C)n1cc(Nc2ccc(N(C)C3CCCCC3)[nH+]c2)cn1 ZINC001212613053 1050373655 /nfs/dbraw/zinc/37/36/55/1050373655.db2.gz AQTBMGYBPGQSJU-UHFFFAOYSA-N 1 2 313.449 4.372 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCC[C@H]2c2cccnc2)cc1Cl ZINC001143839641 1050374695 /nfs/dbraw/zinc/37/46/95/1050374695.db2.gz OCNKDCXBWFKTJV-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCC[C@H]2c2cccnc2)cc1Cl ZINC001143839641 1050374701 /nfs/dbraw/zinc/37/47/01/1050374701.db2.gz OCNKDCXBWFKTJV-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3ccc4cnccc4c3)ccc21 ZINC000785490972 1050381357 /nfs/dbraw/zinc/38/13/57/1050381357.db2.gz CEKIHSSDDUUOSS-UHFFFAOYSA-N 1 2 303.409 4.229 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3ccc4cnccc4c3)ccc21 ZINC000785490972 1050381367 /nfs/dbraw/zinc/38/13/67/1050381367.db2.gz CEKIHSSDDUUOSS-UHFFFAOYSA-N 1 2 303.409 4.229 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)C(CC)(CC)CC)n1 ZINC001143858093 1050385949 /nfs/dbraw/zinc/38/59/49/1050385949.db2.gz WYUSIGCICIIHAG-UHFFFAOYSA-N 1 2 311.495 4.140 20 0 DIADLO c1ccc(OC2CC2)c(Nc2ccc[nH+]c2N2CCCCC2)c1 ZINC001210834898 1050385936 /nfs/dbraw/zinc/38/59/36/1050385936.db2.gz HBQGGBGEWZWLGJ-UHFFFAOYSA-N 1 2 309.413 4.357 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[N@@H+]1CC[C@]2(C1)CCCCO2 ZINC001143854718 1050386433 /nfs/dbraw/zinc/38/64/33/1050386433.db2.gz FUPGEYGHQFWGIQ-HNNXBMFYSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[N@H+]1CC[C@]2(C1)CCCCO2 ZINC001143854718 1050386447 /nfs/dbraw/zinc/38/64/47/1050386447.db2.gz FUPGEYGHQFWGIQ-HNNXBMFYSA-N 1 2 318.219 4.278 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2c(F)ccc(Cl)c2Cl)[C@H](C)C1 ZINC001143867379 1050388285 /nfs/dbraw/zinc/38/82/85/1050388285.db2.gz AEPDPVNHUSVBDT-ZJUUUORDSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2c(F)ccc(Cl)c2Cl)[C@H](C)C1 ZINC001143867379 1050388297 /nfs/dbraw/zinc/38/82/97/1050388297.db2.gz AEPDPVNHUSVBDT-ZJUUUORDSA-N 1 2 306.208 4.132 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nnc(-c2ccccc2)[nH]1)c1ccsc1 ZINC000785564732 1050393328 /nfs/dbraw/zinc/39/33/28/1050393328.db2.gz BKMPYEAXYPEPAU-OAHLLOKOSA-N 1 2 312.442 4.164 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c1F ZINC001143892328 1050394998 /nfs/dbraw/zinc/39/49/98/1050394998.db2.gz WLMTWBWZGQJAQX-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCC(F)(F)C(C)(C)C2)c1F ZINC001143892328 1050395008 /nfs/dbraw/zinc/39/50/08/1050395008.db2.gz WLMTWBWZGQJAQX-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3ccccc3[C@H]2C)c(F)c1F ZINC001143903561 1050398492 /nfs/dbraw/zinc/39/84/92/1050398492.db2.gz ZNQHFOJMSUKXRT-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(C[N@H+]2CCc3ccccc3[C@H]2C)c(F)c1F ZINC001143903561 1050398500 /nfs/dbraw/zinc/39/85/00/1050398500.db2.gz ZNQHFOJMSUKXRT-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@@H+]1Cc1nccn1C(C)C ZINC000593299409 1050403129 /nfs/dbraw/zinc/40/31/29/1050403129.db2.gz ALVLFJQZTYEZRJ-QGZVFWFLSA-N 1 2 313.445 4.200 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1nccn1C(C)C ZINC000593299409 1050403141 /nfs/dbraw/zinc/40/31/41/1050403141.db2.gz ALVLFJQZTYEZRJ-QGZVFWFLSA-N 1 2 313.445 4.200 20 0 DIADLO CCc1ccc(-c2nc(C[N@@H+]3C[C@H]4[C@@H](C3)C4(F)F)cs2)cc1 ZINC000844449594 1050420786 /nfs/dbraw/zinc/42/07/86/1050420786.db2.gz LSRRFYHQQIFXBC-GASCZTMLSA-N 1 2 320.408 4.069 20 0 DIADLO CCc1ccc(-c2nc(C[N@H+]3C[C@H]4[C@@H](C3)C4(F)F)cs2)cc1 ZINC000844449594 1050420793 /nfs/dbraw/zinc/42/07/93/1050420793.db2.gz LSRRFYHQQIFXBC-GASCZTMLSA-N 1 2 320.408 4.069 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)oc1-c1ccc(Cl)cc1 ZINC000844452908 1050421688 /nfs/dbraw/zinc/42/16/88/1050421688.db2.gz JDTIKNPZQVCUNQ-BETUJISGSA-N 1 2 324.758 4.000 20 0 DIADLO Cc1nc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)oc1-c1ccc(Cl)cc1 ZINC000844452908 1050421700 /nfs/dbraw/zinc/42/17/00/1050421700.db2.gz JDTIKNPZQVCUNQ-BETUJISGSA-N 1 2 324.758 4.000 20 0 DIADLO O=C1CCCc2ccc(Nc3cccc(Cn4cc[nH+]c4)c3)cc21 ZINC001210934224 1050423614 /nfs/dbraw/zinc/42/36/14/1050423614.db2.gz IWMDEZPIEDORIQ-UHFFFAOYSA-N 1 2 317.392 4.194 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2ccc(Cl)nc2)[C@H]1c1ccccc1 ZINC000735742817 1050424795 /nfs/dbraw/zinc/42/47/95/1050424795.db2.gz ATXJSZZXRBPAKQ-SUMWQHHRSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2ccc(Cl)nc2)[C@H]1c1ccccc1 ZINC000735742817 1050424805 /nfs/dbraw/zinc/42/48/05/1050424805.db2.gz ATXJSZZXRBPAKQ-SUMWQHHRSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2ccc(Cl)nc2)[C@@H]1c1ccccc1 ZINC000735742816 1050425205 /nfs/dbraw/zinc/42/52/05/1050425205.db2.gz ATXJSZZXRBPAKQ-GUYCJALGSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2ccc(Cl)nc2)[C@@H]1c1ccccc1 ZINC000735742816 1050425211 /nfs/dbraw/zinc/42/52/11/1050425211.db2.gz ATXJSZZXRBPAKQ-GUYCJALGSA-N 1 2 318.873 4.414 20 0 DIADLO CC[N@H+](Cc1ccc(OC)cc1)Cc1c(F)ccc(OC)c1F ZINC001143980390 1050426040 /nfs/dbraw/zinc/42/60/40/1050426040.db2.gz MLWQAMLZMZNVQV-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)cc1)Cc1c(F)ccc(OC)c1F ZINC001143980390 1050426049 /nfs/dbraw/zinc/42/60/49/1050426049.db2.gz MLWQAMLZMZNVQV-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)OCc1sccc1Cl)c1ccccc1 ZINC000785920207 1050427927 /nfs/dbraw/zinc/42/79/27/1050427927.db2.gz VHTKRKZARHOTNZ-HNNXBMFYSA-N 1 2 323.845 4.138 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)OCc1sccc1Cl)c1ccccc1 ZINC000785920207 1050427915 /nfs/dbraw/zinc/42/79/15/1050427915.db2.gz VHTKRKZARHOTNZ-HNNXBMFYSA-N 1 2 323.845 4.138 20 0 DIADLO CC[C@H](OC(=O)C[C@@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC000844462393 1050432968 /nfs/dbraw/zinc/43/29/68/1050432968.db2.gz NGFYZEJZUJVYJZ-DOMZBBRYSA-N 1 2 306.793 4.182 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)OC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000844488886 1050439932 /nfs/dbraw/zinc/43/99/32/1050439932.db2.gz DGMVECCJDYKBLF-JSGCOSHPSA-N 1 2 312.369 4.193 20 0 DIADLO CN(c1ccc(Nc2cncnc2Cl)c[nH+]1)C1CCCCC1 ZINC001212613205 1050448320 /nfs/dbraw/zinc/44/83/20/1050448320.db2.gz IONBUAQJCDJAOJ-UHFFFAOYSA-N 1 2 317.824 4.038 20 0 DIADLO FC(F)(F)c1ccc(Cl)c(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c1Cl ZINC001144038295 1050449546 /nfs/dbraw/zinc/44/95/46/1050449546.db2.gz KMJFTSBBMSMVAF-OCAPTIKFSA-N 1 2 310.146 4.464 20 0 DIADLO FC(F)(F)c1ccc(Cl)c(C[N@H+]2C[C@@H]3C[C@@H]3C2)c1Cl ZINC001144038295 1050449554 /nfs/dbraw/zinc/44/95/54/1050449554.db2.gz KMJFTSBBMSMVAF-OCAPTIKFSA-N 1 2 310.146 4.464 20 0 DIADLO Cc1ccc(Oc2cccc(C[N@H+]3CCC(=O)C[C@@H]3C)c2)cc1 ZINC001144086406 1050456512 /nfs/dbraw/zinc/45/65/12/1050456512.db2.gz RMDJAEWENBUXOF-INIZCTEOSA-N 1 2 309.409 4.341 20 0 DIADLO Cc1ccc(Oc2cccc(C[N@@H+]3CCC(=O)C[C@@H]3C)c2)cc1 ZINC001144086406 1050456516 /nfs/dbraw/zinc/45/65/16/1050456516.db2.gz RMDJAEWENBUXOF-INIZCTEOSA-N 1 2 309.409 4.341 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1noc2c1CCCC2 ZINC000736297346 1050469219 /nfs/dbraw/zinc/46/92/19/1050469219.db2.gz WQODTFSVPMFVNQ-UHFFFAOYSA-N 1 2 324.428 4.163 20 0 DIADLO COc1nccc(Nc2cc[nH+]c3cc(Cl)ccc23)c1OC ZINC001211086874 1050469339 /nfs/dbraw/zinc/46/93/39/1050469339.db2.gz USVNDIHJOQVWRX-UHFFFAOYSA-N 1 2 315.760 4.044 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)cs1 ZINC000761047567 1050479005 /nfs/dbraw/zinc/47/90/05/1050479005.db2.gz VVCBTENAAKCJPO-LLVKDONJSA-N 1 2 306.397 4.116 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)cs1 ZINC000761047567 1050479018 /nfs/dbraw/zinc/47/90/18/1050479018.db2.gz VVCBTENAAKCJPO-LLVKDONJSA-N 1 2 306.397 4.116 20 0 DIADLO CC(C)OC1CC[NH+](Cc2cc(Cl)c(F)cc2F)CC1 ZINC001144130821 1050479825 /nfs/dbraw/zinc/47/98/25/1050479825.db2.gz QCRWLYULXOCUBO-UHFFFAOYSA-N 1 2 303.780 4.008 20 0 DIADLO Cc1ccc2ccccc2c1Nc1ccc[nH+]c1N1CCOCC1 ZINC001211117943 1050482461 /nfs/dbraw/zinc/48/24/61/1050482461.db2.gz GSBNXGHYHCXNJU-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO Fc1ccc2[nH]nc(C[N@@H+]3CCCC[C@H]3c3ccccc3)c2c1 ZINC001144191737 1050490255 /nfs/dbraw/zinc/49/02/55/1050490255.db2.gz XYNZHCNFUROMOU-IBGZPJMESA-N 1 2 309.388 4.429 20 0 DIADLO Fc1ccc2[nH]nc(C[N@H+]3CCCC[C@H]3c3ccccc3)c2c1 ZINC001144191737 1050490259 /nfs/dbraw/zinc/49/02/59/1050490259.db2.gz XYNZHCNFUROMOU-IBGZPJMESA-N 1 2 309.388 4.429 20 0 DIADLO Clc1cccc([C@H]2CSCC[N@@H+]2Cc2ccccn2)c1 ZINC001204059419 1050492710 /nfs/dbraw/zinc/49/27/10/1050492710.db2.gz BHADTCXKIHNNJD-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cccc([C@H]2CSCC[N@H+]2Cc2ccccn2)c1 ZINC001204059419 1050492716 /nfs/dbraw/zinc/49/27/16/1050492716.db2.gz BHADTCXKIHNNJD-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO CC(C)([NH2+]Cc1nc(C(F)F)no1)c1ccc2ccccc2c1 ZINC000626115830 1050502097 /nfs/dbraw/zinc/50/20/97/1050502097.db2.gz GSRAPANRLIDGQZ-UHFFFAOYSA-N 1 2 317.339 4.185 20 0 DIADLO CCOc1nnc(C[NH2+]C(C)(C)c2ccc(C(C)C)cc2)s1 ZINC000594381638 1050506258 /nfs/dbraw/zinc/50/62/58/1050506258.db2.gz RJTNUFNPEKXFNJ-UHFFFAOYSA-N 1 2 319.474 4.085 20 0 DIADLO COc1cc(Nc2ccc(C(F)(F)F)nc2Cl)[nH+]cc1C ZINC001211199826 1050516918 /nfs/dbraw/zinc/51/69/18/1050516918.db2.gz SODMMIQHOPRDSU-UHFFFAOYSA-N 1 2 317.698 4.209 20 0 DIADLO CO[C@H](c1ccccc1)[C@H](C)Nc1ccc([NH+]2CCCC2)cc1 ZINC000786870837 1050523595 /nfs/dbraw/zinc/52/35/95/1050523595.db2.gz GNPRNMFNYVSWAQ-JXFKEZNVSA-N 1 2 310.441 4.475 20 0 DIADLO CC[N@H+](Cn1nc(-c2cccc(Cl)c2)oc1=S)C1CCC1 ZINC000738052301 1050524449 /nfs/dbraw/zinc/52/44/49/1050524449.db2.gz HIRAOOWVHQSYQR-UHFFFAOYSA-N 1 2 323.849 4.358 20 0 DIADLO CC[N@@H+](Cn1nc(-c2cccc(Cl)c2)oc1=S)C1CCC1 ZINC000738052301 1050524458 /nfs/dbraw/zinc/52/44/58/1050524458.db2.gz HIRAOOWVHQSYQR-UHFFFAOYSA-N 1 2 323.849 4.358 20 0 DIADLO C[C@H](c1ccc2ccccc2c1)[N@H+](Cn1ccsc1=O)C1CC1 ZINC000746612161 1050524370 /nfs/dbraw/zinc/52/43/70/1050524370.db2.gz RFGWETPDVKGBEG-CQSZACIVSA-N 1 2 324.449 4.246 20 0 DIADLO C[C@H](c1ccc2ccccc2c1)[N@@H+](Cn1ccsc1=O)C1CC1 ZINC000746612161 1050524386 /nfs/dbraw/zinc/52/43/86/1050524386.db2.gz RFGWETPDVKGBEG-CQSZACIVSA-N 1 2 324.449 4.246 20 0 DIADLO COC[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccc(Cl)cc1 ZINC000786893694 1050526115 /nfs/dbraw/zinc/52/61/15/1050526115.db2.gz YOOOMYXGBNDJSQ-QGZVFWFLSA-N 1 2 304.821 4.206 20 0 DIADLO C[C@H]1CCCCC[N@@H+]1Cn1nc(Cc2cccs2)oc1=S ZINC000738226159 1050528723 /nfs/dbraw/zinc/52/87/23/1050528723.db2.gz VIMNCKIXEWIGLU-LBPRGKRZSA-N 1 2 323.487 4.080 20 0 DIADLO C[C@H]1CCCCC[N@H+]1Cn1nc(Cc2cccs2)oc1=S ZINC000738226159 1050528734 /nfs/dbraw/zinc/52/87/34/1050528734.db2.gz VIMNCKIXEWIGLU-LBPRGKRZSA-N 1 2 323.487 4.080 20 0 DIADLO Oc1ccc2c(c1)C[N@@H+](Cc1cc3ccccc3nc1Cl)CC2 ZINC000738324911 1050533438 /nfs/dbraw/zinc/53/34/38/1050533438.db2.gz WQWGTDAAGKMDFO-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1ccc2c(c1)C[N@H+](Cc1cc3ccccc3nc1Cl)CC2 ZINC000738324911 1050533450 /nfs/dbraw/zinc/53/34/50/1050533450.db2.gz WQWGTDAAGKMDFO-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO CCOC(=O)c1[nH]ccc1C[N@H+](C)[C@@H](C)c1ccccc1Cl ZINC001144337522 1050549935 /nfs/dbraw/zinc/54/99/35/1050549935.db2.gz FZKJNTKBXYKBBQ-LBPRGKRZSA-N 1 2 320.820 4.038 20 0 DIADLO CCOC(=O)c1[nH]ccc1C[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC001144337522 1050549952 /nfs/dbraw/zinc/54/99/52/1050549952.db2.gz FZKJNTKBXYKBBQ-LBPRGKRZSA-N 1 2 320.820 4.038 20 0 DIADLO COc1cc(Nc2cccn3cc[nH+]c23)cc(C(F)(F)F)c1 ZINC001211335159 1050550801 /nfs/dbraw/zinc/55/08/01/1050550801.db2.gz ZIWNMAHUPYLQBD-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc(Cl)nc2C(F)(F)F)o1 ZINC000787155596 1050556971 /nfs/dbraw/zinc/55/69/71/1050556971.db2.gz QQGGHIJVPXDZSO-UHFFFAOYSA-N 1 2 318.726 4.287 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc(Cl)nc2C(F)(F)F)o1 ZINC000787155596 1050556980 /nfs/dbraw/zinc/55/69/80/1050556980.db2.gz QQGGHIJVPXDZSO-UHFFFAOYSA-N 1 2 318.726 4.287 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000787181952 1050567185 /nfs/dbraw/zinc/56/71/85/1050567185.db2.gz YOLYSBCZIMVXQA-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(F)ccc1C[N@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000787181952 1050567199 /nfs/dbraw/zinc/56/71/99/1050567199.db2.gz YOLYSBCZIMVXQA-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(Cn2cc[nH+]c2)cc1)c1ccccc1 ZINC001144426096 1050571697 /nfs/dbraw/zinc/57/16/97/1050571697.db2.gz KSARCZFARYDRLH-INIZCTEOSA-N 1 2 319.408 4.064 20 0 DIADLO CCCCCC(CCCCC)NC(=O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000787249962 1050579531 /nfs/dbraw/zinc/57/95/31/1050579531.db2.gz NFEYYEVSBNIELZ-MRXNPFEDSA-N 1 2 319.493 4.091 20 0 DIADLO FC(F)(F)c1ccncc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213085449 1050582775 /nfs/dbraw/zinc/58/27/75/1050582775.db2.gz FZAXGJPUPIXUGS-UHFFFAOYSA-N 1 2 304.275 4.234 20 0 DIADLO C[C@@H](CC(=O)O[C@H](c1ccccc1)C1CCCC1)n1cc[nH+]c1 ZINC000845465864 1050583438 /nfs/dbraw/zinc/58/34/38/1050583438.db2.gz PVQGTYBBIYCOSL-HNAYVOBHSA-N 1 2 312.413 4.309 20 0 DIADLO CC1(c2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2)COC1 ZINC001213091929 1050585041 /nfs/dbraw/zinc/58/50/41/1050585041.db2.gz RYSWNPNJCTUXCC-UHFFFAOYSA-N 1 2 305.381 4.108 20 0 DIADLO Clc1ncnc2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc12 ZINC001213091989 1050585237 /nfs/dbraw/zinc/58/52/37/1050585237.db2.gz VTGFFKYUJBLPBI-UHFFFAOYSA-N 1 2 321.771 4.417 20 0 DIADLO Cc1ccc(CCCO)c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213090872 1050585987 /nfs/dbraw/zinc/58/59/87/1050585987.db2.gz KMMHGUYRJJGYLW-UHFFFAOYSA-N 1 2 307.397 4.054 20 0 DIADLO COC(=O)c1cc(C)c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1C ZINC001213090726 1050587181 /nfs/dbraw/zinc/58/71/81/1050587181.db2.gz CVQMGESVPLFBAF-UHFFFAOYSA-N 1 2 321.380 4.224 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+]2CCC(=O)[C@@H](C)C23CCCC3)c1 ZINC001144495192 1050601767 /nfs/dbraw/zinc/60/17/67/1050601767.db2.gz SCFJCGOYKMAMSV-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO COc1cc(Cl)cc(C[N@H+]2CCC(=O)[C@@H](C)C23CCCC3)c1 ZINC001144495192 1050601776 /nfs/dbraw/zinc/60/17/76/1050601776.db2.gz SCFJCGOYKMAMSV-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO CC(C)c1cc(N2CCC[C@@]3(CC3(F)F)C2)nc(C(C)C)[nH+]1 ZINC000845744987 1050612584 /nfs/dbraw/zinc/61/25/84/1050612584.db2.gz ZEUPVYLIYMEJKK-MRXNPFEDSA-N 1 2 309.404 4.349 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)cc(O)cc2F)cc1 ZINC001144554888 1050613839 /nfs/dbraw/zinc/61/38/39/1050613839.db2.gz LCSOCKZOPYGJKI-GOSISDBHSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2c(F)cc(O)cc2F)cc1 ZINC001144554888 1050613845 /nfs/dbraw/zinc/61/38/45/1050613845.db2.gz LCSOCKZOPYGJKI-GOSISDBHSA-N 1 2 303.352 4.316 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)cc(O)cc2F)cc1 ZINC001144555175 1050614638 /nfs/dbraw/zinc/61/46/38/1050614638.db2.gz YKFZGKCXRISPLS-GOSISDBHSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2c(F)cc(O)cc2F)cc1 ZINC001144555175 1050614642 /nfs/dbraw/zinc/61/46/42/1050614642.db2.gz YKFZGKCXRISPLS-GOSISDBHSA-N 1 2 319.351 4.016 20 0 DIADLO Oc1cc(F)c(C[N@H+](Cc2ccccc2)C2CCC2)c(F)c1 ZINC001144560948 1050618249 /nfs/dbraw/zinc/61/82/49/1050618249.db2.gz CVGOFHPJMFWSOE-UHFFFAOYSA-N 1 2 303.352 4.225 20 0 DIADLO Oc1cc(F)c(C[N@@H+](Cc2ccccc2)C2CCC2)c(F)c1 ZINC001144560948 1050618262 /nfs/dbraw/zinc/61/82/62/1050618262.db2.gz CVGOFHPJMFWSOE-UHFFFAOYSA-N 1 2 303.352 4.225 20 0 DIADLO CCOc1ccc([C@H]2CCCN2Cc2[nH+]cn3ccccc23)cc1 ZINC001144624272 1050628774 /nfs/dbraw/zinc/62/87/74/1050628774.db2.gz BXKGYZJTMFTJMQ-LJQANCHMSA-N 1 2 321.424 4.070 20 0 DIADLO CC(C)c1cc(N2CC[C@H](c3cccnc3)C2)nc(C(C)C)[nH+]1 ZINC000575056179 1050629190 /nfs/dbraw/zinc/62/91/90/1050629190.db2.gz WCVIJUNFHRMGKY-INIZCTEOSA-N 1 2 310.445 4.112 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@H](C)CCCC(C)C)[C@H]2C ZINC001170079457 1050629748 /nfs/dbraw/zinc/62/97/48/1050629748.db2.gz DIIXYTAHGLRMPL-CVEARBPZSA-N 1 2 307.482 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@H](C)CCCC(C)C)[C@H]2C ZINC001170079457 1050629754 /nfs/dbraw/zinc/62/97/54/1050629754.db2.gz DIIXYTAHGLRMPL-CVEARBPZSA-N 1 2 307.482 4.011 20 0 DIADLO C[C@H]1C[C@H](C)[N@H+](Cn2nc(-c3ccccc3)sc2=S)C1 ZINC000740859024 1050632842 /nfs/dbraw/zinc/63/28/42/1050632842.db2.gz IHFRJNVGMIGQAH-RYUDHWBXSA-N 1 2 305.472 4.029 20 0 DIADLO C[C@H]1C[C@H](C)[N@@H+](Cn2nc(-c3ccccc3)sc2=S)C1 ZINC000740859024 1050632846 /nfs/dbraw/zinc/63/28/46/1050632846.db2.gz IHFRJNVGMIGQAH-RYUDHWBXSA-N 1 2 305.472 4.029 20 0 DIADLO COc1cccc(C(F)(F)F)c1Nc1ccn2cc[nH+]c2c1 ZINC001213343131 1050635806 /nfs/dbraw/zinc/63/58/06/1050635806.db2.gz JFWATPCERUSBAU-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO Oc1cc(F)c(C[NH+]2CCC(Cc3ccccc3)CC2)cc1F ZINC001144647128 1050638829 /nfs/dbraw/zinc/63/88/29/1050638829.db2.gz ZTDLPHOHKWIAMP-UHFFFAOYSA-N 1 2 317.379 4.125 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)Cc1noc2c1CCCC2 ZINC000595550239 1050641965 /nfs/dbraw/zinc/64/19/65/1050641965.db2.gz SRJHYIIADMXUSR-UHFFFAOYSA-N 1 2 324.424 4.494 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)Cc1noc2c1CCCC2 ZINC000595550239 1050641971 /nfs/dbraw/zinc/64/19/71/1050641971.db2.gz SRJHYIIADMXUSR-UHFFFAOYSA-N 1 2 324.424 4.494 20 0 DIADLO CC(C)[C@H]1CC[C@H](C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001144643974 1050643455 /nfs/dbraw/zinc/64/34/55/1050643455.db2.gz QYDDLKOGWREJRV-WKILWMFISA-N 1 2 311.429 4.273 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)c(O)cc2F)cc1 ZINC001144665884 1050645238 /nfs/dbraw/zinc/64/52/38/1050645238.db2.gz CYDXHYZLFABRCE-QGZVFWFLSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)c(O)cc2F)cc1 ZINC001144665884 1050645252 /nfs/dbraw/zinc/64/52/52/1050645252.db2.gz CYDXHYZLFABRCE-QGZVFWFLSA-N 1 2 303.352 4.316 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)cc1F ZINC001144658482 1050649621 /nfs/dbraw/zinc/64/96/21/1050649621.db2.gz YDPZQYIVKFXQBU-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)cc1F ZINC001144658482 1050649625 /nfs/dbraw/zinc/64/96/25/1050649625.db2.gz YDPZQYIVKFXQBU-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO Cc1cn2c(cccc2Nc2cc(F)c(OC(C)C)c(F)c2)[nH+]1 ZINC001213417427 1050651031 /nfs/dbraw/zinc/65/10/31/1050651031.db2.gz POAGJPPUWUVCRY-UHFFFAOYSA-N 1 2 317.339 4.452 20 0 DIADLO CC(C)Oc1c(F)cc(Nc2cccn3cc[nH+]c23)cc1F ZINC001213417386 1050651210 /nfs/dbraw/zinc/65/12/10/1050651210.db2.gz NDCWSTJHVZQZQK-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO Clc1cc(Br)cc(C[N@@H+]2CCC[C@@H]3C[C@@H]32)c1 ZINC001144693351 1050660087 /nfs/dbraw/zinc/66/00/87/1050660087.db2.gz CWEBDGAZGXHZLB-MFKMUULPSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1cc(Br)cc(C[N@H+]2CCC[C@@H]3C[C@@H]32)c1 ZINC001144693351 1050660093 /nfs/dbraw/zinc/66/00/93/1050660093.db2.gz CWEBDGAZGXHZLB-MFKMUULPSA-N 1 2 300.627 4.087 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1occc1Br ZINC000227364752 1050661163 /nfs/dbraw/zinc/66/11/63/1050661163.db2.gz XIVHPSCAIDOPSJ-LLVKDONJSA-N 1 2 324.218 4.210 20 0 DIADLO COC(=O)c1oc([C@@H](C)[N@@H+]2CC[C@@H]2c2ccc(F)cc2)cc1C ZINC000595701874 1050663713 /nfs/dbraw/zinc/66/37/13/1050663713.db2.gz GWQHSAFMQWJGQZ-IUODEOHRSA-N 1 2 317.360 4.022 20 0 DIADLO COC(=O)c1oc([C@@H](C)[N@H+]2CC[C@@H]2c2ccc(F)cc2)cc1C ZINC000595701874 1050663718 /nfs/dbraw/zinc/66/37/18/1050663718.db2.gz GWQHSAFMQWJGQZ-IUODEOHRSA-N 1 2 317.360 4.022 20 0 DIADLO Cc1cc(Br)nc(Nc2cc(C3CC3)c[nH+]c2C)c1 ZINC001213491814 1050670073 /nfs/dbraw/zinc/67/00/73/1050670073.db2.gz QVEAZEICBPIMJS-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccnn1-c1ccccc1F ZINC001213497588 1050671512 /nfs/dbraw/zinc/67/15/12/1050671512.db2.gz WJJQRABAFWLBNZ-UHFFFAOYSA-N 1 2 308.360 4.336 20 0 DIADLO Cc1ncc(C2CC2)cc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001213499590 1050672189 /nfs/dbraw/zinc/67/21/89/1050672189.db2.gz QYQOMMZFDYXQTF-UHFFFAOYSA-N 1 2 304.397 4.256 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnc2cc(C(C)C)nn2c1 ZINC001213497490 1050672513 /nfs/dbraw/zinc/67/25/13/1050672513.db2.gz RFGGWWXZVMUWQC-UHFFFAOYSA-N 1 2 307.401 4.177 20 0 DIADLO COc1cc(OC)c(OC)cc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213500897 1050673684 /nfs/dbraw/zinc/67/36/84/1050673684.db2.gz BTSJMNFUAHMSSK-UHFFFAOYSA-N 1 2 314.385 4.037 20 0 DIADLO CC(=O)Oc1ccc(F)c(Nc2cc(C3CC3)c[nH+]c2C)c1 ZINC001213503515 1050674050 /nfs/dbraw/zinc/67/40/50/1050674050.db2.gz KFVAGNNXXMDZNQ-UHFFFAOYSA-N 1 2 300.333 4.075 20 0 DIADLO Cc1cc(C)c(Nc2ncccc2OCc2ccccc2)c[nH+]1 ZINC001213503582 1050674117 /nfs/dbraw/zinc/67/41/17/1050674117.db2.gz NHRNMPJRMWLNSN-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO COCCCN(c1ccccc1N)c1cc(C2CC2)c[nH+]c1C ZINC001213503688 1050674490 /nfs/dbraw/zinc/67/44/90/1050674490.db2.gz SMUHCYVXKUGJCO-UHFFFAOYSA-N 1 2 311.429 4.024 20 0 DIADLO Cc1cc(C(=O)N(C)C)ccc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213500940 1050674635 /nfs/dbraw/zinc/67/46/35/1050674635.db2.gz FAOQHNFPABUKEG-UHFFFAOYSA-N 1 2 309.413 4.021 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2cc(F)c(F)cc2Cl)c1 ZINC001144725942 1050675176 /nfs/dbraw/zinc/67/51/76/1050675176.db2.gz BGJHESJMJLQONW-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2cc(F)c(F)cc2Cl)c1 ZINC001144725942 1050675180 /nfs/dbraw/zinc/67/51/80/1050675180.db2.gz BGJHESJMJLQONW-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COC(=O)[C@@H](C)c1ccc(Nc2cc(C3CC3)c[nH+]c2C)cc1 ZINC001213503788 1050675261 /nfs/dbraw/zinc/67/52/61/1050675261.db2.gz YFUOBSZDYQNLMF-LBPRGKRZSA-N 1 2 310.397 4.288 20 0 DIADLO Cc1cc(C)c(Nc2ccc(-c3ccc(N)c(O)c3)cc2O)c[nH+]1 ZINC001213518336 1050676061 /nfs/dbraw/zinc/67/60/61/1050676061.db2.gz IMXNVWXKDJILMV-UHFFFAOYSA-N 1 2 321.380 4.102 20 0 DIADLO COc1ccc(Cn2ncc(C)c2Nc2c[nH+]c(C)cc2C)cc1 ZINC001213511124 1050676094 /nfs/dbraw/zinc/67/60/94/1050676094.db2.gz XRZNKFPQDHJMRB-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1ncc([C@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)s1 ZINC000179917859 1050678448 /nfs/dbraw/zinc/67/84/48/1050678448.db2.gz PTGUCVRZIWLVBD-LBPRGKRZSA-N 1 2 302.447 4.010 20 0 DIADLO COc1ccc(Br)cc1Nc1c[nH+]cc(C)c1C ZINC001213529084 1050678592 /nfs/dbraw/zinc/67/85/92/1050678592.db2.gz VQUZRCAAMLCSST-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1c[nH+]cc(Nc2cc(Br)cnc2Cl)c1C ZINC001213524682 1050680142 /nfs/dbraw/zinc/68/01/42/1050680142.db2.gz CXOYHTUOOJCEHG-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO COc1ccc(Cn2nc(C)cc2Nc2c[nH+]cc(C)c2C)cc1 ZINC001213527351 1050680229 /nfs/dbraw/zinc/68/02/29/1050680229.db2.gz HKAHTTFZRNTTQS-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1c[nH+]cc(Nc2ccccc2C(=O)Nc2cccnc2)c1C ZINC001213530840 1050681272 /nfs/dbraw/zinc/68/12/72/1050681272.db2.gz NYHIZKXTXZYLQO-UHFFFAOYSA-N 1 2 318.380 4.089 20 0 DIADLO Cc1c[nH+]cc(Nc2ccccc2-c2nc(CO)cs2)c1C ZINC001213536934 1050681301 /nfs/dbraw/zinc/68/13/01/1050681301.db2.gz SVQDIZSZOOXCOZ-UHFFFAOYSA-N 1 2 311.410 4.058 20 0 DIADLO Cc1c[nH+]cc(Nc2cc(F)ccc2OC[C@H]2CCCO2)c1C ZINC001213531285 1050681789 /nfs/dbraw/zinc/68/17/89/1050681789.db2.gz ZKXGMCSUGZPSMM-OAHLLOKOSA-N 1 2 316.376 4.139 20 0 DIADLO CCOC(=O)c1ccc2ccc(Nc3c[nH+]cc(C)c3C)cc2n1 ZINC001213534292 1050682140 /nfs/dbraw/zinc/68/21/40/1050682140.db2.gz VPYUAPRYDYLCBK-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO c1ccc(N2CCCC2)c(Nc2ccc[nH+]c2N2CCCCC2)c1 ZINC001213601755 1050690481 /nfs/dbraw/zinc/69/04/81/1050690481.db2.gz CSYSDOOVZBARAU-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO c1ccc(N2CCCC2)c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001213605762 1050692579 /nfs/dbraw/zinc/69/25/79/1050692579.db2.gz OWYPUHAWXBMOKF-UHFFFAOYSA-N 1 2 308.429 4.026 20 0 DIADLO Clc1cc(Nc2ccccc2N2CCCC2)cn2cc[nH+]c12 ZINC001213603741 1050693405 /nfs/dbraw/zinc/69/34/05/1050693405.db2.gz BUJHFZLJWNXDIO-UHFFFAOYSA-N 1 2 312.804 4.332 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+]1CCc2ccccc2[C@H]1C ZINC001144744971 1050694404 /nfs/dbraw/zinc/69/44/04/1050694404.db2.gz JYALZZNVUWITJO-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+]1CCc2ccccc2[C@H]1C ZINC001144744971 1050694409 /nfs/dbraw/zinc/69/44/09/1050694409.db2.gz JYALZZNVUWITJO-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)CC[C@@]1(C)O ZINC001231599042 1050695962 /nfs/dbraw/zinc/69/59/62/1050695962.db2.gz ZLIDLPJOLVIPRA-YMTOWFKASA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)CC[C@@]1(C)O ZINC001231599042 1050695972 /nfs/dbraw/zinc/69/59/72/1050695972.db2.gz ZLIDLPJOLVIPRA-YMTOWFKASA-N 1 2 322.663 4.240 20 0 DIADLO CN(c1ccc(COc2ccccc2)cc1)c1[nH+]cccc1N ZINC001213615323 1050697878 /nfs/dbraw/zinc/69/78/78/1050697878.db2.gz RBTOYAKQVFFFPO-UHFFFAOYSA-N 1 2 305.381 4.011 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001144754856 1050700741 /nfs/dbraw/zinc/70/07/41/1050700741.db2.gz OWOZUQYLRYXSEY-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001144754856 1050700757 /nfs/dbraw/zinc/70/07/57/1050700757.db2.gz OWOZUQYLRYXSEY-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+](C)Cc1ccc(Cl)cc1 ZINC001144755384 1050701348 /nfs/dbraw/zinc/70/13/48/1050701348.db2.gz ZINPMOQRFMDBJP-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001144755384 1050701363 /nfs/dbraw/zinc/70/13/63/1050701363.db2.gz ZINPMOQRFMDBJP-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+][C@@H]1CCc2ccc(Cl)nc21 ZINC000788575482 1050709680 /nfs/dbraw/zinc/70/96/80/1050709680.db2.gz XGBLQIZGIUJEPW-CYBMUJFWSA-N 1 2 311.187 4.305 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1SC(C)(C)C)c1nncn1C ZINC000788589419 1050710179 /nfs/dbraw/zinc/71/01/79/1050710179.db2.gz RFMJZXPGEVJVLQ-QWHCGFSZSA-N 1 2 318.490 4.118 20 0 DIADLO CC[N@H+](CC(=O)Nc1ccc(C)c(Cl)c1)Cc1occc1C ZINC001171239589 1050736812 /nfs/dbraw/zinc/73/68/12/1050736812.db2.gz BYFQRUZUQALCFJ-UHFFFAOYSA-N 1 2 320.820 4.010 20 0 DIADLO CC[N@@H+](CC(=O)Nc1ccc(C)c(Cl)c1)Cc1occc1C ZINC001171239589 1050736824 /nfs/dbraw/zinc/73/68/24/1050736824.db2.gz BYFQRUZUQALCFJ-UHFFFAOYSA-N 1 2 320.820 4.010 20 0 DIADLO COc1ccc(C(C)C)cc1C[N@@H+]1CCC[C@H]1c1cc(C)on1 ZINC000846765828 1050745341 /nfs/dbraw/zinc/74/53/41/1050745341.db2.gz DZYRANVIPIESFF-SFHVURJKSA-N 1 2 314.429 4.452 20 0 DIADLO COc1ccc(C(C)C)cc1C[N@H+]1CCC[C@H]1c1cc(C)on1 ZINC000846765828 1050745351 /nfs/dbraw/zinc/74/53/51/1050745351.db2.gz DZYRANVIPIESFF-SFHVURJKSA-N 1 2 314.429 4.452 20 0 DIADLO COc1cccc(Nc2[nH+]cccc2N2CCCC2)c1C1CC1 ZINC001213802916 1050746379 /nfs/dbraw/zinc/74/63/79/1050746379.db2.gz IZGOXGRGJVVHSR-UHFFFAOYSA-N 1 2 309.413 4.311 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1SC(C)(C)C)c1ncnn1C ZINC000788778093 1050752319 /nfs/dbraw/zinc/75/23/19/1050752319.db2.gz QUHIBGQLWGNKFU-STQMWFEESA-N 1 2 318.490 4.118 20 0 DIADLO O[C@H](c1ccc(-c2cccc(Cn3cc[nH+]c3)c2)cc1)C1CCC1 ZINC000846781082 1050752468 /nfs/dbraw/zinc/75/24/68/1050752468.db2.gz ZOPNUZFSOZRFGV-NRFANRHFSA-N 1 2 318.420 4.432 20 0 DIADLO CC(C)(C)OCCCCO[NH+]=C(N)c1cccc2ccccc21 ZINC000788786448 1050755566 /nfs/dbraw/zinc/75/55/66/1050755566.db2.gz IFPLJNBIBXYRSV-UHFFFAOYSA-N 1 2 314.429 4.282 20 0 DIADLO Cc1ncc(C(F)(F)F)cc1Nc1ccc2c(c1)[nH+]cn2C ZINC001213830896 1050757425 /nfs/dbraw/zinc/75/74/25/1050757425.db2.gz QGUBWCZUXWQMBG-UHFFFAOYSA-N 1 2 306.291 4.039 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846797163 1050758206 /nfs/dbraw/zinc/75/82/06/1050758206.db2.gz QTLHKSGSHDMGGS-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846797163 1050758225 /nfs/dbraw/zinc/75/82/25/1050758225.db2.gz QTLHKSGSHDMGGS-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846797162 1050758690 /nfs/dbraw/zinc/75/86/90/1050758690.db2.gz QTLHKSGSHDMGGS-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846797162 1050758706 /nfs/dbraw/zinc/75/87/06/1050758706.db2.gz QTLHKSGSHDMGGS-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Fc1cc(N2CCCC2)ccc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001213850058 1050764388 /nfs/dbraw/zinc/76/43/88/1050764388.db2.gz WDPJKYMVOVUDTK-UHFFFAOYSA-N 1 2 322.387 4.355 20 0 DIADLO CCC[C@H]([NH2+]Cc1cnsn1)c1ccc(Cl)c(Cl)c1 ZINC000846844848 1050770176 /nfs/dbraw/zinc/77/01/76/1050770176.db2.gz QKNGORRRDPFQDT-ZDUSSCGKSA-N 1 2 316.257 4.476 20 0 DIADLO FC(F)(F)Cc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)cn1 ZINC001213916398 1050777504 /nfs/dbraw/zinc/77/75/04/1050777504.db2.gz OYSZILPJMWWOAK-UHFFFAOYSA-N 1 2 318.302 4.116 20 0 DIADLO CC(=O)C1CC[NH+]([C@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000846951864 1050788867 /nfs/dbraw/zinc/78/88/67/1050788867.db2.gz CBLDMSWQBPWZPL-SNVBAGLBSA-N 1 2 300.229 4.355 20 0 DIADLO O=c1[nH]ccc2ccc(Nc3ccc[nH+]c3N3CCCCC3)cc21 ZINC001213954248 1050789109 /nfs/dbraw/zinc/78/91/09/1050789109.db2.gz ULPOKKINPCRWSW-UHFFFAOYSA-N 1 2 320.396 4.069 20 0 DIADLO C/C(=C\C(=O)Nc1cccc2[nH+]ccn21)c1ccccc1Cl ZINC000741969502 1050790309 /nfs/dbraw/zinc/79/03/09/1050790309.db2.gz DNFAPMNTECCYOX-VAWYXSNFSA-N 1 2 311.772 4.030 20 0 DIADLO CCCCCC[C@H](C)C(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC000742058184 1050797544 /nfs/dbraw/zinc/79/75/44/1050797544.db2.gz QXLWFBXWEFVQEF-AWEZNQCLSA-N 1 2 320.477 4.272 20 0 DIADLO CCC[N@H+](CC)Cn1nc(-c2ccc(Cl)s2)oc1=S ZINC000742147420 1050804675 /nfs/dbraw/zinc/80/46/75/1050804675.db2.gz GYFUSSVYEFFVLI-UHFFFAOYSA-N 1 2 317.867 4.277 20 0 DIADLO CCC[N@@H+](CC)Cn1nc(-c2ccc(Cl)s2)oc1=S ZINC000742147420 1050804691 /nfs/dbraw/zinc/80/46/91/1050804691.db2.gz GYFUSSVYEFFVLI-UHFFFAOYSA-N 1 2 317.867 4.277 20 0 DIADLO COc1cc(F)c(Nc2ccc3c(c2)[nH+]cn3C)cc1Cl ZINC001214065401 1050809579 /nfs/dbraw/zinc/80/95/79/1050809579.db2.gz QYSHCXURESHJKI-UHFFFAOYSA-N 1 2 305.740 4.118 20 0 DIADLO NC(Cc1cccs1)=[NH+]OCc1cc(Cl)ccc1Cl ZINC000742358344 1050819928 /nfs/dbraw/zinc/81/99/28/1050819928.db2.gz BWYMEBXQJPTUOH-UHFFFAOYSA-N 1 2 315.225 4.296 20 0 DIADLO Cc1ccc(N2CCC[C@@H](Nc3cc(C)[nH+]c(C4CC4)n3)C2)cc1 ZINC000742420548 1050844114 /nfs/dbraw/zinc/84/41/14/1050844114.db2.gz JMSJQTQDBBIMQF-QGZVFWFLSA-N 1 2 322.456 4.052 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)[C@@H]2CCCCC2(C)C)n1 ZINC000789904094 1050895637 /nfs/dbraw/zinc/89/56/37/1050895637.db2.gz JNGXKPIDVXCWTE-AWEZNQCLSA-N 1 2 323.506 4.140 20 0 DIADLO CCCCC[C@@H](C)CC(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000742590645 1050896940 /nfs/dbraw/zinc/89/69/40/1050896940.db2.gz SBERZDTZNXIFEB-MRXNPFEDSA-N 1 2 313.445 4.095 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1c(Cl)cc(F)cc1Cl ZINC001214475456 1050915712 /nfs/dbraw/zinc/91/57/12/1050915712.db2.gz WJKGJKDKQJNSBL-UHFFFAOYSA-N 1 2 310.159 4.362 20 0 DIADLO Oc1c(F)cc(Nc2ccc[nH+]c2N2CCCCC2)cc1Cl ZINC001214480472 1050917798 /nfs/dbraw/zinc/91/77/98/1050917798.db2.gz RKYJVDYHFGLVMT-UHFFFAOYSA-N 1 2 321.783 4.314 20 0 DIADLO Oc1c(F)cc(Nc2cccc(-n3cc[nH+]c3)c2)cc1Cl ZINC001214486337 1050920682 /nfs/dbraw/zinc/92/06/82/1050920682.db2.gz BKZSZCBPCPTHKK-UHFFFAOYSA-N 1 2 303.724 4.114 20 0 DIADLO Cn1nccc1[C@@H]1CCC[C@H](Nc2ccc([NH+]3CCCC3)cc2)C1 ZINC000790493459 1050962970 /nfs/dbraw/zinc/96/29/70/1050962970.db2.gz ADCRYYLULGPXBD-AEFFLSMTSA-N 1 2 324.472 4.159 20 0 DIADLO Cn1nccc1[C@@H]1CCC[C@H]([NH2+]c2ccc(N3CCCC3)cc2)C1 ZINC000790493459 1050962984 /nfs/dbraw/zinc/96/29/84/1050962984.db2.gz ADCRYYLULGPXBD-AEFFLSMTSA-N 1 2 324.472 4.159 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1c(Cl)cccc1OC ZINC000790699855 1050986568 /nfs/dbraw/zinc/98/65/68/1050986568.db2.gz ZTGGYMFQKUHRIB-JTQLQIEISA-N 1 2 308.809 4.058 20 0 DIADLO CC(=O)c1ccc(F)c(Nc2cccc(-n3cc[nH+]c3)c2)c1F ZINC001214762982 1050995734 /nfs/dbraw/zinc/99/57/34/1050995734.db2.gz UTUDNHNTEVRKOY-UHFFFAOYSA-N 1 2 313.307 4.097 20 0 DIADLO Cc1[nH+]c2c(Nc3ccc(Cl)c(O)c3F)cccn2c1C ZINC001214798473 1051004701 /nfs/dbraw/zinc/00/47/01/1051004701.db2.gz TXEAKKYDUBXZLF-UHFFFAOYSA-N 1 2 305.740 4.193 20 0 DIADLO Oc1c(Cl)ccc(Nc2cccc(Cn3cc[nH+]c3)c2)c1F ZINC001214799161 1051005354 /nfs/dbraw/zinc/00/53/54/1051005354.db2.gz OKPYDGSDETXJJM-UHFFFAOYSA-N 1 2 317.751 4.173 20 0 DIADLO Clc1sccc1C[NH2+]Cc1nc(-c2ccncc2)cs1 ZINC000790965270 1051011677 /nfs/dbraw/zinc/01/16/77/1051011677.db2.gz AUCQSQNEBFDXMI-UHFFFAOYSA-N 1 2 321.858 4.210 20 0 DIADLO CCCCCC[C@H](C)C(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000743319537 1051012485 /nfs/dbraw/zinc/01/24/85/1051012485.db2.gz HTWOVRNDYYVMJL-INIZCTEOSA-N 1 2 313.445 4.095 20 0 DIADLO CCn1c(C)nn(C[N@@H+]2CCCC3(C2)CCCCCC3)c1=S ZINC000743386373 1051019479 /nfs/dbraw/zinc/01/94/79/1051019479.db2.gz WXOLXQJBKPOMEP-UHFFFAOYSA-N 1 2 322.522 4.136 20 0 DIADLO CCn1c(C)nn(C[N@H+]2CCCC3(C2)CCCCCC3)c1=S ZINC000743386373 1051019492 /nfs/dbraw/zinc/01/94/92/1051019492.db2.gz WXOLXQJBKPOMEP-UHFFFAOYSA-N 1 2 322.522 4.136 20 0 DIADLO S=c1n(C2CC2)cnn1C[N@@H+]1CCCC2(C1)CCCCCC2 ZINC000743385791 1051020300 /nfs/dbraw/zinc/02/03/00/1051020300.db2.gz NXNVLBSCYSMJDW-UHFFFAOYSA-N 1 2 320.506 4.143 20 0 DIADLO S=c1n(C2CC2)cnn1C[N@H+]1CCCC2(C1)CCCCCC2 ZINC000743385791 1051020315 /nfs/dbraw/zinc/02/03/15/1051020315.db2.gz NXNVLBSCYSMJDW-UHFFFAOYSA-N 1 2 320.506 4.143 20 0 DIADLO CCC[C@]1(C)CCC[N@H+](Cn2nc3n(c2=S)CCCCC3)C1 ZINC000743404955 1051025363 /nfs/dbraw/zinc/02/53/63/1051025363.db2.gz ZNDQSEZZSGJRQO-QGZVFWFLSA-N 1 2 322.522 4.000 20 0 DIADLO CCC[C@]1(C)CCC[N@@H+](Cn2nc3n(c2=S)CCCCC3)C1 ZINC000743404955 1051025376 /nfs/dbraw/zinc/02/53/76/1051025376.db2.gz ZNDQSEZZSGJRQO-QGZVFWFLSA-N 1 2 322.522 4.000 20 0 DIADLO CC(=O)c1ccc(Nc2cccc(-n3cc[nH+]c3)c2)c(F)c1F ZINC001214983419 1051043283 /nfs/dbraw/zinc/04/32/83/1051043283.db2.gz CFJRFSKXTZTBMG-UHFFFAOYSA-N 1 2 313.307 4.097 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2cccc(F)c2)C(C)(C)C)n1 ZINC000181055077 1051048726 /nfs/dbraw/zinc/04/87/26/1051048726.db2.gz IJPYESXUNNUFCA-MRXNPFEDSA-N 1 2 305.397 4.038 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](c2cccc(F)c2)C(C)(C)C)n1 ZINC000181055059 1051049082 /nfs/dbraw/zinc/04/90/82/1051049082.db2.gz IJPYESXUNNUFCA-INIZCTEOSA-N 1 2 305.397 4.038 20 0 DIADLO CC(C)(C)c1noc(C[NH2+][C@@H](c2cccc(F)c2)C(C)(C)C)n1 ZINC000181072295 1051052936 /nfs/dbraw/zinc/05/29/36/1051052936.db2.gz OYSCWABBLUCHFS-HNNXBMFYSA-N 1 2 319.424 4.383 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc(CO)c(F)c3F)ccc12 ZINC001215041063 1051059557 /nfs/dbraw/zinc/05/95/57/1051059557.db2.gz DEIONYUZRZOBTL-UHFFFAOYSA-N 1 2 300.308 4.057 20 0 DIADLO CCc1cnc(C[N@@H+](CC)Cc2ccc(C(F)(F)F)cc2)o1 ZINC000743842615 1051068692 /nfs/dbraw/zinc/06/86/92/1051068692.db2.gz IOSRWCZDZYMOFK-UHFFFAOYSA-N 1 2 312.335 4.278 20 0 DIADLO CCc1cnc(C[N@H+](CC)Cc2ccc(C(F)(F)F)cc2)o1 ZINC000743842615 1051068700 /nfs/dbraw/zinc/06/87/00/1051068700.db2.gz IOSRWCZDZYMOFK-UHFFFAOYSA-N 1 2 312.335 4.278 20 0 DIADLO FC(F)(F)c1cccc(C[N@@H+]2CCOC3(CCCCC3)C2)c1 ZINC000743852997 1051078073 /nfs/dbraw/zinc/07/80/73/1051078073.db2.gz XNLPBTOUTGEOFI-UHFFFAOYSA-N 1 2 313.363 4.241 20 0 DIADLO FC(F)(F)c1cccc(C[N@H+]2CCOC3(CCCCC3)C2)c1 ZINC000743852997 1051078080 /nfs/dbraw/zinc/07/80/80/1051078080.db2.gz XNLPBTOUTGEOFI-UHFFFAOYSA-N 1 2 313.363 4.241 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ncc(Br)s2)cs1 ZINC000714936002 1051097330 /nfs/dbraw/zinc/09/73/30/1051097330.db2.gz DKKPRJGPPNGDSE-QMMMGPOBSA-N 1 2 317.277 4.126 20 0 DIADLO Cc1cn2cccc(Nc3c(F)ccc(OC(C)C)c3F)c2[nH+]1 ZINC001215172670 1051101674 /nfs/dbraw/zinc/10/16/74/1051101674.db2.gz JNMPCGQTAOOGQU-UHFFFAOYSA-N 1 2 317.339 4.452 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cn1cc(-c2ccccc2)cn1 ZINC000744130373 1051118847 /nfs/dbraw/zinc/11/88/47/1051118847.db2.gz JUJDINBZMKFONH-CQSZACIVSA-N 1 2 309.438 4.188 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cn1cc(-c2ccccc2)cn1 ZINC000744130373 1051118857 /nfs/dbraw/zinc/11/88/57/1051118857.db2.gz JUJDINBZMKFONH-CQSZACIVSA-N 1 2 309.438 4.188 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)nc1Cl ZINC001170232919 1051158361 /nfs/dbraw/zinc/15/83/61/1051158361.db2.gz PQGZIUGRLVCVKM-WCQYABFASA-N 1 2 319.663 4.059 20 0 DIADLO Fc1cccc(F)c1C[N@H+](Cc1ccc2c(c1)COC2)C1CC1 ZINC000792183462 1051124611 /nfs/dbraw/zinc/12/46/11/1051124611.db2.gz OFRXHIMPGXIDOT-UHFFFAOYSA-N 1 2 315.363 4.160 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](Cc1ccc2c(c1)COC2)C1CC1 ZINC000792183462 1051124616 /nfs/dbraw/zinc/12/46/16/1051124616.db2.gz OFRXHIMPGXIDOT-UHFFFAOYSA-N 1 2 315.363 4.160 20 0 DIADLO Cc1c(F)cccc1-c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001215268797 1051144993 /nfs/dbraw/zinc/14/49/93/1051144993.db2.gz WRFXIPRUDHNBAT-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)OC(=O)CCCn1cc[nH+]c1 ZINC000792553383 1051145897 /nfs/dbraw/zinc/14/58/97/1051145897.db2.gz SRYYTBMNYCZDIF-CQSZACIVSA-N 1 2 312.369 4.022 20 0 DIADLO COCc1ccc(C[N@@H+]2CCc3sc(Cl)cc3C2)cc1 ZINC001171532398 1051152078 /nfs/dbraw/zinc/15/20/78/1051152078.db2.gz AFZTYBCPESMWNX-UHFFFAOYSA-N 1 2 307.846 4.106 20 0 DIADLO COCc1ccc(C[N@H+]2CCc3sc(Cl)cc3C2)cc1 ZINC001171532398 1051152084 /nfs/dbraw/zinc/15/20/84/1051152084.db2.gz AFZTYBCPESMWNX-UHFFFAOYSA-N 1 2 307.846 4.106 20 0 DIADLO C[C@@]12CC[N@H+](Cc3cc(Cl)ccc3F)C[C@@H]1C2(Cl)Cl ZINC001170231064 1051156101 /nfs/dbraw/zinc/15/61/01/1051156101.db2.gz ISOIMYWJIZFLSF-QWHCGFSZSA-N 1 2 322.638 4.495 20 0 DIADLO C[C@@]12CC[N@@H+](Cc3cc(Cl)ccc3F)C[C@@H]1C2(Cl)Cl ZINC001170231064 1051156108 /nfs/dbraw/zinc/15/61/08/1051156108.db2.gz ISOIMYWJIZFLSF-QWHCGFSZSA-N 1 2 322.638 4.495 20 0 DIADLO Cc1ccc(C)c(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)c1 ZINC001215295498 1051156223 /nfs/dbraw/zinc/15/62/23/1051156223.db2.gz GWBVTVFWQVZFHK-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Cc1ccc(C)c(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)c1 ZINC001215295491 1051156793 /nfs/dbraw/zinc/15/67/93/1051156793.db2.gz GPEFBISYYSRUOL-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)nc1Cl ZINC001170232919 1051158352 /nfs/dbraw/zinc/15/83/52/1051158352.db2.gz PQGZIUGRLVCVKM-WCQYABFASA-N 1 2 319.663 4.059 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC001170254806 1051175879 /nfs/dbraw/zinc/17/58/79/1051175879.db2.gz WZMBJULYJBZNFI-ZIAGYGMSSA-N 1 2 318.219 4.276 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC001170254806 1051175882 /nfs/dbraw/zinc/17/58/82/1051175882.db2.gz WZMBJULYJBZNFI-ZIAGYGMSSA-N 1 2 318.219 4.276 20 0 DIADLO CC[C@@H]([NH2+]Cc1cnc(C)s1)c1nc(C(F)(F)F)cs1 ZINC000744448987 1051178556 /nfs/dbraw/zinc/17/85/56/1051178556.db2.gz PYSNJGJPVKLELQ-SECBINFHSA-N 1 2 321.393 4.168 20 0 DIADLO CC1(C)CC(Nc2ccc(Cn3cc[nH+]c3)cc2)CC(C)(C)O1 ZINC001170361209 1051189611 /nfs/dbraw/zinc/18/96/11/1051189611.db2.gz GFEWXIWFDYVXIH-UHFFFAOYSA-N 1 2 313.445 4.080 20 0 DIADLO CCOc1c(Nc2ccc(N3CCCC3)[nH+]c2)ccc(F)c1F ZINC001215412940 1051193225 /nfs/dbraw/zinc/19/32/25/1051193225.db2.gz IQACFRCPHOTJLG-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO COc1cccc2c1C[N@@H+]([C@H](C)c1c(F)cccc1F)CC2 ZINC001170341767 1051193538 /nfs/dbraw/zinc/19/35/38/1051193538.db2.gz DXYOPZOGHPPFSO-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cccc2c1C[N@H+]([C@H](C)c1c(F)cccc1F)CC2 ZINC001170341767 1051193540 /nfs/dbraw/zinc/19/35/40/1051193540.db2.gz DXYOPZOGHPPFSO-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO CC(C)Oc1c(F)c(F)ccc1Nc1cccc2[nH+]ccn21 ZINC001215420646 1051198050 /nfs/dbraw/zinc/19/80/50/1051198050.db2.gz FOOOHJFVVMSIRM-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO CC[C@H]1C[N@H+](Cc2cccc(C(F)(F)F)c2)[C@@H](CC)CO1 ZINC001171778671 1051214055 /nfs/dbraw/zinc/21/40/55/1051214055.db2.gz PUNBDDIWVKODMR-GJZGRUSLSA-N 1 2 301.352 4.095 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2)[C@@H](CC)CO1 ZINC001171778671 1051214067 /nfs/dbraw/zinc/21/40/67/1051214067.db2.gz PUNBDDIWVKODMR-GJZGRUSLSA-N 1 2 301.352 4.095 20 0 DIADLO CCCOc1ccc([C@@H](C)[NH2+]Cc2cocn2)cc1OCCC ZINC000182068660 1051224307 /nfs/dbraw/zinc/22/43/07/1051224307.db2.gz DMPZRVWQCIQNNO-CQSZACIVSA-N 1 2 318.417 4.103 20 0 DIADLO Nc1[nH+]cccc1-c1ccc(C(F)(F)F)c(C(F)(F)F)c1 ZINC001243476924 1051229318 /nfs/dbraw/zinc/22/93/18/1051229318.db2.gz FRHBRJYKRALQQF-UHFFFAOYSA-N 1 2 306.209 4.368 20 0 DIADLO Fc1ccc([C@@H]2CC[N@@H+]2Cc2cnc(-c3ccccc3)nc2)cc1 ZINC001171846804 1051230277 /nfs/dbraw/zinc/23/02/77/1051230277.db2.gz FJGPSEJOFIDPGF-IBGZPJMESA-N 1 2 319.383 4.230 20 0 DIADLO Fc1ccc([C@@H]2CC[N@H+]2Cc2cnc(-c3ccccc3)nc2)cc1 ZINC001171846804 1051230288 /nfs/dbraw/zinc/23/02/88/1051230288.db2.gz FJGPSEJOFIDPGF-IBGZPJMESA-N 1 2 319.383 4.230 20 0 DIADLO CSc1cc(Nc2ccc(C(F)(F)F)cc2O)cc[nH+]1 ZINC001212632292 1051256965 /nfs/dbraw/zinc/25/69/65/1051256965.db2.gz REBQIFXMMKAZEK-UHFFFAOYSA-N 1 2 300.305 4.272 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(C(F)(F)F)cc3O)ccc21 ZINC001212633604 1051258400 /nfs/dbraw/zinc/25/84/00/1051258400.db2.gz ZLNRWKNKTDTXTI-UHFFFAOYSA-N 1 2 307.275 4.041 20 0 DIADLO C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH+]1CC(F)(C2CC2)C1 ZINC001171971531 1051261016 /nfs/dbraw/zinc/26/10/16/1051261016.db2.gz WCKADDJYOAJDPL-NSHDSACASA-N 1 2 301.327 4.070 20 0 DIADLO Fc1ncccc1C[NH2+]Cc1c(Cl)ccc(Cl)c1Cl ZINC000793282460 1051275585 /nfs/dbraw/zinc/27/55/85/1051275585.db2.gz VZOGSDHHNZRFAZ-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO Fc1ccc(-c2nc(C[NH+]3CCC(F)(F)CC3)cs2)cc1 ZINC000793363050 1051287681 /nfs/dbraw/zinc/28/76/81/1051287681.db2.gz ZMGQQUAETZYDNY-UHFFFAOYSA-N 1 2 312.360 4.180 20 0 DIADLO Cc1ccc2c(Nc3ccc(F)c(CO)c3F)cccc2[nH+]1 ZINC001215653472 1051288388 /nfs/dbraw/zinc/28/83/88/1051288388.db2.gz QWPFBZSKGANTKD-UHFFFAOYSA-N 1 2 300.308 4.057 20 0 DIADLO CCCOc1ccc2cc(N(C)c3[nH+]cccc3N)ccc2c1 ZINC001215679679 1051296375 /nfs/dbraw/zinc/29/63/75/1051296375.db2.gz UDKVKRILBKFVIR-UHFFFAOYSA-N 1 2 307.397 4.374 20 0 DIADLO COc1cc(Nc2cc(Cl)c3[nH+]ccn3c2)cc(C)c1F ZINC001215703648 1051313589 /nfs/dbraw/zinc/31/35/89/1051313589.db2.gz APYHDKJASFSLBE-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO CCCC[N@@H+](Cc1ccccc1F)Cn1cccnc1=S ZINC000746065958 1051317386 /nfs/dbraw/zinc/31/73/86/1051317386.db2.gz PWTTYAUCPQNSEK-UHFFFAOYSA-N 1 2 305.422 4.011 20 0 DIADLO CCCC[N@H+](Cc1ccccc1F)Cn1cccnc1=S ZINC000746065958 1051317397 /nfs/dbraw/zinc/31/73/97/1051317397.db2.gz PWTTYAUCPQNSEK-UHFFFAOYSA-N 1 2 305.422 4.011 20 0 DIADLO COc1cc(F)c(Nc2ccc3c(C)cc[nH+]c3c2)cc1OC ZINC001215721655 1051323254 /nfs/dbraw/zinc/32/32/54/1051323254.db2.gz SCFUPKGZAZJEKM-UHFFFAOYSA-N 1 2 312.344 4.443 20 0 DIADLO CCCC[N@H+](Cc1ncc(Cl)n1C)[C@@H](C)c1ccc(C)o1 ZINC000746164775 1051334462 /nfs/dbraw/zinc/33/44/62/1051334462.db2.gz BWMVHBZOUKNKME-ZDUSSCGKSA-N 1 2 309.841 4.338 20 0 DIADLO CCCC[N@@H+](Cc1ncc(Cl)n1C)[C@@H](C)c1ccc(C)o1 ZINC000746164775 1051334471 /nfs/dbraw/zinc/33/44/71/1051334471.db2.gz BWMVHBZOUKNKME-ZDUSSCGKSA-N 1 2 309.841 4.338 20 0 DIADLO COc1ccc(Nc2ccc3c(C)cc[nH+]c3c2)c2c[nH]nc21 ZINC001215751989 1051344206 /nfs/dbraw/zinc/34/42/06/1051344206.db2.gz IFGCTBJAENHSEC-UHFFFAOYSA-N 1 2 304.353 4.172 20 0 DIADLO c1ccc(COc2cc(NCCC3=CCCCC3)cc[nH+]2)nc1 ZINC001168776417 1051346926 /nfs/dbraw/zinc/34/69/26/1051346926.db2.gz XWGXCXIRISXWHG-UHFFFAOYSA-N 1 2 309.413 4.358 20 0 DIADLO CCOc1ccc(C)c(F)c1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001215763980 1051353160 /nfs/dbraw/zinc/35/31/60/1051353160.db2.gz ZKASAAUAOJKMJC-UHFFFAOYSA-N 1 2 311.360 4.462 20 0 DIADLO c1cn2ccc(Nc3ccnc(Oc4ccccc4)c3)cc2[nH+]1 ZINC001215774695 1051360077 /nfs/dbraw/zinc/36/00/77/1051360077.db2.gz PKAKHMMQKGIYAJ-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccnc(Oc2ccccc2)c1 ZINC001215775219 1051361472 /nfs/dbraw/zinc/36/14/72/1051361472.db2.gz CRKOBTQCYUYBAW-UHFFFAOYSA-N 1 2 316.364 4.103 20 0 DIADLO S=c1sc(C2CC2)nn1C[N@H+](C1CC1)C1CCCCC1 ZINC000746374138 1051387552 /nfs/dbraw/zinc/38/75/52/1051387552.db2.gz ITFQSMHLYCMDLR-UHFFFAOYSA-N 1 2 309.504 4.306 20 0 DIADLO S=c1sc(C2CC2)nn1C[N@@H+](C1CC1)C1CCCCC1 ZINC000746374138 1051387561 /nfs/dbraw/zinc/38/75/61/1051387561.db2.gz ITFQSMHLYCMDLR-UHFFFAOYSA-N 1 2 309.504 4.306 20 0 DIADLO CC(C)(C)C(=O)Nc1ccccc1Nc1cccc2[nH+]ccn21 ZINC001215830238 1051394036 /nfs/dbraw/zinc/39/40/36/1051394036.db2.gz VRRNTFQFDRSLLF-UHFFFAOYSA-N 1 2 308.385 4.063 20 0 DIADLO Cc1cccc(C2(C(=O)Nc3ccn4cc[nH+]c4c3)CCCC2)c1 ZINC001129482684 1051403286 /nfs/dbraw/zinc/40/32/86/1051403286.db2.gz WPPYRCSKRVMXEG-UHFFFAOYSA-N 1 2 319.408 4.093 20 0 DIADLO C[C@@H](Nc1cc(N2CCCC2)nc[nH+]1)c1csc2ccccc12 ZINC000804439622 1051410651 /nfs/dbraw/zinc/41/06/51/1051410651.db2.gz YFWGTOOFXCHXQF-CYBMUJFWSA-N 1 2 324.453 4.465 20 0 DIADLO C[C@@H](Nc1cc(N2CCCC2)[nH+]cn1)c1csc2ccccc12 ZINC000804439622 1051410658 /nfs/dbraw/zinc/41/06/58/1051410658.db2.gz YFWGTOOFXCHXQF-CYBMUJFWSA-N 1 2 324.453 4.465 20 0 DIADLO C[C@@H]([NH2+]Cc1ccon1)c1ccc(SCC(F)(F)F)cc1 ZINC000766419837 1051418812 /nfs/dbraw/zinc/41/88/12/1051418812.db2.gz FETWDUDDWLUSCG-SNVBAGLBSA-N 1 2 316.348 4.180 20 0 DIADLO C[C@@](O)(CNc1cc[nH+]c2c(Cl)cccc12)c1cccs1 ZINC000804489992 1051430148 /nfs/dbraw/zinc/43/01/48/1051430148.db2.gz DSTUGOQAMHDECT-MRXNPFEDSA-N 1 2 318.829 4.269 20 0 DIADLO CCOc1cc(C)ccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001215874599 1051430278 /nfs/dbraw/zinc/43/02/78/1051430278.db2.gz BWFUQXAFCAHGDU-UHFFFAOYSA-N 1 2 307.397 4.382 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C2CCC2)no1)c1ccc(C)c(F)c1 ZINC001168839116 1051451116 /nfs/dbraw/zinc/45/11/16/1051451116.db2.gz SWCRGUFANCKQRE-OAHLLOKOSA-N 1 2 303.381 4.026 20 0 DIADLO CSc1ncc(Cl)cc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001215917617 1051454696 /nfs/dbraw/zinc/45/46/96/1051454696.db2.gz JLZBBCWTVORLDW-UHFFFAOYSA-N 1 2 316.817 4.386 20 0 DIADLO CSc1c(F)cc(Nc2cccn3cc(C)[nH+]c23)cc1F ZINC001215923220 1051460012 /nfs/dbraw/zinc/46/00/12/1051460012.db2.gz YQASHFSAZJSZSR-UHFFFAOYSA-N 1 2 305.353 4.386 20 0 DIADLO CCOc1cc(Nc2ccc(OC)c(SC)c2)cc(C)[nH+]1 ZINC001215933498 1051466848 /nfs/dbraw/zinc/46/68/48/1051466848.db2.gz QSQZPVXPYXZREO-UHFFFAOYSA-N 1 2 304.415 4.263 20 0 DIADLO COc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1SC ZINC001215932638 1051467349 /nfs/dbraw/zinc/46/73/49/1051467349.db2.gz OCGBGVDHSSZGJW-UHFFFAOYSA-N 1 2 315.442 4.156 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CCC[C@@H]2c2ccc(C(C)C)cc2)[nH]1 ZINC001168917920 1051468083 /nfs/dbraw/zinc/46/80/83/1051468083.db2.gz DEXCYHHBWSZQMY-QGZVFWFLSA-N 1 2 312.461 4.389 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CCC[C@@H]2c2ccc(C(C)C)cc2)[nH]1 ZINC001168917920 1051468086 /nfs/dbraw/zinc/46/80/86/1051468086.db2.gz DEXCYHHBWSZQMY-QGZVFWFLSA-N 1 2 312.461 4.389 20 0 DIADLO Clc1cc(Cl)cc(CC[N@@H+]2CCOCC23CCCC3)c1 ZINC001168924928 1051468725 /nfs/dbraw/zinc/46/87/25/1051468725.db2.gz KGETVCFKIXOVNG-UHFFFAOYSA-N 1 2 314.256 4.181 20 0 DIADLO Clc1cc(Cl)cc(CC[N@H+]2CCOCC23CCCC3)c1 ZINC001168924928 1051468731 /nfs/dbraw/zinc/46/87/31/1051468731.db2.gz KGETVCFKIXOVNG-UHFFFAOYSA-N 1 2 314.256 4.181 20 0 DIADLO COc1cc[nH+]cc1NCc1ccccc1OCc1ccccc1 ZINC001168940127 1051469842 /nfs/dbraw/zinc/46/98/42/1051469842.db2.gz WSWHNTSAKXDZRM-UHFFFAOYSA-N 1 2 320.392 4.281 20 0 DIADLO CSc1ccc(F)c(C)c1NCCc1cn2ccccc2[nH+]1 ZINC001169011740 1051486640 /nfs/dbraw/zinc/48/66/40/1051486640.db2.gz XJRVPWMFQCTBAP-UHFFFAOYSA-N 1 2 315.417 4.158 20 0 DIADLO C/C(=C\c1cccc(Cl)c1)C(=O)NCc1c[nH+]c(C)cc1C ZINC001129714048 1051494861 /nfs/dbraw/zinc/49/48/61/1051494861.db2.gz KOCJGOUZDOQKAC-MDWZMJQESA-N 1 2 314.816 4.072 20 0 DIADLO COCc1cc(OC)ccc1Nc1c(C)cc[nH+]c1C(C)C ZINC001215978978 1051498760 /nfs/dbraw/zinc/49/87/60/1051498760.db2.gz ZMMDHHSJSHVLAB-UHFFFAOYSA-N 1 2 300.402 4.412 20 0 DIADLO Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H](C)c1noc(-c2ccccc2)n1 ZINC000766603033 1051524663 /nfs/dbraw/zinc/52/46/63/1051524663.db2.gz VKIOPCFFNSIAHN-KDOFPFPSSA-N 1 2 319.408 4.383 20 0 DIADLO CSc1ncc(Nc2ccccc2-n2cc[nH+]c2)cc1Cl ZINC001216027473 1051532155 /nfs/dbraw/zinc/53/21/55/1051532155.db2.gz BYTRCHLWGWBOOK-UHFFFAOYSA-N 1 2 316.817 4.386 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CCC(=O)[C@@H]2CCCC[C@H]21 ZINC001172845978 1051533714 /nfs/dbraw/zinc/53/37/14/1051533714.db2.gz AEQNAEUKYPJLFW-PBFPGSCMSA-N 1 2 323.839 4.244 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CCC(=O)[C@@H]2CCCC[C@H]21 ZINC001172845978 1051533725 /nfs/dbraw/zinc/53/37/25/1051533725.db2.gz AEQNAEUKYPJLFW-PBFPGSCMSA-N 1 2 323.839 4.244 20 0 DIADLO CSc1ncc(Nc2cccc(-n3cc[nH+]c3)c2)cc1Cl ZINC001216029241 1051535329 /nfs/dbraw/zinc/53/53/29/1051535329.db2.gz ZIXDPJMNZXDWJM-UHFFFAOYSA-N 1 2 316.817 4.386 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1ccccc1OC(F)F ZINC001169187602 1051542765 /nfs/dbraw/zinc/54/27/65/1051542765.db2.gz IWOMQBAPNJUPTF-CYBMUJFWSA-N 1 2 319.351 4.071 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1ccccc1OC(F)F ZINC001169187602 1051542772 /nfs/dbraw/zinc/54/27/72/1051542772.db2.gz IWOMQBAPNJUPTF-CYBMUJFWSA-N 1 2 319.351 4.071 20 0 DIADLO C[C@H]1CCc2cc(N)ccc2[N@@H+]1c1ccc(N)c(C(F)(F)F)c1 ZINC001216051544 1051549348 /nfs/dbraw/zinc/54/93/48/1051549348.db2.gz RPFNUIBBGNUGFP-JTQLQIEISA-N 1 2 321.346 4.343 20 0 DIADLO C[C@H]1CCc2cc(N)ccc2[N@H+]1c1ccc(N)c(C(F)(F)F)c1 ZINC001216051544 1051549360 /nfs/dbraw/zinc/54/93/60/1051549360.db2.gz RPFNUIBBGNUGFP-JTQLQIEISA-N 1 2 321.346 4.343 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(N)c(C(F)(F)F)c2)cc1 ZINC001216054636 1051552010 /nfs/dbraw/zinc/55/20/10/1051552010.db2.gz RMULMEYOGLCDOT-UHFFFAOYSA-N 1 2 309.335 4.487 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(N)c(C(F)(F)F)c2)cc1 ZINC001216054636 1051552018 /nfs/dbraw/zinc/55/20/18/1051552018.db2.gz RMULMEYOGLCDOT-UHFFFAOYSA-N 1 2 309.335 4.487 20 0 DIADLO Fc1cccc(F)c1C[N@H+](C[C@H]1CCCC2(CCC2)O1)C1CC1 ZINC001169224357 1051555884 /nfs/dbraw/zinc/55/58/84/1051555884.db2.gz IAFOYCSRFNLQFJ-OAHLLOKOSA-N 1 2 321.411 4.421 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](C[C@H]1CCCC2(CCC2)O1)C1CC1 ZINC001169224357 1051555902 /nfs/dbraw/zinc/55/59/02/1051555902.db2.gz IAFOYCSRFNLQFJ-OAHLLOKOSA-N 1 2 321.411 4.421 20 0 DIADLO C[C@H](CSc1ccc(Cl)cc1)[N@@H+]1Cc2cccnc2C1 ZINC001172875502 1051558607 /nfs/dbraw/zinc/55/86/07/1051558607.db2.gz LWZLPURSWXBDPM-GFCCVEGCSA-N 1 2 304.846 4.231 20 0 DIADLO C[C@H](CSc1ccc(Cl)cc1)[N@H+]1Cc2cccnc2C1 ZINC001172875502 1051558617 /nfs/dbraw/zinc/55/86/17/1051558617.db2.gz LWZLPURSWXBDPM-GFCCVEGCSA-N 1 2 304.846 4.231 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(N[C@H](C2CCC2)C(F)(F)F)c1 ZINC001169286893 1051572767 /nfs/dbraw/zinc/57/27/67/1051572767.db2.gz ZOFIGCWDDYDKJH-OAHLLOKOSA-N 1 2 309.335 4.230 20 0 DIADLO Clc1cc(Cl)nc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212693285 1051574886 /nfs/dbraw/zinc/57/48/86/1051574886.db2.gz NDOIGMCEVUBQMU-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO c1cn(Cc2ccc(Nc3cc(-c4ccccc4)no3)cc2)c[nH+]1 ZINC001212692180 1051581123 /nfs/dbraw/zinc/58/11/23/1051581123.db2.gz FSQYMXUYVBDUFY-UHFFFAOYSA-N 1 2 316.364 4.330 20 0 DIADLO Fc1cc(Cl)ccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212696806 1051583772 /nfs/dbraw/zinc/58/37/72/1051583772.db2.gz NESWCVSHRDFMMR-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO Clc1cc2ncoc2c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212699774 1051584585 /nfs/dbraw/zinc/58/45/85/1051584585.db2.gz CKEHZPBMFQNJCF-UHFFFAOYSA-N 1 2 324.771 4.470 20 0 DIADLO Cc1nc2ccc(Nc3ccc(Cn4cc[nH+]c4)cc3)cc2o1 ZINC001212696713 1051584657 /nfs/dbraw/zinc/58/46/57/1051584657.db2.gz HGFMCXYHSZDERE-UHFFFAOYSA-N 1 2 304.353 4.125 20 0 DIADLO O=C(c1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1)C1CC1 ZINC001212699907 1051585572 /nfs/dbraw/zinc/58/55/72/1051585572.db2.gz JMSTXZSZGOHGMY-UHFFFAOYSA-N 1 2 317.392 4.268 20 0 DIADLO Nc1cccc2cccc(Nc3ccc(Cn4cc[nH+]c4)cc3)c12 ZINC001212697750 1051587041 /nfs/dbraw/zinc/58/70/41/1051587041.db2.gz QYVGFRJIQDJNIW-UHFFFAOYSA-N 1 2 314.392 4.410 20 0 DIADLO CC(=O)c1c(F)cccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212698481 1051588084 /nfs/dbraw/zinc/58/80/84/1051588084.db2.gz VLFHIVADAXTZDR-UHFFFAOYSA-N 1 2 309.344 4.017 20 0 DIADLO CC(=O)c1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)ccc1F ZINC001212697523 1051588102 /nfs/dbraw/zinc/58/81/02/1051588102.db2.gz CZUSQAQTAXDGPR-UHFFFAOYSA-N 1 2 309.344 4.017 20 0 DIADLO c1cn(Cc2ccc(Nc3cccc(-c4cnco4)c3)cc2)c[nH+]1 ZINC001212696881 1051588144 /nfs/dbraw/zinc/58/81/44/1051588144.db2.gz RNMPYCBRPAYHEP-UHFFFAOYSA-N 1 2 316.364 4.330 20 0 DIADLO CCOC(=O)CCc1ccc[nH+]c1N[C@H]1C[C@H](C)c2ccccc21 ZINC001169371918 1051593204 /nfs/dbraw/zinc/59/32/04/1051593204.db2.gz DHMINFPUGJVHLJ-KSSFIOAISA-N 1 2 324.424 4.238 20 0 DIADLO Cc1nc(C2([NH2+]C/C=C/c3ccc(Cl)cc3)CCCC2)no1 ZINC000179009133 1051598321 /nfs/dbraw/zinc/59/83/21/1051598321.db2.gz ZYDNSGGBCUWNSF-SNAWJCMRSA-N 1 2 317.820 4.104 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)Cc2ccccc2Cl)c(C)[nH+]1 ZINC000178992493 1051599035 /nfs/dbraw/zinc/59/90/35/1051599035.db2.gz QBYNLZAHJNRDPN-GFCCVEGCSA-N 1 2 316.832 4.478 20 0 DIADLO C/C(=C\c1cccc(Cl)c1)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001130043622 1051601103 /nfs/dbraw/zinc/60/11/03/1051601103.db2.gz VTGGKRIXWHPNPA-KPKJPENVSA-N 1 2 314.816 4.072 20 0 DIADLO Cc1cc(CNC(=O)c2cc(Cl)cc3ccccc32)cc(C)[nH+]1 ZINC001130046365 1051602978 /nfs/dbraw/zinc/60/29/78/1051602978.db2.gz UQXLNWAZMJUZHT-UHFFFAOYSA-N 1 2 324.811 4.435 20 0 DIADLO CC[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccc(F)cn1 ZINC000493247942 1051604854 /nfs/dbraw/zinc/60/48/54/1051604854.db2.gz MGFTVUUEXIRJRR-MRXNPFEDSA-N 1 2 311.360 4.117 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CCCC2(CCCC2)C1 ZINC001169395304 1051607195 /nfs/dbraw/zinc/60/71/95/1051607195.db2.gz GLGQWCRZRWPOIN-MRXNPFEDSA-N 1 2 321.848 4.210 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CCCC2(CCCC2)C1 ZINC001169395304 1051607199 /nfs/dbraw/zinc/60/71/99/1051607199.db2.gz GLGQWCRZRWPOIN-MRXNPFEDSA-N 1 2 321.848 4.210 20 0 DIADLO OCC[C@H](Nc1ccn2cc[nH+]c2c1)c1cccc2ccccc21 ZINC001169424280 1051611276 /nfs/dbraw/zinc/61/12/76/1051611276.db2.gz HGHQKHMTGNXUJM-IBGZPJMESA-N 1 2 317.392 4.023 20 0 DIADLO CC(=O)Nc1ccc(Nc2ccc3c(C)cc[nH+]c3c2)cc1F ZINC001212706278 1051618975 /nfs/dbraw/zinc/61/89/75/1051618975.db2.gz BJETVFWPZJLXQI-UHFFFAOYSA-N 1 2 309.344 4.384 20 0 DIADLO Cc1cc(N)nc(SCc2ccc(-c3ccccc3)cc2)[nH+]1 ZINC000007049090 1051626296 /nfs/dbraw/zinc/62/62/96/1051626296.db2.gz XOAVPSGUDFJGFV-UHFFFAOYSA-N 1 2 307.422 4.327 20 0 DIADLO COc1ccc(CNc2cc(C)c3cccc(C(C)C)c3[nH+]2)nn1 ZINC001169466911 1051626894 /nfs/dbraw/zinc/62/68/94/1051626894.db2.gz OTCZPTPTHAZHDG-UHFFFAOYSA-N 1 2 322.412 4.077 20 0 DIADLO C[C@H](CNc1cc(-c2ccncc2)cc[nH+]1)c1ccc(O)cc1 ZINC001169532087 1051634517 /nfs/dbraw/zinc/63/45/17/1051634517.db2.gz GLZCSRSBGIKVJM-CQSZACIVSA-N 1 2 305.381 4.065 20 0 DIADLO C[C@H]1C[N@H+](Cc2nnc(-c3ccccc3)s2)Cc2ccccc21 ZINC000766753203 1051644729 /nfs/dbraw/zinc/64/47/29/1051644729.db2.gz VTHPWKHKRWPBOH-AWEZNQCLSA-N 1 2 321.449 4.324 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nnc(-c3ccccc3)s2)Cc2ccccc21 ZINC000766753203 1051644742 /nfs/dbraw/zinc/64/47/42/1051644742.db2.gz VTHPWKHKRWPBOH-AWEZNQCLSA-N 1 2 321.449 4.324 20 0 DIADLO CC(C)=CC[N@@H+](Cc1cn(C)cn1)Cc1ccc(Cl)cc1 ZINC001169686081 1051672072 /nfs/dbraw/zinc/67/20/72/1051672072.db2.gz GDCXLHMXFVJELO-UHFFFAOYSA-N 1 2 303.837 4.042 20 0 DIADLO CC(C)=CC[N@H+](Cc1cn(C)cn1)Cc1ccc(Cl)cc1 ZINC001169686081 1051672077 /nfs/dbraw/zinc/67/20/77/1051672077.db2.gz GDCXLHMXFVJELO-UHFFFAOYSA-N 1 2 303.837 4.042 20 0 DIADLO CCCCCC[C@](C)(CCC)C(=O)N[C@@H]1CCc2c[nH+]cn2C1 ZINC000804336218 1051679598 /nfs/dbraw/zinc/67/95/98/1051679598.db2.gz HRHJUHNLQSLEHP-APWZRJJASA-N 1 2 319.493 4.091 20 0 DIADLO Cc1cc(NCc2ncccc2O)[nH+]c2c1cccc2C(C)C ZINC001169731285 1051687574 /nfs/dbraw/zinc/68/75/74/1051687574.db2.gz AELYTVGTEOEKSN-UHFFFAOYSA-N 1 2 307.397 4.379 20 0 DIADLO Clc1ccc(Cl)c(C[NH+]2CCC(c3cccnc3)CC2)n1 ZINC000766842280 1051705783 /nfs/dbraw/zinc/70/57/83/1051705783.db2.gz GLAJDLXYSUQIDW-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO CC(C)(C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CC1 ZINC000805997723 1051715029 /nfs/dbraw/zinc/71/50/29/1051715029.db2.gz DCSKADSGVYYFQY-UHFFFAOYSA-N 1 2 324.424 4.228 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1nc(-c2ccco2)no1 ZINC000183624016 1051717851 /nfs/dbraw/zinc/71/78/51/1051717851.db2.gz XWNOJWOKMSZCDF-GFCCVEGCSA-N 1 2 323.352 4.235 20 0 DIADLO COc1nscc1C[N@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC001169898350 1051724845 /nfs/dbraw/zinc/72/48/45/1051724845.db2.gz BDDPBVUFGULODG-UHFFFAOYSA-N 1 2 320.845 4.094 20 0 DIADLO COc1nscc1C[N@@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC001169898350 1051724854 /nfs/dbraw/zinc/72/48/54/1051724854.db2.gz BDDPBVUFGULODG-UHFFFAOYSA-N 1 2 320.845 4.094 20 0 DIADLO Cc1cc(N[C@@H]2CCc3nc(Cl)ccc32)ccc1[NH+](C)C ZINC000806158029 1051760841 /nfs/dbraw/zinc/76/08/41/1051760841.db2.gz VLTXEVNXRHKBLG-CQSZACIVSA-N 1 2 301.821 4.209 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCC1(F)F)c1cc(Cl)c(N)c(Cl)c1 ZINC000806179349 1051773348 /nfs/dbraw/zinc/77/33/48/1051773348.db2.gz BOWZVEQQVRBDCY-CPCISQLKSA-N 1 2 309.187 4.414 20 0 DIADLO C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000806289164 1051786434 /nfs/dbraw/zinc/78/64/34/1051786434.db2.gz GLOXNWPSYIGQDI-KGLIPLIRSA-N 1 2 314.433 4.013 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C[C@H]3C[C@@H]3c3ccccc3)cc2)CCO1 ZINC000767389603 1051802212 /nfs/dbraw/zinc/80/22/12/1051802212.db2.gz FCCIRAWRHSKPDD-HGHGUNKESA-N 1 2 322.452 4.127 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C[C@@H]3C[C@@H]3c3ccccc3)cc2)CCO1 ZINC000767389605 1051802621 /nfs/dbraw/zinc/80/26/21/1051802621.db2.gz FCCIRAWRHSKPDD-PLMTUMEDSA-N 1 2 322.452 4.127 20 0 DIADLO Cc1cc(C[NH2+]Cc2cc(COC(C)(C)C)on2)ccc1Cl ZINC000186415040 1051815321 /nfs/dbraw/zinc/81/53/21/1051815321.db2.gz DAKSFEVWDTUWIJ-UHFFFAOYSA-N 1 2 322.836 4.241 20 0 DIADLO COc1c(F)cc(SC)cc1Nc1cc[nH+]c(SC)c1 ZINC001216582261 1051825064 /nfs/dbraw/zinc/82/50/64/1051825064.db2.gz GSILCXRUKLVWEF-UHFFFAOYSA-N 1 2 310.419 4.417 20 0 DIADLO CCn1ncc2cc(Nc3ccc[nH+]c3N3CCCCC3)ccc21 ZINC001216589228 1051829839 /nfs/dbraw/zinc/82/98/39/1051829839.db2.gz YBRPXHSPOWWYLF-UHFFFAOYSA-N 1 2 321.428 4.185 20 0 DIADLO COc1c(Nc2cccn3cc(C)[nH+]c23)cccc1C(F)(F)F ZINC001216634388 1051842273 /nfs/dbraw/zinc/84/22/73/1051842273.db2.gz ZPOSQHUCNRCLTN-UHFFFAOYSA-N 1 2 321.302 4.414 20 0 DIADLO CCc1nc(C)c(C[NH2+]Cc2csc(Cl)c2Cl)o1 ZINC000494288300 1051871943 /nfs/dbraw/zinc/87/19/43/1051871943.db2.gz QXWWEBPSTJPBIM-UHFFFAOYSA-N 1 2 305.230 4.204 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccc(Br)s2)o1 ZINC000220950811 1051845559 /nfs/dbraw/zinc/84/55/59/1051845559.db2.gz SEKFALKWSYXIIC-BDAKNGLRSA-N 1 2 315.236 4.219 20 0 DIADLO COCC1=CC[N@H+](Cc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000187623997 1051849822 /nfs/dbraw/zinc/84/98/22/1051849822.db2.gz OSAWQSFZFHPQTF-UHFFFAOYSA-N 1 2 319.754 4.137 20 0 DIADLO COCC1=CC[N@@H+](Cc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000187623997 1051849834 /nfs/dbraw/zinc/84/98/34/1051849834.db2.gz OSAWQSFZFHPQTF-UHFFFAOYSA-N 1 2 319.754 4.137 20 0 DIADLO COC(=O)c1sccc1C[N@H+](C)C/C(C)=C\c1ccccc1 ZINC000494232792 1051857311 /nfs/dbraw/zinc/85/73/11/1051857311.db2.gz CQVUSBZOGJXGDU-KAMYIIQDSA-N 1 2 315.438 4.070 20 0 DIADLO COC(=O)c1sccc1C[N@@H+](C)C/C(C)=C\c1ccccc1 ZINC000494232792 1051857322 /nfs/dbraw/zinc/85/73/22/1051857322.db2.gz CQVUSBZOGJXGDU-KAMYIIQDSA-N 1 2 315.438 4.070 20 0 DIADLO CN(C)c1cc(CS[C@H]2CCc3ccc(F)cc32)cc[nH+]1 ZINC000767865505 1051857921 /nfs/dbraw/zinc/85/79/21/1051857921.db2.gz GZXQBOIAGAGMCX-INIZCTEOSA-N 1 2 302.418 4.207 20 0 DIADLO C/C(=C/c1ccccc1)C[N@@H+](C)[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000494232952 1051857879 /nfs/dbraw/zinc/85/78/79/1051857879.db2.gz FALHBXNPOFRAMZ-ZSMUJPCHSA-N 1 2 313.445 4.463 20 0 DIADLO C/C(=C/c1ccccc1)C[N@H+](C)[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000494232952 1051857887 /nfs/dbraw/zinc/85/78/87/1051857887.db2.gz FALHBXNPOFRAMZ-ZSMUJPCHSA-N 1 2 313.445 4.463 20 0 DIADLO FCc1ccc(C[N@@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC000767877765 1051858378 /nfs/dbraw/zinc/85/83/78/1051858378.db2.gz YPHHNIDOOHZRFO-GOSISDBHSA-N 1 2 319.807 4.383 20 0 DIADLO FCc1ccc(C[N@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC000767877765 1051858386 /nfs/dbraw/zinc/85/83/86/1051858386.db2.gz YPHHNIDOOHZRFO-GOSISDBHSA-N 1 2 319.807 4.383 20 0 DIADLO CCC(CC)n1ccc(CSCc2cc[nH+]c(N(C)C)c2)n1 ZINC000767865839 1051858931 /nfs/dbraw/zinc/85/89/31/1051858931.db2.gz JGYWOAGUCHDCHS-UHFFFAOYSA-N 1 2 318.490 4.139 20 0 DIADLO CN(C)c1cc(CSCCOc2ccccc2Cl)cc[nH+]1 ZINC000767871118 1051860065 /nfs/dbraw/zinc/86/00/65/1051860065.db2.gz YIEAHBDEGWKULP-UHFFFAOYSA-N 1 2 322.861 4.113 20 0 DIADLO CCCCc1nc(CSCc2cc[nH+]c(N(C)C)c2)cs1 ZINC000767871571 1051861006 /nfs/dbraw/zinc/86/10/06/1051861006.db2.gz OJVYUAWAPFGEEW-UHFFFAOYSA-N 1 2 321.515 4.380 20 0 DIADLO Cc1ccccc1O[C@H]1CC[N@H+](Cc2ccc(F)c(F)c2F)C1 ZINC001137939378 1051865422 /nfs/dbraw/zinc/86/54/22/1051865422.db2.gz UIWMNJRRDCHZHN-AWEZNQCLSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1ccccc1O[C@H]1CC[N@@H+](Cc2ccc(F)c(F)c2F)C1 ZINC001137939378 1051865426 /nfs/dbraw/zinc/86/54/26/1051865426.db2.gz UIWMNJRRDCHZHN-AWEZNQCLSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1cc(C)cc(-c2noc(-c3ccccc3-n3cc[nH+]c3)n2)c1 ZINC001216755299 1051873318 /nfs/dbraw/zinc/87/33/18/1051873318.db2.gz ITDASUUVVOKVSA-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Cc1ccc(-c2noc(-c3ccccc3-n3cc[nH+]c3)n2)cc1C ZINC001216755471 1051873673 /nfs/dbraw/zinc/87/36/73/1051873673.db2.gz NNQCHCFNVHOCEI-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Clc1ccccc1-c1noc(-c2ccccc2-n2cc[nH+]c2)n1 ZINC001216755101 1051874282 /nfs/dbraw/zinc/87/42/82/1051874282.db2.gz DFPKRQONYQHEQI-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO CCCc1csc(C[NH2+][C@@H](C)c2cc(F)ccc2OC)n1 ZINC000494374210 1051885326 /nfs/dbraw/zinc/88/53/26/1051885326.db2.gz IWQWSIJRFHGKBY-NSHDSACASA-N 1 2 308.422 4.094 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCNc2[nH+]cc(C)cc21 ZINC001169989104 1051893637 /nfs/dbraw/zinc/89/36/37/1051893637.db2.gz AYSIFZCVKYOVND-CQSZACIVSA-N 1 2 303.450 4.145 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(Cl)ccc(F)c1Cl)c1cn[nH]c1 ZINC000222506507 1051920230 /nfs/dbraw/zinc/92/02/30/1051920230.db2.gz BTKQTFBXSZZVHC-HTQZYQBOSA-N 1 2 302.180 4.267 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1c(Cl)nc(Cl)n1C ZINC000768319459 1051920598 /nfs/dbraw/zinc/92/05/98/1051920598.db2.gz ONKANLBMRFFVKD-CYBMUJFWSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1c(Cl)nc(Cl)n1C ZINC000768319459 1051920609 /nfs/dbraw/zinc/92/06/09/1051920609.db2.gz ONKANLBMRFFVKD-CYBMUJFWSA-N 1 2 324.255 4.372 20 0 DIADLO c1cn(Cc2ccc(Nc3cnc4ccccc4c3)cc2)c[nH+]1 ZINC001174002615 1051927483 /nfs/dbraw/zinc/92/74/83/1051927483.db2.gz RDMINGWYAHKYIR-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO Cl/C=C(\Cl)CNc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000768389189 1051928661 /nfs/dbraw/zinc/92/86/61/1051928661.db2.gz SYFAPSNLJHKWNU-JYRVWZFOSA-N 1 2 320.223 4.333 20 0 DIADLO CCCCOc1ccccc1C[N@@H+]1CCC[C@H]1c1cc(C)on1 ZINC000768506148 1051936369 /nfs/dbraw/zinc/93/63/69/1051936369.db2.gz TVVIZRCPJGFDFW-SFHVURJKSA-N 1 2 314.429 4.499 20 0 DIADLO CCCCOc1ccccc1C[N@H+]1CCC[C@H]1c1cc(C)on1 ZINC000768506148 1051936379 /nfs/dbraw/zinc/93/63/79/1051936379.db2.gz TVVIZRCPJGFDFW-SFHVURJKSA-N 1 2 314.429 4.499 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cnc(Cl)c(C)c2)o1 ZINC000768541257 1051939742 /nfs/dbraw/zinc/93/97/42/1051939742.db2.gz MANJQRVGPRQICK-OAHLLOKOSA-N 1 2 320.820 4.120 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2cnc(Cl)c(C)c2)o1 ZINC000768541257 1051939755 /nfs/dbraw/zinc/93/97/55/1051939755.db2.gz MANJQRVGPRQICK-OAHLLOKOSA-N 1 2 320.820 4.120 20 0 DIADLO CC(C)c1noc([C@H](C)[N@@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)n1 ZINC000190210358 1051941639 /nfs/dbraw/zinc/94/16/39/1051941639.db2.gz NOKORCHLQKSVKS-QWRGUYRKSA-N 1 2 319.371 4.164 20 0 DIADLO CC(C)c1noc([C@H](C)[N@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)n1 ZINC000190210358 1051941648 /nfs/dbraw/zinc/94/16/48/1051941648.db2.gz NOKORCHLQKSVKS-QWRGUYRKSA-N 1 2 319.371 4.164 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2cnn(C(C)(C)C)c2C)cs1 ZINC000191280877 1051968164 /nfs/dbraw/zinc/96/81/64/1051968164.db2.gz FNFCTSSMUZGGTA-RYUDHWBXSA-N 1 2 320.506 4.377 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2cn(C(C)(C)C)nn2)o1 ZINC000191384751 1051972265 /nfs/dbraw/zinc/97/22/65/1051972265.db2.gz WWNFYDLCAVOJCC-MRXNPFEDSA-N 1 2 316.449 4.052 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2cn(C(C)(C)C)nn2)o1 ZINC000191384751 1051972278 /nfs/dbraw/zinc/97/22/78/1051972278.db2.gz WWNFYDLCAVOJCC-MRXNPFEDSA-N 1 2 316.449 4.052 20 0 DIADLO C[C@H]1C[N@H+](Cn2c(-c3ccccc3)csc2=S)CCCO1 ZINC000747457102 1051974322 /nfs/dbraw/zinc/97/43/22/1051974322.db2.gz NRKKIDYJTIFZTF-ZDUSSCGKSA-N 1 2 320.483 4.014 20 0 DIADLO C[C@H]1C[N@@H+](Cn2c(-c3ccccc3)csc2=S)CCCO1 ZINC000747457102 1051974334 /nfs/dbraw/zinc/97/43/34/1051974334.db2.gz NRKKIDYJTIFZTF-ZDUSSCGKSA-N 1 2 320.483 4.014 20 0 DIADLO C[C@@H]1C[N@H+](Cn2c(-c3ccccc3)csc2=S)CCCO1 ZINC000747457100 1051974466 /nfs/dbraw/zinc/97/44/66/1051974466.db2.gz NRKKIDYJTIFZTF-CYBMUJFWSA-N 1 2 320.483 4.014 20 0 DIADLO C[C@@H]1C[N@@H+](Cn2c(-c3ccccc3)csc2=S)CCCO1 ZINC000747457100 1051974478 /nfs/dbraw/zinc/97/44/78/1051974478.db2.gz NRKKIDYJTIFZTF-CYBMUJFWSA-N 1 2 320.483 4.014 20 0 DIADLO CC[C@@]1(C)CC(=O)N(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)C1 ZINC000808142666 1051979687 /nfs/dbraw/zinc/97/96/87/1051979687.db2.gz XQYDWZWKUWLYSO-WMZOPIPTSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@@]1(C)CC(=O)N(C[N@H+]2CCC[C@H]2c2ccccc2Cl)C1 ZINC000808142666 1051979694 /nfs/dbraw/zinc/97/96/94/1051979694.db2.gz XQYDWZWKUWLYSO-WMZOPIPTSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@@]1(C)CC(=O)N(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC000808137754 1051980482 /nfs/dbraw/zinc/98/04/82/1051980482.db2.gz ARWVSSQCUSSTSE-WMZOPIPTSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@@]1(C)CC(=O)N(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC000808137754 1051980493 /nfs/dbraw/zinc/98/04/93/1051980493.db2.gz ARWVSSQCUSSTSE-WMZOPIPTSA-N 1 2 320.864 4.083 20 0 DIADLO Cc1ccc(Nc2ccc(C(=O)N3CCCCC3)cc2)c(C)[nH+]1 ZINC001174070665 1051991371 /nfs/dbraw/zinc/99/13/71/1051991371.db2.gz LAKWKVZTTVFCRJ-UHFFFAOYSA-N 1 2 309.413 4.068 20 0 DIADLO CCC/C=C/C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000769040657 1051991298 /nfs/dbraw/zinc/99/12/98/1051991298.db2.gz AQQZMABYJFUPQE-NYYWCZLTSA-N 1 2 309.413 4.181 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1cccc(C(=O)N(C)C)c1 ZINC001174084455 1051998849 /nfs/dbraw/zinc/99/88/49/1051998849.db2.gz CLWTYYMCDAKUKH-UHFFFAOYSA-N 1 2 311.429 4.034 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)C1(CC)CCCCC1 ZINC000192259816 1052007691 /nfs/dbraw/zinc/00/76/91/1052007691.db2.gz VSJNRKFVFVSALM-UHFFFAOYSA-N 1 2 319.493 4.045 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cnn(Cc3ccccc3)c2)cc1 ZINC001174135129 1052012214 /nfs/dbraw/zinc/01/22/14/1052012214.db2.gz UQZWPNPPKBWYEX-UHFFFAOYSA-N 1 2 306.413 4.131 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cnn(Cc3ccccc3)c2)cc1 ZINC001174135129 1052012227 /nfs/dbraw/zinc/01/22/27/1052012227.db2.gz UQZWPNPPKBWYEX-UHFFFAOYSA-N 1 2 306.413 4.131 20 0 DIADLO COc1ccc(Nc2[nH+]cccc2N2CCCCC2)cc1Cl ZINC001174152649 1052022248 /nfs/dbraw/zinc/02/22/48/1052022248.db2.gz GPZMFWKZQRREIA-UHFFFAOYSA-N 1 2 317.820 4.478 20 0 DIADLO Cc1cccc(Nc2ccc(C(=O)Nc3ccccc3)cc2)[nH+]1 ZINC001174159784 1052024416 /nfs/dbraw/zinc/02/44/16/1052024416.db2.gz OKJDYIWNIJSWGD-UHFFFAOYSA-N 1 2 303.365 4.386 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@@H+]1Cc1coc(C2CC2)n1 ZINC000769333769 1052025958 /nfs/dbraw/zinc/02/59/58/1052025958.db2.gz KYXWKCIYUMCWHU-QGZVFWFLSA-N 1 2 312.413 4.288 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000769333769 1052025968 /nfs/dbraw/zinc/02/59/68/1052025968.db2.gz KYXWKCIYUMCWHU-QGZVFWFLSA-N 1 2 312.413 4.288 20 0 DIADLO CCCCc1noc([C@H](C)[NH+]2CCC(OCCC(C)C)CC2)n1 ZINC000193106012 1052029812 /nfs/dbraw/zinc/02/98/12/1052029812.db2.gz RLZMVPMTVWCHAS-HNNXBMFYSA-N 1 2 323.481 4.000 20 0 DIADLO Clc1csc(C[NH2+]Cc2nnc(-c3ccccc3)s2)c1 ZINC000193150178 1052031615 /nfs/dbraw/zinc/03/16/15/1052031615.db2.gz LAFYIHOFRYTLOT-UHFFFAOYSA-N 1 2 321.858 4.210 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1cccc(C(=O)N2CCCC2)c1 ZINC001174170238 1052031357 /nfs/dbraw/zinc/03/13/57/1052031357.db2.gz LSDZOLBTGHAJEY-UHFFFAOYSA-N 1 2 323.440 4.493 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1cccc(C(=O)N2CCCCC2)c1 ZINC001174177020 1052034724 /nfs/dbraw/zinc/03/47/24/1052034724.db2.gz QPVOJPPEPGUBTE-UHFFFAOYSA-N 1 2 323.440 4.322 20 0 DIADLO CCCCNC(=O)c1cccc(Nc2cc(CCC)cc[nH+]2)c1 ZINC001174190114 1052040570 /nfs/dbraw/zinc/04/05/70/1052040570.db2.gz DKAJRNWVIFEUHF-UHFFFAOYSA-N 1 2 311.429 4.308 20 0 DIADLO C[C@@H](CCC1CC1)[NH2+]c1ccc(N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000769417074 1052045537 /nfs/dbraw/zinc/04/55/37/1052045537.db2.gz PKGOEUHMVWDELM-HRCADAONSA-N 1 2 302.462 4.291 20 0 DIADLO Cc1n[nH]c(C)c1Nc1cc[nH+]c2cc(Br)ccc12 ZINC001174214823 1052053946 /nfs/dbraw/zinc/05/39/46/1052053946.db2.gz ACZBNWRIHZZNNE-UHFFFAOYSA-N 1 2 317.190 4.081 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(Cl)nc3ccccn32)[C@@H]1c1ccccc1 ZINC000769540389 1052066123 /nfs/dbraw/zinc/06/61/23/1052066123.db2.gz OEPGEKCPWCVWEQ-GUYCJALGSA-N 1 2 311.816 4.181 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c(Cl)nc3ccccn32)[C@@H]1c1ccccc1 ZINC000769540389 1052066127 /nfs/dbraw/zinc/06/61/27/1052066127.db2.gz OEPGEKCPWCVWEQ-GUYCJALGSA-N 1 2 311.816 4.181 20 0 DIADLO CCCC[C@H](C)[C@H](C)[NH2+]c1ccc(N2CCC(O)CC2)cc1 ZINC000808710014 1052071618 /nfs/dbraw/zinc/07/16/18/1052071618.db2.gz WQABUKCPNWHKMC-HOTGVXAUSA-N 1 2 304.478 4.274 20 0 DIADLO Cc1cc(-c2noc(-c3cccc4[nH+]ccn43)n2)ccc1Cl ZINC001217500593 1052075230 /nfs/dbraw/zinc/07/52/30/1052075230.db2.gz IRLHKUGUGOMDLK-UHFFFAOYSA-N 1 2 310.744 4.013 20 0 DIADLO Cc1ccccc1N1CC[NH+]([C@H](C)c2c(F)cccc2F)CC1 ZINC000195662154 1052075351 /nfs/dbraw/zinc/07/53/51/1052075351.db2.gz RFXWFGXJNRWQEQ-OAHLLOKOSA-N 1 2 316.395 4.156 20 0 DIADLO Cc1cc(NC(=O)c2ccc(-c3ccccc3)cc2)c(C)c[nH+]1 ZINC000747524957 1052075831 /nfs/dbraw/zinc/07/58/31/1052075831.db2.gz GQVVTJHCPFTQDW-UHFFFAOYSA-N 1 2 302.377 4.040 20 0 DIADLO C[N@H+](Cc1cnc(-c2ccco2)s1)Cc1ccccc1F ZINC000194305168 1052105657 /nfs/dbraw/zinc/10/56/57/1052105657.db2.gz STBUTQPUJWCPCM-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1cnc(-c2ccco2)s1)Cc1ccccc1F ZINC000194305168 1052105660 /nfs/dbraw/zinc/10/56/60/1052105660.db2.gz STBUTQPUJWCPCM-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO FC(F)(F)c1cc(Nc2cc[nH+]c3ccc(Cl)cc23)ccn1 ZINC001174360498 1052126196 /nfs/dbraw/zinc/12/61/96/1052126196.db2.gz YJJAQRCWNUSZBT-UHFFFAOYSA-N 1 2 323.705 4.468 20 0 DIADLO c1nc2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc2s1 ZINC001174363992 1052129624 /nfs/dbraw/zinc/12/96/24/1052129624.db2.gz NIVWZCJIUONPIO-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cnn(CC(F)(F)F)c3)ccc21 ZINC001174380626 1052138576 /nfs/dbraw/zinc/13/85/76/1052138576.db2.gz GOVNLCTVMIFBNF-UHFFFAOYSA-N 1 2 323.322 4.120 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4cn(C)nc43)ccc21 ZINC001174380969 1052138818 /nfs/dbraw/zinc/13/88/18/1052138818.db2.gz COJDEZKUMFGITL-UHFFFAOYSA-N 1 2 305.385 4.248 20 0 DIADLO COc1cccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)c1OC ZINC001174380942 1052139109 /nfs/dbraw/zinc/13/91/09/1052139109.db2.gz BHSULXULRGVNIH-UHFFFAOYSA-N 1 2 311.385 4.378 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3nc(Cl)cnc3Cl)ccc21 ZINC001174381922 1052140230 /nfs/dbraw/zinc/14/02/30/1052140230.db2.gz SONOGWCRRVYWOK-UHFFFAOYSA-N 1 2 322.199 4.458 20 0 DIADLO CC(=O)N(C)c1ccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cc1 ZINC001174381427 1052140259 /nfs/dbraw/zinc/14/02/59/1052140259.db2.gz KRLGOCZBEGMTAN-UHFFFAOYSA-N 1 2 322.412 4.344 20 0 DIADLO CCOc1ncc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cc1F ZINC001174381835 1052140288 /nfs/dbraw/zinc/14/02/88/1052140288.db2.gz QINRTURLXLSSNM-UHFFFAOYSA-N 1 2 314.364 4.294 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(F)nc(F)c3F)ccc21 ZINC001174382225 1052140460 /nfs/dbraw/zinc/14/04/60/1052140460.db2.gz FJXDYCZBWKMAFL-UHFFFAOYSA-N 1 2 306.291 4.173 20 0 DIADLO COC(=O)c1cccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)c1 ZINC001174381782 1052140776 /nfs/dbraw/zinc/14/07/76/1052140776.db2.gz SQCLIDYYFHAOEC-UHFFFAOYSA-N 1 2 309.369 4.147 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4cnncc43)ccc21 ZINC001174381960 1052141534 /nfs/dbraw/zinc/14/15/34/1052141534.db2.gz XUDDMHKARAKPHP-UHFFFAOYSA-N 1 2 303.369 4.304 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4c3CCC4=O)ccc21 ZINC001174382027 1052141595 /nfs/dbraw/zinc/14/15/95/1052141595.db2.gz ZYOMDLINBURAFY-UHFFFAOYSA-N 1 2 305.381 4.490 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc(C4OCCO4)cc3)ccc21 ZINC001174383261 1052142824 /nfs/dbraw/zinc/14/28/24/1052142824.db2.gz LLXSBJVEXACDCR-UHFFFAOYSA-N 1 2 323.396 4.406 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccnc3OC(F)F)ccc21 ZINC001174382373 1052143494 /nfs/dbraw/zinc/14/34/94/1052143494.db2.gz MXBAGKIYZYSNLM-UHFFFAOYSA-N 1 2 318.327 4.357 20 0 DIADLO COc1nc(Cl)ccc1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174382314 1052143764 /nfs/dbraw/zinc/14/37/64/1052143764.db2.gz JUORONYWIYOUKC-UHFFFAOYSA-N 1 2 316.792 4.418 20 0 DIADLO CC(C)(C)OC(=O)c1ccc(Nc2cccn3cc[nH+]c23)cc1 ZINC001174426663 1052155437 /nfs/dbraw/zinc/15/54/37/1052155437.db2.gz XIRKZRPEHMOBTP-UHFFFAOYSA-N 1 2 309.369 4.033 20 0 DIADLO COc1cc(Nc2cc[nH+]c3[nH]ccc32)cc(C(F)(F)F)c1 ZINC001174411085 1052164819 /nfs/dbraw/zinc/16/48/19/1052164819.db2.gz IRPFCXIGAPTYOC-UHFFFAOYSA-N 1 2 307.275 4.286 20 0 DIADLO c1cc2c([nH]1)[nH+]ccc2Nc1ccc(OCc2ccncc2)cc1 ZINC001174413416 1052165409 /nfs/dbraw/zinc/16/54/09/1052165409.db2.gz LMERBMONOGCDQJ-UHFFFAOYSA-N 1 2 316.364 4.232 20 0 DIADLO COc1cc(Nc2cc[nH+]c3[nH]ccc32)ccc1C(F)(F)F ZINC001174412417 1052165748 /nfs/dbraw/zinc/16/57/48/1052165748.db2.gz VGDVLQQIIANIRJ-UHFFFAOYSA-N 1 2 307.275 4.286 20 0 DIADLO c1cc(Nc2ccc(N3CCCCC3)[nH+]c2)cc(N2CCCC2)c1 ZINC001174486881 1052172174 /nfs/dbraw/zinc/17/21/74/1052172174.db2.gz WFZRGOPFJRKPIK-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO c1cc(Nc2ccc(N3CCCC3)[nH+]c2)cc(N2CCCC2)c1 ZINC001174488490 1052173647 /nfs/dbraw/zinc/17/36/47/1052173647.db2.gz MHZWJQQCOKSPHM-UHFFFAOYSA-N 1 2 308.429 4.026 20 0 DIADLO c1cn(Cc2ccc(Nc3cccc(N4CCCC4)c3)cc2)c[nH+]1 ZINC001174487749 1052173894 /nfs/dbraw/zinc/17/38/94/1052173894.db2.gz OKPOPQVDNRGRSF-UHFFFAOYSA-N 1 2 318.424 4.275 20 0 DIADLO c1cn(-c2cccc(Nc3cccc(N4CCCC4)c3)c2)c[nH+]1 ZINC001174488346 1052174114 /nfs/dbraw/zinc/17/41/14/1052174114.db2.gz KBSBUIFAZJATNY-UHFFFAOYSA-N 1 2 304.397 4.216 20 0 DIADLO c1n[nH]c([C@@H]([NH2+]CCC2=CCCCCC2)C2CCCCC2)n1 ZINC000494939909 1052179931 /nfs/dbraw/zinc/17/99/31/1052179931.db2.gz LMCZDUTVBIYPTJ-KRWDZBQOSA-N 1 2 302.466 4.296 20 0 DIADLO Cc1cccc(-c2ccccc2)c1O[C@H]1CC[NH2+]CC1(F)F ZINC001218005114 1052183965 /nfs/dbraw/zinc/18/39/65/1052183965.db2.gz DXJWNMXMNNHGDT-INIZCTEOSA-N 1 2 303.352 4.038 20 0 DIADLO C[C@H](CC[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1)c1ccccc1 ZINC000494983400 1052188337 /nfs/dbraw/zinc/18/83/37/1052188337.db2.gz YDJXRMKYPZYVGD-CRAIPNDOSA-N 1 2 312.461 4.210 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC000495087445 1052214859 /nfs/dbraw/zinc/21/48/59/1052214859.db2.gz SYBCJDQCUJYVCD-CYBMUJFWSA-N 1 2 304.821 4.117 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+]1CCn2cccc2[C@H]1C ZINC000495087445 1052214865 /nfs/dbraw/zinc/21/48/65/1052214865.db2.gz SYBCJDQCUJYVCD-CYBMUJFWSA-N 1 2 304.821 4.117 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N[C@@H](c2ccccn2)C(F)(F)F)c1 ZINC001168477341 1052218619 /nfs/dbraw/zinc/21/86/19/1052218619.db2.gz IWNDSQNFMZEWTD-AWEZNQCLSA-N 1 2 321.277 4.484 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N[C@H](c2ccccn2)C(F)(F)F)c1 ZINC001168477343 1052219700 /nfs/dbraw/zinc/21/97/00/1052219700.db2.gz IWNDSQNFMZEWTD-CQSZACIVSA-N 1 2 321.277 4.484 20 0 DIADLO Nc1cc[nH+]c(O[C@H]2CCN(c3ccccc3)c3ccccc32)c1 ZINC001218491328 1052249992 /nfs/dbraw/zinc/24/99/92/1052249992.db2.gz QDHZICJWLDALAT-IBGZPJMESA-N 1 2 317.392 4.326 20 0 DIADLO Cc1cc(C)c(NC(=O)NC[C@@H]2CCC[C@H](C)[C@H]2C)c(C)[nH+]1 ZINC001219009522 1052268333 /nfs/dbraw/zinc/26/83/33/1052268333.db2.gz CZFDPNGWMDLQTL-PEYYIBSZSA-N 1 2 303.450 4.201 20 0 DIADLO CN(C(=O)Nc1ccc2[nH+]ccn2c1)[C@@H]1CCC[C@@H]1C(C)(C)C ZINC001219557065 1052292931 /nfs/dbraw/zinc/29/29/31/1052292931.db2.gz PDVHUIFOKQLNBA-LSDHHAIUSA-N 1 2 314.433 4.013 20 0 DIADLO CN(C(=O)Nc1ccc2[nH+]ccn2c1)[C@H]1CCC[C@@H]1C(C)(C)C ZINC001219557063 1052293681 /nfs/dbraw/zinc/29/36/81/1052293681.db2.gz PDVHUIFOKQLNBA-GJZGRUSLSA-N 1 2 314.433 4.013 20 0 DIADLO CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001219556651 1052294041 /nfs/dbraw/zinc/29/40/41/1052294041.db2.gz AEWMLFLXXVFWMH-HUUCEWRRSA-N 1 2 314.433 4.061 20 0 DIADLO Nc1[nH+]cccc1CNC(=O)Nc1cccc(C2CCCCC2)c1 ZINC001219599811 1052295890 /nfs/dbraw/zinc/29/58/90/1052295890.db2.gz XBCFHJNRFPGNRZ-UHFFFAOYSA-N 1 2 324.428 4.033 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2csc(C)n2)c2ccccc2)cc1 ZINC000017317968 1052306930 /nfs/dbraw/zinc/30/69/30/1052306930.db2.gz MPLZPAFQZLISNJ-IBGZPJMESA-N 1 2 324.449 4.339 20 0 DIADLO CCCC[N@H+](Cc1noc(CC)n1)[C@@H](CC)c1ccccc1 ZINC000303611368 1052334216 /nfs/dbraw/zinc/33/42/16/1052334216.db2.gz LMMONEZYXLZDKN-INIZCTEOSA-N 1 2 301.434 4.385 20 0 DIADLO CCCC[N@@H+](Cc1noc(CC)n1)[C@@H](CC)c1ccccc1 ZINC000303611368 1052334222 /nfs/dbraw/zinc/33/42/22/1052334222.db2.gz LMMONEZYXLZDKN-INIZCTEOSA-N 1 2 301.434 4.385 20 0 DIADLO CCc1nc(C[N@@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)cs1 ZINC000303703982 1052338949 /nfs/dbraw/zinc/33/89/49/1052338949.db2.gz OOIKPNXSJPRDCR-GUYCJALGSA-N 1 2 318.511 4.384 20 0 DIADLO CCc1nc(C[N@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)cs1 ZINC000303703982 1052338953 /nfs/dbraw/zinc/33/89/53/1052338953.db2.gz OOIKPNXSJPRDCR-GUYCJALGSA-N 1 2 318.511 4.384 20 0 DIADLO CCn1c(-c2cccs2)nn(C[N@H+](C)[C@H](C)C(C)C)c1=S ZINC000915208823 1052366844 /nfs/dbraw/zinc/36/68/44/1052366844.db2.gz HYRXOFFFEKLUAG-GFCCVEGCSA-N 1 2 324.519 4.096 20 0 DIADLO CCn1c(-c2cccs2)nn(C[N@@H+](C)[C@H](C)C(C)C)c1=S ZINC000915208823 1052366845 /nfs/dbraw/zinc/36/68/45/1052366845.db2.gz HYRXOFFFEKLUAG-GFCCVEGCSA-N 1 2 324.519 4.096 20 0 DIADLO Cc1ccccc1-c1nn(C[N@H+](C)[C@@H](C)C(C)C)c(=S)o1 ZINC000915208483 1052367617 /nfs/dbraw/zinc/36/76/17/1052367617.db2.gz DMLNJJCXQJSJDC-ZDUSSCGKSA-N 1 2 305.447 4.115 20 0 DIADLO Cc1ccccc1-c1nn(C[N@@H+](C)[C@@H](C)C(C)C)c(=S)o1 ZINC000915208483 1052367611 /nfs/dbraw/zinc/36/76/11/1052367611.db2.gz DMLNJJCXQJSJDC-ZDUSSCGKSA-N 1 2 305.447 4.115 20 0 DIADLO CCCCCC[C@@](C)(CC)c1nc(Cc2c[nH+]cn2C)no1 ZINC000762412322 1052378367 /nfs/dbraw/zinc/37/83/67/1052378367.db2.gz VSQSFPYXAGNPOP-QGZVFWFLSA-N 1 2 304.438 4.032 20 0 DIADLO CC(C)c1cnc(SCc2cc[nH+]c(N(C)C)c2)n1C(C)C ZINC000762480051 1052390386 /nfs/dbraw/zinc/39/03/86/1052390386.db2.gz PWWHOIWVLILWJR-UHFFFAOYSA-N 1 2 318.490 4.341 20 0 DIADLO CCOc1cc(C)ccc1NCc1c[nH+]c(C)n1-c1ccccc1 ZINC000237048618 1052434810 /nfs/dbraw/zinc/43/48/10/1052434810.db2.gz ITSYBVBUIUUTDN-UHFFFAOYSA-N 1 2 321.424 4.500 20 0 DIADLO COc1ccc(Cl)c(NCc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000237441976 1052440360 /nfs/dbraw/zinc/44/03/60/1052440360.db2.gz KBMHKKFOOWONIU-UHFFFAOYSA-N 1 2 313.788 4.146 20 0 DIADLO c1cn(CCOC2c3ccccc3C=Cc3ccccc32)c[nH+]1 ZINC001222134141 1052448527 /nfs/dbraw/zinc/44/85/27/1052448527.db2.gz ADRJTGNGMVINCH-UHFFFAOYSA-N 1 2 302.377 4.173 20 0 DIADLO CCCOc1ccc(C)c(-c2ccc(Cn3cc[nH+]c3)cn2)c1 ZINC001222165465 1052455459 /nfs/dbraw/zinc/45/54/59/1052455459.db2.gz NEGYXXCRSLSTMT-UHFFFAOYSA-N 1 2 307.397 4.091 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)co1 ZINC000929891758 1052465335 /nfs/dbraw/zinc/46/53/35/1052465335.db2.gz QUVVAUIMEDJULX-MRXNPFEDSA-N 1 2 300.402 4.015 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)co1 ZINC000929891758 1052465338 /nfs/dbraw/zinc/46/53/38/1052465338.db2.gz QUVVAUIMEDJULX-MRXNPFEDSA-N 1 2 300.402 4.015 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccccc2n1C)c1cc(Cl)ccc1F ZINC001168498228 1052473704 /nfs/dbraw/zinc/47/37/04/1052473704.db2.gz PSJYAWJOOJGRNI-LLVKDONJSA-N 1 2 317.795 4.217 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1cccc(OC(F)(F)F)c1 ZINC001222327560 1052483885 /nfs/dbraw/zinc/48/38/85/1052483885.db2.gz OSGUXUXTLWYNER-UHFFFAOYSA-N 1 2 308.259 4.137 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(Cl)c(Cl)c3)nn2)c1C ZINC001222346434 1052487508 /nfs/dbraw/zinc/48/75/08/1052487508.db2.gz AXFATXDHHXWHLE-UHFFFAOYSA-N 1 2 319.195 4.253 20 0 DIADLO C[C@@H](OCc1c[nH+]cn1C)c1c(Cl)ccc(F)c1Cl ZINC001222585365 1052512686 /nfs/dbraw/zinc/51/26/86/1052512686.db2.gz HOLXJAKJFPAKTM-MRVPVSSYSA-N 1 2 303.164 4.144 20 0 DIADLO CSc1cc(NCc2ccc(F)c(Cl)c2F)nc(C)[nH+]1 ZINC001168503336 1052517997 /nfs/dbraw/zinc/51/79/97/1052517997.db2.gz LAMOWUYXKDLGOR-UHFFFAOYSA-N 1 2 315.776 4.051 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1cc(C)n(C)n1 ZINC000282121663 1052527602 /nfs/dbraw/zinc/52/76/02/1052527602.db2.gz JONYAOQYOHZHAW-JKSUJKDBSA-N 1 2 315.461 4.065 20 0 DIADLO Cc1ccsc1C[N@H+](C)Cc1csc(-c2ccco2)n1 ZINC000055472551 1052532289 /nfs/dbraw/zinc/53/22/89/1052532289.db2.gz HULYEGTYUFUTND-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1ccsc1C[N@@H+](C)Cc1csc(-c2ccco2)n1 ZINC000055472551 1052532300 /nfs/dbraw/zinc/53/23/00/1052532300.db2.gz HULYEGTYUFUTND-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1cc(C)cc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000107072343 1052543832 /nfs/dbraw/zinc/54/38/32/1052543832.db2.gz UHUVKUMRPYUCGT-KBPBESRZSA-N 1 2 301.434 4.396 20 0 DIADLO Fc1cccc(Cl)c1CNc1ccc(N2CCCC2)[nH+]c1 ZINC000036982235 1052576158 /nfs/dbraw/zinc/57/61/58/1052576158.db2.gz RNVVHTQPMHQLQZ-UHFFFAOYSA-N 1 2 305.784 4.086 20 0 DIADLO Cc1cc(CO[C@H]2CC[C@@H](OCc3ccccc3)C2)cc(C)[nH+]1 ZINC001223425793 1052600242 /nfs/dbraw/zinc/60/02/42/1052600242.db2.gz VCUWFIONJKKNSJ-UXHICEINSA-N 1 2 311.425 4.353 20 0 DIADLO Cc1cc(CO[C@@H]2CC[C@@H](OCc3ccccc3)C2)cc(C)[nH+]1 ZINC001223425795 1052600466 /nfs/dbraw/zinc/60/04/66/1052600466.db2.gz VCUWFIONJKKNSJ-WOJBJXKFSA-N 1 2 311.425 4.353 20 0 DIADLO CC[C@H]1CCCC[C@@H]1OC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000916293976 1052601488 /nfs/dbraw/zinc/60/14/88/1052601488.db2.gz QIGTVFJTTKZDOY-WMZOPIPTSA-N 1 2 312.413 4.057 20 0 DIADLO CC[N@H+](Cc1cocn1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000191941175 1052619158 /nfs/dbraw/zinc/61/91/58/1052619158.db2.gz XZXRJWNJZCYNEJ-LJQANCHMSA-N 1 2 310.372 4.425 20 0 DIADLO CC[N@@H+](Cc1cocn1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000191941175 1052619163 /nfs/dbraw/zinc/61/91/63/1052619163.db2.gz XZXRJWNJZCYNEJ-LJQANCHMSA-N 1 2 310.372 4.425 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H]2CCc3c2cc(F)cc3F)cs1 ZINC000154681096 1052638447 /nfs/dbraw/zinc/63/84/47/1052638447.db2.gz OLIDNKYYLKKEAY-XPTSAGLGSA-N 1 2 308.397 4.322 20 0 DIADLO Cc1cccc2c1CC[C@H]2[NH2+][C@H](C)c1noc(-c2ccccc2)n1 ZINC000124282186 1052639108 /nfs/dbraw/zinc/63/91/08/1052639108.db2.gz YVSXEBXOXTTXCU-RDTXWAMCSA-N 1 2 319.408 4.383 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1ccccc1Cl ZINC000063517386 1052641304 /nfs/dbraw/zinc/64/13/04/1052641304.db2.gz MEFMOVLIGWZYSH-AWEZNQCLSA-N 1 2 311.816 4.377 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000125586295 1052650936 /nfs/dbraw/zinc/65/09/36/1052650936.db2.gz SVTLAJYPDFOUHP-GOSISDBHSA-N 1 2 317.454 4.109 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000125586295 1052650939 /nfs/dbraw/zinc/65/09/39/1052650939.db2.gz SVTLAJYPDFOUHP-GOSISDBHSA-N 1 2 317.454 4.109 20 0 DIADLO CC[N@H+](Cc1nnc(C2CC2)o1)[C@H](C)c1cc2ccccc2o1 ZINC000125762357 1052652751 /nfs/dbraw/zinc/65/27/51/1052652751.db2.gz CNCVCJIBMJBSEI-GFCCVEGCSA-N 1 2 311.385 4.276 20 0 DIADLO CC[N@@H+](Cc1nnc(C2CC2)o1)[C@H](C)c1cc2ccccc2o1 ZINC000125762357 1052652753 /nfs/dbraw/zinc/65/27/53/1052652753.db2.gz CNCVCJIBMJBSEI-GFCCVEGCSA-N 1 2 311.385 4.276 20 0 DIADLO Fc1ccc2c(c1)nc(-c1ccc(-n3cc[nH+]c3)cc1)n2C1CC1 ZINC000916854941 1052660359 /nfs/dbraw/zinc/66/03/59/1052660359.db2.gz POKUZXVMVKCKER-UHFFFAOYSA-N 1 2 318.355 4.363 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@H](c2cccc(O)c2)C1 ZINC000127111716 1052688059 /nfs/dbraw/zinc/68/80/59/1052688059.db2.gz XRCLBIWTRNAGBI-ACJLOTCBSA-N 1 2 317.816 4.180 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCO[C@H](c2cccc(O)c2)C1 ZINC000127111716 1052688060 /nfs/dbraw/zinc/68/80/60/1052688060.db2.gz XRCLBIWTRNAGBI-ACJLOTCBSA-N 1 2 317.816 4.180 20 0 DIADLO CSc1ccc(C[N@H+](C)Cc2ccn(-c3ccccc3)n2)cc1 ZINC000917068290 1052690865 /nfs/dbraw/zinc/69/08/65/1052690865.db2.gz QMJVRJVRRBTXIK-UHFFFAOYSA-N 1 2 323.465 4.226 20 0 DIADLO CSc1ccc(C[N@@H+](C)Cc2ccn(-c3ccccc3)n2)cc1 ZINC000917068290 1052690867 /nfs/dbraw/zinc/69/08/67/1052690867.db2.gz QMJVRJVRRBTXIK-UHFFFAOYSA-N 1 2 323.465 4.226 20 0 DIADLO CCCCc1noc(C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)n1 ZINC000067712321 1052710120 /nfs/dbraw/zinc/71/01/20/1052710120.db2.gz GOZKWDKCDLDONT-QGZVFWFLSA-N 1 2 311.429 4.064 20 0 DIADLO CCCCc1noc(C[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)n1 ZINC000067712321 1052710123 /nfs/dbraw/zinc/71/01/23/1052710123.db2.gz GOZKWDKCDLDONT-QGZVFWFLSA-N 1 2 311.429 4.064 20 0 DIADLO CCOC(=[NH2+])CCCCOCc1ccc(C)cc1OC(C)C ZINC001224965903 1052738720 /nfs/dbraw/zinc/73/87/20/1052738720.db2.gz OCALKOPFAHCQAT-UHFFFAOYSA-N 1 2 307.434 4.483 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](CC)c2ccc(Cl)cc2)n1 ZINC000128801800 1052753528 /nfs/dbraw/zinc/75/35/28/1052753528.db2.gz XQCCQTQMNQSVSR-AWEZNQCLSA-N 1 2 307.825 4.307 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000069066733 1052778085 /nfs/dbraw/zinc/77/80/85/1052778085.db2.gz QMYIQCLXLIPJIU-GFCCVEGCSA-N 1 2 300.333 4.267 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000069066733 1052778089 /nfs/dbraw/zinc/77/80/89/1052778089.db2.gz QMYIQCLXLIPJIU-GFCCVEGCSA-N 1 2 300.333 4.267 20 0 DIADLO CC(C)c1cccc(NC(=O)C[N@H+](C)[C@H](C)c2ccco2)c1 ZINC000069067544 1052778979 /nfs/dbraw/zinc/77/89/79/1052778979.db2.gz NMYHGYGUQGBBOF-CQSZACIVSA-N 1 2 300.402 4.035 20 0 DIADLO CC(C)c1cccc(NC(=O)C[N@@H+](C)[C@H](C)c2ccco2)c1 ZINC000069067544 1052778982 /nfs/dbraw/zinc/77/89/82/1052778982.db2.gz NMYHGYGUQGBBOF-CQSZACIVSA-N 1 2 300.402 4.035 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000069067571 1052779347 /nfs/dbraw/zinc/77/93/47/1052779347.db2.gz VJFMNZSPCSCHKV-GFCCVEGCSA-N 1 2 300.333 4.267 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000069067571 1052779351 /nfs/dbraw/zinc/77/93/51/1052779351.db2.gz VJFMNZSPCSCHKV-GFCCVEGCSA-N 1 2 300.333 4.267 20 0 DIADLO Cc1cc(Cl)ccc1OC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000918210914 1052787997 /nfs/dbraw/zinc/78/79/97/1052787997.db2.gz AMDOAANKHJHVAY-UHFFFAOYSA-N 1 2 312.756 4.053 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)cc(C(F)(F)F)c1)c1nccs1 ZINC000129459037 1052790969 /nfs/dbraw/zinc/79/09/69/1052790969.db2.gz ORCHIPLTWTUIDI-QMMMGPOBSA-N 1 2 304.312 4.152 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccc(-c3ccccc3)cc2F)nn1C ZINC000556198124 1052818863 /nfs/dbraw/zinc/81/88/63/1052818863.db2.gz IVBANBQAFAUSIE-OAHLLOKOSA-N 1 2 323.415 4.385 20 0 DIADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccnc(Cl)c1 ZINC000154810769 1052831623 /nfs/dbraw/zinc/83/16/23/1052831623.db2.gz OYRORQABRKLCDS-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO CC(C)(C)[NH+]1CC(Oc2cccc(C(F)(F)F)c2Cl)C1 ZINC001225888877 1052843596 /nfs/dbraw/zinc/84/35/96/1052843596.db2.gz PBXNOIGLTRKIBJ-UHFFFAOYSA-N 1 2 307.743 4.220 20 0 DIADLO Clc1nccc(Nc2ccccc2-n2cc[nH+]c2)c1Cl ZINC001212237665 1052848519 /nfs/dbraw/zinc/84/85/19/1052848519.db2.gz ADDROPKYWQYVSA-UHFFFAOYSA-N 1 2 305.168 4.318 20 0 DIADLO C[N@H+](Cc1nc2cc(F)ccc2o1)Cc1ccc(Cl)c(F)c1 ZINC000556621796 1052872062 /nfs/dbraw/zinc/87/20/62/1052872062.db2.gz ISQVBRYIWNXLKY-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO C[N@@H+](Cc1nc2cc(F)ccc2o1)Cc1ccc(Cl)c(F)c1 ZINC000556621796 1052872064 /nfs/dbraw/zinc/87/20/64/1052872064.db2.gz ISQVBRYIWNXLKY-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+][C@H](C)c1c(F)cncc1F ZINC000556915631 1052898946 /nfs/dbraw/zinc/89/89/46/1052898946.db2.gz NRBGEYSBUYCLRR-VXGBXAGGSA-N 1 2 306.356 4.170 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2cc(Cl)ccc21)c1nc(C(C)(C)C)no1 ZINC000920060744 1052913444 /nfs/dbraw/zinc/91/34/44/1052913444.db2.gz TZWPIFTULNSXFR-HZMBPMFUSA-N 1 2 319.836 4.359 20 0 DIADLO CCC/C(C)=C/C(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1 ZINC000920217032 1052928581 /nfs/dbraw/zinc/92/85/81/1052928581.db2.gz IBQASVFPDZYJGO-GXDHUFHOSA-N 1 2 321.490 4.060 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)/C=C/c3ccccc3)c2)[nH+]c1C ZINC000920251953 1052930587 /nfs/dbraw/zinc/93/05/87/1052930587.db2.gz OXBRYMFAMQYRHN-VAWYXSNFSA-N 1 2 317.392 4.345 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3c(C)oc(C)c3C)c2)[nH+]c1C ZINC000920251175 1052930635 /nfs/dbraw/zinc/93/06/35/1052930635.db2.gz HBQNXBNYNSGPNI-UHFFFAOYSA-N 1 2 323.396 4.464 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)C[C@H]2CCCC[C@@H]2C)n1 ZINC000920459431 1052939906 /nfs/dbraw/zinc/93/99/06/1052939906.db2.gz AILBCGREVXHORT-UONOGXRCSA-N 1 2 323.506 4.140 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)C[C@H]2CCCC[C@H]2C)n1 ZINC000920459433 1052940132 /nfs/dbraw/zinc/94/01/32/1052940132.db2.gz AILBCGREVXHORT-ZIAGYGMSSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1cc(C)c(NC(=O)C(F)(F)c2cccc(Cl)c2)c(C)[nH+]1 ZINC000921002100 1052958251 /nfs/dbraw/zinc/95/82/51/1052958251.db2.gz IESLPUCRCWLZKO-UHFFFAOYSA-N 1 2 324.758 4.391 20 0 DIADLO Cc1ccccc1-c1nn(C[N@@H+](C)CCC(C)C)c(=S)o1 ZINC000921050519 1052960993 /nfs/dbraw/zinc/96/09/93/1052960993.db2.gz SVDVTMGLJMXRCP-UHFFFAOYSA-N 1 2 305.447 4.116 20 0 DIADLO Cc1ccccc1-c1nn(C[N@H+](C)CCC(C)C)c(=S)o1 ZINC000921050519 1052960997 /nfs/dbraw/zinc/96/09/97/1052960997.db2.gz SVDVTMGLJMXRCP-UHFFFAOYSA-N 1 2 305.447 4.116 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1csc2ccccc12 ZINC000610000988 1053002262 /nfs/dbraw/zinc/00/22/62/1053002262.db2.gz KWBZWJYMULCOGS-LBPRGKRZSA-N 1 2 305.443 4.063 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1csc2ccccc12 ZINC000610000988 1053002264 /nfs/dbraw/zinc/00/22/64/1053002264.db2.gz KWBZWJYMULCOGS-LBPRGKRZSA-N 1 2 305.443 4.063 20 0 DIADLO C[C@H]([NH2+]CC1(c2cccs2)CCCCC1)C(=O)OC(C)(C)C ZINC000610087614 1053007133 /nfs/dbraw/zinc/00/71/33/1053007133.db2.gz GTBIEQPFBCERCO-AWEZNQCLSA-N 1 2 323.502 4.270 20 0 DIADLO C[C@@H](CSC(C)(C)C)[NH2+]c1ccc(N2CCO[C@@H](C)C2)cc1 ZINC000179949604 1053037445 /nfs/dbraw/zinc/03/74/45/1053037445.db2.gz NETIMKYAMGFYPY-GJZGRUSLSA-N 1 2 322.518 4.244 20 0 DIADLO C[N@H+](CC(=O)c1cccc(O[C@H]2C=CCC2)c1)Cc1ccccc1 ZINC001228105446 1053044666 /nfs/dbraw/zinc/04/46/66/1053044666.db2.gz WHDWLKOJKIWIPP-IBGZPJMESA-N 1 2 321.420 4.099 20 0 DIADLO C[N@@H+](CC(=O)c1cccc(O[C@H]2C=CCC2)c1)Cc1ccccc1 ZINC001228105446 1053044667 /nfs/dbraw/zinc/04/46/67/1053044667.db2.gz WHDWLKOJKIWIPP-IBGZPJMESA-N 1 2 321.420 4.099 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+][C@H](c2ccc(F)cc2)C2CCC2)o1 ZINC000068828390 1053074658 /nfs/dbraw/zinc/07/46/58/1053074658.db2.gz WOFVBHZWUMXDRL-INIZCTEOSA-N 1 2 317.408 4.137 20 0 DIADLO Cc1[nH]c2ccc(O[C@@H]3CC[C@H](OCc4ccccc4)C3)cc2[nH+]1 ZINC001228330294 1053075405 /nfs/dbraw/zinc/07/54/05/1053075405.db2.gz XGTPNPRZOIFPPF-DLBZAZTESA-N 1 2 322.408 4.388 20 0 DIADLO C[N@H+](Cc1cc(F)c(F)c(F)c1)Cc1cccc(Cl)c1O ZINC000181011428 1053121353 /nfs/dbraw/zinc/12/13/53/1053121353.db2.gz PJWHFNSZBXEFOE-UHFFFAOYSA-N 1 2 315.722 4.095 20 0 DIADLO C[N@@H+](Cc1cc(F)c(F)c(F)c1)Cc1cccc(Cl)c1O ZINC000181011428 1053121360 /nfs/dbraw/zinc/12/13/60/1053121360.db2.gz PJWHFNSZBXEFOE-UHFFFAOYSA-N 1 2 315.722 4.095 20 0 DIADLO COc1ccccc1OCCNc1cc(C)c2ccccc2[nH+]1 ZINC001317690391 1053126747 /nfs/dbraw/zinc/12/67/47/1053126747.db2.gz NGRWRLIYGVPGGF-UHFFFAOYSA-N 1 2 308.381 4.043 20 0 DIADLO CCc1cccc(C[NH2+][C@@H](c2nccn2C)c2cccc(F)c2)c1 ZINC000572531867 1053205396 /nfs/dbraw/zinc/20/53/96/1053205396.db2.gz NCCGTOUADOTCAY-LJQANCHMSA-N 1 2 323.415 4.001 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3cc(Cl)cc(Cl)c3)ccn12 ZINC001351741995 1053219567 /nfs/dbraw/zinc/21/95/67/1053219567.db2.gz VFBKWJCHSLQHQG-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO Clc1ccc([C@H]2C[N@H+](CCCc3ccccc3)CCO2)s1 ZINC001319256352 1053230084 /nfs/dbraw/zinc/23/00/84/1053230084.db2.gz SKWNJKNKWJKHOZ-OAHLLOKOSA-N 1 2 321.873 4.408 20 0 DIADLO Clc1ccc([C@H]2C[N@@H+](CCCc3ccccc3)CCO2)s1 ZINC001319256352 1053230087 /nfs/dbraw/zinc/23/00/87/1053230087.db2.gz SKWNJKNKWJKHOZ-OAHLLOKOSA-N 1 2 321.873 4.408 20 0 DIADLO CC(C)c1cc(NCc2noc3ccccc23)nc(C(C)C)[nH+]1 ZINC000470022279 1053234475 /nfs/dbraw/zinc/23/44/75/1053234475.db2.gz JLMTVUGPCAKMOP-UHFFFAOYSA-N 1 2 310.401 4.477 20 0 DIADLO CC(C)(C)c1cnc(C[NH+]2CCC(Nc3ccccc3)CC2)o1 ZINC001319378352 1053239229 /nfs/dbraw/zinc/23/92/29/1053239229.db2.gz UWGIRORXGHIOLM-UHFFFAOYSA-N 1 2 313.445 4.049 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)cs1 ZINC001352041403 1053264157 /nfs/dbraw/zinc/26/41/57/1053264157.db2.gz JWOFXLMZBYDHDV-GFCCVEGCSA-N 1 2 322.371 4.133 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)cs1 ZINC001352041403 1053264174 /nfs/dbraw/zinc/26/41/74/1053264174.db2.gz JWOFXLMZBYDHDV-GFCCVEGCSA-N 1 2 322.371 4.133 20 0 DIADLO Cc1cc(N2CCC[C@H](C[C@H]3CCOC3)C2)[nH+]c2ccccc12 ZINC001319782684 1053273898 /nfs/dbraw/zinc/27/38/98/1053273898.db2.gz CXXJOOAQUHWZDG-IAGOWNOFSA-N 1 2 310.441 4.186 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2ncc(C(C)(C)C)o2)c1 ZINC001319858689 1053281998 /nfs/dbraw/zinc/28/19/98/1053281998.db2.gz JJRJVVJEIAMNOO-UHFFFAOYSA-N 1 2 306.431 4.118 20 0 DIADLO COc1c(C)c[nH+]c(CS[C@H](C)c2nc(C(C)C)no2)c1C ZINC001319859265 1053283675 /nfs/dbraw/zinc/28/36/75/1053283675.db2.gz SJFARKDHZWBLFI-GFCCVEGCSA-N 1 2 321.446 4.208 20 0 DIADLO Cc1ccc(N[C@H](C)c2ncc(Br)s2)c(C)[nH+]1 ZINC001319984098 1053291132 /nfs/dbraw/zinc/29/11/32/1053291132.db2.gz OTUPFJMXKNHJCG-SECBINFHSA-N 1 2 312.236 4.091 20 0 DIADLO Cc1cc(-c2ccccc2)ccc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001320179047 1053311963 /nfs/dbraw/zinc/31/19/63/1053311963.db2.gz JGLHMFHQFZRMTI-OAHLLOKOSA-N 1 2 305.381 4.058 20 0 DIADLO O=C(CCCCc1ccccc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001352517158 1053341626 /nfs/dbraw/zinc/34/16/26/1053341626.db2.gz SSECEDGQGIPNEF-UHFFFAOYSA-N 1 2 319.408 4.224 20 0 DIADLO Cc1ccc(CCn2nc(C(F)(F)F)c3c[nH+]ccc32)cc1 ZINC000092918707 1053353288 /nfs/dbraw/zinc/35/32/88/1053353288.db2.gz JBOOZVNZNGRLHV-UHFFFAOYSA-N 1 2 305.303 4.001 20 0 DIADLO CC(=O)c1cccc(-c2ccccc2)c1OC1C[NH+](C(C)(C)C)C1 ZINC001229565859 1053354177 /nfs/dbraw/zinc/35/41/77/1053354177.db2.gz JCRHZPUIZJOJIS-UHFFFAOYSA-N 1 2 323.436 4.418 20 0 DIADLO Oc1c(Cl)cccc1C[NH2+]CCCc1c[nH]c2ccccc12 ZINC000182190859 1053370125 /nfs/dbraw/zinc/37/01/25/1053370125.db2.gz WOTXHNCTXLNLAK-UHFFFAOYSA-N 1 2 314.816 4.249 20 0 DIADLO CC(C)n1cc(CNc2[nH+]c3ccccc3n2C(C)(C)C)cn1 ZINC001320888982 1053373315 /nfs/dbraw/zinc/37/33/15/1053373315.db2.gz OSTRISOIXYQMII-UHFFFAOYSA-N 1 2 311.433 4.181 20 0 DIADLO COc1ccc2c(c1)CCC[C@@H]2[N@H+](C)C/C(Cl)=C\Cl ZINC000763511634 1053403092 /nfs/dbraw/zinc/40/30/92/1053403092.db2.gz PZLYSVPXTQNSRY-RZXPCSSPSA-N 1 2 300.229 4.323 20 0 DIADLO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)C/C(Cl)=C\Cl ZINC000763511634 1053403098 /nfs/dbraw/zinc/40/30/98/1053403098.db2.gz PZLYSVPXTQNSRY-RZXPCSSPSA-N 1 2 300.229 4.323 20 0 DIADLO COC[C@H](C)CNc1[nH+]c2ccccc2n1C1CCCCC1 ZINC001474762163 1053432265 /nfs/dbraw/zinc/43/22/65/1053432265.db2.gz HTABMAPRMAOQCB-CQSZACIVSA-N 1 2 301.434 4.236 20 0 DIADLO COc1ccc(OC)c([C@@H](C)Oc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001229953906 1053438732 /nfs/dbraw/zinc/43/87/32/1053438732.db2.gz FMWJFMBBMNAXQP-CQSZACIVSA-N 1 2 324.380 4.030 20 0 DIADLO Nc1ncccc1CNc1[nH+]c2ccccc2n1C1CCCCC1 ZINC001474763411 1053440420 /nfs/dbraw/zinc/44/04/20/1053440420.db2.gz XRKWOBINGSYTGX-UHFFFAOYSA-N 1 2 321.428 4.131 20 0 DIADLO CC(C)c1ocnc1C[NH2+][C@H](C)c1ccc(C(F)(F)F)nc1 ZINC001352946444 1053441012 /nfs/dbraw/zinc/44/10/12/1053441012.db2.gz ZXIPIQOSIAVONZ-SNVBAGLBSA-N 1 2 313.323 4.063 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)Cc2cccc(C)c2C)cs1 ZINC000093737365 1053443057 /nfs/dbraw/zinc/44/30/57/1053443057.db2.gz DTKDPCFVAMHCBH-HNNXBMFYSA-N 1 2 318.486 4.489 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)Cc2cccc(C)c2C)cs1 ZINC000093737365 1053443064 /nfs/dbraw/zinc/44/30/64/1053443064.db2.gz DTKDPCFVAMHCBH-HNNXBMFYSA-N 1 2 318.486 4.489 20 0 DIADLO Cc1cccc(Cl)c1NC(=S)Nc1ccn2cc[nH+]c2c1 ZINC001200188311 1053446334 /nfs/dbraw/zinc/44/63/34/1053446334.db2.gz QLTWRDGFUSTAOX-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO c1cc(C[NH2+][C@@H](c2nccs2)c2ccccc2)n(C2CC2)c1 ZINC001353003459 1053455716 /nfs/dbraw/zinc/45/57/16/1053455716.db2.gz NVOUEICKXYDXKO-QGZVFWFLSA-N 1 2 309.438 4.159 20 0 DIADLO Clc1ccc([C@H]2C[N@@H+]([C@@H]3CCc4ccccc43)CCO2)s1 ZINC001322173729 1053466824 /nfs/dbraw/zinc/46/68/24/1053466824.db2.gz BNCVKRJHSVZGSZ-HUUCEWRRSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc([C@H]2C[N@H+]([C@@H]3CCc4ccccc43)CCO2)s1 ZINC001322173729 1053466831 /nfs/dbraw/zinc/46/68/31/1053466831.db2.gz BNCVKRJHSVZGSZ-HUUCEWRRSA-N 1 2 319.857 4.462 20 0 DIADLO Cc1cc(CNC(=O)N2c3ccccc3C(C)(C)[C@H]2C)cc(C)[nH+]1 ZINC001230229987 1053498966 /nfs/dbraw/zinc/49/89/66/1053498966.db2.gz WPYXRVNNWTYXNV-OAHLLOKOSA-N 1 2 323.440 4.094 20 0 DIADLO CC(C)Sc1ccc(Cl)cc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001322508764 1053515423 /nfs/dbraw/zinc/51/54/23/1053515423.db2.gz FVEFVJNJUDAPHN-LLVKDONJSA-N 1 2 323.849 4.237 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc(-n3ccnc3)cc2)ccc1[NH+](C)C ZINC000182849898 1053532278 /nfs/dbraw/zinc/53/22/78/1053532278.db2.gz KNBQWHCXYWFHPR-MRXNPFEDSA-N 1 2 320.440 4.420 20 0 DIADLO Cc1ccc(NC(=S)Nc2ccn3cc[nH+]c3c2)c(Cl)c1 ZINC001200330161 1053564793 /nfs/dbraw/zinc/56/47/93/1053564793.db2.gz RYERYZOVJBQACS-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO Cc1nc(N[C@@H](c2cccc(Cl)c2)c2ccccn2)cc[nH+]1 ZINC000152992758 1053566511 /nfs/dbraw/zinc/56/65/11/1053566511.db2.gz XGBVKYKAQNCXDA-KRWDZBQOSA-N 1 2 310.788 4.035 20 0 DIADLO CC(C)c1ocnc1C[N@H+]1[C@H](C)c2ccc(F)cc2C[C@@H]1C ZINC001323368234 1053578318 /nfs/dbraw/zinc/57/83/18/1053578318.db2.gz SXILZKAUHWSDLM-QWHCGFSZSA-N 1 2 302.393 4.445 20 0 DIADLO CC(C)c1ocnc1C[N@@H+]1[C@H](C)c2ccc(F)cc2C[C@@H]1C ZINC001323368234 1053578333 /nfs/dbraw/zinc/57/83/33/1053578333.db2.gz SXILZKAUHWSDLM-QWHCGFSZSA-N 1 2 302.393 4.445 20 0 DIADLO Cc1c([C@H](C)Nc2ccc(C)[nH+]c2C)cnn1-c1ccccc1 ZINC001323507830 1053587306 /nfs/dbraw/zinc/58/73/06/1053587306.db2.gz ZJJQKZRIMZKVPU-AWEZNQCLSA-N 1 2 306.413 4.366 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@@H](C)c3c(C)cccc3C)ccn12 ZINC001435585544 1053610817 /nfs/dbraw/zinc/61/08/17/1053610817.db2.gz VTJRQHSKYOXDKR-HNNXBMFYSA-N 1 2 308.381 4.178 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1ccc(F)cc1F ZINC000163172798 1053631284 /nfs/dbraw/zinc/63/12/84/1053631284.db2.gz FXTXLSLKSMKBPP-ZDUSSCGKSA-N 1 2 313.351 4.001 20 0 DIADLO CCc1cc(NC(=S)Nc2c(C)cccc2C(C)C)cc[nH+]1 ZINC001200398652 1053631276 /nfs/dbraw/zinc/63/12/76/1053631276.db2.gz RMQNKHBEBMWXLI-UHFFFAOYSA-N 1 2 313.470 4.307 20 0 DIADLO CC(C)CCc1noc(C[N@H+](Cc2cccs2)C(C)C)n1 ZINC000620278332 1053640293 /nfs/dbraw/zinc/64/02/93/1053640293.db2.gz LTFGKXATTCJSIF-UHFFFAOYSA-N 1 2 307.463 4.130 20 0 DIADLO CC(C)CCc1noc(C[N@@H+](Cc2cccs2)C(C)C)n1 ZINC000620278332 1053640301 /nfs/dbraw/zinc/64/03/01/1053640301.db2.gz LTFGKXATTCJSIF-UHFFFAOYSA-N 1 2 307.463 4.130 20 0 DIADLO Cc1ccc(OC[C@@H](C)Oc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001231080986 1053669209 /nfs/dbraw/zinc/66/92/09/1053669209.db2.gz JPYXDYXYFONQSC-OAHLLOKOSA-N 1 2 308.381 4.231 20 0 DIADLO Cc1ccc2c(c1)CC[C@@H]2Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231078367 1053669363 /nfs/dbraw/zinc/66/93/63/1053669363.db2.gz BJPNRXKQWVWBKU-FQEVSTJZSA-N 1 2 304.393 4.462 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(O[C@H]2CCC(=O)c3ccccc32)cc1 ZINC001231079222 1053669813 /nfs/dbraw/zinc/66/98/13/1053669813.db2.gz JDAUWVRANJATDA-FQEVSTJZSA-N 1 2 318.376 4.184 20 0 DIADLO COc1cccc([C@@H](C)Oc2ccc(-c3c[nH+]cn3C)cc2)c1 ZINC001231082945 1053671067 /nfs/dbraw/zinc/67/10/67/1053671067.db2.gz XUYNYSQDNPNZBH-CQSZACIVSA-N 1 2 308.381 4.236 20 0 DIADLO COc1ccc2c(c1)CC[C@H](Oc1ccc(-c3[nH]cc[nH+]3)cc1)C2 ZINC001231085823 1053673518 /nfs/dbraw/zinc/67/35/18/1053673518.db2.gz YQQYXFWWBXDUPW-IBGZPJMESA-N 1 2 320.392 4.022 20 0 DIADLO Cc1cccc(C[N@@H+]2CCO[C@H](c3ccc(Cl)s3)C2)c1 ZINC001324746451 1053675820 /nfs/dbraw/zinc/67/58/20/1053675820.db2.gz MJGJYNSAKGCYFL-AWEZNQCLSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cccc(C[N@H+]2CCO[C@H](c3ccc(Cl)s3)C2)c1 ZINC001324746451 1053675823 /nfs/dbraw/zinc/67/58/23/1053675823.db2.gz MJGJYNSAKGCYFL-AWEZNQCLSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1nc(C2([NH2+]Cc3c(C)cc(C)cc3C)CCCCC2)no1 ZINC000620618243 1053687906 /nfs/dbraw/zinc/68/79/06/1053687906.db2.gz HGKVLYBWJDBUHU-UHFFFAOYSA-N 1 2 313.445 4.252 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2csc(C(C)C)n2)CCC1 ZINC001324924253 1053688939 /nfs/dbraw/zinc/68/89/39/1053688939.db2.gz NACHNMDLBHIEHN-UHFFFAOYSA-N 1 2 316.470 4.444 20 0 DIADLO FC(F)(F)c1csc(C[NH+]2CCC3(CCCC3)CC2)n1 ZINC000154083068 1053723858 /nfs/dbraw/zinc/72/38/58/1053723858.db2.gz MIOYJFLNWHHRJI-UHFFFAOYSA-N 1 2 304.381 4.318 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+](CC)Cc2ccc(OC)cc2)n1 ZINC000154218645 1053730793 /nfs/dbraw/zinc/73/07/93/1053730793.db2.gz ORZWGVBEDFUZGB-AWEZNQCLSA-N 1 2 317.433 4.004 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+](CC)Cc2ccc(OC)cc2)n1 ZINC000154218645 1053730807 /nfs/dbraw/zinc/73/08/07/1053730807.db2.gz ORZWGVBEDFUZGB-AWEZNQCLSA-N 1 2 317.433 4.004 20 0 DIADLO Cc1cc(F)cc(N2CCC[C@H](c3nc4ccccc4o3)C2)[nH+]1 ZINC001354070120 1053756118 /nfs/dbraw/zinc/75/61/18/1053756118.db2.gz LINQUNBKJPVSOZ-ZDUSSCGKSA-N 1 2 311.360 4.054 20 0 DIADLO C[C@@H]1CC[C@H](CO)C[N@@H+]1Cc1c(Cl)ccc(Cl)c1Cl ZINC001231479412 1053760464 /nfs/dbraw/zinc/76/04/64/1053760464.db2.gz KKUDNDSNIMDWJO-ZJUUUORDSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[C@H](CO)C[N@H+]1Cc1c(Cl)ccc(Cl)c1Cl ZINC001231479412 1053760476 /nfs/dbraw/zinc/76/04/76/1053760476.db2.gz KKUDNDSNIMDWJO-ZJUUUORDSA-N 1 2 322.663 4.240 20 0 DIADLO Cc1cc(NC[C@H](c2ccnn2C)C(C)C)[nH+]c2ccccc12 ZINC001326185137 1053762614 /nfs/dbraw/zinc/76/26/14/1053762614.db2.gz JNJKLEITQGFWES-INIZCTEOSA-N 1 2 308.429 4.128 20 0 DIADLO Cc1cc(NC[C@@H](c2ccnn2C)C(C)C)[nH+]c2ccccc12 ZINC001326185138 1053762830 /nfs/dbraw/zinc/76/28/30/1053762830.db2.gz JNJKLEITQGFWES-MRXNPFEDSA-N 1 2 308.429 4.128 20 0 DIADLO CCOC(=O)CC[N@H+](C)Cc1c(Cl)ccc(Cl)c1Cl ZINC001231481941 1053764060 /nfs/dbraw/zinc/76/40/60/1053764060.db2.gz VRGOPPHNTRLXNF-UHFFFAOYSA-N 1 2 324.635 4.032 20 0 DIADLO CCOC(=O)CC[N@@H+](C)Cc1c(Cl)ccc(Cl)c1Cl ZINC001231481941 1053764069 /nfs/dbraw/zinc/76/40/69/1053764069.db2.gz VRGOPPHNTRLXNF-UHFFFAOYSA-N 1 2 324.635 4.032 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC001326267483 1053769552 /nfs/dbraw/zinc/76/95/52/1053769552.db2.gz QJCQXJOAQABFTI-IBGZPJMESA-N 1 2 319.383 4.015 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC001326267483 1053769557 /nfs/dbraw/zinc/76/95/57/1053769557.db2.gz QJCQXJOAQABFTI-IBGZPJMESA-N 1 2 319.383 4.015 20 0 DIADLO Cc1ccc(CSCc2ccc(-n3cc[nH+]c3)cc2C)nc1 ZINC001326257324 1053769612 /nfs/dbraw/zinc/76/96/12/1053769612.db2.gz ZZPRLOPVFNEXTA-UHFFFAOYSA-N 1 2 309.438 4.318 20 0 DIADLO CCOCC1CC[NH+](Cc2c(Cl)cc(F)cc2Cl)CC1 ZINC001237595986 1053770283 /nfs/dbraw/zinc/77/02/83/1053770283.db2.gz CFHQYGLJHNJYMY-UHFFFAOYSA-N 1 2 320.235 4.381 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3cncc(F)c3)co2)cc1 ZINC000155313097 1053774285 /nfs/dbraw/zinc/77/42/85/1053774285.db2.gz MVXNGQNFCHETPB-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO CN(C(=O)c1cc2c[nH+]ccc2[nH]1)C1CC(C)(C)CC(C)(C)C1 ZINC001300525464 1053779033 /nfs/dbraw/zinc/77/90/33/1053779033.db2.gz KMPIVJRSUQQZNB-UHFFFAOYSA-N 1 2 313.445 4.240 20 0 DIADLO CC(C)Oc1ccc(C[N@H+](C)Cc2ccccc2Cl)cn1 ZINC001231534495 1053779626 /nfs/dbraw/zinc/77/96/26/1053779626.db2.gz YTKYOPLCQLHZIT-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+](C)Cc2ccccc2Cl)cn1 ZINC001231534495 1053779632 /nfs/dbraw/zinc/77/96/32/1053779632.db2.gz YTKYOPLCQLHZIT-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2ccc(O)c(C(F)(F)F)c2)C1 ZINC001231523884 1053780008 /nfs/dbraw/zinc/78/00/08/1053780008.db2.gz IDJHAQVJYZJWPI-CQSZACIVSA-N 1 2 305.315 4.125 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2ccc(O)c(C(F)(F)F)c2)C1 ZINC001231523884 1053780018 /nfs/dbraw/zinc/78/00/18/1053780018.db2.gz IDJHAQVJYZJWPI-CQSZACIVSA-N 1 2 305.315 4.125 20 0 DIADLO CC[N@H+](Cc1nc2c(s1)CCCC2)Cc1cccc(F)c1 ZINC001231583252 1053789472 /nfs/dbraw/zinc/78/94/72/1053789472.db2.gz KCNYFIXLGSGCMQ-UHFFFAOYSA-N 1 2 304.434 4.183 20 0 DIADLO CC[N@@H+](Cc1nc2c(s1)CCCC2)Cc1cccc(F)c1 ZINC001231583252 1053789484 /nfs/dbraw/zinc/78/94/84/1053789484.db2.gz KCNYFIXLGSGCMQ-UHFFFAOYSA-N 1 2 304.434 4.183 20 0 DIADLO Fc1ccccc1[C@@H]1CCC[N@@H+]1Cc1nc2c(s1)CCCC2 ZINC001231582018 1053790178 /nfs/dbraw/zinc/79/01/78/1053790178.db2.gz CEWIYLKDDKVEKI-INIZCTEOSA-N 1 2 316.445 4.498 20 0 DIADLO Fc1ccccc1[C@@H]1CCC[N@H+]1Cc1nc2c(s1)CCCC2 ZINC001231582018 1053790193 /nfs/dbraw/zinc/79/01/93/1053790193.db2.gz CEWIYLKDDKVEKI-INIZCTEOSA-N 1 2 316.445 4.498 20 0 DIADLO COC1CC[NH+](Cc2cc(Cl)cc(Cl)c2Cl)CC1 ZINC001231600132 1053797917 /nfs/dbraw/zinc/79/79/17/1053797917.db2.gz VXLLMWPIZVYQAA-UHFFFAOYSA-N 1 2 308.636 4.258 20 0 DIADLO Cc1ccc(-c2ccc(C[N@@H+]3CCc4oc(C)nc4C3)cc2)o1 ZINC001231599816 1053799532 /nfs/dbraw/zinc/79/95/32/1053799532.db2.gz OJEOOYFFVMVVQT-UHFFFAOYSA-N 1 2 308.381 4.110 20 0 DIADLO Cc1ccc(-c2ccc(C[N@H+]3CCc4oc(C)nc4C3)cc2)o1 ZINC001231599816 1053799539 /nfs/dbraw/zinc/79/95/39/1053799539.db2.gz OJEOOYFFVMVVQT-UHFFFAOYSA-N 1 2 308.381 4.110 20 0 DIADLO Clc1cc(Cl)c(Cl)c(C[N@@H+]2CCC[C@]23CCOC3)c1 ZINC001231604508 1053801810 /nfs/dbraw/zinc/80/18/10/1053801810.db2.gz NOLHPVSXVHDAFY-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1cc(Cl)c(Cl)c(C[N@H+]2CCC[C@]23CCOC3)c1 ZINC001231604508 1053801828 /nfs/dbraw/zinc/80/18/28/1053801828.db2.gz NOLHPVSXVHDAFY-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO COc1cc(F)ccc1C[N@@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001231608690 1053802186 /nfs/dbraw/zinc/80/21/86/1053802186.db2.gz PWNOPDAQKKSSSF-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)ccc1C[N@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001231608690 1053802195 /nfs/dbraw/zinc/80/21/95/1053802195.db2.gz PWNOPDAQKKSSSF-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)ccn1 ZINC000671098167 1053803501 /nfs/dbraw/zinc/80/35/01/1053803501.db2.gz HXEGUBQOOWLDFW-AUUYWEPGSA-N 1 2 308.381 4.123 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1ccc(C)o1 ZINC000156411026 1053808282 /nfs/dbraw/zinc/80/82/82/1053808282.db2.gz GUSWMXHDXKZIIO-NHYWBVRUSA-N 1 2 311.784 4.419 20 0 DIADLO CC[C@H]([NH2+][C@H](COC)c1ccc(C)o1)c1ccc(F)cc1F ZINC000156455329 1053811145 /nfs/dbraw/zinc/81/11/45/1053811145.db2.gz IIYYQECWAHRKEX-JKSUJKDBSA-N 1 2 309.356 4.295 20 0 DIADLO CCc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)nc1 ZINC001231643078 1053813796 /nfs/dbraw/zinc/81/37/96/1053813796.db2.gz XZEWUYRACLENLJ-GOSISDBHSA-N 1 2 302.368 4.259 20 0 DIADLO CCc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)nc1 ZINC001231643078 1053813811 /nfs/dbraw/zinc/81/38/11/1053813811.db2.gz XZEWUYRACLENLJ-GOSISDBHSA-N 1 2 302.368 4.259 20 0 DIADLO CC(C)[C@H]1C[C@@H]1C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001436229852 1053817127 /nfs/dbraw/zinc/81/71/27/1053817127.db2.gz VZROHCMXNDUXOW-MSOLQXFVSA-N 1 2 324.424 4.084 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)cn1 ZINC001231658642 1053823877 /nfs/dbraw/zinc/82/38/77/1053823877.db2.gz FEULJBUHSIVECX-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)cn1 ZINC001231658642 1053823899 /nfs/dbraw/zinc/82/38/99/1053823899.db2.gz FEULJBUHSIVECX-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO COc1ccccc1C[NH2+]Cc1cc(Cl)sc1Cl ZINC000312556502 1053825413 /nfs/dbraw/zinc/82/54/13/1053825413.db2.gz JKHJZKSRUNDQHF-UHFFFAOYSA-N 1 2 302.226 4.353 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)Cc2cccc(F)c2)c(OC)c1 ZINC001231693869 1053832118 /nfs/dbraw/zinc/83/21/18/1053832118.db2.gz HBYBHVKWQMGOLT-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)Cc2cccc(F)c2)c(OC)c1 ZINC001231693869 1053832128 /nfs/dbraw/zinc/83/21/28/1053832128.db2.gz HBYBHVKWQMGOLT-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ncc(F)cc1C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001231742209 1053848894 /nfs/dbraw/zinc/84/88/94/1053848894.db2.gz MAJVQSJANOMXNU-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(F)cc1C[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001231742209 1053848907 /nfs/dbraw/zinc/84/89/07/1053848907.db2.gz MAJVQSJANOMXNU-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cccnc1OC(C)C ZINC001231762994 1053850087 /nfs/dbraw/zinc/85/00/87/1053850087.db2.gz VLRSJDIAEHDSRD-OAHLLOKOSA-N 1 2 314.429 4.070 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1cccnc1OC(C)C ZINC001231762994 1053850095 /nfs/dbraw/zinc/85/00/95/1053850095.db2.gz VLRSJDIAEHDSRD-OAHLLOKOSA-N 1 2 314.429 4.070 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000621114103 1053858774 /nfs/dbraw/zinc/85/87/74/1053858774.db2.gz DBRRGKMJDZBBQD-AWEZNQCLSA-N 1 2 309.438 4.053 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000621114103 1053858788 /nfs/dbraw/zinc/85/87/88/1053858788.db2.gz DBRRGKMJDZBBQD-AWEZNQCLSA-N 1 2 309.438 4.053 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)c(C)c1 ZINC001436381216 1053860101 /nfs/dbraw/zinc/86/01/01/1053860101.db2.gz GFNAVYXZPNFYSZ-UHFFFAOYSA-N 1 2 319.408 4.170 20 0 DIADLO COc1cccc2cc([C@H](C)[NH2+][C@@H](C)c3nnc(C)s3)oc21 ZINC000274288657 1053862959 /nfs/dbraw/zinc/86/29/59/1053862959.db2.gz ZYIZEWBGEHZFMD-UWVGGRQHSA-N 1 2 317.414 4.013 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc(OC(C)(C)C)cc1)C2 ZINC001231805615 1053865449 /nfs/dbraw/zinc/86/54/49/1053865449.db2.gz PRTBUUJLSRVZIS-UHFFFAOYSA-N 1 2 311.425 4.388 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc(OC(C)(C)C)cc1)C2 ZINC001231805615 1053865463 /nfs/dbraw/zinc/86/54/63/1053865463.db2.gz PRTBUUJLSRVZIS-UHFFFAOYSA-N 1 2 311.425 4.388 20 0 DIADLO C[N@H+](Cc1ccccc1)Cc1cnc(C(F)(F)F)cc1Cl ZINC001231898243 1053910278 /nfs/dbraw/zinc/91/02/78/1053910278.db2.gz ITRDFACAKPWLCK-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccccc1)Cc1cnc(C(F)(F)F)cc1Cl ZINC001231898243 1053910289 /nfs/dbraw/zinc/91/02/89/1053910289.db2.gz ITRDFACAKPWLCK-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO CC[N@H+](C)Cc1c(Br)ccc(C(F)(F)F)c1F ZINC001231920612 1053915872 /nfs/dbraw/zinc/91/58/72/1053915872.db2.gz KOGFNLGLRDFGOQ-UHFFFAOYSA-N 1 2 314.120 4.059 20 0 DIADLO CC[N@@H+](C)Cc1c(Br)ccc(C(F)(F)F)c1F ZINC001231920612 1053915882 /nfs/dbraw/zinc/91/58/82/1053915882.db2.gz KOGFNLGLRDFGOQ-UHFFFAOYSA-N 1 2 314.120 4.059 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)cnc1F ZINC001231927895 1053915972 /nfs/dbraw/zinc/91/59/72/1053915972.db2.gz YMDXKSBUCMWNNZ-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cccc(Cl)c2Cl)cnc1F ZINC001231927895 1053915984 /nfs/dbraw/zinc/91/59/84/1053915984.db2.gz YMDXKSBUCMWNNZ-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)C1=C(c2ccccc2)CCCC1 ZINC001436598727 1053916219 /nfs/dbraw/zinc/91/62/19/1053916219.db2.gz PAEDMVMGEGDCRE-UHFFFAOYSA-N 1 2 317.392 4.301 20 0 DIADLO CCCCc1noc(C[N@H+](C)[C@H](C)c2cc(C)ccc2C)n1 ZINC000621281407 1053934355 /nfs/dbraw/zinc/93/43/55/1053934355.db2.gz JRVRTBSSDGADIH-OAHLLOKOSA-N 1 2 301.434 4.222 20 0 DIADLO CCCCc1noc(C[N@@H+](C)[C@H](C)c2cc(C)ccc2C)n1 ZINC000621281407 1053934364 /nfs/dbraw/zinc/93/43/64/1053934364.db2.gz JRVRTBSSDGADIH-OAHLLOKOSA-N 1 2 301.434 4.222 20 0 DIADLO Cc1ccccc1-c1noc(C[N@@H+](Cc2ccco2)C(C)C)n1 ZINC000621273472 1053939540 /nfs/dbraw/zinc/93/95/40/1053939540.db2.gz ALXLVPXKQJELCO-UHFFFAOYSA-N 1 2 311.385 4.049 20 0 DIADLO Cc1ccccc1-c1noc(C[N@H+](Cc2ccco2)C(C)C)n1 ZINC000621273472 1053939558 /nfs/dbraw/zinc/93/95/58/1053939558.db2.gz ALXLVPXKQJELCO-UHFFFAOYSA-N 1 2 311.385 4.049 20 0 DIADLO Cc1nccnc1C[NH2+]C1(c2c(Cl)cccc2Cl)CCC1 ZINC000621350830 1053953982 /nfs/dbraw/zinc/95/39/82/1053953982.db2.gz VOWDICVSTRXRGT-UHFFFAOYSA-N 1 2 322.239 4.261 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2nc(Cl)ccc2F)cc1 ZINC001232162300 1053975362 /nfs/dbraw/zinc/97/53/62/1053975362.db2.gz CKMIEPDVUNEKCD-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2nc(Cl)ccc2F)cc1 ZINC001232162300 1053975368 /nfs/dbraw/zinc/97/53/68/1053975368.db2.gz CKMIEPDVUNEKCD-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO CC[C@H]1CO[C@](C)(CCC(C)C)[N@@H+]1Cc1cn(C)nc1C1CC1 ZINC001232175020 1053977864 /nfs/dbraw/zinc/97/78/64/1053977864.db2.gz SBQNSJKUVHOHIH-PKOBYXMFSA-N 1 2 319.493 4.061 20 0 DIADLO CC[C@H]1CO[C@](C)(CCC(C)C)[N@H+]1Cc1cn(C)nc1C1CC1 ZINC001232175020 1053977875 /nfs/dbraw/zinc/97/78/75/1053977875.db2.gz SBQNSJKUVHOHIH-PKOBYXMFSA-N 1 2 319.493 4.061 20 0 DIADLO Clc1ccc(-c2ccccc2C[N@@H+]2CCn3nccc3C2)cc1 ZINC001232198290 1053984955 /nfs/dbraw/zinc/98/49/55/1053984955.db2.gz OWBIGJMKTNHNRH-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Clc1ccc(-c2ccccc2C[N@H+]2CCn3nccc3C2)cc1 ZINC001232198290 1053984968 /nfs/dbraw/zinc/98/49/68/1053984968.db2.gz OWBIGJMKTNHNRH-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Fc1cccc2c(C[N@@H+]3CCC[C@H]3c3nccs3)ccnc12 ZINC001232211504 1053990607 /nfs/dbraw/zinc/99/06/07/1053990607.db2.gz GLCDZEDLDLGKEL-HNNXBMFYSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1cccc2c(C[N@H+]3CCC[C@H]3c3nccs3)ccnc12 ZINC001232211504 1053990615 /nfs/dbraw/zinc/99/06/15/1053990615.db2.gz GLCDZEDLDLGKEL-HNNXBMFYSA-N 1 2 313.401 4.168 20 0 DIADLO CCOc1cncc(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC001329490943 1053991800 /nfs/dbraw/zinc/99/18/00/1053991800.db2.gz JHMKURYRSWTWRI-GFCCVEGCSA-N 1 2 319.474 4.085 20 0 DIADLO Cc1nccnc1C[N@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000621715417 1053999062 /nfs/dbraw/zinc/99/90/62/1053999062.db2.gz UFQCYYXUWFKQIE-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO Cc1nccnc1C[N@@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000621715417 1053999068 /nfs/dbraw/zinc/99/90/68/1053999068.db2.gz UFQCYYXUWFKQIE-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO C[N@H+](Cc1nccn1C(F)F)Cc1ccc(C(C)(C)C)cc1 ZINC000621722748 1054000837 /nfs/dbraw/zinc/00/08/37/1054000837.db2.gz IKBOUZZVEGLPAQ-UHFFFAOYSA-N 1 2 307.388 4.208 20 0 DIADLO C[N@@H+](Cc1nccn1C(F)F)Cc1ccc(C(C)(C)C)cc1 ZINC000621722748 1054000849 /nfs/dbraw/zinc/00/08/49/1054000849.db2.gz IKBOUZZVEGLPAQ-UHFFFAOYSA-N 1 2 307.388 4.208 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCCC[C@H]2c2nc(C)no2)s1 ZINC000621727473 1054001782 /nfs/dbraw/zinc/00/17/82/1054001782.db2.gz DTYKHZQKEKKIQC-HNNXBMFYSA-N 1 2 305.447 4.119 20 0 DIADLO CCCc1ccc(C[N@H+]2CCCC[C@H]2c2nc(C)no2)s1 ZINC000621727473 1054001794 /nfs/dbraw/zinc/00/17/94/1054001794.db2.gz DTYKHZQKEKKIQC-HNNXBMFYSA-N 1 2 305.447 4.119 20 0 DIADLO CC1(C)C[N@H+](Cc2ccnc(C(F)(F)F)c2)Cc2ccccc21 ZINC001232240476 1054003533 /nfs/dbraw/zinc/00/35/33/1054003533.db2.gz IOQYNIRPQITTEU-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccnc(C(F)(F)F)c2)Cc2ccccc21 ZINC001232240476 1054003542 /nfs/dbraw/zinc/00/35/42/1054003542.db2.gz IOQYNIRPQITTEU-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO FCCCC[NH2+][C@H](c1ccc(Br)cc1)C(F)F ZINC000621761586 1054008104 /nfs/dbraw/zinc/00/81/04/1054008104.db2.gz IUVDYMHYPRMFOE-LLVKDONJSA-N 1 2 310.157 4.095 20 0 DIADLO O=C(Nc1ccccc1)[C@@H]1CCC[N@H+]1Cc1cc(Cl)cs1 ZINC001232282825 1054012698 /nfs/dbraw/zinc/01/26/98/1054012698.db2.gz AQUZHSWSCRJQGQ-HNNXBMFYSA-N 1 2 320.845 4.005 20 0 DIADLO O=C(Nc1ccccc1)[C@@H]1CCC[N@@H+]1Cc1cc(Cl)cs1 ZINC001232282825 1054012709 /nfs/dbraw/zinc/01/27/09/1054012709.db2.gz AQUZHSWSCRJQGQ-HNNXBMFYSA-N 1 2 320.845 4.005 20 0 DIADLO CC(C)Oc1cccc([C@@H]([NH2+]CC[C@H]2CC2(F)F)C(F)F)c1 ZINC000621767310 1054013473 /nfs/dbraw/zinc/01/34/73/1054013473.db2.gz BMWJCXUCXQQTOV-GXTWGEPZSA-N 1 2 319.342 4.415 20 0 DIADLO CC(C)C[C@H](C(=O)N[C@H]1CCCC12CCCCC2)n1cc[nH+]c1 ZINC001300770103 1054022073 /nfs/dbraw/zinc/02/20/73/1054022073.db2.gz NQZVGDLZIIESHZ-SJORKVTESA-N 1 2 317.477 4.090 20 0 DIADLO C[C@H](c1ccco1)c1noc([C@@H]2CCC[N@@H+]2Cc2ccccc2)n1 ZINC000621795450 1054022899 /nfs/dbraw/zinc/02/28/99/1054022899.db2.gz ISNPQLILRIPLTN-ZBFHGGJFSA-N 1 2 323.396 4.152 20 0 DIADLO C[C@H](c1ccco1)c1noc([C@@H]2CCC[N@H+]2Cc2ccccc2)n1 ZINC000621795450 1054022913 /nfs/dbraw/zinc/02/29/13/1054022913.db2.gz ISNPQLILRIPLTN-ZBFHGGJFSA-N 1 2 323.396 4.152 20 0 DIADLO COc1cc(C[N@@H+]2CC[C@@H]2c2ccccc2)c(OC)cc1Cl ZINC001232372575 1054029568 /nfs/dbraw/zinc/02/95/68/1054029568.db2.gz AIBHPMBVZJYYBJ-MRXNPFEDSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(C[N@H+]2CC[C@@H]2c2ccccc2)c(OC)cc1Cl ZINC001232372575 1054029573 /nfs/dbraw/zinc/02/95/73/1054029573.db2.gz AIBHPMBVZJYYBJ-MRXNPFEDSA-N 1 2 317.816 4.304 20 0 DIADLO Cc1ccc(OCc2ccccc2)c(C[N@@H+]2CCCC(=O)CC2)c1 ZINC001232375742 1054033761 /nfs/dbraw/zinc/03/37/61/1054033761.db2.gz OULHPEAFDVFAEZ-UHFFFAOYSA-N 1 2 323.436 4.129 20 0 DIADLO Cc1ccc(OCc2ccccc2)c(C[N@H+]2CCCC(=O)CC2)c1 ZINC001232375742 1054033770 /nfs/dbraw/zinc/03/37/70/1054033770.db2.gz OULHPEAFDVFAEZ-UHFFFAOYSA-N 1 2 323.436 4.129 20 0 DIADLO Cc1ccc(SCc2cccc(C[NH+]3CCOCC3)c2)cc1 ZINC001472939184 1054036084 /nfs/dbraw/zinc/03/60/84/1054036084.db2.gz RAJWAFVZOJWLOK-UHFFFAOYSA-N 1 2 313.466 4.120 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc(C)ccc2OC(C)C)no1 ZINC001232394051 1054037817 /nfs/dbraw/zinc/03/78/17/1054037817.db2.gz IIFLZKJCODZMHF-SFHVURJKSA-N 1 2 314.429 4.416 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc(C)ccc2OC(C)C)no1 ZINC001232394051 1054037827 /nfs/dbraw/zinc/03/78/27/1054037827.db2.gz IIFLZKJCODZMHF-SFHVURJKSA-N 1 2 314.429 4.416 20 0 DIADLO Cc1cccc(C[N@@H+]2CCCC(=O)CC2)c1OCc1ccccc1 ZINC001232398020 1054039692 /nfs/dbraw/zinc/03/96/92/1054039692.db2.gz RAALLIJQXPUDLG-UHFFFAOYSA-N 1 2 323.436 4.129 20 0 DIADLO Cc1cccc(C[N@H+]2CCCC(=O)CC2)c1OCc1ccccc1 ZINC001232398020 1054039701 /nfs/dbraw/zinc/03/97/01/1054039701.db2.gz RAALLIJQXPUDLG-UHFFFAOYSA-N 1 2 323.436 4.129 20 0 DIADLO Cc1c(F)cc(C[N@@H+](CC(=O)c2ccccc2)C(C)C)cc1F ZINC001232424722 1054042172 /nfs/dbraw/zinc/04/21/72/1054042172.db2.gz QFGFXWZHAFKOJG-UHFFFAOYSA-N 1 2 317.379 4.367 20 0 DIADLO Cc1c(F)cc(C[N@H+](CC(=O)c2ccccc2)C(C)C)cc1F ZINC001232424722 1054042188 /nfs/dbraw/zinc/04/21/88/1054042188.db2.gz QFGFXWZHAFKOJG-UHFFFAOYSA-N 1 2 317.379 4.367 20 0 DIADLO CC(C)(C)[C@H]([NH2+]Cc1nc(CC2CC2)no1)c1cccc(F)c1 ZINC001330673128 1054044736 /nfs/dbraw/zinc/04/47/36/1054044736.db2.gz UZMKKIFDMMLCCF-QGZVFWFLSA-N 1 2 317.408 4.038 20 0 DIADLO O=C(c1ccccc1)[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)o2)C1 ZINC001232444894 1054047126 /nfs/dbraw/zinc/04/71/26/1054047126.db2.gz DJPVYRPMLFFDOZ-ZDUSSCGKSA-N 1 2 323.314 4.003 20 0 DIADLO O=C(c1ccccc1)[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)o2)C1 ZINC001232444894 1054047139 /nfs/dbraw/zinc/04/71/39/1054047139.db2.gz DJPVYRPMLFFDOZ-ZDUSSCGKSA-N 1 2 323.314 4.003 20 0 DIADLO CCOc1ccc(NCc2c[nH+]c(C)n2-c2ccccc2)cc1 ZINC000081292948 1054049135 /nfs/dbraw/zinc/04/91/35/1054049135.db2.gz HSYHMHVHQVCQGB-UHFFFAOYSA-N 1 2 307.397 4.192 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)c[nH]1 ZINC001232463260 1054050386 /nfs/dbraw/zinc/05/03/86/1054050386.db2.gz FXODLTBHWIDXHL-LBPRGKRZSA-N 1 2 310.228 4.014 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)c[nH]1 ZINC001232463260 1054050401 /nfs/dbraw/zinc/05/04/01/1054050401.db2.gz FXODLTBHWIDXHL-LBPRGKRZSA-N 1 2 310.228 4.014 20 0 DIADLO FCc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)n1 ZINC001232539045 1054066986 /nfs/dbraw/zinc/06/69/86/1054066986.db2.gz WWJVUCGQIIBCSO-QGZVFWFLSA-N 1 2 306.331 4.166 20 0 DIADLO FCc1cccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)n1 ZINC001232539045 1054066997 /nfs/dbraw/zinc/06/69/97/1054066997.db2.gz WWJVUCGQIIBCSO-QGZVFWFLSA-N 1 2 306.331 4.166 20 0 DIADLO CCC(C)(C)CC(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001355162754 1054069662 /nfs/dbraw/zinc/06/96/62/1054069662.db2.gz PTJNPZBQXXASAA-HNNXBMFYSA-N 1 2 319.493 4.170 20 0 DIADLO CCOc1ccnc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001232585713 1054077683 /nfs/dbraw/zinc/07/76/83/1054077683.db2.gz HCGHNSHTNHSAHN-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccnc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001232585713 1054077693 /nfs/dbraw/zinc/07/76/93/1054077693.db2.gz HCGHNSHTNHSAHN-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@H](c3ccccc3)[C@H]2C)c(C)[nH+]1 ZINC001355213432 1054083577 /nfs/dbraw/zinc/08/35/77/1054083577.db2.gz YVZBTZIZCZXSBR-AEFFLSMTSA-N 1 2 308.425 4.025 20 0 DIADLO C[N@H+](CCc1cccc(Cl)c1)Cc1c(Cl)ccnc1F ZINC001232618202 1054084568 /nfs/dbraw/zinc/08/45/68/1054084568.db2.gz MISOAINUCZZLRF-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1cccc(Cl)c1)Cc1c(Cl)ccnc1F ZINC001232618202 1054084582 /nfs/dbraw/zinc/08/45/82/1054084582.db2.gz MISOAINUCZZLRF-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO Fc1nccc(Cl)c1C[N@H+](Cc1ccccc1)C1CCC1 ZINC001232619723 1054085582 /nfs/dbraw/zinc/08/55/82/1054085582.db2.gz ZFADQLVQMQLZME-UHFFFAOYSA-N 1 2 304.796 4.429 20 0 DIADLO Fc1nccc(Cl)c1C[N@@H+](Cc1ccccc1)C1CCC1 ZINC001232619723 1054085594 /nfs/dbraw/zinc/08/55/94/1054085594.db2.gz ZFADQLVQMQLZME-UHFFFAOYSA-N 1 2 304.796 4.429 20 0 DIADLO C[C@@H]1CCCCC[N@@H+]1Cc1cc(F)c(O)c(Br)c1 ZINC001232640888 1054092477 /nfs/dbraw/zinc/09/24/77/1054092477.db2.gz SWYUJLPLQGNKCO-SNVBAGLBSA-N 1 2 316.214 4.058 20 0 DIADLO C[C@@H]1CCCCC[N@H+]1Cc1cc(F)c(O)c(Br)c1 ZINC001232640888 1054092488 /nfs/dbraw/zinc/09/24/88/1054092488.db2.gz SWYUJLPLQGNKCO-SNVBAGLBSA-N 1 2 316.214 4.058 20 0 DIADLO CCC[N@H+](Cc1cc(F)c(O)c(Br)c1)[C@H](C)CC ZINC001232630035 1054090012 /nfs/dbraw/zinc/09/00/12/1054090012.db2.gz JAKYUAKKRBOAOX-SNVBAGLBSA-N 1 2 318.230 4.304 20 0 DIADLO CCC[N@@H+](Cc1cc(F)c(O)c(Br)c1)[C@H](C)CC ZINC001232630035 1054090027 /nfs/dbraw/zinc/09/00/27/1054090027.db2.gz JAKYUAKKRBOAOX-SNVBAGLBSA-N 1 2 318.230 4.304 20 0 DIADLO CCOc1ccccc1C[NH2+]Cc1coc(-c2ccc(C)cc2)n1 ZINC000072180415 1054090208 /nfs/dbraw/zinc/09/02/08/1054090208.db2.gz MCDQCZIHVCDNBZ-UHFFFAOYSA-N 1 2 322.408 4.339 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(F)ccc(Cl)c2Br)C1 ZINC001232690251 1054101242 /nfs/dbraw/zinc/10/12/42/1054101242.db2.gz FQRODGLNFJHTGK-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(F)ccc(Cl)c2Br)C1 ZINC001232690251 1054101246 /nfs/dbraw/zinc/10/12/46/1054101246.db2.gz FQRODGLNFJHTGK-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO Fc1cc(C[N@@H+]2CC[C@@H]3CCCO[C@@H]3C2)c(Cl)cc1Cl ZINC001232703762 1054105135 /nfs/dbraw/zinc/10/51/35/1054105135.db2.gz ZIHQARDAMDXDJB-ZUZCIYMTSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1cc(C[N@H+]2CC[C@@H]3CCCO[C@@H]3C2)c(Cl)cc1Cl ZINC001232703762 1054105141 /nfs/dbraw/zinc/10/51/41/1054105141.db2.gz ZIHQARDAMDXDJB-ZUZCIYMTSA-N 1 2 318.219 4.133 20 0 DIADLO CSC1CC[NH+](Cc2cc(F)c(Cl)cc2Cl)CC1 ZINC001232699653 1054105280 /nfs/dbraw/zinc/10/52/80/1054105280.db2.gz ASFBOHKGPLVBEZ-UHFFFAOYSA-N 1 2 308.249 4.460 20 0 DIADLO C[N@H+](Cc1cccc(O)c1)Cc1cc(F)c(Cl)cc1Cl ZINC001232698945 1054105447 /nfs/dbraw/zinc/10/54/47/1054105447.db2.gz UPDURJZISJCENF-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO C[N@@H+](Cc1cccc(O)c1)Cc1cc(F)c(Cl)cc1Cl ZINC001232698945 1054105454 /nfs/dbraw/zinc/10/54/54/1054105454.db2.gz UPDURJZISJCENF-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO CC(C)(C)Cc1ccccc1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001437905423 1054111374 /nfs/dbraw/zinc/11/13/74/1054111374.db2.gz ITWIAWZHJQWFIC-UHFFFAOYSA-N 1 2 307.397 4.175 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Br)co2)Cc2ccccc21 ZINC001232850588 1054130756 /nfs/dbraw/zinc/13/07/56/1054130756.db2.gz SKEFUVBFWKYEHP-LLVKDONJSA-N 1 2 306.203 4.161 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Br)co2)Cc2ccccc21 ZINC001232850588 1054130762 /nfs/dbraw/zinc/13/07/62/1054130762.db2.gz SKEFUVBFWKYEHP-LLVKDONJSA-N 1 2 306.203 4.161 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1cccc(O)c1Cl ZINC001232788560 1054121338 /nfs/dbraw/zinc/12/13/38/1054121338.db2.gz CFYOBWFGNWPZEB-LBPRGKRZSA-N 1 2 305.805 4.247 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1cccc(O)c1Cl ZINC001232788560 1054121344 /nfs/dbraw/zinc/12/13/44/1054121344.db2.gz CFYOBWFGNWPZEB-LBPRGKRZSA-N 1 2 305.805 4.247 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2ccc(C(F)(F)F)nc2Cl)C1 ZINC001232790871 1054121790 /nfs/dbraw/zinc/12/17/90/1054121790.db2.gz HEHBPKMFAOZZFZ-CYBMUJFWSA-N 1 2 324.749 4.468 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2ccc(C(F)(F)F)nc2Cl)C1 ZINC001232790871 1054121799 /nfs/dbraw/zinc/12/17/99/1054121799.db2.gz HEHBPKMFAOZZFZ-CYBMUJFWSA-N 1 2 324.749 4.468 20 0 DIADLO COc1cc(O)cc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1 ZINC001232803755 1054124585 /nfs/dbraw/zinc/12/45/85/1054124585.db2.gz PQOHZJDKTWFESB-GOSISDBHSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cc(O)cc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)c1 ZINC001232803755 1054124590 /nfs/dbraw/zinc/12/45/90/1054124590.db2.gz PQOHZJDKTWFESB-GOSISDBHSA-N 1 2 319.351 4.016 20 0 DIADLO CC(C)c1nsc(C[NH2+][C@@H](C)c2ccc(Cl)c(F)c2)n1 ZINC001332713296 1054125490 /nfs/dbraw/zinc/12/54/90/1054125490.db2.gz CSAZXKNNXLFRJX-VIFPVBQESA-N 1 2 313.829 4.305 20 0 DIADLO CO[C@@H]1CCC[N@H+](Cc2c(Cl)cc(Cl)nc2Cl)CC1 ZINC001232851775 1054131088 /nfs/dbraw/zinc/13/10/88/1054131088.db2.gz MUINBIXZYVHXRK-SECBINFHSA-N 1 2 323.651 4.043 20 0 DIADLO CO[C@@H]1CCC[N@@H+](Cc2c(Cl)cc(Cl)nc2Cl)CC1 ZINC001232851775 1054131091 /nfs/dbraw/zinc/13/10/91/1054131091.db2.gz MUINBIXZYVHXRK-SECBINFHSA-N 1 2 323.651 4.043 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CCc3ccc(Cl)cc3C2)cn1 ZINC001332974954 1054134256 /nfs/dbraw/zinc/13/42/56/1054134256.db2.gz GDTYQDMSSAOEQA-UHFFFAOYSA-N 1 2 308.759 4.231 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CCc3ccc(Cl)cc3C2)cn1 ZINC001332974954 1054134259 /nfs/dbraw/zinc/13/42/59/1054134259.db2.gz GDTYQDMSSAOEQA-UHFFFAOYSA-N 1 2 308.759 4.231 20 0 DIADLO Fc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c(Cl)c1F ZINC001232875191 1054134529 /nfs/dbraw/zinc/13/45/29/1054134529.db2.gz JFBYMPGFYDETJQ-AOOOYVTPSA-N 1 2 307.718 4.095 20 0 DIADLO Fc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c(Cl)c1F ZINC001232875191 1054134538 /nfs/dbraw/zinc/13/45/38/1054134538.db2.gz JFBYMPGFYDETJQ-AOOOYVTPSA-N 1 2 307.718 4.095 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(C(F)(F)F)nc2)c(C)s1 ZINC001333072856 1054138213 /nfs/dbraw/zinc/13/82/13/1054138213.db2.gz ZXSOWNKDMCDNPA-QMMMGPOBSA-N 1 2 315.364 4.025 20 0 DIADLO CC(C)[C@@H]([NH2+][C@@H](C)c1ncccn1)c1ccc(Cl)cc1F ZINC001333300023 1054148738 /nfs/dbraw/zinc/14/87/38/1054148738.db2.gz OXKKCSQHJTUGOZ-XHDPSFHLSA-N 1 2 307.800 4.317 20 0 DIADLO Oc1c(F)ccc(C[N@@H+]2CCC[C@@H](Cc3ccccc3)C2)c1F ZINC001232935810 1054150387 /nfs/dbraw/zinc/15/03/87/1054150387.db2.gz MYFDYLKCIORDEE-HNNXBMFYSA-N 1 2 317.379 4.125 20 0 DIADLO Oc1c(F)ccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)c1F ZINC001232930708 1054150881 /nfs/dbraw/zinc/15/08/81/1054150881.db2.gz FBPNJXMSJQBDJJ-MRXNPFEDSA-N 1 2 303.352 4.398 20 0 DIADLO Oc1c(F)ccc(C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c1F ZINC001232938008 1054152624 /nfs/dbraw/zinc/15/26/24/1054152624.db2.gz XTFUTQWNZNHJBZ-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1c(F)ccc(C[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c1F ZINC001232938008 1054152634 /nfs/dbraw/zinc/15/26/34/1054152634.db2.gz XTFUTQWNZNHJBZ-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(F)c(O)c2F)cc1 ZINC001232936865 1054153698 /nfs/dbraw/zinc/15/36/98/1054153698.db2.gz YAWROUGIFQOWQZ-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(F)c(O)c2F)cc1 ZINC001232936865 1054153704 /nfs/dbraw/zinc/15/37/04/1054153704.db2.gz YAWROUGIFQOWQZ-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO CC[N@H+](Cc1ccc(C)c(C)c1)Cc1ccc(F)c(O)c1F ZINC001232940367 1054153824 /nfs/dbraw/zinc/15/38/24/1054153824.db2.gz OSSXXDQRSHRRCZ-UHFFFAOYSA-N 1 2 305.368 4.309 20 0 DIADLO CC[N@@H+](Cc1ccc(C)c(C)c1)Cc1ccc(F)c(O)c1F ZINC001232940367 1054153832 /nfs/dbraw/zinc/15/38/32/1054153832.db2.gz OSSXXDQRSHRRCZ-UHFFFAOYSA-N 1 2 305.368 4.309 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1)Cc1ccc(F)c(O)c1F ZINC001232936949 1054153937 /nfs/dbraw/zinc/15/39/37/1054153937.db2.gz ISFVARBQEAQAKM-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)cc1)Cc1ccc(F)c(O)c1F ZINC001232936949 1054153943 /nfs/dbraw/zinc/15/39/43/1054153943.db2.gz ISFVARBQEAQAKM-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(SC(F)(F)F)c2)CCC1=O ZINC001232947426 1054156497 /nfs/dbraw/zinc/15/64/97/1054156497.db2.gz CPHXUEGHBVVXQN-UHFFFAOYSA-N 1 2 317.376 4.100 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(SC(F)(F)F)c2)CCC1=O ZINC001232947426 1054156504 /nfs/dbraw/zinc/15/65/04/1054156504.db2.gz CPHXUEGHBVVXQN-UHFFFAOYSA-N 1 2 317.376 4.100 20 0 DIADLO FC(F)(F)Sc1cccc(C[N@@H+]2CCCCC23COC3)c1 ZINC001232948308 1054156557 /nfs/dbraw/zinc/15/65/57/1054156557.db2.gz SJWHPSSWMTYKIC-UHFFFAOYSA-N 1 2 317.376 4.053 20 0 DIADLO FC(F)(F)Sc1cccc(C[N@H+]2CCCCC23COC3)c1 ZINC001232948308 1054156565 /nfs/dbraw/zinc/15/65/65/1054156565.db2.gz SJWHPSSWMTYKIC-UHFFFAOYSA-N 1 2 317.376 4.053 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(O)c(F)c(F)c2)c1 ZINC001232972928 1054161263 /nfs/dbraw/zinc/16/12/63/1054161263.db2.gz HAIAVBMPMPSOHG-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2cc(O)c(F)c(F)c2)c1 ZINC001232972928 1054161269 /nfs/dbraw/zinc/16/12/69/1054161269.db2.gz HAIAVBMPMPSOHG-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(O)c(F)c(F)c2)c1 ZINC001232968271 1054161444 /nfs/dbraw/zinc/16/14/44/1054161444.db2.gz GNPFHUMIYHKXRU-INIZCTEOSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc(O)c(F)c(F)c2)c1 ZINC001232968271 1054161455 /nfs/dbraw/zinc/16/14/55/1054161455.db2.gz GNPFHUMIYHKXRU-INIZCTEOSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccc(N[C@@H](C)c2cn3c([nH+]2)CCCC3)cc1-c1ncco1 ZINC001333597739 1054162133 /nfs/dbraw/zinc/16/21/33/1054162133.db2.gz XTQJHMAKHKOQDA-AWEZNQCLSA-N 1 2 322.412 4.356 20 0 DIADLO CC[N@H+](Cc1cccc(Cl)c1)Cc1cc(O)c(F)c(F)c1 ZINC001232972730 1054162827 /nfs/dbraw/zinc/16/28/27/1054162827.db2.gz ACOJOYRJPSPVHP-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC[N@@H+](Cc1cccc(Cl)c1)Cc1cc(O)c(F)c(F)c1 ZINC001232972730 1054162832 /nfs/dbraw/zinc/16/28/32/1054162832.db2.gz ACOJOYRJPSPVHP-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO Oc1cc(C[NH+]2CCC(c3ccccc3)CC2)cc(F)c1F ZINC001232971363 1054163294 /nfs/dbraw/zinc/16/32/94/1054163294.db2.gz BTLHUQDGQOLZII-UHFFFAOYSA-N 1 2 303.352 4.050 20 0 DIADLO CC[N@H+](CC(=O)NC1(C)CCCCC1)Cc1ccccc1Cl ZINC000622324642 1054163494 /nfs/dbraw/zinc/16/34/94/1054163494.db2.gz YHSWMBAXNCWGFP-UHFFFAOYSA-N 1 2 322.880 4.001 20 0 DIADLO CC[N@@H+](CC(=O)NC1(C)CCCCC1)Cc1ccccc1Cl ZINC000622324642 1054163500 /nfs/dbraw/zinc/16/35/00/1054163500.db2.gz YHSWMBAXNCWGFP-UHFFFAOYSA-N 1 2 322.880 4.001 20 0 DIADLO COc1cc(Cl)cc(F)c1C[N@H+](C)Cc1ccc(F)cc1 ZINC001233002397 1054168352 /nfs/dbraw/zinc/16/83/52/1054168352.db2.gz STMDBYVBPKAQOM-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(Cl)cc(F)c1C[N@@H+](C)Cc1ccc(F)cc1 ZINC001233002397 1054168358 /nfs/dbraw/zinc/16/83/58/1054168358.db2.gz STMDBYVBPKAQOM-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CC(C)OCC[NH+](CCOC(C)C)Cc1ccsc1Cl ZINC001233056028 1054177750 /nfs/dbraw/zinc/17/77/50/1054177750.db2.gz DNPUTZORJGHKKO-UHFFFAOYSA-N 1 2 319.898 4.054 20 0 DIADLO C[N@H+](Cc1ccc(Cl)c(Cl)c1)Cc1cccc(O)c1F ZINC001233050097 1054178131 /nfs/dbraw/zinc/17/81/31/1054178131.db2.gz FUVJOVSMGVMYFA-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)c(Cl)c1)Cc1cccc(O)c1F ZINC001233050097 1054178139 /nfs/dbraw/zinc/17/81/39/1054178139.db2.gz FUVJOVSMGVMYFA-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO CC1CC([N@H+](C)Cc2c(F)cc(Br)c(F)c2F)C1 ZINC001233060377 1054180470 /nfs/dbraw/zinc/18/04/70/1054180470.db2.gz HKWLXUFYLNSLIN-UHFFFAOYSA-N 1 2 322.168 4.097 20 0 DIADLO CC1CC([N@@H+](C)Cc2c(F)cc(Br)c(F)c2F)C1 ZINC001233060377 1054180474 /nfs/dbraw/zinc/18/04/74/1054180474.db2.gz HKWLXUFYLNSLIN-UHFFFAOYSA-N 1 2 322.168 4.097 20 0 DIADLO CCCCC[C@H](C(=O)NC[C@@H]1c2ccccc2C[N@H+]1C)C(C)C ZINC001438571637 1054189877 /nfs/dbraw/zinc/18/98/77/1054189877.db2.gz IQMDUXYMQJEUAQ-PKOBYXMFSA-N 1 2 316.489 4.142 20 0 DIADLO CCCCC[C@H](C(=O)NC[C@@H]1c2ccccc2C[N@@H+]1C)C(C)C ZINC001438571637 1054189884 /nfs/dbraw/zinc/18/98/84/1054189884.db2.gz IQMDUXYMQJEUAQ-PKOBYXMFSA-N 1 2 316.489 4.142 20 0 DIADLO CCCCC[C@@H](C(=O)NC[C@@H]1c2ccccc2C[N@H+]1C)C(C)C ZINC001438571630 1054190824 /nfs/dbraw/zinc/19/08/24/1054190824.db2.gz IQMDUXYMQJEUAQ-IEBWSBKVSA-N 1 2 316.489 4.142 20 0 DIADLO CCC(CC)[N@H+](CC)Cc1nc(C)sc1Br ZINC001233160137 1054190691 /nfs/dbraw/zinc/19/06/91/1054190691.db2.gz TYMVJUIJWXTLCT-UHFFFAOYSA-N 1 2 305.285 4.225 20 0 DIADLO CCC(CC)[N@@H+](CC)Cc1nc(C)sc1Br ZINC001233160137 1054190703 /nfs/dbraw/zinc/19/07/03/1054190703.db2.gz TYMVJUIJWXTLCT-UHFFFAOYSA-N 1 2 305.285 4.225 20 0 DIADLO CCCCC[C@@H](C(=O)NC[C@@H]1c2ccccc2C[N@@H+]1C)C(C)C ZINC001438571630 1054190842 /nfs/dbraw/zinc/19/08/42/1054190842.db2.gz IQMDUXYMQJEUAQ-IEBWSBKVSA-N 1 2 316.489 4.142 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)cnc1C ZINC001233161398 1054193537 /nfs/dbraw/zinc/19/35/37/1054193537.db2.gz ADTJGLUFZSCFIC-QGZVFWFLSA-N 1 2 302.368 4.314 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)cnc1C ZINC001233161398 1054193543 /nfs/dbraw/zinc/19/35/43/1054193543.db2.gz ADTJGLUFZSCFIC-QGZVFWFLSA-N 1 2 302.368 4.314 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)cnc1C ZINC001233161034 1054193802 /nfs/dbraw/zinc/19/38/02/1054193802.db2.gz POVGXYMUFOYJGM-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)cnc1C ZINC001233161034 1054193807 /nfs/dbraw/zinc/19/38/07/1054193807.db2.gz POVGXYMUFOYJGM-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C[N@@H+]2CCSC[C@@H]2c2ccc(F)cc2)cnc1C ZINC001233161836 1054193861 /nfs/dbraw/zinc/19/38/61/1054193861.db2.gz JKEVYJOTURRWFR-GOSISDBHSA-N 1 2 316.445 4.128 20 0 DIADLO Cc1cc(C[N@H+]2CCSC[C@@H]2c2ccc(F)cc2)cnc1C ZINC001233161836 1054193868 /nfs/dbraw/zinc/19/38/68/1054193868.db2.gz JKEVYJOTURRWFR-GOSISDBHSA-N 1 2 316.445 4.128 20 0 DIADLO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](c1nnc[nH]1)C1CCCCC1)CC2 ZINC000638543256 1054196580 /nfs/dbraw/zinc/19/65/80/1054196580.db2.gz HCUICERUFNBSDN-ROUUACIJSA-N 1 2 310.445 4.012 20 0 DIADLO Fc1c(Cl)ccc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c1F ZINC001233210629 1054202460 /nfs/dbraw/zinc/20/24/60/1054202460.db2.gz JPZTWEZLOWJIMX-AWEZNQCLSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1c(Cl)ccc(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c1F ZINC001233210629 1054202473 /nfs/dbraw/zinc/20/24/73/1054202473.db2.gz JPZTWEZLOWJIMX-AWEZNQCLSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1cc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)ccn1 ZINC001334903626 1054203615 /nfs/dbraw/zinc/20/36/15/1054203615.db2.gz VQLKZWYPJZYDNH-UHFFFAOYSA-N 1 2 322.387 4.033 20 0 DIADLO Fc1c(Cl)ccc(C[NH+]2CCC(c3cccnc3)CC2)c1F ZINC001233212548 1054204213 /nfs/dbraw/zinc/20/42/13/1054204213.db2.gz WRUKKXSEPHMYSN-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Cc1ccc2c(c1Br)C[N@@H+](CCCC(F)(F)F)C2 ZINC001335016462 1054205780 /nfs/dbraw/zinc/20/57/80/1054205780.db2.gz GIJMBVSBURCWDI-UHFFFAOYSA-N 1 2 322.168 4.416 20 0 DIADLO Cc1ccc2c(c1Br)C[N@H+](CCCC(F)(F)F)C2 ZINC001335016462 1054205790 /nfs/dbraw/zinc/20/57/90/1054205790.db2.gz GIJMBVSBURCWDI-UHFFFAOYSA-N 1 2 322.168 4.416 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1)c1cc(Br)cc(F)c1O ZINC000184849736 1054209390 /nfs/dbraw/zinc/20/93/90/1054209390.db2.gz XCTIBWFGEVEEME-JTQLQIEISA-N 1 2 324.193 4.145 20 0 DIADLO Cc1ccc(Cl)cc1C[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001233250077 1054215315 /nfs/dbraw/zinc/21/53/15/1054215315.db2.gz UOVWKMFBYKRNPJ-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccc(Cl)cc1C[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001233250077 1054215325 /nfs/dbraw/zinc/21/53/25/1054215325.db2.gz UOVWKMFBYKRNPJ-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO COc1c(O)cccc1C[N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001233258799 1054219055 /nfs/dbraw/zinc/21/90/55/1054219055.db2.gz UUUYNTPZFOCGCN-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO COc1c(O)cccc1C[N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001233258799 1054219062 /nfs/dbraw/zinc/21/90/62/1054219062.db2.gz UUUYNTPZFOCGCN-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1cc(N)nc(S[C@@H](C)CCSc2ccccc2)[nH+]1 ZINC000473686488 1054226607 /nfs/dbraw/zinc/22/66/07/1054226607.db2.gz KIZCQIYLNBSJHH-LBPRGKRZSA-N 1 2 305.472 4.030 20 0 DIADLO C[N@H+](Cc1nccs1)Cc1ccc(Cc2ccccc2)cc1 ZINC001233331041 1054233740 /nfs/dbraw/zinc/23/37/40/1054233740.db2.gz FINMYQGLBBUZKR-UHFFFAOYSA-N 1 2 308.450 4.366 20 0 DIADLO C[N@@H+](Cc1nccs1)Cc1ccc(Cc2ccccc2)cc1 ZINC001233331041 1054233748 /nfs/dbraw/zinc/23/37/48/1054233748.db2.gz FINMYQGLBBUZKR-UHFFFAOYSA-N 1 2 308.450 4.366 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)c2ccc(F)cc2F)c(C)[nH+]1 ZINC001355891216 1054241583 /nfs/dbraw/zinc/24/15/83/1054241583.db2.gz HVVMZEDEKBNVPN-NSHDSACASA-N 1 2 304.340 4.027 20 0 DIADLO CCn1cc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)c(C)n1 ZINC001336748876 1054245629 /nfs/dbraw/zinc/24/56/29/1054245629.db2.gz ZTQRAEHMXQDPMD-UHFFFAOYSA-N 1 2 324.255 4.297 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1cc2c(ccc3ccccc23)o1 ZINC001439223867 1054250139 /nfs/dbraw/zinc/25/01/39/1054250139.db2.gz KIGNHSXNGIZUBU-UHFFFAOYSA-N 1 2 316.360 4.272 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2nc3ccccc3o2)CCC1 ZINC001336907806 1054251809 /nfs/dbraw/zinc/25/18/09/1054251809.db2.gz QSYWGNKQKQRDBN-UHFFFAOYSA-N 1 2 308.381 4.005 20 0 DIADLO Cc1ccc(N[C@H](C)c2nc3ccc(Cl)cc3n2C)c(C)[nH+]1 ZINC001337320019 1054264590 /nfs/dbraw/zinc/26/45/90/1054264590.db2.gz FAQGXPJSBDXFLF-GFCCVEGCSA-N 1 2 314.820 4.412 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1cc(Br)ncc1Cl ZINC001233427749 1054269989 /nfs/dbraw/zinc/26/99/89/1054269989.db2.gz KFCGTSNVKUCSEG-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1cc(Br)ncc1Cl ZINC001233427749 1054269998 /nfs/dbraw/zinc/26/99/98/1054269998.db2.gz KFCGTSNVKUCSEG-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO CC1(C)CC[NH+](Cc2cc(Br)ncc2Cl)CC1 ZINC001233427147 1054271338 /nfs/dbraw/zinc/27/13/38/1054271338.db2.gz LFCOFOQUTBMADN-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(Br)c(Cl)cc2F)C1 ZINC001233439894 1054274588 /nfs/dbraw/zinc/27/45/88/1054274588.db2.gz VUCLBLMJKUPCGH-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(Br)c(Cl)cc2F)C1 ZINC001233439894 1054274591 /nfs/dbraw/zinc/27/45/91/1054274591.db2.gz VUCLBLMJKUPCGH-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO C[N@H+](Cc1cc(Cl)cc(Cl)c1)Cc1cncc(Cl)n1 ZINC001233451336 1054275993 /nfs/dbraw/zinc/27/59/93/1054275993.db2.gz GYQNZUHLCDUHNU-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO C[N@@H+](Cc1cc(Cl)cc(Cl)c1)Cc1cncc(Cl)n1 ZINC001233451336 1054276006 /nfs/dbraw/zinc/27/60/06/1054276006.db2.gz GYQNZUHLCDUHNU-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)sc1C ZINC001233691910 1054335044 /nfs/dbraw/zinc/33/50/44/1054335044.db2.gz IEPYRFFPXHZDRY-KRWDZBQOSA-N 1 2 323.408 4.217 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)sc1C ZINC001233691910 1054335057 /nfs/dbraw/zinc/33/50/57/1054335057.db2.gz IEPYRFFPXHZDRY-KRWDZBQOSA-N 1 2 323.408 4.217 20 0 DIADLO CC[N@@H+]1CC[C@@H]1C(=O)Nc1ccc(-c2cc3ccccc3o2)cc1 ZINC001440870614 1054371043 /nfs/dbraw/zinc/37/10/43/1054371043.db2.gz QRQSTXSJNKKOIM-QGZVFWFLSA-N 1 2 320.392 4.133 20 0 DIADLO CC[N@H+]1CC[C@@H]1C(=O)Nc1ccc(-c2cc3ccccc3o2)cc1 ZINC001440870614 1054371052 /nfs/dbraw/zinc/37/10/52/1054371052.db2.gz QRQSTXSJNKKOIM-QGZVFWFLSA-N 1 2 320.392 4.133 20 0 DIADLO CC[N@H+](Cc1nccn1C)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000171580663 1054375469 /nfs/dbraw/zinc/37/54/69/1054375469.db2.gz ZTZDRVSTYQQDLM-FQEVSTJZSA-N 1 2 323.415 4.171 20 0 DIADLO CC[N@@H+](Cc1nccn1C)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000171580663 1054375475 /nfs/dbraw/zinc/37/54/75/1054375475.db2.gz ZTZDRVSTYQQDLM-FQEVSTJZSA-N 1 2 323.415 4.171 20 0 DIADLO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]Cc1coc(C(C)(C)C)n1 ZINC001341106407 1054377882 /nfs/dbraw/zinc/37/78/82/1054377882.db2.gz TUHISNFJHSLOEX-LBPRGKRZSA-N 1 2 318.465 4.083 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CCC(c2c[nH+]cn2C)CC1 ZINC001341096777 1054378053 /nfs/dbraw/zinc/37/80/53/1054378053.db2.gz ZKTZRYGOZAMACC-INIZCTEOSA-N 1 2 319.493 4.123 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc([S@@](C)=O)cc2)[nH+]c2ccccc12 ZINC001341155283 1054378897 /nfs/dbraw/zinc/37/88/97/1054378897.db2.gz NFSVEDGBUGDJQW-LFVRLGFBSA-N 1 2 324.449 4.454 20 0 DIADLO Cc1cccc(C2([NH2+]Cc3nc(C(C)(C)C)no3)CCCC2)c1 ZINC000171694208 1054381498 /nfs/dbraw/zinc/38/14/98/1054381498.db2.gz RDERPIQXVPKZFN-UHFFFAOYSA-N 1 2 313.445 4.235 20 0 DIADLO c1cc(OCC2CC2)ccc1CNc1ccc(N2CCCC2)c[nH+]1 ZINC000478567778 1054387568 /nfs/dbraw/zinc/38/75/68/1054387568.db2.gz JDLYDEPMIKRVNM-UHFFFAOYSA-N 1 2 323.440 4.083 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2F)c(C)[nH+]1 ZINC000171916891 1054396083 /nfs/dbraw/zinc/39/60/83/1054396083.db2.gz IREMTBBFMMOGPS-CABCVRRESA-N 1 2 316.351 4.027 20 0 DIADLO CC(C)[C@@H](C)C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000171923319 1054396402 /nfs/dbraw/zinc/39/64/02/1054396402.db2.gz JHCJAOJTCGWVLI-CQSZACIVSA-N 1 2 311.429 4.117 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1ncoc1C(C)C ZINC001341615871 1054400474 /nfs/dbraw/zinc/40/04/74/1054400474.db2.gz CMBNUBBOMVJHSK-UHFFFAOYSA-N 1 2 312.417 4.408 20 0 DIADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccc(Oc2cc(C)cc(C)c2)cc1 ZINC001441949663 1054403568 /nfs/dbraw/zinc/40/35/68/1054403568.db2.gz KJSHRLALGUBREA-IBGZPJMESA-N 1 2 324.424 4.128 20 0 DIADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccc(Oc2cc(C)cc(C)c2)cc1 ZINC001441949663 1054403582 /nfs/dbraw/zinc/40/35/82/1054403582.db2.gz KJSHRLALGUBREA-IBGZPJMESA-N 1 2 324.424 4.128 20 0 DIADLO Cc1cc(N)nc(SCc2ccc(OC(C)C)c(Cl)c2)[nH+]1 ZINC000487727512 1054412636 /nfs/dbraw/zinc/41/26/36/1054412636.db2.gz ZNTOKIRLVJEWPB-UHFFFAOYSA-N 1 2 323.849 4.100 20 0 DIADLO Cc1cc(N2CC3(CCC3)[C@H]2c2ccncc2)nc(C2CCC2)[nH+]1 ZINC001343189524 1054439904 /nfs/dbraw/zinc/43/99/04/1054439904.db2.gz SCLULTXPJHVEHZ-GOSISDBHSA-N 1 2 320.440 4.179 20 0 DIADLO Cc1cc(NC(=O)C[C@H](C)c2ccccc2)ccc1-n1cc[nH+]c1 ZINC001443310635 1054445004 /nfs/dbraw/zinc/44/50/04/1054445004.db2.gz IEUCBAHMYNGPJU-HNNXBMFYSA-N 1 2 319.408 4.313 20 0 DIADLO Cc1cccc2oc(C(=O)Nc3cccc(-n4cc[nH+]c4)c3)cc21 ZINC001357300354 1054454782 /nfs/dbraw/zinc/45/47/82/1054454782.db2.gz YDVMOORJVABGRC-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)C1CC2(C1)CCCCC2 ZINC001357300049 1054455010 /nfs/dbraw/zinc/45/50/10/1054455010.db2.gz UOEGFOOKCGTHFH-UHFFFAOYSA-N 1 2 309.413 4.171 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](C)C(C)(C)c2ccccc2)cs1 ZINC000671245881 1054458102 /nfs/dbraw/zinc/45/81/02/1054458102.db2.gz KJLRLNLZJKKCAB-ZDUSSCGKSA-N 1 2 304.459 4.218 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](C)C(C)(C)c2ccccc2)cs1 ZINC000671245881 1054458115 /nfs/dbraw/zinc/45/81/15/1054458115.db2.gz KJLRLNLZJKKCAB-ZDUSSCGKSA-N 1 2 304.459 4.218 20 0 DIADLO FC(F)C[NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 ZINC000671249005 1054462377 /nfs/dbraw/zinc/46/23/77/1054462377.db2.gz ODKJGSQSAZSDHU-AWEZNQCLSA-N 1 2 323.305 4.028 20 0 DIADLO CCCC[C@H](C(=O)OC)[NH+]1CCC(=Cc2ccccc2F)CC1 ZINC001473276717 1054476600 /nfs/dbraw/zinc/47/66/00/1054476600.db2.gz LAHIEEHPIKBFEH-GOSISDBHSA-N 1 2 319.420 4.037 20 0 DIADLO CCO[C@H](C)c1noc(C[NH2+][C@H](CC)c2cccc(Cl)c2)n1 ZINC000173449580 1054484373 /nfs/dbraw/zinc/48/43/73/1054484373.db2.gz OZWKLBYTSVKHBU-BXUZGUMPSA-N 1 2 323.824 4.061 20 0 DIADLO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1ncoc1C(C)C ZINC001345671738 1054508836 /nfs/dbraw/zinc/50/88/36/1054508836.db2.gz LTFHGTJPDYGMLM-UHFFFAOYSA-N 1 2 322.836 4.485 20 0 DIADLO CC[N@H+](Cc1ccn(-c2ccccc2)n1)[C@@H](C)c1cccc(O)c1 ZINC000174621241 1054512224 /nfs/dbraw/zinc/51/22/24/1054512224.db2.gz ZZIQQLXLPSIHRT-INIZCTEOSA-N 1 2 321.424 4.161 20 0 DIADLO CC[N@@H+](Cc1ccn(-c2ccccc2)n1)[C@@H](C)c1cccc(O)c1 ZINC000174621241 1054512238 /nfs/dbraw/zinc/51/22/38/1054512238.db2.gz ZZIQQLXLPSIHRT-INIZCTEOSA-N 1 2 321.424 4.161 20 0 DIADLO Cc1cn2cc(NC(=O)C(CC(C)C)CC(C)C)ccc2[nH+]1 ZINC001357621268 1054512742 /nfs/dbraw/zinc/51/27/42/1054512742.db2.gz RHNMNHIUZUTDDX-UHFFFAOYSA-N 1 2 301.434 4.290 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CCc3ccc(C)cc3C)cc2[nH+]1 ZINC001445737662 1054514711 /nfs/dbraw/zinc/51/47/11/1054514711.db2.gz DVEGCFKEHWFFMA-UHFFFAOYSA-N 1 2 307.397 4.059 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@@H]2CCc3c2cc(F)cc3F)cc1 ZINC001234587975 1054550624 /nfs/dbraw/zinc/55/06/24/1054550624.db2.gz GUDNIAQEQCJAAU-QGZVFWFLSA-N 1 2 317.335 4.393 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@@H](C)c2ccc(F)c(F)c2)cc1 ZINC001234587456 1054552003 /nfs/dbraw/zinc/55/20/03/1054552003.db2.gz ACTRLDNJBXZIJD-NSHDSACASA-N 1 2 305.324 4.467 20 0 DIADLO CC(C)=C(C)CC(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001347574951 1054573033 /nfs/dbraw/zinc/57/30/33/1054573033.db2.gz GWLCFAIGADFKTQ-MRXNPFEDSA-N 1 2 317.477 4.091 20 0 DIADLO CC1(C)C(C)(C)C1(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001358066946 1054593170 /nfs/dbraw/zinc/59/31/70/1054593170.db2.gz KJTHEYLZFMMISF-UHFFFAOYSA-N 1 2 315.392 4.022 20 0 DIADLO CC(C)(C)CC(C)(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001358067768 1054593238 /nfs/dbraw/zinc/59/32/38/1054593238.db2.gz YSLVQKLUFJJGIE-UHFFFAOYSA-N 1 2 317.408 4.412 20 0 DIADLO C[C@@H](C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1)C(C)(C)C ZINC001348116595 1054612846 /nfs/dbraw/zinc/61/28/46/1054612846.db2.gz VRBFMHZVLZOVTA-GJZGRUSLSA-N 1 2 319.493 4.026 20 0 DIADLO Cc1oc2ccccc2c1C[NH2+]Cc1cccc(Cl)c1O ZINC000185668369 1054615523 /nfs/dbraw/zinc/61/55/23/1054615523.db2.gz BFESNKNTLUSPNS-UHFFFAOYSA-N 1 2 301.773 4.390 20 0 DIADLO FC(F)(F)CC1CC[NH+](Cc2nc(-c3ccccc3)c[nH]2)CC1 ZINC001348382926 1054633053 /nfs/dbraw/zinc/63/30/53/1054633053.db2.gz DKVJVUFAQQEBNF-UHFFFAOYSA-N 1 2 323.362 4.241 20 0 DIADLO CCCCN(C(=O)[C@H](CC(C)C)n1cc[nH+]c1)C1CCCCC1 ZINC001450308521 1054643824 /nfs/dbraw/zinc/64/38/24/1054643824.db2.gz MELQHVCXCQKRPZ-SFHVURJKSA-N 1 2 319.493 4.432 20 0 DIADLO CC/C(C)=C(/C)C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001348644590 1054669702 /nfs/dbraw/zinc/66/97/02/1054669702.db2.gz OFIXJGXKBXQRFT-FCFCDCELSA-N 1 2 317.477 4.091 20 0 DIADLO CCC[C@@H]1CCCC[C@@H]1CNC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001451457014 1054678643 /nfs/dbraw/zinc/67/86/43/1054678643.db2.gz JOJCJGZFEHMUJG-KURKYZTESA-N 1 2 319.493 4.193 20 0 DIADLO CCC[C@@H]1CCCC[C@@H]1CNC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001451457019 1054679281 /nfs/dbraw/zinc/67/92/81/1054679281.db2.gz JOJCJGZFEHMUJG-KZNAEPCWSA-N 1 2 319.493 4.193 20 0 DIADLO Cc1cnc(F)c(C[N@H+](C)Cc2cc(Cl)cc(Cl)c2)c1 ZINC001235336724 1054705072 /nfs/dbraw/zinc/70/50/72/1054705072.db2.gz BLPZPURSMVJJJN-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cnc(F)c(C[N@@H+](C)Cc2cc(Cl)cc(Cl)c2)c1 ZINC001235336724 1054705089 /nfs/dbraw/zinc/70/50/89/1054705089.db2.gz BLPZPURSMVJJJN-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)n1 ZINC000180030610 1054724648 /nfs/dbraw/zinc/72/46/48/1054724648.db2.gz QTUCKWWJNGLBNG-HZUKXOBISA-N 1 2 319.836 4.333 20 0 DIADLO COc1cncc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c1C ZINC001235465666 1054728888 /nfs/dbraw/zinc/72/88/88/1054728888.db2.gz TVCBIBRYJVKARK-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cncc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)c1C ZINC001235465666 1054728909 /nfs/dbraw/zinc/72/89/09/1054728909.db2.gz TVCBIBRYJVKARK-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO Cc1cccc(C)c1[C@@H]1CCCN1C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001453218332 1054730223 /nfs/dbraw/zinc/73/02/23/1054730223.db2.gz AQMTZEVBEKUHRU-SFHVURJKSA-N 1 2 319.408 4.157 20 0 DIADLO C[N@@H+](Cc1cccc2cccnc21)Cc1cncc(F)c1Cl ZINC001235493490 1054730987 /nfs/dbraw/zinc/73/09/87/1054730987.db2.gz CVCJHENPHOZBDJ-UHFFFAOYSA-N 1 2 315.779 4.054 20 0 DIADLO C[N@H+](Cc1cccc2cccnc21)Cc1cncc(F)c1Cl ZINC001235493490 1054731001 /nfs/dbraw/zinc/73/10/01/1054731001.db2.gz CVCJHENPHOZBDJ-UHFFFAOYSA-N 1 2 315.779 4.054 20 0 DIADLO CCc1ccc([C@H](NC(=O)c2cccc3[nH+]ccn32)C(C)C)cc1 ZINC001349339874 1054739881 /nfs/dbraw/zinc/73/98/81/1054739881.db2.gz FQGIBFNEFRMUDA-LJQANCHMSA-N 1 2 321.424 4.024 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)[C@H]1CO ZINC001235594209 1054749334 /nfs/dbraw/zinc/74/93/34/1054749334.db2.gz XRDUTXABBPRWSA-RNCFNFMXSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)[C@H]1CO ZINC001235594209 1054749350 /nfs/dbraw/zinc/74/93/50/1054749350.db2.gz XRDUTXABBPRWSA-RNCFNFMXSA-N 1 2 322.663 4.240 20 0 DIADLO CCO[C@@H]1CC[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC001235599934 1054749606 /nfs/dbraw/zinc/74/96/06/1054749606.db2.gz YPBSHEJPHNFESF-SNVBAGLBSA-N 1 2 308.636 4.258 20 0 DIADLO CCO[C@@H]1CC[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC001235599934 1054749616 /nfs/dbraw/zinc/74/96/16/1054749616.db2.gz YPBSHEJPHNFESF-SNVBAGLBSA-N 1 2 308.636 4.258 20 0 DIADLO COC[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1ccc(F)c(F)c1 ZINC000180363927 1054752889 /nfs/dbraw/zinc/75/28/89/1054752889.db2.gz YSCLRGQYQQXJFS-WHCBVINPSA-N 1 2 321.367 4.159 20 0 DIADLO Clc1c(Br)cccc1C[N@@H+]1CCC[C@@H]2C[C@@H]21 ZINC001235609144 1054753857 /nfs/dbraw/zinc/75/38/57/1054753857.db2.gz YUIJSYQERILJSR-SKDRFNHKSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1c(Br)cccc1C[N@H+]1CCC[C@@H]2C[C@@H]21 ZINC001235609144 1054753874 /nfs/dbraw/zinc/75/38/74/1054753874.db2.gz YUIJSYQERILJSR-SKDRFNHKSA-N 1 2 300.627 4.087 20 0 DIADLO CCCCCC[C@@H](CC)CN(C)C(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC001454018531 1054756553 /nfs/dbraw/zinc/75/65/53/1054756553.db2.gz MKVLYVZXYWOSIY-QGZVFWFLSA-N 1 2 321.509 4.382 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCCC[C@@H]1c1cc(C)[nH]n1 ZINC001473828115 1054759737 /nfs/dbraw/zinc/75/97/37/1054759737.db2.gz JQKOFVREWHNPGG-MRXNPFEDSA-N 1 2 301.459 4.167 20 0 DIADLO CSc1ccccc1C[N@H+]1CCCC[C@@H]1c1cc(C)[nH]n1 ZINC001473828115 1054759745 /nfs/dbraw/zinc/75/97/45/1054759745.db2.gz JQKOFVREWHNPGG-MRXNPFEDSA-N 1 2 301.459 4.167 20 0 DIADLO Cc1ccc(NC(=O)C[C@H](C)n2cc[nH+]c2)c(Cl)c1Cl ZINC001349499330 1054759967 /nfs/dbraw/zinc/75/99/67/1054759967.db2.gz LJWUTNOERUOALQ-JTQLQIEISA-N 1 2 312.200 4.088 20 0 DIADLO Nc1ccc(Cl)nc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001235672919 1054768229 /nfs/dbraw/zinc/76/82/29/1054768229.db2.gz AYXPUAAJCPCCFQ-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccc(Cl)nc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001235672919 1054768244 /nfs/dbraw/zinc/76/82/44/1054768244.db2.gz AYXPUAAJCPCCFQ-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccc(F)c(C[N@@H+]2CCCC[C@H]2c2ccccc2F)c1F ZINC001235677820 1054769983 /nfs/dbraw/zinc/76/99/83/1054769983.db2.gz IYIGMCLYCUNWKD-KRWDZBQOSA-N 1 2 320.358 4.413 20 0 DIADLO Nc1ccc(F)c(C[N@H+]2CCCC[C@H]2c2ccccc2F)c1F ZINC001235677820 1054769995 /nfs/dbraw/zinc/76/99/95/1054769995.db2.gz IYIGMCLYCUNWKD-KRWDZBQOSA-N 1 2 320.358 4.413 20 0 DIADLO Nc1nccc(Cl)c1C[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC001235693858 1054783850 /nfs/dbraw/zinc/78/38/50/1054783850.db2.gz HYQCWQGXCQSIRB-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nccc(Cl)c1C[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC001235693858 1054783860 /nfs/dbraw/zinc/78/38/60/1054783860.db2.gz HYQCWQGXCQSIRB-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO CCOc1cccc(F)c1C[NH2+]Cc1ccc(Cl)cc1F ZINC001474120784 1054785411 /nfs/dbraw/zinc/78/54/11/1054785411.db2.gz WANANFRCFCGAIX-UHFFFAOYSA-N 1 2 311.759 4.307 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC001235747605 1054793823 /nfs/dbraw/zinc/79/38/23/1054793823.db2.gz SXVUNHUZUSJWNE-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC001235747605 1054793836 /nfs/dbraw/zinc/79/38/36/1054793836.db2.gz SXVUNHUZUSJWNE-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO Nc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c1F ZINC001235719783 1054790030 /nfs/dbraw/zinc/79/00/30/1054790030.db2.gz YZWYMVCRUQUWGY-MRXNPFEDSA-N 1 2 306.331 4.023 20 0 DIADLO Nc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2ccccc2F)c1F ZINC001235719783 1054790042 /nfs/dbraw/zinc/79/00/42/1054790042.db2.gz YZWYMVCRUQUWGY-MRXNPFEDSA-N 1 2 306.331 4.023 20 0 DIADLO Cc1cccc(Oc2cccc(NC(=O)CCc3[nH]cc[nH+]3)c2)c1 ZINC001455027646 1054790660 /nfs/dbraw/zinc/79/06/60/1054790660.db2.gz UYAAIHXYYQJNRP-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2c(F)cc(Cl)cc2Cl)[C@H](C)C1 ZINC001235740711 1054796482 /nfs/dbraw/zinc/79/64/82/1054796482.db2.gz BQISLLMTCPZJOX-MWLCHTKSSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2c(F)cc(Cl)cc2Cl)[C@H](C)C1 ZINC001235740711 1054796469 /nfs/dbraw/zinc/79/64/69/1054796469.db2.gz BQISLLMTCPZJOX-MWLCHTKSSA-N 1 2 306.208 4.132 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1 ZINC001349791269 1054796635 /nfs/dbraw/zinc/79/66/35/1054796635.db2.gz GGQFWFZVMSALCU-GFCCVEGCSA-N 1 2 322.330 4.038 20 0 DIADLO CO[C@H]1C[C@@H](CNc2[nH+]ccc3cc(C(F)(F)F)ccc32)C1 ZINC000624757021 1054798650 /nfs/dbraw/zinc/79/86/50/1054798650.db2.gz SDSPCZOKTKWWPY-MJHDQNEOSA-N 1 2 310.319 4.091 20 0 DIADLO CC1(C)C[NH+](Cc2cc(F)c(OCc3ccccc3)c(F)c2)C1 ZINC001235759188 1054800608 /nfs/dbraw/zinc/80/06/08/1054800608.db2.gz FNOZXGZQRIIYCG-UHFFFAOYSA-N 1 2 317.379 4.386 20 0 DIADLO COc1cccc2c1OCC[C@@H]2Nc1cc(C)c2ccccc2[nH+]1 ZINC001349823603 1054802528 /nfs/dbraw/zinc/80/25/28/1054802528.db2.gz NPBBXJVVANAYMB-KRWDZBQOSA-N 1 2 320.392 4.488 20 0 DIADLO C[C@@H]([NH2+]Cc1cscn1)c1ccc(F)cc1C(F)(F)F ZINC000623881410 1054802675 /nfs/dbraw/zinc/80/26/75/1054802675.db2.gz NFNTXOLIAWYYLO-MRVPVSSYSA-N 1 2 304.312 4.152 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@@H](C)c2ccccc2OC(C)C)[nH+]1 ZINC000531433515 1054806761 /nfs/dbraw/zinc/80/67/61/1054806761.db2.gz VVLSDMAXUOVMLD-LBPRGKRZSA-N 1 2 310.401 4.227 20 0 DIADLO Cc1cc2ccccc2nc1NCc1cccc(-n2cc[nH+]c2)c1 ZINC000532015076 1054810875 /nfs/dbraw/zinc/81/08/75/1054810875.db2.gz ZXAHLBRPRFFZPF-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3c(C)cc(Cl)cc3C)ccn12 ZINC001349901802 1054817764 /nfs/dbraw/zinc/81/77/64/1054817764.db2.gz YLVGVRFJGXFCER-UHFFFAOYSA-N 1 2 314.772 4.132 20 0 DIADLO COc1nccc(C[N@H+](C)Cc2cccc(Cl)c2)c1Cl ZINC001235832588 1054818376 /nfs/dbraw/zinc/81/83/76/1054818376.db2.gz KYAZGQJSUDZYFY-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1nccc(C[N@@H+](C)Cc2cccc(Cl)c2)c1Cl ZINC001235832588 1054818386 /nfs/dbraw/zinc/81/83/86/1054818386.db2.gz KYAZGQJSUDZYFY-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cn1c2ccccc2[nH+]c1N[C@H]1CCSc2c(F)cccc21 ZINC000535691839 1054821289 /nfs/dbraw/zinc/82/12/89/1054821289.db2.gz OEYDQRNQMPJJAB-ZDUSSCGKSA-N 1 2 313.401 4.361 20 0 DIADLO Cc1csc([C@@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)n1 ZINC000623932610 1054822994 /nfs/dbraw/zinc/82/29/94/1054822994.db2.gz VUFQYFINLNNQNU-CYBMUJFWSA-N 1 2 302.447 4.010 20 0 DIADLO C[C@H]([NH2+][C@@H]1CC[C@H](c2cccc(Cl)c2)C1)C(=O)OC(C)(C)C ZINC001474575507 1054825487 /nfs/dbraw/zinc/82/54/87/1054825487.db2.gz KOCBMTJSUUCBLI-DUVNUKRYSA-N 1 2 323.864 4.296 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CC[C@H]3[C@@H](C2)C3(F)F)cc1Cl ZINC001474572075 1054825680 /nfs/dbraw/zinc/82/56/80/1054825680.db2.gz RRHUKLYWYFKGIU-VHSXEESVSA-N 1 2 322.182 4.089 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CC[C@H]3[C@@H](C2)C3(F)F)cc1Cl ZINC001474572075 1054825698 /nfs/dbraw/zinc/82/56/98/1054825698.db2.gz RRHUKLYWYFKGIU-VHSXEESVSA-N 1 2 322.182 4.089 20 0 DIADLO CCC[NH+](CCC)Cc1c(Br)ccnc1Cl ZINC001235872376 1054828205 /nfs/dbraw/zinc/82/82/05/1054828205.db2.gz UHDNQCPCFALAMA-UHFFFAOYSA-N 1 2 305.647 4.120 20 0 DIADLO CCCCC[N@H+](C)Cc1c(Br)ccnc1Cl ZINC001235869664 1054828505 /nfs/dbraw/zinc/82/85/05/1054828505.db2.gz CSJRQUWKHRKEOA-UHFFFAOYSA-N 1 2 305.647 4.120 20 0 DIADLO CCCCC[N@@H+](C)Cc1c(Br)ccnc1Cl ZINC001235869664 1054828510 /nfs/dbraw/zinc/82/85/10/1054828510.db2.gz CSJRQUWKHRKEOA-UHFFFAOYSA-N 1 2 305.647 4.120 20 0 DIADLO CCCC[N@H+](CC)Cc1c(Br)ccnc1Cl ZINC001235869610 1054829026 /nfs/dbraw/zinc/82/90/26/1054829026.db2.gz CDRDSTFNRKVNOR-UHFFFAOYSA-N 1 2 305.647 4.120 20 0 DIADLO CCCC[N@@H+](CC)Cc1c(Br)ccnc1Cl ZINC001235869610 1054829040 /nfs/dbraw/zinc/82/90/40/1054829040.db2.gz CDRDSTFNRKVNOR-UHFFFAOYSA-N 1 2 305.647 4.120 20 0 DIADLO COC[C@H]([NH2+][C@@H]1CCCc2scnc21)c1cccc(Cl)c1 ZINC000623985395 1054840241 /nfs/dbraw/zinc/84/02/41/1054840241.db2.gz OXYOSKCWCAQELT-KGLIPLIRSA-N 1 2 322.861 4.151 20 0 DIADLO Fc1cc2c(c(F)c1F)[C@@H]([NH2+][C@H]1CCCc3scnc31)CC2 ZINC000623996132 1054850630 /nfs/dbraw/zinc/85/06/30/1054850630.db2.gz UTPKWRBYFVXISK-QWRGUYRKSA-N 1 2 324.371 4.215 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CCc3cc(F)c(Cl)cc32)c1 ZINC000624008482 1054859943 /nfs/dbraw/zinc/85/99/43/1054859943.db2.gz ZAQOZVCOHNFWJO-OAHLLOKOSA-N 1 2 306.768 4.120 20 0 DIADLO CC(C)Oc1ccc(Cl)cc1-c1c[nH+]c2c(c1)CCCN2 ZINC001235945266 1054864350 /nfs/dbraw/zinc/86/43/50/1054864350.db2.gz UCQIDYXBGGGJBC-UHFFFAOYSA-N 1 2 302.805 4.190 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CC=CCC1)c1cc(Br)cc(F)c1O ZINC000186057041 1054873474 /nfs/dbraw/zinc/87/34/74/1054873474.db2.gz GBNTZZCLQCLYCC-MWLCHTKSSA-N 1 2 314.198 4.053 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1)Cc1c(F)ccc(N)c1F ZINC001235963702 1054875406 /nfs/dbraw/zinc/87/54/06/1054875406.db2.gz YXXQVHHDBVTAPI-UHFFFAOYSA-N 1 2 310.775 4.223 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)cc1)Cc1c(F)ccc(N)c1F ZINC001235963702 1054875412 /nfs/dbraw/zinc/87/54/12/1054875412.db2.gz YXXQVHHDBVTAPI-UHFFFAOYSA-N 1 2 310.775 4.223 20 0 DIADLO Cc1nccnc1[C@@H](C)[NH2+]Cc1c(Cl)oc2ccccc21 ZINC000624109145 1054880280 /nfs/dbraw/zinc/88/02/80/1054880280.db2.gz OAWAGWPSVRMUAH-LLVKDONJSA-N 1 2 301.777 4.035 20 0 DIADLO Cc1cncc([C@H](C)[NH2+][C@H](CCc2ccccc2)C(F)F)c1 ZINC000624125090 1054883203 /nfs/dbraw/zinc/88/32/03/1054883203.db2.gz SHUYJDZEHCADMM-WMLDXEAASA-N 1 2 304.384 4.307 20 0 DIADLO C[C@H]([NH2+][C@H](CCc1ccccc1)C(F)F)c1cccc(CO)c1 ZINC000624125064 1054886104 /nfs/dbraw/zinc/88/61/04/1054886104.db2.gz SBSNJXAVHFFRGO-KBXCAEBGSA-N 1 2 319.395 4.096 20 0 DIADLO Fc1ccc(F)c([C@H]([NH2+][C@@H]2CCOC2)c2ccccc2Cl)c1 ZINC000181165489 1054904876 /nfs/dbraw/zinc/90/48/76/1054904876.db2.gz QXRMLXDGAQPIDE-SJKOYZFVSA-N 1 2 323.770 4.086 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]C2c3ccccc3-c3ccccc32)s1 ZINC000353565263 1054905524 /nfs/dbraw/zinc/90/55/24/1054905524.db2.gz AOSXPSRVCROXRO-LLVKDONJSA-N 1 2 307.422 4.267 20 0 DIADLO Cc1cc(C)c(CNC(=O)N(C)C[C@H](C)C2CCCCC2)c[nH+]1 ZINC000624178319 1054912817 /nfs/dbraw/zinc/91/28/17/1054912817.db2.gz BCLYYDWMJJTZDD-HNNXBMFYSA-N 1 2 317.477 4.056 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3nc4cc(Cl)ccc4o3)n2c1 ZINC000181506454 1054918285 /nfs/dbraw/zinc/91/82/85/1054918285.db2.gz ALNLVIGDLJAUEU-UHFFFAOYSA-N 1 2 312.760 4.049 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(Cc2ccccc2)no1)c1ccc(C)cc1 ZINC000181699110 1054929364 /nfs/dbraw/zinc/92/93/64/1054929364.db2.gz LJDGFHOHNMWNFG-GOSISDBHSA-N 1 2 321.424 4.210 20 0 DIADLO COC[C@H]([NH2+]Cc1csc(CCC(C)C)n1)c1ccccc1 ZINC000181693452 1054930254 /nfs/dbraw/zinc/93/02/54/1054930254.db2.gz KCJLCUUXTDDEOJ-KRWDZBQOSA-N 1 2 318.486 4.209 20 0 DIADLO Cc1cc(OC(C)C)cc(C)c1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001236083307 1054933172 /nfs/dbraw/zinc/93/31/72/1054933172.db2.gz YZWLQJMZEWKHBZ-UHFFFAOYSA-N 1 2 321.424 4.397 20 0 DIADLO CC(C)[N@H+](Cc1ccc(Cl)cc1Cl)Cc1ncccc1N ZINC001236092602 1054941360 /nfs/dbraw/zinc/94/13/60/1054941360.db2.gz NJVHUVAZWPTBKJ-UHFFFAOYSA-N 1 2 324.255 4.381 20 0 DIADLO CC(C)[N@@H+](Cc1ccc(Cl)cc1Cl)Cc1ncccc1N ZINC001236092602 1054941368 /nfs/dbraw/zinc/94/13/68/1054941368.db2.gz NJVHUVAZWPTBKJ-UHFFFAOYSA-N 1 2 324.255 4.381 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3ccc4cc(C)ccc4c3)ccn12 ZINC001535452889 1054944053 /nfs/dbraw/zinc/94/40/53/1054944053.db2.gz DWMGCTQFEBEXIE-UHFFFAOYSA-N 1 2 316.360 4.324 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](CC2CCCC2)c2ccccc2)n1 ZINC000181939560 1054949241 /nfs/dbraw/zinc/94/92/41/1054949241.db2.gz VZMUIFQXMZRAMS-KRWDZBQOSA-N 1 2 313.445 4.433 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](C)c2ccc(OC)c(F)c2)cs1 ZINC000182006736 1054952993 /nfs/dbraw/zinc/95/29/93/1054952993.db2.gz JQLKDQAYEFQUAG-LBPRGKRZSA-N 1 2 322.449 4.484 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cccnc1N1CCCC1 ZINC001236123202 1054960643 /nfs/dbraw/zinc/96/06/43/1054960643.db2.gz OLQXEOQXEGGKTI-UHFFFAOYSA-N 1 2 322.456 4.043 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+]Cc2nc(C(C)C)no2)cc1 ZINC000182117916 1054962807 /nfs/dbraw/zinc/96/28/07/1054962807.db2.gz KHFOCKORBGEDKL-LBPRGKRZSA-N 1 2 305.447 4.156 20 0 DIADLO C[N@H+](Cc1ccc2ccccc2c1)Cc1c(F)ccc(N)c1F ZINC001236183013 1054982548 /nfs/dbraw/zinc/98/25/48/1054982548.db2.gz BTNBRQNPMSGINJ-UHFFFAOYSA-N 1 2 312.363 4.332 20 0 DIADLO C[N@@H+](Cc1ccc2ccccc2c1)Cc1c(F)ccc(N)c1F ZINC001236183013 1054982561 /nfs/dbraw/zinc/98/25/61/1054982561.db2.gz BTNBRQNPMSGINJ-UHFFFAOYSA-N 1 2 312.363 4.332 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1c(C)noc1C ZINC000182395279 1054985731 /nfs/dbraw/zinc/98/57/31/1054985731.db2.gz CTPKESGMGVCHBD-GFCCVEGCSA-N 1 2 307.463 4.286 20 0 DIADLO c1[nH]c2ccccc2c1[C@@H]1CCCN1Cc1[nH+]cc2ccccn21 ZINC001236189666 1054987299 /nfs/dbraw/zinc/98/72/99/1054987299.db2.gz BTCQPCAOGXXOBF-IBGZPJMESA-N 1 2 316.408 4.153 20 0 DIADLO CC[C@@H]([NH2+]Cc1csc(-c2ccoc2)n1)c1c(C)noc1C ZINC000182495639 1054991150 /nfs/dbraw/zinc/99/11/50/1054991150.db2.gz ITOBZLBLAQFVLW-CQSZACIVSA-N 1 2 317.414 4.249 20 0 DIADLO Clc1cnc(C[N@@H+]2CC[C@@H](Nc3ccccc3)C2)c(Cl)c1 ZINC000182642791 1055000872 /nfs/dbraw/zinc/00/08/72/1055000872.db2.gz MTDRWWGYZSXKQC-CQSZACIVSA-N 1 2 322.239 4.075 20 0 DIADLO Clc1cnc(C[N@H+]2CC[C@@H](Nc3ccccc3)C2)c(Cl)c1 ZINC000182642791 1055000884 /nfs/dbraw/zinc/00/08/84/1055000884.db2.gz MTDRWWGYZSXKQC-CQSZACIVSA-N 1 2 322.239 4.075 20 0 DIADLO O=C(/C=C/C1CCCC1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001535691730 1055001255 /nfs/dbraw/zinc/00/12/55/1055001255.db2.gz GOVBJWAEIFUFKC-VMPITWQZSA-N 1 2 315.804 4.211 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nc(C3CCCC3)no2)c(C)s1 ZINC000182745402 1055006279 /nfs/dbraw/zinc/00/62/79/1055006279.db2.gz UMHNVWOIYAHMCQ-NSHDSACASA-N 1 2 305.447 4.256 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nc(CCC(C)C)no2)c(C)s1 ZINC000182986485 1055022330 /nfs/dbraw/zinc/02/23/30/1055022330.db2.gz YUIDLHANWIDFQD-GFCCVEGCSA-N 1 2 307.463 4.187 20 0 DIADLO Cc1cc(Cl)c(C[N@@H+]2CCc3ccc(N)cc3C2)c(Cl)c1 ZINC001236233541 1055024677 /nfs/dbraw/zinc/02/46/77/1055024677.db2.gz JZDJIILPRFBDSW-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO Cc1cc(Cl)c(C[N@H+]2CCc3ccc(N)cc3C2)c(Cl)c1 ZINC001236233541 1055024693 /nfs/dbraw/zinc/02/46/93/1055024693.db2.gz JZDJIILPRFBDSW-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO COc1cc(-c2ccccc2)ccc1C[NH2+]Cc1ncc(C)s1 ZINC000183062930 1055027565 /nfs/dbraw/zinc/02/75/65/1055027565.db2.gz YZMPNYDSLIZALJ-UHFFFAOYSA-N 1 2 324.449 4.417 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc2ccccc2n1 ZINC000183150871 1055031203 /nfs/dbraw/zinc/03/12/03/1055031203.db2.gz AJYRKQYFGUWMIN-OAHLLOKOSA-N 1 2 318.424 4.403 20 0 DIADLO CCc1nc(C)c([C@@H](C)Nc2ccc(N3CCCC3)[nH+]c2)s1 ZINC000183146806 1055031588 /nfs/dbraw/zinc/03/15/88/1055031588.db2.gz WBCYBSQBHHTMCN-GFCCVEGCSA-N 1 2 316.474 4.182 20 0 DIADLO CCc1nc(C)c([C@H](C)Nc2ccc(N3CCCC3)[nH+]c2)s1 ZINC000183146831 1055031861 /nfs/dbraw/zinc/03/18/61/1055031861.db2.gz WBCYBSQBHHTMCN-LBPRGKRZSA-N 1 2 316.474 4.182 20 0 DIADLO c1ccc2c(c1)OCCC[C@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000183147956 1055032475 /nfs/dbraw/zinc/03/24/75/1055032475.db2.gz OWRWOBNBLZONMU-QGZVFWFLSA-N 1 2 309.413 4.008 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)CC(C)(C)c2ccccc2)c(C)[nH+]1 ZINC001535960691 1055034215 /nfs/dbraw/zinc/03/42/15/1055034215.db2.gz DOJNPWAPJSTORT-MRXNPFEDSA-N 1 2 324.468 4.493 20 0 DIADLO FC(F)(F)[C@H]1CC=C(c2ccc(Cn3cc[nH+]c3)cn2)CC1 ZINC001236252315 1055036278 /nfs/dbraw/zinc/03/62/78/1055036278.db2.gz PCGAAQOIKAEELS-AWEZNQCLSA-N 1 2 307.319 4.072 20 0 DIADLO c1ccc(-c2nc(C[NH2+]C3(c4ccccc4)CCCC3)no2)cc1 ZINC000183547273 1055050109 /nfs/dbraw/zinc/05/01/09/1055050109.db2.gz VFVLSJGPAPNCHI-UHFFFAOYSA-N 1 2 319.408 4.296 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2nc(C(C)(C)C)cs2)C2CC2)s1 ZINC000185277156 1055089449 /nfs/dbraw/zinc/08/94/49/1055089449.db2.gz VRKVAZZABFHGRE-AWEZNQCLSA-N 1 2 321.515 4.446 20 0 DIADLO CCn1c2ccccc2nc1[C@@H](C)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000185728044 1055097904 /nfs/dbraw/zinc/09/79/04/1055097904.db2.gz UEJUWTNKDXVCPK-CYBMUJFWSA-N 1 2 321.428 4.205 20 0 DIADLO COc1nc(C(C)C)ccc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001236445854 1055116123 /nfs/dbraw/zinc/11/61/23/1055116123.db2.gz HRGZNZKLDVILGE-UHFFFAOYSA-N 1 2 307.397 4.281 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(C(C)C)nc1OC ZINC001236447425 1055117913 /nfs/dbraw/zinc/11/79/13/1055117913.db2.gz MEIHJJFMOFZMGZ-UHFFFAOYSA-N 1 2 323.396 4.075 20 0 DIADLO Cc1cc(C)c(Cl)c(-c2ccccc2C[NH+]2CCOCC2)c1 ZINC001236550838 1055178463 /nfs/dbraw/zinc/17/84/63/1055178463.db2.gz DRLAXTQGCINCQH-UHFFFAOYSA-N 1 2 315.844 4.456 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccnc(OC(C)C)c1 ZINC001236560295 1055183904 /nfs/dbraw/zinc/18/39/04/1055183904.db2.gz SMDWOVXBZLDWOM-UHFFFAOYSA-N 1 2 311.429 4.230 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cnc(Cl)c(C(F)(F)F)c1 ZINC001236636872 1055209873 /nfs/dbraw/zinc/20/98/73/1055209873.db2.gz UZJVWWXNSLXKOS-VHSXEESVSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cnc(Cl)c(C(F)(F)F)c1 ZINC001236636872 1055209886 /nfs/dbraw/zinc/20/98/86/1055209886.db2.gz UZJVWWXNSLXKOS-VHSXEESVSA-N 1 2 306.759 4.374 20 0 DIADLO CCOc1ncc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cc1F ZINC001236691725 1055231342 /nfs/dbraw/zinc/23/13/42/1055231342.db2.gz ZNVQDABIBMFDEP-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ncc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cc1F ZINC001236691725 1055231353 /nfs/dbraw/zinc/23/13/53/1055231353.db2.gz ZNVQDABIBMFDEP-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CC[C@@H](C)N1CC[C@@]2(CCC[N@@H+](c3ccc(C)cc3)CC2)C1=O ZINC001278000418 1055237918 /nfs/dbraw/zinc/23/79/18/1055237918.db2.gz HHUCEWWWKLPTCM-XLIONFOSSA-N 1 2 314.473 4.003 20 0 DIADLO CC[C@@H](C)N1CC[C@@]2(CCC[N@H+](c3ccc(C)cc3)CC2)C1=O ZINC001278000418 1055237934 /nfs/dbraw/zinc/23/79/34/1055237934.db2.gz HHUCEWWWKLPTCM-XLIONFOSSA-N 1 2 314.473 4.003 20 0 DIADLO O=C(C[C@H]1C=CCC1)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001587253040 1055253143 /nfs/dbraw/zinc/25/31/43/1055253143.db2.gz PAIASOCLYZJQQX-HNNXBMFYSA-N 1 2 322.408 4.148 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c(F)cc1F ZINC001236816249 1055271444 /nfs/dbraw/zinc/27/14/44/1055271444.db2.gz FHZRAMULOOHYEJ-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c(F)cc1F ZINC001236816249 1055271458 /nfs/dbraw/zinc/27/14/58/1055271458.db2.gz FHZRAMULOOHYEJ-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cccc(C)c1-c1cccc(C[N@@H+]2CCn3nccc3C2)c1 ZINC001236815627 1055272950 /nfs/dbraw/zinc/27/29/50/1055272950.db2.gz SCENHHAEZZKVLE-UHFFFAOYSA-N 1 2 317.436 4.183 20 0 DIADLO Cc1cccc(C)c1-c1cccc(C[N@H+]2CCn3nccc3C2)c1 ZINC001236815627 1055272957 /nfs/dbraw/zinc/27/29/57/1055272957.db2.gz SCENHHAEZZKVLE-UHFFFAOYSA-N 1 2 317.436 4.183 20 0 DIADLO Cc1cc(Br)sc1C[N@H+]1CCCC[C@H](F)C1 ZINC001236830173 1055278416 /nfs/dbraw/zinc/27/84/16/1055278416.db2.gz RGQJWTDIIJQWIJ-JTQLQIEISA-N 1 2 306.244 4.143 20 0 DIADLO Cc1cc(Br)sc1C[N@@H+]1CCCC[C@H](F)C1 ZINC001236830173 1055278408 /nfs/dbraw/zinc/27/84/08/1055278408.db2.gz RGQJWTDIIJQWIJ-JTQLQIEISA-N 1 2 306.244 4.143 20 0 DIADLO Cc1cc(Br)sc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC001236829771 1055280685 /nfs/dbraw/zinc/28/06/85/1055280685.db2.gz PTDRZWGDNCJVQZ-UHFFFAOYSA-N 1 2 322.218 4.050 20 0 DIADLO CCOc1cncc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c1 ZINC001236841559 1055286875 /nfs/dbraw/zinc/28/68/75/1055286875.db2.gz RSDBVTBGWAJEOI-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cncc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)c1 ZINC001236841559 1055286883 /nfs/dbraw/zinc/28/68/83/1055286883.db2.gz RSDBVTBGWAJEOI-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1F)CCC2 ZINC000764939180 1055294281 /nfs/dbraw/zinc/29/42/81/1055294281.db2.gz JOPZZUAFYDSLIE-SJCJKPOMSA-N 1 2 319.399 4.470 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cc2sccc2nc1Cl ZINC001236865105 1055294604 /nfs/dbraw/zinc/29/46/04/1055294604.db2.gz VHBDMPULXKEEBQ-LLVKDONJSA-N 1 2 317.845 4.328 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cc2sccc2nc1Cl ZINC001236865105 1055294630 /nfs/dbraw/zinc/29/46/30/1055294630.db2.gz VHBDMPULXKEEBQ-LLVKDONJSA-N 1 2 317.845 4.328 20 0 DIADLO CC1(C)C[NH+](Cc2cc3sccc3nc2Cl)CC(C)(C)O1 ZINC001236862864 1055295746 /nfs/dbraw/zinc/29/57/46/1055295746.db2.gz ACLPLDBICVPARL-UHFFFAOYSA-N 1 2 324.877 4.339 20 0 DIADLO Fc1cc(F)c2cc(C[NH+]3CCC(F)CC3)c(Cl)nc2c1 ZINC001236870978 1055300524 /nfs/dbraw/zinc/30/05/24/1055300524.db2.gz MJGDVOVBGQZLGE-UHFFFAOYSA-N 1 2 314.738 4.100 20 0 DIADLO CC1(C)C[NH+](Cc2nc3ccccc3cc2Cl)CC(C)(C)O1 ZINC001236877404 1055301486 /nfs/dbraw/zinc/30/14/86/1055301486.db2.gz QJZSZAFSJCHYHM-UHFFFAOYSA-N 1 2 318.848 4.278 20 0 DIADLO Clc1cc(C[NH+]2Cc3ccccc3C2)ccc1-n1cccn1 ZINC001236893696 1055304901 /nfs/dbraw/zinc/30/49/01/1055304901.db2.gz BSCRZXBJANECII-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc(-c2ccccc2F)nc1 ZINC001236993308 1055329603 /nfs/dbraw/zinc/32/96/03/1055329603.db2.gz OVDGZANUCAODFU-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccc(-c2ccccc2F)nc1 ZINC001236993308 1055329617 /nfs/dbraw/zinc/32/96/17/1055329617.db2.gz OVDGZANUCAODFU-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc(-c2ccccc2F)nc1 ZINC001236993310 1055330513 /nfs/dbraw/zinc/33/05/13/1055330513.db2.gz OVDGZANUCAODFU-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccc(-c2ccccc2F)nc1 ZINC001236993310 1055330527 /nfs/dbraw/zinc/33/05/27/1055330527.db2.gz OVDGZANUCAODFU-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO CC(C)(C)Oc1ccccc1C[N@@H+]1CCC(=O)[C@H]2CCCC[C@H]21 ZINC001237026112 1055343642 /nfs/dbraw/zinc/34/36/42/1055343642.db2.gz KSBXZLHJRDYPED-DLBZAZTESA-N 1 2 315.457 4.198 20 0 DIADLO CC(C)(C)Oc1ccccc1C[N@H+]1CCC(=O)[C@H]2CCCC[C@H]21 ZINC001237026112 1055343649 /nfs/dbraw/zinc/34/36/49/1055343649.db2.gz KSBXZLHJRDYPED-DLBZAZTESA-N 1 2 315.457 4.198 20 0 DIADLO CNc1ccc(Nc2cccc(NC(=O)c3ccccc3)c2)c[nH+]1 ZINC001203456764 1055362438 /nfs/dbraw/zinc/36/24/38/1055362438.db2.gz VHQYVRXAAVBHEA-UHFFFAOYSA-N 1 2 318.380 4.119 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@@H](Cc2ccccc2)C(C)C)c(C)[nH+]1 ZINC001537619993 1055382120 /nfs/dbraw/zinc/38/21/20/1055382120.db2.gz NWVPXFLSMXJCGS-LJQANCHMSA-N 1 2 324.468 4.252 20 0 DIADLO c1coc([C@H]([NH2+]Cc2cnn(CC3CCC3)c2)c2ccccc2)c1 ZINC000921513634 1055400569 /nfs/dbraw/zinc/40/05/69/1055400569.db2.gz SCTXHWOIGPQQNH-HXUWFJFHSA-N 1 2 321.424 4.155 20 0 DIADLO c1ccc2c(c1)sc1ccc(C[NH+]3CC4(C3)CCCO4)cc12 ZINC001237196366 1055401545 /nfs/dbraw/zinc/40/15/45/1055401545.db2.gz UFJXAKIKISVWIP-UHFFFAOYSA-N 1 2 309.434 4.419 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2ncc(Cl)s2)C2CC2)c(F)c1 ZINC001168541747 1055407849 /nfs/dbraw/zinc/40/78/49/1055407849.db2.gz KGYLOIKZIQGTPH-AWEZNQCLSA-N 1 2 314.788 4.316 20 0 DIADLO COc1cc(C[N@@H+]2CCCC(F)(F)[C@@H](F)C2)ccc1C(F)F ZINC001237277579 1055415901 /nfs/dbraw/zinc/41/59/01/1055415901.db2.gz QAXFZXXNHMRDMU-ZDUSSCGKSA-N 1 2 323.305 4.202 20 0 DIADLO COc1cc(C[N@H+]2CCCC(F)(F)[C@@H](F)C2)ccc1C(F)F ZINC001237277579 1055415907 /nfs/dbraw/zinc/41/59/07/1055415907.db2.gz QAXFZXXNHMRDMU-ZDUSSCGKSA-N 1 2 323.305 4.202 20 0 DIADLO COc1cc(C[N@@H+]2CCn3cccc3[C@@H]2C)ccc1C(F)F ZINC001237279038 1055415931 /nfs/dbraw/zinc/41/59/31/1055415931.db2.gz FUYUTGCEXIOEDY-LBPRGKRZSA-N 1 2 306.356 4.011 20 0 DIADLO COc1cc(C[N@H+]2CCn3cccc3[C@@H]2C)ccc1C(F)F ZINC001237279038 1055415932 /nfs/dbraw/zinc/41/59/32/1055415932.db2.gz FUYUTGCEXIOEDY-LBPRGKRZSA-N 1 2 306.356 4.011 20 0 DIADLO Oc1cc(F)cc(C[N@@H+](Cc2ccccc2)Cc2ccncc2)c1 ZINC001237285213 1055416071 /nfs/dbraw/zinc/41/60/71/1055416071.db2.gz OXTZGAUERSTFLH-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO CCC[C@@H](C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1)c1ccccc1 ZINC000010656907 1055420117 /nfs/dbraw/zinc/42/01/17/1055420117.db2.gz VLTHVVXXUIWDFR-MRXNPFEDSA-N 1 2 307.397 4.394 20 0 DIADLO COc1ccc(-c2ccccc2)c(C[N@@H+]2Cc3ccncc3C2)c1 ZINC001237306487 1055424081 /nfs/dbraw/zinc/42/40/81/1055424081.db2.gz HQLYIQMAKYQBLJ-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccc(-c2ccccc2)c(C[N@H+]2Cc3ccncc3C2)c1 ZINC001237306487 1055424091 /nfs/dbraw/zinc/42/40/91/1055424091.db2.gz HQLYIQMAKYQBLJ-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccc(-c2ccccc2)c(C[N@H+](C)Cc2cscn2)c1 ZINC001237311786 1055424460 /nfs/dbraw/zinc/42/44/60/1055424460.db2.gz SCYVDUVXWXMTFE-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1ccc(-c2ccccc2)c(C[N@@H+](C)Cc2cscn2)c1 ZINC001237311786 1055424467 /nfs/dbraw/zinc/42/44/67/1055424467.db2.gz SCYVDUVXWXMTFE-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@@H]1c1ncccn1 ZINC001237353057 1055436622 /nfs/dbraw/zinc/43/66/22/1055436622.db2.gz MBPOWNKHIOLQOY-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@@H+]1CCC[C@@H]1c1ncccn1 ZINC001237353057 1055436618 /nfs/dbraw/zinc/43/66/18/1055436618.db2.gz MBPOWNKHIOLQOY-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO C[N@H+](Cc1nc(-c2ccsc2)no1)Cc1cccc(Cl)c1 ZINC000015298515 1055440485 /nfs/dbraw/zinc/44/04/85/1055440485.db2.gz UWCXVFDVXSSDPO-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccsc2)no1)Cc1cccc(Cl)c1 ZINC000015298515 1055440492 /nfs/dbraw/zinc/44/04/92/1055440492.db2.gz UWCXVFDVXSSDPO-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO c1csc([C@H]2CCC[N@H+]2Cc2cnc(-c3ccccc3)o2)n1 ZINC001237367168 1055441288 /nfs/dbraw/zinc/44/12/88/1055441288.db2.gz FJHJIEUNMYYRSR-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc([C@H]2CCC[N@@H+]2Cc2cnc(-c3ccccc3)o2)n1 ZINC001237367168 1055441295 /nfs/dbraw/zinc/44/12/95/1055441295.db2.gz FJHJIEUNMYYRSR-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc([C@@H]2CCC[N@H+]2Cc2cnc(-c3ccccc3)o2)n1 ZINC001237367166 1055442120 /nfs/dbraw/zinc/44/21/20/1055442120.db2.gz FJHJIEUNMYYRSR-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc([C@@H]2CCC[N@@H+]2Cc2cnc(-c3ccccc3)o2)n1 ZINC001237367166 1055442129 /nfs/dbraw/zinc/44/21/29/1055442129.db2.gz FJHJIEUNMYYRSR-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC001237405063 1055448265 /nfs/dbraw/zinc/44/82/65/1055448265.db2.gz PNNKGTUFHDODKT-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC001237405063 1055448271 /nfs/dbraw/zinc/44/82/71/1055448271.db2.gz PNNKGTUFHDODKT-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO Clc1ccc([C@H]2CCC[N@@H+]2Cc2cc3ccccn3n2)cc1 ZINC001237442026 1055453517 /nfs/dbraw/zinc/45/35/17/1055453517.db2.gz GXFVULHBWYSCKQ-GOSISDBHSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1ccc([C@H]2CCC[N@H+]2Cc2cc3ccccn3n2)cc1 ZINC001237442026 1055453523 /nfs/dbraw/zinc/45/35/23/1055453523.db2.gz GXFVULHBWYSCKQ-GOSISDBHSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1[nH]c2cnccc2c1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC001237460561 1055455496 /nfs/dbraw/zinc/45/54/96/1055455496.db2.gz JAEBELGODAQWLM-CYBMUJFWSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1[nH]c2cnccc2c1C[N@H+]1CCC[C@@H]1c1nccs1 ZINC001237460561 1055455502 /nfs/dbraw/zinc/45/55/02/1055455502.db2.gz JAEBELGODAQWLM-CYBMUJFWSA-N 1 2 318.833 4.010 20 0 DIADLO Cc1ccccc1NC(=O)[C@@H](C)[N@H+](C)Cc1ccc(Cl)s1 ZINC000016343298 1055456719 /nfs/dbraw/zinc/45/67/19/1055456719.db2.gz AXEFRWOCJALIQE-GFCCVEGCSA-N 1 2 322.861 4.169 20 0 DIADLO Cc1ccccc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(Cl)s1 ZINC000016343298 1055456730 /nfs/dbraw/zinc/45/67/30/1055456730.db2.gz AXEFRWOCJALIQE-GFCCVEGCSA-N 1 2 322.861 4.169 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Oc1c(Cl)ccc2ccccc21 ZINC001588239794 1055456991 /nfs/dbraw/zinc/45/69/91/1055456991.db2.gz PMOSWFWVLIUXGU-UHFFFAOYSA-N 1 2 314.772 4.076 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C=Cc3ccc4[nH]ccc4c3)cc2[nH+]1 ZINC000765564073 1055464021 /nfs/dbraw/zinc/46/40/21/1055464021.db2.gz MLHZCFASPSZMOY-CLTKARDFSA-N 1 2 316.364 4.005 20 0 DIADLO Cc1cc(CNc2ccccc2-n2cccn2)c2c([nH+]1)CCCC2 ZINC001620843557 1055471109 /nfs/dbraw/zinc/47/11/09/1055471109.db2.gz RDXZQCYAADOLSM-UHFFFAOYSA-N 1 2 318.424 4.067 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2nc(CC(C)C)no2)c(C)c1 ZINC000615464419 1055472045 /nfs/dbraw/zinc/47/20/45/1055472045.db2.gz YASLSXPOQCZQBS-HNNXBMFYSA-N 1 2 301.434 4.078 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2nc(CC(C)C)no2)c(C)c1 ZINC000615464419 1055472057 /nfs/dbraw/zinc/47/20/57/1055472057.db2.gz YASLSXPOQCZQBS-HNNXBMFYSA-N 1 2 301.434 4.078 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2cccc(-c3ccccc3)n2)C[C@@H]1F ZINC001237543737 1055472582 /nfs/dbraw/zinc/47/25/82/1055472582.db2.gz ZLCXKOJGVVRKGY-ROUUACIJSA-N 1 2 302.368 4.021 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2cccc(-c3ccccc3)n2)C[C@@H]1F ZINC001237543737 1055472588 /nfs/dbraw/zinc/47/25/88/1055472588.db2.gz ZLCXKOJGVVRKGY-ROUUACIJSA-N 1 2 302.368 4.021 20 0 DIADLO CC[N@H+](Cc1ccn2nccc2c1)Cc1c(F)cccc1Cl ZINC001237544943 1055472702 /nfs/dbraw/zinc/47/27/02/1055472702.db2.gz PWAGZLMEZCCKEU-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO CC[N@@H+](Cc1ccn2nccc2c1)Cc1c(F)cccc1Cl ZINC001237544943 1055472709 /nfs/dbraw/zinc/47/27/09/1055472709.db2.gz PWAGZLMEZCCKEU-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO COc1ccc(OC)c(C[N@H+](Cc2ccccc2)C2CC2)c1F ZINC001237581023 1055477321 /nfs/dbraw/zinc/47/73/21/1055477321.db2.gz NVIWXRLISNVMJK-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO COc1ccc(OC)c(C[N@@H+](Cc2ccccc2)C2CC2)c1F ZINC001237581023 1055477331 /nfs/dbraw/zinc/47/73/31/1055477331.db2.gz NVIWXRLISNVMJK-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO CCn1cncc1C[N@H+](C)Cc1ccccc1Oc1ccccc1 ZINC001237597447 1055481927 /nfs/dbraw/zinc/48/19/27/1055481927.db2.gz PUSBDLHQQPKUSR-UHFFFAOYSA-N 1 2 321.424 4.327 20 0 DIADLO CCn1cncc1C[N@@H+](C)Cc1ccccc1Oc1ccccc1 ZINC001237597447 1055481935 /nfs/dbraw/zinc/48/19/35/1055481935.db2.gz PUSBDLHQQPKUSR-UHFFFAOYSA-N 1 2 321.424 4.327 20 0 DIADLO CCOC1CC[NH+](Cc2c(Cl)cc(F)cc2Cl)CC1 ZINC001237595514 1055482793 /nfs/dbraw/zinc/48/27/93/1055482793.db2.gz CSJZDEYGJJORQX-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO C[C@H]([NH2+]Cc1ccc2c(c1)CCC2)c1noc(-c2ccccc2)n1 ZINC001620859600 1055486584 /nfs/dbraw/zinc/48/65/84/1055486584.db2.gz RWKCVQDHZZDKIT-AWEZNQCLSA-N 1 2 319.408 4.076 20 0 DIADLO Cc1ccnc2cccc(C[N@@H+]3CCC[C@H](F)C(F)(F)C3)c12 ZINC001237624899 1055489107 /nfs/dbraw/zinc/48/91/07/1055489107.db2.gz CQXOTUVPHLNGDG-HNNXBMFYSA-N 1 2 308.347 4.112 20 0 DIADLO Cc1ccnc2cccc(C[N@H+]3CCC[C@H](F)C(F)(F)C3)c12 ZINC001237624899 1055489113 /nfs/dbraw/zinc/48/91/13/1055489113.db2.gz CQXOTUVPHLNGDG-HNNXBMFYSA-N 1 2 308.347 4.112 20 0 DIADLO Cc1coc(C[N@@H+]2C[C@H]3C[C@@]3(c3ccc(Cl)c(Cl)c3)C2)n1 ZINC001237637987 1055490153 /nfs/dbraw/zinc/49/01/53/1055490153.db2.gz BDGIKNBNTFNNFT-WBMJQRKESA-N 1 2 323.223 4.063 20 0 DIADLO Cc1coc(C[N@H+]2C[C@H]3C[C@@]3(c3ccc(Cl)c(Cl)c3)C2)n1 ZINC001237637987 1055490161 /nfs/dbraw/zinc/49/01/61/1055490161.db2.gz BDGIKNBNTFNNFT-WBMJQRKESA-N 1 2 323.223 4.063 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1cccc(OC(F)F)c1 ZINC000921541174 1055491181 /nfs/dbraw/zinc/49/11/81/1055491181.db2.gz WNFGURWAXXDPEM-LLVKDONJSA-N 1 2 324.371 4.424 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2csc3ccccc23)n1 ZINC000921542818 1055493052 /nfs/dbraw/zinc/49/30/52/1055493052.db2.gz RUBDUUIFUXTJHX-UHFFFAOYSA-N 1 2 300.427 4.477 20 0 DIADLO CCN(CC)c1ccc(NCc2coc(-c3ccccc3)n2)c[nH+]1 ZINC001620869190 1055495742 /nfs/dbraw/zinc/49/57/42/1055495742.db2.gz IXHGYJPEWSLFDR-UHFFFAOYSA-N 1 2 322.412 4.195 20 0 DIADLO Cc1cc2c(cn1)C[N@H+](Cc1ccc(-c3ccc(O)cc3)cc1)C2 ZINC001237665755 1055499641 /nfs/dbraw/zinc/49/96/41/1055499641.db2.gz NOEHIDKBVIQJQM-UHFFFAOYSA-N 1 2 316.404 4.278 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+](Cc1ccc(-c3ccc(O)cc3)cc1)C2 ZINC001237665755 1055499646 /nfs/dbraw/zinc/49/96/46/1055499646.db2.gz NOEHIDKBVIQJQM-UHFFFAOYSA-N 1 2 316.404 4.278 20 0 DIADLO Cc1ccc(F)c(C[NH2+][C@H]2CCCc3cn(C(C)C)nc32)c1 ZINC001620873358 1055501617 /nfs/dbraw/zinc/50/16/17/1055501617.db2.gz YHBYXHYFORYXSD-KRWDZBQOSA-N 1 2 301.409 4.079 20 0 DIADLO Cc1cc(C)c(Cl)c(C[N@@H+]2CCC(=O)[C@@H]3CCCC[C@H]32)c1 ZINC001237698961 1055507561 /nfs/dbraw/zinc/50/75/61/1055507561.db2.gz SEFSICWEBNKILU-HZPDHXFCSA-N 1 2 305.849 4.290 20 0 DIADLO Cc1cc(C)c(Cl)c(C[N@H+]2CCC(=O)[C@@H]3CCCC[C@H]32)c1 ZINC001237698961 1055507571 /nfs/dbraw/zinc/50/75/71/1055507571.db2.gz SEFSICWEBNKILU-HZPDHXFCSA-N 1 2 305.849 4.290 20 0 DIADLO COc1ccc(C)c(C[N@H+](C)Cc2csc(C(C)C)n2)c1 ZINC001237712147 1055514567 /nfs/dbraw/zinc/51/45/67/1055514567.db2.gz ZQXSDZMPIGAWRI-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO COc1ccc(C)c(C[N@@H+](C)Cc2csc(C(C)C)n2)c1 ZINC001237712147 1055514572 /nfs/dbraw/zinc/51/45/72/1055514572.db2.gz ZQXSDZMPIGAWRI-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO CCc1ccc2c(c1)[C@H]([NH2+]Cc1csc(C3CC3)n1)CCO2 ZINC001620894690 1055520239 /nfs/dbraw/zinc/52/02/39/1055520239.db2.gz BPYDMMOMWMTSQZ-MRXNPFEDSA-N 1 2 314.454 4.196 20 0 DIADLO CCc1cc(C[N@@H+]2CCc3ncc(C)cc3C2)ccc1Cl ZINC001237743032 1055523284 /nfs/dbraw/zinc/52/32/84/1055523284.db2.gz ZBZCFSAEVCIOKY-UHFFFAOYSA-N 1 2 300.833 4.164 20 0 DIADLO CCc1cc(C[N@H+]2CCc3ncc(C)cc3C2)ccc1Cl ZINC001237743032 1055523291 /nfs/dbraw/zinc/52/32/91/1055523291.db2.gz ZBZCFSAEVCIOKY-UHFFFAOYSA-N 1 2 300.833 4.164 20 0 DIADLO COc1ccc(C[N@H+]2CC=C(c3ccccc3)CC2)c(Cl)n1 ZINC001237797977 1055533145 /nfs/dbraw/zinc/53/31/45/1055533145.db2.gz ZBMNELMPUBCRFF-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1ccc(C[N@@H+]2CC=C(c3ccccc3)CC2)c(Cl)n1 ZINC001237797977 1055533159 /nfs/dbraw/zinc/53/31/59/1055533159.db2.gz ZBMNELMPUBCRFF-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO CCc1ncc(C[N@H+](Cc2ccccc2)Cc2ccncc2)s1 ZINC001237821821 1055536489 /nfs/dbraw/zinc/53/64/89/1055536489.db2.gz QMDUIVTWJQUYAJ-UHFFFAOYSA-N 1 2 323.465 4.303 20 0 DIADLO CCc1ncc(C[N@@H+](Cc2ccccc2)Cc2ccncc2)s1 ZINC001237821821 1055536501 /nfs/dbraw/zinc/53/65/01/1055536501.db2.gz QMDUIVTWJQUYAJ-UHFFFAOYSA-N 1 2 323.465 4.303 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(F)c(C)n1 ZINC001237821875 1055537588 /nfs/dbraw/zinc/53/75/88/1055537588.db2.gz GGJIOWAAFWQPLY-SFHVURJKSA-N 1 2 314.404 4.013 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(F)c(C)n1 ZINC001237821875 1055537600 /nfs/dbraw/zinc/53/76/00/1055537600.db2.gz GGJIOWAAFWQPLY-SFHVURJKSA-N 1 2 314.404 4.013 20 0 DIADLO Fc1c(Cl)c(Br)ccc1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC001237891417 1055552516 /nfs/dbraw/zinc/55/25/16/1055552516.db2.gz CDFAORZTLMOAHT-WCBMZHEXSA-N 1 2 318.617 4.226 20 0 DIADLO Fc1c(Cl)c(Br)ccc1C[N@H+]1C[C@H]2CC[C@@H]1C2 ZINC001237891417 1055552529 /nfs/dbraw/zinc/55/25/29/1055552529.db2.gz CDFAORZTLMOAHT-WCBMZHEXSA-N 1 2 318.617 4.226 20 0 DIADLO Cc1cnc(Cl)c(CNc2ccc([NH+]3CCCC3)cc2)c1 ZINC000921568028 1055566830 /nfs/dbraw/zinc/56/68/30/1055566830.db2.gz DGCRUFQGFZTNNK-UHFFFAOYSA-N 1 2 301.821 4.256 20 0 DIADLO Fc1cccc(-c2nc(C[NH+]3CCC(F)(F)CC3)cs2)c1 ZINC001237976019 1055570209 /nfs/dbraw/zinc/57/02/09/1055570209.db2.gz LFVOCJBZTKYVJC-UHFFFAOYSA-N 1 2 312.360 4.180 20 0 DIADLO CC1(C)C[N@H+](Cc2cncc(Cl)c2Cl)CCC1(F)F ZINC001238005807 1055582209 /nfs/dbraw/zinc/58/22/09/1055582209.db2.gz LVMGYTUZTUIKMG-UHFFFAOYSA-N 1 2 309.187 4.256 20 0 DIADLO CC1(C)C[N@@H+](Cc2cncc(Cl)c2Cl)CCC1(F)F ZINC001238005807 1055582214 /nfs/dbraw/zinc/58/22/14/1055582214.db2.gz LVMGYTUZTUIKMG-UHFFFAOYSA-N 1 2 309.187 4.256 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2cc3ccccc3s2)n1 ZINC000921591750 1055575032 /nfs/dbraw/zinc/57/50/32/1055575032.db2.gz IMEJLSGAUPUKEJ-UHFFFAOYSA-N 1 2 300.427 4.477 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[N@@H+]1CCC[C@H]2CCCC[C@@H]21 ZINC001237997359 1055577168 /nfs/dbraw/zinc/57/71/68/1055577168.db2.gz DJRSRSOPRQOSGP-PXAZEXFGSA-N 1 2 303.837 4.371 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[N@H+]1CCC[C@H]2CCCC[C@@H]21 ZINC001237997359 1055577179 /nfs/dbraw/zinc/57/71/79/1055577179.db2.gz DJRSRSOPRQOSGP-PXAZEXFGSA-N 1 2 303.837 4.371 20 0 DIADLO Cc1ccoc1C[NH2+]Cc1oc2ccccc2c1Br ZINC001620956212 1055579041 /nfs/dbraw/zinc/57/90/41/1055579041.db2.gz LGXDICQJMWLILH-UHFFFAOYSA-N 1 2 320.186 4.387 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+]Cc2nccn2C(F)F)c1Cl ZINC000921610233 1055580537 /nfs/dbraw/zinc/58/05/37/1055580537.db2.gz XITRVSTUQSCSID-UHFFFAOYSA-N 1 2 320.170 4.183 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1cc(C2CC2)cnc1OC ZINC001238029254 1055586523 /nfs/dbraw/zinc/58/65/23/1055586523.db2.gz SEKVJCLRMIIGQR-UHFFFAOYSA-N 1 2 314.404 4.129 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1cc(C2CC2)cnc1OC ZINC001238029254 1055586535 /nfs/dbraw/zinc/58/65/35/1055586535.db2.gz SEKVJCLRMIIGQR-UHFFFAOYSA-N 1 2 314.404 4.129 20 0 DIADLO C/C(=C/c1ccc(C)cc1)C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC001595394836 1055594474 /nfs/dbraw/zinc/59/44/74/1055594474.db2.gz ASXOHMPBPCKLRO-SSZFMOIBSA-N 1 2 317.392 4.223 20 0 DIADLO Fc1cc(Br)c(F)c(C[N@@H+]2CCC23CCCC3)c1 ZINC001238072207 1055600189 /nfs/dbraw/zinc/60/01/89/1055600189.db2.gz ZJFGKNYDGLRUIQ-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1cc(Br)c(F)c(C[N@H+]2CCC23CCCC3)c1 ZINC001238072207 1055600198 /nfs/dbraw/zinc/60/01/98/1055600198.db2.gz ZJFGKNYDGLRUIQ-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Cc1cc(C[N@@H+]2CCC(=O)[C@H]3CCCC[C@@H]32)cc(C)c1Cl ZINC001238088997 1055603150 /nfs/dbraw/zinc/60/31/50/1055603150.db2.gz MQQCUXIQZDKCKW-HOTGVXAUSA-N 1 2 305.849 4.290 20 0 DIADLO Cc1cc(C[N@H+]2CCC(=O)[C@H]3CCCC[C@@H]32)cc(C)c1Cl ZINC001238088997 1055603155 /nfs/dbraw/zinc/60/31/55/1055603155.db2.gz MQQCUXIQZDKCKW-HOTGVXAUSA-N 1 2 305.849 4.290 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1ccc(F)c(Br)c1F ZINC001238082750 1055603384 /nfs/dbraw/zinc/60/33/84/1055603384.db2.gz WWTJAIFSSIICMA-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1ccc(F)c(Br)c1F ZINC001238082750 1055603394 /nfs/dbraw/zinc/60/33/94/1055603394.db2.gz WWTJAIFSSIICMA-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(F)cc(Br)c2F)C2(CC2)C1 ZINC001238083252 1055603483 /nfs/dbraw/zinc/60/34/83/1055603483.db2.gz YYDYXYZRGUPOMA-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(F)cc(Br)c2F)C2(CC2)C1 ZINC001238083252 1055603489 /nfs/dbraw/zinc/60/34/89/1055603489.db2.gz YYDYXYZRGUPOMA-VIFPVBQESA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(Br)c(F)c(C[N@@H+]2CCC3(CCC3)C2)c1 ZINC001238078172 1055603559 /nfs/dbraw/zinc/60/35/59/1055603559.db2.gz FMVXMRZLXJXEND-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Fc1cc(Br)c(F)c(C[N@H+]2CCC3(CCC3)C2)c1 ZINC001238078172 1055603561 /nfs/dbraw/zinc/60/35/61/1055603561.db2.gz FMVXMRZLXJXEND-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2cc(O)ccc2C)on1 ZINC001238102212 1055605262 /nfs/dbraw/zinc/60/52/62/1055605262.db2.gz FPKIRAHVSSZJHL-UHFFFAOYSA-N 1 2 322.408 4.199 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2cc(O)ccc2C)on1 ZINC001238102212 1055605273 /nfs/dbraw/zinc/60/52/73/1055605273.db2.gz FPKIRAHVSSZJHL-UHFFFAOYSA-N 1 2 322.408 4.199 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1csc(-c2ccco2)n1 ZINC000172152919 1055607520 /nfs/dbraw/zinc/60/75/20/1055607520.db2.gz DCBNOEBCLIHTGW-HNNXBMFYSA-N 1 2 313.426 4.079 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1csc(-c2ccco2)n1 ZINC000172152919 1055607524 /nfs/dbraw/zinc/60/75/24/1055607524.db2.gz DCBNOEBCLIHTGW-HNNXBMFYSA-N 1 2 313.426 4.079 20 0 DIADLO C[N@H+](Cc1c(N)ccnc1F)C(c1ccccc1)c1ccccc1 ZINC001238153922 1055614221 /nfs/dbraw/zinc/61/42/21/1055614221.db2.gz QRLWFQIMPQBAFH-UHFFFAOYSA-N 1 2 321.399 4.024 20 0 DIADLO C[N@@H+](Cc1c(N)ccnc1F)C(c1ccccc1)c1ccccc1 ZINC001238153922 1055614230 /nfs/dbraw/zinc/61/42/30/1055614230.db2.gz QRLWFQIMPQBAFH-UHFFFAOYSA-N 1 2 321.399 4.024 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1Cl)Cc1cncnc1C ZINC001238178502 1055615337 /nfs/dbraw/zinc/61/53/37/1055615337.db2.gz MOAFFHVOQQTFLK-UHFFFAOYSA-N 1 2 310.228 4.114 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)cc1Cl)Cc1cncnc1C ZINC001238178502 1055615343 /nfs/dbraw/zinc/61/53/43/1055615343.db2.gz MOAFFHVOQQTFLK-UHFFFAOYSA-N 1 2 310.228 4.114 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1Cl ZINC001238150706 1055615392 /nfs/dbraw/zinc/61/53/92/1055615392.db2.gz XTEVSPOEQRWZHE-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1Cl ZINC001238150706 1055615397 /nfs/dbraw/zinc/61/53/97/1055615397.db2.gz XTEVSPOEQRWZHE-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2cccc(-c3cccs3)n2)C[C@@H]1F ZINC001238211862 1055620100 /nfs/dbraw/zinc/62/01/00/1055620100.db2.gz SVJWYHHZZSQIEW-JKSUJKDBSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2cccc(-c3cccs3)n2)C[C@@H]1F ZINC001238211862 1055620106 /nfs/dbraw/zinc/62/01/06/1055620106.db2.gz SVJWYHHZZSQIEW-JKSUJKDBSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cccc(-c2cccs2)n1 ZINC001238213795 1055623573 /nfs/dbraw/zinc/62/35/73/1055623573.db2.gz PORBIHKKQGREGZ-AWEZNQCLSA-N 1 2 309.438 4.188 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cccc(-c2cccs2)n1 ZINC001238213795 1055623581 /nfs/dbraw/zinc/62/35/81/1055623581.db2.gz PORBIHKKQGREGZ-AWEZNQCLSA-N 1 2 309.438 4.188 20 0 DIADLO Fc1ccnc(Cl)c1C[NH+]1CCC(Cc2ccccc2)CC1 ZINC001238226380 1055625605 /nfs/dbraw/zinc/62/56/05/1055625605.db2.gz VEBWWJKTRXDDCU-UHFFFAOYSA-N 1 2 318.823 4.329 20 0 DIADLO Cn1ccc(CNc2ccc3[nH]c(-c4ccc(F)cc4)[nH+]c3c2)c1 ZINC001620962100 1055628837 /nfs/dbraw/zinc/62/88/37/1055628837.db2.gz OTTTWLHECQJMJK-UHFFFAOYSA-N 1 2 320.371 4.320 20 0 DIADLO Cc1cc(Cl)c(Cl)cc1C[NH+]1CC2(C1)C[C@@H](F)CS2 ZINC001238265721 1055634378 /nfs/dbraw/zinc/63/43/78/1055634378.db2.gz DWRKPQKAMMGZSB-LLVKDONJSA-N 1 2 320.260 4.331 20 0 DIADLO CC(C)Oc1c(F)cccc1C[NH+]1CC(C)(C)OC(C)(C)C1 ZINC001238324806 1055638752 /nfs/dbraw/zinc/63/87/52/1055638752.db2.gz VVFDPVYVKZKPRS-UHFFFAOYSA-N 1 2 309.425 4.002 20 0 DIADLO CC(C)Oc1c(F)cccc1C[N@@H+]1CCOc2ccccc2C1 ZINC001238319276 1055639371 /nfs/dbraw/zinc/63/93/71/1055639371.db2.gz LWYVJDRKGPOXLH-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO CC(C)Oc1c(F)cccc1C[N@H+]1CCOc2ccccc2C1 ZINC001238319276 1055639379 /nfs/dbraw/zinc/63/93/79/1055639379.db2.gz LWYVJDRKGPOXLH-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO FC[C@H]1CCC[N@@H+]1Cc1cccc(F)c1OCc1ccccc1 ZINC001238334021 1055640624 /nfs/dbraw/zinc/64/06/24/1055640624.db2.gz FELAGMGRQPANEO-QGZVFWFLSA-N 1 2 317.379 4.339 20 0 DIADLO FC[C@H]1CCC[N@H+]1Cc1cccc(F)c1OCc1ccccc1 ZINC001238334021 1055640632 /nfs/dbraw/zinc/64/06/32/1055640632.db2.gz FELAGMGRQPANEO-QGZVFWFLSA-N 1 2 317.379 4.339 20 0 DIADLO C[C@H]1CC[N@@H+]1Cc1ccc(F)c(OCc2ccccc2)c1F ZINC001238350740 1055642979 /nfs/dbraw/zinc/64/29/79/1055642979.db2.gz YFBPONNNFZFBAU-ZDUSSCGKSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@H]1CC[N@H+]1Cc1ccc(F)c(OCc2ccccc2)c1F ZINC001238350740 1055642985 /nfs/dbraw/zinc/64/29/85/1055642985.db2.gz YFBPONNNFZFBAU-ZDUSSCGKSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@@H]1CC[N@@H+]1Cc1ccc(OCc2ccccc2)c(F)c1F ZINC001238349258 1055643325 /nfs/dbraw/zinc/64/33/25/1055643325.db2.gz BCLFUDQZXDDBPK-CYBMUJFWSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@@H]1CC[N@H+]1Cc1ccc(OCc2ccccc2)c(F)c1F ZINC001238349258 1055643328 /nfs/dbraw/zinc/64/33/28/1055643328.db2.gz BCLFUDQZXDDBPK-CYBMUJFWSA-N 1 2 303.352 4.138 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c(Cl)cn1 ZINC001238356514 1055643771 /nfs/dbraw/zinc/64/37/71/1055643771.db2.gz CBBDYKHNYLZSHX-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c(Cl)cn1 ZINC001238356514 1055643776 /nfs/dbraw/zinc/64/37/76/1055643776.db2.gz CBBDYKHNYLZSHX-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+](C)Cc2ccc(Cl)cc2)c(Cl)cn1 ZINC001238360492 1055645811 /nfs/dbraw/zinc/64/58/11/1055645811.db2.gz PEZOWDVJSMANQX-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2ccc(Cl)cc2)c(Cl)cn1 ZINC001238360492 1055645819 /nfs/dbraw/zinc/64/58/19/1055645819.db2.gz PEZOWDVJSMANQX-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccnc(Br)c2Cl)[C@@H](C)C1 ZINC001238386262 1055649022 /nfs/dbraw/zinc/64/90/22/1055649022.db2.gz YFXLJNUZSXICJW-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccnc(Br)c2Cl)[C@@H](C)C1 ZINC001238386262 1055649028 /nfs/dbraw/zinc/64/90/28/1055649028.db2.gz YFXLJNUZSXICJW-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3nc(C)sc3C2)c(Cl)c1 ZINC001238403007 1055652825 /nfs/dbraw/zinc/65/28/25/1055652825.db2.gz NIDMQRVZIGZOIG-UHFFFAOYSA-N 1 2 322.861 4.062 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3nc(C)sc3C2)c(Cl)c1 ZINC001238403007 1055652829 /nfs/dbraw/zinc/65/28/29/1055652829.db2.gz NIDMQRVZIGZOIG-UHFFFAOYSA-N 1 2 322.861 4.062 20 0 DIADLO CC(C)c1cc(Br)cc(C[NH+]2CCSCC2)c1 ZINC001238417569 1055653233 /nfs/dbraw/zinc/65/32/33/1055653233.db2.gz VWEOVMKDBUOOEC-UHFFFAOYSA-N 1 2 314.292 4.121 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2cccnc2)ncc1Cl ZINC001238418590 1055656217 /nfs/dbraw/zinc/65/62/17/1055656217.db2.gz CBXFMAQRORGBLO-KRWDZBQOSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2cccnc2)ncc1Cl ZINC001238418590 1055656224 /nfs/dbraw/zinc/65/62/24/1055656224.db2.gz CBXFMAQRORGBLO-KRWDZBQOSA-N 1 2 301.821 4.166 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1cccc(OC(C)C)c1F ZINC001238431040 1055657437 /nfs/dbraw/zinc/65/74/37/1055657437.db2.gz SZCRYPOLIXTCFS-UHFFFAOYSA-N 1 2 302.393 4.030 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1cccc(OC(C)C)c1F ZINC001238431040 1055657444 /nfs/dbraw/zinc/65/74/44/1055657444.db2.gz SZCRYPOLIXTCFS-UHFFFAOYSA-N 1 2 302.393 4.030 20 0 DIADLO COc1c(C[N@@H+]2CCSc3ccccc3C2)ccc(F)c1F ZINC001238469034 1055666256 /nfs/dbraw/zinc/66/62/56/1055666256.db2.gz KOFFNEVBUXBFRD-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO COc1c(C[N@H+]2CCSc3ccccc3C2)ccc(F)c1F ZINC001238469034 1055666264 /nfs/dbraw/zinc/66/62/64/1055666264.db2.gz KOFFNEVBUXBFRD-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO COc1c(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)ccc(F)c1F ZINC001238477986 1055667636 /nfs/dbraw/zinc/66/76/36/1055667636.db2.gz QZKJLQPFVYPDRH-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(C[N@H+]2CCC[C@H]2c2cccc(F)c2)ccc(F)c1F ZINC001238477986 1055667647 /nfs/dbraw/zinc/66/76/47/1055667647.db2.gz QZKJLQPFVYPDRH-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(C[N@@H+]2CCCC[C@H]2c2cccnc2)ccc(F)c1F ZINC001238474698 1055668240 /nfs/dbraw/zinc/66/82/40/1055668240.db2.gz FVANIFPQMWEYSA-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1c(C[N@H+]2CCCC[C@H]2c2cccnc2)ccc(F)c1F ZINC001238474698 1055668243 /nfs/dbraw/zinc/66/82/43/1055668243.db2.gz FVANIFPQMWEYSA-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1noc([C@@H](C)[N@H+](C)Cc2ccc(-c3ccccc3)cc2)n1 ZINC000042146012 1055673519 /nfs/dbraw/zinc/67/35/19/1055673519.db2.gz RNEIGPZRYFVDHU-CQSZACIVSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2ccc(-c3ccccc3)cc2)n1 ZINC000042146012 1055673526 /nfs/dbraw/zinc/67/35/26/1055673526.db2.gz RNEIGPZRYFVDHU-CQSZACIVSA-N 1 2 307.397 4.238 20 0 DIADLO COc1cnc(C[N@H+]2CC=C(c3ccccc3)CC2)c(Cl)c1 ZINC001238495056 1055673673 /nfs/dbraw/zinc/67/36/73/1055673673.db2.gz RXAQJYPBLJRAFT-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1cnc(C[N@@H+]2CC=C(c3ccccc3)CC2)c(Cl)c1 ZINC001238495056 1055673679 /nfs/dbraw/zinc/67/36/79/1055673679.db2.gz RXAQJYPBLJRAFT-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO CCOc1cc(C[NH+]2CCC(F)(F)CC2)cc(C(F)(F)F)c1 ZINC001238501249 1055673845 /nfs/dbraw/zinc/67/38/45/1055673845.db2.gz NPRLPTVXJMRDCS-UHFFFAOYSA-N 1 2 323.305 4.335 20 0 DIADLO Cc1cc(C[N@H+]2CCC(=O)C[C@H]2C)ccc1Oc1ccccc1 ZINC001238524776 1055677764 /nfs/dbraw/zinc/67/77/64/1055677764.db2.gz AOBVLCRTWCUXIL-MRXNPFEDSA-N 1 2 309.409 4.341 20 0 DIADLO Cc1cc(C[N@@H+]2CCC(=O)C[C@H]2C)ccc1Oc1ccccc1 ZINC001238524776 1055677774 /nfs/dbraw/zinc/67/77/74/1055677774.db2.gz AOBVLCRTWCUXIL-MRXNPFEDSA-N 1 2 309.409 4.341 20 0 DIADLO Fc1ccc(C[NH+]2CC3(C2)CCCCO3)cc1-c1ccccc1 ZINC001238560502 1055687119 /nfs/dbraw/zinc/68/71/19/1055687119.db2.gz IVUVOAYZCCOXGS-UHFFFAOYSA-N 1 2 311.400 4.248 20 0 DIADLO Cc1ccc(-c2noc(C[N@H+](Cc3ccccc3)C3CC3)n2)cc1 ZINC000043643197 1055703105 /nfs/dbraw/zinc/70/31/05/1055703105.db2.gz YWJCMQYBVHMCKT-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1ccc(-c2noc(C[N@@H+](Cc3ccccc3)C3CC3)n2)cc1 ZINC000043643197 1055703114 /nfs/dbraw/zinc/70/31/14/1055703114.db2.gz YWJCMQYBVHMCKT-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Clc1ccc(-c2cccc(C[N@@H+]3Cc4cccnc4C3)c2)nc1 ZINC001238635889 1055706060 /nfs/dbraw/zinc/70/60/60/1055706060.db2.gz XUMMFIWIZHYPJL-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1ccc(-c2cccc(C[N@H+]3Cc4cccnc4C3)c2)nc1 ZINC001238635889 1055706069 /nfs/dbraw/zinc/70/60/69/1055706069.db2.gz XUMMFIWIZHYPJL-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO FC[C@H]1CCC[N@@H+]1Cc1cc(-c2ccccc2)ncc1Cl ZINC001238635092 1055707312 /nfs/dbraw/zinc/70/73/12/1055707312.db2.gz ZPPLTOMETOWFMQ-OAHLLOKOSA-N 1 2 304.796 4.336 20 0 DIADLO FC[C@H]1CCC[N@H+]1Cc1cc(-c2ccccc2)ncc1Cl ZINC001238635092 1055707321 /nfs/dbraw/zinc/70/73/21/1055707321.db2.gz ZPPLTOMETOWFMQ-OAHLLOKOSA-N 1 2 304.796 4.336 20 0 DIADLO C=Cc1ccc(CNc2cc[nH+]c(OCc3ccccn3)c2)cc1 ZINC001168576212 1055707844 /nfs/dbraw/zinc/70/78/44/1055707844.db2.gz WGSCCVFHOQYVDG-UHFFFAOYSA-N 1 2 317.392 4.311 20 0 DIADLO COC(=O)c1ccoc1C[N@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000044089980 1055708423 /nfs/dbraw/zinc/70/84/23/1055708423.db2.gz RLXXNMKEICPGNG-GFCCVEGCSA-N 1 2 313.353 4.005 20 0 DIADLO COC(=O)c1ccoc1C[N@@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000044089980 1055708434 /nfs/dbraw/zinc/70/84/34/1055708434.db2.gz RLXXNMKEICPGNG-GFCCVEGCSA-N 1 2 313.353 4.005 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@@H+]1CCC[C@H](C(F)(F)F)C1 ZINC001238654596 1055709049 /nfs/dbraw/zinc/70/90/49/1055709049.db2.gz YJHNUKXMQVMGJC-NSHDSACASA-N 1 2 323.305 4.138 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC001238654596 1055709057 /nfs/dbraw/zinc/70/90/57/1055709057.db2.gz YJHNUKXMQVMGJC-NSHDSACASA-N 1 2 323.305 4.138 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC001238652572 1055709651 /nfs/dbraw/zinc/70/96/51/1055709651.db2.gz RXHCZYHQEVAAED-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC001238652572 1055709658 /nfs/dbraw/zinc/70/96/58/1055709658.db2.gz RXHCZYHQEVAAED-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001238661137 1055711077 /nfs/dbraw/zinc/71/10/77/1055711077.db2.gz PEOCEKCUHFAPOG-QGZVFWFLSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC001238661137 1055711089 /nfs/dbraw/zinc/71/10/89/1055711089.db2.gz PEOCEKCUHFAPOG-QGZVFWFLSA-N 1 2 303.352 4.311 20 0 DIADLO C[C@]1(F)CCC[N@H+](Cc2cc(-c3ccccc3)cnc2F)C1 ZINC001238660133 1055711506 /nfs/dbraw/zinc/71/15/06/1055711506.db2.gz ZVDYTZSHTWAVNO-SFHVURJKSA-N 1 2 302.368 4.212 20 0 DIADLO C[C@]1(F)CCC[N@@H+](Cc2cc(-c3ccccc3)cnc2F)C1 ZINC001238660133 1055711509 /nfs/dbraw/zinc/71/15/09/1055711509.db2.gz ZVDYTZSHTWAVNO-SFHVURJKSA-N 1 2 302.368 4.212 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000044736383 1055713345 /nfs/dbraw/zinc/71/33/45/1055713345.db2.gz BHRUAFQHNJVLQI-GOSISDBHSA-N 1 2 317.429 4.121 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000044736383 1055713355 /nfs/dbraw/zinc/71/33/55/1055713355.db2.gz BHRUAFQHNJVLQI-GOSISDBHSA-N 1 2 317.429 4.121 20 0 DIADLO Cc1cc(OC(C)C)cc(C)c1C[N@@H+]1CCC(F)(F)[C@H](F)C1 ZINC001238670930 1055714209 /nfs/dbraw/zinc/71/42/09/1055714209.db2.gz ZKSGFPROWNDEPT-MRXNPFEDSA-N 1 2 315.379 4.270 20 0 DIADLO Cc1cc(OC(C)C)cc(C)c1C[N@H+]1CCC(F)(F)[C@H](F)C1 ZINC001238670930 1055714224 /nfs/dbraw/zinc/71/42/24/1055714224.db2.gz ZKSGFPROWNDEPT-MRXNPFEDSA-N 1 2 315.379 4.270 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nnc(-c2ccco2)o1 ZINC000045007375 1055716232 /nfs/dbraw/zinc/71/62/32/1055716232.db2.gz PENKVZSHAXLLMJ-LLVKDONJSA-N 1 2 317.776 4.176 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nnc(-c2ccco2)o1 ZINC000045007375 1055716244 /nfs/dbraw/zinc/71/62/44/1055716244.db2.gz PENKVZSHAXLLMJ-LLVKDONJSA-N 1 2 317.776 4.176 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nnc(-c2ccco2)o1 ZINC000045007372 1055716283 /nfs/dbraw/zinc/71/62/83/1055716283.db2.gz PENKVZSHAXLLMJ-NSHDSACASA-N 1 2 317.776 4.176 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nnc(-c2ccco2)o1 ZINC000045007372 1055716293 /nfs/dbraw/zinc/71/62/93/1055716293.db2.gz PENKVZSHAXLLMJ-NSHDSACASA-N 1 2 317.776 4.176 20 0 DIADLO CCCCCCc1ccc(C[N@@H+]2CCc3c(ncn3C)C2)s1 ZINC001238703097 1055727054 /nfs/dbraw/zinc/72/70/54/1055727054.db2.gz KUNUBOWLRXRGGM-UHFFFAOYSA-N 1 2 317.502 4.163 20 0 DIADLO CCCCCCc1ccc(C[N@H+]2CCc3c(ncn3C)C2)s1 ZINC001238703097 1055727066 /nfs/dbraw/zinc/72/70/66/1055727066.db2.gz KUNUBOWLRXRGGM-UHFFFAOYSA-N 1 2 317.502 4.163 20 0 DIADLO CCCCCCc1ccc(CN2CCc3c([nH+]cn3C)C2)s1 ZINC001238703097 1055727078 /nfs/dbraw/zinc/72/70/78/1055727078.db2.gz KUNUBOWLRXRGGM-UHFFFAOYSA-N 1 2 317.502 4.163 20 0 DIADLO C[N@@H+](Cc1coc(-c2cccc(F)c2)n1)Cc1cccs1 ZINC000045735362 1055727909 /nfs/dbraw/zinc/72/79/09/1055727909.db2.gz LNWJVRBBCSTYKM-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@H+](Cc1coc(-c2cccc(F)c2)n1)Cc1cccs1 ZINC000045735362 1055727921 /nfs/dbraw/zinc/72/79/21/1055727921.db2.gz LNWJVRBBCSTYKM-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO CCc1sc(C(=O)Nc2ccccc2-n2cc[nH+]c2)cc1C ZINC000045860100 1055729011 /nfs/dbraw/zinc/72/90/11/1055729011.db2.gz MACLIKKRTQIYAO-UHFFFAOYSA-N 1 2 311.410 4.057 20 0 DIADLO CC(C)c1ccc(C[N@@H+]2CCn3cccc3[C@@H]2C)c(Cl)n1 ZINC001238731009 1055737012 /nfs/dbraw/zinc/73/70/12/1055737012.db2.gz KWYHDECLIPOQTA-ZDUSSCGKSA-N 1 2 303.837 4.237 20 0 DIADLO CC(C)c1ccc(C[N@H+]2CCn3cccc3[C@@H]2C)c(Cl)n1 ZINC001238731009 1055737021 /nfs/dbraw/zinc/73/70/21/1055737021.db2.gz KWYHDECLIPOQTA-ZDUSSCGKSA-N 1 2 303.837 4.237 20 0 DIADLO Cc1cc(C[N@H+](C)CCF)c(OCc2ccccc2)cc1C ZINC001238767730 1055745155 /nfs/dbraw/zinc/74/51/55/1055745155.db2.gz ZVJOXVOUJKWKKH-UHFFFAOYSA-N 1 2 301.405 4.284 20 0 DIADLO Cc1cc(C[N@@H+](C)CCF)c(OCc2ccccc2)cc1C ZINC001238767730 1055745167 /nfs/dbraw/zinc/74/51/67/1055745167.db2.gz ZVJOXVOUJKWKKH-UHFFFAOYSA-N 1 2 301.405 4.284 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccncc2)cc1Cl ZINC001238790989 1055751819 /nfs/dbraw/zinc/75/18/19/1055751819.db2.gz SUPHDSHEINZDED-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@H]2c2ccncc2)cc1Cl ZINC001238790989 1055751827 /nfs/dbraw/zinc/75/18/27/1055751827.db2.gz SUPHDSHEINZDED-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)c1ccccc1NC(=O)[C@H]1CCCN(c2cccc[nH+]2)C1 ZINC000047410494 1055755691 /nfs/dbraw/zinc/75/56/91/1055755691.db2.gz PBSGGUKAJNLVGH-INIZCTEOSA-N 1 2 323.440 4.060 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cc3ccccc3[nH]c2=O)c1 ZINC001238882922 1055778437 /nfs/dbraw/zinc/77/84/37/1055778437.db2.gz UAKIUJVRSLJVRP-UHFFFAOYSA-N 1 2 301.349 4.008 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2Cl)nn1C ZINC000282197189 1055792621 /nfs/dbraw/zinc/79/26/21/1055792621.db2.gz NSZZXDARUOOXFH-GHMZBOCLSA-N 1 2 312.244 4.447 20 0 DIADLO COc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1OC(C)C ZINC001238932331 1055795197 /nfs/dbraw/zinc/79/51/97/1055795197.db2.gz NNAREKPOQWFMEH-UHFFFAOYSA-N 1 2 308.381 4.335 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc(Cl)c1F ZINC001238959879 1055804695 /nfs/dbraw/zinc/80/46/95/1055804695.db2.gz KEPHWNZJYRUFJN-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO COc1ccc(C[N@H+](Cc2ncc(C(C)(C)C)o2)C2CC2)cc1 ZINC000058733139 1055814177 /nfs/dbraw/zinc/81/41/77/1055814177.db2.gz HWNGSYLLXQQNBJ-UHFFFAOYSA-N 1 2 314.429 4.145 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ncc(C(C)(C)C)o2)C2CC2)cc1 ZINC000058733139 1055814190 /nfs/dbraw/zinc/81/41/90/1055814190.db2.gz HWNGSYLLXQQNBJ-UHFFFAOYSA-N 1 2 314.429 4.145 20 0 DIADLO Cc1cc(C)c(CNC(=O)[C@@H](C)c2ccc3ccccc3c2)c[nH+]1 ZINC001597402396 1055824965 /nfs/dbraw/zinc/82/49/65/1055824965.db2.gz FAGMQKZOTHDBRI-INIZCTEOSA-N 1 2 318.420 4.272 20 0 DIADLO CCCc1nc(C[N@H+](Cc2ccccc2)C2CCCCC2)no1 ZINC000059993318 1055827015 /nfs/dbraw/zinc/82/70/15/1055827015.db2.gz ZEFYDVBTZLNMCR-UHFFFAOYSA-N 1 2 313.445 4.357 20 0 DIADLO CCCc1nc(C[N@@H+](Cc2ccccc2)C2CCCCC2)no1 ZINC000059993318 1055827018 /nfs/dbraw/zinc/82/70/18/1055827018.db2.gz ZEFYDVBTZLNMCR-UHFFFAOYSA-N 1 2 313.445 4.357 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1nc(C)sc1C ZINC000347568300 1055834045 /nfs/dbraw/zinc/83/40/45/1055834045.db2.gz UYDCCVBLPOYBPX-INIZCTEOSA-N 1 2 304.459 4.352 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1nc(C)sc1C ZINC000347568300 1055834051 /nfs/dbraw/zinc/83/40/51/1055834051.db2.gz UYDCCVBLPOYBPX-INIZCTEOSA-N 1 2 304.459 4.352 20 0 DIADLO Fc1cc(C[NH+]2CCOCC2)ccc1-c1coc2ccccc21 ZINC001239064467 1055837638 /nfs/dbraw/zinc/83/76/38/1055837638.db2.gz KTHPCALFJSJYAA-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2ccc(Cl)c(Cl)c2)c(C)[nH+]1 ZINC001539396722 1055838379 /nfs/dbraw/zinc/83/83/79/1055838379.db2.gz FJHWYCBWTVSDKB-UHFFFAOYSA-N 1 2 323.223 4.244 20 0 DIADLO O=C(N[C@H]1CCC[C@H](c2ccccc2)C1)c1cc2c[nH+]ccc2[nH]1 ZINC001568683582 1055843630 /nfs/dbraw/zinc/84/36/30/1055843630.db2.gz MVLHKOUQZDFEQL-RDJZCZTQSA-N 1 2 319.408 4.019 20 0 DIADLO CC[N@@H+](Cc1cn2c(cccc2C)n1)Cc1ccc(Cl)s1 ZINC000060843514 1055851478 /nfs/dbraw/zinc/85/14/78/1055851478.db2.gz BEKWOHPVXKVYGO-UHFFFAOYSA-N 1 2 319.861 4.380 20 0 DIADLO CC[N@H+](Cc1cn2c(cccc2C)n1)Cc1ccc(Cl)s1 ZINC000060843514 1055851486 /nfs/dbraw/zinc/85/14/86/1055851486.db2.gz BEKWOHPVXKVYGO-UHFFFAOYSA-N 1 2 319.861 4.380 20 0 DIADLO Cc1ccc(-c2ccc(-c3ccc(-n4cc[nH+]c4)cc3)nn2)cc1 ZINC001239479329 1055901114 /nfs/dbraw/zinc/90/11/14/1055901114.db2.gz YZYNDWXVBWBYOQ-UHFFFAOYSA-N 1 2 312.376 4.305 20 0 DIADLO CC(C)c1ccccc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001598072094 1055910156 /nfs/dbraw/zinc/91/01/56/1055910156.db2.gz VOTIAETVFDNVPN-UHFFFAOYSA-N 1 2 305.381 4.452 20 0 DIADLO CCC[C@H]1CCC[C@H]1C(=O)Nc1nc(C[NH+](CC)CC)cs1 ZINC001570869776 1055919511 /nfs/dbraw/zinc/91/95/11/1055919511.db2.gz XXIIXJBTIPOLHP-DZGCQCFKSA-N 1 2 323.506 4.140 20 0 DIADLO CCC[C@H]1CCC[C@@H]1C(=O)Nc1nc(C[NH+](CC)CC)cs1 ZINC001570869779 1055919691 /nfs/dbraw/zinc/91/96/91/1055919691.db2.gz XXIIXJBTIPOLHP-ZFWWWQNUSA-N 1 2 323.506 4.140 20 0 DIADLO CC(C)COC(=O)C[N@@H+]1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC001615518987 1055924297 /nfs/dbraw/zinc/92/42/97/1055924297.db2.gz AUWDJNBWWOOJJQ-KRWDZBQOSA-N 1 2 323.864 4.456 20 0 DIADLO CC(C)COC(=O)C[N@H+]1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC001615518987 1055924306 /nfs/dbraw/zinc/92/43/06/1055924306.db2.gz AUWDJNBWWOOJJQ-KRWDZBQOSA-N 1 2 323.864 4.456 20 0 DIADLO CC(C)n1c(C[NH2+]Cc2ccc(F)cc2F)nc2ccccc21 ZINC001620755544 1055928235 /nfs/dbraw/zinc/92/82/35/1055928235.db2.gz XRRBWRULPRFHTF-UHFFFAOYSA-N 1 2 315.367 4.185 20 0 DIADLO C[C@@H](CC(C)(C)c1ccccc1)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001598262836 1055932376 /nfs/dbraw/zinc/93/23/76/1055932376.db2.gz QJYCMMMNSNDWRY-AWEZNQCLSA-N 1 2 321.424 4.049 20 0 DIADLO CCc1cnc(C[N@H+](C)C[C@H]2CC[C@H](c3ccccc3)O2)s1 ZINC001615743776 1055933305 /nfs/dbraw/zinc/93/33/05/1055933305.db2.gz HBYXFWUJXCCKNQ-NVXWUHKLSA-N 1 2 316.470 4.058 20 0 DIADLO CCc1cnc(C[N@@H+](C)C[C@H]2CC[C@H](c3ccccc3)O2)s1 ZINC001615743776 1055933312 /nfs/dbraw/zinc/93/33/12/1055933312.db2.gz HBYXFWUJXCCKNQ-NVXWUHKLSA-N 1 2 316.470 4.058 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cc(Br)ccc2F)o1 ZINC000065208694 1055940299 /nfs/dbraw/zinc/94/02/99/1055940299.db2.gz PRKYIWDMXLSENK-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cc(Br)ccc2F)o1 ZINC000065208694 1055940305 /nfs/dbraw/zinc/94/03/05/1055940305.db2.gz PRKYIWDMXLSENK-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1nc(C[N@H+](C)CCOc2ccc3ccccc3c2)cs1 ZINC000065300688 1055942852 /nfs/dbraw/zinc/94/28/52/1055942852.db2.gz LEVYGWHSSGYASP-UHFFFAOYSA-N 1 2 312.438 4.116 20 0 DIADLO Cc1nc(C[N@@H+](C)CCOc2ccc3ccccc3c2)cs1 ZINC000065300688 1055942868 /nfs/dbraw/zinc/94/28/68/1055942868.db2.gz LEVYGWHSSGYASP-UHFFFAOYSA-N 1 2 312.438 4.116 20 0 DIADLO CC(C)c1cc(N2CC[C@H](c3ccncc3)C2)nc(C(C)C)[nH+]1 ZINC000624358640 1055946870 /nfs/dbraw/zinc/94/68/70/1055946870.db2.gz PPQCCOYMZVWBNR-INIZCTEOSA-N 1 2 310.445 4.112 20 0 DIADLO O=C(Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1ccsc1 ZINC001539989625 1055948589 /nfs/dbraw/zinc/94/85/89/1055948589.db2.gz GXBAHCGQMZDYIU-UHFFFAOYSA-N 1 2 324.405 4.167 20 0 DIADLO Fc1ccc(C([NH2+]Cc2cnsc2)c2ccc(F)cc2)cc1 ZINC001620783133 1055952907 /nfs/dbraw/zinc/95/29/07/1055952907.db2.gz XDXRFMXXTMWYTF-UHFFFAOYSA-N 1 2 316.376 4.301 20 0 DIADLO c1csc(C[N@H+](Cc2cc[nH]n2)Cc2ccc3[nH]ccc3c2)c1 ZINC001620468061 1055955301 /nfs/dbraw/zinc/95/53/01/1055955301.db2.gz SWWQFIDMWWINIM-UHFFFAOYSA-N 1 2 322.437 4.155 20 0 DIADLO c1csc(C[N@@H+](Cc2cc[nH]n2)Cc2ccc3[nH]ccc3c2)c1 ZINC001620468061 1055955313 /nfs/dbraw/zinc/95/53/13/1055955313.db2.gz SWWQFIDMWWINIM-UHFFFAOYSA-N 1 2 322.437 4.155 20 0 DIADLO Cc1cc(CNc2cc3cc[nH]c3c[nH+]2)c(OC(F)F)cc1C ZINC001620988118 1055961930 /nfs/dbraw/zinc/96/19/30/1055961930.db2.gz KPGYWZNBTFKXKF-UHFFFAOYSA-N 1 2 317.339 4.393 20 0 DIADLO COc1cccc(CN2CCC[C@@H]2c2[nH]c(C)c(C)[nH+]2)c1Cl ZINC001620574204 1055969859 /nfs/dbraw/zinc/96/98/59/1055969859.db2.gz KCBQBVPWXDYODR-CQSZACIVSA-N 1 2 319.836 4.026 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(C(C)(C)C)cc3)nn2)c1C ZINC001239606757 1055974916 /nfs/dbraw/zinc/97/49/16/1055974916.db2.gz ZMNBFVJUDKIURQ-UHFFFAOYSA-N 1 2 306.413 4.244 20 0 DIADLO CCCn1nccc1CNc1ccc(Nc2ccccc2)c[nH+]1 ZINC001621012921 1055978473 /nfs/dbraw/zinc/97/84/73/1055978473.db2.gz KECHLAURLKRTRA-UHFFFAOYSA-N 1 2 307.401 4.044 20 0 DIADLO c1ccc2c(c1)cccc2[C@H]1CCC[N@H+]1Cc1noc(C2CC2)n1 ZINC000066468789 1055979442 /nfs/dbraw/zinc/97/94/42/1055979442.db2.gz XNHKZFKKLGYPFJ-GOSISDBHSA-N 1 2 319.408 4.437 20 0 DIADLO c1ccc2c(c1)cccc2[C@H]1CCC[N@@H+]1Cc1noc(C2CC2)n1 ZINC000066468789 1055979450 /nfs/dbraw/zinc/97/94/50/1055979450.db2.gz XNHKZFKKLGYPFJ-GOSISDBHSA-N 1 2 319.408 4.437 20 0 DIADLO Cc1ccccc1C(F)(F)C[NH2+]Cc1cccc2cccnc21 ZINC001621018639 1055985059 /nfs/dbraw/zinc/98/50/59/1055985059.db2.gz FNMLIKNBKJZLMC-UHFFFAOYSA-N 1 2 312.363 4.425 20 0 DIADLO Fc1ccc2nc(C[NH2+]Cc3cccc(F)c3F)sc2c1 ZINC001621024414 1055991503 /nfs/dbraw/zinc/99/15/03/1055991503.db2.gz WRJWUNPGBOMUID-UHFFFAOYSA-N 1 2 308.328 4.003 20 0 DIADLO FC[C@@H]([NH2+]Cc1cc(F)c(F)c(F)c1)c1ccc(F)cc1 ZINC001621040370 1055999889 /nfs/dbraw/zinc/99/98/89/1055999889.db2.gz UJCMMNQLUJNGLX-CQSZACIVSA-N 1 2 301.258 4.043 20 0 DIADLO COc1ccc(C[NH2+][C@@H]2c3ccccc3CC[C@@H]2F)c(Cl)c1 ZINC001621043368 1056004180 /nfs/dbraw/zinc/00/41/80/1056004180.db2.gz DENNTHWHBQCJAZ-ZWKOTPCHSA-N 1 2 319.807 4.464 20 0 DIADLO CCSCc1ccc[nH+]c1N[C@H]1CCc2cccnc2CC1 ZINC001621043361 1056005125 /nfs/dbraw/zinc/00/51/25/1056005125.db2.gz DDWAIYHIJLIMCM-INIZCTEOSA-N 1 2 313.470 4.089 20 0 DIADLO CN(Cc1ccccc1)c1ccc(-c2ccn3cc[nH+]c3c2)cn1 ZINC001239660021 1056008525 /nfs/dbraw/zinc/00/85/25/1056008525.db2.gz FPZUVNNESBAALO-UHFFFAOYSA-N 1 2 314.392 4.033 20 0 DIADLO COc1cccc(OC(F)(F)F)c1C[NH2+][C@H](C)c1ccco1 ZINC000671769182 1056010444 /nfs/dbraw/zinc/01/04/44/1056010444.db2.gz KDCJLJBWONULQV-SNVBAGLBSA-N 1 2 315.291 4.038 20 0 DIADLO CCOc1ccc(CNc2[nH]c3ccc(Cl)cc3[nH+]2)cc1F ZINC001621057218 1056014493 /nfs/dbraw/zinc/01/44/93/1056014493.db2.gz VNGBDKVEOKIRGN-UHFFFAOYSA-N 1 2 319.767 4.366 20 0 DIADLO Clc1ccc2[nH]c(NCc3scnc3C3CC3)[nH+]c2c1 ZINC001621056903 1056015032 /nfs/dbraw/zinc/01/50/32/1056015032.db2.gz JGJSGBBNQMEFCE-UHFFFAOYSA-N 1 2 304.806 4.162 20 0 DIADLO Clc1ccc2[nH+]c(NCc3scnc3C3CC3)[nH]c2c1 ZINC001621056903 1056015038 /nfs/dbraw/zinc/01/50/38/1056015038.db2.gz JGJSGBBNQMEFCE-UHFFFAOYSA-N 1 2 304.806 4.162 20 0 DIADLO CC(C)CCc1noc(C[NH2+]C(C)(C)c2ccc(Cl)cc2)n1 ZINC000072603318 1056029848 /nfs/dbraw/zinc/02/98/48/1056029848.db2.gz ODKJSDXXUOLVDI-UHFFFAOYSA-N 1 2 321.852 4.337 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000072575193 1056030911 /nfs/dbraw/zinc/03/09/11/1056030911.db2.gz FOVVFMFPPPANPF-DLBZAZTESA-N 1 2 317.477 4.112 20 0 DIADLO CCC[C@H](NC(=O)[C@H](CC(C)C)n1cc[nH+]c1)c1ccccc1 ZINC001540587325 1056048114 /nfs/dbraw/zinc/04/81/14/1056048114.db2.gz GABPVTNGFFKGMQ-ROUUACIJSA-N 1 2 313.445 4.128 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc(-c3ccc(C)cc3)no2)no1 ZINC000073872440 1056049155 /nfs/dbraw/zinc/04/91/55/1056049155.db2.gz GTSHIZNEOYZNLP-IBGZPJMESA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc(-c3ccc(C)cc3)no2)no1 ZINC000073872440 1056049160 /nfs/dbraw/zinc/04/91/60/1056049160.db2.gz GTSHIZNEOYZNLP-IBGZPJMESA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cn2c(cccc2-c2cncc(Oc3ccccc3)c2)[nH+]1 ZINC001239752953 1056058347 /nfs/dbraw/zinc/05/83/47/1056058347.db2.gz VTHYVCLFTQPEHC-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CCCC[C@H]3C)c2)[nH+]c1C ZINC001583354570 1056069984 /nfs/dbraw/zinc/06/99/84/1056069984.db2.gz GAIZPNSMDBZJFK-SJKOYZFVSA-N 1 2 311.429 4.458 20 0 DIADLO CCCCC1(C(=O)Nc2nc(C[NH+]3CCCCC3)cs2)CC1 ZINC001542203766 1056110795 /nfs/dbraw/zinc/11/07/95/1056110795.db2.gz SCYWXUVHLQYNSZ-UHFFFAOYSA-N 1 2 321.490 4.038 20 0 DIADLO Cc1ccc(-c2ccc(C)cc2C[NH+]2CCOCC2)c(Cl)c1 ZINC001239862975 1056113787 /nfs/dbraw/zinc/11/37/87/1056113787.db2.gz BSERWNDVGPZSRY-UHFFFAOYSA-N 1 2 315.844 4.456 20 0 DIADLO CC(C)CC(CC(C)C)C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC001542298237 1056115686 /nfs/dbraw/zinc/11/56/86/1056115686.db2.gz VWDPYZPJOSTFOC-QGZVFWFLSA-N 1 2 321.509 4.122 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@H]2CCOc3ccc(F)cc32)n1 ZINC000765803684 1056121055 /nfs/dbraw/zinc/12/10/55/1056121055.db2.gz OZWKBCHGNMFIBE-ZDUSSCGKSA-N 1 2 320.433 4.193 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(C(F)F)cc1 ZINC000338669642 1056152710 /nfs/dbraw/zinc/15/27/10/1056152710.db2.gz TZJQBUIISJPHIH-UHFFFAOYSA-N 1 2 313.307 4.267 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3c[nH]cc3C3CC3)cc2)[nH+]c1C ZINC000921667110 1056178260 /nfs/dbraw/zinc/17/82/60/1056178260.db2.gz ASPXEJSXFZRJNT-UHFFFAOYSA-N 1 2 320.396 4.151 20 0 DIADLO Cc1nc(N(C)Cc2ccc(C(C)C)cc2)c2c([nH+]1)CCCC2 ZINC001611774065 1056188501 /nfs/dbraw/zinc/18/85/01/1056188501.db2.gz RCSHNDHDQMSFSP-UHFFFAOYSA-N 1 2 309.457 4.424 20 0 DIADLO COc1cccc(CSc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001611872672 1056201176 /nfs/dbraw/zinc/20/11/76/1056201176.db2.gz NNCUOGGLZPGOAX-UHFFFAOYSA-N 1 2 321.405 4.183 20 0 DIADLO CNc1ccc(Nc2cc(C(F)(F)F)cc3ncccc32)c[nH+]1 ZINC001203462484 1056211264 /nfs/dbraw/zinc/21/12/64/1056211264.db2.gz UMHBGSJDFPZUOK-UHFFFAOYSA-N 1 2 318.302 4.434 20 0 DIADLO CC(C)Oc1cccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)c1 ZINC001239971950 1056211569 /nfs/dbraw/zinc/21/15/69/1056211569.db2.gz LOUOAIHDMGTCOV-UHFFFAOYSA-N 1 2 305.368 4.481 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)o1 ZINC000765820145 1056211906 /nfs/dbraw/zinc/21/19/06/1056211906.db2.gz SVAGZIUPLHWKMH-XJKSGUPXSA-N 1 2 301.434 4.348 20 0 DIADLO CCc1ccc(N(CC)C(=O)[C@H](CC(C)C)n2cc[nH+]c2)cc1 ZINC001543400726 1056214986 /nfs/dbraw/zinc/21/49/86/1056214986.db2.gz RESSNINSJDJNHI-SFHVURJKSA-N 1 2 313.445 4.086 20 0 DIADLO Fc1ccc(C2CC2)cc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000623991293 1056216162 /nfs/dbraw/zinc/21/61/62/1056216162.db2.gz CVJARSCMTVMPCG-OAHLLOKOSA-N 1 2 302.418 4.327 20 0 DIADLO CC[C@@H]1c2ccccc2CCN1c1nc(C)[nH+]c2c1CCCC2 ZINC001611987038 1056219520 /nfs/dbraw/zinc/21/95/20/1056219520.db2.gz KXQNHEOLRLGPHK-LJQANCHMSA-N 1 2 307.441 4.178 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)NCc1[nH+]cc(C)c(OC)c1C ZINC001583975686 1056226714 /nfs/dbraw/zinc/22/67/14/1056226714.db2.gz BFHJJQWWTIHUNP-LJQANCHMSA-N 1 2 320.477 4.320 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2CCC(C)(C)C[C@@H]2c2ccccc2)cc[nH+]1 ZINC001584005461 1056234642 /nfs/dbraw/zinc/23/46/42/1056234642.db2.gz UHSXLGSDOLGBAL-RTBURBONSA-N 1 2 322.452 4.361 20 0 DIADLO CCOc1cc(Cl)ccc1CNc1cc(CC)[nH+]c(CC)n1 ZINC001612167431 1056247166 /nfs/dbraw/zinc/24/71/66/1056247166.db2.gz HCCHFJBZHTWDBD-UHFFFAOYSA-N 1 2 319.836 4.266 20 0 DIADLO Cc1nc(N[C@@H]2C[C@H]2C2CCCCC2)c(Br)c(C)[nH+]1 ZINC001612314492 1056271104 /nfs/dbraw/zinc/27/11/04/1056271104.db2.gz ZYYVCJRXCDRUEQ-QWHCGFSZSA-N 1 2 324.266 4.237 20 0 DIADLO Cc1ccc(-c2ccc(C(=O)Nc3c(C)c[nH+]cc3C)s2)o1 ZINC001584257454 1056300020 /nfs/dbraw/zinc/30/00/20/1056300020.db2.gz SIVAQLMHYYSRNT-UHFFFAOYSA-N 1 2 312.394 4.003 20 0 DIADLO CCc1nc(N2CCC[C@@]2(C)Cc2cccc(F)c2)cc(C)[nH+]1 ZINC001612519091 1056300598 /nfs/dbraw/zinc/30/05/98/1056300598.db2.gz HGBIPVXLYLEVQJ-IBGZPJMESA-N 1 2 313.420 4.088 20 0 DIADLO Cc1c2ccc(F)cc2sc1C(=O)Nc1c(C)c[nH+]cc1C ZINC001584257086 1056300556 /nfs/dbraw/zinc/30/05/56/1056300556.db2.gz OAFZOADTXPPLLG-UHFFFAOYSA-N 1 2 314.385 4.035 20 0 DIADLO CCCCNC(=O)c1cccc(-c2cccc(C(=[NH2+])OCC)c2)c1 ZINC001240087321 1056314172 /nfs/dbraw/zinc/31/41/72/1056314172.db2.gz GXFWFTCKQZMSCE-UHFFFAOYSA-N 1 2 324.424 4.245 20 0 DIADLO COc1cccc2[nH+]c(N[C@@H]3CCNc4ccccc43)ccc21 ZINC001168640279 1056314323 /nfs/dbraw/zinc/31/43/23/1056314323.db2.gz YGVXFKMCDWYQNA-QGZVFWFLSA-N 1 2 305.381 4.212 20 0 DIADLO Cc1cc(N[C@@H]2C[C@H]2c2ccc(F)cc2F)nc(C2CCC2)[nH+]1 ZINC001612691435 1056319015 /nfs/dbraw/zinc/31/90/15/1056319015.db2.gz JSUAQXJWYJCTAG-GOEBONIOSA-N 1 2 315.367 4.299 20 0 DIADLO CNc1cc(-c2cccc(C(=O)Nc3ccccc3)c2)cc[nH+]1 ZINC001240113598 1056334923 /nfs/dbraw/zinc/33/49/23/1056334923.db2.gz DPXZMVGRGVCZQX-UHFFFAOYSA-N 1 2 303.365 4.043 20 0 DIADLO CC(C)c1cc(NC[C@@H]2CCC3(CCC3)CO2)nc(C(C)C)[nH+]1 ZINC001612907956 1056338396 /nfs/dbraw/zinc/33/83/96/1056338396.db2.gz FPXLKUIHCIUXPR-HNNXBMFYSA-N 1 2 317.477 4.485 20 0 DIADLO CC(C)c1cc(N[C@@H](CCO)C2CCCC2)nc(C(C)C)[nH+]1 ZINC001612983990 1056341983 /nfs/dbraw/zinc/34/19/83/1056341983.db2.gz SRTDJGKNOVFJQV-HNNXBMFYSA-N 1 2 305.466 4.077 20 0 DIADLO c1ccc2c(c1)NCC[C@H]2Nc1cccc(Cc2ccncc2)[nH+]1 ZINC001168645885 1056344345 /nfs/dbraw/zinc/34/43/45/1056344345.db2.gz NJSRTCUNFYKCFN-LJQANCHMSA-N 1 2 316.408 4.036 20 0 DIADLO CCc1cc(N2C[C@@H](c3ccccc3)CC2(C)C)nc(CC)[nH+]1 ZINC001613005229 1056345531 /nfs/dbraw/zinc/34/55/31/1056345531.db2.gz VHMMXGLMXCXNKV-INIZCTEOSA-N 1 2 309.457 4.374 20 0 DIADLO CN(C)c1cc(-c2ccc(C(=O)c3ccccc3)cc2)cc[nH+]1 ZINC001240136292 1056348603 /nfs/dbraw/zinc/34/86/03/1056348603.db2.gz GGUHQRFGPLCQBO-UHFFFAOYSA-N 1 2 302.377 4.046 20 0 DIADLO CCc1cc(N2CCc3cc(C(C)C)ccc3C2)nc(CC)[nH+]1 ZINC001613083067 1056349996 /nfs/dbraw/zinc/34/99/96/1056349996.db2.gz VXGGHBKRAHAQRS-UHFFFAOYSA-N 1 2 309.457 4.288 20 0 DIADLO CCCCn1c(SC[C@@H]2C[C@H]2CC)nnc1[C@@H](CC)[NH+](C)C ZINC001613148740 1056351297 /nfs/dbraw/zinc/35/12/97/1056351297.db2.gz RWABZMKUAXVEMX-QLFBSQMISA-N 1 2 324.538 4.229 20 0 DIADLO Cc1cc(NC(=O)c2ccc(C#Cc3ccccc3)cc2)cc[nH+]1 ZINC000011683159 1056365789 /nfs/dbraw/zinc/36/57/89/1056365789.db2.gz CGLOMNHWFCFXBM-UHFFFAOYSA-N 1 2 312.372 4.042 20 0 DIADLO Cc1ncsc1C[N@@H+](C)[C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000172582721 1056366123 /nfs/dbraw/zinc/36/61/23/1056366123.db2.gz SDZSJDJXVZGJIV-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ncsc1C[N@H+](C)[C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000172582721 1056366143 /nfs/dbraw/zinc/36/61/43/1056366143.db2.gz SDZSJDJXVZGJIV-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ncsc1C[N@@H+](C)[C@H](C)c1ncc(-c2ccccc2)o1 ZINC000172582723 1056366954 /nfs/dbraw/zinc/36/69/54/1056366954.db2.gz SDZSJDJXVZGJIV-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ncsc1C[N@H+](C)[C@H](C)c1ncc(-c2ccccc2)o1 ZINC000172582723 1056366968 /nfs/dbraw/zinc/36/69/68/1056366968.db2.gz SDZSJDJXVZGJIV-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO c1cnc2c(c1)CCC[C@H]2Nc1cc(-c2ccncc2)cc[nH+]1 ZINC001168651863 1056368723 /nfs/dbraw/zinc/36/87/23/1056368723.db2.gz UYNXKZYWGFTKPN-QGZVFWFLSA-N 1 2 302.381 4.028 20 0 DIADLO c1cnc2c(c1)CCC[C@@H]2Nc1cc(-c2ccncc2)cc[nH+]1 ZINC001168651861 1056369023 /nfs/dbraw/zinc/36/90/23/1056369023.db2.gz UYNXKZYWGFTKPN-KRWDZBQOSA-N 1 2 302.381 4.028 20 0 DIADLO c1coc(-c2csc3ncnc(-c4ccc5[nH+]ccn5c4)c23)c1 ZINC001240216358 1056374268 /nfs/dbraw/zinc/37/42/68/1056374268.db2.gz GEAOIDOXAJGNML-UHFFFAOYSA-N 1 2 318.361 4.266 20 0 DIADLO Fc1ccc(COc2cccnc2-c2ccc3[nH+]ccn3c2)cc1 ZINC001240217491 1056374657 /nfs/dbraw/zinc/37/46/57/1056374657.db2.gz PAMFTVBXQKICGZ-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO COc1ccc(-c2cncc(-c3ccc4[nH+]ccn4c3)c2)cc1 ZINC001240219158 1056375191 /nfs/dbraw/zinc/37/51/91/1056375191.db2.gz CQUCLTJJYRFBSC-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO FC(F)(F)c1cnc(-c2ccc3[nH+]ccn3c2)c(C2CC2)c1 ZINC001240217258 1056375564 /nfs/dbraw/zinc/37/55/64/1056375564.db2.gz JMYICZGAUOVWBP-UHFFFAOYSA-N 1 2 303.287 4.293 20 0 DIADLO c1cn2cc(-c3ccnc(CSc4ccccc4)n3)ccc2[nH+]1 ZINC001240217735 1056375937 /nfs/dbraw/zinc/37/59/37/1056375937.db2.gz UUWDCQVGVLKJHC-UHFFFAOYSA-N 1 2 318.405 4.084 20 0 DIADLO Cc1cc(C(=O)OC(C)(C)C)ccc1-c1ccc2[nH+]ccn2c1 ZINC001240218480 1056376323 /nfs/dbraw/zinc/37/63/23/1056376323.db2.gz DYVZEUUCMQROIF-UHFFFAOYSA-N 1 2 308.381 4.265 20 0 DIADLO Fc1ccccc1COc1cccnc1-c1ccc2[nH+]ccn2c1 ZINC001240217843 1056376633 /nfs/dbraw/zinc/37/66/33/1056376633.db2.gz XULWLOWYCZJSGG-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO c1cn2cc(-c3ncnc4sc5ccccc5c43)ccc2[nH+]1 ZINC001240217857 1056377175 /nfs/dbraw/zinc/37/71/75/1056377175.db2.gz YTXWHLKBTBMBNI-UHFFFAOYSA-N 1 2 302.362 4.159 20 0 DIADLO Fc1cccc(COc2cc(-c3ccc4[nH+]ccn4c3)ccn2)c1 ZINC001240221981 1056378935 /nfs/dbraw/zinc/37/89/35/1056378935.db2.gz RUUNAGYTXJTMNL-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N3CC[C@H](C)c4cccc(C)c43)ccn12 ZINC001544328932 1056408301 /nfs/dbraw/zinc/40/83/01/1056408301.db2.gz BZMLGROYMNBOPS-ZDUSSCGKSA-N 1 2 319.408 4.105 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2cc3ccccc3s2)c(C)[nH+]1 ZINC001544422339 1056428165 /nfs/dbraw/zinc/42/81/65/1056428165.db2.gz IOEVPCWYIFBBPR-UHFFFAOYSA-N 1 2 310.422 4.152 20 0 DIADLO Nc1ccc(Cl)cc1Nc1[nH+]cccc1N1CCCCC1 ZINC001212433629 1056447028 /nfs/dbraw/zinc/44/70/28/1056447028.db2.gz BCNXZJGVIKCKOC-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)cc1C ZINC001614763966 1056449615 /nfs/dbraw/zinc/44/96/15/1056449615.db2.gz OGSSVPHUYCEWFX-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO Cc1cc(NC(=O)C2C[C@H](C)C[C@@H](C)C2)ccc1-n1cc[nH+]c1 ZINC001614884216 1056456146 /nfs/dbraw/zinc/45/61/46/1056456146.db2.gz QIISMCFROGHEFR-ZIAGYGMSSA-N 1 2 311.429 4.192 20 0 DIADLO Cc1cc(C)c(CNC(=O)CCc2ccc(C(C)(C)C)cc2)c[nH+]1 ZINC001585012225 1056463831 /nfs/dbraw/zinc/46/38/31/1056463831.db2.gz UKTGLXLXSRNUCY-UHFFFAOYSA-N 1 2 324.468 4.245 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2ccncc2Br)cc1 ZINC001615175361 1056472677 /nfs/dbraw/zinc/47/26/77/1056472677.db2.gz FEQXWGNCYUHEEH-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2ccncc2Br)cc1 ZINC001615175361 1056472681 /nfs/dbraw/zinc/47/26/81/1056472681.db2.gz FEQXWGNCYUHEEH-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cc(C)cnc1Cl)c1nc(C)cs1 ZINC000921782994 1056487316 /nfs/dbraw/zinc/48/73/16/1056487316.db2.gz WHYQFKGUHJTLMA-OAHLLOKOSA-N 1 2 309.866 4.223 20 0 DIADLO CC1(C)CC[NH+](Cc2noc(-c3c(F)cccc3Cl)n2)CC1 ZINC001615387278 1056500344 /nfs/dbraw/zinc/50/03/44/1056500344.db2.gz CAPYPANISMVTHM-UHFFFAOYSA-N 1 2 323.799 4.151 20 0 DIADLO Cc1cc(-c2cc(C[NH+]3CCOCC3)ccc2F)c(C)s1 ZINC001240431903 1056504335 /nfs/dbraw/zinc/50/43/35/1056504335.db2.gz SNJZUOPNXYNQBB-UHFFFAOYSA-N 1 2 305.418 4.003 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1cccc(-n2cccn2)c1 ZINC000921807064 1056506221 /nfs/dbraw/zinc/50/62/21/1056506221.db2.gz MEZUCRXSFOGMHN-AWEZNQCLSA-N 1 2 324.428 4.009 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1cccc(-n2cccn2)c1 ZINC000921807066 1056507103 /nfs/dbraw/zinc/50/71/03/1056507103.db2.gz MEZUCRXSFOGMHN-CQSZACIVSA-N 1 2 324.428 4.009 20 0 DIADLO COC(=[NH2+])c1cccc(-c2ccc(C(=O)OC(C)(C)C)cc2)c1 ZINC001240440852 1056512124 /nfs/dbraw/zinc/51/21/24/1056512124.db2.gz VMPRSSMGBYPUFL-UHFFFAOYSA-N 1 2 311.381 4.281 20 0 DIADLO C[C@@H]1Cc2ccccc2N(Cc2ccc(-n3cc[nH+]c3)cc2)C1 ZINC001615458121 1056512992 /nfs/dbraw/zinc/51/29/92/1056512992.db2.gz QOYUOAKNLZDNDH-MRXNPFEDSA-N 1 2 303.409 4.071 20 0 DIADLO COc1ccc2c(c1)[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)CCC2 ZINC000921816390 1056513672 /nfs/dbraw/zinc/51/36/72/1056513672.db2.gz AGVSRKFGVUBECF-MRXNPFEDSA-N 1 2 314.429 4.148 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1ccc(Br)s1)C2 ZINC001615466146 1056514126 /nfs/dbraw/zinc/51/41/26/1056514126.db2.gz RAMJCUYRKYVSFP-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1ccc(Br)s1)C2 ZINC001615466146 1056514135 /nfs/dbraw/zinc/51/41/35/1056514135.db2.gz RAMJCUYRKYVSFP-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc(C(=O)OC(C)(C)C)cc1 ZINC001240441436 1056514603 /nfs/dbraw/zinc/51/46/03/1056514603.db2.gz ZOURXRONMXKXHQ-UHFFFAOYSA-N 1 2 324.380 4.194 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@H](CC)CC1 ZINC001615496972 1056519910 /nfs/dbraw/zinc/51/99/10/1056519910.db2.gz QBUJTFDCWDBSHV-WMLDXEAASA-N 1 2 323.864 4.456 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H](CC)CC1 ZINC001615496972 1056519919 /nfs/dbraw/zinc/51/99/19/1056519919.db2.gz QBUJTFDCWDBSHV-WMLDXEAASA-N 1 2 323.864 4.456 20 0 DIADLO COc1cc(-c2ccc(C)c(N)[nH+]2)ccc1OCc1ccccc1 ZINC001240471384 1056526550 /nfs/dbraw/zinc/52/65/50/1056526550.db2.gz DHPOISKHTWYJQT-UHFFFAOYSA-N 1 2 320.392 4.227 20 0 DIADLO CC(C)OCCCNc1[nH+]cccc1OCc1ccccc1F ZINC001168677747 1056527873 /nfs/dbraw/zinc/52/78/73/1056527873.db2.gz VAFCYNSHRVEREA-UHFFFAOYSA-N 1 2 318.392 4.027 20 0 DIADLO CNc1cc(-c2ccc(OCc3ccccc3)c(OC)c2)cc[nH+]1 ZINC001240473210 1056530740 /nfs/dbraw/zinc/53/07/40/1056530740.db2.gz CPSXPCLKLGZKNJ-UHFFFAOYSA-N 1 2 320.392 4.378 20 0 DIADLO Cc1cccc(Sc2cncc(-c3ccn4cc[nH+]c4c3)n2)c1 ZINC001240496526 1056538494 /nfs/dbraw/zinc/53/84/94/1056538494.db2.gz FFSXDAIDTKYODH-UHFFFAOYSA-N 1 2 318.405 4.251 20 0 DIADLO C[C@H]1CCc2c(sc3ncnc(-c4ccn5cc[nH+]c5c4)c23)C1 ZINC001240496701 1056538917 /nfs/dbraw/zinc/53/89/17/1056538917.db2.gz QTYKSQGNJHRLBG-NSHDSACASA-N 1 2 320.421 4.131 20 0 DIADLO CC(C)CCC[C@H](C)N(CCC(C)C)C(=O)Cc1[nH]cc[nH+]1 ZINC001544979086 1056540794 /nfs/dbraw/zinc/54/07/94/1056540794.db2.gz KJOIRTNUJMBGJU-INIZCTEOSA-N 1 2 307.482 4.042 20 0 DIADLO c1cn2ccc(-c3cncc(SCc4ccccc4)n3)cc2[nH+]1 ZINC001240503860 1056540881 /nfs/dbraw/zinc/54/08/81/1056540881.db2.gz HGXMGWORKRFTEJ-UHFFFAOYSA-N 1 2 318.405 4.084 20 0 DIADLO Cc1nc2sc3c(c2c(-c2ccn4cc[nH+]c4c2)n1)CCCC3 ZINC001240504274 1056541873 /nfs/dbraw/zinc/54/18/73/1056541873.db2.gz MBXUYNHWWBVSQM-UHFFFAOYSA-N 1 2 320.421 4.193 20 0 DIADLO COc1ccc(-c2ccccn2)cc1-c1ccn2cc[nH+]c2c1 ZINC001240510469 1056543719 /nfs/dbraw/zinc/54/37/19/1056543719.db2.gz LIJMBPGYHXPQQZ-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO COc1ccc(-c2ccncc2)cc1-c1ccn2cc[nH+]c2c1 ZINC001240509319 1056544519 /nfs/dbraw/zinc/54/45/19/1056544519.db2.gz VYKBQNINJDZCKV-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO c1cn2ccc(-c3ccc4nc(-c5ccccc5)cn4c3)cc2[nH+]1 ZINC001240513626 1056546081 /nfs/dbraw/zinc/54/60/81/1056546081.db2.gz WVVLZHYAYFTENB-UHFFFAOYSA-N 1 2 310.360 4.316 20 0 DIADLO COc1cc(-c2ccn3cc[nH+]c3c2)c(OC)c2ccccc12 ZINC001240513677 1056546508 /nfs/dbraw/zinc/54/65/08/1056546508.db2.gz ZCFZGSDKAPNZQY-UHFFFAOYSA-N 1 2 304.349 4.172 20 0 DIADLO CCOC(=O)[C@@H](CC)c1ccc(-c2ccn3cc[nH+]c3c2)cc1 ZINC001240512313 1056547356 /nfs/dbraw/zinc/54/73/56/1056547356.db2.gz TZSSCBQHOOKCRP-KRWDZBQOSA-N 1 2 308.381 4.058 20 0 DIADLO O=C(c1ccc(F)cc1)[C@@H]1CCC[N@H+](CC=C(Cl)Cl)C1 ZINC001615629543 1056547819 /nfs/dbraw/zinc/54/78/19/1056547819.db2.gz GHEHJQPPPOFKRH-GFCCVEGCSA-N 1 2 316.203 4.039 20 0 DIADLO O=C(c1ccc(F)cc1)[C@@H]1CCC[N@@H+](CC=C(Cl)Cl)C1 ZINC001615629543 1056547832 /nfs/dbraw/zinc/54/78/32/1056547832.db2.gz GHEHJQPPPOFKRH-GFCCVEGCSA-N 1 2 316.203 4.039 20 0 DIADLO Fc1ccc(-c2cccc(N3CCCC3)c2)cc1-n1cc[nH+]c1 ZINC001240537464 1056560885 /nfs/dbraw/zinc/56/08/85/1056560885.db2.gz HSQHHTCNQDXESR-UHFFFAOYSA-N 1 2 307.372 4.279 20 0 DIADLO c1cn(Cc2ccccc2-c2cccc(N3CCCC3)c2)c[nH+]1 ZINC001240539544 1056563615 /nfs/dbraw/zinc/56/36/15/1056563615.db2.gz TUIADWSDEBTGQX-UHFFFAOYSA-N 1 2 303.409 4.199 20 0 DIADLO c1cc2cc(NCc3cccc(OC4CCCC4)c3)[nH+]cc2[nH]1 ZINC000672200585 1056564489 /nfs/dbraw/zinc/56/44/89/1056564489.db2.gz MWCDOWVTQOGYRW-UHFFFAOYSA-N 1 2 307.397 4.496 20 0 DIADLO FC(F)Oc1ccc(Cl)cc1CNc1cc2cc[nH]c2c[nH+]1 ZINC000672228577 1056573865 /nfs/dbraw/zinc/57/38/65/1056573865.db2.gz PFQDHQSGUHIABY-UHFFFAOYSA-N 1 2 323.730 4.430 20 0 DIADLO Fc1ccc(F)c(C[N@H+](Cc2ccncc2F)C2CCCC2)c1 ZINC001615804131 1056579427 /nfs/dbraw/zinc/57/94/27/1056579427.db2.gz BFPJDOQDUNRJFJ-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO Fc1ccc(F)c(C[N@@H+](Cc2ccncc2F)C2CCCC2)c1 ZINC001615804131 1056579440 /nfs/dbraw/zinc/57/94/40/1056579440.db2.gz BFPJDOQDUNRJFJ-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO COc1cc(Nc2cc(F)c(OC(F)F)c(F)c2)cc(C)[nH+]1 ZINC001212446425 1056581258 /nfs/dbraw/zinc/58/12/58/1056581258.db2.gz BATKICTWGHXQEU-UHFFFAOYSA-N 1 2 316.254 4.022 20 0 DIADLO Cc1cc(F)cc(-c2ncnc3c2C[N@H+](Cc2ccccc2)C3)c1 ZINC001240593257 1056601376 /nfs/dbraw/zinc/60/13/76/1056601376.db2.gz PRBLEBPXEXKUSA-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO Cc1cc(F)cc(-c2ncnc3c2C[N@@H+](Cc2ccccc2)C3)c1 ZINC001240593257 1056601379 /nfs/dbraw/zinc/60/13/79/1056601379.db2.gz PRBLEBPXEXKUSA-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO O=C(C[C@H]1CCC[N@H+]1CC=C(Cl)Cl)c1cccs1 ZINC001615995541 1056604211 /nfs/dbraw/zinc/60/42/11/1056604211.db2.gz URVMUQSWLPJAMH-SNVBAGLBSA-N 1 2 304.242 4.104 20 0 DIADLO O=C(C[C@H]1CCC[N@@H+]1CC=C(Cl)Cl)c1cccs1 ZINC001615995541 1056604214 /nfs/dbraw/zinc/60/42/14/1056604214.db2.gz URVMUQSWLPJAMH-SNVBAGLBSA-N 1 2 304.242 4.104 20 0 DIADLO CC[C@H](C)C[C@H](C)Nc1ccc(C)cc1C[NH+]1CCOCC1 ZINC001168694394 1056608143 /nfs/dbraw/zinc/60/81/43/1056608143.db2.gz PTFHDAXMLXUEJR-RDJZCZTQSA-N 1 2 304.478 4.064 20 0 DIADLO CSCCC[N@H+](CCc1ccccc1)c1ccc(O)cc1 ZINC001616051453 1056609155 /nfs/dbraw/zinc/60/91/55/1056609155.db2.gz WLMWDAOEFNLLQB-UHFFFAOYSA-N 1 2 301.455 4.194 20 0 DIADLO CSCCC[N@@H+](CCc1ccccc1)c1ccc(O)cc1 ZINC001616051453 1056609163 /nfs/dbraw/zinc/60/91/63/1056609163.db2.gz WLMWDAOEFNLLQB-UHFFFAOYSA-N 1 2 301.455 4.194 20 0 DIADLO Cc1cc(O)ccc1-c1ccc(-c2nc3c(o2)CC[N@@H+](C)C3)cc1 ZINC001240645938 1056622554 /nfs/dbraw/zinc/62/25/54/1056622554.db2.gz ZUMFSNCXWUJUMR-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO Cc1cc(O)ccc1-c1ccc(-c2nc3c(o2)CC[N@H+](C)C3)cc1 ZINC001240645938 1056622558 /nfs/dbraw/zinc/62/25/58/1056622558.db2.gz ZUMFSNCXWUJUMR-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO Fc1cc(C[NH+]2CCOCC2)ccc1-c1cccc(C(F)F)c1 ZINC001240691556 1056644331 /nfs/dbraw/zinc/64/43/31/1056644331.db2.gz ZWZZQKIBLHPJLF-UHFFFAOYSA-N 1 2 321.342 4.263 20 0 DIADLO O=C(c1cc2c[nH+]ccc2[nH]1)N1CCCC2(CCCCC2)CC1 ZINC001616377994 1056645747 /nfs/dbraw/zinc/64/57/47/1056645747.db2.gz QPBUDQXZEJHUPF-UHFFFAOYSA-N 1 2 311.429 4.140 20 0 DIADLO CC(C)(C)c1noc(C[N@@H+]2CCCCC[C@H]2c2ccco2)n1 ZINC000076804982 1056657877 /nfs/dbraw/zinc/65/78/77/1056657877.db2.gz RNNOTECODXWVHM-ZDUSSCGKSA-N 1 2 303.406 4.077 20 0 DIADLO CC(C)(C)c1noc(C[N@H+]2CCCCC[C@H]2c2ccco2)n1 ZINC000076804982 1056657885 /nfs/dbraw/zinc/65/78/85/1056657885.db2.gz RNNOTECODXWVHM-ZDUSSCGKSA-N 1 2 303.406 4.077 20 0 DIADLO c1coc([C@@H]2CCCCC[N@H+]2Cc2cn3ccsc3n2)c1 ZINC000076804954 1056658828 /nfs/dbraw/zinc/65/88/28/1056658828.db2.gz REBNDOOCHFRCDA-AWEZNQCLSA-N 1 2 301.415 4.106 20 0 DIADLO c1coc([C@@H]2CCCCC[N@@H+]2Cc2cn3ccsc3n2)c1 ZINC000076804954 1056658834 /nfs/dbraw/zinc/65/88/34/1056658834.db2.gz REBNDOOCHFRCDA-AWEZNQCLSA-N 1 2 301.415 4.106 20 0 DIADLO CC(C)(C)c1noc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)n1 ZINC000076804979 1056659150 /nfs/dbraw/zinc/65/91/50/1056659150.db2.gz RNNOTECODXWVHM-CYBMUJFWSA-N 1 2 303.406 4.077 20 0 DIADLO CC(C)(C)c1noc(C[N@H+]2CCCCC[C@@H]2c2ccco2)n1 ZINC000076804979 1056659155 /nfs/dbraw/zinc/65/91/55/1056659155.db2.gz RNNOTECODXWVHM-CYBMUJFWSA-N 1 2 303.406 4.077 20 0 DIADLO COc1ccc(C)cc1C[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000076900770 1056664554 /nfs/dbraw/zinc/66/45/54/1056664554.db2.gz BJVDABAYHYZOGE-CYBMUJFWSA-N 1 2 304.459 4.434 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2OCCC(C)C)nn1C ZINC000282320166 1056664631 /nfs/dbraw/zinc/66/46/31/1056664631.db2.gz UGLJXHLWAVFHBS-MRXNPFEDSA-N 1 2 315.461 4.004 20 0 DIADLO Cc1cc(N[C@H](C)CCCC(C)(C)O)[nH+]cc1C(F)(F)F ZINC001168698110 1056679697 /nfs/dbraw/zinc/67/96/97/1056679697.db2.gz SEPSIODYJWQWNN-LLVKDONJSA-N 1 2 304.356 4.150 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+]2CCC[C@@H]2c2ccsc2)n1 ZINC000076989702 1056680386 /nfs/dbraw/zinc/68/03/86/1056680386.db2.gz HRZUZZCOQFTWOV-TZMCWYRMSA-N 1 2 305.447 4.372 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+]2CCC[C@@H]2c2ccsc2)n1 ZINC000076989702 1056680394 /nfs/dbraw/zinc/68/03/94/1056680394.db2.gz HRZUZZCOQFTWOV-TZMCWYRMSA-N 1 2 305.447 4.372 20 0 DIADLO CC(C)(C)c1cccc(OC(=O)C23CCC[NH+]2CCC3)c1Cl ZINC001616793980 1056718633 /nfs/dbraw/zinc/71/86/33/1056718633.db2.gz FPUGGJAZCCVDRA-UHFFFAOYSA-N 1 2 321.848 4.171 20 0 DIADLO COc1ccc(C(F)(F)F)cc1-c1c[nH+]c(N(C)C)cc1C ZINC001240824852 1056720437 /nfs/dbraw/zinc/72/04/37/1056720437.db2.gz QMOZCZHGLCUXDU-UHFFFAOYSA-N 1 2 310.319 4.150 20 0 DIADLO COc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCCC1(F)F)CCCS2 ZINC000672619993 1056738111 /nfs/dbraw/zinc/73/81/11/1056738111.db2.gz HHHWJYYGSGZYCR-UKRRQHHQSA-N 1 2 313.413 4.400 20 0 DIADLO FC(F)(F)c1cnc2c(c1)[C@H]([NH2+][C@H]1CCCC1(F)F)CCC2 ZINC000672622514 1056738285 /nfs/dbraw/zinc/73/82/85/1056738285.db2.gz ZYGMOEXUHWCUCE-OLZOCXBDSA-N 1 2 320.305 4.255 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H]2CCCC2(F)F)ccc1OC(F)F ZINC000672621698 1056740968 /nfs/dbraw/zinc/74/09/68/1056740968.db2.gz DZYSIINMFGHMOP-RNCFNFMXSA-N 1 2 321.314 4.135 20 0 DIADLO CSCc1cccc(C[NH2+]Cc2nc(C(C)(C)C)co2)c1 ZINC000922037487 1056759895 /nfs/dbraw/zinc/75/98/95/1056759895.db2.gz FOKSMZWPCAVVTN-UHFFFAOYSA-N 1 2 304.459 4.125 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1ccc(F)c(Cl)c1 ZINC001617197652 1056791405 /nfs/dbraw/zinc/79/14/05/1056791405.db2.gz BNPSIASZPJNSPQ-CQSZACIVSA-N 1 2 315.816 4.031 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC001617197652 1056791420 /nfs/dbraw/zinc/79/14/20/1056791420.db2.gz BNPSIASZPJNSPQ-CQSZACIVSA-N 1 2 315.816 4.031 20 0 DIADLO CC[C@H](CC(C)C)C(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC001128329959 1056795293 /nfs/dbraw/zinc/79/52/93/1056795293.db2.gz UVPFTGVCQUHWJI-HZPDHXFCSA-N 1 2 322.518 4.026 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@H](C(C)C)C1 ZINC001617285374 1056808993 /nfs/dbraw/zinc/80/89/93/1056808993.db2.gz VHLSDJILTZTXGN-DOTOQJQBSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H](C(C)C)C1 ZINC001617285374 1056808998 /nfs/dbraw/zinc/80/89/98/1056808998.db2.gz VHLSDJILTZTXGN-DOTOQJQBSA-N 1 2 323.864 4.312 20 0 DIADLO Cc1ccc(-c2cncc(C[NH+]3CCOCC3)c2)c2ccccc12 ZINC001241006737 1056811404 /nfs/dbraw/zinc/81/14/04/1056811404.db2.gz NERNGDVJYGPZOO-UHFFFAOYSA-N 1 2 318.420 4.042 20 0 DIADLO Cc1cc(-c2ccc(F)c(OCc3ccccc3)c2)c[nH+]c1N ZINC001241009878 1056813708 /nfs/dbraw/zinc/81/37/08/1056813708.db2.gz HSLAZZWHABELJJ-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO CCOc1cc(F)c(-c2ccccc2Cn2cc[nH+]c2)cc1F ZINC001241073307 1056864537 /nfs/dbraw/zinc/86/45/37/1056864537.db2.gz ALEOYYSVMLZJNG-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO CCOc1cc(F)c(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc1F ZINC001241074880 1056867171 /nfs/dbraw/zinc/86/71/71/1056867171.db2.gz CCSBSCPMLLRGTM-UHFFFAOYSA-N 1 2 318.298 4.355 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@@H](C)c2ccccc2C(F)(F)F)n1 ZINC000114750099 1056872904 /nfs/dbraw/zinc/87/29/04/1056872904.db2.gz LLEMRHMETUKOCO-VHSXEESVSA-N 1 2 313.323 4.063 20 0 DIADLO Fc1ccc([C@H]([NH2+][C@@H]2CCCc3[nH]ncc32)C2CC2)cc1Cl ZINC000453309397 1056879391 /nfs/dbraw/zinc/87/93/91/1056879391.db2.gz DURHFSFYGPPSIF-NVXWUHKLSA-N 1 2 319.811 4.321 20 0 DIADLO C[C@@H](c1ccc(Oc2ccccc2)cc1)[N@@H+]1CCc2c[nH]nc2C1 ZINC000682074551 1056887689 /nfs/dbraw/zinc/88/76/89/1056887689.db2.gz VKORHKAVBXUZPF-HNNXBMFYSA-N 1 2 319.408 4.321 20 0 DIADLO C[C@@H](c1ccc(Oc2ccccc2)cc1)[N@H+]1CCc2c[nH]nc2C1 ZINC000682074551 1056887695 /nfs/dbraw/zinc/88/76/95/1056887695.db2.gz VKORHKAVBXUZPF-HNNXBMFYSA-N 1 2 319.408 4.321 20 0 DIADLO COc1cc(C)c(-c2ccc(-n3cc[nH+]c3)cc2OC)cc1C ZINC001241139050 1056919542 /nfs/dbraw/zinc/91/95/42/1056919542.db2.gz VDZYHURGAFQUFP-UHFFFAOYSA-N 1 2 308.381 4.173 20 0 DIADLO C[C@@H](C[NH2+][C@@H](c1ccccc1)C(F)F)COCc1ccccc1 ZINC001618083849 1056921426 /nfs/dbraw/zinc/92/14/26/1056921426.db2.gz GHUKCMFQMZKBJO-YJBOKZPZSA-N 1 2 319.395 4.435 20 0 DIADLO C[C@H](C[NH2+][C@H](c1ccccc1)C(F)F)COCc1ccccc1 ZINC001618083846 1056921508 /nfs/dbraw/zinc/92/15/08/1056921508.db2.gz GHUKCMFQMZKBJO-CRAIPNDOSA-N 1 2 319.395 4.435 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+]1CCC[C@](C)(F)C1 ZINC001618122392 1056924850 /nfs/dbraw/zinc/92/48/50/1056924850.db2.gz KXXWFHJJHKPZSZ-RISCZKNCSA-N 1 2 300.215 4.334 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+]1CCC[C@](C)(F)C1 ZINC001618122392 1056924856 /nfs/dbraw/zinc/92/48/56/1056924856.db2.gz KXXWFHJJHKPZSZ-RISCZKNCSA-N 1 2 300.215 4.334 20 0 DIADLO CCn1ncc(C[N@H+](Cc2ccccc2)[C@H](C)c2ccccc2)n1 ZINC001618160648 1056927819 /nfs/dbraw/zinc/92/78/19/1056927819.db2.gz ZAWZJSIQKCNNFJ-QGZVFWFLSA-N 1 2 320.440 4.061 20 0 DIADLO CCn1ncc(C[N@@H+](Cc2ccccc2)[C@H](C)c2ccccc2)n1 ZINC001618160648 1056927825 /nfs/dbraw/zinc/92/78/25/1056927825.db2.gz ZAWZJSIQKCNNFJ-QGZVFWFLSA-N 1 2 320.440 4.061 20 0 DIADLO Cc1ccnc(C[N@@H+](C)[C@H](C)c2ccccc2Br)c1 ZINC000683004763 1056928637 /nfs/dbraw/zinc/92/86/37/1056928637.db2.gz OSSWVKLJJJHUAE-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccnc(C[N@H+](C)[C@H](C)c2ccccc2Br)c1 ZINC000683004763 1056928644 /nfs/dbraw/zinc/92/86/44/1056928644.db2.gz OSSWVKLJJJHUAE-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cc(C)cc(C[NH2+][C@@H](c2nccn2C)c2cccc(F)c2)c1 ZINC000067448649 1056941729 /nfs/dbraw/zinc/94/17/29/1056941729.db2.gz DJYRSPPMJNNVHC-LJQANCHMSA-N 1 2 323.415 4.055 20 0 DIADLO O=C(NC1CCCCCCC1)c1c[nH+]ccc1Nc1ccccc1 ZINC001618260553 1056942488 /nfs/dbraw/zinc/94/24/88/1056942488.db2.gz FIXAMXGMBDBFQI-UHFFFAOYSA-N 1 2 323.440 4.090 20 0 DIADLO CCOc1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c(F)c1F ZINC001241179511 1056948482 /nfs/dbraw/zinc/94/84/82/1056948482.db2.gz HQQOWGAMDUBTJP-UHFFFAOYSA-N 1 2 318.298 4.355 20 0 DIADLO Cc1cc(-c2cccc(O[C@@H]3CCCCO3)c2)c2[nH+]ccn2c1 ZINC001241214263 1056963721 /nfs/dbraw/zinc/96/37/21/1056963721.db2.gz RARVKXHPWYRTLY-GOSISDBHSA-N 1 2 308.381 4.215 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(OCc2ccccc2)cn1 ZINC001241233749 1056972713 /nfs/dbraw/zinc/97/27/13/1056972713.db2.gz TWDZOWYXLOTZRT-UHFFFAOYSA-N 1 2 319.408 4.097 20 0 DIADLO CCc1cc(-c2c[nH+]c(N(C)C)cc2C)nnc1-c1ccccc1 ZINC001241239749 1056975498 /nfs/dbraw/zinc/97/54/98/1056975498.db2.gz CBOOIDOHESHLPF-UHFFFAOYSA-N 1 2 318.424 4.142 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1nc(-c2ccccc2)nc(C)c1F ZINC001241241091 1056976750 /nfs/dbraw/zinc/97/67/50/1056976750.db2.gz XMRUYCORXLSDFY-UHFFFAOYSA-N 1 2 322.387 4.028 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ncc(C(F)(F)F)cc1C1CC1 ZINC001241244048 1056978121 /nfs/dbraw/zinc/97/81/21/1056978121.db2.gz UEBHDLJFIXTICW-UHFFFAOYSA-N 1 2 321.346 4.414 20 0 DIADLO CCCCOc1ccc(F)cc1-c1c[nH+]c(N(C)C)cc1C ZINC001241251686 1056980573 /nfs/dbraw/zinc/98/05/73/1056980573.db2.gz ZLJWBCZIJCXTFH-UHFFFAOYSA-N 1 2 302.393 4.441 20 0 DIADLO COc1cccc(C2([NH2+]Cc3nc(C(C)(C)C)co3)CCC2)c1 ZINC000922263108 1056991309 /nfs/dbraw/zinc/99/13/09/1056991309.db2.gz PSXVQDMFIDBQFH-UHFFFAOYSA-N 1 2 314.429 4.150 20 0 DIADLO COc1ccc(C(C)(C)[NH2+]Cc2nc(C(C)(C)C)co2)cc1F ZINC000922288429 1056998518 /nfs/dbraw/zinc/99/85/18/1056998518.db2.gz QOUWUKCBLJTACP-UHFFFAOYSA-N 1 2 320.408 4.145 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1F ZINC000338855565 1057025217 /nfs/dbraw/zinc/02/52/17/1057025217.db2.gz DYQNPQQHDIIMHR-CQSZACIVSA-N 1 2 323.371 4.144 20 0 DIADLO CSc1ccc(C[NH2+][C@@H]2c3ccccc3OC[C@H]2F)s1 ZINC000922520296 1057030184 /nfs/dbraw/zinc/03/01/84/1057030184.db2.gz LAOKKLFXEKUYCZ-IUODEOHRSA-N 1 2 309.431 4.031 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@H](c2ccccn2)C2CC2)n1 ZINC000922581665 1057034634 /nfs/dbraw/zinc/03/46/34/1057034634.db2.gz LJPRMKPMHHAATG-INIZCTEOSA-N 1 2 301.459 4.077 20 0 DIADLO CCc1cc(C[NH2+][C@H](C)c2cc(Cl)sc2Cl)[nH]n1 ZINC000765993306 1057038448 /nfs/dbraw/zinc/03/84/48/1057038448.db2.gz MMOGAVUENRBHRO-SSDOTTSWSA-N 1 2 304.246 4.191 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cccc4ccsc43)nn2)c1C ZINC001241402670 1057040977 /nfs/dbraw/zinc/04/09/77/1057040977.db2.gz MUEKOQDKBGFBGX-UHFFFAOYSA-N 1 2 306.394 4.161 20 0 DIADLO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1ncc(C(F)(F)F)s1 ZINC000922667830 1057046380 /nfs/dbraw/zinc/04/63/80/1057046380.db2.gz SOAFPURSBWJPPN-SECBINFHSA-N 1 2 318.339 4.460 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2F)nn1C ZINC000922669981 1057046841 /nfs/dbraw/zinc/04/68/41/1057046841.db2.gz OHHGVERHDMRTIT-SECBINFHSA-N 1 2 316.207 4.025 20 0 DIADLO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1ncc(C(F)(F)F)s1 ZINC000922670330 1057047348 /nfs/dbraw/zinc/04/73/48/1057047348.db2.gz SOAFPURSBWJPPN-VIFPVBQESA-N 1 2 318.339 4.460 20 0 DIADLO C[C@H]([NH2+]Cc1cscc1Cl)c1nccn1-c1ccccc1 ZINC000673613188 1057054404 /nfs/dbraw/zinc/05/44/04/1057054404.db2.gz BGIIEVLBHCOODT-LBPRGKRZSA-N 1 2 317.845 4.438 20 0 DIADLO CCCc1nc(C)c(C[N@@H+]2CCc3cc(Cl)ccc3C2)o1 ZINC000428985951 1057060368 /nfs/dbraw/zinc/06/03/68/1057060368.db2.gz MCABBAUWUPQWOI-UHFFFAOYSA-N 1 2 304.821 4.147 20 0 DIADLO CCCc1nc(C)c(C[N@H+]2CCc3cc(Cl)ccc3C2)o1 ZINC000428985951 1057060374 /nfs/dbraw/zinc/06/03/74/1057060374.db2.gz MCABBAUWUPQWOI-UHFFFAOYSA-N 1 2 304.821 4.147 20 0 DIADLO Cc1cc(C[NH2+][C@H]2CCCC2(F)F)ccc1Oc1cccnc1 ZINC000673618289 1057061417 /nfs/dbraw/zinc/06/14/17/1057061417.db2.gz ZLEQXSXIOHRHJS-KRWDZBQOSA-N 1 2 318.367 4.460 20 0 DIADLO Cc1scc(C[NH2+][C@@H](c2nc(C3CC3)no2)C(C)C)c1C ZINC000631071544 1057064966 /nfs/dbraw/zinc/06/49/66/1057064966.db2.gz PNEFSADPZKIZHY-CQSZACIVSA-N 1 2 305.447 4.112 20 0 DIADLO Fc1ccc(F)c(C[NH2+][C@@H]2CCCc3cccnc32)c1Cl ZINC000922876350 1057072596 /nfs/dbraw/zinc/07/25/96/1057072596.db2.gz XASHXQZIUGKYKH-CQSZACIVSA-N 1 2 308.759 4.180 20 0 DIADLO Cn1c[nH+]cc1CNc1ccccc1Oc1cc(F)cc(F)c1 ZINC000347762281 1057072629 /nfs/dbraw/zinc/07/26/29/1057072629.db2.gz BINDBUPCDHTEHK-UHFFFAOYSA-N 1 2 315.323 4.103 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](C)Cc1ccncc1Br ZINC000625056627 1057082232 /nfs/dbraw/zinc/08/22/32/1057082232.db2.gz KRRSQIXJDBRSLH-GFCCVEGCSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1ccncc1Br ZINC000625056627 1057082235 /nfs/dbraw/zinc/08/22/35/1057082235.db2.gz KRRSQIXJDBRSLH-GFCCVEGCSA-N 1 2 305.219 4.037 20 0 DIADLO COCCC[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccc(F)cc1 ZINC000282445962 1057133886 /nfs/dbraw/zinc/13/38/86/1057133886.db2.gz UUMPYPGLEWTKMJ-LJQANCHMSA-N 1 2 316.420 4.472 20 0 DIADLO COc1cc(F)c(-c2cccc(-c3c[nH+]cn3C)c2)c(F)c1 ZINC001241694093 1057140210 /nfs/dbraw/zinc/14/02/10/1057140210.db2.gz DZJRXYXIDKPIKY-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1csc([C@H](C)OC)n1 ZINC000673856154 1057143034 /nfs/dbraw/zinc/14/30/34/1057143034.db2.gz KMPRSGSGEYIGBX-GUYCJALGSA-N 1 2 316.470 4.360 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1csc([C@H](C)OC)n1 ZINC000673856154 1057143036 /nfs/dbraw/zinc/14/30/36/1057143036.db2.gz KMPRSGSGEYIGBX-GUYCJALGSA-N 1 2 316.470 4.360 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2F)C2CCCCC2)co1 ZINC000659881047 1057159815 /nfs/dbraw/zinc/15/98/15/1057159815.db2.gz XMKZMMZWBMDNIU-UHFFFAOYSA-N 1 2 302.393 4.457 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2F)C2CCCCC2)co1 ZINC000659881047 1057159820 /nfs/dbraw/zinc/15/98/20/1057159820.db2.gz XMKZMMZWBMDNIU-UHFFFAOYSA-N 1 2 302.393 4.457 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CC=C(c3cccc(Cl)c3)CC2)s1 ZINC000282478606 1057161040 /nfs/dbraw/zinc/16/10/40/1057161040.db2.gz LJMGZFFIDFXHRF-LLVKDONJSA-N 1 2 319.861 4.350 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)s1 ZINC000282478606 1057161046 /nfs/dbraw/zinc/16/10/46/1057161046.db2.gz LJMGZFFIDFXHRF-LLVKDONJSA-N 1 2 319.861 4.350 20 0 DIADLO CCCC[N@H+](Cc1cn2ccccc2n1)Cc1ccccc1F ZINC000058398086 1057171601 /nfs/dbraw/zinc/17/16/01/1057171601.db2.gz CZINGMKVQNQECA-UHFFFAOYSA-N 1 2 311.404 4.276 20 0 DIADLO CCCC[N@@H+](Cc1cn2ccccc2n1)Cc1ccccc1F ZINC000058398086 1057171604 /nfs/dbraw/zinc/17/16/04/1057171604.db2.gz CZINGMKVQNQECA-UHFFFAOYSA-N 1 2 311.404 4.276 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(C(C)(C)C)n2)C[C@H](C)C1(F)F ZINC000625644243 1057182585 /nfs/dbraw/zinc/18/25/85/1057182585.db2.gz ADNWJXAGGFGYOV-PHIMTYICSA-N 1 2 302.434 4.164 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(C(C)(C)C)n2)C[C@H](C)C1(F)F ZINC000625644243 1057182588 /nfs/dbraw/zinc/18/25/88/1057182588.db2.gz ADNWJXAGGFGYOV-PHIMTYICSA-N 1 2 302.434 4.164 20 0 DIADLO C[C@@H]1C[NH+](Cc2csc(-c3ccco3)n2)C[C@@H](C)C1(F)F ZINC000625648707 1057183577 /nfs/dbraw/zinc/18/35/77/1057183577.db2.gz RVSQDCITWRREHX-GHMZBOCLSA-N 1 2 312.385 4.126 20 0 DIADLO C[C@@H](c1noc(-c2ccccc2)n1)[N@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000625653787 1057184786 /nfs/dbraw/zinc/18/47/86/1057184786.db2.gz NJKNIOASKVGWTE-XQQFMLRXSA-N 1 2 321.371 4.021 20 0 DIADLO C[C@@H](c1noc(-c2ccccc2)n1)[N@@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000625653787 1057184787 /nfs/dbraw/zinc/18/47/87/1057184787.db2.gz NJKNIOASKVGWTE-XQQFMLRXSA-N 1 2 321.371 4.021 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[NH+]1C[C@@H](C)C(F)(F)[C@H](C)C1 ZINC000625653783 1057184816 /nfs/dbraw/zinc/18/48/16/1057184816.db2.gz NJKNIOASKVGWTE-JHJVBQTASA-N 1 2 321.371 4.021 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cnn(C2CCCCC2)c1 ZINC001241842332 1057186260 /nfs/dbraw/zinc/18/62/60/1057186260.db2.gz JCUQGLCHRYXDHW-UHFFFAOYSA-N 1 2 322.412 4.250 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(-c4cccnc4)cc3)nc2)c[nH+]1 ZINC001241844217 1057187389 /nfs/dbraw/zinc/18/73/89/1057187389.db2.gz VBRNBNITGBCIDQ-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc(-c2cccnc2)cc1 ZINC001241845571 1057187908 /nfs/dbraw/zinc/18/79/08/1057187908.db2.gz FRFJZLUNBIPBQP-UHFFFAOYSA-N 1 2 301.349 4.301 20 0 DIADLO C[C@H]1CN(c2ccc([NH2+]C3CCC(C(F)F)CC3)cc2)CCO1 ZINC000282514064 1057190013 /nfs/dbraw/zinc/19/00/13/1057190013.db2.gz ZFQMDHRMUURAKY-NFOMZHRRSA-N 1 2 324.415 4.148 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2scnc2c1 ZINC001241870904 1057197639 /nfs/dbraw/zinc/19/76/39/1057197639.db2.gz HZGKNHJCKVJAFH-UHFFFAOYSA-N 1 2 307.378 4.158 20 0 DIADLO CCOc1ccc2ccccc2c1-c1cc(-n2ccnc2)cc[nH+]1 ZINC001241924676 1057213293 /nfs/dbraw/zinc/21/32/93/1057213293.db2.gz DCDMBUDTJVKOJQ-UHFFFAOYSA-N 1 2 315.376 4.486 20 0 DIADLO CCCCOC(=O)Nc1ccc(-c2cccc3[nH+]ccn32)cc1 ZINC001241932714 1057216924 /nfs/dbraw/zinc/21/69/24/1057216924.db2.gz FOQZSPWMPIMGRS-UHFFFAOYSA-N 1 2 309.369 4.350 20 0 DIADLO Cc1nnc(-c2cccc(-c3cccc(-c4c[nH+]cn4C)c3)c2)o1 ZINC001241937437 1057219606 /nfs/dbraw/zinc/21/96/06/1057219606.db2.gz VDRAVOFGIZTYHD-UHFFFAOYSA-N 1 2 316.364 4.113 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccccc2OC(F)F)c1 ZINC001241952628 1057222507 /nfs/dbraw/zinc/22/25/07/1057222507.db2.gz JTESGNLOKNEYIZ-UHFFFAOYSA-N 1 2 300.308 4.356 20 0 DIADLO COc1ccc(-c2cc3[nH]c[nH+]c3cc2OC)c2ccccc12 ZINC001241978335 1057229706 /nfs/dbraw/zinc/22/97/06/1057229706.db2.gz ZIOVXHPJGYZUTD-UHFFFAOYSA-N 1 2 304.349 4.400 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2n[nH]c3ccccc32)C2CCC2)cc1 ZINC000922892035 1057231451 /nfs/dbraw/zinc/23/14/51/1057231451.db2.gz NJSPTPJNHBZVLU-FQEVSTJZSA-N 1 2 321.424 4.203 20 0 DIADLO C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1n[nH]c2ccccc21 ZINC000674336034 1057232139 /nfs/dbraw/zinc/23/21/39/1057232139.db2.gz WSGXBYRIHBTPBR-BUXKBTBVSA-N 1 2 309.388 4.115 20 0 DIADLO COC(=O)c1c(C)noc1-c1ccc(-c2cc(C)[nH+]c(C)c2)cc1 ZINC001241992202 1057232458 /nfs/dbraw/zinc/23/24/58/1057232458.db2.gz HWMVKAZTQMPQJG-UHFFFAOYSA-N 1 2 322.364 4.115 20 0 DIADLO CCOC(=O)c1nccc2cc(-c3cc(C)[nH+]c(C)c3)ccc21 ZINC001241993027 1057232483 /nfs/dbraw/zinc/23/24/83/1057232483.db2.gz DHMRMPVFCOFIHO-UHFFFAOYSA-N 1 2 306.365 4.090 20 0 DIADLO COC(=O)c1ccc(N2CCCCC2)c(-c2cc(C)[nH+]c(C)c2)c1 ZINC001241991299 1057232782 /nfs/dbraw/zinc/23/27/82/1057232782.db2.gz AZNLJDLRQJJTMR-UHFFFAOYSA-N 1 2 324.424 4.142 20 0 DIADLO CCOC(=O)c1coc(-c2cccc(-c3cc(C)[nH+]c(C)c3)c2)n1 ZINC001241995980 1057233388 /nfs/dbraw/zinc/23/33/88/1057233388.db2.gz PKWFIGWDJIXFQK-UHFFFAOYSA-N 1 2 322.364 4.197 20 0 DIADLO CCOC(COc1ccc(-c2cc(C)[nH+]c(C)c2)cc1)OCC ZINC001241994358 1057233607 /nfs/dbraw/zinc/23/36/07/1057233607.db2.gz SHSWUIZLNZGCHD-UHFFFAOYSA-N 1 2 315.413 4.143 20 0 DIADLO Cc1cc(-c2ccnc(OCc3ccc(F)cc3)c2)cc(C)[nH+]1 ZINC001241993778 1057233772 /nfs/dbraw/zinc/23/37/72/1057233772.db2.gz CWJOLFYGEBKVCQ-UHFFFAOYSA-N 1 2 308.356 4.479 20 0 DIADLO COc1cccc2[nH]c(-c3ccc(-c4c[nH+]cn4C)cc3)cc21 ZINC001241998867 1057235373 /nfs/dbraw/zinc/23/53/73/1057235373.db2.gz JFZXSTQPIWXTBA-UHFFFAOYSA-N 1 2 303.365 4.244 20 0 DIADLO CCOc1ccc(C[N@H+](C)[C@H](C)c2ccccc2Cl)nc1 ZINC000674389031 1057238538 /nfs/dbraw/zinc/23/85/38/1057238538.db2.gz NJUBGCLRKFPDCS-CYBMUJFWSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)nc1 ZINC000674389031 1057238540 /nfs/dbraw/zinc/23/85/40/1057238540.db2.gz NJUBGCLRKFPDCS-CYBMUJFWSA-N 1 2 304.821 4.327 20 0 DIADLO c1cc(CNc2nc(NCc3ccoc3)c3ccccc3[nH+]2)co1 ZINC000171863491 1057243690 /nfs/dbraw/zinc/24/36/90/1057243690.db2.gz WBYKHJSWTOSTSQ-UHFFFAOYSA-N 1 2 320.352 4.040 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(C)c(F)c1F ZINC001242031141 1057243669 /nfs/dbraw/zinc/24/36/69/1057243669.db2.gz AEAGBGJIUNSYEM-UHFFFAOYSA-N 1 2 300.308 4.135 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(O)c(C(F)(F)F)c2)c1 ZINC001242166317 1057285707 /nfs/dbraw/zinc/28/57/07/1057285707.db2.gz ORGMRDIWWRAJBF-UHFFFAOYSA-N 1 2 318.298 4.479 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+]1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000245402898 1057286715 /nfs/dbraw/zinc/28/67/15/1057286715.db2.gz JVJNJZKWMHFYSN-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccccc1)[N@H+]1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000245402898 1057286721 /nfs/dbraw/zinc/28/67/21/1057286721.db2.gz JVJNJZKWMHFYSN-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H]([NH2+]Cc1n[nH]c2ccccc21)c1cccc(N2CCCC2)c1 ZINC000674883297 1057295559 /nfs/dbraw/zinc/29/55/59/1057295559.db2.gz ZRPRHIVQAXCSMU-HNNXBMFYSA-N 1 2 320.440 4.014 20 0 DIADLO C[C@@H]([NH2+]Cc1n[nH]c2ccccc21)c1cccc(N2CCCC2)c1 ZINC000674883299 1057295624 /nfs/dbraw/zinc/29/56/24/1057295624.db2.gz ZRPRHIVQAXCSMU-OAHLLOKOSA-N 1 2 320.440 4.014 20 0 DIADLO Cc1cc(-c2cccnc2OC2CCCCC2)cn2cc[nH+]c12 ZINC001242228311 1057302627 /nfs/dbraw/zinc/30/26/27/1057302627.db2.gz ASUSCNVTBALHHF-UHFFFAOYSA-N 1 2 307.397 4.416 20 0 DIADLO Cc1ccc(C[NH+]2CCOCC2)cc1C1=CCC(F)(F)CC1 ZINC001242236498 1057306002 /nfs/dbraw/zinc/30/60/02/1057306002.db2.gz NVUYLODJNXKWHJ-UHFFFAOYSA-N 1 2 307.384 4.030 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2cccnc2c1 ZINC001242249592 1057311665 /nfs/dbraw/zinc/31/16/65/1057311665.db2.gz OKIFSUURZFMPCT-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO CCCc1ccc(C[NH2+]Cc2nnc(C(C)(C)C)s2)cc1 ZINC000675155274 1057322736 /nfs/dbraw/zinc/32/27/36/1057322736.db2.gz JMVWVFTXFZXURG-UHFFFAOYSA-N 1 2 303.475 4.078 20 0 DIADLO CCOc1c(F)cccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001212536221 1057345022 /nfs/dbraw/zinc/34/50/22/1057345022.db2.gz RICBMDKKNUGWHY-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1cnc2ccccc2c1 ZINC000766108581 1057345557 /nfs/dbraw/zinc/34/55/57/1057345557.db2.gz BHQURYMHVAEWLD-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO CCOc1c(F)cccc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001212535416 1057346006 /nfs/dbraw/zinc/34/60/06/1057346006.db2.gz VHFMEYZDFQGAGP-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO CC(C)CCC1CCN(C(=O)Nc2ccc3[nH+]ccn3c2)CC1 ZINC000675369968 1057348321 /nfs/dbraw/zinc/34/83/21/1057348321.db2.gz RRZNCWNWJOVPMG-UHFFFAOYSA-N 1 2 314.433 4.014 20 0 DIADLO FC(F)(F)c1ncccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001242373742 1057352139 /nfs/dbraw/zinc/35/21/39/1057352139.db2.gz GSKRUQJOJWZYHT-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cccnc1C(F)(F)F ZINC001242374737 1057352502 /nfs/dbraw/zinc/35/25/02/1057352502.db2.gz ALBOWPLIJMZGPD-UHFFFAOYSA-N 1 2 321.346 4.461 20 0 DIADLO Cc1scc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)c1C ZINC001212550844 1057362338 /nfs/dbraw/zinc/36/23/38/1057362338.db2.gz KIPXBVSSXZVLKJ-UHFFFAOYSA-N 1 2 322.393 4.268 20 0 DIADLO FC(F)Oc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001242440931 1057368121 /nfs/dbraw/zinc/36/81/21/1057368121.db2.gz MRWYVGMFENLDAA-UHFFFAOYSA-N 1 2 300.308 4.200 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(OC(F)F)cc1 ZINC001242443063 1057369723 /nfs/dbraw/zinc/36/97/23/1057369723.db2.gz WVVRFUCKTDJJBY-UHFFFAOYSA-N 1 2 316.307 4.149 20 0 DIADLO c1cn2cc(-c3ccc4c(cnn4[C@H]4CCCCO4)c3)ccc2[nH+]1 ZINC001242447486 1057371632 /nfs/dbraw/zinc/37/16/32/1057371632.db2.gz PKXWHXURTYFSFG-LJQANCHMSA-N 1 2 318.380 4.050 20 0 DIADLO Cc1cc2c[nH+]c(C=Cc3ccccc3C(F)(F)F)nc2[nH]1 ZINC001242490571 1057381733 /nfs/dbraw/zinc/38/17/33/1057381733.db2.gz BNTJBCIYKQRXNF-VOTSOKGWSA-N 1 2 303.287 4.407 20 0 DIADLO c1cc2c(s1)CCC[N@@H+](Cc1ccn(C3CCCC3)n1)C2 ZINC000675639780 1057390237 /nfs/dbraw/zinc/39/02/37/1057390237.db2.gz VFEJQCFWPXCBIS-UHFFFAOYSA-N 1 2 301.459 4.008 20 0 DIADLO c1cc2c(s1)CCC[N@H+](Cc1ccn(C3CCCC3)n1)C2 ZINC000675639780 1057390245 /nfs/dbraw/zinc/39/02/45/1057390245.db2.gz VFEJQCFWPXCBIS-UHFFFAOYSA-N 1 2 301.459 4.008 20 0 DIADLO CC(C)[C@@H]1c2ccccc2CC[N@H+]1Cc1nccn1C(F)F ZINC000675642832 1057391021 /nfs/dbraw/zinc/39/10/21/1057391021.db2.gz OLAMHBDBKOCQJZ-MRXNPFEDSA-N 1 2 305.372 4.034 20 0 DIADLO CC(C)[C@@H]1c2ccccc2CC[N@@H+]1Cc1nccn1C(F)F ZINC000675642832 1057391027 /nfs/dbraw/zinc/39/10/27/1057391027.db2.gz OLAMHBDBKOCQJZ-MRXNPFEDSA-N 1 2 305.372 4.034 20 0 DIADLO CC(C)[C@@H]1c2ccccc2CC[N@H+]1Cc1nc(C(C)(C)C)no1 ZINC000675642743 1057391477 /nfs/dbraw/zinc/39/14/77/1057391477.db2.gz MIVPJVBKLQZHRQ-QGZVFWFLSA-N 1 2 313.445 4.123 20 0 DIADLO CC(C)[C@@H]1c2ccccc2CC[N@@H+]1Cc1nc(C(C)(C)C)no1 ZINC000675642743 1057391482 /nfs/dbraw/zinc/39/14/82/1057391482.db2.gz MIVPJVBKLQZHRQ-QGZVFWFLSA-N 1 2 313.445 4.123 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccsc2C(F)(F)F)cc1 ZINC000704355448 1057396380 /nfs/dbraw/zinc/39/63/80/1057396380.db2.gz ZHPXXXHNNYLWLS-UHFFFAOYSA-N 1 2 300.349 4.445 20 0 DIADLO Cc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)c(C(F)(F)F)c1 ZINC001242561424 1057405990 /nfs/dbraw/zinc/40/59/90/1057405990.db2.gz OWCHVGQDKDAFNX-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO C[N@H+](CCOC(C)(C)C)Cc1csc(-c2cccs2)n1 ZINC000676042823 1057446335 /nfs/dbraw/zinc/44/63/35/1057446335.db2.gz PHVWLRZJMOEKBW-UHFFFAOYSA-N 1 2 310.488 4.119 20 0 DIADLO C[N@@H+](CCOC(C)(C)C)Cc1csc(-c2cccs2)n1 ZINC000676042823 1057446339 /nfs/dbraw/zinc/44/63/39/1057446339.db2.gz PHVWLRZJMOEKBW-UHFFFAOYSA-N 1 2 310.488 4.119 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(OC(F)(F)F)nc2)c1 ZINC001242779700 1057472303 /nfs/dbraw/zinc/47/23/03/1057472303.db2.gz WPEBWCBHFKPDGA-UHFFFAOYSA-N 1 2 319.286 4.048 20 0 DIADLO Oc1cc(-c2ccc(-n3cc[nH+]c3)cc2)cc(C(F)(F)F)c1 ZINC001242781871 1057473923 /nfs/dbraw/zinc/47/39/23/1057473923.db2.gz CMDWUOQUGXWORS-UHFFFAOYSA-N 1 2 304.271 4.264 20 0 DIADLO CC1(C)C[N@H+](Cc2ncc(-c3ccccc3)s2)C(C)(C)CO1 ZINC000676594558 1057488284 /nfs/dbraw/zinc/48/82/84/1057488284.db2.gz VIBOTWWLJSBIAT-UHFFFAOYSA-N 1 2 316.470 4.200 20 0 DIADLO CC1(C)C[N@@H+](Cc2ncc(-c3ccccc3)s2)C(C)(C)CO1 ZINC000676594558 1057488289 /nfs/dbraw/zinc/48/82/89/1057488289.db2.gz VIBOTWWLJSBIAT-UHFFFAOYSA-N 1 2 316.470 4.200 20 0 DIADLO Nc1[nH+]ccn1-c1cccc(-c2cc(Cl)c(O)c(Cl)c2)c1 ZINC001242852754 1057499138 /nfs/dbraw/zinc/49/91/38/1057499138.db2.gz BCBNNZYHDJMDKD-UHFFFAOYSA-N 1 2 320.179 4.134 20 0 DIADLO CC[NH+](CC)Cc1cc(OC)ccc1-c1cccc(S)c1 ZINC001242867427 1057505201 /nfs/dbraw/zinc/50/52/01/1057505201.db2.gz NHBWHONWTGBOEO-UHFFFAOYSA-N 1 2 301.455 4.493 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000073637380 1057510065 /nfs/dbraw/zinc/51/00/65/1057510065.db2.gz PMNBVBLNEAGLBI-CHWSQXEVSA-N 1 2 317.433 4.178 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@@]2(C)CCOc3ccccc32)cs1 ZINC000923023737 1057521773 /nfs/dbraw/zinc/52/17/73/1057521773.db2.gz AGGSNZHDCYAIJA-SFHVURJKSA-N 1 2 316.470 4.228 20 0 DIADLO CCOc1ccc(F)c(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1 ZINC001242938330 1057523293 /nfs/dbraw/zinc/52/32/93/1057523293.db2.gz JBKPQBDPPDZFPY-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(SC)c(F)c1 ZINC001242977382 1057532561 /nfs/dbraw/zinc/53/25/61/1057532561.db2.gz QSLIKWMKVUUZIJ-UHFFFAOYSA-N 1 2 314.385 4.409 20 0 DIADLO Nc1ccc(C(F)(F)F)cc1-c1cc[nH+]c(N2CCCCC2)c1 ZINC001243004930 1057544262 /nfs/dbraw/zinc/54/42/62/1057544262.db2.gz ZONKZPDLVCYVKE-UHFFFAOYSA-N 1 2 321.346 4.340 20 0 DIADLO C[C@@H](Nc1[nH+]cnc2c1cnn2-c1ccccc1)c1ccsc1 ZINC000320153541 1057547592 /nfs/dbraw/zinc/54/75/92/1057547592.db2.gz NUENWAVOXUREJS-GFCCVEGCSA-N 1 2 321.409 4.050 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)o1 ZINC000626007597 1057548598 /nfs/dbraw/zinc/54/85/98/1057548598.db2.gz MQOWEUOOOXFXLO-NSHDSACASA-N 1 2 310.319 4.121 20 0 DIADLO Cc1cnc([C@H](C)[N@H+]2CCc3cc(C(F)(F)F)ccc3C2)o1 ZINC000626007597 1057548601 /nfs/dbraw/zinc/54/86/01/1057548601.db2.gz MQOWEUOOOXFXLO-NSHDSACASA-N 1 2 310.319 4.121 20 0 DIADLO Nc1nc(N2CCC[C@@H]2c2ccc(Cl)cc2)[nH+]c2ccccc12 ZINC000535721419 1057556208 /nfs/dbraw/zinc/55/62/08/1057556208.db2.gz CZPUBDMVEOBQOW-MRXNPFEDSA-N 1 2 324.815 4.207 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ccc(C)cc3)c2)[nH+]c1C ZINC000142508819 1057562886 /nfs/dbraw/zinc/56/28/86/1057562886.db2.gz NVUMKIQIPCAAQC-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(OC(F)(F)F)cc2)nc1 ZINC001243071811 1057563312 /nfs/dbraw/zinc/56/33/12/1057563312.db2.gz GMAUXZAPZLTAEQ-UHFFFAOYSA-N 1 2 319.286 4.048 20 0 DIADLO Cc1ccc(OC(C)C)c(-c2ccc(Cn3cc[nH+]c3)cn2)c1 ZINC001243089306 1057567961 /nfs/dbraw/zinc/56/79/61/1057567961.db2.gz APQCYOJBZFUXMK-UHFFFAOYSA-N 1 2 307.397 4.089 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@H](Cc2ccccc2)c2ccccc2)n1 ZINC000078541100 1057568756 /nfs/dbraw/zinc/56/87/56/1057568756.db2.gz VAHXWDRXCHYMQO-KBXCAEBGSA-N 1 2 307.397 4.013 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)c(-c2cccc3occc32)c1 ZINC001243101644 1057572837 /nfs/dbraw/zinc/57/28/37/1057572837.db2.gz OLOKJGUXROPEES-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO Cc1c2[nH]ccc2ccc1-c1cc(F)ccc1C[NH+]1CCOCC1 ZINC001243101661 1057573477 /nfs/dbraw/zinc/57/34/77/1057573477.db2.gz UWEQYNFRPZELKS-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO COc1cc(-c2cccc3[nH+]c(C)cn32)cc(C(F)(F)F)c1 ZINC001243115549 1057576089 /nfs/dbraw/zinc/57/60/89/1057576089.db2.gz HKVQYNMSESBFIZ-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO COc1cc(-c2cc(C)cn3cc[nH+]c23)cc(C(F)(F)F)c1 ZINC001243120210 1057578774 /nfs/dbraw/zinc/57/87/74/1057578774.db2.gz WWTJEFIMNRSYMX-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO CCc1cccc(NC2CCN(c3cccc[nH+]3)CC2)c1CC ZINC000488399338 1057579793 /nfs/dbraw/zinc/57/97/93/1057579793.db2.gz SJMQCZFXOXNXMA-UHFFFAOYSA-N 1 2 309.457 4.287 20 0 DIADLO CCc1cccc(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)c1CC ZINC000489524163 1057590776 /nfs/dbraw/zinc/59/07/76/1057590776.db2.gz PQIACKXWLSLODX-UHFFFAOYSA-N 1 2 319.408 4.249 20 0 DIADLO CCOc1cc(F)c(F)cc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001243275887 1057631681 /nfs/dbraw/zinc/63/16/81/1057631681.db2.gz GCNORFOZEUYGHS-UHFFFAOYSA-N 1 2 314.335 4.431 20 0 DIADLO CCOc1cc(F)c(F)cc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001243277260 1057633333 /nfs/dbraw/zinc/63/33/33/1057633333.db2.gz UHZXAIDONZXJIE-UHFFFAOYSA-N 1 2 314.335 4.431 20 0 DIADLO Cc1cc(OC(C)C)ccc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001243278949 1057633763 /nfs/dbraw/zinc/63/37/63/1057633763.db2.gz LMRZNNNGMBIFEM-UHFFFAOYSA-N 1 2 307.397 4.089 20 0 DIADLO COc1c(F)c(F)ccc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001243304364 1057640905 /nfs/dbraw/zinc/64/09/05/1057640905.db2.gz CNNYPOLYFQTKMR-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000727222123 1057642577 /nfs/dbraw/zinc/64/25/77/1057642577.db2.gz RZNMBRGUOBBRAJ-UHFFFAOYSA-N 1 2 319.880 4.311 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000727222123 1057642586 /nfs/dbraw/zinc/64/25/86/1057642586.db2.gz RZNMBRGUOBBRAJ-UHFFFAOYSA-N 1 2 319.880 4.311 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(C2CC2)n1)c1cccc(C(F)(F)F)c1 ZINC000727464292 1057654662 /nfs/dbraw/zinc/65/46/62/1057654662.db2.gz XHCUKFKPJCDJGO-SNVBAGLBSA-N 1 2 310.319 4.422 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cccc(OC(F)F)c2)cc1 ZINC001243360268 1057659012 /nfs/dbraw/zinc/65/90/12/1057659012.db2.gz YOHRBCQPAHQYFD-UHFFFAOYSA-N 1 2 300.308 4.356 20 0 DIADLO Clc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)cc(Cl)n1 ZINC001243367529 1057661126 /nfs/dbraw/zinc/66/11/26/1057661126.db2.gz BOBUMQJCJPCDMW-UHFFFAOYSA-N 1 2 304.180 4.300 20 0 DIADLO CCCCCC[C@H](C)CC(=O)NCc1[nH+]cc(C)c(OC)c1C ZINC000727665161 1057661568 /nfs/dbraw/zinc/66/15/68/1057661568.db2.gz HRUNBPQJUCXPEJ-AWEZNQCLSA-N 1 2 320.477 4.320 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)NCc1[nH+]cc(C)c(OC)c1C ZINC000727665162 1057661615 /nfs/dbraw/zinc/66/16/15/1057661615.db2.gz HRUNBPQJUCXPEJ-CQSZACIVSA-N 1 2 320.477 4.320 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000727675434 1057664966 /nfs/dbraw/zinc/66/49/66/1057664966.db2.gz OVDNIDKOYPYVBE-HNNXBMFYSA-N 1 2 305.466 4.112 20 0 DIADLO c1ccc(NCc2ccc(-c3c[nH+]c4c(c3)CCCN4)cc2)cc1 ZINC001243441812 1057685730 /nfs/dbraw/zinc/68/57/30/1057685730.db2.gz NRXBTVIRWXYLKN-UHFFFAOYSA-N 1 2 315.420 4.362 20 0 DIADLO CC(C)c1cc(C[NH2+][C@@H](C)c2ccccc2Br)on1 ZINC000169224212 1057690736 /nfs/dbraw/zinc/69/07/36/1057690736.db2.gz HOZKRITXBXMKKF-NSHDSACASA-N 1 2 323.234 4.411 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2ccc(C3CCCC3)cc2)cc1 ZINC001243491972 1057695150 /nfs/dbraw/zinc/69/51/50/1057695150.db2.gz JQCINWZIMLCVIH-IBGZPJMESA-N 1 2 309.409 4.184 20 0 DIADLO COc1c(F)ccc(-c2cccc(-c3c[nH+]cn3C)c2)c1F ZINC001243510873 1057699643 /nfs/dbraw/zinc/69/96/43/1057699643.db2.gz OSNYLBQQJNFVMI-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO CC(C)[N@H+](CC1CC1)Cn1nc(-c2ccccc2)sc1=S ZINC000729982297 1057700160 /nfs/dbraw/zinc/70/01/60/1057700160.db2.gz VCFINQVUTKJHSS-UHFFFAOYSA-N 1 2 319.499 4.419 20 0 DIADLO CC(C)[N@@H+](CC1CC1)Cn1nc(-c2ccccc2)sc1=S ZINC000729982297 1057700164 /nfs/dbraw/zinc/70/01/64/1057700164.db2.gz VCFINQVUTKJHSS-UHFFFAOYSA-N 1 2 319.499 4.419 20 0 DIADLO CCOc1cc(-c2cccc(-c3c[nH+]cn3C)c2)c(F)cc1F ZINC001243530600 1057704671 /nfs/dbraw/zinc/70/46/71/1057704671.db2.gz PPSZSUSUPWTILY-UHFFFAOYSA-N 1 2 314.335 4.431 20 0 DIADLO CCOc1cc(-c2cc(F)c(C[NH+](C)C)c(F)c2)ccc1OC ZINC001243542944 1057708435 /nfs/dbraw/zinc/70/84/35/1057708435.db2.gz RMFPWZHECYWWRE-UHFFFAOYSA-N 1 2 321.367 4.101 20 0 DIADLO Cc1ccsc1-c1nn(C[N@@H+](C)[C@@H](C)C(C)C)c(=S)o1 ZINC000730253053 1057709555 /nfs/dbraw/zinc/70/95/55/1057709555.db2.gz PUWGYWKVDHDWDA-NSHDSACASA-N 1 2 311.476 4.176 20 0 DIADLO Cc1ccsc1-c1nn(C[N@H+](C)[C@@H](C)C(C)C)c(=S)o1 ZINC000730253053 1057709558 /nfs/dbraw/zinc/70/95/58/1057709558.db2.gz PUWGYWKVDHDWDA-NSHDSACASA-N 1 2 311.476 4.176 20 0 DIADLO COc1c(Cl)ccc(-c2ccc(-n3cc[nH+]c3)cc2)c1F ZINC001243575498 1057720017 /nfs/dbraw/zinc/72/00/17/1057720017.db2.gz SDZSHMIYXJBTNB-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(F)cc3)CCC2)nc2ccccc12 ZINC000730932387 1057729042 /nfs/dbraw/zinc/72/90/42/1057729042.db2.gz FPOOMQCBIRZXKH-UHFFFAOYSA-N 1 2 321.399 4.246 20 0 DIADLO CC(C)Oc1c(F)cc(F)c(-c2cccc3[nH+]ccn32)c1F ZINC001243616196 1057734232 /nfs/dbraw/zinc/73/42/32/1057734232.db2.gz MQRJVJZILSDYNW-UHFFFAOYSA-N 1 2 306.287 4.206 20 0 DIADLO c1cn(Cc2ccccc2-c2ccc(C3CCOCC3)cc2)c[nH+]1 ZINC001243628794 1057739911 /nfs/dbraw/zinc/73/99/11/1057739911.db2.gz SFNJOGISRNDRCE-UHFFFAOYSA-N 1 2 318.420 4.492 20 0 DIADLO CSc1ncc(Cl)cc1-c1ccccc1Cn1cc[nH+]c1 ZINC001243634803 1057740644 /nfs/dbraw/zinc/74/06/44/1057740644.db2.gz PBHCEPNVJVETFO-UHFFFAOYSA-N 1 2 315.829 4.369 20 0 DIADLO Cc1cc(-c2ccc(C(C)(F)F)cc2)c[nH+]c1N1CCOCC1 ZINC001243643017 1057741996 /nfs/dbraw/zinc/74/19/96/1057741996.db2.gz HIDRJWZBUPUVLT-UHFFFAOYSA-N 1 2 318.367 4.005 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(-c4ccccc4)nn3)cc2)c[nH+]1 ZINC001243656034 1057745320 /nfs/dbraw/zinc/74/53/20/1057745320.db2.gz AKOYKVAUZKLKIO-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO COc1ccc2ncc(-c3ccc(Cn4cc[nH+]c4)cc3)cc2c1 ZINC001243656967 1057745365 /nfs/dbraw/zinc/74/53/65/1057745365.db2.gz IGJOEYAHYXECND-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Cc1csc2nc(C)nc(-c3ccc(Cn4cc[nH+]c4)cc3)c12 ZINC001243656594 1057745671 /nfs/dbraw/zinc/74/56/71/1057745671.db2.gz NLYRVTNSAAEGRX-UHFFFAOYSA-N 1 2 320.421 4.220 20 0 DIADLO c1coc(-c2cccc(-c3ccc(Cn4cc[nH+]c4)cc3)c2)n1 ZINC001243656442 1057745699 /nfs/dbraw/zinc/74/56/99/1057745699.db2.gz DWVVCQHHBUBMJN-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO FC(F)(F)c1ccnc(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243657175 1057745815 /nfs/dbraw/zinc/74/58/15/1057745815.db2.gz LGXNSMWUWCEHMI-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO CCOC(=O)c1ccc(C)cc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243658135 1057746071 /nfs/dbraw/zinc/74/60/71/1057746071.db2.gz DLTHSCLXCUJIAO-UHFFFAOYSA-N 1 2 320.392 4.084 20 0 DIADLO Fc1ccc2c(ccnc2-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243657695 1057746134 /nfs/dbraw/zinc/74/61/34/1057746134.db2.gz SLVJNAORJQYFDQ-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO COc1ncc(-c2ccc(Cn3cc[nH+]c3)cc2)c2ccccc21 ZINC001243659024 1057746344 /nfs/dbraw/zinc/74/63/44/1057746344.db2.gz YREMEDIHVKLAAC-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO CCc1cc2cc(-c3ccc(Cn4cc[nH+]c4)cc3)cnc2[nH]1 ZINC001243658637 1057746396 /nfs/dbraw/zinc/74/63/96/1057746396.db2.gz GRFZZJKNGGXLQG-UHFFFAOYSA-N 1 2 302.381 4.037 20 0 DIADLO c1csc(-c2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)nn2)c1 ZINC001243658565 1057746423 /nfs/dbraw/zinc/74/64/23/1057746423.db2.gz XWGFCHLAGRHHAT-UHFFFAOYSA-N 1 2 318.405 4.117 20 0 DIADLO Fc1cc2ncccc2cc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243658647 1057746643 /nfs/dbraw/zinc/74/66/43/1057746643.db2.gz GVHPJACDWZZKFO-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO COc1ccnc2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)cc21 ZINC001243658552 1057746754 /nfs/dbraw/zinc/74/67/54/1057746754.db2.gz SWHLIMSFRAHBGT-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO COC(=O)c1cc(C)c(C)cc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243659682 1057746892 /nfs/dbraw/zinc/74/68/92/1057746892.db2.gz ZULFAFPDVQFJEW-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO Cc1cc(C(F)(F)F)ncc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243659438 1057747006 /nfs/dbraw/zinc/74/70/06/1057747006.db2.gz TXNGHYOORBOBED-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO CC(=O)Nc1cc(C)c(C)cc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243659328 1057747096 /nfs/dbraw/zinc/74/70/96/1057747096.db2.gz SILKQVIWWNJPPU-UHFFFAOYSA-N 1 2 319.408 4.174 20 0 DIADLO Fc1ccc(OC(F)F)c(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243661493 1057747912 /nfs/dbraw/zinc/74/79/12/1057747912.db2.gz DPJYURBIXKUEAS-UHFFFAOYSA-N 1 2 318.298 4.339 20 0 DIADLO c1cn(Cc2ccc(-c3cccc(-c4ccncc4)n3)cc2)c[nH+]1 ZINC001243663008 1057748536 /nfs/dbraw/zinc/74/85/36/1057748536.db2.gz SHKUVFNTUNYRRV-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO CCOC(=O)c1cccc(-c2ccc(Cn3cc[nH+]c3)cc2)c1C ZINC001243663738 1057748628 /nfs/dbraw/zinc/74/86/28/1057748628.db2.gz ZXHDXXGUPAFATE-UHFFFAOYSA-N 1 2 320.392 4.084 20 0 DIADLO CC1(C)COc2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)cc21 ZINC001243662384 1057748711 /nfs/dbraw/zinc/74/87/11/1057748711.db2.gz NZFMMEJNBXITPH-UHFFFAOYSA-N 1 2 304.393 4.268 20 0 DIADLO C/C(=C/C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1cccc(F)c1 ZINC000731966019 1057762065 /nfs/dbraw/zinc/76/20/65/1057762065.db2.gz GATIAEATCGCLPU-KAMYIIQDSA-N 1 2 321.355 4.053 20 0 DIADLO Cc1ccc([C@H](C)Nc2cc(N3CCCCC3)nc[nH+]2)s1 ZINC000731984230 1057763831 /nfs/dbraw/zinc/76/38/31/1057763831.db2.gz YMNAJKXWBTWJIA-ZDUSSCGKSA-N 1 2 302.447 4.010 20 0 DIADLO Cc1ccc([C@H](C)Nc2cc(N3CCCCC3)[nH+]cn2)s1 ZINC000731984230 1057763836 /nfs/dbraw/zinc/76/38/36/1057763836.db2.gz YMNAJKXWBTWJIA-ZDUSSCGKSA-N 1 2 302.447 4.010 20 0 DIADLO CC(C)c1nn(C[N@@H+]2CCCC3(CCCCC3)C2)c(=S)n1C ZINC000732190825 1057768669 /nfs/dbraw/zinc/76/86/69/1057768669.db2.gz NROQHNIDEIHGBV-UHFFFAOYSA-N 1 2 322.522 4.078 20 0 DIADLO CC(C)c1nn(C[N@H+]2CCCC3(CCCCC3)C2)c(=S)n1C ZINC000732190825 1057768671 /nfs/dbraw/zinc/76/86/71/1057768671.db2.gz NROQHNIDEIHGBV-UHFFFAOYSA-N 1 2 322.522 4.078 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1ccc(F)c(F)c1 ZINC000732209995 1057769124 /nfs/dbraw/zinc/76/91/24/1057769124.db2.gz YTCWYCDIVVBFCA-BIENJYKASA-N 1 2 317.379 4.315 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@H+]1Cc1ccc(F)c(F)c1 ZINC000732209995 1057769126 /nfs/dbraw/zinc/76/91/26/1057769126.db2.gz YTCWYCDIVVBFCA-BIENJYKASA-N 1 2 317.379 4.315 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1cc(F)ccc1F ZINC000732210241 1057769680 /nfs/dbraw/zinc/76/96/80/1057769680.db2.gz RBZUGEANODBPIU-TYILLQQXSA-N 1 2 317.379 4.315 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@H+]1Cc1cc(F)ccc1F ZINC000732210241 1057769682 /nfs/dbraw/zinc/76/96/82/1057769682.db2.gz RBZUGEANODBPIU-TYILLQQXSA-N 1 2 317.379 4.315 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2ccc(OC)c(SC)c2)cc1 ZINC001243749565 1057770140 /nfs/dbraw/zinc/77/01/40/1057770140.db2.gz MYTLDQGSURIQJE-UHFFFAOYSA-N 1 2 301.411 4.446 20 0 DIADLO COc1ccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)cc1SC ZINC001243753444 1057771266 /nfs/dbraw/zinc/77/12/66/1057771266.db2.gz YCEUUKQPPDLCMD-UHFFFAOYSA-N 1 2 323.408 4.424 20 0 DIADLO Cc1nc(OCC(C)C)ccc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001243801489 1057782526 /nfs/dbraw/zinc/78/25/26/1057782526.db2.gz XKSQHMJPFSMBNH-UHFFFAOYSA-N 1 2 321.424 4.492 20 0 DIADLO Cc1c(-c2ccc(Br)cc2F)ccc2[nH+]ccn21 ZINC001243808282 1057784447 /nfs/dbraw/zinc/78/44/47/1057784447.db2.gz LAABXGVGUAEDLE-UHFFFAOYSA-N 1 2 305.150 4.211 20 0 DIADLO COc1ccc(-c2cccc3[nH+]c(C)cn32)c(OC(F)(F)F)c1 ZINC001243813966 1057785680 /nfs/dbraw/zinc/78/56/80/1057785680.db2.gz WFPJIEKSBYDYFK-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO CC1(C)CCc2cc(-c3cc[nH+]c(N4CCCC4)c3)ccc2O1 ZINC001243915587 1057806054 /nfs/dbraw/zinc/80/60/54/1057806054.db2.gz CMEFDKSBQOUDER-UHFFFAOYSA-N 1 2 308.425 4.452 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc2c(c1)CCC(C)(C)O2 ZINC001243916418 1057806380 /nfs/dbraw/zinc/80/63/80/1057806380.db2.gz LVLKKAOPINNNIE-UHFFFAOYSA-N 1 2 308.381 4.114 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ncc(C(C)C)o2)cc1 ZINC000733305069 1057810782 /nfs/dbraw/zinc/81/07/82/1057810782.db2.gz WZEKKJBGFPWPDF-MRXNPFEDSA-N 1 2 300.402 4.144 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ncc(C(C)C)o2)cc1 ZINC000733305069 1057810784 /nfs/dbraw/zinc/81/07/84/1057810784.db2.gz WZEKKJBGFPWPDF-MRXNPFEDSA-N 1 2 300.402 4.144 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC=C(c3ccc(F)cc3)CC2)o1 ZINC000733306775 1057810932 /nfs/dbraw/zinc/81/09/32/1057810932.db2.gz GFHIFPCKIUZNEC-UHFFFAOYSA-N 1 2 300.377 4.226 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)o1 ZINC000733306775 1057810936 /nfs/dbraw/zinc/81/09/36/1057810936.db2.gz GFHIFPCKIUZNEC-UHFFFAOYSA-N 1 2 300.377 4.226 20 0 DIADLO COCC[N@H+](Cc1ncc(C(C)C)o1)[C@H](C)c1ccccc1 ZINC000733308503 1057811102 /nfs/dbraw/zinc/81/11/02/1057811102.db2.gz KUUGZBOZGSWQJM-OAHLLOKOSA-N 1 2 302.418 4.008 20 0 DIADLO COCC[N@@H+](Cc1ncc(C(C)C)o1)[C@H](C)c1ccccc1 ZINC000733308503 1057811107 /nfs/dbraw/zinc/81/11/07/1057811107.db2.gz KUUGZBOZGSWQJM-OAHLLOKOSA-N 1 2 302.418 4.008 20 0 DIADLO COc1ccc(-c2cc3ncnc(C4=C[NH2+]CCC4)c3s2)cc1 ZINC001243948727 1057817621 /nfs/dbraw/zinc/81/76/21/1057817621.db2.gz KUQMZXUWUKDZOR-UHFFFAOYSA-N 1 2 323.421 4.091 20 0 DIADLO COC(=O)[C@@H](C)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001243976010 1057826457 /nfs/dbraw/zinc/82/64/57/1057826457.db2.gz GAJIUQSSFJQMIA-ZDUSSCGKSA-N 1 2 306.365 4.020 20 0 DIADLO c1c[nH+]c(-c2ccc(-c3ccc(-c4csnn4)cc3)cc2)[nH]1 ZINC001243976372 1057826512 /nfs/dbraw/zinc/82/65/12/1057826512.db2.gz PACGFCSLQMSVHF-UHFFFAOYSA-N 1 2 304.378 4.262 20 0 DIADLO COC(=O)c1cc2[nH]ccc2c(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001243975837 1057826516 /nfs/dbraw/zinc/82/65/16/1057826516.db2.gz CIZLACQGGWBZGI-UHFFFAOYSA-N 1 2 317.348 4.012 20 0 DIADLO CC(=O)Oc1c[nH]c2ccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)cc21 ZINC001243976004 1057826547 /nfs/dbraw/zinc/82/65/47/1057826547.db2.gz FWLJMBQOADVTKH-UHFFFAOYSA-N 1 2 317.348 4.150 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(-c2ncc[nH]2)cc1 ZINC001243977569 1057827114 /nfs/dbraw/zinc/82/71/14/1057827114.db2.gz MVYJHLPZOLIVJJ-UHFFFAOYSA-N 1 2 318.424 4.437 20 0 DIADLO CC1(C)CC(=O)Nc2ccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)cc21 ZINC001243977430 1057827227 /nfs/dbraw/zinc/82/72/27/1057827227.db2.gz GRDMZKIYUOIXIY-UHFFFAOYSA-N 1 2 317.392 4.364 20 0 DIADLO Cc1nc(-c2ccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)cc2)no1 ZINC001243977715 1057827407 /nfs/dbraw/zinc/82/74/07/1057827407.db2.gz TVULMHKAKGLGGT-UHFFFAOYSA-N 1 2 302.337 4.102 20 0 DIADLO FC(F)(F)c1ccc(-c2c[nH+]c3c(c2)CCCN3)c(Cl)c1 ZINC001243982772 1057828647 /nfs/dbraw/zinc/82/86/47/1057828647.db2.gz QMLXPOADRSPAIP-UHFFFAOYSA-N 1 2 312.722 4.422 20 0 DIADLO COC(=O)c1c(C)cc(-c2cccc(-c3c[nH+]cn3C)c2)cc1C ZINC001244006296 1057836587 /nfs/dbraw/zinc/83/65/87/1057836587.db2.gz GCWQIYLIPPCQGI-UHFFFAOYSA-N 1 2 320.392 4.158 20 0 DIADLO COC(=O)c1c(C)cc(-c2ccccc2Cn2cc[nH+]c2)cc1C ZINC001244008488 1057837511 /nfs/dbraw/zinc/83/75/11/1057837511.db2.gz ZRQRKBNFAGBFAC-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO CCOC(=O)c1ccccc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001244027403 1057842762 /nfs/dbraw/zinc/84/27/62/1057842762.db2.gz KUTNDBQDNIQVLB-UHFFFAOYSA-N 1 2 324.424 4.224 20 0 DIADLO Fc1ccc(C2CC2)c(F)c1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001244078032 1057860613 /nfs/dbraw/zinc/86/06/13/1057860613.db2.gz XKGBLAQQUUQTFP-UHFFFAOYSA-N 1 2 311.335 4.149 20 0 DIADLO Cc1cc(-c2cccc(C3CC3)c2C)c[nH+]c1N1CCOCC1 ZINC001244133517 1057882057 /nfs/dbraw/zinc/88/20/57/1057882057.db2.gz YGALGUJVXNTJCV-UHFFFAOYSA-N 1 2 308.425 4.079 20 0 DIADLO c1ccc(N2CCCC2)c(-c2cc[nH+]c(N3CCCCC3)c2)c1 ZINC001244180331 1057892615 /nfs/dbraw/zinc/89/26/15/1057892615.db2.gz VIYHOTYPMPZVTB-UHFFFAOYSA-N 1 2 307.441 4.339 20 0 DIADLO c1cn(Cc2ccc(-c3ccccc3N3CCCC3)cc2)c[nH+]1 ZINC001244181673 1057893357 /nfs/dbraw/zinc/89/33/57/1057893357.db2.gz FRETVLOOEWAWBF-UHFFFAOYSA-N 1 2 303.409 4.199 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc3[nH]c(=O)ccc3c2)cc1 ZINC001244239108 1057906803 /nfs/dbraw/zinc/90/68/03/1057906803.db2.gz PYQCUMAFGRUFKJ-UHFFFAOYSA-N 1 2 301.349 4.008 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2[nH]c(C)cc2c1 ZINC001244243824 1057908458 /nfs/dbraw/zinc/90/84/58/1057908458.db2.gz BAGKRTCMUXPGOZ-UHFFFAOYSA-N 1 2 303.365 4.338 20 0 DIADLO Cc1ncc(C(F)(F)F)cc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001244258325 1057913666 /nfs/dbraw/zinc/91/36/66/1057913666.db2.gz VBXVJOTYPHCDRB-UHFFFAOYSA-N 1 2 321.224 4.072 20 0 DIADLO Cc1cc(-c2ccc(N3CCCCC3)cc2F)cn2cc[nH+]c12 ZINC001244265233 1057916591 /nfs/dbraw/zinc/91/65/91/1057916591.db2.gz UZJIFPWLGLORHZ-UHFFFAOYSA-N 1 2 309.388 4.439 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc3cc[nH]c(=O)c3c2)cc1 ZINC001244312837 1057931406 /nfs/dbraw/zinc/93/14/06/1057931406.db2.gz PVZLMHZOQLMRNV-UHFFFAOYSA-N 1 2 301.349 4.008 20 0 DIADLO Cc1ccc(O)c(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c1 ZINC001244408987 1057952816 /nfs/dbraw/zinc/95/28/16/1057952816.db2.gz NNHLAQIPLYXVET-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO Cc1ccc(O)c(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c1 ZINC001244408987 1057952821 /nfs/dbraw/zinc/95/28/21/1057952821.db2.gz NNHLAQIPLYXVET-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO Fc1ncc(-c2ccccc2)cc1-c1cc(-n2cc[nH+]c2)ccn1 ZINC001244459412 1057964378 /nfs/dbraw/zinc/96/43/78/1057964378.db2.gz UUAQJXVVNLZONZ-UHFFFAOYSA-N 1 2 316.339 4.135 20 0 DIADLO COCOc1ccc(Cl)cc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001244475265 1057970661 /nfs/dbraw/zinc/97/06/61/1057970661.db2.gz IHNRRTTXHSMCHH-UHFFFAOYSA-N 1 2 314.772 4.175 20 0 DIADLO Oc1c(F)cc(-c2cc(N3CCCCC3)cc[nH+]2)cc1Cl ZINC001244501041 1057977344 /nfs/dbraw/zinc/97/73/44/1057977344.db2.gz PXBIRXKVIWDPCN-UHFFFAOYSA-N 1 2 306.768 4.237 20 0 DIADLO Cc1ccc(-c2cc(Cl)cc(OC(F)(F)F)c2)[nH+]c1N ZINC001244522294 1057985061 /nfs/dbraw/zinc/98/50/61/1057985061.db2.gz ZNEYWQXWDOLHAW-UHFFFAOYSA-N 1 2 302.683 4.191 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1-c1cc(-n2cc[nH+]c2)ccn1 ZINC001244536103 1057988535 /nfs/dbraw/zinc/98/85/35/1057988535.db2.gz WNMNXQXBWMPUMP-UHFFFAOYSA-N 1 2 308.143 4.380 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(C)c(O)c(Cl)c1 ZINC001244554726 1057994247 /nfs/dbraw/zinc/99/42/47/1057994247.db2.gz MYOWNEFRSDGUHR-UHFFFAOYSA-N 1 2 314.772 4.215 20 0 DIADLO COc1c(F)cc(-c2ccc3[nH+]ccn3c2C)cc1C(F)(F)F ZINC001244574492 1057999277 /nfs/dbraw/zinc/99/92/77/1057999277.db2.gz OLQBJQGAAILIIQ-UHFFFAOYSA-N 1 2 324.277 4.476 20 0 DIADLO Oc1c(Cl)ccc(-c2cc(C[NH+]3CCCCC3)ccn2)c1F ZINC001244631624 1058014468 /nfs/dbraw/zinc/01/44/68/1058014468.db2.gz VTZLDCKNANSYOH-UHFFFAOYSA-N 1 2 320.795 4.233 20 0 DIADLO Cc1cc(-c2ccc(-c3c[nH+]cn3C)cc2)cnc1OC(C)C ZINC001244689492 1058026547 /nfs/dbraw/zinc/02/65/47/1058026547.db2.gz RCPQKQVBEKWMGL-UHFFFAOYSA-N 1 2 307.397 4.245 20 0 DIADLO CC(=O)c1ccc(-c2ccc(-c3c[nH+]cn3C)cc2)c(F)c1F ZINC001244704565 1058031547 /nfs/dbraw/zinc/03/15/47/1058031547.db2.gz INFSFLKNTNKYRJ-UHFFFAOYSA-N 1 2 312.319 4.235 20 0 DIADLO Cc1cc(-c2c(Cl)cccc2NC(=O)C(C)(C)C)c[nH+]c1N ZINC001244726918 1058036264 /nfs/dbraw/zinc/03/62/64/1058036264.db2.gz DNJLTKNWMVGVFT-UHFFFAOYSA-N 1 2 317.820 4.277 20 0 DIADLO c1cc(-c2ccncc2)cc(-c2cc[nH+]c(N3CCCC3)c2)c1 ZINC001244780708 1058046689 /nfs/dbraw/zinc/04/66/89/1058046689.db2.gz AVVJKBUOSHAKAV-UHFFFAOYSA-N 1 2 301.393 4.411 20 0 DIADLO O=C(O[C@H]1CC=C(c2cccn3cc[nH+]c23)CC1)c1ccccc1 ZINC001244807654 1058051487 /nfs/dbraw/zinc/05/14/87/1058051487.db2.gz UPUCIVACMPUEQH-KRWDZBQOSA-N 1 2 318.376 4.127 20 0 DIADLO COc1cc(-c2cc[nH+]c(N3CCCC3)c2)ccc1OC(C)C ZINC001244885473 1058065761 /nfs/dbraw/zinc/06/57/61/1058065761.db2.gz WXCWXVMANULIKV-UHFFFAOYSA-N 1 2 312.413 4.145 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1c(Cl)ccnc1Cl ZINC001244943033 1058077151 /nfs/dbraw/zinc/07/71/51/1058077151.db2.gz OWMLMZIKKZNIGJ-UHFFFAOYSA-N 1 2 320.179 4.250 20 0 DIADLO Cc1cc(-c2ccc(C3CCC3)cc2)c[nH+]c1N1CCOCC1 ZINC001244943781 1058077911 /nfs/dbraw/zinc/07/79/11/1058077911.db2.gz OKONFQJJKVNMKA-UHFFFAOYSA-N 1 2 308.425 4.161 20 0 DIADLO Cc1c(Cl)c(-c2cccc(-c3c[nH+]cn3C)c2)ccc1CO ZINC001244969238 1058083078 /nfs/dbraw/zinc/08/30/78/1058083078.db2.gz CAPMMAKIOMZRTF-UHFFFAOYSA-N 1 2 312.800 4.208 20 0 DIADLO CNc1cc(-c2ccc3c(c2)ncn3-c2ccccc2)cc[nH+]1 ZINC001244972369 1058083980 /nfs/dbraw/zinc/08/39/80/1058083980.db2.gz FWQGTQXIIYWPKF-UHFFFAOYSA-N 1 2 300.365 4.129 20 0 DIADLO CNc1cc(-c2ccc(OC(F)(F)C(F)(F)F)cc2)cc[nH+]1 ZINC001244971539 1058084155 /nfs/dbraw/zinc/08/41/55/1058084155.db2.gz HVMZJLFSDMCDKI-UHFFFAOYSA-N 1 2 318.245 4.324 20 0 DIADLO OCc1cc(Cl)c(-c2ccc(-n3cc[nH+]c3)cc2)c(Cl)c1 ZINC001245007700 1058090787 /nfs/dbraw/zinc/09/07/87/1058090787.db2.gz KGHLOPUCUHXKFC-UHFFFAOYSA-N 1 2 319.191 4.338 20 0 DIADLO CCOc1cc(C)cc(F)c1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001245015472 1058093488 /nfs/dbraw/zinc/09/34/88/1058093488.db2.gz ZOMCHUAYVAZTHU-UHFFFAOYSA-N 1 2 310.372 4.445 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cccc(Cl)c3Cl)nn2)c1C ZINC001245097430 1058112080 /nfs/dbraw/zinc/11/20/80/1058112080.db2.gz FMAWROLRASZURA-UHFFFAOYSA-N 1 2 319.195 4.253 20 0 DIADLO CCOC(=O)c1ccc(-c2c[nH+]cn2Cc2ccccc2)cc1C ZINC001245197918 1058126376 /nfs/dbraw/zinc/12/63/76/1058126376.db2.gz GQSGPOVNNFVWSH-UHFFFAOYSA-N 1 2 320.392 4.084 20 0 DIADLO c1cc(-c2ccc(-c3c[nH+]cn3Cc3ccccc3)cc2)on1 ZINC001245197943 1058126476 /nfs/dbraw/zinc/12/64/76/1058126476.db2.gz HUGORHKIQBHXIR-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO CCc1cc(NC(C)=O)cc(-c2c[nH+]cn2Cc2ccccc2)c1 ZINC001245196847 1058126548 /nfs/dbraw/zinc/12/65/48/1058126548.db2.gz IOGRCLQEMHMYJO-UHFFFAOYSA-N 1 2 319.408 4.119 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1-c1ccnc(OCC2CCC2)c1 ZINC001245199714 1058127080 /nfs/dbraw/zinc/12/70/80/1058127080.db2.gz DCKJXPTWJBTVEK-UHFFFAOYSA-N 1 2 319.408 4.172 20 0 DIADLO COc1ccc(-c2c[nH+]cn2Cc2ccccc2)cc1SC ZINC001245202000 1058127536 /nfs/dbraw/zinc/12/75/36/1058127536.db2.gz UKNCLTUNXDCFGO-UHFFFAOYSA-N 1 2 310.422 4.329 20 0 DIADLO CCn1ncc2cc(-c3cc(F)c(C[NH+](C)C)c(F)c3)ccc21 ZINC001245237499 1058132430 /nfs/dbraw/zinc/13/24/30/1058132430.db2.gz TXRIEWXXQSMTGL-UHFFFAOYSA-N 1 2 315.367 4.063 20 0 DIADLO c1cn(Cc2ccccc2-c2ccnc(OCC3CCC3)c2)c[nH+]1 ZINC001245239056 1058133136 /nfs/dbraw/zinc/13/31/36/1058133136.db2.gz HAGVHFCGCVYZTQ-UHFFFAOYSA-N 1 2 319.408 4.172 20 0 DIADLO Fc1ccc(-c2ccnc(OCC3CCC3)c2)cc1-n1cc[nH+]c1 ZINC001245240674 1058133876 /nfs/dbraw/zinc/13/38/76/1058133876.db2.gz IKZYBGIJDDJRKA-UHFFFAOYSA-N 1 2 323.371 4.252 20 0 DIADLO Cc1cc2[nH]ccc2c(-c2cccc(Br)c2F)[nH+]1 ZINC001245482538 1058176965 /nfs/dbraw/zinc/17/69/65/1058176965.db2.gz BDFPFPADHGFTJO-UHFFFAOYSA-N 1 2 305.150 4.440 20 0 DIADLO CCC[C@H](C(=O)Nc1cc(C)[nH+]cc1C)c1cccc(Cl)c1 ZINC001527661506 1058196973 /nfs/dbraw/zinc/19/69/73/1058196973.db2.gz GGFPZQGIEOFGSH-INIZCTEOSA-N 1 2 316.832 4.296 20 0 DIADLO Cc1cc(-c2nccc3ccn(Cc4ccccc4)c32)c[nH+]c1N ZINC001245539262 1058219270 /nfs/dbraw/zinc/21/92/70/1058219270.db2.gz WLCCAPSOSFSEDY-UHFFFAOYSA-N 1 2 314.392 4.037 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cc3cc(F)ccc3[nH]2)cc1F ZINC001245575280 1058242716 /nfs/dbraw/zinc/24/27/16/1058242716.db2.gz CWEOMAFZBYIWDA-UHFFFAOYSA-N 1 2 304.315 4.314 20 0 DIADLO COc1cccc(C2CC([N@H+](C)Cc3csc(Cl)n3)C2)c1 ZINC001548858532 1058269168 /nfs/dbraw/zinc/26/91/68/1058269168.db2.gz HPOKQGGJVKKIJT-UHFFFAOYSA-N 1 2 322.861 4.183 20 0 DIADLO COc1cccc(C2CC([N@@H+](C)Cc3csc(Cl)n3)C2)c1 ZINC001548858532 1058269183 /nfs/dbraw/zinc/26/91/83/1058269183.db2.gz HPOKQGGJVKKIJT-UHFFFAOYSA-N 1 2 322.861 4.183 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2Cc2cc(C3CC3)no2)sc1C ZINC001549220522 1058286449 /nfs/dbraw/zinc/28/64/49/1058286449.db2.gz AILNYGZMTYQSHN-MRXNPFEDSA-N 1 2 317.458 4.353 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2Cc2cc(C3CC3)no2)sc1C ZINC001549220522 1058286464 /nfs/dbraw/zinc/28/64/64/1058286464.db2.gz AILNYGZMTYQSHN-MRXNPFEDSA-N 1 2 317.458 4.353 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(-c3ncco3)cc2)c1 ZINC001245624093 1058293716 /nfs/dbraw/zinc/29/37/16/1058293716.db2.gz MJVPSWARQZMEOA-UHFFFAOYSA-N 1 2 301.349 4.409 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3CCCC3(F)F)cc2)[nH+]c1C ZINC001550420150 1058339664 /nfs/dbraw/zinc/33/96/64/1058339664.db2.gz FIBPLFHFVXKXKN-CQSZACIVSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2Cc2cnc(F)cc2C)sc1C ZINC001550622965 1058350446 /nfs/dbraw/zinc/35/04/46/1058350446.db2.gz NNWCVYFDYGHJHC-HNNXBMFYSA-N 1 2 319.449 4.330 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2Cc2cnc(F)cc2C)sc1C ZINC001550622965 1058350461 /nfs/dbraw/zinc/35/04/61/1058350461.db2.gz NNWCVYFDYGHJHC-HNNXBMFYSA-N 1 2 319.449 4.330 20 0 DIADLO c1c(C[N@@H+]2CCC[C@H]3O[C@H](c4ccccc4)C[C@H]32)noc1C1CC1 ZINC001550641064 1058352705 /nfs/dbraw/zinc/35/27/05/1058352705.db2.gz BDOJUWLFNIGYNW-QRVBRYPASA-N 1 2 324.424 4.047 20 0 DIADLO c1c(C[N@H+]2CCC[C@H]3O[C@H](c4ccccc4)C[C@H]32)noc1C1CC1 ZINC001550641064 1058352721 /nfs/dbraw/zinc/35/27/21/1058352721.db2.gz BDOJUWLFNIGYNW-QRVBRYPASA-N 1 2 324.424 4.047 20 0 DIADLO CC[C@H]1CCCC[C@@H]1CNC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001562900479 1058356910 /nfs/dbraw/zinc/35/69/10/1058356910.db2.gz FRWYTCCGJJCZCD-JKSUJKDBSA-N 1 2 303.450 4.345 20 0 DIADLO CCC[C@H](NC(=O)Nc1c(C)cc(C)[nH+]c1C)C1CCCC1 ZINC001562900720 1058356948 /nfs/dbraw/zinc/35/69/48/1058356948.db2.gz PEMOWNOLXOJCFU-INIZCTEOSA-N 1 2 303.450 4.487 20 0 DIADLO CCOC(=O)c1ccc(-c2ccc(-c3c[nH+]cn3C)cc2)cc1C ZINC001245719549 1058392904 /nfs/dbraw/zinc/39/29/04/1058392904.db2.gz NYQZOSSJXNJIHR-UHFFFAOYSA-N 1 2 320.392 4.239 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C[C@@H]2CCC[C@@H]2C)[nH+]c1C ZINC001551740763 1058408356 /nfs/dbraw/zinc/40/83/56/1058408356.db2.gz OCPAHWZMNKDDDA-WFASDCNBSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2CCC(C)(C)C2)[nH+]c1C ZINC001551741543 1058409040 /nfs/dbraw/zinc/40/90/40/1058409040.db2.gz PYPMLICOSMDIJR-AWEZNQCLSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@H]2CC(C)C)[nH+]c1C ZINC001551738011 1058409689 /nfs/dbraw/zinc/40/96/89/1058409689.db2.gz GDOVZSRUFWGOQZ-ZBFHGGJFSA-N 1 2 311.429 4.314 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2CCC(F)(F)C2)[nH+]c1C ZINC001551737368 1058409777 /nfs/dbraw/zinc/40/97/77/1058409777.db2.gz CWRBFYZCFHLWTN-LBPRGKRZSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@]2(C)C(C)C)[nH+]c1C ZINC001551743575 1058410919 /nfs/dbraw/zinc/41/09/19/1058410919.db2.gz XBWVPZFPKKLMQE-HNAYVOBHSA-N 1 2 311.429 4.314 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2CCC(C)(C)C2)[nH+]c1C ZINC001551741545 1058411390 /nfs/dbraw/zinc/41/13/90/1058411390.db2.gz PYPMLICOSMDIJR-CQSZACIVSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1cc(F)c(-c2ccn3cc(N)[nH+]c3c2)c(Cl)c1Cl ZINC001245738277 1058418343 /nfs/dbraw/zinc/41/83/43/1058418343.db2.gz XYAJNIFVUYGXGS-UHFFFAOYSA-N 1 2 310.159 4.338 20 0 DIADLO C/C(=C/C(C)(C)C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001519379798 1058424040 /nfs/dbraw/zinc/42/40/40/1058424040.db2.gz IZCYWIXETLRFMH-BENRWUELSA-N 1 2 317.820 4.457 20 0 DIADLO CSc1ccc(F)c(C)c1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001245755132 1058437989 /nfs/dbraw/zinc/43/79/89/1058437989.db2.gz JFIJEQINDMAZIB-UHFFFAOYSA-N 1 2 313.401 4.163 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1c(C)c(F)ccc1SC ZINC001245759447 1058442451 /nfs/dbraw/zinc/44/24/51/1058442451.db2.gz LZBJJKABJMRBAO-UHFFFAOYSA-N 1 2 302.374 4.179 20 0 DIADLO FC(F)(F)c1ccc([C@H]2OCCC[C@H]2Cn2cc[nH+]c2)cc1 ZINC001552678133 1058448020 /nfs/dbraw/zinc/44/80/20/1058448020.db2.gz OHZQVLLCNCVWHN-DZGCQCFKSA-N 1 2 310.319 4.070 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@@H]2C[C@H](C)CC[C@@H]2C(C)C)c(C)[nH+]1 ZINC001519675464 1058457705 /nfs/dbraw/zinc/45/77/05/1058457705.db2.gz UKPQHESUXKBGGM-JEBQAFNWSA-N 1 2 316.489 4.445 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cnc(Cl)c(Cl)c1Cl ZINC001245806396 1058490202 /nfs/dbraw/zinc/49/02/02/1058490202.db2.gz BDXUKYXFRCFPHL-UHFFFAOYSA-N 1 2 316.619 4.478 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccco3)cc2)[nH+]c1C ZINC001553889039 1058509464 /nfs/dbraw/zinc/50/94/64/1058509464.db2.gz BFRJERKTFFXHDC-JKSUJKDBSA-N 1 2 321.380 4.029 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@@H]2c2ccco2)[nH+]c1C ZINC001553986729 1058512156 /nfs/dbraw/zinc/51/21/56/1058512156.db2.gz GGPYUPZLKFWUTR-GJZGRUSLSA-N 1 2 321.380 4.029 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H](C)Cc2ccco2)[nH+]c1C ZINC001553987708 1058512722 /nfs/dbraw/zinc/51/27/22/1058512722.db2.gz JIAPSEQMKPOTRS-GFCCVEGCSA-N 1 2 323.396 4.104 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C[C@H](C)c2ccco2)[nH+]c1C ZINC001553989933 1058513750 /nfs/dbraw/zinc/51/37/50/1058513750.db2.gz UXOLPVWSDVTXMU-LBPRGKRZSA-N 1 2 323.396 4.419 20 0 DIADLO Cc1ccc(-c2c[nH+]c(N3CCOCC3)cc2C)c(C)c1Cl ZINC001245826795 1058522915 /nfs/dbraw/zinc/52/29/15/1058522915.db2.gz QSJHWBUCPNVSCC-UHFFFAOYSA-N 1 2 316.832 4.164 20 0 DIADLO COc1cc(-c2ccc(-n3cc[nH+]c3)cc2)c(F)c(F)c1Cl ZINC001245856912 1058562484 /nfs/dbraw/zinc/56/24/84/1058562484.db2.gz NXPPXIRIPCYRLP-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO COc1cc(-c2ccc3[nH+]c(C)cn3c2)c(F)c(F)c1Cl ZINC001245862073 1058570764 /nfs/dbraw/zinc/57/07/64/1058570764.db2.gz LIOXCXOKOJQWLH-UHFFFAOYSA-N 1 2 308.715 4.250 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1ccc(C2CCC2)cc1)n1cc[nH+]c1 ZINC001556406988 1058588218 /nfs/dbraw/zinc/58/82/18/1058588218.db2.gz GLCMDNBKWJICEU-GOSISDBHSA-N 1 2 311.429 4.377 20 0 DIADLO CC(C)C[C@@H](C(=O)N(C)c1ccccc1C(C)C)n1cc[nH+]c1 ZINC001556888131 1058663749 /nfs/dbraw/zinc/66/37/49/1058663749.db2.gz MEUXHPLOQWVTSL-SFHVURJKSA-N 1 2 313.445 4.257 20 0 DIADLO CC(C)C[C@H](C(=O)N[C@H](C)c1ccc(Cl)cc1)n1cc[nH+]c1 ZINC001556942376 1058673088 /nfs/dbraw/zinc/67/30/88/1058673088.db2.gz YVQJDHIWXUAJGT-CZUORRHYSA-N 1 2 319.836 4.001 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1 ZINC001520814112 1058692806 /nfs/dbraw/zinc/69/28/06/1058692806.db2.gz JYAZVALGNBVPKN-LJQANCHMSA-N 1 2 319.493 4.187 20 0 DIADLO CC(C)=C(C)C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001521241970 1058797290 /nfs/dbraw/zinc/79/72/90/1058797290.db2.gz LAKMIZBBXIIVGJ-UHFFFAOYSA-N 1 2 310.397 4.148 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)CCCC2CCCC2)[nH+]c1C ZINC001558351899 1058860831 /nfs/dbraw/zinc/86/08/31/1058860831.db2.gz OBCOTBQFCZCXMZ-MRXNPFEDSA-N 1 2 303.450 4.051 20 0 DIADLO Cc1cc(NCCCOC2CCCCC2)nc(C2CCC2)[nH+]1 ZINC001559056331 1058953157 /nfs/dbraw/zinc/95/31/57/1058953157.db2.gz CPUYALYPRXMLBI-UHFFFAOYSA-N 1 2 303.450 4.204 20 0 DIADLO CCc1nc(N(Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)cc(C)[nH+]1 ZINC001559067005 1058963803 /nfs/dbraw/zinc/96/38/03/1058963803.db2.gz SMARECDWHQMHEK-WBMJQRKESA-N 1 2 311.429 4.233 20 0 DIADLO CCc1cc(N(C)CCc2cccc3ccccc32)nc(CC)[nH+]1 ZINC001559088666 1058978744 /nfs/dbraw/zinc/97/87/44/1058978744.db2.gz INHONCYNQOQWGH-UHFFFAOYSA-N 1 2 319.452 4.434 20 0 DIADLO CCc1cc(N2C[C@H](c3ccc(F)cc3)C[C@H]2C)nc(CC)[nH+]1 ZINC001559109439 1058995750 /nfs/dbraw/zinc/99/57/50/1058995750.db2.gz TWMFLYMKUZQQBJ-UKRRQHHQSA-N 1 2 313.420 4.123 20 0 DIADLO CCc1cc(N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)nc(CC)[nH+]1 ZINC001559109438 1058996507 /nfs/dbraw/zinc/99/65/07/1058996507.db2.gz TWMFLYMKUZQQBJ-HIFRSBDPSA-N 1 2 313.420 4.123 20 0 DIADLO CC[C@@H](Cc1ccccc1C(F)(F)F)Nc1cc[nH+]c(C)n1 ZINC001559117250 1059003009 /nfs/dbraw/zinc/00/30/09/1059003009.db2.gz JOAOYEGVSXSRNT-ZDUSSCGKSA-N 1 2 309.335 4.237 20 0 DIADLO Cc1cnc([C@@H](Nc2cc(C)[nH+]c(C3CCC3)n2)C2CC2)s1 ZINC001559119931 1059008264 /nfs/dbraw/zinc/00/82/64/1059008264.db2.gz YQUSMIQXMKZSJN-HNNXBMFYSA-N 1 2 314.458 4.381 20 0 DIADLO Cc1nc(NC[C@H](Cc2ccccc2)c2ccccc2)cc[nH+]1 ZINC001559120895 1059009019 /nfs/dbraw/zinc/00/90/19/1059009019.db2.gz INRNCXIGISLGRH-IBGZPJMESA-N 1 2 303.409 4.223 20 0 DIADLO CO[C@@H]1C[C@H](N(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)C12CCC2 ZINC001559189896 1059073543 /nfs/dbraw/zinc/07/35/43/1059073543.db2.gz FFOHJMAROPUDHW-JKSUJKDBSA-N 1 2 317.477 4.117 20 0 DIADLO CC(C)c1cc(N2CC(c3ccc(F)cc3)C2)nc(C(C)C)[nH+]1 ZINC001559198057 1059078672 /nfs/dbraw/zinc/07/86/72/1059078672.db2.gz YCOGPADQGVQJGY-UHFFFAOYSA-N 1 2 313.420 4.466 20 0 DIADLO CC(C)c1cc(NC[C@]2(O)CCCC2(C)C)nc(C(C)C)[nH+]1 ZINC001559198859 1059079017 /nfs/dbraw/zinc/07/90/17/1059079017.db2.gz ZEOQUPYAPHEXCM-GOSISDBHSA-N 1 2 305.466 4.077 20 0 DIADLO Cc1nc(N[C@H](C)c2ccc(Cl)cc2)c2c([nH+]1)CCCC2 ZINC001559207434 1059088869 /nfs/dbraw/zinc/08/88/69/1059088869.db2.gz PGQHXAHMKXQMTG-LLVKDONJSA-N 1 2 301.821 4.490 20 0 DIADLO Cc1nc(N(C)[C@H]2CCC[C@@H]2C(C)(C)C)c2c([nH+]1)CCCC2 ZINC001559216044 1059095746 /nfs/dbraw/zinc/09/57/46/1059095746.db2.gz MILRSYWTYHLTPG-RDJZCZTQSA-N 1 2 301.478 4.315 20 0 DIADLO Cc1nc(N(C)[C@H]2CCC[C@H]2C(C)(C)C)c2c([nH+]1)CCCC2 ZINC001559216045 1059096483 /nfs/dbraw/zinc/09/64/83/1059096483.db2.gz MILRSYWTYHLTPG-WBVHZDCISA-N 1 2 301.478 4.315 20 0 DIADLO Cc1cc(N2CCc3ccc(C(C)C)cc3C2)nc(C2CC2)[nH+]1 ZINC001559230438 1059106600 /nfs/dbraw/zinc/10/66/00/1059106600.db2.gz CSPLOFXJBWKNOK-UHFFFAOYSA-N 1 2 307.441 4.349 20 0 DIADLO Cc1cccc(C(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)c1F ZINC001522599349 1059120437 /nfs/dbraw/zinc/12/04/37/1059120437.db2.gz ZUEDDRCUBFBYSE-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO Cc1ccc(CSc2nccn2-c2ccccc2C)c(C)[nH+]1 ZINC001559343555 1059173480 /nfs/dbraw/zinc/17/34/80/1059173480.db2.gz YWIHYKVCWBCMDC-UHFFFAOYSA-N 1 2 309.438 4.485 20 0 DIADLO [NH3+][C@H](Cc1ccccc1)c1nc2cc(Cl)cc(Cl)c2[nH]1 ZINC001247012737 1059244063 /nfs/dbraw/zinc/24/40/63/1059244063.db2.gz BPTUABBFZJWWEH-GFCCVEGCSA-N 1 2 306.196 4.112 20 0 DIADLO COc1ccccc1Cc1cn(Cc2cc(C)cc(C)c2)c[nH+]1 ZINC001559479264 1059254140 /nfs/dbraw/zinc/25/41/40/1059254140.db2.gz YAHMXFVVPOHZCQ-UHFFFAOYSA-N 1 2 306.409 4.148 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+](Cc1nsc3ccccc31)CC2 ZINC001559502840 1059286144 /nfs/dbraw/zinc/28/61/44/1059286144.db2.gz QIJIVZOANBQALS-UHFFFAOYSA-N 1 2 324.449 4.253 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+](Cc1nsc3ccccc31)CC2 ZINC001559502840 1059286164 /nfs/dbraw/zinc/28/61/64/1059286164.db2.gz QIJIVZOANBQALS-UHFFFAOYSA-N 1 2 324.449 4.253 20 0 DIADLO CC(C)(C)SCC[N@@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC001559533712 1059336022 /nfs/dbraw/zinc/33/60/22/1059336022.db2.gz SHPRMHDOXTUNQT-OAHLLOKOSA-N 1 2 313.894 4.245 20 0 DIADLO CC(C)(C)SCC[N@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC001559533712 1059336042 /nfs/dbraw/zinc/33/60/42/1059336042.db2.gz SHPRMHDOXTUNQT-OAHLLOKOSA-N 1 2 313.894 4.245 20 0 DIADLO CC(C)(C)SCC[N@@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC001559533711 1059336266 /nfs/dbraw/zinc/33/62/66/1059336266.db2.gz SHPRMHDOXTUNQT-HNNXBMFYSA-N 1 2 313.894 4.245 20 0 DIADLO CC(C)(C)SCC[N@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC001559533711 1059336290 /nfs/dbraw/zinc/33/62/90/1059336290.db2.gz SHPRMHDOXTUNQT-HNNXBMFYSA-N 1 2 313.894 4.245 20 0 DIADLO CCc1cccc(-c2noc([C@@H]3CCC[N@@H+]3Cc3ccco3)n2)c1 ZINC001247224106 1059349973 /nfs/dbraw/zinc/34/99/73/1059349973.db2.gz FHOWZCCQGAPRSH-KRWDZBQOSA-N 1 2 323.396 4.229 20 0 DIADLO CCc1cccc(-c2noc([C@@H]3CCC[N@H+]3Cc3ccco3)n2)c1 ZINC001247224106 1059349993 /nfs/dbraw/zinc/34/99/93/1059349993.db2.gz FHOWZCCQGAPRSH-KRWDZBQOSA-N 1 2 323.396 4.229 20 0 DIADLO Cc1cc(C)cc(-c2noc([C@@H]3CCC[N@@H+]3Cc3ccco3)n2)c1 ZINC001247226337 1059352916 /nfs/dbraw/zinc/35/29/16/1059352916.db2.gz UDSQAVJFUQTSKG-KRWDZBQOSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cc(C)cc(-c2noc([C@@H]3CCC[N@H+]3Cc3ccco3)n2)c1 ZINC001247226337 1059352938 /nfs/dbraw/zinc/35/29/38/1059352938.db2.gz UDSQAVJFUQTSKG-KRWDZBQOSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1ccc(-c2noc([C@@H](C)n3cc[nH+]c3)n2)c2ccccc12 ZINC001247257867 1059361596 /nfs/dbraw/zinc/36/15/96/1059361596.db2.gz SYJGUAHQDPLNSB-CYBMUJFWSA-N 1 2 304.353 4.004 20 0 DIADLO CC(C)c1ccc(-c2noc([C@@H]3CCCc4[nH]c[nH+]c43)n2)cc1 ZINC001247273070 1059366293 /nfs/dbraw/zinc/36/62/93/1059366293.db2.gz RFLMZRQCJRHEBO-CQSZACIVSA-N 1 2 308.385 4.051 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2c(F)cncc2F)cc1 ZINC001559560633 1059379792 /nfs/dbraw/zinc/37/97/92/1059379792.db2.gz OQTAFKNOFHFKEZ-GOSISDBHSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2c(F)cncc2F)cc1 ZINC001559560633 1059379815 /nfs/dbraw/zinc/37/98/15/1059379815.db2.gz OQTAFKNOFHFKEZ-GOSISDBHSA-N 1 2 302.368 4.395 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC001559603285 1059437407 /nfs/dbraw/zinc/43/74/07/1059437407.db2.gz QCVVCWCIEQTYJO-QWHCGFSZSA-N 1 2 309.837 4.207 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC001559603285 1059437413 /nfs/dbraw/zinc/43/74/13/1059437413.db2.gz QCVVCWCIEQTYJO-QWHCGFSZSA-N 1 2 309.837 4.207 20 0 DIADLO CCOC(=O)C[N@H+](Cc1ccc(C)cc1)[C@H]1CCc2ccccc21 ZINC001559640531 1059466140 /nfs/dbraw/zinc/46/61/40/1059466140.db2.gz XUDBXIPXHGVUDW-FQEVSTJZSA-N 1 2 323.436 4.048 20 0 DIADLO CCOC(=O)C[N@@H+](Cc1ccc(C)cc1)[C@H]1CCc2ccccc21 ZINC001559640531 1059466154 /nfs/dbraw/zinc/46/61/54/1059466154.db2.gz XUDBXIPXHGVUDW-FQEVSTJZSA-N 1 2 323.436 4.048 20 0 DIADLO CC(C)(C)c1ccc(CCC(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001524620003 1059557162 /nfs/dbraw/zinc/55/71/62/1059557162.db2.gz YUQUVCZOJHBXCH-UHFFFAOYSA-N 1 2 321.424 4.203 20 0 DIADLO C/C(=C\c1ccccc1Cl)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001524618985 1059557648 /nfs/dbraw/zinc/55/76/48/1059557648.db2.gz GLOBTYTZJIXGQQ-ZRDIBKRKSA-N 1 2 311.772 4.030 20 0 DIADLO CCCc1nc(C[NH2+][C@H](C)c2sc3ccccc3c2C)no1 ZINC001559729795 1059563323 /nfs/dbraw/zinc/56/33/23/1059563323.db2.gz LDONBHUVTNZYGD-GFCCVEGCSA-N 1 2 315.442 4.396 20 0 DIADLO Fc1cccc(F)c1C[N@H+](C[C@@H]1CCC2(CCC2)CO1)C1CC1 ZINC001559746113 1059577961 /nfs/dbraw/zinc/57/79/61/1059577961.db2.gz NJKIJJAJDGNAHS-HNNXBMFYSA-N 1 2 321.411 4.279 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](C[C@@H]1CCC2(CCC2)CO1)C1CC1 ZINC001559746113 1059577973 /nfs/dbraw/zinc/57/79/73/1059577973.db2.gz NJKIJJAJDGNAHS-HNNXBMFYSA-N 1 2 321.411 4.279 20 0 DIADLO CCc1cccc(C[N@@H+]2CCc3[nH]c4ccc(F)cc4c3C2)c1 ZINC001559745453 1059578103 /nfs/dbraw/zinc/57/81/03/1059578103.db2.gz QVYRSBCBOYFLCQ-UHFFFAOYSA-N 1 2 308.400 4.428 20 0 DIADLO CCc1cccc(C[N@H+]2CCc3[nH]c4ccc(F)cc4c3C2)c1 ZINC001559745453 1059578126 /nfs/dbraw/zinc/57/81/26/1059578126.db2.gz QVYRSBCBOYFLCQ-UHFFFAOYSA-N 1 2 308.400 4.428 20 0 DIADLO COc1cccc(C[N@H+](Cc2c(F)cccc2F)C2CC2)c1C ZINC001559746268 1059578785 /nfs/dbraw/zinc/57/87/85/1059578785.db2.gz SSRNLYBTZCWSTN-UHFFFAOYSA-N 1 2 317.379 4.446 20 0 DIADLO COc1cccc(C[N@@H+](Cc2c(F)cccc2F)C2CC2)c1C ZINC001559746268 1059578798 /nfs/dbraw/zinc/57/87/98/1059578798.db2.gz SSRNLYBTZCWSTN-UHFFFAOYSA-N 1 2 317.379 4.446 20 0 DIADLO [NH3+][C@@H](c1nc(-c2cc(Cl)ccc2Cl)no1)c1ccccc1 ZINC001247649852 1059585410 /nfs/dbraw/zinc/58/54/10/1059585410.db2.gz CTNCPMMDSDUIMV-CYBMUJFWSA-N 1 2 320.179 4.092 20 0 DIADLO [NH3+][C@H](c1nc(-c2ccc(Cl)cc2Cl)no1)c1ccccc1 ZINC001247652734 1059590145 /nfs/dbraw/zinc/59/01/45/1059590145.db2.gz YNTXCUFTMFKFNQ-ZDUSSCGKSA-N 1 2 320.179 4.092 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@@H+](Cc1nccn1-c1ccccc1)CC2 ZINC001559762586 1059597365 /nfs/dbraw/zinc/59/73/65/1059597365.db2.gz PPHSTLLCGDKWIL-UHFFFAOYSA-N 1 2 317.436 4.047 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@H+](Cc1nccn1-c1ccccc1)CC2 ZINC001559762586 1059597384 /nfs/dbraw/zinc/59/73/84/1059597384.db2.gz PPHSTLLCGDKWIL-UHFFFAOYSA-N 1 2 317.436 4.047 20 0 DIADLO CCOC(=O)[C@H](CC)[N@H+](C/C=C/c1ccc(Cl)cc1)C1CC1 ZINC001559766041 1059600141 /nfs/dbraw/zinc/60/01/41/1059600141.db2.gz WMFGKFSVHFBYGV-RTRPANQVSA-N 1 2 321.848 4.159 20 0 DIADLO CCOC(=O)[C@H](CC)[N@@H+](C/C=C/c1ccc(Cl)cc1)C1CC1 ZINC001559766041 1059600155 /nfs/dbraw/zinc/60/01/55/1059600155.db2.gz WMFGKFSVHFBYGV-RTRPANQVSA-N 1 2 321.848 4.159 20 0 DIADLO C[C@H]1CCCC[C@H]1c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001247734539 1059605671 /nfs/dbraw/zinc/60/56/71/1059605671.db2.gz LOHIVSLZFLUZIF-UONOGXRCSA-N 1 2 308.385 4.216 20 0 DIADLO Clc1ccccc1CCC[N@@H+]1CCC=C(Br)C1 ZINC001559788616 1059625103 /nfs/dbraw/zinc/62/51/03/1059625103.db2.gz LTSXMNGKYZJLCO-UHFFFAOYSA-N 1 2 314.654 4.257 20 0 DIADLO Clc1ccccc1CCC[N@H+]1CCC=C(Br)C1 ZINC001559788616 1059625116 /nfs/dbraw/zinc/62/51/16/1059625116.db2.gz LTSXMNGKYZJLCO-UHFFFAOYSA-N 1 2 314.654 4.257 20 0 DIADLO CC1=CC[C@H](c2nc(-c3ccccc3-n3cc[nH+]c3)no2)CC1 ZINC001247763430 1059616483 /nfs/dbraw/zinc/61/64/83/1059616483.db2.gz KXPHXSFTQHHRBN-AWEZNQCLSA-N 1 2 306.369 4.136 20 0 DIADLO CC1=C(Br)C[N@@H+]([C@@H]2C[C@H]2c2cccc(F)c2)CC1 ZINC001559793692 1059628211 /nfs/dbraw/zinc/62/82/11/1059628211.db2.gz XXSBVULBBDKBNP-DZGCQCFKSA-N 1 2 310.210 4.056 20 0 DIADLO CC1=C(Br)C[N@H+]([C@@H]2C[C@H]2c2cccc(F)c2)CC1 ZINC001559793692 1059628217 /nfs/dbraw/zinc/62/82/17/1059628217.db2.gz XXSBVULBBDKBNP-DZGCQCFKSA-N 1 2 310.210 4.056 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2cc(C)ccc2F)c1Cl ZINC001559795789 1059629708 /nfs/dbraw/zinc/62/97/08/1059629708.db2.gz OSMUAQGJXVOBMN-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2cc(C)ccc2F)c1Cl ZINC001559795789 1059629722 /nfs/dbraw/zinc/62/97/22/1059629722.db2.gz OSMUAQGJXVOBMN-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO C[C@H]1C[N@H+](CCc2cccc(Cl)c2Cl)C[C@H](C2CC2)O1 ZINC001559802218 1059639390 /nfs/dbraw/zinc/63/93/90/1059639390.db2.gz ULQZTRLHZLYRQL-XHDPSFHLSA-N 1 2 314.256 4.035 20 0 DIADLO C[C@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)C[C@H](C2CC2)O1 ZINC001559802218 1059639404 /nfs/dbraw/zinc/63/94/04/1059639404.db2.gz ULQZTRLHZLYRQL-XHDPSFHLSA-N 1 2 314.256 4.035 20 0 DIADLO CC(C)c1cccc2c1CC[N@H+](Cc1ccc(Cl)nc1)C2 ZINC001559806917 1059642841 /nfs/dbraw/zinc/64/28/41/1059642841.db2.gz MKCHGSUMOSEICO-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1cccc2c1CC[N@@H+](Cc1ccc(Cl)nc1)C2 ZINC001559806917 1059642858 /nfs/dbraw/zinc/64/28/58/1059642858.db2.gz MKCHGSUMOSEICO-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1cc(F)ccc1Cl)C2 ZINC001559859433 1059681090 /nfs/dbraw/zinc/68/10/90/1059681090.db2.gz CRSQNJXVPPMQKH-UHFFFAOYSA-N 1 2 317.791 4.232 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@H+](Cc1cc(F)ccc1Cl)C2 ZINC001559859433 1059681109 /nfs/dbraw/zinc/68/11/09/1059681109.db2.gz CRSQNJXVPPMQKH-UHFFFAOYSA-N 1 2 317.791 4.232 20 0 DIADLO Cc1ccc(Cl)cc1N(C)Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001559871958 1059692631 /nfs/dbraw/zinc/69/26/31/1059692631.db2.gz KBFKOOYOCUELAS-UHFFFAOYSA-N 1 2 311.816 4.471 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001559876358 1059695837 /nfs/dbraw/zinc/69/58/37/1059695837.db2.gz TYLAIRXMHDUURM-CHWSQXEVSA-N 1 2 303.352 4.309 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001559876358 1059695851 /nfs/dbraw/zinc/69/58/51/1059695851.db2.gz TYLAIRXMHDUURM-CHWSQXEVSA-N 1 2 303.352 4.309 20 0 DIADLO Clc1ccc(C[N@@H+]2CCSC[C@H]2C2CCC2)c(Cl)n1 ZINC001559926013 1059739593 /nfs/dbraw/zinc/73/95/93/1059739593.db2.gz HIZVILHXUILXRJ-LBPRGKRZSA-N 1 2 317.285 4.106 20 0 DIADLO Clc1ccc(C[N@H+]2CCSC[C@H]2C2CCC2)c(Cl)n1 ZINC001559926013 1059739611 /nfs/dbraw/zinc/73/96/11/1059739611.db2.gz HIZVILHXUILXRJ-LBPRGKRZSA-N 1 2 317.285 4.106 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@@H](c3cccc(F)c3)[C@@H]2C)cs1 ZINC001559937669 1059754940 /nfs/dbraw/zinc/75/49/40/1059754940.db2.gz JFIVIJYJLMAKKY-SUMWQHHRSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@@H](c3cccc(F)c3)[C@@H]2C)cs1 ZINC001559937669 1059754962 /nfs/dbraw/zinc/75/49/62/1059754962.db2.gz JFIVIJYJLMAKKY-SUMWQHHRSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1cc(Cl)ccc1NC(=S)Nc1ccc2[nH+]ccn2c1 ZINC001248367880 1059798684 /nfs/dbraw/zinc/79/86/84/1059798684.db2.gz LXJDKCDVQDJREE-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO CC[C@@H]1CC[C@@H](C)[N@H+](Cc2nc(C)c(Br)s2)C1 ZINC001560004092 1059814203 /nfs/dbraw/zinc/81/42/03/1059814203.db2.gz UJPINGXHKVLLCN-MWLCHTKSSA-N 1 2 317.296 4.225 20 0 DIADLO CC[C@@H]1CC[C@@H](C)[N@@H+](Cc2nc(C)c(Br)s2)C1 ZINC001560004092 1059814223 /nfs/dbraw/zinc/81/42/23/1059814223.db2.gz UJPINGXHKVLLCN-MWLCHTKSSA-N 1 2 317.296 4.225 20 0 DIADLO Cc1ccn2cc(C[N@@H+](C)Cc3c4ccoc4ccc3F)nc2c1 ZINC001248545796 1059880213 /nfs/dbraw/zinc/88/02/13/1059880213.db2.gz PKAZCINGNWXXJH-UHFFFAOYSA-N 1 2 323.371 4.160 20 0 DIADLO Cc1ccn2cc(C[N@H+](C)Cc3c4ccoc4ccc3F)nc2c1 ZINC001248545796 1059880243 /nfs/dbraw/zinc/88/02/43/1059880243.db2.gz PKAZCINGNWXXJH-UHFFFAOYSA-N 1 2 323.371 4.160 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@H+](Cc2cccc(Cl)n2)C1 ZINC001560081928 1059893674 /nfs/dbraw/zinc/89/36/74/1059893674.db2.gz QBCJEDQEUIUWCG-QGZVFWFLSA-N 1 2 304.796 4.196 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@@H+](Cc2cccc(Cl)n2)C1 ZINC001560081928 1059893693 /nfs/dbraw/zinc/89/36/93/1059893693.db2.gz QBCJEDQEUIUWCG-QGZVFWFLSA-N 1 2 304.796 4.196 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@H+]([C@@H](C)c1ccc(F)nc1)CC2 ZINC001560089576 1059896876 /nfs/dbraw/zinc/89/68/76/1059896876.db2.gz OVDITIJGINYKPR-LBPRGKRZSA-N 1 2 304.796 4.302 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@@H+]([C@@H](C)c1ccc(F)nc1)CC2 ZINC001560089576 1059896899 /nfs/dbraw/zinc/89/68/99/1059896899.db2.gz OVDITIJGINYKPR-LBPRGKRZSA-N 1 2 304.796 4.302 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H]2CCC[C@@H](c3ccccc3)C2)c(C)[nH+]1 ZINC001525522462 1059922957 /nfs/dbraw/zinc/92/29/57/1059922957.db2.gz HHYRODPLNIOCTE-MOPGFXCFSA-N 1 2 322.452 4.463 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2Cc2ccc(Cl)c(F)c2)[nH+]c1C ZINC001560137553 1059939568 /nfs/dbraw/zinc/93/95/68/1059939568.db2.gz GVKYQYUMVHMIHV-OAHLLOKOSA-N 1 2 307.800 4.156 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1ncc(C(F)(F)F)cc1F)C2 ZINC001248787349 1059973608 /nfs/dbraw/zinc/97/36/08/1059973608.db2.gz YVFLTDJTEBIGCI-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1ncc(C(F)(F)F)cc1F)C2 ZINC001248787349 1059973633 /nfs/dbraw/zinc/97/36/33/1059973633.db2.gz YVFLTDJTEBIGCI-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1ncc(C(F)(F)F)cc1F)CC2 ZINC001248787265 1059975106 /nfs/dbraw/zinc/97/51/06/1059975106.db2.gz VHDZUEJMJLHFLW-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1ncc(C(F)(F)F)cc1F)CC2 ZINC001248787265 1059975128 /nfs/dbraw/zinc/97/51/28/1059975128.db2.gz VHDZUEJMJLHFLW-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO CC[C@H](c1ccc(Br)cc1)[N@@H+]1CCC[C@H](F)C1 ZINC001560205180 1059986085 /nfs/dbraw/zinc/98/60/85/1059986085.db2.gz NYGMNANRFLZGGR-UONOGXRCSA-N 1 2 300.215 4.334 20 0 DIADLO CC[C@H](c1ccc(Br)cc1)[N@H+]1CCC[C@H](F)C1 ZINC001560205180 1059986101 /nfs/dbraw/zinc/98/61/01/1059986101.db2.gz NYGMNANRFLZGGR-UONOGXRCSA-N 1 2 300.215 4.334 20 0 DIADLO CC(C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1)=C1CCC1 ZINC001525682257 1059988305 /nfs/dbraw/zinc/98/83/05/1059988305.db2.gz IRSBAWDSMRERAL-UHFFFAOYSA-N 1 2 322.408 4.292 20 0 DIADLO CCCCCC[N@H+](Cc1ccco1)[C@@H](C)C(=O)OC(C)(C)C ZINC001560208841 1059988678 /nfs/dbraw/zinc/98/86/78/1059988678.db2.gz NOSMBBIHLAVCNZ-HNNXBMFYSA-N 1 2 309.450 4.392 20 0 DIADLO CCCCCC[N@@H+](Cc1ccco1)[C@@H](C)C(=O)OC(C)(C)C ZINC001560208841 1059988701 /nfs/dbraw/zinc/98/87/01/1059988701.db2.gz NOSMBBIHLAVCNZ-HNNXBMFYSA-N 1 2 309.450 4.392 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1cnc2ccccc2c1Cl ZINC001248813508 1059989909 /nfs/dbraw/zinc/98/99/09/1059989909.db2.gz ZVDLRVZYXBDYIV-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1cnc2ccccc2c1Cl ZINC001248813508 1059989930 /nfs/dbraw/zinc/98/99/30/1059989930.db2.gz ZVDLRVZYXBDYIV-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@@H+](Cc1cccnc1Cl)C2 ZINC001560241046 1060007306 /nfs/dbraw/zinc/00/73/06/1060007306.db2.gz BVKFBPZDDPFZFI-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@H+](Cc1cccnc1Cl)C2 ZINC001560241046 1060007327 /nfs/dbraw/zinc/00/73/27/1060007327.db2.gz BVKFBPZDDPFZFI-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CCNc1nc(C[N@@H+]2CCc3cc(C(C)C)ccc3C2)cs1 ZINC001560241897 1060009165 /nfs/dbraw/zinc/00/91/65/1060009165.db2.gz RZAYSORLVSWWHL-UHFFFAOYSA-N 1 2 315.486 4.257 20 0 DIADLO CCNc1nc(C[N@H+]2CCc3cc(C(C)C)ccc3C2)cs1 ZINC001560241897 1060009185 /nfs/dbraw/zinc/00/91/85/1060009185.db2.gz RZAYSORLVSWWHL-UHFFFAOYSA-N 1 2 315.486 4.257 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2nc3ccc(C)cc3[nH]2)c1 ZINC001248843104 1060014908 /nfs/dbraw/zinc/01/49/08/1060014908.db2.gz XRKCKJFLGTYRCO-LJQANCHMSA-N 1 2 321.424 4.217 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2nc3ccc(C)cc3[nH]2)c1 ZINC001248843104 1060014927 /nfs/dbraw/zinc/01/49/27/1060014927.db2.gz XRKCKJFLGTYRCO-LJQANCHMSA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2nc3ccc(C)cc3[nH]2)cc1 ZINC001248842024 1060016887 /nfs/dbraw/zinc/01/68/87/1060016887.db2.gz COLGVWQOIJNIOK-LJQANCHMSA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2nc3ccc(C)cc3[nH]2)cc1 ZINC001248842024 1060016908 /nfs/dbraw/zinc/01/69/08/1060016908.db2.gz COLGVWQOIJNIOK-LJQANCHMSA-N 1 2 321.424 4.217 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CCC[C@H]3c3ccccc3F)nc2c1 ZINC001248842373 1060018193 /nfs/dbraw/zinc/01/81/93/1060018193.db2.gz RZDOFTFMEHLKAO-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CCC[C@H]3c3ccccc3F)nc2c1 ZINC001248842373 1060018218 /nfs/dbraw/zinc/01/82/18/1060018218.db2.gz RZDOFTFMEHLKAO-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1nc2cccc(Br)c2o1 ZINC001248847952 1060020356 /nfs/dbraw/zinc/02/03/56/1060020356.db2.gz IHHLTONBZPWWQC-GHMZBOCLSA-N 1 2 323.234 4.353 20 0 DIADLO Cc1cc(CNC(=O)/C=C\c2ccc(C(C)(C)C)cc2)cc(C)[nH+]1 ZINC001525866025 1060059975 /nfs/dbraw/zinc/05/99/75/1060059975.db2.gz SPGHYPRXTMXDCZ-FLIBITNWSA-N 1 2 322.452 4.326 20 0 DIADLO CCOc1ccccc1C[NH2+]Cc1coc(-c2ccccc2)n1 ZINC001560285596 1060065036 /nfs/dbraw/zinc/06/50/36/1060065036.db2.gz ZMDBLTZFAMJHLA-UHFFFAOYSA-N 1 2 308.381 4.030 20 0 DIADLO CCC1(CC)C[C@H]1c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001248946546 1060073858 /nfs/dbraw/zinc/07/38/58/1060073858.db2.gz CXUQZSMXJQFOCC-AWEZNQCLSA-N 1 2 308.385 4.216 20 0 DIADLO c1cn(-c2ccc(-c3noc([C@H]4CC45CCCCC5)n3)cc2)c[nH+]1 ZINC001248951370 1060082209 /nfs/dbraw/zinc/08/22/09/1060082209.db2.gz NGGUIZGBVGIOHX-MRXNPFEDSA-N 1 2 320.396 4.360 20 0 DIADLO [NH3+][C@H](c1nc(-c2ccccc2Cl)no1)c1ccc(Cl)cc1 ZINC001248997136 1060103918 /nfs/dbraw/zinc/10/39/18/1060103918.db2.gz DFITZLLRVGUZRL-ZDUSSCGKSA-N 1 2 320.179 4.092 20 0 DIADLO Cc1cc(C[N@@H+]2CCSc3ccccc3C2)c(Cl)nc1C ZINC001249036791 1060128425 /nfs/dbraw/zinc/12/84/25/1060128425.db2.gz PFYROISSCCWBGC-UHFFFAOYSA-N 1 2 318.873 4.460 20 0 DIADLO Cc1cc(C[N@H+]2CCSc3ccccc3C2)c(Cl)nc1C ZINC001249036791 1060128430 /nfs/dbraw/zinc/12/84/30/1060128430.db2.gz PFYROISSCCWBGC-UHFFFAOYSA-N 1 2 318.873 4.460 20 0 DIADLO CCc1ccc(-c2noc([C@@H]([NH3+])c3cccc(Cl)c3)n2)cc1 ZINC001249067340 1060142126 /nfs/dbraw/zinc/14/21/26/1060142126.db2.gz MVLSAFKZUFOJRW-HNNXBMFYSA-N 1 2 313.788 4.001 20 0 DIADLO CN(C)C[C@@H]1CCC[N@@H+]1Cc1sc(Cl)c2ccccc21 ZINC001249068723 1060143535 /nfs/dbraw/zinc/14/35/35/1060143535.db2.gz XYPOQWOYDARASB-LBPRGKRZSA-N 1 2 308.878 4.081 20 0 DIADLO CN(C)C[C@@H]1CCC[N@H+]1Cc1sc(Cl)c2ccccc21 ZINC001249068723 1060143553 /nfs/dbraw/zinc/14/35/53/1060143553.db2.gz XYPOQWOYDARASB-LBPRGKRZSA-N 1 2 308.878 4.081 20 0 DIADLO Cc1csc(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)n1 ZINC001560385757 1060171355 /nfs/dbraw/zinc/17/13/55/1060171355.db2.gz WMQPSIGTAICYMJ-UHFFFAOYSA-N 1 2 324.453 4.263 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3cc(F)cc(Cl)c3)ccc21 ZINC001560389929 1060176030 /nfs/dbraw/zinc/17/60/30/1060176030.db2.gz WZINVXGOIGQURK-UHFFFAOYSA-N 1 2 304.796 4.474 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3cc(F)cc(Cl)c3)ccc21 ZINC001560389929 1060176052 /nfs/dbraw/zinc/17/60/52/1060176052.db2.gz WZINVXGOIGQURK-UHFFFAOYSA-N 1 2 304.796 4.474 20 0 DIADLO Cc1cc(NCc2cccc3ncccc23)ccc1-n1cc[nH+]c1 ZINC001560391493 1060176931 /nfs/dbraw/zinc/17/69/31/1060176931.db2.gz CXCRDIAQATXKDV-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO CCC[C@@](C)(CC)c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001249166531 1060178014 /nfs/dbraw/zinc/17/80/14/1060178014.db2.gz WIWXYKLXQCUJHL-GOSISDBHSA-N 1 2 310.401 4.390 20 0 DIADLO CCN(CC)c1ccc(NCc2cnc3c(F)cccc3c2)c[nH+]1 ZINC001560407026 1060190951 /nfs/dbraw/zinc/19/09/51/1060190951.db2.gz AYBOJVPTIJRLPB-UHFFFAOYSA-N 1 2 324.403 4.227 20 0 DIADLO Cc1ccc(NCc2cccc(OCc3ccccn3)c2)c(C)[nH+]1 ZINC001560408012 1060192994 /nfs/dbraw/zinc/19/29/94/1060192994.db2.gz SULDVOOJRZKTBF-UHFFFAOYSA-N 1 2 319.408 4.285 20 0 DIADLO Cc1cc(C)cc(-c2noc([C@H]3CC[N@@H+]3Cc3ccccc3)n2)c1 ZINC001249254549 1060205764 /nfs/dbraw/zinc/20/57/64/1060205764.db2.gz AZIOWTQBBMAHLX-GOSISDBHSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1cc(C)cc(-c2noc([C@H]3CC[N@H+]3Cc3ccccc3)n2)c1 ZINC001249254549 1060205775 /nfs/dbraw/zinc/20/57/75/1060205775.db2.gz AZIOWTQBBMAHLX-GOSISDBHSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1cccc(-c2noc([C@H]3CC[N@@H+]3Cc3ccccc3)n2)c1F ZINC001249253080 1060205840 /nfs/dbraw/zinc/20/58/40/1060205840.db2.gz JGALDCCVECOXMS-MRXNPFEDSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cccc(-c2noc([C@H]3CC[N@H+]3Cc3ccccc3)n2)c1F ZINC001249253080 1060205854 /nfs/dbraw/zinc/20/58/54/1060205854.db2.gz JGALDCCVECOXMS-MRXNPFEDSA-N 1 2 323.371 4.131 20 0 DIADLO CCCN(C(=O)c1ccn2c(C)c[nH+]c2c1)c1ccc(CC)cc1 ZINC001526397588 1060207697 /nfs/dbraw/zinc/20/76/97/1060207697.db2.gz BKZBVINUBVGBLV-UHFFFAOYSA-N 1 2 321.424 4.262 20 0 DIADLO Cc1ccc(F)c(C(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)c1 ZINC001526417682 1060213195 /nfs/dbraw/zinc/21/31/95/1060213195.db2.gz GQMCVABDCMZHFL-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO c1cn(-c2ccc(-c3noc(C4CCC5(CC5)CC4)n3)cc2)c[nH+]1 ZINC001249291706 1060213899 /nfs/dbraw/zinc/21/38/99/1060213899.db2.gz YICDFNSPSOHPBB-UHFFFAOYSA-N 1 2 320.396 4.360 20 0 DIADLO [NH3+][C@H](c1nc(-c2ccccc2)no1)c1ccc(Cl)c(Cl)c1 ZINC001249331217 1060219499 /nfs/dbraw/zinc/21/94/99/1060219499.db2.gz RDQCDAQNZNNGGH-ZDUSSCGKSA-N 1 2 320.179 4.092 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2cc(Br)sc2Cl)C1 ZINC001249378934 1060230827 /nfs/dbraw/zinc/23/08/27/1060230827.db2.gz FUGNGERJEONQGT-QMMMGPOBSA-N 1 2 308.672 4.396 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2cc(Br)sc2Cl)C1 ZINC001249378934 1060230845 /nfs/dbraw/zinc/23/08/45/1060230845.db2.gz FUGNGERJEONQGT-QMMMGPOBSA-N 1 2 308.672 4.396 20 0 DIADLO Clc1sc(Br)cc1C[N@@H+]1CCC2(CC2)C1 ZINC001249380080 1060233715 /nfs/dbraw/zinc/23/37/15/1060233715.db2.gz WZMFECVZYDWGJL-UHFFFAOYSA-N 1 2 306.656 4.150 20 0 DIADLO Clc1sc(Br)cc1C[N@H+]1CCC2(CC2)C1 ZINC001249380080 1060233729 /nfs/dbraw/zinc/23/37/29/1060233729.db2.gz WZMFECVZYDWGJL-UHFFFAOYSA-N 1 2 306.656 4.150 20 0 DIADLO CC[C@@H](C)c1nn(C)cc1C[N@@H+]1CCc2ccc(Cl)cc2C1 ZINC001249402564 1060235286 /nfs/dbraw/zinc/23/52/86/1060235286.db2.gz NVBCRPFGOFGTMW-CYBMUJFWSA-N 1 2 317.864 4.145 20 0 DIADLO CC[C@@H](C)c1nn(C)cc1C[N@H+]1CCc2ccc(Cl)cc2C1 ZINC001249402564 1060235305 /nfs/dbraw/zinc/23/53/05/1060235305.db2.gz NVBCRPFGOFGTMW-CYBMUJFWSA-N 1 2 317.864 4.145 20 0 DIADLO COc1ccc2nc(C[N@@H+]3CCC[C@H]3c3cccc(C)c3)[nH]c2c1 ZINC001249411167 1060240443 /nfs/dbraw/zinc/24/04/43/1060240443.db2.gz QMVSGZHPMTWJMD-IBGZPJMESA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccc2nc(C[N@H+]3CCC[C@H]3c3cccc(C)c3)[nH]c2c1 ZINC001249411167 1060240456 /nfs/dbraw/zinc/24/04/56/1060240456.db2.gz QMVSGZHPMTWJMD-IBGZPJMESA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccc2nc(C[N@H+](Cc3ccccc3)C3CCC3)[nH]c2c1 ZINC001249415982 1060242066 /nfs/dbraw/zinc/24/20/66/1060242066.db2.gz VOVTVBPUXJMKFV-UHFFFAOYSA-N 1 2 321.424 4.126 20 0 DIADLO COc1ccc2nc(C[N@@H+](Cc3ccccc3)C3CCC3)[nH]c2c1 ZINC001249415982 1060242087 /nfs/dbraw/zinc/24/20/87/1060242087.db2.gz VOVTVBPUXJMKFV-UHFFFAOYSA-N 1 2 321.424 4.126 20 0 DIADLO CCCCC1CCC(NC(=O)c2ccn3c(C)c[nH+]c3c2)CC1 ZINC001526533140 1060249501 /nfs/dbraw/zinc/24/95/01/1060249501.db2.gz JWGYRCKJPVITFI-UHFFFAOYSA-N 1 2 313.445 4.122 20 0 DIADLO C[C@@H]([NH2+]Cc1cn2cccc(F)c2n1)c1ccc(F)cc1Cl ZINC001560486009 1060278407 /nfs/dbraw/zinc/27/84/07/1060278407.db2.gz OXFQUTRITXVIEY-SNVBAGLBSA-N 1 2 321.758 4.117 20 0 DIADLO CCCOc1ccc(C[NH2+][C@H]2CCCC2(F)F)cc1OCC ZINC001560494039 1060287896 /nfs/dbraw/zinc/28/78/96/1060287896.db2.gz XAYPEJAKQWYLDY-INIZCTEOSA-N 1 2 313.388 4.152 20 0 DIADLO Fc1ccc(-c2[nH]c3ccc(NCc4cc[nH]c4)cc3[nH+]2)cc1 ZINC001560497517 1060293629 /nfs/dbraw/zinc/29/36/29/1060293629.db2.gz UENZKQIMGXJIAC-UHFFFAOYSA-N 1 2 306.344 4.309 20 0 DIADLO Cc1ccc(NC(=O)C[C@H](C)C2CCCCC2)c(N(C)C)[nH+]1 ZINC001526675097 1060298561 /nfs/dbraw/zinc/29/85/61/1060298561.db2.gz VEVDZFMMGAGOEO-ZDUSSCGKSA-N 1 2 303.450 4.001 20 0 DIADLO COc1cccc([C@H]2CCCC[N@@H+]2Cc2cc(C)sn2)c1 ZINC001249581518 1060299154 /nfs/dbraw/zinc/29/91/54/1060299154.db2.gz KOONIGGJUBHTFG-QGZVFWFLSA-N 1 2 302.443 4.187 20 0 DIADLO COc1cccc([C@H]2CCCC[N@H+]2Cc2cc(C)sn2)c1 ZINC001249581518 1060299168 /nfs/dbraw/zinc/29/91/68/1060299168.db2.gz KOONIGGJUBHTFG-QGZVFWFLSA-N 1 2 302.443 4.187 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(N(C)c2ccccc2)cc1)c1csnn1 ZINC001560507940 1060304215 /nfs/dbraw/zinc/30/42/15/1060304215.db2.gz GXRGVTRJZBOHLP-CQSZACIVSA-N 1 2 324.453 4.157 20 0 DIADLO C[C@H]([NH2+]Cc1ccc2oc3ccccc3c2c1)c1csnn1 ZINC001560508436 1060307264 /nfs/dbraw/zinc/30/72/64/1060307264.db2.gz VVNAAKLZELMTCW-NSHDSACASA-N 1 2 309.394 4.288 20 0 DIADLO F[C@@]1(c2ccccc2)C[C@H]1[NH2+]Cc1ccccc1Br ZINC001560511979 1060309021 /nfs/dbraw/zinc/30/90/21/1060309021.db2.gz WVLHCEJDJKISMM-HZPDHXFCSA-N 1 2 320.205 4.176 20 0 DIADLO OCc1cc[nH+]c(NCc2ccc(Oc3cccc(F)c3)cc2)c1 ZINC001560510723 1060310307 /nfs/dbraw/zinc/31/03/07/1060310307.db2.gz ILWHBHQYXJAZFX-UHFFFAOYSA-N 1 2 324.355 4.117 20 0 DIADLO Nc1cc(F)cc(Nc2ccc[nH+]c2N2CCCCC2)c1Cl ZINC001249647971 1060333716 /nfs/dbraw/zinc/33/37/16/1060333716.db2.gz WRGXEMUZDLJJFY-UHFFFAOYSA-N 1 2 320.799 4.190 20 0 DIADLO c1nn2ccccc2c1CNc1ccc(Nc2ccccc2)c[nH+]1 ZINC001560538731 1060343512 /nfs/dbraw/zinc/34/35/12/1060343512.db2.gz BZYUSCBQZZGUPP-UHFFFAOYSA-N 1 2 315.380 4.085 20 0 DIADLO CCCn1cc(C[NH2+]C2(c3c(F)cccc3F)CCC2)c(C)n1 ZINC001560550644 1060360427 /nfs/dbraw/zinc/36/04/27/1060360427.db2.gz ABPMJHGTRUIEBJ-UHFFFAOYSA-N 1 2 319.399 4.049 20 0 DIADLO CC1(CCC(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)CC1 ZINC001526903606 1060374277 /nfs/dbraw/zinc/37/42/77/1060374277.db2.gz IISURUWUCSNIIU-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO CCOc1ccc(CNc2[nH+]cccc2CSCC)cc1F ZINC001560568397 1060378969 /nfs/dbraw/zinc/37/89/69/1060378969.db2.gz MUHVUWDCQMXXPV-UHFFFAOYSA-N 1 2 320.433 4.485 20 0 DIADLO Cc1ccc2[nH+]c(NCc3ccc(OC(F)(F)F)cc3)[nH]c2c1 ZINC001560569915 1060380384 /nfs/dbraw/zinc/38/03/84/1060380384.db2.gz NTAQUFVGOYTXSK-UHFFFAOYSA-N 1 2 321.302 4.382 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1cccc2c1OCC2 ZINC001560574451 1060387352 /nfs/dbraw/zinc/38/73/52/1060387352.db2.gz DDDRDZRIHBISPL-UHFFFAOYSA-N 1 2 321.424 4.338 20 0 DIADLO CCN(C)c1ccc(CNc2[nH+]c3ccccc3n2C(C)C)cn1 ZINC001560574005 1060389379 /nfs/dbraw/zinc/38/93/79/1060389379.db2.gz BLQRZMZJHFVKNO-UHFFFAOYSA-N 1 2 323.444 4.080 20 0 DIADLO O=c1[nH]c2ccccc2cc1CNc1[nH]c2ccc(Cl)cc2[nH+]1 ZINC001560578878 1060394060 /nfs/dbraw/zinc/39/40/60/1060394060.db2.gz MUTFGTJUVBJALI-UHFFFAOYSA-N 1 2 324.771 4.082 20 0 DIADLO O=c1[nH]c2ccccc2cc1CNc1[nH]c2cc(Cl)ccc2[nH+]1 ZINC001560578878 1060394077 /nfs/dbraw/zinc/39/40/77/1060394077.db2.gz MUTFGTJUVBJALI-UHFFFAOYSA-N 1 2 324.771 4.082 20 0 DIADLO CC1(C)C(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1(C)C ZINC001527046374 1060421446 /nfs/dbraw/zinc/42/14/46/1060421446.db2.gz FUAOCGHTIRECCK-UHFFFAOYSA-N 1 2 317.820 4.146 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+][C@@H](C)c1ncccc1C ZINC001560618187 1060429033 /nfs/dbraw/zinc/42/90/33/1060429033.db2.gz LKRWGISUQFDLOF-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO Cn1cnc(C[NH2+]Cc2ccc(-c3ccc(C(C)(C)C)cc3)o2)c1 ZINC001560615981 1060429695 /nfs/dbraw/zinc/42/96/95/1060429695.db2.gz JGFYOCUQSMLILM-UHFFFAOYSA-N 1 2 323.440 4.267 20 0 DIADLO CSc1ccc(F)c(C[N@H+](C)C(C)C)c1Br ZINC001249878230 1060439458 /nfs/dbraw/zinc/43/94/58/1060439458.db2.gz UTNJWQULOFNZSC-UHFFFAOYSA-N 1 2 306.244 4.150 20 0 DIADLO CSc1ccc(F)c(C[N@@H+](C)C(C)C)c1Br ZINC001249878230 1060439462 /nfs/dbraw/zinc/43/94/62/1060439462.db2.gz UTNJWQULOFNZSC-UHFFFAOYSA-N 1 2 306.244 4.150 20 0 DIADLO CC[N@H+](Cc1cc2cnccc2o1)Cc1c(F)cccc1F ZINC001560631097 1060439748 /nfs/dbraw/zinc/43/97/48/1060439748.db2.gz WNLIOOOKFVQUAP-UHFFFAOYSA-N 1 2 302.324 4.128 20 0 DIADLO CC[N@@H+](Cc1cc2cnccc2o1)Cc1c(F)cccc1F ZINC001560631097 1060439756 /nfs/dbraw/zinc/43/97/56/1060439756.db2.gz WNLIOOOKFVQUAP-UHFFFAOYSA-N 1 2 302.324 4.128 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)c1cccc(C2CCCC2)c1 ZINC001535115222 1060464148 /nfs/dbraw/zinc/46/41/48/1060464148.db2.gz GIKDNFZJPXXVRJ-UHFFFAOYSA-N 1 2 305.381 4.244 20 0 DIADLO O=C(Cc1ccc2[nH+]ccn2c1)c1ccc(-c2ccccc2)cc1 ZINC001249905054 1060468367 /nfs/dbraw/zinc/46/83/67/1060468367.db2.gz KPZAQVNZKRBWQF-UHFFFAOYSA-N 1 2 312.372 4.427 20 0 DIADLO COc1ccc2c(c1)CCC[N@@H+](Cc1ccc(F)c(F)c1F)C2 ZINC001560653690 1060477394 /nfs/dbraw/zinc/47/73/94/1060477394.db2.gz ROBHAIINMJQMSC-UHFFFAOYSA-N 1 2 321.342 4.061 20 0 DIADLO COc1ccc2c(c1)CCC[N@H+](Cc1ccc(F)c(F)c1F)C2 ZINC001560653690 1060477398 /nfs/dbraw/zinc/47/73/98/1060477398.db2.gz ROBHAIINMJQMSC-UHFFFAOYSA-N 1 2 321.342 4.061 20 0 DIADLO COc1ccc(C[N@H+](C)[C@H](C)c2ccccc2Cl)nc1C ZINC001249913705 1060478004 /nfs/dbraw/zinc/47/80/04/1060478004.db2.gz FZZDDRODRONBBX-CYBMUJFWSA-N 1 2 304.821 4.245 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)nc1C ZINC001249913705 1060478017 /nfs/dbraw/zinc/47/80/17/1060478017.db2.gz FZZDDRODRONBBX-CYBMUJFWSA-N 1 2 304.821 4.245 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@H+](C)Cc1cnc(C)s1 ZINC001560660166 1060484001 /nfs/dbraw/zinc/48/40/01/1060484001.db2.gz GFXWLYZBCJYQSN-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@@H+](C)Cc1cnc(C)s1 ZINC001560660166 1060484010 /nfs/dbraw/zinc/48/40/10/1060484010.db2.gz GFXWLYZBCJYQSN-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@H+](Cc2ccc(C3CC3)cc2)CCO1 ZINC001560659279 1060484331 /nfs/dbraw/zinc/48/43/31/1060484331.db2.gz CKUBISDYBVTQJK-FQEVSTJZSA-N 1 2 311.400 4.277 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@@H+](Cc2ccc(C3CC3)cc2)CCO1 ZINC001560659279 1060484340 /nfs/dbraw/zinc/48/43/40/1060484340.db2.gz CKUBISDYBVTQJK-FQEVSTJZSA-N 1 2 311.400 4.277 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@]2(C1)CCCCO2 ZINC001249934686 1060491534 /nfs/dbraw/zinc/49/15/34/1060491534.db2.gz XZTZKTFNFQJULG-HNNXBMFYSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@]2(C1)CCCCO2 ZINC001249934686 1060491548 /nfs/dbraw/zinc/49/15/48/1060491548.db2.gz XZTZKTFNFQJULG-HNNXBMFYSA-N 1 2 318.219 4.278 20 0 DIADLO COC[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1F ZINC001249933749 1060492969 /nfs/dbraw/zinc/49/29/69/1060492969.db2.gz NIRIMWNVOLUAOR-LBPRGKRZSA-N 1 2 306.208 4.133 20 0 DIADLO COC[C@@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1F ZINC001249933749 1060492977 /nfs/dbraw/zinc/49/29/77/1060492977.db2.gz NIRIMWNVOLUAOR-LBPRGKRZSA-N 1 2 306.208 4.133 20 0 DIADLO CCOC1CC[NH+](Cc2cc(Cl)cc(Cl)c2F)CC1 ZINC001249945600 1060497259 /nfs/dbraw/zinc/49/72/59/1060497259.db2.gz MTAUZDOLSBAFAR-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H](C)CCCc3ccccc3)ccc2[nH+]1 ZINC001527356801 1060499376 /nfs/dbraw/zinc/49/93/76/1060499376.db2.gz SHVQLUPXCGUNQB-HNNXBMFYSA-N 1 2 321.424 4.240 20 0 DIADLO Cc1cn2cc(NC(=O)[C@H](C)c3ccc(Cl)cc3)ccc2[nH+]1 ZINC001527357404 1060500221 /nfs/dbraw/zinc/50/02/21/1060500221.db2.gz WKSHCCFWPTZRMY-GFCCVEGCSA-N 1 2 313.788 4.038 20 0 DIADLO Cc1occc1C[N@H+]1Cc2cc(Br)ccc2C[C@H]1C ZINC001560674674 1060505301 /nfs/dbraw/zinc/50/53/01/1060505301.db2.gz HTSBPJKWIVWADZ-LLVKDONJSA-N 1 2 320.230 4.297 20 0 DIADLO Cc1occc1C[N@@H+]1Cc2cc(Br)ccc2C[C@H]1C ZINC001560674674 1060505320 /nfs/dbraw/zinc/50/53/20/1060505320.db2.gz HTSBPJKWIVWADZ-LLVKDONJSA-N 1 2 320.230 4.297 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2c(O)cccc2F)cc[nH+]1 ZINC001249989303 1060522524 /nfs/dbraw/zinc/52/25/24/1060522524.db2.gz QCISNMXNYBNXRX-UHFFFAOYSA-N 1 2 319.336 4.017 20 0 DIADLO C[C@H](C[N@H+](C)Cc1c(Cl)ccnc1Cl)c1nccs1 ZINC001560702741 1060557466 /nfs/dbraw/zinc/55/74/66/1060557466.db2.gz DFIQRXRSWYJSQP-SECBINFHSA-N 1 2 316.257 4.080 20 0 DIADLO C[C@H](C[N@@H+](C)Cc1c(Cl)ccnc1Cl)c1nccs1 ZINC001560702741 1060557473 /nfs/dbraw/zinc/55/74/73/1060557473.db2.gz DFIQRXRSWYJSQP-SECBINFHSA-N 1 2 316.257 4.080 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3ccc(Cl)cc3C2)cc1F ZINC001560689283 1060535974 /nfs/dbraw/zinc/53/59/74/1060535974.db2.gz JGCLQTNTZZPOQH-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3ccc(Cl)cc3C2)cc1F ZINC001560689283 1060535996 /nfs/dbraw/zinc/53/59/96/1060535996.db2.gz JGCLQTNTZZPOQH-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)ccn1 ZINC001250014245 1060539580 /nfs/dbraw/zinc/53/95/80/1060539580.db2.gz RLXKHOBDXOIRPZ-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)ccn1 ZINC001250014245 1060539601 /nfs/dbraw/zinc/53/96/01/1060539601.db2.gz RLXKHOBDXOIRPZ-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)ccn1 ZINC001250014243 1060540831 /nfs/dbraw/zinc/54/08/31/1060540831.db2.gz RLXKHOBDXOIRPZ-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)ccn1 ZINC001250014243 1060540851 /nfs/dbraw/zinc/54/08/51/1060540851.db2.gz RLXKHOBDXOIRPZ-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1c[nH+]c(Nc2cccc(C(F)(F)F)c2Cl)c(N)c1 ZINC001250075531 1060590711 /nfs/dbraw/zinc/59/07/11/1060590711.db2.gz BBLBOHDZMBEWMX-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO C[N@H+](Cc1cc(Cl)cc2c1OCC2)Cc1ccc(F)cc1F ZINC001560727587 1060595210 /nfs/dbraw/zinc/59/52/10/1060595210.db2.gz NCVVPAXYVFVVLR-UHFFFAOYSA-N 1 2 323.770 4.185 20 0 DIADLO C[N@@H+](Cc1cc(Cl)cc2c1OCC2)Cc1ccc(F)cc1F ZINC001560727587 1060595224 /nfs/dbraw/zinc/59/52/24/1060595224.db2.gz NCVVPAXYVFVVLR-UHFFFAOYSA-N 1 2 323.770 4.185 20 0 DIADLO C[N@H+](Cc1ccc2c(c1)CCCO2)Cc1c(F)cccc1Cl ZINC001560730306 1060598951 /nfs/dbraw/zinc/59/89/51/1060598951.db2.gz SWCTVIXOOUEFMR-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO C[N@@H+](Cc1ccc2c(c1)CCCO2)Cc1c(F)cccc1Cl ZINC001560730306 1060598962 /nfs/dbraw/zinc/59/89/62/1060598962.db2.gz SWCTVIXOOUEFMR-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO COc1cc(F)cc(OC)c1C[N@H+](Cc1cccs1)C1CC1 ZINC001560730127 1060599493 /nfs/dbraw/zinc/59/94/93/1060599493.db2.gz LUONZGBKNSFKDY-UHFFFAOYSA-N 1 2 321.417 4.069 20 0 DIADLO COc1cc(F)cc(OC)c1C[N@@H+](Cc1cccs1)C1CC1 ZINC001560730127 1060599509 /nfs/dbraw/zinc/59/95/09/1060599509.db2.gz LUONZGBKNSFKDY-UHFFFAOYSA-N 1 2 321.417 4.069 20 0 DIADLO COc1cc(OC)c(Nc2cc[nH+]c(SC)c2)cc1Cl ZINC001250095841 1060604885 /nfs/dbraw/zinc/60/48/85/1060604885.db2.gz YPIKJBAVTZHWGM-UHFFFAOYSA-N 1 2 310.806 4.218 20 0 DIADLO Fc1ccc2c(c1)CC[N@@H+](Cc1ccc(C(F)F)c(F)c1)C2 ZINC001560748620 1060615906 /nfs/dbraw/zinc/61/59/06/1060615906.db2.gz YSRKSPWPRZCLKX-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO Fc1ccc2c(c1)CC[N@H+](Cc1ccc(C(F)F)c(F)c1)C2 ZINC001560748620 1060615918 /nfs/dbraw/zinc/61/59/18/1060615918.db2.gz YSRKSPWPRZCLKX-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO CSc1ccc(F)c(C)c1-n1c(C)[nH+]c2ccc(N)cc21 ZINC001250132480 1060634529 /nfs/dbraw/zinc/63/45/29/1060634529.db2.gz LIXAHIRBJDHKDX-UHFFFAOYSA-N 1 2 301.390 4.086 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCOc3cccc(F)c3C2)s1 ZINC001560784184 1060643956 /nfs/dbraw/zinc/64/39/56/1060643956.db2.gz KFOLJUIAZJTPPS-UHFFFAOYSA-N 1 2 305.418 4.234 20 0 DIADLO CCCc1ccc(C[N@H+]2CCOc3cccc(F)c3C2)s1 ZINC001560784184 1060643964 /nfs/dbraw/zinc/64/39/64/1060643964.db2.gz KFOLJUIAZJTPPS-UHFFFAOYSA-N 1 2 305.418 4.234 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@@H+]2CC[C@H](C(F)(F)F)C2)c(F)c1 ZINC001250146634 1060644454 /nfs/dbraw/zinc/64/44/54/1060644454.db2.gz BZPURHMXAFZQJF-JTQLQIEISA-N 1 2 323.305 4.136 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@H+]2CC[C@H](C(F)(F)F)C2)c(F)c1 ZINC001250146634 1060644465 /nfs/dbraw/zinc/64/44/65/1060644465.db2.gz BZPURHMXAFZQJF-JTQLQIEISA-N 1 2 323.305 4.136 20 0 DIADLO CCCC[C@H](CC)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)[nH+]c1 ZINC001560798286 1060658187 /nfs/dbraw/zinc/65/81/87/1060658187.db2.gz CGNNQJBUQXRRQG-OAGGEKHMSA-N 1 2 305.466 4.076 20 0 DIADLO CCOc1cc(C)ccc1C[N@H+](C)Cc1cccc(F)c1F ZINC001250187997 1060665315 /nfs/dbraw/zinc/66/53/15/1060665315.db2.gz SUGNLULGERUCFY-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CCOc1cc(C)ccc1C[N@@H+](C)Cc1cccc(F)c1F ZINC001250187997 1060665321 /nfs/dbraw/zinc/66/53/21/1060665321.db2.gz SUGNLULGERUCFY-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CC1CCC(C)(C[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)CC1 ZINC001560804511 1060665852 /nfs/dbraw/zinc/66/58/52/1060665852.db2.gz FUIKQACVUFKCTO-HQVVEAJESA-N 1 2 304.482 4.232 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(Cl)c(F)c2OC)c[nH+]1 ZINC001250192001 1060670320 /nfs/dbraw/zinc/67/03/20/1060670320.db2.gz PZTODQLTOINUSO-UHFFFAOYSA-N 1 2 309.772 4.082 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC001560823359 1060682451 /nfs/dbraw/zinc/68/24/51/1060682451.db2.gz CXWXVWVMRPOLRC-ZDUSSCGKSA-N 1 2 303.837 4.282 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC001560823359 1060682459 /nfs/dbraw/zinc/68/24/59/1060682459.db2.gz CXWXVWVMRPOLRC-ZDUSSCGKSA-N 1 2 303.837 4.282 20 0 DIADLO Cc1cc(Br)c(C[N@@H+]2CCC[C@](C)(F)C2)s1 ZINC001560848271 1060705140 /nfs/dbraw/zinc/70/51/40/1060705140.db2.gz DBUWRUUMEWYHKB-LBPRGKRZSA-N 1 2 306.244 4.143 20 0 DIADLO Cc1cc(Br)c(C[N@H+]2CCC[C@](C)(F)C2)s1 ZINC001560848271 1060705151 /nfs/dbraw/zinc/70/51/51/1060705151.db2.gz DBUWRUUMEWYHKB-LBPRGKRZSA-N 1 2 306.244 4.143 20 0 DIADLO C[C@@]1(C[NH2+][C@H](CCc2ccccc2)C(F)F)CC1(Cl)Cl ZINC001560839373 1060695336 /nfs/dbraw/zinc/69/53/36/1060695336.db2.gz QMTNCYPZKFEJAX-OCCSQVGLSA-N 1 2 322.226 4.426 20 0 DIADLO CC(C)Cc1ccc([C@H](C)[C@H](C)[NH2+][C@@H](C)C(=O)OC(C)C)cc1 ZINC001560837747 1060696178 /nfs/dbraw/zinc/69/61/78/1060696178.db2.gz ANUBFEQAKNYEDC-IKGGRYGDSA-N 1 2 319.489 4.307 20 0 DIADLO CCOc1c(F)cc(Nc2cccc3[nH+]ccn32)cc1Cl ZINC001250218621 1060698974 /nfs/dbraw/zinc/69/89/74/1060698974.db2.gz SYEWBICEFBXDEU-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO C[N@H+](Cc1ccc(OCC2CC2)cc1)Cc1c(F)cccc1F ZINC001560846792 1060702056 /nfs/dbraw/zinc/70/20/56/1060702056.db2.gz DMXIMFIJVDQUGP-UHFFFAOYSA-N 1 2 317.379 4.386 20 0 DIADLO C[N@@H+](Cc1ccc(OCC2CC2)cc1)Cc1c(F)cccc1F ZINC001560846792 1060702062 /nfs/dbraw/zinc/70/20/62/1060702062.db2.gz DMXIMFIJVDQUGP-UHFFFAOYSA-N 1 2 317.379 4.386 20 0 DIADLO Oc1ccc(F)c(Nc2cccc(Cn3cc[nH+]c3)c2)c1Cl ZINC001250233370 1060714819 /nfs/dbraw/zinc/71/48/19/1060714819.db2.gz OAYFVMLHDFIWPU-UHFFFAOYSA-N 1 2 317.751 4.173 20 0 DIADLO CC(C)Oc1c(F)cc(C[NH+]2CCC(F)CC2)cc1Cl ZINC001250288623 1060757352 /nfs/dbraw/zinc/75/73/52/1060757352.db2.gz RHWWGOZWLLJBJF-UHFFFAOYSA-N 1 2 303.780 4.200 20 0 DIADLO Cc1cc(Br)c(C[NH+]2CC3(CCC3)C2)cc1Cl ZINC001560876176 1060734823 /nfs/dbraw/zinc/73/48/23/1060734823.db2.gz ZIAKOVIXOGLCDB-UHFFFAOYSA-N 1 2 314.654 4.397 20 0 DIADLO CCCn1cc(C[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)nn1 ZINC001560877064 1060738041 /nfs/dbraw/zinc/73/80/41/1060738041.db2.gz JCJSVRLTIGKUSS-LJQANCHMSA-N 1 2 324.472 4.196 20 0 DIADLO CCCn1cc(C[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)nn1 ZINC001560877064 1060738061 /nfs/dbraw/zinc/73/80/61/1060738061.db2.gz JCJSVRLTIGKUSS-LJQANCHMSA-N 1 2 324.472 4.196 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3c(F)ccc(CO)c3F)ccc12 ZINC001250259291 1060738929 /nfs/dbraw/zinc/73/89/29/1060738929.db2.gz LJIUOWPYKYELSF-UHFFFAOYSA-N 1 2 300.308 4.057 20 0 DIADLO CCCn1cc(C[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)nn1 ZINC001560877063 1060739454 /nfs/dbraw/zinc/73/94/54/1060739454.db2.gz JCJSVRLTIGKUSS-IBGZPJMESA-N 1 2 324.472 4.196 20 0 DIADLO CCCn1cc(C[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)nn1 ZINC001560877063 1060739465 /nfs/dbraw/zinc/73/94/65/1060739465.db2.gz JCJSVRLTIGKUSS-IBGZPJMESA-N 1 2 324.472 4.196 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cc(OC)c(Cl)c(F)c1F ZINC001250263176 1060740625 /nfs/dbraw/zinc/74/06/25/1060740625.db2.gz UHVAUXOBXMSRMI-UHFFFAOYSA-N 1 2 314.719 4.164 20 0 DIADLO COc1cc(Nc2cccn3cc[nH+]c23)c(F)c(F)c1Cl ZINC001250263101 1060740867 /nfs/dbraw/zinc/74/08/67/1060740867.db2.gz RHIGIQSVQXAIFC-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)CCc1cccc(C)c1)C(=O)OC(C)(C)C ZINC001560903895 1060768107 /nfs/dbraw/zinc/76/81/07/1060768107.db2.gz HLARAFBPEMUIMN-NVXWUHKLSA-N 1 2 305.462 4.026 20 0 DIADLO Cc1cc(C[N@H+](CC(=O)OC(C)(C)C)C2CCC2)ccc1Cl ZINC001560909082 1060771585 /nfs/dbraw/zinc/77/15/85/1060771585.db2.gz JVYSQOLZRQDPGV-UHFFFAOYSA-N 1 2 323.864 4.345 20 0 DIADLO Cc1cc(C[N@@H+](CC(=O)OC(C)(C)C)C2CCC2)ccc1Cl ZINC001560909082 1060771598 /nfs/dbraw/zinc/77/15/98/1060771598.db2.gz JVYSQOLZRQDPGV-UHFFFAOYSA-N 1 2 323.864 4.345 20 0 DIADLO FC(F)(F)c1ccc(CCn2cc[nH+]c2)c(C(F)(F)F)c1 ZINC001250316363 1060776598 /nfs/dbraw/zinc/77/65/98/1060776598.db2.gz LRIPCFZTMUFZIS-UHFFFAOYSA-N 1 2 308.225 4.163 20 0 DIADLO Clc1cccc(COc2cccc(CCn3cc[nH+]c3)c2)c1 ZINC001250320237 1060777959 /nfs/dbraw/zinc/77/79/59/1060777959.db2.gz JIWAVUAZOWOGQR-UHFFFAOYSA-N 1 2 312.800 4.358 20 0 DIADLO CC1(C)OCc2cc(CNc3c[nH+]cc4c3CCCC4)ccc2O1 ZINC001560927318 1060790913 /nfs/dbraw/zinc/79/09/13/1060790913.db2.gz OANIKZDOWVZZCP-UHFFFAOYSA-N 1 2 324.424 4.218 20 0 DIADLO c1ccc(Oc2ccc3[nH]c(CC4CCOCC4)[nH+]c3c2)cc1 ZINC001250431093 1060799939 /nfs/dbraw/zinc/79/99/39/1060799939.db2.gz BVYOEJAGAPVGMF-UHFFFAOYSA-N 1 2 308.381 4.324 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[N@@H+]1CC[C@H]2C[C@H]2C1 ZINC001560942278 1060807437 /nfs/dbraw/zinc/80/74/37/1060807437.db2.gz LWNBKMDVIVZJFL-IUCAKERBSA-N 1 2 318.617 4.083 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[N@H+]1CC[C@H]2C[C@H]2C1 ZINC001560942278 1060807452 /nfs/dbraw/zinc/80/74/52/1060807452.db2.gz LWNBKMDVIVZJFL-IUCAKERBSA-N 1 2 318.617 4.083 20 0 DIADLO Cc1ccc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)c(C)c1 ZINC001250458734 1060816873 /nfs/dbraw/zinc/81/68/73/1060816873.db2.gz HGOOVZLJKQCTQP-UHFFFAOYSA-N 1 2 306.344 4.172 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cncc(Br)c2Cl)[C@@H](C)C1 ZINC001250464722 1060823225 /nfs/dbraw/zinc/82/32/25/1060823225.db2.gz JALFIIZOJCQWJT-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cncc(Br)c2Cl)[C@@H](C)C1 ZINC001250464722 1060823235 /nfs/dbraw/zinc/82/32/35/1060823235.db2.gz JALFIIZOJCQWJT-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO c1ccc2c(c1)nccc2-c1[nH]c2ccc(N3CCCC3)cc2[nH+]1 ZINC001250477317 1060832460 /nfs/dbraw/zinc/83/24/60/1060832460.db2.gz DBXILQZJEJZHLV-UHFFFAOYSA-N 1 2 314.392 4.378 20 0 DIADLO CSc1ccc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)cc1 ZINC001250479300 1060835584 /nfs/dbraw/zinc/83/55/84/1060835584.db2.gz GOAHEOPLLYHUGK-UHFFFAOYSA-N 1 2 324.384 4.277 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cncc2ccccc21 ZINC001560981351 1060844895 /nfs/dbraw/zinc/84/48/95/1060844895.db2.gz GTQBQKRSWMOTJM-UHFFFAOYSA-N 1 2 309.438 4.495 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(C(F)(F)F)ccc2Cl)CCS1 ZINC001560980159 1060845101 /nfs/dbraw/zinc/84/51/01/1060845101.db2.gz ZEZIANWIFRQRHY-SECBINFHSA-N 1 2 309.784 4.296 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(C(F)(F)F)ccc2Cl)CCS1 ZINC001560980159 1060845117 /nfs/dbraw/zinc/84/51/17/1060845117.db2.gz ZEZIANWIFRQRHY-SECBINFHSA-N 1 2 309.784 4.296 20 0 DIADLO Cc1ccc(CC[NH2+]CC(F)(F)c2ccc(F)cc2F)cc1 ZINC001560997993 1060857976 /nfs/dbraw/zinc/85/79/76/1060857976.db2.gz KFNXJZNQURDWPZ-UHFFFAOYSA-N 1 2 311.322 4.197 20 0 DIADLO CC[C@@H]1C[C@@H]([NH2+][C@H](c2cccc(Cl)c2)C(F)F)CCO1 ZINC001561006867 1060866053 /nfs/dbraw/zinc/86/60/53/1060866053.db2.gz DKVQKBAPGLUGLP-BFHYXJOUSA-N 1 2 303.780 4.193 20 0 DIADLO CCc1cnc(C[N@@H+]2Cc3ccccc3OC3(CCC3)C2)s1 ZINC001561005464 1060866447 /nfs/dbraw/zinc/86/64/47/1060866447.db2.gz OPDLLDMWFQZLDU-UHFFFAOYSA-N 1 2 314.454 4.023 20 0 DIADLO CCc1cnc(C[N@H+]2Cc3ccccc3OC3(CCC3)C2)s1 ZINC001561005464 1060866455 /nfs/dbraw/zinc/86/64/55/1060866455.db2.gz OPDLLDMWFQZLDU-UHFFFAOYSA-N 1 2 314.454 4.023 20 0 DIADLO Cc1ccc2[nH]c(Cc3c(Cl)nc(C)nc3Cl)[nH+]c2c1C ZINC001250544174 1060885098 /nfs/dbraw/zinc/88/50/98/1060885098.db2.gz YPVAJMBZSRZYEG-UHFFFAOYSA-N 1 2 321.211 4.176 20 0 DIADLO Cc1ccc(-c2cccc(Cl)c2C[NH+]2CCOCC2)c(C)c1 ZINC001250548896 1060887910 /nfs/dbraw/zinc/88/79/10/1060887910.db2.gz PWAYTRCAONZHNV-UHFFFAOYSA-N 1 2 315.844 4.456 20 0 DIADLO Cc1cccc(C)c1-c1cccc(Cl)c1C[NH+]1CCOCC1 ZINC001250548318 1060888470 /nfs/dbraw/zinc/88/84/70/1060888470.db2.gz NQQLSBLHHCUGOU-UHFFFAOYSA-N 1 2 315.844 4.456 20 0 DIADLO CCOc1cc(F)cc(C[N@@H+]2CC[C@H]2c2ccc(F)cc2)c1 ZINC001561035248 1060889551 /nfs/dbraw/zinc/88/95/51/1060889551.db2.gz QWMMNQPDWAZJDT-SFHVURJKSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1cc(F)cc(C[N@H+]2CC[C@H]2c2ccc(F)cc2)c1 ZINC001561035248 1060889561 /nfs/dbraw/zinc/88/95/61/1060889561.db2.gz QWMMNQPDWAZJDT-SFHVURJKSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1ccc2[nH]c([C@@H](C)Cc3ccc4c(c3)OCO4)[nH+]c2c1 ZINC001250568392 1060903791 /nfs/dbraw/zinc/90/37/91/1060903791.db2.gz VSEHAPXUFNGJKO-LBPRGKRZSA-N 1 2 324.380 4.037 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@@H+](C/C=C\c1ccc(F)c(F)c1)C2 ZINC001561054940 1060905141 /nfs/dbraw/zinc/90/51/41/1060905141.db2.gz PRLRFVCPAIYZLR-UPHRSURJSA-N 1 2 321.317 4.315 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@H+](C/C=C\c1ccc(F)c(F)c1)C2 ZINC001561054940 1060905153 /nfs/dbraw/zinc/90/51/53/1060905153.db2.gz PRLRFVCPAIYZLR-UPHRSURJSA-N 1 2 321.317 4.315 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CCc4cc(F)cc(F)c4C3)ccc2n1 ZINC001561055763 1060905573 /nfs/dbraw/zinc/90/55/73/1060905573.db2.gz WTPVEXFPRXRODS-UHFFFAOYSA-N 1 2 324.374 4.380 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CCc4cc(F)cc(F)c4C3)ccc2n1 ZINC001561055763 1060905589 /nfs/dbraw/zinc/90/55/89/1060905589.db2.gz WTPVEXFPRXRODS-UHFFFAOYSA-N 1 2 324.374 4.380 20 0 DIADLO COCOc1ccc2[nH]c(CC(C)(C)c3ccccc3)[nH+]c2c1 ZINC001250572594 1060910701 /nfs/dbraw/zinc/91/07/01/1060910701.db2.gz CSLROYNMUGMVQX-UHFFFAOYSA-N 1 2 310.397 4.066 20 0 DIADLO COc1cc2[nH+]c(CCc3ccc(F)cc3)[nH]c2cc1Cl ZINC001250578268 1060913022 /nfs/dbraw/zinc/91/30/22/1060913022.db2.gz HPWLBGAPBFUKCB-UHFFFAOYSA-N 1 2 304.752 4.149 20 0 DIADLO COc1cc2[nH+]c(Cc3cc(F)cc(F)c3)[nH]c2cc1Cl ZINC001250596925 1060930124 /nfs/dbraw/zinc/93/01/24/1060930124.db2.gz HJGKLYQGOIBDCR-UHFFFAOYSA-N 1 2 308.715 4.094 20 0 DIADLO Cc1cccc2[nH+]c(C3CCC4(CC3)OCCO4)n(C3CC3)c21 ZINC001250597311 1060930684 /nfs/dbraw/zinc/93/06/84/1060930684.db2.gz OSSVVVVQJXZCJN-UHFFFAOYSA-N 1 2 312.413 4.080 20 0 DIADLO CCOc1cc2[nH]c(Cc3cccs3)[nH+]c2cc1OCC ZINC001250604600 1060933032 /nfs/dbraw/zinc/93/30/32/1060933032.db2.gz KMLWRIGERDTQJD-UHFFFAOYSA-N 1 2 302.399 4.013 20 0 DIADLO COc1cc2[nH+]c(Cc3ccc(F)c(F)c3)[nH]c2cc1Cl ZINC001250604953 1060933204 /nfs/dbraw/zinc/93/32/04/1060933204.db2.gz YFGBFQHQUZQLEW-UHFFFAOYSA-N 1 2 308.715 4.094 20 0 DIADLO CCOc1ccc2[nH]c(CCCOCc3ccccc3)[nH+]c2c1 ZINC001250604925 1060933264 /nfs/dbraw/zinc/93/32/64/1060933264.db2.gz CQLYCZYHVCSQKF-UHFFFAOYSA-N 1 2 310.397 4.111 20 0 DIADLO COCCCc1[nH+]c2ccc(F)c(F)c2n1C1CCCCC1 ZINC001250604735 1060933566 /nfs/dbraw/zinc/93/35/66/1060933566.db2.gz NTSBGEQKNRFTBA-UHFFFAOYSA-N 1 2 308.372 4.399 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCOc3cccc(F)c3C2)c(Cl)c1 ZINC001462150334 1060971907 /nfs/dbraw/zinc/97/19/07/1060971907.db2.gz UETAAYUFOFPQIK-UHFFFAOYSA-N 1 2 323.770 4.055 20 0 DIADLO Fc1ccc(CC[N@H+]2CCOc3cccc(F)c3C2)c(Cl)c1 ZINC001462150334 1060971935 /nfs/dbraw/zinc/97/19/35/1060971935.db2.gz UETAAYUFOFPQIK-UHFFFAOYSA-N 1 2 323.770 4.055 20 0 DIADLO Fc1cccc2c(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)c[nH]c21 ZINC001250639363 1060976201 /nfs/dbraw/zinc/97/62/01/1060976201.db2.gz OYKYWWLUVITAGV-UHFFFAOYSA-N 1 2 320.371 4.451 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ncccc2Br)[C@H]1c1ccccc1 ZINC001473208068 1060976629 /nfs/dbraw/zinc/97/66/29/1060976629.db2.gz HPPKRZVEPWGBOU-MLGOLLRUSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ncccc2Br)[C@H]1c1ccccc1 ZINC001473208068 1060976604 /nfs/dbraw/zinc/97/66/04/1060976604.db2.gz HPPKRZVEPWGBOU-MLGOLLRUSA-N 1 2 317.230 4.037 20 0 DIADLO Cc1ccccc1-c1nc(C[NH+]2CCC(CC(C)C)CC2)no1 ZINC001473217074 1060989571 /nfs/dbraw/zinc/98/95/71/1060989571.db2.gz KAWDNTUZPZSQPA-UHFFFAOYSA-N 1 2 313.445 4.303 20 0 DIADLO C/C=C\C[C@H]([NH2+][C@H](C)[C@@H](C)c1ccc(Cl)cc1)C(=O)OCC ZINC001462194084 1061015397 /nfs/dbraw/zinc/01/53/97/1061015397.db2.gz WRNNYXPCVPTAOA-NYAHMKPPSA-N 1 2 323.864 4.320 20 0 DIADLO C[N@H+](Cc1nc(-c2ccccc2)c[nH]1)Cc1ccc2occc2c1 ZINC001462207453 1061026881 /nfs/dbraw/zinc/02/68/81/1061026881.db2.gz KXYLXSUMSSPCRC-UHFFFAOYSA-N 1 2 317.392 4.455 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccccc2)c[nH]1)Cc1ccc2occc2c1 ZINC001462207453 1061026898 /nfs/dbraw/zinc/02/68/98/1061026898.db2.gz KXYLXSUMSSPCRC-UHFFFAOYSA-N 1 2 317.392 4.455 20 0 DIADLO Cc1[nH+]ccn1-c1ccc(-c2nc3cc(C)cc(C)c3[nH]2)cc1 ZINC001250704446 1061028101 /nfs/dbraw/zinc/02/81/01/1061028101.db2.gz AJKXJMKKCIALOV-UHFFFAOYSA-N 1 2 302.381 4.341 20 0 DIADLO Cc1cc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)c(C)s1 ZINC001250707990 1061030608 /nfs/dbraw/zinc/03/06/08/1061030608.db2.gz MBWIBCHICDSNDI-UHFFFAOYSA-N 1 2 312.373 4.233 20 0 DIADLO Cc1cc(F)c(C[NH+]2CCC(CC(F)(F)F)CC2)c(F)c1 ZINC001462220342 1061036601 /nfs/dbraw/zinc/03/66/01/1061036601.db2.gz PGGNAJBNZDYEMX-UHFFFAOYSA-N 1 2 307.306 4.438 20 0 DIADLO CC[C@@H]1CCc2ccccc2N1Cc1[nH+]cc(C)c(OC)c1C ZINC001473264464 1061039120 /nfs/dbraw/zinc/03/91/20/1061039120.db2.gz RIYSQFVHYHKHOB-QGZVFWFLSA-N 1 2 310.441 4.438 20 0 DIADLO C[C@@H](c1cccc(Cl)c1F)[NH+]1CCN(c2cccs2)CC1 ZINC001473265994 1061039391 /nfs/dbraw/zinc/03/93/91/1061039391.db2.gz PDWRLKDYPIWWBJ-LBPRGKRZSA-N 1 2 324.852 4.424 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@@H+]1CCOCC12CCCCC2 ZINC001462239648 1061048381 /nfs/dbraw/zinc/04/83/81/1061048381.db2.gz YQCUBUWMYXFQHH-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@H+]1CCOCC12CCCCC2 ZINC001462239648 1061048398 /nfs/dbraw/zinc/04/83/98/1061048398.db2.gz YQCUBUWMYXFQHH-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO Cc1ccc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3)nc2c1Cl ZINC001250772398 1061061460 /nfs/dbraw/zinc/06/14/60/1061061460.db2.gz UMFAFXXOISYAHR-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO Fc1cc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3)nc2c(Cl)c1 ZINC001250771790 1061062586 /nfs/dbraw/zinc/06/25/86/1061062586.db2.gz FEUMPTDZXBZKLZ-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccc4cc(O)ccc4c3)[nH+]c2c1 ZINC001250767672 1061062846 /nfs/dbraw/zinc/06/28/46/1061062846.db2.gz IVMGTWIZEXJTMJ-UHFFFAOYSA-N 1 2 303.365 4.155 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccc(-c4ccncc4)cc3)[nH+]c2c1 ZINC001250847287 1061094392 /nfs/dbraw/zinc/09/43/92/1061094392.db2.gz MLWKQDXSPLWIAG-UHFFFAOYSA-N 1 2 314.392 4.358 20 0 DIADLO Clc1ccnc(Cl)c1C[NH+]1CC(Cc2ccccc2)C1 ZINC001462315224 1061100322 /nfs/dbraw/zinc/10/03/22/1061100322.db2.gz KBQZDIKUILFBKX-UHFFFAOYSA-N 1 2 307.224 4.063 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccccc3-c3nccs3)[nH+]c2c1 ZINC001250869893 1061102152 /nfs/dbraw/zinc/10/21/52/1061102152.db2.gz QMQYFTQELXYOGD-UHFFFAOYSA-N 1 2 320.421 4.419 20 0 DIADLO CCC1(CC)C[NH+](Cc2c(F)cccc2Br)C1 ZINC001462317766 1061102643 /nfs/dbraw/zinc/10/26/43/1061102643.db2.gz UYIWRSJBDRSJAY-UHFFFAOYSA-N 1 2 300.215 4.210 20 0 DIADLO Nc1ccc(Cl)cc1-c1[nH]c2ccc(N3CCCC3)cc2[nH+]1 ZINC001250898699 1061114844 /nfs/dbraw/zinc/11/48/44/1061114844.db2.gz IGIVNQQULREHFI-UHFFFAOYSA-N 1 2 312.804 4.066 20 0 DIADLO Fc1cc2[nH]c(-c3coc4ccccc34)nc2cc1-n1cc[nH+]c1 ZINC001250906965 1061119123 /nfs/dbraw/zinc/11/91/23/1061119123.db2.gz SYWWYBDBONDGBE-UHFFFAOYSA-N 1 2 318.311 4.301 20 0 DIADLO CN(C)c1ccc([NH2+]CC2CCSCC2)cc1C(F)(F)F ZINC001462350958 1061124086 /nfs/dbraw/zinc/12/40/86/1061124086.db2.gz JPYDVMZXNGTZTC-UHFFFAOYSA-N 1 2 318.408 4.327 20 0 DIADLO CC(C)CCn1c2ccccc2nc1-c1ccn2cc[nH+]c2c1 ZINC001250927884 1061128962 /nfs/dbraw/zinc/12/89/62/1061128962.db2.gz MHDWMXGRSWUCBE-UHFFFAOYSA-N 1 2 304.397 4.397 20 0 DIADLO Clc1cc2nc(-c3ccn4cc[nH+]c4c3)[nH]c2cc1Cl ZINC001250927538 1061129304 /nfs/dbraw/zinc/12/93/04/1061129304.db2.gz AHQDMXNEDLUUFY-UHFFFAOYSA-N 1 2 303.152 4.184 20 0 DIADLO Cc1cc2[nH]c(-c3cccc(-n4cc[nH+]c4)c3)nc2cc1Cl ZINC001250940454 1061135832 /nfs/dbraw/zinc/13/58/32/1061135832.db2.gz MBNKNTPJKLFODH-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO Cc1cc2[nH]c(-c3cccc(-n4cc[nH+]c4)c3)nc2c(Cl)c1 ZINC001250940069 1061136293 /nfs/dbraw/zinc/13/62/93/1061136293.db2.gz DBTRZOVTFVGISG-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO Cc1ccc(Cl)c2nc(-c3cccc(-n4cc[nH+]c4)c3)[nH]c21 ZINC001250939927 1061136426 /nfs/dbraw/zinc/13/64/26/1061136426.db2.gz BENPEZFYTCPNSN-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO C[C@H]1C[N@H+](Cc2nc(Cl)cs2)CCc2ccc(F)cc21 ZINC001462393287 1061145833 /nfs/dbraw/zinc/14/58/33/1061145833.db2.gz CGXJBFIRQWPYMF-JTQLQIEISA-N 1 2 310.825 4.097 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nc(Cl)cs2)CCc2ccc(F)cc21 ZINC001462393287 1061145840 /nfs/dbraw/zinc/14/58/40/1061145840.db2.gz CGXJBFIRQWPYMF-JTQLQIEISA-N 1 2 310.825 4.097 20 0 DIADLO Fc1cccc(Cl)c1[C@@H]1C[N@H+](C[C@H]2CC=CCC2)CCO1 ZINC001462407004 1061154472 /nfs/dbraw/zinc/15/44/72/1061154472.db2.gz GKXCBJVZJMNHIW-BBRMVZONSA-N 1 2 309.812 4.209 20 0 DIADLO Fc1cccc(Cl)c1[C@@H]1C[N@@H+](C[C@H]2CC=CCC2)CCO1 ZINC001462407004 1061154480 /nfs/dbraw/zinc/15/44/80/1061154480.db2.gz GKXCBJVZJMNHIW-BBRMVZONSA-N 1 2 309.812 4.209 20 0 DIADLO CCCn1c2cc(OCC)ccc2nc1-c1ccc2[nH+]ccn2c1 ZINC001250978603 1061158563 /nfs/dbraw/zinc/15/85/63/1061158563.db2.gz NGTFMDDDHSZKKQ-UHFFFAOYSA-N 1 2 320.396 4.160 20 0 DIADLO Cc1ccc(-c2nc3ccccc3n2C2CCCCC2)c(N)[nH+]1 ZINC001250982469 1061159975 /nfs/dbraw/zinc/15/99/75/1061159975.db2.gz ZOOYPFIOADNSGZ-UHFFFAOYSA-N 1 2 306.413 4.494 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@@H+]1CCc2ccc(C(C)C)cc2C1 ZINC001462418633 1061162558 /nfs/dbraw/zinc/16/25/58/1061162558.db2.gz UOIRNWRLQQHFDR-UHFFFAOYSA-N 1 2 317.864 4.307 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@H+]1CCc2ccc(C(C)C)cc2C1 ZINC001462418633 1061162565 /nfs/dbraw/zinc/16/25/65/1061162565.db2.gz UOIRNWRLQQHFDR-UHFFFAOYSA-N 1 2 317.864 4.307 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1ccsc1Br)CC2 ZINC001462419141 1061162961 /nfs/dbraw/zinc/16/29/61/1061162961.db2.gz WBDOZSUKQDQEQU-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1ccsc1Br)CC2 ZINC001462419141 1061162969 /nfs/dbraw/zinc/16/29/69/1061162969.db2.gz WBDOZSUKQDQEQU-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)[C@H](C)c2cn(-c3ccccc3)nn2)c1 ZINC001473446050 1061163405 /nfs/dbraw/zinc/16/34/05/1061163405.db2.gz HRFSCHYTTQGNDX-QGZVFWFLSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)[C@H](C)c2cn(-c3ccccc3)nn2)c1 ZINC001473446050 1061163410 /nfs/dbraw/zinc/16/34/10/1061163410.db2.gz HRFSCHYTTQGNDX-QGZVFWFLSA-N 1 2 320.440 4.077 20 0 DIADLO c1cc2cccc(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)c2[nH]1 ZINC001251010800 1061181513 /nfs/dbraw/zinc/18/15/13/1061181513.db2.gz OTPPRYPFPJCFIE-UHFFFAOYSA-N 1 2 302.381 4.311 20 0 DIADLO Cc1cc(C)c(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)cc1C ZINC001251019604 1061185465 /nfs/dbraw/zinc/18/54/65/1061185465.db2.gz XMNFJCBPBYRIHX-UHFFFAOYSA-N 1 2 320.371 4.480 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)C[C@@H]2OCCc3ccccc32)c1F ZINC001473487302 1061188282 /nfs/dbraw/zinc/18/82/82/1061188282.db2.gz JTCAKPMUGLFKSP-SFHVURJKSA-N 1 2 317.379 4.019 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)C[C@@H]2OCCc3ccccc32)c1F ZINC001473487302 1061188286 /nfs/dbraw/zinc/18/82/86/1061188286.db2.gz JTCAKPMUGLFKSP-SFHVURJKSA-N 1 2 317.379 4.019 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[NH+]1CCC2(CCCC2)CC1 ZINC001473497918 1061192985 /nfs/dbraw/zinc/19/29/85/1061192985.db2.gz PIELMZXOCQGQHU-INIZCTEOSA-N 1 2 321.848 4.210 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+]1CCc2c(O)cccc2C1 ZINC001462488068 1061208176 /nfs/dbraw/zinc/20/81/76/1061208176.db2.gz IHMLPYUFMFERQZ-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+]1CCc2c(O)cccc2C1 ZINC001462488068 1061208191 /nfs/dbraw/zinc/20/81/91/1061208191.db2.gz IHMLPYUFMFERQZ-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC001473530090 1061226537 /nfs/dbraw/zinc/22/65/37/1061226537.db2.gz CJJDEMQCMDHZFK-WMZOPIPTSA-N 1 2 315.457 4.336 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC001473530090 1061226557 /nfs/dbraw/zinc/22/65/57/1061226557.db2.gz CJJDEMQCMDHZFK-WMZOPIPTSA-N 1 2 315.457 4.336 20 0 DIADLO Cc1cccc(F)c1-c1nc2cc(-n3cc[nH+]c3)c(F)cc2[nH]1 ZINC001251127071 1061246031 /nfs/dbraw/zinc/24/60/31/1061246031.db2.gz BOSFYEOXIJOBSI-UHFFFAOYSA-N 1 2 310.307 4.002 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ccccc2Cl)[C@H]1C(=O)OC(C)(C)C ZINC001473571523 1061257905 /nfs/dbraw/zinc/25/79/05/1061257905.db2.gz KCUPKFPZGSTGQY-CZUORRHYSA-N 1 2 323.864 4.282 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ccccc2Cl)[C@H]1C(=O)OC(C)(C)C ZINC001473571523 1061257919 /nfs/dbraw/zinc/25/79/19/1061257919.db2.gz KCUPKFPZGSTGQY-CZUORRHYSA-N 1 2 323.864 4.282 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2ccccc2Cl)[C@H]1C(=O)OC(C)(C)C ZINC001473571524 1061258008 /nfs/dbraw/zinc/25/80/08/1061258008.db2.gz KCUPKFPZGSTGQY-XJKSGUPXSA-N 1 2 323.864 4.282 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2ccccc2Cl)[C@H]1C(=O)OC(C)(C)C ZINC001473571524 1061258031 /nfs/dbraw/zinc/25/80/31/1061258031.db2.gz KCUPKFPZGSTGQY-XJKSGUPXSA-N 1 2 323.864 4.282 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@@H](C)[C@H]2C(=O)OC(C)(C)C)cc1F ZINC001473571285 1061260326 /nfs/dbraw/zinc/26/03/26/1061260326.db2.gz FEYVNZZRULIPCM-PBHICJAKSA-N 1 2 321.436 4.076 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@@H](C)[C@H]2C(=O)OC(C)(C)C)cc1F ZINC001473571285 1061260351 /nfs/dbraw/zinc/26/03/51/1061260351.db2.gz FEYVNZZRULIPCM-PBHICJAKSA-N 1 2 321.436 4.076 20 0 DIADLO C[C@@H](CC1CCOCC1)[NH2+][C@H](c1cccc(Cl)c1)C(F)F ZINC001462589237 1061280772 /nfs/dbraw/zinc/28/07/72/1061280772.db2.gz VILBHBFYHCETMR-XHDPSFHLSA-N 1 2 317.807 4.441 20 0 DIADLO COC(=O)[C@H]([NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1)c1cccc2ccccc21 ZINC001462590673 1061282105 /nfs/dbraw/zinc/28/21/05/1061282105.db2.gz XIMZJDYJXBPYEL-TXDAXLQXSA-N 1 2 323.436 4.222 20 0 DIADLO COC(=O)[C@H]([NH2+][C@H]1CCC[C@H](C)C1)c1cccc2ccccc21 ZINC001462588297 1061283435 /nfs/dbraw/zinc/28/34/35/1061283435.db2.gz STNHXKVWWKQYJW-URLQWDBASA-N 1 2 311.425 4.222 20 0 DIADLO FC(F)(F)c1nc(Cl)ccc1C[N@@H+]1C[C@H]2CCCC[C@H]21 ZINC001473615096 1061290456 /nfs/dbraw/zinc/29/04/56/1061290456.db2.gz XXTPZOKJAOBMLV-MWLCHTKSSA-N 1 2 304.743 4.128 20 0 DIADLO FC(F)(F)c1nc(Cl)ccc1C[N@H+]1C[C@H]2CCCC[C@H]21 ZINC001473615096 1061290475 /nfs/dbraw/zinc/29/04/75/1061290475.db2.gz XXTPZOKJAOBMLV-MWLCHTKSSA-N 1 2 304.743 4.128 20 0 DIADLO COc1nscc1C[N@H+](C)C/C=C\c1c(C)cc(C)cc1C ZINC001462608318 1061295199 /nfs/dbraw/zinc/29/51/99/1061295199.db2.gz JPIZOZCYJREPMQ-SREVYHEPSA-N 1 2 316.470 4.222 20 0 DIADLO COc1nscc1C[N@@H+](C)C/C=C\c1c(C)cc(C)cc1C ZINC001462608318 1061295219 /nfs/dbraw/zinc/29/52/19/1061295219.db2.gz JPIZOZCYJREPMQ-SREVYHEPSA-N 1 2 316.470 4.222 20 0 DIADLO C[C@H](CC(C)(C)C)[NH2+][C@@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001462621233 1061301323 /nfs/dbraw/zinc/30/13/23/1061301323.db2.gz ZNRCNEKHWRYPPG-WBVHZDCISA-N 1 2 319.489 4.354 20 0 DIADLO CC(C)c1[nH]cc(CNC(=O)C=C2CCC(C(C)(C)C)CC2)[nH+]1 ZINC001456347237 1061302934 /nfs/dbraw/zinc/30/29/34/1061302934.db2.gz VGGJGFRQICRFPL-UHFFFAOYSA-N 1 2 317.477 4.312 20 0 DIADLO CC(C)c1[nH]c(CNC(=O)C=C2CCC(C(C)(C)C)CC2)c[nH+]1 ZINC001456347237 1061302950 /nfs/dbraw/zinc/30/29/50/1061302950.db2.gz VGGJGFRQICRFPL-UHFFFAOYSA-N 1 2 317.477 4.312 20 0 DIADLO Fc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3)CC2)c(F)c1F ZINC001462681708 1061336859 /nfs/dbraw/zinc/33/68/59/1061336859.db2.gz YRRIULLRDWFUIZ-INIZCTEOSA-N 1 2 321.342 4.068 20 0 DIADLO Fc1ccc(C[N@H+]2CCO[C@H](c3ccccc3)CC2)c(F)c1F ZINC001462681708 1061336879 /nfs/dbraw/zinc/33/68/79/1061336879.db2.gz YRRIULLRDWFUIZ-INIZCTEOSA-N 1 2 321.342 4.068 20 0 DIADLO CCOc1cc(CNc2[nH+]c3ccccc3n2C2CC2)ccc1O ZINC001462680828 1061338423 /nfs/dbraw/zinc/33/84/23/1061338423.db2.gz HVTKGMOUDRMCAN-UHFFFAOYSA-N 1 2 323.396 4.088 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1cccc(Oc2ccccc2)c1 ZINC001462729845 1061346127 /nfs/dbraw/zinc/34/61/27/1061346127.db2.gz FUZGUWKXIMQHMJ-UHFFFAOYSA-N 1 2 318.376 4.165 20 0 DIADLO CO[C@H](CC(C)C)C[N@H+](C)[C@@H](CCc1ccccc1)C(F)F ZINC001473691275 1061352149 /nfs/dbraw/zinc/35/21/49/1061352149.db2.gz GBVZMTQEVBQWIL-SJORKVTESA-N 1 2 313.432 4.246 20 0 DIADLO CO[C@H](CC(C)C)C[N@@H+](C)[C@@H](CCc1ccccc1)C(F)F ZINC001473691275 1061352165 /nfs/dbraw/zinc/35/21/65/1061352165.db2.gz GBVZMTQEVBQWIL-SJORKVTESA-N 1 2 313.432 4.246 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccccc3-c3ccncc3)[nH+]c2c1 ZINC001251435112 1061355968 /nfs/dbraw/zinc/35/59/68/1061355968.db2.gz PRUWLWALPCURTA-UHFFFAOYSA-N 1 2 314.392 4.358 20 0 DIADLO C[C@@H]1Cc2cccc(F)c2N(Cc2ccc(-n3cc[nH+]c3)cc2)C1 ZINC001473733234 1061380909 /nfs/dbraw/zinc/38/09/09/1061380909.db2.gz BRZAXSCQXYXZHX-OAHLLOKOSA-N 1 2 321.399 4.210 20 0 DIADLO C[C@H]1Cc2cccc(F)c2N(Cc2ccc(-n3cc[nH+]c3)cc2)C1 ZINC001473733233 1061381689 /nfs/dbraw/zinc/38/16/89/1061381689.db2.gz BRZAXSCQXYXZHX-HNNXBMFYSA-N 1 2 321.399 4.210 20 0 DIADLO CC(C)(C)OC(=O)C[NH2+][C@H]1CCC(C)(C)C[C@H]1c1ccccc1 ZINC001473743372 1061383873 /nfs/dbraw/zinc/38/38/73/1061383873.db2.gz RPUBRQITPBWJKH-IRXDYDNUSA-N 1 2 317.473 4.280 20 0 DIADLO COc1cccc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3Cl)nc21 ZINC001251507632 1061384187 /nfs/dbraw/zinc/38/41/87/1061384187.db2.gz OYRREEYFYIVTJE-UHFFFAOYSA-N 1 2 324.771 4.078 20 0 DIADLO CC[N@H+](Cc1c(F)cccc1Cl)[C@@H](CO)c1ccccc1 ZINC001473746335 1061386103 /nfs/dbraw/zinc/38/61/03/1061386103.db2.gz GSHYAGHGTDFMES-KRWDZBQOSA-N 1 2 307.796 4.035 20 0 DIADLO CC[N@@H+](Cc1c(F)cccc1Cl)[C@@H](CO)c1ccccc1 ZINC001473746335 1061386111 /nfs/dbraw/zinc/38/61/11/1061386111.db2.gz GSHYAGHGTDFMES-KRWDZBQOSA-N 1 2 307.796 4.035 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccc(OC(F)F)c(F)c3)[nH+]c2c1 ZINC001251586873 1061408601 /nfs/dbraw/zinc/40/86/01/1061408601.db2.gz KIVFAQVAKZOLCD-UHFFFAOYSA-N 1 2 321.302 4.036 20 0 DIADLO Cl/C=C(\Cl)C[N@@H+]1CCC[C@H](c2nc3c(s2)CCC3)C1 ZINC001473805351 1061414892 /nfs/dbraw/zinc/41/48/92/1061414892.db2.gz CUOAABWONJPWCJ-QBQSQJOESA-N 1 2 317.285 4.130 20 0 DIADLO Cl/C=C(\Cl)C[N@H+]1CCC[C@H](c2nc3c(s2)CCC3)C1 ZINC001473805351 1061414904 /nfs/dbraw/zinc/41/49/04/1061414904.db2.gz CUOAABWONJPWCJ-QBQSQJOESA-N 1 2 317.285 4.130 20 0 DIADLO Cc1cccc(C)c1C[N@@H+](C)Cc1ccncc1Br ZINC001473836435 1061428608 /nfs/dbraw/zinc/42/86/08/1061428608.db2.gz BSWDHMLYQUHRHA-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1F)c1cc(Cl)cc2c1OCC2 ZINC001473827449 1061426378 /nfs/dbraw/zinc/42/63/78/1061426378.db2.gz ZKUSHHMJNKYUDI-JTQLQIEISA-N 1 2 323.770 4.404 20 0 DIADLO Cc1cccc(C)c1C[N@H+](C)Cc1ccncc1Br ZINC001473836435 1061428604 /nfs/dbraw/zinc/42/86/04/1061428604.db2.gz BSWDHMLYQUHRHA-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO FC1(C2CC2)CC[NH+](Cc2cc(Cl)nc(Cl)c2)CC1 ZINC001473854345 1061435006 /nfs/dbraw/zinc/43/50/06/1061435006.db2.gz DSUKVZQCXVDYEN-UHFFFAOYSA-N 1 2 303.208 4.103 20 0 DIADLO Cc1cccnc1[C@H](C)[NH2+][C@H](C)c1ncc(-c2ccccc2)o1 ZINC001473878791 1061448460 /nfs/dbraw/zinc/44/84/60/1061448460.db2.gz ABJYPTCBIKXYRD-LSDHHAIUSA-N 1 2 307.397 4.457 20 0 DIADLO CC(C)Oc1cc(F)ccc1-c1[nH]c2ccc(N(C)C)cc2[nH+]1 ZINC001251763376 1061476702 /nfs/dbraw/zinc/47/67/02/1061476702.db2.gz YYJJHVLVLSFKAC-UHFFFAOYSA-N 1 2 313.376 4.222 20 0 DIADLO CC[NH+](CC)[C@H](CNCc1cccc(Cl)c1F)c1ccco1 ZINC001473966243 1061510700 /nfs/dbraw/zinc/51/07/00/1061510700.db2.gz FVTOMSUSCRRSHF-OAHLLOKOSA-N 1 2 324.827 4.245 20 0 DIADLO CN(C)c1cc(F)cc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c1 ZINC001251853975 1061512855 /nfs/dbraw/zinc/51/28/55/1061512855.db2.gz IWWORHBVEORVSN-UHFFFAOYSA-N 1 2 324.403 4.035 20 0 DIADLO Cc1cc(Oc2ccc(NC[C@H](O)c3ccccc3)cc2)cc[nH+]1 ZINC001251999057 1061552923 /nfs/dbraw/zinc/55/29/23/1061552923.db2.gz MFDFPDJUKAISAI-FQEVSTJZSA-N 1 2 320.392 4.328 20 0 DIADLO Cc1cc(CNC(=O)N2CCC(C)(CC(C)C)CC2)cc(C)[nH+]1 ZINC001252028324 1061559327 /nfs/dbraw/zinc/55/93/27/1061559327.db2.gz SBUAWPBWEPNACD-UHFFFAOYSA-N 1 2 317.477 4.056 20 0 DIADLO CC(C)Cc1cc(Nc2ccc([NH+]3CCCCC3)cc2)ncn1 ZINC001458073679 1061559743 /nfs/dbraw/zinc/55/97/43/1061559743.db2.gz WUPQEPMAJGFGSD-UHFFFAOYSA-N 1 2 310.445 4.409 20 0 DIADLO CC/C=C(\F)C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001464222684 1061565229 /nfs/dbraw/zinc/56/52/29/1061565229.db2.gz TWLYTLPFOVSYJW-BNCCVWRVSA-N 1 2 313.376 4.088 20 0 DIADLO CCCC[C@@H](O)CNc1ccc(Oc2cc[nH+]c(C)c2)cc1 ZINC001252103446 1061572882 /nfs/dbraw/zinc/57/28/82/1061572882.db2.gz ZKCZDAFTNOOXPW-MRXNPFEDSA-N 1 2 300.402 4.145 20 0 DIADLO CC(C)c1cc(NCCSC(F)(F)F)nc(C(C)C)[nH+]1 ZINC001458110668 1061574525 /nfs/dbraw/zinc/57/45/25/1061574525.db2.gz VNUOPUCFPXGINJ-UHFFFAOYSA-N 1 2 307.385 4.388 20 0 DIADLO Cc1cc(N2CC[C@@H](c3ccccc3C)C2)nc(C2CCC2)[nH+]1 ZINC001458139416 1061593722 /nfs/dbraw/zinc/59/37/22/1061593722.db2.gz GWXFLUFDRIISGJ-QGZVFWFLSA-N 1 2 307.441 4.355 20 0 DIADLO C/C(=C\c1ccco1)C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC001464460812 1061595894 /nfs/dbraw/zinc/59/58/94/1061595894.db2.gz VKIOZDVPSSCOCE-ZRDIBKRKSA-N 1 2 321.380 4.329 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@]34C[C@@H]3CCCC4)c2)[nH+]c1C ZINC001464458472 1061596020 /nfs/dbraw/zinc/59/60/20/1061596020.db2.gz JGNCACAUQNSWRA-KXBFYZLASA-N 1 2 309.413 4.212 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3C[C@H]3C(C)(C)C)c2)[nH+]c1C ZINC001464467483 1061597487 /nfs/dbraw/zinc/59/74/87/1061597487.db2.gz ZEXJFFKLXHIUHE-HZPDHXFCSA-N 1 2 311.429 4.314 20 0 DIADLO CC(C)(C)c1ccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)nc1 ZINC001464571389 1061608644 /nfs/dbraw/zinc/60/86/44/1061608644.db2.gz WNMGOGSQIPGQHS-UHFFFAOYSA-N 1 2 320.396 4.022 20 0 DIADLO CC(C)Oc1ccc(NCc2cccc3[nH+]ccn32)cc1Cl ZINC001474063253 1061610773 /nfs/dbraw/zinc/61/07/73/1061610773.db2.gz CPKIBFXCVSJPEH-UHFFFAOYSA-N 1 2 315.804 4.387 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccccc1CCC(F)(F)F ZINC001474067331 1061613702 /nfs/dbraw/zinc/61/37/02/1061613702.db2.gz NQQCUBXRFAQSPH-UHFFFAOYSA-N 1 2 311.351 4.400 20 0 DIADLO COc1cc[nH+]cc1NCc1ccc(-c2ccc(F)cc2C)o1 ZINC001474079971 1061626206 /nfs/dbraw/zinc/62/62/06/1061626206.db2.gz MLDJFVRJGGDHKY-UHFFFAOYSA-N 1 2 312.344 4.410 20 0 DIADLO CSc1cc(C[NH2+]Cc2c(F)ccc(F)c2Cl)ccn1 ZINC001474089759 1061637691 /nfs/dbraw/zinc/63/76/91/1061637691.db2.gz JJIHPIIWKXSZTH-UHFFFAOYSA-N 1 2 314.788 4.025 20 0 DIADLO CCO[C@H](CCNc1cc(C)[nH+]c(C2CC2)n1)C1CCCC1 ZINC001458234111 1061650313 /nfs/dbraw/zinc/65/03/13/1061650313.db2.gz YFENDVSCSRVXJI-MRXNPFEDSA-N 1 2 303.450 4.060 20 0 DIADLO CCc1nc(N2CCCC[C@@H]2c2ccc(F)cc2F)cc(C)[nH+]1 ZINC001458251386 1061659982 /nfs/dbraw/zinc/65/99/82/1061659982.db2.gz LOAVJSRWGOXEJE-MRXNPFEDSA-N 1 2 317.383 4.357 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1cc(C)[nH+]c(C3CC3)n1)CCC2 ZINC001458263048 1061664775 /nfs/dbraw/zinc/66/47/75/1061664775.db2.gz MTITUXMYFYKKMO-KRWDZBQOSA-N 1 2 309.413 4.161 20 0 DIADLO Cc1cccc([C@H](O)CNc2cc(C(C)C)[nH+]c(C(C)C)n2)c1 ZINC001458259744 1061665096 /nfs/dbraw/zinc/66/50/96/1061665096.db2.gz IXRWFNDZLDOLBX-QGZVFWFLSA-N 1 2 313.445 4.177 20 0 DIADLO CCC1(CC)[C@H](Nc2cc(C)[nH+]c(C3CCC3)n2)[C@@H](C)[C@H]1OC ZINC001458294160 1061681226 /nfs/dbraw/zinc/68/12/26/1061681226.db2.gz BSAJMVQNEZJLRE-KBRIMQKVSA-N 1 2 317.477 4.304 20 0 DIADLO Cc1nc(NCCCc2cccc(Cl)c2)c2c([nH+]1)CCCC2 ZINC001458355296 1061717728 /nfs/dbraw/zinc/71/77/28/1061717728.db2.gz FUYKIBDIPJIZEL-UHFFFAOYSA-N 1 2 315.848 4.362 20 0 DIADLO CCc1ccc([C@@H]2CCN(c3nc(C)[nH+]c4c3CCCC4)C2)cc1 ZINC001458404623 1061742942 /nfs/dbraw/zinc/74/29/42/1061742942.db2.gz FGVNSTOZIPMTNV-GOSISDBHSA-N 1 2 321.468 4.220 20 0 DIADLO CCc1ccc([C@H]2CCN(c3nc(C)[nH+]c4c3CCCC4)C2)cc1 ZINC001458404636 1061743009 /nfs/dbraw/zinc/74/30/09/1061743009.db2.gz FGVNSTOZIPMTNV-SFHVURJKSA-N 1 2 321.468 4.220 20 0 DIADLO Cc1cc(CNc2cc3cc[nH]c3c[nH+]2)ccc1Br ZINC001474193331 1061743184 /nfs/dbraw/zinc/74/31/84/1061743184.db2.gz HLFLQUCDIOXCJV-UHFFFAOYSA-N 1 2 316.202 4.246 20 0 DIADLO Clc1ccc2sc(CNc3cc4cc[nH]c4c[nH+]3)cc2n1 ZINC001474193793 1061744830 /nfs/dbraw/zinc/74/48/30/1061744830.db2.gz XCAGRHVXYPSETN-UHFFFAOYSA-N 1 2 314.801 4.438 20 0 DIADLO CC(C)c1cc(N[C@H](CO)CC2CCCCC2)nc(C(C)C)[nH+]1 ZINC001458442720 1061767257 /nfs/dbraw/zinc/76/72/57/1061767257.db2.gz FFZQDINEJVPLFT-INIZCTEOSA-N 1 2 319.493 4.467 20 0 DIADLO CCc1ccc(-c2nnc([C@@H]3Cc4ccccc4C[N@@H+]3C)o2)cc1 ZINC001252972580 1061770758 /nfs/dbraw/zinc/77/07/58/1061770758.db2.gz MGLQWDTXKFBBRV-SFHVURJKSA-N 1 2 319.408 4.028 20 0 DIADLO CCc1ccc(-c2nnc([C@@H]3Cc4ccccc4C[N@H+]3C)o2)cc1 ZINC001252972580 1061770768 /nfs/dbraw/zinc/77/07/68/1061770768.db2.gz MGLQWDTXKFBBRV-SFHVURJKSA-N 1 2 319.408 4.028 20 0 DIADLO CCC[C@@H](NC(=O)Nc1ccc2[nH+]c(C)cn2c1)C1CCCC1 ZINC001465531849 1061771490 /nfs/dbraw/zinc/77/14/90/1061771490.db2.gz IMDJIEODHZBAMK-MRXNPFEDSA-N 1 2 314.433 4.123 20 0 DIADLO CCc1ccc(-c2nnc([C@@H]3CC[N@@H+]3Cc3ccccc3)o2)cc1 ZINC001252981818 1061771570 /nfs/dbraw/zinc/77/15/70/1061771570.db2.gz NFMGAYMYZQUFES-SFHVURJKSA-N 1 2 319.408 4.246 20 0 DIADLO CCc1ccc(-c2nnc([C@@H]3CC[N@H+]3Cc3ccccc3)o2)cc1 ZINC001252981818 1061771604 /nfs/dbraw/zinc/77/16/04/1061771604.db2.gz NFMGAYMYZQUFES-SFHVURJKSA-N 1 2 319.408 4.246 20 0 DIADLO Cc1cc(NCCC[C@@H]2CC2(Cl)Cl)nc(C2CCC2)[nH+]1 ZINC001458463058 1061777950 /nfs/dbraw/zinc/77/79/50/1061777950.db2.gz IGSQRBCTICPWMP-GFCCVEGCSA-N 1 2 314.260 4.438 20 0 DIADLO CCc1cc(N(C)[C@@H](C)CSc2ccccc2)nc(CC)[nH+]1 ZINC001458472957 1061784183 /nfs/dbraw/zinc/78/41/83/1061784183.db2.gz RYIFXSMQBPWJMX-AWEZNQCLSA-N 1 2 315.486 4.218 20 0 DIADLO CCCOc1ccc(NCc2c[nH+]c3c(C)cccn23)cc1C ZINC001474226074 1061786056 /nfs/dbraw/zinc/78/60/56/1061786056.db2.gz HNFDEXJNQVBDLE-UHFFFAOYSA-N 1 2 309.413 4.352 20 0 DIADLO FC[C@H]([NH2+]Cc1cc2cc(Cl)cnc2o1)c1ccc(F)cc1 ZINC001474241778 1061805478 /nfs/dbraw/zinc/80/54/78/1061805478.db2.gz DAGLKKOIIWGHKI-HNNXBMFYSA-N 1 2 322.742 4.421 20 0 DIADLO COc1cccc2[nH]c(NCc3ccc(CSC)cc3)[nH+]c21 ZINC001474253536 1061819121 /nfs/dbraw/zinc/81/91/21/1061819121.db2.gz CAROYPSWOZOURS-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO COc1cc(F)cc(CNc2[nH+]c3ccccc3n2C(C)C)c1 ZINC001474251390 1061819930 /nfs/dbraw/zinc/81/99/30/1061819930.db2.gz ZISJOSBRDDGBLH-UHFFFAOYSA-N 1 2 313.376 4.377 20 0 DIADLO CCn1cnc(CNc2[nH+]c3ccccc3n2C2CCCCC2)c1 ZINC001474250943 1061820028 /nfs/dbraw/zinc/82/00/28/1061820028.db2.gz HDSCICCFNHYFNP-UHFFFAOYSA-N 1 2 323.444 4.370 20 0 DIADLO Cc1cc(N2CCc3ccc(Cl)c(C)c3C2)nc(C2CC2)[nH+]1 ZINC001458541131 1061826635 /nfs/dbraw/zinc/82/66/35/1061826635.db2.gz DTUMTULFFIJRAM-UHFFFAOYSA-N 1 2 313.832 4.187 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSc1ncc2ccccn21 ZINC001458794367 1061907751 /nfs/dbraw/zinc/90/77/51/1061907751.db2.gz VFYBPTVNGNREJQ-UHFFFAOYSA-N 1 2 320.421 4.121 20 0 DIADLO CCCCC[C@@H](O)CNc1cc(-c2cccc(F)c2)cc[nH+]1 ZINC001253521092 1061911783 /nfs/dbraw/zinc/91/17/83/1061911783.db2.gz OWDHUPOPKRRECX-QGZVFWFLSA-N 1 2 302.393 4.241 20 0 DIADLO c1cc(CSCC2CCCCC2)cc(C[NH+]2CCOCC2)c1 ZINC001458934557 1061948619 /nfs/dbraw/zinc/94/86/19/1061948619.db2.gz QOVURRHUHPFXTF-UHFFFAOYSA-N 1 2 319.514 4.332 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2[C@H](c3ccccc3)C2(C)C)c(C)[nH+]1 ZINC001466755956 1061999792 /nfs/dbraw/zinc/99/97/92/1061999792.db2.gz IHFUNCXRFDQJJA-WMZOPIPTSA-N 1 2 323.440 4.321 20 0 DIADLO CON(C[C@H]1CCC[C@H](C)C1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001466755256 1062001308 /nfs/dbraw/zinc/00/13/08/1062001308.db2.gz NYRSUJVHFSOETE-LRDDRELGSA-N 1 2 319.449 4.228 20 0 DIADLO COc1cc(C[NH+](Cc2ccco2)Cc2ccco2)ccc1F ZINC001253976110 1062005789 /nfs/dbraw/zinc/00/57/89/1062005789.db2.gz NACGXUGTHKARCK-UHFFFAOYSA-N 1 2 315.344 4.223 20 0 DIADLO Cc1cc(N2CCC(Cc3cccnc3)CC2)[nH+]c2ccccc12 ZINC001254071045 1062020271 /nfs/dbraw/zinc/02/02/71/1062020271.db2.gz VBIUXHHNTZLDAC-UHFFFAOYSA-N 1 2 317.436 4.397 20 0 DIADLO CC[NH+](CC)[C@H](c1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC001254082238 1062022129 /nfs/dbraw/zinc/02/21/29/1062022129.db2.gz PIFNNCATQUOGOD-AWEZNQCLSA-N 1 2 305.809 4.032 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H]2CC[C@@H](Cc3ccccc3)C2)c(C)[nH+]1 ZINC001459169051 1062033585 /nfs/dbraw/zinc/03/35/85/1062033585.db2.gz ZBLRYDZWXLTGKJ-OALUTQOASA-N 1 2 322.452 4.148 20 0 DIADLO CCC[C@@H](O)CCCSCc1ccc(-n2cc[nH+]c2)cc1 ZINC001459209558 1062043112 /nfs/dbraw/zinc/04/31/12/1062043112.db2.gz FHSFBTPVNAGTTQ-QGZVFWFLSA-N 1 2 304.459 4.047 20 0 DIADLO Cc1cc(F)ncc1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC001474397802 1062051398 /nfs/dbraw/zinc/05/13/98/1062051398.db2.gz BAJPJLVQXKRRQD-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC001474397802 1062051414 /nfs/dbraw/zinc/05/14/14/1062051414.db2.gz BAJPJLVQXKRRQD-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1cccc([C@@H](NC(=O)Nc2ccc3[nH+]ccn3c2)C(C)C)c1 ZINC001467067403 1062060220 /nfs/dbraw/zinc/06/02/20/1062060220.db2.gz RJTWNGAXWLNWAM-SFHVURJKSA-N 1 2 322.412 4.162 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](C)Cc1nc(Br)cs1 ZINC001474410244 1062072121 /nfs/dbraw/zinc/07/21/21/1062072121.db2.gz OMUCIOGVPNVLHN-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1nc(Br)cs1 ZINC001474410244 1062072145 /nfs/dbraw/zinc/07/21/45/1062072145.db2.gz OMUCIOGVPNVLHN-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO Cc1ccnc(C[N@@H+](C)[C@H](C)c2ccccc2)c1Br ZINC001474409647 1062073916 /nfs/dbraw/zinc/07/39/16/1062073916.db2.gz HFXPSRANHPHTRL-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccnc(C[N@H+](C)[C@H](C)c2ccccc2)c1Br ZINC001474409647 1062073937 /nfs/dbraw/zinc/07/39/37/1062073937.db2.gz HFXPSRANHPHTRL-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO COC(=O)[C@@H](CC(C)C)[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC001459314287 1062083899 /nfs/dbraw/zinc/08/38/99/1062083899.db2.gz OGRFOKPNNMFEAJ-CQSZACIVSA-N 1 2 318.244 4.013 20 0 DIADLO COC(=O)[C@@H](CC(C)C)[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC001459314287 1062083922 /nfs/dbraw/zinc/08/39/22/1062083922.db2.gz OGRFOKPNNMFEAJ-CQSZACIVSA-N 1 2 318.244 4.013 20 0 DIADLO COC(=O)[C@H](CC(C)C)[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC001459314284 1062085658 /nfs/dbraw/zinc/08/56/58/1062085658.db2.gz OGRFOKPNNMFEAJ-AWEZNQCLSA-N 1 2 318.244 4.013 20 0 DIADLO COC(=O)[C@H](CC(C)C)[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC001459314284 1062085685 /nfs/dbraw/zinc/08/56/85/1062085685.db2.gz OGRFOKPNNMFEAJ-AWEZNQCLSA-N 1 2 318.244 4.013 20 0 DIADLO Fc1cccc(C[N@H+](Cc2ccc(F)c(F)c2F)C2CC2)c1 ZINC001474414930 1062085595 /nfs/dbraw/zinc/08/55/95/1062085595.db2.gz QIVLVGXHPMJVLM-UHFFFAOYSA-N 1 2 309.306 4.408 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2ccc(F)c(F)c2F)C2CC2)c1 ZINC001474414930 1062085616 /nfs/dbraw/zinc/08/56/16/1062085616.db2.gz QIVLVGXHPMJVLM-UHFFFAOYSA-N 1 2 309.306 4.408 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)n1 ZINC001459328509 1062091977 /nfs/dbraw/zinc/09/19/77/1062091977.db2.gz DYKLYKXPAZEKLC-HNNXBMFYSA-N 1 2 302.393 4.448 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)n1 ZINC001459328509 1062091995 /nfs/dbraw/zinc/09/19/95/1062091995.db2.gz DYKLYKXPAZEKLC-HNNXBMFYSA-N 1 2 302.393 4.448 20 0 DIADLO CCC[N@H+](CC(=O)OCC)Cc1ccc(-c2cccs2)cc1 ZINC001459363320 1062112923 /nfs/dbraw/zinc/11/29/23/1062112923.db2.gz JBBXSEALBLHKGP-UHFFFAOYSA-N 1 2 317.454 4.190 20 0 DIADLO CCC[N@@H+](CC(=O)OCC)Cc1ccc(-c2cccs2)cc1 ZINC001459363320 1062112933 /nfs/dbraw/zinc/11/29/33/1062112933.db2.gz JBBXSEALBLHKGP-UHFFFAOYSA-N 1 2 317.454 4.190 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1ccc(-c2ncco2)cc1F ZINC001459385550 1062120735 /nfs/dbraw/zinc/12/07/35/1062120735.db2.gz GWJYZWGELMZIBL-LBPRGKRZSA-N 1 2 300.333 4.267 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccc(-c2ncco2)cc1F ZINC001459385550 1062120750 /nfs/dbraw/zinc/12/07/50/1062120750.db2.gz GWJYZWGELMZIBL-LBPRGKRZSA-N 1 2 300.333 4.267 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ncc(Br)cc1Cl ZINC001459450184 1062148454 /nfs/dbraw/zinc/14/84/54/1062148454.db2.gz SACUVLQRZNQTEJ-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+](Cc1ccccc1Cl)C1CCCC1 ZINC001459445290 1062148802 /nfs/dbraw/zinc/14/88/02/1062148802.db2.gz CENQGPIOZHJVGV-CQSZACIVSA-N 1 2 323.864 4.426 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+](Cc1ccccc1Cl)C1CCCC1 ZINC001459445290 1062148813 /nfs/dbraw/zinc/14/88/13/1062148813.db2.gz CENQGPIOZHJVGV-CQSZACIVSA-N 1 2 323.864 4.426 20 0 DIADLO Cc1ccc2[nH+]cc(CN3C[C@@H](C(C)C)c4ccccc43)n2c1 ZINC001474488162 1062166885 /nfs/dbraw/zinc/16/68/85/1062166885.db2.gz IMPMCJOMYCFHGN-SFHVURJKSA-N 1 2 305.425 4.403 20 0 DIADLO Cc1ccc2[nH+]cc(CN3C[C@H](C(C)C)c4ccccc43)n2c1 ZINC001474488160 1062166972 /nfs/dbraw/zinc/16/69/72/1062166972.db2.gz IMPMCJOMYCFHGN-GOSISDBHSA-N 1 2 305.425 4.403 20 0 DIADLO C/C=C\C[C@H]([NH2+][C@@H](C)CC(C)(C)c1ccccc1)C(=O)OCC ZINC001474495176 1062176092 /nfs/dbraw/zinc/17/60/92/1062176092.db2.gz GLQQUERZEUOQHE-UQVHZRPISA-N 1 2 317.473 4.230 20 0 DIADLO Fc1ccccc1-n1ccc(C[N@H+](Cc2ccccc2)C2CC2)n1 ZINC001459522321 1062180415 /nfs/dbraw/zinc/18/04/15/1062180415.db2.gz KMTQUYGBSWBPDS-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO Fc1ccccc1-n1ccc(C[N@@H+](Cc2ccccc2)C2CC2)n1 ZINC001459522321 1062180423 /nfs/dbraw/zinc/18/04/23/1062180423.db2.gz KMTQUYGBSWBPDS-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2ncc(C(C)C)s2)CCC1 ZINC001254574337 1062186284 /nfs/dbraw/zinc/18/62/84/1062186284.db2.gz ZIIFUMABXZCLKD-UHFFFAOYSA-N 1 2 316.470 4.444 20 0 DIADLO CC(C)[C@@H]1C[N@H+](Cc2ncc(Br)s2)[C@H]1C(C)C ZINC001474521648 1062205539 /nfs/dbraw/zinc/20/55/39/1062205539.db2.gz OHYVVCQZQPNVQW-GWCFXTLKSA-N 1 2 317.296 4.018 20 0 DIADLO CC(C)[C@@H]1C[N@@H+](Cc2ncc(Br)s2)[C@H]1C(C)C ZINC001474521648 1062205559 /nfs/dbraw/zinc/20/55/59/1062205559.db2.gz OHYVVCQZQPNVQW-GWCFXTLKSA-N 1 2 317.296 4.018 20 0 DIADLO CCCn1c[nH+]cc1CN1CC[C@H](C(F)(F)F)c2ccccc21 ZINC001474541799 1062233269 /nfs/dbraw/zinc/23/32/69/1062233269.db2.gz PJPFTTLMFGTFES-HNNXBMFYSA-N 1 2 323.362 4.349 20 0 DIADLO Clc1ccnc(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)c1Cl ZINC001459602340 1062237751 /nfs/dbraw/zinc/23/77/51/1062237751.db2.gz LRXLDJJBYVDXMI-OLZOCXBDSA-N 1 2 317.285 4.248 20 0 DIADLO Clc1ccnc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)c1Cl ZINC001459602340 1062237774 /nfs/dbraw/zinc/23/77/74/1062237774.db2.gz LRXLDJJBYVDXMI-OLZOCXBDSA-N 1 2 317.285 4.248 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Br)cc2C(F)(F)F)[C@@H]1C ZINC001474549849 1062245200 /nfs/dbraw/zinc/24/52/00/1062245200.db2.gz LBOJIVOCTWUVMH-RKDXNWHRSA-N 1 2 322.168 4.308 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Br)cc2C(F)(F)F)[C@@H]1C ZINC001474549849 1062245222 /nfs/dbraw/zinc/24/52/22/1062245222.db2.gz LBOJIVOCTWUVMH-RKDXNWHRSA-N 1 2 322.168 4.308 20 0 DIADLO C[N@H+](C[C@H]1CCCC(C)(C)C1)[C@H](c1nnc[nH]1)c1ccccc1 ZINC001474571058 1062280304 /nfs/dbraw/zinc/28/03/04/1062280304.db2.gz JOPOTAOIMGCTPT-RDJZCZTQSA-N 1 2 312.461 4.042 20 0 DIADLO C[N@@H+](C[C@H]1CCCC(C)(C)C1)[C@H](c1nnc[nH]1)c1ccccc1 ZINC001474571058 1062280324 /nfs/dbraw/zinc/28/03/24/1062280324.db2.gz JOPOTAOIMGCTPT-RDJZCZTQSA-N 1 2 312.461 4.042 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]([C@H](C)C(=O)OC(C)(C)C)C2CC2)c1 ZINC001474575133 1062284080 /nfs/dbraw/zinc/28/40/80/1062284080.db2.gz BRGBHLRDQMNJCB-CYBMUJFWSA-N 1 2 323.864 4.343 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]([C@H](C)C(=O)OC(C)(C)C)C2CC2)c1 ZINC001474575133 1062284093 /nfs/dbraw/zinc/28/40/93/1062284093.db2.gz BRGBHLRDQMNJCB-CYBMUJFWSA-N 1 2 323.864 4.343 20 0 DIADLO CC(C)Cc1ccc([C@@H]([NH2+]Cc2cnsn2)C(C)C)cc1 ZINC001459687813 1062308654 /nfs/dbraw/zinc/30/86/54/1062308654.db2.gz UHHZFAZUBIIACV-KRWDZBQOSA-N 1 2 303.475 4.224 20 0 DIADLO CN(C)c1[nH+]cc(CN2CCc3cccc(F)c32)c2ccccc21 ZINC001459692875 1062310242 /nfs/dbraw/zinc/31/02/42/1062310242.db2.gz IVZPXCPDAFSAMF-UHFFFAOYSA-N 1 2 321.399 4.003 20 0 DIADLO COc1ccc(NCc2[nH+]cc(C)c(OC)c2C)c2ccccc12 ZINC001474656056 1062386692 /nfs/dbraw/zinc/38/66/92/1062386692.db2.gz BNETUDNITUNPRU-UHFFFAOYSA-N 1 2 322.408 4.481 20 0 DIADLO CCCC[C@H](C)[NH2+][C@@H](Cc1ccc2ccccc2c1)C(=O)OC ZINC001255321195 1062399168 /nfs/dbraw/zinc/39/91/68/1062399168.db2.gz QMHVKUNMUZFGDS-KXBFYZLASA-N 1 2 313.441 4.092 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCc3c(cccc3C(C)C)C2)c(C)[nH+]1 ZINC001459791715 1062401326 /nfs/dbraw/zinc/40/13/26/1062401326.db2.gz MIXYHMYFNMQEOM-UHFFFAOYSA-N 1 2 322.452 4.329 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCc3ccc(Cl)c(C)c3C2)c1 ZINC001474677379 1062407808 /nfs/dbraw/zinc/40/78/08/1062407808.db2.gz KXNLOLRUVFWMSM-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCc3ccc(Cl)c(C)c3C2)c1 ZINC001474677379 1062407845 /nfs/dbraw/zinc/40/78/45/1062407845.db2.gz KXNLOLRUVFWMSM-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO COc1ccc(C(C)(C)CNc2c[nH+]c(C)c(C)c2)cc1OC ZINC001474684951 1062417343 /nfs/dbraw/zinc/41/73/43/1062417343.db2.gz RAMSRJPUOAJJFU-UHFFFAOYSA-N 1 2 314.429 4.105 20 0 DIADLO COC1CCC([NH2+][C@H](c2cccc(Cl)c2)C(F)F)CC1 ZINC001474707023 1062434131 /nfs/dbraw/zinc/43/41/31/1062434131.db2.gz OJOKBOWPYGUBPL-JXQTWKCFSA-N 1 2 303.780 4.193 20 0 DIADLO Cc1ccc(C)c(C2CC[NH+](Cc3ncc(Cl)n3C)CC2)c1 ZINC001474740276 1062457355 /nfs/dbraw/zinc/45/73/55/1062457355.db2.gz LLSXVKMREOFCMB-UHFFFAOYSA-N 1 2 317.864 4.070 20 0 DIADLO CC(C)CCNc1[nH+]c2ccccc2n1CCc1ccccn1 ZINC001474764074 1062468654 /nfs/dbraw/zinc/46/86/54/1062468654.db2.gz PUPUZKUPZWIEQB-UHFFFAOYSA-N 1 2 308.429 4.132 20 0 DIADLO C[C@@H](CC(F)(F)F)[N@@H+]1CCc2ccc(Br)cc2C1 ZINC001255657452 1062500892 /nfs/dbraw/zinc/50/08/92/1062500892.db2.gz HLIYTNDWBMMKAV-VIFPVBQESA-N 1 2 322.168 4.148 20 0 DIADLO C[C@@H](CC(F)(F)F)[N@H+]1CCc2ccc(Br)cc2C1 ZINC001255657452 1062500904 /nfs/dbraw/zinc/50/09/04/1062500904.db2.gz HLIYTNDWBMMKAV-VIFPVBQESA-N 1 2 322.168 4.148 20 0 DIADLO Clc1cccc(CSCc2ccc(-n3cc[nH+]c3)cc2)n1 ZINC001255680947 1062513848 /nfs/dbraw/zinc/51/38/48/1062513848.db2.gz CIAFAXMZAWZUOE-UHFFFAOYSA-N 1 2 315.829 4.354 20 0 DIADLO CCC[N@H+](Cc1c(C)cccc1Cl)[C@H](CC)C(=O)OCC ZINC001459946783 1062514446 /nfs/dbraw/zinc/51/44/46/1062514446.db2.gz XUYAQZNKCVSQSM-MRXNPFEDSA-N 1 2 311.853 4.202 20 0 DIADLO CCC[N@@H+](Cc1c(C)cccc1Cl)[C@H](CC)C(=O)OCC ZINC001459946783 1062514471 /nfs/dbraw/zinc/51/44/71/1062514471.db2.gz XUYAQZNKCVSQSM-MRXNPFEDSA-N 1 2 311.853 4.202 20 0 DIADLO CC[C@]1(C)C[N@H+](Cc2ccc(OC(C)C)c(Cl)c2)CCO1 ZINC001459964230 1062534004 /nfs/dbraw/zinc/53/40/04/1062534004.db2.gz XWEGUCWBYRLMHU-QGZVFWFLSA-N 1 2 311.853 4.128 20 0 DIADLO CC[C@]1(C)C[N@@H+](Cc2ccc(OC(C)C)c(Cl)c2)CCO1 ZINC001459964230 1062534020 /nfs/dbraw/zinc/53/40/20/1062534020.db2.gz XWEGUCWBYRLMHU-QGZVFWFLSA-N 1 2 311.853 4.128 20 0 DIADLO CC[C@@]1(C)C[N@H+](Cc2ccc(OC(C)C)c(Cl)c2)CCO1 ZINC001459964229 1062534957 /nfs/dbraw/zinc/53/49/57/1062534957.db2.gz XWEGUCWBYRLMHU-KRWDZBQOSA-N 1 2 311.853 4.128 20 0 DIADLO CC[C@@]1(C)C[N@@H+](Cc2ccc(OC(C)C)c(Cl)c2)CCO1 ZINC001459964229 1062534977 /nfs/dbraw/zinc/53/49/77/1062534977.db2.gz XWEGUCWBYRLMHU-KRWDZBQOSA-N 1 2 311.853 4.128 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2[C@@H]2CCC[C@H](C(F)(F)F)C2)no1 ZINC001255718927 1062538175 /nfs/dbraw/zinc/53/81/75/1062538175.db2.gz XGABDPPTCHPPSB-XQQFMLRXSA-N 1 2 317.355 4.026 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2[C@@H]2CCC[C@H](C(F)(F)F)C2)no1 ZINC001255718927 1062538196 /nfs/dbraw/zinc/53/81/96/1062538196.db2.gz XGABDPPTCHPPSB-XQQFMLRXSA-N 1 2 317.355 4.026 20 0 DIADLO Cn1nc(C[NH+]2CCC(c3ccc(Cl)cc3)CC2)cc1Cl ZINC001459996205 1062552687 /nfs/dbraw/zinc/55/26/87/1062552687.db2.gz XGKKGSXWGGJBKZ-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO CCN(Cc1cc(OC)cc(C)[nH+]1)c1ccc(Cl)c(F)c1 ZINC001460023167 1062580142 /nfs/dbraw/zinc/58/01/42/1062580142.db2.gz QKFCVQUORXJYCS-UHFFFAOYSA-N 1 2 308.784 4.218 20 0 DIADLO Cc1ccc(SC[C@@H](C)[NH2+]CC(F)(F)c2ccccn2)cc1 ZINC001255758771 1062582225 /nfs/dbraw/zinc/58/22/25/1062582225.db2.gz IQMQHCLFQQMHRD-CQSZACIVSA-N 1 2 322.424 4.252 20 0 DIADLO Cc1ccc(SC[C@H](C)[N@@H+]2CCC(F)(F)[C@@H](F)C2)cc1 ZINC001255765178 1062585315 /nfs/dbraw/zinc/58/53/15/1062585315.db2.gz KCQPYDQRAQNWMJ-JSGCOSHPSA-N 1 2 303.393 4.155 20 0 DIADLO Cc1ccc(SC[C@H](C)[N@H+]2CCC(F)(F)[C@@H](F)C2)cc1 ZINC001255765178 1062585335 /nfs/dbraw/zinc/58/53/35/1062585335.db2.gz KCQPYDQRAQNWMJ-JSGCOSHPSA-N 1 2 303.393 4.155 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CCc2c(cccc2C(C)C)C1 ZINC001460048260 1062600944 /nfs/dbraw/zinc/60/09/44/1062600944.db2.gz MRFWGROILODYOI-UHFFFAOYSA-N 1 2 317.864 4.064 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CCc2c(cccc2C(C)C)C1 ZINC001460048260 1062600963 /nfs/dbraw/zinc/60/09/63/1062600963.db2.gz MRFWGROILODYOI-UHFFFAOYSA-N 1 2 317.864 4.064 20 0 DIADLO CCC1(CC)[C@H]([NH2+]CC(F)(F)c2ccc(F)cc2)C[C@@H]1OC ZINC001460063757 1062608674 /nfs/dbraw/zinc/60/86/74/1062608674.db2.gz IPGDPYMSJPCWCR-CABCVRRESA-N 1 2 315.379 4.101 20 0 DIADLO CCC1(CC)[C@@H]([NH2+]CC(F)(F)c2ccc(F)cc2)C[C@@H]1OC ZINC001460063759 1062608925 /nfs/dbraw/zinc/60/89/25/1062608925.db2.gz IPGDPYMSJPCWCR-GJZGRUSLSA-N 1 2 315.379 4.101 20 0 DIADLO CCSc1ccccc1C[N@@H+]1CCCC[C@@H]1c1nc(C)no1 ZINC001460073672 1062619058 /nfs/dbraw/zinc/61/90/58/1062619058.db2.gz SCWKKEAOIAYEOY-OAHLLOKOSA-N 1 2 317.458 4.217 20 0 DIADLO CCSc1ccccc1C[N@H+]1CCCC[C@@H]1c1nc(C)no1 ZINC001460073672 1062619066 /nfs/dbraw/zinc/61/90/66/1062619066.db2.gz SCWKKEAOIAYEOY-OAHLLOKOSA-N 1 2 317.458 4.217 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@@H+]1CCC[C@](C)(F)C1 ZINC001460145530 1062664429 /nfs/dbraw/zinc/66/44/29/1062664429.db2.gz QROPPGKICAUGRK-RISCZKNCSA-N 1 2 300.215 4.334 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@H+]1CCC[C@](C)(F)C1 ZINC001460145530 1062664434 /nfs/dbraw/zinc/66/44/34/1062664434.db2.gz QROPPGKICAUGRK-RISCZKNCSA-N 1 2 300.215 4.334 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2Cc3cnn(-c4ccccc4)c3C2)c(C)c1 ZINC001460175953 1062682531 /nfs/dbraw/zinc/68/25/31/1062682531.db2.gz GAZQRNZWBHFYSR-UHFFFAOYSA-N 1 2 317.436 4.313 20 0 DIADLO Cc1cc(C)c(C[N@H+]2Cc3cnn(-c4ccccc4)c3C2)c(C)c1 ZINC001460175953 1062682540 /nfs/dbraw/zinc/68/25/40/1062682540.db2.gz GAZQRNZWBHFYSR-UHFFFAOYSA-N 1 2 317.436 4.313 20 0 DIADLO C[C@H]([NH2+][C@H]1CCC[C@H](c2ccccc2)C1)C(=O)OC(C)(C)C ZINC001256106192 1062704150 /nfs/dbraw/zinc/70/41/50/1062704150.db2.gz NXSLZTNBCDCKCN-XIRDDKMYSA-N 1 2 303.446 4.033 20 0 DIADLO CCCCOC(=O)[C@H](C)[NH2+][C@H]1CCC[C@H](c2ccccc2)C1 ZINC001256106893 1062705288 /nfs/dbraw/zinc/70/52/88/1062705288.db2.gz MBKRYEOWDYLERW-SZMVWBNQSA-N 1 2 303.446 4.034 20 0 DIADLO C[C@H]1CC(C)(C)C[N@@H+]1Cc1cc(Br)cc(F)c1F ZINC001460249306 1062730723 /nfs/dbraw/zinc/73/07/23/1062730723.db2.gz FLSUVZGLDHJMJL-VIFPVBQESA-N 1 2 318.205 4.348 20 0 DIADLO C[C@H]1CC(C)(C)C[N@H+]1Cc1cc(Br)cc(F)c1F ZINC001460249306 1062730737 /nfs/dbraw/zinc/73/07/37/1062730737.db2.gz FLSUVZGLDHJMJL-VIFPVBQESA-N 1 2 318.205 4.348 20 0 DIADLO CCc1ccc(C(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)cc1 ZINC001460270691 1062747830 /nfs/dbraw/zinc/74/78/30/1062747830.db2.gz DOVIGYGWEPCPAD-UHFFFAOYSA-N 1 2 319.408 4.116 20 0 DIADLO CN(C)c1[nH+]ccc2cc(NC(=O)C=C3CCCCC3)ccc21 ZINC001460276248 1062751241 /nfs/dbraw/zinc/75/12/41/1062751241.db2.gz WXERPYOLKAHSQB-UHFFFAOYSA-N 1 2 309.413 4.130 20 0 DIADLO C[C@@H](CCc1ccc(Br)cc1)[N@@H+]1CCC(F)(F)C1 ZINC001256221466 1062754395 /nfs/dbraw/zinc/75/43/95/1062754395.db2.gz CGAIDJGNAZWPKK-NSHDSACASA-N 1 2 318.205 4.111 20 0 DIADLO C[C@@H](CCc1ccc(Br)cc1)[N@H+]1CCC(F)(F)C1 ZINC001256221466 1062754417 /nfs/dbraw/zinc/75/44/17/1062754417.db2.gz CGAIDJGNAZWPKK-NSHDSACASA-N 1 2 318.205 4.111 20 0 DIADLO CC(C)(C)OC(=O)C[N@H+](Cc1ccc(Cl)cc1)C1CCC1 ZINC001460316672 1062777370 /nfs/dbraw/zinc/77/73/70/1062777370.db2.gz QEYOOYVBNKBNPD-UHFFFAOYSA-N 1 2 309.837 4.036 20 0 DIADLO CC(C)(C)OC(=O)C[N@@H+](Cc1ccc(Cl)cc1)C1CCC1 ZINC001460316672 1062777385 /nfs/dbraw/zinc/77/73/85/1062777385.db2.gz QEYOOYVBNKBNPD-UHFFFAOYSA-N 1 2 309.837 4.036 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC001460336576 1062790534 /nfs/dbraw/zinc/79/05/34/1062790534.db2.gz DBNBLEAHZVAPBD-CHWSQXEVSA-N 1 2 324.262 4.154 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC001460336576 1062790551 /nfs/dbraw/zinc/79/05/51/1062790551.db2.gz DBNBLEAHZVAPBD-CHWSQXEVSA-N 1 2 324.262 4.154 20 0 DIADLO C[C@@H](CSc1ccccc1)[N@H+](C)CC(=O)c1ccccc1F ZINC001460359693 1062806662 /nfs/dbraw/zinc/80/66/62/1062806662.db2.gz HJXGEMPIVGYKMF-AWEZNQCLSA-N 1 2 317.429 4.121 20 0 DIADLO C[C@@H](CSc1ccccc1)[N@@H+](C)CC(=O)c1ccccc1F ZINC001460359693 1062806686 /nfs/dbraw/zinc/80/66/86/1062806686.db2.gz HJXGEMPIVGYKMF-AWEZNQCLSA-N 1 2 317.429 4.121 20 0 DIADLO CCc1ccc(C2CC[NH+](Cc3cc(Cl)n(C)n3)CC2)cc1 ZINC001460574386 1062919438 /nfs/dbraw/zinc/91/94/38/1062919438.db2.gz HQKNCAZXSYPVQA-UHFFFAOYSA-N 1 2 317.864 4.016 20 0 DIADLO CCn1nc(C)c(C[N@H+](C)Cc2ccc(C)cc2Cl)c1C ZINC001460577810 1062920338 /nfs/dbraw/zinc/92/03/38/1062920338.db2.gz BGRKOADBYQMOCX-UHFFFAOYSA-N 1 2 305.853 4.114 20 0 DIADLO CCn1nc(C)c(C[N@@H+](C)Cc2ccc(C)cc2Cl)c1C ZINC001460577810 1062920351 /nfs/dbraw/zinc/92/03/51/1062920351.db2.gz BGRKOADBYQMOCX-UHFFFAOYSA-N 1 2 305.853 4.114 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@H+](Cc1ccc(C)c(C)c1)C3 ZINC001460705165 1062999726 /nfs/dbraw/zinc/99/97/26/1062999726.db2.gz YQOXFUVTVFIBSW-UHFFFAOYSA-N 1 2 320.436 4.352 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@@H+](Cc1ccc(C)c(C)c1)C3 ZINC001460705165 1062999742 /nfs/dbraw/zinc/99/97/42/1062999742.db2.gz YQOXFUVTVFIBSW-UHFFFAOYSA-N 1 2 320.436 4.352 20 0 DIADLO CCC[C@@H](C)CCC[NH2+][C@@](C)(Cc1ccc(F)cc1)C(=O)OC ZINC001460707053 1063003067 /nfs/dbraw/zinc/00/30/67/1063003067.db2.gz PWWUGGZWOFPLNI-BEFAXECRSA-N 1 2 323.452 4.106 20 0 DIADLO c1cn(-c2cccc(-c3nnc(CCC4CCCCC4)o3)c2)c[nH+]1 ZINC001256849668 1063015945 /nfs/dbraw/zinc/01/59/45/1063015945.db2.gz GWNZHYASJQOYMU-UHFFFAOYSA-N 1 2 322.412 4.435 20 0 DIADLO c1cn(-c2ccc(-c3nnc(CCC4CCCCC4)o3)cc2)c[nH+]1 ZINC001256850202 1063017095 /nfs/dbraw/zinc/01/70/95/1063017095.db2.gz RTPQQWHEPABKGU-UHFFFAOYSA-N 1 2 322.412 4.435 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC001460730122 1063025955 /nfs/dbraw/zinc/02/59/55/1063025955.db2.gz NVARAESVFDZFNV-GPCCPHFNSA-N 1 2 323.305 4.068 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC001460730122 1063025974 /nfs/dbraw/zinc/02/59/74/1063025974.db2.gz NVARAESVFDZFNV-GPCCPHFNSA-N 1 2 323.305 4.068 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC001460736688 1063026732 /nfs/dbraw/zinc/02/67/32/1063026732.db2.gz KFJQMFNXZMLUCR-GFCCVEGCSA-N 1 2 302.805 4.151 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)C/C=C\c2ccc(C)cc2)[nH+]c1C ZINC001471859761 1063026584 /nfs/dbraw/zinc/02/65/84/1063026584.db2.gz SLCKGQYEQQMUMP-SUZKBHRPSA-N 1 2 323.440 4.102 20 0 DIADLO C=Cc1ccc(C(=O)N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001472532747 1063096585 /nfs/dbraw/zinc/09/65/85/1063096585.db2.gz KPWNKVDLAVFYJV-OAHLLOKOSA-N 1 2 317.392 4.006 20 0 DIADLO CC[N@@H+]1CCCC[C@H]1C(=O)Nc1ncc(C2CCCCC2)s1 ZINC001472543511 1063100127 /nfs/dbraw/zinc/10/01/27/1063100127.db2.gz XCYOKCOLCRJMCD-AWEZNQCLSA-N 1 2 321.490 4.004 20 0 DIADLO CC[N@H+]1CCCC[C@H]1C(=O)Nc1ncc(C2CCCCC2)s1 ZINC001472543511 1063100145 /nfs/dbraw/zinc/10/01/45/1063100145.db2.gz XCYOKCOLCRJMCD-AWEZNQCLSA-N 1 2 321.490 4.004 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccc(-c3ccccc3F)o2)c[nH+]1 ZINC001460888461 1063117904 /nfs/dbraw/zinc/11/79/04/1063117904.db2.gz DWDMYRIIKDXVHQ-UHFFFAOYSA-N 1 2 324.355 4.028 20 0 DIADLO CCc1nc(N2CCC[C@H]2c2ccccc2Cl)cc(C)[nH+]1 ZINC001472663337 1063130228 /nfs/dbraw/zinc/13/02/28/1063130228.db2.gz FCMWXKPRONKMLR-HNNXBMFYSA-N 1 2 301.821 4.342 20 0 DIADLO CCC1CCC(CNc2[nH+]cnc3c2cnn3C(C)(C)C)CC1 ZINC001472666676 1063132419 /nfs/dbraw/zinc/13/24/19/1063132419.db2.gz SJBQIWVCRBWJLA-UHFFFAOYSA-N 1 2 315.465 4.210 20 0 DIADLO Cc1cccc2sc(NCCCCNc3cccc[nH+]3)nc21 ZINC001472679409 1063145408 /nfs/dbraw/zinc/14/54/08/1063145408.db2.gz OHNKNSHYKROFJK-UHFFFAOYSA-N 1 2 312.442 4.304 20 0 DIADLO CCc1cc(NCC(C)(C)c2ccc(F)cc2)nc(CC)[nH+]1 ZINC001472687163 1063149727 /nfs/dbraw/zinc/14/97/27/1063149727.db2.gz VMTIHZDWLUUYOD-UHFFFAOYSA-N 1 2 301.409 4.130 20 0 DIADLO Cc1cc(NCCc2c[nH]c3cccc(C)c23)nc(C2CCC2)[nH+]1 ZINC001472686507 1063150184 /nfs/dbraw/zinc/15/01/84/1063150184.db2.gz RWIAJPFTMWEKIE-UHFFFAOYSA-N 1 2 320.440 4.497 20 0 DIADLO C[C@@H](CCC(C)(C)C)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001472700128 1063161297 /nfs/dbraw/zinc/16/12/97/1063161297.db2.gz KCGJCKXRQLUVFR-LBPRGKRZSA-N 1 2 303.454 4.208 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@@H+](Cc1cncc(Cl)c1)C2 ZINC001460982861 1063168915 /nfs/dbraw/zinc/16/89/15/1063168915.db2.gz VLXFYKPSDYMDOU-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@H+](Cc1cncc(Cl)c1)C2 ZINC001460982861 1063168928 /nfs/dbraw/zinc/16/89/28/1063168928.db2.gz VLXFYKPSDYMDOU-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO c1c2cccnc2oc1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC001460987419 1063170368 /nfs/dbraw/zinc/17/03/68/1063170368.db2.gz ATWMVCJTDVZTRA-LJQANCHMSA-N 1 2 315.376 4.102 20 0 DIADLO Cc1cccc2sc(NCCc3cn4cccc(C)c4[nH+]3)nc21 ZINC001472714557 1063174502 /nfs/dbraw/zinc/17/45/02/1063174502.db2.gz WGNIUQOFDYSGGP-UHFFFAOYSA-N 1 2 322.437 4.215 20 0 DIADLO Cc1nc(N(C)Cc2cc3ccccc3o2)c2c([nH+]1)CCCC2 ZINC001472718984 1063180878 /nfs/dbraw/zinc/18/08/78/1063180878.db2.gz UDVWFEFRHNGJPX-UHFFFAOYSA-N 1 2 307.397 4.046 20 0 DIADLO CCc1cc(N2CC[C@H](Cc3ccccc3)[C@@H]2C)nc(CC)[nH+]1 ZINC001472719181 1063180949 /nfs/dbraw/zinc/18/09/49/1063180949.db2.gz ZKDAPIYPPCWDNQ-DOTOQJQBSA-N 1 2 309.457 4.059 20 0 DIADLO COc1ccc2cc(CC[C@@H](C)[N@H+](C)CC(F)F)ccc2c1 ZINC001257285004 1063181175 /nfs/dbraw/zinc/18/11/75/1063181175.db2.gz LEHKISBMKOWLNB-CYBMUJFWSA-N 1 2 307.384 4.366 20 0 DIADLO COc1ccc2cc(CC[C@@H](C)[N@@H+](C)CC(F)F)ccc2c1 ZINC001257285004 1063181180 /nfs/dbraw/zinc/18/11/80/1063181180.db2.gz LEHKISBMKOWLNB-CYBMUJFWSA-N 1 2 307.384 4.366 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(S[C@@H](C)c3cccc(OC)c3)c12 ZINC001472725939 1063187618 /nfs/dbraw/zinc/18/76/18/1063187618.db2.gz TZOVXVVNTVGSGK-NSHDSACASA-N 1 2 313.426 4.382 20 0 DIADLO CCc1cc(N(CCc2ccccc2)CC(C)C)nc(CC)[nH+]1 ZINC001472738200 1063194673 /nfs/dbraw/zinc/19/46/73/1063194673.db2.gz GHZPLKUUGIHYTQ-UHFFFAOYSA-N 1 2 311.473 4.307 20 0 DIADLO Cc1csc([C@@H](C)CNc2cc(C)[nH+]c(C3CCC3)n2)n1 ZINC001472754389 1063206598 /nfs/dbraw/zinc/20/65/98/1063206598.db2.gz QBTOCDMTQVIQLX-JTQLQIEISA-N 1 2 302.447 4.033 20 0 DIADLO Cc1nc(NCc2ccc(Cl)cc2F)c2c([nH+]1)CCCC2 ZINC001472761900 1063213961 /nfs/dbraw/zinc/21/39/61/1063213961.db2.gz DHLZQGUDDRYNRR-UHFFFAOYSA-N 1 2 305.784 4.068 20 0 DIADLO Cc1cc(N2CC[C@](F)(c3ccccc3)C2)nc(C2CCC2)[nH+]1 ZINC001472766229 1063217035 /nfs/dbraw/zinc/21/70/35/1063217035.db2.gz RKQGEKYMHFNUQZ-LJQANCHMSA-N 1 2 311.404 4.128 20 0 DIADLO Cc1cccc(CCCNc2nc(Cl)nc3ccccc32)[nH+]1 ZINC001472779643 1063228702 /nfs/dbraw/zinc/22/87/02/1063228702.db2.gz JFTLLYDHKVZXFL-UHFFFAOYSA-N 1 2 312.804 4.031 20 0 DIADLO CC[C@H](C)Oc1ccc(NCc2c[nH+]c3ccc(C)cn23)cc1 ZINC001461095800 1063251022 /nfs/dbraw/zinc/25/10/22/1063251022.db2.gz LHYBYUIEQRPYCF-HNNXBMFYSA-N 1 2 309.413 4.432 20 0 DIADLO Cc1cc(N[C@H]2C[C@@H](OC(C)(C)C)C23CCC3)nc(C2CC2)[nH+]1 ZINC001472831852 1063273245 /nfs/dbraw/zinc/27/32/45/1063273245.db2.gz USCLPEFNCIBCAG-LSDHHAIUSA-N 1 2 315.461 4.201 20 0 DIADLO CCC[C@H](C)CC[C@@H](C)[N@@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001257480109 1063299222 /nfs/dbraw/zinc/29/92/22/1063299222.db2.gz TZSMGWVAIZIDTR-XHSDSOJGSA-N 1 2 307.482 4.011 20 0 DIADLO CCC[C@H](C)CC[C@@H](C)[N@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001257480109 1063299240 /nfs/dbraw/zinc/29/92/40/1063299240.db2.gz TZSMGWVAIZIDTR-XHSDSOJGSA-N 1 2 307.482 4.011 20 0 DIADLO CSC1(CNc2nc(C)[nH+]c3c2CCCC3)CCCCC1 ZINC001472879940 1063299347 /nfs/dbraw/zinc/29/93/47/1063299347.db2.gz HSTPTYKODSNBMI-UHFFFAOYSA-N 1 2 305.491 4.142 20 0 DIADLO c1[nH+]cn2c1c(NC[C@@H]1CCC=CCCC1)nc1ccccc12 ZINC001472898831 1063305119 /nfs/dbraw/zinc/30/51/19/1063305119.db2.gz NQKLILQCPRRXCZ-OAHLLOKOSA-N 1 2 306.413 4.431 20 0 DIADLO CCCCCC(CCCCC)[N@@H+]1CCn2c(CC)nnc2C1 ZINC001257554277 1063336745 /nfs/dbraw/zinc/33/67/45/1063336745.db2.gz TZRNEDMUYGXEPG-UHFFFAOYSA-N 1 2 306.498 4.185 20 0 DIADLO CCCCCC(CCCCC)[N@H+]1CCn2c(CC)nnc2C1 ZINC001257554277 1063336752 /nfs/dbraw/zinc/33/67/52/1063336752.db2.gz TZRNEDMUYGXEPG-UHFFFAOYSA-N 1 2 306.498 4.185 20 0 DIADLO CC(C)c1cnc(SCc2cc[nH+]c(N(C)C)c2)n1C1CC1 ZINC001472991996 1063346868 /nfs/dbraw/zinc/34/68/68/1063346868.db2.gz JEHOZDOLXUDJDA-UHFFFAOYSA-N 1 2 316.474 4.095 20 0 DIADLO C[N@@H+]1CCCC[C@@H]1c1nnc([C@@H]2C[C@H]2c2ccc(Cl)cc2)o1 ZINC001257647399 1063355867 /nfs/dbraw/zinc/35/58/67/1063355867.db2.gz FCJLNHBRGPQMPG-RRFJBIMHSA-N 1 2 317.820 4.151 20 0 DIADLO C[N@H+]1CCCC[C@@H]1c1nnc([C@@H]2C[C@H]2c2ccc(Cl)cc2)o1 ZINC001257647399 1063355888 /nfs/dbraw/zinc/35/58/88/1063355888.db2.gz FCJLNHBRGPQMPG-RRFJBIMHSA-N 1 2 317.820 4.151 20 0 DIADLO FC1(F)C[N@@H+]([C@@H]2CCCSC2)CC[C@@H]1Cc1ccccc1 ZINC001257685958 1063370243 /nfs/dbraw/zinc/37/02/43/1063370243.db2.gz XJUBEXGANBJVAC-HZPDHXFCSA-N 1 2 311.441 4.082 20 0 DIADLO FC1(F)C[N@H+]([C@@H]2CCCSC2)CC[C@@H]1Cc1ccccc1 ZINC001257685958 1063370259 /nfs/dbraw/zinc/37/02/59/1063370259.db2.gz XJUBEXGANBJVAC-HZPDHXFCSA-N 1 2 311.441 4.082 20 0 DIADLO C[C@H]([NH2+]Cc1cccc2[nH]c(=O)oc21)c1c(F)cccc1Cl ZINC001461289644 1063393666 /nfs/dbraw/zinc/39/36/66/1063393666.db2.gz XRKRJYQMIWWYLW-VIFPVBQESA-N 1 2 320.751 4.177 20 0 DIADLO CN(C)c1cc(CSc2nc3ccc(F)cc3s2)cc[nH+]1 ZINC001473085176 1063394436 /nfs/dbraw/zinc/39/44/36/1063394436.db2.gz FINOIBKMHYEXNT-UHFFFAOYSA-N 1 2 319.430 4.189 20 0 DIADLO Fc1cc(NCc2c(F)cccc2Cl)ccc1-n1cc[nH+]c1 ZINC001461321285 1063416486 /nfs/dbraw/zinc/41/64/86/1063416486.db2.gz WKOPDNCPDBEOPC-UHFFFAOYSA-N 1 2 319.742 4.416 20 0 DIADLO CCC[N@H+](CCCc1ccccc1Br)CC(F)F ZINC001473135836 1063443291 /nfs/dbraw/zinc/44/32/91/1063443291.db2.gz ODSPSILWVPIYML-UHFFFAOYSA-N 1 2 320.221 4.359 20 0 DIADLO CCC[N@@H+](CCCc1ccccc1Br)CC(F)F ZINC001473135836 1063443296 /nfs/dbraw/zinc/44/32/96/1063443296.db2.gz ODSPSILWVPIYML-UHFFFAOYSA-N 1 2 320.221 4.359 20 0 DIADLO Brc1ccccc1[C@H]1C[N@H+](CCCC2CC2)CCO1 ZINC001473135168 1063444234 /nfs/dbraw/zinc/44/42/34/1063444234.db2.gz NPPWPUFRSXJSQM-MRXNPFEDSA-N 1 2 324.262 4.013 20 0 DIADLO Brc1ccccc1[C@H]1C[N@@H+](CCCC2CC2)CCO1 ZINC001473135168 1063444243 /nfs/dbraw/zinc/44/42/43/1063444243.db2.gz NPPWPUFRSXJSQM-MRXNPFEDSA-N 1 2 324.262 4.013 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H]2CCCOc3c(F)cccc32)s1 ZINC001461393296 1063470165 /nfs/dbraw/zinc/47/01/65/1063470165.db2.gz RORWQXAURUNSED-AWEZNQCLSA-N 1 2 320.433 4.409 20 0 DIADLO Cc1cc([NH+](C)C)cc(C)c1N[C@H]1CCc2cccnc2CC1 ZINC001461413069 1063482652 /nfs/dbraw/zinc/48/26/52/1063482652.db2.gz AJFADYHOAJBTSF-KRWDZBQOSA-N 1 2 309.457 4.124 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1ccc(F)c(F)c1F ZINC001461440079 1063507905 /nfs/dbraw/zinc/50/79/05/1063507905.db2.gz ITXYKFAXJWOPPE-UHFFFAOYSA-N 1 2 321.298 4.149 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC(C)(C)CC(C)(C)C2)c(C)[nH+]1 ZINC001461485804 1063531028 /nfs/dbraw/zinc/53/10/28/1063531028.db2.gz SHMYNCNDJNLFBO-UHFFFAOYSA-N 1 2 302.462 4.295 20 0 DIADLO CCc1ccc(NCc2ccc(-n3cc[nH+]c3)cc2)cc1OC ZINC001461508438 1063544274 /nfs/dbraw/zinc/54/42/74/1063544274.db2.gz ALCMIXBEJLYXBZ-UHFFFAOYSA-N 1 2 307.397 4.055 20 0 DIADLO Fc1cc(Br)cc(C[NH2+]C2(C(F)F)CCCC2)c1 ZINC001461551108 1063576379 /nfs/dbraw/zinc/57/63/79/1063576379.db2.gz MBFMINBLZBLHDM-UHFFFAOYSA-N 1 2 322.168 4.256 20 0 DIADLO CCCCC(CCCC)[NH2+][C@H](C(=O)OC)[C@@H](C)OC(C)(C)C ZINC001258381119 1063626641 /nfs/dbraw/zinc/62/66/41/1063626641.db2.gz SWJOCRJLFNDWFO-ZBFHGGJFSA-N 1 2 315.498 4.070 20 0 DIADLO CCCCC(CCCC)[N@@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001258386331 1063629358 /nfs/dbraw/zinc/62/93/58/1063629358.db2.gz XCBDEYZBDCLWSU-OAHLLOKOSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCC(CCCC)[N@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001258386331 1063629366 /nfs/dbraw/zinc/62/93/66/1063629366.db2.gz XCBDEYZBDCLWSU-OAHLLOKOSA-N 1 2 307.482 4.155 20 0 DIADLO FC[C@H]([NH2+]Cc1cnc2c(F)cccc2c1)c1ccc(F)cc1 ZINC001461700261 1063666492 /nfs/dbraw/zinc/66/64/92/1063666492.db2.gz TWFFOZWNLCZBRA-KRWDZBQOSA-N 1 2 316.326 4.313 20 0 DIADLO COc1cccc2[nH]c(NCc3cc4cc(F)ccc4o3)[nH+]c21 ZINC001461729930 1063683486 /nfs/dbraw/zinc/68/34/86/1063683486.db2.gz SWOSIQHPVGBMKC-UHFFFAOYSA-N 1 2 311.316 4.069 20 0 DIADLO COc1cccc2[nH+]c(NC[C@@H](C)CCc3ccccc3)[nH]c21 ZINC001461730940 1063683588 /nfs/dbraw/zinc/68/35/88/1063683588.db2.gz WYPNVBJMNSLENA-AWEZNQCLSA-N 1 2 309.413 4.252 20 0 DIADLO COc1cccc2[nH]c(NC[C@@H](C)CCc3ccccc3)[nH+]c21 ZINC001461730940 1063683596 /nfs/dbraw/zinc/68/35/96/1063683596.db2.gz WYPNVBJMNSLENA-AWEZNQCLSA-N 1 2 309.413 4.252 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1cc(F)cc2ccoc21 ZINC001515866202 1063705291 /nfs/dbraw/zinc/70/52/91/1063705291.db2.gz PDKVREKJHWOHAE-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO Cc1nc(CNc2[nH+]c3ccccc3n2CC2CC2)sc1C ZINC001461767581 1063705745 /nfs/dbraw/zinc/70/57/45/1063705745.db2.gz KYXQCEUPRJSMEP-UHFFFAOYSA-N 1 2 312.442 4.132 20 0 DIADLO COc1cc(CNc2[nH+]c3ccccc3n2CC2CC2)ccc1C ZINC001461770014 1063707484 /nfs/dbraw/zinc/70/74/84/1063707484.db2.gz QYUKBHCBFTVJQY-UHFFFAOYSA-N 1 2 321.424 4.375 20 0 DIADLO CCCCC[C@H](CCC)[N@@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001258668868 1063738297 /nfs/dbraw/zinc/73/82/97/1063738297.db2.gz FXROTSOHLAREQP-HOTGVXAUSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCC[C@H](CCC)[N@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001258668868 1063738307 /nfs/dbraw/zinc/73/83/07/1063738307.db2.gz FXROTSOHLAREQP-HOTGVXAUSA-N 1 2 307.482 4.155 20 0 DIADLO CCNc1ccccc1C[N@H+](CC)Cc1c(F)cccc1F ZINC001461843729 1063747190 /nfs/dbraw/zinc/74/71/90/1063747190.db2.gz NUPGVDWNDTVZSW-UHFFFAOYSA-N 1 2 304.384 4.419 20 0 DIADLO CCNc1ccccc1C[N@@H+](CC)Cc1c(F)cccc1F ZINC001461843729 1063747205 /nfs/dbraw/zinc/74/72/05/1063747205.db2.gz NUPGVDWNDTVZSW-UHFFFAOYSA-N 1 2 304.384 4.419 20 0 DIADLO Clc1csc(C[N@@H+]2CC[C@@H](CSc3ccccc3)C2)n1 ZINC001461845548 1063748127 /nfs/dbraw/zinc/74/81/27/1063748127.db2.gz QTONMULRSSNEFR-GFCCVEGCSA-N 1 2 324.902 4.411 20 0 DIADLO Clc1csc(C[N@H+]2CC[C@@H](CSc3ccccc3)C2)n1 ZINC001461845548 1063748144 /nfs/dbraw/zinc/74/81/44/1063748144.db2.gz QTONMULRSSNEFR-GFCCVEGCSA-N 1 2 324.902 4.411 20 0 DIADLO Fc1cccc(/C=C/C[N@@H+]2CCc3c(F)ccc(F)c3C2)c1 ZINC001461869306 1063764415 /nfs/dbraw/zinc/76/44/15/1063764415.db2.gz GPYMUAWNUKTPAN-DUXPYHPUSA-N 1 2 303.327 4.175 20 0 DIADLO Fc1cccc(/C=C/C[N@H+]2CCc3c(F)ccc(F)c3C2)c1 ZINC001461869306 1063764433 /nfs/dbraw/zinc/76/44/33/1063764433.db2.gz GPYMUAWNUKTPAN-DUXPYHPUSA-N 1 2 303.327 4.175 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC001461875488 1063767243 /nfs/dbraw/zinc/76/72/43/1063767243.db2.gz UVCDHUYSLHNGRY-OLZOCXBDSA-N 1 2 307.825 4.123 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC001461875488 1063767233 /nfs/dbraw/zinc/76/72/33/1063767233.db2.gz UVCDHUYSLHNGRY-OLZOCXBDSA-N 1 2 307.825 4.123 20 0 DIADLO CC[C@H](C[C@@H](C)CC)[N@@H+]1Cc2cc(Br)cnc2C1 ZINC001258798445 1063833904 /nfs/dbraw/zinc/83/39/04/1063833904.db2.gz UBSQEKSRHRSBEO-SMDDNHRTSA-N 1 2 311.267 4.375 20 0 DIADLO CC[C@H](C[C@@H](C)CC)[N@H+]1Cc2cc(Br)cnc2C1 ZINC001258798445 1063833913 /nfs/dbraw/zinc/83/39/13/1063833913.db2.gz UBSQEKSRHRSBEO-SMDDNHRTSA-N 1 2 311.267 4.375 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(C(F)(F)F)nc2Cl)CCS1 ZINC001461960350 1063843001 /nfs/dbraw/zinc/84/30/01/1063843001.db2.gz OSEKYBPUDJVPHI-SNVBAGLBSA-N 1 2 324.799 4.081 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(C(F)(F)F)nc2Cl)CCS1 ZINC001461960350 1063843023 /nfs/dbraw/zinc/84/30/23/1063843023.db2.gz OSEKYBPUDJVPHI-SNVBAGLBSA-N 1 2 324.799 4.081 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccco2)Cc2ccccc2)cnc1F ZINC001462006165 1063875107 /nfs/dbraw/zinc/87/51/07/1063875107.db2.gz SFKIGMRJSBIVQB-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2)cnc1F ZINC001462006165 1063875121 /nfs/dbraw/zinc/87/51/21/1063875121.db2.gz SFKIGMRJSBIVQB-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO CCn1ccc(C[N@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)n1 ZINC001462018719 1063881311 /nfs/dbraw/zinc/88/13/11/1063881311.db2.gz MOLXNWLSKCSSJQ-UHFFFAOYSA-N 1 2 323.362 4.086 20 0 DIADLO CCn1ccc(C[N@@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)n1 ZINC001462018719 1063881322 /nfs/dbraw/zinc/88/13/22/1063881322.db2.gz MOLXNWLSKCSSJQ-UHFFFAOYSA-N 1 2 323.362 4.086 20 0 DIADLO Cc1n[nH]c(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)c1C ZINC001462045311 1063900820 /nfs/dbraw/zinc/90/08/20/1063900820.db2.gz PTPUDXAPHRAEAJ-CYBMUJFWSA-N 1 2 303.837 4.406 20 0 DIADLO Cc1n[nH]c(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)c1C ZINC001462045311 1063900827 /nfs/dbraw/zinc/90/08/27/1063900827.db2.gz PTPUDXAPHRAEAJ-CYBMUJFWSA-N 1 2 303.837 4.406 20 0 DIADLO COc1cc2cc[nH+]c(N3CCc4ccsc4C3)c2cc1F ZINC000361043176 1063906742 /nfs/dbraw/zinc/90/67/42/1063906742.db2.gz CTFQQNXVJCTYSS-UHFFFAOYSA-N 1 2 314.385 4.007 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C(F)(F)F)n(C)n1)c1ccc(Cl)s1 ZINC001262479410 1063965360 /nfs/dbraw/zinc/96/53/60/1063965360.db2.gz AFVCGAWUIXHUQJ-SSDOTTSWSA-N 1 2 323.771 4.005 20 0 DIADLO CC[C@@H](CC(F)F)C[N@@H+]1CCO[C@@H](c2ccc(Cl)s2)C1 ZINC001261638382 1063939973 /nfs/dbraw/zinc/93/99/73/1063939973.db2.gz ZQJZVROLXDQPSV-WDEREUQCSA-N 1 2 323.836 4.456 20 0 DIADLO CC[C@@H](CC(F)F)C[N@H+]1CCO[C@@H](c2ccc(Cl)s2)C1 ZINC001261638382 1063939996 /nfs/dbraw/zinc/93/99/96/1063939996.db2.gz ZQJZVROLXDQPSV-WDEREUQCSA-N 1 2 323.836 4.456 20 0 DIADLO C[N@H+](Cc1cc(F)cc(F)c1)Cc1cccnc1C(F)(F)F ZINC001261796134 1063946186 /nfs/dbraw/zinc/94/61/86/1063946186.db2.gz QUVVRDPVLHVIDB-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO C[N@@H+](Cc1cc(F)cc(F)c1)Cc1cccnc1C(F)(F)F ZINC001261796134 1063946189 /nfs/dbraw/zinc/94/61/89/1063946189.db2.gz QUVVRDPVLHVIDB-UHFFFAOYSA-N 1 2 316.273 4.011 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1ncoc1C(C)C)C(C)(C)C ZINC001262334676 1063962512 /nfs/dbraw/zinc/96/25/12/1063962512.db2.gz DMRPEISAJBLUKB-QGZVFWFLSA-N 1 2 301.434 4.378 20 0 DIADLO Cn1cc(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)c(C2CCCC2)n1 ZINC001262371540 1063965224 /nfs/dbraw/zinc/96/52/24/1063965224.db2.gz ORVQUYQQIGOHNA-LJQANCHMSA-N 1 2 324.472 4.056 20 0 DIADLO Cn1cc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)c(C2CCCC2)n1 ZINC001262371540 1063965226 /nfs/dbraw/zinc/96/52/26/1063965226.db2.gz ORVQUYQQIGOHNA-LJQANCHMSA-N 1 2 324.472 4.056 20 0 DIADLO CCCC(C)(C)C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001262824410 1063975383 /nfs/dbraw/zinc/97/53/83/1063975383.db2.gz JJVGMKNZMZSMEP-OAHLLOKOSA-N 1 2 319.493 4.170 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)C1[C@H]2CCCCCC[C@H]12 ZINC001264340408 1064078647 /nfs/dbraw/zinc/07/86/47/1064078647.db2.gz TXPMOCMICRVHLN-IRXDYDNUSA-N 1 2 309.413 4.027 20 0 DIADLO O=C(/C=C\C1CCCCCC1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001264340001 1064078772 /nfs/dbraw/zinc/07/87/72/1064078772.db2.gz DCXGSXFDTVRUOW-GHXNOFRVSA-N 1 2 309.413 4.337 20 0 DIADLO CC1(c2ccccc2C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001264340386 1064079181 /nfs/dbraw/zinc/07/91/81/1064079181.db2.gz SVFUURBWVKANKZ-UHFFFAOYSA-N 1 2 317.392 4.176 20 0 DIADLO CC1(C)CCCC[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001264719903 1064123767 /nfs/dbraw/zinc/12/37/67/1064123767.db2.gz SGMKAXBZGLWRRY-CQSZACIVSA-N 1 2 315.392 4.166 20 0 DIADLO CCCC[C@@](C)(F)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001264831625 1064144394 /nfs/dbraw/zinc/14/43/94/1064144394.db2.gz GLGLAUJZAUIDAF-MRXNPFEDSA-N 1 2 323.799 4.383 20 0 DIADLO Cc1cn2cc(NC(=O)/C=C/c3cc(C)c(C)cc3C)ccc2[nH+]1 ZINC001264857685 1064151206 /nfs/dbraw/zinc/15/12/06/1064151206.db2.gz FGXOOLPYTVHBAU-VMPITWQZSA-N 1 2 319.408 4.220 20 0 DIADLO C[C@@H]1CC[C@](C)(/C=C/C(=O)Nc2cccc3[nH+]ccn32)C1(C)C ZINC001265165323 1064198111 /nfs/dbraw/zinc/19/81/11/1064198111.db2.gz QWDNSCYLGQIGPZ-GJNLVEQSSA-N 1 2 311.429 4.291 20 0 DIADLO C[C@@H]1CC[C@@](C)(/C=C\C(=O)Nc2cccc3[nH+]ccn32)C1(C)C ZINC001265165325 1064198345 /nfs/dbraw/zinc/19/83/45/1064198345.db2.gz QWDNSCYLGQIGPZ-KXQOXUMJSA-N 1 2 311.429 4.291 20 0 DIADLO C[C@@H]1CC[C@@](C)(/C=C/C(=O)Nc2cccc3[nH+]ccn32)C1(C)C ZINC001265165324 1064198361 /nfs/dbraw/zinc/19/83/61/1064198361.db2.gz QWDNSCYLGQIGPZ-HYGXSDHVSA-N 1 2 311.429 4.291 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2ccc(Br)c(F)c2F)[C@H]1C ZINC000701299015 1064246805 /nfs/dbraw/zinc/24/68/05/1064246805.db2.gz IZZVTNRIOAQABQ-UWVGGRQHSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2ccc(Br)c(F)c2F)[C@H]1C ZINC000701299015 1064246813 /nfs/dbraw/zinc/24/68/13/1064246813.db2.gz IZZVTNRIOAQABQ-UWVGGRQHSA-N 1 2 318.205 4.348 20 0 DIADLO c1nn(-c2ccccc2)cc1CNc1ccc([NH+]2CCCC2)cc1 ZINC000393365118 1064273679 /nfs/dbraw/zinc/27/36/79/1064273679.db2.gz AMGOGKPZNNCIBG-UHFFFAOYSA-N 1 2 318.424 4.085 20 0 DIADLO Cn1cc(Cl)c(C[NH2+]Cc2ccc(-c3ccccc3)s2)n1 ZINC000393383659 1064275669 /nfs/dbraw/zinc/27/56/69/1064275669.db2.gz WZKWSDCXOZWJTA-UHFFFAOYSA-N 1 2 317.845 4.092 20 0 DIADLO Cc1nnsc1[C@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC001332854355 1064414769 /nfs/dbraw/zinc/41/47/69/1064414769.db2.gz QXCXKILUGGLLMF-WPRPVWTQSA-N 1 2 310.492 4.012 20 0 DIADLO C[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1cccc2ccccc21 ZINC001290046614 1064676912 /nfs/dbraw/zinc/67/69/12/1064676912.db2.gz SIQTVJDMWHDTLM-ZDUSSCGKSA-N 1 2 315.376 4.207 20 0 DIADLO CC(C)=CCC[C@H](C)CC(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC001292058543 1064755918 /nfs/dbraw/zinc/75/59/18/1064755918.db2.gz JGJHBXQTDDYCCH-DLBZAZTESA-N 1 2 319.493 4.187 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@]3(C)CCC[C@H]3C)c2)[nH+]c1C ZINC001292072770 1064757606 /nfs/dbraw/zinc/75/76/06/1064757606.db2.gz KSOLDLYUZLWNGV-CWTRNNRKSA-N 1 2 311.429 4.458 20 0 DIADLO CC(C)c1cccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001292297004 1064768263 /nfs/dbraw/zinc/76/82/63/1064768263.db2.gz DEWWRAMFZNOHOF-UHFFFAOYSA-N 1 2 305.381 4.452 20 0 DIADLO CC(C)CC[C@@H]1CCC[C@H]1NC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001292764514 1064786712 /nfs/dbraw/zinc/78/67/12/1064786712.db2.gz BHMBCCXIQZQEME-KSZLIROESA-N 1 2 319.493 4.191 20 0 DIADLO Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1-n1cc[nH+]c1 ZINC001292862228 1064791329 /nfs/dbraw/zinc/79/13/29/1064791329.db2.gz KJJKKIDGGNDNNF-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1cc(NC(=O)[C@H](C)[C@H](C)C(C)(C)C)ccc1-n1cc[nH+]c1 ZINC001292865481 1064791759 /nfs/dbraw/zinc/79/17/59/1064791759.db2.gz QURSHTFERXPTHE-CABCVRRESA-N 1 2 313.445 4.438 20 0 DIADLO Cc1cc(NC(=O)[C@@H](C)[C@@H](C)C(C)(C)C)ccc1-n1cc[nH+]c1 ZINC001292865484 1064791936 /nfs/dbraw/zinc/79/19/36/1064791936.db2.gz QURSHTFERXPTHE-LSDHHAIUSA-N 1 2 313.445 4.438 20 0 DIADLO CC[C@@H](C)C[C@@H](C)NC(=O)C[N@H+](CC)Cc1ccccc1Cl ZINC001293941380 1064840418 /nfs/dbraw/zinc/84/04/18/1064840418.db2.gz FPIXKWDQTNBOGW-HUUCEWRRSA-N 1 2 324.896 4.103 20 0 DIADLO CC[C@@H](C)C[C@@H](C)NC(=O)C[N@@H+](CC)Cc1ccccc1Cl ZINC001293941380 1064840425 /nfs/dbraw/zinc/84/04/25/1064840425.db2.gz FPIXKWDQTNBOGW-HUUCEWRRSA-N 1 2 324.896 4.103 20 0 DIADLO Cc1cc(N2CC(Cc3ccccc3C)C2)nc(C2CCC2)[nH+]1 ZINC001307170926 1064855037 /nfs/dbraw/zinc/85/50/37/1064855037.db2.gz IOJKOUPJZCXDSJ-UHFFFAOYSA-N 1 2 307.441 4.040 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@]3(C)CCCc4ccccc43)cc2[nH+]1 ZINC001294767961 1064883896 /nfs/dbraw/zinc/88/38/96/1064883896.db2.gz HNFWVRLZSLOOEQ-HXUWFJFHSA-N 1 2 319.408 4.104 20 0 DIADLO CC[C@H](Cc1cccc(C)c1)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC001294769453 1064884535 /nfs/dbraw/zinc/88/45/35/1064884535.db2.gz ULSRUWJTMFNQNE-MRXNPFEDSA-N 1 2 321.424 4.387 20 0 DIADLO CCCCN(C(=O)c1cc2c[nH+]ccc2[nH]1)[C@@H]1CCC[C@@H](C)C1 ZINC001298620108 1065012335 /nfs/dbraw/zinc/01/23/35/1065012335.db2.gz VPRPNAFAONFROA-GDBMZVCRSA-N 1 2 313.445 4.384 20 0 DIADLO CC[N@H+](CC(=O)N[C@H](C)CC(C)(C)C)Cc1ccccc1Cl ZINC001299072347 1065031373 /nfs/dbraw/zinc/03/13/73/1065031373.db2.gz GMBFYLKNYFIJTN-CQSZACIVSA-N 1 2 324.896 4.103 20 0 DIADLO CC[N@@H+](CC(=O)N[C@H](C)CC(C)(C)C)Cc1ccccc1Cl ZINC001299072347 1065031378 /nfs/dbraw/zinc/03/13/78/1065031378.db2.gz GMBFYLKNYFIJTN-CQSZACIVSA-N 1 2 324.896 4.103 20 0 DIADLO CCCC[C@@H](CC)CCCN(C)C(=O)C(C)(C)c1c[nH+]c[nH]1 ZINC001301079382 1065051725 /nfs/dbraw/zinc/05/17/25/1065051725.db2.gz DIOAAGXBIJBRPF-OAHLLOKOSA-N 1 2 307.482 4.142 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)c2cccc3ccccc32)[nH+]c1C ZINC001303605995 1065119433 /nfs/dbraw/zinc/11/94/33/1065119433.db2.gz OEVYYUUTSZXGIG-SFHVURJKSA-N 1 2 319.408 4.157 20 0 DIADLO CCCC[C@H](C(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1)C(C)C ZINC001303607717 1065119507 /nfs/dbraw/zinc/11/95/07/1065119507.db2.gz BDAAXXYJAFHBSW-JKSUJKDBSA-N 1 2 305.466 4.152 20 0 DIADLO CCCC(C)(C)C(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1 ZINC001306237231 1065174182 /nfs/dbraw/zinc/17/41/82/1065174182.db2.gz DDAVGOMLTPHXJC-UHFFFAOYSA-N 1 2 323.506 4.140 20 0 DIADLO COc1ccc([C@@H](C)N(C)c2cc(C)[nH+]c(C3CCC3)n2)cc1 ZINC001306926507 1065207716 /nfs/dbraw/zinc/20/77/16/1065207716.db2.gz RERQDWHWXMXOPH-CQSZACIVSA-N 1 2 311.429 4.259 20 0 DIADLO COc1ccc([C@@H](C)Nc2nc3ccccc3n3c[nH+]cc23)cc1 ZINC001306946538 1065215914 /nfs/dbraw/zinc/21/59/14/1065215914.db2.gz GGOFVKXZYUYIMP-CYBMUJFWSA-N 1 2 318.380 4.064 20 0 DIADLO COc1ccc([C@H](C)Nc2nc3ccccc3n3c[nH+]cc23)cc1 ZINC001306946539 1065216756 /nfs/dbraw/zinc/21/67/56/1065216756.db2.gz GGOFVKXZYUYIMP-ZDUSSCGKSA-N 1 2 318.380 4.064 20 0 DIADLO CCCN(Cc1ccc(F)cc1)c1nc(C)[nH+]c2c1CCCC2 ZINC001306949972 1065217467 /nfs/dbraw/zinc/21/74/67/1065217467.db2.gz USDIRNWVHBQSBQ-UHFFFAOYSA-N 1 2 313.420 4.220 20 0 DIADLO Cc1nc(C)c(CCNc2cc(C(C)C)[nH+]c(C(C)C)n2)s1 ZINC001306963092 1065223719 /nfs/dbraw/zinc/22/37/19/1065223719.db2.gz OKLIJUXEKBGNHU-UHFFFAOYSA-N 1 2 318.490 4.451 20 0 DIADLO Cc1nc(N2CC[C@@H](c3ccccc3)[C@H]2C)c2c([nH+]1)CCCC2 ZINC001306988875 1065238292 /nfs/dbraw/zinc/23/82/92/1065238292.db2.gz DKLGYQBFFUMANG-RHSMWYFYSA-N 1 2 307.441 4.046 20 0 DIADLO CC(C)(C)CC(C)(C)Nc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC001306992087 1065239900 /nfs/dbraw/zinc/23/99/00/1065239900.db2.gz RUDNJVVOXPCWIO-UHFFFAOYSA-N 1 2 323.444 4.442 20 0 DIADLO CC(C)c1cc(NCC2([C@H](C)CCO)CCC2)nc(C(C)C)[nH+]1 ZINC001307082418 1065253316 /nfs/dbraw/zinc/25/33/16/1065253316.db2.gz BOSVRXSHIFMULG-OAHLLOKOSA-N 1 2 319.493 4.324 20 0 DIADLO Cc1nc2c(s1)[C@@H](Nc1cc(C)[nH+]c(C3CCC3)n1)CCC2 ZINC001307081226 1065254031 /nfs/dbraw/zinc/25/40/31/1065254031.db2.gz NMMHAVANPIJKDJ-AWEZNQCLSA-N 1 2 314.458 4.307 20 0 DIADLO Cc1cccc(CSc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001307120104 1065271794 /nfs/dbraw/zinc/27/17/94/1065271794.db2.gz GCTSZNIAHFAWKL-UHFFFAOYSA-N 1 2 305.406 4.483 20 0 DIADLO CCc1cc(N(C)[C@@H]2CCC[C@@H]2c2ccccc2)nc(CC)[nH+]1 ZINC001307138014 1065279069 /nfs/dbraw/zinc/27/90/69/1065279069.db2.gz BVXGDSCRYWOBRS-QZTJIDSGSA-N 1 2 309.457 4.374 20 0 DIADLO CCc1cccc(CNc2nc(C)[nH+]c(C)c2Br)c1 ZINC001307155852 1065287471 /nfs/dbraw/zinc/28/74/71/1065287471.db2.gz WVANLCCLSPWPLV-UHFFFAOYSA-N 1 2 320.234 4.030 20 0 DIADLO CC[C@H](Nc1cc(C(C)C)[nH+]c(C(C)C)n1)[C@H]1CCCOC1 ZINC001307196169 1065299668 /nfs/dbraw/zinc/29/96/68/1065299668.db2.gz XMGZYXCEHCDBMJ-GJZGRUSLSA-N 1 2 305.466 4.341 20 0 DIADLO CC(C)c1cc(NC[C@@H]2C[C@H]3CCC[C@H]3O2)nc(C(C)C)[nH+]1 ZINC001307201732 1065301926 /nfs/dbraw/zinc/30/19/26/1065301926.db2.gz SIDDUWWNUDADAT-IJEWVQPXSA-N 1 2 303.450 4.093 20 0 DIADLO Cc1[nH]c(CNc2nc3cc(Cl)cc(Cl)c3o2)[nH+]c1C ZINC001307214398 1065304422 /nfs/dbraw/zinc/30/44/22/1065304422.db2.gz CXFPUGGQCMMCRQ-UHFFFAOYSA-N 1 2 311.172 4.087 20 0 DIADLO COc1c(C)c[nH+]c(CSc2nc(C(C)(C)C)c[nH]2)c1C ZINC001307382586 1065363219 /nfs/dbraw/zinc/36/32/19/1065363219.db2.gz ATYHQCQQMPBUCT-UHFFFAOYSA-N 1 2 305.447 4.020 20 0 DIADLO Cc1cc(Br)ccc1Cn1c[nH+]c(C(C)(C)C)c1 ZINC001307381353 1065363337 /nfs/dbraw/zinc/36/33/37/1065363337.db2.gz LGZOLTPXTIISLD-UHFFFAOYSA-N 1 2 307.235 4.300 20 0 DIADLO COc1ccccc1Cc1cn(CCCc2ccc(C)cc2)c[nH+]1 ZINC001307407771 1065373187 /nfs/dbraw/zinc/37/31/87/1065373187.db2.gz MVRPOUXZHCKCDZ-UHFFFAOYSA-N 1 2 320.436 4.424 20 0 DIADLO C[C@H]1C[N@H+](Cc2nsc3ccccc32)C[C@@H](c2ccccc2)O1 ZINC001307428230 1065388610 /nfs/dbraw/zinc/38/86/10/1065388610.db2.gz OTEJQUSQSRVHFQ-KSSFIOAISA-N 1 2 324.449 4.258 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nsc3ccccc32)C[C@@H](c2ccccc2)O1 ZINC001307428230 1065388627 /nfs/dbraw/zinc/38/86/27/1065388627.db2.gz OTEJQUSQSRVHFQ-KSSFIOAISA-N 1 2 324.449 4.258 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+](Cc1cccc(F)c1Cl)CC2 ZINC001307434067 1065392716 /nfs/dbraw/zinc/39/27/16/1065392716.db2.gz RNQDSVIZXBAUED-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+](Cc1cccc(F)c1Cl)CC2 ZINC001307434067 1065392728 /nfs/dbraw/zinc/39/27/28/1065392728.db2.gz RNQDSVIZXBAUED-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(Br)cccc3C2)cs1 ZINC001307447190 1065407018 /nfs/dbraw/zinc/40/70/18/1065407018.db2.gz LZDUWXSHKIVVLC-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(Br)cccc3C2)cs1 ZINC001307447190 1065407028 /nfs/dbraw/zinc/40/70/28/1065407028.db2.gz LZDUWXSHKIVVLC-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO CC1(C)CCc2onc(C[N@H+](Cc3ccccc3)C3CC3)c2C1 ZINC001307480844 1065427876 /nfs/dbraw/zinc/42/78/76/1065427876.db2.gz CEXBVLUJGUMMHP-UHFFFAOYSA-N 1 2 310.441 4.354 20 0 DIADLO CC1(C)CCc2onc(C[N@@H+](Cc3ccccc3)C3CC3)c2C1 ZINC001307480844 1065427881 /nfs/dbraw/zinc/42/78/81/1065427881.db2.gz CEXBVLUJGUMMHP-UHFFFAOYSA-N 1 2 310.441 4.354 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@H](CC(C)C)C1 ZINC001307506901 1065447917 /nfs/dbraw/zinc/44/79/17/1065447917.db2.gz RCBFBEGVUCPVDE-WMLDXEAASA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CC[C@@H](CC(C)C)C1 ZINC001307506901 1065447930 /nfs/dbraw/zinc/44/79/30/1065447930.db2.gz RCBFBEGVUCPVDE-WMLDXEAASA-N 1 2 323.864 4.312 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1noc2c1CC(C)(C)CC2 ZINC001307521715 1065460523 /nfs/dbraw/zinc/46/05/23/1065460523.db2.gz MANURQIAMQBNPV-CQSZACIVSA-N 1 2 310.441 4.309 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1noc2c1CC(C)(C)CC2 ZINC001307521715 1065460528 /nfs/dbraw/zinc/46/05/28/1065460528.db2.gz MANURQIAMQBNPV-CQSZACIVSA-N 1 2 310.441 4.309 20 0 DIADLO C[C@H]1[N@H+](CCc2cccc(Cl)c2Cl)CCOC1(C)C ZINC001307528384 1065466698 /nfs/dbraw/zinc/46/66/98/1065466698.db2.gz FKTMJDAFTDRZJT-LLVKDONJSA-N 1 2 302.245 4.035 20 0 DIADLO C[C@H]1[N@@H+](CCc2cccc(Cl)c2Cl)CCOC1(C)C ZINC001307528384 1065466702 /nfs/dbraw/zinc/46/67/02/1065466702.db2.gz FKTMJDAFTDRZJT-LLVKDONJSA-N 1 2 302.245 4.035 20 0 DIADLO CCSCC[C@H](C)[N@H+](C)Cc1c(Cl)cncc1Cl ZINC001307561851 1065483740 /nfs/dbraw/zinc/48/37/40/1065483740.db2.gz MXBUAYRKZQTNOR-JTQLQIEISA-N 1 2 307.290 4.352 20 0 DIADLO CCSCC[C@H](C)[N@@H+](C)Cc1c(Cl)cncc1Cl ZINC001307561851 1065483742 /nfs/dbraw/zinc/48/37/42/1065483742.db2.gz MXBUAYRKZQTNOR-JTQLQIEISA-N 1 2 307.290 4.352 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1ccncc1Cl)C1CCC1 ZINC001307578791 1065494449 /nfs/dbraw/zinc/49/44/49/1065494449.db2.gz CQEQLAMXTYZQNC-UHFFFAOYSA-N 1 2 304.796 4.429 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1ccncc1Cl)C1CCC1 ZINC001307578791 1065494454 /nfs/dbraw/zinc/49/44/54/1065494454.db2.gz CQEQLAMXTYZQNC-UHFFFAOYSA-N 1 2 304.796 4.429 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+](CC(=O)OC(C)(C)C)C(C)C ZINC001307589466 1065499898 /nfs/dbraw/zinc/49/98/98/1065499898.db2.gz NUVYBGUMEUXEBX-UHFFFAOYSA-N 1 2 311.853 4.201 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+](CC(=O)OC(C)(C)C)C(C)C ZINC001307589466 1065499907 /nfs/dbraw/zinc/49/99/07/1065499907.db2.gz NUVYBGUMEUXEBX-UHFFFAOYSA-N 1 2 311.853 4.201 20 0 DIADLO Cc1ccc(N2CC[NH+](Cc3cccc(F)c3Cl)CC2)cc1 ZINC001307600930 1065506255 /nfs/dbraw/zinc/50/62/55/1065506255.db2.gz AELIXXJNLXOKDC-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO C[C@H]1CC[C@@H](c2ccccc2)[N@H+](Cc2cc(Cl)n(C)n2)C1 ZINC001307756455 1065607991 /nfs/dbraw/zinc/60/79/91/1065607991.db2.gz NWNZYEITTDOLKL-BBRMVZONSA-N 1 2 303.837 4.047 20 0 DIADLO C[C@H]1CC[C@@H](c2ccccc2)[N@@H+](Cc2cc(Cl)n(C)n2)C1 ZINC001307756455 1065607995 /nfs/dbraw/zinc/60/79/95/1065607995.db2.gz NWNZYEITTDOLKL-BBRMVZONSA-N 1 2 303.837 4.047 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2Cc3ccccc3C3(CCC3)C2)n1 ZINC001307761554 1065609166 /nfs/dbraw/zinc/60/91/66/1065609166.db2.gz LPJZIKORQFMIGT-UHFFFAOYSA-N 1 2 310.441 4.410 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2Cc3ccccc3C3(CCC3)C2)n1 ZINC001307761554 1065609174 /nfs/dbraw/zinc/60/91/74/1065609174.db2.gz LPJZIKORQFMIGT-UHFFFAOYSA-N 1 2 310.441 4.410 20 0 DIADLO CCCC[C@@H](CC)C[NH2+][C@](CC)(C(=O)OC)c1ccccc1 ZINC001307759588 1065609990 /nfs/dbraw/zinc/60/99/90/1065609990.db2.gz AGDKVLPHUFIZGK-APWZRJJASA-N 1 2 305.462 4.271 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(F)c2Cl)Cc2ccccc2O1 ZINC001307811145 1065634374 /nfs/dbraw/zinc/63/43/74/1065634374.db2.gz SLSKAJHDVJQKSZ-GFCCVEGCSA-N 1 2 305.780 4.262 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(F)c2Cl)Cc2ccccc2O1 ZINC001307811145 1065634379 /nfs/dbraw/zinc/63/43/79/1065634379.db2.gz SLSKAJHDVJQKSZ-GFCCVEGCSA-N 1 2 305.780 4.262 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1c(F)ccc(C)c1F ZINC001307828225 1065641860 /nfs/dbraw/zinc/64/18/60/1065641860.db2.gz YKUIWEVZZWBAAA-ZDUSSCGKSA-N 1 2 305.368 4.441 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@H+](Cc1cc2ccccc2o1)C1CC1 ZINC001307833664 1065643431 /nfs/dbraw/zinc/64/34/31/1065643431.db2.gz PICRJYRFDZBQMQ-CYBMUJFWSA-N 1 2 315.413 4.127 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+](Cc1cc2ccccc2o1)C1CC1 ZINC001307833664 1065643437 /nfs/dbraw/zinc/64/34/37/1065643437.db2.gz PICRJYRFDZBQMQ-CYBMUJFWSA-N 1 2 315.413 4.127 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@H+](Cc1ccccc1C1CC1)C1CC1 ZINC001307833479 1065644345 /nfs/dbraw/zinc/64/43/45/1065644345.db2.gz MZIUMSHKNRBTKO-CQSZACIVSA-N 1 2 315.457 4.259 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+](Cc1ccccc1C1CC1)C1CC1 ZINC001307833479 1065644351 /nfs/dbraw/zinc/64/43/51/1065644351.db2.gz MZIUMSHKNRBTKO-CQSZACIVSA-N 1 2 315.457 4.259 20 0 DIADLO Clc1cncc(Cl)c1C[N@@H+]1CCSC[C@H]1C1CCC1 ZINC001307860665 1065658844 /nfs/dbraw/zinc/65/88/44/1065658844.db2.gz VSBKVMOHJKRMSV-AWEZNQCLSA-N 1 2 317.285 4.106 20 0 DIADLO Clc1cncc(Cl)c1C[N@H+]1CCSC[C@H]1C1CCC1 ZINC001307860665 1065658849 /nfs/dbraw/zinc/65/88/49/1065658849.db2.gz VSBKVMOHJKRMSV-AWEZNQCLSA-N 1 2 317.285 4.106 20 0 DIADLO CC(C)SCC[N@@H+]1CCc2[nH]c3ccc(Cl)cc3c2C1 ZINC001307881260 1065667273 /nfs/dbraw/zinc/66/72/73/1065667273.db2.gz XEDKWRXEGLZYQC-UHFFFAOYSA-N 1 2 308.878 4.321 20 0 DIADLO CC(C)SCC[N@H+]1CCc2[nH]c3ccc(Cl)cc3c2C1 ZINC001307881260 1065667279 /nfs/dbraw/zinc/66/72/79/1065667279.db2.gz XEDKWRXEGLZYQC-UHFFFAOYSA-N 1 2 308.878 4.321 20 0 DIADLO Fc1cccc(Cl)c1[C@@H]1C[N@H+](CC2CCCCC2)CCO1 ZINC001307901916 1065674473 /nfs/dbraw/zinc/67/44/73/1065674473.db2.gz XKBLMHKXBLJEPB-INIZCTEOSA-N 1 2 311.828 4.433 20 0 DIADLO Fc1cccc(Cl)c1[C@@H]1C[N@@H+](CC2CCCCC2)CCO1 ZINC001307901916 1065674480 /nfs/dbraw/zinc/67/44/80/1065674480.db2.gz XKBLMHKXBLJEPB-INIZCTEOSA-N 1 2 311.828 4.433 20 0 DIADLO CC[C@H]1C[N@H+](Cc2ncc(-c3ccc(C)cc3)o2)[C@@H](CC)CO1 ZINC001307907889 1065677434 /nfs/dbraw/zinc/67/74/34/1065677434.db2.gz OANQZHMGEMCWBR-IRXDYDNUSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2ncc(-c3ccc(C)cc3)o2)[C@@H](CC)CO1 ZINC001307907889 1065677438 /nfs/dbraw/zinc/67/74/38/1065677438.db2.gz OANQZHMGEMCWBR-IRXDYDNUSA-N 1 2 314.429 4.039 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1cscc1Br)CC2 ZINC001307912618 1065680420 /nfs/dbraw/zinc/68/04/20/1065680420.db2.gz YMBBZDJIWCYSPU-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1cscc1Br)CC2 ZINC001307912618 1065680427 /nfs/dbraw/zinc/68/04/27/1065680427.db2.gz YMBBZDJIWCYSPU-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO CC1(C)CO[C@H](c2cccc(F)c2)C[N@@H+]1Cc1ccccc1F ZINC001307933404 1065688689 /nfs/dbraw/zinc/68/86/89/1065688689.db2.gz CSSRMHSJCVKAOH-SFHVURJKSA-N 1 2 317.379 4.317 20 0 DIADLO CC1(C)CO[C@H](c2cccc(F)c2)C[N@H+]1Cc1ccccc1F ZINC001307933404 1065688713 /nfs/dbraw/zinc/68/87/13/1065688713.db2.gz CSSRMHSJCVKAOH-SFHVURJKSA-N 1 2 317.379 4.317 20 0 DIADLO COc1nc(C)cc(C)c1C[N@H+](C)Cc1c(C)cccc1Cl ZINC001307960884 1065703006 /nfs/dbraw/zinc/70/30/06/1065703006.db2.gz MLJZBDNAHSWZOA-UHFFFAOYSA-N 1 2 318.848 4.301 20 0 DIADLO COc1nc(C)cc(C)c1C[N@@H+](C)Cc1c(C)cccc1Cl ZINC001307960884 1065703014 /nfs/dbraw/zinc/70/30/14/1065703014.db2.gz MLJZBDNAHSWZOA-UHFFFAOYSA-N 1 2 318.848 4.301 20 0 DIADLO CC(C)c1cc([C@H]2CCC[N@H+](CC=C(Cl)Cl)C2)n[nH]1 ZINC001308056430 1065743918 /nfs/dbraw/zinc/74/39/18/1065743918.db2.gz VWIJVHYGNSHGKD-NSHDSACASA-N 1 2 302.249 4.032 20 0 DIADLO CC(C)c1cc([C@H]2CCC[N@@H+](CC=C(Cl)Cl)C2)n[nH]1 ZINC001308056430 1065743928 /nfs/dbraw/zinc/74/39/28/1065743928.db2.gz VWIJVHYGNSHGKD-NSHDSACASA-N 1 2 302.249 4.032 20 0 DIADLO C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1Cc2cn[nH]c2C[C@H](C)C1 ZINC001308075163 1065753346 /nfs/dbraw/zinc/75/33/46/1065753346.db2.gz RJORTGOBXGYMII-LSDHHAIUSA-N 1 2 311.473 4.463 20 0 DIADLO C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1Cc2cn[nH]c2C[C@H](C)C1 ZINC001308075163 1065753353 /nfs/dbraw/zinc/75/33/53/1065753353.db2.gz RJORTGOBXGYMII-LSDHHAIUSA-N 1 2 311.473 4.463 20 0 DIADLO C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1Cc2cn[nH]c2C[C@@H](C)C1 ZINC001308075161 1065753625 /nfs/dbraw/zinc/75/36/25/1065753625.db2.gz RJORTGOBXGYMII-HUUCEWRRSA-N 1 2 311.473 4.463 20 0 DIADLO C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1Cc2cn[nH]c2C[C@@H](C)C1 ZINC001308075161 1065753637 /nfs/dbraw/zinc/75/36/37/1065753637.db2.gz RJORTGOBXGYMII-HUUCEWRRSA-N 1 2 311.473 4.463 20 0 DIADLO CC[C@H](C)[C@@H]([NH2+][C@@H](CC)c1cccc2ccccc21)C(=O)OC ZINC001308084223 1065755522 /nfs/dbraw/zinc/75/55/22/1065755522.db2.gz DPXFMSKPJGLSMC-ZOCIIQOWSA-N 1 2 313.441 4.468 20 0 DIADLO CCn1cnc2c1CC[N@H+](Cc1ccc(C3CCCC3)cc1)C2 ZINC001308101004 1065762687 /nfs/dbraw/zinc/76/26/87/1065762687.db2.gz UAOOYMHANNMNGF-UHFFFAOYSA-N 1 2 309.457 4.119 20 0 DIADLO CCn1cnc2c1CC[N@@H+](Cc1ccc(C3CCCC3)cc1)C2 ZINC001308101004 1065762702 /nfs/dbraw/zinc/76/27/02/1065762702.db2.gz UAOOYMHANNMNGF-UHFFFAOYSA-N 1 2 309.457 4.119 20 0 DIADLO Cn1c[nH+]cc1CN1c2ccccc2CC[C@@H]1c1ccccc1 ZINC001308141472 1065777054 /nfs/dbraw/zinc/77/70/54/1065777054.db2.gz KODFXFVDJHLCGV-HXUWFJFHSA-N 1 2 303.409 4.114 20 0 DIADLO Cn1c[nH+]cc1CN1c2ccccc2CC[C@H]1c1ccccc1 ZINC001308141190 1065778347 /nfs/dbraw/zinc/77/83/47/1065778347.db2.gz KODFXFVDJHLCGV-FQEVSTJZSA-N 1 2 303.409 4.114 20 0 DIADLO Cc1cccc(C2=CC[N@H+]([C@@H](C)C(=O)OC(C)(C)C)CC2)c1C ZINC001308146963 1065780448 /nfs/dbraw/zinc/78/04/48/1065780448.db2.gz RKNBAWXAYVPOKP-INIZCTEOSA-N 1 2 315.457 4.123 20 0 DIADLO Cc1cccc(C2=CC[N@@H+]([C@@H](C)C(=O)OC(C)(C)C)CC2)c1C ZINC001308146963 1065780470 /nfs/dbraw/zinc/78/04/70/1065780470.db2.gz RKNBAWXAYVPOKP-INIZCTEOSA-N 1 2 315.457 4.123 20 0 DIADLO CCc1cnc(C[NH2+][C@H](c2nc3ccccc3[nH]2)C(C)C)s1 ZINC001308201565 1065809020 /nfs/dbraw/zinc/80/90/20/1065809020.db2.gz LVUMSHZXZHFHGB-INIZCTEOSA-N 1 2 314.458 4.069 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1ccc(OCC2CC2)cc1 ZINC001308210864 1065816727 /nfs/dbraw/zinc/81/67/27/1065816727.db2.gz RWSLSDOTXFXFCH-UHFFFAOYSA-N 1 2 310.441 4.462 20 0 DIADLO CCc1cccc2c1OCC[C@H]2[NH2+]Cc1csc(C2CC2)n1 ZINC001308256013 1065858508 /nfs/dbraw/zinc/85/85/08/1065858508.db2.gz ZLNYNKGHUQTSJT-MRXNPFEDSA-N 1 2 314.454 4.196 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccc(-c3ccccc3F)o2)s1 ZINC001308273717 1065873403 /nfs/dbraw/zinc/87/34/03/1065873403.db2.gz JHRSJWFAUVUXHV-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2cnc(-c3ccccc3)[nH]2)C2CC2)s1 ZINC001308290704 1065886359 /nfs/dbraw/zinc/88/63/59/1065886359.db2.gz QILGDLMORSTHKB-MRXNPFEDSA-N 1 2 324.453 4.083 20 0 DIADLO CN(C)c1ccc(NCc2cccc(OC3CCCC3)c2)[nH+]c1 ZINC001308315681 1065907394 /nfs/dbraw/zinc/90/73/94/1065907394.db2.gz BDUZQBCSSMSKAV-UHFFFAOYSA-N 1 2 311.429 4.081 20 0 DIADLO CCc1ccccc1CNc1ccccc1OCCn1cc[nH+]c1 ZINC001308322194 1065913115 /nfs/dbraw/zinc/91/31/15/1065913115.db2.gz YATDOBKRSCHYOI-UHFFFAOYSA-N 1 2 321.424 4.137 20 0 DIADLO Fc1cccc(/C=C\CNc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001308339490 1065924844 /nfs/dbraw/zinc/92/48/44/1065924844.db2.gz RSBAWCAENDTNJT-ALCCZGGFSA-N 1 2 311.404 4.336 20 0 DIADLO C[C@@H]1Cc2cc(CNc3c[nH+]ccc3OC(C)(C)C)ccc2O1 ZINC001308356873 1065935601 /nfs/dbraw/zinc/93/56/01/1065935601.db2.gz MTIZYHLZGKGIHB-CYBMUJFWSA-N 1 2 312.413 4.194 20 0 DIADLO C[C@@H](CNc1cc(CSCCO)cc[nH+]1)CC1CCCCC1 ZINC001308363228 1065942267 /nfs/dbraw/zinc/94/22/67/1065942267.db2.gz XXEHJBKWSBJDPX-OAHLLOKOSA-N 1 2 322.518 4.326 20 0 DIADLO Fc1ccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)c(F)c1F ZINC001308391428 1065957530 /nfs/dbraw/zinc/95/75/30/1065957530.db2.gz FHCHEEFVZMYTKH-UHFFFAOYSA-N 1 2 321.676 4.325 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[NH2+]Cc1cccnc1Cl ZINC001308493280 1066026370 /nfs/dbraw/zinc/02/63/70/1066026370.db2.gz VAJWVCICSIPXAP-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO CCn1nc(C[NH2+][C@@H]2c3ccccc3CC[C@H]2F)c2ccccc21 ZINC001308498991 1066029757 /nfs/dbraw/zinc/02/97/57/1066029757.db2.gz CEAOBGIYNQQAMH-YLJYHZDGSA-N 1 2 323.415 4.171 20 0 DIADLO Cc1ccc(COc2ccc(C[NH2+][C@H](C)C(F)F)cc2)cc1 ZINC001308501621 1066030993 /nfs/dbraw/zinc/03/09/93/1066030993.db2.gz TYWXAJKGCZECOP-CQSZACIVSA-N 1 2 305.368 4.317 20 0 DIADLO Fc1cc(F)cc(C(F)(F)C[NH2+]Cc2cccc3[nH]ccc32)c1 ZINC001308505686 1066033475 /nfs/dbraw/zinc/03/34/75/1066033475.db2.gz LWBKYBKGUDYMEX-UHFFFAOYSA-N 1 2 322.305 4.328 20 0 DIADLO COc1cncc(CNc2[nH+]c3ccccc3n2C(C)(C)C)c1C ZINC001308505433 1066034138 /nfs/dbraw/zinc/03/41/38/1066034138.db2.gz FWFCNXBVTCGMOA-UHFFFAOYSA-N 1 2 324.428 4.115 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1ccc2c(c1)CCO2 ZINC001308505270 1066034204 /nfs/dbraw/zinc/03/42/04/1066034204.db2.gz CRISEQRLVFHENF-UHFFFAOYSA-N 1 2 307.397 4.164 20 0 DIADLO Cc1cccc(CNc2[nH]c3ccc(Br)cc3[nH+]2)c1 ZINC001308508043 1066035636 /nfs/dbraw/zinc/03/56/36/1066035636.db2.gz SHGJHYHBHPWSQN-UHFFFAOYSA-N 1 2 316.202 4.246 20 0 DIADLO Cc1cccc(CNc2[nH]c3cc(Br)ccc3[nH+]2)c1 ZINC001308508043 1066035649 /nfs/dbraw/zinc/03/56/49/1066035649.db2.gz SHGJHYHBHPWSQN-UHFFFAOYSA-N 1 2 316.202 4.246 20 0 DIADLO Cc1cc(C[NH2+]Cc2noc3c2CC(C)(C)CC3)ccc1Cl ZINC001308508758 1066036041 /nfs/dbraw/zinc/03/60/41/1066036041.db2.gz LLEHNDACMMFPDQ-UHFFFAOYSA-N 1 2 318.848 4.441 20 0 DIADLO CCCOc1cccc(C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)c1 ZINC001308521649 1066044347 /nfs/dbraw/zinc/04/43/47/1066044347.db2.gz WPXIVKCDGLDIFF-PKOBYXMFSA-N 1 2 315.388 4.037 20 0 DIADLO CCOc1ccc(CNc2[nH+]c3cc(F)ccc3n2CC)cc1 ZINC001308553484 1066065823 /nfs/dbraw/zinc/06/58/23/1066065823.db2.gz JRMOKUHNHPZHBT-UHFFFAOYSA-N 1 2 313.376 4.206 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308574427 1066087476 /nfs/dbraw/zinc/08/74/76/1066087476.db2.gz VSZLETLKCNGSAN-IAQYHMDHSA-N 1 2 321.342 4.393 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308574427 1066087485 /nfs/dbraw/zinc/08/74/85/1066087485.db2.gz VSZLETLKCNGSAN-IAQYHMDHSA-N 1 2 321.342 4.393 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(Br)cccc3C2)c(C)o1 ZINC001308596351 1066107221 /nfs/dbraw/zinc/10/72/21/1066107221.db2.gz OOLAMJPOWSVFBS-UHFFFAOYSA-N 1 2 320.230 4.217 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(Br)cccc3C2)c(C)o1 ZINC001308596351 1066107227 /nfs/dbraw/zinc/10/72/27/1066107227.db2.gz OOLAMJPOWSVFBS-UHFFFAOYSA-N 1 2 320.230 4.217 20 0 DIADLO CCOC(=O)[C@@H]1CCCC[N@@H+]1C/C=C\c1cc(C)c(C)cc1C ZINC001308598571 1066108607 /nfs/dbraw/zinc/10/86/07/1066108607.db2.gz RNRZYVWAOQRNBW-QWUACUGRSA-N 1 2 315.457 4.043 20 0 DIADLO CCOC(=O)[C@@H]1CCCC[N@H+]1C/C=C\c1cc(C)c(C)cc1C ZINC001308598571 1066108611 /nfs/dbraw/zinc/10/86/11/1066108611.db2.gz RNRZYVWAOQRNBW-QWUACUGRSA-N 1 2 315.457 4.043 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001308659804 1066142463 /nfs/dbraw/zinc/14/24/63/1066142463.db2.gz CYQYUWZHNDBERX-GOSISDBHSA-N 1 2 313.441 4.459 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001308659804 1066142465 /nfs/dbraw/zinc/14/24/65/1066142465.db2.gz CYQYUWZHNDBERX-GOSISDBHSA-N 1 2 313.441 4.459 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCC[C@@H]1c1ccccc1)C(=O)OC1CCCC1 ZINC001308706141 1066189649 /nfs/dbraw/zinc/18/96/49/1066189649.db2.gz YSPLIUSJGUZSJV-IPELMVKDSA-N 1 2 315.457 4.177 20 0 DIADLO CC[C@]1(C)CCC[C@@H]1Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001308732615 1066207459 /nfs/dbraw/zinc/20/74/59/1066207459.db2.gz SIDHKMNGZKJHPM-JHDROBOHSA-N 1 2 317.477 4.076 20 0 DIADLO CC[C@]1(C)CCC[C@H]1Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001308732616 1066207676 /nfs/dbraw/zinc/20/76/76/1066207676.db2.gz SIDHKMNGZKJHPM-LORHWOILSA-N 1 2 317.477 4.076 20 0 DIADLO Cc1cc(CNc2cncc(Cl)c2C)c2c([nH+]1)CCCC2 ZINC001308791515 1066266511 /nfs/dbraw/zinc/26/65/11/1066266511.db2.gz PAVYIBKUEAGIJQ-UHFFFAOYSA-N 1 2 301.821 4.238 20 0 DIADLO Cc1[nH]c(CN2C[C@@H](C)CSc3ccc(Cl)cc32)[nH+]c1C ZINC001308796294 1066273488 /nfs/dbraw/zinc/27/34/88/1066273488.db2.gz FTEDPXSNNYPMOP-SNVBAGLBSA-N 1 2 321.877 4.428 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@H+](C/C=C/c1ccc(F)cc1)C1CC1 ZINC001308813495 1066289263 /nfs/dbraw/zinc/28/92/63/1066289263.db2.gz OHPFFFNPDFHKIC-VBROQKIQSA-N 1 2 319.420 4.034 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+](C/C=C/c1ccc(F)cc1)C1CC1 ZINC001308813495 1066289274 /nfs/dbraw/zinc/28/92/74/1066289274.db2.gz OHPFFFNPDFHKIC-VBROQKIQSA-N 1 2 319.420 4.034 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](C/C=C\c1ccc(F)cc1)C1CC1 ZINC001308813494 1066289783 /nfs/dbraw/zinc/28/97/83/1066289783.db2.gz OHPFFFNPDFHKIC-GXMNPTEKSA-N 1 2 319.420 4.034 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](C/C=C\c1ccc(F)cc1)C1CC1 ZINC001308813494 1066289795 /nfs/dbraw/zinc/28/97/95/1066289795.db2.gz OHPFFFNPDFHKIC-GXMNPTEKSA-N 1 2 319.420 4.034 20 0 DIADLO CC1(C)CCC[C@H](C[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC001308820990 1066296926 /nfs/dbraw/zinc/29/69/26/1066296926.db2.gz TUHUSUPQHMAFPK-HOCLYGCPSA-N 1 2 304.482 4.232 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccc(F)cc2SC)c1C ZINC001308832309 1066307948 /nfs/dbraw/zinc/30/79/48/1066307948.db2.gz QAFIPOGERUDCOH-UHFFFAOYSA-N 1 2 306.406 4.180 20 0 DIADLO C[C@@H]([NH2+][C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1)C(=O)OC(C)(C)C ZINC001308859243 1066338123 /nfs/dbraw/zinc/33/81/23/1066338123.db2.gz KRJFYWKUECQILB-CIRFHOKZSA-N 1 2 317.473 4.279 20 0 DIADLO Oc1ccc(C[NH2+]Cc2c(Cl)oc3ccccc32)c(F)c1F ZINC001308862704 1066342117 /nfs/dbraw/zinc/34/21/17/1066342117.db2.gz DCHOSZNNQMGHTP-UHFFFAOYSA-N 1 2 323.726 4.360 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH+]1CC(C)(c2ccccc2)C1 ZINC001308873769 1066353383 /nfs/dbraw/zinc/35/33/83/1066353383.db2.gz NPUTYXMOFSCHOB-UHFFFAOYSA-N 1 2 324.449 4.485 20 0 DIADLO CC(C)(C)c1csc(C[NH+]2CC(C)(c3ccccc3)C2)n1 ZINC001308873801 1066353769 /nfs/dbraw/zinc/35/37/69/1066353769.db2.gz OMDOPQOBCZBMDK-UHFFFAOYSA-N 1 2 300.471 4.214 20 0 DIADLO CO[C@@H](C[NH2+]CC(F)(F)c1ccccc1C)C1CCCCC1 ZINC001308883577 1066364262 /nfs/dbraw/zinc/36/42/62/1066364262.db2.gz YDOOOJANLKMIIF-KRWDZBQOSA-N 1 2 311.416 4.272 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2c(F)ccc(F)c2Cl)C1 ZINC001308928166 1066402473 /nfs/dbraw/zinc/40/24/73/1066402473.db2.gz NHFYFLDCHMOUPP-LBPRGKRZSA-N 1 2 313.697 4.393 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2c(F)ccc(F)c2Cl)C1 ZINC001308928166 1066402477 /nfs/dbraw/zinc/40/24/77/1066402477.db2.gz NHFYFLDCHMOUPP-LBPRGKRZSA-N 1 2 313.697 4.393 20 0 DIADLO CCOC(=O)[C@H](CCCC(C)C)[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC001308935247 1066406885 /nfs/dbraw/zinc/40/68/85/1066406885.db2.gz NZGVJXZKTZHNHH-FHWLQOOXSA-N 1 2 317.473 4.138 20 0 DIADLO COC(=O)[C@@H]([NH2+]C[C@H](C)C(C)(C)C)c1cccc2ccccc21 ZINC001308940021 1066409805 /nfs/dbraw/zinc/40/98/05/1066409805.db2.gz MNRYXCPYJCUHEU-KSSFIOAISA-N 1 2 313.441 4.326 20 0 DIADLO CC(C)n1c[nH+]cc1CN[C@H](c1cccc(Cl)c1)C(F)F ZINC001308939899 1066409899 /nfs/dbraw/zinc/40/98/99/1066409899.db2.gz SBPCVVMOMWCUEK-CQSZACIVSA-N 1 2 313.779 4.213 20 0 DIADLO COC(=O)[C@H]([NH2+]C[C@H](C)C(C)(C)C)c1cccc2ccccc21 ZINC001308940019 1066410521 /nfs/dbraw/zinc/41/05/21/1066410521.db2.gz MNRYXCPYJCUHEU-KBXCAEBGSA-N 1 2 313.441 4.326 20 0 DIADLO Cc1csc2nc(C)c(C[N@@H+]3CC[C@@H]3c3ccc(F)cc3)n12 ZINC001308966926 1066423862 /nfs/dbraw/zinc/42/38/62/1066423862.db2.gz FFHORGRDRFNUKY-OAHLLOKOSA-N 1 2 315.417 4.099 20 0 DIADLO Cc1csc2nc(C)c(C[N@H+]3CC[C@@H]3c3ccc(F)cc3)n12 ZINC001308966926 1066423867 /nfs/dbraw/zinc/42/38/67/1066423867.db2.gz FFHORGRDRFNUKY-OAHLLOKOSA-N 1 2 315.417 4.099 20 0 DIADLO c1n[nH]c([C@@H]([NH2+]C[C@H]2CCC=CCCC2)C2CCCCC2)n1 ZINC001308975477 1066428213 /nfs/dbraw/zinc/42/82/13/1066428213.db2.gz UQIUFGHKOYUYLX-RDJZCZTQSA-N 1 2 302.466 4.152 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+]1CCc2cc(O)ccc2C1 ZINC001308983778 1066431988 /nfs/dbraw/zinc/43/19/88/1066431988.db2.gz BZJKERPIXGDIGE-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+]1CCc2cc(O)ccc2C1 ZINC001308983778 1066431992 /nfs/dbraw/zinc/43/19/92/1066431992.db2.gz BZJKERPIXGDIGE-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO Cc1nc(N[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc[nH+]1 ZINC000343283444 334925105 /nfs/dbraw/zinc/92/51/05/334925105.db2.gz JSRJHTLHHMYNPD-OAHLLOKOSA-N 1 2 323.318 4.247 20 0 DIADLO Cc1cccc(NC2CC[NH+](Cc3cnc(Cl)s3)CC2)c1 ZINC000079325483 185164993 /nfs/dbraw/zinc/16/49/93/185164993.db2.gz AVVZYPRZXONEDW-UHFFFAOYSA-N 1 2 321.877 4.181 20 0 DIADLO Cc1csc(CSCc2[nH+]ccn2Cc2ccccc2)n1 ZINC000088306942 185245043 /nfs/dbraw/zinc/24/50/43/185245043.db2.gz DIFNCEXYBBZGGD-UHFFFAOYSA-N 1 2 315.467 4.130 20 0 DIADLO CC(C)n1ncnc1C[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000088588550 185258818 /nfs/dbraw/zinc/25/88/18/185258818.db2.gz MLXAFFHIYDBJDV-JTQLQIEISA-N 1 2 313.232 4.017 20 0 DIADLO Cc1cccc(C2=CC[N@H+]([C@@H](C)c3nc(C4CC4)no3)CC2)c1 ZINC000092822065 185344166 /nfs/dbraw/zinc/34/41/66/185344166.db2.gz WYRLPKUAKDHYNV-AWEZNQCLSA-N 1 2 309.413 4.106 20 0 DIADLO Cc1cccc(C2=CC[N@@H+]([C@@H](C)c3nc(C4CC4)no3)CC2)c1 ZINC000092822065 185344167 /nfs/dbraw/zinc/34/41/67/185344167.db2.gz WYRLPKUAKDHYNV-AWEZNQCLSA-N 1 2 309.413 4.106 20 0 DIADLO Cc1ccc(NC(=O)NC2(c3ccc(Cl)cc3)CC2)c(C)[nH+]1 ZINC000152321805 334959245 /nfs/dbraw/zinc/95/92/45/334959245.db2.gz OGHNNRQFSPBUMG-UHFFFAOYSA-N 1 2 315.804 4.163 20 0 DIADLO CC(C)(C)Sc1ccc(NC(=O)CCc2[nH]cc[nH+]2)cc1F ZINC000295551445 535031587 /nfs/dbraw/zinc/03/15/87/535031587.db2.gz MKUGCVLTGLUOLG-UHFFFAOYSA-N 1 2 321.421 4.011 20 0 DIADLO C[C@H](CC(=O)N[C@@H](C)c1cccc2ccccc21)C1CC[NH2+]CC1 ZINC000150723257 186060187 /nfs/dbraw/zinc/06/01/87/186060187.db2.gz GZCKUQBLZKLBCN-CVEARBPZSA-N 1 2 324.468 4.043 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@H](C)c1ccc(Cl)cn1)c1ccco1 ZINC000274957165 535180913 /nfs/dbraw/zinc/18/09/13/535180913.db2.gz WCIGNAYXLGQVDD-CZUORRHYSA-N 1 2 322.836 4.393 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc2ccccc2s1)c1nc(C)cs1 ZINC000072864754 191244134 /nfs/dbraw/zinc/24/41/34/191244134.db2.gz GXXZDYDFOQJIHX-INIZCTEOSA-N 1 2 317.483 4.476 20 0 DIADLO FC(F)(F)C1CC[NH+](Cc2csc(-c3ccco3)n2)CC1 ZINC000075997238 191548746 /nfs/dbraw/zinc/54/87/46/191548746.db2.gz NQURJZIEOOVERJ-UHFFFAOYSA-N 1 2 316.348 4.177 20 0 DIADLO CC[N@@H+](Cc1nc(C)c(C)o1)Cc1cccc(Br)c1 ZINC000299409368 535389858 /nfs/dbraw/zinc/38/98/58/535389858.db2.gz ZDUYWOWUGAKODL-UHFFFAOYSA-N 1 2 323.234 4.076 20 0 DIADLO O=C(c1cccc(-c2ccoc2)c1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000089805845 192874832 /nfs/dbraw/zinc/87/48/32/192874832.db2.gz RZCWWASDNVLKGE-KRWDZBQOSA-N 1 2 321.380 4.037 20 0 DIADLO Cc1ccc(C[C@@H]([NH2+][C@@H](C)c2nccs2)c2ccccn2)cc1 ZINC000091725243 193098527 /nfs/dbraw/zinc/09/85/27/193098527.db2.gz DXQBJQSODOSKLE-MAUKXSAKSA-N 1 2 323.465 4.481 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nccs1)c1nc(C(F)(F)F)cs1 ZINC000091731812 193099174 /nfs/dbraw/zinc/09/91/74/193099174.db2.gz NFSWSLALKLTOPP-JGVFFNPUSA-N 1 2 321.393 4.420 20 0 DIADLO CC(C)c1csc(C[NH2+][C@H](C)c2nc3c(s2)CCCC3)n1 ZINC000091738389 193100615 /nfs/dbraw/zinc/10/06/15/193100615.db2.gz IAQAWJIZHPHJLU-LLVKDONJSA-N 1 2 321.515 4.453 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000091986637 193137627 /nfs/dbraw/zinc/13/76/27/193137627.db2.gz LZCWBNPHBZKRBI-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)[C@@H](C)c1ccncc1 ZINC000091986637 193137629 /nfs/dbraw/zinc/13/76/29/193137629.db2.gz LZCWBNPHBZKRBI-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@H]2C2CCCCC2)c(C)[nH+]1 ZINC000152336532 334995988 /nfs/dbraw/zinc/99/59/88/334995988.db2.gz MPHWPYOHKSFCEL-KRWDZBQOSA-N 1 2 301.434 4.275 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccccc2Br)s1 ZINC000134911503 335012559 /nfs/dbraw/zinc/01/25/59/335012559.db2.gz LIODLINDPZHLNS-SNVBAGLBSA-N 1 2 311.248 4.065 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H]2CCSc3ccc(F)cc32)cs1 ZINC000036968753 182856857 /nfs/dbraw/zinc/85/68/57/182856857.db2.gz LSPUHHRZTKUSMD-TVQRCGJNSA-N 1 2 308.447 4.478 20 0 DIADLO CCCC[C@@H](C)N(CCCC)C(=O)c1ccc2[nH+]ccn2c1 ZINC000563835890 335038537 /nfs/dbraw/zinc/03/85/37/335038537.db2.gz LKDMDSSARPCITO-OAHLLOKOSA-N 1 2 301.434 4.155 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H](C)c2ccc(F)cc2Cl)c(C)[nH+]1 ZINC000152390080 335043693 /nfs/dbraw/zinc/04/36/93/335043693.db2.gz LQANSDZAAVIHNA-JTQLQIEISA-N 1 2 321.783 4.374 20 0 DIADLO Brc1cncc(C[N@@H+]2CCC[C@H]2c2ccsc2)c1 ZINC000298773404 532977372 /nfs/dbraw/zinc/97/73/72/532977372.db2.gz SNVSVZQEMNNRJT-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cncc(C[N@H+]2CCC[C@H]2c2ccsc2)c1 ZINC000298773404 532977377 /nfs/dbraw/zinc/97/73/77/532977377.db2.gz SNVSVZQEMNNRJT-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO CC[C@H](NC(=O)Nc1ccc(C)[nH+]c1C)c1cc(F)ccc1F ZINC000152392854 335047805 /nfs/dbraw/zinc/04/78/05/335047805.db2.gz PTZNIMWOWQLSMW-HNNXBMFYSA-N 1 2 319.355 4.249 20 0 DIADLO Cc1cc(C[NH+](Cc2cccs2)Cc2cccs2)n(C)n1 ZINC000417687251 335048600 /nfs/dbraw/zinc/04/86/00/335048600.db2.gz VLAUZZZELAPGHQ-UHFFFAOYSA-N 1 2 317.483 4.054 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@H]1CCCc2ccccc21 ZINC000072058356 184927085 /nfs/dbraw/zinc/92/70/85/184927085.db2.gz CYFJVSZFDPLEKG-SFHVURJKSA-N 1 2 317.392 4.135 20 0 DIADLO COc1cc(C)nc(C[NH2+][C@@H](C)c2c(F)cccc2Cl)c1 ZINC000272129326 130000878 /nfs/dbraw/zinc/00/08/78/130000878.db2.gz AABAHXGJIMSSNB-NSHDSACASA-N 1 2 308.784 4.042 20 0 DIADLO COc1cc(C)[nH+]c(CN[C@@H](C)c2c(F)cccc2Cl)c1 ZINC000272129326 130000880 /nfs/dbraw/zinc/00/08/80/130000880.db2.gz AABAHXGJIMSSNB-NSHDSACASA-N 1 2 308.784 4.042 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)[C@@H]1CCCCS1 ZINC000272923768 130074884 /nfs/dbraw/zinc/07/48/84/130074884.db2.gz GGZUPGUDYVKRQT-INIZCTEOSA-N 1 2 314.410 4.098 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2nc(Cl)ccc2Cl)n1 ZINC000273170379 130095172 /nfs/dbraw/zinc/09/51/72/130095172.db2.gz DNRMZXZEKMIRKV-UHFFFAOYSA-N 1 2 316.257 4.178 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc(Cl)ccc1Cl)c1nccs1 ZINC000273185513 130096690 /nfs/dbraw/zinc/09/66/90/130096690.db2.gz LEPFNPCDODXFQZ-CYBMUJFWSA-N 1 2 316.257 4.260 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)[C@@H](C)c1nnc(C)s1 ZINC000273192499 130096706 /nfs/dbraw/zinc/09/67/06/130096706.db2.gz OAUZNQVFPUQVAC-QMMMGPOBSA-N 1 2 301.868 4.145 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)[C@@H](C)c1nnc(C)s1 ZINC000273192499 130096707 /nfs/dbraw/zinc/09/67/07/130096707.db2.gz OAUZNQVFPUQVAC-QMMMGPOBSA-N 1 2 301.868 4.145 20 0 DIADLO Cc1cccc([C@@H]2CCN(C(=O)Nc3ccc(C)[nH+]c3C)C2)c1 ZINC000273220077 130099137 /nfs/dbraw/zinc/09/91/37/130099137.db2.gz KWXYDOUNJOFEJZ-QGZVFWFLSA-N 1 2 309.413 4.028 20 0 DIADLO CCc1ccc(-c2noc([C@@H](C)[NH2+]Cc3ccccc3)n2)cc1 ZINC000273292753 130103742 /nfs/dbraw/zinc/10/37/42/130103742.db2.gz IZZKHVQLMOXOHC-CQSZACIVSA-N 1 2 307.397 4.150 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1ccc(Cl)s1 ZINC000273480307 130126690 /nfs/dbraw/zinc/12/66/90/130126690.db2.gz HZGJBKHRGKTHES-WCBMZHEXSA-N 1 2 311.838 4.464 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)s1 ZINC000273622125 130147145 /nfs/dbraw/zinc/14/71/45/130147145.db2.gz QRSNKSIXMUUFGJ-LLVKDONJSA-N 1 2 315.364 4.136 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)s1 ZINC000273622125 130147148 /nfs/dbraw/zinc/14/71/48/130147148.db2.gz QRSNKSIXMUUFGJ-LLVKDONJSA-N 1 2 315.364 4.136 20 0 DIADLO c1cc2c(s1)CCC[C@@H]2[NH2+]Cc1ncc(-c2ccccc2)cn1 ZINC000274095084 130205699 /nfs/dbraw/zinc/20/56/99/130205699.db2.gz VDVMHKZYPGUFMG-KRWDZBQOSA-N 1 2 321.449 4.372 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3nc(Cl)ccc3Cl)CC2)c1 ZINC000274295424 130225110 /nfs/dbraw/zinc/22/51/10/130225110.db2.gz IACBUPOBJOGDLI-UHFFFAOYSA-N 1 2 311.187 4.306 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)sc1C ZINC000274554368 130244248 /nfs/dbraw/zinc/24/42/48/130244248.db2.gz FAWPJDPAZJOTQU-SSDOTTSWSA-N 1 2 321.393 4.086 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)nc1)c1nc(C(F)(F)F)cs1 ZINC000274609864 130249212 /nfs/dbraw/zinc/24/92/12/130249212.db2.gz NBLYBTNSJFXKFI-ZETCQYMHSA-N 1 2 321.755 4.061 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2occc21)c1nc(C(F)(F)F)cs1 ZINC000274634455 130250628 /nfs/dbraw/zinc/25/06/28/130250628.db2.gz RYQIJQHUPDQBAK-WPRPVWTQSA-N 1 2 316.348 4.483 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+][C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000274616194 130251195 /nfs/dbraw/zinc/25/11/95/130251195.db2.gz OOMRQEWHFAVTEH-UWVGGRQHSA-N 1 2 315.364 4.277 20 0 DIADLO CC(C)c1ccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000275660515 130356408 /nfs/dbraw/zinc/35/64/08/130356408.db2.gz BIBHRYALBZOXKX-LJQANCHMSA-N 1 2 305.425 4.412 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(C2CCCCC2)cc1)c1ncn(C)n1 ZINC000275802870 130388840 /nfs/dbraw/zinc/38/88/40/130388840.db2.gz YSTSHZGNNCTABF-LSDHHAIUSA-N 1 2 312.461 4.275 20 0 DIADLO Cc1ccc(C[NH2+]Cc2nnc(C(C)(C)C)s2)cc1Cl ZINC000277745132 130636284 /nfs/dbraw/zinc/63/62/84/130636284.db2.gz QHPWZSXGWCNRIX-UHFFFAOYSA-N 1 2 309.866 4.087 20 0 DIADLO CC(C)c1occc1C(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000280592185 130808205 /nfs/dbraw/zinc/80/82/05/130808205.db2.gz XAOGKFWZEKGWFC-UHFFFAOYSA-N 1 2 323.396 4.419 20 0 DIADLO Cc1noc(C(C)(C)[NH2+]Cc2cc(-c3ccccc3)cs2)n1 ZINC000284000254 131040267 /nfs/dbraw/zinc/04/02/67/131040267.db2.gz MMPOTUZWIFNWTM-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO O=C(Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1)c1cc[nH]c1C1CC1 ZINC000284055534 131044114 /nfs/dbraw/zinc/04/41/14/131044114.db2.gz URGVOWZLUHGWHV-UHFFFAOYSA-N 1 2 320.396 4.288 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2nnc(C)s2)cc1 ZINC000284329926 131070597 /nfs/dbraw/zinc/07/05/97/131070597.db2.gz MGKDHOQBORFWPG-CHWSQXEVSA-N 1 2 319.474 4.437 20 0 DIADLO FC(F)(F)C1CC[NH+](Cc2cc(-c3ccccc3)on2)CC1 ZINC000285236626 131150398 /nfs/dbraw/zinc/15/03/98/131150398.db2.gz YJABCMHBDDFWRQ-UHFFFAOYSA-N 1 2 310.319 4.116 20 0 DIADLO Cc1ccc(NC(=O)N2CCC=C(c3ccccc3)C2)c(C)[nH+]1 ZINC000285277911 131153348 /nfs/dbraw/zinc/15/33/48/131153348.db2.gz AXRXWNDNZWPNOL-UHFFFAOYSA-N 1 2 307.397 4.020 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+]3CCC[C@@H]3c3cc[nH]n3)n2)cc1 ZINC000285343996 131158384 /nfs/dbraw/zinc/15/83/84/131158384.db2.gz PJUOVBPYAHWLKL-QGZVFWFLSA-N 1 2 324.453 4.179 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+]3CCC[C@@H]3c3cc[nH]n3)n2)cc1 ZINC000285343996 131158386 /nfs/dbraw/zinc/15/83/86/131158386.db2.gz PJUOVBPYAHWLKL-QGZVFWFLSA-N 1 2 324.453 4.179 20 0 DIADLO Cc1cc([C@H](C)Nc2ccc(-c3cn4c([nH+]3)CCCC4)cc2)no1 ZINC000285420800 131166828 /nfs/dbraw/zinc/16/68/28/131166828.db2.gz YDMIYSPSWIUYIZ-AWEZNQCLSA-N 1 2 322.412 4.356 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000285490547 131173278 /nfs/dbraw/zinc/17/32/78/131173278.db2.gz WRWVOUSQAVTXLP-GOSISDBHSA-N 1 2 322.412 4.100 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000285490547 131173280 /nfs/dbraw/zinc/17/32/80/131173280.db2.gz WRWVOUSQAVTXLP-GOSISDBHSA-N 1 2 322.412 4.100 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1cc(C)ccc1OC ZINC000285643912 131188570 /nfs/dbraw/zinc/18/85/70/131188570.db2.gz LBSHKADQHQGMHT-MLGOLLRUSA-N 1 2 320.383 4.479 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1nc2c(s1)CCCC2 ZINC000285745251 131198335 /nfs/dbraw/zinc/19/83/35/131198335.db2.gz RPILMHGJNGAANB-UWVGGRQHSA-N 1 2 323.412 4.107 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000285825014 131204411 /nfs/dbraw/zinc/20/44/11/131204411.db2.gz WQLDFXKVPBNOGI-UHFFFAOYSA-N 1 2 307.463 4.070 20 0 DIADLO Cc1c([C@H](C)Nc2cc[nH+]c3c(Cl)cccc23)cnn1C ZINC000286075854 131218919 /nfs/dbraw/zinc/21/89/19/131218919.db2.gz JJOZXOVDUFGWIJ-JTQLQIEISA-N 1 2 300.793 4.103 20 0 DIADLO CC(C)c1csc(C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)n1 ZINC000286124171 131220056 /nfs/dbraw/zinc/22/00/56/131220056.db2.gz OGUMIJYZXMRJQZ-MRXNPFEDSA-N 1 2 318.490 4.401 20 0 DIADLO CSc1ccccc1[C@@H](C)NC(=O)Nc1c(C)cc[nH+]c1C ZINC000286974358 131259022 /nfs/dbraw/zinc/25/90/22/131259022.db2.gz BKGJQHVTIXSSPJ-GFCCVEGCSA-N 1 2 315.442 4.303 20 0 DIADLO Cc1ccccc1NC(=O)C[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000287052791 131261794 /nfs/dbraw/zinc/26/17/94/131261794.db2.gz UNAIWSKLTQMZGK-KRWDZBQOSA-N 1 2 314.454 4.078 20 0 DIADLO Cc1ccccc1NC(=O)C[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000287052791 131261795 /nfs/dbraw/zinc/26/17/95/131261795.db2.gz UNAIWSKLTQMZGK-KRWDZBQOSA-N 1 2 314.454 4.078 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1C[C@H](C)CC[C@H]1c1ccccc1 ZINC000287214658 131269023 /nfs/dbraw/zinc/26/90/23/131269023.db2.gz UYSOTTKURFUFSE-KDOFPFPSSA-N 1 2 309.413 4.395 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000287400844 131278795 /nfs/dbraw/zinc/27/87/95/131278795.db2.gz DMOLOJWTCKCUOF-SWLSCSKDSA-N 1 2 313.401 4.297 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000287400838 131279128 /nfs/dbraw/zinc/27/91/28/131279128.db2.gz DMOLOJWTCKCUOF-IUODEOHRSA-N 1 2 313.401 4.297 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC(C)(c2ccccc2)CC1 ZINC000287447060 131280898 /nfs/dbraw/zinc/28/08/98/131280898.db2.gz HSPZJENQEACQEH-UHFFFAOYSA-N 1 2 323.440 4.284 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](C)c1ccc(F)cc1Cl ZINC000287470891 131282283 /nfs/dbraw/zinc/28/22/83/131282283.db2.gz JLGIEMOBHHGDCE-JTQLQIEISA-N 1 2 321.783 4.374 20 0 DIADLO CC[C@@H](C)Sc1ccc(NC(=O)CCc2[nH]cc[nH+]2)c(C)c1 ZINC000287519472 131284156 /nfs/dbraw/zinc/28/41/56/131284156.db2.gz ZJYVRSRUWCCWMH-CYBMUJFWSA-N 1 2 317.458 4.180 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@@H]1C1CCCCC1 ZINC000287529655 131284710 /nfs/dbraw/zinc/28/47/10/131284710.db2.gz NKLUUUHWVSXFTO-MRXNPFEDSA-N 1 2 301.434 4.275 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CCc2cc(Cl)ccc21 ZINC000287536020 131286324 /nfs/dbraw/zinc/28/63/24/131286324.db2.gz NWMYNOCSPPGNQI-HNNXBMFYSA-N 1 2 315.804 4.161 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NC1(c2cccc(Cl)c2)CC1 ZINC000287601176 131289134 /nfs/dbraw/zinc/28/91/34/131289134.db2.gz SANXNDCDRGNEMU-UHFFFAOYSA-N 1 2 315.804 4.163 20 0 DIADLO Fc1ccc(C[N@H+](C/C(Cl)=C/Cl)C2CCOCC2)cc1 ZINC000287593324 131289467 /nfs/dbraw/zinc/28/94/67/131289467.db2.gz CWLXNNBRXITVJM-LCYFTJDESA-N 1 2 318.219 4.126 20 0 DIADLO Fc1ccc(C[N@@H+](C/C(Cl)=C/Cl)C2CCOCC2)cc1 ZINC000287593324 131289469 /nfs/dbraw/zinc/28/94/69/131289469.db2.gz CWLXNNBRXITVJM-LCYFTJDESA-N 1 2 318.219 4.126 20 0 DIADLO CCCN(Cc1ccc(F)cc1)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287612827 131290543 /nfs/dbraw/zinc/29/05/43/131290543.db2.gz SXIICZUDWFJTCH-UHFFFAOYSA-N 1 2 315.392 4.282 20 0 DIADLO Cc1ccc([C@H]2CCN(C(=O)Nc3c(C)cc[nH+]c3C)C2)c(C)c1 ZINC000287631250 131290968 /nfs/dbraw/zinc/29/09/68/131290968.db2.gz UYBNVBUTMWYIKV-KRWDZBQOSA-N 1 2 323.440 4.337 20 0 DIADLO CC[C@H](Cc1ccccc1)N(C)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287627510 131291400 /nfs/dbraw/zinc/29/14/00/131291400.db2.gz URGITHYDJKNCNR-QGZVFWFLSA-N 1 2 311.429 4.183 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000287621393 131291454 /nfs/dbraw/zinc/29/14/54/131291454.db2.gz UFOCRFPQRKZNFM-DOTOQJQBSA-N 1 2 309.413 4.108 20 0 DIADLO Cc1cc([C@H](C)NC(=O)Nc2c(C)cc[nH+]c2C)c(C)s1 ZINC000287655349 131293007 /nfs/dbraw/zinc/29/30/07/131293007.db2.gz WPSSNFVCTRCHKW-NSHDSACASA-N 1 2 303.431 4.259 20 0 DIADLO c1cc(-c2ccccc2)oc1C[NH2+]Cc1noc2c1CCCC2 ZINC000288455027 131326034 /nfs/dbraw/zinc/32/60/34/131326034.db2.gz NLNASQZDCSSQKS-UHFFFAOYSA-N 1 2 308.381 4.103 20 0 DIADLO COc1ccc(C[N@H+](Cc2noc(C(C)C)n2)C(C)(C)C)cc1 ZINC000288634963 131333204 /nfs/dbraw/zinc/33/32/04/131333204.db2.gz ADJYVVRSLRKWHV-UHFFFAOYSA-N 1 2 317.433 4.002 20 0 DIADLO COc1ccc(C[N@@H+](Cc2noc(C(C)C)n2)C(C)(C)C)cc1 ZINC000288634963 131333206 /nfs/dbraw/zinc/33/32/06/131333206.db2.gz ADJYVVRSLRKWHV-UHFFFAOYSA-N 1 2 317.433 4.002 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@@H]2CCCCS2)no1)c1ccccc1 ZINC000288958852 131347953 /nfs/dbraw/zinc/34/79/53/131347953.db2.gz BMWCBRCFNAWNDO-LSDHHAIUSA-N 1 2 317.458 4.069 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@@H]2CCCCS2)no1)c1ccccc1 ZINC000288958852 131347954 /nfs/dbraw/zinc/34/79/54/131347954.db2.gz BMWCBRCFNAWNDO-LSDHHAIUSA-N 1 2 317.458 4.069 20 0 DIADLO CC[N@H+](C)[C@H](c1nc([C@@H]2CCCCS2)no1)c1ccccc1 ZINC000288958847 131348378 /nfs/dbraw/zinc/34/83/78/131348378.db2.gz BMWCBRCFNAWNDO-GJZGRUSLSA-N 1 2 317.458 4.069 20 0 DIADLO CC[N@@H+](C)[C@H](c1nc([C@@H]2CCCCS2)no1)c1ccccc1 ZINC000288958847 131348380 /nfs/dbraw/zinc/34/83/80/131348380.db2.gz BMWCBRCFNAWNDO-GJZGRUSLSA-N 1 2 317.458 4.069 20 0 DIADLO CC[N@H+](Cc1cn(C(C)C)nn1)[C@H](C)c1cc2ccccc2o1 ZINC000289005415 131351792 /nfs/dbraw/zinc/35/17/92/131351792.db2.gz FDCORWPXELYYCD-CQSZACIVSA-N 1 2 312.417 4.188 20 0 DIADLO CC[N@@H+](Cc1cn(C(C)C)nn1)[C@H](C)c1cc2ccccc2o1 ZINC000289005415 131351795 /nfs/dbraw/zinc/35/17/95/131351795.db2.gz FDCORWPXELYYCD-CQSZACIVSA-N 1 2 312.417 4.188 20 0 DIADLO C[NH+](C)[C@@H](c1nc(C(C)(C)c2ccccc2)no1)c1ccccc1 ZINC000289054372 131354613 /nfs/dbraw/zinc/35/46/13/131354613.db2.gz LANWMOAPENJXFV-QGZVFWFLSA-N 1 2 321.424 4.047 20 0 DIADLO C[NH+](C)[C@H](c1nc(C(C)(C)c2ccccc2)no1)c1ccccc1 ZINC000289054365 131354700 /nfs/dbraw/zinc/35/47/00/131354700.db2.gz LANWMOAPENJXFV-KRWDZBQOSA-N 1 2 321.424 4.047 20 0 DIADLO Cc1ccc(NC(=O)N([C@H](C)c2ccccc2)C2CC2)c(C)[nH+]1 ZINC000289085349 131357548 /nfs/dbraw/zinc/35/75/48/131357548.db2.gz OEPUEMJKKDHSBC-OAHLLOKOSA-N 1 2 309.413 4.456 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccncc1F ZINC000340306214 131364171 /nfs/dbraw/zinc/36/41/71/131364171.db2.gz PJQPZVXDPPWNNR-KUHUBIRLSA-N 1 2 307.372 4.056 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1nccn1C(C)C ZINC000289351419 131376853 /nfs/dbraw/zinc/37/68/53/131376853.db2.gz GFIWMVYADGPFNH-KRWDZBQOSA-N 1 2 301.434 4.056 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1nccn1C(C)C ZINC000289351419 131376855 /nfs/dbraw/zinc/37/68/55/131376855.db2.gz GFIWMVYADGPFNH-KRWDZBQOSA-N 1 2 301.434 4.056 20 0 DIADLO Cc1cnc(C2CC[NH+](Cc3cc(C(C)(C)C)on3)CC2)s1 ZINC000289582924 131397915 /nfs/dbraw/zinc/39/79/15/131397915.db2.gz RMXHDOWNFPQYKJ-UHFFFAOYSA-N 1 2 319.474 4.117 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2ccc(OC(C)(C)C)cc2)s1 ZINC000289597711 131399955 /nfs/dbraw/zinc/39/99/55/131399955.db2.gz BKGHVQBRLUCOIF-GFCCVEGCSA-N 1 2 319.474 4.129 20 0 DIADLO CC(C)n1cc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)nn1 ZINC000289818104 131419839 /nfs/dbraw/zinc/41/98/39/131419839.db2.gz SLOGPUGCVUYMCJ-INIZCTEOSA-N 1 2 322.403 4.014 20 0 DIADLO Fc1cnc(Cl)c(C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)c1 ZINC000297451340 132016143 /nfs/dbraw/zinc/01/61/43/132016143.db2.gz WZMFYMOCUDRDCK-CQSZACIVSA-N 1 2 322.815 4.008 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000297611613 132025496 /nfs/dbraw/zinc/02/54/96/132025496.db2.gz KQIAQMYMXNNTEH-FUHWJXTLSA-N 1 2 309.413 4.190 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000297655542 132027496 /nfs/dbraw/zinc/02/74/96/132027496.db2.gz DWQFEIMIMDLBGC-QGZVFWFLSA-N 1 2 307.397 4.149 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(C)cc1OC(C)(C)C ZINC000297955599 132041968 /nfs/dbraw/zinc/04/19/68/132041968.db2.gz ZBLRVEYNARIXCD-OAHLLOKOSA-N 1 2 315.461 4.240 20 0 DIADLO CC(C)c1noc(C[NH2+]C(c2ccccc2)c2ccccc2)n1 ZINC000298093401 132046456 /nfs/dbraw/zinc/04/64/56/132046456.db2.gz UKJQANGRZFYXNV-UHFFFAOYSA-N 1 2 307.397 4.072 20 0 DIADLO CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1nc(=O)c2sccc2[nH]1 ZINC000298616573 132070413 /nfs/dbraw/zinc/07/04/13/132070413.db2.gz MWADSRSWVPTEOA-NEPJUHHUSA-N 1 2 319.474 4.091 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1cc(-c2ccco2)on1)C(C)C ZINC000298712557 132074797 /nfs/dbraw/zinc/07/47/97/132074797.db2.gz UFCFJQRFHUKXLI-QGZVFWFLSA-N 1 2 311.385 4.125 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nc(Cc2ccccc2)no1)c1ccccc1 ZINC000298729549 132075937 /nfs/dbraw/zinc/07/59/37/132075937.db2.gz OHIDORJWKAVFBR-HXUWFJFHSA-N 1 2 321.424 4.147 20 0 DIADLO Cc1cc(-c2noc([C@@H](C)[NH2+]Cc3cccs3)n2)ccc1F ZINC000298872478 132081469 /nfs/dbraw/zinc/08/14/69/132081469.db2.gz LEPQXCNOGIHDFR-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO c1coc(-c2noc(-c3cccc(Oc4cc[nH+]cc4)c3)n2)c1 ZINC000340662159 132121862 /nfs/dbraw/zinc/12/18/62/132121862.db2.gz LNOIPRYYKLSGMT-UHFFFAOYSA-N 1 2 305.293 4.184 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2csc(Br)c2)cs1 ZINC000163939469 132127915 /nfs/dbraw/zinc/12/79/15/132127915.db2.gz HFOIZSRQNQOMCL-ZETCQYMHSA-N 1 2 317.277 4.126 20 0 DIADLO CCC1(C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)CCCC1 ZINC000340664908 132129904 /nfs/dbraw/zinc/12/99/04/132129904.db2.gz CDTCRDNCKWAYMB-UHFFFAOYSA-N 1 2 311.429 4.360 20 0 DIADLO Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000164141374 132130423 /nfs/dbraw/zinc/13/04/23/132130423.db2.gz WQZLFQRVJZHWEY-CABCVRRESA-N 1 2 323.421 4.189 20 0 DIADLO Cn1c2ccc(NC(=O)CCc3ccccc3)cc2[nH+]c1C1CC1 ZINC000340667237 132136527 /nfs/dbraw/zinc/13/65/27/132136527.db2.gz OURNQKBPFUAIHQ-UHFFFAOYSA-N 1 2 319.408 4.022 20 0 DIADLO Cc1cc(NC(=O)N[C@@H](C)c2nc(C(C)(C)C)cs2)cc[nH+]1 ZINC000119792986 132137499 /nfs/dbraw/zinc/13/74/99/132137499.db2.gz YQUNJUYBKJWQLD-NSHDSACASA-N 1 2 318.446 4.027 20 0 DIADLO CCn1c[nH+]cc1CN(C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000417705540 335065204 /nfs/dbraw/zinc/06/52/04/335065204.db2.gz MCYKUDVNRKLSHC-LLVKDONJSA-N 1 2 312.244 4.403 20 0 DIADLO Cc1cc(N[C@H](C)c2ccccc2-n2cccn2)nc(C2CC2)[nH+]1 ZINC000531589441 435103968 /nfs/dbraw/zinc/10/39/68/435103968.db2.gz IFKIPSPFOBFISD-CQSZACIVSA-N 1 2 319.412 4.021 20 0 DIADLO COc1ccccc1C(C)(C)CNc1cc(C)[nH+]c(C2CC2)n1 ZINC000604757065 435338429 /nfs/dbraw/zinc/33/84/29/435338429.db2.gz ZXIYBCRJESZPPX-UHFFFAOYSA-N 1 2 311.429 4.061 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H](C)CCc3cccn3C)ccc2c1 ZINC000608090813 435351847 /nfs/dbraw/zinc/35/18/47/435351847.db2.gz GICSFJKACWQRHG-AWEZNQCLSA-N 1 2 309.413 4.015 20 0 DIADLO CC(C)c1cc(N[C@@H](CO)c2cccc(F)c2)nc(C(C)C)[nH+]1 ZINC000536389677 435382088 /nfs/dbraw/zinc/38/20/88/435382088.db2.gz VSJAIFNEZMWWPR-INIZCTEOSA-N 1 2 317.408 4.008 20 0 DIADLO c1[nH+]c(-c2cccc(N[C@@H]3CC[C@H]3C3CC3)c2)n2c1CCCC2 ZINC000570748362 332810122 /nfs/dbraw/zinc/81/01/22/332810122.db2.gz FETCVPPKUACAOU-RBUKOAKNSA-N 1 2 307.441 4.487 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)c(C)o1 ZINC000570896355 332837072 /nfs/dbraw/zinc/83/70/72/332837072.db2.gz XTPHGNFPKAEMNS-KDOFPFPSSA-N 1 2 309.413 4.070 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)CCc2cccc(F)c2)c(C)[nH+]1 ZINC000175102387 332874515 /nfs/dbraw/zinc/87/45/15/332874515.db2.gz JTEITBYDKWVNNI-LBPRGKRZSA-N 1 2 314.404 4.353 20 0 DIADLO Fc1ccc(-c2nc(C[NH+]3CC4(CCC4(F)F)C3)cs2)cc1 ZINC000574967839 332898444 /nfs/dbraw/zinc/89/84/44/332898444.db2.gz BTGKRAUZJMPHOM-UHFFFAOYSA-N 1 2 324.371 4.180 20 0 DIADLO Fc1ccc(NCc2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC000035039695 331466447 /nfs/dbraw/zinc/46/64/47/331466447.db2.gz XRXBNSBHQGTLKA-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO C[C@H]([NH2+]Cc1cscn1)c1cc(Cl)ccc1OC(F)F ZINC000127386514 331532272 /nfs/dbraw/zinc/53/22/72/331532272.db2.gz YNGVBMXGUGGETR-QMMMGPOBSA-N 1 2 318.776 4.249 20 0 DIADLO COc1ccc2oc([C@@H](C)[NH2+]Cc3ncccc3F)c(C)c2c1 ZINC000530524157 331564876 /nfs/dbraw/zinc/56/48/76/331564876.db2.gz ILKFRODEASGCBB-GFCCVEGCSA-N 1 2 314.360 4.135 20 0 DIADLO Cc1ccsc1[C@H]1C[C@H]1c1nc(Cc2ccc[nH+]c2C)no1 ZINC000580055459 332918900 /nfs/dbraw/zinc/91/89/00/332918900.db2.gz TUJSJPPTZPTDIM-UONOGXRCSA-N 1 2 311.410 4.005 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CCc3[nH]c4ccccc4c3C2)c1 ZINC000530695575 331619648 /nfs/dbraw/zinc/61/96/48/331619648.db2.gz YMEVWXSMXCKBMW-UHFFFAOYSA-N 1 2 317.314 4.144 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1cccs1)c1ccc(F)cc1)c1ncc[nH]1 ZINC000556860396 331742812 /nfs/dbraw/zinc/74/28/12/331742812.db2.gz IZMXOXSZVSBWHB-IAQYHMDHSA-N 1 2 301.390 4.051 20 0 DIADLO Clc1cccc2c(N3CCC[C@@H]3[C@H]3CCCO3)cc[nH+]c12 ZINC000557672116 331807699 /nfs/dbraw/zinc/80/76/99/331807699.db2.gz FREFFUOLYGHDKM-HZPDHXFCSA-N 1 2 302.805 4.036 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+]Cc2cscn2)cc1OC ZINC000060526668 331808837 /nfs/dbraw/zinc/80/88/37/331808837.db2.gz BOLFHQYFUMVDIG-ZDUSSCGKSA-N 1 2 320.458 4.181 20 0 DIADLO C[C@H]([NH2+]Cc1ncccc1F)c1cc2cc(Cl)ccc2o1 ZINC000557800093 331817224 /nfs/dbraw/zinc/81/72/24/331817224.db2.gz OUXYMNFTZXFRMT-JTQLQIEISA-N 1 2 304.752 4.471 20 0 DIADLO Cc1cc(C)c(NC(=O)C2CC(c3cccc(F)c3)C2)c(C)[nH+]1 ZINC000363441372 331910728 /nfs/dbraw/zinc/91/07/28/331910728.db2.gz GMISWCSGRCUWNL-UHFFFAOYSA-N 1 2 312.388 4.278 20 0 DIADLO Cc1ccc2[nH+]c(CNc3ccc(C(F)(F)F)cc3)cn2c1 ZINC000530992784 331944221 /nfs/dbraw/zinc/94/42/21/331944221.db2.gz OVOMIBJXTBBSTI-UHFFFAOYSA-N 1 2 305.303 4.274 20 0 DIADLO Cc1oc(C(C)C)cc1C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000518228970 331998401 /nfs/dbraw/zinc/99/84/01/331998401.db2.gz IBKXRNSOAJZLHC-UHFFFAOYSA-N 1 2 309.369 4.354 20 0 DIADLO Cc1cc(C)cc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)c1 ZINC000518249670 332000606 /nfs/dbraw/zinc/00/06/06/332000606.db2.gz WWKOFYIIEYCEQR-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)c1 ZINC000518249670 332000607 /nfs/dbraw/zinc/00/06/07/332000607.db2.gz WWKOFYIIEYCEQR-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H]2CCc3sc(Cl)cc32)c(C)[nH+]1 ZINC000518261610 332002094 /nfs/dbraw/zinc/00/20/94/332002094.db2.gz LXJOJZYHAVYOPT-GFCCVEGCSA-N 1 2 321.833 4.222 20 0 DIADLO FC(F)(F)Cc1cccc(NCc2cn3ccccc3[nH+]2)c1 ZINC000084493416 332003158 /nfs/dbraw/zinc/00/31/58/332003158.db2.gz XVFNYISKKJDUGA-UHFFFAOYSA-N 1 2 305.303 4.051 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)C(C)(C)Cc1cccc(Cl)c1 ZINC000084761010 332005887 /nfs/dbraw/zinc/00/58/87/332005887.db2.gz ICDAIMCXWVGJCZ-UHFFFAOYSA-N 1 2 302.805 4.251 20 0 DIADLO Cc1cc(NC(Cc2ccccc2)Cc2ccccc2)nc[nH+]1 ZINC000518378282 332021979 /nfs/dbraw/zinc/02/19/79/332021979.db2.gz PWGWDBMOPGDAMP-UHFFFAOYSA-N 1 2 303.409 4.051 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2ccccc2OC(F)F)s1 ZINC000130501377 332024317 /nfs/dbraw/zinc/02/43/17/332024317.db2.gz OIDVKJBHQQKXNX-SNVBAGLBSA-N 1 2 312.385 4.158 20 0 DIADLO CCc1cnc(C[N@H+](C)C[C@H]2CCC3(CCCCC3)O2)s1 ZINC000409446833 332032512 /nfs/dbraw/zinc/03/25/12/332032512.db2.gz NMCIANDHWIFQFX-CQSZACIVSA-N 1 2 308.491 4.019 20 0 DIADLO CCc1cnc(C[N@@H+](C)C[C@H]2CCC3(CCCCC3)O2)s1 ZINC000409446833 332032513 /nfs/dbraw/zinc/03/25/13/332032513.db2.gz NMCIANDHWIFQFX-CQSZACIVSA-N 1 2 308.491 4.019 20 0 DIADLO CC(C)(C)c1cnc(C[NH+]2CCC(OCC3CCCC3)CC2)o1 ZINC000409447646 332033175 /nfs/dbraw/zinc/03/31/75/332033175.db2.gz FGRDGUFMWJDCMI-UHFFFAOYSA-N 1 2 320.477 4.143 20 0 DIADLO C[C@H](CSCCn1cc[nH+]c1)c1ccc(C(F)(F)F)cc1 ZINC000409862127 332060247 /nfs/dbraw/zinc/06/02/47/332060247.db2.gz NERODTXFPKLZBI-GFCCVEGCSA-N 1 2 314.376 4.439 20 0 DIADLO CCCC[C@H](C)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000409983661 332071050 /nfs/dbraw/zinc/07/10/50/332071050.db2.gz IMMNCTFSGJHSJA-HNNXBMFYSA-N 1 2 323.440 4.367 20 0 DIADLO Cc1ccoc1C[NH2+][C@H](c1cccnc1)c1ccc(F)c(C)c1 ZINC000426352485 332074173 /nfs/dbraw/zinc/07/41/73/332074173.db2.gz QAJHNRUGGRGXGC-IBGZPJMESA-N 1 2 310.372 4.310 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(C(F)(F)F)s2)[C@H]1[C@@H]1CCCO1 ZINC000569399042 332074719 /nfs/dbraw/zinc/07/47/19/332074719.db2.gz AWYAYABGSDAMGA-AAEUAGOBSA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(C(F)(F)F)s2)[C@H]1[C@@H]1CCCO1 ZINC000569399042 332074720 /nfs/dbraw/zinc/07/47/20/332074720.db2.gz AWYAYABGSDAMGA-AAEUAGOBSA-N 1 2 319.392 4.156 20 0 DIADLO O=C(CC1CCCC1)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000410080562 332086956 /nfs/dbraw/zinc/08/69/56/332086956.db2.gz PGYJZHSYFLVCNC-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO Fc1ccc(C2CC2)cc1C[NH2+]Cc1csc(C2CC2)n1 ZINC000449372663 332087420 /nfs/dbraw/zinc/08/74/20/332087420.db2.gz KJORJIIKOJSLFG-UHFFFAOYSA-N 1 2 302.418 4.327 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)Cc3ccc(O)cc3)cs2)cc1 ZINC000569466556 332096399 /nfs/dbraw/zinc/09/63/99/332096399.db2.gz GKRKNWRWLNSRPB-UHFFFAOYSA-N 1 2 324.449 4.456 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)Cc3ccc(O)cc3)cs2)cc1 ZINC000569466556 332096400 /nfs/dbraw/zinc/09/64/00/332096400.db2.gz GKRKNWRWLNSRPB-UHFFFAOYSA-N 1 2 324.449 4.456 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CCc2cc(F)ccc2C1 ZINC000091893667 332113802 /nfs/dbraw/zinc/11/38/02/332113802.db2.gz MKGMGZLKRROTHV-LBPRGKRZSA-N 1 2 302.393 4.231 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCc2cc(F)ccc2C1 ZINC000091893667 332113803 /nfs/dbraw/zinc/11/38/03/332113803.db2.gz MKGMGZLKRROTHV-LBPRGKRZSA-N 1 2 302.393 4.231 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc3ccccc3c2)[C@H](c2ccccc2)CO1 ZINC000410394728 332122038 /nfs/dbraw/zinc/12/20/38/332122038.db2.gz DSZAELPKCXSVEH-IERDGZPVSA-N 1 2 318.420 4.197 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc3ccccc3c2)[C@H](c2ccccc2)CO1 ZINC000410394728 332122041 /nfs/dbraw/zinc/12/20/41/332122041.db2.gz DSZAELPKCXSVEH-IERDGZPVSA-N 1 2 318.420 4.197 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCO[C@H](c3ccsc3)C2)cc1F ZINC000569529794 332126989 /nfs/dbraw/zinc/12/69/89/332126989.db2.gz BCEJGJZZZLFGOD-IMLGJKEDSA-N 1 2 321.392 4.113 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCO[C@H](c3ccsc3)C2)cc1F ZINC000569529794 332126990 /nfs/dbraw/zinc/12/69/90/332126990.db2.gz BCEJGJZZZLFGOD-IMLGJKEDSA-N 1 2 321.392 4.113 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCO[C@H](c3ccsc3)C2)cc1F ZINC000569529797 332126998 /nfs/dbraw/zinc/12/69/98/332126998.db2.gz BCEJGJZZZLFGOD-YYZONTRBSA-N 1 2 321.392 4.113 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCO[C@H](c3ccsc3)C2)cc1F ZINC000569529797 332126999 /nfs/dbraw/zinc/12/69/99/332126999.db2.gz BCEJGJZZZLFGOD-YYZONTRBSA-N 1 2 321.392 4.113 20 0 DIADLO Cc1nc(N[C@H](COc2ccccc2F)c2ccccc2)cc[nH+]1 ZINC000426893078 332160433 /nfs/dbraw/zinc/16/04/33/332160433.db2.gz DBRDJTRXDDABSS-QGZVFWFLSA-N 1 2 323.371 4.156 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cccc(C)c2F)[nH+]1 ZINC000427192260 332182852 /nfs/dbraw/zinc/18/28/52/332182852.db2.gz IERGFBNXENAGPU-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO CC[C@@H](Nc1ccc(C(F)(F)F)c(OC)c1)c1[nH+]ccn1C ZINC000448029043 332201680 /nfs/dbraw/zinc/20/16/80/332201680.db2.gz PNXXXSIKPIJHMF-GFCCVEGCSA-N 1 2 313.323 4.011 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc([C@H]2CCCC(C)(C)C2)no1 ZINC000533849685 332221089 /nfs/dbraw/zinc/22/10/89/332221089.db2.gz NFLXFLAFRORTSU-AWEZNQCLSA-N 1 2 324.428 4.460 20 0 DIADLO CSCc1cnc(C[N@@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)s1 ZINC000449463312 332234724 /nfs/dbraw/zinc/23/47/24/332234724.db2.gz VVVCOKJZMDCPDB-VHSXEESVSA-N 1 2 324.437 4.169 20 0 DIADLO CSCc1cnc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)s1 ZINC000449463312 332234726 /nfs/dbraw/zinc/23/47/26/332234726.db2.gz VVVCOKJZMDCPDB-VHSXEESVSA-N 1 2 324.437 4.169 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000559934413 332294976 /nfs/dbraw/zinc/29/49/76/332294976.db2.gz ZVBMLBRZRPXAJL-KPZWWZAWSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000559934413 332294977 /nfs/dbraw/zinc/29/49/77/332294977.db2.gz ZVBMLBRZRPXAJL-KPZWWZAWSA-N 1 2 321.342 4.238 20 0 DIADLO Cc1ccc(Cc2noc(/C(F)=C\C3CCCCC3)n2)c[nH+]1 ZINC000559944093 332295432 /nfs/dbraw/zinc/29/54/32/332295432.db2.gz FHBGUPZJWVSIAH-OQLLNIDSSA-N 1 2 301.365 4.255 20 0 DIADLO Cc1ccc2[nH+]c(CNC(=O)CCCC3CCCCC3)cn2c1 ZINC000560188040 332317806 /nfs/dbraw/zinc/31/78/06/332317806.db2.gz TZZMPACEYFIKGM-UHFFFAOYSA-N 1 2 313.445 4.010 20 0 DIADLO Cc1ccc2cc([C@@H](C)[NH2+][C@@H](C)c3nnc(C(C)C)[nH]3)oc2c1 ZINC000426076430 335100847 /nfs/dbraw/zinc/10/08/47/335100847.db2.gz LBRHVGQPDRLAKZ-OLZOCXBDSA-N 1 2 312.417 4.395 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H]2CC3CCC2CC3)[nH+]1 ZINC000560320395 332330392 /nfs/dbraw/zinc/33/03/92/332330392.db2.gz QTVURUKHEQWGRU-ZBCRRDGASA-N 1 2 309.413 4.150 20 0 DIADLO C[C@@H](CC(=O)Nc1cccc(Nc2ccccc2)c1)n1cc[nH+]c1 ZINC000560338940 332331905 /nfs/dbraw/zinc/33/19/05/332331905.db2.gz XWRJPTCODQBRTI-HNNXBMFYSA-N 1 2 320.396 4.217 20 0 DIADLO CCC1CCN(c2cc(COC)[nH+]c3ccc(F)cc32)CC1 ZINC000560366339 332335180 /nfs/dbraw/zinc/33/51/80/332335180.db2.gz GFIYHZQFBHDWEB-UHFFFAOYSA-N 1 2 302.393 4.147 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+][C@H](COCC(C)C)c2ccco2)c1 ZINC000560530344 332352478 /nfs/dbraw/zinc/35/24/78/332352478.db2.gz YAGYBCGWESJBQO-DOTOQJQBSA-N 1 2 302.418 4.048 20 0 DIADLO c1nc(C2CCCC2)sc1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC000560546182 332356993 /nfs/dbraw/zinc/35/69/93/332356993.db2.gz RYLYSAOYEVLNRD-UHFFFAOYSA-N 1 2 320.502 4.336 20 0 DIADLO c1nc(C2CCCC2)sc1C[N@H+]1CCOC2(CCCCC2)C1 ZINC000560546182 332356994 /nfs/dbraw/zinc/35/69/94/332356994.db2.gz RYLYSAOYEVLNRD-UHFFFAOYSA-N 1 2 320.502 4.336 20 0 DIADLO Clc1oc2ccccc2c1C[N@@H+]1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000560630345 332370922 /nfs/dbraw/zinc/37/09/22/332370922.db2.gz YQIWMHNRGVDEIC-FUHWJXTLSA-N 1 2 317.816 4.230 20 0 DIADLO Clc1oc2ccccc2c1C[N@H+]1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000560630345 332370923 /nfs/dbraw/zinc/37/09/23/332370923.db2.gz YQIWMHNRGVDEIC-FUHWJXTLSA-N 1 2 317.816 4.230 20 0 DIADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)c1ccccc1 ZINC000560682437 332376911 /nfs/dbraw/zinc/37/69/11/332376911.db2.gz JCTYBNOITVXVGT-UHFFFAOYSA-N 1 2 317.392 4.139 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc(-c3cccs3)s2)CC2(CCC2)O1 ZINC000564990735 332385695 /nfs/dbraw/zinc/38/56/95/332385695.db2.gz MUNQGFLWJRHXMN-LBPRGKRZSA-N 1 2 320.483 4.015 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnc(-c3cccs3)s2)CC2(CCC2)O1 ZINC000564990735 332385696 /nfs/dbraw/zinc/38/56/96/332385696.db2.gz MUNQGFLWJRHXMN-LBPRGKRZSA-N 1 2 320.483 4.015 20 0 DIADLO FC(F)(F)c1cc(Nc2ccc(N3CCCCC3)[nH+]c2)ccn1 ZINC000561103669 332410802 /nfs/dbraw/zinc/41/08/02/332410802.db2.gz LNRBEPBRTUTVNP-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO COCCCOc1cccc(CNc2[nH+]ccc(C)c2Cl)c1 ZINC000561281464 332432966 /nfs/dbraw/zinc/43/29/66/332432966.db2.gz UAYKVDVGZBZBLW-UHFFFAOYSA-N 1 2 320.820 4.071 20 0 DIADLO Cc1ccc(S[C@@H](C)C(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000425583712 335106640 /nfs/dbraw/zinc/10/66/40/335106640.db2.gz BMRIZUIPTUSORK-AWEZNQCLSA-N 1 2 300.427 4.126 20 0 DIADLO O=C(Nc1cccc(-c2ccccc2)c1)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000561663483 332477138 /nfs/dbraw/zinc/47/71/38/332477138.db2.gz PPHGVKKILXAPNO-KRWDZBQOSA-N 1 2 317.392 4.135 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1ccccc1C)c1ccco1 ZINC000151115534 332522414 /nfs/dbraw/zinc/52/24/14/332522414.db2.gz CBJQZLKESMZRKK-HXUWFJFHSA-N 1 2 307.393 4.476 20 0 DIADLO c1ccc([C@@H]([NH2+][C@H]2COCc3ccccc32)c2ccccn2)cc1 ZINC000428216044 332557944 /nfs/dbraw/zinc/55/79/44/332557944.db2.gz BFDJEPFACLFTCD-LEWJYISDSA-N 1 2 316.404 4.032 20 0 DIADLO CCCc1nc(C)c(C[NH2+]C(C)(C)c2nc(C)c(C)s2)o1 ZINC000428380141 332566663 /nfs/dbraw/zinc/56/66/63/332566663.db2.gz LFJCAIBHHJBVET-UHFFFAOYSA-N 1 2 307.463 4.034 20 0 DIADLO Cc1ccc(Br)c(NCc2cn3ccccc3[nH+]2)c1 ZINC000168551942 332577198 /nfs/dbraw/zinc/57/71/98/332577198.db2.gz FROASMKQJPXMNO-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO COc1nc2ccccc2cc1C[NH+]1CC(C)(CC(F)(F)F)C1 ZINC000562683157 332615826 /nfs/dbraw/zinc/61/58/26/332615826.db2.gz ZCHZVXMAVKMRKU-UHFFFAOYSA-N 1 2 324.346 4.018 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nc(C)c3ccccc3n2)ccc1F ZINC000562710641 332619883 /nfs/dbraw/zinc/61/98/83/332619883.db2.gz OTMIFKUXRXMXKD-CYBMUJFWSA-N 1 2 309.388 4.237 20 0 DIADLO Cc1cccc(NCc2cn3ccccc3[nH+]2)c1Br ZINC000157827954 332643641 /nfs/dbraw/zinc/64/36/41/332643641.db2.gz PEMOURSIKRHEAX-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO Cc1cccn2cc(COc3ccc(F)c4c3C(=O)C[C@@H]4C)[nH+]c12 ZINC000569914011 332692410 /nfs/dbraw/zinc/69/24/10/332692410.db2.gz ZUJYSBHPSZEJNW-LBPRGKRZSA-N 1 2 324.355 4.051 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1nc2ccccc2o1 ZINC000528653816 332701715 /nfs/dbraw/zinc/70/17/15/332701715.db2.gz ADNGNTHRQMCQIG-ACJLOTCBSA-N 1 2 307.397 4.415 20 0 DIADLO C[C@@H]([NH2+]Cc1cc2cccnc2o1)c1nc(C(C)(C)C)cs1 ZINC000570275995 332733419 /nfs/dbraw/zinc/73/34/19/332733419.db2.gz QBBHNOLMRGFBPU-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO CC1(CNC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)CCC1 ZINC000177031324 332967675 /nfs/dbraw/zinc/96/76/75/332967675.db2.gz DGDGDMQEUHGYAH-UHFFFAOYSA-N 1 2 311.385 4.186 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2sccc2Br)s1 ZINC000168354307 333024206 /nfs/dbraw/zinc/02/42/06/333024206.db2.gz RAIQEBZUMVKBGK-QMMMGPOBSA-N 1 2 317.277 4.126 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1sccc1Br ZINC000178064772 333001337 /nfs/dbraw/zinc/00/13/37/333001337.db2.gz JIPZGJRTOYMPSD-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1sccc1Br ZINC000178064772 333001339 /nfs/dbraw/zinc/00/13/39/333001339.db2.gz JIPZGJRTOYMPSD-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)[C@@H]2CCc3ccccc32)n1 ZINC000178292465 333006912 /nfs/dbraw/zinc/00/69/12/333006912.db2.gz ASUAEMLTUUZXMS-SWLSCSKDSA-N 1 2 317.458 4.003 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)[C@@H]2CCc3ccccc32)n1 ZINC000178292465 333006913 /nfs/dbraw/zinc/00/69/13/333006913.db2.gz ASUAEMLTUUZXMS-SWLSCSKDSA-N 1 2 317.458 4.003 20 0 DIADLO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000180309238 333027508 /nfs/dbraw/zinc/02/75/08/333027508.db2.gz UXXCJLQWWJLNQH-FRRDWIJNSA-N 1 2 320.820 4.165 20 0 DIADLO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000180309238 333027510 /nfs/dbraw/zinc/02/75/10/333027510.db2.gz UXXCJLQWWJLNQH-FRRDWIJNSA-N 1 2 320.820 4.165 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+][C@@H](C)c1cccc(O)c1 ZINC000181575517 333030879 /nfs/dbraw/zinc/03/08/79/333030879.db2.gz PQACUEZQQJSGCW-NSHDSACASA-N 1 2 314.410 4.268 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2cccc(F)c2)n1)c1cccc(O)c1 ZINC000181539879 333031111 /nfs/dbraw/zinc/03/11/11/333031111.db2.gz UOXJORRSCHYPOP-LBPRGKRZSA-N 1 2 312.344 4.037 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1ccn(-c2ccccc2F)n1 ZINC000188843753 333055980 /nfs/dbraw/zinc/05/59/80/333055980.db2.gz AJRVYIMVHQXAEY-CYBMUJFWSA-N 1 2 315.417 4.266 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1ccn(-c2ccccc2F)n1 ZINC000188843753 333055983 /nfs/dbraw/zinc/05/59/83/333055983.db2.gz AJRVYIMVHQXAEY-CYBMUJFWSA-N 1 2 315.417 4.266 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2nc(C(C)(C)C)cs2)C1 ZINC000460348565 333068232 /nfs/dbraw/zinc/06/82/32/333068232.db2.gz MHMKSPLMBGGPDS-ZFWWWQNUSA-N 1 2 315.486 4.419 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2nc(C(C)(C)C)cs2)C1 ZINC000460348565 333068233 /nfs/dbraw/zinc/06/82/33/333068233.db2.gz MHMKSPLMBGGPDS-ZFWWWQNUSA-N 1 2 315.486 4.419 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccccc2)no1)c1cc2ccccc2o1 ZINC000181767738 333078331 /nfs/dbraw/zinc/07/83/31/333078331.db2.gz MESIGBJGTNVEKL-ZDUSSCGKSA-N 1 2 319.364 4.334 20 0 DIADLO Clc1ccc(/C=C\C[N@@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000526056818 333107722 /nfs/dbraw/zinc/10/77/22/333107722.db2.gz KFXNQKRHEKGSRZ-NLVOMGJBSA-N 1 2 319.857 4.488 20 0 DIADLO Clc1ccc(/C=C\C[N@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000526056818 333107723 /nfs/dbraw/zinc/10/77/23/333107723.db2.gz KFXNQKRHEKGSRZ-NLVOMGJBSA-N 1 2 319.857 4.488 20 0 DIADLO CC(C)(C)C1=CC[N@H+](Cc2nc(C(F)(F)F)cs2)CC1 ZINC000533930513 333138894 /nfs/dbraw/zinc/13/88/94/333138894.db2.gz XIMRRTZCKWNTHP-UHFFFAOYSA-N 1 2 304.381 4.340 20 0 DIADLO CC(C)(C)C1=CC[N@@H+](Cc2nc(C(F)(F)F)cs2)CC1 ZINC000533930513 333138895 /nfs/dbraw/zinc/13/88/95/333138895.db2.gz XIMRRTZCKWNTHP-UHFFFAOYSA-N 1 2 304.381 4.340 20 0 DIADLO Cc1cc2occ(CC(=O)Nc3c(C)cc[nH+]c3C)c2cc1C ZINC000425591467 335124408 /nfs/dbraw/zinc/12/44/08/335124408.db2.gz ZOUXZBOJOCRAJL-UHFFFAOYSA-N 1 2 308.381 4.243 20 0 DIADLO Cc1cccc(Oc2cc(CNc3cccc[nH+]3)ccn2)c1C ZINC000463022111 333140986 /nfs/dbraw/zinc/14/09/86/333140986.db2.gz QMFRXIQHJOBEEL-UHFFFAOYSA-N 1 2 305.381 4.498 20 0 DIADLO Cc1cccc(C(C)(C)[NH2+]Cc2noc(-c3ccsc3)n2)c1 ZINC000179596635 333153050 /nfs/dbraw/zinc/15/30/50/333153050.db2.gz JMNMMUVYOJWESC-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO CC(C)COC1CC[NH+](Cc2ncc(Cl)cc2Cl)CC1 ZINC000182069345 333175409 /nfs/dbraw/zinc/17/54/09/333175409.db2.gz BPSKSNGLNWNFSX-UHFFFAOYSA-N 1 2 317.260 4.025 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCSC[C@@H]1CCCO1 ZINC000460874429 333189354 /nfs/dbraw/zinc/18/93/54/333189354.db2.gz IKSAWBQTXDVJRM-INIZCTEOSA-N 1 2 318.486 4.427 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3cccc4ccccc43)ccc2n1C ZINC000525731257 333201524 /nfs/dbraw/zinc/20/15/24/333201524.db2.gz MOIWLKDWUNUNLC-UHFFFAOYSA-N 1 2 315.376 4.287 20 0 DIADLO c1coc(C[N@@H+]2CCCC[C@@H]2c2nc(-c3ccccc3)no2)c1 ZINC000093005021 333209517 /nfs/dbraw/zinc/20/95/17/333209517.db2.gz NIVFZTXOSZSNEQ-MRXNPFEDSA-N 1 2 309.369 4.057 20 0 DIADLO c1coc(C[N@H+]2CCCC[C@@H]2c2nc(-c3ccccc3)no2)c1 ZINC000093005021 333209518 /nfs/dbraw/zinc/20/95/18/333209518.db2.gz NIVFZTXOSZSNEQ-MRXNPFEDSA-N 1 2 309.369 4.057 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000497590510 333266367 /nfs/dbraw/zinc/26/63/67/333266367.db2.gz IRSLCDMLYNZWHI-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000497590510 333266368 /nfs/dbraw/zinc/26/63/68/333266368.db2.gz IRSLCDMLYNZWHI-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1nc(CCC(C)C)no1 ZINC000518829425 335130470 /nfs/dbraw/zinc/13/04/70/335130470.db2.gz ZWGWMURDBJFVBF-CQSZACIVSA-N 1 2 319.474 4.229 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1nc(CCC(C)C)no1 ZINC000518829425 335130471 /nfs/dbraw/zinc/13/04/71/335130471.db2.gz ZWGWMURDBJFVBF-CQSZACIVSA-N 1 2 319.474 4.229 20 0 DIADLO CCOc1ccc([C@@H](C)Nc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC000390361583 333272054 /nfs/dbraw/zinc/27/20/54/333272054.db2.gz CZJSQSSSPJQISB-OAHLLOKOSA-N 1 2 311.429 4.254 20 0 DIADLO C[C@@H](Sc1[nH+]cnc2c1cnn2C)c1ccc(F)c(Cl)c1 ZINC000497663732 333274988 /nfs/dbraw/zinc/27/49/88/333274988.db2.gz QTHOVIJNZAIMAO-MRVPVSSYSA-N 1 2 322.796 4.009 20 0 DIADLO Fc1ccc(F)c(C[NH2+]Cc2ccsc2Br)c1 ZINC000388421224 333303436 /nfs/dbraw/zinc/30/34/36/333303436.db2.gz HVAKADQAJNAHCR-UHFFFAOYSA-N 1 2 318.186 4.079 20 0 DIADLO c1coc(C[NH+](Cc2ccco2)Cc2ccc3c(c2)CCO3)c1 ZINC000109827009 333326573 /nfs/dbraw/zinc/32/65/73/333326573.db2.gz VPGDJYYLQSOMSZ-UHFFFAOYSA-N 1 2 309.365 4.010 20 0 DIADLO CC[C@H]1C[N@H+](Cc2nnsc2Cl)CC[C@@H]1c1ccccc1 ZINC000531339906 333344603 /nfs/dbraw/zinc/34/46/03/333344603.db2.gz BZUNJYHBPLVRCD-JSGCOSHPSA-N 1 2 321.877 4.207 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2nnsc2Cl)CC[C@@H]1c1ccccc1 ZINC000531339906 333344605 /nfs/dbraw/zinc/34/46/05/333344605.db2.gz BZUNJYHBPLVRCD-JSGCOSHPSA-N 1 2 321.877 4.207 20 0 DIADLO FC(F)Oc1ccccc1COc1ccccc1-n1cc[nH+]c1 ZINC000531349747 333345340 /nfs/dbraw/zinc/34/53/40/333345340.db2.gz RQBKHCKDYXHQTK-UHFFFAOYSA-N 1 2 316.307 4.053 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCc3nc(C)sc3C)c2c1 ZINC000354539574 333345360 /nfs/dbraw/zinc/34/53/60/333345360.db2.gz RKWHHKRBSYVQCQ-UHFFFAOYSA-N 1 2 314.410 4.204 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccn(-c3ccccc3)n2)[C@@H]1c1ccccc1 ZINC000531378338 333347654 /nfs/dbraw/zinc/34/76/54/333347654.db2.gz FXMHRFURAHDNIH-UZLBHIALSA-N 1 2 303.409 4.065 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccn(-c3ccccc3)n2)[C@@H]1c1ccccc1 ZINC000531378338 333347655 /nfs/dbraw/zinc/34/76/55/333347655.db2.gz FXMHRFURAHDNIH-UZLBHIALSA-N 1 2 303.409 4.065 20 0 DIADLO CC[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc(OC)cc1 ZINC000319639739 333392105 /nfs/dbraw/zinc/39/21/05/333392105.db2.gz CXSDVNKRBVUVDR-GOSISDBHSA-N 1 2 311.429 4.254 20 0 DIADLO COc1ccc(OC)c([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c1 ZINC000319723004 333400436 /nfs/dbraw/zinc/40/04/36/333400436.db2.gz BEKWWFAGEWAZTC-VXGBXAGGSA-N 1 2 321.367 4.394 20 0 DIADLO Cc1cccc2[nH+]c(CN(C)[C@@H](C)c3c(F)cccc3F)cn21 ZINC000337496772 333450357 /nfs/dbraw/zinc/45/03/57/333450357.db2.gz GGCMNSVMEOTJBM-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO CCn1c[nH+]cc1CN(Cc1c(F)cccc1F)C1CCCC1 ZINC000417778299 335143706 /nfs/dbraw/zinc/14/37/06/335143706.db2.gz ABNSVOBDKOYXIC-UHFFFAOYSA-N 1 2 319.399 4.126 20 0 DIADLO Cc1ccnc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)n1 ZINC000338593752 333492845 /nfs/dbraw/zinc/49/28/45/333492845.db2.gz MGCHYKOXEXVYIW-MRXNPFEDSA-N 1 2 321.346 4.045 20 0 DIADLO CCCN(C(=O)Nc1cc(C)[nH+]cc1C)[C@H]1CCc2ccccc21 ZINC000534323505 333576407 /nfs/dbraw/zinc/57/64/07/333576407.db2.gz HOXJYSNCTFBZTQ-IBGZPJMESA-N 1 2 323.440 4.052 20 0 DIADLO CC(C)(C)c1cccc(C(=O)N2CCCC[C@@H]2c2[nH]cc[nH+]2)c1 ZINC000563547567 333622334 /nfs/dbraw/zinc/62/23/34/333622334.db2.gz WMKGIZZWVARWLL-MRXNPFEDSA-N 1 2 311.429 4.075 20 0 DIADLO CC(C)CC[C@H]([NH2+]Cc1nc(=O)c2sccc2[nH]1)C(C)(C)C ZINC000411485643 333680096 /nfs/dbraw/zinc/68/00/96/333680096.db2.gz GPALHJKMZRJPKR-ZDUSSCGKSA-N 1 2 321.490 4.337 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+]CC2(C(F)F)CC2)C(F)F)c1 ZINC000571225046 333685242 /nfs/dbraw/zinc/68/52/42/333685242.db2.gz RPFJJOOKGAUJJV-ZDUSSCGKSA-N 1 2 319.342 4.415 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2c1cc(Cl)cc2Cl)c1csnn1 ZINC000412036492 333725120 /nfs/dbraw/zinc/72/51/20/333725120.db2.gz IHCJSEBEVPGDJH-JMCQJSRRSA-N 1 2 314.241 4.183 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000413278052 333839155 /nfs/dbraw/zinc/83/91/55/333839155.db2.gz HJMIWJNYOBPFAP-SJORKVTESA-N 1 2 317.477 4.460 20 0 DIADLO CCC[C@@H]([NH2+][C@@H](C)c1cc2n(n1)CCC2)c1ccc(F)cc1F ZINC000414097633 333895793 /nfs/dbraw/zinc/89/57/93/333895793.db2.gz IIFKAMUXUFBLLJ-YVEFUNNKSA-N 1 2 319.399 4.300 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+][C@@H](C)c1nc2c(s1)CCC2 ZINC000414137240 333901190 /nfs/dbraw/zinc/90/11/90/333901190.db2.gz DXBYYZJASZEJHS-NEPJUHHUSA-N 1 2 301.459 4.001 20 0 DIADLO CC1(C[S@](=O)Cc2[nH+]ccn2-c2ccccc2)CCCCC1 ZINC000414254945 333928087 /nfs/dbraw/zinc/92/80/87/333928087.db2.gz BTYZRPORONIYAB-JOCHJYFZSA-N 1 2 316.470 4.091 20 0 DIADLO C[C@@H]([NH2+]Cc1nccc(C(F)(F)F)n1)c1ccc(Cl)s1 ZINC000414270086 333931221 /nfs/dbraw/zinc/93/12/21/333931221.db2.gz YNZRYTUSHWVRMA-SSDOTTSWSA-N 1 2 321.755 4.061 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc(Cl)cc(Cl)c1)c1csnn1 ZINC000414309344 333937061 /nfs/dbraw/zinc/93/70/61/333937061.db2.gz UVWAYJBZRSAUKA-HTQZYQBOSA-N 1 2 302.230 4.257 20 0 DIADLO Cc1occc1CNc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000414364461 333945650 /nfs/dbraw/zinc/94/56/50/333945650.db2.gz YMEREPUFDIUISO-UHFFFAOYSA-N 1 2 307.397 4.400 20 0 DIADLO CC(C)(C)c1ccncc1C[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000414497293 333997781 /nfs/dbraw/zinc/99/77/81/333997781.db2.gz KDSANZUQEMBXRK-UHFFFAOYSA-N 1 2 321.424 4.324 20 0 DIADLO CCc1ccc(-c2ccc(C[NH2+][C@H](C)c3csnn3)o2)cc1 ZINC000414545629 334014181 /nfs/dbraw/zinc/01/41/81/334014181.db2.gz FJRMFKHWPMYUSY-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2nc(C3CC3)cs2)s1 ZINC000343539348 335170787 /nfs/dbraw/zinc/17/07/87/335170787.db2.gz UDZZEBCAUXYRJS-JTQLQIEISA-N 1 2 307.488 4.287 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2nc(C3CC3)cs2)s1 ZINC000343539348 335170788 /nfs/dbraw/zinc/17/07/88/335170788.db2.gz UDZZEBCAUXYRJS-JTQLQIEISA-N 1 2 307.488 4.287 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCOc2cc(Cl)ccc21)c1cscn1 ZINC000271913481 334028585 /nfs/dbraw/zinc/02/85/85/334028585.db2.gz YIOABHLQMXEWNM-GXFFZTMASA-N 1 2 308.834 4.361 20 0 DIADLO CSc1ccc([C@H](C)[NH2+][C@@H](C)c2nnc(C)s2)cc1F ZINC000274255940 334058193 /nfs/dbraw/zinc/05/81/93/334058193.db2.gz TURKOIJGARUHKY-IUCAKERBSA-N 1 2 311.451 4.119 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+]1CCc2c(F)cc(F)cc2[C@H]1C ZINC000343528959 335175174 /nfs/dbraw/zinc/17/51/74/335175174.db2.gz CHJCOYXSRYPUNI-CYBMUJFWSA-N 1 2 319.399 4.170 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+]1CCc2c(F)cc(F)cc2[C@H]1C ZINC000343528959 335175175 /nfs/dbraw/zinc/17/51/75/335175175.db2.gz CHJCOYXSRYPUNI-CYBMUJFWSA-N 1 2 319.399 4.170 20 0 DIADLO Cc1cccc(C[NH2+][C@H](C)c2cscn2)c1Br ZINC000276542157 334081458 /nfs/dbraw/zinc/08/14/58/334081458.db2.gz OXOXXRWZCKIJBL-SNVBAGLBSA-N 1 2 311.248 4.065 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)[nH]1 ZINC000277071353 334086430 /nfs/dbraw/zinc/08/64/30/334086430.db2.gz DZCPQWKXLWKGCC-GARJFASQSA-N 1 2 308.376 4.008 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1cccc(F)c1F ZINC000278883245 334102648 /nfs/dbraw/zinc/10/26/48/334102648.db2.gz UADDTRZIECCLKR-VIFPVBQESA-N 1 2 316.273 4.229 20 0 DIADLO COc1cc(CNc2ccc3c(c2)CCC[NH2+]3)ccc1SC ZINC000414852510 334126516 /nfs/dbraw/zinc/12/65/16/334126516.db2.gz QCKBJTLZWDNFAU-UHFFFAOYSA-N 1 2 314.454 4.387 20 0 DIADLO COc1ccc(CNc2ccc3c(c2)CCC[NH2+]3)cc1Cl ZINC000414855166 334128309 /nfs/dbraw/zinc/12/83/09/334128309.db2.gz VVMVNZOAHYNZHU-UHFFFAOYSA-N 1 2 302.805 4.319 20 0 DIADLO FC(F)Oc1cccc(CNc2ccc3c(c2)CCC[NH2+]3)c1 ZINC000414856625 334129780 /nfs/dbraw/zinc/12/97/80/334129780.db2.gz YUVOZESWYBUXLI-UHFFFAOYSA-N 1 2 304.340 4.258 20 0 DIADLO C[C@H](Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)c1ccncc1F ZINC000340343124 334173072 /nfs/dbraw/zinc/17/30/72/334173072.db2.gz KDJXVYMODZTRBS-NSHDSACASA-N 1 2 316.767 4.233 20 0 DIADLO Cn1ccnc1C[NH2+][C@H](c1cccs1)c1ccc(Cl)cc1 ZINC000340436698 334200708 /nfs/dbraw/zinc/20/07/08/334200708.db2.gz PBOATDKWHSBPTF-INIZCTEOSA-N 1 2 317.845 4.014 20 0 DIADLO c1c[nH+]c([C@@H](Nc2ccc([C@@H]3CCOC3)cc2)c2ccccc2)[nH]1 ZINC000295050946 334216019 /nfs/dbraw/zinc/21/60/19/334216019.db2.gz QGSVPCYFSWGSCS-MJGOQNOKSA-N 1 2 319.408 4.115 20 0 DIADLO Cc1[nH+]c(-c2ccncc2)nc(NCCCC(C)(F)F)c1C ZINC000295057247 334216532 /nfs/dbraw/zinc/21/65/32/334216532.db2.gz YSNMVYBIPNJZNF-UHFFFAOYSA-N 1 2 306.360 4.003 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)Nc1cc(Cl)c(Cl)cc1OC ZINC000296389832 334233394 /nfs/dbraw/zinc/23/33/94/334233394.db2.gz JUFWPLOMPYOXAA-VIFPVBQESA-N 1 2 314.216 4.392 20 0 DIADLO CC1(C)C[C@@H]([NH2+]Cc2ncc(C(F)(F)F)cn2)c2ccccc21 ZINC000296390905 334233544 /nfs/dbraw/zinc/23/35/44/334233544.db2.gz KBGVRYJVSOZRSU-CQSZACIVSA-N 1 2 321.346 4.008 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)no1 ZINC000582150592 334276096 /nfs/dbraw/zinc/27/60/96/334276096.db2.gz HZHQEGITSBWCMV-GOSISDBHSA-N 1 2 302.393 4.043 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CC[C@](F)(c3ccccc3)C2)no1 ZINC000582150592 334276098 /nfs/dbraw/zinc/27/60/98/334276098.db2.gz HZHQEGITSBWCMV-GOSISDBHSA-N 1 2 302.393 4.043 20 0 DIADLO CC1=CC[N@H+]([C@@H](C)c2nc(Cc3ccc(Cl)cc3)no2)CC1 ZINC000534480978 334276449 /nfs/dbraw/zinc/27/64/49/334276449.db2.gz XWFCYOKIVBEPPL-ZDUSSCGKSA-N 1 2 317.820 4.027 20 0 DIADLO CC1=CC[N@@H+]([C@@H](C)c2nc(Cc3ccc(Cl)cc3)no2)CC1 ZINC000534480978 334276450 /nfs/dbraw/zinc/27/64/50/334276450.db2.gz XWFCYOKIVBEPPL-ZDUSSCGKSA-N 1 2 317.820 4.027 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1cc(OC)cc(C)n1 ZINC000534545067 334282420 /nfs/dbraw/zinc/28/24/20/334282420.db2.gz MYVWYWMZBAOSIQ-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1cc(OC)cc(C)n1 ZINC000534545067 334282422 /nfs/dbraw/zinc/28/24/22/334282422.db2.gz MYVWYWMZBAOSIQ-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CCN(Cc1ccc(Cl)cc1)Cc1cc(OC)cc(C)[nH+]1 ZINC000534553514 334284285 /nfs/dbraw/zinc/28/42/85/334284285.db2.gz BBQVSYBTNPBING-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO Cc1nc(C(C)C)sc1C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000531930298 334290977 /nfs/dbraw/zinc/29/09/77/334290977.db2.gz FXDQRAPIIKTBPB-UHFFFAOYSA-N 1 2 314.414 4.012 20 0 DIADLO Cc1nc(C(C)C)sc1C(=O)Nc1ccc2[nH+]c(C)[nH]c2c1 ZINC000531930298 334290978 /nfs/dbraw/zinc/29/09/78/334290978.db2.gz FXDQRAPIIKTBPB-UHFFFAOYSA-N 1 2 314.414 4.012 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)cc1 ZINC000531943820 334299964 /nfs/dbraw/zinc/29/99/64/334299964.db2.gz CLMSFQLFOUURCE-LPHOPBHVSA-N 1 2 305.425 4.169 20 0 DIADLO CC(C)(C)OC(=O)C[N@@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000303372343 334315853 /nfs/dbraw/zinc/31/58/53/334315853.db2.gz KJHACHNBTZUISX-KRWDZBQOSA-N 1 2 314.429 4.037 20 0 DIADLO CC(C)(C)OC(=O)C[N@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000303372343 334315854 /nfs/dbraw/zinc/31/58/54/334315854.db2.gz KJHACHNBTZUISX-KRWDZBQOSA-N 1 2 314.429 4.037 20 0 DIADLO CCCC[N@H+](Cc1ncc(C2CC2)o1)Cc1ccccc1F ZINC000534858451 334341638 /nfs/dbraw/zinc/34/16/38/334341638.db2.gz YUDHZITZXAHWSL-UHFFFAOYSA-N 1 2 302.393 4.493 20 0 DIADLO CCCC[N@@H+](Cc1ncc(C2CC2)o1)Cc1ccccc1F ZINC000534858451 334341639 /nfs/dbraw/zinc/34/16/39/334341639.db2.gz YUDHZITZXAHWSL-UHFFFAOYSA-N 1 2 302.393 4.493 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+]2CCc3ccsc3C2)o1 ZINC000534863468 334341882 /nfs/dbraw/zinc/34/18/82/334341882.db2.gz JFTWOWISYVLVRG-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+]2CCc3ccsc3C2)o1 ZINC000534863468 334341883 /nfs/dbraw/zinc/34/18/83/334341883.db2.gz JFTWOWISYVLVRG-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(Cl)c2)C[C@@H](c2ccc(F)cc2)O1 ZINC000303957576 334349367 /nfs/dbraw/zinc/34/93/67/334349367.db2.gz XZHHNKTYHXVOMD-UGSOOPFHSA-N 1 2 319.807 4.441 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(Cl)c2)C[C@@H](c2ccc(F)cc2)O1 ZINC000303957576 334349369 /nfs/dbraw/zinc/34/93/69/334349369.db2.gz XZHHNKTYHXVOMD-UGSOOPFHSA-N 1 2 319.807 4.441 20 0 DIADLO Cc1cc(NC(=O)N[C@H](c2ccccc2)C(C)(C)C)c(C)c[nH+]1 ZINC000535061132 334361731 /nfs/dbraw/zinc/36/17/31/334361731.db2.gz VVAKHCUWNYSPRG-QGZVFWFLSA-N 1 2 311.429 4.029 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+]2CCc3cc(F)ccc3C2)o1 ZINC000535073451 334364933 /nfs/dbraw/zinc/36/49/33/334364933.db2.gz WAIUHVGASADNIQ-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+]2CCc3cc(F)ccc3C2)o1 ZINC000535073451 334364936 /nfs/dbraw/zinc/36/49/36/334364936.db2.gz WAIUHVGASADNIQ-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2ccc(OCC(C)C)cc2)cs1 ZINC000535085343 334366850 /nfs/dbraw/zinc/36/68/50/334366850.db2.gz HJVVOYFEQJYDDH-UHFFFAOYSA-N 1 2 318.486 4.372 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2ccc(OCC(C)C)cc2)cs1 ZINC000535085343 334366852 /nfs/dbraw/zinc/36/68/52/334366852.db2.gz HJVVOYFEQJYDDH-UHFFFAOYSA-N 1 2 318.486 4.372 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NC(=O)[C@H]2CCCC(C)(C)C2)c1 ZINC000535126399 334371320 /nfs/dbraw/zinc/37/13/20/334371320.db2.gz UUVKWWLGGIHING-HNNXBMFYSA-N 1 2 311.429 4.242 20 0 DIADLO COc1cc(C)[nH+]c(CS[C@H](C)c2ccccc2OC)c1 ZINC000535255999 334383582 /nfs/dbraw/zinc/38/35/82/334383582.db2.gz YOZIIKCFPXZZDR-CYBMUJFWSA-N 1 2 303.427 4.402 20 0 DIADLO COc1cc(C)[nH+]c(CS[C@@H](C)c2ccccc2OC)c1 ZINC000535256006 334383646 /nfs/dbraw/zinc/38/36/46/334383646.db2.gz YOZIIKCFPXZZDR-ZDUSSCGKSA-N 1 2 303.427 4.402 20 0 DIADLO CSc1ccc(C)c(C(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)c1 ZINC000340948566 334396023 /nfs/dbraw/zinc/39/60/23/334396023.db2.gz COEJTAGBLRGKDS-UHFFFAOYSA-N 1 2 311.410 4.154 20 0 DIADLO CSc1ccc(C)c(C(=O)Nc2ccc3[nH+]c(C)[nH]c3c2)c1 ZINC000340948566 334396024 /nfs/dbraw/zinc/39/60/24/334396024.db2.gz COEJTAGBLRGKDS-UHFFFAOYSA-N 1 2 311.410 4.154 20 0 DIADLO O=C(C[C@H]1C[C@H]1c1ccccc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000340951092 334396088 /nfs/dbraw/zinc/39/60/88/334396088.db2.gz JRYUGAPVMBQOCI-APWZRJJASA-N 1 2 317.392 4.005 20 0 DIADLO Brc1cnc(C[N@@H+]2CCC[C@H]2c2ccccc2)s1 ZINC000340905530 334396564 /nfs/dbraw/zinc/39/65/64/334396564.db2.gz CDVPJJDTKCJODU-LBPRGKRZSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cnc(C[N@H+]2CCC[C@H]2c2ccccc2)s1 ZINC000340905530 334396566 /nfs/dbraw/zinc/39/65/66/334396566.db2.gz CDVPJJDTKCJODU-LBPRGKRZSA-N 1 2 323.259 4.243 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)o1 ZINC000341070656 334407521 /nfs/dbraw/zinc/40/75/21/334407521.db2.gz QIGISSHUCQETPH-UWVGGRQHSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cccc4ccc(C)nc43)cn2c1 ZINC000341266321 334426927 /nfs/dbraw/zinc/42/69/27/334426927.db2.gz WOIGPAPMLXJEES-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nccc(C)n1)c1cccc(C(F)(F)F)c1 ZINC000341643587 334468016 /nfs/dbraw/zinc/46/80/16/334468016.db2.gz VYVDYAYPYLPCII-OAHLLOKOSA-N 1 2 323.362 4.435 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1ccc(F)cc1F ZINC000341849216 334487394 /nfs/dbraw/zinc/48/73/94/334487394.db2.gz XWCMXTKUKXXXGN-CQSZACIVSA-N 1 2 320.314 4.486 20 0 DIADLO Cc1ccccc1[C@H](C)N(C)C(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000342335061 334533392 /nfs/dbraw/zinc/53/33/92/334533392.db2.gz NKRAVTQEFPDCOB-INIZCTEOSA-N 1 2 319.408 4.014 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2cccnc2s1)c1c(F)cccc1Cl ZINC000342341423 334533730 /nfs/dbraw/zinc/53/37/30/334533730.db2.gz QLFXMTUQVAVHQQ-SECBINFHSA-N 1 2 321.808 4.335 20 0 DIADLO C[C@@H](Nc1cc[nH+]c2ccncc12)c1cc2ccccc2s1 ZINC000443500273 338452966 /nfs/dbraw/zinc/45/29/66/338452966.db2.gz LXHPBOPFXURYQY-GFCCVEGCSA-N 1 2 305.406 4.440 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@H](c2cccs2)C2CC2)n1 ZINC000342516754 334548796 /nfs/dbraw/zinc/54/87/96/334548796.db2.gz XBIVKVCSCMJOLT-HZMBPMFUSA-N 1 2 323.487 4.186 20 0 DIADLO Cc1c[nH+]c(CN([C@@H](C)c2ccccc2Cl)C2CC2)n1C ZINC000342799884 334572884 /nfs/dbraw/zinc/57/28/84/334572884.db2.gz PFSVFYSBKJPSTG-ZDUSSCGKSA-N 1 2 303.837 4.108 20 0 DIADLO Clc1cccc2c(N3CCC(OCC4CC4)CC3)cc[nH+]c12 ZINC000342818704 334580504 /nfs/dbraw/zinc/58/05/04/334580504.db2.gz YEYJJQCDYSFXLT-UHFFFAOYSA-N 1 2 316.832 4.284 20 0 DIADLO OC[C@H](Nc1cc[nH+]c2c(Cl)cccc12)c1ccsc1 ZINC000342880262 334585976 /nfs/dbraw/zinc/58/59/76/334585976.db2.gz FKDREVWIEUQFCP-AWEZNQCLSA-N 1 2 304.802 4.095 20 0 DIADLO Cc1nn(-c2ccccc2)cc1CNc1[nH+]ccc(C)c1Cl ZINC000342915288 334588397 /nfs/dbraw/zinc/58/83/97/334588397.db2.gz FAYHHHLJHNLANZ-UHFFFAOYSA-N 1 2 312.804 4.150 20 0 DIADLO Cn1ccc2ccc(N[C@@H](c3[nH]cc[nH+]3)c3ccc(F)cc3)cc21 ZINC000188020360 334607913 /nfs/dbraw/zinc/60/79/13/334607913.db2.gz RSQQFCVWMREESZ-GOSISDBHSA-N 1 2 320.371 4.242 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)C1(C(F)(F)F)CCCC1 ZINC000416152092 334652017 /nfs/dbraw/zinc/65/20/17/334652017.db2.gz UUXZOSYUVRIZQV-UHFFFAOYSA-N 1 2 323.318 4.138 20 0 DIADLO CC1(C)CCC[C@@H](c2noc(CCc3[nH]c4ccccc4[nH+]3)n2)C1 ZINC000535354790 334719821 /nfs/dbraw/zinc/71/98/21/334719821.db2.gz PEQJLVUBZXCWER-CYBMUJFWSA-N 1 2 324.428 4.415 20 0 DIADLO Fc1cccc(F)c1C[NH2+]Cc1sccc1Br ZINC000112838454 334728145 /nfs/dbraw/zinc/72/81/45/334728145.db2.gz IWPSHOMPNLVLHJ-UHFFFAOYSA-N 1 2 318.186 4.079 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Oc2cccc(F)c2)cc1)c1ccon1 ZINC000444004022 338466687 /nfs/dbraw/zinc/46/66/87/338466687.db2.gz PWMZFLGVRZEHEZ-ZDUSSCGKSA-N 1 2 312.344 4.457 20 0 DIADLO CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)Nc1ccc(C)[nH+]c1C ZINC000331336732 334854676 /nfs/dbraw/zinc/85/46/76/334854676.db2.gz YRTGVECEZVVLLF-MJEQTWJJSA-N 1 2 304.434 4.011 20 0 DIADLO C[C@@H](Nc1cc[nH+]c2ccncc12)c1c(F)cccc1Cl ZINC000444084223 338468050 /nfs/dbraw/zinc/46/80/50/338468050.db2.gz KTTXWCDWFVUOHP-SNVBAGLBSA-N 1 2 301.752 4.017 20 0 DIADLO CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000331292446 334855180 /nfs/dbraw/zinc/85/51/80/334855180.db2.gz QEFYMTUUKDPWKR-ZLIFDBKOSA-N 1 2 318.461 4.319 20 0 DIADLO COc1cnccc1[C@@H](C)[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000188774550 334872311 /nfs/dbraw/zinc/87/23/11/334872311.db2.gz YWECIZPMRKAMNS-VXGBXAGGSA-N 1 2 305.447 4.082 20 0 DIADLO Cc1cccn2c(CNc3cccc(C(C)(F)F)c3)c[nH+]c12 ZINC000189545400 334900007 /nfs/dbraw/zinc/90/00/07/334900007.db2.gz ZKOVZRQSTRXARC-UHFFFAOYSA-N 1 2 301.340 4.367 20 0 DIADLO Cc1cccc(NC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c1C ZINC000426011774 334901063 /nfs/dbraw/zinc/90/10/63/334901063.db2.gz YKVSBWCSOQXJMP-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO CCn1ccnc1C[NH+]1CCC(F)(c2cccc(Cl)c2)CC1 ZINC000343653804 335185190 /nfs/dbraw/zinc/18/51/90/335185190.db2.gz FXUIWLXMWSIELH-UHFFFAOYSA-N 1 2 321.827 4.017 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)o1 ZINC000343853363 335197389 /nfs/dbraw/zinc/19/73/89/335197389.db2.gz HTJBOCCQOGWWGB-DTWKUNHWSA-N 1 2 304.337 4.475 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)o1 ZINC000343853359 335197435 /nfs/dbraw/zinc/19/74/35/335197435.db2.gz HTJBOCCQOGWWGB-BDAKNGLRSA-N 1 2 304.337 4.475 20 0 DIADLO COc1cncc(C[N@H+](C)Cc2cccc(Cl)c2Cl)c1 ZINC000343831334 335200213 /nfs/dbraw/zinc/20/02/13/335200213.db2.gz XBSNOASDWLVTRK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cncc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)c1 ZINC000343831334 335200215 /nfs/dbraw/zinc/20/02/15/335200215.db2.gz XBSNOASDWLVTRK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cncc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)c1 ZINC000343835687 335200708 /nfs/dbraw/zinc/20/07/08/335200708.db2.gz CZWVGGANOSFCJI-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cncc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)c1 ZINC000343835687 335200710 /nfs/dbraw/zinc/20/07/10/335200710.db2.gz CZWVGGANOSFCJI-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO Fc1cccc(-c2cnc(C[N@@H+]3CCCc4occc4C3)o2)c1 ZINC000344241211 335231517 /nfs/dbraw/zinc/23/15/17/335231517.db2.gz WNQWRJUKIYOOCR-UHFFFAOYSA-N 1 2 312.344 4.022 20 0 DIADLO Fc1cccc(-c2cnc(C[N@H+]3CCCc4occc4C3)o2)c1 ZINC000344241211 335231518 /nfs/dbraw/zinc/23/15/18/335231518.db2.gz WNQWRJUKIYOOCR-UHFFFAOYSA-N 1 2 312.344 4.022 20 0 DIADLO COCC[C@@H]([NH2+]Cc1ncc(C(C)C)s1)c1ccc(C)o1 ZINC000344319115 335240614 /nfs/dbraw/zinc/24/06/14/335240614.db2.gz BGTVMUZWTNNVTH-CYBMUJFWSA-N 1 2 308.447 4.035 20 0 DIADLO CC(C)[C@H](N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1)C(F)(F)F ZINC000345162091 335302614 /nfs/dbraw/zinc/30/26/14/335302614.db2.gz KBOYSHWBCDRSPP-DOMZBBRYSA-N 1 2 311.351 4.110 20 0 DIADLO C[C@H]([NH2+]Cc1nccn1CC(F)(F)F)c1csc(Cl)c1 ZINC000345311388 335316042 /nfs/dbraw/zinc/31/60/42/335316042.db2.gz LEFOZTGXYHCAAA-QMMMGPOBSA-N 1 2 323.771 4.011 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cccc(Cl)c1)c1nc(C2CC2)no1 ZINC000113357165 335325689 /nfs/dbraw/zinc/32/56/89/335325689.db2.gz KQJPUMBVAYMBDF-AWEZNQCLSA-N 1 2 305.809 4.087 20 0 DIADLO CC(C)c1cnc(C[N@H+](C)C[C@H]2OCCc3ccccc32)s1 ZINC000346148321 335381962 /nfs/dbraw/zinc/38/19/62/335381962.db2.gz KJMYGKFVGKKJJP-MRXNPFEDSA-N 1 2 316.470 4.012 20 0 DIADLO CC(C)c1cnc(C[N@@H+](C)C[C@H]2OCCc3ccccc32)s1 ZINC000346148321 335381964 /nfs/dbraw/zinc/38/19/64/335381964.db2.gz KJMYGKFVGKKJJP-MRXNPFEDSA-N 1 2 316.470 4.012 20 0 DIADLO CC(C)C[C@@H]1C[C@H](Nc2[nH+]ccc3ccc(F)cc32)CCO1 ZINC000346229189 335386352 /nfs/dbraw/zinc/38/63/52/335386352.db2.gz LSTSEAXAYMTBCW-HZPDHXFCSA-N 1 2 302.393 4.380 20 0 DIADLO Cc1ccc(-c2nnc(C[N@@H+](Cc3ccco3)C(C)C)o2)cc1 ZINC000346299740 335393765 /nfs/dbraw/zinc/39/37/65/335393765.db2.gz BGBIEUXNUBSRJX-UHFFFAOYSA-N 1 2 311.385 4.049 20 0 DIADLO CC(C)c1nc(N2CCC(OC3CCC(C)CC3)CC2)cc[nH+]1 ZINC000347126487 335468105 /nfs/dbraw/zinc/46/81/05/335468105.db2.gz KVPGXRQLGHXIDA-UHFFFAOYSA-N 1 2 317.477 4.164 20 0 DIADLO Cc1ccc(N[C@H]2CCc3c2cc(Br)cc3F)c[nH+]1 ZINC000347138367 335472779 /nfs/dbraw/zinc/47/27/79/335472779.db2.gz XPZNZRYWZJBDSF-HNNXBMFYSA-N 1 2 321.193 4.391 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1ccco1 ZINC000347272157 335485176 /nfs/dbraw/zinc/48/51/76/335485176.db2.gz QDMKGUAHOQFVSD-CQSZACIVSA-N 1 2 305.381 4.368 20 0 DIADLO Cc1cccc(C)c1Oc1ccccc1NCc1c[nH+]cn1C ZINC000347759104 335527459 /nfs/dbraw/zinc/52/74/59/335527459.db2.gz UHIKFXMQSZSHBT-UHFFFAOYSA-N 1 2 307.397 4.441 20 0 DIADLO Cc1cnc([C@H](C)CNc2[nH+]ccc3ccc(F)cc32)s1 ZINC000347869176 335535822 /nfs/dbraw/zinc/53/58/22/335535822.db2.gz BAKYDRTZIBFQBS-SNVBAGLBSA-N 1 2 301.390 4.354 20 0 DIADLO CC1(CC(=O)Nc2nc(C[NH+]3CCCCC3)cs2)CCCC1 ZINC000347947575 335541135 /nfs/dbraw/zinc/54/11/35/335541135.db2.gz FCXRYBXRMNSBSC-UHFFFAOYSA-N 1 2 321.490 4.038 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc4sccc4c3)ccc2[nH+]1 ZINC000348327486 335577732 /nfs/dbraw/zinc/57/77/32/335577732.db2.gz QWODLGDOITXSCM-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO Cc1cnc(C[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)s1 ZINC000348378348 335581813 /nfs/dbraw/zinc/58/18/13/335581813.db2.gz SUTNOHVQYLHUHL-GOSISDBHSA-N 1 2 309.438 4.034 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1ccc2sccc2c1 ZINC000348695581 335602863 /nfs/dbraw/zinc/60/28/63/335602863.db2.gz AKESJDKWRWBXNI-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO CCn1c[nH+]cc1CNc1cccc(OCc2ccccc2C)c1 ZINC000417838542 335643444 /nfs/dbraw/zinc/64/34/44/335643444.db2.gz QMPQBAKMNCPVLC-UHFFFAOYSA-N 1 2 321.424 4.403 20 0 DIADLO Clc1ccc(OCc2nc(C[NH+]3CCCCC3)cs2)cc1 ZINC000518861173 335654715 /nfs/dbraw/zinc/65/47/15/335654715.db2.gz UEKCPYFNHOOGGS-UHFFFAOYSA-N 1 2 322.861 4.361 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ncc(Cl)s1)c1nc2ccccc2[nH]1 ZINC000349609358 335684804 /nfs/dbraw/zinc/68/48/04/335684804.db2.gz JJWQTWHEMVVUMQ-AWEZNQCLSA-N 1 2 320.849 4.160 20 0 DIADLO CC[C@H]([NH2+]Cc1ncc(Cl)s1)c1cc(F)ccc1F ZINC000349648437 335688414 /nfs/dbraw/zinc/68/84/14/335688414.db2.gz ZRMLBRDEVDSDLA-NSHDSACASA-N 1 2 302.777 4.316 20 0 DIADLO Cc1c(NCc2[nH+]ccn2C(C)C)cnn1-c1cc(C)ccc1C ZINC000349768447 335698452 /nfs/dbraw/zinc/69/84/52/335698452.db2.gz QINBNTZSZPAXPQ-UHFFFAOYSA-N 1 2 323.444 4.187 20 0 DIADLO Cc1ccc(-c2cnc(C[NH2+][C@H](c3cccnc3)C3CC3)o2)cc1 ZINC000526083931 335722542 /nfs/dbraw/zinc/72/25/42/335722542.db2.gz SSJWYUAFOAZCEG-FQEVSTJZSA-N 1 2 319.408 4.286 20 0 DIADLO Cn1c2ccccc2[nH+]c1N[C@@H](c1ccccc1)c1ccccn1 ZINC000535689989 335730712 /nfs/dbraw/zinc/73/07/12/335730712.db2.gz OEILRPJOPNMAFY-IBGZPJMESA-N 1 2 314.392 4.170 20 0 DIADLO CC(C)(CCNC(=O)c1cccc(Oc2cc[nH+]cc2)c1)C1CC1 ZINC000583585540 335749003 /nfs/dbraw/zinc/74/90/03/335749003.db2.gz DKVKQSYNJMWCMW-UHFFFAOYSA-N 1 2 324.424 4.430 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC[C@@H]2CCc3ccccc32)c(C)[nH+]1 ZINC000520978309 335797987 /nfs/dbraw/zinc/79/79/87/335797987.db2.gz AQWVDRZSVMBTLY-KRWDZBQOSA-N 1 2 323.440 4.248 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NC(=O)C(C)(C)C2CCCC2)c1 ZINC000536080890 335818825 /nfs/dbraw/zinc/81/88/25/335818825.db2.gz GNFKSHONTGFRNT-UHFFFAOYSA-N 1 2 311.429 4.242 20 0 DIADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1cccc(Cl)c1F ZINC000532164762 335907813 /nfs/dbraw/zinc/90/78/13/335907813.db2.gz HLGWDMIESOILMX-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO Cc1ccc(NC(=O)N(C)[C@H]2CCCc3ccccc32)c(C)[nH+]1 ZINC000532287995 335928519 /nfs/dbraw/zinc/92/85/19/335928519.db2.gz HQQJGZDCOUVKMY-SFHVURJKSA-N 1 2 309.413 4.240 20 0 DIADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1cc(F)cc(Cl)c1 ZINC000532303016 335929013 /nfs/dbraw/zinc/92/90/13/335929013.db2.gz CPJXSCABYKJKMN-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO C[C@@H]1CCCC[C@H]1CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000520369644 335967887 /nfs/dbraw/zinc/96/78/87/335967887.db2.gz YYFHTDOVWDAHIV-KGLIPLIRSA-N 1 2 315.392 4.166 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[N@@H+]3CCCc4occc4C3)o2)cc1 ZINC000329613704 336010290 /nfs/dbraw/zinc/01/02/90/336010290.db2.gz CUDSEWQBODVQRH-CQSZACIVSA-N 1 2 323.396 4.147 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[N@H+]3CCCc4occc4C3)o2)cc1 ZINC000329613704 336010292 /nfs/dbraw/zinc/01/02/92/336010292.db2.gz CUDSEWQBODVQRH-CQSZACIVSA-N 1 2 323.396 4.147 20 0 DIADLO Cc1cccc(N(C)Cc2c[nH+]cn2Cc2ccccc2)c1C ZINC000445798763 338509933 /nfs/dbraw/zinc/50/99/33/338509933.db2.gz JYWMIQWSXSLIFZ-UHFFFAOYSA-N 1 2 305.425 4.185 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2cocn2)c2cccs2)cc1 ZINC000192287901 336027275 /nfs/dbraw/zinc/02/72/75/336027275.db2.gz BHKLQCYUMUTILG-HNNXBMFYSA-N 1 2 304.802 4.269 20 0 DIADLO Cc1ccc([C@@H]2CCN(C(=O)Nc3c(C)cc(C)[nH+]c3C)C2)cc1 ZINC000582224642 336027995 /nfs/dbraw/zinc/02/79/95/336027995.db2.gz UIXFRGQKEMASIB-GOSISDBHSA-N 1 2 323.440 4.337 20 0 DIADLO c1cn(Cc2ccc(NCc3cccc4ccccc43)nc2)c[nH+]1 ZINC000351550316 336042693 /nfs/dbraw/zinc/04/26/93/336042693.db2.gz JXEIEODMALNVPO-UHFFFAOYSA-N 1 2 314.392 4.092 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)no1 ZINC000351572199 336046063 /nfs/dbraw/zinc/04/60/63/336046063.db2.gz CHNYPRQCSBVMDK-NWDGAFQWSA-N 1 2 305.447 4.290 20 0 DIADLO CSCc1cnc(C[N@H+](CCC(F)(F)F)CC2CC2)s1 ZINC000351772962 336068111 /nfs/dbraw/zinc/06/81/11/336068111.db2.gz BLZLFARFVWPIAU-UHFFFAOYSA-N 1 2 324.437 4.171 20 0 DIADLO CSCc1cnc(C[N@@H+](CCC(F)(F)F)CC2CC2)s1 ZINC000351772962 336068113 /nfs/dbraw/zinc/06/81/13/336068113.db2.gz BLZLFARFVWPIAU-UHFFFAOYSA-N 1 2 324.437 4.171 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2[C@@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331405995 336135008 /nfs/dbraw/zinc/13/50/08/336135008.db2.gz OCZQKWFWINJASN-STQMWFEESA-N 1 2 303.406 4.167 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2[C@@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331405995 336135009 /nfs/dbraw/zinc/13/50/09/336135009.db2.gz OCZQKWFWINJASN-STQMWFEESA-N 1 2 303.406 4.167 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2nc(-c3ccccc3)c[nH]2)on1 ZINC000194339803 338515356 /nfs/dbraw/zinc/51/53/56/338515356.db2.gz BLQHFIXODNFSKY-UHFFFAOYSA-N 1 2 324.428 4.258 20 0 DIADLO CCC1(CNC(=O)N2CCCC[C@@H]2c2[nH]cc[nH+]2)CCCCC1 ZINC000331717037 336145428 /nfs/dbraw/zinc/14/54/28/336145428.db2.gz OYNAQEQXOIZZQP-OAHLLOKOSA-N 1 2 318.465 4.007 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@@H](C)c1c(F)cccc1F ZINC000351931935 336180689 /nfs/dbraw/zinc/18/06/89/336180689.db2.gz VTYGTGPOXQGULK-LBPRGKRZSA-N 1 2 319.355 4.202 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)Cc1cc(Cl)ccc1F ZINC000351937879 336181483 /nfs/dbraw/zinc/18/14/83/336181483.db2.gz SHOVGXGQJDQHAV-UHFFFAOYSA-N 1 2 321.783 4.155 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(C3CCCC3)n2)[C@@H]1[C@H]1CCCO1 ZINC000351960157 336183442 /nfs/dbraw/zinc/18/34/42/336183442.db2.gz UTAYSXOWEHTPRF-HZPDHXFCSA-N 1 2 320.502 4.190 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(C3CCCC3)n2)[C@@H]1[C@H]1CCCO1 ZINC000351960157 336183444 /nfs/dbraw/zinc/18/34/44/336183444.db2.gz UTAYSXOWEHTPRF-HZPDHXFCSA-N 1 2 320.502 4.190 20 0 DIADLO Fc1cccc(F)c1[C@H]1CC[N@H+](Cc2ncc(Cl)s2)C1 ZINC000351983989 336185875 /nfs/dbraw/zinc/18/58/75/336185875.db2.gz WATYNTHBWIZIPI-VIFPVBQESA-N 1 2 314.788 4.064 20 0 DIADLO Fc1cccc(F)c1[C@H]1CC[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000351983989 336185876 /nfs/dbraw/zinc/18/58/76/336185876.db2.gz WATYNTHBWIZIPI-VIFPVBQESA-N 1 2 314.788 4.064 20 0 DIADLO Clc1cnc(C[N@@H+]2CCCCC[C@@H]2c2ccncc2)s1 ZINC000351996619 336187073 /nfs/dbraw/zinc/18/70/73/336187073.db2.gz PYBYFFJNBSYURV-CYBMUJFWSA-N 1 2 307.850 4.309 20 0 DIADLO Clc1cnc(C[N@H+]2CCCCC[C@@H]2c2ccncc2)s1 ZINC000351996619 336187074 /nfs/dbraw/zinc/18/70/74/336187074.db2.gz PYBYFFJNBSYURV-CYBMUJFWSA-N 1 2 307.850 4.309 20 0 DIADLO C[N@H+](Cc1ncc(Cl)s1)Cc1ccccc1N1CCCC1 ZINC000352010268 336188697 /nfs/dbraw/zinc/18/86/97/336188697.db2.gz AOBVEBJYOMWMCV-UHFFFAOYSA-N 1 2 321.877 4.029 20 0 DIADLO C[N@@H+](Cc1ncc(Cl)s1)Cc1ccccc1N1CCCC1 ZINC000352010268 336188698 /nfs/dbraw/zinc/18/86/98/336188698.db2.gz AOBVEBJYOMWMCV-UHFFFAOYSA-N 1 2 321.877 4.029 20 0 DIADLO Fc1cccc(F)c1C1=CC[N@H+](Cc2ccncc2Cl)CC1 ZINC000352018689 336189494 /nfs/dbraw/zinc/18/94/94/336189494.db2.gz BDWUSMUNEFHHEK-UHFFFAOYSA-N 1 2 320.770 4.303 20 0 DIADLO Fc1cccc(F)c1C1=CC[N@@H+](Cc2ccncc2Cl)CC1 ZINC000352018689 336189495 /nfs/dbraw/zinc/18/94/95/336189495.db2.gz BDWUSMUNEFHHEK-UHFFFAOYSA-N 1 2 320.770 4.303 20 0 DIADLO Cc1cnc([C@H](C)[N@H+]2CC=C(c3c(F)cccc3F)CC2)o1 ZINC000352022854 336190019 /nfs/dbraw/zinc/19/00/19/336190019.db2.gz RMHPTGQVUDICID-LBPRGKRZSA-N 1 2 304.340 4.112 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+]2CC=C(c3c(F)cccc3F)CC2)o1 ZINC000352022854 336190020 /nfs/dbraw/zinc/19/00/20/336190020.db2.gz RMHPTGQVUDICID-LBPRGKRZSA-N 1 2 304.340 4.112 20 0 DIADLO c1c[nH]c([C@@H]([NH2+]Cc2cc3c(s2)CCCC3)c2ccccc2)n1 ZINC000526117242 336199425 /nfs/dbraw/zinc/19/94/25/336199425.db2.gz DFKNEUZLIVSWDX-SFHVURJKSA-N 1 2 323.465 4.229 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCSC[C@H]1c1nccs1 ZINC000352276211 336209545 /nfs/dbraw/zinc/20/95/45/336209545.db2.gz SMIDUUYUXKBGHK-ZDUSSCGKSA-N 1 2 322.524 4.155 20 0 DIADLO CSc1ccccc1C[N@H+]1CCSC[C@H]1c1nccs1 ZINC000352276211 336209546 /nfs/dbraw/zinc/20/95/46/336209546.db2.gz SMIDUUYUXKBGHK-ZDUSSCGKSA-N 1 2 322.524 4.155 20 0 DIADLO Cn1c2ccccc2nc1[C@H]1CCC[N@@H+]1Cc1ccc(Cl)o1 ZINC000352285566 336210141 /nfs/dbraw/zinc/21/01/41/336210141.db2.gz GUYKDLKVNCMSHZ-OAHLLOKOSA-N 1 2 315.804 4.157 20 0 DIADLO Cn1c2ccccc2nc1[C@H]1CCC[N@H+]1Cc1ccc(Cl)o1 ZINC000352285566 336210142 /nfs/dbraw/zinc/21/01/42/336210142.db2.gz GUYKDLKVNCMSHZ-OAHLLOKOSA-N 1 2 315.804 4.157 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)[C@H](C)[C@H](C)O1 ZINC000526121301 336213067 /nfs/dbraw/zinc/21/30/67/336213067.db2.gz JFKWKJXMDHWSQI-MCIONIFRSA-N 1 2 308.491 4.189 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)[C@H](C)[C@H](C)O1 ZINC000526121301 336213068 /nfs/dbraw/zinc/21/30/68/336213068.db2.gz JFKWKJXMDHWSQI-MCIONIFRSA-N 1 2 308.491 4.189 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+]3C[C@H](C)O[C@@H](C)[C@H]3C)n2)cc1 ZINC000352413889 336217028 /nfs/dbraw/zinc/21/70/28/336217028.db2.gz RERRPNQHJCCCSA-ZNMIVQPWSA-N 1 2 316.470 4.116 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+]3C[C@H](C)O[C@@H](C)[C@H]3C)n2)cc1 ZINC000352413889 336217029 /nfs/dbraw/zinc/21/70/29/336217029.db2.gz RERRPNQHJCCCSA-ZNMIVQPWSA-N 1 2 316.470 4.116 20 0 DIADLO Fc1c(Cl)cccc1C[N@@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000352441203 336218878 /nfs/dbraw/zinc/21/88/78/336218878.db2.gz UBJNWSNFBDYTCH-ZBFHGGJFSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1c(Cl)cccc1C[N@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000352441203 336218879 /nfs/dbraw/zinc/21/88/79/336218879.db2.gz UBJNWSNFBDYTCH-ZBFHGGJFSA-N 1 2 309.812 4.013 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1sccc1Cl ZINC000352442007 336219254 /nfs/dbraw/zinc/21/92/54/336219254.db2.gz IFRCIFQIEZLQCI-UHFFFAOYSA-N 1 2 303.774 4.044 20 0 DIADLO Cc1oc(C(C)C)cc1C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000352442489 336219338 /nfs/dbraw/zinc/21/93/38/336219338.db2.gz QZYIADGQSQAKAV-UHFFFAOYSA-N 1 2 309.369 4.354 20 0 DIADLO CC[C@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1ccccc1F ZINC000352555769 336224453 /nfs/dbraw/zinc/22/44/53/336224453.db2.gz RBTSAYGDCNXPNO-IBGZPJMESA-N 1 2 309.388 4.252 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)Cc2ccoc2)cc1Cl ZINC000352642162 336228290 /nfs/dbraw/zinc/22/82/90/336228290.db2.gz FQMIMHDSZMVGCR-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)Cc2ccoc2)cc1Cl ZINC000352642162 336228291 /nfs/dbraw/zinc/22/82/91/336228291.db2.gz FQMIMHDSZMVGCR-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO C[C@@H]1CCC[C@@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000352764190 336233712 /nfs/dbraw/zinc/23/37/12/336233712.db2.gz VFVWFDNDBIZHKJ-GDBMZVCRSA-N 1 2 310.397 4.182 20 0 DIADLO CCc1ccc(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)cn1 ZINC000352765822 336233760 /nfs/dbraw/zinc/23/37/60/336233760.db2.gz SQOZLCMOUXZVMX-UHFFFAOYSA-N 1 2 312.804 4.095 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1ccccc1Br ZINC000042268086 336238235 /nfs/dbraw/zinc/23/82/35/336238235.db2.gz OVODEVOWOFMXJB-UHFFFAOYSA-N 1 2 320.230 4.090 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1ccccc1Br ZINC000042268086 336238236 /nfs/dbraw/zinc/23/82/36/336238236.db2.gz OVODEVOWOFMXJB-UHFFFAOYSA-N 1 2 320.230 4.090 20 0 DIADLO CC(C)Cc1ccc(C[NH2+]Cc2nnc(C(C)(C)C)s2)cc1 ZINC000532330722 336241001 /nfs/dbraw/zinc/24/10/01/336241001.db2.gz GKIDPTCVSVGCAJ-UHFFFAOYSA-N 1 2 317.502 4.324 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C3CC3)no2)cc1 ZINC000103499721 336242069 /nfs/dbraw/zinc/24/20/69/336242069.db2.gz NNSUZHNSGTWDDB-NEPJUHHUSA-N 1 2 317.458 4.471 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C3CC3)no2)cc1 ZINC000103499724 336242104 /nfs/dbraw/zinc/24/21/04/336242104.db2.gz NNSUZHNSGTWDDB-RYUDHWBXSA-N 1 2 317.458 4.471 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc3ccccc3s2)C[C@@H](c2ccccc2)O1 ZINC000532483633 336251629 /nfs/dbraw/zinc/25/16/29/336251629.db2.gz ITYFIERCZQPVHK-PBHICJAKSA-N 1 2 324.449 4.258 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc3ccccc3s2)C[C@@H](c2ccccc2)O1 ZINC000532483633 336251630 /nfs/dbraw/zinc/25/16/30/336251630.db2.gz ITYFIERCZQPVHK-PBHICJAKSA-N 1 2 324.449 4.258 20 0 DIADLO COc1cccc2c(N[C@@H](C)c3ccc4n[nH]cc4c3)cc[nH+]c12 ZINC000580358784 336259297 /nfs/dbraw/zinc/25/92/97/336259297.db2.gz JMQWEKMSTXNEKM-LBPRGKRZSA-N 1 2 318.380 4.293 20 0 DIADLO C[N@H+](Cc1sccc1Br)Cc1ccc(F)cc1 ZINC000043501896 336263517 /nfs/dbraw/zinc/26/35/17/336263517.db2.gz SROZWWQDZYWVFP-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[N@@H+](Cc1sccc1Br)Cc1ccc(F)cc1 ZINC000043501896 336263518 /nfs/dbraw/zinc/26/35/18/336263518.db2.gz SROZWWQDZYWVFP-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(-c2ccccc2)o1)c1cccc(Cl)c1 ZINC000192847235 336268873 /nfs/dbraw/zinc/26/88/73/336268873.db2.gz PKOYLLGWFWVATC-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1cccc(-n2ccnc2SCc2cn3ccccc3[nH+]2)c1 ZINC000030868006 336276127 /nfs/dbraw/zinc/27/61/27/336276127.db2.gz MJMXOGKIXHTVJH-UHFFFAOYSA-N 1 2 320.421 4.121 20 0 DIADLO Nc1cc(CSc2ncc(C(F)(F)F)cc2Cl)cc[nH+]1 ZINC000193042776 336287375 /nfs/dbraw/zinc/28/73/75/336287375.db2.gz HYTKYJRVEXLAMS-UHFFFAOYSA-N 1 2 319.739 4.023 20 0 DIADLO Cc1cc(Nc2ccc(NC(=O)C3CC3)cc2)nc(C(C)C)[nH+]1 ZINC000301066949 336288112 /nfs/dbraw/zinc/28/81/12/336288112.db2.gz DEDHFACXTVRLFM-UHFFFAOYSA-N 1 2 310.401 4.001 20 0 DIADLO Cc1ccc([C@H](C)Nc2cc(C)[nH+]c(-c3cccnc3)n2)s1 ZINC000301076260 336288710 /nfs/dbraw/zinc/28/87/10/336288710.db2.gz IRHJTNZQPKLIES-ZDUSSCGKSA-N 1 2 310.426 4.390 20 0 DIADLO c1ccc2sc(NCc3cc[nH+]c(N4CCCCC4)c3)nc2c1 ZINC000301080566 336288923 /nfs/dbraw/zinc/28/89/23/336288923.db2.gz HPESIPDEGPTBPF-UHFFFAOYSA-N 1 2 324.453 4.294 20 0 DIADLO c1nn(-c2ccccc2)cc1CCNc1ccc2ccccc2[nH+]1 ZINC000301098673 336289881 /nfs/dbraw/zinc/28/98/81/336289881.db2.gz WTFMXAQIKGHDFA-UHFFFAOYSA-N 1 2 314.392 4.075 20 0 DIADLO Cc1ccc([C@@H](C)Nc2cc(C)[nH+]c(-c3cccnc3)n2)cc1 ZINC000301101973 336290141 /nfs/dbraw/zinc/29/01/41/336290141.db2.gz LDCDMTFPQCLOOZ-OAHLLOKOSA-N 1 2 304.397 4.329 20 0 DIADLO Cc1cc(N[C@@H](c2ccccc2)C2CC2)nc(-c2cccnc2)[nH+]1 ZINC000301124943 336291244 /nfs/dbraw/zinc/29/12/44/336291244.db2.gz PNJMZKLKZORCMP-IBGZPJMESA-N 1 2 316.408 4.410 20 0 DIADLO CCc1cc(NCc2ccccc2C)nc(-c2ccncc2)[nH+]1 ZINC000301170126 336293163 /nfs/dbraw/zinc/29/31/63/336293163.db2.gz JPSAGQPDKCWQLW-UHFFFAOYSA-N 1 2 304.397 4.022 20 0 DIADLO CCc1cc(N[C@H](C)c2ccccc2)nc(-c2ccncc2)[nH+]1 ZINC000301180437 336293571 /nfs/dbraw/zinc/29/35/71/336293571.db2.gz PEJRSHGHXWLJCJ-CQSZACIVSA-N 1 2 304.397 4.274 20 0 DIADLO CCc1cc(N[C@H]2C[C@@H]2c2ccccc2)nc(-c2ccncc2)[nH+]1 ZINC000301186094 336293802 /nfs/dbraw/zinc/29/38/02/336293802.db2.gz UWATVKWRXXOUGT-MSOLQXFVSA-N 1 2 316.408 4.069 20 0 DIADLO CCc1cc(NCc2ccc(F)c(C)c2)nc(-c2ccncc2)[nH+]1 ZINC000301188282 336294083 /nfs/dbraw/zinc/29/40/83/336294083.db2.gz WNWZLZQUPUZVJU-UHFFFAOYSA-N 1 2 322.387 4.161 20 0 DIADLO CCc1cc(NCc2ccc(C)c(F)c2)nc(-c2ccncc2)[nH+]1 ZINC000301189465 336294086 /nfs/dbraw/zinc/29/40/86/336294086.db2.gz XWNMMTCXQPACIV-UHFFFAOYSA-N 1 2 322.387 4.161 20 0 DIADLO CCc1cc(N[C@@H](C)Cc2cccs2)nc(-c2ccncc2)[nH+]1 ZINC000301190036 336294204 /nfs/dbraw/zinc/29/42/04/336294204.db2.gz YEVIRJKQIVSKJA-ZDUSSCGKSA-N 1 2 324.453 4.206 20 0 DIADLO Cc1cc(N[C@H]2c3ccccc3C[C@H]2C)nc(-c2cccnc2)[nH+]1 ZINC000301266788 336297745 /nfs/dbraw/zinc/29/77/45/336297745.db2.gz WQBMSIJABHNUTN-BFUOFWGJSA-N 1 2 316.408 4.192 20 0 DIADLO Cc1ccsc1CNc1nc(-c2ccncc2)[nH+]c(C)c1C ZINC000301270200 336297829 /nfs/dbraw/zinc/29/78/29/336297829.db2.gz NKIKDKPNMCOULF-UHFFFAOYSA-N 1 2 310.426 4.137 20 0 DIADLO Clc1ccccc1C[C@H]1CCCN1c1cc[nH+]c(C2CC2)n1 ZINC000301276421 336298251 /nfs/dbraw/zinc/29/82/51/336298251.db2.gz ZLEWEBLZNOAZIR-OAHLLOKOSA-N 1 2 313.832 4.219 20 0 DIADLO CCOc1ccc([C@H](Nc2cc(C)[nH+]cn2)c2ccccc2)cc1 ZINC000301281776 336298605 /nfs/dbraw/zinc/29/86/05/336298605.db2.gz QEKRTJUUPOUKNR-HXUWFJFHSA-N 1 2 319.408 4.385 20 0 DIADLO Cc1ccc(C)c(OC2CCN(c3cc[nH+]c(C4CC4)n3)CC2)c1 ZINC000301288027 336298933 /nfs/dbraw/zinc/29/89/33/336298933.db2.gz ZZJREMVHLNOZSX-UHFFFAOYSA-N 1 2 323.440 4.019 20 0 DIADLO CCc1cc(N2[C@H](C)C[C@@H]3CCCC[C@H]32)nc(-c2ccncc2)[nH+]1 ZINC000301350002 336301921 /nfs/dbraw/zinc/30/19/21/336301921.db2.gz JMXOMOGNTYPROB-UWWQBHOKSA-N 1 2 322.456 4.258 20 0 DIADLO Cc1cc(N[C@@H](COCc2ccccc2)c2ccccc2)nc[nH+]1 ZINC000301379766 336303556 /nfs/dbraw/zinc/30/35/56/336303556.db2.gz XVRRGPKXBOOIMF-IBGZPJMESA-N 1 2 319.408 4.155 20 0 DIADLO Fc1cccc(Cl)c1[C@H]1C[C@H]1Nc1cc[nH+]c(C2CC2)n1 ZINC000301380745 336303612 /nfs/dbraw/zinc/30/36/12/336303612.db2.gz YGHYDPHPLRTWRP-GXFFZTMASA-N 1 2 303.768 4.115 20 0 DIADLO Cc1ccc(C[C@@H](C)Nc2cc(C)[nH+]c(-c3cccnc3)n2)s1 ZINC000301384709 336303779 /nfs/dbraw/zinc/30/37/79/336303779.db2.gz VCTXSIKOZTWANX-GFCCVEGCSA-N 1 2 324.453 4.260 20 0 DIADLO Cc1cc(NC[C@@H]2CCO[C@H]2c2ccccc2)nc(C(C)C)[nH+]1 ZINC000301429759 336306275 /nfs/dbraw/zinc/30/62/75/336306275.db2.gz PZOLRFUYDGBLNW-WMZOPIPTSA-N 1 2 311.429 4.098 20 0 DIADLO COc1cccc(-c2ccc(CNc3cc(C)[nH+]cn3)cc2)c1 ZINC000301432016 336306441 /nfs/dbraw/zinc/30/64/41/336306441.db2.gz GECLNHAPWOKSNY-UHFFFAOYSA-N 1 2 305.381 4.073 20 0 DIADLO FC(F)(F)c1csc(CCNc2ccc3ccccc3[nH+]2)n1 ZINC000301443596 336307065 /nfs/dbraw/zinc/30/70/65/336307065.db2.gz NEKADSRUPBSECS-UHFFFAOYSA-N 1 2 323.343 4.365 20 0 DIADLO COc1cccc(F)c1[C@@H](C)Nc1cc(C)[nH+]c(C(C)C)n1 ZINC000301460892 336308254 /nfs/dbraw/zinc/30/82/54/336308254.db2.gz NYXOKLOACAFYNB-GFCCVEGCSA-N 1 2 303.381 4.229 20 0 DIADLO COc1ccc([C@@H](C)Nc2cc[nH+]c(C(C)(C)C)n2)cc1F ZINC000301500799 336310800 /nfs/dbraw/zinc/31/08/00/336310800.db2.gz DQKIQIYYCZVWTO-LLVKDONJSA-N 1 2 303.381 4.095 20 0 DIADLO CCC(CC)c1cc(CNc2cc[nH+]c(C(C)(C)C)n2)on1 ZINC000301502824 336310836 /nfs/dbraw/zinc/31/08/36/336310836.db2.gz BNVJKXVHQOGOKD-UHFFFAOYSA-N 1 2 302.422 4.278 20 0 DIADLO c1csc(N2CCC(Nc3ccc4ccccc4[nH+]3)CC2)c1 ZINC000301567779 336315423 /nfs/dbraw/zinc/31/54/23/336315423.db2.gz MZXIRZPPJZIZCB-UHFFFAOYSA-N 1 2 309.438 4.377 20 0 DIADLO Cc1cccc([C@@H]2CCCN2c2cc(N3CCCCC3)[nH+]cn2)c1 ZINC000301566778 336315484 /nfs/dbraw/zinc/31/54/84/336315484.db2.gz ZLTPITKKJFWPBB-SFHVURJKSA-N 1 2 322.456 4.117 20 0 DIADLO Cc1cccc([C@@H]2CCCN2c2cc(N3CCCCC3)nc[nH+]2)c1 ZINC000301566778 336315485 /nfs/dbraw/zinc/31/54/85/336315485.db2.gz ZLTPITKKJFWPBB-SFHVURJKSA-N 1 2 322.456 4.117 20 0 DIADLO Cc1cc(N2CCC[C@@H]2c2cccc(N(C)C)c2)nc(C(C)C)[nH+]1 ZINC000301567944 336315508 /nfs/dbraw/zinc/31/55/08/336315508.db2.gz WXBTVOXDUXGEDN-GOSISDBHSA-N 1 2 324.472 4.316 20 0 DIADLO COc1ccccc1[C@@H]1CCCN1c1cc(C)[nH+]c(C(C)C)n1 ZINC000301573776 336315857 /nfs/dbraw/zinc/31/58/57/336315857.db2.gz YZVCTHHXKJVVRW-INIZCTEOSA-N 1 2 311.429 4.259 20 0 DIADLO COc1ccccc1[C@H]1CCCN1c1cc(C)[nH+]c(C(C)C)n1 ZINC000301573778 336315902 /nfs/dbraw/zinc/31/59/02/336315902.db2.gz YZVCTHHXKJVVRW-MRXNPFEDSA-N 1 2 311.429 4.259 20 0 DIADLO COc1ccc([C@@H]2CCCN2c2nc(C)[nH+]c3c2CCCC3)cc1 ZINC000301592469 336317050 /nfs/dbraw/zinc/31/70/50/336317050.db2.gz YOPQUANNIOIAJT-IBGZPJMESA-N 1 2 323.440 4.014 20 0 DIADLO COc1cccc(F)c1[C@@H](C)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000301607377 336317990 /nfs/dbraw/zinc/31/79/90/336317990.db2.gz ZEPBJSUVLHPMPT-LLVKDONJSA-N 1 2 303.381 4.095 20 0 DIADLO Clc1cc(NCc2ccc(N3CCCCCC3)[nH+]c2)ccn1 ZINC000301632693 336319475 /nfs/dbraw/zinc/31/94/75/336319475.db2.gz UNZOQVAETDJYEY-UHFFFAOYSA-N 1 2 316.836 4.123 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NC[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)c1 ZINC000301710209 336324861 /nfs/dbraw/zinc/32/48/61/336324861.db2.gz USGLHMPYRVEQRL-LZWOXQAQSA-N 1 2 304.315 4.098 20 0 DIADLO Cc1cc2ccccc2nc1NCCCCNc1cccc[nH+]1 ZINC000301729856 336326049 /nfs/dbraw/zinc/32/60/49/336326049.db2.gz RWPUJEICACOVCA-UHFFFAOYSA-N 1 2 306.413 4.242 20 0 DIADLO Cc1cc(N[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c2cccc(F)c2[nH+]1 ZINC000301795962 336330504 /nfs/dbraw/zinc/33/05/04/336330504.db2.gz ACIZFMJWYQHCBL-XWIAVFTESA-N 1 2 312.388 4.052 20 0 DIADLO Cc1nc(CCNc2cc(C(C)C)[nH+]c(C(C)C)n2)cs1 ZINC000301834798 336333080 /nfs/dbraw/zinc/33/30/80/336333080.db2.gz WBHWOVMFWZJBFG-UHFFFAOYSA-N 1 2 304.463 4.143 20 0 DIADLO CC(C)c1cc(N[C@@H](C)C[C@@H](O)c2ccco2)nc(C(C)C)[nH+]1 ZINC000301846551 336333736 /nfs/dbraw/zinc/33/37/36/336333736.db2.gz BADGXVDYBFUJSD-DZGCQCFKSA-N 1 2 317.433 4.241 20 0 DIADLO Cc1nc(N[C@@H](c2cccc(F)c2)c2ccccn2)c(C)c(C)[nH+]1 ZINC000301858606 336334619 /nfs/dbraw/zinc/33/46/19/336334619.db2.gz CVCWWXATQJSSRJ-SFHVURJKSA-N 1 2 322.387 4.137 20 0 DIADLO Cc1nc(N[C@H](c2cccc(F)c2)c2ccccn2)c(C)c(C)[nH+]1 ZINC000301858605 336334696 /nfs/dbraw/zinc/33/46/96/336334696.db2.gz CVCWWXATQJSSRJ-GOSISDBHSA-N 1 2 322.387 4.137 20 0 DIADLO Cc1cc(N2CCc3ccccc3[C@H]2Cc2ccccc2)nc[nH+]1 ZINC000301881486 336335888 /nfs/dbraw/zinc/33/58/88/336335888.db2.gz WDUKUTLIJUSCNR-HXUWFJFHSA-N 1 2 315.420 4.132 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccc(F)cc2OC(C)C)c(C)[nH+]1 ZINC000352886891 336337206 /nfs/dbraw/zinc/33/72/06/336337206.db2.gz XNRHBCCZUHFXOZ-UHFFFAOYSA-N 1 2 317.364 4.269 20 0 DIADLO Cc1cccc([C@@H](Nc2nc(C)[nH+]c(C)c2C)c2ccccn2)c1 ZINC000301901156 336337314 /nfs/dbraw/zinc/33/73/14/336337314.db2.gz VLLBFOLIANRCLV-LJQANCHMSA-N 1 2 318.424 4.307 20 0 DIADLO c1ccc(Nc2ccc(Nc3nc(C4CC4)ns3)c[nH+]2)cc1 ZINC000301959433 336340096 /nfs/dbraw/zinc/34/00/96/336340096.db2.gz PILYUHQLKFFLLO-UHFFFAOYSA-N 1 2 309.398 4.298 20 0 DIADLO CCc1cc(Nc2cccc(COCc3ccco3)c2)nc(C)[nH+]1 ZINC000302047548 336345400 /nfs/dbraw/zinc/34/54/00/336345400.db2.gz LPBGLHUJVPXCHU-UHFFFAOYSA-N 1 2 323.396 4.401 20 0 DIADLO Fc1cc(Br)cc([C@H]2CCCN2c2cccc[nH+]2)c1 ZINC000302233868 336355500 /nfs/dbraw/zinc/35/55/00/336355500.db2.gz ZRVSRVQBIZTNLT-CQSZACIVSA-N 1 2 321.193 4.325 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@H+](Cc2cc3ccccc3o2)CCO1 ZINC000514106178 336360974 /nfs/dbraw/zinc/36/09/74/336360974.db2.gz WSDSLXHMUCFTHH-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@@H+](Cc2cc3ccccc3o2)CCO1 ZINC000514106178 336360975 /nfs/dbraw/zinc/36/09/75/336360975.db2.gz WSDSLXHMUCFTHH-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO COc1cccc2c(NC[C@@H](C)c3nc(C)cs3)cc[nH+]c12 ZINC000302548438 336361298 /nfs/dbraw/zinc/36/12/98/336361298.db2.gz POZPMEIVIRIQOO-LLVKDONJSA-N 1 2 313.426 4.224 20 0 DIADLO Cc1cc(NCc2ccc(C3CC3)cc2)nc(-c2ccncc2)[nH+]1 ZINC000302736080 336367190 /nfs/dbraw/zinc/36/71/90/336367190.db2.gz WQYNRHCELASGMK-UHFFFAOYSA-N 1 2 316.408 4.337 20 0 DIADLO Clc1ccc(N2CC[C@@H](Nc3cccc[nH+]3)C2)c(Cl)c1 ZINC000302752072 336367800 /nfs/dbraw/zinc/36/78/00/336367800.db2.gz HOFROMKXFCVZEQ-GFCCVEGCSA-N 1 2 308.212 4.079 20 0 DIADLO Cc1cc(N2CCC(c3ccncc3)CC2)c2cccc(F)c2[nH+]1 ZINC000302780595 336368750 /nfs/dbraw/zinc/36/87/50/336368750.db2.gz ISZNFLQTKRWPGG-UHFFFAOYSA-N 1 2 321.399 4.461 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NC[C@@H](c1ccnn1C)C(C)C ZINC000302782456 336368942 /nfs/dbraw/zinc/36/89/42/336368942.db2.gz SQDSSQHXDUJHCC-MRXNPFEDSA-N 1 2 308.429 4.128 20 0 DIADLO CC(C)c1nc(NCc2cn3ccccc3n2)cc(C(C)(C)C)[nH+]1 ZINC000302802670 336369861 /nfs/dbraw/zinc/36/98/61/336369861.db2.gz UVAWUCLQSZVAHF-UHFFFAOYSA-N 1 2 323.444 4.157 20 0 DIADLO CC(C)c1nc(N[C@@H](CCO)c2ccco2)cc(C(C)(C)C)[nH+]1 ZINC000302823984 336370609 /nfs/dbraw/zinc/37/06/09/336370609.db2.gz FYYYYLXRWWLJJQ-ZDUSSCGKSA-N 1 2 317.433 4.026 20 0 DIADLO CC(C)c1nc(NCc2nccn2C(F)F)cc(C(C)(C)C)[nH+]1 ZINC000302877057 336372889 /nfs/dbraw/zinc/37/28/89/336372889.db2.gz FVGFVIMZXMZPNF-UHFFFAOYSA-N 1 2 323.391 4.101 20 0 DIADLO Cc1noc(C)c1CCNc1cc(C(C)(C)C)[nH+]c(C(C)C)n1 ZINC000302885309 336373209 /nfs/dbraw/zinc/37/32/09/336373209.db2.gz KRIFAHMHTNOJSZ-UHFFFAOYSA-N 1 2 316.449 4.157 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)s1 ZINC000352947186 336378812 /nfs/dbraw/zinc/37/88/12/336378812.db2.gz OXRKORWMDYQZBJ-MWLCHTKSSA-N 1 2 324.437 4.169 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)s1 ZINC000352947186 336378813 /nfs/dbraw/zinc/37/88/13/336378813.db2.gz OXRKORWMDYQZBJ-MWLCHTKSSA-N 1 2 324.437 4.169 20 0 DIADLO CC[C@H](Nc1cc(OC)c(C(C)C)c(OC)c1)c1[nH+]ccn1C ZINC000352972154 336380560 /nfs/dbraw/zinc/38/05/60/336380560.db2.gz WNXBEKNJLNINLO-AWEZNQCLSA-N 1 2 317.433 4.124 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)c(C)n1C ZINC000353046273 336390711 /nfs/dbraw/zinc/39/07/11/336390711.db2.gz SUBWDZBQFBCVDU-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO CC[N@H+](Cc1cc(C(C)(C)C)on1)Cc1ccc(OC)cc1 ZINC000582245452 336392689 /nfs/dbraw/zinc/39/26/89/336392689.db2.gz LGARJTWMAFIBHB-UHFFFAOYSA-N 1 2 302.418 4.003 20 0 DIADLO CC[N@@H+](Cc1cc(C(C)(C)C)on1)Cc1ccc(OC)cc1 ZINC000582245452 336392690 /nfs/dbraw/zinc/39/26/90/336392690.db2.gz LGARJTWMAFIBHB-UHFFFAOYSA-N 1 2 302.418 4.003 20 0 DIADLO Cc1[nH]c(CN[C@H](c2ccccc2F)C2CCCC2)[nH+]c1C ZINC000582252637 336395248 /nfs/dbraw/zinc/39/52/48/336395248.db2.gz NEKPOCIMBIMRJY-SFHVURJKSA-N 1 2 301.409 4.187 20 0 DIADLO COc1ccc2cc(CNc3cc[nH+]c(C4CC4)n3)ccc2c1 ZINC000110125724 336395828 /nfs/dbraw/zinc/39/58/28/336395828.db2.gz XUPBIWRLXYYUJJ-UHFFFAOYSA-N 1 2 305.381 4.128 20 0 DIADLO Cc1nc(-c2ccccc2)sc1CNc1cc[nH+]c(C2CC2)n1 ZINC000110513276 336396912 /nfs/dbraw/zinc/39/69/12/336396912.db2.gz WQBXPWRZXTXTFV-UHFFFAOYSA-N 1 2 322.437 4.398 20 0 DIADLO CC1CCN(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000112211533 336399407 /nfs/dbraw/zinc/39/94/07/336399407.db2.gz GHAREPYYPQDQGO-UHFFFAOYSA-N 1 2 311.385 4.138 20 0 DIADLO CC(C)[C@H](Nc1cc[nH+]c(C2CC2)n1)c1nc2ccccc2[nH]1 ZINC000112963878 336399869 /nfs/dbraw/zinc/39/98/69/336399869.db2.gz DPUIXGORRQVXAG-INIZCTEOSA-N 1 2 307.401 4.040 20 0 DIADLO Cc1ccc(C(C)(C)[NH2+]Cc2csc(C(C)(C)C)n2)cn1 ZINC000353163586 336405183 /nfs/dbraw/zinc/40/51/83/336405183.db2.gz CHPAIQIPVUYECS-UHFFFAOYSA-N 1 2 303.475 4.169 20 0 DIADLO FC(F)(C[NH2+]Cc1c[nH]nc1-c1ccsc1)c1ccccc1 ZINC000353239651 336407893 /nfs/dbraw/zinc/40/78/93/336407893.db2.gz HVSBIWVGMQVAEA-UHFFFAOYSA-N 1 2 319.380 4.020 20 0 DIADLO c1cn(Cc2ccc(N[C@@H]3CCCCC34CCCC4)nc2)c[nH+]1 ZINC000353502751 336421240 /nfs/dbraw/zinc/42/12/40/336421240.db2.gz GVCCLFYJSISDSH-QGZVFWFLSA-N 1 2 310.445 4.241 20 0 DIADLO CCOCc1nc([C@@H](C)[NH2+][C@@H](CC)c2ccc(Cl)cc2)no1 ZINC000353608208 336428365 /nfs/dbraw/zinc/42/83/65/336428365.db2.gz HWBJIJYSXWUOEX-RISCZKNCSA-N 1 2 323.824 4.061 20 0 DIADLO O=C(c1ccc(C2=CCCC2)cc1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000353774019 336439948 /nfs/dbraw/zinc/43/99/48/336439948.db2.gz PHLMAUACNGACTK-SFHVURJKSA-N 1 2 321.424 4.344 20 0 DIADLO O=C(c1ccc(C2CCCC2)cc1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000353773557 336439957 /nfs/dbraw/zinc/43/99/57/336439957.db2.gz OUKOBTPSXIZECC-SFHVURJKSA-N 1 2 323.440 4.435 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)[C@@H]1Cc2ccccc21 ZINC000353779924 336440249 /nfs/dbraw/zinc/44/02/49/336440249.db2.gz RIADQBPBQOAPST-LJQANCHMSA-N 1 2 316.360 4.152 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)[C@H]1CC12CCCC2 ZINC000353820358 336442416 /nfs/dbraw/zinc/44/24/16/336442416.db2.gz YLIRQCLHINUSCQ-CYBMUJFWSA-N 1 2 315.804 4.045 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1ccc(F)cc1Cl ZINC000353880010 336445490 /nfs/dbraw/zinc/44/54/90/336445490.db2.gz IDORXMMYVVHVMO-ZUZCIYMTSA-N 1 2 307.800 4.015 20 0 DIADLO CCCOc1cccc2c(NCCc3ccncc3)cc[nH+]c12 ZINC000354156449 336461803 /nfs/dbraw/zinc/46/18/03/336461803.db2.gz ZNWGULNJKOJMKT-UHFFFAOYSA-N 1 2 307.397 4.073 20 0 DIADLO C[C@H](Nc1[nH+]ccc2ccc(F)cc21)c1nc2ccccc2[nH]1 ZINC000354340719 336467376 /nfs/dbraw/zinc/46/73/76/336467376.db2.gz QCCVFINMLDLDGO-NSHDSACASA-N 1 2 306.344 4.423 20 0 DIADLO OCCC1(CNc2[nH+]ccc3ccc(F)cc32)CCCCC1 ZINC000354537290 336473913 /nfs/dbraw/zinc/47/39/13/336473913.db2.gz JUEDXEGTYRBWDA-UHFFFAOYSA-N 1 2 302.393 4.119 20 0 DIADLO CC(C)n1cc2c(n1)C[C@H](Nc1[nH+]ccc3ccc(F)cc31)CC2 ZINC000354874935 336485852 /nfs/dbraw/zinc/48/58/52/336485852.db2.gz IHBPQXOAIXJXGL-MRXNPFEDSA-N 1 2 324.403 4.121 20 0 DIADLO CC(C)(CC(=O)N1CCC(c2[nH]cc[nH+]2)CC1)C1CCCCC1 ZINC000355437282 336509146 /nfs/dbraw/zinc/50/91/46/336509146.db2.gz BVVNKUXBTAMBPZ-UHFFFAOYSA-N 1 2 317.477 4.112 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]Cc2ccc(Cl)c(C)c2)cs1 ZINC000355672050 336518731 /nfs/dbraw/zinc/51/87/31/336518731.db2.gz MMICIFVAEGUBCS-NSHDSACASA-N 1 2 310.850 4.102 20 0 DIADLO Cc1ccc(Cc2noc(/C=C\c3ccc([C@@H]4C[C@@H]4C)o3)n2)c[nH+]1 ZINC000356155046 336538616 /nfs/dbraw/zinc/53/86/16/336538616.db2.gz VGODLVHJBCNMRN-YTCBSGDJSA-N 1 2 321.380 4.251 20 0 DIADLO COCCSc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncc(C)o2)cc1 ZINC000356273041 336543706 /nfs/dbraw/zinc/54/37/06/336543706.db2.gz QSHATBCDMGWLGT-KGLIPLIRSA-N 1 2 320.458 4.133 20 0 DIADLO Cc1nc(N2CCC(c3[nH]c4ccccc4[nH+]3)CC2)sc1C ZINC000357659747 336593565 /nfs/dbraw/zinc/59/35/65/336593565.db2.gz JUKWHVNXCXYHIG-UHFFFAOYSA-N 1 2 312.442 4.020 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](c2ccc(F)cc2)[C@H]2CCCO2)cs1 ZINC000358014054 336606094 /nfs/dbraw/zinc/60/60/94/336606094.db2.gz BJWLQFLJRUHATO-YMRXKLBXSA-N 1 2 320.433 4.162 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2cc(F)c(F)c(F)c2)cs1 ZINC000358092192 336611225 /nfs/dbraw/zinc/61/12/25/336611225.db2.gz YBQPFBDZNRGOFG-HTQZYQBOSA-N 1 2 300.349 4.281 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[S@@](=O)Cc1ccc(C)[nH+]c1C ZINC000358116187 336612120 /nfs/dbraw/zinc/61/21/20/336612120.db2.gz GJROKLUOBQQIDK-JTSKRJEESA-N 1 2 323.408 4.377 20 0 DIADLO Clc1cc(-c2nc(C3CC3)no2)ccc1Oc1cc[nH+]cc1 ZINC000114629431 336626721 /nfs/dbraw/zinc/62/67/21/336626721.db2.gz BYJYPJLEXGNLAY-UHFFFAOYSA-N 1 2 313.744 4.455 20 0 DIADLO Cc1nnc(C[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)s1 ZINC000359254146 336664616 /nfs/dbraw/zinc/66/46/16/336664616.db2.gz ZKBPRMPCNFQXSQ-AWEZNQCLSA-N 1 2 313.829 4.126 20 0 DIADLO COCc1c2ccccc2oc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000359413564 336671777 /nfs/dbraw/zinc/67/17/77/336671777.db2.gz KWNVZCMVEGPFSG-UHFFFAOYSA-N 1 2 324.380 4.152 20 0 DIADLO Cc1ccnc(C[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)n1 ZINC000359652610 336681826 /nfs/dbraw/zinc/68/18/26/336681826.db2.gz UHEUQZQFKVYJDT-INIZCTEOSA-N 1 2 307.800 4.064 20 0 DIADLO CC[C@H](C)n1ncc(NCc2c[nH+]c3ccc(Cl)cn23)c1C ZINC000359802054 336687999 /nfs/dbraw/zinc/68/79/99/336687999.db2.gz OEITXNHDKNJGIC-NSHDSACASA-N 1 2 317.824 4.076 20 0 DIADLO C/C=C/c1ccc(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000360320858 336708132 /nfs/dbraw/zinc/70/81/32/336708132.db2.gz WTHXULPHFDDAMB-NSCUHMNNSA-N 1 2 303.365 4.158 20 0 DIADLO Cc1nc(N(Cc2ccccc2)Cc2ccccc2F)cc[nH+]1 ZINC000360976498 336730540 /nfs/dbraw/zinc/73/05/40/336730540.db2.gz VLPILRBQJYKDMR-UHFFFAOYSA-N 1 2 307.372 4.131 20 0 DIADLO Cc1[nH+]cn(-c2ccc(NC/C=C/c3ccncc3)cc2)c1C ZINC000361227040 336745271 /nfs/dbraw/zinc/74/52/71/336745271.db2.gz DIHJSRIWZCASAZ-ONEGZZNKSA-N 1 2 304.397 4.009 20 0 DIADLO CC(C)c1cccc2c1OCCC[C@H]2[NH2+]Cc1cscn1 ZINC000361292393 336748954 /nfs/dbraw/zinc/74/89/54/336748954.db2.gz DFQRTVOPIASJMX-MRXNPFEDSA-N 1 2 302.443 4.270 20 0 DIADLO Cn1ccc(C[NH2+][C@@H](c2ccsc2)c2ccc(Cl)cc2)n1 ZINC000361567457 336762933 /nfs/dbraw/zinc/76/29/33/336762933.db2.gz AHZXLTFGVCRVBW-MRXNPFEDSA-N 1 2 317.845 4.014 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cccc2ccsc21 ZINC000362232101 336788813 /nfs/dbraw/zinc/78/88/13/336788813.db2.gz ZANRUEHJPKWWQD-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO Fc1ccc2cc(CNc3cccc(-n4cc[nH+]c4)c3)[nH]c2c1 ZINC000362926267 336814999 /nfs/dbraw/zinc/81/49/99/336814999.db2.gz YJEVONVEFYNGJS-UHFFFAOYSA-N 1 2 306.344 4.105 20 0 DIADLO CC[C@H]1CCCN(C(=O)c2ccc(C)c(Oc3cc[nH+]cc3)c2)C1 ZINC000115331517 336823967 /nfs/dbraw/zinc/82/39/67/336823967.db2.gz AABOZVJXTRJDCJ-INIZCTEOSA-N 1 2 324.424 4.445 20 0 DIADLO Cc1nc([C@H](C)[NH+]2CCC(F)(c3cccc(Cl)c3)CC2)no1 ZINC000367658061 336827546 /nfs/dbraw/zinc/82/75/46/336827546.db2.gz MNHWCZQWKURBRV-NSHDSACASA-N 1 2 323.799 4.053 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@@H](C)c2nccn2-c2ccccc2)n1 ZINC000367855490 336831080 /nfs/dbraw/zinc/83/10/80/336831080.db2.gz HVZGBSOHTZUUOP-KBPBESRZSA-N 1 2 312.442 4.049 20 0 DIADLO CCc1nc(C[NH+]2CCC(Oc3ccc(C)cc3)CC2)cs1 ZINC000116883832 336847781 /nfs/dbraw/zinc/84/77/81/336847781.db2.gz INZHRKUSNSWHFJ-UHFFFAOYSA-N 1 2 316.470 4.057 20 0 DIADLO Cc1csc(C[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)n1 ZINC000117385621 336854608 /nfs/dbraw/zinc/85/46/08/336854608.db2.gz ZSRFAULZTHNGMT-GFCCVEGCSA-N 1 2 315.467 4.426 20 0 DIADLO CC(C)(CC(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1)C1CCCCC1 ZINC000370043334 336876377 /nfs/dbraw/zinc/87/63/77/336876377.db2.gz QJVBJCJQIBKVQV-HNNXBMFYSA-N 1 2 317.477 4.112 20 0 DIADLO CCOc1cccc(C(=O)Nc2ccccc2-c2[nH]cc(C)[nH+]2)c1 ZINC000371247977 336898444 /nfs/dbraw/zinc/89/84/44/336898444.db2.gz SIIRDELKECDJOR-UHFFFAOYSA-N 1 2 321.380 4.036 20 0 DIADLO CCO[C@H](C)c1noc(C[NH2+][C@H](CC)c2ccc(Cl)cc2)n1 ZINC000120416523 336911823 /nfs/dbraw/zinc/91/18/23/336911823.db2.gz IDFZWHYLCODXQA-BXUZGUMPSA-N 1 2 323.824 4.061 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@@H](CC(C)C)c2ccccc2)n1 ZINC000121004245 336927831 /nfs/dbraw/zinc/92/78/31/336927831.db2.gz WXJXPQUSRPFNQB-INIZCTEOSA-N 1 2 301.434 4.145 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000373063177 336946908 /nfs/dbraw/zinc/94/69/08/336946908.db2.gz KHTNPESGROYAEG-QFBILLFUSA-N 1 2 319.493 4.123 20 0 DIADLO Cc1[nH+]cccc1Cc1nc(-c2cc(Cl)cc(Cl)c2)no1 ZINC000582385395 336953057 /nfs/dbraw/zinc/95/30/57/336953057.db2.gz BSFAPPHVNURMOF-UHFFFAOYSA-N 1 2 320.179 4.338 20 0 DIADLO CCSc1ccc([C@H](C)NC(=O)Nc2cc[nH+]cc2C)cc1 ZINC000121433118 336954323 /nfs/dbraw/zinc/95/43/23/336954323.db2.gz CGZPBTKYUUOWPT-ZDUSSCGKSA-N 1 2 315.442 4.385 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](c2ccccc2)c2cc(C)ccc2C)s1 ZINC000391769225 336962500 /nfs/dbraw/zinc/96/25/00/336962500.db2.gz CCQCDTANAQLDCH-IBGZPJMESA-N 1 2 323.465 4.343 20 0 DIADLO C[C@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1cccc(CO)c1 ZINC000121544121 336963167 /nfs/dbraw/zinc/96/31/67/336963167.db2.gz LPTSERZBNIJJAX-KSSFIOAISA-N 1 2 324.449 4.076 20 0 DIADLO Cc1ccc([C@@H]2CCCCN2C(=O)Nc2cc[nH+]cc2C)cc1 ZINC000121692063 336970547 /nfs/dbraw/zinc/97/05/47/336970547.db2.gz TXUJYCQBOFBCAC-SFHVURJKSA-N 1 2 309.413 4.458 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)[C@H]1CCCCC1(C)C ZINC000373764759 336972195 /nfs/dbraw/zinc/97/21/95/336972195.db2.gz FHPBTPLXXFRQKV-CVEARBPZSA-N 1 2 317.477 4.173 20 0 DIADLO CC[C@H](NC(=O)Nc1cc[nH+]cc1C)c1cccc(Cl)c1 ZINC000121939711 336987096 /nfs/dbraw/zinc/98/70/96/336987096.db2.gz IFPTVRCLCATLRZ-AWEZNQCLSA-N 1 2 303.793 4.316 20 0 DIADLO CCCCC1CCC(C(=O)N2CCC[C@H]2c2[nH]cc[nH+]2)CC1 ZINC000374472970 336990073 /nfs/dbraw/zinc/99/00/73/336990073.db2.gz SCKNBMVANCWVTI-GPANFISMSA-N 1 2 303.450 4.070 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)c1 ZINC000375800645 337019858 /nfs/dbraw/zinc/01/98/58/337019858.db2.gz CITHVXSOHVIQIX-YGRLFVJLSA-N 1 2 323.223 4.481 20 0 DIADLO CC(C)c1nc(N2CCC(c3ncccc3Cl)CC2)cc[nH+]1 ZINC000375931123 337023501 /nfs/dbraw/zinc/02/35/01/337023501.db2.gz HVJADKDMTZGSKU-UHFFFAOYSA-N 1 2 316.836 4.032 20 0 DIADLO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1csc(C(C)C)n1)CO2 ZINC000376317648 337031326 /nfs/dbraw/zinc/03/13/26/337031326.db2.gz AFRPUXQQKKCPFO-OCCSQVGLSA-N 1 2 302.443 4.359 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000376551023 337036544 /nfs/dbraw/zinc/03/65/44/337036544.db2.gz AJAORZSSDQEOLY-RISCZKNCSA-N 1 2 322.239 4.367 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000376551023 337036545 /nfs/dbraw/zinc/03/65/45/337036545.db2.gz AJAORZSSDQEOLY-RISCZKNCSA-N 1 2 322.239 4.367 20 0 DIADLO FC(F)(F)CCCC[N@@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000376578017 337037090 /nfs/dbraw/zinc/03/70/90/337037090.db2.gz ADILUOKBLSHKAK-GFCCVEGCSA-N 1 2 317.355 4.207 20 0 DIADLO FC(F)(F)CCCC[N@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000376578017 337037091 /nfs/dbraw/zinc/03/70/91/337037091.db2.gz ADILUOKBLSHKAK-GFCCVEGCSA-N 1 2 317.355 4.207 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)cc1F)c1nccn1-c1ccccc1 ZINC000376606965 337037870 /nfs/dbraw/zinc/03/78/70/337037870.db2.gz SNKCAHNHJNEEIX-ZDUSSCGKSA-N 1 2 313.351 4.001 20 0 DIADLO CC[C@@H]1c2ccsc2CCN1C(=O)Nc1c(C)cc[nH+]c1C ZINC000376620936 337038269 /nfs/dbraw/zinc/03/82/69/337038269.db2.gz HXBVLXGUYUQXON-CQSZACIVSA-N 1 2 315.442 4.301 20 0 DIADLO CC[C@H]1c2ccsc2CCN1C(=O)Nc1c(C)cc[nH+]c1C ZINC000376620935 337038281 /nfs/dbraw/zinc/03/82/81/337038281.db2.gz HXBVLXGUYUQXON-AWEZNQCLSA-N 1 2 315.442 4.301 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NCc2c[nH]nc2-c2cccs2)c1 ZINC000377013183 337045285 /nfs/dbraw/zinc/04/52/85/337045285.db2.gz NHKDTAPFTHZOLY-UHFFFAOYSA-N 1 2 324.331 4.164 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)C[C@H]1CCC[C@H](C)C1 ZINC000377228254 337048975 /nfs/dbraw/zinc/04/89/75/337048975.db2.gz ZYZOWUNHRBRGIH-ULQDDVLXSA-N 1 2 317.477 4.173 20 0 DIADLO c1cc([C@H]2CCCC[N@H+]2Cc2cnc(C3CCCC3)s2)n[nH]1 ZINC000377633211 337057028 /nfs/dbraw/zinc/05/70/28/337057028.db2.gz WZJFRDLDPKKKOU-MRXNPFEDSA-N 1 2 316.474 4.251 20 0 DIADLO c1cc([C@H]2CCCC[N@@H+]2Cc2cnc(C3CCCC3)s2)n[nH]1 ZINC000377633211 337057029 /nfs/dbraw/zinc/05/70/29/337057029.db2.gz WZJFRDLDPKKKOU-MRXNPFEDSA-N 1 2 316.474 4.251 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000378081712 337066132 /nfs/dbraw/zinc/06/61/32/337066132.db2.gz ZUYBNXRRBSDURF-HNNXBMFYSA-N 1 2 305.466 4.112 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000378081712 337066133 /nfs/dbraw/zinc/06/61/33/337066133.db2.gz ZUYBNXRRBSDURF-HNNXBMFYSA-N 1 2 305.466 4.112 20 0 DIADLO CCCCCC[C@](C)(CC)C(=O)N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000378269635 337069160 /nfs/dbraw/zinc/06/91/60/337069160.db2.gz YZCJRGSGUHQGOA-APWZRJJASA-N 1 2 319.493 4.123 20 0 DIADLO CC(C)(C)C1CCC(CC(=O)N2CCC[C@@H]2c2[nH]cc[nH+]2)CC1 ZINC000378523355 337075054 /nfs/dbraw/zinc/07/50/54/337075054.db2.gz ZSWDRWLODVORPP-UYSNPLJNSA-N 1 2 317.477 4.316 20 0 DIADLO COc1cc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)ccc1Cl ZINC000193843726 337079607 /nfs/dbraw/zinc/07/96/07/337079607.db2.gz KUWFGFRCGGWPHN-INIZCTEOSA-N 1 2 313.788 4.273 20 0 DIADLO Cc1ccc(C(=O)N2CCC(C)(C)C2)cc1Oc1cc[nH+]cc1 ZINC000173672104 337137213 /nfs/dbraw/zinc/13/72/13/337137213.db2.gz HMCURXYBOFJLBU-UHFFFAOYSA-N 1 2 310.397 4.054 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1)c1ncc(-c2ccccc2)o1 ZINC000173896076 337138873 /nfs/dbraw/zinc/13/88/73/337138873.db2.gz JSHFLRDWWPIBNK-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2nccn2C(C)C)o1 ZINC000173996956 337140343 /nfs/dbraw/zinc/14/03/43/337140343.db2.gz JZOVRFXDWRHXGK-GOEBONIOSA-N 1 2 301.434 4.339 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2nccn2C(C)C)o1 ZINC000173996956 337140344 /nfs/dbraw/zinc/14/03/44/337140344.db2.gz JZOVRFXDWRHXGK-GOEBONIOSA-N 1 2 301.434 4.339 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nc(-c3cccc(F)c3)no2)cc1 ZINC000174664811 337142999 /nfs/dbraw/zinc/14/29/99/337142999.db2.gz XBDIXVDKOPPLBM-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ncc(-c3cccc(F)c3)o2)o1 ZINC000175060257 337144130 /nfs/dbraw/zinc/14/41/30/337144130.db2.gz XSNAZQLBBIPEQM-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ncc(-c3cccc(F)c3)o2)o1 ZINC000175060257 337144131 /nfs/dbraw/zinc/14/41/31/337144131.db2.gz XSNAZQLBBIPEQM-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000175135904 337144665 /nfs/dbraw/zinc/14/46/65/337144665.db2.gz FBYGOHKJUDWEJC-LBPRGKRZSA-N 1 2 300.333 4.267 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000175135904 337144666 /nfs/dbraw/zinc/14/46/66/337144666.db2.gz FBYGOHKJUDWEJC-LBPRGKRZSA-N 1 2 300.333 4.267 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NC(=O)N(C2CC2)C2CCCC2)c1 ZINC000175831898 337149419 /nfs/dbraw/zinc/14/94/19/337149419.db2.gz QWUCTIZGCLKZQY-UHFFFAOYSA-N 1 2 324.428 4.026 20 0 DIADLO Cc1cscc1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000176291327 337150583 /nfs/dbraw/zinc/15/05/83/337150583.db2.gz CNAQNMDNBHYLOU-UHFFFAOYSA-N 1 2 317.801 4.148 20 0 DIADLO Cc1cscc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000176289983 337150603 /nfs/dbraw/zinc/15/06/03/337150603.db2.gz YNRIFSBTBSMPFD-UHFFFAOYSA-N 1 2 310.378 4.496 20 0 DIADLO CC[C@@H](C)CN(CC)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000176633002 337152443 /nfs/dbraw/zinc/15/24/43/337152443.db2.gz DBLQCUVQMVIQCN-OAHLLOKOSA-N 1 2 312.413 4.382 20 0 DIADLO O=C(C[C@@H]1CCC[N@H+]1Cc1ccncc1Cl)c1cccs1 ZINC000177398173 337155722 /nfs/dbraw/zinc/15/57/22/337155722.db2.gz FBLCBBXXSOAHKL-ZDUSSCGKSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@@H]1CCC[N@@H+]1Cc1ccncc1Cl)c1cccs1 ZINC000177398173 337155723 /nfs/dbraw/zinc/15/57/23/337155723.db2.gz FBLCBBXXSOAHKL-ZDUSSCGKSA-N 1 2 320.845 4.034 20 0 DIADLO C[C@H]([NH2+][C@H](c1nccn1C)c1cccc(F)c1)c1ccsc1 ZINC000177805768 337157535 /nfs/dbraw/zinc/15/75/35/337157535.db2.gz FKMMFMTYCCFPCE-LRDDRELGSA-N 1 2 315.417 4.061 20 0 DIADLO CCc1nc(CSCc2ccc(-n3cc[nH+]c3)cc2)cs1 ZINC000177823800 337157712 /nfs/dbraw/zinc/15/77/12/337157712.db2.gz UZHYRXSZLXZLDZ-UHFFFAOYSA-N 1 2 315.467 4.325 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC000177719431 337158702 /nfs/dbraw/zinc/15/87/02/337158702.db2.gz VYHAKYJPBOTKBA-UHFFFAOYSA-N 1 2 321.424 4.282 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC000177719431 337158703 /nfs/dbraw/zinc/15/87/03/337158703.db2.gz VYHAKYJPBOTKBA-UHFFFAOYSA-N 1 2 321.424 4.282 20 0 DIADLO CC(C)n1cc[nH+]c1CN1CCc2cc(-c3ccccc3)oc2C1 ZINC000177719431 337158704 /nfs/dbraw/zinc/15/87/04/337158704.db2.gz VYHAKYJPBOTKBA-UHFFFAOYSA-N 1 2 321.424 4.282 20 0 DIADLO CC(C)n1ccc(CSCc2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000177851402 337160729 /nfs/dbraw/zinc/16/07/29/337160729.db2.gz MZVUZTUKYQGDTQ-UHFFFAOYSA-N 1 2 312.442 4.083 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1cc(-c2ccccn2)ccc1Cl ZINC000179059009 337167009 /nfs/dbraw/zinc/16/70/09/337167009.db2.gz ZWDZCWURYDWTNY-UHFFFAOYSA-N 1 2 323.783 4.358 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2ccc(F)cc21)c1nc(C(C)(C)C)no1 ZINC000179754753 337171780 /nfs/dbraw/zinc/17/17/80/337171780.db2.gz GFGZYDDBDDQDED-XHDPSFHLSA-N 1 2 317.408 4.234 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H]2CCCc3cc(F)ccc32)c(C)[nH+]1 ZINC000179838874 337172169 /nfs/dbraw/zinc/17/21/69/337172169.db2.gz KXKJYKACMGYYGW-QGZVFWFLSA-N 1 2 313.376 4.037 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1CCC[C@H]1CCc1ccccc1 ZINC000179856777 337172196 /nfs/dbraw/zinc/17/21/96/337172196.db2.gz FYWRBGYNZOMUJG-KRWDZBQOSA-N 1 2 309.413 4.019 20 0 DIADLO Cc1cnc(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)s1 ZINC000180421486 337174429 /nfs/dbraw/zinc/17/44/29/337174429.db2.gz AWHXZRGDRRHZLK-CYBMUJFWSA-N 1 2 315.467 4.398 20 0 DIADLO Cc1cnc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)s1 ZINC000180421486 337174430 /nfs/dbraw/zinc/17/44/30/337174430.db2.gz AWHXZRGDRRHZLK-CYBMUJFWSA-N 1 2 315.467 4.398 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@H](CC)c2ccccc2F)o1 ZINC000180631540 337176739 /nfs/dbraw/zinc/17/67/39/337176739.db2.gz BLJZOBMNLIOOAI-SJORKVTESA-N 1 2 305.393 4.410 20 0 DIADLO CC[C@@H]([NH2+][C@H]1CCCn2nc(C(C)C)nc21)c1ccccc1F ZINC000180745192 337177605 /nfs/dbraw/zinc/17/76/05/337177605.db2.gz ATBWXTULGOGYDC-CVEARBPZSA-N 1 2 316.424 4.116 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(-c2cccc(Cl)c2)o1)c1cccnc1 ZINC000181395535 337181822 /nfs/dbraw/zinc/18/18/22/337181822.db2.gz RGAKQUXWGHVKON-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1cccc2[nH+]c(CSCc3csc(C4CC4)n3)cn21 ZINC000181493645 337182562 /nfs/dbraw/zinc/18/25/62/337182562.db2.gz YIGKDDLFIKJYFE-UHFFFAOYSA-N 1 2 315.467 4.410 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2noc(-c3ccsc3)n2)c(C)s1 ZINC000182745783 337189621 /nfs/dbraw/zinc/18/96/21/337189621.db2.gz AUHWUQUTAWMBAO-JTQLQIEISA-N 1 2 319.455 4.327 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ncc(C(C)C)s2)n1 ZINC000183077490 337191339 /nfs/dbraw/zinc/19/13/39/337191339.db2.gz BYDJQSDAFXPJHM-HNNXBMFYSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ncc(C(C)C)s2)n1 ZINC000183077490 337191340 /nfs/dbraw/zinc/19/13/40/337191340.db2.gz BYDJQSDAFXPJHM-HNNXBMFYSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1nc(-c2ccoc2)no1 ZINC000183549388 337192067 /nfs/dbraw/zinc/19/20/67/337192067.db2.gz KAQZSYLRFUQVAA-LBPRGKRZSA-N 1 2 323.352 4.235 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H](C)c1nc(C2CC2)no1 ZINC000183534961 337192148 /nfs/dbraw/zinc/19/21/48/337192148.db2.gz LDMTZRKXIBVQDB-NEPJUHHUSA-N 1 2 311.385 4.413 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@@H+]2Cc2ccc(C(F)F)cc2)o1 ZINC000183948055 337195850 /nfs/dbraw/zinc/19/58/50/337195850.db2.gz CMEFIDOXOJIBEA-HNNXBMFYSA-N 1 2 307.340 4.099 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@H+]2Cc2ccc(C(F)F)cc2)o1 ZINC000183948055 337195851 /nfs/dbraw/zinc/19/58/51/337195851.db2.gz CMEFIDOXOJIBEA-HNNXBMFYSA-N 1 2 307.340 4.099 20 0 DIADLO Cc1cc(C)cc([C@@H]2CCN(C(=O)Nc3cc[nH+]cc3C)C2)c1 ZINC000183962658 337195940 /nfs/dbraw/zinc/19/59/40/337195940.db2.gz JLBFWGCGNUYUFB-MRXNPFEDSA-N 1 2 309.413 4.028 20 0 DIADLO CCSc1cc(Cl)ccc1C(=O)Nc1c[nH+]ccc1OC ZINC000184108219 337196226 /nfs/dbraw/zinc/19/62/26/337196226.db2.gz XOVLABIRZIXXAS-UHFFFAOYSA-N 1 2 322.817 4.108 20 0 DIADLO COC(=O)c1ccc(CSCc2ccc(C)[nH+]c2C)cc1F ZINC000184830087 337200373 /nfs/dbraw/zinc/20/03/73/337200373.db2.gz ANQIHFFMESROMW-UHFFFAOYSA-N 1 2 319.401 4.058 20 0 DIADLO CCCCc1noc([C@H](C)SCc2ccc(C)[nH+]c2C)n1 ZINC000184824511 337200429 /nfs/dbraw/zinc/20/04/29/337200429.db2.gz VMUYBAYXXSOZFR-ZDUSSCGKSA-N 1 2 305.447 4.418 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2nc3ccccc3n2C2CC2)o1 ZINC000184784868 337201126 /nfs/dbraw/zinc/20/11/26/337201126.db2.gz LDFHMNQQHVVQJV-BBRMVZONSA-N 1 2 321.424 4.377 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2nc3ccccc3n2C2CC2)o1 ZINC000184784884 337201160 /nfs/dbraw/zinc/20/11/60/337201160.db2.gz LDFHMNQQHVVQJV-CZUORRHYSA-N 1 2 321.424 4.377 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2nc3ccccc3n2C2CC2)o1 ZINC000184784849 337201190 /nfs/dbraw/zinc/20/11/90/337201190.db2.gz LDFHMNQQHVVQJV-CJNGLKHVSA-N 1 2 321.424 4.377 20 0 DIADLO C[C@@H](Cc1nc(-c2ccc(C(C)(C)C)cc2)no1)n1cc[nH+]c1 ZINC000583028938 337230748 /nfs/dbraw/zinc/23/07/48/337230748.db2.gz XEPIBBNOBUZGRU-ZDUSSCGKSA-N 1 2 310.401 4.034 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(Cl)c2F)[C@@H]1c1ccncc1 ZINC000583159575 337247881 /nfs/dbraw/zinc/24/78/81/337247881.db2.gz GEGNJAGWVSQWCQ-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(Cl)c2F)[C@@H]1c1ccncc1 ZINC000583159575 337247882 /nfs/dbraw/zinc/24/78/82/337247882.db2.gz GEGNJAGWVSQWCQ-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO Cc1coc2ccc(NC(=O)Cn3c(C)[nH+]c4ccccc43)cc12 ZINC000185792501 337251342 /nfs/dbraw/zinc/25/13/42/337251342.db2.gz VJNNXJLTYRNXTH-UHFFFAOYSA-N 1 2 319.364 4.038 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@H]1c1cccs1 ZINC000532902075 337252213 /nfs/dbraw/zinc/25/22/13/337252213.db2.gz ONHAJQZNSISJOF-RYUDHWBXSA-N 1 2 305.447 4.327 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@H]1c1cccs1 ZINC000532902075 337252214 /nfs/dbraw/zinc/25/22/14/337252214.db2.gz ONHAJQZNSISJOF-RYUDHWBXSA-N 1 2 305.447 4.327 20 0 DIADLO CC1(C)C[N@H+](Cc2nc(-c3ccccc3Cl)cs2)CCO1 ZINC000186452493 337256401 /nfs/dbraw/zinc/25/64/01/337256401.db2.gz HNFNTVWKVKTLKG-UHFFFAOYSA-N 1 2 322.861 4.074 20 0 DIADLO CC1(C)C[N@@H+](Cc2nc(-c3ccccc3Cl)cs2)CCO1 ZINC000186452493 337256402 /nfs/dbraw/zinc/25/64/02/337256402.db2.gz HNFNTVWKVKTLKG-UHFFFAOYSA-N 1 2 322.861 4.074 20 0 DIADLO c1cc(C2CC[NH+](Cc3nc(C4CCCC4)no3)CC2)cs1 ZINC000186941834 337260483 /nfs/dbraw/zinc/26/04/83/337260483.db2.gz XWDLRBYKHGCELV-UHFFFAOYSA-N 1 2 317.458 4.168 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[S@@](=O)Cc1ccc(C)[nH+]c1C ZINC000187160280 337263430 /nfs/dbraw/zinc/26/34/30/337263430.db2.gz KBIIIHHLZHLOQF-UWJYYQICSA-N 1 2 305.418 4.238 20 0 DIADLO C[C@H]1OCC[N@H+](Cc2nc(-c3ccccc3Cl)cs2)[C@H]1C ZINC000187180753 337263463 /nfs/dbraw/zinc/26/34/63/337263463.db2.gz UPZGYEIOGUQGTL-NWDGAFQWSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@H]1OCC[N@@H+](Cc2nc(-c3ccccc3Cl)cs2)[C@H]1C ZINC000187180753 337263464 /nfs/dbraw/zinc/26/34/64/337263464.db2.gz UPZGYEIOGUQGTL-NWDGAFQWSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@@H]1OCC[N@H+](Cc2nc(-c3ccccc3Cl)cs2)[C@H]1C ZINC000187180710 337263468 /nfs/dbraw/zinc/26/34/68/337263468.db2.gz UPZGYEIOGUQGTL-RYUDHWBXSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@@H]1OCC[N@@H+](Cc2nc(-c3ccccc3Cl)cs2)[C@H]1C ZINC000187180710 337263469 /nfs/dbraw/zinc/26/34/69/337263469.db2.gz UPZGYEIOGUQGTL-RYUDHWBXSA-N 1 2 322.861 4.073 20 0 DIADLO Cc1ccc(NC(=O)N2CCC(c3ccsc3)CC2)c(C)[nH+]1 ZINC000187308912 337264148 /nfs/dbraw/zinc/26/41/48/337264148.db2.gz GBPUVTLALUQCPG-UHFFFAOYSA-N 1 2 315.442 4.171 20 0 DIADLO CCOc1cc2c(cc1NCc1ccc(C)[nH+]c1C)O[C@H](C)C2 ZINC000187727622 337269478 /nfs/dbraw/zinc/26/94/78/337269478.db2.gz PYJTZGOLVWIDJD-CYBMUJFWSA-N 1 2 312.413 4.033 20 0 DIADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2cc(-c3ccccc3)n[nH]2)cs1 ZINC000189931137 337283916 /nfs/dbraw/zinc/28/39/16/337283916.db2.gz VQLRPEDWOHSYIC-SFHVURJKSA-N 1 2 324.453 4.179 20 0 DIADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2cc(-c3ccccc3)n[nH]2)cs1 ZINC000189931137 337283917 /nfs/dbraw/zinc/28/39/17/337283917.db2.gz VQLRPEDWOHSYIC-SFHVURJKSA-N 1 2 324.453 4.179 20 0 DIADLO Clc1cccc([C@H]([NH2+]Cc2ncccn2)c2ccccc2)c1 ZINC000190347243 337287004 /nfs/dbraw/zinc/28/70/04/337287004.db2.gz TVMIDLRPDQYYPE-GOSISDBHSA-N 1 2 309.800 4.009 20 0 DIADLO Cc1noc(C)c1CSCc1ccc(-n2cc[nH+]c2)cc1C ZINC000190870902 337290322 /nfs/dbraw/zinc/29/03/22/337290322.db2.gz CCYDZUVKKZBMHF-UHFFFAOYSA-N 1 2 313.426 4.219 20 0 DIADLO CC(C)c1nc2n(n1)CCC[C@H]2[NH2+][C@H](C)c1csc(Cl)c1 ZINC000191337253 337296032 /nfs/dbraw/zinc/29/60/32/337296032.db2.gz KKLLJNJVMGVRIG-ZYHUDNBSSA-N 1 2 324.881 4.302 20 0 DIADLO CSc1ccccc1NCc1ccc(N(C)C(C)C)[nH+]c1 ZINC000191370364 337296337 /nfs/dbraw/zinc/29/63/37/337296337.db2.gz WAERBGHOSIFXCW-UHFFFAOYSA-N 1 2 301.459 4.260 20 0 DIADLO CCN(C)c1ccc(CNc2ccc3cnn(C(C)C)c3c2)c[nH+]1 ZINC000191415888 337296765 /nfs/dbraw/zinc/29/67/65/337296765.db2.gz YADDRFMMMHYROJ-UHFFFAOYSA-N 1 2 323.444 4.080 20 0 DIADLO CCN(C)c1ccc(CNc2ccc(CCSC)cc2)c[nH+]1 ZINC000191424393 337296826 /nfs/dbraw/zinc/29/68/26/337296826.db2.gz LPWGVOSAZAFLFD-UHFFFAOYSA-N 1 2 315.486 4.055 20 0 DIADLO FC(F)(F)CC[N@@H+](Cc1nccn1-c1ccccc1)CC1CC1 ZINC000191439751 337296970 /nfs/dbraw/zinc/29/69/70/337296970.db2.gz PCSLOBMOOKEAIQ-UHFFFAOYSA-N 1 2 323.362 4.037 20 0 DIADLO FC(F)(F)CC[N@H+](Cc1nccn1-c1ccccc1)CC1CC1 ZINC000191439751 337296971 /nfs/dbraw/zinc/29/69/71/337296971.db2.gz PCSLOBMOOKEAIQ-UHFFFAOYSA-N 1 2 323.362 4.037 20 0 DIADLO CCN(C)c1ccc(CNc2cccc(-c3nc(C)co3)c2)c[nH+]1 ZINC000191442186 337297110 /nfs/dbraw/zinc/29/71/10/337297110.db2.gz QQLIOOHVQJVPKT-UHFFFAOYSA-N 1 2 322.412 4.113 20 0 DIADLO C[C@@H]([NH2+]Cc1nccn1-c1ccccc1)c1cccc(F)c1F ZINC000191528756 337298846 /nfs/dbraw/zinc/29/88/46/337298846.db2.gz NFBAINOJHQVPAT-CYBMUJFWSA-N 1 2 313.351 4.001 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@H+](C)Cc1ncccn1 ZINC000192070830 337302352 /nfs/dbraw/zinc/30/23/52/337302352.db2.gz MHVCPGIQCBPMSX-CQSZACIVSA-N 1 2 324.453 4.102 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@@H+](C)Cc1ncccn1 ZINC000192070830 337302353 /nfs/dbraw/zinc/30/23/53/337302353.db2.gz MHVCPGIQCBPMSX-CQSZACIVSA-N 1 2 324.453 4.102 20 0 DIADLO COc1ccc(Cl)c(C[NH2+][C@H](c2ncc(C)s2)C2CC2)c1 ZINC000192178069 337303823 /nfs/dbraw/zinc/30/38/23/337303823.db2.gz AXGBVWAFPNHCBK-HNNXBMFYSA-N 1 2 322.861 4.354 20 0 DIADLO Cc1cc(C(=O)Nc2c(C)cc(C)[nH+]c2C)c2ccccc2n1 ZINC000192679405 337306805 /nfs/dbraw/zinc/30/68/05/337306805.db2.gz GSQZDIVHUDPYBB-UHFFFAOYSA-N 1 2 305.381 4.116 20 0 DIADLO C[C@H]1CN(c2[nH+]cccc2OCc2ccccc2)CCC1(F)F ZINC000583785139 337332722 /nfs/dbraw/zinc/33/27/22/337332722.db2.gz OBWQGBUJNPDYCW-AWEZNQCLSA-N 1 2 318.367 4.142 20 0 DIADLO Cc1nsc(C)c1C[N@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000584448508 337339136 /nfs/dbraw/zinc/33/91/36/337339136.db2.gz QUGLQFKZNIQFSO-UHFFFAOYSA-N 1 2 308.397 4.203 20 0 DIADLO Cc1nsc(C)c1C[N@@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000584448508 337339137 /nfs/dbraw/zinc/33/91/37/337339137.db2.gz QUGLQFKZNIQFSO-UHFFFAOYSA-N 1 2 308.397 4.203 20 0 DIADLO Cc1ccc(C[NH2+]Cc2nc(C(F)(F)F)cs2)c(Cl)c1 ZINC000583876496 337366984 /nfs/dbraw/zinc/36/69/84/337366984.db2.gz UVHVCZUVTHMOIN-UHFFFAOYSA-N 1 2 320.767 4.414 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@@]2(C)CCCc3ccccc32)n1 ZINC000520777744 337390236 /nfs/dbraw/zinc/39/02/36/337390236.db2.gz XYHKGHIJUGDYFW-FQEVSTJZSA-N 1 2 319.408 4.006 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000116740939 337392841 /nfs/dbraw/zinc/39/28/41/337392841.db2.gz UCYHKERIVVTFKB-MRXNPFEDSA-N 1 2 305.466 4.043 20 0 DIADLO C[C@@H]1c2c(F)cccc2CC[N@H+]1Cc1cnc(C(C)(C)C)nc1 ZINC000580414758 337399549 /nfs/dbraw/zinc/39/95/49/337399549.db2.gz LGGUZXVAKPCSDT-CYBMUJFWSA-N 1 2 313.420 4.033 20 0 DIADLO C[C@@H]1c2c(F)cccc2CC[N@@H+]1Cc1cnc(C(C)(C)C)nc1 ZINC000580414758 337399550 /nfs/dbraw/zinc/39/95/50/337399550.db2.gz LGGUZXVAKPCSDT-CYBMUJFWSA-N 1 2 313.420 4.033 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)N[C@H]2CC23CC3)c1 ZINC000425654539 337421962 /nfs/dbraw/zinc/42/19/62/337421962.db2.gz MZNGGOIJHGWMBZ-INIZCTEOSA-N 1 2 324.428 4.024 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1cncc(-c2ccc(Cl)cc2)c1 ZINC000129240131 337428768 /nfs/dbraw/zinc/42/87/68/337428768.db2.gz ALLDUAPRAIRCCE-UHFFFAOYSA-N 1 2 323.783 4.358 20 0 DIADLO COc1ccc(OCc2ccc(C(C)C)[nH+]c2C)cc1OC ZINC000418892928 337459651 /nfs/dbraw/zinc/45/96/51/337459651.db2.gz WPXOYPFVZTUGTE-UHFFFAOYSA-N 1 2 301.386 4.110 20 0 DIADLO CCCCNC(=O)CCSCc1ccc(C(C)C)[nH+]c1C ZINC000419492716 337487743 /nfs/dbraw/zinc/48/77/43/337487743.db2.gz LVRBDOJGFIAGOZ-UHFFFAOYSA-N 1 2 308.491 4.053 20 0 DIADLO CCCC1(c2noc(CCn3c(C)[nH+]c4ccccc43)n2)CCC1 ZINC000420519102 337507013 /nfs/dbraw/zinc/50/70/13/337507013.db2.gz WPUZVDHNOMLVAP-UHFFFAOYSA-N 1 2 324.428 4.192 20 0 DIADLO CC[C@H]1C[C@]1([NH2+]Cc1nn(C)c(C)c1Cl)c1cccc(C)c1 ZINC000421359463 337531953 /nfs/dbraw/zinc/53/19/53/337531953.db2.gz WVBXHOZQRSNQCV-KBXCAEBGSA-N 1 2 317.864 4.105 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc2ccccc2o1)c1nc(C)cs1 ZINC000072863136 337548543 /nfs/dbraw/zinc/54/85/43/337548543.db2.gz YVWZPHTVLGHCQR-MRXNPFEDSA-N 1 2 301.415 4.008 20 0 DIADLO Cc1cc(NC(=O)[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)cc[nH+]1 ZINC000073409127 337549980 /nfs/dbraw/zinc/54/99/80/337549980.db2.gz OZOUYRSSNOUDDD-KGLIPLIRSA-N 1 2 320.314 4.151 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc([C@H]2C[C@H]2C(C)C)n1 ZINC000571959258 337583335 /nfs/dbraw/zinc/58/33/35/337583335.db2.gz AGLUDGMKHFEBTN-KBPBESRZSA-N 1 2 324.428 4.351 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc([C@@H]2C[C@H]2C(C)C)n1 ZINC000571959260 337583338 /nfs/dbraw/zinc/58/33/38/337583338.db2.gz AGLUDGMKHFEBTN-UONOGXRCSA-N 1 2 324.428 4.351 20 0 DIADLO CC[C@H]([NH2+]Cc1ccccc1Br)c1nccs1 ZINC000078004156 337588614 /nfs/dbraw/zinc/58/86/14/337588614.db2.gz HVQUUMHEZAUTBU-LBPRGKRZSA-N 1 2 311.248 4.147 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CCCCCO[C@H]1CCC[C@H](C)C1 ZINC000162261169 337612569 /nfs/dbraw/zinc/61/25/69/337612569.db2.gz FQFICFNADULSNA-RDJZCZTQSA-N 1 2 318.461 4.484 20 0 DIADLO CC(C)(C)n1cc(CNc2[nH+]cccc2-c2ccccc2)cn1 ZINC000162385796 337617273 /nfs/dbraw/zinc/61/72/73/337617273.db2.gz TZWBIQJUQGKBRB-UHFFFAOYSA-N 1 2 306.413 4.312 20 0 DIADLO C[S@@](=O)c1ccc(CNc2[nH+]cccc2-c2ccccc2)cc1 ZINC000162383559 337618042 /nfs/dbraw/zinc/61/80/42/337618042.db2.gz UXQMWQKEJUUFMC-QHCPKHFHSA-N 1 2 322.433 4.098 20 0 DIADLO CCc1sc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1C ZINC000162723771 337662651 /nfs/dbraw/zinc/66/26/51/337662651.db2.gz YABCXLUVFHHNOH-UHFFFAOYSA-N 1 2 311.410 4.261 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1ccc3c(c1)CC[NH2+]3)CCS2 ZINC000423220521 337705187 /nfs/dbraw/zinc/70/51/87/337705187.db2.gz VLBQVASMTGAERP-KRWDZBQOSA-N 1 2 312.438 4.312 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1cc(-c2ccccc2)nn1C ZINC000423220844 337705391 /nfs/dbraw/zinc/70/53/91/337705391.db2.gz VZQGWDKDVAQJOF-AWEZNQCLSA-N 1 2 318.424 4.228 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)nn1 ZINC000396728482 337732157 /nfs/dbraw/zinc/73/21/57/337732157.db2.gz ZVAOTZVWMONBOE-VIFPVBQESA-N 1 2 314.191 4.082 20 0 DIADLO CC[C@H]([NH2+]Cc1ncn(-c2ccccc2)n1)c1cc(C)ccc1C ZINC000527900944 337772730 /nfs/dbraw/zinc/77/27/30/337772730.db2.gz IKJYFCQSOYNNGX-IBGZPJMESA-N 1 2 320.440 4.125 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@@H]2CCOc3c(F)cccc32)c(F)c1 ZINC000424172722 337793512 /nfs/dbraw/zinc/79/35/12/337793512.db2.gz DHPNLUGPJPIKDJ-MRXNPFEDSA-N 1 2 307.315 4.026 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1cc2c(ccc3ccccc23)[nH]1 ZINC000107292353 337828351 /nfs/dbraw/zinc/82/83/51/337828351.db2.gz HNLCULBJMLKNSZ-UHFFFAOYSA-N 1 2 301.349 4.277 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3ccccc3C(C)(C)C)ccc2n1C ZINC000533233222 337836424 /nfs/dbraw/zinc/83/64/24/337836424.db2.gz PPXNJMJWPUHDDG-UHFFFAOYSA-N 1 2 321.424 4.432 20 0 DIADLO Fc1ccc(Cl)cc1C[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000119011951 337852664 /nfs/dbraw/zinc/85/26/64/337852664.db2.gz WESSAVDJYRNDLH-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)CCc2ccccc2F)c(C)[nH+]1 ZINC000119218428 337856459 /nfs/dbraw/zinc/85/64/59/337856459.db2.gz ACIOLGGVAIVXRD-GFCCVEGCSA-N 1 2 300.377 4.045 20 0 DIADLO Cc1ccc([C@@H]2CCCCN2C(=O)Nc2cc[nH+]c(C)c2)cc1 ZINC000119815485 337866284 /nfs/dbraw/zinc/86/62/84/337866284.db2.gz NLZUVHKLQSTQET-SFHVURJKSA-N 1 2 309.413 4.458 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@H](C)c1cccc2ccccc21 ZINC000120345989 337872709 /nfs/dbraw/zinc/87/27/09/337872709.db2.gz MCGLWYVCIWOGHQ-CQSZACIVSA-N 1 2 305.381 4.426 20 0 DIADLO C[C@@H](SCCn1cc[nH+]c1)c1ccc(C(F)(F)F)cc1 ZINC000090201085 337879008 /nfs/dbraw/zinc/87/90/08/337879008.db2.gz IHICMLKWNPSBKH-LLVKDONJSA-N 1 2 300.349 4.396 20 0 DIADLO C[C@H](SCCn1cc[nH+]c1)c1ccc(OC(F)(F)F)cc1 ZINC000090201241 337879012 /nfs/dbraw/zinc/87/90/12/337879012.db2.gz ZFKRJSQDWRKYNF-NSHDSACASA-N 1 2 316.348 4.276 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)Oc2ccccc2Cl)c(C)[nH+]1 ZINC000121125503 337886455 /nfs/dbraw/zinc/88/64/55/337886455.db2.gz SPBODFDGVKLKHN-ZDUSSCGKSA-N 1 2 318.804 4.066 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@H](C)c2ccccn2)c2ccccn2)c1 ZINC000090946171 337887210 /nfs/dbraw/zinc/88/72/10/337887210.db2.gz WNVHKVCPSAJYTM-OXQOHEQNSA-N 1 2 303.409 4.225 20 0 DIADLO C[C@H](NC1(c2c(Cl)cccc2Cl)CC1)c1[nH+]ccn1C ZINC000537485723 337937771 /nfs/dbraw/zinc/93/77/71/337937771.db2.gz FHTJXELVUVNWQH-JTQLQIEISA-N 1 2 310.228 4.067 20 0 DIADLO CCCC[C@H](COC)[NH2+]c1ccc(N2CCSCC2)cc1C ZINC000537527147 337940022 /nfs/dbraw/zinc/94/00/22/337940022.db2.gz CJJDIJDJSVOAGN-MRXNPFEDSA-N 1 2 322.518 4.165 20 0 DIADLO CC[C@H](Nc1cccc([NH+]2CCCCCC2)c1)[C@H]1CCOC1 ZINC000537535853 337941337 /nfs/dbraw/zinc/94/13/37/337941337.db2.gz HDBDCMGNNBXIPP-LPHOPBHVSA-N 1 2 302.462 4.294 20 0 DIADLO Cc1c2cc(F)ccc2sc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000097105800 337943345 /nfs/dbraw/zinc/94/33/45/337943345.db2.gz GQHZCMDGZCCSMQ-UHFFFAOYSA-N 1 2 300.358 4.305 20 0 DIADLO CCSc1ccc(Cl)cc1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000514941243 337974666 /nfs/dbraw/zinc/97/46/66/337974666.db2.gz AMPQEVOKLWCQBB-LLVKDONJSA-N 1 2 323.849 4.238 20 0 DIADLO CCS(=O)(=O)Nc1ccc([NH2+][C@@H](C)CCC(C)(C)C)cc1 ZINC000314951515 337976027 /nfs/dbraw/zinc/97/60/27/337976027.db2.gz ZRTAWQMOOXKZHT-ZDUSSCGKSA-N 1 2 312.479 4.075 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1F)c1ccccc1OC(F)F ZINC000315405814 337986362 /nfs/dbraw/zinc/98/63/62/337986362.db2.gz GZRZYKNXORHOLP-JTQLQIEISA-N 1 2 313.294 4.417 20 0 DIADLO Cc1cccn2cc(CSc3c(F)cc(F)cc3F)[nH+]c12 ZINC000515593343 337993705 /nfs/dbraw/zinc/99/37/05/337993705.db2.gz CXEMGRHKPBSJRW-UHFFFAOYSA-N 1 2 308.328 4.352 20 0 DIADLO C[C@H](CC(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccc(F)cc1 ZINC000516101450 338003553 /nfs/dbraw/zinc/00/35/53/338003553.db2.gz UGEBLRYJMDRBDP-CQSZACIVSA-N 1 2 323.371 4.144 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@@H]2CCC[C@H]2c2ccccc2)n1 ZINC000516169333 338007060 /nfs/dbraw/zinc/00/70/60/338007060.db2.gz OWZJTXIQEBUVFO-ZWKOTPCHSA-N 1 2 319.408 4.415 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1Cc2ccc(O)cc2C2(CC2)C1 ZINC000516360860 338010646 /nfs/dbraw/zinc/01/06/46/338010646.db2.gz KZZMKIHAPIWLDB-UHFFFAOYSA-N 1 2 316.404 4.301 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](CC(=O)Nc1ccccc1Cl)C1CC1 ZINC000086233796 338013657 /nfs/dbraw/zinc/01/36/57/338013657.db2.gz UFFIDHNICGODOU-LBPRGKRZSA-N 1 2 318.804 4.097 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](CC(=O)Nc1ccccc1Cl)C1CC1 ZINC000086233796 338013658 /nfs/dbraw/zinc/01/36/58/338013658.db2.gz UFFIDHNICGODOU-LBPRGKRZSA-N 1 2 318.804 4.097 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@@H](C)c1c[nH]c2ccccc21 ZINC000425595952 338015763 /nfs/dbraw/zinc/01/57/63/338015763.db2.gz KTJIATMSVYQRRG-CYBMUJFWSA-N 1 2 307.397 4.312 20 0 DIADLO Cc1ccc(Cc2nc(-c3ccc(Cl)cc3Cl)no2)c[nH+]1 ZINC000445458027 338017906 /nfs/dbraw/zinc/01/79/06/338017906.db2.gz QBLRWVZLIUAITN-UHFFFAOYSA-N 1 2 320.179 4.338 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(-c2ccccc2)cc1F)c1nccn1C ZINC000426302016 338025668 /nfs/dbraw/zinc/02/56/68/338025668.db2.gz GRCMFFSLKBQWQZ-LJQANCHMSA-N 1 2 323.415 4.467 20 0 DIADLO CCSc1cccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)c1 ZINC000426352085 338028496 /nfs/dbraw/zinc/02/84/96/338028496.db2.gz OKWVYFOPNANMSG-GOSISDBHSA-N 1 2 323.465 4.401 20 0 DIADLO Cc1nc2ccc(C[N@@H+]3CCOC[C@@H]3c3ccccc3)cc2s1 ZINC000426403344 338030742 /nfs/dbraw/zinc/03/07/42/338030742.db2.gz VVTKGEIHBKMQOA-GOSISDBHSA-N 1 2 324.449 4.178 20 0 DIADLO Cc1nc2ccc(C[N@H+]3CCOC[C@@H]3c3ccccc3)cc2s1 ZINC000426403344 338030743 /nfs/dbraw/zinc/03/07/43/338030743.db2.gz VVTKGEIHBKMQOA-GOSISDBHSA-N 1 2 324.449 4.178 20 0 DIADLO CCCc1csc(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccccc3)C2)n1 ZINC000426417585 338031546 /nfs/dbraw/zinc/03/15/46/338031546.db2.gz BORZCBLAPHOMBK-RHSMWYFYSA-N 1 2 316.470 4.058 20 0 DIADLO CCCc1csc(C[N@H+]2C[C@@H](C)O[C@@H](c3ccccc3)C2)n1 ZINC000426417585 338031547 /nfs/dbraw/zinc/03/15/47/338031547.db2.gz BORZCBLAPHOMBK-RHSMWYFYSA-N 1 2 316.470 4.058 20 0 DIADLO Cc1c[nH+]cc(CCc2nc(-c3cccc(Cl)c3F)no2)c1 ZINC000426456922 338032542 /nfs/dbraw/zinc/03/25/42/338032542.db2.gz GMECILCFYGFMLU-UHFFFAOYSA-N 1 2 317.751 4.018 20 0 DIADLO CC[N@H+](Cc1oc(C(C)C)nc1C)Cc1c(F)cccc1F ZINC000428209332 338042408 /nfs/dbraw/zinc/04/24/08/338042408.db2.gz QQLWGSUUKZOWOF-UHFFFAOYSA-N 1 2 308.372 4.407 20 0 DIADLO CC[N@@H+](Cc1oc(C(C)C)nc1C)Cc1c(F)cccc1F ZINC000428209332 338042409 /nfs/dbraw/zinc/04/24/09/338042409.db2.gz QQLWGSUUKZOWOF-UHFFFAOYSA-N 1 2 308.372 4.407 20 0 DIADLO CC(C)c1nnc(C[N@@H+](C)[C@H](c2ccccc2Cl)C(C)C)[nH]1 ZINC000428214012 338042624 /nfs/dbraw/zinc/04/26/24/338042624.db2.gz XIJDAMKJXDYOAZ-INIZCTEOSA-N 1 2 320.868 4.411 20 0 DIADLO CC(C)c1nnc(C[N@H+](C)[C@H](c2ccccc2Cl)C(C)C)[nH]1 ZINC000428214012 338042625 /nfs/dbraw/zinc/04/26/25/338042625.db2.gz XIJDAMKJXDYOAZ-INIZCTEOSA-N 1 2 320.868 4.411 20 0 DIADLO COC(=O)c1oc([C@@H](C)[N@H+](C)Cc2ccccc2Cl)cc1C ZINC000428257752 338044751 /nfs/dbraw/zinc/04/47/51/338044751.db2.gz BPMDEJCMDINBHF-GFCCVEGCSA-N 1 2 321.804 4.221 20 0 DIADLO COC(=O)c1oc([C@@H](C)[N@@H+](C)Cc2ccccc2Cl)cc1C ZINC000428257752 338044752 /nfs/dbraw/zinc/04/47/52/338044752.db2.gz BPMDEJCMDINBHF-GFCCVEGCSA-N 1 2 321.804 4.221 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2oc(C(C)C)nc2C)C2CC2)n1 ZINC000428317031 338046988 /nfs/dbraw/zinc/04/69/88/338046988.db2.gz BKKVFBRKKPJJGE-AWEZNQCLSA-N 1 2 305.447 4.112 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000428327948 338047523 /nfs/dbraw/zinc/04/75/23/338047523.db2.gz WKIYZRPCTZWRKG-UHFFFAOYSA-N 1 2 312.335 4.156 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000428327948 338047524 /nfs/dbraw/zinc/04/75/24/338047524.db2.gz WKIYZRPCTZWRKG-UHFFFAOYSA-N 1 2 312.335 4.156 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2oc(C(C)C)nc2C)C2CC2)s1 ZINC000428346156 338048182 /nfs/dbraw/zinc/04/81/82/338048182.db2.gz NEIMEJKYGIGIQO-CQSZACIVSA-N 1 2 305.447 4.112 20 0 DIADLO CCc1nc(C)c(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)o1 ZINC000428378823 338049508 /nfs/dbraw/zinc/04/95/08/338049508.db2.gz IOKLATSQBSMHHR-LBPRGKRZSA-N 1 2 315.442 4.348 20 0 DIADLO CCc1nc(C)c(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)o1 ZINC000428378823 338049509 /nfs/dbraw/zinc/04/95/09/338049509.db2.gz IOKLATSQBSMHHR-LBPRGKRZSA-N 1 2 315.442 4.348 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@H]2COCc3ccccc32)cs1 ZINC000428451474 338052258 /nfs/dbraw/zinc/05/22/58/338052258.db2.gz BRICIQJPXHYPNE-DOMZBBRYSA-N 1 2 302.443 4.189 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@@H]3CCC[C@@H]32)cc1Oc1cc[nH+]cc1 ZINC000428538839 338055733 /nfs/dbraw/zinc/05/57/33/338055733.db2.gz YGWRILYFERKLSP-YJBOKZPZSA-N 1 2 322.408 4.197 20 0 DIADLO C[C@H]1C[N@H+](Cc2ncc(-c3ccccc3)o2)Cc2ccccc2O1 ZINC000429116856 338071156 /nfs/dbraw/zinc/07/11/56/338071156.db2.gz OMTZDTVGTMDVTF-HNNXBMFYSA-N 1 2 320.392 4.125 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ncc(-c3ccccc3)o2)Cc2ccccc2O1 ZINC000429116856 338071157 /nfs/dbraw/zinc/07/11/57/338071157.db2.gz OMTZDTVGTMDVTF-HNNXBMFYSA-N 1 2 320.392 4.125 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1c(F)cccc1Br ZINC000429360096 338078512 /nfs/dbraw/zinc/07/85/12/338078512.db2.gz FJVODRRYCIWICW-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1c(F)cccc1Br ZINC000429360096 338078513 /nfs/dbraw/zinc/07/85/13/338078513.db2.gz FJVODRRYCIWICW-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1coc(-c2c(F)cccc2F)n1 ZINC000429396396 338079453 /nfs/dbraw/zinc/07/94/53/338079453.db2.gz FWFGSFMJYWUXSE-UHFFFAOYSA-N 1 2 318.323 4.153 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1coc(-c2c(F)cccc2F)n1 ZINC000429396396 338079454 /nfs/dbraw/zinc/07/94/54/338079454.db2.gz FWFGSFMJYWUXSE-UHFFFAOYSA-N 1 2 318.323 4.153 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1csc(-c2ccc(F)cc2)n1 ZINC000429408705 338079884 /nfs/dbraw/zinc/07/98/84/338079884.db2.gz UFSJQKFKQHRBHF-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1csc(-c2ccc(F)cc2)n1 ZINC000429408705 338079885 /nfs/dbraw/zinc/07/98/85/338079885.db2.gz UFSJQKFKQHRBHF-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO C[C@@H](Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1[nH+]ccn1C ZINC000429460225 338081817 /nfs/dbraw/zinc/08/18/17/338081817.db2.gz XHOLYNFBDXTZRT-LLVKDONJSA-N 1 2 311.351 4.433 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1coc(-c3cccs3)n1)CC2 ZINC000429579276 338084891 /nfs/dbraw/zinc/08/48/91/338084891.db2.gz LINDGMJLBBMBKO-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1coc(-c3cccs3)n1)CC2 ZINC000429579276 338084892 /nfs/dbraw/zinc/08/48/92/338084892.db2.gz LINDGMJLBBMBKO-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1nc([C@@H](C)[NH+]2CCC(CCc3ccc(C)cc3)CC2)no1 ZINC000429714103 338088080 /nfs/dbraw/zinc/08/80/80/338088080.db2.gz FOMJDHTZSUVXNW-OAHLLOKOSA-N 1 2 313.445 4.092 20 0 DIADLO CCC(C)(C)CNC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000429755614 338089130 /nfs/dbraw/zinc/08/91/30/338089130.db2.gz YHRNJIOSDJYJPW-UHFFFAOYSA-N 1 2 313.401 4.432 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)o1 ZINC000430032081 338093969 /nfs/dbraw/zinc/09/39/69/338093969.db2.gz FENQCDDTDCLUBF-PSASIEDQSA-N 1 2 313.294 4.249 20 0 DIADLO Fc1cc(Cl)cc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)c1 ZINC000430033972 338094000 /nfs/dbraw/zinc/09/40/00/338094000.db2.gz IHPNQRUZABJGDF-UHFFFAOYSA-N 1 2 321.676 4.325 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000430087575 338095565 /nfs/dbraw/zinc/09/55/65/338095565.db2.gz SPQLJBBUOSUHMU-LJQANCHMSA-N 1 2 310.441 4.452 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000430087575 338095566 /nfs/dbraw/zinc/09/55/66/338095566.db2.gz SPQLJBBUOSUHMU-LJQANCHMSA-N 1 2 310.441 4.452 20 0 DIADLO CC1(C)C[N@H+](Cc2cc3ccc(F)cc3[nH]2)[C@H]1c1cccnc1 ZINC000430105410 338096856 /nfs/dbraw/zinc/09/68/56/338096856.db2.gz NVKZJQQIDYBRIW-SFHVURJKSA-N 1 2 309.388 4.285 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc3ccc(F)cc3[nH]2)[C@H]1c1cccnc1 ZINC000430105410 338096857 /nfs/dbraw/zinc/09/68/57/338096857.db2.gz NVKZJQQIDYBRIW-SFHVURJKSA-N 1 2 309.388 4.285 20 0 DIADLO CC(C)Cc1ncc(C[N@@H+]2CC(C)(C)[C@H]2c2cccnc2)s1 ZINC000430106392 338097091 /nfs/dbraw/zinc/09/70/91/338097091.db2.gz NIPUCKQAEGEIQL-QGZVFWFLSA-N 1 2 315.486 4.320 20 0 DIADLO CC(C)Cc1ncc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)s1 ZINC000430106392 338097092 /nfs/dbraw/zinc/09/70/92/338097092.db2.gz NIPUCKQAEGEIQL-QGZVFWFLSA-N 1 2 315.486 4.320 20 0 DIADLO CC(C)[C@@H]1[N@H+](Cc2ncc(C(F)(F)F)s2)CC12CCC2 ZINC000430109547 338097298 /nfs/dbraw/zinc/09/72/98/338097298.db2.gz YPQAIPBCECQYJX-LBPRGKRZSA-N 1 2 304.381 4.172 20 0 DIADLO CC(C)[C@@H]1[N@@H+](Cc2ncc(C(F)(F)F)s2)CC12CCC2 ZINC000430109547 338097299 /nfs/dbraw/zinc/09/72/99/338097299.db2.gz YPQAIPBCECQYJX-LBPRGKRZSA-N 1 2 304.381 4.172 20 0 DIADLO c1cc([C@@H]2C[N@H+](CCSCc3ccccc3)CCO2)cs1 ZINC000430755683 338113820 /nfs/dbraw/zinc/11/38/20/338113820.db2.gz RETAVGONSPSMHY-KRWDZBQOSA-N 1 2 319.495 4.055 20 0 DIADLO c1cc([C@@H]2C[N@@H+](CCSCc3ccccc3)CCO2)cs1 ZINC000430755683 338113821 /nfs/dbraw/zinc/11/38/21/338113821.db2.gz RETAVGONSPSMHY-KRWDZBQOSA-N 1 2 319.495 4.055 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1ccc(F)c(C)c1 ZINC000430861811 338117313 /nfs/dbraw/zinc/11/73/13/338117313.db2.gz CHLFHXUSGDHVGN-QGZVFWFLSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1ccc(F)c(C)c1 ZINC000430861811 338117314 /nfs/dbraw/zinc/11/73/14/338117314.db2.gz CHLFHXUSGDHVGN-QGZVFWFLSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1cc(F)c(F)cc1F ZINC000430861159 338117366 /nfs/dbraw/zinc/11/73/66/338117366.db2.gz ANHKZVGOFVUQPQ-INIZCTEOSA-N 1 2 323.362 4.048 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1cc(Cl)cs1 ZINC000430877021 338117895 /nfs/dbraw/zinc/11/78/95/338117895.db2.gz UPKRJDHDVSLDFH-CQSZACIVSA-N 1 2 309.866 4.345 20 0 DIADLO Clc1ccc(-n2ncc3c2nc[nH+]c3SC2CCC2)cc1 ZINC000430991212 338120169 /nfs/dbraw/zinc/12/01/69/338120169.db2.gz FTUQPOYYMKFNSZ-UHFFFAOYSA-N 1 2 316.817 4.114 20 0 DIADLO c1ccc(C(OCCOc2cc[nH+]cc2)c2ccccc2)cc1 ZINC000431479835 338131856 /nfs/dbraw/zinc/13/18/56/338131856.db2.gz YFNVTVUWJTXJKT-UHFFFAOYSA-N 1 2 305.377 4.267 20 0 DIADLO C[C@H](Nc1cc(N(C)c2ccccc2)nc[nH+]1)c1cccc(O)c1 ZINC000432161795 338147677 /nfs/dbraw/zinc/14/76/77/338147677.db2.gz HVHZGGDGXMVZIU-AWEZNQCLSA-N 1 2 320.396 4.123 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1csc(Cl)c1Cl)CO2 ZINC000432232592 338149264 /nfs/dbraw/zinc/14/92/64/338149264.db2.gz NDQRMFZPSCMUCH-SNVBAGLBSA-N 1 2 318.200 4.417 20 0 DIADLO Clc1scc(C[NH2+]Cc2cccc3c2OCO3)c1Cl ZINC000432239310 338149802 /nfs/dbraw/zinc/14/98/02/338149802.db2.gz BFUMWJOBVAIMTM-UHFFFAOYSA-N 1 2 316.209 4.073 20 0 DIADLO COc1ccc(C[NH2+]Cc2csc(Cl)c2Cl)c(F)c1 ZINC000432249167 338150818 /nfs/dbraw/zinc/15/08/18/338150818.db2.gz CZXRFRDQYQWIAQ-UHFFFAOYSA-N 1 2 320.216 4.492 20 0 DIADLO CC[N@H+](Cc1noc(C2CCCCC2)n1)Cc1ccccc1C ZINC000448522971 338151002 /nfs/dbraw/zinc/15/10/02/338151002.db2.gz XNJDFWVSOAYFLW-UHFFFAOYSA-N 1 2 313.445 4.448 20 0 DIADLO CC[N@@H+](Cc1noc(C2CCCCC2)n1)Cc1ccccc1C ZINC000448522971 338151003 /nfs/dbraw/zinc/15/10/03/338151003.db2.gz XNJDFWVSOAYFLW-UHFFFAOYSA-N 1 2 313.445 4.448 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)s1 ZINC000432253630 338151164 /nfs/dbraw/zinc/15/11/64/338151164.db2.gz OKGSEHMAMQXAAM-UHFFFAOYSA-N 1 2 319.232 4.441 20 0 DIADLO Clc1scc(C[NH2+]Cc2ccc(Cl)cn2)c1Cl ZINC000432256363 338151457 /nfs/dbraw/zinc/15/14/57/338151457.db2.gz GYYBNWVLDWPSIU-UHFFFAOYSA-N 1 2 307.633 4.393 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2csc(Cl)c2Cl)s1 ZINC000432259297 338151760 /nfs/dbraw/zinc/15/17/60/338151760.db2.gz RIICIIKCINQDAI-RXMQYKEDSA-N 1 2 308.259 4.066 20 0 DIADLO CC(C)CO[C@H]1CC[N@H+](Cc2csc(Cl)c2Cl)C1 ZINC000432718653 338164107 /nfs/dbraw/zinc/16/41/07/338164107.db2.gz KXMFMKCTCCFUKK-NSHDSACASA-N 1 2 308.274 4.302 20 0 DIADLO CC(C)CO[C@H]1CC[N@@H+](Cc2csc(Cl)c2Cl)C1 ZINC000432718653 338164108 /nfs/dbraw/zinc/16/41/08/338164108.db2.gz KXMFMKCTCCFUKK-NSHDSACASA-N 1 2 308.274 4.302 20 0 DIADLO Fc1ccc2nc(C[NH+]3CCC(C(F)(F)F)CC3)sc2c1 ZINC000432736222 338165144 /nfs/dbraw/zinc/16/51/44/338165144.db2.gz CCCPPRFWLLFPOJ-UHFFFAOYSA-N 1 2 318.339 4.210 20 0 DIADLO Oc1ccc2c(c1)C[N@@H+](Cc1ccc(C(F)(F)F)s1)CC2 ZINC000432737954 338165165 /nfs/dbraw/zinc/16/51/65/338165165.db2.gz GNLNOBPTHXBKAD-UHFFFAOYSA-N 1 2 313.344 4.031 20 0 DIADLO Oc1ccc2c(c1)C[N@H+](Cc1ccc(C(F)(F)F)s1)CC2 ZINC000432737954 338165166 /nfs/dbraw/zinc/16/51/66/338165166.db2.gz GNLNOBPTHXBKAD-UHFFFAOYSA-N 1 2 313.344 4.031 20 0 DIADLO OCC[N@H+](Cc1csc(Cl)c1Cl)Cc1ccccc1 ZINC000432741597 338165433 /nfs/dbraw/zinc/16/54/33/338165433.db2.gz ICSPSHQFSHIDNX-UHFFFAOYSA-N 1 2 316.253 4.049 20 0 DIADLO OCC[N@@H+](Cc1csc(Cl)c1Cl)Cc1ccccc1 ZINC000432741597 338165434 /nfs/dbraw/zinc/16/54/34/338165434.db2.gz ICSPSHQFSHIDNX-UHFFFAOYSA-N 1 2 316.253 4.049 20 0 DIADLO Cn1cccc1C[N@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432753053 338166515 /nfs/dbraw/zinc/16/65/15/338166515.db2.gz SHLDTTZYIXGMNO-UHFFFAOYSA-N 1 2 301.192 4.103 20 0 DIADLO Cn1cccc1C[N@@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432753053 338166516 /nfs/dbraw/zinc/16/65/16/338166516.db2.gz SHLDTTZYIXGMNO-UHFFFAOYSA-N 1 2 301.192 4.103 20 0 DIADLO Cc1cc(Cl)cc(C)c1CN(C)Cc1cn2c([nH+]1)CCCC2 ZINC000432786368 338167690 /nfs/dbraw/zinc/16/76/90/338167690.db2.gz CJXSMKJKAJWXSR-UHFFFAOYSA-N 1 2 317.864 4.122 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+](C2CC2)[C@H]2CCCc3ccccc32)[nH]1 ZINC000432829073 338169622 /nfs/dbraw/zinc/16/96/22/338169622.db2.gz MLXNLLSGSYLZDT-KRWDZBQOSA-N 1 2 324.472 4.144 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+](C2CC2)[C@H]2CCCc3ccccc32)[nH]1 ZINC000432829073 338169623 /nfs/dbraw/zinc/16/96/23/338169623.db2.gz MLXNLLSGSYLZDT-KRWDZBQOSA-N 1 2 324.472 4.144 20 0 DIADLO CC[C@]1(CO)CCC[N@H+](Cc2csc(Cl)c2Cl)C1 ZINC000432920259 338173075 /nfs/dbraw/zinc/17/30/75/338173075.db2.gz XTDQEWWIGORVGW-ZDUSSCGKSA-N 1 2 308.274 4.039 20 0 DIADLO CC[C@]1(CO)CCC[N@@H+](Cc2csc(Cl)c2Cl)C1 ZINC000432920259 338173076 /nfs/dbraw/zinc/17/30/76/338173076.db2.gz XTDQEWWIGORVGW-ZDUSSCGKSA-N 1 2 308.274 4.039 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1nnc(C(C)(C)C)[nH]1 ZINC000432935353 338173959 /nfs/dbraw/zinc/17/39/59/338173959.db2.gz CTXYIHJHMSTRSZ-GFCCVEGCSA-N 1 2 312.417 4.041 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nnc(C(C)(C)C)[nH]1 ZINC000432935353 338173960 /nfs/dbraw/zinc/17/39/60/338173960.db2.gz CTXYIHJHMSTRSZ-GFCCVEGCSA-N 1 2 312.417 4.041 20 0 DIADLO Cc1ccc(NC(=O)Nc2cccc(-c3ncco3)c2C)c(C)[nH+]1 ZINC000433020241 338176612 /nfs/dbraw/zinc/17/66/12/338176612.db2.gz MPPCQEQESCITPI-UHFFFAOYSA-N 1 2 322.368 4.306 20 0 DIADLO COc1ccc(OCCC[NH2+][C@@H](c2ccccc2)C(F)F)cc1 ZINC000433054950 338178899 /nfs/dbraw/zinc/17/88/99/338178899.db2.gz WTTSSCCJSMKXQY-KRWDZBQOSA-N 1 2 321.367 4.060 20 0 DIADLO COc1ccccc1CCC[NH2+][C@H](c1ccccc1)C(F)F ZINC000433062555 338179405 /nfs/dbraw/zinc/17/94/05/338179405.db2.gz OZHWDMOPNRPMDH-QGZVFWFLSA-N 1 2 305.368 4.224 20 0 DIADLO COc1ccccc1CCC[NH2+][C@@H](c1ccccc1)C(F)F ZINC000433062554 338179467 /nfs/dbraw/zinc/17/94/67/338179467.db2.gz OZHWDMOPNRPMDH-KRWDZBQOSA-N 1 2 305.368 4.224 20 0 DIADLO FC(F)[C@H]([NH2+]CCOc1ccccc1Cl)c1ccccc1 ZINC000433061942 338179530 /nfs/dbraw/zinc/17/95/30/338179530.db2.gz MMFMUHOEROTREU-OAHLLOKOSA-N 1 2 311.759 4.315 20 0 DIADLO CC(C)c1cnc(C[NH2+]Cc2cc(F)c(Cl)cc2F)s1 ZINC000433182454 338184654 /nfs/dbraw/zinc/18/46/54/338184654.db2.gz NSNZGKIZBUCBRD-UHFFFAOYSA-N 1 2 316.804 4.488 20 0 DIADLO FC(F)(F)c1cnc(C[NH2+]Cc2ccc(Cl)s2)s1 ZINC000433309604 338191107 /nfs/dbraw/zinc/19/11/07/338191107.db2.gz BODVTKBYTOKMKZ-UHFFFAOYSA-N 1 2 312.769 4.167 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)no1 ZINC000433286677 338189413 /nfs/dbraw/zinc/18/94/13/338189413.db2.gz JSVNOLBAYCWCFS-CQSZACIVSA-N 1 2 319.836 4.055 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)no1 ZINC000433286677 338189414 /nfs/dbraw/zinc/18/94/14/338189414.db2.gz JSVNOLBAYCWCFS-CQSZACIVSA-N 1 2 319.836 4.055 20 0 DIADLO CCC(CC)n1ccc(COc2cccc(-n3cc[nH+]c3)c2)n1 ZINC000433608658 338198118 /nfs/dbraw/zinc/19/81/18/338198118.db2.gz OHXNZDAMTJGCCZ-UHFFFAOYSA-N 1 2 310.401 4.009 20 0 DIADLO Cc1nc2[nH]ccc2c(N2CCC(=Cc3cccc(F)c3)CC2)[nH+]1 ZINC000433774256 338201338 /nfs/dbraw/zinc/20/13/38/338201338.db2.gz NDPUKCWGCVDLGY-UHFFFAOYSA-N 1 2 322.387 4.089 20 0 DIADLO CC(C)c1nc(N2CCC(C(F)F)CC2)cc(C(C)(C)C)[nH+]1 ZINC000433776658 338201370 /nfs/dbraw/zinc/20/13/70/338201370.db2.gz ZAYUKGMUUGUSHR-UHFFFAOYSA-N 1 2 311.420 4.379 20 0 DIADLO Cc1nc2[nH]ccc2c(N2CCC[C@H](c3ccccc3)CC2)[nH+]1 ZINC000433778934 338201556 /nfs/dbraw/zinc/20/15/56/338201556.db2.gz DNNFNIUDGNZDJB-INIZCTEOSA-N 1 2 306.413 4.040 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)o1 ZINC000433788867 338201954 /nfs/dbraw/zinc/20/19/54/338201954.db2.gz JPKNNCJNANWVGB-XHDPSFHLSA-N 1 2 307.825 4.333 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@@H+]2Cc2ncnn2C(C)C)o1 ZINC000434541492 338219847 /nfs/dbraw/zinc/21/98/47/338219847.db2.gz FHSADOTWCJXBRF-INIZCTEOSA-N 1 2 316.449 4.132 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@H+]2Cc2ncnn2C(C)C)o1 ZINC000434541492 338219848 /nfs/dbraw/zinc/21/98/48/338219848.db2.gz FHSADOTWCJXBRF-INIZCTEOSA-N 1 2 316.449 4.132 20 0 DIADLO CC(C)[C@H](c1ccc(F)cc1)[N@H+](C)Cc1nc(C(C)(C)C)no1 ZINC000434618818 338221192 /nfs/dbraw/zinc/22/11/92/338221192.db2.gz AZOBQNINDXROBV-MRXNPFEDSA-N 1 2 319.424 4.335 20 0 DIADLO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc(C(C)(C)C)no1 ZINC000434618818 338221193 /nfs/dbraw/zinc/22/11/93/338221193.db2.gz AZOBQNINDXROBV-MRXNPFEDSA-N 1 2 319.424 4.335 20 0 DIADLO Cc1cccc([C@H](C)[S@@](=O)Cc2[nH+]ccn2-c2ccccc2)c1 ZINC000434629877 338221939 /nfs/dbraw/zinc/22/19/39/338221939.db2.gz ROXPTVAJUMIHIU-HJPURHCSSA-N 1 2 324.449 4.191 20 0 DIADLO Oc1ccc(Br)c(C[N@@H+]2CC[C@H]2c2ccccc2)c1 ZINC000434989073 338229211 /nfs/dbraw/zinc/22/92/11/338229211.db2.gz ZLCYFRNZNQOWFH-INIZCTEOSA-N 1 2 318.214 4.102 20 0 DIADLO Oc1ccc(Br)c(C[N@H+]2CC[C@H]2c2ccccc2)c1 ZINC000434989073 338229212 /nfs/dbraw/zinc/22/92/12/338229212.db2.gz ZLCYFRNZNQOWFH-INIZCTEOSA-N 1 2 318.214 4.102 20 0 DIADLO C[N@H+](Cc1ncc(C(F)(F)F)s1)[C@@H]1CCc2ccccc21 ZINC000435125330 338232371 /nfs/dbraw/zinc/23/23/71/338232371.db2.gz WJEAGJWLUCGQDG-GFCCVEGCSA-N 1 2 312.360 4.281 20 0 DIADLO C[N@@H+](Cc1ncc(C(F)(F)F)s1)[C@@H]1CCc2ccccc21 ZINC000435125330 338232372 /nfs/dbraw/zinc/23/23/72/338232372.db2.gz WJEAGJWLUCGQDG-GFCCVEGCSA-N 1 2 312.360 4.281 20 0 DIADLO C[C@@H]1[C@@H](C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)[C@@H]1c1ccccc1 ZINC000435679277 338245041 /nfs/dbraw/zinc/24/50/41/338245041.db2.gz XSUMUDBCQHEVCM-DOPJRALCSA-N 1 2 317.392 4.065 20 0 DIADLO Cc1ccc(NCc2ccc(N(C)c3ccccc3)nc2)c[nH+]1 ZINC000435709874 338245944 /nfs/dbraw/zinc/24/59/44/338245944.db2.gz HAIRBVWXFCXJJT-UHFFFAOYSA-N 1 2 304.397 4.165 20 0 DIADLO CC[N@H+](Cc1nc(C2CCCC2)no1)[C@@H](C)c1cccc(O)c1 ZINC000155068871 338253443 /nfs/dbraw/zinc/25/34/43/338253443.db2.gz GIYVGLQLQDKLDS-ZDUSSCGKSA-N 1 2 315.417 4.016 20 0 DIADLO CC[N@@H+](Cc1nc(C2CCCC2)no1)[C@@H](C)c1cccc(O)c1 ZINC000155068871 338253444 /nfs/dbraw/zinc/25/34/44/338253444.db2.gz GIYVGLQLQDKLDS-ZDUSSCGKSA-N 1 2 315.417 4.016 20 0 DIADLO CC[N@H+](Cc1nc(C2CCCC2)no1)[C@H](C)c1cccc(O)c1 ZINC000155069000 338253459 /nfs/dbraw/zinc/25/34/59/338253459.db2.gz GIYVGLQLQDKLDS-CYBMUJFWSA-N 1 2 315.417 4.016 20 0 DIADLO CC[N@@H+](Cc1nc(C2CCCC2)no1)[C@H](C)c1cccc(O)c1 ZINC000155069000 338253460 /nfs/dbraw/zinc/25/34/60/338253460.db2.gz GIYVGLQLQDKLDS-CYBMUJFWSA-N 1 2 315.417 4.016 20 0 DIADLO CCC1(C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)CC1 ZINC000436162482 338260091 /nfs/dbraw/zinc/26/00/91/338260091.db2.gz ONWNRWOOKWUNJK-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO O=C(Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)[C@@H]1CC=CCC1 ZINC000436171004 338260429 /nfs/dbraw/zinc/26/04/29/338260429.db2.gz NDOLLODWDXXJDA-OAHLLOKOSA-N 1 2 321.424 4.181 20 0 DIADLO CC1(C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)CCCC1 ZINC000436175304 338260693 /nfs/dbraw/zinc/26/06/93/338260693.db2.gz MHHCNUCYPNIXJO-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO Fc1cccc2[nH]c(CNc3cccc(-n4cc[nH+]c4)c3)cc21 ZINC000436286443 338266150 /nfs/dbraw/zinc/26/61/50/338266150.db2.gz QNCZAYREPGLIJJ-UHFFFAOYSA-N 1 2 306.344 4.105 20 0 DIADLO CSc1cccc([C@H]([NH2+]CCF)c2cc(F)ccc2F)c1 ZINC000436298675 338267364 /nfs/dbraw/zinc/26/73/64/338267364.db2.gz ZTHJOFCLFJQRSX-INIZCTEOSA-N 1 2 311.372 4.335 20 0 DIADLO CC1=C(C(=O)Nc2ccc(-c3cn4c([nH+]3)CCCC4)cc2)CCC1 ZINC000437294055 338306462 /nfs/dbraw/zinc/30/64/62/338306462.db2.gz QOIKXGCCHOXWKZ-UHFFFAOYSA-N 1 2 321.424 4.325 20 0 DIADLO CC(C)[N@H+](Cc1c(Cl)cnn1C)Cc1cccc(Cl)c1 ZINC000437579180 338314416 /nfs/dbraw/zinc/31/44/16/338314416.db2.gz NUGLLFDMHJLAKP-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO CC(C)[N@@H+](Cc1c(Cl)cnn1C)Cc1cccc(Cl)c1 ZINC000437579180 338314417 /nfs/dbraw/zinc/31/44/17/338314417.db2.gz NUGLLFDMHJLAKP-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO Fc1cccc2[nH]c(C[N@@H+]3CCc4[nH]c5ccccc5c4C3)cc21 ZINC000437585837 338314965 /nfs/dbraw/zinc/31/49/65/338314965.db2.gz BUTWWNNOTNMYOT-UHFFFAOYSA-N 1 2 319.383 4.347 20 0 DIADLO Fc1cccc2[nH]c(C[N@H+]3CCc4[nH]c5ccccc5c4C3)cc21 ZINC000437585837 338314966 /nfs/dbraw/zinc/31/49/66/338314966.db2.gz BUTWWNNOTNMYOT-UHFFFAOYSA-N 1 2 319.383 4.347 20 0 DIADLO O=C(Nc1ccc2[nH]c(C3CCCCC3)[nH+]c2c1)c1ccc[nH]1 ZINC000437587730 338315007 /nfs/dbraw/zinc/31/50/07/338315007.db2.gz HDVMGBBFGWIFCW-UHFFFAOYSA-N 1 2 308.385 4.191 20 0 DIADLO CCC(=O)c1ccc(OCc2c[nH+]cn2Cc2ccccc2)cc1 ZINC000437620803 338316339 /nfs/dbraw/zinc/31/63/39/338316339.db2.gz NHDBDYIPIYDZLI-UHFFFAOYSA-N 1 2 320.392 4.103 20 0 DIADLO CC[C@H](C)C[C@@H](C)NC(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000437980004 338327149 /nfs/dbraw/zinc/32/71/49/338327149.db2.gz RYITZGCXDNMXNO-UONOGXRCSA-N 1 2 314.433 4.033 20 0 DIADLO Cc1ccc(-c2ccc(C[N@@H+]3CCC[C@H]3c3ncc[nH]3)o2)cc1 ZINC000437985177 338327329 /nfs/dbraw/zinc/32/73/29/338327329.db2.gz LGXKVYGNNZFPFE-KRWDZBQOSA-N 1 2 307.397 4.315 20 0 DIADLO Cc1ccc(-c2ccc(C[N@H+]3CCC[C@H]3c3ncc[nH]3)o2)cc1 ZINC000437985177 338327330 /nfs/dbraw/zinc/32/73/30/338327330.db2.gz LGXKVYGNNZFPFE-KRWDZBQOSA-N 1 2 307.397 4.315 20 0 DIADLO CC(C)CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)cc1 ZINC000437983621 338327386 /nfs/dbraw/zinc/32/73/86/338327386.db2.gz HKLYSDLNJMHUDW-GOSISDBHSA-N 1 2 313.445 4.172 20 0 DIADLO CC(C)CCOc1ccc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)cc1 ZINC000437983621 338327387 /nfs/dbraw/zinc/32/73/87/338327387.db2.gz HKLYSDLNJMHUDW-GOSISDBHSA-N 1 2 313.445 4.172 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[NH+]1CCC2(CCCC2)CC1 ZINC000438059100 338329332 /nfs/dbraw/zinc/32/93/32/338329332.db2.gz DOSINXIWBMIFFV-UHFFFAOYSA-N 1 2 303.450 4.274 20 0 DIADLO FC(F)(F)[C@H]1CCC[C@@H](Nc2ccc(N3CCCC3)c[nH+]2)C1 ZINC000438089205 338330769 /nfs/dbraw/zinc/33/07/69/338330769.db2.gz UHSSZSKUSQQOMF-QWHCGFSZSA-N 1 2 313.367 4.215 20 0 DIADLO CCOc1cc(C)ccc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438298752 338339032 /nfs/dbraw/zinc/33/90/32/338339032.db2.gz BEKVHQANMVWFRP-UHFFFAOYSA-N 1 2 321.424 4.251 20 0 DIADLO Fc1c(Cl)cccc1OCc1c[nH+]cn1Cc1ccccc1 ZINC000438307490 338339063 /nfs/dbraw/zinc/33/90/63/338339063.db2.gz STOPCIVHBUDZCK-UHFFFAOYSA-N 1 2 316.763 4.303 20 0 DIADLO CCCOc1ccccc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438304256 338339066 /nfs/dbraw/zinc/33/90/66/338339066.db2.gz UZJZSPKEMQPWJF-UHFFFAOYSA-N 1 2 321.424 4.332 20 0 DIADLO COc1cc(C)[nH+]c(COc2ccccc2-c2nccs2)c1 ZINC000438309600 338339270 /nfs/dbraw/zinc/33/92/70/338339270.db2.gz ZEPUVCMEOQYUEL-UHFFFAOYSA-N 1 2 312.394 4.101 20 0 DIADLO Fc1cc(NCc2c[nH+]cn2Cc2ccccc2)ccc1Cl ZINC000438318901 338339454 /nfs/dbraw/zinc/33/94/54/338339454.db2.gz FRFWNZVNXBANFP-UHFFFAOYSA-N 1 2 315.779 4.336 20 0 DIADLO Fc1ccc(NCc2c[nH+]cn2Cc2ccccc2)cc1Cl ZINC000438322996 338339604 /nfs/dbraw/zinc/33/96/04/338339604.db2.gz VUGCEHCKJBXFDF-UHFFFAOYSA-N 1 2 315.779 4.336 20 0 DIADLO Clc1ccc(SCC[N@@H+]2CCO[C@H](c3ccco3)C2)cc1 ZINC000438539374 338347315 /nfs/dbraw/zinc/34/73/15/338347315.db2.gz FTSPZXIGSKCKQE-INIZCTEOSA-N 1 2 323.845 4.099 20 0 DIADLO Clc1ccc(SCC[N@H+]2CCO[C@H](c3ccco3)C2)cc1 ZINC000438539374 338347316 /nfs/dbraw/zinc/34/73/16/338347316.db2.gz FTSPZXIGSKCKQE-INIZCTEOSA-N 1 2 323.845 4.099 20 0 DIADLO C[C@H]1CO[C@@H](c2cccc(Cl)c2)C[N@@H+]1Cc1cccc(O)c1 ZINC000438538403 338347357 /nfs/dbraw/zinc/34/73/57/338347357.db2.gz CPCKXRZZVFQBOH-SCLBCKFNSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@H]1CO[C@@H](c2cccc(Cl)c2)C[N@H+]1Cc1cccc(O)c1 ZINC000438538403 338347358 /nfs/dbraw/zinc/34/73/58/338347358.db2.gz CPCKXRZZVFQBOH-SCLBCKFNSA-N 1 2 317.816 4.008 20 0 DIADLO Cc1ccc(SCC[N@@H+]2CCO[C@H](c3ccco3)C2)cc1C ZINC000438554368 338347938 /nfs/dbraw/zinc/34/79/38/338347938.db2.gz OGPMSPCJTDFFLK-SFHVURJKSA-N 1 2 317.454 4.062 20 0 DIADLO Cc1ccc(SCC[N@H+]2CCO[C@H](c3ccco3)C2)cc1C ZINC000438554368 338347939 /nfs/dbraw/zinc/34/79/39/338347939.db2.gz OGPMSPCJTDFFLK-SFHVURJKSA-N 1 2 317.454 4.062 20 0 DIADLO Cc1cccnc1C[N@H+]1C[C@H](c2cccc(Cl)c2)OC[C@H]1C ZINC000438554729 338348008 /nfs/dbraw/zinc/34/80/08/338348008.db2.gz VVZUOGTXPYKYPL-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cccnc1C[N@@H+]1C[C@H](c2cccc(Cl)c2)OC[C@H]1C ZINC000438554729 338348009 /nfs/dbraw/zinc/34/80/09/338348009.db2.gz VVZUOGTXPYKYPL-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)ccc(O)c2F)cc1 ZINC000438849324 338353789 /nfs/dbraw/zinc/35/37/89/338353789.db2.gz DRCJKADFGFGOQJ-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2c(F)ccc(O)c2F)cc1 ZINC000438849324 338353790 /nfs/dbraw/zinc/35/37/90/338353790.db2.gz DRCJKADFGFGOQJ-MRXNPFEDSA-N 1 2 319.351 4.016 20 0 DIADLO C[C@H](CSCc1cn2cc(Cl)ccc2[nH+]1)C(F)(F)F ZINC000439026334 338358825 /nfs/dbraw/zinc/35/88/25/338358825.db2.gz IKFQEHZPCNXBEB-MRVPVSSYSA-N 1 2 308.756 4.419 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2)CC[N@@H+]1Cc1noc(C(C)(C)C)n1 ZINC000439324867 338367327 /nfs/dbraw/zinc/36/73/27/338367327.db2.gz JCIBJIOZSPYBGU-ZBFHGGJFSA-N 1 2 313.445 4.135 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2)CC[N@H+]1Cc1noc(C(C)(C)C)n1 ZINC000439324867 338367328 /nfs/dbraw/zinc/36/73/28/338367328.db2.gz JCIBJIOZSPYBGU-ZBFHGGJFSA-N 1 2 313.445 4.135 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2)CC[N@@H+]1Cc1noc(C(C)(C)C)n1 ZINC000439324863 338367333 /nfs/dbraw/zinc/36/73/33/338367333.db2.gz JCIBJIOZSPYBGU-GOEBONIOSA-N 1 2 313.445 4.135 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2)CC[N@H+]1Cc1noc(C(C)(C)C)n1 ZINC000439324863 338367334 /nfs/dbraw/zinc/36/73/34/338367334.db2.gz JCIBJIOZSPYBGU-GOEBONIOSA-N 1 2 313.445 4.135 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@H](c3ccccc3)C[C@H]2C)no1 ZINC000439334139 338367650 /nfs/dbraw/zinc/36/76/50/338367650.db2.gz XCIWTGJMQKIZCS-WBVHZDCISA-N 1 2 313.445 4.180 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@H](c3ccccc3)C[C@H]2C)no1 ZINC000439334139 338367651 /nfs/dbraw/zinc/36/76/51/338367651.db2.gz XCIWTGJMQKIZCS-WBVHZDCISA-N 1 2 313.445 4.180 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@H](c3ccccc3)C[C@@H]2C)c(C)[nH+]1 ZINC000439448250 338369723 /nfs/dbraw/zinc/36/97/23/338369723.db2.gz FXUFIJKLJJTJEB-YJBOKZPZSA-N 1 2 323.440 4.498 20 0 DIADLO Cc1nc(C)c(CSCc2cn3cc(Cl)ccc3[nH+]2)s1 ZINC000439541993 338372822 /nfs/dbraw/zinc/37/28/22/338372822.db2.gz NOQAJGVFWNOUBN-UHFFFAOYSA-N 1 2 323.874 4.494 20 0 DIADLO CCC[C@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1)C(=O)OCC ZINC000439558000 338373031 /nfs/dbraw/zinc/37/30/31/338373031.db2.gz QIKKJMXXBVPJCH-FZMZJTMJSA-N 1 2 317.351 4.088 20 0 DIADLO COC(=O)[C@H]([NH2+][C@@H](C)C1CCCCC1)c1cccc(Cl)c1 ZINC000439586886 338373926 /nfs/dbraw/zinc/37/39/26/338373926.db2.gz JXOZXXHKEGGFQW-BLLLJJGKSA-N 1 2 309.837 4.113 20 0 DIADLO Cc1ccc(/C=C/CC(=O)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC000440526446 338389200 /nfs/dbraw/zinc/38/92/00/338389200.db2.gz MIUMQWQYICPBRK-SNAWJCMRSA-N 1 2 317.392 4.223 20 0 DIADLO Cc1ccc(/C=C\CC(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000440592816 338391641 /nfs/dbraw/zinc/39/16/41/338391641.db2.gz XPTAWOBIZQPXTI-IHWYPQMZSA-N 1 2 317.392 4.427 20 0 DIADLO CSc1ccccc1[C@H](C)[NH2+]Cc1nc(CCC(C)C)no1 ZINC000440650783 338394367 /nfs/dbraw/zinc/39/43/67/338394367.db2.gz VPJBXIHGIVGLBX-ZDUSSCGKSA-N 1 2 319.474 4.231 20 0 DIADLO CC[C@@H](Nc1ncnc2sc3ccccc3c21)c1[nH]cc[nH+]1 ZINC000440659017 338394648 /nfs/dbraw/zinc/39/46/48/338394648.db2.gz DWPGRINCKSDACW-LLVKDONJSA-N 1 2 309.398 4.131 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](CC(=O)Nc1ccc(Cl)cc1)C1CC1 ZINC000440890161 338399394 /nfs/dbraw/zinc/39/93/94/338399394.db2.gz GQWXLWWPZDJWCX-LBPRGKRZSA-N 1 2 318.804 4.097 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](CC(=O)Nc1ccc(Cl)cc1)C1CC1 ZINC000440890161 338399395 /nfs/dbraw/zinc/39/93/95/338399395.db2.gz GQWXLWWPZDJWCX-LBPRGKRZSA-N 1 2 318.804 4.097 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+]([C@@H](C)c2ccco2)C2CC2)cc1C ZINC000440899033 338399499 /nfs/dbraw/zinc/39/94/99/338399499.db2.gz FXVWSQGFJLTSCC-HNNXBMFYSA-N 1 2 312.413 4.061 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+]([C@@H](C)c2ccco2)C2CC2)cc1C ZINC000440899033 338399500 /nfs/dbraw/zinc/39/95/00/338399500.db2.gz FXVWSQGFJLTSCC-HNNXBMFYSA-N 1 2 312.413 4.061 20 0 DIADLO CCC[C@@H](C)C(=O)N(Cc1[nH]cc[nH+]1)c1cc(C)ccc1Cl ZINC000440906927 338399765 /nfs/dbraw/zinc/39/97/65/338399765.db2.gz VMKHUPVGGHYOSX-CYBMUJFWSA-N 1 2 319.836 4.341 20 0 DIADLO C[C@H](CCC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000441323132 338408535 /nfs/dbraw/zinc/40/85/35/338408535.db2.gz MHKMIOWFVHEKBY-MRXNPFEDSA-N 1 2 319.408 4.395 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)C[C@@H]2C=CCC2)c1C(C)C ZINC000441577440 338417090 /nfs/dbraw/zinc/41/70/90/338417090.db2.gz SKIXPSDIBYXLLM-OAHLLOKOSA-N 1 2 308.425 4.383 20 0 DIADLO CC[C@@H](F)CSCc1cn2cc(Br)ccc2[nH+]1 ZINC000442539180 338424853 /nfs/dbraw/zinc/42/48/53/338424853.db2.gz GPDXJGGYICIBLE-SNVBAGLBSA-N 1 2 317.227 4.078 20 0 DIADLO Cc1ccc(NC(=O)CCCOc2ccc(C)c(C)c2)c(C)[nH+]1 ZINC000446418845 338527607 /nfs/dbraw/zinc/52/76/07/338527607.db2.gz KOKDFTCCTIRYRK-UHFFFAOYSA-N 1 2 312.413 4.113 20 0 DIADLO Cc1ccc(NC(=O)CO[C@@H]2C[C@H](C)CC[C@@H]2C(C)C)c(C)[nH+]1 ZINC000446438164 338528107 /nfs/dbraw/zinc/52/81/07/338528107.db2.gz HDNAJCSNEWXLFI-MZMPZRCHSA-N 1 2 318.461 4.114 20 0 DIADLO Fc1cccc(Cl)c1CN[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000446836547 338537576 /nfs/dbraw/zinc/53/75/76/338537576.db2.gz VDEBKOJDTZBSJA-INIZCTEOSA-N 1 2 315.779 4.081 20 0 DIADLO CC(C)(c1ccccc1)[S@@](=O)Cc1[nH+]ccn1-c1ccccc1 ZINC000447148659 338546466 /nfs/dbraw/zinc/54/64/66/338546466.db2.gz YKXABUVABDFDHW-QHCPKHFHSA-N 1 2 324.449 4.056 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@H](C(C)(C)C)CC2)c(C)[nH+]1 ZINC000447165098 338546656 /nfs/dbraw/zinc/54/66/56/338546656.db2.gz GKKJRJFWIMSNFX-HNNXBMFYSA-N 1 2 303.450 4.379 20 0 DIADLO Cc1ccc(NC(=O)N[C@H]2CCC[C@H]2c2ccccc2)c(C)[nH+]1 ZINC000447168466 338546842 /nfs/dbraw/zinc/54/68/42/338546842.db2.gz SKYVAWOOANIKLW-WMZOPIPTSA-N 1 2 309.413 4.156 20 0 DIADLO COc1cc(F)ccc1N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000194570117 338568647 /nfs/dbraw/zinc/56/86/47/338568647.db2.gz AGBIUNZULRHNJQ-CYBMUJFWSA-N 1 2 311.360 4.193 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+][C@@H]2COc3ccc(Cl)cc32)s1 ZINC000447898809 338570942 /nfs/dbraw/zinc/57/09/42/338570942.db2.gz YZBKZKCFLUIOHS-GFCCVEGCSA-N 1 2 322.861 4.317 20 0 DIADLO Fc1cnccc1CNc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000449047840 338587904 /nfs/dbraw/zinc/58/79/04/338587904.db2.gz CZIJRJKRZRYSNA-UHFFFAOYSA-N 1 2 322.387 4.033 20 0 DIADLO C[C@H]1CSC[C@@H]1Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000449051389 338588151 /nfs/dbraw/zinc/58/81/51/338588151.db2.gz UQTGNPUACSXJDG-GUYCJALGSA-N 1 2 313.470 4.050 20 0 DIADLO CCc1nc(C[NH2+]Cc2cc3ccccc3cc2OC)cs1 ZINC000449126074 338595466 /nfs/dbraw/zinc/59/54/66/338595466.db2.gz UKWUUZHCKDTKRJ-UHFFFAOYSA-N 1 2 312.438 4.157 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2ccccc2-c2ccccc2C)n1 ZINC000449280405 338609250 /nfs/dbraw/zinc/60/92/50/338609250.db2.gz XSTWLCIPULTWPF-CQSZACIVSA-N 1 2 307.397 4.204 20 0 DIADLO Fc1cc(F)c2c(c1)[C@@H]([NH2+]Cc1ncc(Cl)s1)CCC2 ZINC000449353109 338616918 /nfs/dbraw/zinc/61/69/18/338616918.db2.gz YDCNGOYJNWNWAY-LBPRGKRZSA-N 1 2 314.788 4.242 20 0 DIADLO CC[C@@H]([NH2+]Cc1cnc(-c2ccccc2F)s1)C(F)F ZINC000449361724 338617689 /nfs/dbraw/zinc/61/76/89/338617689.db2.gz LHPOYISDIBOHLZ-GFCCVEGCSA-N 1 2 300.349 4.083 20 0 DIADLO Clc1cccc(C2C[NH+](Cc3csc(C4CC4)n3)C2)c1 ZINC000449555253 338637182 /nfs/dbraw/zinc/63/71/82/338637182.db2.gz GQCPHBWTSBVSAR-UHFFFAOYSA-N 1 2 304.846 4.273 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(-c2ccc(F)cc2)o1 ZINC000449561978 338637843 /nfs/dbraw/zinc/63/78/43/338637843.db2.gz GDZZSPBNOAYLBG-CYBMUJFWSA-N 1 2 313.376 4.153 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]Cc2ccc(F)c(Cl)c2Cl)c2nccn21 ZINC000449569939 338638607 /nfs/dbraw/zinc/63/86/07/338638607.db2.gz IMWXRSQCNYKYGM-GZMMTYOYSA-N 1 2 314.191 4.125 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H](C)n4ccnc43)o2)cc1 ZINC000449575297 338639368 /nfs/dbraw/zinc/63/93/68/338639368.db2.gz XPUHGSQBNOBIPY-WMLDXEAASA-N 1 2 307.397 4.247 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](c2ccco2)c2ccc(OC)cc2)o1 ZINC000449774418 338651697 /nfs/dbraw/zinc/65/16/97/338651697.db2.gz LUHJYYQFLMBMOS-LJQANCHMSA-N 1 2 311.381 4.323 20 0 DIADLO CC(C)CC(CC(C)C)C(=O)N1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000450110147 338667487 /nfs/dbraw/zinc/66/74/87/338667487.db2.gz DJESCOHOEJMNSE-WMZOPIPTSA-N 1 2 319.493 4.001 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2C)c(C)[nH+]1 ZINC000450148543 338668947 /nfs/dbraw/zinc/66/89/47/338668947.db2.gz PVCSLKGAHOCVIX-UHFFFAOYSA-N 1 2 308.303 4.278 20 0 DIADLO Cc1nn(C)cc1[C@@H](C)Nc1cc[nH+]c2cc(F)c(Cl)cc12 ZINC000450309134 338676769 /nfs/dbraw/zinc/67/67/69/338676769.db2.gz QYZHRANIWNTKST-SECBINFHSA-N 1 2 318.783 4.242 20 0 DIADLO CC[C@]1(CO)CCCN(c2cc[nH+]c3cc(F)c(Cl)cc32)C1 ZINC000450457078 338685578 /nfs/dbraw/zinc/68/55/78/338685578.db2.gz ZPMPTOJCLFZILV-KRWDZBQOSA-N 1 2 322.811 4.016 20 0 DIADLO CC(C)c1nc(N2[C@H](C)[C@H](CC(F)(F)F)C[C@@H]2C)cc[nH+]1 ZINC000450565960 338691235 /nfs/dbraw/zinc/69/12/35/338691235.db2.gz KVEVJRXETVBTNH-TUAOUCFPSA-N 1 2 301.356 4.156 20 0 DIADLO COC[C@]1(C)CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C1 ZINC000450620736 338694324 /nfs/dbraw/zinc/69/43/24/338694324.db2.gz VYJJCPKHGUXHTF-MRXNPFEDSA-N 1 2 324.346 4.116 20 0 DIADLO CC1(C)C[C@H](O)CCN(c2cc[nH+]c3cc(F)c(Cl)cc32)C1 ZINC000450858028 338708826 /nfs/dbraw/zinc/70/88/26/338708826.db2.gz RWOWYDNXUWHJDG-LLVKDONJSA-N 1 2 322.811 4.015 20 0 DIADLO CC[C@@H]1C[C@@]1([NH2+]Cc1nnc(C(C)C)s1)c1cccc(C)c1 ZINC000450921552 338712503 /nfs/dbraw/zinc/71/25/03/338712503.db2.gz IQSCJLQCUYZTAR-KDOFPFPSSA-N 1 2 315.486 4.385 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)n1 ZINC000451359566 338731095 /nfs/dbraw/zinc/73/10/95/338731095.db2.gz WVPJYQWSCWHBOS-MRXNPFEDSA-N 1 2 323.799 4.056 20 0 DIADLO C[C@@H](C(=O)Nc1c[nH+]c2n1CCCC2)c1ccc2ccccc2c1 ZINC000452337251 338764255 /nfs/dbraw/zinc/76/42/55/338764255.db2.gz ZDCJYAAGZLWVMU-CQSZACIVSA-N 1 2 319.408 4.115 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@H](CC(F)(F)F)c1ccccc1 ZINC000453059364 338788672 /nfs/dbraw/zinc/78/86/72/338788672.db2.gz KZKLSZPRQVMPOC-GXTWGEPZSA-N 1 2 311.351 4.247 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)Nc1cnn(CC(C)C)c1C(C)C ZINC000453179212 338803391 /nfs/dbraw/zinc/80/33/91/338803391.db2.gz IIFDBRVTYOQUHV-AWEZNQCLSA-N 1 2 303.454 4.052 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1ccc(OC)c(Br)c1)C(F)F ZINC000453231980 338811584 /nfs/dbraw/zinc/81/15/84/338811584.db2.gz FVTCPEPJLJAXLD-KWQFWETISA-N 1 2 322.193 4.152 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1ccc(OCC(F)(F)F)cc1)C(F)F ZINC000453252761 338814638 /nfs/dbraw/zinc/81/46/38/338814638.db2.gz VQGWIBFODQTOKK-BXKDBHETSA-N 1 2 311.294 4.322 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2ncc(C(F)(F)F)cc21)C(C)(F)F ZINC000453293886 338819841 /nfs/dbraw/zinc/81/98/41/338819841.db2.gz PISVLGHVOGHTLK-UFBFGSQYSA-N 1 2 308.294 4.111 20 0 DIADLO C[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1ccc(-c2ccccc2)o1 ZINC000453339309 338827409 /nfs/dbraw/zinc/82/74/09/338827409.db2.gz GLHFPMIJFPYUAZ-DZKIICNBSA-N 1 2 307.397 4.500 20 0 DIADLO CC(C)[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1cc(F)ccc1F ZINC000453347712 338828899 /nfs/dbraw/zinc/82/88/99/338828899.db2.gz KXZMUQHKYLIGJW-UVBJJODRSA-N 1 2 305.372 4.154 20 0 DIADLO COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1cnc(C2CC2)o1 ZINC000453370516 338833372 /nfs/dbraw/zinc/83/33/72/338833372.db2.gz UDZUHTOAOIRDID-SNVBAGLBSA-N 1 2 306.793 4.065 20 0 DIADLO COc1cccnc1C[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000453374654 338833710 /nfs/dbraw/zinc/83/37/10/338833710.db2.gz SMDMOHWZQAFKBX-SNVBAGLBSA-N 1 2 311.212 4.248 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+][C@@H](C)c1nccn1CC ZINC000453379051 338834847 /nfs/dbraw/zinc/83/48/47/338834847.db2.gz ZYDAEGGFCKYSCN-STQMWFEESA-N 1 2 321.852 4.367 20 0 DIADLO CCc1ncc(C[NH2+][C@H](C)c2cc(Cl)sc2Cl)o1 ZINC000453391333 338836840 /nfs/dbraw/zinc/83/68/40/338836840.db2.gz YRPDWXVWMIRKGE-SSDOTTSWSA-N 1 2 305.230 4.456 20 0 DIADLO COc1ccc([C@H]([NH2+][C@H](C)c2cnccc2C)c2ccco2)cc1 ZINC000453393677 338837249 /nfs/dbraw/zinc/83/72/49/338837249.db2.gz FSVANMZIVYOANG-QRWLVFNGSA-N 1 2 322.408 4.432 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)NC(=O)Nc1c(C)cccc1C(C)C ZINC000454227364 338858288 /nfs/dbraw/zinc/85/82/88/338858288.db2.gz SMSVSIZFTYDXLJ-AWEZNQCLSA-N 1 2 314.433 4.218 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)c(C)[nH+]1 ZINC000455476401 338895672 /nfs/dbraw/zinc/89/56/72/338895672.db2.gz DUPVVUFKZGPKOQ-WMZOPIPTSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2c3ccccc3C[C@@H]2C)c(C)[nH+]1 ZINC000455487573 338896286 /nfs/dbraw/zinc/89/62/86/338896286.db2.gz SUVWCLQNPGOXNN-SGTLLEGYSA-N 1 2 309.413 4.062 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2c3ccccc3C[C@H]2C)c(C)[nH+]1 ZINC000455487575 338896297 /nfs/dbraw/zinc/89/62/97/338896297.db2.gz SUVWCLQNPGOXNN-XIKOKIGWSA-N 1 2 309.413 4.062 20 0 DIADLO CCN(Cc1cccc(F)c1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455489102 338896303 /nfs/dbraw/zinc/89/63/03/338896303.db2.gz VJNUOFSKSWNRTQ-UHFFFAOYSA-N 1 2 315.392 4.200 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](C)CCCC(F)(F)F)c(C)[nH+]1 ZINC000455514376 338897406 /nfs/dbraw/zinc/89/74/06/338897406.db2.gz JLLQMGQTHWLYBK-SNVBAGLBSA-N 1 2 317.355 4.249 20 0 DIADLO COc1cc(C)cc(NC(=O)Nc2c(C)cc(C)[nH+]c2C)c1C ZINC000455533212 338898105 /nfs/dbraw/zinc/89/81/05/338898105.db2.gz TZHDERYPEVICCN-UHFFFAOYSA-N 1 2 313.401 4.276 20 0 DIADLO Cc1cc(Cl)cc2nc(SCc3cc[nH+]c(N)c3)oc21 ZINC000195501240 338903388 /nfs/dbraw/zinc/90/33/88/338903388.db2.gz UAJFYSNHKPAZTR-UHFFFAOYSA-N 1 2 305.790 4.059 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)C1=C(c2ccccc2)CCCC1 ZINC000456355261 338927422 /nfs/dbraw/zinc/92/74/22/338927422.db2.gz QKLIZOYXCGQTIU-OAHLLOKOSA-N 1 2 323.440 4.108 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)NC(=O)C1=C(c2ccccc2)CCCC1 ZINC000456355259 338927431 /nfs/dbraw/zinc/92/74/31/338927431.db2.gz QKLIZOYXCGQTIU-HNNXBMFYSA-N 1 2 323.440 4.108 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000456363373 338927720 /nfs/dbraw/zinc/92/77/20/338927720.db2.gz UPRJUNKHGOKKEU-ZBFHGGJFSA-N 1 2 305.466 4.077 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000456363369 338927781 /nfs/dbraw/zinc/92/77/81/338927781.db2.gz UPRJUNKHGOKKEU-GOEBONIOSA-N 1 2 305.466 4.077 20 0 DIADLO C[C@@H]1C[C@H](NC(=O)C2=C(c3ccccc3)CCCC2)c2[nH+]ccn21 ZINC000456443142 338930308 /nfs/dbraw/zinc/93/03/08/338930308.db2.gz ZYGZMOAHUCQMQE-KDOFPFPSSA-N 1 2 321.424 4.033 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccccc2SC(C)C)c[nH+]1 ZINC000456857907 338944352 /nfs/dbraw/zinc/94/43/52/338944352.db2.gz LCUBZBIKPYDGJW-UHFFFAOYSA-N 1 2 314.454 4.129 20 0 DIADLO CC[C@H](CC(F)F)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000457559865 338969261 /nfs/dbraw/zinc/96/92/61/338969261.db2.gz KWLCJLQOMQLGOO-GFCCVEGCSA-N 1 2 320.339 4.494 20 0 DIADLO CCCC[C@H](C)N(CCCC)C(=O)N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000459122917 339014247 /nfs/dbraw/zinc/01/42/47/339014247.db2.gz SYNPMFHLKFKMEM-JYJNAYRXSA-N 1 2 320.481 4.279 20 0 DIADLO CCC[C@@H](NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1)C1CCCC1 ZINC000459280683 339018966 /nfs/dbraw/zinc/01/89/66/339018966.db2.gz KVTJYOYCUFHTPX-CVEARBPZSA-N 1 2 318.465 4.005 20 0 DIADLO CCCCC[N@H+](Cc1cc(COC)on1)Cc1ccc(F)cc1 ZINC000459311704 339020968 /nfs/dbraw/zinc/02/09/68/339020968.db2.gz SLWBHLCUOQWBDV-UHFFFAOYSA-N 1 2 320.408 4.153 20 0 DIADLO CCCCC[N@@H+](Cc1cc(COC)on1)Cc1ccc(F)cc1 ZINC000459311704 339020969 /nfs/dbraw/zinc/02/09/69/339020969.db2.gz SLWBHLCUOQWBDV-UHFFFAOYSA-N 1 2 320.408 4.153 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2c(F)cc(C)cc2Cl)on1 ZINC000459317426 339021363 /nfs/dbraw/zinc/02/13/63/339021363.db2.gz BXPSZOVNFDATSA-OAHLLOKOSA-N 1 2 308.784 4.421 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2c(F)cc(C)cc2Cl)on1 ZINC000459317426 339021364 /nfs/dbraw/zinc/02/13/64/339021364.db2.gz BXPSZOVNFDATSA-OAHLLOKOSA-N 1 2 308.784 4.421 20 0 DIADLO COc1ccc(-c2ccccc2C)cc1C[N@H+](C)Cc1cc[nH]n1 ZINC000459345062 339023123 /nfs/dbraw/zinc/02/31/23/339023123.db2.gz JDQSIXPFPRYCAX-UHFFFAOYSA-N 1 2 321.424 4.026 20 0 DIADLO COc1ccc(-c2ccccc2C)cc1C[N@@H+](C)Cc1cc[nH]n1 ZINC000459345062 339023124 /nfs/dbraw/zinc/02/31/24/339023124.db2.gz JDQSIXPFPRYCAX-UHFFFAOYSA-N 1 2 321.424 4.026 20 0 DIADLO COc1ccc(-c2ccccc2C)cc1C[N@H+](C)Cc1ccon1 ZINC000459348072 339023347 /nfs/dbraw/zinc/02/33/47/339023347.db2.gz QVOZKSSJTRRMRR-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO COc1ccc(-c2ccccc2C)cc1C[N@@H+](C)Cc1ccon1 ZINC000459348072 339023348 /nfs/dbraw/zinc/02/33/48/339023348.db2.gz QVOZKSSJTRRMRR-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO CCOc1cc(CNc2ccc(C)[nH+]c2C)cc(Cl)c1O ZINC000459455759 339030194 /nfs/dbraw/zinc/03/01/94/339030194.db2.gz VSLXKVARWXZQFX-UHFFFAOYSA-N 1 2 306.793 4.068 20 0 DIADLO Clc1cccc(CC[N@@H+]2CCSC[C@H]2c2nccs2)c1 ZINC000459515170 339033585 /nfs/dbraw/zinc/03/35/85/339033585.db2.gz DGCHZFXERNCBJF-AWEZNQCLSA-N 1 2 324.902 4.129 20 0 DIADLO Clc1cccc(CC[N@H+]2CCSC[C@H]2c2nccs2)c1 ZINC000459515170 339033586 /nfs/dbraw/zinc/03/35/86/339033586.db2.gz DGCHZFXERNCBJF-AWEZNQCLSA-N 1 2 324.902 4.129 20 0 DIADLO c1csc([C@@H]2CSCC[N@H+]2Cc2ccc(C3CC3)cc2)n1 ZINC000459530065 339034258 /nfs/dbraw/zinc/03/42/58/339034258.db2.gz MBELAXFDTPZVIJ-INIZCTEOSA-N 1 2 316.495 4.311 20 0 DIADLO c1csc([C@@H]2CSCC[N@@H+]2Cc2ccc(C3CC3)cc2)n1 ZINC000459530065 339034259 /nfs/dbraw/zinc/03/42/59/339034259.db2.gz MBELAXFDTPZVIJ-INIZCTEOSA-N 1 2 316.495 4.311 20 0 DIADLO CCCc1noc(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)n1 ZINC000459574157 339036726 /nfs/dbraw/zinc/03/67/26/339036726.db2.gz RTZXFLDBIAAUGG-GOSISDBHSA-N 1 2 311.429 4.139 20 0 DIADLO CCCc1noc(C[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)n1 ZINC000459574157 339036727 /nfs/dbraw/zinc/03/67/27/339036727.db2.gz RTZXFLDBIAAUGG-GOSISDBHSA-N 1 2 311.429 4.139 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)n1 ZINC000459573527 339036819 /nfs/dbraw/zinc/03/68/19/339036819.db2.gz RCHOVEAFOLOEIJ-PBHICJAKSA-N 1 2 311.429 4.310 20 0 DIADLO CCc1noc([C@@H](C)[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)n1 ZINC000459573527 339036820 /nfs/dbraw/zinc/03/68/20/339036820.db2.gz RCHOVEAFOLOEIJ-PBHICJAKSA-N 1 2 311.429 4.310 20 0 DIADLO CCN(C(=O)Nc1c(C)cc(C)[nH+]c1C)c1cccc(OC)c1 ZINC000459583957 339037211 /nfs/dbraw/zinc/03/72/11/339037211.db2.gz QAKRWZVPYXMYCY-UHFFFAOYSA-N 1 2 313.401 4.074 20 0 DIADLO CSCC[N@@H+]1CCCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000459597277 339038021 /nfs/dbraw/zinc/03/80/21/339038021.db2.gz UPPCAOZFKHGLMT-AWEZNQCLSA-N 1 2 309.866 4.106 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ncc(C(C)C)s1 ZINC000459651463 339040616 /nfs/dbraw/zinc/04/06/16/339040616.db2.gz QDNVXLCHUPELNK-ZDUSSCGKSA-N 1 2 304.459 4.434 20 0 DIADLO Cc1ncc(C[NH2+]Cc2cc(Cl)ccc2OC2CCCC2)o1 ZINC000459675333 339042452 /nfs/dbraw/zinc/04/24/52/339042452.db2.gz LWJRAZLATJKKGD-UHFFFAOYSA-N 1 2 320.820 4.248 20 0 DIADLO c1ccc([C@H]2[N@H+](Cc3nc(C4CC4)no3)CC23CCCCC3)cc1 ZINC000459740374 339045466 /nfs/dbraw/zinc/04/54/66/339045466.db2.gz JMTDBPJTKOEMHK-GOSISDBHSA-N 1 2 323.440 4.454 20 0 DIADLO c1ccc([C@H]2[N@@H+](Cc3nc(C4CC4)no3)CC23CCCCC3)cc1 ZINC000459740374 339045467 /nfs/dbraw/zinc/04/54/67/339045467.db2.gz JMTDBPJTKOEMHK-GOSISDBHSA-N 1 2 323.440 4.454 20 0 DIADLO Clc1ccc(-c2nc(C[N@@H+]3C[C@@H]4C[C@H]3CS4)cs2)cc1 ZINC000459746923 339045944 /nfs/dbraw/zinc/04/59/44/339045944.db2.gz GGICYIGGWKIDLC-KBPBESRZSA-N 1 2 322.886 4.153 20 0 DIADLO Clc1ccc(-c2nc(C[N@H+]3C[C@@H]4C[C@H]3CS4)cs2)cc1 ZINC000459746923 339045945 /nfs/dbraw/zinc/04/59/45/339045945.db2.gz GGICYIGGWKIDLC-KBPBESRZSA-N 1 2 322.886 4.153 20 0 DIADLO Cc1ccnc(C[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)n1 ZINC000459753624 339046332 /nfs/dbraw/zinc/04/63/32/339046332.db2.gz RSOWKOSMRYUWRE-IBGZPJMESA-N 1 2 307.441 4.292 20 0 DIADLO Cc1ccnc(C[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)n1 ZINC000459753624 339046333 /nfs/dbraw/zinc/04/63/33/339046333.db2.gz RSOWKOSMRYUWRE-IBGZPJMESA-N 1 2 307.441 4.292 20 0 DIADLO Cc1ccnc(C[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)n1 ZINC000459753627 339046351 /nfs/dbraw/zinc/04/63/51/339046351.db2.gz RSOWKOSMRYUWRE-LJQANCHMSA-N 1 2 307.441 4.292 20 0 DIADLO Cc1ccnc(C[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)n1 ZINC000459753627 339046352 /nfs/dbraw/zinc/04/63/52/339046352.db2.gz RSOWKOSMRYUWRE-LJQANCHMSA-N 1 2 307.441 4.292 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(C(C)(F)F)cc2)c(C)[nH+]1 ZINC000459927956 339050763 /nfs/dbraw/zinc/05/07/63/339050763.db2.gz JCZXEDILIKGSHQ-UHFFFAOYSA-N 1 2 304.340 4.371 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2ccc(C)c(F)c2)cs1 ZINC000165229775 339052865 /nfs/dbraw/zinc/05/28/65/339052865.db2.gz JPQOCXDTCYDURW-VXGBXAGGSA-N 1 2 308.422 4.149 20 0 DIADLO COC[C@@H](C)SCCCCCn1c(C)[nH+]c2ccccc21 ZINC000461253892 339060819 /nfs/dbraw/zinc/06/08/19/339060819.db2.gz YWDBSUDJSCBAFG-CQSZACIVSA-N 1 2 306.475 4.283 20 0 DIADLO CC[C@H](C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1)C1CCC(C)CC1 ZINC000461344953 339062132 /nfs/dbraw/zinc/06/21/32/339062132.db2.gz OJGPXFTYUOVJMD-GQGLESIBSA-N 1 2 317.477 4.316 20 0 DIADLO Fc1ccc2c(c1F)C[N@H+](Cc1ccc(C(F)F)cc1)CC2 ZINC000461385085 339062707 /nfs/dbraw/zinc/06/27/07/339062707.db2.gz HKWXAUOGPVSMOX-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO Fc1ccc2c(c1F)C[N@@H+](Cc1ccc(C(F)F)cc1)CC2 ZINC000461385085 339062708 /nfs/dbraw/zinc/06/27/08/339062708.db2.gz HKWXAUOGPVSMOX-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO CCC[C@@H]1C[C@H]1C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000461928860 339069027 /nfs/dbraw/zinc/06/90/27/339069027.db2.gz PFRUWJZBSUIEJM-NVXWUHKLSA-N 1 2 323.440 4.261 20 0 DIADLO CSc1ccc(OCCn2c[nH+]c3cc(F)c(F)cc32)cc1 ZINC000462566974 339081556 /nfs/dbraw/zinc/08/15/56/339081556.db2.gz PHWPJRKXZCTICR-UHFFFAOYSA-N 1 2 320.364 4.115 20 0 DIADLO CCN(c1cc[nH+]c(C)n1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000462806068 339090322 /nfs/dbraw/zinc/09/03/22/339090322.db2.gz OTTADRFPSIFAQC-NSHDSACASA-N 1 2 309.335 4.391 20 0 DIADLO CC(C)(C)c1cnc(C[NH+]2CC(c3ccccc3F)C2)s1 ZINC000462828208 339092725 /nfs/dbraw/zinc/09/27/25/339092725.db2.gz VBKQLBMCXLUTJD-UHFFFAOYSA-N 1 2 304.434 4.179 20 0 DIADLO CCCn1c2ccccc2nc1C[NH+]1CC(c2ccccc2F)C1 ZINC000462828187 339092733 /nfs/dbraw/zinc/09/27/33/339092733.db2.gz UXDAAIFYGBJHBM-UHFFFAOYSA-N 1 2 323.415 4.185 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@H]3CS[C@@H](C(C)C)C3)cc2)c1C ZINC000463032666 339102003 /nfs/dbraw/zinc/10/20/03/339102003.db2.gz ISJBSIXOKFRGTO-SJLPKXTDSA-N 1 2 315.486 4.431 20 0 DIADLO Fc1ccc2nc(C[NH+]3CC(c4ccccc4F)C3)sc2c1 ZINC000463035690 339102077 /nfs/dbraw/zinc/10/20/77/339102077.db2.gz JAAOUJCCVFTESQ-UHFFFAOYSA-N 1 2 316.376 4.174 20 0 DIADLO CCC(CC)[C@@H](C)C(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000463039507 339102528 /nfs/dbraw/zinc/10/25/28/339102528.db2.gz BTWIEGPOKXKIFJ-HUUCEWRRSA-N 1 2 322.518 4.026 20 0 DIADLO CC[C@H](CC(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1)C(C)C ZINC000463040385 339102680 /nfs/dbraw/zinc/10/26/80/339102680.db2.gz VGRWTNUDDNMRJY-JKSUJKDBSA-N 1 2 322.518 4.026 20 0 DIADLO CC(C)[C@@H](C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000463116107 339106356 /nfs/dbraw/zinc/10/63/56/339106356.db2.gz MTJCENILOCJCBD-LJQANCHMSA-N 1 2 319.408 4.251 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CCC(F)(F)[C@H](CO)C1 ZINC000463227468 339110527 /nfs/dbraw/zinc/11/05/27/339110527.db2.gz AXRDUUIUDZEZQW-ONGXEEELSA-N 1 2 324.198 4.004 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCC(F)(F)[C@H](CO)C1 ZINC000463227468 339110528 /nfs/dbraw/zinc/11/05/28/339110528.db2.gz AXRDUUIUDZEZQW-ONGXEEELSA-N 1 2 324.198 4.004 20 0 DIADLO Cc1cc(N2CCc3cc(Cl)c(Cl)cc3[C@@H]2C)nc[nH+]1 ZINC000463474558 339119108 /nfs/dbraw/zinc/11/91/08/339119108.db2.gz AIAJIPNNUWHTDI-JTQLQIEISA-N 1 2 308.212 4.216 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc4cc(C)c(C)cc4o3)ccc2[nH+]1 ZINC000463614862 339122788 /nfs/dbraw/zinc/12/27/88/339122788.db2.gz OUQDHGPHTARVCY-UHFFFAOYSA-N 1 2 319.364 4.258 20 0 DIADLO CC[C@@H](C)C[C@H](C)NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000463912469 339128848 /nfs/dbraw/zinc/12/88/48/339128848.db2.gz AKAAIHVSPJKOHA-CABCVRRESA-N 1 2 312.413 4.428 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2)[C@H](c2ccccc2)CO1 ZINC000464826265 339155422 /nfs/dbraw/zinc/15/54/22/339155422.db2.gz ZJKJUTUHDJFGQR-KDOFPFPSSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2)[C@H](c2ccccc2)CO1 ZINC000464826265 339155423 /nfs/dbraw/zinc/15/54/23/339155423.db2.gz ZJKJUTUHDJFGQR-KDOFPFPSSA-N 1 2 301.817 4.302 20 0 DIADLO CCCc1noc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccc(CC)o2)n1 ZINC000464837304 339156420 /nfs/dbraw/zinc/15/64/20/339156420.db2.gz MHOHHWALUJSRGG-DZGCQCFKSA-N 1 2 317.433 4.151 20 0 DIADLO CCCc1noc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccc(CC)o2)n1 ZINC000464837304 339156421 /nfs/dbraw/zinc/15/64/21/339156421.db2.gz MHOHHWALUJSRGG-DZGCQCFKSA-N 1 2 317.433 4.151 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccn(-c3ccccc3)n2)[C@H](c2ccco2)C1 ZINC000464847455 339157540 /nfs/dbraw/zinc/15/75/40/339157540.db2.gz FKVIBBGIPXOKBN-LPHOPBHVSA-N 1 2 321.424 4.439 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccn(-c3ccccc3)n2)[C@H](c2ccco2)C1 ZINC000464847455 339157541 /nfs/dbraw/zinc/15/75/41/339157541.db2.gz FKVIBBGIPXOKBN-LPHOPBHVSA-N 1 2 321.424 4.439 20 0 DIADLO CC(C)CCc1noc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccco2)n1 ZINC000464863098 339158838 /nfs/dbraw/zinc/15/88/38/339158838.db2.gz ZOPWAMDQUKIWKO-CABCVRRESA-N 1 2 317.433 4.224 20 0 DIADLO CC(C)CCc1noc(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccco2)n1 ZINC000464863098 339158839 /nfs/dbraw/zinc/15/88/39/339158839.db2.gz ZOPWAMDQUKIWKO-CABCVRRESA-N 1 2 317.433 4.224 20 0 DIADLO COc1ccc2c(c1)[nH+]ccc2OCc1cccc(F)c1F ZINC000465014170 339165548 /nfs/dbraw/zinc/16/55/48/339165548.db2.gz KDFYWKCIMNTDMI-UHFFFAOYSA-N 1 2 301.292 4.101 20 0 DIADLO CC(C)CCOc1ccc(NC(=O)c2ccc3[nH+]ccn3c2)cc1 ZINC000465345781 339174733 /nfs/dbraw/zinc/17/47/33/339174733.db2.gz QTNAAIKLXGCWHL-UHFFFAOYSA-N 1 2 323.396 4.012 20 0 DIADLO OC[C@@H]([NH2+]Cc1ccsc1Cl)c1cccc(Cl)c1F ZINC000466398980 339202504 /nfs/dbraw/zinc/20/25/04/339202504.db2.gz LCMPQKYPCGHXQY-LLVKDONJSA-N 1 2 320.216 4.017 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(Cl)c1Cl)CO2 ZINC000466458800 339205816 /nfs/dbraw/zinc/20/58/16/339205816.db2.gz QJAUTCHOBIWXQN-CYBMUJFWSA-N 1 2 312.171 4.356 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1ccc3ccccc3[nH+]1)CCO2 ZINC000466497656 339207443 /nfs/dbraw/zinc/20/74/43/339207443.db2.gz SRJUGHMEAIGUAY-KRWDZBQOSA-N 1 2 306.365 4.179 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc(-c4ccccc4)cn3)n2c1 ZINC000466617031 339210586 /nfs/dbraw/zinc/21/05/86/339210586.db2.gz HJQPXNDBHBFAHS-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO Cc1ccoc1CNc1cccc(-c2ccc3c(c2)CCO3)[nH+]1 ZINC000466632618 339211101 /nfs/dbraw/zinc/21/11/01/339211101.db2.gz AMGTUHLCDIFIBW-UHFFFAOYSA-N 1 2 306.365 4.197 20 0 DIADLO COCC[C@H]1CCCCN(c2cc(C)[nH+]c3c(F)cccc23)C1 ZINC000466632725 339211178 /nfs/dbraw/zinc/21/11/78/339211178.db2.gz BQTLCVCUQJOWGH-OAHLLOKOSA-N 1 2 316.420 4.325 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ncccc3-c3ccccc3)n2c1 ZINC000466636598 339211338 /nfs/dbraw/zinc/21/13/38/339211338.db2.gz TZXPVEYHPHMGOM-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO c1c(CSC[C@H]2CCC3(CCCCC3)O2)[nH+]c2ccccn12 ZINC000466733774 339214834 /nfs/dbraw/zinc/21/48/34/339214834.db2.gz FBGYVKBNGGMCSZ-MRXNPFEDSA-N 1 2 316.470 4.449 20 0 DIADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@@H](Nc2cnn(CC(C)C)c2)C1 ZINC000467344120 339232747 /nfs/dbraw/zinc/23/27/47/339232747.db2.gz GLKOJPQXMCMFCV-IAGOWNOFSA-N 1 2 312.461 4.381 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@@H](Nc2cnn(CC(C)C)c2)C1 ZINC000467344119 339232813 /nfs/dbraw/zinc/23/28/13/339232813.db2.gz GLKOJPQXMCMFCV-DLBZAZTESA-N 1 2 312.461 4.381 20 0 DIADLO c1cn(Cc2ccccc2)c(CSCCc2ccccc2)[nH+]1 ZINC000467561024 339242692 /nfs/dbraw/zinc/24/26/92/339242692.db2.gz XVNGBZSFLGDYKP-UHFFFAOYSA-N 1 2 308.450 4.407 20 0 DIADLO COc1ccc([C@H](C)[C@H](C)[NH2+][C@@H](C(C)C)C(F)(F)F)cc1 ZINC000468797048 339271048 /nfs/dbraw/zinc/27/10/48/339271048.db2.gz CBHVRWHAJWIICI-XUJVJEKNSA-N 1 2 303.368 4.364 20 0 DIADLO CCCCCc1ccc(NC(=O)[C@H]2CCCc3[nH+]c[nH]c32)cc1 ZINC000469073866 339279291 /nfs/dbraw/zinc/27/92/91/339279291.db2.gz XPWNCTHTAGTLSM-INIZCTEOSA-N 1 2 311.429 4.201 20 0 DIADLO CCCc1nc(C[N@@H+]2CC[C@H](c3c(F)cccc3F)C2)cs1 ZINC000469465201 339290442 /nfs/dbraw/zinc/29/04/42/339290442.db2.gz RPWXSHFUAXONHV-LBPRGKRZSA-N 1 2 322.424 4.363 20 0 DIADLO CCCc1nc(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)cs1 ZINC000469465201 339290443 /nfs/dbraw/zinc/29/04/43/339290443.db2.gz RPWXSHFUAXONHV-LBPRGKRZSA-N 1 2 322.424 4.363 20 0 DIADLO Cc1cccc(NCc2cccc3[nH+]ccn32)c1Br ZINC000469558435 339293259 /nfs/dbraw/zinc/29/32/59/339293259.db2.gz KVEPYGDVXWJGIK-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO Fc1ccc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)nc1 ZINC000469722134 339296693 /nfs/dbraw/zinc/29/66/93/339296693.db2.gz ZVTXYCRJYQXGMN-KRWDZBQOSA-N 1 2 306.331 4.226 20 0 DIADLO Fc1ccc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)nc1 ZINC000469722134 339296694 /nfs/dbraw/zinc/29/66/94/339296694.db2.gz ZVTXYCRJYQXGMN-KRWDZBQOSA-N 1 2 306.331 4.226 20 0 DIADLO CCc1ccc([C@H](CO)[NH2+][C@@H](C)c2csc(C(C)C)n2)cc1 ZINC000469784191 339299731 /nfs/dbraw/zinc/29/97/31/339299731.db2.gz VQZJHOPQUZUWQF-BBRMVZONSA-N 1 2 318.486 4.213 20 0 DIADLO Brc1ccc(SCc2c[nH+]c3ccccn23)cc1 ZINC000469812517 339301788 /nfs/dbraw/zinc/30/17/88/339301788.db2.gz ZBAZORRLFONSTH-UHFFFAOYSA-N 1 2 319.227 4.389 20 0 DIADLO CCc1ccc(-c2ccc(C(=O)N[C@H](CC)c3[nH]cc[nH+]3)o2)cc1 ZINC000470696950 339325272 /nfs/dbraw/zinc/32/52/72/339325272.db2.gz JYOKSSBRGFMFAA-OAHLLOKOSA-N 1 2 323.396 4.113 20 0 DIADLO COc1cc2c(cc1F)C[N@H+](Cc1cccc(C(F)F)c1)CC2 ZINC000470790749 339328245 /nfs/dbraw/zinc/32/82/45/339328245.db2.gz WTUNTIWGLRADMT-UHFFFAOYSA-N 1 2 321.342 4.330 20 0 DIADLO COc1cc2c(cc1F)C[N@@H+](Cc1cccc(C(F)F)c1)CC2 ZINC000470790749 339328246 /nfs/dbraw/zinc/32/82/46/339328246.db2.gz WTUNTIWGLRADMT-UHFFFAOYSA-N 1 2 321.342 4.330 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(-c2cccs2)on1 ZINC000470947069 339332226 /nfs/dbraw/zinc/33/22/26/339332226.db2.gz MWCVQDPHSODBKN-MWLCHTKSSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(-c2cccs2)on1 ZINC000470947069 339332227 /nfs/dbraw/zinc/33/22/27/339332227.db2.gz MWCVQDPHSODBKN-MWLCHTKSSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1csc(-c2ccco2)n1 ZINC000470949670 339332294 /nfs/dbraw/zinc/33/22/94/339332294.db2.gz XIZCZXOKHORIHG-GXSJLCMTSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1csc(-c2ccco2)n1 ZINC000470949670 339332295 /nfs/dbraw/zinc/33/22/95/339332295.db2.gz XIZCZXOKHORIHG-GXSJLCMTSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000470953597 339332638 /nfs/dbraw/zinc/33/26/38/339332638.db2.gz QNJAUGZJHSPYPG-MXWKQRLJSA-N 1 2 304.356 4.306 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000470953597 339332639 /nfs/dbraw/zinc/33/26/39/339332639.db2.gz QNJAUGZJHSPYPG-MXWKQRLJSA-N 1 2 304.356 4.306 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000471043796 339335410 /nfs/dbraw/zinc/33/54/10/339335410.db2.gz HXYYLOGIKMPVBB-VBKZILBWSA-N 1 2 323.415 4.388 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000471043796 339335411 /nfs/dbraw/zinc/33/54/11/339335411.db2.gz HXYYLOGIKMPVBB-VBKZILBWSA-N 1 2 323.415 4.388 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000471043795 339335446 /nfs/dbraw/zinc/33/54/46/339335446.db2.gz HXYYLOGIKMPVBB-JLTOFOAXSA-N 1 2 323.415 4.388 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000471043795 339335447 /nfs/dbraw/zinc/33/54/47/339335447.db2.gz HXYYLOGIKMPVBB-JLTOFOAXSA-N 1 2 323.415 4.388 20 0 DIADLO COc1ccsc1[C@H](C)Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000471580290 339348137 /nfs/dbraw/zinc/34/81/37/339348137.db2.gz HNUCANQSENVUAC-ZDUSSCGKSA-N 1 2 317.458 4.315 20 0 DIADLO CCN(Cc1ccc(N2CCCC2)[nH+]c1)c1ccc2[nH]ccc2c1 ZINC000471812349 339354872 /nfs/dbraw/zinc/35/48/72/339354872.db2.gz VDFTYVFXENGSHU-UHFFFAOYSA-N 1 2 320.440 4.190 20 0 DIADLO Cc1ccc(C[NH2+]Cc2ncc(Cl)s2)c(OCC2CC2)c1 ZINC000472039476 339360159 /nfs/dbraw/zinc/36/01/59/339360159.db2.gz XGTYNCYFJVVONR-UHFFFAOYSA-N 1 2 322.861 4.184 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@@H+]2Cc2ccncc2Cl)cc1 ZINC000472230331 339366610 /nfs/dbraw/zinc/36/66/10/339366610.db2.gz GJXQSOBBURXAGH-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@H+]2Cc2ccncc2Cl)cc1 ZINC000472230331 339366611 /nfs/dbraw/zinc/36/66/11/339366611.db2.gz GJXQSOBBURXAGH-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO CC[C@H]1C[N@H+](Cc2noc(C(C)C)n2)CC[C@@H]1c1ccccc1 ZINC000472247739 339367609 /nfs/dbraw/zinc/36/76/09/339367609.db2.gz SRIOKZDLPZZKAM-RDJZCZTQSA-N 1 2 313.445 4.209 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2noc(C(C)C)n2)CC[C@@H]1c1ccccc1 ZINC000472247739 339367610 /nfs/dbraw/zinc/36/76/10/339367610.db2.gz SRIOKZDLPZZKAM-RDJZCZTQSA-N 1 2 313.445 4.209 20 0 DIADLO Fc1cccc(Cl)c1CCC[N@@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000472578010 339374157 /nfs/dbraw/zinc/37/41/57/339374157.db2.gz DNCRGGIZOJJUTM-INIZCTEOSA-N 1 2 321.827 4.362 20 0 DIADLO Fc1cccc(Cl)c1CCC[N@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000472578010 339374158 /nfs/dbraw/zinc/37/41/58/339374158.db2.gz DNCRGGIZOJJUTM-INIZCTEOSA-N 1 2 321.827 4.362 20 0 DIADLO Cc1ccsc1C[N@@H+](C)Cc1noc(-c2ccccc2C)n1 ZINC000472754682 339376979 /nfs/dbraw/zinc/37/69/79/339376979.db2.gz RCEALUJJDKIQRQ-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccsc1C[N@H+](C)Cc1noc(-c2ccccc2C)n1 ZINC000472754682 339376980 /nfs/dbraw/zinc/37/69/80/339376980.db2.gz RCEALUJJDKIQRQ-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2noc(-c3ccccc3C)n2)cc1 ZINC000472761684 339377043 /nfs/dbraw/zinc/37/70/43/339377043.db2.gz GTFKARKUORBDKP-UHFFFAOYSA-N 1 2 321.424 4.239 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2noc(-c3ccccc3C)n2)cc1 ZINC000472761684 339377044 /nfs/dbraw/zinc/37/70/44/339377044.db2.gz GTFKARKUORBDKP-UHFFFAOYSA-N 1 2 321.424 4.239 20 0 DIADLO Fc1ccccc1SCC[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000472814254 339377781 /nfs/dbraw/zinc/37/77/81/339377781.db2.gz VPFAYVHWAFZJAR-AWEZNQCLSA-N 1 2 323.458 4.053 20 0 DIADLO Fc1ccccc1SCC[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000472814254 339377782 /nfs/dbraw/zinc/37/77/82/339377782.db2.gz VPFAYVHWAFZJAR-AWEZNQCLSA-N 1 2 323.458 4.053 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCSC[C@H]2c2nccs2)cc1C ZINC000473060958 339380882 /nfs/dbraw/zinc/38/08/82/339380882.db2.gz WMALEQXUMHPNOP-INIZCTEOSA-N 1 2 318.511 4.358 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCSC[C@H]2c2nccs2)cc1C ZINC000473060958 339380883 /nfs/dbraw/zinc/38/08/83/339380883.db2.gz WMALEQXUMHPNOP-INIZCTEOSA-N 1 2 318.511 4.358 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCSC[C@H]2c2nccs2)c(C)c1 ZINC000473075695 339381052 /nfs/dbraw/zinc/38/10/52/339381052.db2.gz NKWKYJLTDVLTBM-INIZCTEOSA-N 1 2 318.511 4.358 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCSC[C@H]2c2nccs2)c(C)c1 ZINC000473075695 339381053 /nfs/dbraw/zinc/38/10/53/339381053.db2.gz NKWKYJLTDVLTBM-INIZCTEOSA-N 1 2 318.511 4.358 20 0 DIADLO Fc1ccc(C[C@H]2CC[N@H+](Cc3ncc(Cl)s3)C2)cc1 ZINC000473134194 339381900 /nfs/dbraw/zinc/38/19/00/339381900.db2.gz WHDDNHYTXZBEMI-GFCCVEGCSA-N 1 2 310.825 4.000 20 0 DIADLO Fc1ccc(C[C@H]2CC[N@@H+](Cc3ncc(Cl)s3)C2)cc1 ZINC000473134194 339381901 /nfs/dbraw/zinc/38/19/01/339381901.db2.gz WHDDNHYTXZBEMI-GFCCVEGCSA-N 1 2 310.825 4.000 20 0 DIADLO Clc1cnc(C[NH+]2CCC(Cc3ccccc3)CC2)s1 ZINC000473139718 339382289 /nfs/dbraw/zinc/38/22/89/339382289.db2.gz LATORLVUNONGMZ-UHFFFAOYSA-N 1 2 306.862 4.251 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CCCC[C@@H]3c3ncc[nH]3)cc2c1C ZINC000473142771 339382702 /nfs/dbraw/zinc/38/27/02/339382702.db2.gz UECYETZBYGJJOG-GOSISDBHSA-N 1 2 308.429 4.235 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CCCC[C@@H]3c3ncc[nH]3)cc2c1C ZINC000473142771 339382703 /nfs/dbraw/zinc/38/27/03/339382703.db2.gz UECYETZBYGJJOG-GOSISDBHSA-N 1 2 308.429 4.235 20 0 DIADLO Cc1cccc(NC2CC[NH+](Cc3ncc(Cl)s3)CC2)c1 ZINC000473145844 339382721 /nfs/dbraw/zinc/38/27/21/339382721.db2.gz KVUHIBBMYCYYSU-UHFFFAOYSA-N 1 2 321.877 4.181 20 0 DIADLO CC[N@H+](Cc1ncc(Cl)s1)Cc1cccc(Cl)c1 ZINC000473145575 339382958 /nfs/dbraw/zinc/38/29/58/339382958.db2.gz JSHJUFRVOPURTL-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC[N@@H+](Cc1ncc(Cl)s1)Cc1cccc(Cl)c1 ZINC000473145575 339382959 /nfs/dbraw/zinc/38/29/59/339382959.db2.gz JSHJUFRVOPURTL-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO CC(C)[C@@H](NC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1)c1[nH]cc[nH+]1 ZINC000473295976 339384298 /nfs/dbraw/zinc/38/42/98/339384298.db2.gz MKQPDCIBNNOULM-IJEWVQPXSA-N 1 2 305.466 4.076 20 0 DIADLO C[C@@H](CCOc1cccc(-n2cc[nH+]c2)c1)OCc1ccccc1 ZINC000473674518 339390091 /nfs/dbraw/zinc/39/00/91/339390091.db2.gz IIIWMOMNKPMNET-KRWDZBQOSA-N 1 2 322.408 4.247 20 0 DIADLO CCc1[nH+]c(C)ccc1OCc1ncc(-c2ccccc2F)o1 ZINC000473675758 339390144 /nfs/dbraw/zinc/39/01/44/339390144.db2.gz MGSXMCNJYKOEHR-UHFFFAOYSA-N 1 2 312.344 4.326 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2cc3cccc(F)c3o2)cs1 ZINC000473992846 339396605 /nfs/dbraw/zinc/39/66/05/339396605.db2.gz FWTDVLYHFVEYFP-JTQLQIEISA-N 1 2 304.390 4.442 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000473999336 339396740 /nfs/dbraw/zinc/39/67/40/339396740.db2.gz HXUBRAUERTZDQM-SWLSCSKDSA-N 1 2 311.381 4.448 20 0 DIADLO Cc1cc(N2CC[C@@H](C)[C@H]2c2cccc(F)c2)nc(C2CC2)[nH+]1 ZINC000474152962 339404597 /nfs/dbraw/zinc/40/45/97/339404597.db2.gz JOAVPKVLSCDVSA-XIKOKIGWSA-N 1 2 311.404 4.389 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)NCC(C)C)c1 ZINC000477956329 339506054 /nfs/dbraw/zinc/50/60/54/339506054.db2.gz VPIIXHWNYPCUOL-UHFFFAOYSA-N 1 2 314.433 4.128 20 0 DIADLO Cc1ccc(C(=O)N(Cc2[nH]cc[nH+]2)c2cccc(F)c2)cc1C ZINC000479379794 339532403 /nfs/dbraw/zinc/53/24/03/339532403.db2.gz PDYSLBWUCOUTNK-UHFFFAOYSA-N 1 2 323.371 4.013 20 0 DIADLO C[C@@H]([NH2+][C@@H](CO)c1c(Cl)cccc1Cl)c1ccsc1 ZINC000479560987 339541297 /nfs/dbraw/zinc/54/12/97/339541297.db2.gz SNFLOIGILDJZFN-RNCFNFMXSA-N 1 2 316.253 4.439 20 0 DIADLO Cc1cccc2ncnc(Nc3ccc(N4CCCCC4)[nH+]c3)c12 ZINC000484820623 339693821 /nfs/dbraw/zinc/69/38/21/339693821.db2.gz YYINZCHTWIOXBS-UHFFFAOYSA-N 1 2 319.412 4.067 20 0 DIADLO C/C(=C/c1ccccc1)CN(C)C(=O)Nc1c(C)cc[nH+]c1C ZINC000485480810 339704261 /nfs/dbraw/zinc/70/42/61/339704261.db2.gz LQKBPUQQVWCYCU-OWBHPGMISA-N 1 2 309.413 4.266 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)Cc1ccc(Cl)c(Cl)c1 ZINC000485484435 339704357 /nfs/dbraw/zinc/70/43/57/339704357.db2.gz BHGFDOKVPZQIHJ-UHFFFAOYSA-N 1 2 309.196 4.186 20 0 DIADLO Cc1ccncc1C(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000485662497 339708568 /nfs/dbraw/zinc/70/85/68/339708568.db2.gz DRUVBIZXTULUGY-UHFFFAOYSA-N 1 2 319.408 4.044 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)Cc2ccsc2)c1C(C)C ZINC000485666653 339708656 /nfs/dbraw/zinc/70/86/56/339708656.db2.gz XSHUJJWPXBDDHI-UHFFFAOYSA-N 1 2 324.449 4.331 20 0 DIADLO Cc1cc(Br)cc(NCc2ccc(C)[nH+]c2C)c1 ZINC000486132732 339721876 /nfs/dbraw/zinc/72/18/76/339721876.db2.gz WXTUCOOZEYEGND-UHFFFAOYSA-N 1 2 305.219 4.381 20 0 DIADLO COc1cc(C)cc(NCc2cn3cc(Cl)ccc3[nH+]2)c1C ZINC000487201089 339746142 /nfs/dbraw/zinc/74/61/42/339746142.db2.gz JEGYDIBQVRRZLE-UHFFFAOYSA-N 1 2 315.804 4.225 20 0 DIADLO Cc1cc(NC(=O)[C@H]2C[C@@H]2C(C)C)ccc1Oc1cc[nH+]cc1 ZINC000487708174 339761465 /nfs/dbraw/zinc/76/14/65/339761465.db2.gz LWHHKXGBIAYLOV-SJORKVTESA-N 1 2 310.397 4.413 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC[C@H](CSC)C1 ZINC000488986378 339799180 /nfs/dbraw/zinc/79/91/80/339799180.db2.gz RYYLKPVHNNMSRC-AWEZNQCLSA-N 1 2 316.470 4.131 20 0 DIADLO CCCC[C@@H](CC)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000490567605 339834541 /nfs/dbraw/zinc/83/45/41/339834541.db2.gz SNBLVDVPYJEGLW-CYBMUJFWSA-N 1 2 303.381 4.166 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCC2)c1nc(C(C)(C)C)no1 ZINC000491401004 339860866 /nfs/dbraw/zinc/86/08/66/339860866.db2.gz NJKYVABNDZAURI-CYBMUJFWSA-N 1 2 313.445 4.097 20 0 DIADLO CCCC(C)(C)CC(=O)N(C)[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000493033199 339915516 /nfs/dbraw/zinc/91/55/16/339915516.db2.gz CPXXVPPCPHJQDZ-KRWDZBQOSA-N 1 2 313.445 4.174 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)/C=C\C1CCCCC1 ZINC000493293508 339922302 /nfs/dbraw/zinc/92/23/02/339922302.db2.gz LJMNYXBKTYUDDF-WFTPILKQSA-N 1 2 315.461 4.093 20 0 DIADLO CCCc1csc(C[NH2+][C@H](c2nc(C)cs2)C2CC2)n1 ZINC000494151461 339942261 /nfs/dbraw/zinc/94/22/61/339942261.db2.gz CBRLRVLKWISUSO-AWEZNQCLSA-N 1 2 307.488 4.101 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCC(=O)NCCCCC(C)(C)C ZINC000496470884 340006148 /nfs/dbraw/zinc/00/61/48/340006148.db2.gz PXPDSTQAFUDHMO-UHFFFAOYSA-N 1 2 315.461 4.067 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2cccc(Cl)c2Cl)n1 ZINC000496897832 340015625 /nfs/dbraw/zinc/01/56/25/340015625.db2.gz HXEWJGQPFUARQQ-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)n1 ZINC000496897832 340015626 /nfs/dbraw/zinc/01/56/26/340015626.db2.gz HXEWJGQPFUARQQ-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Br)ccc2Cl)CCS1 ZINC000497001375 340018024 /nfs/dbraw/zinc/01/80/24/340018024.db2.gz LJCSDCJUGASVAD-SECBINFHSA-N 1 2 320.683 4.040 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Br)ccc2Cl)CCS1 ZINC000497001375 340018025 /nfs/dbraw/zinc/01/80/25/340018025.db2.gz LJCSDCJUGASVAD-SECBINFHSA-N 1 2 320.683 4.040 20 0 DIADLO Cc1cc(N(C)[C@@H](C)c2ccc(F)cc2)nc(-c2ccncc2)[nH+]1 ZINC000498825895 340024004 /nfs/dbraw/zinc/02/40/04/340024004.db2.gz VHRPFPZHWJBSEM-AWEZNQCLSA-N 1 2 322.387 4.184 20 0 DIADLO Cc1cc(N(C)[C@@H](C)c2ccccc2F)nc(-c2ccncc2)[nH+]1 ZINC000498832136 340024090 /nfs/dbraw/zinc/02/40/90/340024090.db2.gz JFHBGOFXRHQLKI-AWEZNQCLSA-N 1 2 322.387 4.184 20 0 DIADLO CCc1cc(N2CC[C@@H]2c2ccccc2)nc(-c2ccncc2)[nH+]1 ZINC000498841417 340024269 /nfs/dbraw/zinc/02/42/69/340024269.db2.gz WHOBMKRXHWUQAI-GOSISDBHSA-N 1 2 316.408 4.052 20 0 DIADLO FC(F)Oc1ccc[nH+]c1NCc1cccc(C(F)(F)F)c1 ZINC000498887347 340025075 /nfs/dbraw/zinc/02/50/75/340025075.db2.gz FJRMFJRHRDLGLO-UHFFFAOYSA-N 1 2 318.245 4.314 20 0 DIADLO Cc1cc(N(Cc2ccccc2)Cc2ccccc2F)nc[nH+]1 ZINC000498999667 340027613 /nfs/dbraw/zinc/02/76/13/340027613.db2.gz MJOHZESKXXWXDG-UHFFFAOYSA-N 1 2 307.372 4.131 20 0 DIADLO C[C@@H]1CC[C@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)[C@@H](C)C1 ZINC000499150937 340031270 /nfs/dbraw/zinc/03/12/70/340031270.db2.gz ZWZNKOVRVYEVDZ-VCBZYWHSSA-N 1 2 324.424 4.428 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC000499566220 340039559 /nfs/dbraw/zinc/03/95/59/340039559.db2.gz VNCYYHGBEIPTRK-SFHVURJKSA-N 1 2 319.399 4.469 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC000499566220 340039560 /nfs/dbraw/zinc/03/95/60/340039560.db2.gz VNCYYHGBEIPTRK-SFHVURJKSA-N 1 2 319.399 4.469 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@@H+]1Cc1ccccc1C(F)(F)F ZINC000500415090 340057460 /nfs/dbraw/zinc/05/74/60/340057460.db2.gz JISJWRRDWWESOM-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@H+]1Cc1ccccc1C(F)(F)F ZINC000500415090 340057461 /nfs/dbraw/zinc/05/74/61/340057461.db2.gz JISJWRRDWWESOM-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CCc3cc(F)ccc3C2)s1 ZINC000500768183 340066873 /nfs/dbraw/zinc/06/68/73/340066873.db2.gz DPFSJZCQWCXUSG-UHFFFAOYSA-N 1 2 304.434 4.138 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CCc3cc(F)ccc3C2)s1 ZINC000500768183 340066874 /nfs/dbraw/zinc/06/68/74/340066874.db2.gz DPFSJZCQWCXUSG-UHFFFAOYSA-N 1 2 304.434 4.138 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000501397447 340080061 /nfs/dbraw/zinc/08/00/61/340080061.db2.gz XCGHFIWAHXNMHV-HNNXBMFYSA-N 1 2 310.825 4.397 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000501397447 340080062 /nfs/dbraw/zinc/08/00/62/340080062.db2.gz XCGHFIWAHXNMHV-HNNXBMFYSA-N 1 2 310.825 4.397 20 0 DIADLO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+]1CC[C@@](C)(F)C1 ZINC000501415851 340080487 /nfs/dbraw/zinc/08/04/87/340080487.db2.gz FYRZUGZPLQSYAJ-MEDUHNTESA-N 1 2 308.784 4.490 20 0 DIADLO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1CC[C@@](C)(F)C1 ZINC000501415851 340080488 /nfs/dbraw/zinc/08/04/88/340080488.db2.gz FYRZUGZPLQSYAJ-MEDUHNTESA-N 1 2 308.784 4.490 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCNc1ncc(Cl)cc1Cl ZINC000501936541 340091095 /nfs/dbraw/zinc/09/10/95/340091095.db2.gz VKYKTBPFVWYUKE-UHFFFAOYSA-N 1 2 321.211 4.159 20 0 DIADLO CCCOc1cccc2c(N[C@H]3CCO[C@@H](C)C3)cc[nH+]c12 ZINC000502007361 340092718 /nfs/dbraw/zinc/09/27/18/340092718.db2.gz WSUULKAEFYBBSR-KBPBESRZSA-N 1 2 300.402 4.003 20 0 DIADLO c1cnn(-c2ccc([NH2+][C@@H]3CCC[C@@H](c4cccnc4)C3)cc2)c1 ZINC000502238775 340097426 /nfs/dbraw/zinc/09/74/26/340097426.db2.gz CHLNRFWYUMUZFE-VQIMIIECSA-N 1 2 318.424 4.406 20 0 DIADLO Cc1ccc(CC(=O)Nc2ccc3[nH]c(C4CCC4)[nH+]c3c2)cc1 ZINC000502459014 340104456 /nfs/dbraw/zinc/10/44/56/340104456.db2.gz VBBKQNBXVYYSCL-UHFFFAOYSA-N 1 2 319.408 4.320 20 0 DIADLO CC[C@@H]1C[C@]1([NH2+]Cc1nc(-c2ccoc2)no1)c1cccc(C)c1 ZINC000502483731 340105680 /nfs/dbraw/zinc/10/56/80/340105680.db2.gz JTIUTCZSGKRRDY-DNVCBOLYSA-N 1 2 323.396 4.053 20 0 DIADLO COc1cc(C[N@@H+]2CCc3cccc(F)c3C2)ccc1SC ZINC000502521366 340106772 /nfs/dbraw/zinc/10/67/72/340106772.db2.gz HFTPYSRGURPJPA-UHFFFAOYSA-N 1 2 317.429 4.115 20 0 DIADLO COc1cc(C[N@H+]2CCc3cccc(F)c3C2)ccc1SC ZINC000502521366 340106773 /nfs/dbraw/zinc/10/67/73/340106773.db2.gz HFTPYSRGURPJPA-UHFFFAOYSA-N 1 2 317.429 4.115 20 0 DIADLO CCCCc1noc(C[NH2+][C@@]2(c3cccc(C)c3)C[C@H]2CC)n1 ZINC000502592361 340108618 /nfs/dbraw/zinc/10/86/18/340108618.db2.gz PLYPBSOBACVDSW-BEFAXECRSA-N 1 2 313.445 4.136 20 0 DIADLO Cc1cc(F)cc2c1C[N@H+](Cc1ccn(C3CCCC3)n1)CC2 ZINC000502876918 340115248 /nfs/dbraw/zinc/11/52/48/340115248.db2.gz KTYSKJLYRMQXPZ-UHFFFAOYSA-N 1 2 313.420 4.004 20 0 DIADLO Cc1cc(F)cc2c1C[N@@H+](Cc1ccn(C3CCCC3)n1)CC2 ZINC000502876918 340115249 /nfs/dbraw/zinc/11/52/49/340115249.db2.gz KTYSKJLYRMQXPZ-UHFFFAOYSA-N 1 2 313.420 4.004 20 0 DIADLO CCc1nc(C[N@@H+]2CC[C@@](F)(c3ccccc3C)C2)cs1 ZINC000502939742 340117202 /nfs/dbraw/zinc/11/72/02/340117202.db2.gz MSNFYNNXJBZNTG-KRWDZBQOSA-N 1 2 304.434 4.085 20 0 DIADLO CCc1nc(C[N@H+]2CC[C@@](F)(c3ccccc3C)C2)cs1 ZINC000502939742 340117203 /nfs/dbraw/zinc/11/72/03/340117203.db2.gz MSNFYNNXJBZNTG-KRWDZBQOSA-N 1 2 304.434 4.085 20 0 DIADLO CCc1cnc(C[N@@H+]2CC[C@](F)(c3ccccc3C)C2)s1 ZINC000503099800 340121029 /nfs/dbraw/zinc/12/10/29/340121029.db2.gz DTIPGEGXQRWCGH-QGZVFWFLSA-N 1 2 304.434 4.085 20 0 DIADLO CCc1cnc(C[N@H+]2CC[C@](F)(c3ccccc3C)C2)s1 ZINC000503099800 340121030 /nfs/dbraw/zinc/12/10/30/340121030.db2.gz DTIPGEGXQRWCGH-QGZVFWFLSA-N 1 2 304.434 4.085 20 0 DIADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1c(F)cccc1F ZINC000503170733 340122480 /nfs/dbraw/zinc/12/24/80/340122480.db2.gz QCLIWKRMAXQAMA-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000503201079 340123215 /nfs/dbraw/zinc/12/32/15/340123215.db2.gz YYAKIUKDDPTXBH-UHFFFAOYSA-N 1 2 322.408 4.375 20 0 DIADLO C[C@@H]1C[C@]1([NH2+]Cc1nc(C(C)(C)C)no1)c1ccc(Cl)cc1 ZINC000503379258 340126925 /nfs/dbraw/zinc/12/69/25/340126925.db2.gz UVUSKQMDFLQHLI-PIGZYNQJSA-N 1 2 319.836 4.045 20 0 DIADLO CCCOc1cccc2c(N[C@H](C)[C@@H]3CCCOC3)cc[nH+]c12 ZINC000503577037 340131412 /nfs/dbraw/zinc/13/14/12/340131412.db2.gz UHYMJZFFOSKWQI-HUUCEWRRSA-N 1 2 314.429 4.251 20 0 DIADLO Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]C1(C(F)F)CC1 ZINC000503853520 340135128 /nfs/dbraw/zinc/13/51/28/340135128.db2.gz DPLAGVRUWKFONX-LBPRGKRZSA-N 1 2 322.424 4.491 20 0 DIADLO CC[C@H]([NH2+]C1(C(F)F)CC1)c1cc(F)cc(Br)c1 ZINC000503887632 340135796 /nfs/dbraw/zinc/13/57/96/340135796.db2.gz RLQBVWWPJRXDMI-NSHDSACASA-N 1 2 322.168 4.427 20 0 DIADLO C[C@H]1C[C@H](C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)C[C@@H](C)C1 ZINC000504072492 340140311 /nfs/dbraw/zinc/14/03/11/340140311.db2.gz FGKIVASJKJGCSD-FOLVSLTJSA-N 1 2 311.429 4.098 20 0 DIADLO CCC(CC)[C@@H](NC(=O)Nc1cc[nH+]cc1C)c1cccs1 ZINC000504155647 340141977 /nfs/dbraw/zinc/14/19/77/340141977.db2.gz GZPVVBGXVGJXBV-MRXNPFEDSA-N 1 2 317.458 4.172 20 0 DIADLO CCCN(C(=O)Nc1cc[nH+]cc1C)[C@H](CC)c1ccccc1 ZINC000504158752 340142126 /nfs/dbraw/zinc/14/21/26/340142126.db2.gz ZOHZOXKSCMCJFX-GOSISDBHSA-N 1 2 311.429 4.207 20 0 DIADLO Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)Nc2cc[nH+]c(C)c2)cc1 ZINC000504161564 340142137 /nfs/dbraw/zinc/14/21/37/340142137.db2.gz FVXVGXSKNSBSIO-DNVCBOLYSA-N 1 2 323.440 4.125 20 0 DIADLO Cc1cccc([C@@H](NC(=O)Nc2cc[nH+]cc2C)C(C)(C)C)c1 ZINC000504167075 340142338 /nfs/dbraw/zinc/14/23/38/340142338.db2.gz BHAQAOIYCNCDJJ-QGZVFWFLSA-N 1 2 311.429 4.029 20 0 DIADLO C[NH+](C)[C@H](c1nc(-c2cccs2)no1)c1cccc(Cl)c1 ZINC000504247220 340143731 /nfs/dbraw/zinc/14/37/31/340143731.db2.gz QGMKMTOVHPJYGL-ZDUSSCGKSA-N 1 2 319.817 4.103 20 0 DIADLO CC[C@@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000504382243 340146604 /nfs/dbraw/zinc/14/66/04/340146604.db2.gz RKQQMFHVMNGSQB-INIZCTEOSA-N 1 2 319.408 4.395 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)CCCc1ccccc1 ZINC000504656460 340150646 /nfs/dbraw/zinc/15/06/46/340150646.db2.gz ZBEHAMPGTOCNIV-UHFFFAOYSA-N 1 2 312.413 4.220 20 0 DIADLO C[C@H]1CC(C)(C)c2ccccc2N1C(=O)c1ccc2[nH+]ccn2c1 ZINC000504855029 340153892 /nfs/dbraw/zinc/15/38/92/340153892.db2.gz YBRMCDPGVJFGTI-AWEZNQCLSA-N 1 2 319.408 4.051 20 0 DIADLO C[C@H]1CCc2nc(C[N@H+](C)Cc3cccc(F)c3)sc2C1 ZINC000505577489 340171662 /nfs/dbraw/zinc/17/16/62/340171662.db2.gz WWUYZNVNTMQLLA-LBPRGKRZSA-N 1 2 304.434 4.039 20 0 DIADLO C[C@H]1CCc2nc(C[N@@H+](C)Cc3cccc(F)c3)sc2C1 ZINC000505577489 340171663 /nfs/dbraw/zinc/17/16/63/340171663.db2.gz WWUYZNVNTMQLLA-LBPRGKRZSA-N 1 2 304.434 4.039 20 0 DIADLO CCCn1c(C[N@H+](C)Cc2ccccc2OC)nc2ccccc21 ZINC000505611848 340172888 /nfs/dbraw/zinc/17/28/88/340172888.db2.gz RJJXDEIGLZWMAW-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO CCCn1c(C[N@@H+](C)Cc2ccccc2OC)nc2ccccc21 ZINC000505611848 340172889 /nfs/dbraw/zinc/17/28/89/340172889.db2.gz RJJXDEIGLZWMAW-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO CC(C)(C)c1noc(C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)n1 ZINC000505873799 340180426 /nfs/dbraw/zinc/18/04/26/340180426.db2.gz BBTDIIZEPLXYDP-YUQCYMQKSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1noc(C[N@H+]2CCC[C@@H]2/C=C\c2ccccc2)n1 ZINC000505873799 340180427 /nfs/dbraw/zinc/18/04/27/340180427.db2.gz BBTDIIZEPLXYDP-YUQCYMQKSA-N 1 2 311.429 4.045 20 0 DIADLO CC[C@@H](CN1CC[NH+](CCc2ccccc2)CC1)c1ccccc1 ZINC000506270298 340190685 /nfs/dbraw/zinc/19/06/85/340190685.db2.gz UTRWFROMZNATAC-NRFANRHFSA-N 1 2 322.496 4.041 20 0 DIADLO Fc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c(Cl)c1 ZINC000506343191 340192989 /nfs/dbraw/zinc/19/29/89/340192989.db2.gz VDDMTTPJVVPKCH-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)c(Cl)c1 ZINC000506343191 340192990 /nfs/dbraw/zinc/19/29/90/340192990.db2.gz VDDMTTPJVVPKCH-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Cc1cccn2c(CN(C)Cc3c(F)cccc3Cl)c[nH+]c12 ZINC000506773341 340201569 /nfs/dbraw/zinc/20/15/69/340201569.db2.gz CZJFWOZHIAUMNO-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@@H]2/C=C\c2ccccc2)c(C)[nH+]1 ZINC000506782144 340201585 /nfs/dbraw/zinc/20/15/85/340201585.db2.gz VEIZDAJWHGWWTQ-YUIUBULTSA-N 1 2 321.424 4.408 20 0 DIADLO CC[C@H](C)N(C)C(=O)Nc1c[nH+]c(N2CCCC[C@H]2C)c(C)c1 ZINC000506988175 340204809 /nfs/dbraw/zinc/20/48/09/340204809.db2.gz TUMZZGRBSMXSQH-LSDHHAIUSA-N 1 2 318.465 4.031 20 0 DIADLO COc1ccc(C[N@H+](Cc2cccc(O)c2Cl)C2CC2)cc1 ZINC000507023912 340205664 /nfs/dbraw/zinc/20/56/64/340205664.db2.gz XYSVPFHXPYLSCQ-UHFFFAOYSA-N 1 2 317.816 4.219 20 0 DIADLO COc1ccc(C[N@@H+](Cc2cccc(O)c2Cl)C2CC2)cc1 ZINC000507023912 340205665 /nfs/dbraw/zinc/20/56/65/340205665.db2.gz XYSVPFHXPYLSCQ-UHFFFAOYSA-N 1 2 317.816 4.219 20 0 DIADLO Cc1n[nH]c(C)c1C[N@H+](Cc1c(Cl)cccc1Cl)C1CC1 ZINC000507141424 340209381 /nfs/dbraw/zinc/20/93/81/340209381.db2.gz GDEMBQZUIMRHHV-UHFFFAOYSA-N 1 2 324.255 4.498 20 0 DIADLO Cc1n[nH]c(C)c1C[N@@H+](Cc1c(Cl)cccc1Cl)C1CC1 ZINC000507141424 340209382 /nfs/dbraw/zinc/20/93/82/340209382.db2.gz GDEMBQZUIMRHHV-UHFFFAOYSA-N 1 2 324.255 4.498 20 0 DIADLO Cc1nccc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)n1 ZINC000507157687 340210060 /nfs/dbraw/zinc/21/00/60/340210060.db2.gz BNAGRLQKHRNXKW-LBPRGKRZSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1nccc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)n1 ZINC000507157687 340210061 /nfs/dbraw/zinc/21/00/61/340210061.db2.gz BNAGRLQKHRNXKW-LBPRGKRZSA-N 1 2 301.821 4.164 20 0 DIADLO CSCc1cnc(C[N@H+](Cc2cccc(F)c2)C2CC2)s1 ZINC000507171643 340210803 /nfs/dbraw/zinc/21/08/03/340210803.db2.gz WQGZMUJTOZXVBN-UHFFFAOYSA-N 1 2 322.474 4.310 20 0 DIADLO CSCc1cnc(C[N@@H+](Cc2cccc(F)c2)C2CC2)s1 ZINC000507171643 340210804 /nfs/dbraw/zinc/21/08/04/340210804.db2.gz WQGZMUJTOZXVBN-UHFFFAOYSA-N 1 2 322.474 4.310 20 0 DIADLO Cc1cccc2ncc(C[N@@H+](C)[C@H](C)c3cc(F)ccc3F)n21 ZINC000507201632 340212874 /nfs/dbraw/zinc/21/28/74/340212874.db2.gz GYYGOYOIKBEOCY-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1cccc2ncc(C[N@H+](C)[C@H](C)c3cc(F)ccc3F)n21 ZINC000507201632 340212875 /nfs/dbraw/zinc/21/28/75/340212875.db2.gz GYYGOYOIKBEOCY-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1ccc2[nH+]cc(CN(C)[C@H](C)c3c(F)cccc3F)n2c1 ZINC000507213946 340214031 /nfs/dbraw/zinc/21/40/31/340214031.db2.gz QYQAHQMFUSZNQA-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1c(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)cnn1C ZINC000507227253 340214554 /nfs/dbraw/zinc/21/45/54/340214554.db2.gz DVUQIJXIVLDNDV-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO Cc1c(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)cnn1C ZINC000507227253 340214555 /nfs/dbraw/zinc/21/45/55/340214555.db2.gz DVUQIJXIVLDNDV-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO Cc1ccn2c(CN(C)[C@H](C)c3c(F)cccc3F)c[nH+]c2c1 ZINC000507252773 340215685 /nfs/dbraw/zinc/21/56/85/340215685.db2.gz NZWYZLZZWHZTRH-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO CC[N@H+](Cc1c(F)ccc(O)c1F)[C@@H](C)c1cccc(OC)c1 ZINC000507331562 340217427 /nfs/dbraw/zinc/21/74/27/340217427.db2.gz FUDYOWOYQOHCLH-LBPRGKRZSA-N 1 2 321.367 4.262 20 0 DIADLO CC[N@@H+](Cc1c(F)ccc(O)c1F)[C@@H](C)c1cccc(OC)c1 ZINC000507331562 340217428 /nfs/dbraw/zinc/21/74/28/340217428.db2.gz FUDYOWOYQOHCLH-LBPRGKRZSA-N 1 2 321.367 4.262 20 0 DIADLO COCC[C@@H]([NH2+][C@@H](CCc1ccccc1)C(F)F)c1ccco1 ZINC000507479197 340221792 /nfs/dbraw/zinc/22/17/92/340221792.db2.gz NYFYGOVLUQHHCE-CVEARBPZSA-N 1 2 323.383 4.213 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+]Cc1csc(-c2ccco2)n1 ZINC000507516416 340223789 /nfs/dbraw/zinc/22/37/89/340223789.db2.gz XMQWVJVDIBACLA-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@H+](Cc3ccn(C(F)F)n3)CC2)c1 ZINC000507694326 340228575 /nfs/dbraw/zinc/22/85/75/340228575.db2.gz KXGVLRDQJZAMCJ-UHFFFAOYSA-N 1 2 317.383 4.184 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@@H+](Cc3ccn(C(F)F)n3)CC2)c1 ZINC000507694326 340228576 /nfs/dbraw/zinc/22/85/76/340228576.db2.gz KXGVLRDQJZAMCJ-UHFFFAOYSA-N 1 2 317.383 4.184 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+][C@@H]1CCc2c1c(F)ccc2F ZINC000507794807 340231714 /nfs/dbraw/zinc/23/17/14/340231714.db2.gz QSOKFCDXSWYBAM-ZUZCIYMTSA-N 1 2 321.342 4.451 20 0 DIADLO Fc1ccc(F)c2c1CC[C@H]2[NH2+][C@H]1COc2ccc(Cl)cc21 ZINC000507869507 340234727 /nfs/dbraw/zinc/23/47/27/340234727.db2.gz AIENWDNQWCFPIX-CABCVRRESA-N 1 2 321.754 4.329 20 0 DIADLO COCC[N@H+](CC(F)F)CC(c1ccccc1)c1ccccc1 ZINC000508163562 340239945 /nfs/dbraw/zinc/23/99/45/340239945.db2.gz PGGCNLPOHGRPGH-UHFFFAOYSA-N 1 2 319.395 4.032 20 0 DIADLO COCC[N@@H+](CC(F)F)CC(c1ccccc1)c1ccccc1 ZINC000508163562 340239946 /nfs/dbraw/zinc/23/99/46/340239946.db2.gz PGGCNLPOHGRPGH-UHFFFAOYSA-N 1 2 319.395 4.032 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1cccc(O)c1Cl ZINC000508171145 340240106 /nfs/dbraw/zinc/24/01/06/340240106.db2.gz CZSVIZISECDXDT-SUMWQHHRSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1cccc(O)c1Cl ZINC000508171145 340240107 /nfs/dbraw/zinc/24/01/07/340240107.db2.gz CZSVIZISECDXDT-SUMWQHHRSA-N 1 2 317.816 4.008 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1c(F)ccc(O)c1F ZINC000508187902 340240204 /nfs/dbraw/zinc/24/02/04/340240204.db2.gz RYWQWAKJFGNXAF-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1c(F)ccc(O)c1F ZINC000508187902 340240205 /nfs/dbraw/zinc/24/02/05/340240205.db2.gz RYWQWAKJFGNXAF-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO CSCc1cnc(C[N@@H+]2Cc3ccccc3C(C)(C)C2)s1 ZINC000508598225 340247345 /nfs/dbraw/zinc/24/73/45/340247345.db2.gz FUOSEFQUCADAOL-UHFFFAOYSA-N 1 2 318.511 4.300 20 0 DIADLO CSCc1cnc(C[N@H+]2Cc3ccccc3C(C)(C)C2)s1 ZINC000508598225 340247346 /nfs/dbraw/zinc/24/73/46/340247346.db2.gz FUOSEFQUCADAOL-UHFFFAOYSA-N 1 2 318.511 4.300 20 0 DIADLO O=C(Nc1ccccc1F)c1ccccc1Oc1cc[nH+]cc1 ZINC000509016967 340258377 /nfs/dbraw/zinc/25/83/77/340258377.db2.gz SDBVWTQFXKBYCR-UHFFFAOYSA-N 1 2 308.312 4.265 20 0 DIADLO C[C@H](NC(=O)c1ccccc1Oc1cc[nH+]cc1)c1cccs1 ZINC000509027252 340258691 /nfs/dbraw/zinc/25/86/91/340258691.db2.gz VHIOMDMOAFCOAA-ZDUSSCGKSA-N 1 2 324.405 4.426 20 0 DIADLO C[C@H]1CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C[C@@H](C)C1 ZINC000509189769 340263455 /nfs/dbraw/zinc/26/34/55/340263455.db2.gz IBLVDFPJBSIEBR-HOTGVXAUSA-N 1 2 324.424 4.382 20 0 DIADLO O=C(N[C@H]1CC2CCC1CC2)c1ccccc1Oc1cc[nH+]cc1 ZINC000509189508 340263497 /nfs/dbraw/zinc/26/34/97/340263497.db2.gz ZXMPYBYJPXNTLU-JMLCCBQJSA-N 1 2 322.408 4.182 20 0 DIADLO CCc1ccc2occ(C(=O)Nc3ccc4[nH+]c(C)cn4c3)c2c1 ZINC000509195194 340263683 /nfs/dbraw/zinc/26/36/83/340263683.db2.gz LZPAJFARJFNRDG-UHFFFAOYSA-N 1 2 319.364 4.204 20 0 DIADLO C[C@@H]1c2cccc(Br)c2CC[N@H+]1CCC(F)(F)F ZINC000509437849 340269494 /nfs/dbraw/zinc/26/94/94/340269494.db2.gz QLTZTRWRIKCPSM-SECBINFHSA-N 1 2 322.168 4.321 20 0 DIADLO C[C@@H]1c2cccc(Br)c2CC[N@@H+]1CCC(F)(F)F ZINC000509437849 340269495 /nfs/dbraw/zinc/26/94/95/340269495.db2.gz QLTZTRWRIKCPSM-SECBINFHSA-N 1 2 322.168 4.321 20 0 DIADLO FC(F)(F)[C@H]1CCN(c2[nH]c3ccccc3[nH+]2)CC12CCC2 ZINC000509459623 340270185 /nfs/dbraw/zinc/27/01/85/340270185.db2.gz NVXWDAFFQFPAGD-ZDUSSCGKSA-N 1 2 309.335 4.122 20 0 DIADLO CC(C)c1nc(N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cc[nH+]1 ZINC000509469458 340270607 /nfs/dbraw/zinc/27/06/07/340270607.db2.gz JCJUHCYMNJHOHZ-GFCCVEGCSA-N 1 2 313.367 4.159 20 0 DIADLO c1ccc([C@H]2C[C@H]3CC[C@@H](C2)N3c2cc[nH+]c(C3CC3)n2)cc1 ZINC000509472393 340270709 /nfs/dbraw/zinc/27/07/09/340270709.db2.gz RILODTFOZJOUSV-BCDXTJNWSA-N 1 2 305.425 4.269 20 0 DIADLO CCCCN(Cc1cn2cc(Cl)ccc2[nH+]1)CC(F)(F)F ZINC000509572862 340273705 /nfs/dbraw/zinc/27/37/05/340273705.db2.gz PLFUBGOLLGFKSK-UHFFFAOYSA-N 1 2 319.758 4.152 20 0 DIADLO CC1(C)C[N@H+](Cc2c(OC(F)F)ccc3ccccc32)CCO1 ZINC000509572051 340273809 /nfs/dbraw/zinc/27/38/09/340273809.db2.gz AVXJIYZNLTXXPY-UHFFFAOYSA-N 1 2 321.367 4.052 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)CCO1 ZINC000509572051 340273810 /nfs/dbraw/zinc/27/38/10/340273810.db2.gz AVXJIYZNLTXXPY-UHFFFAOYSA-N 1 2 321.367 4.052 20 0 DIADLO C[C@@H](F)CC[N@@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000509673160 340276656 /nfs/dbraw/zinc/27/66/56/340276656.db2.gz NGSNQVGSQXQXFN-YGRLFVJLSA-N 1 2 306.208 4.115 20 0 DIADLO C[C@@H](F)CC[N@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000509673160 340276657 /nfs/dbraw/zinc/27/66/57/340276657.db2.gz NGSNQVGSQXQXFN-YGRLFVJLSA-N 1 2 306.208 4.115 20 0 DIADLO FC(F)(F)c1nn(C[C@@H]2CCCC(F)(F)C2)c2cc[nH+]cc21 ZINC000509743335 340278179 /nfs/dbraw/zinc/27/81/79/340278179.db2.gz AEQFSOUOZCHKCA-SECBINFHSA-N 1 2 319.277 4.276 20 0 DIADLO CC(C)CN(Cc1c[nH+]c2ccc(Cl)cn12)CC(F)(F)F ZINC000509749007 340278306 /nfs/dbraw/zinc/27/83/06/340278306.db2.gz FPHDPCGKUVIDSA-UHFFFAOYSA-N 1 2 319.758 4.008 20 0 DIADLO Cc1ccc(C(=O)N[C@@H]2CCC(C)(C)C2)cc1Oc1cc[nH+]cc1 ZINC000509946340 340283460 /nfs/dbraw/zinc/28/34/60/340283460.db2.gz RUNJSHVFRONQBX-MRXNPFEDSA-N 1 2 324.424 4.491 20 0 DIADLO C[C@@H](CC1CCCCC1)C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000510033996 340285908 /nfs/dbraw/zinc/28/59/08/340285908.db2.gz QTGLRFIIMQLFLP-HNNXBMFYSA-N 1 2 311.429 4.417 20 0 DIADLO CC[C@@H](C)C[C@H](C)NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000510071727 340287264 /nfs/dbraw/zinc/28/72/64/340287264.db2.gz MQHAIZJMASCLMU-CABCVRRESA-N 1 2 312.413 4.428 20 0 DIADLO CC[C@H](C)C[C@@H](C)NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000510071730 340287269 /nfs/dbraw/zinc/28/72/69/340287269.db2.gz MQHAIZJMASCLMU-LSDHHAIUSA-N 1 2 312.413 4.428 20 0 DIADLO CC[C@@H](C)C[C@@H](C)NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000510071729 340287351 /nfs/dbraw/zinc/28/73/51/340287351.db2.gz MQHAIZJMASCLMU-HUUCEWRRSA-N 1 2 312.413 4.428 20 0 DIADLO CC[C@@H](CC1CCCC1)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000510073951 340287358 /nfs/dbraw/zinc/28/73/58/340287358.db2.gz YSLQNWCHADOAPL-INIZCTEOSA-N 1 2 311.429 4.417 20 0 DIADLO C[C@@H]1CCC[C@@H](C)C1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000510320502 340295894 /nfs/dbraw/zinc/29/58/94/340295894.db2.gz FACWWDFIPQMYPI-HUUCEWRRSA-N 1 2 324.424 4.428 20 0 DIADLO C[C@@H]1CCC[C@H](C)[C@H]1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000510320504 340295910 /nfs/dbraw/zinc/29/59/10/340295910.db2.gz FACWWDFIPQMYPI-QWHZDKJVSA-N 1 2 324.424 4.428 20 0 DIADLO Cc1cccc([C@H](NCc2c[nH+]c3ccccn23)C(F)(F)F)c1 ZINC000510453350 340299913 /nfs/dbraw/zinc/29/99/13/340299913.db2.gz ASFASMAIWQTLQQ-INIZCTEOSA-N 1 2 319.330 4.036 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2cscn2)c2cccc(F)c2)c1 ZINC000510736359 340308868 /nfs/dbraw/zinc/30/88/68/340308868.db2.gz NBFOJDBNQFZUQK-SFHVURJKSA-N 1 2 312.413 4.470 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccc2c(c1)CCC=C2 ZINC000510860921 340313110 /nfs/dbraw/zinc/31/31/10/340313110.db2.gz VFHMQYZBTXFKSV-UHFFFAOYSA-N 1 2 315.376 4.288 20 0 DIADLO Cn1nccc1C1=CC[N@H+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000511061033 340319833 /nfs/dbraw/zinc/31/98/33/340319833.db2.gz WUYNPJJIAYQVOG-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1nccc1C1=CC[N@@H+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000511061033 340319834 /nfs/dbraw/zinc/31/98/34/340319834.db2.gz WUYNPJJIAYQVOG-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccc(F)cc2Cl)CC2CC2)on1 ZINC000511119623 340321236 /nfs/dbraw/zinc/32/12/36/340321236.db2.gz AWCWUBOCBMBWFK-UHFFFAOYSA-N 1 2 308.784 4.188 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccc(F)cc2Cl)CC2CC2)on1 ZINC000511119623 340321237 /nfs/dbraw/zinc/32/12/37/340321237.db2.gz AWCWUBOCBMBWFK-UHFFFAOYSA-N 1 2 308.784 4.188 20 0 DIADLO COC(=O)c1ccccc1C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511556215 340330528 /nfs/dbraw/zinc/33/05/28/340330528.db2.gz QFLMFHZQITWJBC-KRWDZBQOSA-N 1 2 315.800 4.074 20 0 DIADLO COC(=O)c1ccccc1C[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511556215 340330529 /nfs/dbraw/zinc/33/05/29/340330529.db2.gz QFLMFHZQITWJBC-KRWDZBQOSA-N 1 2 315.800 4.074 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)cc1 ZINC000511568518 340331044 /nfs/dbraw/zinc/33/10/44/340331044.db2.gz VFKRDVKMDVOOSM-KRWDZBQOSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)cc1 ZINC000511568518 340331045 /nfs/dbraw/zinc/33/10/45/340331045.db2.gz VFKRDVKMDVOOSM-KRWDZBQOSA-N 1 2 314.816 4.034 20 0 DIADLO COC(=O)c1cccc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000511605136 340332111 /nfs/dbraw/zinc/33/21/11/340332111.db2.gz PBJLJEKZXOLQPG-QGZVFWFLSA-N 1 2 315.800 4.074 20 0 DIADLO COC(=O)c1cccc(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000511605136 340332112 /nfs/dbraw/zinc/33/21/12/340332112.db2.gz PBJLJEKZXOLQPG-QGZVFWFLSA-N 1 2 315.800 4.074 20 0 DIADLO CCOC(=O)c1ccc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000511613427 340332509 /nfs/dbraw/zinc/33/25/09/340332509.db2.gz XJEWICZBKXHKFZ-OAHLLOKOSA-N 1 2 319.788 4.057 20 0 DIADLO CCOC(=O)c1ccc(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000511613427 340332510 /nfs/dbraw/zinc/33/25/10/340332510.db2.gz XJEWICZBKXHKFZ-OAHLLOKOSA-N 1 2 319.788 4.057 20 0 DIADLO CC(C)N(C(=O)[C@@H](C)[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1)C(C)C ZINC000511621242 340332884 /nfs/dbraw/zinc/33/28/84/340332884.db2.gz BWWHKWMUTPEMNL-RHSMWYFYSA-N 1 2 322.880 4.121 20 0 DIADLO CC(C)N(C(=O)[C@@H](C)[N@H+]1CC[C@@H]1c1ccc(Cl)cc1)C(C)C ZINC000511621242 340332885 /nfs/dbraw/zinc/33/28/85/340332885.db2.gz BWWHKWMUTPEMNL-RHSMWYFYSA-N 1 2 322.880 4.121 20 0 DIADLO CCCCc1nc(C[N@H+](CCC)CCc2cccc(F)c2)no1 ZINC000303587122 340335818 /nfs/dbraw/zinc/33/58/18/340335818.db2.gz LNQNXYSRWZICFT-UHFFFAOYSA-N 1 2 319.424 4.006 20 0 DIADLO CCCCc1nc(C[N@@H+](CCC)CCc2cccc(F)c2)no1 ZINC000303587122 340335819 /nfs/dbraw/zinc/33/58/19/340335819.db2.gz LNQNXYSRWZICFT-UHFFFAOYSA-N 1 2 319.424 4.006 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2csc(-c3ccc(C)cc3)n2)C[C@H](C)O1 ZINC000511855807 340340549 /nfs/dbraw/zinc/34/05/49/340340549.db2.gz QWHXOPKKEBCHOH-WMLDXEAASA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2csc(-c3ccc(C)cc3)n2)C[C@H](C)O1 ZINC000511855807 340340550 /nfs/dbraw/zinc/34/05/50/340340550.db2.gz QWHXOPKKEBCHOH-WMLDXEAASA-N 1 2 316.470 4.118 20 0 DIADLO Fc1cccc(N2CCCC2)c1C[NH2+]Cc1ccsc1Cl ZINC000512505799 340364635 /nfs/dbraw/zinc/36/46/35/340364635.db2.gz CBEWPGRQTYVUEP-UHFFFAOYSA-N 1 2 324.852 4.431 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1ccncc1Cl ZINC000173442089 340365088 /nfs/dbraw/zinc/36/50/88/340365088.db2.gz APDVUDNTOIEDFK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1ccncc1Cl ZINC000173442089 340365089 /nfs/dbraw/zinc/36/50/89/340365089.db2.gz APDVUDNTOIEDFK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Clc1cc(Cl)cc(CN2CCCC[C@H]2c2[nH]cc[nH+]2)c1 ZINC000512536885 340365938 /nfs/dbraw/zinc/36/59/38/340365938.db2.gz LZPSWQRYBXXOBB-AWEZNQCLSA-N 1 2 310.228 4.444 20 0 DIADLO Clc1ccc(Cl)c(CN2CCCC[C@@H]2c2[nH]cc[nH+]2)c1 ZINC000512542417 340366109 /nfs/dbraw/zinc/36/61/09/340366109.db2.gz OWUMTMXOFVAYQM-CQSZACIVSA-N 1 2 310.228 4.444 20 0 DIADLO CCCC(CCC)C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000512681729 340372884 /nfs/dbraw/zinc/37/28/84/340372884.db2.gz XPJOGMLUDHWPTC-UHFFFAOYSA-N 1 2 323.506 4.284 20 0 DIADLO CCOc1cc(C[NH2+]C2(C(F)F)CCCCC2)ccc1OC ZINC000512863559 340381365 /nfs/dbraw/zinc/38/13/65/340381365.db2.gz CJDUVFDOTPYCJE-UHFFFAOYSA-N 1 2 313.388 4.152 20 0 DIADLO COc1ccc2c(c1)[nH+]ccc2OCc1cc(-c2ccco2)on1 ZINC000174123727 340382531 /nfs/dbraw/zinc/38/25/31/340382531.db2.gz YJGZXFVXBMUNPH-UHFFFAOYSA-N 1 2 322.320 4.070 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1)c1c(F)cncc1F ZINC000513106749 340393547 /nfs/dbraw/zinc/39/35/47/340393547.db2.gz QVZUOQOUMAFONH-MRVPVSSYSA-N 1 2 300.711 4.003 20 0 DIADLO Cc1ncccc1C[N@@H+]1CCc2c(Cl)c(Cl)ccc2C1 ZINC000513111452 340393718 /nfs/dbraw/zinc/39/37/18/340393718.db2.gz FOEDPONQJIWKRN-UHFFFAOYSA-N 1 2 307.224 4.255 20 0 DIADLO Cc1ncccc1C[N@H+]1CCc2c(Cl)c(Cl)ccc2C1 ZINC000513111452 340393719 /nfs/dbraw/zinc/39/37/19/340393719.db2.gz FOEDPONQJIWKRN-UHFFFAOYSA-N 1 2 307.224 4.255 20 0 DIADLO Cn1nccc1C[N@@H+]1CCCC[C@H]1c1ccccc1C(F)(F)F ZINC000513134510 340394744 /nfs/dbraw/zinc/39/47/44/340394744.db2.gz YWHYVYRNBVSWJL-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1nccc1C[N@H+]1CCCC[C@H]1c1ccccc1C(F)(F)F ZINC000513134510 340394745 /nfs/dbraw/zinc/39/47/45/340394745.db2.gz YWHYVYRNBVSWJL-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO CC[N@H+](Cc1cccc(COC)c1)Cc1c(F)cccc1F ZINC000513174041 340395671 /nfs/dbraw/zinc/39/56/71/340395671.db2.gz NSEFJXUAUNYUBM-UHFFFAOYSA-N 1 2 305.368 4.133 20 0 DIADLO CC[N@@H+](Cc1cccc(COC)c1)Cc1c(F)cccc1F ZINC000513174041 340395672 /nfs/dbraw/zinc/39/56/72/340395672.db2.gz NSEFJXUAUNYUBM-UHFFFAOYSA-N 1 2 305.368 4.133 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1c(F)cncc1F ZINC000513232113 340398574 /nfs/dbraw/zinc/39/85/74/340398574.db2.gz LVRJEBQJUJEHSO-MRVPVSSYSA-N 1 2 300.711 4.003 20 0 DIADLO COc1cc[nH+]cc1NC(=O)[C@@H](c1cccc(Cl)c1)C(C)C ZINC000176299677 340426394 /nfs/dbraw/zinc/42/63/94/340426394.db2.gz CTFIPNRURPYUDK-MRXNPFEDSA-N 1 2 318.804 4.122 20 0 DIADLO Cc1cc(C)c(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)o1 ZINC000176636174 340429624 /nfs/dbraw/zinc/42/96/24/340429624.db2.gz BVBZRJGWAZBVNJ-UHFFFAOYSA-N 1 2 308.337 4.336 20 0 DIADLO Cc1ccc(NC(=O)CCOc2ccccc2C(C)C)c(C)[nH+]1 ZINC000178914345 340452436 /nfs/dbraw/zinc/45/24/36/340452436.db2.gz YLHRKQZMQYUKRS-UHFFFAOYSA-N 1 2 312.413 4.229 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccc(C(C)(C)C)c(Cl)c1 ZINC000516776296 340455512 /nfs/dbraw/zinc/45/55/12/340455512.db2.gz YBOMOOAYENNNLJ-UHFFFAOYSA-N 1 2 302.805 4.015 20 0 DIADLO CCSc1cccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000185560223 340502944 /nfs/dbraw/zinc/50/29/44/340502944.db2.gz NKPFMYKDXIANAR-GFCCVEGCSA-N 1 2 319.474 4.330 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@H](C)CCC2CC2)c2ccc(Cl)cc2)no1 ZINC000186471977 340513216 /nfs/dbraw/zinc/51/32/16/340513216.db2.gz LDRBPZHPBALCGY-BZNIZROVSA-N 1 2 319.836 4.289 20 0 DIADLO CS[C@H](C)C(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000191956339 340560505 /nfs/dbraw/zinc/56/05/05/340560505.db2.gz YJPGIOSWELXADY-GFCCVEGCSA-N 1 2 302.443 4.357 20 0 DIADLO Cc1cccn2cc(-c3ccc(N[C@@H]4CCOC[C@H]4C)cc3)[nH+]c12 ZINC000195084050 340573911 /nfs/dbraw/zinc/57/39/11/340573911.db2.gz IYYJKOYPFFEIPL-CRAIPNDOSA-N 1 2 321.424 4.147 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc3[nH+]c(N(C)C)ccc3c2)cc1C ZINC000195705601 340586009 /nfs/dbraw/zinc/58/60/09/340586009.db2.gz FCTYKNWDLSCLJU-UHFFFAOYSA-N 1 2 319.408 4.170 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](COC)c2ccc(Cl)cc2)cs1 ZINC000194037234 340588413 /nfs/dbraw/zinc/58/84/13/340588413.db2.gz AZGDGAIXVBBPSB-BXUZGUMPSA-N 1 2 324.877 4.397 20 0 DIADLO Fc1cc(Cl)cc(NCc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000226647810 340589961 /nfs/dbraw/zinc/58/99/61/340589961.db2.gz HTVGTVGSKPIQMO-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO COc1c(C)c[nH+]c(COc2ccccc2C(F)(F)F)c1C ZINC000522829574 340607449 /nfs/dbraw/zinc/60/74/49/340607449.db2.gz LNOVLISTEJATQZ-UHFFFAOYSA-N 1 2 311.303 4.305 20 0 DIADLO CC[C@@H](C)[C@H](C)NC(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000523147190 340616826 /nfs/dbraw/zinc/61/68/26/340616826.db2.gz SGNDCNBSMNSGPH-HIFRSBDPSA-N 1 2 312.413 4.347 20 0 DIADLO CC(C)C[C@H](C)CC(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000524312548 340652244 /nfs/dbraw/zinc/65/22/44/340652244.db2.gz YMIVWOFIMQHHSE-AWEZNQCLSA-N 1 2 323.506 4.140 20 0 DIADLO COc1ccc([C@H](C)Nc2[nH+]ccc(C)c2Br)cc1 ZINC000234962008 340655516 /nfs/dbraw/zinc/65/55/16/340655516.db2.gz NXKZSXZCQQQURX-NSHDSACASA-N 1 2 321.218 4.334 20 0 DIADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1coc2cc(F)ccc12 ZINC000525979393 340705888 /nfs/dbraw/zinc/70/58/88/340705888.db2.gz SHIVJNPHTQLTOK-UHFFFAOYSA-N 1 2 321.311 4.214 20 0 DIADLO Oc1ccc2c(c1)[C@H](Nc1ccc(N3CCCCC3)[nH+]c1)CCC2 ZINC000326414183 340714660 /nfs/dbraw/zinc/71/46/60/340714660.db2.gz SWLJPHPEKJDORD-LJQANCHMSA-N 1 2 323.440 4.267 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2nc3cc(C)ccc3s2)s1 ZINC000528452027 340719835 /nfs/dbraw/zinc/71/98/35/340719835.db2.gz OOKMTLBUDGUPLL-NSHDSACASA-N 1 2 303.456 4.220 20 0 DIADLO c1nc(C[NH2+][C@H](c2ccccn2)C2CCC2)oc1-c1ccccc1 ZINC000528653207 340728045 /nfs/dbraw/zinc/72/80/45/340728045.db2.gz XGPZLRLAAGTYFX-FQEVSTJZSA-N 1 2 319.408 4.368 20 0 DIADLO O=C(Nc1cccc(C2CCCCC2)c1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000529651615 340766839 /nfs/dbraw/zinc/76/68/39/340766839.db2.gz XYDJPDWUFBOAAO-QGZVFWFLSA-N 1 2 323.440 4.132 20 0 DIADLO Cn1c[nH+]cc1CCC(=O)Nc1cccc(C2CCCCC2)c1 ZINC000529651453 340766865 /nfs/dbraw/zinc/76/68/65/340766865.db2.gz VNNNNKSBPYVSQH-UHFFFAOYSA-N 1 2 311.429 4.039 20 0 DIADLO Cc1cccn2cc(CNc3cccc(C4CCOCC4)c3)[nH+]c12 ZINC000530123923 340780035 /nfs/dbraw/zinc/78/00/35/340780035.db2.gz YBGXCXBRGGZZIN-UHFFFAOYSA-N 1 2 321.424 4.149 20 0 DIADLO CSc1ccc(NC2CCC(C(=O)OC(C)(C)C)CC2)[nH+]c1 ZINC000124322178 340798444 /nfs/dbraw/zinc/79/84/44/340798444.db2.gz RZJQLKOUIGSBAR-UHFFFAOYSA-N 1 2 322.474 4.116 20 0 DIADLO C[C@@H]([NH2+][C@H](C(=O)Nc1ccccc1)c1ccccc1)c1ccoc1 ZINC000537985600 340805603 /nfs/dbraw/zinc/80/56/03/340805603.db2.gz CRKMMUMZQVYQKS-BEFAXECRSA-N 1 2 320.392 4.310 20 0 DIADLO COC(=O)c1ccoc1C[NH2+][C@@H](c1ccccc1Cl)C(C)C ZINC000538189287 340812474 /nfs/dbraw/zinc/81/24/74/340812474.db2.gz XUVQEJCVCAOWRP-MRXNPFEDSA-N 1 2 321.804 4.207 20 0 DIADLO CCCc1nc(C[NH2+]C(C)(C)c2ccc(C(C)(C)C)cc2)no1 ZINC000538208074 340813303 /nfs/dbraw/zinc/81/33/03/340813303.db2.gz OEWDGMAIXZLSDQ-UHFFFAOYSA-N 1 2 315.461 4.345 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NCc2ccn(C)c2)c1 ZINC000127622442 340854211 /nfs/dbraw/zinc/85/42/11/340854211.db2.gz YUPMBLPYHIVBDY-UHFFFAOYSA-N 1 2 308.429 4.301 20 0 DIADLO Cc1ccnc(C[NH2+][C@H](C)c2ccccc2Oc2ccccc2)n1 ZINC000539257134 340878698 /nfs/dbraw/zinc/87/86/98/340878698.db2.gz OMSLRFQAVANOBM-MRXNPFEDSA-N 1 2 319.408 4.428 20 0 DIADLO CCc1cnc(C[NH2+]C(C)(C)c2ccc(OCC(C)C)cc2)o1 ZINC000539317150 340880600 /nfs/dbraw/zinc/88/06/00/340880600.db2.gz PEIHCNYNDKZPFX-UHFFFAOYSA-N 1 2 316.445 4.297 20 0 DIADLO Cc1cc(OCCCOCC(F)(F)F)c2cccc(C)c2[nH+]1 ZINC000539743760 340898600 /nfs/dbraw/zinc/89/86/00/340898600.db2.gz CRNZKINXMVTKGO-UHFFFAOYSA-N 1 2 313.319 4.199 20 0 DIADLO COc1ccccc1-c1ccc([C@H](C)[NH2+]Cc2ccon2)cc1 ZINC000540458590 340931993 /nfs/dbraw/zinc/93/19/93/340931993.db2.gz RBXOIOGZBDFRAS-AWEZNQCLSA-N 1 2 308.381 4.201 20 0 DIADLO COc1cccc2c1CC[C@H]2Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000540839534 340948333 /nfs/dbraw/zinc/94/83/33/340948333.db2.gz ZESHRXHFROWTAF-GOSISDBHSA-N 1 2 323.440 4.180 20 0 DIADLO c1oc(-c2ccccc2)nc1CNc1c[nH+]c2c(c1)CCCC2 ZINC000541066733 340958250 /nfs/dbraw/zinc/95/82/50/340958250.db2.gz JPXOJJYVORIYOV-UHFFFAOYSA-N 1 2 305.381 4.228 20 0 DIADLO c1ccc(-c2ncc(CNc3c[nH+]c4c(c3)CCCC4)cn2)cc1 ZINC000541066401 340958312 /nfs/dbraw/zinc/95/83/12/340958312.db2.gz AZXPSTMPJJNAEU-UHFFFAOYSA-N 1 2 316.408 4.030 20 0 DIADLO CO[C@H](C)c1cccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000129445352 340961031 /nfs/dbraw/zinc/96/10/31/340961031.db2.gz WWRGWFQBWSLRSD-KDOFPFPSSA-N 1 2 307.397 4.319 20 0 DIADLO COc1cccc([C@H]2C[C@H](C)CN2c2cc[nH+]c3ccncc32)c1 ZINC000541275004 340964996 /nfs/dbraw/zinc/96/49/96/340964996.db2.gz AEKWYJFRPDHITM-VBKZILBWSA-N 1 2 319.408 4.226 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000130127270 341000719 /nfs/dbraw/zinc/00/07/19/341000719.db2.gz LPWJWVZDGUJLRM-UHFFFAOYSA-N 1 2 314.694 4.315 20 0 DIADLO COCC[N@H+](Cc1ncc(C(C)C)s1)[C@@H](C)c1ccccc1 ZINC000542464442 341008155 /nfs/dbraw/zinc/00/81/55/341008155.db2.gz IKMIYEZXPMEEEN-HNNXBMFYSA-N 1 2 318.486 4.476 20 0 DIADLO COCC[N@@H+](Cc1ncc(C(C)C)s1)[C@@H](C)c1ccccc1 ZINC000542464442 341008156 /nfs/dbraw/zinc/00/81/56/341008156.db2.gz IKMIYEZXPMEEEN-HNNXBMFYSA-N 1 2 318.486 4.476 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)C(=O)[C@@H](C)CCC(C)(C)C)c1C ZINC000542624611 341015232 /nfs/dbraw/zinc/01/52/32/341015232.db2.gz QBTQALUCRPBWRA-ZDUSSCGKSA-N 1 2 320.477 4.128 20 0 DIADLO C[N@H+](Cc1cnc(C2CCCCC2)s1)Cc1ccncc1 ZINC000542694461 341017537 /nfs/dbraw/zinc/01/75/37/341017537.db2.gz VTNLFFAMBSMEJJ-UHFFFAOYSA-N 1 2 301.459 4.218 20 0 DIADLO C[N@@H+](Cc1cnc(C2CCCCC2)s1)Cc1ccncc1 ZINC000542694461 341017538 /nfs/dbraw/zinc/01/75/38/341017538.db2.gz VTNLFFAMBSMEJJ-UHFFFAOYSA-N 1 2 301.459 4.218 20 0 DIADLO CCOc1cccc2cc([C@@H](C)[NH2+][C@@H](C)c3ccon3)oc21 ZINC000542698547 341017659 /nfs/dbraw/zinc/01/76/59/341017659.db2.gz WFHJWJQVHFWPAP-NWDGAFQWSA-N 1 2 300.358 4.231 20 0 DIADLO CCc1cc(C[NH2+]Cc2ccc(-c3ccccc3)cc2OC)on1 ZINC000542835091 341022684 /nfs/dbraw/zinc/02/26/84/341022684.db2.gz OOFTZVRXSNEIAR-UHFFFAOYSA-N 1 2 322.408 4.202 20 0 DIADLO C[C@@H](C(=O)Nc1cccc(Cl)c1)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000543061725 341029886 /nfs/dbraw/zinc/02/98/86/341029886.db2.gz OUGDKALBTDCNEY-OLZOCXBDSA-N 1 2 314.816 4.244 20 0 DIADLO C[C@@H](C(=O)Nc1cccc(Cl)c1)[N@H+]1Cc2ccccc2[C@H]1C ZINC000543061725 341029887 /nfs/dbraw/zinc/02/98/87/341029887.db2.gz OUGDKALBTDCNEY-OLZOCXBDSA-N 1 2 314.816 4.244 20 0 DIADLO CC[C@@H]1CCN(C(=O)c2ccc(C)c(Oc3cc[nH+]cc3)c2)C1 ZINC000130614726 341032844 /nfs/dbraw/zinc/03/28/44/341032844.db2.gz CVJIZNBGEQJWDS-OAHLLOKOSA-N 1 2 310.397 4.054 20 0 DIADLO Fc1ccc2sc(-c3cc(-n4cc[nH+]c4)cs3)nc2c1 ZINC000543126932 341033100 /nfs/dbraw/zinc/03/31/00/341033100.db2.gz HFRRXPXGEYBRMT-UHFFFAOYSA-N 1 2 301.371 4.350 20 0 DIADLO CCc1cnc(C[N@@H+]2CC[C@H](Oc3ccccc3Cl)C2)s1 ZINC000543393307 341041638 /nfs/dbraw/zinc/04/16/38/341041638.db2.gz ASBWLRJQGLNGAY-LBPRGKRZSA-N 1 2 322.861 4.012 20 0 DIADLO CCc1cnc(C[N@H+]2CC[C@H](Oc3ccccc3Cl)C2)s1 ZINC000543393307 341041639 /nfs/dbraw/zinc/04/16/39/341041639.db2.gz ASBWLRJQGLNGAY-LBPRGKRZSA-N 1 2 322.861 4.012 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1nnsc1Cl)c1cccs1 ZINC000543484922 341046873 /nfs/dbraw/zinc/04/68/73/341046873.db2.gz HRNHNDKSDSGGJP-VIFPVBQESA-N 1 2 301.868 4.130 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2csc(-c3ccoc3)n2)cn1 ZINC000543504821 341047715 /nfs/dbraw/zinc/04/77/15/341047715.db2.gz LRNQPELBDINUDJ-GFCCVEGCSA-N 1 2 316.430 4.031 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2ccccc2Oc2ccccc2)n1 ZINC000543509602 341048036 /nfs/dbraw/zinc/04/80/36/341048036.db2.gz OWFKTSXJKNYMHE-ZDUSSCGKSA-N 1 2 309.369 4.021 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc(C2CCCC2)no1 ZINC000130846300 341048852 /nfs/dbraw/zinc/04/88/52/341048852.db2.gz XLGQMFVKZHDFTC-NSHDSACASA-N 1 2 321.371 4.198 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc(C2CCCC2)no1 ZINC000130846300 341048853 /nfs/dbraw/zinc/04/88/53/341048853.db2.gz XLGQMFVKZHDFTC-NSHDSACASA-N 1 2 321.371 4.198 20 0 DIADLO Cc1nnc(C[NH2+][C@H](c2cc3ccccc3o2)C(C)C)s1 ZINC000543739596 341056005 /nfs/dbraw/zinc/05/60/05/341056005.db2.gz FGJGFPCSEDUAKV-INIZCTEOSA-N 1 2 301.415 4.080 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2csc(C(C)C)n2)o1 ZINC000131016589 341056306 /nfs/dbraw/zinc/05/63/06/341056306.db2.gz SDTJIWRDNGCASL-OAHLLOKOSA-N 1 2 320.458 4.343 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2csc(C(C)C)n2)o1 ZINC000131016589 341056307 /nfs/dbraw/zinc/05/63/07/341056307.db2.gz SDTJIWRDNGCASL-OAHLLOKOSA-N 1 2 320.458 4.343 20 0 DIADLO CCOc1c(C[N@H+](C)[C@@H](C)c2ccco2)c(C)nn1CC(C)C ZINC000131026379 341056507 /nfs/dbraw/zinc/05/65/07/341056507.db2.gz GTORMGSZWZDDLQ-HNNXBMFYSA-N 1 2 319.449 4.032 20 0 DIADLO CCOc1c(C[N@@H+](C)[C@@H](C)c2ccco2)c(C)nn1CC(C)C ZINC000131026379 341056508 /nfs/dbraw/zinc/05/65/08/341056508.db2.gz GTORMGSZWZDDLQ-HNNXBMFYSA-N 1 2 319.449 4.032 20 0 DIADLO CCc1cnccc1[C@@H](C)[NH2+]Cc1ncc(-c2ccccc2)o1 ZINC000543980288 341064946 /nfs/dbraw/zinc/06/49/46/341064946.db2.gz PVPCBZSSDPTUIT-CQSZACIVSA-N 1 2 307.397 4.150 20 0 DIADLO CCn1c2cc(F)ccc2nc1-c1cc(-n2cc[nH+]c2)cs1 ZINC000544055039 341068409 /nfs/dbraw/zinc/06/84/09/341068409.db2.gz AUIZEQYCBURJON-UHFFFAOYSA-N 1 2 312.373 4.110 20 0 DIADLO Cc1ccc(Cc2noc(-c3ccc(-c4ccccc4)o3)n2)c[nH+]1 ZINC000544164516 341072542 /nfs/dbraw/zinc/07/25/42/341072542.db2.gz BWXBZEFNMFSDSY-UHFFFAOYSA-N 1 2 317.348 4.291 20 0 DIADLO Cc1cccc(NC(=O)[C@@H](c2cccc(Cl)c2)[NH+](C)C)c1F ZINC000544341837 341077065 /nfs/dbraw/zinc/07/70/65/341077065.db2.gz HEPSLGLPDGAAFO-MRXNPFEDSA-N 1 2 320.795 4.029 20 0 DIADLO CC(C)C[C@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1cccs1 ZINC000544448152 341082602 /nfs/dbraw/zinc/08/26/02/341082602.db2.gz BCEBKSNWRLVCQM-AAEUAGOBSA-N 1 2 305.447 4.447 20 0 DIADLO c1c2ccccc2oc1C[NH2+][C@@H](c1ccccc1)c1cncnc1 ZINC000544567792 341086049 /nfs/dbraw/zinc/08/60/49/341086049.db2.gz XOHQJIPBUGNAHX-FQEVSTJZSA-N 1 2 315.376 4.102 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2CCO[C@H](C3CCCCC3)C2)s1 ZINC000544625701 341089773 /nfs/dbraw/zinc/08/97/73/341089773.db2.gz HWBSHEYHVJEMGI-INIZCTEOSA-N 1 2 308.491 4.048 20 0 DIADLO CC(C)c1ncc(C[N@H+]2CCO[C@H](C3CCCCC3)C2)s1 ZINC000544625701 341089774 /nfs/dbraw/zinc/08/97/74/341089774.db2.gz HWBSHEYHVJEMGI-INIZCTEOSA-N 1 2 308.491 4.048 20 0 DIADLO c1cn(-c2cccc(-c3noc([C@@H]4CC45CCCCC5)n3)c2)c[nH+]1 ZINC000544723898 341092071 /nfs/dbraw/zinc/09/20/71/341092071.db2.gz KHTGNYLAYKNPEJ-INIZCTEOSA-N 1 2 320.396 4.360 20 0 DIADLO CCCC1(c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)CCC1 ZINC000544954767 341101091 /nfs/dbraw/zinc/10/10/91/341101091.db2.gz INFZVPXUUFFGLW-UHFFFAOYSA-N 1 2 322.412 4.203 20 0 DIADLO Cc1cc(NC(=O)c2oc3ccccc3c2COC(C)C)cc[nH+]1 ZINC000073069048 341112655 /nfs/dbraw/zinc/11/26/55/341112655.db2.gz WFMWRRWHQVJAAJ-UHFFFAOYSA-N 1 2 324.380 4.314 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@@H](C)[C@H](C)C2)cc1Oc1cc[nH+]cc1 ZINC000131864037 341112799 /nfs/dbraw/zinc/11/27/99/341112799.db2.gz XYGACXAUPDDZPJ-GDBMZVCRSA-N 1 2 324.424 4.300 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCc4sccc4C3)cs2)cs1 ZINC000073368869 341115888 /nfs/dbraw/zinc/11/58/88/341115888.db2.gz ASLCFBPCVBFDSK-UHFFFAOYSA-N 1 2 318.492 4.491 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCc4sccc4C3)cs2)cs1 ZINC000073368869 341115889 /nfs/dbraw/zinc/11/58/89/341115889.db2.gz ASLCFBPCVBFDSK-UHFFFAOYSA-N 1 2 318.492 4.491 20 0 DIADLO Fc1ccccc1C1CC[NH+](Cc2ncc(Cl)s2)CC1 ZINC000545328838 341121705 /nfs/dbraw/zinc/12/17/05/341121705.db2.gz WLZDGOHYDOPGEZ-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO Cc1ccc(CCNc2[nH+]cccc2OCc2ccccc2)cn1 ZINC000545473328 341126685 /nfs/dbraw/zinc/12/66/85/341126685.db2.gz JWKZEHFSVNJLFM-UHFFFAOYSA-N 1 2 319.408 4.019 20 0 DIADLO C[C@@H](Cc1nc(Cc2cn3ccccc3[nH+]2)no1)C1CCCCC1 ZINC000545603060 341132648 /nfs/dbraw/zinc/13/26/48/341132648.db2.gz MOMHFABSXITYCI-AWEZNQCLSA-N 1 2 324.428 4.067 20 0 DIADLO Cc1ccc(Cc2noc(/C=C/c3ccccc3Cl)n2)c[nH+]1 ZINC000545637688 341134351 /nfs/dbraw/zinc/13/43/51/341134351.db2.gz ASEPKAYGULYYND-CMDGGOBGSA-N 1 2 311.772 4.188 20 0 DIADLO Cc1ccc(Cc2noc([C@@H]3CC[C@H]4CCCC[C@H]4C3)n2)c[nH+]1 ZINC000545636717 341134356 /nfs/dbraw/zinc/13/43/56/341134356.db2.gz MVZLDZIBDUFBGP-IXDOHACOSA-N 1 2 311.429 4.438 20 0 DIADLO Cc1ccc(Cc2noc([C@@]3(C)CCCc4ccccc43)n2)c[nH+]1 ZINC000545638420 341134406 /nfs/dbraw/zinc/13/44/06/341134406.db2.gz MZHZUGDUMWTNSZ-FQEVSTJZSA-N 1 2 319.408 4.006 20 0 DIADLO Cc1ccc(Cc2noc(C[C@@H](c3ccccc3)C(C)C)n2)c[nH+]1 ZINC000545638487 341134454 /nfs/dbraw/zinc/13/44/54/341134454.db2.gz PISSEFKDTLSOAV-GOSISDBHSA-N 1 2 321.424 4.346 20 0 DIADLO C[C@H]1CCCC[C@H]1c1noc(CCc2[nH]c3ccccc3[nH+]2)n1 ZINC000545686756 341136292 /nfs/dbraw/zinc/13/62/92/341136292.db2.gz KLAVYIXZYCLEFR-QWHCGFSZSA-N 1 2 310.401 4.025 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+]2CCc3ccsc3C2)o1 ZINC000132822934 341146533 /nfs/dbraw/zinc/14/65/33/341146533.db2.gz KQVYLDKCTDVUMC-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+]2CCc3ccsc3C2)o1 ZINC000132822934 341146534 /nfs/dbraw/zinc/14/65/34/341146534.db2.gz KQVYLDKCTDVUMC-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1nc2cc(F)ccc2o1 ZINC000133007860 341151733 /nfs/dbraw/zinc/15/17/33/341151733.db2.gz BNTQHCWQJWDCIC-JTQLQIEISA-N 1 2 320.314 4.438 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1nc2cc(F)ccc2o1 ZINC000133007860 341151734 /nfs/dbraw/zinc/15/17/34/341151734.db2.gz BNTQHCWQJWDCIC-JTQLQIEISA-N 1 2 320.314 4.438 20 0 DIADLO Cc1ccc(Cc2noc(COc3ccccc3C(C)C)n2)c[nH+]1 ZINC000546340274 341164085 /nfs/dbraw/zinc/16/40/85/341164085.db2.gz HRFSAFLWRAXBBK-UHFFFAOYSA-N 1 2 323.396 4.066 20 0 DIADLO C/C(=C/c1ccc(C)cc1)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000546345961 341164433 /nfs/dbraw/zinc/16/44/33/341164433.db2.gz INJYYXRKAQZSPE-UVTDQMKNSA-N 1 2 305.381 4.233 20 0 DIADLO Cc1cccn2cc(Cc3noc(/C=C\C4CCCCC4)n3)[nH+]c12 ZINC000546391293 341166366 /nfs/dbraw/zinc/16/63/66/341166366.db2.gz YBLCVRHNWKRHFL-KTKRTIGZSA-N 1 2 322.412 4.210 20 0 DIADLO C[C@@H]1CCCC[C@@H]1c1noc(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC000546396893 341166542 /nfs/dbraw/zinc/16/65/42/341166542.db2.gz ITLPTLVZTKZJBG-PBHICJAKSA-N 1 2 322.412 4.275 20 0 DIADLO CC[C@H](C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1ccc(F)cc1 ZINC000546597796 341174068 /nfs/dbraw/zinc/17/40/68/341174068.db2.gz RMLYJGHVNOZTQZ-KRWDZBQOSA-N 1 2 323.371 4.348 20 0 DIADLO CC[C@@H](C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1ccc(F)cc1 ZINC000546597797 341174077 /nfs/dbraw/zinc/17/40/77/341174077.db2.gz RMLYJGHVNOZTQZ-QGZVFWFLSA-N 1 2 323.371 4.348 20 0 DIADLO CC[N@H+](Cc1nc(C2CCCC2)no1)[C@H](C)c1ccc(F)cc1 ZINC000133508756 341176912 /nfs/dbraw/zinc/17/69/12/341176912.db2.gz KZLZUPPUEVYOSK-CYBMUJFWSA-N 1 2 317.408 4.449 20 0 DIADLO CC[N@@H+](Cc1nc(C2CCCC2)no1)[C@H](C)c1ccc(F)cc1 ZINC000133508756 341176913 /nfs/dbraw/zinc/17/69/13/341176913.db2.gz KZLZUPPUEVYOSK-CYBMUJFWSA-N 1 2 317.408 4.449 20 0 DIADLO C[C@@H](c1nc(-c2cccs2)no1)[N@H+](C)Cc1ccc(F)cc1 ZINC000075608464 341179467 /nfs/dbraw/zinc/17/94/67/341179467.db2.gz BTNPVYFELJLFEE-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO C[C@@H](c1nc(-c2cccs2)no1)[N@@H+](C)Cc1ccc(F)cc1 ZINC000075608464 341179468 /nfs/dbraw/zinc/17/94/68/341179468.db2.gz BTNPVYFELJLFEE-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO COc1ccc2c(c1)[nH+]ccc2OCc1ccc2ncccc2c1 ZINC000546727009 341180464 /nfs/dbraw/zinc/18/04/64/341180464.db2.gz VNQIESFYUHIDRQ-UHFFFAOYSA-N 1 2 316.360 4.371 20 0 DIADLO COCC[N@H+](Cc1csc(-c2ccc(Cl)cc2)n1)C1CC1 ZINC000546741587 341181190 /nfs/dbraw/zinc/18/11/90/341181190.db2.gz YBYMNVPQCXJQGL-UHFFFAOYSA-N 1 2 322.861 4.074 20 0 DIADLO COCC[N@@H+](Cc1csc(-c2ccc(Cl)cc2)n1)C1CC1 ZINC000546741587 341181191 /nfs/dbraw/zinc/18/11/91/341181191.db2.gz YBYMNVPQCXJQGL-UHFFFAOYSA-N 1 2 322.861 4.074 20 0 DIADLO Cc1ccc2[nH+]c(CNc3c(C)cccc3OC(F)F)cn2c1 ZINC000133682022 341181681 /nfs/dbraw/zinc/18/16/81/341181681.db2.gz RNRXWCPEIDAMJE-UHFFFAOYSA-N 1 2 317.339 4.165 20 0 DIADLO Cc1ncc(C[N@H+]2C[C@@H](c3cc(C)ccc3C)OC[C@H]2C)s1 ZINC000075837121 341185263 /nfs/dbraw/zinc/18/52/63/341185263.db2.gz ZSNAMJNQXBTIHL-KDOFPFPSSA-N 1 2 316.470 4.030 20 0 DIADLO Cc1ncc(C[N@@H+]2C[C@@H](c3cc(C)ccc3C)OC[C@H]2C)s1 ZINC000075837121 341185264 /nfs/dbraw/zinc/18/52/64/341185264.db2.gz ZSNAMJNQXBTIHL-KDOFPFPSSA-N 1 2 316.470 4.030 20 0 DIADLO Cc1ncc(C[N@H+]2C[C@H](c3cc(C)ccc3C)OC[C@H]2C)s1 ZINC000075837122 341185376 /nfs/dbraw/zinc/18/53/76/341185376.db2.gz ZSNAMJNQXBTIHL-RDTXWAMCSA-N 1 2 316.470 4.030 20 0 DIADLO Cc1ncc(C[N@@H+]2C[C@H](c3cc(C)ccc3C)OC[C@H]2C)s1 ZINC000075837122 341185377 /nfs/dbraw/zinc/18/53/77/341185377.db2.gz ZSNAMJNQXBTIHL-RDTXWAMCSA-N 1 2 316.470 4.030 20 0 DIADLO Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1noc(Cc2ccccc2)n1 ZINC000546932514 341187188 /nfs/dbraw/zinc/18/71/88/341187188.db2.gz MDQARYCNYPYKCU-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO CC(C)CC(C)(C)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000546990191 341190147 /nfs/dbraw/zinc/19/01/47/341190147.db2.gz AECDZFJSJSOMRG-UHFFFAOYSA-N 1 2 324.428 4.305 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc([C@@H]2CCC[C@@H](C)C2)no1 ZINC000547061014 341194078 /nfs/dbraw/zinc/19/40/78/341194078.db2.gz WBQHBGSQVSURDG-TZMCWYRMSA-N 1 2 310.401 4.070 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc(C2CCC(C)CC2)no1 ZINC000547061314 341194100 /nfs/dbraw/zinc/19/41/00/341194100.db2.gz WOGSEXNHIAKOJD-UHFFFAOYSA-N 1 2 310.401 4.070 20 0 DIADLO OC[C@@H]([NH2+]Cc1sccc1Cl)c1cccc(Cl)c1F ZINC000547373902 341209597 /nfs/dbraw/zinc/20/95/97/341209597.db2.gz OUYNVBBPOGUHQG-LLVKDONJSA-N 1 2 320.216 4.017 20 0 DIADLO OC[C@H]([NH2+]Cc1sccc1Cl)c1cccc(Cl)c1F ZINC000547373903 341209656 /nfs/dbraw/zinc/20/96/56/341209656.db2.gz OUYNVBBPOGUHQG-NSHDSACASA-N 1 2 320.216 4.017 20 0 DIADLO CCCc1cccc(C[NH2+][C@H](c2nccn2C)c2ccccc2)c1 ZINC000547499756 341218056 /nfs/dbraw/zinc/21/80/56/341218056.db2.gz QTUWYAMNPZHPBZ-FQEVSTJZSA-N 1 2 319.452 4.252 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2nc3ccccc3[nH]2)[C@H]1c1ccccc1 ZINC000547506283 341218730 /nfs/dbraw/zinc/21/87/30/341218730.db2.gz UEXMEDCQSRIYBJ-IFXJQAMLSA-N 1 2 323.465 4.242 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2nc3ccccc3[nH]2)[C@H]1c1ccccc1 ZINC000547506283 341218731 /nfs/dbraw/zinc/21/87/31/341218731.db2.gz UEXMEDCQSRIYBJ-IFXJQAMLSA-N 1 2 323.465 4.242 20 0 DIADLO Cc1nc(C[NH2+]Cc2cc(F)cc(Cl)c2)nc2ccccc12 ZINC000547605199 341222821 /nfs/dbraw/zinc/22/28/21/341222821.db2.gz KQYZIZBBGNARML-UHFFFAOYSA-N 1 2 315.779 4.021 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(C(C)(C)C)n1)c1nc2c(s1)CCC2 ZINC000134856678 341225290 /nfs/dbraw/zinc/22/52/90/341225290.db2.gz XUBIHCHESHUDQM-SNVBAGLBSA-N 1 2 321.515 4.237 20 0 DIADLO Fc1ccc(C2=CC[N@H+](Cc3csc(C4CC4)n3)CC2)cc1 ZINC000134859331 341225392 /nfs/dbraw/zinc/22/53/92/341225392.db2.gz FUYBUDPOLCLSKI-UHFFFAOYSA-N 1 2 314.429 4.449 20 0 DIADLO Fc1ccc(C2=CC[N@@H+](Cc3csc(C4CC4)n3)CC2)cc1 ZINC000134859331 341225393 /nfs/dbraw/zinc/22/53/93/341225393.db2.gz FUYBUDPOLCLSKI-UHFFFAOYSA-N 1 2 314.429 4.449 20 0 DIADLO C[C@@H]1CSCC[N@@H+]1Cc1ccc(Br)cc1Cl ZINC000134895774 341226117 /nfs/dbraw/zinc/22/61/17/341226117.db2.gz ZTOUCIJCZJKUKE-SECBINFHSA-N 1 2 320.683 4.040 20 0 DIADLO C[C@@H]1CSCC[N@H+]1Cc1ccc(Br)cc1Cl ZINC000134895774 341226118 /nfs/dbraw/zinc/22/61/18/341226118.db2.gz ZTOUCIJCZJKUKE-SECBINFHSA-N 1 2 320.683 4.040 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2csc(C3CC3)n2)c1 ZINC000135112197 341231278 /nfs/dbraw/zinc/23/12/78/341231278.db2.gz CJKURDVJJMPMGA-INIZCTEOSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2csc(C3CC3)n2)c1 ZINC000135112197 341231279 /nfs/dbraw/zinc/23/12/79/341231279.db2.gz CJKURDVJJMPMGA-INIZCTEOSA-N 1 2 302.418 4.497 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@@H](C)C[C@H]2C)cc1Oc1cc[nH+]cc1 ZINC000078004606 341233567 /nfs/dbraw/zinc/23/35/67/341233567.db2.gz IMUGOQLBUGRLAW-GDBMZVCRSA-N 1 2 324.424 4.443 20 0 DIADLO c1cc2cccc(NCc3[nH+]ccn3Cc3ccccc3)c2[nH]1 ZINC000547820717 341234927 /nfs/dbraw/zinc/23/49/27/341234927.db2.gz HOISUIBWXCUNQV-UHFFFAOYSA-N 1 2 302.381 4.025 20 0 DIADLO Fc1ccc([C@H]2CCCC[N@@H+]2Cc2nc3ccccc3[nH]2)cc1 ZINC000547830296 341236034 /nfs/dbraw/zinc/23/60/34/341236034.db2.gz SMADAEGSYBEXPL-GOSISDBHSA-N 1 2 309.388 4.429 20 0 DIADLO Fc1ccc([C@H]2CCCC[N@H+]2Cc2nc3ccccc3[nH]2)cc1 ZINC000547830296 341236035 /nfs/dbraw/zinc/23/60/35/341236035.db2.gz SMADAEGSYBEXPL-GOSISDBHSA-N 1 2 309.388 4.429 20 0 DIADLO Cn1c2ccc(NC(=O)C3(C)CCCCC3)cc2[nH+]c1C1CC1 ZINC000548047623 341244646 /nfs/dbraw/zinc/24/46/46/341244646.db2.gz PEOHUJULSKSNDG-UHFFFAOYSA-N 1 2 311.429 4.360 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000548300358 341255049 /nfs/dbraw/zinc/25/50/49/341255049.db2.gz DLYNHDXWDITAGY-KZULUSFZSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000548300358 341255050 /nfs/dbraw/zinc/25/50/50/341255050.db2.gz DLYNHDXWDITAGY-KZULUSFZSA-N 1 2 321.342 4.238 20 0 DIADLO CCn1c2ccccc2nc1C[NH2+]Cc1ccc(Cl)cc1F ZINC000548317297 341255800 /nfs/dbraw/zinc/25/58/00/341255800.db2.gz DLYJFWGGRZRDDC-UHFFFAOYSA-N 1 2 317.795 4.139 20 0 DIADLO C[C@H](Cc1ccsc1)[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000548317826 341255829 /nfs/dbraw/zinc/25/58/29/341255829.db2.gz ZHTOWYGBWAIHDX-PXAZEXFGSA-N 1 2 323.408 4.031 20 0 DIADLO C[C@H](Cc1ccsc1)[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000548317826 341255830 /nfs/dbraw/zinc/25/58/30/341255830.db2.gz ZHTOWYGBWAIHDX-PXAZEXFGSA-N 1 2 323.408 4.031 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc(F)c1Cl ZINC000079852508 341266704 /nfs/dbraw/zinc/26/67/04/341266704.db2.gz QDXSLGGUKORHAU-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000548628465 341267777 /nfs/dbraw/zinc/26/77/77/341267777.db2.gz FFLYMBGGGFLRKT-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccccc1)[N@H+]1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000548628465 341267778 /nfs/dbraw/zinc/26/77/78/341267778.db2.gz FFLYMBGGGFLRKT-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO CCc1noc(C)c1C[N@@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000548938697 341281885 /nfs/dbraw/zinc/28/18/85/341281885.db2.gz CAGKKAUOHMWCMR-QGZVFWFLSA-N 1 2 322.811 4.270 20 0 DIADLO CCc1noc(C)c1C[N@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000548938697 341281886 /nfs/dbraw/zinc/28/18/86/341281886.db2.gz CAGKKAUOHMWCMR-QGZVFWFLSA-N 1 2 322.811 4.270 20 0 DIADLO C[C@@H](C(=O)Nc1ccc2[nH]c(C(C)(C)C)[nH+]c2c1)C(C)(F)F ZINC000549121501 341286300 /nfs/dbraw/zinc/28/63/00/341286300.db2.gz HRHVRZQGEHPFDH-VIFPVBQESA-N 1 2 309.360 4.090 20 0 DIADLO Fc1ccccc1[C@]1(F)CC[N@H+](Cc2cnc(C3CC3)s2)C1 ZINC000549445671 341294722 /nfs/dbraw/zinc/29/47/22/341294722.db2.gz CSHGXMCJZHBWLF-KRWDZBQOSA-N 1 2 320.408 4.230 20 0 DIADLO Fc1ccccc1[C@]1(F)CC[N@@H+](Cc2cnc(C3CC3)s2)C1 ZINC000549445671 341294723 /nfs/dbraw/zinc/29/47/23/341294723.db2.gz CSHGXMCJZHBWLF-KRWDZBQOSA-N 1 2 320.408 4.230 20 0 DIADLO CCCc1noc(C[N@H+](C)C2c3ccccc3-c3ccccc32)n1 ZINC000081596611 341298330 /nfs/dbraw/zinc/29/83/30/341298330.db2.gz DMWIOVVCSDTAHL-UHFFFAOYSA-N 1 2 319.408 4.224 20 0 DIADLO CCCc1noc(C[N@@H+](C)C2c3ccccc3-c3ccccc32)n1 ZINC000081596611 341298331 /nfs/dbraw/zinc/29/83/31/341298331.db2.gz DMWIOVVCSDTAHL-UHFFFAOYSA-N 1 2 319.408 4.224 20 0 DIADLO COC1(CC[N@@H+]2CCn3c(cc4c3cccc4Cl)C2)CCC1 ZINC000549613838 341299139 /nfs/dbraw/zinc/29/91/39/341299139.db2.gz RSCHWDBWYPSWCB-UHFFFAOYSA-N 1 2 318.848 4.070 20 0 DIADLO COC1(CC[N@H+]2CCn3c(cc4c3cccc4Cl)C2)CCC1 ZINC000549613838 341299140 /nfs/dbraw/zinc/29/91/40/341299140.db2.gz RSCHWDBWYPSWCB-UHFFFAOYSA-N 1 2 318.848 4.070 20 0 DIADLO Cc1cc(SCc2cn3ccccc3[nH+]2)n(-c2ccccc2)n1 ZINC000549620403 341299236 /nfs/dbraw/zinc/29/92/36/341299236.db2.gz YZGBZLGNKXWWLN-UHFFFAOYSA-N 1 2 320.421 4.121 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cccnc3-c3ccccc3)cn2c1 ZINC000549917099 341306399 /nfs/dbraw/zinc/30/63/99/341306399.db2.gz DZCSWVAWYLRJED-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO c1nc(C[N@@H+]2CCc3ccccc3[C@@H]2c2ccccc2)cs1 ZINC000549960877 341307858 /nfs/dbraw/zinc/30/78/58/341307858.db2.gz CFVACCFOOGJCPB-IBGZPJMESA-N 1 2 306.434 4.291 20 0 DIADLO c1nc(C[N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)cs1 ZINC000549960877 341307859 /nfs/dbraw/zinc/30/78/59/341307859.db2.gz CFVACCFOOGJCPB-IBGZPJMESA-N 1 2 306.434 4.291 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1c(F)cccc1Cl ZINC000549999290 341308560 /nfs/dbraw/zinc/30/85/60/341308560.db2.gz ZDSJZLNVOJRLHK-INIZCTEOSA-N 1 2 321.827 4.423 20 0 DIADLO CC[C@@H](C)Oc1cccc(NCc2c[nH+]c3c(C)cccn23)c1 ZINC000550239327 341313087 /nfs/dbraw/zinc/31/30/87/341313087.db2.gz ACAMKNZPJHNPAK-OAHLLOKOSA-N 1 2 309.413 4.432 20 0 DIADLO FC[C@H]1CCC[N@@H+]1Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000550409758 341316467 /nfs/dbraw/zinc/31/64/67/341316467.db2.gz YSCVCEODOIMSED-CQSZACIVSA-N 1 2 310.825 4.397 20 0 DIADLO FC[C@H]1CCC[N@H+]1Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000550409758 341316468 /nfs/dbraw/zinc/31/64/68/341316468.db2.gz YSCVCEODOIMSED-CQSZACIVSA-N 1 2 310.825 4.397 20 0 DIADLO Cc1cccc([C@@H](C)[N@@H+]2Cc3cnn(-c4ccccc4)c3C2)c1 ZINC000550525115 341318081 /nfs/dbraw/zinc/31/80/81/341318081.db2.gz WMXVGZBHKQBAPC-MRXNPFEDSA-N 1 2 303.409 4.258 20 0 DIADLO Cc1cccc([C@@H](C)[N@H+]2Cc3cnn(-c4ccccc4)c3C2)c1 ZINC000550525115 341318082 /nfs/dbraw/zinc/31/80/82/341318082.db2.gz WMXVGZBHKQBAPC-MRXNPFEDSA-N 1 2 303.409 4.258 20 0 DIADLO CC(C)C1CCC(C[NH2+][C@@H](c2cccs2)c2nnc[nH]2)CC1 ZINC000550699858 341321494 /nfs/dbraw/zinc/32/14/94/341321494.db2.gz PGKARKPDALYIDM-XUJLQICISA-N 1 2 318.490 4.008 20 0 DIADLO Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CC(C)(F)F ZINC000550882573 341325299 /nfs/dbraw/zinc/32/52/99/341325299.db2.gz NZHSNEYKLBAUKO-NSHDSACASA-N 1 2 310.413 4.348 20 0 DIADLO COCCCCCOc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000550989716 341328448 /nfs/dbraw/zinc/32/84/48/341328448.db2.gz ZTUGZBXGYMSGFA-UHFFFAOYSA-N 1 2 314.429 4.082 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cccc(OC(F)(F)F)c3)cn2c1 ZINC000551222246 341334238 /nfs/dbraw/zinc/33/42/38/341334238.db2.gz WGENYZJQXCQRAT-UHFFFAOYSA-N 1 2 321.302 4.153 20 0 DIADLO Cc1ccc2[nH+]c(CNc3ccc4cnn(C(C)C)c4c3)cn2c1 ZINC000551239517 341334944 /nfs/dbraw/zinc/33/49/44/341334944.db2.gz JCKVGGZHUJDEKO-UHFFFAOYSA-N 1 2 319.412 4.185 20 0 DIADLO CC(C)c1cnc(C[NH+]2CCC(CC(F)(F)F)CC2)s1 ZINC000551586515 341346672 /nfs/dbraw/zinc/34/66/72/341346672.db2.gz OQYJODOCYVPWAY-UHFFFAOYSA-N 1 2 306.397 4.431 20 0 DIADLO Clc1cnc(C[NH2+]Cc2ccc(OC3CCCC3)cc2)s1 ZINC000551615757 341347249 /nfs/dbraw/zinc/34/72/49/341347249.db2.gz UQTAISHBJLFXBD-UHFFFAOYSA-N 1 2 322.861 4.408 20 0 DIADLO CCc1nc(C[N@H+](CC(C)C)[C@@H](C)c2ccccc2C)no1 ZINC000551721552 341349857 /nfs/dbraw/zinc/34/98/57/341349857.db2.gz YSAYWLGNXDENMK-HNNXBMFYSA-N 1 2 301.434 4.160 20 0 DIADLO CCc1nc(C[N@@H+](CC(C)C)[C@@H](C)c2ccccc2C)no1 ZINC000551721552 341349858 /nfs/dbraw/zinc/34/98/58/341349858.db2.gz YSAYWLGNXDENMK-HNNXBMFYSA-N 1 2 301.434 4.160 20 0 DIADLO CC(C)(C)c1cc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)no1 ZINC000564382360 341350307 /nfs/dbraw/zinc/35/03/07/341350307.db2.gz WJDHTOQHDWMVPF-UHFFFAOYSA-N 1 2 304.821 4.404 20 0 DIADLO CCc1cnc(C[N@@H+](Cc2ccc(F)cc2Cl)CC2CC2)o1 ZINC000551995227 341358446 /nfs/dbraw/zinc/35/84/46/341358446.db2.gz YCZAIMYSKZTSRS-UHFFFAOYSA-N 1 2 322.811 4.442 20 0 DIADLO CCc1cnc(C[N@H+](Cc2ccc(F)cc2Cl)CC2CC2)o1 ZINC000551995227 341358447 /nfs/dbraw/zinc/35/84/47/341358447.db2.gz YCZAIMYSKZTSRS-UHFFFAOYSA-N 1 2 322.811 4.442 20 0 DIADLO C[C@@H]1CCC[N@H+](CC(=O)Nc2c(Cl)cccc2Cl)[C@H]1C ZINC000247012238 341359840 /nfs/dbraw/zinc/35/98/40/341359840.db2.gz UGCBGRFUMCJKSE-MNOVXSKESA-N 1 2 315.244 4.052 20 0 DIADLO C[C@@H]1CCC[N@@H+](CC(=O)Nc2c(Cl)cccc2Cl)[C@H]1C ZINC000247012238 341359841 /nfs/dbraw/zinc/35/98/41/341359841.db2.gz UGCBGRFUMCJKSE-MNOVXSKESA-N 1 2 315.244 4.052 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)[C@H]2CCc3ccccc32)n1 ZINC000247132172 341361255 /nfs/dbraw/zinc/36/12/55/341361255.db2.gz ASUAEMLTUUZXMS-WFASDCNBSA-N 1 2 317.458 4.003 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)[C@H]2CCc3ccccc32)n1 ZINC000247132172 341361256 /nfs/dbraw/zinc/36/12/56/341361256.db2.gz ASUAEMLTUUZXMS-WFASDCNBSA-N 1 2 317.458 4.003 20 0 DIADLO CCc1cnc(C[N@@H+](Cc2ccccc2Cl)CC2CC2)o1 ZINC000552110148 341370495 /nfs/dbraw/zinc/37/04/95/341370495.db2.gz JOSDFMUNLALRRB-UHFFFAOYSA-N 1 2 304.821 4.303 20 0 DIADLO CCc1cnc(C[N@H+](Cc2ccccc2Cl)CC2CC2)o1 ZINC000552110148 341370496 /nfs/dbraw/zinc/37/04/96/341370496.db2.gz JOSDFMUNLALRRB-UHFFFAOYSA-N 1 2 304.821 4.303 20 0 DIADLO Cc1nn(C)cc1C[N@@H+]1CCc2cc(Cl)c(Cl)cc2[C@@H]1C ZINC000552175046 341375676 /nfs/dbraw/zinc/37/56/76/341375676.db2.gz GLMJZTLLXCFRDV-NSHDSACASA-N 1 2 324.255 4.155 20 0 DIADLO Cc1nn(C)cc1C[N@H+]1CCc2cc(Cl)c(Cl)cc2[C@@H]1C ZINC000552175046 341375677 /nfs/dbraw/zinc/37/56/77/341375677.db2.gz GLMJZTLLXCFRDV-NSHDSACASA-N 1 2 324.255 4.155 20 0 DIADLO Cc1nc([C@H]([NH2+]C[C@@H]2CCCC[C@H]2C)c2ccccc2F)no1 ZINC000248469126 341378485 /nfs/dbraw/zinc/37/84/85/341378485.db2.gz UNYMSORFDOQCQC-HACGYAERSA-N 1 2 317.408 4.022 20 0 DIADLO CCCCCC(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000552213112 341378667 /nfs/dbraw/zinc/37/86/67/341378667.db2.gz DHGHGJDJTLGSCO-UHFFFAOYSA-N 1 2 311.429 4.405 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(F)cc(Cl)c2)[C@@H]1c1ccncc1 ZINC000552279589 341383664 /nfs/dbraw/zinc/38/36/64/341383664.db2.gz VLFORGXVRSXVMU-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(F)cc(Cl)c2)[C@@H]1c1ccncc1 ZINC000552279589 341383665 /nfs/dbraw/zinc/38/36/65/341383665.db2.gz VLFORGXVRSXVMU-MRXNPFEDSA-N 1 2 304.796 4.457 20 0 DIADLO Cc1ncc(C[N@H+]2C[C@H](c3cccc(Cl)c3)OC[C@H]2C)s1 ZINC000249382911 341396901 /nfs/dbraw/zinc/39/69/01/341396901.db2.gz PHYQQDIXFHBSFV-BDJLRTHQSA-N 1 2 322.861 4.067 20 0 DIADLO Cc1ncc(C[N@@H+]2C[C@H](c3cccc(Cl)c3)OC[C@H]2C)s1 ZINC000249382911 341396902 /nfs/dbraw/zinc/39/69/02/341396902.db2.gz PHYQQDIXFHBSFV-BDJLRTHQSA-N 1 2 322.861 4.067 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)C1(c2ccc(F)cc2F)CCCC1 ZINC000089803253 341408985 /nfs/dbraw/zinc/40/89/85/341408985.db2.gz USEUQNAIUUHUAY-UHFFFAOYSA-N 1 2 316.351 4.119 20 0 DIADLO c1cn(CCSCCCOc2ccc3ccccc3c2)c[nH+]1 ZINC000090201058 341414048 /nfs/dbraw/zinc/41/40/48/341414048.db2.gz ZWYAAUPIJMULNH-UHFFFAOYSA-N 1 2 312.438 4.239 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2csc3ccccc23)c(C)[nH+]1 ZINC000553113725 341416448 /nfs/dbraw/zinc/41/64/48/341416448.db2.gz KQHWFWMOKSMUNX-UHFFFAOYSA-N 1 2 310.422 4.403 20 0 DIADLO c1c[nH+]c(COCc2cccc(SCc3ccccc3)c2)[nH]1 ZINC000553413240 341428304 /nfs/dbraw/zinc/42/83/04/341428304.db2.gz AKSPJXMFZOAMTJ-UHFFFAOYSA-N 1 2 310.422 4.419 20 0 DIADLO Cc1cnc(CCN(C)c2cc[nH+]c3c(Cl)cccc23)s1 ZINC000553506088 341430635 /nfs/dbraw/zinc/43/06/35/341430635.db2.gz AJDNTFPCENEAMG-UHFFFAOYSA-N 1 2 317.845 4.332 20 0 DIADLO COc1nc(C)cc(C)c1C[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000553879825 341437739 /nfs/dbraw/zinc/43/77/39/341437739.db2.gz XVXFTJDBJFLIPR-LBPRGKRZSA-N 1 2 322.811 4.350 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CC[C@H](Cc2ccccc2)C1 ZINC000554386808 341452959 /nfs/dbraw/zinc/45/29/59/341452959.db2.gz CUYHTHNQAVMUKW-MSOLQXFVSA-N 1 2 323.440 4.231 20 0 DIADLO Cn1c(CCSCc2ccc(F)cc2)[nH+]c2ccccc21 ZINC000554710049 341461590 /nfs/dbraw/zinc/46/15/90/341461590.db2.gz VEBJKUDEFSKQSS-UHFFFAOYSA-N 1 2 300.402 4.188 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+]C[C@H]2CCCS2)C(F)F)c1 ZINC000556260158 341499752 /nfs/dbraw/zinc/49/97/52/341499752.db2.gz FJFNUMXMMFONKM-CABCVRRESA-N 1 2 315.429 4.265 20 0 DIADLO Cc1cc(N2CCSCC2)ccc1[NH2+][C@@H]1CC=C(C)CC1 ZINC000556264778 341500050 /nfs/dbraw/zinc/50/00/50/341500050.db2.gz VFWKUOAOISAFEX-MRXNPFEDSA-N 1 2 302.487 4.459 20 0 DIADLO COCc1cc(N2C[C@@H]3CCCC[C@@H]3C2)c2cc(F)ccc2[nH+]1 ZINC000564567339 341504118 /nfs/dbraw/zinc/50/41/18/341504118.db2.gz JKXJTEIYFKVYFJ-OKILXGFUSA-N 1 2 314.404 4.147 20 0 DIADLO C[C@H]([NH2+]Cc1noc(C2CC2)n1)c1ccc(F)c2ccccc21 ZINC000564682423 341506715 /nfs/dbraw/zinc/50/67/15/341506715.db2.gz GFGPBZTVDAGINM-NSHDSACASA-N 1 2 311.360 4.090 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2ccc(OC)cc2F)on1 ZINC000565079279 341516539 /nfs/dbraw/zinc/51/65/39/341516539.db2.gz FOESHZXZSVVNTL-UHFFFAOYSA-N 1 2 306.381 4.016 20 0 DIADLO C[C@@H](CC(=O)N(c1ccccc1)C1CCCCC1)n1cc[nH+]c1 ZINC000565306604 341523309 /nfs/dbraw/zinc/52/33/09/341523309.db2.gz CIXWSNTXQCKTRZ-INIZCTEOSA-N 1 2 311.429 4.200 20 0 DIADLO COc1cc2cc[nH+]c(N3CCC[C@@H]3c3ccccn3)c2cc1F ZINC000565442114 341527571 /nfs/dbraw/zinc/52/75/71/341527571.db2.gz AGOQFDFYSNXIEU-QGZVFWFLSA-N 1 2 323.371 4.119 20 0 DIADLO Cc1ccc([C@H]2C[C@H]2c2nc(CCc3[nH+]cccc3C)no2)cc1 ZINC000566097228 341547608 /nfs/dbraw/zinc/54/76/08/341547608.db2.gz GOALDLXTNITQTH-IAGOWNOFSA-N 1 2 319.408 4.138 20 0 DIADLO CCn1c(C[NH2+]Cc2cc(C3CC3)ccc2F)nc2ccccc21 ZINC000567214162 341588434 /nfs/dbraw/zinc/58/84/34/341588434.db2.gz VHXRAJGJVIMIAB-UHFFFAOYSA-N 1 2 323.415 4.363 20 0 DIADLO FC(F)(F)c1csc(CSc2[nH+]cc3ccccn32)n1 ZINC000155595257 341610116 /nfs/dbraw/zinc/61/01/16/341610116.db2.gz CBCQVOVDYXZWKZ-UHFFFAOYSA-N 1 2 315.345 4.102 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccsc2)no1)c1cccc(Cl)c1 ZINC000155885407 341614399 /nfs/dbraw/zinc/61/43/99/341614399.db2.gz QWWXZKMIGBAHGG-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO O[C@H](CNc1ccc(Oc2cc[nH+]cc2)cc1)CC1CCCC1 ZINC000567701539 341628569 /nfs/dbraw/zinc/62/85/69/341628569.db2.gz FABRBWSVBXQGKV-KRWDZBQOSA-N 1 2 312.413 4.227 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@H](C)c2cn[nH]c2)c1 ZINC000569011384 341688226 /nfs/dbraw/zinc/68/82/26/341688226.db2.gz YEGDFCXHYYAVDW-CQSZACIVSA-N 1 2 309.417 4.246 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc2c(n1)CCC2)c1c(F)cccc1Cl ZINC000569077929 341690102 /nfs/dbraw/zinc/69/01/02/341690102.db2.gz AJPGKXQHLALOMK-LLVKDONJSA-N 1 2 304.796 4.214 20 0 DIADLO Cc1c[nH+]cc(CCc2nc([C@H]3CCCc4ccccc43)no2)c1 ZINC000572697861 341700941 /nfs/dbraw/zinc/70/09/41/341700941.db2.gz YVVBCTSZKZVILQ-SFHVURJKSA-N 1 2 319.408 4.026 20 0 DIADLO Cc1c(Cl)cccc1C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000573541535 341731400 /nfs/dbraw/zinc/73/14/00/341731400.db2.gz PXEVJBOVQCOWNA-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO Cc1cc(N2CC[C@@H](c3cccnc3)C2)c2cccc(F)c2[nH+]1 ZINC000573840160 341740788 /nfs/dbraw/zinc/74/07/88/341740788.db2.gz NCCWTDNCUGIWKU-OAHLLOKOSA-N 1 2 307.372 4.071 20 0 DIADLO COc1cc[nH+]cc1CSCCOc1cccc(Cl)c1 ZINC000573953863 341744288 /nfs/dbraw/zinc/74/42/88/341744288.db2.gz ATEYDFYDTNGOIO-UHFFFAOYSA-N 1 2 309.818 4.056 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000174566760 341828861 /nfs/dbraw/zinc/82/88/61/341828861.db2.gz JPTHQVCADJXPPC-MBNYWOFBSA-N 1 2 303.377 4.402 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1OC(F)F)c1cscn1 ZINC000576242408 341835862 /nfs/dbraw/zinc/83/58/62/341835862.db2.gz YKWVRBIZHHRPTE-DTWKUNHWSA-N 1 2 316.348 4.295 20 0 DIADLO CCC(CC)[C@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)c1ccccc1 ZINC000576588617 341853883 /nfs/dbraw/zinc/85/38/83/341853883.db2.gz VIHJIRWARKDKCJ-BEFAXECRSA-N 1 2 313.445 4.128 20 0 DIADLO COCC(C)(C)C[NH2+][C@@H](c1cccc(OC(C)C)c1)C(F)F ZINC000576597438 341854428 /nfs/dbraw/zinc/85/44/28/341854428.db2.gz SFBPLOBQXBULHD-HNNXBMFYSA-N 1 2 315.404 4.042 20 0 DIADLO CCCCn1c(SC2CCCC2)nnc1[C@H](CC)[NH+](C)C ZINC000176539888 341885037 /nfs/dbraw/zinc/88/50/37/341885037.db2.gz IZHNGHMQSGQALQ-AWEZNQCLSA-N 1 2 310.511 4.126 20 0 DIADLO COC[C@@H]([NH2+]Cc1ccc(-c2ccc(C)cc2)o1)c1ccco1 ZINC000177576634 341921413 /nfs/dbraw/zinc/92/14/13/341921413.db2.gz BNXBRPDQURVXHV-QGZVFWFLSA-N 1 2 311.381 4.325 20 0 DIADLO C[C@H]1C[C@@H](NC(=O)Nc2ccc(C(C)(C)C)cc2)c2[nH+]ccn21 ZINC000578031660 341975765 /nfs/dbraw/zinc/97/57/65/341975765.db2.gz DZEYERLURPSZOM-SWLSCSKDSA-N 1 2 312.417 4.008 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@@H+]2Cc2cccs2)nc1 ZINC000339164291 518216808 /nfs/dbraw/zinc/21/68/08/518216808.db2.gz KCHKYFRNGGJUKW-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@H+]2Cc2cccs2)nc1 ZINC000339164291 518216809 /nfs/dbraw/zinc/21/68/09/518216809.db2.gz KCHKYFRNGGJUKW-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO CC(C)(C)c1noc(C[NH2+][C@@H](CC2CCC2)c2ccccc2)n1 ZINC000181350715 519134432 /nfs/dbraw/zinc/13/44/32/519134432.db2.gz TZBYIZZWKAYINY-INIZCTEOSA-N 1 2 313.445 4.388 20 0 DIADLO CC(C)(C)n1cc(C[NH+](Cc2ccco2)Cc2ccco2)cn1 ZINC000162577972 519155231 /nfs/dbraw/zinc/15/52/31/519155231.db2.gz IEVFGVDOGLKUNI-UHFFFAOYSA-N 1 2 313.401 4.027 20 0 DIADLO CC(C)N(C)c1ccc(CNc2ccccc2N2CCCC2)c[nH+]1 ZINC000190807111 519632984 /nfs/dbraw/zinc/63/29/84/519632984.db2.gz WJTQPOXKSJPRFA-UHFFFAOYSA-N 1 2 324.472 4.139 20 0 DIADLO CC(C)[N@H+](Cc1cccnc1)Cc1ccccc1Br ZINC000339294321 519659522 /nfs/dbraw/zinc/65/95/22/519659522.db2.gz UQDNCGQQCBYHLE-UHFFFAOYSA-N 1 2 319.246 4.255 20 0 DIADLO CC(C)[N@@H+](Cc1cccnc1)Cc1ccccc1Br ZINC000339294321 519659523 /nfs/dbraw/zinc/65/95/23/519659523.db2.gz UQDNCGQQCBYHLE-UHFFFAOYSA-N 1 2 319.246 4.255 20 0 DIADLO CC(C)[N@H+](Cc1ncnn1C(C)(C)C)Cc1cccc(Cl)c1 ZINC000338264645 519664309 /nfs/dbraw/zinc/66/43/09/519664309.db2.gz XYTRMQASTZIIPA-UHFFFAOYSA-N 1 2 320.868 4.097 20 0 DIADLO CC(C)[N@@H+](Cc1ncnn1C(C)(C)C)Cc1cccc(Cl)c1 ZINC000338264645 519664312 /nfs/dbraw/zinc/66/43/12/519664312.db2.gz XYTRMQASTZIIPA-UHFFFAOYSA-N 1 2 320.868 4.097 20 0 DIADLO CC(C)CCc1nc(C[NH2+][C@@H](C)c2ccncc2F)cs1 ZINC000338358508 519698148 /nfs/dbraw/zinc/69/81/48/519698148.db2.gz QXNXUDOWUMXTEW-LBPRGKRZSA-N 1 2 307.438 4.117 20 0 DIADLO CC(=O)Nc1cccc(C[N@@H+](C)Cc2ccc(F)cc2Cl)c1 ZINC000107063771 519738530 /nfs/dbraw/zinc/73/85/30/519738530.db2.gz VPJBYVJPFUGLKA-UHFFFAOYSA-N 1 2 320.795 4.070 20 0 DIADLO CC(=O)Nc1cccc(C[N@H+](C)Cc2ccc(F)cc2Cl)c1 ZINC000107063771 519738532 /nfs/dbraw/zinc/73/85/32/519738532.db2.gz VPJBYVJPFUGLKA-UHFFFAOYSA-N 1 2 320.795 4.070 20 0 DIADLO CC(C)[C@H]1CCCN1C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000264899527 519825176 /nfs/dbraw/zinc/82/51/76/519825176.db2.gz JPPYEAURPDENCC-GOSISDBHSA-N 1 2 310.397 4.135 20 0 DIADLO CC(C)c1nc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)cs1 ZINC000112978751 519862266 /nfs/dbraw/zinc/86/22/66/519862266.db2.gz OQUSUVMXODYEFN-UHFFFAOYSA-N 1 2 316.470 4.384 20 0 DIADLO CC(C)c1nc(C[N@H+](Cc2cccc(O)c2)CC2CC2)cs1 ZINC000112978751 519862267 /nfs/dbraw/zinc/86/22/67/519862267.db2.gz OQUSUVMXODYEFN-UHFFFAOYSA-N 1 2 316.470 4.384 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)no1 ZINC000180020886 519864329 /nfs/dbraw/zinc/86/43/29/519864329.db2.gz ZEHKXIIPEBMCCQ-DJSGYFEHSA-N 1 2 319.836 4.333 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)o1 ZINC000181607791 519888041 /nfs/dbraw/zinc/88/80/41/519888041.db2.gz ZZUCFXNSUAFSJH-JTQLQIEISA-N 1 2 313.323 4.063 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](c2ccccc2F)C2CCCC2)n1 ZINC000181490721 519904890 /nfs/dbraw/zinc/90/48/90/519904890.db2.gz YQADNVVFUNVAIE-KRWDZBQOSA-N 1 2 317.408 4.353 20 0 DIADLO CC(C)n1cc[nH+]c1CN(Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000337349986 520026239 /nfs/dbraw/zinc/02/62/39/520026239.db2.gz RBJMTFNFCMNSHQ-YOEHRIQHSA-N 1 2 313.445 4.345 20 0 DIADLO CC(C)n1ccnc1C[NH2+][C@@H](c1ccccc1)c1cccc(F)c1 ZINC000124775364 520031167 /nfs/dbraw/zinc/03/11/67/520031167.db2.gz YYGVOATXZHKQMY-FQEVSTJZSA-N 1 2 323.415 4.482 20 0 DIADLO CCCCC[C@H]([NH2+]Cc1nc([C@@H](C)OC)no1)c1ccccc1 ZINC000181744765 520312472 /nfs/dbraw/zinc/31/24/72/520312472.db2.gz GAGPJKLBJGXRQA-ZBFHGGJFSA-N 1 2 317.433 4.188 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)[C@H]2C[C@H]2c2ccccc2)cs1 ZINC000336854167 520474484 /nfs/dbraw/zinc/47/44/84/520474484.db2.gz DFWPNCRVOOWQJV-COXVUDFISA-N 1 2 316.470 4.229 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)[C@H]2C[C@H]2c2ccccc2)cs1 ZINC000336854167 520474493 /nfs/dbraw/zinc/47/44/93/520474493.db2.gz DFWPNCRVOOWQJV-COXVUDFISA-N 1 2 316.470 4.229 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nc(C(C)C)no1)c1ccc(F)cc1F ZINC000181664259 520782300 /nfs/dbraw/zinc/78/23/00/520782300.db2.gz VWUKAEWKAAIACH-CQSZACIVSA-N 1 2 309.360 4.102 20 0 DIADLO CCC[C@H]([NH2+]Cc1noc(C)n1)c1cccc(C(F)(F)F)c1 ZINC000181857677 521168872 /nfs/dbraw/zinc/16/88/72/521168872.db2.gz JQHAJZSNUYLLHD-ZDUSSCGKSA-N 1 2 313.323 4.028 20 0 DIADLO CCCC[C@H]([NH2+]Cc1nnc(C(C)C)o1)c1ccc(OC)cc1 ZINC000182151547 521241466 /nfs/dbraw/zinc/24/14/66/521241466.db2.gz GNJAIWXMGHHFRG-INIZCTEOSA-N 1 2 317.433 4.223 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@H](CC)c2ccc(OC)cc2)n1 ZINC000181823290 521347363 /nfs/dbraw/zinc/34/73/63/521347363.db2.gz WMQIZNQPEPNGGF-CZUORRHYSA-N 1 2 317.433 4.223 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)no1 ZINC000180287875 521516951 /nfs/dbraw/zinc/51/69/51/521516951.db2.gz NKKQIUJAULRRGJ-GOSISDBHSA-N 1 2 317.408 4.182 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)no1 ZINC000182574169 521517569 /nfs/dbraw/zinc/51/75/69/521517569.db2.gz QWGWLXDEOFWEPF-QGZVFWFLSA-N 1 2 319.836 4.307 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](c2ccccc2C)C(C)(C)C)no1 ZINC000180087020 521517830 /nfs/dbraw/zinc/51/78/30/521517830.db2.gz PELNEIXZAQCHLU-KRWDZBQOSA-N 1 2 301.434 4.208 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+][C@H](COC)c1ccc(C)o1 ZINC000156502028 521573577 /nfs/dbraw/zinc/57/35/77/521573577.db2.gz MDTHOOXCZGHPHY-GDBMZVCRSA-N 1 2 303.402 4.025 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+][C@@H](C)c1nc(C(C)C)no1 ZINC000179746892 521576313 /nfs/dbraw/zinc/57/63/13/521576313.db2.gz SLWVQOAQKJATMY-DZGCQCFKSA-N 1 2 317.433 4.394 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)n1 ZINC000181613479 521585594 /nfs/dbraw/zinc/58/55/94/521585594.db2.gz DYYOKQIHZBSBNP-INIZCTEOSA-N 1 2 323.387 4.177 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)n1 ZINC000180279094 521586808 /nfs/dbraw/zinc/58/68/08/521586808.db2.gz PHDAKXWPSOCEAY-SFHVURJKSA-N 1 2 317.408 4.182 20 0 DIADLO CCCn1c(C)nnc1C[N@@H+]1CCCCC[C@H]1c1ccc(C)o1 ZINC000159174295 521621696 /nfs/dbraw/zinc/62/16/96/521621696.db2.gz AHTLBZJYAHVJFB-INIZCTEOSA-N 1 2 316.449 4.015 20 0 DIADLO CCCn1c(C)nnc1C[N@H+]1CCCCC[C@H]1c1ccc(C)o1 ZINC000159174295 521621703 /nfs/dbraw/zinc/62/17/03/521621703.db2.gz AHTLBZJYAHVJFB-INIZCTEOSA-N 1 2 316.449 4.015 20 0 DIADLO CCC[N@H+](Cc1csc([C@H](C)OC)n1)Cc1ccc(F)cc1 ZINC000267017871 521693237 /nfs/dbraw/zinc/69/32/37/521693237.db2.gz JSFUKSQKEGCTAC-ZDUSSCGKSA-N 1 2 322.449 4.402 20 0 DIADLO CCC[N@@H+](Cc1csc([C@H](C)OC)n1)Cc1ccc(F)cc1 ZINC000267017871 521693240 /nfs/dbraw/zinc/69/32/40/521693240.db2.gz JSFUKSQKEGCTAC-ZDUSSCGKSA-N 1 2 322.449 4.402 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+]2CCc3ccccc3[C@@H]2C)n1 ZINC000130569412 521721858 /nfs/dbraw/zinc/72/18/58/521721858.db2.gz JTUNYGWQRSCETA-STQMWFEESA-N 1 2 317.458 4.003 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+]2CCc3ccccc3[C@@H]2C)n1 ZINC000130569412 521721860 /nfs/dbraw/zinc/72/18/60/521721860.db2.gz JTUNYGWQRSCETA-STQMWFEESA-N 1 2 317.458 4.003 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@@H](C)c2ccc(C)cc2)n1 ZINC000182313867 521721922 /nfs/dbraw/zinc/72/19/22/521721922.db2.gz SEGFQWLHTGPFBX-STQMWFEESA-N 1 2 305.447 4.043 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2cc(Cl)ccc2OC)s1 ZINC000130626102 522038766 /nfs/dbraw/zinc/03/87/66/522038766.db2.gz STYCVBUQHULZPX-SNVBAGLBSA-N 1 2 310.850 4.218 20 0 DIADLO CCc1cnc(C[NH2+][C@H]2CC(C)(C)Oc3cc(F)ccc32)s1 ZINC000130532313 522041663 /nfs/dbraw/zinc/04/16/63/522041663.db2.gz QQNSJOVEZLHOJQ-AWEZNQCLSA-N 1 2 320.433 4.237 20 0 DIADLO CCc1nc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCCC2)no1 ZINC000182544944 522356473 /nfs/dbraw/zinc/35/64/73/522356473.db2.gz HKODMMRFSRIULU-KRWDZBQOSA-N 1 2 319.836 4.307 20 0 DIADLO COC(=O)c1oc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2F)cc1C ZINC000181577209 522405605 /nfs/dbraw/zinc/40/56/05/522405605.db2.gz USAALIDTCDJGDL-GHMZBOCLSA-N 1 2 323.339 4.065 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cnn(C(C)C)c2C)cs1 ZINC000191280797 522423476 /nfs/dbraw/zinc/42/34/76/522423476.db2.gz FWZVFKQMJQGZQM-NWDGAFQWSA-N 1 2 306.479 4.203 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cccc(NC(C)=O)c2)cs1 ZINC000162267399 522423672 /nfs/dbraw/zinc/42/36/72/522423672.db2.gz MBYJDSVSYPTJEI-VXGBXAGGSA-N 1 2 317.458 4.076 20 0 DIADLO CCc1[nH+]c2cc(CNc3ncccc3F)ccc2n1C1CC1 ZINC000338485262 522488240 /nfs/dbraw/zinc/48/82/40/522488240.db2.gz RLTMQPDKMUGIBW-UHFFFAOYSA-N 1 2 310.376 4.080 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(-c2ccoc2)no1)c1ccc(Cl)cc1 ZINC000105607841 522667275 /nfs/dbraw/zinc/66/72/75/522667275.db2.gz IZZHPUFHYFCUTF-AWEZNQCLSA-N 1 2 317.776 4.224 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1ccccn1)c1nc(C(F)(F)F)cs1 ZINC000159275034 522699457 /nfs/dbraw/zinc/69/94/57/522699457.db2.gz CULJXNCLIPUWDR-UWVGGRQHSA-N 1 2 315.364 4.359 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)o1 ZINC000365656461 522731013 /nfs/dbraw/zinc/73/10/13/522731013.db2.gz HVMDAJSTIUOVQB-AWEZNQCLSA-N 1 2 305.809 4.013 20 0 DIADLO CCc1nnc(C[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)o1 ZINC000365656461 522731027 /nfs/dbraw/zinc/73/10/27/522731027.db2.gz HVMDAJSTIUOVQB-AWEZNQCLSA-N 1 2 305.809 4.013 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nc(C(C)C)no1)c1ccc(OC)cc1 ZINC000181828300 522745446 /nfs/dbraw/zinc/74/54/46/522745446.db2.gz JFCFIUATQXQFCB-DOMZBBRYSA-N 1 2 303.406 4.004 20 0 DIADLO CC[C@H](Nc1cc(F)c(OC(C)(C)C)c(F)c1)c1[nH+]ccn1C ZINC000180443113 522763793 /nfs/dbraw/zinc/76/37/93/522763793.db2.gz QUFQCXDHTMGADV-AWEZNQCLSA-N 1 2 323.387 4.439 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)n1 ZINC000180018485 522915479 /nfs/dbraw/zinc/91/54/79/522915479.db2.gz QRUHQRMCBXRDMU-WYURAEBNSA-N 1 2 319.836 4.333 20 0 DIADLO CC[C@@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1cc(F)ccc1F ZINC000156412239 522922397 /nfs/dbraw/zinc/92/23/97/522922397.db2.gz JWHDZDRHBOAVRF-CVEARBPZSA-N 1 2 309.356 4.295 20 0 DIADLO CC[C@@H]([NH2+][C@H](c1nccn1C)c1cccc(F)c1)c1ccccc1 ZINC000128366017 522946911 /nfs/dbraw/zinc/94/69/11/522946911.db2.gz IWMVZTFSBIRIRC-MOPGFXCFSA-N 1 2 323.415 4.390 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2csc(C3CC3)n2)o1 ZINC000130850073 523014627 /nfs/dbraw/zinc/01/46/27/523014627.db2.gz LPDIRDMWOVQKIY-HNNXBMFYSA-N 1 2 318.442 4.097 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2csc(C3CC3)n2)o1 ZINC000130850073 523014639 /nfs/dbraw/zinc/01/46/39/523014639.db2.gz LPDIRDMWOVQKIY-HNNXBMFYSA-N 1 2 318.442 4.097 20 0 DIADLO COCCC[C@@H](C)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000182923887 523467120 /nfs/dbraw/zinc/46/71/20/523467120.db2.gz UILBLPLZWIGDCH-OAHLLOKOSA-N 1 2 313.445 4.113 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cs1 ZINC000267050993 523470069 /nfs/dbraw/zinc/47/00/69/523470069.db2.gz QRRNSVQNHLYGJA-LRDDRELGSA-N 1 2 320.433 4.327 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cs1 ZINC000267050993 523470078 /nfs/dbraw/zinc/47/00/78/523470078.db2.gz QRRNSVQNHLYGJA-LRDDRELGSA-N 1 2 320.433 4.327 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1ccc(Cl)s1 ZINC000339148830 523558839 /nfs/dbraw/zinc/55/88/39/523558839.db2.gz DLMKOPGWDFMXCY-CYBMUJFWSA-N 1 2 309.866 4.345 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](Cc2ccc(F)cc2)C(C)C)cs1 ZINC000267019234 523912817 /nfs/dbraw/zinc/91/28/17/523912817.db2.gz JUBQGWFSFGLCMD-CYBMUJFWSA-N 1 2 322.449 4.400 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](Cc2ccc(F)cc2)C(C)C)cs1 ZINC000267019234 523912820 /nfs/dbraw/zinc/91/28/20/523912820.db2.gz JUBQGWFSFGLCMD-CYBMUJFWSA-N 1 2 322.449 4.400 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(F)c(C)c2)cs1 ZINC000269076390 523915835 /nfs/dbraw/zinc/91/58/35/523915835.db2.gz NNZWYAFNOSGQPV-NWDGAFQWSA-N 1 2 308.422 4.149 20 0 DIADLO COC(=O)[C@H](c1ccsc1)[N@@H+]1CCC[C@H]1c1ccc(C)s1 ZINC000337190422 523942193 /nfs/dbraw/zinc/94/21/93/523942193.db2.gz RVPTXKIHGFRLKO-ZFWWWQNUSA-N 1 2 321.467 4.169 20 0 DIADLO COC(=O)[C@H](c1ccsc1)[N@H+]1CCC[C@H]1c1ccc(C)s1 ZINC000337190422 523942199 /nfs/dbraw/zinc/94/21/99/523942199.db2.gz RVPTXKIHGFRLKO-ZFWWWQNUSA-N 1 2 321.467 4.169 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000265841397 524034783 /nfs/dbraw/zinc/03/47/83/524034783.db2.gz WOEBHTJAWICBJX-HNNXBMFYSA-N 1 2 317.433 4.466 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000265841397 524034786 /nfs/dbraw/zinc/03/47/86/524034786.db2.gz WOEBHTJAWICBJX-HNNXBMFYSA-N 1 2 317.433 4.466 20 0 DIADLO CCc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(C)[nH+]c2C)o1 ZINC000268035987 524037232 /nfs/dbraw/zinc/03/72/32/524037232.db2.gz QEYKCVFPLPPWLJ-INIZCTEOSA-N 1 2 313.401 4.223 20 0 DIADLO C[C@H](CCC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1)c1ccccc1 ZINC000158341973 524115422 /nfs/dbraw/zinc/11/54/22/524115422.db2.gz BQPSFAOSMFXSPZ-WBVHZDCISA-N 1 2 311.429 4.047 20 0 DIADLO COc1ccc(Cl)cc1[C@@H](CC(C)C)[NH2+]Cc1cocn1 ZINC000182070114 524251502 /nfs/dbraw/zinc/25/15/02/524251502.db2.gz COLUPWGJSMNVQB-OAHLLOKOSA-N 1 2 308.809 4.214 20 0 DIADLO COc1ccc(F)c(C[NH2+]Cc2nc(C(C)C)c(C)s2)c1 ZINC000339252196 524278913 /nfs/dbraw/zinc/27/89/13/524278913.db2.gz FHOMGSQBJHITKB-UHFFFAOYSA-N 1 2 308.422 4.012 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ncc(-c3ccccc3F)o2)o1 ZINC000158356415 524395785 /nfs/dbraw/zinc/39/57/85/524395785.db2.gz YHBBOBBEGIYBQD-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ncc(-c3ccccc3F)o2)o1 ZINC000158356415 524395793 /nfs/dbraw/zinc/39/57/93/524395793.db2.gz YHBBOBBEGIYBQD-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO C[C@@H](CCC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1)c1ccccc1 ZINC000158341530 524438886 /nfs/dbraw/zinc/43/88/86/524438886.db2.gz BQPSFAOSMFXSPZ-DOTOQJQBSA-N 1 2 311.429 4.047 20 0 DIADLO Cc1cc(C)cc([C@H](C)[NH2+]Cc2nc(-c3cccs3)no2)c1 ZINC000182901570 524470807 /nfs/dbraw/zinc/47/08/07/524470807.db2.gz YQWUXYYUZDLKQN-ZDUSSCGKSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1cc(C)cc([C@H](C)[NH2+]Cc2nc(Cc3ccccc3)no2)c1 ZINC000182922862 524471207 /nfs/dbraw/zinc/47/12/07/524471207.db2.gz PZHMJEWILMONIU-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO C[C@@H]1CC[C@H](N(C)C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000338203150 524683348 /nfs/dbraw/zinc/68/33/48/524683348.db2.gz HMMOGYXOKCNJCF-CABCVRRESA-N 1 2 310.397 4.135 20 0 DIADLO C[C@H]1COC[C@@H](c2ccccc2)[N@@H+]1Cc1cnc2ccccc2c1 ZINC000337178764 524734411 /nfs/dbraw/zinc/73/44/11/524734411.db2.gz KPQYLWYUEXBSQR-KKSFZXQISA-N 1 2 318.420 4.197 20 0 DIADLO C[C@H]1COC[C@@H](c2ccccc2)[N@H+]1Cc1cnc2ccccc2c1 ZINC000337178764 524734420 /nfs/dbraw/zinc/73/44/20/524734420.db2.gz KPQYLWYUEXBSQR-KKSFZXQISA-N 1 2 318.420 4.197 20 0 DIADLO C[C@H]1C[C@@H]1[C@H]([NH2+]Cc1noc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000180029192 524854305 /nfs/dbraw/zinc/85/43/05/524854305.db2.gz OZUKFESVGBIESG-JMPLFQLZSA-N 1 2 317.820 4.087 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2noc(C(C)C)n2)C(C)(C)C)c1 ZINC000180797519 524884435 /nfs/dbraw/zinc/88/44/35/524884435.db2.gz FJWIOKSDFFLSTE-INIZCTEOSA-N 1 2 301.434 4.378 20 0 DIADLO COc1ccc(OC)c([C@@H](C)[NH2+]Cc2nc(C(C)C)cs2)c1 ZINC000128541801 524887344 /nfs/dbraw/zinc/88/73/44/524887344.db2.gz OIZLFYFJZWSMGD-GFCCVEGCSA-N 1 2 320.458 4.135 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2coc(-c3ccccc3)n2)o1 ZINC000237669485 524972880 /nfs/dbraw/zinc/97/28/80/524972880.db2.gz WINAHJBSNKUYLY-SUMWQHHRSA-N 1 2 308.381 4.348 20 0 DIADLO Cc1ccccc1-c1noc([C@H](C)[NH2+][C@@H](C)c2cccc(O)c2)n1 ZINC000181531854 525022320 /nfs/dbraw/zinc/02/23/20/525022320.db2.gz QTUOJWSRXCUDJR-KBPBESRZSA-N 1 2 323.396 4.162 20 0 DIADLO Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1nc(Cc2ccccc2)no1 ZINC000173806694 525360689 /nfs/dbraw/zinc/36/06/89/525360689.db2.gz INHLRZJCIWJFRU-HZPDHXFCSA-N 1 2 321.424 4.381 20 0 DIADLO C[C@H]([NH2+]Cc1cccc2cc[nH]c21)c1nc(C2CCCCC2)no1 ZINC000266309664 525459953 /nfs/dbraw/zinc/45/99/53/525459953.db2.gz PITUTUQQSAEURX-ZDUSSCGKSA-N 1 2 324.428 4.449 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nc(-c3ccccc3)no2)c(C)s1 ZINC000182980360 525468984 /nfs/dbraw/zinc/46/89/84/525468984.db2.gz UQFLRTZPLGNPFK-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(F)(F)F)cs1)c1ccc(F)cc1F ZINC000157304647 525485505 /nfs/dbraw/zinc/48/55/05/525485505.db2.gz UUDVBITZZFIICN-ZETCQYMHSA-N 1 2 322.302 4.291 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccncc1F)c1nc(C(F)(F)F)cs1 ZINC000338012530 525537145 /nfs/dbraw/zinc/53/71/45/525537145.db2.gz ROPLMEJSNNYYCA-YUMQZZPRSA-N 1 2 319.327 4.108 20 0 DIADLO Cc1cccnc1[C@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)C(C)C ZINC000118839398 525555498 /nfs/dbraw/zinc/55/54/98/525555498.db2.gz QAWPKNODNKCOGC-ZIAGYGMSSA-N 1 2 316.449 4.118 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(C2CCCC2)n1)c1ccncc1F ZINC000338341738 525556488 /nfs/dbraw/zinc/55/64/88/525556488.db2.gz IAWZKAIHNVQYQA-LLVKDONJSA-N 1 2 305.422 4.186 20 0 DIADLO C[C@@H]([NH2+]Cc1nccs1)c1nc(-c2ccccc2)cs1 ZINC000107322044 525563427 /nfs/dbraw/zinc/56/34/27/525563427.db2.gz FHMRAUFVBIJJSQ-LLVKDONJSA-N 1 2 301.440 4.117 20 0 DIADLO C[C@@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1cccc2ccccc21 ZINC000181667475 525567262 /nfs/dbraw/zinc/56/72/62/525567262.db2.gz RMBWPOOLMYJJIG-CYBMUJFWSA-N 1 2 309.413 4.371 20 0 DIADLO C[C@H]([NH2+][C@H]1CC(C)(C)Oc2cc(F)ccc21)c1nccs1 ZINC000153364073 525602614 /nfs/dbraw/zinc/60/26/14/525602614.db2.gz VPWSUCIUVZXBOP-GWCFXTLKSA-N 1 2 306.406 4.235 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cnccn1)c1cc(F)c(Cl)cc1Cl ZINC000178053297 525618837 /nfs/dbraw/zinc/61/88/37/525618837.db2.gz HCNWMGSSFNPNRU-BDAKNGLRSA-N 1 2 314.191 4.334 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncc(-c2ccccc2)o1)c1ccncc1F ZINC000338348885 525621828 /nfs/dbraw/zinc/62/18/28/525621828.db2.gz XBBPYUBIYONCLE-OLZOCXBDSA-N 1 2 311.360 4.288 20 0 DIADLO Cc1ccc(SCCC(=O)Nc2cc[nH+]cc2C)cc1C ZINC000107293426 525656270 /nfs/dbraw/zinc/65/62/70/525656270.db2.gz XHGLAJVVPYVJFS-UHFFFAOYSA-N 1 2 300.427 4.128 20 0 DIADLO C[C@H]([NH2+]c1ccc(OCc2noc(C3CC3)n2)cc1)C1CCC1 ZINC000179853783 525660450 /nfs/dbraw/zinc/66/04/50/525660450.db2.gz ALJJWGANBJOIEV-LBPRGKRZSA-N 1 2 313.401 4.127 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)c1 ZINC000368609224 525709650 /nfs/dbraw/zinc/70/96/50/525709650.db2.gz WSEYAKLEIVBKAO-PBHICJAKSA-N 1 2 309.438 4.287 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3ccncc3F)cs2)o1 ZINC000338374173 525815042 /nfs/dbraw/zinc/81/50/42/525815042.db2.gz SNPQKLFYSYRCMC-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2[C@H](C)c2nc3ccccc3c(=O)[nH]2)o1 ZINC000265354089 525825439 /nfs/dbraw/zinc/82/54/39/525825439.db2.gz KTRFSMDZVZZTKR-CJNGLKHVSA-N 1 2 323.396 4.135 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2[C@H](C)c2nc3ccccc3c(=O)[nH]2)o1 ZINC000265354089 525825453 /nfs/dbraw/zinc/82/54/53/525825453.db2.gz KTRFSMDZVZZTKR-CJNGLKHVSA-N 1 2 323.396 4.135 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2ncnn2-c2ccccc2)c(C)c1 ZINC000337133652 525884803 /nfs/dbraw/zinc/88/48/03/525884803.db2.gz LCELXMXPFCJMBA-KRWDZBQOSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2ncnn2-c2ccccc2)c(C)c1 ZINC000337133652 525884813 /nfs/dbraw/zinc/88/48/13/525884813.db2.gz LCELXMXPFCJMBA-KRWDZBQOSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1c([C@@H](C)Nc2ccc([NH+](C)C)c(C)c2)cnn1C(C)C ZINC000191472407 525904836 /nfs/dbraw/zinc/90/48/36/525904836.db2.gz CVHIDWJNXBYPBQ-CQSZACIVSA-N 1 2 300.450 4.320 20 0 DIADLO Cc1c([C@H](C)[NH2+]Cc2coc(-c3ccccc3)n2)cnn1C(C)C ZINC000191313757 525920669 /nfs/dbraw/zinc/92/06/69/525920669.db2.gz DWJPTXXZTGQERI-AWEZNQCLSA-N 1 2 324.428 4.278 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@H](C)c2cncc(F)c2)c2ccccn2)cc1 ZINC000366435288 525972732 /nfs/dbraw/zinc/97/27/32/525972732.db2.gz WPJLTVQLDMJGOU-QRWLVFNGSA-N 1 2 321.399 4.364 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2ncnn2C(C)(C)C)o1 ZINC000338307062 525990424 /nfs/dbraw/zinc/99/04/24/525990424.db2.gz PWWZJFHFUAGZHA-OAHLLOKOSA-N 1 2 316.449 4.052 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2ncnn2C(C)(C)C)o1 ZINC000338307062 525990433 /nfs/dbraw/zinc/99/04/33/525990433.db2.gz PWWZJFHFUAGZHA-OAHLLOKOSA-N 1 2 316.449 4.052 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+][C@@H](CO)c2c(F)cccc2F)cc1 ZINC000266797728 526063803 /nfs/dbraw/zinc/06/38/03/526063803.db2.gz RBCHIALYVNUVOU-BZNIZROVSA-N 1 2 323.408 4.071 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1csc(-c2cccs2)n1 ZINC000127724639 526119259 /nfs/dbraw/zinc/11/92/59/526119259.db2.gz OXFVVJJWUDUMML-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1csc(-c2cccs2)n1 ZINC000127724639 526119268 /nfs/dbraw/zinc/11/92/68/526119268.db2.gz OXFVVJJWUDUMML-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO CC(C)(C)c1[nH]c2ccc(NC(=O)c3cc[nH]c3C3CC3)cc2[nH+]1 ZINC000284558690 534905783 /nfs/dbraw/zinc/90/57/83/534905783.db2.gz QFHRQFIJPIBFQO-UHFFFAOYSA-N 1 2 322.412 4.318 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cnc(-c3ccsc3)s2)o1 ZINC000337211247 526126079 /nfs/dbraw/zinc/12/60/79/526126079.db2.gz AHFDDJPTOVYJKW-SNVBAGLBSA-N 1 2 305.428 4.019 20 0 DIADLO C[C@H](C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1)c1ccccn1 ZINC000339252679 526146563 /nfs/dbraw/zinc/14/65/63/526146563.db2.gz HNENNHRMMCXWLJ-AWEZNQCLSA-N 1 2 319.364 4.011 20 0 DIADLO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1noc(-c3ccccc3)n1)CC2 ZINC000124428877 526211906 /nfs/dbraw/zinc/21/19/06/526211906.db2.gz MCZZVMXQNXYSDQ-RDTXWAMCSA-N 1 2 319.408 4.383 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@H](SCc1ccccc1)C(C)C ZINC000107289006 526240355 /nfs/dbraw/zinc/24/03/55/526240355.db2.gz BLSSCBATIUQBMA-QGZVFWFLSA-N 1 2 314.454 4.287 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@H](C)c1ccc(OC(C)C)cc1 ZINC000179848281 526240364 /nfs/dbraw/zinc/24/03/64/526240364.db2.gz RJFQVQHVPXTVEO-CQSZACIVSA-N 1 2 313.401 4.060 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccc(-c2cccs2)nc1C ZINC000107291940 526241404 /nfs/dbraw/zinc/24/14/04/526241404.db2.gz AQKINTHHENPEBH-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO C[C@H]1CCCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000264831578 526267441 /nfs/dbraw/zinc/26/74/41/526267441.db2.gz ADLFTWLWQMBYMI-HNNXBMFYSA-N 1 2 310.397 4.136 20 0 DIADLO FC(F)n1ccnc1C[N@H+](Cc1ccoc1)C1CCCCC1 ZINC000266003622 526271535 /nfs/dbraw/zinc/27/15/35/526271535.db2.gz OSFZWYMJUUVDOO-UHFFFAOYSA-N 1 2 309.360 4.206 20 0 DIADLO FC(F)n1ccnc1C[N@@H+](Cc1ccoc1)C1CCCCC1 ZINC000266003622 526271540 /nfs/dbraw/zinc/27/15/40/526271540.db2.gz OSFZWYMJUUVDOO-UHFFFAOYSA-N 1 2 309.360 4.206 20 0 DIADLO Fc1cc2cccnc2c(COc2cccc(-n3cc[nH+]c3)c2)c1 ZINC000156929750 526312196 /nfs/dbraw/zinc/31/21/96/526312196.db2.gz BSSKWXOGFAFXOY-UHFFFAOYSA-N 1 2 319.339 4.139 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ccc(F)cc3Cl)CCC2)n1 ZINC000265531673 526326450 /nfs/dbraw/zinc/32/64/50/526326450.db2.gz VKPAXQSRAUGEQN-UHFFFAOYSA-N 1 2 310.825 4.413 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](CCC(C)C)c2ccc(Cl)cc2)o1 ZINC000180030825 526343601 /nfs/dbraw/zinc/34/36/01/526343601.db2.gz HHFSVHATQYSFCC-HNNXBMFYSA-N 1 2 307.825 4.299 20 0 DIADLO Fc1cccc(Cl)c1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000338142367 526391226 /nfs/dbraw/zinc/39/12/26/526391226.db2.gz IXVATIFNDLCJQY-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cc3cccc(F)c3o2)s1 ZINC000338350227 526397246 /nfs/dbraw/zinc/39/72/46/526397246.db2.gz DQTDWBOAONZDQV-RKDXNWHRSA-N 1 2 305.378 4.144 20 0 DIADLO Fc1ccccc1-c1noc(C[NH2+]C2(c3ccccc3)CCC2)n1 ZINC000189094669 526406867 /nfs/dbraw/zinc/40/68/67/526406867.db2.gz CJBQGOOIFVDTQA-UHFFFAOYSA-N 1 2 323.371 4.045 20 0 DIADLO Fc1ccccc1[C@@H]([NH2+]Cc1nc(C2CC2)no1)C1CCCC1 ZINC000181492978 526416286 /nfs/dbraw/zinc/41/62/86/526416286.db2.gz YDWHIOSEMPJHBO-KRWDZBQOSA-N 1 2 315.392 4.107 20 0 DIADLO O=C(CCCc1cccs1)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000103967166 526462764 /nfs/dbraw/zinc/46/27/64/526462764.db2.gz PUCMJBXFDCCCIX-UHFFFAOYSA-N 1 2 311.410 4.100 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCOc2cccc(F)c2C1 ZINC000339164426 526668566 /nfs/dbraw/zinc/66/85/66/526668566.db2.gz MZFLBQKDLLBMED-UHFFFAOYSA-N 1 2 314.404 4.047 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCOc2cccc(F)c2C1 ZINC000339164426 526668570 /nfs/dbraw/zinc/66/85/70/526668570.db2.gz MZFLBQKDLLBMED-UHFFFAOYSA-N 1 2 314.404 4.047 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2csc(C3CC3)n2)s1 ZINC000162958640 526750350 /nfs/dbraw/zinc/75/03/50/526750350.db2.gz QJDJQRLHNWPNFD-JTQLQIEISA-N 1 2 307.488 4.287 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2csc(C3CC3)n2)s1 ZINC000162958640 526750356 /nfs/dbraw/zinc/75/03/56/526750356.db2.gz QJDJQRLHNWPNFD-JTQLQIEISA-N 1 2 307.488 4.287 20 0 DIADLO Cc1nc(C)c([C@H](C)[NH2+][C@H](c2nc(C3CC3)no2)C(C)C)s1 ZINC000180852566 526754994 /nfs/dbraw/zinc/75/49/94/526754994.db2.gz WFNIIFMVJCRGMB-GWCFXTLKSA-N 1 2 320.462 4.068 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)oc1C ZINC000181628190 526893938 /nfs/dbraw/zinc/89/39/38/526893938.db2.gz YVJMKAGAWJXPSR-MRXNPFEDSA-N 1 2 308.372 4.447 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2cccc(Cl)c2)C2CCCC2)no1 ZINC000181038921 526894439 /nfs/dbraw/zinc/89/44/39/526894439.db2.gz QFHHFURNIADIIE-INIZCTEOSA-N 1 2 305.809 4.053 20 0 DIADLO Cc1sccc1C[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000339212940 526917073 /nfs/dbraw/zinc/91/70/73/526917073.db2.gz FBRRTIUYTCEPNN-OAHLLOKOSA-N 1 2 300.452 4.392 20 0 DIADLO Clc1ccc([C@@H]2CSCC[N@@H+]2Cc2cccnc2)cc1 ZINC000116411087 526960558 /nfs/dbraw/zinc/96/05/58/526960558.db2.gz BPEGYNDDVXKITJ-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccc([C@@H]2CSCC[N@H+]2Cc2cccnc2)cc1 ZINC000116411087 526960564 /nfs/dbraw/zinc/96/05/64/526960564.db2.gz BPEGYNDDVXKITJ-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cccc(-c2noc(CCc3[nH]c4ccccc4[nH+]3)n2)c1 ZINC000073638081 526972852 /nfs/dbraw/zinc/97/28/52/526972852.db2.gz TVZYIGNDLLAIFG-UHFFFAOYSA-N 1 2 324.771 4.052 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2CCC(=O)c2ccc(F)cc2)cs1 ZINC000189833045 527080991 /nfs/dbraw/zinc/08/09/91/527080991.db2.gz YVGHACCEXWWMOU-MRXNPFEDSA-N 1 2 318.417 4.001 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2CCC(=O)c2ccc(F)cc2)cs1 ZINC000189833045 527080995 /nfs/dbraw/zinc/08/09/95/527080995.db2.gz YVGHACCEXWWMOU-MRXNPFEDSA-N 1 2 318.417 4.001 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)C2CCOCC2)c1C(C)C ZINC000191319816 527159722 /nfs/dbraw/zinc/15/97/22/527159722.db2.gz WVBSAYLOHIQAAG-UHFFFAOYSA-N 1 2 312.413 4.032 20 0 DIADLO Cc1ncc(C[N@@H+]2CCc3c(Cl)c(Cl)ccc3C2)s1 ZINC000338426048 527259870 /nfs/dbraw/zinc/25/98/70/527259870.db2.gz SXXWWMYPICADDW-UHFFFAOYSA-N 1 2 313.253 4.317 20 0 DIADLO Cc1ncc(C[N@H+]2CCc3c(Cl)c(Cl)ccc3C2)s1 ZINC000338426048 527259877 /nfs/dbraw/zinc/25/98/77/527259877.db2.gz SXXWWMYPICADDW-UHFFFAOYSA-N 1 2 313.253 4.317 20 0 DIADLO O=C(Nc1ccc2ccccc2c1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000128385113 527295841 /nfs/dbraw/zinc/29/58/41/527295841.db2.gz GGBNQCDUGFYTFK-QGZVFWFLSA-N 1 2 320.396 4.322 20 0 DIADLO Cc1ncc([C@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)c(C)n1 ZINC000163190162 527309653 /nfs/dbraw/zinc/30/96/53/527309653.db2.gz WMZYNLVTLYODPC-LIRRHRJNSA-N 1 2 307.397 4.127 20 0 DIADLO Cc1nc(N2CC=C(c3ccccc3C(F)(F)F)CC2)cc[nH+]1 ZINC000154743368 527343704 /nfs/dbraw/zinc/34/37/04/527343704.db2.gz LSXQWJAOOILETR-UHFFFAOYSA-N 1 2 319.330 4.098 20 0 DIADLO Cc1nc(N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc[nH+]1 ZINC000338484457 527351189 /nfs/dbraw/zinc/35/11/89/527351189.db2.gz LOFOIEHORBRAAY-OAHLLOKOSA-N 1 2 307.319 4.367 20 0 DIADLO Cn1cc[nH+]c1CNc1cccc(Cl)c1SCC(F)F ZINC000124544840 527438144 /nfs/dbraw/zinc/43/81/44/527438144.db2.gz QGUIVURUKZCJQU-UHFFFAOYSA-N 1 2 317.792 4.043 20 0 DIADLO CC(C)CC[C@H](NCc1cn2c([nH+]1)CCCC2)c1ccoc1 ZINC000286000119 534944793 /nfs/dbraw/zinc/94/47/93/534944793.db2.gz IOQHOQRKXNAAJM-KRWDZBQOSA-N 1 2 301.434 4.080 20 0 DIADLO CC[N@H+](Cc1nc(C)c(C)o1)Cc1cccc(Br)c1 ZINC000299409368 535389857 /nfs/dbraw/zinc/38/98/57/535389857.db2.gz ZDUYWOWUGAKODL-UHFFFAOYSA-N 1 2 323.234 4.076 20 0 DIADLO CC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287627507 535772566 /nfs/dbraw/zinc/77/25/66/535772566.db2.gz URGITHYDJKNCNR-KRWDZBQOSA-N 1 2 311.429 4.183 20 0 DIADLO CCc1noc(C)c1C[NH2+][C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000273414071 535885393 /nfs/dbraw/zinc/88/53/93/535885393.db2.gz UCMZWABENRGELK-LBPRGKRZSA-N 1 2 311.385 4.051 20 0 DIADLO CCc1c(NCc2ccc(C)[nH+]c2C)cnn1CCC(C)C ZINC000340603491 536079464 /nfs/dbraw/zinc/07/94/64/536079464.db2.gz IAABDHIENOQOJN-UHFFFAOYSA-N 1 2 300.450 4.116 20 0 DIADLO COc1cc(C)nc(C[NH2+][C@H](C)c2c(F)cccc2Cl)c1 ZINC000272129325 536693998 /nfs/dbraw/zinc/69/39/98/536693998.db2.gz AABAHXGJIMSSNB-LLVKDONJSA-N 1 2 308.784 4.042 20 0 DIADLO COc1cc(C)[nH+]c(CN[C@H](C)c2c(F)cccc2Cl)c1 ZINC000272129325 536694004 /nfs/dbraw/zinc/69/40/04/536694004.db2.gz AABAHXGJIMSSNB-LLVKDONJSA-N 1 2 308.784 4.042 20 0 DIADLO COc1cc(C)nc(C[NH2+][C@H](C)c2ccc(F)cc2Cl)c1 ZINC000272124205 536694221 /nfs/dbraw/zinc/69/42/21/536694221.db2.gz KNAZBVZGLFQWTP-LLVKDONJSA-N 1 2 308.784 4.042 20 0 DIADLO COCC[C@@H]([NH2+]Cc1csc(CCC(C)C)n1)c1ccco1 ZINC000273283232 536806021 /nfs/dbraw/zinc/80/60/21/536806021.db2.gz OHCZLEXADZUWEA-OAHLLOKOSA-N 1 2 322.474 4.192 20 0 DIADLO COCC[C@@H]([NH2+][C@H](C)c1nc2c(s1)CCCC2)c1ccco1 ZINC000272540117 536811255 /nfs/dbraw/zinc/81/12/55/536811255.db2.gz KNBZVKREFMMWPX-CHWSQXEVSA-N 1 2 320.458 4.043 20 0 DIADLO Fc1cc(C[N@@H+]2CC3CCC2CC3)cc(Br)c1F ZINC001236860153 1055294075 /nfs/dbraw/zinc/29/40/75/1055294075.db2.gz OYJRFFBXZZWMCL-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(C[N@H+]2CC3CCC2CC3)cc(Br)c1F ZINC001236860153 1055294091 /nfs/dbraw/zinc/29/40/91/1055294091.db2.gz OYJRFFBXZZWMCL-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(Cl)cncc2Br)[C@@H](C)C1 ZINC001238394679 1055651396 /nfs/dbraw/zinc/65/13/96/1055651396.db2.gz UJKRTKSZMOSCAD-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccc(OC(C)(C)C)cc3)ccn12 ZINC000654829402 1035581405 /nfs/dbraw/zinc/58/14/05/1035581405.db2.gz ZHEXONZBGXQFMJ-UHFFFAOYSA-N 1 2 323.396 4.072 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cccc(O)c1Br ZINC001213503724 1035614270 /nfs/dbraw/zinc/61/42/70/1035614270.db2.gz UXNYIXSIVARNPJ-UHFFFAOYSA-N 1 2 319.202 4.479 20 0 DIADLO Cc1noc(C)c1C[NH2+][C@H](C)c1nc(-c2ccccc2)cs1 ZINC000153972414 1035655669 /nfs/dbraw/zinc/65/56/69/1035655669.db2.gz NCHJZCATWYRTHY-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO CC[N@H+](Cc1cccc(Cl)c1)[C@H](C)c1nc(C2CC2)no1 ZINC000153988842 1035666563 /nfs/dbraw/zinc/66/65/63/1035666563.db2.gz KMUQTUMGOQBIRL-LLVKDONJSA-N 1 2 305.809 4.184 20 0 DIADLO CC[N@@H+](Cc1cccc(Cl)c1)[C@H](C)c1nc(C2CC2)no1 ZINC000153988842 1035666577 /nfs/dbraw/zinc/66/65/77/1035666577.db2.gz KMUQTUMGOQBIRL-LLVKDONJSA-N 1 2 305.809 4.184 20 0 DIADLO Cc1ncsc1C[N@@H+](C)Cc1cc(Cl)ccc1Cl ZINC000172799079 1035667191 /nfs/dbraw/zinc/66/71/91/1035667191.db2.gz VMYJWAGDXDSXSY-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1ncsc1C[N@H+](C)Cc1cc(Cl)ccc1Cl ZINC000172799079 1035667205 /nfs/dbraw/zinc/66/72/05/1035667205.db2.gz VMYJWAGDXDSXSY-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@@H]2c2ccncc2)cs1 ZINC000153999538 1035673281 /nfs/dbraw/zinc/67/32/81/1035673281.db2.gz ZFBBXBDIQSLPCR-MRXNPFEDSA-N 1 2 301.459 4.218 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@@H]2c2ccncc2)cs1 ZINC000153999538 1035673288 /nfs/dbraw/zinc/67/32/88/1035673288.db2.gz ZFBBXBDIQSLPCR-MRXNPFEDSA-N 1 2 301.459 4.218 20 0 DIADLO COc1cc(C[NH2+][C@H](CF)c2ccc(F)cc2)ccc1SC ZINC000631285124 1035711554 /nfs/dbraw/zinc/71/15/54/1035711554.db2.gz XRTHLHNXGQAQAN-OAHLLOKOSA-N 1 2 323.408 4.357 20 0 DIADLO Cc1cc(C)c(Nc2ccnc(Cl)c2OC(F)(F)F)c[nH+]1 ZINC001213511077 1035722516 /nfs/dbraw/zinc/72/25/16/1035722516.db2.gz VFUNFFINDUQCNJ-UHFFFAOYSA-N 1 2 317.698 4.389 20 0 DIADLO CC(C)(C)C1CC(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)C1 ZINC001125301965 1035850058 /nfs/dbraw/zinc/85/00/58/1035850058.db2.gz ZYYVEIWECUAABL-UHFFFAOYSA-N 1 2 315.392 4.022 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)sn1 ZINC001167084704 1035893689 /nfs/dbraw/zinc/89/36/89/1035893689.db2.gz OBPQIADACHDVFD-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)sn1 ZINC001167084704 1035893709 /nfs/dbraw/zinc/89/37/09/1035893709.db2.gz OBPQIADACHDVFD-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1ncsc1C[N@@H+](C)Cc1cccc(Cl)c1Cl ZINC000179611051 1035904021 /nfs/dbraw/zinc/90/40/21/1035904021.db2.gz YRUNCDKGQXQSND-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1ncsc1C[N@H+](C)Cc1cccc(Cl)c1Cl ZINC000179611051 1035904031 /nfs/dbraw/zinc/90/40/31/1035904031.db2.gz YRUNCDKGQXQSND-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO CCCC1(C(=O)Nc2cccc3c2CN(c2cccc[nH+]2)C3)CC1 ZINC000339850341 1035989738 /nfs/dbraw/zinc/98/97/38/1035989738.db2.gz QIFXQPHFMUXQDR-UHFFFAOYSA-N 1 2 321.424 4.121 20 0 DIADLO Cc1ncsc1C[N@H+](C)Cc1ccc(Oc2ccccc2)o1 ZINC000180429032 1036063166 /nfs/dbraw/zinc/06/31/66/1036063166.db2.gz RNIAZELJJFKJFI-UHFFFAOYSA-N 1 2 314.410 4.469 20 0 DIADLO Cc1ncsc1C[N@@H+](C)Cc1ccc(Oc2ccccc2)o1 ZINC000180429032 1036063183 /nfs/dbraw/zinc/06/31/83/1036063183.db2.gz RNIAZELJJFKJFI-UHFFFAOYSA-N 1 2 314.410 4.469 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)Cc1cnc(-c2cccs2)s1 ZINC000091812737 1036164109 /nfs/dbraw/zinc/16/41/09/1036164109.db2.gz XNYWGZPKZNHZMW-UHFFFAOYSA-N 1 2 319.455 4.108 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)Cc1cnc(-c2cccs2)s1 ZINC000091812737 1036164127 /nfs/dbraw/zinc/16/41/27/1036164127.db2.gz XNYWGZPKZNHZMW-UHFFFAOYSA-N 1 2 319.455 4.108 20 0 DIADLO CC(C)=C[C@H]1[C@H](C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)C1(C)C ZINC000072058467 1036175870 /nfs/dbraw/zinc/17/58/70/1036175870.db2.gz CMYGRPKTSAXJRS-JKSUJKDBSA-N 1 2 309.413 4.254 20 0 DIADLO CCC[C@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1ccccn1 ZINC000090228565 1036188500 /nfs/dbraw/zinc/18/85/00/1036188500.db2.gz QKMOJXBIWHVPKD-ZDUSSCGKSA-N 1 2 312.310 4.269 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000247011593 1036189095 /nfs/dbraw/zinc/18/90/95/1036189095.db2.gz DEZCSFGJHHRONO-BZSNNMDCSA-N 1 2 319.493 4.289 20 0 DIADLO Clc1snnc1C[NH2+][C@H](c1ccccc1)C1CCCC1 ZINC000109801214 1036260709 /nfs/dbraw/zinc/26/07/09/1036260709.db2.gz JJMBZAIIQMDNNN-CQSZACIVSA-N 1 2 307.850 4.213 20 0 DIADLO C[N@H+](CCC(=O)OC(C)(C)C)Cc1c(Cl)cccc1Cl ZINC001167199061 1036264545 /nfs/dbraw/zinc/26/45/45/1036264545.db2.gz DKAVLYYLDSRQBZ-UHFFFAOYSA-N 1 2 318.244 4.157 20 0 DIADLO C[N@@H+](CCC(=O)OC(C)(C)C)Cc1c(Cl)cccc1Cl ZINC001167199061 1036264563 /nfs/dbraw/zinc/26/45/63/1036264563.db2.gz DKAVLYYLDSRQBZ-UHFFFAOYSA-N 1 2 318.244 4.157 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1coc(-c2ccccc2F)n1 ZINC001167244661 1036315179 /nfs/dbraw/zinc/31/51/79/1036315179.db2.gz XQWLHMDZXSTDJF-GFCCVEGCSA-N 1 2 300.333 4.267 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1coc(-c2ccccc2F)n1 ZINC001167244661 1036315188 /nfs/dbraw/zinc/31/51/88/1036315188.db2.gz XQWLHMDZXSTDJF-GFCCVEGCSA-N 1 2 300.333 4.267 20 0 DIADLO c1cc(C[NH2+]Cc2csc(COc3ccccc3)n2)cs1 ZINC001648802271 1036371473 /nfs/dbraw/zinc/37/14/73/1036371473.db2.gz DASAFVJMKSRAIL-UHFFFAOYSA-N 1 2 316.451 4.073 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1F)Cc1ccc(C(C)(C)C)cc1 ZINC000144854455 1036377104 /nfs/dbraw/zinc/37/71/04/1036377104.db2.gz ZPOLAUQTBKIPBA-UHFFFAOYSA-N 1 2 313.416 4.438 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1F)Cc1ccc(C(C)(C)C)cc1 ZINC000144854455 1036377117 /nfs/dbraw/zinc/37/71/17/1036377117.db2.gz ZPOLAUQTBKIPBA-UHFFFAOYSA-N 1 2 313.416 4.438 20 0 DIADLO C[N@H+](CCOC(C)(C)C)Cc1nc(C2CCCCC2)cs1 ZINC000683520866 1036437877 /nfs/dbraw/zinc/43/78/77/1036437877.db2.gz LVYCURRTMXDEEQ-UHFFFAOYSA-N 1 2 310.507 4.438 20 0 DIADLO C[N@@H+](CCOC(C)(C)C)Cc1nc(C2CCCCC2)cs1 ZINC000683520866 1036437884 /nfs/dbraw/zinc/43/78/84/1036437884.db2.gz LVYCURRTMXDEEQ-UHFFFAOYSA-N 1 2 310.507 4.438 20 0 DIADLO COCc1cc[nH+]c(NCc2csc(Cl)c2Cl)c1 ZINC000650243656 1036499638 /nfs/dbraw/zinc/49/96/38/1036499638.db2.gz KDYFDRBFGCQYHL-UHFFFAOYSA-N 1 2 303.214 4.208 20 0 DIADLO Fc1cccc([C@H]([NH2+][C@@H]2CCCn3ccnc32)c2ccccc2)c1 ZINC000655723272 1036506016 /nfs/dbraw/zinc/50/60/16/1036506016.db2.gz MMIRGNZWMPWOBD-RTBURBONSA-N 1 2 321.399 4.236 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)CC2CCCCC2)c(N(C)C)[nH+]1 ZINC001266515943 1036586953 /nfs/dbraw/zinc/58/69/53/1036586953.db2.gz NEURUVJDTCXQRU-CYBMUJFWSA-N 1 2 303.450 4.001 20 0 DIADLO Cc1cc(CNc2ccc(OC(F)F)cc2)c2c([nH+]1)CCCC2 ZINC001648857341 1036649974 /nfs/dbraw/zinc/64/99/74/1036649974.db2.gz SNKVWHKBMNEWMT-UHFFFAOYSA-N 1 2 318.367 4.482 20 0 DIADLO Cc1ccc2cc(CNc3ccc(-n4cc[nH+]c4)cc3)[nH]c2c1 ZINC001648864565 1036659826 /nfs/dbraw/zinc/65/98/26/1036659826.db2.gz SDVWEJNLBITSES-UHFFFAOYSA-N 1 2 302.381 4.274 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)[nH]c1C ZINC000579972740 1036660364 /nfs/dbraw/zinc/66/03/64/1036660364.db2.gz IQPOXJSKHSGHLZ-UHFFFAOYSA-N 1 2 310.228 4.112 20 0 DIADLO Cc1[nH]c(CNC2(c3ccc(Cl)c(Cl)c3)CC2)[nH+]c1C ZINC000579972740 1036660372 /nfs/dbraw/zinc/66/03/72/1036660372.db2.gz IQPOXJSKHSGHLZ-UHFFFAOYSA-N 1 2 310.228 4.112 20 0 DIADLO c1cn(-c2ccc(NCc3ccc4scnc4c3)cc2)c[nH+]1 ZINC001648864524 1036660702 /nfs/dbraw/zinc/66/07/02/1036660702.db2.gz PJIPFBFAYVCJEL-UHFFFAOYSA-N 1 2 306.394 4.094 20 0 DIADLO Fc1cc(Cl)cc(CNc2ccc(N3CCCCC3)c[nH+]2)c1 ZINC001648873862 1036665822 /nfs/dbraw/zinc/66/58/22/1036665822.db2.gz FLNLXKCOJSKTTP-UHFFFAOYSA-N 1 2 319.811 4.477 20 0 DIADLO Fc1ccc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)c(F)c1 ZINC000072671463 1036694845 /nfs/dbraw/zinc/69/48/45/1036694845.db2.gz FPIMTKXJSZGGJP-IBGZPJMESA-N 1 2 310.347 4.239 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1csc2c1CCCC2 ZINC000023889400 1036717497 /nfs/dbraw/zinc/71/74/97/1036717497.db2.gz PFKCFRCDQRLXTI-UHFFFAOYSA-N 1 2 323.421 4.065 20 0 DIADLO CC[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccccc1OC ZINC000340490930 1036740678 /nfs/dbraw/zinc/74/06/78/1036740678.db2.gz SRBAHZKJZJIRPA-INIZCTEOSA-N 1 2 309.331 4.353 20 0 DIADLO Cc1c([C@@H](C)[NH2+]Cc2c(F)cc(F)cc2F)cnn1C(C)C ZINC000340492933 1036759864 /nfs/dbraw/zinc/75/98/64/1036759864.db2.gz WZRJMBDKXMOAKF-SNVBAGLBSA-N 1 2 311.351 4.041 20 0 DIADLO Oc1ccc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)cc1 ZINC000683722118 1036768471 /nfs/dbraw/zinc/76/84/71/1036768471.db2.gz KQHJPULQCPWDDR-UHFFFAOYSA-N 1 2 319.408 4.204 20 0 DIADLO CCCC[C@H]([NH2+]Cc1ncn(-c2ccccc2)n1)c1ccccc1 ZINC000340531087 1036793396 /nfs/dbraw/zinc/79/33/96/1036793396.db2.gz IVEUJVACNKHIDT-IBGZPJMESA-N 1 2 320.440 4.288 20 0 DIADLO C[N@H+](CCF)Cc1cnc(-c2ccc(C(F)(F)F)cc2)s1 ZINC001140218630 1036814334 /nfs/dbraw/zinc/81/43/34/1036814334.db2.gz XZYSSUYGSURBIV-UHFFFAOYSA-N 1 2 318.339 4.230 20 0 DIADLO C[N@@H+](CCF)Cc1cnc(-c2ccc(C(F)(F)F)cc2)s1 ZINC001140218630 1036814367 /nfs/dbraw/zinc/81/43/67/1036814367.db2.gz XZYSSUYGSURBIV-UHFFFAOYSA-N 1 2 318.339 4.230 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1ccsc1Cl ZINC000312641480 1036842157 /nfs/dbraw/zinc/84/21/57/1036842157.db2.gz JOQVBHXTCZMOSB-UHFFFAOYSA-N 1 2 302.226 4.353 20 0 DIADLO Cc1cc(Oc2ccc(Nc3c[nH]c(=O)c(F)c3)cc2)cc[nH+]1 ZINC001210606340 1036868163 /nfs/dbraw/zinc/86/81/63/1036868163.db2.gz DENINFUTDXPMEX-UHFFFAOYSA-N 1 2 311.316 4.166 20 0 DIADLO Fc1cc(NCc2ccc3cnccc3c2)ccc1-n1cc[nH+]c1 ZINC000683773438 1036886689 /nfs/dbraw/zinc/88/66/89/1036886689.db2.gz XZTWUTRQJXCPCN-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO Cc1nc([C@H]([NH2+][C@H](C)[C@H]2CC2(C)C)c2ccc(Cl)cc2)no1 ZINC000683774465 1036893637 /nfs/dbraw/zinc/89/36/37/1036893637.db2.gz VKXSELQDYRANFW-VCTAVGKDSA-N 1 2 319.836 4.145 20 0 DIADLO COc1cc(Nc2ncc(C(F)(F)F)cc2Cl)cc(C)[nH+]1 ZINC001210775621 1036954698 /nfs/dbraw/zinc/95/46/98/1036954698.db2.gz HOYAFFHPVRBYED-UHFFFAOYSA-N 1 2 317.698 4.209 20 0 DIADLO COc1cc(Nc2ncc(Cl)cc2C(F)(F)F)cc(C)[nH+]1 ZINC001210779810 1036959663 /nfs/dbraw/zinc/95/96/63/1036959663.db2.gz ZHMQLKAKMLEIQD-UHFFFAOYSA-N 1 2 317.698 4.209 20 0 DIADLO COc1cc(N(Cc2ccccc2)c2ccccc2N)cc(C)[nH+]1 ZINC001210781098 1036965534 /nfs/dbraw/zinc/96/55/34/1036965534.db2.gz XLRQBKDLXHBKBQ-UHFFFAOYSA-N 1 2 319.408 4.319 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1nc(C)sc1C)c1ccc(Cl)cc1 ZINC000683822480 1036973572 /nfs/dbraw/zinc/97/35/72/1036973572.db2.gz UWDLIWBSLDCAIJ-MEBBXXQBSA-N 1 2 324.877 4.452 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@@H+]2Cc2ncccc2Cl)cc1 ZINC001167371800 1037014206 /nfs/dbraw/zinc/01/42/06/1037014206.db2.gz ISBJWDNFACGNHL-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@H+]2Cc2ncccc2Cl)cc1 ZINC001167371800 1037014221 /nfs/dbraw/zinc/01/42/21/1037014221.db2.gz ISBJWDNFACGNHL-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO c1cc(Nc2ccc(N3CCCCC3)[nH+]c2)cc(OC2CC2)c1 ZINC001210859529 1037019804 /nfs/dbraw/zinc/01/98/04/1037019804.db2.gz WPNIBCRRZCDBTP-UHFFFAOYSA-N 1 2 309.413 4.357 20 0 DIADLO CC[C@H]1CCC[N@@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)CC1 ZINC001167382120 1037068154 /nfs/dbraw/zinc/06/81/54/1037068154.db2.gz VJBIDPQDKCHITD-BBRMVZONSA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@H]1CCC[N@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)CC1 ZINC001167382120 1037068173 /nfs/dbraw/zinc/06/81/73/1037068173.db2.gz VJBIDPQDKCHITD-BBRMVZONSA-N 1 2 309.837 4.066 20 0 DIADLO COc1ccc2cc(CNc3cc4cc[nH]c4c[nH+]3)ccc2c1 ZINC000683893396 1037074490 /nfs/dbraw/zinc/07/44/90/1037074490.db2.gz QYYUTHIFCCATSC-UHFFFAOYSA-N 1 2 303.365 4.337 20 0 DIADLO COc1cc(C)c(Nc2ccc(C)c[nH+]2)cc1Br ZINC001211012375 1037092029 /nfs/dbraw/zinc/09/20/29/1037092029.db2.gz CNQUGWBBZNFJDV-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cn1c(NCc2cc3ccccc3[nH]2)[nH+]c2cccc(Cl)c21 ZINC000683923860 1037102673 /nfs/dbraw/zinc/10/26/73/1037102673.db2.gz GZDFDKVJOUKISS-UHFFFAOYSA-N 1 2 310.788 4.320 20 0 DIADLO Cc1cccc(C)c1NC(=O)/C=C\c1ccc(-n2cc[nH+]c2)cc1 ZINC000255523589 1037136294 /nfs/dbraw/zinc/13/62/94/1037136294.db2.gz PDXCXOVVELNIBX-FLIBITNWSA-N 1 2 317.392 4.141 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cc(C(F)(F)F)ccc2N)cc1 ZINC001211154250 1037179706 /nfs/dbraw/zinc/17/97/06/1037179706.db2.gz WORFJNOAAYRFLC-UHFFFAOYSA-N 1 2 309.335 4.487 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cc(C(F)(F)F)ccc2N)cc1 ZINC001211154250 1037179718 /nfs/dbraw/zinc/17/97/18/1037179718.db2.gz WORFJNOAAYRFLC-UHFFFAOYSA-N 1 2 309.335 4.487 20 0 DIADLO Clc1ccccc1C1([NH2+]Cc2cc(C3CC3)no2)CCC1 ZINC000660908246 1037181341 /nfs/dbraw/zinc/18/13/41/1037181341.db2.gz AJSUUPBELKJGGB-UHFFFAOYSA-N 1 2 302.805 4.374 20 0 DIADLO CC[C@@H]1COCC[N@@H+]1Cc1ccc(Oc2ccccc2)c(F)c1 ZINC001167421513 1037219415 /nfs/dbraw/zinc/21/94/15/1037219415.db2.gz VKEDOZJODHTYTL-MRXNPFEDSA-N 1 2 315.388 4.229 20 0 DIADLO CC[C@@H]1COCC[N@H+]1Cc1ccc(Oc2ccccc2)c(F)c1 ZINC001167421513 1037219428 /nfs/dbraw/zinc/21/94/28/1037219428.db2.gz VKEDOZJODHTYTL-MRXNPFEDSA-N 1 2 315.388 4.229 20 0 DIADLO CC[C@@H]1C[N@H+](CCc2cccc(Cl)c2Cl)C[C@H](C)O1 ZINC001167421660 1037219727 /nfs/dbraw/zinc/21/97/27/1037219727.db2.gz ZPBKGZGCGGJVOQ-WCQYABFASA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)C[C@H](C)O1 ZINC001167421660 1037219736 /nfs/dbraw/zinc/21/97/36/1037219736.db2.gz ZPBKGZGCGGJVOQ-WCQYABFASA-N 1 2 302.245 4.035 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3ccccc3[nH]2)C[C@H](c2ccsc2)O1 ZINC000684020400 1037245426 /nfs/dbraw/zinc/24/54/26/1037245426.db2.gz CBCRLKRUWYWALJ-FZKQIMNGSA-N 1 2 312.438 4.191 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)C[C@H](c2ccsc2)O1 ZINC000684020400 1037245443 /nfs/dbraw/zinc/24/54/43/1037245443.db2.gz CBCRLKRUWYWALJ-FZKQIMNGSA-N 1 2 312.438 4.191 20 0 DIADLO Cc1nc(C[NH2+][C@@H]2CCCOc3c(Cl)cccc32)cs1 ZINC000126557523 1037317551 /nfs/dbraw/zinc/31/75/51/1037317551.db2.gz KJJZSJABQUSVKY-CQSZACIVSA-N 1 2 308.834 4.108 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000580861416 1037337298 /nfs/dbraw/zinc/33/72/98/1037337298.db2.gz ZSCFJKIMVYUHBA-GFCCVEGCSA-N 1 2 309.837 4.035 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000580861416 1037337305 /nfs/dbraw/zinc/33/73/05/1037337305.db2.gz ZSCFJKIMVYUHBA-GFCCVEGCSA-N 1 2 309.837 4.035 20 0 DIADLO FC(F)(F)c1cccc([C@@]2(F)CC[N@H+](CC3(F)CC3)C2)c1 ZINC000580905398 1037348531 /nfs/dbraw/zinc/34/85/31/1037348531.db2.gz HOGAFPVTNSOSRC-CQSZACIVSA-N 1 2 305.290 4.078 20 0 DIADLO FC(F)(F)c1cccc([C@@]2(F)CC[N@@H+](CC3(F)CC3)C2)c1 ZINC000580905398 1037348549 /nfs/dbraw/zinc/34/85/49/1037348549.db2.gz HOGAFPVTNSOSRC-CQSZACIVSA-N 1 2 305.290 4.078 20 0 DIADLO COc1ccc(C)cc1C[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000684109393 1037354960 /nfs/dbraw/zinc/35/49/60/1037354960.db2.gz PBFJUOHYNVOGHG-UHFFFAOYSA-N 1 2 304.459 4.047 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC001143387745 1037415991 /nfs/dbraw/zinc/41/59/91/1037415991.db2.gz RFUCTOFEARWXNP-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC001143387745 1037416001 /nfs/dbraw/zinc/41/60/01/1037416001.db2.gz RFUCTOFEARWXNP-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+]1CCc2ccccc2[C@@H]1C ZINC001143387849 1037417310 /nfs/dbraw/zinc/41/73/10/1037417310.db2.gz WEDUHKQXKDCVJC-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+]1CCc2ccccc2[C@@H]1C ZINC001143387849 1037417313 /nfs/dbraw/zinc/41/73/13/1037417313.db2.gz WEDUHKQXKDCVJC-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO CCOC(=O)[C@H](c1ccccc1)[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000558054352 1037438398 /nfs/dbraw/zinc/43/83/98/1037438398.db2.gz URYZWXIHKWTZGU-IRXDYDNUSA-N 1 2 315.438 4.189 20 0 DIADLO CCOC(=O)[C@H](c1ccccc1)[N@H+]1CCC[C@H]1c1ccsc1 ZINC000558054352 1037438401 /nfs/dbraw/zinc/43/84/01/1037438401.db2.gz URYZWXIHKWTZGU-IRXDYDNUSA-N 1 2 315.438 4.189 20 0 DIADLO CC1(C)CCC[C@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000581156675 1037456463 /nfs/dbraw/zinc/45/64/63/1037456463.db2.gz BWRZEAQSJKKXBK-INIZCTEOSA-N 1 2 322.412 4.275 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)c1Cl ZINC001204553753 1037489588 /nfs/dbraw/zinc/48/95/88/1037489588.db2.gz YAQXVRNHGBYBIE-ZIAGYGMSSA-N 1 2 317.832 4.478 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c1Cl ZINC001204553753 1037489593 /nfs/dbraw/zinc/48/95/93/1037489593.db2.gz YAQXVRNHGBYBIE-ZIAGYGMSSA-N 1 2 317.832 4.478 20 0 DIADLO CC(C)c1ccc([C@H]([NH2+]Cc2ncc[nH]2)c2cccs2)cc1 ZINC000067667184 1037519515 /nfs/dbraw/zinc/51/95/15/1037519515.db2.gz VVROYVUTZWFSPU-SFHVURJKSA-N 1 2 311.454 4.474 20 0 DIADLO Cc1cc(C)cc(NC(=O)C[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000340977068 1037549148 /nfs/dbraw/zinc/54/91/48/1037549148.db2.gz ARJMECIOFXMTMX-GOSISDBHSA-N 1 2 319.408 4.187 20 0 DIADLO C[N@@H+](Cc1sc(NC(C)(C)C)nc1Cl)C1CC(F)(F)C1 ZINC001140391016 1037608396 /nfs/dbraw/zinc/60/83/96/1037608396.db2.gz YYGXFEHHIMHZEI-UHFFFAOYSA-N 1 2 323.840 4.236 20 0 DIADLO C[N@H+](Cc1sc(NC(C)(C)C)nc1Cl)C1CC(F)(F)C1 ZINC001140391016 1037608389 /nfs/dbraw/zinc/60/83/89/1037608389.db2.gz YYGXFEHHIMHZEI-UHFFFAOYSA-N 1 2 323.840 4.236 20 0 DIADLO C[N@H+](Cc1csc(-c2ccsc2)n1)Cc1ccc(O)cc1 ZINC000349410414 1037611277 /nfs/dbraw/zinc/61/12/77/1037611277.db2.gz TWAWHYWUFGMFFD-UHFFFAOYSA-N 1 2 316.451 4.209 20 0 DIADLO C[N@@H+](Cc1csc(-c2ccsc2)n1)Cc1ccc(O)cc1 ZINC000349410414 1037611285 /nfs/dbraw/zinc/61/12/85/1037611285.db2.gz TWAWHYWUFGMFFD-UHFFFAOYSA-N 1 2 316.451 4.209 20 0 DIADLO Cc1cc2c(s1)N(c1ccncc1F)c1ccccc1NC2=[NH2+] ZINC001167463261 1037645989 /nfs/dbraw/zinc/64/59/89/1037645989.db2.gz IFTMAOLLOQSHQN-UHFFFAOYSA-N 1 2 324.384 4.411 20 0 DIADLO Cc1cn(C)nc1C[NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl ZINC000723495362 1037675126 /nfs/dbraw/zinc/67/51/26/1037675126.db2.gz DVPOHVIFUUIPAO-SECBINFHSA-N 1 2 316.207 4.025 20 0 DIADLO Cc1csc(C(C)(C)[NH2+]Cc2cc(-c3ccccc3)no2)n1 ZINC000072663114 1037693568 /nfs/dbraw/zinc/69/35/68/1037693568.db2.gz YUKQTGPKDJGPKS-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001143394874 1037706478 /nfs/dbraw/zinc/70/64/78/1037706478.db2.gz UAOQJDOOJWOPPR-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001143394874 1037706496 /nfs/dbraw/zinc/70/64/96/1037706496.db2.gz UAOQJDOOJWOPPR-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cn(C)nc1C[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1F ZINC000723517384 1037707853 /nfs/dbraw/zinc/70/78/53/1037707853.db2.gz KSSFVZIEDFCQTL-SECBINFHSA-N 1 2 316.207 4.025 20 0 DIADLO CCO[C@@H](C)c1nc(C[NH2+][C@H](C)c2cccc(OC)c2)cs1 ZINC000341218730 1037758874 /nfs/dbraw/zinc/75/88/74/1037758874.db2.gz KYKPQKODBZTXOE-OLZOCXBDSA-N 1 2 320.458 4.100 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1cc(F)cc(F)c1 ZINC000090228919 1037759770 /nfs/dbraw/zinc/75/97/70/1037759770.db2.gz MMKUGBKGSUCMAZ-ZETCQYMHSA-N 1 2 319.248 4.372 20 0 DIADLO C[N@H+](Cc1nc(-c2cccs2)no1)Cc1ccc(Cl)cc1 ZINC000023038264 1037804395 /nfs/dbraw/zinc/80/43/95/1037804395.db2.gz UYUJKHYIMOQGNG-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO C[N@@H+](Cc1nc(-c2cccs2)no1)Cc1ccc(Cl)cc1 ZINC000023038264 1037804406 /nfs/dbraw/zinc/80/44/06/1037804406.db2.gz UYUJKHYIMOQGNG-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO Cc1cccn2c(/C=C/C(=O)c3csc(Cl)c3)c[nH+]c12 ZINC000188863298 1037828498 /nfs/dbraw/zinc/82/84/98/1037828498.db2.gz DEINBKVWWIPOTN-SNAWJCMRSA-N 1 2 302.786 4.254 20 0 DIADLO COCc1csc(CNc2[nH+]c3cc(Cl)ccc3n2C)c1 ZINC000656767166 1037849087 /nfs/dbraw/zinc/84/90/87/1037849087.db2.gz HIWWIUFFCZBBCX-UHFFFAOYSA-N 1 2 321.833 4.047 20 0 DIADLO Fc1cc2c(c(F)c1)[C@H]([NH2+]Cc1ccc(C(F)F)cc1)CO2 ZINC000684395206 1037932534 /nfs/dbraw/zinc/93/25/34/1037932534.db2.gz STRHMNVDPNAIDN-CYBMUJFWSA-N 1 2 311.278 4.126 20 0 DIADLO Clc1ccc(Cl)c(C[NH+]2CC([C@@H]3CCOC3)C2)c1Cl ZINC000684414201 1037961502 /nfs/dbraw/zinc/96/15/02/1037961502.db2.gz CLEGYDRSGRVFPW-SECBINFHSA-N 1 2 320.647 4.115 20 0 DIADLO COc1c(C)c[nH+]c(CNC(=O)CCCC2CCCCC2)c1C ZINC000064998792 1037962379 /nfs/dbraw/zinc/96/23/79/1037962379.db2.gz JNLDHHNBLGVKMS-UHFFFAOYSA-N 1 2 318.461 4.074 20 0 DIADLO Clc1ccc(Cl)c(C[NH+]2CC([C@H]3CCOC3)C2)c1Cl ZINC000684414202 1037962759 /nfs/dbraw/zinc/96/27/59/1037962759.db2.gz CLEGYDRSGRVFPW-VIFPVBQESA-N 1 2 320.647 4.115 20 0 DIADLO CC(C)Cn1nccc1C[NH2+]Cc1c(Cl)cccc1Cl ZINC000647177009 1037964777 /nfs/dbraw/zinc/96/47/77/1037964777.db2.gz HQRCAVZLYHJVSY-UHFFFAOYSA-N 1 2 312.244 4.136 20 0 DIADLO C[C@H](CNc1cccc[nH+]1)Sc1ccc(Br)cc1 ZINC000597950331 1037982494 /nfs/dbraw/zinc/98/24/94/1037982494.db2.gz VWGGIMQKNBIQFZ-LLVKDONJSA-N 1 2 323.259 4.437 20 0 DIADLO Fc1ccc(C(F)(F)C[N@@H+]2CC[C@H](Cc3ccccc3)C2)cc1 ZINC001167482734 1037990900 /nfs/dbraw/zinc/99/09/00/1037990900.db2.gz PUHVRBIKMICSCH-MRXNPFEDSA-N 1 2 319.370 4.482 20 0 DIADLO Fc1ccc(C(F)(F)C[N@H+]2CC[C@H](Cc3ccccc3)C2)cc1 ZINC001167482734 1037990920 /nfs/dbraw/zinc/99/09/20/1037990920.db2.gz PUHVRBIKMICSCH-MRXNPFEDSA-N 1 2 319.370 4.482 20 0 DIADLO CC(C)(CC(=O)N1CCC[C@H](n2cc[nH+]c2)C1)C1CCCCC1 ZINC000684430557 1038019533 /nfs/dbraw/zinc/01/95/33/1038019533.db2.gz AAIRGKIQLQUPPW-KRWDZBQOSA-N 1 2 317.477 4.043 20 0 DIADLO Cc1cc(N2CCC[C@@H]2Cc2cccc(F)c2)nc(C2CC2)[nH+]1 ZINC000341478825 1038054928 /nfs/dbraw/zinc/05/49/28/1038054928.db2.gz GXUKFVUNFILDDH-QGZVFWFLSA-N 1 2 311.404 4.013 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc(C(F)F)c(F)c2)no1 ZINC000891648844 1038101236 /nfs/dbraw/zinc/10/12/36/1038101236.db2.gz UUSSKCBMXGGUOA-OAHLLOKOSA-N 1 2 310.319 4.397 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc(C(F)F)c(F)c2)no1 ZINC000891648844 1038101247 /nfs/dbraw/zinc/10/12/47/1038101247.db2.gz UUSSKCBMXGGUOA-OAHLLOKOSA-N 1 2 310.319 4.397 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2)c(C)c1 ZINC000926221444 1038184883 /nfs/dbraw/zinc/18/48/83/1038184883.db2.gz UPIAFLVNEQIPFV-CQSZACIVSA-N 1 2 307.397 4.204 20 0 DIADLO Cc1ccc(-c2ccc(C)c(NC(=O)CCCn3cc[nH+]c3)c2)o1 ZINC000684501709 1038186698 /nfs/dbraw/zinc/18/66/98/1038186698.db2.gz HUFVDPIDJBLXGP-UHFFFAOYSA-N 1 2 323.396 4.179 20 0 DIADLO COc1ccccc1/C(C)=C/C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000170750707 1038192171 /nfs/dbraw/zinc/19/21/71/1038192171.db2.gz SBVCHRVMUCVWGJ-VAWYXSNFSA-N 1 2 310.397 4.057 20 0 DIADLO COc1ccc(C[N@H+](CC(F)F)C2CCCCC2)cc1OC ZINC000603412445 1038200763 /nfs/dbraw/zinc/20/07/63/1038200763.db2.gz NSBYSKZKSPVSSJ-UHFFFAOYSA-N 1 2 313.388 4.104 20 0 DIADLO COc1ccc(C[N@@H+](CC(F)F)C2CCCCC2)cc1OC ZINC000603412445 1038200775 /nfs/dbraw/zinc/20/07/75/1038200775.db2.gz NSBYSKZKSPVSSJ-UHFFFAOYSA-N 1 2 313.388 4.104 20 0 DIADLO CCOc1ccc([C@@H]([NH2+]CC(F)F)C(C)C)cc1OCC ZINC000603408209 1038201975 /nfs/dbraw/zinc/20/19/75/1038201975.db2.gz PRNGEIIHPXCKJW-INIZCTEOSA-N 1 2 301.377 4.036 20 0 DIADLO CCC[C@@H](CC1CCCC1)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000603469755 1038214523 /nfs/dbraw/zinc/21/45/23/1038214523.db2.gz HYJFLXAVZRYSPM-ZWKOTPCHSA-N 1 2 317.477 4.043 20 0 DIADLO CC[N@H+](Cc1cscn1)Cc1ccc(C(F)(F)F)cc1 ZINC000728388212 1038215309 /nfs/dbraw/zinc/21/53/09/1038215309.db2.gz RKWPHNWSIWYHLS-UHFFFAOYSA-N 1 2 300.349 4.184 20 0 DIADLO CC[N@@H+](Cc1cscn1)Cc1ccc(C(F)(F)F)cc1 ZINC000728388212 1038215339 /nfs/dbraw/zinc/21/53/39/1038215339.db2.gz RKWPHNWSIWYHLS-UHFFFAOYSA-N 1 2 300.349 4.184 20 0 DIADLO CCCCOc1ccc(C[NH2+][C@@H](C)c2ncco2)cc1Cl ZINC000926251098 1038221752 /nfs/dbraw/zinc/22/17/52/1038221752.db2.gz OYELKEIFSMSOLV-LBPRGKRZSA-N 1 2 308.809 4.358 20 0 DIADLO C[N@H+](Cc1ncc(-c2ccccc2F)o1)Cc1cccc(F)c1 ZINC000158325623 1038239054 /nfs/dbraw/zinc/23/90/54/1038239054.db2.gz YKRPEYNHFPJAEJ-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1ncc(-c2ccccc2F)o1)Cc1cccc(F)c1 ZINC000158325623 1038239069 /nfs/dbraw/zinc/23/90/69/1038239069.db2.gz YKRPEYNHFPJAEJ-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO CC[N@H+](Cc1cc(C)c(C(=O)OC)o1)Cc1ccccc1Cl ZINC000603630115 1038255268 /nfs/dbraw/zinc/25/52/68/1038255268.db2.gz IQXCHTZXRQFXCU-UHFFFAOYSA-N 1 2 321.804 4.050 20 0 DIADLO CC[N@@H+](Cc1cc(C)c(C(=O)OC)o1)Cc1ccccc1Cl ZINC000603630115 1038255280 /nfs/dbraw/zinc/25/52/80/1038255280.db2.gz IQXCHTZXRQFXCU-UHFFFAOYSA-N 1 2 321.804 4.050 20 0 DIADLO FC(F)(F)c1ccc2c(cc[nH+]c2N2CCC3(CCO3)CC2)c1 ZINC000581984235 1038256490 /nfs/dbraw/zinc/25/64/90/1038256490.db2.gz BHNFTRWLUGSFQX-UHFFFAOYSA-N 1 2 322.330 4.013 20 0 DIADLO CC(C)c1nn(-c2ccccc2)cc1C[N@H+](C)Cc1ccco1 ZINC000349613688 1038269653 /nfs/dbraw/zinc/26/96/53/1038269653.db2.gz DJRXTZOVIGQUGU-UHFFFAOYSA-N 1 2 309.413 4.221 20 0 DIADLO CC(C)c1nn(-c2ccccc2)cc1C[N@@H+](C)Cc1ccco1 ZINC000349613688 1038269662 /nfs/dbraw/zinc/26/96/62/1038269662.db2.gz DJRXTZOVIGQUGU-UHFFFAOYSA-N 1 2 309.413 4.221 20 0 DIADLO CC(C)c1ccc(C[S@](=O)Cc2c[nH+]cn2C)c(C(C)C)c1 ZINC000610715287 1038270506 /nfs/dbraw/zinc/27/05/06/1038270506.db2.gz LPHGWZSZQXOHCY-QFIPXVFZSA-N 1 2 318.486 4.116 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+][C@@H](C)c2nnc(CC)o2)cc1 ZINC000341803904 1038271331 /nfs/dbraw/zinc/27/13/31/1038271331.db2.gz NRAGIYPGMFCRSR-RYUDHWBXSA-N 1 2 305.447 4.156 20 0 DIADLO CC(C)C[C@@H]1CCCCC[N@@H+]1Cc1nnc(C(F)(F)F)s1 ZINC000659946620 1038272507 /nfs/dbraw/zinc/27/25/07/1038272507.db2.gz HSAMHMJVUDIRMZ-NSHDSACASA-N 1 2 321.412 4.348 20 0 DIADLO CC(C)C[C@@H]1CCCCC[N@H+]1Cc1nnc(C(F)(F)F)s1 ZINC000659946620 1038272514 /nfs/dbraw/zinc/27/25/14/1038272514.db2.gz HSAMHMJVUDIRMZ-NSHDSACASA-N 1 2 321.412 4.348 20 0 DIADLO CC[C@H](C)[C@H](C(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000603785519 1038281258 /nfs/dbraw/zinc/28/12/58/1038281258.db2.gz SQDBPXKBEAIDMU-KSSFIOAISA-N 1 2 307.397 4.103 20 0 DIADLO CCc1ccc(NC(=O)c2ccc(Cn3cc[nH+]c3)cc2)cc1C ZINC000535818587 1038350322 /nfs/dbraw/zinc/35/03/22/1038350322.db2.gz XQHBBGDLFQYSAE-UHFFFAOYSA-N 1 2 319.408 4.055 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+]1CC(C)(C)OCC1(C)C ZINC000604386419 1038409990 /nfs/dbraw/zinc/40/99/90/1038409990.db2.gz KUJNQVDFUFQVMP-UHFFFAOYSA-N 1 2 320.458 4.101 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+]1CC(C)(C)OCC1(C)C ZINC000604386419 1038409994 /nfs/dbraw/zinc/40/99/94/1038409994.db2.gz KUJNQVDFUFQVMP-UHFFFAOYSA-N 1 2 320.458 4.101 20 0 DIADLO Cc1cccc([C@@H](C)Nc2cc(N3CCCCC3)nc[nH+]2)c1C ZINC000604380454 1038410159 /nfs/dbraw/zinc/41/01/59/1038410159.db2.gz SRUYYWUEJAESDC-MRXNPFEDSA-N 1 2 310.445 4.257 20 0 DIADLO Cc1cccc([C@@H](C)Nc2cc(N3CCCCC3)[nH+]cn2)c1C ZINC000604380454 1038410164 /nfs/dbraw/zinc/41/01/64/1038410164.db2.gz SRUYYWUEJAESDC-MRXNPFEDSA-N 1 2 310.445 4.257 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1ccco1 ZINC000236630551 1038432515 /nfs/dbraw/zinc/43/25/15/1038432515.db2.gz KMZBVUXFOMSWPU-UAGQMJEPSA-N 1 2 317.429 4.500 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1coc(-c2c(F)cccc2F)n1 ZINC000151330820 1038437636 /nfs/dbraw/zinc/43/76/36/1038437636.db2.gz UQPGDHQNXNVSRW-LLVKDONJSA-N 1 2 318.323 4.406 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1coc(-c2c(F)cccc2F)n1 ZINC000151330820 1038437642 /nfs/dbraw/zinc/43/76/42/1038437642.db2.gz UQPGDHQNXNVSRW-LLVKDONJSA-N 1 2 318.323 4.406 20 0 DIADLO COc1ccc(C2([NH2+]Cc3n[nH]c4ccccc43)CCCC2)cc1 ZINC000604765509 1038448723 /nfs/dbraw/zinc/44/87/23/1038448723.db2.gz SNCYRTQFDOKHAP-UHFFFAOYSA-N 1 2 321.424 4.131 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2ccc(C(F)(F)F)cn2)c1 ZINC000342124287 1038448935 /nfs/dbraw/zinc/44/89/35/1038448935.db2.gz IVVKKMSEZBCDTJ-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2ccc(C(F)(F)F)cn2)c1 ZINC000342124287 1038448942 /nfs/dbraw/zinc/44/89/42/1038448942.db2.gz IVVKKMSEZBCDTJ-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO CCCN(Cc1ccc(OC)cc1)c1cc(C)[nH+]c(C2CC2)n1 ZINC000604756891 1038449483 /nfs/dbraw/zinc/44/94/83/1038449483.db2.gz QPMPBBBLZIVSPW-UHFFFAOYSA-N 1 2 311.429 4.088 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC000604884998 1038462609 /nfs/dbraw/zinc/46/26/09/1038462609.db2.gz SKBWJFKYWKIQEB-QGZVFWFLSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC000604884998 1038462612 /nfs/dbraw/zinc/46/26/12/1038462612.db2.gz SKBWJFKYWKIQEB-QGZVFWFLSA-N 1 2 303.837 4.455 20 0 DIADLO Cn1c[nH+]cc1CNc1cccc(CSC2CCCC2)c1 ZINC000151698473 1038478784 /nfs/dbraw/zinc/47/87/84/1038478784.db2.gz ZNKPIAORSRGVIA-UHFFFAOYSA-N 1 2 301.459 4.208 20 0 DIADLO CCSc1ccccc1C[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC001167503925 1038479836 /nfs/dbraw/zinc/47/98/36/1038479836.db2.gz FRXNZZYRWRXVBM-GOSISDBHSA-N 1 2 313.466 4.372 20 0 DIADLO CCSc1ccccc1C[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC001167503925 1038479841 /nfs/dbraw/zinc/47/98/41/1038479841.db2.gz FRXNZZYRWRXVBM-GOSISDBHSA-N 1 2 313.466 4.372 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1ccnc(Cl)c1 ZINC000171792981 1038488249 /nfs/dbraw/zinc/48/82/49/1038488249.db2.gz FHTNCNHMHPJVBU-GLJUWKHASA-N 1 2 316.832 4.086 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@H+]1Cc1ccnc(Cl)c1 ZINC000171792981 1038488253 /nfs/dbraw/zinc/48/82/53/1038488253.db2.gz FHTNCNHMHPJVBU-GLJUWKHASA-N 1 2 316.832 4.086 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@H]2CSc3ccccc32)cs1 ZINC000605165956 1038492068 /nfs/dbraw/zinc/49/20/68/1038492068.db2.gz ISANNBWUKNNLCP-ZDUSSCGKSA-N 1 2 304.484 4.377 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3cncs3)cs2)o1 ZINC000934193183 1038506348 /nfs/dbraw/zinc/50/63/48/1038506348.db2.gz DVRIUCIHJOTDSF-SNVBAGLBSA-N 1 2 305.428 4.019 20 0 DIADLO CCC[C@H](NC(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccccn1 ZINC000653179876 1038507007 /nfs/dbraw/zinc/50/70/07/1038507007.db2.gz VBIACQWKNFDHEQ-INIZCTEOSA-N 1 2 312.417 4.065 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2csc(Cc3ccccc3)n2)[C@H]1C ZINC000605317127 1038509344 /nfs/dbraw/zinc/50/93/44/1038509344.db2.gz TUXVBEOLYMLKRE-UONOGXRCSA-N 1 2 318.511 4.060 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2csc(Cc3ccccc3)n2)[C@H]1C ZINC000605317127 1038509352 /nfs/dbraw/zinc/50/93/52/1038509352.db2.gz TUXVBEOLYMLKRE-UONOGXRCSA-N 1 2 318.511 4.060 20 0 DIADLO Fc1cccc2c1SCC[C@H]2[NH2+]Cc1nc2ccccc2o1 ZINC000684710098 1038531721 /nfs/dbraw/zinc/53/17/21/1038531721.db2.gz DEFPZICJAIVGSI-CYBMUJFWSA-N 1 2 314.385 4.294 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1nc(C2CCCC2)no1 ZINC000342356036 1038552764 /nfs/dbraw/zinc/55/27/64/1038552764.db2.gz FBRURTORWFDAEB-KRWDZBQOSA-N 1 2 311.429 4.064 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1nc(C2CCCC2)no1 ZINC000342356036 1038552768 /nfs/dbraw/zinc/55/27/68/1038552768.db2.gz FBRURTORWFDAEB-KRWDZBQOSA-N 1 2 311.429 4.064 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1ncc(Cl)s1)C(C)(C)C ZINC000934289609 1038578881 /nfs/dbraw/zinc/57/88/81/1038578881.db2.gz PJKVQWVFRLQAFG-CQSZACIVSA-N 1 2 309.866 4.377 20 0 DIADLO C[C@@]1(F)CCC[N@H+](Cc2ccc(F)c(OC(F)(F)F)c2)C1 ZINC001143436369 1038582536 /nfs/dbraw/zinc/58/25/36/1038582536.db2.gz NNXQATFIQARCFS-CYBMUJFWSA-N 1 2 309.278 4.048 20 0 DIADLO C[C@@]1(F)CCC[N@@H+](Cc2ccc(F)c(OC(F)(F)F)c2)C1 ZINC001143436369 1038582541 /nfs/dbraw/zinc/58/25/41/1038582541.db2.gz NNXQATFIQARCFS-CYBMUJFWSA-N 1 2 309.278 4.048 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1nc2ccccc2o1)C(C)(C)C ZINC000934295306 1038583529 /nfs/dbraw/zinc/58/35/29/1038583529.db2.gz WCITXUWREYNMOA-GOSISDBHSA-N 1 2 309.413 4.408 20 0 DIADLO CCc1ccc([C@H](C)CC(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC000606199013 1038584120 /nfs/dbraw/zinc/58/41/20/1038584120.db2.gz UDHUOSHTHHQBDM-CQSZACIVSA-N 1 2 307.397 4.029 20 0 DIADLO CC1CC[NH+](Cc2csc(NC(=O)CCC(C)(C)C)n2)CC1 ZINC000606356347 1038594241 /nfs/dbraw/zinc/59/42/41/1038594241.db2.gz HXOTUWXWUBCUHF-UHFFFAOYSA-N 1 2 323.506 4.140 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000606431420 1038600947 /nfs/dbraw/zinc/60/09/47/1038600947.db2.gz PTBJMOHCILLNMV-MOPGFXCFSA-N 1 2 317.379 4.489 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000606431420 1038600953 /nfs/dbraw/zinc/60/09/53/1038600953.db2.gz PTBJMOHCILLNMV-MOPGFXCFSA-N 1 2 317.379 4.489 20 0 DIADLO Cc1cccc(C)c1C[N@@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000606431698 1038601478 /nfs/dbraw/zinc/60/14/78/1038601478.db2.gz ODIMBVIQPQQTMV-QGZVFWFLSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1cccc(C)c1C[N@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000606431698 1038601482 /nfs/dbraw/zinc/60/14/82/1038601482.db2.gz ODIMBVIQPQQTMV-QGZVFWFLSA-N 1 2 311.429 4.291 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3cccc(F)c3[C@@H]2C)cc1F ZINC000606450850 1038603318 /nfs/dbraw/zinc/60/33/18/1038603318.db2.gz ULDUYXJYDHHLKM-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(C[N@H+]2CCc3cccc(F)c3[C@@H]2C)cc1F ZINC000606450850 1038603321 /nfs/dbraw/zinc/60/33/21/1038603321.db2.gz ULDUYXJYDHHLKM-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO C[C@H]1c2c(F)cccc2CC[N@H+]1Cc1cnn(-c2ccccc2)c1 ZINC000606450833 1038603761 /nfs/dbraw/zinc/60/37/61/1038603761.db2.gz SXTHHBVEQHQKTJ-HNNXBMFYSA-N 1 2 321.399 4.131 20 0 DIADLO C[C@H]1c2c(F)cccc2CC[N@@H+]1Cc1cnn(-c2ccccc2)c1 ZINC000606450833 1038603770 /nfs/dbraw/zinc/60/37/70/1038603770.db2.gz SXTHHBVEQHQKTJ-HNNXBMFYSA-N 1 2 321.399 4.131 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2nc(C(C)C)no2)o1 ZINC000606454126 1038604710 /nfs/dbraw/zinc/60/47/10/1038604710.db2.gz FFWBQRPLVCVRHE-CQSZACIVSA-N 1 2 303.406 4.212 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2nc(C(C)C)no2)o1 ZINC000606454126 1038604717 /nfs/dbraw/zinc/60/47/17/1038604717.db2.gz FFWBQRPLVCVRHE-CQSZACIVSA-N 1 2 303.406 4.212 20 0 DIADLO Clc1cccc2c(NCCc3cnc(C4CC4)nc3)cc[nH+]c12 ZINC000563283010 1038613632 /nfs/dbraw/zinc/61/36/32/1038613632.db2.gz WBGLAUNLAPNTIX-UHFFFAOYSA-N 1 2 324.815 4.210 20 0 DIADLO CC[C@@H]1CCC[N@H+](Cn2nc(C3CC3)n(C3CC3)c2=S)CC1 ZINC000172509590 1038613933 /nfs/dbraw/zinc/61/39/33/1038613933.db2.gz HSXRFJHCQHMSLY-CYBMUJFWSA-N 1 2 320.506 4.096 20 0 DIADLO CC[C@@H]1CCC[N@@H+](Cn2nc(C3CC3)n(C3CC3)c2=S)CC1 ZINC000172509590 1038613939 /nfs/dbraw/zinc/61/39/39/1038613939.db2.gz HSXRFJHCQHMSLY-CYBMUJFWSA-N 1 2 320.506 4.096 20 0 DIADLO CC(C)n1ccnc1C[NH2+]C(c1cccs1)c1cccs1 ZINC000657369218 1038614816 /nfs/dbraw/zinc/61/48/16/1038614816.db2.gz YSSGDUBKWVFXGN-UHFFFAOYSA-N 1 2 317.483 4.466 20 0 DIADLO CCCC[C@@H]1CCC[C@H]1NC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000606570051 1038614922 /nfs/dbraw/zinc/61/49/22/1038614922.db2.gz OPBITEQZWFGTTJ-GDBMZVCRSA-N 1 2 314.433 4.123 20 0 DIADLO CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000606570164 1038615233 /nfs/dbraw/zinc/61/52/33/1038615233.db2.gz YWOZYDIWZUNJKH-XJKSGUPXSA-N 1 2 314.433 4.075 20 0 DIADLO CC(C)(C)[C@@H](NC(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000606582950 1038616141 /nfs/dbraw/zinc/61/61/41/1038616141.db2.gz JYKXQDQLNJZMBG-KRWDZBQOSA-N 1 2 322.412 4.243 20 0 DIADLO Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc3[nH+]ccn3c2)c(C)c1 ZINC000606582771 1038616252 /nfs/dbraw/zinc/61/62/52/1038616252.db2.gz CMUHNMBLLFUIAH-OAHLLOKOSA-N 1 2 322.412 4.176 20 0 DIADLO CC(C)CN(Cc1ccccc1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606580629 1038616364 /nfs/dbraw/zinc/61/63/64/1038616364.db2.gz XAXAHIUTIPQJRL-UHFFFAOYSA-N 1 2 322.412 4.024 20 0 DIADLO Cc1nc(C[NH2+][C@H](Cc2ccccc2)c2ccccc2F)[nH]c1C ZINC000657373061 1038618533 /nfs/dbraw/zinc/61/85/33/1038618533.db2.gz OTKHKLPDOYKJKY-LJQANCHMSA-N 1 2 323.415 4.239 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2ccc(F)c(F)c2F)C2CC2)s1 ZINC000657380992 1038622048 /nfs/dbraw/zinc/62/20/48/1038622048.db2.gz NRGGFNFOKBKUOQ-CQSZACIVSA-N 1 2 312.360 4.110 20 0 DIADLO Cc1ccc2cc(C[NH2+][C@H](C)c3nc(C(C)(C)C)no3)[nH]c2c1 ZINC000657383067 1038623340 /nfs/dbraw/zinc/62/33/40/1038623340.db2.gz MBCKDWMVBXBKKA-GFCCVEGCSA-N 1 2 312.417 4.008 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+]Cc1nccn1C(C)C ZINC000657392934 1038634336 /nfs/dbraw/zinc/63/43/36/1038634336.db2.gz FWIBDYWBKUQZFN-MRXNPFEDSA-N 1 2 315.461 4.240 20 0 DIADLO CCCCCOc1cc(C)ccc1C[NH2+]Cc1nc(C)c(C)[nH]1 ZINC000657393082 1038634400 /nfs/dbraw/zinc/63/44/00/1038634400.db2.gz LJTZYEUFYASBMR-UHFFFAOYSA-N 1 2 315.461 4.194 20 0 DIADLO CCCCCOc1cc(C)ccc1CNCc1[nH]c(C)c(C)[nH+]1 ZINC000657393082 1038634403 /nfs/dbraw/zinc/63/44/03/1038634403.db2.gz LJTZYEUFYASBMR-UHFFFAOYSA-N 1 2 315.461 4.194 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@H]2c2ccccn2)s1 ZINC000582340911 1038635008 /nfs/dbraw/zinc/63/50/08/1038635008.db2.gz YRLWHHLYJAJTIA-AWEZNQCLSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@H]2c2ccccn2)s1 ZINC000582340911 1038635012 /nfs/dbraw/zinc/63/50/12/1038635012.db2.gz YRLWHHLYJAJTIA-AWEZNQCLSA-N 1 2 301.459 4.173 20 0 DIADLO FC(F)(F)[C@@H]1C[N@H+](CCCc2cccc3ccccc32)CCO1 ZINC000606901969 1038637919 /nfs/dbraw/zinc/63/79/19/1038637919.db2.gz SWMOTIVEGSRDRY-KRWDZBQOSA-N 1 2 323.358 4.036 20 0 DIADLO FC(F)(F)[C@@H]1C[N@@H+](CCCc2cccc3ccccc32)CCO1 ZINC000606901969 1038637921 /nfs/dbraw/zinc/63/79/21/1038637921.db2.gz SWMOTIVEGSRDRY-KRWDZBQOSA-N 1 2 323.358 4.036 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1ccncc1Cl)CCC2 ZINC000152502019 1038666142 /nfs/dbraw/zinc/66/61/42/1038666142.db2.gz GTJXLILMVLFEMX-AWEZNQCLSA-N 1 2 321.877 4.263 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccncc1Cl)CCC2 ZINC000152502019 1038666147 /nfs/dbraw/zinc/66/61/47/1038666147.db2.gz GTJXLILMVLFEMX-AWEZNQCLSA-N 1 2 321.877 4.263 20 0 DIADLO CCc1cc(C[N@H+](C)Cc2cscn2)c(O)c(C(C)(C)C)c1 ZINC000063127368 1038668756 /nfs/dbraw/zinc/66/87/56/1038668756.db2.gz VBIRQJLRNQFYQS-UHFFFAOYSA-N 1 2 318.486 4.341 20 0 DIADLO CCc1cc(C[N@@H+](C)Cc2cscn2)c(O)c(C(C)(C)C)c1 ZINC000063127368 1038668759 /nfs/dbraw/zinc/66/87/59/1038668759.db2.gz VBIRQJLRNQFYQS-UHFFFAOYSA-N 1 2 318.486 4.341 20 0 DIADLO Fc1cc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c(Cl)cc1Cl ZINC001232701006 1038671598 /nfs/dbraw/zinc/67/15/98/1038671598.db2.gz QZUJZSOFHSTJHJ-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1cc(C[N@H+]2CC[C@]3(CC3(F)F)C2)c(Cl)cc1Cl ZINC001232701006 1038671599 /nfs/dbraw/zinc/67/15/99/1038671599.db2.gz QZUJZSOFHSTJHJ-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO Cc1c[nH]c(C[NH2+]C(c2ccccc2C)c2ccccc2C)n1 ZINC000657433749 1038672039 /nfs/dbraw/zinc/67/20/39/1038672039.db2.gz AFZDJILZLLKTMT-UHFFFAOYSA-N 1 2 305.425 4.214 20 0 DIADLO CCc1cc(C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)on1 ZINC000607366000 1038674478 /nfs/dbraw/zinc/67/44/78/1038674478.db2.gz JHIMCNFJOKYCIY-UHFFFAOYSA-N 1 2 316.788 4.440 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccn(-c3cccc(F)c3)n2)[C@@H]1c1ccccc1 ZINC001167577685 1038678657 /nfs/dbraw/zinc/67/86/57/1038678657.db2.gz VCYQXDRIHUYZPA-QRWLVFNGSA-N 1 2 321.399 4.204 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccn(-c3cccc(F)c3)n2)[C@@H]1c1ccccc1 ZINC001167577685 1038678660 /nfs/dbraw/zinc/67/86/60/1038678660.db2.gz VCYQXDRIHUYZPA-QRWLVFNGSA-N 1 2 321.399 4.204 20 0 DIADLO CCCOc1cccc2c(NCc3csc(C)n3)cc[nH+]c12 ZINC000684888230 1038679898 /nfs/dbraw/zinc/67/98/98/1038679898.db2.gz MGYGDENLEANLHZ-UHFFFAOYSA-N 1 2 313.426 4.401 20 0 DIADLO Cc1ccc2nc(C)c(C(=O)Nc3c(C)cc(C)[nH+]c3C)cc2c1 ZINC000097040370 1038684891 /nfs/dbraw/zinc/68/48/91/1038684891.db2.gz KHRJTCVWNOUHOP-UHFFFAOYSA-N 1 2 319.408 4.424 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1csc(C2CC2)n1 ZINC000113335094 1038698806 /nfs/dbraw/zinc/69/88/06/1038698806.db2.gz DFIHJCWPIVFVEE-UHFFFAOYSA-N 1 2 302.443 4.054 20 0 DIADLO FC(F)c1ccnc(C[NH2+]Cc2cccc(C3CCCC3)c2)n1 ZINC000657466334 1038702999 /nfs/dbraw/zinc/70/29/99/1038702999.db2.gz GTBYEEYALBNKAS-UHFFFAOYSA-N 1 2 317.383 4.362 20 0 DIADLO COCC[N@H+](Cc1nc(C2CC2)cs1)[C@H](C)c1ccccc1 ZINC000342663239 1038709824 /nfs/dbraw/zinc/70/98/24/1038709824.db2.gz LVOKGZCHWULRDH-CQSZACIVSA-N 1 2 316.470 4.230 20 0 DIADLO COCC[N@@H+](Cc1nc(C2CC2)cs1)[C@H](C)c1ccccc1 ZINC000342663239 1038709832 /nfs/dbraw/zinc/70/98/32/1038709832.db2.gz LVOKGZCHWULRDH-CQSZACIVSA-N 1 2 316.470 4.230 20 0 DIADLO Cc1nc(C)c(C[N@@H+]2CCc3[nH]c4ccc(C)cc4c3C2)s1 ZINC000607729578 1038718665 /nfs/dbraw/zinc/71/86/65/1038718665.db2.gz UIXOLHMYOGAHIE-UHFFFAOYSA-N 1 2 311.454 4.108 20 0 DIADLO Cc1nc(C)c(C[N@H+]2CCc3[nH]c4ccc(C)cc4c3C2)s1 ZINC000607729578 1038718670 /nfs/dbraw/zinc/71/86/70/1038718670.db2.gz UIXOLHMYOGAHIE-UHFFFAOYSA-N 1 2 311.454 4.108 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](Cc2ccc(Cl)cc2)CCO1 ZINC000607745927 1038719197 /nfs/dbraw/zinc/71/91/97/1038719197.db2.gz VYQHNAOKOXXZAV-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2ccc(Cl)cc2)CCO1 ZINC000607745927 1038719206 /nfs/dbraw/zinc/71/92/06/1038719206.db2.gz VYQHNAOKOXXZAV-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2cccc(OCC(C)C)c2)cs1 ZINC000342682029 1038719303 /nfs/dbraw/zinc/71/93/03/1038719303.db2.gz NDPUUJSFEVLSPP-UHFFFAOYSA-N 1 2 304.459 4.118 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2cccc(OCC(C)C)c2)cs1 ZINC000342682029 1038719311 /nfs/dbraw/zinc/71/93/11/1038719311.db2.gz NDPUUJSFEVLSPP-UHFFFAOYSA-N 1 2 304.459 4.118 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2nc(C(C)(C)C)no2)cc1 ZINC000607741497 1038720165 /nfs/dbraw/zinc/72/01/65/1038720165.db2.gz HWPSVXQAIFOXHX-INIZCTEOSA-N 1 2 313.445 4.403 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2nc(C(C)(C)C)no2)cc1 ZINC000607741497 1038720173 /nfs/dbraw/zinc/72/01/73/1038720173.db2.gz HWPSVXQAIFOXHX-INIZCTEOSA-N 1 2 313.445 4.403 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2nc(C(C)(C)C)no2)cc1 ZINC000607741498 1038721048 /nfs/dbraw/zinc/72/10/48/1038721048.db2.gz HWPSVXQAIFOXHX-MRXNPFEDSA-N 1 2 313.445 4.403 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2nc(C(C)(C)C)no2)cc1 ZINC000607741498 1038721057 /nfs/dbraw/zinc/72/10/57/1038721057.db2.gz HWPSVXQAIFOXHX-MRXNPFEDSA-N 1 2 313.445 4.403 20 0 DIADLO FC(F)(F)c1ccc(COc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000607723337 1038726320 /nfs/dbraw/zinc/72/63/20/1038726320.db2.gz MFJKSXQRSYCJRG-UHFFFAOYSA-N 1 2 318.298 4.470 20 0 DIADLO COCc1cnc(C[N@H+](C)[C@H](C)c2cc3ccccc3o2)s1 ZINC000342710307 1038732944 /nfs/dbraw/zinc/73/29/44/1038732944.db2.gz GSIJUFPWWAWGPD-GFCCVEGCSA-N 1 2 316.426 4.229 20 0 DIADLO COCc1cnc(C[N@@H+](C)[C@H](C)c2cc3ccccc3o2)s1 ZINC000342710307 1038732955 /nfs/dbraw/zinc/73/29/55/1038732955.db2.gz GSIJUFPWWAWGPD-GFCCVEGCSA-N 1 2 316.426 4.229 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1nc2ccccc2o1)c1cnn(CC2CCC2)c1 ZINC000934562481 1038735029 /nfs/dbraw/zinc/73/50/29/1038735029.db2.gz QKIHIWVMIGYMTH-KBPBESRZSA-N 1 2 324.428 4.236 20 0 DIADLO C/C(=C/C1CCC(C)CC1)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001125613838 1038750196 /nfs/dbraw/zinc/75/01/96/1038750196.db2.gz OAQWSJTXQQDFAR-UVTDQMKNSA-N 1 2 311.429 4.354 20 0 DIADLO Cc1ccc2oc(C[NH2+][C@H](c3nnc[nH]3)C3CCCCC3)cc2c1 ZINC000563444577 1038770997 /nfs/dbraw/zinc/77/09/97/1038770997.db2.gz PHSCRLBGKWUYFK-SFHVURJKSA-N 1 2 324.428 4.271 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000075532031 1038797917 /nfs/dbraw/zinc/79/79/17/1038797917.db2.gz AWVAPYNZPNPTCT-HOTGVXAUSA-N 1 2 305.466 4.112 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ncc(-c3ccc(C)cc3)o2)on1 ZINC000075640368 1038807216 /nfs/dbraw/zinc/80/72/16/1038807216.db2.gz UFOFBEQFTVFMSW-INIZCTEOSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ncc(-c3ccc(C)cc3)o2)on1 ZINC000075640368 1038807245 /nfs/dbraw/zinc/80/72/45/1038807245.db2.gz UFOFBEQFTVFMSW-INIZCTEOSA-N 1 2 323.396 4.284 20 0 DIADLO COCc1nc(C[N@H+](C)[C@@H](C)c2cc(C)ccc2C)cs1 ZINC000075674492 1038814547 /nfs/dbraw/zinc/81/45/47/1038814547.db2.gz FJQQGCAWDXLJSR-AWEZNQCLSA-N 1 2 304.459 4.099 20 0 DIADLO COCc1nc(C[N@@H+](C)[C@@H](C)c2cc(C)ccc2C)cs1 ZINC000075674492 1038814572 /nfs/dbraw/zinc/81/45/72/1038814572.db2.gz FJQQGCAWDXLJSR-AWEZNQCLSA-N 1 2 304.459 4.099 20 0 DIADLO COCc1nc(C[N@@H+]2CCCCC[C@H]2c2ccc(C)o2)cs1 ZINC000075765150 1038822047 /nfs/dbraw/zinc/82/20/47/1038822047.db2.gz UJTDPGJQUFFEPO-HNNXBMFYSA-N 1 2 320.458 4.308 20 0 DIADLO COCc1nc(C[N@H+]2CCCCC[C@H]2c2ccc(C)o2)cs1 ZINC000075765150 1038822067 /nfs/dbraw/zinc/82/20/67/1038822067.db2.gz UJTDPGJQUFFEPO-HNNXBMFYSA-N 1 2 320.458 4.308 20 0 DIADLO CC(C)=C[C@H]1[C@@H](C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)C1(C)C ZINC000029912778 1038843171 /nfs/dbraw/zinc/84/31/71/1038843171.db2.gz ZEKFOXKKNMHMIK-IRXDYDNUSA-N 1 2 309.413 4.049 20 0 DIADLO CC(C)Cc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000029917522 1038868140 /nfs/dbraw/zinc/86/81/40/1038868140.db2.gz BSSAWMUQQUEXSU-UHFFFAOYSA-N 1 2 319.408 4.323 20 0 DIADLO Cc1c[nH+]c(CN2CCCC[C@@H]2c2cccc(Cl)c2)n1C ZINC000342844947 1038909231 /nfs/dbraw/zinc/90/92/31/1038909231.db2.gz HUOCKZZOXRHQEG-MRXNPFEDSA-N 1 2 303.837 4.109 20 0 DIADLO CC(C)c1cnc(C[NH2+]Cc2cccc(OC3CC3)c2F)s1 ZINC000657621151 1038918041 /nfs/dbraw/zinc/91/80/41/1038918041.db2.gz HBJQZJRRAJVASQ-UHFFFAOYSA-N 1 2 320.433 4.237 20 0 DIADLO C[N@H+](Cc1nc2cccnc2s1)Cc1ccc(Cl)c(F)c1 ZINC000342868528 1038939583 /nfs/dbraw/zinc/93/95/83/1038939583.db2.gz OAXFMJAEQHUOLZ-UHFFFAOYSA-N 1 2 321.808 4.116 20 0 DIADLO C[N@@H+](Cc1nc2cccnc2s1)Cc1ccc(Cl)c(F)c1 ZINC000342868528 1038939598 /nfs/dbraw/zinc/93/95/98/1038939598.db2.gz OAXFMJAEQHUOLZ-UHFFFAOYSA-N 1 2 321.808 4.116 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(CSC(F)F)o2)sc1C ZINC000174434520 1038941679 /nfs/dbraw/zinc/94/16/79/1038941679.db2.gz KWFZUHUNVLMALS-UHFFFAOYSA-N 1 2 318.414 4.099 20 0 DIADLO CC(=O)Nc1ccc(NCc2cc(C)[nH+]c3c2CCCC3)cc1C ZINC000892308257 1038948990 /nfs/dbraw/zinc/94/89/90/1038948990.db2.gz IHWAKCYCRWCZQA-UHFFFAOYSA-N 1 2 323.440 4.148 20 0 DIADLO FC(F)(F)c1cccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)n1 ZINC001213085792 1038965849 /nfs/dbraw/zinc/96/58/49/1038965849.db2.gz XHOJNNQMKDNQGG-UHFFFAOYSA-N 1 2 304.275 4.234 20 0 DIADLO CCN(CCc1nccs1)c1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC000534147401 1038998431 /nfs/dbraw/zinc/99/84/31/1038998431.db2.gz TUDSQJJBQVKDKE-UHFFFAOYSA-N 1 2 318.490 4.249 20 0 DIADLO Clc1ncc(C[NH2+][C@H](c2ccccc2)c2ccccn2)s1 ZINC000078668720 1039003391 /nfs/dbraw/zinc/00/33/91/1039003391.db2.gz HCPZTCYABAOKPH-OAHLLOKOSA-N 1 2 315.829 4.071 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Oc2ccccc2)nc1)c1cscn1 ZINC000534329237 1039027315 /nfs/dbraw/zinc/02/73/15/1039027315.db2.gz YFOCPOKNYXOUTN-CYBMUJFWSA-N 1 2 311.410 4.181 20 0 DIADLO COCc1cnc(C[N@@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)s1 ZINC000342930995 1039027970 /nfs/dbraw/zinc/02/79/70/1039027970.db2.gz JCOIEFADOJFWSM-LRDDRELGSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1cnc(C[N@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)s1 ZINC000342930995 1039027986 /nfs/dbraw/zinc/02/79/86/1039027986.db2.gz JCOIEFADOJFWSM-LRDDRELGSA-N 1 2 320.433 4.012 20 0 DIADLO CC[C@@H](NC(=O)Nc1cc(C)[nH+]cc1C)c1ccc(Cl)cc1 ZINC000534325848 1039028234 /nfs/dbraw/zinc/02/82/34/1039028234.db2.gz XPMXMHTXEJNUDX-OAHLLOKOSA-N 1 2 317.820 4.047 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000728539906 1039105182 /nfs/dbraw/zinc/10/51/82/1039105182.db2.gz ZRGIQQIPZIQCPN-IAGOWNOFSA-N 1 2 305.466 4.043 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](Cc1ccon1)C1CC1 ZINC000122877831 1039123766 /nfs/dbraw/zinc/12/37/66/1039123766.db2.gz FTZJXLNJXNEXIC-NSHDSACASA-N 1 2 310.319 4.419 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](Cc1ccon1)C1CC1 ZINC000122877831 1039123772 /nfs/dbraw/zinc/12/37/72/1039123772.db2.gz FTZJXLNJXNEXIC-NSHDSACASA-N 1 2 310.319 4.419 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)cs1 ZINC000343105953 1039201256 /nfs/dbraw/zinc/20/12/56/1039201256.db2.gz XEGUWTUYCNITKS-MEBBXXQBSA-N 1 2 322.861 4.281 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)cs1 ZINC000343105950 1039201944 /nfs/dbraw/zinc/20/19/44/1039201944.db2.gz XEGUWTUYCNITKS-BONVTDFDSA-N 1 2 322.861 4.281 20 0 DIADLO c1coc(-c2nc(C[N@@H+]3CCC[C@@H]3c3ccncc3)cs2)c1 ZINC000125432192 1039251198 /nfs/dbraw/zinc/25/11/98/1039251198.db2.gz UZARIPCROFYHJS-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO c1coc(-c2nc(C[N@H+]3CCC[C@@H]3c3ccncc3)cs2)c1 ZINC000125432192 1039251207 /nfs/dbraw/zinc/25/12/07/1039251207.db2.gz UZARIPCROFYHJS-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO CC(C)Oc1ccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000125803564 1039271445 /nfs/dbraw/zinc/27/14/45/1039271445.db2.gz MNKREADLJLXSPX-LJQANCHMSA-N 1 2 321.424 4.076 20 0 DIADLO Cc1ccccc1[C@@H]([NH2+]Cc1nc(C2CCCC2)no1)C1CC1 ZINC000539491713 1039271640 /nfs/dbraw/zinc/27/16/40/1039271640.db2.gz AUQYGHWPJRIUOA-SFHVURJKSA-N 1 2 311.429 4.277 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2sccc2Br)s1 ZINC000125990183 1039276817 /nfs/dbraw/zinc/27/68/17/1039276817.db2.gz FFYJSVODHCFJIV-MRVPVSSYSA-N 1 2 317.277 4.126 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(-c2cccs2)no1)c1ccsc1 ZINC000669828931 1039284638 /nfs/dbraw/zinc/28/46/38/1039284638.db2.gz UYIXAFSIXGIMKU-ZJUUUORDSA-N 1 2 305.428 4.271 20 0 DIADLO CCc1nc(C)c([C@H](C)Nc2ccc(N(CC)CC)[nH+]c2)s1 ZINC000539658897 1039312949 /nfs/dbraw/zinc/31/29/49/1039312949.db2.gz JSDAQIVLILCFKH-LBPRGKRZSA-N 1 2 318.490 4.428 20 0 DIADLO CCCCn1c(C)c(C)nc1SCc1cc(OC)cc(C)[nH+]1 ZINC000536011315 1039313322 /nfs/dbraw/zinc/31/33/22/1039313322.db2.gz RVIHMHUAQAGUTH-UHFFFAOYSA-N 1 2 319.474 4.304 20 0 DIADLO CC[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cccc(OC)c1 ZINC000539658019 1039313561 /nfs/dbraw/zinc/31/35/61/1039313561.db2.gz KBKJDXUWKDEYSL-GOSISDBHSA-N 1 2 311.429 4.254 20 0 DIADLO Clc1cnc(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)c(Cl)c1 ZINC000539720161 1039324230 /nfs/dbraw/zinc/32/42/30/1039324230.db2.gz CDVIZKMBJAJWQV-UONOGXRCSA-N 1 2 317.285 4.248 20 0 DIADLO Clc1cnc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c(Cl)c1 ZINC000539720161 1039324250 /nfs/dbraw/zinc/32/42/50/1039324250.db2.gz CDVIZKMBJAJWQV-UONOGXRCSA-N 1 2 317.285 4.248 20 0 DIADLO Clc1cnc(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)c(Cl)c1 ZINC000539720162 1039325184 /nfs/dbraw/zinc/32/51/84/1039325184.db2.gz CDVIZKMBJAJWQV-ZIAGYGMSSA-N 1 2 317.285 4.248 20 0 DIADLO Clc1cnc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c(Cl)c1 ZINC000539720162 1039325200 /nfs/dbraw/zinc/32/52/00/1039325200.db2.gz CDVIZKMBJAJWQV-ZIAGYGMSSA-N 1 2 317.285 4.248 20 0 DIADLO Clc1cnc(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)c(Cl)c1 ZINC000539720160 1039326127 /nfs/dbraw/zinc/32/61/27/1039326127.db2.gz CDVIZKMBJAJWQV-KGLIPLIRSA-N 1 2 317.285 4.248 20 0 DIADLO Clc1cnc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)c(Cl)c1 ZINC000539720160 1039326146 /nfs/dbraw/zinc/32/61/46/1039326146.db2.gz CDVIZKMBJAJWQV-KGLIPLIRSA-N 1 2 317.285 4.248 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)[C@H](C)[N@H+](C)Cc1ccsc1 ZINC000127229366 1039332125 /nfs/dbraw/zinc/33/21/25/1039332125.db2.gz MFUOWUAPWUHJQN-LBPRGKRZSA-N 1 2 322.861 4.169 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccsc1 ZINC000127229366 1039332141 /nfs/dbraw/zinc/33/21/41/1039332141.db2.gz MFUOWUAPWUHJQN-LBPRGKRZSA-N 1 2 322.861 4.169 20 0 DIADLO COc1cc(C)[nH+]c(CN2CCCC[C@H]2c2ccc(F)cc2)c1 ZINC000536037943 1039338888 /nfs/dbraw/zinc/33/88/88/1039338888.db2.gz CFDMPHRYEGMEDA-IBGZPJMESA-N 1 2 314.404 4.265 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc3ccc(Cl)cn23)[C@H]1c1ccccc1 ZINC000539825342 1039344174 /nfs/dbraw/zinc/34/41/74/1039344174.db2.gz RYAYLQFFVLAVAC-SCLBCKFNSA-N 1 2 311.816 4.181 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnc3ccc(Cl)cn23)[C@H]1c1ccccc1 ZINC000539825342 1039344185 /nfs/dbraw/zinc/34/41/85/1039344185.db2.gz RYAYLQFFVLAVAC-SCLBCKFNSA-N 1 2 311.816 4.181 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc3ccc(Cl)cn23)[C@@H]1c1ccccc1 ZINC000539825343 1039345395 /nfs/dbraw/zinc/34/53/95/1039345395.db2.gz RYAYLQFFVLAVAC-UGSOOPFHSA-N 1 2 311.816 4.181 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnc3ccc(Cl)cn23)[C@@H]1c1ccccc1 ZINC000539825343 1039345402 /nfs/dbraw/zinc/34/54/02/1039345402.db2.gz RYAYLQFFVLAVAC-UGSOOPFHSA-N 1 2 311.816 4.181 20 0 DIADLO c1[nH+]c(-c2ccc(NC[C@@H]3CCSC3)cc2)n2c1CCCC2 ZINC000278287785 1039353687 /nfs/dbraw/zinc/35/36/87/1039353687.db2.gz AYJZYFKAIISPQN-AWEZNQCLSA-N 1 2 313.470 4.051 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1nc2cc(F)ccc2o1 ZINC000151022588 1039355313 /nfs/dbraw/zinc/35/53/13/1039355313.db2.gz QVLAZJUERWBKMJ-UHFFFAOYSA-N 1 2 314.360 4.000 20 0 DIADLO Clc1ccc(N(CCCn2cc[nH+]c2)Cc2ccco2)cc1 ZINC000343302347 1039385601 /nfs/dbraw/zinc/38/56/01/1039385601.db2.gz JENVOKYAULQFOH-UHFFFAOYSA-N 1 2 315.804 4.226 20 0 DIADLO Cc1cnc([C@H](C)[NH+]2CCC(=Cc3ccccc3F)CC2)o1 ZINC000540052581 1039408478 /nfs/dbraw/zinc/40/84/78/1039408478.db2.gz ABZAORBVDOHJAF-AWEZNQCLSA-N 1 2 300.377 4.363 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+](Cc2cccnc2)C(C)C)o1 ZINC000540098952 1039416657 /nfs/dbraw/zinc/41/66/57/1039416657.db2.gz NAYJIBOIEQICHA-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+](Cc2cccnc2)C(C)C)o1 ZINC000540098952 1039416666 /nfs/dbraw/zinc/41/66/66/1039416666.db2.gz NAYJIBOIEQICHA-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1cc(F)ccc1F ZINC000540165136 1039441005 /nfs/dbraw/zinc/44/10/05/1039441005.db2.gz WXJCKFVTGFMAMM-RFAUZJTJSA-N 1 2 309.743 4.403 20 0 DIADLO Cc1ccnc(C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)n1 ZINC000540354863 1039479183 /nfs/dbraw/zinc/47/91/83/1039479183.db2.gz UCNOATTZMOPYAM-INIZCTEOSA-N 1 2 319.408 4.428 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1csc(C(F)(F)F)c1 ZINC000926534327 1039485322 /nfs/dbraw/zinc/48/53/22/1039485322.db2.gz YHQALLHVNUPNMY-VHSXEESVSA-N 1 2 317.380 4.395 20 0 DIADLO CC[C@H](C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1)c1ccc(OC)cc1 ZINC000540490379 1039504538 /nfs/dbraw/zinc/50/45/38/1039504538.db2.gz CLVZJTZEUVDIPV-INIZCTEOSA-N 1 2 323.396 4.012 20 0 DIADLO COc1ccc2oc(C[N@@H+]3CCOC[C@H]3c3ccccc3)cc2c1 ZINC000583950599 1039518875 /nfs/dbraw/zinc/51/88/75/1039518875.db2.gz KSFISWDNMZWTAI-IBGZPJMESA-N 1 2 323.392 4.015 20 0 DIADLO COc1ccc2oc(C[N@H+]3CCOC[C@H]3c3ccccc3)cc2c1 ZINC000583950599 1039518886 /nfs/dbraw/zinc/51/88/86/1039518886.db2.gz KSFISWDNMZWTAI-IBGZPJMESA-N 1 2 323.392 4.015 20 0 DIADLO Cn1cc(Cl)c(C[NH2+]C(C)(C)c2ccc3ccccc3c2)n1 ZINC000626115829 1039566434 /nfs/dbraw/zinc/56/64/34/1039566434.db2.gz GQXFWZWMVSDFBN-UHFFFAOYSA-N 1 2 313.832 4.252 20 0 DIADLO Cc1cc(OCC(=O)Nc2ccc(F)cc2)c2cccc(C)c2[nH+]1 ZINC000540845344 1039581216 /nfs/dbraw/zinc/58/12/16/1039581216.db2.gz HSMABOIZJCPOQN-UHFFFAOYSA-N 1 2 324.355 4.008 20 0 DIADLO Cc1c[nH]c(C[NH+]2CCC(Sc3ccc(Cl)cc3)CC2)n1 ZINC000628186649 1039675457 /nfs/dbraw/zinc/67/54/57/1039675457.db2.gz ROTGSYLDYQTVEX-UHFFFAOYSA-N 1 2 321.877 4.128 20 0 DIADLO CCc1cnc(C[N@H+](C)C2c3ccccc3-c3ccccc32)o1 ZINC000081596853 1039720188 /nfs/dbraw/zinc/72/01/88/1039720188.db2.gz TWNZGAXLPCIVRL-UHFFFAOYSA-N 1 2 304.393 4.439 20 0 DIADLO CCc1cnc(C[N@@H+](C)C2c3ccccc3-c3ccccc32)o1 ZINC000081596853 1039720203 /nfs/dbraw/zinc/72/02/03/1039720203.db2.gz TWNZGAXLPCIVRL-UHFFFAOYSA-N 1 2 304.393 4.439 20 0 DIADLO Clc1ccccc1C[NH2+][C@H](c1ccccc1)c1cncnc1 ZINC000541746280 1039736119 /nfs/dbraw/zinc/73/61/19/1039736119.db2.gz HZQHCWQPMICOPY-GOSISDBHSA-N 1 2 309.800 4.009 20 0 DIADLO COC[C@H]([NH2+]Cc1cnc(C2CCCCC2)s1)c1ccco1 ZINC000084050137 1039740884 /nfs/dbraw/zinc/74/08/84/1039740884.db2.gz GKADRHFFCVBBNG-HNNXBMFYSA-N 1 2 320.458 4.261 20 0 DIADLO Cc1ccc(Oc2ccccc2)c(NC(=O)CCn2cc[nH+]c2)c1 ZINC000084786122 1039751470 /nfs/dbraw/zinc/75/14/70/1039751470.db2.gz CXJCSQADVUPMFP-UHFFFAOYSA-N 1 2 321.380 4.013 20 0 DIADLO COC[C@H](Nc1cc(C(C)C)[nH+]c(C(C)C)n1)c1ccco1 ZINC000090107477 1039801183 /nfs/dbraw/zinc/80/11/83/1039801183.db2.gz GRBSRQNCXKIQSI-AWEZNQCLSA-N 1 2 303.406 4.116 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccccc2OC(F)F)c(C)s1 ZINC000090888617 1039805198 /nfs/dbraw/zinc/80/51/98/1039805198.db2.gz NWZJQQSGDLPEFG-VIFPVBQESA-N 1 2 312.385 4.212 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2ncccc2F)c2ccccc2)cc1 ZINC000090722092 1039814237 /nfs/dbraw/zinc/81/42/37/1039814237.db2.gz SJEARZXXZOMEDS-LJQANCHMSA-N 1 2 310.347 4.239 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](C)Cc2cccc(C)c2C)cs1 ZINC000091868354 1039862544 /nfs/dbraw/zinc/86/25/44/1039862544.db2.gz UNVCCGTUTQEJJY-AWEZNQCLSA-N 1 2 304.459 4.099 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](C)Cc2cccc(C)c2C)cs1 ZINC000091868354 1039862570 /nfs/dbraw/zinc/86/25/70/1039862570.db2.gz UNVCCGTUTQEJJY-AWEZNQCLSA-N 1 2 304.459 4.099 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nc(-c2ccc(C)cc2)no1 ZINC000092224115 1039863034 /nfs/dbraw/zinc/86/30/34/1039863034.db2.gz NBQVQSDPRBRLTQ-QGZVFWFLSA-N 1 2 322.412 4.023 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nc(-c2ccc(C)cc2)no1 ZINC000092224115 1039863058 /nfs/dbraw/zinc/86/30/58/1039863058.db2.gz NBQVQSDPRBRLTQ-QGZVFWFLSA-N 1 2 322.412 4.023 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3cccc(-c4ncco4)c3C)n2c1 ZINC000491596127 1039863501 /nfs/dbraw/zinc/86/35/01/1039863501.db2.gz HNLAYXBJRCTVQI-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(-c2cccc(F)c2)o1)c1ccsc1 ZINC000669937367 1039867961 /nfs/dbraw/zinc/86/79/61/1039867961.db2.gz CZELHVYKRJYMJS-NSHDSACASA-N 1 2 302.374 4.393 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccc(Cl)cc2)no1)c1ccsc1 ZINC000669938961 1039878250 /nfs/dbraw/zinc/87/82/50/1039878250.db2.gz GKODCHNFTAWBOM-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO Cc1nc(-c2cc3c(s2)CCN(c2cccc[nH+]2)C3)cs1 ZINC000092945023 1039892619 /nfs/dbraw/zinc/89/26/19/1039892619.db2.gz UIGYIFWNMRLIEH-UHFFFAOYSA-N 1 2 313.451 4.138 20 0 DIADLO Cc1cccnc1C[NH2+][C@@H](c1cccc(Cl)c1)c1ccccn1 ZINC000093200181 1039895189 /nfs/dbraw/zinc/89/51/89/1039895189.db2.gz JGMJCYWRVRMCIR-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO Fc1cccc(Br)c1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000093191646 1039896865 /nfs/dbraw/zinc/89/68/65/1039896865.db2.gz SRDZMBMXTJDJAF-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1cccc(Br)c1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000093191646 1039896882 /nfs/dbraw/zinc/89/68/82/1039896882.db2.gz SRDZMBMXTJDJAF-OAHLLOKOSA-N 1 2 323.209 4.253 20 0 DIADLO Cc1cc(C[NH2+]C(C)(C)c2cc(C(F)(F)F)on2)ccc1F ZINC000492020286 1039906473 /nfs/dbraw/zinc/90/64/73/1039906473.db2.gz CFYKSGVHAVWZDR-UHFFFAOYSA-N 1 2 316.298 4.166 20 0 DIADLO C[N@H+](Cc1nc(-c2cccs2)no1)Cc1cccc(Cl)c1 ZINC000137212650 1039914810 /nfs/dbraw/zinc/91/48/10/1039914810.db2.gz ZTWYFDCUXWXROQ-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO C[N@@H+](Cc1nc(-c2cccs2)no1)Cc1cccc(Cl)c1 ZINC000137212650 1039914825 /nfs/dbraw/zinc/91/48/25/1039914825.db2.gz ZTWYFDCUXWXROQ-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO Cc1ccc(C[NH2+]C(C)(C)c2cc(C(F)(F)F)on2)cc1F ZINC000492102532 1039917302 /nfs/dbraw/zinc/91/73/02/1039917302.db2.gz FQNTVDPDDXEDHU-UHFFFAOYSA-N 1 2 316.298 4.166 20 0 DIADLO FC(F)(F)c1ccc(-c2n[nH]cc2CNc2cccc[nH+]2)cc1 ZINC000140381787 1039933732 /nfs/dbraw/zinc/93/37/32/1039933732.db2.gz JDNDFTWRNUYRAP-UHFFFAOYSA-N 1 2 318.302 4.103 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2cc3cnccc3o2)cs1 ZINC000657879902 1039987603 /nfs/dbraw/zinc/98/76/03/1039987603.db2.gz VATASLFFFXVRBM-WDEREUQCSA-N 1 2 301.415 4.259 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(C(F)F)nc2)cs1 ZINC000657877872 1039988127 /nfs/dbraw/zinc/98/81/27/1039988127.db2.gz KUGGHOHJTVGBLT-VHSXEESVSA-N 1 2 311.401 4.450 20 0 DIADLO C[N@H+](Cc1ncc(-c2cccc(F)c2)o1)Cc1cccc(F)c1 ZINC000175059716 1040003881 /nfs/dbraw/zinc/00/38/81/1040003881.db2.gz MCPHXKLOWKKYTO-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1ncc(-c2cccc(F)c2)o1)Cc1cccc(F)c1 ZINC000175059716 1040003900 /nfs/dbraw/zinc/00/39/00/1040003900.db2.gz MCPHXKLOWKKYTO-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000171684853 1040032998 /nfs/dbraw/zinc/03/29/98/1040032998.db2.gz KCSJNFVGZUWJHA-JKSUJKDBSA-N 1 2 314.816 4.402 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1cscc1Br ZINC000685412465 1040034141 /nfs/dbraw/zinc/03/41/41/1040034141.db2.gz YDLURPYXKNOISQ-UHFFFAOYSA-N 1 2 316.186 4.285 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1cscc1Br ZINC000685412465 1040034155 /nfs/dbraw/zinc/03/41/55/1040034155.db2.gz YDLURPYXKNOISQ-UHFFFAOYSA-N 1 2 316.186 4.285 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1cscc1Br ZINC000685408344 1040035530 /nfs/dbraw/zinc/03/55/30/1040035530.db2.gz UTQCKAQWAUJEET-UHFFFAOYSA-N 1 2 302.262 4.204 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1cscc1Br ZINC000685408344 1040035538 /nfs/dbraw/zinc/03/55/38/1040035538.db2.gz UTQCKAQWAUJEET-UHFFFAOYSA-N 1 2 302.262 4.204 20 0 DIADLO Cc1cccc(CC[C@H](C)Nc2ccc(Cn3cc[nH+]c3)cn2)c1 ZINC000685447620 1040056698 /nfs/dbraw/zinc/05/66/98/1040056698.db2.gz ULCBPWQBODRPNH-KRWDZBQOSA-N 1 2 320.440 4.068 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H](C)c2csnn2)cc2ccccc21 ZINC000926590022 1040060438 /nfs/dbraw/zinc/06/04/38/1040060438.db2.gz JCBCZPFEYHSKIY-RYUDHWBXSA-N 1 2 313.426 4.112 20 0 DIADLO CC[C@H]([NH2+]Cc1ncoc1-c1ccccc1)c1ccc(F)cn1 ZINC000493034080 1040066397 /nfs/dbraw/zinc/06/63/97/1040066397.db2.gz IRBLLIOKNKANKS-HNNXBMFYSA-N 1 2 311.360 4.117 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2cc3cnccc3o2)o1 ZINC000657892311 1040084817 /nfs/dbraw/zinc/08/48/17/1040084817.db2.gz XPBSKMPNRGYCDI-WFASDCNBSA-N 1 2 314.385 4.022 20 0 DIADLO Fc1cc(C[NH+]2CCC(Oc3ccccc3)CC2)cc(F)c1F ZINC000350972456 1040100589 /nfs/dbraw/zinc/10/05/89/1040100589.db2.gz RWJAWDWSIKZODN-UHFFFAOYSA-N 1 2 321.342 4.147 20 0 DIADLO O=C(C[C@@H]1CCC[N@H+]1Cc1cccnc1Cl)c1cccs1 ZINC000176909894 1040101011 /nfs/dbraw/zinc/10/10/11/1040101011.db2.gz RZOVPPFAIRRSBH-ZDUSSCGKSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@@H]1CCC[N@@H+]1Cc1cccnc1Cl)c1cccs1 ZINC000176909894 1040101015 /nfs/dbraw/zinc/10/10/15/1040101015.db2.gz RZOVPPFAIRRSBH-ZDUSSCGKSA-N 1 2 320.845 4.034 20 0 DIADLO Cn1c[nH+]cc1CN1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000177014514 1040103268 /nfs/dbraw/zinc/10/32/68/1040103268.db2.gz GAWMIEYKKUXZML-HNNXBMFYSA-N 1 2 310.228 4.064 20 0 DIADLO Fc1cccc(C[NH2+]C2(c3nccs3)CCCC2)c1Cl ZINC000093194145 1040103700 /nfs/dbraw/zinc/10/37/00/1040103700.db2.gz QXOXEOVUUMKXFV-UHFFFAOYSA-N 1 2 310.825 4.495 20 0 DIADLO Cc1nc(NCCc2ccc(OCc3ccccc3)cc2)cc[nH+]1 ZINC000310103337 1040109849 /nfs/dbraw/zinc/10/98/49/1040109849.db2.gz OHUJWVJGIHYZCC-UHFFFAOYSA-N 1 2 319.408 4.019 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nc(C)c3ccccc3n2)cc1F ZINC000178460243 1040144118 /nfs/dbraw/zinc/14/41/18/1040144118.db2.gz DDEMJHARBMVUOX-CYBMUJFWSA-N 1 2 309.388 4.237 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000685612518 1040154560 /nfs/dbraw/zinc/15/45/60/1040154560.db2.gz ITFRVAHGIUCWJT-GOSISDBHSA-N 1 2 311.816 4.251 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000685612518 1040154567 /nfs/dbraw/zinc/15/45/67/1040154567.db2.gz ITFRVAHGIUCWJT-GOSISDBHSA-N 1 2 311.816 4.251 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000685625268 1040165495 /nfs/dbraw/zinc/16/54/95/1040165495.db2.gz JDAXJXUQRWHMGQ-HNNXBMFYSA-N 1 2 310.228 4.266 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000685625268 1040165513 /nfs/dbraw/zinc/16/55/13/1040165513.db2.gz JDAXJXUQRWHMGQ-HNNXBMFYSA-N 1 2 310.228 4.266 20 0 DIADLO FC1(c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)CCCCC1 ZINC000685682492 1040231349 /nfs/dbraw/zinc/23/13/49/1040231349.db2.gz HNOUNTVFTIIVER-UHFFFAOYSA-N 1 2 312.348 4.051 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(C(F)F)nc2)[nH]1 ZINC000657991349 1040254070 /nfs/dbraw/zinc/25/40/70/1040254070.db2.gz VERKYCWGIQVWPR-GARJFASQSA-N 1 2 323.391 4.063 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(C(F)F)nc1)c1c(F)cncc1F ZINC000658014276 1040259933 /nfs/dbraw/zinc/25/99/33/1040259933.db2.gz XFWBJQPGPGRGBJ-DTWKUNHWSA-N 1 2 313.298 4.104 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(C(F)F)nc1 ZINC000658014275 1040261705 /nfs/dbraw/zinc/26/17/05/1040261705.db2.gz XFWBJQPGPGRGBJ-BDAKNGLRSA-N 1 2 313.298 4.104 20 0 DIADLO Nc1ccc(Cl)cc1C[N@@H+]1CCc2c(Cl)cccc2C1 ZINC001140717804 1040303720 /nfs/dbraw/zinc/30/37/20/1040303720.db2.gz ONZSMPBQDGRRPA-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1ccc(Cl)cc1C[N@H+]1CCc2c(Cl)cccc2C1 ZINC001140717804 1040303726 /nfs/dbraw/zinc/30/37/26/1040303726.db2.gz ONZSMPBQDGRRPA-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+][C@H]1C[C@H](C)n2ncnc21 ZINC000658104126 1040315167 /nfs/dbraw/zinc/31/51/67/1040315167.db2.gz ZUSHNLYVMZDULF-XEZPLFJOSA-N 1 2 324.428 4.252 20 0 DIADLO COc1ccnc(C[NH2+][C@@H](CCC(C)C)c2ccoc2)c1F ZINC000658223637 1040365657 /nfs/dbraw/zinc/36/56/57/1040365657.db2.gz KZXQTRFEPPQSNY-AWEZNQCLSA-N 1 2 306.381 4.089 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2CCc3ccc(O)cc32)cs1 ZINC000658237493 1040382164 /nfs/dbraw/zinc/38/21/64/1040382164.db2.gz MQDFXIRLMXYQSC-NHYWBVRUSA-N 1 2 302.443 4.310 20 0 DIADLO C[C@@H]([NH2+]CC(F)(F)C(C)(C)C)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000658336348 1040427756 /nfs/dbraw/zinc/42/77/56/1040427756.db2.gz BWAAXXZRBPEHKS-LLVKDONJSA-N 1 2 324.415 4.248 20 0 DIADLO O=C(c1ccc(C2CCCC2)cc1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000685707984 1040453320 /nfs/dbraw/zinc/45/33/20/1040453320.db2.gz ZECSMXPMEXJKLJ-IBGZPJMESA-N 1 2 323.440 4.018 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](C)Cc2cccnc2Cl)c1 ZINC000179428821 1040461288 /nfs/dbraw/zinc/46/12/88/1040461288.db2.gz ULVICSWUNIFXCT-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2cccnc2Cl)c1 ZINC000179428821 1040461298 /nfs/dbraw/zinc/46/12/98/1040461298.db2.gz ULVICSWUNIFXCT-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1cn2c(n1)CCCC2 ZINC000924535309 1040536609 /nfs/dbraw/zinc/53/66/09/1040536609.db2.gz LSARCVUDVWOPKP-NSHDSACASA-N 1 2 324.255 4.377 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[NH+]1CCC(c2ccccc2F)CC1 ZINC000605577131 1040555608 /nfs/dbraw/zinc/55/56/08/1040555608.db2.gz MKFVQZNAKLKKNM-GFCCVEGCSA-N 1 2 315.392 4.027 20 0 DIADLO CCSc1ccccc1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000612504293 1040616477 /nfs/dbraw/zinc/61/64/77/1040616477.db2.gz UNILQPRCHDAUQD-UHFFFAOYSA-N 1 2 323.421 4.237 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCC1(F)F)c1cc(Br)cs1 ZINC000309506253 1040709291 /nfs/dbraw/zinc/70/92/91/1040709291.db2.gz BZRGLFOZZWAIER-OIBJUYFYSA-N 1 2 310.207 4.349 20 0 DIADLO Cc1nc(N2CCC(Sc3ccc(Cl)cc3)CC2)cc[nH+]1 ZINC000161552348 1040713210 /nfs/dbraw/zinc/71/32/10/1040713210.db2.gz PJHAKSRWTPDYNQ-UHFFFAOYSA-N 1 2 319.861 4.200 20 0 DIADLO FC(F)(F)c1cscc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000685833892 1040767431 /nfs/dbraw/zinc/76/74/31/1040767431.db2.gz VVVYWIODDJPLEC-CQSZACIVSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cscc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000685833892 1040767449 /nfs/dbraw/zinc/76/74/49/1040767449.db2.gz VVVYWIODDJPLEC-CQSZACIVSA-N 1 2 312.360 4.499 20 0 DIADLO c1cc2ccc(CNc3ccc(N4CCCCC4)[nH+]c3)cc2[nH]1 ZINC000322918655 1040791276 /nfs/dbraw/zinc/79/12/76/1040791276.db2.gz KNGGQZZFIZBDLX-UHFFFAOYSA-N 1 2 306.413 4.165 20 0 DIADLO CC(C)n1ccc(C[NH2+]C(c2ccccc2)c2ccccc2)n1 ZINC000172332657 1040861487 /nfs/dbraw/zinc/86/14/87/1040861487.db2.gz CERYFXZODHXDIP-UHFFFAOYSA-N 1 2 305.425 4.343 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C)c1ccn(C)n1 ZINC000414115256 1040883544 /nfs/dbraw/zinc/88/35/44/1040883544.db2.gz PIIVDGGBUITVFX-MEDUHNTESA-N 1 2 307.388 4.136 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+][C@H](C)c1nc2c(s1)CCC2 ZINC000414137251 1040913565 /nfs/dbraw/zinc/91/35/65/1040913565.db2.gz DXBYYZJASZEJHS-VXGBXAGGSA-N 1 2 301.459 4.001 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cncc(F)c1)c1ncc(-c2ccccc2)n1C ZINC000414139890 1040916452 /nfs/dbraw/zinc/91/64/52/1040916452.db2.gz IJXWATVDOJQEKM-UONOGXRCSA-N 1 2 324.403 4.033 20 0 DIADLO Cc1cc(C[N@@H+]2Cc3ccccc3C[C@H]2c2ccccc2)no1 ZINC000174040531 1040942027 /nfs/dbraw/zinc/94/20/27/1040942027.db2.gz YGRHIWAKOPYARS-FQEVSTJZSA-N 1 2 304.393 4.283 20 0 DIADLO Cc1cc(C[N@H+]2Cc3ccccc3C[C@H]2c2ccccc2)no1 ZINC000174040531 1040942040 /nfs/dbraw/zinc/94/20/40/1040942040.db2.gz YGRHIWAKOPYARS-FQEVSTJZSA-N 1 2 304.393 4.283 20 0 DIADLO FC(F)(F)[C@@H]1CC(Nc2cccc[nH+]2)C[C@@H](C(F)(F)F)C1 ZINC000613438194 1040956649 /nfs/dbraw/zinc/95/66/49/1040956649.db2.gz VINVTRBKYDMNEO-IUCAKERBSA-N 1 2 312.257 4.403 20 0 DIADLO COc1ccc(C)cc1C[N@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000613465576 1040970556 /nfs/dbraw/zinc/97/05/56/1040970556.db2.gz RAEIBQPMIMOEPN-ZDUSSCGKSA-N 1 2 305.368 4.475 20 0 DIADLO COc1ccc(C)cc1C[N@@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000613465576 1040970580 /nfs/dbraw/zinc/97/05/80/1040970580.db2.gz RAEIBQPMIMOEPN-ZDUSSCGKSA-N 1 2 305.368 4.475 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1nc(C)cs1 ZINC000755940063 1041004503 /nfs/dbraw/zinc/00/45/03/1041004503.db2.gz MATVNLFKSMAJQT-UHFFFAOYSA-N 1 2 300.431 4.062 20 0 DIADLO CCCCCC(C)(C)C[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000808702070 1041012614 /nfs/dbraw/zinc/01/26/14/1041012614.db2.gz RHHZITJYERSLNA-INIZCTEOSA-N 1 2 300.450 4.090 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)o1 ZINC000171137049 1041026183 /nfs/dbraw/zinc/02/61/83/1041026183.db2.gz AUJLEEPLKDYQCY-OAHLLOKOSA-N 1 2 305.809 4.087 20 0 DIADLO CCCc1ccc([C@H](C)[NH2+]Cc2nccc(C(F)(F)F)n2)cc1 ZINC000414230647 1041029368 /nfs/dbraw/zinc/02/93/68/1041029368.db2.gz BFHWJKGKJNPQRK-LBPRGKRZSA-N 1 2 323.362 4.299 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2SCCc3sccc32)c(C)[nH+]1 ZINC000175102152 1041031381 /nfs/dbraw/zinc/03/13/81/1041031381.db2.gz PTRWGBXOAJUABR-OAHLLOKOSA-N 1 2 318.467 4.037 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2SCCc3sccc32)c(C)[nH+]1 ZINC000175102137 1041032344 /nfs/dbraw/zinc/03/23/44/1041032344.db2.gz PTRWGBXOAJUABR-HNNXBMFYSA-N 1 2 318.467 4.037 20 0 DIADLO CCCc1cc(C(=O)Nc2ccc3[nH+]ccn3c2)ccc1Cl ZINC001131516211 1041054627 /nfs/dbraw/zinc/05/46/27/1041054627.db2.gz LSKNAESQGLUBSB-UHFFFAOYSA-N 1 2 313.788 4.193 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]Cc1nccc(C(F)(F)F)n1 ZINC000414258665 1041057022 /nfs/dbraw/zinc/05/70/22/1041057022.db2.gz PMOVXFVUIGTIJD-YPMHNXCESA-N 1 2 321.346 4.142 20 0 DIADLO CCC[C@]1(C)CCC[N@H+](Cc2noc(Cc3ccccc3)n2)C1 ZINC000464845713 1041088600 /nfs/dbraw/zinc/08/86/00/1041088600.db2.gz OUZVPDCYFVHSQB-LJQANCHMSA-N 1 2 313.445 4.063 20 0 DIADLO CCC[C@]1(C)CCC[N@@H+](Cc2noc(Cc3ccccc3)n2)C1 ZINC000464845713 1041088622 /nfs/dbraw/zinc/08/86/22/1041088622.db2.gz OUZVPDCYFVHSQB-LJQANCHMSA-N 1 2 313.445 4.063 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2csnn2)cc1 ZINC000414310914 1041108709 /nfs/dbraw/zinc/10/87/09/1041108709.db2.gz XKWOERRVAJZCPI-OLZOCXBDSA-N 1 2 305.447 4.129 20 0 DIADLO Cc1ccc(C)c(C[N@@H+]2CCCC[C@H]2c2noc(C3CC3)n2)c1 ZINC000613532020 1041119793 /nfs/dbraw/zinc/11/97/93/1041119793.db2.gz GORBTDFWCGYMTF-KRWDZBQOSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1ccc(C)c(C[N@H+]2CCCC[C@H]2c2noc(C3CC3)n2)c1 ZINC000613532020 1041119804 /nfs/dbraw/zinc/11/98/04/1041119804.db2.gz GORBTDFWCGYMTF-KRWDZBQOSA-N 1 2 311.429 4.291 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@](C)(F)C2)c(C(F)(F)F)c1 ZINC001143472680 1041161741 /nfs/dbraw/zinc/16/17/41/1041161741.db2.gz DMYJODNCQIAICE-CQSZACIVSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@](C)(F)C2)c(C(F)(F)F)c1 ZINC001143472680 1041161751 /nfs/dbraw/zinc/16/17/51/1041161751.db2.gz DMYJODNCQIAICE-CQSZACIVSA-N 1 2 305.315 4.038 20 0 DIADLO c1ccn(-c2ccc[nH+]c2NCc2nccc3ccccc32)c1 ZINC001167701310 1041186354 /nfs/dbraw/zinc/18/63/54/1041186354.db2.gz QJWTWBXHYNHKMU-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO CC(C)Oc1ccccc1C[NH2+]Cc1nc2cc(F)ccc2o1 ZINC000623015089 1041187310 /nfs/dbraw/zinc/18/73/10/1041187310.db2.gz BTWTWVURPGOUFX-UHFFFAOYSA-N 1 2 314.360 4.044 20 0 DIADLO Cc1ccc(-c2cc(C[N@@H+]3CCOc4ccccc4C3)on2)cc1 ZINC000613564864 1041318272 /nfs/dbraw/zinc/31/82/72/1041318272.db2.gz IKQPEIQDIHXFNI-UHFFFAOYSA-N 1 2 320.392 4.045 20 0 DIADLO Cc1ccc(-c2cc(C[N@H+]3CCOc4ccccc4C3)on2)cc1 ZINC000613564864 1041318288 /nfs/dbraw/zinc/31/82/88/1041318288.db2.gz IKQPEIQDIHXFNI-UHFFFAOYSA-N 1 2 320.392 4.045 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(F)c1F)c1nc2c(s1)CCCC2 ZINC000605593930 1041328631 /nfs/dbraw/zinc/32/86/31/1041328631.db2.gz ROYWRVQEVAAFDR-SNVBAGLBSA-N 1 2 308.397 4.151 20 0 DIADLO CCCCCC[C@H](CC)[N@@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001170600054 1041330448 /nfs/dbraw/zinc/33/04/48/1041330448.db2.gz QRURDTRRJXPHAA-CVEARBPZSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCCC[C@H](CC)[N@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001170600054 1041330462 /nfs/dbraw/zinc/33/04/62/1041330462.db2.gz QRURDTRRJXPHAA-CVEARBPZSA-N 1 2 307.482 4.155 20 0 DIADLO CCc1nn(C)c(Cl)c1C[N@H+](C)C/C(C)=C/c1ccccc1 ZINC000756121558 1041360795 /nfs/dbraw/zinc/36/07/95/1041360795.db2.gz LYMBAEMOSXCYQR-SDNWHVSQSA-N 1 2 317.864 4.171 20 0 DIADLO CCc1nn(C)c(Cl)c1C[N@@H+](C)C/C(C)=C/c1ccccc1 ZINC000756121558 1041360808 /nfs/dbraw/zinc/36/08/08/1041360808.db2.gz LYMBAEMOSXCYQR-SDNWHVSQSA-N 1 2 317.864 4.171 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@H](C)c1ccccc1OC(F)F ZINC000924603053 1041396009 /nfs/dbraw/zinc/39/60/09/1041396009.db2.gz ZRLFBEHZZRYSDE-MFKMUULPSA-N 1 2 322.355 4.313 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(C(C)(C)C)cc1)[N@H+](C)Cc1ccco1 ZINC000023992931 1041420795 /nfs/dbraw/zinc/42/07/95/1041420795.db2.gz UTRKFLYSFGJSMY-AWEZNQCLSA-N 1 2 314.429 4.036 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(C(C)(C)C)cc1)[N@@H+](C)Cc1ccco1 ZINC000023992931 1041420799 /nfs/dbraw/zinc/42/07/99/1041420799.db2.gz UTRKFLYSFGJSMY-AWEZNQCLSA-N 1 2 314.429 4.036 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2ncc(Cl)n2C)cc1C ZINC000122507333 1041437314 /nfs/dbraw/zinc/43/73/14/1041437314.db2.gz SXNKRNHVDVDALW-OAHLLOKOSA-N 1 2 303.837 4.027 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ncc(Cl)n2C)cc1C ZINC000122507333 1041437322 /nfs/dbraw/zinc/43/73/22/1041437322.db2.gz SXNKRNHVDVDALW-OAHLLOKOSA-N 1 2 303.837 4.027 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2ccc(CC(C)C)nc2)cs1 ZINC000892976631 1041444707 /nfs/dbraw/zinc/44/47/07/1041444707.db2.gz AUXHEXCHNKZGKV-CYBMUJFWSA-N 1 2 303.475 4.150 20 0 DIADLO CCOc1ccc(C[NH2+][C@H](C)c2nc3ccccc3s2)o1 ZINC000892981958 1041447533 /nfs/dbraw/zinc/44/75/33/1041447533.db2.gz WFNQIFDUYVJOLW-LLVKDONJSA-N 1 2 302.399 4.139 20 0 DIADLO CC(C)(C)c1nn(C[NH2+]C2(c3ccccc3)CCC2)c(=S)o1 ZINC000728707424 1041462111 /nfs/dbraw/zinc/46/21/11/1041462111.db2.gz OLMIFAKMFVFLOW-UHFFFAOYSA-N 1 2 317.458 4.130 20 0 DIADLO c1csc(C([NH2+]Cc2nccn2C2CC2)c2cccs2)c1 ZINC000893047331 1041470015 /nfs/dbraw/zinc/47/00/15/1041470015.db2.gz LZCZWTAZZAWWBV-UHFFFAOYSA-N 1 2 315.467 4.220 20 0 DIADLO Brc1csc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c1 ZINC000271000608 1041483900 /nfs/dbraw/zinc/48/39/00/1041483900.db2.gz KCIJQUFAVYRQMS-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1csc(C[N@H+]2CCC[C@@H]2c2ccncc2)c1 ZINC000271000608 1041483910 /nfs/dbraw/zinc/48/39/10/1041483910.db2.gz KCIJQUFAVYRQMS-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Oc1ccc([C@H]2CCC[N@@H+]2Cc2ccnc(Cl)c2Cl)cc1 ZINC000811458473 1041520097 /nfs/dbraw/zinc/52/00/97/1041520097.db2.gz MBKAWACYIBSOQW-CQSZACIVSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@H]2CCC[N@H+]2Cc2ccnc(Cl)c2Cl)cc1 ZINC000811458473 1041520106 /nfs/dbraw/zinc/52/01/06/1041520106.db2.gz MBKAWACYIBSOQW-CQSZACIVSA-N 1 2 323.223 4.431 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2ccnc(Cl)c2Cl)n1 ZINC000811477941 1041527035 /nfs/dbraw/zinc/52/70/35/1041527035.db2.gz IVLACPSEGFQINU-MRVPVSSYSA-N 1 2 302.230 4.004 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@H]1CCCc2cc(OC(F)F)ccc21 ZINC000180331700 1041529016 /nfs/dbraw/zinc/52/90/16/1041529016.db2.gz IVVRLLFPCUIGTP-HWPZZCPQSA-N 1 2 321.371 4.048 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccnc(Cl)c1Cl)c1nccs1 ZINC000811481009 1041529152 /nfs/dbraw/zinc/52/91/52/1041529152.db2.gz MCJSPDJNJYRBEN-SECBINFHSA-N 1 2 302.230 4.086 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3ccccc3[C@@H]2c2ccccc2)co1 ZINC000659910750 1041536110 /nfs/dbraw/zinc/53/61/10/1041536110.db2.gz NHNNARJYVUISLD-FQEVSTJZSA-N 1 2 304.393 4.131 20 0 DIADLO Cc1nc(C[N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)co1 ZINC000659910750 1041536116 /nfs/dbraw/zinc/53/61/16/1041536116.db2.gz NHNNARJYVUISLD-FQEVSTJZSA-N 1 2 304.393 4.131 20 0 DIADLO Clc1cccc([C@H]([NH2+]Cc2cncs2)c2ccccn2)c1 ZINC000136350445 1041565728 /nfs/dbraw/zinc/56/57/28/1041565728.db2.gz WXZYATGQBXUYQB-INIZCTEOSA-N 1 2 315.829 4.071 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc([NH+](C)C)c(C)c2)cc1OC ZINC000182848546 1041574372 /nfs/dbraw/zinc/57/43/72/1041574372.db2.gz AVGZFTWHTGXTLH-AWEZNQCLSA-N 1 2 314.429 4.251 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc([NH+](C)C)c(C)c2)cc1OC ZINC000182848566 1041574619 /nfs/dbraw/zinc/57/46/19/1041574619.db2.gz AVGZFTWHTGXTLH-CQSZACIVSA-N 1 2 314.429 4.251 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3Cl)C2)co1 ZINC001206074786 1041585668 /nfs/dbraw/zinc/58/56/68/1041585668.db2.gz VBJXZBUYARDREB-NSHDSACASA-N 1 2 311.212 4.279 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@H](c3cccc(Cl)c3Cl)C2)co1 ZINC001206074786 1041585674 /nfs/dbraw/zinc/58/56/74/1041585674.db2.gz VBJXZBUYARDREB-NSHDSACASA-N 1 2 311.212 4.279 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1cccc(F)c1OC(F)F ZINC000660021137 1041585810 /nfs/dbraw/zinc/58/58/10/1041585810.db2.gz IRZOTGZZHRDXJG-OAHLLOKOSA-N 1 2 324.346 4.103 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1cccc(F)c1OC(F)F ZINC000660021137 1041585813 /nfs/dbraw/zinc/58/58/13/1041585813.db2.gz IRZOTGZZHRDXJG-OAHLLOKOSA-N 1 2 324.346 4.103 20 0 DIADLO Fc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)c1OC(F)F ZINC000660033176 1041588605 /nfs/dbraw/zinc/58/86/05/1041588605.db2.gz YYKMLOQKSQEJJF-CQSZACIVSA-N 1 2 310.319 4.092 20 0 DIADLO Fc1cccc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c1OC(F)F ZINC000660033176 1041588612 /nfs/dbraw/zinc/58/86/12/1041588612.db2.gz YYKMLOQKSQEJJF-CQSZACIVSA-N 1 2 310.319 4.092 20 0 DIADLO Cc1nc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)c(C)o1 ZINC000660064441 1041597642 /nfs/dbraw/zinc/59/76/42/1041597642.db2.gz GXDVSVMOBNDDDY-UHFFFAOYSA-N 1 2 310.319 4.089 20 0 DIADLO Cc1nc(C[N@@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)c(C)o1 ZINC000660068603 1041599362 /nfs/dbraw/zinc/59/93/62/1041599362.db2.gz LIMLMVKVYCHDHN-IBGZPJMESA-N 1 2 309.413 4.500 20 0 DIADLO Cc1nc(C[N@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)c(C)o1 ZINC000660068603 1041599365 /nfs/dbraw/zinc/59/93/65/1041599365.db2.gz LIMLMVKVYCHDHN-IBGZPJMESA-N 1 2 309.413 4.500 20 0 DIADLO CC[C@](C)([NH2+]Cc1nsc2ccccc12)c1nccs1 ZINC000660079241 1041603513 /nfs/dbraw/zinc/60/35/13/1041603513.db2.gz DMZARBDKDYRZHO-HNNXBMFYSA-N 1 2 303.456 4.168 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)c1 ZINC000660137697 1041628944 /nfs/dbraw/zinc/62/89/44/1041628944.db2.gz MLTCAPVLMVJIEU-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@H+]2CCC[C@@H]2c2cccnc2)c1 ZINC000660137697 1041628946 /nfs/dbraw/zinc/62/89/46/1041628946.db2.gz MLTCAPVLMVJIEU-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccc(-c3csc(C)n3)cc2)co1 ZINC000660183135 1041654190 /nfs/dbraw/zinc/65/41/90/1041654190.db2.gz BOTAVLAWLHVGJP-LLVKDONJSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1nc(C[NH2+][C@@H](COc2ccccc2)c2ccccc2)c(C)o1 ZINC000660197779 1041661565 /nfs/dbraw/zinc/66/15/65/1041661565.db2.gz QOHQNBBVNUMLNZ-FQEVSTJZSA-N 1 2 322.408 4.201 20 0 DIADLO CCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1coc(C)n1 ZINC000660200386 1041665709 /nfs/dbraw/zinc/66/57/09/1041665709.db2.gz BOAKCIDMPRIYHD-KRWDZBQOSA-N 1 2 302.418 4.259 20 0 DIADLO Brc1scnc1C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000660206965 1041667527 /nfs/dbraw/zinc/66/75/27/1041667527.db2.gz AWRUAOOKQXNRNG-CYBMUJFWSA-N 1 2 323.259 4.147 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccccc2Oc2cccc(C)c2)[nH]c1C ZINC000584793740 1041673657 /nfs/dbraw/zinc/67/36/57/1041673657.db2.gz VVOAAWQUTXYQDC-UHFFFAOYSA-N 1 2 321.424 4.417 20 0 DIADLO CCO[C@H]1C[C@@H](Nc2ccc([NH+]3CCCC3)cc2)C12CCC2 ZINC000388266404 1041677662 /nfs/dbraw/zinc/67/76/62/1041677662.db2.gz MWJKZAWPDRQMKW-MSOLQXFVSA-N 1 2 300.446 4.046 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)s1 ZINC000584876511 1041697381 /nfs/dbraw/zinc/69/73/81/1041697381.db2.gz LVAJQBBOCQFFOL-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCC[C@@H]2c2ccccn2)s1 ZINC000584876511 1041697386 /nfs/dbraw/zinc/69/73/86/1041697386.db2.gz LVAJQBBOCQFFOL-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cc(F)ccc2OC(F)F)s1 ZINC000660269797 1041697507 /nfs/dbraw/zinc/69/75/07/1041697507.db2.gz ORMRDVBCUCSDRN-SECBINFHSA-N 1 2 316.348 4.043 20 0 DIADLO C[C@H](OCCn1cc[nH+]c1)c1c(Cl)ccc(F)c1Cl ZINC001222129403 1041709004 /nfs/dbraw/zinc/70/90/04/1041709004.db2.gz OJMFCAJPBOXKTJ-VIFPVBQESA-N 1 2 303.164 4.107 20 0 DIADLO CCc1nc(C)c([C@H](C)[NH2+][C@H]2COc3cc(F)cc(F)c32)s1 ZINC000364311238 1041739631 /nfs/dbraw/zinc/73/96/31/1041739631.db2.gz JQEHIEYRPZWFHN-UFBFGSQYSA-N 1 2 324.396 4.076 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCC1(F)F)c1cccc(Br)c1 ZINC000397955187 1041740869 /nfs/dbraw/zinc/74/08/69/1041740869.db2.gz MPNJWRCTZDZINH-CABZTGNLSA-N 1 2 304.178 4.288 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCC[N@@H+]1C/C=C/Cl ZINC000759805841 1041743481 /nfs/dbraw/zinc/74/34/81/1041743481.db2.gz ZRSNGJWGQOYVOO-VUDGCMKMSA-N 1 2 316.276 4.390 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCC[N@H+]1C/C=C/Cl ZINC000759805841 1041743491 /nfs/dbraw/zinc/74/34/91/1041743491.db2.gz ZRSNGJWGQOYVOO-VUDGCMKMSA-N 1 2 316.276 4.390 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccccc1Oc1cccnc1 ZINC000109390279 1041743761 /nfs/dbraw/zinc/74/37/61/1041743761.db2.gz LXUBBPIKWUASKN-INIZCTEOSA-N 1 2 319.408 4.252 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccccc1Oc1cccnc1 ZINC000109390279 1041743764 /nfs/dbraw/zinc/74/37/64/1041743764.db2.gz LXUBBPIKWUASKN-INIZCTEOSA-N 1 2 319.408 4.252 20 0 DIADLO C[C@@H]1CCC[C@@H]([N@H+](C)Cn2nc(-c3ccccc3)[nH]c2=S)C1 ZINC000025484840 1041753616 /nfs/dbraw/zinc/75/36/16/1041753616.db2.gz XXTGBNQVAWSGIW-UKRRQHHQSA-N 1 2 316.474 4.076 20 0 DIADLO C[C@@H]1CCC[C@@H]([N@@H+](C)Cn2nc(-c3ccccc3)[nH]c2=S)C1 ZINC000025484840 1041753621 /nfs/dbraw/zinc/75/36/21/1041753621.db2.gz XXTGBNQVAWSGIW-UKRRQHHQSA-N 1 2 316.474 4.076 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[N@H+](C)Cc1cncs1 ZINC000652039886 1041764441 /nfs/dbraw/zinc/76/44/41/1041764441.db2.gz QVAUXEUUVPFOPQ-CQSZACIVSA-N 1 2 322.861 4.315 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[N@@H+](C)Cc1cncs1 ZINC000652039886 1041764450 /nfs/dbraw/zinc/76/44/50/1041764450.db2.gz QVAUXEUUVPFOPQ-CQSZACIVSA-N 1 2 322.861 4.315 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1coc(C3CC3)n1)[C@H]2C ZINC000781928232 1041772815 /nfs/dbraw/zinc/77/28/15/1041772815.db2.gz VIWZTUWAWNEZOA-OLZOCXBDSA-N 1 2 312.413 4.068 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1coc(C3CC3)n1)[C@H]2C ZINC000781928232 1041772820 /nfs/dbraw/zinc/77/28/20/1041772820.db2.gz VIWZTUWAWNEZOA-OLZOCXBDSA-N 1 2 312.413 4.068 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2ccc(Br)cc2)c1 ZINC000652067612 1041773339 /nfs/dbraw/zinc/77/33/39/1041773339.db2.gz AARRZJQLRVPSMP-LLVKDONJSA-N 1 2 321.218 4.164 20 0 DIADLO OCc1ccc2c(c1)CC[N@@H+](Cc1c(Cl)cccc1Cl)C2 ZINC001203416245 1041774542 /nfs/dbraw/zinc/77/45/42/1041774542.db2.gz ATWWMNOGKAWUOY-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO OCc1ccc2c(c1)CC[N@H+](Cc1c(Cl)cccc1Cl)C2 ZINC001203416245 1041774546 /nfs/dbraw/zinc/77/45/46/1041774546.db2.gz ATWWMNOGKAWUOY-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO CCN(C)c1cc(N[C@@H](C)c2ccccc2C(F)(F)F)[nH+]cn1 ZINC001170735424 1041796997 /nfs/dbraw/zinc/79/69/97/1041796997.db2.gz GIJIKVBBRLNZFS-NSHDSACASA-N 1 2 324.350 4.125 20 0 DIADLO CCN(C)c1cc(N[C@@H](C)c2ccccc2C(F)(F)F)nc[nH+]1 ZINC001170735424 1041797002 /nfs/dbraw/zinc/79/70/02/1041797002.db2.gz GIJIKVBBRLNZFS-NSHDSACASA-N 1 2 324.350 4.125 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CC[C@@H](F)C(F)(F)CC2)c1Cl ZINC001137999426 1041802804 /nfs/dbraw/zinc/80/28/04/1041802804.db2.gz HGFQXOBXBRNUSN-LLVKDONJSA-N 1 2 313.697 4.187 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c1Cl ZINC001137999426 1041802813 /nfs/dbraw/zinc/80/28/13/1041802813.db2.gz HGFQXOBXBRNUSN-LLVKDONJSA-N 1 2 313.697 4.187 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1coc(-c2cccs2)n1 ZINC000109784360 1041811777 /nfs/dbraw/zinc/81/17/77/1041811777.db2.gz PIMVTNQGLZMTJM-LBPRGKRZSA-N 1 2 314.410 4.302 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1coc(-c2cccs2)n1 ZINC000109784360 1041811780 /nfs/dbraw/zinc/81/17/80/1041811780.db2.gz PIMVTNQGLZMTJM-LBPRGKRZSA-N 1 2 314.410 4.302 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[NH+]1CCC(C)(C2CC2)CC1 ZINC001170745059 1041817499 /nfs/dbraw/zinc/81/74/99/1041817499.db2.gz PVVCGQWDRDTQOC-MRXNPFEDSA-N 1 2 321.848 4.066 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2ccc(F)c(-c3cccs3)c2)n1 ZINC000557178840 1041838635 /nfs/dbraw/zinc/83/86/35/1041838635.db2.gz LDHPJEULAUXVMS-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ccc(-c2nn(C[N@@H+](C)[C@@H](C)C(C)(C)C)c(=S)[nH]2)cc1 ZINC000026630054 1041842008 /nfs/dbraw/zinc/84/20/08/1041842008.db2.gz MMGXKOXPTJCZHW-ZDUSSCGKSA-N 1 2 318.490 4.240 20 0 DIADLO Cc1ccc(-c2nn(C[N@H+](C)[C@@H](C)C(C)(C)C)c(=S)[nH]2)cc1 ZINC000026630054 1041842014 /nfs/dbraw/zinc/84/20/14/1041842014.db2.gz MMGXKOXPTJCZHW-ZDUSSCGKSA-N 1 2 318.490 4.240 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(C=Cc2ccc(C)o2)[nH]c1=S ZINC000026636471 1041844153 /nfs/dbraw/zinc/84/41/53/1041844153.db2.gz IJPWFHCSAPVAHK-MDZDMXLPSA-N 1 2 320.462 4.092 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(C=Cc2ccc(C)o2)[nH]c1=S ZINC000026636471 1041844161 /nfs/dbraw/zinc/84/41/61/1041844161.db2.gz IJPWFHCSAPVAHK-MDZDMXLPSA-N 1 2 320.462 4.092 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(F)c2Br)CCC1(F)F ZINC001137717261 1041848475 /nfs/dbraw/zinc/84/84/75/1041848475.db2.gz RLUOMCZCUMSVDZ-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(F)c2Br)CCC1(F)F ZINC001137717261 1041848482 /nfs/dbraw/zinc/84/84/82/1041848482.db2.gz RLUOMCZCUMSVDZ-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO CCCC[C@@H](CC)C[N@H+](C)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660764375 1041860678 /nfs/dbraw/zinc/86/06/78/1041860678.db2.gz OBKYMFMVARUXDC-WBVHZDCISA-N 1 2 300.450 4.042 20 0 DIADLO CCCC[C@@H](CC)C[N@@H+](C)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660764375 1041860686 /nfs/dbraw/zinc/86/06/86/1041860686.db2.gz OBKYMFMVARUXDC-WBVHZDCISA-N 1 2 300.450 4.042 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](CCc1nsc3ccccc31)C2 ZINC000660802820 1041863954 /nfs/dbraw/zinc/86/39/54/1041863954.db2.gz ZTMQSSXXTRPVQE-UHFFFAOYSA-N 1 2 322.433 4.057 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](CCc1nsc3ccccc31)C2 ZINC000660802820 1041863958 /nfs/dbraw/zinc/86/39/58/1041863958.db2.gz ZTMQSSXXTRPVQE-UHFFFAOYSA-N 1 2 322.433 4.057 20 0 DIADLO C[C@H]1c2cc(F)cc(F)c2CC[N@H+]1Cc1cc2cnccc2o1 ZINC000651650338 1041865162 /nfs/dbraw/zinc/86/51/62/1041865162.db2.gz KJRSHKPIBVODSW-NSHDSACASA-N 1 2 314.335 4.225 20 0 DIADLO C[C@H]1c2cc(F)cc(F)c2CC[N@@H+]1Cc1cc2cnccc2o1 ZINC000651650338 1041865164 /nfs/dbraw/zinc/86/51/64/1041865164.db2.gz KJRSHKPIBVODSW-NSHDSACASA-N 1 2 314.335 4.225 20 0 DIADLO Clc1cnc(C[NH+]2CCC(c3ccco3)CC2)c(Cl)c1 ZINC000661161176 1041897099 /nfs/dbraw/zinc/89/70/99/1041897099.db2.gz MQKBVNYCLNNMRR-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc2c1CCC2)c1noc(-c2ccccc2)n1 ZINC000651732258 1041899388 /nfs/dbraw/zinc/89/93/88/1041899388.db2.gz OEABTFKJDBCEAE-CQSZACIVSA-N 1 2 319.408 4.076 20 0 DIADLO CCc1nc(C(C)C)ccc1C[N@@H+]1CCC[C@@H]1c1cc(C)on1 ZINC000815011650 1041904420 /nfs/dbraw/zinc/90/44/20/1041904420.db2.gz VNBALJOXXUTFBQ-LJQANCHMSA-N 1 2 313.445 4.401 20 0 DIADLO CCc1nc(C(C)C)ccc1C[N@H+]1CCC[C@@H]1c1cc(C)on1 ZINC000815011650 1041904424 /nfs/dbraw/zinc/90/44/24/1041904424.db2.gz VNBALJOXXUTFBQ-LJQANCHMSA-N 1 2 313.445 4.401 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1sccc1OC ZINC001141329389 1041913727 /nfs/dbraw/zinc/91/37/27/1041913727.db2.gz UVYIFLGQOVEYDH-HNNXBMFYSA-N 1 2 317.454 4.240 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1sccc1OC ZINC001141329389 1041913731 /nfs/dbraw/zinc/91/37/31/1041913731.db2.gz UVYIFLGQOVEYDH-HNNXBMFYSA-N 1 2 317.454 4.240 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1csc(-c3ccccn3)n1)CC2 ZINC000661375328 1041926617 /nfs/dbraw/zinc/92/66/17/1041926617.db2.gz LVROSABZVYODQX-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1csc(-c3ccccn3)n1)CC2 ZINC000661375328 1041926625 /nfs/dbraw/zinc/92/66/25/1041926625.db2.gz LVROSABZVYODQX-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Fc1c[nH]c2nc[nH+]c(NC3c4ccccc4-c4ccccc43)c12 ZINC001167778071 1041930072 /nfs/dbraw/zinc/93/00/72/1041930072.db2.gz VTXQOEPJIPNJAT-UHFFFAOYSA-N 1 2 316.339 4.279 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncc(CSC)s1)c1ccccc1F ZINC000594509983 1041931994 /nfs/dbraw/zinc/93/19/94/1041931994.db2.gz MGFRAVWJPFBNRK-CQSZACIVSA-N 1 2 310.463 4.386 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nccn2CCCc2ccccc2)o1 ZINC000164362140 1041934542 /nfs/dbraw/zinc/93/45/42/1041934542.db2.gz YNUGEKREOMDAHL-KRWDZBQOSA-N 1 2 323.440 4.268 20 0 DIADLO C[C@@H](Oc1ccc([C@H](C)[NH2+]Cc2c[nH]cn2)cc1)c1ccccc1 ZINC000661460027 1041940591 /nfs/dbraw/zinc/94/05/91/1041940591.db2.gz XMXNXWUBJZRRJL-JKSUJKDBSA-N 1 2 321.424 4.401 20 0 DIADLO Cc1nnc(C[N@@H+](C)Cc2ccc(C(C)C)cc2C(C)C)o1 ZINC000661532346 1041950560 /nfs/dbraw/zinc/95/05/60/1041950560.db2.gz WKORPLOFGYNDKD-UHFFFAOYSA-N 1 2 301.434 4.257 20 0 DIADLO Cc1nnc(C[N@H+](C)Cc2ccc(C(C)C)cc2C(C)C)o1 ZINC000661532346 1041950561 /nfs/dbraw/zinc/95/05/61/1041950561.db2.gz WKORPLOFGYNDKD-UHFFFAOYSA-N 1 2 301.434 4.257 20 0 DIADLO Clc1ccc(C[N@@H+]2CC3(CCOCC3)[C@H]2c2ccco2)cc1 ZINC000661561078 1041953130 /nfs/dbraw/zinc/95/31/30/1041953130.db2.gz KKXAQRBHFKFOCY-QGZVFWFLSA-N 1 2 317.816 4.287 20 0 DIADLO Clc1ccc(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccco2)cc1 ZINC000661561078 1041953134 /nfs/dbraw/zinc/95/31/34/1041953134.db2.gz KKXAQRBHFKFOCY-QGZVFWFLSA-N 1 2 317.816 4.287 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccncc2Cl)cc1F ZINC000661661225 1041966668 /nfs/dbraw/zinc/96/66/68/1041966668.db2.gz VVNUAADNQZXOGK-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ccncc2Cl)cc1F ZINC000661661225 1041966672 /nfs/dbraw/zinc/96/66/72/1041966672.db2.gz VVNUAADNQZXOGK-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CCCCCC(C)(C)C[NH2+][C@@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000815587901 1041967999 /nfs/dbraw/zinc/96/79/99/1041967999.db2.gz WWKDOGXYQZPTQH-MRXNPFEDSA-N 1 2 318.440 4.229 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(-c2ccccc2)[nH]1)c1cccc(C2CC2)c1 ZINC000815610821 1041974001 /nfs/dbraw/zinc/97/40/01/1041974001.db2.gz VBZJSFAULUUXOD-AWEZNQCLSA-N 1 2 318.424 4.200 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nccn1C1CC1)c1ccc(Cl)cc1F ZINC000893491840 1041975134 /nfs/dbraw/zinc/97/51/34/1041975134.db2.gz MJEPYZYIPJWGSW-KRWDZBQOSA-N 1 2 321.827 4.497 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CC(C)(C)Oc2ccc(F)cc21)c1cscn1 ZINC000652266706 1041986110 /nfs/dbraw/zinc/98/61/10/1041986110.db2.gz JNOOJFSJZUKWRE-ZWNOBZJWSA-N 1 2 306.406 4.235 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccc(F)cn1 ZINC000815649726 1041986049 /nfs/dbraw/zinc/98/60/49/1041986049.db2.gz XJSNXOBLSPICCL-MRXNPFEDSA-N 1 2 312.310 4.125 20 0 DIADLO Brc1nc(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)cs1 ZINC001137583564 1041992694 /nfs/dbraw/zinc/99/26/94/1041992694.db2.gz ZHPCONMEMHRYSG-CMPLNLGQSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1nc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)cs1 ZINC001137583564 1041992696 /nfs/dbraw/zinc/99/26/96/1041992696.db2.gz ZHPCONMEMHRYSG-CMPLNLGQSA-N 1 2 315.280 4.060 20 0 DIADLO c1ccc(N2CCC(Nc3ccc4ccccc4c3)CC2)[nH+]c1 ZINC000236749081 1041998050 /nfs/dbraw/zinc/99/80/50/1041998050.db2.gz MWSMWEDLQZEVIK-UHFFFAOYSA-N 1 2 303.409 4.316 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ccc(F)cc2)nn1C ZINC000487364547 1041999481 /nfs/dbraw/zinc/99/94/81/1041999481.db2.gz LJABQQLDCKIARO-UHFFFAOYSA-N 1 2 323.415 4.070 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2ccc(F)cc2)nn1C ZINC000487364547 1041999486 /nfs/dbraw/zinc/99/94/86/1041999486.db2.gz LJABQQLDCKIARO-UHFFFAOYSA-N 1 2 323.415 4.070 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2ccc(OC)c(Cl)c2)c1 ZINC000652330780 1042009575 /nfs/dbraw/zinc/00/95/75/1042009575.db2.gz PKRKZCCKWOCEHQ-LLVKDONJSA-N 1 2 306.793 4.063 20 0 DIADLO CCCOc1ccc([C@@H](C)Nc2cc(COC)cc[nH+]2)cc1 ZINC000652330712 1042009865 /nfs/dbraw/zinc/00/98/65/1042009865.db2.gz NJNLAZKHFFAVKJ-CQSZACIVSA-N 1 2 300.402 4.190 20 0 DIADLO CCOc1ccc(Cl)cc1[C@@H](C)Nc1cc(COC)cc[nH+]1 ZINC000652331034 1042010797 /nfs/dbraw/zinc/01/07/97/1042010797.db2.gz WKLKORPIHIJHMI-GFCCVEGCSA-N 1 2 320.820 4.453 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2cc(C)c(OC)c(Cl)c2)c1 ZINC000652330945 1042011285 /nfs/dbraw/zinc/01/12/85/1042011285.db2.gz TUOBXAAXDOFWPI-LBPRGKRZSA-N 1 2 320.820 4.372 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nc(C)c3ccccc3n2)cc1F ZINC000178460254 1042016548 /nfs/dbraw/zinc/01/65/48/1042016548.db2.gz DDEMJHARBMVUOX-ZDUSSCGKSA-N 1 2 309.388 4.237 20 0 DIADLO COc1c(F)cc(Nc2ccc[nH+]c2N2CCCCC2)cc1F ZINC001211675107 1042020256 /nfs/dbraw/zinc/02/02/56/1042020256.db2.gz WIQATBXXUGEKGA-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO C[C@H]1COCC[C@H]1Nc1[nH+]ccc2cccc(C(F)(F)F)c21 ZINC001170820963 1042042185 /nfs/dbraw/zinc/04/21/85/1042042185.db2.gz QFMXXHUUONSZKW-GXFFZTMASA-N 1 2 310.319 4.091 20 0 DIADLO CSCc1cnc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)s1 ZINC000816482406 1042056325 /nfs/dbraw/zinc/05/63/25/1042056325.db2.gz DSDSQVXNKFRIEL-LBPRGKRZSA-N 1 2 304.484 4.125 20 0 DIADLO CSCc1cnc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)s1 ZINC000816482406 1042056333 /nfs/dbraw/zinc/05/63/33/1042056333.db2.gz DSDSQVXNKFRIEL-LBPRGKRZSA-N 1 2 304.484 4.125 20 0 DIADLO CCOc1nnc(C[N@H+](C(C)C)[C@@H](CC)c2ccccc2)s1 ZINC000662109445 1042066703 /nfs/dbraw/zinc/06/67/03/1042066703.db2.gz WYLONSIEYYAVAI-HNNXBMFYSA-N 1 2 319.474 4.299 20 0 DIADLO CCOc1nnc(C[N@@H+](C(C)C)[C@@H](CC)c2ccccc2)s1 ZINC000662109445 1042066710 /nfs/dbraw/zinc/06/67/10/1042066710.db2.gz WYLONSIEYYAVAI-HNNXBMFYSA-N 1 2 319.474 4.299 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2cnc(C3CC3)o2)c(F)c1 ZINC000628302757 1042078723 /nfs/dbraw/zinc/07/87/23/1042078723.db2.gz QPUVLJNOSLIQHZ-INIZCTEOSA-N 1 2 304.340 4.167 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2cnc(C3CC3)o2)c(F)c1 ZINC000628302757 1042078729 /nfs/dbraw/zinc/07/87/29/1042078729.db2.gz QPUVLJNOSLIQHZ-INIZCTEOSA-N 1 2 304.340 4.167 20 0 DIADLO CCOc1ccc(C[NH2+][C@H](CF)c2ccc(F)cc2)cc1OC ZINC000631280411 1042091702 /nfs/dbraw/zinc/09/17/02/1042091702.db2.gz LMCNYDZMULLQKK-MRXNPFEDSA-N 1 2 321.367 4.033 20 0 DIADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)Oc1ccc2oc3ccccc3c2c1 ZINC001135911332 1042105946 /nfs/dbraw/zinc/10/59/46/1042105946.db2.gz CXMGEDGUWCJIJE-GFCCVEGCSA-N 1 2 320.348 4.093 20 0 DIADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)Oc1ccc2oc3ccccc3c2c1 ZINC001135911332 1042105947 /nfs/dbraw/zinc/10/59/47/1042105947.db2.gz CXMGEDGUWCJIJE-GFCCVEGCSA-N 1 2 320.348 4.093 20 0 DIADLO Cc1cc(CNC(=S)Nc2cccc(Cl)c2C)cc(C)[nH+]1 ZINC000817560305 1042112994 /nfs/dbraw/zinc/11/29/94/1042112994.db2.gz LOLAYNCJQVYXPH-UHFFFAOYSA-N 1 2 319.861 4.147 20 0 DIADLO c1cnc2c(c1)CC[C@H](Nc1ccc([NH+]3CCCC3)cc1)CC2 ZINC000817581618 1042117163 /nfs/dbraw/zinc/11/71/63/1042117163.db2.gz UXXRZOQDPAWDND-KRWDZBQOSA-N 1 2 307.441 4.041 20 0 DIADLO CCOc1cccc([C@@H](C)[NH2+]Cc2csc([C@@H](C)OC)n2)c1 ZINC000165243172 1042123786 /nfs/dbraw/zinc/12/37/86/1042123786.db2.gz XAYPCANSZOVIJV-CHWSQXEVSA-N 1 2 320.458 4.100 20 0 DIADLO CC(C)Cc1ncc(C[N@@H+]2CCc3cccc(F)c3C2)s1 ZINC000353686019 1042132164 /nfs/dbraw/zinc/13/21/64/1042132164.db2.gz WNXZBWKTDYIKGR-UHFFFAOYSA-N 1 2 304.434 4.039 20 0 DIADLO CC(C)Cc1ncc(C[N@H+]2CCc3cccc(F)c3C2)s1 ZINC000353686019 1042132172 /nfs/dbraw/zinc/13/21/72/1042132172.db2.gz WNXZBWKTDYIKGR-UHFFFAOYSA-N 1 2 304.434 4.039 20 0 DIADLO CCc1nc(C[N@@H+]2CCC[C@H]2c2cccc3ccccc32)no1 ZINC000067460380 1042141616 /nfs/dbraw/zinc/14/16/16/1042141616.db2.gz DNTOSHSBJAFCBF-KRWDZBQOSA-N 1 2 307.397 4.122 20 0 DIADLO CCc1nc(C[N@H+]2CCC[C@H]2c2cccc3ccccc32)no1 ZINC000067460380 1042141619 /nfs/dbraw/zinc/14/16/19/1042141619.db2.gz DNTOSHSBJAFCBF-KRWDZBQOSA-N 1 2 307.397 4.122 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc2ccnc(Cl)c2c1 ZINC000818217812 1042143013 /nfs/dbraw/zinc/14/30/13/1042143013.db2.gz YSSWMSANCOKRKE-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO C[N@H+](Cn1sc2ccccc2c1=O)[C@H]1CCCc2ccccc21 ZINC000818260154 1042144788 /nfs/dbraw/zinc/14/47/88/1042144788.db2.gz VKQQVDVOSJPNLW-KRWDZBQOSA-N 1 2 324.449 4.030 20 0 DIADLO C[N@@H+](Cn1sc2ccccc2c1=O)[C@H]1CCCc2ccccc21 ZINC000818260154 1042144792 /nfs/dbraw/zinc/14/47/92/1042144792.db2.gz VKQQVDVOSJPNLW-KRWDZBQOSA-N 1 2 324.449 4.030 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)/C(F)=C\C1CCCCC1 ZINC001136134787 1042147117 /nfs/dbraw/zinc/14/71/17/1042147117.db2.gz BZKHVTFZKKAUNO-SFQUDFHCSA-N 1 2 313.376 4.245 20 0 DIADLO FC[C@]1(C(F)(F)F)CC[N@H+](Cc2ccc(Cl)cc2F)C1 ZINC001137656578 1042157033 /nfs/dbraw/zinc/15/70/33/1042157033.db2.gz MRDSWUIQJYCVKC-GFCCVEGCSA-N 1 2 313.697 4.203 20 0 DIADLO FC[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccc(Cl)cc2F)C1 ZINC001137656578 1042157036 /nfs/dbraw/zinc/15/70/36/1042157036.db2.gz MRDSWUIQJYCVKC-GFCCVEGCSA-N 1 2 313.697 4.203 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1ccc(C2CC2)cc1 ZINC001136185664 1042172056 /nfs/dbraw/zinc/17/20/56/1042172056.db2.gz IHWDFMGOBZTFDC-UHFFFAOYSA-N 1 2 303.365 4.002 20 0 DIADLO CC(C)(C)/C=C/C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000819606081 1042190053 /nfs/dbraw/zinc/19/00/53/1042190053.db2.gz OSZXOSANUOCWGI-VAWYXSNFSA-N 1 2 323.440 4.427 20 0 DIADLO O=C(Nc1ccc(C2CCC2)cc1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000278915657 1042206949 /nfs/dbraw/zinc/20/69/49/1042206949.db2.gz LDGXYCWJHBBASU-MRXNPFEDSA-N 1 2 324.428 4.089 20 0 DIADLO FC(F)c1ccc(C[NH2+]Cc2csc(C(F)(F)F)n2)cc1 ZINC000893620683 1042209920 /nfs/dbraw/zinc/20/99/20/1042209920.db2.gz DIOGLOKJPOFEFZ-UHFFFAOYSA-N 1 2 322.302 4.389 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2cc(Cl)nc(Cl)c2)C1 ZINC000805750827 1042221007 /nfs/dbraw/zinc/22/10/07/1042221007.db2.gz VPFLWCASAVWAOU-SMDDNHRTSA-N 1 2 322.239 4.367 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cc(Cl)nc(Cl)c2)C1 ZINC000805750827 1042221017 /nfs/dbraw/zinc/22/10/17/1042221017.db2.gz VPFLWCASAVWAOU-SMDDNHRTSA-N 1 2 322.239 4.367 20 0 DIADLO Cc1ccc(F)c(C[NH2+]Cc2coc(-c3cccs3)n2)c1 ZINC001648933419 1042221640 /nfs/dbraw/zinc/22/16/40/1042221640.db2.gz UPYBZPRRWMTUNT-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000279088698 1042270007 /nfs/dbraw/zinc/27/00/07/1042270007.db2.gz HZWKGCGSGPINGG-NSHDSACASA-N 1 2 322.449 4.439 20 0 DIADLO FC(F)(F)c1cccc(COc2ccccc2-n2cc[nH+]c2)c1 ZINC000039239584 1042275762 /nfs/dbraw/zinc/27/57/62/1042275762.db2.gz HJFGEFKZWZNKSH-UHFFFAOYSA-N 1 2 318.298 4.470 20 0 DIADLO C[C@H]1CCN(c2[nH+]ccc3c(N)cccc32)[C@H](c2ccco2)C1 ZINC000663674289 1042277645 /nfs/dbraw/zinc/27/76/45/1042277645.db2.gz HUBYXCBNCYQYAL-GUYCJALGSA-N 1 2 307.397 4.388 20 0 DIADLO CC(C)n1cncc1C[N@@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000822443464 1042283490 /nfs/dbraw/zinc/28/34/90/1042283490.db2.gz ULTKSDYBVPMZDC-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1cncc1C[N@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000822443464 1042283495 /nfs/dbraw/zinc/28/34/95/1042283495.db2.gz ULTKSDYBVPMZDC-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+]2CCC[C@@H]2c2ccccc2)n1 ZINC000169280891 1042288929 /nfs/dbraw/zinc/28/89/29/1042288929.db2.gz KTLRLVJEQRYDRW-UKRRQHHQSA-N 1 2 317.458 4.221 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+]2CCC[C@@H]2c2ccccc2)n1 ZINC000169280891 1042288934 /nfs/dbraw/zinc/28/89/34/1042288934.db2.gz KTLRLVJEQRYDRW-UKRRQHHQSA-N 1 2 317.458 4.221 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(C)n1C1CC1 ZINC000162732974 1042295520 /nfs/dbraw/zinc/29/55/20/1042295520.db2.gz FYIXKADEOYATMR-UHFFFAOYSA-N 1 2 320.396 4.082 20 0 DIADLO Cc1cc(NC(=O)CC(C)(C)CC(F)F)ccc1-n1cc[nH+]c1 ZINC001136625528 1042300952 /nfs/dbraw/zinc/30/09/52/1042300952.db2.gz NQTBZTNVLYBHDB-UHFFFAOYSA-N 1 2 321.371 4.191 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000162920440 1042301778 /nfs/dbraw/zinc/30/17/78/1042301778.db2.gz KBHCINNVJZHDAY-MRXNPFEDSA-N 1 2 314.454 4.366 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1csc(C2CC2)n1 ZINC000162920440 1042301785 /nfs/dbraw/zinc/30/17/85/1042301785.db2.gz KBHCINNVJZHDAY-MRXNPFEDSA-N 1 2 314.454 4.366 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc([NH+](C)C)cc2C)c(OC)c1 ZINC000320166077 1042314496 /nfs/dbraw/zinc/31/44/96/1042314496.db2.gz YKSHMFJXYUIINW-AWEZNQCLSA-N 1 2 314.429 4.251 20 0 DIADLO Cc1cncc([C@H](C)[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000279479301 1042319173 /nfs/dbraw/zinc/31/91/73/1042319173.db2.gz KPQPBTQUUQFMMI-UWVGGRQHSA-N 1 2 315.364 4.277 20 0 DIADLO Cc1cncc([C@@H](C)[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000279479305 1042319192 /nfs/dbraw/zinc/31/91/92/1042319192.db2.gz KPQPBTQUUQFMMI-ZJUUUORDSA-N 1 2 315.364 4.277 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1nc(C(F)(F)F)cs1)c1cncs1 ZINC000279492088 1042319205 /nfs/dbraw/zinc/31/92/05/1042319205.db2.gz LTXVTWFBOBXWDS-RNFRBKRXSA-N 1 2 307.366 4.030 20 0 DIADLO c1oc2ccccc2c1Nc1ccccc1C[NH+]1CCOCC1 ZINC001203151955 1042319269 /nfs/dbraw/zinc/31/92/69/1042319269.db2.gz IKZAAVXJWCAFQF-UHFFFAOYSA-N 1 2 308.381 4.009 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccnc(Cl)c2F)cc1 ZINC000823372024 1042322261 /nfs/dbraw/zinc/32/22/61/1042322261.db2.gz SEPSXZBBCBFSTD-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ccnc(Cl)c2F)cc1 ZINC000823372024 1042322267 /nfs/dbraw/zinc/32/22/67/1042322267.db2.gz SEPSXZBBCBFSTD-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2ccnc(Cl)c2F)cc1 ZINC000823394995 1042323984 /nfs/dbraw/zinc/32/39/84/1042323984.db2.gz IESDZFHLXBEVEQ-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2ccnc(Cl)c2F)cc1 ZINC000823394995 1042323992 /nfs/dbraw/zinc/32/39/92/1042323992.db2.gz IESDZFHLXBEVEQ-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](c2ccc(C)cc2)c2ccccn2)o1 ZINC000279587538 1042324618 /nfs/dbraw/zinc/32/46/18/1042324618.db2.gz CGPAUFRIUVTTAY-FQEVSTJZSA-N 1 2 306.409 4.425 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2cc(F)ncc2F)C1 ZINC000823459174 1042326333 /nfs/dbraw/zinc/32/63/33/1042326333.db2.gz RCTIHAIUJFEMNR-MEDUHNTESA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2cc(F)ncc2F)C1 ZINC000823459174 1042326339 /nfs/dbraw/zinc/32/63/39/1042326339.db2.gz RCTIHAIUJFEMNR-MEDUHNTESA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+][C@H]2CCCC23CCC3)cc1 ZINC000823554073 1042334271 /nfs/dbraw/zinc/33/42/71/1042334271.db2.gz GVUOFZZHWPYWLC-QAPCUYQASA-N 1 2 300.446 4.046 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ncnn1C(C)C)c1ccc(Cl)cc1F ZINC000279753708 1042337921 /nfs/dbraw/zinc/33/79/21/1042337921.db2.gz QKOSFSKSRFWYIJ-INIZCTEOSA-N 1 2 324.831 4.138 20 0 DIADLO CC(C)n1ncnc1C[N@H+](C)Cc1ccccc1-c1ccccc1 ZINC000279855293 1042347488 /nfs/dbraw/zinc/34/74/88/1042347488.db2.gz BFMYFVXGFNPVRM-UHFFFAOYSA-N 1 2 320.440 4.158 20 0 DIADLO CC(C)n1ncnc1C[N@@H+](C)Cc1ccccc1-c1ccccc1 ZINC000279855293 1042347495 /nfs/dbraw/zinc/34/74/95/1042347495.db2.gz BFMYFVXGFNPVRM-UHFFFAOYSA-N 1 2 320.440 4.158 20 0 DIADLO Cc1cccc(COc2ccc(-c3[nH+]cc4n3CCCC4)cc2)n1 ZINC000419012927 1042373080 /nfs/dbraw/zinc/37/30/80/1042373080.db2.gz XVEDTDUDFHIFLC-UHFFFAOYSA-N 1 2 319.408 4.169 20 0 DIADLO Fc1ccccc1C1([NH2+][C@@H]2CCc3c2nccc3Cl)CC1 ZINC000925883276 1042373571 /nfs/dbraw/zinc/37/35/71/1042373571.db2.gz IGSOUFWJRPCVMW-OAHLLOKOSA-N 1 2 302.780 4.140 20 0 DIADLO Cc1cccc(NC(=O)C[N@@H+](C)[C@@H](C)c2ccccc2F)c1C ZINC000051537153 1042376511 /nfs/dbraw/zinc/37/65/11/1042376511.db2.gz KFUQSAWDIPWBFE-HNNXBMFYSA-N 1 2 314.404 4.074 20 0 DIADLO Cc1cccc(NC(=O)C[N@H+](C)[C@@H](C)c2ccccc2F)c1C ZINC000051537153 1042376515 /nfs/dbraw/zinc/37/65/15/1042376515.db2.gz KFUQSAWDIPWBFE-HNNXBMFYSA-N 1 2 314.404 4.074 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[N@H+](C)Cc1ccc2ccccc2c1 ZINC000051679197 1042382025 /nfs/dbraw/zinc/38/20/25/1042382025.db2.gz PMVVYDWBXNARRE-CYBMUJFWSA-N 1 2 307.397 4.293 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000051679197 1042382031 /nfs/dbraw/zinc/38/20/31/1042382031.db2.gz PMVVYDWBXNARRE-CYBMUJFWSA-N 1 2 307.397 4.293 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2cscc2Br)c1 ZINC000709883902 1042385974 /nfs/dbraw/zinc/38/59/74/1042385974.db2.gz WGKOWZRKXWRAIZ-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2cscc2Br)c1 ZINC000709883902 1042385982 /nfs/dbraw/zinc/38/59/82/1042385982.db2.gz WGKOWZRKXWRAIZ-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO COc1c(F)cccc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001143536921 1042391412 /nfs/dbraw/zinc/39/14/12/1042391412.db2.gz KLVNRNIJDVYRLI-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cccc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001143536921 1042391421 /nfs/dbraw/zinc/39/14/21/1042391421.db2.gz KLVNRNIJDVYRLI-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cccc1C[N@@H+]1CCc2cccc(Cl)c2C1 ZINC001143537097 1042391574 /nfs/dbraw/zinc/39/15/74/1042391574.db2.gz OZTXKOZQATZRHH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1c(F)cccc1C[N@H+]1CCc2cccc(Cl)c2C1 ZINC001143537097 1042391578 /nfs/dbraw/zinc/39/15/78/1042391578.db2.gz OZTXKOZQATZRHH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1c(F)cccc1C[N@@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001143537525 1042391835 /nfs/dbraw/zinc/39/18/35/1042391835.db2.gz ZWPUOLBYDKKIGQ-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cccc1C[N@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001143537525 1042391839 /nfs/dbraw/zinc/39/18/39/1042391839.db2.gz ZWPUOLBYDKKIGQ-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1ncoc1C[N@@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000893969237 1042399652 /nfs/dbraw/zinc/39/96/52/1042399652.db2.gz SGVPGLWDONYVGB-CQSZACIVSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ncoc1C[N@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000893969237 1042399659 /nfs/dbraw/zinc/39/96/59/1042399659.db2.gz SGVPGLWDONYVGB-CQSZACIVSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ncoc1C[N@H+]1CCC[C@H]1c1nc2ccccc2n1C(C)C ZINC000894021750 1042402692 /nfs/dbraw/zinc/40/26/92/1042402692.db2.gz VHRWNCGKAYPZES-KRWDZBQOSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1ncoc1C[N@@H+]1CCC[C@H]1c1nc2ccccc2n1C(C)C ZINC000894021750 1042402697 /nfs/dbraw/zinc/40/26/97/1042402697.db2.gz VHRWNCGKAYPZES-KRWDZBQOSA-N 1 2 324.428 4.251 20 0 DIADLO COc1c(F)cc(F)cc1C[N@@H+]1CCc2ccccc2[C@H]1C ZINC001143551922 1042407384 /nfs/dbraw/zinc/40/73/84/1042407384.db2.gz NFILTOLOJXXOTR-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(F)cc(F)cc1C[N@H+]1CCc2ccccc2[C@H]1C ZINC001143551922 1042407391 /nfs/dbraw/zinc/40/73/91/1042407391.db2.gz NFILTOLOJXXOTR-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cc2[nH]ccc2s1 ZINC000366526141 1042433264 /nfs/dbraw/zinc/43/32/64/1042433264.db2.gz ULAFOIGVPFBFBO-UHFFFAOYSA-N 1 2 322.393 4.180 20 0 DIADLO CCCN(CCC)C(=O)c1ccc(Nc2cc(C)cc[nH+]2)cc1 ZINC001211760852 1042440257 /nfs/dbraw/zinc/44/02/57/1042440257.db2.gz ZXFHSLFDCBZTTD-UHFFFAOYSA-N 1 2 311.429 4.396 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+][C@H]2CCC23CCCC3)cc1 ZINC000249035576 1042451031 /nfs/dbraw/zinc/45/10/31/1042451031.db2.gz GAEZPSVLJWSFPX-QAPCUYQASA-N 1 2 300.446 4.046 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc(Cl)c2cccnc12 ZINC000051960239 1042457343 /nfs/dbraw/zinc/45/73/43/1042457343.db2.gz JRBPAUXIEWUPIH-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccc(Cl)c2cccnc12 ZINC000051960239 1042457348 /nfs/dbraw/zinc/45/73/48/1042457348.db2.gz JRBPAUXIEWUPIH-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1c(Cl)ccc2cccnc21 ZINC000051960150 1042457587 /nfs/dbraw/zinc/45/75/87/1042457587.db2.gz DGGCDOWHSHEGOM-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1c(Cl)ccc2cccnc21 ZINC000051960150 1042457589 /nfs/dbraw/zinc/45/75/89/1042457589.db2.gz DGGCDOWHSHEGOM-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO Cc1[nH+]c2cc(OCc3csc(C(C)C)n3)ccc2n1C ZINC000664052625 1042458290 /nfs/dbraw/zinc/45/82/90/1042458290.db2.gz CNQIRYDRSTWPSD-UHFFFAOYSA-N 1 2 301.415 4.041 20 0 DIADLO CCc1ccc(C[N@@H+]2CCC[C@H]2c2nc3cc(C)ccc3[nH]2)nc1 ZINC000411734986 1042460770 /nfs/dbraw/zinc/46/07/70/1042460770.db2.gz VBEJUYHZVSBIBY-IBGZPJMESA-N 1 2 320.440 4.166 20 0 DIADLO CCc1ccc(C[N@H+]2CCC[C@H]2c2nc3cc(C)ccc3[nH]2)nc1 ZINC000411734986 1042460771 /nfs/dbraw/zinc/46/07/71/1042460771.db2.gz VBEJUYHZVSBIBY-IBGZPJMESA-N 1 2 320.440 4.166 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)[nH]1 ZINC000411824583 1042462331 /nfs/dbraw/zinc/46/23/31/1042462331.db2.gz QRNPTFGHFCLLQA-YOEHRIQHSA-N 1 2 310.445 4.182 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)[nH]1 ZINC000411824583 1042462333 /nfs/dbraw/zinc/46/23/33/1042462333.db2.gz QRNPTFGHFCLLQA-YOEHRIQHSA-N 1 2 310.445 4.182 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cc(F)cc2c1OCOC2 ZINC000052073684 1042466293 /nfs/dbraw/zinc/46/62/93/1042466293.db2.gz WNHDCVINXNCXSQ-LBPRGKRZSA-N 1 2 319.351 4.024 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cc(F)cc2c1OCOC2 ZINC000052073684 1042466295 /nfs/dbraw/zinc/46/62/95/1042466295.db2.gz WNHDCVINXNCXSQ-LBPRGKRZSA-N 1 2 319.351 4.024 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+](C)[C@@H](C)c2ccccc2F)c(C)c1 ZINC000052074435 1042467069 /nfs/dbraw/zinc/46/70/69/1042467069.db2.gz AVWASAZUMDZPMC-HNNXBMFYSA-N 1 2 314.404 4.074 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+](C)[C@@H](C)c2ccccc2F)c(C)c1 ZINC000052074435 1042467074 /nfs/dbraw/zinc/46/70/74/1042467074.db2.gz AVWASAZUMDZPMC-HNNXBMFYSA-N 1 2 314.404 4.074 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(OC2CCCCC2)cc1)c1ncco1 ZINC000924882912 1042469702 /nfs/dbraw/zinc/46/97/02/1042469702.db2.gz OBOLLGLLFLEQJF-CQSZACIVSA-N 1 2 300.402 4.237 20 0 DIADLO CC(C)c1ccc([C@@H]([NH2+]Cc2cnc[nH]2)c2cccs2)cc1 ZINC000894158489 1042475735 /nfs/dbraw/zinc/47/57/35/1042475735.db2.gz RQGVIDGQHWGHNT-GOSISDBHSA-N 1 2 311.454 4.474 20 0 DIADLO C=C/C(C)=C\CC(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000614353129 1042475821 /nfs/dbraw/zinc/47/58/21/1042475821.db2.gz IDFBHDYKCXSOJD-PTNGSMBKSA-N 1 2 321.424 4.347 20 0 DIADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)C1CC2(CC2)C1 ZINC000614353262 1042476063 /nfs/dbraw/zinc/47/60/63/1042476063.db2.gz KQIDGIQTQNUAKR-UHFFFAOYSA-N 1 2 321.424 4.015 20 0 DIADLO Cc1ccc2[nH+]c(CSc3c(F)cc(F)cc3F)cn2c1 ZINC000614390475 1042489498 /nfs/dbraw/zinc/48/94/98/1042489498.db2.gz WYTSUJPIGVKQMF-UHFFFAOYSA-N 1 2 308.328 4.352 20 0 DIADLO CCOc1ccc([C@@H]([NH2+]Cc2ocnc2C)c2ccccc2)cc1 ZINC000894196853 1042500142 /nfs/dbraw/zinc/50/01/42/1042500142.db2.gz FYMZPKBXYYUREJ-FQEVSTJZSA-N 1 2 322.408 4.261 20 0 DIADLO c1ccc(C2(c3noc([C@@H]4CC[N@@H+]4C4CCCC4)n3)CCC2)cc1 ZINC000923971659 1042500257 /nfs/dbraw/zinc/50/02/57/1042500257.db2.gz QYPFQLOTYNRTME-KRWDZBQOSA-N 1 2 323.440 4.229 20 0 DIADLO c1ccc(C2(c3noc([C@@H]4CC[N@H+]4C4CCCC4)n3)CCC2)cc1 ZINC000923971659 1042500258 /nfs/dbraw/zinc/50/02/58/1042500258.db2.gz QYPFQLOTYNRTME-KRWDZBQOSA-N 1 2 323.440 4.229 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1cc2c(s1)CCCC2 ZINC000052909431 1042522354 /nfs/dbraw/zinc/52/23/54/1042522354.db2.gz RFOANDUMPJGMAD-UHFFFAOYSA-N 1 2 323.421 4.065 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1ccc(OC(F)F)cc1 ZINC000237100431 1042524699 /nfs/dbraw/zinc/52/46/99/1042524699.db2.gz NZSCJZFJNKXKHP-UHFFFAOYSA-N 1 2 306.356 4.275 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@H+](Cc3noc(C(C)C)n3)C2)cc1 ZINC000513371990 1042536947 /nfs/dbraw/zinc/53/69/47/1042536947.db2.gz RPBQAUDLSBLBPB-QGZVFWFLSA-N 1 2 313.445 4.135 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@@H+](Cc3noc(C(C)C)n3)C2)cc1 ZINC000513371990 1042536949 /nfs/dbraw/zinc/53/69/49/1042536949.db2.gz RPBQAUDLSBLBPB-QGZVFWFLSA-N 1 2 313.445 4.135 20 0 DIADLO Fc1ccc(/C=C\C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000513387224 1042537018 /nfs/dbraw/zinc/53/70/18/1042537018.db2.gz XKMIYHCHZGGJRF-DAXSKMNVSA-N 1 2 321.399 4.264 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000513387224 1042537023 /nfs/dbraw/zinc/53/70/23/1042537023.db2.gz XKMIYHCHZGGJRF-DAXSKMNVSA-N 1 2 321.399 4.264 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@H]2CCc3c2c(F)ccc3F)n1 ZINC000513395962 1042538490 /nfs/dbraw/zinc/53/84/90/1042538490.db2.gz WDXKLTZLCIDJGY-ZDUSSCGKSA-N 1 2 322.424 4.496 20 0 DIADLO Fc1ccc(C[NH2+]Cc2cc(C(F)(F)F)ccc2Cl)nc1 ZINC000513525818 1042550702 /nfs/dbraw/zinc/55/07/02/1042550702.db2.gz MDNOJZHJKCPFFF-UHFFFAOYSA-N 1 2 318.701 4.183 20 0 DIADLO CCS[C@@H](C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C)C(C)C ZINC000280006055 1042560921 /nfs/dbraw/zinc/56/09/21/1042560921.db2.gz LNDKTMJSTZWWND-OAHLLOKOSA-N 1 2 317.458 4.101 20 0 DIADLO CCS[C@H](C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C)C(C)C ZINC000280006054 1042561364 /nfs/dbraw/zinc/56/13/64/1042561364.db2.gz LNDKTMJSTZWWND-HNNXBMFYSA-N 1 2 317.458 4.101 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+]C1(c2nc(C)cs2)CCC1 ZINC000280131611 1042565233 /nfs/dbraw/zinc/56/52/33/1042565233.db2.gz BAGRVGQVOJKGCM-UHFFFAOYSA-N 1 2 322.861 4.283 20 0 DIADLO c1sc(-c2ccccn2)nc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000348528063 1042572839 /nfs/dbraw/zinc/57/28/39/1042572839.db2.gz WTBNFCSPDCBQRS-QGZVFWFLSA-N 1 2 307.422 4.152 20 0 DIADLO c1sc(-c2ccccn2)nc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000348528063 1042572841 /nfs/dbraw/zinc/57/28/41/1042572841.db2.gz WTBNFCSPDCBQRS-QGZVFWFLSA-N 1 2 307.422 4.152 20 0 DIADLO CCC(CC)([NH2+]Cc1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000072599721 1042595295 /nfs/dbraw/zinc/59/52/95/1042595295.db2.gz WOSVINQJUCGACU-UHFFFAOYSA-N 1 2 319.836 4.406 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+]Cc2csc(-c3ccccc3)n2)c1 ZINC000513718620 1042596721 /nfs/dbraw/zinc/59/67/21/1042596721.db2.gz ZZDMLCGDJKCOCU-CQSZACIVSA-N 1 2 309.438 4.364 20 0 DIADLO Cc1cc(CNC(=O)N[C@H](C)c2cc3ccccc3o2)cc(C)[nH+]1 ZINC000420836333 1042613263 /nfs/dbraw/zinc/61/32/63/1042613263.db2.gz PIMYNLPGOJTXMG-CQSZACIVSA-N 1 2 323.396 4.005 20 0 DIADLO Cc1cc(CNC(=O)N[C@H](C)c2ccc(C3CC3)cc2)cc(C)[nH+]1 ZINC000420856469 1042614887 /nfs/dbraw/zinc/61/48/87/1042614887.db2.gz FUMDVPZUTLTTPJ-OAHLLOKOSA-N 1 2 323.440 4.136 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420939600 1042616623 /nfs/dbraw/zinc/61/66/23/1042616623.db2.gz BVCUYLLGQHBQEP-WDEREUQCSA-N 1 2 319.371 4.093 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420939600 1042616624 /nfs/dbraw/zinc/61/66/24/1042616624.db2.gz BVCUYLLGQHBQEP-WDEREUQCSA-N 1 2 319.371 4.093 20 0 DIADLO FC(F)(F)C[C@@H]1CCC[N@H+](Cc2ccn(C3CCCC3)n2)C1 ZINC000420947022 1042616713 /nfs/dbraw/zinc/61/67/13/1042616713.db2.gz MJSLIFSKBFBFBY-ZDUSSCGKSA-N 1 2 315.383 4.163 20 0 DIADLO FC(F)(F)C[C@@H]1CCC[N@@H+](Cc2ccn(C3CCCC3)n2)C1 ZINC000420947022 1042616716 /nfs/dbraw/zinc/61/67/16/1042616716.db2.gz MJSLIFSKBFBFBY-ZDUSSCGKSA-N 1 2 315.383 4.163 20 0 DIADLO CC[C@H]1C[NH+](Cc2nc(-c3ccsc3)oc2C)C[C@H](CC)O1 ZINC000420955412 1042617372 /nfs/dbraw/zinc/61/73/72/1042617372.db2.gz LLXUIHWVTXKDBO-GJZGRUSLSA-N 1 2 320.458 4.101 20 0 DIADLO CCSc1cccc(NC(=O)NCc2cc(C)[nH+]c(C)c2)c1 ZINC000421065132 1042624334 /nfs/dbraw/zinc/62/43/34/1042624334.db2.gz SWWRQBNBAZUCCG-UHFFFAOYSA-N 1 2 315.442 4.132 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H]2CCC(C)(C)c3ccccc32)nn1C ZINC000421324011 1042630171 /nfs/dbraw/zinc/63/01/71/1042630171.db2.gz JCPMYSWEFXEQRR-HNNXBMFYSA-N 1 2 317.864 4.284 20 0 DIADLO Cc1c(Cl)c(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)nn1C ZINC000421326690 1042630948 /nfs/dbraw/zinc/63/09/48/1042630948.db2.gz OMISHNNWFCBJEN-UHFFFAOYSA-N 1 2 324.255 4.204 20 0 DIADLO CC[C@H]([NH2+]Cc1nn(C)c(C)c1Cl)c1cccc(Cl)c1 ZINC000421334186 1042631758 /nfs/dbraw/zinc/63/17/58/1042631758.db2.gz PJLJZPBNBFRJRR-ZDUSSCGKSA-N 1 2 312.244 4.276 20 0 DIADLO CCc1ccc([C@H](C)CC(=O)NCc2cc(C)[nH+]c(C)c2)cc1 ZINC000421579745 1042645161 /nfs/dbraw/zinc/64/51/61/1042645161.db2.gz UYICJNYULLFTEL-CQSZACIVSA-N 1 2 310.441 4.071 20 0 DIADLO CCc1ccc([C@@H](C)CC(=O)NCc2cc(C)[nH+]c(C)c2)cc1 ZINC000421579744 1042645196 /nfs/dbraw/zinc/64/51/96/1042645196.db2.gz UYICJNYULLFTEL-AWEZNQCLSA-N 1 2 310.441 4.071 20 0 DIADLO CCc1nc(C[NH2+][C@H](c2ccc(OC)cc2F)C(C)C)cs1 ZINC000421839119 1042655384 /nfs/dbraw/zinc/65/53/84/1042655384.db2.gz WJUDFHUJZDTKEK-KRWDZBQOSA-N 1 2 322.449 4.340 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1ccncc1Cl ZINC000421836488 1042656126 /nfs/dbraw/zinc/65/61/26/1042656126.db2.gz GZCAOCGCHRLOIF-JTQLQIEISA-N 1 2 311.212 4.248 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccncc1Cl)c1nc2c(s1)CCC2 ZINC000421851723 1042656996 /nfs/dbraw/zinc/65/69/96/1042656996.db2.gz GDFYDGAEQPOLDX-VHSXEESVSA-N 1 2 307.850 4.092 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ncc(C3CC3)o2)cc1 ZINC000271783084 1042668848 /nfs/dbraw/zinc/66/88/48/1042668848.db2.gz PLFHOWKAEAWUNY-CYBMUJFWSA-N 1 2 300.402 4.190 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ncc(C3CC3)o2)cc1 ZINC000271783087 1042668927 /nfs/dbraw/zinc/66/89/27/1042668927.db2.gz PLFHOWKAEAWUNY-ZDUSSCGKSA-N 1 2 300.402 4.190 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](C)c2ccc(OCCC(C)C)cc2)s1 ZINC000271855429 1042671210 /nfs/dbraw/zinc/67/12/10/1042671210.db2.gz XLKIFESXEAZPJE-ZDUSSCGKSA-N 1 2 319.474 4.122 20 0 DIADLO CCn1cnnc1C[NH2+][C@H](C)c1cc2c(ccc3ccccc23)o1 ZINC000271917197 1042672115 /nfs/dbraw/zinc/67/21/15/1042672115.db2.gz ZAZQFPXJLAVVGR-CYBMUJFWSA-N 1 2 320.396 4.048 20 0 DIADLO C[C@@H]([NH2+]C1(c2cccc(Br)c2)CC1)c1cscn1 ZINC000271944148 1042673051 /nfs/dbraw/zinc/67/30/51/1042673051.db2.gz ALVYLAZQFCEPIE-SNVBAGLBSA-N 1 2 323.259 4.246 20 0 DIADLO C[C@H]([NH2+]C1(c2ccccc2)CC1)c1ncc(Br)s1 ZINC000272029633 1042675643 /nfs/dbraw/zinc/67/56/43/1042675643.db2.gz TZNLEMZIHOFTOE-JTQLQIEISA-N 1 2 323.259 4.246 20 0 DIADLO Cc1cc([C@H]([NH2+][C@@H](C)c2nc(C(C)C)no2)C2CC2)ccc1F ZINC000272064361 1042676215 /nfs/dbraw/zinc/67/62/15/1042676215.db2.gz INZOFRKBOICJDU-BLLLJJGKSA-N 1 2 317.408 4.442 20 0 DIADLO Cc1cc([C@@H]([NH2+][C@H](C)c2nc(C3CC3)no2)C2CC2)ccc1F ZINC000272055858 1042676516 /nfs/dbraw/zinc/67/65/16/1042676516.db2.gz HBAIKCDZWVZBGR-BZNIZROVSA-N 1 2 315.392 4.196 20 0 DIADLO CC[C@](C)([NH2+]Cc1c(F)ccc(C)c1F)c1nc(C)cs1 ZINC001167949588 1042684455 /nfs/dbraw/zinc/68/44/55/1042684455.db2.gz NBDNTBDVNUVKRV-INIZCTEOSA-N 1 2 310.413 4.453 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ncc(Br)s1 ZINC000423211855 1042699640 /nfs/dbraw/zinc/69/96/40/1042699640.db2.gz HLFXQEFGVWNNII-MRVPVSSYSA-N 1 2 324.247 4.047 20 0 DIADLO COc1cc(C)c([C@@H](C)Nc2ccc3c(c2)CC[NH2+]3)cc1OC ZINC000423221746 1042700929 /nfs/dbraw/zinc/70/09/29/1042700929.db2.gz XXBKPZPBZHIEND-CYBMUJFWSA-N 1 2 312.413 4.153 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc(F)cc1OC(C)(C)C ZINC000424150743 1042726730 /nfs/dbraw/zinc/72/67/30/1042726730.db2.gz DUOKOYPVGIKAKW-UHFFFAOYSA-N 1 2 305.397 4.393 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccccc1N(C)C1CCCC1 ZINC000424152996 1042727508 /nfs/dbraw/zinc/72/75/08/1042727508.db2.gz KJNUCOOUOBMEIH-UHFFFAOYSA-N 1 2 312.461 4.455 20 0 DIADLO Cc1c(NCc2c[nH+]cn2C(C)C)cnn1-c1cc(C)ccc1C ZINC000424159726 1042728221 /nfs/dbraw/zinc/72/82/21/1042728221.db2.gz AJCABBSGWSGZQB-UHFFFAOYSA-N 1 2 323.444 4.187 20 0 DIADLO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1csc(C)n1 ZINC000424206423 1042729871 /nfs/dbraw/zinc/72/98/71/1042729871.db2.gz WGTKQJRPOWHVPP-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO CCCc1nc(C[N@H+](C)Cc2cc(C)c(OC)c(C)c2)cs1 ZINC000513961556 1042765146 /nfs/dbraw/zinc/76/51/46/1042765146.db2.gz GMSXNDNXGIUXKG-UHFFFAOYSA-N 1 2 318.486 4.353 20 0 DIADLO CCCc1nc(C[N@@H+](C)Cc2cc(C)c(OC)c(C)c2)cs1 ZINC000513961556 1042765148 /nfs/dbraw/zinc/76/51/48/1042765148.db2.gz GMSXNDNXGIUXKG-UHFFFAOYSA-N 1 2 318.486 4.353 20 0 DIADLO c1sc(Cc2ccccc2)nc1C[N@@H+]1CCc2ccccc2C1 ZINC000514068023 1042768498 /nfs/dbraw/zinc/76/84/98/1042768498.db2.gz AEGWMAWEALLGOC-UHFFFAOYSA-N 1 2 320.461 4.292 20 0 DIADLO c1sc(Cc2ccccc2)nc1C[N@H+]1CCc2ccccc2C1 ZINC000514068023 1042768501 /nfs/dbraw/zinc/76/85/01/1042768501.db2.gz AEGWMAWEALLGOC-UHFFFAOYSA-N 1 2 320.461 4.292 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2noc(-c3ccccc3)n2)cc1 ZINC000514235987 1042776326 /nfs/dbraw/zinc/77/63/26/1042776326.db2.gz LXSZWFMCWZKWHF-GOSISDBHSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2noc(-c3ccccc3)n2)cc1 ZINC000514235987 1042776329 /nfs/dbraw/zinc/77/63/29/1042776329.db2.gz LXSZWFMCWZKWHF-GOSISDBHSA-N 1 2 319.408 4.382 20 0 DIADLO FC(F)CC1C[NH+](Cc2cc(C(F)(F)F)ccc2Cl)C1 ZINC000425366978 1042798821 /nfs/dbraw/zinc/79/88/21/1042798821.db2.gz RBRHTKJKAZVMHQ-UHFFFAOYSA-N 1 2 313.697 4.446 20 0 DIADLO CC1(C)CCc2ccccc2[C@@H]([NH2+]Cc2nc(C(F)F)no2)C1 ZINC000425449966 1042825012 /nfs/dbraw/zinc/82/50/12/1042825012.db2.gz XRCHDGICBCCGRO-ZDUSSCGKSA-N 1 2 321.371 4.201 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2nc(C(F)F)no2)C(C)(C)C)c1 ZINC000425465006 1042828101 /nfs/dbraw/zinc/82/81/01/1042828101.db2.gz YQGZXOLPPMXEIK-CYBMUJFWSA-N 1 2 309.360 4.193 20 0 DIADLO CCCCc1noc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2C)n1 ZINC000515776158 1042833887 /nfs/dbraw/zinc/83/38/87/1042833887.db2.gz NBCGWBABGHGWAG-HNNXBMFYSA-N 1 2 301.434 4.222 20 0 DIADLO CCCCc1noc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2C)n1 ZINC000515776158 1042833891 /nfs/dbraw/zinc/83/38/91/1042833891.db2.gz NBCGWBABGHGWAG-HNNXBMFYSA-N 1 2 301.434 4.222 20 0 DIADLO CCCCc1noc(C[N@H+](C)[C@H](C)c2ccc(C)cc2C)n1 ZINC000515776159 1042834587 /nfs/dbraw/zinc/83/45/87/1042834587.db2.gz NBCGWBABGHGWAG-OAHLLOKOSA-N 1 2 301.434 4.222 20 0 DIADLO CCCCc1noc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2C)n1 ZINC000515776159 1042834592 /nfs/dbraw/zinc/83/45/92/1042834592.db2.gz NBCGWBABGHGWAG-OAHLLOKOSA-N 1 2 301.434 4.222 20 0 DIADLO Brc1cccc2c3c([nH]c21)CC[N@H+](C1CCCC1)C3 ZINC001167960879 1042840447 /nfs/dbraw/zinc/84/04/47/1042840447.db2.gz YCEPXNYLYBNOEP-UHFFFAOYSA-N 1 2 319.246 4.231 20 0 DIADLO Brc1cccc2c3c([nH]c21)CC[N@@H+](C1CCCC1)C3 ZINC001167960879 1042840451 /nfs/dbraw/zinc/84/04/51/1042840451.db2.gz YCEPXNYLYBNOEP-UHFFFAOYSA-N 1 2 319.246 4.231 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@H](C)c2cccs2)c(C)[nH+]1 ZINC000436491809 1042840481 /nfs/dbraw/zinc/84/04/81/1042840481.db2.gz IHXBKQCJIKTMCS-CYBMUJFWSA-N 1 2 303.431 4.293 20 0 DIADLO CC(C)c1cc(N2CCC(c3ccon3)CC2)nc(C(C)C)[nH+]1 ZINC000664566401 1042840882 /nfs/dbraw/zinc/84/08/82/1042840882.db2.gz LGNHUENUEIIGIR-UHFFFAOYSA-N 1 2 314.433 4.095 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(F)ccc2Br)CCC1(F)F ZINC000516688323 1042851655 /nfs/dbraw/zinc/85/16/55/1042851655.db2.gz BBAJWHZWTHDDFN-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(F)ccc2Br)CCC1(F)F ZINC000516688323 1042851659 /nfs/dbraw/zinc/85/16/59/1042851659.db2.gz BBAJWHZWTHDDFN-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO CCCCCNC(=O)C[N@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000517125183 1042869071 /nfs/dbraw/zinc/86/90/71/1042869071.db2.gz JSOUTCOWODAHNF-CQSZACIVSA-N 1 2 322.880 4.172 20 0 DIADLO CCCCCNC(=O)C[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000517125183 1042869078 /nfs/dbraw/zinc/86/90/78/1042869078.db2.gz JSOUTCOWODAHNF-CQSZACIVSA-N 1 2 322.880 4.172 20 0 DIADLO CC[N@H+](Cc1nc(CC(C)C)no1)Cc1ccc2ccccc2c1 ZINC000517771734 1042896754 /nfs/dbraw/zinc/89/67/54/1042896754.db2.gz AYVDYNVOHNZPGF-UHFFFAOYSA-N 1 2 323.440 4.443 20 0 DIADLO CC[N@@H+](Cc1nc(CC(C)C)no1)Cc1ccc2ccccc2c1 ZINC000517771734 1042896759 /nfs/dbraw/zinc/89/67/59/1042896759.db2.gz AYVDYNVOHNZPGF-UHFFFAOYSA-N 1 2 323.440 4.443 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H]2CCCc3c(Cl)ccnc32)cs1 ZINC000925033669 1042900134 /nfs/dbraw/zinc/90/01/34/1042900134.db2.gz NASLTWGGXSMGFV-GWCFXTLKSA-N 1 2 321.877 4.482 20 0 DIADLO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]Cc1cccc(O)c1Cl ZINC000293373694 1042901349 /nfs/dbraw/zinc/90/13/49/1042901349.db2.gz VMAAZDYNUFCWLQ-NSHDSACASA-N 1 2 321.852 4.156 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+][C@@H]2COCc3cccc(Cl)c32)cn1 ZINC000925045874 1042913812 /nfs/dbraw/zinc/91/38/12/1042913812.db2.gz NGCHDSHEIUHJGD-BLLLJJGKSA-N 1 2 319.836 4.040 20 0 DIADLO COc1ccc2c(c1)C[N@H+]([C@@H](C)c1cc(F)ccc1F)CC2 ZINC000519214544 1042938687 /nfs/dbraw/zinc/93/86/87/1042938687.db2.gz MLDLLCSYZLPNKO-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc2c(c1)C[N@@H+]([C@@H](C)c1cc(F)ccc1F)CC2 ZINC000519214544 1042938693 /nfs/dbraw/zinc/93/86/93/1042938693.db2.gz MLDLLCSYZLPNKO-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+](C)Cc1cccc(F)c1 ZINC000120982909 1042942469 /nfs/dbraw/zinc/94/24/69/1042942469.db2.gz LUEDQTGGCAOJHC-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+](C)Cc1cccc(F)c1 ZINC000120982909 1042942474 /nfs/dbraw/zinc/94/24/74/1042942474.db2.gz LUEDQTGGCAOJHC-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO CC[C@]1(C)C[N@H+](Cc2cnc(C3CCCCC3)s2)CCO1 ZINC000519295659 1042943452 /nfs/dbraw/zinc/94/34/52/1042943452.db2.gz YVOARTSLBJNDGI-QGZVFWFLSA-N 1 2 308.491 4.192 20 0 DIADLO CC[C@]1(C)C[N@@H+](Cc2cnc(C3CCCCC3)s2)CCO1 ZINC000519295659 1042943458 /nfs/dbraw/zinc/94/34/58/1042943458.db2.gz YVOARTSLBJNDGI-QGZVFWFLSA-N 1 2 308.491 4.192 20 0 DIADLO Fc1cccc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)c1F ZINC000073621079 1042951604 /nfs/dbraw/zinc/95/16/04/1042951604.db2.gz MGUOVCAXWHFECM-IBGZPJMESA-N 1 2 310.347 4.239 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[NH2+]Cc1noc2c1CCCC2 ZINC000894520045 1042964373 /nfs/dbraw/zinc/96/43/73/1042964373.db2.gz GDTQHZOYWYTXPX-UHFFFAOYSA-N 1 2 302.418 4.042 20 0 DIADLO Fc1ccccc1C[NH2+][C@@H]1COc2c1ccc(Cl)c2Cl ZINC000608065988 1042977233 /nfs/dbraw/zinc/97/72/33/1042977233.db2.gz QFTSPLYSSZIWCC-CYBMUJFWSA-N 1 2 312.171 4.356 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCc3c(C)cccc3C2)cs1 ZINC000729479966 1042999572 /nfs/dbraw/zinc/99/95/72/1042999572.db2.gz KXJNIHDHCPQLRM-UHFFFAOYSA-N 1 2 300.471 4.352 20 0 DIADLO CCCCc1nc(C[N@H+]2CCc3c(C)cccc3C2)cs1 ZINC000729479966 1042999576 /nfs/dbraw/zinc/99/95/76/1042999576.db2.gz KXJNIHDHCPQLRM-UHFFFAOYSA-N 1 2 300.471 4.352 20 0 DIADLO Cc1nccnc1[C@H](C)[NH2+][C@H](c1ccccc1)c1cccc(F)c1 ZINC000188136620 1043014800 /nfs/dbraw/zinc/01/48/00/1043014800.db2.gz NRKYNQGXQKETCM-MGPUTAFESA-N 1 2 321.399 4.364 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+](C)Cc3ccc(F)cc3)o2)cc1 ZINC000441201227 1043026717 /nfs/dbraw/zinc/02/67/17/1043026717.db2.gz QIGGMYKWNYHZOA-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+](C)Cc3ccc(F)cc3)o2)cc1 ZINC000441201227 1043026723 /nfs/dbraw/zinc/02/67/23/1043026723.db2.gz QIGGMYKWNYHZOA-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO CC[N@@H+](Cc1ccn(-c2ccc(F)cc2)n1)Cc1cccs1 ZINC000441245241 1043030055 /nfs/dbraw/zinc/03/00/55/1043030055.db2.gz LYNVIJBPPKYRJN-UHFFFAOYSA-N 1 2 315.417 4.095 20 0 DIADLO CC[N@H+](Cc1ccn(-c2ccc(F)cc2)n1)Cc1cccs1 ZINC000441245241 1043030060 /nfs/dbraw/zinc/03/00/60/1043030060.db2.gz LYNVIJBPPKYRJN-UHFFFAOYSA-N 1 2 315.417 4.095 20 0 DIADLO C[C@@H](CCC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000441323130 1043036121 /nfs/dbraw/zinc/03/61/21/1043036121.db2.gz MHKMIOWFVHEKBY-INIZCTEOSA-N 1 2 319.408 4.395 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2cn3ccsc3n2)C1 ZINC000441329021 1043037239 /nfs/dbraw/zinc/03/72/39/1043037239.db2.gz DODCSTJETVXQKY-MLGOLLRUSA-N 1 2 315.417 4.118 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2cn3ccsc3n2)C1 ZINC000441329021 1043037242 /nfs/dbraw/zinc/03/72/42/1043037242.db2.gz DODCSTJETVXQKY-MLGOLLRUSA-N 1 2 315.417 4.118 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000520383640 1043040994 /nfs/dbraw/zinc/04/09/94/1043040994.db2.gz JKVNLWULWLKAAN-LPMFXHHGSA-N 1 2 317.379 4.488 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000520383640 1043040999 /nfs/dbraw/zinc/04/09/99/1043040999.db2.gz JKVNLWULWLKAAN-LPMFXHHGSA-N 1 2 317.379 4.488 20 0 DIADLO CC(C)CCc1noc(C[N@H+](C)[C@H]2CCCc3ccccc32)n1 ZINC000520386910 1043041429 /nfs/dbraw/zinc/04/14/29/1043041429.db2.gz IWDFIJRVBORUKM-KRWDZBQOSA-N 1 2 313.445 4.168 20 0 DIADLO CC(C)CCc1noc(C[N@@H+](C)[C@H]2CCCc3ccccc32)n1 ZINC000520386910 1043041434 /nfs/dbraw/zinc/04/14/34/1043041434.db2.gz IWDFIJRVBORUKM-KRWDZBQOSA-N 1 2 313.445 4.168 20 0 DIADLO CC(C)c1nc(C[NH2+]C2(c3ccc(F)cc3)CC2)c2ccccn21 ZINC000520414912 1043045892 /nfs/dbraw/zinc/04/58/92/1043045892.db2.gz AJSGVCCHNCGUII-UHFFFAOYSA-N 1 2 323.415 4.376 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000174962745 1043072102 /nfs/dbraw/zinc/07/21/02/1043072102.db2.gz OBUGXXGYVXDWFK-JTQLQIEISA-N 1 2 300.349 4.355 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000174962745 1043072113 /nfs/dbraw/zinc/07/21/13/1043072113.db2.gz OBUGXXGYVXDWFK-JTQLQIEISA-N 1 2 300.349 4.355 20 0 DIADLO C[C@H](c1ccc(OC(F)(F)F)cc1)[N@H+](C)Cc1nccs1 ZINC000175048226 1043075861 /nfs/dbraw/zinc/07/58/61/1043075861.db2.gz SIBHKXDLKCODOO-SNVBAGLBSA-N 1 2 316.348 4.235 20 0 DIADLO C[C@H](c1ccc(OC(F)(F)F)cc1)[N@@H+](C)Cc1nccs1 ZINC000175048226 1043075875 /nfs/dbraw/zinc/07/58/75/1043075875.db2.gz SIBHKXDLKCODOO-SNVBAGLBSA-N 1 2 316.348 4.235 20 0 DIADLO c1cn(-c2ccc(CSCc3coc(C4CC4)n3)cc2)c[nH+]1 ZINC000865281705 1043077081 /nfs/dbraw/zinc/07/70/81/1043077081.db2.gz WOILPELQRSTWOJ-UHFFFAOYSA-N 1 2 311.410 4.171 20 0 DIADLO CN(C)C(=O)Sc1ccc(Cn2c[nH+]c(C(C)(C)C)c2)cc1 ZINC000865375316 1043089149 /nfs/dbraw/zinc/08/91/49/1043089149.db2.gz IMSYVBNWSIVPCU-UHFFFAOYSA-N 1 2 317.458 4.003 20 0 DIADLO CC[C@@H](c1ccccc1)[S@@](=O)Cc1cn2cccc(C)c2[nH+]1 ZINC000176517348 1043096290 /nfs/dbraw/zinc/09/62/90/1043096290.db2.gz KXXCSAHETIDZIL-JTSKRJEESA-N 1 2 312.438 4.043 20 0 DIADLO CC(C)O[C@@H](COc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000427568082 1043096655 /nfs/dbraw/zinc/09/66/55/1043096655.db2.gz CQZBUNGCIIILKU-FQEVSTJZSA-N 1 2 322.408 4.417 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2cn(C3CC3)cn2)c2ccccc2)cc1 ZINC000865432131 1043097738 /nfs/dbraw/zinc/09/77/38/1043097738.db2.gz PXUPNGUSWVFQIC-HXUWFJFHSA-N 1 2 321.399 4.236 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2ccc(OC(F)F)cc2F)n1 ZINC000865446502 1043100172 /nfs/dbraw/zinc/10/01/72/1043100172.db2.gz VSIZIISQVSHLIG-VIFPVBQESA-N 1 2 316.348 4.043 20 0 DIADLO C[C@@H]([NH2+]Cc1cn(C2CC2)cn1)c1cccc(Cl)c1Cl ZINC000865468981 1043102925 /nfs/dbraw/zinc/10/29/25/1043102925.db2.gz HFJWIVOGPPKZAQ-SNVBAGLBSA-N 1 2 310.228 4.376 20 0 DIADLO CC(C)(C)[C@H]([NH2+]Cc1cn(C2CC2)cn1)c1ccc(F)cc1F ZINC000865491003 1043104505 /nfs/dbraw/zinc/10/45/05/1043104505.db2.gz JIEYZMXOOUUDTK-QGZVFWFLSA-N 1 2 319.399 4.373 20 0 DIADLO CCC[C@@H]([NH2+]Cc1cn(C2CC2)cn1)c1ccc(F)cc1F ZINC000865492384 1043104914 /nfs/dbraw/zinc/10/49/14/1043104914.db2.gz XRSILCXKQYNMSU-QGZVFWFLSA-N 1 2 305.372 4.127 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1nc(C)c(C)s1)CCC2 ZINC000177895199 1043115505 /nfs/dbraw/zinc/11/55/05/1043115505.db2.gz NPBVQUKAUUTTSK-CYBMUJFWSA-N 1 2 321.515 4.288 20 0 DIADLO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1nc(C)c(C)s1)CCC2 ZINC000177895199 1043115514 /nfs/dbraw/zinc/11/55/14/1043115514.db2.gz NPBVQUKAUUTTSK-CYBMUJFWSA-N 1 2 321.515 4.288 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)c1cnccn1 ZINC000178053284 1043119377 /nfs/dbraw/zinc/11/93/77/1043119377.db2.gz HCNWMGSSFNPNRU-IUCAKERBSA-N 1 2 314.191 4.334 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3ncc(C4CC4)o3)CC2)cc1 ZINC000536349435 1043140458 /nfs/dbraw/zinc/14/04/58/1043140458.db2.gz WONSPHLLBSILHE-UHFFFAOYSA-N 1 2 314.816 4.495 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3ncc(C4CC4)o3)CC2)cc1 ZINC000536349435 1043140463 /nfs/dbraw/zinc/14/04/63/1043140463.db2.gz WONSPHLLBSILHE-UHFFFAOYSA-N 1 2 314.816 4.495 20 0 DIADLO Cc1ccc(F)cc1C[N@H+](Cc1ccco1)Cc1cccnc1 ZINC000189314390 1043145633 /nfs/dbraw/zinc/14/56/33/1043145633.db2.gz VQPMDVOKILGFCH-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1ccc(F)cc1C[N@@H+](Cc1ccco1)Cc1cccnc1 ZINC000189314390 1043145641 /nfs/dbraw/zinc/14/56/41/1043145641.db2.gz VQPMDVOKILGFCH-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]C2(c3cccc(Cl)c3)CC2)cs1 ZINC000179671677 1043148507 /nfs/dbraw/zinc/14/85/07/1043148507.db2.gz VIAKBWZSEMMWRC-NSHDSACASA-N 1 2 322.861 4.283 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3nc(C(F)(F)F)cs3)CC2)c1 ZINC000179702145 1043151025 /nfs/dbraw/zinc/15/10/25/1043151025.db2.gz ILIRQMXPHAOWON-UHFFFAOYSA-N 1 2 316.323 4.080 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2cc(F)ccc2Cl)C2CC2)s1 ZINC000189437511 1043151784 /nfs/dbraw/zinc/15/17/84/1043151784.db2.gz VQODMGOJZARHNV-AWEZNQCLSA-N 1 2 310.825 4.485 20 0 DIADLO CCCCCOc1ccc([C@@H](C)[NH2+]Cc2ccon2)cc1OC ZINC000179785035 1043151875 /nfs/dbraw/zinc/15/18/75/1043151875.db2.gz YCDBBHIFSPDVKT-CQSZACIVSA-N 1 2 318.417 4.103 20 0 DIADLO Cc1cncc(C[N@@H+](C)[C@@H](C)c2ccccc2Br)c1 ZINC000189811310 1043165552 /nfs/dbraw/zinc/16/55/52/1043165552.db2.gz UFFSGOQXYBODRA-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cncc(C[N@H+](C)[C@@H](C)c2ccccc2Br)c1 ZINC000189811310 1043165556 /nfs/dbraw/zinc/16/55/56/1043165556.db2.gz UFFSGOQXYBODRA-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)s1 ZINC000866335828 1043182406 /nfs/dbraw/zinc/18/24/06/1043182406.db2.gz AXYSVUZWXSEICG-JGVFFNPUSA-N 1 2 322.821 4.053 20 0 DIADLO CCC[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1cc(C)ccn1 ZINC000866362163 1043188421 /nfs/dbraw/zinc/18/84/21/1043188421.db2.gz AYXGDPPDLFRGLX-INIZCTEOSA-N 1 2 308.347 4.438 20 0 DIADLO CCc1nc(C[NH2+][C@H](CCc2ccccc2)c2ccccn2)co1 ZINC000866370742 1043191790 /nfs/dbraw/zinc/19/17/90/1043191790.db2.gz BWPNBIKRAWMTLB-LJQANCHMSA-N 1 2 321.424 4.096 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cc(-c3ccc(C)cc3)no2)s1 ZINC000184983209 1043193288 /nfs/dbraw/zinc/19/32/88/1043193288.db2.gz IBYPHEMBCLNRHN-CYBMUJFWSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc2c(ccnc2Cl)o1)c1cscn1 ZINC000866388499 1043194287 /nfs/dbraw/zinc/19/42/87/1043194287.db2.gz KCENOMOSWQLGDP-BDAKNGLRSA-N 1 2 307.806 4.350 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2cc3c(ccnc3Cl)o2)c1 ZINC000866385616 1043194746 /nfs/dbraw/zinc/19/47/46/1043194746.db2.gz YBYNKSRWISBOKM-JTQLQIEISA-N 1 2 317.776 4.196 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc2c(ccnc2Cl)o1)c1cscn1 ZINC000866388504 1043195357 /nfs/dbraw/zinc/19/53/57/1043195357.db2.gz KCENOMOSWQLGDP-RKDXNWHRSA-N 1 2 307.806 4.350 20 0 DIADLO CC(C)([NH2+]Cc1nccn1C(F)F)c1cccc(Cl)c1F ZINC000185848463 1043208470 /nfs/dbraw/zinc/20/84/70/1043208470.db2.gz LSUBUNXGVZNOKK-UHFFFAOYSA-N 1 2 317.742 4.096 20 0 DIADLO COc1ccsc1[C@H](C)[NH2+][C@@H](COCC(C)C)c1ccco1 ZINC000186145056 1043214570 /nfs/dbraw/zinc/21/45/70/1043214570.db2.gz KZUIQHIOZRKUKG-KBPBESRZSA-N 1 2 323.458 4.414 20 0 DIADLO C[C@H]([NH2+]Cc1nn(C)cc1C(F)F)c1ccc(F)cc1Cl ZINC000866563705 1043223279 /nfs/dbraw/zinc/22/32/79/1043223279.db2.gz PQNRQWACOWYAIG-QMMMGPOBSA-N 1 2 317.742 4.001 20 0 DIADLO CC(C)CCOc1ccc(NC(=O)c2cccc3[nH+]ccn32)cc1 ZINC001126511873 1043224317 /nfs/dbraw/zinc/22/43/17/1043224317.db2.gz DRTGBOIAZRKJHG-UHFFFAOYSA-N 1 2 323.396 4.012 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2cc(Cl)cc(Cl)c2F)nn1C ZINC000866578848 1043229467 /nfs/dbraw/zinc/22/94/67/1043229467.db2.gz UAUKPBFUVQTSDN-VIFPVBQESA-N 1 2 316.207 4.025 20 0 DIADLO C[C@@H]([NH2+][C@@H](CCO)c1ccco1)c1cc(Cl)ccc1Cl ZINC000186558219 1043229384 /nfs/dbraw/zinc/22/93/84/1043229384.db2.gz GVKMGOKNPWHBSJ-YGRLFVJLSA-N 1 2 314.212 4.361 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nc2ccccc2[nH]1)C1CCCCC1)c1ncc[nH]1 ZINC000866613520 1043236229 /nfs/dbraw/zinc/23/62/29/1043236229.db2.gz BXQLWZGBZJHFTL-CXAGYDPISA-N 1 2 323.444 4.258 20 0 DIADLO O=C(Nc1ccsc1Cl)[C@@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000186928065 1043237540 /nfs/dbraw/zinc/23/75/40/1043237540.db2.gz NYUYMRWPRDCQLU-AWEZNQCLSA-N 1 2 320.845 4.005 20 0 DIADLO O=C(Nc1ccsc1Cl)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000186928065 1043237547 /nfs/dbraw/zinc/23/75/47/1043237547.db2.gz NYUYMRWPRDCQLU-AWEZNQCLSA-N 1 2 320.845 4.005 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000520630614 1043243781 /nfs/dbraw/zinc/24/37/81/1043243781.db2.gz NUGUQDOBNZUKOQ-HXUWFJFHSA-N 1 2 311.425 4.047 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000520630614 1043243785 /nfs/dbraw/zinc/24/37/85/1043243785.db2.gz NUGUQDOBNZUKOQ-HXUWFJFHSA-N 1 2 311.425 4.047 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000520630613 1043244104 /nfs/dbraw/zinc/24/41/04/1043244104.db2.gz NUGUQDOBNZUKOQ-FQEVSTJZSA-N 1 2 311.425 4.047 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000520630613 1043244110 /nfs/dbraw/zinc/24/41/10/1043244110.db2.gz NUGUQDOBNZUKOQ-FQEVSTJZSA-N 1 2 311.425 4.047 20 0 DIADLO Fc1ccc([C@@H]([NH2+][C@H]2CCCc3ccccc32)c2ncc[nH]2)cc1 ZINC000187677904 1043249338 /nfs/dbraw/zinc/24/93/38/1043249338.db2.gz SXFIJPTYZJCURZ-RBUKOAKNSA-N 1 2 321.399 4.305 20 0 DIADLO CCC[NH+](CCC)Cn1nc(-c2ccc(F)cc2)oc1=S ZINC000867481313 1043252362 /nfs/dbraw/zinc/25/23/62/1043252362.db2.gz PRBLKNZBPRYKCZ-UHFFFAOYSA-N 1 2 309.410 4.091 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Oc1ccc(Cl)c2ccccc12 ZINC000121652271 1043253525 /nfs/dbraw/zinc/25/35/25/1043253525.db2.gz IPMNIEZYMSQCMI-UHFFFAOYSA-N 1 2 314.772 4.076 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1ccccc1Cl ZINC000680040803 1043253641 /nfs/dbraw/zinc/25/36/41/1043253641.db2.gz AVQMLRIPINVYIS-LKFCYVNXSA-N 1 2 309.743 4.403 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cc(Cl)cs1)c1nc(C2CC2)no1 ZINC000193103797 1043279658 /nfs/dbraw/zinc/27/96/58/1043279658.db2.gz WZSRXQDLNWKFTD-LBPRGKRZSA-N 1 2 311.838 4.149 20 0 DIADLO Cc1ccc(Nc2ccn3cc[nH+]c3c2)c(Br)c1 ZINC001204977400 1043281153 /nfs/dbraw/zinc/28/11/53/1043281153.db2.gz GJQTUIMRNGBVTG-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO CC(C)(C)Oc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cn1 ZINC000665212171 1043285456 /nfs/dbraw/zinc/28/54/56/1043285456.db2.gz RNTDJXZGKMRFJF-UHFFFAOYSA-N 1 2 307.397 4.171 20 0 DIADLO C[C@@H](Nc1cccc(C[N@H+](C)Cc2cscn2)c1)C1CCC1 ZINC000195099627 1043297386 /nfs/dbraw/zinc/29/73/86/1043297386.db2.gz PGLNORULTOJBCP-CQSZACIVSA-N 1 2 315.486 4.376 20 0 DIADLO C[C@@H](Nc1cccc(C[N@@H+](C)Cc2cscn2)c1)C1CCC1 ZINC000195099627 1043297393 /nfs/dbraw/zinc/29/73/93/1043297393.db2.gz PGLNORULTOJBCP-CQSZACIVSA-N 1 2 315.486 4.376 20 0 DIADLO C[C@H](Nc1cccc(C[N@H+](C)Cc2cscn2)c1)C1CCC1 ZINC000195099616 1043297416 /nfs/dbraw/zinc/29/74/16/1043297416.db2.gz PGLNORULTOJBCP-AWEZNQCLSA-N 1 2 315.486 4.376 20 0 DIADLO C[C@H](Nc1cccc(C[N@@H+](C)Cc2cscn2)c1)C1CCC1 ZINC000195099616 1043297420 /nfs/dbraw/zinc/29/74/20/1043297420.db2.gz PGLNORULTOJBCP-AWEZNQCLSA-N 1 2 315.486 4.376 20 0 DIADLO Cc1ccc(C[NH2+]Cc2cc(COC(C)(C)C)on2)cc1Cl ZINC000195450613 1043298973 /nfs/dbraw/zinc/29/89/73/1043298973.db2.gz FLSOEQKSVGATDS-UHFFFAOYSA-N 1 2 322.836 4.241 20 0 DIADLO COc1cccc(C[N@@H+](C)[C@@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000267014081 1043303436 /nfs/dbraw/zinc/30/34/36/1043303436.db2.gz NZNNGURVFOGJTP-ZDUSSCGKSA-N 1 2 302.418 4.174 20 0 DIADLO COc1cccc(C[N@H+](C)[C@@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000267014081 1043303417 /nfs/dbraw/zinc/30/34/17/1043303417.db2.gz NZNNGURVFOGJTP-ZDUSSCGKSA-N 1 2 302.418 4.174 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cccc(Cl)c3F)CCC2)n1 ZINC000268380807 1043319599 /nfs/dbraw/zinc/31/95/99/1043319599.db2.gz UUCWNENPSKERBR-UHFFFAOYSA-N 1 2 310.825 4.413 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccn(C3CCCC3)n2)s1 ZINC000268735647 1043327966 /nfs/dbraw/zinc/32/79/66/1043327966.db2.gz YEEQOGSHWKVCLC-CYBMUJFWSA-N 1 2 318.490 4.265 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccn(C3CCCC3)n2)s1 ZINC000268735647 1043327974 /nfs/dbraw/zinc/32/79/74/1043327974.db2.gz YEEQOGSHWKVCLC-CYBMUJFWSA-N 1 2 318.490 4.265 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H]2CCCc3occc32)c2ccccn21 ZINC000520822179 1043332244 /nfs/dbraw/zinc/33/22/44/1043332244.db2.gz FJWIHGJKPNPQIF-HNNXBMFYSA-N 1 2 309.413 4.218 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H]2CCCc3occc32)c2ccccn21 ZINC000520822180 1043332616 /nfs/dbraw/zinc/33/26/16/1043332616.db2.gz FJWIHGJKPNPQIF-OAHLLOKOSA-N 1 2 309.413 4.218 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2nnc(C(C)(C)C)o2)C(C)C)s1 ZINC000067461422 1043333700 /nfs/dbraw/zinc/33/37/00/1043333700.db2.gz DDKCNAGLKPAQJG-UHFFFAOYSA-N 1 2 307.463 4.148 20 0 DIADLO Cc1ccc(C[N@H+](Cc2nnc(C(C)(C)C)o2)C(C)C)s1 ZINC000067461422 1043333705 /nfs/dbraw/zinc/33/37/05/1043333705.db2.gz DDKCNAGLKPAQJG-UHFFFAOYSA-N 1 2 307.463 4.148 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H]2CCSc3ccccc32)cs1 ZINC000269025926 1043352366 /nfs/dbraw/zinc/35/23/66/1043352366.db2.gz COISBQXRHKHINM-RISCZKNCSA-N 1 2 320.483 4.177 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](CC(C)C)c2ccccn2)cs1 ZINC000269040170 1043353385 /nfs/dbraw/zinc/35/33/85/1043353385.db2.gz GIACGQLSKQUHAJ-CZUORRHYSA-N 1 2 319.474 4.123 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccnc(OC3CCCC3)c2)cs1 ZINC000269388385 1043363363 /nfs/dbraw/zinc/36/33/63/1043363363.db2.gz BUOYFQCAYLDESW-LBPRGKRZSA-N 1 2 317.458 4.019 20 0 DIADLO Brc1csc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c1 ZINC000346988055 1043399978 /nfs/dbraw/zinc/39/99/78/1043399978.db2.gz QYRKFTIRAXQTLP-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1csc(C[N@H+]2CCC[C@@H]2c2cccnc2)c1 ZINC000346988055 1043399985 /nfs/dbraw/zinc/39/99/85/1043399985.db2.gz QYRKFTIRAXQTLP-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO C[N@H+](Cc1nc(C(F)(F)F)cs1)[C@H]1C[C@@H]1c1ccccc1 ZINC000269755771 1043372958 /nfs/dbraw/zinc/37/29/58/1043372958.db2.gz GSISLYPSLVMWIA-NEPJUHHUSA-N 1 2 312.360 4.150 20 0 DIADLO C[N@@H+](Cc1nc(C(F)(F)F)cs1)[C@H]1C[C@@H]1c1ccccc1 ZINC000269755771 1043372966 /nfs/dbraw/zinc/37/29/66/1043372966.db2.gz GSISLYPSLVMWIA-NEPJUHHUSA-N 1 2 312.360 4.150 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccc(OC(F)F)c(F)c2)cs1 ZINC000269959829 1043377402 /nfs/dbraw/zinc/37/74/02/1043377402.db2.gz IVRSBNMWYZVDMB-QMMMGPOBSA-N 1 2 316.348 4.043 20 0 DIADLO Cc1oc2ccccc2c1C[NH2+]Cc1nnc(C(C)(C)C)s1 ZINC000270218798 1043382545 /nfs/dbraw/zinc/38/25/45/1043382545.db2.gz GZMSFIGCQDFSMN-UHFFFAOYSA-N 1 2 315.442 4.180 20 0 DIADLO CCCCCC(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000270483209 1043389217 /nfs/dbraw/zinc/38/92/17/1043389217.db2.gz OIRWFSANSKDRIF-UHFFFAOYSA-N 1 2 309.413 4.121 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2cccc(F)c2)c2ccccn2)c(C)o1 ZINC000123751702 1043389409 /nfs/dbraw/zinc/38/94/09/1043389409.db2.gz AYRWNQLHYUCMGF-IBGZPJMESA-N 1 2 310.372 4.310 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ncc(C3CC3)o2)[C@H]1c1cccc(F)c1 ZINC000270648517 1043393920 /nfs/dbraw/zinc/39/39/20/1043393920.db2.gz SXCCSVRPZMGKMX-KZULUSFZSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ncc(C3CC3)o2)[C@H]1c1cccc(F)c1 ZINC000270648517 1043393930 /nfs/dbraw/zinc/39/39/30/1043393930.db2.gz SXCCSVRPZMGKMX-KZULUSFZSA-N 1 2 300.377 4.274 20 0 DIADLO CC(C)n1ccnc1C[N@H+](Cc1ccoc1)C1CCCCC1 ZINC000357747919 1043394751 /nfs/dbraw/zinc/39/47/51/1043394751.db2.gz RECPPBPLKCFMMR-UHFFFAOYSA-N 1 2 301.434 4.392 20 0 DIADLO CC(C)n1ccnc1C[N@@H+](Cc1ccoc1)C1CCCCC1 ZINC000357747919 1043394758 /nfs/dbraw/zinc/39/47/58/1043394758.db2.gz RECPPBPLKCFMMR-UHFFFAOYSA-N 1 2 301.434 4.392 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1)[C@@H](C)c1nc(C2CC2)no1 ZINC000270818509 1043396519 /nfs/dbraw/zinc/39/65/19/1043396519.db2.gz YBFBAHJSODXNRJ-NSHDSACASA-N 1 2 305.809 4.184 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)cc1)[C@@H](C)c1nc(C2CC2)no1 ZINC000270818509 1043396527 /nfs/dbraw/zinc/39/65/27/1043396527.db2.gz YBFBAHJSODXNRJ-NSHDSACASA-N 1 2 305.809 4.184 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1)[C@H](C)c1nc(C2CC2)no1 ZINC000270818506 1043397417 /nfs/dbraw/zinc/39/74/17/1043397417.db2.gz YBFBAHJSODXNRJ-LLVKDONJSA-N 1 2 305.809 4.184 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)cc1)[C@H](C)c1nc(C2CC2)no1 ZINC000270818506 1043397422 /nfs/dbraw/zinc/39/74/22/1043397422.db2.gz YBFBAHJSODXNRJ-LLVKDONJSA-N 1 2 305.809 4.184 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1nc2ccc(Cl)cc2n1C ZINC000271056645 1043398253 /nfs/dbraw/zinc/39/82/53/1043398253.db2.gz UHVUOZQTKOLVBM-LLVKDONJSA-N 1 2 303.793 4.013 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1nc2ccc(Cl)cc2n1C ZINC000271056645 1043398262 /nfs/dbraw/zinc/39/82/62/1043398262.db2.gz UHVUOZQTKOLVBM-LLVKDONJSA-N 1 2 303.793 4.013 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1nc2ccc(Cl)cc2n1C ZINC000271056648 1043398387 /nfs/dbraw/zinc/39/83/87/1043398387.db2.gz UHVUOZQTKOLVBM-NSHDSACASA-N 1 2 303.793 4.013 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1nc2ccc(Cl)cc2n1C ZINC000271056648 1043398392 /nfs/dbraw/zinc/39/83/92/1043398392.db2.gz UHVUOZQTKOLVBM-NSHDSACASA-N 1 2 303.793 4.013 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cnc([C@H]2CCCO2)s1 ZINC000271051796 1043400158 /nfs/dbraw/zinc/40/01/58/1043400158.db2.gz PUAAIAPVSUWDMC-MLGOLLRUSA-N 1 2 320.433 4.327 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cnc([C@H]2CCCO2)s1 ZINC000271051796 1043400164 /nfs/dbraw/zinc/40/01/64/1043400164.db2.gz PUAAIAPVSUWDMC-MLGOLLRUSA-N 1 2 320.433 4.327 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccccc2)oc1C)Cc1ccncc1 ZINC000271020708 1043400393 /nfs/dbraw/zinc/40/03/93/1043400393.db2.gz NTPUGRCBDVZSLN-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccccc2)oc1C)Cc1ccncc1 ZINC000271020708 1043400403 /nfs/dbraw/zinc/40/04/03/1043400403.db2.gz NTPUGRCBDVZSLN-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO C[C@H](c1ccco1)[N@H+](Cc1cnc([C@@H]2CCCO2)s1)C1CC1 ZINC000271153404 1043405452 /nfs/dbraw/zinc/40/54/52/1043405452.db2.gz UZLCZMRSOCAZFC-WBMJQRKESA-N 1 2 318.442 4.313 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](Cc1cnc([C@@H]2CCCO2)s1)C1CC1 ZINC000271153404 1043405460 /nfs/dbraw/zinc/40/54/60/1043405460.db2.gz UZLCZMRSOCAZFC-WBMJQRKESA-N 1 2 318.442 4.313 20 0 DIADLO CC(C)c1nc([C@H]2CCC[N@@H+]2Cc2cccc3cc[nH]c32)no1 ZINC000271199094 1043406409 /nfs/dbraw/zinc/40/64/09/1043406409.db2.gz VQMPWCXVEGISDZ-OAHLLOKOSA-N 1 2 310.401 4.011 20 0 DIADLO CC(C)c1nc([C@H]2CCC[N@H+]2Cc2cccc3cc[nH]c32)no1 ZINC000271199094 1043406420 /nfs/dbraw/zinc/40/64/20/1043406420.db2.gz VQMPWCXVEGISDZ-OAHLLOKOSA-N 1 2 310.401 4.011 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000925270122 1043406518 /nfs/dbraw/zinc/40/65/18/1043406518.db2.gz RRFBQEZDVCFLCF-HZPDHXFCSA-N 1 2 324.424 4.397 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(OCC2CC2)c(F)c1)c1cscn1 ZINC000271195489 1043406467 /nfs/dbraw/zinc/40/64/67/1043406467.db2.gz YIKZOAQSVPQONO-VXGBXAGGSA-N 1 2 320.433 4.483 20 0 DIADLO CC(C)[C@@H]([NH2+][C@@H](C)c1cscn1)c1nc2ccccc2[nH]1 ZINC000271191000 1043408191 /nfs/dbraw/zinc/40/81/91/1043408191.db2.gz XOCVOJPLEJLPRM-XHDPSFHLSA-N 1 2 300.431 4.067 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@@H]2CCC(F)(F)C2)no1)c1ccccc1 ZINC000347265001 1043418471 /nfs/dbraw/zinc/41/84/71/1043418471.db2.gz NWYKOWMCDRGZJT-ZIAGYGMSSA-N 1 2 321.371 4.014 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@@H]2CCC(F)(F)C2)no1)c1ccccc1 ZINC000347265001 1043418480 /nfs/dbraw/zinc/41/84/80/1043418480.db2.gz NWYKOWMCDRGZJT-ZIAGYGMSSA-N 1 2 321.371 4.014 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+](C)[C@@H](C)c3ccncc3)o2)cc1 ZINC000271450071 1043419036 /nfs/dbraw/zinc/41/90/36/1043419036.db2.gz XALDVGIOAANKAP-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+](C)[C@@H](C)c3ccncc3)o2)cc1 ZINC000271450071 1043419041 /nfs/dbraw/zinc/41/90/41/1043419041.db2.gz XALDVGIOAANKAP-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO COc1cc([C@H](C)[NH2+]C(c2cccs2)c2cccs2)on1 ZINC000925448667 1043419410 /nfs/dbraw/zinc/41/94/10/1043419410.db2.gz BSPXHEYEUNRRTF-JTQLQIEISA-N 1 2 320.439 4.246 20 0 DIADLO CC[N@H+](C)[C@H](c1nc([C@@H]2CCC(F)(F)C2)no1)c1ccccc1 ZINC000347264999 1043419783 /nfs/dbraw/zinc/41/97/83/1043419783.db2.gz NWYKOWMCDRGZJT-KGLIPLIRSA-N 1 2 321.371 4.014 20 0 DIADLO CC[N@@H+](C)[C@H](c1nc([C@@H]2CCC(F)(F)C2)no1)c1ccccc1 ZINC000347264999 1043419793 /nfs/dbraw/zinc/41/97/93/1043419793.db2.gz NWYKOWMCDRGZJT-KGLIPLIRSA-N 1 2 321.371 4.014 20 0 DIADLO CC[C@@H]([NH2+]Cc1cn[nH]c1C)c1ccc2cc(OC)ccc2c1 ZINC000271448944 1043419949 /nfs/dbraw/zinc/41/99/49/1043419949.db2.gz FHRZMYIGHOJLEK-LJQANCHMSA-N 1 2 309.413 4.121 20 0 DIADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000271472394 1043423004 /nfs/dbraw/zinc/42/30/04/1043423004.db2.gz HPVAUNVLZYQPSI-ABAIWWIYSA-N 1 2 319.836 4.190 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+][C@H](C)c2nnc(C(C)C)[nH]2)cc1F ZINC000271473463 1043424595 /nfs/dbraw/zinc/42/45/95/1043424595.db2.gz ISEVVNVPLGMNNL-GHMZBOCLSA-N 1 2 322.453 4.201 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nnc(C(C)C)[nH]1)c1cc(F)ccc1F ZINC000271535656 1043431730 /nfs/dbraw/zinc/43/17/30/1043431730.db2.gz QGHUXQJDIRDASP-YGRLFVJLSA-N 1 2 308.376 4.008 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)[nH]n1 ZINC000442840579 1043433373 /nfs/dbraw/zinc/43/33/73/1043433373.db2.gz LVPJVTCMEVGTHV-XVJNWHFHSA-N 1 2 321.346 4.106 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)[nH]n1 ZINC000442840579 1043433380 /nfs/dbraw/zinc/43/33/80/1043433380.db2.gz LVPJVTCMEVGTHV-XVJNWHFHSA-N 1 2 321.346 4.106 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)[nH]n1 ZINC000442840577 1043433879 /nfs/dbraw/zinc/43/38/79/1043433879.db2.gz LVPJVTCMEVGTHV-HVHJFMEUSA-N 1 2 321.346 4.106 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)[nH]n1 ZINC000442840577 1043433891 /nfs/dbraw/zinc/43/38/91/1043433891.db2.gz LVPJVTCMEVGTHV-HVHJFMEUSA-N 1 2 321.346 4.106 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nnc(C(C)C)[nH]1)c1cc(C)ccc1OC ZINC000271557318 1043436948 /nfs/dbraw/zinc/43/69/48/1043436948.db2.gz SWLDZBYDMQUIAX-HIFRSBDPSA-N 1 2 316.449 4.047 20 0 DIADLO Cn1ccc2ccc(NCc3c[nH+]cn3Cc3ccccc3)cc21 ZINC000442864935 1043438246 /nfs/dbraw/zinc/43/82/46/1043438246.db2.gz DTWYUCNOXSOJGH-UHFFFAOYSA-N 1 2 316.408 4.035 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+][C@H](C)c1nnc(C(C)C)[nH]1 ZINC000271571772 1043438967 /nfs/dbraw/zinc/43/89/67/1043438967.db2.gz VVKCFNHBJKSXOZ-ZYHUDNBSSA-N 1 2 321.494 4.228 20 0 DIADLO CC(C)(C)[C@H]1C[C@@H](Nc2ccc([NH+]3CCCC3)cc2)CCO1 ZINC000872055401 1043439287 /nfs/dbraw/zinc/43/92/87/1043439287.db2.gz HUSIXZKFKCRYIE-FUHWJXTLSA-N 1 2 302.462 4.292 20 0 DIADLO CC(C)(C)[C@H]1C[C@@H]([NH2+]c2ccc(N3CCCC3)cc2)CCO1 ZINC000872055401 1043439296 /nfs/dbraw/zinc/43/92/96/1043439296.db2.gz HUSIXZKFKCRYIE-FUHWJXTLSA-N 1 2 302.462 4.292 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2F)ncn1 ZINC000925630636 1043440691 /nfs/dbraw/zinc/44/06/91/1043440691.db2.gz VGGPVXRCWZGTFT-SECBINFHSA-N 1 2 314.191 4.082 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H](C)c1nnc(C(C)C)[nH]1 ZINC000271593484 1043441223 /nfs/dbraw/zinc/44/12/23/1043441223.db2.gz YPQFEHLYUWIACY-OLZOCXBDSA-N 1 2 312.417 4.395 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)[nH]1 ZINC000271594966 1043442306 /nfs/dbraw/zinc/44/23/06/1043442306.db2.gz YUEQBFXNBZPELX-RKDXNWHRSA-N 1 2 313.232 4.086 20 0 DIADLO CC[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(OC)cc1 ZINC000271625612 1043443581 /nfs/dbraw/zinc/44/35/81/1043443581.db2.gz DVWWBPMGBPDCNB-HNNXBMFYSA-N 1 2 302.418 4.222 20 0 DIADLO COC(=O)c1oc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)cc1C ZINC000271650407 1043444503 /nfs/dbraw/zinc/44/45/03/1043444503.db2.gz FCMSMGUWAUVQEO-MNOVXSKESA-N 1 2 323.339 4.065 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1cccc(O)c1F)c1cccc(Cl)c1 ZINC000872072357 1043450135 /nfs/dbraw/zinc/45/01/35/1043450135.db2.gz CTOMWFIRBQZLJJ-XHDPSFHLSA-N 1 2 323.795 4.223 20 0 DIADLO CCOc1nnc(C[NH2+][C@@H](c2cccc(C)c2)C(C)(C)C)s1 ZINC000271697360 1043450372 /nfs/dbraw/zinc/45/03/72/1043450372.db2.gz KIVSDNRXONCSFX-HNNXBMFYSA-N 1 2 319.474 4.122 20 0 DIADLO Cn1cc(Cl)c(C[NH2+][C@H]2CC(C)(C)Sc3ccccc32)n1 ZINC000872076395 1043451995 /nfs/dbraw/zinc/45/19/95/1043451995.db2.gz KUOLGAKCKFHCOB-ZDUSSCGKSA-N 1 2 321.877 4.179 20 0 DIADLO CC[C@H]([NH2+]Cc1ncc(Cl)s1)c1cc(C)ccc1OC ZINC000872115159 1043464219 /nfs/dbraw/zinc/46/42/19/1043464219.db2.gz IBBCEZGCCITBFU-LBPRGKRZSA-N 1 2 310.850 4.354 20 0 DIADLO Cc1ccc2c(c1)OCCC[C@H]2[NH2+]Cc1ncc(Cl)s1 ZINC000872115087 1043465297 /nfs/dbraw/zinc/46/52/97/1043465297.db2.gz GSTHDUKLSKQZPO-GFCCVEGCSA-N 1 2 308.834 4.108 20 0 DIADLO Cc1nccnc1[C@@H](C)[NH2+][C@@H](C)c1csc(-c2ccccc2)n1 ZINC000872131690 1043472601 /nfs/dbraw/zinc/47/26/01/1043472601.db2.gz ZPEFAIUMNNQMMX-GXTWGEPZSA-N 1 2 324.453 4.320 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+][C@@H](C)c1nccn1-c1ccccc1 ZINC000558260340 1043476096 /nfs/dbraw/zinc/47/60/96/1043476096.db2.gz XRSICHPUIQKVNC-HOTGVXAUSA-N 1 2 320.440 4.242 20 0 DIADLO C[C@@H]1CCc2nc(C[N@@H+]3CCC[C@@H]3c3cccnc3)sc2C1 ZINC000348894692 1043478583 /nfs/dbraw/zinc/47/85/83/1043478583.db2.gz OTJMEGKOFVVQLC-CZUORRHYSA-N 1 2 313.470 4.000 20 0 DIADLO C[C@@H]1CCc2nc(C[N@H+]3CCC[C@@H]3c3cccnc3)sc2C1 ZINC000348894692 1043478595 /nfs/dbraw/zinc/47/85/95/1043478595.db2.gz OTJMEGKOFVVQLC-CZUORRHYSA-N 1 2 313.470 4.000 20 0 DIADLO CCc1cccc(Cl)c1C[N@H+](C)Cc1cnc(C(C)C)nc1 ZINC000443072625 1043482399 /nfs/dbraw/zinc/48/23/99/1043482399.db2.gz VFKYCWRFCFXWHB-UHFFFAOYSA-N 1 2 317.864 4.448 20 0 DIADLO CCc1cccc(Cl)c1C[N@@H+](C)Cc1cnc(C(C)C)nc1 ZINC000443072625 1043482404 /nfs/dbraw/zinc/48/24/04/1043482404.db2.gz VFKYCWRFCFXWHB-UHFFFAOYSA-N 1 2 317.864 4.448 20 0 DIADLO Cc1ccccc1C[N@H+](Cc1cccnc1)Cc1cncc(F)c1 ZINC000349063611 1043488702 /nfs/dbraw/zinc/48/87/02/1043488702.db2.gz QXUQEEGHBLLOER-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ccccc1C[N@@H+](Cc1cccnc1)Cc1cncc(F)c1 ZINC000349063611 1043488710 /nfs/dbraw/zinc/48/87/10/1043488710.db2.gz QXUQEEGHBLLOER-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO CC(C)[N@H+](Cc1nc2c(s1)C[C@H](C)CC2)Cc1cccnc1 ZINC000349274533 1043498175 /nfs/dbraw/zinc/49/81/75/1043498175.db2.gz GEESPARVAGBVEH-CQSZACIVSA-N 1 2 315.486 4.074 20 0 DIADLO CC(C)[N@@H+](Cc1nc2c(s1)C[C@H](C)CC2)Cc1cccnc1 ZINC000349274533 1043498181 /nfs/dbraw/zinc/49/81/81/1043498181.db2.gz GEESPARVAGBVEH-CQSZACIVSA-N 1 2 315.486 4.074 20 0 DIADLO CC[C@@H](C)CC(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000558393779 1043499128 /nfs/dbraw/zinc/49/91/28/1043499128.db2.gz UQYPTZAETOKCNA-CQSZACIVSA-N 1 2 311.429 4.261 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@@H]1CCCOc2cc(F)ccc21 ZINC000925970558 1043500899 /nfs/dbraw/zinc/50/08/99/1043500899.db2.gz VZCDNJGYVYIMPK-CABCVRRESA-N 1 2 316.376 4.003 20 0 DIADLO CC(C)C[C@H](C)CNc1ccccc1OCCn1cc[nH+]c1 ZINC000558403290 1043501931 /nfs/dbraw/zinc/50/19/31/1043501931.db2.gz XOPGICCMPWABKN-INIZCTEOSA-N 1 2 301.434 4.056 20 0 DIADLO Fc1cccc2c(C[N@@H+]3CCc4cc(F)c(F)cc4C3)c[nH]c21 ZINC001137060653 1043502325 /nfs/dbraw/zinc/50/23/25/1043502325.db2.gz YWZDFAYUQZCYGS-UHFFFAOYSA-N 1 2 316.326 4.144 20 0 DIADLO Fc1cccc2c(C[N@H+]3CCc4cc(F)c(F)cc4C3)c[nH]c21 ZINC001137060653 1043502334 /nfs/dbraw/zinc/50/23/34/1043502334.db2.gz YWZDFAYUQZCYGS-UHFFFAOYSA-N 1 2 316.326 4.144 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)cn1 ZINC000558425285 1043509543 /nfs/dbraw/zinc/50/95/43/1043509543.db2.gz WWRCUEKJDINZBH-OAHLLOKOSA-N 1 2 315.486 4.419 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)cn1 ZINC000558425285 1043509555 /nfs/dbraw/zinc/50/95/55/1043509555.db2.gz WWRCUEKJDINZBH-OAHLLOKOSA-N 1 2 315.486 4.419 20 0 DIADLO Cc1cc(N[C@H]2CCc3c2nccc3Cl)ccc1[NH+](C)C ZINC000926053350 1043514640 /nfs/dbraw/zinc/51/46/40/1043514640.db2.gz ZUNPCYVROQTHBH-HNNXBMFYSA-N 1 2 301.821 4.209 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000349650539 1043516156 /nfs/dbraw/zinc/51/61/56/1043516156.db2.gz AWWFPNXAWASCQB-SMDDNHRTSA-N 1 2 315.442 4.053 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000349650539 1043516167 /nfs/dbraw/zinc/51/61/67/1043516167.db2.gz AWWFPNXAWASCQB-SMDDNHRTSA-N 1 2 315.442 4.053 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1cnn(C2CCC2)c1 ZINC000926067459 1043517809 /nfs/dbraw/zinc/51/78/09/1043517809.db2.gz WROGZRUVQXJFTA-AWEZNQCLSA-N 1 2 310.445 4.164 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1cnn(C2CCC2)c1 ZINC000926067459 1043517823 /nfs/dbraw/zinc/51/78/23/1043517823.db2.gz WROGZRUVQXJFTA-AWEZNQCLSA-N 1 2 310.445 4.164 20 0 DIADLO FC(F)Sc1ccc(C[NH2+]Cc2ncc(Cl)s2)cc1 ZINC000873165534 1043521790 /nfs/dbraw/zinc/52/17/90/1043521790.db2.gz LKCRABHGUIYRHU-UHFFFAOYSA-N 1 2 320.817 4.401 20 0 DIADLO Cc1nccnc1[C@H](C)[NH2+]Cc1ccc(F)c(Cl)c1Cl ZINC000873186737 1043526159 /nfs/dbraw/zinc/52/61/59/1043526159.db2.gz DQBIXCXAXBQKLA-VIFPVBQESA-N 1 2 314.191 4.082 20 0 DIADLO Cc1nocc1C[N@@H+]1CCC[C@H]1c1ccc(Br)cc1 ZINC000350557391 1043547255 /nfs/dbraw/zinc/54/72/55/1043547255.db2.gz LTVYFUQCHILOPR-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1nocc1C[N@H+]1CCC[C@H]1c1ccc(Br)cc1 ZINC000350557391 1043547258 /nfs/dbraw/zinc/54/72/58/1043547258.db2.gz LTVYFUQCHILOPR-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO CC[C@@H](c1nc(Cc2ccccc2)no1)[N@H+](C)Cc1ccccc1 ZINC000558596478 1043552842 /nfs/dbraw/zinc/55/28/42/1043552842.db2.gz PWJIRSIZKIZLRB-SFHVURJKSA-N 1 2 321.424 4.244 20 0 DIADLO CC[C@@H](c1nc(Cc2ccccc2)no1)[N@@H+](C)Cc1ccccc1 ZINC000558596478 1043552852 /nfs/dbraw/zinc/55/28/52/1043552852.db2.gz PWJIRSIZKIZLRB-SFHVURJKSA-N 1 2 321.424 4.244 20 0 DIADLO Cc1cc(CNc2ccc3oc(CO)cc3c2)c2c([nH+]1)CCCC2 ZINC000895194363 1043558539 /nfs/dbraw/zinc/55/85/39/1043558539.db2.gz CGPXYGIFVZKJRR-UHFFFAOYSA-N 1 2 322.408 4.119 20 0 DIADLO C[C@H](Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)c1ncco1 ZINC000926293447 1043559679 /nfs/dbraw/zinc/55/96/79/1043559679.db2.gz MSEQDCICTGTQQL-ZDUSSCGKSA-N 1 2 308.385 4.048 20 0 DIADLO CC(C)n1cc(C[N@H+](Cc2ccccc2)Cc2ccncc2)cn1 ZINC001137072773 1043559657 /nfs/dbraw/zinc/55/96/57/1043559657.db2.gz GAHFNTUOCSZNLL-UHFFFAOYSA-N 1 2 320.440 4.061 20 0 DIADLO CC(C)n1cc(C[N@@H+](Cc2ccccc2)Cc2ccncc2)cn1 ZINC001137072773 1043559664 /nfs/dbraw/zinc/55/96/64/1043559664.db2.gz GAHFNTUOCSZNLL-UHFFFAOYSA-N 1 2 320.440 4.061 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)c1c(Cl)cc(F)cc1Cl ZINC001274961607 1043562970 /nfs/dbraw/zinc/56/29/70/1043562970.db2.gz SSUHNJLXRPNJLA-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2Cl)C2CCCC2)nn1C ZINC000487430325 1043563958 /nfs/dbraw/zinc/56/39/58/1043563958.db2.gz LFGBQSVAYDQERI-UHFFFAOYSA-N 1 2 317.864 4.327 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2Cl)C2CCCC2)nn1C ZINC000487430325 1043563966 /nfs/dbraw/zinc/56/39/66/1043563966.db2.gz LFGBQSVAYDQERI-UHFFFAOYSA-N 1 2 317.864 4.327 20 0 DIADLO Cc1cc(NC(=O)c2ccc(COc3ccccc3)cc2)cc[nH+]1 ZINC000010634859 1043568221 /nfs/dbraw/zinc/56/82/21/1043568221.db2.gz JSBGSDZGUZYOQJ-UHFFFAOYSA-N 1 2 318.376 4.221 20 0 DIADLO COc1ccc([C@@H](Cc2ccccc2)[NH2+][C@@H](C)c2ncco2)cc1 ZINC000926448781 1043580525 /nfs/dbraw/zinc/58/05/25/1043580525.db2.gz BLVFSTBYDCAKHJ-HNAYVOBHSA-N 1 2 322.408 4.318 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1cn2c(n1)CCCC2 ZINC000926468750 1043582454 /nfs/dbraw/zinc/58/24/54/1043582454.db2.gz ITTNTRQSGCEJEV-CYBMUJFWSA-N 1 2 313.420 4.087 20 0 DIADLO CCc1noc(C)c1C[NH2+][C@@H](c1cccc(C)c1)c1ccccn1 ZINC000926481552 1043584857 /nfs/dbraw/zinc/58/48/57/1043584857.db2.gz LVMWUVFKEFXKFC-FQEVSTJZSA-N 1 2 321.424 4.128 20 0 DIADLO COCc1nc(C[NH2+][C@H](C)c2cc3cccc(F)c3o2)cs1 ZINC000353210501 1043591684 /nfs/dbraw/zinc/59/16/84/1043591684.db2.gz XDVNHBGLQOVKQT-SNVBAGLBSA-N 1 2 320.389 4.026 20 0 DIADLO C/C=C/c1ccc(NC(=O)N2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)cc1 ZINC000353243930 1043592519 /nfs/dbraw/zinc/59/25/19/1043592519.db2.gz NNZVSTMMZLKFTL-AWXCJNTOSA-N 1 2 324.428 4.031 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2csc(C(F)(F)F)c2)co1 ZINC000926536043 1043594415 /nfs/dbraw/zinc/59/44/15/1043594415.db2.gz IOCVJPSTYNHIPD-QMMMGPOBSA-N 1 2 304.337 4.168 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2cc3ccccc3c(OC)c2)co1 ZINC000926535471 1043595309 /nfs/dbraw/zinc/59/53/09/1043595309.db2.gz AJTISWLZGMAWIA-CYBMUJFWSA-N 1 2 310.397 4.250 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+]2CC[C@H]2c2ccccc2)s1 ZINC000353536306 1043613289 /nfs/dbraw/zinc/61/32/89/1043613289.db2.gz ZXNJRDNWOBWSHW-LBPRGKRZSA-N 1 2 312.360 4.417 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+]2CC[C@H]2c2ccccc2)s1 ZINC000353536306 1043613290 /nfs/dbraw/zinc/61/32/90/1043613290.db2.gz ZXNJRDNWOBWSHW-LBPRGKRZSA-N 1 2 312.360 4.417 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)n1 ZINC000443613001 1043618500 /nfs/dbraw/zinc/61/85/00/1043618500.db2.gz GTUXBWQPROCHJW-CQSZACIVSA-N 1 2 316.392 4.484 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CCC[C@]3(CC=CCC3)C2)n1 ZINC000443613001 1043618510 /nfs/dbraw/zinc/61/85/10/1043618510.db2.gz GTUXBWQPROCHJW-CQSZACIVSA-N 1 2 316.392 4.484 20 0 DIADLO CSc1ccc(C[N@H+](C)Cc2nc3c(s2)CCCC3)cc1 ZINC000353591324 1043620951 /nfs/dbraw/zinc/62/09/51/1043620951.db2.gz JUOAAMKJYUKVPI-UHFFFAOYSA-N 1 2 318.511 4.376 20 0 DIADLO CSc1ccc(C[N@@H+](C)Cc2nc3c(s2)CCCC3)cc1 ZINC000353591324 1043620960 /nfs/dbraw/zinc/62/09/60/1043620960.db2.gz JUOAAMKJYUKVPI-UHFFFAOYSA-N 1 2 318.511 4.376 20 0 DIADLO Cc1c([C@@H](C)Nc2ccc([NH+](C)C)cc2)cnn1-c1ccccc1 ZINC000777602730 1043622618 /nfs/dbraw/zinc/62/26/18/1043622618.db2.gz VGJXKKBQXVZLGH-OAHLLOKOSA-N 1 2 320.440 4.420 20 0 DIADLO O=C(c1ccccc1)C1CC[NH+](Cc2cc(F)ccc2F)CC1 ZINC000051379387 1043629072 /nfs/dbraw/zinc/62/90/72/1043629072.db2.gz BZHWHSZRBMWSRQ-UHFFFAOYSA-N 1 2 315.363 4.060 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@H](c3ccccc3)OCC2(C)C)c(C)s1 ZINC000443635673 1043633794 /nfs/dbraw/zinc/63/37/94/1043633794.db2.gz ZKNOACSNOHPGBW-QGZVFWFLSA-N 1 2 316.470 4.112 20 0 DIADLO Cc1nc(C[N@H+]2C[C@H](c3ccccc3)OCC2(C)C)c(C)s1 ZINC000443635673 1043633798 /nfs/dbraw/zinc/63/37/98/1043633798.db2.gz ZKNOACSNOHPGBW-QGZVFWFLSA-N 1 2 316.470 4.112 20 0 DIADLO CC(C)[C@@H](CC1CCCCC1)C(=O)NCCCCn1cc[nH+]c1 ZINC000522348518 1043635117 /nfs/dbraw/zinc/63/51/17/1043635117.db2.gz PLTVBMDFDZGLSJ-GOSISDBHSA-N 1 2 319.493 4.022 20 0 DIADLO FC(F)(F)C1=CC[N@H+](Cc2cnc(C3CCC3)s2)CC1 ZINC000353744537 1043638874 /nfs/dbraw/zinc/63/88/74/1043638874.db2.gz GUBQWJFAAAKHIG-UHFFFAOYSA-N 1 2 302.365 4.105 20 0 DIADLO FC(F)(F)C1=CC[N@@H+](Cc2cnc(C3CCC3)s2)CC1 ZINC000353744537 1043638878 /nfs/dbraw/zinc/63/88/78/1043638878.db2.gz GUBQWJFAAAKHIG-UHFFFAOYSA-N 1 2 302.365 4.105 20 0 DIADLO COCc1nc(C[N@H+](Cc2ccoc2)C2CCCCC2)cs1 ZINC000353779206 1043643215 /nfs/dbraw/zinc/64/32/15/1043643215.db2.gz HMGYWIVGEZMJKW-UHFFFAOYSA-N 1 2 320.458 4.217 20 0 DIADLO COCc1nc(C[N@@H+](Cc2ccoc2)C2CCCCC2)cs1 ZINC000353779206 1043643224 /nfs/dbraw/zinc/64/32/24/1043643224.db2.gz HMGYWIVGEZMJKW-UHFFFAOYSA-N 1 2 320.458 4.217 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@@H](Oc3ccccc3Cl)C2)c(C)s1 ZINC000443662846 1043650414 /nfs/dbraw/zinc/65/04/14/1043650414.db2.gz VXCGWYXLMKGZFL-CYBMUJFWSA-N 1 2 322.861 4.067 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@@H](Oc3ccccc3Cl)C2)c(C)s1 ZINC000443662846 1043650440 /nfs/dbraw/zinc/65/04/40/1043650440.db2.gz VXCGWYXLMKGZFL-CYBMUJFWSA-N 1 2 322.861 4.067 20 0 DIADLO CC[C@H]([NH2+][C@@H]1CCCc2oc(C)nc21)c1cc(F)ccc1OC ZINC000926901410 1043651599 /nfs/dbraw/zinc/65/15/99/1043651599.db2.gz RIYHXUSEVFYNRL-LSDHHAIUSA-N 1 2 318.392 4.249 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2nccn2CC)o1 ZINC000353934291 1043662708 /nfs/dbraw/zinc/66/27/08/1043662708.db2.gz PLAYVJHJYKKBQW-HOCLYGCPSA-N 1 2 301.434 4.032 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2nccn2CC)o1 ZINC000353934291 1043662712 /nfs/dbraw/zinc/66/27/12/1043662712.db2.gz PLAYVJHJYKKBQW-HOCLYGCPSA-N 1 2 301.434 4.032 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1cccnc1Br ZINC000876588661 1043695826 /nfs/dbraw/zinc/69/58/26/1043695826.db2.gz CGIJUKUHEVYMIO-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1cccnc1Br ZINC000876588661 1043695834 /nfs/dbraw/zinc/69/58/34/1043695834.db2.gz CGIJUKUHEVYMIO-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO Fc1ccc2oc(C[N@@H+]3CCOC[C@H]3c3ccccc3)cc2c1 ZINC000354108674 1043681232 /nfs/dbraw/zinc/68/12/32/1043681232.db2.gz GJJXNCDDHOENGJ-SFHVURJKSA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccc2oc(C[N@H+]3CCOC[C@H]3c3ccccc3)cc2c1 ZINC000354108674 1043681238 /nfs/dbraw/zinc/68/12/38/1043681238.db2.gz GJJXNCDDHOENGJ-SFHVURJKSA-N 1 2 311.356 4.145 20 0 DIADLO CC(C)(C)CCCCC(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927076138 1043682477 /nfs/dbraw/zinc/68/24/77/1043682477.db2.gz RZCJFTHGNHFRAK-UHFFFAOYSA-N 1 2 317.477 4.091 20 0 DIADLO Fc1cccc(C[N@H+](Cc2nc(-c3ccccc3)no2)C2CC2)c1 ZINC000052161504 1043682664 /nfs/dbraw/zinc/68/26/64/1043682664.db2.gz PXIZEYRQWPGARD-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2nc(-c3ccccc3)no2)C2CC2)c1 ZINC000052161504 1043682672 /nfs/dbraw/zinc/68/26/72/1043682672.db2.gz PXIZEYRQWPGARD-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO CCCCC[C@H](CC)C(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927087570 1043684669 /nfs/dbraw/zinc/68/46/69/1043684669.db2.gz SKERTNOQUAIGGD-INIZCTEOSA-N 1 2 317.477 4.091 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@H](c2ccc(F)cn2)C(C)C)c(F)c1 ZINC000927095255 1043684890 /nfs/dbraw/zinc/68/48/90/1043684890.db2.gz YGXIMISWYWAGQW-KRWDZBQOSA-N 1 2 308.347 4.294 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1cccc(Cl)c1F ZINC000927107470 1043689741 /nfs/dbraw/zinc/68/97/41/1043689741.db2.gz GASWRJJIIHCZFQ-HNNXBMFYSA-N 1 2 321.827 4.331 20 0 DIADLO Cc1ccc2cc(C[N@@H+](C)Cc3c(F)cccc3F)ccc2n1 ZINC000354343015 1043696961 /nfs/dbraw/zinc/69/69/61/1043696961.db2.gz HUXRSHGQWWEEOE-UHFFFAOYSA-N 1 2 312.363 4.453 20 0 DIADLO Cc1ccc2cc(C[N@H+](C)Cc3c(F)cccc3F)ccc2n1 ZINC000354343015 1043696967 /nfs/dbraw/zinc/69/69/67/1043696967.db2.gz HUXRSHGQWWEEOE-UHFFFAOYSA-N 1 2 312.363 4.453 20 0 DIADLO CCc1onc(C)c1C[NH2+][C@@H](C)c1nc2ccccc2s1 ZINC000927139393 1043697006 /nfs/dbraw/zinc/69/70/06/1043697006.db2.gz IIAZZGOAIABLEL-NSHDSACASA-N 1 2 301.415 4.006 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)cc3c2OCC3)cs1 ZINC000927142752 1043698802 /nfs/dbraw/zinc/69/88/02/1043698802.db2.gz XAAYMYVHCQRQTD-NXEZZACHSA-N 1 2 322.861 4.452 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cc(Cl)cc2c1OCC2)c1cscn1 ZINC000927140790 1043698952 /nfs/dbraw/zinc/69/89/52/1043698952.db2.gz PGAHWGSSDRSHRZ-UWVGGRQHSA-N 1 2 308.834 4.143 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)[C@H]2C=CCCCCC2)n1 ZINC000559113654 1043702123 /nfs/dbraw/zinc/70/21/23/1043702123.db2.gz XBYZSPUUOHRQDS-KBPBESRZSA-N 1 2 309.479 4.204 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)[C@H]2C=CCCCCC2)n1 ZINC000559113654 1043702133 /nfs/dbraw/zinc/70/21/33/1043702133.db2.gz XBYZSPUUOHRQDS-KBPBESRZSA-N 1 2 309.479 4.204 20 0 DIADLO Clc1cnc(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)s1 ZINC001137110009 1043705592 /nfs/dbraw/zinc/70/55/92/1043705592.db2.gz FTFLPSLUTOVNMI-SNVBAGLBSA-N 1 2 313.253 4.439 20 0 DIADLO Clc1cnc(C[N@H+]2CC[C@@H](c3ccccc3Cl)C2)s1 ZINC001137110009 1043705602 /nfs/dbraw/zinc/70/56/02/1043705602.db2.gz FTFLPSLUTOVNMI-SNVBAGLBSA-N 1 2 313.253 4.439 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2ccc(Cl)nn2)o1 ZINC000876754058 1043707172 /nfs/dbraw/zinc/70/71/72/1043707172.db2.gz MDIQYYJCCJZWIE-AWEZNQCLSA-N 1 2 305.809 4.149 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2ccc(Cl)nn2)o1 ZINC000876754058 1043707182 /nfs/dbraw/zinc/70/71/82/1043707182.db2.gz MDIQYYJCCJZWIE-AWEZNQCLSA-N 1 2 305.809 4.149 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)Nc1ccc([NH+]2CCCC2)cc1 ZINC000876820692 1043713808 /nfs/dbraw/zinc/71/38/08/1043713808.db2.gz QSTYNJXSDSHVJO-NYHFZMIOSA-N 1 2 324.405 4.422 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)[NH2+]c1ccc(N2CCCC2)cc1 ZINC000876820692 1043713817 /nfs/dbraw/zinc/71/38/17/1043713817.db2.gz QSTYNJXSDSHVJO-NYHFZMIOSA-N 1 2 324.405 4.422 20 0 DIADLO Cc1cc([NH2+][C@@H](C)[C@H]2CC2(F)F)ccc1N1CCSCC1 ZINC000876854445 1043720070 /nfs/dbraw/zinc/72/00/70/1043720070.db2.gz GWZBNOAKCLEUPV-GXTWGEPZSA-N 1 2 312.429 4.004 20 0 DIADLO Cc1cccc(N2CCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)[nH+]1 ZINC000354795375 1043720303 /nfs/dbraw/zinc/72/03/03/1043720303.db2.gz TZIIGIJKRMPIOE-HNNXBMFYSA-N 1 2 312.804 4.261 20 0 DIADLO CCc1nnc(C[N@H+]([C@@H](C)c2ccc3ccccc3c2)C2CC2)[nH]1 ZINC000354836769 1043724840 /nfs/dbraw/zinc/72/48/40/1043724840.db2.gz BAISOSMORMTELT-AWEZNQCLSA-N 1 2 320.440 4.246 20 0 DIADLO CCc1nnc(C[N@@H+]([C@@H](C)c2ccc3ccccc3c2)C2CC2)[nH]1 ZINC000354836769 1043724849 /nfs/dbraw/zinc/72/48/49/1043724849.db2.gz BAISOSMORMTELT-AWEZNQCLSA-N 1 2 320.440 4.246 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)c(F)c1 ZINC000777657004 1043728746 /nfs/dbraw/zinc/72/87/46/1043728746.db2.gz NPXXWTDYMMHDQG-ZDUSSCGKSA-N 1 2 314.404 4.390 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)c(F)c1 ZINC000777657004 1043728751 /nfs/dbraw/zinc/72/87/51/1043728751.db2.gz NPXXWTDYMMHDQG-ZDUSSCGKSA-N 1 2 314.404 4.390 20 0 DIADLO C[C@@H]([NH2+]c1ccc(N2CCCC2)c(Cl)c1)C1CCOCC1 ZINC000777660572 1043729309 /nfs/dbraw/zinc/72/93/09/1043729309.db2.gz PZVQEZBVOAKSKD-CYBMUJFWSA-N 1 2 308.853 4.167 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccc2c(c1)OCCO2 ZINC000777656815 1043729366 /nfs/dbraw/zinc/72/93/66/1043729366.db2.gz LLAYZDVCTLMDCR-AWEZNQCLSA-N 1 2 324.424 4.013 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccc2c(c1)OCCO2 ZINC000777656815 1043729376 /nfs/dbraw/zinc/72/93/76/1043729376.db2.gz LLAYZDVCTLMDCR-AWEZNQCLSA-N 1 2 324.424 4.013 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1ccc3c(c1)CCC[N@H+]3C)CC2 ZINC000777658149 1043730006 /nfs/dbraw/zinc/73/00/06/1043730006.db2.gz XHPMJLUGRKXMRJ-IBGZPJMESA-N 1 2 308.425 4.177 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1ccc3c(c1)CCC[N@@H+]3C)CC2 ZINC000777658149 1043730013 /nfs/dbraw/zinc/73/00/13/1043730013.db2.gz XHPMJLUGRKXMRJ-IBGZPJMESA-N 1 2 308.425 4.177 20 0 DIADLO COc1cccc2c1CC[C@@H]2Nc1ccc2c(c1)CCC[N@H+]2C ZINC000777657490 1043730506 /nfs/dbraw/zinc/73/05/06/1043730506.db2.gz RDKRXSHKQXPVRH-SFHVURJKSA-N 1 2 308.425 4.177 20 0 DIADLO COc1cccc2c1CC[C@@H]2Nc1ccc2c(c1)CCC[N@@H+]2C ZINC000777657490 1043730519 /nfs/dbraw/zinc/73/05/19/1043730519.db2.gz RDKRXSHKQXPVRH-SFHVURJKSA-N 1 2 308.425 4.177 20 0 DIADLO C[C@@H]1CCC[N@@H+]1Cc1c(F)cc(Cl)cc1Br ZINC001141837557 1043741386 /nfs/dbraw/zinc/74/13/86/1043741386.db2.gz IGDOCUUPXOJVKM-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@@H]1CCC[N@H+]1Cc1c(F)cc(Cl)cc1Br ZINC001141837557 1043741405 /nfs/dbraw/zinc/74/14/05/1043741405.db2.gz IGDOCUUPXOJVKM-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO Cc1ccc(C[NH2+]Cc2nc(Cl)cs2)c(OCC2CC2)c1 ZINC000877109476 1043744677 /nfs/dbraw/zinc/74/46/77/1043744677.db2.gz MEIJXAVBEJIZJS-UHFFFAOYSA-N 1 2 322.861 4.184 20 0 DIADLO Fc1ccc2c(c1F)C[N@@H+](Cc1ccc3ncccc3c1)CC2 ZINC000355208968 1043750554 /nfs/dbraw/zinc/75/05/54/1043750554.db2.gz IPXREBATEUQTLX-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1ccc2c(c1F)C[N@H+](Cc1ccc3ncccc3c1)CC2 ZINC000355208968 1043750567 /nfs/dbraw/zinc/75/05/67/1043750567.db2.gz IPXREBATEUQTLX-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO c1ccc(-c2noc([C@H]3CCC[C@@H](c4ccccc4)[NH2+]3)n2)cc1 ZINC001211885411 1043751588 /nfs/dbraw/zinc/75/15/88/1043751588.db2.gz OLZGJRSRWDMUCD-DLBZAZTESA-N 1 2 305.381 4.293 20 0 DIADLO CC(C)=CCC[C@H](C)[NH2+]c1ccc(N2CCOC[C@H]2C)cc1 ZINC000777691817 1043756101 /nfs/dbraw/zinc/75/61/01/1043756101.db2.gz GHEFNQFCPWNVJZ-DLBZAZTESA-N 1 2 302.462 4.459 20 0 DIADLO C(=C\c1ccc(-n2cc[nH+]c2)cc1)\c1nc(CC2=CCCC2)no1 ZINC000355439372 1043768301 /nfs/dbraw/zinc/76/83/01/1043768301.db2.gz JXNZWFGEXLKHPN-YFHOEESVSA-N 1 2 318.380 4.079 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccnc(Cl)c1 ZINC000777704961 1043769604 /nfs/dbraw/zinc/76/96/04/1043769604.db2.gz OCLZCFKZQNCWFO-ZDUSSCGKSA-N 1 2 316.836 4.293 20 0 DIADLO Cc1ccncc1C[N@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000355589001 1043778518 /nfs/dbraw/zinc/77/85/18/1043778518.db2.gz WQSCLPSROVZMOS-UHFFFAOYSA-N 1 2 300.789 4.422 20 0 DIADLO Cc1ccncc1C[N@@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000355589001 1043778525 /nfs/dbraw/zinc/77/85/25/1043778525.db2.gz WQSCLPSROVZMOS-UHFFFAOYSA-N 1 2 300.789 4.422 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2c(Cl)cncc2Cl)C1 ZINC000877810257 1043799528 /nfs/dbraw/zinc/79/95/28/1043799528.db2.gz AWVLDNOKIRPFKJ-NSHDSACASA-N 1 2 313.150 4.163 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2c(Cl)cncc2Cl)C1 ZINC000877810257 1043799534 /nfs/dbraw/zinc/79/95/34/1043799534.db2.gz AWVLDNOKIRPFKJ-NSHDSACASA-N 1 2 313.150 4.163 20 0 DIADLO FC(F)(F)c1ccc(C[NH2+]Cc2nc(Cl)cs2)s1 ZINC000877804554 1043801472 /nfs/dbraw/zinc/80/14/72/1043801472.db2.gz ABLHUYWFKBZQFZ-UHFFFAOYSA-N 1 2 312.769 4.167 20 0 DIADLO Fc1ccc(C[N@H+](Cc2nncs2)C2CCCCC2)cc1 ZINC000929222622 1043803446 /nfs/dbraw/zinc/80/34/46/1043803446.db2.gz JPKMUOFDEUSQBS-UHFFFAOYSA-N 1 2 305.422 4.012 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2nncs2)C2CCCCC2)cc1 ZINC000929222622 1043803463 /nfs/dbraw/zinc/80/34/63/1043803463.db2.gz JPKMUOFDEUSQBS-UHFFFAOYSA-N 1 2 305.422 4.012 20 0 DIADLO FC(F)(F)c1cscc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000356048239 1043805034 /nfs/dbraw/zinc/80/50/34/1043805034.db2.gz BMNZKXQVWSQJLG-ZDUSSCGKSA-N 1 2 300.349 4.432 20 0 DIADLO FC(F)(F)c1cscc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000356048239 1043805061 /nfs/dbraw/zinc/80/50/61/1043805061.db2.gz BMNZKXQVWSQJLG-ZDUSSCGKSA-N 1 2 300.349 4.432 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000780533548 1043808542 /nfs/dbraw/zinc/80/85/42/1043808542.db2.gz RWWJNTBFIKJYFN-GOSISDBHSA-N 1 2 305.466 4.112 20 0 DIADLO Cc1[nH]c(CN(C)[C@H](C)c2cccc(C(F)(F)F)c2)c(C)[nH+]1 ZINC000929371043 1043811910 /nfs/dbraw/zinc/81/19/10/1043811910.db2.gz DGDYOYMMHPJBAL-LLVKDONJSA-N 1 2 311.351 4.238 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(Cl)c1 ZINC000191792124 1043815068 /nfs/dbraw/zinc/81/50/68/1043815068.db2.gz QQNRJPHMSAEDCR-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO C[C@@H]1CCC[C@H](c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)C1 ZINC000356229579 1043824931 /nfs/dbraw/zinc/82/49/31/1043824931.db2.gz YXGFTBVZTFPDNW-KGLIPLIRSA-N 1 2 308.385 4.216 20 0 DIADLO Cc1c[nH+]c(CN2CC[C@@H](C)Sc3ccc(Cl)cc32)n1C ZINC000356299154 1043830343 /nfs/dbraw/zinc/83/03/43/1043830343.db2.gz GWUOYIFPHSGTNO-GFCCVEGCSA-N 1 2 321.877 4.273 20 0 DIADLO C[C@H]([NH2+]Cc1cscc1C(F)(F)F)c1c(F)cncc1F ZINC000356290385 1043831498 /nfs/dbraw/zinc/83/14/98/1043831498.db2.gz BHINZUDNBBCWPD-ZETCQYMHSA-N 1 2 322.302 4.291 20 0 DIADLO Brc1cccnc1C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000877961304 1043833980 /nfs/dbraw/zinc/83/39/80/1043833980.db2.gz NQQWXSICTWKZDX-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cccnc1C[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000877961304 1043833962 /nfs/dbraw/zinc/83/39/62/1043833962.db2.gz NQQWXSICTWKZDX-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO FC(F)(F)c1cscc1C[N@H+]1CCCc2occc2C1 ZINC000356335944 1043834929 /nfs/dbraw/zinc/83/49/29/1043834929.db2.gz KGGYEYDXNCPAIE-UHFFFAOYSA-N 1 2 301.333 4.308 20 0 DIADLO FC(F)(F)c1cscc1C[N@@H+]1CCCc2occc2C1 ZINC000356335944 1043834920 /nfs/dbraw/zinc/83/49/20/1043834920.db2.gz KGGYEYDXNCPAIE-UHFFFAOYSA-N 1 2 301.333 4.308 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@@H]2c2ccccn2)sc1C(C)(C)C ZINC000929813109 1043841214 /nfs/dbraw/zinc/84/12/14/1043841214.db2.gz XOTSCEURRZLVLS-OAHLLOKOSA-N 1 2 315.486 4.481 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@@H]2c2ccccn2)sc1C(C)(C)C ZINC000929813109 1043841229 /nfs/dbraw/zinc/84/12/29/1043841229.db2.gz XOTSCEURRZLVLS-OAHLLOKOSA-N 1 2 315.486 4.481 20 0 DIADLO Cc1cnn([C@H]2CC[N@H+](Cc3csc(Cl)c3Cl)C2)c1 ZINC000356499072 1043843341 /nfs/dbraw/zinc/84/33/41/1043843341.db2.gz ASSMTQSPGNXETG-NSHDSACASA-N 1 2 316.257 4.007 20 0 DIADLO Cc1cnn([C@H]2CC[N@@H+](Cc3csc(Cl)c3Cl)C2)c1 ZINC000356499072 1043843353 /nfs/dbraw/zinc/84/33/53/1043843353.db2.gz ASSMTQSPGNXETG-NSHDSACASA-N 1 2 316.257 4.007 20 0 DIADLO COc1ccccc1-c1nc(C[N@@H+]2CC[C@@H]2c2ccccc2)co1 ZINC000878165953 1043854379 /nfs/dbraw/zinc/85/43/79/1043854379.db2.gz IJZDWGKTWOFXEE-GOSISDBHSA-N 1 2 320.392 4.297 20 0 DIADLO COc1ccccc1-c1nc(C[N@H+]2CC[C@@H]2c2ccccc2)co1 ZINC000878165953 1043854395 /nfs/dbraw/zinc/85/43/95/1043854395.db2.gz IJZDWGKTWOFXEE-GOSISDBHSA-N 1 2 320.392 4.297 20 0 DIADLO C[C@@H](c1cccs1)c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000356651111 1043858117 /nfs/dbraw/zinc/85/81/17/1043858117.db2.gz SJNOXIKBMMFHOI-LBPRGKRZSA-N 1 2 322.393 4.136 20 0 DIADLO CC(C)c1nsc(C[NH2+]C(C)(C)c2ccc(Cl)cc2)n1 ZINC000929960262 1043859083 /nfs/dbraw/zinc/85/90/83/1043859083.db2.gz AZJRNJBKMTWNFK-UHFFFAOYSA-N 1 2 309.866 4.340 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3c(Cl)cncc3Cl)CC2)cc1 ZINC000878239520 1043863895 /nfs/dbraw/zinc/86/38/95/1043863895.db2.gz IMBZYTIKAMPBJW-UHFFFAOYSA-N 1 2 311.187 4.306 20 0 DIADLO FC(F)(F)c1coc(C[NH2+]C2(c3nccs3)CCCC2)c1 ZINC000878262564 1043866356 /nfs/dbraw/zinc/86/63/56/1043866356.db2.gz SKOFYRJNTFIFTJ-UHFFFAOYSA-N 1 2 316.348 4.314 20 0 DIADLO C[C@H]([NH2+]Cc1ncccc1C(F)(F)F)c1c(F)cccc1F ZINC000878351289 1043875137 /nfs/dbraw/zinc/87/51/37/1043875137.db2.gz VBNBPHQSPJQDBZ-VIFPVBQESA-N 1 2 316.273 4.229 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C(F)(F)F)co1)c1c(F)cccc1F ZINC000878350118 1043875468 /nfs/dbraw/zinc/87/54/68/1043875468.db2.gz JMFCIWDVBSXFRB-MRVPVSSYSA-N 1 2 305.246 4.427 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cc(C(F)(F)F)co1 ZINC000878355525 1043876718 /nfs/dbraw/zinc/87/67/18/1043876718.db2.gz ZVKSIFCHLOARJN-VIFPVBQESA-N 1 2 317.282 4.297 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cc(C(F)(F)F)co1 ZINC000878355524 1043877616 /nfs/dbraw/zinc/87/76/16/1043877616.db2.gz ZVKSIFCHLOARJN-SECBINFHSA-N 1 2 317.282 4.297 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+]Cc2nocc2C)cc1OC ZINC000878356622 1043877707 /nfs/dbraw/zinc/87/77/07/1043877707.db2.gz WTQMYFCERXFJGU-AWEZNQCLSA-N 1 2 318.417 4.021 20 0 DIADLO CCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nocc1C ZINC000878368393 1043881169 /nfs/dbraw/zinc/88/11/69/1043881169.db2.gz BHVUNRXHJKUHNK-INIZCTEOSA-N 1 2 302.418 4.259 20 0 DIADLO CCn1c[nH+]cc1CNc1cccnc1Oc1cccc(C)c1C ZINC000561088029 1043882962 /nfs/dbraw/zinc/88/29/62/1043882962.db2.gz RXPGIOCLLHJCFJ-UHFFFAOYSA-N 1 2 322.412 4.319 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3c[nH]cc3C3CC3)c2)[nH+]c1C ZINC000878392321 1043884062 /nfs/dbraw/zinc/88/40/62/1043884062.db2.gz ISGNQXIAUFSJHW-UHFFFAOYSA-N 1 2 320.396 4.151 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2ccc(C)c(Cl)n2)C2CC2)s1 ZINC000878412428 1043887136 /nfs/dbraw/zinc/88/71/36/1043887136.db2.gz VGLYODLRWSUBSL-CYBMUJFWSA-N 1 2 307.850 4.049 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CCC2)no1)c1csc2ccccc12 ZINC000878420976 1043889864 /nfs/dbraw/zinc/88/98/64/1043889864.db2.gz RUFIVVUFHHOLSM-NSHDSACASA-N 1 2 313.426 4.403 20 0 DIADLO CC[N@H+](Cc1c(Cl)ccc(Br)c1F)C1CC1 ZINC001141887770 1043895918 /nfs/dbraw/zinc/89/59/18/1043895918.db2.gz TZIUUPSMHPBWGA-UHFFFAOYSA-N 1 2 306.606 4.226 20 0 DIADLO CC[N@@H+](Cc1c(Cl)ccc(Br)c1F)C1CC1 ZINC001141887770 1043895928 /nfs/dbraw/zinc/89/59/28/1043895928.db2.gz TZIUUPSMHPBWGA-UHFFFAOYSA-N 1 2 306.606 4.226 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000289923565 1043896621 /nfs/dbraw/zinc/89/66/21/1043896621.db2.gz UKFUTISCANFELR-SNVBAGLBSA-N 1 2 312.385 4.189 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000289923565 1043896628 /nfs/dbraw/zinc/89/66/28/1043896628.db2.gz UKFUTISCANFELR-SNVBAGLBSA-N 1 2 312.385 4.189 20 0 DIADLO CC[C@H](C)[N@H+](Cc1ncn(-c2ccccc2)n1)Cc1ccccc1 ZINC000356954920 1043900264 /nfs/dbraw/zinc/90/02/64/1043900264.db2.gz CHKPFHGZXZEYJJ-KRWDZBQOSA-N 1 2 320.440 4.068 20 0 DIADLO CC[C@H](C)[N@@H+](Cc1ncn(-c2ccccc2)n1)Cc1ccccc1 ZINC000356954920 1043900269 /nfs/dbraw/zinc/90/02/69/1043900269.db2.gz CHKPFHGZXZEYJJ-KRWDZBQOSA-N 1 2 320.440 4.068 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2c(F)ccc(C)c2F)C2CC2)n1 ZINC000930236402 1043901224 /nfs/dbraw/zinc/90/12/24/1043901224.db2.gz AXIOMRYEOWOGFB-HNNXBMFYSA-N 1 2 308.397 4.279 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(C(F)(F)F)co1 ZINC000878534218 1043901986 /nfs/dbraw/zinc/90/19/86/1043901986.db2.gz MDYJPQMNXLOODN-GMSGAONNSA-N 1 2 301.230 4.071 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(C(F)(F)F)co1 ZINC000878534218 1043901992 /nfs/dbraw/zinc/90/19/92/1043901992.db2.gz MDYJPQMNXLOODN-GMSGAONNSA-N 1 2 301.230 4.071 20 0 DIADLO CSc1ccccc1[C@H](C)[NH2+]Cc1nc2c(o1)CCCC2 ZINC000878554406 1043902712 /nfs/dbraw/zinc/90/27/12/1043902712.db2.gz BLOVMILQWLPBGQ-LBPRGKRZSA-N 1 2 302.443 4.126 20 0 DIADLO CSc1ccccc1[C@H](C)[NH2+]Cc1nc(C(C)C)ns1 ZINC000930325528 1043912312 /nfs/dbraw/zinc/91/23/12/1043912312.db2.gz MNAATUDNUZWYSJ-NSHDSACASA-N 1 2 307.488 4.234 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cn(C(C)C)nn1)c1ccc(Cl)cc1F ZINC000290060347 1043913721 /nfs/dbraw/zinc/91/37/21/1043913721.db2.gz HEBSYVMLCZUTOS-INIZCTEOSA-N 1 2 324.831 4.138 20 0 DIADLO CCc1cccc(F)c1C[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000474801516 1043924091 /nfs/dbraw/zinc/92/40/91/1043924091.db2.gz MJPUZZRIOQECOY-UHFFFAOYSA-N 1 2 310.372 4.333 20 0 DIADLO C[N@H+](Cc1nc(-c2ccoc2)no1)Cc1ccc2ccccc2c1 ZINC000357250185 1043934244 /nfs/dbraw/zinc/93/42/44/1043934244.db2.gz ATJZOMNXHACOSK-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccoc2)no1)Cc1ccc2ccccc2c1 ZINC000357250185 1043934263 /nfs/dbraw/zinc/93/42/63/1043934263.db2.gz ATJZOMNXHACOSK-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO CCc1onc(C)c1C[N@@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC000930654048 1043952012 /nfs/dbraw/zinc/95/20/12/1043952012.db2.gz BPLQOKAVWJYYDR-KRWDZBQOSA-N 1 2 324.428 4.149 20 0 DIADLO CCc1onc(C)c1C[N@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC000930654048 1043952020 /nfs/dbraw/zinc/95/20/20/1043952020.db2.gz BPLQOKAVWJYYDR-KRWDZBQOSA-N 1 2 324.428 4.149 20 0 DIADLO Clc1cccc2c(NCc3ccn4ccnc4c3)cc[nH+]c12 ZINC000357443770 1043952115 /nfs/dbraw/zinc/95/21/15/1043952115.db2.gz WICVPBOODCKRBZ-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO Clc1cccc2c(NCc3ccn4cc[nH+]c4c3)ccnc12 ZINC000357443770 1043952124 /nfs/dbraw/zinc/95/21/24/1043952124.db2.gz WICVPBOODCKRBZ-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO CCc1onc(C)c1C[N@@H+]1CCCC[C@@H]1c1nc2ccccc2[nH]1 ZINC000930654054 1043952280 /nfs/dbraw/zinc/95/22/80/1043952280.db2.gz BPLQOKAVWJYYDR-QGZVFWFLSA-N 1 2 324.428 4.149 20 0 DIADLO CCc1onc(C)c1C[N@H+]1CCCC[C@@H]1c1nc2ccccc2[nH]1 ZINC000930654054 1043952284 /nfs/dbraw/zinc/95/22/84/1043952284.db2.gz BPLQOKAVWJYYDR-QGZVFWFLSA-N 1 2 324.428 4.149 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2nc(Cl)ccc2Cl)s1 ZINC000879252155 1043952518 /nfs/dbraw/zinc/95/25/18/1043952518.db2.gz IFPUKUZQVWOHOR-ZETCQYMHSA-N 1 2 302.230 4.004 20 0 DIADLO CC(C)OCc1noc(C[N@H+](C(C)C)[C@@H](C)c2ccsc2)n1 ZINC000930750518 1043959547 /nfs/dbraw/zinc/95/95/47/1043959547.db2.gz GWJSRHQRXWCLEB-ZDUSSCGKSA-N 1 2 323.462 4.028 20 0 DIADLO CC(C)OCc1noc(C[N@@H+](C(C)C)[C@@H](C)c2ccsc2)n1 ZINC000930750518 1043959553 /nfs/dbraw/zinc/95/95/53/1043959553.db2.gz GWJSRHQRXWCLEB-ZDUSSCGKSA-N 1 2 323.462 4.028 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]C2(c3cccc(Br)c3)CC2)no1 ZINC000290606508 1043966239 /nfs/dbraw/zinc/96/62/39/1043966239.db2.gz HQELETDJZFUSTI-LLVKDONJSA-N 1 2 321.218 4.085 20 0 DIADLO COCc1nc(CNc2cc[nH+]c3c(Cl)cccc23)cs1 ZINC000357583573 1043966659 /nfs/dbraw/zinc/96/66/59/1043966659.db2.gz QYEPLTSIARGSDJ-UHFFFAOYSA-N 1 2 319.817 4.103 20 0 DIADLO Clc1ccc2cccnc2c1C[N@H+](Cc1ccccn1)C1CC1 ZINC000357611191 1043968762 /nfs/dbraw/zinc/96/87/62/1043968762.db2.gz SIDPLAXMXJKPHS-UHFFFAOYSA-N 1 2 323.827 4.448 20 0 DIADLO Clc1ccc2cccnc2c1C[N@@H+](Cc1ccccn1)C1CC1 ZINC000357611191 1043968778 /nfs/dbraw/zinc/96/87/78/1043968778.db2.gz SIDPLAXMXJKPHS-UHFFFAOYSA-N 1 2 323.827 4.448 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+]1CCC[C@H]1c1noc(C)n1 ZINC000329423543 1043975621 /nfs/dbraw/zinc/97/56/21/1043975621.db2.gz IFOMIRBSRVDWCF-HNNXBMFYSA-N 1 2 311.385 4.024 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+]1CCC[C@H]1c1noc(C)n1 ZINC000329423543 1043975628 /nfs/dbraw/zinc/97/56/28/1043975628.db2.gz IFOMIRBSRVDWCF-HNNXBMFYSA-N 1 2 311.385 4.024 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc([C@@H]3CCCOC3)cc2)c(C)[nH+]1 ZINC000329396428 1043975857 /nfs/dbraw/zinc/97/58/57/1043975857.db2.gz WCFFLFAFHFXWCQ-GOSISDBHSA-N 1 2 324.424 4.153 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1csc(-c2ccoc2)n1 ZINC000357776504 1043986551 /nfs/dbraw/zinc/98/65/51/1043986551.db2.gz WFMHQPAQDVXCME-ZDUSSCGKSA-N 1 2 310.422 4.350 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1csc(-c2ccoc2)n1 ZINC000357776504 1043986559 /nfs/dbraw/zinc/98/65/59/1043986559.db2.gz WFMHQPAQDVXCME-ZDUSSCGKSA-N 1 2 310.422 4.350 20 0 DIADLO Cc1cncc([C@H]2CCC[N@@H+]2Cc2ccc(C)nc2Cl)c1 ZINC000879751422 1043989310 /nfs/dbraw/zinc/98/93/10/1043989310.db2.gz IIBQYJBMUMPEJG-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cncc([C@H]2CCC[N@H+]2Cc2ccc(C)nc2Cl)c1 ZINC000879751422 1043989315 /nfs/dbraw/zinc/98/93/15/1043989315.db2.gz IIBQYJBMUMPEJG-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO C[C@H]([NH2+]Cc1coc(C(C)(C)C)n1)c1ccc2c(c1)CCCO2 ZINC000931080504 1043990840 /nfs/dbraw/zinc/99/08/40/1043990840.db2.gz RSDMLVVDTQOTPF-ZDUSSCGKSA-N 1 2 314.429 4.148 20 0 DIADLO CC1(C)CCC[N@@H+]1Cc1cc(F)c(Br)cc1F ZINC001141910118 1043994021 /nfs/dbraw/zinc/99/40/21/1043994021.db2.gz JWWGLLYGGPMAMP-UHFFFAOYSA-N 1 2 304.178 4.102 20 0 DIADLO CC1(C)CCC[N@H+]1Cc1cc(F)c(Br)cc1F ZINC001141910118 1043994027 /nfs/dbraw/zinc/99/40/27/1043994027.db2.gz JWWGLLYGGPMAMP-UHFFFAOYSA-N 1 2 304.178 4.102 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+](Cn3ncsc3=S)CC2)cc1 ZINC000777969362 1044000961 /nfs/dbraw/zinc/00/09/61/1044000961.db2.gz IPUIPFFHVHONJY-LBPRGKRZSA-N 1 2 323.462 4.040 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+](Cn3ncsc3=S)CC2)cc1 ZINC000777969362 1044000974 /nfs/dbraw/zinc/00/09/74/1044000974.db2.gz IPUIPFFHVHONJY-LBPRGKRZSA-N 1 2 323.462 4.040 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](c2ccc(F)cc2)[C@@H]2CCCO2)cs1 ZINC000358014052 1044007539 /nfs/dbraw/zinc/00/75/39/1044007539.db2.gz BJWLQFLJRUHATO-MZPVMMEZSA-N 1 2 320.433 4.162 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000358067910 1044013531 /nfs/dbraw/zinc/01/35/31/1044013531.db2.gz QGUKNPFOSQBVKD-HNNXBMFYSA-N 1 2 305.468 4.044 20 0 DIADLO CSc1ccccc1C[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000358067910 1044013547 /nfs/dbraw/zinc/01/35/47/1044013547.db2.gz QGUKNPFOSQBVKD-HNNXBMFYSA-N 1 2 305.468 4.044 20 0 DIADLO c1cnc(C2([NH2+]Cc3ccc(C4CCCC4)cc3)CCC2)nc1 ZINC000880367538 1044032589 /nfs/dbraw/zinc/03/25/89/1044032589.db2.gz GZTXODMKADFBDF-UHFFFAOYSA-N 1 2 307.441 4.303 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)[nH]1 ZINC000358237294 1044038488 /nfs/dbraw/zinc/03/84/88/1044038488.db2.gz LAPLIDXGCDDTSH-STQMWFEESA-N 1 2 310.401 4.039 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+][C@@H](c1cccc(F)c1)c1ccccn1 ZINC000358241794 1044040420 /nfs/dbraw/zinc/04/04/20/1044040420.db2.gz TYQDLPUPWYMWBJ-YWZLYKJASA-N 1 2 321.399 4.364 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H]2CC(C)(C)Cc3occc32)s1 ZINC000358264347 1044044830 /nfs/dbraw/zinc/04/48/30/1044044830.db2.gz HSRAJPDLJSHSPX-GFCCVEGCSA-N 1 2 305.447 4.058 20 0 DIADLO CCOc1ccc([C@H]2CCCN2c2cc(C)[nH+]c(C3CC3)n2)cc1 ZINC000522567715 1044045937 /nfs/dbraw/zinc/04/59/37/1044045937.db2.gz RITYUDHNPGCPSL-GOSISDBHSA-N 1 2 323.440 4.403 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[NH2+]Cc1nnc(C(C)C)s1 ZINC000358299425 1044051056 /nfs/dbraw/zinc/05/10/56/1044051056.db2.gz OIJHKVONVQURAX-JTQLQIEISA-N 1 2 324.519 4.401 20 0 DIADLO Cc1csc(C[NH+](Cc2cccnc2)Cc2cccnc2)c1 ZINC001137156982 1044051606 /nfs/dbraw/zinc/05/16/06/1044051606.db2.gz HCZYWDPVNQDMIW-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO COc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1cccc(F)c1F)C2 ZINC000562059810 1044058925 /nfs/dbraw/zinc/05/89/25/1044058925.db2.gz IYSOXDWQCDZBSK-UHFFFAOYSA-N 1 2 315.363 4.021 20 0 DIADLO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1cccc(F)c1F)C2 ZINC000562059810 1044058940 /nfs/dbraw/zinc/05/89/40/1044058940.db2.gz IYSOXDWQCDZBSK-UHFFFAOYSA-N 1 2 315.363 4.021 20 0 DIADLO CC[C@H](C)CN(CC)C(=O)C[N@H+](CC)Cc1ccccc1Cl ZINC001137158743 1044060104 /nfs/dbraw/zinc/06/01/04/1044060104.db2.gz GCDLGBAGZPWUPC-HNNXBMFYSA-N 1 2 324.896 4.057 20 0 DIADLO CC[C@H](C)CN(CC)C(=O)C[N@@H+](CC)Cc1ccccc1Cl ZINC001137158743 1044060113 /nfs/dbraw/zinc/06/01/13/1044060113.db2.gz GCDLGBAGZPWUPC-HNNXBMFYSA-N 1 2 324.896 4.057 20 0 DIADLO Fc1cncc(F)c1C[N@@H+]1CCCSC[C@H]1c1ccccc1 ZINC000931694659 1044060986 /nfs/dbraw/zinc/06/09/86/1044060986.db2.gz NBURTLDWLFTBBS-KRWDZBQOSA-N 1 2 320.408 4.040 20 0 DIADLO Fc1cncc(F)c1C[N@H+]1CCCSC[C@H]1c1ccccc1 ZINC000931694659 1044061000 /nfs/dbraw/zinc/06/10/00/1044061000.db2.gz NBURTLDWLFTBBS-KRWDZBQOSA-N 1 2 320.408 4.040 20 0 DIADLO CC[N@H+](Cc1ccnc(Cl)c1Cl)[C@@H](C)c1cccnc1 ZINC000291508880 1044079080 /nfs/dbraw/zinc/07/90/80/1044079080.db2.gz IDBANTUZOGSGCV-NSHDSACASA-N 1 2 310.228 4.367 20 0 DIADLO CC[N@@H+](Cc1ccnc(Cl)c1Cl)[C@@H](C)c1cccnc1 ZINC000291508880 1044079096 /nfs/dbraw/zinc/07/90/96/1044079096.db2.gz IDBANTUZOGSGCV-NSHDSACASA-N 1 2 310.228 4.367 20 0 DIADLO Cc1nnc(C[N@@H+]2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)s1 ZINC000358624618 1044088343 /nfs/dbraw/zinc/08/83/43/1044088343.db2.gz NAOBOJWAZCITTR-MRXNPFEDSA-N 1 2 315.486 4.481 20 0 DIADLO Cc1nnc(C[N@H+]2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)s1 ZINC000358624618 1044088358 /nfs/dbraw/zinc/08/83/58/1044088358.db2.gz NAOBOJWAZCITTR-MRXNPFEDSA-N 1 2 315.486 4.481 20 0 DIADLO Cc1nnc(C[N@@H+]2CCC[C@H]2c2ccc(C(C)(C)C)cc2)s1 ZINC000358624617 1044088425 /nfs/dbraw/zinc/08/84/25/1044088425.db2.gz NAOBOJWAZCITTR-INIZCTEOSA-N 1 2 315.486 4.481 20 0 DIADLO Cc1nnc(C[N@H+]2CCC[C@H]2c2ccc(C(C)(C)C)cc2)s1 ZINC000358624617 1044088437 /nfs/dbraw/zinc/08/84/37/1044088437.db2.gz NAOBOJWAZCITTR-INIZCTEOSA-N 1 2 315.486 4.481 20 0 DIADLO CCCCC[N@H+](Cc1nnc(C)s1)Cc1ccc(F)cc1 ZINC000358633088 1044088932 /nfs/dbraw/zinc/08/89/32/1044088932.db2.gz ICRBFHJYFBQAAI-UHFFFAOYSA-N 1 2 307.438 4.178 20 0 DIADLO CCCCC[N@@H+](Cc1nnc(C)s1)Cc1ccc(F)cc1 ZINC000358633088 1044088947 /nfs/dbraw/zinc/08/89/47/1044088947.db2.gz ICRBFHJYFBQAAI-UHFFFAOYSA-N 1 2 307.438 4.178 20 0 DIADLO CCc1nc(C)c(C[NH2+]Cc2ccc(Oc3ccccc3)o2)o1 ZINC000291683563 1044095503 /nfs/dbraw/zinc/09/55/03/1044095503.db2.gz DUIQEGUCERUZPT-UHFFFAOYSA-N 1 2 312.369 4.221 20 0 DIADLO c1cn(-c2ccc(CSCc3ccc4c(c3)COC4)cc2)c[nH+]1 ZINC000778055729 1044095987 /nfs/dbraw/zinc/09/59/87/1044095987.db2.gz YVLFNARJNGJMAE-UHFFFAOYSA-N 1 2 322.433 4.336 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@@H]2CCCOc3ccc(Cl)cc32)n1 ZINC000562318109 1044100148 /nfs/dbraw/zinc/10/01/48/1044100148.db2.gz UUHYYLSNAPGIMN-MRXNPFEDSA-N 1 2 319.836 4.121 20 0 DIADLO Clc1ccc(C[N@H+](Cc2ccccc2)Cc2ccccn2)cn1 ZINC001137162884 1044101881 /nfs/dbraw/zinc/10/18/81/1044101881.db2.gz ODXXPXOFDKVNLD-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1ccc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)cn1 ZINC001137162884 1044101885 /nfs/dbraw/zinc/10/18/85/1044101885.db2.gz ODXXPXOFDKVNLD-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1cccnc1C[NH2+][C@H]1CC2(CCC2)Oc2ccccc21 ZINC000932212293 1044109486 /nfs/dbraw/zinc/10/94/86/1044109486.db2.gz AEFIAHRYLPORJA-HNNXBMFYSA-N 1 2 314.816 4.271 20 0 DIADLO CCc1cccc(C[N@H+](Cc2ccco2)Cc2cccnc2)c1 ZINC000346576764 1044119170 /nfs/dbraw/zinc/11/91/70/1044119170.db2.gz SWDMUCVMZGZMHT-UHFFFAOYSA-N 1 2 306.409 4.439 20 0 DIADLO CCc1cccc(C[N@@H+](Cc2ccco2)Cc2cccnc2)c1 ZINC000346576764 1044119178 /nfs/dbraw/zinc/11/91/78/1044119178.db2.gz SWDMUCVMZGZMHT-UHFFFAOYSA-N 1 2 306.409 4.439 20 0 DIADLO O=C(Nc1cccc(C2CCC2)c1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000291975106 1044120899 /nfs/dbraw/zinc/12/08/99/1044120899.db2.gz DZODBSSTFDIION-MRXNPFEDSA-N 1 2 324.428 4.089 20 0 DIADLO Cc1nc([C@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)cs1 ZINC000346579590 1044121107 /nfs/dbraw/zinc/12/11/07/1044121107.db2.gz STUVKPJLDCKSSJ-LBPRGKRZSA-N 1 2 302.447 4.010 20 0 DIADLO c1sc(C2CCCC2)nc1C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000932381964 1044121637 /nfs/dbraw/zinc/12/16/37/1044121637.db2.gz OEKXFZUPOBQLJE-QGZVFWFLSA-N 1 2 313.470 4.437 20 0 DIADLO Fc1ccc(-c2cnc(C[NH2+][C@H](c3ccccn3)C3CC3)o2)cc1 ZINC000932381703 1044122802 /nfs/dbraw/zinc/12/28/02/1044122802.db2.gz RWXNXAZXNUQCKO-IBGZPJMESA-N 1 2 323.371 4.117 20 0 DIADLO Fc1ccc(-c2cnc(C[NH2+][C@@H](c3ccccn3)C3CC3)o2)cc1 ZINC000932381705 1044122850 /nfs/dbraw/zinc/12/28/50/1044122850.db2.gz RWXNXAZXNUQCKO-LJQANCHMSA-N 1 2 323.371 4.117 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@H]3CCSc4ccccc43)cc2[nH+]1 ZINC000359049150 1044124621 /nfs/dbraw/zinc/12/46/21/1044124621.db2.gz ZSBUBRWNTXXBAB-AWEZNQCLSA-N 1 2 323.421 4.089 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1nc(-c2ccccc2)cs1 ZINC000350390676 1044124793 /nfs/dbraw/zinc/12/47/93/1044124793.db2.gz KOVGKKBIGSPNJM-AWEZNQCLSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1nc(-c2ccccc2)cs1 ZINC000350390676 1044124798 /nfs/dbraw/zinc/12/47/98/1044124798.db2.gz KOVGKKBIGSPNJM-AWEZNQCLSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1nc(-c2ccccc2)cs1 ZINC000350390677 1044125170 /nfs/dbraw/zinc/12/51/70/1044125170.db2.gz KOVGKKBIGSPNJM-CQSZACIVSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1nc(-c2ccccc2)cs1 ZINC000350390677 1044125174 /nfs/dbraw/zinc/12/51/74/1044125174.db2.gz KOVGKKBIGSPNJM-CQSZACIVSA-N 1 2 309.438 4.398 20 0 DIADLO FC(F)(F)CC[N@H+](Cc1nc2ccccc2s1)C1CC1 ZINC000932398356 1044126354 /nfs/dbraw/zinc/12/63/54/1044126354.db2.gz IOURICSJRVSMCU-UHFFFAOYSA-N 1 2 300.349 4.213 20 0 DIADLO FC(F)(F)CC[N@@H+](Cc1nc2ccccc2s1)C1CC1 ZINC000932398356 1044126359 /nfs/dbraw/zinc/12/63/59/1044126359.db2.gz IOURICSJRVSMCU-UHFFFAOYSA-N 1 2 300.349 4.213 20 0 DIADLO Cc1ccc(-c2ccc(C(=O)Nc3cccc4[nH+]ccn43)s2)o1 ZINC000359076448 1044129030 /nfs/dbraw/zinc/12/90/30/1044129030.db2.gz LPHMOYGNGYTHLW-UHFFFAOYSA-N 1 2 323.377 4.217 20 0 DIADLO CCCC[N@H+](Cc1nnc(C2CC2)o1)Cc1c(C)oc(C)c1C ZINC000932500072 1044134880 /nfs/dbraw/zinc/13/48/80/1044134880.db2.gz LZTSEJWHSVUFOF-UHFFFAOYSA-N 1 2 317.433 4.268 20 0 DIADLO CCCC[N@@H+](Cc1nnc(C2CC2)o1)Cc1c(C)oc(C)c1C ZINC000932500072 1044134888 /nfs/dbraw/zinc/13/48/88/1044134888.db2.gz LZTSEJWHSVUFOF-UHFFFAOYSA-N 1 2 317.433 4.268 20 0 DIADLO C[C@@H](CCNc1ccccc1C[NH+]1CCOCC1)c1ccccc1 ZINC000562612818 1044137843 /nfs/dbraw/zinc/13/78/43/1044137843.db2.gz OCVKWFZMJIOUAC-SFHVURJKSA-N 1 2 324.468 4.125 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@H](C)c2ccc(F)cc2C)n1 ZINC000932557874 1044142431 /nfs/dbraw/zinc/14/24/31/1044142431.db2.gz VKCCYILSMYIGGG-VXGBXAGGSA-N 1 2 323.437 4.182 20 0 DIADLO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1nc(-c2cccs2)no1 ZINC000932567911 1044144932 /nfs/dbraw/zinc/14/49/32/1044144932.db2.gz WKQOFZUHACGRDR-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1nc(-c2ccsc2)no1 ZINC000932566512 1044145108 /nfs/dbraw/zinc/14/51/08/1044145108.db2.gz FKXXRSWVJRLJTO-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO Cc1oncc1C[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F ZINC000932568173 1044145325 /nfs/dbraw/zinc/14/53/25/1044145325.db2.gz PMIFYIJBFNFQEG-ZETCQYMHSA-N 1 2 303.164 4.280 20 0 DIADLO CC(C)[C@H](c1ccccc1)N(C)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC000932655936 1044153007 /nfs/dbraw/zinc/15/30/07/1044153007.db2.gz WRFKCVAGNUEXCD-GOSISDBHSA-N 1 2 307.397 4.032 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1Oc1ccccc1)c1nncn1C ZINC000346932373 1044173920 /nfs/dbraw/zinc/17/39/20/1044173920.db2.gz AXQZTPKLSRUBKM-GJZGRUSLSA-N 1 2 322.412 4.019 20 0 DIADLO c1csc(-c2cc(C[N@@H+]3CCC[C@@H]3c3cccnc3)no2)c1 ZINC000346982540 1044180997 /nfs/dbraw/zinc/18/09/97/1044180997.db2.gz MPAURODNKKBSSS-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2cc(C[N@H+]3CCC[C@@H]3c3cccnc3)no2)c1 ZINC000346982540 1044181003 /nfs/dbraw/zinc/18/10/03/1044181003.db2.gz MPAURODNKKBSSS-OAHLLOKOSA-N 1 2 311.410 4.135 20 0 DIADLO Cc1sc(C[NH2+][C@@H](C)c2ccc(Cl)cn2)nc1C(C)C ZINC000359677966 1044189510 /nfs/dbraw/zinc/18/95/10/1044189510.db2.gz PDBDJWDIXYEIQY-JTQLQIEISA-N 1 2 309.866 4.474 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@H+](C)Cc1cccc(=O)[nH]1 ZINC000933397615 1044195195 /nfs/dbraw/zinc/19/51/95/1044195195.db2.gz FWPNRNPJVJCMJQ-SNVBAGLBSA-N 1 2 311.212 4.287 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@@H+](C)Cc1cccc(=O)[nH]1 ZINC000933397615 1044195205 /nfs/dbraw/zinc/19/52/05/1044195205.db2.gz FWPNRNPJVJCMJQ-SNVBAGLBSA-N 1 2 311.212 4.287 20 0 DIADLO CC(C)c1cc(N2CC[C@H](c3nccs3)C2)nc(C(C)C)[nH+]1 ZINC000882858477 1044199154 /nfs/dbraw/zinc/19/91/54/1044199154.db2.gz IEBXYZTUNZVFHR-ZDUSSCGKSA-N 1 2 316.474 4.174 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cn(C(C)C)nc2C)c1 ZINC000281838633 1044199275 /nfs/dbraw/zinc/19/92/75/1044199275.db2.gz KHFBQQVXXXTTEB-UHFFFAOYSA-N 1 2 304.463 4.033 20 0 DIADLO COCc1cnc(C[NH2+][C@@H](C)c2oc3ccccc3c2C)s1 ZINC000359790486 1044201283 /nfs/dbraw/zinc/20/12/83/1044201283.db2.gz CFNRKGSALKUMIL-LBPRGKRZSA-N 1 2 316.426 4.195 20 0 DIADLO Cc1cc(CNC(=O)Nc2cccc(C3CCC3)c2)cc(C)[nH+]1 ZINC000562935936 1044209581 /nfs/dbraw/zinc/20/95/81/1044209581.db2.gz JJRAOKDWZALTDZ-UHFFFAOYSA-N 1 2 309.413 4.288 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)c(C)n1 ZINC000359878489 1044210317 /nfs/dbraw/zinc/21/03/17/1044210317.db2.gz PIXHFJYXFYZCCI-ZDUSSCGKSA-N 1 2 302.368 4.096 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)c(C)n1 ZINC000359878489 1044210330 /nfs/dbraw/zinc/21/03/30/1044210330.db2.gz PIXHFJYXFYZCCI-ZDUSSCGKSA-N 1 2 302.368 4.096 20 0 DIADLO CSc1ccc(C[NH2+][C@H](C)c2nc3ccccc3s2)o1 ZINC000883001798 1044214082 /nfs/dbraw/zinc/21/40/82/1044214082.db2.gz NURZWFKSJDQZBJ-SNVBAGLBSA-N 1 2 304.440 4.462 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)n1 ZINC000883083366 1044221148 /nfs/dbraw/zinc/22/11/48/1044221148.db2.gz JOMNUBQJKZBEOW-CQSZACIVSA-N 1 2 319.836 4.190 20 0 DIADLO c1cn(-c2ccccc2OCc2cc(-c3ccccc3)on2)c[nH+]1 ZINC000522893371 1044237850 /nfs/dbraw/zinc/23/78/50/1044237850.db2.gz PHFKDKZLUURNNM-UHFFFAOYSA-N 1 2 317.348 4.106 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+][C@@H](CC2CCC2)c2ccccc2)o1 ZINC000778237702 1044240135 /nfs/dbraw/zinc/24/01/35/1044240135.db2.gz RKCKDNLZUMLKFC-INIZCTEOSA-N 1 2 313.445 4.388 20 0 DIADLO CC[C@@H]([NH2+]Cc1nn(C)cc1C(F)F)c1sccc1Cl ZINC000883242742 1044243338 /nfs/dbraw/zinc/24/33/38/1044243338.db2.gz PRQXWRRVQDVQNQ-SNVBAGLBSA-N 1 2 319.808 4.314 20 0 DIADLO C/C=C\c1ccc(NC(=O)c2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000360314722 1044256657 /nfs/dbraw/zinc/25/66/57/1044256657.db2.gz BOYHONZQGKSTHH-RQOWECAXSA-N 1 2 303.365 4.158 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1cnn(CC2CCC2)c1 ZINC000934552849 1044257425 /nfs/dbraw/zinc/25/74/25/1044257425.db2.gz XCSNLEUUIYLXJT-GFCCVEGCSA-N 1 2 321.827 4.327 20 0 DIADLO COc1nc(C)cc(C)c1C[N@H+](C)[C@H](C)c1ccccc1F ZINC000563557068 1044281817 /nfs/dbraw/zinc/28/18/17/1044281817.db2.gz ICHNWYLIHLMAJF-CQSZACIVSA-N 1 2 302.393 4.039 20 0 DIADLO COc1nc(C)cc(C)c1C[N@@H+](C)[C@H](C)c1ccccc1F ZINC000563557068 1044281831 /nfs/dbraw/zinc/28/18/31/1044281831.db2.gz ICHNWYLIHLMAJF-CQSZACIVSA-N 1 2 302.393 4.039 20 0 DIADLO COc1ccc([C@H](Nc2cc[nH+]c(C)n2)c2ccc(F)cc2)cc1 ZINC000360534927 1044282862 /nfs/dbraw/zinc/28/28/62/1044282862.db2.gz LYCQPWIMOCDXFJ-LJQANCHMSA-N 1 2 323.371 4.134 20 0 DIADLO CC(C)c1ncc(C[NH2+][C@@H]2c3ccccc3CC[C@@H]2F)s1 ZINC000883383106 1044296417 /nfs/dbraw/zinc/29/64/17/1044296417.db2.gz TWZJBRSIBUWVDK-JKSUJKDBSA-N 1 2 304.434 4.382 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC000360736304 1044304149 /nfs/dbraw/zinc/30/41/49/1044304149.db2.gz JMIGRRWGLRRJSU-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC000360736304 1044304158 /nfs/dbraw/zinc/30/41/58/1044304158.db2.gz JMIGRRWGLRRJSU-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO CSCc1cnc(CNc2ccc([NH+]3CCCC3)cc2)s1 ZINC000293722355 1044319436 /nfs/dbraw/zinc/31/94/36/1044319436.db2.gz YOVOYWQIYYZUII-UHFFFAOYSA-N 1 2 319.499 4.218 20 0 DIADLO Cc1ccc2c(Nc3cnnc(Cl)c3Cl)cccc2[nH+]1 ZINC001212796280 1044325855 /nfs/dbraw/zinc/32/58/55/1044325855.db2.gz WJOSQCZMDPWUAW-UHFFFAOYSA-N 1 2 305.168 4.384 20 0 DIADLO Cc1ccc2c(Nc3cc(-c4ccncc4)no3)cccc2[nH+]1 ZINC001212796211 1044325919 /nfs/dbraw/zinc/32/59/19/1044325919.db2.gz SZVNVWCRCNBLDF-UHFFFAOYSA-N 1 2 302.337 4.337 20 0 DIADLO Cc1cc(Nc2cccc3[nH+]c(C)ccc23)n(C2CCOCC2)n1 ZINC001212796275 1044326076 /nfs/dbraw/zinc/32/60/76/1044326076.db2.gz WBTNRKYKTYIQPU-UHFFFAOYSA-N 1 2 322.412 4.143 20 0 DIADLO Cc1nsc(C)c1C[NH2+]C1(c2c(F)cccc2F)CCC1 ZINC000626179175 1044329353 /nfs/dbraw/zinc/32/93/53/1044329353.db2.gz YXWCQCDEHTWMFN-UHFFFAOYSA-N 1 2 308.397 4.207 20 0 DIADLO CC[N@H+](Cc1ccc(C)nc1)Cc1ccccc1Br ZINC000360983032 1044338357 /nfs/dbraw/zinc/33/83/57/1044338357.db2.gz LKPJQXLWISBOBY-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccc(C)nc1)Cc1ccccc1Br ZINC000360983032 1044338365 /nfs/dbraw/zinc/33/83/65/1044338365.db2.gz LKPJQXLWISBOBY-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000475276782 1044339592 /nfs/dbraw/zinc/33/95/92/1044339592.db2.gz BTDFYKNKLPUNBY-VHSXEESVSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000475276782 1044339609 /nfs/dbraw/zinc/33/96/09/1044339609.db2.gz BTDFYKNKLPUNBY-VHSXEESVSA-N 1 2 306.397 4.213 20 0 DIADLO Cc1ccc2c(Nc3ncccc3N3CCCC3)cccc2[nH+]1 ZINC001212796765 1044339649 /nfs/dbraw/zinc/33/96/49/1044339649.db2.gz BFKFLMZQJQNFNP-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO CCn1c2ccccc2nc1[C@@H]1CCC[N@@H+]1Cc1ccc(C)nc1 ZINC000360976116 1044340434 /nfs/dbraw/zinc/34/04/34/1044340434.db2.gz RSDWANWZFCTAPQ-IBGZPJMESA-N 1 2 320.440 4.097 20 0 DIADLO CCn1c2ccccc2nc1[C@@H]1CCC[N@H+]1Cc1ccc(C)nc1 ZINC000360976116 1044340447 /nfs/dbraw/zinc/34/04/47/1044340447.db2.gz RSDWANWZFCTAPQ-IBGZPJMESA-N 1 2 320.440 4.097 20 0 DIADLO Cc1ccc2c(Nc3cccc(-n4ccnc4)c3)cccc2[nH+]1 ZINC001212796863 1044346134 /nfs/dbraw/zinc/34/61/34/1044346134.db2.gz IRAZSMZUXVYIBH-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO COc1cc(F)c([C@H](C)[NH2+][C@@H](C)c2nc(C)cs2)cc1OC ZINC000361012313 1044346735 /nfs/dbraw/zinc/34/67/35/1044346735.db2.gz IQTZIIIQAUFNPF-QWRGUYRKSA-N 1 2 324.421 4.020 20 0 DIADLO Cc1cnn(-c2ccccn2)c1Nc1cccc2[nH+]c(C)ccc12 ZINC001212797127 1044355794 /nfs/dbraw/zinc/35/57/94/1044355794.db2.gz ZJASVNCZLJHRCA-UHFFFAOYSA-N 1 2 315.380 4.176 20 0 DIADLO Fc1cccc(NCc2c[nH+]cn2Cc2ccccc2)c1Cl ZINC000564199578 1044357471 /nfs/dbraw/zinc/35/74/71/1044357471.db2.gz MYTSPIOXPBNYRV-UHFFFAOYSA-N 1 2 315.779 4.336 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C[C@H]1CCCC1(F)F ZINC000935759227 1044364404 /nfs/dbraw/zinc/36/44/04/1044364404.db2.gz HSBZDGFXVHAIRX-CYBMUJFWSA-N 1 2 319.355 4.149 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1C[C@@H]2C[C@@H]2C[C@H]1C ZINC000935759500 1044366485 /nfs/dbraw/zinc/36/64/85/1044366485.db2.gz JTJMDXAAXWDTHD-SYAUCNOPSA-N 1 2 309.413 4.006 20 0 DIADLO Cc1ccc2c(Nc3ccc(C4=NCCO4)cc3)cccc2[nH+]1 ZINC001212797679 1044370269 /nfs/dbraw/zinc/37/02/69/1044370269.db2.gz DEYZPQKFTUDJMN-UHFFFAOYSA-N 1 2 303.365 4.064 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2cc(-c3ccco3)on2)s1 ZINC000106879100 1044372918 /nfs/dbraw/zinc/37/29/18/1044372918.db2.gz WDXWMDJKAZPSNI-NSHDSACASA-N 1 2 317.414 4.201 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2cc(-c3ccco3)on2)s1 ZINC000106879100 1044372933 /nfs/dbraw/zinc/37/29/33/1044372933.db2.gz WDXWMDJKAZPSNI-NSHDSACASA-N 1 2 317.414 4.201 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@@H](C)c2cc(C)cc(C)c2)n1 ZINC000107071881 1044375681 /nfs/dbraw/zinc/37/56/81/1044375681.db2.gz RUDBCCYUNZPOBC-LSDHHAIUSA-N 1 2 301.434 4.441 20 0 DIADLO Cc1cc(C)c(NC(=O)C[NH+]2CCC(C(C)C)CC2)c(Cl)c1 ZINC000475371371 1044383679 /nfs/dbraw/zinc/38/36/79/1044383679.db2.gz VCNDBTFZMCHYSI-UHFFFAOYSA-N 1 2 322.880 4.263 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2ncoc2-c2ccccc2)cc1F ZINC000361289670 1044384405 /nfs/dbraw/zinc/38/44/05/1044384405.db2.gz VZLCYWIECSXKNH-UHFFFAOYSA-N 1 2 318.298 4.049 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cncc(C(F)(F)F)c1 ZINC000361286921 1044385828 /nfs/dbraw/zinc/38/58/28/1044385828.db2.gz HYLJCGAOKCLJJQ-NSHDSACASA-N 1 2 312.310 4.433 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cncc(C(F)(F)F)c1 ZINC000361286921 1044385844 /nfs/dbraw/zinc/38/58/44/1044385844.db2.gz HYLJCGAOKCLJJQ-NSHDSACASA-N 1 2 312.310 4.433 20 0 DIADLO C[N@H+](Cc1cncc(C(F)(F)F)c1)Cc1ccccc1Cl ZINC000361290788 1044385943 /nfs/dbraw/zinc/38/59/43/1044385943.db2.gz UORJXMOIQGORBM-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1cncc(C(F)(F)F)c1)Cc1ccccc1Cl ZINC000361290788 1044385962 /nfs/dbraw/zinc/38/59/62/1044385962.db2.gz UORJXMOIQGORBM-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO Cc1ccc2sc(C(=O)Nc3cccc4[nH+]ccn43)cc2c1 ZINC000564484661 1044386438 /nfs/dbraw/zinc/38/64/38/1044386438.db2.gz SOWPLTLGIHSION-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cncc(C(F)(F)F)c2)C1 ZINC000361339808 1044395105 /nfs/dbraw/zinc/39/51/05/1044395105.db2.gz UXFZFPOYQSHXKO-LRDDRELGSA-N 1 2 321.346 4.079 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cncc(C(F)(F)F)c2)C1 ZINC000361339808 1044395120 /nfs/dbraw/zinc/39/51/20/1044395120.db2.gz UXFZFPOYQSHXKO-LRDDRELGSA-N 1 2 321.346 4.079 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2cncc(C(F)(F)F)c2)C1 ZINC000361339807 1044395763 /nfs/dbraw/zinc/39/57/63/1044395763.db2.gz UXFZFPOYQSHXKO-BLLLJJGKSA-N 1 2 321.346 4.079 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cncc(C(F)(F)F)c2)C1 ZINC000361339807 1044395778 /nfs/dbraw/zinc/39/57/78/1044395778.db2.gz UXFZFPOYQSHXKO-BLLLJJGKSA-N 1 2 321.346 4.079 20 0 DIADLO FC(F)(F)c1cncc(C[N@@H+]2Cc3ccccc3C3(CC3)C2)c1 ZINC000361374032 1044399898 /nfs/dbraw/zinc/39/98/98/1044399898.db2.gz DMXRSGITHUUXTM-UHFFFAOYSA-N 1 2 318.342 4.148 20 0 DIADLO FC(F)(F)c1cncc(C[N@H+]2Cc3ccccc3C3(CC3)C2)c1 ZINC000361374032 1044399910 /nfs/dbraw/zinc/39/99/10/1044399910.db2.gz DMXRSGITHUUXTM-UHFFFAOYSA-N 1 2 318.342 4.148 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](Cc1ccccc1)Cc1ncccn1 ZINC000361402060 1044401666 /nfs/dbraw/zinc/40/16/66/1044401666.db2.gz GEYMMQWUSMLKTM-QGZVFWFLSA-N 1 2 303.409 4.240 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](Cc1ccccc1)Cc1ncccn1 ZINC000361402060 1044401668 /nfs/dbraw/zinc/40/16/68/1044401668.db2.gz GEYMMQWUSMLKTM-QGZVFWFLSA-N 1 2 303.409 4.240 20 0 DIADLO Cc1ccncc1C[N@@H+](C)[C@H](C)c1ncc(-c2ccccc2)o1 ZINC000361444892 1044403159 /nfs/dbraw/zinc/40/31/59/1044403159.db2.gz ZSFLUABWTYNYSP-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccncc1C[N@H+](C)[C@H](C)c1ncc(-c2ccccc2)o1 ZINC000361444892 1044403167 /nfs/dbraw/zinc/40/31/67/1044403167.db2.gz ZSFLUABWTYNYSP-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Fc1ccc([C@@H]2C[C@H]2Nc2[nH+]cccc2-n2cccc2)cc1F ZINC001168065266 1044403172 /nfs/dbraw/zinc/40/31/72/1044403172.db2.gz ZNQOEKSHASIJKD-XJKSGUPXSA-N 1 2 311.335 4.119 20 0 DIADLO CSCc1cnc(C[N@H+](Cc2ccccc2)C2CC2)s1 ZINC000294339531 1044408536 /nfs/dbraw/zinc/40/85/36/1044408536.db2.gz ANFGARQVNDXSRA-UHFFFAOYSA-N 1 2 304.484 4.171 20 0 DIADLO CSCc1cnc(C[N@@H+](Cc2ccccc2)C2CC2)s1 ZINC000294339531 1044408543 /nfs/dbraw/zinc/40/85/43/1044408543.db2.gz ANFGARQVNDXSRA-UHFFFAOYSA-N 1 2 304.484 4.171 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2nccn2-c2ccccc2)cc1 ZINC000361498607 1044409216 /nfs/dbraw/zinc/40/92/16/1044409216.db2.gz VDXXSYVMIUWZMH-LJQANCHMSA-N 1 2 321.399 4.349 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2nccn2-c2ccccc2)cc1 ZINC000361498607 1044409224 /nfs/dbraw/zinc/40/92/24/1044409224.db2.gz VDXXSYVMIUWZMH-LJQANCHMSA-N 1 2 321.399 4.349 20 0 DIADLO C[N@H+](Cc1nccn1-c1ccccc1)Cc1cccc(Cl)c1 ZINC000361498165 1044410105 /nfs/dbraw/zinc/41/01/05/1044410105.db2.gz RVJFOPITUNVTGQ-UHFFFAOYSA-N 1 2 311.816 4.158 20 0 DIADLO C[N@@H+](Cc1nccn1-c1ccccc1)Cc1cccc(Cl)c1 ZINC000361498165 1044410111 /nfs/dbraw/zinc/41/01/11/1044410111.db2.gz RVJFOPITUNVTGQ-UHFFFAOYSA-N 1 2 311.816 4.158 20 0 DIADLO COCC[N@H+](Cc1cccs1)Cc1ccsc1Cl ZINC000361495638 1044410446 /nfs/dbraw/zinc/41/04/46/1044410446.db2.gz GNJZGEPOZWQAGQ-UHFFFAOYSA-N 1 2 301.864 4.112 20 0 DIADLO COCC[N@@H+](Cc1cccs1)Cc1ccsc1Cl ZINC000361495638 1044410450 /nfs/dbraw/zinc/41/04/50/1044410450.db2.gz GNJZGEPOZWQAGQ-UHFFFAOYSA-N 1 2 301.864 4.112 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2oc(-c3ccccc3)nc2C)n1 ZINC000639582036 1044410904 /nfs/dbraw/zinc/41/09/04/1044410904.db2.gz ZNMRXOADRPHDJZ-ZDUSSCGKSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@@H](CC[NH2+][C@H](c1cccs1)c1nnc[nH]1)CC(C)(C)C ZINC000294374599 1044412353 /nfs/dbraw/zinc/41/23/53/1044412353.db2.gz RCNFOKFSKYVSLP-GXTWGEPZSA-N 1 2 306.479 4.008 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@H](c2ccccc2)C2CCCC2)no1 ZINC000109800717 1044413132 /nfs/dbraw/zinc/41/31/32/1044413132.db2.gz YYUKBBAAWXKNGM-QGZVFWFLSA-N 1 2 313.445 4.388 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1nc3ccccc3s1)C2 ZINC000361562081 1044418742 /nfs/dbraw/zinc/41/87/42/1044418742.db2.gz KBWSDSRFMADKJS-UHFFFAOYSA-N 1 2 322.433 4.049 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@H+](Cc1nc3ccccc3s1)C2 ZINC000361562081 1044418751 /nfs/dbraw/zinc/41/87/51/1044418751.db2.gz KBWSDSRFMADKJS-UHFFFAOYSA-N 1 2 322.433 4.049 20 0 DIADLO Cc1noc([C@@H](C)[N@H+](C)Cc2cc(-c3ccccc3)cs2)n1 ZINC000565229098 1044420996 /nfs/dbraw/zinc/42/09/96/1044420996.db2.gz KPYSFRRKNGRMTL-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2cc(-c3ccccc3)cs2)n1 ZINC000565229098 1044420999 /nfs/dbraw/zinc/42/09/99/1044420999.db2.gz KPYSFRRKNGRMTL-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(OC(F)F)c([C@@H](C)[NH2+][C@H](C)c2cscn2)c1 ZINC000565247606 1044423909 /nfs/dbraw/zinc/42/39/09/1044423909.db2.gz UVWHQNYRQFBRHV-GHMZBOCLSA-N 1 2 312.385 4.465 20 0 DIADLO Cc1ccc(C)c([C@H](C)N(C)C(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC000565278006 1044426096 /nfs/dbraw/zinc/42/60/96/1044426096.db2.gz WVLKHJFDRDYBAX-HNNXBMFYSA-N 1 2 322.412 4.176 20 0 DIADLO CO[C@H](c1ccccc1)[C@@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000565392973 1044431691 /nfs/dbraw/zinc/43/16/91/1044431691.db2.gz QCUXZUVWXZSUIH-PBHICJAKSA-N 1 2 305.368 4.144 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccn1)c1ccccc1Oc1ccccc1 ZINC000361861609 1044452893 /nfs/dbraw/zinc/45/28/93/1044452893.db2.gz DFDKYTLQINJBPP-OAHLLOKOSA-N 1 2 305.381 4.120 20 0 DIADLO CCCC(C)(C)CC(=O)N[C@H]1CC[C@H](Nc2cccc[nH+]2)CC1 ZINC000565782871 1044458115 /nfs/dbraw/zinc/45/81/15/1044458115.db2.gz PZOZWCZDLUTCPA-WKILWMFISA-N 1 2 317.477 4.137 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)n1 ZINC000114745676 1044459451 /nfs/dbraw/zinc/45/94/51/1044459451.db2.gz AEEIUDSZDGMWTA-VHSXEESVSA-N 1 2 313.323 4.063 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CCC=C(c2ccccn2)C1 ZINC000565870980 1044461564 /nfs/dbraw/zinc/46/15/64/1044461564.db2.gz UMCMZINMRPOZGR-AWEZNQCLSA-N 1 2 311.429 4.217 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCC=C(c2ccccn2)C1 ZINC000565870980 1044461569 /nfs/dbraw/zinc/46/15/69/1044461569.db2.gz UMCMZINMRPOZGR-AWEZNQCLSA-N 1 2 311.429 4.217 20 0 DIADLO CSc1ccccc1C[N@H+](C)CC(=O)c1c[nH]c2ccccc21 ZINC000348302706 1044462433 /nfs/dbraw/zinc/46/24/33/1044462433.db2.gz DGDQRCFUOBXOEE-UHFFFAOYSA-N 1 2 324.449 4.205 20 0 DIADLO CSc1ccccc1C[N@@H+](C)CC(=O)c1c[nH]c2ccccc21 ZINC000348302706 1044462437 /nfs/dbraw/zinc/46/24/37/1044462437.db2.gz DGDQRCFUOBXOEE-UHFFFAOYSA-N 1 2 324.449 4.205 20 0 DIADLO Cc1cc(C[N@H+](C)CC(=O)Nc2c(C)cc(C)cc2C)cs1 ZINC000294852758 1044466037 /nfs/dbraw/zinc/46/60/37/1044466037.db2.gz OZVVUCJIXIUWAM-UHFFFAOYSA-N 1 2 316.470 4.052 20 0 DIADLO Cc1cc(C[N@@H+](C)CC(=O)Nc2c(C)cc(C)cc2C)cs1 ZINC000294852758 1044466043 /nfs/dbraw/zinc/46/60/43/1044466043.db2.gz OZVVUCJIXIUWAM-UHFFFAOYSA-N 1 2 316.470 4.052 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@H]2c2cccs2)s1 ZINC000294921198 1044473875 /nfs/dbraw/zinc/47/38/75/1044473875.db2.gz OCBFZBGBNANVGX-LBPRGKRZSA-N 1 2 310.513 4.405 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@H]2c2cccs2)s1 ZINC000294921198 1044473883 /nfs/dbraw/zinc/47/38/83/1044473883.db2.gz OCBFZBGBNANVGX-LBPRGKRZSA-N 1 2 310.513 4.405 20 0 DIADLO Cc1cccc(NC(=O)Nc2ccccc2-n2cc[nH+]c2)c1C ZINC001202692477 1044474062 /nfs/dbraw/zinc/47/40/62/1044474062.db2.gz PEHUJOFZTHUPPE-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO Cc1nnc(C[N@@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)o1 ZINC000117346613 1044478909 /nfs/dbraw/zinc/47/89/09/1044478909.db2.gz BVCJESMKIHOQSH-HNNXBMFYSA-N 1 2 305.809 4.149 20 0 DIADLO Cc1nnc(C[N@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)o1 ZINC000117346613 1044478922 /nfs/dbraw/zinc/47/89/22/1044478922.db2.gz BVCJESMKIHOQSH-HNNXBMFYSA-N 1 2 305.809 4.149 20 0 DIADLO Cc1csc(C[N@@H+](C)Cc2cccc(C(F)(F)F)c2)n1 ZINC000118406552 1044483631 /nfs/dbraw/zinc/48/36/31/1044483631.db2.gz HEGOJTZTFPLQJK-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1csc(C[N@H+](C)Cc2cccc(C(F)(F)F)c2)n1 ZINC000118406552 1044483641 /nfs/dbraw/zinc/48/36/41/1044483641.db2.gz HEGOJTZTFPLQJK-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2nc(-c3ccccc3)c[nH]2)ccc1F ZINC000362323177 1044500547 /nfs/dbraw/zinc/50/05/47/1044500547.db2.gz NLZZWIBBFADEOU-UHFFFAOYSA-N 1 2 309.388 4.156 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2nc(-c3ccccc3)c[nH]2)ccc1F ZINC000362323177 1044500562 /nfs/dbraw/zinc/50/05/62/1044500562.db2.gz NLZZWIBBFADEOU-UHFFFAOYSA-N 1 2 309.388 4.156 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+][C@H](C)c2nc(C(C)C)no2)c1 ZINC000120238349 1044504096 /nfs/dbraw/zinc/50/40/96/1044504096.db2.gz HVRSXEZENBZZAX-UONOGXRCSA-N 1 2 317.433 4.392 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccccc2)no1)c1cccc(C2CC2)c1 ZINC000295313627 1044508438 /nfs/dbraw/zinc/50/84/38/1044508438.db2.gz GFTYKKKGVBQIOS-AWEZNQCLSA-N 1 2 319.408 4.465 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](c2ncccc2C)C(C)C)cs1 ZINC000120773351 1044512467 /nfs/dbraw/zinc/51/24/67/1044512467.db2.gz FNGJMTULPCNADO-MRXNPFEDSA-N 1 2 303.475 4.286 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSC[C@@H]1CCO[C@@H](C)C1 ZINC000362457696 1044516104 /nfs/dbraw/zinc/51/61/04/1044516104.db2.gz QIZPEZGNVQFKEG-JKSUJKDBSA-N 1 2 316.470 4.229 20 0 DIADLO Cc1nc(C[NH+]2CCC(c3c(F)cccc3F)CC2)cs1 ZINC000362524631 1044524275 /nfs/dbraw/zinc/52/42/75/1044524275.db2.gz IPTYSJPWXJQYFQ-UHFFFAOYSA-N 1 2 308.397 4.109 20 0 DIADLO CC[C@H](c1ccccc1)N(CC)C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000566923800 1044527656 /nfs/dbraw/zinc/52/76/56/1044527656.db2.gz OPDMTZPOCLSBFB-GOSISDBHSA-N 1 2 321.424 4.256 20 0 DIADLO COc1cccc2c(NCc3cc(C4CC4)no3)c(C)c[nH+]c12 ZINC000884637628 1044543847 /nfs/dbraw/zinc/54/38/47/1044543847.db2.gz VDMKKRCWVSSDLQ-UHFFFAOYSA-N 1 2 309.369 4.029 20 0 DIADLO C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)[N@H+]1Cc1csc(Cl)n1 ZINC000295598218 1044545240 /nfs/dbraw/zinc/54/52/40/1044545240.db2.gz CCCUTYXSKKGLRF-DJLDLDEBSA-N 1 2 312.788 4.348 20 0 DIADLO C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)[N@@H+]1Cc1csc(Cl)n1 ZINC000295598218 1044545253 /nfs/dbraw/zinc/54/52/53/1044545253.db2.gz CCCUTYXSKKGLRF-DJLDLDEBSA-N 1 2 312.788 4.348 20 0 DIADLO CCCCc1noc(C[N@H+](C)[C@H](CC)c2cccc(OC)c2)n1 ZINC000567142583 1044545618 /nfs/dbraw/zinc/54/56/18/1044545618.db2.gz WSGVUJUVPUNPNK-MRXNPFEDSA-N 1 2 317.433 4.004 20 0 DIADLO CCCCc1noc(C[N@@H+](C)[C@H](CC)c2cccc(OC)c2)n1 ZINC000567142583 1044545639 /nfs/dbraw/zinc/54/56/39/1044545639.db2.gz WSGVUJUVPUNPNK-MRXNPFEDSA-N 1 2 317.433 4.004 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2nccs2)ccc1SC ZINC000362966959 1044572345 /nfs/dbraw/zinc/57/23/45/1044572345.db2.gz KPZYGSFGHAVDMX-ZDUSSCGKSA-N 1 2 320.483 4.211 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2nccs2)ccc1SC ZINC000362966959 1044572361 /nfs/dbraw/zinc/57/23/61/1044572361.db2.gz KPZYGSFGHAVDMX-ZDUSSCGKSA-N 1 2 320.483 4.211 20 0 DIADLO Cc1ccn2cc(C[NH2+]Cc3cc(Cl)ccc3Cl)nc2c1 ZINC001649171189 1044589540 /nfs/dbraw/zinc/58/95/40/1044589540.db2.gz LWHDTCGADCJFET-UHFFFAOYSA-N 1 2 320.223 4.239 20 0 DIADLO Oc1ccc2c(c1)CC[N@@H+](Cc1ccc3cccc(Cl)c3n1)C2 ZINC001137221544 1044590859 /nfs/dbraw/zinc/59/08/59/1044590859.db2.gz SPNVEFNUKXDQBK-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1ccc2c(c1)CC[N@H+](Cc1ccc3cccc(Cl)c3n1)C2 ZINC001137221544 1044590872 /nfs/dbraw/zinc/59/08/72/1044590872.db2.gz SPNVEFNUKXDQBK-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Cc1[nH]nc(CNc2ccc([N@H+]3CCCC[C@@H]3C)cc2C)c1C ZINC000886040432 1044602843 /nfs/dbraw/zinc/60/28/43/1044602843.db2.gz YZDOXRYCSPLTCS-AWEZNQCLSA-N 1 2 312.461 4.326 20 0 DIADLO Cc1[nH]nc(CNc2ccc([N@@H+]3CCCC[C@@H]3C)cc2C)c1C ZINC000886040432 1044602849 /nfs/dbraw/zinc/60/28/49/1044602849.db2.gz YZDOXRYCSPLTCS-AWEZNQCLSA-N 1 2 312.461 4.326 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+](C)Cc2cc(C)cc(C)c2)n1 ZINC000444699038 1044605287 /nfs/dbraw/zinc/60/52/87/1044605287.db2.gz DQKKLTUXSWHMTK-HNNXBMFYSA-N 1 2 301.434 4.222 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+](C)Cc2cc(C)cc(C)c2)n1 ZINC000444699038 1044605294 /nfs/dbraw/zinc/60/52/94/1044605294.db2.gz DQKKLTUXSWHMTK-HNNXBMFYSA-N 1 2 301.434 4.222 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(Cl)n1)c1ccc(OC(F)F)cc1 ZINC000296296712 1044605573 /nfs/dbraw/zinc/60/55/73/1044605573.db2.gz MIQRQVIILFHSCH-MRVPVSSYSA-N 1 2 318.776 4.249 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+](C)Cc2cc(C)cc(C)c2)n1 ZINC000444699047 1044606676 /nfs/dbraw/zinc/60/66/76/1044606676.db2.gz DQKKLTUXSWHMTK-OAHLLOKOSA-N 1 2 301.434 4.222 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+](C)Cc2cc(C)cc(C)c2)n1 ZINC000444699047 1044606690 /nfs/dbraw/zinc/60/66/90/1044606690.db2.gz DQKKLTUXSWHMTK-OAHLLOKOSA-N 1 2 301.434 4.222 20 0 DIADLO Clc1cccc2ccc(C[N@@H+]3CCOc4ccccc4C3)nc12 ZINC001137224490 1044607154 /nfs/dbraw/zinc/60/71/54/1044607154.db2.gz KRWKJQUWPDYGMH-UHFFFAOYSA-N 1 2 324.811 4.283 20 0 DIADLO Clc1cccc2ccc(C[N@H+]3CCOc4ccccc4C3)nc12 ZINC001137224490 1044607158 /nfs/dbraw/zinc/60/71/58/1044607158.db2.gz KRWKJQUWPDYGMH-UHFFFAOYSA-N 1 2 324.811 4.283 20 0 DIADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H](CC1CCCCC1)C(C)(C)C ZINC000568199257 1044610136 /nfs/dbraw/zinc/61/01/36/1044610136.db2.gz RJLRLVIGZRNDNL-YOEHRIQHSA-N 1 2 319.493 4.090 20 0 DIADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H](CC1CCCCC1)C(C)(C)C ZINC000568199257 1044610139 /nfs/dbraw/zinc/61/01/39/1044610139.db2.gz RJLRLVIGZRNDNL-YOEHRIQHSA-N 1 2 319.493 4.090 20 0 DIADLO COC(=O)c1oc([C@H](C)[N@H+](C)Cc2cc(C)ccc2F)cc1C ZINC000444735089 1044613831 /nfs/dbraw/zinc/61/38/31/1044613831.db2.gz ONYCDDILXBQBFM-ZDUSSCGKSA-N 1 2 319.376 4.015 20 0 DIADLO COC(=O)c1oc([C@H](C)[N@@H+](C)Cc2cc(C)ccc2F)cc1C ZINC000444735089 1044613838 /nfs/dbraw/zinc/61/38/38/1044613838.db2.gz ONYCDDILXBQBFM-ZDUSSCGKSA-N 1 2 319.376 4.015 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+]Cc1nnc(C(C)C)s1 ZINC000296398527 1044615312 /nfs/dbraw/zinc/61/53/12/1044615312.db2.gz VNVGCNHYBCDWSO-AWEZNQCLSA-N 1 2 319.474 4.301 20 0 DIADLO Cc1cnc([C@H](C)[N@H+](C)Cc2ccc(Br)cc2C)o1 ZINC000444719685 1044616368 /nfs/dbraw/zinc/61/63/68/1044616368.db2.gz ZTCAEKQAXPUJBM-LBPRGKRZSA-N 1 2 323.234 4.247 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+](C)Cc2ccc(Br)cc2C)o1 ZINC000444719685 1044616371 /nfs/dbraw/zinc/61/63/71/1044616371.db2.gz ZTCAEKQAXPUJBM-LBPRGKRZSA-N 1 2 323.234 4.247 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2csc(-c3ccoc3)n2)ccc1F ZINC000444744623 1044618802 /nfs/dbraw/zinc/61/88/02/1044618802.db2.gz QCUHNDQIDWPPIH-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2csc(-c3ccoc3)n2)ccc1F ZINC000444744623 1044618805 /nfs/dbraw/zinc/61/88/05/1044618805.db2.gz QCUHNDQIDWPPIH-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccco3)cc2F)c2nccn21 ZINC000296500798 1044622499 /nfs/dbraw/zinc/62/24/99/1044622499.db2.gz QAUWNMMNTKWIOS-BLLLJJGKSA-N 1 2 311.360 4.078 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ncc(C(F)(F)F)cn2)c(C)s1 ZINC000296510638 1044625463 /nfs/dbraw/zinc/62/54/63/1044625463.db2.gz PMODOBQVSVRTPZ-SECBINFHSA-N 1 2 315.364 4.025 20 0 DIADLO CCc1c2ccccc2oc1[C@H](C)[NH2+]Cc1nnc(C(C)C)[nH]1 ZINC000296583631 1044628965 /nfs/dbraw/zinc/62/89/65/1044628965.db2.gz UMMRWGPBLGRRCA-LBPRGKRZSA-N 1 2 312.417 4.088 20 0 DIADLO Cc1cc(C[NH2+]Cc2cc(C3CC3)no2)c(OC(F)F)cc1C ZINC000886272082 1044629244 /nfs/dbraw/zinc/62/92/44/1044629244.db2.gz GKVPKWHQRHJYGM-UHFFFAOYSA-N 1 2 322.355 4.060 20 0 DIADLO CC(C)c1ccc([C@H](C)[NH2+]Cc2ncc(C(F)(F)F)cn2)cc1 ZINC000296643957 1044638789 /nfs/dbraw/zinc/63/87/89/1044638789.db2.gz YHWAKCJAIPOQRC-LBPRGKRZSA-N 1 2 323.362 4.470 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)Cc3ccccc3F)c2)[nH+]c1C ZINC000363628730 1044639925 /nfs/dbraw/zinc/63/99/25/1044639925.db2.gz RAVHHJKVSSRDRL-UHFFFAOYSA-N 1 2 323.371 4.014 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)[nH]1 ZINC000296656094 1044641245 /nfs/dbraw/zinc/64/12/45/1044641245.db2.gz ZIXHECWMPHZWJF-SNVBAGLBSA-N 1 2 318.808 4.179 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2ccc(F)cc2)o1)c1cscn1 ZINC000568778852 1044649213 /nfs/dbraw/zinc/64/92/13/1044649213.db2.gz JTRGHGMAPJTMLT-LLVKDONJSA-N 1 2 302.374 4.393 20 0 DIADLO CC[C@](C)([NH2+]Cc1cnc(-c2ccccc2)nc1)c1nccs1 ZINC000523527619 1044654612 /nfs/dbraw/zinc/65/46/12/1044654612.db2.gz BRDQIGPQHKXSBE-SFHVURJKSA-N 1 2 324.453 4.015 20 0 DIADLO C[C@H]([NH2+]Cc1ncoc1-c1ccccc1)c1cc(F)ccc1F ZINC000364492735 1044666013 /nfs/dbraw/zinc/66/60/13/1044666013.db2.gz HZQGNXSTTGZGPU-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO CCCCN(CCCC)C(=O)[C@H]1CCc2[nH+]c(C(C)C)[nH]c2C1 ZINC000364539668 1044668399 /nfs/dbraw/zinc/66/83/99/1044668399.db2.gz SCHWCDRZCIGODY-HNNXBMFYSA-N 1 2 319.493 4.067 20 0 DIADLO CCCCN(CCCC)C(=O)[C@H]1CCc2[nH]c(C(C)C)[nH+]c2C1 ZINC000364539668 1044668404 /nfs/dbraw/zinc/66/84/04/1044668404.db2.gz SCHWCDRZCIGODY-HNNXBMFYSA-N 1 2 319.493 4.067 20 0 DIADLO Fc1cccc(F)c1C1([NH2+][C@@H]2CCc3cccnc32)CCC1 ZINC000886644799 1044672644 /nfs/dbraw/zinc/67/26/44/1044672644.db2.gz KUNNRTWQHYWROH-OAHLLOKOSA-N 1 2 300.352 4.016 20 0 DIADLO C[NH+](C)[C@H](c1nc([C@@H]2CCCC(C)(C)C2)no1)c1ccccc1 ZINC000569272876 1044689610 /nfs/dbraw/zinc/68/96/10/1044689610.db2.gz ILQLGVKMKAONRP-CVEARBPZSA-N 1 2 313.445 4.404 20 0 DIADLO FC(F)(F)C1CC[NH+](Cc2cc(-c3cccs3)on2)CC1 ZINC000075969261 1044691985 /nfs/dbraw/zinc/69/19/85/1044691985.db2.gz JPYLSMKBFLVOSK-UHFFFAOYSA-N 1 2 316.348 4.177 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@@H](C)c2ccccn2)c2ccccn2)cc1 ZINC000366276928 1044717682 /nfs/dbraw/zinc/71/76/82/1044717682.db2.gz ZYKZLRQNMFPPBD-JXFKEZNVSA-N 1 2 303.409 4.225 20 0 DIADLO CC1(C)CCc2onc(C[NH2+][C@@H]3CCc4c3cccc4F)c2C1 ZINC000886928675 1044719213 /nfs/dbraw/zinc/71/92/13/1044719213.db2.gz KGUIGWSSYZBQNO-MRXNPFEDSA-N 1 2 314.404 4.106 20 0 DIADLO CCc1ccccc1C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000366523562 1044720699 /nfs/dbraw/zinc/72/06/99/1044720699.db2.gz UAMHSSYJFQGSQW-UHFFFAOYSA-N 1 2 305.381 4.200 20 0 DIADLO Cc1cc(N2C[C@H](c3ccc(F)cc3)C[C@H]2C)nc(C2CC2)[nH+]1 ZINC000524067900 1044726762 /nfs/dbraw/zinc/72/67/62/1044726762.db2.gz NLNXEDNTMKHTTA-CZUORRHYSA-N 1 2 311.404 4.184 20 0 DIADLO CCCC(CCC)[S@@](=O)Cc1c[nH+]cn1Cc1ccccc1 ZINC000445482894 1044731276 /nfs/dbraw/zinc/73/12/76/1044731276.db2.gz RJNCIJYVYANXBZ-QFIPXVFZSA-N 1 2 318.486 4.149 20 0 DIADLO Cc1cc(C)c(NC(=O)C2(Cc3ccc(F)cc3)CC2)c(C)[nH+]1 ZINC000445565014 1044754565 /nfs/dbraw/zinc/75/45/65/1044754565.db2.gz RGBMBDHPBXRPNG-UHFFFAOYSA-N 1 2 312.388 4.107 20 0 DIADLO Cc1cn2cc(NC(=O)Cc3ccc(CC(C)C)cc3)ccc2[nH+]1 ZINC000524165001 1044754873 /nfs/dbraw/zinc/75/48/73/1044754873.db2.gz IWFWFYNKCMQPRU-UHFFFAOYSA-N 1 2 321.424 4.022 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@@H](c2cnn(C)c2)c2ccccc2)o1 ZINC000368240701 1044771516 /nfs/dbraw/zinc/77/15/16/1044771516.db2.gz DRXBLQBHJPAUOD-LXGCGDOSSA-N 1 2 321.424 4.016 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1cccc(Cl)c1Cl ZINC000368423178 1044775521 /nfs/dbraw/zinc/77/55/21/1044775521.db2.gz BJIBXELQNODDNY-TVQRCGJNSA-N 1 2 310.228 4.445 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1Cl ZINC000368423178 1044775532 /nfs/dbraw/zinc/77/55/32/1044775532.db2.gz BJIBXELQNODDNY-TVQRCGJNSA-N 1 2 310.228 4.445 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1cccc(Cl)c1Cl ZINC000368423176 1044775711 /nfs/dbraw/zinc/77/57/11/1044775711.db2.gz BJIBXELQNODDNY-NOZJJQNGSA-N 1 2 310.228 4.445 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1Cl ZINC000368423176 1044775724 /nfs/dbraw/zinc/77/57/24/1044775724.db2.gz BJIBXELQNODDNY-NOZJJQNGSA-N 1 2 310.228 4.445 20 0 DIADLO c1[nH+]c(-c2cccc(N[C@H]3CC[C@@H]3C3CC3)c2)n2c1CCCC2 ZINC000570748357 1044779660 /nfs/dbraw/zinc/77/96/60/1044779660.db2.gz FETCVPPKUACAOU-MOPGFXCFSA-N 1 2 307.441 4.487 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccc(Cn3cc[nH+]c3)cc2)c(C)c1 ZINC001202746829 1044779603 /nfs/dbraw/zinc/77/96/03/1044779603.db2.gz IZIXHNNULHYWFY-UHFFFAOYSA-N 1 2 320.396 4.192 20 0 DIADLO c1n[nH]c2c1[C@@H]([NH2+][C@H](Cc1ccccc1)c1ccccc1)CCC2 ZINC000368608586 1044782018 /nfs/dbraw/zinc/78/20/18/1044782018.db2.gz QAPTVNSZOKXEKZ-PZJWPPBQSA-N 1 2 317.436 4.361 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)nc2ccccc12 ZINC000570828655 1044784816 /nfs/dbraw/zinc/78/48/16/1044784816.db2.gz WUWPHLMRBNGUQA-HXUWFJFHSA-N 1 2 321.399 4.009 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@](F)(c3ccccc3)C2)nc2ccccc12 ZINC000570828655 1044784824 /nfs/dbraw/zinc/78/48/24/1044784824.db2.gz WUWPHLMRBNGUQA-HXUWFJFHSA-N 1 2 321.399 4.009 20 0 DIADLO C[C@@H]([NH2+][C@@H](CO)c1c(Cl)cccc1Cl)c1ccccc1 ZINC000475633180 1044796656 /nfs/dbraw/zinc/79/66/56/1044796656.db2.gz GBDCVLAVUNEUQT-ABAIWWIYSA-N 1 2 310.224 4.378 20 0 DIADLO CCc1occc1C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC000369054474 1044797322 /nfs/dbraw/zinc/79/73/22/1044797322.db2.gz LDKHCRPCPQLWAG-UHFFFAOYSA-N 1 2 309.369 4.101 20 0 DIADLO Cc1cccc([C@H](c2noc(C[C@H](C)n3cc[nH+]c3)n2)C(C)C)c1 ZINC000571170725 1044800426 /nfs/dbraw/zinc/80/04/26/1044800426.db2.gz IXDUMCOKWCMNNN-MAUKXSAKSA-N 1 2 324.428 4.166 20 0 DIADLO CC[N@H+](C)[C@H](c1nc(CCC(C)(C)C)no1)c1ccccc1 ZINC000571244939 1044805085 /nfs/dbraw/zinc/80/50/85/1044805085.db2.gz FLGGQXVYCVPWFD-INIZCTEOSA-N 1 2 301.434 4.089 20 0 DIADLO CC[N@@H+](C)[C@H](c1nc(CCC(C)(C)C)no1)c1ccccc1 ZINC000571244939 1044805099 /nfs/dbraw/zinc/80/50/99/1044805099.db2.gz FLGGQXVYCVPWFD-INIZCTEOSA-N 1 2 301.434 4.089 20 0 DIADLO Cc1ccc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)nc1C ZINC001202760531 1044805844 /nfs/dbraw/zinc/80/58/44/1044805844.db2.gz SGSSQDXTNMDLDL-UHFFFAOYSA-N 1 2 308.381 4.374 20 0 DIADLO Cc1ccc(C)c(N(C)Cc2c[nH+]cn2Cc2ccccc2)c1 ZINC000445800150 1044819238 /nfs/dbraw/zinc/81/92/38/1044819238.db2.gz UMIPHEDUNHTJOI-UHFFFAOYSA-N 1 2 305.425 4.185 20 0 DIADLO CC[C@H](C)Sc1ccc(NC(=O)CCn2cc[nH+]c2)c(C)c1 ZINC000263856160 1044830184 /nfs/dbraw/zinc/83/01/84/1044830184.db2.gz ZSXUHSVLEPWBTK-AWEZNQCLSA-N 1 2 317.458 4.111 20 0 DIADLO CC(C)c1csc(C[NH2+][C@H]2CCCOc3ccc(F)cc32)n1 ZINC000128562135 1044836229 /nfs/dbraw/zinc/83/62/29/1044836229.db2.gz MKQKPCLZTHGEHE-AWEZNQCLSA-N 1 2 320.433 4.409 20 0 DIADLO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1noc(C2CCCCC2)n1 ZINC000445880825 1044841805 /nfs/dbraw/zinc/84/18/05/1044841805.db2.gz PTFZDDHMJRUEMN-GFCCVEGCSA-N 1 2 319.371 4.184 20 0 DIADLO Cc1cncc(C[N@@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)c1 ZINC000572619768 1044865320 /nfs/dbraw/zinc/86/53/20/1044865320.db2.gz HOJUOYZEDLLUNC-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1cncc(C[N@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)c1 ZINC000572619768 1044865338 /nfs/dbraw/zinc/86/53/38/1044865338.db2.gz HOJUOYZEDLLUNC-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1cncc(C[N@@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)c1 ZINC000572619767 1044867601 /nfs/dbraw/zinc/86/76/01/1044867601.db2.gz HOJUOYZEDLLUNC-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1cncc(C[N@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)c1 ZINC000572619767 1044867620 /nfs/dbraw/zinc/86/76/20/1044867620.db2.gz HOJUOYZEDLLUNC-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO CC(C)(C)Oc1ccc(NC(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC000572686002 1044868428 /nfs/dbraw/zinc/86/84/28/1044868428.db2.gz SWFHQTHLXAXGFW-UHFFFAOYSA-N 1 2 324.384 4.156 20 0 DIADLO COC[C@@H]([NH2+]Cc1ncc(C(C)C)s1)c1cccc(Cl)c1 ZINC000572796719 1044879935 /nfs/dbraw/zinc/87/99/35/1044879935.db2.gz VXZIOULVUKLJTM-CQSZACIVSA-N 1 2 324.877 4.397 20 0 DIADLO FC(F)(C[NH2+][C@@H]1CCCNc2ccccc21)c1ccccc1 ZINC000348444485 1044880657 /nfs/dbraw/zinc/88/06/57/1044880657.db2.gz ZDOLUVUYEWLEDT-QGZVFWFLSA-N 1 2 302.368 4.315 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1cnn(C2CCCC2)c1 ZINC000337494765 1044909181 /nfs/dbraw/zinc/90/91/81/1044909181.db2.gz XVQQXNFFULRKDG-LBPRGKRZSA-N 1 2 316.474 4.183 20 0 DIADLO CC[C@H](CC(=O)Nc1nc(C[NH+]2CCCCC2)cs1)C(C)C ZINC000524709108 1044909835 /nfs/dbraw/zinc/90/98/35/1044909835.db2.gz NNEFRUUIRKHTMU-CQSZACIVSA-N 1 2 323.506 4.140 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(F)cccc2Br)CCC1(F)F ZINC000573527960 1044911139 /nfs/dbraw/zinc/91/11/39/1044911139.db2.gz LXWDEFXDDSEVLD-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(F)cccc2Br)CCC1(F)F ZINC000573527960 1044911148 /nfs/dbraw/zinc/91/11/48/1044911148.db2.gz LXWDEFXDDSEVLD-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2cn(-c3ccccc3)nc2C(C)C)no1 ZINC000337555477 1044919110 /nfs/dbraw/zinc/91/91/10/1044919110.db2.gz VTZMURGZUJEDBL-OAHLLOKOSA-N 1 2 324.428 4.143 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CC[C@@]3(C2)OCc2ccccc23)c1 ZINC000573717441 1044920049 /nfs/dbraw/zinc/92/00/49/1044920049.db2.gz JLQBJMKKKCGEPQ-FQEVSTJZSA-N 1 2 320.367 4.010 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H]2CC(C)(C)Oc3cc(F)ccc32)no1 ZINC000337560242 1044920547 /nfs/dbraw/zinc/92/05/47/1044920547.db2.gz URMXDMSDBCVHIN-XHDPSFHLSA-N 1 2 304.365 4.075 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000133539026 1044940083 /nfs/dbraw/zinc/94/00/83/1044940083.db2.gz OTTZDXZJJMMKIO-NSHDSACASA-N 1 2 322.449 4.439 20 0 DIADLO Cc1cccc2nc(C[N@@H+]3CC(C)(C)[C@H]3c3cccs3)cn21 ZINC000574144598 1044940622 /nfs/dbraw/zinc/94/06/22/1044940622.db2.gz GNKPAYCTBXYRTH-QGZVFWFLSA-N 1 2 311.454 4.287 20 0 DIADLO Cc1cccc2nc(C[N@H+]3CC(C)(C)[C@H]3c3cccs3)cn21 ZINC000574144598 1044940634 /nfs/dbraw/zinc/94/06/34/1044940634.db2.gz GNKPAYCTBXYRTH-QGZVFWFLSA-N 1 2 311.454 4.287 20 0 DIADLO COc1cccc2c(N[C@@H](C)c3ccncc3F)c(C)c[nH+]c12 ZINC000337799389 1044951144 /nfs/dbraw/zinc/95/11/44/1044951144.db2.gz HKVQMJDYTCPEID-LBPRGKRZSA-N 1 2 311.360 4.259 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CC=C(c3cccc4ccccc43)CC2)[nH]1 ZINC000411217483 1044984428 /nfs/dbraw/zinc/98/44/28/1044984428.db2.gz YZBCVUZDCCXDCI-CQSZACIVSA-N 1 2 318.424 4.117 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CC=C(c3cccc4ccccc43)CC2)[nH]1 ZINC000411217483 1044984440 /nfs/dbraw/zinc/98/44/40/1044984440.db2.gz YZBCVUZDCCXDCI-CQSZACIVSA-N 1 2 318.424 4.117 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+]C2(c3ccccc3)CCC2)n1 ZINC000136346281 1044985414 /nfs/dbraw/zinc/98/54/14/1044985414.db2.gz BJCAZWKMEMSVBZ-ZDUSSCGKSA-N 1 2 317.458 4.053 20 0 DIADLO Cc1cnc(F)cc1Nc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001212845694 1044985582 /nfs/dbraw/zinc/98/55/82/1044985582.db2.gz GMGHJBCTAUUETE-UHFFFAOYSA-N 1 2 318.352 4.015 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@H+](C)Cc1nccs1 ZINC000137804432 1044994729 /nfs/dbraw/zinc/99/47/29/1044994729.db2.gz PVAQDTAELYFOHE-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@@H+](C)Cc1nccs1 ZINC000137804432 1044994748 /nfs/dbraw/zinc/99/47/48/1044994748.db2.gz PVAQDTAELYFOHE-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO CSc1ccccc1C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000373696216 1045001961 /nfs/dbraw/zinc/00/19/61/1045001961.db2.gz NTCHTLVKMVVQJO-UHFFFAOYSA-N 1 2 323.421 4.359 20 0 DIADLO Cc1noc(C[NH2+][C@H](c2cccc(Cl)c2)C2CCCCC2)n1 ZINC000150793269 1045008047 /nfs/dbraw/zinc/00/80/47/1045008047.db2.gz HBWVHEPYEINLNY-KRWDZBQOSA-N 1 2 319.836 4.443 20 0 DIADLO Cc1ccoc1C[NH2+][C@@H](C(=O)Nc1ccccc1)c1ccccc1 ZINC000525195811 1045010128 /nfs/dbraw/zinc/01/01/28/1045010128.db2.gz OSXZRIGQKRBLGW-LJQANCHMSA-N 1 2 320.392 4.058 20 0 DIADLO CCn1c(C[NH2+]Cc2ccc(C3CC3)cc2F)nc2ccccc21 ZINC000575811527 1045010531 /nfs/dbraw/zinc/01/05/31/1045010531.db2.gz ONYBNHRANAXPDK-UHFFFAOYSA-N 1 2 323.415 4.363 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(-c2ncco2)cc1F)c1nccs1 ZINC000411520889 1045015535 /nfs/dbraw/zinc/01/55/35/1045015535.db2.gz XHQGXGVPFKOMEO-AWEZNQCLSA-N 1 2 317.389 4.178 20 0 DIADLO CCc1nc(C[N@@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000525272711 1045019604 /nfs/dbraw/zinc/01/96/04/1045019604.db2.gz OCUSPGCLYPLLPF-MLGOLLRUSA-N 1 2 304.434 4.428 20 0 DIADLO CCc1nc(C[N@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000525272711 1045019612 /nfs/dbraw/zinc/01/96/12/1045019612.db2.gz OCUSPGCLYPLLPF-MLGOLLRUSA-N 1 2 304.434 4.428 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)s1 ZINC000575943550 1045021187 /nfs/dbraw/zinc/02/11/87/1045021187.db2.gz ZAWUZESOAWUBIY-OAHLLOKOSA-N 1 2 315.486 4.419 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)s1 ZINC000575943550 1045021199 /nfs/dbraw/zinc/02/11/99/1045021199.db2.gz ZAWUZESOAWUBIY-OAHLLOKOSA-N 1 2 315.486 4.419 20 0 DIADLO CCc1cnc(C[N@H+](C)[C@H](C)c2cccc(C(F)(F)F)c2)o1 ZINC000525270018 1045028875 /nfs/dbraw/zinc/02/88/75/1045028875.db2.gz OQMJHJYRMFVYIS-LLVKDONJSA-N 1 2 312.335 4.449 20 0 DIADLO CCc1cnc(C[N@@H+](C)[C@H](C)c2cccc(C(F)(F)F)c2)o1 ZINC000525270018 1045028884 /nfs/dbraw/zinc/02/88/84/1045028884.db2.gz OQMJHJYRMFVYIS-LLVKDONJSA-N 1 2 312.335 4.449 20 0 DIADLO CCc1ccc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3[nH]2)nc1 ZINC000411788645 1045031118 /nfs/dbraw/zinc/03/11/18/1045031118.db2.gz GUKOTUUYFPBCND-LJQANCHMSA-N 1 2 320.440 4.248 20 0 DIADLO CCc1ccc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3[nH]2)nc1 ZINC000411788645 1045031125 /nfs/dbraw/zinc/03/11/25/1045031125.db2.gz GUKOTUUYFPBCND-LJQANCHMSA-N 1 2 320.440 4.248 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc([C@H](C)C(F)(F)F)cc1)c1csnn1 ZINC000412035904 1045048487 /nfs/dbraw/zinc/04/84/87/1045048487.db2.gz HPMPADIVZHAEIH-VHSXEESVSA-N 1 2 315.364 4.055 20 0 DIADLO CC(C)(C)c1nc(C[NH2+]C2(c3cccc(F)c3)CC2)cs1 ZINC000152860578 1045049037 /nfs/dbraw/zinc/04/90/37/1045049037.db2.gz OELABEGQWDXLKY-UHFFFAOYSA-N 1 2 304.434 4.359 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+]Cc2cc(C)on2)cc1OC ZINC000153528512 1045057070 /nfs/dbraw/zinc/05/70/70/1045057070.db2.gz HUKDGOANYJYDFQ-AWEZNQCLSA-N 1 2 318.417 4.021 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)n1 ZINC000374505886 1045064600 /nfs/dbraw/zinc/06/46/00/1045064600.db2.gz OBCRKTRGHJOCFV-CQSZACIVSA-N 1 2 315.383 4.019 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)n1 ZINC000374505886 1045064616 /nfs/dbraw/zinc/06/46/16/1045064616.db2.gz OBCRKTRGHJOCFV-CQSZACIVSA-N 1 2 315.383 4.019 20 0 DIADLO CCC(CC)[C@H](NC(=O)C[C@H](C)n1cc[nH+]c1)c1ccccc1 ZINC000576588627 1045065820 /nfs/dbraw/zinc/06/58/20/1045065820.db2.gz VIHJIRWARKDKCJ-KXBFYZLASA-N 1 2 313.445 4.128 20 0 DIADLO COc1ccc(Cl)cc1C[C@H]1CCCN(c2cccc[nH+]2)C1 ZINC000525463154 1045072895 /nfs/dbraw/zinc/07/28/95/1045072895.db2.gz YZZOXRXHGYGHOB-CQSZACIVSA-N 1 2 316.832 4.203 20 0 DIADLO FCC1([NH2+]Cc2csc(-c3ccc(Cl)cc3)n2)CCC1 ZINC000576874546 1045086519 /nfs/dbraw/zinc/08/65/19/1045086519.db2.gz USXXHXJINUZCPA-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+](C)Cc3cc(C(C)(C)C)n[nH]3)cc2c1C ZINC000447067035 1045091721 /nfs/dbraw/zinc/09/17/21/1045091721.db2.gz IOFSNYQYKGOJTG-UHFFFAOYSA-N 1 2 324.472 4.437 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+](C)Cc3cc(C(C)(C)C)n[nH]3)cc2c1C ZINC000447067035 1045091733 /nfs/dbraw/zinc/09/17/33/1045091733.db2.gz IOFSNYQYKGOJTG-UHFFFAOYSA-N 1 2 324.472 4.437 20 0 DIADLO CC(C)CCn1cccc1C[N@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000447067711 1045094335 /nfs/dbraw/zinc/09/43/35/1045094335.db2.gz LHPPEFGHLNHELX-UHFFFAOYSA-N 1 2 316.493 4.187 20 0 DIADLO CC(C)CCn1cccc1C[N@@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000447067711 1045094353 /nfs/dbraw/zinc/09/43/53/1045094353.db2.gz LHPPEFGHLNHELX-UHFFFAOYSA-N 1 2 316.493 4.187 20 0 DIADLO Clc1ccc(C[NH+]2CCC(c3ccccn3)CC2)c(Cl)n1 ZINC000374870341 1045095649 /nfs/dbraw/zinc/09/56/49/1045095649.db2.gz YLZPVFASXNEEBP-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Cc1noc([C@H]2CCCC[N@@H+]2Cc2ccc(C(C)(C)C)s2)n1 ZINC000577146774 1045105722 /nfs/dbraw/zinc/10/57/22/1045105722.db2.gz MIYSIXHUBDOCBZ-CQSZACIVSA-N 1 2 319.474 4.464 20 0 DIADLO Cc1noc([C@H]2CCCC[N@H+]2Cc2ccc(C(C)(C)C)s2)n1 ZINC000577146774 1045105725 /nfs/dbraw/zinc/10/57/25/1045105725.db2.gz MIYSIXHUBDOCBZ-CQSZACIVSA-N 1 2 319.474 4.464 20 0 DIADLO Cc1nc(C[NH2+]C(c2ccccc2C)c2ccccc2C)co1 ZINC000577191427 1045107720 /nfs/dbraw/zinc/10/77/20/1045107720.db2.gz KTIGNIBBKIABLT-UHFFFAOYSA-N 1 2 306.409 4.479 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc([S@@](C)=O)cc2)c(Cl)c1 ZINC000447314259 1045118564 /nfs/dbraw/zinc/11/85/64/1045118564.db2.gz MGQYRPHNIKYCAX-OAQYLSRUSA-N 1 2 321.873 4.018 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc([S@@](C)=O)cc2)c(Cl)c1 ZINC000447314259 1045118568 /nfs/dbraw/zinc/11/85/68/1045118568.db2.gz MGQYRPHNIKYCAX-OAQYLSRUSA-N 1 2 321.873 4.018 20 0 DIADLO C[N@H+](CCOc1ccccc1F)Cc1nc(C(C)(C)C)cs1 ZINC000447372658 1045123622 /nfs/dbraw/zinc/12/36/22/1045123622.db2.gz IYGVCKQEHGZMTJ-UHFFFAOYSA-N 1 2 322.449 4.091 20 0 DIADLO C[N@@H+](CCOc1ccccc1F)Cc1nc(C(C)(C)C)cs1 ZINC000447372658 1045123627 /nfs/dbraw/zinc/12/36/27/1045123627.db2.gz IYGVCKQEHGZMTJ-UHFFFAOYSA-N 1 2 322.449 4.091 20 0 DIADLO COC(=O)c1sccc1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000447383077 1045125227 /nfs/dbraw/zinc/12/52/27/1045125227.db2.gz RDXGEUHYLCLXOM-HNNXBMFYSA-N 1 2 319.401 4.011 20 0 DIADLO COC(=O)c1sccc1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000447383077 1045125232 /nfs/dbraw/zinc/12/52/32/1045125232.db2.gz RDXGEUHYLCLXOM-HNNXBMFYSA-N 1 2 319.401 4.011 20 0 DIADLO Fc1cccc2c1N(Cc1c[nH+]cn1Cc1ccccc1)CCC2 ZINC000525834976 1045127720 /nfs/dbraw/zinc/12/77/20/1045127720.db2.gz WSEHQMBOIUMCOU-UHFFFAOYSA-N 1 2 321.399 4.023 20 0 DIADLO CC(C)C[C@H](c1nc(-c2ccc(Cl)s2)no1)n1cc[nH+]c1 ZINC000924017512 1045146288 /nfs/dbraw/zinc/14/62/88/1045146288.db2.gz VTYCOKWHBXKJIN-SNVBAGLBSA-N 1 2 322.821 4.284 20 0 DIADLO Cc1cccc(-c2noc([C@H](CC(C)C)n3cc[nH+]c3)n2)c1F ZINC000924045577 1045146388 /nfs/dbraw/zinc/14/63/88/1045146388.db2.gz OKRCMVWJSPSDFG-AWEZNQCLSA-N 1 2 314.364 4.016 20 0 DIADLO Cc1cccc(-c2noc([C@@H](CC(C)C)n3cc[nH+]c3)n2)c1F ZINC000924045578 1045146771 /nfs/dbraw/zinc/14/67/71/1045146771.db2.gz OKRCMVWJSPSDFG-CQSZACIVSA-N 1 2 314.364 4.016 20 0 DIADLO CC(C)C[C@H](c1nc(-c2occc2C(C)C)no1)n1cc[nH+]c1 ZINC000924079669 1045148345 /nfs/dbraw/zinc/14/83/45/1045148345.db2.gz VAVQKKHDPHJQOR-CQSZACIVSA-N 1 2 314.389 4.285 20 0 DIADLO Cc1ccc(Cc2noc([C@H](CC(C)C)n3cc[nH+]c3)n2)cc1C ZINC000924121977 1045148391 /nfs/dbraw/zinc/14/83/91/1045148391.db2.gz QRRVGCNIHATAPX-KRWDZBQOSA-N 1 2 324.428 4.109 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2ccc(-c3ccc(F)cc3)s2)n1 ZINC000557169704 1045151739 /nfs/dbraw/zinc/15/17/39/1045151739.db2.gz KAZVMCHSNPKJPV-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ccccc1[C@H]([C@H](C)N[C@@H]1CCCc2occc21)[NH+](C)C ZINC000447593659 1045155566 /nfs/dbraw/zinc/15/55/66/1045155566.db2.gz UHLXRAXLNGBTBK-CVAIRZPRSA-N 1 2 312.457 4.246 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1ccc(Cl)nc1 ZINC000777504744 1045159292 /nfs/dbraw/zinc/15/92/92/1045159292.db2.gz GAYZBGJGKQTSBR-UHFFFAOYSA-N 1 2 300.793 4.107 20 0 DIADLO CC(C)C[C@H](c1nc(-c2cc3ccccc3[nH]2)no1)n1cc[nH+]c1 ZINC000924427097 1045170057 /nfs/dbraw/zinc/17/00/57/1045170057.db2.gz ADQPNDDZYMNLKM-MRXNPFEDSA-N 1 2 321.384 4.050 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](Cc1cnc(C(F)(F)F)s1)C1CC1 ZINC000447747794 1045172809 /nfs/dbraw/zinc/17/28/09/1045172809.db2.gz UNXLRHCFTAAWOO-VIFPVBQESA-N 1 2 316.348 4.481 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](Cc1cnc(C(F)(F)F)s1)C1CC1 ZINC000447747794 1045172813 /nfs/dbraw/zinc/17/28/13/1045172813.db2.gz UNXLRHCFTAAWOO-VIFPVBQESA-N 1 2 316.348 4.481 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000924527464 1045174745 /nfs/dbraw/zinc/17/47/45/1045174745.db2.gz ZNGYRUZMDZQEQT-ZIAGYGMSSA-N 1 2 307.397 4.457 20 0 DIADLO C=Cn1cc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000447797880 1045176382 /nfs/dbraw/zinc/17/63/82/1045176382.db2.gz OQUZCDKEFWPLCG-NSHDSACASA-N 1 2 310.228 4.483 20 0 DIADLO C=Cn1cc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000447797880 1045176389 /nfs/dbraw/zinc/17/63/89/1045176389.db2.gz OQUZCDKEFWPLCG-NSHDSACASA-N 1 2 310.228 4.483 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+][C@@H]2CSc3ccccc32)s1 ZINC000447934359 1045191661 /nfs/dbraw/zinc/19/16/61/1045191661.db2.gz XTTOJOCJILLSHT-GFCCVEGCSA-N 1 2 304.484 4.377 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2c1nccc2Cl)c1c(F)cccc1F ZINC000924723198 1045194734 /nfs/dbraw/zinc/19/47/34/1045194734.db2.gz ZIKAODJQFWXGNQ-YMTOWFKASA-N 1 2 308.759 4.351 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cnn(C2CCC2)c1)c1c(F)cccc1F ZINC000924720684 1045194858 /nfs/dbraw/zinc/19/48/58/1045194858.db2.gz KFSLTCKIBBTRTC-NWDGAFQWSA-N 1 2 305.372 4.298 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccnnc1)c1c(Cl)ccc(F)c1Cl ZINC000924719906 1045195546 /nfs/dbraw/zinc/19/55/46/1045195546.db2.gz BGIKKHFBHONXEQ-DTWKUNHWSA-N 1 2 314.191 4.334 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1oc2ccc(F)cc2c1C ZINC000924784105 1045197727 /nfs/dbraw/zinc/19/77/27/1045197727.db2.gz AMWAAZQDFALGLN-AWEZNQCLSA-N 1 2 314.360 4.344 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@H]1CCOc2c(Cl)cccc21 ZINC000924823817 1045202381 /nfs/dbraw/zinc/20/23/81/1045202381.db2.gz CWEJLBXWLCDPEI-KBPBESRZSA-N 1 2 318.804 4.127 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+]([C@H](C)c2ccc(F)c(F)c2)CCO1 ZINC000578060064 1045203370 /nfs/dbraw/zinc/20/33/70/1045203370.db2.gz DGMDDOHYUXHENQ-AUUYWEPGSA-N 1 2 317.379 4.408 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+]([C@H](C)c2ccc(F)c(F)c2)CCO1 ZINC000578060064 1045203382 /nfs/dbraw/zinc/20/33/82/1045203382.db2.gz DGMDDOHYUXHENQ-AUUYWEPGSA-N 1 2 317.379 4.408 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1ccnn1C1CCC1 ZINC000924859040 1045205211 /nfs/dbraw/zinc/20/52/11/1045205211.db2.gz RXPGRUJLMBIZGS-LLVKDONJSA-N 1 2 307.800 4.251 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@H](C)c1ccc(OCCC(C)C)cc1 ZINC000924889705 1045208202 /nfs/dbraw/zinc/20/82/02/1045208202.db2.gz MHDFZWFLFSCIPZ-KGLIPLIRSA-N 1 2 317.433 4.215 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@@H]2CCCc3c(Cl)ccnc32)n1 ZINC000924925801 1045210758 /nfs/dbraw/zinc/21/07/58/1045210758.db2.gz MXDMPORQMNJLMB-ZWNOBZJWSA-N 1 2 307.850 4.228 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@H]2CCCc3c(Cl)ccnc32)n1 ZINC000924925527 1045210920 /nfs/dbraw/zinc/21/09/20/1045210920.db2.gz MXDMPORQMNJLMB-GWCFXTLKSA-N 1 2 307.850 4.228 20 0 DIADLO CCn1nc(C)c([C@H](C)[NH2+][C@@H](c2ccccc2Cl)C(C)C)n1 ZINC000925076983 1045224740 /nfs/dbraw/zinc/22/47/40/1045224740.db2.gz QVRUVRFWDFUFRV-BLLLJJGKSA-N 1 2 320.868 4.308 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(F)c1F)c1nccn1-c1ccccc1 ZINC000578294978 1045228622 /nfs/dbraw/zinc/22/86/22/1045228622.db2.gz ZDDSCHZLDJBPFL-CYBMUJFWSA-N 1 2 313.351 4.001 20 0 DIADLO CN(C)c1cccc(C[N@H+](C)Cc2ncc(C(C)(C)C)s2)c1 ZINC000448342780 1045233519 /nfs/dbraw/zinc/23/35/19/1045233519.db2.gz GZKWZJZAOBDSDD-UHFFFAOYSA-N 1 2 317.502 4.139 20 0 DIADLO CN(C)c1cccc(C[N@@H+](C)Cc2ncc(C(C)(C)C)s2)c1 ZINC000448342780 1045233528 /nfs/dbraw/zinc/23/35/28/1045233528.db2.gz GZKWZJZAOBDSDD-UHFFFAOYSA-N 1 2 317.502 4.139 20 0 DIADLO C[C@H]([NH2+]Cc1ccon1)c1ccccc1SC(F)(F)F ZINC000925210358 1045236018 /nfs/dbraw/zinc/23/60/18/1045236018.db2.gz FDSKNTZFELFMFA-VIFPVBQESA-N 1 2 302.321 4.137 20 0 DIADLO CCOc1ccccc1[C@@H](CC(C)C)[NH2+][C@@H](C)c1nonc1C ZINC000925208193 1045236512 /nfs/dbraw/zinc/23/65/12/1045236512.db2.gz NZOYZBFDERVEKG-XJKSGUPXSA-N 1 2 317.433 4.215 20 0 DIADLO C[N@H+](Cc1nc2ccccc2s1)Cc1ccccc1OC1CC1 ZINC000578400912 1045241045 /nfs/dbraw/zinc/24/10/45/1045241045.db2.gz RVEBRRGDTQHYFX-UHFFFAOYSA-N 1 2 324.449 4.470 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2s1)Cc1ccccc1OC1CC1 ZINC000578400912 1045241056 /nfs/dbraw/zinc/24/10/56/1045241056.db2.gz RVEBRRGDTQHYFX-UHFFFAOYSA-N 1 2 324.449 4.470 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000578475212 1045246425 /nfs/dbraw/zinc/24/64/25/1045246425.db2.gz ZNQNXLYVJJXYNO-SECBINFHSA-N 1 2 324.198 4.479 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000578475212 1045246437 /nfs/dbraw/zinc/24/64/37/1045246437.db2.gz ZNQNXLYVJJXYNO-SECBINFHSA-N 1 2 324.198 4.479 20 0 DIADLO S=c1ncccn1C[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000048621879 1045249356 /nfs/dbraw/zinc/24/93/56/1045249356.db2.gz DJDABUJTXUQIQB-CQSZACIVSA-N 1 2 305.834 4.061 20 0 DIADLO S=c1ncccn1C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000048621879 1045249362 /nfs/dbraw/zinc/24/93/62/1045249362.db2.gz DJDABUJTXUQIQB-CQSZACIVSA-N 1 2 305.834 4.061 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1CCO[C@@H](c2ccsc2)C1 ZINC000578525529 1045251565 /nfs/dbraw/zinc/25/15/65/1045251565.db2.gz BNWYTDMKSFYUGQ-QGZVFWFLSA-N 1 2 310.422 4.183 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1CCO[C@H](c2ccsc2)C1 ZINC000578525528 1045252214 /nfs/dbraw/zinc/25/22/14/1045252214.db2.gz BNWYTDMKSFYUGQ-KRWDZBQOSA-N 1 2 310.422 4.183 20 0 DIADLO CC(C)c1cccc([C@@H](C)[NH2+][C@@H](CO)c2c(F)cccc2F)c1 ZINC000527872248 1045271222 /nfs/dbraw/zinc/27/12/22/1045271222.db2.gz VWDLUVYARLODTM-ACJLOTCBSA-N 1 2 319.395 4.472 20 0 DIADLO CCn1ncc(C[NH2+][C@@H](C)c2cc3c(ccc4ccccc34)o2)n1 ZINC000527925047 1045278311 /nfs/dbraw/zinc/27/83/11/1045278311.db2.gz TZISJAKFJHWDFB-ZDUSSCGKSA-N 1 2 320.396 4.048 20 0 DIADLO CCn1ncc(C[NH2+][C@H](C)c2cc3c(ccc4ccccc34)o2)n1 ZINC000527925046 1045278353 /nfs/dbraw/zinc/27/83/53/1045278353.db2.gz TZISJAKFJHWDFB-CYBMUJFWSA-N 1 2 320.396 4.048 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](Cc2ccc(C)cc2)c2ccccn2)no1 ZINC000578916967 1045280360 /nfs/dbraw/zinc/28/03/60/1045280360.db2.gz IWEWMPDITKTJOJ-OXQOHEQNSA-N 1 2 321.424 4.321 20 0 DIADLO CC(C)Cc1ccccc1C[NH2+][C@@H](c1ncc[nH]1)c1ccccc1 ZINC000527916713 1045282383 /nfs/dbraw/zinc/28/23/83/1045282383.db2.gz BSYLQUDHYSFDSO-HXUWFJFHSA-N 1 2 319.452 4.487 20 0 DIADLO CC[N@@H+](Cc1ccc(F)nc1)Cc1ccccc1Br ZINC000779154594 1045328357 /nfs/dbraw/zinc/32/83/57/1045328357.db2.gz XZKCVIJYZUDYJW-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[C@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1c(C)noc1C ZINC000578959399 1045285275 /nfs/dbraw/zinc/28/52/75/1045285275.db2.gz AOSHHOVBSNLVSF-LBPRGKRZSA-N 1 2 307.463 4.286 20 0 DIADLO C[C@@H](c1noc(Cc2c[nH+]cn2Cc2ccccc2)n1)C(C)(C)C ZINC000579060089 1045292093 /nfs/dbraw/zinc/29/20/93/1045292093.db2.gz KYOGEMWSDNGHHG-AWEZNQCLSA-N 1 2 324.428 4.055 20 0 DIADLO C[C@H](c1noc(Cc2c[nH+]cn2Cc2ccccc2)n1)C(C)(C)C ZINC000579060090 1045292219 /nfs/dbraw/zinc/29/22/19/1045292219.db2.gz KYOGEMWSDNGHHG-CQSZACIVSA-N 1 2 324.428 4.055 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1ccccc1OC(F)F ZINC000528036357 1045296302 /nfs/dbraw/zinc/29/63/02/1045296302.db2.gz QNBKJXJVONPYKZ-MNOVXSKESA-N 1 2 310.319 4.234 20 0 DIADLO Cc1noc(C[N@@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC000117346692 1045302247 /nfs/dbraw/zinc/30/22/47/1045302247.db2.gz REFSDMZFVJBGJY-OAHLLOKOSA-N 1 2 305.809 4.149 20 0 DIADLO Cc1noc(C[N@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC000117346692 1045302256 /nfs/dbraw/zinc/30/22/56/1045302256.db2.gz REFSDMZFVJBGJY-OAHLLOKOSA-N 1 2 305.809 4.149 20 0 DIADLO CC(C)C[C@@H](C)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000579524007 1045319702 /nfs/dbraw/zinc/31/97/02/1045319702.db2.gz DXIFHFREKZCTIV-CQSZACIVSA-N 1 2 310.401 4.131 20 0 DIADLO CC[N@H+](Cc1ccc(F)nc1)Cc1ccccc1Br ZINC000779154594 1045328350 /nfs/dbraw/zinc/32/83/50/1045328350.db2.gz XZKCVIJYZUDYJW-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[N@H+](C)Cc1ccncc1F ZINC000449035368 1045335738 /nfs/dbraw/zinc/33/57/38/1045335738.db2.gz GSUUSKUEMNIEPK-GFCCVEGCSA-N 1 2 307.438 4.302 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)Cc1ccncc1F ZINC000449035368 1045335740 /nfs/dbraw/zinc/33/57/40/1045335740.db2.gz GSUUSKUEMNIEPK-GFCCVEGCSA-N 1 2 307.438 4.302 20 0 DIADLO C[C@@H]([NH2+]Cc1ccnn1C1CCCC1)c1c(F)cccc1F ZINC000449087291 1045342857 /nfs/dbraw/zinc/34/28/57/1045342857.db2.gz FOVQOOHKZHKHIV-GFCCVEGCSA-N 1 2 305.372 4.127 20 0 DIADLO C/C=C/C[C@H]1CCCN(C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000626568332 1045351437 /nfs/dbraw/zinc/35/14/37/1045351437.db2.gz ALVDAXJPSYZUSY-JFDDCEBESA-N 1 2 301.434 4.217 20 0 DIADLO Cc1ccc2sc(C[N@H+](Cc3cccnc3)C3CC3)nc2c1 ZINC000528426340 1045357136 /nfs/dbraw/zinc/35/71/36/1045357136.db2.gz ROZYLGBSDKTLAV-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO Cc1ccc2sc(C[N@@H+](Cc3cccnc3)C3CC3)nc2c1 ZINC000528426340 1045357139 /nfs/dbraw/zinc/35/71/39/1045357139.db2.gz ROZYLGBSDKTLAV-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO C[C@@H](Cc1ccoc1)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000449209773 1045361441 /nfs/dbraw/zinc/36/14/41/1045361441.db2.gz FWSIYUPARLXCLD-HNNXBMFYSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2nc3cc(C)ccc3s2)s1 ZINC000528452024 1045362610 /nfs/dbraw/zinc/36/26/10/1045362610.db2.gz OOKMTLBUDGUPLL-LLVKDONJSA-N 1 2 303.456 4.220 20 0 DIADLO c1coc([C@H]([NH2+]Cc2ccnn2C2CCCC2)c2ccccc2)c1 ZINC000449222919 1045364737 /nfs/dbraw/zinc/36/47/37/1045364737.db2.gz WZROYDXKDCFJCI-HXUWFJFHSA-N 1 2 321.424 4.470 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1cccc(Br)c1F ZINC000449225640 1045364747 /nfs/dbraw/zinc/36/47/47/1045364747.db2.gz KYNUMNXZVKAZTN-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1cccc(Br)c1F ZINC000449225640 1045364748 /nfs/dbraw/zinc/36/47/48/1045364748.db2.gz KYNUMNXZVKAZTN-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO Cc1cnccc1C[N@@H+](C)[C@@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000528515752 1045370399 /nfs/dbraw/zinc/37/03/99/1045370399.db2.gz CMOCMNMHLBUIOC-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1cnccc1C[N@H+](C)[C@@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000528515752 1045370404 /nfs/dbraw/zinc/37/04/04/1045370404.db2.gz CMOCMNMHLBUIOC-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO C[C@@H]1CSC[C@@H]1Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000449281589 1045371427 /nfs/dbraw/zinc/37/14/27/1045371427.db2.gz DGLBGXKCRWLUSE-DYVFJYSZSA-N 1 2 313.470 4.050 20 0 DIADLO C[C@@H]1C[N@H+](CCOC2CCCCCC2)C[C@H](c2ccsc2)O1 ZINC000470196407 1045379239 /nfs/dbraw/zinc/37/92/39/1045379239.db2.gz UWRATSFWGQTFKS-CRAIPNDOSA-N 1 2 323.502 4.249 20 0 DIADLO C[C@@H]1C[N@@H+](CCOC2CCCCCC2)C[C@H](c2ccsc2)O1 ZINC000470196407 1045379241 /nfs/dbraw/zinc/37/92/41/1045379241.db2.gz UWRATSFWGQTFKS-CRAIPNDOSA-N 1 2 323.502 4.249 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)s1 ZINC000449456898 1045395310 /nfs/dbraw/zinc/39/53/10/1045395310.db2.gz DTMWATBLKDFGDM-WDEREUQCSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)s1 ZINC000449456898 1045395312 /nfs/dbraw/zinc/39/53/12/1045395312.db2.gz DTMWATBLKDFGDM-WDEREUQCSA-N 1 2 306.397 4.429 20 0 DIADLO Cn1cc(Cl)c(C[NH2+]Cc2ccc(C3CCCC3)cc2)n1 ZINC000449481426 1045397792 /nfs/dbraw/zinc/39/77/92/1045397792.db2.gz SUAKTLKXJGLQNK-UHFFFAOYSA-N 1 2 303.837 4.021 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1nccn1-c1ccccc1 ZINC000449462414 1045399560 /nfs/dbraw/zinc/39/95/60/1045399560.db2.gz SXRRBRNJJBQPNE-UONOGXRCSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1nccn1-c1ccccc1 ZINC000449462414 1045399564 /nfs/dbraw/zinc/39/95/64/1045399564.db2.gz SXRRBRNJJBQPNE-UONOGXRCSA-N 1 2 323.362 4.035 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)cs1 ZINC000449462001 1045399791 /nfs/dbraw/zinc/39/97/91/1045399791.db2.gz RLSGRHRRIYPCBZ-GHMZBOCLSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)cs1 ZINC000449462001 1045399797 /nfs/dbraw/zinc/39/97/97/1045399797.db2.gz RLSGRHRRIYPCBZ-GHMZBOCLSA-N 1 2 306.397 4.429 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCC(F)(F)C[C@H]3C)cs2)o1 ZINC000528768193 1045411143 /nfs/dbraw/zinc/41/11/43/1045411143.db2.gz OEBAZCWNNFFCIF-SNVBAGLBSA-N 1 2 312.385 4.331 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCC(F)(F)C[C@H]3C)cs2)o1 ZINC000528768193 1045411146 /nfs/dbraw/zinc/41/11/46/1045411146.db2.gz OEBAZCWNNFFCIF-SNVBAGLBSA-N 1 2 312.385 4.331 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1csc(Cc2ccccc2)n1 ZINC000528765011 1045411692 /nfs/dbraw/zinc/41/16/92/1045411692.db2.gz FHNMPSRVKZPPBD-ZDUSSCGKSA-N 1 2 322.424 4.354 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1csc(Cc2ccccc2)n1 ZINC000528765011 1045411695 /nfs/dbraw/zinc/41/16/95/1045411695.db2.gz FHNMPSRVKZPPBD-ZDUSSCGKSA-N 1 2 322.424 4.354 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2nc(CC(C)C)no2)C(C)C)c1 ZINC000528766637 1045411827 /nfs/dbraw/zinc/41/18/27/1045411827.db2.gz NQHGSKLTXBZPRV-SFHVURJKSA-N 1 2 301.434 4.063 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+]Cc1c(Cl)oc2ccccc21 ZINC000449562318 1045414912 /nfs/dbraw/zinc/41/49/12/1045414912.db2.gz JEXLROVNAVQWNM-NSHDSACASA-N 1 2 303.793 4.153 20 0 DIADLO Fc1ccc(-c2ccc(C[NH2+]Cc3cnc(C4CC4)o3)o2)cc1 ZINC000449694422 1045427327 /nfs/dbraw/zinc/42/73/27/1045427327.db2.gz BNPFDMIMBZNMBJ-UHFFFAOYSA-N 1 2 312.344 4.241 20 0 DIADLO COCc1nc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2C)cs1 ZINC000449730078 1045429625 /nfs/dbraw/zinc/42/96/25/1045429625.db2.gz CRDKTXRUBBIFKU-MRXNPFEDSA-N 1 2 320.433 4.074 20 0 DIADLO COCc1nc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2C)cs1 ZINC000449730078 1045429629 /nfs/dbraw/zinc/42/96/29/1045429629.db2.gz CRDKTXRUBBIFKU-MRXNPFEDSA-N 1 2 320.433 4.074 20 0 DIADLO COCc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)o1 ZINC000449731321 1045430906 /nfs/dbraw/zinc/43/09/06/1045430906.db2.gz HYPCQXKQNMSZCP-QGZVFWFLSA-N 1 2 307.340 4.041 20 0 DIADLO COCc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)o1 ZINC000449731321 1045430909 /nfs/dbraw/zinc/43/09/09/1045430909.db2.gz HYPCQXKQNMSZCP-QGZVFWFLSA-N 1 2 307.340 4.041 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC000449732325 1045431537 /nfs/dbraw/zinc/43/15/37/1045431537.db2.gz LGWHGSTUDCJCAT-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC000449732325 1045431543 /nfs/dbraw/zinc/43/15/43/1045431543.db2.gz LGWHGSTUDCJCAT-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO CC[C@H](C)[N@H+](Cc1nnc(C(C)C)s1)Cc1ccccc1 ZINC000450240441 1045478755 /nfs/dbraw/zinc/47/87/55/1045478755.db2.gz DGSLSJTVGZGHQX-AWEZNQCLSA-N 1 2 303.475 4.462 20 0 DIADLO CC[C@H](C)[N@@H+](Cc1nnc(C(C)C)s1)Cc1ccccc1 ZINC000450240441 1045478760 /nfs/dbraw/zinc/47/87/60/1045478760.db2.gz DGSLSJTVGZGHQX-AWEZNQCLSA-N 1 2 303.475 4.462 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2nnc(C(C)C)s2)c(C)c1 ZINC000450285857 1045481942 /nfs/dbraw/zinc/48/19/42/1045481942.db2.gz NAQAZXJFEXKLBX-AWEZNQCLSA-N 1 2 303.475 4.471 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2nnc(C(C)C)s2)c(C)c1 ZINC000450285857 1045481946 /nfs/dbraw/zinc/48/19/46/1045481946.db2.gz NAQAZXJFEXKLBX-AWEZNQCLSA-N 1 2 303.475 4.471 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](C)Cc2ccncc2Cl)c1 ZINC000120660585 1045482445 /nfs/dbraw/zinc/48/24/45/1045482445.db2.gz FJNOUCKRLVKHKS-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2ccncc2Cl)c1 ZINC000120660585 1045482449 /nfs/dbraw/zinc/48/24/49/1045482449.db2.gz FJNOUCKRLVKHKS-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO COC[C@H]1CCCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C1 ZINC000450328362 1045487623 /nfs/dbraw/zinc/48/76/23/1045487623.db2.gz HJFVXOUQUFHIQB-LBPRGKRZSA-N 1 2 324.346 4.116 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+]2CCCc3ccccc3C2)cs1 ZINC000120751504 1045487687 /nfs/dbraw/zinc/48/76/87/1045487687.db2.gz SUIYRSKNNKCERY-AWEZNQCLSA-N 1 2 316.470 4.189 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+]2CCCc3ccccc3C2)cs1 ZINC000120751504 1045487690 /nfs/dbraw/zinc/48/76/90/1045487690.db2.gz SUIYRSKNNKCERY-AWEZNQCLSA-N 1 2 316.470 4.189 20 0 DIADLO CC1(C)C[N@H+](Cc2ccsc2C(F)(F)F)[C@H]1[C@@H]1CCCO1 ZINC000529570485 1045497842 /nfs/dbraw/zinc/49/78/42/1045497842.db2.gz BKUVBFZNMDXYHW-RYUDHWBXSA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccsc2C(F)(F)F)[C@H]1[C@@H]1CCCO1 ZINC000529570485 1045497846 /nfs/dbraw/zinc/49/78/46/1045497846.db2.gz BKUVBFZNMDXYHW-RYUDHWBXSA-N 1 2 319.392 4.156 20 0 DIADLO CC(=O)c1cccc(C[N@H+]2C[C@@H](c3ccccc3C)OC[C@H]2C)c1 ZINC000450435358 1045504814 /nfs/dbraw/zinc/50/48/14/1045504814.db2.gz HVBUVOUAOKDZAJ-IERDGZPVSA-N 1 2 323.436 4.160 20 0 DIADLO CC(=O)c1cccc(C[N@@H+]2C[C@@H](c3ccccc3C)OC[C@H]2C)c1 ZINC000450435358 1045504820 /nfs/dbraw/zinc/50/48/20/1045504820.db2.gz HVBUVOUAOKDZAJ-IERDGZPVSA-N 1 2 323.436 4.160 20 0 DIADLO FC(F)(F)c1ccc(C[NH+]2CC(Cc3ccco3)C2)s1 ZINC000529649310 1045506874 /nfs/dbraw/zinc/50/68/74/1045506874.db2.gz QYQBDSYTUCWGHU-UHFFFAOYSA-N 1 2 301.333 4.034 20 0 DIADLO O=C(Nc1cccc(C2CCCCC2)c1)[C@@H]1CCn2c[nH+]cc2C1 ZINC000529649532 1045507710 /nfs/dbraw/zinc/50/77/10/1045507710.db2.gz POJQCYULEHJOJZ-QGZVFWFLSA-N 1 2 323.440 4.132 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CC[C@H](C)[C@@H]2c2cccc(F)c2)s1 ZINC000450455926 1045508705 /nfs/dbraw/zinc/50/87/05/1045508705.db2.gz RONPFUHNEZDIJB-BLLLJJGKSA-N 1 2 319.449 4.384 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CC[C@H](C)[C@@H]2c2cccc(F)c2)s1 ZINC000450455926 1045508711 /nfs/dbraw/zinc/50/87/11/1045508711.db2.gz RONPFUHNEZDIJB-BLLLJJGKSA-N 1 2 319.449 4.384 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nnc(C3CC3)s2)[C@@H]1c1cccc(F)c1 ZINC000450458873 1045509110 /nfs/dbraw/zinc/50/91/10/1045509110.db2.gz YYUXPGRFIXCHMH-ZBEGNZNMSA-N 1 2 317.433 4.138 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nnc(C3CC3)s2)[C@@H]1c1cccc(F)c1 ZINC000450458873 1045509116 /nfs/dbraw/zinc/50/91/16/1045509116.db2.gz YYUXPGRFIXCHMH-ZBEGNZNMSA-N 1 2 317.433 4.138 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CC[C@@H](C)[C@@H]2c2cccc(F)c2)s1 ZINC000450455928 1045509690 /nfs/dbraw/zinc/50/96/90/1045509690.db2.gz RONPFUHNEZDIJB-MLGOLLRUSA-N 1 2 319.449 4.384 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CC[C@@H](C)[C@@H]2c2cccc(F)c2)s1 ZINC000450455928 1045509694 /nfs/dbraw/zinc/50/96/94/1045509694.db2.gz RONPFUHNEZDIJB-MLGOLLRUSA-N 1 2 319.449 4.384 20 0 DIADLO CC(C)(C)[N@H+](Cc1nnc(C2CC2)s1)Cc1ccc(F)cc1 ZINC000450493494 1045512782 /nfs/dbraw/zinc/51/27/82/1045512782.db2.gz CXWWDILJBSJWSP-UHFFFAOYSA-N 1 2 319.449 4.355 20 0 DIADLO CC(C)(C)[N@@H+](Cc1nnc(C2CC2)s1)Cc1ccc(F)cc1 ZINC000450493494 1045512784 /nfs/dbraw/zinc/51/27/84/1045512784.db2.gz CXWWDILJBSJWSP-UHFFFAOYSA-N 1 2 319.449 4.355 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)cn1 ZINC000529683556 1045513096 /nfs/dbraw/zinc/51/30/96/1045513096.db2.gz ZUXFQBDCWMANBG-UHFFFAOYSA-N 1 2 323.362 4.041 20 0 DIADLO CC(C)n1cc(C[N@H+]2CCc3cccc(C(F)(F)F)c3C2)cn1 ZINC000529683556 1045513101 /nfs/dbraw/zinc/51/31/01/1045513101.db2.gz ZUXFQBDCWMANBG-UHFFFAOYSA-N 1 2 323.362 4.041 20 0 DIADLO COc1ccc(C[N@H+]([C@H](C)c2ccco2)C2CC2)c(F)c1OC ZINC001119507886 1045515981 /nfs/dbraw/zinc/51/59/81/1045515981.db2.gz SQBLUHZLJZUAPW-GFCCVEGCSA-N 1 2 319.376 4.162 20 0 DIADLO COc1ccc(C[N@@H+]([C@H](C)c2ccco2)C2CC2)c(F)c1OC ZINC001119507886 1045515985 /nfs/dbraw/zinc/51/59/85/1045515985.db2.gz SQBLUHZLJZUAPW-GFCCVEGCSA-N 1 2 319.376 4.162 20 0 DIADLO CC(C)C[C@@H](c1nc(-c2cc3ccccc3o2)no1)n1cc[nH+]c1 ZINC001119684364 1045520793 /nfs/dbraw/zinc/52/07/93/1045520793.db2.gz USSKADGRNDOXQG-AWEZNQCLSA-N 1 2 322.368 4.315 20 0 DIADLO C(=C\[C@@H]1CCCCC[N@H+]1Cc1nncs1)\c1cccs1 ZINC001119729340 1045522466 /nfs/dbraw/zinc/52/24/66/1045522466.db2.gz OEMRDTOMESDCBD-WSROAFLRSA-N 1 2 305.472 4.058 20 0 DIADLO C(=C\[C@@H]1CCCCC[N@@H+]1Cc1nncs1)\c1cccs1 ZINC001119729340 1045522476 /nfs/dbraw/zinc/52/24/76/1045522476.db2.gz OEMRDTOMESDCBD-WSROAFLRSA-N 1 2 305.472 4.058 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cs1 ZINC000628117529 1045526076 /nfs/dbraw/zinc/52/60/76/1045526076.db2.gz MJYDIANXJHNGFX-GFCCVEGCSA-N 1 2 300.349 4.432 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)cs1 ZINC000628117529 1045526085 /nfs/dbraw/zinc/52/60/85/1045526085.db2.gz MJYDIANXJHNGFX-GFCCVEGCSA-N 1 2 300.349 4.432 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C)sc1C)c1cc(F)ccc1OC ZINC001119845820 1045527467 /nfs/dbraw/zinc/52/74/67/1045527467.db2.gz HTQMENBHAXPSOJ-CQSZACIVSA-N 1 2 308.422 4.149 20 0 DIADLO Cc1ncc(C[N@@H+]2CCC[C@H]2c2cccc(Br)c2)o1 ZINC000628137211 1045528099 /nfs/dbraw/zinc/52/80/99/1045528099.db2.gz AYTKWTFMUSMJSA-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ncc(C[N@H+]2CCC[C@H]2c2cccc(Br)c2)o1 ZINC000628137211 1045528110 /nfs/dbraw/zinc/52/81/10/1045528110.db2.gz AYTKWTFMUSMJSA-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO CCC[N@H+](Cc1cnc(C)o1)Cc1ccccc1Br ZINC000628139631 1045528366 /nfs/dbraw/zinc/52/83/66/1045528366.db2.gz LRWRPKGMBRSTDQ-UHFFFAOYSA-N 1 2 323.234 4.158 20 0 DIADLO CCC[N@@H+](Cc1cnc(C)o1)Cc1ccccc1Br ZINC000628139631 1045528374 /nfs/dbraw/zinc/52/83/74/1045528374.db2.gz LRWRPKGMBRSTDQ-UHFFFAOYSA-N 1 2 323.234 4.158 20 0 DIADLO Cc1c[nH]c(C[N@@H+]([C@H](C)c2cccc(C(F)(F)F)c2)C2CC2)n1 ZINC000628131387 1045529229 /nfs/dbraw/zinc/52/92/29/1045529229.db2.gz XMIQDRQOCDFYKL-GFCCVEGCSA-N 1 2 323.362 4.463 20 0 DIADLO Cc1c[nH]c(C[N@H+]([C@H](C)c2cccc(C(F)(F)F)c2)C2CC2)n1 ZINC000628131387 1045529244 /nfs/dbraw/zinc/52/92/44/1045529244.db2.gz XMIQDRQOCDFYKL-GFCCVEGCSA-N 1 2 323.362 4.463 20 0 DIADLO CC[N@H+](Cc1nc(C)c[nH]1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000628139416 1045529544 /nfs/dbraw/zinc/52/95/44/1045529544.db2.gz FIWFIEJMLLRMJR-LBPRGKRZSA-N 1 2 311.351 4.320 20 0 DIADLO CC[N@@H+](Cc1nc(C)c[nH]1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000628139416 1045529558 /nfs/dbraw/zinc/52/95/58/1045529558.db2.gz FIWFIEJMLLRMJR-LBPRGKRZSA-N 1 2 311.351 4.320 20 0 DIADLO CCC[N@H+](CC)Cn1nc(-c2cccs2)n(C2CC2)c1=S ZINC000750602133 1045537581 /nfs/dbraw/zinc/53/75/81/1045537581.db2.gz IPOSTPCDXMDECY-UHFFFAOYSA-N 1 2 322.503 4.167 20 0 DIADLO CCC[N@@H+](CC)Cn1nc(-c2cccs2)n(C2CC2)c1=S ZINC000750602133 1045537593 /nfs/dbraw/zinc/53/75/93/1045537593.db2.gz IPOSTPCDXMDECY-UHFFFAOYSA-N 1 2 322.503 4.167 20 0 DIADLO Cc1c[nH]c(C[N@H+]2CC=C(c3ccccc3C(F)(F)F)CC2)n1 ZINC000628190761 1045538069 /nfs/dbraw/zinc/53/80/69/1045538069.db2.gz PHZOTKAYODDPNU-UHFFFAOYSA-N 1 2 321.346 4.026 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2CC=C(c3ccccc3C(F)(F)F)CC2)n1 ZINC000628190761 1045538076 /nfs/dbraw/zinc/53/80/76/1045538076.db2.gz PHZOTKAYODDPNU-UHFFFAOYSA-N 1 2 321.346 4.026 20 0 DIADLO CC(C)c1cc(Cl)ccc1NC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000529848402 1045538697 /nfs/dbraw/zinc/53/86/97/1045538697.db2.gz KSEYOVGGOJVLLM-LLVKDONJSA-N 1 2 305.809 4.004 20 0 DIADLO CC(C)c1cc(Cl)ccc1NC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000529848402 1045538710 /nfs/dbraw/zinc/53/87/10/1045538710.db2.gz KSEYOVGGOJVLLM-LLVKDONJSA-N 1 2 305.809 4.004 20 0 DIADLO CC(C)c1cc(Cl)ccc1NC(=O)CCCn1cc[nH+]c1 ZINC000529852574 1045540328 /nfs/dbraw/zinc/54/03/28/1045540328.db2.gz PZUBNRIKVGUECM-UHFFFAOYSA-N 1 2 305.809 4.079 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2nnc(C3CC3)s2)c1 ZINC000450668318 1045542572 /nfs/dbraw/zinc/54/25/72/1045542572.db2.gz NBVOYFKTOUQSMB-LBPRGKRZSA-N 1 2 317.458 4.054 20 0 DIADLO FCC1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)CC1 ZINC000450684153 1045544578 /nfs/dbraw/zinc/54/45/78/1045544578.db2.gz ILLMOZKDIMAHNS-UHFFFAOYSA-N 1 2 312.310 4.440 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C)c1csnn1 ZINC000450692571 1045548044 /nfs/dbraw/zinc/54/80/44/1045548044.db2.gz KWLDSRSHFYVHRJ-MHOHDPQLSA-N 1 2 307.850 4.239 20 0 DIADLO Cc1c[nH]c(C[N@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)n1 ZINC000628235929 1045551957 /nfs/dbraw/zinc/55/19/57/1045551957.db2.gz JHVGJLJIEQFFOA-UHFFFAOYSA-N 1 2 322.239 4.314 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)n1 ZINC000628235929 1045551966 /nfs/dbraw/zinc/55/19/66/1045551966.db2.gz JHVGJLJIEQFFOA-UHFFFAOYSA-N 1 2 322.239 4.314 20 0 DIADLO Cc1[nH]c(CNc2cccc(-c3ccc4c(c3)CCO4)c2)[nH+]c1C ZINC000628235449 1045552257 /nfs/dbraw/zinc/55/22/57/1045552257.db2.gz OHSCAGHMBNHIAW-UHFFFAOYSA-N 1 2 319.408 4.241 20 0 DIADLO Cc1c(C(=O)Nc2c(C)c[nH+]cc2C)oc2c1c(C)ccc2C ZINC001121139593 1045552414 /nfs/dbraw/zinc/55/24/14/1045552414.db2.gz KMTVTHPUVBXEMY-UHFFFAOYSA-N 1 2 308.381 4.044 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC[C@@H]2c2cccnc2)cs1 ZINC000628277245 1045561155 /nfs/dbraw/zinc/56/11/55/1045561155.db2.gz KSCBKXADCNXQMH-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC[C@@H]2c2cccnc2)cs1 ZINC000628277245 1045561168 /nfs/dbraw/zinc/56/11/68/1045561168.db2.gz KSCBKXADCNXQMH-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO Cc1[nH]c(CN(Cc2ccccc2Cl)CC2CC2)[nH+]c1C ZINC000628271930 1045561707 /nfs/dbraw/zinc/56/17/07/1045561707.db2.gz WSUMFAVGFFLZPD-UHFFFAOYSA-N 1 2 303.837 4.092 20 0 DIADLO Cc1[nH]c(CN(Cc2ccc(F)cc2Cl)CC2CC2)[nH+]c1C ZINC000628271310 1045561846 /nfs/dbraw/zinc/56/18/46/1045561846.db2.gz UZVXVMKZXRNKIC-UHFFFAOYSA-N 1 2 321.827 4.231 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC[C@@H]2c2ccncc2)cs1 ZINC000628277532 1045564514 /nfs/dbraw/zinc/56/45/14/1045564514.db2.gz WRBQBOARDLCDRM-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC[C@@H]2c2ccncc2)cs1 ZINC000628277532 1045564525 /nfs/dbraw/zinc/56/45/25/1045564525.db2.gz WRBQBOARDLCDRM-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO COc1ccc(CO[NH+]=C(N)c2cccc3ccccc32)cc1F ZINC000750871629 1045565504 /nfs/dbraw/zinc/56/55/04/1045565504.db2.gz YOSBWDQJLDHKOM-UHFFFAOYSA-N 1 2 324.355 4.034 20 0 DIADLO C[C@H]1CO[C@H](c2cccc(Cl)c2)C[N@@H+]1CC1CC(F)(F)C1 ZINC000450813220 1045569139 /nfs/dbraw/zinc/56/91/39/1045569139.db2.gz VINUGPAOMPWNAR-NHYWBVRUSA-N 1 2 315.791 4.147 20 0 DIADLO C[C@H]1CO[C@H](c2cccc(Cl)c2)C[N@H+]1CC1CC(F)(F)C1 ZINC000450813220 1045569147 /nfs/dbraw/zinc/56/91/47/1045569147.db2.gz VINUGPAOMPWNAR-NHYWBVRUSA-N 1 2 315.791 4.147 20 0 DIADLO CCc1ccc([C@@H]2C[N@H+](Cc3ccc(C(C)=O)cc3)CCO2)cc1 ZINC000450848885 1045577062 /nfs/dbraw/zinc/57/70/62/1045577062.db2.gz XUFCHGVIRQBNAN-NRFANRHFSA-N 1 2 323.436 4.025 20 0 DIADLO CCc1ccc([C@@H]2C[N@@H+](Cc3ccc(C(C)=O)cc3)CCO2)cc1 ZINC000450848885 1045577067 /nfs/dbraw/zinc/57/70/67/1045577067.db2.gz XUFCHGVIRQBNAN-NRFANRHFSA-N 1 2 323.436 4.025 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CCC[C@@H]2CC(=O)c2cccs2)o1 ZINC000751033117 1045577864 /nfs/dbraw/zinc/57/78/64/1045577864.db2.gz LQGSSGWCMACVFT-CYBMUJFWSA-N 1 2 318.442 4.097 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CCC[C@@H]2CC(=O)c2cccs2)o1 ZINC000751033117 1045577876 /nfs/dbraw/zinc/57/78/76/1045577876.db2.gz LQGSSGWCMACVFT-CYBMUJFWSA-N 1 2 318.442 4.097 20 0 DIADLO Fc1cc(Cl)cc(F)c1C[NH+]1CCC(OC2CCC2)CC1 ZINC001139048472 1045589002 /nfs/dbraw/zinc/58/90/02/1045589002.db2.gz ZLXYPERRNBKFPA-UHFFFAOYSA-N 1 2 315.791 4.152 20 0 DIADLO C[C@@H](c1csnn1)[NH+]1CCC(c2cccc(Cl)c2)CC1 ZINC000450893151 1045590582 /nfs/dbraw/zinc/59/05/82/1045590582.db2.gz QWPIRSHALXNCTB-NSHDSACASA-N 1 2 307.850 4.132 20 0 DIADLO CC[C@H](C)CCCCC(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000751427591 1045605913 /nfs/dbraw/zinc/60/59/13/1045605913.db2.gz JDJQOMXHAWWZDI-JKSUJKDBSA-N 1 2 307.482 4.021 20 0 DIADLO C[C@@H]1c2nnc(C3CCCC3)n2CC[N@H+]1CCC1=CCCCC1 ZINC000451025902 1045615068 /nfs/dbraw/zinc/61/50/68/1045615068.db2.gz LXZVSJFYYUBQMF-OAHLLOKOSA-N 1 2 314.477 4.203 20 0 DIADLO C[C@@H]1c2nnc(C3CCCC3)n2CC[N@@H+]1CCC1=CCCCC1 ZINC000451025902 1045615072 /nfs/dbraw/zinc/61/50/72/1045615072.db2.gz LXZVSJFYYUBQMF-OAHLLOKOSA-N 1 2 314.477 4.203 20 0 DIADLO Cc1cc([NH2+][C@@H]2CCC23CCC3)ccc1N1CCSCC1 ZINC000800489656 1045630323 /nfs/dbraw/zinc/63/03/23/1045630323.db2.gz VBEHECAVRKPJFD-QGZVFWFLSA-N 1 2 302.487 4.293 20 0 DIADLO CC(C)c1nnc(C[N@H+]2[C@H](C)[C@H](CC(F)(F)F)C[C@@H]2C)s1 ZINC000451149563 1045633922 /nfs/dbraw/zinc/63/39/22/1045633922.db2.gz QFXDCNHZPZZQBC-AXFHLTTASA-N 1 2 321.412 4.213 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2[C@H](C)[C@H](CC(F)(F)F)C[C@@H]2C)s1 ZINC000451149563 1045633929 /nfs/dbraw/zinc/63/39/29/1045633929.db2.gz QFXDCNHZPZZQBC-AXFHLTTASA-N 1 2 321.412 4.213 20 0 DIADLO Cc1cnc(C[N@@H+]2CCc3ccc(-c4ccccc4)cc3C2)o1 ZINC000451156085 1045636381 /nfs/dbraw/zinc/63/63/81/1045636381.db2.gz DBJKHCIDQPMBOP-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO Cc1cnc(C[N@H+]2CCc3ccc(-c4ccccc4)cc3C2)o1 ZINC000451156085 1045636397 /nfs/dbraw/zinc/63/63/97/1045636397.db2.gz DBJKHCIDQPMBOP-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2c1cccc2O)c1ncc(-c2ccccc2)o1 ZINC000451182481 1045641416 /nfs/dbraw/zinc/64/14/16/1045641416.db2.gz XQMLZWPAVZWQDD-DYVFJYSZSA-N 1 2 320.392 4.385 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ncc(-c2ccccc2)o1 ZINC000451182480 1045641555 /nfs/dbraw/zinc/64/15/55/1045641555.db2.gz XQMLZWPAVZWQDD-CXAGYDPISA-N 1 2 320.392 4.385 20 0 DIADLO Cc1cccc(C(=O)Nc2ccccc2-n2cc[nH+]c2)c1Cl ZINC000121799900 1045660331 /nfs/dbraw/zinc/66/03/31/1045660331.db2.gz ZRWJQXSKAPHMJB-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO c1coc(C[NH+](Cc2ccco2)C[C@H]2CCC3(CCCC3)O2)c1 ZINC000530419144 1045662539 /nfs/dbraw/zinc/66/25/39/1045662539.db2.gz DHZHCAIDFUYMGD-GOSISDBHSA-N 1 2 315.413 4.367 20 0 DIADLO Cc1cc(C(=O)Nc2cc[nH+]c(C)c2)c(C)n1Cc1ccccc1 ZINC000078230871 1045663007 /nfs/dbraw/zinc/66/30/07/1045663007.db2.gz WAQSULDJTIAFAW-UHFFFAOYSA-N 1 2 319.408 4.109 20 0 DIADLO C[NH2+]c1ccc(NCc2ccccc2OCC(F)(F)F)cc1 ZINC000629387852 1045664471 /nfs/dbraw/zinc/66/44/71/1045664471.db2.gz GSYZVMFLAHPRQC-UHFFFAOYSA-N 1 2 310.319 4.282 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccc(F)c(Cl)c1)C1CC1)c1csnn1 ZINC000451358362 1045669898 /nfs/dbraw/zinc/66/98/98/1045669898.db2.gz URCTYMLPKXOTSY-RTHLEPHNSA-N 1 2 311.813 4.133 20 0 DIADLO c1cc(N2CCSCC2)ccc1[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000800982396 1045675963 /nfs/dbraw/zinc/67/59/63/1045675963.db2.gz RYDFPCNKIYWAJE-QZTJIDSGSA-N 1 2 302.487 4.230 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CC[C@H]3C3CCC3)cc2)C[C@H](C)O1 ZINC000800981087 1045676697 /nfs/dbraw/zinc/67/66/97/1045676697.db2.gz KBFMNCJEXVXSNM-IDENBPMYSA-N 1 2 314.473 4.291 20 0 DIADLO Cc1cc([NH2+][C@@H]2CCC[C@H]2CCCF)ccc1N1CCOCC1 ZINC000800982227 1045676810 /nfs/dbraw/zinc/67/68/10/1045676810.db2.gz FFCXUAPGZJCDEQ-FUHWJXTLSA-N 1 2 320.452 4.162 20 0 DIADLO Clc1cncc(Cl)c1C[NH2+]Cc1cc2ccccc2o1 ZINC001461046553 1045677601 /nfs/dbraw/zinc/67/76/01/1045677601.db2.gz CEOWOOGRWVENMU-UHFFFAOYSA-N 1 2 307.180 4.424 20 0 DIADLO Clc1ccc(C[NH2+][C@H](c2ccccc2)c2cccnc2)nc1 ZINC000779414932 1045680237 /nfs/dbraw/zinc/68/02/37/1045680237.db2.gz AOPADNULFGYGNZ-GOSISDBHSA-N 1 2 309.800 4.009 20 0 DIADLO Cc1cc(N[C@H](c2ccc(F)cn2)C(C)C)ccc1[NH+](C)C ZINC000779421016 1045698736 /nfs/dbraw/zinc/69/87/36/1045698736.db2.gz BCGUVBUYDLHARG-SFHVURJKSA-N 1 2 301.409 4.404 20 0 DIADLO Fc1ccc(-c2cnc(C[N@@H+]3CC[C@H]3c3ccccc3)o2)cc1 ZINC000530663399 1045708499 /nfs/dbraw/zinc/70/84/99/1045708499.db2.gz FWOZYFXRHQDWQR-KRWDZBQOSA-N 1 2 308.356 4.428 20 0 DIADLO Fc1ccc(-c2cnc(C[N@H+]3CC[C@H]3c3ccccc3)o2)cc1 ZINC000530663399 1045708524 /nfs/dbraw/zinc/70/85/24/1045708524.db2.gz FWOZYFXRHQDWQR-KRWDZBQOSA-N 1 2 308.356 4.428 20 0 DIADLO N#CCC[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1ccccc1 ZINC000191460958 1045711312 /nfs/dbraw/zinc/71/13/12/1045711312.db2.gz JADSCEGVLDEFCL-HNNXBMFYSA-N 1 2 318.779 4.319 20 0 DIADLO CC(C)n1ccn(C[N@H+](CCC(F)(F)F)CC2CC2)c1=S ZINC000753107886 1045726843 /nfs/dbraw/zinc/72/68/43/1045726843.db2.gz FEIRHECVZAICQD-UHFFFAOYSA-N 1 2 321.412 4.222 20 0 DIADLO CC(C)n1ccn(C[N@@H+](CCC(F)(F)F)CC2CC2)c1=S ZINC000753107886 1045726850 /nfs/dbraw/zinc/72/68/50/1045726850.db2.gz FEIRHECVZAICQD-UHFFFAOYSA-N 1 2 321.412 4.222 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451855902 1045735032 /nfs/dbraw/zinc/73/50/32/1045735032.db2.gz OYLGLTPSQDVNRO-MRXNPFEDSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451855902 1045735039 /nfs/dbraw/zinc/73/50/39/1045735039.db2.gz OYLGLTPSQDVNRO-MRXNPFEDSA-N 1 2 300.402 4.427 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)nc1 ZINC000451867024 1045736260 /nfs/dbraw/zinc/73/62/60/1045736260.db2.gz YSDJJUZCOGOTKC-HNNXBMFYSA-N 1 2 322.330 4.421 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)nc1 ZINC000451867024 1045736276 /nfs/dbraw/zinc/73/62/76/1045736276.db2.gz YSDJJUZCOGOTKC-HNNXBMFYSA-N 1 2 322.330 4.421 20 0 DIADLO CCCCCC(C)(C)C(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000753213391 1045737396 /nfs/dbraw/zinc/73/73/96/1045737396.db2.gz RIMREZKVQZGPHU-UHFFFAOYSA-N 1 2 313.445 4.095 20 0 DIADLO CCc1nc(C)c(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3[nH]2)o1 ZINC000451877815 1045739776 /nfs/dbraw/zinc/73/97/76/1045739776.db2.gz KNNDLYOFAJBDKO-MRXNPFEDSA-N 1 2 324.428 4.149 20 0 DIADLO CCc1nc(C)c(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3[nH]2)o1 ZINC000451877815 1045739787 /nfs/dbraw/zinc/73/97/87/1045739787.db2.gz KNNDLYOFAJBDKO-MRXNPFEDSA-N 1 2 324.428 4.149 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+](C)Cc1ccc(C)s1 ZINC000530871314 1045744410 /nfs/dbraw/zinc/74/44/10/1045744410.db2.gz CYKZZVCSZWGCGO-UHFFFAOYSA-N 1 2 317.454 4.290 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+](C)Cc1ccc(C)s1 ZINC000530871314 1045744421 /nfs/dbraw/zinc/74/44/21/1045744421.db2.gz CYKZZVCSZWGCGO-UHFFFAOYSA-N 1 2 317.454 4.290 20 0 DIADLO Cc1ccc(-c2noc(C[N@H+]3C[C@@H](C)[C@@H]3c3ccccc3)n2)cc1 ZINC000530902653 1045749042 /nfs/dbraw/zinc/74/90/42/1045749042.db2.gz PQTVLNHVKDZMFR-DNVCBOLYSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccc(-c2noc(C[N@@H+]3C[C@@H](C)[C@@H]3c3ccccc3)n2)cc1 ZINC000530902653 1045749052 /nfs/dbraw/zinc/74/90/52/1045749052.db2.gz PQTVLNHVKDZMFR-DNVCBOLYSA-N 1 2 319.408 4.238 20 0 DIADLO CCc1nc(C)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)o1 ZINC000451968519 1045753166 /nfs/dbraw/zinc/75/31/66/1045753166.db2.gz IVXSGJUFZGDNMI-OAHLLOKOSA-N 1 2 306.356 4.161 20 0 DIADLO CCc1nc(C)c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)o1 ZINC000451968519 1045753178 /nfs/dbraw/zinc/75/31/78/1045753178.db2.gz IVXSGJUFZGDNMI-OAHLLOKOSA-N 1 2 306.356 4.161 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@@H+]1Cc1ncc(C2CC2)o1 ZINC000451984858 1045755599 /nfs/dbraw/zinc/75/55/99/1045755599.db2.gz HWGMPBUTEMUMHL-MRXNPFEDSA-N 1 2 300.377 4.337 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@H+]1Cc1ncc(C2CC2)o1 ZINC000451984858 1045755613 /nfs/dbraw/zinc/75/56/13/1045755613.db2.gz HWGMPBUTEMUMHL-MRXNPFEDSA-N 1 2 300.377 4.337 20 0 DIADLO C[C@@H]1CCC(C)(C)[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000452006590 1045762814 /nfs/dbraw/zinc/76/28/14/1045762814.db2.gz MAEGBOTUVYMNAM-SNVBAGLBSA-N 1 2 315.244 4.195 20 0 DIADLO C[C@@H]1CCC(C)(C)[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000452006590 1045762823 /nfs/dbraw/zinc/76/28/23/1045762823.db2.gz MAEGBOTUVYMNAM-SNVBAGLBSA-N 1 2 315.244 4.195 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2c(Cl)cccc2Cl)c(C)[nH+]1 ZINC001124922125 1045801641 /nfs/dbraw/zinc/80/16/41/1045801641.db2.gz XNXHIYLPYBLKPX-UHFFFAOYSA-N 1 2 323.223 4.244 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2coc(C(C)(C)C)n2)c1 ZINC000901779689 1045816989 /nfs/dbraw/zinc/81/69/89/1045816989.db2.gz UEGXBOYSRWVTJR-UHFFFAOYSA-N 1 2 306.431 4.118 20 0 DIADLO Cc1nc(C[NH2+][C@H](CCc2ccccc2)c2ccccn2)cs1 ZINC000631200983 1045834608 /nfs/dbraw/zinc/83/46/08/1045834608.db2.gz OMBBHOWLRRWTLL-LJQANCHMSA-N 1 2 323.465 4.310 20 0 DIADLO COc1cc([C@H](C)[NH2+]Cc2ccc(C)cc2OC(C)(C)C)on1 ZINC000925244796 1045838166 /nfs/dbraw/zinc/83/81/66/1045838166.db2.gz YLKIAKDDKLZYIM-ZDUSSCGKSA-N 1 2 318.417 4.020 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C3CC3)no2)cc1 ZINC000282034272 1045846546 /nfs/dbraw/zinc/84/65/46/1045846546.db2.gz YLLGYJUWPZIKSS-MNOVXSKESA-N 1 2 303.431 4.081 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+]C2CCC3(CC3)CC2)cc1 ZINC000754103179 1045847670 /nfs/dbraw/zinc/84/76/70/1045847670.db2.gz WAVBDQCCXHGEPZ-OAHLLOKOSA-N 1 2 300.446 4.046 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1c(Cl)nc2ccccn21 ZINC000754150410 1045855584 /nfs/dbraw/zinc/85/55/84/1045855584.db2.gz RHYYQTDWSJJXMY-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1c(Cl)nc2ccccn21 ZINC000754150410 1045855597 /nfs/dbraw/zinc/85/55/97/1045855597.db2.gz RHYYQTDWSJJXMY-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO CCCc1ccc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)s1 ZINC001125150801 1045860898 /nfs/dbraw/zinc/86/08/98/1045860898.db2.gz GHHJDKYJOKGLKW-UHFFFAOYSA-N 1 2 311.410 4.139 20 0 DIADLO C[N@H+](CCOCc1ccccc1)Cc1csc(C(C)(C)C)n1 ZINC000531547989 1045870335 /nfs/dbraw/zinc/87/03/35/1045870335.db2.gz QQNISXTWVHWZGI-UHFFFAOYSA-N 1 2 318.486 4.089 20 0 DIADLO C[N@@H+](CCOCc1ccccc1)Cc1csc(C(C)(C)C)n1 ZINC000531547989 1045870357 /nfs/dbraw/zinc/87/03/57/1045870357.db2.gz QQNISXTWVHWZGI-UHFFFAOYSA-N 1 2 318.486 4.089 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccccc2Cl)C[C@H](c2ccsc2)O1 ZINC000531588432 1045874826 /nfs/dbraw/zinc/87/48/26/1045874826.db2.gz XJEFAISLAOPCBD-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccccc2Cl)C[C@H](c2ccsc2)O1 ZINC000531588432 1045874844 /nfs/dbraw/zinc/87/48/44/1045874844.db2.gz XJEFAISLAOPCBD-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccccn1 ZINC000754338924 1045877435 /nfs/dbraw/zinc/87/74/35/1045877435.db2.gz VDLHAKRARYCGDX-SFHVURJKSA-N 1 2 307.397 4.224 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1csc(C)n1)c1cccc(OC)c1OC ZINC000631583398 1045878091 /nfs/dbraw/zinc/87/80/91/1045878091.db2.gz XCYPGXKMYJLUQW-BXUZGUMPSA-N 1 2 320.458 4.271 20 0 DIADLO CCC[C@H]([NH2+]Cc1csc([C@@H](C)OC)n1)c1cc(C)ccn1 ZINC000631587164 1045879795 /nfs/dbraw/zinc/87/97/95/1045879795.db2.gz PLCBEDJLUCNGKX-HIFRSBDPSA-N 1 2 319.474 4.185 20 0 DIADLO Cc1cccc([C@@H](C)C(=O)OCc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000754499715 1045894699 /nfs/dbraw/zinc/89/46/99/1045894699.db2.gz PONVFRIWCONEAC-MRXNPFEDSA-N 1 2 320.392 4.028 20 0 DIADLO C[N@H+](Cc1csc(Br)n1)[C@@H]1CCc2ccccc21 ZINC001137586831 1045898997 /nfs/dbraw/zinc/89/89/97/1045898997.db2.gz GBANXEJWQWRKIK-CYBMUJFWSA-N 1 2 323.259 4.025 20 0 DIADLO C[N@@H+](Cc1csc(Br)n1)[C@@H]1CCc2ccccc21 ZINC001137586831 1045899019 /nfs/dbraw/zinc/89/90/19/1045899019.db2.gz GBANXEJWQWRKIK-CYBMUJFWSA-N 1 2 323.259 4.025 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H](F)C2)ccc1Br ZINC001137613040 1045905726 /nfs/dbraw/zinc/90/57/26/1045905726.db2.gz GJYVDKUWWWAJEB-ZDUSSCGKSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H](F)C2)ccc1Br ZINC001137613040 1045905734 /nfs/dbraw/zinc/90/57/34/1045905734.db2.gz GJYVDKUWWWAJEB-ZDUSSCGKSA-N 1 2 300.215 4.082 20 0 DIADLO Clc1cncc(Cl)c1C[N@@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001137608041 1045906107 /nfs/dbraw/zinc/90/61/07/1045906107.db2.gz HHSRBQJZVOQVIT-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cncc(Cl)c1C[N@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001137608041 1045906114 /nfs/dbraw/zinc/90/61/14/1045906114.db2.gz HHSRBQJZVOQVIT-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nc([C@@H](C)OCC(C)C)no2)s1 ZINC000754667823 1045907728 /nfs/dbraw/zinc/90/77/28/1045907728.db2.gz LZODCSUZIVZEFI-QWHCGFSZSA-N 1 2 323.462 4.024 20 0 DIADLO C[C@@]1(C[N@@H+]2CCc3c4ccccc4[nH]c3C2)CC1(Cl)Cl ZINC000828505315 1045912985 /nfs/dbraw/zinc/91/29/85/1045912985.db2.gz NGKIGEUQCZLUQS-HNNXBMFYSA-N 1 2 309.240 4.110 20 0 DIADLO C[C@@]1(C[N@H+]2CCc3c4ccccc4[nH]c3C2)CC1(Cl)Cl ZINC000828505315 1045913001 /nfs/dbraw/zinc/91/30/01/1045913001.db2.gz NGKIGEUQCZLUQS-HNNXBMFYSA-N 1 2 309.240 4.110 20 0 DIADLO C[C@@H]([NH2+]Cc1c(Cl)cccc1OC(F)F)c1ccoc1 ZINC000631773008 1045918096 /nfs/dbraw/zinc/91/80/96/1045918096.db2.gz RWQBXKMJTUOGCU-SECBINFHSA-N 1 2 301.720 4.385 20 0 DIADLO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)c1 ZINC000631795119 1045918925 /nfs/dbraw/zinc/91/89/25/1045918925.db2.gz GILHJHCSUBTUGF-KZULUSFZSA-N 1 2 318.367 4.146 20 0 DIADLO Oc1cccc2c1CCC[C@H]2[NH2+][C@H](CF)c1ccc(F)cc1 ZINC000631798181 1045920466 /nfs/dbraw/zinc/92/04/66/1045920466.db2.gz OBZPXIWVMUVODF-IAGOWNOFSA-N 1 2 303.352 4.209 20 0 DIADLO C[C@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1cnn(C2CCCC2)c1 ZINC000631798658 1045920802 /nfs/dbraw/zinc/92/08/02/1045920802.db2.gz XBKDGENIDJHFPP-SCLBCKFNSA-N 1 2 319.399 4.499 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@@H](C)c2csc3ccccc23)n1 ZINC000754734432 1045921634 /nfs/dbraw/zinc/92/16/34/1045921634.db2.gz RMJSCKKIMGTXSI-LBPRGKRZSA-N 1 2 315.442 4.334 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1csc2ccccc12 ZINC000754738564 1045922827 /nfs/dbraw/zinc/92/28/27/1045922827.db2.gz NMOVPBIKJFYTGV-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](C)c2csc3ccccc23)n1 ZINC000754744978 1045923395 /nfs/dbraw/zinc/92/33/95/1045923395.db2.gz URQNATZZTVJNEB-GFCCVEGCSA-N 1 2 315.442 4.478 20 0 DIADLO C[C@H](c1ccco1)[N@H+](CC(=O)NC1CCCCCCC1)C1CC1 ZINC000754869693 1045937092 /nfs/dbraw/zinc/93/70/92/1045937092.db2.gz COAPCEOCGWBONG-OAHLLOKOSA-N 1 2 318.461 4.034 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](CC(=O)NC1CCCCCCC1)C1CC1 ZINC000754869693 1045937101 /nfs/dbraw/zinc/93/71/01/1045937101.db2.gz COAPCEOCGWBONG-OAHLLOKOSA-N 1 2 318.461 4.034 20 0 DIADLO CC(C)CCOc1ccccc1C[NH2+][C@H]1C[C@@H](C)n2ccnc21 ZINC000453097091 1045937363 /nfs/dbraw/zinc/93/73/63/1045937363.db2.gz QHCLVVGKPOTYCT-WBVHZDCISA-N 1 2 313.445 4.104 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]C(c1cccs1)c1cccs1 ZINC000453145102 1045949762 /nfs/dbraw/zinc/94/97/62/1045949762.db2.gz NIKWWKUPYOOJSU-GFCCVEGCSA-N 1 2 317.483 4.466 20 0 DIADLO CCCC[C@H](C)[N@H+](CCCC)Cn1ncc2sccc2c1=O ZINC000902277543 1045961775 /nfs/dbraw/zinc/96/17/75/1045961775.db2.gz MJCRUDFJYBPYPP-AWEZNQCLSA-N 1 2 321.490 4.096 20 0 DIADLO CCCC[C@H](C)[N@@H+](CCCC)Cn1ncc2sccc2c1=O ZINC000902277543 1045961779 /nfs/dbraw/zinc/96/17/79/1045961779.db2.gz MJCRUDFJYBPYPP-AWEZNQCLSA-N 1 2 321.490 4.096 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cccnc2C)c(Br)c1 ZINC001137808226 1045970297 /nfs/dbraw/zinc/97/02/97/1045970297.db2.gz DPWAJNOBFJSYHQ-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cccnc2C)c(Br)c1 ZINC001137808226 1045970308 /nfs/dbraw/zinc/97/03/08/1045970308.db2.gz DPWAJNOBFJSYHQ-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cc(C)c(CNc2ccc(C(F)(F)F)c(Cl)n2)c[nH+]1 ZINC000829463361 1045977546 /nfs/dbraw/zinc/97/75/46/1045977546.db2.gz JZFTZZITOCSYRD-UHFFFAOYSA-N 1 2 315.726 4.378 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccncc1F)c1ncc(-c2ccccc2)n1C ZINC000453207023 1045983267 /nfs/dbraw/zinc/98/32/67/1045983267.db2.gz FVEVITRNNKNSHL-ZIAGYGMSSA-N 1 2 324.403 4.033 20 0 DIADLO Cc1cccc(C)c1C[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC001137852715 1045985042 /nfs/dbraw/zinc/98/50/42/1045985042.db2.gz PHMKZQKLIOPHQS-UHFFFAOYSA-N 1 2 303.409 4.005 20 0 DIADLO Cc1cccc(C)c1C[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC001137852715 1045985051 /nfs/dbraw/zinc/98/50/51/1045985051.db2.gz PHMKZQKLIOPHQS-UHFFFAOYSA-N 1 2 303.409 4.005 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(F)cc(F)c2F)c1 ZINC001137873699 1045993997 /nfs/dbraw/zinc/99/39/97/1045993997.db2.gz QKEAJMGEEKTWKS-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2cc(F)cc(F)c2F)c1 ZINC001137873699 1045994001 /nfs/dbraw/zinc/99/40/01/1045994001.db2.gz QKEAJMGEEKTWKS-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001137881459 1045997627 /nfs/dbraw/zinc/99/76/27/1045997627.db2.gz RFJGTRGPCQGZCV-ZDUSSCGKSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[N@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001137881459 1045997636 /nfs/dbraw/zinc/99/76/36/1045997636.db2.gz RFJGTRGPCQGZCV-ZDUSSCGKSA-N 1 2 323.770 4.272 20 0 DIADLO O=C(/C=C/Sc1ccccc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000193365846 1045998470 /nfs/dbraw/zinc/99/84/70/1045998470.db2.gz LMEOKPFQIQUODU-FMIVXFBMSA-N 1 2 321.405 4.117 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cc(F)c(F)cc1F)CCC2 ZINC001137893417 1046002646 /nfs/dbraw/zinc/00/26/46/1046002646.db2.gz UMCVIUQIDMQULT-UHFFFAOYSA-N 1 2 321.342 4.061 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cc(F)c(F)cc1F)CCC2 ZINC001137893417 1046002660 /nfs/dbraw/zinc/00/26/60/1046002660.db2.gz UMCVIUQIDMQULT-UHFFFAOYSA-N 1 2 321.342 4.061 20 0 DIADLO CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]Cc1csc(N)n1 ZINC000902497916 1046007933 /nfs/dbraw/zinc/00/79/33/1046007933.db2.gz BUPBBEOQGMOWRK-LLVKDONJSA-N 1 2 315.442 4.193 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+][C@@H](C)C(C)(F)F)cc1OCC ZINC000453289015 1046017019 /nfs/dbraw/zinc/01/70/19/1046017019.db2.gz MDYSZZBCUKAUQA-RYUDHWBXSA-N 1 2 301.377 4.178 20 0 DIADLO Cc1ccc2[nH]c([C@@H]3CCC[N@@H+]3C[C@@H]3CC3(Cl)Cl)nc2c1 ZINC000829859428 1046019249 /nfs/dbraw/zinc/01/92/49/1046019249.db2.gz RBBSUWXSIGJBTR-FZMZJTMJSA-N 1 2 324.255 4.202 20 0 DIADLO Cc1ccc2[nH]c([C@@H]3CCC[N@H+]3C[C@@H]3CC3(Cl)Cl)nc2c1 ZINC000829859428 1046019263 /nfs/dbraw/zinc/01/92/63/1046019263.db2.gz RBBSUWXSIGJBTR-FZMZJTMJSA-N 1 2 324.255 4.202 20 0 DIADLO Cc1ccc2nc([C@@H]3CCC[N@@H+]3C[C@@H]3CC3(Cl)Cl)[nH]c2c1 ZINC000829859428 1046019278 /nfs/dbraw/zinc/01/92/78/1046019278.db2.gz RBBSUWXSIGJBTR-FZMZJTMJSA-N 1 2 324.255 4.202 20 0 DIADLO Cc1ccc2nc([C@@H]3CCC[N@H+]3C[C@@H]3CC3(Cl)Cl)[nH]c2c1 ZINC000829859428 1046019289 /nfs/dbraw/zinc/01/92/89/1046019289.db2.gz RBBSUWXSIGJBTR-FZMZJTMJSA-N 1 2 324.255 4.202 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2c(F)ccc(F)c2F)c1 ZINC001137931974 1046022678 /nfs/dbraw/zinc/02/26/78/1046022678.db2.gz CWOJEEAAEFWIOF-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2c(F)ccc(F)c2F)c1 ZINC001137931974 1046022699 /nfs/dbraw/zinc/02/26/99/1046022699.db2.gz CWOJEEAAEFWIOF-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1ccccc1O[C@@H]1CC[N@H+](Cc2c(F)ccc(F)c2F)C1 ZINC001137930160 1046023639 /nfs/dbraw/zinc/02/36/39/1046023639.db2.gz DQMOCHMHTRWTKT-CYBMUJFWSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1ccccc1O[C@@H]1CC[N@@H+](Cc2c(F)ccc(F)c2F)C1 ZINC001137930160 1046023651 /nfs/dbraw/zinc/02/36/51/1046023651.db2.gz DQMOCHMHTRWTKT-CYBMUJFWSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1ccc(OC(F)F)c([C@H](C)[NH2+][C@@H]2C[C@H](C)n3ccnc32)c1 ZINC000453332507 1046025630 /nfs/dbraw/zinc/02/56/30/1046025630.db2.gz AURFMUJBLPFTJM-SGMGOOAPSA-N 1 2 321.371 4.150 20 0 DIADLO CC(C)c1ccc2c(c1)[C@@H]([NH2+]Cc1nn(C)cc1Cl)CCC2 ZINC000453312313 1046032078 /nfs/dbraw/zinc/03/20/78/1046032078.db2.gz CREFNNLGWJSRPI-KRWDZBQOSA-N 1 2 317.864 4.364 20 0 DIADLO Fc1c(Cl)cccc1C[N@@H+]1CC[C@H]1COCc1ccccc1 ZINC001137961534 1046035483 /nfs/dbraw/zinc/03/54/83/1046035483.db2.gz QAQPUJVSWYWORE-INIZCTEOSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1c(Cl)cccc1C[N@H+]1CC[C@H]1COCc1ccccc1 ZINC001137961534 1046035495 /nfs/dbraw/zinc/03/54/95/1046035495.db2.gz QAQPUJVSWYWORE-INIZCTEOSA-N 1 2 319.807 4.270 20 0 DIADLO Cn1cc(Cl)c(C[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)n1 ZINC000453322435 1046037683 /nfs/dbraw/zinc/03/76/83/1046037683.db2.gz OYEQSBXWYNUSHG-OAHLLOKOSA-N 1 2 323.843 4.480 20 0 DIADLO CCC[C@@H]1CCCC[C@@H]1C[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000453339378 1046041186 /nfs/dbraw/zinc/04/11/86/1046041186.db2.gz BKYWFSJAOVPZSJ-FMKPAKJESA-N 1 2 318.490 4.152 20 0 DIADLO CCC[C@@H]1CCCC[C@H]1C[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000453339394 1046042318 /nfs/dbraw/zinc/04/23/18/1046042318.db2.gz BKYWFSJAOVPZSJ-YCPHGPKFSA-N 1 2 318.490 4.152 20 0 DIADLO COc1cccc2c1CC[C@H](Nc1ccc([NH+]3CCCC3)cc1)C2 ZINC000756041346 1046042665 /nfs/dbraw/zinc/04/26/65/1046042665.db2.gz LJKKDYAGGPLCMR-SFHVURJKSA-N 1 2 322.452 4.265 20 0 DIADLO Clc1nc2ccccc2cc1C[N@@H+]1CCC[C@@H]1c1cnccn1 ZINC001137977379 1046043289 /nfs/dbraw/zinc/04/32/89/1046043289.db2.gz LZMMJBMMIFXKEV-QGZVFWFLSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1nc2ccccc2cc1C[N@H+]1CCC[C@@H]1c1cnccn1 ZINC001137977379 1046043302 /nfs/dbraw/zinc/04/33/02/1046043302.db2.gz LZMMJBMMIFXKEV-QGZVFWFLSA-N 1 2 324.815 4.015 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(C2CC2)o1)c1ccccc1Br ZINC000453352005 1046051643 /nfs/dbraw/zinc/05/16/43/1046051643.db2.gz KMRMCMTUZIVFKR-JTQLQIEISA-N 1 2 321.218 4.165 20 0 DIADLO CCCc1ncc(C[NH2+][C@H](C)c2cc(Cl)ccc2OC)o1 ZINC000453388198 1046062811 /nfs/dbraw/zinc/06/28/11/1046062811.db2.gz PCKJDSOJFALODR-LLVKDONJSA-N 1 2 308.809 4.140 20 0 DIADLO CCc1ncc(C[NH2+][C@@H](C)c2cc(Cl)sc2Cl)o1 ZINC000453391334 1046081262 /nfs/dbraw/zinc/08/12/62/1046081262.db2.gz YRPDWXVWMIRKGE-ZETCQYMHSA-N 1 2 305.230 4.456 20 0 DIADLO Cc1cc(Br)c(C[N@H+](C)CCC(F)(F)F)s1 ZINC000453558380 1046088593 /nfs/dbraw/zinc/08/85/93/1046088593.db2.gz CVKPMUSYICFECB-UHFFFAOYSA-N 1 2 316.186 4.203 20 0 DIADLO Cc1cc(Br)c(C[N@@H+](C)CCC(F)(F)F)s1 ZINC000453558380 1046088607 /nfs/dbraw/zinc/08/86/07/1046088607.db2.gz CVKPMUSYICFECB-UHFFFAOYSA-N 1 2 316.186 4.203 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3ccccc3c(Cl)n2)CC2(CCC2)O1 ZINC000830734201 1046093092 /nfs/dbraw/zinc/09/30/92/1046093092.db2.gz HYLAEUQNNZUWHH-CYBMUJFWSA-N 1 2 316.832 4.032 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3ccccc3c(Cl)n2)CC2(CCC2)O1 ZINC000830734201 1046093104 /nfs/dbraw/zinc/09/31/04/1046093104.db2.gz HYLAEUQNNZUWHH-CYBMUJFWSA-N 1 2 316.832 4.032 20 0 DIADLO C[N@H+](Cc1cnc(-c2ccco2)s1)Cc1ccc(Cl)nc1 ZINC000194322134 1046097151 /nfs/dbraw/zinc/09/71/51/1046097151.db2.gz RQRRPIANMVOECT-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO C[N@@H+](Cc1cnc(-c2ccco2)s1)Cc1ccc(Cl)nc1 ZINC000194322134 1046097169 /nfs/dbraw/zinc/09/71/69/1046097169.db2.gz RQRRPIANMVOECT-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cccc3cccnc32)c1F ZINC001138118501 1046099125 /nfs/dbraw/zinc/09/91/25/1046099125.db2.gz LTBKBBIQLAAIAW-UHFFFAOYSA-N 1 2 312.363 4.453 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cccc3cccnc32)c1F ZINC001138118501 1046099134 /nfs/dbraw/zinc/09/91/34/1046099134.db2.gz LTBKBBIQLAAIAW-UHFFFAOYSA-N 1 2 312.363 4.453 20 0 DIADLO C[N@H+](Cc1ccc(N2CCCCC2)o1)Cc1ccccc1F ZINC001138175845 1046111261 /nfs/dbraw/zinc/11/12/61/1046111261.db2.gz IJLDSANVLQXKDV-UHFFFAOYSA-N 1 2 302.393 4.041 20 0 DIADLO C[N@@H+](Cc1ccc(N2CCCCC2)o1)Cc1ccccc1F ZINC001138175845 1046111270 /nfs/dbraw/zinc/11/12/70/1046111270.db2.gz IJLDSANVLQXKDV-UHFFFAOYSA-N 1 2 302.393 4.041 20 0 DIADLO C[C@H]1COCC[C@@H]1[NH2+]c1ccc(N(C)Cc2ccccc2)cc1 ZINC000195085970 1046113745 /nfs/dbraw/zinc/11/37/45/1046113745.db2.gz JPOWKROBWGLUDF-JXFKEZNVSA-N 1 2 310.441 4.160 20 0 DIADLO C[N@H+](Cc1ccc(N2CCCCC2)o1)Cc1cccc(F)c1F ZINC001138178864 1046114631 /nfs/dbraw/zinc/11/46/31/1046114631.db2.gz ZAICBKZSYIFXQJ-UHFFFAOYSA-N 1 2 320.383 4.180 20 0 DIADLO C[N@@H+](Cc1ccc(N2CCCCC2)o1)Cc1cccc(F)c1F ZINC001138178864 1046114637 /nfs/dbraw/zinc/11/46/37/1046114637.db2.gz ZAICBKZSYIFXQJ-UHFFFAOYSA-N 1 2 320.383 4.180 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+]Cc1nc(C)c2ccccc2n1 ZINC000532217619 1046116436 /nfs/dbraw/zinc/11/64/36/1046116436.db2.gz AZBYYZJZJNVKRW-CQSZACIVSA-N 1 2 321.424 4.188 20 0 DIADLO CC/C(C)=C/C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000831181560 1046122708 /nfs/dbraw/zinc/12/27/08/1046122708.db2.gz PVDBULZJAIJRMA-SDNWHVSQSA-N 1 2 309.413 4.181 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2ccc(C(F)(F)F)s2)co1 ZINC000903012582 1046141183 /nfs/dbraw/zinc/14/11/83/1046141183.db2.gz RALXKKKWTSHRTP-QMMMGPOBSA-N 1 2 304.337 4.168 20 0 DIADLO CC(C)(C)c1[nH]c2ccccc2c1C[NH+]1CC(F)(C2CC2)C1 ZINC001138310714 1046146877 /nfs/dbraw/zinc/14/68/77/1046146877.db2.gz NNWOSZUNSUQEOU-UHFFFAOYSA-N 1 2 300.421 4.399 20 0 DIADLO CC(C)OC(=O)[C@H](C)[N@H+](C)Cc1ccc(-c2cccs2)cc1 ZINC001168145724 1046148783 /nfs/dbraw/zinc/14/87/83/1046148783.db2.gz ORKYRTPYKNMGIB-AWEZNQCLSA-N 1 2 317.454 4.187 20 0 DIADLO CC(C)OC(=O)[C@H](C)[N@@H+](C)Cc1ccc(-c2cccs2)cc1 ZINC001168145724 1046148787 /nfs/dbraw/zinc/14/87/87/1046148787.db2.gz ORKYRTPYKNMGIB-AWEZNQCLSA-N 1 2 317.454 4.187 20 0 DIADLO CC[C@H]([NH2+][C@H](c1nncn1C)C(C)C)c1cccc(Cl)c1F ZINC000903066872 1046153213 /nfs/dbraw/zinc/15/32/13/1046153213.db2.gz XVCASZZRODMGTD-ZFWWWQNUSA-N 1 2 324.831 4.046 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+]Cc3cc(F)cc(F)c3)co2)cc1 ZINC000085299397 1046153224 /nfs/dbraw/zinc/15/32/24/1046153224.db2.gz RNESAWYHNUFICL-UHFFFAOYSA-N 1 2 314.335 4.218 20 0 DIADLO COc1ccc2c(c1Cl)[C@H]([NH2+]Cc1csc(C)n1)CCC2 ZINC000903072479 1046155522 /nfs/dbraw/zinc/15/55/22/1046155522.db2.gz DOEBJWJUIBMEKP-CYBMUJFWSA-N 1 2 322.861 4.281 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)cs1 ZINC000903091966 1046161484 /nfs/dbraw/zinc/16/14/84/1046161484.db2.gz DVBSMMBNYMDROI-STQMWFEESA-N 1 2 318.490 4.114 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000903089699 1046161667 /nfs/dbraw/zinc/16/16/67/1046161667.db2.gz ZMANNZIKCXYROC-HNNXBMFYSA-N 1 2 319.836 4.018 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000903089699 1046161675 /nfs/dbraw/zinc/16/16/75/1046161675.db2.gz ZMANNZIKCXYROC-HNNXBMFYSA-N 1 2 319.836 4.018 20 0 DIADLO C[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(C(F)(F)F)s1 ZINC000717968471 1046163529 /nfs/dbraw/zinc/16/35/29/1046163529.db2.gz ODZJDARSHKGPCA-ZETCQYMHSA-N 1 2 323.771 4.005 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2[nH]c3ccc(F)cc3c2C)no1 ZINC001138412064 1046170298 /nfs/dbraw/zinc/17/02/98/1046170298.db2.gz WRGGCJQXAAAATB-GOSISDBHSA-N 1 2 313.376 4.249 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2[nH]c3ccc(F)cc3c2C)no1 ZINC001138412064 1046170306 /nfs/dbraw/zinc/17/03/06/1046170306.db2.gz WRGGCJQXAAAATB-GOSISDBHSA-N 1 2 313.376 4.249 20 0 DIADLO Cc1c2cc(F)ccc2[nH]c1C[N@@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001138409649 1046170355 /nfs/dbraw/zinc/17/03/55/1046170355.db2.gz CKGCGASIFPLMJX-OAHLLOKOSA-N 1 2 314.326 4.185 20 0 DIADLO Cc1c2cc(F)ccc2[nH]c1C[N@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001138409649 1046170362 /nfs/dbraw/zinc/17/03/62/1046170362.db2.gz CKGCGASIFPLMJX-OAHLLOKOSA-N 1 2 314.326 4.185 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1[nH]c3ccc(F)cc3c1C)C2 ZINC001138413435 1046172792 /nfs/dbraw/zinc/17/27/92/1046172792.db2.gz RWEHFJQJPPHNIQ-UHFFFAOYSA-N 1 2 310.372 4.140 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1[nH]c3ccc(F)cc3c1C)C2 ZINC001138413435 1046172798 /nfs/dbraw/zinc/17/27/98/1046172798.db2.gz RWEHFJQJPPHNIQ-UHFFFAOYSA-N 1 2 310.372 4.140 20 0 DIADLO Cc1ccc(NC(=O)Nc2cccc(Cn3cc[nH+]c3)c2)cc1C ZINC001202827336 1046177809 /nfs/dbraw/zinc/17/78/09/1046177809.db2.gz XENQVZVNATXZQO-UHFFFAOYSA-N 1 2 320.396 4.192 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000102408215 1046179601 /nfs/dbraw/zinc/17/96/01/1046179601.db2.gz BXDKQVJUBVHNQN-UHFFFAOYSA-N 1 2 300.333 4.096 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000102408215 1046179604 /nfs/dbraw/zinc/17/96/04/1046179604.db2.gz BXDKQVJUBVHNQN-UHFFFAOYSA-N 1 2 300.333 4.096 20 0 DIADLO CCOc1ccc2ccccc2c1C[N@@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001138440059 1046182807 /nfs/dbraw/zinc/18/28/07/1046182807.db2.gz OIKQXPUXSQVTHZ-KRWDZBQOSA-N 1 2 323.358 4.418 20 0 DIADLO CCOc1ccc2ccccc2c1C[N@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001138440059 1046182809 /nfs/dbraw/zinc/18/28/09/1046182809.db2.gz OIKQXPUXSQVTHZ-KRWDZBQOSA-N 1 2 323.358 4.418 20 0 DIADLO Fc1ccc2c(c1Cl)[C@@H]([NH2+]Cc1nc3c(s1)CCC3)CC2 ZINC000903191263 1046188989 /nfs/dbraw/zinc/18/89/89/1046188989.db2.gz RMZLMMKVNRXFCM-LBPRGKRZSA-N 1 2 322.836 4.201 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1cc(N(C)C)ccn1 ZINC000903201582 1046191787 /nfs/dbraw/zinc/19/17/87/1046191787.db2.gz KCAYSLLALNVRPB-CQSZACIVSA-N 1 2 309.413 4.053 20 0 DIADLO O=C(C=C1CCCC1)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000757604623 1046192957 /nfs/dbraw/zinc/19/29/57/1046192957.db2.gz SSHXAQNGATYFGV-UHFFFAOYSA-N 1 2 319.408 4.041 20 0 DIADLO CCC/C(C)=C\C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000757604894 1046193635 /nfs/dbraw/zinc/19/36/35/1046193635.db2.gz XEMLXGJOANQQRX-QINSGFPZSA-N 1 2 321.424 4.287 20 0 DIADLO COc1ccc(C)cc1C[N@H+](C)Cc1ncccc1C(F)(F)F ZINC001138483985 1046195971 /nfs/dbraw/zinc/19/59/71/1046195971.db2.gz FIQJTRWPPBYIDH-UHFFFAOYSA-N 1 2 324.346 4.049 20 0 DIADLO COc1ccc(C)cc1C[N@@H+](C)Cc1ncccc1C(F)(F)F ZINC001138483985 1046195979 /nfs/dbraw/zinc/19/59/79/1046195979.db2.gz FIQJTRWPPBYIDH-UHFFFAOYSA-N 1 2 324.346 4.049 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1CCC(=O)[C@H](C)C12CCCC2 ZINC001138483522 1046196686 /nfs/dbraw/zinc/19/66/86/1046196686.db2.gz JSAOECAZPWRNJP-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1CCC(=O)[C@H](C)C12CCCC2 ZINC001138483522 1046196692 /nfs/dbraw/zinc/19/66/92/1046196692.db2.gz JSAOECAZPWRNJP-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1cc(OC)no1 ZINC000925262582 1046199804 /nfs/dbraw/zinc/19/98/04/1046199804.db2.gz NOWDAUDWHHOKHP-KGLIPLIRSA-N 1 2 318.417 4.020 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1)[NH2+]CC(F)(F)c1ccccn1 ZINC001168155934 1046203720 /nfs/dbraw/zinc/20/37/20/1046203720.db2.gz IMGPVOXVUPZLJK-LBPRGKRZSA-N 1 2 310.775 4.048 20 0 DIADLO CSc1cccc(NC(=O)[C@@H](CC(C)C)n2cc[nH+]c2)c1C ZINC000635768702 1046205355 /nfs/dbraw/zinc/20/53/55/1046205355.db2.gz RVBJXICAKIUBML-OAHLLOKOSA-N 1 2 317.458 4.139 20 0 DIADLO CCc1nc(C)c([C@H](C)[NH2+][C@H]2c3ccccc3OC[C@@H]2F)s1 ZINC000903270384 1046215869 /nfs/dbraw/zinc/21/58/69/1046215869.db2.gz DKOMICPRRXIUKH-RBOXIYTFSA-N 1 2 320.433 4.136 20 0 DIADLO Cc1cc(C)c(NC(=O)c2csc(C(F)(F)F)c2)c(C)[nH+]1 ZINC000636581530 1046230229 /nfs/dbraw/zinc/23/02/29/1046230229.db2.gz DQZGGURSZRKDIF-UHFFFAOYSA-N 1 2 314.332 4.339 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@H]2CC(C)(C)Cc3occc32)n1 ZINC000903312959 1046234700 /nfs/dbraw/zinc/23/47/00/1046234700.db2.gz DQPQPCRXORZLCS-ZDUSSCGKSA-N 1 2 302.418 4.368 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@H](c1ncccn1)C1CC1 ZINC000903323620 1046236995 /nfs/dbraw/zinc/23/69/95/1046236995.db2.gz BTKKETOAGAVUJD-FZMZJTMJSA-N 1 2 316.474 4.167 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1ccccc1N1CCCCC1)C2 ZINC001138605432 1046238502 /nfs/dbraw/zinc/23/85/02/1046238502.db2.gz KEFKNCUVLKYUGL-UHFFFAOYSA-N 1 2 310.416 4.332 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1ccccc1N1CCCCC1)C2 ZINC001138605432 1046238514 /nfs/dbraw/zinc/23/85/14/1046238514.db2.gz KEFKNCUVLKYUGL-UHFFFAOYSA-N 1 2 310.416 4.332 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ncccn1)C1CC1)c1ccc(Cl)c(F)c1 ZINC000903327624 1046241471 /nfs/dbraw/zinc/24/14/71/1046241471.db2.gz WUNJQNILBYDANY-BMIGLBTASA-N 1 2 305.784 4.071 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+][C@@H](c2ncccn2)C2CC2)cc1F ZINC000903327765 1046241731 /nfs/dbraw/zinc/24/17/31/1046241731.db2.gz YNYUUMHBGMTPDZ-BDJLRTHQSA-N 1 2 317.433 4.140 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@H](c1ncccc1C)C(C)(C)C ZINC000903328046 1046242715 /nfs/dbraw/zinc/24/27/15/1046242715.db2.gz DDKLFZAGDBDUPV-RDTXWAMCSA-N 1 2 313.445 4.441 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ncccn1)C1CC1)c1ccc(F)c(Cl)c1 ZINC000903331899 1046244866 /nfs/dbraw/zinc/24/48/66/1046244866.db2.gz KPAQQVCDHHNLSP-BMIGLBTASA-N 1 2 305.784 4.071 20 0 DIADLO COc1ccc2c(c1)CC[N@@H+](Cc1cc(F)ccc1Cl)C2 ZINC001138671626 1046263037 /nfs/dbraw/zinc/26/30/37/1046263037.db2.gz HHSDHJIRPZNLSC-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc2c(c1)CC[N@H+](Cc1cc(F)ccc1Cl)C2 ZINC001138671626 1046263045 /nfs/dbraw/zinc/26/30/45/1046263045.db2.gz HHSDHJIRPZNLSC-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(-c3ccccn3)nc2)[C@H]1c1ccco1 ZINC000639930483 1046271028 /nfs/dbraw/zinc/27/10/28/1046271028.db2.gz XJNAHNYDCGYUQC-IBGZPJMESA-N 1 2 319.408 4.320 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(-c3ccccn3)nc2)[C@H]1c1ccco1 ZINC000639930483 1046271037 /nfs/dbraw/zinc/27/10/37/1046271037.db2.gz XJNAHNYDCGYUQC-IBGZPJMESA-N 1 2 319.408 4.320 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2SC(F)(F)F)no1 ZINC000903421230 1046273352 /nfs/dbraw/zinc/27/33/52/1046273352.db2.gz FZLIFGAEPRBWQQ-SNVBAGLBSA-N 1 2 316.348 4.446 20 0 DIADLO CSc1ncc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)cn1 ZINC001138707595 1046274372 /nfs/dbraw/zinc/27/43/72/1046274372.db2.gz NYNNPPFKDGCNBP-NSHDSACASA-N 1 2 307.850 4.045 20 0 DIADLO CSc1ncc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)cn1 ZINC001138707595 1046274383 /nfs/dbraw/zinc/27/43/83/1046274383.db2.gz NYNNPPFKDGCNBP-NSHDSACASA-N 1 2 307.850 4.045 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cc(Br)cnc2Cl)[C@H]1C ZINC001138945060 1046334691 /nfs/dbraw/zinc/33/46/91/1046334691.db2.gz PSSVXAMQDYPONM-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cc(Br)cnc2Cl)[C@H]1C ZINC001138945060 1046334701 /nfs/dbraw/zinc/33/47/01/1046334701.db2.gz PSSVXAMQDYPONM-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)c1ccc(Cl)s1 ZINC000638337083 1046313348 /nfs/dbraw/zinc/31/33/48/1046313348.db2.gz MBXAKLOYLYDSHI-QMTHXVAHSA-N 1 2 324.881 4.492 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1ccsc1)c1ccccn1 ZINC000089797022 1046315620 /nfs/dbraw/zinc/31/56/20/1046315620.db2.gz SNPPFCQKVKLFPY-GOSISDBHSA-N 1 2 310.422 4.031 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)c(C)c1 ZINC000638399057 1046318401 /nfs/dbraw/zinc/31/84/01/1046318401.db2.gz XZAWETJIKHPPOE-YJBOKZPZSA-N 1 2 312.461 4.394 20 0 DIADLO c1c(C[NH2+]Cc2ccccc2OC2CCCC2)onc1C1CC1 ZINC000638384352 1046319983 /nfs/dbraw/zinc/31/99/83/1046319983.db2.gz OELSMTGMRGOTMV-UHFFFAOYSA-N 1 2 312.413 4.163 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(OCC2CC2)c(F)c1)c1ncco1 ZINC000925268494 1046320623 /nfs/dbraw/zinc/32/06/23/1046320623.db2.gz IDIJLRKHFIGKSB-VXGBXAGGSA-N 1 2 304.365 4.014 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(OCC2CC2)c(F)c1)c1ncco1 ZINC000925268488 1046321642 /nfs/dbraw/zinc/32/16/42/1046321642.db2.gz IDIJLRKHFIGKSB-RYUDHWBXSA-N 1 2 304.365 4.014 20 0 DIADLO CCc1cccc(NC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001202875005 1046321534 /nfs/dbraw/zinc/32/15/34/1046321534.db2.gz DJHYFTSAUZUGFX-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO Cn1c2ccccc2c2cc(C[N@@H+]3C[C@@H](F)C[C@H]3CF)ccc21 ZINC001138915908 1046325801 /nfs/dbraw/zinc/32/58/01/1046325801.db2.gz DWOQTRRXUQPYIZ-GJZGRUSLSA-N 1 2 314.379 4.213 20 0 DIADLO Cn1c2ccccc2c2cc(C[N@H+]3C[C@@H](F)C[C@H]3CF)ccc21 ZINC001138915908 1046325810 /nfs/dbraw/zinc/32/58/10/1046325810.db2.gz DWOQTRRXUQPYIZ-GJZGRUSLSA-N 1 2 314.379 4.213 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@H]3CC[C@H](C)C3)c2)[nH+]c1C ZINC000759164455 1046327032 /nfs/dbraw/zinc/32/70/32/1046327032.db2.gz YDWLDMKSMVIDMB-WFASDCNBSA-N 1 2 311.429 4.458 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1nc2ccccc2o1 ZINC000246220350 1046329004 /nfs/dbraw/zinc/32/90/04/1046329004.db2.gz YXOVOPJXRLVOKM-STXHMFSFSA-N 1 2 322.408 4.178 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1nc2ccccc2o1 ZINC000246220350 1046329014 /nfs/dbraw/zinc/32/90/14/1046329014.db2.gz YXOVOPJXRLVOKM-STXHMFSFSA-N 1 2 322.408 4.178 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cc(Br)cnc1Cl ZINC001138945261 1046330654 /nfs/dbraw/zinc/33/06/54/1046330654.db2.gz XQDBVDPLFINOTI-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cc(Br)cnc1Cl ZINC001138945261 1046330666 /nfs/dbraw/zinc/33/06/66/1046330666.db2.gz XQDBVDPLFINOTI-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1ccc(C[C@@H](C)[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)s1 ZINC000638661194 1046332994 /nfs/dbraw/zinc/33/29/94/1046332994.db2.gz YPSJJLUXQKKEJI-WBMJQRKESA-N 1 2 318.490 4.017 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccc(Cl)nc1 ZINC000179118127 1046334610 /nfs/dbraw/zinc/33/46/10/1046334610.db2.gz VGEJVZUYHVYRLB-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1nc(C[N@@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@H]2C)sc1C ZINC000246324247 1046343716 /nfs/dbraw/zinc/34/37/16/1046343716.db2.gz XGKYEZGSHXXJCU-DFHBCGBQSA-N 1 2 316.470 4.110 20 0 DIADLO Cc1nc(C[N@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@H]2C)sc1C ZINC000246324247 1046343720 /nfs/dbraw/zinc/34/37/20/1046343720.db2.gz XGKYEZGSHXXJCU-DFHBCGBQSA-N 1 2 316.470 4.110 20 0 DIADLO CCCCOc1ccc(C[NH2+]Cc2ncc(C)o2)cc1Cl ZINC000639089635 1046356085 /nfs/dbraw/zinc/35/60/85/1046356085.db2.gz BLQBTJFHIXELIU-UHFFFAOYSA-N 1 2 308.809 4.105 20 0 DIADLO C[C@H](CCCC(F)(F)F)[NH2+][C@H](c1ncn[nH]1)C1CCCCC1 ZINC000639106015 1046359348 /nfs/dbraw/zinc/35/93/48/1046359348.db2.gz KFIJYEPXWJYPHX-YPMHNXCESA-N 1 2 318.387 4.137 20 0 DIADLO C[C@@H](Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)[C@H]1CC1(F)F ZINC000639123293 1046360611 /nfs/dbraw/zinc/36/06/11/1046360611.db2.gz IJEBJTTXQMKTCJ-MLGOLLRUSA-N 1 2 317.383 4.342 20 0 DIADLO Cc1ccccc1C1([NH2+][C@H](c2nnc[nH]2)C2CCCCC2)CC1 ZINC000639281229 1046376030 /nfs/dbraw/zinc/37/60/30/1046376030.db2.gz FQDIZLFVWYYJSQ-KRWDZBQOSA-N 1 2 310.445 4.013 20 0 DIADLO Cc1ccccc1C1([NH2+][C@H](c2nnc[nH]2)C2CCCCC2)CCC1 ZINC000639290859 1046377316 /nfs/dbraw/zinc/37/73/16/1046377316.db2.gz WGUQOYJXYSVCFH-SFHVURJKSA-N 1 2 324.472 4.404 20 0 DIADLO CC1(C)CN(c2[nH+]ccc3c(N)cccc32)CC[C@H]1C(F)(F)F ZINC000663838401 1046380213 /nfs/dbraw/zinc/38/02/13/1046380213.db2.gz JBOALGIRZNYYRI-CQSZACIVSA-N 1 2 323.362 4.232 20 0 DIADLO CCC1CC[NH+](Cc2ccc(Br)nc2Cl)CC1 ZINC001139109405 1046384023 /nfs/dbraw/zinc/38/40/23/1046384023.db2.gz INYBPAHVKKRVKX-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCc3ccnc(Cl)c3)c2c1 ZINC000748589925 1046385159 /nfs/dbraw/zinc/38/51/59/1046385159.db2.gz SKPMLGJGIDXSEV-UHFFFAOYSA-N 1 2 314.772 4.179 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccc(Br)nc1Cl ZINC001139107230 1046385991 /nfs/dbraw/zinc/38/59/91/1046385991.db2.gz AJLGZDJLQBWZEG-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO CC[C@H]1CCC[N@H+](Cc2ccc(Br)nc2Cl)C1 ZINC001139114783 1046390450 /nfs/dbraw/zinc/39/04/50/1046390450.db2.gz STSALSDNAIJQPL-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@H]1CCC[N@@H+](Cc2ccc(Br)nc2Cl)C1 ZINC001139114783 1046390463 /nfs/dbraw/zinc/39/04/63/1046390463.db2.gz STSALSDNAIJQPL-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO C[C@H]([NH2+]Cc1cc[nH]n1)c1ccc(Cl)c(Cl)c1Cl ZINC000041015391 1046392163 /nfs/dbraw/zinc/39/21/63/1046392163.db2.gz XAJWNVTUOAPYHG-ZETCQYMHSA-N 1 2 304.608 4.221 20 0 DIADLO CCc1nnc(C[N@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)o1 ZINC000170913645 1046392957 /nfs/dbraw/zinc/39/29/57/1046392957.db2.gz BJHIMQGLFWGXHI-NSHDSACASA-N 1 2 305.809 4.011 20 0 DIADLO CCc1nnc(C[N@@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)o1 ZINC000170913645 1046392971 /nfs/dbraw/zinc/39/29/71/1046392971.db2.gz BJHIMQGLFWGXHI-NSHDSACASA-N 1 2 305.809 4.011 20 0 DIADLO Cc1ccc2cc(NCc3cccc4cn(C)nc43)[nH+]cc2c1 ZINC001168198204 1046395652 /nfs/dbraw/zinc/39/56/52/1046395652.db2.gz HFFRWSRZDJGVII-UHFFFAOYSA-N 1 2 302.381 4.042 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000780593721 1046395461 /nfs/dbraw/zinc/39/54/61/1046395461.db2.gz WVEILHVZPMCVAY-AEFFLSMTSA-N 1 2 305.466 4.043 20 0 DIADLO Cc1c(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)cnn1CC(C)C ZINC000347370372 1046400302 /nfs/dbraw/zinc/40/03/02/1046400302.db2.gz MBOBOFUEEWDPEV-OAHLLOKOSA-N 1 2 323.444 4.206 20 0 DIADLO COc1cccc(-c2nc(C[N@H+](C)[C@@H](C)c3ccco3)co2)c1 ZINC000639461996 1046402879 /nfs/dbraw/zinc/40/28/79/1046402879.db2.gz LEQMSZZVRQMRPP-ZDUSSCGKSA-N 1 2 312.369 4.136 20 0 DIADLO COc1cccc(-c2nc(C[N@@H+](C)[C@@H](C)c3ccco3)co2)c1 ZINC000639461996 1046402888 /nfs/dbraw/zinc/40/28/88/1046402888.db2.gz LEQMSZZVRQMRPP-ZDUSSCGKSA-N 1 2 312.369 4.136 20 0 DIADLO CC(C)(C)C[C@H]([NH2+]Cc1nc(CC2CC2)no1)c1ccccc1 ZINC000639562891 1046411426 /nfs/dbraw/zinc/41/14/26/1046411426.db2.gz YALVVQSBDKXDAK-INIZCTEOSA-N 1 2 313.445 4.289 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CCC2)no1)c1cc2ccccc2s1 ZINC000639582056 1046415324 /nfs/dbraw/zinc/41/53/24/1046415324.db2.gz ZRBJJXUCNFUUOT-LLVKDONJSA-N 1 2 313.426 4.403 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(CC2CC2)no1)c1cc2ccccc2s1 ZINC000639580106 1046415391 /nfs/dbraw/zinc/41/53/91/1046415391.db2.gz KQFZOFFSVYCCGI-LLVKDONJSA-N 1 2 313.426 4.088 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc(Oc2ccccc2)nc1 ZINC001139247471 1046418819 /nfs/dbraw/zinc/41/88/19/1046418819.db2.gz GBDXXKPCCFRAFW-INIZCTEOSA-N 1 2 319.408 4.252 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccc(Oc2ccccc2)nc1 ZINC001139247471 1046418827 /nfs/dbraw/zinc/41/88/27/1046418827.db2.gz GBDXXKPCCFRAFW-INIZCTEOSA-N 1 2 319.408 4.252 20 0 DIADLO CC(=O)C[N@@H+](C)Cc1ccccc1Oc1ccc(Cl)cc1 ZINC001139260862 1046421146 /nfs/dbraw/zinc/42/11/46/1046421146.db2.gz AEFRWGVBKYXIJP-UHFFFAOYSA-N 1 2 303.789 4.153 20 0 DIADLO CC(=O)C[N@H+](C)Cc1ccccc1Oc1ccc(Cl)cc1 ZINC001139260862 1046421150 /nfs/dbraw/zinc/42/11/50/1046421150.db2.gz AEFRWGVBKYXIJP-UHFFFAOYSA-N 1 2 303.789 4.153 20 0 DIADLO Clc1ccc(Oc2ccccc2C[N@@H+]2C[C@@H]3C[C@H]2CO3)cc1 ZINC001139264519 1046422373 /nfs/dbraw/zinc/42/23/73/1046422373.db2.gz RDEABOBBJMODON-RDJZCZTQSA-N 1 2 315.800 4.105 20 0 DIADLO Clc1ccc(Oc2ccccc2C[N@H+]2C[C@@H]3C[C@H]2CO3)cc1 ZINC001139264519 1046422379 /nfs/dbraw/zinc/42/23/79/1046422379.db2.gz RDEABOBBJMODON-RDJZCZTQSA-N 1 2 315.800 4.105 20 0 DIADLO CCCCOc1ccc(C[NH2+]Cc2ncc(Cl)s2)cc1 ZINC000719387193 1046424483 /nfs/dbraw/zinc/42/44/83/1046424483.db2.gz XZHFLPZKPKLANE-UHFFFAOYSA-N 1 2 310.850 4.265 20 0 DIADLO Clc1ccc(Cl)c(CC[N@@H+]2CCC[C@H]2c2ncccn2)c1 ZINC000639864456 1046431959 /nfs/dbraw/zinc/43/19/59/1046431959.db2.gz CZLCFRJSEOSYGU-HNNXBMFYSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1ccc(Cl)c(CC[N@H+]2CCC[C@H]2c2ncccn2)c1 ZINC000639864456 1046431968 /nfs/dbraw/zinc/43/19/68/1046431968.db2.gz CZLCFRJSEOSYGU-HNNXBMFYSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1ccc(C[N@@H+]2CCC[C@@H]2c2ncccn2)c2ncccc12 ZINC000639843333 1046432388 /nfs/dbraw/zinc/43/23/88/1046432388.db2.gz PUKXPMPCZQHBRN-MRXNPFEDSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1ccc(C[N@H+]2CCC[C@@H]2c2ncccn2)c2ncccc12 ZINC000639843333 1046432395 /nfs/dbraw/zinc/43/23/95/1046432395.db2.gz PUKXPMPCZQHBRN-MRXNPFEDSA-N 1 2 324.815 4.015 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(Cl)cnc2Cl)CCC1(F)F ZINC001139352808 1046436023 /nfs/dbraw/zinc/43/60/23/1046436023.db2.gz AJZGQOGYZMMNBS-UHFFFAOYSA-N 1 2 309.187 4.256 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(Cl)cnc2Cl)CCC1(F)F ZINC001139352808 1046436033 /nfs/dbraw/zinc/43/60/33/1046436033.db2.gz AJZGQOGYZMMNBS-UHFFFAOYSA-N 1 2 309.187 4.256 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccccc2OC(C)C)c(C)s1 ZINC000676838891 1046439991 /nfs/dbraw/zinc/43/99/91/1046439991.db2.gz HMRVCZYIWOIZDV-GFCCVEGCSA-N 1 2 304.459 4.398 20 0 DIADLO Clc1ccc(Cl)c(C[NH2+]Cc2nc3c(s2)CCC3)c1 ZINC000719541156 1046441458 /nfs/dbraw/zinc/44/14/58/1046441458.db2.gz VCSITBDFZRHQOI-UHFFFAOYSA-N 1 2 313.253 4.228 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2coc(-c3cccc(F)c3)n2)s1 ZINC000639995893 1046441614 /nfs/dbraw/zinc/44/16/14/1046441614.db2.gz ZYQPQMHKXTYWJB-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO C[C@@H](c1nc2ccccc2n1C(F)F)[NH+]1CCC(C)(F)CC1 ZINC000640071134 1046446752 /nfs/dbraw/zinc/44/67/52/1046446752.db2.gz XZWKJKIIJIYLNU-NSHDSACASA-N 1 2 311.351 4.316 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc(-c2ccsc2)nc1 ZINC001139505011 1046458088 /nfs/dbraw/zinc/45/80/88/1046458088.db2.gz MOJNYTALLGPGDQ-CQSZACIVSA-N 1 2 309.438 4.188 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccc(-c2ccsc2)nc1 ZINC001139505011 1046458092 /nfs/dbraw/zinc/45/80/92/1046458092.db2.gz MOJNYTALLGPGDQ-CQSZACIVSA-N 1 2 309.438 4.188 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc(-c3ccsc3)nc1)C2 ZINC001139505222 1046458312 /nfs/dbraw/zinc/45/83/12/1046458312.db2.gz PSRGPKIQEDWPAJ-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc(-c3ccsc3)nc1)C2 ZINC001139505222 1046458320 /nfs/dbraw/zinc/45/83/20/1046458320.db2.gz PSRGPKIQEDWPAJ-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2ccc(-c3ccsc3)nc2)C[C@H]1F ZINC001139501517 1046458637 /nfs/dbraw/zinc/45/86/37/1046458637.db2.gz UBPWCJMJSHZHNY-HZPDHXFCSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2ccc(-c3ccsc3)nc2)C[C@H]1F ZINC001139501517 1046458645 /nfs/dbraw/zinc/45/86/45/1046458645.db2.gz UBPWCJMJSHZHNY-HZPDHXFCSA-N 1 2 308.397 4.082 20 0 DIADLO Fc1cc2c(cc1F)C[N@H+](Cc1cnc3ccccc3c1)CC2 ZINC001137285770 1046470110 /nfs/dbraw/zinc/47/01/10/1046470110.db2.gz HBFZEKIABGCROT-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1cc2c(cc1F)C[N@@H+](Cc1cnc3ccccc3c1)CC2 ZINC001137285770 1046470118 /nfs/dbraw/zinc/47/01/18/1046470118.db2.gz HBFZEKIABGCROT-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cc(Cl)ccn1 ZINC001139565453 1046472236 /nfs/dbraw/zinc/47/22/36/1046472236.db2.gz ZYAOMUKKGGJOPG-QGZVFWFLSA-N 1 2 316.832 4.218 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cc(Cl)ccn1 ZINC001139565453 1046472245 /nfs/dbraw/zinc/47/22/45/1046472245.db2.gz ZYAOMUKKGGJOPG-QGZVFWFLSA-N 1 2 316.832 4.218 20 0 DIADLO CC(C)c1nc2n(n1)CCC[C@H]2[NH2+][C@H](C)c1ccccc1Cl ZINC000126128953 1046473800 /nfs/dbraw/zinc/47/38/00/1046473800.db2.gz VMZCUZPFPRCFFY-IUODEOHRSA-N 1 2 318.852 4.241 20 0 DIADLO Cn1c[nH+]cc1CNc1ccc(CCCc2ccccc2)cc1 ZINC000126017322 1046474773 /nfs/dbraw/zinc/47/47/73/1046474773.db2.gz SLNUVXGCUMXMEN-UHFFFAOYSA-N 1 2 305.425 4.208 20 0 DIADLO CCOC(=O)C[N@H+](C)Cc1ccccc1-c1ccccc1Cl ZINC001139572985 1046475237 /nfs/dbraw/zinc/47/52/37/1046475237.db2.gz BRWHCHJJAKEXPB-UHFFFAOYSA-N 1 2 317.816 4.002 20 0 DIADLO CCOC(=O)C[N@@H+](C)Cc1ccccc1-c1ccccc1Cl ZINC001139572985 1046475243 /nfs/dbraw/zinc/47/52/43/1046475243.db2.gz BRWHCHJJAKEXPB-UHFFFAOYSA-N 1 2 317.816 4.002 20 0 DIADLO C[C@H]1C[C@@H](CCNC(=O)c2cc3c[nH+]ccc3[nH]2)CC(C)(C)C1 ZINC001139604740 1046483197 /nfs/dbraw/zinc/48/31/97/1046483197.db2.gz AWVHBHOBNBENGY-UONOGXRCSA-N 1 2 313.445 4.145 20 0 DIADLO Cc1csc(C[N@@H+](C)Cc2cccc3c2OCO3)c1Cl ZINC001137293901 1046483719 /nfs/dbraw/zinc/48/37/19/1046483719.db2.gz GZQPZAMUIKNMDF-UHFFFAOYSA-N 1 2 309.818 4.071 20 0 DIADLO Cc1csc(C[N@H+](C)Cc2cccc3c2OCO3)c1Cl ZINC001137293901 1046483721 /nfs/dbraw/zinc/48/37/21/1046483721.db2.gz GZQPZAMUIKNMDF-UHFFFAOYSA-N 1 2 309.818 4.071 20 0 DIADLO COc1ccncc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)s1 ZINC001139609304 1046484063 /nfs/dbraw/zinc/48/40/63/1046484063.db2.gz UCDRAMOMDBMBDN-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccncc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)s1 ZINC001139609304 1046484065 /nfs/dbraw/zinc/48/40/65/1046484065.db2.gz UCDRAMOMDBMBDN-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cc(C[N@@H+]2CCc3ccc(F)cc3C2)ccc1Cl ZINC001139614906 1046486652 /nfs/dbraw/zinc/48/66/52/1046486652.db2.gz WDVYGHAPOUBUSL-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(C[N@H+]2CCc3ccc(F)cc3C2)ccc1Cl ZINC001139614906 1046486657 /nfs/dbraw/zinc/48/66/57/1046486657.db2.gz WDVYGHAPOUBUSL-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CCOc1ccc(C[N@@H+]2Cc3ccc(OC)cc3C2)cc1CC ZINC001139623859 1046489375 /nfs/dbraw/zinc/48/93/75/1046489375.db2.gz PLNGVZGIQNSIIG-UHFFFAOYSA-N 1 2 311.425 4.172 20 0 DIADLO CCOc1ccc(C[N@H+]2Cc3ccc(OC)cc3C2)cc1CC ZINC001139623859 1046489380 /nfs/dbraw/zinc/48/93/80/1046489380.db2.gz PLNGVZGIQNSIIG-UHFFFAOYSA-N 1 2 311.425 4.172 20 0 DIADLO Cc1csc(C[N@@H+](C)Cc2ccc(Cl)nc2)c1Cl ZINC001137292807 1046491143 /nfs/dbraw/zinc/49/11/43/1046491143.db2.gz QHMWBGLZYZEWRI-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1csc(C[N@H+](C)Cc2ccc(Cl)nc2)c1Cl ZINC001137292807 1046491147 /nfs/dbraw/zinc/49/11/47/1046491147.db2.gz QHMWBGLZYZEWRI-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1ccc(-c3cccnc3)cc1)C2 ZINC001139645295 1046492816 /nfs/dbraw/zinc/49/28/16/1046492816.db2.gz FPACHFBCBPZUMU-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1ccc(-c3cccnc3)cc1)C2 ZINC001139645295 1046492821 /nfs/dbraw/zinc/49/28/21/1046492821.db2.gz FPACHFBCBPZUMU-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Clc1ccc2c(c1)CC[C@@H]2[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000782180937 1046498031 /nfs/dbraw/zinc/49/80/31/1046498031.db2.gz LFXFWNDCWDDKCA-JKSUJKDBSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)CC[C@@H]2[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000782180937 1046498036 /nfs/dbraw/zinc/49/80/36/1046498036.db2.gz LFXFWNDCWDDKCA-JKSUJKDBSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)CC[C@H]2[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000782191580 1046499998 /nfs/dbraw/zinc/49/99/98/1046499998.db2.gz XRAWNRVRLPTOBA-SJORKVTESA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)CC[C@H]2[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000782191580 1046500004 /nfs/dbraw/zinc/50/00/04/1046500004.db2.gz XRAWNRVRLPTOBA-SJORKVTESA-N 1 2 319.857 4.462 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@@H](F)C2)cc1Br ZINC001139728618 1046506516 /nfs/dbraw/zinc/50/65/16/1046506516.db2.gz AQWBLYIRZKTLDC-CYBMUJFWSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@@H](F)C2)cc1Br ZINC001139728618 1046506531 /nfs/dbraw/zinc/50/65/31/1046506531.db2.gz AQWBLYIRZKTLDC-CYBMUJFWSA-N 1 2 300.215 4.082 20 0 DIADLO C[C@H]([NH2+]Cc1cscc1Cl)c1nc2ccccc2n1C ZINC000641726206 1046507806 /nfs/dbraw/zinc/50/78/06/1046507806.db2.gz OMGKTWFIWBCPTH-JTQLQIEISA-N 1 2 305.834 4.139 20 0 DIADLO CCc1cc(C[NH2+][C@H]2CCc3cc(Cl)cc(Cl)c32)on1 ZINC000677655130 1046509518 /nfs/dbraw/zinc/50/95/18/1046509518.db2.gz RMHOLYULILMVDX-AWEZNQCLSA-N 1 2 311.212 4.321 20 0 DIADLO CCc1cc(C[NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c32)on1 ZINC000677655131 1046510422 /nfs/dbraw/zinc/51/04/22/1046510422.db2.gz RMHOLYULILMVDX-CQSZACIVSA-N 1 2 311.212 4.321 20 0 DIADLO COc1ncc(Cl)cc1C[N@H+](C)Cc1ccc(Cl)cc1 ZINC001139749646 1046510812 /nfs/dbraw/zinc/51/08/12/1046510812.db2.gz GSDAJKRMJVSZRM-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ncc(Cl)cc1C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001139749646 1046510815 /nfs/dbraw/zinc/51/08/15/1046510815.db2.gz GSDAJKRMJVSZRM-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO CCCc1nc(C[N@H+](C)CCOc2ccccc2Cl)cs1 ZINC000641853450 1046519842 /nfs/dbraw/zinc/51/98/42/1046519842.db2.gz JWHSULIRBHXDJD-UHFFFAOYSA-N 1 2 324.877 4.260 20 0 DIADLO CCCc1nc(C[N@@H+](C)CCOc2ccccc2Cl)cs1 ZINC000641853450 1046519850 /nfs/dbraw/zinc/51/98/50/1046519850.db2.gz JWHSULIRBHXDJD-UHFFFAOYSA-N 1 2 324.877 4.260 20 0 DIADLO Cc1ccc2[nH+]c(CSc3nc(-c4ccccc4)c[nH]3)cn2c1 ZINC000641876921 1046521532 /nfs/dbraw/zinc/52/15/32/1046521532.db2.gz ZWDNNNXLGCRTSM-UHFFFAOYSA-N 1 2 320.421 4.325 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)s1 ZINC001139818026 1046523605 /nfs/dbraw/zinc/52/36/05/1046523605.db2.gz QTIMRWVTLMCQFN-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)s1 ZINC001139818026 1046523609 /nfs/dbraw/zinc/52/36/09/1046523609.db2.gz QTIMRWVTLMCQFN-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2ccccc2Br)CC1 ZINC000237809778 1046531088 /nfs/dbraw/zinc/53/10/88/1046531088.db2.gz DWIOVVYDOSOAIR-UHFFFAOYSA-N 1 2 320.205 4.367 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)c(Cl)c1)[C@H](C)c1nc(C)no1 ZINC000677886148 1046534020 /nfs/dbraw/zinc/53/40/20/1046534020.db2.gz KXIUWTZQIQXDMV-SECBINFHSA-N 1 2 314.216 4.268 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@H](C)c1nc(C)no1 ZINC000677886148 1046534036 /nfs/dbraw/zinc/53/40/36/1046534036.db2.gz KXIUWTZQIQXDMV-SECBINFHSA-N 1 2 314.216 4.268 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@H]2c2cccc(C)c2C)c(C)c[nH+]1 ZINC000536621040 1046534280 /nfs/dbraw/zinc/53/42/80/1046534280.db2.gz XUERFEZMEPGRFR-IBGZPJMESA-N 1 2 323.440 4.106 20 0 DIADLO CCCCc1noc(C[N@H+](CCC)Cc2ccc(C)cc2)n1 ZINC000641979650 1046534935 /nfs/dbraw/zinc/53/49/35/1046534935.db2.gz XEURRKVEMAPLSW-UHFFFAOYSA-N 1 2 301.434 4.133 20 0 DIADLO CCCCc1noc(C[N@@H+](CCC)Cc2ccc(C)cc2)n1 ZINC000641979650 1046534944 /nfs/dbraw/zinc/53/49/44/1046534944.db2.gz XEURRKVEMAPLSW-UHFFFAOYSA-N 1 2 301.434 4.133 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1C[N@@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001139888050 1046545860 /nfs/dbraw/zinc/54/58/60/1046545860.db2.gz JEJNSYHZPVKJNP-KBPBESRZSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1ccc(C(F)(F)F)cc1C[N@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001139888050 1046545865 /nfs/dbraw/zinc/54/58/65/1046545865.db2.gz JEJNSYHZPVKJNP-KBPBESRZSA-N 1 2 307.306 4.286 20 0 DIADLO Brc1ccc([C@H]2CCCN2c2cccc[nH+]2)cc1 ZINC000152499233 1046550172 /nfs/dbraw/zinc/55/01/72/1046550172.db2.gz MNWBHPAYFAPGIF-CQSZACIVSA-N 1 2 303.203 4.186 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1[nH]nc2ccccc21 ZINC000678126471 1046559954 /nfs/dbraw/zinc/55/99/54/1046559954.db2.gz UUHSBZDMJOJVFB-LBPRGKRZSA-N 1 2 322.437 4.366 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1[nH]nc2ccccc21 ZINC000678126471 1046559967 /nfs/dbraw/zinc/55/99/67/1046559967.db2.gz UUHSBZDMJOJVFB-LBPRGKRZSA-N 1 2 322.437 4.366 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cnc([C@@H]3CCCO3)s2)C2CC2)o1 ZINC000678135079 1046560944 /nfs/dbraw/zinc/56/09/44/1046560944.db2.gz GGCWNMREDOZRKL-INIZCTEOSA-N 1 2 318.442 4.061 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cnc([C@@H]3CCCO3)s2)C2CC2)o1 ZINC000678135079 1046560952 /nfs/dbraw/zinc/56/09/52/1046560952.db2.gz GGCWNMREDOZRKL-INIZCTEOSA-N 1 2 318.442 4.061 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+](Cc3csc(Cl)n3)C2)c1 ZINC001139984417 1046561947 /nfs/dbraw/zinc/56/19/47/1046561947.db2.gz JUWBGYQLWKSQHB-CYBMUJFWSA-N 1 2 322.861 4.185 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+](Cc3csc(Cl)n3)C2)c1 ZINC001139984417 1046561967 /nfs/dbraw/zinc/56/19/67/1046561967.db2.gz JUWBGYQLWKSQHB-CYBMUJFWSA-N 1 2 322.861 4.185 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cnc([C@H]3CCCO3)s2)C2CC2)o1 ZINC000678135086 1046564756 /nfs/dbraw/zinc/56/47/56/1046564756.db2.gz GGCWNMREDOZRKL-MRXNPFEDSA-N 1 2 318.442 4.061 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cnc([C@H]3CCCO3)s2)C2CC2)o1 ZINC000678135086 1046564771 /nfs/dbraw/zinc/56/47/71/1046564771.db2.gz GGCWNMREDOZRKL-MRXNPFEDSA-N 1 2 318.442 4.061 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2[nH]nc3ccccc32)C2CC2)o1 ZINC000678135463 1046565172 /nfs/dbraw/zinc/56/51/72/1046565172.db2.gz NNGQUYUSOMXMKV-GUYCJALGSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2[nH]nc3ccccc32)C2CC2)o1 ZINC000678135463 1046565188 /nfs/dbraw/zinc/56/51/88/1046565188.db2.gz NNGQUYUSOMXMKV-GUYCJALGSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2n[nH]c3ccccc32)C2CC2)o1 ZINC000678135463 1046565203 /nfs/dbraw/zinc/56/52/03/1046565203.db2.gz NNGQUYUSOMXMKV-GUYCJALGSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2n[nH]c3ccccc32)C2CC2)o1 ZINC000678135463 1046565217 /nfs/dbraw/zinc/56/52/17/1046565217.db2.gz NNGQUYUSOMXMKV-GUYCJALGSA-N 1 2 321.424 4.444 20 0 DIADLO c1ccc([C@@H]2CC[C@H]([NH2+]c3ccc(N4CCOCC4)cc3)C2)cc1 ZINC000783267891 1046572277 /nfs/dbraw/zinc/57/22/77/1046572277.db2.gz LUZGFFAPXMJVIL-QUCCMNQESA-N 1 2 322.452 4.271 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+]Cc1cccnc1Cl ZINC000729679078 1046573821 /nfs/dbraw/zinc/57/38/21/1046573821.db2.gz BIFNBSRDYDVXCU-UHFFFAOYSA-N 1 2 301.604 4.332 20 0 DIADLO CSc1nccc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)n1 ZINC001140036879 1046575195 /nfs/dbraw/zinc/57/51/95/1046575195.db2.gz ODLNDMHTFGUSTF-OAHLLOKOSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1nccc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)n1 ZINC001140036879 1046575211 /nfs/dbraw/zinc/57/52/11/1046575211.db2.gz ODLNDMHTFGUSTF-OAHLLOKOSA-N 1 2 319.861 4.189 20 0 DIADLO C[C@@H](c1nnc(-c2ccccc2)o1)[N@H+](C)Cc1ccc(F)cc1 ZINC000061778874 1046578707 /nfs/dbraw/zinc/57/87/07/1046578707.db2.gz LYCZSYXWCOHQRD-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1nnc(-c2ccccc2)o1)[N@@H+](C)Cc1ccc(F)cc1 ZINC000061778874 1046578728 /nfs/dbraw/zinc/57/87/28/1046578728.db2.gz LYCZSYXWCOHQRD-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1cn2cccc(F)c2n1 ZINC000678177541 1046579035 /nfs/dbraw/zinc/57/90/35/1046579035.db2.gz FRMYVBXWMQJSPQ-OAHLLOKOSA-N 1 2 315.417 4.044 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1cn2cccc(F)c2n1 ZINC000678177541 1046579044 /nfs/dbraw/zinc/57/90/44/1046579044.db2.gz FRMYVBXWMQJSPQ-OAHLLOKOSA-N 1 2 315.417 4.044 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cnc(Br)cc2Cl)[C@H]1C ZINC001140077712 1046585608 /nfs/dbraw/zinc/58/56/08/1046585608.db2.gz MVJYTEYJCXTPFU-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cnc(Br)cc2Cl)[C@H]1C ZINC001140077712 1046585623 /nfs/dbraw/zinc/58/56/23/1046585623.db2.gz MVJYTEYJCXTPFU-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO Fc1ccc2c(c1)[nH]c1nc[nH+]c(NCC3(C(F)(F)F)CC3)c21 ZINC000642266471 1046587162 /nfs/dbraw/zinc/58/71/62/1046587162.db2.gz JNEZGCRIUSIODB-UHFFFAOYSA-N 1 2 324.281 4.005 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1cccc(F)c1)c1ccccn1)c1cccc(O)c1 ZINC000194941209 1046590209 /nfs/dbraw/zinc/59/02/09/1046590209.db2.gz XVEOGKUDGNYRAO-VLIAUNLRSA-N 1 2 322.383 4.367 20 0 DIADLO CC[N@H+](Cc1cc(C(F)(F)F)ccn1)Cc1ccccc1F ZINC001140108857 1046592572 /nfs/dbraw/zinc/59/25/72/1046592572.db2.gz QUJDIOZQWVNTBS-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1cc(C(F)(F)F)ccn1)Cc1ccccc1F ZINC001140108857 1046592586 /nfs/dbraw/zinc/59/25/86/1046592586.db2.gz QUJDIOZQWVNTBS-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)c(F)c1 ZINC001140129211 1046594371 /nfs/dbraw/zinc/59/43/71/1046594371.db2.gz WODLMNSMBHGQLE-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)c(F)c1 ZINC001140129211 1046594379 /nfs/dbraw/zinc/59/43/79/1046594379.db2.gz WODLMNSMBHGQLE-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO CCCCCCC(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000834296172 1046597793 /nfs/dbraw/zinc/59/77/93/1046597793.db2.gz QTSANXPPNUVOOS-UHFFFAOYSA-N 1 2 309.479 4.038 20 0 DIADLO Cc1ccc2oc(C[N@@H+](Cc3cn[nH]c3)Cc3ccco3)cc2c1 ZINC000678275435 1046606547 /nfs/dbraw/zinc/60/65/47/1046606547.db2.gz RZWUZHNVDZMDOK-UHFFFAOYSA-N 1 2 321.380 4.260 20 0 DIADLO Cc1ccc2oc(C[N@H+](Cc3cn[nH]c3)Cc3ccco3)cc2c1 ZINC000678275435 1046606553 /nfs/dbraw/zinc/60/65/53/1046606553.db2.gz RZWUZHNVDZMDOK-UHFFFAOYSA-N 1 2 321.380 4.260 20 0 DIADLO CCOc1ccc(NCc2c[nH+]cn2Cc2ccccc2)c(C)c1 ZINC000783565674 1046609026 /nfs/dbraw/zinc/60/90/26/1046609026.db2.gz VIXCWUIIGJYIQA-UHFFFAOYSA-N 1 2 321.424 4.251 20 0 DIADLO Fc1cccc([C@@H]2CC[N@@H+]2Cc2cc(-c3ccccc3)n[nH]2)c1 ZINC000678283236 1046611918 /nfs/dbraw/zinc/61/19/18/1046611918.db2.gz GBWQKUNOKLGCSM-IBGZPJMESA-N 1 2 307.372 4.163 20 0 DIADLO Fc1cccc([C@@H]2CC[N@H+]2Cc2cc(-c3ccccc3)n[nH]2)c1 ZINC000678283236 1046611930 /nfs/dbraw/zinc/61/19/30/1046611930.db2.gz GBWQKUNOKLGCSM-IBGZPJMESA-N 1 2 307.372 4.163 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)[nH]1 ZINC001137329921 1046613115 /nfs/dbraw/zinc/61/31/15/1046613115.db2.gz VLUVTBHSNBCWFZ-UHFFFAOYSA-N 1 2 308.347 4.209 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)[nH]1 ZINC001137329921 1046613122 /nfs/dbraw/zinc/61/31/22/1046613122.db2.gz VLUVTBHSNBCWFZ-UHFFFAOYSA-N 1 2 308.347 4.209 20 0 DIADLO COc1ccc(Nc2cccn3cc(C)[nH+]c23)cc1OC(C)C ZINC001203011688 1046613748 /nfs/dbraw/zinc/61/37/48/1046613748.db2.gz DDAXHFNVPOFABM-UHFFFAOYSA-N 1 2 311.385 4.182 20 0 DIADLO CC(C)Cc1ncc(C[N@@H+]2CC[C@H]2c2cccc(F)c2)s1 ZINC000678284641 1046614055 /nfs/dbraw/zinc/61/40/55/1046614055.db2.gz ZLFNUUFZQXPBBL-INIZCTEOSA-N 1 2 304.434 4.428 20 0 DIADLO CC(C)Cc1ncc(C[N@H+]2CC[C@H]2c2cccc(F)c2)s1 ZINC000678284641 1046614061 /nfs/dbraw/zinc/61/40/61/1046614061.db2.gz ZLFNUUFZQXPBBL-INIZCTEOSA-N 1 2 304.434 4.428 20 0 DIADLO CC(C)(C)c1ccc(C[N@@H+]2CCO[C@H](c3ccco3)C2)s1 ZINC000678294263 1046615528 /nfs/dbraw/zinc/61/55/28/1046615528.db2.gz BWXCWYBMXNLHJW-HNNXBMFYSA-N 1 2 305.443 4.212 20 0 DIADLO CC(C)(C)c1ccc(C[N@H+]2CCO[C@H](c3ccco3)C2)s1 ZINC000678294263 1046615532 /nfs/dbraw/zinc/61/55/32/1046615532.db2.gz BWXCWYBMXNLHJW-HNNXBMFYSA-N 1 2 305.443 4.212 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@H](c2ccccc2)C2CCC2)c[nH+]1 ZINC000454433124 1046617880 /nfs/dbraw/zinc/61/78/80/1046617880.db2.gz CBVPCVOACODTEX-LJQANCHMSA-N 1 2 323.440 4.039 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nc(-c2ccccc2C)no1 ZINC000678315425 1046619150 /nfs/dbraw/zinc/61/91/50/1046619150.db2.gz QLKNXLRBCNXOAT-QGZVFWFLSA-N 1 2 322.412 4.023 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nc(-c2ccccc2C)no1 ZINC000678315425 1046619160 /nfs/dbraw/zinc/61/91/60/1046619160.db2.gz QLKNXLRBCNXOAT-QGZVFWFLSA-N 1 2 322.412 4.023 20 0 DIADLO Cc1ccc(C)c([C@H]([NH2+][C@@H]2CCn3ccnc32)c2ccccc2)c1 ZINC000834547370 1046629013 /nfs/dbraw/zinc/62/90/13/1046629013.db2.gz AXURUTFSRMGCKI-WOJBJXKFSA-N 1 2 317.436 4.324 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@H]2CCn3ccnc32)c2ccccc2)c(C)c1 ZINC000834548739 1046631118 /nfs/dbraw/zinc/63/11/18/1046631118.db2.gz QSRRVXHRIZGEJS-VQTJNVASSA-N 1 2 317.436 4.324 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cccc(F)c2Cl)cc1OC ZINC000678516023 1046650378 /nfs/dbraw/zinc/65/03/78/1046650378.db2.gz HYFCMHCJYVCXGZ-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cccc(F)c2Cl)cc1OC ZINC000678516023 1046650384 /nfs/dbraw/zinc/65/03/84/1046650384.db2.gz HYFCMHCJYVCXGZ-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO CCSc1nn(C[N@H+](C)C[C@H]2CC=CCC2)c(=S)s1 ZINC000784011603 1046650353 /nfs/dbraw/zinc/65/03/53/1046650353.db2.gz BUYRWKLIFWKGCH-NSHDSACASA-N 1 2 315.533 4.032 20 0 DIADLO CCSc1nn(C[N@@H+](C)C[C@H]2CC=CCC2)c(=S)s1 ZINC000784011603 1046650364 /nfs/dbraw/zinc/65/03/64/1046650364.db2.gz BUYRWKLIFWKGCH-NSHDSACASA-N 1 2 315.533 4.032 20 0 DIADLO C[C@H]([NH2+]Cc1ccnc(Oc2ccccc2)c1)c1nccs1 ZINC000678541748 1046653713 /nfs/dbraw/zinc/65/37/13/1046653713.db2.gz IHYDDIMGCCSLRL-ZDUSSCGKSA-N 1 2 311.410 4.181 20 0 DIADLO Cc1ccc2n[nH]c(C[N@@H+]3CCc4c(Cl)cccc4C3)c2c1 ZINC001140330237 1046659423 /nfs/dbraw/zinc/65/94/23/1046659423.db2.gz RDARYXLSJZCYCR-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1ccc2n[nH]c(C[N@H+]3CCc4c(Cl)cccc4C3)c2c1 ZINC001140330237 1046659428 /nfs/dbraw/zinc/65/94/28/1046659428.db2.gz RDARYXLSJZCYCR-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2csc(C)n2)C(C)C)c(F)c1 ZINC000643344790 1046660862 /nfs/dbraw/zinc/66/08/62/1046660862.db2.gz RQKBQOQWWGLVMG-MRXNPFEDSA-N 1 2 308.422 4.086 20 0 DIADLO O=C(Nc1ccc(C2CC2)cc1)c1ccc(Cn2cc[nH+]c2)cc1 ZINC000678573019 1046661266 /nfs/dbraw/zinc/66/12/66/1046661266.db2.gz LZNKHTCNVXYRQT-UHFFFAOYSA-N 1 2 317.392 4.061 20 0 DIADLO Fc1cccc2c1CC[C@H]2[NH2+]Cc1c(F)c(F)cc(F)c1F ZINC000678594653 1046669441 /nfs/dbraw/zinc/66/94/41/1046669441.db2.gz FNBCMUHQWCLMAY-CQSZACIVSA-N 1 2 313.269 4.159 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3sccc3[C@@H]2C)nc2ccccc12 ZINC000533223492 1046671445 /nfs/dbraw/zinc/67/14/45/1046671445.db2.gz UIZBISNAGGHVQD-ZDUSSCGKSA-N 1 2 309.438 4.119 20 0 DIADLO Cc1nc(C[N@H+]2CCc3sccc3[C@@H]2C)nc2ccccc12 ZINC000533223492 1046671455 /nfs/dbraw/zinc/67/14/55/1046671455.db2.gz UIZBISNAGGHVQD-ZDUSSCGKSA-N 1 2 309.438 4.119 20 0 DIADLO Clc1cc2c(c(Cl)c1)[C@H]([NH2+][C@@H]1CCCc3cn[nH]c31)CC2 ZINC000678598346 1046671986 /nfs/dbraw/zinc/67/19/86/1046671986.db2.gz FWADYMRRZPQFPH-ZIAGYGMSSA-N 1 2 322.239 4.371 20 0 DIADLO Clc1cc2c(c(Cl)c1)[C@H]([NH2+][C@@H]1CCCc3c[nH]nc31)CC2 ZINC000678598346 1046671992 /nfs/dbraw/zinc/67/19/92/1046671992.db2.gz FWADYMRRZPQFPH-ZIAGYGMSSA-N 1 2 322.239 4.371 20 0 DIADLO Cc1ccc(NCc2c(Cl)nc3cc(Cl)ccn32)c(C)[nH+]1 ZINC000795791384 1046678108 /nfs/dbraw/zinc/67/81/08/1046678108.db2.gz YTDQJGYCCVEINS-UHFFFAOYSA-N 1 2 321.211 4.265 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@@H](c3cccnc3)C3CCC3)ccc21 ZINC000795809555 1046681716 /nfs/dbraw/zinc/68/17/16/1046681716.db2.gz MKLHMJJDDNYGEH-HXUWFJFHSA-N 1 2 307.441 4.417 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@@H](c3cccnc3)C3CCC3)ccc21 ZINC000795809555 1046681722 /nfs/dbraw/zinc/68/17/22/1046681722.db2.gz MKLHMJJDDNYGEH-HXUWFJFHSA-N 1 2 307.441 4.417 20 0 DIADLO CCCC[C@@](C)(F)C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000834845096 1046683973 /nfs/dbraw/zinc/68/39/73/1046683973.db2.gz WSTMHILSRATEPK-QGZVFWFLSA-N 1 2 303.381 4.242 20 0 DIADLO CC[N@H+](Cc1ccc2n[nH]cc2c1)Cc1c(F)cccc1Cl ZINC001140388030 1046684699 /nfs/dbraw/zinc/68/46/99/1046684699.db2.gz GCNFDMKVNJVSEG-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO CC[N@@H+](Cc1ccc2n[nH]cc2c1)Cc1c(F)cccc1Cl ZINC001140388030 1046684702 /nfs/dbraw/zinc/68/47/02/1046684702.db2.gz GCNFDMKVNJVSEG-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO Fc1ccc(F)c([C@H]2CCC[N@@H+]2Cc2[nH]nc3ccccc32)c1 ZINC001137348903 1046692552 /nfs/dbraw/zinc/69/25/52/1046692552.db2.gz WNTIVWGETPSGAQ-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc(F)c([C@H]2CCC[N@H+]2Cc2[nH]nc3ccccc32)c1 ZINC001137348903 1046692560 /nfs/dbraw/zinc/69/25/60/1046692560.db2.gz WNTIVWGETPSGAQ-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc(F)c([C@H]2CCC[N@@H+]2Cc2n[nH]c3ccccc32)c1 ZINC001137348903 1046692565 /nfs/dbraw/zinc/69/25/65/1046692565.db2.gz WNTIVWGETPSGAQ-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc(F)c([C@H]2CCC[N@H+]2Cc2n[nH]c3ccccc32)c1 ZINC001137348903 1046692570 /nfs/dbraw/zinc/69/25/70/1046692570.db2.gz WNTIVWGETPSGAQ-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO CSc1cccc(NC(=O)Nc2ccc3[nH+]ccn3c2)c1C ZINC000678763192 1046694765 /nfs/dbraw/zinc/69/47/65/1046694765.db2.gz OYDTYIZGMHZYCI-UHFFFAOYSA-N 1 2 312.398 4.009 20 0 DIADLO FC(F)C[NH2+][C@@H](c1ccc(Br)cc1)C1CCC1 ZINC000678756685 1046694890 /nfs/dbraw/zinc/69/48/90/1046694890.db2.gz NZSPFYLRRKKQFT-CYBMUJFWSA-N 1 2 304.178 4.145 20 0 DIADLO Cl/C=C\C[N@@H+]1CCC[C@@H]1c1ccc(Br)s1 ZINC000784525418 1046695134 /nfs/dbraw/zinc/69/51/34/1046695134.db2.gz DRFVCNWARWOKSR-MEHWWPQUSA-N 1 2 306.656 4.400 20 0 DIADLO Cl/C=C\C[N@H+]1CCC[C@@H]1c1ccc(Br)s1 ZINC000784525418 1046695138 /nfs/dbraw/zinc/69/51/38/1046695138.db2.gz DRFVCNWARWOKSR-MEHWWPQUSA-N 1 2 306.656 4.400 20 0 DIADLO Cl/C=C\C[N@@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000784525419 1046695540 /nfs/dbraw/zinc/69/55/40/1046695540.db2.gz DRFVCNWARWOKSR-PVARNGBLSA-N 1 2 306.656 4.400 20 0 DIADLO Cl/C=C\C[N@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000784525419 1046695545 /nfs/dbraw/zinc/69/55/45/1046695545.db2.gz DRFVCNWARWOKSR-PVARNGBLSA-N 1 2 306.656 4.400 20 0 DIADLO CC1CC[NH+](Cn2c3ccccc3n(C(F)F)c2=S)CC1 ZINC000834883856 1046696824 /nfs/dbraw/zinc/69/68/24/1046696824.db2.gz QMYLYOGZNYFDHD-UHFFFAOYSA-N 1 2 311.401 4.257 20 0 DIADLO CCc1noc(C[NH2+][C@H](CC(C)C)c2ccc(Cl)cc2)n1 ZINC000678784400 1046700041 /nfs/dbraw/zinc/70/00/41/1046700041.db2.gz UZUIWWBSMOHDKX-CQSZACIVSA-N 1 2 307.825 4.162 20 0 DIADLO c1ccc(-c2nc(C[NH2+][C@@H](CC3CC3)c3ccccc3)no2)cc1 ZINC000678778351 1046700474 /nfs/dbraw/zinc/70/04/74/1046700474.db2.gz WRCZUZYCGOSFLE-SFHVURJKSA-N 1 2 319.408 4.368 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2[nH]nc3ccccc32)c(F)c1 ZINC001137351065 1046702884 /nfs/dbraw/zinc/70/28/84/1046702884.db2.gz NTZYICSEMLGSPA-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2[nH]nc3ccccc32)c(F)c1 ZINC001137351065 1046702896 /nfs/dbraw/zinc/70/28/96/1046702896.db2.gz NTZYICSEMLGSPA-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2n[nH]c3ccccc32)c(F)c1 ZINC001137351065 1046702902 /nfs/dbraw/zinc/70/29/02/1046702902.db2.gz NTZYICSEMLGSPA-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2n[nH]c3ccccc32)c(F)c1 ZINC001137351065 1046702914 /nfs/dbraw/zinc/70/29/14/1046702914.db2.gz NTZYICSEMLGSPA-SFHVURJKSA-N 1 2 313.351 4.178 20 0 DIADLO C[N@H+](Cc1cncs1)Cc1cnc(-c2cccc(F)c2)s1 ZINC001140421020 1046708777 /nfs/dbraw/zinc/70/87/77/1046708777.db2.gz LTDRLTZZTJSHAO-UHFFFAOYSA-N 1 2 319.430 4.038 20 0 DIADLO C[N@@H+](Cc1cncs1)Cc1cnc(-c2cccc(F)c2)s1 ZINC001140421020 1046708789 /nfs/dbraw/zinc/70/87/89/1046708789.db2.gz LTDRLTZZTJSHAO-UHFFFAOYSA-N 1 2 319.430 4.038 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CCCOc3c(C)cc(Cl)cc32)co1 ZINC000834896897 1046709402 /nfs/dbraw/zinc/70/94/02/1046709402.db2.gz DKOADKOPYFACAQ-HNNXBMFYSA-N 1 2 320.820 4.202 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+]Cc2coc(CC)n2)cc1 ZINC000834898526 1046710193 /nfs/dbraw/zinc/71/01/93/1046710193.db2.gz LAIRHQULBQQPSD-AWEZNQCLSA-N 1 2 302.418 4.267 20 0 DIADLO CCc1nc(C[NH2+][C@@H](CC)c2ccccc2OC(F)F)co1 ZINC000834902066 1046714921 /nfs/dbraw/zinc/71/49/21/1046714921.db2.gz ZQZUCIXKPYCXDA-ZDUSSCGKSA-N 1 2 310.344 4.079 20 0 DIADLO Fc1ccccc1C[NH2+]Cc1c(Cl)cccc1OC(F)F ZINC000678863633 1046723257 /nfs/dbraw/zinc/72/32/57/1046723257.db2.gz XQXFHAYBVHUYBM-UHFFFAOYSA-N 1 2 315.722 4.370 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1c[nH]c3cccc(Cl)c13)C2 ZINC001140446331 1046725302 /nfs/dbraw/zinc/72/53/02/1046725302.db2.gz HFYOSHVXKFWTNJ-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1c[nH]c3cccc(Cl)c13)C2 ZINC001140446331 1046725311 /nfs/dbraw/zinc/72/53/11/1046725311.db2.gz HFYOSHVXKFWTNJ-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)n1 ZINC000678900273 1046730713 /nfs/dbraw/zinc/73/07/13/1046730713.db2.gz YDKNPVAOCQTBAQ-KTJYFRGRSA-N 1 2 305.809 4.079 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1csnn1)c1cccc(C(F)(F)F)c1 ZINC000678922406 1046733014 /nfs/dbraw/zinc/73/30/14/1046733014.db2.gz NUYUOXXXQTYCQA-ZDUSSCGKSA-N 1 2 315.364 4.044 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2CCc3c2cccc3Cl)c(C)[nH+]1 ZINC000678932345 1046739306 /nfs/dbraw/zinc/73/93/06/1046739306.db2.gz SFSNZQBIFZTIIR-HNNXBMFYSA-N 1 2 314.816 4.329 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1nc2c(s1)CCCC2 ZINC000678949253 1046742521 /nfs/dbraw/zinc/74/25/21/1046742521.db2.gz VODVMRCDALMRMH-NSHDSACASA-N 1 2 304.484 4.203 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1nc2c(s1)CCCC2 ZINC000678949253 1046742534 /nfs/dbraw/zinc/74/25/34/1046742534.db2.gz VODVMRCDALMRMH-NSHDSACASA-N 1 2 304.484 4.203 20 0 DIADLO COc1cc(F)cc(C[N@@H+]2CCc3cc(Cl)ccc3C2)c1 ZINC001140482809 1046742971 /nfs/dbraw/zinc/74/29/71/1046742971.db2.gz BIKUNHNPXGIQOC-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(F)cc(C[N@H+]2CCc3cc(Cl)ccc3C2)c1 ZINC001140482809 1046742984 /nfs/dbraw/zinc/74/29/84/1046742984.db2.gz BIKUNHNPXGIQOC-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO c1csc(C[N@H+](Cc2nc3c(s2)CCCC3)C2CC2)c1 ZINC000678956495 1046744944 /nfs/dbraw/zinc/74/49/44/1046744944.db2.gz XRNDEFUWQUBJTD-UHFFFAOYSA-N 1 2 304.484 4.248 20 0 DIADLO c1csc(C[N@@H+](Cc2nc3c(s2)CCCC3)C2CC2)c1 ZINC000678956495 1046744958 /nfs/dbraw/zinc/74/49/58/1046744958.db2.gz XRNDEFUWQUBJTD-UHFFFAOYSA-N 1 2 304.484 4.248 20 0 DIADLO C[C@H]([NH2+]Cc1nc2c(s1)CCCC2)c1ccc(F)cc1F ZINC000678955207 1046746184 /nfs/dbraw/zinc/74/61/84/1046746184.db2.gz BSMRKELNWVBOLT-JTQLQIEISA-N 1 2 308.397 4.151 20 0 DIADLO COc1ncc(C[N@H+](Cc2ccccc2F)C2CC2)cc1Cl ZINC000533555411 1046751509 /nfs/dbraw/zinc/75/15/09/1046751509.db2.gz LYMIDRQTQTWNTG-UHFFFAOYSA-N 1 2 320.795 4.047 20 0 DIADLO COc1ncc(C[N@@H+](Cc2ccccc2F)C2CC2)cc1Cl ZINC000533555411 1046751522 /nfs/dbraw/zinc/75/15/22/1046751522.db2.gz LYMIDRQTQTWNTG-UHFFFAOYSA-N 1 2 320.795 4.047 20 0 DIADLO CC[N@H+](Cc1nc(C(F)(F)F)cs1)Cc1ccc(C)cc1 ZINC000533558395 1046752018 /nfs/dbraw/zinc/75/20/18/1046752018.db2.gz LJQUITSALZMQCH-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CC[N@@H+](Cc1nc(C(F)(F)F)cs1)Cc1ccc(C)cc1 ZINC000533558395 1046752030 /nfs/dbraw/zinc/75/20/30/1046752030.db2.gz LJQUITSALZMQCH-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CCc1nc(C[N@H+](C)[C@@H]2CCCc3ccc(F)cc32)cs1 ZINC000533573849 1046755399 /nfs/dbraw/zinc/75/53/99/1046755399.db2.gz NZAMXZOVOGJKHZ-MRXNPFEDSA-N 1 2 304.434 4.354 20 0 DIADLO CCc1nc(C[N@@H+](C)[C@@H]2CCCc3ccc(F)cc32)cs1 ZINC000533573849 1046755412 /nfs/dbraw/zinc/75/54/12/1046755412.db2.gz NZAMXZOVOGJKHZ-MRXNPFEDSA-N 1 2 304.434 4.354 20 0 DIADLO Cc1ccc([C@@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)c(C)n1 ZINC000679007081 1046756046 /nfs/dbraw/zinc/75/60/46/1046756046.db2.gz BFXAZGLIQASECZ-MRXNPFEDSA-N 1 2 310.445 4.257 20 0 DIADLO COC(=O)c1csc([C@H](C)Nc2ccc([NH+](C)C)c(C)c2)c1 ZINC000796911719 1046756527 /nfs/dbraw/zinc/75/65/27/1046756527.db2.gz KHBLAZMLBNVYKP-LBPRGKRZSA-N 1 2 318.442 4.082 20 0 DIADLO Cc1ccccc1COc1ccc([C@H](C)[NH2+]Cc2cocn2)cc1 ZINC000679047142 1046761917 /nfs/dbraw/zinc/76/19/17/1046761917.db2.gz BFOMAVIGEZHTOG-INIZCTEOSA-N 1 2 322.408 4.413 20 0 DIADLO Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]Cc1cocn1 ZINC000679047681 1046762518 /nfs/dbraw/zinc/76/25/18/1046762518.db2.gz JJWQMCIKTXBRSV-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C)c2c(F)cccc2F)c(C)[nH+]1 ZINC000455468124 1046767882 /nfs/dbraw/zinc/76/78/82/1046767882.db2.gz GYUJPNKGWBJEHS-NSHDSACASA-N 1 2 319.355 4.168 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC3(CCCC3)CC2)c(C)[nH+]1 ZINC000455473824 1046768469 /nfs/dbraw/zinc/76/84/69/1046768469.db2.gz CMCGDLCJLXBJJH-UHFFFAOYSA-N 1 2 301.434 4.195 20 0 DIADLO Cc1cc(C)c(NC(=O)Nc2cccc(OC(F)F)c2)c(C)[nH+]1 ZINC000455476828 1046769445 /nfs/dbraw/zinc/76/94/45/1046769445.db2.gz LSQXKQYXYBJUAC-UHFFFAOYSA-N 1 2 321.327 4.252 20 0 DIADLO CC(C)COc1ccccc1C[NH2+]Cc1cccc(O)c1Cl ZINC000645150403 1046769711 /nfs/dbraw/zinc/76/97/11/1046769711.db2.gz LTZWZRNURIABGU-UHFFFAOYSA-N 1 2 319.832 4.370 20 0 DIADLO Cc1ccc(CC[C@@H](C)NC(=O)Nc2c(C)cc(C)[nH+]c2C)o1 ZINC000455495850 1046770285 /nfs/dbraw/zinc/77/02/85/1046770285.db2.gz OKZUJEQTUBAULZ-GFCCVEGCSA-N 1 2 315.417 4.051 20 0 DIADLO Fc1cc2c(c(F)c1)CC[C@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000679076399 1046770690 /nfs/dbraw/zinc/77/06/90/1046770690.db2.gz OCZAFIGVSKQOGP-QGZVFWFLSA-N 1 2 315.367 4.059 20 0 DIADLO CCCOc1ccccc1NC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455492177 1046771906 /nfs/dbraw/zinc/77/19/06/1046771906.db2.gz ZFGGKNIGPTYYIC-UHFFFAOYSA-N 1 2 313.401 4.440 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@@H](C(C)C)[C@H]2C(C)C)c(C)[nH+]1 ZINC000455493264 1046771964 /nfs/dbraw/zinc/77/19/64/1046771964.db2.gz CFASDLRSUOPVHS-DOTOQJQBSA-N 1 2 303.450 4.151 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2ccc(Cl)s2)c(C)[nH+]1 ZINC000455485228 1046772477 /nfs/dbraw/zinc/77/24/77/1046772477.db2.gz QUGPNTDZZADIGU-UHFFFAOYSA-N 1 2 309.822 4.043 20 0 DIADLO Cc1cc(C)c(NC(=O)NCCc2cccc(Cl)c2)c(C)[nH+]1 ZINC000455485202 1046772505 /nfs/dbraw/zinc/77/25/05/1046772505.db2.gz QTCUYTUIEKKPSY-UHFFFAOYSA-N 1 2 317.820 4.024 20 0 DIADLO CC[C@H](Cc1ccccc1)NC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455485355 1046772592 /nfs/dbraw/zinc/77/25/92/1046772592.db2.gz RFUKQLOIDOCXCR-QGZVFWFLSA-N 1 2 311.429 4.150 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@H](C)CC2CCC2)c2ccc(Cl)cc2)no1 ZINC000679092400 1046773841 /nfs/dbraw/zinc/77/38/41/1046773841.db2.gz SIBCLNYFGRKWKV-BZNIZROVSA-N 1 2 319.836 4.289 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC(C(C)(C)C)CC2)c(C)[nH+]1 ZINC000455491170 1046774645 /nfs/dbraw/zinc/77/46/45/1046774645.db2.gz XWSWRGVAAYPWBA-UHFFFAOYSA-N 1 2 303.450 4.297 20 0 DIADLO CC[C@H](CNC(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccccc1 ZINC000455491209 1046775367 /nfs/dbraw/zinc/77/53/67/1046775367.db2.gz YDFDEALUMNZQPA-MRXNPFEDSA-N 1 2 311.429 4.322 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@H](c3ccccc3)C[C@H]2C)c(C)[nH+]1 ZINC000455490753 1046775472 /nfs/dbraw/zinc/77/54/72/1046775472.db2.gz XQDZDZPOEGMDSC-CRAIPNDOSA-N 1 2 323.440 4.417 20 0 DIADLO CCN(C(=O)Nc1c(C)cc(C)[nH+]c1C)[C@H](C)c1cccnc1 ZINC000455488340 1046775600 /nfs/dbraw/zinc/77/56/00/1046775600.db2.gz UQLZSICUZZSNDR-OAHLLOKOSA-N 1 2 312.417 4.017 20 0 DIADLO Cc1c(F)cc(C[NH+]2CCC(F)(F)CC2)cc1Br ZINC001140551667 1046776792 /nfs/dbraw/zinc/77/67/92/1046776792.db2.gz GLZCRJLWYOKGTP-UHFFFAOYSA-N 1 2 322.168 4.128 20 0 DIADLO Cc1ccc([C@H](C)CNC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000455500078 1046777439 /nfs/dbraw/zinc/77/74/39/1046777439.db2.gz SSJNMEMWYLPQQM-CQSZACIVSA-N 1 2 311.429 4.240 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)Cc2ccc(F)cc2C)c(C)[nH+]1 ZINC000455519822 1046778243 /nfs/dbraw/zinc/77/82/43/1046778243.db2.gz MFGNQUSXKZDLNE-UHFFFAOYSA-N 1 2 315.392 4.118 20 0 DIADLO CCCOc1ccc(NC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000455499290 1046778435 /nfs/dbraw/zinc/77/84/35/1046778435.db2.gz SDWMHJFLHBDUEN-UHFFFAOYSA-N 1 2 313.401 4.440 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@H](c3ccccc3)C2)c(C)[nH+]1 ZINC000455509466 1046778779 /nfs/dbraw/zinc/77/87/79/1046778779.db2.gz GMHHRLDHECUZKO-SFHVURJKSA-N 1 2 323.440 4.418 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@]2(C)CC(C)C)c(C)[nH+]1 ZINC000455511646 1046779095 /nfs/dbraw/zinc/77/90/95/1046779095.db2.gz HQYKIEXPGSLCMW-GOSISDBHSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC3(CCC3)[C@@H]2C(C)C)c(C)[nH+]1 ZINC000455526484 1046781964 /nfs/dbraw/zinc/78/19/64/1046781964.db2.gz PQNJMJWNVBWWEH-INIZCTEOSA-N 1 2 301.434 4.049 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@H+](CCC(=O)c1ccccc1)CC3 ZINC000679134543 1046783356 /nfs/dbraw/zinc/78/33/56/1046783356.db2.gz YSAZBLLFWPPLEE-UHFFFAOYSA-N 1 2 318.420 4.107 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](CCC(=O)c1ccccc1)CC3 ZINC000679134543 1046783361 /nfs/dbraw/zinc/78/33/61/1046783361.db2.gz YSAZBLLFWPPLEE-UHFFFAOYSA-N 1 2 318.420 4.107 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)C2CCC(F)(F)CC2)c(C)[nH+]1 ZINC000455541734 1046783490 /nfs/dbraw/zinc/78/34/90/1046783490.db2.gz ZGNVOCNJAZCKCZ-UHFFFAOYSA-N 1 2 311.376 4.048 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000069067081 1046790710 /nfs/dbraw/zinc/79/07/10/1046790710.db2.gz HKAVPINMSHUCOS-NSHDSACASA-N 1 2 302.399 4.498 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)[C@@H](C)c1ccco1 ZINC000069067081 1046790717 /nfs/dbraw/zinc/79/07/17/1046790717.db2.gz HKAVPINMSHUCOS-NSHDSACASA-N 1 2 302.399 4.498 20 0 DIADLO Cc1ccc([C@@H]2CCCN2C(=O)NCc2c[nH+]c(C)cc2C)cc1 ZINC000455554348 1046792763 /nfs/dbraw/zinc/79/27/63/1046792763.db2.gz ICQFNTJAZVPAGN-IBGZPJMESA-N 1 2 323.440 4.054 20 0 DIADLO Cc1nc(C[N@H+]2C[C@@H](c3ccccc3C)OC[C@@H]2C)sc1C ZINC000246460773 1046803055 /nfs/dbraw/zinc/80/30/55/1046803055.db2.gz YWZMDBYLWXRIMM-GUYCJALGSA-N 1 2 316.470 4.030 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@@H](c3ccccc3C)OC[C@@H]2C)sc1C ZINC000246460773 1046803067 /nfs/dbraw/zinc/80/30/67/1046803067.db2.gz YWZMDBYLWXRIMM-GUYCJALGSA-N 1 2 316.470 4.030 20 0 DIADLO Oc1ccc(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)cc1 ZINC000679392756 1046834803 /nfs/dbraw/zinc/83/48/03/1046834803.db2.gz PPVVQROAAAAFJO-UHFFFAOYSA-N 1 2 319.408 4.204 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2Cl)C[N@@H+]1Cc1ccc(O)cc1 ZINC000679391917 1046835854 /nfs/dbraw/zinc/83/58/54/1046835854.db2.gz BYKLUUAFIMJHSI-FZKQIMNGSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2Cl)C[N@H+]1Cc1ccc(O)cc1 ZINC000679391917 1046835870 /nfs/dbraw/zinc/83/58/70/1046835870.db2.gz BYKLUUAFIMJHSI-FZKQIMNGSA-N 1 2 317.816 4.008 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)[C@H](C)c2ccccc2)n1 ZINC000248005328 1046836987 /nfs/dbraw/zinc/83/69/87/1046836987.db2.gz KTIVNTIHPKAKJY-OLZOCXBDSA-N 1 2 305.447 4.077 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)[C@H](C)c2ccccc2)n1 ZINC000248005328 1046836991 /nfs/dbraw/zinc/83/69/91/1046836991.db2.gz KTIVNTIHPKAKJY-OLZOCXBDSA-N 1 2 305.447 4.077 20 0 DIADLO Cc1ccc2nc(C[NH2+]C3(c4ccccc4Cl)CC3)cn2c1 ZINC000645976718 1046838092 /nfs/dbraw/zinc/83/80/92/1046838092.db2.gz RZKBJMQKXUVFHV-UHFFFAOYSA-N 1 2 311.816 4.075 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ncc(C(C)(C)C)o2)CC2CC2)cn1 ZINC000646019210 1046845891 /nfs/dbraw/zinc/84/58/91/1046845891.db2.gz VKVGIIJWGILUNI-UHFFFAOYSA-N 1 2 313.445 4.088 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ncc(C(C)(C)C)o2)CC2CC2)cn1 ZINC000646019210 1046845915 /nfs/dbraw/zinc/84/59/15/1046845915.db2.gz VKVGIIJWGILUNI-UHFFFAOYSA-N 1 2 313.445 4.088 20 0 DIADLO FC(F)Oc1cccc(Nc2ccc[nH+]c2N2CCCCC2)c1 ZINC001212053656 1046847645 /nfs/dbraw/zinc/84/76/45/1046847645.db2.gz DLICHJXXUFGUDS-UHFFFAOYSA-N 1 2 319.355 4.417 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)s1 ZINC000646119458 1046860205 /nfs/dbraw/zinc/86/02/05/1046860205.db2.gz UUWKOBJTVNGSJW-BBRMVZONSA-N 1 2 311.454 4.301 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)s1 ZINC000646119458 1046860225 /nfs/dbraw/zinc/86/02/25/1046860225.db2.gz UUWKOBJTVNGSJW-BBRMVZONSA-N 1 2 311.454 4.301 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cc(-c2ccco2)on1 ZINC000679539446 1046861337 /nfs/dbraw/zinc/86/13/37/1046861337.db2.gz AWXNPOABYUMDLA-WDEREUQCSA-N 1 2 314.307 4.097 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cc(-c2ccco2)on1 ZINC000679539446 1046861354 /nfs/dbraw/zinc/86/13/54/1046861354.db2.gz AWXNPOABYUMDLA-WDEREUQCSA-N 1 2 314.307 4.097 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)n1 ZINC000646117412 1046861408 /nfs/dbraw/zinc/86/14/08/1046861408.db2.gz ZDPSRRGYWTVJMJ-PBHICJAKSA-N 1 2 309.413 4.086 20 0 DIADLO CCc1noc([C@@H](C)[N@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)n1 ZINC000646117412 1046861429 /nfs/dbraw/zinc/86/14/29/1046861429.db2.gz ZDPSRRGYWTVJMJ-PBHICJAKSA-N 1 2 309.413 4.086 20 0 DIADLO CC(C)c1nc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)cs1 ZINC000679542691 1046861774 /nfs/dbraw/zinc/86/17/74/1046861774.db2.gz BAXAUYXRBDCHAL-QWRGUYRKSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)cs1 ZINC000679542691 1046861752 /nfs/dbraw/zinc/86/17/52/1046861752.db2.gz BAXAUYXRBDCHAL-QWRGUYRKSA-N 1 2 306.397 4.429 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)s1 ZINC000646119462 1046862213 /nfs/dbraw/zinc/86/22/13/1046862213.db2.gz UUWKOBJTVNGSJW-XJKSGUPXSA-N 1 2 311.454 4.301 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)s1 ZINC000646119462 1046862236 /nfs/dbraw/zinc/86/22/36/1046862236.db2.gz UUWKOBJTVNGSJW-XJKSGUPXSA-N 1 2 311.454 4.301 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cc(-c2ccco2)on1 ZINC000679539445 1046863554 /nfs/dbraw/zinc/86/35/54/1046863554.db2.gz AWXNPOABYUMDLA-QWRGUYRKSA-N 1 2 314.307 4.097 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cc(-c2ccco2)on1 ZINC000679539445 1046863572 /nfs/dbraw/zinc/86/35/72/1046863572.db2.gz AWXNPOABYUMDLA-QWRGUYRKSA-N 1 2 314.307 4.097 20 0 DIADLO Cc1ccc(C2([NH2+]Cc3noc(-c4ccccc4)n3)CCC2)cc1 ZINC000646131364 1046864824 /nfs/dbraw/zinc/86/48/24/1046864824.db2.gz OYCIBPWDBORNNE-UHFFFAOYSA-N 1 2 319.408 4.214 20 0 DIADLO CC(C)OC1CC[NH+](Cc2cc(F)c(Cl)cc2F)CC1 ZINC001140701705 1046865764 /nfs/dbraw/zinc/86/57/64/1046865764.db2.gz XAFRRMFANSREPQ-UHFFFAOYSA-N 1 2 303.780 4.008 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1csc(C2CC2)n1 ZINC000679540841 1046865558 /nfs/dbraw/zinc/86/55/58/1046865558.db2.gz HFCKKRDWYVMPNC-MWLCHTKSSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1csc(C2CC2)n1 ZINC000679540841 1046865579 /nfs/dbraw/zinc/86/55/79/1046865579.db2.gz HFCKKRDWYVMPNC-MWLCHTKSSA-N 1 2 304.381 4.183 20 0 DIADLO CC1=C(Br)C[N@H+](Cc2cnc3ccccc3c2)CC1 ZINC000797605722 1046869259 /nfs/dbraw/zinc/86/92/59/1046869259.db2.gz VWUWCNPXGOCIKV-UHFFFAOYSA-N 1 2 317.230 4.109 20 0 DIADLO CC1=C(Br)C[N@@H+](Cc2cnc3ccccc3c2)CC1 ZINC000797605722 1046869279 /nfs/dbraw/zinc/86/92/79/1046869279.db2.gz VWUWCNPXGOCIKV-UHFFFAOYSA-N 1 2 317.230 4.109 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1F)c1nc(-c2ccncc2)cs1 ZINC000076895749 1046870887 /nfs/dbraw/zinc/87/08/87/1046870887.db2.gz LDLUBZGOXXJHQY-LBPRGKRZSA-N 1 2 313.401 4.195 20 0 DIADLO CCc1noc([C@@H](C)[N@H+](C)Cc2csc3ccccc23)n1 ZINC000076991007 1046874760 /nfs/dbraw/zinc/87/47/60/1046874760.db2.gz GOGWHGALUHLWDF-LLVKDONJSA-N 1 2 301.415 4.040 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+](C)Cc2csc3ccccc23)n1 ZINC000076991007 1046874778 /nfs/dbraw/zinc/87/47/78/1046874778.db2.gz GOGWHGALUHLWDF-LLVKDONJSA-N 1 2 301.415 4.040 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000679584133 1046876553 /nfs/dbraw/zinc/87/65/53/1046876553.db2.gz LLPWNKZQVJVUSW-SCZZXKLOSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cc(F)c(F)cc1F ZINC000679584133 1046876568 /nfs/dbraw/zinc/87/65/68/1046876568.db2.gz LLPWNKZQVJVUSW-SCZZXKLOSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000679584114 1046877423 /nfs/dbraw/zinc/87/74/23/1046877423.db2.gz KZQUZGPSDYMMTR-PSASIEDQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000679584114 1046877434 /nfs/dbraw/zinc/87/74/34/1046877434.db2.gz KZQUZGPSDYMMTR-PSASIEDQSA-N 1 2 311.269 4.267 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+]1CCC(=O)[C@@H](C)C12CCCC2 ZINC001140731471 1046880663 /nfs/dbraw/zinc/88/06/63/1046880663.db2.gz ZXKMNJHNAWDEIK-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO COc1cccc(Cl)c1C[N@H+]1CCC(=O)[C@@H](C)C12CCCC2 ZINC001140731471 1046880671 /nfs/dbraw/zinc/88/06/71/1046880671.db2.gz ZXKMNJHNAWDEIK-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO FC(F)O[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2Cl)C1 ZINC000679680081 1046891067 /nfs/dbraw/zinc/89/10/67/1046891067.db2.gz WICXKISQLRFSKV-LLVKDONJSA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2Cl)C1 ZINC000679680081 1046891078 /nfs/dbraw/zinc/89/10/78/1046891078.db2.gz WICXKISQLRFSKV-LLVKDONJSA-N 1 2 310.171 4.197 20 0 DIADLO COc1cc(C)ccc1[C@H](C)Nc1ccc(N2CCCC2)[nH+]c1 ZINC000320025664 1046898757 /nfs/dbraw/zinc/89/87/57/1046898757.db2.gz GPJPGSQLZJLHGO-HNNXBMFYSA-N 1 2 311.429 4.172 20 0 DIADLO FC(F)O[C@H]1CCC[N@H+](Cc2cccc(Cl)c2Cl)C1 ZINC000679740445 1046898893 /nfs/dbraw/zinc/89/88/93/1046898893.db2.gz NWQBOKJFBBDPIS-JTQLQIEISA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2Cl)C1 ZINC000679740445 1046898902 /nfs/dbraw/zinc/89/89/02/1046898902.db2.gz NWQBOKJFBBDPIS-JTQLQIEISA-N 1 2 310.171 4.197 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c(Cl)c1 ZINC001140798544 1046905364 /nfs/dbraw/zinc/90/53/64/1046905364.db2.gz NZEXCCOKQDRUBE-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)c(Cl)c1 ZINC001140798544 1046905375 /nfs/dbraw/zinc/90/53/75/1046905375.db2.gz NZEXCCOKQDRUBE-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1c[nH]c2ccncc12 ZINC001140806127 1046908227 /nfs/dbraw/zinc/90/82/27/1046908227.db2.gz VZCRBTWWBGZJAM-LJQANCHMSA-N 1 2 321.424 4.046 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1c[nH]c2ccncc12 ZINC001140806127 1046908240 /nfs/dbraw/zinc/90/82/40/1046908240.db2.gz VZCRBTWWBGZJAM-LJQANCHMSA-N 1 2 321.424 4.046 20 0 DIADLO Fc1ccc(F)c([C@H]2CCC[N@@H+]2Cc2c[nH]c3ccncc23)c1 ZINC001140805552 1046909560 /nfs/dbraw/zinc/90/95/60/1046909560.db2.gz IXIALAPKSSDPFV-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc(F)c([C@H]2CCC[N@H+]2Cc2c[nH]c3ccncc23)c1 ZINC001140805552 1046909568 /nfs/dbraw/zinc/90/95/68/1046909568.db2.gz IXIALAPKSSDPFV-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CC(C3CCC3)C3CCC3)cc2[nH+]1 ZINC001137392629 1046911606 /nfs/dbraw/zinc/91/16/06/1046911606.db2.gz CUZBSCFAJILOCK-UHFFFAOYSA-N 1 2 311.429 4.416 20 0 DIADLO Cc1cc(Br)ccc1C[N@@H+]1CCC[C@](C)(F)C1 ZINC001140815208 1046912504 /nfs/dbraw/zinc/91/25/04/1046912504.db2.gz JBZRGTVOMMDZDR-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cc(Br)ccc1C[N@H+]1CCC[C@](C)(F)C1 ZINC001140815208 1046912513 /nfs/dbraw/zinc/91/25/13/1046912513.db2.gz JBZRGTVOMMDZDR-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO C[N@H+](CC(=O)OCc1ccccc1)Cc1cccc2ccccc21 ZINC000303378219 1046914543 /nfs/dbraw/zinc/91/45/43/1046914543.db2.gz LYBHHMBXYWDWTM-UHFFFAOYSA-N 1 2 319.404 4.015 20 0 DIADLO C[N@@H+](CC(=O)OCc1ccccc1)Cc1cccc2ccccc21 ZINC000303378219 1046914551 /nfs/dbraw/zinc/91/45/51/1046914551.db2.gz LYBHHMBXYWDWTM-UHFFFAOYSA-N 1 2 319.404 4.015 20 0 DIADLO Cc1ccccc1-c1noc([C@H](C)[NH2+][C@H](C)c2cnccc2C)n1 ZINC000679943640 1046915578 /nfs/dbraw/zinc/91/55/78/1046915578.db2.gz XGDAARGNXDKATC-CABCVRRESA-N 1 2 322.412 4.160 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCCC[C@@H]2/C=C\c2cccs2)o1 ZINC000679952048 1046915624 /nfs/dbraw/zinc/91/56/24/1046915624.db2.gz FXRFRYHVQDQMNK-CFYYFVFUSA-N 1 2 317.458 4.152 20 0 DIADLO CCc1nnc(C[N@H+]2CCCCC[C@@H]2/C=C\c2cccs2)o1 ZINC000679952048 1046915634 /nfs/dbraw/zinc/91/56/34/1046915634.db2.gz FXRFRYHVQDQMNK-CFYYFVFUSA-N 1 2 317.458 4.152 20 0 DIADLO C[N@H+](Cc1ccc(F)cc1)Cc1cc(Cl)c(O)c(Cl)c1 ZINC001140829415 1046917750 /nfs/dbraw/zinc/91/77/50/1046917750.db2.gz IWKUHDPMWWOBMZ-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO C[N@@H+](Cc1ccc(F)cc1)Cc1cc(Cl)c(O)c(Cl)c1 ZINC001140829415 1046917762 /nfs/dbraw/zinc/91/77/62/1046917762.db2.gz IWKUHDPMWWOBMZ-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccc(C)nc2)c(F)c1 ZINC001140827589 1046918869 /nfs/dbraw/zinc/91/88/69/1046918869.db2.gz DRSAETQIDXQRFV-GOSISDBHSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccc(C)nc2)c(F)c1 ZINC001140827589 1046918884 /nfs/dbraw/zinc/91/88/84/1046918884.db2.gz DRSAETQIDXQRFV-GOSISDBHSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c(F)c1 ZINC001140826191 1046919835 /nfs/dbraw/zinc/91/98/35/1046919835.db2.gz DUOJAXIZLZTZBX-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccccc2F)c(F)c1 ZINC001140826191 1046919852 /nfs/dbraw/zinc/91/98/52/1046919852.db2.gz DUOJAXIZLZTZBX-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@@H](c1nc2ccccc2c(=O)[nH]1)[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000253547947 1046922350 /nfs/dbraw/zinc/92/23/50/1046922350.db2.gz AGZWRJFLSNJOJX-QWQRMKEZSA-N 1 2 319.408 4.089 20 0 DIADLO C[C@@H](c1nc2ccccc2c(=O)[nH]1)[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000253547947 1046922364 /nfs/dbraw/zinc/92/23/64/1046922364.db2.gz AGZWRJFLSNJOJX-QWQRMKEZSA-N 1 2 319.408 4.089 20 0 DIADLO CCOc1ccccc1C[NH2+][C@@H]1COCc2cccc(Cl)c21 ZINC000798180192 1046934354 /nfs/dbraw/zinc/93/43/54/1046934354.db2.gz BLWGPHFJTIZWJZ-MRXNPFEDSA-N 1 2 317.816 4.100 20 0 DIADLO CC[C@@H]([NH2+][C@H]1COCc2cccc(Cl)c21)c1c(C)noc1C ZINC000798181496 1046934500 /nfs/dbraw/zinc/93/45/00/1046934500.db2.gz KRBJBQFYANNKCX-CABCVRRESA-N 1 2 320.820 4.257 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1cccc(Cl)c1 ZINC000680041917 1046936796 /nfs/dbraw/zinc/93/67/96/1046936796.db2.gz PGWIWZHRQWCZFJ-YMTOWFKASA-N 1 2 309.743 4.403 20 0 DIADLO Nc1cccc(F)c1C[N@H+](Cc1ccccc1)Cc1cccnc1 ZINC001140875069 1046938839 /nfs/dbraw/zinc/93/88/39/1046938839.db2.gz UVFPUNYLGKYFKT-UHFFFAOYSA-N 1 2 321.399 4.005 20 0 DIADLO Nc1cccc(F)c1C[N@@H+](Cc1ccccc1)Cc1cccnc1 ZINC001140875069 1046938841 /nfs/dbraw/zinc/93/88/41/1046938841.db2.gz UVFPUNYLGKYFKT-UHFFFAOYSA-N 1 2 321.399 4.005 20 0 DIADLO Oc1ccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)c(F)c1F ZINC001140889974 1046944660 /nfs/dbraw/zinc/94/46/60/1046944660.db2.gz RZBQFLZAWFFASL-OAHLLOKOSA-N 1 2 303.352 4.398 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cnccc1C(F)(F)F ZINC001140920424 1046950636 /nfs/dbraw/zinc/95/06/36/1046950636.db2.gz UZMRWYXVOSCERG-LBPRGKRZSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cnccc1C(F)(F)F ZINC001140920424 1046950640 /nfs/dbraw/zinc/95/06/40/1046950640.db2.gz UZMRWYXVOSCERG-LBPRGKRZSA-N 1 2 306.331 4.047 20 0 DIADLO Cc1nccnc1C[N@H+](C)Cc1sc2ccccc2c1Cl ZINC001140937863 1046955025 /nfs/dbraw/zinc/95/50/25/1046955025.db2.gz GPHIZXSWIDDOHF-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO Cc1nccnc1C[N@@H+](C)Cc1sc2ccccc2c1Cl ZINC001140937863 1046955033 /nfs/dbraw/zinc/95/50/33/1046955033.db2.gz GPHIZXSWIDDOHF-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO Clc1ccccc1C1([NH2+]Cc2nc3c(s2)CCCC3)CC1 ZINC000647224054 1046955408 /nfs/dbraw/zinc/95/54/08/1046955408.db2.gz KKKVJNNLINSXFX-UHFFFAOYSA-N 1 2 318.873 4.454 20 0 DIADLO CC(C)[C@@H]1C[C@@H]1C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000476006390 1046960613 /nfs/dbraw/zinc/96/06/13/1046960613.db2.gz GMPPRTBKKBEJLS-ROUUACIJSA-N 1 2 323.440 4.117 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1cc2n(n1)CCCC2 ZINC000647279909 1046964631 /nfs/dbraw/zinc/96/46/31/1046964631.db2.gz FMSVXYDKVDQKCP-LLVKDONJSA-N 1 2 324.255 4.377 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2ccccc2C(F)(F)F)[nH]n1 ZINC001203082954 1046964729 /nfs/dbraw/zinc/96/47/29/1046964729.db2.gz DRUJQZHFMGKTFF-MRXNPFEDSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2ccccc2C(F)(F)F)[nH]n1 ZINC001203082954 1046964740 /nfs/dbraw/zinc/96/47/40/1046964740.db2.gz DRUJQZHFMGKTFF-MRXNPFEDSA-N 1 2 323.362 4.464 20 0 DIADLO Oc1c(F)cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1F ZINC001140987765 1046970988 /nfs/dbraw/zinc/97/09/88/1046970988.db2.gz CNKIOVHRIMOTKR-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1F ZINC001140987765 1046970998 /nfs/dbraw/zinc/97/09/98/1046970998.db2.gz CNKIOVHRIMOTKR-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1cc2ccccc2o1 ZINC000680354911 1046972221 /nfs/dbraw/zinc/97/22/21/1046972221.db2.gz KNEQNECKCLYHIV-HZMBPMFUSA-N 1 2 315.319 4.495 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1cc(F)cc(F)c1 ZINC000680355250 1046972302 /nfs/dbraw/zinc/97/23/02/1046972302.db2.gz NWSAMVATGFCMAY-CLAHSXSESA-N 1 2 311.278 4.027 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1csc(CCC(C)C)n1 ZINC000680381899 1046977131 /nfs/dbraw/zinc/97/71/31/1046977131.db2.gz ASNXMRRDMIPSLT-NSHDSACASA-N 1 2 307.463 4.187 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1nc(-c2ccsc2)oc1C ZINC000680381075 1046977652 /nfs/dbraw/zinc/97/76/52/1046977652.db2.gz LQXFJWOCJUVFBQ-SECBINFHSA-N 1 2 317.414 4.167 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1csc(CCC(C)C)n1 ZINC000680381898 1046977683 /nfs/dbraw/zinc/97/76/83/1046977683.db2.gz ASNXMRRDMIPSLT-LLVKDONJSA-N 1 2 307.463 4.187 20 0 DIADLO C[C@@H]([NH2+]C1(c2ccccc2F)CCC1)c1cc2n(n1)CCCC2 ZINC000647332875 1046980714 /nfs/dbraw/zinc/98/07/14/1046980714.db2.gz GTDLCWXIEQQFPR-CQSZACIVSA-N 1 2 313.420 4.089 20 0 DIADLO COc1cc2c(cc1F)CC[C@@H]2Nc1ccc([NH+](C)C)cc1C ZINC000798931992 1046988688 /nfs/dbraw/zinc/98/86/88/1046988688.db2.gz QQEZWMLUQUUREU-SFHVURJKSA-N 1 2 314.404 4.308 20 0 DIADLO CN1CCCc2cc([NH2+][C@@H]3CCC[C@@H]([C@H]4CCOC4)C3)ccc21 ZINC000798932767 1046990625 /nfs/dbraw/zinc/99/06/25/1046990625.db2.gz KAGWSPJPJSTKTH-BPQIPLTHSA-N 1 2 314.473 4.076 20 0 DIADLO COc1cc2c(cc1F)CC[C@H]2Nc1ccc([NH+](C)C)c(C)c1 ZINC000798932940 1046990725 /nfs/dbraw/zinc/99/07/25/1046990725.db2.gz KZOHBSUZOIURBQ-QGZVFWFLSA-N 1 2 314.404 4.308 20 0 DIADLO Cc1ncoc1C[N@@H+](C)Cc1sc2ccccc2c1Cl ZINC001141052819 1046993068 /nfs/dbraw/zinc/99/30/68/1046993068.db2.gz KQYIGDNWHBUUFB-UHFFFAOYSA-N 1 2 306.818 4.483 20 0 DIADLO Cc1ncoc1C[N@H+](C)Cc1sc2ccccc2c1Cl ZINC001141052819 1046993075 /nfs/dbraw/zinc/99/30/75/1046993075.db2.gz KQYIGDNWHBUUFB-UHFFFAOYSA-N 1 2 306.818 4.483 20 0 DIADLO Clc1cnc(C[NH+]2CCC3(CCCCC3)CC2)c(Cl)n1 ZINC001141133194 1047022071 /nfs/dbraw/zinc/02/20/71/1047022071.db2.gz LGASNOZTTPLYPB-UHFFFAOYSA-N 1 2 314.260 4.330 20 0 DIADLO C/C(=C\c1nc(Cc2cn3cccc(C)c3[nH+]2)no1)C(C)(C)C ZINC000680733911 1047022691 /nfs/dbraw/zinc/02/26/91/1047022691.db2.gz MORSPGDBMUPQBI-UKTHLTGXSA-N 1 2 310.401 4.066 20 0 DIADLO CC[N@H+](Cc1ccc(C)cc1)Cc1ncc(Cl)nc1Cl ZINC001141137184 1047025596 /nfs/dbraw/zinc/02/55/96/1047025596.db2.gz GLOSHOVKCPCVJX-UHFFFAOYSA-N 1 2 310.228 4.114 20 0 DIADLO CC[N@@H+](Cc1ccc(C)cc1)Cc1ncc(Cl)nc1Cl ZINC001141137184 1047025605 /nfs/dbraw/zinc/02/56/05/1047025605.db2.gz GLOSHOVKCPCVJX-UHFFFAOYSA-N 1 2 310.228 4.114 20 0 DIADLO C[C@H](c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1)C1CCCC1 ZINC000680748715 1047028281 /nfs/dbraw/zinc/02/82/81/1047028281.db2.gz DPCUYQUYQRPKFI-ZDUSSCGKSA-N 1 2 308.385 4.216 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCCC[C@@H]2C2CCC2)s1 ZINC000648078058 1047036814 /nfs/dbraw/zinc/03/68/14/1047036814.db2.gz YTNHZVJFMPVGCZ-LLVKDONJSA-N 1 2 304.381 4.317 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCCC[C@@H]2C2CCC2)s1 ZINC000648078058 1047036824 /nfs/dbraw/zinc/03/68/24/1047036824.db2.gz YTNHZVJFMPVGCZ-LLVKDONJSA-N 1 2 304.381 4.317 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@](C)(c3ccc(F)cc3)C2)c(F)c1 ZINC001141196637 1047044498 /nfs/dbraw/zinc/04/44/98/1047044498.db2.gz SBKUNDURECRXOJ-IBGZPJMESA-N 1 2 317.379 4.021 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@](C)(c3ccc(F)cc3)C2)c(F)c1 ZINC001141196637 1047044510 /nfs/dbraw/zinc/04/45/10/1047044510.db2.gz SBKUNDURECRXOJ-IBGZPJMESA-N 1 2 317.379 4.021 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cccc(-c2ccc(F)cc2)n1 ZINC001141209131 1047045745 /nfs/dbraw/zinc/04/57/45/1047045745.db2.gz QRCIWIGDPGXGLO-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cccc(-c2ccc(F)cc2)n1 ZINC001141209131 1047045759 /nfs/dbraw/zinc/04/57/59/1047045759.db2.gz QRCIWIGDPGXGLO-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO COc1cccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)c1F ZINC001141223722 1047051946 /nfs/dbraw/zinc/05/19/46/1047051946.db2.gz MOTGVXGXXCLVGY-HNNXBMFYSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)c1F ZINC001141223722 1047051961 /nfs/dbraw/zinc/05/19/61/1047051961.db2.gz MOTGVXGXXCLVGY-HNNXBMFYSA-N 1 2 321.342 4.450 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2cc3cc(Cl)cnc3o2)cs1 ZINC000648456725 1047054841 /nfs/dbraw/zinc/05/48/41/1047054841.db2.gz HZCGDCCDNJLFQR-SECBINFHSA-N 1 2 321.833 4.351 20 0 DIADLO Cc1[nH]ncc1C[N@@H+]1C[C@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000536663634 1047056431 /nfs/dbraw/zinc/05/64/31/1047056431.db2.gz RHTJSLOLSBKDIQ-BZNIZROVSA-N 1 2 323.362 4.320 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1C[C@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000536663634 1047056447 /nfs/dbraw/zinc/05/64/47/1047056447.db2.gz RHTJSLOLSBKDIQ-BZNIZROVSA-N 1 2 323.362 4.320 20 0 DIADLO Cc1[nH]ncc1C[N@@H+]1C[C@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000536663633 1047058671 /nfs/dbraw/zinc/05/86/71/1047058671.db2.gz RHTJSLOLSBKDIQ-BDJLRTHQSA-N 1 2 323.362 4.320 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1C[C@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000536663633 1047058680 /nfs/dbraw/zinc/05/86/80/1047058680.db2.gz RHTJSLOLSBKDIQ-BDJLRTHQSA-N 1 2 323.362 4.320 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2nccn2Cc2ccccc2)c1C ZINC000536673225 1047063089 /nfs/dbraw/zinc/06/30/89/1047063089.db2.gz COOBIAYHZNUJQG-UHFFFAOYSA-N 1 2 319.452 4.180 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2nccn2Cc2ccccc2)c1C ZINC000536673225 1047063102 /nfs/dbraw/zinc/06/31/02/1047063102.db2.gz COOBIAYHZNUJQG-UHFFFAOYSA-N 1 2 319.452 4.180 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NCc1ccccc1C1CC1 ZINC000680976084 1047076088 /nfs/dbraw/zinc/07/60/88/1047076088.db2.gz BKORPFPWUFVFIM-UHFFFAOYSA-N 1 2 321.424 4.172 20 0 DIADLO Clc1ccc(C[N@@H+]2CC[C@@H](Oc3ccccc3Cl)C2)o1 ZINC000536711540 1047084617 /nfs/dbraw/zinc/08/46/17/1047084617.db2.gz XORBWDRITJJVBU-GFCCVEGCSA-N 1 2 312.196 4.240 20 0 DIADLO Clc1ccc(C[N@H+]2CC[C@@H](Oc3ccccc3Cl)C2)o1 ZINC000536711540 1047084632 /nfs/dbraw/zinc/08/46/32/1047084632.db2.gz XORBWDRITJJVBU-GFCCVEGCSA-N 1 2 312.196 4.240 20 0 DIADLO CCC[N@H+](C)Cc1c(Br)cccc1Br ZINC001139598908 1047086580 /nfs/dbraw/zinc/08/65/80/1047086580.db2.gz SILIJFOTUGMHRW-UHFFFAOYSA-N 1 2 321.056 4.053 20 0 DIADLO CCC[N@@H+](C)Cc1c(Br)cccc1Br ZINC001139598908 1047086589 /nfs/dbraw/zinc/08/65/89/1047086589.db2.gz SILIJFOTUGMHRW-UHFFFAOYSA-N 1 2 321.056 4.053 20 0 DIADLO COc1cc(Cl)ncc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001141333434 1047096150 /nfs/dbraw/zinc/09/61/50/1047096150.db2.gz BUJIGONLKMTMSB-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(Cl)ncc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001141333434 1047096164 /nfs/dbraw/zinc/09/61/64/1047096164.db2.gz BUJIGONLKMTMSB-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@H](Nc1cc(N)nc[nH+]1)c1ccccc1Oc1ccccc1 ZINC001115994416 1047098814 /nfs/dbraw/zinc/09/88/14/1047098814.db2.gz YXIRIHSVHIXNJF-ZDUSSCGKSA-N 1 2 306.369 4.024 20 0 DIADLO COc1ccsc1[C@@H](C)[NH2+]Cc1c(F)c(F)cc(F)c1F ZINC000681139602 1047101582 /nfs/dbraw/zinc/10/15/82/1047101582.db2.gz LWYPSWHTNIXIQO-SSDOTTSWSA-N 1 2 319.323 4.164 20 0 DIADLO Fc1cccc2c1CC[C@H]2[N@@H+]1CCO[C@H](c2ccccc2F)C1 ZINC001116188371 1047117548 /nfs/dbraw/zinc/11/75/48/1047117548.db2.gz YVCSMKVABIFZTC-MOPGFXCFSA-N 1 2 315.363 4.026 20 0 DIADLO Fc1cccc2c1CC[C@H]2[N@H+]1CCO[C@H](c2ccccc2F)C1 ZINC001116188371 1047117552 /nfs/dbraw/zinc/11/75/52/1047117552.db2.gz YVCSMKVABIFZTC-MOPGFXCFSA-N 1 2 315.363 4.026 20 0 DIADLO CCc1nc([C@H]2CCCC[N@@H+]2CCCCc2ccccc2)no1 ZINC000681400601 1047120749 /nfs/dbraw/zinc/12/07/49/1047120749.db2.gz RYXURKKAFNKOCM-QGZVFWFLSA-N 1 2 313.445 4.182 20 0 DIADLO CCc1nc([C@H]2CCCC[N@H+]2CCCCc2ccccc2)no1 ZINC000681400601 1047120754 /nfs/dbraw/zinc/12/07/54/1047120754.db2.gz RYXURKKAFNKOCM-QGZVFWFLSA-N 1 2 313.445 4.182 20 0 DIADLO CC[NH+](CC)c1ccc(Nc2cc(-c3ccncc3)no2)cc1 ZINC001212969326 1047121913 /nfs/dbraw/zinc/12/19/13/1047121913.db2.gz ZYLALBRBYLFOSV-UHFFFAOYSA-N 1 2 308.385 4.326 20 0 DIADLO CC(C)(C)[C@H]([NH2+]Cn1ncsc1=S)c1ccc(F)cc1 ZINC000098051591 1047123477 /nfs/dbraw/zinc/12/34/77/1047123477.db2.gz AXPCRPJAVOMXFJ-GFCCVEGCSA-N 1 2 311.451 4.148 20 0 DIADLO CC[NH+](CC)c1ccc(Nc2ncccc2N2CCCC2)cc1 ZINC001212969921 1047123496 /nfs/dbraw/zinc/12/34/96/1047123496.db2.gz JJGFNDIHJPHIHF-UHFFFAOYSA-N 1 2 310.445 4.272 20 0 DIADLO CCOc1ccc(C)cc1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC001139605428 1047125188 /nfs/dbraw/zinc/12/51/88/1047125188.db2.gz YYATWQQELFKTKY-OAHLLOKOSA-N 1 2 302.443 4.187 20 0 DIADLO CCOc1ccc(C)cc1C[N@H+]1CCC[C@@H]1c1nccs1 ZINC001139605428 1047125194 /nfs/dbraw/zinc/12/51/94/1047125194.db2.gz YYATWQQELFKTKY-OAHLLOKOSA-N 1 2 302.443 4.187 20 0 DIADLO CCc1ncc(C[N@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)o1 ZINC000929114794 1047126776 /nfs/dbraw/zinc/12/67/76/1047126776.db2.gz AJDGIGVBUKNBPD-MLGOLLRUSA-N 1 2 300.402 4.118 20 0 DIADLO CCc1ncc(C[N@@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)o1 ZINC000929114794 1047126784 /nfs/dbraw/zinc/12/67/84/1047126784.db2.gz AJDGIGVBUKNBPD-MLGOLLRUSA-N 1 2 300.402 4.118 20 0 DIADLO C[C@H]([NH2+]Cc1n[nH]c2ccccc21)c1ccc2ncsc2c1 ZINC000681595034 1047133194 /nfs/dbraw/zinc/13/31/94/1047133194.db2.gz JZPQQPAJVNWGHY-NSHDSACASA-N 1 2 308.410 4.023 20 0 DIADLO Fc1cccc(Br)c1C[NH2+]C1(c2ccccc2)CC1 ZINC000537059660 1047133669 /nfs/dbraw/zinc/13/36/69/1047133669.db2.gz RWEJCAJGGKOUAU-UHFFFAOYSA-N 1 2 320.205 4.367 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1cc2n(n1)CCCC2 ZINC000649471980 1047135777 /nfs/dbraw/zinc/13/57/77/1047135777.db2.gz XDKUQVSTJKRIOH-CQSZACIVSA-N 1 2 309.413 4.159 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1cc2n(n1)CCCC2 ZINC000649471980 1047135783 /nfs/dbraw/zinc/13/57/83/1047135783.db2.gz XDKUQVSTJKRIOH-CQSZACIVSA-N 1 2 309.413 4.159 20 0 DIADLO O=C(CCCSc1[nH+]cc2ccccn21)c1ccc(F)cc1 ZINC000649471334 1047135804 /nfs/dbraw/zinc/13/58/04/1047135804.db2.gz DJTYLOVHGPXTAU-UHFFFAOYSA-N 1 2 314.385 4.229 20 0 DIADLO COc1cc(C)c([C@H](C)[N@H+](C)Cc2nccn2C(F)F)cc1C ZINC000681664771 1047138640 /nfs/dbraw/zinc/13/86/40/1047138640.db2.gz MJGBFLOVVBOQGP-ZDUSSCGKSA-N 1 2 323.387 4.097 20 0 DIADLO COc1cc(C)c([C@H](C)[N@@H+](C)Cc2nccn2C(F)F)cc1C ZINC000681664771 1047138645 /nfs/dbraw/zinc/13/86/45/1047138645.db2.gz MJGBFLOVVBOQGP-ZDUSSCGKSA-N 1 2 323.387 4.097 20 0 DIADLO CC(C)c1ocnc1C[NH2+][C@@H](C)c1ccc(OC(F)F)cc1 ZINC001116477071 1047147125 /nfs/dbraw/zinc/14/71/25/1047147125.db2.gz MCQRWEFSLFTEJI-NSHDSACASA-N 1 2 310.344 4.250 20 0 DIADLO Cc1ccc(OCc2nc(C[N@H+]3CC[C@@H]3C(C)C)cs2)cc1 ZINC000537201216 1047149248 /nfs/dbraw/zinc/14/92/48/1047149248.db2.gz VFXTWOCORLUAEJ-QGZVFWFLSA-N 1 2 316.470 4.261 20 0 DIADLO Cc1ccc(OCc2nc(C[N@@H+]3CC[C@@H]3C(C)C)cs2)cc1 ZINC000537201216 1047149258 /nfs/dbraw/zinc/14/92/58/1047149258.db2.gz VFXTWOCORLUAEJ-QGZVFWFLSA-N 1 2 316.470 4.261 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc(Cl)nc1F ZINC001137478085 1047151906 /nfs/dbraw/zinc/15/19/06/1047151906.db2.gz UNXDFEKSQMZEEX-OAHLLOKOSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc(Cl)nc1F ZINC001137478085 1047151908 /nfs/dbraw/zinc/15/19/08/1047151908.db2.gz UNXDFEKSQMZEEX-OAHLLOKOSA-N 1 2 304.796 4.384 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1ccc(Cl)nc1F ZINC001137477946 1047151972 /nfs/dbraw/zinc/15/19/72/1047151972.db2.gz NVUKEYOSUUFKMK-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1ccc(Cl)nc1F ZINC001137477946 1047151976 /nfs/dbraw/zinc/15/19/76/1047151976.db2.gz NVUKEYOSUUFKMK-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1ncccc1C)c1ccccc1 ZINC001116529353 1047152892 /nfs/dbraw/zinc/15/28/92/1047152892.db2.gz PYJRQNQYHNSKFE-OAQYLSRUSA-N 1 2 318.420 4.278 20 0 DIADLO C[C@@H](CSc1ccccc1)[N@H+](C)Cc1nnc(C2CC2)s1 ZINC000649666288 1047161234 /nfs/dbraw/zinc/16/12/34/1047161234.db2.gz MFTHIMBPWAANFA-LBPRGKRZSA-N 1 2 319.499 4.028 20 0 DIADLO C[C@@H](CSc1ccccc1)[N@@H+](C)Cc1nnc(C2CC2)s1 ZINC000649666288 1047161242 /nfs/dbraw/zinc/16/12/42/1047161242.db2.gz MFTHIMBPWAANFA-LBPRGKRZSA-N 1 2 319.499 4.028 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCOc2c(Cl)cccc21)c1cscn1 ZINC000537305068 1047162759 /nfs/dbraw/zinc/16/27/59/1047162759.db2.gz AQKAWPCHQPUWSY-ZWNOBZJWSA-N 1 2 308.834 4.361 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccc(Cl)cn1 ZINC001116650817 1047165719 /nfs/dbraw/zinc/16/57/19/1047165719.db2.gz GVIUEXLJEJFCSF-LBPRGKRZSA-N 1 2 301.821 4.291 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccc(Cl)cn1 ZINC001116650817 1047165722 /nfs/dbraw/zinc/16/57/22/1047165722.db2.gz GVIUEXLJEJFCSF-LBPRGKRZSA-N 1 2 301.821 4.291 20 0 DIADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1ncc(-c2ccccc2C)o1 ZINC000649716113 1047167238 /nfs/dbraw/zinc/16/72/38/1047167238.db2.gz SZIBKJVIGIUTDV-OAHLLOKOSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1ncc(-c2ccccc2C)o1 ZINC000649716113 1047167243 /nfs/dbraw/zinc/16/72/43/1047167243.db2.gz SZIBKJVIGIUTDV-OAHLLOKOSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1ncc(-c2ccccc2C)o1 ZINC000649716112 1047167564 /nfs/dbraw/zinc/16/75/64/1047167564.db2.gz SZIBKJVIGIUTDV-HNNXBMFYSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1ncc(-c2ccccc2C)o1 ZINC000649716112 1047167570 /nfs/dbraw/zinc/16/75/70/1047167570.db2.gz SZIBKJVIGIUTDV-HNNXBMFYSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@H]([NH2+]Cc1nccn1Cc1ccccc1)c1ccccc1F ZINC000649739215 1047169066 /nfs/dbraw/zinc/16/90/66/1047169066.db2.gz JUIATXNOYARSJQ-IBGZPJMESA-N 1 2 323.415 4.311 20 0 DIADLO Cc1ccc(C[NH2+]C2(c3nccs3)CCCC2)c(Cl)n1 ZINC000838898670 1047171538 /nfs/dbraw/zinc/17/15/38/1047171538.db2.gz BUDJYISUDNFFOW-UHFFFAOYSA-N 1 2 307.850 4.059 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCCc1ccccn1 ZINC001116745279 1047174312 /nfs/dbraw/zinc/17/43/12/1047174312.db2.gz INXGSQZDPQONPP-UHFFFAOYSA-N 1 2 309.438 4.052 20 0 DIADLO Cc1cc(Cl)c(NC(=O)C[C@@H](C)n2cc[nH+]c2)cc1Cl ZINC000649858833 1047183148 /nfs/dbraw/zinc/18/31/48/1047183148.db2.gz RRQVBNBJHHXCHN-SNVBAGLBSA-N 1 2 312.200 4.088 20 0 DIADLO Fc1ccc(C[C@@H]2CC[N@H+](Cc3csc(Cl)n3)C2)cc1 ZINC000827859817 1047186247 /nfs/dbraw/zinc/18/62/47/1047186247.db2.gz ONVYOILRUCWQCG-LBPRGKRZSA-N 1 2 310.825 4.000 20 0 DIADLO Fc1ccc(C[C@@H]2CC[N@@H+](Cc3csc(Cl)n3)C2)cc1 ZINC000827859817 1047186249 /nfs/dbraw/zinc/18/62/49/1047186249.db2.gz ONVYOILRUCWQCG-LBPRGKRZSA-N 1 2 310.825 4.000 20 0 DIADLO Cc1ccccc1[C@@H](O)C1CC[NH+](C/C(Cl)=C/Cl)CC1 ZINC000796406223 1047198092 /nfs/dbraw/zinc/19/80/92/1047198092.db2.gz JWTGOTJWWOWXHB-DNXIFWLFSA-N 1 2 314.256 4.059 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)ccc1F)c1nc2ccccc2n1C ZINC000682533595 1047202272 /nfs/dbraw/zinc/20/22/72/1047202272.db2.gz DFKCEZAKBRWSJZ-NSHDSACASA-N 1 2 317.795 4.217 20 0 DIADLO COCc1cc[nH+]c(NCc2cc(Cl)sc2Cl)c1 ZINC000650243394 1047226212 /nfs/dbraw/zinc/22/62/12/1047226212.db2.gz XDSRJTFNHBJCEV-UHFFFAOYSA-N 1 2 303.214 4.208 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1cn2cc(C)ccc2n1 ZINC000682730406 1047215559 /nfs/dbraw/zinc/21/55/59/1047215559.db2.gz AMOGIJZACUNJPA-UHFFFAOYSA-N 1 2 313.832 4.148 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001117595981 1047232823 /nfs/dbraw/zinc/23/28/23/1047232823.db2.gz UCGIYCUDJNIBCZ-CZUORRHYSA-N 1 2 315.486 4.246 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001117595981 1047232832 /nfs/dbraw/zinc/23/28/32/1047232832.db2.gz UCGIYCUDJNIBCZ-CZUORRHYSA-N 1 2 315.486 4.246 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC001117595977 1047234214 /nfs/dbraw/zinc/23/42/14/1047234214.db2.gz UCGIYCUDJNIBCZ-BBRMVZONSA-N 1 2 315.486 4.246 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nc2c(s1)C[C@@H](C)CC2 ZINC001117595977 1047234224 /nfs/dbraw/zinc/23/42/24/1047234224.db2.gz UCGIYCUDJNIBCZ-BBRMVZONSA-N 1 2 315.486 4.246 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(Cl)n1)c1ccc(Cl)c(F)c1 ZINC001117756970 1047240476 /nfs/dbraw/zinc/24/04/76/1047240476.db2.gz NTZVVVLRCUZIFA-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1nccn1-c1ccccc1 ZINC000682997726 1047247040 /nfs/dbraw/zinc/24/70/40/1047247040.db2.gz XQKPAKSJMRVXIL-KBPBESRZSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1nccn1-c1ccccc1 ZINC000682997726 1047247053 /nfs/dbraw/zinc/24/70/53/1047247053.db2.gz XQKPAKSJMRVXIL-KBPBESRZSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H](CC(C)(C)C)C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000476254324 1047264236 /nfs/dbraw/zinc/26/42/36/1047264236.db2.gz KEQKDXROMVWBPY-CABCVRRESA-N 1 2 322.518 4.026 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC001141696820 1047268232 /nfs/dbraw/zinc/26/82/32/1047268232.db2.gz QFEZRRLNBYXCBM-DTWKUNHWSA-N 1 2 318.617 4.226 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[N@H+]1C[C@H]2CC[C@@H]1C2 ZINC001141696820 1047268256 /nfs/dbraw/zinc/26/82/56/1047268256.db2.gz QFEZRRLNBYXCBM-DTWKUNHWSA-N 1 2 318.617 4.226 20 0 DIADLO Fc1cc(Br)cc(C[N@@H+]2CCC[C@H](F)CC2)c1F ZINC001141797487 1047290264 /nfs/dbraw/zinc/29/02/64/1047290264.db2.gz SBDOWRIJRFKLQI-NSHDSACASA-N 1 2 322.168 4.051 20 0 DIADLO C[C@@H]1CC[C@@H](c2ccccc2)[N@H+](Cc2ncc(Cl)n2C)C1 ZINC000796436864 1047279360 /nfs/dbraw/zinc/27/93/60/1047279360.db2.gz ZANVGDFEJOYAMS-HIFRSBDPSA-N 1 2 303.837 4.047 20 0 DIADLO C[C@@H]1CC[C@@H](c2ccccc2)[N@@H+](Cc2ncc(Cl)n2C)C1 ZINC000796436864 1047279371 /nfs/dbraw/zinc/27/93/71/1047279371.db2.gz ZANVGDFEJOYAMS-HIFRSBDPSA-N 1 2 303.837 4.047 20 0 DIADLO C[C@H]([NH2+]Cc1ccon1)c1cc2cc(Br)ccc2o1 ZINC000148758994 1047281472 /nfs/dbraw/zinc/28/14/72/1047281472.db2.gz OTBTUIKTQHVAES-VIFPVBQESA-N 1 2 321.174 4.034 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cccc(Br)n1 ZINC000388760873 1047288737 /nfs/dbraw/zinc/28/87/37/1047288737.db2.gz NRTLQKCLENJJOY-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cccc(Br)n1 ZINC000388760873 1047288748 /nfs/dbraw/zinc/28/87/48/1047288748.db2.gz NRTLQKCLENJJOY-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO COC1(C(F)(F)F)C[NH+](CC2CCC(C(C)(C)C)CC2)C1 ZINC001462615228 1047289055 /nfs/dbraw/zinc/28/90/55/1047289055.db2.gz ZZUFOWPYMHUWDT-UHFFFAOYSA-N 1 2 307.400 4.102 20 0 DIADLO Fc1cc(Br)cc(C[N@H+]2CCC[C@H](F)CC2)c1F ZINC001141797487 1047290251 /nfs/dbraw/zinc/29/02/51/1047290251.db2.gz SBDOWRIJRFKLQI-NSHDSACASA-N 1 2 322.168 4.051 20 0 DIADLO CC(C)CC[C@@H]([NH2+]c1ccc(N2CCOCC2)cc1)C1CC1 ZINC000389925576 1047293507 /nfs/dbraw/zinc/29/35/07/1047293507.db2.gz UPCOBPREOKAMFH-LJQANCHMSA-N 1 2 302.462 4.150 20 0 DIADLO Fc1ccc2occ(C[N@@H+]3CCCC(F)(F)[C@@H](F)C3)c2c1 ZINC001141847058 1047298660 /nfs/dbraw/zinc/29/86/60/1047298660.db2.gz VMQMTMFAVFCQCS-AWEZNQCLSA-N 1 2 301.283 4.141 20 0 DIADLO Fc1ccc2occ(C[N@H+]3CCCC(F)(F)[C@@H](F)C3)c2c1 ZINC001141847058 1047298669 /nfs/dbraw/zinc/29/86/69/1047298669.db2.gz VMQMTMFAVFCQCS-AWEZNQCLSA-N 1 2 301.283 4.141 20 0 DIADLO CCC[C@@](C)([NH2+]Cc1ncc(CN(C)C)s1)c1ccccc1 ZINC000897926318 1047302672 /nfs/dbraw/zinc/30/26/72/1047302672.db2.gz URVDCCBGIHUHNI-GOSISDBHSA-N 1 2 317.502 4.010 20 0 DIADLO C[N@H+](CCCc1ccccc1)Cc1csc(C(F)(F)F)n1 ZINC001141878738 1047303080 /nfs/dbraw/zinc/30/30/80/1047303080.db2.gz JQHWENMRWRNMCP-UHFFFAOYSA-N 1 2 314.376 4.227 20 0 DIADLO C[N@@H+](CCCc1ccccc1)Cc1csc(C(F)(F)F)n1 ZINC001141878738 1047303092 /nfs/dbraw/zinc/30/30/92/1047303092.db2.gz JQHWENMRWRNMCP-UHFFFAOYSA-N 1 2 314.376 4.227 20 0 DIADLO CCCCOc1ccc(C[NH2+]Cc2nc(C(C)(C)C)co2)cc1 ZINC000897944199 1047303919 /nfs/dbraw/zinc/30/39/19/1047303919.db2.gz ARRMLPPIUYIWDG-UHFFFAOYSA-N 1 2 316.445 4.441 20 0 DIADLO c1n[nH]c([C@H]([NH2+]CC[C@@H]2CCc3ccccc32)C2CCCCC2)n1 ZINC000651376274 1047311477 /nfs/dbraw/zinc/31/14/77/1047311477.db2.gz ZDLVHUGNJIZSRV-QFBILLFUSA-N 1 2 324.472 4.136 20 0 DIADLO c1n[nH]c([C@@H]([NH2+]CC[C@@H]2CCc3ccccc32)C2CCCCC2)n1 ZINC000651376273 1047313273 /nfs/dbraw/zinc/31/32/73/1047313273.db2.gz ZDLVHUGNJIZSRV-LPHOPBHVSA-N 1 2 324.472 4.136 20 0 DIADLO Cc1cccc(Nc2nn(C[N@H+]3CC[C@@H](C)C3)c(=S)s2)c1 ZINC000725779990 1047314647 /nfs/dbraw/zinc/31/46/47/1047314647.db2.gz WAVJGGSCZCGEBU-GFCCVEGCSA-N 1 2 320.487 4.025 20 0 DIADLO Cc1cccc(Nc2nn(C[N@@H+]3CC[C@@H](C)C3)c(=S)s2)c1 ZINC000725779990 1047314659 /nfs/dbraw/zinc/31/46/59/1047314659.db2.gz WAVJGGSCZCGEBU-GFCCVEGCSA-N 1 2 320.487 4.025 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCC[C@@H]1CCCC1=O ZINC001118895343 1047315570 /nfs/dbraw/zinc/31/55/70/1047315570.db2.gz PUESWDZARQSJHE-HNNXBMFYSA-N 1 2 314.454 4.173 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2cnn(CC3CCC3)c2)c(C)s1 ZINC000898179112 1047325715 /nfs/dbraw/zinc/32/57/15/1047325715.db2.gz HSPAWBMVXZXWKO-VXGBXAGGSA-N 1 2 318.490 4.168 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H](C)c2cnn(CC3CCC3)c2)s1 ZINC000898180198 1047326219 /nfs/dbraw/zinc/32/62/19/1047326219.db2.gz VHVVDGDNMSLGJK-CYBMUJFWSA-N 1 2 318.490 4.114 20 0 DIADLO C[N@H+](Cc1ccno1)Cc1sccc1Oc1ccccc1 ZINC001142001542 1047338538 /nfs/dbraw/zinc/33/85/38/1047338538.db2.gz USIDBXUHJWSBSH-UHFFFAOYSA-N 1 2 300.383 4.160 20 0 DIADLO C[N@@H+](Cc1ccno1)Cc1sccc1Oc1ccccc1 ZINC001142001542 1047338547 /nfs/dbraw/zinc/33/85/47/1047338547.db2.gz USIDBXUHJWSBSH-UHFFFAOYSA-N 1 2 300.383 4.160 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[N@H+](C)Cc1cncs1 ZINC000652039885 1047340711 /nfs/dbraw/zinc/34/07/11/1047340711.db2.gz QVAUXEUUVPFOPQ-AWEZNQCLSA-N 1 2 322.861 4.315 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[N@@H+](C)Cc1cncs1 ZINC000652039885 1047340718 /nfs/dbraw/zinc/34/07/18/1047340718.db2.gz QVAUXEUUVPFOPQ-AWEZNQCLSA-N 1 2 322.861 4.315 20 0 DIADLO COCc1cc[nH+]c(NC2CC(c3cccc(Cl)c3)C2)c1 ZINC000652068807 1047342780 /nfs/dbraw/zinc/34/27/80/1047342780.db2.gz PMUNTNCNDPVHFG-UHFFFAOYSA-N 1 2 302.805 4.240 20 0 DIADLO O=C(C[C@H]1C=CCC1)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000044568420 1047346851 /nfs/dbraw/zinc/34/68/51/1047346851.db2.gz BLWBSGVARJQEPZ-HNNXBMFYSA-N 1 2 321.424 4.181 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H]2CC(C)(C)Oc3ccc(F)cc32)no1 ZINC000652267589 1047349666 /nfs/dbraw/zinc/34/96/66/1047349666.db2.gz XERZMXVETCNXMS-NHYWBVRUSA-N 1 2 304.365 4.075 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](Cc2ccccc2)c2nccn2C)oc1C ZINC000652275615 1047351467 /nfs/dbraw/zinc/35/14/67/1047351467.db2.gz SJLZKBKIJIYELU-QAPCUYQASA-N 1 2 323.440 4.265 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](Cc2ccccc2)c2nccn2C)oc1C ZINC000652275613 1047352643 /nfs/dbraw/zinc/35/26/43/1047352643.db2.gz SJLZKBKIJIYELU-CRAIPNDOSA-N 1 2 323.440 4.265 20 0 DIADLO CSc1ccc(C[N@H+](C)Cc2nc3ccccc3o2)s1 ZINC001142029176 1047353455 /nfs/dbraw/zinc/35/34/55/1047353455.db2.gz OVAZKWDHXFDXFM-UHFFFAOYSA-N 1 2 304.440 4.243 20 0 DIADLO CSc1ccc(C[N@@H+](C)Cc2nc3ccccc3o2)s1 ZINC001142029176 1047353469 /nfs/dbraw/zinc/35/34/69/1047353469.db2.gz OVAZKWDHXFDXFM-UHFFFAOYSA-N 1 2 304.440 4.243 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2cc3c(s2)CCCC3)c1 ZINC000652331102 1047355201 /nfs/dbraw/zinc/35/52/01/1047355201.db2.gz YEARZWPVDRKFCK-GFCCVEGCSA-N 1 2 302.443 4.341 20 0 DIADLO COCc1cc[nH+]c(N[C@H](c2ccc(OC)cc2)C(C)C)c1 ZINC000652330688 1047355706 /nfs/dbraw/zinc/35/57/06/1047355706.db2.gz MSGDSJQOBFMWIL-SFHVURJKSA-N 1 2 300.402 4.046 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2c3cccc(F)c3CC[C@H]2C)c1 ZINC000652330672 1047356501 /nfs/dbraw/zinc/35/65/01/1047356501.db2.gz MKNFJZJUFNPENZ-XIKOKIGWSA-N 1 2 300.377 4.103 20 0 DIADLO CC(C)c1ccc(-c2nc(C[N@H+](C)[C@@H]3CCOC3)cs2)cc1 ZINC000106881370 1047369152 /nfs/dbraw/zinc/36/91/52/1047369152.db2.gz ZMTHBJZEBANLHZ-QGZVFWFLSA-N 1 2 316.470 4.154 20 0 DIADLO CC(C)c1ccc(-c2nc(C[N@@H+](C)[C@@H]3CCOC3)cs2)cc1 ZINC000106881370 1047369159 /nfs/dbraw/zinc/36/91/59/1047369159.db2.gz ZMTHBJZEBANLHZ-QGZVFWFLSA-N 1 2 316.470 4.154 20 0 DIADLO Fc1ccc(Br)c(Cl)c1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC001142092284 1047376084 /nfs/dbraw/zinc/37/60/84/1047376084.db2.gz WLICWUZEPNYRDI-DTWKUNHWSA-N 1 2 318.617 4.226 20 0 DIADLO Fc1ccc(Br)c(Cl)c1C[N@H+]1C[C@H]2CC[C@@H]1C2 ZINC001142092284 1047376094 /nfs/dbraw/zinc/37/60/94/1047376094.db2.gz WLICWUZEPNYRDI-DTWKUNHWSA-N 1 2 318.617 4.226 20 0 DIADLO CC[N@H+](Cc1ccc(C(F)(F)F)cn1)Cc1ccccc1F ZINC001139014860 1047376905 /nfs/dbraw/zinc/37/69/05/1047376905.db2.gz IFEZKUXLCUOZTG-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1ccc(C(F)(F)F)cn1)Cc1ccccc1F ZINC001139014860 1047376919 /nfs/dbraw/zinc/37/69/19/1047376919.db2.gz IFEZKUXLCUOZTG-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO Clc1ccccc1-c1ccc(C[N@@H+]2CCn3cncc3C2)cc1 ZINC001142102055 1047381609 /nfs/dbraw/zinc/38/16/09/1047381609.db2.gz MQBUWBNEKLPAGL-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Clc1ccccc1-c1ccc(C[N@H+]2CCn3cncc3C2)cc1 ZINC001142102055 1047381615 /nfs/dbraw/zinc/38/16/15/1047381615.db2.gz MQBUWBNEKLPAGL-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Oc1cc(Cl)c(C[N@@H+]2CCC[C@H]2c2cccnc2)c(Cl)c1 ZINC001142105698 1047381871 /nfs/dbraw/zinc/38/18/71/1047381871.db2.gz KIDCQEQTIRIRIX-INIZCTEOSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1cc(Cl)c(C[N@@H+]2CCC[C@H]2c2ccncc2)c(Cl)c1 ZINC001142114266 1047383767 /nfs/dbraw/zinc/38/37/67/1047383767.db2.gz DKFZCSHZMVGFHP-INIZCTEOSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1cc(Cl)c(C[N@H+]2CCC[C@H]2c2ccncc2)c(Cl)c1 ZINC001142114266 1047383777 /nfs/dbraw/zinc/38/37/77/1047383777.db2.gz DKFZCSHZMVGFHP-INIZCTEOSA-N 1 2 323.223 4.431 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(C(C)(C)C)cc1)[NH+]1CCC(F)(F)CC1 ZINC000796540053 1047383898 /nfs/dbraw/zinc/38/38/98/1047383898.db2.gz PFMMBISJWCFKAL-ZDUSSCGKSA-N 1 2 324.415 4.042 20 0 DIADLO Oc1cc(Cl)c(C[N@@H+]2CCC[C@H]2c2ccccn2)c(Cl)c1 ZINC001142114792 1047384086 /nfs/dbraw/zinc/38/40/86/1047384086.db2.gz OYBGCDPXJGSDGQ-INIZCTEOSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1cc(Cl)c(C[N@H+]2CCC[C@H]2c2ccccn2)c(Cl)c1 ZINC001142114792 1047384093 /nfs/dbraw/zinc/38/40/93/1047384093.db2.gz OYBGCDPXJGSDGQ-INIZCTEOSA-N 1 2 323.223 4.431 20 0 DIADLO CCC[C@@H](NC(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccccn1 ZINC000653179877 1047384659 /nfs/dbraw/zinc/38/46/59/1047384659.db2.gz VBIACQWKNFDHEQ-MRXNPFEDSA-N 1 2 312.417 4.065 20 0 DIADLO COc1ccc2c(c1)[C@@H](C(=O)Nc1c(C)cc(C)[nH+]c1C)CCC2 ZINC000653540348 1047398396 /nfs/dbraw/zinc/39/83/96/1047398396.db2.gz DKHXASPSUIOBLB-KRWDZBQOSA-N 1 2 324.424 4.074 20 0 DIADLO Cc1cc(C)cc(CCC(=O)Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC000533234950 1047399274 /nfs/dbraw/zinc/39/92/74/1047399274.db2.gz ALSMLSGQCHJMHB-UHFFFAOYSA-N 1 2 319.408 4.060 20 0 DIADLO COc1ccc(C(C)C)cc1C[NH2+]C(C)(C)c1nccs1 ZINC000653581070 1047403633 /nfs/dbraw/zinc/40/36/33/1047403633.db2.gz WGOJAAOGSHHBMZ-UHFFFAOYSA-N 1 2 304.459 4.300 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](CCO)Cc1c(F)cccc1Cl ZINC001168307610 1047404260 /nfs/dbraw/zinc/40/42/60/1047404260.db2.gz DEGVMCWZKOYRTB-ZDUSSCGKSA-N 1 2 307.796 4.035 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](CCO)Cc1c(F)cccc1Cl ZINC001168307610 1047404265 /nfs/dbraw/zinc/40/42/65/1047404265.db2.gz DEGVMCWZKOYRTB-ZDUSSCGKSA-N 1 2 307.796 4.035 20 0 DIADLO Fc1ccccc1-c1nc(C[N@@H+]2CC[C@@H]3[C@H](C2)C3(F)F)cs1 ZINC001168311017 1047412770 /nfs/dbraw/zinc/41/27/70/1047412770.db2.gz XQBHINSZXOBLIZ-OLZOCXBDSA-N 1 2 324.371 4.036 20 0 DIADLO Fc1ccccc1-c1nc(C[N@H+]2CC[C@@H]3[C@H](C2)C3(F)F)cs1 ZINC001168311017 1047412779 /nfs/dbraw/zinc/41/27/79/1047412779.db2.gz XQBHINSZXOBLIZ-OLZOCXBDSA-N 1 2 324.371 4.036 20 0 DIADLO O=C(/C=C/c1ccccc1Cl)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000749382818 1047415026 /nfs/dbraw/zinc/41/50/26/1047415026.db2.gz QUUKQVRLMJGYBI-JXMROGBWSA-N 1 2 323.783 4.382 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2csc(-c3ccco3)n2)cc1 ZINC000055472470 1047423083 /nfs/dbraw/zinc/42/30/83/1047423083.db2.gz KKOMEFZIQNSXFD-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2csc(-c3ccco3)n2)cc1 ZINC000055472470 1047423090 /nfs/dbraw/zinc/42/30/90/1047423090.db2.gz KKOMEFZIQNSXFD-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO CC(C)c1ccsc1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000053346109 1047427549 /nfs/dbraw/zinc/42/75/49/1047427549.db2.gz MKMJQTLQWWKHIZ-UHFFFAOYSA-N 1 2 311.410 4.310 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C=C(C3CC3)C3CC3)c2)[nH+]c1C ZINC000749578658 1047428001 /nfs/dbraw/zinc/42/80/01/1047428001.db2.gz DRNVFHPTPJGKPQ-UHFFFAOYSA-N 1 2 321.424 4.378 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+][C@H](Cc1ccccc1)c1ncco1)CC2 ZINC000653911686 1047432245 /nfs/dbraw/zinc/43/22/45/1047432245.db2.gz JHSPHLZJBZYJSP-RBUKOAKNSA-N 1 2 322.383 4.375 20 0 DIADLO Cc1cccc(CN(CC(C)C)C(=O)c2cc3c[nH+]ccc3[nH]2)c1 ZINC001142440074 1047451692 /nfs/dbraw/zinc/45/16/92/1047451692.db2.gz CXOFNPKVLWNVQX-UHFFFAOYSA-N 1 2 321.424 4.170 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](C)Cc2c(C)cccc2C)cs1 ZINC000750061872 1047455481 /nfs/dbraw/zinc/45/54/81/1047455481.db2.gz XHOPNGQVHXMGJG-AWEZNQCLSA-N 1 2 304.459 4.099 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](C)Cc2c(C)cccc2C)cs1 ZINC000750061872 1047455487 /nfs/dbraw/zinc/45/54/87/1047455487.db2.gz XHOPNGQVHXMGJG-AWEZNQCLSA-N 1 2 304.459 4.099 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(N2CCCCC2)c(Cl)c1 ZINC000841851837 1047460208 /nfs/dbraw/zinc/46/02/08/1047460208.db2.gz YSWSDOLASZMNCA-UHFFFAOYSA-N 1 2 318.852 4.159 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(-c3ccccc3)[nH]2)[C@H]1c1ccccc1 ZINC000537622508 1047467689 /nfs/dbraw/zinc/46/76/89/1047467689.db2.gz ZXSBJEPXRKRQMI-DNVCBOLYSA-N 1 2 303.409 4.270 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc(-c3ccccc3)[nH]2)[C@@H]1c1ccccc1 ZINC000537622510 1047467925 /nfs/dbraw/zinc/46/79/25/1047467925.db2.gz ZXSBJEPXRKRQMI-KXBFYZLASA-N 1 2 303.409 4.270 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1ccc(C)cc1Br ZINC000537628463 1047484471 /nfs/dbraw/zinc/48/44/71/1047484471.db2.gz KXJKDCHPRGAZEE-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1ccc(C)cc1Br ZINC000537628463 1047484476 /nfs/dbraw/zinc/48/44/76/1047484476.db2.gz KXJKDCHPRGAZEE-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2Cl)C[N@@H+]1Cc1ccsc1 ZINC000537627485 1047486558 /nfs/dbraw/zinc/48/65/58/1047486558.db2.gz UUEXEQGMVWFUKT-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2Cl)C[N@H+]1Cc1ccsc1 ZINC000537627485 1047486560 /nfs/dbraw/zinc/48/65/60/1047486560.db2.gz UUEXEQGMVWFUKT-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO C[N@H+](Cc1csc(Cl)c1)Cc1ncccc1C(F)(F)F ZINC001142759992 1047491749 /nfs/dbraw/zinc/49/17/49/1047491749.db2.gz DJMXILZFPAUXGN-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1csc(Cl)c1)Cc1ncccc1C(F)(F)F ZINC001142759992 1047491757 /nfs/dbraw/zinc/49/17/57/1047491757.db2.gz DJMXILZFPAUXGN-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO Cc1ccccc1N1CC[NH+](Cc2csc(Cl)c2)CC1 ZINC001142759927 1047492082 /nfs/dbraw/zinc/49/20/82/1047492082.db2.gz ANGNAWIUJSJQMU-UHFFFAOYSA-N 1 2 306.862 4.032 20 0 DIADLO Cc1ccc(NCc2c[nH+]cn2C(C)C)c(Br)c1 ZINC000090207470 1047499755 /nfs/dbraw/zinc/49/97/55/1047499755.db2.gz UMCRPYIKRLIWES-UHFFFAOYSA-N 1 2 308.223 4.147 20 0 DIADLO Cc1cc(NCc2c[nH+]cn2C(C)C)ccc1Br ZINC000090207501 1047499885 /nfs/dbraw/zinc/49/98/85/1047499885.db2.gz JFCAWSYLGKAXMY-UHFFFAOYSA-N 1 2 308.223 4.147 20 0 DIADLO Clc1ccc(-c2cc(CSCCn3cc[nH+]c3)on2)cc1 ZINC000090200105 1047500163 /nfs/dbraw/zinc/50/01/63/1047500163.db2.gz JUIMDDXESDUKNJ-UHFFFAOYSA-N 1 2 319.817 4.125 20 0 DIADLO Clc1ccc2cccnc2c1CSCCn1cc[nH+]c1 ZINC000090200246 1047500194 /nfs/dbraw/zinc/50/01/94/1047500194.db2.gz SRWALPWVKDQEBU-UHFFFAOYSA-N 1 2 303.818 4.018 20 0 DIADLO Cc1ccc(NCc2c[nH+]cn2C(C)C)cc1Br ZINC000090209302 1047500251 /nfs/dbraw/zinc/50/02/51/1047500251.db2.gz DZUZVRLCMAIDOI-UHFFFAOYSA-N 1 2 308.223 4.147 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1cccc(F)c1)c1ccccn1)c1ccncc1 ZINC000090955968 1047513706 /nfs/dbraw/zinc/51/37/06/1047513706.db2.gz AQHUHEYKCRDHJW-KUHUBIRLSA-N 1 2 307.372 4.056 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@H](C)c2cncc(F)c2)c2ccccn2)c1 ZINC000090945795 1047514134 /nfs/dbraw/zinc/51/41/34/1047514134.db2.gz PISMLWXJDPBLEY-FOIQADDNSA-N 1 2 321.399 4.364 20 0 DIADLO CCC[NH+]1CCN(C2CCC(c3ccc(Cl)cc3)CC2)CC1 ZINC001168343314 1047517428 /nfs/dbraw/zinc/51/74/28/1047517428.db2.gz PFPMEVCGSQDLMM-UHFFFAOYSA-N 1 2 320.908 4.394 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000091990531 1047527601 /nfs/dbraw/zinc/52/76/01/1047527601.db2.gz JAUHWDRLIDHCPU-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ncc(-c2cccc(F)c2)o1 ZINC000091990531 1047527606 /nfs/dbraw/zinc/52/76/06/1047527606.db2.gz JAUHWDRLIDHCPU-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO CN(Cc1ccc2[nH+]ccn2c1)Cc1c(Cl)cccc1Cl ZINC001143029041 1047527714 /nfs/dbraw/zinc/52/77/14/1047527714.db2.gz OHUATWZYEUQTQA-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1ccc(-c2ccncc2)cc1F ZINC000092438441 1047534220 /nfs/dbraw/zinc/53/42/20/1047534220.db2.gz WDZQMVSMSGRWLS-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1ccc(-c2ccncc2)cc1F ZINC000092438441 1047534224 /nfs/dbraw/zinc/53/42/24/1047534224.db2.gz WDZQMVSMSGRWLS-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1c[nH+]c(CCSC[C@H]2OCCc3ccccc32)c(C)c1 ZINC000843301502 1047540123 /nfs/dbraw/zinc/54/01/23/1047540123.db2.gz BCEQBZNFEVWEDZ-LJQANCHMSA-N 1 2 313.466 4.288 20 0 DIADLO CC1(CC(F)F)C[NH+](Cc2ccc(CSC(F)F)o2)C1 ZINC000843424758 1047549426 /nfs/dbraw/zinc/54/94/26/1047549426.db2.gz ILALWIWFARYEBO-UHFFFAOYSA-N 1 2 311.344 4.213 20 0 DIADLO COc1ccc(F)c(C(F)(F)F)c1C[NH+]1CC2(C1)CCCC2 ZINC001143299161 1047550463 /nfs/dbraw/zinc/55/04/63/1047550463.db2.gz OAQDIORJHNZUIH-UHFFFAOYSA-N 1 2 317.326 4.229 20 0 DIADLO CC1(F)CC[NH+](Cc2c(Br)ccc(F)c2F)CC1 ZINC001143327984 1047552891 /nfs/dbraw/zinc/55/28/91/1047552891.db2.gz CCOWYLKDEFUHKT-UHFFFAOYSA-N 1 2 322.168 4.051 20 0 DIADLO COc1c(F)ccc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c1F ZINC001143318089 1047553060 /nfs/dbraw/zinc/55/30/60/1047553060.db2.gz HPKGHDHIEKQGOS-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c1F ZINC001143318089 1047553063 /nfs/dbraw/zinc/55/30/63/1047553063.db2.gz HPKGHDHIEKQGOS-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO CC[C@H]([NH2+]Cc1ncc(C)s1)c1cc(Cl)ccc1OC ZINC000122879474 1047555957 /nfs/dbraw/zinc/55/59/57/1047555957.db2.gz BJWPGJHZOAXFFQ-ZDUSSCGKSA-N 1 2 310.850 4.354 20 0 DIADLO CCC[C@](C)(CC)C(=O)N1CCC(CCCn2cc[nH+]c2)CC1 ZINC000476633352 1047560498 /nfs/dbraw/zinc/56/04/98/1047560498.db2.gz RFBKJVVDEJTLDU-IBGZPJMESA-N 1 2 319.493 4.118 20 0 DIADLO CCCCCC[C@](C)(CCC)C(=O)NCc1[nH]c(C)c(C)[nH+]1 ZINC001149404613 1047562255 /nfs/dbraw/zinc/56/22/55/1047562255.db2.gz MAHVTDDHVASIBN-SFHVURJKSA-N 1 2 307.482 4.420 20 0 DIADLO CCn1c(C)cc(C(=O)C[N@H+](Cc2cccs2)C2CC2)c1C ZINC000315307468 1047603966 /nfs/dbraw/zinc/60/39/66/1047603966.db2.gz ZFQFDWVOTMKPLY-UHFFFAOYSA-N 1 2 316.470 4.034 20 0 DIADLO CCn1c(C)cc(C(=O)C[N@@H+](Cc2cccs2)C2CC2)c1C ZINC000315307468 1047603968 /nfs/dbraw/zinc/60/39/68/1047603968.db2.gz ZFQFDWVOTMKPLY-UHFFFAOYSA-N 1 2 316.470 4.034 20 0 DIADLO O=C(N[C@H](c1ccccc1)C1CCCC1)c1cc2c[nH+]ccc2[nH]1 ZINC001151976708 1047605154 /nfs/dbraw/zinc/60/51/54/1047605154.db2.gz QSCHVZZAPWIBRR-LJQANCHMSA-N 1 2 319.408 4.224 20 0 DIADLO CN(C)c1cc[nH+]c(NC(=O)c2ccc(-c3ccccc3)s2)c1 ZINC001152319645 1047610300 /nfs/dbraw/zinc/61/03/00/1047610300.db2.gz KICFPTOUJNEOKB-UHFFFAOYSA-N 1 2 323.421 4.128 20 0 DIADLO CC[N@H+](Cc1ccn(C2CCCC2)n1)[C@@H](C)c1cccc(O)c1 ZINC000477287048 1047610380 /nfs/dbraw/zinc/61/03/80/1047610380.db2.gz WSNCVPRHPCDGHY-HNNXBMFYSA-N 1 2 313.445 4.287 20 0 DIADLO CC[N@@H+](Cc1ccn(C2CCCC2)n1)[C@@H](C)c1cccc(O)c1 ZINC000477287048 1047610381 /nfs/dbraw/zinc/61/03/81/1047610381.db2.gz WSNCVPRHPCDGHY-HNNXBMFYSA-N 1 2 313.445 4.287 20 0 DIADLO COc1ccc(C[N@H+](C)[C@H](C)c2ccc(F)cc2F)c(OC)c1 ZINC000477537277 1047625600 /nfs/dbraw/zinc/62/56/00/1047625600.db2.gz OIDYJBFJJVVJIN-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@H](C)c2ccc(F)cc2F)c(OC)c1 ZINC000477537277 1047625603 /nfs/dbraw/zinc/62/56/03/1047625603.db2.gz OIDYJBFJJVVJIN-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@]3(C)CCC[C@@H]3C)cc2)[nH+]c1C ZINC001153557067 1047627764 /nfs/dbraw/zinc/62/77/64/1047627764.db2.gz TXTOKUHVBLOFHB-HXPMCKFVSA-N 1 2 311.429 4.458 20 0 DIADLO C/C(=C/c1ccco1)C(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1 ZINC001153554359 1047627784 /nfs/dbraw/zinc/62/77/84/1047627784.db2.gz CXHSUAPZUYXUHL-QXMHVHEDSA-N 1 2 321.380 4.329 20 0 DIADLO CCSc1cc[nH+]c(NCc2cccc(OC(F)F)c2)c1 ZINC001154669950 1047654378 /nfs/dbraw/zinc/65/43/78/1047654378.db2.gz FEQDTQNZRJFSNV-UHFFFAOYSA-N 1 2 310.369 4.407 20 0 DIADLO Cc1cc(NCc2ccc3c(ccn3C)c2)nc(C(C)(C)C)[nH+]1 ZINC001154805604 1047658249 /nfs/dbraw/zinc/65/82/49/1047658249.db2.gz DLZLILFJHCYSEP-UHFFFAOYSA-N 1 2 308.429 4.186 20 0 DIADLO Cc1cc(NCc2cnc3cccc(C)n23)[nH+]c2ccccc12 ZINC001154943169 1047662173 /nfs/dbraw/zinc/66/21/73/1047662173.db2.gz BZDDHSHDLJKWGK-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1ncccc1OCc1ccc(F)cc1 ZINC001155181715 1047670930 /nfs/dbraw/zinc/67/09/30/1047670930.db2.gz PBJNDIZBNOLRQF-UHFFFAOYSA-N 1 2 301.365 4.235 20 0 DIADLO Fc1ccc2c(c1)[nH]c1nc[nH+]c(NC[C@@H]3CCC(F)(F)C3)c21 ZINC001155176140 1047671015 /nfs/dbraw/zinc/67/10/15/1047671015.db2.gz RBZYQXDCHZMYHX-SECBINFHSA-N 1 2 320.318 4.098 20 0 DIADLO Cc1ccn2c(CNc3cc(-c4ccccc4)cc[nH+]3)cnc2c1 ZINC001155274563 1047674047 /nfs/dbraw/zinc/67/40/47/1047674047.db2.gz VKMASSMNJONCPE-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO Cc1ccn2c(CNc3[nH+]ccc4cc(Cl)ccc43)cnc2c1 ZINC001155279086 1047674223 /nfs/dbraw/zinc/67/42/23/1047674223.db2.gz XEDMBSWKMUTJJE-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO CSc1cc[nH+]c(N2CCc3c(cccc3C(F)(F)F)C2)c1 ZINC001155449776 1047681578 /nfs/dbraw/zinc/68/15/78/1047681578.db2.gz JGQOLIGUKIFHBT-UHFFFAOYSA-N 1 2 324.371 4.385 20 0 DIADLO CCOC(CCCNc1[nH+]ccc2cccc(Cl)c21)OCC ZINC001155725240 1047687625 /nfs/dbraw/zinc/68/76/25/1047687625.db2.gz YVIORFZICMQBGX-UHFFFAOYSA-N 1 2 322.836 4.479 20 0 DIADLO CCOc1cccc(CCNc2cc(SCC)cc[nH+]2)c1 ZINC001155875070 1047690757 /nfs/dbraw/zinc/69/07/57/1047690757.db2.gz RJJREPFUTZEXBJ-UHFFFAOYSA-N 1 2 302.443 4.247 20 0 DIADLO [NH2+]=C(Nc1cnc2ccc(F)cc2n1)C12CC3CC(CC(C3)C1)C2 ZINC001155960231 1047692794 /nfs/dbraw/zinc/69/27/94/1047692794.db2.gz VEIBDMIAOWJPBT-UHFFFAOYSA-N 1 2 324.403 4.374 20 0 DIADLO Cc1nc(Cl)cnc1NC(=[NH2+])C12CC3CC(CC(C3)C1)C2 ZINC001155959652 1047692881 /nfs/dbraw/zinc/69/28/81/1047692881.db2.gz MFYVBFFKGIXYJB-UHFFFAOYSA-N 1 2 304.825 4.044 20 0 DIADLO [NH2+]=C(Nc1cnc2ccccc2n1)C12CC3CC(CC(C3)C1)C2 ZINC001155955963 1047693050 /nfs/dbraw/zinc/69/30/50/1047693050.db2.gz JIJMOOUOONACCX-UHFFFAOYSA-N 1 2 306.413 4.235 20 0 DIADLO COc1ccnc(Cl)c1NC(=[NH2+])C12CC3CC(CC(C3)C1)C2 ZINC001155962324 1047693616 /nfs/dbraw/zinc/69/36/16/1047693616.db2.gz INDUIDMQEQXIFX-UHFFFAOYSA-N 1 2 319.836 4.349 20 0 DIADLO CCc1c(Cl)ncnc1NC(=[NH2+])C12CC3CC(CC(C3)C1)C2 ZINC001155962501 1047693839 /nfs/dbraw/zinc/69/38/39/1047693839.db2.gz QCFHNGFODFLVOE-UHFFFAOYSA-N 1 2 318.852 4.298 20 0 DIADLO Cc1cc(Cl)c(C)c(N(C)CC/C=C/c2cccnc2)[nH+]1 ZINC001155976188 1047694313 /nfs/dbraw/zinc/69/43/13/1047694313.db2.gz FHFOOHKVSYNECT-QPJJXVBHSA-N 1 2 301.821 4.287 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC3CC2(c2ccccc2)C3)c(C)[nH+]1 ZINC000667118940 1047694423 /nfs/dbraw/zinc/69/44/23/1047694423.db2.gz CLOICNLRIHWXQJ-UHFFFAOYSA-N 1 2 321.424 4.160 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](C)C2CCC(F)CC2)c(C)[nH+]1 ZINC000667118959 1047694446 /nfs/dbraw/zinc/69/44/46/1047694446.db2.gz DDPKDTQGKMCBOF-LRVUVFPRSA-N 1 2 307.413 4.045 20 0 DIADLO c1[nH+]c(-c2ccc(NC(C3CC3)C3CC3)cc2)n2c1CCCC2 ZINC000538641717 1047694528 /nfs/dbraw/zinc/69/45/28/1047694528.db2.gz FWWJVPSBVSKSOR-UHFFFAOYSA-N 1 2 307.441 4.487 20 0 DIADLO Cc1cc(C)c(NC(=O)NC2CCC3(CC3(F)F)CC2)c(C)[nH+]1 ZINC000667119477 1047695749 /nfs/dbraw/zinc/69/57/49/1047695749.db2.gz VPYSYTYGRMSFLL-UHFFFAOYSA-N 1 2 323.387 4.096 20 0 DIADLO C[N@@H+](Cc1ccon1)Cc1ccc(-c2ccc(F)cc2)s1 ZINC000538719917 1047700954 /nfs/dbraw/zinc/70/09/54/1047700954.db2.gz RIDIIWYZSSUXJA-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@H+](Cc1ccon1)Cc1ccc(-c2ccc(F)cc2)s1 ZINC000538719917 1047700958 /nfs/dbraw/zinc/70/09/58/1047700958.db2.gz RIDIIWYZSSUXJA-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO COc1ccccc1/C=C\C[N@@H+]1CCO[C@H](c2ccccc2C)C1 ZINC000538729124 1047701768 /nfs/dbraw/zinc/70/17/68/1047701768.db2.gz RVBZLCFPYUGICP-UKSYNSBOSA-N 1 2 323.436 4.090 20 0 DIADLO COc1ccccc1/C=C\C[N@H+]1CCO[C@H](c2ccccc2C)C1 ZINC000538729124 1047701774 /nfs/dbraw/zinc/70/17/74/1047701774.db2.gz RVBZLCFPYUGICP-UKSYNSBOSA-N 1 2 323.436 4.090 20 0 DIADLO C[C@H]1c2c(F)cccc2CC[N@H+]1Cc1cnc(C2CC2)s1 ZINC000538728097 1047702302 /nfs/dbraw/zinc/70/23/02/1047702302.db2.gz VDQSKEKWYHAJSR-NSHDSACASA-N 1 2 302.418 4.279 20 0 DIADLO C[C@H]1c2c(F)cccc2CC[N@@H+]1Cc1cnc(C2CC2)s1 ZINC000538728097 1047702307 /nfs/dbraw/zinc/70/23/07/1047702307.db2.gz VDQSKEKWYHAJSR-NSHDSACASA-N 1 2 302.418 4.279 20 0 DIADLO Cc1cc(N[C@@H](c2cccnc2)C(F)(F)F)nc(C(C)C)[nH+]1 ZINC001156163431 1047703810 /nfs/dbraw/zinc/70/38/10/1047703810.db2.gz QBSNFROVSNMTOI-ZDUSSCGKSA-N 1 2 310.323 4.019 20 0 DIADLO c1coc(CSCCNc2[nH+]cnc3[nH]c4ccccc4c32)c1 ZINC001156190911 1047705287 /nfs/dbraw/zinc/70/52/87/1047705287.db2.gz GRKREQILGXBNIA-UHFFFAOYSA-N 1 2 324.409 4.049 20 0 DIADLO C[C@@H]1C[N@H+](C/C=C\c2ccc(F)cc2)C[C@@H](c2ccsc2)O1 ZINC000538750900 1047707901 /nfs/dbraw/zinc/70/79/01/1047707901.db2.gz GAECQPFUWKRNMM-BUGOJEBSSA-N 1 2 317.429 4.362 20 0 DIADLO C[C@@H]1C[N@@H+](C/C=C\c2ccc(F)cc2)C[C@@H](c2ccsc2)O1 ZINC000538750900 1047707905 /nfs/dbraw/zinc/70/79/05/1047707905.db2.gz GAECQPFUWKRNMM-BUGOJEBSSA-N 1 2 317.429 4.362 20 0 DIADLO CC(C)(C)Oc1cc(F)ccc1NCc1cccc2[nH+]ccn21 ZINC000538753300 1047708896 /nfs/dbraw/zinc/70/88/96/1047708896.db2.gz FJEVAXJRKUWBKM-UHFFFAOYSA-N 1 2 313.376 4.263 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)cc1 ZINC000538752830 1047709279 /nfs/dbraw/zinc/70/92/79/1047709279.db2.gz PBFXWOOLZOUQGB-DYVFJYSZSA-N 1 2 319.495 4.432 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)cc1 ZINC000538752830 1047709284 /nfs/dbraw/zinc/70/92/84/1047709284.db2.gz PBFXWOOLZOUQGB-DYVFJYSZSA-N 1 2 319.495 4.432 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000538763155 1047711401 /nfs/dbraw/zinc/71/14/01/1047711401.db2.gz JOTWIDDJGBSVOC-MRXNPFEDSA-N 1 2 308.347 4.170 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1cc(F)c(F)c(F)c1 ZINC000538763155 1047711407 /nfs/dbraw/zinc/71/14/07/1047711407.db2.gz JOTWIDDJGBSVOC-MRXNPFEDSA-N 1 2 308.347 4.170 20 0 DIADLO CSCc1cc[nH+]c(NC2CCC(C(F)(F)F)CC2)c1 ZINC001156420461 1047711606 /nfs/dbraw/zinc/71/16/06/1047711606.db2.gz KTFMAYAVJHMPQE-UHFFFAOYSA-N 1 2 304.381 4.478 20 0 DIADLO Nc1cc(CNc2cc(Cl)nc3cc(Cl)ccc32)cc[nH+]1 ZINC001156755993 1047722011 /nfs/dbraw/zinc/72/20/11/1047722011.db2.gz MYHWOFUPWBXTNM-UHFFFAOYSA-N 1 2 319.195 4.131 20 0 DIADLO COc1cccc(CNc2cc(C)c3ccccc3[nH+]2)c1OC ZINC000052471838 1047723921 /nfs/dbraw/zinc/72/39/21/1047723921.db2.gz NOEVHCGIESWNSN-UHFFFAOYSA-N 1 2 308.381 4.173 20 0 DIADLO Clc1ccc2c(cc[nH+]c2NC2(C3CCOCC3)CC2)c1 ZINC001156917856 1047727341 /nfs/dbraw/zinc/72/73/41/1047727341.db2.gz LZIURVJNDLUQOU-UHFFFAOYSA-N 1 2 302.805 4.259 20 0 DIADLO CSc1cc[nH+]c(N2CCC[C@H]2c2c(F)cccc2F)c1 ZINC001156949310 1047730158 /nfs/dbraw/zinc/73/01/58/1047730158.db2.gz YFVKJKBUFOEALT-AWEZNQCLSA-N 1 2 306.381 4.423 20 0 DIADLO Cc1cc(N2CCC[C@H]2c2c(F)cccc2F)nc(C2CC2)[nH+]1 ZINC001156948489 1047730288 /nfs/dbraw/zinc/73/02/88/1047730288.db2.gz URSFCXVHSLOINQ-HNNXBMFYSA-N 1 2 315.367 4.282 20 0 DIADLO Cc1nc2[nH]ccc2c(NC2c3ccccc3-c3ccccc32)[nH+]1 ZINC001156966539 1047730930 /nfs/dbraw/zinc/73/09/30/1047730930.db2.gz MQAWPMUBQHKZEG-UHFFFAOYSA-N 1 2 312.376 4.448 20 0 DIADLO CC(C)c1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)c(F)c2)[nH]1 ZINC000539047216 1047731323 /nfs/dbraw/zinc/73/13/23/1047731323.db2.gz UFOKYNDLINKIAU-UWVGGRQHSA-N 1 2 310.804 4.132 20 0 DIADLO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1nc2ccccc2n1C ZINC000539163109 1047739428 /nfs/dbraw/zinc/73/94/28/1047739428.db2.gz BXTMNVIYNQDSJH-KCQAQPDRSA-N 1 2 309.413 4.141 20 0 DIADLO Fc1cc(Nc2ccccc2-n2cc[nH+]c2)cc(C(F)(F)F)n1 ZINC001213009168 1047745101 /nfs/dbraw/zinc/74/51/01/1047745101.db2.gz XSYGRYFOOHQDAR-UHFFFAOYSA-N 1 2 322.265 4.169 20 0 DIADLO Cc1ncc(CNc2cc(SCc3ccccc3)cc[nH+]2)cn1 ZINC001157604163 1047746535 /nfs/dbraw/zinc/74/65/35/1047746535.db2.gz PCUVXQHWCZDUMK-UHFFFAOYSA-N 1 2 322.437 4.084 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@H](c2ccccn2)C(F)(F)F)[nH+]1 ZINC001157684280 1047748923 /nfs/dbraw/zinc/74/89/23/1047748923.db2.gz MBMFJDCJQYAKLI-GFCCVEGCSA-N 1 2 315.726 4.462 20 0 DIADLO CC(C)(C)c1ccc(N[C@H](c2ccccn2)C(F)(F)F)[nH+]c1 ZINC001157685717 1047749209 /nfs/dbraw/zinc/74/92/09/1047749209.db2.gz CWJKNJDFLBCUBL-CQSZACIVSA-N 1 2 309.335 4.490 20 0 DIADLO Cc1c(CNc2ccc(Cl)c(N)[nH+]2)cccc1C(F)(F)F ZINC001157736758 1047751459 /nfs/dbraw/zinc/75/14/59/1047751459.db2.gz KUDFEUOEZACMNQ-UHFFFAOYSA-N 1 2 315.726 4.257 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)N(C)c1cc2[nH]ccc2c[nH+]1 ZINC001157755713 1047752372 /nfs/dbraw/zinc/75/23/72/1047752372.db2.gz HMLRFUSTKLCYDS-KRWDZBQOSA-N 1 2 307.397 4.051 20 0 DIADLO CC[C@@H](C)C[C@@H](C)Nc1cc([C@@H](CC(=O)OC)C2CC2)cc[nH+]1 ZINC001157885542 1047761798 /nfs/dbraw/zinc/76/17/98/1047761798.db2.gz BOUQGJPXRIVSTP-CPUCHLNUSA-N 1 2 318.461 4.375 20 0 DIADLO CCc1ccc(CC(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)cc1 ZINC000478010798 1047762982 /nfs/dbraw/zinc/76/29/82/1047762982.db2.gz UVDBNLCGWQJYTN-UHFFFAOYSA-N 1 2 319.408 4.129 20 0 DIADLO Cc1ccc([C@@H](C)Nc2[nH+]cnc3[nH]c4cc(F)ccc4c32)nc1 ZINC001158020427 1047768327 /nfs/dbraw/zinc/76/83/27/1047768327.db2.gz GHHBWBZRPUPNGZ-LLVKDONJSA-N 1 2 321.359 4.127 20 0 DIADLO Clc1ccc2c(cc[nH+]c2NCCc2cn3ccccc3n2)c1 ZINC001158144445 1047769583 /nfs/dbraw/zinc/76/95/83/1047769583.db2.gz AVYOXJRRBIQPCR-UHFFFAOYSA-N 1 2 322.799 4.191 20 0 DIADLO c1c(CCNc2cc(-c3ccccc3)cc[nH+]2)nc2ccccn12 ZINC001158144873 1047770143 /nfs/dbraw/zinc/77/01/43/1047770143.db2.gz JDEIGBXQMSCESD-UHFFFAOYSA-N 1 2 314.392 4.051 20 0 DIADLO Cc1cc(NCc2cc(F)cc3c2OCOC3)[nH+]c2ccccc12 ZINC001158223772 1047771606 /nfs/dbraw/zinc/77/16/06/1047771606.db2.gz FLVASQZTVXTHPI-UHFFFAOYSA-N 1 2 324.355 4.161 20 0 DIADLO C[C@H]1CN(c2ccc(C(C)(C)C)c[nH+]2)[C@@H](c2ccccc2)CO1 ZINC001158292490 1047773717 /nfs/dbraw/zinc/77/37/17/1047773717.db2.gz VZGHLDZSFNIALW-MAUKXSAKSA-N 1 2 310.441 4.346 20 0 DIADLO Cc1cc(NCc2c(Cl)cncc2Cl)nc(C(C)C)[nH+]1 ZINC001158303011 1047774041 /nfs/dbraw/zinc/77/40/41/1047774041.db2.gz VCFJKKVGWRLQRB-UHFFFAOYSA-N 1 2 311.216 4.222 20 0 DIADLO C[C@H]1C[C@H](Nc2cc(N3CCCCC3)nc[nH+]2)c2ccccc21 ZINC001158474916 1047784327 /nfs/dbraw/zinc/78/43/27/1047784327.db2.gz WEQFUHADPYGAOR-YOEHRIQHSA-N 1 2 308.429 4.127 20 0 DIADLO C[C@H]1C[C@H](Nc2cc(N3CCCCC3)[nH+]cn2)c2ccccc21 ZINC001158474916 1047784329 /nfs/dbraw/zinc/78/43/29/1047784329.db2.gz WEQFUHADPYGAOR-YOEHRIQHSA-N 1 2 308.429 4.127 20 0 DIADLO Cc1ccc(Nc2ccc(C(=O)OC(C)(C)C)cc2O)c(C)[nH+]1 ZINC001203380973 1047793831 /nfs/dbraw/zinc/79/38/31/1047793831.db2.gz OFHQBUXFIFPQQS-UHFFFAOYSA-N 1 2 314.385 4.103 20 0 DIADLO Cc1cc(N[C@@H]2CCc3ccccc3[C@H]2O)[nH+]c2ccccc12 ZINC001158686074 1047794338 /nfs/dbraw/zinc/79/43/38/1047794338.db2.gz WBGPEMSTJMBCCB-UYAOXDASSA-N 1 2 304.393 4.004 20 0 DIADLO Cc1cc2[nH]c(CNc3ccc(N4CCCC4)[nH+]c3)cc2c(C)c1 ZINC000478610254 1047799340 /nfs/dbraw/zinc/79/93/40/1047799340.db2.gz VJLWRWQSNQRJJD-UHFFFAOYSA-N 1 2 320.440 4.392 20 0 DIADLO CCSc1cc[nH+]c(N2CCc3cc(F)c(F)cc3C2)c1 ZINC001158809382 1047799645 /nfs/dbraw/zinc/79/96/45/1047799645.db2.gz VZHIXKHCGMTGAT-UHFFFAOYSA-N 1 2 306.381 4.035 20 0 DIADLO Cc1ccn2cc(CN(C)c3[nH+]ccc4c(C)cccc43)nc2c1 ZINC001158854185 1047801543 /nfs/dbraw/zinc/80/15/43/1047801543.db2.gz FQQCVGIRAGUFAK-UHFFFAOYSA-N 1 2 316.408 4.136 20 0 DIADLO Clc1cccc2c(NCCc3cn4ccccc4n3)cc[nH+]c12 ZINC000552911050 1047804871 /nfs/dbraw/zinc/80/48/71/1047804871.db2.gz IZWAPDBWTMSHEL-UHFFFAOYSA-N 1 2 322.799 4.191 20 0 DIADLO CCc1cc(OCc2ncc(Cl)s2)c2ccccc2[nH+]1 ZINC000478822914 1047818556 /nfs/dbraw/zinc/81/85/56/1047818556.db2.gz FSYHKYGTVDZHKY-UHFFFAOYSA-N 1 2 304.802 4.486 20 0 DIADLO CNc1ccc(Nc2cnc(OCc3ccccc3)cc2C)c[nH+]1 ZINC001159254404 1047823507 /nfs/dbraw/zinc/82/35/07/1047823507.db2.gz VDJDIBMZZALMOL-UHFFFAOYSA-N 1 2 320.396 4.149 20 0 DIADLO Nc1ccc(Nc2cc(F)cc(OCc3ccccc3)c2)c[nH+]1 ZINC001159280941 1047825708 /nfs/dbraw/zinc/82/57/08/1047825708.db2.gz IUWCIJXQJKTOLF-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO Nc1ccc(Nc2cccc(OCc3ccccc3F)c2)c[nH+]1 ZINC001159281410 1047825807 /nfs/dbraw/zinc/82/58/07/1047825807.db2.gz YAMHPGSDCWICDF-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO Cc1ccc(C)c([C@H]2CCCN2c2cc(N3CCCC3)[nH+]cn2)c1 ZINC000553149750 1047827229 /nfs/dbraw/zinc/82/72/29/1047827229.db2.gz KNPJSSCESNCWOG-GOSISDBHSA-N 1 2 322.456 4.035 20 0 DIADLO Cc1ccc(C)c([C@H]2CCCN2c2cc(N3CCCC3)nc[nH+]2)c1 ZINC000553149750 1047827235 /nfs/dbraw/zinc/82/72/35/1047827235.db2.gz KNPJSSCESNCWOG-GOSISDBHSA-N 1 2 322.456 4.035 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000479069699 1047834662 /nfs/dbraw/zinc/83/46/62/1047834662.db2.gz OJFSHUCTKAOXOI-AWEZNQCLSA-N 1 2 309.388 4.409 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000479069699 1047834668 /nfs/dbraw/zinc/83/46/68/1047834668.db2.gz OJFSHUCTKAOXOI-AWEZNQCLSA-N 1 2 309.388 4.409 20 0 DIADLO COc1ccc2c(c1)C[C@H](Nc1cc3ccccc3c[nH+]1)CC2 ZINC001159362257 1047835240 /nfs/dbraw/zinc/83/52/40/1047835240.db2.gz WPCUCBNXGNXAPM-GOSISDBHSA-N 1 2 304.393 4.213 20 0 DIADLO CC(C)C[C@@H](c1nc(CCCc2ccccc2)no1)n1cc[nH+]c1 ZINC000923806594 1047838519 /nfs/dbraw/zinc/83/85/19/1047838519.db2.gz PESHPYOVPQCPPM-KRWDZBQOSA-N 1 2 324.428 4.077 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cccc(OCc2ccccn2)c1)c1ncco1 ZINC000924715778 1047838538 /nfs/dbraw/zinc/83/85/38/1047838538.db2.gz POWRUCVMOKGTNB-GJZGRUSLSA-N 1 2 323.396 4.060 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@H]2CCc3ccc(Cl)nc32)c(F)c1 ZINC000927092837 1047840139 /nfs/dbraw/zinc/84/01/39/1047840139.db2.gz FSPJITFYOXKIDB-AWEZNQCLSA-N 1 2 308.759 4.099 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@@H]2CCc3c2nccc3Cl)c(F)c1 ZINC000927094383 1047841668 /nfs/dbraw/zinc/84/16/68/1047841668.db2.gz VJSJTFBTOXFHHY-OAHLLOKOSA-N 1 2 308.759 4.099 20 0 DIADLO CSC1(CNc2cc[nH+]c3c(Cl)cccc23)CCOCC1 ZINC000553411803 1047849732 /nfs/dbraw/zinc/84/97/32/1047849732.db2.gz JTTBSMSLMDZEKC-UHFFFAOYSA-N 1 2 322.861 4.212 20 0 DIADLO c1c[nH+]c(Nc2ccc(N3CCCC3)cc2)c(N2CCCCC2)c1 ZINC001174527228 1047857364 /nfs/dbraw/zinc/85/73/64/1047857364.db2.gz VRTQXMPVXCUPDY-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO C[C@H]([NH2+]Cc1c[nH]c(-c2ccccc2)n1)c1ccc(F)cc1F ZINC000553496298 1047861170 /nfs/dbraw/zinc/86/11/70/1047861170.db2.gz LLJIFTALLJBIJK-LBPRGKRZSA-N 1 2 313.351 4.206 20 0 DIADLO CCSc1cccc(C[N@@H+]2C[C@H](C)O[C@@](C)(C(F)F)C2)c1 ZINC001182969340 1047870001 /nfs/dbraw/zinc/87/00/01/1047870001.db2.gz HKKIEIIRKKRKHY-BLLLJJGKSA-N 1 2 315.429 4.043 20 0 DIADLO CCSc1cccc(C[N@H+]2C[C@H](C)O[C@@](C)(C(F)F)C2)c1 ZINC001182969340 1047870017 /nfs/dbraw/zinc/87/00/17/1047870017.db2.gz HKKIEIIRKKRKHY-BLLLJJGKSA-N 1 2 315.429 4.043 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@H+]2C[C@H](C)O[C@](C)(C(F)F)C2)cc1C ZINC001182970255 1047870365 /nfs/dbraw/zinc/87/03/65/1047870365.db2.gz LZCLVIOFGOQJLL-WENXUGBFSA-N 1 2 323.427 4.370 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@@H+]2C[C@H](C)O[C@](C)(C(F)F)C2)cc1C ZINC001182970255 1047870382 /nfs/dbraw/zinc/87/03/82/1047870382.db2.gz LZCLVIOFGOQJLL-WENXUGBFSA-N 1 2 323.427 4.370 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2ccccc2N)c[nH+]1 ZINC001159591906 1047876464 /nfs/dbraw/zinc/87/64/64/1047876464.db2.gz WBFFXVFDOYKGNF-UHFFFAOYSA-N 1 2 304.397 4.044 20 0 DIADLO Cn1ccc2ccc(Nc3ccc[nH+]c3N3CCCCC3)cc21 ZINC001174514884 1047876893 /nfs/dbraw/zinc/87/68/93/1047876893.db2.gz GGRRCSRAYJPZQV-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO CCNC(=O)Nc1ccc(Nc2ccc3c(C)cc[nH+]c3c2)cc1 ZINC001174521144 1047883347 /nfs/dbraw/zinc/88/33/47/1047883347.db2.gz HMLCXKUMMYEORJ-UHFFFAOYSA-N 1 2 320.396 4.428 20 0 DIADLO Cc1cnn(C2CCC2)c1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174522676 1047884095 /nfs/dbraw/zinc/88/40/95/1047884095.db2.gz SQLNRVFGLXMSDU-UHFFFAOYSA-N 1 2 311.433 4.045 20 0 DIADLO c1cc2ncc(Nc3ccc(N4CCCCC4)[nH+]c3)cc2s1 ZINC001174522609 1047884139 /nfs/dbraw/zinc/88/41/39/1047884139.db2.gz OQLOLBBOFHYYIK-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO CCC(=O)c1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)cc1 ZINC001174523315 1047884688 /nfs/dbraw/zinc/88/46/88/1047884688.db2.gz IGBWZTDNPQGAQE-UHFFFAOYSA-N 1 2 309.413 4.408 20 0 DIADLO Cc1cc(N)c(Cl)cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523210 1047885050 /nfs/dbraw/zinc/88/50/50/1047885050.db2.gz GPMLCSLUEXCZFL-UHFFFAOYSA-N 1 2 316.836 4.360 20 0 DIADLO Cc1c(Cl)cc(N)cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523846 1047887700 /nfs/dbraw/zinc/88/77/00/1047887700.db2.gz VFACRGKZMUISPW-UHFFFAOYSA-N 1 2 316.836 4.360 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1c(C2CC2)cnn1C ZINC000667482298 1047888437 /nfs/dbraw/zinc/88/84/37/1047888437.db2.gz ZLVUGOLVFBWJOR-UHFFFAOYSA-N 1 2 309.866 4.035 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1c(C2CC2)cnn1C ZINC000667482298 1047888454 /nfs/dbraw/zinc/88/84/54/1047888454.db2.gz ZLVUGOLVFBWJOR-UHFFFAOYSA-N 1 2 309.866 4.035 20 0 DIADLO CCOc1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)cc1F ZINC001174524169 1047888472 /nfs/dbraw/zinc/88/84/72/1047888472.db2.gz AONQSNOOAOLBPP-UHFFFAOYSA-N 1 2 315.392 4.353 20 0 DIADLO c1ncc(-c2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc2)o1 ZINC001174525197 1047888632 /nfs/dbraw/zinc/88/86/32/1047888632.db2.gz ZGEQNEBHYMSERU-UHFFFAOYSA-N 1 2 320.396 4.471 20 0 DIADLO C[C@H](Nc1[nH+]cnc2[nH]c3cc(F)ccc3c21)c1cccc(N)c1 ZINC001159641570 1047892737 /nfs/dbraw/zinc/89/27/37/1047892737.db2.gz IXKYKFJGBFLMJU-JTQLQIEISA-N 1 2 321.359 4.006 20 0 DIADLO COc1cc(Nc2cc(Cl)c3[nH+]ccn3c2)cc(F)c1F ZINC001174582425 1047892595 /nfs/dbraw/zinc/89/25/95/1047892595.db2.gz QGJKKGJEXVJWDM-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO Cc1c(Cl)cccc1C[N@@H+]1CCC[C@@]1(C)C(=O)OC(C)(C)C ZINC001183179855 1047899736 /nfs/dbraw/zinc/89/97/36/1047899736.db2.gz JQEHYGMREIAVQJ-SFHVURJKSA-N 1 2 323.864 4.345 20 0 DIADLO Cc1c(Cl)cccc1C[N@H+]1CCC[C@@]1(C)C(=O)OC(C)(C)C ZINC001183179855 1047899753 /nfs/dbraw/zinc/89/97/53/1047899753.db2.gz JQEHYGMREIAVQJ-SFHVURJKSA-N 1 2 323.864 4.345 20 0 DIADLO COc1cc(Nc2cc[nH+]c3cc(Cl)ccc23)cnc1OC ZINC001174545986 1047901856 /nfs/dbraw/zinc/90/18/56/1047901856.db2.gz FKGAKKAOOQITQZ-UHFFFAOYSA-N 1 2 315.760 4.044 20 0 DIADLO Clc1ccc2c(NC3=CCC4(CC3)OCCO4)cc[nH+]c2c1 ZINC001174638293 1047917400 /nfs/dbraw/zinc/91/74/00/1047917400.db2.gz SQBQUHAKXCYJDE-UHFFFAOYSA-N 1 2 316.788 4.111 20 0 DIADLO CCCCC[C@H](CC)C(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000775816053 1047923760 /nfs/dbraw/zinc/92/37/60/1047923760.db2.gz MJQBVVBLLGHGCN-INIZCTEOSA-N 1 2 313.445 4.095 20 0 DIADLO COc1cc(C)[nH+]c(CN2CCCCc3cc(Cl)ccc32)c1 ZINC001174605136 1047924394 /nfs/dbraw/zinc/92/43/94/1047924394.db2.gz VLDYBXZCZLFFPW-UHFFFAOYSA-N 1 2 316.832 4.395 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cccc2c1NCCC2 ZINC001183491436 1047929839 /nfs/dbraw/zinc/92/98/39/1047929839.db2.gz PMGQZBGBCRBCKJ-UHFFFAOYSA-N 1 2 313.470 4.305 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@H]2CCc3ccc(O)cc3C2)[nH+]1 ZINC001159892972 1047941700 /nfs/dbraw/zinc/94/17/00/1047941700.db2.gz JSVRFWGWLSDAQE-AWEZNQCLSA-N 1 2 302.805 4.027 20 0 DIADLO CCCC[N@H+](Cc1cn(C2CCC2)nn1)[C@@H](C)c1ccc(C)o1 ZINC000667526572 1047945044 /nfs/dbraw/zinc/94/50/44/1047945044.db2.gz KZXYPXHQAKMTMJ-HNNXBMFYSA-N 1 2 316.449 4.268 20 0 DIADLO CCCC[N@@H+](Cc1cn(C2CCC2)nn1)[C@@H](C)c1ccc(C)o1 ZINC000667526572 1047945058 /nfs/dbraw/zinc/94/50/58/1047945058.db2.gz KZXYPXHQAKMTMJ-HNNXBMFYSA-N 1 2 316.449 4.268 20 0 DIADLO Cc1cc(Nc2cc(N)ccc2Br)ccc1[NH+](C)C ZINC001159926405 1047952290 /nfs/dbraw/zinc/95/22/90/1047952290.db2.gz QLJLGEHULWJLGU-UHFFFAOYSA-N 1 2 320.234 4.149 20 0 DIADLO C[C@H]1CCOCC[N@@H+]1Cn1c(-c2ccccc2)csc1=S ZINC000774661088 1047953598 /nfs/dbraw/zinc/95/35/98/1047953598.db2.gz SHHMERPECZCGBA-ZDUSSCGKSA-N 1 2 320.483 4.014 20 0 DIADLO C[C@H]1CCOCC[N@H+]1Cn1c(-c2ccccc2)csc1=S ZINC000774661088 1047953607 /nfs/dbraw/zinc/95/36/07/1047953607.db2.gz SHHMERPECZCGBA-ZDUSSCGKSA-N 1 2 320.483 4.014 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2ccc(O)c(F)c2)cc[nH+]1 ZINC001174733185 1047956691 /nfs/dbraw/zinc/95/66/91/1047956691.db2.gz PMUYIXJFAZISKG-UHFFFAOYSA-N 1 2 319.336 4.017 20 0 DIADLO CCO[C@H]1CCC[N@H+](Cc2ccc(F)c(Cl)c2Cl)C1 ZINC001204146511 1047956930 /nfs/dbraw/zinc/95/69/30/1047956930.db2.gz VSYYOYNUHAWKQI-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@H]1CCC[N@@H+](Cc2ccc(F)c(Cl)c2Cl)C1 ZINC001204146511 1047956940 /nfs/dbraw/zinc/95/69/40/1047956940.db2.gz VSYYOYNUHAWKQI-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO CCc1cccc(CC)c1NC(=O)[C@@H]1CC[N@@H+]1Cc1ccccc1 ZINC001183750647 1047963821 /nfs/dbraw/zinc/96/38/21/1047963821.db2.gz FTXMTUUPELPABN-IBGZPJMESA-N 1 2 322.452 4.024 20 0 DIADLO CCc1cccc(CC)c1NC(=O)[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC001183750647 1047963829 /nfs/dbraw/zinc/96/38/29/1047963829.db2.gz FTXMTUUPELPABN-IBGZPJMESA-N 1 2 322.452 4.024 20 0 DIADLO Cc1cc(C)cc(C2CC[NH+]([C@@H](C)c3csnn3)CC2)c1 ZINC001198478825 1047966785 /nfs/dbraw/zinc/96/67/85/1047966785.db2.gz KFLHJQCTXDCVAX-AWEZNQCLSA-N 1 2 301.459 4.096 20 0 DIADLO Oc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(F)c(F)c2F)cc1 ZINC000667554847 1047969835 /nfs/dbraw/zinc/96/98/35/1047969835.db2.gz GYGGVSRLJXKWCH-OAHLLOKOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc([C@H]2CCC[N@H+]2Cc2ccc(F)c(F)c2F)cc1 ZINC000667554847 1047969845 /nfs/dbraw/zinc/96/98/45/1047969845.db2.gz GYGGVSRLJXKWCH-OAHLLOKOSA-N 1 2 307.315 4.147 20 0 DIADLO CCCc1nc(C[N@H+](Cc2ccc(C)cc2)C(C)(C)C)no1 ZINC001174781652 1047972453 /nfs/dbraw/zinc/97/24/53/1047972453.db2.gz YJXPDRMCSQEMDR-UHFFFAOYSA-N 1 2 301.434 4.131 20 0 DIADLO CCCc1nc(C[N@@H+](Cc2ccc(C)cc2)C(C)(C)C)no1 ZINC001174781652 1047972461 /nfs/dbraw/zinc/97/24/61/1047972461.db2.gz YJXPDRMCSQEMDR-UHFFFAOYSA-N 1 2 301.434 4.131 20 0 DIADLO COc1ccc([C@H](C)CC(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)cc1 ZINC000479782338 1047973008 /nfs/dbraw/zinc/97/30/08/1047973008.db2.gz UQRONDSVAIPXHR-GFCCVEGCSA-N 1 2 323.396 4.012 20 0 DIADLO CC[N@H+](Cc1cn(C2CCC2)nn1)[C@@H](C)c1cc2ccccc2o1 ZINC000667554143 1047974765 /nfs/dbraw/zinc/97/47/65/1047974765.db2.gz KRPRYRANRQFWIC-AWEZNQCLSA-N 1 2 324.428 4.332 20 0 DIADLO CC[N@@H+](Cc1cn(C2CCC2)nn1)[C@@H](C)c1cc2ccccc2o1 ZINC000667554143 1047974779 /nfs/dbraw/zinc/97/47/79/1047974779.db2.gz KRPRYRANRQFWIC-AWEZNQCLSA-N 1 2 324.428 4.332 20 0 DIADLO CC(C)(C)OC(=O)Nc1ccc(Nc2ccn3cc[nH+]c3c2)cc1 ZINC001160027642 1047975144 /nfs/dbraw/zinc/97/51/44/1047975144.db2.gz LPUNZZXUKLJEKG-UHFFFAOYSA-N 1 2 324.384 4.425 20 0 DIADLO CCOc1cc(Br)ccc1Nc1ccc(NC)[nH+]c1 ZINC001160033368 1047975820 /nfs/dbraw/zinc/97/58/20/1047975820.db2.gz HWVBXSPXMDKYFM-UHFFFAOYSA-N 1 2 322.206 4.028 20 0 DIADLO CC(C)c1ccc(NC(=S)Nc2cccc3[nH+]ccn32)cc1 ZINC001198588475 1047979391 /nfs/dbraw/zinc/97/93/91/1047979391.db2.gz UKBHZIZGFBJKOP-UHFFFAOYSA-N 1 2 310.426 4.267 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3CCO[C@H](c4cccs4)C3)cc21 ZINC000667561833 1047981859 /nfs/dbraw/zinc/98/18/59/1047981859.db2.gz JIBXJZNRRREJBY-KRWDZBQOSA-N 1 2 312.438 4.111 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3CCO[C@H](c4cccs4)C3)cc21 ZINC000667561833 1047981876 /nfs/dbraw/zinc/98/18/76/1047981876.db2.gz JIBXJZNRRREJBY-KRWDZBQOSA-N 1 2 312.438 4.111 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)s2)nc1 ZINC001198597637 1047982284 /nfs/dbraw/zinc/98/22/84/1047982284.db2.gz WDYQGUZZLICXHE-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)s2)nc1 ZINC001198597637 1047982291 /nfs/dbraw/zinc/98/22/91/1047982291.db2.gz WDYQGUZZLICXHE-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO CC(C)(CC1CCC1)C(=O)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001183926674 1047984335 /nfs/dbraw/zinc/98/43/35/1047984335.db2.gz ZGRXEMDGGQBPTP-UHFFFAOYSA-N 1 2 311.429 4.086 20 0 DIADLO CC1CCC([NH2+][C@@H](Cc2ccccc2)C(=O)OC(C)(C)C)CC1 ZINC001184024245 1047990005 /nfs/dbraw/zinc/99/00/05/1047990005.db2.gz YCPDVMUWWYYKLI-VJFUWPCTSA-N 1 2 317.473 4.108 20 0 DIADLO COC1(C(F)(F)F)C[NH+](CC2CCC3(CCCCC3)CC2)C1 ZINC001184012576 1047990929 /nfs/dbraw/zinc/99/09/29/1047990929.db2.gz NLRLBHNMAPGVHY-UHFFFAOYSA-N 1 2 319.411 4.390 20 0 DIADLO CN(C)c1ccc(Nc2ccc(Oc3cccnc3)cc2)c[nH+]1 ZINC001174846314 1047997361 /nfs/dbraw/zinc/99/73/61/1047997361.db2.gz FLEAWKYRARCWLS-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO c1cn2ccc(Nc3ccc(Oc4cccnc4)cc3)cc2[nH+]1 ZINC001174849282 1047998189 /nfs/dbraw/zinc/99/81/89/1047998189.db2.gz OEPVUUVFQDCQQN-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO Cc1ccc(Cl)cc1C[NH2+][C@H](c1nnc[nH]1)C1CCCCC1 ZINC001184153295 1047999169 /nfs/dbraw/zinc/99/91/69/1047999169.db2.gz DTPXQEIOZXVUSX-INIZCTEOSA-N 1 2 318.852 4.178 20 0 DIADLO CNc1ccc(Nc2cc(F)c(OCC3CCC3)c(F)c2)c[nH+]1 ZINC001160241068 1048009393 /nfs/dbraw/zinc/00/93/93/1048009393.db2.gz HEOQLVMBLGPNIW-UHFFFAOYSA-N 1 2 319.355 4.324 20 0 DIADLO CCOC(=O)[C@@H](c1ccccc1)[N@@H+]1CCC[C@H]1c1cccs1 ZINC000554172166 1048026738 /nfs/dbraw/zinc/02/67/38/1048026738.db2.gz UVMFDZBJIFXKNC-DOTOQJQBSA-N 1 2 315.438 4.189 20 0 DIADLO CCOC(=O)[C@@H](c1ccccc1)[N@H+]1CCC[C@H]1c1cccs1 ZINC000554172166 1048026750 /nfs/dbraw/zinc/02/67/50/1048026750.db2.gz UVMFDZBJIFXKNC-DOTOQJQBSA-N 1 2 315.438 4.189 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)cc1OC)Cc1cc(F)ccc1F ZINC000554185314 1048028277 /nfs/dbraw/zinc/02/82/77/1048028277.db2.gz IUIVHZSBGWSIQI-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@H+](Cc1ccc(OC)cc1OC)Cc1cc(F)ccc1F ZINC000554185314 1048028291 /nfs/dbraw/zinc/02/82/91/1048028291.db2.gz IUIVHZSBGWSIQI-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1ccccc1C(C)(C)C)n1cc[nH+]c1 ZINC001174932088 1048035301 /nfs/dbraw/zinc/03/53/01/1048035301.db2.gz ZRAPGIWBSJGONC-QGZVFWFLSA-N 1 2 313.445 4.407 20 0 DIADLO CC1(C)Cc2n[nH]cc2C[N@@H+](Cc2cccc(Cl)c2Cl)C1 ZINC001174976295 1048035781 /nfs/dbraw/zinc/03/57/81/1048035781.db2.gz XMPCLARRAMKFBC-UHFFFAOYSA-N 1 2 324.255 4.301 20 0 DIADLO CC1(C)Cc2n[nH]cc2C[N@H+](Cc2cccc(Cl)c2Cl)C1 ZINC001174976295 1048035794 /nfs/dbraw/zinc/03/57/94/1048035794.db2.gz XMPCLARRAMKFBC-UHFFFAOYSA-N 1 2 324.255 4.301 20 0 DIADLO Cc1cc(CNc2[nH+]c3ccccc3n2CC2CC2)cc(C)c1O ZINC001184463253 1048043832 /nfs/dbraw/zinc/04/38/32/1048043832.db2.gz YYYNXSKMFWFUKB-UHFFFAOYSA-N 1 2 321.424 4.381 20 0 DIADLO C[C@](CO)(Nc1cc(-c2ccccc2)cc[nH+]1)c1ccccc1 ZINC001160434402 1048050846 /nfs/dbraw/zinc/05/08/46/1048050846.db2.gz GKVONMAQKURBST-HXUWFJFHSA-N 1 2 304.393 4.068 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)cc1 ZINC000554309828 1048065898 /nfs/dbraw/zinc/06/58/98/1048065898.db2.gz WUZITCCPYUIPNC-KRWDZBQOSA-N 1 2 314.454 4.078 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)cc1 ZINC000554309828 1048065914 /nfs/dbraw/zinc/06/59/14/1048065914.db2.gz WUZITCCPYUIPNC-KRWDZBQOSA-N 1 2 314.454 4.078 20 0 DIADLO CC(C)(C)c1ccc(N[C@H](c2ccccc2)C2(O)CCC2)[nH+]c1 ZINC001160544510 1048066511 /nfs/dbraw/zinc/06/65/11/1048066511.db2.gz VPFTVZCZROTKBM-GOSISDBHSA-N 1 2 310.441 4.447 20 0 DIADLO CCOc1ccc(NCc2c[nH+]c3ccc(C)cn23)cc1Cl ZINC001199448459 1048067112 /nfs/dbraw/zinc/06/71/12/1048067112.db2.gz CNUXSVOYFZTYHG-UHFFFAOYSA-N 1 2 315.804 4.307 20 0 DIADLO Cc1cc(C(C)C)nc(N[C@@H](C)c2c[nH+]c3c(C)cccn23)n1 ZINC001160689107 1048077853 /nfs/dbraw/zinc/07/78/53/1048077853.db2.gz XUZBLIFVXBSTCI-AWEZNQCLSA-N 1 2 309.417 4.038 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3nc4cnccc4cc3C)c[nH+]c12 ZINC001160689129 1048078740 /nfs/dbraw/zinc/07/87/40/1048078740.db2.gz YAHOJCPWPJPSCI-AWEZNQCLSA-N 1 2 317.396 4.067 20 0 DIADLO COc1ccc(Nc2cccn3cc[nH+]c23)cc1C(F)(F)F ZINC001175069517 1048083169 /nfs/dbraw/zinc/08/31/69/1048083169.db2.gz RMXQEAKAHGHZAU-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO Cc1ccc(Nc2[nH+]cccc2N2CCOCC2)c2ccccc12 ZINC001174988385 1048083505 /nfs/dbraw/zinc/08/35/05/1048083505.db2.gz PJMBBNYFFIINKV-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO Cc1cc(Cl)c(C)c(NCc2ccc(C3OCCO3)cc2)[nH+]1 ZINC001160815889 1048087219 /nfs/dbraw/zinc/08/72/19/1048087219.db2.gz WSFJSYUUPOGKOH-UHFFFAOYSA-N 1 2 318.804 4.009 20 0 DIADLO FC(F)(F)c1cnc(Cl)c(Nc2cccc3[nH+]c[nH]c32)c1 ZINC001213027054 1048093155 /nfs/dbraw/zinc/09/31/55/1048093155.db2.gz GQPVQPFWUVUJJN-UHFFFAOYSA-N 1 2 312.682 4.374 20 0 DIADLO COc1ccc(-c2ccc(Nc3cccc4[nH+]c[nH]c43)cn2)cc1 ZINC001213027028 1048093244 /nfs/dbraw/zinc/09/32/44/1048093244.db2.gz FLLLYGAYSNBZSP-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO Fc1ccc(F)c(Nc2cccc(Cn3cc[nH+]c3)c2)c1F ZINC001175029180 1048096616 /nfs/dbraw/zinc/09/66/16/1048096616.db2.gz VQKJBHJMUYXREM-UHFFFAOYSA-N 1 2 303.287 4.092 20 0 DIADLO CSc1cc[nH+]c(NCc2nccc(Cl)c2Cl)c1 ZINC001160932105 1048098813 /nfs/dbraw/zinc/09/88/13/1048098813.db2.gz SGRXKUIZLXRJNA-UHFFFAOYSA-N 1 2 300.214 4.117 20 0 DIADLO CCOc1ccc(Nc2c[nH+]ccc2OC)cc1C(F)(F)F ZINC001175033456 1048100509 /nfs/dbraw/zinc/10/05/09/1048100509.db2.gz UNEOHJZUKOMQQO-UHFFFAOYSA-N 1 2 312.291 4.251 20 0 DIADLO FC(F)(F)c1cc(Nc2cccc3[nH+]c[nH]c32)cnc1Cl ZINC001213028810 1048101146 /nfs/dbraw/zinc/10/11/46/1048101146.db2.gz YDZLZAURDMSQNH-UHFFFAOYSA-N 1 2 312.682 4.374 20 0 DIADLO FC(F)(F)c1cc(Nc2cccc3[nH+]c[nH]c32)cc(Cl)n1 ZINC001213028602 1048102098 /nfs/dbraw/zinc/10/20/98/1048102098.db2.gz SWIDPHFXMILBNC-UHFFFAOYSA-N 1 2 312.682 4.374 20 0 DIADLO Cc1ccnc2c(Nc3ccc[nH+]c3N3CCCC3)cccc12 ZINC001184963807 1048105176 /nfs/dbraw/zinc/10/51/76/1048105176.db2.gz AFCHQASCTIGKSV-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO Fc1cc2cccnc2c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001184963904 1048105912 /nfs/dbraw/zinc/10/59/12/1048105912.db2.gz GNOCXKQDEOUUEY-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO CCOc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)cc1F ZINC001175069384 1048106624 /nfs/dbraw/zinc/10/66/24/1048106624.db2.gz UXHXGYNJHLPGBW-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO Fc1cc(F)c(Cl)c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001184968571 1048107875 /nfs/dbraw/zinc/10/78/75/1048107875.db2.gz QFWSYPOBRWNQKY-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO CCOc1cc(F)c(Nc2cccn3cc(C)[nH+]c23)cc1F ZINC001175054213 1048112510 /nfs/dbraw/zinc/11/25/10/1048112510.db2.gz BZSYOXAFTKFRSY-UHFFFAOYSA-N 1 2 303.312 4.063 20 0 DIADLO CCc1ncc(Br)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213030603 1048113276 /nfs/dbraw/zinc/11/32/76/1048113276.db2.gz IHRINJNJOQKESR-UHFFFAOYSA-N 1 2 317.190 4.026 20 0 DIADLO c1[nH]c2c(cccc2Nc2ccc(Oc3ccncc3)cc2)[nH+]1 ZINC001213030623 1048113706 /nfs/dbraw/zinc/11/37/06/1048113706.db2.gz JKHKCDKUWHFDQV-UHFFFAOYSA-N 1 2 302.337 4.494 20 0 DIADLO Fc1ccc(Nc2cccc3[nH+]c[nH]c32)c(Br)c1F ZINC001213031843 1048117330 /nfs/dbraw/zinc/11/73/30/1048117330.db2.gz PDKWLCTWWGFGSK-UHFFFAOYSA-N 1 2 324.128 4.347 20 0 DIADLO COc1cc(Nc2cccc3[nH+]c[nH]c32)cc(C(F)(F)F)c1 ZINC001213031657 1048119672 /nfs/dbraw/zinc/11/96/72/1048119672.db2.gz LOPHSFUTWWPHAA-UHFFFAOYSA-N 1 2 307.275 4.334 20 0 DIADLO CC(C)Oc1ccc(F)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001185042801 1048122701 /nfs/dbraw/zinc/12/27/01/1048122701.db2.gz JRJBCAYKJGHEER-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO COc1ccc(F)c(Nc2ccc[nH+]c2N2CCCCC2)c1F ZINC001175116280 1048124658 /nfs/dbraw/zinc/12/46/58/1048124658.db2.gz MGYZFSPMSIJZIT-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO COC(=O)c1cc2cc(Nc3cccc4[nH+]c[nH]c43)ccc2s1 ZINC001213032444 1048127295 /nfs/dbraw/zinc/12/72/95/1048127295.db2.gz GFZTUSKIBZAPAB-UHFFFAOYSA-N 1 2 323.377 4.308 20 0 DIADLO Cc1cc(O)c(Nc2cccc3[nH+]c[nH]c32)cc1Br ZINC001213032796 1048130783 /nfs/dbraw/zinc/13/07/83/1048130783.db2.gz YDDHKWFFROHXIT-UHFFFAOYSA-N 1 2 318.174 4.083 20 0 DIADLO O=c1cc(Oc2ccc(Nc3cccc4[nH+]c[nH]c43)cc2)cc[nH]1 ZINC001213032768 1048130899 /nfs/dbraw/zinc/13/08/99/1048130899.db2.gz XATAVDVIHYDBEL-UHFFFAOYSA-N 1 2 318.336 4.199 20 0 DIADLO CCc1ccc(-c2ccc(NCc3c[nH+]cn3C(C)C)nn2)cc1 ZINC001161569871 1048140269 /nfs/dbraw/zinc/14/02/69/1048140269.db2.gz SFEJDBURJPENMZ-UHFFFAOYSA-N 1 2 321.428 4.096 20 0 DIADLO Cc1nc(NCc2cncn2C(C)C)cc(C2CCCCC2)[nH+]1 ZINC001161570445 1048140834 /nfs/dbraw/zinc/14/08/34/1048140834.db2.gz XFJWTJZOPIVQAZ-UHFFFAOYSA-N 1 2 313.449 4.222 20 0 DIADLO COC(=O)c1ccc2cc(Nc3cccc4[nH+]c[nH]c43)ccc2c1 ZINC001213033659 1048143184 /nfs/dbraw/zinc/14/31/84/1048143184.db2.gz QWYBBKMWOAPSIA-UHFFFAOYSA-N 1 2 317.348 4.246 20 0 DIADLO Cc1ccccc1[C@@H](CC(C)C)NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000567392446 1048143377 /nfs/dbraw/zinc/14/33/77/1048143377.db2.gz RBSLRJWBJPWQLG-SJLPKXTDSA-N 1 2 313.445 4.046 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@H+]1Cc1ccc2ncccc2c1 ZINC000794435561 1048143468 /nfs/dbraw/zinc/14/34/68/1048143468.db2.gz PRBQYFJTYYYVRF-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@@H+]1Cc1ccc2ncccc2c1 ZINC000794435561 1048143470 /nfs/dbraw/zinc/14/34/70/1048143470.db2.gz PRBQYFJTYYYVRF-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO CC(C)Sc1ccc([C@H](C)[NH2+][C@@H](C)c2ncccn2)cc1 ZINC000930214302 1048146494 /nfs/dbraw/zinc/14/64/94/1048146494.db2.gz AZCXGEHSUJGQHT-KBPBESRZSA-N 1 2 301.459 4.389 20 0 DIADLO CC[C@@H](Cc1ccccc1)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001185220943 1048149206 /nfs/dbraw/zinc/14/92/06/1048149206.db2.gz GLYFYPIAEOOAEX-HNNXBMFYSA-N 1 2 323.444 4.015 20 0 DIADLO CCCCn1ncc(NCc2cccc3[nH+]ccn32)c1C(C)C ZINC000480481410 1048150787 /nfs/dbraw/zinc/15/07/87/1048150787.db2.gz ZSCLKCDEQLTHNT-UHFFFAOYSA-N 1 2 311.433 4.066 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1cccc(C(F)(F)F)c1F ZINC001175134070 1048159367 /nfs/dbraw/zinc/15/93/67/1048159367.db2.gz HKZXXHZRXXTMGF-UHFFFAOYSA-N 1 2 309.266 4.074 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cccc(C(F)(F)F)c3F)ccc21 ZINC001175137278 1048161188 /nfs/dbraw/zinc/16/11/88/1048161188.db2.gz MGDCMFCCSVRQDL-UHFFFAOYSA-N 1 2 309.266 4.475 20 0 DIADLO FC(F)(F)c1c[nH]c2[nH+]ccc(NC3Cc4ccccc4C3)c12 ZINC001161762883 1048165493 /nfs/dbraw/zinc/16/54/93/1048165493.db2.gz SNTQEAWKKVVDBG-UHFFFAOYSA-N 1 2 317.314 4.161 20 0 DIADLO Cc1cc(NC[C@H]2CCCO[C@@H]2C(C)(C)C)nc(C2CCC2)[nH+]1 ZINC001185386952 1048170463 /nfs/dbraw/zinc/17/04/63/1048170463.db2.gz LOMOXYZQJMFVRD-WBVHZDCISA-N 1 2 317.477 4.306 20 0 DIADLO COc1ncccc1[C@H](Nc1ccc(C(C)(C)C)c[nH+]1)C1CC1 ZINC001161794339 1048172750 /nfs/dbraw/zinc/17/27/50/1048172750.db2.gz OSSAWLSFZAUXQV-QGZVFWFLSA-N 1 2 311.429 4.346 20 0 DIADLO CC(C)Cn1cnc(CNc2cc(-c3ccccc3)cc[nH+]2)c1 ZINC001161793390 1048173910 /nfs/dbraw/zinc/17/39/10/1048173910.db2.gz FIJNRZLMNGTUJH-UHFFFAOYSA-N 1 2 306.413 4.213 20 0 DIADLO Cc1nc(N[C@@H](c2cncc(F)c2)C2CC2)cc(C(C)C)[nH+]1 ZINC001161812026 1048175382 /nfs/dbraw/zinc/17/53/82/1048175382.db2.gz MLCKINOZBIVGIN-QGZVFWFLSA-N 1 2 300.381 4.006 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@@H](c2cncc(F)c2)C2CC2)[nH+]1 ZINC001161815066 1048176742 /nfs/dbraw/zinc/17/67/42/1048176742.db2.gz MDNUPTMXELUBEK-OAHLLOKOSA-N 1 2 305.784 4.449 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000480564298 1048181647 /nfs/dbraw/zinc/18/16/47/1048181647.db2.gz RVMFLCYXUGSATQ-DGCLKSJQSA-N 1 2 324.346 4.329 20 0 DIADLO COCc1cc[nH+]c(NC2(CC3CC3)CCC(F)(F)CC2)c1 ZINC001161897364 1048191039 /nfs/dbraw/zinc/19/10/39/1048191039.db2.gz GFQYUVZRLWXTMH-UHFFFAOYSA-N 1 2 310.388 4.388 20 0 DIADLO Nc1[nH+]c(NC2(CC3CC3)CCC(F)(F)CC2)ccc1Cl ZINC001161901018 1048191649 /nfs/dbraw/zinc/19/16/49/1048191649.db2.gz NECGCVMSXBJDCX-UHFFFAOYSA-N 1 2 315.795 4.477 20 0 DIADLO CSc1cc(Nc2cccc(O[C@H]3CCCCO3)c2)cc[nH+]1 ZINC001175187965 1048192304 /nfs/dbraw/zinc/19/23/04/1048192304.db2.gz PBRDBNCGVZKQAE-KRWDZBQOSA-N 1 2 316.426 4.453 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CCN2c2cc(CC)[nH+]c(C)n2)o1 ZINC001185526380 1048192792 /nfs/dbraw/zinc/19/27/92/1048192792.db2.gz AKAMQJXLHLOTRN-CXAGYDPISA-N 1 2 313.445 4.480 20 0 DIADLO CCOc1ccc(OC)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001175212979 1048196814 /nfs/dbraw/zinc/19/68/14/1048196814.db2.gz OUEMZZDLIWOOJV-UHFFFAOYSA-N 1 2 323.396 4.082 20 0 DIADLO CN(C)c1cc(Cl)[nH+]c(N[C@H](c2ccccc2)C2CC2)c1 ZINC001161954693 1048197853 /nfs/dbraw/zinc/19/78/53/1048197853.db2.gz GRRBCDJGESGHAH-QGZVFWFLSA-N 1 2 301.821 4.364 20 0 DIADLO C[C@H](CCc1ccccc1)Nc1nc2ccccc2n2c[nH+]cc12 ZINC001161984922 1048207187 /nfs/dbraw/zinc/20/71/87/1048207187.db2.gz VWHHIRTVAANVPQ-OAHLLOKOSA-N 1 2 316.408 4.316 20 0 DIADLO Clc1cccc(CNc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001161984491 1048208252 /nfs/dbraw/zinc/20/82/52/1048208252.db2.gz ACEMBOJFWTVTPB-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO CC(C)Oc1cc(NCc2cccc(OC(F)F)c2)cc[nH+]1 ZINC001161987607 1048210142 /nfs/dbraw/zinc/21/01/42/1048210142.db2.gz VLGTWQOQFWSYPI-UHFFFAOYSA-N 1 2 308.328 4.082 20 0 DIADLO C=Cc1ccc(NCC2(CCOC)CCC(F)(F)CC2)[nH+]c1 ZINC001162008263 1048213694 /nfs/dbraw/zinc/21/36/94/1048213694.db2.gz VHUBTINUGNDVBJ-UHFFFAOYSA-N 1 2 310.388 4.369 20 0 DIADLO Cc1cc(Oc2ccc(NC(=O)Nc3cccnc3)cc2)cc[nH+]1 ZINC001185695985 1048214549 /nfs/dbraw/zinc/21/45/49/1048214549.db2.gz SWYHRIFJDZHESC-UHFFFAOYSA-N 1 2 320.352 4.221 20 0 DIADLO FC(F)(F)c1cncc(CCCNc2cc3cc[nH]c3c[nH+]2)c1 ZINC001162039871 1048218095 /nfs/dbraw/zinc/21/80/95/1048218095.db2.gz WUONZDCJWOIILN-UHFFFAOYSA-N 1 2 320.318 4.021 20 0 DIADLO CN(c1ccccc1NCc1cccc2[nH+]ccn21)C1CCCC1 ZINC001201226841 1048219889 /nfs/dbraw/zinc/21/98/89/1048219889.db2.gz KRKYJQRELRKYMX-UHFFFAOYSA-N 1 2 320.440 4.325 20 0 DIADLO CCOc1ccc(F)c(F)c1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001175278057 1048225740 /nfs/dbraw/zinc/22/57/40/1048225740.db2.gz FAQPSBAQUFARME-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO CCOc1ccc(F)c(F)c1Nc1ccccc1-n1cc[nH+]c1 ZINC001175278089 1048225964 /nfs/dbraw/zinc/22/59/64/1048225964.db2.gz GVHZVFYJXPKVRS-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO CCOc1ccc(F)c(F)c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175278691 1048226754 /nfs/dbraw/zinc/22/67/54/1048226754.db2.gz VGMYPHXHBGOMTR-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO Cc1cc(Br)cc(Cl)c1Nc1ccc(N)[nH+]c1 ZINC001201284734 1048226850 /nfs/dbraw/zinc/22/68/50/1048226850.db2.gz ZBQXAMHGYMUMJG-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO Cc1c(Cl)c(Br)ccc1Nc1ccc(N)[nH+]c1 ZINC001201287098 1048229286 /nfs/dbraw/zinc/22/92/86/1048229286.db2.gz STYOSUPADUPTNJ-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO Nc1ccc(Nc2c(Cl)nc(Cl)cc2C(F)(F)F)c[nH+]1 ZINC001201273047 1048230966 /nfs/dbraw/zinc/23/09/66/1048230966.db2.gz ZULJWUYVSNFKAU-UHFFFAOYSA-N 1 2 323.105 4.128 20 0 DIADLO Cc1ccc(Nc2ccc(N)[nH+]c2)cc1NC(=O)OC(C)(C)C ZINC001201300448 1048233056 /nfs/dbraw/zinc/23/30/56/1048233056.db2.gz RNDPXQMIVMTDIQ-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO Clc1cncc(Cl)c1CNc1cccc(-n2cc[nH+]c2)c1 ZINC001201357840 1048240259 /nfs/dbraw/zinc/24/02/59/1048240259.db2.gz VCTNCDOCQVFVKL-UHFFFAOYSA-N 1 2 319.195 4.186 20 0 DIADLO Clc1cscc1C[NH2+][C@H]1COc2ccc(Cl)cc21 ZINC001201372144 1048241135 /nfs/dbraw/zinc/24/11/35/1048241135.db2.gz BJQXPHPZEPJFHC-LBPRGKRZSA-N 1 2 300.210 4.278 20 0 DIADLO CCc1nc(N2CC=C(c3cccc4ccccc43)C2)cc(C)[nH+]1 ZINC001185931244 1048245110 /nfs/dbraw/zinc/24/51/10/1048245110.db2.gz RWXGQKJDHIODFL-UHFFFAOYSA-N 1 2 315.420 4.404 20 0 DIADLO CN(C)c1ccc(Nc2cccnc2Oc2ccc(F)cc2)c[nH+]1 ZINC001175341914 1048250054 /nfs/dbraw/zinc/25/00/54/1048250054.db2.gz WVPRRTLHAOPMBX-UHFFFAOYSA-N 1 2 324.359 4.218 20 0 DIADLO Clc1ccnc(Cl)c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175346439 1048251765 /nfs/dbraw/zinc/25/17/65/1048251765.db2.gz UGQCHYSCADPWHF-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO Cc1cc(Nc2ccc(N3CCCC3)[nH+]c2)cc2scnc21 ZINC001175349380 1048252051 /nfs/dbraw/zinc/25/20/51/1048252051.db2.gz OHRDTLHXHAWTMB-UHFFFAOYSA-N 1 2 310.426 4.344 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cnn(-c3ccccc3)c2C)cc1 ZINC001201376755 1048254355 /nfs/dbraw/zinc/25/43/55/1048254355.db2.gz VPVRGSOOUZCLBW-UHFFFAOYSA-N 1 2 306.413 4.380 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cnn(-c3ccccc3)c2C)cc1 ZINC001201376755 1048254368 /nfs/dbraw/zinc/25/43/68/1048254368.db2.gz VPVRGSOOUZCLBW-UHFFFAOYSA-N 1 2 306.413 4.380 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1ccccc1[S@](C)=O ZINC001175304623 1048255304 /nfs/dbraw/zinc/25/53/04/1048255304.db2.gz DMYYOXGDJDUIAZ-NRFANRHFSA-N 1 2 302.443 4.070 20 0 DIADLO Cc1oncc1CNc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1 ZINC001162274642 1048256358 /nfs/dbraw/zinc/25/63/58/1048256358.db2.gz DIZBKNHCMZVHSV-UHFFFAOYSA-N 1 2 304.353 4.138 20 0 DIADLO CCN(Cc1ccc(Cl)cc1)c1cc(C)[nH+]c(C2CC2)n1 ZINC001162302959 1048259087 /nfs/dbraw/zinc/25/90/87/1048259087.db2.gz GKNWMWNARUTDJL-UHFFFAOYSA-N 1 2 301.821 4.342 20 0 DIADLO Fc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c(Cl)c1F ZINC001175348930 1048261973 /nfs/dbraw/zinc/26/19/73/1048261973.db2.gz JWKABEBWOJVSPQ-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO CCCOc1ccc(CNc2cc(CC)[nH+]c(CC)n2)c(C)c1 ZINC001186088814 1048263168 /nfs/dbraw/zinc/26/31/68/1048263168.db2.gz JPABEJZMPASYST-UHFFFAOYSA-N 1 2 313.445 4.311 20 0 DIADLO Cc1ccccc1C[C@@H](C)Nc1nc2ccccc2n2c[nH+]cc12 ZINC001162344908 1048265057 /nfs/dbraw/zinc/26/50/57/1048265057.db2.gz AQZXMTSQTNCJQJ-OAHLLOKOSA-N 1 2 316.408 4.234 20 0 DIADLO Cc1nc(NCC(C)(C)c2ccc(C(F)(F)F)cc2)cc[nH+]1 ZINC001186144663 1048267770 /nfs/dbraw/zinc/26/77/70/1048267770.db2.gz PDWZWIGZVBQQDM-UHFFFAOYSA-N 1 2 309.335 4.194 20 0 DIADLO Cc1cc(Nc2ccc(N3CCCC3)[nH+]c2)c2ccsc2n1 ZINC001175349782 1048270920 /nfs/dbraw/zinc/27/09/20/1048270920.db2.gz DNZXBVOOPVBRIF-UHFFFAOYSA-N 1 2 310.426 4.344 20 0 DIADLO Oc1cc(Cl)c(Cl)cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175350937 1048271979 /nfs/dbraw/zinc/27/19/79/1048271979.db2.gz JVFSPHBDNFLUCS-UHFFFAOYSA-N 1 2 324.211 4.438 20 0 DIADLO FC(F)(F)Oc1ccccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175351894 1048272090 /nfs/dbraw/zinc/27/20/90/1048272090.db2.gz XGAOXCQLZHKUHY-UHFFFAOYSA-N 1 2 323.318 4.324 20 0 DIADLO c1ccc(-c2ncccc2Nc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC001175350146 1048272151 /nfs/dbraw/zinc/27/21/51/1048272151.db2.gz UOPYNBIURYTKEK-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO FC(F)Oc1ccccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175350543 1048272827 /nfs/dbraw/zinc/27/28/27/1048272827.db2.gz ASTLRUCIQCJTJV-UHFFFAOYSA-N 1 2 305.328 4.027 20 0 DIADLO c1cc([NH+]2CCCCC2)ccc1Nc1ccc(N2CCCC2)nc1 ZINC001175352906 1048273596 /nfs/dbraw/zinc/27/35/96/1048273596.db2.gz XGWUNJUUDAZQTB-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO Brc1cccc(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175352514 1048274281 /nfs/dbraw/zinc/27/42/81/1048274281.db2.gz QMEYXNXERDWVKS-UHFFFAOYSA-N 1 2 318.218 4.188 20 0 DIADLO Cc1cc(NCC2(c3ccc(Cl)cc3)CC2)nc(C2CC2)[nH+]1 ZINC001162407897 1048276574 /nfs/dbraw/zinc/27/65/74/1048276574.db2.gz HDKXZYVJSXQZBZ-UHFFFAOYSA-N 1 2 313.832 4.460 20 0 DIADLO Cc1cc(Nc2ccc([NH2+]C(C)C)cc2)n(Cc2cccnc2)n1 ZINC001201488532 1048280096 /nfs/dbraw/zinc/28/00/96/1048280096.db2.gz SWGHEMCYGHMTKY-UHFFFAOYSA-N 1 2 321.428 4.199 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cnn(Cc3ccccc3)c2)cc1 ZINC001201488973 1048280250 /nfs/dbraw/zinc/28/02/50/1048280250.db2.gz VFFZDUNLXKJOFW-UHFFFAOYSA-N 1 2 306.413 4.495 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cc(Br)c[nH]c2=O)cc1 ZINC001201488211 1048281442 /nfs/dbraw/zinc/28/14/42/1048281442.db2.gz AHARMKOPOAWWGO-UHFFFAOYSA-N 1 2 322.206 4.114 20 0 DIADLO CC(C)[NH2+]c1ccc(-n2cc(N)c3c2nccc3Cl)cc1 ZINC001201492312 1048282712 /nfs/dbraw/zinc/28/27/12/1048282712.db2.gz ZVLPFVOKIVPQRV-UHFFFAOYSA-N 1 2 300.793 4.081 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2cnc(-c3ccc(O)cc3)nc2)cc1 ZINC001201492229 1048282753 /nfs/dbraw/zinc/28/27/53/1048282753.db2.gz XLPFINUHADLMNJ-UHFFFAOYSA-N 1 2 320.396 4.413 20 0 DIADLO CC[C@@H](C)C[N@@H+]1CCOC[C@H]1c1csc(-c2ccccc2)n1 ZINC001201502989 1048289499 /nfs/dbraw/zinc/28/94/99/1048289499.db2.gz MVKWGHPYRYVYBB-PBHICJAKSA-N 1 2 316.470 4.230 20 0 DIADLO CC[C@@H](C)C[N@H+]1CCOC[C@H]1c1csc(-c2ccccc2)n1 ZINC001201502989 1048289519 /nfs/dbraw/zinc/28/95/19/1048289519.db2.gz MVKWGHPYRYVYBB-PBHICJAKSA-N 1 2 316.470 4.230 20 0 DIADLO COc1ncc(Nc2ccc(Oc3cc[nH+]c(C)c3)cc2)s1 ZINC001175392177 1048294641 /nfs/dbraw/zinc/29/46/41/1048294641.db2.gz WGTBOOXQMFOZHP-UHFFFAOYSA-N 1 2 313.382 4.391 20 0 DIADLO CCCCOc1ccc(N(C)c2[nH+]cccc2N)cc1Cl ZINC001201480399 1048296386 /nfs/dbraw/zinc/29/63/86/1048296386.db2.gz BRFRDATUPGSRTG-UHFFFAOYSA-N 1 2 305.809 4.264 20 0 DIADLO Cc1cccc2c(C)cc(NCc3cccc4c3cnn4C)[nH+]c12 ZINC001162587306 1048307968 /nfs/dbraw/zinc/30/79/68/1048307968.db2.gz VELKMOIFIVXYRX-UHFFFAOYSA-N 1 2 316.408 4.350 20 0 DIADLO Cc1ccccc1[C@@H]1C[C@@H](C)N(c2nc(C)[nH+]c3c2CCCC3)C1 ZINC001162590778 1048309118 /nfs/dbraw/zinc/30/91/18/1048309118.db2.gz FYZWDWHQEDSQNH-NVXWUHKLSA-N 1 2 321.468 4.355 20 0 DIADLO Cc1ccccc1[C@H]1C[C@@H](C)N(c2nc(C)[nH+]c3c2CCCC3)C1 ZINC001162590783 1048309737 /nfs/dbraw/zinc/30/97/37/1048309737.db2.gz FYZWDWHQEDSQNH-WBVHZDCISA-N 1 2 321.468 4.355 20 0 DIADLO O=C1Nc2ccccc2[C@@H]1CNc1[nH+]ccc2cc(Cl)ccc21 ZINC001162610828 1048314198 /nfs/dbraw/zinc/31/41/98/1048314198.db2.gz RGBCAATXLSKZAL-HNNXBMFYSA-N 1 2 323.783 4.036 20 0 DIADLO Cc1cc(N[C@@H](C)c2cccc(N(C)C)c2)nc(C(C)(C)C)[nH+]1 ZINC001162633219 1048320015 /nfs/dbraw/zinc/32/00/15/1048320015.db2.gz QUXOXKHMTBZQED-AWEZNQCLSA-N 1 2 312.461 4.322 20 0 DIADLO FC(F)(F)c1c[nH]c2[nH+]ccc(NC[C@H]3CCC(F)(F)C3)c12 ZINC001162649433 1048326445 /nfs/dbraw/zinc/32/64/45/1048326445.db2.gz GXBYXRVOZWSUFP-QMMMGPOBSA-N 1 2 319.277 4.429 20 0 DIADLO CCc1cc(NC[C@@H](C)Sc2ccccc2)nc(CC)[nH+]1 ZINC001162652977 1048327738 /nfs/dbraw/zinc/32/77/38/1048327738.db2.gz YCHZTZDZGQAODT-CYBMUJFWSA-N 1 2 301.459 4.194 20 0 DIADLO Cc1c[nH+]c(Nc2cncc(OCc3ccccc3)c2)c(C)c1 ZINC001201621411 1048334160 /nfs/dbraw/zinc/33/41/60/1048334160.db2.gz HFZXGWQJZQUTCH-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO Oc1cncc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)c1 ZINC001201628502 1048338882 /nfs/dbraw/zinc/33/88/82/1048338882.db2.gz MCADXCWERJMHRA-UHFFFAOYSA-N 1 2 305.259 4.098 20 0 DIADLO CCSc1cc[nH+]c(NCc2ccnc(C(F)(F)F)c2)c1 ZINC001162740290 1048347057 /nfs/dbraw/zinc/34/70/57/1048347057.db2.gz PUZLAZYFKRUCPJ-UHFFFAOYSA-N 1 2 313.348 4.220 20 0 DIADLO Cc1cc(NCc2ccc(C(F)(F)F)n2C)ccc1[NH+](C)C ZINC001162754368 1048350398 /nfs/dbraw/zinc/35/03/98/1048350398.db2.gz HNRAOBYJNBUXCH-UHFFFAOYSA-N 1 2 311.351 4.030 20 0 DIADLO COCc1ccc(C[N@H+](Cc2c(F)cccc2F)C2CC2)cc1 ZINC000555461086 1048354134 /nfs/dbraw/zinc/35/41/34/1048354134.db2.gz MWADLVNOZIEEHR-UHFFFAOYSA-N 1 2 317.379 4.276 20 0 DIADLO COCc1ccc(C[N@@H+](Cc2c(F)cccc2F)C2CC2)cc1 ZINC000555461086 1048354147 /nfs/dbraw/zinc/35/41/47/1048354147.db2.gz MWADLVNOZIEEHR-UHFFFAOYSA-N 1 2 317.379 4.276 20 0 DIADLO Cc1ccc2n[nH]cc2c1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001175525978 1048355883 /nfs/dbraw/zinc/35/58/83/1048355883.db2.gz QETMPURPPRTWBU-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](CC)c2ccccc2OC)cs1 ZINC000775062487 1048360751 /nfs/dbraw/zinc/36/07/51/1048360751.db2.gz BPRNGFQTSTXXJJ-HNNXBMFYSA-N 1 2 304.459 4.345 20 0 DIADLO Fc1ccc2c(c1)OCCC[C@H]2[NH2+]Cc1csc(C2CC2)n1 ZINC001201742890 1048362734 /nfs/dbraw/zinc/36/27/34/1048362734.db2.gz XRNYEKZTDGPFOI-OAHLLOKOSA-N 1 2 318.417 4.163 20 0 DIADLO CCCOc1cccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001175600366 1048367546 /nfs/dbraw/zinc/36/75/46/1048367546.db2.gz CDYPCSCUAQWLBK-UHFFFAOYSA-N 1 2 307.397 4.464 20 0 DIADLO Fc1ccc(C(F)(F)C[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)cc1 ZINC001175601812 1048369441 /nfs/dbraw/zinc/36/94/41/1048369441.db2.gz UAZNZPCIUPCVFT-CHWSQXEVSA-N 1 2 323.280 4.404 20 0 DIADLO Cc1cc(NCc2cn(C)c3ccccc23)cc(OC(F)F)[nH+]1 ZINC001162834613 1048370237 /nfs/dbraw/zinc/37/02/37/1048370237.db2.gz BPLQPHQARTXWGO-UHFFFAOYSA-N 1 2 317.339 4.095 20 0 DIADLO CCOc1ccc(-c2cc(Nc3cc(C)c[nH+]c3C)on2)cc1 ZINC001203654640 1048373358 /nfs/dbraw/zinc/37/33/58/1048373358.db2.gz OEBVGJZELPDMER-UHFFFAOYSA-N 1 2 309.369 4.496 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)Nc1cc(Cl)cc(Cl)c1 ZINC001187125498 1048377431 /nfs/dbraw/zinc/37/74/31/1048377431.db2.gz KQBMKBATLHFQNN-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO CO[C@@H](CNc1cc(C(C)C)[nH+]c(C(C)C)n1)C1CCCC1 ZINC001187139908 1048379292 /nfs/dbraw/zinc/37/92/92/1048379292.db2.gz FLNHNWASFQNIRC-INIZCTEOSA-N 1 2 305.466 4.341 20 0 DIADLO CCNC(=O)c1ccc(Nc2c[nH+]c(CC(C)C)cc2C)cc1 ZINC001175629609 1048382668 /nfs/dbraw/zinc/38/26/68/1048382668.db2.gz VXIJUDJSASJNPX-UHFFFAOYSA-N 1 2 311.429 4.082 20 0 DIADLO Cc1cc(Nc2cc(C)c[nH+]c2C)n(Cc2ccccc2F)n1 ZINC001203657674 1048388526 /nfs/dbraw/zinc/38/85/26/1048388526.db2.gz TWHUKGPPOSHAPC-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO Cc1ccc([C@@H](CO)Nc2cc(C)c3cccc(C)c3[nH+]2)cc1 ZINC001162945331 1048394026 /nfs/dbraw/zinc/39/40/26/1048394026.db2.gz ZWVAAHJXVCMWPQ-GOSISDBHSA-N 1 2 306.409 4.306 20 0 DIADLO CCc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(O)c1Cl)CCO2 ZINC001201921092 1048401592 /nfs/dbraw/zinc/40/15/92/1048401592.db2.gz ZHFBBCRLZXNICF-HNNXBMFYSA-N 1 2 317.816 4.221 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cc(Cl)ccc2F)cnc1Cl ZINC000775125520 1048401761 /nfs/dbraw/zinc/40/17/61/1048401761.db2.gz SQPIGEPJXDDFBL-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cc(Cl)ccc2F)cnc1Cl ZINC000775125520 1048401780 /nfs/dbraw/zinc/40/17/80/1048401780.db2.gz SQPIGEPJXDDFBL-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO c1ccc([C@H](Nc2[nH+]ccc3ccccc32)c2cccnn2)cc1 ZINC001163101631 1048415593 /nfs/dbraw/zinc/41/55/93/1048415593.db2.gz CJYNHTZGTQFCCP-IBGZPJMESA-N 1 2 312.376 4.226 20 0 DIADLO c1ccc([C@@H](Nc2cc3ccccc3c[nH+]2)c2cccnn2)cc1 ZINC001163102547 1048417357 /nfs/dbraw/zinc/41/73/57/1048417357.db2.gz PGZSKHZLSGAWDD-HXUWFJFHSA-N 1 2 312.376 4.226 20 0 DIADLO Cc1cccc(Cl)c1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175712979 1048418897 /nfs/dbraw/zinc/41/88/97/1048418897.db2.gz WDXGXMJKVMTWNE-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(Cl)c(F)c2)c[nH+]1 ZINC001175713124 1048419403 /nfs/dbraw/zinc/41/94/03/1048419403.db2.gz QSXRVYZQEXNTEM-UHFFFAOYSA-N 1 2 305.662 4.219 20 0 DIADLO COc1ccc(Nc2c[nH+]c(N)cc2C(F)(F)F)cc1Cl ZINC001175712617 1048419558 /nfs/dbraw/zinc/41/95/58/1048419558.db2.gz FLBMSZJIQFIGHL-UHFFFAOYSA-N 1 2 317.698 4.088 20 0 DIADLO Cc1cc(Cl)ccc1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175712153 1048419614 /nfs/dbraw/zinc/41/96/14/1048419614.db2.gz HMVMTBDTMCEBQP-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Cc1ccc2cc(Nc3c[nH+]c(N)cc3C(F)(F)F)ccc2n1 ZINC001175712686 1048419671 /nfs/dbraw/zinc/41/96/71/1048419671.db2.gz GZNWKKRBNYIING-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO COc1cc(C)c(Nc2c[nH+]c(N)cc2C(F)(F)F)c(C)c1 ZINC001175714569 1048420406 /nfs/dbraw/zinc/42/04/06/1048420406.db2.gz PUZXINHPHPWEKT-UHFFFAOYSA-N 1 2 311.307 4.052 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(F)c3cnccc23)c[nH+]1 ZINC001175716076 1048421497 /nfs/dbraw/zinc/42/14/97/1048421497.db2.gz SJSHZNRTTMZQLO-UHFFFAOYSA-N 1 2 322.265 4.114 20 0 DIADLO COc1cc(Cl)cc(Nc2c[nH+]c(N)cc2C(F)(F)F)c1 ZINC001175714548 1048421540 /nfs/dbraw/zinc/42/15/40/1048421540.db2.gz OZKRABWRBPHWKR-UHFFFAOYSA-N 1 2 317.698 4.088 20 0 DIADLO CSc1ccc(Nc2c[nH+]c(N)cc2C(F)(F)F)c(F)c1 ZINC001175713449 1048421873 /nfs/dbraw/zinc/42/18/73/1048421873.db2.gz IGRIFADHRGIOJY-UHFFFAOYSA-N 1 2 317.311 4.287 20 0 DIADLO Cc1ccc(Nc2c[nH+]c(N)cc2C(F)(F)F)c(F)c1F ZINC001175713475 1048421924 /nfs/dbraw/zinc/42/19/24/1048421924.db2.gz AASYZBPPFPLSAK-UHFFFAOYSA-N 1 2 303.234 4.013 20 0 DIADLO CC(=O)Nc1ccc([C@H](C)Nc2cc3ccccc3c[nH+]2)cc1 ZINC001163149275 1048422539 /nfs/dbraw/zinc/42/25/39/1048422539.db2.gz KRHTZZIBIFYOPN-ZDUSSCGKSA-N 1 2 305.381 4.366 20 0 DIADLO COc1cc(Cl)ccc1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175717225 1048422674 /nfs/dbraw/zinc/42/26/74/1048422674.db2.gz GAPWAJQHUAHRDU-UHFFFAOYSA-N 1 2 317.698 4.088 20 0 DIADLO CCC(=O)c1ccc(Nc2c[nH+]c(N)cc2C(F)(F)F)cc1 ZINC001175716849 1048423064 /nfs/dbraw/zinc/42/30/64/1048423064.db2.gz ZVLCBHDMRQXBMK-UHFFFAOYSA-N 1 2 309.291 4.019 20 0 DIADLO CC(=O)Nc1ccc([C@H](C)Nc2cc(C(C)C)[nH+]c(C)n2)cc1 ZINC001163150132 1048423174 /nfs/dbraw/zinc/42/31/74/1048423174.db2.gz QKEIIVOYKWQHQE-LBPRGKRZSA-N 1 2 312.417 4.040 20 0 DIADLO Cc1cc(N[C@@H](C)COCC2CCCCC2)nc(C2CCC2)[nH+]1 ZINC001187677882 1048424116 /nfs/dbraw/zinc/42/41/16/1048424116.db2.gz PMESRWPDHYIPBM-HNNXBMFYSA-N 1 2 317.477 4.450 20 0 DIADLO Cc1cc(NCc2cccc(C(F)(F)F)n2)nc(C(C)(C)C)[nH+]1 ZINC001163184551 1048429478 /nfs/dbraw/zinc/42/94/78/1048429478.db2.gz OVZLBJMWICMIRH-UHFFFAOYSA-N 1 2 324.350 4.108 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc(Cl)cnc2Cl)c[nH+]1 ZINC001175709667 1048437571 /nfs/dbraw/zinc/43/75/71/1048437571.db2.gz JHECEWUZKSCCPY-UHFFFAOYSA-N 1 2 323.105 4.128 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc(Cl)nc(Cl)c2)c[nH+]1 ZINC001175709898 1048438366 /nfs/dbraw/zinc/43/83/66/1048438366.db2.gz OUXPAFQIFCWFDX-UHFFFAOYSA-N 1 2 323.105 4.128 20 0 DIADLO O=C(Nc1ccc(Cl)cc1Cl)Nc1cccc2[nH+]ccn21 ZINC001202071566 1048438894 /nfs/dbraw/zinc/43/88/94/1048438894.db2.gz VDSJKAYFGCPESA-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO Cc1cc(NCC[C@H]2CCC(C)(C)CO2)nc(C2CCC2)[nH+]1 ZINC001187756851 1048440059 /nfs/dbraw/zinc/44/00/59/1048440059.db2.gz ALNZPUDXLPGMRE-OAHLLOKOSA-N 1 2 303.450 4.060 20 0 DIADLO COc1cccc(NCc2cc(C)[nH+]c(C)c2)c1Br ZINC001202102594 1048450588 /nfs/dbraw/zinc/45/05/88/1048450588.db2.gz UCBDEABZCWAEPT-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO CC(C)c1cccc(Nc2ccccc2C[NH+]2CCOCC2)c1 ZINC001175778663 1048450887 /nfs/dbraw/zinc/45/08/87/1048450887.db2.gz NQGFEXDBGHVMII-UHFFFAOYSA-N 1 2 310.441 4.386 20 0 DIADLO C[C@H]1c2sccc2CC[N@H+]1Cc1cc(C(F)(F)F)co1 ZINC001175828555 1048456389 /nfs/dbraw/zinc/45/63/89/1048456389.db2.gz BSRCMGFUACPTSG-VIFPVBQESA-N 1 2 301.333 4.479 20 0 DIADLO C[C@H]1c2sccc2CC[N@@H+]1Cc1cc(C(F)(F)F)co1 ZINC001175828555 1048456395 /nfs/dbraw/zinc/45/63/95/1048456395.db2.gz BSRCMGFUACPTSG-VIFPVBQESA-N 1 2 301.333 4.479 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@@H](c2cccc(N)n2)C(C)C)[nH+]1 ZINC001163343851 1048459108 /nfs/dbraw/zinc/45/91/08/1048459108.db2.gz ROQUNJNZKRVGCI-OAHLLOKOSA-N 1 2 304.825 4.138 20 0 DIADLO CCSc1cc[nH+]c(N[C@H](c2ccncc2OC)C2CC2)c1 ZINC001163401929 1048467829 /nfs/dbraw/zinc/46/78/29/1048467829.db2.gz ZPZHURGGNHLFPS-KRWDZBQOSA-N 1 2 315.442 4.160 20 0 DIADLO c1cn(-c2ccc(Nc3cnn(C4CCCCC4)c3)cc2)c[nH+]1 ZINC001175878880 1048469204 /nfs/dbraw/zinc/46/92/04/1048469204.db2.gz VDOKTNMBRYFNFQ-UHFFFAOYSA-N 1 2 307.401 4.318 20 0 DIADLO CSc1ccc(NC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001188073880 1048472090 /nfs/dbraw/zinc/47/20/90/1048472090.db2.gz RVSRTAJBOCMQHO-UHFFFAOYSA-N 1 2 324.409 4.238 20 0 DIADLO Cc1cc(N(C)[C@@H]2CCC[C@@H]2c2ccccc2)nc(C2CC2)[nH+]1 ZINC001163474064 1048475446 /nfs/dbraw/zinc/47/54/46/1048475446.db2.gz YIDBVMQLQLHOBA-QZTJIDSGSA-N 1 2 307.441 4.435 20 0 DIADLO CCOC(CCCNc1cc(C(C)C)[nH+]c(C(C)C)n1)OCC ZINC001163483978 1048476371 /nfs/dbraw/zinc/47/63/71/1048476371.db2.gz UTNMPGFENJFVTC-UHFFFAOYSA-N 1 2 323.481 4.315 20 0 DIADLO COC[C@H]([NH2+]Cc1cscc1Cl)c1ccc(F)c(F)c1 ZINC000776255745 1048481667 /nfs/dbraw/zinc/48/16/67/1048481667.db2.gz HSYRQMWMNLLDOI-AWEZNQCLSA-N 1 2 317.788 4.157 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)cs1 ZINC000481763094 1048481785 /nfs/dbraw/zinc/48/17/85/1048481785.db2.gz CVTZJLBFNZLCPR-JQWIXIFHSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)cs1 ZINC000481763094 1048481790 /nfs/dbraw/zinc/48/17/90/1048481790.db2.gz CVTZJLBFNZLCPR-JQWIXIFHSA-N 1 2 306.397 4.429 20 0 DIADLO Cn1ccc2c1cccc2Nc1ccc[nH+]c1N1CCCCC1 ZINC001175863747 1048482059 /nfs/dbraw/zinc/48/20/59/1048482059.db2.gz YNGQTKWIUIZAQY-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cccnc1OCc1ccccc1 ZINC001175872253 1048486522 /nfs/dbraw/zinc/48/65/22/1048486522.db2.gz NRRGWNDCHYHRAQ-UHFFFAOYSA-N 1 2 321.380 4.198 20 0 DIADLO Cc1ccc(Nc2cccnc2OCc2ccccc2)c(C)[nH+]1 ZINC001175871197 1048487103 /nfs/dbraw/zinc/48/71/03/1048487103.db2.gz DTZBDNUVYQLYLC-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO Cc1cc(C)[nH+]c(Nc2cccnc2OCc2ccccc2)c1 ZINC001175871179 1048487568 /nfs/dbraw/zinc/48/75/68/1048487568.db2.gz DHFSQFGQRBXMOR-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC001175875274 1048488589 /nfs/dbraw/zinc/48/85/89/1048488589.db2.gz WLPGUGQVPGCKDI-GBIKHYSHSA-N 1 2 323.305 4.068 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC001175875274 1048488602 /nfs/dbraw/zinc/48/86/02/1048488602.db2.gz WLPGUGQVPGCKDI-GBIKHYSHSA-N 1 2 323.305 4.068 20 0 DIADLO CCc1cc(N2CC3(CC=CC3)[C@H]2c2ccccc2)nc(CC)[nH+]1 ZINC001163657423 1048499990 /nfs/dbraw/zinc/49/99/90/1048499990.db2.gz YTCKLVGLPHTSAG-HXUWFJFHSA-N 1 2 319.452 4.499 20 0 DIADLO Cc1ccc2oc(CNc3nc(C)[nH+]c4c3CCCC4)cc2c1 ZINC001163734485 1048512937 /nfs/dbraw/zinc/51/29/37/1048512937.db2.gz YVTDNQIZLPYIET-UHFFFAOYSA-N 1 2 307.397 4.331 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nc2c(o1)CCCC2 ZINC001175975802 1048513883 /nfs/dbraw/zinc/51/38/83/1048513883.db2.gz ZMYCIAOYWSYYKH-GFCCVEGCSA-N 1 2 304.821 4.400 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nc2c(o1)CCCC2 ZINC001175975802 1048513899 /nfs/dbraw/zinc/51/38/99/1048513899.db2.gz ZMYCIAOYWSYYKH-GFCCVEGCSA-N 1 2 304.821 4.400 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)C2(C)CCCCCC2)n1 ZINC001163770921 1048522923 /nfs/dbraw/zinc/52/29/23/1048522923.db2.gz ZOYVJAMUDCRLIO-UHFFFAOYSA-N 1 2 323.506 4.284 20 0 DIADLO FC(F)Oc1ccccc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001176010692 1048531978 /nfs/dbraw/zinc/53/19/78/1048531978.db2.gz AQEIDYBITHKNOY-UHFFFAOYSA-N 1 2 309.703 4.333 20 0 DIADLO Cc1c(C)c(NC(=[NH2+])C23CC4CC(CC(C4)C2)C3)nnc1Cl ZINC001163839278 1048533622 /nfs/dbraw/zinc/53/36/22/1048533622.db2.gz IEYLAIUACXCFJL-UHFFFAOYSA-N 1 2 318.852 4.352 20 0 DIADLO [NH2+]=C(Nc1ccnc(C(F)(F)F)n1)C12CC3CC(CC(C3)C1)C2 ZINC001163839866 1048534300 /nfs/dbraw/zinc/53/43/00/1048534300.db2.gz RFABKPDVHMNDGV-UHFFFAOYSA-N 1 2 324.350 4.101 20 0 DIADLO [NH2+]=C(Nc1cncnc1C(F)(F)F)C12CC3CC(CC(C3)C1)C2 ZINC001163847726 1048536067 /nfs/dbraw/zinc/53/60/67/1048536067.db2.gz CNIOPTHKOJLORJ-UHFFFAOYSA-N 1 2 324.350 4.101 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cccc(N4CCOCC4)c3)ccc12 ZINC001176021183 1048538036 /nfs/dbraw/zinc/53/80/36/1048538036.db2.gz KPSDXBKASZFNPB-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@H](C)c1cn(C(C)C)nn1 ZINC000924772520 1048544374 /nfs/dbraw/zinc/54/43/74/1048544374.db2.gz HUXUXPTXDOIJHO-ZIAGYGMSSA-N 1 2 312.417 4.325 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1cc(C(=O)N(C)C)ccc1F ZINC001176048355 1048555048 /nfs/dbraw/zinc/55/50/48/1048555048.db2.gz ZPULCIZOUHSCTG-UHFFFAOYSA-N 1 2 315.392 4.098 20 0 DIADLO COc1cc2cc[nH+]c(N3CCCC(F)(F)CC3)c2cc1F ZINC001163980419 1048564775 /nfs/dbraw/zinc/56/47/75/1048564775.db2.gz IXGOGPONSWBDOI-UHFFFAOYSA-N 1 2 310.319 4.008 20 0 DIADLO COc1ccc2[nH+]c(N3CCCC(F)(F)CC3)cc(C)c2c1 ZINC001163980231 1048564931 /nfs/dbraw/zinc/56/49/31/1048564931.db2.gz YOJPDMZPUDUIGJ-UHFFFAOYSA-N 1 2 306.356 4.177 20 0 DIADLO COc1cc[nH+]cc1Nc1cc2ccccc2nc1C(F)(F)F ZINC001176118077 1048573829 /nfs/dbraw/zinc/57/38/29/1048573829.db2.gz AWJBINANTYYEHI-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO COc1cc[nH+]cc1Nc1c(Cl)cnc(Cl)c1Cl ZINC001176118467 1048574823 /nfs/dbraw/zinc/57/48/23/1048574823.db2.gz LFTLCVFBZLMAGY-UHFFFAOYSA-N 1 2 304.564 4.189 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(C)c(Br)cc1F ZINC001176120584 1048575348 /nfs/dbraw/zinc/57/53/48/1048575348.db2.gz GJJKMHMEJKZLLP-UHFFFAOYSA-N 1 2 311.154 4.044 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(Cl)c(Br)c1 ZINC001176123206 1048576365 /nfs/dbraw/zinc/57/63/65/1048576365.db2.gz PNVRSXWRHFITPD-UHFFFAOYSA-N 1 2 313.582 4.250 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(SC(F)(F)F)ccc1N ZINC001176123422 1048576493 /nfs/dbraw/zinc/57/64/93/1048576493.db2.gz SLNQJSHSUNZTEO-UHFFFAOYSA-N 1 2 315.320 4.028 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(C2CCC2)nn1-c1ccccc1 ZINC001176121398 1048576960 /nfs/dbraw/zinc/57/69/60/1048576960.db2.gz HFRCNTCMBKDNLK-UHFFFAOYSA-N 1 2 320.396 4.287 20 0 DIADLO CNc1ccc(N[C@@H](C)c2ccc(Br)s2)c[nH+]1 ZINC001164089448 1048580749 /nfs/dbraw/zinc/58/07/49/1048580749.db2.gz RCYSWPFTMKOFJJ-QMMMGPOBSA-N 1 2 312.236 4.120 20 0 DIADLO FC(F)C[N@H+](CCn1ccc2cc(Cl)ccc21)C1CCC1 ZINC001176192998 1048589970 /nfs/dbraw/zinc/58/99/70/1048589970.db2.gz IIQXEMJZSRKSIC-UHFFFAOYSA-N 1 2 312.791 4.414 20 0 DIADLO FC(F)C[N@@H+](CCn1ccc2cc(Cl)ccc21)C1CCC1 ZINC001176192998 1048589984 /nfs/dbraw/zinc/58/99/84/1048589984.db2.gz IIQXEMJZSRKSIC-UHFFFAOYSA-N 1 2 312.791 4.414 20 0 DIADLO Cc1cc(NC[C@]2(C)CCOC3(CCC3)C2)nc(C2CCC2)[nH+]1 ZINC001164170352 1048597164 /nfs/dbraw/zinc/59/71/64/1048597164.db2.gz NDRZLGHHACYLOX-GOSISDBHSA-N 1 2 315.461 4.204 20 0 DIADLO c1csc(Cn2cc(Nc3cccc4cc[nH+]cc43)cn2)c1 ZINC001176160848 1048598963 /nfs/dbraw/zinc/59/89/63/1048598963.db2.gz CXKKTNBBLKMEHK-UHFFFAOYSA-N 1 2 306.394 4.285 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3CCC[C@@H](C)C3)cc2)[nH+]c1C ZINC001176211246 1048606149 /nfs/dbraw/zinc/60/61/49/1048606149.db2.gz MEMWSSKBVHPVFH-MLGOLLRUSA-N 1 2 311.429 4.458 20 0 DIADLO Fc1ccc(NCc2cnc3ccccc3c2)cc1-n1cc[nH+]c1 ZINC001164205834 1048606895 /nfs/dbraw/zinc/60/68/95/1048606895.db2.gz AAGUVCPTLJEWIX-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(-c2ccccc2)c[nH]1)c1nc(C)cs1 ZINC000194297383 1048607016 /nfs/dbraw/zinc/60/70/16/1048607016.db2.gz KVIRUFCLHZENIC-CQSZACIVSA-N 1 2 312.442 4.083 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(NCCSCc2ccco2)c1 ZINC001164226701 1048610347 /nfs/dbraw/zinc/61/03/47/1048610347.db2.gz DUJARGBTHMIEJZ-UHFFFAOYSA-N 1 2 313.426 4.025 20 0 DIADLO Clc1ccc(OCCCNc2cc3cc[nH]c3c[nH+]2)cc1 ZINC001164231998 1048610678 /nfs/dbraw/zinc/61/06/78/1048610678.db2.gz YRSSIAUDUJFYCU-UHFFFAOYSA-N 1 2 301.777 4.097 20 0 DIADLO Cc1cc(N2CC[C@](CF)(C(F)(F)F)C2)[nH+]c2ccccc12 ZINC001164266676 1048616049 /nfs/dbraw/zinc/61/60/49/1048616049.db2.gz OKVMHJNEBRMRSD-OAHLLOKOSA-N 1 2 312.310 4.272 20 0 DIADLO Cc1nnsc1C[N@@H+](C)[C@H](c1ccccc1Cl)C(C)C ZINC000567989586 1048621674 /nfs/dbraw/zinc/62/16/74/1048621674.db2.gz KRQMERRBVSJQGM-HNNXBMFYSA-N 1 2 309.866 4.329 20 0 DIADLO Cc1nnsc1C[N@H+](C)[C@H](c1ccccc1Cl)C(C)C ZINC000567989586 1048621678 /nfs/dbraw/zinc/62/16/78/1048621678.db2.gz KRQMERRBVSJQGM-HNNXBMFYSA-N 1 2 309.866 4.329 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000482505177 1048621724 /nfs/dbraw/zinc/62/17/24/1048621724.db2.gz HTQLQVCZXDPFBO-WCBMZHEXSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)c(F)cc1F ZINC000482505177 1048621727 /nfs/dbraw/zinc/62/17/27/1048621727.db2.gz HTQLQVCZXDPFBO-WCBMZHEXSA-N 1 2 311.269 4.267 20 0 DIADLO CCCC1CCC(C[NH2+][C@@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000482542137 1048628306 /nfs/dbraw/zinc/62/83/06/1048628306.db2.gz XSBYJXXQSXYPHK-LEOMRAHMSA-N 1 2 312.461 4.090 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(O)cc2C(F)(F)F)c[nH+]1 ZINC001176339023 1048631535 /nfs/dbraw/zinc/63/15/35/1048631535.db2.gz QNZLJWJQJZMBRE-UHFFFAOYSA-N 1 2 311.307 4.006 20 0 DIADLO Cc1[nH]c(CNc2cc(Cl)ccc2OC(F)(F)F)[nH+]c1C ZINC000850311200 1048631990 /nfs/dbraw/zinc/63/19/90/1048631990.db2.gz PMJYWSBZFSQPAP-UHFFFAOYSA-N 1 2 319.714 4.191 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc4c(c3)[C@H](O)CCCC4)n2c1 ZINC000850362062 1048638278 /nfs/dbraw/zinc/63/82/78/1048638278.db2.gz FXCUWMBLWANJRX-LJQANCHMSA-N 1 2 321.424 4.015 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc4c(c3)[C@@H](O)CCCC4)n2c1 ZINC000850362061 1048638804 /nfs/dbraw/zinc/63/88/04/1048638804.db2.gz FXCUWMBLWANJRX-IBGZPJMESA-N 1 2 321.424 4.015 20 0 DIADLO CCN(CC)C(=O)c1cc(F)cc(Nc2c[nH+]c(C)cc2C)c1 ZINC001176297293 1048639537 /nfs/dbraw/zinc/63/95/37/1048639537.db2.gz QPVXLMQWEMGEAT-UHFFFAOYSA-N 1 2 315.392 4.063 20 0 DIADLO COc1c(Cl)cc(Nc2cccc3[nH+]ccn32)cc1Cl ZINC001176307136 1048642586 /nfs/dbraw/zinc/64/25/86/1048642586.db2.gz DIVYKRTVSUKOGM-UHFFFAOYSA-N 1 2 308.168 4.393 20 0 DIADLO Cc1ccc2[nH+]c(CSc3nccc4ccccc43)cn2c1 ZINC001189610469 1048645638 /nfs/dbraw/zinc/64/56/38/1048645638.db2.gz ZWORYLDXRUOCIP-UHFFFAOYSA-N 1 2 305.406 4.483 20 0 DIADLO COc1c(Cl)cc(-n2c(C)[nH+]c3ccc(N)cc32)cc1Cl ZINC001176309041 1048646437 /nfs/dbraw/zinc/64/64/37/1048646437.db2.gz LXDKXILBUWCHJB-UHFFFAOYSA-N 1 2 322.195 4.232 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1cc2c(cccc2C)[nH]1 ZINC000668098833 1048655571 /nfs/dbraw/zinc/65/55/71/1048655571.db2.gz SJKMKWUFTZFLCI-IBGZPJMESA-N 1 2 322.456 4.420 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1cc2c(cccc2C)[nH]1 ZINC000668098833 1048655579 /nfs/dbraw/zinc/65/55/79/1048655579.db2.gz SJKMKWUFTZFLCI-IBGZPJMESA-N 1 2 322.456 4.420 20 0 DIADLO CCc1cccc(CC)c1NC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001189749074 1048659196 /nfs/dbraw/zinc/65/91/96/1048659196.db2.gz UWQFBILBSBXWDI-UHFFFAOYSA-N 1 2 322.412 4.412 20 0 DIADLO c1cn2cccc(Nc3ccc(Oc4ccccc4)nc3)c2[nH+]1 ZINC001176374402 1048664773 /nfs/dbraw/zinc/66/47/73/1048664773.db2.gz XDCCEIFUJHNLQY-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO CC(C)(C)c1cn(Cc2ccccc2OCC(F)(F)F)c[nH+]1 ZINC001189876683 1048672334 /nfs/dbraw/zinc/67/23/34/1048672334.db2.gz UELDTYIVKAZIPT-UHFFFAOYSA-N 1 2 312.335 4.170 20 0 DIADLO COc1cc(C)c(NCc2cc(-n3cc[nH+]c3)cs2)cc1F ZINC000775326237 1048673889 /nfs/dbraw/zinc/67/38/89/1048673889.db2.gz RFKLGYNZQITSQQ-UHFFFAOYSA-N 1 2 317.389 4.002 20 0 DIADLO CCc1cccc(C)c1NC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC001189941544 1048680020 /nfs/dbraw/zinc/68/00/20/1048680020.db2.gz UCEQSNTVVSJZMJ-UHFFFAOYSA-N 1 2 320.396 4.387 20 0 DIADLO Fc1cc(Nc2cccc(-n3cc[nH+]c3)c2)cc(N2CCCC2)c1 ZINC001176418781 1048681457 /nfs/dbraw/zinc/68/14/57/1048681457.db2.gz KKJHBDXHZDANOD-UHFFFAOYSA-N 1 2 322.387 4.355 20 0 DIADLO Cc1nc(N2CCC3(C=Cc4ccccc43)CC2)cc(C(C)C)[nH+]1 ZINC001165332149 1048683037 /nfs/dbraw/zinc/68/30/37/1048683037.db2.gz VYNDEXMXBCYRAC-UHFFFAOYSA-N 1 2 319.452 4.473 20 0 DIADLO Fc1cc(Nc2ccc(-n3cc[nH+]c3)cc2)cc(N2CCCC2)c1 ZINC001176419224 1048683093 /nfs/dbraw/zinc/68/30/93/1048683093.db2.gz SURKDGOHGQTEFE-UHFFFAOYSA-N 1 2 322.387 4.355 20 0 DIADLO CC(C)(C)CN(CC(C)(C)C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000775340190 1048693676 /nfs/dbraw/zinc/69/36/76/1048693676.db2.gz WESWANKNELLXMJ-UHFFFAOYSA-N 1 2 316.449 4.260 20 0 DIADLO FC(F)(F)c1c[nH]c2[nH+]ccc(NCCCc3ccncc3)c12 ZINC001165534437 1048696138 /nfs/dbraw/zinc/69/61/38/1048696138.db2.gz LOUUSCMXSGLSNT-UHFFFAOYSA-N 1 2 320.318 4.021 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+]Cc2nnc(C(C)(C)C)o2)cc1 ZINC000775354785 1048700438 /nfs/dbraw/zinc/70/04/38/1048700438.db2.gz CIBUVHLDNQRUMT-GFCCVEGCSA-N 1 2 319.474 4.330 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2)n1 ZINC000482898183 1048702450 /nfs/dbraw/zinc/70/24/50/1048702450.db2.gz ATROVNVLJKQSHT-SFHVURJKSA-N 1 2 301.409 4.330 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2)n1 ZINC000482898183 1048702463 /nfs/dbraw/zinc/70/24/63/1048702463.db2.gz ATROVNVLJKQSHT-SFHVURJKSA-N 1 2 301.409 4.330 20 0 DIADLO FC(F)(F)C1CCC(Nc2ccc(-n3cccc3)c[nH+]2)CC1 ZINC001165599982 1048702740 /nfs/dbraw/zinc/70/27/40/1048702740.db2.gz RRCAJMNCGNYQCB-UHFFFAOYSA-N 1 2 309.335 4.405 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1cnc(N2CCCCC2)nc1 ZINC001176508331 1048703630 /nfs/dbraw/zinc/70/36/30/1048703630.db2.gz YMFDKWIWFJNLGC-UHFFFAOYSA-N 1 2 311.433 4.037 20 0 DIADLO Fc1ccc([C@@H]2CCCC[N@@H+]2Cc2cn3ccsc3n2)cc1 ZINC000482926249 1048705055 /nfs/dbraw/zinc/70/50/55/1048705055.db2.gz IXGITWCOUOMTAK-INIZCTEOSA-N 1 2 315.417 4.262 20 0 DIADLO Fc1ccc([C@@H]2CCCC[N@H+]2Cc2cn3ccsc3n2)cc1 ZINC000482926249 1048705067 /nfs/dbraw/zinc/70/50/67/1048705067.db2.gz IXGITWCOUOMTAK-INIZCTEOSA-N 1 2 315.417 4.262 20 0 DIADLO CCOc1nccc(C[N@H+](C)Cc2cccc(C)c2)c1Cl ZINC001250361220 1048706233 /nfs/dbraw/zinc/70/62/33/1048706233.db2.gz NUUPIDWOBYZQJV-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCOc1nccc(C[N@@H+](C)Cc2cccc(C)c2)c1Cl ZINC001250361220 1048706246 /nfs/dbraw/zinc/70/62/46/1048706246.db2.gz NUUPIDWOBYZQJV-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cccc(OC(F)(F)F)c3)ccc21 ZINC001176541379 1048713680 /nfs/dbraw/zinc/71/36/80/1048713680.db2.gz WERVOZRVVFAFQA-UHFFFAOYSA-N 1 2 307.275 4.216 20 0 DIADLO COc1ccccc1Cc1cn(Cc2ccsc2Cl)c[nH+]1 ZINC001190283431 1048716935 /nfs/dbraw/zinc/71/69/35/1048716935.db2.gz MDVBJPFZHSKSQM-UHFFFAOYSA-N 1 2 318.829 4.246 20 0 DIADLO CCOC1CCC(Nc2ccc(-n3c[nH+]c(C)c3C)cc2)CC1 ZINC000668183926 1048717666 /nfs/dbraw/zinc/71/76/66/1048717666.db2.gz UMLTWSSYKMVVBY-UHFFFAOYSA-N 1 2 313.445 4.249 20 0 DIADLO C[N@H+](Cc1ccccc1F)Cc1cc(F)ccc1OC(F)F ZINC001190406695 1048731856 /nfs/dbraw/zinc/73/18/56/1048731856.db2.gz JJUPHHPTRVXROF-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO C[N@@H+](Cc1ccccc1F)Cc1cc(F)ccc1OC(F)F ZINC001190406695 1048731864 /nfs/dbraw/zinc/73/18/64/1048731864.db2.gz JJUPHHPTRVXROF-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO CSc1cc(Nc2c(Cl)cccc2COC(C)=O)cc[nH+]1 ZINC001212776120 1048741311 /nfs/dbraw/zinc/74/13/11/1048741311.db2.gz JBTNNGIMCFEVST-UHFFFAOYSA-N 1 2 322.817 4.264 20 0 DIADLO CC[NH+](CC)c1ccc(Nc2c(F)cc(F)c(O)c2F)cc1 ZINC001176670129 1048756174 /nfs/dbraw/zinc/75/61/74/1048756174.db2.gz SRTOSDNGVCRHOL-UHFFFAOYSA-N 1 2 310.319 4.399 20 0 DIADLO Clc1ccc2c(cc[nH+]c2N2CC[C@H](c3ccncc3)C2)c1 ZINC001166568284 1048762975 /nfs/dbraw/zinc/76/29/75/1048762975.db2.gz GFZLDPNRCZQRCG-HNNXBMFYSA-N 1 2 309.800 4.277 20 0 DIADLO c1ccc(-c2cc[nH+]c(N3CC[C@@H](c4ccncc4)C3)c2)cc1 ZINC001166570239 1048763303 /nfs/dbraw/zinc/76/33/03/1048763303.db2.gz YHQSLQXLSZYNAT-LJQANCHMSA-N 1 2 301.393 4.138 20 0 DIADLO c1cncc([C@@H]2CCCCN2c2[nH+]ccc3c4c([nH]c32)CCC4)c1 ZINC001166577088 1048764784 /nfs/dbraw/zinc/76/47/84/1048764784.db2.gz LWKSHRHINBWWSC-SFHVURJKSA-N 1 2 318.424 4.178 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[NH+]1CCC(C)(CC)CC1 ZINC001190690757 1048776828 /nfs/dbraw/zinc/77/68/28/1048776828.db2.gz IZODYBSZYVLVHR-INIZCTEOSA-N 1 2 323.864 4.456 20 0 DIADLO Cc1ccc2nc(Nc3ccc[nH+]c3N3CCCC3)sc2c1 ZINC001176743428 1048778268 /nfs/dbraw/zinc/77/82/68/1048778268.db2.gz KGKZMNDGHIXNHP-UHFFFAOYSA-N 1 2 310.426 4.344 20 0 DIADLO Cc1cc(N2CC[C@@H]2COCc2ccccc2)[nH+]c2ccccc12 ZINC001166669775 1048778344 /nfs/dbraw/zinc/77/83/44/1048778344.db2.gz CARQSBWNUHLTQP-GOSISDBHSA-N 1 2 318.420 4.339 20 0 DIADLO CCC1(C)CC[NH+]([C@@H](C(=O)OC)c2ccccc2Cl)CC1 ZINC001190692263 1048778668 /nfs/dbraw/zinc/77/86/68/1048778668.db2.gz URJRJHZKCNLXKL-OAHLLOKOSA-N 1 2 309.837 4.066 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1Nc1ccc[nH+]c1N1CCCC1 ZINC001176750010 1048779073 /nfs/dbraw/zinc/77/90/73/1048779073.db2.gz LPIJPGVJCOWOKU-UHFFFAOYSA-N 1 2 323.227 4.436 20 0 DIADLO Clc1ccc2c(cc[nH+]c2N2CCO[C@H](c3ccccc3)C2)c1 ZINC001166680084 1048781215 /nfs/dbraw/zinc/78/12/15/1048781215.db2.gz AJECADVZCSRYCR-SFHVURJKSA-N 1 2 324.811 4.466 20 0 DIADLO COc1ccc(C)[nH+]c1N(C)Cc1cccc(C(F)(F)F)c1 ZINC001166683946 1048781939 /nfs/dbraw/zinc/78/19/39/1048781939.db2.gz KRNFCUPPFJPPLF-UHFFFAOYSA-N 1 2 310.319 4.054 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@H+](C)Cc2ccsc2)cc1 ZINC000007926840 1048788811 /nfs/dbraw/zinc/78/88/11/1048788811.db2.gz ZXIMDPNPCRQWGF-CQSZACIVSA-N 1 2 316.470 4.332 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@@H+](C)Cc2ccsc2)cc1 ZINC000007926840 1048788822 /nfs/dbraw/zinc/78/88/22/1048788822.db2.gz ZXIMDPNPCRQWGF-CQSZACIVSA-N 1 2 316.470 4.332 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cccc(Br)c3F)ccc21 ZINC001249688237 1048811462 /nfs/dbraw/zinc/81/14/62/1048811462.db2.gz XNZWKOKJZNGZIP-UHFFFAOYSA-N 1 2 320.165 4.219 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2ncsc2Br)s1 ZINC000851928801 1048813796 /nfs/dbraw/zinc/81/37/96/1048813796.db2.gz QMGGZCPNYNPNHS-MRVPVSSYSA-N 1 2 317.277 4.126 20 0 DIADLO CC(C)c1ccc(N2CCC(Sc3ccncc3)CC2)[nH+]c1 ZINC001166988218 1048823777 /nfs/dbraw/zinc/82/37/77/1048823777.db2.gz ADXPRXNPEGDWCK-UHFFFAOYSA-N 1 2 313.470 4.361 20 0 DIADLO CCc1ccccc1C[NH2+][C@@H](c1nccn1C)c1ccc(F)cc1 ZINC001177191147 1048849351 /nfs/dbraw/zinc/84/93/51/1048849351.db2.gz LTPGYPPVLVCHRX-LJQANCHMSA-N 1 2 323.415 4.001 20 0 DIADLO CC(C)(C)c1ccc(NC(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001191132518 1048875720 /nfs/dbraw/zinc/87/57/20/1048875720.db2.gz WXKFSTBMURPQFE-UHFFFAOYSA-N 1 2 308.385 4.276 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1ccc(OCC(F)F)cc1 ZINC001177362762 1048880660 /nfs/dbraw/zinc/88/06/60/1048880660.db2.gz FIUWHWPBIWWIOL-UHFFFAOYSA-N 1 2 320.383 4.317 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1cnc2c(F)cccc2c1 ZINC001177363390 1048881483 /nfs/dbraw/zinc/88/14/83/1048881483.db2.gz PYTJYZCJIBUKAG-UHFFFAOYSA-N 1 2 309.388 4.360 20 0 DIADLO COc1ccccc1/C=C\CNc1ccc(-n2cc[nH+]c2)cc1 ZINC001177387431 1048881527 /nfs/dbraw/zinc/88/15/27/1048881527.db2.gz MLIPEBVRHQZXLJ-XQRVVYSFSA-N 1 2 305.381 4.006 20 0 DIADLO COc1cc(CNc2ccc(-n3cc[nH+]c3)cc2)ccc1Cl ZINC001177387150 1048882061 /nfs/dbraw/zinc/88/20/61/1048882061.db2.gz ABPBJGXQNHMSBM-UHFFFAOYSA-N 1 2 313.788 4.146 20 0 DIADLO Cc1ccc(Nc2nc(Cl)c(Cl)nc2Cl)c(C)[nH+]1 ZINC001203370047 1048882356 /nfs/dbraw/zinc/88/23/56/1048882356.db2.gz WJFWXZZOHHVLRX-UHFFFAOYSA-N 1 2 303.580 4.192 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3cccnc3Cl)CC2)cn1 ZINC000773665591 1048885182 /nfs/dbraw/zinc/88/51/82/1048885182.db2.gz MNKSVDFOLRHRQV-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3cccnc3Cl)CC2)cn1 ZINC000773665591 1048885200 /nfs/dbraw/zinc/88/52/00/1048885200.db2.gz MNKSVDFOLRHRQV-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3ccncc3Cl)CC2)cn1 ZINC000773659651 1048886954 /nfs/dbraw/zinc/88/69/54/1048886954.db2.gz ZPEHRNZMGPDWIB-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3ccncc3Cl)CC2)cn1 ZINC000773659651 1048886969 /nfs/dbraw/zinc/88/69/69/1048886969.db2.gz ZPEHRNZMGPDWIB-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2c(Cl)nc3ccccn32)o1 ZINC001203389646 1048890926 /nfs/dbraw/zinc/89/09/26/1048890926.db2.gz JSYICSINJDBPOE-UHFFFAOYSA-N 1 2 317.820 4.168 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cc(C)nc(Cl)c2)c1 ZINC000797602831 1048901386 /nfs/dbraw/zinc/90/13/86/1048901386.db2.gz WTABQNHVKQBGKV-UHFFFAOYSA-N 1 2 307.850 4.304 20 0 DIADLO CNc1ccc(Nc2c(Cl)cnc(Cl)c2Cl)c[nH+]1 ZINC001203449195 1048903377 /nfs/dbraw/zinc/90/33/77/1048903377.db2.gz CDGHJEJAWCDJID-UHFFFAOYSA-N 1 2 303.580 4.222 20 0 DIADLO CNc1ccc(Nc2cnc3c(cccc3C(F)(F)F)c2)c[nH+]1 ZINC001203451892 1048903597 /nfs/dbraw/zinc/90/35/97/1048903597.db2.gz FROJLJPTJPHILR-UHFFFAOYSA-N 1 2 318.302 4.434 20 0 DIADLO CNc1ccc(Nc2cccc(CCc3ccccn3)c2)c[nH+]1 ZINC001203454618 1048905040 /nfs/dbraw/zinc/90/50/40/1048905040.db2.gz GVHDNXXKWPIMDI-UHFFFAOYSA-N 1 2 304.397 4.047 20 0 DIADLO CNc1ccc(Nc2ccc3c(c2)Cc2cc(N)ccc2-3)c[nH+]1 ZINC001203456706 1048906954 /nfs/dbraw/zinc/90/69/54/1048906954.db2.gz RVDFWARRXKFBQD-UHFFFAOYSA-N 1 2 302.381 4.020 20 0 DIADLO CNc1ccc(Nc2cnc3ccccc3c2C(F)(F)F)c[nH+]1 ZINC001203452604 1048907493 /nfs/dbraw/zinc/90/74/93/1048907493.db2.gz PWGIZNXOWPBIMX-UHFFFAOYSA-N 1 2 318.302 4.434 20 0 DIADLO Cc1cccc(C)c1[C@H]1CCC[N@@H+]1Cn1ncsc1=S ZINC000853522247 1048908354 /nfs/dbraw/zinc/90/83/54/1048908354.db2.gz LRXOYXIATGNCBQ-CYBMUJFWSA-N 1 2 305.472 4.086 20 0 DIADLO Cc1cccc(C)c1[C@H]1CCC[N@H+]1Cn1ncsc1=S ZINC000853522247 1048908362 /nfs/dbraw/zinc/90/83/62/1048908362.db2.gz LRXOYXIATGNCBQ-CYBMUJFWSA-N 1 2 305.472 4.086 20 0 DIADLO FC(F)(F)C[C@H]1CCC[N@H+](Cn2ncc(Cl)c2C2CC2)C1 ZINC000853517746 1048908960 /nfs/dbraw/zinc/90/89/60/1048908960.db2.gz CYIYTHJYNQQBTG-SNVBAGLBSA-N 1 2 321.774 4.036 20 0 DIADLO FC(F)(F)C[C@H]1CCC[N@@H+](Cn2ncc(Cl)c2C2CC2)C1 ZINC000853517746 1048908983 /nfs/dbraw/zinc/90/89/83/1048908983.db2.gz CYIYTHJYNQQBTG-SNVBAGLBSA-N 1 2 321.774 4.036 20 0 DIADLO CCOc1cc(F)cc(CNc2[nH+]cccc2CSCC)c1 ZINC001203463482 1048909889 /nfs/dbraw/zinc/90/98/89/1048909889.db2.gz CRBVZASALILIQP-UHFFFAOYSA-N 1 2 320.433 4.485 20 0 DIADLO Cc1ccc2[nH+]c(NCc3ccsc3Br)[nH]c2c1 ZINC001203479077 1048912952 /nfs/dbraw/zinc/91/29/52/1048912952.db2.gz OESAWGSBKXYDLP-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO Cc1cc[nH+]c(Nc2ccc(N(C)Cc3ccccc3)nc2)c1 ZINC001203514136 1048917047 /nfs/dbraw/zinc/91/70/47/1048917047.db2.gz UEMGNTAEZDCMED-UHFFFAOYSA-N 1 2 304.397 4.165 20 0 DIADLO COc1ccc2c(Nc3c(C)nc4ccc(F)cn43)cc[nH+]c2c1 ZINC001203525175 1048918865 /nfs/dbraw/zinc/91/88/65/1048918865.db2.gz VNFLZIGZTNHKGK-UHFFFAOYSA-N 1 2 322.343 4.082 20 0 DIADLO FC(F)(F)c1ccc(C[NH2+]Cc2nc3ccccc3o2)s1 ZINC001203553704 1048927143 /nfs/dbraw/zinc/92/71/43/1048927143.db2.gz NFIVWVAKGVDNDV-UHFFFAOYSA-N 1 2 312.316 4.198 20 0 DIADLO FC(F)Oc1ccc(CNc2[nH]c3ccc(Cl)cc3[nH+]2)cc1 ZINC001203573164 1048932262 /nfs/dbraw/zinc/93/22/62/1048932262.db2.gz VUAZXKKHTHDTPS-UHFFFAOYSA-N 1 2 323.730 4.430 20 0 DIADLO Cc1c[nH]c(C[NH2+][C@@H](c2ccccc2)c2cccc(Cl)c2)n1 ZINC001177779726 1048943465 /nfs/dbraw/zinc/94/34/65/1048943465.db2.gz OYMUWFGKJKTIGG-SFHVURJKSA-N 1 2 311.816 4.251 20 0 DIADLO CC(=O)Nc1ccc(Nc2cc(C)c[nH+]c2C)cc1C(F)(F)F ZINC001203663337 1048952764 /nfs/dbraw/zinc/95/27/64/1048952764.db2.gz NQRUVNDBYZIECE-UHFFFAOYSA-N 1 2 323.318 4.419 20 0 DIADLO Fc1ccc(/C=C\C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)cc1F ZINC001203665922 1048953926 /nfs/dbraw/zinc/95/39/26/1048953926.db2.gz TYRMSWXVQJTWNI-OIWWRSOPSA-N 1 2 319.326 4.039 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc3cnn([C@@H]4CCCCO4)c3c2)c1 ZINC001203663864 1048954312 /nfs/dbraw/zinc/95/43/12/1048954312.db2.gz XKFPTXPESDFYMJ-IBGZPJMESA-N 1 2 322.412 4.491 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cc(Br)c(C)cc2O)c1 ZINC001203663869 1048954720 /nfs/dbraw/zinc/95/47/20/1048954720.db2.gz UZWWYMXLMTVWKW-UHFFFAOYSA-N 1 2 307.191 4.219 20 0 DIADLO COc1cc(Nc2cc(C)c[nH+]c2C)ccc1Br ZINC001203663297 1048954800 /nfs/dbraw/zinc/95/48/00/1048954800.db2.gz MVTAEJNNMMJIDE-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Fc1ccc(/C=C/C[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)cc1F ZINC001203665921 1048955214 /nfs/dbraw/zinc/95/52/14/1048955214.db2.gz TYRMSWXVQJTWNI-NDIJEHHESA-N 1 2 319.326 4.039 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc3cnn([C@H]4CCCCO4)c3c2)c1 ZINC001203663866 1048955249 /nfs/dbraw/zinc/95/52/49/1048955249.db2.gz XKFPTXPESDFYMJ-LJQANCHMSA-N 1 2 322.412 4.491 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cccc(F)c2OC[C@H]2CCCO2)c1 ZINC001203668675 1048957644 /nfs/dbraw/zinc/95/76/44/1048957644.db2.gz YELVVHBYVIGEJY-CQSZACIVSA-N 1 2 316.376 4.139 20 0 DIADLO CCN(C(=O)Nc1c(C(C)C)cccc1C(C)C)C1C[NH+](C)C1 ZINC001191638005 1048969738 /nfs/dbraw/zinc/96/97/38/1048969738.db2.gz QWCYNEUCXGKYLT-UHFFFAOYSA-N 1 2 317.477 4.101 20 0 DIADLO CCC[C@H](C)c1noc([C@H]([NH3+])c2ccccc2C(F)(F)F)n1 ZINC000904090361 1048970912 /nfs/dbraw/zinc/97/09/12/1048970912.db2.gz WANWOUVORBLNAD-JOYOIKCWSA-N 1 2 313.323 4.040 20 0 DIADLO O=c1cc[nH]c(Cl)c1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203719341 1048975383 /nfs/dbraw/zinc/97/53/83/1048975383.db2.gz SLARLTFVTZJPBB-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO c1cn(-c2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc2)nn1 ZINC001203719409 1048975940 /nfs/dbraw/zinc/97/59/40/1048975940.db2.gz VGTDIWDSBSELRD-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO CN1Cc2cc(Nc3ccc([NH+]4CCCCC4)cc3)ccc2C1=O ZINC001203718862 1048976816 /nfs/dbraw/zinc/97/68/16/1048976816.db2.gz FNFFYWVPJJZJKQ-UHFFFAOYSA-N 1 2 321.424 4.006 20 0 DIADLO FC(F)(F)c1cnc(Nc2ccc([NH+]3CCCCC3)cc2)cn1 ZINC001203718284 1048977102 /nfs/dbraw/zinc/97/71/02/1048977102.db2.gz ZXUBYOVFLNCMLC-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO CC[C@@H]1C[C@H](CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)CCO1 ZINC001178068666 1048979783 /nfs/dbraw/zinc/97/97/83/1048979783.db2.gz SZPOBEGYCIFBIJ-UKRRQHHQSA-N 1 2 319.836 4.143 20 0 DIADLO CN1CCc2cc(Nc3ccc([NH+]4CCCCC4)cc3)ccc21 ZINC001203724158 1048979749 /nfs/dbraw/zinc/97/97/49/1048979749.db2.gz HIZLHMBUPJBAIQ-UHFFFAOYSA-N 1 2 307.441 4.413 20 0 DIADLO CC(=O)N(C)c1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1 ZINC001203719630 1048980106 /nfs/dbraw/zinc/98/01/06/1048980106.db2.gz RIASDKKJGOOJPF-UHFFFAOYSA-N 1 2 323.440 4.403 20 0 DIADLO OCc1c(F)cccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203724348 1048980762 /nfs/dbraw/zinc/98/07/62/1048980762.db2.gz KCLHVKWUPARJSH-UHFFFAOYSA-N 1 2 300.377 4.052 20 0 DIADLO O=C1NCc2cc(Nc3ccc([NH+]4CCCCC4)cc3)ccc2N1 ZINC001203724660 1048980921 /nfs/dbraw/zinc/98/09/21/1048980921.db2.gz VCTSLGDCPNNFGL-UHFFFAOYSA-N 1 2 322.412 4.056 20 0 DIADLO c1ccc(C2=NCCO2)c(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001203724441 1048981590 /nfs/dbraw/zinc/98/15/90/1048981590.db2.gz ODHWHUZOPQIOSN-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO c1cn(CCOc2ccccc2NCC2CCCCCC2)c[nH+]1 ZINC001178111124 1048985622 /nfs/dbraw/zinc/98/56/22/1048985622.db2.gz FXXBQYRPRPEMIQ-UHFFFAOYSA-N 1 2 313.445 4.344 20 0 DIADLO Cc1cccc(C2(C(=O)NCc3cc(C)[nH+]c(C)c3)CCCC2)c1 ZINC001276417506 1048986783 /nfs/dbraw/zinc/98/67/83/1048986783.db2.gz AYBDOUHBLQZUMD-UHFFFAOYSA-N 1 2 322.452 4.135 20 0 DIADLO COCc1csc(CNc2ccc(-n3cc[nH+]c3)c(C)c2)c1 ZINC001178139210 1048990961 /nfs/dbraw/zinc/99/09/61/1048990961.db2.gz RHYSVRDXYFWXLK-UHFFFAOYSA-N 1 2 313.426 4.001 20 0 DIADLO C[C@@H](N[C@@H](C)c1c(F)cccc1Cl)c1cn2c([nH+]1)CCCC2 ZINC000925488518 1048995273 /nfs/dbraw/zinc/99/52/73/1048995273.db2.gz KEZVAJFJLYGMLJ-NEPJUHHUSA-N 1 2 321.827 4.424 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cc(O)cc(Cl)c2)c1 ZINC001178192039 1048997582 /nfs/dbraw/zinc/99/75/82/1048997582.db2.gz QFDKBXTZCXUYPS-UHFFFAOYSA-N 1 2 308.834 4.306 20 0 DIADLO C[C@]1(c2ccc(F)cc2)C[N@H+](Cc2cccc(Cl)c2)CCO1 ZINC001203801179 1049000162 /nfs/dbraw/zinc/00/01/62/1049000162.db2.gz MEJXELWBPKLEFO-GOSISDBHSA-N 1 2 319.807 4.227 20 0 DIADLO C[C@]1(c2ccc(F)cc2)C[N@@H+](Cc2cccc(Cl)c2)CCO1 ZINC001203801179 1049000176 /nfs/dbraw/zinc/00/01/76/1049000176.db2.gz MEJXELWBPKLEFO-GOSISDBHSA-N 1 2 319.807 4.227 20 0 DIADLO Oc1cc(Cl)cc(CNc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001178253648 1049003720 /nfs/dbraw/zinc/00/37/20/1049003720.db2.gz AHCSNPMKTAADHU-UHFFFAOYSA-N 1 2 317.820 4.043 20 0 DIADLO Nc1ccccc1Nc1cc[nH+]c2cc(Br)ccc12 ZINC001206322515 1049003937 /nfs/dbraw/zinc/00/39/37/1049003937.db2.gz CZUALPINQIBVSX-UHFFFAOYSA-N 1 2 314.186 4.323 20 0 DIADLO Oc1cccc(C[N@@H+]2CCSC[C@H]2c2cccc(Cl)c2)c1 ZINC001203862212 1049017421 /nfs/dbraw/zinc/01/74/21/1049017421.db2.gz BNBDLIHQVGYXCS-KRWDZBQOSA-N 1 2 319.857 4.336 20 0 DIADLO Oc1cccc(C[N@H+]2CCSC[C@H]2c2cccc(Cl)c2)c1 ZINC001203862212 1049017427 /nfs/dbraw/zinc/01/74/27/1049017427.db2.gz BNBDLIHQVGYXCS-KRWDZBQOSA-N 1 2 319.857 4.336 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(Br)cc1C(C)C ZINC001178392921 1049024563 /nfs/dbraw/zinc/02/45/63/1049024563.db2.gz AMOCYLIZNHHODB-UHFFFAOYSA-N 1 2 322.250 4.401 20 0 DIADLO C[C@@H]([NH2+]Cc1cn2cccc(F)c2n1)c1cc(Cl)ccc1F ZINC001178360315 1049026691 /nfs/dbraw/zinc/02/66/91/1049026691.db2.gz MHNUNNWWOJDKEY-SNVBAGLBSA-N 1 2 321.758 4.117 20 0 DIADLO Clc1ccc(C[NH+](Cc2cccnc2)Cc2cccnc2)cc1 ZINC001203921263 1049032381 /nfs/dbraw/zinc/03/23/81/1049032381.db2.gz JKHVCWCAQRHQDS-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2cc(C(F)(F)F)ccc2F)n1 ZINC000113334639 1049033236 /nfs/dbraw/zinc/03/32/36/1049033236.db2.gz KGYQWLDCIDOZBJ-SECBINFHSA-N 1 2 318.339 4.460 20 0 DIADLO c1nc(CNc2[nH+]c3ccccc3n2-c2ccccc2)cs1 ZINC000195052176 1049046140 /nfs/dbraw/zinc/04/61/40/1049046140.db2.gz JZSQGBXKHNZHQK-UHFFFAOYSA-N 1 2 306.394 4.094 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@@H+]1CCC[C@H](CC(C)C)C1 ZINC001192197921 1049052040 /nfs/dbraw/zinc/05/20/40/1049052040.db2.gz HRYANOUCKNXONK-RHSMWYFYSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@H+]1CCC[C@H](CC(C)C)C1 ZINC001192197921 1049052052 /nfs/dbraw/zinc/05/20/52/1049052052.db2.gz HRYANOUCKNXONK-RHSMWYFYSA-N 1 2 323.864 4.312 20 0 DIADLO C[N@H+](CCC(=O)OC(C)(C)C)Cc1cc(Cl)sc1Cl ZINC001192252788 1049058861 /nfs/dbraw/zinc/05/88/61/1049058861.db2.gz LOJNLJAVPQDPKK-UHFFFAOYSA-N 1 2 324.273 4.219 20 0 DIADLO C[N@@H+](CCC(=O)OC(C)(C)C)Cc1cc(Cl)sc1Cl ZINC001192252788 1049058879 /nfs/dbraw/zinc/05/88/79/1049058879.db2.gz LOJNLJAVPQDPKK-UHFFFAOYSA-N 1 2 324.273 4.219 20 0 DIADLO Cc1cn2c(cccc2NC(=O)Nc2ccccc2C(C)C)[nH+]1 ZINC001192218074 1049062211 /nfs/dbraw/zinc/06/22/11/1049062211.db2.gz WNVBBCHTNKUCAP-UHFFFAOYSA-N 1 2 308.385 4.410 20 0 DIADLO Brc1cccc2c1CC[N@H+](Cc1cccs1)C2 ZINC001204015446 1049062720 /nfs/dbraw/zinc/06/27/20/1049062720.db2.gz CJLOJKIBWCSJDR-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1cccc2c1CC[N@@H+](Cc1cccs1)C2 ZINC001204015446 1049062732 /nfs/dbraw/zinc/06/27/32/1049062732.db2.gz CJLOJKIBWCSJDR-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2cc(Br)cs2)C1 ZINC001204026241 1049065905 /nfs/dbraw/zinc/06/59/05/1049065905.db2.gz DCHNHOMXQJHZTC-GFCCVEGCSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2cc(Br)cs2)C1 ZINC001204026241 1049065918 /nfs/dbraw/zinc/06/59/18/1049065918.db2.gz DCHNHOMXQJHZTC-GFCCVEGCSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2cc(Br)cs2)C1 ZINC001204026242 1049066422 /nfs/dbraw/zinc/06/64/22/1049066422.db2.gz DCHNHOMXQJHZTC-LBPRGKRZSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2cc(Br)cs2)C1 ZINC001204026242 1049066435 /nfs/dbraw/zinc/06/64/35/1049066435.db2.gz DCHNHOMXQJHZTC-LBPRGKRZSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@@H](c1nc(C(C)(C)c2ccc3ccccc3c2)no1)[NH+](C)C ZINC000867071476 1049070846 /nfs/dbraw/zinc/07/08/46/1049070846.db2.gz ZZLPNIKJZBWUBU-ZDUSSCGKSA-N 1 2 309.413 4.171 20 0 DIADLO CC(C)CCc1ccccc1NC(=O)c1cccc2[nH+]ccn21 ZINC000776862988 1049072649 /nfs/dbraw/zinc/07/26/49/1049072649.db2.gz PDGGHWYOJLDGHM-UHFFFAOYSA-N 1 2 307.397 4.175 20 0 DIADLO CC(C)Oc1cc(C[N@H+](Cc2ccccc2F)C2CC2)ccn1 ZINC001192281999 1049073406 /nfs/dbraw/zinc/07/34/06/1049073406.db2.gz FJOWQPSASLNWTP-UHFFFAOYSA-N 1 2 314.404 4.173 20 0 DIADLO CC(C)Oc1cc(C[N@@H+](Cc2ccccc2F)C2CC2)ccn1 ZINC001192281999 1049073421 /nfs/dbraw/zinc/07/34/21/1049073421.db2.gz FJOWQPSASLNWTP-UHFFFAOYSA-N 1 2 314.404 4.173 20 0 DIADLO C[C@H]([NH2+]Cc1cc2cc(Cl)cnc2o1)c1c(F)cncc1F ZINC001178688064 1049074584 /nfs/dbraw/zinc/07/45/84/1049074584.db2.gz AEGCLJDLQSWOSF-QMMMGPOBSA-N 1 2 323.730 4.005 20 0 DIADLO COc1cc(C)[nH+]c(CN2CC=C(c3cc(C)cc(C)c3)CC2)c1 ZINC001192292519 1049076511 /nfs/dbraw/zinc/07/65/11/1049076511.db2.gz VSVWMHVSGRMTQM-UHFFFAOYSA-N 1 2 322.452 4.305 20 0 DIADLO Clc1cccc([C@@H]2CSCC[N@@H+]2Cc2cccnc2)c1 ZINC001204075712 1049079195 /nfs/dbraw/zinc/07/91/95/1049079195.db2.gz RBYMNPDCWQYRKV-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cccc([C@@H]2CSCC[N@H+]2Cc2cccnc2)c1 ZINC001204075712 1049079207 /nfs/dbraw/zinc/07/92/07/1049079207.db2.gz RBYMNPDCWQYRKV-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Cc1noc([C@H]([NH2+]Cc2cc(C(C)(C)C)oc2C)C(C)C)n1 ZINC001204128130 1049090227 /nfs/dbraw/zinc/09/02/27/1049090227.db2.gz IJHGGBAWHPNKQM-OAHLLOKOSA-N 1 2 305.422 4.064 20 0 DIADLO Cc1ccnc(C[N@@H+]2CC[C@H]2c2ccccc2)c1Br ZINC001204144890 1049097760 /nfs/dbraw/zinc/09/77/60/1049097760.db2.gz KYAOTSXCLHSHER-HNNXBMFYSA-N 1 2 317.230 4.100 20 0 DIADLO Cc1ccnc(C[N@H+]2CC[C@H]2c2ccccc2)c1Br ZINC001204144890 1049097772 /nfs/dbraw/zinc/09/77/72/1049097772.db2.gz KYAOTSXCLHSHER-HNNXBMFYSA-N 1 2 317.230 4.100 20 0 DIADLO C[C@H](NC(=O)c1cccc2[nH+]ccn21)c1csc2ccccc21 ZINC000776895536 1049100607 /nfs/dbraw/zinc/10/06/07/1049100607.db2.gz CDAHMMCBYZTTEP-LBPRGKRZSA-N 1 2 321.405 4.040 20 0 DIADLO COc1cc2c(cc1OC)C[NH+](Cc1ccc(C(C)C)cc1)C2 ZINC001204169249 1049103198 /nfs/dbraw/zinc/10/31/98/1049103198.db2.gz LHBYQLIWQOSHQN-UHFFFAOYSA-N 1 2 311.425 4.343 20 0 DIADLO C[C@@H]([NH2+]Cc1cn(C)nc1Cl)c1cccc(Cl)c1Cl ZINC000856770152 1049103871 /nfs/dbraw/zinc/10/38/71/1049103871.db2.gz NLKPZENMRXCNMZ-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO FC1(F)CCC[C@H]1[NH2+]Cc1cc2nc(Cl)ccc2s1 ZINC001178859636 1049104817 /nfs/dbraw/zinc/10/48/17/1049104817.db2.gz CNXFYCKAPLDJFR-LLVKDONJSA-N 1 2 302.777 4.227 20 0 DIADLO CCc1ccc(C[N@H+](Cc2cccnc2)Cc2ccccn2)cc1 ZINC001204177326 1049105291 /nfs/dbraw/zinc/10/52/91/1049105291.db2.gz PGBVHVSVJRIGPS-UHFFFAOYSA-N 1 2 317.436 4.241 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2cccnc2)Cc2ccccn2)cc1 ZINC001204177326 1049105293 /nfs/dbraw/zinc/10/52/93/1049105293.db2.gz PGBVHVSVJRIGPS-UHFFFAOYSA-N 1 2 317.436 4.241 20 0 DIADLO OC[C@H]([NH2+]Cc1cc(Cl)sc1Cl)c1cccc(F)c1 ZINC001192461798 1049109507 /nfs/dbraw/zinc/10/95/07/1049109507.db2.gz YHUOFTVTWGWASK-NSHDSACASA-N 1 2 320.216 4.017 20 0 DIADLO OC[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1cccc(F)c1 ZINC001192461796 1049109675 /nfs/dbraw/zinc/10/96/75/1049109675.db2.gz YHUOFTVTWGWASK-LLVKDONJSA-N 1 2 320.216 4.017 20 0 DIADLO Fc1cccc(F)c1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC001204205480 1049111922 /nfs/dbraw/zinc/11/19/22/1049111922.db2.gz WIOKCEYAOVQWDL-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1cccc(F)c1C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC001204205480 1049111932 /nfs/dbraw/zinc/11/19/32/1049111932.db2.gz WIOKCEYAOVQWDL-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO Cc1cnc(C[NH2+]C(C)(C)c2ccc(OCC(C)C)cc2)o1 ZINC000173352828 1049113410 /nfs/dbraw/zinc/11/34/10/1049113410.db2.gz KPDBNAMHQVXRQE-UHFFFAOYSA-N 1 2 302.418 4.043 20 0 DIADLO Fc1cccc(C(F)(F)C[NH2+]Cc2cccc3c2CCC3)c1 ZINC001179099835 1049126572 /nfs/dbraw/zinc/12/65/72/1049126572.db2.gz GQBAFNDFIIVGCS-UHFFFAOYSA-N 1 2 305.343 4.196 20 0 DIADLO Fc1ccc(C[N@@H+]2CC[C@H]2COCc2ccccc2)cc1Cl ZINC001204284680 1049127689 /nfs/dbraw/zinc/12/76/89/1049127689.db2.gz PKACELIVQJMKST-INIZCTEOSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1ccc(C[N@H+]2CC[C@H]2COCc2ccccc2)cc1Cl ZINC001204284680 1049127697 /nfs/dbraw/zinc/12/76/97/1049127697.db2.gz PKACELIVQJMKST-INIZCTEOSA-N 1 2 319.807 4.270 20 0 DIADLO CCCCCCOc1ccccc1C[N@@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001204294985 1049132025 /nfs/dbraw/zinc/13/20/25/1049132025.db2.gz XOQMERUMDFRNFO-QZTJIDSGSA-N 1 2 303.446 4.009 20 0 DIADLO CCCCCCOc1ccccc1C[N@H+]1C[C@H]2CC[C@@H]1CO2 ZINC001204294985 1049132033 /nfs/dbraw/zinc/13/20/33/1049132033.db2.gz XOQMERUMDFRNFO-QZTJIDSGSA-N 1 2 303.446 4.009 20 0 DIADLO CCCCCCOc1ccccc1C[N@@H+]1CCOCC12CC2 ZINC001204293851 1049132639 /nfs/dbraw/zinc/13/26/39/1049132639.db2.gz JZAPJEZLSGSRGP-UHFFFAOYSA-N 1 2 303.446 4.011 20 0 DIADLO CCCCCCOc1ccccc1C[N@H+]1CCOCC12CC2 ZINC001204293851 1049132644 /nfs/dbraw/zinc/13/26/44/1049132644.db2.gz JZAPJEZLSGSRGP-UHFFFAOYSA-N 1 2 303.446 4.011 20 0 DIADLO CCCCCOc1ccc(C[NH+]2CC3(C2)CCCCO3)cc1 ZINC001204310762 1049139063 /nfs/dbraw/zinc/13/90/63/1049139063.db2.gz DWUXELWNXAXVQQ-UHFFFAOYSA-N 1 2 303.446 4.011 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3ncc(C(F)(F)F)cc3C2)cc1C ZINC001204354819 1049146668 /nfs/dbraw/zinc/14/66/68/1049146668.db2.gz MTXHAKKYCYYUTL-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3ncc(C(F)(F)F)cc3C2)cc1C ZINC001204354819 1049146676 /nfs/dbraw/zinc/14/66/76/1049146676.db2.gz MTXHAKKYCYYUTL-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Fc1cccc(F)c1C1([NH2+]Cc2cccc3c2OCC3)CCC1 ZINC001179295532 1049150503 /nfs/dbraw/zinc/15/05/03/1049150503.db2.gz OGUBQVCUBXEVGR-UHFFFAOYSA-N 1 2 315.363 4.069 20 0 DIADLO FC(F)(F)Oc1ccccc1C[N@@H+]1CCc2ccsc2C1 ZINC001204424950 1049159805 /nfs/dbraw/zinc/15/98/05/1049159805.db2.gz HZECKDZGSULFPI-UHFFFAOYSA-N 1 2 313.344 4.205 20 0 DIADLO FC(F)(F)Oc1ccccc1C[N@H+]1CCc2ccsc2C1 ZINC001204424950 1049159811 /nfs/dbraw/zinc/15/98/11/1049159811.db2.gz HZECKDZGSULFPI-UHFFFAOYSA-N 1 2 313.344 4.205 20 0 DIADLO c1nc(CCc2ccccc2)sc1C[NH+]1Cc2ccccc2C1 ZINC001204462315 1049167990 /nfs/dbraw/zinc/16/79/90/1049167990.db2.gz YTCNOTFQNJQPFK-UHFFFAOYSA-N 1 2 320.461 4.444 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2c(F)cccc2C(F)(F)F)cn1 ZINC001204464794 1049168309 /nfs/dbraw/zinc/16/83/09/1049168309.db2.gz PWHPCTUDKGIZQT-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2c(F)cccc2C(F)(F)F)cn1 ZINC001204464794 1049168317 /nfs/dbraw/zinc/16/83/17/1049168317.db2.gz PWHPCTUDKGIZQT-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1c(F)cccc1C(F)(F)F ZINC001204465463 1049168598 /nfs/dbraw/zinc/16/85/98/1049168598.db2.gz JQUMLKRMVNJULK-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1c(F)cccc1C(F)(F)F ZINC001204465463 1049168604 /nfs/dbraw/zinc/16/86/04/1049168604.db2.gz JQUMLKRMVNJULK-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](C)c2cccc(O)c2)c2ccccn21 ZINC000568755231 1049168812 /nfs/dbraw/zinc/16/88/12/1049168812.db2.gz TWTVFLHSCSAOHU-AWEZNQCLSA-N 1 2 309.413 4.014 20 0 DIADLO Fc1cc(C(F)(F)F)ccc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC001204462938 1049169088 /nfs/dbraw/zinc/16/90/88/1049169088.db2.gz BILSJQCZSSOAAY-UHFFFAOYSA-N 1 2 309.253 4.076 20 0 DIADLO CC[C@@H](CNc1[nH+]c2ccccc2n1CCOC)c1ccccc1 ZINC001179489485 1049170437 /nfs/dbraw/zinc/17/04/37/1049170437.db2.gz PWNKXFIESOFALN-INIZCTEOSA-N 1 2 323.440 4.288 20 0 DIADLO Cc1nc(CNc2[nH+]c3ccccc3n2C2CCCCC2)[nH]c1C ZINC001179473171 1049170556 /nfs/dbraw/zinc/17/05/56/1049170556.db2.gz QAOHTHGWUWSYGA-UHFFFAOYSA-N 1 2 323.444 4.494 20 0 DIADLO c1ccc2c(c1)[nH+]c(NC[C@H]1CCSC1)n2C1CCCC1 ZINC001179479534 1049170622 /nfs/dbraw/zinc/17/06/22/1049170622.db2.gz OQHAQWAVGCBAHM-CYBMUJFWSA-N 1 2 301.459 4.316 20 0 DIADLO CN(C)c1ccc(F)cc1CNc1[nH]c2ccc(Cl)cc2[nH+]1 ZINC001179516058 1049172699 /nfs/dbraw/zinc/17/26/99/1049172699.db2.gz PWPUYWVNDGDVOP-UHFFFAOYSA-N 1 2 318.783 4.034 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2c(F)cc(Br)cc2F)CC1 ZINC001204497975 1049177247 /nfs/dbraw/zinc/17/72/47/1049177247.db2.gz VNKYXCHXRGVAGM-JTQLQIEISA-N 1 2 318.205 4.349 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2c(F)cc(Br)cc2F)CC1 ZINC001204497975 1049177257 /nfs/dbraw/zinc/17/72/57/1049177257.db2.gz VNKYXCHXRGVAGM-JTQLQIEISA-N 1 2 318.205 4.349 20 0 DIADLO CCCOc1ccc(C[NH2+][C@H]2c3ccccc3OC[C@@H]2F)cc1 ZINC001179578857 1049178893 /nfs/dbraw/zinc/17/88/93/1049178893.db2.gz AQTVYSODUMGRQZ-HKUYNNGSSA-N 1 2 315.388 4.037 20 0 DIADLO Cc1nccc2c(NCc3ccc(-n4cc[nH+]c4)cc3)cccc12 ZINC001179588617 1049180630 /nfs/dbraw/zinc/18/06/30/1049180630.db2.gz IVWAWZWGLQARCH-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)c(F)c(F)c2)cn1 ZINC001204529657 1049183146 /nfs/dbraw/zinc/18/31/46/1049183146.db2.gz LFZRLEBBKOGUKO-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)c(F)c(F)c2)cn1 ZINC001204529657 1049183151 /nfs/dbraw/zinc/18/31/51/1049183151.db2.gz LFZRLEBBKOGUKO-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1ccc([C@H]2CCCCN2C(=O)c2cccc3[nH+]ccn32)cc1 ZINC000776952830 1049184819 /nfs/dbraw/zinc/18/48/19/1049184819.db2.gz CHEOTTHIWVFVNF-QGZVFWFLSA-N 1 2 319.408 4.010 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCOC[C@H]2c2ccccc2)s1 ZINC001204550768 1049188049 /nfs/dbraw/zinc/18/80/49/1049188049.db2.gz IFSVULRQGFSWCX-SFHVURJKSA-N 1 2 301.455 4.274 20 0 DIADLO CCCc1ccc(C[N@H+]2CCOC[C@H]2c2ccccc2)s1 ZINC001204550768 1049188057 /nfs/dbraw/zinc/18/80/57/1049188057.db2.gz IFSVULRQGFSWCX-SFHVURJKSA-N 1 2 301.455 4.274 20 0 DIADLO CCc1nc(CNc2[nH+]c3ccccc3n2CC2CC2)cs1 ZINC001179631929 1049190085 /nfs/dbraw/zinc/19/00/85/1049190085.db2.gz XRVYIWSDJZRZIH-UHFFFAOYSA-N 1 2 312.442 4.077 20 0 DIADLO COC(=O)c1occc1C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000339006221 1049193686 /nfs/dbraw/zinc/19/36/86/1049193686.db2.gz YIZFPFMEFDZBSM-HNNXBMFYSA-N 1 2 319.788 4.057 20 0 DIADLO COC(=O)c1occc1C[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000339006221 1049193689 /nfs/dbraw/zinc/19/36/89/1049193689.db2.gz YIZFPFMEFDZBSM-HNNXBMFYSA-N 1 2 319.788 4.057 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cc(C(F)(F)F)co1 ZINC001193293647 1049195314 /nfs/dbraw/zinc/19/53/14/1049195314.db2.gz OVOPALBDBAUKNK-DTWKUNHWSA-N 1 2 315.257 4.461 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cc(C(F)(F)F)co1 ZINC001193293647 1049195323 /nfs/dbraw/zinc/19/53/23/1049195323.db2.gz OVOPALBDBAUKNK-DTWKUNHWSA-N 1 2 315.257 4.461 20 0 DIADLO COCOc1cc(C)c(-c2ccc(Cn3cc[nH+]c3)cc2)c(C)c1 ZINC001204605145 1049198880 /nfs/dbraw/zinc/19/88/80/1049198880.db2.gz JKJFXLDTZRNRDH-UHFFFAOYSA-N 1 2 322.408 4.198 20 0 DIADLO COCOc1cc(C)c(-c2cccc(-c3c[nH+]cn3C)c2)c(C)c1 ZINC001204612646 1049200021 /nfs/dbraw/zinc/20/00/21/1049200021.db2.gz PQIFMHSXRAWEDU-UHFFFAOYSA-N 1 2 322.408 4.354 20 0 DIADLO Cc1ccc(C[S@@](=O)Cc2ccccc2CC(C)C)c(C)[nH+]1 ZINC000905193974 1049200750 /nfs/dbraw/zinc/20/07/50/1049200750.db2.gz FQGKRYUWOJJBOQ-JOCHJYFZSA-N 1 2 315.482 4.346 20 0 DIADLO Cc1ccc2cc(C[N@H+]3C[C@@H](C)OC[C@@H]3c3ccccc3)[nH]c2c1 ZINC001204615837 1049201283 /nfs/dbraw/zinc/20/12/83/1049201283.db2.gz MFQBRSLZBZTRRG-IIBYNOLFSA-N 1 2 320.436 4.438 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3C[C@@H](C)OC[C@@H]3c3ccccc3)[nH]c2c1 ZINC001204615837 1049201290 /nfs/dbraw/zinc/20/12/90/1049201290.db2.gz MFQBRSLZBZTRRG-IIBYNOLFSA-N 1 2 320.436 4.438 20 0 DIADLO Fc1ccc([C@H]([NH2+][C@H]2CCCc3cn[nH]c32)c2ccccc2)cc1 ZINC000857850490 1049201501 /nfs/dbraw/zinc/20/15/01/1049201501.db2.gz STRCXJWGMDOQES-RBUKOAKNSA-N 1 2 321.399 4.305 20 0 DIADLO Fc1ccc([C@H]([NH2+][C@H]2CCCc3c[nH]nc32)c2ccccc2)cc1 ZINC000857850490 1049201511 /nfs/dbraw/zinc/20/15/11/1049201511.db2.gz STRCXJWGMDOQES-RBUKOAKNSA-N 1 2 321.399 4.305 20 0 DIADLO Fc1cccc([C@@H]([NH2+][C@@H]2CCCc3cn[nH]c32)c2ccccc2)c1 ZINC000857857431 1049201908 /nfs/dbraw/zinc/20/19/08/1049201908.db2.gz UFWXMVFHASTSHC-MOPGFXCFSA-N 1 2 321.399 4.305 20 0 DIADLO Fc1cccc([C@@H]([NH2+][C@@H]2CCCc3c[nH]nc32)c2ccccc2)c1 ZINC000857857431 1049201918 /nfs/dbraw/zinc/20/19/18/1049201918.db2.gz UFWXMVFHASTSHC-MOPGFXCFSA-N 1 2 321.399 4.305 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2ccc(Cl)nc21)c1c(F)cccc1F ZINC000857902901 1049206439 /nfs/dbraw/zinc/20/64/39/1049206439.db2.gz WUNDMYUSTSFODY-ZANVPECISA-N 1 2 308.759 4.351 20 0 DIADLO CC[N@H+](Cc1ncsc1Br)[C@H]1CCCC[C@@H]1C ZINC001193412824 1049208773 /nfs/dbraw/zinc/20/87/73/1049208773.db2.gz HWPWIOUEKHLGJV-JQWIXIFHSA-N 1 2 317.296 4.306 20 0 DIADLO CC[N@@H+](Cc1ncsc1Br)[C@H]1CCCC[C@@H]1C ZINC001193412824 1049208783 /nfs/dbraw/zinc/20/87/83/1049208783.db2.gz HWPWIOUEKHLGJV-JQWIXIFHSA-N 1 2 317.296 4.306 20 0 DIADLO Oc1ccc(F)c(C[N@@H+](Cc2ccc(F)cc2)CC2CC2)c1F ZINC001204651512 1049210593 /nfs/dbraw/zinc/21/05/93/1049210593.db2.gz PLOQDOAMDLIIOZ-UHFFFAOYSA-N 1 2 321.342 4.222 20 0 DIADLO Oc1ccc(F)c(C[N@H+](Cc2ccc(F)cc2)CC2CC2)c1F ZINC001204651512 1049210604 /nfs/dbraw/zinc/21/06/04/1049210604.db2.gz PLOQDOAMDLIIOZ-UHFFFAOYSA-N 1 2 321.342 4.222 20 0 DIADLO CCC[C@H]1CCCC[C@@H]1CNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001204649152 1049211695 /nfs/dbraw/zinc/21/16/95/1049211695.db2.gz RSIGTXGJAHPYNJ-LSDHHAIUSA-N 1 2 314.433 4.062 20 0 DIADLO CC(C)[N@H+](Cc1ccccc1F)Cc1ccc(O)c(F)c1F ZINC001179913692 1049237544 /nfs/dbraw/zinc/23/75/44/1049237544.db2.gz DTNBEFHZVYSRBO-UHFFFAOYSA-N 1 2 309.331 4.220 20 0 DIADLO CC(C)[N@@H+](Cc1ccccc1F)Cc1ccc(O)c(F)c1F ZINC001179913692 1049237554 /nfs/dbraw/zinc/23/75/54/1049237554.db2.gz DTNBEFHZVYSRBO-UHFFFAOYSA-N 1 2 309.331 4.220 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3Cl)o2)CCC1=O ZINC001204718146 1049239237 /nfs/dbraw/zinc/23/92/37/1049239237.db2.gz WECKQBDCMJRXCR-GFCCVEGCSA-N 1 2 303.789 4.011 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)CCC1=O ZINC001204718146 1049239248 /nfs/dbraw/zinc/23/92/48/1049239248.db2.gz WECKQBDCMJRXCR-GFCCVEGCSA-N 1 2 303.789 4.011 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(-c3ccccc3Cl)o2)CCC1=O ZINC001204738573 1049247034 /nfs/dbraw/zinc/24/70/34/1049247034.db2.gz IZTZPOAYLURAPU-UHFFFAOYSA-N 1 2 317.816 4.401 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)CCC1=O ZINC001204738573 1049247043 /nfs/dbraw/zinc/24/70/43/1049247043.db2.gz IZTZPOAYLURAPU-UHFFFAOYSA-N 1 2 317.816 4.401 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2cc(F)ncc2F)o1 ZINC001179955944 1049249313 /nfs/dbraw/zinc/24/93/13/1049249313.db2.gz BWNCCIYGWQGTBO-IAQYHMDHSA-N 1 2 306.356 4.234 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2cc(F)ncc2F)o1 ZINC001179955944 1049249324 /nfs/dbraw/zinc/24/93/24/1049249324.db2.gz BWNCCIYGWQGTBO-IAQYHMDHSA-N 1 2 306.356 4.234 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2scnc21)c1nc2ccccc2s1 ZINC000858365580 1049249644 /nfs/dbraw/zinc/24/96/44/1049249644.db2.gz PEMIFJSMMORGQA-CMPLNLGQSA-N 1 2 315.467 4.481 20 0 DIADLO C[N@H+](Cc1ccc(-c2ccccc2Cl)o1)Cc1cncnc1 ZINC001204746297 1049250511 /nfs/dbraw/zinc/25/05/11/1049250511.db2.gz WNDFNKAIAOXXST-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1ccc(-c2ccccc2Cl)o1)Cc1cncnc1 ZINC001204746297 1049250520 /nfs/dbraw/zinc/25/05/20/1049250520.db2.gz WNDFNKAIAOXXST-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO COc1c(C)c[nH+]c(CN2CCCc3cc(Cl)ccc32)c1C ZINC001193734465 1049250489 /nfs/dbraw/zinc/25/04/89/1049250489.db2.gz KSPGXMZSAMUMDT-UHFFFAOYSA-N 1 2 316.832 4.313 20 0 DIADLO Clc1csc(C[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)n1 ZINC001179965884 1049252367 /nfs/dbraw/zinc/25/23/67/1049252367.db2.gz BOCAIUSADHKILG-CQSZACIVSA-N 1 2 304.846 4.448 20 0 DIADLO CO[C@@]1(C)C[C@@H]([N@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001179962128 1049252251 /nfs/dbraw/zinc/25/22/51/1049252251.db2.gz LHQVTOBRLAFDBI-DOMZBBRYSA-N 1 2 317.260 4.024 20 0 DIADLO CO[C@@]1(C)C[C@@H]([N@@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001179962128 1049252262 /nfs/dbraw/zinc/25/22/62/1049252262.db2.gz LHQVTOBRLAFDBI-DOMZBBRYSA-N 1 2 317.260 4.024 20 0 DIADLO Clc1csc(C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)n1 ZINC001179965884 1049252350 /nfs/dbraw/zinc/25/23/50/1049252350.db2.gz BOCAIUSADHKILG-CQSZACIVSA-N 1 2 304.846 4.448 20 0 DIADLO Cc1cc(F)cc2c1C[N@H+](Cc1nsc3ccccc31)CC2 ZINC001193773281 1049255264 /nfs/dbraw/zinc/25/52/64/1049255264.db2.gz PPUPJBCJBGVUNI-UHFFFAOYSA-N 1 2 312.413 4.302 20 0 DIADLO Cc1cc(F)cc2c1C[N@@H+](Cc1nsc3ccccc31)CC2 ZINC001193773281 1049255277 /nfs/dbraw/zinc/25/52/77/1049255277.db2.gz PPUPJBCJBGVUNI-UHFFFAOYSA-N 1 2 312.413 4.302 20 0 DIADLO C[C@H]1C[NH+](Cc2ccc(F)c(Cl)c2Cl)C[C@H](C)S1 ZINC001180025317 1049261519 /nfs/dbraw/zinc/26/15/19/1049261519.db2.gz ZOKZEJMLSJEXGW-IUCAKERBSA-N 1 2 308.249 4.458 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2cc(O)ccc2Cl)C1 ZINC001193797692 1049264700 /nfs/dbraw/zinc/26/47/00/1049264700.db2.gz NLXUKZATPORBRM-GOSISDBHSA-N 1 2 319.807 4.425 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2cc(O)ccc2Cl)C1 ZINC001193797692 1049264714 /nfs/dbraw/zinc/26/47/14/1049264714.db2.gz NLXUKZATPORBRM-GOSISDBHSA-N 1 2 319.807 4.425 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCc3c(F)cc(F)cc3C2)cc1 ZINC001204796453 1049267538 /nfs/dbraw/zinc/26/75/38/1049267538.db2.gz PWCIOYXRAPIIAV-OWOJBTEDSA-N 1 2 303.327 4.175 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCc3c(F)cc(F)cc3C2)cc1 ZINC001204796453 1049267554 /nfs/dbraw/zinc/26/75/54/1049267554.db2.gz PWCIOYXRAPIIAV-OWOJBTEDSA-N 1 2 303.327 4.175 20 0 DIADLO C[C@@H]1C[N@H+](C/C=C/c2cccc(F)c2)C[C@@H](c2ccsc2)O1 ZINC001180076302 1049273173 /nfs/dbraw/zinc/27/31/73/1049273173.db2.gz DMUZICPPCWEHEV-GITZNGSGSA-N 1 2 317.429 4.362 20 0 DIADLO C[C@@H]1C[N@@H+](C/C=C/c2cccc(F)c2)C[C@@H](c2ccsc2)O1 ZINC001180076302 1049273189 /nfs/dbraw/zinc/27/31/89/1049273189.db2.gz DMUZICPPCWEHEV-GITZNGSGSA-N 1 2 317.429 4.362 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)o1 ZINC001204816062 1049274998 /nfs/dbraw/zinc/27/49/98/1049274998.db2.gz GCFYIXNWQKYJAA-MRXNPFEDSA-N 1 2 307.340 4.294 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)o1 ZINC001204816062 1049275002 /nfs/dbraw/zinc/27/50/02/1049275002.db2.gz GCFYIXNWQKYJAA-MRXNPFEDSA-N 1 2 307.340 4.294 20 0 DIADLO Cc1coc(C[N@H+]2Cc3cc(Br)ccc3C[C@H]2C)c1 ZINC001180133202 1049278896 /nfs/dbraw/zinc/27/88/96/1049278896.db2.gz RNSRILLNVZRHNV-GFCCVEGCSA-N 1 2 320.230 4.297 20 0 DIADLO Cc1coc(C[N@@H+]2Cc3cc(Br)ccc3C[C@H]2C)c1 ZINC001180133202 1049278906 /nfs/dbraw/zinc/27/89/06/1049278906.db2.gz RNSRILLNVZRHNV-GFCCVEGCSA-N 1 2 320.230 4.297 20 0 DIADLO C[C@@H]1C[N@H+](CCc2cc(Cl)cc(Cl)c2)C[C@H](C2CC2)O1 ZINC001193974865 1049289494 /nfs/dbraw/zinc/28/94/94/1049289494.db2.gz DMTLLVAAVFKGMP-BDJLRTHQSA-N 1 2 314.256 4.035 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2cc(Cl)cc(Cl)c2)C[C@H](C2CC2)O1 ZINC001193974865 1049289505 /nfs/dbraw/zinc/28/95/05/1049289505.db2.gz DMTLLVAAVFKGMP-BDJLRTHQSA-N 1 2 314.256 4.035 20 0 DIADLO CCCC[C@@H](CC)COC(=O)NCc1c[nH+]cn1C1CCC1 ZINC001193979953 1049290712 /nfs/dbraw/zinc/29/07/12/1049290712.db2.gz BADFFOSLUBHRKJ-CQSZACIVSA-N 1 2 307.438 4.051 20 0 DIADLO C[C@@H]1C[N@H+](CCc2c(Cl)cccc2Cl)C[C@H](C2CC2)O1 ZINC001193976904 1049291230 /nfs/dbraw/zinc/29/12/30/1049291230.db2.gz NBFRJLFEGDDBQN-BDJLRTHQSA-N 1 2 314.256 4.035 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)C[C@H](C2CC2)O1 ZINC001193976904 1049291243 /nfs/dbraw/zinc/29/12/43/1049291243.db2.gz NBFRJLFEGDDBQN-BDJLRTHQSA-N 1 2 314.256 4.035 20 0 DIADLO C[N@@H+](Cc1cccc(F)c1N)Cc1ccc(Cl)cc1Cl ZINC001204869618 1049291340 /nfs/dbraw/zinc/29/13/40/1049291340.db2.gz FXHPMYNTAXQFBO-UHFFFAOYSA-N 1 2 313.203 4.347 20 0 DIADLO C[N@H+](Cc1cccc(F)c1N)Cc1ccc(Cl)cc1Cl ZINC001204869618 1049291352 /nfs/dbraw/zinc/29/13/52/1049291352.db2.gz FXHPMYNTAXQFBO-UHFFFAOYSA-N 1 2 313.203 4.347 20 0 DIADLO CCCC[C@H](CC)COC(=O)NCc1c[nH+]c2ccc(C)cn12 ZINC001193977376 1049291590 /nfs/dbraw/zinc/29/15/90/1049291590.db2.gz WFHQZJYGMOHNBS-HNNXBMFYSA-N 1 2 317.433 4.085 20 0 DIADLO c1cn2ccc(-c3cccc4c3cnn4[C@@H]3CCCCO3)cc2[nH+]1 ZINC001204874176 1049293114 /nfs/dbraw/zinc/29/31/14/1049293114.db2.gz NQAWQDQTKWANEA-IBGZPJMESA-N 1 2 318.380 4.050 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)Oc1ccc(Cl)cc1 ZINC001194024570 1049302055 /nfs/dbraw/zinc/30/20/55/1049302055.db2.gz LEQKQZFWRBTMNK-UHFFFAOYSA-N 1 2 313.744 4.137 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2cc(C)cc(C)n2)c2ccccn2)cc1 ZINC001194051868 1049308242 /nfs/dbraw/zinc/30/82/42/1049308242.db2.gz KADFZMARCVCHQB-NRFANRHFSA-N 1 2 317.436 4.281 20 0 DIADLO CCc1ccc([N@H+](CCc2ccc(C(N)=O)cc2)CC(C)C)cc1 ZINC001194066367 1049312985 /nfs/dbraw/zinc/31/29/85/1049312985.db2.gz IJZVTTLLYSTRLY-UHFFFAOYSA-N 1 2 324.468 4.053 20 0 DIADLO CCc1ccc([N@@H+](CCc2ccc(C(N)=O)cc2)CC(C)C)cc1 ZINC001194066367 1049312990 /nfs/dbraw/zinc/31/29/90/1049312990.db2.gz IJZVTTLLYSTRLY-UHFFFAOYSA-N 1 2 324.468 4.053 20 0 DIADLO CC[C@@H]1CCC[N@H+](Cc2c(F)cc(Br)cc2F)C1 ZINC001180199834 1049314683 /nfs/dbraw/zinc/31/46/83/1049314683.db2.gz ZFOVAWYLKUUXJA-SNVBAGLBSA-N 1 2 318.205 4.349 20 0 DIADLO CC[C@@H]1CCC[N@@H+](Cc2c(F)cc(Br)cc2F)C1 ZINC001180199834 1049314694 /nfs/dbraw/zinc/31/46/94/1049314694.db2.gz ZFOVAWYLKUUXJA-SNVBAGLBSA-N 1 2 318.205 4.349 20 0 DIADLO Fc1cc(Cl)cc(C[NH2+]Cc2coc(-c3cccs3)n2)c1 ZINC000485683367 1049316660 /nfs/dbraw/zinc/31/66/60/1049316660.db2.gz IKBUUUKKMPSKPU-UHFFFAOYSA-N 1 2 322.792 4.485 20 0 DIADLO FC(F)(F)c1cc(Nc2ccn3cc[nH+]c3c2)cnc1Cl ZINC001204958714 1049322211 /nfs/dbraw/zinc/32/22/11/1049322211.db2.gz AUHHYBZALMUBNA-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1ccc(C2CC2)cc1 ZINC001194149793 1049329849 /nfs/dbraw/zinc/32/98/49/1049329849.db2.gz IXLXCEBGPUJCTI-UHFFFAOYSA-N 1 2 303.365 4.002 20 0 DIADLO Fc1cc(F)c(C(F)(F)F)cc1Nc1ccn2cc[nH+]c2c1 ZINC001204982768 1049331699 /nfs/dbraw/zinc/33/16/99/1049331699.db2.gz IIHKOZJYFONUAV-UHFFFAOYSA-N 1 2 313.229 4.375 20 0 DIADLO Cc1ccc(Nc2ccn3cc[nH+]c3c2)cc1Br ZINC001204983015 1049331799 /nfs/dbraw/zinc/33/17/99/1049331799.db2.gz LOXLWIIBJYYFLK-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO C[C@@H]1C[NH+](Cc2cc(Cl)nc(Cl)c2)C[C@@H](C)C1(F)F ZINC000859410662 1049332674 /nfs/dbraw/zinc/33/26/74/1049332674.db2.gz DCNTWXSWZDWWOK-RKDXNWHRSA-N 1 2 309.187 4.112 20 0 DIADLO FC(F)(Cl)Oc1ccc(Nc2ccn3cc[nH+]c3c2)cc1 ZINC001204991219 1049332928 /nfs/dbraw/zinc/33/29/28/1049332928.db2.gz MCRMRCRUXLBEOF-UHFFFAOYSA-N 1 2 309.703 4.246 20 0 DIADLO Cc1ccc2ncc(C[NH2+][C@@H](C)c3c(F)cncc3F)cc2c1 ZINC001194164700 1049333855 /nfs/dbraw/zinc/33/38/55/1049333855.db2.gz MCBSZEVPMUQNPF-LBPRGKRZSA-N 1 2 313.351 4.067 20 0 DIADLO FC(F)(F)COc1ccccc1Nc1ccn2cc[nH+]c2c1 ZINC001204991143 1049334038 /nfs/dbraw/zinc/33/40/38/1049334038.db2.gz LJQLEQYSHUVJRW-UHFFFAOYSA-N 1 2 307.275 4.019 20 0 DIADLO COc1cc2[nH+]c(C[C@H](C)CCCC(C)(C)O)[nH]c2cc1Cl ZINC001250556712 1049334736 /nfs/dbraw/zinc/33/47/36/1049334736.db2.gz QEOPOOFWAMEDCX-LLVKDONJSA-N 1 2 324.852 4.345 20 0 DIADLO Clc1ccc(Cl)c(C[NH2+][C@H](c2ccccn2)C2CCC2)n1 ZINC000859564787 1049339521 /nfs/dbraw/zinc/33/95/21/1049339521.db2.gz ONNSXFLSLXRLOH-INIZCTEOSA-N 1 2 322.239 4.414 20 0 DIADLO COc1ccc(-c2ccccc2Nc2ccn3cc[nH+]c3c2)nc1 ZINC001205006145 1049339836 /nfs/dbraw/zinc/33/98/36/1049339836.db2.gz UGSQRODSJLCLCP-UHFFFAOYSA-N 1 2 316.364 4.149 20 0 DIADLO Cc1ccc(Nc2ccnc(NC(=O)OC(C)(C)C)c2)c(C)[nH+]1 ZINC001203362554 1049357197 /nfs/dbraw/zinc/35/71/97/1049357197.db2.gz BFXYYIWOKYKNOR-UHFFFAOYSA-N 1 2 314.389 4.184 20 0 DIADLO c1csc([C@H]2c3ccsc3CC[N@H+]2Cc2ccns2)c1 ZINC001180586729 1049385382 /nfs/dbraw/zinc/38/53/82/1049385382.db2.gz WWYNZXDCTFHVGP-OAHLLOKOSA-N 1 2 318.492 4.414 20 0 DIADLO c1csc([C@H]2c3ccsc3CC[N@@H+]2Cc2ccns2)c1 ZINC001180586729 1049385393 /nfs/dbraw/zinc/38/53/93/1049385393.db2.gz WWYNZXDCTFHVGP-OAHLLOKOSA-N 1 2 318.492 4.414 20 0 DIADLO Oc1ccc(C[N@H+]2CC=C(c3ccc(F)cc3)CC2)c(F)c1F ZINC001205122946 1049386339 /nfs/dbraw/zinc/38/63/39/1049386339.db2.gz GUKCXXBZXSSGBH-UHFFFAOYSA-N 1 2 319.326 4.099 20 0 DIADLO Oc1ccc(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)c(F)c1F ZINC001205122946 1049386348 /nfs/dbraw/zinc/38/63/48/1049386348.db2.gz GUKCXXBZXSSGBH-UHFFFAOYSA-N 1 2 319.326 4.099 20 0 DIADLO Cc1ccc([C@H](CC(F)(F)F)[NH2+][C@@H]2C[C@@H](C)n3ccnc32)cc1 ZINC001180595114 1049389099 /nfs/dbraw/zinc/38/90/99/1049389099.db2.gz YEWJNHDQQFBNDN-YUELXQCFSA-N 1 2 323.362 4.481 20 0 DIADLO CC(C)C[C@H]([NH2+]C[C@H](C)c1ccc(F)cc1)C(=O)OC(C)(C)C ZINC001205136856 1049389947 /nfs/dbraw/zinc/38/99/47/1049389947.db2.gz KVTRTDRKXPFQIF-YOEHRIQHSA-N 1 2 323.452 4.275 20 0 DIADLO C[C@@H]1CN(c2cccc(Cl)c2)CC[N@H+]1CC=C(Cl)Cl ZINC001194551959 1049391577 /nfs/dbraw/zinc/39/15/77/1049391577.db2.gz ODPUUTSCGNLOFH-LLVKDONJSA-N 1 2 319.663 4.170 20 0 DIADLO C[C@@H]1CN(c2cccc(Cl)c2)CC[N@@H+]1CC=C(Cl)Cl ZINC001194551959 1049391562 /nfs/dbraw/zinc/39/15/62/1049391562.db2.gz ODPUUTSCGNLOFH-LLVKDONJSA-N 1 2 319.663 4.170 20 0 DIADLO C[N@@H+](Cc1c(F)cccc1F)C[C@H]1CC[C@@H](c2ccccc2)O1 ZINC001194570807 1049393437 /nfs/dbraw/zinc/39/34/37/1049393437.db2.gz PTHGFFOKOXCRLX-BEFAXECRSA-N 1 2 317.379 4.317 20 0 DIADLO C[N@H+](Cc1c(F)cccc1F)C[C@H]1CC[C@@H](c2ccccc2)O1 ZINC001194570807 1049393449 /nfs/dbraw/zinc/39/34/49/1049393449.db2.gz PTHGFFOKOXCRLX-BEFAXECRSA-N 1 2 317.379 4.317 20 0 DIADLO Cc1cn2cc(NC(=O)Oc3ccc4ccccc4c3)ccc2[nH+]1 ZINC001194631297 1049399583 /nfs/dbraw/zinc/39/95/83/1049399583.db2.gz BCDMDQUXLHGBSS-UHFFFAOYSA-N 1 2 317.348 4.407 20 0 DIADLO Cc1csc2nc(C)c(C[N@@H+](C)Cc3ccccc3Cl)n12 ZINC001205184221 1049404029 /nfs/dbraw/zinc/40/40/29/1049404029.db2.gz CXHQJYZWZFNZGY-UHFFFAOYSA-N 1 2 319.861 4.298 20 0 DIADLO Cc1csc2nc(C)c(C[N@H+](C)Cc3ccccc3Cl)n12 ZINC001205184221 1049404031 /nfs/dbraw/zinc/40/40/31/1049404031.db2.gz CXHQJYZWZFNZGY-UHFFFAOYSA-N 1 2 319.861 4.298 20 0 DIADLO Fc1cc(F)c(-c2ccc(F)c(-n3cc[nH+]c3)c2)c(F)c1F ZINC001205191802 1049407316 /nfs/dbraw/zinc/40/73/16/1049407316.db2.gz RDEBQHIABCWZMC-UHFFFAOYSA-N 1 2 310.225 4.235 20 0 DIADLO CCc1ccc([C@H]2C[N@H+](Cc3ccc(C)cc3F)CCO2)cc1 ZINC001180884559 1049409611 /nfs/dbraw/zinc/40/96/11/1049409611.db2.gz LTADPQYBDLIJEU-HXUWFJFHSA-N 1 2 313.416 4.270 20 0 DIADLO CCc1ccc([C@H]2C[N@@H+](Cc3ccc(C)cc3F)CCO2)cc1 ZINC001180884559 1049409617 /nfs/dbraw/zinc/40/96/17/1049409617.db2.gz LTADPQYBDLIJEU-HXUWFJFHSA-N 1 2 313.416 4.270 20 0 DIADLO O=C(NCc1c[nH+]cn1C1CCC1)Oc1ccc2ccccc2c1 ZINC001194677452 1049410804 /nfs/dbraw/zinc/41/08/04/1049410804.db2.gz QRXHJIGRFWTSRR-UHFFFAOYSA-N 1 2 321.380 4.050 20 0 DIADLO Cc1ccc(C[NH+](Cc2cccnc2)Cc2cccnc2)cc1F ZINC001205227171 1049413226 /nfs/dbraw/zinc/41/32/26/1049413226.db2.gz BJBLNNLXFNZLSC-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO CC1(CCCc2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)CC1 ZINC001205266447 1049421745 /nfs/dbraw/zinc/42/17/45/1049421745.db2.gz YBFUMZRJFUGNDF-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO CCCCC[C@@H]([NH2+]CCc1ccc(C(C)C)cc1)C(=O)OC ZINC001180954445 1049423370 /nfs/dbraw/zinc/42/33/70/1049423370.db2.gz VXLKSSDBZSVZRY-GOSISDBHSA-N 1 2 305.462 4.064 20 0 DIADLO CCc1ccc2c(c1)[C@H]([NH2+]Cc1c(Cl)ccnc1F)CCO2 ZINC001205276315 1049425006 /nfs/dbraw/zinc/42/50/06/1049425006.db2.gz GWTQXUFVWJKSAJ-OAHLLOKOSA-N 1 2 320.795 4.050 20 0 DIADLO C[C@@H](CC(=O)O[C@@H]1CCCc2ccc(Cl)cc21)n1cc[nH+]c1 ZINC000861402739 1049446301 /nfs/dbraw/zinc/44/63/01/1049446301.db2.gz FSSXFJXSYBCGTM-BLLLJJGKSA-N 1 2 318.804 4.108 20 0 DIADLO CC(C)=CC[N@@H+](Cc1cc(C)nn1C)Cc1ccc(Cl)cc1 ZINC001181162186 1049448250 /nfs/dbraw/zinc/44/82/50/1049448250.db2.gz CMPGXFHLLUZQNL-UHFFFAOYSA-N 1 2 317.864 4.350 20 0 DIADLO CC(C)=CC[N@H+](Cc1cc(C)nn1C)Cc1ccc(Cl)cc1 ZINC001181162186 1049448253 /nfs/dbraw/zinc/44/82/53/1049448253.db2.gz CMPGXFHLLUZQNL-UHFFFAOYSA-N 1 2 317.864 4.350 20 0 DIADLO Cc1ccc(Nc2cc(Cl)cnc2Br)c(C)[nH+]1 ZINC001203366569 1049451159 /nfs/dbraw/zinc/45/11/59/1049451159.db2.gz BRLHLBWVBGTDMW-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO COc1cc([NH2+]C[C@H]2CCCC[C@H]2C)c(OC)c(C)c1OC ZINC001181206228 1049453837 /nfs/dbraw/zinc/45/38/37/1049453837.db2.gz QXPZUIBQFJNXCD-TZMCWYRMSA-N 1 2 307.434 4.259 20 0 DIADLO COc1cc([NH2+]C[C@H]2CCCC[C@@H]2C)c(OC)c(C)c1OC ZINC001181206224 1049453932 /nfs/dbraw/zinc/45/39/32/1049453932.db2.gz QXPZUIBQFJNXCD-GXTWGEPZSA-N 1 2 307.434 4.259 20 0 DIADLO COc1ccc(C[NH2+][C@@H](c2nccs2)c2ccccc2)c(C)c1 ZINC000775629094 1049457242 /nfs/dbraw/zinc/45/72/42/1049457242.db2.gz OCWNTOTWOLJKCW-GOSISDBHSA-N 1 2 324.449 4.339 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CCCC[C@H]3C)cc2)C[C@H](C)O1 ZINC001181383405 1049470007 /nfs/dbraw/zinc/47/00/07/1049470007.db2.gz TVOULYXLVYFXMX-JEWRLFTDSA-N 1 2 302.462 4.291 20 0 DIADLO COc1cccc([C@@H](C)[N@@H+]2CCc3ccc(F)c(F)c3C2)c1 ZINC000486788068 1049471105 /nfs/dbraw/zinc/47/11/05/1049471105.db2.gz NUEJSOBHYFOCOK-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cccc([C@@H](C)[N@H+]2CCc3ccc(F)c(F)c3C2)c1 ZINC000486788068 1049471109 /nfs/dbraw/zinc/47/11/09/1049471109.db2.gz NUEJSOBHYFOCOK-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO c1nc(C2CC2)oc1C[N@@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC000862252672 1049481412 /nfs/dbraw/zinc/48/14/12/1049481412.db2.gz WDTHXWOYSKEOFQ-UHFFFAOYSA-N 1 2 320.392 4.370 20 0 DIADLO c1nc(C2CC2)oc1C[N@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC000862252672 1049481416 /nfs/dbraw/zinc/48/14/16/1049481416.db2.gz WDTHXWOYSKEOFQ-UHFFFAOYSA-N 1 2 320.392 4.370 20 0 DIADLO C[C@H]([NH2+]c1ccc(N2CCSCC2)cc1)C1CC(F)(F)C1 ZINC000862261803 1049482455 /nfs/dbraw/zinc/48/24/55/1049482455.db2.gz FRVKIUZLHHGMBG-LBPRGKRZSA-N 1 2 312.429 4.086 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@H](c3ccc(F)c(F)c3)C2)c(F)cn1 ZINC000862438497 1049493638 /nfs/dbraw/zinc/49/36/38/1049493638.db2.gz BOCFDDYKJOVDOG-LBPRGKRZSA-N 1 2 324.321 4.018 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@H](c3ccc(F)c(F)c3)C2)c(F)cn1 ZINC000862438497 1049493644 /nfs/dbraw/zinc/49/36/44/1049493644.db2.gz BOCFDDYKJOVDOG-LBPRGKRZSA-N 1 2 324.321 4.018 20 0 DIADLO Oc1ccc(C[N@@H+]2Cc3ccccc3C3(CCC3)C2)c(F)c1F ZINC001181654555 1049498997 /nfs/dbraw/zinc/49/89/97/1049498997.db2.gz DDFKYERQLCRBSW-UHFFFAOYSA-N 1 2 315.363 4.108 20 0 DIADLO Oc1ccc(C[N@H+]2Cc3ccccc3C3(CCC3)C2)c(F)c1F ZINC001181654555 1049499003 /nfs/dbraw/zinc/49/90/03/1049499003.db2.gz DDFKYERQLCRBSW-UHFFFAOYSA-N 1 2 315.363 4.108 20 0 DIADLO Oc1ccc(F)c(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)c1F ZINC000862539401 1049500717 /nfs/dbraw/zinc/50/07/17/1049500717.db2.gz NTVDFYPCKIMCLJ-CQSZACIVSA-N 1 2 309.743 4.101 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCC[C@@H](C3CCC3)C2)s1 ZINC000668719053 1049503031 /nfs/dbraw/zinc/50/30/31/1049503031.db2.gz RXPYHAISWVWJMJ-LLVKDONJSA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCC[C@@H](C3CCC3)C2)s1 ZINC000668719053 1049503039 /nfs/dbraw/zinc/50/30/39/1049503039.db2.gz RXPYHAISWVWJMJ-LLVKDONJSA-N 1 2 304.381 4.174 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+]2CCC[C@H]2/C=C\c2ccccc2)o1 ZINC000780396454 1049504939 /nfs/dbraw/zinc/50/49/39/1049504939.db2.gz CVVYZVCCNKOEFB-JNSOCZORSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+]2CCC[C@H]2/C=C\c2ccccc2)o1 ZINC000780396454 1049504949 /nfs/dbraw/zinc/50/49/49/1049504949.db2.gz CVVYZVCCNKOEFB-JNSOCZORSA-N 1 2 311.429 4.045 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncco2)cc1OC ZINC000924820620 1049505130 /nfs/dbraw/zinc/50/51/30/1049505130.db2.gz QQOVHPXAPPZUNV-KGLIPLIRSA-N 1 2 318.417 4.274 20 0 DIADLO CC(C)c1[nH+]cc(-c2cc(F)ccc2OCC(F)(F)F)n1C ZINC000630053162 1049507687 /nfs/dbraw/zinc/50/76/87/1049507687.db2.gz LLPWMJJYGDYCIN-UHFFFAOYSA-N 1 2 316.298 4.291 20 0 DIADLO Cc1sccc1C[N@@H+]1CCc2c(ncn2-c2ccc(C)cc2)C1 ZINC001205615132 1049512581 /nfs/dbraw/zinc/51/25/81/1049512581.db2.gz MLUVFDAVQLDFHX-UHFFFAOYSA-N 1 2 323.465 4.109 20 0 DIADLO Cc1sccc1C[N@H+]1CCc2c(ncn2-c2ccc(C)cc2)C1 ZINC001205615132 1049512591 /nfs/dbraw/zinc/51/25/91/1049512591.db2.gz MLUVFDAVQLDFHX-UHFFFAOYSA-N 1 2 323.465 4.109 20 0 DIADLO Cc1cc2ncn(C[N@@H+]3CCC[C@@H]3c3ccccc3)c2cc1C ZINC000014308398 1049516113 /nfs/dbraw/zinc/51/61/13/1049516113.db2.gz LBZFJDRYGWMAIV-LJQANCHMSA-N 1 2 305.425 4.448 20 0 DIADLO Cc1cc2ncn(C[N@H+]3CCC[C@@H]3c3ccccc3)c2cc1C ZINC000014308398 1049516125 /nfs/dbraw/zinc/51/61/25/1049516125.db2.gz LBZFJDRYGWMAIV-LJQANCHMSA-N 1 2 305.425 4.448 20 0 DIADLO CC(C)(C)c1nn(C[N@@H+]2CCC[C@@H]2c2ccccc2)c(=S)[nH]1 ZINC000014309232 1049516811 /nfs/dbraw/zinc/51/68/11/1049516811.db2.gz WHKVBNWRAJNATP-CQSZACIVSA-N 1 2 316.474 4.033 20 0 DIADLO CC(C)(C)c1nn(C[N@H+]2CCC[C@@H]2c2ccccc2)c(=S)[nH]1 ZINC000014309232 1049516826 /nfs/dbraw/zinc/51/68/26/1049516826.db2.gz WHKVBNWRAJNATP-CQSZACIVSA-N 1 2 316.474 4.033 20 0 DIADLO CCCc1csc(C[NH2+][C@H](COC)c2ccc(Cl)cc2)n1 ZINC000487155734 1049519582 /nfs/dbraw/zinc/51/95/82/1049519582.db2.gz JCEGMTJTBXSXIB-OAHLLOKOSA-N 1 2 324.877 4.226 20 0 DIADLO Clc1cccc(Cl)c1C1CC[NH+](Cc2cnoc2)CC1 ZINC001205670135 1049528302 /nfs/dbraw/zinc/52/83/02/1049528302.db2.gz JOWKMIRFZVMJJV-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO CCc1cccc(Cl)c1C[N@@H+]1CCOc2cc(O)ccc2C1 ZINC001205752640 1049554456 /nfs/dbraw/zinc/55/44/56/1049554456.db2.gz NEVREEGMNGDSJU-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCc1cccc(Cl)c1C[N@H+]1CCOc2cc(O)ccc2C1 ZINC001205752640 1049554470 /nfs/dbraw/zinc/55/44/70/1049554470.db2.gz NEVREEGMNGDSJU-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCN(C)C[C@@H]1c1ccccc1 ZINC000339054653 1049560186 /nfs/dbraw/zinc/56/01/86/1049560186.db2.gz WHMBBJQDLQMZPW-OAQYLSRUSA-N 1 2 323.484 4.002 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCN(C)C[C@@H]1c1ccccc1 ZINC000339054653 1049560197 /nfs/dbraw/zinc/56/01/97/1049560197.db2.gz WHMBBJQDLQMZPW-OAQYLSRUSA-N 1 2 323.484 4.002 20 0 DIADLO CCc1cc(-c2c[nH+]c(N3CCOCC3)cc2C)ccc1Cl ZINC001205807519 1049569053 /nfs/dbraw/zinc/56/90/53/1049569053.db2.gz FWJLTBVSVKKZOV-UHFFFAOYSA-N 1 2 316.832 4.109 20 0 DIADLO Cc1ccc(-c2noc([C@H]([NH3+])c3cccc(Cl)c3)n2)c(C)c1 ZINC001205806977 1049569559 /nfs/dbraw/zinc/56/95/59/1049569559.db2.gz YGWJMHJQEUPEBX-OAHLLOKOSA-N 1 2 313.788 4.055 20 0 DIADLO [NH3+][C@@H](c1nc(-c2ccccc2Cl)no1)c1cccc(Cl)c1 ZINC001205806240 1049569832 /nfs/dbraw/zinc/56/98/32/1049569832.db2.gz GCRWIXJFXSMBHU-CYBMUJFWSA-N 1 2 320.179 4.092 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1c[nH]nc1-c1ccccc1 ZINC000121424336 1049571481 /nfs/dbraw/zinc/57/14/81/1049571481.db2.gz FAVRRQHIWRXZLY-UHFFFAOYSA-N 1 2 306.413 4.063 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@@H]1CCCOc2ccc(F)cc21 ZINC000924827837 1049576421 /nfs/dbraw/zinc/57/64/21/1049576421.db2.gz WKSCKTHLEOHUDK-CABCVRRESA-N 1 2 316.376 4.003 20 0 DIADLO C[C@H]([NH2+]C[C@H]1CCCC[C@@H]1c1ccccc1)C(=O)OC(C)(C)C ZINC001205830292 1049576568 /nfs/dbraw/zinc/57/65/68/1049576568.db2.gz AFRYTJDHPUWSHC-CGTJXYLNSA-N 1 2 317.473 4.280 20 0 DIADLO Cc1ccc(C[S@](=O)Cc2ccc(CC(C)C)cc2)c(C)[nH+]1 ZINC000773983084 1049577249 /nfs/dbraw/zinc/57/72/49/1049577249.db2.gz GCGBYTKBAFQDSC-JOCHJYFZSA-N 1 2 315.482 4.346 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1ccc(F)c(F)c1OC(C)C ZINC001205854211 1049581851 /nfs/dbraw/zinc/58/18/51/1049581851.db2.gz CFRBGUPMBRSXCD-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2cc3ccccc3c(Cl)n2)s1 ZINC000794550195 1049590344 /nfs/dbraw/zinc/59/03/44/1049590344.db2.gz LDSGTADRWOMSIS-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2cc3ccccc3c(Cl)n2)s1 ZINC000794550195 1049590355 /nfs/dbraw/zinc/59/03/55/1049590355.db2.gz LDSGTADRWOMSIS-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO CC[NH+](CC)[C@@H](C(=O)NC(C)(C)C1CC1)c1ccccc1Cl ZINC001182225993 1049593302 /nfs/dbraw/zinc/59/33/02/1049593302.db2.gz ZATARKKYDLOBQY-MRXNPFEDSA-N 1 2 322.880 4.028 20 0 DIADLO Cc1cc(C)c(NC(=O)Nc2ccc(O)c(C(C)C)c2)c(C)[nH+]1 ZINC001205899725 1049595224 /nfs/dbraw/zinc/59/52/24/1049595224.db2.gz NREUBPBYYIYCEZ-UHFFFAOYSA-N 1 2 313.401 4.480 20 0 DIADLO FC1(F)CC2(C[NH+](Cc3cc4ccccc4c(Cl)n3)C2)C1 ZINC000794564047 1049595370 /nfs/dbraw/zinc/59/53/70/1049595370.db2.gz ZQPYHFWIVMSBPI-UHFFFAOYSA-N 1 2 308.759 4.119 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+](C)Cc2ccc(F)cc2C)n1 ZINC000488064463 1049597865 /nfs/dbraw/zinc/59/78/65/1049597865.db2.gz SMIYOWKGGUKOQO-UHFFFAOYSA-N 1 2 303.425 4.324 20 0 DIADLO CCC(CC)n1ccc(C[N@H+](C)Cc2ccc(F)cc2C)n1 ZINC000488064463 1049597847 /nfs/dbraw/zinc/59/78/47/1049597847.db2.gz SMIYOWKGGUKOQO-UHFFFAOYSA-N 1 2 303.425 4.324 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H](C)c1ccc(C(C)(C)O)cc1 ZINC000863983850 1049607989 /nfs/dbraw/zinc/60/79/89/1049607989.db2.gz WKXWSGLULYKAEG-HNNXBMFYSA-N 1 2 312.457 4.462 20 0 DIADLO Cc1sc(C[N@@H+]2CCC[C@](C)(F)C2)cc1Br ZINC001205960138 1049610879 /nfs/dbraw/zinc/61/08/79/1049610879.db2.gz KIEVHMRPCHJTSG-LBPRGKRZSA-N 1 2 306.244 4.143 20 0 DIADLO Cc1sc(C[N@H+]2CCC[C@](C)(F)C2)cc1Br ZINC001205960138 1049610893 /nfs/dbraw/zinc/61/08/93/1049610893.db2.gz KIEVHMRPCHJTSG-LBPRGKRZSA-N 1 2 306.244 4.143 20 0 DIADLO FC[C@@]1(C(F)(F)F)CC[N@H+](Cc2cc(Cl)ccc2F)C1 ZINC001205998723 1049624392 /nfs/dbraw/zinc/62/43/92/1049624392.db2.gz GXIRMVRRLYYNFB-LBPRGKRZSA-N 1 2 313.697 4.203 20 0 DIADLO FC[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cc(Cl)ccc2F)C1 ZINC001205998723 1049624399 /nfs/dbraw/zinc/62/43/99/1049624399.db2.gz GXIRMVRRLYYNFB-LBPRGKRZSA-N 1 2 313.697 4.203 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(C)cc2OCCC(C)C)[nH]c1C ZINC000570108377 1049631449 /nfs/dbraw/zinc/63/14/49/1049631449.db2.gz VFZXEMKWCJPOSG-UHFFFAOYSA-N 1 2 315.461 4.050 20 0 DIADLO Cc1[nH]c(CNCc2ccc(C)cc2OCCC(C)C)[nH+]c1C ZINC000570108377 1049631456 /nfs/dbraw/zinc/63/14/56/1049631456.db2.gz VFZXEMKWCJPOSG-UHFFFAOYSA-N 1 2 315.461 4.050 20 0 DIADLO O=c1[nH]cc(C[NH2+][C@@H](C(F)F)C2CCCCC2)c2ccccc12 ZINC001196264756 1049634976 /nfs/dbraw/zinc/63/49/76/1049634976.db2.gz YYCXVYMPUPWPSX-MRXNPFEDSA-N 1 2 320.383 4.244 20 0 DIADLO CC(C)(C)[C@H]1C[C@H](Nc2cccc(-n3cc[nH+]c3)c2)CS1 ZINC000488358873 1049640862 /nfs/dbraw/zinc/64/08/62/1049640862.db2.gz YNWPITRCCBJFJZ-GOEBONIOSA-N 1 2 301.459 4.204 20 0 DIADLO O[C@@H](c1ccccc1)[C@H]([NH2+]C/C(Cl)=C\Cl)c1ccccc1 ZINC000794658840 1049653593 /nfs/dbraw/zinc/65/35/93/1049653593.db2.gz PORJMFTZQJDUNA-ZBBFWBNCSA-N 1 2 322.235 4.370 20 0 DIADLO CC(C)(C)[C@@H]1C[C@H](Nc2ccc(N3CCCC3)c[nH+]2)CS1 ZINC000488440019 1049654323 /nfs/dbraw/zinc/65/43/23/1049654323.db2.gz IQHLVCBWPYJOJB-ZFWWWQNUSA-N 1 2 305.491 4.014 20 0 DIADLO C[N@H+](Cn1nc(C2CC2)n(C2CC2)c1=S)[C@H]1CCC(C)(C)C1 ZINC000794686104 1049655022 /nfs/dbraw/zinc/65/50/22/1049655022.db2.gz PROJPSUXJMRFGJ-AWEZNQCLSA-N 1 2 320.506 4.094 20 0 DIADLO C[N@@H+](Cn1nc(C2CC2)n(C2CC2)c1=S)[C@H]1CCC(C)(C)C1 ZINC000794686104 1049655030 /nfs/dbraw/zinc/65/50/30/1049655030.db2.gz PROJPSUXJMRFGJ-AWEZNQCLSA-N 1 2 320.506 4.094 20 0 DIADLO C[N@H+](Cn1nc(C2CC2)n(C2CC2)c1=S)[C@@H]1CCC(C)(C)C1 ZINC000794686106 1049655097 /nfs/dbraw/zinc/65/50/97/1049655097.db2.gz PROJPSUXJMRFGJ-CQSZACIVSA-N 1 2 320.506 4.094 20 0 DIADLO C[N@@H+](Cn1nc(C2CC2)n(C2CC2)c1=S)[C@@H]1CCC(C)(C)C1 ZINC000794686106 1049655104 /nfs/dbraw/zinc/65/51/04/1049655104.db2.gz PROJPSUXJMRFGJ-CQSZACIVSA-N 1 2 320.506 4.094 20 0 DIADLO CC(C)[C@@H]1C[C@H](Nc2ccc(N3CCCCC3)c[nH+]2)CS1 ZINC000488446562 1049656264 /nfs/dbraw/zinc/65/62/64/1049656264.db2.gz UISCIYYTHOQXIN-HOCLYGCPSA-N 1 2 305.491 4.014 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(-c3ccccn3)n[nH]2)[C@@H]1c1cccs1 ZINC001206136037 1049664116 /nfs/dbraw/zinc/66/41/16/1049664116.db2.gz QBGGJOMBMNBROX-QGZVFWFLSA-N 1 2 324.453 4.116 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(-c3ccccn3)n[nH]2)[C@@H]1c1cccs1 ZINC001206136037 1049664119 /nfs/dbraw/zinc/66/41/19/1049664119.db2.gz QBGGJOMBMNBROX-QGZVFWFLSA-N 1 2 324.453 4.116 20 0 DIADLO CC(C)[C@H]1C[C@@H](Nc2ccc(N3CCCCC3)[nH+]c2)CS1 ZINC000488518625 1049671498 /nfs/dbraw/zinc/67/14/98/1049671498.db2.gz SVESUDRJXFAKED-HZPDHXFCSA-N 1 2 305.491 4.014 20 0 DIADLO Cc1ccccc1-c1ccccc1C[NH+]1CC(OCC(F)F)C1 ZINC001206181016 1049677540 /nfs/dbraw/zinc/67/75/40/1049677540.db2.gz WRYQLFCSCPKZQT-UHFFFAOYSA-N 1 2 317.379 4.128 20 0 DIADLO c1ccc([C@H]2CC[C@H](Nc3ccc(N4CCCC4)c[nH+]3)C2)cc1 ZINC001182499283 1049679049 /nfs/dbraw/zinc/67/90/49/1049679049.db2.gz NRBIVJCAAUDFAH-ROUUACIJSA-N 1 2 307.441 4.430 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc(F)c(OC(C)C)c1 ZINC001206184246 1049679255 /nfs/dbraw/zinc/67/92/55/1049679255.db2.gz SGBISCXEQXBDGZ-UHFFFAOYSA-N 1 2 300.333 4.165 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1cc(F)ccc1Br ZINC001196693675 1049681170 /nfs/dbraw/zinc/68/11/70/1049681170.db2.gz OJYMUPZVEMMGJS-SECBINFHSA-N 1 2 322.168 4.208 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1cc(F)ccc1Br ZINC001196693675 1049681174 /nfs/dbraw/zinc/68/11/74/1049681174.db2.gz OJYMUPZVEMMGJS-SECBINFHSA-N 1 2 322.168 4.208 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@H](C)c2ccc(Br)cc2)C[C@@H](C)O1 ZINC000488614972 1049684829 /nfs/dbraw/zinc/68/48/29/1049684829.db2.gz SUKQAIFBIOONAS-LALPHHSUSA-N 1 2 312.251 4.009 20 0 DIADLO CC[C@@H]1C[N@H+]([C@H](C)c2ccc(Br)cc2)C[C@@H](C)O1 ZINC000488614972 1049684830 /nfs/dbraw/zinc/68/48/30/1049684830.db2.gz SUKQAIFBIOONAS-LALPHHSUSA-N 1 2 312.251 4.009 20 0 DIADLO FC(F)(F)[C@@H]1CC=C(Nc2ccc[nH+]c2N2CCCC2)CC1 ZINC001196768392 1049685539 /nfs/dbraw/zinc/68/55/39/1049685539.db2.gz QQGOKNVYYCONDA-GFCCVEGCSA-N 1 2 311.351 4.340 20 0 DIADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1cc(Cl)nc(Cl)c1 ZINC000120230758 1049688563 /nfs/dbraw/zinc/68/85/63/1049688563.db2.gz OTUGNSNILUCNTO-UHFFFAOYSA-N 1 2 318.635 4.012 20 0 DIADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1cc(Cl)nc(Cl)c1 ZINC000120230758 1049688569 /nfs/dbraw/zinc/68/85/69/1049688569.db2.gz OTUGNSNILUCNTO-UHFFFAOYSA-N 1 2 318.635 4.012 20 0 DIADLO Cc1ccc(C[S@@](=O)[C@H]2CCc3cc(Cl)ccc32)c(C)[nH+]1 ZINC000794782601 1049692997 /nfs/dbraw/zinc/69/29/97/1049692997.db2.gz YTDSYGCILOJDPO-LAUBAEHRSA-N 1 2 319.857 4.288 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1cccc(Cl)c1C ZINC001182667220 1049697183 /nfs/dbraw/zinc/69/71/83/1049697183.db2.gz VDUMXNQQLJCWJU-OAHLLOKOSA-N 1 2 311.853 4.201 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1cccc(Cl)c1C ZINC001182667220 1049697186 /nfs/dbraw/zinc/69/71/86/1049697186.db2.gz VDUMXNQQLJCWJU-OAHLLOKOSA-N 1 2 311.853 4.201 20 0 DIADLO Cc1c2cccc(C)c2oc1C[N@@H+](C)Cc1cc(F)ncc1F ZINC001182724794 1049706018 /nfs/dbraw/zinc/70/60/18/1049706018.db2.gz AVBHYLBNSWQILU-UHFFFAOYSA-N 1 2 316.351 4.355 20 0 DIADLO Cc1c2cccc(C)c2oc1C[N@H+](C)Cc1cc(F)ncc1F ZINC001182724794 1049706025 /nfs/dbraw/zinc/70/60/25/1049706025.db2.gz AVBHYLBNSWQILU-UHFFFAOYSA-N 1 2 316.351 4.355 20 0 DIADLO Brc1csc(C[N@@H+]2CCCC[C@H]2C2CCC2)n1 ZINC001182734026 1049709166 /nfs/dbraw/zinc/70/91/66/1049709166.db2.gz LCPCBHFZLNGOHE-NSHDSACASA-N 1 2 315.280 4.060 20 0 DIADLO Brc1csc(C[N@H+]2CCCC[C@H]2C2CCC2)n1 ZINC001182734026 1049709176 /nfs/dbraw/zinc/70/91/76/1049709176.db2.gz LCPCBHFZLNGOHE-NSHDSACASA-N 1 2 315.280 4.060 20 0 DIADLO Cc1nc2[nH]ccc2c(NCc2nc(-c3ccccc3)cs2)[nH+]1 ZINC000080947550 1049725441 /nfs/dbraw/zinc/72/54/41/1049725441.db2.gz IDRBMJKZJOGOSO-UHFFFAOYSA-N 1 2 321.409 4.002 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)Cc1coc2ccccc12)C(=O)OC(C)(C)C ZINC001206399673 1049728011 /nfs/dbraw/zinc/72/80/11/1049728011.db2.gz CZSKSCHWGBPKID-BBRMVZONSA-N 1 2 317.429 4.074 20 0 DIADLO COc1cnccc1C[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC001206446652 1049735052 /nfs/dbraw/zinc/73/50/52/1049735052.db2.gz IZYSZAUCRJGDSN-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cnccc1C[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC001206446652 1049735060 /nfs/dbraw/zinc/73/50/60/1049735060.db2.gz IZYSZAUCRJGDSN-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1cn2c(cccc2NC(=S)Nc2ccc(Cl)cc2)[nH+]1 ZINC001197298691 1049735722 /nfs/dbraw/zinc/73/57/22/1049735722.db2.gz DDVMYXKEPIYXSU-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO CC(C)(CC1CCC1)c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001206478790 1049740365 /nfs/dbraw/zinc/74/03/65/1049740365.db2.gz JSPKAPPMRYNYTO-UHFFFAOYSA-N 1 2 322.412 4.390 20 0 DIADLO COc1ccc(C[NH+]2CCOCC2)cc1-c1cccc(C2CC2)c1 ZINC001206511384 1049747838 /nfs/dbraw/zinc/74/78/38/1049747838.db2.gz ZRLKFVIBFHYKBV-UHFFFAOYSA-N 1 2 323.436 4.072 20 0 DIADLO Clc1ccc(/C=C/C[N@@H+]2CCCC[C@@H]2c2ncccn2)cc1 ZINC001197450774 1049753303 /nfs/dbraw/zinc/75/33/03/1049753303.db2.gz SLJQXAWFFIOCPL-NJELEJDNSA-N 1 2 313.832 4.370 20 0 DIADLO Clc1ccc(/C=C/C[N@H+]2CCCC[C@@H]2c2ncccn2)cc1 ZINC001197450774 1049753313 /nfs/dbraw/zinc/75/33/13/1049753313.db2.gz SLJQXAWFFIOCPL-NJELEJDNSA-N 1 2 313.832 4.370 20 0 DIADLO CCCCCOc1ccc(C[N@H+](C)[C@@H](C)c2nc(C)no2)cc1 ZINC000570463079 1049759057 /nfs/dbraw/zinc/75/90/57/1049759057.db2.gz QCVQUWACVJUEKJ-AWEZNQCLSA-N 1 2 317.433 4.140 20 0 DIADLO CCCCCOc1ccc(C[N@@H+](C)[C@@H](C)c2nc(C)no2)cc1 ZINC000570463079 1049759064 /nfs/dbraw/zinc/75/90/64/1049759064.db2.gz QCVQUWACVJUEKJ-AWEZNQCLSA-N 1 2 317.433 4.140 20 0 DIADLO COc1cccnc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)s1 ZINC001206643848 1049774747 /nfs/dbraw/zinc/77/47/47/1049774747.db2.gz BESDHYGPPQHTCC-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cccnc1C[N@H+]1CCC[C@H]1c1ccc(Cl)s1 ZINC001206643848 1049774756 /nfs/dbraw/zinc/77/47/56/1049774756.db2.gz BESDHYGPPQHTCC-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO c1cn2c(cccc2-c2ccc3cnn([C@@H]4CCCCO4)c3c2)[nH+]1 ZINC001206656976 1049776176 /nfs/dbraw/zinc/77/61/76/1049776176.db2.gz UDQKRJFPEUUXRH-IBGZPJMESA-N 1 2 318.380 4.050 20 0 DIADLO c1cn2cc(-c3ccc4cnn([C@@H]5CCCCO5)c4c3)ccc2[nH+]1 ZINC001206656842 1049776477 /nfs/dbraw/zinc/77/64/77/1049776477.db2.gz RKQZTBQDHGCSIH-IBGZPJMESA-N 1 2 318.380 4.050 20 0 DIADLO Cc1ccc2oc(C[NH2+]Cc3c(F)nccc3Cl)cc2c1 ZINC001206680909 1049778214 /nfs/dbraw/zinc/77/82/14/1049778214.db2.gz WYWAWLBZIHKCJG-UHFFFAOYSA-N 1 2 304.752 4.219 20 0 DIADLO CCC[N@H+](Cc1ccccc1F)Cc1c(OC)cccc1OC ZINC001206689241 1049779417 /nfs/dbraw/zinc/77/94/17/1049779417.db2.gz SFSJFSFCJZHZIL-UHFFFAOYSA-N 1 2 317.404 4.255 20 0 DIADLO CCC[N@@H+](Cc1ccccc1F)Cc1c(OC)cccc1OC ZINC001206689241 1049779427 /nfs/dbraw/zinc/77/94/27/1049779427.db2.gz SFSJFSFCJZHZIL-UHFFFAOYSA-N 1 2 317.404 4.255 20 0 DIADLO CCCOc1ccc(C[NH+]2CC(OC(C)(C)CC)C2)cc1C ZINC001206691999 1049779445 /nfs/dbraw/zinc/77/94/45/1049779445.db2.gz VLHRZCZJVUOANP-UHFFFAOYSA-N 1 2 305.462 4.173 20 0 DIADLO Oc1ccc2c(c1)C[N@@H+](Cc1ccc(-c3ccc(F)cc3)o1)C2 ZINC001206720701 1049784181 /nfs/dbraw/zinc/78/41/81/1049784181.db2.gz MEMDGULXFVXIHM-UHFFFAOYSA-N 1 2 309.340 4.307 20 0 DIADLO Oc1ccc2c(c1)C[N@H+](Cc1ccc(-c3ccc(F)cc3)o1)C2 ZINC001206720701 1049784187 /nfs/dbraw/zinc/78/41/87/1049784187.db2.gz MEMDGULXFVXIHM-UHFFFAOYSA-N 1 2 309.340 4.307 20 0 DIADLO CCCOc1ccc(F)c(-c2cc(-n3cc[nH+]c3)ccn2)c1F ZINC001206733180 1049786594 /nfs/dbraw/zinc/78/65/94/1049786594.db2.gz NGJFASRQFIGQAK-UHFFFAOYSA-N 1 2 315.323 4.001 20 0 DIADLO C=Cc1cc(F)ccc1-c1ccc(C[NH+]2CCOCC2)cc1F ZINC001206740157 1049787759 /nfs/dbraw/zinc/78/77/59/1049787759.db2.gz SFCUPOLEBNOMDE-UHFFFAOYSA-N 1 2 315.363 4.107 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2cc(O)cc(F)c2)cc[nH+]1 ZINC001206754816 1049793005 /nfs/dbraw/zinc/79/30/05/1049793005.db2.gz NUQSAXMUWQGYNU-UHFFFAOYSA-N 1 2 319.336 4.017 20 0 DIADLO c1cn(Cc2ccc(-c3cccc(OCC4CC4)c3)cc2)c[nH+]1 ZINC001206771525 1049796362 /nfs/dbraw/zinc/79/63/62/1049796362.db2.gz ZXFRTEYYVHKFET-UHFFFAOYSA-N 1 2 304.393 4.387 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+](C)Cc2ccc(OCC)cc2)n1 ZINC000490295802 1049819892 /nfs/dbraw/zinc/81/98/92/1049819892.db2.gz APDRDWSVSDWLBF-AWEZNQCLSA-N 1 2 317.433 4.004 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+](C)Cc2ccc(OCC)cc2)n1 ZINC000490295802 1049819901 /nfs/dbraw/zinc/81/99/01/1049819901.db2.gz APDRDWSVSDWLBF-AWEZNQCLSA-N 1 2 317.433 4.004 20 0 DIADLO Fc1cccnc1C[NH+](Cc1ccccc1)Cc1ccccc1 ZINC001207034181 1049823775 /nfs/dbraw/zinc/82/37/75/1049823775.db2.gz NDSUTOACJUQJHQ-UHFFFAOYSA-N 1 2 306.384 4.423 20 0 DIADLO Cc1ncc(C[N@@H+]2CCSC[C@@H]2c2cccc(Cl)c2)s1 ZINC001207061563 1049829057 /nfs/dbraw/zinc/82/90/57/1049829057.db2.gz AIENURKTVGMNQF-OAHLLOKOSA-N 1 2 324.902 4.395 20 0 DIADLO Cc1ncc(C[N@H+]2CCSC[C@@H]2c2cccc(Cl)c2)s1 ZINC001207061563 1049829070 /nfs/dbraw/zinc/82/90/70/1049829070.db2.gz AIENURKTVGMNQF-OAHLLOKOSA-N 1 2 324.902 4.395 20 0 DIADLO Cc1ncc(C[N@@H+]2CCSC[C@H]2c2cccc(Cl)c2)s1 ZINC001207061562 1049830627 /nfs/dbraw/zinc/83/06/27/1049830627.db2.gz AIENURKTVGMNQF-HNNXBMFYSA-N 1 2 324.902 4.395 20 0 DIADLO Cc1ncc(C[N@H+]2CCSC[C@H]2c2cccc(Cl)c2)s1 ZINC001207061562 1049830652 /nfs/dbraw/zinc/83/06/52/1049830652.db2.gz AIENURKTVGMNQF-HNNXBMFYSA-N 1 2 324.902 4.395 20 0 DIADLO CCC[NH+](CCC)Cn1[nH]c(/C=C\c2ccccc2)nc1=S ZINC000913059644 1049835186 /nfs/dbraw/zinc/83/51/86/1049835186.db2.gz FEJCCUHMBFXAKT-KHPPLWFESA-N 1 2 316.474 4.191 20 0 DIADLO C[N@H+](Cc1cccc(F)c1)Cc1c(F)cccc1OC(F)F ZINC001207111748 1049837754 /nfs/dbraw/zinc/83/77/54/1049837754.db2.gz PFIZCRWOJXYXLB-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO C[N@@H+](Cc1cccc(F)c1)Cc1c(F)cccc1OC(F)F ZINC001207111748 1049837768 /nfs/dbraw/zinc/83/77/68/1049837768.db2.gz PFIZCRWOJXYXLB-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO FC[C@@H]1CC[N@H+](C[C@@H]2C[C@@H]2c2ccc(Cl)cc2)CC1(F)F ZINC001207184106 1049852851 /nfs/dbraw/zinc/85/28/51/1049852851.db2.gz ZELMHVBJVLQGMQ-KCQAQPDRSA-N 1 2 317.782 4.370 20 0 DIADLO FC[C@@H]1CC[N@@H+](C[C@@H]2C[C@@H]2c2ccc(Cl)cc2)CC1(F)F ZINC001207184106 1049852878 /nfs/dbraw/zinc/85/28/78/1049852878.db2.gz ZELMHVBJVLQGMQ-KCQAQPDRSA-N 1 2 317.782 4.370 20 0 DIADLO CC(C)[C@H]1C[C@@H]([NH2+]CC(F)(F)c2cc(F)cc(F)c2)CS1 ZINC001207302525 1049879521 /nfs/dbraw/zinc/87/95/21/1049879521.db2.gz QHKBJMKBUBZXQE-ZIAGYGMSSA-N 1 2 321.383 4.176 20 0 DIADLO COc1nc(CNc2ccc3[nH+]c(C)cc(C)c3c2)ccc1C ZINC001207554496 1049909103 /nfs/dbraw/zinc/90/91/03/1049909103.db2.gz XPAGJXDDKAIUNM-UHFFFAOYSA-N 1 2 307.397 4.176 20 0 DIADLO CCCC[C@H](C)[NH2+][C@@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001207678753 1049926140 /nfs/dbraw/zinc/92/61/40/1049926140.db2.gz BDBRMKQZKRRDAH-RDJZCZTQSA-N 1 2 305.462 4.108 20 0 DIADLO C[C@H](CCCC(C)(C)O)CC[N@@H+]1Cc2cnc(Cl)cc2C1 ZINC001207693103 1049928574 /nfs/dbraw/zinc/92/85/74/1049928574.db2.gz NOQWKLNZYNXVGF-CYBMUJFWSA-N 1 2 310.869 4.018 20 0 DIADLO C[C@H](CCCC(C)(C)O)CC[N@H+]1Cc2cnc(Cl)cc2C1 ZINC001207693103 1049928581 /nfs/dbraw/zinc/92/85/81/1049928581.db2.gz NOQWKLNZYNXVGF-CYBMUJFWSA-N 1 2 310.869 4.018 20 0 DIADLO c1ccc(-c2nc3c(s2)C[N@@H+](CC2CCSCC2)C3)cc1 ZINC001207761993 1049936932 /nfs/dbraw/zinc/93/69/32/1049936932.db2.gz SSEJZTHZZYPZPN-UHFFFAOYSA-N 1 2 316.495 4.269 20 0 DIADLO c1ccc(-c2nc3c(s2)C[N@H+](CC2CCSCC2)C3)cc1 ZINC001207761993 1049936938 /nfs/dbraw/zinc/93/69/38/1049936938.db2.gz SSEJZTHZZYPZPN-UHFFFAOYSA-N 1 2 316.495 4.269 20 0 DIADLO COCC[C@H](C)C[NH2+][C@@H](c1cccc(OC(C)C)c1)C(F)F ZINC000571536488 1049938437 /nfs/dbraw/zinc/93/84/37/1049938437.db2.gz JUXHVGWPVLJCSR-BBRMVZONSA-N 1 2 315.404 4.042 20 0 DIADLO CSc1cc(NC(=O)Nc2ccc3[nH+]ccn3c2)ccc1C ZINC001207824438 1049940883 /nfs/dbraw/zinc/94/08/83/1049940883.db2.gz BTINUBFHYOFKFX-UHFFFAOYSA-N 1 2 312.398 4.009 20 0 DIADLO CC(C)c1ccc(N(C)C(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001207826036 1049943931 /nfs/dbraw/zinc/94/39/31/1049943931.db2.gz KXQPHEBEVWIODA-UHFFFAOYSA-N 1 2 308.385 4.126 20 0 DIADLO C[NH+](C)c1ccc(NCc2cccc(F)c2Br)cc1 ZINC000156701181 1049947188 /nfs/dbraw/zinc/94/71/88/1049947188.db2.gz BRSSBJBEVCFEOI-UHFFFAOYSA-N 1 2 323.209 4.266 20 0 DIADLO Fc1cnccc1CNc1[nH+]c2ccccc2n1C1CCCC1 ZINC001207873255 1049948535 /nfs/dbraw/zinc/94/85/35/1049948535.db2.gz OXZMEEFZDKOVDC-UHFFFAOYSA-N 1 2 310.376 4.298 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1cc(Br)ccc1F ZINC000588168992 1049972336 /nfs/dbraw/zinc/97/23/36/1049972336.db2.gz KEOJVLUQCXOBOB-UHFFFAOYSA-N 1 2 312.182 4.203 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1cc(Br)ccc1F ZINC000588168992 1049972339 /nfs/dbraw/zinc/97/23/39/1049972339.db2.gz KEOJVLUQCXOBOB-UHFFFAOYSA-N 1 2 312.182 4.203 20 0 DIADLO CC1=C[C@H](C)[C@@H](C[N@@H+]2Cc3cc(Br)cnc3C2)CC1 ZINC001208180600 1049982180 /nfs/dbraw/zinc/98/21/80/1049982180.db2.gz HEEPUVCLSOKGHN-QWHCGFSZSA-N 1 2 321.262 4.152 20 0 DIADLO CC1=C[C@H](C)[C@@H](C[N@H+]2Cc3cc(Br)cnc3C2)CC1 ZINC001208180600 1049982183 /nfs/dbraw/zinc/98/21/83/1049982183.db2.gz HEEPUVCLSOKGHN-QWHCGFSZSA-N 1 2 321.262 4.152 20 0 DIADLO CC1=C[C@@H](C)[C@@H](C[N@@H+]2Cc3cc(Br)cnc3C2)CC1 ZINC001208180598 1049982380 /nfs/dbraw/zinc/98/23/80/1049982380.db2.gz HEEPUVCLSOKGHN-CHWSQXEVSA-N 1 2 321.262 4.152 20 0 DIADLO CC1=C[C@@H](C)[C@@H](C[N@H+]2Cc3cc(Br)cnc3C2)CC1 ZINC001208180598 1049982383 /nfs/dbraw/zinc/98/23/83/1049982383.db2.gz HEEPUVCLSOKGHN-CHWSQXEVSA-N 1 2 321.262 4.152 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)Cc1ccc(F)cc1 ZINC000588668747 1049987516 /nfs/dbraw/zinc/98/75/16/1049987516.db2.gz IRRCTENXOUFTLB-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)Cc1ccc(F)cc1 ZINC000588668747 1049987523 /nfs/dbraw/zinc/98/75/23/1049987523.db2.gz IRRCTENXOUFTLB-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)s1 ZINC000572324146 1049999924 /nfs/dbraw/zinc/99/99/24/1049999924.db2.gz KPKLROLBDWTPAF-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCC[C@@H]2c2cccnc2)s1 ZINC000572324146 1049999925 /nfs/dbraw/zinc/99/99/25/1049999925.db2.gz KPKLROLBDWTPAF-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO CC(C)(CC[N@@H+]1Cc2cnc(Cl)cc2C1)c1ccccc1 ZINC001208672832 1050000121 /nfs/dbraw/zinc/00/01/21/1050000121.db2.gz COJFBASEOFWTFM-UHFFFAOYSA-N 1 2 300.833 4.419 20 0 DIADLO CC(C)(CC[N@H+]1Cc2cnc(Cl)cc2C1)c1ccccc1 ZINC001208672832 1050000126 /nfs/dbraw/zinc/00/01/26/1050000126.db2.gz COJFBASEOFWTFM-UHFFFAOYSA-N 1 2 300.833 4.419 20 0 DIADLO C[C@@H](C[N@@H+]1Cc2cccc(Cl)c2C1)OCc1ccccc1 ZINC001208703131 1050003393 /nfs/dbraw/zinc/00/33/93/1050003393.db2.gz VYDCQDPFAAQVLD-AWEZNQCLSA-N 1 2 301.817 4.261 20 0 DIADLO C[C@@H](C[N@H+]1Cc2cccc(Cl)c2C1)OCc1ccccc1 ZINC001208703131 1050003397 /nfs/dbraw/zinc/00/33/97/1050003397.db2.gz VYDCQDPFAAQVLD-AWEZNQCLSA-N 1 2 301.817 4.261 20 0 DIADLO C[C@@H](C[N@@H+]1CC(F)(F)CC[C@H]1CO)c1cccc2ccccc21 ZINC001208707427 1050004132 /nfs/dbraw/zinc/00/41/32/1050004132.db2.gz SSWDRDNXERNTPB-HOCLYGCPSA-N 1 2 319.395 4.035 20 0 DIADLO C[C@@H](C[N@H+]1CC(F)(F)CC[C@H]1CO)c1cccc2ccccc21 ZINC001208707427 1050004136 /nfs/dbraw/zinc/00/41/36/1050004136.db2.gz SSWDRDNXERNTPB-HOCLYGCPSA-N 1 2 319.395 4.035 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc4ccccc4c3)ccc2[nH+]1 ZINC000588859526 1050006288 /nfs/dbraw/zinc/00/62/88/1050006288.db2.gz RHEQMMIZCWKQKA-UHFFFAOYSA-N 1 2 301.349 4.048 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@@H+]1CCCc1ccc(Cl)c(Cl)c1 ZINC001208834264 1050014610 /nfs/dbraw/zinc/01/46/10/1050014610.db2.gz RBXXEBLUCKKBNN-RYUDHWBXSA-N 1 2 308.199 4.308 20 0 DIADLO FC[C@@H]1C[C@H](F)C[N@H+]1CCCc1ccc(Cl)c(Cl)c1 ZINC001208834264 1050014616 /nfs/dbraw/zinc/01/46/16/1050014616.db2.gz RBXXEBLUCKKBNN-RYUDHWBXSA-N 1 2 308.199 4.308 20 0 DIADLO Clc1cc(NC2=CCN(c3ccccc3)CC2)cn2cc[nH+]c12 ZINC001209041015 1050031472 /nfs/dbraw/zinc/03/14/72/1050031472.db2.gz FZIIIDTZEUYDNO-UHFFFAOYSA-N 1 2 324.815 4.194 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCOC[C@@H]2c2ccccc2)c(Cl)c1 ZINC001209109120 1050036686 /nfs/dbraw/zinc/03/66/86/1050036686.db2.gz IVSPXBCOFLNGFJ-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc(CC[N@H+]2CCOC[C@@H]2c2ccccc2)c(Cl)c1 ZINC001209109120 1050036691 /nfs/dbraw/zinc/03/66/91/1050036691.db2.gz IVSPXBCOFLNGFJ-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(C2CC2)s1)c1cc2cccc(F)c2o1 ZINC000572711361 1050040900 /nfs/dbraw/zinc/04/09/00/1050040900.db2.gz GUHSRNYEPWCFKQ-SECBINFHSA-N 1 2 317.389 4.152 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1cccc(Cl)c1 ZINC000589605359 1050048238 /nfs/dbraw/zinc/04/82/38/1050048238.db2.gz XCGNDYNAKOFFQL-KSSFIOAISA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1cccc(Cl)c1 ZINC000589605359 1050048244 /nfs/dbraw/zinc/04/82/44/1050048244.db2.gz XCGNDYNAKOFFQL-KSSFIOAISA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1ccccc1Cl ZINC000589605170 1050048267 /nfs/dbraw/zinc/04/82/67/1050048267.db2.gz QXFYWKZXGSPMRR-KSSFIOAISA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1ccccc1Cl ZINC000589605170 1050048274 /nfs/dbraw/zinc/04/82/74/1050048274.db2.gz QXFYWKZXGSPMRR-KSSFIOAISA-N 1 2 301.817 4.302 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)c(Cl)c3)C2)cc1 ZINC000589598757 1050050135 /nfs/dbraw/zinc/05/01/35/1050050135.db2.gz YWVHVZLFELJDQT-SFHVURJKSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@H](c3ccc(F)c(Cl)c3)C2)cc1 ZINC000589598757 1050050138 /nfs/dbraw/zinc/05/01/38/1050050138.db2.gz YWVHVZLFELJDQT-SFHVURJKSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1cc(C)cc(C[N@@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c1 ZINC000589707355 1050055275 /nfs/dbraw/zinc/05/52/75/1050055275.db2.gz IZBUCJUIWMATAR-IBGZPJMESA-N 1 2 317.379 4.155 20 0 DIADLO Cc1cc(C)cc(C[N@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c1 ZINC000589707355 1050055279 /nfs/dbraw/zinc/05/52/79/1050055279.db2.gz IZBUCJUIWMATAR-IBGZPJMESA-N 1 2 317.379 4.155 20 0 DIADLO Cc1cccc2c(C[N@@H+]3CCOC[C@H]3c3ccc(F)cc3)c[nH]c21 ZINC001209489263 1050062472 /nfs/dbraw/zinc/06/24/72/1050062472.db2.gz GJVOQGQKDWBBBU-IBGZPJMESA-N 1 2 324.399 4.189 20 0 DIADLO Cc1cccc2c(C[N@H+]3CCOC[C@H]3c3ccc(F)cc3)c[nH]c21 ZINC001209489263 1050062477 /nfs/dbraw/zinc/06/24/77/1050062477.db2.gz GJVOQGQKDWBBBU-IBGZPJMESA-N 1 2 324.399 4.189 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1cc2c(cn1)OCCC2 ZINC001209506049 1050064877 /nfs/dbraw/zinc/06/48/77/1050064877.db2.gz JLNQFFANQCHZFW-CYBMUJFWSA-N 1 2 316.832 4.253 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1cc2c(cn1)OCCC2 ZINC001209506049 1050064881 /nfs/dbraw/zinc/06/48/81/1050064881.db2.gz JLNQFFANQCHZFW-CYBMUJFWSA-N 1 2 316.832 4.253 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1cc2c(cn1)OCCC2 ZINC001209506050 1050065124 /nfs/dbraw/zinc/06/51/24/1050065124.db2.gz JLNQFFANQCHZFW-ZDUSSCGKSA-N 1 2 316.832 4.253 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1cc2c(cn1)OCCC2 ZINC001209506050 1050065128 /nfs/dbraw/zinc/06/51/28/1050065128.db2.gz JLNQFFANQCHZFW-ZDUSSCGKSA-N 1 2 316.832 4.253 20 0 DIADLO FC1CC[NH+](Cc2c(Cl)cccc2OC(F)(F)F)CC1 ZINC001209520824 1050065630 /nfs/dbraw/zinc/06/56/30/1050065630.db2.gz DGFDUNDPVKRSCI-UHFFFAOYSA-N 1 2 311.706 4.173 20 0 DIADLO CCc1ccc([C@H](C)C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000589947393 1050069506 /nfs/dbraw/zinc/06/95/06/1050069506.db2.gz FIAUBYZKWCZLAO-AWEZNQCLSA-N 1 2 319.408 4.381 20 0 DIADLO F[C@H]1C[N@H+](Cc2cccc3[nH]cc(Cl)c32)CCC1(F)F ZINC001209655785 1050073376 /nfs/dbraw/zinc/07/33/76/1050073376.db2.gz CBPHIWJTMYQPMV-LBPRGKRZSA-N 1 2 302.727 4.000 20 0 DIADLO F[C@H]1C[N@@H+](Cc2cccc3[nH]cc(Cl)c32)CCC1(F)F ZINC001209655785 1050073382 /nfs/dbraw/zinc/07/33/82/1050073382.db2.gz CBPHIWJTMYQPMV-LBPRGKRZSA-N 1 2 302.727 4.000 20 0 DIADLO COc1c(Cl)ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c1F ZINC001209702420 1050077698 /nfs/dbraw/zinc/07/76/98/1050077698.db2.gz VLSOYSZLFWSYOV-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(Cl)ccc(C[N@H+]2CCC[C@@H]2c2ccncc2)c1F ZINC001209702420 1050077701 /nfs/dbraw/zinc/07/77/01/1050077701.db2.gz VLSOYSZLFWSYOV-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@H]1C[N@H+](Cc2[nH]nc3ccc(Cl)cc32)Cc2ccccc21 ZINC001209751228 1050080700 /nfs/dbraw/zinc/08/07/00/1050080700.db2.gz OGWQUWGVRDOALA-LBPRGKRZSA-N 1 2 311.816 4.336 20 0 DIADLO C[C@H]1C[N@@H+](Cc2[nH]nc3ccc(Cl)cc32)Cc2ccccc21 ZINC001209751228 1050080701 /nfs/dbraw/zinc/08/07/01/1050080701.db2.gz OGWQUWGVRDOALA-LBPRGKRZSA-N 1 2 311.816 4.336 20 0 DIADLO C[C@H]1C[N@H+](Cc2n[nH]c3ccc(Cl)cc32)Cc2ccccc21 ZINC001209751228 1050080703 /nfs/dbraw/zinc/08/07/03/1050080703.db2.gz OGWQUWGVRDOALA-LBPRGKRZSA-N 1 2 311.816 4.336 20 0 DIADLO C[C@H]1C[N@@H+](Cc2n[nH]c3ccc(Cl)cc32)Cc2ccccc21 ZINC001209751228 1050080704 /nfs/dbraw/zinc/08/07/04/1050080704.db2.gz OGWQUWGVRDOALA-LBPRGKRZSA-N 1 2 311.816 4.336 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1[nH]nc2ccc(Cl)cc21 ZINC001209760497 1050081229 /nfs/dbraw/zinc/08/12/29/1050081229.db2.gz XKDZTVUGQPZNQC-LBPRGKRZSA-N 1 2 311.816 4.163 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1[nH]nc2ccc(Cl)cc21 ZINC001209760497 1050081235 /nfs/dbraw/zinc/08/12/35/1050081235.db2.gz XKDZTVUGQPZNQC-LBPRGKRZSA-N 1 2 311.816 4.163 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1n[nH]c2ccc(Cl)cc21 ZINC001209760497 1050081238 /nfs/dbraw/zinc/08/12/38/1050081238.db2.gz XKDZTVUGQPZNQC-LBPRGKRZSA-N 1 2 311.816 4.163 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1n[nH]c2ccc(Cl)cc21 ZINC001209760497 1050081244 /nfs/dbraw/zinc/08/12/44/1050081244.db2.gz XKDZTVUGQPZNQC-LBPRGKRZSA-N 1 2 311.816 4.163 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2nc3ccccc3s2)s1 ZINC000224319528 1050091220 /nfs/dbraw/zinc/09/12/20/1050091220.db2.gz RQFSSCRDQVIVFN-SNVBAGLBSA-N 1 2 303.456 4.166 20 0 DIADLO c1[nH]c2ccc(Nc3ncccc3Oc3ccccc3)cc2[nH+]1 ZINC001209842679 1050093488 /nfs/dbraw/zinc/09/34/88/1050093488.db2.gz OXPNGYJTJZLQOT-UHFFFAOYSA-N 1 2 302.337 4.494 20 0 DIADLO Cc1cc(Cl)cc(Nc2ccccc2C[NH+]2CCOCC2)c1 ZINC001209929529 1050107932 /nfs/dbraw/zinc/10/79/32/1050107932.db2.gz BLUQWERBUALFMU-UHFFFAOYSA-N 1 2 316.832 4.224 20 0 DIADLO Cc1cccc(Cl)c1Nc1ccccc1C[NH+]1CCOCC1 ZINC001209927557 1050108205 /nfs/dbraw/zinc/10/82/05/1050108205.db2.gz WEELBCWIZXWKLL-UHFFFAOYSA-N 1 2 316.832 4.224 20 0 DIADLO C=Cc1ccccc1Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001209944781 1050109187 /nfs/dbraw/zinc/10/91/87/1050109187.db2.gz PVBGUXUSGSJXPM-GASCZTMLSA-N 1 2 309.413 4.082 20 0 DIADLO CCCc1nc(C[N@@H+]2CCCc3cc(OC)ccc3C2)cs1 ZINC000590820417 1050109933 /nfs/dbraw/zinc/10/99/33/1050109933.db2.gz ZERRFKYOBMHQQM-UHFFFAOYSA-N 1 2 316.470 4.053 20 0 DIADLO CCCc1nc(C[N@H+]2CCCc3cc(OC)ccc3C2)cs1 ZINC000590820417 1050109938 /nfs/dbraw/zinc/10/99/38/1050109938.db2.gz ZERRFKYOBMHQQM-UHFFFAOYSA-N 1 2 316.470 4.053 20 0 DIADLO Oc1ccc(C(F)(F)F)cc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001209981401 1050115488 /nfs/dbraw/zinc/11/54/88/1050115488.db2.gz CTOQITFZCQBUCU-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(O)c(C(F)(F)F)c2)c[nH+]1 ZINC001209983905 1050116105 /nfs/dbraw/zinc/11/61/05/1050116105.db2.gz AKZYGFCWRQDUEL-UHFFFAOYSA-N 1 2 311.307 4.006 20 0 DIADLO Cc1cc(Nc2ccc(-c3ccncn3)cc2)ccc1[NH+](C)C ZINC001210042662 1050127544 /nfs/dbraw/zinc/12/75/44/1050127544.db2.gz AACORXHIMFEFGN-UHFFFAOYSA-N 1 2 304.397 4.262 20 0 DIADLO Brc1cccc(Nc2ccc3c[nH+]ccc3c2)n1 ZINC001210043687 1050127581 /nfs/dbraw/zinc/12/75/81/1050127581.db2.gz IKTXRUZJRBKDAJ-UHFFFAOYSA-N 1 2 300.159 4.136 20 0 DIADLO CCOC(=O)Nc1ccc(Nc2ccc([NH+](C)C)c(C)c2)cc1 ZINC001210042836 1050127806 /nfs/dbraw/zinc/12/78/06/1050127806.db2.gz DKKXOMBFZFYLIQ-UHFFFAOYSA-N 1 2 313.401 4.373 20 0 DIADLO Cc1cc(Nc2cc(N)cc(C(F)(F)F)c2)ccc1[NH+](C)C ZINC001210041017 1050127859 /nfs/dbraw/zinc/12/78/59/1050127859.db2.gz FSGWINDNKCZVPQ-UHFFFAOYSA-N 1 2 309.335 4.406 20 0 DIADLO Cc1cnc(Nc2ccc3c[nH+]ccc3c2)c(Br)c1 ZINC001210044169 1050128225 /nfs/dbraw/zinc/12/82/25/1050128225.db2.gz MKGAVBYARUQQNJ-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO Cc1cc(Nc2cccc3c2CC(C)(C)C(=O)N3)ccc1[NH+](C)C ZINC001210044450 1050128412 /nfs/dbraw/zinc/12/84/12/1050128412.db2.gz PXLHCLRTZYJIPX-UHFFFAOYSA-N 1 2 323.440 4.325 20 0 DIADLO COC(=O)[C@@H]1CCc2cc(Nc3ccc([NH+](C)C)c(C)c3)ccc21 ZINC001210045937 1050128778 /nfs/dbraw/zinc/12/87/78/1050128778.db2.gz ZZYAZJYESUSMCC-GOSISDBHSA-N 1 2 324.424 4.007 20 0 DIADLO CCSc1ccc(Cl)cc1NC(=O)CCCn1cc[nH+]c1 ZINC000591252052 1050129219 /nfs/dbraw/zinc/12/92/19/1050129219.db2.gz FIPCZJJPUVUBQT-UHFFFAOYSA-N 1 2 323.849 4.067 20 0 DIADLO OCc1ccc(F)cc1Nc1cc[nH+]c2cc(Cl)ccc12 ZINC001210183423 1050149479 /nfs/dbraw/zinc/14/94/79/1050149479.db2.gz ZNAVKIMHDYGIFH-UHFFFAOYSA-N 1 2 302.736 4.263 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@H]2CCCC[C@H]2C)no1)c1ccccc1 ZINC000573246559 1050153779 /nfs/dbraw/zinc/15/37/79/1050153779.db2.gz QUYLJYZUOIXUAO-HYVNUMGLSA-N 1 2 313.445 4.404 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@H]2CCCC[C@H]2C)no1)c1ccccc1 ZINC000573246559 1050153782 /nfs/dbraw/zinc/15/37/82/1050153782.db2.gz QUYLJYZUOIXUAO-HYVNUMGLSA-N 1 2 313.445 4.404 20 0 DIADLO CC/C(C)=C\C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000823770241 1050155168 /nfs/dbraw/zinc/15/51/68/1050155168.db2.gz NTYGFIHEONKCTL-OWBHPGMISA-N 1 2 309.413 4.181 20 0 DIADLO ClC1(Cl)C[C@@H]1C[N@@H+]1CCCn2c(cc3ccccc32)C1 ZINC000805842043 1050159339 /nfs/dbraw/zinc/15/93/39/1050159339.db2.gz ZVXPPIRCAISABK-CYBMUJFWSA-N 1 2 309.240 4.041 20 0 DIADLO ClC1(Cl)C[C@@H]1C[N@H+]1CCCn2c(cc3ccccc32)C1 ZINC000805842043 1050159344 /nfs/dbraw/zinc/15/93/44/1050159344.db2.gz ZVXPPIRCAISABK-CYBMUJFWSA-N 1 2 309.240 4.041 20 0 DIADLO Oc1c(Cl)cccc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001210216312 1050162070 /nfs/dbraw/zinc/16/20/70/1050162070.db2.gz UCMNXCUCFZBQGS-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO CC[C@@](C)([NH2+]Cc1ccnc(Cl)c1F)c1nc(C)cs1 ZINC000823882533 1050164698 /nfs/dbraw/zinc/16/46/98/1050164698.db2.gz OUIAJIMQFWQYRM-CQSZACIVSA-N 1 2 313.829 4.054 20 0 DIADLO c1ccc2c(c1)n[nH]c2CNc1ccc([NH+]2CCCCC2)cc1 ZINC000770480162 1050165327 /nfs/dbraw/zinc/16/53/27/1050165327.db2.gz GNMVCHPJQJCTCU-UHFFFAOYSA-N 1 2 306.413 4.165 20 0 DIADLO Nc1cccc(-c2cccc(Nc3cccc4cc[nH+]cc43)n2)n1 ZINC001210223628 1050165258 /nfs/dbraw/zinc/16/52/58/1050165258.db2.gz AWWONCPNLRZGAK-UHFFFAOYSA-N 1 2 313.364 4.018 20 0 DIADLO Cc1cnc(Br)c(Nc2cccc3cc[nH+]cc32)c1 ZINC001210223967 1050165280 /nfs/dbraw/zinc/16/52/80/1050165280.db2.gz LWLYXYYLLBEHGJ-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO Cc1cc(Nc2cccc3cc[nH+]cc32)n(CC(F)(F)F)n1 ZINC001210224450 1050167252 /nfs/dbraw/zinc/16/72/52/1050167252.db2.gz MZBNJFCEOLQZIW-UHFFFAOYSA-N 1 2 306.291 4.046 20 0 DIADLO FC(F)(F)Oc1ccnc(Nc2cccc3cc[nH+]cc32)c1 ZINC001210225141 1050167609 /nfs/dbraw/zinc/16/76/09/1050167609.db2.gz DMWIAEHCRPMVHT-UHFFFAOYSA-N 1 2 305.259 4.272 20 0 DIADLO Cc1ccc(CNc2ccc([NH+](C)C)cc2)c(-c2cnn(C)c2)c1 ZINC000282644806 1050168236 /nfs/dbraw/zinc/16/82/36/1050168236.db2.gz LJCXWNAADCAYEN-UHFFFAOYSA-N 1 2 320.440 4.074 20 0 DIADLO COC(=O)c1ccc(Cl)c(Nc2cccc3cc[nH+]cc32)c1 ZINC001210231372 1050169567 /nfs/dbraw/zinc/16/95/67/1050169567.db2.gz NHYWKCUVZDFDHS-UHFFFAOYSA-N 1 2 312.756 4.418 20 0 DIADLO COCCOc1c(F)cccc1Nc1cccc2cc[nH+]cc21 ZINC001210233435 1050171581 /nfs/dbraw/zinc/17/15/81/1050171581.db2.gz ZUYRNFRBOFUBBT-UHFFFAOYSA-N 1 2 312.344 4.143 20 0 DIADLO CC[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1ccc(Cl)s1 ZINC001136806332 1050176237 /nfs/dbraw/zinc/17/62/37/1050176237.db2.gz KJVXJQXDKQHDOU-SNVBAGLBSA-N 1 2 319.817 4.159 20 0 DIADLO CCSCc1cc[nH+]c(NCc2ccnc(Cl)c2F)c1 ZINC000824044076 1050178001 /nfs/dbraw/zinc/17/80/01/1050178001.db2.gz JNTHYVMXFDIDPJ-UHFFFAOYSA-N 1 2 311.813 4.134 20 0 DIADLO CCCCOc1ccc(C[NH2+][C@@H](C)c2cc(C)on2)cc1OC ZINC000282699295 1050178573 /nfs/dbraw/zinc/17/85/73/1050178573.db2.gz OTHBGYKWVRDJBP-AWEZNQCLSA-N 1 2 318.417 4.021 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(Br)cc2Cl)cc1N ZINC001210287888 1050191073 /nfs/dbraw/zinc/19/10/73/1050191073.db2.gz FRUYQOOHKPBCPA-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO Cc1[nH+]cc(Nc2c(Cl)cnc(Cl)c2Cl)cc1N ZINC001210286951 1050189881 /nfs/dbraw/zinc/18/98/81/1050189881.db2.gz GZJXNGXWQRUZND-UHFFFAOYSA-N 1 2 303.580 4.071 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(Oc3ccc(F)cc3)nc2)cc1N ZINC001210287066 1050190255 /nfs/dbraw/zinc/19/02/55/1050190255.db2.gz JXIPYZWGYYJUKJ-UHFFFAOYSA-N 1 2 310.332 4.042 20 0 DIADLO Cc1[nH+]cc(Nc2cccc(Oc3cccc(N)c3)c2)cc1N ZINC001210291682 1050191170 /nfs/dbraw/zinc/19/11/70/1050191170.db2.gz QBZYALCKOONXDL-UHFFFAOYSA-N 1 2 306.369 4.090 20 0 DIADLO Cc1[nH+]cc(Nc2cccc(Cl)c2Br)cc1N ZINC001210290461 1050191578 /nfs/dbraw/zinc/19/15/78/1050191578.db2.gz LRWLDROPFOZUAA-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(Cl)cc2Br)cc1N ZINC001210290562 1050191595 /nfs/dbraw/zinc/19/15/95/1050191595.db2.gz OGXHLMKQVBLLOL-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO Cc1cc(Br)c(Nc2c[nH+]c(C)c(N)c2)cc1C ZINC001210291643 1050191863 /nfs/dbraw/zinc/19/18/63/1050191863.db2.gz PCCYNFXDCUINMN-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO Cc1[nH+]cc(Nc2cc(-c3ccc(Cl)s3)on2)cc1N ZINC001210288294 1050191921 /nfs/dbraw/zinc/19/19/21/1050191921.db2.gz KYZFVBGGMQVIDX-UHFFFAOYSA-N 1 2 306.778 4.086 20 0 DIADLO Cc1[nH+]cc(Nc2cc(-c3ccccc3)cc(Cl)n2)cc1N ZINC001210289048 1050192567 /nfs/dbraw/zinc/19/25/67/1050192567.db2.gz RULCTPDCOMPBBZ-UHFFFAOYSA-N 1 2 310.788 4.431 20 0 DIADLO Cc1[nH+]cc(Nc2ccc3sc(C(F)(F)F)nc3c2)cc1N ZINC001210291945 1050192863 /nfs/dbraw/zinc/19/28/63/1050192863.db2.gz UZMNKXVURCADNP-UHFFFAOYSA-N 1 2 324.331 4.344 20 0 DIADLO Clc1cc(Cl)cc(C2=CC[N@H+](Cc3c[nH]cn3)CC2)c1 ZINC001136866048 1050207126 /nfs/dbraw/zinc/20/71/26/1050207126.db2.gz IUEOKMXSYJRNRG-UHFFFAOYSA-N 1 2 308.212 4.006 20 0 DIADLO Clc1cc(Cl)cc(C2=CC[N@@H+](Cc3c[nH]cn3)CC2)c1 ZINC001136866048 1050207136 /nfs/dbraw/zinc/20/71/36/1050207136.db2.gz IUEOKMXSYJRNRG-UHFFFAOYSA-N 1 2 308.212 4.006 20 0 DIADLO Cc1ccc[nH+]c1Nc1ccc2c(cnn2[C@H]2CCCCO2)c1 ZINC001210331830 1050207442 /nfs/dbraw/zinc/20/74/42/1050207442.db2.gz XSHNFGKGTKECKI-QGZVFWFLSA-N 1 2 308.385 4.182 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1ccnc(Cl)c1F ZINC000824402716 1050208453 /nfs/dbraw/zinc/20/84/53/1050208453.db2.gz NONJIDCMZKJUBF-AWEZNQCLSA-N 1 2 322.811 4.466 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1ccnc(Cl)c1F ZINC000824402716 1050208465 /nfs/dbraw/zinc/20/84/65/1050208465.db2.gz NONJIDCMZKJUBF-AWEZNQCLSA-N 1 2 322.811 4.466 20 0 DIADLO CC(=O)c1ccc([C@H](C)Nc2cccc(-c3c[nH+]cn3C)c2)cc1 ZINC001171056426 1050213643 /nfs/dbraw/zinc/21/36/43/1050213643.db2.gz UENAVDSLMNEKEZ-AWEZNQCLSA-N 1 2 319.408 4.463 20 0 DIADLO Cc1nn(C)c(Cl)c1C[NH2+][C@H](C)c1ccc(F)cc1Cl ZINC000824462780 1050214656 /nfs/dbraw/zinc/21/46/56/1050214656.db2.gz MPDXAZBQAMFDJR-MRVPVSSYSA-N 1 2 316.207 4.025 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H]1CCc2ccc(Cl)nc21 ZINC000771174907 1050224815 /nfs/dbraw/zinc/22/48/15/1050224815.db2.gz CMCWHUSFNYGPEI-ZWNOBZJWSA-N 1 2 320.795 4.221 20 0 DIADLO Cc1ccccc1-c1nn(C[N@H+](C)CC2CCCC2)c(=S)o1 ZINC000058207534 1050229104 /nfs/dbraw/zinc/22/91/04/1050229104.db2.gz SPPPHLBKRHONJZ-UHFFFAOYSA-N 1 2 317.458 4.261 20 0 DIADLO Cc1ccccc1-c1nn(C[N@@H+](C)CC2CCCC2)c(=S)o1 ZINC000058207534 1050229119 /nfs/dbraw/zinc/22/91/19/1050229119.db2.gz SPPPHLBKRHONJZ-UHFFFAOYSA-N 1 2 317.458 4.261 20 0 DIADLO Cc1nonc1C[N@@H+]([C@@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000734147833 1050232816 /nfs/dbraw/zinc/23/28/16/1050232816.db2.gz ZJJDUJDGLGTWBI-AWEZNQCLSA-N 1 2 307.397 4.257 20 0 DIADLO Cc1nonc1C[N@H+]([C@@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000734147833 1050232831 /nfs/dbraw/zinc/23/28/31/1050232831.db2.gz ZJJDUJDGLGTWBI-AWEZNQCLSA-N 1 2 307.397 4.257 20 0 DIADLO C[C@H]([NH2+]Cc1nn(C)c2ccccc12)c1nc2ccccc2s1 ZINC000734164113 1050236053 /nfs/dbraw/zinc/23/60/53/1050236053.db2.gz KGOZLMHBKWWILN-LBPRGKRZSA-N 1 2 322.437 4.034 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(-c3nccn3C)cc2)cc1 ZINC001210435262 1050246195 /nfs/dbraw/zinc/24/61/95/1050246195.db2.gz CIVWTTMSGMNWCG-UHFFFAOYSA-N 1 2 306.413 4.287 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(-c3nccn3C)cc2)cc1 ZINC001210435262 1050246207 /nfs/dbraw/zinc/24/62/07/1050246207.db2.gz CIVWTTMSGMNWCG-UHFFFAOYSA-N 1 2 306.413 4.287 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1nc2ccccc2s1 ZINC001136955955 1050252719 /nfs/dbraw/zinc/25/27/19/1050252719.db2.gz BSCIHTIUPZWIBF-ZDUSSCGKSA-N 1 2 312.438 4.498 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1nc2ccccc2s1 ZINC001136955955 1050252734 /nfs/dbraw/zinc/25/27/34/1050252734.db2.gz BSCIHTIUPZWIBF-ZDUSSCGKSA-N 1 2 312.438 4.498 20 0 DIADLO Cc1ccc2c(C[N@@H+]3CCOC[C@H]3c3ccc(F)cc3)c[nH]c2c1 ZINC001136976480 1050264859 /nfs/dbraw/zinc/26/48/59/1050264859.db2.gz CDIGRFVEKPRLFO-FQEVSTJZSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1ccc2c(C[N@H+]3CCOC[C@H]3c3ccc(F)cc3)c[nH]c2c1 ZINC001136976480 1050264863 /nfs/dbraw/zinc/26/48/63/1050264863.db2.gz CDIGRFVEKPRLFO-FQEVSTJZSA-N 1 2 324.399 4.189 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccc(Oc3cccnc3)c(C)c2)co1 ZINC000825050192 1050267573 /nfs/dbraw/zinc/26/75/73/1050267573.db2.gz KEZHDWHWKQOAST-UHFFFAOYSA-N 1 2 323.396 4.023 20 0 DIADLO CC1(C)C[N@H+](Cc2cc3ccccc3nc2Cl)C(C)(C)CO1 ZINC000734485335 1050276964 /nfs/dbraw/zinc/27/69/64/1050276964.db2.gz IAYFKTGOCGUWNW-UHFFFAOYSA-N 1 2 318.848 4.278 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc3ccccc3nc2Cl)C(C)(C)CO1 ZINC000734485335 1050276979 /nfs/dbraw/zinc/27/69/79/1050276979.db2.gz IAYFKTGOCGUWNW-UHFFFAOYSA-N 1 2 318.848 4.278 20 0 DIADLO CC(C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)=C1CCC1 ZINC000825118387 1050276966 /nfs/dbraw/zinc/27/69/66/1050276966.db2.gz SFYCZTXHGZSTEF-UHFFFAOYSA-N 1 2 321.424 4.325 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)cc1C ZINC001137004962 1050284742 /nfs/dbraw/zinc/28/47/42/1050284742.db2.gz UJUWLMGXOHTOKN-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)cc1C ZINC001137004962 1050284757 /nfs/dbraw/zinc/28/47/57/1050284757.db2.gz UJUWLMGXOHTOKN-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)s2)cn1 ZINC001137036343 1050310003 /nfs/dbraw/zinc/31/00/03/1050310003.db2.gz FSEVRGXCPINISC-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)cn1 ZINC001137036343 1050310013 /nfs/dbraw/zinc/31/00/13/1050310013.db2.gz FSEVRGXCPINISC-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cnc(C(F)(F)F)nc3)ccc12 ZINC001210671908 1050333368 /nfs/dbraw/zinc/33/33/68/1050333368.db2.gz ONXIZVUZQYLBNJ-UHFFFAOYSA-N 1 2 304.275 4.096 20 0 DIADLO COC[C@H]1CCC[N@@H+]1Cc1c(Cl)cc(Cl)cc1Cl ZINC001143797981 1050363383 /nfs/dbraw/zinc/36/33/83/1050363383.db2.gz ZRACOPXAKLHNCM-SNVBAGLBSA-N 1 2 308.636 4.258 20 0 DIADLO CC[N@H+](Cc1ncc(C)s1)Cc1ccc(C(F)(F)F)cc1 ZINC000772173616 1050336703 /nfs/dbraw/zinc/33/67/03/1050336703.db2.gz ABRFABROHSRGAW-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO CC[N@@H+](Cc1ncc(C)s1)Cc1ccc(C(F)(F)F)cc1 ZINC000772173616 1050336715 /nfs/dbraw/zinc/33/67/15/1050336715.db2.gz ABRFABROHSRGAW-UHFFFAOYSA-N 1 2 314.376 4.492 20 0 DIADLO COC[C@H]1CCC[N@H+]1Cc1c(Cl)cc(Cl)cc1Cl ZINC001143797981 1050363391 /nfs/dbraw/zinc/36/33/91/1050363391.db2.gz ZRACOPXAKLHNCM-SNVBAGLBSA-N 1 2 308.636 4.258 20 0 DIADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1cc(Cl)ccc1OC(F)(F)F ZINC001143704511 1050339757 /nfs/dbraw/zinc/33/97/57/1050339757.db2.gz IJBZWWWNPKQVDC-KPXOXKRLSA-N 1 2 323.717 4.171 20 0 DIADLO F[C@@H]1C[C@@H]2C[C@H]1C[N@H+]2Cc1cc(Cl)ccc1OC(F)(F)F ZINC001143704511 1050339773 /nfs/dbraw/zinc/33/97/73/1050339773.db2.gz IJBZWWWNPKQVDC-KPXOXKRLSA-N 1 2 323.717 4.171 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(OCC(F)(F)F)cc2)[nH+]1 ZINC001210741293 1050356614 /nfs/dbraw/zinc/35/66/14/1050356614.db2.gz MIFLWPIROFKGKC-UHFFFAOYSA-N 1 2 321.302 4.327 20 0 DIADLO COc1c(F)c(F)c(Nc2ccc(C)[nH+]c2C)c(F)c1F ZINC001210758216 1050360296 /nfs/dbraw/zinc/36/02/96/1050360296.db2.gz JUOGXFHPFOQMSO-UHFFFAOYSA-N 1 2 300.255 4.007 20 0 DIADLO CCCC[C@@H](CC)CC(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000735250784 1050362260 /nfs/dbraw/zinc/36/22/60/1050362260.db2.gz LJAPCMUTGNETMO-MRXNPFEDSA-N 1 2 313.445 4.095 20 0 DIADLO C[C@H]1CC[C@H](CO)C[N@@H+]1Cc1c(Cl)cc(Cl)cc1Cl ZINC001143797677 1050362887 /nfs/dbraw/zinc/36/28/87/1050362887.db2.gz OSYCXILOYGHZHE-UWVGGRQHSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1CC[C@H](CO)C[N@H+]1Cc1c(Cl)cc(Cl)cc1Cl ZINC001143797677 1050362894 /nfs/dbraw/zinc/36/28/94/1050362894.db2.gz OSYCXILOYGHZHE-UWVGGRQHSA-N 1 2 322.663 4.240 20 0 DIADLO CCOc1c(Cl)ccc(C[N@H+](C)C2CC(F)(F)C2)c1F ZINC001143824940 1050367504 /nfs/dbraw/zinc/36/75/04/1050367504.db2.gz XFPHGWLZXZLWNV-UHFFFAOYSA-N 1 2 307.743 4.107 20 0 DIADLO CCOc1c(Cl)ccc(C[N@@H+](C)C2CC(F)(F)C2)c1F ZINC001143824940 1050367520 /nfs/dbraw/zinc/36/75/20/1050367520.db2.gz XFPHGWLZXZLWNV-UHFFFAOYSA-N 1 2 307.743 4.107 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nc(C(C)C)n2ccccc12 ZINC000574046077 1050371373 /nfs/dbraw/zinc/37/13/73/1050371373.db2.gz AOBICMZEYJPSBD-GOSISDBHSA-N 1 2 322.456 4.436 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nc(C(C)C)n2ccccc12 ZINC000574046077 1050371378 /nfs/dbraw/zinc/37/13/78/1050371378.db2.gz AOBICMZEYJPSBD-GOSISDBHSA-N 1 2 322.456 4.436 20 0 DIADLO CC(C)[C@@H]1COCC[N@@H+]1Cc1ccc(C(F)(F)F)c(Cl)c1 ZINC001143810621 1050371476 /nfs/dbraw/zinc/37/14/76/1050371476.db2.gz UKXBTVJFJKTUKZ-AWEZNQCLSA-N 1 2 321.770 4.216 20 0 DIADLO CC(C)[C@@H]1COCC[N@H+]1Cc1ccc(C(F)(F)F)c(Cl)c1 ZINC001143810621 1050371485 /nfs/dbraw/zinc/37/14/85/1050371485.db2.gz UKXBTVJFJKTUKZ-AWEZNQCLSA-N 1 2 321.770 4.216 20 0 DIADLO Clc1cccc2c(NCc3nnc(C4CC4)s3)cc[nH+]c12 ZINC000574138367 1050372934 /nfs/dbraw/zinc/37/29/34/1050372934.db2.gz LBNFRGQLYPTJOX-UHFFFAOYSA-N 1 2 316.817 4.229 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[NH+]1CCC2(CCCO2)CC1 ZINC001143859857 1050378578 /nfs/dbraw/zinc/37/85/78/1050378578.db2.gz CDSCWGGRAJNYBI-UHFFFAOYSA-N 1 2 318.219 4.278 20 0 DIADLO CCN(C)c1ccc(Nc2cc(O)cc(C(F)(F)F)c2)c[nH+]1 ZINC001210824763 1050379804 /nfs/dbraw/zinc/37/98/04/1050379804.db2.gz YCHDMBQIQJQCGJ-UHFFFAOYSA-N 1 2 311.307 4.006 20 0 DIADLO Cc1cn2cccc(Nc3cc(O)cc(C(F)(F)F)c3)c2[nH+]1 ZINC001210822569 1050380087 /nfs/dbraw/zinc/38/00/87/1050380087.db2.gz KMOZGQAQSCBNKR-UHFFFAOYSA-N 1 2 307.275 4.111 20 0 DIADLO O=C(/C=C\C1CCCCC1)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000735432582 1050392794 /nfs/dbraw/zinc/39/27/94/1050392794.db2.gz MSBXWNGDMRUVOT-TWGQIWQCSA-N 1 2 313.376 4.086 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c(F)c1F ZINC001143904291 1050399272 /nfs/dbraw/zinc/39/92/72/1050399272.db2.gz NZUPJVUQUHBQNR-HNNXBMFYSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c(F)c1F ZINC001143904291 1050399281 /nfs/dbraw/zinc/39/92/81/1050399281.db2.gz NZUPJVUQUHBQNR-HNNXBMFYSA-N 1 2 321.342 4.450 20 0 DIADLO Nc1c(F)cc(Nc2cc[nH+]c3cc(Cl)ccc23)cc1F ZINC001210906091 1050409427 /nfs/dbraw/zinc/40/94/27/1050409427.db2.gz KFIPGPWDDNVGRM-UHFFFAOYSA-N 1 2 305.715 4.492 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(SC(C)(C)C)cc1)n1cc[nH+]c1 ZINC000844365600 1050409426 /nfs/dbraw/zinc/40/94/26/1050409426.db2.gz LXUXLDOAUPUNRR-ZDUSSCGKSA-N 1 2 317.458 4.364 20 0 DIADLO Cc1c(C[N@@H+]2CC[C@@](C)(F)[C@@H](F)C2)cccc1C(F)(F)F ZINC001143923276 1050409613 /nfs/dbraw/zinc/40/96/13/1050409613.db2.gz UJWSJAWTKSOJMV-UONOGXRCSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1c(C[N@H+]2CC[C@@](C)(F)[C@@H](F)C2)cccc1C(F)(F)F ZINC001143923276 1050409618 /nfs/dbraw/zinc/40/96/18/1050409618.db2.gz UJWSJAWTKSOJMV-UONOGXRCSA-N 1 2 307.306 4.286 20 0 DIADLO CCOc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)c1F ZINC001143937386 1050409767 /nfs/dbraw/zinc/40/97/67/1050409767.db2.gz LVESHAYRACHYQH-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2ccncc2)c1F ZINC001143937386 1050409779 /nfs/dbraw/zinc/40/97/79/1050409779.db2.gz LVESHAYRACHYQH-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO CC[C@@H]1CCC[C@]1(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001143939846 1050411226 /nfs/dbraw/zinc/41/12/26/1050411226.db2.gz PDJTZBLKYJEBSU-BEFAXECRSA-N 1 2 311.429 4.336 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(Cl)ccc(F)c2F)CCC1(F)F ZINC001143945235 1050412276 /nfs/dbraw/zinc/41/22/76/1050412276.db2.gz AMNSSICPWPZDEJ-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(Cl)ccc(F)c2F)CCC1(F)F ZINC001143945235 1050412283 /nfs/dbraw/zinc/41/22/83/1050412283.db2.gz AMNSSICPWPZDEJ-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO C[N@@H+](Cc1c(Cl)ccc(F)c1F)C[C@H]1Cc2ccccc2O1 ZINC001143969914 1050419623 /nfs/dbraw/zinc/41/96/23/1050419623.db2.gz FDZFXDBMYXDJHE-GFCCVEGCSA-N 1 2 323.770 4.054 20 0 DIADLO C[N@H+](Cc1c(Cl)ccc(F)c1F)C[C@H]1Cc2ccccc2O1 ZINC001143969914 1050419625 /nfs/dbraw/zinc/41/96/25/1050419625.db2.gz FDZFXDBMYXDJHE-GFCCVEGCSA-N 1 2 323.770 4.054 20 0 DIADLO FC(F)COCC[N@H+](Cc1c(Cl)cccc1Cl)C1CC1 ZINC001170050709 1050420229 /nfs/dbraw/zinc/42/02/29/1050420229.db2.gz CBLATBCWRPQQIF-UHFFFAOYSA-N 1 2 324.198 4.240 20 0 DIADLO FC(F)COCC[N@@H+](Cc1c(Cl)cccc1Cl)C1CC1 ZINC001170050709 1050420236 /nfs/dbraw/zinc/42/02/36/1050420236.db2.gz CBLATBCWRPQQIF-UHFFFAOYSA-N 1 2 324.198 4.240 20 0 DIADLO O=C1CCCc2ccc(Nc3ccc(-n4cc[nH+]c4)cc3)cc21 ZINC001210933740 1050422038 /nfs/dbraw/zinc/42/20/38/1050422038.db2.gz MFUXNHYQMYBSFB-UHFFFAOYSA-N 1 2 303.365 4.135 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)o1 ZINC000735674761 1050422001 /nfs/dbraw/zinc/42/20/01/1050422001.db2.gz UMBNKHSAIWGJCY-RDTXWAMCSA-N 1 2 316.470 4.477 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)o1 ZINC000735674761 1050422003 /nfs/dbraw/zinc/42/20/03/1050422003.db2.gz UMBNKHSAIWGJCY-RDTXWAMCSA-N 1 2 316.470 4.477 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CCS[C@H](C)[C@H]2c2ccccc2)o1 ZINC000735674759 1050422362 /nfs/dbraw/zinc/42/23/62/1050422362.db2.gz UMBNKHSAIWGJCY-KDOFPFPSSA-N 1 2 316.470 4.477 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CCS[C@H](C)[C@H]2c2ccccc2)o1 ZINC000735674759 1050422370 /nfs/dbraw/zinc/42/23/70/1050422370.db2.gz UMBNKHSAIWGJCY-KDOFPFPSSA-N 1 2 316.470 4.477 20 0 DIADLO FC1(F)C[C@@]12CCC[N@H+](Cc1nc(Cl)ccc1Cl)C2 ZINC000844438027 1050424758 /nfs/dbraw/zinc/42/47/58/1050424758.db2.gz AVWUQLLVGXTADV-GFCCVEGCSA-N 1 2 307.171 4.010 20 0 DIADLO FC1(F)C[C@@]12CCC[N@@H+](Cc1nc(Cl)ccc1Cl)C2 ZINC000844438027 1050424770 /nfs/dbraw/zinc/42/47/70/1050424770.db2.gz AVWUQLLVGXTADV-GFCCVEGCSA-N 1 2 307.171 4.010 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2ccccc2F)c1F ZINC001143979298 1050426613 /nfs/dbraw/zinc/42/66/13/1050426613.db2.gz YRKNLIRUTFVZPX-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@H]2c2ccccc2F)c1F ZINC001143979298 1050426618 /nfs/dbraw/zinc/42/66/18/1050426618.db2.gz YRKNLIRUTFVZPX-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)OCc1sccc1Cl)c1ccccc1 ZINC000785920210 1050427449 /nfs/dbraw/zinc/42/74/49/1050427449.db2.gz VHTKRKZARHOTNZ-OAHLLOKOSA-N 1 2 323.845 4.138 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)OCc1sccc1Cl)c1ccccc1 ZINC000785920210 1050427461 /nfs/dbraw/zinc/42/74/61/1050427461.db2.gz VHTKRKZARHOTNZ-OAHLLOKOSA-N 1 2 323.845 4.138 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2c(F)ccc(OC)c2F)cc1 ZINC001143980090 1050427639 /nfs/dbraw/zinc/42/76/39/1050427639.db2.gz BKKRRLRPIDPNMG-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2c(F)ccc(OC)c2F)cc1 ZINC001143980090 1050427659 /nfs/dbraw/zinc/42/76/59/1050427659.db2.gz BKKRRLRPIDPNMG-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)OC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000844469221 1050434859 /nfs/dbraw/zinc/43/48/59/1050434859.db2.gz DXGVREGWLXKUDD-AAEUAGOBSA-N 1 2 321.446 4.027 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)OC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000844469223 1050435560 /nfs/dbraw/zinc/43/55/60/1050435560.db2.gz DXGVREGWLXKUDD-DGCLKSJQSA-N 1 2 321.446 4.027 20 0 DIADLO CC[C@@H](OC(=O)C[C@H](C)n1cc[nH+]c1)c1cccc(Cl)c1F ZINC000844489975 1050439968 /nfs/dbraw/zinc/43/99/68/1050439968.db2.gz KXFOWPGDVRUOKR-SMDDNHRTSA-N 1 2 324.783 4.321 20 0 DIADLO CN(C)c1ccccc1C[N@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000574319323 1050440500 /nfs/dbraw/zinc/44/05/00/1050440500.db2.gz FIRFVVIJXOZGFU-UHFFFAOYSA-N 1 2 317.502 4.139 20 0 DIADLO CN(C)c1ccccc1C[N@@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000574319323 1050440517 /nfs/dbraw/zinc/44/05/17/1050440517.db2.gz FIRFVVIJXOZGFU-UHFFFAOYSA-N 1 2 317.502 4.139 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2CCCC[C@](C)(F)C2)cc1F ZINC001144020107 1050442376 /nfs/dbraw/zinc/44/23/76/1050442376.db2.gz AQSUHQSXTJCXEY-INIZCTEOSA-N 1 2 301.352 4.078 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2CCCC[C@](C)(F)C2)cc1F ZINC001144020107 1050442390 /nfs/dbraw/zinc/44/23/90/1050442390.db2.gz AQSUHQSXTJCXEY-INIZCTEOSA-N 1 2 301.352 4.078 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2CCC[C@H]2c2ccccn2)cc1F ZINC001144026272 1050444832 /nfs/dbraw/zinc/44/48/32/1050444832.db2.gz NSQXGHDEDLMRJU-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2CCC[C@H]2c2ccccn2)cc1F ZINC001144026272 1050444842 /nfs/dbraw/zinc/44/48/42/1050444842.db2.gz NSQXGHDEDLMRJU-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1ccc(Nc2cccc(C(=O)NC3CCCCC3)c2)[nH+]c1 ZINC001211013734 1050446899 /nfs/dbraw/zinc/44/68/99/1050446899.db2.gz LXRILPSHRJMZCI-UHFFFAOYSA-N 1 2 309.413 4.196 20 0 DIADLO CN(c1ccc(Nc2cnnc(Cl)c2)c[nH+]1)C1CCCCC1 ZINC001212613346 1050460742 /nfs/dbraw/zinc/46/07/42/1050460742.db2.gz PIBCHGQITQIFGM-UHFFFAOYSA-N 1 2 317.824 4.038 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2cccc(O)c2C)on1 ZINC001144118332 1050470872 /nfs/dbraw/zinc/47/08/72/1050470872.db2.gz SWJUORTVJIJQGL-UHFFFAOYSA-N 1 2 322.408 4.199 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2cccc(O)c2C)on1 ZINC001144118332 1050470883 /nfs/dbraw/zinc/47/08/83/1050470883.db2.gz SWJUORTVJIJQGL-UHFFFAOYSA-N 1 2 322.408 4.199 20 0 DIADLO F/C=C(\CCc1ccc(F)cc1)CNc1ccn2cc[nH+]c2c1 ZINC001170057185 1050476480 /nfs/dbraw/zinc/47/64/80/1050476480.db2.gz SNPIURCGSVUPIQ-NTCAYCPXSA-N 1 2 313.351 4.372 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1ccc(SC)o1 ZINC000641749978 1050488094 /nfs/dbraw/zinc/48/80/94/1050488094.db2.gz KWAMQKBYTSCDAQ-UHFFFAOYSA-N 1 2 303.383 4.046 20 0 DIADLO CC[N@H+](Cc1[nH]nc2ccc(F)cc21)Cc1cccc(F)c1F ZINC001144200284 1050494428 /nfs/dbraw/zinc/49/44/28/1050494428.db2.gz BXOCLHNZHGBSST-UHFFFAOYSA-N 1 2 319.330 4.002 20 0 DIADLO CC[N@@H+](Cc1[nH]nc2ccc(F)cc21)Cc1cccc(F)c1F ZINC001144200284 1050494436 /nfs/dbraw/zinc/49/44/36/1050494436.db2.gz BXOCLHNZHGBSST-UHFFFAOYSA-N 1 2 319.330 4.002 20 0 DIADLO Cc1cc(Br)cc(C[N@@H+]2CCC[C@@](C)(F)C2)c1 ZINC001144214625 1050495984 /nfs/dbraw/zinc/49/59/84/1050495984.db2.gz IZCQDOSRRXDQKM-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cc(Br)cc(C[N@H+]2CCC[C@@](C)(F)C2)c1 ZINC001144214625 1050495993 /nfs/dbraw/zinc/49/59/93/1050495993.db2.gz IZCQDOSRRXDQKM-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1n[nH]c2ccc(F)cc21 ZINC001144202516 1050498466 /nfs/dbraw/zinc/49/84/66/1050498466.db2.gz SSHNLVJWQOMWQO-IBGZPJMESA-N 1 2 309.388 4.211 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1n[nH]c2ccc(F)cc21 ZINC001144202516 1050498477 /nfs/dbraw/zinc/49/84/77/1050498477.db2.gz SSHNLVJWQOMWQO-IBGZPJMESA-N 1 2 309.388 4.211 20 0 DIADLO Nc1ccc(C(F)(F)F)cc1Nc1[nH+]cccc1N1CCCC1 ZINC001211149871 1050498699 /nfs/dbraw/zinc/49/86/99/1050498699.db2.gz ARLBTFFZLBARPL-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO Cc1ccccc1-c1nn(C[N@@H+](C)CC(C)(C)C)c(=S)o1 ZINC000738099668 1050522235 /nfs/dbraw/zinc/52/22/35/1050522235.db2.gz QAAJMHBOIGUCHT-UHFFFAOYSA-N 1 2 305.447 4.116 20 0 DIADLO Cc1ccccc1-c1nn(C[N@H+](C)CC(C)(C)C)c(=S)o1 ZINC000738099668 1050522240 /nfs/dbraw/zinc/52/22/40/1050522240.db2.gz QAAJMHBOIGUCHT-UHFFFAOYSA-N 1 2 305.447 4.116 20 0 DIADLO CC[N@H+](Cn1nc(-c2ccc(Cl)cc2)oc1=S)C1CCC1 ZINC000738055461 1050524711 /nfs/dbraw/zinc/52/47/11/1050524711.db2.gz NDCFZDKGAVISDM-UHFFFAOYSA-N 1 2 323.849 4.358 20 0 DIADLO CC[N@@H+](Cn1nc(-c2ccc(Cl)cc2)oc1=S)C1CCC1 ZINC000738055461 1050524722 /nfs/dbraw/zinc/52/47/22/1050524722.db2.gz NDCFZDKGAVISDM-UHFFFAOYSA-N 1 2 323.849 4.358 20 0 DIADLO CCSc1nn(C[N@@H+]2CCCCC[C@H]2C)c(=S)s1 ZINC000738226668 1050527082 /nfs/dbraw/zinc/52/70/82/1050527082.db2.gz YRKAZJHUAAPNIZ-SNVBAGLBSA-N 1 2 303.522 4.008 20 0 DIADLO CCSc1nn(C[N@H+]2CCCCC[C@H]2C)c(=S)s1 ZINC000738226668 1050527096 /nfs/dbraw/zinc/52/70/96/1050527096.db2.gz YRKAZJHUAAPNIZ-SNVBAGLBSA-N 1 2 303.522 4.008 20 0 DIADLO Cc1cc[nH+]c(Nc2ccc3c(cnn3C(=O)OC(C)(C)C)c2)c1 ZINC001211253307 1050529247 /nfs/dbraw/zinc/52/92/47/1050529247.db2.gz DZECLKNTGYFBDE-UHFFFAOYSA-N 1 2 324.384 4.267 20 0 DIADLO Cc1ccc([C@@H]2[C@H](C)CCC[N@@H+]2Cc2ncc(Cl)n2C)cc1 ZINC000738340203 1050531804 /nfs/dbraw/zinc/53/18/04/1050531804.db2.gz KYURLZIVWMDMDX-KDOFPFPSSA-N 1 2 317.864 4.355 20 0 DIADLO Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2Cc2ncc(Cl)n2C)cc1 ZINC000738340203 1050531819 /nfs/dbraw/zinc/53/18/19/1050531819.db2.gz KYURLZIVWMDMDX-KDOFPFPSSA-N 1 2 317.864 4.355 20 0 DIADLO Clc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(Cl)n1 ZINC001211278793 1050533712 /nfs/dbraw/zinc/53/37/12/1050533712.db2.gz KIJTXORNXZKDHX-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO Cc1nc(F)ccc1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC000787063791 1050552608 /nfs/dbraw/zinc/55/26/08/1050552608.db2.gz KZDQGVNDABTMPP-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000787063791 1050552620 /nfs/dbraw/zinc/55/26/20/1050552620.db2.gz KZDQGVNDABTMPP-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO CC[C@](C)(NC(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000738918965 1050556915 /nfs/dbraw/zinc/55/69/15/1050556915.db2.gz DRQQCCCPCBUERF-IBGZPJMESA-N 1 2 322.412 4.090 20 0 DIADLO C[C@H](SCc1c[nH+]cn1C)c1cccc(C(F)(F)F)c1 ZINC000594909070 1050558819 /nfs/dbraw/zinc/55/88/19/1050558819.db2.gz ABSGQJNZWITZKC-JTQLQIEISA-N 1 2 300.349 4.433 20 0 DIADLO C[C@H](CC(=O)O[C@H](C)c1cccc2ccccc21)n1cc[nH+]c1 ZINC000845280013 1050560193 /nfs/dbraw/zinc/56/01/93/1050560193.db2.gz ANILKHYSNWVWPA-HUUCEWRRSA-N 1 2 308.381 4.292 20 0 DIADLO O=C1CCCc2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc21 ZINC001213088880 1050582590 /nfs/dbraw/zinc/58/25/90/1050582590.db2.gz ITMFYAJYGLDZCG-UHFFFAOYSA-N 1 2 303.365 4.339 20 0 DIADLO O=c1cccc2[nH]cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc1-2 ZINC001213087132 1050583606 /nfs/dbraw/zinc/58/36/06/1050583606.db2.gz JLUFYKNDZIOZNR-UHFFFAOYSA-N 1 2 302.337 4.074 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3cc(-c4ccccc4)cnn3)cc2)[nH]1 ZINC001213088246 1050584448 /nfs/dbraw/zinc/58/44/48/1050584448.db2.gz XQHFLOMVUSQDNV-UHFFFAOYSA-N 1 2 313.364 4.277 20 0 DIADLO COc1c(F)cc(F)cc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213089914 1050585525 /nfs/dbraw/zinc/58/55/25/1050585525.db2.gz KWTMJHKNHBDSNW-UHFFFAOYSA-N 1 2 301.296 4.107 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)cc1F ZINC001144463485 1050589943 /nfs/dbraw/zinc/58/99/43/1050589943.db2.gz SDUCQXVXBKHYTD-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)cc1F ZINC001144463485 1050589954 /nfs/dbraw/zinc/58/99/54/1050589954.db2.gz SDUCQXVXBKHYTD-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)cc1F ZINC001144462837 1050590943 /nfs/dbraw/zinc/59/09/43/1050590943.db2.gz IUNQPSKERAXYQP-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)cc1F ZINC001144462837 1050590953 /nfs/dbraw/zinc/59/09/53/1050590953.db2.gz IUNQPSKERAXYQP-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(Cl)cc(C[N@H+](C)Cc2nc3ccccc3o2)c1 ZINC001144490401 1050598433 /nfs/dbraw/zinc/59/84/33/1050598433.db2.gz ZWQDXMWKSPYADP-UHFFFAOYSA-N 1 2 316.788 4.122 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+](C)Cc2nc3ccccc3o2)c1 ZINC001144490401 1050598449 /nfs/dbraw/zinc/59/84/49/1050598449.db2.gz ZWQDXMWKSPYADP-UHFFFAOYSA-N 1 2 316.788 4.122 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2ncc(CC)o2)o1 ZINC000574855106 1050604794 /nfs/dbraw/zinc/60/47/94/1050604794.db2.gz MVICWTORTACXLU-BBRMVZONSA-N 1 2 302.418 4.366 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2ncc(CC)o2)o1 ZINC000574855106 1050604799 /nfs/dbraw/zinc/60/47/99/1050604799.db2.gz MVICWTORTACXLU-BBRMVZONSA-N 1 2 302.418 4.366 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1c(F)cc(O)cc1F ZINC001144545103 1050608562 /nfs/dbraw/zinc/60/85/62/1050608562.db2.gz SCPTXTPKAIWKNX-GOSISDBHSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1c(F)cc(O)cc1F ZINC001144545103 1050608569 /nfs/dbraw/zinc/60/85/69/1050608569.db2.gz SCPTXTPKAIWKNX-GOSISDBHSA-N 1 2 303.352 4.316 20 0 DIADLO FC(F)(F)c1ncccc1C[N@@H+]1CCSc2ccccc2C1 ZINC001144537970 1050611340 /nfs/dbraw/zinc/61/13/40/1050611340.db2.gz CUFFJLSTTQVTIX-UHFFFAOYSA-N 1 2 324.371 4.208 20 0 DIADLO FC(F)(F)c1ncccc1C[N@H+]1CCSc2ccccc2C1 ZINC001144537970 1050611351 /nfs/dbraw/zinc/61/13/51/1050611351.db2.gz CUFFJLSTTQVTIX-UHFFFAOYSA-N 1 2 324.371 4.208 20 0 DIADLO Cc1cn2cccc(Nc3ccc(OCC(F)F)cc3)c2[nH+]1 ZINC001213301544 1050623403 /nfs/dbraw/zinc/62/34/03/1050623403.db2.gz VERVIPALBNRJNS-UHFFFAOYSA-N 1 2 303.312 4.030 20 0 DIADLO CC[C@@H](Nc1ccc(Cn2cc[nH+]c2)cn1)c1ccccc1C ZINC001171199857 1050623963 /nfs/dbraw/zinc/62/39/63/1050623963.db2.gz KTZHQBNKXWSVLW-GOSISDBHSA-N 1 2 306.413 4.198 20 0 DIADLO CC(C)N(C(=O)C[C@H](C)n1cc[nH+]c1)c1ccc(F)cc1Cl ZINC000575050059 1050628211 /nfs/dbraw/zinc/62/82/11/1050628211.db2.gz YSLDGWDIWWXWAX-LBPRGKRZSA-N 1 2 323.799 4.068 20 0 DIADLO CC[C@@]1(C)CCC[C@@H]1[NH2+]c1ccc(N2CCC(O)CC2)cc1 ZINC000845916538 1050630974 /nfs/dbraw/zinc/63/09/74/1050630974.db2.gz WUEHQBUOWSVOGD-OALUTQOASA-N 1 2 302.462 4.028 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](C)[C@@H]1CCc2c1cccc2Cl ZINC000788007859 1050634658 /nfs/dbraw/zinc/63/46/58/1050634658.db2.gz ZQROKZCXGOCQSC-OAHLLOKOSA-N 1 2 324.255 4.155 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](C)[C@@H]1CCc2c1cccc2Cl ZINC000788007859 1050634661 /nfs/dbraw/zinc/63/46/61/1050634661.db2.gz ZQROKZCXGOCQSC-OAHLLOKOSA-N 1 2 324.255 4.155 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1)Cc1cc(F)c(O)cc1F ZINC001144657954 1050643320 /nfs/dbraw/zinc/64/33/20/1050643320.db2.gz ONKGLFHVLSLAFZ-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)cc1)Cc1cc(F)c(O)cc1F ZINC001144657954 1050643324 /nfs/dbraw/zinc/64/33/24/1050643324.db2.gz ONKGLFHVLSLAFZ-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)c(O)cc2F)cc1 ZINC001144665682 1050645840 /nfs/dbraw/zinc/64/58/40/1050645840.db2.gz CYDXHYZLFABRCE-KRWDZBQOSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)c(O)cc2F)cc1 ZINC001144665682 1050645842 /nfs/dbraw/zinc/64/58/42/1050645842.db2.gz CYDXHYZLFABRCE-KRWDZBQOSA-N 1 2 303.352 4.316 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)c(O)cc2F)cc1 ZINC001144667068 1050646429 /nfs/dbraw/zinc/64/64/29/1050646429.db2.gz QTBCNHHUNQZPFJ-QGZVFWFLSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)c(O)cc2F)cc1 ZINC001144667068 1050646433 /nfs/dbraw/zinc/64/64/33/1050646433.db2.gz QTBCNHHUNQZPFJ-QGZVFWFLSA-N 1 2 319.351 4.016 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1ccc2ccccc2c1 ZINC000772714836 1050655218 /nfs/dbraw/zinc/65/52/18/1050655218.db2.gz AVXFJCIOFJZTEP-OAHLLOKOSA-N 1 2 322.408 4.282 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1ccc2ccccc2c1 ZINC000772714836 1050655233 /nfs/dbraw/zinc/65/52/33/1050655233.db2.gz AVXFJCIOFJZTEP-OAHLLOKOSA-N 1 2 322.408 4.282 20 0 DIADLO CC[C@H]([NH2+]Cc1occc1Br)c1ccccc1F ZINC000846043788 1050657564 /nfs/dbraw/zinc/65/75/64/1050657564.db2.gz CNBYBBANPVUUEW-ZDUSSCGKSA-N 1 2 312.182 4.422 20 0 DIADLO COC(=O)c1oc([C@@H](C)[N@@H+]2CC[C@H]2c2ccc(F)cc2)cc1C ZINC000595701873 1050663424 /nfs/dbraw/zinc/66/34/24/1050663424.db2.gz GWQHSAFMQWJGQZ-DOMZBBRYSA-N 1 2 317.360 4.022 20 0 DIADLO COC(=O)c1oc([C@@H](C)[N@H+]2CC[C@H]2c2ccc(F)cc2)cc1C ZINC000595701873 1050663432 /nfs/dbraw/zinc/66/34/32/1050663432.db2.gz GWQHSAFMQWJGQZ-DOMZBBRYSA-N 1 2 317.360 4.022 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)CC[C@@]1(C)O ZINC001231480744 1050668108 /nfs/dbraw/zinc/66/81/08/1050668108.db2.gz XEKJQTIXNQEXTP-YMTOWFKASA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)CC[C@@]1(C)O ZINC001231480744 1050668112 /nfs/dbraw/zinc/66/81/12/1050668112.db2.gz XEKJQTIXNQEXTP-YMTOWFKASA-N 1 2 322.663 4.240 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(OCC(F)(F)F)nc1 ZINC001213494495 1050669113 /nfs/dbraw/zinc/66/91/13/1050669113.db2.gz ABHVDLGYPHYCPE-UHFFFAOYSA-N 1 2 323.318 4.347 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1csc(Br)n1 ZINC001213494745 1050670043 /nfs/dbraw/zinc/67/00/43/1050670043.db2.gz HVXSAMCAWNTORC-UHFFFAOYSA-N 1 2 310.220 4.230 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnc(C(F)(F)F)cc1N ZINC001213495082 1050670164 /nfs/dbraw/zinc/67/01/64/1050670164.db2.gz PMZSMIYLUXSEIG-UHFFFAOYSA-N 1 2 308.307 4.007 20 0 DIADLO COC(=O)c1cc(Nc2cc(C3CC3)c[nH+]c2C)c(F)cc1F ZINC001213499656 1050671677 /nfs/dbraw/zinc/67/16/77/1050671677.db2.gz UVMZNRZOXQMIIF-UHFFFAOYSA-N 1 2 318.323 4.076 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnc2cc(C(C)(C)C)nn2c1 ZINC001213496873 1050671858 /nfs/dbraw/zinc/67/18/58/1050671858.db2.gz BJMRSNJKPAVPGO-UHFFFAOYSA-N 1 2 321.428 4.351 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2nnc(C(C)C)n2c1 ZINC001213497353 1050672328 /nfs/dbraw/zinc/67/23/28/1050672328.db2.gz OUPXJXDZSYGTJK-UHFFFAOYSA-N 1 2 307.401 4.177 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cccc(C(=O)NC(C)C)c1 ZINC001213499644 1050672842 /nfs/dbraw/zinc/67/28/42/1050672842.db2.gz UHZMSWVCLYMCEW-UHFFFAOYSA-N 1 2 309.413 4.149 20 0 DIADLO CCCOC1CC[NH+](Cc2cc(F)c(F)cc2Cl)CC1 ZINC001144725963 1050674180 /nfs/dbraw/zinc/67/41/80/1050674180.db2.gz BYERUPBMIVTIOS-UHFFFAOYSA-N 1 2 303.780 4.009 20 0 DIADLO CCOc1ccc(-c2cc(Nc3c[nH+]c(C)cc3C)on2)cc1 ZINC001213503352 1050674203 /nfs/dbraw/zinc/67/42/03/1050674203.db2.gz ASQFDSHYRIZPCX-UHFFFAOYSA-N 1 2 309.369 4.496 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2c(c1)C[C@H](C)C(=O)N2C ZINC001213503419 1050674281 /nfs/dbraw/zinc/67/42/81/1050674281.db2.gz FASGICLKLGSUJP-LBPRGKRZSA-N 1 2 321.424 4.166 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cccc(C(=O)NCC(C)C)c1 ZINC001213501168 1050674952 /nfs/dbraw/zinc/67/49/52/1050674952.db2.gz KTIWBLYWQQERAR-UHFFFAOYSA-N 1 2 323.440 4.397 20 0 DIADLO Cc1cc(C)c(Nc2nc(C)c(C)cc2Br)c[nH+]1 ZINC001213508641 1050677101 /nfs/dbraw/zinc/67/71/01/1050677101.db2.gz YDEHGSANEVMEJU-UHFFFAOYSA-N 1 2 306.207 4.216 20 0 DIADLO Cc1cc(Nc2c[nH+]c(C)cc2C)n(Cc2cccc(F)c2)n1 ZINC001213511103 1050677372 /nfs/dbraw/zinc/67/73/72/1050677372.db2.gz WHTFAISQMIJVKJ-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO Cc1cc(C)c(Nc2cccc(-c3nc(CO)cs3)c2)c[nH+]1 ZINC001213520942 1050679414 /nfs/dbraw/zinc/67/94/14/1050679414.db2.gz LMTVJGLTQHTVFF-UHFFFAOYSA-N 1 2 311.410 4.058 20 0 DIADLO Cc1c[nH+]cc(Nc2cc(C(C)(C)C)nn2-c2cccnc2)c1C ZINC001213527483 1050679811 /nfs/dbraw/zinc/67/98/11/1050679811.db2.gz NRTGKFQBVMQRQR-UHFFFAOYSA-N 1 2 321.428 4.320 20 0 DIADLO CCOC(=O)c1cnc2cc(Nc3c[nH+]c(C)cc3C)ccc2c1 ZINC001213520685 1050679851 /nfs/dbraw/zinc/67/98/51/1050679851.db2.gz FVQOACJVRPGZFJ-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO Cc1cnn(Cc2ccccc2F)c1Nc1c[nH+]cc(C)c1C ZINC001213527604 1050680101 /nfs/dbraw/zinc/68/01/01/1050680101.db2.gz VINYRHCJCVTREG-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO CCOC(=O)Cc1ccc(Cl)c(Nc2c[nH+]cc(C)c2C)c1 ZINC001213536908 1050682373 /nfs/dbraw/zinc/68/23/73/1050682373.db2.gz RSCLYTOVIJJIKY-UHFFFAOYSA-N 1 2 318.804 4.201 20 0 DIADLO COc1cccc(Nc2c[nH+]cc(C)c2C)c1Br ZINC001213530794 1050682527 /nfs/dbraw/zinc/68/25/27/1050682527.db2.gz LOZAUIDGFNBLFJ-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO CCOC(=O)c1cnc2cccc(Nc3c[nH+]cc(C)c3C)c2c1 ZINC001213534289 1050682457 /nfs/dbraw/zinc/68/24/57/1050682457.db2.gz VLNVPXXQPBWWDT-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO Cc1c[nH+]cc(Nc2cccc(-c3nc(CO)cs3)c2)c1C ZINC001213536739 1050682882 /nfs/dbraw/zinc/68/28/82/1050682882.db2.gz NTRTZUAWMDHCTP-UHFFFAOYSA-N 1 2 311.410 4.058 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1Nc1[nH+]ccc2ccccc21 ZINC001213554296 1050683769 /nfs/dbraw/zinc/68/37/69/1050683769.db2.gz HORGADJKZWKITE-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO C[C@@H]([NH2+]CCN1CCC[C@H]1C)c1cc(Cl)sc1Cl ZINC000766271925 1050694221 /nfs/dbraw/zinc/69/42/21/1050694221.db2.gz HIFOQNFPVCGTOE-NXEZZACHSA-N 1 2 307.290 4.190 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+]1CCc2ccccc2[C@@H]1C ZINC001144744972 1050695639 /nfs/dbraw/zinc/69/56/39/1050695639.db2.gz JYALZZNVUWITJO-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+]1CCc2ccccc2[C@@H]1C ZINC001144744972 1050695644 /nfs/dbraw/zinc/69/56/44/1050695644.db2.gz JYALZZNVUWITJO-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)CC[C@]1(C)O ZINC001231599040 1050697137 /nfs/dbraw/zinc/69/71/37/1050697137.db2.gz ZLIDLPJOLVIPRA-OTYXRUKQSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)CC[C@]1(C)O ZINC001231599040 1050697144 /nfs/dbraw/zinc/69/71/44/1050697144.db2.gz ZLIDLPJOLVIPRA-OTYXRUKQSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nncn1C)c1ccccc1SC(C)(C)C ZINC000788589417 1050710235 /nfs/dbraw/zinc/71/02/35/1050710235.db2.gz RFMJZXPGEVJVLQ-OLZOCXBDSA-N 1 2 318.490 4.118 20 0 DIADLO CCc1nc2sc3c(c2c(NC(=[NH2+])C(C)(C)C)n1)CCC3 ZINC001155179967 1050711835 /nfs/dbraw/zinc/71/18/35/1050711835.db2.gz FIQFTJZITOQPFW-UHFFFAOYSA-N 1 2 302.447 4.178 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@H](Cc1ccccc1)c1ccccc1 ZINC000180001986 1050712006 /nfs/dbraw/zinc/71/20/06/1050712006.db2.gz UMBIJTGCPPLEGY-FOIQADDNSA-N 1 2 305.425 4.353 20 0 DIADLO CCO[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)C1 ZINC001231604650 1050713562 /nfs/dbraw/zinc/71/35/62/1050713562.db2.gz PRMUQIINHRGRAR-LLVKDONJSA-N 1 2 308.636 4.258 20 0 DIADLO CCO[C@@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)C1 ZINC001231604650 1050713551 /nfs/dbraw/zinc/71/35/51/1050713551.db2.gz PRMUQIINHRGRAR-LLVKDONJSA-N 1 2 308.636 4.258 20 0 DIADLO c1cn(-c2ccc(CSCC[C@@H]3CCCCO3)cc2)c[nH+]1 ZINC000596355448 1050722828 /nfs/dbraw/zinc/72/28/28/1050722828.db2.gz AOLRSTGFHRYTEW-KRWDZBQOSA-N 1 2 302.443 4.065 20 0 DIADLO Cc1nn(C)c2cc(Nc3ccc[nH+]c3N3CCCCC3)ccc12 ZINC001213752906 1050727467 /nfs/dbraw/zinc/72/74/67/1050727467.db2.gz NRDSRUVYHPLANG-UHFFFAOYSA-N 1 2 321.428 4.011 20 0 DIADLO CC(C)[C@H](O)Cc1ccccc1-c1cccc(Cn2cc[nH+]c2)c1 ZINC000846778806 1050749816 /nfs/dbraw/zinc/74/98/16/1050749816.db2.gz DUJSQMMXOQNPMJ-OAQYLSRUSA-N 1 2 320.436 4.158 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncnn1C)c1ccccc1SC(C)(C)C ZINC000788778089 1050752422 /nfs/dbraw/zinc/75/24/22/1050752422.db2.gz QUHIBGQLWGNKFU-OLZOCXBDSA-N 1 2 318.490 4.118 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(N3CCCC3)cc2F)c[nH+]1 ZINC001213847789 1050763842 /nfs/dbraw/zinc/76/38/42/1050763842.db2.gz LYYJMMXQPYEAHB-UHFFFAOYSA-N 1 2 314.408 4.021 20 0 DIADLO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846870563 1050766832 /nfs/dbraw/zinc/76/68/32/1050766832.db2.gz ZZKFDIQKZGBLCS-JTQLQIEISA-N 1 2 310.722 4.037 20 0 DIADLO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846870563 1050766845 /nfs/dbraw/zinc/76/68/45/1050766845.db2.gz ZZKFDIQKZGBLCS-JTQLQIEISA-N 1 2 310.722 4.037 20 0 DIADLO Cc1c2ccccc2oc1[C@@H]([NH2+]Cc1cnsn1)C(C)C ZINC000846844010 1050769131 /nfs/dbraw/zinc/76/91/31/1050769131.db2.gz JZDHBUDJFJCUTN-HNNXBMFYSA-N 1 2 301.415 4.080 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CCC34CCCC4)cc2)C[C@H](C)O1 ZINC000788986688 1050771379 /nfs/dbraw/zinc/77/13/79/1050771379.db2.gz YSRSGMWDOKQZGU-FCEWJHQRSA-N 1 2 314.473 4.435 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846936783 1050782153 /nfs/dbraw/zinc/78/21/53/1050782153.db2.gz NFKHTUJBUIMHCB-PSASIEDQSA-N 1 2 310.722 4.037 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846936783 1050782167 /nfs/dbraw/zinc/78/21/67/1050782167.db2.gz NFKHTUJBUIMHCB-PSASIEDQSA-N 1 2 310.722 4.037 20 0 DIADLO Cc1ccc(N)cc1Nc1ccc(N(C)C2CCCCC2)[nH+]c1 ZINC001212615093 1050784266 /nfs/dbraw/zinc/78/42/66/1050784266.db2.gz GYODPBJLJFEATF-UHFFFAOYSA-N 1 2 310.445 4.485 20 0 DIADLO C/C(=C/C(=O)Nc1cccc2[nH+]ccn21)c1ccccc1Cl ZINC000741969501 1050788838 /nfs/dbraw/zinc/78/88/38/1050788838.db2.gz DNFAPMNTECCYOX-QXMHVHEDSA-N 1 2 311.772 4.030 20 0 DIADLO CCCCCC[C@H](C)C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000742056365 1050796934 /nfs/dbraw/zinc/79/69/34/1050796934.db2.gz SYRANTHGIUYJNH-JKSUJKDBSA-N 1 2 307.482 4.021 20 0 DIADLO CCC/C=C\C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000847007284 1050798103 /nfs/dbraw/zinc/79/81/03/1050798103.db2.gz DUTDMMFKEMKFNL-QCDXTXTGSA-N 1 2 309.413 4.181 20 0 DIADLO Nc1cc(-c2cc(C(F)(F)F)ccc2C(F)(F)F)cc[nH+]1 ZINC001241163705 1050805332 /nfs/dbraw/zinc/80/53/32/1050805332.db2.gz YOOFARWATJIROK-UHFFFAOYSA-N 1 2 306.209 4.368 20 0 DIADLO CCSc1nn(C[N@@H+]2C[C@@H](C)CCC[C@@H]2C)c(=S)s1 ZINC000742154455 1050806813 /nfs/dbraw/zinc/80/68/13/1050806813.db2.gz JRSDVFFTCUSROR-QWRGUYRKSA-N 1 2 317.549 4.254 20 0 DIADLO CCSc1nn(C[N@H+]2C[C@@H](C)CCC[C@@H]2C)c(=S)s1 ZINC000742154455 1050806823 /nfs/dbraw/zinc/80/68/23/1050806823.db2.gz JRSDVFFTCUSROR-QWRGUYRKSA-N 1 2 317.549 4.254 20 0 DIADLO COc1cc(F)c(Nc2ccccc2-n2cc[nH+]c2)cc1Cl ZINC001214065147 1050806954 /nfs/dbraw/zinc/80/69/54/1050806954.db2.gz DMJAZKUNKLMVSA-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO COc1ccc(C[NH2+]Cc2csc(C(C)(C)C)n2)cc1Cl ZINC000742368570 1050822235 /nfs/dbraw/zinc/82/22/35/1050822235.db2.gz JGQRKCIHWSKCRV-UHFFFAOYSA-N 1 2 324.877 4.392 20 0 DIADLO CC(C)c1cc(N[C@H]2COCc3ccccc32)nc(C(C)C)[nH+]1 ZINC001171292737 1050852324 /nfs/dbraw/zinc/85/23/24/1050852324.db2.gz XSEVMWFIUWNENG-KRWDZBQOSA-N 1 2 311.429 4.407 20 0 DIADLO COCOc1ccc(C)c(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001214361716 1050882090 /nfs/dbraw/zinc/88/20/90/1050882090.db2.gz RXZYUPUBNGXYDN-UHFFFAOYSA-N 1 2 317.776 4.022 20 0 DIADLO CC(C)(C)OC(=O)Nc1cccc(COc2cc[nH+]cc2)c1 ZINC000789742542 1050883000 /nfs/dbraw/zinc/88/30/00/1050883000.db2.gz ZNIXLHUBJJEZOC-UHFFFAOYSA-N 1 2 300.358 4.008 20 0 DIADLO CC[C@@H](Cc1ccccc1)C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000601961413 1050884640 /nfs/dbraw/zinc/88/46/40/1050884640.db2.gz ZYRZCUWFSHFGDH-KRWDZBQOSA-N 1 2 319.408 4.080 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(F)c(C(F)(F)F)c1F ZINC001241242496 1050925337 /nfs/dbraw/zinc/92/53/37/1050925337.db2.gz FJVMIUXTBWMXIF-UHFFFAOYSA-N 1 2 316.273 4.420 20 0 DIADLO CC(C)Cc1ccccc1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000790258038 1050932803 /nfs/dbraw/zinc/93/28/03/1050932803.db2.gz YNAAKJVITKSNRG-UHFFFAOYSA-N 1 2 319.408 4.323 20 0 DIADLO Cn1nccc1[C@H]1CCC[C@@H](Nc2ccc([NH+]3CCCC3)cc2)C1 ZINC000790493460 1050964671 /nfs/dbraw/zinc/96/46/71/1050964671.db2.gz ADCRYYLULGPXBD-FUHWJXTLSA-N 1 2 324.472 4.159 20 0 DIADLO Cn1nccc1[C@H]1CCC[C@@H]([NH2+]c2ccc(N3CCCC3)cc2)C1 ZINC000790493460 1050964686 /nfs/dbraw/zinc/96/46/86/1050964686.db2.gz ADCRYYLULGPXBD-FUHWJXTLSA-N 1 2 324.472 4.159 20 0 DIADLO COc1c(F)cc(Nc2cc(C)cc[nH+]2)cc1C(F)(F)F ZINC001214633242 1050967373 /nfs/dbraw/zinc/96/73/73/1050967373.db2.gz LCEAZBRGGUWILN-UHFFFAOYSA-N 1 2 300.255 4.300 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2c(F)ccc(OC)c2OC)cc1 ZINC001214707953 1050985422 /nfs/dbraw/zinc/98/54/22/1050985422.db2.gz RVMONUWXXHTKEW-UHFFFAOYSA-N 1 2 304.365 4.043 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2c(F)ccc(OC)c2OC)cc1 ZINC001214707953 1050985436 /nfs/dbraw/zinc/98/54/36/1050985436.db2.gz RVMONUWXXHTKEW-UHFFFAOYSA-N 1 2 304.365 4.043 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2cc(-c3ccc(F)cc3)no2)n1 ZINC000348119513 1050987582 /nfs/dbraw/zinc/98/75/82/1050987582.db2.gz ZODRNWXNKDSECJ-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2cc(-c3ccc(F)cc3)no2)n1 ZINC000348119509 1050987990 /nfs/dbraw/zinc/98/79/90/1050987990.db2.gz ZODRNWXNKDSECJ-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2nnc(-c3cccs3)o2)c(C)o1 ZINC000348105460 1050989620 /nfs/dbraw/zinc/98/96/20/1050989620.db2.gz DCQXCBYKVYCMEC-GHMZBOCLSA-N 1 2 317.414 4.420 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2Cl)nn1C ZINC000282782280 1051001493 /nfs/dbraw/zinc/00/14/93/1051001493.db2.gz PPQVXJZCYCXUGR-MNOVXSKESA-N 1 2 312.244 4.447 20 0 DIADLO Cc1[nH+]c2ccc(F)cn2c1Nc1ccc(Cl)c(O)c1F ZINC001214798526 1051004400 /nfs/dbraw/zinc/00/44/00/1051004400.db2.gz VEVBSGWBJIPORD-UHFFFAOYSA-N 1 2 309.703 4.024 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+]Cc1ccsc1Cl)CCC2 ZINC000790991248 1051012793 /nfs/dbraw/zinc/01/27/93/1051012793.db2.gz RUQXNNMKNIRPRJ-CYBMUJFWSA-N 1 2 309.866 4.346 20 0 DIADLO CCC[N@H+](CC)Cn1nc(CCCc2ccccc2)oc1=S ZINC000743359243 1051017737 /nfs/dbraw/zinc/01/77/37/1051017737.db2.gz JQGMMADNXKRQHT-UHFFFAOYSA-N 1 2 319.474 4.070 20 0 DIADLO CCC[N@@H+](CC)Cn1nc(CCCc2ccccc2)oc1=S ZINC000743359243 1051017751 /nfs/dbraw/zinc/01/77/51/1051017751.db2.gz JQGMMADNXKRQHT-UHFFFAOYSA-N 1 2 319.474 4.070 20 0 DIADLO CCC[C@H]1CC(=O)N(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)C1 ZINC000743349203 1051019571 /nfs/dbraw/zinc/01/95/71/1051019571.db2.gz BZJVPHYOHIMROZ-WMLDXEAASA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@H]1CC(=O)N(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)C1 ZINC000743349203 1051019581 /nfs/dbraw/zinc/01/95/81/1051019581.db2.gz BZJVPHYOHIMROZ-WMLDXEAASA-N 1 2 320.864 4.083 20 0 DIADLO Cc1cccc([C@@H]2CCCC[N@@H+]2Cn2ncsc2=S)c1C ZINC000743387032 1051019604 /nfs/dbraw/zinc/01/96/04/1051019604.db2.gz CQKYUJNZUIOWIK-HNNXBMFYSA-N 1 2 319.499 4.476 20 0 DIADLO Cc1cccc([C@@H]2CCCC[N@H+]2Cn2ncsc2=S)c1C ZINC000743387032 1051019612 /nfs/dbraw/zinc/01/96/12/1051019612.db2.gz CQKYUJNZUIOWIK-HNNXBMFYSA-N 1 2 319.499 4.476 20 0 DIADLO CCC[C@H]1CC(=O)N(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC000743348463 1051021282 /nfs/dbraw/zinc/02/12/82/1051021282.db2.gz MTELCSGXXWSWAV-WMLDXEAASA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@H]1CC(=O)N(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC000743348463 1051021296 /nfs/dbraw/zinc/02/12/96/1051021296.db2.gz MTELCSGXXWSWAV-WMLDXEAASA-N 1 2 320.864 4.083 20 0 DIADLO CCN(CC)C(=O)c1cccc(Nc2cc(C)cc(C)[nH+]2)c1F ZINC001215006731 1051051557 /nfs/dbraw/zinc/05/15/57/1051051557.db2.gz RKQRKPYSQQNARF-UHFFFAOYSA-N 1 2 315.392 4.063 20 0 DIADLO CC(C)Oc1ccc(F)c(F)c1Nc1cccn2cc[nH+]c12 ZINC001215073995 1051069831 /nfs/dbraw/zinc/06/98/31/1051069831.db2.gz MMGIMVGAVNWATA-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO COC(=O)c1cc(Nc2ccc3c(C)cc[nH+]c3c2)ccc1OC ZINC001215092780 1051074458 /nfs/dbraw/zinc/07/44/58/1051074458.db2.gz NPKPJVLDIRYVFE-UHFFFAOYSA-N 1 2 322.364 4.082 20 0 DIADLO COCOc1cc(C)c(Nc2ccccc2-n2cc[nH+]c2)c(C)c1 ZINC001215163833 1051095196 /nfs/dbraw/zinc/09/51/96/1051095196.db2.gz MZIDYWJDRYRNNA-UHFFFAOYSA-N 1 2 323.396 4.215 20 0 DIADLO COCOc1cc(C)c(Nc2cc[nH+]c(SC)c2)c(C)c1 ZINC001215163675 1051095574 /nfs/dbraw/zinc/09/55/74/1051095574.db2.gz DUUQOQCCJAGJSG-UHFFFAOYSA-N 1 2 304.415 4.147 20 0 DIADLO COc1cc(F)cc(CNc2cc3cc(F)ccc3c[nH+]2)c1 ZINC001171410556 1051096853 /nfs/dbraw/zinc/09/68/53/1051096853.db2.gz JMNCPFGWICBOKA-UHFFFAOYSA-N 1 2 300.308 4.134 20 0 DIADLO COc1cc(F)cc(CNc2nc(C(C)(C)C)[nH+]c(C)c2C)c1 ZINC001171412549 1051101449 /nfs/dbraw/zinc/10/14/49/1051101449.db2.gz CVWFDORTWUCDLI-UHFFFAOYSA-N 1 2 317.408 4.151 20 0 DIADLO CCc1ccc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)cc1 ZINC001215216666 1051119145 /nfs/dbraw/zinc/11/91/45/1051119145.db2.gz BFEPLBYOSWBTBA-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1cnc(C)s1 ZINC000744180714 1051127248 /nfs/dbraw/zinc/12/72/48/1051127248.db2.gz YIUMVFANVAHINM-UHFFFAOYSA-N 1 2 300.431 4.062 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F ZINC000716457343 1051130780 /nfs/dbraw/zinc/13/07/80/1051130780.db2.gz ODSMOJSPILZLNC-QMMMGPOBSA-N 1 2 302.180 4.015 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F ZINC000716457343 1051130784 /nfs/dbraw/zinc/13/07/84/1051130784.db2.gz ODSMOJSPILZLNC-QMMMGPOBSA-N 1 2 302.180 4.015 20 0 DIADLO COCOc1ccc(Nc2cccn3cc(C)[nH+]c23)cc1Cl ZINC001215253455 1051135791 /nfs/dbraw/zinc/13/57/91/1051135791.db2.gz YHDLTPDGBNGMQN-UHFFFAOYSA-N 1 2 317.776 4.022 20 0 DIADLO CCc1ccccc1-c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001215256293 1051136567 /nfs/dbraw/zinc/13/65/67/1051136567.db2.gz ALWNQHOLUWTTMU-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO FC(F)(F)[C@@H](Nc1cc2ccccc2c[nH+]1)c1ccccn1 ZINC001157685268 1051138963 /nfs/dbraw/zinc/13/89/63/1051138963.db2.gz XJZBWRJMFYLZON-HNNXBMFYSA-N 1 2 303.287 4.345 20 0 DIADLO Cc1cccc(F)c1-c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001215286707 1051151688 /nfs/dbraw/zinc/15/16/88/1051151688.db2.gz PYFTTZGNHHKZGL-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CC[N@H+](Cc1cnns1)C(c1ccccc1)c1ccccc1 ZINC001171500883 1051153471 /nfs/dbraw/zinc/15/34/71/1051153471.db2.gz FFSFOZPJMCMYQE-UHFFFAOYSA-N 1 2 309.438 4.150 20 0 DIADLO CC[N@@H+](Cc1cnns1)C(c1ccccc1)c1ccccc1 ZINC001171500883 1051153480 /nfs/dbraw/zinc/15/34/80/1051153480.db2.gz FFSFOZPJMCMYQE-UHFFFAOYSA-N 1 2 309.438 4.150 20 0 DIADLO COC(=[NH2+])c1cccc(NCc2nc(-c3ccccc3)cs2)c1 ZINC001170247439 1051171303 /nfs/dbraw/zinc/17/13/03/1051171303.db2.gz LNICUUYTNVCHTD-UHFFFAOYSA-N 1 2 323.421 4.394 20 0 DIADLO Cc1ccc(CC[C@@H](C)[NH2+]C(C)(C)C(=O)OC(C)(C)C)cc1 ZINC001171660625 1051185578 /nfs/dbraw/zinc/18/55/78/1051185578.db2.gz MTBFWHVOVOEVGE-OAHLLOKOSA-N 1 2 305.462 4.026 20 0 DIADLO CCCOc1cccc(C[N@H+](C)[C@@H](CC)C(=O)OC(C)(C)C)c1 ZINC001171670400 1051189840 /nfs/dbraw/zinc/18/98/40/1051189840.db2.gz DZQSXXZRUZTEID-KRWDZBQOSA-N 1 2 321.461 4.028 20 0 DIADLO CCCOc1cccc(C[N@@H+](C)[C@@H](CC)C(=O)OC(C)(C)C)c1 ZINC001171670400 1051189850 /nfs/dbraw/zinc/18/98/50/1051189850.db2.gz DZQSXXZRUZTEID-KRWDZBQOSA-N 1 2 321.461 4.028 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1c(C)cccc1Cl)CCO2 ZINC001170358476 1051190006 /nfs/dbraw/zinc/19/00/06/1051190006.db2.gz XNVVOBDANKWFLJ-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1c(C)cccc1Cl)CCO2 ZINC001170358476 1051190010 /nfs/dbraw/zinc/19/00/10/1051190010.db2.gz XNVVOBDANKWFLJ-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO Cc1ccc(CC[C@H](C)[N@@H+]2Cc3cnc(Cl)cc3C2)cc1 ZINC001171679660 1051190934 /nfs/dbraw/zinc/19/09/34/1051190934.db2.gz BXQCTAUDMBPELO-AWEZNQCLSA-N 1 2 300.833 4.380 20 0 DIADLO Cc1ccc(CC[C@H](C)[N@H+]2Cc3cnc(Cl)cc3C2)cc1 ZINC001171679660 1051190947 /nfs/dbraw/zinc/19/09/47/1051190947.db2.gz BXQCTAUDMBPELO-AWEZNQCLSA-N 1 2 300.833 4.380 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(Cl)n2)CCc2ccc(F)cc21 ZINC001171671394 1051191033 /nfs/dbraw/zinc/19/10/33/1051191033.db2.gz UVAFQZVNDFFUDQ-SNVBAGLBSA-N 1 2 310.825 4.097 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(Cl)n2)CCc2ccc(F)cc21 ZINC001171671394 1051191041 /nfs/dbraw/zinc/19/10/41/1051191041.db2.gz UVAFQZVNDFFUDQ-SNVBAGLBSA-N 1 2 310.825 4.097 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(NC2CC(C)(C)OC(C)(C)C2)c1 ZINC001170361683 1051191391 /nfs/dbraw/zinc/19/13/91/1051191391.db2.gz SIWNJVMCNKMIOO-UHFFFAOYSA-N 1 2 313.445 4.235 20 0 DIADLO Cc1nnc(C[NH2+]C2(c3ccc(C(C)(C)C)cc3)CCCC2)o1 ZINC000181692799 1051197542 /nfs/dbraw/zinc/19/75/42/1051197542.db2.gz URJDXIUGAPRKSV-UHFFFAOYSA-N 1 2 313.445 4.235 20 0 DIADLO CC(C)Oc1c(Nc2[nH+]c3ccccc3n2C)ccc(F)c1F ZINC001215420630 1051198739 /nfs/dbraw/zinc/19/87/39/1051198739.db2.gz DXXNMSJTPDBHGQ-UHFFFAOYSA-N 1 2 317.339 4.382 20 0 DIADLO CC(C)Oc1c(F)c(F)ccc1Nc1ccc2c(c1)[nH+]cn2C ZINC001215426283 1051202101 /nfs/dbraw/zinc/20/21/01/1051202101.db2.gz JRUUJVXIROBJSV-UHFFFAOYSA-N 1 2 317.339 4.382 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@H+](Cc1cc(F)ccc1C)CC3 ZINC001171820643 1051216804 /nfs/dbraw/zinc/21/68/04/1051216804.db2.gz RDZBPRDAVXXODV-UHFFFAOYSA-N 1 2 308.400 4.482 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](Cc1cc(F)ccc1C)CC3 ZINC001171820643 1051216815 /nfs/dbraw/zinc/21/68/15/1051216815.db2.gz RDZBPRDAVXXODV-UHFFFAOYSA-N 1 2 308.400 4.482 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)OCc1cc(C)sc1C)c1ccccc1 ZINC000745097464 1051222789 /nfs/dbraw/zinc/22/27/89/1051222789.db2.gz DAZWBWSVMRIZCN-QGZVFWFLSA-N 1 2 317.454 4.101 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)OCc1cc(C)sc1C)c1ccccc1 ZINC000745097464 1051222801 /nfs/dbraw/zinc/22/28/01/1051222801.db2.gz DAZWBWSVMRIZCN-QGZVFWFLSA-N 1 2 317.454 4.101 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)O[C@@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000745097881 1051222882 /nfs/dbraw/zinc/22/28/82/1051222882.db2.gz MJWREENURNAHOF-KSSFIOAISA-N 1 2 315.388 4.123 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)O[C@@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000745097881 1051222890 /nfs/dbraw/zinc/22/28/90/1051222890.db2.gz MJWREENURNAHOF-KSSFIOAISA-N 1 2 315.388 4.123 20 0 DIADLO Fc1ccc([C@H]2CC[N@@H+]2Cc2cnc(-c3ccccc3)nc2)cc1 ZINC001171846805 1051231388 /nfs/dbraw/zinc/23/13/88/1051231388.db2.gz FJGPSEJOFIDPGF-LJQANCHMSA-N 1 2 319.383 4.230 20 0 DIADLO Fc1ccc([C@H]2CC[N@H+]2Cc2cnc(-c3ccccc3)nc2)cc1 ZINC001171846805 1051231401 /nfs/dbraw/zinc/23/14/01/1051231401.db2.gz FJGPSEJOFIDPGF-LJQANCHMSA-N 1 2 319.383 4.230 20 0 DIADLO COCc1cc(C)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c(C)c1 ZINC001215531120 1051234408 /nfs/dbraw/zinc/23/44/08/1051234408.db2.gz YTJPMXJHCRXWEW-UHFFFAOYSA-N 1 2 321.424 4.438 20 0 DIADLO COCc1cc(C)c(Nc2ccc(N3CCCC3)[nH+]c2)c(C)c1 ZINC001215530521 1051235329 /nfs/dbraw/zinc/23/53/29/1051235329.db2.gz LLQVNVKMHQJAIQ-UHFFFAOYSA-N 1 2 311.429 4.189 20 0 DIADLO CCCOc1ccc(F)c(Nc2ccn3cc[nH+]c3c2)c1F ZINC001215568923 1051248823 /nfs/dbraw/zinc/24/88/23/1051248823.db2.gz OLDCUGFSVNNCCT-UHFFFAOYSA-N 1 2 303.312 4.145 20 0 DIADLO CCN(C)c1ccc(Nc2cc(COC)ccc2Cl)c[nH+]1 ZINC001215597634 1051267282 /nfs/dbraw/zinc/26/72/82/1051267282.db2.gz VRYLREVIPGULRW-UHFFFAOYSA-N 1 2 305.809 4.081 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(Cl)c(CO)c2F)cc1 ZINC001215610453 1051274184 /nfs/dbraw/zinc/27/41/84/1051274184.db2.gz QCYLEDASFFRNQA-UHFFFAOYSA-N 1 2 308.784 4.171 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(Cl)c(CO)c2F)cc1 ZINC001215610453 1051274200 /nfs/dbraw/zinc/27/42/00/1051274200.db2.gz QCYLEDASFFRNQA-UHFFFAOYSA-N 1 2 308.784 4.171 20 0 DIADLO FC1(F)CC[NH+](Cc2csc(-c3ccsc3)n2)CC1 ZINC000793358715 1051285976 /nfs/dbraw/zinc/28/59/76/1051285976.db2.gz GVDIANRHWDGERL-UHFFFAOYSA-N 1 2 300.399 4.103 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)cc1)Cn1ccc(C(F)(F)F)n1 ZINC000746032705 1051307989 /nfs/dbraw/zinc/30/79/89/1051307989.db2.gz HGIWCQOYMHMLOY-UHFFFAOYSA-N 1 2 317.742 4.035 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1)Cn1ccc(C(F)(F)F)n1 ZINC000746032705 1051308000 /nfs/dbraw/zinc/30/80/00/1051308000.db2.gz HGIWCQOYMHMLOY-UHFFFAOYSA-N 1 2 317.742 4.035 20 0 DIADLO C[C@H]([NH2+]Cc1coc(C2CC2)n1)c1ccc(-c2ccncc2)cc1 ZINC000746053010 1051314547 /nfs/dbraw/zinc/31/45/47/1051314547.db2.gz IGYVKYXIIODAGE-AWEZNQCLSA-N 1 2 319.408 4.465 20 0 DIADLO Cc1cc(F)cc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)c1 ZINC001215706458 1051315250 /nfs/dbraw/zinc/31/52/50/1051315250.db2.gz GTZHWPSJSPJJSA-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO COc1cc(C)cc(F)c1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001215707714 1051315612 /nfs/dbraw/zinc/31/56/12/1051315612.db2.gz LHCXGKAHLIDQHW-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](Oc3cccc(F)c3)C2)cs1 ZINC000183387487 1051316954 /nfs/dbraw/zinc/31/69/54/1051316954.db2.gz AIQUUTWIPBTNHU-MRXNPFEDSA-N 1 2 320.433 4.059 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@@H](Oc3cccc(F)c3)C2)cs1 ZINC000183387487 1051316961 /nfs/dbraw/zinc/31/69/61/1051316961.db2.gz AIQUUTWIPBTNHU-MRXNPFEDSA-N 1 2 320.433 4.059 20 0 DIADLO COc1cc(C)cc(F)c1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001215709371 1051317084 /nfs/dbraw/zinc/31/70/84/1051317084.db2.gz QTLYMHSYEWPBOG-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@H+](C)[C@H](C)c2ccco2)cc1 ZINC000746124456 1051326074 /nfs/dbraw/zinc/32/60/74/1051326074.db2.gz LWRCDQBQBJUNIW-LSDHHAIUSA-N 1 2 314.429 4.425 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@@H+](C)[C@H](C)c2ccco2)cc1 ZINC000746124456 1051326085 /nfs/dbraw/zinc/32/60/85/1051326085.db2.gz LWRCDQBQBJUNIW-LSDHHAIUSA-N 1 2 314.429 4.425 20 0 DIADLO Oc1ccc(Cl)c(Nc2ccc(-n3cc[nH+]c3)cc2)c1F ZINC001214559030 1051335876 /nfs/dbraw/zinc/33/58/76/1051335876.db2.gz DISYEBQJKVYLHJ-UHFFFAOYSA-N 1 2 303.724 4.114 20 0 DIADLO CC(C)([NH2+]Cc1cc(Cl)cc(Cl)c1N)c1nccs1 ZINC000638611467 1051343003 /nfs/dbraw/zinc/34/30/03/1051343003.db2.gz ZJRYCHCSXXJXPQ-UHFFFAOYSA-N 1 2 316.257 4.057 20 0 DIADLO O=C(CCc1c[nH]c[nH+]1)Nc1ccccc1SC1CCCC1 ZINC000188594908 1051357374 /nfs/dbraw/zinc/35/73/74/1051357374.db2.gz FABWKRZSXTVNCA-UHFFFAOYSA-N 1 2 315.442 4.016 20 0 DIADLO O=C(CCc1c[nH+]c[nH]1)Nc1ccccc1SC1CCCC1 ZINC000188594908 1051357384 /nfs/dbraw/zinc/35/73/84/1051357384.db2.gz FABWKRZSXTVNCA-UHFFFAOYSA-N 1 2 315.442 4.016 20 0 DIADLO CCCNc1ccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000193358017 1051373051 /nfs/dbraw/zinc/37/30/51/1051373051.db2.gz PEJAQAXGSQXELN-LJQANCHMSA-N 1 2 320.440 4.111 20 0 DIADLO CCOc1cc(Nc2cccn3cc(C)[nH+]c23)ccc1Cl ZINC001212577876 1051386277 /nfs/dbraw/zinc/38/62/77/1051386277.db2.gz AHNBZSQIVMNKDH-UHFFFAOYSA-N 1 2 301.777 4.438 20 0 DIADLO CSc1ncc(Nc2cccc(Cn3cc[nH+]c3)c2)cc1C ZINC001215828631 1051394290 /nfs/dbraw/zinc/39/42/90/1051394290.db2.gz OAVPTBDYFDQITK-UHFFFAOYSA-N 1 2 310.426 4.100 20 0 DIADLO Cc1cn2c(cccc2Nc2ccccc2NC(=O)C(C)(C)C)[nH+]1 ZINC001215829527 1051394445 /nfs/dbraw/zinc/39/44/45/1051394445.db2.gz JMMNCWOQBAGYJQ-UHFFFAOYSA-N 1 2 322.412 4.371 20 0 DIADLO CSc1cc(F)c(Nc2cccn3cc(C)[nH+]c23)c(F)c1 ZINC001215841228 1051406273 /nfs/dbraw/zinc/40/62/73/1051406273.db2.gz PGIAYHAVTDYYKQ-UHFFFAOYSA-N 1 2 305.353 4.386 20 0 DIADLO CC[C@@H](Nc1[nH+]cnc2c1cnn2C(C)(C)C)c1ccccc1 ZINC000766403300 1051415247 /nfs/dbraw/zinc/41/52/47/1051415247.db2.gz LLLPAZAUDIPTFI-OAHLLOKOSA-N 1 2 309.417 4.145 20 0 DIADLO Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]Cc1ccon1 ZINC000766419207 1051418537 /nfs/dbraw/zinc/41/85/37/1051418537.db2.gz DYDCKPRHYIAXRF-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ccccc1COc1ccc([C@H](C)[NH2+]Cc2ccon2)cc1 ZINC000766420527 1051418607 /nfs/dbraw/zinc/41/86/07/1051418607.db2.gz RGVAEIFRFJDIPZ-INIZCTEOSA-N 1 2 322.408 4.413 20 0 DIADLO C[N@H+](Cc1ccc(Cl)nc1)Cc1cc(Cl)nc(Cl)c1 ZINC000746451208 1051419128 /nfs/dbraw/zinc/41/91/28/1051419128.db2.gz OZYWIUVOZDVEMI-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)nc1)Cc1cc(Cl)nc(Cl)c1 ZINC000746451208 1051419141 /nfs/dbraw/zinc/41/91/41/1051419141.db2.gz OZYWIUVOZDVEMI-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO C[N@H+](Cc1cc(-c2ccccc2)no1)Cc1ccc(Cl)nc1 ZINC000746449781 1051421477 /nfs/dbraw/zinc/42/14/77/1051421477.db2.gz BCVABZHNUFGJFU-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccccc2)no1)Cc1ccc(Cl)nc1 ZINC000746449781 1051421482 /nfs/dbraw/zinc/42/14/82/1051421482.db2.gz BCVABZHNUFGJFU-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO OCC[C@@H](Nc1cc[nH+]c2c(Cl)cccc12)c1cccs1 ZINC000804498979 1051431312 /nfs/dbraw/zinc/43/13/12/1051431312.db2.gz WTDKZJKXMZGGBN-CQSZACIVSA-N 1 2 318.829 4.485 20 0 DIADLO C[C@H](C[C@@H](O)c1ccco1)Nc1cc[nH+]c2c(Cl)cccc12 ZINC000804549346 1051444464 /nfs/dbraw/zinc/44/44/64/1051444464.db2.gz AXZZAMLSKKOJIZ-IAQYHMDHSA-N 1 2 316.788 4.405 20 0 DIADLO Cc1[nH+]c(C(C)(C)C)nc(NCc2cc(C(C)C)no2)c1C ZINC001168826781 1051446771 /nfs/dbraw/zinc/44/67/71/1051446771.db2.gz APTSXLDKZUFXIQ-UHFFFAOYSA-N 1 2 302.422 4.114 20 0 DIADLO CSc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)c(C)n1 ZINC001215911513 1051449427 /nfs/dbraw/zinc/44/94/27/1051449427.db2.gz FCMJTKWKZKALLR-UHFFFAOYSA-N 1 2 310.426 4.100 20 0 DIADLO Cc1cccc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)c1C ZINC001215916741 1051454619 /nfs/dbraw/zinc/45/46/19/1051454619.db2.gz OCKLQOPEILHXSF-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Cc1nc(OC(C)C)ccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001215920138 1051456543 /nfs/dbraw/zinc/45/65/43/1051456543.db2.gz LKHNGDFBECMPCD-UHFFFAOYSA-N 1 2 322.412 4.166 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CCC[C@H]2c2ccc(C(C)C)cc2)[nH]1 ZINC001168917918 1051468503 /nfs/dbraw/zinc/46/85/03/1051468503.db2.gz DEXCYHHBWSZQMY-KRWDZBQOSA-N 1 2 312.461 4.389 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CCC[C@H]2c2ccc(C(C)C)cc2)[nH]1 ZINC001168917918 1051468509 /nfs/dbraw/zinc/46/85/09/1051468509.db2.gz DEXCYHHBWSZQMY-KRWDZBQOSA-N 1 2 312.461 4.389 20 0 DIADLO Clc1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)c2c[nH]nc21 ZINC001215940782 1051471443 /nfs/dbraw/zinc/47/14/43/1051471443.db2.gz BTGCWNXJVRLFSO-UHFFFAOYSA-N 1 2 318.167 4.261 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1coc(-c2ccccc2F)n1 ZINC001168948910 1051473751 /nfs/dbraw/zinc/47/37/51/1051473751.db2.gz IPNGJMPPEPBGAO-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1coc(-c2ccccc2F)n1 ZINC001168948910 1051473763 /nfs/dbraw/zinc/47/37/63/1051473763.db2.gz IPNGJMPPEPBGAO-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO Clc1ccc(Nc2ccccc2-n2cc[nH+]c2)c2c[nH]nc21 ZINC001215943182 1051473870 /nfs/dbraw/zinc/47/38/70/1051473870.db2.gz YNENXRCLNDJNEY-UHFFFAOYSA-N 1 2 309.760 4.146 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cnc(F)c(-c2ccccc2)c1 ZINC001215958796 1051483908 /nfs/dbraw/zinc/48/39/08/1051483908.db2.gz KHOOGGYYIFFRAP-UHFFFAOYSA-N 1 2 309.344 4.425 20 0 DIADLO CC1(C)C[NH+](CC(=O)Nc2ccccc2Cl)CC(C)(C)C1 ZINC001169002732 1051484463 /nfs/dbraw/zinc/48/44/63/1051484463.db2.gz CJGJFKWBIYPWLO-UHFFFAOYSA-N 1 2 308.853 4.037 20 0 DIADLO Fc1ccc(NCCc2cn3ccccc3[nH+]2)c2ccccc12 ZINC001169004649 1051484634 /nfs/dbraw/zinc/48/46/34/1051484634.db2.gz JTVXMSTULWBJSD-UHFFFAOYSA-N 1 2 305.356 4.281 20 0 DIADLO c1c(CCNc2cccnc2-c2ccccc2)[nH+]c2ccccn12 ZINC001169003418 1051485040 /nfs/dbraw/zinc/48/50/40/1051485040.db2.gz FWBHVNVPNQRLHD-UHFFFAOYSA-N 1 2 314.392 4.051 20 0 DIADLO c1c(CCNc2ccc(-c3ccccc3)nc2)[nH+]c2ccccn12 ZINC001169004354 1051485187 /nfs/dbraw/zinc/48/51/87/1051485187.db2.gz MOZOYOXPXVNDOD-UHFFFAOYSA-N 1 2 314.392 4.051 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(NCc2cn3cccc(C)c3n2)c1 ZINC001169021651 1051492711 /nfs/dbraw/zinc/49/27/11/1051492711.db2.gz IJXBPXMXPMHBLW-UHFFFAOYSA-N 1 2 322.456 4.409 20 0 DIADLO Cc1ccc(NC(C)(C)CC(C)(C)C)c(C[NH+]2CCOCC2)c1 ZINC001169052378 1051497541 /nfs/dbraw/zinc/49/75/41/1051497541.db2.gz KWIYMYXQWTYPHS-UHFFFAOYSA-N 1 2 318.505 4.454 20 0 DIADLO CC(C)c1nsc(C[NH2+][C@H](C)c2ccc3c(c2)CCCC3)n1 ZINC001169065547 1051505106 /nfs/dbraw/zinc/50/51/06/1051505106.db2.gz TWOSRPXNEHIOIW-CYBMUJFWSA-N 1 2 315.486 4.391 20 0 DIADLO Nc1c(F)c(F)c(F)cc1Nc1cc[nH+]c2ccc(Cl)cc12 ZINC001216006366 1051520659 /nfs/dbraw/zinc/52/06/59/1051520659.db2.gz AQMWCOBRROZFTH-UHFFFAOYSA-N 1 2 323.705 4.053 20 0 DIADLO CSc1ncc(Nc2ccc[nH+]c2N2CCCC2)cc1Cl ZINC001216025875 1051531764 /nfs/dbraw/zinc/53/17/64/1051531764.db2.gz WSSYITXBLFPECT-UHFFFAOYSA-N 1 2 320.849 4.196 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001172846079 1051534060 /nfs/dbraw/zinc/53/40/60/1051534060.db2.gz BLTOBGKCMNGRJH-KMUNFCNLSA-N 1 2 305.771 4.182 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001172846079 1051534071 /nfs/dbraw/zinc/53/40/71/1051534071.db2.gz BLTOBGKCMNGRJH-KMUNFCNLSA-N 1 2 305.771 4.182 20 0 DIADLO Cc1cc(CNC(=O)[C@@H](C)c2ccc(CC(C)C)cc2)cc(C)[nH+]1 ZINC001129859132 1051541720 /nfs/dbraw/zinc/54/17/20/1051541720.db2.gz XLXPGEIMBUQGCZ-KRWDZBQOSA-N 1 2 324.468 4.317 20 0 DIADLO CC(C)Oc1cc(NCc2c(Cl)cncc2Cl)cc[nH+]1 ZINC001169185708 1051542053 /nfs/dbraw/zinc/54/20/53/1051542053.db2.gz MEBACAJEYDQMBU-UHFFFAOYSA-N 1 2 312.200 4.183 20 0 DIADLO CNc1ccccc1NC(=[NH2+])c1ccc(Br)cc1F ZINC001170464106 1051550116 /nfs/dbraw/zinc/55/01/16/1051550116.db2.gz GNNSQEBJABPSND-UHFFFAOYSA-N 1 2 322.181 4.067 20 0 DIADLO CN(C)c1ccc(Nc2[nH+]cccc2N2CCCC2)cc1Cl ZINC001216061235 1051558164 /nfs/dbraw/zinc/55/81/64/1051558164.db2.gz RFXFMEXVDBJPQV-UHFFFAOYSA-N 1 2 316.836 4.145 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@@H+]1CCc2cccc(C)c2C1 ZINC001169234163 1051560184 /nfs/dbraw/zinc/56/01/84/1051560184.db2.gz QXBNEQYNWWYIPS-UHFFFAOYSA-N 1 2 323.415 4.062 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@H+]1CCc2cccc(C)c2C1 ZINC001169234163 1051560198 /nfs/dbraw/zinc/56/01/98/1051560198.db2.gz QXBNEQYNWWYIPS-UHFFFAOYSA-N 1 2 323.415 4.062 20 0 DIADLO Fc1ncc(-c2ccccc2)cc1Nc1ccn2cc[nH+]c2c1 ZINC001216071257 1051561482 /nfs/dbraw/zinc/56/14/82/1051561482.db2.gz DAQFNVFXNKMJIT-UHFFFAOYSA-N 1 2 304.328 4.279 20 0 DIADLO Fc1cc(F)c(C[NH+]2CCC(Oc3ccccc3)CC2)cc1F ZINC000351027049 1051563521 /nfs/dbraw/zinc/56/35/21/1051563521.db2.gz IRKTVUAQOPXZDL-UHFFFAOYSA-N 1 2 321.342 4.147 20 0 DIADLO C[C@@H](CSc1ccc(Cl)cc1)[N@@H+]1Cc2ccncc2C1 ZINC001172883409 1051565923 /nfs/dbraw/zinc/56/59/23/1051565923.db2.gz UJFWHUCFPHNOOI-LBPRGKRZSA-N 1 2 304.846 4.231 20 0 DIADLO C[C@@H](CSc1ccc(Cl)cc1)[N@H+]1Cc2ccncc2C1 ZINC001172883409 1051565935 /nfs/dbraw/zinc/56/59/35/1051565935.db2.gz UJFWHUCFPHNOOI-LBPRGKRZSA-N 1 2 304.846 4.231 20 0 DIADLO Clc1ccc2c(cc3n2CC[N@H+](CCc2ccccc2)C3)c1 ZINC001169271256 1051566640 /nfs/dbraw/zinc/56/66/40/1051566640.db2.gz LOLHMBJILAGXPW-UHFFFAOYSA-N 1 2 310.828 4.353 20 0 DIADLO Clc1ccc2c(cc3n2CC[N@@H+](CCc2ccccc2)C3)c1 ZINC001169271256 1051566654 /nfs/dbraw/zinc/56/66/54/1051566654.db2.gz LOLHMBJILAGXPW-UHFFFAOYSA-N 1 2 310.828 4.353 20 0 DIADLO Clc1cnc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(Cl)c1 ZINC001212693362 1051573452 /nfs/dbraw/zinc/57/34/52/1051573452.db2.gz RLRAEVKWWOSEBJ-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO CC1(C)C[C@@H](CNc2[nH+]ccc3cccc(C(F)(F)F)c32)O1 ZINC001168451427 1051575283 /nfs/dbraw/zinc/57/52/83/1051575283.db2.gz MRGDTDBHZDMBSW-NSHDSACASA-N 1 2 310.319 4.233 20 0 DIADLO Cc1cc(Cl)c(N)c(Nc2[nH+]cccc2N2CCCCC2)c1 ZINC001216092939 1051576711 /nfs/dbraw/zinc/57/67/11/1051576711.db2.gz QLBOTVMGWMKGCH-UHFFFAOYSA-N 1 2 316.836 4.360 20 0 DIADLO COc1cccc([C@@H]2C[N@H+](Cc3cc4ccccc4o3)CCO2)c1 ZINC000178547534 1051577433 /nfs/dbraw/zinc/57/74/33/1051577433.db2.gz HVZCHGMVSZNEIF-FQEVSTJZSA-N 1 2 323.392 4.015 20 0 DIADLO COc1cccc([C@@H]2C[N@@H+](Cc3cc4ccccc4o3)CCO2)c1 ZINC000178547534 1051577443 /nfs/dbraw/zinc/57/74/43/1051577443.db2.gz HVZCHGMVSZNEIF-FQEVSTJZSA-N 1 2 323.392 4.015 20 0 DIADLO FC(F)(F)Oc1ccc(CCNc2cc3cc[nH]c3c[nH+]2)cc1 ZINC001169347184 1051582803 /nfs/dbraw/zinc/58/28/03/1051582803.db2.gz BBWHBVCNOKKREW-UHFFFAOYSA-N 1 2 321.302 4.116 20 0 DIADLO c1cn(Cc2ccc(Nc3cnc4ccsc4c3)cc2)c[nH+]1 ZINC001212695099 1051583365 /nfs/dbraw/zinc/58/33/65/1051583365.db2.gz NGGXOIVXHAPPBR-UHFFFAOYSA-N 1 2 306.394 4.285 20 0 DIADLO COc1cc(Nc2cc[nH+]c3cc(Cl)ccc23)ccc1CO ZINC001216113067 1051584825 /nfs/dbraw/zinc/58/48/25/1051584825.db2.gz XHAFSKUVOJIYMO-UHFFFAOYSA-N 1 2 314.772 4.133 20 0 DIADLO Fc1ccc(Cl)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212696685 1051585455 /nfs/dbraw/zinc/58/54/55/1051585455.db2.gz FFGDTSNVTWZGIX-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO COc1ccc(Cl)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212695799 1051585638 /nfs/dbraw/zinc/58/56/38/1051585638.db2.gz SLDOICGHSWFLML-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO Cc1c(C)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c(C)c(C)c1N ZINC001212699203 1051586102 /nfs/dbraw/zinc/58/61/02/1051586102.db2.gz SXKUCSIKANVRRR-UHFFFAOYSA-N 1 2 320.440 4.491 20 0 DIADLO COc1cc[nH+]cc1N[C@@H]1CCc2c1cccc2OC(F)(F)F ZINC001169360795 1051587159 /nfs/dbraw/zinc/58/71/59/1051587159.db2.gz YMSRGZIOSGAZDH-GFCCVEGCSA-N 1 2 324.302 4.088 20 0 DIADLO Nc1cc(Cl)cc(F)c1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212698844 1051587293 /nfs/dbraw/zinc/58/72/93/1051587293.db2.gz ACKYBINHLQRUIF-UHFFFAOYSA-N 1 2 316.767 4.050 20 0 DIADLO Cc1c(C)n(-c2ccc(Cn3cc[nH+]c3)cc2)c2c1cccc2N ZINC001212700198 1051587552 /nfs/dbraw/zinc/58/75/52/1051587552.db2.gz YPGWEZGJWGIESC-UHFFFAOYSA-N 1 2 316.408 4.074 20 0 DIADLO Fc1cc(Cl)cc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212696855 1051588745 /nfs/dbraw/zinc/58/87/45/1051588745.db2.gz QFUODSGIPVEHGF-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO CCc1ccccc1-c1noc(-c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000761561511 1051598999 /nfs/dbraw/zinc/59/89/99/1051598999.db2.gz AFZCUAJHWNUPGX-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO CCN(C)c1ccc(Nc2cccc(-c3ccncc3)c2)c[nH+]1 ZINC001216144200 1051599044 /nfs/dbraw/zinc/59/90/44/1051599044.db2.gz DDXQHXAFTDVOPU-UHFFFAOYSA-N 1 2 304.397 4.343 20 0 DIADLO CC(=O)Nc1ccc(Nc2c(C)cc[nH+]c2C(C)C)cc1F ZINC001212703629 1051599655 /nfs/dbraw/zinc/59/96/55/1051599655.db2.gz JRBXTJRGQPWKSB-UHFFFAOYSA-N 1 2 301.365 4.355 20 0 DIADLO CCC(C)(C)c1ccccc1C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001130044848 1051601073 /nfs/dbraw/zinc/60/10/73/1051601073.db2.gz GYJKTOHRPSXJJE-UHFFFAOYSA-N 1 2 310.441 4.316 20 0 DIADLO Cc1ccccc1C(N)=[NH+]OCc1nc(-c2ccccc2)cs1 ZINC000766685407 1051604498 /nfs/dbraw/zinc/60/44/98/1051604498.db2.gz KEJTWZGDCITIKE-UHFFFAOYSA-N 1 2 323.421 4.165 20 0 DIADLO C[C@@H](c1ccc(Oc2ccccc2)cc1)[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC001169409769 1051604672 /nfs/dbraw/zinc/60/46/72/1051604672.db2.gz QGWHQQVVPRIQGR-HOTGVXAUSA-N 1 2 309.409 4.451 20 0 DIADLO C[C@@H](c1ccc(Oc2ccccc2)cc1)[N@H+]1CCC(=O)[C@@H](C)C1 ZINC001169409769 1051604679 /nfs/dbraw/zinc/60/46/79/1051604679.db2.gz QGWHQQVVPRIQGR-HOTGVXAUSA-N 1 2 309.409 4.451 20 0 DIADLO Cc1cc(N[C@@H](CCO)c2cccc3ccccc32)c[nH+]c1C ZINC001169425821 1051609426 /nfs/dbraw/zinc/60/94/26/1051609426.db2.gz REEJXLAAPQXMPY-FQEVSTJZSA-N 1 2 306.409 4.387 20 0 DIADLO COc1cc(CO)cc(Nc2cc[nH+]c3cc(Cl)ccc23)c1 ZINC001216199330 1051626523 /nfs/dbraw/zinc/62/65/23/1051626523.db2.gz NIVHVKRNHUADCN-UHFFFAOYSA-N 1 2 314.772 4.133 20 0 DIADLO O=C(/C=C\c1[nH]cc[nH+]1)Nc1ccccc1SC1CCCC1 ZINC000493492223 1051629656 /nfs/dbraw/zinc/62/96/56/1051629656.db2.gz KNIZOZGOSXAKCA-KTKRTIGZSA-N 1 2 313.426 4.096 20 0 DIADLO C[C@@H](CNc1cc(-c2ccncc2)cc[nH+]1)c1ccc(O)cc1 ZINC001169532085 1051634348 /nfs/dbraw/zinc/63/43/48/1051634348.db2.gz GLZCSRSBGIKVJM-AWEZNQCLSA-N 1 2 305.381 4.065 20 0 DIADLO CSc1ncc(C)cc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001216238875 1051645583 /nfs/dbraw/zinc/64/55/83/1051645583.db2.gz ASZUHXWFECCDEM-UHFFFAOYSA-N 1 2 314.458 4.241 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(NCCc2coc3ccccc23)c1 ZINC001169598288 1051651727 /nfs/dbraw/zinc/65/17/27/1051651727.db2.gz LUAKYZZFCMUJFI-UHFFFAOYSA-N 1 2 317.392 4.488 20 0 DIADLO CCCC[C@@H](CC(C)C)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001173254513 1051657018 /nfs/dbraw/zinc/65/70/18/1051657018.db2.gz GSBKBRUFHXSGQE-ZDUSSCGKSA-N 1 2 317.399 4.322 20 0 DIADLO CCCC[C@@H](CC(C)C)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001173254513 1051657023 /nfs/dbraw/zinc/65/70/23/1051657023.db2.gz GSBKBRUFHXSGQE-ZDUSSCGKSA-N 1 2 317.399 4.322 20 0 DIADLO COc1cc(Nc2[nH+]cccc2N2CCCC2)ccc1C1CC1 ZINC001216251049 1051657361 /nfs/dbraw/zinc/65/73/61/1051657361.db2.gz AFYSWKIZEOBBCG-UHFFFAOYSA-N 1 2 309.413 4.311 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(N[C@H]2CCc3ccccc3[C@H]2O)c1 ZINC001169629205 1051660136 /nfs/dbraw/zinc/66/01/36/1051660136.db2.gz RKAKGJODQYCLIC-PZJWPPBQSA-N 1 2 324.468 4.302 20 0 DIADLO CCCC[C@H](CC(C)C)[N@@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001173259709 1051660997 /nfs/dbraw/zinc/66/09/97/1051660997.db2.gz JSJWPMLLXPWLGS-IAGOWNOFSA-N 1 2 321.509 4.401 20 0 DIADLO CCCC[C@H](CC(C)C)[N@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001173259709 1051661003 /nfs/dbraw/zinc/66/10/03/1051661003.db2.gz JSJWPMLLXPWLGS-IAGOWNOFSA-N 1 2 321.509 4.401 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1cnc(Br)s1 ZINC001216266881 1051664356 /nfs/dbraw/zinc/66/43/56/1051664356.db2.gz VGQJUZPEIPNJAF-UHFFFAOYSA-N 1 2 312.236 4.476 20 0 DIADLO Cn1c2ccccc2[nH+]c1Nc1c(Cl)cc(CO)cc1Cl ZINC001216360942 1051720737 /nfs/dbraw/zinc/72/07/37/1051720737.db2.gz BTUFUSPJCMHCHZ-UHFFFAOYSA-N 1 2 322.195 4.116 20 0 DIADLO Fc1cccc([C@@H]2C[N@H+](Cc3ccc(C(F)F)cc3)CCO2)c1 ZINC000183935064 1051723253 /nfs/dbraw/zinc/72/32/53/1051723253.db2.gz ORFSDJNUPNHAGW-KRWDZBQOSA-N 1 2 321.342 4.337 20 0 DIADLO Fc1cccc([C@@H]2C[N@@H+](Cc3ccc(C(F)F)cc3)CCO2)c1 ZINC000183935064 1051723263 /nfs/dbraw/zinc/72/32/63/1051723263.db2.gz ORFSDJNUPNHAGW-KRWDZBQOSA-N 1 2 321.342 4.337 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(C(F)F)cc1)c1nc(C(C)(C)C)no1 ZINC000184001356 1051725707 /nfs/dbraw/zinc/72/57/07/1051725707.db2.gz YXICQJCWHCOHRJ-JTQLQIEISA-N 1 2 309.360 4.156 20 0 DIADLO COc1cc(C)c(C)cc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001216375492 1051731473 /nfs/dbraw/zinc/73/14/73/1051731473.db2.gz MXMBGMKMFMWMCW-UHFFFAOYSA-N 1 2 307.397 4.300 20 0 DIADLO Cc1oc2ccccc2c1C[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000185046652 1051752725 /nfs/dbraw/zinc/75/27/25/1051752725.db2.gz RXOYALVZTUTLPX-NSHDSACASA-N 1 2 313.401 4.273 20 0 DIADLO COc1cc(Nc2cc[nH+]c3cc(Cl)ccc23)cnc1F ZINC001216420397 1051756480 /nfs/dbraw/zinc/75/64/80/1051756480.db2.gz UHIYMQVTUKGYEG-UHFFFAOYSA-N 1 2 303.724 4.175 20 0 DIADLO Cc1cc([NH2+][C@@H]2CC[C@@H]2C2CC2)ccc1N1CCSCC1 ZINC000806156699 1051759354 /nfs/dbraw/zinc/75/93/54/1051759354.db2.gz ILTBCUKDQUEXTR-IAGOWNOFSA-N 1 2 302.487 4.149 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@H]3CCc4nc(Cl)ccc43)ccc21 ZINC000806157119 1051759475 /nfs/dbraw/zinc/75/94/75/1051759475.db2.gz OQZUVDDAPOZHFL-HNNXBMFYSA-N 1 2 313.832 4.217 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@H]3CCc4nc(Cl)ccc43)ccc21 ZINC000806157119 1051759489 /nfs/dbraw/zinc/75/94/89/1051759489.db2.gz OQZUVDDAPOZHFL-HNNXBMFYSA-N 1 2 313.832 4.217 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+][C@H]2CC[C@H]2C(C)(C)C)cc1 ZINC000806156464 1051759513 /nfs/dbraw/zinc/75/95/13/1051759513.db2.gz DDUSKZIKUCASRW-OLMNPRSZSA-N 1 2 302.462 4.148 20 0 DIADLO Fc1cccc(F)c1[C@H]1CC[N@H+](Cc2csc(C3CC3)n2)C1 ZINC000185306213 1051761552 /nfs/dbraw/zinc/76/15/52/1051761552.db2.gz MSDXEQFKDKOKOJ-LBPRGKRZSA-N 1 2 320.408 4.288 20 0 DIADLO Fc1cccc(F)c1[C@H]1CC[N@@H+](Cc2csc(C3CC3)n2)C1 ZINC000185306213 1051761573 /nfs/dbraw/zinc/76/15/73/1051761573.db2.gz MSDXEQFKDKOKOJ-LBPRGKRZSA-N 1 2 320.408 4.288 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(O)cc(F)c1)c1nc(C(C)(C)C)cs1 ZINC000185524386 1051771605 /nfs/dbraw/zinc/77/16/05/1051771605.db2.gz ZAOGELVWJRMIPC-SNVBAGLBSA-N 1 2 308.422 4.136 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1csc([C@@H](C)OC)n1 ZINC000185786397 1051783680 /nfs/dbraw/zinc/78/36/80/1051783680.db2.gz YCSSLADYUOKMBW-CXAGYDPISA-N 1 2 316.470 4.187 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1csc([C@@H](C)OC)n1 ZINC000185786397 1051783692 /nfs/dbraw/zinc/78/36/92/1051783692.db2.gz YCSSLADYUOKMBW-CXAGYDPISA-N 1 2 316.470 4.187 20 0 DIADLO OCCc1ccc[nH+]c1Nc1ccc(Oc2ccccc2)cc1 ZINC001173811947 1051790348 /nfs/dbraw/zinc/79/03/48/1051790348.db2.gz UEIWSAJLNYEWNK-UHFFFAOYSA-N 1 2 306.365 4.152 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cc(F)cc(C(C)(C)O)c2)cc1 ZINC001216496473 1051791699 /nfs/dbraw/zinc/79/16/99/1051791699.db2.gz QYILAFKQRURUSH-UHFFFAOYSA-N 1 2 302.393 4.253 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cc(F)cc(C(C)(C)O)c2)cc1 ZINC001216496473 1051791708 /nfs/dbraw/zinc/79/17/08/1051791708.db2.gz QYILAFKQRURUSH-UHFFFAOYSA-N 1 2 302.393 4.253 20 0 DIADLO Brc1ccc2[nH+]ccc(Nc3ccsc3)c2c1 ZINC001173818637 1051797329 /nfs/dbraw/zinc/79/73/29/1051797329.db2.gz KUUWMVBOZPMCIM-UHFFFAOYSA-N 1 2 305.200 4.224 20 0 DIADLO COc1ccsc1[C@@H](C)Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000186245245 1051802198 /nfs/dbraw/zinc/80/21/98/1051802198.db2.gz IGFKYDSBFIHTDO-CYBMUJFWSA-N 1 2 317.458 4.315 20 0 DIADLO Nc1c(Cl)cccc1Nc1cc[nH+]c2ccc(Cl)cc12 ZINC001216525030 1051805558 /nfs/dbraw/zinc/80/55/58/1051805558.db2.gz NANXPFJYRBULBL-UHFFFAOYSA-N 1 2 304.180 4.289 20 0 DIADLO Nc1c(Cl)cccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001216525428 1051805735 /nfs/dbraw/zinc/80/57/35/1051805735.db2.gz RAXKXEZQEGNNEQ-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO Cc1ccc(Nc2cc(Br)c3[nH+]ccn3c2)cc1 ZINC001173802323 1051809106 /nfs/dbraw/zinc/80/91/06/1051809106.db2.gz KSQIJLDYXOZWPK-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO Cc1cccc(Nc2cc(Br)c3[nH+]ccn3c2)c1 ZINC001173807944 1051814723 /nfs/dbraw/zinc/81/47/23/1051814723.db2.gz BEFUEJQNJWREPG-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO CC(C)n1ccnc1C[NH2+]C(C)(C)c1cccc(Cl)c1F ZINC000186883951 1051831472 /nfs/dbraw/zinc/83/14/72/1051831472.db2.gz KWQJZFMFETZDGN-UHFFFAOYSA-N 1 2 309.816 4.281 20 0 DIADLO Fc1ccc(Nc2ccc3[nH+]cc(Br)n3c2)cc1F ZINC001173867543 1051839150 /nfs/dbraw/zinc/83/91/50/1051839150.db2.gz GOZWVQMETHLSTR-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO CCCCC[C@@H]1CCC[N@@H+]1Cn1nc(OCC)sc1=S ZINC000767766070 1051847547 /nfs/dbraw/zinc/84/75/47/1051847547.db2.gz VRQCWROLWXKHGD-GFCCVEGCSA-N 1 2 315.508 4.075 20 0 DIADLO CCCCC[C@@H]1CCC[N@H+]1Cn1nc(OCC)sc1=S ZINC000767766070 1051847555 /nfs/dbraw/zinc/84/75/55/1051847555.db2.gz VRQCWROLWXKHGD-GFCCVEGCSA-N 1 2 315.508 4.075 20 0 DIADLO CCCCC[C@H]1CCC[N@@H+]1Cn1ncn(C(C)(C)C)c1=S ZINC000767763246 1051848256 /nfs/dbraw/zinc/84/82/56/1051848256.db2.gz SGXHKSIGXXHHMR-AWEZNQCLSA-N 1 2 310.511 4.171 20 0 DIADLO CCCCC[C@H]1CCC[N@H+]1Cn1ncn(C(C)(C)C)c1=S ZINC000767763246 1051848267 /nfs/dbraw/zinc/84/82/67/1051848267.db2.gz SGXHKSIGXXHHMR-AWEZNQCLSA-N 1 2 310.511 4.171 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1F)c1ccc(C)o1 ZINC000187487224 1051848930 /nfs/dbraw/zinc/84/89/30/1051848930.db2.gz QTHSYYWDHKFRTG-SMDDNHRTSA-N 1 2 311.784 4.419 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1F)c1ccc(C)o1 ZINC000187487259 1051849373 /nfs/dbraw/zinc/84/93/73/1051849373.db2.gz QTHSYYWDHKFRTG-BXUZGUMPSA-N 1 2 311.784 4.419 20 0 DIADLO CSc1ccc(CSCc2cc[nH+]c(N(C)C)c2)cc1 ZINC000767869747 1051861367 /nfs/dbraw/zinc/86/13/67/1051861367.db2.gz OWPQJASECXNUFL-UHFFFAOYSA-N 1 2 304.484 4.303 20 0 DIADLO COc1cc(Nc2c(C)cc[nH+]c2C(C)C)cc(OC)c1OC ZINC001173905573 1051869206 /nfs/dbraw/zinc/86/92/06/1051869206.db2.gz UAVFQNCYUBOYPJ-UHFFFAOYSA-N 1 2 316.401 4.283 20 0 DIADLO COc1cc(OC)c(Nc2ccc3c(C)cc[nH+]c3c2)c(OC)c1 ZINC001173910685 1051870333 /nfs/dbraw/zinc/87/03/33/1051870333.db2.gz ISQSSJMPLHBCAO-UHFFFAOYSA-N 1 2 324.380 4.313 20 0 DIADLO COc1cc(OC)c(Nc2c(C)cc[nH+]c2C(C)C)c(OC)c1 ZINC001173909972 1051870985 /nfs/dbraw/zinc/87/09/85/1051870985.db2.gz RLLWSJIYUYZYBG-UHFFFAOYSA-N 1 2 316.401 4.283 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2ccc(F)cc2F)cc[nH+]1 ZINC001173925510 1051882772 /nfs/dbraw/zinc/88/27/72/1051882772.db2.gz VRQWBXMKCNCCDV-UHFFFAOYSA-N 1 2 321.327 4.450 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2F)C2CC2)cnc1Cl ZINC000768204453 1051894356 /nfs/dbraw/zinc/89/43/56/1051894356.db2.gz ZPTXIXOCHJZXOS-UHFFFAOYSA-N 1 2 304.796 4.347 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2F)C2CC2)cnc1Cl ZINC000768204453 1051894361 /nfs/dbraw/zinc/89/43/61/1051894361.db2.gz ZPTXIXOCHJZXOS-UHFFFAOYSA-N 1 2 304.796 4.347 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCNc2[nH+]cc(C)cc21 ZINC001169989103 1051895501 /nfs/dbraw/zinc/89/55/01/1051895501.db2.gz AYSIFZCVKYOVND-AWEZNQCLSA-N 1 2 303.450 4.145 20 0 DIADLO COC(=O)c1cccc(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001173963428 1051895470 /nfs/dbraw/zinc/89/54/70/1051895470.db2.gz MTNXHJCHDIXOOC-UHFFFAOYSA-N 1 2 310.397 4.207 20 0 DIADLO Cc1ccc(C2=CC[N@H+](Cc3cn4cccc(F)c4n3)CC2)cc1 ZINC000768213925 1051904045 /nfs/dbraw/zinc/90/40/45/1051904045.db2.gz BEFFXJLDTAOFOJ-UHFFFAOYSA-N 1 2 321.399 4.071 20 0 DIADLO Cc1ccc(C2=CC[N@@H+](Cc3cn4cccc(F)c4n3)CC2)cc1 ZINC000768213925 1051904055 /nfs/dbraw/zinc/90/40/55/1051904055.db2.gz BEFFXJLDTAOFOJ-UHFFFAOYSA-N 1 2 321.399 4.071 20 0 DIADLO Brc1ccoc1C[N@H+](Cc1ccccc1)C1CC1 ZINC000768227609 1051905935 /nfs/dbraw/zinc/90/59/35/1051905935.db2.gz CSUWQNTZGZBWNU-UHFFFAOYSA-N 1 2 306.203 4.207 20 0 DIADLO Brc1ccoc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000768227609 1051905941 /nfs/dbraw/zinc/90/59/41/1051905941.db2.gz CSUWQNTZGZBWNU-UHFFFAOYSA-N 1 2 306.203 4.207 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2occc2Br)cc1 ZINC000768236767 1051907825 /nfs/dbraw/zinc/90/78/25/1051907825.db2.gz KZVULMHMPJMTIZ-LLVKDONJSA-N 1 2 324.218 4.244 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2occc2Br)cc1 ZINC000768236767 1051907834 /nfs/dbraw/zinc/90/78/34/1051907834.db2.gz KZVULMHMPJMTIZ-LLVKDONJSA-N 1 2 324.218 4.244 20 0 DIADLO Fc1cccc(Nc2cc(Br)cn3cc[nH+]c23)c1F ZINC001173945371 1051912162 /nfs/dbraw/zinc/91/21/62/1051912162.db2.gz RIQJJPQLXWDYMC-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Cc1nn(Cc2ccccc2Cl)c(Cl)c1C[N@@H+](C)C1CC1 ZINC000768335253 1051918973 /nfs/dbraw/zinc/91/89/73/1051918973.db2.gz KQQSPWNYOCUNJU-UHFFFAOYSA-N 1 2 324.255 4.141 20 0 DIADLO Cc1nn(Cc2ccccc2Cl)c(Cl)c1C[N@H+](C)C1CC1 ZINC000768335253 1051918980 /nfs/dbraw/zinc/91/89/80/1051918980.db2.gz KQQSPWNYOCUNJU-UHFFFAOYSA-N 1 2 324.255 4.141 20 0 DIADLO Cc1cccc(-c2noc(-c3ccc(-c4c[nH+]cn4C)cc3)n2)c1 ZINC001217010832 1051929203 /nfs/dbraw/zinc/92/92/03/1051929203.db2.gz UGHWVIFYUKDWMQ-UHFFFAOYSA-N 1 2 316.364 4.113 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc3cc(F)ccc3o2)no1 ZINC000768428198 1051929444 /nfs/dbraw/zinc/92/94/44/1051929444.db2.gz FAIGVSHPVOSGCL-MRXNPFEDSA-N 1 2 300.333 4.205 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cc3cc(F)ccc3o2)no1 ZINC000768428198 1051929452 /nfs/dbraw/zinc/92/94/52/1051929452.db2.gz FAIGVSHPVOSGCL-MRXNPFEDSA-N 1 2 300.333 4.205 20 0 DIADLO C=Cc1ccccc1-c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001217034038 1051934870 /nfs/dbraw/zinc/93/48/70/1051934870.db2.gz MLCZHDHLYNDIGH-UHFFFAOYSA-N 1 2 314.348 4.232 20 0 DIADLO COc1cccc(Nc2cc[nH+]c3ccc(Cl)cc23)c1OC ZINC001174014464 1051935589 /nfs/dbraw/zinc/93/55/89/1051935589.db2.gz RJRGJGZQCLMIFS-UHFFFAOYSA-N 1 2 314.772 4.071 20 0 DIADLO Cc1cc([NH2+]C2CC(C(F)F)C2)ccc1N1CCSCC1 ZINC000768671963 1051952969 /nfs/dbraw/zinc/95/29/69/1051952969.db2.gz RZFIUTLZNNTKMV-UHFFFAOYSA-N 1 2 312.429 4.004 20 0 DIADLO CC(C)c1cn(C[N@@H+]2CC[C@@H]2c2ccccc2)c(=S)n1C ZINC000747451533 1051973277 /nfs/dbraw/zinc/97/32/77/1051973277.db2.gz GHWDPXMBHYVXHT-OAHLLOKOSA-N 1 2 301.459 4.084 20 0 DIADLO CC(C)c1cn(C[N@H+]2CC[C@@H]2c2ccccc2)c(=S)n1C ZINC000747451533 1051973284 /nfs/dbraw/zinc/97/32/84/1051973284.db2.gz GHWDPXMBHYVXHT-OAHLLOKOSA-N 1 2 301.459 4.084 20 0 DIADLO c1cn(Cc2cccc(Nc3cncc4ccccc43)c2)c[nH+]1 ZINC001174101035 1051975122 /nfs/dbraw/zinc/97/51/22/1051975122.db2.gz MNDJAYXNWLONEU-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO FC(F)(F)c1ccccc1C[NH2+]Cc1ncc(Cl)s1 ZINC000225333147 1052010955 /nfs/dbraw/zinc/01/09/55/1052010955.db2.gz ZJQYUQIFAIQQTM-UHFFFAOYSA-N 1 2 306.740 4.105 20 0 DIADLO C[N@H+](Cc1ccn(-c2ccccc2)n1)Cc1coc2ccccc12 ZINC000768917887 1051981788 /nfs/dbraw/zinc/98/17/88/1051981788.db2.gz BHTIICCDWOFLNP-UHFFFAOYSA-N 1 2 317.392 4.251 20 0 DIADLO C[N@@H+](Cc1ccn(-c2ccccc2)n1)Cc1coc2ccccc12 ZINC000768917887 1051981801 /nfs/dbraw/zinc/98/18/01/1051981801.db2.gz BHTIICCDWOFLNP-UHFFFAOYSA-N 1 2 317.392 4.251 20 0 DIADLO Cc1nn(C[NH+]2CCC(C)(CC(C)C)CC2)c(=S)n1C1CC1 ZINC000808232238 1051990022 /nfs/dbraw/zinc/99/00/22/1051990022.db2.gz XCZWQEPYGZUGOV-UHFFFAOYSA-N 1 2 322.522 4.163 20 0 DIADLO COc1ccc(Cl)c(C[NH2+]C(C)(C)c2nc(C)c(C)s2)c1 ZINC000192112576 1051996225 /nfs/dbraw/zinc/99/62/25/1051996225.db2.gz HMMODYUPSGMUHG-UHFFFAOYSA-N 1 2 324.877 4.447 20 0 DIADLO Cc1ccc(NC(=O)COc2cc(C)[nH+]c3ccccc32)c(C)c1 ZINC000192192990 1052005768 /nfs/dbraw/zinc/00/57/68/1052005768.db2.gz OUAYLDLXBHBFJI-UHFFFAOYSA-N 1 2 320.392 4.178 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC[C@H](c3c(F)cccc3F)C2)o1 ZINC000769228782 1052010832 /nfs/dbraw/zinc/01/08/32/1052010832.db2.gz RGZDANBFUMQEQK-LBPRGKRZSA-N 1 2 306.356 4.066 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)o1 ZINC000769228782 1052010841 /nfs/dbraw/zinc/01/08/41/1052010841.db2.gz RGZDANBFUMQEQK-LBPRGKRZSA-N 1 2 306.356 4.066 20 0 DIADLO COc1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)cc1Cl ZINC001174151808 1052021049 /nfs/dbraw/zinc/02/10/49/1052021049.db2.gz KSFOITMUTSVXHY-UHFFFAOYSA-N 1 2 317.820 4.478 20 0 DIADLO Cc1cc[nH+]c(Nc2ccc(C(=O)Nc3ccccc3)cc2)c1 ZINC001174160613 1052025959 /nfs/dbraw/zinc/02/59/59/1052025959.db2.gz YEQJHGFVFSOUMK-UHFFFAOYSA-N 1 2 303.365 4.386 20 0 DIADLO Clc1ccsc1C[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000193075490 1052027107 /nfs/dbraw/zinc/02/71/07/1052027107.db2.gz XOQWXHPECWVESO-UHFFFAOYSA-N 1 2 304.802 4.346 20 0 DIADLO CCCc1cc[nH+]c(Nc2cccc(C(=O)N(CC)CC)c2)c1 ZINC001174165241 1052027443 /nfs/dbraw/zinc/02/74/43/1052027443.db2.gz MJCIOCWQTMGSRL-UHFFFAOYSA-N 1 2 311.429 4.260 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc2ccccc2[nH]1 ZINC000193191339 1052033555 /nfs/dbraw/zinc/03/35/55/1052033555.db2.gz LBNFQYTVRXMPSN-LLVKDONJSA-N 1 2 301.340 4.034 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc2ccccc2[nH]1 ZINC000193191339 1052033565 /nfs/dbraw/zinc/03/35/65/1052033565.db2.gz LBNFQYTVRXMPSN-LLVKDONJSA-N 1 2 301.340 4.034 20 0 DIADLO CCCCOc1ccc(C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000193181885 1052033976 /nfs/dbraw/zinc/03/39/76/1052033976.db2.gz HHRRAAZJDLLAHU-UHFFFAOYSA-N 1 2 312.413 4.438 20 0 DIADLO CCCc1cc[nH+]c(Nc2cccc(C(=O)N3CCCCC3)c2)c1 ZINC001174176906 1052034745 /nfs/dbraw/zinc/03/47/45/1052034745.db2.gz NQQGQCUPLHRDAV-UHFFFAOYSA-N 1 2 323.440 4.404 20 0 DIADLO COc1ncccc1C[N@H+](C)[C@@H](C)c1sc(C(C)C)nc1C ZINC000193450805 1052044568 /nfs/dbraw/zinc/04/45/68/1052044568.db2.gz VMVUYXUALBBJTK-ZDUSSCGKSA-N 1 2 319.474 4.172 20 0 DIADLO COc1ncccc1C[N@@H+](C)[C@@H](C)c1sc(C(C)C)nc1C ZINC000193450805 1052044585 /nfs/dbraw/zinc/04/45/85/1052044585.db2.gz VMVUYXUALBBJTK-ZDUSSCGKSA-N 1 2 319.474 4.172 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)cn1 ZINC000769427046 1052045262 /nfs/dbraw/zinc/04/52/62/1052045262.db2.gz FPSCDXKALLFGAS-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)cn1 ZINC000769427046 1052045268 /nfs/dbraw/zinc/04/52/68/1052045268.db2.gz FPSCDXKALLFGAS-QGZVFWFLSA-N 1 2 305.372 4.079 20 0 DIADLO Cc1ccc[nH+]c1Nc1cccc(C(=O)N2CCC(C)CC2)c1 ZINC001174202229 1052047006 /nfs/dbraw/zinc/04/70/06/1052047006.db2.gz BABAAVHIESSFGV-UHFFFAOYSA-N 1 2 309.413 4.006 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2coc(C3CC3)n2)[C@H]1c1ccccc1 ZINC000769463526 1052060133 /nfs/dbraw/zinc/06/01/33/1052060133.db2.gz PPNFLSWFRXIJLP-SUMWQHHRSA-N 1 2 314.454 4.231 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2coc(C3CC3)n2)[C@H]1c1ccccc1 ZINC000769463526 1052060145 /nfs/dbraw/zinc/06/01/45/1052060145.db2.gz PPNFLSWFRXIJLP-SUMWQHHRSA-N 1 2 314.454 4.231 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2coc(C3CC3)n2)[C@@H]1c1ccccc1 ZINC000769463522 1052061117 /nfs/dbraw/zinc/06/11/17/1052061117.db2.gz PPNFLSWFRXIJLP-DYVFJYSZSA-N 1 2 314.454 4.231 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2coc(C3CC3)n2)[C@@H]1c1ccccc1 ZINC000769463522 1052061132 /nfs/dbraw/zinc/06/11/32/1052061132.db2.gz PPNFLSWFRXIJLP-DYVFJYSZSA-N 1 2 314.454 4.231 20 0 DIADLO Cc1nn(C)c(C)c1Nc1ccc(Oc2cc[nH+]c(C)c2)cc1 ZINC001174229005 1052064753 /nfs/dbraw/zinc/06/47/53/1052064753.db2.gz OWYXUIOGUQZTRS-UHFFFAOYSA-N 1 2 308.385 4.276 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(Cl)nc3ccccn32)[C@H]1c1ccccc1 ZINC000769540391 1052065026 /nfs/dbraw/zinc/06/50/26/1052065026.db2.gz OEPGEKCPWCVWEQ-SUMWQHHRSA-N 1 2 311.816 4.181 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c(Cl)nc3ccccn32)[C@H]1c1ccccc1 ZINC000769540391 1052065035 /nfs/dbraw/zinc/06/50/35/1052065035.db2.gz OEPGEKCPWCVWEQ-SUMWQHHRSA-N 1 2 311.816 4.181 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccccc1)[C@H](O)c1ccccc1)c1cscn1 ZINC000808722924 1052082099 /nfs/dbraw/zinc/08/20/99/1052082099.db2.gz HLXVHUVKZKIMTC-ZOCIIQOWSA-N 1 2 324.449 4.269 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cc(C(F)(F)F)nn3C)ccc12 ZINC001174327543 1052101766 /nfs/dbraw/zinc/10/17/66/1052101766.db2.gz SKIHJBBIADAFGN-UHFFFAOYSA-N 1 2 306.291 4.039 20 0 DIADLO Cc1nn(C)cc1Nc1cc[nH+]c2cc(C(F)(F)F)ccc12 ZINC001174333228 1052102965 /nfs/dbraw/zinc/10/29/65/1052102965.db2.gz IFXHBEHAAAKXFZ-UHFFFAOYSA-N 1 2 306.291 4.039 20 0 DIADLO Cn1ncc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc21 ZINC001174340744 1052106656 /nfs/dbraw/zinc/10/66/56/1052106656.db2.gz GQICOZVJBJRTQM-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1cnc(-c3ccco3)s1)CC2 ZINC000194396911 1052109963 /nfs/dbraw/zinc/10/99/63/1052109963.db2.gz YPIMFRLOMBNRCS-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1cnc(-c3ccco3)s1)CC2 ZINC000194396911 1052109968 /nfs/dbraw/zinc/10/99/68/1052109968.db2.gz YPIMFRLOMBNRCS-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(C(F)(F)F)cc1F ZINC001174400986 1052123259 /nfs/dbraw/zinc/12/32/59/1052123259.db2.gz PFNUAFFKFREZOP-UHFFFAOYSA-N 1 2 309.266 4.074 20 0 DIADLO FC(F)(F)c1cc(Nc2cccc(-n3cc[nH+]c3)c2)ccn1 ZINC001174361308 1052127499 /nfs/dbraw/zinc/12/74/99/1052127499.db2.gz HIRDRMAHIBVALR-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1nc2cc(Cl)ccc2s1 ZINC000754157242 1052133609 /nfs/dbraw/zinc/13/36/09/1052133609.db2.gz UARXBSIGOHRXQL-QMMMGPOBSA-N 1 2 321.833 4.405 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ncnc4sccc43)ccc21 ZINC001174381014 1052138828 /nfs/dbraw/zinc/13/88/28/1052138828.db2.gz PSYJXYMZAWOATL-UHFFFAOYSA-N 1 2 309.398 4.366 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cnc(C(F)(F)F)cn3)ccc21 ZINC001174381260 1052138941 /nfs/dbraw/zinc/13/89/41/1052138941.db2.gz CORKBTNWPXPELD-UHFFFAOYSA-N 1 2 321.306 4.170 20 0 DIADLO Cc1nc(Cl)cc(Nc2ccc3c(c2)[nH+]cn3C(C)C)n1 ZINC001174381098 1052139056 /nfs/dbraw/zinc/13/90/56/1052139056.db2.gz UOVYDWVZRSPJPG-UHFFFAOYSA-N 1 2 301.781 4.113 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(F)c(O)c(F)c3)ccc21 ZINC001174381944 1052140174 /nfs/dbraw/zinc/14/01/74/1052140174.db2.gz XOMABHPTJQKAEE-UHFFFAOYSA-N 1 2 303.312 4.345 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3c(F)c(F)nc(F)c3F)ccc21 ZINC001174381364 1052140376 /nfs/dbraw/zinc/14/03/76/1052140376.db2.gz XVGJXQUHFBLOEI-UHFFFAOYSA-N 1 2 324.281 4.312 20 0 DIADLO COC(=O)c1cc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cs1 ZINC001174382132 1052140892 /nfs/dbraw/zinc/14/08/92/1052140892.db2.gz ZWTFKKYOWBQEOE-UHFFFAOYSA-N 1 2 315.398 4.209 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3nnccc3C(F)(F)F)ccc21 ZINC001174381869 1052140950 /nfs/dbraw/zinc/14/09/50/1052140950.db2.gz VHPMEXUHXYNXMY-UHFFFAOYSA-N 1 2 321.306 4.170 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cn(CC(F)(F)F)cn3)ccc21 ZINC001174382255 1052141516 /nfs/dbraw/zinc/14/15/16/1052141516.db2.gz GXHJOELBOYBAAB-UHFFFAOYSA-N 1 2 323.322 4.120 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(c3)CCC4=O)ccc21 ZINC001174382652 1052143212 /nfs/dbraw/zinc/14/32/12/1052143212.db2.gz APMDZJWAXVABIB-UHFFFAOYSA-N 1 2 305.381 4.490 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4o[nH]c(=O)c4c3)ccc21 ZINC001174382696 1052143359 /nfs/dbraw/zinc/14/33/59/1052143359.db2.gz CFIPEKXKMRFTCH-UHFFFAOYSA-N 1 2 308.341 4.208 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cnnc(Cl)c3Cl)ccc21 ZINC001174382580 1052143459 /nfs/dbraw/zinc/14/34/59/1052143459.db2.gz XJZVVJNPRRIGQR-UHFFFAOYSA-N 1 2 322.199 4.458 20 0 DIADLO COc1ccc(Cl)c(Nc2ccc3c(c2)[nH+]cn3C(C)C)n1 ZINC001174382410 1052143701 /nfs/dbraw/zinc/14/37/01/1052143701.db2.gz ONNQIKBYFIPIKP-UHFFFAOYSA-N 1 2 316.792 4.418 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccccc3C3OCCO3)ccc21 ZINC001174386022 1052145439 /nfs/dbraw/zinc/14/54/39/1052145439.db2.gz XVWSBIXUDRAKAQ-UHFFFAOYSA-N 1 2 323.396 4.406 20 0 DIADLO COc1ccc(F)c(F)c1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174423061 1052152962 /nfs/dbraw/zinc/15/29/62/1052152962.db2.gz IJIDYCASGGKREN-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO CC(C)(O)c1cccc(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174403937 1052160624 /nfs/dbraw/zinc/16/06/24/1052160624.db2.gz FCCYRGOVKOFFCP-UHFFFAOYSA-N 1 2 311.429 4.043 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000227600034 1052162345 /nfs/dbraw/zinc/16/23/45/1052162345.db2.gz OAKBUGVSABUAKU-AAEUAGOBSA-N 1 2 305.805 4.355 20 0 DIADLO Fc1ccc(Nc2cc[nH+]c3[nH]ccc32)cc1Br ZINC001174411132 1052164482 /nfs/dbraw/zinc/16/44/82/1052164482.db2.gz LASNMFHDCZMDHX-UHFFFAOYSA-N 1 2 306.138 4.160 20 0 DIADLO Fc1ccc(Nc2cc[nH+]c3[nH]ccc32)cc1OC(F)(F)F ZINC001174411535 1052165716 /nfs/dbraw/zinc/16/57/16/1052165716.db2.gz AVZHFIRPGCWDSK-UHFFFAOYSA-N 1 2 311.238 4.296 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nccn2Cc2ccccc2)Cc2ccccc21 ZINC000914572843 1052166878 /nfs/dbraw/zinc/16/68/78/1052166878.db2.gz HKNVAIMJTCZLBL-QGZVFWFLSA-N 1 2 317.436 4.051 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nccn2Cc2ccccc2)Cc2ccccc21 ZINC000914572843 1052166884 /nfs/dbraw/zinc/16/68/84/1052166884.db2.gz HKNVAIMJTCZLBL-QGZVFWFLSA-N 1 2 317.436 4.051 20 0 DIADLO C[C@H]1C[N@H+](Cc2nccn2Cc2ccccc2)Cc2ccccc21 ZINC000914572842 1052167244 /nfs/dbraw/zinc/16/72/44/1052167244.db2.gz HKNVAIMJTCZLBL-KRWDZBQOSA-N 1 2 317.436 4.051 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nccn2Cc2ccccc2)Cc2ccccc21 ZINC000914572842 1052167254 /nfs/dbraw/zinc/16/72/54/1052167254.db2.gz HKNVAIMJTCZLBL-KRWDZBQOSA-N 1 2 317.436 4.051 20 0 DIADLO CC(C)CCn1cc(Nc2ccc[nH+]c2N2CCCCC2)cn1 ZINC001174415808 1052168229 /nfs/dbraw/zinc/16/82/29/1052168229.db2.gz XUAZGIFVPAXZMV-UHFFFAOYSA-N 1 2 313.449 4.058 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(-c2ccccc2C)oc1=S ZINC000914567132 1052169572 /nfs/dbraw/zinc/16/95/72/1052169572.db2.gz DBKMQZZETLASKG-UHFFFAOYSA-N 1 2 305.447 4.261 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(-c2ccccc2C)oc1=S ZINC000914567132 1052169575 /nfs/dbraw/zinc/16/95/75/1052169575.db2.gz DBKMQZZETLASKG-UHFFFAOYSA-N 1 2 305.447 4.261 20 0 DIADLO c1cn(-c2ccccc2Nc2cccc(N3CCCC3)c2)c[nH+]1 ZINC001174488475 1052173678 /nfs/dbraw/zinc/17/36/78/1052173678.db2.gz LPMAYRWDDDZAJU-UHFFFAOYSA-N 1 2 304.397 4.216 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+]1CCc2ccc(O)cc2C1 ZINC000494942484 1052181169 /nfs/dbraw/zinc/18/11/69/1052181169.db2.gz QOWMLMYUASLNOI-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+]1CCc2ccc(O)cc2C1 ZINC000494942484 1052181174 /nfs/dbraw/zinc/18/11/74/1052181174.db2.gz QOWMLMYUASLNOI-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO Fc1cccc2c1CC[N@H+](Cc1cnc(-c3ccco3)s1)C2 ZINC000494956497 1052181932 /nfs/dbraw/zinc/18/19/32/1052181932.db2.gz MSUIOULLBLOVEK-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1cccc2c1CC[N@@H+](Cc1cnc(-c3ccco3)s1)C2 ZINC000494956497 1052181936 /nfs/dbraw/zinc/18/19/36/1052181936.db2.gz MSUIOULLBLOVEK-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO FC1(F)C[NH2+]CC[C@@H]1Oc1cc(Cl)c(Cl)cc1Cl ZINC001218007883 1052185626 /nfs/dbraw/zinc/18/56/26/1052185626.db2.gz RXONWSHRGRDLHV-JTQLQIEISA-N 1 2 316.562 4.023 20 0 DIADLO C[C@@H](CC[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1)c1ccccc1 ZINC000494983401 1052189331 /nfs/dbraw/zinc/18/93/31/1052189331.db2.gz YDJXRMKYPZYVGD-MAUKXSAKSA-N 1 2 312.461 4.210 20 0 DIADLO CC(C)[C@@H]1CCC[C@H]([NH2+][C@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC000495045369 1052200932 /nfs/dbraw/zinc/20/09/32/1052200932.db2.gz LVDXCBMMMKWKCH-IKGGRYGDSA-N 1 2 304.482 4.231 20 0 DIADLO Nc1[nH+]cccc1O[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC001218212993 1052208789 /nfs/dbraw/zinc/20/87/89/1052208789.db2.gz BYMJRXHFJORJOR-KRWDZBQOSA-N 1 2 310.784 4.486 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC000495087446 1052214708 /nfs/dbraw/zinc/21/47/08/1052214708.db2.gz SYBCJDQCUJYVCD-ZDUSSCGKSA-N 1 2 304.821 4.117 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC000495087446 1052214717 /nfs/dbraw/zinc/21/47/17/1052214717.db2.gz SYBCJDQCUJYVCD-ZDUSSCGKSA-N 1 2 304.821 4.117 20 0 DIADLO Cc1cc(O[C@H]2C[NH2+]CC(F)(F)C2)cc(C)c1-c1ccccc1 ZINC001218278904 1052217114 /nfs/dbraw/zinc/21/71/14/1052217114.db2.gz QHEFEMOAMXXFHD-QGZVFWFLSA-N 1 2 317.379 4.346 20 0 DIADLO Nc1cc[nH+]c(O[C@H](c2ccccc2)c2ccccc2Cl)c1 ZINC001218371748 1052231607 /nfs/dbraw/zinc/23/16/07/1052231607.db2.gz MHRNFQSTUOAQOH-GOSISDBHSA-N 1 2 310.784 4.486 20 0 DIADLO Fc1ccc2c[nH+]c(N[C@@H](c3ccccn3)C(F)(F)F)cc2c1 ZINC001168480782 1052258434 /nfs/dbraw/zinc/25/84/34/1052258434.db2.gz ZSYTYMJJXYNMRG-HNNXBMFYSA-N 1 2 321.277 4.484 20 0 DIADLO CCCCc1nc(N[C@@H](c2ccccn2)C(F)(F)F)cc(C)[nH+]1 ZINC001168481026 1052260554 /nfs/dbraw/zinc/26/05/54/1052260554.db2.gz PQJFNZJHELTTCQ-HNNXBMFYSA-N 1 2 324.350 4.238 20 0 DIADLO CCC1(CNC(=O)Nc2c(C)cc(C)[nH+]c2C)CCCCC1 ZINC001219009627 1052268021 /nfs/dbraw/zinc/26/80/21/1052268021.db2.gz HKXYDOIPYMIGLX-UHFFFAOYSA-N 1 2 303.450 4.489 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2csc(C)n2)c2ccccc2)cc1 ZINC000017317969 1052306543 /nfs/dbraw/zinc/30/65/43/1052306543.db2.gz MPLZPAFQZLISNJ-LJQANCHMSA-N 1 2 324.449 4.339 20 0 DIADLO C[N@H+](Cc1ccccc1)Cc1cc(F)ccc1Br ZINC000303253686 1052318974 /nfs/dbraw/zinc/31/89/74/1052318974.db2.gz NTQQUPQCZYVMOV-UHFFFAOYSA-N 1 2 308.194 4.220 20 0 DIADLO C[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1Br ZINC000303253686 1052318983 /nfs/dbraw/zinc/31/89/83/1052318983.db2.gz NTQQUPQCZYVMOV-UHFFFAOYSA-N 1 2 308.194 4.220 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc([NH+](C)C)cc2C)cc1F ZINC000315639684 1052346211 /nfs/dbraw/zinc/34/62/11/1052346211.db2.gz YZSNJWUTLFXZOS-CYBMUJFWSA-N 1 2 302.393 4.382 20 0 DIADLO CC(C)[C@@H](C)[N@H+](C)Cn1[nH]c(/C=C\c2ccccc2)nc1=S ZINC000915208111 1052367482 /nfs/dbraw/zinc/36/74/82/1052367482.db2.gz CGHRHNWUHWUNCP-IWMPZKFUSA-N 1 2 316.474 4.045 20 0 DIADLO CC(C)[C@@H](C)[N@@H+](C)Cn1[nH]c(/C=C\c2ccccc2)nc1=S ZINC000915208111 1052367487 /nfs/dbraw/zinc/36/74/87/1052367487.db2.gz CGHRHNWUHWUNCP-IWMPZKFUSA-N 1 2 316.474 4.045 20 0 DIADLO CCn1c(-c2ccccc2)nn(C[N@H+](C)[C@@H](C)C(C)C)c1=S ZINC000915209855 1052368519 /nfs/dbraw/zinc/36/85/19/1052368519.db2.gz VGHQINHVYKIBGS-AWEZNQCLSA-N 1 2 318.490 4.035 20 0 DIADLO CCn1c(-c2ccccc2)nn(C[N@@H+](C)[C@@H](C)C(C)C)c1=S ZINC000915209855 1052368524 /nfs/dbraw/zinc/36/85/24/1052368524.db2.gz VGHQINHVYKIBGS-AWEZNQCLSA-N 1 2 318.490 4.035 20 0 DIADLO CC(=O)Oc1ccc(C[N@@H+](C)Cc2c(F)cccc2Cl)cc1 ZINC000762632424 1052409930 /nfs/dbraw/zinc/40/99/30/1052409930.db2.gz QDPQYQJLXZGYAF-UHFFFAOYSA-N 1 2 321.779 4.036 20 0 DIADLO CC(=O)Oc1ccc(C[N@H+](C)Cc2c(F)cccc2Cl)cc1 ZINC000762632424 1052409932 /nfs/dbraw/zinc/40/99/32/1052409932.db2.gz QDPQYQJLXZGYAF-UHFFFAOYSA-N 1 2 321.779 4.036 20 0 DIADLO CC[C@H](C(=O)Nc1ccc(C)[nH+]c1N(C)C)C1CCC(C)CC1 ZINC001127366135 1052413450 /nfs/dbraw/zinc/41/34/50/1052413450.db2.gz XHJCTKVIXTUDBV-BCLQGDPASA-N 1 2 317.477 4.247 20 0 DIADLO CC[C@@H](C(=O)Nc1ccc(C)[nH+]c1N(C)C)C1CCC(C)CC1 ZINC001127366134 1052414138 /nfs/dbraw/zinc/41/41/38/1052414138.db2.gz XHJCTKVIXTUDBV-AVVWSFFYSA-N 1 2 317.477 4.247 20 0 DIADLO CC(C)Oc1cccc(CNc2ccc(N3CCCC3)[nH+]c2)c1 ZINC000236836256 1052431338 /nfs/dbraw/zinc/43/13/38/1052431338.db2.gz OWYMRBUQTDQSGL-UHFFFAOYSA-N 1 2 311.429 4.081 20 0 DIADLO FC(F)(F)c1ccccc1CNc1ccc(N2CCCC2)[nH+]c1 ZINC000237805750 1052445797 /nfs/dbraw/zinc/44/57/97/1052445797.db2.gz MMYSMAVADQLFRS-UHFFFAOYSA-N 1 2 321.346 4.313 20 0 DIADLO C[C@H]1CC[C@@H](CO)C[N@H+]1Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235587300 1052485111 /nfs/dbraw/zinc/48/51/11/1052485111.db2.gz AQKJUPYUGGAXCV-VHSXEESVSA-N 1 2 322.663 4.240 20 0 DIADLO CNc1ccc(Nc2c(C)cnn2-c2ccc(Cl)cc2)c[nH+]1 ZINC001203452952 1052456812 /nfs/dbraw/zinc/45/68/12/1052456812.db2.gz UNCXAXJSLSIOSS-UHFFFAOYSA-N 1 2 313.792 4.014 20 0 DIADLO CNc1ccc(Nc2cnc3ccc(C(F)(F)F)cc3c2)c[nH+]1 ZINC001203452908 1052457008 /nfs/dbraw/zinc/45/70/08/1052457008.db2.gz SPWWHXGWPJRZSK-UHFFFAOYSA-N 1 2 318.302 4.434 20 0 DIADLO CCCc1ccc(NC(=O)c2cccc(Cn3cc[nH+]c3)c2)cc1 ZINC000915655954 1052466649 /nfs/dbraw/zinc/46/66/49/1052466649.db2.gz JFYGDLHZGFMMNS-UHFFFAOYSA-N 1 2 319.408 4.136 20 0 DIADLO C[C@@H]1CC[C@H](CO)C[N@@H+]1Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235587307 1052484634 /nfs/dbraw/zinc/48/46/34/1052484634.db2.gz AQKJUPYUGGAXCV-ZJUUUORDSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[C@H](CO)C[N@H+]1Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235587307 1052484639 /nfs/dbraw/zinc/48/46/39/1052484639.db2.gz AQKJUPYUGGAXCV-ZJUUUORDSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1CC[C@@H](CO)C[N@@H+]1Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235587300 1052485106 /nfs/dbraw/zinc/48/51/06/1052485106.db2.gz AQKJUPYUGGAXCV-VHSXEESVSA-N 1 2 322.663 4.240 20 0 DIADLO COc1ccc2cc(CC[C@H](C)OCc3c[nH+]cn3C)ccc2c1 ZINC001222600670 1052516861 /nfs/dbraw/zinc/51/68/61/1052516861.db2.gz UFQSGUWWHLSPBM-HNNXBMFYSA-N 1 2 324.424 4.120 20 0 DIADLO Cc1cc(CO[C@H](c2ccccc2)C2CCOCC2)cc(C)[nH+]1 ZINC001223424111 1052600460 /nfs/dbraw/zinc/60/04/60/1052600460.db2.gz HDBGTBQNDRRXRF-HXUWFJFHSA-N 1 2 311.425 4.383 20 0 DIADLO CC(C)c1ccccc1OC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000916356368 1052604272 /nfs/dbraw/zinc/60/42/72/1052604272.db2.gz SZHPYIDDZCCSGR-UHFFFAOYSA-N 1 2 320.392 4.274 20 0 DIADLO Cc1ccc(Cl)cc1NC1CCN(c2cccc[nH+]2)CC1 ZINC000037184640 1052610056 /nfs/dbraw/zinc/61/00/56/1052610056.db2.gz KUTQHEZYRQUMTK-UHFFFAOYSA-N 1 2 301.821 4.124 20 0 DIADLO Fc1ccc(Br)c(C[NH2+]Cc2ccc(Cl)o2)c1 ZINC000037997433 1052631253 /nfs/dbraw/zinc/63/12/53/1052631253.db2.gz AHPKRAXHBFKPHY-UHFFFAOYSA-N 1 2 318.573 4.124 20 0 DIADLO Cc1cc(NCc2ccc(F)c(Cl)c2F)[nH+]c2cc[nH]c21 ZINC001168514017 1052633776 /nfs/dbraw/zinc/63/37/76/1052633776.db2.gz NNQLJJHTDPYGFZ-UHFFFAOYSA-N 1 2 307.731 4.415 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NCc1ccc(F)c(Cl)c1F ZINC001168513940 1052634256 /nfs/dbraw/zinc/63/42/56/1052634256.db2.gz LUGOZYXXQAKVDT-UHFFFAOYSA-N 1 2 312.747 4.413 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000125805700 1052654798 /nfs/dbraw/zinc/65/47/98/1052654798.db2.gz XNLPBXALKWXEHA-CQSZACIVSA-N 1 2 308.381 4.201 20 0 DIADLO CCCn1c2ccc(F)cc2nc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC000916854951 1052660027 /nfs/dbraw/zinc/66/00/27/1052660027.db2.gz QFXSLJZUVLSIQI-UHFFFAOYSA-N 1 2 320.371 4.438 20 0 DIADLO Cc1cccc(N2CC[NH+](Cc3csc(Cl)c3)CC2)c1 ZINC001142759942 1052673771 /nfs/dbraw/zinc/67/37/71/1052673771.db2.gz AYNLHNYOWNLUDL-UHFFFAOYSA-N 1 2 306.862 4.032 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2cc[nH]n2)c2ccsc2)cc1 ZINC000066990576 1052699388 /nfs/dbraw/zinc/69/93/88/1052699388.db2.gz PIUCKDWHBPWNQK-HNNXBMFYSA-N 1 2 303.818 4.004 20 0 DIADLO CC[N@H+](CC(C)C)Cn1[nH]c(-c2ccc(Cl)cc2)nc1=S ZINC000917454047 1052729756 /nfs/dbraw/zinc/72/97/56/1052729756.db2.gz FBKMRKVINNUTQH-UHFFFAOYSA-N 1 2 324.881 4.196 20 0 DIADLO CC[N@@H+](CC(C)C)Cn1[nH]c(-c2ccc(Cl)cc2)nc1=S ZINC000917454047 1052729761 /nfs/dbraw/zinc/72/97/61/1052729761.db2.gz FBKMRKVINNUTQH-UHFFFAOYSA-N 1 2 324.881 4.196 20 0 DIADLO CC[N@H+](CC(C)C)Cn1nc(-c2ccccc2C)oc1=S ZINC000917454053 1052729951 /nfs/dbraw/zinc/72/99/51/1052729951.db2.gz FMLAPGKJPDGJKR-UHFFFAOYSA-N 1 2 305.447 4.116 20 0 DIADLO CC[N@@H+](CC(C)C)Cn1nc(-c2ccccc2C)oc1=S ZINC000917454053 1052729956 /nfs/dbraw/zinc/72/99/56/1052729956.db2.gz FMLAPGKJPDGJKR-UHFFFAOYSA-N 1 2 305.447 4.116 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](CC)c2ccc(Cl)cc2)n1 ZINC000128802002 1052753357 /nfs/dbraw/zinc/75/33/57/1052753357.db2.gz XQCCQTQMNQSVSR-CQSZACIVSA-N 1 2 307.825 4.307 20 0 DIADLO Brc1ccc2c(c1)[C@@H](Oc1cc[nH+]cc1)CCC2 ZINC001225293968 1052769821 /nfs/dbraw/zinc/76/98/21/1052769821.db2.gz DCTLGJKAZGPMML-HNNXBMFYSA-N 1 2 304.187 4.301 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1sccc1Br ZINC000069065025 1052778111 /nfs/dbraw/zinc/77/81/11/1052778111.db2.gz PMZOVXXKUCSKJH-SECBINFHSA-N 1 2 300.221 4.297 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1sccc1Br ZINC000069065025 1052778114 /nfs/dbraw/zinc/77/81/14/1052778114.db2.gz PMZOVXXKUCSKJH-SECBINFHSA-N 1 2 300.221 4.297 20 0 DIADLO CCSc1nn(C[N@H+](C(CC)CC)C2CC2)c(=S)s1 ZINC000918178205 1052787276 /nfs/dbraw/zinc/78/72/76/1052787276.db2.gz CBTNBNACDBNVGU-UHFFFAOYSA-N 1 2 317.549 4.397 20 0 DIADLO CCSc1nn(C[N@@H+](C(CC)CC)C2CC2)c(=S)s1 ZINC000918178205 1052787282 /nfs/dbraw/zinc/78/72/82/1052787282.db2.gz CBTNBNACDBNVGU-UHFFFAOYSA-N 1 2 317.549 4.397 20 0 DIADLO CCC[N@H+](Cc1nnc(C2CC2)s1)Cc1ccc(C)cc1 ZINC000556192495 1052817863 /nfs/dbraw/zinc/81/78/63/1052817863.db2.gz FVVVFYBOFXUXDG-UHFFFAOYSA-N 1 2 301.459 4.136 20 0 DIADLO CCC[N@@H+](Cc1nnc(C2CC2)s1)Cc1ccc(C)cc1 ZINC000556192495 1052817865 /nfs/dbraw/zinc/81/78/65/1052817865.db2.gz FVVVFYBOFXUXDG-UHFFFAOYSA-N 1 2 301.459 4.136 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001127451821 1052840979 /nfs/dbraw/zinc/84/09/79/1052840979.db2.gz GGMHCRJCXXAPFU-CQSZACIVSA-N 1 2 305.466 4.391 20 0 DIADLO CC(C)C[C@@H](c1nc(-c2ccccc2Cl)no1)n1cc[nH+]c1 ZINC000923759331 1052846828 /nfs/dbraw/zinc/84/68/28/1052846828.db2.gz RAFOULPEAXVSGW-AWEZNQCLSA-N 1 2 316.792 4.222 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Oc2ccccc2)cn1)c1ccn(C)n1 ZINC000556890042 1052894315 /nfs/dbraw/zinc/89/43/15/1052894315.db2.gz BRUKXUZZBOYWHP-LSDHHAIUSA-N 1 2 322.412 4.019 20 0 DIADLO C[C@H]1[N@H+](Cc2cnc(C3CCCCC3)s2)CCOC1(C)C ZINC000556901975 1052895408 /nfs/dbraw/zinc/89/54/08/1052895408.db2.gz XIFOKDMEEFXOEE-CYBMUJFWSA-N 1 2 308.491 4.190 20 0 DIADLO C[C@H]1[N@@H+](Cc2cnc(C3CCCCC3)s2)CCOC1(C)C ZINC000556901975 1052895413 /nfs/dbraw/zinc/89/54/13/1052895413.db2.gz XIFOKDMEEFXOEE-CYBMUJFWSA-N 1 2 308.491 4.190 20 0 DIADLO Clc1cnc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)s1 ZINC000556909635 1052897370 /nfs/dbraw/zinc/89/73/70/1052897370.db2.gz JIWYGDYHHRYMNS-LLVKDONJSA-N 1 2 313.253 4.439 20 0 DIADLO Clc1cnc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)s1 ZINC000556909635 1052897372 /nfs/dbraw/zinc/89/73/72/1052897372.db2.gz JIWYGDYHHRYMNS-LLVKDONJSA-N 1 2 313.253 4.439 20 0 DIADLO C[N@@H+](Cc1ccc2ccccc2c1)Cn1ccc(C(F)(F)F)n1 ZINC000920255973 1052931008 /nfs/dbraw/zinc/93/10/08/1052931008.db2.gz OLBIXJAWWSSWRN-UHFFFAOYSA-N 1 2 319.330 4.145 20 0 DIADLO C[N@H+](Cc1ccc2ccccc2c1)Cn1ccc(C(F)(F)F)n1 ZINC000920255973 1052931011 /nfs/dbraw/zinc/93/10/11/1052931011.db2.gz OLBIXJAWWSSWRN-UHFFFAOYSA-N 1 2 319.330 4.145 20 0 DIADLO Cc1nc(N[C@@H](C)CCCC(C)C)c(Br)c(C)[nH+]1 ZINC000322957205 1052979856 /nfs/dbraw/zinc/97/98/56/1052979856.db2.gz MUEMGJNXYWRWDG-JTQLQIEISA-N 1 2 314.271 4.483 20 0 DIADLO CCC1(CNc2nc(C)[nH+]c(C)c2Br)CCCC1 ZINC000322840980 1052960363 /nfs/dbraw/zinc/96/03/63/1052960363.db2.gz QCPGNKALRBBXJG-UHFFFAOYSA-N 1 2 312.255 4.238 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccc(-n2ccnc2)cc1 ZINC000921482485 1052973912 /nfs/dbraw/zinc/97/39/12/1052973912.db2.gz NNSMXQMQULDBBZ-CQSZACIVSA-N 1 2 324.428 4.009 20 0 DIADLO Cc1ccccc1N1CC[NH+]([C@H](C)c2cc(F)ccc2F)CC1 ZINC000195546037 1052975644 /nfs/dbraw/zinc/97/56/44/1052975644.db2.gz SKSHVSBUIIKALI-OAHLLOKOSA-N 1 2 316.395 4.156 20 0 DIADLO CSc1ccc(C[N@H+](C)Cc2cnc(C(C)C)nc2)s1 ZINC000356292731 1052980122 /nfs/dbraw/zinc/98/01/22/1052980122.db2.gz DMRAHQDLDXFCFH-UHFFFAOYSA-N 1 2 307.488 4.015 20 0 DIADLO CSc1ccc(C[N@@H+](C)Cc2cnc(C(C)C)nc2)s1 ZINC000356292731 1052980125 /nfs/dbraw/zinc/98/01/25/1052980125.db2.gz DMRAHQDLDXFCFH-UHFFFAOYSA-N 1 2 307.488 4.015 20 0 DIADLO Cc1cccc(C[N@@H+]2CCO[C@@H](c3ccccc3Cl)C2)c1 ZINC000078440886 1052984322 /nfs/dbraw/zinc/98/43/22/1052984322.db2.gz YKFUYRXSHPQDEW-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1cccc(C[N@H+]2CCO[C@@H](c3ccccc3Cl)C2)c1 ZINC000078440886 1052984324 /nfs/dbraw/zinc/98/43/24/1052984324.db2.gz YKFUYRXSHPQDEW-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1nc(NCC(C)(C)C(C)(C)C)c(Br)c(C)[nH+]1 ZINC000322984170 1052985401 /nfs/dbraw/zinc/98/54/01/1052985401.db2.gz WRSSMCAEERIVGR-UHFFFAOYSA-N 1 2 314.271 4.340 20 0 DIADLO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C1(c2ccccc2F)CC1 ZINC000179648145 1053020050 /nfs/dbraw/zinc/02/00/50/1053020050.db2.gz FKQYAEFCNPITHY-UHFFFAOYSA-N 1 2 320.751 4.166 20 0 DIADLO CC(C)[N@H+](Cc1ccc(C#N)cc1)Cc1cccc(Cl)c1O ZINC000179696111 1053022289 /nfs/dbraw/zinc/02/22/89/1053022289.db2.gz OOVBQWBMMNBGGJ-UHFFFAOYSA-N 1 2 314.816 4.328 20 0 DIADLO CC(C)[N@@H+](Cc1ccc(C#N)cc1)Cc1cccc(Cl)c1O ZINC000179696111 1053022292 /nfs/dbraw/zinc/02/22/92/1053022292.db2.gz OOVBQWBMMNBGGJ-UHFFFAOYSA-N 1 2 314.816 4.328 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(Cl)nc1Cl)c1nccs1 ZINC000801539975 1053025748 /nfs/dbraw/zinc/02/57/48/1053025748.db2.gz SASLOJFTCJWCGP-VIFPVBQESA-N 1 2 302.230 4.086 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1cccnc1Cl ZINC000179921136 1053034546 /nfs/dbraw/zinc/03/45/46/1053034546.db2.gz PXMKOHSDUUPSMM-CYBMUJFWSA-N 1 2 316.836 4.293 20 0 DIADLO C[C@@H](CSC(C)(C)C)[NH2+]c1ccc(N2CCOC[C@@H]2C)cc1 ZINC000179942463 1053035903 /nfs/dbraw/zinc/03/59/03/1053035903.db2.gz AQRMKJLOBFUZTI-GJZGRUSLSA-N 1 2 322.518 4.244 20 0 DIADLO c1cn(CCCSc2nc(-c3ccccc3)cs2)c[nH+]1 ZINC000180431562 1053056997 /nfs/dbraw/zinc/05/69/97/1053056997.db2.gz BDQVILAUQIXRRR-UHFFFAOYSA-N 1 2 301.440 4.189 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)Cc1ccc(Oc2ccccc2)o1 ZINC000180422751 1053057474 /nfs/dbraw/zinc/05/74/74/1053057474.db2.gz JULNOQUJIPBROH-UHFFFAOYSA-N 1 2 312.369 4.309 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)Cc1ccc(Oc2ccccc2)o1 ZINC000180422751 1053057479 /nfs/dbraw/zinc/05/74/79/1053057479.db2.gz JULNOQUJIPBROH-UHFFFAOYSA-N 1 2 312.369 4.309 20 0 DIADLO Cc1cc([NH2+][C@H](C)CSC(C)(C)C)ccc1N1CCOCC1 ZINC000180427664 1053058169 /nfs/dbraw/zinc/05/81/69/1053058169.db2.gz STLRGDWACCTJAD-OAHLLOKOSA-N 1 2 322.518 4.164 20 0 DIADLO Cc1[nH]c2ccc(O[C@H]3CCc4c3cc(F)cc4F)cc2[nH+]1 ZINC001228328509 1053075252 /nfs/dbraw/zinc/07/52/52/1053075252.db2.gz FXARLIHGHKGLOP-KRWDZBQOSA-N 1 2 300.308 4.216 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1O ZINC000180638474 1053075435 /nfs/dbraw/zinc/07/54/35/1053075435.db2.gz PAPRGCUTUUHXEP-INIZCTEOSA-N 1 2 304.821 4.111 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1cccc(Cl)c1O ZINC000180638474 1053075437 /nfs/dbraw/zinc/07/54/37/1053075437.db2.gz PAPRGCUTUUHXEP-INIZCTEOSA-N 1 2 304.821 4.111 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1ccc(Cl)nc1 ZINC000849347385 1053089732 /nfs/dbraw/zinc/08/97/32/1053089732.db2.gz HAFOHTOAQDBZIV-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO CC(C)C(C)(C)C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001350904692 1053117040 /nfs/dbraw/zinc/11/70/40/1053117040.db2.gz MWNSZGGKORIVSS-OAHLLOKOSA-N 1 2 319.493 4.026 20 0 DIADLO CC(C)(C)c1cnc(NCc2cc(-n3cc[nH+]c3)cs2)s1 ZINC000543678312 1053132092 /nfs/dbraw/zinc/13/20/92/1053132092.db2.gz SREKUMCOKDHHLW-UHFFFAOYSA-N 1 2 318.471 4.300 20 0 DIADLO C[C@@H](C(=O)Nc1cccc(Sc2ccccc2)c1)n1cc[nH+]c1 ZINC001351086995 1053135948 /nfs/dbraw/zinc/13/59/48/1053135948.db2.gz LUVJJKNUCJTXNF-AWEZNQCLSA-N 1 2 323.421 4.234 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+]1CCO[C@@](C)(C2CC2)C1 ZINC001559992795 1053141356 /nfs/dbraw/zinc/14/13/56/1053141356.db2.gz ILEGDELGNKCFJD-MLGOLLRUSA-N 1 2 324.262 4.011 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+]1CCO[C@@](C)(C2CC2)C1 ZINC001559992795 1053141363 /nfs/dbraw/zinc/14/13/63/1053141363.db2.gz ILEGDELGNKCFJD-MLGOLLRUSA-N 1 2 324.262 4.011 20 0 DIADLO CC[C@@H](C)Sc1ccc(NC(=O)[C@H](C)n2cc[nH+]c2)c(C)c1 ZINC001318081478 1053149503 /nfs/dbraw/zinc/14/95/03/1053149503.db2.gz GOEWVERMIODYEV-KGLIPLIRSA-N 1 2 317.458 4.282 20 0 DIADLO CC(C)C[C@H](NC(=O)[C@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC001318682313 1053183374 /nfs/dbraw/zinc/18/33/74/1053183374.db2.gz SHQZKLJUWPBWDS-BBRMVZONSA-N 1 2 319.836 4.001 20 0 DIADLO Cc1cc(C)c(C(=O)NCCCc2ccc(Cl)cc2)c(C)[nH+]1 ZINC001360137673 1053190348 /nfs/dbraw/zinc/19/03/48/1053190348.db2.gz YKTVFFVLMBMBCE-UHFFFAOYSA-N 1 2 316.832 4.023 20 0 DIADLO CCO[C@H]1C[C@H]([N@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001560635720 1053195451 /nfs/dbraw/zinc/19/54/51/1053195451.db2.gz LKGJKXHFQBJHRT-STQMWFEESA-N 1 2 317.260 4.024 20 0 DIADLO CCO[C@H]1C[C@H]([N@@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001560635720 1053195455 /nfs/dbraw/zinc/19/54/55/1053195455.db2.gz LKGJKXHFQBJHRT-STQMWFEESA-N 1 2 317.260 4.024 20 0 DIADLO CCCCC[C@H](NC(=O)c1cccc2[nH+]ccn21)C(C)(C)C ZINC001360195401 1053197114 /nfs/dbraw/zinc/19/71/14/1053197114.db2.gz UMSFIMBRIKETNG-HNNXBMFYSA-N 1 2 301.434 4.059 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2csc(C3CC3)n2)CCC1 ZINC001318882116 1053202106 /nfs/dbraw/zinc/20/21/06/1053202106.db2.gz NIZMAOVHCKRLOH-UHFFFAOYSA-N 1 2 314.454 4.198 20 0 DIADLO Cc1cc(C)c(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)c(C)c1 ZINC000090369437 1053230890 /nfs/dbraw/zinc/23/08/90/1053230890.db2.gz BGJLQCFKNXWMPO-UHFFFAOYSA-N 1 2 323.371 4.189 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@@H+]1CC[C@@H]2CCCC[C@H]2C1 ZINC001319334822 1053235824 /nfs/dbraw/zinc/23/58/24/1053235824.db2.gz NNBRKWCPNJFMAI-HOCLYGCPSA-N 1 2 303.450 4.129 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@H+]1CC[C@@H]2CCCC[C@H]2C1 ZINC001319334822 1053235831 /nfs/dbraw/zinc/23/58/31/1053235831.db2.gz NNBRKWCPNJFMAI-HOCLYGCPSA-N 1 2 303.450 4.129 20 0 DIADLO CCOc1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)o1 ZINC001351986714 1053255180 /nfs/dbraw/zinc/25/51/80/1053255180.db2.gz JHMZCINTYCWSHA-NSHDSACASA-N 1 2 308.447 4.283 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)cs1 ZINC001352041407 1053264852 /nfs/dbraw/zinc/26/48/52/1053264852.db2.gz JWOFXLMZBYDHDV-LBPRGKRZSA-N 1 2 322.371 4.133 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)cs1 ZINC001352041407 1053264862 /nfs/dbraw/zinc/26/48/62/1053264862.db2.gz JWOFXLMZBYDHDV-LBPRGKRZSA-N 1 2 322.371 4.133 20 0 DIADLO C[N@@H+](Cc1c[nH]c(-c2ccccc2)n1)Cc1cc2ccccc2[nH]1 ZINC001319828574 1053277754 /nfs/dbraw/zinc/27/77/54/1053277754.db2.gz KHEJLGONEPHVIW-UHFFFAOYSA-N 1 2 316.408 4.190 20 0 DIADLO C[N@H+](Cc1c[nH]c(-c2ccccc2)n1)Cc1cc2ccccc2[nH]1 ZINC001319828574 1053277762 /nfs/dbraw/zinc/27/77/62/1053277762.db2.gz KHEJLGONEPHVIW-UHFFFAOYSA-N 1 2 316.408 4.190 20 0 DIADLO C[N@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1cc2ccccc2[nH]1 ZINC001319828574 1053277770 /nfs/dbraw/zinc/27/77/70/1053277770.db2.gz KHEJLGONEPHVIW-UHFFFAOYSA-N 1 2 316.408 4.190 20 0 DIADLO C[N@@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1cc2ccccc2[nH]1 ZINC001319828574 1053277779 /nfs/dbraw/zinc/27/77/79/1053277779.db2.gz KHEJLGONEPHVIW-UHFFFAOYSA-N 1 2 316.408 4.190 20 0 DIADLO Cc1ccc(NC(=O)c2cccc3[nH+]ccn32)c(Cl)c1Cl ZINC001319973843 1053290408 /nfs/dbraw/zinc/29/04/08/1053290408.db2.gz KMTQGAZSTGSZGK-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2ccc(Cl)nc2)c1C ZINC001320093673 1053304128 /nfs/dbraw/zinc/30/41/28/1053304128.db2.gz APTQSZIRNXAYBP-UHFFFAOYSA-N 1 2 308.834 4.189 20 0 DIADLO Cc1nc(NCC[C@H](C)c2cccc(C(F)(F)F)c2)cc[nH+]1 ZINC000470873894 1053305171 /nfs/dbraw/zinc/30/51/71/1053305171.db2.gz QQOFJYCKUDCPJW-NSHDSACASA-N 1 2 309.335 4.410 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1cn(C)nc1C(F)F ZINC001320464716 1053334605 /nfs/dbraw/zinc/33/46/05/1053334605.db2.gz YUQOXLHHNZWBOH-MNOVXSKESA-N 1 2 323.362 4.005 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1cn(C)nc1C(F)F ZINC001320464716 1053334619 /nfs/dbraw/zinc/33/46/19/1053334619.db2.gz YUQOXLHHNZWBOH-MNOVXSKESA-N 1 2 323.362 4.005 20 0 DIADLO Cc1ccnc(CSCc2ccc(-n3cc[nH+]c3)cc2C)c1 ZINC001320815212 1053363125 /nfs/dbraw/zinc/36/31/25/1053363125.db2.gz KCKAPMFMKSAIIZ-UHFFFAOYSA-N 1 2 309.438 4.318 20 0 DIADLO Cc1nc(NCc2cccc(C(F)F)c2)c2c([nH+]1)CCCC2 ZINC001320821554 1053364301 /nfs/dbraw/zinc/36/43/01/1053364301.db2.gz YMFPXWJLRBWFAO-UHFFFAOYSA-N 1 2 303.356 4.214 20 0 DIADLO CCCCC1CCC(CNC(=O)c2cccc3[nH+]ccn32)CC1 ZINC001434871200 1053371810 /nfs/dbraw/zinc/37/18/10/1053371810.db2.gz ANYJKQYVHPZRQF-UHFFFAOYSA-N 1 2 313.445 4.061 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@H]3CCCc4c(O)cccc43)ccc21 ZINC001321586623 1053422596 /nfs/dbraw/zinc/42/25/96/1053422596.db2.gz FYYNEBUFCYCIRQ-SFHVURJKSA-N 1 2 308.425 4.264 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@H]3CCCc4c(O)cccc43)ccc21 ZINC001321586623 1053422601 /nfs/dbraw/zinc/42/26/01/1053422601.db2.gz FYYNEBUFCYCIRQ-SFHVURJKSA-N 1 2 308.425 4.264 20 0 DIADLO COc1cccc2c1CC[C@H]([NH2+][C@H](c1ccccc1)C(F)F)C2 ZINC001474761668 1053430897 /nfs/dbraw/zinc/43/08/97/1053430897.db2.gz CYAPKQRZKIHBMU-MAUKXSAKSA-N 1 2 317.379 4.149 20 0 DIADLO FC(F)[C@@H]([NH2+]C1CCC2(CCOCC2)CC1)c1ccccc1 ZINC001474763136 1053438542 /nfs/dbraw/zinc/43/85/42/1053438542.db2.gz UKZQUNYOXHOVPT-INIZCTEOSA-N 1 2 309.400 4.322 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1ccc2[nH]cnc2c1 ZINC001353003007 1053453486 /nfs/dbraw/zinc/45/34/86/1053453486.db2.gz JBNJLEFGRDIVTD-UHFFFAOYSA-N 1 2 319.412 4.280 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1ccc2nc[nH]c2c1 ZINC001353003007 1053453495 /nfs/dbraw/zinc/45/34/95/1053453495.db2.gz JBNJLEFGRDIVTD-UHFFFAOYSA-N 1 2 319.412 4.280 20 0 DIADLO CC1(C)CCCC[C@H]1Nc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC000325354175 1053467437 /nfs/dbraw/zinc/46/74/37/1053467437.db2.gz AYPPHRZAQWZFFZ-MRXNPFEDSA-N 1 2 321.428 4.196 20 0 DIADLO CC(C)([NH2+]Cc1cccc(Cl)c1O)c1ccc(F)c(F)c1 ZINC000182523821 1053468462 /nfs/dbraw/zinc/46/84/62/1053468462.db2.gz NORSDAWIIBFOTK-UHFFFAOYSA-N 1 2 311.759 4.349 20 0 DIADLO Cc1ccc(OC2CC[NH+](C/C(Cl)=C/Cl)CC2)cc1 ZINC000763565095 1053474947 /nfs/dbraw/zinc/47/49/47/1053474947.db2.gz YLITXBIQWIXQIW-RAXLEYEMSA-N 1 2 300.229 4.157 20 0 DIADLO N#CCC[C@H]([NH2+]Cc1cccc(Cl)c1O)c1ccccc1 ZINC000182656197 1053490250 /nfs/dbraw/zinc/49/02/50/1053490250.db2.gz JKMLRPHRJNDMCA-INIZCTEOSA-N 1 2 300.789 4.180 20 0 DIADLO C[C@@H]1CC[C@@H](Nc2[nH+]cnc3c2cnn3-c2ccccc2)C[C@H]1C ZINC000325669980 1053516576 /nfs/dbraw/zinc/51/65/76/1053516576.db2.gz LVDNQOJDKVEELC-RBSFLKMASA-N 1 2 321.428 4.052 20 0 DIADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccc(F)c(F)c1 ZINC000152715396 1053518741 /nfs/dbraw/zinc/51/87/41/1053518741.db2.gz IDUSQLYCQHHGDE-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc2c(s1)C[C@@H](C)CC2)c1nccs1 ZINC000152763495 1053525873 /nfs/dbraw/zinc/52/58/73/1053525873.db2.gz KMVHUGUKOCTXIF-ZBEGNZNMSA-N 1 2 321.515 4.139 20 0 DIADLO CC(C)Oc1ccc[nH+]c1N[C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC001322653033 1053534234 /nfs/dbraw/zinc/53/42/34/1053534234.db2.gz SRUBTURERBHFGD-NVXWUHKLSA-N 1 2 311.429 4.402 20 0 DIADLO Cc1cc(NC(=O)C(C)(C)c2ccc(Cl)c(Cl)c2)cc[nH+]1 ZINC001322765373 1053541855 /nfs/dbraw/zinc/54/18/55/1053541855.db2.gz DWXHEECINPHIMB-UHFFFAOYSA-N 1 2 323.223 4.035 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000182955711 1053562324 /nfs/dbraw/zinc/56/23/24/1053562324.db2.gz HGKFMJUVCKUYIQ-CYBMUJFWSA-N 1 2 311.385 4.150 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000182955711 1053562337 /nfs/dbraw/zinc/56/23/37/1053562337.db2.gz HGKFMJUVCKUYIQ-CYBMUJFWSA-N 1 2 311.385 4.150 20 0 DIADLO Cc1cc(NC[C@H](O)c2ccccc2Cl)[nH+]c2ccccc12 ZINC001323116916 1053564963 /nfs/dbraw/zinc/56/49/63/1053564963.db2.gz HDSXUZHWQGGETM-KRWDZBQOSA-N 1 2 312.800 4.342 20 0 DIADLO C[C@H](Nc1nc(N)c2ccccc2[nH+]1)c1ccc(Cl)c(F)c1 ZINC001323205671 1053569465 /nfs/dbraw/zinc/56/94/65/1053569465.db2.gz GLJPNHBIVYMTCF-VIFPVBQESA-N 1 2 316.767 4.178 20 0 DIADLO C[C@@H]([NH2+]Cc1noc2c1CCCC2)c1ccc(Cl)c(F)c1 ZINC001323438725 1053581481 /nfs/dbraw/zinc/58/14/81/1053581481.db2.gz NHIRTLHNPCTMKB-SNVBAGLBSA-N 1 2 308.784 4.197 20 0 DIADLO CC(=O)Nc1cccc([C@@H](C)Nc2ccc([NH+]3CCCC3)cc2)c1 ZINC000324926411 1053589301 /nfs/dbraw/zinc/58/93/01/1053589301.db2.gz WBFZFRQARRLANG-OAHLLOKOSA-N 1 2 323.440 4.418 20 0 DIADLO CC(=O)Nc1cccc([C@H](C)Nc2ccc([NH+]3CCCC3)cc2)c1 ZINC000324926410 1053589746 /nfs/dbraw/zinc/58/97/46/1053589746.db2.gz WBFZFRQARRLANG-HNNXBMFYSA-N 1 2 323.440 4.418 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C)Cc2ccc(C(C)C)cc2)c(C)[nH+]1 ZINC001435569546 1053604193 /nfs/dbraw/zinc/60/41/93/1053604193.db2.gz IUYXVWVLQGYHDD-INIZCTEOSA-N 1 2 324.468 4.491 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000620127973 1053610340 /nfs/dbraw/zinc/61/03/40/1053610340.db2.gz GMQGULUZLWOGJZ-PJIJBLCYSA-N 1 2 317.379 4.488 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000620127973 1053610350 /nfs/dbraw/zinc/61/03/50/1053610350.db2.gz GMQGULUZLWOGJZ-PJIJBLCYSA-N 1 2 317.379 4.488 20 0 DIADLO CCCCc1ccc(NC(=S)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001200383141 1053614465 /nfs/dbraw/zinc/61/44/65/1053614465.db2.gz UXGLJAWYQXJCOZ-UHFFFAOYSA-N 1 2 324.453 4.486 20 0 DIADLO COc1ccccc1C1([NH2+][C@@H](C)c2csc(C)n2)CCC1 ZINC001323997383 1053615205 /nfs/dbraw/zinc/61/52/05/1053615205.db2.gz NLBAOXXGRMMKEY-LBPRGKRZSA-N 1 2 302.443 4.190 20 0 DIADLO Cc1cc(NCc2ccccc2-n2cccn2)[nH+]c2ccccc12 ZINC000326567779 1053619797 /nfs/dbraw/zinc/61/97/97/1053619797.db2.gz FOLOWEHQRNKWEE-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO FC(F)n1ccnc1C[N@@H+]1C[C@H]2CCCC[C@]21c1ccccc1 ZINC001324058645 1053621397 /nfs/dbraw/zinc/62/13/97/1053621397.db2.gz AUIAISKEURHHQJ-QAPCUYQASA-N 1 2 317.383 4.180 20 0 DIADLO FC(F)n1ccnc1C[N@H+]1C[C@H]2CCCC[C@]21c1ccccc1 ZINC001324058645 1053621404 /nfs/dbraw/zinc/62/14/04/1053621404.db2.gz AUIAISKEURHHQJ-QAPCUYQASA-N 1 2 317.383 4.180 20 0 DIADLO Cc1ccc(NC(=O)C[C@@H]2C[C@H](C)CC(C)(C)C2)c(N(C)C)[nH+]1 ZINC001435646246 1053628563 /nfs/dbraw/zinc/62/85/63/1053628563.db2.gz VDAJANGWFJPVKX-ZFWWWQNUSA-N 1 2 317.477 4.247 20 0 DIADLO CO[C@]1(C(F)(F)F)CCCN(c2cc(C)c3ccccc3[nH+]2)C1 ZINC001324272017 1053640396 /nfs/dbraw/zinc/64/03/96/1053640396.db2.gz HHJJNTYTANEPKX-MRXNPFEDSA-N 1 2 324.346 4.091 20 0 DIADLO Fc1cc(Br)ccc1C[NH2+]Cc1ccc(Cl)o1 ZINC000620438756 1053663444 /nfs/dbraw/zinc/66/34/44/1053663444.db2.gz LXYIXDZWIFFDMP-UHFFFAOYSA-N 1 2 318.573 4.124 20 0 DIADLO CCc1cc(C(=O)Nc2cc[nH+]c(C)c2)sc1-c1ccccc1 ZINC001435757203 1053665354 /nfs/dbraw/zinc/66/53/54/1053665354.db2.gz IQYNWCBJYHJLAL-UHFFFAOYSA-N 1 2 322.433 4.355 20 0 DIADLO CSC1(C[N@@H+]2CCO[C@H](c3ccc(Cl)s3)C2)CCC1 ZINC001324622852 1053666596 /nfs/dbraw/zinc/66/65/96/1053666596.db2.gz KOOJTSJXSVZDSN-NSHDSACASA-N 1 2 317.907 4.061 20 0 DIADLO CSC1(C[N@H+]2CCO[C@H](c3ccc(Cl)s3)C2)CCC1 ZINC001324622852 1053666607 /nfs/dbraw/zinc/66/66/07/1053666607.db2.gz KOOJTSJXSVZDSN-NSHDSACASA-N 1 2 317.907 4.061 20 0 DIADLO CCCC(=O)[C@@H](CCC)Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231082678 1053671320 /nfs/dbraw/zinc/67/13/20/1053671320.db2.gz QOVICFNDRXZTBU-GOSISDBHSA-N 1 2 300.402 4.004 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(O[C@@H]2CCc3ccccc3C2)cc1 ZINC001231083246 1053672167 /nfs/dbraw/zinc/67/21/67/1053672167.db2.gz GKMZVPPILBUFQZ-LJQANCHMSA-N 1 2 304.393 4.023 20 0 DIADLO Cc1cccc2nc(N3CCC(CCCn4cc[nH+]c4)CC3)oc21 ZINC001324716024 1053673785 /nfs/dbraw/zinc/67/37/85/1053673785.db2.gz JBZDQWFMCBFCBK-UHFFFAOYSA-N 1 2 324.428 4.030 20 0 DIADLO O=C(c1ccc(-n2cc[nH+]c2)cc1)N1CCCC[C@@H]1CC1CCC1 ZINC000620573746 1053684810 /nfs/dbraw/zinc/68/48/10/1053684810.db2.gz QTJUZLHZULJBTB-LJQANCHMSA-N 1 2 323.440 4.057 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2ncc(C(C)(C)C)o2)c1C ZINC001324957770 1053691901 /nfs/dbraw/zinc/69/19/01/1053691901.db2.gz FUIUIGCOTTXJJV-UHFFFAOYSA-N 1 2 320.458 4.426 20 0 DIADLO CCn1ccnc1C[NH2+][C@H](c1ccccc1)c1ccc(C)cc1C ZINC000263886805 1053702545 /nfs/dbraw/zinc/70/25/45/1053702545.db2.gz JEYTZBXMPWQDBJ-OAQYLSRUSA-N 1 2 319.452 4.399 20 0 DIADLO Fc1cc2[nH+]ccc(N3CC[C@@H]4OCCC[C@@H]4C3)c2cc1Cl ZINC001325182742 1053703510 /nfs/dbraw/zinc/70/35/10/1053703510.db2.gz VWJGGGJSVONXMC-DIFFPNOSSA-N 1 2 320.795 4.033 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC[C@@H]2c2ccncc2)cs1 ZINC000153893010 1053717883 /nfs/dbraw/zinc/71/78/83/1053717883.db2.gz GORAFMFNJOQFEV-QGZVFWFLSA-N 1 2 315.486 4.464 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC[C@@H]2c2ccncc2)cs1 ZINC000153893010 1053717891 /nfs/dbraw/zinc/71/78/91/1053717891.db2.gz GORAFMFNJOQFEV-QGZVFWFLSA-N 1 2 315.486 4.464 20 0 DIADLO CCS[C@H]1CC[C@H]([N@H+](C)Cc2noc(C3CCCCC3)n2)C1 ZINC000154153354 1053729465 /nfs/dbraw/zinc/72/94/65/1053729465.db2.gz CYDDYVGZTOHUJR-GJZGRUSLSA-N 1 2 323.506 4.223 20 0 DIADLO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2noc(C3CCCCC3)n2)C1 ZINC000154153354 1053729478 /nfs/dbraw/zinc/72/94/78/1053729478.db2.gz CYDDYVGZTOHUJR-GJZGRUSLSA-N 1 2 323.506 4.223 20 0 DIADLO Cc1cc(N2CCO[C@H](c3ccccc3F)C2)[nH+]c2ccccc12 ZINC001325889012 1053741849 /nfs/dbraw/zinc/74/18/49/1053741849.db2.gz JCFIQYKMFSBFRT-IBGZPJMESA-N 1 2 322.383 4.260 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1csc(C(C)C)n1 ZINC001325943070 1053743840 /nfs/dbraw/zinc/74/38/40/1053743840.db2.gz QFKCQCPLBUULBB-UHFFFAOYSA-N 1 2 318.421 4.387 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155079426 1053762840 /nfs/dbraw/zinc/76/28/40/1053762840.db2.gz IZIWMCBSCOPHRH-AWEZNQCLSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155079426 1053762854 /nfs/dbraw/zinc/76/28/54/1053762854.db2.gz IZIWMCBSCOPHRH-AWEZNQCLSA-N 1 2 309.438 4.398 20 0 DIADLO CCc1ccc(C[NH+](Cc2cccnc2)Cc2cccnc2)s1 ZINC001231501528 1053771362 /nfs/dbraw/zinc/77/13/62/1053771362.db2.gz KYWLCZSAHCSUFM-UHFFFAOYSA-N 1 2 323.465 4.303 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(F)c(Oc3ccccc3)c2)C[C@H](C)O1 ZINC001231536248 1053780584 /nfs/dbraw/zinc/78/05/84/1053780584.db2.gz GATDSCNOALCYNK-GASCZTMLSA-N 1 2 315.388 4.227 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(F)c(Oc3ccccc3)c2)C[C@H](C)O1 ZINC001231536248 1053780595 /nfs/dbraw/zinc/78/05/95/1053780595.db2.gz GATDSCNOALCYNK-GASCZTMLSA-N 1 2 315.388 4.227 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(F)c(Oc3ccccc3)c2)CCO1 ZINC001231536946 1053782115 /nfs/dbraw/zinc/78/21/15/1053782115.db2.gz JVLJWIBFRCMFME-UHFFFAOYSA-N 1 2 315.388 4.229 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(F)c(Oc3ccccc3)c2)CCO1 ZINC001231536946 1053782131 /nfs/dbraw/zinc/78/21/31/1053782131.db2.gz JVLJWIBFRCMFME-UHFFFAOYSA-N 1 2 315.388 4.229 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(Br)c[nH]1 ZINC001231576326 1053785270 /nfs/dbraw/zinc/78/52/70/1053785270.db2.gz ADVPGKXUVLBYAC-MRXNPFEDSA-N 1 2 319.246 4.287 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc(Br)c[nH]1 ZINC001231576326 1053785273 /nfs/dbraw/zinc/78/52/73/1053785273.db2.gz ADVPGKXUVLBYAC-MRXNPFEDSA-N 1 2 319.246 4.287 20 0 DIADLO CC[C@@H]1CC[N@H+](Cc2cc(Cl)c(O)c(Br)c2)C1 ZINC001231751342 1053848853 /nfs/dbraw/zinc/84/88/53/1053848853.db2.gz SBMONIZPYROTRB-SECBINFHSA-N 1 2 318.642 4.040 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(Br)c[nH]2)cc1 ZINC001231572289 1053785967 /nfs/dbraw/zinc/78/59/67/1053785967.db2.gz UELAJSLPHOVUAW-HNNXBMFYSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2cc(Br)c[nH]2)cc1 ZINC001231572289 1053785973 /nfs/dbraw/zinc/78/59/73/1053785973.db2.gz UELAJSLPHOVUAW-HNNXBMFYSA-N 1 2 323.209 4.253 20 0 DIADLO CC[C@@H]1CC[N@@H+](Cc2cc(Cl)c(O)c(Br)c2)C1 ZINC001231751342 1053848859 /nfs/dbraw/zinc/84/88/59/1053848859.db2.gz SBMONIZPYROTRB-SECBINFHSA-N 1 2 318.642 4.040 20 0 DIADLO Fc1ccccc1[C@H]1CCC[N@@H+]1Cc1nc2c(s1)CCCC2 ZINC001231582019 1053788201 /nfs/dbraw/zinc/78/82/01/1053788201.db2.gz CEWIYLKDDKVEKI-MRXNPFEDSA-N 1 2 316.445 4.498 20 0 DIADLO Fc1ccccc1[C@H]1CCC[N@H+]1Cc1nc2c(s1)CCCC2 ZINC001231582019 1053788217 /nfs/dbraw/zinc/78/82/17/1053788217.db2.gz CEWIYLKDDKVEKI-MRXNPFEDSA-N 1 2 316.445 4.498 20 0 DIADLO Brc1c[nH]c(C[N@@H+]2CCC[C@@H]2c2cccs2)c1 ZINC001231576910 1053789225 /nfs/dbraw/zinc/78/92/25/1053789225.db2.gz PGVBWKVYDMWTDN-GFCCVEGCSA-N 1 2 311.248 4.176 20 0 DIADLO Brc1c[nH]c(C[N@H+]2CCC[C@@H]2c2cccs2)c1 ZINC001231576910 1053789236 /nfs/dbraw/zinc/78/92/36/1053789236.db2.gz PGVBWKVYDMWTDN-GFCCVEGCSA-N 1 2 311.248 4.176 20 0 DIADLO FC(F)(F)c1cc(Br)cc(C[NH+]2CCCCC2)c1 ZINC001231583540 1053790409 /nfs/dbraw/zinc/79/04/09/1053790409.db2.gz LEIDWTVJMCCFPS-UHFFFAOYSA-N 1 2 322.168 4.454 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(Br)c[nH]2)c1 ZINC001231577471 1053790462 /nfs/dbraw/zinc/79/04/62/1053790462.db2.gz WBLWRSAMIIYKEN-HNNXBMFYSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2cc(Br)c[nH]2)c1 ZINC001231577471 1053790466 /nfs/dbraw/zinc/79/04/66/1053790466.db2.gz WBLWRSAMIIYKEN-HNNXBMFYSA-N 1 2 323.209 4.253 20 0 DIADLO Cc1cc(C[NH2+]C2(c3c(Cl)cccc3Cl)CCC2)[nH]n1 ZINC001326578723 1053794082 /nfs/dbraw/zinc/79/40/82/1053794082.db2.gz YZBXGBIWWHDILZ-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO Cc1ccc(-c2ccc(C[N@@H+]3CCC(F)(F)[C@H](F)C3)cc2)o1 ZINC001231596469 1053795613 /nfs/dbraw/zinc/79/56/13/1053795613.db2.gz VMEZTYHJDCJENT-MRXNPFEDSA-N 1 2 309.331 4.434 20 0 DIADLO Cc1ccc(-c2ccc(C[N@H+]3CCC(F)(F)[C@H](F)C3)cc2)o1 ZINC001231596469 1053795622 /nfs/dbraw/zinc/79/56/22/1053795622.db2.gz VMEZTYHJDCJENT-MRXNPFEDSA-N 1 2 309.331 4.434 20 0 DIADLO COC[C@H]1CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1Cl ZINC001231597845 1053796014 /nfs/dbraw/zinc/79/60/14/1053796014.db2.gz IZRFEHSWIDHYBU-LLVKDONJSA-N 1 2 308.636 4.258 20 0 DIADLO COC[C@H]1CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1Cl ZINC001231597845 1053796020 /nfs/dbraw/zinc/79/60/20/1053796020.db2.gz IZRFEHSWIDHYBU-LLVKDONJSA-N 1 2 308.636 4.258 20 0 DIADLO Cc1ccc(N[C@@H](C)c2cccc(Br)n2)c(C)[nH+]1 ZINC001354238855 1053804726 /nfs/dbraw/zinc/80/47/26/1053804726.db2.gz ZOUYZRHVQWDGLE-NSHDSACASA-N 1 2 306.207 4.029 20 0 DIADLO COC[C@@H]([NH2+][C@@H]1CCOc2c(Cl)cccc21)c1ccc(C)o1 ZINC000156437530 1053807024 /nfs/dbraw/zinc/80/70/24/1053807024.db2.gz JUCNBPPHVJYSHX-HUUCEWRRSA-N 1 2 321.804 4.042 20 0 DIADLO CCc1ccc(C[N@@H+]2CCSC[C@@H]2c2ccc(F)cc2)nc1 ZINC001231641954 1053812788 /nfs/dbraw/zinc/81/27/88/1053812788.db2.gz LIUHVYNUFSIOSB-GOSISDBHSA-N 1 2 316.445 4.073 20 0 DIADLO CCc1ccc(C[N@H+]2CCSC[C@@H]2c2ccc(F)cc2)nc1 ZINC001231641954 1053812802 /nfs/dbraw/zinc/81/28/02/1053812802.db2.gz LIUHVYNUFSIOSB-GOSISDBHSA-N 1 2 316.445 4.073 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1csc(N(C)C2CC2)n1 ZINC000156586038 1053816457 /nfs/dbraw/zinc/81/64/57/1053816457.db2.gz BUCFNKBEIGAIED-LBPRGKRZSA-N 1 2 319.449 4.074 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1csc(N(C)C2CC2)n1 ZINC000156586038 1053816475 /nfs/dbraw/zinc/81/64/75/1053816475.db2.gz BUCFNKBEIGAIED-LBPRGKRZSA-N 1 2 319.449 4.074 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(N(C)C2CC2)n1)c1ccccc1Cl ZINC000156579535 1053816895 /nfs/dbraw/zinc/81/68/95/1053816895.db2.gz OTRVZDADIVJTHZ-LLVKDONJSA-N 1 2 321.877 4.246 20 0 DIADLO CC(C)[C@H]1C[C@H]1C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001436229854 1053817816 /nfs/dbraw/zinc/81/78/16/1053817816.db2.gz VZROHCMXNDUXOW-QZTJIDSGSA-N 1 2 324.424 4.084 20 0 DIADLO CSc1ccccc1[C@H](C)[NH2+][C@@H]1COc2cc(F)cc(F)c21 ZINC001327031252 1053827751 /nfs/dbraw/zinc/82/77/51/1053827751.db2.gz CNNDWDJRBULQFS-IINYFYTJSA-N 1 2 321.392 4.471 20 0 DIADLO CCC(C)(C)C1CCC2(C[C@@H]2c2nnc(C[NH+](C)C)o2)CC1 ZINC001327043334 1053828887 /nfs/dbraw/zinc/82/88/87/1053828887.db2.gz YXOKFBBASOKYMA-TXKKKEFDSA-N 1 2 305.466 4.231 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CCCC[C@](C)(F)C2)c(OC)c1 ZINC001231694182 1053834061 /nfs/dbraw/zinc/83/40/61/1053834061.db2.gz JALKUBNJEACAML-INIZCTEOSA-N 1 2 315.816 4.071 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CCCC[C@](C)(F)C2)c(OC)c1 ZINC001231694182 1053834070 /nfs/dbraw/zinc/83/40/70/1053834070.db2.gz JALKUBNJEACAML-INIZCTEOSA-N 1 2 315.816 4.071 20 0 DIADLO CC(C)(C)c1csc([C@@H]2C[N@H+](Cc3ccccc3)CCO2)n1 ZINC000157099644 1053839815 /nfs/dbraw/zinc/83/98/15/1053839815.db2.gz YCOQRPVCKFXEHA-HNNXBMFYSA-N 1 2 316.470 4.014 20 0 DIADLO CC(C)(C)c1csc([C@@H]2C[N@@H+](Cc3ccccc3)CCO2)n1 ZINC000157099644 1053839837 /nfs/dbraw/zinc/83/98/37/1053839837.db2.gz YCOQRPVCKFXEHA-HNNXBMFYSA-N 1 2 316.470 4.014 20 0 DIADLO CC[N@H+](Cc1cc(Cl)c(OC(C)C)c(Cl)c1)C1COC1 ZINC001231730725 1053841367 /nfs/dbraw/zinc/84/13/67/1053841367.db2.gz CMPXKONAFUPFQW-UHFFFAOYSA-N 1 2 318.244 4.001 20 0 DIADLO CC[N@@H+](Cc1cc(Cl)c(OC(C)C)c(Cl)c1)C1COC1 ZINC001231730725 1053841379 /nfs/dbraw/zinc/84/13/79/1053841379.db2.gz CMPXKONAFUPFQW-UHFFFAOYSA-N 1 2 318.244 4.001 20 0 DIADLO c1ccc([C@H]2CC[N@@H+](Cc3noc(C4CCCCC4)n3)C2)cc1 ZINC000157158329 1053841923 /nfs/dbraw/zinc/84/19/23/1053841923.db2.gz AYTLKVINNSFMTA-KRWDZBQOSA-N 1 2 311.429 4.107 20 0 DIADLO c1ccc([C@H]2CC[N@H+](Cc3noc(C4CCCCC4)n3)C2)cc1 ZINC000157158329 1053841936 /nfs/dbraw/zinc/84/19/36/1053841936.db2.gz AYTLKVINNSFMTA-KRWDZBQOSA-N 1 2 311.429 4.107 20 0 DIADLO CCOc1ncccc1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001231764704 1053851449 /nfs/dbraw/zinc/85/14/49/1053851449.db2.gz IKBKECNLMOHDJE-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ncccc1C[N@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001231764704 1053851470 /nfs/dbraw/zinc/85/14/70/1053851470.db2.gz IKBKECNLMOHDJE-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000157396361 1053854671 /nfs/dbraw/zinc/85/46/71/1053854671.db2.gz FBLNVWOVMVFLCF-KRWDZBQOSA-N 1 2 317.454 4.109 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000157396361 1053854688 /nfs/dbraw/zinc/85/46/88/1053854688.db2.gz FBLNVWOVMVFLCF-KRWDZBQOSA-N 1 2 317.454 4.109 20 0 DIADLO C[C@@H]([NH2+]Cc1cn2ccccc2n1)c1cccc(Cl)c1Cl ZINC001200653564 1053855352 /nfs/dbraw/zinc/85/53/52/1053855352.db2.gz CQVKGCOURALCSH-LLVKDONJSA-N 1 2 320.223 4.492 20 0 DIADLO C[C@@H](c1ccccc1)N(C)c1nc2ccccc2n2c[nH+]cc12 ZINC001472642514 1053860505 /nfs/dbraw/zinc/86/05/05/1053860505.db2.gz SXVGFUJKPAGIRT-AWEZNQCLSA-N 1 2 302.381 4.080 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1ccc(OC(C)(C)C)cc1 ZINC001231806039 1053864312 /nfs/dbraw/zinc/86/43/12/1053864312.db2.gz YGESAXLHTQSKFM-UHFFFAOYSA-N 1 2 311.425 4.179 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1ccc(OC(C)(C)C)cc1 ZINC001231806039 1053864329 /nfs/dbraw/zinc/86/43/29/1053864329.db2.gz YGESAXLHTQSKFM-UHFFFAOYSA-N 1 2 311.425 4.179 20 0 DIADLO Cc1c[nH+]c(CCSCc2cnn(C(C)(C)C)c2)c(C)c1 ZINC001327714869 1053873137 /nfs/dbraw/zinc/87/31/37/1053873137.db2.gz RPTZWSSZVUPLMN-UHFFFAOYSA-N 1 2 303.475 4.126 20 0 DIADLO CSC1CC[NH+](Cc2cc(Cl)ncc2C(F)(F)F)CC1 ZINC001231932047 1053919665 /nfs/dbraw/zinc/91/96/65/1053919665.db2.gz UMGGQKGCJRFNPW-UHFFFAOYSA-N 1 2 324.799 4.081 20 0 DIADLO Cc1cc(N[C@@H]2CCO[C@@H](c3ccccn3)C2)[nH+]c2ccccc12 ZINC001327999465 1053901167 /nfs/dbraw/zinc/90/11/67/1053901167.db2.gz BRWLOJXFRVRMDX-DNVCBOLYSA-N 1 2 319.408 4.270 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1csc(C2CC2)n1 ZINC000158447343 1053901913 /nfs/dbraw/zinc/90/19/13/1053901913.db2.gz JSTRRKFPMQVUGA-UHFFFAOYSA-N 1 2 303.431 4.205 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1cccc(C2CC2)c1 ZINC001354540879 1053902295 /nfs/dbraw/zinc/90/22/95/1053902295.db2.gz AEZQXPCIPKIBJW-UHFFFAOYSA-N 1 2 303.365 4.002 20 0 DIADLO CCc1cc(C[NH2+]Cc2cc3cccc(C)c3nc2Cl)on1 ZINC001200704227 1053907897 /nfs/dbraw/zinc/90/78/97/1053907897.db2.gz RPXLNYUDYCYZGL-UHFFFAOYSA-N 1 2 315.804 4.037 20 0 DIADLO Brc1cccc([C@H]2CCC[N@@H+]2Cc2cncs2)c1 ZINC000158629891 1053912609 /nfs/dbraw/zinc/91/26/09/1053912609.db2.gz KUANTKCPHAYJCD-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cccc([C@H]2CCC[N@H+]2Cc2cncs2)c1 ZINC000158629891 1053912628 /nfs/dbraw/zinc/91/26/28/1053912628.db2.gz KUANTKCPHAYJCD-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1cc(NC[C@]2(C)CCCc3ccccc32)nc(C2CC2)[nH+]1 ZINC001472747936 1053920669 /nfs/dbraw/zinc/92/06/69/1053920669.db2.gz IAGIJECAJKQKHV-FQEVSTJZSA-N 1 2 307.441 4.369 20 0 DIADLO CCOCCCn1c2ccccc2[nH+]c1NCc1cccs1 ZINC000158979055 1053928995 /nfs/dbraw/zinc/92/89/95/1053928995.db2.gz KTJJWRTXJDCHCW-UHFFFAOYSA-N 1 2 315.442 4.137 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2cc(C)nc(C)c2)on1 ZINC001232003854 1053935186 /nfs/dbraw/zinc/93/51/86/1053935186.db2.gz XHXJUMSDFSXTOI-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2cc(C)nc(C)c2)on1 ZINC001232003854 1053935190 /nfs/dbraw/zinc/93/51/90/1053935190.db2.gz XHXJUMSDFSXTOI-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1nccnc1C[NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl ZINC000621325723 1053946201 /nfs/dbraw/zinc/94/62/01/1053946201.db2.gz ILDIXHIPNJMUFR-MRVPVSSYSA-N 1 2 314.191 4.082 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2nc3cc(Cl)ccc3[nH]2)ccn1 ZINC000621299998 1053946335 /nfs/dbraw/zinc/94/63/35/1053946335.db2.gz YLUVTGSQQZROHS-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1cc(C[N@H+](C)[C@@H](C)c2nc3cc(Cl)ccc3[nH]2)ccn1 ZINC000621299998 1053946352 /nfs/dbraw/zinc/94/63/52/1053946352.db2.gz YLUVTGSQQZROHS-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO CCOc1cncc(C[NH2+]Cc2c(Cl)cccc2Cl)c1 ZINC000621331529 1053948489 /nfs/dbraw/zinc/94/84/89/1053948489.db2.gz DQCHEFFCWLPCMM-UHFFFAOYSA-N 1 2 311.212 4.077 20 0 DIADLO Cc1cc(C[NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)no1 ZINC000621351592 1053951401 /nfs/dbraw/zinc/95/14/01/1053951401.db2.gz YIAOGOHSHYPGCU-UHFFFAOYSA-N 1 2 310.319 4.171 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1nc(Cl)ccc1Br ZINC001232058972 1053952500 /nfs/dbraw/zinc/95/25/00/1053952500.db2.gz ZHIFGHWFLCFQKE-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO CCC1CC[NH+](Cc2nc(Cl)ccc2Br)CC1 ZINC001232056705 1053953180 /nfs/dbraw/zinc/95/31/80/1053953180.db2.gz CEPQXQFNOSWNPL-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO Cc1nnc(C[N@H+](Cc2cccc(Cl)c2)CC(C)C)s1 ZINC000621386234 1053963080 /nfs/dbraw/zinc/96/30/80/1053963080.db2.gz BUDYJJFMZVNWJU-UHFFFAOYSA-N 1 2 309.866 4.158 20 0 DIADLO Cc1nnc(C[N@@H+](Cc2cccc(Cl)c2)CC(C)C)s1 ZINC000621386234 1053963093 /nfs/dbraw/zinc/96/30/93/1053963093.db2.gz BUDYJJFMZVNWJU-UHFFFAOYSA-N 1 2 309.866 4.158 20 0 DIADLO CC[C@@H]1CO[C@](C)(CCC(C)C)[N@@H+]1Cc1cn(C)nc1C1CC1 ZINC001232175018 1053979709 /nfs/dbraw/zinc/97/97/09/1053979709.db2.gz SBQNSJKUVHOHIH-IEBWSBKVSA-N 1 2 319.493 4.061 20 0 DIADLO CC[C@@H]1CO[C@](C)(CCC(C)C)[N@H+]1Cc1cn(C)nc1C1CC1 ZINC001232175018 1053979721 /nfs/dbraw/zinc/97/97/21/1053979721.db2.gz SBQNSJKUVHOHIH-IEBWSBKVSA-N 1 2 319.493 4.061 20 0 DIADLO Cc1scnc1C[NH+]1CCC(Oc2ccccc2Cl)CC1 ZINC001232204112 1053986495 /nfs/dbraw/zinc/98/64/95/1053986495.db2.gz RJPVGCPUVRXHGT-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001329521156 1053992893 /nfs/dbraw/zinc/99/28/93/1053992893.db2.gz GRYZFGGJBDJLDU-GXTWGEPZSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001329521156 1053992915 /nfs/dbraw/zinc/99/29/15/1053992915.db2.gz GRYZFGGJBDJLDU-GXTWGEPZSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001329521161 1053993448 /nfs/dbraw/zinc/99/34/48/1053993448.db2.gz GRYZFGGJBDJLDU-OCCSQVGLSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001329521161 1053993456 /nfs/dbraw/zinc/99/34/56/1053993456.db2.gz GRYZFGGJBDJLDU-OCCSQVGLSA-N 1 2 323.362 4.240 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccnc(C(C)(C)C)c1)CC2 ZINC001232220891 1053996740 /nfs/dbraw/zinc/99/67/40/1053996740.db2.gz SDIKLZBLXXETRC-UHFFFAOYSA-N 1 2 322.452 4.140 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1ccnc(C(C)(C)C)c1)CC2 ZINC001232220891 1053996750 /nfs/dbraw/zinc/99/67/50/1053996750.db2.gz SDIKLZBLXXETRC-UHFFFAOYSA-N 1 2 322.452 4.140 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccnc(C(F)(F)F)c2)Cc2ccccc21 ZINC001232236823 1053998735 /nfs/dbraw/zinc/99/87/35/1053998735.db2.gz JVIOZXRCAUPHFM-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccnc(C(F)(F)F)c2)Cc2ccccc21 ZINC001232236823 1053998748 /nfs/dbraw/zinc/99/87/48/1053998748.db2.gz JVIOZXRCAUPHFM-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCCC[C@@H]2c2nc(C)no2)s1 ZINC000621727474 1054001678 /nfs/dbraw/zinc/00/16/78/1054001678.db2.gz DTYKHZQKEKKIQC-OAHLLOKOSA-N 1 2 305.447 4.119 20 0 DIADLO CCCc1ccc(C[N@H+]2CCCC[C@@H]2c2nc(C)no2)s1 ZINC000621727474 1054001687 /nfs/dbraw/zinc/00/16/87/1054001687.db2.gz DTYKHZQKEKKIQC-OAHLLOKOSA-N 1 2 305.447 4.119 20 0 DIADLO CC[C@@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)C(C)(C)C ZINC001354918624 1054003371 /nfs/dbraw/zinc/00/33/71/1054003371.db2.gz NPJZIRUWOBKEBT-ZDUSSCGKSA-N 1 2 317.408 4.412 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](c2ccc(F)cc2F)C2CC2)s1 ZINC001200819539 1054005658 /nfs/dbraw/zinc/00/56/58/1054005658.db2.gz BVWKWDOJLJLXPC-MRXNPFEDSA-N 1 2 308.397 4.225 20 0 DIADLO Cc1ccc([C@]2(C)C[N@H+](Cc3cc(Cl)cs3)CCO2)cc1 ZINC001232280387 1054013072 /nfs/dbraw/zinc/01/30/72/1054013072.db2.gz NMRQSCBOVNYXCC-KRWDZBQOSA-N 1 2 321.873 4.458 20 0 DIADLO Cc1ccc([C@]2(C)C[N@@H+](Cc3cc(Cl)cs3)CCO2)cc1 ZINC001232280387 1054013083 /nfs/dbraw/zinc/01/30/83/1054013083.db2.gz NMRQSCBOVNYXCC-KRWDZBQOSA-N 1 2 321.873 4.458 20 0 DIADLO Cc1ccc([C@@]2(C)C[N@H+](Cc3cc(Cl)cs3)CCO2)cc1 ZINC001232280388 1054013149 /nfs/dbraw/zinc/01/31/49/1054013149.db2.gz NMRQSCBOVNYXCC-QGZVFWFLSA-N 1 2 321.873 4.458 20 0 DIADLO Cc1ccc([C@@]2(C)C[N@@H+](Cc3cc(Cl)cs3)CCO2)cc1 ZINC001232280388 1054013162 /nfs/dbraw/zinc/01/31/62/1054013162.db2.gz NMRQSCBOVNYXCC-QGZVFWFLSA-N 1 2 321.873 4.458 20 0 DIADLO CCOc1ncc(C[N@H+](C)Cc2ccccc2Cl)cc1C ZINC001232308973 1054017775 /nfs/dbraw/zinc/01/77/75/1054017775.db2.gz MOASOODBRNSWPJ-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCOc1ncc(C[N@@H+](C)Cc2ccccc2Cl)cc1C ZINC001232308973 1054017780 /nfs/dbraw/zinc/01/77/80/1054017780.db2.gz MOASOODBRNSWPJ-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CSc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)cn1 ZINC001232329957 1054023172 /nfs/dbraw/zinc/02/31/72/1054023172.db2.gz JJXLGOPHLGRFKH-MRXNPFEDSA-N 1 2 320.408 4.419 20 0 DIADLO CSc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)cn1 ZINC001232329957 1054023184 /nfs/dbraw/zinc/02/31/84/1054023184.db2.gz JJXLGOPHLGRFKH-MRXNPFEDSA-N 1 2 320.408 4.419 20 0 DIADLO CSc1cc(C)c(C[N@@H+]2CCc3ccc(Cl)cc3C2)cn1 ZINC001232343085 1054024514 /nfs/dbraw/zinc/02/45/14/1054024514.db2.gz WCMGZUKIRIVENH-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CSc1cc(C)c(C[N@H+]2CCc3ccc(Cl)cc3C2)cn1 ZINC001232343085 1054024527 /nfs/dbraw/zinc/02/45/27/1054024527.db2.gz WCMGZUKIRIVENH-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCSc3ccccc3C2)o1 ZINC001232446175 1054045237 /nfs/dbraw/zinc/04/52/37/1054045237.db2.gz IQUDXDGMLGRSBN-UHFFFAOYSA-N 1 2 313.344 4.406 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCSc3ccccc3C2)o1 ZINC001232446175 1054045254 /nfs/dbraw/zinc/04/52/54/1054045254.db2.gz IQUDXDGMLGRSBN-UHFFFAOYSA-N 1 2 313.344 4.406 20 0 DIADLO Cc1cc(Br)c(C[N@@H+]2C[C@@H](C)C[C@H]2CF)cc1F ZINC001232466654 1054049961 /nfs/dbraw/zinc/04/99/61/1054049961.db2.gz QFTNOHCKOLLKFY-CABZTGNLSA-N 1 2 318.205 4.077 20 0 DIADLO Cc1cc(Br)c(C[N@H+]2C[C@@H](C)C[C@H]2CF)cc1F ZINC001232466654 1054049969 /nfs/dbraw/zinc/04/99/69/1054049969.db2.gz QFTNOHCKOLLKFY-CABZTGNLSA-N 1 2 318.205 4.077 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)c[nH]1 ZINC001232463259 1054051045 /nfs/dbraw/zinc/05/10/45/1054051045.db2.gz FXODLTBHWIDXHL-GFCCVEGCSA-N 1 2 310.228 4.014 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)c[nH]1 ZINC001232463259 1054051054 /nfs/dbraw/zinc/05/10/54/1054051054.db2.gz FXODLTBHWIDXHL-GFCCVEGCSA-N 1 2 310.228 4.014 20 0 DIADLO Cc1[nH]c(CN2[C@@H]3Cc4ccccc4[C@@]2(C)c2ccccc23)c[nH+]1 ZINC001232464997 1054051395 /nfs/dbraw/zinc/05/13/95/1054051395.db2.gz PRPFUHHHGZVNLF-RTWAWAEBSA-N 1 2 315.420 4.095 20 0 DIADLO Cc1cc(NCc2cccc(-c3ccccn3)c2)nc(C2CC2)[nH+]1 ZINC000164249625 1054052720 /nfs/dbraw/zinc/05/27/20/1054052720.db2.gz YDRNTCWXCRLHPG-UHFFFAOYSA-N 1 2 316.408 4.337 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1cnc(C2CC2)o1 ZINC001331287842 1054068387 /nfs/dbraw/zinc/06/83/87/1054068387.db2.gz CEGKFIBTNNQILC-UHFFFAOYSA-N 1 2 310.401 4.269 20 0 DIADLO CCCC[C@H](C)C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001355164388 1054071256 /nfs/dbraw/zinc/07/12/56/1054071256.db2.gz XFWOLKSAZGZDEE-HOTGVXAUSA-N 1 2 319.493 4.170 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2cc(C)ccc2OC)o1 ZINC000165253214 1054074779 /nfs/dbraw/zinc/07/47/79/1054074779.db2.gz HODBNSMCYKIUAQ-RHSMWYFYSA-N 1 2 317.429 4.197 20 0 DIADLO CCOc1ccnc(C[N@H+](C)[C@H](C)c2ccccc2Cl)c1 ZINC001232587707 1054075286 /nfs/dbraw/zinc/07/52/86/1054075286.db2.gz LCUDYHYOQHQYDB-CYBMUJFWSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1ccnc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)c1 ZINC001232587707 1054075303 /nfs/dbraw/zinc/07/53/03/1054075303.db2.gz LCUDYHYOQHQYDB-CYBMUJFWSA-N 1 2 304.821 4.327 20 0 DIADLO CCC(CC)[N@H+](CC)Cc1cc(F)c(O)c(Br)c1 ZINC001232635078 1054092054 /nfs/dbraw/zinc/09/20/54/1054092054.db2.gz LBKZDASLVYUDMV-UHFFFAOYSA-N 1 2 318.230 4.304 20 0 DIADLO CCC(CC)[N@@H+](CC)Cc1cc(F)c(O)c(Br)c1 ZINC001232635078 1054092066 /nfs/dbraw/zinc/09/20/66/1054092066.db2.gz LBKZDASLVYUDMV-UHFFFAOYSA-N 1 2 318.230 4.304 20 0 DIADLO FC(F)(F)c1cc(C[NH+]2CCCCC2)ccc1Br ZINC001232659503 1054096038 /nfs/dbraw/zinc/09/60/38/1054096038.db2.gz VADNEVROGDAWMW-UHFFFAOYSA-N 1 2 322.168 4.454 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@H]2c2cccs2)[nH]1 ZINC001232690173 1054101405 /nfs/dbraw/zinc/10/14/05/1054101405.db2.gz WUFOFHBIBJOWGR-NSHDSACASA-N 1 2 311.248 4.176 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cnc(Cl)cc1Br ZINC001232680672 1054099679 /nfs/dbraw/zinc/09/96/79/1054099679.db2.gz GFBJTBBGTTYQMO-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cnc(Cl)cc1Br ZINC001232680672 1054099691 /nfs/dbraw/zinc/09/96/91/1054099691.db2.gz GFBJTBBGTTYQMO-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@H]2c2cccs2)[nH]1 ZINC001232690173 1054101418 /nfs/dbraw/zinc/10/14/18/1054101418.db2.gz WUFOFHBIBJOWGR-NSHDSACASA-N 1 2 311.248 4.176 20 0 DIADLO Cc1cc(CSCc2ccc(-n3cc[nH+]c3)cc2C)c(C)nn1 ZINC001331952542 1054101724 /nfs/dbraw/zinc/10/17/24/1054101724.db2.gz RDPLOSJKZBAWAB-UHFFFAOYSA-N 1 2 324.453 4.021 20 0 DIADLO Fc1ccc(Cl)c(Br)c1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC001232694625 1054102819 /nfs/dbraw/zinc/10/28/19/1054102819.db2.gz PVPUQYJCJLJCTR-DTWKUNHWSA-N 1 2 318.617 4.226 20 0 DIADLO Fc1ccc(Cl)c(Br)c1C[N@H+]1C[C@H]2CC[C@@H]1C2 ZINC001232694625 1054102823 /nfs/dbraw/zinc/10/28/23/1054102823.db2.gz PVPUQYJCJLJCTR-DTWKUNHWSA-N 1 2 318.617 4.226 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2cccnc21)c1nc(C(C)(C)C)cs1 ZINC001331959930 1054103799 /nfs/dbraw/zinc/10/37/99/1054103799.db2.gz MCDVMYGUXYBKBB-YPMHNXCESA-N 1 2 301.459 4.174 20 0 DIADLO Fc1cc(C[N@H+]2C[C@H]3[C@H](CC3(F)F)C2)c(Cl)cc1Cl ZINC001232702721 1054105222 /nfs/dbraw/zinc/10/52/22/1054105222.db2.gz PHXRKCGKBZTPFP-BDAKNGLRSA-N 1 2 310.146 4.220 20 0 DIADLO Fc1cc(C[N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)c(Cl)cc1Cl ZINC001232702721 1054105225 /nfs/dbraw/zinc/10/52/25/1054105225.db2.gz PHXRKCGKBZTPFP-BDAKNGLRSA-N 1 2 310.146 4.220 20 0 DIADLO Cc1ncccc1C[N@@H+](C)Cc1cc(F)c(Cl)cc1Cl ZINC001232703056 1054105242 /nfs/dbraw/zinc/10/52/42/1054105242.db2.gz MPUWWXSETZBEND-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1ncccc1C[N@H+](C)Cc1cc(F)c(Cl)cc1Cl ZINC001232703056 1054105249 /nfs/dbraw/zinc/10/52/49/1054105249.db2.gz MPUWWXSETZBEND-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1nc2c(s1)C[N@H+](Cc1cc3ccc(Cl)cc3[nH]1)CC2 ZINC001232729151 1054107999 /nfs/dbraw/zinc/10/79/99/1054107999.db2.gz CRFLQZJRGOENED-UHFFFAOYSA-N 1 2 317.845 4.145 20 0 DIADLO Cc1nc2c(s1)C[N@@H+](Cc1cc3ccc(Cl)cc3[nH]1)CC2 ZINC001232729151 1054108009 /nfs/dbraw/zinc/10/80/09/1054108009.db2.gz CRFLQZJRGOENED-UHFFFAOYSA-N 1 2 317.845 4.145 20 0 DIADLO c1csc([C@H]2CCC[N@H+]2Cc2ccc3ncsc3c2)n1 ZINC001232742965 1054112565 /nfs/dbraw/zinc/11/25/65/1054112565.db2.gz JBCDOXJNJNUKSI-CYBMUJFWSA-N 1 2 301.440 4.090 20 0 DIADLO c1csc([C@H]2CCC[N@@H+]2Cc2ccc3ncsc3c2)n1 ZINC001232742965 1054112570 /nfs/dbraw/zinc/11/25/70/1054112570.db2.gz JBCDOXJNJNUKSI-CYBMUJFWSA-N 1 2 301.440 4.090 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccc3ncsc3c1)CC2 ZINC001232743082 1054113463 /nfs/dbraw/zinc/11/34/63/1054113463.db2.gz KRXWPNQOMSJDGV-UHFFFAOYSA-N 1 2 322.433 4.057 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1ccc3ncsc3c1)CC2 ZINC001232743082 1054113472 /nfs/dbraw/zinc/11/34/72/1054113472.db2.gz KRXWPNQOMSJDGV-UHFFFAOYSA-N 1 2 322.433 4.057 20 0 DIADLO CC1(CC(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)CCCCC1 ZINC001355349519 1054115646 /nfs/dbraw/zinc/11/56/46/1054115646.db2.gz UPNDRKWRIFABRM-UHFFFAOYSA-N 1 2 315.392 4.310 20 0 DIADLO CC(C)Cn1nccc1C[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC001332325286 1054115806 /nfs/dbraw/zinc/11/58/06/1054115806.db2.gz OPOIGPDNMZIZKC-ZDUSSCGKSA-N 1 2 320.506 4.144 20 0 DIADLO CCCn1cnc(C[N@@H+]2CCCC[C@H]2c2ccccc2F)c1 ZINC001232799113 1054121453 /nfs/dbraw/zinc/12/14/53/1054121453.db2.gz VZNUXJMLYNTEKT-SFHVURJKSA-N 1 2 301.409 4.159 20 0 DIADLO CCCn1cnc(C[N@H+]2CCCC[C@H]2c2ccccc2F)c1 ZINC001232799113 1054121455 /nfs/dbraw/zinc/12/14/55/1054121455.db2.gz VZNUXJMLYNTEKT-SFHVURJKSA-N 1 2 301.409 4.159 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc(O)c2Cl)cn1 ZINC001232788758 1054121485 /nfs/dbraw/zinc/12/14/85/1054121485.db2.gz MNTLUXHZSKDIRU-HNNXBMFYSA-N 1 2 302.805 4.086 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cccc(O)c2Cl)cn1 ZINC001232788758 1054121487 /nfs/dbraw/zinc/12/14/87/1054121487.db2.gz MNTLUXHZSKDIRU-HNNXBMFYSA-N 1 2 302.805 4.086 20 0 DIADLO Clc1cc(Cl)c(C[NH+]2C[C@@H]3CCC[C@H]3C2)c(Cl)n1 ZINC001232847074 1054131034 /nfs/dbraw/zinc/13/10/34/1054131034.db2.gz SHBFGMBBUVTJFV-IUCAKERBSA-N 1 2 305.636 4.274 20 0 DIADLO Cc1cc(O)cc(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)c1 ZINC001232885917 1054142230 /nfs/dbraw/zinc/14/22/30/1054142230.db2.gz OBZCXENNNNDDLZ-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO Cc1cc(O)cc(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)c1 ZINC001232885917 1054142239 /nfs/dbraw/zinc/14/22/39/1054142239.db2.gz OBZCXENNNNDDLZ-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc(F)c(O)c1F ZINC001232933558 1054150129 /nfs/dbraw/zinc/15/01/29/1054150129.db2.gz LCABXTIMMDWIJJ-INIZCTEOSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ccc(F)c(O)c2F)C2CC2)c1C ZINC001232940357 1054152103 /nfs/dbraw/zinc/15/21/03/1054152103.db2.gz OPXMSPJDWJOEJX-UHFFFAOYSA-N 1 2 317.379 4.452 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ccc(F)c(O)c2F)C2CC2)c1C ZINC001232940357 1054152107 /nfs/dbraw/zinc/15/21/07/1054152107.db2.gz OPXMSPJDWJOEJX-UHFFFAOYSA-N 1 2 317.379 4.452 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2cc(Cl)cc3c2OCC3)c(C)s1 ZINC001333381591 1054152256 /nfs/dbraw/zinc/15/22/56/1054152256.db2.gz UQIFBRPZWXSTDW-SECBINFHSA-N 1 2 322.861 4.199 20 0 DIADLO Oc1c(F)ccc(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c1F ZINC001232938007 1054154149 /nfs/dbraw/zinc/15/41/49/1054154149.db2.gz XTFUTQWNZNHJBZ-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1c(F)ccc(C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c1F ZINC001232938007 1054154159 /nfs/dbraw/zinc/15/41/59/1054154159.db2.gz XTFUTQWNZNHJBZ-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)nc1)c1nc(C(F)(F)F)cs1 ZINC001333495799 1054156333 /nfs/dbraw/zinc/15/63/33/1054156333.db2.gz FHMWIUUMMKUPLD-JGVFFNPUSA-N 1 2 319.327 4.108 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cc(Cl)cnc2Br)[C@@H]1C ZINC001232961572 1054159729 /nfs/dbraw/zinc/15/97/29/1054159729.db2.gz PTMIZSUACNZBMY-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cc(Cl)cnc2Br)[C@@H]1C ZINC001232961572 1054159736 /nfs/dbraw/zinc/15/97/36/1054159736.db2.gz PTMIZSUACNZBMY-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1cc(Cl)cnc1Br ZINC001232960562 1054160331 /nfs/dbraw/zinc/16/03/31/1054160331.db2.gz ZQQBOZCMUWWCQK-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO Oc1cc(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)cc(F)c1F ZINC001232973126 1054162210 /nfs/dbraw/zinc/16/22/10/1054162210.db2.gz NWZQECLVXKSTQW-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(C[N@H+]2CC[C@@H](c3ccccc3Cl)C2)cc(F)c1F ZINC001232973126 1054162221 /nfs/dbraw/zinc/16/22/21/1054162221.db2.gz NWZQECLVXKSTQW-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232972333 1054162997 /nfs/dbraw/zinc/16/29/97/1054162997.db2.gz NAUHMYVXSPANFU-INIZCTEOSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232972333 1054163001 /nfs/dbraw/zinc/16/30/01/1054163001.db2.gz NAUHMYVXSPANFU-INIZCTEOSA-N 1 2 303.352 4.316 20 0 DIADLO Oc1cc(C[N@@H+]2CCCC[C@H]2c2ccccc2)cc(F)c1F ZINC001232970046 1054163068 /nfs/dbraw/zinc/16/30/68/1054163068.db2.gz GWZUSUZGKXZGEI-INIZCTEOSA-N 1 2 303.352 4.398 20 0 DIADLO Oc1cc(C[N@H+]2CCCC[C@H]2c2ccccc2)cc(F)c1F ZINC001232970046 1054163070 /nfs/dbraw/zinc/16/30/70/1054163070.db2.gz GWZUSUZGKXZGEI-INIZCTEOSA-N 1 2 303.352 4.398 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232975194 1054163573 /nfs/dbraw/zinc/16/35/73/1054163573.db2.gz GHXMRHUDMZQLCJ-MRXNPFEDSA-N 1 2 303.352 4.180 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232975194 1054163584 /nfs/dbraw/zinc/16/35/84/1054163584.db2.gz GHXMRHUDMZQLCJ-MRXNPFEDSA-N 1 2 303.352 4.180 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc(O)c(F)c(F)c2)c1 ZINC001232968273 1054163976 /nfs/dbraw/zinc/16/39/76/1054163976.db2.gz GNPFHUMIYHKXRU-MRXNPFEDSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2cc(O)c(F)c(F)c2)c1 ZINC001232968273 1054163985 /nfs/dbraw/zinc/16/39/85/1054163985.db2.gz GNPFHUMIYHKXRU-MRXNPFEDSA-N 1 2 303.352 4.316 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(Cl)c(Br)n2)[C@H](C)C1 ZINC001233092745 1054185187 /nfs/dbraw/zinc/18/51/87/1054185187.db2.gz VNDFUNSHPCEPJQ-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)c(Br)n2)[C@H](C)C1 ZINC001233092745 1054185192 /nfs/dbraw/zinc/18/51/92/1054185192.db2.gz VNDFUNSHPCEPJQ-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[N@H+](Cc1cc(Cl)cc(Cl)c1)Cc1cccc(O)c1F ZINC001233055015 1054177191 /nfs/dbraw/zinc/17/71/91/1054177191.db2.gz JIPQASUKVJCBQJ-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO C[N@@H+](Cc1cc(Cl)cc(Cl)c1)Cc1cccc(O)c1F ZINC001233055015 1054177202 /nfs/dbraw/zinc/17/72/02/1054177202.db2.gz JIPQASUKVJCBQJ-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO Cc1nc(C[N@@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@@H]2C)c(C)s1 ZINC001333926335 1054178236 /nfs/dbraw/zinc/17/82/36/1054178236.db2.gz LICHJMRIEULIRG-VBHSOAQHSA-N 1 2 316.470 4.110 20 0 DIADLO Cc1nc(C[N@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@@H]2C)c(C)s1 ZINC001333926335 1054178246 /nfs/dbraw/zinc/17/82/46/1054178246.db2.gz LICHJMRIEULIRG-VBHSOAQHSA-N 1 2 316.470 4.110 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1ccc(Cl)c(Br)n1 ZINC001233090010 1054184088 /nfs/dbraw/zinc/18/40/88/1054184088.db2.gz DOALFCRXWUYFKG-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO CCCCC[C@@H](C(=O)NC[C@H]1c2ccccc2C[N@H+]1C)C(C)C ZINC001438571634 1054190960 /nfs/dbraw/zinc/19/09/60/1054190960.db2.gz IQMDUXYMQJEUAQ-MJGOQNOKSA-N 1 2 316.489 4.142 20 0 DIADLO CCCCC[C@@H](C(=O)NC[C@H]1c2ccccc2C[N@@H+]1C)C(C)C ZINC001438571634 1054190967 /nfs/dbraw/zinc/19/09/67/1054190967.db2.gz IQMDUXYMQJEUAQ-MJGOQNOKSA-N 1 2 316.489 4.142 20 0 DIADLO Cc1nc(C[N@H+](C)CC2CCCCC2)c(Br)s1 ZINC001233159919 1054191247 /nfs/dbraw/zinc/19/12/47/1054191247.db2.gz QCSABWJOOXEJGU-UHFFFAOYSA-N 1 2 317.296 4.226 20 0 DIADLO Cc1nc(C[N@@H+](C)CC2CCCCC2)c(Br)s1 ZINC001233159919 1054191250 /nfs/dbraw/zinc/19/12/50/1054191250.db2.gz QCSABWJOOXEJGU-UHFFFAOYSA-N 1 2 317.296 4.226 20 0 DIADLO Cc1ccc(C)c2nc(Cl)c(C[NH+]3CC4(CSC4)C3)cc12 ZINC001233135784 1054191509 /nfs/dbraw/zinc/19/15/09/1054191509.db2.gz FEESJYMBYVXMDR-UHFFFAOYSA-N 1 2 318.873 4.054 20 0 DIADLO CC(C)OC1CC[NH+](Cc2ccc(Cl)c(F)c2F)CC1 ZINC001233210770 1054200704 /nfs/dbraw/zinc/20/07/04/1054200704.db2.gz MEEKWXKDYMILDT-UHFFFAOYSA-N 1 2 303.780 4.008 20 0 DIADLO CCCOC1CC[NH+](Cc2ccc(Cl)c(F)c2F)CC1 ZINC001233210945 1054202138 /nfs/dbraw/zinc/20/21/38/1054202138.db2.gz NOVMZPNSZPOOPR-UHFFFAOYSA-N 1 2 303.780 4.009 20 0 DIADLO Fc1ccc(-c2nc(C[N@H+]3CCCC[C@@H](F)C3)cs2)cc1 ZINC001233240747 1054212954 /nfs/dbraw/zinc/21/29/54/1054212954.db2.gz PAXMMMPOMADURE-CQSZACIVSA-N 1 2 308.397 4.273 20 0 DIADLO Fc1ccc(-c2nc(C[N@@H+]3CCCC[C@@H](F)C3)cs2)cc1 ZINC001233240747 1054212963 /nfs/dbraw/zinc/21/29/63/1054212963.db2.gz PAXMMMPOMADURE-CQSZACIVSA-N 1 2 308.397 4.273 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001335315069 1054214440 /nfs/dbraw/zinc/21/44/40/1054214440.db2.gz POJAPDADDMNRBT-LJQANCHMSA-N 1 2 320.440 4.142 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001335315069 1054214448 /nfs/dbraw/zinc/21/44/48/1054214448.db2.gz POJAPDADDMNRBT-LJQANCHMSA-N 1 2 320.440 4.142 20 0 DIADLO Fc1ccc(C[NH+]2CC(C(F)F)C2)c(OCc2ccccc2)c1 ZINC001233245650 1054216440 /nfs/dbraw/zinc/21/64/40/1054216440.db2.gz FAKVFALUKCBIJM-UHFFFAOYSA-N 1 2 321.342 4.102 20 0 DIADLO CC(C)([NH2+]Cc1csc(C(F)(F)F)n1)c1ccc(F)cc1 ZINC001335519273 1054219375 /nfs/dbraw/zinc/21/93/75/1054219375.db2.gz LKNWMSMGKPOMNH-UHFFFAOYSA-N 1 2 318.339 4.326 20 0 DIADLO c1ccc(Cc2ccc(C[N@@H+]3Cc4cccnc4C3)cc2)cc1 ZINC001233330172 1054233957 /nfs/dbraw/zinc/23/39/57/1054233957.db2.gz YIDRAJISUIKNMJ-UHFFFAOYSA-N 1 2 300.405 4.188 20 0 DIADLO c1ccc(Cc2ccc(C[N@H+]3Cc4cccnc4C3)cc2)cc1 ZINC001233330172 1054233974 /nfs/dbraw/zinc/23/39/74/1054233974.db2.gz YIDRAJISUIKNMJ-UHFFFAOYSA-N 1 2 300.405 4.188 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccccc2F)cc1F ZINC001233343283 1054238313 /nfs/dbraw/zinc/23/83/13/1054238313.db2.gz GXBADUFQQWBWMM-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@H]2c2ccccc2F)cc1F ZINC001233343283 1054238319 /nfs/dbraw/zinc/23/83/19/1054238319.db2.gz GXBADUFQQWBWMM-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+]1CCc2ncccc2C1 ZINC001233352356 1054244467 /nfs/dbraw/zinc/24/44/67/1054244467.db2.gz AQSCETUFZHRUSF-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+]1CCc2ncccc2C1 ZINC001233352356 1054244486 /nfs/dbraw/zinc/24/44/86/1054244486.db2.gz AQSCETUFZHRUSF-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CCO[P@@](C)(=O)CC[C@H](C)Nc1[nH+]cccc1OC(C)C ZINC001336741770 1054244830 /nfs/dbraw/zinc/24/48/30/1054244830.db2.gz CKOTZTXAIBAEFJ-YEJXKQKISA-N 1 2 314.366 4.004 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+](C)Cc1ccc(C)nc1 ZINC001233352997 1054247811 /nfs/dbraw/zinc/24/78/11/1054247811.db2.gz BVYXOLJQGSZSEH-UHFFFAOYSA-N 1 2 306.862 4.397 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+](C)Cc1ccc(C)nc1 ZINC001233352997 1054247818 /nfs/dbraw/zinc/24/78/18/1054247818.db2.gz BVYXOLJQGSZSEH-UHFFFAOYSA-N 1 2 306.862 4.397 20 0 DIADLO Cc1cc(NCc2cnccc2C(F)(F)F)nc(C2CCC2)[nH+]1 ZINC001336826592 1054249154 /nfs/dbraw/zinc/24/91/54/1054249154.db2.gz UOMIUQLRYDINLQ-UHFFFAOYSA-N 1 2 322.334 4.078 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+](C)Cc1cccnc1C ZINC001233353149 1054250330 /nfs/dbraw/zinc/25/03/30/1054250330.db2.gz IRBJHHIBCKVETM-UHFFFAOYSA-N 1 2 306.862 4.397 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+](C)Cc1cccnc1C ZINC001233353149 1054250339 /nfs/dbraw/zinc/25/03/39/1054250339.db2.gz IRBJHHIBCKVETM-UHFFFAOYSA-N 1 2 306.862 4.397 20 0 DIADLO Nc1ccc(C[N@@H+]2CCc3cccc(Cl)c3C2)c(Cl)c1 ZINC001233376914 1054253227 /nfs/dbraw/zinc/25/32/27/1054253227.db2.gz GLZFVKXVLBGUEY-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1ccc(C[N@H+]2CCc3cccc(Cl)c3C2)c(Cl)c1 ZINC001233376914 1054253241 /nfs/dbraw/zinc/25/32/41/1054253241.db2.gz GLZFVKXVLBGUEY-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO COc1ccc(C[N@H+](C)C/C=C/c2ccccc2)c(Cl)c1O ZINC001233400948 1054258950 /nfs/dbraw/zinc/25/89/50/1054258950.db2.gz GAHQDZYKCNIOIM-RMKNXTFCSA-N 1 2 317.816 4.199 20 0 DIADLO C[N@H+](Cc1c(Cl)ncnc1Cl)C(C)(C)Cc1ccccc1 ZINC001233410920 1054262934 /nfs/dbraw/zinc/26/29/34/1054262934.db2.gz HJFHWARWSLSADW-UHFFFAOYSA-N 1 2 324.255 4.237 20 0 DIADLO C[N@@H+](Cc1c(Cl)ncnc1Cl)C(C)(C)Cc1ccccc1 ZINC001233410920 1054262943 /nfs/dbraw/zinc/26/29/43/1054262943.db2.gz HJFHWARWSLSADW-UHFFFAOYSA-N 1 2 324.255 4.237 20 0 DIADLO COc1ccc(C[N@@H+]2Cc3ccccc3C[C@H]2C)c(Cl)c1O ZINC001233401326 1054264629 /nfs/dbraw/zinc/26/46/29/1054264629.db2.gz VQNXWIGKGUBTTR-GFCCVEGCSA-N 1 2 317.816 4.001 20 0 DIADLO COc1ccc(C[N@H+]2Cc3ccccc3C[C@H]2C)c(Cl)c1O ZINC001233401326 1054264635 /nfs/dbraw/zinc/26/46/35/1054264635.db2.gz VQNXWIGKGUBTTR-GFCCVEGCSA-N 1 2 317.816 4.001 20 0 DIADLO Cc1nc(Cl)c(C[N@H+]2CCCC[C@H]2C)cc1Br ZINC001233465158 1054279231 /nfs/dbraw/zinc/27/92/31/1054279231.db2.gz WTZWXROWGWOBAC-SECBINFHSA-N 1 2 317.658 4.180 20 0 DIADLO Cc1nc(Cl)c(C[N@@H+]2CCCC[C@H]2C)cc1Br ZINC001233465158 1054279242 /nfs/dbraw/zinc/27/92/42/1054279242.db2.gz WTZWXROWGWOBAC-SECBINFHSA-N 1 2 317.658 4.180 20 0 DIADLO Cc1cc(C)c(C(=O)NC(C2CCCC2)C2CCCC2)c(C)[nH+]1 ZINC001439544045 1054280801 /nfs/dbraw/zinc/28/08/01/1054280801.db2.gz HHHDIGYTEGOPIC-UHFFFAOYSA-N 1 2 314.473 4.486 20 0 DIADLO O=C(c1cccs1)C1CCN(c2[nH+]ccc3ccccc32)CC1 ZINC001337665464 1054280723 /nfs/dbraw/zinc/28/07/23/1054280723.db2.gz RFVYYVPRQOKVKC-UHFFFAOYSA-N 1 2 322.433 4.396 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2ccsc2Br)C1 ZINC001233479098 1054281215 /nfs/dbraw/zinc/28/12/15/1054281215.db2.gz JOZOSOUFJLLDAV-GFCCVEGCSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2ccsc2Br)C1 ZINC001233479098 1054281227 /nfs/dbraw/zinc/28/12/27/1054281227.db2.gz JOZOSOUFJLLDAV-GFCCVEGCSA-N 1 2 306.244 4.225 20 0 DIADLO CCc1ncc(CNc2[nH+]c3ccccc3n2C(C)(C)C)s1 ZINC001338664043 1054312632 /nfs/dbraw/zinc/31/26/32/1054312632.db2.gz FWAUREAXZGFONJ-UHFFFAOYSA-N 1 2 314.458 4.422 20 0 DIADLO O=C(CC1CCCCCC1)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001356295387 1054315407 /nfs/dbraw/zinc/31/54/07/1054315407.db2.gz BLKISKGJMHFDNO-UHFFFAOYSA-N 1 2 315.392 4.310 20 0 DIADLO CC1(C)CCC[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001356317020 1054317740 /nfs/dbraw/zinc/31/77/40/1054317740.db2.gz NCFFPYFMYCMNQU-CYBMUJFWSA-N 1 2 317.820 4.291 20 0 DIADLO CC[C@H](C)CCC(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001339299770 1054333752 /nfs/dbraw/zinc/33/37/52/1054333752.db2.gz FVPUZHIQCDYNHW-JKSUJKDBSA-N 1 2 319.493 4.170 20 0 DIADLO Cc1ccccc1[C@H]1CN(c2cc(C)c3ccccc3[nH+]2)CCO1 ZINC001339512054 1054339810 /nfs/dbraw/zinc/33/98/10/1054339810.db2.gz JQXIXNKJHSXEDZ-HXUWFJFHSA-N 1 2 318.420 4.430 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2cccs2)no1)c1cccc(Cl)c1 ZINC000171117147 1054346493 /nfs/dbraw/zinc/34/64/93/1054346493.db2.gz CXLKERFTGQYTNB-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO CC[N@@H+]1CC[C@H]1C(=O)Nc1ccc(-c2cc3ccccc3o2)cc1 ZINC001440870609 1054371080 /nfs/dbraw/zinc/37/10/80/1054371080.db2.gz QRQSTXSJNKKOIM-KRWDZBQOSA-N 1 2 320.392 4.133 20 0 DIADLO CC[N@H+]1CC[C@H]1C(=O)Nc1ccc(-c2cc3ccccc3o2)cc1 ZINC001440870609 1054371088 /nfs/dbraw/zinc/37/10/88/1054371088.db2.gz QRQSTXSJNKKOIM-KRWDZBQOSA-N 1 2 320.392 4.133 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)c(C)[nH+]1 ZINC000622776479 1054379604 /nfs/dbraw/zinc/37/96/04/1054379604.db2.gz IQAKMLMRLPRQCG-ZWKOTPCHSA-N 1 2 308.425 4.366 20 0 DIADLO Cc1cccc(C)c1Oc1ccccc1NC(=O)Cc1[nH]cc[nH+]1 ZINC001442056294 1054407699 /nfs/dbraw/zinc/40/76/99/1054407699.db2.gz YDLRVNQXMRFKSX-UHFFFAOYSA-N 1 2 321.380 4.000 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1cc2ccc(F)cc2[nH]1 ZINC000486345665 1054409472 /nfs/dbraw/zinc/40/94/72/1054409472.db2.gz RCWQZGVLVFHDGS-UHFFFAOYSA-N 1 2 308.360 4.289 20 0 DIADLO Cn1cc([C@H]([NH2+]Cc2cscc2Cl)c2ccccc2)cn1 ZINC001342323535 1054421158 /nfs/dbraw/zinc/42/11/58/1054421158.db2.gz CPHUEOUMCQFXHG-MRXNPFEDSA-N 1 2 317.845 4.014 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)Cc2ccc(C)cc2C)cs1 ZINC000172317457 1054422529 /nfs/dbraw/zinc/42/25/29/1054422529.db2.gz SJBAHFUFQDMAEX-OAHLLOKOSA-N 1 2 318.486 4.489 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)Cc2ccc(C)cc2C)cs1 ZINC000172317457 1054422541 /nfs/dbraw/zinc/42/25/41/1054422541.db2.gz SJBAHFUFQDMAEX-OAHLLOKOSA-N 1 2 318.486 4.489 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)n1 ZINC000172409320 1054427745 /nfs/dbraw/zinc/42/77/45/1054427745.db2.gz ISTBXQBZRGWLTQ-MAUKXSAKSA-N 1 2 315.486 4.143 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)n1 ZINC000172409320 1054427760 /nfs/dbraw/zinc/42/77/60/1054427760.db2.gz ISTBXQBZRGWLTQ-MAUKXSAKSA-N 1 2 315.486 4.143 20 0 DIADLO C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001357253880 1054445269 /nfs/dbraw/zinc/44/52/69/1054445269.db2.gz HFHAFBOXXVJEKF-TZMCWYRMSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1cccc(C[N@@H+](C)[C@@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000671240176 1054456414 /nfs/dbraw/zinc/45/64/14/1054456414.db2.gz PBQQULGWPGAVAS-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1cccc(C[N@H+](C)[C@@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000671240176 1054456425 /nfs/dbraw/zinc/45/64/25/1054456425.db2.gz PBQQULGWPGAVAS-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO CC(C)C[C@H](C(=O)N[C@H](C)CCC1CCCCC1)n1cc[nH+]c1 ZINC001443972894 1054464480 /nfs/dbraw/zinc/46/44/80/1054464480.db2.gz ILDBZUZEEURJDD-SJLPKXTDSA-N 1 2 319.493 4.336 20 0 DIADLO Cc1cc(CSCCn2cc[nH+]c2)ccc1N1CCCCC1 ZINC001345181419 1054490485 /nfs/dbraw/zinc/49/04/85/1054490485.db2.gz XHVWUBTVZSZDEE-UHFFFAOYSA-N 1 2 315.486 4.115 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000174566745 1054513107 /nfs/dbraw/zinc/51/31/07/1054513107.db2.gz JPTHQVCADJXPPC-OBJOEFQTSA-N 1 2 303.377 4.402 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nc(C(C)(C)C)no2)[C@@H]1c1cccc(F)c1 ZINC000175153150 1054521463 /nfs/dbraw/zinc/52/14/63/1054521463.db2.gz OGDVOHSNIFZWCN-WBMJQRKESA-N 1 2 317.408 4.089 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nc(C(C)(C)C)no2)[C@@H]1c1cccc(F)c1 ZINC000175153150 1054521475 /nfs/dbraw/zinc/52/14/75/1054521475.db2.gz OGDVOHSNIFZWCN-WBMJQRKESA-N 1 2 317.408 4.089 20 0 DIADLO Fc1cccc2c1CC[C@H]2[NH2+][C@H](Cc1ccccc1)c1ncco1 ZINC001346438261 1054537654 /nfs/dbraw/zinc/53/76/54/1054537654.db2.gz NKQBPCPVDIKKHL-RTBURBONSA-N 1 2 322.383 4.375 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@H](C)c2ccc(F)c(F)c2)cc1 ZINC001234587451 1054550440 /nfs/dbraw/zinc/55/04/40/1054550440.db2.gz ACTRLDNJBXZIJD-LLVKDONJSA-N 1 2 305.324 4.467 20 0 DIADLO C=CC[N@@H+](Cc1nnc(-c2cccc(F)c2)o1)Cc1ccccc1 ZINC000075596089 1054568679 /nfs/dbraw/zinc/56/86/79/1054568679.db2.gz ABRKQORWPIJQMX-UHFFFAOYSA-N 1 2 323.371 4.064 20 0 DIADLO C=CC[N@H+](Cc1nnc(-c2cccc(F)c2)o1)Cc1ccccc1 ZINC000075596089 1054568695 /nfs/dbraw/zinc/56/86/95/1054568695.db2.gz ABRKQORWPIJQMX-UHFFFAOYSA-N 1 2 323.371 4.064 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+]Cc3cc(C)ccc3F)co2)cc1 ZINC000072927101 1054575258 /nfs/dbraw/zinc/57/52/58/1054575258.db2.gz RPTMIKTWTOOEGG-UHFFFAOYSA-N 1 2 310.372 4.387 20 0 DIADLO Fc1cc(F)c(C[NH+]2CCC3(CC3)CC2)c(Br)c1 ZINC001234742969 1054587545 /nfs/dbraw/zinc/58/75/45/1054587545.db2.gz VCWREKPEGUFUAI-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO CC(C)[C@@]1(C)C[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001358056039 1054588905 /nfs/dbraw/zinc/58/89/05/1054588905.db2.gz KLJLCFPQZTYXGY-SUMWQHHRSA-N 1 2 317.820 4.146 20 0 DIADLO FC(F)(F)c1cc(C[NH2+]Cc2csc(C3CC3)n2)cs1 ZINC000623415771 1054589107 /nfs/dbraw/zinc/58/91/07/1054589107.db2.gz XDVITRXNQFFRST-UHFFFAOYSA-N 1 2 318.389 4.391 20 0 DIADLO C[C@@H]1CC[C@@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)C[C@H]1C ZINC001358066862 1054592349 /nfs/dbraw/zinc/59/23/49/1054592349.db2.gz HKSBYYDRXZWIIM-MGPQQGTHSA-N 1 2 315.392 4.022 20 0 DIADLO C[C@@H]1CC[C@@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)C[C@@H]1C ZINC001358066860 1054592904 /nfs/dbraw/zinc/59/29/04/1054592904.db2.gz HKSBYYDRXZWIIM-HZSPNIEDSA-N 1 2 315.392 4.022 20 0 DIADLO Fc1cccc(C[N@H+](Cc2ccn(-c3ccccc3)n2)C2CC2)c1 ZINC000623433860 1054593870 /nfs/dbraw/zinc/59/38/70/1054593870.db2.gz HXYOMPHZHRVDFA-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2ccn(-c3ccccc3)n2)C2CC2)c1 ZINC000623433860 1054593882 /nfs/dbraw/zinc/59/38/82/1054593882.db2.gz HXYOMPHZHRVDFA-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2csc(C(F)(F)F)c2)s1 ZINC000623441343 1054594648 /nfs/dbraw/zinc/59/46/48/1054594648.db2.gz NYRFXTOPJZSAPD-MRVPVSSYSA-N 1 2 306.378 4.383 20 0 DIADLO CCC(C)(C)C1CCC2(C[C@H]2C(=O)Nc2cc[nH+]c(C)c2)CC1 ZINC001358136561 1054607185 /nfs/dbraw/zinc/60/71/85/1054607185.db2.gz HYXQPDBSULTIRE-CMVHYPBASA-N 1 2 314.473 4.383 20 0 DIADLO C[C@H](C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1)C(C)(C)C ZINC001348116590 1054613262 /nfs/dbraw/zinc/61/32/62/1054613262.db2.gz VRBFMHZVLZOVTA-CABCVRRESA-N 1 2 319.493 4.026 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccc(F)cc1)c1cnccn1 ZINC000177765699 1054633785 /nfs/dbraw/zinc/63/37/85/1054633785.db2.gz FBIGIJILKAUAED-LIRRHRJNSA-N 1 2 307.372 4.056 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Cl)cc(Br)c2F)C1 ZINC001234968878 1054636197 /nfs/dbraw/zinc/63/61/97/1054636197.db2.gz PDNXYOCCKRHGKC-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(Br)c2F)C1 ZINC001234968878 1054636200 /nfs/dbraw/zinc/63/62/00/1054636200.db2.gz PDNXYOCCKRHGKC-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1c[nH]c(-c3ccccc3F)c1)C2 ZINC001235044175 1054647536 /nfs/dbraw/zinc/64/75/36/1054647536.db2.gz UQSXWVOPHOKCMP-UHFFFAOYSA-N 1 2 322.383 4.345 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1c[nH]c(-c3ccccc3F)c1)C2 ZINC001235044175 1054647543 /nfs/dbraw/zinc/64/75/43/1054647543.db2.gz UQSXWVOPHOKCMP-UHFFFAOYSA-N 1 2 322.383 4.345 20 0 DIADLO Cc1cn2cc(NC(=O)C[C@@H]3C[C@@H](C)CC(C)(C)C3)ccc2[nH+]1 ZINC001358364366 1054665601 /nfs/dbraw/zinc/66/56/01/1054665601.db2.gz WQYYNCWJQBMERH-HIFRSBDPSA-N 1 2 313.445 4.434 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000179142135 1054668514 /nfs/dbraw/zinc/66/85/14/1054668514.db2.gz CNTPUQVCCJDVCI-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000179142135 1054668522 /nfs/dbraw/zinc/66/85/22/1054668522.db2.gz CNTPUQVCCJDVCI-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO CC[C@H](OC(=O)c1ccn2c(C)c[nH+]c2c1)c1ccc(C)cc1 ZINC001358414929 1054676780 /nfs/dbraw/zinc/67/67/80/1054676780.db2.gz MJRAWYHXMUMKHA-KRWDZBQOSA-N 1 2 308.381 4.259 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC3(CCCC3)[C@@H]2C(C)C)c(C)[nH+]1 ZINC001451391002 1054677345 /nfs/dbraw/zinc/67/73/45/1054677345.db2.gz RVWKJXMJFRSQEX-KRWDZBQOSA-N 1 2 300.446 4.048 20 0 DIADLO CCO[C@H](C)c1nc(C[NH2+]C(C)(C)c2cccc(F)c2)cs1 ZINC000179574476 1054687723 /nfs/dbraw/zinc/68/77/23/1054687723.db2.gz AJMPQCVLGSDYIL-GFCCVEGCSA-N 1 2 322.449 4.405 20 0 DIADLO CCc1cccc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)n1 ZINC001235250044 1054691793 /nfs/dbraw/zinc/69/17/93/1054691793.db2.gz HKSMJPPCJBWEJR-NRFANRHFSA-N 1 2 317.436 4.051 20 0 DIADLO CCc1cccc(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)n1 ZINC001235250044 1054691800 /nfs/dbraw/zinc/69/18/00/1054691800.db2.gz HKSMJPPCJBWEJR-NRFANRHFSA-N 1 2 317.436 4.051 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1ccc(F)cc1F ZINC000179623508 1054692763 /nfs/dbraw/zinc/69/27/63/1054692763.db2.gz HIXQZYXZNOKVNB-CQSZACIVSA-N 1 2 320.314 4.486 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cccc(CC)n1 ZINC001235266124 1054694548 /nfs/dbraw/zinc/69/45/48/1054694548.db2.gz JUMMWNZXOXGQGS-IBGZPJMESA-N 1 2 310.441 4.127 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cccc(CC)n1 ZINC001235266124 1054694556 /nfs/dbraw/zinc/69/45/56/1054694556.db2.gz JUMMWNZXOXGQGS-IBGZPJMESA-N 1 2 310.441 4.127 20 0 DIADLO CCc1cccc(C[N@H+](Cc2ccccc2)Cc2cccnc2)n1 ZINC001235258274 1054695492 /nfs/dbraw/zinc/69/54/92/1054695492.db2.gz OEVYWUXNFPKQTQ-UHFFFAOYSA-N 1 2 317.436 4.241 20 0 DIADLO CCc1cccc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)n1 ZINC001235258274 1054695495 /nfs/dbraw/zinc/69/54/95/1054695495.db2.gz OEVYWUXNFPKQTQ-UHFFFAOYSA-N 1 2 317.436 4.241 20 0 DIADLO CC(C)(C)c1ccc(CNc2ccc(Cn3cc[nH+]c3)cn2)cc1 ZINC000508471373 1054698616 /nfs/dbraw/zinc/69/86/16/1054698616.db2.gz MFILWAQXEGIWBX-UHFFFAOYSA-N 1 2 320.440 4.236 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(F)c(F)c(F)c2F)CCC1(F)F ZINC001235343561 1054705176 /nfs/dbraw/zinc/70/51/76/1054705176.db2.gz WWAWIDJPFZZQJY-MRVPVSSYSA-N 1 2 311.269 4.110 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(F)c(F)c(F)c2F)CCC1(F)F ZINC001235343561 1054705188 /nfs/dbraw/zinc/70/51/88/1054705188.db2.gz WWAWIDJPFZZQJY-MRVPVSSYSA-N 1 2 311.269 4.110 20 0 DIADLO CC(C)c1cc(N[C@@H](C)c2ccncc2F)nc(C(C)C)[nH+]1 ZINC000509443733 1054707619 /nfs/dbraw/zinc/70/76/19/1054707619.db2.gz GBWWBDTUSJUADM-LBPRGKRZSA-N 1 2 302.397 4.431 20 0 DIADLO CC(C)c1cc(N[C@H](C)c2ccncc2F)nc(C(C)C)[nH+]1 ZINC000509443732 1054708807 /nfs/dbraw/zinc/70/88/07/1054708807.db2.gz GBWWBDTUSJUADM-GFCCVEGCSA-N 1 2 302.397 4.431 20 0 DIADLO C[N@H+](Cc1ncc(Cl)cn1)C(c1ccccc1)c1ccccc1 ZINC001235418882 1054714214 /nfs/dbraw/zinc/71/42/14/1054714214.db2.gz SNQHFLIXNONSGJ-UHFFFAOYSA-N 1 2 323.827 4.351 20 0 DIADLO C[N@@H+](Cc1ncc(Cl)cn1)C(c1ccccc1)c1ccccc1 ZINC001235418882 1054714226 /nfs/dbraw/zinc/71/42/26/1054714226.db2.gz SNQHFLIXNONSGJ-UHFFFAOYSA-N 1 2 323.827 4.351 20 0 DIADLO CC(C)n1cc([C@@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)cn1 ZINC000179924077 1054716543 /nfs/dbraw/zinc/71/65/43/1054716543.db2.gz FWZWHPARQMNQBM-OAHLLOKOSA-N 1 2 313.449 4.022 20 0 DIADLO CCCc1nc(C[NH2+][C@H](C)c2cc(F)ccc2OC)cs1 ZINC000179915542 1054716672 /nfs/dbraw/zinc/71/66/72/1054716672.db2.gz FMBHREZZPJHGOD-LLVKDONJSA-N 1 2 308.422 4.094 20 0 DIADLO COc1cncc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1C ZINC001235470157 1054731089 /nfs/dbraw/zinc/73/10/89/1054731089.db2.gz KLYHOLYCQAWKHT-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cncc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1C ZINC001235470157 1054731106 /nfs/dbraw/zinc/73/11/06/1054731106.db2.gz KLYHOLYCQAWKHT-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO C[C@H]1C[NH+](Cc2csc(Nc3ccccc3)n2)C[C@H](C)S1 ZINC000608502138 1054731879 /nfs/dbraw/zinc/73/18/79/1054731879.db2.gz ACHGZPHSWMWCSX-STQMWFEESA-N 1 2 319.499 4.213 20 0 DIADLO CCc1ccc(C(C)(C)[NH2+]Cc2noc(-c3ccccc3)n2)cc1 ZINC000180103169 1054734562 /nfs/dbraw/zinc/73/45/62/1054734562.db2.gz XBJDUCBFDAMVCB-UHFFFAOYSA-N 1 2 321.424 4.324 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccccc2OC(F)(F)F)c(C)[nH+]1 ZINC000180142209 1054738338 /nfs/dbraw/zinc/73/83/38/1054738338.db2.gz RTDCYYGAWWKFEF-UHFFFAOYSA-N 1 2 324.302 4.158 20 0 DIADLO c1ccc2c(c1)cccc2CNc1ccc(N2CCCC2)c[nH+]1 ZINC000513055167 1054742308 /nfs/dbraw/zinc/74/23/08/1054742308.db2.gz YJPQHNQIQRKXHY-UHFFFAOYSA-N 1 2 303.409 4.447 20 0 DIADLO FC(F)(F)c1cccc(CNc2ccc(N3CCCC3)c[nH+]2)c1 ZINC000513054646 1054743852 /nfs/dbraw/zinc/74/38/52/1054743852.db2.gz QAWNEVVREAHASX-UHFFFAOYSA-N 1 2 321.346 4.313 20 0 DIADLO C[N@@H+](Cc1ccno1)Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235597207 1054749934 /nfs/dbraw/zinc/74/99/34/1054749934.db2.gz IYFQYVKUNQANBH-UHFFFAOYSA-N 1 2 305.592 4.267 20 0 DIADLO C[N@H+](Cc1ccno1)Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235597207 1054749923 /nfs/dbraw/zinc/74/99/23/1054749923.db2.gz IYFQYVKUNQANBH-UHFFFAOYSA-N 1 2 305.592 4.267 20 0 DIADLO Cc1cc(NC[C@H]2CC[C@H](c3ccccc3)O2)nc(C(C)C)[nH+]1 ZINC000515474061 1054750641 /nfs/dbraw/zinc/75/06/41/1054750641.db2.gz GEXPRQNAMBLUIQ-IAGOWNOFSA-N 1 2 311.429 4.241 20 0 DIADLO CCc1nc(CSCc2[nH+]cc(C)c(OC)c2C)cs1 ZINC000180364347 1054752413 /nfs/dbraw/zinc/75/24/13/1054752413.db2.gz KBEJKMAVTIGSOZ-UHFFFAOYSA-N 1 2 308.472 4.159 20 0 DIADLO COC[C@H]([NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1)c1ccc(F)c(F)c1 ZINC000180363960 1054752528 /nfs/dbraw/zinc/75/25/28/1054752528.db2.gz YSCLRGQYQQXJFS-ZLENFMNRSA-N 1 2 321.367 4.159 20 0 DIADLO COC[C@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1ccc(F)c(F)c1 ZINC000180363973 1054753308 /nfs/dbraw/zinc/75/33/08/1054753308.db2.gz YSCLRGQYQQXJFS-KHIZAZIESA-N 1 2 321.367 4.159 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2c(C)cncc2Br)cc1 ZINC001235646487 1054760671 /nfs/dbraw/zinc/76/06/71/1054760671.db2.gz WQMNNTWSYYWBBS-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2c(C)cncc2Br)cc1 ZINC001235646487 1054760684 /nfs/dbraw/zinc/76/06/84/1054760684.db2.gz WQMNNTWSYYWBBS-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO CCCC[C@@H](CC)C(=O)N1CC[NH2+][C@@H](c2ccc(Cl)cc2)C1 ZINC001454259509 1054762373 /nfs/dbraw/zinc/76/23/73/1054762373.db2.gz XPRGGOADGUQTAH-RHSMWYFYSA-N 1 2 322.880 4.029 20 0 DIADLO Nc1nccc(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001235673188 1054768000 /nfs/dbraw/zinc/76/80/00/1054768000.db2.gz CUBKXMVTYILFBS-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nccc(Cl)c1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001235673188 1054768017 /nfs/dbraw/zinc/76/80/17/1054768017.db2.gz CUBKXMVTYILFBS-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Cc1cccc2oc(C(=O)Nc3ccc(-n4cc[nH+]c4)cc3)cc21 ZINC001349616880 1054774412 /nfs/dbraw/zinc/77/44/12/1054774412.db2.gz WVGULDMJQLWVEA-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO CCCCOc1cccc(CNc2cc(C)[nH+]c(C3CC3)n2)c1 ZINC000522567257 1054776929 /nfs/dbraw/zinc/77/69/29/1054776929.db2.gz BBTCAQZNZMOYLS-UHFFFAOYSA-N 1 2 311.429 4.453 20 0 DIADLO Cc1cc(NC[C@H](Nc2ccccc2)C(C)C)nc(C2CC2)[nH+]1 ZINC000523874658 1054778491 /nfs/dbraw/zinc/77/84/91/1054778491.db2.gz SJQCTQXZBLUWRX-KRWDZBQOSA-N 1 2 310.445 4.211 20 0 DIADLO Cc1ccc(OCCCCNc2cc(C)[nH+]c(C3CC3)n2)cc1 ZINC000523876173 1054781252 /nfs/dbraw/zinc/78/12/52/1054781252.db2.gz VLQMRNDEUSCOFT-UHFFFAOYSA-N 1 2 311.429 4.242 20 0 DIADLO CC(C)(C)[N@@H+]1CC[C@@H]1C(=O)Nc1nc(C2CCCCC2)cs1 ZINC001454719968 1054781747 /nfs/dbraw/zinc/78/17/47/1054781747.db2.gz DZIMINFNNMSULM-CQSZACIVSA-N 1 2 321.490 4.002 20 0 DIADLO CC(C)(C)[N@H+]1CC[C@@H]1C(=O)Nc1nc(C2CCCCC2)cs1 ZINC001454719968 1054781762 /nfs/dbraw/zinc/78/17/62/1054781762.db2.gz DZIMINFNNMSULM-CQSZACIVSA-N 1 2 321.490 4.002 20 0 DIADLO Nc1ccc(Cl)nc1C[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC001235694114 1054782357 /nfs/dbraw/zinc/78/23/57/1054782357.db2.gz LWQIGXNWMZYUAH-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccc(Cl)nc1C[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC001235694114 1054782370 /nfs/dbraw/zinc/78/23/70/1054782370.db2.gz LWQIGXNWMZYUAH-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CC[C@@H](C4CCCCC4)C3)[nH]c2c1 ZINC001235696044 1054783444 /nfs/dbraw/zinc/78/34/44/1054783444.db2.gz YWXXUCDPHZJLIH-CQSZACIVSA-N 1 2 301.409 4.104 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CC[C@@H](C4CCCCC4)C3)[nH]c2c1 ZINC001235696044 1054783449 /nfs/dbraw/zinc/78/34/49/1054783449.db2.gz YWXXUCDPHZJLIH-CQSZACIVSA-N 1 2 301.409 4.104 20 0 DIADLO Nc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2ccccc2F)c1F ZINC001235719781 1054788017 /nfs/dbraw/zinc/78/80/17/1054788017.db2.gz YZWYMVCRUQUWGY-INIZCTEOSA-N 1 2 306.331 4.023 20 0 DIADLO Nc1ccc(F)c(C[N@H+]2CCC[C@H]2c2ccccc2F)c1F ZINC001235719781 1054788025 /nfs/dbraw/zinc/78/80/25/1054788025.db2.gz YZWYMVCRUQUWGY-INIZCTEOSA-N 1 2 306.331 4.023 20 0 DIADLO Fc1cccc(F)c1C1([NH2+]Cc2cncc(Cl)c2)CCC1 ZINC000623845196 1054789468 /nfs/dbraw/zinc/78/94/68/1054789468.db2.gz ZDRAYAIHVVVUBY-UHFFFAOYSA-N 1 2 308.759 4.182 20 0 DIADLO Cc1csc(CNc2[nH+]c3ccccc3n2C(C)(C)C)n1 ZINC001349762120 1054791366 /nfs/dbraw/zinc/79/13/66/1054791366.db2.gz UMFNRPGGRDFEKR-UHFFFAOYSA-N 1 2 300.431 4.168 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2cccnc2OC2CCCC2)n1 ZINC000623862133 1054792038 /nfs/dbraw/zinc/79/20/38/1054792038.db2.gz MYEXHNGGOZIGLU-ZDUSSCGKSA-N 1 2 317.458 4.019 20 0 DIADLO c1cc2ccc(CNc3ccc(N4CCCCC4)c[nH+]3)cc2[nH]1 ZINC000527641782 1054793154 /nfs/dbraw/zinc/79/31/54/1054793154.db2.gz GCGUOVDBYBFQND-UHFFFAOYSA-N 1 2 306.413 4.165 20 0 DIADLO C[N@@H+](Cc1c(F)cc(Cl)cc1Cl)C[C@@H]1CCCCO1 ZINC001235747070 1054795203 /nfs/dbraw/zinc/79/52/03/1054795203.db2.gz PMLOPGCHAXITPJ-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO C[N@H+](Cc1c(F)cc(Cl)cc1Cl)C[C@@H]1CCCCO1 ZINC001235747070 1054795217 /nfs/dbraw/zinc/79/52/17/1054795217.db2.gz PMLOPGCHAXITPJ-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO Cc1ccc(Br)c(C[NH+]2CCC(F)(F)CC2)c1F ZINC001235740783 1054795928 /nfs/dbraw/zinc/79/59/28/1054795928.db2.gz CUEZLXGVUGZHNN-UHFFFAOYSA-N 1 2 322.168 4.128 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[N@@H+]1CC[C@]2(C1)CCCCO2 ZINC001235740362 1054796350 /nfs/dbraw/zinc/79/63/50/1054796350.db2.gz MSFUPOWDRLGTAY-HNNXBMFYSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1C[N@H+]1CC[C@]2(C1)CCCCO2 ZINC001235740362 1054796364 /nfs/dbraw/zinc/79/63/64/1054796364.db2.gz MSFUPOWDRLGTAY-HNNXBMFYSA-N 1 2 318.219 4.278 20 0 DIADLO CC(C)O[C@H]1CC[N@H+](Cc2c(F)cc(Cl)cc2Cl)C1 ZINC001235751141 1054797970 /nfs/dbraw/zinc/79/79/70/1054797970.db2.gz QFUMDMRHGMRHRY-NSHDSACASA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@H]1CC[N@@H+](Cc2c(F)cc(Cl)cc2Cl)C1 ZINC001235751141 1054797982 /nfs/dbraw/zinc/79/79/82/1054797982.db2.gz QFUMDMRHGMRHRY-NSHDSACASA-N 1 2 306.208 4.132 20 0 DIADLO CC1(C)C[N@H+](Cc2c(F)cc(Cl)cc2Cl)CCCO1 ZINC001235748042 1054796841 /nfs/dbraw/zinc/79/68/41/1054796841.db2.gz WTXPNOJKBRRXGP-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(F)cc(Cl)cc2Cl)CCCO1 ZINC001235748042 1054796855 /nfs/dbraw/zinc/79/68/55/1054796855.db2.gz WTXPNOJKBRRXGP-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1ccc([C@H](C)C(F)(F)F)cc1 ZINC001349791270 1054797097 /nfs/dbraw/zinc/79/70/97/1054797097.db2.gz GGQFWFZVMSALCU-LBPRGKRZSA-N 1 2 322.330 4.038 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCCc3scnc31)CCCO2 ZINC000623877355 1054799764 /nfs/dbraw/zinc/79/97/64/1054799764.db2.gz ZVSABLMVURMJEN-UONOGXRCSA-N 1 2 318.417 4.163 20 0 DIADLO Clc1cccc2c1OCC[C@H]2[NH2+][C@@H]1CCCc2scnc21 ZINC000623877296 1054800653 /nfs/dbraw/zinc/80/06/53/1054800653.db2.gz XYCHEIIZVRQWQM-CHWSQXEVSA-N 1 2 320.845 4.287 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccc(F)cc2C(F)(F)F)cs1 ZINC000623868806 1054803062 /nfs/dbraw/zinc/80/30/62/1054803062.db2.gz IBMOGOBNPRKVAG-MRVPVSSYSA-N 1 2 318.339 4.460 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1cc(-c2ccccc2)n(C)n1 ZINC000623894238 1054804866 /nfs/dbraw/zinc/80/48/66/1054804866.db2.gz NKBYHOWEYXSZKW-CHWSQXEVSA-N 1 2 324.428 4.104 20 0 DIADLO C[N@H+](Cc1ccc(N)c(F)c1)Cc1c(Cl)cccc1Cl ZINC001235792820 1054807241 /nfs/dbraw/zinc/80/72/41/1054807241.db2.gz VPSBVSYCAVWUSB-UHFFFAOYSA-N 1 2 313.203 4.347 20 0 DIADLO C[N@@H+](Cc1ccc(N)c(F)c1)Cc1c(Cl)cccc1Cl ZINC001235792820 1054807254 /nfs/dbraw/zinc/80/72/54/1054807254.db2.gz VPSBVSYCAVWUSB-UHFFFAOYSA-N 1 2 313.203 4.347 20 0 DIADLO CC[C@@H](Nc1cc(C(C)C)[nH+]c(C(C)C)n1)C1CCOCC1 ZINC000534881040 1054816544 /nfs/dbraw/zinc/81/65/44/1054816544.db2.gz XHORCYKUFRYBFM-OAHLLOKOSA-N 1 2 305.466 4.341 20 0 DIADLO C[C@H](Nc1[nH+]c2ccccc2n1C)c1cccc(OC(F)F)c1 ZINC000536501857 1054827982 /nfs/dbraw/zinc/82/79/82/1054827982.db2.gz JLKAEDYDNDHEJJ-NSHDSACASA-N 1 2 317.339 4.348 20 0 DIADLO CC[C@H]([NH2+]C1CC(Sc2ccccc2)C1)C(=O)OC(C)(C)C ZINC001474595780 1054839357 /nfs/dbraw/zinc/83/93/57/1054839357.db2.gz YKZVGOMNYRTMPD-BCLQGDPASA-N 1 2 321.486 4.020 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1nc(C)cs1)c1cccc(Cl)c1 ZINC000623985029 1054839697 /nfs/dbraw/zinc/83/96/97/1054839697.db2.gz BVWQQDZPLFCGBP-RISCZKNCSA-N 1 2 310.850 4.143 20 0 DIADLO Cc1ccc(Cl)c2ccc(NCCCCn3cc[nH+]c3)nc12 ZINC000537604161 1054840915 /nfs/dbraw/zinc/84/09/15/1054840915.db2.gz WCGFFZUVTFKYKB-UHFFFAOYSA-N 1 2 314.820 4.285 20 0 DIADLO Cc1sc(C[NH+]2CC(C)(CC(F)F)C2)cc1Br ZINC001474596563 1054841281 /nfs/dbraw/zinc/84/12/81/1054841281.db2.gz JTNCNSWAQWMKKI-UHFFFAOYSA-N 1 2 324.234 4.296 20 0 DIADLO COC[C@H]([NH2+][C@@H]1CCCc2scnc21)c1ccc(Cl)cc1 ZINC000623972252 1054841356 /nfs/dbraw/zinc/84/13/56/1054841356.db2.gz XADBBLJYKGCTSL-KGLIPLIRSA-N 1 2 322.861 4.151 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2cc(F)c(Cl)cc2F)n1 ZINC000623973740 1054842584 /nfs/dbraw/zinc/84/25/84/1054842584.db2.gz YXWUYWCUKSFDCV-MRVPVSSYSA-N 1 2 302.777 4.234 20 0 DIADLO Fc1cc(C[NH2+][C@H]2CCCc3scnc32)c(F)cc1Cl ZINC000623973617 1054842796 /nfs/dbraw/zinc/84/27/96/1054842796.db2.gz VRIBSGQGCJMCKA-LBPRGKRZSA-N 1 2 314.788 4.242 20 0 DIADLO Fc1cc(C2CC2)ccc1C[NH2+][C@@H]1CCCc2scnc21 ZINC000623987612 1054842930 /nfs/dbraw/zinc/84/29/30/1054842930.db2.gz HWTCTULZFJNOOU-OAHLLOKOSA-N 1 2 302.418 4.327 20 0 DIADLO CC(C)N(C(=O)c1ccc(-c2ccn3cc[nH+]c3c2)cc1)C(C)C ZINC001235908975 1054844105 /nfs/dbraw/zinc/84/41/05/1054844105.db2.gz LFVLSIONWFNAFG-UHFFFAOYSA-N 1 2 321.424 4.260 20 0 DIADLO CC(C)N(C(=O)c1ccc(-c2ccc3[nH+]ccn3c2)cc1)C(C)C ZINC001235918239 1054846906 /nfs/dbraw/zinc/84/69/06/1054846906.db2.gz GXYOXDJCXGQMLX-UHFFFAOYSA-N 1 2 321.424 4.260 20 0 DIADLO Fc1cc2c(c(F)c1F)[C@H]([NH2+][C@@H]1CCCc3scnc31)CC2 ZINC000623996130 1054851281 /nfs/dbraw/zinc/85/12/81/1054851281.db2.gz UTPKWRBYFVXISK-GHMZBOCLSA-N 1 2 324.371 4.215 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@@H]3CCSc4ccccc43)ccn12 ZINC001127716086 1054853553 /nfs/dbraw/zinc/85/35/53/1054853553.db2.gz SNBCJYCTVCIXDM-OAHLLOKOSA-N 1 2 324.405 4.037 20 0 DIADLO C[C@@H]([NH2+][C@H]1CC=CCC1)c1cc(Br)cc(F)c1O ZINC000186057007 1054873272 /nfs/dbraw/zinc/87/32/72/1054873272.db2.gz GBNTZZCLQCLYCC-KOLCDFICSA-N 1 2 314.198 4.053 20 0 DIADLO CCC(F)(F)C(C)(C)C[NH2+][C@H](c1ncn[nH]1)C1CCCCC1 ZINC000624156206 1054892926 /nfs/dbraw/zinc/89/29/26/1054892926.db2.gz UIZIFJWTYBHZHV-ZDUSSCGKSA-N 1 2 314.424 4.087 20 0 DIADLO Cc1cccn2c(CNc3nc4cc(Cl)ccc4o3)c[nH+]c12 ZINC000181504798 1054916888 /nfs/dbraw/zinc/91/68/88/1054916888.db2.gz NFCMOQTYBVSSKQ-UHFFFAOYSA-N 1 2 312.760 4.049 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(CCC(C)C)no1)c1ccc(C)cc1 ZINC000181685266 1054928366 /nfs/dbraw/zinc/92/83/66/1054928366.db2.gz PRJJJPSVRQSPLQ-INIZCTEOSA-N 1 2 301.434 4.208 20 0 DIADLO Cc1oncc1C[N@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000181684810 1054930181 /nfs/dbraw/zinc/93/01/81/1054930181.db2.gz YJEMXZKQVVGINW-UHFFFAOYSA-N 1 2 306.356 4.206 20 0 DIADLO Cc1oncc1C[N@@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000181684810 1054930195 /nfs/dbraw/zinc/93/01/95/1054930195.db2.gz YJEMXZKQVVGINW-UHFFFAOYSA-N 1 2 306.356 4.206 20 0 DIADLO Clc1ccc(-c2ncnc3c2C[N@H+](Cc2ccccc2)C3)cc1 ZINC001236091169 1054938891 /nfs/dbraw/zinc/93/88/91/1054938891.db2.gz UEHCDCIHDVJMIO-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1ccc(-c2ncnc3c2C[N@@H+](Cc2ccccc2)C3)cc1 ZINC001236091169 1054938904 /nfs/dbraw/zinc/93/89/04/1054938904.db2.gz UEHCDCIHDVJMIO-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Cc1nnc(C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)o1 ZINC000181814835 1054939316 /nfs/dbraw/zinc/93/93/16/1054939316.db2.gz JRYCSIWCLDCOBI-CYBMUJFWSA-N 1 2 309.369 4.021 20 0 DIADLO C[N@H+](CCC(=O)c1ccccc1)Cc1nc2ccccc2s1 ZINC000182003454 1054953097 /nfs/dbraw/zinc/95/30/97/1054953097.db2.gz AXLZJBKEWJARSD-UHFFFAOYSA-N 1 2 310.422 4.001 20 0 DIADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1nc2ccccc2s1 ZINC000182003454 1054953111 /nfs/dbraw/zinc/95/31/11/1054953111.db2.gz AXLZJBKEWJARSD-UHFFFAOYSA-N 1 2 310.422 4.001 20 0 DIADLO CCCc1nc(C[NH2+][C@H](C)c2ccc(OC)c(F)c2)cs1 ZINC000181995781 1054953396 /nfs/dbraw/zinc/95/33/96/1054953396.db2.gz OHFXAAXSCJKULG-LLVKDONJSA-N 1 2 308.422 4.094 20 0 DIADLO Nc1ccnc(Cl)c1C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001236152574 1054970606 /nfs/dbraw/zinc/97/06/06/1054970606.db2.gz SPNUEKVRGJZCEX-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccnc(Cl)c1C[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001236152574 1054970613 /nfs/dbraw/zinc/97/06/13/1054970613.db2.gz SPNUEKVRGJZCEX-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO CC[C@H]([NH2+]Cc1csc(-c2ccoc2)n1)c1c(C)noc1C ZINC000182495621 1054992183 /nfs/dbraw/zinc/99/21/83/1054992183.db2.gz ITOBZLBLAQFVLW-AWEZNQCLSA-N 1 2 317.414 4.249 20 0 DIADLO O=C(CC1CCC(F)(F)CC1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000624249165 1054995480 /nfs/dbraw/zinc/99/54/80/1054995480.db2.gz WUVUBRJSJPFWGQ-UHFFFAOYSA-N 1 2 319.355 4.026 20 0 DIADLO Nc1cn2ccc(-c3cc(Cl)cc(C(F)(F)F)c3)cc2[nH+]1 ZINC001236203007 1054997484 /nfs/dbraw/zinc/99/74/84/1054997484.db2.gz HTFVUPJACDHUDK-UHFFFAOYSA-N 1 2 311.694 4.256 20 0 DIADLO Cc1nc([C@H]([NH2+]C2CCCCCC2)c2ccc(Cl)cc2)no1 ZINC000182681499 1055004365 /nfs/dbraw/zinc/00/43/65/1055004365.db2.gz XRTJXPHQMFNXSM-MRXNPFEDSA-N 1 2 319.836 4.433 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CCCC[C@H]2c2cccn2C)s1 ZINC000183117192 1055029418 /nfs/dbraw/zinc/02/94/18/1055029418.db2.gz ZKYDETDDCZDRHY-HNNXBMFYSA-N 1 2 303.475 4.332 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CCCC[C@H]2c2cccn2C)s1 ZINC000183117192 1055029430 /nfs/dbraw/zinc/02/94/30/1055029430.db2.gz ZKYDETDDCZDRHY-HNNXBMFYSA-N 1 2 303.475 4.332 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cc(F)c(F)c(F)c1 ZINC000183150186 1055032583 /nfs/dbraw/zinc/03/25/83/1055032583.db2.gz LRKQZHCAJNRJCX-LLVKDONJSA-N 1 2 321.346 4.272 20 0 DIADLO Fc1ccc(Br)c2[nH+]ccc(N3CCC[C@H]4C[C@H]43)c12 ZINC000672323798 1055033593 /nfs/dbraw/zinc/03/35/93/1055033593.db2.gz RROCAOSAKMFKBI-TVQRCGJNSA-N 1 2 321.193 4.125 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C)CC(C)(C)c2ccccc2)c(C)[nH+]1 ZINC001535960690 1055034571 /nfs/dbraw/zinc/03/45/71/1055034571.db2.gz DOJNPWAPJSTORT-INIZCTEOSA-N 1 2 324.468 4.493 20 0 DIADLO COc1ccc(F)cc1N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000183302418 1055039749 /nfs/dbraw/zinc/03/97/49/1055039749.db2.gz UNTVPYWVMSKTLI-CYBMUJFWSA-N 1 2 311.360 4.193 20 0 DIADLO Cc1cc(F)ccc1-c1cccc(Cl)c1C[NH+]1CCOCC1 ZINC001236267154 1055044872 /nfs/dbraw/zinc/04/48/72/1055044872.db2.gz QJDQMXJQCWLCBC-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO FCc1ccc(-c2cccc(Cl)c2C[NH+]2CCOCC2)cc1 ZINC001236267987 1055045140 /nfs/dbraw/zinc/04/51/40/1055045140.db2.gz NKQQAPSSEPRLBH-UHFFFAOYSA-N 1 2 319.807 4.309 20 0 DIADLO Cc1cc(-c2cccc(Cl)c2C[NH+]2CCOCC2)ccc1F ZINC001236268132 1055045330 /nfs/dbraw/zinc/04/53/30/1055045330.db2.gz ZZCWMMYSUXKFSC-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO C/C(=C/c1ccccc1Cl)C(=O)NCc1c[nH+]c(C)cc1C ZINC001536109169 1055049363 /nfs/dbraw/zinc/04/93/63/1055049363.db2.gz IYSSCVSWORMCBO-LCYFTJDESA-N 1 2 314.816 4.072 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+]Cc2nc(CCC(C)C)no2)c1C ZINC000183714946 1055053711 /nfs/dbraw/zinc/05/37/11/1055053711.db2.gz MPNUDUUITLXOAP-OAHLLOKOSA-N 1 2 301.434 4.126 20 0 DIADLO Nc1ccc(-c2ccc(-c3cc(F)c(F)c(F)c3)cc2)c[nH+]1 ZINC001236312606 1055054543 /nfs/dbraw/zinc/05/45/43/1055054543.db2.gz SOEPIRLUYILREK-UHFFFAOYSA-N 1 2 300.283 4.415 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000185409916 1055092253 /nfs/dbraw/zinc/09/22/53/1055092253.db2.gz HQNODFACQCBFBC-JKSUJKDBSA-N 1 2 321.424 4.381 20 0 DIADLO Cc1c(-c2ccc(-n3cc[nH+]c3)cc2)cnn1-c1ccccc1 ZINC001236402528 1055094288 /nfs/dbraw/zinc/09/42/88/1055094288.db2.gz CLUMPTFWVJYBIF-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1sccc1Cl)c1ccco1 ZINC000193073633 1055099366 /nfs/dbraw/zinc/09/93/66/1055099366.db2.gz KUZKLOXYDOPZCW-ZDUSSCGKSA-N 1 2 313.850 4.498 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cnn(Cc3ccccn3)c2)c1 ZINC001236436712 1055113696 /nfs/dbraw/zinc/11/36/96/1055113696.db2.gz HRKALLYPFZJJES-UHFFFAOYSA-N 1 2 320.440 4.148 20 0 DIADLO Cc1cc(NC(=O)C2(c3ccc(C(C)(C)C)cc3)CC2)c(C)c[nH+]1 ZINC001127734013 1055117217 /nfs/dbraw/zinc/11/72/17/1055117217.db2.gz VDNBQTGPESJSRK-UHFFFAOYSA-N 1 2 322.452 4.088 20 0 DIADLO Cc1ccc(NC(=O)CC2CCC(C)(C)CC2)c(N(C)C)[nH+]1 ZINC001536523378 1055122257 /nfs/dbraw/zinc/12/22/57/1055122257.db2.gz PIGDNMIUAVUKPW-UHFFFAOYSA-N 1 2 303.450 4.001 20 0 DIADLO CCOc1ncc(Cl)cc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001236496887 1055149203 /nfs/dbraw/zinc/14/92/03/1055149203.db2.gz AWGXFAPMSGNTMO-UHFFFAOYSA-N 1 2 313.788 4.046 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2ccnc(Cl)c2Cl)CC1 ZINC000842739479 1055149635 /nfs/dbraw/zinc/14/96/35/1055149635.db2.gz WRPHTFCTKXYGLH-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO Cc1cn2c(cccc2-c2cncc(OCc3ccccc3)c2)[nH+]1 ZINC001236569934 1055192004 /nfs/dbraw/zinc/19/20/04/1055192004.db2.gz SXZATVPEWXIILV-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO Cc1cc(Cl)nc(Cl)c1C[NH+]1CC(c2ccccc2)C1 ZINC001236608216 1055203173 /nfs/dbraw/zinc/20/31/73/1055203173.db2.gz OGVMMHGXDYLKRO-UHFFFAOYSA-N 1 2 307.224 4.296 20 0 DIADLO Fc1c(Cl)cc(C[N@@H+]2CC[C@@H]3CCCO[C@H]3C2)cc1Cl ZINC001236651534 1055211204 /nfs/dbraw/zinc/21/12/04/1055211204.db2.gz LJRCEIHRXKGMJM-FZMZJTMJSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1c(Cl)cc(C[N@H+]2CC[C@@H]3CCCO[C@H]3C2)cc1Cl ZINC001236651534 1055211215 /nfs/dbraw/zinc/21/12/15/1055211215.db2.gz LJRCEIHRXKGMJM-FZMZJTMJSA-N 1 2 318.219 4.133 20 0 DIADLO CCOc1ncc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)cc1F ZINC001236695766 1055232189 /nfs/dbraw/zinc/23/21/89/1055232189.db2.gz YIINQFVECQXKSY-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ncc(C[N@H+]2CCC[C@@H]2c2ccccc2F)cc1F ZINC001236695766 1055232208 /nfs/dbraw/zinc/23/22/08/1055232208.db2.gz YIINQFVECQXKSY-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)ccc1F ZINC001236706374 1055236273 /nfs/dbraw/zinc/23/62/73/1055236273.db2.gz WTNFOFZQDQBEEO-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)ccc1F ZINC001236706374 1055236286 /nfs/dbraw/zinc/23/62/86/1055236286.db2.gz WTNFOFZQDQBEEO-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO C[N@H+](Cc1ccc(F)c(O)c1)Cc1cccc(Cl)c1Cl ZINC001236706550 1055238335 /nfs/dbraw/zinc/23/83/35/1055238335.db2.gz ZEWPURHXHYWCIR-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO C[N@@H+](Cc1ccc(F)c(O)c1)Cc1cccc(Cl)c1Cl ZINC001236706550 1055238343 /nfs/dbraw/zinc/23/83/43/1055238343.db2.gz ZEWPURHXHYWCIR-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO Fc1cc(OC(F)F)ccc1C[N@H+](Cc1ccco1)C1CC1 ZINC001236724462 1055239270 /nfs/dbraw/zinc/23/92/70/1055239270.db2.gz IOVXXRAJWSJQLT-UHFFFAOYSA-N 1 2 311.303 4.185 20 0 DIADLO Fc1cc(OC(F)F)ccc1C[N@@H+](Cc1ccco1)C1CC1 ZINC001236724462 1055239286 /nfs/dbraw/zinc/23/92/86/1055239286.db2.gz IOVXXRAJWSJQLT-UHFFFAOYSA-N 1 2 311.303 4.185 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2ccc(O)cc2OC(F)(F)F)C1 ZINC001236721876 1055240350 /nfs/dbraw/zinc/24/03/50/1055240350.db2.gz LZXNGKMMTYXXKK-AWEZNQCLSA-N 1 2 321.314 4.005 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2ccc(O)cc2OC(F)(F)F)C1 ZINC001236721876 1055240363 /nfs/dbraw/zinc/24/03/63/1055240363.db2.gz LZXNGKMMTYXXKK-AWEZNQCLSA-N 1 2 321.314 4.005 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1ccc(OC(F)F)cc1F)C2 ZINC001236718168 1055240607 /nfs/dbraw/zinc/24/06/07/1055240607.db2.gz IVGOSPHHEYDDMK-UHFFFAOYSA-N 1 2 307.315 4.251 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1ccc(OC(F)F)cc1F)C2 ZINC001236718168 1055240620 /nfs/dbraw/zinc/24/06/20/1055240620.db2.gz IVGOSPHHEYDDMK-UHFFFAOYSA-N 1 2 307.315 4.251 20 0 DIADLO CCCCN1CC[C@@]2(CCC[N@@H+](c3ccc(C)cc3)CC2)C1=O ZINC001278001173 1055241887 /nfs/dbraw/zinc/24/18/87/1055241887.db2.gz YRFRBWPNZAQVLD-FQEVSTJZSA-N 1 2 314.473 4.004 20 0 DIADLO CCCCN1CC[C@@]2(CCC[N@H+](c3ccc(C)cc3)CC2)C1=O ZINC001278001173 1055241895 /nfs/dbraw/zinc/24/18/95/1055241895.db2.gz YRFRBWPNZAQVLD-FQEVSTJZSA-N 1 2 314.473 4.004 20 0 DIADLO Oc1ccc(C[NH+]2CC3(C2)CCCCC3)c(OC(F)(F)F)c1 ZINC001236731992 1055244536 /nfs/dbraw/zinc/24/45/36/1055244536.db2.gz XSBODBVKRPFILG-UHFFFAOYSA-N 1 2 315.335 4.057 20 0 DIADLO Cc1cc(Br)sc1C[NH+]1CCC(F)(F)CC1 ZINC001236823527 1055277669 /nfs/dbraw/zinc/27/76/69/1055277669.db2.gz AVHXYSOWBLREIT-UHFFFAOYSA-N 1 2 310.207 4.050 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(F)c(Br)c1 ZINC001236848022 1055291981 /nfs/dbraw/zinc/29/19/81/1055291981.db2.gz LPPUBLSHMDPGNU-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1cc(F)c(F)c(Br)c1 ZINC001236848022 1055291989 /nfs/dbraw/zinc/29/19/89/1055291989.db2.gz LPPUBLSHMDPGNU-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cc2sccc2nc1Cl ZINC001236865109 1055297051 /nfs/dbraw/zinc/29/70/51/1055297051.db2.gz VHBDMPULXKEEBQ-NSHDSACASA-N 1 2 317.845 4.328 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cc2sccc2nc1Cl ZINC001236865109 1055297068 /nfs/dbraw/zinc/29/70/68/1055297068.db2.gz VHBDMPULXKEEBQ-NSHDSACASA-N 1 2 317.845 4.328 20 0 DIADLO CCCc1ccccc1OC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC001587470015 1055304203 /nfs/dbraw/zinc/30/42/03/1055304203.db2.gz RCDJEILMFACIQE-UHFFFAOYSA-N 1 2 320.392 4.103 20 0 DIADLO CCC[N@H+](CC)Cn1nc(-c2ccc(C)cc2)n(CC)c1=S ZINC000764948634 1055304787 /nfs/dbraw/zinc/30/47/87/1055304787.db2.gz YICOPDWQENVXBE-UHFFFAOYSA-N 1 2 318.490 4.099 20 0 DIADLO CCC[N@@H+](CC)Cn1nc(-c2ccc(C)cc2)n(CC)c1=S ZINC000764948634 1055304800 /nfs/dbraw/zinc/30/48/00/1055304800.db2.gz YICOPDWQENVXBE-UHFFFAOYSA-N 1 2 318.490 4.099 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cncc(-c2ccc(F)cc2)c1 ZINC001237002317 1055334421 /nfs/dbraw/zinc/33/44/21/1055334421.db2.gz QNIFKGMDFUDSGO-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cncc(-c2ccc(F)cc2)c1 ZINC001237002317 1055334434 /nfs/dbraw/zinc/33/44/34/1055334434.db2.gz QNIFKGMDFUDSGO-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H](C)c1cnn(-c2ccccc2)c1 ZINC000325420771 1055336075 /nfs/dbraw/zinc/33/60/75/1055336075.db2.gz WUYYIVVZIKNWTK-INIZCTEOSA-N 1 2 320.440 4.420 20 0 DIADLO Cc1ccc(-c2cncc(C[N@@H+]3CCn4cccc4[C@H]3C)c2)cc1 ZINC001237003779 1055336438 /nfs/dbraw/zinc/33/64/38/1055336438.db2.gz UMZGBCAWYYKQCY-QGZVFWFLSA-N 1 2 317.436 4.435 20 0 DIADLO Cc1ccc(-c2cncc(C[N@H+]3CCn4cccc4[C@H]3C)c2)cc1 ZINC001237003779 1055336451 /nfs/dbraw/zinc/33/64/51/1055336451.db2.gz UMZGBCAWYYKQCY-QGZVFWFLSA-N 1 2 317.436 4.435 20 0 DIADLO Cc1cc(NC(=O)C2(c3ccccc3C)CCCCC2)c(C)c[nH+]1 ZINC001537540168 1055353018 /nfs/dbraw/zinc/35/30/18/1055353018.db2.gz NHUREOWACHMKQM-UHFFFAOYSA-N 1 2 322.452 4.269 20 0 DIADLO CC[N@H+](CC(=O)OC(C)(C)C)Cc1cccc(OC(C)(C)C)c1 ZINC001237101604 1055371547 /nfs/dbraw/zinc/37/15/47/1055371547.db2.gz DYZNYTZCRBGBRB-UHFFFAOYSA-N 1 2 321.461 4.028 20 0 DIADLO CC[N@@H+](CC(=O)OC(C)(C)C)Cc1cccc(OC(C)(C)C)c1 ZINC001237101604 1055371563 /nfs/dbraw/zinc/37/15/63/1055371563.db2.gz DYZNYTZCRBGBRB-UHFFFAOYSA-N 1 2 321.461 4.028 20 0 DIADLO COc1cccc2c(C[N@@H+]3Cc4cccc(Cl)c4C3)ccnc12 ZINC001237112302 1055375991 /nfs/dbraw/zinc/37/59/91/1055375991.db2.gz RODNDDFJEIIBDP-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO COc1cccc2c(C[N@H+]3Cc4cccc(Cl)c4C3)ccnc12 ZINC001237112302 1055376003 /nfs/dbraw/zinc/37/60/03/1055376003.db2.gz RODNDDFJEIIBDP-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C=Cc1ccc(F)c2ccccc12 ZINC001537610143 1055380382 /nfs/dbraw/zinc/38/03/82/1055380382.db2.gz TXJOIPHVSNHERM-CSKARUKUSA-N 1 2 320.367 4.065 20 0 DIADLO Cc1c(C[N@H+](C)Cc2nc3ccccc3o2)ccc(F)c1F ZINC001237163611 1055390712 /nfs/dbraw/zinc/39/07/12/1055390712.db2.gz SSNJOBWXHHNYTK-UHFFFAOYSA-N 1 2 302.324 4.046 20 0 DIADLO Cc1c(C[N@@H+](C)Cc2nc3ccccc3o2)ccc(F)c1F ZINC001237163611 1055390725 /nfs/dbraw/zinc/39/07/25/1055390725.db2.gz SSNJOBWXHHNYTK-UHFFFAOYSA-N 1 2 302.324 4.046 20 0 DIADLO COc1cccc(C[N@@H+]2CCc3c(F)cccc3C2)c1Cl ZINC001237197358 1055401767 /nfs/dbraw/zinc/40/17/67/1055401767.db2.gz NLKZUABFZWPNHU-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc(C[N@H+]2CCc3c(F)cccc3C2)c1Cl ZINC001237197358 1055401777 /nfs/dbraw/zinc/40/17/77/1055401777.db2.gz NLKZUABFZWPNHU-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Cc1csc(C[NH2+]Cc2ccc(Cl)c(C)c2Cl)n1 ZINC000921518451 1055405436 /nfs/dbraw/zinc/40/54/36/1055405436.db2.gz BUTNPVORNDDHKL-UHFFFAOYSA-N 1 2 301.242 4.357 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2ccc3nccc(Cl)c3c2)C[C@@H]1F ZINC001237265284 1055409849 /nfs/dbraw/zinc/40/98/49/1055409849.db2.gz RHDMKUANNNWQFL-JKSUJKDBSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2ccc3nccc(Cl)c3c2)C[C@@H]1F ZINC001237265284 1055409857 /nfs/dbraw/zinc/40/98/57/1055409857.db2.gz RHDMKUANNNWQFL-JKSUJKDBSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2ccc3nccc(Cl)c3c2)C[C@H]1F ZINC001237265283 1055410418 /nfs/dbraw/zinc/41/04/18/1055410418.db2.gz RHDMKUANNNWQFL-HZPDHXFCSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2ccc3nccc(Cl)c3c2)C[C@H]1F ZINC001237265283 1055410424 /nfs/dbraw/zinc/41/04/24/1055410424.db2.gz RHDMKUANNNWQFL-HZPDHXFCSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc2nccc(Cl)c2c1 ZINC001237273593 1055412462 /nfs/dbraw/zinc/41/24/62/1055412462.db2.gz UJEZWPVSICCVQQ-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccc2nccc(Cl)c2c1 ZINC001237273593 1055412465 /nfs/dbraw/zinc/41/24/65/1055412465.db2.gz UJEZWPVSICCVQQ-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO Oc1cc(F)cc(C[N@H+](Cc2ccccc2)Cc2cccnc2)c1 ZINC001237278671 1055414792 /nfs/dbraw/zinc/41/47/92/1055414792.db2.gz JCQUWETTWPKFIJ-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO Oc1cc(F)cc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)c1 ZINC001237278671 1055414801 /nfs/dbraw/zinc/41/48/01/1055414801.db2.gz JCQUWETTWPKFIJ-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO FC(F)(F)c1cnccc1C[N@@H+]1CCSc2ccccc2C1 ZINC001237302010 1055423654 /nfs/dbraw/zinc/42/36/54/1055423654.db2.gz KOUXFGONKILGOV-UHFFFAOYSA-N 1 2 324.371 4.208 20 0 DIADLO FC(F)(F)c1cnccc1C[N@H+]1CCSc2ccccc2C1 ZINC001237302010 1055423668 /nfs/dbraw/zinc/42/36/68/1055423668.db2.gz KOUXFGONKILGOV-UHFFFAOYSA-N 1 2 324.371 4.208 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@@H]2c2cccs2)nc1 ZINC000171959113 1055426492 /nfs/dbraw/zinc/42/64/92/1055426492.db2.gz LKSKNJSYJMMBLV-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@@H]2c2cccs2)nc1 ZINC000171959113 1055426497 /nfs/dbraw/zinc/42/64/97/1055426497.db2.gz LKSKNJSYJMMBLV-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO CCCC[C@H](C)N(CCCC)C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC001588108201 1055430220 /nfs/dbraw/zinc/43/02/20/1055430220.db2.gz MAKATDFOLKUWJI-HNNXBMFYSA-N 1 2 315.461 4.464 20 0 DIADLO C[N@H+](Cc1cnc(-c2ccccc2)o1)Cc1ccc(F)cc1F ZINC001237370818 1055441395 /nfs/dbraw/zinc/44/13/95/1055441395.db2.gz NTTPXEODFDDFDC-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1cnc(-c2ccccc2)o1)Cc1ccc(F)cc1F ZINC001237370818 1055441400 /nfs/dbraw/zinc/44/14/00/1055441400.db2.gz NTTPXEODFDDFDC-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO CC1CCN(c2cccc(NCc3cccc4[nH+]ccn43)c2)CC1 ZINC001620840479 1055449041 /nfs/dbraw/zinc/44/90/41/1055449041.db2.gz DBBWMVBAVVVTOB-UHFFFAOYSA-N 1 2 320.440 4.183 20 0 DIADLO CC(C)c1cccc(C[N@@H+]2CCc3ncc(Cl)cc3C2)c1 ZINC001237460664 1055455734 /nfs/dbraw/zinc/45/57/34/1055455734.db2.gz UYAHBMQFYRAPFE-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1cccc(C[N@H+]2CCc3ncc(Cl)cc3C2)c1 ZINC001237460664 1055455736 /nfs/dbraw/zinc/45/57/36/1055455736.db2.gz UYAHBMQFYRAPFE-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1cccc(C[N@@H+]2CCc3nc(Cl)ccc3C2)c1 ZINC001237463740 1055455839 /nfs/dbraw/zinc/45/58/39/1055455839.db2.gz XQPSVSNNBCAIBL-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1cccc(C[N@H+]2CCc3nc(Cl)ccc3C2)c1 ZINC001237463740 1055455843 /nfs/dbraw/zinc/45/58/43/1055455843.db2.gz XQPSVSNNBCAIBL-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO Cc1cc(NC(=O)c2cc3c(s2)-c2ccccc2OC3)cc[nH+]1 ZINC000017820880 1055466051 /nfs/dbraw/zinc/46/60/51/1055466051.db2.gz DYQGOAMGEARHOQ-UHFFFAOYSA-N 1 2 322.389 4.263 20 0 DIADLO CCc1ccc(CNc2ccc(-n3cc[nH+]c3)c(F)c2)s1 ZINC001620849063 1055476282 /nfs/dbraw/zinc/47/62/82/1055476282.db2.gz MRDWSEWYOPFUFJ-UHFFFAOYSA-N 1 2 301.390 4.247 20 0 DIADLO COc1ccccc1/C=C\CNc1cccc(-n2cc[nH+]c2)c1 ZINC001620853576 1055480650 /nfs/dbraw/zinc/48/06/50/1055480650.db2.gz MSFNORHRGJBUIA-ALCCZGGFSA-N 1 2 305.381 4.006 20 0 DIADLO Fc1cc(Cl)c(C[N@H+]2C[C@H]3[C@H](CC3(F)F)C2)c(Cl)c1 ZINC001237590887 1055482600 /nfs/dbraw/zinc/48/26/00/1055482600.db2.gz BDQLNOFJOOPMSF-XCBNKYQSSA-N 1 2 310.146 4.220 20 0 DIADLO Fc1cc(Cl)c(C[N@@H+]2C[C@H]3[C@H](CC3(F)F)C2)c(Cl)c1 ZINC001237590887 1055482606 /nfs/dbraw/zinc/48/26/06/1055482606.db2.gz BDQLNOFJOOPMSF-XCBNKYQSSA-N 1 2 310.146 4.220 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)/C=C\C3CCCC3)cc2)[nH+]c1C ZINC001589465788 1055484983 /nfs/dbraw/zinc/48/49/83/1055484983.db2.gz DXHUDNXAYZAZSG-GHXNOFRVSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C=CC3CCCC3)cc2)[nH+]c1C ZINC001589465788 1055484990 /nfs/dbraw/zinc/48/49/90/1055484990.db2.gz DXHUDNXAYZAZSG-GHXNOFRVSA-N 1 2 309.413 4.378 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cccc(COC)c2)c1 ZINC001620861311 1055490313 /nfs/dbraw/zinc/49/03/13/1055490313.db2.gz USWVRZKNPKXCKO-UHFFFAOYSA-N 1 2 302.443 4.093 20 0 DIADLO CCc1[nH]ncc1C[N@H+](C)C(c1ccccc1)c1ccccc1 ZINC001237652030 1055493465 /nfs/dbraw/zinc/49/34/65/1055493465.db2.gz PCPCQTTWHPLQIG-UHFFFAOYSA-N 1 2 305.425 4.194 20 0 DIADLO CCc1[nH]ncc1C[N@@H+](C)C(c1ccccc1)c1ccccc1 ZINC001237652030 1055493474 /nfs/dbraw/zinc/49/34/74/1055493474.db2.gz PCPCQTTWHPLQIG-UHFFFAOYSA-N 1 2 305.425 4.194 20 0 DIADLO Cc1coc(C[N@@H+]2CCc3ccccc3[C@@H]2c2ccccc2)n1 ZINC001237646066 1055494523 /nfs/dbraw/zinc/49/45/23/1055494523.db2.gz NVTGSVWQXDOSNU-FQEVSTJZSA-N 1 2 304.393 4.131 20 0 DIADLO Cc1coc(C[N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)n1 ZINC001237646066 1055494528 /nfs/dbraw/zinc/49/45/28/1055494528.db2.gz NVTGSVWQXDOSNU-FQEVSTJZSA-N 1 2 304.393 4.131 20 0 DIADLO CCC1CC[NH+](Cc2ncc(Cl)cc2Br)CC1 ZINC001237753977 1055515538 /nfs/dbraw/zinc/51/55/38/1055515538.db2.gz SLDVENWOJZGNSC-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cccc(Cl)c2)c(Cl)n1 ZINC001237804061 1055534223 /nfs/dbraw/zinc/53/42/23/1055534223.db2.gz SRCFUGPBSCQUHK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cccc(Cl)c2)c(Cl)n1 ZINC001237804061 1055534235 /nfs/dbraw/zinc/53/42/35/1055534235.db2.gz SRCFUGPBSCQUHK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO CCc1ncc(C[N@@H+]2CCSC[C@H]2c2ccc(F)cc2)s1 ZINC001237825522 1055537464 /nfs/dbraw/zinc/53/74/64/1055537464.db2.gz BNTAUEFQEICERU-HNNXBMFYSA-N 1 2 322.474 4.135 20 0 DIADLO CCc1ncc(C[N@H+]2CCSC[C@H]2c2ccc(F)cc2)s1 ZINC001237825522 1055537474 /nfs/dbraw/zinc/53/74/74/1055537474.db2.gz BNTAUEFQEICERU-HNNXBMFYSA-N 1 2 322.474 4.135 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cnc(CC)s1 ZINC001237830781 1055541484 /nfs/dbraw/zinc/54/14/84/1055541484.db2.gz PTAUKDPDJFFKII-MRXNPFEDSA-N 1 2 316.470 4.189 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cnc(CC)s1 ZINC001237830781 1055541492 /nfs/dbraw/zinc/54/14/92/1055541492.db2.gz PTAUKDPDJFFKII-MRXNPFEDSA-N 1 2 316.470 4.189 20 0 DIADLO CC(C)([NH2+]Cc1occc1Br)c1cccc(F)c1 ZINC000736647028 1055541472 /nfs/dbraw/zinc/54/14/72/1055541472.db2.gz BDKCRPDBEHVMLM-UHFFFAOYSA-N 1 2 312.182 4.206 20 0 DIADLO Fc1ccc(C[N@@H+]2CCc3c(Br)cccc3C2)cc1 ZINC000021778748 1055547034 /nfs/dbraw/zinc/54/70/34/1055547034.db2.gz LPUYODAPPWEAIJ-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO Fc1ccc(C[N@H+]2CCc3c(Br)cccc3C2)cc1 ZINC000021778748 1055547042 /nfs/dbraw/zinc/54/70/42/1055547042.db2.gz LPUYODAPPWEAIJ-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO c1ccc(OCc2ccc(C[N@@H+]3Cc4ccncc4C3)cc2)cc1 ZINC001237927128 1055560125 /nfs/dbraw/zinc/56/01/25/1055560125.db2.gz YMJPVQPVYKKLGX-UHFFFAOYSA-N 1 2 316.404 4.176 20 0 DIADLO c1ccc(OCc2ccc(C[N@H+]3Cc4ccncc4C3)cc2)cc1 ZINC001237927128 1055560133 /nfs/dbraw/zinc/56/01/33/1055560133.db2.gz YMJPVQPVYKKLGX-UHFFFAOYSA-N 1 2 316.404 4.176 20 0 DIADLO Clc1n[nH]c(C2CC2)c1CNc1ccc([NH+]2CCCC2)cc1 ZINC000921568277 1055567022 /nfs/dbraw/zinc/56/70/22/1055567022.db2.gz GLZXEVXLZLMGBT-UHFFFAOYSA-N 1 2 316.836 4.153 20 0 DIADLO CCC[N@H+](CCc1ccccn1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237998038 1055576983 /nfs/dbraw/zinc/57/69/83/1055576983.db2.gz PPZKTXGEPRFWII-UHFFFAOYSA-N 1 2 322.811 4.034 20 0 DIADLO CCC[N@@H+](CCc1ccccn1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237998038 1055576994 /nfs/dbraw/zinc/57/69/94/1055576994.db2.gz PPZKTXGEPRFWII-UHFFFAOYSA-N 1 2 322.811 4.034 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cncc(Cl)c2Cl)CCC1(F)F ZINC001238006493 1055581965 /nfs/dbraw/zinc/58/19/65/1055581965.db2.gz RPAMNJRMZDNGRX-VIFPVBQESA-N 1 2 309.187 4.256 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cncc(Cl)c2Cl)CCC1(F)F ZINC001238006493 1055581976 /nfs/dbraw/zinc/58/19/76/1055581976.db2.gz RPAMNJRMZDNGRX-VIFPVBQESA-N 1 2 309.187 4.256 20 0 DIADLO CC[N@H+](Cc1ccc(F)cc1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237998169 1055582344 /nfs/dbraw/zinc/58/23/44/1055582344.db2.gz REEYYWXWSUHHJS-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC[N@@H+](Cc1ccc(F)cc1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237998169 1055582355 /nfs/dbraw/zinc/58/23/55/1055582355.db2.gz REEYYWXWSUHHJS-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@@H]2CCc3c2cccc3Cl)n1 ZINC000921614095 1055585642 /nfs/dbraw/zinc/58/56/42/1055585642.db2.gz MOFVXVUKNVYMNQ-CQSZACIVSA-N 1 2 304.821 4.403 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cnc(F)cc2Cl)cc1 ZINC001238026272 1055587326 /nfs/dbraw/zinc/58/73/26/1055587326.db2.gz RGZGOAITXYWDHE-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cnc(F)cc2Cl)cc1 ZINC001238026272 1055587334 /nfs/dbraw/zinc/58/73/34/1055587334.db2.gz RGZGOAITXYWDHE-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cnc(F)cc1Cl ZINC001238026894 1055588472 /nfs/dbraw/zinc/58/84/72/1055588472.db2.gz DHVOTXHEWUZRRP-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cnc(F)cc1Cl ZINC001238026894 1055588482 /nfs/dbraw/zinc/58/84/82/1055588482.db2.gz DHVOTXHEWUZRRP-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO CCOc1ccccc1C[N@H+](CC)Cc1cccc(F)c1F ZINC001203545235 1055589175 /nfs/dbraw/zinc/58/91/75/1055589175.db2.gz DPKURPZCEYELJX-UHFFFAOYSA-N 1 2 305.368 4.386 20 0 DIADLO CCOc1ccccc1C[N@@H+](CC)Cc1cccc(F)c1F ZINC001203545235 1055589186 /nfs/dbraw/zinc/58/91/86/1055589186.db2.gz DPKURPZCEYELJX-UHFFFAOYSA-N 1 2 305.368 4.386 20 0 DIADLO c1cc(C[N@@H+]2CCOCC23CC3)cc(OCC2CCCCC2)c1 ZINC001238069822 1055601280 /nfs/dbraw/zinc/60/12/80/1055601280.db2.gz LLFZAMBNWPFYRA-UHFFFAOYSA-N 1 2 315.457 4.011 20 0 DIADLO c1cc(C[N@H+]2CCOCC23CC3)cc(OCC2CCCCC2)c1 ZINC001238069822 1055601287 /nfs/dbraw/zinc/60/12/87/1055601287.db2.gz LLFZAMBNWPFYRA-UHFFFAOYSA-N 1 2 315.457 4.011 20 0 DIADLO C[N@H+](CCCc1ccccc1)Cc1cc(Cl)c(O)cc1F ZINC001238147924 1055611524 /nfs/dbraw/zinc/61/15/24/1055611524.db2.gz NQKMSQRVDSHDNS-UHFFFAOYSA-N 1 2 307.796 4.249 20 0 DIADLO C[N@@H+](CCCc1ccccc1)Cc1cc(Cl)c(O)cc1F ZINC001238147924 1055611531 /nfs/dbraw/zinc/61/15/31/1055611531.db2.gz NQKMSQRVDSHDNS-UHFFFAOYSA-N 1 2 307.796 4.249 20 0 DIADLO Oc1cc(F)c(C[N@H+](Cc2ccccc2)C2CC2)cc1Cl ZINC001238150007 1055611622 /nfs/dbraw/zinc/61/16/22/1055611622.db2.gz NWFXAFWMWMHTPQ-UHFFFAOYSA-N 1 2 305.780 4.349 20 0 DIADLO Oc1cc(F)c(C[N@@H+](Cc2ccccc2)C2CC2)cc1Cl ZINC001238150007 1055611625 /nfs/dbraw/zinc/61/16/25/1055611625.db2.gz NWFXAFWMWMHTPQ-UHFFFAOYSA-N 1 2 305.780 4.349 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cc2c(s1)CCCC2 ZINC000029277653 1055614709 /nfs/dbraw/zinc/61/47/09/1055614709.db2.gz ZRRDFZMNYYWCRT-UHFFFAOYSA-N 1 2 323.421 4.065 20 0 DIADLO Fc1ccccc1[C@@H]1CC[N@H+](Cc2c(F)ccnc2Cl)C1 ZINC001238230762 1055627513 /nfs/dbraw/zinc/62/75/13/1055627513.db2.gz MWRUEQJMIQGKEU-LLVKDONJSA-N 1 2 308.759 4.003 20 0 DIADLO Fc1ccccc1[C@@H]1CC[N@@H+](Cc2c(F)ccnc2Cl)C1 ZINC001238230762 1055627518 /nfs/dbraw/zinc/62/75/18/1055627518.db2.gz MWRUEQJMIQGKEU-LLVKDONJSA-N 1 2 308.759 4.003 20 0 DIADLO Fc1ccccc1[C@H]1CC[N@H+](Cc2c(F)ccnc2Cl)C1 ZINC001238230764 1055627790 /nfs/dbraw/zinc/62/77/90/1055627790.db2.gz MWRUEQJMIQGKEU-NSHDSACASA-N 1 2 308.759 4.003 20 0 DIADLO Fc1ccccc1[C@H]1CC[N@@H+](Cc2c(F)ccnc2Cl)C1 ZINC001238230764 1055627791 /nfs/dbraw/zinc/62/77/91/1055627791.db2.gz MWRUEQJMIQGKEU-NSHDSACASA-N 1 2 308.759 4.003 20 0 DIADLO CCCOc1ccc(Br)c(C[N@H+](C)C(C)C)c1F ZINC001238292491 1055635737 /nfs/dbraw/zinc/63/57/37/1055635737.db2.gz WNGXEGDPOGAZGW-UHFFFAOYSA-N 1 2 318.230 4.217 20 0 DIADLO CCCOc1ccc(Br)c(C[N@@H+](C)C(C)C)c1F ZINC001238292491 1055635742 /nfs/dbraw/zinc/63/57/42/1055635742.db2.gz WNGXEGDPOGAZGW-UHFFFAOYSA-N 1 2 318.230 4.217 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC001238338477 1055640482 /nfs/dbraw/zinc/64/04/82/1055640482.db2.gz JYMGDUTXHVNOHC-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC001238338477 1055640492 /nfs/dbraw/zinc/64/04/92/1055640492.db2.gz JYMGDUTXHVNOHC-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2c(F)ccc(Cl)c2OC)cc1 ZINC001238340843 1055640683 /nfs/dbraw/zinc/64/06/83/1055640683.db2.gz PIMHEAWGJONQNB-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2c(F)ccc(Cl)c2OC)cc1 ZINC001238340843 1055640690 /nfs/dbraw/zinc/64/06/90/1055640690.db2.gz PIMHEAWGJONQNB-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO CC1(C)C[NH+](Cc2ccc(OCc3ccccc3)c(F)c2F)C1 ZINC001238347402 1055642801 /nfs/dbraw/zinc/64/28/01/1055642801.db2.gz KPJYSTOEAZXXQC-UHFFFAOYSA-N 1 2 317.379 4.386 20 0 DIADLO CCCCC[C@H]1CCCN1C(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001595874048 1055642904 /nfs/dbraw/zinc/64/29/04/1055642904.db2.gz IZKSQFQEHOBNDO-DLBZAZTESA-N 1 2 305.466 4.042 20 0 DIADLO Fc1ccc(C[NH+]2CC(C(F)F)C2)cc1OCc1ccccc1 ZINC001238346480 1055643889 /nfs/dbraw/zinc/64/38/89/1055643889.db2.gz CVJYROPVMNOVSO-UHFFFAOYSA-N 1 2 321.342 4.102 20 0 DIADLO C[C@@H]1CC[N@@H+]1Cc1ccc(F)c(OCc2ccccc2)c1F ZINC001238350739 1055644246 /nfs/dbraw/zinc/64/42/46/1055644246.db2.gz YFBPONNNFZFBAU-CYBMUJFWSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@@H]1CC[N@H+]1Cc1ccc(F)c(OCc2ccccc2)c1F ZINC001238350739 1055644257 /nfs/dbraw/zinc/64/42/57/1055644257.db2.gz YFBPONNNFZFBAU-CYBMUJFWSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccnc(Br)c1Cl ZINC001238370704 1055646209 /nfs/dbraw/zinc/64/62/09/1055646209.db2.gz JJGSDYFYVYYVKU-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ccnc(Br)c1Cl ZINC001238370704 1055646213 /nfs/dbraw/zinc/64/62/13/1055646213.db2.gz JJGSDYFYVYYVKU-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1ccnc(Br)c1Cl ZINC001238370709 1055646758 /nfs/dbraw/zinc/64/67/58/1055646758.db2.gz JJGSDYFYVYYVKU-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c(Cl)cn1 ZINC001238361904 1055647040 /nfs/dbraw/zinc/64/70/40/1055647040.db2.gz RVUPLMARZUPTTE-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c(Cl)cn1 ZINC001238361904 1055647048 /nfs/dbraw/zinc/64/70/48/1055647048.db2.gz RVUPLMARZUPTTE-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccnc(Br)c2Cl)[C@H](C)C1 ZINC001238386260 1055647861 /nfs/dbraw/zinc/64/78/61/1055647861.db2.gz YFXLJNUZSXICJW-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccnc(Br)c2Cl)[C@H](C)C1 ZINC001238386260 1055647870 /nfs/dbraw/zinc/64/78/70/1055647870.db2.gz YFXLJNUZSXICJW-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2ccnc(Br)c2Cl)[C@H]1C ZINC001238377700 1055648486 /nfs/dbraw/zinc/64/84/86/1055648486.db2.gz QSDTWHITLDGSSM-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2ccnc(Br)c2Cl)[C@H]1C ZINC001238377700 1055648487 /nfs/dbraw/zinc/64/84/87/1055648487.db2.gz QSDTWHITLDGSSM-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO CC[C@H]1CCC[N@H+](Cc2ccnc(Br)c2Cl)C1 ZINC001238386316 1055649204 /nfs/dbraw/zinc/64/92/04/1055649204.db2.gz YURXWVHWHXWAKL-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@H]1CCC[N@@H+](Cc2ccnc(Br)c2Cl)C1 ZINC001238386316 1055649213 /nfs/dbraw/zinc/64/92/13/1055649213.db2.gz YURXWVHWHXWAKL-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1c(Cl)cncc1Br ZINC001238391251 1055650436 /nfs/dbraw/zinc/65/04/36/1055650436.db2.gz QFBKNYHJRUOURU-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1c(Cl)cncc1Br ZINC001238391251 1055650438 /nfs/dbraw/zinc/65/04/38/1055650438.db2.gz QFBKNYHJRUOURU-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(Cl)cncc2Br)[C@@H](C)C1 ZINC001238394679 1055651393 /nfs/dbraw/zinc/65/13/93/1055651393.db2.gz UJKRTKSZMOSCAD-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO CC1(C)CC[C@@H]1C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC001538541598 1055654665 /nfs/dbraw/zinc/65/46/65/1055654665.db2.gz AFBZZEVCJDWHAW-QGZVFWFLSA-N 1 2 323.440 4.261 20 0 DIADLO CC1(C)CC[C@H]1C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC001538541597 1055654798 /nfs/dbraw/zinc/65/47/98/1055654798.db2.gz AFBZZEVCJDWHAW-KRWDZBQOSA-N 1 2 323.440 4.261 20 0 DIADLO CCOc1cccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)c1 ZINC000921621173 1055657175 /nfs/dbraw/zinc/65/71/75/1055657175.db2.gz BSAXZAGGBFURBX-ZDUSSCGKSA-N 1 2 302.418 4.222 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+]2CCOC3(CCCCC3)C2)c1F ZINC001238429438 1055657979 /nfs/dbraw/zinc/65/79/79/1055657979.db2.gz HUMRHQGYFIWKLG-UHFFFAOYSA-N 1 2 321.436 4.148 20 0 DIADLO CC(C)Oc1cccc(C[N@H+]2CCOC3(CCCCC3)C2)c1F ZINC001238429438 1055657985 /nfs/dbraw/zinc/65/79/85/1055657985.db2.gz HUMRHQGYFIWKLG-UHFFFAOYSA-N 1 2 321.436 4.148 20 0 DIADLO CC(C)Oc1ccc(C[N@H+](Cc2ccco2)C2CC2)c(F)c1 ZINC001238449909 1055660532 /nfs/dbraw/zinc/66/05/32/1055660532.db2.gz PCRCJDRDWMZMRE-UHFFFAOYSA-N 1 2 303.377 4.371 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+](Cc2ccco2)C2CC2)c(F)c1 ZINC001238449909 1055660539 /nfs/dbraw/zinc/66/05/39/1055660539.db2.gz PCRCJDRDWMZMRE-UHFFFAOYSA-N 1 2 303.377 4.371 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1ccc(OC(C)C)cc1F ZINC001238449162 1055661080 /nfs/dbraw/zinc/66/10/80/1055661080.db2.gz HKVANQBHIVZCJE-UHFFFAOYSA-N 1 2 302.393 4.030 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1ccc(OC(C)C)cc1F ZINC001238449162 1055661092 /nfs/dbraw/zinc/66/10/92/1055661092.db2.gz HKVANQBHIVZCJE-UHFFFAOYSA-N 1 2 302.393 4.030 20 0 DIADLO CC(C)Oc1cncc(C[N@H+](C)Cc2ccccc2Cl)c1 ZINC001238465357 1055665670 /nfs/dbraw/zinc/66/56/70/1055665670.db2.gz KLIQCISTMNUMGE-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO CC(C)Oc1cncc(C[N@@H+](C)Cc2ccccc2Cl)c1 ZINC001238465357 1055665678 /nfs/dbraw/zinc/66/56/78/1055665678.db2.gz KLIQCISTMNUMGE-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)c1F ZINC001238526296 1055681060 /nfs/dbraw/zinc/68/10/60/1055681060.db2.gz BOQDJYINYUEPPJ-LLVKDONJSA-N 1 2 319.342 4.229 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@H+]2CCC(F)(F)[C@H](C)C2)c1F ZINC001238526296 1055681067 /nfs/dbraw/zinc/68/10/67/1055681067.db2.gz BOQDJYINYUEPPJ-LLVKDONJSA-N 1 2 319.342 4.229 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)c1F ZINC001238534006 1055681215 /nfs/dbraw/zinc/68/12/15/1055681215.db2.gz ZROMPWJQWOSHIC-LLVKDONJSA-N 1 2 323.305 4.136 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C2)c1F ZINC001238534006 1055681222 /nfs/dbraw/zinc/68/12/22/1055681222.db2.gz ZROMPWJQWOSHIC-LLVKDONJSA-N 1 2 323.305 4.136 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc(F)c(-c2ccncc2)c1 ZINC001238553998 1055684187 /nfs/dbraw/zinc/68/41/87/1055684187.db2.gz BUBAGZRGEDRRPO-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccc(F)c(-c2ccncc2)c1 ZINC001238553998 1055684192 /nfs/dbraw/zinc/68/41/92/1055684192.db2.gz BUBAGZRGEDRRPO-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3c(C)ccc4ccccc43)ccn12 ZINC001596351258 1055700856 /nfs/dbraw/zinc/70/08/56/1055700856.db2.gz FGTUGUDIVZBFSB-UHFFFAOYSA-N 1 2 316.360 4.324 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)Cc3cccc(F)c3)co2)cc1 ZINC000043579557 1055702779 /nfs/dbraw/zinc/70/27/79/1055702779.db2.gz RNSTWYUXAWBHSL-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)Cc3cccc(F)c3)co2)cc1 ZINC000043579557 1055702780 /nfs/dbraw/zinc/70/27/80/1055702780.db2.gz RNSTWYUXAWBHSL-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO C[C@@H]1CC[C@](C)(/C=C\C(=O)Nc2ccn3cc[nH+]c3c2)C1(C)C ZINC001596391618 1055703474 /nfs/dbraw/zinc/70/34/74/1055703474.db2.gz MAJPKGRZVLFSET-YQHRYNEBSA-N 1 2 311.429 4.291 20 0 DIADLO CCCc1ccc(CCCC(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001596391550 1055704024 /nfs/dbraw/zinc/70/40/24/1055704024.db2.gz JKAUHLFMHDSRKM-UHFFFAOYSA-N 1 2 321.424 4.248 20 0 DIADLO C[N@H+](Cc1ccon1)Cc1cccc(-c2ccc(Cl)cn2)c1 ZINC001238641146 1055707115 /nfs/dbraw/zinc/70/71/15/1055707115.db2.gz PBPFYYNZIHGBDL-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1ccon1)Cc1cccc(-c2ccc(Cl)cn2)c1 ZINC001238641146 1055707128 /nfs/dbraw/zinc/70/71/28/1055707128.db2.gz PBPFYYNZIHGBDL-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO Cc1cc(NC(=O)C2(C)CCC(C)CC2)ccc1-n1cc[nH+]c1 ZINC001565582335 1055711424 /nfs/dbraw/zinc/71/14/24/1055711424.db2.gz RTUASZXIJPHWCX-UHFFFAOYSA-N 1 2 311.429 4.336 20 0 DIADLO Cc1cc(OC(C)C)cc(C)c1C[N@H+](C)Cc1cscn1 ZINC001238664423 1055712156 /nfs/dbraw/zinc/71/21/56/1055712156.db2.gz KGHRVKPQOHBPAZ-UHFFFAOYSA-N 1 2 304.459 4.179 20 0 DIADLO Cc1cc(OC(C)C)cc(C)c1C[N@@H+](C)Cc1cscn1 ZINC001238664423 1055712170 /nfs/dbraw/zinc/71/21/70/1055712170.db2.gz KGHRVKPQOHBPAZ-UHFFFAOYSA-N 1 2 304.459 4.179 20 0 DIADLO CSc1ccc(Cl)cc1C[N@@H+]1CCC(=O)[C@H]2CCCC[C@H]21 ZINC001238672432 1055714894 /nfs/dbraw/zinc/71/48/94/1055714894.db2.gz QRHLILXVYQPXDF-LSDHHAIUSA-N 1 2 323.889 4.396 20 0 DIADLO CSc1ccc(Cl)cc1C[N@H+]1CCC(=O)[C@H]2CCCC[C@H]21 ZINC001238672432 1055714904 /nfs/dbraw/zinc/71/49/04/1055714904.db2.gz QRHLILXVYQPXDF-LSDHHAIUSA-N 1 2 323.889 4.396 20 0 DIADLO CSc1ccc(Cl)cc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC001238672435 1055715908 /nfs/dbraw/zinc/71/59/08/1055715908.db2.gz QULLTHLUNTTWPO-UHFFFAOYSA-N 1 2 303.805 4.293 20 0 DIADLO CC(C)Oc1cc(F)ccc1C[N@H+](C)Cc1ccc(Cl)nc1 ZINC001238703420 1055725234 /nfs/dbraw/zinc/72/52/34/1055725234.db2.gz UZRROGYUFHDVRX-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO CC(C)Oc1cc(F)ccc1C[N@@H+](C)Cc1ccc(Cl)nc1 ZINC001238703420 1055725244 /nfs/dbraw/zinc/72/52/44/1055725244.db2.gz UZRROGYUFHDVRX-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO CC(C)Oc1cc(F)ccc1C[N@H+](Cc1ccco1)C1CC1 ZINC001238701366 1055726289 /nfs/dbraw/zinc/72/62/89/1055726289.db2.gz YXOSQLQWRGPNMD-UHFFFAOYSA-N 1 2 303.377 4.371 20 0 DIADLO CC(C)Oc1cc(F)ccc1C[N@@H+](Cc1ccco1)C1CC1 ZINC001238701366 1055726304 /nfs/dbraw/zinc/72/63/04/1055726304.db2.gz YXOSQLQWRGPNMD-UHFFFAOYSA-N 1 2 303.377 4.371 20 0 DIADLO CCCCCCc1ccc(C[N@H+]2CCC(=O)[C@@H](F)CC2)s1 ZINC001238707043 1055729891 /nfs/dbraw/zinc/72/98/91/1055729891.db2.gz SPCJZMYSINZFBL-INIZCTEOSA-N 1 2 311.466 4.374 20 0 DIADLO CCCCCCc1ccc(C[N@@H+]2CCC(=O)[C@@H](F)CC2)s1 ZINC001238707043 1055729900 /nfs/dbraw/zinc/72/99/00/1055729900.db2.gz SPCJZMYSINZFBL-INIZCTEOSA-N 1 2 311.466 4.374 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1ccc(F)c(F)c1Br ZINC001238752704 1055742646 /nfs/dbraw/zinc/74/26/46/1055742646.db2.gz CALICGRCSKSOKB-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1ccc(F)c(F)c1Br ZINC001238752704 1055742660 /nfs/dbraw/zinc/74/26/60/1055742660.db2.gz CALICGRCSKSOKB-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO CC(C)(C)c1nc(C[NH2+]Cc2nccc3c2CCCC3)cs1 ZINC000921641928 1055750492 /nfs/dbraw/zinc/75/04/92/1055750492.db2.gz CTEYRNFHFHUKIR-UHFFFAOYSA-N 1 2 315.486 4.004 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)cc1Cl ZINC001238788220 1055752269 /nfs/dbraw/zinc/75/22/69/1055752269.db2.gz LJXYWIYTUMUJBF-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@@H]2c2cccnc2)cc1Cl ZINC001238788220 1055752279 /nfs/dbraw/zinc/75/22/79/1055752279.db2.gz LJXYWIYTUMUJBF-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)Oc1cc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c(F)cn1 ZINC001238794715 1055753785 /nfs/dbraw/zinc/75/37/85/1055753785.db2.gz SJMSSJNODOZJCB-AWEZNQCLSA-N 1 2 314.404 4.127 20 0 DIADLO CC(C)Oc1cc(C[N@H+]2CCc3ccccc3[C@@H]2C)c(F)cn1 ZINC001238794715 1055753794 /nfs/dbraw/zinc/75/37/94/1055753794.db2.gz SJMSSJNODOZJCB-AWEZNQCLSA-N 1 2 314.404 4.127 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1cc(OC(C)C)ncc1F ZINC001238800338 1055755046 /nfs/dbraw/zinc/75/50/46/1055755046.db2.gz UYKXOHQLOOPJPK-UHFFFAOYSA-N 1 2 308.422 4.092 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1cc(OC(C)C)ncc1F ZINC001238800338 1055755056 /nfs/dbraw/zinc/75/50/56/1055755056.db2.gz UYKXOHQLOOPJPK-UHFFFAOYSA-N 1 2 308.422 4.092 20 0 DIADLO CCc1cc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)sc1C ZINC000047533716 1055757992 /nfs/dbraw/zinc/75/79/92/1055757992.db2.gz ARYXWXOAVWRRCS-UHFFFAOYSA-N 1 2 311.410 4.057 20 0 DIADLO COc1ccc(-c2ccc(C3CC3)cc2)cc1C[NH+]1CCOCC1 ZINC001238836881 1055759957 /nfs/dbraw/zinc/75/99/57/1055759957.db2.gz DEBWYYARVUIKJI-UHFFFAOYSA-N 1 2 323.436 4.072 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2Cl)nn1C ZINC000282162663 1055765157 /nfs/dbraw/zinc/76/51/57/1055765157.db2.gz LTOCDNLWXFMEFT-MNOVXSKESA-N 1 2 312.244 4.447 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCn3c(cc4ccccc43)C2)c(C)n1 ZINC000347513504 1055768275 /nfs/dbraw/zinc/76/82/75/1055768275.db2.gz HILMCPZISNFKGC-UHFFFAOYSA-N 1 2 305.425 4.059 20 0 DIADLO Cc1ccc(C[N@H+]2CCCn3c(cc4ccccc43)C2)c(C)n1 ZINC000347513504 1055768285 /nfs/dbraw/zinc/76/82/85/1055768285.db2.gz HILMCPZISNFKGC-UHFFFAOYSA-N 1 2 305.425 4.059 20 0 DIADLO CCOc1ccc(Cl)cc1C[NH2+][C@H](C)c1nc(C)cs1 ZINC001649055024 1055776644 /nfs/dbraw/zinc/77/66/44/1055776644.db2.gz VVORBOHBPTWUGV-LLVKDONJSA-N 1 2 310.850 4.354 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2Cl)nn1C ZINC000282197192 1055792990 /nfs/dbraw/zinc/79/29/90/1055792990.db2.gz NSZZXDARUOOXFH-QWRGUYRKSA-N 1 2 312.244 4.447 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC=C(c3ccc(O)cc3)CC2)cs1 ZINC000058505640 1055803034 /nfs/dbraw/zinc/80/30/34/1055803034.db2.gz KXCSSAHBTLPEQD-UHFFFAOYSA-N 1 2 314.454 4.261 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)cs1 ZINC000058505640 1055803047 /nfs/dbraw/zinc/80/30/47/1055803047.db2.gz KXCSSAHBTLPEQD-UHFFFAOYSA-N 1 2 314.454 4.261 20 0 DIADLO CCOc1ccccc1C[NH2+]Cc1coc(-c2cccs2)n1 ZINC000064412051 1055803675 /nfs/dbraw/zinc/80/36/75/1055803675.db2.gz BIJFTAPJOKOZBR-UHFFFAOYSA-N 1 2 314.410 4.092 20 0 DIADLO CCCCOc1ncc(-c2ccccc2Cn2cc[nH+]c2)cc1C ZINC001238963066 1055805702 /nfs/dbraw/zinc/80/57/02/1055805702.db2.gz BZBVSLXXEKTXNN-UHFFFAOYSA-N 1 2 321.424 4.481 20 0 DIADLO Cc1ccccc1C(C)(C)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000058659707 1055810819 /nfs/dbraw/zinc/81/08/19/1055810819.db2.gz QVOGGMNUTMGINN-UHFFFAOYSA-N 1 2 319.408 4.097 20 0 DIADLO CC(C)Oc1ccc(-c2nc3[nH]ccc3c[nH+]2)cc1C(F)(F)F ZINC001238993868 1055816640 /nfs/dbraw/zinc/81/66/40/1055816640.db2.gz HTQGMLNBQHATCW-UHFFFAOYSA-N 1 2 321.302 4.383 20 0 DIADLO Cc1nnc(-c2ccc(-c3ccc(F)c(-n4cc[nH+]c4)c3)cc2)o1 ZINC001239022528 1055827126 /nfs/dbraw/zinc/82/71/26/1055827126.db2.gz HIUZHIDMLLGAQV-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CCC(F)(F)c1ccccc1NC(=O)c1cccc2[nH+]ccn21 ZINC001597541912 1055846095 /nfs/dbraw/zinc/84/60/95/1055846095.db2.gz RQNCJVSFMFWPPB-UHFFFAOYSA-N 1 2 315.323 4.088 20 0 DIADLO c1ccc(NCc2ccc(-c3ccc4c(c3)CCO4)cc2)[nH+]c1 ZINC000060875070 1055853422 /nfs/dbraw/zinc/85/34/22/1055853422.db2.gz FADGCNMHLWBZSI-UHFFFAOYSA-N 1 2 302.377 4.296 20 0 DIADLO CCc1ccc(-c2noc(C[N@H+](C)Cc3ccc(C)cc3)n2)cc1 ZINC000061779491 1055871051 /nfs/dbraw/zinc/87/10/51/1055871051.db2.gz MEEXAYMVFJQXSR-UHFFFAOYSA-N 1 2 321.424 4.239 20 0 DIADLO CCc1ccc(-c2noc(C[N@@H+](C)Cc3ccc(C)cc3)n2)cc1 ZINC000061779491 1055871055 /nfs/dbraw/zinc/87/10/55/1055871055.db2.gz MEEXAYMVFJQXSR-UHFFFAOYSA-N 1 2 321.424 4.239 20 0 DIADLO Fc1cccc(N2CCCC2)c1C[NH2+]Cc1cscc1Cl ZINC000671723898 1055877828 /nfs/dbraw/zinc/87/78/28/1055877828.db2.gz GIQSSPUNIPSWFT-UHFFFAOYSA-N 1 2 324.852 4.431 20 0 DIADLO CC(C)C[C@H](C(=O)N1CC[C@@H](C(C)(C)C)C[C@H]1C)n1cc[nH+]c1 ZINC001569936052 1055878377 /nfs/dbraw/zinc/87/83/77/1055878377.db2.gz GFWMBCZFWGNMLV-BRWVUGGUSA-N 1 2 319.493 4.144 20 0 DIADLO CCc1ccc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)cn1 ZINC000347612436 1055883639 /nfs/dbraw/zinc/88/36/39/1055883639.db2.gz NWCFLGKRSCGENB-NRFANRHFSA-N 1 2 317.436 4.051 20 0 DIADLO CCc1ccc(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)cn1 ZINC000347612436 1055883645 /nfs/dbraw/zinc/88/36/45/1055883645.db2.gz NWCFLGKRSCGENB-NRFANRHFSA-N 1 2 317.436 4.051 20 0 DIADLO Cc1cn2cc(-c3cccc(C(=O)C(F)(F)F)c3)ccc2[nH+]1 ZINC001239387098 1055885879 /nfs/dbraw/zinc/88/58/79/1055885879.db2.gz YPDALBZMPMFPJN-UHFFFAOYSA-N 1 2 304.271 4.055 20 0 DIADLO Cc1noc(C[N@@H+]([C@@H](C)c2ccc3ccccc3c2)C2CC2)n1 ZINC000063577587 1055895973 /nfs/dbraw/zinc/89/59/73/1055895973.db2.gz HJCDTGGYWFMWBZ-ZDUSSCGKSA-N 1 2 307.397 4.257 20 0 DIADLO Cc1noc(C[N@H+]([C@@H](C)c2ccc3ccccc3c2)C2CC2)n1 ZINC000063577587 1055895985 /nfs/dbraw/zinc/89/59/85/1055895985.db2.gz HJCDTGGYWFMWBZ-ZDUSSCGKSA-N 1 2 307.397 4.257 20 0 DIADLO Cc1cc(CNC(=O)C2CC(C)(C)CC(C)(C)C2)cc(C)[nH+]1 ZINC001597956372 1055897383 /nfs/dbraw/zinc/89/73/83/1055897383.db2.gz VJPPUBCYXHXKRZ-UHFFFAOYSA-N 1 2 302.462 4.167 20 0 DIADLO Clc1snnc1C[N@H+](CCc1ccccc1)C1CCCC1 ZINC000063754819 1055901293 /nfs/dbraw/zinc/90/12/93/1055901293.db2.gz VJJMBTFSIZVGRM-UHFFFAOYSA-N 1 2 321.877 4.179 20 0 DIADLO Clc1snnc1C[N@@H+](CCc1ccccc1)C1CCCC1 ZINC000063754819 1055901304 /nfs/dbraw/zinc/90/13/04/1055901304.db2.gz VJJMBTFSIZVGRM-UHFFFAOYSA-N 1 2 321.877 4.179 20 0 DIADLO Cc1cccc(-c2ccc(-c3ccc(-n4cc[nH+]c4)cc3)nn2)c1 ZINC001239488163 1055904937 /nfs/dbraw/zinc/90/49/37/1055904937.db2.gz JJGHPCKQTZSLPA-UHFFFAOYSA-N 1 2 312.376 4.305 20 0 DIADLO Cn1ccc2c[nH+]c(-c3ccc(Oc4ccccc4)cc3)nc21 ZINC001239493144 1055907790 /nfs/dbraw/zinc/90/77/90/1055907790.db2.gz OEFHWUBSFDFODU-UHFFFAOYSA-N 1 2 301.349 4.428 20 0 DIADLO Fc1cccc(F)c1C1([NH2+][C@H]2CCCc3cccnc32)CCC1 ZINC000624345714 1055913574 /nfs/dbraw/zinc/91/35/74/1055913574.db2.gz SFJQKSXLVAZXPH-INIZCTEOSA-N 1 2 314.379 4.406 20 0 DIADLO CCc1[nH]nc(Cl)c1C[NH2+]Cc1cccc(Cl)c1Cl ZINC001620754754 1055928640 /nfs/dbraw/zinc/92/86/40/1055928640.db2.gz BBDUURDWCQCRHN-UHFFFAOYSA-N 1 2 318.635 4.222 20 0 DIADLO CCCCc1nc(C[N@H+](C2CC2)C2CCC(CC)CC2)no1 ZINC000064932117 1055931141 /nfs/dbraw/zinc/93/11/41/1055931141.db2.gz YBSRKHTXZYPONH-UHFFFAOYSA-N 1 2 305.466 4.345 20 0 DIADLO CCCCc1nc(C[N@@H+](C2CC2)C2CCC(CC)CC2)no1 ZINC000064932117 1055931149 /nfs/dbraw/zinc/93/11/49/1055931149.db2.gz YBSRKHTXZYPONH-UHFFFAOYSA-N 1 2 305.466 4.345 20 0 DIADLO Cc1oc2ccccc2c1C[NH2+]Cc1nc(C)c2ccccc2n1 ZINC001620763922 1055935076 /nfs/dbraw/zinc/93/50/76/1055935076.db2.gz SAOXRSDXVQFIJX-UHFFFAOYSA-N 1 2 317.392 4.283 20 0 DIADLO COc1cc(C)c(C)cc1NCc1ccc(-n2cc[nH+]c2)cc1 ZINC001621002525 1055971266 /nfs/dbraw/zinc/97/12/66/1055971266.db2.gz ZODROMPHTKWEEA-UHFFFAOYSA-N 1 2 307.397 4.110 20 0 DIADLO CNc1ccc(C)cc1C[NH2+][C@@H](CCc1ccccc1)C(F)F ZINC001621006670 1055974319 /nfs/dbraw/zinc/97/43/19/1055974319.db2.gz QFGUBGLEFVQIMK-SFHVURJKSA-N 1 2 318.411 4.393 20 0 DIADLO Cc1cc(-c2ccc(C(C)(C)C)cc2)c[nH+]c1N1CCOCC1 ZINC001239605656 1055974438 /nfs/dbraw/zinc/97/44/38/1055974438.db2.gz AYLHVKJTUMCVBP-UHFFFAOYSA-N 1 2 310.441 4.191 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1ccc(C(C)(C)C)cc1 ZINC001239605633 1055974769 /nfs/dbraw/zinc/97/47/69/1055974769.db2.gz ABANVZBXIXAKJI-UHFFFAOYSA-N 1 2 310.441 4.191 20 0 DIADLO Cc1cccc(-c2ccc(NCc3cccc4[nH+]ccn43)nc2)c1 ZINC001621012298 1055977735 /nfs/dbraw/zinc/97/77/35/1055977735.db2.gz NTGDJPFUJDUNAK-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO CC(C)Cc1ccccc1C[NH2+]Cc1nc(C(C)(C)C)co1 ZINC001621014334 1055979816 /nfs/dbraw/zinc/97/98/16/1055979816.db2.gz MCAPNQHJKKFVEE-UHFFFAOYSA-N 1 2 300.446 4.460 20 0 DIADLO c1coc([C@@H]([NH2+]Cc2cc3cccnc3o2)c2ccccc2)c1 ZINC001620704595 1055983306 /nfs/dbraw/zinc/98/33/06/1055983306.db2.gz UOJHUZXBANFWMF-SFHVURJKSA-N 1 2 304.349 4.300 20 0 DIADLO FC[C@H]([NH2+]Cc1cc(F)c(F)c(F)c1)c1ccc(F)cc1 ZINC001621040369 1056000658 /nfs/dbraw/zinc/00/06/58/1056000658.db2.gz UJCMMNQLUJNGLX-AWEZNQCLSA-N 1 2 301.258 4.043 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2cccc(-c3ccccc3)c2)cc1 ZINC001239652417 1056003205 /nfs/dbraw/zinc/00/32/05/1056003205.db2.gz RECHPRSWHBIPLP-HXUWFJFHSA-N 1 2 317.388 4.193 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cnc(Cl)c(C)c1 ZINC001621043375 1056005055 /nfs/dbraw/zinc/00/50/55/1056005055.db2.gz DKJOYFCCJKIENE-UHFFFAOYSA-N 1 2 307.850 4.304 20 0 DIADLO COc1cccc(COc2ccc(C[NH2+][C@H](C)C(F)F)cc2)c1 ZINC001621045791 1056006631 /nfs/dbraw/zinc/00/66/31/1056006631.db2.gz HSBDPYFJFJFCPT-CYBMUJFWSA-N 1 2 321.367 4.017 20 0 DIADLO Cc1ccc2ncc(CNc3[nH+]c4ccccc4n3C(C)C)n2c1 ZINC001621051356 1056010813 /nfs/dbraw/zinc/01/08/13/1056010813.db2.gz BACRPBHZSVBNNK-UHFFFAOYSA-N 1 2 319.412 4.185 20 0 DIADLO CCOc1cccc(CNc2[nH]c3ccc(Cl)cc3[nH+]2)c1 ZINC001621057127 1056014910 /nfs/dbraw/zinc/01/49/10/1056014910.db2.gz RNINDFQLKZXTKS-UHFFFAOYSA-N 1 2 301.777 4.227 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC(Cc3ccccc3)CC2)c(C)[nH+]1 ZINC001540395510 1056026023 /nfs/dbraw/zinc/02/60/23/1056026023.db2.gz RNQUHUUDQFTARS-UHFFFAOYSA-N 1 2 322.452 4.102 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)CCn2cc[nH+]c2)cc1 ZINC000072622241 1056029902 /nfs/dbraw/zinc/02/99/02/1056029902.db2.gz BSXDGBKLJOENSE-UHFFFAOYSA-N 1 2 321.380 4.013 20 0 DIADLO c1ccc(C[C@@H]([NH2+]Cc2nnc(C3CC3)o2)c2ccccc2)cc1 ZINC000072557397 1056029929 /nfs/dbraw/zinc/02/99/29/1056029929.db2.gz BOYJYKQQJVTCNK-GOSISDBHSA-N 1 2 319.408 4.021 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc(-c3ccc(C)cc3)no2)no1 ZINC000073872437 1056048624 /nfs/dbraw/zinc/04/86/24/1056048624.db2.gz GTSHIZNEOYZNLP-LJQANCHMSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cc(-c3ccc(C)cc3)no2)no1 ZINC000073872437 1056048634 /nfs/dbraw/zinc/04/86/34/1056048634.db2.gz GTSHIZNEOYZNLP-LJQANCHMSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cncc(Oc2ccccc2)c1 ZINC001239751010 1056056931 /nfs/dbraw/zinc/05/69/31/1056056931.db2.gz CDDHFESGGANJRL-UHFFFAOYSA-N 1 2 305.381 4.310 20 0 DIADLO CC[C@@H](CC(C)C)C(=O)N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC001611051911 1056101167 /nfs/dbraw/zinc/10/11/67/1056101167.db2.gz FNVBSBRPNDNLLY-CVEARBPZSA-N 1 2 313.445 4.122 20 0 DIADLO COc1ccc2cc(-c3ccc(Cn4cc[nH+]c4)cn3)ccc2c1 ZINC001239841557 1056104229 /nfs/dbraw/zinc/10/42/29/1056104229.db2.gz UNFNJAFPAUAHTO-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO CCN(C(=O)[C@H](CC(C)C)n1cc[nH+]c1)c1cc(C)cc(C)c1 ZINC001542201903 1056109686 /nfs/dbraw/zinc/10/96/86/1056109686.db2.gz FAWLHCJPHLDCDD-SFHVURJKSA-N 1 2 313.445 4.140 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@@H]2CSc3ccccc32)n1 ZINC000765805461 1056120484 /nfs/dbraw/zinc/12/04/84/1056120484.db2.gz WAYDCJWUGCUOLP-GFCCVEGCSA-N 1 2 304.484 4.377 20 0 DIADLO CC[C@@H](c1ccccc1)N(CC)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001542469374 1056125128 /nfs/dbraw/zinc/12/51/28/1056125128.db2.gz CAJWMWFWQMSHJJ-SFHVURJKSA-N 1 2 307.397 4.176 20 0 DIADLO C/C(=C\C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C)c1ccco1 ZINC001611243943 1056130248 /nfs/dbraw/zinc/13/02/48/1056130248.db2.gz FMXQEYHSWCIVIX-JLHYYAGUSA-N 1 2 307.353 4.020 20 0 DIADLO Cc1cnc(C)c(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c1 ZINC001239913620 1056153103 /nfs/dbraw/zinc/15/31/03/1056153103.db2.gz YSDKHYJJSXTNOC-UHFFFAOYSA-N 1 2 319.408 4.008 20 0 DIADLO Cc1cnc(C)c(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c1 ZINC001239913620 1056153113 /nfs/dbraw/zinc/15/31/13/1056153113.db2.gz YSDKHYJJSXTNOC-UHFFFAOYSA-N 1 2 319.408 4.008 20 0 DIADLO O=C(NC1CCCCC1)c1ccc(-c2ccn3cc[nH+]c3c2)cc1 ZINC001239915238 1056155065 /nfs/dbraw/zinc/15/50/65/1056155065.db2.gz DMRMTRFPIUZOEK-UHFFFAOYSA-N 1 2 319.408 4.064 20 0 DIADLO CC[C@H]1CC[C@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)CC1 ZINC001542877090 1056162911 /nfs/dbraw/zinc/16/29/11/1056162911.db2.gz IWUFVYXRSWALTF-WKILWMFISA-N 1 2 311.429 4.336 20 0 DIADLO Cc1cc(NC(=O)C2(C)CCCCCC2)ccc1-n1cc[nH+]c1 ZINC001542877418 1056163282 /nfs/dbraw/zinc/16/32/82/1056163282.db2.gz VLDRMHLPWQZLNW-UHFFFAOYSA-N 1 2 311.429 4.480 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+]Cc2cn3c(n2)CCCC3)c1Cl ZINC000921658396 1056168351 /nfs/dbraw/zinc/16/83/51/1056168351.db2.gz TYLSRPBZKLKOKX-UHFFFAOYSA-N 1 2 324.255 4.124 20 0 DIADLO Cc1c(Cl)ccc(CNCc2cn3c([nH+]2)CCCC3)c1Cl ZINC000921658396 1056168355 /nfs/dbraw/zinc/16/83/55/1056168355.db2.gz TYLSRPBZKLKOKX-UHFFFAOYSA-N 1 2 324.255 4.124 20 0 DIADLO CCc1cc(NCc2nc(-c3ccccc3)cs2)nc(CC)[nH+]1 ZINC001611792277 1056191299 /nfs/dbraw/zinc/19/12/99/1056191299.db2.gz YWTVTAWOPRUFJQ-UHFFFAOYSA-N 1 2 324.453 4.337 20 0 DIADLO Cc1nc(N2CCC(Cc3cccc(F)c3)CC2)c(C)c(C)[nH+]1 ZINC001611815187 1056193923 /nfs/dbraw/zinc/19/39/23/1056193923.db2.gz RPOQXAIEWCHECL-UHFFFAOYSA-N 1 2 313.420 4.000 20 0 DIADLO CCCOc1ccc(-c2cc(-n3ccnc3)cc[nH+]2)c(F)c1F ZINC001239965869 1056203981 /nfs/dbraw/zinc/20/39/81/1056203981.db2.gz ZMZXCUBEWXCAHX-UHFFFAOYSA-N 1 2 315.323 4.001 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2ccc(C(C)(C)C)s2)c(C)[nH+]1 ZINC001583941212 1056208917 /nfs/dbraw/zinc/20/89/17/1056208917.db2.gz CTDROKIMNGKAFV-UHFFFAOYSA-N 1 2 316.470 4.296 20 0 DIADLO CC[C@H]1c2ccccc2CCN1c1nc(C)[nH+]c2c1CCCC2 ZINC001611987036 1056218036 /nfs/dbraw/zinc/21/80/36/1056218036.db2.gz KXQNHEOLRLGPHK-IBGZPJMESA-N 1 2 307.441 4.178 20 0 DIADLO Cc1cn2cc(NC(=O)c3cccc(Cl)c3Cl)ccc2[nH+]1 ZINC000624710892 1056218938 /nfs/dbraw/zinc/21/89/38/1056218938.db2.gz WTYYOMDJHSPFHP-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO Cc1cc(N2CC[C@H](c3ccccc3)[C@@H]2C)nc(C2CCC2)[nH+]1 ZINC001612074106 1056233883 /nfs/dbraw/zinc/23/38/83/1056233883.db2.gz VBKWHQRVBDBBOU-YJBOKZPZSA-N 1 2 307.441 4.435 20 0 DIADLO CCC(C)(C)C1CCC(CC(=O)Nc2cc[nH+]c(C)c2)CC1 ZINC001584005399 1056234952 /nfs/dbraw/zinc/23/49/52/1056234952.db2.gz SBYDTNGIIBOOMB-UHFFFAOYSA-N 1 2 302.462 4.383 20 0 DIADLO Cc1cc(NC(=O)c2cc3cc(Cl)ccc3s2)c(C)c[nH+]1 ZINC001584009931 1056235814 /nfs/dbraw/zinc/23/58/14/1056235814.db2.gz XPLPETLSUPVQKO-UHFFFAOYSA-N 1 2 316.813 4.241 20 0 DIADLO Cc1nc(N[C@H](C)[C@@H](C)c2ccccc2C(F)(F)F)cc[nH+]1 ZINC001612148803 1056245625 /nfs/dbraw/zinc/24/56/25/1056245625.db2.gz IWSGACIJMAENAL-GHMZBOCLSA-N 1 2 309.335 4.408 20 0 DIADLO CC[C@@H](C)[C@H]1CCCCN1c1nc2ccccc2n2c[nH+]cc12 ZINC001612199771 1056252856 /nfs/dbraw/zinc/25/28/56/1056252856.db2.gz IGIDVEZXTOGMOM-GDBMZVCRSA-N 1 2 308.429 4.288 20 0 DIADLO Cc1cc(N2CCC(c3ccsc3)CC2)nc(C2CCC2)[nH+]1 ZINC001612272309 1056264095 /nfs/dbraw/zinc/26/40/95/1056264095.db2.gz FLPJMXSOUIBMFN-UHFFFAOYSA-N 1 2 313.470 4.498 20 0 DIADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccc(-c2ccccc2)cc1F ZINC001543643722 1056270604 /nfs/dbraw/zinc/27/06/04/1056270604.db2.gz HYEBUHTYIDIWEB-CYBMUJFWSA-N 1 2 323.371 4.033 20 0 DIADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccc(-c2ccccc2)cc1F ZINC001543643722 1056270618 /nfs/dbraw/zinc/27/06/18/1056270618.db2.gz HYEBUHTYIDIWEB-CYBMUJFWSA-N 1 2 323.371 4.033 20 0 DIADLO C/C(=C\C(=O)NCc1cc(C)[nH+]c(C)c1)c1ccccc1Cl ZINC001584183143 1056277108 /nfs/dbraw/zinc/27/71/08/1056277108.db2.gz DPFVXMUADIAOTQ-XYOKQWHBSA-N 1 2 314.816 4.072 20 0 DIADLO Cc1nc(N[C@@H]2CCCc3c(F)cccc32)c2c([nH+]1)CCCC2 ZINC001612438426 1056288925 /nfs/dbraw/zinc/28/89/25/1056288925.db2.gz IDQOEALPYMJYIY-QGZVFWFLSA-N 1 2 311.404 4.292 20 0 DIADLO Cc1cc(N2CCC[C@@H]2c2ccc(F)cc2C)nc(C2CC2)[nH+]1 ZINC001612484458 1056294459 /nfs/dbraw/zinc/29/44/59/1056294459.db2.gz SBSVSAHGNVOIGC-QGZVFWFLSA-N 1 2 311.404 4.451 20 0 DIADLO CC(C)(C)[C@@H]1CCC[C@H]1Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001612471900 1056295462 /nfs/dbraw/zinc/29/54/62/1056295462.db2.gz ZXKDOCXYZVJTFL-ZIAGYGMSSA-N 1 2 315.465 4.208 20 0 DIADLO CCCN(Cc1ccccc1F)c1cc(CC)[nH+]c(CC)n1 ZINC001612615638 1056309774 /nfs/dbraw/zinc/30/97/74/1056309774.db2.gz BNJLYUGJCXNXRU-UHFFFAOYSA-N 1 2 301.409 4.157 20 0 DIADLO CCc1cc(N[C@@H](CCc2ccccc2)C(F)F)nc(CC)[nH+]1 ZINC001612615821 1056310915 /nfs/dbraw/zinc/31/09/15/1056310915.db2.gz JILYEKQBCTVLDJ-HNNXBMFYSA-N 1 2 319.399 4.280 20 0 DIADLO CC(C)c1cc(N[C@H](c2ccccc2)[C@H](C)O)nc(C(C)C)[nH+]1 ZINC001612656531 1056316531 /nfs/dbraw/zinc/31/65/31/1056316531.db2.gz DHXLOLKMVDXGJR-KSSFIOAISA-N 1 2 313.445 4.257 20 0 DIADLO CC(C)CNC(=O)c1cccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001240092631 1056317662 /nfs/dbraw/zinc/31/76/62/1056317662.db2.gz HORRTCXMPZYUEU-UHFFFAOYSA-N 1 2 319.408 4.130 20 0 DIADLO CCc1cc(N2CCC[C@]2(C)Cc2cccc(C)c2)nc(C)[nH+]1 ZINC001612678723 1056319092 /nfs/dbraw/zinc/31/90/92/1056319092.db2.gz OKXAFGJKFDLARE-HXUWFJFHSA-N 1 2 309.457 4.257 20 0 DIADLO C/C=C/C[C@H]1CCCN(c2nc3ccccc3n3c[nH+]cc23)C1 ZINC001612685300 1056319412 /nfs/dbraw/zinc/31/94/12/1056319412.db2.gz PYZBOEBVZNNXCA-FAAWYNLUSA-N 1 2 306.413 4.065 20 0 DIADLO Cc1cc(NCc2ccc(-c3c[nH]cn3)cc2)nc(C2CCC2)[nH+]1 ZINC001612722015 1056322911 /nfs/dbraw/zinc/32/29/11/1056322911.db2.gz GJDSHSRMQHUXJZ-UHFFFAOYSA-N 1 2 319.412 4.055 20 0 DIADLO Cc1cccc(Oc2cc(C[NH2+][C@H](C)c3ncc[nH]3)ccn2)c1C ZINC000353515920 1056326139 /nfs/dbraw/zinc/32/61/39/1056326139.db2.gz IMLXAAMUMSXZNC-OAHLLOKOSA-N 1 2 322.412 4.065 20 0 DIADLO COc1cccc2c(N[C@H]3CCNc4ccccc43)cc[nH+]c12 ZINC001168645615 1056342454 /nfs/dbraw/zinc/34/24/54/1056342454.db2.gz QUESBDOTMMSEST-INIZCTEOSA-N 1 2 305.381 4.212 20 0 DIADLO CC(C)c1cc(N[C@H](CCO)C2CCCC2)nc(C(C)C)[nH+]1 ZINC001612983991 1056343202 /nfs/dbraw/zinc/34/32/02/1056343202.db2.gz SRTDJGKNOVFJQV-OAHLLOKOSA-N 1 2 305.466 4.077 20 0 DIADLO Cc1ccc(C)c(C2CCN(c3nc(C)[nH+]c(C)c3C)CC2)c1 ZINC001613029634 1056346557 /nfs/dbraw/zinc/34/65/57/1056346557.db2.gz AHTHUTLIVUQQRU-UHFFFAOYSA-N 1 2 309.457 4.403 20 0 DIADLO CCCCNc1nnc(SCc2ccc(C)[nH+]c2C)s1 ZINC001613123405 1056352844 /nfs/dbraw/zinc/35/28/44/1056352844.db2.gz NTDCRHXDEDYFPK-UHFFFAOYSA-N 1 2 308.476 4.054 20 0 DIADLO c1[nH+]c(SC[C@@H]2CC3(CO2)CCCCC3)n2ccccc12 ZINC001613234119 1056361806 /nfs/dbraw/zinc/36/18/06/1056361806.db2.gz FBLZENMWQFIONW-HNNXBMFYSA-N 1 2 302.443 4.166 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@H]2[C@H](c3ccccc3)C2(C)C)c(C)[nH+]1 ZINC001584532753 1056362326 /nfs/dbraw/zinc/36/23/26/1056362326.db2.gz XNCCISKBEARVAD-HKUYNNGSSA-N 1 2 322.452 4.176 20 0 DIADLO C[C@H](c1ccc(F)c(Cl)c1)[N@@H+]1CCOc2ccccc2C1 ZINC000108721084 1056370073 /nfs/dbraw/zinc/37/00/73/1056370073.db2.gz XONYLAIXQVKBMW-GFCCVEGCSA-N 1 2 305.780 4.435 20 0 DIADLO C[C@H](c1ccc(F)c(Cl)c1)[N@H+]1CCOc2ccccc2C1 ZINC000108721084 1056370085 /nfs/dbraw/zinc/37/00/85/1056370085.db2.gz XONYLAIXQVKBMW-GFCCVEGCSA-N 1 2 305.780 4.435 20 0 DIADLO Cc1nc(OCc2ccccc2)ccc1-c1ccc2[nH+]ccn2c1 ZINC001240219329 1056375428 /nfs/dbraw/zinc/37/54/28/1056375428.db2.gz GRBYVYSJEIMCLG-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO CCOc1ccc(-c2ccc3[nH+]ccn3c2)c(C(F)(F)F)c1 ZINC001240218835 1056375665 /nfs/dbraw/zinc/37/56/65/1056375665.db2.gz LNHBOALPWPSYAB-UHFFFAOYSA-N 1 2 306.287 4.419 20 0 DIADLO CCOC(=O)c1cc2c(ccc(-c3ccc4[nH+]ccn4c3)c2C)o1 ZINC001240218858 1056376044 /nfs/dbraw/zinc/37/60/44/1056376044.db2.gz MPEXQYRYCQZNLY-UHFFFAOYSA-N 1 2 320.348 4.233 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1c2cc[nH]c2ccc1F ZINC001240225507 1056381672 /nfs/dbraw/zinc/38/16/72/1056381672.db2.gz FXGXNEFTWQNYHB-UHFFFAOYSA-N 1 2 307.328 4.168 20 0 DIADLO c1cc(-c2cc[nH+]c(N3CCCC3)c2)cc(N2CCCCC2)c1 ZINC001240251701 1056391086 /nfs/dbraw/zinc/39/10/86/1056391086.db2.gz PEIKMVBALUCHEA-UHFFFAOYSA-N 1 2 307.441 4.339 20 0 DIADLO Fc1ccc(-c2ccc(C(F)(F)F)nc2)cc1-n1cc[nH+]c1 ZINC001240269906 1056403892 /nfs/dbraw/zinc/40/38/92/1056403892.db2.gz KXQUAGWGHIMTLX-UHFFFAOYSA-N 1 2 307.250 4.092 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000303733260 1056407483 /nfs/dbraw/zinc/40/74/83/1056407483.db2.gz FLDPZGVHYLLFIY-RBUKOAKNSA-N 1 2 317.379 4.489 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000303733260 1056407486 /nfs/dbraw/zinc/40/74/86/1056407486.db2.gz FLDPZGVHYLLFIY-RBUKOAKNSA-N 1 2 317.379 4.489 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(F)c2occc21 ZINC001544349982 1056413286 /nfs/dbraw/zinc/41/32/86/1056413286.db2.gz HUYDKZADBUBNEM-UHFFFAOYSA-N 1 2 321.311 4.214 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cc(C(F)(F)F)nn2C)c1 ZINC001240291409 1056416057 /nfs/dbraw/zinc/41/60/57/1056416057.db2.gz GUKBVBVYIQBKKS-UHFFFAOYSA-N 1 2 311.351 4.261 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(F)c2OC(F)(F)F)CCS1 ZINC001621175007 1056426061 /nfs/dbraw/zinc/42/60/61/1056426061.db2.gz NTFSKZHRYWIEGL-UHFFFAOYSA-N 1 2 323.355 4.052 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(F)c2OC(F)(F)F)CCS1 ZINC001621175007 1056426064 /nfs/dbraw/zinc/42/60/64/1056426064.db2.gz NTFSKZHRYWIEGL-UHFFFAOYSA-N 1 2 323.355 4.052 20 0 DIADLO Cc1cc(NC(=O)c2sccc2Cl)ccc1-n1cc[nH+]c1 ZINC001584948936 1056449742 /nfs/dbraw/zinc/44/97/42/1056449742.db2.gz UCWDRVSQSKOHDK-UHFFFAOYSA-N 1 2 317.801 4.148 20 0 DIADLO Cc1cc(NC(=O)[C@H]2C[C@H](C)C[C@H](C)C2)ccc1-n1cc[nH+]c1 ZINC001614884214 1056455830 /nfs/dbraw/zinc/45/58/30/1056455830.db2.gz QIISMCFROGHEFR-FOLVSLTJSA-N 1 2 311.429 4.192 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2cccc3c2OCC3)cs1 ZINC000921758229 1056465184 /nfs/dbraw/zinc/46/51/84/1056465184.db2.gz KSFAHNRQSIJWLL-GFCCVEGCSA-N 1 2 302.443 4.052 20 0 DIADLO COc1c(C)c[nH+]c(CNC(=O)C(CC(C)C)CC(C)C)c1C ZINC001544609890 1056466461 /nfs/dbraw/zinc/46/64/61/1056466461.db2.gz YTCNXYZANFXCMZ-UHFFFAOYSA-N 1 2 320.477 4.032 20 0 DIADLO COc1ccccc1Cc1cn(Cc2ccccc2SC)c[nH+]1 ZINC001615065046 1056467405 /nfs/dbraw/zinc/46/74/05/1056467405.db2.gz WIHSBCFDAYQTOI-UHFFFAOYSA-N 1 2 324.449 4.253 20 0 DIADLO Cc1ccc(C)c(OC2CC[NH+](C/C(Cl)=C/Cl)CC2)c1 ZINC001615264890 1056484366 /nfs/dbraw/zinc/48/43/66/1056484366.db2.gz HENHQXBMLZFAHG-UVTDQMKNSA-N 1 2 314.256 4.466 20 0 DIADLO O=C(CCC1CCCCCC1)NCCCCNc1cccc[nH+]1 ZINC001585107663 1056486197 /nfs/dbraw/zinc/48/61/97/1056486197.db2.gz POJIPTVOQFUMDN-UHFFFAOYSA-N 1 2 317.477 4.141 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cnn(CCC(C)C)c1 ZINC001240418694 1056494765 /nfs/dbraw/zinc/49/47/65/1056494765.db2.gz PJZZCLFOKATRLS-UHFFFAOYSA-N 1 2 312.461 4.290 20 0 DIADLO C[C@H]([NH2+]Cc1cnn(CC2CCC2)c1)c1c(F)cccc1Cl ZINC000921809469 1056510993 /nfs/dbraw/zinc/51/09/93/1056510993.db2.gz JNIUGTQQLDYDLZ-LBPRGKRZSA-N 1 2 321.827 4.327 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1ccc(C(=O)OC(C)(C)C)cc1 ZINC001240440856 1056512580 /nfs/dbraw/zinc/51/25/80/1056512580.db2.gz KTZXQFFVGBMTCT-UHFFFAOYSA-N 1 2 308.381 4.265 20 0 DIADLO Cc1cc(C)cc(Oc2ccc(NC(=O)Cc3[nH]cc[nH+]3)cc2)c1 ZINC001544897963 1056523560 /nfs/dbraw/zinc/52/35/60/1056523560.db2.gz SJBAOOBVSIINAQ-UHFFFAOYSA-N 1 2 321.380 4.000 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2cncc(Cl)c2)[C@@H]1c1ccccc1 ZINC001615524685 1056526188 /nfs/dbraw/zinc/52/61/88/1056526188.db2.gz XGMKJFBPZTVSBK-GUYCJALGSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2cncc(Cl)c2)[C@@H]1c1ccccc1 ZINC001615524685 1056526198 /nfs/dbraw/zinc/52/61/98/1056526198.db2.gz XGMKJFBPZTVSBK-GUYCJALGSA-N 1 2 318.873 4.414 20 0 DIADLO Cc1cn[nH]c1C[N@@H+]1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC001615520063 1056526340 /nfs/dbraw/zinc/52/63/40/1056526340.db2.gz QFCASCILYOOBNE-QGZVFWFLSA-N 1 2 303.837 4.489 20 0 DIADLO Cc1cn[nH]c1C[N@H+]1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC001615520063 1056526356 /nfs/dbraw/zinc/52/63/56/1056526356.db2.gz QFCASCILYOOBNE-QGZVFWFLSA-N 1 2 303.837 4.489 20 0 DIADLO CC[C@@H]1C[N@H+](CCc2c(Cl)cccc2Cl)C[C@H](C)O1 ZINC001615535386 1056528977 /nfs/dbraw/zinc/52/89/77/1056528977.db2.gz DNSLHXRWLQZNPB-NWDGAFQWSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)C[C@H](C)O1 ZINC001615535386 1056528993 /nfs/dbraw/zinc/52/89/93/1056528993.db2.gz DNSLHXRWLQZNPB-NWDGAFQWSA-N 1 2 302.245 4.035 20 0 DIADLO FC(F)(F)c1nc2ccsc2c(-c2ccn3cc[nH+]c3c2)n1 ZINC001240497090 1056537432 /nfs/dbraw/zinc/53/74/32/1056537432.db2.gz YCHXZSDAZUNPBE-UHFFFAOYSA-N 1 2 320.299 4.025 20 0 DIADLO c1cn2ccc(-c3nc(-c4ccccn4)nc4ccccc43)cc2[nH+]1 ZINC001240504003 1056542652 /nfs/dbraw/zinc/54/26/52/1056542652.db2.gz KCIFCEOLXADADV-UHFFFAOYSA-N 1 2 323.359 4.007 20 0 DIADLO c1cn2ccc(-c3nc(N4CCCC4)cc4ccccc43)cc2[nH+]1 ZINC001240504400 1056542861 /nfs/dbraw/zinc/54/28/61/1056542861.db2.gz OGMSSKJJAFQZGX-UHFFFAOYSA-N 1 2 314.392 4.150 20 0 DIADLO c1cn2ccc(-c3ccc(-c4cn5ccccc5n4)cc3)cc2[nH+]1 ZINC001240510575 1056544099 /nfs/dbraw/zinc/54/40/99/1056544099.db2.gz OCIGOAFJVXVTRK-UHFFFAOYSA-N 1 2 310.360 4.316 20 0 DIADLO CCCCOc1c(F)cc(-c2ccn3cc[nH+]c3c2)cc1F ZINC001240513390 1056547213 /nfs/dbraw/zinc/54/72/13/1056547213.db2.gz PKQNPXAQFSNZAQ-UHFFFAOYSA-N 1 2 302.324 4.458 20 0 DIADLO COc1ncc(-c2ccccc2)cc1-c1ccn2cc[nH+]c2c1 ZINC001240518777 1056548606 /nfs/dbraw/zinc/54/86/06/1056548606.db2.gz VACPUSIKMDZXEH-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO FC(F)(F)COc1cccc(CNc2cc3cc[nH]c3c[nH+]2)c1 ZINC000672165285 1056554567 /nfs/dbraw/zinc/55/45/67/1056554567.db2.gz VFVUELGMQIOTGG-UHFFFAOYSA-N 1 2 321.302 4.116 20 0 DIADLO Fc1ccc(CNc2cc3cc[nH]c3c[nH+]2)c(Br)c1 ZINC000672187587 1056561273 /nfs/dbraw/zinc/56/12/73/1056561273.db2.gz BTFOKMNUHFMVGG-UHFFFAOYSA-N 1 2 320.165 4.077 20 0 DIADLO CC[C@@H](C)C[C@@H](C)Nc1[nH+]cccc1CC(=O)OC(C)(C)C ZINC001168688771 1056563946 /nfs/dbraw/zinc/56/39/46/1056563946.db2.gz DMLNPDOAZNZZLE-ZIAGYGMSSA-N 1 2 306.450 4.202 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2ccn(C)c2c1 ZINC001240577168 1056586104 /nfs/dbraw/zinc/58/61/04/1056586104.db2.gz POLIHZSGZRJGNW-UHFFFAOYSA-N 1 2 303.365 4.040 20 0 DIADLO CCc1nc(N2CCCC[C@H]2c2ccccc2OC)cc(C)[nH+]1 ZINC000672244114 1056586933 /nfs/dbraw/zinc/58/69/33/1056586933.db2.gz HTPVFSNQIQDRKG-INIZCTEOSA-N 1 2 311.429 4.088 20 0 DIADLO Clc1cccc2c(N3CCC[C@@H]3C3CCOCC3)cc[nH+]c12 ZINC000672247703 1056587429 /nfs/dbraw/zinc/58/74/29/1056587429.db2.gz WPGQHHXKCJLNNI-MRXNPFEDSA-N 1 2 316.832 4.284 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2coc(-c3ccc(F)cc3)n2)s1 ZINC000076342248 1056622320 /nfs/dbraw/zinc/62/23/20/1056622320.db2.gz AGLYBPVLCQBMNZ-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2coc(-c3ccc(F)cc3)n2)s1 ZINC000076342248 1056622336 /nfs/dbraw/zinc/62/23/36/1056622336.db2.gz AGLYBPVLCQBMNZ-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C=C[C@]1(C)CC[C@H](C)C1(C)C ZINC001616247026 1056623866 /nfs/dbraw/zinc/62/38/66/1056623866.db2.gz PNOHUDRGONLKGG-AORVMSTASA-N 1 2 300.446 4.077 20 0 DIADLO CCCC[N@H+](CC(=O)NC1CCCC1)Cc1ccccc1Cl ZINC000064807402 1056671668 /nfs/dbraw/zinc/67/16/68/1056671668.db2.gz FNRRNNHMYWBOCH-UHFFFAOYSA-N 1 2 322.880 4.001 20 0 DIADLO CCCC[N@@H+](CC(=O)NC1CCCC1)Cc1ccccc1Cl ZINC000064807402 1056671673 /nfs/dbraw/zinc/67/16/73/1056671673.db2.gz FNRRNNHMYWBOCH-UHFFFAOYSA-N 1 2 322.880 4.001 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc3c(c2)CCCO3)cc1F ZINC001240775945 1056696014 /nfs/dbraw/zinc/69/60/14/1056696014.db2.gz MGSXKVQBRWOKQT-UHFFFAOYSA-N 1 2 303.352 4.018 20 0 DIADLO CCOc1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)nc1 ZINC000672578846 1056728187 /nfs/dbraw/zinc/72/81/87/1056728187.db2.gz UYXNWUIZIKXPST-MRXNPFEDSA-N 1 2 302.443 4.125 20 0 DIADLO CCOc1ccc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)nc1 ZINC000672578846 1056728199 /nfs/dbraw/zinc/72/81/99/1056728199.db2.gz UYXNWUIZIKXPST-MRXNPFEDSA-N 1 2 302.443 4.125 20 0 DIADLO Cc1cccn2cc(C[N@@H+]3CC(C)(C)[C@H]3c3cccs3)nc12 ZINC000672578636 1056728410 /nfs/dbraw/zinc/72/84/10/1056728410.db2.gz HMLXEKUBUAKJJC-MRXNPFEDSA-N 1 2 311.454 4.287 20 0 DIADLO Cc1cccn2cc(C[N@H+]3CC(C)(C)[C@H]3c3cccs3)nc12 ZINC000672578636 1056728421 /nfs/dbraw/zinc/72/84/21/1056728421.db2.gz HMLXEKUBUAKJJC-MRXNPFEDSA-N 1 2 311.454 4.287 20 0 DIADLO Cc1c(-c2ccc(Oc3cccnc3)cc2)ccc2[nH+]ccn21 ZINC001240882960 1056739019 /nfs/dbraw/zinc/73/90/19/1056739019.db2.gz BYIHHZYUCYYVKW-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO Cc1ccc(N2CC[NH+](Cc3ccsc3Cl)CC2)cc1C ZINC001616935673 1056743692 /nfs/dbraw/zinc/74/36/92/1056743692.db2.gz IFAPVZQGHOCUPC-UHFFFAOYSA-N 1 2 320.889 4.341 20 0 DIADLO Cn1nc(C(F)(F)F)cc1C[N@@H+]1CCCC[C@H]1c1ccccc1 ZINC001616975328 1056751231 /nfs/dbraw/zinc/75/12/31/1056751231.db2.gz YWTXACLYIIACGB-HNNXBMFYSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1nc(C(F)(F)F)cc1C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC001616975328 1056751242 /nfs/dbraw/zinc/75/12/42/1056751242.db2.gz YWTXACLYIIACGB-HNNXBMFYSA-N 1 2 323.362 4.166 20 0 DIADLO Cc1cc(-c2ccc3ccccc3c2)c[nH+]c1N1CCOCC1 ZINC001240909322 1056753984 /nfs/dbraw/zinc/75/39/84/1056753984.db2.gz CAEAKPKTAZUAOW-UHFFFAOYSA-N 1 2 304.393 4.047 20 0 DIADLO Cc1c2ccccc2sc1[C@@H](C)[NH2+]Cc1noc(C2CC2)n1 ZINC001617030855 1056763304 /nfs/dbraw/zinc/76/33/04/1056763304.db2.gz LLGXGWDDZJSDMG-LLVKDONJSA-N 1 2 313.426 4.321 20 0 DIADLO CC[C@H](CC(=O)N1CCNc2[nH+]cc(C)cc21)c1ccc(C)cc1 ZINC001586630940 1056769863 /nfs/dbraw/zinc/76/98/63/1056769863.db2.gz YWHGNIVMLXRWMF-MRXNPFEDSA-N 1 2 323.440 4.041 20 0 DIADLO CC(C)OC(=O)c1cccc(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001240946682 1056774836 /nfs/dbraw/zinc/77/48/36/1056774836.db2.gz DIFOVXSUXLPCJV-UHFFFAOYSA-N 1 2 320.392 4.164 20 0 DIADLO CCc1cnccc1[C@H](C)[NH2+]Cc1nccc(Cl)c1Cl ZINC001617130366 1056780781 /nfs/dbraw/zinc/78/07/81/1056780781.db2.gz DPYBYMWVCDDLSO-JTQLQIEISA-N 1 2 310.228 4.197 20 0 DIADLO CCCc1cc(N[C@@H](C)CCCC(C)(C)O)nc(CCC)[nH+]1 ZINC001168700577 1056781010 /nfs/dbraw/zinc/78/10/10/1056781010.db2.gz ZEYDYTVFLAKNQV-AWEZNQCLSA-N 1 2 307.482 4.123 20 0 DIADLO Fc1cccc(F)c1C[N@H+](C[C@H]1CCC2(CCC2)O1)C1CC1 ZINC001617169349 1056786815 /nfs/dbraw/zinc/78/68/15/1056786815.db2.gz SMACGGUAKGEIEE-CQSZACIVSA-N 1 2 307.384 4.031 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](C[C@H]1CCC2(CCC2)O1)C1CC1 ZINC001617169349 1056786823 /nfs/dbraw/zinc/78/68/23/1056786823.db2.gz SMACGGUAKGEIEE-CQSZACIVSA-N 1 2 307.384 4.031 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@@H](C(C)C)C1 ZINC001617285378 1056809038 /nfs/dbraw/zinc/80/90/38/1056809038.db2.gz VHLSDJILTZTXGN-WBVHZDCISA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H](C(C)C)C1 ZINC001617285378 1056809044 /nfs/dbraw/zinc/80/90/44/1056809044.db2.gz VHLSDJILTZTXGN-WBVHZDCISA-N 1 2 323.864 4.312 20 0 DIADLO Cc1ccc(-c2c[nH+]c(N3CCOCC3)cc2C)c2ccccc12 ZINC001241005573 1056809980 /nfs/dbraw/zinc/80/99/80/1056809980.db2.gz WKZLJKNEHCVASX-UHFFFAOYSA-N 1 2 318.420 4.355 20 0 DIADLO CCOc1cc(F)cc(-c2cc(F)c(C[NH+](C)C)c(F)c2)c1 ZINC001241026933 1056829301 /nfs/dbraw/zinc/82/93/01/1056829301.db2.gz WXSUJGCJOWELCQ-UHFFFAOYSA-N 1 2 309.331 4.231 20 0 DIADLO CCCCCc1ccc(-c2ccc(C[NH+]3CCOCC3)nc2)cc1 ZINC001241032128 1056830486 /nfs/dbraw/zinc/83/04/86/1056830486.db2.gz JJUVYRBXLPQPAS-UHFFFAOYSA-N 1 2 324.468 4.314 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)on1 ZINC001617590607 1056853306 /nfs/dbraw/zinc/85/33/06/1056853306.db2.gz ORVHTVJUHWSCTJ-OAHLLOKOSA-N 1 2 306.793 4.064 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)on1 ZINC001617590607 1056853311 /nfs/dbraw/zinc/85/33/11/1056853311.db2.gz ORVHTVJUHWSCTJ-OAHLLOKOSA-N 1 2 306.793 4.064 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1CC(=O)Nc1cc(Cl)ccc1Cl ZINC000009997676 1056856103 /nfs/dbraw/zinc/85/61/03/1056856103.db2.gz NLQCOEJSLUJKEL-GHMZBOCLSA-N 1 2 315.244 4.195 20 0 DIADLO CCOc1cc(-c2ccc(-n3cc[nH+]c3)cc2OC)ccc1F ZINC001241070463 1056863784 /nfs/dbraw/zinc/86/37/84/1056863784.db2.gz JRGIGKOKAVFNCF-UHFFFAOYSA-N 1 2 312.344 4.086 20 0 DIADLO CCOc1cc(F)c(-c2cc(N)c(C(F)(F)F)c[nH+]2)cc1F ZINC001241072161 1056865088 /nfs/dbraw/zinc/86/50/88/1056865088.db2.gz XKEKIFQKFMRJBQ-UHFFFAOYSA-N 1 2 318.245 4.027 20 0 DIADLO COc1ccc(-c2cc(C)cn3cc[nH+]c23)cc1C(F)(F)F ZINC001241091168 1056883213 /nfs/dbraw/zinc/88/32/13/1056883213.db2.gz LTRUPGFDDHTWGK-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(F)c(C(F)(F)F)c1 ZINC001241096204 1056887929 /nfs/dbraw/zinc/88/79/29/1056887929.db2.gz BSHYEVIIOOBHKH-UHFFFAOYSA-N 1 2 310.250 4.168 20 0 DIADLO Cc1cc(C)nc(SCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000682451655 1056898101 /nfs/dbraw/zinc/89/81/01/1056898101.db2.gz BASZDEXXNWXIQS-UHFFFAOYSA-N 1 2 309.438 4.236 20 0 DIADLO Cc1ccc([C@H]2CCCCN2C(=O)c2cc3c[nH+]ccc3[nH]2)cc1 ZINC001618009008 1056914267 /nfs/dbraw/zinc/91/42/67/1056914267.db2.gz IGJIAVIXDYTBSN-LJQANCHMSA-N 1 2 319.408 4.239 20 0 DIADLO COc1ccc(F)c(-c2ccc(-c3c[nH+]cn3C)cc2)c1F ZINC001241141548 1056922818 /nfs/dbraw/zinc/92/28/18/1056922818.db2.gz QESWALBQJZQGTQ-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO Clc1ccc([C@@H]2C[N@H+](CCOC3CCCCC3)CCO2)cc1 ZINC001618106807 1056924204 /nfs/dbraw/zinc/92/42/04/1056924204.db2.gz RCGQPWXJWXGKNA-SFHVURJKSA-N 1 2 323.864 4.063 20 0 DIADLO Clc1ccc([C@@H]2C[N@@H+](CCOC3CCCCC3)CCO2)cc1 ZINC001618106807 1056924216 /nfs/dbraw/zinc/92/42/16/1056924216.db2.gz RCGQPWXJWXGKNA-SFHVURJKSA-N 1 2 323.864 4.063 20 0 DIADLO Oc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Br)o2)cc1 ZINC000682995885 1056928871 /nfs/dbraw/zinc/92/88/71/1056928871.db2.gz SWWOJUZJOJJIGW-CQSZACIVSA-N 1 2 322.202 4.085 20 0 DIADLO Oc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Br)o2)cc1 ZINC000682995885 1056928877 /nfs/dbraw/zinc/92/88/77/1056928877.db2.gz SWWOJUZJOJJIGW-CQSZACIVSA-N 1 2 322.202 4.085 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccc(C4CCC4)cc3)ccn12 ZINC001128453963 1056934553 /nfs/dbraw/zinc/93/45/53/1056934553.db2.gz RBXPMLUAVHEANP-UHFFFAOYSA-N 1 2 305.381 4.163 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001618235458 1056939043 /nfs/dbraw/zinc/93/90/43/1056939043.db2.gz SJXXKDGBGLSQKZ-MRXNPFEDSA-N 1 2 323.436 4.053 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001618235458 1056939049 /nfs/dbraw/zinc/93/90/49/1056939049.db2.gz SJXXKDGBGLSQKZ-MRXNPFEDSA-N 1 2 323.436 4.053 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)c1Cl ZINC000922163565 1056940285 /nfs/dbraw/zinc/94/02/85/1056940285.db2.gz CEFSDOUCDBRLOK-RNCFNFMXSA-N 1 2 310.228 4.294 20 0 DIADLO Cn1c[nH+]cc1CNc1cc(C(F)F)nc2ccc(Cl)cc21 ZINC000357589779 1056940790 /nfs/dbraw/zinc/94/07/90/1056940790.db2.gz CUSGYBPVKYFTTQ-UHFFFAOYSA-N 1 2 322.746 4.171 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1c(F)cc(F)cc1F ZINC001241171116 1056945308 /nfs/dbraw/zinc/94/53/08/1056945308.db2.gz IUCSHEWUPKUJIU-UHFFFAOYSA-N 1 2 306.331 4.465 20 0 DIADLO Nc1cc(-c2ccc(C(F)(F)F)c(C(F)(F)F)c2)cc[nH+]1 ZINC001241176092 1056946001 /nfs/dbraw/zinc/94/60/01/1056946001.db2.gz URJBYFZQGSTLPT-UHFFFAOYSA-N 1 2 306.209 4.368 20 0 DIADLO COC(=[NH2+])c1cccc(-c2cccc(O[C@@H]3CCCCO3)c2)c1 ZINC001241217091 1056964615 /nfs/dbraw/zinc/96/46/15/1056964615.db2.gz UURJJWUFHBEIPA-GOSISDBHSA-N 1 2 311.381 4.231 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]C2(c3cccc(F)c3)CCC2)n1 ZINC000922209978 1056972473 /nfs/dbraw/zinc/97/24/73/1056972473.db2.gz JJDMOXSFTWZVGR-UHFFFAOYSA-N 1 2 302.393 4.280 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1nc(C(F)F)nc2ccccc21 ZINC001241240020 1056975743 /nfs/dbraw/zinc/97/57/43/1056975743.db2.gz GNPUNQWKJNQBHV-UHFFFAOYSA-N 1 2 314.339 4.004 20 0 DIADLO CCOc1cccc(F)c1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001241252920 1056981338 /nfs/dbraw/zinc/98/13/38/1056981338.db2.gz YKWYZNFOCNFFPT-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO CCOc1cccc(F)c1-c1ccc(-n2cc[nH+]c2)cc1OC ZINC001241252546 1056981625 /nfs/dbraw/zinc/98/16/25/1056981625.db2.gz PZGVURXNIZHYNM-UHFFFAOYSA-N 1 2 312.344 4.086 20 0 DIADLO CCOc1ccc(-c2ccc(-n3cc[nH+]c3)cc2OC)c(C)c1 ZINC001241273660 1056991903 /nfs/dbraw/zinc/99/19/03/1056991903.db2.gz YCLJKBDNHJGIEF-UHFFFAOYSA-N 1 2 308.381 4.255 20 0 DIADLO CCOc1ccc(-c2ccc(-n3cc[nH+]c3)cc2OC)c(F)c1 ZINC001241277214 1056993664 /nfs/dbraw/zinc/99/36/64/1056993664.db2.gz LYNOAKRXFBQYQU-UHFFFAOYSA-N 1 2 312.344 4.086 20 0 DIADLO CCCCOc1cccc(-c2ccc(Cn3cc[nH+]c3)cn2)c1 ZINC001241287369 1056998127 /nfs/dbraw/zinc/99/81/27/1056998127.db2.gz GVUHOGNVIZCXDG-UHFFFAOYSA-N 1 2 307.397 4.172 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2ccnc(-c3ccccc3)c2)n1 ZINC000922296351 1056999988 /nfs/dbraw/zinc/99/99/88/1056999988.db2.gz TUQCHGMSUHSIKI-UHFFFAOYSA-N 1 2 321.424 4.324 20 0 DIADLO Fc1cccc(F)c1C1([NH2+]Cc2cnn(C3CCC3)c2)CCC1 ZINC000922299042 1057002273 /nfs/dbraw/zinc/00/22/73/1057002273.db2.gz AVJUJBKBZUXQJZ-UHFFFAOYSA-N 1 2 317.383 4.055 20 0 DIADLO O=C(Nc1cccc2ccccc21)c1cccc(-n2cc[nH+]c2)c1 ZINC000117561289 1057002591 /nfs/dbraw/zinc/00/25/91/1057002591.db2.gz ABELWOVTPWWUDH-UHFFFAOYSA-N 1 2 313.360 4.278 20 0 DIADLO Cc1cc(-c2cccc(C(C)(C)C)c2)c[nH+]c1N1CCOCC1 ZINC001241301659 1057004372 /nfs/dbraw/zinc/00/43/72/1057004372.db2.gz GPFZCIZVAGIGFH-UHFFFAOYSA-N 1 2 310.441 4.191 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1cnn(C2CCC2)c1 ZINC000922327887 1057009523 /nfs/dbraw/zinc/00/95/23/1057009523.db2.gz CHTLWELWIHCLHE-UHFFFAOYSA-N 1 2 309.417 4.151 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccccc2[S@](C)=O)c1 ZINC001241344502 1057020982 /nfs/dbraw/zinc/02/09/82/1057020982.db2.gz VJPLGUVHTGNWQD-NRFANRHFSA-N 1 2 301.455 4.246 20 0 DIADLO Cc1ccc2cc(C[NH2+][C@H]3c4ccccc4OC[C@H]3F)[nH]c2c1 ZINC000922521981 1057030171 /nfs/dbraw/zinc/03/01/71/1057030171.db2.gz OXELBRZJQPIPQO-APWZRJJASA-N 1 2 310.372 4.038 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+][C@H](c2ccccn2)C2CC2)s1 ZINC000922584434 1057034946 /nfs/dbraw/zinc/03/49/46/1057034946.db2.gz KLZSNNGANOHSQP-INIZCTEOSA-N 1 2 301.459 4.077 20 0 DIADLO Cc1cc2cc(C[NH2+][C@H](c3ncccn3)C3CC3)oc2cc1C ZINC000922581242 1057035269 /nfs/dbraw/zinc/03/52/69/1057035269.db2.gz SKVHGZAZVUCJMJ-SFHVURJKSA-N 1 2 307.397 4.081 20 0 DIADLO Clc1cc(Cl)cc(C[NH2+][C@@H](c2ncccn2)C2CC2)c1 ZINC000922581418 1057035295 /nfs/dbraw/zinc/03/52/95/1057035295.db2.gz VCBMTMYFERBLLK-CQSZACIVSA-N 1 2 308.212 4.024 20 0 DIADLO c1sc(-c2ccccc2)nc1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC000922585164 1057035861 /nfs/dbraw/zinc/03/58/61/1057035861.db2.gz JBUNBBWEOFDVKB-SFHVURJKSA-N 1 2 321.449 4.446 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncc(Cl)s1)c1cc(F)ccc1OC ZINC000922621695 1057040703 /nfs/dbraw/zinc/04/07/03/1057040703.db2.gz MWRPHYGQGLPXFA-LLVKDONJSA-N 1 2 314.813 4.185 20 0 DIADLO Cc1cccc2cc(C(=O)Nc3ccc4[nH+]ccn4c3)sc21 ZINC000673605512 1057044516 /nfs/dbraw/zinc/04/45/16/1057044516.db2.gz AYROOKMXVFDEDT-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2c(F)c(F)c(F)c(F)c2F)cc1 ZINC001241409171 1057044527 /nfs/dbraw/zinc/04/45/27/1057044527.db2.gz NYYWJLHVNQUGCV-UHFFFAOYSA-N 1 2 324.252 4.450 20 0 DIADLO c1csc(-c2nc(C[N@@H+]3CCC=C(c4cccnc4)C3)co2)c1 ZINC000347734723 1057061650 /nfs/dbraw/zinc/06/16/50/1057061650.db2.gz ZVGLVISMJCWAIZ-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO c1csc(-c2nc(C[N@H+]3CCC=C(c4cccnc4)C3)co2)c1 ZINC000347734723 1057061665 /nfs/dbraw/zinc/06/16/65/1057061665.db2.gz ZVGLVISMJCWAIZ-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO CC[C@@H](C)Oc1cc(C[NH2+][C@H]2CCCC2(F)F)ccc1OC ZINC000673618600 1057062946 /nfs/dbraw/zinc/06/29/46/1057062946.db2.gz UQTFULYAXYZCMK-WBMJQRKESA-N 1 2 313.388 4.150 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1ccncc1Br ZINC000625042022 1057078030 /nfs/dbraw/zinc/07/80/30/1057078030.db2.gz DFENFFXJZCSTCH-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccncc1Br ZINC000625042022 1057078035 /nfs/dbraw/zinc/07/80/35/1057078035.db2.gz DFENFFXJZCSTCH-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](C1CC1)[N@H+](Cc1noc(C2CCC2)n1)Cc1ccccc1 ZINC000625081809 1057084659 /nfs/dbraw/zinc/08/46/59/1057084659.db2.gz STSCJTWOHKIXJC-AWEZNQCLSA-N 1 2 311.429 4.138 20 0 DIADLO C[C@@H](C1CC1)[N@@H+](Cc1noc(C2CCC2)n1)Cc1ccccc1 ZINC000625081809 1057084671 /nfs/dbraw/zinc/08/46/71/1057084671.db2.gz STSCJTWOHKIXJC-AWEZNQCLSA-N 1 2 311.429 4.138 20 0 DIADLO COc1c(F)ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1Cl ZINC001241521594 1057084850 /nfs/dbraw/zinc/08/48/50/1057084850.db2.gz SJMFJVSYTKVZEN-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1cccc2cnccc21 ZINC000158906609 1057085445 /nfs/dbraw/zinc/08/54/45/1057085445.db2.gz GUWCSIDVCSXDDB-UHFFFAOYSA-N 1 2 302.381 4.217 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2nc(C)cs2)c2ccccc2)cc1 ZINC000126012246 1057086892 /nfs/dbraw/zinc/08/68/92/1057086892.db2.gz NBJCIDFZUVYEPV-LJQANCHMSA-N 1 2 324.449 4.339 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2noc(C3CCC3)n2)C(C)C)cc1 ZINC000625228859 1057103774 /nfs/dbraw/zinc/10/37/74/1057103774.db2.gz LSPJFNRGEYBQRZ-GOSISDBHSA-N 1 2 313.445 4.386 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cc(O)ccc3Cl)CCCC2)n1 ZINC000625257459 1057109162 /nfs/dbraw/zinc/10/91/62/1057109162.db2.gz PXVSZORWKNMJRO-UHFFFAOYSA-N 1 2 322.861 4.370 20 0 DIADLO CC(C)Sc1ccc(-c2cc[nH+]c(N3CCOCC3)c2)cc1 ZINC001241611102 1057109178 /nfs/dbraw/zinc/10/91/78/1057109178.db2.gz FRIAQJHBHSEKDX-UHFFFAOYSA-N 1 2 314.454 4.086 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(SC(C)C)cc3)nn2)c1C ZINC001241611515 1057109233 /nfs/dbraw/zinc/10/92/33/1057109233.db2.gz ZJQOYGFGXOMWIG-UHFFFAOYSA-N 1 2 324.453 4.447 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)Cc3cccc(O)c3)cs2)cc1 ZINC000673712107 1057120237 /nfs/dbraw/zinc/12/02/37/1057120237.db2.gz VJDWOKCJHSYIDN-UHFFFAOYSA-N 1 2 324.449 4.456 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)Cc3cccc(O)c3)cs2)cc1 ZINC000673712107 1057120239 /nfs/dbraw/zinc/12/02/39/1057120239.db2.gz VJDWOKCJHSYIDN-UHFFFAOYSA-N 1 2 324.449 4.456 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2ccncc2c1 ZINC001241678111 1057133904 /nfs/dbraw/zinc/13/39/04/1057133904.db2.gz YJIBRFMNNBQFPZ-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO COc1cc(F)c(-c2ccc(-c3c[nH+]cn3C)cc2)c(F)c1 ZINC001241694050 1057140123 /nfs/dbraw/zinc/14/01/23/1057140123.db2.gz BXKHBKZQGPZABY-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO Cc1cscc1-c1ccc(-c2nc3c(o2)CC[N@@H+](C)C3)cc1 ZINC001241730911 1057149783 /nfs/dbraw/zinc/14/97/83/1057149783.db2.gz CVKMTJDJJFAHDL-UHFFFAOYSA-N 1 2 310.422 4.366 20 0 DIADLO Cc1cscc1-c1ccc(-c2nc3c(o2)CC[N@H+](C)C3)cc1 ZINC001241730911 1057149788 /nfs/dbraw/zinc/14/97/88/1057149788.db2.gz CVKMTJDJJFAHDL-UHFFFAOYSA-N 1 2 310.422 4.366 20 0 DIADLO Cc1cnccc1C[N@H+]1CCO[C@H](c2cccc(Cl)c2)[C@H]1C ZINC000625539535 1057158446 /nfs/dbraw/zinc/15/84/46/1057158446.db2.gz ZZNULPSBUDMOQH-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cnccc1C[N@@H+]1CCO[C@H](c2cccc(Cl)c2)[C@H]1C ZINC000625539535 1057158448 /nfs/dbraw/zinc/15/84/48/1057158448.db2.gz ZZNULPSBUDMOQH-KDOFPFPSSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cc(N2CCSCC2)ccc1[NH2+][C@@H]1CCCSCC1 ZINC000657961276 1057160696 /nfs/dbraw/zinc/16/06/96/1057160696.db2.gz BMSRJOCOYLSGQO-OAHLLOKOSA-N 1 2 322.543 4.246 20 0 DIADLO c1[nH+]c(-c2ccc(N[C@@H]3COC4(CCC4)C3)cc2)n2c1CCCC2 ZINC000657961617 1057160990 /nfs/dbraw/zinc/16/09/90/1057160990.db2.gz SGNMVBLREJCCNS-KRWDZBQOSA-N 1 2 323.440 4.010 20 0 DIADLO Cc1cnccc1C[N@@H+]1CC[C@@H]1c1ccc(Br)cc1 ZINC000625562783 1057164160 /nfs/dbraw/zinc/16/41/60/1057164160.db2.gz YXJWLPTZPWPKIX-MRXNPFEDSA-N 1 2 317.230 4.100 20 0 DIADLO Cc1cnccc1C[N@H+]1CC[C@@H]1c1ccc(Br)cc1 ZINC000625562783 1057164163 /nfs/dbraw/zinc/16/41/63/1057164163.db2.gz YXJWLPTZPWPKIX-MRXNPFEDSA-N 1 2 317.230 4.100 20 0 DIADLO COc1cc(C(F)(F)F)ccc1-c1cc(C)cn2cc[nH+]c12 ZINC001241804638 1057170189 /nfs/dbraw/zinc/17/01/89/1057170189.db2.gz GCBBEKQKSSAQQQ-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(OC(C)C)c(Cl)c1 ZINC001241826459 1057178639 /nfs/dbraw/zinc/17/86/39/1057178639.db2.gz BMSGHRRMTVQNSW-UHFFFAOYSA-N 1 2 316.788 4.451 20 0 DIADLO Cc1cc(-c2cccnc2OCc2ccccc2)cn2cc[nH+]c12 ZINC001241831280 1057181084 /nfs/dbraw/zinc/18/10/84/1057181084.db2.gz YGROKMVMHXHIQR-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO COc1cc(Cl)ccc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001241905780 1057207598 /nfs/dbraw/zinc/20/75/98/1057207598.db2.gz CBGRADIQYWWGIA-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO FC(F)C1([NH2+]Cc2cnc(-c3ccccc3)s2)CCCC1 ZINC000674144294 1057210776 /nfs/dbraw/zinc/21/07/76/1057210776.db2.gz SCPIJWKQUFUTEJ-UHFFFAOYSA-N 1 2 308.397 4.478 20 0 DIADLO COc1cc(C[NH2+]C2(C(F)F)CCCC2)ccc1OC(C)C ZINC000674135377 1057212124 /nfs/dbraw/zinc/21/21/24/1057212124.db2.gz NDOPXTHZYRBHTB-UHFFFAOYSA-N 1 2 313.388 4.150 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2cccc(-c3nnc(C)o3)c2)c1 ZINC001241936351 1057218602 /nfs/dbraw/zinc/21/86/02/1057218602.db2.gz BFFYYCCHZNIXAM-UHFFFAOYSA-N 1 2 307.353 4.074 20 0 DIADLO FC(F)Oc1ccccc1-c1ccccc1Cn1cc[nH+]c1 ZINC001241953320 1057222033 /nfs/dbraw/zinc/22/20/33/1057222033.db2.gz PDXBJVLJPXGMJR-UHFFFAOYSA-N 1 2 300.308 4.200 20 0 DIADLO CCOC(=O)Cc1coc2ccc(-c3cc(C)[nH+]c(C)c3)cc12 ZINC001241992711 1057232570 /nfs/dbraw/zinc/23/25/70/1057232570.db2.gz XIVLXEAHXCCTGO-UHFFFAOYSA-N 1 2 309.365 4.217 20 0 DIADLO COC(=O)c1cc(-c2cc(C)[nH+]c(C)c2)cc(C(F)(F)F)c1 ZINC001241993025 1057232675 /nfs/dbraw/zinc/23/26/75/1057232675.db2.gz DDVNIPJZGZLCJI-UHFFFAOYSA-N 1 2 309.287 4.171 20 0 DIADLO COc1cccc2[nH]c(-c3cc[nH+]c(N4CCCCC4)c3)cc21 ZINC001241997665 1057234677 /nfs/dbraw/zinc/23/46/77/1057234677.db2.gz GFUQNEJMJFYFBZ-UHFFFAOYSA-N 1 2 307.397 4.229 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc([C@@H](C)OC)c1 ZINC001242040358 1057247257 /nfs/dbraw/zinc/24/72/57/1057247257.db2.gz LFITYZOSNDPBIV-CQSZACIVSA-N 1 2 308.381 4.255 20 0 DIADLO C[C@@H](C[NH+]1CCCCC1)NCc1cnc(C2CCCCC2)s1 ZINC000674487033 1057247349 /nfs/dbraw/zinc/24/73/49/1057247349.db2.gz JMNMQVZXXRRHMC-HNNXBMFYSA-N 1 2 321.534 4.155 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1ccc(-c2ccc3ccccc3c2)nn1 ZINC001242077908 1057256347 /nfs/dbraw/zinc/25/63/47/1057256347.db2.gz KTYPYKIGIKSULU-UHFFFAOYSA-N 1 2 312.376 4.249 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cc(C(F)(F)F)ccc2O)c1 ZINC001242141844 1057277845 /nfs/dbraw/zinc/27/78/45/1057277845.db2.gz VRLIDHQXQQXGNG-UHFFFAOYSA-N 1 2 318.298 4.479 20 0 DIADLO Oc1ccc(C(F)(F)F)cc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001242147642 1057280158 /nfs/dbraw/zinc/28/01/58/1057280158.db2.gz CFQKQDPAFHZIRE-UHFFFAOYSA-N 1 2 322.261 4.403 20 0 DIADLO Nc1cc(-c2ccc(O)c(C(F)(F)F)c2)[nH+]cc1C(F)(F)F ZINC001242151875 1057280829 /nfs/dbraw/zinc/28/08/29/1057280829.db2.gz XDHHLSXTLKGFCK-UHFFFAOYSA-N 1 2 322.208 4.074 20 0 DIADLO CC(C)Oc1ccccc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001242225425 1057300114 /nfs/dbraw/zinc/30/01/14/1057300114.db2.gz RWUOZAAHZSHWPV-UHFFFAOYSA-N 1 2 305.368 4.481 20 0 DIADLO Cc1cc(Cl)cc(-c2ccccc2C[NH+]2CCOCC2)c1F ZINC001242226724 1057301294 /nfs/dbraw/zinc/30/12/94/1057301294.db2.gz KUXCUDSVTLNSAA-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO CCn1cc(C[NH2+][C@@H](C)c2cc3c(ccc4ccccc34)o2)nn1 ZINC000658176010 1057306487 /nfs/dbraw/zinc/30/64/87/1057306487.db2.gz JRKJFQHLEYYOOP-ZDUSSCGKSA-N 1 2 320.396 4.048 20 0 DIADLO CCOc1cc(Nc2cccc(-n3cc[nH+]c3)c2)c(F)cc1F ZINC001212530815 1057321255 /nfs/dbraw/zinc/32/12/55/1057321255.db2.gz STJLIVKKACNAKS-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+]Cc2ccccc2C2CC2)s1 ZINC000675155272 1057322312 /nfs/dbraw/zinc/32/23/12/1057322312.db2.gz JLZDSSZDFQXUGF-UHFFFAOYSA-N 1 2 301.459 4.003 20 0 DIADLO Fc1cccc(C(F)(F)F)c1-c1cc(-n2cc[nH+]c2)ccn1 ZINC001242302744 1057327950 /nfs/dbraw/zinc/32/79/50/1057327950.db2.gz LIKDRJDXBKOHLE-UHFFFAOYSA-N 1 2 307.250 4.092 20 0 DIADLO C[C@H]1CC[N@H+](Cc2noc3c2CCCC3)[C@H](c2ccco2)C1 ZINC000174512009 1057364310 /nfs/dbraw/zinc/36/43/10/1057364310.db2.gz JPHUPXKRFHUZEM-BBRMVZONSA-N 1 2 300.402 4.120 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2noc3c2CCCC3)[C@H](c2ccco2)C1 ZINC000174512009 1057364316 /nfs/dbraw/zinc/36/43/16/1057364316.db2.gz JPHUPXKRFHUZEM-BBRMVZONSA-N 1 2 300.402 4.120 20 0 DIADLO Cc1c(Cl)c(Cl)ccc1-c1cc[nH+]c(N2CCOCC2)c1 ZINC001242515783 1057390787 /nfs/dbraw/zinc/39/07/87/1057390787.db2.gz LBPANMNPOPDUJJ-UHFFFAOYSA-N 1 2 323.223 4.200 20 0 DIADLO C[C@@H]([NH2+]Cc1ccncc1Cl)c1nc2ccccc2s1 ZINC000704401901 1057400306 /nfs/dbraw/zinc/40/03/06/1057400306.db2.gz RGXMDYNGDFNITJ-SNVBAGLBSA-N 1 2 303.818 4.196 20 0 DIADLO Cc1ccc(-c2cccc(F)c2Cl)c(C[NH+]2CCOCC2)c1 ZINC001242574823 1057410969 /nfs/dbraw/zinc/41/09/69/1057410969.db2.gz IRMUDAXJKGSDBX-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO CCOc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1nc(C)cs1)CCO2 ZINC000675810282 1057417573 /nfs/dbraw/zinc/41/75/73/1057417573.db2.gz QKEXVFQFODXBIZ-WFASDCNBSA-N 1 2 318.442 4.025 20 0 DIADLO Cc1cn2cc(-c3ccc(OCC(F)(F)F)cc3)ccc2[nH+]1 ZINC001242720729 1057459229 /nfs/dbraw/zinc/45/92/29/1057459229.db2.gz AUSFSHVKCOEACW-UHFFFAOYSA-N 1 2 306.287 4.251 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(OC(F)(F)F)nc2)cc1 ZINC001242779369 1057472496 /nfs/dbraw/zinc/47/24/96/1057472496.db2.gz JQKUUAHEFIMGBH-UHFFFAOYSA-N 1 2 319.286 4.048 20 0 DIADLO Oc1c(Cl)cc(-c2ccc(O[C@@H]3CC[NH2+]C3)cc2)cc1Cl ZINC001242853039 1057499382 /nfs/dbraw/zinc/49/93/82/1057499382.db2.gz JKNLASZVNKPGMG-CYBMUJFWSA-N 1 2 324.207 4.107 20 0 DIADLO Oc1c(Cl)cc(-c2ccc([C@@H]3CC[NH2+]C3)cc2)cc1Cl ZINC001242852934 1057499420 /nfs/dbraw/zinc/49/94/20/1057499420.db2.gz HBSHFKVKNZRICF-GFCCVEGCSA-N 1 2 308.208 4.443 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc3c(c2)C(=O)CCC3)c1 ZINC001242858083 1057502938 /nfs/dbraw/zinc/50/29/38/1057502938.db2.gz RSOCIXVFGIOCLQ-UHFFFAOYSA-N 1 2 302.377 4.273 20 0 DIADLO Sc1cccc(-c2ccc3c(c2)ncn3[C@@H]2CCC[NH2+]CC2)c1 ZINC001242863728 1057504418 /nfs/dbraw/zinc/50/44/18/1057504418.db2.gz HIDLOIIPALBKLP-MRXNPFEDSA-N 1 2 323.465 4.307 20 0 DIADLO Sc1cccc(-c2ccc3ncn([C@@H]4CCC[NH2+]CC4)c3c2)c1 ZINC001242864896 1057504817 /nfs/dbraw/zinc/50/48/17/1057504817.db2.gz XBVUHTANNIZBCX-MRXNPFEDSA-N 1 2 323.465 4.307 20 0 DIADLO Cc1cccn2cc(C[N@@H+](C)[C@@H](C)c3ccc(F)c(F)c3)nc12 ZINC000073431930 1057507359 /nfs/dbraw/zinc/50/73/59/1057507359.db2.gz TZJVPHVTVYBDDI-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1cccn2cc(C[N@H+](C)[C@@H](C)c3ccc(F)c(F)c3)nc12 ZINC000073431930 1057507363 /nfs/dbraw/zinc/50/73/63/1057507363.db2.gz TZJVPHVTVYBDDI-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cccc(-c2cccnc2)c1 ZINC001243003737 1057543394 /nfs/dbraw/zinc/54/33/94/1057543394.db2.gz ZDLOAYKVEWDRLU-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+]2CCC(F)(F)C[C@H]2C)s1 ZINC000625980787 1057544102 /nfs/dbraw/zinc/54/41/02/1057544102.db2.gz QQQWOEUQTPFWNC-SSDOTTSWSA-N 1 2 314.323 4.090 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+]2CCC(F)(F)C[C@H]2C)s1 ZINC000625980787 1057544110 /nfs/dbraw/zinc/54/41/10/1057544110.db2.gz QQQWOEUQTPFWNC-SSDOTTSWSA-N 1 2 314.323 4.090 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1cc(F)ccc1OC(F)F ZINC000625981611 1057544859 /nfs/dbraw/zinc/54/48/59/1057544859.db2.gz YZQYHCQXFSRSHP-SECBINFHSA-N 1 2 309.278 4.047 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1cc(F)ccc1OC(F)F ZINC000625981611 1057544866 /nfs/dbraw/zinc/54/48/66/1057544866.db2.gz YZQYHCQXFSRSHP-SECBINFHSA-N 1 2 309.278 4.047 20 0 DIADLO Nc1ccc(C(F)(F)F)cc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243005289 1057545037 /nfs/dbraw/zinc/54/50/37/1057545037.db2.gz HZSAKWZRAWQWTR-UHFFFAOYSA-N 1 2 317.314 4.199 20 0 DIADLO C[C@H]([NH2+]Cc1nccn1C1CC1)c1ccc(Cl)cc1Cl ZINC000711755255 1057547138 /nfs/dbraw/zinc/54/71/38/1057547138.db2.gz IKERGVVAGJBYFB-JTQLQIEISA-N 1 2 310.228 4.376 20 0 DIADLO Nc1cc(CSc2ncc(-c3ccc(Cl)cc3)o2)cc[nH+]1 ZINC000443465780 1057556525 /nfs/dbraw/zinc/55/65/25/1057556525.db2.gz HMGCTXXLKFTGMF-UHFFFAOYSA-N 1 2 317.801 4.265 20 0 DIADLO COc1cccc(OC(F)(F)F)c1C[NH2+][C@@H](C)c1ccco1 ZINC000671769181 1057559467 /nfs/dbraw/zinc/55/94/67/1057559467.db2.gz KDCJLJBWONULQV-JTQLQIEISA-N 1 2 315.291 4.038 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 ZINC001243068824 1057563291 /nfs/dbraw/zinc/56/32/91/1057563291.db2.gz HQOYSRGZBHZZOW-UHFFFAOYSA-N 1 2 319.286 4.293 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cc(C)ccc3OC(C)C)nn2)c1C ZINC001243088433 1057567496 /nfs/dbraw/zinc/56/74/96/1057567496.db2.gz RWPZRKDJEDHQGR-UHFFFAOYSA-N 1 2 322.412 4.042 20 0 DIADLO c1cc2cc(CNc3ccc(N4CCCCC4)[nH+]c3)ccc2[nH]1 ZINC000322912394 1057567823 /nfs/dbraw/zinc/56/78/23/1057567823.db2.gz IYUGFVCTBISMRN-UHFFFAOYSA-N 1 2 306.413 4.165 20 0 DIADLO Cc1ccccc1-c1noc(C[N@@H+](C)[C@H](C)c2cccs2)n1 ZINC000016434902 1057569539 /nfs/dbraw/zinc/56/95/39/1057569539.db2.gz IXKHPKMAMLVSII-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccccc1-c1noc(C[N@H+](C)[C@H](C)c2cccs2)n1 ZINC000016434902 1057569546 /nfs/dbraw/zinc/56/95/46/1057569546.db2.gz IXKHPKMAMLVSII-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO C[C@@H]1C[N@H+](Cc2scnc2C2CC2)C[C@@H](c2ccsc2)O1 ZINC000494929989 1057619712 /nfs/dbraw/zinc/61/97/12/1057619712.db2.gz MRXPWLINQXWNDC-RISCZKNCSA-N 1 2 320.483 4.044 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2scnc2C2CC2)C[C@@H](c2ccsc2)O1 ZINC000494929989 1057619716 /nfs/dbraw/zinc/61/97/16/1057619716.db2.gz MRXPWLINQXWNDC-RISCZKNCSA-N 1 2 320.483 4.044 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1scnc1C1CC1)C1CC1 ZINC000495079015 1057622160 /nfs/dbraw/zinc/62/21/60/1057622160.db2.gz MGLFFJMAERCHQF-UHFFFAOYSA-N 1 2 302.418 4.324 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1scnc1C1CC1)C1CC1 ZINC000495079015 1057622162 /nfs/dbraw/zinc/62/21/62/1057622162.db2.gz MGLFFJMAERCHQF-UHFFFAOYSA-N 1 2 302.418 4.324 20 0 DIADLO CCCN(CCC)C(=O)c1ccc(-c2ccn3cc[nH+]c3c2)cc1 ZINC001243256785 1057622786 /nfs/dbraw/zinc/62/27/86/1057622786.db2.gz ZGKSCYMSDMXHGI-UHFFFAOYSA-N 1 2 321.424 4.264 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2ncc[nH]2)c(O[C@@H](C)CC(C)C)c1 ZINC000513690873 1057623686 /nfs/dbraw/zinc/62/36/86/1057623686.db2.gz NJZYRBKQINCDHT-HOTGVXAUSA-N 1 2 315.461 4.382 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cc(-c3cccs3)on2)cc1 ZINC000052929945 1057632504 /nfs/dbraw/zinc/63/25/04/1057632504.db2.gz NAJYLWRTDRAOGX-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cc(-c3cccs3)on2)cc1 ZINC000052929945 1057632506 /nfs/dbraw/zinc/63/25/06/1057632506.db2.gz NAJYLWRTDRAOGX-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000727221641 1057642503 /nfs/dbraw/zinc/64/25/03/1057642503.db2.gz GDUOQRWMPBZBQQ-UHFFFAOYSA-N 1 2 324.255 4.200 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000727221641 1057642505 /nfs/dbraw/zinc/64/25/05/1057642505.db2.gz GDUOQRWMPBZBQQ-UHFFFAOYSA-N 1 2 324.255 4.200 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cc(Cl)cc3n[nH]cc32)cc1 ZINC001243315298 1057643358 /nfs/dbraw/zinc/64/33/58/1057643358.db2.gz HGVNXQDIBOVFAI-UHFFFAOYSA-N 1 2 308.772 4.284 20 0 DIADLO COc1nccc(-c2c[nH+]c(N3CCCCC3)cc2C)c1Cl ZINC001243321757 1057645556 /nfs/dbraw/zinc/64/55/56/1057645556.db2.gz WZVGELLCVNGENJ-UHFFFAOYSA-N 1 2 317.820 4.104 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2cc(Cl)cc(Cl)c2C)cc1 ZINC001243331938 1057648477 /nfs/dbraw/zinc/64/84/77/1057648477.db2.gz BRGQXSPXRCPCSI-HNNXBMFYSA-N 1 2 324.207 4.142 20 0 DIADLO Cc1nn(C[N@@H+]2CCC[C@@H](c3ccccc3)CC2)c(=S)s1 ZINC000727429845 1057654046 /nfs/dbraw/zinc/65/40/46/1057654046.db2.gz CEZUOPHYNMLJHH-OAHLLOKOSA-N 1 2 319.499 4.210 20 0 DIADLO Cc1nn(C[N@H+]2CCC[C@@H](c3ccccc3)CC2)c(=S)s1 ZINC000727429845 1057654049 /nfs/dbraw/zinc/65/40/49/1057654049.db2.gz CEZUOPHYNMLJHH-OAHLLOKOSA-N 1 2 319.499 4.210 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(C2CC2)n1)c1ccccc1C(F)(F)F ZINC000727467932 1057655615 /nfs/dbraw/zinc/65/56/15/1057655615.db2.gz CCRJDBABUWXBLZ-SNVBAGLBSA-N 1 2 310.319 4.422 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1coc(C2CC2)n1 ZINC000727467462 1057655727 /nfs/dbraw/zinc/65/57/27/1057655727.db2.gz ZYJZJFSLQCOWBW-CYBMUJFWSA-N 1 2 300.402 4.190 20 0 DIADLO CC(C)(C)[C@@H](Cn1cc[nH+]c1)NC(=O)CCCC1CCCCC1 ZINC000727494473 1057656806 /nfs/dbraw/zinc/65/68/06/1057656806.db2.gz AUHPMGIFWOSJLZ-QGZVFWFLSA-N 1 2 319.493 4.165 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)Nc1nc2c(s1)C[N@H+](C)CC2 ZINC000727673890 1057664742 /nfs/dbraw/zinc/66/47/42/1057664742.db2.gz ZJVHTGJCTSVESW-CYBMUJFWSA-N 1 2 323.506 4.066 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)Nc1nc2c(s1)C[N@@H+](C)CC2 ZINC000727673890 1057664746 /nfs/dbraw/zinc/66/47/46/1057664746.db2.gz ZJVHTGJCTSVESW-CYBMUJFWSA-N 1 2 323.506 4.066 20 0 DIADLO Cc1cn2c(cccc2-c2cccc(OCC(F)(F)F)c2)[nH+]1 ZINC001243391048 1057668755 /nfs/dbraw/zinc/66/87/55/1057668755.db2.gz BDSSUYUJWNVTME-UHFFFAOYSA-N 1 2 306.287 4.251 20 0 DIADLO CCC[N@H+](CC)Cn1nc(-c2ccc(C)cc2C)oc1=S ZINC000727820202 1057676606 /nfs/dbraw/zinc/67/66/06/1057676606.db2.gz BUOZFKTXLUAXOS-UHFFFAOYSA-N 1 2 305.447 4.179 20 0 DIADLO CCC[N@@H+](CC)Cn1nc(-c2ccc(C)cc2C)oc1=S ZINC000727820202 1057676611 /nfs/dbraw/zinc/67/66/11/1057676611.db2.gz BUOZFKTXLUAXOS-UHFFFAOYSA-N 1 2 305.447 4.179 20 0 DIADLO CCCCC[C@H](Nc1[nH+]cnc2c1cnn2C)c1ccccc1 ZINC000728052932 1057684875 /nfs/dbraw/zinc/68/48/75/1057684875.db2.gz WJAUMPAXRLCRGQ-INIZCTEOSA-N 1 2 309.417 4.097 20 0 DIADLO COc1cccc2cc(CNc3cc(C)[nH+]c(C(C)C)n3)oc21 ZINC000728052129 1057685132 /nfs/dbraw/zinc/68/51/32/1057685132.db2.gz DRIVIFVJZCRAJM-UHFFFAOYSA-N 1 2 311.385 4.275 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2nccn2CC(F)(F)F)C1 ZINC000285535345 1057685783 /nfs/dbraw/zinc/68/57/83/1057685783.db2.gz FPXPXCZRFQIEEI-DZGCQCFKSA-N 1 2 323.362 4.029 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2)[N@@H+](Cc2nccn2CC(F)(F)F)C1 ZINC000285535345 1057685785 /nfs/dbraw/zinc/68/57/85/1057685785.db2.gz FPXPXCZRFQIEEI-DZGCQCFKSA-N 1 2 323.362 4.029 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1cccc2cnccc21 ZINC000167769331 1057687158 /nfs/dbraw/zinc/68/71/58/1057687158.db2.gz ZYFAIMKMDBYDDQ-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)N1CCCC[C@H]1c1ccccc1 ZINC000290712312 1057690860 /nfs/dbraw/zinc/69/08/60/1057690860.db2.gz NZJLEYCVNPETSR-KRWDZBQOSA-N 1 2 320.396 4.093 20 0 DIADLO c1cc(C2CCCC2)ccc1-c1cncc(C[NH+]2CCOCC2)c1 ZINC001243491058 1057694723 /nfs/dbraw/zinc/69/47/23/1057694723.db2.gz BUNDXXKENZGCKT-UHFFFAOYSA-N 1 2 322.452 4.238 20 0 DIADLO Cc1c(-c2cc(F)c(OC(F)F)c(F)c2)ccc2[nH+]ccn21 ZINC001243492182 1057694855 /nfs/dbraw/zinc/69/48/55/1057694855.db2.gz MJZXUBALJQIVHG-UHFFFAOYSA-N 1 2 310.250 4.189 20 0 DIADLO Cc1cc(-c2cc(F)c(OC(F)F)c(F)c2)c2[nH+]ccn2c1 ZINC001243491658 1057695109 /nfs/dbraw/zinc/69/51/09/1057695109.db2.gz HEBNGJTVISFJCW-UHFFFAOYSA-N 1 2 310.250 4.189 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1ccc(-c2cc(F)cc(F)c2O)nc1 ZINC001243501105 1057696090 /nfs/dbraw/zinc/69/60/90/1057696090.db2.gz CXUQVOXXDCLTSM-LBPRGKRZSA-N 1 2 318.367 4.107 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1ccc(-c2cc(F)cc(F)c2O)nc1 ZINC001243501105 1057696091 /nfs/dbraw/zinc/69/60/91/1057696091.db2.gz CXUQVOXXDCLTSM-LBPRGKRZSA-N 1 2 318.367 4.107 20 0 DIADLO CC(C)[C@@H](C)[N@H+](C)Cn1nc(-c2ccccc2)sc1=S ZINC000729981770 1057700187 /nfs/dbraw/zinc/70/01/87/1057700187.db2.gz KSENMXHUVMUFCR-GFCCVEGCSA-N 1 2 307.488 4.275 20 0 DIADLO CC(C)[C@@H](C)[N@@H+](C)Cn1nc(-c2ccccc2)sc1=S ZINC000729981770 1057700192 /nfs/dbraw/zinc/70/01/92/1057700192.db2.gz KSENMXHUVMUFCR-GFCCVEGCSA-N 1 2 307.488 4.275 20 0 DIADLO CCOc1cc(-c2ccccc2Cn2cc[nH+]c2)ccc1OC ZINC001243539723 1057707862 /nfs/dbraw/zinc/70/78/62/1057707862.db2.gz DQNGTWXXSLQABA-UHFFFAOYSA-N 1 2 308.381 4.006 20 0 DIADLO Cc1ccsc1-c1nn(C[N@H+](C)CC2CCCC2)c(=S)o1 ZINC000730251975 1057709957 /nfs/dbraw/zinc/70/99/57/1057709957.db2.gz JUOPGJYABIONNJ-UHFFFAOYSA-N 1 2 323.487 4.322 20 0 DIADLO Cc1ccsc1-c1nn(C[N@@H+](C)CC2CCCC2)c(=S)o1 ZINC000730251975 1057709961 /nfs/dbraw/zinc/70/99/61/1057709961.db2.gz JUOPGJYABIONNJ-UHFFFAOYSA-N 1 2 323.487 4.322 20 0 DIADLO CN(c1ccc(-c2cccc3[nH+]ccn32)cn1)C1CCCCC1 ZINC001243596998 1057728422 /nfs/dbraw/zinc/72/84/22/1057728422.db2.gz QSZUTBVUPQHULF-UHFFFAOYSA-N 1 2 306.413 4.165 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000731451146 1057743545 /nfs/dbraw/zinc/74/35/45/1057743545.db2.gz WZEZMPGPXHDCIC-UHFFFAOYSA-N 1 2 324.877 4.392 20 0 DIADLO Cc1nc(-c2ccc(Cn3cc[nH+]c3)cc2)nc(C)c1CC(C)C ZINC001243655914 1057745530 /nfs/dbraw/zinc/74/55/30/1057745530.db2.gz GPHMRMSFNNEKSJ-UHFFFAOYSA-N 1 2 320.440 4.204 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(-c4cccnc4)nc3)cc2)c[nH+]1 ZINC001243658479 1057746350 /nfs/dbraw/zinc/74/63/50/1057746350.db2.gz RIVULMKOPUEHJM-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO CC(C)[S@](=O)c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001243658593 1057746440 /nfs/dbraw/zinc/74/64/40/1057746440.db2.gz VFQUEWHDLDMGFB-QHCPKHFHSA-N 1 2 324.449 4.114 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(C4=CCOCC4)cc3)cc2)c[nH+]1 ZINC001243657967 1057746675 /nfs/dbraw/zinc/74/66/75/1057746675.db2.gz CQKPOYMVXYVXLD-UHFFFAOYSA-N 1 2 316.404 4.402 20 0 DIADLO c1cn(Cc2ccc(-c3cc(-c4ccncc4)ccn3)cc2)c[nH+]1 ZINC001243657596 1057746709 /nfs/dbraw/zinc/74/67/09/1057746709.db2.gz RLCGQEFPJFKLAQ-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO c1cc(-c2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)cc2)on1 ZINC001243659440 1057746938 /nfs/dbraw/zinc/74/69/38/1057746938.db2.gz TZJXPQQBXPCBCI-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO COc1ccc2cc(-c3ccc(Cn4cc[nH+]c4)cc3)cnc2c1 ZINC001243659268 1057747290 /nfs/dbraw/zinc/74/72/90/1057747290.db2.gz PDINZMSVPZBHSM-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Cc1nc(OCC(C)C)ccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243660228 1057747314 /nfs/dbraw/zinc/74/73/14/1057747314.db2.gz QRKQGPAKMYEKPI-UHFFFAOYSA-N 1 2 321.424 4.337 20 0 DIADLO Fc1cccc2ccnc(-c3ccc(Cn4cc[nH+]c4)cc3)c12 ZINC001243662333 1057747728 /nfs/dbraw/zinc/74/77/28/1057747728.db2.gz LHHMWFAAAVREKK-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO CC(C)COc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)ccn1 ZINC001243661974 1057748186 /nfs/dbraw/zinc/74/81/86/1057748186.db2.gz IDZWLKUVKYBLMI-UHFFFAOYSA-N 1 2 307.397 4.028 20 0 DIADLO CC1CC[NH+](c2ccc(Nc3ccnc(C4CC4)n3)cc2)CC1 ZINC000731918718 1057758773 /nfs/dbraw/zinc/75/87/73/1057758773.db2.gz SVCPIWJTFCSQRA-UHFFFAOYSA-N 1 2 308.429 4.334 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1c(Cl)cccc1CO ZINC001243711064 1057759122 /nfs/dbraw/zinc/75/91/22/1057759122.db2.gz QKGMGHJOMBEMQF-UHFFFAOYSA-N 1 2 316.832 4.193 20 0 DIADLO CC(=O)OCc1cccc(Cl)c1-c1cc(C)c2[nH+]ccn2c1 ZINC001243723047 1057762857 /nfs/dbraw/zinc/76/28/57/1057762857.db2.gz JCXDVQVTJWFRMJ-UHFFFAOYSA-N 1 2 314.772 4.026 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1cc(F)ccc1F ZINC000732210239 1057769144 /nfs/dbraw/zinc/76/91/44/1057769144.db2.gz RBZUGEANODBPIU-LPMFXHHGSA-N 1 2 317.379 4.315 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1cc(F)ccc1F ZINC000732210239 1057769146 /nfs/dbraw/zinc/76/91/46/1057769146.db2.gz RBZUGEANODBPIU-LPMFXHHGSA-N 1 2 317.379 4.315 20 0 DIADLO COc1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc1SC ZINC001243753111 1057771417 /nfs/dbraw/zinc/77/14/17/1057771417.db2.gz PGUBMAXZAFIOHX-UHFFFAOYSA-N 1 2 314.385 4.409 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2cnc(-c3ccccc3)nc2)cs1 ZINC000732232392 1057771369 /nfs/dbraw/zinc/77/13/69/1057771369.db2.gz KXOCOSQGDPAFRS-CYBMUJFWSA-N 1 2 324.453 4.013 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2cnc(-c3ccccc3)nc2)cs1 ZINC000732232393 1057771722 /nfs/dbraw/zinc/77/17/22/1057771722.db2.gz KXOCOSQGDPAFRS-ZDUSSCGKSA-N 1 2 324.453 4.013 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(Cl)c3n[nH]cc32)cc1 ZINC001243784439 1057778258 /nfs/dbraw/zinc/77/82/58/1057778258.db2.gz LDTGZDGHHKSCAD-UHFFFAOYSA-N 1 2 308.772 4.284 20 0 DIADLO CC[N@H+](CC1CC1)Cn1nc(-c2ccc(C)cc2C)oc1=S ZINC000732663268 1057783125 /nfs/dbraw/zinc/78/31/25/1057783125.db2.gz MDSZTYGHOVSZIR-UHFFFAOYSA-N 1 2 317.458 4.179 20 0 DIADLO CC[N@@H+](CC1CC1)Cn1nc(-c2ccc(C)cc2C)oc1=S ZINC000732663268 1057783130 /nfs/dbraw/zinc/78/31/30/1057783130.db2.gz MDSZTYGHOVSZIR-UHFFFAOYSA-N 1 2 317.458 4.179 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccnc(OCC2CC2)c1 ZINC001243921069 1057807769 /nfs/dbraw/zinc/80/77/69/1057807769.db2.gz QXLNSAWXCXGDMX-UHFFFAOYSA-N 1 2 323.440 4.231 20 0 DIADLO C1=C(c2nc(C3CC3)nc3sc4c(c32)CCCC4)CCC[NH2+]1 ZINC001243948888 1057817578 /nfs/dbraw/zinc/81/75/78/1057817578.db2.gz ODBRANAPPNXMMD-UHFFFAOYSA-N 1 2 311.454 4.172 20 0 DIADLO Cc1sc2ncnc(C3=C[NH2+]CCC3)c2c1-c1ccccc1 ZINC001243948624 1057817822 /nfs/dbraw/zinc/81/78/22/1057817822.db2.gz JHKODMQZEDYZPA-UHFFFAOYSA-N 1 2 307.422 4.391 20 0 DIADLO COC(OC)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1F ZINC001243975985 1057826429 /nfs/dbraw/zinc/82/64/29/1057826429.db2.gz FHGVQKWHANMCNI-UHFFFAOYSA-N 1 2 312.344 4.174 20 0 DIADLO CCc1cc(NC(C)=O)cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001243976063 1057826483 /nfs/dbraw/zinc/82/64/83/1057826483.db2.gz JKHBVJOZEFEPHP-UHFFFAOYSA-N 1 2 305.381 4.265 20 0 DIADLO COC(=O)c1cc2c(cccc2-c2ccc(-c3[nH]cc[nH+]3)cc2)[nH]1 ZINC001243977778 1057827338 /nfs/dbraw/zinc/82/73/38/1057827338.db2.gz WXKBBKBOOXVLON-UHFFFAOYSA-N 1 2 317.348 4.012 20 0 DIADLO COC(=O)CCCc1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001243978019 1057827414 /nfs/dbraw/zinc/82/74/14/1057827414.db2.gz DUBZXFQMQRMFFQ-UHFFFAOYSA-N 1 2 320.392 4.239 20 0 DIADLO Cc1cc(-c2cc(F)c(OC(C)C)c(F)c2)c2[nH+]ccn2c1 ZINC001244110556 1057872349 /nfs/dbraw/zinc/87/23/49/1057872349.db2.gz QMBFETOTIALSOU-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Fc1cccc(C2CC2)c1-c1ccccc1C[NH+]1CCOCC1 ZINC001244120561 1057875541 /nfs/dbraw/zinc/87/55/41/1057875541.db2.gz QTZYNSMZUCXRSH-UHFFFAOYSA-N 1 2 311.400 4.202 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(C2CC2)cnc1C ZINC001244143265 1057884972 /nfs/dbraw/zinc/88/49/72/1057884972.db2.gz FNPWEDDVASBADC-UHFFFAOYSA-N 1 2 305.381 4.129 20 0 DIADLO Cc1cc2c[nH+]c(-c3ccc(COc4ccccc4)cc3)nc2[nH]1 ZINC001244183856 1057893755 /nfs/dbraw/zinc/89/37/55/1057893755.db2.gz DKYHZOGQXYFHCA-UHFFFAOYSA-N 1 2 315.376 4.464 20 0 DIADLO COc1ccc(-c2ccc(C)c(N)[nH+]2)cc1OCc1ccccc1 ZINC001244206011 1057899847 /nfs/dbraw/zinc/89/98/47/1057899847.db2.gz UFLHTEGSUUAMDI-UHFFFAOYSA-N 1 2 320.392 4.227 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cc(C)c(OC(C)C)c(C)c1 ZINC001244211913 1057901743 /nfs/dbraw/zinc/90/17/43/1057901743.db2.gz YNDJSBDJFWKLTK-UHFFFAOYSA-N 1 2 310.397 4.414 20 0 DIADLO Cc1cc2cc(-c3cc(C[NH+]4CCOCC4)ccc3F)ccc2[nH]1 ZINC001244243807 1057907926 /nfs/dbraw/zinc/90/79/26/1057907926.db2.gz AKOIXJFAESNHCY-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Cc1ncc(C(F)(F)F)cc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001244262387 1057915208 /nfs/dbraw/zinc/91/52/08/1057915208.db2.gz LVNRSZMHBZBOIK-UHFFFAOYSA-N 1 2 317.314 4.476 20 0 DIADLO Nc1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1OC(F)(F)F ZINC001244266369 1057917112 /nfs/dbraw/zinc/91/71/12/1057917112.db2.gz FYQDLILZWPAAJP-UHFFFAOYSA-N 1 2 319.286 4.225 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(C4CC4)cc3Cl)nn2)c1C ZINC001244272423 1057919430 /nfs/dbraw/zinc/91/94/30/1057919430.db2.gz BDJIHFBFJBDKGY-UHFFFAOYSA-N 1 2 324.815 4.477 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(CC(F)(F)F)nc2)c1 ZINC001244294667 1057925114 /nfs/dbraw/zinc/92/51/14/1057925114.db2.gz GRFNNWHLAVXCQZ-UHFFFAOYSA-N 1 2 317.314 4.254 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cccc2[nH]c(=O)ccc21 ZINC001244315313 1057932109 /nfs/dbraw/zinc/93/21/09/1057932109.db2.gz BBJAFNOZKCBGQN-UHFFFAOYSA-N 1 2 319.408 4.301 20 0 DIADLO CC(C)c1cc(-c2cc(F)c(C[NH+](C)C)c(F)c2)ccc1N ZINC001244336981 1057936602 /nfs/dbraw/zinc/93/66/02/1057936602.db2.gz BMDUNFXIWCYLET-UHFFFAOYSA-N 1 2 304.384 4.399 20 0 DIADLO COc1cc(F)c(-c2cc(N)c(C(F)(F)F)c[nH+]2)cc1Cl ZINC001244346918 1057938171 /nfs/dbraw/zinc/93/81/71/1057938171.db2.gz CUOSGLGLWWKQSK-UHFFFAOYSA-N 1 2 320.673 4.151 20 0 DIADLO CNc1cc(-c2ccc(C(=O)Nc3cccc(F)c3)cc2)cc[nH+]1 ZINC001244381158 1057947844 /nfs/dbraw/zinc/94/78/44/1057947844.db2.gz NUGXXQVGYSBTKP-UHFFFAOYSA-N 1 2 321.355 4.182 20 0 DIADLO Cc1cc(Cl)c(-c2cc(N3CCOCC3)cc[nH+]2)c(Cl)c1 ZINC001244504052 1057978996 /nfs/dbraw/zinc/97/89/96/1057978996.db2.gz LGMVPGOIRILZLZ-UHFFFAOYSA-N 1 2 323.223 4.200 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1c(F)ccc(C)c1OC ZINC001244527683 1057986188 /nfs/dbraw/zinc/98/61/88/1057986188.db2.gz FOPJUYFFEQOHBF-UHFFFAOYSA-N 1 2 312.344 4.004 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001244534130 1057987978 /nfs/dbraw/zinc/98/79/78/1057987978.db2.gz BPFFQPUENWMTFX-UHFFFAOYSA-N 1 2 322.170 4.439 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2c(Cl)ccc(O)c2F)cc1 ZINC001244543168 1057992312 /nfs/dbraw/zinc/99/23/12/1057992312.db2.gz VABDLQXTGZCGRW-UHFFFAOYSA-N 1 2 302.736 4.252 20 0 DIADLO C/C(=C\C=C\[NH3+])c1ccc(Br)cc1OC(F)(F)F ZINC001244551699 1057993501 /nfs/dbraw/zinc/99/35/01/1057993501.db2.gz RGDXVQIKYBVEDH-YALUOGEHSA-N 1 2 322.124 4.223 20 0 DIADLO Cc1cc(Cl)c(N)c(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1 ZINC001244588804 1058003193 /nfs/dbraw/zinc/00/31/93/1058003193.db2.gz GOWZKVHHQMLSHN-UHFFFAOYSA-N 1 2 301.752 4.222 20 0 DIADLO Oc1c(Cl)ccc(-c2ccccc2C[NH+]2CCCC2)c1F ZINC001244632068 1058014729 /nfs/dbraw/zinc/01/47/29/1058014729.db2.gz BUMVKVRXTUCAIZ-UHFFFAOYSA-N 1 2 305.780 4.448 20 0 DIADLO Cc1ccc(OCc2ccccc2)c(-c2cc(N)cc[nH+]2)c1F ZINC001244638498 1058016809 /nfs/dbraw/zinc/01/68/09/1058016809.db2.gz IUVYWAIYACKTCE-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO Cc1cc(-c2cc(F)c(C[NH+](C)C)c(F)c2)cnc1OC(C)C ZINC001244687947 1058026249 /nfs/dbraw/zinc/02/62/49/1058026249.db2.gz IJHBRQBZJXWYOC-UHFFFAOYSA-N 1 2 320.383 4.184 20 0 DIADLO CSc1cc(-c2ccn3cc(N)[nH+]c3c2)ccc1C(F)(F)F ZINC001244849776 1058058217 /nfs/dbraw/zinc/05/82/17/1058058217.db2.gz QMKLYFXIXRIXMG-UHFFFAOYSA-N 1 2 323.343 4.324 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(C4CCC4)cc3)nn2)c1C ZINC001244943502 1058077159 /nfs/dbraw/zinc/07/71/59/1058077159.db2.gz GVFFCFBVULNVBK-UHFFFAOYSA-N 1 2 304.397 4.214 20 0 DIADLO CNc1cc(-c2ccc(OCc3ccccc3)nc2C)cc[nH+]1 ZINC001244973337 1058084309 /nfs/dbraw/zinc/08/43/09/1058084309.db2.gz MUULKILWMDOEBL-UHFFFAOYSA-N 1 2 305.381 4.073 20 0 DIADLO CNc1cc(-c2ccc(-c3ccc(C(=O)OC)cc3)cc2)cc[nH+]1 ZINC001244972603 1058084375 /nfs/dbraw/zinc/08/43/75/1058084375.db2.gz HMYFSLHQVSQZBG-UHFFFAOYSA-N 1 2 318.376 4.244 20 0 DIADLO CCOC(=O)c1csc2cc(-c3cc[nH+]c(NC)c3)ccc12 ZINC001244977465 1058084915 /nfs/dbraw/zinc/08/49/15/1058084915.db2.gz GDKOCAISXFEPRL-UHFFFAOYSA-N 1 2 312.394 4.182 20 0 DIADLO Cc1cn2c(cccc2-c2c(Cl)cc(CO)cc2Cl)[nH+]1 ZINC001245007500 1058090700 /nfs/dbraw/zinc/09/07/00/1058090700.db2.gz JPMIUSQSWYATGY-UHFFFAOYSA-N 1 2 307.180 4.109 20 0 DIADLO COc1cc(C)c(C)cc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001245023406 1058096251 /nfs/dbraw/zinc/09/62/51/1058096251.db2.gz ZMTLNRUBGMHNTP-UHFFFAOYSA-N 1 2 305.368 4.319 20 0 DIADLO Cc1cc(F)cc(Cl)c1-c1ccccc1C[NH+]1CCOCC1 ZINC001245060081 1058105287 /nfs/dbraw/zinc/10/52/87/1058105287.db2.gz SPIFGUMURVKXRZ-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2ccc(C)c(Cl)c2Cl)cc1 ZINC001245095488 1058111541 /nfs/dbraw/zinc/11/15/41/1058111541.db2.gz IYVTYYYYZHGIDM-HNNXBMFYSA-N 1 2 324.207 4.142 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1cccc(Cl)c1Cl ZINC001245099313 1058113361 /nfs/dbraw/zinc/11/33/61/1058113361.db2.gz WOMYSTFAMSWRJF-UHFFFAOYSA-N 1 2 323.223 4.200 20 0 DIADLO Cc1ccc(Cl)cc1NC(=S)Nc1ccc2[nH+]ccn2c1 ZINC001245134931 1058118778 /nfs/dbraw/zinc/11/87/78/1058118778.db2.gz UUXXMJDJOPOFTP-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO COC(=O)c1cc(-c2c[nH+]cn2Cc2ccccc2)c(C)cc1C ZINC001245198228 1058126890 /nfs/dbraw/zinc/12/68/90/1058126890.db2.gz VWTJDVXAKSTROA-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO COc1cc(-c2c[nH+]cn2Cc2ccccc2)ccc1OC(C)C ZINC001245200980 1058126921 /nfs/dbraw/zinc/12/69/21/1058126921.db2.gz MLCAIJRDZUJAHG-UHFFFAOYSA-N 1 2 322.408 4.394 20 0 DIADLO COc1cnc2cc(-c3c[nH+]cn3Cc3ccccc3)ccc2c1 ZINC001245199108 1058126995 /nfs/dbraw/zinc/12/69/95/1058126995.db2.gz POPKVERXYFNFGR-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO CC(=O)Nc1ccc(-c2c[nH+]cn2Cc2ccccc2)c(C)c1C ZINC001245200327 1058127119 /nfs/dbraw/zinc/12/71/19/1058127119.db2.gz KSGJILSUAUKSJL-UHFFFAOYSA-N 1 2 319.408 4.174 20 0 DIADLO COc1c(F)cc(SC)cc1-c1cc(C)c2[nH+]ccn2c1 ZINC001245226846 1058130072 /nfs/dbraw/zinc/13/00/72/1058130072.db2.gz RNJRJJAGRHRXQT-UHFFFAOYSA-N 1 2 302.374 4.179 20 0 DIADLO c1cn(-c2ccc(-c3ccnc(OCC4CCC4)c3)cc2)c[nH+]1 ZINC001245239139 1058133283 /nfs/dbraw/zinc/13/32/83/1058133283.db2.gz LFFFEGIQPVQHGB-UHFFFAOYSA-N 1 2 305.381 4.113 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccnc(OCC3CCC3)c2)c1 ZINC001245241180 1058133597 /nfs/dbraw/zinc/13/35/97/1058133597.db2.gz DMHGJOVEDRDKSO-UHFFFAOYSA-N 1 2 310.397 4.289 20 0 DIADLO Cc1c(C)c(C)c(-c2cncc(C[NH+]3CCOCC3)c2)c(C)c1C ZINC001245252200 1058135601 /nfs/dbraw/zinc/13/56/01/1058135601.db2.gz SZJGDTLDOOUZBN-UHFFFAOYSA-N 1 2 324.468 4.123 20 0 DIADLO CCOC(=O)c1ccc(-c2cc([NH+](CC)CC)ccc2C)cn1 ZINC001245258361 1058136213 /nfs/dbraw/zinc/13/62/13/1058136213.db2.gz MBWSGTAYUAOTRE-UHFFFAOYSA-N 1 2 312.413 4.080 20 0 DIADLO COc1c(-c2cc(C)cn3cc[nH+]c23)cccc1C(F)(F)F ZINC001245275617 1058138446 /nfs/dbraw/zinc/13/84/46/1058138446.db2.gz RBSWSWAUULLASW-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Nc1ccc2cc(-c3ccc(F)c(-n4cc[nH+]c4)c3)ccc2c1 ZINC001245370491 1058154472 /nfs/dbraw/zinc/15/44/72/1058154472.db2.gz WWPUVJWWEYUHRZ-UHFFFAOYSA-N 1 2 303.340 4.414 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cc(F)cc(N)c2Cl)c1 ZINC001245465706 1058172991 /nfs/dbraw/zinc/17/29/91/1058172991.db2.gz CYJGIGXRWOSISE-UHFFFAOYSA-N 1 2 301.752 4.129 20 0 DIADLO Nc1cc(F)cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1Cl ZINC001245465715 1058173026 /nfs/dbraw/zinc/17/30/26/1058173026.db2.gz BMWCRGHJZMMWEH-UHFFFAOYSA-N 1 2 305.715 4.053 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc(F)cc(N)c1Cl ZINC001245468078 1058174100 /nfs/dbraw/zinc/17/41/00/1058174100.db2.gz YACAGHCJUAXZFH-UHFFFAOYSA-N 1 2 319.811 4.422 20 0 DIADLO Cc1cc(NC(=O)C=C[C@]2(C)CC[C@@H](C)C2(C)C)c(C)c[nH+]1 ZINC001527662915 1058200014 /nfs/dbraw/zinc/20/00/14/1058200014.db2.gz XDPGDQNBFDGNOX-XGKLZFSYSA-N 1 2 300.446 4.077 20 0 DIADLO Cc1cc(-c2cc(C(F)(F)F)c3c(n2)CCCCC3)c[nH+]c1N ZINC001245537623 1058216036 /nfs/dbraw/zinc/21/60/36/1058216036.db2.gz SUQNKKQHBANJIQ-UHFFFAOYSA-N 1 2 321.346 4.322 20 0 DIADLO Cc1cc(-c2cnc3[nH]c(-c4ccccc4)cc3c2)c[nH+]c1N ZINC001245536969 1058216222 /nfs/dbraw/zinc/21/62/22/1058216222.db2.gz POPYNNLKYCDTHS-UHFFFAOYSA-N 1 2 300.365 4.183 20 0 DIADLO Cc1cc(-c2ccc3cc(C(F)(F)F)cnc3c2)c[nH+]c1N ZINC001245539537 1058220202 /nfs/dbraw/zinc/22/02/02/1058220202.db2.gz MKOKMLYEWFRYFV-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO COC(=O)c1cc(-c2ccccc2Cn2cc[nH+]c2)c(C)cc1C ZINC001245554013 1058226167 /nfs/dbraw/zinc/22/61/67/1058226167.db2.gz DXJKUDBCZQBYHS-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc2cc(C)ccc2[nH]1 ZINC001245571986 1058238052 /nfs/dbraw/zinc/23/80/52/1058238052.db2.gz JJZLKFNWRGZQGN-UHFFFAOYSA-N 1 2 303.365 4.338 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cc3ccc(F)cc3[nH]2)cc1F ZINC001245590787 1058262240 /nfs/dbraw/zinc/26/22/40/1058262240.db2.gz ZHTYNHUCMZLELD-UHFFFAOYSA-N 1 2 304.315 4.314 20 0 DIADLO COc1ccc2[nH]c(-c3ccc(-c4c[nH+]cn4C)cc3)cc2c1 ZINC001245596205 1058268942 /nfs/dbraw/zinc/26/89/42/1058268942.db2.gz SRTYRDQMGOPRNR-UHFFFAOYSA-N 1 2 303.365 4.244 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(-c2ncco2)cc1 ZINC001245625782 1058294604 /nfs/dbraw/zinc/29/46/04/1058294604.db2.gz PYVXRWZFDLQQNX-UHFFFAOYSA-N 1 2 317.348 4.203 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2Cc2ccnc(F)c2C)sc1C ZINC001549631725 1058300408 /nfs/dbraw/zinc/30/04/08/1058300408.db2.gz LAGZZZQLHCCHPA-OAHLLOKOSA-N 1 2 319.449 4.330 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2Cc2ccnc(F)c2C)sc1C ZINC001549631725 1058300415 /nfs/dbraw/zinc/30/04/15/1058300415.db2.gz LAGZZZQLHCCHPA-OAHLLOKOSA-N 1 2 319.449 4.330 20 0 DIADLO Oc1cc(F)c(-c2cnccc2C[NH+]2CCCCC2)cc1Cl ZINC001245674449 1058336415 /nfs/dbraw/zinc/33/64/15/1058336415.db2.gz XXNBLTRTOZJGPZ-UHFFFAOYSA-N 1 2 320.795 4.233 20 0 DIADLO CCc1ncc(C[N@@H+]2CCCC[C@H]2c2nc(C)c(C)s2)o1 ZINC001550530492 1058345033 /nfs/dbraw/zinc/34/50/33/1058345033.db2.gz DCPHPGNAHJYKDQ-AWEZNQCLSA-N 1 2 305.447 4.038 20 0 DIADLO CCc1ncc(C[N@H+]2CCCC[C@H]2c2nc(C)c(C)s2)o1 ZINC001550530492 1058345055 /nfs/dbraw/zinc/34/50/55/1058345055.db2.gz DCPHPGNAHJYKDQ-AWEZNQCLSA-N 1 2 305.447 4.038 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2Cc2cnc(F)c(C)c2)sc1C ZINC001550624382 1058350214 /nfs/dbraw/zinc/35/02/14/1058350214.db2.gz WNLMZKTZEQVSRR-HNNXBMFYSA-N 1 2 319.449 4.330 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2Cc2cnc(F)c(C)c2)sc1C ZINC001550624382 1058350230 /nfs/dbraw/zinc/35/02/30/1058350230.db2.gz WNLMZKTZEQVSRR-HNNXBMFYSA-N 1 2 319.449 4.330 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCCCc3ccccc32)c(C)[nH+]1 ZINC001562901262 1058357139 /nfs/dbraw/zinc/35/71/39/1058357139.db2.gz JJFAXCNOSOELQY-UHFFFAOYSA-N 1 2 309.413 4.382 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1CNC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001562900478 1058357588 /nfs/dbraw/zinc/35/75/88/1058357588.db2.gz FRWYTCCGJJCZCD-HZPDHXFCSA-N 1 2 303.450 4.345 20 0 DIADLO COc1cc(-c2cccc3[nH+]c(C)cn32)ccc1OC(F)(F)F ZINC001245713453 1058387192 /nfs/dbraw/zinc/38/71/92/1058387192.db2.gz NHZMPRKVRJATBB-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO CC[C@H]1CCC[C@@H]1C(=O)Nc1ccccc1-c1[nH]c(C)c(C)[nH+]1 ZINC001551738637 1058408492 /nfs/dbraw/zinc/40/84/92/1058408492.db2.gz IDXMGXFPHOADLM-GJZGRUSLSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H](C)C2CCCC2)[nH+]c1C ZINC001551744206 1058410647 /nfs/dbraw/zinc/41/06/47/1058410647.db2.gz ZDQVCWIEEVAPAJ-GFCCVEGCSA-N 1 2 311.429 4.458 20 0 DIADLO CC(C)CCCC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001519381761 1058422897 /nfs/dbraw/zinc/42/28/97/1058422897.db2.gz PJIGQKYBGKUZRV-UHFFFAOYSA-N 1 2 305.809 4.291 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C1CCC=CCC1 ZINC001519379766 1058423479 /nfs/dbraw/zinc/42/34/79/1058423479.db2.gz IWIRCLCWEHSNLC-UHFFFAOYSA-N 1 2 315.804 4.211 20 0 DIADLO COc1ccc(Cl)cc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001245813872 1058498894 /nfs/dbraw/zinc/49/88/94/1058498894.db2.gz JZJZAMGJMYUZKW-UHFFFAOYSA-N 1 2 311.759 4.355 20 0 DIADLO CCOc1cc(-c2cccc(-c3c[nH+]cn3C)c2)c(Cl)cn1 ZINC001245817672 1058505321 /nfs/dbraw/zinc/50/53/21/1058505321.db2.gz QXJVZYQJTPIVAK-UHFFFAOYSA-N 1 2 313.788 4.201 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C[C@H](C)n2cccc2)[nH+]c1C ZINC001553990594 1058511248 /nfs/dbraw/zinc/51/12/48/1058511248.db2.gz YRXZBLDSLJMSEO-ZDUSSCGKSA-N 1 2 322.412 4.085 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C[C@@H](C)n2cccc2)[nH+]c1C ZINC001553990592 1058513236 /nfs/dbraw/zinc/51/32/36/1058513236.db2.gz YRXZBLDSLJMSEO-CYBMUJFWSA-N 1 2 322.412 4.085 20 0 DIADLO Cc1cc(-c2cc(F)cc(C(F)(F)F)c2Cl)c[nH+]c1N ZINC001245842474 1058545535 /nfs/dbraw/zinc/54/55/35/1058545535.db2.gz UZYQRUQGTSXOMU-UHFFFAOYSA-N 1 2 304.674 4.451 20 0 DIADLO COc1cc(-c2[nH+]c(C)cc3[nH]ccc32)c(F)c(F)c1Cl ZINC001245856628 1058562779 /nfs/dbraw/zinc/56/27/79/1058562779.db2.gz DOFRIJRPGKJWPH-UHFFFAOYSA-N 1 2 308.715 4.479 20 0 DIADLO Cc1ccc(NC(=O)/C=C\c2cc(C)c(C)cc2C)c(N(C)C)[nH+]1 ZINC001520236177 1058563016 /nfs/dbraw/zinc/56/30/16/1058563016.db2.gz CHVVYDXCDRYFIZ-NTMALXAHSA-N 1 2 323.440 4.033 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1ccc(C2CCC2)cc1)n1cc[nH+]c1 ZINC001556406989 1058588947 /nfs/dbraw/zinc/58/89/47/1058588947.db2.gz GLCMDNBKWJICEU-SFHVURJKSA-N 1 2 311.429 4.377 20 0 DIADLO CC(C)C[C@H](C)C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001529257334 1058656256 /nfs/dbraw/zinc/65/62/56/1058656256.db2.gz QDMNOEAOMOWCCN-JKSUJKDBSA-N 1 2 319.493 4.026 20 0 DIADLO CCCc1ccc(CCCC(=O)NCc2cc(C)[nH+]c(C)c2)cc1 ZINC001529389549 1058695568 /nfs/dbraw/zinc/69/55/68/1058695568.db2.gz BRDSWJZTQXQEGH-UHFFFAOYSA-N 1 2 324.468 4.290 20 0 DIADLO Cc1cc(C)c(C(=O)NC2CCC(C3CCC3)CC2)c(C)[nH+]1 ZINC001529470784 1058723253 /nfs/dbraw/zinc/72/32/53/1058723253.db2.gz WBJJBSIETYQABG-UHFFFAOYSA-N 1 2 300.446 4.096 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C2CCC2)C2CCCCC2)c(C)[nH+]1 ZINC001529691143 1058800930 /nfs/dbraw/zinc/80/09/30/1058800930.db2.gz PBLHCSXUGIKVAM-IBGZPJMESA-N 1 2 314.473 4.486 20 0 DIADLO C/C(=C\C(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1)c1ccco1 ZINC001558136091 1058841928 /nfs/dbraw/zinc/84/19/28/1058841928.db2.gz XXOMRSICPVUKRF-VAWYXSNFSA-N 1 2 321.380 4.329 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)[C@H](C)[C@H](C)C(C)(C)C)[nH+]c1C ZINC001558353225 1058859781 /nfs/dbraw/zinc/85/97/81/1058859781.db2.gz PMTDNIBMYSYGOT-XUJVJEKNSA-N 1 2 305.466 4.008 20 0 DIADLO CCC[C@H](C(=O)N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1)C(C)C ZINC001558953075 1058927045 /nfs/dbraw/zinc/92/70/45/1058927045.db2.gz AKUBGEHRICQLFV-QAPCUYQASA-N 1 2 313.445 4.122 20 0 DIADLO CC(C)[C@@H](CCc1ccccc1)C(=O)Nc1cccc2[nH+]ccn21 ZINC001521674350 1058938272 /nfs/dbraw/zinc/93/82/72/1058938272.db2.gz ZLAYVWYISNQISH-QGZVFWFLSA-N 1 2 321.424 4.178 20 0 DIADLO C/C(=C/c1cccc(Cl)c1)C(=O)Nc1cccc2[nH+]ccn21 ZINC001521673792 1058938543 /nfs/dbraw/zinc/93/85/43/1058938543.db2.gz PEFWSEGTAUETON-BENRWUELSA-N 1 2 311.772 4.030 20 0 DIADLO C/C(=C\c1cccc(Cl)c1)C(=O)Nc1cccc2[nH+]ccn21 ZINC001521673793 1058939485 /nfs/dbraw/zinc/93/94/85/1058939485.db2.gz PEFWSEGTAUETON-ZRDIBKRKSA-N 1 2 311.772 4.030 20 0 DIADLO COc1ccc(CCNc2cc(C(C)C)[nH+]c(C(C)C)n2)cc1 ZINC001559052888 1058951418 /nfs/dbraw/zinc/95/14/18/1058951418.db2.gz JFRBVFSPYRZXOW-UHFFFAOYSA-N 1 2 313.445 4.387 20 0 DIADLO CCOc1ccc(Sc2nc3ccccc3n3c[nH+]cc23)cc1 ZINC001559058245 1058956783 /nfs/dbraw/zinc/95/67/83/1058956783.db2.gz HIIFDJBGHKMCMR-UHFFFAOYSA-N 1 2 321.405 4.432 20 0 DIADLO CCc1cc(N2CCC[C@@H]2c2ccccc2Cl)nc(C)[nH+]1 ZINC001559075878 1058967742 /nfs/dbraw/zinc/96/77/42/1058967742.db2.gz ZNVLVYUQHOHSMF-MRXNPFEDSA-N 1 2 301.821 4.342 20 0 DIADLO CC[C@H](Nc1cc(C)[nH+]c(C2CCC2)n1)c1nc(C)cs1 ZINC001559100794 1058987633 /nfs/dbraw/zinc/98/76/33/1058987633.db2.gz ZJCGIILPIXMMKV-ZDUSSCGKSA-N 1 2 302.447 4.381 20 0 DIADLO CCC(CC)(CNc1nc2ccccc2n2c[nH+]cc12)SC ZINC001559121207 1059009900 /nfs/dbraw/zinc/00/99/00/1059009900.db2.gz MRWCUKMRBGWTQH-UHFFFAOYSA-N 1 2 314.458 4.216 20 0 DIADLO CO[C@]1(C)C[C@H](N(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)C1(C)C ZINC001559125175 1059013102 /nfs/dbraw/zinc/01/31/02/1059013102.db2.gz FRHQXHKPJDHPOL-HNAYVOBHSA-N 1 2 319.493 4.363 20 0 DIADLO CCc1cc(N2CC[C@H](c3ccc(C)cc3C)C2)nc(CC)[nH+]1 ZINC001559184210 1059070609 /nfs/dbraw/zinc/07/06/09/1059070609.db2.gz YYOGEDMBDNPSHY-INIZCTEOSA-N 1 2 309.457 4.212 20 0 DIADLO Cc1cc(N[C@@H](C)CCCc2cccnc2)nc(C2CCC2)[nH+]1 ZINC001559209329 1059088049 /nfs/dbraw/zinc/08/80/49/1059088049.db2.gz WMKHMPGUPAKGGB-AWEZNQCLSA-N 1 2 310.445 4.271 20 0 DIADLO Cc1c[nH+]c(CCNc2nc(C3CCCCC3)ns2)c(C)c1 ZINC001559223375 1059102612 /nfs/dbraw/zinc/10/26/12/1059102612.db2.gz ASVPNNJIDZRXLL-UHFFFAOYSA-N 1 2 316.474 4.252 20 0 DIADLO CCSc1ccc(CNc2cc(CC)[nH+]c(CC)n2)cc1 ZINC001559267599 1059132219 /nfs/dbraw/zinc/13/22/19/1059132219.db2.gz XIJWYVDRVLXKEQ-UHFFFAOYSA-N 1 2 301.459 4.326 20 0 DIADLO CC[C@H](Nc1cc(C)[nH+]c(C2CC2)n1)c1cc(F)ccc1OC ZINC001559284117 1059140922 /nfs/dbraw/zinc/14/09/22/1059140922.db2.gz OHTXNXPZJWKFRN-HNNXBMFYSA-N 1 2 315.392 4.373 20 0 DIADLO CO[C@H](CSc1[nH+]cc2ccccn21)c1ccc(Cl)cc1 ZINC001559323658 1059160986 /nfs/dbraw/zinc/16/09/86/1059160986.db2.gz LONBTLIBRVJCEW-OAHLLOKOSA-N 1 2 318.829 4.468 20 0 DIADLO Cc1ccc2[nH+]c(CS[C@H]3CCOc4ccccc43)cn2c1 ZINC001559384709 1059197870 /nfs/dbraw/zinc/19/78/70/1059197870.db2.gz RBGKKRWVXXXVBG-KRWDZBQOSA-N 1 2 310.422 4.400 20 0 DIADLO CCc1cccc(Cn2c[nH+]c(Cc3ccccc3OC)c2)c1 ZINC001559479222 1059253103 /nfs/dbraw/zinc/25/31/03/1059253103.db2.gz VWTHJEWZQVBRRF-UHFFFAOYSA-N 1 2 306.409 4.093 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cccc2c1OC(F)(F)O2 ZINC001559487947 1059261426 /nfs/dbraw/zinc/26/14/26/1059261426.db2.gz SEVWWRVKYGQRBP-LLVKDONJSA-N 1 2 323.314 4.340 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cccc2c1OC(F)(F)O2 ZINC001559487947 1059261446 /nfs/dbraw/zinc/26/14/46/1059261446.db2.gz SEVWWRVKYGQRBP-LLVKDONJSA-N 1 2 323.314 4.340 20 0 DIADLO OCCCCc1[nH+]c2ccc(F)c(F)c2n1C1CCCCC1 ZINC001247042187 1059264223 /nfs/dbraw/zinc/26/42/23/1059264223.db2.gz UPBOVPAKCHXAHR-UHFFFAOYSA-N 1 2 308.372 4.135 20 0 DIADLO C(=C/c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1)\c1cccs1 ZINC001247047805 1059271871 /nfs/dbraw/zinc/27/18/71/1059271871.db2.gz ZLLHKDNNJPDCCK-BQYQJAHWSA-N 1 2 320.377 4.154 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1cccc(C)c1Br ZINC001559519263 1059316466 /nfs/dbraw/zinc/31/64/66/1059316466.db2.gz XTIWBKPIUKFVGO-UHFFFAOYSA-N 1 2 308.219 4.373 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1cccc(C)c1Br ZINC001559519263 1059316484 /nfs/dbraw/zinc/31/64/84/1059316484.db2.gz XTIWBKPIUKFVGO-UHFFFAOYSA-N 1 2 308.219 4.373 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+](Cc1ccc(F)c(Cl)c1)CC2 ZINC001559502939 1059288314 /nfs/dbraw/zinc/28/83/14/1059288314.db2.gz SBLFIEPHSFDXTA-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+](Cc1ccc(F)c(Cl)c1)CC2 ZINC001559502939 1059288336 /nfs/dbraw/zinc/28/83/36/1059288336.db2.gz SBLFIEPHSFDXTA-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO Cc1cccc(N(C)Cc2c[nH+]c(N(C)C)c3ccccc23)c1 ZINC001559523089 1059321109 /nfs/dbraw/zinc/32/11/09/1059321109.db2.gz GSVHDSFWRZQOAP-UHFFFAOYSA-N 1 2 305.425 4.246 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](CCCC3CCC3)CCO2)cc1Cl ZINC001559521475 1059321957 /nfs/dbraw/zinc/32/19/57/1059321957.db2.gz IRGIALUFLCFXPA-KRWDZBQOSA-N 1 2 311.828 4.433 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](CCCC3CCC3)CCO2)cc1Cl ZINC001559521475 1059321979 /nfs/dbraw/zinc/32/19/79/1059321979.db2.gz IRGIALUFLCFXPA-KRWDZBQOSA-N 1 2 311.828 4.433 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2ncccc2Cl)[C@@H]1c1ccccc1 ZINC001559543530 1059346585 /nfs/dbraw/zinc/34/65/85/1059346585.db2.gz XJVAMUROZJEPIC-GUYCJALGSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2ncccc2Cl)[C@@H]1c1ccccc1 ZINC001559543530 1059346605 /nfs/dbraw/zinc/34/66/05/1059346605.db2.gz XJVAMUROZJEPIC-GUYCJALGSA-N 1 2 318.873 4.414 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@H](C(C)C)CC1 ZINC001559546115 1059350224 /nfs/dbraw/zinc/35/02/24/1059350224.db2.gz OBZBGWYUOSDGCZ-YOEHRIQHSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@H](C(C)C)CC1 ZINC001559546115 1059350243 /nfs/dbraw/zinc/35/02/43/1059350243.db2.gz OBZBGWYUOSDGCZ-YOEHRIQHSA-N 1 2 323.864 4.312 20 0 DIADLO CCc1ccc(NC(=S)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001247281649 1059366789 /nfs/dbraw/zinc/36/67/89/1059366789.db2.gz GKVCPMNDQYUSAF-UHFFFAOYSA-N 1 2 322.437 4.244 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@@H+]1CCC2(C1)CCCCC2 ZINC001559561668 1059381258 /nfs/dbraw/zinc/38/12/58/1059381258.db2.gz MLSROYHMFIYXFA-INIZCTEOSA-N 1 2 321.848 4.210 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@H+]1CCC2(C1)CCCCC2 ZINC001559561668 1059381279 /nfs/dbraw/zinc/38/12/79/1059381279.db2.gz MLSROYHMFIYXFA-INIZCTEOSA-N 1 2 321.848 4.210 20 0 DIADLO Fc1cccc(F)c1CCC[N@@H+]1CCc2c(F)ccc(F)c2C1 ZINC001559584752 1059420410 /nfs/dbraw/zinc/42/04/10/1059420410.db2.gz WEDZHVRXZZUUSM-UHFFFAOYSA-N 1 2 323.333 4.234 20 0 DIADLO Fc1cccc(F)c1CCC[N@H+]1CCc2c(F)ccc(F)c2C1 ZINC001559584752 1059420420 /nfs/dbraw/zinc/42/04/20/1059420420.db2.gz WEDZHVRXZZUUSM-UHFFFAOYSA-N 1 2 323.333 4.234 20 0 DIADLO C[C@H]1CCN(Cc2cc[nH+]c(N(C)C)c2)c2ccccc2S1 ZINC001559605776 1059440375 /nfs/dbraw/zinc/44/03/75/1059440375.db2.gz DJAAXPONFAAFFQ-AWEZNQCLSA-N 1 2 313.470 4.039 20 0 DIADLO Clc1ncsc1C[N@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC001559604957 1059440519 /nfs/dbraw/zinc/44/05/19/1059440519.db2.gz WZZQLAVHBVVLEU-AWEZNQCLSA-N 1 2 304.846 4.448 20 0 DIADLO Clc1ncsc1C[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC001559604957 1059440529 /nfs/dbraw/zinc/44/05/29/1059440529.db2.gz WZZQLAVHBVVLEU-AWEZNQCLSA-N 1 2 304.846 4.448 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1C[C@@H](C)CC(C)(C)C1 ZINC001559675254 1059504491 /nfs/dbraw/zinc/50/44/91/1059504491.db2.gz DOWZLANODGRSCA-BBRMVZONSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1C[C@@H](C)CC(C)(C)C1 ZINC001559675254 1059504515 /nfs/dbraw/zinc/50/45/15/1059504515.db2.gz DOWZLANODGRSCA-BBRMVZONSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC001559682859 1059511499 /nfs/dbraw/zinc/51/14/99/1059511499.db2.gz RVGDZWKPTSQFIK-CJNGLKHVSA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC001559682859 1059511521 /nfs/dbraw/zinc/51/15/21/1059511521.db2.gz RVGDZWKPTSQFIK-CJNGLKHVSA-N 1 2 321.848 4.066 20 0 DIADLO CC[C@@]1(C)COCC[N@@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001559713727 1059544190 /nfs/dbraw/zinc/54/41/90/1059544190.db2.gz XLYYWAAODDHJIA-HNNXBMFYSA-N 1 2 302.245 4.037 20 0 DIADLO CC[C@@]1(C)COCC[N@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001559713727 1059544210 /nfs/dbraw/zinc/54/42/10/1059544210.db2.gz XLYYWAAODDHJIA-HNNXBMFYSA-N 1 2 302.245 4.037 20 0 DIADLO CCC(C)(C)C1CCC(NC(=O)c2cccc3[nH+]ccn32)CC1 ZINC001524599045 1059551600 /nfs/dbraw/zinc/55/16/00/1059551600.db2.gz ZEIUNRAJEMNETI-UHFFFAOYSA-N 1 2 313.445 4.059 20 0 DIADLO CC(C)(C)C1=CC[N@H+](Cc2sncc2Br)CC1 ZINC001559719499 1059551988 /nfs/dbraw/zinc/55/19/88/1059551988.db2.gz HFZUCCUUBMDZJW-UHFFFAOYSA-N 1 2 315.280 4.084 20 0 DIADLO CC(C)(C)C1=CC[N@@H+](Cc2sncc2Br)CC1 ZINC001559719499 1059552003 /nfs/dbraw/zinc/55/20/03/1059552003.db2.gz HFZUCCUUBMDZJW-UHFFFAOYSA-N 1 2 315.280 4.084 20 0 DIADLO CC(C)(C)c1ccc(-c2noc([C@H]([NH3+])c3ccccc3)n2)cc1 ZINC001247650025 1059587648 /nfs/dbraw/zinc/58/76/48/1059587648.db2.gz GEXSLKIJILDXAI-MRXNPFEDSA-N 1 2 307.397 4.082 20 0 DIADLO Cc1nc(C[NH+]2CC(C)(C)OC(C)(C)C2)sc1C(C)(C)C ZINC001559756615 1059588887 /nfs/dbraw/zinc/58/88/87/1059588887.db2.gz DVMYMOUYOWXMCU-UHFFFAOYSA-N 1 2 310.507 4.138 20 0 DIADLO CC(C)c1ccc(-c2noc([C@H]([NH3+])[C@@H](C)OC(C)(C)C)n2)cc1 ZINC001247699745 1059593200 /nfs/dbraw/zinc/59/32/00/1059593200.db2.gz LAWWNNFBSBOCBH-IUODEOHRSA-N 1 2 317.433 4.063 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)nn1)c1cc(Cl)ccc1Cl ZINC001559771403 1059607604 /nfs/dbraw/zinc/60/76/04/1059607604.db2.gz VCWXMPYFQQGKSB-QMMMGPOBSA-N 1 2 316.619 4.288 20 0 DIADLO CCCC[C@@H]([NH2+][C@@H]1CC(C)(C)CCc2ccccc21)C(=O)OC ZINC001559782365 1059618893 /nfs/dbraw/zinc/61/88/93/1059618893.db2.gz MFDDYJYMQLDJIX-QZTJIDSGSA-N 1 2 317.473 4.412 20 0 DIADLO CCCC[C@@H]([NH2+][C@H]1CC(C)(C)CCc2ccccc21)C(=O)OC ZINC001559782364 1059619070 /nfs/dbraw/zinc/61/90/70/1059619070.db2.gz MFDDYJYMQLDJIX-MSOLQXFVSA-N 1 2 317.473 4.412 20 0 DIADLO Cc1cc(F)cc2c1C[N@H+](Cc1ccc(Cl)c(F)c1)CC2 ZINC001559785201 1059622279 /nfs/dbraw/zinc/62/22/79/1059622279.db2.gz QZOXUKCPQSBJAZ-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO Cc1cc(F)cc2c1C[N@@H+](Cc1ccc(Cl)c(F)c1)CC2 ZINC001559785201 1059622286 /nfs/dbraw/zinc/62/22/86/1059622286.db2.gz QZOXUKCPQSBJAZ-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO COC[C@H](c1ccc(Cl)cc1)[N@@H+](C)CC=C(Cl)Cl ZINC001559803252 1059640815 /nfs/dbraw/zinc/64/08/15/1059640815.db2.gz ZLKHUPDONUDDSB-GFCCVEGCSA-N 1 2 308.636 4.278 20 0 DIADLO COC[C@H](c1ccc(Cl)cc1)[N@H+](C)CC=C(Cl)Cl ZINC001559803252 1059640808 /nfs/dbraw/zinc/64/08/08/1059640808.db2.gz ZLKHUPDONUDDSB-GFCCVEGCSA-N 1 2 308.636 4.278 20 0 DIADLO Cc1ccc2c(c1)C[N@H+]([C@H](C)c1cc(F)ccc1F)CCO2 ZINC001559826581 1059661207 /nfs/dbraw/zinc/66/12/07/1059661207.db2.gz QQMFQOKYHYMCJN-CYBMUJFWSA-N 1 2 303.352 4.229 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+]([C@H](C)c1cc(F)ccc1F)CCO2 ZINC001559826581 1059661217 /nfs/dbraw/zinc/66/12/17/1059661217.db2.gz QQMFQOKYHYMCJN-CYBMUJFWSA-N 1 2 303.352 4.229 20 0 DIADLO C[N@@H+](Cc1c(F)cccc1F)C[C@@H]1CC2(CO1)CCCCC2 ZINC001559857718 1059679579 /nfs/dbraw/zinc/67/95/79/1059679579.db2.gz RZVSOPLLQCGEFR-AWEZNQCLSA-N 1 2 309.400 4.136 20 0 DIADLO C[N@H+](Cc1c(F)cccc1F)C[C@@H]1CC2(CO1)CCCCC2 ZINC001559857718 1059679592 /nfs/dbraw/zinc/67/95/92/1059679592.db2.gz RZVSOPLLQCGEFR-AWEZNQCLSA-N 1 2 309.400 4.136 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc3ccccc3c2)C[C@H](C(F)(F)F)O1 ZINC001559858850 1059680565 /nfs/dbraw/zinc/68/05/65/1059680565.db2.gz MDSBMHOZZLQEBS-MRXNPFEDSA-N 1 2 323.358 4.382 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc3ccccc3c2)C[C@H](C(F)(F)F)O1 ZINC001559858850 1059680570 /nfs/dbraw/zinc/68/05/70/1059680570.db2.gz MDSBMHOZZLQEBS-MRXNPFEDSA-N 1 2 323.358 4.382 20 0 DIADLO C[C@@H]1CC[N@H+](CC(=O)Nc2cc(Cl)ccc2Cl)[C@H](C)C1 ZINC001559929341 1059738794 /nfs/dbraw/zinc/73/87/94/1059738794.db2.gz JKROHEUFANNJMQ-GHMZBOCLSA-N 1 2 315.244 4.052 20 0 DIADLO C[C@@H]1CC[N@@H+](CC(=O)Nc2cc(Cl)ccc2Cl)[C@H](C)C1 ZINC001559929341 1059738806 /nfs/dbraw/zinc/73/88/06/1059738806.db2.gz JKROHEUFANNJMQ-GHMZBOCLSA-N 1 2 315.244 4.052 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@H+](C)C/C=C/c1ccc(Cl)cc1 ZINC001559960115 1059768812 /nfs/dbraw/zinc/76/88/12/1059768812.db2.gz KPHQJEZKRJTJSK-KXPUMZMLSA-N 1 2 323.864 4.405 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@@H+](C)C/C=C/c1ccc(Cl)cc1 ZINC001559960115 1059768831 /nfs/dbraw/zinc/76/88/31/1059768831.db2.gz KPHQJEZKRJTJSK-KXPUMZMLSA-N 1 2 323.864 4.405 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@H+](C)C/C=C\c1ccc(Cl)cc1 ZINC001559960118 1059769408 /nfs/dbraw/zinc/76/94/08/1059769408.db2.gz KPHQJEZKRJTJSK-XITLMJRVSA-N 1 2 323.864 4.405 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@@H+](C)C/C=C\c1ccc(Cl)cc1 ZINC001559960118 1059769417 /nfs/dbraw/zinc/76/94/17/1059769417.db2.gz KPHQJEZKRJTJSK-XITLMJRVSA-N 1 2 323.864 4.405 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2Cc3ccccc3NC(=O)[C@H]2C)cc1 ZINC001559989754 1059796585 /nfs/dbraw/zinc/79/65/85/1059796585.db2.gz XEWDBRXMOIJCNT-MRXNPFEDSA-N 1 2 322.452 4.228 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2Cc3ccccc3NC(=O)[C@H]2C)cc1 ZINC001559989754 1059796605 /nfs/dbraw/zinc/79/66/05/1059796605.db2.gz XEWDBRXMOIJCNT-MRXNPFEDSA-N 1 2 322.452 4.228 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)C1=C(c2ccccc2)CCCC1 ZINC001533110435 1059797460 /nfs/dbraw/zinc/79/74/60/1059797460.db2.gz VWQOUEUSCVKCSX-UHFFFAOYSA-N 1 2 317.392 4.301 20 0 DIADLO CC1(c2nc(-c3ccccc3-n3cc[nH+]c3)no2)CCCCC1 ZINC001248368611 1059800160 /nfs/dbraw/zinc/80/01/60/1059800160.db2.gz XQIBPVBBDGNJTA-UHFFFAOYSA-N 1 2 308.385 4.144 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2c3ccoc3ccc2F)no1 ZINC001248523967 1059867381 /nfs/dbraw/zinc/86/73/81/1059867381.db2.gz IZDMQYGBNRZFMB-INIZCTEOSA-N 1 2 300.333 4.205 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2c3ccoc3ccc2F)no1 ZINC001248523967 1059867407 /nfs/dbraw/zinc/86/74/07/1059867407.db2.gz IZDMQYGBNRZFMB-INIZCTEOSA-N 1 2 300.333 4.205 20 0 DIADLO Fc1ccc2occc2c1C[N@@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001248528822 1059867548 /nfs/dbraw/zinc/86/75/48/1059867548.db2.gz WPISHCYJOQZSMQ-AWEZNQCLSA-N 1 2 301.283 4.141 20 0 DIADLO Fc1ccc2occc2c1C[N@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001248528822 1059867574 /nfs/dbraw/zinc/86/75/74/1059867574.db2.gz WPISHCYJOQZSMQ-AWEZNQCLSA-N 1 2 301.283 4.141 20 0 DIADLO Cc1ccc2c(C[N@@H+]3CCC[C@@H](F)C(F)(F)C3)cccc2n1 ZINC001248550296 1059879241 /nfs/dbraw/zinc/87/92/41/1059879241.db2.gz ISBQDRDSVVJLNX-MRXNPFEDSA-N 1 2 308.347 4.112 20 0 DIADLO Cc1ccc2c(C[N@H+]3CCC[C@@H](F)C(F)(F)C3)cccc2n1 ZINC001248550296 1059879262 /nfs/dbraw/zinc/87/92/62/1059879262.db2.gz ISBQDRDSVVJLNX-MRXNPFEDSA-N 1 2 308.347 4.112 20 0 DIADLO Cc1cccc(Br)c1C[N@@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001248603291 1059910584 /nfs/dbraw/zinc/91/05/84/1059910584.db2.gz GUHADJPOQQSDLY-KGLIPLIRSA-N 1 2 318.205 4.030 20 0 DIADLO Cc1cccc(Br)c1C[N@H+]1CC[C@](C)(F)[C@H](F)C1 ZINC001248603291 1059910597 /nfs/dbraw/zinc/91/05/97/1059910597.db2.gz GUHADJPOQQSDLY-KGLIPLIRSA-N 1 2 318.205 4.030 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(C)c(COC(C)=O)c2)cc1 ZINC001248589978 1059906475 /nfs/dbraw/zinc/90/64/75/1059906475.db2.gz CKDIUWONGAEMPI-UHFFFAOYSA-N 1 2 312.413 4.258 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(C)c(COC(C)=O)c2)cc1 ZINC001248589978 1059906493 /nfs/dbraw/zinc/90/64/93/1059906493.db2.gz CKDIUWONGAEMPI-UHFFFAOYSA-N 1 2 312.413 4.258 20 0 DIADLO CCc1cccc(CC)c1NC(=S)Nc1cccc2[nH+]ccn21 ZINC001248633339 1059918574 /nfs/dbraw/zinc/91/85/74/1059918574.db2.gz AORLNWPVZZBUDT-UHFFFAOYSA-N 1 2 324.453 4.268 20 0 DIADLO CC(C)Oc1cc(C[N@@H+]2CCC[C@H](F)C2)cc(OC(C)C)c1 ZINC001248658657 1059927439 /nfs/dbraw/zinc/92/74/39/1059927439.db2.gz QACYYLXSJUJION-INIZCTEOSA-N 1 2 309.425 4.195 20 0 DIADLO CC(C)Oc1cc(C[N@H+]2CCC[C@H](F)C2)cc(OC(C)C)c1 ZINC001248658657 1059927462 /nfs/dbraw/zinc/92/74/62/1059927462.db2.gz QACYYLXSJUJION-INIZCTEOSA-N 1 2 309.425 4.195 20 0 DIADLO COc1c(C)c[nH+]c(CN(CC2CC2)c2ccc(C)cc2)c1C ZINC001560141406 1059943333 /nfs/dbraw/zinc/94/33/33/1059943333.db2.gz RUZPPCAUHQZOSI-UHFFFAOYSA-N 1 2 310.441 4.432 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@H+]1Cc2c[nH]nc2C[C@@H](C)C1 ZINC001560143437 1059945299 /nfs/dbraw/zinc/94/52/99/1059945299.db2.gz BAIDKMZZUXKMOV-GHMZBOCLSA-N 1 2 324.255 4.472 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@@H+]1Cc2c[nH]nc2C[C@@H](C)C1 ZINC001560143437 1059945325 /nfs/dbraw/zinc/94/53/25/1059945325.db2.gz BAIDKMZZUXKMOV-GHMZBOCLSA-N 1 2 324.255 4.472 20 0 DIADLO Fc1cc(C(F)(F)F)cnc1C[NH+]1CC2(C1)CCCCC2 ZINC001248790668 1059981231 /nfs/dbraw/zinc/98/12/31/1059981231.db2.gz ZPTYQBYGKZCQBY-UHFFFAOYSA-N 1 2 302.315 4.006 20 0 DIADLO Clc1cc(-c2ccccc2)ccc1CN1CCn2c[nH+]cc2C1 ZINC001248820175 1059995854 /nfs/dbraw/zinc/99/58/54/1059995854.db2.gz BILUTCXVYQBNIS-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO FC(F)(F)c1ccc2c(c1)C[N@@H+](Cc1ccc3n1CCC3)CC2 ZINC001248823887 1060001737 /nfs/dbraw/zinc/00/17/37/1060001737.db2.gz OYOAUQIGZZCBPL-UHFFFAOYSA-N 1 2 320.358 4.011 20 0 DIADLO FC(F)(F)c1ccc2c(c1)C[N@H+](Cc1ccc3n1CCC3)CC2 ZINC001248823887 1060001741 /nfs/dbraw/zinc/00/17/41/1060001741.db2.gz OYOAUQIGZZCBPL-UHFFFAOYSA-N 1 2 320.358 4.011 20 0 DIADLO COC(C[N@H+](C)Cc1ccc(-c2ccccc2)cc1Cl)OC ZINC001248820518 1060004138 /nfs/dbraw/zinc/00/41/38/1060004138.db2.gz OUKJJBTZXLTTIO-UHFFFAOYSA-N 1 2 319.832 4.058 20 0 DIADLO COC(C[N@@H+](C)Cc1ccc(-c2ccccc2)cc1Cl)OC ZINC001248820518 1060004160 /nfs/dbraw/zinc/00/41/60/1060004160.db2.gz OUKJJBTZXLTTIO-UHFFFAOYSA-N 1 2 319.832 4.058 20 0 DIADLO Cc1nc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)ccc1Cl ZINC001248878685 1060029837 /nfs/dbraw/zinc/02/98/37/1060029837.db2.gz WEODWIQKWOMHDY-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1nc(C[N@H+]2CCSC[C@@H]2c2ccccc2)ccc1Cl ZINC001248878685 1060029859 /nfs/dbraw/zinc/02/98/59/1060029859.db2.gz WEODWIQKWOMHDY-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO CC(C)Oc1ccccc1C[NH2+]Cc1coc(-c2ccccc2)n1 ZINC001560284172 1060062086 /nfs/dbraw/zinc/06/20/86/1060062086.db2.gz HFOMAQNLFSMEAB-UHFFFAOYSA-N 1 2 322.408 4.419 20 0 DIADLO CCc1cccc(-c2noc([C@H]([NH3+])c3ccc(Cl)cc3)n2)c1 ZINC001248998004 1060102460 /nfs/dbraw/zinc/10/24/60/1060102460.db2.gz GYNJFFPOENTGBB-OAHLLOKOSA-N 1 2 313.788 4.001 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)c2ccc(Cl)c(F)c2)c(C)[nH+]1 ZINC001534085511 1060132681 /nfs/dbraw/zinc/13/26/81/1060132681.db2.gz IJJRSPMVJOUEAU-LLVKDONJSA-N 1 2 320.795 4.290 20 0 DIADLO Cc1ccc(-c2noc([C@@H]([NH3+])c3cccc(Cl)c3)n2)cc1C ZINC001249067959 1060142186 /nfs/dbraw/zinc/14/21/86/1060142186.db2.gz STDZOJHGCLLYMV-HNNXBMFYSA-N 1 2 313.788 4.055 20 0 DIADLO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1sc(Cl)c2ccccc21 ZINC001249075383 1060146368 /nfs/dbraw/zinc/14/63/68/1060146368.db2.gz LDMFGQLPDHHMGF-AWEZNQCLSA-N 1 2 307.846 4.498 20 0 DIADLO CC(=O)[C@@H]1CCCC[N@H+]1Cc1sc(Cl)c2ccccc21 ZINC001249075383 1060146377 /nfs/dbraw/zinc/14/63/77/1060146377.db2.gz LDMFGQLPDHHMGF-AWEZNQCLSA-N 1 2 307.846 4.498 20 0 DIADLO COC[C@@H]([NH2+]Cc1cc(C(C)(C)C)oc1C)c1ccc(C)o1 ZINC001560362703 1060148926 /nfs/dbraw/zinc/14/89/26/1060148926.db2.gz WKWDEEZHQJMUGB-OAHLLOKOSA-N 1 2 305.418 4.264 20 0 DIADLO FC(F)c1ccc(C[NH2+]Cc2csc(-c3ccco3)n2)cn1 ZINC001560374202 1060159945 /nfs/dbraw/zinc/15/99/45/1060159945.db2.gz RAQAXUMDWNPVIK-UHFFFAOYSA-N 1 2 321.352 4.026 20 0 DIADLO CC(C)c1ccc(-c2noc(Cc3c[nH+]c4ccccn34)n2)cc1 ZINC001249108768 1060161120 /nfs/dbraw/zinc/16/11/20/1060161120.db2.gz IQYBSLDPRPWOFI-UHFFFAOYSA-N 1 2 318.380 4.099 20 0 DIADLO Cc1cccn2c(CNc3ccc4cnn(C(C)C)c4c3)c[nH+]c12 ZINC001560376690 1060162999 /nfs/dbraw/zinc/16/29/99/1060162999.db2.gz BEGLJPSMLBZTFP-UHFFFAOYSA-N 1 2 319.412 4.185 20 0 DIADLO c1cc2cc(-c3noc([C@@H]4[NH2+]Cc5ccccc54)n3)ccc2s1 ZINC001249131415 1060169994 /nfs/dbraw/zinc/16/99/94/1060169994.db2.gz BMATUSLOYWYZTQ-MRXNPFEDSA-N 1 2 319.389 4.144 20 0 DIADLO COc1ccc(C)cc1CNc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001560392260 1060178533 /nfs/dbraw/zinc/17/85/33/1060178533.db2.gz WORIENZRAITZJL-UHFFFAOYSA-N 1 2 307.397 4.110 20 0 DIADLO Cc1cc(F)cc(-c2noc([C@H]3CC[N@@H+]3Cc3ccccc3)n2)c1 ZINC001249256846 1060202553 /nfs/dbraw/zinc/20/25/53/1060202553.db2.gz XWKQGESALGYTBU-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cc(F)cc(-c2noc([C@H]3CC[N@H+]3Cc3ccccc3)n2)c1 ZINC001249256846 1060202573 /nfs/dbraw/zinc/20/25/73/1060202573.db2.gz XWKQGESALGYTBU-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc(-c2noc([C@H]3CC[N@@H+]3Cc3ccccc3)n2)cc1F ZINC001249255970 1060202849 /nfs/dbraw/zinc/20/28/49/1060202849.db2.gz MRFKDAAGEKXFLV-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc(-c2noc([C@H]3CC[N@H+]3Cc3ccccc3)n2)cc1F ZINC001249255970 1060202869 /nfs/dbraw/zinc/20/28/69/1060202869.db2.gz MRFKDAAGEKXFLV-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc(F)c(-c2noc([C@H]3CC[N@@H+]3Cc3ccccc3)n2)c1 ZINC001249253259 1060204936 /nfs/dbraw/zinc/20/49/36/1060204936.db2.gz ROMVXEXYEIFGEP-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc(F)c(-c2noc([C@H]3CC[N@H+]3Cc3ccccc3)n2)c1 ZINC001249253259 1060204965 /nfs/dbraw/zinc/20/49/65/1060204965.db2.gz ROMVXEXYEIFGEP-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2cccc(F)c2)c2ccccn2)cs1 ZINC001560423498 1060210828 /nfs/dbraw/zinc/21/08/28/1060210828.db2.gz LTWVLDGKDIFWOU-SFHVURJKSA-N 1 2 312.413 4.470 20 0 DIADLO [NH3+][C@@H](c1nc(-c2ccccc2F)no1)c1ccc2ccccc2c1 ZINC001249325638 1060218782 /nfs/dbraw/zinc/21/87/82/1060218782.db2.gz SKKFYNNSBLCVPX-QGZVFWFLSA-N 1 2 319.339 4.077 20 0 DIADLO [NH3+][C@@H](c1nc(-c2ccccc2)no1)c1ccc(Cl)c(Cl)c1 ZINC001249331216 1060219968 /nfs/dbraw/zinc/21/99/68/1060219968.db2.gz RDQCDAQNZNNGGH-CYBMUJFWSA-N 1 2 320.179 4.092 20 0 DIADLO F[C@@H]1CCCC[N@H+](Cc2coc(-c3ccc(Cl)cc3)n2)C1 ZINC001249372416 1060228940 /nfs/dbraw/zinc/22/89/40/1060228940.db2.gz NUEACPRANJVKID-CQSZACIVSA-N 1 2 308.784 4.319 20 0 DIADLO F[C@@H]1CCCC[N@@H+](Cc2coc(-c3ccc(Cl)cc3)n2)C1 ZINC001249372416 1060228957 /nfs/dbraw/zinc/22/89/57/1060228957.db2.gz NUEACPRANJVKID-CQSZACIVSA-N 1 2 308.784 4.319 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1coc(-c3ccccc3)n1)CCO2 ZINC001560441188 1060232180 /nfs/dbraw/zinc/23/21/80/1060232180.db2.gz SVJAXKWAYKHPDG-QGZVFWFLSA-N 1 2 324.355 4.094 20 0 DIADLO CN(C)c1ccc(-c2ccc(C[N@H+](C)Cc3ccon3)cc2)cc1 ZINC001249442339 1060250711 /nfs/dbraw/zinc/25/07/11/1060250711.db2.gz JOMDKEGUXMXEQG-UHFFFAOYSA-N 1 2 321.424 4.040 20 0 DIADLO CN(C)c1ccc(-c2ccc(C[N@@H+](C)Cc3ccon3)cc2)cc1 ZINC001249442339 1060250728 /nfs/dbraw/zinc/25/07/28/1060250728.db2.gz JOMDKEGUXMXEQG-UHFFFAOYSA-N 1 2 321.424 4.040 20 0 DIADLO Cc1ccc(C[NH+]2CC3(C2)CCCC3)c(F)c1Br ZINC001249459970 1060257947 /nfs/dbraw/zinc/25/79/47/1060257947.db2.gz PEZORDDWHIDKFZ-UHFFFAOYSA-N 1 2 312.226 4.273 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+]2CCC[C@@H]2c2ccccn2)cn1 ZINC001249514282 1060269593 /nfs/dbraw/zinc/26/95/93/1060269593.db2.gz FOPZMLGTGHTKDG-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]2c2ccccn2)cn1 ZINC001249514282 1060269620 /nfs/dbraw/zinc/26/96/20/1060269620.db2.gz FOPZMLGTGHTKDG-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)cn1 ZINC001249514408 1060271260 /nfs/dbraw/zinc/27/12/60/1060271260.db2.gz KAAOHOQWXCKIBC-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]2c2ccncc2)cn1 ZINC001249514408 1060271278 /nfs/dbraw/zinc/27/12/78/1060271278.db2.gz KAAOHOQWXCKIBC-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO COc1ccc(C[NH2+][C@@H](CCc2ccccc2)C(F)F)c(C)c1 ZINC001560534357 1060338171 /nfs/dbraw/zinc/33/81/71/1060338171.db2.gz XYAZTFHPYOZBOZ-SFHVURJKSA-N 1 2 319.395 4.360 20 0 DIADLO CC[C@@H]1C[C@@H](CNc2ccc(Nc3ccccc3)c[nH+]2)CCO1 ZINC001560538783 1060342646 /nfs/dbraw/zinc/34/26/46/1060342646.db2.gz DSNVVPLWIQUFQR-MAUKXSAKSA-N 1 2 311.429 4.442 20 0 DIADLO Cc1cn2cccc(Nc3cccc(Br)c3F)c2[nH+]1 ZINC001249686273 1060345685 /nfs/dbraw/zinc/34/56/85/1060345685.db2.gz NHOWFGASNBRZIY-UHFFFAOYSA-N 1 2 320.165 4.288 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1coc2ccc(C(C)C)cc12 ZINC001534713664 1060346177 /nfs/dbraw/zinc/34/61/77/1060346177.db2.gz YPZLUKIPZNVXNH-UHFFFAOYSA-N 1 2 308.381 4.242 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C)c2cccc(C3CC3)c2)c(C)[nH+]1 ZINC001526832947 1060354343 /nfs/dbraw/zinc/35/43/43/1060354343.db2.gz WGVXXYSWKONSQI-AWEZNQCLSA-N 1 2 308.425 4.375 20 0 DIADLO Cc1cccn2cc(CC(=O)Nc3ccc(CC(C)C)cc3)[nH+]c12 ZINC001534808822 1060373873 /nfs/dbraw/zinc/37/38/73/1060373873.db2.gz MIOPGHILVDJDBL-UHFFFAOYSA-N 1 2 321.424 4.022 20 0 DIADLO COc1ccc(-c2ccncc2)cc1CNc1c[nH+]c(C)c(C)c1 ZINC001560570950 1060381464 /nfs/dbraw/zinc/38/14/64/1060381464.db2.gz AOFMNKQTIWVVBD-UHFFFAOYSA-N 1 2 319.408 4.381 20 0 DIADLO Nc1ncc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)cc1F ZINC001249754501 1060385580 /nfs/dbraw/zinc/38/55/80/1060385580.db2.gz ICKBSOCVOLMOOC-UHFFFAOYSA-N 1 2 322.265 4.114 20 0 DIADLO Cc1cn2c(cccc2Nc2c(F)cc(OC(C)C)cc2F)[nH+]1 ZINC001249772530 1060388699 /nfs/dbraw/zinc/38/86/99/1060388699.db2.gz MMOOKEHHLMAJSG-UHFFFAOYSA-N 1 2 317.339 4.452 20 0 DIADLO CC(C)Oc1cc(F)c(Nc2cccn3cc[nH+]c23)c(F)c1 ZINC001249773423 1060389582 /nfs/dbraw/zinc/38/95/82/1060389582.db2.gz JWWUJAUYQVAYIM-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO Cc1cccn2c(CNc3cnc4c(ccc(F)c4F)c3)c[nH+]c12 ZINC001560578866 1060393107 /nfs/dbraw/zinc/39/31/07/1060393107.db2.gz MGBNTTFLYAKMKW-UHFFFAOYSA-N 1 2 324.334 4.081 20 0 DIADLO Cc1nccc2c(NCc3cc(-n4cc[nH+]c4)cs3)cccc12 ZINC001560588907 1060400694 /nfs/dbraw/zinc/40/06/94/1060400694.db2.gz SUIARRLSBDXHTA-UHFFFAOYSA-N 1 2 320.421 4.403 20 0 DIADLO Cc1cc(Nc2cc(Cl)c(Cl)c(Cl)c2O)c[nH+]c1N ZINC001249794349 1060404112 /nfs/dbraw/zinc/40/41/12/1060404112.db2.gz PWDCBVRIZFMTRI-UHFFFAOYSA-N 1 2 318.591 4.382 20 0 DIADLO COc1cc(C[N@H+](C)Cc2ccsc2)c(F)c(F)c1Cl ZINC001249801908 1060406769 /nfs/dbraw/zinc/40/67/69/1060406769.db2.gz QABHYQXQSRYEQK-UHFFFAOYSA-N 1 2 317.788 4.320 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2ccsc2)c(F)c(F)c1Cl ZINC001249801908 1060406781 /nfs/dbraw/zinc/40/67/81/1060406781.db2.gz QABHYQXQSRYEQK-UHFFFAOYSA-N 1 2 317.788 4.320 20 0 DIADLO CCCCOc1ccccc1C[NH2+]Cc1c(F)cccc1OC ZINC001560603407 1060416620 /nfs/dbraw/zinc/41/66/20/1060416620.db2.gz IYFGHBKWDKYVNJ-UHFFFAOYSA-N 1 2 317.404 4.303 20 0 DIADLO CCCn1c[nH+]cc1CNc1cccc(COC(C)(C)C)c1 ZINC001560606286 1060419201 /nfs/dbraw/zinc/41/92/01/1060419201.db2.gz NSRHFASJQXXKHF-UHFFFAOYSA-N 1 2 301.434 4.220 20 0 DIADLO CCCC[C@@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001527046360 1060422333 /nfs/dbraw/zinc/42/23/33/1060422333.db2.gz FIVQPKHCAVIKFG-GFCCVEGCSA-N 1 2 305.809 4.291 20 0 DIADLO Fc1ccc2[nH]c(Nc3cc(OC(F)(F)F)cc[nH+]3)cc2c1 ZINC001249852957 1060422883 /nfs/dbraw/zinc/42/28/83/1060422883.db2.gz ZPSMWIUBOCDBTQ-UHFFFAOYSA-N 1 2 311.238 4.344 20 0 DIADLO Fc1ccc2cc(Nc3cccc(Cn4cc[nH+]c4)c3)[nH]c2c1 ZINC001249879000 1060439336 /nfs/dbraw/zinc/43/93/36/1060439336.db2.gz UIJQVXVGVNIMKQ-UHFFFAOYSA-N 1 2 306.344 4.295 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@@H]2CCC[C@H]2c2ccccc2)c(C)[nH+]1 ZINC001527119016 1060439796 /nfs/dbraw/zinc/43/97/96/1060439796.db2.gz UXRKPBPZQWPBQR-OALUTQOASA-N 1 2 322.452 4.321 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc4c(c3)C(=O)CCCC4)ccc21 ZINC001249893075 1060455939 /nfs/dbraw/zinc/45/59/39/1060455939.db2.gz JGNDMFPTSDSQBY-UHFFFAOYSA-N 1 2 305.381 4.226 20 0 DIADLO CC/C(=C/C(=O)Nc1ccn2cc[nH+]c2c1)c1ccc(C)cc1 ZINC001535108512 1060463010 /nfs/dbraw/zinc/46/30/10/1060463010.db2.gz WFJQWILUZDYPCD-QINSGFPZSA-N 1 2 305.381 4.075 20 0 DIADLO Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001535108036 1060463186 /nfs/dbraw/zinc/46/31/86/1060463186.db2.gz JARHDJZMBZKWIN-GJZGRUSLSA-N 1 2 319.408 4.262 20 0 DIADLO Cc1cccc2c1[C@@H](C)C[C@@H]2CC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001535108038 1060463282 /nfs/dbraw/zinc/46/32/82/1060463282.db2.gz JARHDJZMBZKWIN-LSDHHAIUSA-N 1 2 319.408 4.262 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)c1ccc(C2=CCCC2)cc1 ZINC001535115499 1060463912 /nfs/dbraw/zinc/46/39/12/1060463912.db2.gz JYEILCOYHRKFMZ-UHFFFAOYSA-N 1 2 303.365 4.154 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)cnc1Cl ZINC001249926661 1060486728 /nfs/dbraw/zinc/48/67/28/1060486728.db2.gz QQCJBNQUUFYTAJ-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)cnc1Cl ZINC001249926661 1060486738 /nfs/dbraw/zinc/48/67/38/1060486738.db2.gz QQCJBNQUUFYTAJ-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CC=C(c3ccccc3)CC2)cnc1Cl ZINC001249931005 1060488232 /nfs/dbraw/zinc/48/82/32/1060488232.db2.gz DEOYVGKPVKIDKZ-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1cc(C[N@@H+]2CC=C(c3ccccc3)CC2)cnc1Cl ZINC001249931005 1060488245 /nfs/dbraw/zinc/48/82/45/1060488245.db2.gz DEOYVGKPVKIDKZ-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC001249933022 1060490121 /nfs/dbraw/zinc/49/01/21/1060490121.db2.gz FCTRIOLHMVJCMF-HNNXBMFYSA-N 1 2 318.219 4.135 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@]2(CCOC2)C1 ZINC001249933022 1060490127 /nfs/dbraw/zinc/49/01/27/1060490127.db2.gz FCTRIOLHMVJCMF-HNNXBMFYSA-N 1 2 318.219 4.135 20 0 DIADLO COC1(C)CC[NH+](Cc2cc(Cl)cc(Cl)c2F)CC1 ZINC001249935695 1060491742 /nfs/dbraw/zinc/49/17/42/1060491742.db2.gz QVJZUPSGPLFQFG-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO CC[C@@H](Cc1ccccc1C)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001527357738 1060499141 /nfs/dbraw/zinc/49/91/41/1060499141.db2.gz YJCXRTKIYTXONH-INIZCTEOSA-N 1 2 321.424 4.159 20 0 DIADLO COC(=O)c1ccc(Nc2ccc3c(C)cc[nH+]c3c2)c(OC)c1 ZINC001249956273 1060499306 /nfs/dbraw/zinc/49/93/06/1060499306.db2.gz ZYDZQYKRGFUYDJ-UHFFFAOYSA-N 1 2 322.364 4.082 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@H+](Cc1cccc(F)c1)C(C)C ZINC001560678883 1060515928 /nfs/dbraw/zinc/51/59/28/1060515928.db2.gz VBIYARMRPIJNRX-UHFFFAOYSA-N 1 2 309.816 4.175 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@@H+](Cc1cccc(F)c1)C(C)C ZINC001560678883 1060515943 /nfs/dbraw/zinc/51/59/43/1060515943.db2.gz VBIYARMRPIJNRX-UHFFFAOYSA-N 1 2 309.816 4.175 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1cc2c(cc[nH]c2=O)o1 ZINC001560681117 1060520807 /nfs/dbraw/zinc/52/08/07/1060520807.db2.gz FPGPRBKUJDWOHE-SNVBAGLBSA-N 1 2 318.323 4.005 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cc2c(cc[nH]c2=O)o1 ZINC001560681117 1060520820 /nfs/dbraw/zinc/52/08/20/1060520820.db2.gz FPGPRBKUJDWOHE-SNVBAGLBSA-N 1 2 318.323 4.005 20 0 DIADLO CCn1ccc(C[N@H+](Cc2ccc(Cl)c(Cl)c2)C2CC2)n1 ZINC001560681410 1060521233 /nfs/dbraw/zinc/52/12/33/1060521233.db2.gz ZRGXFGRRGDTHEC-UHFFFAOYSA-N 1 2 324.255 4.374 20 0 DIADLO CCn1ccc(C[N@@H+](Cc2ccc(Cl)c(Cl)c2)C2CC2)n1 ZINC001560681410 1060521256 /nfs/dbraw/zinc/52/12/56/1060521256.db2.gz ZRGXFGRRGDTHEC-UHFFFAOYSA-N 1 2 324.255 4.374 20 0 DIADLO Oc1cc(F)c(Nc2ccc[nH+]c2N2CCCCC2)cc1Cl ZINC001250020245 1060543549 /nfs/dbraw/zinc/54/35/49/1060543549.db2.gz GVBGGKLPLVITEC-UHFFFAOYSA-N 1 2 321.783 4.314 20 0 DIADLO Cc1c[nH+]c(Nc2cc(Cl)c(OC(C)C)cc2F)c(N)c1 ZINC001250069536 1060582513 /nfs/dbraw/zinc/58/25/13/1060582513.db2.gz OJHKBSHXLXRJOZ-UHFFFAOYSA-N 1 2 309.772 4.296 20 0 DIADLO Cc1ccccc1C[N@@H+](C)Cc1nccc(C)c1Br ZINC001560725479 1060588915 /nfs/dbraw/zinc/58/89/15/1060588915.db2.gz YBQNZFSHAZWTMF-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccccc1C[N@H+](C)Cc1nccc(C)c1Br ZINC001560725479 1060588926 /nfs/dbraw/zinc/58/89/26/1060588926.db2.gz YBQNZFSHAZWTMF-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(N2CC[NH+](Cc3cscc3Cl)CC2)cc1C ZINC001560729044 1060599651 /nfs/dbraw/zinc/59/96/51/1060599651.db2.gz SCYJJWIGPAZBHY-UHFFFAOYSA-N 1 2 320.889 4.341 20 0 DIADLO COc1c(Cl)ccc(F)c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001250102015 1060609622 /nfs/dbraw/zinc/60/96/22/1060609622.db2.gz GCKIPESNZQSEPJ-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO Fc1ccc(CCNc2c[nH+]c3c(c2)CCCC3)c(Cl)c1 ZINC001560752420 1060617788 /nfs/dbraw/zinc/61/77/88/1060617788.db2.gz FCOVSMWNXFCYQJ-UHFFFAOYSA-N 1 2 304.796 4.408 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@H+](C)C/C(C)=C/c1ccccc1 ZINC001560755293 1060619944 /nfs/dbraw/zinc/61/99/44/1060619944.db2.gz FGZFPXBRVZQCLO-JLHYYAGUSA-N 1 2 303.837 4.161 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@@H+](C)C/C(C)=C/c1ccccc1 ZINC001560755293 1060619956 /nfs/dbraw/zinc/61/99/56/1060619956.db2.gz FGZFPXBRVZQCLO-JLHYYAGUSA-N 1 2 303.837 4.161 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)C1(c2ccccc2)CCCC1)C(=O)OC(C)(C)C ZINC001560763863 1060629252 /nfs/dbraw/zinc/62/92/52/1060629252.db2.gz PMFDQVSHFSIURW-CVEARBPZSA-N 1 2 317.473 4.207 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NCCc1ccc(F)cc1Cl ZINC001560764288 1060630603 /nfs/dbraw/zinc/63/06/03/1060630603.db2.gz JFCRFZVESOMZCJ-UHFFFAOYSA-N 1 2 308.784 4.316 20 0 DIADLO Clc1cccc2c1cc1n2CC[N@@H+](C[C@H]2CC=CCC2)C1 ZINC001560794969 1060656132 /nfs/dbraw/zinc/65/61/32/1060656132.db2.gz JKVORYXEXMLAKI-AWEZNQCLSA-N 1 2 300.833 4.467 20 0 DIADLO Clc1cccc2c1cc1n2CC[N@H+](C[C@H]2CC=CCC2)C1 ZINC001560794969 1060656140 /nfs/dbraw/zinc/65/61/40/1060656140.db2.gz JKVORYXEXMLAKI-AWEZNQCLSA-N 1 2 300.833 4.467 20 0 DIADLO c1cnc2c(c1)cccc2Cc1ccc(N2CCCCC2)[nH+]c1 ZINC001250187284 1060664700 /nfs/dbraw/zinc/66/47/00/1060664700.db2.gz XQTNWUPKQFECOY-UHFFFAOYSA-N 1 2 303.409 4.211 20 0 DIADLO COc1c(F)c(Cl)ccc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001250192443 1060670678 /nfs/dbraw/zinc/67/06/78/1060670678.db2.gz XISPKFAGFSJABC-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO CN(C)c1ccc(Nc2cnc(Cl)c(Cl)c2Cl)c[nH+]1 ZINC001250195850 1060675781 /nfs/dbraw/zinc/67/57/81/1060675781.db2.gz UHKIBOFHPBZIJW-UHFFFAOYSA-N 1 2 317.607 4.246 20 0 DIADLO Cc1[nH]c2ccc(Cc3ccc(OC(F)(F)F)cc3)cc2[nH+]1 ZINC001250199116 1060677717 /nfs/dbraw/zinc/67/77/17/1060677717.db2.gz IHLKSYPLBNMBEK-UHFFFAOYSA-N 1 2 306.287 4.361 20 0 DIADLO Clc1ncc(Nc2ccn3cc[nH+]c3c2)c(Cl)c1Cl ZINC001250199513 1060679579 /nfs/dbraw/zinc/67/95/79/1060679579.db2.gz AXDAOIKWVDOYBF-UHFFFAOYSA-N 1 2 313.575 4.433 20 0 DIADLO CN(C)c1ccc(F)cc1C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC001560827788 1060687521 /nfs/dbraw/zinc/68/75/21/1060687521.db2.gz YYQZBMGLOVPUNZ-SFHVURJKSA-N 1 2 318.823 4.492 20 0 DIADLO CN(C)c1ccc(F)cc1C[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC001560827788 1060687529 /nfs/dbraw/zinc/68/75/29/1060687529.db2.gz YYQZBMGLOVPUNZ-SFHVURJKSA-N 1 2 318.823 4.492 20 0 DIADLO Fc1cccnc1C[NH2+]C1(c2cccc(C(F)(F)F)c2)CC1 ZINC001560834810 1060690718 /nfs/dbraw/zinc/69/07/18/1060690718.db2.gz VPOOIYUSLGOZAR-UHFFFAOYSA-N 1 2 310.294 4.018 20 0 DIADLO Fc1ccc(Cc2ccc(N3CCCC3)[nH+]c2)c(C(F)(F)F)c1 ZINC001250214863 1060694032 /nfs/dbraw/zinc/69/40/32/1060694032.db2.gz TYDWNNXTFRXVGU-UHFFFAOYSA-N 1 2 324.321 4.431 20 0 DIADLO C[C@@]1(C[NH2+][C@@H](CCc2ccccc2)C(F)F)CC1(Cl)Cl ZINC001560839372 1060695979 /nfs/dbraw/zinc/69/59/79/1060695979.db2.gz QMTNCYPZKFEJAX-JSGCOSHPSA-N 1 2 322.226 4.426 20 0 DIADLO CCOc1c(F)cc(Nc2ccn3cc[nH+]c3c2)cc1Cl ZINC001250222070 1060700892 /nfs/dbraw/zinc/70/08/92/1060700892.db2.gz XUBOWQPZDCFKGF-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO Cc1cc(Br)c(C[N@@H+]2CCC[C@@](C)(F)C2)s1 ZINC001560848270 1060704869 /nfs/dbraw/zinc/70/48/69/1060704869.db2.gz DBUWRUUMEWYHKB-GFCCVEGCSA-N 1 2 306.244 4.143 20 0 DIADLO Cc1cc(Br)c(C[N@H+]2CCC[C@@](C)(F)C2)s1 ZINC001560848270 1060704879 /nfs/dbraw/zinc/70/48/79/1060704879.db2.gz DBUWRUUMEWYHKB-GFCCVEGCSA-N 1 2 306.244 4.143 20 0 DIADLO Oc1ccc(F)c(Nc2cccc(-n3cc[nH+]c3)c2)c1Cl ZINC001250234232 1060714346 /nfs/dbraw/zinc/71/43/46/1060714346.db2.gz MCJHERFRMAXXRW-UHFFFAOYSA-N 1 2 303.724 4.114 20 0 DIADLO CCCCO[C@H]1C[C@@H]([NH2+]CC(F)(F)c2ccccc2)C1(C)C ZINC001560871038 1060732498 /nfs/dbraw/zinc/73/24/98/1060732498.db2.gz WXEVNSCCZPIXHL-CVEARBPZSA-N 1 2 311.416 4.352 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1c(F)ccc(CO)c1F ZINC001250254702 1060733473 /nfs/dbraw/zinc/73/34/73/1060733473.db2.gz JTQBVZIPQFRQSQ-UHFFFAOYSA-N 1 2 306.356 4.103 20 0 DIADLO FC(F)Oc1cccc(Cc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001250267196 1060744311 /nfs/dbraw/zinc/74/43/11/1060744311.db2.gz IAFJMSQCKSLBJM-UHFFFAOYSA-N 1 2 318.367 4.264 20 0 DIADLO FC(F)(F)c1ccc(Cl)c(CCn2cc[nH+]c2)c1Cl ZINC001250319100 1060777870 /nfs/dbraw/zinc/77/78/70/1060777870.db2.gz APLKZWRECZPGAE-UHFFFAOYSA-N 1 2 309.118 4.451 20 0 DIADLO Cc1cc(CCn2cc[nH+]c2)c(OCc2ccccc2)cc1C ZINC001250319366 1060778733 /nfs/dbraw/zinc/77/87/33/1060778733.db2.gz COCSTLKWWOPDRX-UHFFFAOYSA-N 1 2 306.409 4.322 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@@H+](Cc1ccc(O)c(F)c1F)CC2 ZINC001560922296 1060785650 /nfs/dbraw/zinc/78/56/50/1060785650.db2.gz PZYLRUULMLTRSR-UHFFFAOYSA-N 1 2 317.379 4.352 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@H+](Cc1ccc(O)c(F)c1F)CC2 ZINC001560922296 1060785665 /nfs/dbraw/zinc/78/56/65/1060785665.db2.gz PZYLRUULMLTRSR-UHFFFAOYSA-N 1 2 317.379 4.352 20 0 DIADLO CCCCO[C@@H]1C[C@H](Nc2c[nH+]cc3c2CCCC3)C1(C)C ZINC001560927480 1060790408 /nfs/dbraw/zinc/79/04/08/1060790408.db2.gz RIJUFHRSVZTVIH-ZWKOTPCHSA-N 1 2 302.462 4.356 20 0 DIADLO Cc1ccc2cc(CNc3c[nH+]cc4c3CCCC4)ccc2n1 ZINC001560927566 1060790834 /nfs/dbraw/zinc/79/08/34/1060790834.db2.gz UTIRUIVYIZOSPC-UHFFFAOYSA-N 1 2 303.409 4.429 20 0 DIADLO CCCCO[C@@H]1C[C@@H](Nc2c[nH+]cc3c2CCCC3)C1(C)C ZINC001560927478 1060791321 /nfs/dbraw/zinc/79/13/21/1060791321.db2.gz RIJUFHRSVZTVIH-QZTJIDSGSA-N 1 2 302.462 4.356 20 0 DIADLO Cc1sccc1C[N@H+](CC(=O)OC(C)(C)C)CC(C)(C)C ZINC001560943287 1060808450 /nfs/dbraw/zinc/80/84/50/1060808450.db2.gz MSDKVJVQCZNSIR-UHFFFAOYSA-N 1 2 311.491 4.246 20 0 DIADLO Cc1sccc1C[N@@H+](CC(=O)OC(C)(C)C)CC(C)(C)C ZINC001560943287 1060808463 /nfs/dbraw/zinc/80/84/63/1060808463.db2.gz MSDKVJVQCZNSIR-UHFFFAOYSA-N 1 2 311.491 4.246 20 0 DIADLO CCO[C@H]1C[C@@H]([NH2+]CC(F)(F)c2ccccc2C)C12CCC2 ZINC001560948785 1060814588 /nfs/dbraw/zinc/81/45/88/1060814588.db2.gz HWLHOPNWMNQOAZ-CVEARBPZSA-N 1 2 309.400 4.024 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cncc(Br)c1Cl ZINC001250464987 1060821251 /nfs/dbraw/zinc/82/12/51/1060821251.db2.gz PBXXLCBSMHWLAK-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cncc(Br)c1Cl ZINC001250464987 1060821263 /nfs/dbraw/zinc/82/12/63/1060821263.db2.gz PBXXLCBSMHWLAK-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO Clc1ccc2cccnc2c1C[NH2+]Cc1nc2ccccc2o1 ZINC001561015136 1060873676 /nfs/dbraw/zinc/87/36/76/1060873676.db2.gz MEDJILDBZZKZFT-UHFFFAOYSA-N 1 2 323.783 4.319 20 0 DIADLO CCn1cnc2c1CC[N@H+](Cc1cccc(C3CCCC3)c1)C2 ZINC001561020286 1060877365 /nfs/dbraw/zinc/87/73/65/1060877365.db2.gz CAQQNYFQXYTEJV-UHFFFAOYSA-N 1 2 309.457 4.119 20 0 DIADLO CCn1cnc2c1CC[N@@H+](Cc1cccc(C3CCCC3)c1)C2 ZINC001561020286 1060877371 /nfs/dbraw/zinc/87/73/71/1060877371.db2.gz CAQQNYFQXYTEJV-UHFFFAOYSA-N 1 2 309.457 4.119 20 0 DIADLO CCn1c[nH+]c2c1CCN(Cc1cccc(C3CCCC3)c1)C2 ZINC001561020286 1060877382 /nfs/dbraw/zinc/87/73/82/1060877382.db2.gz CAQQNYFQXYTEJV-UHFFFAOYSA-N 1 2 309.457 4.119 20 0 DIADLO C[C@@H](CC1CCC1)[NH2+][C@@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001561025335 1060880541 /nfs/dbraw/zinc/88/05/41/1060880541.db2.gz VMQLPXOTLHJUHE-YJBOKZPZSA-N 1 2 317.473 4.108 20 0 DIADLO Clc1ccc([C@H]2C[C@@H]2c2[nH]c3cc4c(cc3[nH+]2)OCO4)cc1 ZINC001250536889 1060881551 /nfs/dbraw/zinc/88/15/51/1060881551.db2.gz DUGOCFXTXJKKOT-NEPJUHHUSA-N 1 2 312.756 4.216 20 0 DIADLO Clc1ccc([C@@H]2C[C@@H]2c2[nH]c3cc4c(cc3[nH+]2)OCC4)cc1 ZINC001250537182 1060883929 /nfs/dbraw/zinc/88/39/29/1060883929.db2.gz HPNDIQOGRCCZLD-KBPBESRZSA-N 1 2 310.784 4.422 20 0 DIADLO CCOc1cc2[nH]c(Cc3ccc(F)cc3)[nH+]c2cc1OCC ZINC001250554322 1060893909 /nfs/dbraw/zinc/89/39/09/1060893909.db2.gz NNBMYFQZTNXSDW-UHFFFAOYSA-N 1 2 314.360 4.090 20 0 DIADLO COc1cc2[nH+]c(C[C@@H](C)CCCC(C)(C)O)[nH]c2cc1Cl ZINC001250556713 1060895409 /nfs/dbraw/zinc/89/54/09/1060895409.db2.gz QEOPOOFWAMEDCX-NSHDSACASA-N 1 2 324.852 4.345 20 0 DIADLO CCOc1ccc2[nH+]c(C[C@@H](C)CCCC(C)(C)O)n(C)c2c1 ZINC001250556317 1060895678 /nfs/dbraw/zinc/89/56/78/1060895678.db2.gz LLBVFDIWDYQDCA-AWEZNQCLSA-N 1 2 318.461 4.092 20 0 DIADLO CCOc1ccc2[nH+]c(C[C@H](C)CCCC(C)(C)O)n(C)c2c1 ZINC001250556318 1060896682 /nfs/dbraw/zinc/89/66/82/1060896682.db2.gz LLBVFDIWDYQDCA-CQSZACIVSA-N 1 2 318.461 4.092 20 0 DIADLO Cc1c2[nH+]c([C@@H](C)Cc3ccc4c(c3)OCO4)[nH]c2ccc1F ZINC001250567913 1060903036 /nfs/dbraw/zinc/90/30/36/1060903036.db2.gz OKDUBJKXTDHGSW-JTQLQIEISA-N 1 2 312.344 4.085 20 0 DIADLO CS[C@@H](C)Cc1[nH]c2ccc(OCc3ccccc3)cc2[nH+]1 ZINC001250566628 1060904393 /nfs/dbraw/zinc/90/43/93/1060904393.db2.gz KYRWZSVMVPJETC-ZDUSSCGKSA-N 1 2 312.438 4.436 20 0 DIADLO FC(F)[C@H]([NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1)c1ccccc1 ZINC001561059098 1060906865 /nfs/dbraw/zinc/90/68/65/1060906865.db2.gz OOKNXZWITMLLIJ-SCLBCKFNSA-N 1 2 312.363 4.231 20 0 DIADLO COc1cc2[nH+]c(C[C@@H](C)c3ccc(C)o3)[nH]c2cc1Cl ZINC001250569602 1060907790 /nfs/dbraw/zinc/90/77/90/1060907790.db2.gz VSOAFKAUEWOJCJ-SECBINFHSA-N 1 2 304.777 4.473 20 0 DIADLO COc1cc2[nH+]c(C[C@H](C)c3ccc(C)o3)[nH]c2cc1Cl ZINC001250569603 1060907866 /nfs/dbraw/zinc/90/78/66/1060907866.db2.gz VSOAFKAUEWOJCJ-VIFPVBQESA-N 1 2 304.777 4.473 20 0 DIADLO Fc1cccc2[nH]c([C@@H]3CCCC[N@@H+]3Cc3ccccc3)nc21 ZINC001250573152 1060909612 /nfs/dbraw/zinc/90/96/12/1060909612.db2.gz ZYJTUNQQQRERIJ-KRWDZBQOSA-N 1 2 309.388 4.429 20 0 DIADLO Fc1cccc2[nH]c([C@@H]3CCCC[N@H+]3Cc3ccccc3)nc21 ZINC001250573152 1060909625 /nfs/dbraw/zinc/90/96/25/1060909625.db2.gz ZYJTUNQQQRERIJ-KRWDZBQOSA-N 1 2 309.388 4.429 20 0 DIADLO CCn1c(CCc2ccccc2OC)[nH+]c2ccc(F)c(F)c21 ZINC001250583641 1060918227 /nfs/dbraw/zinc/91/82/27/1060918227.db2.gz OBUUWKKGNSDYSW-UHFFFAOYSA-N 1 2 316.351 4.128 20 0 DIADLO CCCCn1c(CCc2ccncc2)[nH+]c2ccc(F)c(F)c21 ZINC001250600191 1060932313 /nfs/dbraw/zinc/93/23/13/1060932313.db2.gz IRMJUBLBSRSRLB-UHFFFAOYSA-N 1 2 315.367 4.295 20 0 DIADLO Cc1ccc2[nH+]c(CCCCNC(=O)OC(C)(C)C)[nH]c2c1C ZINC001250612623 1060941720 /nfs/dbraw/zinc/94/17/20/1060941720.db2.gz RBVLUDIWLPEMPN-UHFFFAOYSA-N 1 2 317.433 4.027 20 0 DIADLO CCC(CC)CCCN(C)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001562323579 1061029321 /nfs/dbraw/zinc/02/93/21/1061029321.db2.gz MKEBPNBJBNNBDO-UHFFFAOYSA-N 1 2 316.449 4.323 20 0 DIADLO Cc1cn2cc(NC(=O)N[C@@H](C)C3CCCCCC3)ccc2[nH+]1 ZINC001562322640 1061029731 /nfs/dbraw/zinc/02/97/31/1061029731.db2.gz DMSVJNCKQXOZQA-AWEZNQCLSA-N 1 2 314.433 4.123 20 0 DIADLO Cc1ccc(C[NH2+][C@H](c2ccccc2)c2ccccn2)nc1Cl ZINC001473256718 1061034685 /nfs/dbraw/zinc/03/46/85/1061034685.db2.gz RKSAVXWRNUMROS-GOSISDBHSA-N 1 2 323.827 4.318 20 0 DIADLO Fc1cccc(C[N@H+](Cc2c(F)cncc2F)C2CCCC2)c1 ZINC001473261054 1061037379 /nfs/dbraw/zinc/03/73/79/1061037379.db2.gz BXWXGTNQRJFMRT-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2c(F)cncc2F)C2CCCC2)c1 ZINC001473261054 1061037387 /nfs/dbraw/zinc/03/73/87/1061037387.db2.gz BXWXGTNQRJFMRT-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO Fc1cc2[nH]c(-c3ccc4occc4c3)nc2cc1-n1cc[nH+]c1 ZINC001250726498 1061045422 /nfs/dbraw/zinc/04/54/22/1061045422.db2.gz UEOBBMQOVMFSBZ-UHFFFAOYSA-N 1 2 318.311 4.301 20 0 DIADLO Cn1ccc2c1cccc2-c1[nH]c2ccc(N3CCCC3)cc2[nH+]1 ZINC001250756775 1061056879 /nfs/dbraw/zinc/05/68/79/1061056879.db2.gz SUEFBJICIKLLIB-UHFFFAOYSA-N 1 2 316.408 4.322 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccco2)Cc2cccnc2)cc1C ZINC001473307890 1061072535 /nfs/dbraw/zinc/07/25/35/1061072535.db2.gz UTXKEQKJSKNDAQ-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccco2)Cc2cccnc2)cc1C ZINC001473307890 1061072540 /nfs/dbraw/zinc/07/25/40/1061072540.db2.gz UTXKEQKJSKNDAQ-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO FCc1ccccc1C[N@H+](Cc1ccco1)Cc1cccnc1 ZINC001473308187 1061072751 /nfs/dbraw/zinc/07/27/51/1061072751.db2.gz YJLWXZQCPJDXPP-UHFFFAOYSA-N 1 2 310.372 4.347 20 0 DIADLO FCc1ccccc1C[N@@H+](Cc1ccco1)Cc1cccnc1 ZINC001473308187 1061072761 /nfs/dbraw/zinc/07/27/61/1061072761.db2.gz YJLWXZQCPJDXPP-UHFFFAOYSA-N 1 2 310.372 4.347 20 0 DIADLO Cc1noc2ncc(C[N@@H+]3CC(C)(C)[C@@H]3c3cccs3)cc12 ZINC001462302821 1061091854 /nfs/dbraw/zinc/09/18/54/1061091854.db2.gz ABBHVUNLMMZCRA-HNNXBMFYSA-N 1 2 313.426 4.176 20 0 DIADLO Cc1noc2ncc(C[N@H+]3CC(C)(C)[C@@H]3c3cccs3)cc12 ZINC001462302821 1061091872 /nfs/dbraw/zinc/09/18/72/1061091872.db2.gz ABBHVUNLMMZCRA-HNNXBMFYSA-N 1 2 313.426 4.176 20 0 DIADLO CCOc1ccc2[nH]cc(-c3[nH]c4ccc(N(C)C)cc4[nH+]3)c2c1 ZINC001250858666 1061096325 /nfs/dbraw/zinc/09/63/25/1061096325.db2.gz FBBBNTVWXCBGMY-UHFFFAOYSA-N 1 2 320.396 4.176 20 0 DIADLO CC(C)(C)c1cnc(C[NH+]2CC(Cc3ccc(F)cc3)C2)s1 ZINC001462319027 1061102595 /nfs/dbraw/zinc/10/25/95/1061102595.db2.gz FBCLBSSUOCQEID-UHFFFAOYSA-N 1 2 318.461 4.254 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1nccc(Cl)c1Cl ZINC001473348810 1061106627 /nfs/dbraw/zinc/10/66/27/1061106627.db2.gz DIGKLFTUANHGSF-CQSZACIVSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1nccc(Cl)c1Cl ZINC001473348810 1061106638 /nfs/dbraw/zinc/10/66/38/1061106638.db2.gz DIGKLFTUANHGSF-CQSZACIVSA-N 1 2 310.228 4.367 20 0 DIADLO CCC1(C)C[NH+](Cc2ccc(Cl)c(Br)c2)C1 ZINC001462328887 1061106580 /nfs/dbraw/zinc/10/65/80/1061106580.db2.gz XOOMXYVUHMRAED-UHFFFAOYSA-N 1 2 302.643 4.334 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@H+](C/C=C\c1cccc(F)c1)C1CC1 ZINC001462339262 1061115598 /nfs/dbraw/zinc/11/55/98/1061115598.db2.gz XQEBEHRQHHEXNY-IQCBXXCUSA-N 1 2 319.420 4.034 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+](C/C=C\c1cccc(F)c1)C1CC1 ZINC001462339262 1061115606 /nfs/dbraw/zinc/11/56/06/1061115606.db2.gz XQEBEHRQHHEXNY-IQCBXXCUSA-N 1 2 319.420 4.034 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+]Cc2c(C)cccc2Cl)o1 ZINC001473367221 1061116404 /nfs/dbraw/zinc/11/64/04/1061116404.db2.gz PFUPHHKRQWNZON-MRXNPFEDSA-N 1 2 307.821 4.281 20 0 DIADLO Cc1cc2nc(-c3c[nH]c4cc[nH+]cc43)[nH]c2cc1C(F)(F)F ZINC001250908569 1061122432 /nfs/dbraw/zinc/12/24/32/1061122432.db2.gz VYQHJJFGYKGHAX-UHFFFAOYSA-N 1 2 316.286 4.433 20 0 DIADLO CC[C@@]1(C)C[N@H+](CCc2cc(Cl)cc(Cl)c2)CCO1 ZINC001473389876 1061129187 /nfs/dbraw/zinc/12/91/87/1061129187.db2.gz UYKHIJJRIIAISW-HNNXBMFYSA-N 1 2 302.245 4.037 20 0 DIADLO CC[C@@]1(C)C[N@@H+](CCc2cc(Cl)cc(Cl)c2)CCO1 ZINC001473389876 1061129192 /nfs/dbraw/zinc/12/91/92/1061129192.db2.gz UYKHIJJRIIAISW-HNNXBMFYSA-N 1 2 302.245 4.037 20 0 DIADLO CC(C)(C)n1c2ccc(F)cc2nc1-c1ccn2cc[nH+]c2c1 ZINC001250927555 1061129763 /nfs/dbraw/zinc/12/97/63/1061129763.db2.gz BWKMCJFHUUSBOD-UHFFFAOYSA-N 1 2 308.360 4.245 20 0 DIADLO CCCn1c2cc(F)ccc2nc1-c1cccc(-n2cc[nH+]c2)c1 ZINC001250940126 1061136450 /nfs/dbraw/zinc/13/64/50/1061136450.db2.gz FEGKVSFELHDXKC-UHFFFAOYSA-N 1 2 320.371 4.438 20 0 DIADLO CC1(C)c2ccccc2CC[N@H+]1Cc1ccc(F)c(F)c1F ZINC001462377832 1061138213 /nfs/dbraw/zinc/13/82/13/1061138213.db2.gz ZAQOMQGQRDULHD-UHFFFAOYSA-N 1 2 305.343 4.397 20 0 DIADLO CC1(C)c2ccccc2CC[N@@H+]1Cc1ccc(F)c(F)c1F ZINC001462377832 1061138220 /nfs/dbraw/zinc/13/82/20/1061138220.db2.gz ZAQOMQGQRDULHD-UHFFFAOYSA-N 1 2 305.343 4.397 20 0 DIADLO Fc1cc2nc(-c3cccc(-n4cc[nH+]c4)c3)[nH]c2cc1Cl ZINC001250940812 1061138884 /nfs/dbraw/zinc/13/88/84/1061138884.db2.gz ZBYPTTRMNSIENT-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO Cc1[nH]nc(C[N@@H+]2CCC[C@@]2(C)Cc2cccc(Cl)c2)c1C ZINC001462397851 1061150421 /nfs/dbraw/zinc/15/04/21/1061150421.db2.gz CFIDXIULCDRVEM-SFHVURJKSA-N 1 2 317.864 4.277 20 0 DIADLO Cc1[nH]nc(C[N@H+]2CCC[C@@]2(C)Cc2cccc(Cl)c2)c1C ZINC001462397851 1061150429 /nfs/dbraw/zinc/15/04/29/1061150429.db2.gz CFIDXIULCDRVEM-SFHVURJKSA-N 1 2 317.864 4.277 20 0 DIADLO Clc1ccc2[nH]c(-c3ccc4[nH+]ccn4c3)nc2c1Cl ZINC001250978326 1061157658 /nfs/dbraw/zinc/15/76/58/1061157658.db2.gz HRGLVBYWQOVYFO-UHFFFAOYSA-N 1 2 303.152 4.184 20 0 DIADLO Clc1ccc2c(c1)nc(-c1ccc3[nH+]ccn3c1)n2CC1CC1 ZINC001250978238 1061158063 /nfs/dbraw/zinc/15/80/63/1061158063.db2.gz DQLHGACVPXAMQZ-UHFFFAOYSA-N 1 2 322.799 4.414 20 0 DIADLO CCCCn1c2ccc(Cl)cc2nc1-c1ccc(C)[nH+]c1N ZINC001250982057 1061160862 /nfs/dbraw/zinc/16/08/62/1061160862.db2.gz OYETXYQUAWVHHH-UHFFFAOYSA-N 1 2 314.820 4.442 20 0 DIADLO C[C@H](CNc1c[nH+]cc2c1CCCC2)c1cc(F)cc(F)c1 ZINC001462422267 1061164134 /nfs/dbraw/zinc/16/41/34/1061164134.db2.gz UGNMMJPCHBEHNN-GFCCVEGCSA-N 1 2 302.368 4.454 20 0 DIADLO CC(C)[C@]1(CO)CCC[N@H+](Cc2cc(Cl)sc2Cl)C1 ZINC001473500032 1061192884 /nfs/dbraw/zinc/19/28/84/1061192884.db2.gz WHPSPKMMHNEEEK-CQSZACIVSA-N 1 2 322.301 4.285 20 0 DIADLO CC(C)[C@]1(CO)CCC[N@@H+](Cc2cc(Cl)sc2Cl)C1 ZINC001473500032 1061192890 /nfs/dbraw/zinc/19/28/90/1061192890.db2.gz WHPSPKMMHNEEEK-CQSZACIVSA-N 1 2 322.301 4.285 20 0 DIADLO FC(F)c1cc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)ccn1 ZINC001251050009 1061201474 /nfs/dbraw/zinc/20/14/74/1061201474.db2.gz YZDJMVMUPMRQSQ-UHFFFAOYSA-N 1 2 314.339 4.163 20 0 DIADLO COc1cc2c(cc1Cl)C[N@H+](Cc1csc(C)c1)CC2 ZINC001473512481 1061203158 /nfs/dbraw/zinc/20/31/58/1061203158.db2.gz ZDKSANCSKIPDDO-UHFFFAOYSA-N 1 2 307.846 4.277 20 0 DIADLO COc1cc2c(cc1Cl)C[N@@H+](Cc1csc(C)c1)CC2 ZINC001473512481 1061203176 /nfs/dbraw/zinc/20/31/76/1061203176.db2.gz ZDKSANCSKIPDDO-UHFFFAOYSA-N 1 2 307.846 4.277 20 0 DIADLO CC(C)(C)OC(=O)C[N@@H+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001473512861 1061204178 /nfs/dbraw/zinc/20/41/78/1061204178.db2.gz FKRYEMIYSKHJHR-UHFFFAOYSA-N 1 2 323.436 4.053 20 0 DIADLO CC(C)(C)OC(=O)C[N@H+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001473512861 1061204197 /nfs/dbraw/zinc/20/41/97/1061204197.db2.gz FKRYEMIYSKHJHR-UHFFFAOYSA-N 1 2 323.436 4.053 20 0 DIADLO Cc1cc(Br)c(C[N@H+]2C[C@H](C)[C@H]2C)cc1Cl ZINC001473511560 1061205278 /nfs/dbraw/zinc/20/52/78/1061205278.db2.gz YCWGEZKWPAHPRV-VHSXEESVSA-N 1 2 302.643 4.251 20 0 DIADLO Cc1cc(Br)c(C[N@@H+]2C[C@H](C)[C@H]2C)cc1Cl ZINC001473511560 1061205296 /nfs/dbraw/zinc/20/52/96/1061205296.db2.gz YCWGEZKWPAHPRV-VHSXEESVSA-N 1 2 302.643 4.251 20 0 DIADLO CC[C@H](CC(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1)C(C)(C)C ZINC001455770639 1061234349 /nfs/dbraw/zinc/23/43/49/1061234349.db2.gz NAGANLJKLFTFIM-CABCVRRESA-N 1 2 305.466 4.152 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1nc2cc(-c3ccccc3)ccc2[nH]1 ZINC001251092538 1061234997 /nfs/dbraw/zinc/23/49/97/1061234997.db2.gz QJOVDHHCUGPFEF-UHFFFAOYSA-N 1 2 300.365 4.183 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[C@@H](Nc1c[nH+]c(C)c(C)c1)CC3 ZINC001462534989 1061244494 /nfs/dbraw/zinc/24/44/94/1061244494.db2.gz HDEACOBKSQPJAB-HNNXBMFYSA-N 1 2 305.425 4.458 20 0 DIADLO Fc1cc(F)cc(C(F)(F)C[NH2+]C2CC3(C2)CCCC3)c1 ZINC001462541372 1061249279 /nfs/dbraw/zinc/24/92/79/1061249279.db2.gz PEQNSYZLGYKFMW-UHFFFAOYSA-N 1 2 301.327 4.369 20 0 DIADLO Clc1ccnc(C[N@@H+]2CCSC[C@@H]2C2CCC2)c1Cl ZINC001473569518 1061258405 /nfs/dbraw/zinc/25/84/05/1061258405.db2.gz YSFKGPYBOZNYMR-CYBMUJFWSA-N 1 2 317.285 4.106 20 0 DIADLO Clc1ccnc(C[N@H+]2CCSC[C@@H]2C2CCC2)c1Cl ZINC001473569518 1061258423 /nfs/dbraw/zinc/25/84/23/1061258423.db2.gz YSFKGPYBOZNYMR-CYBMUJFWSA-N 1 2 317.285 4.106 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@@H](C)[C@@H]2C(=O)OC(C)(C)C)cc1F ZINC001473571286 1061258779 /nfs/dbraw/zinc/25/87/79/1061258779.db2.gz FEYVNZZRULIPCM-RHSMWYFYSA-N 1 2 321.436 4.076 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@@H](C)[C@@H]2C(=O)OC(C)(C)C)cc1F ZINC001473571286 1061258795 /nfs/dbraw/zinc/25/87/95/1061258795.db2.gz FEYVNZZRULIPCM-RHSMWYFYSA-N 1 2 321.436 4.076 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ccccc2Cl)[C@@H]1C(=O)OC(C)(C)C ZINC001473571522 1061259702 /nfs/dbraw/zinc/25/97/02/1061259702.db2.gz KCUPKFPZGSTGQY-CJNGLKHVSA-N 1 2 323.864 4.282 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ccccc2Cl)[C@@H]1C(=O)OC(C)(C)C ZINC001473571522 1061259722 /nfs/dbraw/zinc/25/97/22/1061259722.db2.gz KCUPKFPZGSTGQY-CJNGLKHVSA-N 1 2 323.864 4.282 20 0 DIADLO CC(C)(C)OC(=O)CC[C@H]1CCCC[N@@H+]1C/C(Cl)=C/Cl ZINC001473575222 1061262000 /nfs/dbraw/zinc/26/20/00/1061262000.db2.gz OFRFAWJBVZVOJN-KXXVWKPMSA-N 1 2 322.276 4.282 20 0 DIADLO CC(C)(C)OC(=O)CC[C@H]1CCCC[N@H+]1C/C(Cl)=C/Cl ZINC001473575222 1061262022 /nfs/dbraw/zinc/26/20/22/1061262022.db2.gz OFRFAWJBVZVOJN-KXXVWKPMSA-N 1 2 322.276 4.282 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2cccc3ccccc32)c(C)[nH+]1 ZINC001456152619 1061276929 /nfs/dbraw/zinc/27/69/29/1061276929.db2.gz ASCUNCUFPGFTBL-UHFFFAOYSA-N 1 2 304.393 4.090 20 0 DIADLO Oc1ccc2[nH]cc(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)c2c1 ZINC001251222357 1061277404 /nfs/dbraw/zinc/27/74/04/1061277404.db2.gz NGJDTJONIMOHKW-UHFFFAOYSA-N 1 2 318.380 4.017 20 0 DIADLO Nc1[nH+]cccc1CNc1c2ccccc2[nH]c1-c1ccccc1 ZINC001462604165 1061292859 /nfs/dbraw/zinc/29/28/59/1061292859.db2.gz PMJUDAPFPILOJL-UHFFFAOYSA-N 1 2 314.392 4.424 20 0 DIADLO COC(=O)[C@@H](c1ccsc1)[NH+]1CCC(C2CCCCC2)CC1 ZINC001473617127 1061293082 /nfs/dbraw/zinc/29/30/82/1061293082.db2.gz FAMOJYMOYNUGBV-QGZVFWFLSA-N 1 2 321.486 4.255 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@@H+](Cc1noc3c1CCCC3)CC2 ZINC001473624385 1061299344 /nfs/dbraw/zinc/29/93/44/1061299344.db2.gz XGKCHHPPCWZFNL-UHFFFAOYSA-N 1 2 310.441 4.235 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@H+](Cc1noc3c1CCCC3)CC2 ZINC001473624385 1061299360 /nfs/dbraw/zinc/29/93/60/1061299360.db2.gz XGKCHHPPCWZFNL-UHFFFAOYSA-N 1 2 310.441 4.235 20 0 DIADLO C[C@@H](CC(C)(C)C)[NH2+][C@@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001462621230 1061302680 /nfs/dbraw/zinc/30/26/80/1061302680.db2.gz ZNRCNEKHWRYPPG-RDJZCZTQSA-N 1 2 319.489 4.354 20 0 DIADLO CCC(C)(C)c1ccc(C(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC001456369744 1061304925 /nfs/dbraw/zinc/30/49/25/1061304925.db2.gz HKHMWIBOHOCWGW-UHFFFAOYSA-N 1 2 307.397 4.274 20 0 DIADLO c1cn2c(cccc2-c2nc3ccccc3n2Cc2ccccc2)[nH+]1 ZINC001251326418 1061316238 /nfs/dbraw/zinc/31/62/38/1061316238.db2.gz IPOOABKRTOLBOZ-UHFFFAOYSA-N 1 2 324.387 4.399 20 0 DIADLO CCOc1ccc2nc(-c3cccc4[nH+]ccn43)n(C3CC3)c2c1 ZINC001251326649 1061316335 /nfs/dbraw/zinc/31/63/35/1061316335.db2.gz RHVIFZOQKKWRKQ-UHFFFAOYSA-N 1 2 318.380 4.085 20 0 DIADLO FC(F)[C@@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccccc1 ZINC001462680266 1061333052 /nfs/dbraw/zinc/33/30/52/1061333052.db2.gz DWJZHNINRRWCEO-HOTGVXAUSA-N 1 2 309.400 4.464 20 0 DIADLO COc1cc(-c2nc3c(cccc3Cl)[nH]2)ccc1-n1cc[nH+]c1 ZINC001251363682 1061335911 /nfs/dbraw/zinc/33/59/11/1061335911.db2.gz ACGIBINVURYHLZ-UHFFFAOYSA-N 1 2 324.771 4.078 20 0 DIADLO COC[C@H](C)[N@H+](C/C(Cl)=C\Cl)[C@H]1CCc2ccccc21 ZINC001473691186 1061348952 /nfs/dbraw/zinc/34/89/52/1061348952.db2.gz DVWADQZOECBQGI-BMKJPTANSA-N 1 2 314.256 4.330 20 0 DIADLO COC[C@H](C)[N@@H+](C/C(Cl)=C\Cl)[C@H]1CCc2ccccc21 ZINC001473691186 1061348969 /nfs/dbraw/zinc/34/89/69/1061348969.db2.gz DVWADQZOECBQGI-BMKJPTANSA-N 1 2 314.256 4.330 20 0 DIADLO CO[C@@H]1CC[C@@H](C)[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001473713739 1061363407 /nfs/dbraw/zinc/36/34/07/1061363407.db2.gz XDPASIVAQGBTRP-BXKDBHETSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@@H]1CC[C@@H](C)[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001473713739 1061363423 /nfs/dbraw/zinc/36/34/23/1061363423.db2.gz XDPASIVAQGBTRP-BXKDBHETSA-N 1 2 306.208 4.132 20 0 DIADLO CCc1nc(C(C)C)ccc1C[N@@H+]1Cc2cccc(OC)c2C1 ZINC001473718170 1061368265 /nfs/dbraw/zinc/36/82/65/1061368265.db2.gz MVQRJIYEIJQZPX-UHFFFAOYSA-N 1 2 310.441 4.292 20 0 DIADLO CCc1nc(C(C)C)ccc1C[N@H+]1Cc2cccc(OC)c2C1 ZINC001473718170 1061368283 /nfs/dbraw/zinc/36/82/83/1061368283.db2.gz MVQRJIYEIJQZPX-UHFFFAOYSA-N 1 2 310.441 4.292 20 0 DIADLO Cc1cc(NCc2ccc3c(c2)OCCCO3)[nH+]c2ccccc12 ZINC001251543697 1061398926 /nfs/dbraw/zinc/39/89/26/1061398926.db2.gz YIJPMXCSXNXPAP-UHFFFAOYSA-N 1 2 320.392 4.317 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(Cl)c(F)c1)c1c(F)cccc1F ZINC001473812445 1061418035 /nfs/dbraw/zinc/41/80/35/1061418035.db2.gz KGKHFUXVGKZHRP-MRVPVSSYSA-N 1 2 300.711 4.003 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@@H](Cc3ccccc3)[C@H]2C)c(C)[nH+]1 ZINC001457434512 1061457786 /nfs/dbraw/zinc/45/77/86/1061457786.db2.gz JTMBWUCUIXXLJJ-MJGOQNOKSA-N 1 2 322.452 4.100 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3cc(F)cc(N4CCCC4)c3)[nH+]c2c1 ZINC001251763178 1061476373 /nfs/dbraw/zinc/47/63/73/1061476373.db2.gz SHPZLKOEMULKGC-UHFFFAOYSA-N 1 2 324.403 4.035 20 0 DIADLO OC1CC[NH+](c2ccc(NCc3cc4ccccc4o3)cc2)CC1 ZINC001473942695 1061487282 /nfs/dbraw/zinc/48/72/82/1061487282.db2.gz MQYZILOLDOPULW-UHFFFAOYSA-N 1 2 322.408 4.006 20 0 DIADLO Cc1cc(F)c(CNc2ccc(N3CCCCC3)c[nH+]2)c(F)c1 ZINC001473947595 1061490767 /nfs/dbraw/zinc/49/07/67/1061490767.db2.gz HWNJNUBGUSGALQ-UHFFFAOYSA-N 1 2 317.383 4.271 20 0 DIADLO Cc1cc(C)c(CNC(=O)N2CCC(CCC(C)C)CC2)c[nH+]1 ZINC001251861698 1061515441 /nfs/dbraw/zinc/51/54/41/1061515441.db2.gz HYQKTBZKNQFILC-UHFFFAOYSA-N 1 2 317.477 4.056 20 0 DIADLO Cc1cccc2nc(C[NH2+]Cc3cc(Cl)ccc3Cl)cn21 ZINC001473996904 1061540635 /nfs/dbraw/zinc/54/06/35/1061540635.db2.gz DFYLRFVWIFOXCJ-UHFFFAOYSA-N 1 2 320.223 4.239 20 0 DIADLO Cc1nc(NCCc2ccc(C(C)C)cc2)c2c([nH+]1)CCCC2 ZINC001458049198 1061546341 /nfs/dbraw/zinc/54/63/41/1061546341.db2.gz UZGUWNYGZJDNCU-UHFFFAOYSA-N 1 2 309.457 4.442 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)C1[C@H]2CCCCCC[C@H]12 ZINC001464071577 1061553541 /nfs/dbraw/zinc/55/35/41/1061553541.db2.gz DUDXEGIMBQNPPN-GJZGRUSLSA-N 1 2 309.413 4.027 20 0 DIADLO Cc1cc(N2CC=C(c3ccc(F)cc3)CC2)nc(C2CCC2)[nH+]1 ZINC001458073062 1061557961 /nfs/dbraw/zinc/55/79/61/1061557961.db2.gz QRNTUTDFRIUIDM-UHFFFAOYSA-N 1 2 323.415 4.485 20 0 DIADLO CCCCCN(CCCCC)C(=O)c1cccc2[nH+]ccn21 ZINC001464246045 1061566471 /nfs/dbraw/zinc/56/64/71/1061566471.db2.gz JQTHXTIYNIBOGD-UHFFFAOYSA-N 1 2 301.434 4.157 20 0 DIADLO Cc1cccn2c(CNc3ccc(C(F)(F)F)cc3)c[nH+]c12 ZINC001474047742 1061595708 /nfs/dbraw/zinc/59/57/08/1061595708.db2.gz ZTVTVCUEMMVVGZ-UHFFFAOYSA-N 1 2 305.303 4.274 20 0 DIADLO Cc1ccc(C[C@H]2CCCN(c3cc(C)[nH+]c(C4CC4)n3)C2)cc1 ZINC001458146763 1061598671 /nfs/dbraw/zinc/59/86/71/1061598671.db2.gz ZIPMSBJBRRFGDR-GOSISDBHSA-N 1 2 321.468 4.430 20 0 DIADLO CCOc1cccc(CNc2ccc(-n3cc[nH+]c3)c(F)c2)c1 ZINC001474058238 1061605559 /nfs/dbraw/zinc/60/55/59/1061605559.db2.gz ITOHGTZQHACCHT-UHFFFAOYSA-N 1 2 311.360 4.022 20 0 DIADLO C/C(=C\C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccs1 ZINC001464569833 1061608554 /nfs/dbraw/zinc/60/85/54/1061608554.db2.gz NVQGSYVUSVNRCG-VAWYXSNFSA-N 1 2 309.394 4.180 20 0 DIADLO Cc1cc(NCc2cc(O)cc(Cl)c2)ccc1-n1cc[nH+]c1 ZINC001474063562 1061610791 /nfs/dbraw/zinc/61/07/91/1061610791.db2.gz SHWXDIUQVQLTIX-UHFFFAOYSA-N 1 2 313.788 4.152 20 0 DIADLO Cc1cccc2c(CCNc3nc(C)[nH+]c4c3CCCC4)c[nH]c21 ZINC001458190009 1061622751 /nfs/dbraw/zinc/62/27/51/1061622751.db2.gz NOGJIAKSPPLTDW-UHFFFAOYSA-N 1 2 320.440 4.108 20 0 DIADLO Cc1cc(C)cc(CCNc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001458193297 1061623830 /nfs/dbraw/zinc/62/38/30/1061623830.db2.gz GJGBIOJNTLUIBH-UHFFFAOYSA-N 1 2 316.408 4.154 20 0 DIADLO CCN(CC)c1ccc(NCc2cc3c(cccc3C)[nH]2)c[nH+]1 ZINC001474079457 1061626795 /nfs/dbraw/zinc/62/67/95/1061626795.db2.gz RAOXSVJYRXHNMV-UHFFFAOYSA-N 1 2 308.429 4.330 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)c(N(C)C)[nH+]1 ZINC001458216887 1061639129 /nfs/dbraw/zinc/63/91/29/1061639129.db2.gz PXOINUNEZGKAIQ-OWCLPIDISA-N 1 2 315.461 4.001 20 0 DIADLO Cc1cc(NCc2ccc(Br)cc2)ccc1[NH+](C)C ZINC001474093428 1061639857 /nfs/dbraw/zinc/63/98/57/1061639857.db2.gz GVEUYMCPPBEZNP-UHFFFAOYSA-N 1 2 319.246 4.436 20 0 DIADLO Cc1nc(NCc2cccc(Cl)c2F)c2c([nH+]1)CCCC2 ZINC001458221044 1061642487 /nfs/dbraw/zinc/64/24/87/1061642487.db2.gz SNNYAKFTGBXTPO-UHFFFAOYSA-N 1 2 305.784 4.068 20 0 DIADLO CCc1cc(N2CCC(c3ccccc3C)CC2)nc(CC)[nH+]1 ZINC001458312557 1061693399 /nfs/dbraw/zinc/69/33/99/1061693399.db2.gz XHEXAORHFLLHFH-UHFFFAOYSA-N 1 2 309.457 4.294 20 0 DIADLO C[N@@H+](Cc1cn2cc(Cl)ccc2n1)Cc1cc2ccccc2[nH]1 ZINC001252732651 1061704811 /nfs/dbraw/zinc/70/48/11/1061704811.db2.gz KAQYNSIPRBOFBS-UHFFFAOYSA-N 1 2 324.815 4.101 20 0 DIADLO C[N@H+](Cc1cn2cc(Cl)ccc2n1)Cc1cc2ccccc2[nH]1 ZINC001252732651 1061704833 /nfs/dbraw/zinc/70/48/33/1061704833.db2.gz KAQYNSIPRBOFBS-UHFFFAOYSA-N 1 2 324.815 4.101 20 0 DIADLO CCc1cc(N2CCc3c(cccc3C(C)C)C2)nc(CC)[nH+]1 ZINC001458352501 1061715914 /nfs/dbraw/zinc/71/59/14/1061715914.db2.gz DVHJHAAIPDMJMP-UHFFFAOYSA-N 1 2 309.457 4.288 20 0 DIADLO Fc1ccccc1CCCNc1nc2ccccc2n2c[nH+]cc12 ZINC001458356081 1061718475 /nfs/dbraw/zinc/71/84/75/1061718475.db2.gz SJSJLTLXNUSGDI-UHFFFAOYSA-N 1 2 320.371 4.066 20 0 DIADLO Clc1ccc(-c2nnc(-c3ccc(-n4cc[nH+]c4)cc3)o2)cc1 ZINC001252788293 1061718446 /nfs/dbraw/zinc/71/84/46/1061718446.db2.gz ZMSUFKPGOOSNBS-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO OCc1cc[nH+]c(NCc2cccc(Oc3ccc(F)cc3)c2)c1 ZINC001474188021 1061735813 /nfs/dbraw/zinc/73/58/13/1061735813.db2.gz DKSMPQTVAUKSPG-UHFFFAOYSA-N 1 2 324.355 4.117 20 0 DIADLO Cc1nc(N2[C@H](C)C[C@H](c3ccccc3)[C@@H]2C)c2c([nH+]1)CCCC2 ZINC001458402380 1061742336 /nfs/dbraw/zinc/74/23/36/1061742336.db2.gz QXQLOCUJDRWIEQ-VCBZYWHSSA-N 1 2 321.468 4.435 20 0 DIADLO CO[C@@H]1C[C@H](Nc2cc(C(C)C)[nH+]c(C(C)C)n2)C12CCC2 ZINC001458428251 1061757368 /nfs/dbraw/zinc/75/73/68/1061757368.db2.gz IORPJUAEYUYNRT-LSDHHAIUSA-N 1 2 303.450 4.093 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2cc3c[nH+]ccc3[nH]2)o1 ZINC001465476481 1061761128 /nfs/dbraw/zinc/76/11/28/1061761128.db2.gz ITJDOFZMPWJGEZ-PXAZEXFGSA-N 1 2 323.396 4.078 20 0 DIADLO CCc1ccc(-c2nnc([C@@H]3CCC[N@@H+]3Cc3ccco3)o2)cc1 ZINC001252967974 1061765898 /nfs/dbraw/zinc/76/58/98/1061765898.db2.gz VNUJUYSWDYMFAC-KRWDZBQOSA-N 1 2 323.396 4.229 20 0 DIADLO CCc1ccc(-c2nnc([C@@H]3CCC[N@H+]3Cc3ccco3)o2)cc1 ZINC001252967974 1061765909 /nfs/dbraw/zinc/76/59/09/1061765909.db2.gz VNUJUYSWDYMFAC-KRWDZBQOSA-N 1 2 323.396 4.229 20 0 DIADLO CC[C@H](Nc1[nH+]cnc2c1cnn2-c1ccccc1)[C@H]1CC1(C)C ZINC001458442582 1061767837 /nfs/dbraw/zinc/76/78/37/1061767837.db2.gz CNLYQOCKUBGZRU-CVEARBPZSA-N 1 2 321.428 4.052 20 0 DIADLO Cc1ccc(F)cc1C[NH2+][C@H](CCc1ccccc1)C(F)F ZINC001474211553 1061769054 /nfs/dbraw/zinc/76/90/54/1061769054.db2.gz SNCUHVPUTYWONK-QGZVFWFLSA-N 1 2 307.359 4.490 20 0 DIADLO Cc1cc(NCCC[C@H]2CC2(Cl)Cl)nc(C2CCC2)[nH+]1 ZINC001458463178 1061776218 /nfs/dbraw/zinc/77/62/18/1061776218.db2.gz IGSQRBCTICPWMP-LBPRGKRZSA-N 1 2 314.260 4.438 20 0 DIADLO C[C@@](O)(CNc1cc(-c2cccc(F)c2)cc[nH+]1)c1ccccc1 ZINC001253090908 1061798589 /nfs/dbraw/zinc/79/85/89/1061798589.db2.gz KRTMSCLSPMGTHD-HXUWFJFHSA-N 1 2 322.383 4.207 20 0 DIADLO CC(C)(CNc1nc2ccccc2n2c[nH+]cc12)CC(F)(F)F ZINC001458499870 1061802375 /nfs/dbraw/zinc/80/23/75/1061802375.db2.gz QRIFXPREXMNMMK-UHFFFAOYSA-N 1 2 322.334 4.273 20 0 DIADLO CC[C@@H](C)Oc1cccc(NCc2ccc(-n3cc[nH+]c3)cc2)n1 ZINC001474243052 1061803582 /nfs/dbraw/zinc/80/35/82/1061803582.db2.gz WSKBWZOWCNQNDR-OAHLLOKOSA-N 1 2 322.412 4.057 20 0 DIADLO Cc1ccc2[nH+]c(NCc3nc4ccc(F)cc4s3)[nH]c2c1 ZINC001474248594 1061814770 /nfs/dbraw/zinc/81/47/70/1061814770.db2.gz NDIVRZWLSCMZJY-UHFFFAOYSA-N 1 2 312.373 4.232 20 0 DIADLO CC(C)c1cc(N[C@@H](C2CCC2)[C@H]2CCCO2)nc(C(C)C)[nH+]1 ZINC001458521789 1061818035 /nfs/dbraw/zinc/81/80/35/1061818035.db2.gz ZVXORYQLHWQDIL-AEFFLSMTSA-N 1 2 317.477 4.483 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1nc2ccccc2o1 ZINC001474251245 1061818368 /nfs/dbraw/zinc/81/83/68/1061818368.db2.gz UAMUMTZLFMKAIA-UHFFFAOYSA-N 1 2 306.369 4.371 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1cnc(F)cc1C ZINC001474252466 1061818840 /nfs/dbraw/zinc/81/88/40/1061818840.db2.gz OBOVVTYGAXZWDL-UHFFFAOYSA-N 1 2 318.783 4.164 20 0 DIADLO Cc1ncccc1CNc1[nH+]c2ccccc2n1CCC(C)C ZINC001474253401 1061820728 /nfs/dbraw/zinc/82/07/28/1061820728.db2.gz HVBWNHPNKCSAHI-UHFFFAOYSA-N 1 2 308.429 4.398 20 0 DIADLO Fc1cccc2nc(N[C@@H](Cn3cc[nH+]c3)c3ccccc3)oc21 ZINC001458554971 1061834734 /nfs/dbraw/zinc/83/47/34/1061834734.db2.gz RCOTXCFXHWXDNU-INIZCTEOSA-N 1 2 322.343 4.017 20 0 DIADLO Cc1cc(N(CCc2ccccc2)C2CC2)nc(C2CCC2)[nH+]1 ZINC001458631343 1061862260 /nfs/dbraw/zinc/86/22/60/1061862260.db2.gz AEVMUGAGWQBAJH-UHFFFAOYSA-N 1 2 307.441 4.264 20 0 DIADLO CC1(C[N@@H+]2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)CC1 ZINC001474343419 1061939354 /nfs/dbraw/zinc/93/93/54/1061939354.db2.gz OHUFNFQILDLTQP-CQSZACIVSA-N 1 2 300.229 4.167 20 0 DIADLO CC1(C[N@H+]2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)CC1 ZINC001474343419 1061939391 /nfs/dbraw/zinc/93/93/91/1061939391.db2.gz OHUFNFQILDLTQP-CQSZACIVSA-N 1 2 300.229 4.167 20 0 DIADLO C[C@@H]1C[N@@H+](CCCc2c(Cl)cccc2Cl)CC(C)(C)O1 ZINC001474341193 1061942128 /nfs/dbraw/zinc/94/21/28/1061942128.db2.gz NSVGYMBXJNXRSU-GFCCVEGCSA-N 1 2 316.272 4.425 20 0 DIADLO C[C@@H]1C[N@H+](CCCc2c(Cl)cccc2Cl)CC(C)(C)O1 ZINC001474341193 1061942111 /nfs/dbraw/zinc/94/21/11/1061942111.db2.gz NSVGYMBXJNXRSU-GFCCVEGCSA-N 1 2 316.272 4.425 20 0 DIADLO Cc1scc(C[N@@H+]2CCO[C@@H](c3ccccc3F)C2)c1C ZINC001474343664 1061944313 /nfs/dbraw/zinc/94/43/13/1061944313.db2.gz RAIJRCBPILCFAI-QGZVFWFLSA-N 1 2 305.418 4.078 20 0 DIADLO Cc1scc(C[N@H+]2CCO[C@@H](c3ccccc3F)C2)c1C ZINC001474343664 1061944334 /nfs/dbraw/zinc/94/43/34/1061944334.db2.gz RAIJRCBPILCFAI-QGZVFWFLSA-N 1 2 305.418 4.078 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3C[C@@H](C)OC[C@@H]3c3ccccc3)cc21 ZINC001474349975 1061956567 /nfs/dbraw/zinc/95/65/67/1061956567.db2.gz BXJCPIPENGOQMR-IIBYNOLFSA-N 1 2 320.436 4.438 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3C[C@@H](C)OC[C@@H]3c3ccccc3)cc21 ZINC001474349975 1061956609 /nfs/dbraw/zinc/95/66/09/1061956609.db2.gz BXJCPIPENGOQMR-IIBYNOLFSA-N 1 2 320.436 4.438 20 0 DIADLO Cc1cccc(-c2nnc(-c3cccc(-c4c[nH+]cn4C)c3)o2)c1 ZINC001253716689 1061960108 /nfs/dbraw/zinc/96/01/08/1061960108.db2.gz DMQNCXFOWWAUOP-UHFFFAOYSA-N 1 2 316.364 4.113 20 0 DIADLO Clc1ccccc1[C@@H]1CCC[N@@H+]1Cc1nccn1C1CC1 ZINC001474358333 1061980825 /nfs/dbraw/zinc/98/08/25/1061980825.db2.gz PYNOHKALWPBOQZ-INIZCTEOSA-N 1 2 301.821 4.209 20 0 DIADLO Clc1ccccc1[C@@H]1CCC[N@H+]1Cc1nccn1C1CC1 ZINC001474358333 1061980849 /nfs/dbraw/zinc/98/08/49/1061980849.db2.gz PYNOHKALWPBOQZ-INIZCTEOSA-N 1 2 301.821 4.209 20 0 DIADLO CC(C)[N@H+](Cc1ccc(F)cc1)Cc1ccc(O)c(F)c1F ZINC001474362970 1061993867 /nfs/dbraw/zinc/99/38/67/1061993867.db2.gz VIJDSVLUKRINKA-UHFFFAOYSA-N 1 2 309.331 4.220 20 0 DIADLO CC(C)[N@@H+](Cc1ccc(F)cc1)Cc1ccc(O)c(F)c1F ZINC001474362970 1061993892 /nfs/dbraw/zinc/99/38/92/1061993892.db2.gz VIJDSVLUKRINKA-UHFFFAOYSA-N 1 2 309.331 4.220 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2C[C@H]2C2CCCCC2)c(C)[nH+]1 ZINC001466754336 1061998845 /nfs/dbraw/zinc/99/88/45/1061998845.db2.gz AULRSWHNMLQWPR-JKSUJKDBSA-N 1 2 301.434 4.097 20 0 DIADLO CC1(C)C[N@H+](Cc2c(F)cccc2OC(F)(F)F)CCS1 ZINC001474368916 1062004150 /nfs/dbraw/zinc/00/41/50/1062004150.db2.gz CIXDOHSCYRHVHN-UHFFFAOYSA-N 1 2 323.355 4.052 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(F)cccc2OC(F)(F)F)CCS1 ZINC001474368916 1062004174 /nfs/dbraw/zinc/00/41/74/1062004174.db2.gz CIXDOHSCYRHVHN-UHFFFAOYSA-N 1 2 323.355 4.052 20 0 DIADLO CCCc1nnc([C@@H](c2ccccc2)[N@H+](C)Cc2ccccc2)o1 ZINC001253976308 1062007595 /nfs/dbraw/zinc/00/75/95/1062007595.db2.gz AJUYAPMHVOULLT-LJQANCHMSA-N 1 2 321.424 4.244 20 0 DIADLO CCCc1nnc([C@@H](c2ccccc2)[N@@H+](C)Cc2ccccc2)o1 ZINC001253976308 1062007619 /nfs/dbraw/zinc/00/76/19/1062007619.db2.gz AJUYAPMHVOULLT-LJQANCHMSA-N 1 2 321.424 4.244 20 0 DIADLO Clc1ccc(Cl)c(-c2ccc(C[NH2+]Cc3cc[nH]n3)o2)c1 ZINC001254166267 1062039821 /nfs/dbraw/zinc/03/98/21/1062039821.db2.gz TXHAYCNSEXOSGR-UHFFFAOYSA-N 1 2 322.195 4.266 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@H](C)[C@H](F)C2)c(C)c1Br ZINC001474393428 1062050218 /nfs/dbraw/zinc/05/02/18/1062050218.db2.gz QIZFEZBKWAKAMR-IINYFYTJSA-N 1 2 314.242 4.246 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)c(C)c1Br ZINC001474393428 1062050237 /nfs/dbraw/zinc/05/02/37/1062050237.db2.gz QIZFEZBKWAKAMR-IINYFYTJSA-N 1 2 314.242 4.246 20 0 DIADLO c1nc(C[NH+](Cc2ccccc2)Cc2ccccc2)cn1C1CC1 ZINC001474399608 1062051020 /nfs/dbraw/zinc/05/10/20/1062051020.db2.gz FAKFZJKGSOXJDF-UHFFFAOYSA-N 1 2 317.436 4.420 20 0 DIADLO CCc1cn(Cc2oc3ccccc3c2Br)c[nH+]1 ZINC001459259725 1062059165 /nfs/dbraw/zinc/05/91/65/1062059165.db2.gz JEJQLKUSKWZPBF-UHFFFAOYSA-N 1 2 305.175 4.003 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cccc(C)c2Br)o1 ZINC001474413119 1062079097 /nfs/dbraw/zinc/07/90/97/1062079097.db2.gz VIEDGRAGSDRVKQ-UHFFFAOYSA-N 1 2 308.219 4.291 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cccc(C)c2Br)o1 ZINC001474413119 1062079123 /nfs/dbraw/zinc/07/91/23/1062079123.db2.gz VIEDGRAGSDRVKQ-UHFFFAOYSA-N 1 2 308.219 4.291 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(Oc2ccccc2)o1 ZINC001474411632 1062079175 /nfs/dbraw/zinc/07/91/75/1062079175.db2.gz DDZYRCIPZYNBOH-CABCVRRESA-N 1 2 301.386 4.071 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccc(Oc2ccccc2)o1 ZINC001474411632 1062079200 /nfs/dbraw/zinc/07/92/00/1062079200.db2.gz DDZYRCIPZYNBOH-CABCVRRESA-N 1 2 301.386 4.071 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(Oc2ccccc2)o1 ZINC001474411635 1062080578 /nfs/dbraw/zinc/08/05/78/1062080578.db2.gz DDZYRCIPZYNBOH-LSDHHAIUSA-N 1 2 301.386 4.071 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(Oc2ccccc2)o1 ZINC001474411635 1062080597 /nfs/dbraw/zinc/08/05/97/1062080597.db2.gz DDZYRCIPZYNBOH-LSDHHAIUSA-N 1 2 301.386 4.071 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1cc(F)ncc1F ZINC001474413544 1062081202 /nfs/dbraw/zinc/08/12/02/1062081202.db2.gz OGWNLHQYXWZZQC-LLVKDONJSA-N 1 2 302.324 4.299 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1cc(F)ncc1F ZINC001474413544 1062081229 /nfs/dbraw/zinc/08/12/29/1062081229.db2.gz OGWNLHQYXWZZQC-LLVKDONJSA-N 1 2 302.324 4.299 20 0 DIADLO Cc1cccc(C[N@@H+](C)CCC(F)(F)F)c1Br ZINC001459394913 1062128676 /nfs/dbraw/zinc/12/86/76/1062128676.db2.gz FOWGKMMCUYCGAK-UHFFFAOYSA-N 1 2 310.157 4.142 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccc(F)c(F)c1F ZINC001474437550 1062114579 /nfs/dbraw/zinc/11/45/79/1062114579.db2.gz ZYIPJUBQKBQDRK-WPRPVWTQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccc(F)c(F)c1F ZINC001474437550 1062114584 /nfs/dbraw/zinc/11/45/84/1062114584.db2.gz ZYIPJUBQKBQDRK-WPRPVWTQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1ccc(-c2ncco2)cc1F ZINC001459385546 1062118935 /nfs/dbraw/zinc/11/89/35/1062118935.db2.gz GWJYZWGELMZIBL-GFCCVEGCSA-N 1 2 300.333 4.267 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1ccc(-c2ncco2)cc1F ZINC001459385546 1062118947 /nfs/dbraw/zinc/11/89/47/1062118947.db2.gz GWJYZWGELMZIBL-GFCCVEGCSA-N 1 2 300.333 4.267 20 0 DIADLO Cc1cccc(C[N@H+](C)CCC(F)(F)F)c1Br ZINC001459394913 1062128669 /nfs/dbraw/zinc/12/86/69/1062128669.db2.gz FOWGKMMCUYCGAK-UHFFFAOYSA-N 1 2 310.157 4.142 20 0 DIADLO CC1=C(C)C[N@H+](Cc2cccc(F)c2OC(F)(F)F)CC1 ZINC001474481842 1062160099 /nfs/dbraw/zinc/16/00/99/1062160099.db2.gz IERUYCJNGZLSLX-UHFFFAOYSA-N 1 2 303.299 4.266 20 0 DIADLO CC1=C(C)C[N@@H+](Cc2cccc(F)c2OC(F)(F)F)CC1 ZINC001474481842 1062160103 /nfs/dbraw/zinc/16/01/03/1062160103.db2.gz IERUYCJNGZLSLX-UHFFFAOYSA-N 1 2 303.299 4.266 20 0 DIADLO Cn1cc(C[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)c(Cl)n1 ZINC001474481721 1062161855 /nfs/dbraw/zinc/16/18/55/1062161855.db2.gz DSVPWIXDLRNGMF-HNNXBMFYSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1cc(C[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)c(Cl)n1 ZINC001474481721 1062161875 /nfs/dbraw/zinc/16/18/75/1062161875.db2.gz DSVPWIXDLRNGMF-HNNXBMFYSA-N 1 2 324.255 4.454 20 0 DIADLO C[C@@H]1CN(c2ccc(N[C@H]3CCCC(C)(C)C3)c[nH+]2)C[C@H](C)O1 ZINC001474487772 1062165785 /nfs/dbraw/zinc/16/57/85/1062165785.db2.gz UPZKJENGLUSGGC-XHSDSOJGSA-N 1 2 317.477 4.076 20 0 DIADLO C[C@@H]1CN(c2ccc(N[C@H]3CCCC(C)(C)C3)c[nH+]2)C[C@@H](C)O1 ZINC001474487768 1062166649 /nfs/dbraw/zinc/16/66/49/1062166649.db2.gz UPZKJENGLUSGGC-OAGGEKHMSA-N 1 2 317.477 4.076 20 0 DIADLO Cc1coc(C[NH2+]Cc2nc(-c3ccccc3F)cs2)c1 ZINC001474491610 1062170433 /nfs/dbraw/zinc/17/04/33/1062170433.db2.gz JYMFPJYFBMDFQB-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO C[C@@H]1CC[C@H](c2ccccc2)[N@H+](Cc2cc(C(F)(F)F)n[nH]2)C1 ZINC001474518538 1062202747 /nfs/dbraw/zinc/20/27/47/1062202747.db2.gz ZIVLZUWOBMKXQG-IUODEOHRSA-N 1 2 323.362 4.402 20 0 DIADLO C[C@@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2cc(C(F)(F)F)n[nH]2)C1 ZINC001474518538 1062202765 /nfs/dbraw/zinc/20/27/65/1062202765.db2.gz ZIVLZUWOBMKXQG-IUODEOHRSA-N 1 2 323.362 4.402 20 0 DIADLO CC(C)[C@@H]1C[N@H+](Cc2csc(C(F)(F)F)n2)[C@@H]1C(C)C ZINC001474521622 1062205431 /nfs/dbraw/zinc/20/54/31/1062205431.db2.gz NMNZBVRFZOKRLL-NWDGAFQWSA-N 1 2 306.397 4.274 20 0 DIADLO CC(C)[C@@H]1C[N@@H+](Cc2csc(C(F)(F)F)n2)[C@@H]1C(C)C ZINC001474521622 1062205450 /nfs/dbraw/zinc/20/54/50/1062205450.db2.gz NMNZBVRFZOKRLL-NWDGAFQWSA-N 1 2 306.397 4.274 20 0 DIADLO Clc1ccnc(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)c1Cl ZINC001459602341 1062239844 /nfs/dbraw/zinc/23/98/44/1062239844.db2.gz LRXLDJJBYVDXMI-QWHCGFSZSA-N 1 2 317.285 4.248 20 0 DIADLO Clc1ccnc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c1Cl ZINC001459602341 1062239869 /nfs/dbraw/zinc/23/98/69/1062239869.db2.gz LRXLDJJBYVDXMI-QWHCGFSZSA-N 1 2 317.285 4.248 20 0 DIADLO CC[C@@H]1CCCC[C@H]1C[NH2+][C@H](c1ncn[nH]1)C1CCCCC1 ZINC001474553239 1062250651 /nfs/dbraw/zinc/25/06/51/1062250651.db2.gz YLKSHOOHESPJRY-PVAVHDDUSA-N 1 2 304.482 4.232 20 0 DIADLO CC[C@@H]1CCCC[C@H]1C[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1 ZINC001474553236 1062250945 /nfs/dbraw/zinc/25/09/45/1062250945.db2.gz YLKSHOOHESPJRY-HYVNUMGLSA-N 1 2 304.482 4.232 20 0 DIADLO CC(C)c1ccc(-c2nnc([C@H]3CCCc4[nH]c[nH+]c43)o2)cc1 ZINC001254842303 1062262529 /nfs/dbraw/zinc/26/25/29/1062262529.db2.gz CMFSBVQWTZVEIN-AWEZNQCLSA-N 1 2 308.385 4.051 20 0 DIADLO Cc1nn(C)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2C)c1Cl ZINC001474578604 1062284848 /nfs/dbraw/zinc/28/48/48/1062284848.db2.gz BPYHDYYTEYDSSI-OAHLLOKOSA-N 1 2 321.827 4.167 20 0 DIADLO Cc1nn(C)c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2C)c1Cl ZINC001474578604 1062284862 /nfs/dbraw/zinc/28/48/62/1062284862.db2.gz BPYHDYYTEYDSSI-OAHLLOKOSA-N 1 2 321.827 4.167 20 0 DIADLO CCc1ccc(N(CC)Cc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001459672529 1062291915 /nfs/dbraw/zinc/29/19/15/1062291915.db2.gz AHMOLYNEARXRPW-UHFFFAOYSA-N 1 2 305.425 4.461 20 0 DIADLO CC(C)C1(c2ccccc2)C[NH+](Cc2nc(C(C)(C)C)co2)C1 ZINC001474585538 1062295591 /nfs/dbraw/zinc/29/55/91/1062295591.db2.gz WHGFTMUIEDJNJH-UHFFFAOYSA-N 1 2 312.457 4.382 20 0 DIADLO COc1c(C)c[nH+]c(CN2c3ccccc3SC[C@H]2C)c1C ZINC001459705864 1062322435 /nfs/dbraw/zinc/32/24/35/1062322435.db2.gz SXZQQNVDGAZBNH-CYBMUJFWSA-N 1 2 314.454 4.208 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3c(ccnc3Cl)o2)CC2(CCCC2)O1 ZINC001474613577 1062328169 /nfs/dbraw/zinc/32/81/69/1062328169.db2.gz GZBXNTYZDXCSLA-GFCCVEGCSA-N 1 2 320.820 4.015 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3c(ccnc3Cl)o2)CC2(CCCC2)O1 ZINC001474613577 1062328195 /nfs/dbraw/zinc/32/81/95/1062328195.db2.gz GZBXNTYZDXCSLA-GFCCVEGCSA-N 1 2 320.820 4.015 20 0 DIADLO Fc1ccc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)c(F)c1F ZINC001474617298 1062340347 /nfs/dbraw/zinc/34/03/47/1062340347.db2.gz VKRMCJNJPXGZHV-HNNXBMFYSA-N 1 2 323.383 4.394 20 0 DIADLO Fc1ccc(C[N@H+]2CCS[C@H](c3ccccc3)C2)c(F)c1F ZINC001474617298 1062340369 /nfs/dbraw/zinc/34/03/69/1062340369.db2.gz VKRMCJNJPXGZHV-HNNXBMFYSA-N 1 2 323.383 4.394 20 0 DIADLO COc1nc2ccccc2cc1CNc1c[nH+]cc2c1CCCC2 ZINC001474623598 1062345898 /nfs/dbraw/zinc/34/58/98/1062345898.db2.gz WGBOOVAYMMPEHE-UHFFFAOYSA-N 1 2 319.408 4.129 20 0 DIADLO FC(F)C(F)(F)C[N@@H+]1CCC[C@@H]1CCCc1ccccc1 ZINC001459768937 1062378608 /nfs/dbraw/zinc/37/86/08/1062378608.db2.gz QLNJZXWWBBWFEG-AWEZNQCLSA-N 1 2 303.343 4.374 20 0 DIADLO FC(F)C(F)(F)C[N@H+]1CCC[C@@H]1CCCc1ccccc1 ZINC001459768937 1062378630 /nfs/dbraw/zinc/37/86/30/1062378630.db2.gz QLNJZXWWBBWFEG-AWEZNQCLSA-N 1 2 303.343 4.374 20 0 DIADLO CC(C)C[C@H]1CCC[N@H+](Cc2ncsc2Br)C1 ZINC001459770235 1062384912 /nfs/dbraw/zinc/38/49/12/1062384912.db2.gz UJCROXPISPIWPO-LLVKDONJSA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)C[C@H]1CCC[N@@H+](Cc2ncsc2Br)C1 ZINC001459770235 1062384936 /nfs/dbraw/zinc/38/49/36/1062384936.db2.gz UJCROXPISPIWPO-LLVKDONJSA-N 1 2 317.296 4.164 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1Cc1nc2ccccc2n1C ZINC001459775348 1062390119 /nfs/dbraw/zinc/39/01/19/1062390119.db2.gz LISNBPXSQZBODV-ZIAGYGMSSA-N 1 2 323.415 4.220 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1Cc1nc2ccccc2n1C ZINC001459775348 1062390145 /nfs/dbraw/zinc/39/01/45/1062390145.db2.gz LISNBPXSQZBODV-ZIAGYGMSSA-N 1 2 323.415 4.220 20 0 DIADLO C[N@H+](Cc1ccc(-c2ccc(F)cc2)o1)Cc1ccns1 ZINC001474669496 1062398123 /nfs/dbraw/zinc/39/81/23/1062398123.db2.gz GEYUUMLMAZGOMH-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1ccc(-c2ccc(F)cc2)o1)Cc1ccns1 ZINC001474669496 1062398140 /nfs/dbraw/zinc/39/81/40/1062398140.db2.gz GEYUUMLMAZGOMH-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO CCCC[C@@H](C)[NH2+][C@@H](Cc1ccc2ccccc2c1)C(=O)OC ZINC001255321194 1062398191 /nfs/dbraw/zinc/39/81/91/1062398191.db2.gz QMHVKUNMUZFGDS-BEFAXECRSA-N 1 2 313.441 4.092 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@@H+]1CCC[C@](F)(c2ccccc2)C1 ZINC001474673770 1062405188 /nfs/dbraw/zinc/40/51/88/1062405188.db2.gz OFQZFQKHTZFQHT-QGZVFWFLSA-N 1 2 321.827 4.086 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@H+]1CCC[C@](F)(c2ccccc2)C1 ZINC001474673770 1062405198 /nfs/dbraw/zinc/40/51/98/1062405198.db2.gz OFQZFQKHTZFQHT-QGZVFWFLSA-N 1 2 321.827 4.086 20 0 DIADLO CCSCc1ccc[nH+]c1NC[C@H](OC)C1CCCCC1 ZINC001474680607 1062413548 /nfs/dbraw/zinc/41/35/48/1062413548.db2.gz ZEWXALUXVGLDDQ-INIZCTEOSA-N 1 2 308.491 4.342 20 0 DIADLO Fc1cccc(/C=C/C[N@@H+]2CCc3cc(F)c(F)cc3C2)c1 ZINC001474685510 1062417239 /nfs/dbraw/zinc/41/72/39/1062417239.db2.gz SCUCFGCRGQWRDB-DUXPYHPUSA-N 1 2 303.327 4.175 20 0 DIADLO Fc1cccc(/C=C/C[N@H+]2CCc3cc(F)c(F)cc3C2)c1 ZINC001474685510 1062417249 /nfs/dbraw/zinc/41/72/49/1062417249.db2.gz SCUCFGCRGQWRDB-DUXPYHPUSA-N 1 2 303.327 4.175 20 0 DIADLO CCOC(=O)c1ccc(CNc2ccc3[nH+]c(C)cc(C)c3c2)o1 ZINC001474708703 1062434057 /nfs/dbraw/zinc/43/40/57/1062434057.db2.gz MUWGDQOEYMJTLT-UHFFFAOYSA-N 1 2 324.380 4.233 20 0 DIADLO Cc1cc(F)c(C[N@@H+](Cc2ccccn2)CC(C)C)c(F)c1 ZINC001474719829 1062445900 /nfs/dbraw/zinc/44/59/00/1062445900.db2.gz YVWGNSVLPZJIQY-UHFFFAOYSA-N 1 2 304.384 4.326 20 0 DIADLO Cc1cc(F)c(C[N@H+](Cc2ccccn2)CC(C)C)c(F)c1 ZINC001474719829 1062445909 /nfs/dbraw/zinc/44/59/09/1062445909.db2.gz YVWGNSVLPZJIQY-UHFFFAOYSA-N 1 2 304.384 4.326 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NCC[C@H](C)c1ccccc1 ZINC001474748268 1062463229 /nfs/dbraw/zinc/46/32/29/1062463229.db2.gz XYBOETJYFZYUBF-INIZCTEOSA-N 1 2 323.440 4.288 20 0 DIADLO Cc1cc(CNc2[nH+]c3ccccc3n2C2CC2)cc(C)c1O ZINC001474763830 1062469106 /nfs/dbraw/zinc/46/91/06/1062469106.db2.gz IIYWQECJYGXJQA-UHFFFAOYSA-N 1 2 307.397 4.306 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(-c2ncco2)cc1F ZINC001459900630 1062484218 /nfs/dbraw/zinc/48/42/18/1062484218.db2.gz MLWUBCKKPUSLMQ-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(-c2ncco2)cc1F ZINC001459900630 1062484230 /nfs/dbraw/zinc/48/42/30/1062484230.db2.gz MLWUBCKKPUSLMQ-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO COc1ccc(C[N@H+](Cc2c(F)cccc2F)C2CC2)cc1 ZINC001459946138 1062515676 /nfs/dbraw/zinc/51/56/76/1062515676.db2.gz VHWOVBLAWSXLNX-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO COc1ccc(C[N@@H+](Cc2c(F)cccc2F)C2CC2)cc1 ZINC001459946138 1062515694 /nfs/dbraw/zinc/51/56/94/1062515694.db2.gz VHWOVBLAWSXLNX-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO Fc1ccccc1OC1C[NH+]([C@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC001255717417 1062540279 /nfs/dbraw/zinc/54/02/79/1062540279.db2.gz MEYFFMARYCCMAH-NEPJUHHUSA-N 1 2 317.326 4.010 20 0 DIADLO CCC1(CNC(=O)Nc2ccc3[nH+]c(C)cn3c2)CCCCC1 ZINC001476103048 1062588647 /nfs/dbraw/zinc/58/86/47/1062588647.db2.gz ZWDZUHHKOQTREK-UHFFFAOYSA-N 1 2 314.433 4.125 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3ccc(C)c4ccccc34)ccn12 ZINC001460087661 1062626856 /nfs/dbraw/zinc/62/68/56/1062626856.db2.gz GGLHFALNEKFZPW-UHFFFAOYSA-N 1 2 316.360 4.324 20 0 DIADLO Cc1ccc2sc(C[N@@H+]3Cc4ccccc4O[C@H](C)C3)nc2c1 ZINC001460174292 1062677902 /nfs/dbraw/zinc/67/79/02/1062677902.db2.gz JBFPRDQLTICHGF-CQSZACIVSA-N 1 2 324.449 4.388 20 0 DIADLO Cc1ccc2sc(C[N@H+]3Cc4ccccc4O[C@H](C)C3)nc2c1 ZINC001460174292 1062677911 /nfs/dbraw/zinc/67/79/11/1062677911.db2.gz JBFPRDQLTICHGF-CQSZACIVSA-N 1 2 324.449 4.388 20 0 DIADLO c1cn2c(cccc2-c2nnc(-c3ccc4ccccc4c3)o2)[nH+]1 ZINC001255996222 1062679255 /nfs/dbraw/zinc/67/92/55/1062679255.db2.gz OXLABSYGMJRIIY-UHFFFAOYSA-N 1 2 312.332 4.205 20 0 DIADLO c1[nH]c2c([nH+]1)[C@@H](c1nnc(-c3ccc4ccccc4c3)o1)CCC2 ZINC001256002744 1062682692 /nfs/dbraw/zinc/68/26/92/1062682692.db2.gz UKKSOWHLZODMTG-HNNXBMFYSA-N 1 2 316.364 4.081 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC001460201471 1062695593 /nfs/dbraw/zinc/69/55/93/1062695593.db2.gz HUMKBFNKDZHXJI-NVXWUHKLSA-N 1 2 315.457 4.334 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC001460201471 1062695600 /nfs/dbraw/zinc/69/56/00/1062695600.db2.gz HUMKBFNKDZHXJI-NVXWUHKLSA-N 1 2 315.457 4.334 20 0 DIADLO Clc1cc(Cl)c2c(c1)N(CCCn1cc[nH+]c1)CCC2 ZINC001460202063 1062696329 /nfs/dbraw/zinc/69/63/29/1062696329.db2.gz QEGWEAKKWMDGOQ-UHFFFAOYSA-N 1 2 310.228 4.033 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](C)C2CCCCCC2)c(C)[nH+]1 ZINC001476698461 1062703095 /nfs/dbraw/zinc/70/30/95/1062703095.db2.gz UGOBVLJBLIZINT-CQSZACIVSA-N 1 2 303.450 4.487 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C2CCC2)C2CCCC2)c(C)[nH+]1 ZINC001476697688 1062704441 /nfs/dbraw/zinc/70/44/41/1062704441.db2.gz GLNHHZMYIVEXDY-GOSISDBHSA-N 1 2 315.461 4.487 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCCCC[C@@H]2C(C)C)c(C)[nH+]1 ZINC001476697616 1062704650 /nfs/dbraw/zinc/70/46/50/1062704650.db2.gz CNPMRETZRZYNPT-MRXNPFEDSA-N 1 2 303.450 4.439 20 0 DIADLO CCCCOC(=O)[C@H](C)[NH2+][C@@H]1CCC[C@H](c2ccccc2)C1 ZINC001256106892 1062705434 /nfs/dbraw/zinc/70/54/34/1062705434.db2.gz MBKRYEOWDYLERW-RYQLBKOJSA-N 1 2 303.446 4.034 20 0 DIADLO CN(C)c1[nH+]ccc2cc(NC(=O)C(F)=C3CCCC3)ccc21 ZINC001460276454 1062749909 /nfs/dbraw/zinc/74/99/09/1062749909.db2.gz YLQJIRMSXSBLSJ-UHFFFAOYSA-N 1 2 313.376 4.037 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1cccc(C(F)F)c1 ZINC001460334726 1062790309 /nfs/dbraw/zinc/79/03/09/1062790309.db2.gz QOGFOIQAOWADQJ-CQSZACIVSA-N 1 2 313.388 4.176 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC001460334726 1062790331 /nfs/dbraw/zinc/79/03/31/1062790331.db2.gz QOGFOIQAOWADQJ-CQSZACIVSA-N 1 2 313.388 4.176 20 0 DIADLO CC[C@H]1C[N@H+](CCc2c(Cl)cccc2Cl)[C@@H](C)CO1 ZINC001460338814 1062794362 /nfs/dbraw/zinc/79/43/62/1062794362.db2.gz MRVDMYQGZWXZTJ-RYUDHWBXSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)[C@@H](C)CO1 ZINC001460338814 1062794381 /nfs/dbraw/zinc/79/43/81/1062794381.db2.gz MRVDMYQGZWXZTJ-RYUDHWBXSA-N 1 2 302.245 4.035 20 0 DIADLO Cc1c2cccc(C)c2oc1C[N@@H+](C)Cc1ccn(C(C)C)n1 ZINC001460338865 1062795599 /nfs/dbraw/zinc/79/55/99/1062795599.db2.gz ZBGTWNXBNRKZDA-UHFFFAOYSA-N 1 2 311.429 4.459 20 0 DIADLO Cc1c2cccc(C)c2oc1C[N@H+](C)Cc1ccn(C(C)C)n1 ZINC001460338865 1062795621 /nfs/dbraw/zinc/79/56/21/1062795621.db2.gz ZBGTWNXBNRKZDA-UHFFFAOYSA-N 1 2 311.429 4.459 20 0 DIADLO Fc1cc(C[N@@H+]2CCc3oc(-c4ccccc4)cc3C2)ccn1 ZINC001460356960 1062803420 /nfs/dbraw/zinc/80/34/20/1062803420.db2.gz PKVRVCUDDIKIKA-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1cc(C[N@H+]2CCc3oc(-c4ccccc4)cc3C2)ccn1 ZINC001460356960 1062803444 /nfs/dbraw/zinc/80/34/44/1062803444.db2.gz PKVRVCUDDIKIKA-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@H+](Cc1cc(C)cc(C)n1)CC3 ZINC001460366350 1062814516 /nfs/dbraw/zinc/81/45/16/1062814516.db2.gz VLEFCKHAUPQLLJ-UHFFFAOYSA-N 1 2 305.425 4.046 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](Cc1cc(C)cc(C)n1)CC3 ZINC001460366350 1062814546 /nfs/dbraw/zinc/81/45/46/1062814546.db2.gz VLEFCKHAUPQLLJ-UHFFFAOYSA-N 1 2 305.425 4.046 20 0 DIADLO CC(C)Cc1nnc([C@@H](c2ccc(Cl)cc2)[NH+]2CCCC2)o1 ZINC001256450927 1062831369 /nfs/dbraw/zinc/83/13/69/1062831369.db2.gz ZNUNQSSJHRCWBC-MRXNPFEDSA-N 1 2 319.836 4.107 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC001460470288 1062870194 /nfs/dbraw/zinc/87/01/94/1062870194.db2.gz VKUCBLZIDBTRJQ-HFAKWTLXSA-N 1 2 303.780 4.146 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC001460470288 1062870210 /nfs/dbraw/zinc/87/02/10/1062870210.db2.gz VKUCBLZIDBTRJQ-HFAKWTLXSA-N 1 2 303.780 4.146 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2CCO[C@@H](CC(F)(F)F)C2)cc1 ZINC001460482805 1062873537 /nfs/dbraw/zinc/87/35/37/1062873537.db2.gz HSIAKWVHONWUHQ-INIZCTEOSA-N 1 2 315.379 4.038 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2CCO[C@@H](CC(F)(F)F)C2)cc1 ZINC001460482805 1062873562 /nfs/dbraw/zinc/87/35/62/1062873562.db2.gz HSIAKWVHONWUHQ-INIZCTEOSA-N 1 2 315.379 4.038 20 0 DIADLO CC1(C)CC[C@@H](CO)[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001460490845 1062879754 /nfs/dbraw/zinc/87/97/54/1062879754.db2.gz OSCXLAZNKZHWTC-LBPRGKRZSA-N 1 2 320.235 4.115 20 0 DIADLO CC1(C)CC[C@@H](CO)[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001460490845 1062879780 /nfs/dbraw/zinc/87/97/80/1062879780.db2.gz OSCXLAZNKZHWTC-LBPRGKRZSA-N 1 2 320.235 4.115 20 0 DIADLO CC(C)Oc1cccc(C[NH2+][C@H](CF)c2ccc(F)cc2)c1 ZINC001460659581 1062970250 /nfs/dbraw/zinc/97/02/50/1062970250.db2.gz QRGRFRUVCPXOQD-GOSISDBHSA-N 1 2 305.368 4.413 20 0 DIADLO Cc1cccc2c1CCN2Cc1c[nH+]c(N(C)C)c2ccccc12 ZINC001460668417 1062972220 /nfs/dbraw/zinc/97/22/20/1062972220.db2.gz UCRGXZPYFZHZCC-UHFFFAOYSA-N 1 2 317.436 4.172 20 0 DIADLO C/C(=C/c1cccc(Cl)c1)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001460691889 1062991962 /nfs/dbraw/zinc/99/19/62/1062991962.db2.gz QQPZIXIMPXAGGK-XFXZXTDPSA-N 1 2 311.772 4.030 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H](C)c3ccccc3)cc2)[nH+]c1C ZINC001471593370 1063007046 /nfs/dbraw/zinc/00/70/46/1063007046.db2.gz MOJFMABREADHDT-ZDUSSCGKSA-N 1 2 319.408 4.436 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)C/C=C\c2ccc(C)cc2)[nH+]c1C ZINC001471859762 1063025820 /nfs/dbraw/zinc/02/58/20/1063025820.db2.gz SLCKGQYEQQMUMP-WLPBJKJWSA-N 1 2 323.440 4.102 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)C2CC3(C2)CCCCC3)[nH+]c1C ZINC001471860968 1063026274 /nfs/dbraw/zinc/02/62/74/1063026274.db2.gz UYQHDAQPRVSFMT-INIZCTEOSA-N 1 2 315.461 4.051 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)[C@@H](C)CC2CCCCC2)[nH+]c1C ZINC001471859754 1063027371 /nfs/dbraw/zinc/02/73/71/1063027371.db2.gz SKWZCVSOFNMMIL-GUYCJALGSA-N 1 2 317.477 4.297 20 0 DIADLO Clc1sccc1C[N@@H+]1CCc2nc[nH]c2C12CCCCC2 ZINC001460773535 1063052825 /nfs/dbraw/zinc/05/28/25/1063052825.db2.gz QNFJTCMIANUAPB-UHFFFAOYSA-N 1 2 321.877 4.342 20 0 DIADLO Clc1sccc1C[N@H+]1CCc2nc[nH]c2C12CCCCC2 ZINC001460773535 1063052857 /nfs/dbraw/zinc/05/28/57/1063052857.db2.gz QNFJTCMIANUAPB-UHFFFAOYSA-N 1 2 321.877 4.342 20 0 DIADLO Fc1c(Br)ccc2c1C[N@H+](CC1=CCCC1)CC2 ZINC001460792895 1063059392 /nfs/dbraw/zinc/05/93/92/1063059392.db2.gz JPEJNXIFVDPBOX-UHFFFAOYSA-N 1 2 310.210 4.057 20 0 DIADLO Fc1c(Br)ccc2c1C[N@@H+](CC1=CCCC1)CC2 ZINC001460792895 1063059411 /nfs/dbraw/zinc/05/94/11/1063059411.db2.gz JPEJNXIFVDPBOX-UHFFFAOYSA-N 1 2 310.210 4.057 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+](Cc2ccccn2)CC(C)C)n1 ZINC001460824225 1063084846 /nfs/dbraw/zinc/08/48/46/1063084846.db2.gz BSRBNDMNCLLTHE-UHFFFAOYSA-N 1 2 314.477 4.297 20 0 DIADLO CCC(CC)n1ccc(C[N@H+](Cc2ccccn2)CC(C)C)n1 ZINC001460824225 1063084868 /nfs/dbraw/zinc/08/48/68/1063084868.db2.gz BSRBNDMNCLLTHE-UHFFFAOYSA-N 1 2 314.477 4.297 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H]1CCC=CCCC1 ZINC001472555406 1063099198 /nfs/dbraw/zinc/09/91/98/1063099198.db2.gz IQFXNWIJVBQQHR-HNNXBMFYSA-N 1 2 309.413 4.460 20 0 DIADLO CCc1nc(N2CCC[C@@H]2c2ccccc2Cl)cc(C)[nH+]1 ZINC001472663338 1063129943 /nfs/dbraw/zinc/12/99/43/1063129943.db2.gz FCMWXKPRONKMLR-OAHLLOKOSA-N 1 2 301.821 4.342 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3ncccc3C)cs2)o1 ZINC001460938087 1063144432 /nfs/dbraw/zinc/14/44/32/1063144432.db2.gz QHYQUBCORHSFFE-CYBMUJFWSA-N 1 2 313.426 4.266 20 0 DIADLO CCCC[N@H+](C)c1ccc(Nc2nccc(C(F)(F)F)n2)cc1 ZINC001472688726 1063152184 /nfs/dbraw/zinc/15/21/84/1063152184.db2.gz IDHKFIXUPBLCJY-UHFFFAOYSA-N 1 2 324.350 4.475 20 0 DIADLO CCCC[N@@H+](C)c1ccc(Nc2nccc(C(F)(F)F)n2)cc1 ZINC001472688726 1063152191 /nfs/dbraw/zinc/15/21/91/1063152191.db2.gz IDHKFIXUPBLCJY-UHFFFAOYSA-N 1 2 324.350 4.475 20 0 DIADLO CCc1cc(NC[C@@H]2SCCc3ccccc32)nc(CC)[nH+]1 ZINC001472710561 1063169001 /nfs/dbraw/zinc/16/90/01/1063169001.db2.gz LECIJLQNVURUSW-INIZCTEOSA-N 1 2 313.470 4.044 20 0 DIADLO CC(C)c1cc(N[C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)nc(C(C)C)[nH+]1 ZINC001472713148 1063171639 /nfs/dbraw/zinc/17/16/39/1063171639.db2.gz QTYWVVHOYSGEQK-IAOVAPTHSA-N 1 2 317.477 4.339 20 0 DIADLO CCc1cc(N2CC[C@@H](Cc3ccccc3)[C@H]2C)nc(CC)[nH+]1 ZINC001472719184 1063179529 /nfs/dbraw/zinc/17/95/29/1063179529.db2.gz ZKDAPIYPPCWDNQ-WBVHZDCISA-N 1 2 309.457 4.059 20 0 DIADLO Cc1nc(NCCc2c(F)cccc2Cl)c2c([nH+]1)CCCC2 ZINC001472721025 1063183311 /nfs/dbraw/zinc/18/33/11/1063183311.db2.gz VSSMWVIJDMDSIF-UHFFFAOYSA-N 1 2 319.811 4.111 20 0 DIADLO Cc1nc(N2CCC[C@H](c3ccc(F)cc3)CC2)c(C)c(C)[nH+]1 ZINC001472741271 1063197779 /nfs/dbraw/zinc/19/77/79/1063197779.db2.gz YWXJVNWTBPEAQK-INIZCTEOSA-N 1 2 313.420 4.315 20 0 DIADLO Cc1cc(NCCc2nc3c(cccc3C)o2)nc(C2CCC2)[nH+]1 ZINC001472766359 1063218655 /nfs/dbraw/zinc/21/86/55/1063218655.db2.gz BSYOIKKFROQXEJ-UHFFFAOYSA-N 1 2 322.412 4.157 20 0 DIADLO CCc1ccc([C@H]2CCCN(c3nc(C)[nH+]c(C)c3C)C2)cc1 ZINC001472779764 1063229306 /nfs/dbraw/zinc/22/93/06/1063229306.db2.gz KBODLYOYHIKINX-IBGZPJMESA-N 1 2 309.457 4.348 20 0 DIADLO c1cn(-c2ccc(NCc3ccc4c(c3)CCCC4)cc2)c[nH+]1 ZINC001461075964 1063236324 /nfs/dbraw/zinc/23/63/24/1063236324.db2.gz USBCDSOHSCSXGV-UHFFFAOYSA-N 1 2 303.409 4.363 20 0 DIADLO Cc1nc(NC[C@@H](c2ccccc2)C2CC2)c2c([nH+]1)CCCC2 ZINC001472794875 1063240372 /nfs/dbraw/zinc/24/03/72/1063240372.db2.gz KHVRFWBZNUFGEW-SFHVURJKSA-N 1 2 307.441 4.270 20 0 DIADLO CCC(C)(C)C1CCC([N@@H+]2CCn3c(nnc3C(C)C)C2)CC1 ZINC001257407376 1063256895 /nfs/dbraw/zinc/25/68/95/1063256895.db2.gz FWUPJFPZFUOXOX-UHFFFAOYSA-N 1 2 318.509 4.212 20 0 DIADLO CCC(C)(C)C1CCC([N@H+]2CCn3c(nnc3C(C)C)C2)CC1 ZINC001257407376 1063256910 /nfs/dbraw/zinc/25/69/10/1063256910.db2.gz FWUPJFPZFUOXOX-UHFFFAOYSA-N 1 2 318.509 4.212 20 0 DIADLO CCCC[C@@H](CC)[NH2+][C@@H](c1nnc(C)o1)c1ccccc1OC ZINC001257416633 1063264230 /nfs/dbraw/zinc/26/42/30/1063264230.db2.gz NSDFCCNGDBHDCD-RHSMWYFYSA-N 1 2 317.433 4.034 20 0 DIADLO C[C@@H]1CC(CNc2[nH+]cnc3c2cnn3C(C)(C)C)C[C@@H](C)C1 ZINC001472826740 1063269278 /nfs/dbraw/zinc/26/92/78/1063269278.db2.gz HFPXNSVUVSBKCR-STQMWFEESA-N 1 2 315.465 4.066 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2nccs2)c2ccccc2)cc(C)n1 ZINC001461128584 1063280120 /nfs/dbraw/zinc/28/01/20/1063280120.db2.gz HYBSLPWTOBHUJU-QGZVFWFLSA-N 1 2 309.438 4.034 20 0 DIADLO CCc1cc(N[C@@H](Cc2cccnc2)C2CCCC2)nc(CC)[nH+]1 ZINC001472860163 1063288415 /nfs/dbraw/zinc/28/84/15/1063288415.db2.gz LWAPNANUIUCIHI-SFHVURJKSA-N 1 2 324.472 4.210 20 0 DIADLO Clc1ncccc1C[NH2+][C@@H](c1ccccc1)c1cccnc1 ZINC001461145380 1063291685 /nfs/dbraw/zinc/29/16/85/1063291685.db2.gz CDUJVXRQLVRSGW-KRWDZBQOSA-N 1 2 309.800 4.009 20 0 DIADLO Cc1cc(C)c(CNC(=O)N2CC[C@@H](C(C)(C)C)C[C@H]2C)c[nH+]1 ZINC001478814046 1063297769 /nfs/dbraw/zinc/29/77/69/1063297769.db2.gz IPENVQIQUMJECF-NVXWUHKLSA-N 1 2 317.477 4.055 20 0 DIADLO C[C@H](Cc1ccc(Br)cc1)[N@H+]1CCCC(F)(F)C1 ZINC001257559439 1063336554 /nfs/dbraw/zinc/33/65/54/1063336554.db2.gz FHNFBSQNIFUOKU-LLVKDONJSA-N 1 2 318.205 4.111 20 0 DIADLO Cc1nc(NC2(C)C(C)(C)C2(C)C)c(Br)c(C)[nH+]1 ZINC001472894624 1063303792 /nfs/dbraw/zinc/30/37/92/1063303792.db2.gz IEGDWOYVOFTNDQ-UHFFFAOYSA-N 1 2 312.255 4.093 20 0 DIADLO CCCCC[C@H](C)[NH2+][C@H](c1nnc(C)o1)c1ccccc1OC ZINC001257506702 1063318006 /nfs/dbraw/zinc/31/80/06/1063318006.db2.gz SCJLNTYNBZBHHV-GUYCJALGSA-N 1 2 317.433 4.034 20 0 DIADLO C[C@H](Cc1ccc(Br)cc1)[N@@H+]1CCCC(F)(F)C1 ZINC001257559439 1063336540 /nfs/dbraw/zinc/33/65/40/1063336540.db2.gz FHNFBSQNIFUOKU-LLVKDONJSA-N 1 2 318.205 4.111 20 0 DIADLO CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OC(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC001473070109 1063384908 /nfs/dbraw/zinc/38/49/08/1063384908.db2.gz QBCVECHFDCJBHP-PMPSAXMXSA-N 1 2 320.477 4.185 20 0 DIADLO Cc1ccc2[nH+]c(CSc3nc4ccc(F)cc4o3)cn2c1 ZINC001473090165 1063393750 /nfs/dbraw/zinc/39/37/50/1063393750.db2.gz QGPNPPYFQPSSQH-UHFFFAOYSA-N 1 2 313.357 4.215 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc2[nH]c(=O)oc21)c1c(F)cccc1Cl ZINC001461289643 1063393808 /nfs/dbraw/zinc/39/38/08/1063393808.db2.gz XRKRJYQMIWWYLW-SECBINFHSA-N 1 2 320.751 4.177 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc(OC(C)C)c(C)c3)n2c1 ZINC001461297333 1063400560 /nfs/dbraw/zinc/40/05/60/1063400560.db2.gz KNRIXETXHNQDFQ-UHFFFAOYSA-N 1 2 309.413 4.350 20 0 DIADLO Cc1ccc(NCc2cccc3[nH+]ccn32)cc1Br ZINC001461303894 1063405897 /nfs/dbraw/zinc/40/58/97/1063405897.db2.gz OQBSJLYEGOOJEQ-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO COc1ccccc1C[N@H+](Cc1nsc2ccccc21)C1CC1 ZINC001473112037 1063412083 /nfs/dbraw/zinc/41/20/83/1063412083.db2.gz YASOLDLJSGHHSB-UHFFFAOYSA-N 1 2 324.449 4.470 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1nsc2ccccc21)C1CC1 ZINC001473112037 1063412106 /nfs/dbraw/zinc/41/21/06/1063412106.db2.gz YASOLDLJSGHHSB-UHFFFAOYSA-N 1 2 324.449 4.470 20 0 DIADLO Fc1ccc(/C=C\CNc2ccc(-n3cc[nH+]c3)c(F)c2)cc1 ZINC001461320318 1063416746 /nfs/dbraw/zinc/41/67/46/1063416746.db2.gz ICQBPXKWNXIHPZ-UPHRSURJSA-N 1 2 311.335 4.276 20 0 DIADLO C[C@@H]1CCCC[C@H]1CNc1ccccc1OCCn1cc[nH+]c1 ZINC001461324789 1063419867 /nfs/dbraw/zinc/41/98/67/1063419867.db2.gz PESQMQJKGUJFSH-SJORKVTESA-N 1 2 313.445 4.200 20 0 DIADLO Cc1cc(CNc2ccn([C@@H](C)c3ccccc3)n2)cc(C)[nH+]1 ZINC001461331851 1063424748 /nfs/dbraw/zinc/42/47/48/1063424748.db2.gz JFTBEJBWPQLBKV-INIZCTEOSA-N 1 2 306.413 4.116 20 0 DIADLO Cc1cc(C(F)(F)F)ccc1CNc1ccc(N(C)C)[nH+]c1 ZINC001461331075 1063424829 /nfs/dbraw/zinc/42/48/29/1063424829.db2.gz JUSKMVCVVCXSMP-UHFFFAOYSA-N 1 2 309.335 4.087 20 0 DIADLO CCN(CC)c1ccc(NC/C=C\c2ccc(F)cc2F)c[nH+]1 ZINC001461366081 1063446506 /nfs/dbraw/zinc/44/65/06/1063446506.db2.gz FBMHZUJIOMNONO-WAYWQWQTSA-N 1 2 317.383 4.331 20 0 DIADLO CCN(CC)c1ccc(NCc2cc(C)c3ncccc3c2)c[nH+]1 ZINC001461367645 1063449401 /nfs/dbraw/zinc/44/94/01/1063449401.db2.gz ZNZIRERKORKCSP-UHFFFAOYSA-N 1 2 320.440 4.397 20 0 DIADLO COc1ccc(F)c(NCc2cc(C)[nH+]c3c2CCCC3)c1 ZINC001461414284 1063483926 /nfs/dbraw/zinc/48/39/26/1063483926.db2.gz KLILAOAJRDYDDX-UHFFFAOYSA-N 1 2 300.377 4.029 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@H](C)C[C@H](C)CC(C)C)[C@@H]2C ZINC001258066425 1063493774 /nfs/dbraw/zinc/49/37/74/1063493774.db2.gz QKRVKAFDYLCIRG-BRWVUGGUSA-N 1 2 321.509 4.257 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@H](C)C[C@H](C)CC(C)C)[C@@H]2C ZINC001258066425 1063493788 /nfs/dbraw/zinc/49/37/88/1063493788.db2.gz QKRVKAFDYLCIRG-BRWVUGGUSA-N 1 2 321.509 4.257 20 0 DIADLO COC(=O)[C@H](Cc1ccc(Cl)cc1)[NH2+][C@H](C)CCC=C(C)C ZINC001258077749 1063505528 /nfs/dbraw/zinc/50/55/28/1063505528.db2.gz MZTAAHYDMDANQB-PBHICJAKSA-N 1 2 323.864 4.149 20 0 DIADLO C[C@H](Nc1cc(N2CCCC2)nc[nH+]1)c1ccc(Cl)c(F)c1 ZINC001258123981 1063528329 /nfs/dbraw/zinc/52/83/29/1063528329.db2.gz KUWOBNPWJXDSPS-NSHDSACASA-N 1 2 320.799 4.042 20 0 DIADLO C[C@H](Nc1cc(N2CCCC2)[nH+]cn1)c1ccc(Cl)c(F)c1 ZINC001258123981 1063528341 /nfs/dbraw/zinc/52/83/41/1063528341.db2.gz KUWOBNPWJXDSPS-NSHDSACASA-N 1 2 320.799 4.042 20 0 DIADLO C[C@H](Cc1ccco1)[N@@H+]1CC[C@@H](c2ccccc2)C(F)(F)C1 ZINC001258197764 1063557164 /nfs/dbraw/zinc/55/71/64/1063557164.db2.gz QXAPKUIPBJFQJF-PBHICJAKSA-N 1 2 305.368 4.335 20 0 DIADLO C[C@H](Cc1ccco1)[N@H+]1CC[C@@H](c2ccccc2)C(F)(F)C1 ZINC001258197764 1063557175 /nfs/dbraw/zinc/55/71/75/1063557175.db2.gz QXAPKUIPBJFQJF-PBHICJAKSA-N 1 2 305.368 4.335 20 0 DIADLO CC(C)CCc1nnc(/C=C/c2ccc(Cn3cc[nH+]c3)cc2)o1 ZINC001258256788 1063582492 /nfs/dbraw/zinc/58/24/92/1063582492.db2.gz QIGDZVGYCPJSAP-CSKARUKUSA-N 1 2 322.412 4.073 20 0 DIADLO CSc1cc(NCc2cccc3[nH+]ccn32)ccc1Cl ZINC001461579853 1063591392 /nfs/dbraw/zinc/59/13/92/1063591392.db2.gz FJJQBTWLDGDKKE-UHFFFAOYSA-N 1 2 303.818 4.322 20 0 DIADLO FC(F)Oc1ccc(Cl)cc1NCc1cccc2[nH+]ccn21 ZINC001461591731 1063600150 /nfs/dbraw/zinc/60/01/50/1063600150.db2.gz CCVIAZBXDBMTRJ-UHFFFAOYSA-N 1 2 323.730 4.201 20 0 DIADLO Cn1c2ccccc2[nH+]c1NCc1ccc(-c2ccccc2)o1 ZINC001461719293 1063675777 /nfs/dbraw/zinc/67/57/77/1063675777.db2.gz VIGMNHDFXPBTCZ-UHFFFAOYSA-N 1 2 303.365 4.445 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1ccc(Cl)cn1 ZINC001461727529 1063681597 /nfs/dbraw/zinc/68/15/97/1063681597.db2.gz HCAXTTAMTXZRBG-UHFFFAOYSA-N 1 2 321.211 4.370 20 0 DIADLO Cc1ccc(O)c(CNc2[nH+]c3ccccc3n2CCC(C)C)n1 ZINC001461729609 1063683309 /nfs/dbraw/zinc/68/33/09/1063683309.db2.gz NVYYGMDBMZYOBS-UHFFFAOYSA-N 1 2 324.428 4.104 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1cnc(F)c(C)c1 ZINC001461729421 1063683870 /nfs/dbraw/zinc/68/38/70/1063683870.db2.gz MPPQIXQRANZVEJ-UHFFFAOYSA-N 1 2 318.783 4.164 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc3[nH+]ccn3c2)c2ccccc12 ZINC001461741235 1063690407 /nfs/dbraw/zinc/69/04/07/1063690407.db2.gz HFZAZOBGBFHPBY-UHFFFAOYSA-N 1 2 301.349 4.048 20 0 DIADLO COC(=O)[C@H]([NH2+][C@H]1CCC(C)(C)C1)c1cccc2ccccc21 ZINC001258596261 1063699540 /nfs/dbraw/zinc/69/95/40/1063699540.db2.gz GOCVFUJEMGAFMC-MAUKXSAKSA-N 1 2 311.425 4.222 20 0 DIADLO COC(=O)[C@H]([NH2+][C@@H]1CCC(C)(C)C1)c1cccc2ccccc21 ZINC001258596257 1063699810 /nfs/dbraw/zinc/69/98/10/1063699810.db2.gz GOCVFUJEMGAFMC-CRAIPNDOSA-N 1 2 311.425 4.222 20 0 DIADLO Clc1ccc(CNc2[nH+]c3ccccc3n2CC2CC2)nc1 ZINC001461766124 1063705607 /nfs/dbraw/zinc/70/56/07/1063705607.db2.gz IDCDRHDLKSWCQV-UHFFFAOYSA-N 1 2 312.804 4.107 20 0 DIADLO COc1c(Cl)cccc1C[NH2+]Cc1c(F)cc(C)cc1F ZINC001461789728 1063717841 /nfs/dbraw/zinc/71/78/41/1063717841.db2.gz QZWQJHHNIHHHQX-UHFFFAOYSA-N 1 2 311.759 4.225 20 0 DIADLO CCC[C@@H](Cc1ccccc1)[NH2+][C@@H](CC(C)(C)F)C(=O)OCC ZINC001258652220 1063724684 /nfs/dbraw/zinc/72/46/84/1063724684.db2.gz QDYLHJMKUUJQNR-IRXDYDNUSA-N 1 2 323.452 4.057 20 0 DIADLO CCCCC[C@H](CCC)[N@@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001258668866 1063738601 /nfs/dbraw/zinc/73/86/01/1063738601.db2.gz FXROTSOHLAREQP-CVEARBPZSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCC[C@H](CCC)[N@H+]1CCn2c(COC)cnc2[C@H]1C ZINC001258668866 1063738616 /nfs/dbraw/zinc/73/86/16/1063738616.db2.gz FXROTSOHLAREQP-CVEARBPZSA-N 1 2 307.482 4.155 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@@H]1C[C@@H](C)CC(C)(C)C1)[C@@H]2C ZINC001258698610 1063757169 /nfs/dbraw/zinc/75/71/69/1063757169.db2.gz XGICDHKZCGTGTO-BZUAXINKSA-N 1 2 319.493 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@@H]1C[C@@H](C)CC(C)(C)C1)[C@@H]2C ZINC001258698610 1063757177 /nfs/dbraw/zinc/75/71/77/1063757177.db2.gz XGICDHKZCGTGTO-BZUAXINKSA-N 1 2 319.493 4.011 20 0 DIADLO Cn1c(C[N@@H+]2CCc3c(F)ccc(F)c3C2)cc2ccccc21 ZINC001461874196 1063766451 /nfs/dbraw/zinc/76/64/51/1063766451.db2.gz OGDOOFCIJLQKBE-UHFFFAOYSA-N 1 2 312.363 4.015 20 0 DIADLO Cn1c(C[N@H+]2CCc3c(F)ccc(F)c3C2)cc2ccccc21 ZINC001461874196 1063766460 /nfs/dbraw/zinc/76/64/60/1063766460.db2.gz OGDOOFCIJLQKBE-UHFFFAOYSA-N 1 2 312.363 4.015 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1cc(C)no1 ZINC001461970400 1063847862 /nfs/dbraw/zinc/84/78/62/1063847862.db2.gz HIVRKFKPAMFLHS-OAHLLOKOSA-N 1 2 320.820 4.372 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@H+]1CCC[C@@H]1c1cc(C)no1 ZINC001461970400 1063847873 /nfs/dbraw/zinc/84/78/73/1063847873.db2.gz HIVRKFKPAMFLHS-OAHLLOKOSA-N 1 2 320.820 4.372 20 0 DIADLO CC[C@H]1C[N@H+](CCCc2c(Cl)cccc2Cl)C[C@H](C)O1 ZINC001461985168 1063859145 /nfs/dbraw/zinc/85/91/45/1063859145.db2.gz DRLLGBRHTFPPHG-STQMWFEESA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@H]1C[N@@H+](CCCc2c(Cl)cccc2Cl)C[C@H](C)O1 ZINC001461985168 1063859156 /nfs/dbraw/zinc/85/91/56/1063859156.db2.gz DRLLGBRHTFPPHG-STQMWFEESA-N 1 2 316.272 4.425 20 0 DIADLO COc1nccc(C[N@H+](C)[C@H](C)c2cccc(Cl)c2)c1F ZINC001462013378 1063878716 /nfs/dbraw/zinc/87/87/16/1063878716.db2.gz IWBQTHSSMXYGMD-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1nccc(C[N@@H+](C)[C@H](C)c2cccc(Cl)c2)c1F ZINC001462013378 1063878726 /nfs/dbraw/zinc/87/87/26/1063878726.db2.gz IWBQTHSSMXYGMD-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO C[C@H]([NH2+][C@H]1CC[C@@H](c2ccc(Cl)cc2)C1)C(=O)OC(C)(C)C ZINC001462016174 1063880749 /nfs/dbraw/zinc/88/07/49/1063880749.db2.gz ZAZOYCGNIBGQAB-BJJXKVORSA-N 1 2 323.864 4.296 20 0 DIADLO COc1nccc(C[N@H+](C)Cc2ccc3ccccc3c2)c1F ZINC001462022424 1063883558 /nfs/dbraw/zinc/88/35/58/1063883558.db2.gz VPMFWROCRDNSDX-UHFFFAOYSA-N 1 2 310.372 4.015 20 0 DIADLO COc1nccc(C[N@@H+](C)Cc2ccc3ccccc3c2)c1F ZINC001462022424 1063883566 /nfs/dbraw/zinc/88/35/66/1063883566.db2.gz VPMFWROCRDNSDX-UHFFFAOYSA-N 1 2 310.372 4.015 20 0 DIADLO COc1ccc(C[N@@H+]2CCn3cccc3[C@H]2C)cc1C(C)(C)C ZINC001462026090 1063885275 /nfs/dbraw/zinc/88/52/75/1063885275.db2.gz YYYPDAAPAVZTJT-OAHLLOKOSA-N 1 2 312.457 4.371 20 0 DIADLO COc1ccc(C[N@H+]2CCn3cccc3[C@H]2C)cc1C(C)(C)C ZINC001462026090 1063885289 /nfs/dbraw/zinc/88/52/89/1063885289.db2.gz YYYPDAAPAVZTJT-OAHLLOKOSA-N 1 2 312.457 4.371 20 0 DIADLO COc1ccc(C[N@@H+]2CCn3cccc3[C@@H]2C)cc1C(C)(C)C ZINC001462026089 1063886202 /nfs/dbraw/zinc/88/62/02/1063886202.db2.gz YYYPDAAPAVZTJT-HNNXBMFYSA-N 1 2 312.457 4.371 20 0 DIADLO COc1ccc(C[N@H+]2CCn3cccc3[C@@H]2C)cc1C(C)(C)C ZINC001462026089 1063886221 /nfs/dbraw/zinc/88/62/21/1063886221.db2.gz YYYPDAAPAVZTJT-HNNXBMFYSA-N 1 2 312.457 4.371 20 0 DIADLO Cc1cccc(N2CC[NH+](Cc3ccc(F)c(Cl)c3)CC2)c1 ZINC001462033144 1063890800 /nfs/dbraw/zinc/89/08/00/1063890800.db2.gz ZRLAJTLYSLAZQE-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cccc(F)c2OC(F)(F)F)o1 ZINC001462038201 1063895578 /nfs/dbraw/zinc/89/55/78/1063895578.db2.gz CDLAFQRPFKFQRT-UHFFFAOYSA-N 1 2 317.282 4.258 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cccc(F)c2OC(F)(F)F)o1 ZINC001462038201 1063895587 /nfs/dbraw/zinc/89/55/87/1063895587.db2.gz CDLAFQRPFKFQRT-UHFFFAOYSA-N 1 2 317.282 4.258 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2[nH]ncc2C)c2cccc(F)c2)cc1 ZINC001261205505 1063911924 /nfs/dbraw/zinc/91/19/24/1063911924.db2.gz FCWAIZSSBDRZKK-FQEVSTJZSA-N 1 2 323.415 4.299 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2n[nH]cc2C)c2cccc(F)c2)cc1 ZINC001261205505 1063911933 /nfs/dbraw/zinc/91/19/33/1063911933.db2.gz FCWAIZSSBDRZKK-FQEVSTJZSA-N 1 2 323.415 4.299 20 0 DIADLO COc1c(C)cnc(C[N@H+](C)Cc2cc3ccc(C)cc3[nH]2)c1C ZINC001462074858 1063916071 /nfs/dbraw/zinc/91/60/71/1063916071.db2.gz LXCYJIUDSLNLFJ-UHFFFAOYSA-N 1 2 323.440 4.129 20 0 DIADLO COc1c(C)cnc(C[N@@H+](C)Cc2cc3ccc(C)cc3[nH]2)c1C ZINC001462074858 1063916080 /nfs/dbraw/zinc/91/60/80/1063916080.db2.gz LXCYJIUDSLNLFJ-UHFFFAOYSA-N 1 2 323.440 4.129 20 0 DIADLO Fc1ccc(C2CC(Nc3cccc(-n4cc[nH+]c4)c3)C2)cc1 ZINC000378867293 1063978380 /nfs/dbraw/zinc/97/83/80/1063978380.db2.gz DWGFFTDEBSIOFH-UHFFFAOYSA-N 1 2 307.372 4.370 20 0 DIADLO c1cnc2c(c1)cccc2CNc1ccc([NH+]2CCCC2)cc1 ZINC000378922140 1063980745 /nfs/dbraw/zinc/98/07/45/1063980745.db2.gz YZKDCCIZKRSSAR-UHFFFAOYSA-N 1 2 303.409 4.447 20 0 DIADLO Fc1ccc(Br)c(F)c1C[N@@H+]1CCC2(CCC2)C1 ZINC000380334583 1063988018 /nfs/dbraw/zinc/98/80/18/1063988018.db2.gz VVDHKOCKUWFGHY-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Fc1ccc(Br)c(F)c1C[N@H+]1CCC2(CCC2)C1 ZINC000380334583 1063988026 /nfs/dbraw/zinc/98/80/26/1063988026.db2.gz VVDHKOCKUWFGHY-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3ccc(Cl)c(Cl)c3)ccn12 ZINC001264221861 1064045103 /nfs/dbraw/zinc/04/51/03/1064045103.db2.gz LRIDCBIJCLRBCF-UHFFFAOYSA-N 1 2 321.163 4.169 20 0 DIADLO C[C@H]([NH2+]Cc1nc2ccccc2[nH]1)c1nc2ccccc2s1 ZINC000386398641 1064050268 /nfs/dbraw/zinc/05/02/68/1064050268.db2.gz KPAUFHSPHMJTRW-NSHDSACASA-N 1 2 308.410 4.023 20 0 DIADLO Cc1ccc2c(c1)[C@@H](Nc1cc(N3CCC[C@@H](C)C3)nc[nH+]1)CC2 ZINC000592462643 1064066648 /nfs/dbraw/zinc/06/66/48/1064066648.db2.gz MJITVURRSJCZRK-QAPCUYQASA-N 1 2 322.456 4.121 20 0 DIADLO Cc1ccc2c(c1)[C@@H](Nc1cc(N3CCC[C@@H](C)C3)[nH+]cn1)CC2 ZINC000592462643 1064066658 /nfs/dbraw/zinc/06/66/58/1064066658.db2.gz MJITVURRSJCZRK-QAPCUYQASA-N 1 2 322.456 4.121 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccsc2Br)cc1 ZINC000388993993 1064120303 /nfs/dbraw/zinc/12/03/03/1064120303.db2.gz HGTBLIBUTFCEPB-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccsc2Br)cc1 ZINC000388993993 1064120306 /nfs/dbraw/zinc/12/03/06/1064120306.db2.gz HGTBLIBUTFCEPB-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO Cc1ccccc1C[N@H+](C)Cc1ccsc1Br ZINC000388998447 1064118365 /nfs/dbraw/zinc/11/83/65/1064118365.db2.gz NRFUEXODKYUOLJ-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO Cc1ccccc1C[N@@H+](C)Cc1ccsc1Br ZINC000388998447 1064118366 /nfs/dbraw/zinc/11/83/66/1064118366.db2.gz NRFUEXODKYUOLJ-UHFFFAOYSA-N 1 2 310.260 4.451 20 0 DIADLO C[C@H]1CCC[C@@H]1CC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001264831750 1064144733 /nfs/dbraw/zinc/14/47/33/1064144733.db2.gz KEILMFAYUOIJOV-QWHCGFSZSA-N 1 2 317.820 4.291 20 0 DIADLO C[C@@H]1CCC[C@H]1CC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001264831749 1064144901 /nfs/dbraw/zinc/14/49/01/1064144901.db2.gz KEILMFAYUOIJOV-OLZOCXBDSA-N 1 2 317.820 4.291 20 0 DIADLO CCn1c[nH+]cc1CNc1cccc(OCc2ccccc2)c1 ZINC000390745213 1064167387 /nfs/dbraw/zinc/16/73/87/1064167387.db2.gz PJVMHEDUFRVXMQ-UHFFFAOYSA-N 1 2 307.397 4.094 20 0 DIADLO C[C@H]1CCCN(c2cc(NCc3ccc(Cl)s3)[nH+]cn2)C1 ZINC000599456951 1064180240 /nfs/dbraw/zinc/18/02/40/1064180240.db2.gz DPOVVSUVPDEGIX-NSHDSACASA-N 1 2 322.865 4.040 20 0 DIADLO C[C@H]1CCCN(c2cc(NCc3ccc(Cl)s3)nc[nH+]2)C1 ZINC000599456951 1064180245 /nfs/dbraw/zinc/18/02/45/1064180245.db2.gz DPOVVSUVPDEGIX-NSHDSACASA-N 1 2 322.865 4.040 20 0 DIADLO Cc1cc(C)c(C(=O)N2C[C@H](c3ccccc3)C[C@H]2C)c(C)[nH+]1 ZINC001265153369 1064196989 /nfs/dbraw/zinc/19/69/89/1064196989.db2.gz VUNSIQKFHYNMSP-CRAIPNDOSA-N 1 2 308.425 4.025 20 0 DIADLO C[C@@H]1CC[C@](C)(/C=C\C(=O)Nc2cccc3[nH+]ccn32)C1(C)C ZINC001265165326 1064198404 /nfs/dbraw/zinc/19/84/04/1064198404.db2.gz QWDNSCYLGQIGPZ-RVYUYEOTSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@H](c3ccccc3)[C@@H](C)C2)c(C)[nH+]1 ZINC001265476312 1064233951 /nfs/dbraw/zinc/23/39/51/1064233951.db2.gz ZOCYBZDNEVVFBA-KXBFYZLASA-N 1 2 322.452 4.273 20 0 DIADLO Cc1nnsc1[C@@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC001332854353 1064414927 /nfs/dbraw/zinc/41/49/27/1064414927.db2.gz QXCXKILUGGLLMF-SCZZXKLOSA-N 1 2 310.492 4.012 20 0 DIADLO C[C@H](CC(=O)N1CCC(CC2CCCCC2)CC1)n1cc[nH+]c1 ZINC001289342599 1064617445 /nfs/dbraw/zinc/61/74/45/1064617445.db2.gz WNZSUKXYLQKZBP-MRXNPFEDSA-N 1 2 317.477 4.043 20 0 DIADLO C[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1cccc2ccccc21 ZINC001290046611 1064676900 /nfs/dbraw/zinc/67/69/00/1064676900.db2.gz SIQTVJDMWHDTLM-CYBMUJFWSA-N 1 2 315.376 4.207 20 0 DIADLO CCc1cc(NCCCSc2ccccc2)nc(CC)[nH+]1 ZINC001306926614 1064719684 /nfs/dbraw/zinc/71/96/84/1064719684.db2.gz TVBDENZIAVTBFI-UHFFFAOYSA-N 1 2 301.459 4.196 20 0 DIADLO CC(C)=CCC[C@@H](C)CC(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC001292058544 1064755703 /nfs/dbraw/zinc/75/57/03/1064755703.db2.gz JGJHBXQTDDYCCH-IAGOWNOFSA-N 1 2 319.493 4.187 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C3=CC[C@H](C)CC3)c2)[nH+]c1C ZINC001292072962 1064759249 /nfs/dbraw/zinc/75/92/49/1064759249.db2.gz NSJCYHQXRIVTAQ-LBPRGKRZSA-N 1 2 309.413 4.378 20 0 DIADLO Cc1cc(NC(=O)[C@H](C)[C@@H](C)C(C)(C)C)ccc1-n1cc[nH+]c1 ZINC001292865483 1064792034 /nfs/dbraw/zinc/79/20/34/1064792034.db2.gz QURSHTFERXPTHE-HUUCEWRRSA-N 1 2 313.445 4.438 20 0 DIADLO CCC[C@@](C)(CC)C(=O)N1CC[NH2+][C@@H](c2ccc(Cl)cc2)C1 ZINC001301662169 1065070581 /nfs/dbraw/zinc/07/05/81/1065070581.db2.gz NXVXNFGHMXAHPI-SJLPKXTDSA-N 1 2 322.880 4.029 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)/C=C/c3cccs3)cc2)[nH+]c1C ZINC001303122838 1065107738 /nfs/dbraw/zinc/10/77/38/1065107738.db2.gz QQTLTHBMENSKIK-MDZDMXLPSA-N 1 2 323.421 4.407 20 0 DIADLO C/C(=C\c1ccc(C)cc1)C(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001303608609 1065119907 /nfs/dbraw/zinc/11/99/07/1065119907.db2.gz JGTOEPFJAVGUKK-QIXNEVBVSA-N 1 2 323.440 4.102 20 0 DIADLO C[C@@H](NC(=O)[C@@H]1CCCC2(CC2)C1)c1ccc(-n2cc[nH+]c2)cc1 ZINC001306753939 1065192795 /nfs/dbraw/zinc/19/27/95/1065192795.db2.gz GTAHWQXUHWNWBD-NVXWUHKLSA-N 1 2 323.440 4.020 20 0 DIADLO CC(C)[C@@H]1CCCN(c2nc3ccccc3n3c[nH+]cc23)CC1 ZINC001306968529 1065226654 /nfs/dbraw/zinc/22/66/54/1065226654.db2.gz KJBFVACPJBBJLN-OAHLLOKOSA-N 1 2 308.429 4.145 20 0 DIADLO Cc1nc(N2CC[C@H](c3ccccc3)[C@H]2C)c2c([nH+]1)CCCC2 ZINC001306988873 1065237767 /nfs/dbraw/zinc/23/77/67/1065237767.db2.gz DKLGYQBFFUMANG-PBHICJAKSA-N 1 2 307.441 4.046 20 0 DIADLO CCc1nsc(Nc2ccc3c(c2)[nH+]c(C(C)(C)C)n3C)n1 ZINC001307087569 1065255585 /nfs/dbraw/zinc/25/55/85/1065255585.db2.gz YFNDVAVVVCTVHM-UHFFFAOYSA-N 1 2 315.446 4.028 20 0 DIADLO Cc1ccc([C@@H](O)CNc2cc(C(C)C)[nH+]c(C(C)C)n2)cc1 ZINC001307106148 1065264909 /nfs/dbraw/zinc/26/49/09/1065264909.db2.gz QJFFAMGXLPPKDQ-KRWDZBQOSA-N 1 2 313.445 4.177 20 0 DIADLO Cc1cc(N2CC(c3ccc(Cl)cc3)C2)nc(C2CCC2)[nH+]1 ZINC001307120940 1065272311 /nfs/dbraw/zinc/27/23/11/1065272311.db2.gz CFIPJWCSXUSEMO-UHFFFAOYSA-N 1 2 313.832 4.310 20 0 DIADLO C=Cc1ccc(CCNc2nc3ccccc3n3c[nH+]cc23)cc1 ZINC001307124876 1065272974 /nfs/dbraw/zinc/27/29/74/1065272974.db2.gz FFUGYAHNULZCRF-UHFFFAOYSA-N 1 2 314.392 4.180 20 0 DIADLO CCc1cc(N(C)[C@@H]2CCC[C@H]2c2ccccc2)nc(CC)[nH+]1 ZINC001307138016 1065279718 /nfs/dbraw/zinc/27/97/18/1065279718.db2.gz BVXGDSCRYWOBRS-ZWKOTPCHSA-N 1 2 309.457 4.374 20 0 DIADLO Cc1nc(N(C)[C@H]2CCC[C@H]2c2ccccc2)c2c([nH+]1)CCCC2 ZINC001307139905 1065281315 /nfs/dbraw/zinc/28/13/15/1065281315.db2.gz PTSKTFUZHWGPHX-PXNSSMCTSA-N 1 2 321.468 4.436 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(SCc3cccc4cccnc43)c12 ZINC001307187271 1065296080 /nfs/dbraw/zinc/29/60/80/1065296080.db2.gz HSCSDSXLQHPQNQ-UHFFFAOYSA-N 1 2 320.421 4.361 20 0 DIADLO Cc1nnc(SCc2ccc(C)[nH+]c2C)n1C1CCCCC1 ZINC001307246894 1065313219 /nfs/dbraw/zinc/31/32/19/1065313219.db2.gz CUICQLZKLRBJAG-UHFFFAOYSA-N 1 2 316.474 4.396 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2cccc(F)c2F)c1C ZINC001307395753 1065367726 /nfs/dbraw/zinc/36/77/26/1065367726.db2.gz YVCUKMMVQKRQCU-UHFFFAOYSA-N 1 2 309.381 4.419 20 0 DIADLO Cc1ccc2sc(SCc3cc[nH+]c(N(C)C)c3)nc2c1 ZINC001307397357 1065370025 /nfs/dbraw/zinc/37/00/25/1065370025.db2.gz FVAATGHLHSNIKZ-UHFFFAOYSA-N 1 2 315.467 4.358 20 0 DIADLO CCc1cn(Cc2cc(=O)oc3cc(C)c(C(C)C)cc23)c[nH+]1 ZINC001307398528 1065370233 /nfs/dbraw/zinc/37/02/33/1065370233.db2.gz XBFVWZIDYNIAHH-UHFFFAOYSA-N 1 2 310.397 4.032 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@H](C)CC1 ZINC001307441230 1065401524 /nfs/dbraw/zinc/40/15/24/1065401524.db2.gz YKGJXLWHZZLBES-XJKSGUPXSA-N 1 2 309.837 4.066 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H](C)CC1 ZINC001307441230 1065401530 /nfs/dbraw/zinc/40/15/30/1065401530.db2.gz YKGJXLWHZZLBES-XJKSGUPXSA-N 1 2 309.837 4.066 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@H](CC(C)C)C1 ZINC001307506902 1065449054 /nfs/dbraw/zinc/44/90/54/1065449054.db2.gz RCBFBEGVUCPVDE-YOEHRIQHSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@@H](CC(C)C)C1 ZINC001307506902 1065449058 /nfs/dbraw/zinc/44/90/58/1065449058.db2.gz RCBFBEGVUCPVDE-YOEHRIQHSA-N 1 2 323.864 4.312 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CCCCC[C@@H]2/C=C\c2ccccc2)[nH]1 ZINC001307582355 1065497101 /nfs/dbraw/zinc/49/71/01/1065497101.db2.gz GPUNNHNXUFDRQD-MENFKHAKSA-N 1 2 324.472 4.386 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CCCCC[C@@H]2/C=C\c2ccccc2)[nH]1 ZINC001307582355 1065497106 /nfs/dbraw/zinc/49/71/06/1065497106.db2.gz GPUNNHNXUFDRQD-MENFKHAKSA-N 1 2 324.472 4.386 20 0 DIADLO Fc1ccc(OCC[N@@H+]2CCc3c(F)cccc3C2)c(Cl)c1 ZINC001307589027 1065501258 /nfs/dbraw/zinc/50/12/58/1065501258.db2.gz QLQCHTNYMWUVNY-UHFFFAOYSA-N 1 2 323.770 4.055 20 0 DIADLO Fc1ccc(OCC[N@H+]2CCc3c(F)cccc3C2)c(Cl)c1 ZINC001307589027 1065501267 /nfs/dbraw/zinc/50/12/67/1065501267.db2.gz QLQCHTNYMWUVNY-UHFFFAOYSA-N 1 2 323.770 4.055 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cc2ccccc2o1)c1nc(C2CC2)no1 ZINC001307614981 1065519184 /nfs/dbraw/zinc/51/91/84/1065519184.db2.gz OKVIJJMXFUEDEZ-INIZCTEOSA-N 1 2 311.385 4.180 20 0 DIADLO FC(F)[C@@H]1CCC[N@@H+]1CCCOc1cccc2ccccc21 ZINC001307652097 1065542916 /nfs/dbraw/zinc/54/29/16/1065542916.db2.gz GIMWRLREOAJCDF-INIZCTEOSA-N 1 2 305.368 4.338 20 0 DIADLO FC(F)[C@@H]1CCC[N@H+]1CCCOc1cccc2ccccc21 ZINC001307652097 1065542927 /nfs/dbraw/zinc/54/29/27/1065542927.db2.gz GIMWRLREOAJCDF-INIZCTEOSA-N 1 2 305.368 4.338 20 0 DIADLO CC[C@]1(C)C[N@@H+]([C@H](C)c2ccc(Br)cc2)CCO1 ZINC001307688069 1065563976 /nfs/dbraw/zinc/56/39/76/1065563976.db2.gz KGFISPDOZZHQIT-IUODEOHRSA-N 1 2 312.251 4.011 20 0 DIADLO CC[C@]1(C)C[N@H+]([C@H](C)c2ccc(Br)cc2)CCO1 ZINC001307688069 1065563979 /nfs/dbraw/zinc/56/39/79/1065563979.db2.gz KGFISPDOZZHQIT-IUODEOHRSA-N 1 2 312.251 4.011 20 0 DIADLO COc1ccc2c(c1)OCC[N@@H+](Cc1c(C)cccc1Cl)C2 ZINC001307715236 1065581761 /nfs/dbraw/zinc/58/17/61/1065581761.db2.gz HEUVMHPYPXVJPT-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO COc1ccc2c(c1)OCC[N@H+](Cc1c(C)cccc1Cl)C2 ZINC001307715236 1065581767 /nfs/dbraw/zinc/58/17/67/1065581767.db2.gz HEUVMHPYPXVJPT-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO COc1cc(C[N@@H+]2CCOc3ccc(C)cc3C2)ccc1Cl ZINC001307754988 1065607713 /nfs/dbraw/zinc/60/77/13/1065607713.db2.gz BCGJKOKPJAKCKN-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO COc1cc(C[N@H+]2CCOc3ccc(C)cc3C2)ccc1Cl ZINC001307754988 1065607717 /nfs/dbraw/zinc/60/77/17/1065607717.db2.gz BCGJKOKPJAKCKN-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO Cc1cc2c(cc1C)N(Cc1ccc(-n3cc[nH+]c3)cc1C)CC2 ZINC001307760869 1065609719 /nfs/dbraw/zinc/60/97/19/1065609719.db2.gz KHGQOCSAXMCHTC-UHFFFAOYSA-N 1 2 317.436 4.360 20 0 DIADLO Cc1ccccc1C[N@H+](Cc1cncs1)Cc1ccccn1 ZINC001307795768 1065625994 /nfs/dbraw/zinc/62/59/94/1065625994.db2.gz KSFVUMRSAUNSME-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1ccccc1C[N@@H+](Cc1cncs1)Cc1ccccn1 ZINC001307795768 1065625999 /nfs/dbraw/zinc/62/59/99/1065625999.db2.gz KSFVUMRSAUNSME-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO CC[C@@H]1C[N@H+]([C@H](C)c2ncc(-c3ccccc3)o2)C[C@H](CC)O1 ZINC001307856523 1065655246 /nfs/dbraw/zinc/65/52/46/1065655246.db2.gz LPGHJAHJYGYWDS-OIISXLGYSA-N 1 2 314.429 4.292 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@H](C)c2ncc(-c3ccccc3)o2)C[C@H](CC)O1 ZINC001307856523 1065655253 /nfs/dbraw/zinc/65/52/53/1065655253.db2.gz LPGHJAHJYGYWDS-OIISXLGYSA-N 1 2 314.429 4.292 20 0 DIADLO C[C@H]1C[N@H+](CCc2cccc(Cl)c2Cl)CC2(CCC2)O1 ZINC001307894624 1065671835 /nfs/dbraw/zinc/67/18/35/1065671835.db2.gz KRGFDLDHFYYBEB-LBPRGKRZSA-N 1 2 314.256 4.179 20 0 DIADLO C[C@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)CC2(CCC2)O1 ZINC001307894624 1065671841 /nfs/dbraw/zinc/67/18/41/1065671841.db2.gz KRGFDLDHFYYBEB-LBPRGKRZSA-N 1 2 314.256 4.179 20 0 DIADLO Cc1c(C[N@@H+](C)[C@H](C)C(=O)OC(C)(C)C)oc2c1cccc2C ZINC001307902025 1065673719 /nfs/dbraw/zinc/67/37/19/1065673719.db2.gz PKWRHVPJITVWOZ-CQSZACIVSA-N 1 2 317.429 4.212 20 0 DIADLO Cc1c(C[N@H+](C)[C@H](C)C(=O)OC(C)(C)C)oc2c1cccc2C ZINC001307902025 1065673728 /nfs/dbraw/zinc/67/37/28/1065673728.db2.gz PKWRHVPJITVWOZ-CQSZACIVSA-N 1 2 317.429 4.212 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ncc(-c3ccc(C)cc3)o2)[C@@H](CC)CO1 ZINC001307907887 1065677853 /nfs/dbraw/zinc/67/78/53/1065677853.db2.gz OANQZHMGEMCWBR-DLBZAZTESA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ncc(-c3ccc(C)cc3)o2)[C@@H](CC)CO1 ZINC001307907887 1065677858 /nfs/dbraw/zinc/67/78/58/1065677858.db2.gz OANQZHMGEMCWBR-DLBZAZTESA-N 1 2 314.429 4.039 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)ccc2F)cc1F ZINC001307916003 1065680054 /nfs/dbraw/zinc/68/00/54/1065680054.db2.gz ZECMYTJSDNFATI-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)ccc2F)cc1F ZINC001307916003 1065680056 /nfs/dbraw/zinc/68/00/56/1065680056.db2.gz ZECMYTJSDNFATI-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1ccc([C@@H]2CC[N@H+]2Cc2ccccc2OC(F)F)cc1 ZINC001307915878 1065680252 /nfs/dbraw/zinc/68/02/52/1065680252.db2.gz IEAXEMVRKCXZAL-HNNXBMFYSA-N 1 2 307.315 4.374 20 0 DIADLO Fc1ccc([C@@H]2CC[N@@H+]2Cc2ccccc2OC(F)F)cc1 ZINC001307915878 1065680256 /nfs/dbraw/zinc/68/02/56/1065680256.db2.gz IEAXEMVRKCXZAL-HNNXBMFYSA-N 1 2 307.315 4.374 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC001307947719 1065694350 /nfs/dbraw/zinc/69/43/50/1065694350.db2.gz SZZGBFIBQKHFOS-INIZCTEOSA-N 1 2 303.450 4.129 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@H+]1CCC[C@H](C2CCC2)C1 ZINC001307947719 1065694361 /nfs/dbraw/zinc/69/43/61/1065694361.db2.gz SZZGBFIBQKHFOS-INIZCTEOSA-N 1 2 303.450 4.129 20 0 DIADLO Cc1cc(Br)c2c(c1)CC[N@@H+](CCC(F)(F)F)C2 ZINC001307997082 1065717211 /nfs/dbraw/zinc/71/72/11/1065717211.db2.gz XBMWTTCFUILALX-UHFFFAOYSA-N 1 2 322.168 4.068 20 0 DIADLO Cc1cc(Br)c2c(c1)CC[N@H+](CCC(F)(F)F)C2 ZINC001307997082 1065717222 /nfs/dbraw/zinc/71/72/22/1065717222.db2.gz XBMWTTCFUILALX-UHFFFAOYSA-N 1 2 322.168 4.068 20 0 DIADLO C[C@H](c1csnn1)[NH+]1CCC(Cc2ccc(Cl)cc2)CC1 ZINC001308011373 1065723943 /nfs/dbraw/zinc/72/39/43/1065723943.db2.gz OWXYXZMECDASSI-GFCCVEGCSA-N 1 2 321.877 4.207 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2Cc2cc(Cl)ccc2F)[nH+]c1C ZINC001308070958 1065749327 /nfs/dbraw/zinc/74/93/27/1065749327.db2.gz OHBPFBFWMOBARN-HNNXBMFYSA-N 1 2 307.800 4.156 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001308079741 1065752202 /nfs/dbraw/zinc/75/22/02/1065752202.db2.gz BIRSPEVRSABUJY-JOYOIKCWSA-N 1 2 309.784 4.381 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001308079741 1065752215 /nfs/dbraw/zinc/75/22/15/1065752215.db2.gz BIRSPEVRSABUJY-JOYOIKCWSA-N 1 2 309.784 4.381 20 0 DIADLO CC[C@@H](C)[C@H]([NH2+][C@@H](CC)c1cccc2ccccc21)C(=O)OC ZINC001308084220 1065755815 /nfs/dbraw/zinc/75/58/15/1065755815.db2.gz DPXFMSKPJGLSMC-CCKFTAQKSA-N 1 2 313.441 4.468 20 0 DIADLO COC(=O)[C@H](CC(C)C)[NH2+][C@@H]1CCc2cccc3cccc1c32 ZINC001308092703 1065758845 /nfs/dbraw/zinc/75/88/45/1065758845.db2.gz NAGLXYQVGUKWSI-MSOLQXFVSA-N 1 2 311.425 4.004 20 0 DIADLO C[C@H]1CSCCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1F ZINC001308140178 1065778470 /nfs/dbraw/zinc/77/84/70/1065778470.db2.gz FHTRWDXKSJHFIP-VIFPVBQESA-N 1 2 308.249 4.460 20 0 DIADLO C[C@H]1CSCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1F ZINC001308140178 1065778479 /nfs/dbraw/zinc/77/84/79/1065778479.db2.gz FHTRWDXKSJHFIP-VIFPVBQESA-N 1 2 308.249 4.460 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccsc2Cl)nc1 ZINC001308150974 1065782356 /nfs/dbraw/zinc/78/23/56/1065782356.db2.gz ZZOASCGKFVQGID-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ccsc2Cl)nc1 ZINC001308150974 1065782365 /nfs/dbraw/zinc/78/23/65/1065782365.db2.gz ZZOASCGKFVQGID-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO CCOc1cc(F)cc(CNc2ccc([NH+](C)C)cc2C)c1 ZINC001308210509 1065816696 /nfs/dbraw/zinc/81/66/96/1065816696.db2.gz CATCGKUDHHEPDP-UHFFFAOYSA-N 1 2 302.393 4.211 20 0 DIADLO Cc1ccc(C[NH2+]Cc2csc(-c3ccco3)n2)c(F)c1 ZINC001308306830 1065900902 /nfs/dbraw/zinc/90/09/02/1065900902.db2.gz RXDLEFGEDCVURQ-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccc(C)cc2OCC2CC2)s1 ZINC001308307962 1065901967 /nfs/dbraw/zinc/90/19/67/1065901967.db2.gz VKHJZOVAMUUWOC-UHFFFAOYSA-N 1 2 316.470 4.093 20 0 DIADLO CCCn1c[nH+]cc1CNc1cccc(N2CCCCCC2)c1 ZINC001308314140 1065907572 /nfs/dbraw/zinc/90/75/72/1065907572.db2.gz NXNIHEIEEQKDBE-UHFFFAOYSA-N 1 2 312.461 4.286 20 0 DIADLO Cc1coc(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)c1 ZINC001308318577 1065909332 /nfs/dbraw/zinc/90/93/32/1065909332.db2.gz ARTUVNLEXDAIAN-UHFFFAOYSA-N 1 2 307.397 4.400 20 0 DIADLO Fc1ccc(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)cc1 ZINC001308317902 1065909657 /nfs/dbraw/zinc/90/96/57/1065909657.db2.gz ZJERWDFWJQZTFP-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO Cc1ccc(-c2ccc(CNc3ccc(N(C)C)[nH+]c3)o2)cc1 ZINC001308325960 1065914654 /nfs/dbraw/zinc/91/46/54/1065914654.db2.gz KRYKUZYCFVCGQZ-UHFFFAOYSA-N 1 2 307.397 4.328 20 0 DIADLO C[C@@H]([NH2+]C/C=C\c1cccc(F)c1)c1noc(-c2ccccc2)n1 ZINC001308329238 1065917789 /nfs/dbraw/zinc/91/77/89/1065917789.db2.gz UJKLRDWXMABHRL-IQCBXXCUSA-N 1 2 323.371 4.240 20 0 DIADLO COc1cc[nH+]cc1NCc1cc(Cl)c(OC)cc1Cl ZINC001308340385 1065924227 /nfs/dbraw/zinc/92/42/27/1065924227.db2.gz NHZGHYISZHYGBT-UHFFFAOYSA-N 1 2 313.184 4.018 20 0 DIADLO COc1ccc(Cl)cc1CNc1ccc([NH+](C)C)c(C)c1 ZINC001308354189 1065934253 /nfs/dbraw/zinc/93/42/53/1065934253.db2.gz MBWOEBZZRRRJPB-UHFFFAOYSA-N 1 2 304.821 4.335 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1nccc2ccccc21 ZINC001308356555 1065936042 /nfs/dbraw/zinc/93/60/42/1065936042.db2.gz GRWBKWKELBPNLZ-UHFFFAOYSA-N 1 2 307.397 4.419 20 0 DIADLO CC[C@@H](C)c1nnc([C@@H](C)[NH2+]Cc2cc(C(C)(C)C)oc2C)[nH]1 ZINC001308394463 1065960955 /nfs/dbraw/zinc/96/09/55/1065960955.db2.gz PONOZRHLCACGDM-VXGBXAGGSA-N 1 2 318.465 4.368 20 0 DIADLO CC(C)n1c(CNc2cc3cc[nH]c3c[nH+]2)nc2ccccc21 ZINC001308449836 1065994984 /nfs/dbraw/zinc/99/49/84/1065994984.db2.gz GEQPFPCTSYJIOH-UHFFFAOYSA-N 1 2 305.385 4.106 20 0 DIADLO Fc1cccc(C[NH2+]Cc2csc(-c3cccs3)n2)c1F ZINC001308481644 1066020379 /nfs/dbraw/zinc/02/03/79/1066020379.db2.gz VOUCBDGUPWXONA-UHFFFAOYSA-N 1 2 322.405 4.440 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[NH2+]Cc1ccncc1Cl ZINC001308493450 1066025739 /nfs/dbraw/zinc/02/57/39/1066025739.db2.gz VCNGTFLNYRXWMQ-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO Cc1ccc(CNc2[nH]c3ccc(Br)cc3[nH+]2)s1 ZINC001308507765 1066035872 /nfs/dbraw/zinc/03/58/72/1066035872.db2.gz OZZVCPWKGICZMB-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO Cc1ccc(CNc2[nH]c3cc(Br)ccc3[nH+]2)s1 ZINC001308507765 1066035884 /nfs/dbraw/zinc/03/58/84/1066035884.db2.gz OZZVCPWKGICZMB-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO Cc1nc(C)c(CNc2[nH+]c3ccccc3n2CC2CC2)s1 ZINC001308527916 1066046613 /nfs/dbraw/zinc/04/66/13/1066046613.db2.gz UTPOLHYIKFFGDO-UHFFFAOYSA-N 1 2 312.442 4.132 20 0 DIADLO Clc1ccc(CNc2[nH+]c3ccccc3n2CC2CC2)o1 ZINC001308527463 1066046629 /nfs/dbraw/zinc/04/66/29/1066046629.db2.gz IHHYWAJEGPTSSS-UHFFFAOYSA-N 1 2 301.777 4.305 20 0 DIADLO Fc1ccc(F)c(CNc2[nH+]c3ccccc3n2CC2CC2)c1 ZINC001308527805 1066047217 /nfs/dbraw/zinc/04/72/17/1066047217.db2.gz SOTGICHSCNYGGE-UHFFFAOYSA-N 1 2 313.351 4.337 20 0 DIADLO CC(C)(C)c1coc(CNc2[nH+]c3ccccc3n2CC2CC2)n1 ZINC001308528188 1066048047 /nfs/dbraw/zinc/04/80/47/1066048047.db2.gz ZDPVUMVGHMUTPL-UHFFFAOYSA-N 1 2 324.428 4.344 20 0 DIADLO CC[N@H+](Cc1cc2ccccc2n1C)Cc1c(F)cccc1F ZINC001308560833 1066068562 /nfs/dbraw/zinc/06/85/62/1066068562.db2.gz URMNWQVIBJEMRB-UHFFFAOYSA-N 1 2 314.379 4.479 20 0 DIADLO CC[N@@H+](Cc1cc2ccccc2n1C)Cc1c(F)cccc1F ZINC001308560833 1066068570 /nfs/dbraw/zinc/06/85/70/1066068570.db2.gz URMNWQVIBJEMRB-UHFFFAOYSA-N 1 2 314.379 4.479 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1ccc(C(F)F)c(F)c1)CC2 ZINC001308578157 1066093483 /nfs/dbraw/zinc/09/34/83/1066093483.db2.gz YUWKLSSXSLIRSS-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1ccc(C(F)F)c(F)c1)CC2 ZINC001308578157 1066093493 /nfs/dbraw/zinc/09/34/93/1066093493.db2.gz YUWKLSSXSLIRSS-UHFFFAOYSA-N 1 2 309.306 4.461 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2c(Cl)c(C)nn2C)o1 ZINC001308578252 1066093922 /nfs/dbraw/zinc/09/39/22/1066093922.db2.gz NYRUPUILNVWROB-RISCZKNCSA-N 1 2 321.852 4.257 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2c(Cl)c(C)nn2C)o1 ZINC001308578252 1066093929 /nfs/dbraw/zinc/09/39/29/1066093929.db2.gz NYRUPUILNVWROB-RISCZKNCSA-N 1 2 321.852 4.257 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2cc(Cl)c(OC)cc2Cl)CCS1 ZINC001308619790 1066121676 /nfs/dbraw/zinc/12/16/76/1066121676.db2.gz PIYRIRAWXVUHAU-LLVKDONJSA-N 1 2 320.285 4.329 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2cc(Cl)c(OC)cc2Cl)CCS1 ZINC001308619790 1066121681 /nfs/dbraw/zinc/12/16/81/1066121681.db2.gz PIYRIRAWXVUHAU-LLVKDONJSA-N 1 2 320.285 4.329 20 0 DIADLO CCCN(Cc1c[nH+]cn1CCC)Cc1c(F)cccc1Cl ZINC001308622575 1066123259 /nfs/dbraw/zinc/12/32/59/1066123259.db2.gz CQTFMCZGLYTTOV-UHFFFAOYSA-N 1 2 323.843 4.498 20 0 DIADLO CCCn1c[nH+]cc1CN(C)[C@@H](C)c1nc2ccccc2s1 ZINC001308626762 1066124840 /nfs/dbraw/zinc/12/48/40/1066124840.db2.gz VNNKYABDJVQGPI-ZDUSSCGKSA-N 1 2 314.458 4.096 20 0 DIADLO Cc1cccc(N2CC[NH+](Cc3cc(F)cc(Cl)c3)CC2)c1 ZINC001308656207 1066139185 /nfs/dbraw/zinc/13/91/85/1066139185.db2.gz YMJAFTWISPBQFH-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO CC1(C[N@@H+]2CCc3c(Br)ccc(Cl)c3C2)CC1 ZINC001308664601 1066144776 /nfs/dbraw/zinc/14/47/76/1066144776.db2.gz UGQGPJLHZKGVKE-UHFFFAOYSA-N 1 2 314.654 4.261 20 0 DIADLO CC1(C[N@H+]2CCc3c(Br)ccc(Cl)c3C2)CC1 ZINC001308664601 1066144778 /nfs/dbraw/zinc/14/47/78/1066144778.db2.gz UGQGPJLHZKGVKE-UHFFFAOYSA-N 1 2 314.654 4.261 20 0 DIADLO C[N@H+](Cc1cn(C2CC2)cn1)Cc1ccc(Cl)c(Cl)c1 ZINC001308663953 1066144873 /nfs/dbraw/zinc/14/48/73/1066144873.db2.gz XANNQAIYZAZSEG-UHFFFAOYSA-N 1 2 310.228 4.157 20 0 DIADLO C[N@@H+](Cc1cn(C2CC2)cn1)Cc1ccc(Cl)c(Cl)c1 ZINC001308663953 1066144880 /nfs/dbraw/zinc/14/48/80/1066144880.db2.gz XANNQAIYZAZSEG-UHFFFAOYSA-N 1 2 310.228 4.157 20 0 DIADLO C[C@H]1CN(c2ccccc2F)CC[N@@H+]1Cc1cscc1Cl ZINC001308731648 1066206950 /nfs/dbraw/zinc/20/69/50/1066206950.db2.gz BZQZLTVJVFQOOV-LBPRGKRZSA-N 1 2 324.852 4.251 20 0 DIADLO C[C@H]1CN(c2ccccc2F)CC[N@H+]1Cc1cscc1Cl ZINC001308731648 1066206956 /nfs/dbraw/zinc/20/69/56/1066206956.db2.gz BZQZLTVJVFQOOV-LBPRGKRZSA-N 1 2 324.852 4.251 20 0 DIADLO C/C=C\C[C@H]([NH2+][C@@H](CC)Cc1ccc(Cl)cc1)C(=O)OCC ZINC001308740083 1066214425 /nfs/dbraw/zinc/21/44/25/1066214425.db2.gz MURXXQVPNSWMEX-FAPKFNLRSA-N 1 2 323.864 4.149 20 0 DIADLO CCc1cccc(Cl)c1C[NH+]1CC(OC)(c2ccccc2)C1 ZINC001308748644 1066221960 /nfs/dbraw/zinc/22/19/60/1066221960.db2.gz VIBWKDQWQYNMRK-UHFFFAOYSA-N 1 2 315.844 4.260 20 0 DIADLO Cc1[nH]c(CNc2cc(C(F)(F)F)c(F)cc2C)[nH+]c1C ZINC001308805664 1066282036 /nfs/dbraw/zinc/28/20/36/1066282036.db2.gz YAGZGFLFHWBDGE-UHFFFAOYSA-N 1 2 301.287 4.105 20 0 DIADLO c1ccc(CCCOC2C[NH+](Cc3cccc(C4CC4)c3)C2)cc1 ZINC001308808077 1066284058 /nfs/dbraw/zinc/28/40/58/1066284058.db2.gz KXTQHFUKMJSWGS-UHFFFAOYSA-N 1 2 321.464 4.398 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@H+](C/C=C\c1ccc(F)cc1)C1CC1 ZINC001308813492 1066288192 /nfs/dbraw/zinc/28/81/92/1066288192.db2.gz OHPFFFNPDFHKIC-GEXIGZQTSA-N 1 2 319.420 4.034 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+](C/C=C\c1ccc(F)cc1)C1CC1 ZINC001308813492 1066288202 /nfs/dbraw/zinc/28/82/02/1066288202.db2.gz OHPFFFNPDFHKIC-GEXIGZQTSA-N 1 2 319.420 4.034 20 0 DIADLO CC[C@H]([NH2+]C[C@H](C)c1cccc(Cl)c1)C(=O)OC(C)(C)C ZINC001308835227 1066311994 /nfs/dbraw/zinc/31/19/94/1066311994.db2.gz WPJNKNKOBRJOJX-WFASDCNBSA-N 1 2 311.853 4.153 20 0 DIADLO C[C@@H]([NH2+][C@@H]1C[C@H](c2ccccc2)C[C@H](C)C1)C(=O)OC(C)(C)C ZINC001308859245 1066339872 /nfs/dbraw/zinc/33/98/72/1066339872.db2.gz KRJFYWKUECQILB-IDCNUPLLSA-N 1 2 317.473 4.279 20 0 DIADLO CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]CC(F)(F)c1ccc(F)cc1 ZINC001308880377 1066360505 /nfs/dbraw/zinc/36/05/05/1066360505.db2.gz LQJVZBIBXVKLRH-CXAGYDPISA-N 1 2 323.358 4.283 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccccc2CCSC)c1C ZINC001308894060 1066376672 /nfs/dbraw/zinc/37/66/72/1066376672.db2.gz CONVSGOAUKMVBT-UHFFFAOYSA-N 1 2 316.470 4.225 20 0 DIADLO FC(F)(F)c1sccc1C[N@@H+]1CCc2ccsc2C1 ZINC001308966552 1066423691 /nfs/dbraw/zinc/42/36/91/1066423691.db2.gz YXVBAZFUSPTLKU-UHFFFAOYSA-N 1 2 303.374 4.387 20 0 DIADLO FC(F)(F)c1sccc1C[N@H+]1CCc2ccsc2C1 ZINC001308966552 1066423696 /nfs/dbraw/zinc/42/36/96/1066423696.db2.gz YXVBAZFUSPTLKU-UHFFFAOYSA-N 1 2 303.374 4.387 20 0 DIADLO c1n[nH]c([C@H]([NH2+]C[C@@H]2CCC=CCCC2)C2CCCCC2)n1 ZINC001308975476 1066427324 /nfs/dbraw/zinc/42/73/24/1066427324.db2.gz UQIUFGHKOYUYLX-NVXWUHKLSA-N 1 2 302.466 4.152 20 0 DIADLO CC[C@@H](C)[C@@H](CNc1[nH+]c2ccccc2n1C(C)(C)C)OC ZINC001308989817 1066434694 /nfs/dbraw/zinc/43/46/94/1066434694.db2.gz LSNUUZSMTBMMEM-CZUORRHYSA-N 1 2 303.450 4.264 20 0 DIADLO CC[C@@](C)(CNc1[nH+]c2ccccc2n1C1CCCC1)OC ZINC001308991013 1066434714 /nfs/dbraw/zinc/43/47/14/1066434714.db2.gz GQEJANIBQNKVSK-SFHVURJKSA-N 1 2 301.434 4.378 20 0 DIADLO COC1(CNc2[nH+]c3ccccc3n2CCC(C)C)CCCC1 ZINC001308991482 1066435497 /nfs/dbraw/zinc/43/54/97/1066435497.db2.gz WRSRMYOCBJHTHD-UHFFFAOYSA-N 1 2 315.461 4.454 20 0 DIADLO CSC1(CNc2[nH+]c3ccccc3n2CCC(C)C)CC1 ZINC001308990935 1066435603 /nfs/dbraw/zinc/43/56/03/1066435603.db2.gz CVIOHBJPCVHMDO-UHFFFAOYSA-N 1 2 303.475 4.390 20 0 DIADLO Cc1cn2cc(NC(=O)NCC[C@@H](C)CC(C)(C)C)ccc2[nH+]1 ZINC001310256823 1066505348 /nfs/dbraw/zinc/50/53/48/1066505348.db2.gz XDXYEADKVXIXQD-CYBMUJFWSA-N 1 2 316.449 4.227 20 0 DIADLO Cc1cc(NC(=O)NCC[C@H]2C[C@H](C)CC(C)(C)C2)c(C)c[nH+]1 ZINC001310450369 1066525689 /nfs/dbraw/zinc/52/56/89/1066525689.db2.gz FQOPJQSPORMBBV-BBRMVZONSA-N 1 2 317.477 4.094 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2c3ccccc3CC[C@@H]2C)c(C)[nH+]1 ZINC001310833687 1066566706 /nfs/dbraw/zinc/56/67/06/1066566706.db2.gz CWOALOUKQWIKKN-BUXKBTBVSA-N 1 2 323.440 4.452 20 0 DIADLO c1coc(-c2noc(C[N@@H+]3CCCCC[C@H]3c3ccco3)n2)c1 ZINC000076803698 185043584 /nfs/dbraw/zinc/04/35/84/185043584.db2.gz LVMHFJRCCVMGJN-ZDUSSCGKSA-N 1 2 313.357 4.040 20 0 DIADLO c1coc(-c2noc(C[N@H+]3CCCCC[C@H]3c3ccco3)n2)c1 ZINC000076803698 185043586 /nfs/dbraw/zinc/04/35/86/185043586.db2.gz LVMHFJRCCVMGJN-ZDUSSCGKSA-N 1 2 313.357 4.040 20 0 DIADLO CC[C@@H](C(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccccc1 ZINC000095552761 185379104 /nfs/dbraw/zinc/37/91/04/185379104.db2.gz JGPBVZXHYZJAON-MRXNPFEDSA-N 1 2 305.381 4.005 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1ccc2c(c1)CCCC2 ZINC000079291115 185163541 /nfs/dbraw/zinc/16/35/41/185163541.db2.gz FYSHGRKMBKKTKO-OLZOCXBDSA-N 1 2 311.429 4.238 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+]Cc2nnc(-c3ccccc3)s2)o1 ZINC000090401501 185294593 /nfs/dbraw/zinc/29/45/93/185294593.db2.gz BSIZINZZMBOELW-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1nc(C3CC3)cs1)CCCO2 ZINC000090459855 185297524 /nfs/dbraw/zinc/29/75/24/185297524.db2.gz UWSOUCFNMCQSPE-AWEZNQCLSA-N 1 2 318.417 4.163 20 0 DIADLO CC(C)(C)[C@H]([NH2+]Cc1ncn(-c2ccccc2)n1)c1ccccc1 ZINC000092802992 185342341 /nfs/dbraw/zinc/34/23/41/185342341.db2.gz GGQHAMCNSHPEAW-LJQANCHMSA-N 1 2 320.440 4.144 20 0 DIADLO Cc1cc(NC(=O)C[C@H](c2ccccc2)C(F)(F)F)cc[nH+]1 ZINC000103186457 185437243 /nfs/dbraw/zinc/43/72/43/185437243.db2.gz KKGMHOKYSCUJER-CQSZACIVSA-N 1 2 308.303 4.065 20 0 DIADLO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1nccn1C(C)C ZINC000425506330 334954249 /nfs/dbraw/zinc/95/42/49/334954249.db2.gz CHBQKLDZJDGDCX-UHFFFAOYSA-N 1 2 321.852 4.151 20 0 DIADLO COc1ccccc1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000078651601 191905132 /nfs/dbraw/zinc/90/51/32/191905132.db2.gz XRETUJCVQROBDF-UHFFFAOYSA-N 1 2 320.348 4.135 20 0 DIADLO Cc1noc(C)c1C[N@H+](Cc1cccc(C)c1)Cc1ccccn1 ZINC000081012378 192215105 /nfs/dbraw/zinc/21/51/05/192215105.db2.gz WRWCIXDHYARPDR-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1noc(C)c1C[N@@H+](Cc1cccc(C)c1)Cc1ccccn1 ZINC000081012378 192215107 /nfs/dbraw/zinc/21/51/07/192215107.db2.gz WRWCIXDHYARPDR-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Fc1ccc(C[NH2+]C2(c3nccs3)CCCC2)c(Cl)c1 ZINC000081594894 192299103 /nfs/dbraw/zinc/29/91/03/192299103.db2.gz SVFQHLQBWPUOJN-UHFFFAOYSA-N 1 2 310.825 4.495 20 0 DIADLO CC(C)c1cc(NCc2nccc(C(F)F)n2)nc(C(C)C)[nH+]1 ZINC000288148296 535370066 /nfs/dbraw/zinc/37/00/66/535370066.db2.gz GLZHVVGLVOKDLT-UHFFFAOYSA-N 1 2 321.375 4.063 20 0 DIADLO CCc1ccc(N[C@@H](c2[nH]cc[nH+]2)c2cccnc2)cc1CC ZINC000195102049 201340040 /nfs/dbraw/zinc/34/00/40/201340040.db2.gz HUPDETLZJYQREM-GOSISDBHSA-N 1 2 306.413 4.131 20 0 DIADLO Cc1ccc(C[C@H]([NH2+][C@@H](C)c2nccs2)c2ccccn2)cc1 ZINC000091725241 193097708 /nfs/dbraw/zinc/09/77/08/193097708.db2.gz DXQBJQSODOSKLE-YJBOKZPZSA-N 1 2 323.465 4.481 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nccs1)c1nc(C(F)(F)F)cs1 ZINC000091731810 193098952 /nfs/dbraw/zinc/09/89/52/193098952.db2.gz NFSWSLALKLTOPP-YUMQZZPRSA-N 1 2 321.393 4.420 20 0 DIADLO Cc1cc(C)n(-c2cccc(NCCCc3c[nH+]ccc3C)c2)n1 ZINC000563779542 335006191 /nfs/dbraw/zinc/00/61/91/335006191.db2.gz QEWLHHLRGOWWQO-UHFFFAOYSA-N 1 2 320.440 4.237 20 0 DIADLO CC(C)CCOc1ccccc1C[NH2+][C@H](C)c1nccs1 ZINC000093404082 193244298 /nfs/dbraw/zinc/24/42/98/193244298.db2.gz GJKZQPLLHKJUIJ-CQSZACIVSA-N 1 2 304.459 4.419 20 0 DIADLO Cc1cncc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)c1 ZINC000442679493 335014023 /nfs/dbraw/zinc/01/40/23/335014023.db2.gz MMHHCSKTKOJCKO-GOSISDBHSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1cncc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)c1 ZINC000442679493 335014025 /nfs/dbraw/zinc/01/40/25/335014025.db2.gz MMHHCSKTKOJCKO-GOSISDBHSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)[C@H]2CCCCO2)c1C(C)C ZINC000191955696 335018693 /nfs/dbraw/zinc/01/86/93/335018693.db2.gz OQHQHTINWJZGPE-MRXNPFEDSA-N 1 2 312.413 4.174 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)s1)c1nc(C(C)(C)C)no1 ZINC000193114283 335042932 /nfs/dbraw/zinc/04/29/32/335042932.db2.gz HARFIRDNYVSUHJ-DTWKUNHWSA-N 1 2 313.854 4.494 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1nccn1CC(F)(F)F ZINC000057873170 184059794 /nfs/dbraw/zinc/05/97/94/184059794.db2.gz DPYZZQHVWRVDLD-HNNXBMFYSA-N 1 2 323.362 4.091 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1nccn1CC(F)(F)F ZINC000057873170 184059796 /nfs/dbraw/zinc/05/97/96/184059796.db2.gz DPYZZQHVWRVDLD-HNNXBMFYSA-N 1 2 323.362 4.091 20 0 DIADLO Cc1cc(NC(=O)Nc2cccc(CC(F)(F)F)c2)cc[nH+]1 ZINC000119708793 195023937 /nfs/dbraw/zinc/02/39/37/195023937.db2.gz CDLVBYQBDRQRRS-UHFFFAOYSA-N 1 2 309.291 4.139 20 0 DIADLO Cc1cc(NC(=O)N(C)[C@@H](C)c2cccc(Cl)c2)cc[nH+]1 ZINC000120011976 195080671 /nfs/dbraw/zinc/08/06/71/195080671.db2.gz ILGSKSIEGPZLIU-LBPRGKRZSA-N 1 2 303.793 4.268 20 0 DIADLO Cc1ccc(NC(=O)N[C@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000152402574 335057507 /nfs/dbraw/zinc/05/75/07/335057507.db2.gz MLTMUNKCMKNKBJ-LLVKDONJSA-N 1 2 303.793 4.235 20 0 DIADLO Cc1nn(C)cc1[C@@H](C)[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000272301758 130019351 /nfs/dbraw/zinc/01/93/51/130019351.db2.gz RKNYXWGFATXRNS-SNVBAGLBSA-N 1 2 324.255 4.375 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2nnc(C(C)(C)C)s2)cc1C ZINC000272818752 130066542 /nfs/dbraw/zinc/06/65/42/130066542.db2.gz CSAGQYRQPZAFNE-GFCCVEGCSA-N 1 2 319.474 4.003 20 0 DIADLO Cc1cccc([C@H]2CCN(C(=O)Nc3ccc(C)[nH+]c3C)C2)c1 ZINC000273220073 130098459 /nfs/dbraw/zinc/09/84/59/130098459.db2.gz KWXYDOUNJOFEJZ-KRWDZBQOSA-N 1 2 309.413 4.028 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](c2ccccc2F)C2CCCC2)s1 ZINC000273238492 130100298 /nfs/dbraw/zinc/10/02/98/130100298.db2.gz XDEIFIUFQLTEIF-QGZVFWFLSA-N 1 2 319.449 4.261 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2ccn(C(CC)CC)n2)cs1 ZINC000273389211 130115473 /nfs/dbraw/zinc/11/54/73/130115473.db2.gz OOMKKIKHVYJYBV-LBPRGKRZSA-N 1 2 306.479 4.114 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)s1 ZINC000273622127 130146558 /nfs/dbraw/zinc/14/65/58/130146558.db2.gz QRSNKSIXMUUFGJ-NSHDSACASA-N 1 2 315.364 4.136 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+]2CCC[C@H]2c2ccc[nH]2)s1 ZINC000273622127 130146561 /nfs/dbraw/zinc/14/65/61/130146561.db2.gz QRSNKSIXMUUFGJ-NSHDSACASA-N 1 2 315.364 4.136 20 0 DIADLO Cc1nnc(C[NH2+]C(c2ccccc2C)c2ccccc2C)s1 ZINC000273685735 130154150 /nfs/dbraw/zinc/15/41/50/130154150.db2.gz AQEYFCYKZOEXAD-UHFFFAOYSA-N 1 2 323.465 4.343 20 0 DIADLO CC[C@H]([NH2+]Cc1cn2ccsc2n1)c1cccc(Cl)c1F ZINC000274048481 130200240 /nfs/dbraw/zinc/20/02/40/130200240.db2.gz KSIAGTASAHQHTF-ZDUSSCGKSA-N 1 2 323.824 4.429 20 0 DIADLO Cc1cc(Cl)ccc1C[NH2+]Cc1nnc(C(C)(C)C)s1 ZINC000274298055 130224674 /nfs/dbraw/zinc/22/46/74/130224674.db2.gz NAKYDNIMVNVPFL-UHFFFAOYSA-N 1 2 309.866 4.087 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(F)c1)c1nc(C(F)(F)F)cs1 ZINC000274676352 130253419 /nfs/dbraw/zinc/25/34/19/130253419.db2.gz YYMARFHPERAYSW-MRVPVSSYSA-N 1 2 304.312 4.152 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1)c1nc(C(F)(F)F)cs1 ZINC000274666971 130253985 /nfs/dbraw/zinc/25/39/85/130253985.db2.gz XFGBJGSQHVSVRN-SSDOTTSWSA-N 1 2 322.302 4.291 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cc(F)cc(Cl)c1)c1nc(C2CC2)no1 ZINC000274940866 130276154 /nfs/dbraw/zinc/27/61/54/130276154.db2.gz BCEWFZQZEGNDFK-AWEZNQCLSA-N 1 2 323.799 4.226 20 0 DIADLO Cn1cc[nH+]c1[C@H](Nc1ccc2oc(C3CC3)nc2c1)C1CC1 ZINC000275031120 130284123 /nfs/dbraw/zinc/28/41/23/130284123.db2.gz FQVRDPFMJMUBRD-MRXNPFEDSA-N 1 2 308.385 4.002 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1ncc(-c2ccc(Cl)cc2)o1 ZINC000275198381 130297821 /nfs/dbraw/zinc/29/78/21/130297821.db2.gz QBPCAYGIKQJQLK-WDEREUQCSA-N 1 2 316.792 4.130 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(Oc2ccccc2)cc1)c1ncn(C)n1 ZINC000275709908 130368953 /nfs/dbraw/zinc/36/89/53/130368953.db2.gz LXQTZGVFRHNYJJ-HUUCEWRRSA-N 1 2 322.412 4.019 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(C2CCCCC2)cc1)c1ncn(C)n1 ZINC000275802865 130389394 /nfs/dbraw/zinc/38/93/94/130389394.db2.gz YSTSHZGNNCTABF-GJZGRUSLSA-N 1 2 312.461 4.275 20 0 DIADLO Fc1ccc([C@@H](CC(F)(F)F)[NH2+]Cc2ccc(F)cn2)cc1 ZINC000276158559 130448525 /nfs/dbraw/zinc/44/85/25/130448525.db2.gz CVZIZDIXGUDPDI-CQSZACIVSA-N 1 2 316.273 4.143 20 0 DIADLO FC(F)c1cccc(C[N@@H+]2CCO[C@H](c3ccsc3)C2)c1 ZINC000279801331 130764111 /nfs/dbraw/zinc/76/41/11/130764111.db2.gz WIFIGJNBPTYZKG-HNNXBMFYSA-N 1 2 309.381 4.259 20 0 DIADLO FC(F)c1cccc(C[N@H+]2CCO[C@H](c3ccsc3)C2)c1 ZINC000279801331 130764112 /nfs/dbraw/zinc/76/41/12/130764112.db2.gz WIFIGJNBPTYZKG-HNNXBMFYSA-N 1 2 309.381 4.259 20 0 DIADLO Cc1cc([C@H](C)Nc2cccc([NH+]3CCCCCC3)c2)nn1C ZINC000282678696 130934933 /nfs/dbraw/zinc/93/49/33/130934933.db2.gz JOYUENFLISBMLG-INIZCTEOSA-N 1 2 312.461 4.282 20 0 DIADLO Cc1noc(C(C)(C)[NH2+]Cc2cccc(-c3ccccc3C)c2)n1 ZINC000283999934 131040216 /nfs/dbraw/zinc/04/02/16/131040216.db2.gz MKMBDRDWDGFOOT-UHFFFAOYSA-N 1 2 321.424 4.378 20 0 DIADLO CCCc1cc(=O)[nH]c(C(=Cc2cn3cc(C)ccc3[nH+]2)CC)n1 ZINC000284069942 131045799 /nfs/dbraw/zinc/04/57/99/131045799.db2.gz KAPZZDCQYOZMPE-ZROIWOOFSA-N 1 2 322.412 4.041 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](COc2ccccc2)c2ccccc2)no1 ZINC000284963134 131126210 /nfs/dbraw/zinc/12/62/10/131126210.db2.gz FMPGLABKYFEMDR-OXJNMPFZSA-N 1 2 322.408 4.454 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1ccncc1F ZINC000340206567 131172495 /nfs/dbraw/zinc/17/24/95/131172495.db2.gz OSSHXDMSRLTKFV-KUHUBIRLSA-N 1 2 307.372 4.056 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(F)c(F)c(F)c1)c1c(F)cncc1F ZINC000285729146 131196933 /nfs/dbraw/zinc/19/69/33/131196933.db2.gz QSMMRIZNUXYWGQ-JGVFFNPUSA-N 1 2 316.273 4.189 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1nc2c(s1)CCCC2 ZINC000285745252 131198810 /nfs/dbraw/zinc/19/88/10/131198810.db2.gz RPILMHGJNGAANB-VHSXEESVSA-N 1 2 323.412 4.107 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@H+](Cc1ccco1)C(C)C ZINC000340216264 131210474 /nfs/dbraw/zinc/21/04/74/131210474.db2.gz WPJUNYOYFVHPMO-UHFFFAOYSA-N 1 2 315.392 4.199 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@@H+](Cc1ccco1)C(C)C ZINC000340216264 131210476 /nfs/dbraw/zinc/21/04/76/131210476.db2.gz WPJUNYOYFVHPMO-UHFFFAOYSA-N 1 2 315.392 4.199 20 0 DIADLO COc1cc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)cc(OC)c1 ZINC000286215890 131224931 /nfs/dbraw/zinc/22/49/31/131224931.db2.gz SBXNAFIUUZRZCW-KRWDZBQOSA-N 1 2 315.417 4.160 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ccc2occc2c1)c1nc(C2CC2)no1 ZINC000286617007 131243121 /nfs/dbraw/zinc/24/31/21/131243121.db2.gz RVYCTEPJATYPKV-MRXNPFEDSA-N 1 2 311.385 4.180 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@@H](C)c2nccn2-c2ccccc2)o1 ZINC000287053919 131261696 /nfs/dbraw/zinc/26/16/96/131261696.db2.gz NBZXZBMXKMQPFG-GJZGRUSLSA-N 1 2 309.413 4.440 20 0 DIADLO Cn1cc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)c(C(F)F)n1 ZINC000287082779 131263005 /nfs/dbraw/zinc/26/30/05/131263005.db2.gz WNZRPLHBQVCPPH-CYBMUJFWSA-N 1 2 311.401 4.002 20 0 DIADLO Cn1cc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)c(C(F)F)n1 ZINC000287082779 131263006 /nfs/dbraw/zinc/26/30/06/131263006.db2.gz WNZRPLHBQVCPPH-CYBMUJFWSA-N 1 2 311.401 4.002 20 0 DIADLO OCCC[C@H](Nc1[nH+]ccc2ccc(F)cc21)c1ccccc1 ZINC000340252387 131277536 /nfs/dbraw/zinc/27/75/36/131277536.db2.gz DDDMPOFCPHTFBC-SFHVURJKSA-N 1 2 310.372 4.300 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@H](C)C[C@H]1c1ccco1 ZINC000287400852 131278725 /nfs/dbraw/zinc/27/87/25/131278725.db2.gz DMOLOJWTCKCUOF-WFASDCNBSA-N 1 2 313.401 4.297 20 0 DIADLO COc1ccc(OC)c(CNc2[nH+]ccc3ccc(F)cc32)c1 ZINC000340254674 131279138 /nfs/dbraw/zinc/27/91/38/131279138.db2.gz LSWQFYFQOYXRNG-UHFFFAOYSA-N 1 2 312.344 4.003 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](C)c1ccc(F)cc1Cl ZINC000287470902 131282247 /nfs/dbraw/zinc/28/22/47/131282247.db2.gz JLGIEMOBHHGDCE-SNVBAGLBSA-N 1 2 321.783 4.374 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCSc2ccccc21 ZINC000287490636 131282951 /nfs/dbraw/zinc/28/29/51/131282951.db2.gz KVDPRZSQYFKXML-CQSZACIVSA-N 1 2 313.426 4.057 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N([C@H](C)c1ccccc1)C1CC1 ZINC000287494942 131283405 /nfs/dbraw/zinc/28/34/05/131283405.db2.gz LDJIZRCFKLLLID-OAHLLOKOSA-N 1 2 309.413 4.456 20 0 DIADLO CCN(C(=O)Nc1c(C)cc[nH+]c1C)[C@H](C)c1cccc(O)c1 ZINC000287508011 131284106 /nfs/dbraw/zinc/28/41/06/131284106.db2.gz LXVNDROZANSORT-CQSZACIVSA-N 1 2 313.401 4.019 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@H]1C1CCCCC1 ZINC000287529653 131284703 /nfs/dbraw/zinc/28/47/03/131284703.db2.gz NKLUUUHWVSXFTO-INIZCTEOSA-N 1 2 301.434 4.275 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1Cc2ccccc2C(C)(C)C1 ZINC000287660320 131293777 /nfs/dbraw/zinc/29/37/77/131293777.db2.gz WXCQHXHVULVVMV-UHFFFAOYSA-N 1 2 309.413 4.024 20 0 DIADLO CCc1oc2ccccc2c1C[NH2+]Cc1noc2c1CCCC2 ZINC000288400000 131323934 /nfs/dbraw/zinc/32/39/34/131323934.db2.gz HWWMEONXPDAFBV-UHFFFAOYSA-N 1 2 310.397 4.152 20 0 DIADLO CCCCOc1ccccc1C[NH2+]Cc1noc2c1CCCC2 ZINC000288453265 131326065 /nfs/dbraw/zinc/32/60/65/131326065.db2.gz NFMYYOPQTWPARL-UHFFFAOYSA-N 1 2 314.429 4.022 20 0 DIADLO C[C@@H]1CC=CC[C@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000288851814 131341797 /nfs/dbraw/zinc/34/17/97/131341797.db2.gz AGGKFUAGEZLVIY-RHSMWYFYSA-N 1 2 320.396 4.051 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)N(C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000288898435 131344404 /nfs/dbraw/zinc/34/44/04/131344404.db2.gz RWSRBJQRFGPPOY-KRWDZBQOSA-N 1 2 313.401 4.014 20 0 DIADLO Cc1cc(-c2nc(Cn3c4ccccc4[nH+]c3C(C)C)no2)co1 ZINC000288934987 131346383 /nfs/dbraw/zinc/34/63/83/131346383.db2.gz AJXPNWZXFDAUBS-UHFFFAOYSA-N 1 2 322.368 4.159 20 0 DIADLO CC(C)n1cc(C[N@H+](C)C2c3ccccc3-c3ccccc32)nn1 ZINC000289244999 131368616 /nfs/dbraw/zinc/36/86/16/131368616.db2.gz AZLYCLATPXUUGB-UHFFFAOYSA-N 1 2 318.424 4.061 20 0 DIADLO CC(C)n1cc(C[N@@H+](C)C2c3ccccc3-c3ccccc32)nn1 ZINC000289244999 131368618 /nfs/dbraw/zinc/36/86/18/131368618.db2.gz AZLYCLATPXUUGB-UHFFFAOYSA-N 1 2 318.424 4.061 20 0 DIADLO FC(F)c1ccnc(C[NH2+]Cc2ccc(C3CCCC3)cc2)n1 ZINC000291011213 131535565 /nfs/dbraw/zinc/53/55/65/131535565.db2.gz FBVOWYUFTJUKLI-UHFFFAOYSA-N 1 2 317.383 4.362 20 0 DIADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ccnc(Cl)c1Cl ZINC000291668572 131590680 /nfs/dbraw/zinc/59/06/80/131590680.db2.gz WBDDVZAWHIROOS-YMTOWFKASA-N 1 2 309.196 4.000 20 0 DIADLO Cc1ccc(C)n1C1CC[NH+](Cc2csc(Cl)n2)CC1 ZINC000297169136 132002830 /nfs/dbraw/zinc/00/28/30/132002830.db2.gz PKZHJJKDUCLYQI-UHFFFAOYSA-N 1 2 309.866 4.052 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1[C@H](C)C[C@H](c2ccccc2)[C@H]1C ZINC000297197427 132003625 /nfs/dbraw/zinc/00/36/25/132003625.db2.gz XQIIWAGUPPAZID-KYJSFNMBSA-N 1 2 323.440 4.497 20 0 DIADLO COCC[N@H+](Cc1csc(Cl)n1)[C@H](C)c1ccccc1 ZINC000297276338 132007205 /nfs/dbraw/zinc/00/72/05/132007205.db2.gz XCKHBXOYHOAGKL-GFCCVEGCSA-N 1 2 310.850 4.006 20 0 DIADLO COCC[N@@H+](Cc1csc(Cl)n1)[C@H](C)c1ccccc1 ZINC000297276338 132007207 /nfs/dbraw/zinc/00/72/07/132007207.db2.gz XCKHBXOYHOAGKL-GFCCVEGCSA-N 1 2 310.850 4.006 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CNc1ccccc1C[S@@](C)=O ZINC000297573472 132023555 /nfs/dbraw/zinc/02/35/55/132023555.db2.gz GUVGRQOYIWJLSX-JOCHJYFZSA-N 1 2 316.470 4.004 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@@H]1C[C@@H](C)n2ccnc21 ZINC000297646106 132026710 /nfs/dbraw/zinc/02/67/10/132026710.db2.gz JZHGSLQIHXPTRS-HLLBOEOZSA-N 1 2 313.445 4.164 20 0 DIADLO Cc1ccc(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)c(OC(C)(C)C)c1 ZINC000297834133 132036018 /nfs/dbraw/zinc/03/60/18/132036018.db2.gz SAFKQOORAOSABO-GOEBONIOSA-N 1 2 313.445 4.164 20 0 DIADLO FC1(F)CC(CNc2cccc3c2CN(c2cccc[nH+]2)C3)C1 ZINC000297938535 132041520 /nfs/dbraw/zinc/04/15/20/132041520.db2.gz XZXNTXAPQRANIJ-UHFFFAOYSA-N 1 2 315.367 4.059 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@@H+]2Cc2cc(COC)on2)o1 ZINC000297990229 132043104 /nfs/dbraw/zinc/04/31/04/132043104.db2.gz YRFHTKFNFCTDMW-KRWDZBQOSA-N 1 2 318.417 4.094 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@H+]2Cc2cc(COC)on2)o1 ZINC000297990229 132043105 /nfs/dbraw/zinc/04/31/05/132043105.db2.gz YRFHTKFNFCTDMW-KRWDZBQOSA-N 1 2 318.417 4.094 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000298198414 132050274 /nfs/dbraw/zinc/05/02/74/132050274.db2.gz VQZPTCHZRQABLX-OAHLLOKOSA-N 1 2 305.809 4.087 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2ncc(C(C)(C)C)o2)cc1 ZINC000298274269 132053979 /nfs/dbraw/zinc/05/39/79/132053979.db2.gz JDBVQGSRWHECLB-CYBMUJFWSA-N 1 2 302.418 4.174 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2ncc(C(C)(C)C)o2)cc1 ZINC000298274269 132053980 /nfs/dbraw/zinc/05/39/80/132053980.db2.gz JDBVQGSRWHECLB-CYBMUJFWSA-N 1 2 302.418 4.174 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccccc1OC(F)F ZINC000298526685 132067070 /nfs/dbraw/zinc/06/70/70/132067070.db2.gz XZNULNFJSOPBIW-NSHDSACASA-N 1 2 324.371 4.424 20 0 DIADLO CCC[C@H]([NH2+]Cc1nc(=O)c2sccc2[nH]1)c1ccccc1 ZINC000298789520 132077276 /nfs/dbraw/zinc/07/72/76/132077276.db2.gz DHXCPHXJSZYBDD-ZDUSSCGKSA-N 1 2 313.426 4.028 20 0 DIADLO Cc1cc(-c2noc([C@H](C)[NH2+]Cc3ccsc3)n2)ccc1F ZINC000298886791 132082083 /nfs/dbraw/zinc/08/20/83/132082083.db2.gz SEMTUAQWXOKCGH-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO CCC[N@H+](Cc1nc(C)c(C)o1)[C@@H](C)c1ccccc1OC ZINC000299344243 132099745 /nfs/dbraw/zinc/09/97/45/132099745.db2.gz ARSNXWGLWVCNTC-AWEZNQCLSA-N 1 2 302.418 4.273 20 0 DIADLO CCC[N@@H+](Cc1nc(C)c(C)o1)[C@@H](C)c1ccccc1OC ZINC000299344243 132099747 /nfs/dbraw/zinc/09/97/47/132099747.db2.gz ARSNXWGLWVCNTC-AWEZNQCLSA-N 1 2 302.418 4.273 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000299339875 132100190 /nfs/dbraw/zinc/10/01/90/132100190.db2.gz ACVHYQAMLPOZCD-OAHLLOKOSA-N 1 2 321.424 4.148 20 0 DIADLO Clc1ccc(C2([NH2+]Cc3nc(C4CC4)no3)CC2)cc1Cl ZINC000299394663 132103340 /nfs/dbraw/zinc/10/33/40/132103340.db2.gz WJUFQYPEPHSIDJ-UHFFFAOYSA-N 1 2 324.211 4.033 20 0 DIADLO Cc1nnc(C[N@H+](Cc2ccccc2)[C@@H](C)c2cccs2)o1 ZINC000299442623 132105593 /nfs/dbraw/zinc/10/55/93/132105593.db2.gz XFYARVZJJDGUKT-ZDUSSCGKSA-N 1 2 313.426 4.203 20 0 DIADLO Cc1nnc(C[N@@H+](Cc2ccccc2)[C@@H](C)c2cccs2)o1 ZINC000299442623 132105595 /nfs/dbraw/zinc/10/55/95/132105595.db2.gz XFYARVZJJDGUKT-ZDUSSCGKSA-N 1 2 313.426 4.203 20 0 DIADLO C[C@@H](c1nc2ccccc2n1C(F)F)[N@H+](C)Cc1cccnc1 ZINC000299732759 132116483 /nfs/dbraw/zinc/11/64/83/132116483.db2.gz XYTGBSBLRYWEBV-LBPRGKRZSA-N 1 2 316.355 4.019 20 0 DIADLO C[C@@H](c1nc2ccccc2n1C(F)F)[N@@H+](C)Cc1cccnc1 ZINC000299732759 132116484 /nfs/dbraw/zinc/11/64/84/132116484.db2.gz XYTGBSBLRYWEBV-LBPRGKRZSA-N 1 2 316.355 4.019 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2cc(Cl)cc(Cl)c2)cs1 ZINC000340661003 132122386 /nfs/dbraw/zinc/12/23/86/132122386.db2.gz JSCWJFUJJWWXNB-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2cc(Cl)cc(Cl)c2)cs1 ZINC000340661003 132122387 /nfs/dbraw/zinc/12/23/87/132122387.db2.gz JSCWJFUJJWWXNB-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cn1c2ccc(NC(=O)CC3=CCCCC3)cc2[nH+]c1C1CC1 ZINC000340670186 132139850 /nfs/dbraw/zinc/13/98/50/132139850.db2.gz XASJLBFEUAVKIA-UHFFFAOYSA-N 1 2 309.413 4.280 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccccc2)Cc2ccccc2C)nc1 ZINC000340671970 132140615 /nfs/dbraw/zinc/14/06/15/132140615.db2.gz GOGGDRZXYITGBT-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccccc2)Cc2ccccc2C)nc1 ZINC000340671970 132140616 /nfs/dbraw/zinc/14/06/16/132140616.db2.gz GOGGDRZXYITGBT-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO Cc1cnc(C[N@@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)nc1 ZINC000340690572 132158096 /nfs/dbraw/zinc/15/80/96/132158096.db2.gz VSWRAVBLPASPNR-CYBMUJFWSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1cnc(C[N@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)nc1 ZINC000340690572 132158098 /nfs/dbraw/zinc/15/80/98/132158098.db2.gz VSWRAVBLPASPNR-CYBMUJFWSA-N 1 2 301.821 4.164 20 0 DIADLO Fc1ccccc1[C@H]1C[N@H+](Cc2coc3ccccc23)CCO1 ZINC000514099351 335073009 /nfs/dbraw/zinc/07/30/09/335073009.db2.gz NKLXSHMQNFDEHQ-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccccc1[C@H]1C[N@@H+](Cc2coc3ccccc23)CCO1 ZINC000514099351 335073010 /nfs/dbraw/zinc/07/30/10/335073010.db2.gz NKLXSHMQNFDEHQ-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO CCCC(=O)Nc1cccc(CNc2cc(C)[nH+]c(C3CC3)n2)c1 ZINC000604756913 435338069 /nfs/dbraw/zinc/33/80/69/435338069.db2.gz DFDXJDSKCQFTLL-UHFFFAOYSA-N 1 2 324.428 4.013 20 0 DIADLO CCO[C@@H]1C[C@H](Nc2ccc3cc(OC)ccc3[nH+]2)C12CCC2 ZINC000608088374 435350722 /nfs/dbraw/zinc/35/07/22/435350722.db2.gz OTSLWLIKPPBHOI-DLBZAZTESA-N 1 2 312.413 4.003 20 0 DIADLO CCO[C@@H](C)c1nc(C[NH+]2CCC(C(F)(F)F)CC2)cs1 ZINC000174180537 332847716 /nfs/dbraw/zinc/84/77/16/332847716.db2.gz BJQBRZYHSHKTDB-JTQLQIEISA-N 1 2 322.396 4.015 20 0 DIADLO CC[C@@H](C)Oc1ccc(C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000175726863 332905119 /nfs/dbraw/zinc/90/51/19/332905119.db2.gz DCNGOUTUIOBIHC-CQSZACIVSA-N 1 2 312.413 4.436 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)C(=O)C2(C)CCCCCC2)c1C ZINC000180639694 331574749 /nfs/dbraw/zinc/57/47/49/331574749.db2.gz YFHSHSNSLYWOFO-UHFFFAOYSA-N 1 2 318.461 4.026 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCSc2ccc(Cl)cc21)c1csnn1 ZINC000398245561 331602850 /nfs/dbraw/zinc/60/28/50/331602850.db2.gz ITOXREFTQBOHFZ-LDYMZIIASA-N 1 2 311.863 4.079 20 0 DIADLO C[C@H]([NH2+][C@H]1CCSc2ccc(Cl)cc21)c1csnn1 ZINC000398245559 331603025 /nfs/dbraw/zinc/60/30/25/331603025.db2.gz ITOXREFTQBOHFZ-KWQFWETISA-N 1 2 311.863 4.079 20 0 DIADLO Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+][C@@H](C)c1csnn1 ZINC000398265301 331603517 /nfs/dbraw/zinc/60/35/17/331603517.db2.gz CATFKTDAJJAQCB-DTWKUNHWSA-N 1 2 310.492 4.012 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1Cl)c1csnn1 ZINC000398291739 331604973 /nfs/dbraw/zinc/60/49/73/331604973.db2.gz CMOIPCNVRIWUFW-HTQZYQBOSA-N 1 2 302.230 4.257 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)Nc1cc[nH+]c2ccncc12 ZINC000530776342 331624954 /nfs/dbraw/zinc/62/49/54/331624954.db2.gz DJFNVLHJXWXDEF-CQSZACIVSA-N 1 2 307.397 4.012 20 0 DIADLO COc1ccc(C2([NH2+]Cc3coc(-c4ccccc4)n3)CC2)cc1 ZINC000530774238 331625236 /nfs/dbraw/zinc/62/52/36/331625236.db2.gz WAFAMZMVEVPXRK-UHFFFAOYSA-N 1 2 320.392 4.129 20 0 DIADLO Cc1nc([C@H](C)[NH+]2CCC(C)(c3cccc(Cl)c3)CC2)no1 ZINC000517441736 331691208 /nfs/dbraw/zinc/69/12/08/331691208.db2.gz DFFQIZIOLOZGDI-LBPRGKRZSA-N 1 2 319.836 4.146 20 0 DIADLO Cn1c2ccc(NC(=O)[C@H]3CC=CCC3)cc2[nH+]c1C(C)(C)C ZINC000536319855 331696718 /nfs/dbraw/zinc/69/67/18/331696718.db2.gz LXYFUJVAYPDTRP-ZDUSSCGKSA-N 1 2 311.429 4.166 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(-c2ccc(Cl)cc2)n1)c1cn[nH]c1 ZINC000533801745 331698422 /nfs/dbraw/zinc/69/84/22/331698422.db2.gz IVODTEUPBFCHIB-SNVBAGLBSA-N 1 2 318.833 4.037 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(SC(C)C)cc2)c(C)[nH+]1 ZINC000176192877 332928056 /nfs/dbraw/zinc/92/80/56/332928056.db2.gz KHMRBDROPHWYGL-UHFFFAOYSA-N 1 2 300.427 4.451 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCN(c3cccc[nH+]3)C2)c1 ZINC000557682464 331808354 /nfs/dbraw/zinc/80/83/54/331808354.db2.gz MFBJTMWKVBGEIN-CQSZACIVSA-N 1 2 306.331 4.484 20 0 DIADLO COc1cc(C)[nH+]c(CNc2cc(C)ccc2Br)c1 ZINC000214111604 331809847 /nfs/dbraw/zinc/80/98/47/331809847.db2.gz XQMMILHMSKQDHJ-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]Cc2cnc(C3CCCCC3)s2)c2nccn21 ZINC000584212726 331869186 /nfs/dbraw/zinc/86/91/86/331869186.db2.gz PBZPPHXLZLNEPB-SWLSCSKDSA-N 1 2 316.474 4.183 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)cs1 ZINC000517863139 331974777 /nfs/dbraw/zinc/97/47/77/331974777.db2.gz VMIRQHWSLBPBGB-RHSMWYFYSA-N 1 2 311.454 4.230 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2cccc(F)c2Cl)o1 ZINC000559148964 331982309 /nfs/dbraw/zinc/98/23/09/331982309.db2.gz ACILGBHCDMVDTN-AWEZNQCLSA-N 1 2 311.784 4.112 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@H](c2ccccc2)c2ccccn2)c1 ZINC000559233952 331997516 /nfs/dbraw/zinc/99/75/16/331997516.db2.gz IMXKHWYBICQTJY-HXUWFJFHSA-N 1 2 322.383 4.109 20 0 DIADLO CC(=O)c1cc(Cl)ccc1OCc1cn2cccc(C)c2[nH+]1 ZINC000559243444 332001113 /nfs/dbraw/zinc/00/11/13/332001113.db2.gz FZVFTDOAXUWUMF-UHFFFAOYSA-N 1 2 314.772 4.078 20 0 DIADLO COc1c(C)cnc(C[N@H+](C)[C@@H](C)c2ccccc2F)c1C ZINC000409447074 332031113 /nfs/dbraw/zinc/03/11/13/332031113.db2.gz ZRSUQJHIIXVZIC-AWEZNQCLSA-N 1 2 302.393 4.039 20 0 DIADLO COc1c(C)cnc(C[N@@H+](C)[C@@H](C)c2ccccc2F)c1C ZINC000409447074 332031114 /nfs/dbraw/zinc/03/11/14/332031114.db2.gz ZRSUQJHIIXVZIC-AWEZNQCLSA-N 1 2 302.393 4.039 20 0 DIADLO Clc1cc(C[NH2+]Cc2noc3c2CCCC3)c(Cl)s1 ZINC000449327784 332039093 /nfs/dbraw/zinc/03/90/93/332039093.db2.gz GGYNZRFKZRUTBZ-UHFFFAOYSA-N 1 2 317.241 4.212 20 0 DIADLO Cn1c2c(cccc2F)[nH+]c1N1CCC(c2ccsc2)CC1 ZINC000409642230 332041831 /nfs/dbraw/zinc/04/18/31/332041831.db2.gz RWRKBHZGQVEVIB-UHFFFAOYSA-N 1 2 315.417 4.158 20 0 DIADLO COc1cccc2c(N[C@H]3CCCC34CCOCC4)cc[nH+]c12 ZINC000409675426 332046742 /nfs/dbraw/zinc/04/67/42/332046742.db2.gz KIPWNKBWWBGXRJ-KRWDZBQOSA-N 1 2 312.413 4.005 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1csc(Nc2ccccc2)n1 ZINC000091703641 332110760 /nfs/dbraw/zinc/11/07/60/332110760.db2.gz TVCCLCXMOYQFQT-CQSZACIVSA-N 1 2 324.453 4.475 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1csc(Nc2ccccc2)n1 ZINC000091703641 332110761 /nfs/dbraw/zinc/11/07/61/332110761.db2.gz TVCCLCXMOYQFQT-CQSZACIVSA-N 1 2 324.453 4.475 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCO[C@@H](c3ccsc3)C2)cc1F ZINC000569529796 332126858 /nfs/dbraw/zinc/12/68/58/332126858.db2.gz BCEJGJZZZLFGOD-WZHGYECESA-N 1 2 321.392 4.113 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCO[C@@H](c3ccsc3)C2)cc1F ZINC000569529796 332126859 /nfs/dbraw/zinc/12/68/59/332126859.db2.gz BCEJGJZZZLFGOD-WZHGYECESA-N 1 2 321.392 4.113 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2cncs2)s1 ZINC000092536762 332128246 /nfs/dbraw/zinc/12/82/46/332128246.db2.gz CJFSCCRKQHCBGV-UHFFFAOYSA-N 1 2 304.440 4.308 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2cncs2)s1 ZINC000092536762 332128247 /nfs/dbraw/zinc/12/82/47/332128247.db2.gz CJFSCCRKQHCBGV-UHFFFAOYSA-N 1 2 304.440 4.308 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1nc2ccccc2o1 ZINC000569566864 332140687 /nfs/dbraw/zinc/14/06/87/332140687.db2.gz TWGPACYRHNBDKM-QWRGUYRKSA-N 1 2 313.426 4.185 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cccc(O)c1Cl ZINC000294047950 332146198 /nfs/dbraw/zinc/14/61/98/332146198.db2.gz JELMYIFKOIZPFV-LBPRGKRZSA-N 1 2 305.805 4.213 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cccc(O)c1Cl ZINC000294047940 332146271 /nfs/dbraw/zinc/14/62/71/332146271.db2.gz JELMYIFKOIZPFV-GFCCVEGCSA-N 1 2 305.805 4.213 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccccc1OCC(F)(F)F ZINC000317745849 332162374 /nfs/dbraw/zinc/16/23/74/332162374.db2.gz RCOFOUARKMVGEQ-UHFFFAOYSA-N 1 2 313.323 4.017 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c(Cl)c1 ZINC000427116852 332168853 /nfs/dbraw/zinc/16/88/53/332168853.db2.gz IIPIQPVQAIQONZ-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1cc[nH+]cc1CCCNc1cccc(Br)c1 ZINC000584258832 332170542 /nfs/dbraw/zinc/17/05/42/332170542.db2.gz JVDAGINMGSMUGB-UHFFFAOYSA-N 1 2 305.219 4.197 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)ccc1Cl ZINC000180984541 332172646 /nfs/dbraw/zinc/17/26/46/332172646.db2.gz FLFKVAXUXHMSPQ-NSHDSACASA-N 1 2 307.825 4.180 20 0 DIADLO Cc1ccc(C(=O)N[C@@H]2CCCC2(C)C)cc1Oc1cc[nH+]cc1 ZINC000427168651 332174962 /nfs/dbraw/zinc/17/49/62/332174962.db2.gz FQVYAOHCXJPFLR-GOSISDBHSA-N 1 2 324.424 4.491 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(F)c(Br)c2)CCC1(F)F ZINC000584260569 332174988 /nfs/dbraw/zinc/17/49/88/332174988.db2.gz KOXWUJACKMAICS-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(F)c(Br)c2)CCC1(F)F ZINC000584260569 332174989 /nfs/dbraw/zinc/17/49/89/332174989.db2.gz KOXWUJACKMAICS-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO Cc1ccc(C(=O)NCC2(C)CCC2)cc1Oc1cc[nH+]cc1 ZINC000427189385 332182619 /nfs/dbraw/zinc/18/26/19/332182619.db2.gz LWOLYXSVIZDSAW-UHFFFAOYSA-N 1 2 310.397 4.102 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2c(F)cccc2Cl)C2CC2)n1 ZINC000181597001 332201516 /nfs/dbraw/zinc/20/15/16/332201516.db2.gz IPSUNEUYRQRENR-AWEZNQCLSA-N 1 2 310.825 4.485 20 0 DIADLO Cn1cc([C@@H](Nc2ccc3ccccc3[nH+]2)c2ccccc2)cn1 ZINC000363669820 332215976 /nfs/dbraw/zinc/21/59/76/332215976.db2.gz IMBNCPIXBQJBLS-FQEVSTJZSA-N 1 2 314.392 4.170 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc([C@@H]2CCCC(C)(C)C2)no1 ZINC000533849686 332221151 /nfs/dbraw/zinc/22/11/51/332221151.db2.gz NFLXFLAFRORTSU-CQSZACIVSA-N 1 2 324.428 4.460 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1Cl)c1csnn1 ZINC000398318694 332231017 /nfs/dbraw/zinc/23/10/17/332231017.db2.gz GYHRQTWXKXNULG-JGVFFNPUSA-N 1 2 302.230 4.257 20 0 DIADLO Cc1cnc(C[N@@H+](C)[C@H](c2ccccc2Cl)C(C)C)nc1 ZINC000536367159 332233369 /nfs/dbraw/zinc/23/33/69/332233369.db2.gz QBMSBBLLTTURRH-KRWDZBQOSA-N 1 2 303.837 4.268 20 0 DIADLO Cc1cnc(C[N@H+](C)[C@H](c2ccccc2Cl)C(C)C)nc1 ZINC000536367159 332233371 /nfs/dbraw/zinc/23/33/71/332233371.db2.gz QBMSBBLLTTURRH-KRWDZBQOSA-N 1 2 303.837 4.268 20 0 DIADLO CSCc1cnc(C[N@@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)s1 ZINC000449463310 332234687 /nfs/dbraw/zinc/23/46/87/332234687.db2.gz VVVCOKJZMDCPDB-NXEZZACHSA-N 1 2 324.437 4.169 20 0 DIADLO CSCc1cnc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)s1 ZINC000449463310 332234688 /nfs/dbraw/zinc/23/46/88/332234688.db2.gz VVVCOKJZMDCPDB-NXEZZACHSA-N 1 2 324.437 4.169 20 0 DIADLO CCC(CC)[C@H](C)C(=O)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000536395897 332237962 /nfs/dbraw/zinc/23/79/62/332237962.db2.gz SCEIMILEHANGLP-ZDUSSCGKSA-N 1 2 317.408 4.154 20 0 DIADLO CC[C@H](c1ccccc1)[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000559479534 332263914 /nfs/dbraw/zinc/26/39/14/332263914.db2.gz KDUYMLKHENQLRW-LJQANCHMSA-N 1 2 303.409 4.339 20 0 DIADLO CC[C@H](c1ccccc1)[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000559479534 332263915 /nfs/dbraw/zinc/26/39/15/332263915.db2.gz KDUYMLKHENQLRW-LJQANCHMSA-N 1 2 303.409 4.339 20 0 DIADLO Clc1ccccc1SCCC[N@@H+]1Cc2cccnc2C1 ZINC000559759443 332279485 /nfs/dbraw/zinc/27/94/85/332279485.db2.gz IRMCFPABZZQSGR-UHFFFAOYSA-N 1 2 304.846 4.233 20 0 DIADLO Clc1ccccc1SCCC[N@H+]1Cc2cccnc2C1 ZINC000559759443 332279486 /nfs/dbraw/zinc/27/94/86/332279486.db2.gz IRMCFPABZZQSGR-UHFFFAOYSA-N 1 2 304.846 4.233 20 0 DIADLO C[C@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1cccc(C2CC2)c1 ZINC000559785495 332282072 /nfs/dbraw/zinc/28/20/72/332282072.db2.gz CNMFIEJWPWBNDK-KPZWWZAWSA-N 1 2 317.379 4.226 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1ncc(-c2ccccc2)o1 ZINC000109783620 332283912 /nfs/dbraw/zinc/28/39/12/332283912.db2.gz NYTMDOPDJKNOAH-AWEZNQCLSA-N 1 2 308.381 4.240 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ncc(-c2ccccc2)o1 ZINC000109783620 332283914 /nfs/dbraw/zinc/28/39/14/332283914.db2.gz NYTMDOPDJKNOAH-AWEZNQCLSA-N 1 2 308.381 4.240 20 0 DIADLO FC(F)(F)CCOc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000559946629 332295890 /nfs/dbraw/zinc/29/58/90/332295890.db2.gz DJOFBDXPLYYKNM-UHFFFAOYSA-N 1 2 310.319 4.218 20 0 DIADLO Cc1cc[nH+]cc1CCCNc1ccc(F)cc1OC(F)F ZINC000573961419 332299269 /nfs/dbraw/zinc/29/92/69/332299269.db2.gz PIRAFEOWTXMUGA-UHFFFAOYSA-N 1 2 310.319 4.175 20 0 DIADLO CCOc1cc(NCc2cn3cc(Cl)ccc3[nH+]2)ccc1C ZINC000560073535 332308267 /nfs/dbraw/zinc/30/82/67/332308267.db2.gz WOXQEXMJDMPHRP-UHFFFAOYSA-N 1 2 315.804 4.307 20 0 DIADLO Cc1ccc2cc([C@H](C)[NH2+][C@@H](C)c3nnc(C(C)C)[nH]3)oc2c1 ZINC000426076432 335100906 /nfs/dbraw/zinc/10/09/06/335100906.db2.gz LBRHVGQPDRLAKZ-STQMWFEESA-N 1 2 312.417 4.395 20 0 DIADLO Cc1ccc2cc([C@H](C)[NH2+][C@H](C)c3nnc(C(C)C)[nH]3)oc2c1 ZINC000426076431 335100916 /nfs/dbraw/zinc/10/09/16/335100916.db2.gz LBRHVGQPDRLAKZ-QWHCGFSZSA-N 1 2 312.417 4.395 20 0 DIADLO COc1c(C)c[nH+]c(COc2ccc(Cl)cc2C(C)=O)c1C ZINC000387526184 332329598 /nfs/dbraw/zinc/32/95/98/332329598.db2.gz PDAZUBVRBJFEJU-UHFFFAOYSA-N 1 2 319.788 4.142 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@@H](C)c2cccc(C)c2C)n1 ZINC000115602852 332333857 /nfs/dbraw/zinc/33/38/57/332333857.db2.gz VVPUOIHIALJYTJ-LSDHHAIUSA-N 1 2 301.434 4.441 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NC[C@]1(C)C[C@H]1c1ccccc1 ZINC000560435273 332339548 /nfs/dbraw/zinc/33/95/48/332339548.db2.gz VBAQNXXYZGCCID-LPHOPBHVSA-N 1 2 309.413 4.014 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2nc(C)c3ccccc3n2)ccc1F ZINC000560503094 332347090 /nfs/dbraw/zinc/34/70/90/332347090.db2.gz DUCWWDMDIOGLEO-UHFFFAOYSA-N 1 2 309.388 4.018 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2nc(C)c3ccccc3n2)ccc1F ZINC000560503094 332347092 /nfs/dbraw/zinc/34/70/92/332347092.db2.gz DUCWWDMDIOGLEO-UHFFFAOYSA-N 1 2 309.388 4.018 20 0 DIADLO CC(C)[C@H]1CC[C@H]1Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000560553252 332358896 /nfs/dbraw/zinc/35/88/96/332358896.db2.gz PNPHMTQAXATHFH-VQIMIIECSA-N 1 2 307.441 4.448 20 0 DIADLO Cc1ccc(NCc2[nH+]ccn2C)cc1OCC1CCCCC1 ZINC000560681856 332376828 /nfs/dbraw/zinc/37/68/28/332376828.db2.gz DBHOMCKQTCTMNB-UHFFFAOYSA-N 1 2 313.445 4.300 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)CCCc1ccc(Cl)cc1 ZINC000425587308 335107404 /nfs/dbraw/zinc/10/74/04/335107404.db2.gz MQJHVXYFVBPVDI-UHFFFAOYSA-N 1 2 302.805 4.313 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1csc2c1CC[C@H](C)C2 ZINC000425587423 335107428 /nfs/dbraw/zinc/10/74/28/335107428.db2.gz OENKZMMHJBZRNR-JTQLQIEISA-N 1 2 300.427 4.137 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)Oc1ccc(Cl)c(C)c1 ZINC000425588394 335107632 /nfs/dbraw/zinc/10/76/32/335107632.db2.gz PWRYEKPTNRYHHD-CYBMUJFWSA-N 1 2 318.804 4.066 20 0 DIADLO Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2cc[nH+]c(C)c2)o1 ZINC000120152120 332383966 /nfs/dbraw/zinc/38/39/66/332383966.db2.gz ZERBZKGQPPVKBV-INIZCTEOSA-N 1 2 313.401 4.441 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)Sc1ccccc1Cl ZINC000425589481 335108125 /nfs/dbraw/zinc/10/81/25/335108125.db2.gz SRMKPZQXAUDWQC-LBPRGKRZSA-N 1 2 320.845 4.471 20 0 DIADLO COc1cccc2c(NCc3cnc(C4CC4)o3)c(C)c[nH+]c12 ZINC000564410090 332394873 /nfs/dbraw/zinc/39/48/73/332394873.db2.gz MHMGTKWBHXKATG-UHFFFAOYSA-N 1 2 309.369 4.029 20 0 DIADLO CC(C)[C@@H]1C[C@@H]1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000425580844 335106402 /nfs/dbraw/zinc/10/64/02/335106402.db2.gz YRXHJTKTQOONRU-IRXDYDNUSA-N 1 2 323.440 4.117 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)CSc1ccccc1 ZINC000425583512 335106638 /nfs/dbraw/zinc/10/66/38/335106638.db2.gz AURDUZXDLOVGRZ-CYBMUJFWSA-N 1 2 300.427 4.065 20 0 DIADLO O=C(Nc1cccc(-c2ccccc2)c1)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000561663484 332477151 /nfs/dbraw/zinc/47/71/51/332477151.db2.gz PPHGVKKILXAPNO-QGZVFWFLSA-N 1 2 317.392 4.135 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1ccc(C)cc1)c1ccco1 ZINC000151108220 332517040 /nfs/dbraw/zinc/51/70/40/332517040.db2.gz IYPUVHBBIQMOFM-FQEVSTJZSA-N 1 2 307.393 4.476 20 0 DIADLO C[C@H]([NH2+]C/C=C\c1ccc(F)cc1F)c1nc(C(C)(C)C)no1 ZINC000562034001 332534882 /nfs/dbraw/zinc/53/48/82/332534882.db2.gz NULPTUXMSQPMJL-GZTOBOFZSA-N 1 2 321.371 4.009 20 0 DIADLO Cc1cc(NC(=O)N2C[C@H](C)CC[C@@H]2c2ccccc2)c(C)c[nH+]1 ZINC000562250201 332564221 /nfs/dbraw/zinc/56/42/21/332564221.db2.gz OGMGBPVALHBFAU-AUUYWEPGSA-N 1 2 323.440 4.125 20 0 DIADLO Cc1oc2ccc(NC(=O)N[C@H]3C[C@@H](C)n4cc[nH+]c43)cc2c1C ZINC000562606102 332609238 /nfs/dbraw/zinc/60/92/38/332609238.db2.gz LDKPJZPXFFJJPY-BMIGLBTASA-N 1 2 324.384 4.074 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)no1 ZINC000569735579 332673942 /nfs/dbraw/zinc/67/39/42/332673942.db2.gz FGJXMRLAJYEACD-LBPRGKRZSA-N 1 2 313.376 4.336 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H](C)c1c(F)cccc1OC ZINC000318376168 332695009 /nfs/dbraw/zinc/69/50/09/332695009.db2.gz OCKJQDFXLRIBFC-LLVKDONJSA-N 1 2 323.795 4.347 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@H]2CCc2ccccc2)c(C)[nH+]1 ZINC000176731735 332954030 /nfs/dbraw/zinc/95/40/30/332954030.db2.gz FLWXZCNJRUKSHQ-SFHVURJKSA-N 1 2 323.440 4.328 20 0 DIADLO COc1ccc(CNc2[nH+]c3ccccc3cc2C)cc1OC ZINC000301143600 332970580 /nfs/dbraw/zinc/97/05/80/332970580.db2.gz DRELKKPXNFHAJA-UHFFFAOYSA-N 1 2 308.381 4.173 20 0 DIADLO COC(=O)c1cc([C@H](C)SCCc2cccc(C)[nH+]2)oc1C ZINC000580193246 332996246 /nfs/dbraw/zinc/99/62/46/332996246.db2.gz RMHZNUISZSZHSO-ZDUSSCGKSA-N 1 2 319.426 4.115 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+][C@H](C)c1cccc(O)c1 ZINC000181575535 333030881 /nfs/dbraw/zinc/03/08/81/333030881.db2.gz PQACUEZQQJSGCW-LLVKDONJSA-N 1 2 314.410 4.268 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[NH2+][C@H](C)c3cccc(O)c3)o2)cc1 ZINC000181550827 333031168 /nfs/dbraw/zinc/03/11/68/333031168.db2.gz OIEWPWCZULVALD-KGLIPLIRSA-N 1 2 323.396 4.162 20 0 DIADLO C[C@@H]([NH2+]Cc1noc(-c2ccccc2)n1)c1cc2ccccc2o1 ZINC000182644505 333042980 /nfs/dbraw/zinc/04/29/80/333042980.db2.gz FOUWODGOMAJLOI-CYBMUJFWSA-N 1 2 319.364 4.334 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2nc(C(C)(C)C)cs2)C1 ZINC000460348564 333068186 /nfs/dbraw/zinc/06/81/86/333068186.db2.gz MHMKSPLMBGGPDS-UKRRQHHQSA-N 1 2 315.486 4.419 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2nc(C(C)(C)C)cs2)C1 ZINC000460348564 333068187 /nfs/dbraw/zinc/06/81/87/333068187.db2.gz MHMKSPLMBGGPDS-UKRRQHHQSA-N 1 2 315.486 4.419 20 0 DIADLO Cc1[nH]c2ccc(CSc3nc4ccccc4n3C)cc2[nH+]1 ZINC000460445715 333088872 /nfs/dbraw/zinc/08/88/72/333088872.db2.gz UHPUUUFAKGEFBF-UHFFFAOYSA-N 1 2 308.410 4.050 20 0 DIADLO Cc1[nH]c2cc(CSc3nc4ccccc4n3C)ccc2[nH+]1 ZINC000460445715 333088874 /nfs/dbraw/zinc/08/88/74/333088874.db2.gz UHPUUUFAKGEFBF-UHFFFAOYSA-N 1 2 308.410 4.050 20 0 DIADLO COc1ccc(F)cc1C[NH2+]Cc1c(Cl)cccc1Cl ZINC000462797034 333114846 /nfs/dbraw/zinc/11/48/46/333114846.db2.gz AYXJWZDHMWPJGU-UHFFFAOYSA-N 1 2 314.187 4.431 20 0 DIADLO Fc1ccc(C[N@H+](Cc2cc(-c3ccco3)on2)C2CC2)cc1 ZINC000181845799 333125148 /nfs/dbraw/zinc/12/51/48/333125148.db2.gz BCDXVHRPZAQFLO-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2cc(-c3ccco3)on2)C2CC2)cc1 ZINC000181845799 333125149 /nfs/dbraw/zinc/12/51/49/333125149.db2.gz BCDXVHRPZAQFLO-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(/C=C(\C)C(C)(C)C)n1 ZINC000460738247 333131327 /nfs/dbraw/zinc/13/13/27/333131327.db2.gz SVADDRZLXOUKEC-ACCUITESSA-N 1 2 324.428 4.479 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(-c2ccc(C)s2)n1 ZINC000460746582 333132990 /nfs/dbraw/zinc/13/29/90/333132990.db2.gz ITOIQFLURLLJOV-UHFFFAOYSA-N 1 2 324.409 4.067 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)C1CCC(F)(F)CC1 ZINC000179532844 333152272 /nfs/dbraw/zinc/15/22/72/333152272.db2.gz QNQBJYZSPWPKQH-UHFFFAOYSA-N 1 2 312.360 4.023 20 0 DIADLO CCc1noc(CC)c1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000180739705 333164914 /nfs/dbraw/zinc/16/49/14/333164914.db2.gz ZTPCJMPRAVHXAI-HXUWFJFHSA-N 1 2 321.424 4.074 20 0 DIADLO Fc1cc2[nH+]cn(C[C@H]3CCC4(CCCCC4)O3)c2cc1F ZINC000318586355 333191084 /nfs/dbraw/zinc/19/10/84/333191084.db2.gz XVGMFVYILPZGQV-GFCCVEGCSA-N 1 2 306.356 4.196 20 0 DIADLO CC[C@@H]1Cc2ccccc2CN1C(=O)Nc1ccc(C)[nH+]c1C ZINC000185398561 333208267 /nfs/dbraw/zinc/20/82/67/333208267.db2.gz PHTQYBZOAXLPEX-QGZVFWFLSA-N 1 2 309.413 4.067 20 0 DIADLO Cc1ccc(C)c(C[NH2+][C@@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000185401151 333208414 /nfs/dbraw/zinc/20/84/14/333208414.db2.gz DRABHVOCHOBUKU-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1ccc(C)c(C[NH2+][C@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000185401175 333208438 /nfs/dbraw/zinc/20/84/38/333208438.db2.gz DRABHVOCHOBUKU-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1cc(C)cc([C@@H](C)Nc2cc(N3CCCCC3)nc[nH+]2)c1 ZINC000514084764 333230948 /nfs/dbraw/zinc/23/09/48/333230948.db2.gz RPWDXYOBHACLIC-MRXNPFEDSA-N 1 2 310.445 4.257 20 0 DIADLO Cc1cc(C)cc([C@@H](C)Nc2cc(N3CCCCC3)[nH+]cn2)c1 ZINC000514084764 333230949 /nfs/dbraw/zinc/23/09/49/333230949.db2.gz RPWDXYOBHACLIC-MRXNPFEDSA-N 1 2 310.445 4.257 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000497590685 333266196 /nfs/dbraw/zinc/26/61/96/333266196.db2.gz LZJVQJBVUADJEQ-KZULUSFZSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000497590685 333266198 /nfs/dbraw/zinc/26/61/98/333266198.db2.gz LZJVQJBVUADJEQ-KZULUSFZSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H](Sc1[nH+]cnc2c1cnn2C)c1ccc(F)c(Cl)c1 ZINC000497663736 333275076 /nfs/dbraw/zinc/27/50/76/333275076.db2.gz QTHOVIJNZAIMAO-QMMMGPOBSA-N 1 2 322.796 4.009 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1nc2c(s1)CCC2 ZINC000497710505 333280827 /nfs/dbraw/zinc/28/08/27/333280827.db2.gz JYPHUNGKZHFIOH-VHSXEESVSA-N 1 2 308.397 4.322 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Nc2cc[nH+]c(C)c2)o1 ZINC000120472221 333284229 /nfs/dbraw/zinc/28/42/29/333284229.db2.gz ROEWNDTZAPRUKU-LRDDRELGSA-N 1 2 313.401 4.297 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H]1CCC[C@H](c2cccnc2)C1)C(F)(F)F ZINC000502433429 333295080 /nfs/dbraw/zinc/29/50/80/333295080.db2.gz HYNHUXNWLGNKCE-CFVMTHIKSA-N 1 2 300.368 4.284 20 0 DIADLO CC(C)[C@H]([NH2+][C@H]1CCC[C@H](c2cccnc2)C1)C(F)(F)F ZINC000502433430 333295104 /nfs/dbraw/zinc/29/51/04/333295104.db2.gz HYNHUXNWLGNKCE-QEJZJMRPSA-N 1 2 300.368 4.284 20 0 DIADLO Cc1ccc(C)c([C@H]2C[N@H+](CCC(F)(F)F)[C@@H](C)CO2)c1 ZINC000525785977 333311436 /nfs/dbraw/zinc/31/14/36/333311436.db2.gz XKDGPTXYPCSUBJ-DZGCQCFKSA-N 1 2 301.352 4.018 20 0 DIADLO Cc1ccc(C)c([C@H]2C[N@@H+](CCC(F)(F)F)[C@@H](C)CO2)c1 ZINC000525785977 333311438 /nfs/dbraw/zinc/31/14/38/333311438.db2.gz XKDGPTXYPCSUBJ-DZGCQCFKSA-N 1 2 301.352 4.018 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@@H+]2CCSC2CCCCC2)o1 ZINC000500077025 333324150 /nfs/dbraw/zinc/32/41/50/333324150.db2.gz VQIMIVJWCBFAGK-INIZCTEOSA-N 1 2 309.475 4.027 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@H+]2CCSC2CCCCC2)o1 ZINC000500077025 333324152 /nfs/dbraw/zinc/32/41/52/333324152.db2.gz VQIMIVJWCBFAGK-INIZCTEOSA-N 1 2 309.475 4.027 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2cc(F)ccc2F)s1 ZINC000531233470 333336875 /nfs/dbraw/zinc/33/68/75/333336875.db2.gz YPFWFLWRBHASOB-NSHDSACASA-N 1 2 310.413 4.485 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2cc(F)ccc2F)s1 ZINC000531233470 333336876 /nfs/dbraw/zinc/33/68/76/333336876.db2.gz YPFWFLWRBHASOB-NSHDSACASA-N 1 2 310.413 4.485 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccn(-c3ccccc3)n2)[C@@H]1c1ccccc1 ZINC000531378333 333347460 /nfs/dbraw/zinc/34/74/60/333347460.db2.gz FXMHRFURAHDNIH-JXFKEZNVSA-N 1 2 303.409 4.065 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccn(-c3ccccc3)n2)[C@@H]1c1ccccc1 ZINC000531378333 333347461 /nfs/dbraw/zinc/34/74/61/333347461.db2.gz FXMHRFURAHDNIH-JXFKEZNVSA-N 1 2 303.409 4.065 20 0 DIADLO Clc1cc(Br)ccc1C[N@@H+]1CCC12CCC2 ZINC000531416760 333350485 /nfs/dbraw/zinc/35/04/85/333350485.db2.gz OKTSIZJAYZBXMN-UHFFFAOYSA-N 1 2 300.627 4.231 20 0 DIADLO Clc1cc(Br)ccc1C[N@H+]1CCC12CCC2 ZINC000531416760 333350486 /nfs/dbraw/zinc/35/04/86/333350486.db2.gz OKTSIZJAYZBXMN-UHFFFAOYSA-N 1 2 300.627 4.231 20 0 DIADLO CC(C)CC(CC(C)C)NC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000522760913 333386093 /nfs/dbraw/zinc/38/60/93/333386093.db2.gz NPFHDTVOFDYOPW-UHFFFAOYSA-N 1 2 313.445 4.063 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@@H+]1Cc1cnccn1 ZINC000563090910 333386761 /nfs/dbraw/zinc/38/67/61/333386761.db2.gz IGBIYFNOTNWMOS-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@H+]1Cc1cnccn1 ZINC000563090910 333386763 /nfs/dbraw/zinc/38/67/63/333386763.db2.gz IGBIYFNOTNWMOS-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO Cn1cc[nH+]c1CNc1ccc(Oc2ccc(Cl)cc2)cc1 ZINC000571010285 333478801 /nfs/dbraw/zinc/47/88/01/333478801.db2.gz YVGCFXCHDAGSGL-UHFFFAOYSA-N 1 2 313.788 4.478 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(OC(C)C)cc2)s1 ZINC000274275193 333487272 /nfs/dbraw/zinc/48/72/72/333487272.db2.gz XLPSDFAAGXZTJG-NWDGAFQWSA-N 1 2 305.447 4.046 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)ccc1Cl ZINC000531582951 333535395 /nfs/dbraw/zinc/53/53/95/333535395.db2.gz ITMJRIADBGLLJY-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO Cc1ccc(O)c(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)n1 ZINC000531848883 333576770 /nfs/dbraw/zinc/57/67/70/333576770.db2.gz SOXLBGJJMVZZRN-UHFFFAOYSA-N 1 2 323.223 4.181 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@](C)(c3ccccc3)C2)c(C)[nH+]1 ZINC000152218042 333644742 /nfs/dbraw/zinc/64/47/42/333644742.db2.gz REXKVLPHVGLUKG-FQEVSTJZSA-N 1 2 323.440 4.284 20 0 DIADLO CCc1ccc(C[NH2+][C@H](C)c2ncc(-c3ccccc3)o2)nc1 ZINC000411537152 333691828 /nfs/dbraw/zinc/69/18/28/333691828.db2.gz IANSYLFTYBLVQF-CQSZACIVSA-N 1 2 307.397 4.150 20 0 DIADLO CCS[C@@H](C)c1noc(CSCCc2cccc(C)[nH+]2)n1 ZINC000571562414 333816160 /nfs/dbraw/zinc/81/61/60/333816160.db2.gz ILRVGLUPRZJOPY-LBPRGKRZSA-N 1 2 323.487 4.063 20 0 DIADLO Cc1noc(C)c1C[NH2+][C@H](C)c1csc(-c2ccccc2)n1 ZINC000414070458 333891130 /nfs/dbraw/zinc/89/11/30/333891130.db2.gz LGFQKSIVEQDHEY-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO CCn1ccc(C[NH2+][C@@H](C)c2cc(Cl)sc2Cl)n1 ZINC000414203140 333913712 /nfs/dbraw/zinc/91/37/12/333913712.db2.gz DOXWTZWKPIJMLY-QMMMGPOBSA-N 1 2 304.246 4.122 20 0 DIADLO CCCC[S@](=O)CCCCCn1c(C)[nH+]c2ccccc21 ZINC000414275107 333931957 /nfs/dbraw/zinc/93/19/57/333931957.db2.gz SOEYZFYBQXVSDW-NRFANRHFSA-N 1 2 306.475 4.064 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2cc(Cl)cc(Cl)c21)c1csnn1 ZINC000414293503 333934980 /nfs/dbraw/zinc/93/49/80/333934980.db2.gz CVSQEPHIPZBOLM-CPCISQLKSA-N 1 2 314.241 4.183 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1)c1csnn1 ZINC000414309356 333936781 /nfs/dbraw/zinc/93/67/81/333936781.db2.gz UVWAYJBZRSAUKA-YUMQZZPRSA-N 1 2 302.230 4.257 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2nccs2)c(OC(F)F)cc1C ZINC000414491215 333995854 /nfs/dbraw/zinc/99/58/54/333995854.db2.gz COBIBCLODYUWMU-NSHDSACASA-N 1 2 312.385 4.212 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2nnc(C3CC3)s2)cc1 ZINC000414550156 334015399 /nfs/dbraw/zinc/01/53/99/334015399.db2.gz CIBPDUZLIMJTPH-UHFFFAOYSA-N 1 2 301.459 4.003 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)c1csnn1 ZINC000414549825 334015403 /nfs/dbraw/zinc/01/54/03/334015403.db2.gz MGOGYEHHXCHVNU-SSDOTTSWSA-N 1 2 321.755 4.061 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2nc(C3CC3)cs2)s1 ZINC000343539349 335170766 /nfs/dbraw/zinc/17/07/66/335170766.db2.gz UDZZEBCAUXYRJS-SNVBAGLBSA-N 1 2 307.488 4.287 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2nc(C3CC3)cs2)s1 ZINC000343539349 335170767 /nfs/dbraw/zinc/17/07/67/335170767.db2.gz UDZZEBCAUXYRJS-SNVBAGLBSA-N 1 2 307.488 4.287 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1)c1csnn1 ZINC000414557103 334017102 /nfs/dbraw/zinc/01/71/02/334017102.db2.gz ZLBYHZIAWDCURN-ZETCQYMHSA-N 1 2 321.755 4.061 20 0 DIADLO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@@H](C)c1cccnc1Cl ZINC000271418603 334023066 /nfs/dbraw/zinc/02/30/66/334023066.db2.gz BJRJOIKGWHTIBU-WFASDCNBSA-N 1 2 302.805 4.136 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncn(C)n1)c1cc2c(ccc3ccccc23)o1 ZINC000275629006 334072352 /nfs/dbraw/zinc/07/23/52/334072352.db2.gz BASHIUPTYFLDLF-OLZOCXBDSA-N 1 2 320.396 4.126 20 0 DIADLO c1[nH]c([C@@H]2CCCC[N@H+]2Cc2ccncc2)nc1-c1ccccc1 ZINC000276407273 334077372 /nfs/dbraw/zinc/07/73/72/334077372.db2.gz GLELRWBUWVXSAJ-IBGZPJMESA-N 1 2 318.424 4.199 20 0 DIADLO c1[nH]c([C@@H]2CCCC[N@@H+]2Cc2ccncc2)nc1-c1ccccc1 ZINC000276407273 334077373 /nfs/dbraw/zinc/07/73/73/334077373.db2.gz GLELRWBUWVXSAJ-IBGZPJMESA-N 1 2 318.424 4.199 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ncnn1C)c1cc2c(ccc3ccccc23)o1 ZINC000276523328 334080901 /nfs/dbraw/zinc/08/09/01/334080901.db2.gz CAOYFVRFORZNGT-CHWSQXEVSA-N 1 2 320.396 4.126 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ncnn1C)c1cc2c(ccc3ccccc23)o1 ZINC000276523351 334080946 /nfs/dbraw/zinc/08/09/46/334080946.db2.gz CAOYFVRFORZNGT-STQMWFEESA-N 1 2 320.396 4.126 20 0 DIADLO Cc1c([C@H](C)Nc2ccc([NH+](C)C)cc2C)cnn1C(C)C ZINC000276564115 334082170 /nfs/dbraw/zinc/08/21/70/334082170.db2.gz SHEWZLVGDQXUHG-AWEZNQCLSA-N 1 2 300.450 4.320 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000343508358 335172799 /nfs/dbraw/zinc/17/27/99/335172799.db2.gz HVWCEGXYWKVBRP-ZDUSSCGKSA-N 1 2 307.388 4.244 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000343508358 335172800 /nfs/dbraw/zinc/17/28/00/335172800.db2.gz HVWCEGXYWKVBRP-ZDUSSCGKSA-N 1 2 307.388 4.244 20 0 DIADLO FC(F)Oc1ccc(CNc2ccc3c(c2)CCC[NH2+]3)cc1 ZINC000414827356 334110229 /nfs/dbraw/zinc/11/02/29/334110229.db2.gz BHIKFOBEYAIDLH-UHFFFAOYSA-N 1 2 304.340 4.258 20 0 DIADLO FC(F)(F)C[C@@H]1CC[N@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000282402144 334134258 /nfs/dbraw/zinc/13/42/58/334134258.db2.gz FHPJRKRVNRSVRL-QMMMGPOBSA-N 1 2 313.150 4.163 20 0 DIADLO FC(F)(F)C[C@@H]1CC[N@@H+](Cc2ccc(Cl)nc2Cl)C1 ZINC000282402144 334134259 /nfs/dbraw/zinc/13/42/59/334134259.db2.gz FHPJRKRVNRSVRL-QMMMGPOBSA-N 1 2 313.150 4.163 20 0 DIADLO CCCc1nc(C)c(C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)o1 ZINC000293685847 334200712 /nfs/dbraw/zinc/20/07/12/334200712.db2.gz NLAWIGLAJLXVLI-KRWDZBQOSA-N 1 2 316.449 4.070 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cccc(O)c1Cl)c1nc(C)cs1 ZINC000293694111 334201100 /nfs/dbraw/zinc/20/11/00/334201100.db2.gz WNBTVWQHADBYFL-OAHLLOKOSA-N 1 2 310.850 4.226 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(Cl)ccc(F)c1Cl)c1ccncn1 ZINC000453067486 334229720 /nfs/dbraw/zinc/22/97/20/334229720.db2.gz WPTGFFAOEOKFDZ-IUCAKERBSA-N 1 2 314.191 4.334 20 0 DIADLO Cc1c(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)cnn1-c1cc(C)ccc1C ZINC000296349102 334232674 /nfs/dbraw/zinc/23/26/74/334232674.db2.gz HISRJNTVNCSKDW-GDBMZVCRSA-N 1 2 321.428 4.112 20 0 DIADLO Cc1c(N[C@@H]2C[C@H](C)n3cc[nH+]c32)cnn1-c1cc(C)ccc1C ZINC000296349106 334232734 /nfs/dbraw/zinc/23/27/34/334232734.db2.gz HISRJNTVNCSKDW-GOEBONIOSA-N 1 2 321.428 4.112 20 0 DIADLO CC(C)(C)c1noc(C[N@H+](Cc2ccc(F)cc2)C(C)(C)C)n1 ZINC000531888754 334276687 /nfs/dbraw/zinc/27/66/87/334276687.db2.gz JDJVPGIPURKMLK-UHFFFAOYSA-N 1 2 319.424 4.307 20 0 DIADLO CC(C)(C)c1noc(C[N@@H+](Cc2ccc(F)cc2)C(C)(C)C)n1 ZINC000531888754 334276689 /nfs/dbraw/zinc/27/66/89/334276689.db2.gz JDJVPGIPURKMLK-UHFFFAOYSA-N 1 2 319.424 4.307 20 0 DIADLO COc1cc(OC)c([C@@H](C)[NH2+][C@H](C)C(C)(F)F)cc1Cl ZINC000453288826 334249018 /nfs/dbraw/zinc/24/90/18/334249018.db2.gz LVIGOSILTZNXAS-RKDXNWHRSA-N 1 2 307.768 4.052 20 0 DIADLO CCc1c(NCc2ccc(C)[nH+]c2C)cnn1C(CC)CC ZINC000340602999 334249542 /nfs/dbraw/zinc/24/95/42/334249542.db2.gz MJWOIWFRUSYKLT-UHFFFAOYSA-N 1 2 300.450 4.431 20 0 DIADLO CC(C)(C)[C@@H]([NH2+]Cc1nnc(C2CC2)[nH]1)c1cc2ccccc2o1 ZINC000583482270 334263574 /nfs/dbraw/zinc/26/35/74/334263574.db2.gz NIAABCNVKVDJIM-KRWDZBQOSA-N 1 2 324.428 4.305 20 0 DIADLO COc1cc(C)[nH+]c(CSc2nc3cc(Cl)ccc3o2)c1 ZINC000534519982 334278667 /nfs/dbraw/zinc/27/86/67/334278667.db2.gz YWEUMTMDYJYLTN-UHFFFAOYSA-N 1 2 320.801 4.486 20 0 DIADLO C[C@H](c1ccccc1Cl)[NH+]1CCN(Cc2ccsc2)CC1 ZINC000534521400 334278728 /nfs/dbraw/zinc/27/87/28/334278728.db2.gz DBSIUWQOTVFKQO-CQSZACIVSA-N 1 2 320.889 4.280 20 0 DIADLO CC(C)(C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)C1CCCC1 ZINC000534598160 334290768 /nfs/dbraw/zinc/29/07/68/334290768.db2.gz SOJAIPXBXBTPRF-UHFFFAOYSA-N 1 2 315.392 4.166 20 0 DIADLO CCOc1cccc(C[NH2+]Cc2c(Cl)cccc2Cl)n1 ZINC000531912960 334290787 /nfs/dbraw/zinc/29/07/87/334290787.db2.gz WBEZHPKVZPYAKE-UHFFFAOYSA-N 1 2 311.212 4.077 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2cc(F)cc(F)c2)nc2ccccc12 ZINC000531962402 334320399 /nfs/dbraw/zinc/32/03/99/334320399.db2.gz LDVBNZBAJDJRPW-NSHDSACASA-N 1 2 313.351 4.067 20 0 DIADLO CC(C)(C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1F ZINC000101516113 334322004 /nfs/dbraw/zinc/32/20/04/334322004.db2.gz JSMHECOKAYSAQV-UHFFFAOYSA-N 1 2 323.371 4.132 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(F)c(F)c2)C[C@H](c2ccc(F)cc2)O1 ZINC000303841683 334334670 /nfs/dbraw/zinc/33/46/70/334334670.db2.gz BRQAKIRGZLHUFC-KPZWWZAWSA-N 1 2 321.342 4.066 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(F)c(F)c2)C[C@H](c2ccc(F)cc2)O1 ZINC000303841683 334334671 /nfs/dbraw/zinc/33/46/71/334334671.db2.gz BRQAKIRGZLHUFC-KPZWWZAWSA-N 1 2 321.342 4.066 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3ncc(C4CC4)o3)CCCC2)cc1 ZINC000534845869 334339374 /nfs/dbraw/zinc/33/93/74/334339374.db2.gz JZRKPCVCNOFONC-UHFFFAOYSA-N 1 2 300.377 4.250 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(F)c2F)C[C@@H](c2ccc(F)cc2)O1 ZINC000303921403 334347238 /nfs/dbraw/zinc/34/72/38/334347238.db2.gz ORCBKWVFJZFXCD-SJCJKPOMSA-N 1 2 321.342 4.066 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(F)c2F)C[C@@H](c2ccc(F)cc2)O1 ZINC000303921403 334347240 /nfs/dbraw/zinc/34/72/40/334347240.db2.gz ORCBKWVFJZFXCD-SJCJKPOMSA-N 1 2 321.342 4.066 20 0 DIADLO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1csc([C@H](C)OC)n1 ZINC000531979650 334350868 /nfs/dbraw/zinc/35/08/68/334350868.db2.gz XWFLIQCCAXLKRS-OLZOCXBDSA-N 1 2 320.458 4.018 20 0 DIADLO C[N@H+](Cc1ccc(OC(F)F)cc1)Cc1c(F)cccc1F ZINC000535063050 334362025 /nfs/dbraw/zinc/36/20/25/334362025.db2.gz OPVIUTXEUVWKRA-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO C[N@@H+](Cc1ccc(OC(F)F)cc1)Cc1c(F)cccc1F ZINC000535063050 334362026 /nfs/dbraw/zinc/36/20/26/334362026.db2.gz OPVIUTXEUVWKRA-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000535062969 334362198 /nfs/dbraw/zinc/36/21/98/334362198.db2.gz AAOZLSJRUPXRJZ-UKRRQHHQSA-N 1 2 308.491 4.190 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000535062969 334362200 /nfs/dbraw/zinc/36/22/00/334362200.db2.gz AAOZLSJRUPXRJZ-UKRRQHHQSA-N 1 2 308.491 4.190 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3n2C)nc1 ZINC000535078139 334363036 /nfs/dbraw/zinc/36/30/36/334363036.db2.gz KYQXUFGBJQEFSA-LJQANCHMSA-N 1 2 320.440 4.004 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3n2C)nc1 ZINC000535078139 334363037 /nfs/dbraw/zinc/36/30/37/334363037.db2.gz KYQXUFGBJQEFSA-LJQANCHMSA-N 1 2 320.440 4.004 20 0 DIADLO CCc1ccc([C@H]2COCC[N@@H+]2Cc2cc3ccccc3o2)o1 ZINC000532013783 334374302 /nfs/dbraw/zinc/37/43/02/334374302.db2.gz REZGMYLLQHNXOD-QGZVFWFLSA-N 1 2 311.381 4.162 20 0 DIADLO CCc1ccc([C@H]2COCC[N@H+]2Cc2cc3ccccc3o2)o1 ZINC000532013783 334374303 /nfs/dbraw/zinc/37/43/03/334374303.db2.gz REZGMYLLQHNXOD-QGZVFWFLSA-N 1 2 311.381 4.162 20 0 DIADLO CCOc1ccccc1[C@@H](CC(C)C)NCc1[nH+]cc(C)n1C ZINC000341000655 334398774 /nfs/dbraw/zinc/39/87/74/334398774.db2.gz ANROACFIVWXWBS-QGZVFWFLSA-N 1 2 315.461 4.004 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2csc(-c3ccccc3)n2)cs1 ZINC000341213612 334418023 /nfs/dbraw/zinc/41/80/23/334418023.db2.gz RFPHEOBWJAMTTE-NSHDSACASA-N 1 2 315.467 4.426 20 0 DIADLO Cc1ncc(CN(C)c2cc[nH+]c3c(Cl)cccc23)s1 ZINC000341723106 334473814 /nfs/dbraw/zinc/47/38/14/334473814.db2.gz RBMZOHFKMAHTIN-UHFFFAOYSA-N 1 2 303.818 4.290 20 0 DIADLO CCn1nccc1CNc1[nH+]cccc1O[C@@H](C)c1ccccc1 ZINC000341942484 334494592 /nfs/dbraw/zinc/49/45/92/334494592.db2.gz BQGBLKZRAPSBOF-HNNXBMFYSA-N 1 2 322.412 4.050 20 0 DIADLO COCC[C@@H]1CCCCN(c2[nH+]ccc3ccc(F)cc32)C1 ZINC000341967964 334498139 /nfs/dbraw/zinc/49/81/39/334498139.db2.gz XQXRXYMQQYDBJE-AWEZNQCLSA-N 1 2 302.393 4.017 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000342223174 334522518 /nfs/dbraw/zinc/52/25/18/334522518.db2.gz FTAFYFGQDXSPAY-LSDHHAIUSA-N 1 2 307.397 4.457 20 0 DIADLO Cc1noc(C)c1CCNc1cc[nH+]c2c(Cl)cccc12 ZINC000342227442 334523010 /nfs/dbraw/zinc/52/30/10/334523010.db2.gz HLOJATUQSMVIIO-UHFFFAOYSA-N 1 2 301.777 4.148 20 0 DIADLO Cc1ccc(C[NH2+]Cc2cc(F)c(C(F)(F)F)cc2F)o1 ZINC000342292959 334525551 /nfs/dbraw/zinc/52/55/51/334525551.db2.gz OBWPSTYJEGKSBV-UHFFFAOYSA-N 1 2 305.246 4.175 20 0 DIADLO C[C@H]1CCN(c2[nH+]c3cccc(F)c3n2C)[C@@H](c2ccco2)C1 ZINC000443510489 338453174 /nfs/dbraw/zinc/45/31/74/338453174.db2.gz OAXQVVFRFAMITM-SWLSCSKDSA-N 1 2 313.376 4.283 20 0 DIADLO Cn1cc([C@H](Nc2cc(C(F)(F)F)cc[nH+]2)C(C)(C)C)cn1 ZINC000342586879 334553060 /nfs/dbraw/zinc/55/30/60/334553060.db2.gz WLHPVNNQZKYWFI-ZDUSSCGKSA-N 1 2 312.339 4.033 20 0 DIADLO CN(CCc1nccs1)c1cc[nH+]c2c(Cl)cccc12 ZINC000342785174 334571042 /nfs/dbraw/zinc/57/10/42/334571042.db2.gz SEZUZSBKUBMFNE-UHFFFAOYSA-N 1 2 303.818 4.024 20 0 DIADLO Cc1c[nH+]c(CN2CCc3c(Cl)cc(Cl)cc3[C@H]2C)n1C ZINC000342795603 334572424 /nfs/dbraw/zinc/57/24/24/334572424.db2.gz XPHOZFNKCUIWTB-LLVKDONJSA-N 1 2 324.255 4.155 20 0 DIADLO Cc1c[nH+]c(CN(Cc2ccccc2)Cc2ccccc2F)n1C ZINC000342807706 334578653 /nfs/dbraw/zinc/57/86/53/334578653.db2.gz OKYUAMPUDPWBTR-UHFFFAOYSA-N 1 2 323.415 4.070 20 0 DIADLO COCC[C@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1ccc(C)o1 ZINC000342928840 334589720 /nfs/dbraw/zinc/58/97/20/334589720.db2.gz DEDRUBPQJQAOIG-LBPRGKRZSA-N 1 2 314.307 4.192 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC000343188373 334646781 /nfs/dbraw/zinc/64/67/81/334646781.db2.gz GPRNBQAHOLDCTQ-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(Oc2ccc(C)c(C)c2)nc1 ZINC000416428526 334667657 /nfs/dbraw/zinc/66/76/57/334667657.db2.gz VDZYJPRWMZAHFN-UHFFFAOYSA-N 1 2 322.412 4.319 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000416954969 334685660 /nfs/dbraw/zinc/68/56/60/334685660.db2.gz LWBJUCMXRFIAJQ-PKOBYXMFSA-N 1 2 323.440 4.002 20 0 DIADLO CC[C@H](CNC(=O)Nc1c(C)cc(C)[nH+]c1C)CC(F)(F)F ZINC000417136838 334694970 /nfs/dbraw/zinc/69/49/70/334694970.db2.gz JKEHFDDKKVQTCP-LBPRGKRZSA-N 1 2 317.355 4.107 20 0 DIADLO Fc1cc(NCc2cn3cc(Cl)ccc3[nH+]2)cc(F)c1F ZINC000147454306 334727259 /nfs/dbraw/zinc/72/72/59/334727259.db2.gz WBRVVHBXBSQRFE-UHFFFAOYSA-N 1 2 311.694 4.017 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(C(F)(F)F)s1)c1c(F)cccc1F ZINC000443983181 338465307 /nfs/dbraw/zinc/46/53/07/338465307.db2.gz RJLOTUZBAMWXLH-ZETCQYMHSA-N 1 2 322.302 4.291 20 0 DIADLO FC(F)(F)c1ncc(CNc2c[nH+]c3c(c2)CCCC3)s1 ZINC000443982917 338465409 /nfs/dbraw/zinc/46/54/09/338465409.db2.gz FAJGTNYHHWEXLW-UHFFFAOYSA-N 1 2 313.348 4.048 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)CO[C@@H]1C[C@@H](C)CC[C@H]1C(C)C ZINC000331233474 334848924 /nfs/dbraw/zinc/84/89/24/334848924.db2.gz BQFGIYBBPHASMB-RRQGHBQHSA-N 1 2 318.461 4.114 20 0 DIADLO Cc1ccccc1[C@@H]1C[C@H](C)N(c2cc[nH+]c3ccncc32)C1 ZINC000444069506 338467856 /nfs/dbraw/zinc/46/78/56/338467856.db2.gz HXUPORVANASHLJ-JKSUJKDBSA-N 1 2 303.409 4.321 20 0 DIADLO c1ccc(C[C@@H]2CCCN(c3cc[nH+]c4ccncc43)C2)cc1 ZINC000444087861 338468221 /nfs/dbraw/zinc/46/82/21/338468221.db2.gz RNVBXVLIZJJCHF-KRWDZBQOSA-N 1 2 303.409 4.089 20 0 DIADLO CCS[C@H]1CCCC[C@@H]1NC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000334105542 334869241 /nfs/dbraw/zinc/86/92/41/334869241.db2.gz OXTVILXLHSVIGX-GJZGRUSLSA-N 1 2 321.490 4.193 20 0 DIADLO CC(C)n1c[nH+]cc1CN1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000425390838 334884904 /nfs/dbraw/zinc/88/49/04/334884904.db2.gz YYRMTQQCHISUNH-QGZVFWFLSA-N 1 2 321.827 4.188 20 0 DIADLO COc1cc[nH+]cc1CSc1nc2ccccc2n1C(F)F ZINC000343835554 335200785 /nfs/dbraw/zinc/20/07/85/335200785.db2.gz SEUVTWSLFTVTKT-UHFFFAOYSA-N 1 2 321.352 4.127 20 0 DIADLO Clc1cccc(Cl)c1C1CCN(Cc2[nH]cc[nH+]2)CC1 ZINC000344030015 335210508 /nfs/dbraw/zinc/21/05/08/335210508.db2.gz BMVUPKCFYCEHQY-UHFFFAOYSA-N 1 2 310.228 4.096 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2ccc(Oc3cccnc3)cc2)o1 ZINC000344054279 335213561 /nfs/dbraw/zinc/21/35/61/335213561.db2.gz BGSYWWDZLDEGIW-CQSZACIVSA-N 1 2 309.369 4.021 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2ccc(F)c3ccccc32)o1 ZINC000344084174 335216541 /nfs/dbraw/zinc/21/65/41/335216541.db2.gz GCEPDRLBHZNLNN-GFCCVEGCSA-N 1 2 313.376 4.336 20 0 DIADLO CC[C@H](NC(=O)c1cccc(-n2cc[nH+]c2)c1)c1ccc(C)cc1 ZINC000344206157 335225093 /nfs/dbraw/zinc/22/50/93/335225093.db2.gz FICXXOVPELEVPN-IBGZPJMESA-N 1 2 319.408 4.062 20 0 DIADLO CCCCOc1ccccc1C[N@H+](C)Cc1csc(C)n1 ZINC000344470798 335251612 /nfs/dbraw/zinc/25/16/12/335251612.db2.gz WTOQLQZWWCBDQK-UHFFFAOYSA-N 1 2 304.459 4.262 20 0 DIADLO CCCCOc1ccccc1C[N@@H+](C)Cc1csc(C)n1 ZINC000344470798 335251613 /nfs/dbraw/zinc/25/16/13/335251613.db2.gz WTOQLQZWWCBDQK-UHFFFAOYSA-N 1 2 304.459 4.262 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2cncc(F)c2)s1 ZINC000344635965 335261405 /nfs/dbraw/zinc/26/14/05/335261405.db2.gz BFCSOXFEYRZXSH-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2cncc(F)c2)s1 ZINC000344635965 335261406 /nfs/dbraw/zinc/26/14/06/335261406.db2.gz BFCSOXFEYRZXSH-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cncc(F)c2)C2CC2)o1 ZINC000344699046 335267992 /nfs/dbraw/zinc/26/79/92/335267992.db2.gz XGYMGFADDOOIRU-SJCJKPOMSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cncc(F)c2)C2CC2)o1 ZINC000344699046 335267994 /nfs/dbraw/zinc/26/79/94/335267994.db2.gz XGYMGFADDOOIRU-SJCJKPOMSA-N 1 2 300.377 4.102 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C)cs1)c1nc(C(F)(F)F)cs1 ZINC000344722238 335271584 /nfs/dbraw/zinc/27/15/84/335271584.db2.gz JSZXUODYLVGNOB-QMMMGPOBSA-N 1 2 321.393 4.168 20 0 DIADLO Cc1ccoc1CN(C)C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000345022804 335292242 /nfs/dbraw/zinc/29/22/42/335292242.db2.gz FEWANGCKZILGBR-UHFFFAOYSA-N 1 2 322.364 4.048 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)ccc1Cl ZINC000345457306 335326828 /nfs/dbraw/zinc/32/68/28/335326828.db2.gz YFKWRPABHKHQKZ-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO C[C@@H]1CC=CC[C@@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000346007374 335369158 /nfs/dbraw/zinc/36/91/58/335369158.db2.gz AGGKFUAGEZLVIY-PBHICJAKSA-N 1 2 320.396 4.051 20 0 DIADLO Cn1cc[nH+]c1CN1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000346154977 335382737 /nfs/dbraw/zinc/38/27/37/335382737.db2.gz UAYWSQVNUJEHJA-OAHLLOKOSA-N 1 2 323.362 4.166 20 0 DIADLO Cc1ccc([C@H]2COCC[N@@H+]2Cc2cc(C)c3ncccc3c2)o1 ZINC000346221333 335385779 /nfs/dbraw/zinc/38/57/79/335385779.db2.gz OBZWXJJZWQQOLD-GOSISDBHSA-N 1 2 322.408 4.018 20 0 DIADLO Cc1ccc([C@H]2COCC[N@H+]2Cc2cc(C)c3ncccc3c2)o1 ZINC000346221333 335385780 /nfs/dbraw/zinc/38/57/80/335385780.db2.gz OBZWXJJZWQQOLD-GOSISDBHSA-N 1 2 322.408 4.018 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+](Cc1ccco1)C(C)C ZINC000346288234 335392877 /nfs/dbraw/zinc/39/28/77/335392877.db2.gz FNUOCESDOJTUER-UHFFFAOYSA-N 1 2 315.413 4.292 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+](Cc1ccco1)C(C)C ZINC000346288234 335392879 /nfs/dbraw/zinc/39/28/79/335392879.db2.gz FNUOCESDOJTUER-UHFFFAOYSA-N 1 2 315.413 4.292 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2cc(-c3ccco3)on2)c1 ZINC000346571658 335417432 /nfs/dbraw/zinc/41/74/32/335417432.db2.gz DLMVHCMYRZNBPI-UHFFFAOYSA-N 1 2 316.382 4.080 20 0 DIADLO Cc1ccc(-c2csc(C[NH2+][C@@H](C)c3ccccn3)n2)cc1 ZINC000347002891 335458668 /nfs/dbraw/zinc/45/86/68/335458668.db2.gz ZIZBHTJJIROGAA-AWEZNQCLSA-N 1 2 309.438 4.364 20 0 DIADLO Cc1ccc(N[C@H]2CCc3c2c(Br)ccc3F)c[nH+]1 ZINC000347124069 335467909 /nfs/dbraw/zinc/46/79/09/335467909.db2.gz IPDRSWFECHRBAK-AWEZNQCLSA-N 1 2 321.193 4.391 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nccn1-c1ccccc1)c1c(C)noc1C ZINC000347252581 335478672 /nfs/dbraw/zinc/47/86/72/335478672.db2.gz QSCSKEJVMJWWKY-YOEHRIQHSA-N 1 2 324.428 4.279 20 0 DIADLO CC[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1nc(C)cs1 ZINC000347643445 335517086 /nfs/dbraw/zinc/51/70/86/335517086.db2.gz WSSANSKMEWVLLY-AWEZNQCLSA-N 1 2 319.474 4.265 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2cccc(OC(C)(C)C)n2)s1 ZINC000348071800 335550672 /nfs/dbraw/zinc/55/06/72/335550672.db2.gz FJIVSOHBRPPKOF-UHFFFAOYSA-N 1 2 319.474 4.049 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2ccncc2Cl)c2ccccn2)cc1 ZINC000348364311 335580941 /nfs/dbraw/zinc/58/09/41/335580941.db2.gz MBYNPELTHSXYKG-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO CC(C)(C)CCCC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000348937117 335622832 /nfs/dbraw/zinc/62/28/32/335622832.db2.gz UPEYYQQFYKDXIV-UHFFFAOYSA-N 1 2 303.381 4.166 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)s1 ZINC000349727954 335694664 /nfs/dbraw/zinc/69/46/64/335694664.db2.gz CAHOAQZYSOXWPP-CYBMUJFWSA-N 1 2 307.850 4.092 20 0 DIADLO Cc1ccc(C)n1C1CCN(c2cc(C)[nH+]c(C(C)C)n2)CC1 ZINC000350736203 335778270 /nfs/dbraw/zinc/77/82/70/335778270.db2.gz ISEPMJSTHDLMKO-UHFFFAOYSA-N 1 2 312.461 4.168 20 0 DIADLO Cc1cc(N2CC=C(C(F)(F)F)CC2)c2cccc(F)c2[nH+]1 ZINC000535992744 335807432 /nfs/dbraw/zinc/80/74/32/335807432.db2.gz BVSSNHSHXSOIHU-UHFFFAOYSA-N 1 2 310.294 4.381 20 0 DIADLO COc1cccc(CSCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000445596421 338501878 /nfs/dbraw/zinc/50/18/78/338501878.db2.gz IKOIMVICCRCGNC-UHFFFAOYSA-N 1 2 324.449 4.373 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(OC2CCCCC2)nc1)c1nccs1 ZINC000536772814 335887645 /nfs/dbraw/zinc/88/76/45/335887645.db2.gz PKJYWSAVIWEVFO-CYBMUJFWSA-N 1 2 317.458 4.100 20 0 DIADLO Cc1ccc(-c2nc(Cn3c4ccccc4[nH+]c3C(C)C)no2)o1 ZINC000445657564 338504761 /nfs/dbraw/zinc/50/47/61/338504761.db2.gz REJOKVMLBXKHHK-UHFFFAOYSA-N 1 2 322.368 4.159 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1cc(CC)no1 ZINC000532234653 335922820 /nfs/dbraw/zinc/92/28/20/335922820.db2.gz HYFGGJUGYUAFDO-NSHDSACASA-N 1 2 308.809 4.140 20 0 DIADLO Cn1ncc2ccc(CNc3cc[nH+]c4c(Cl)cccc34)cc21 ZINC000520301171 335960511 /nfs/dbraw/zinc/96/05/11/335960511.db2.gz JEWFGIQZOFZJEK-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO Cc1ccc2oc(-c3noc(Cc4ccc(C)[nH+]c4)n3)cc2c1 ZINC000445758945 338507598 /nfs/dbraw/zinc/50/75/98/338507598.db2.gz OXZPLEZBRNOJDZ-UHFFFAOYSA-N 1 2 305.337 4.085 20 0 DIADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1csc2c1CCCC2 ZINC000520618422 335995682 /nfs/dbraw/zinc/99/56/82/335995682.db2.gz WMWDJLPYHPAYJZ-UHFFFAOYSA-N 1 2 323.421 4.269 20 0 DIADLO COc1cccc2c(N3CCC(c4ccncc4)CC3)cc[nH+]c12 ZINC000192246076 336022919 /nfs/dbraw/zinc/02/29/19/336022919.db2.gz LFZPJTIXDKOHFE-UHFFFAOYSA-N 1 2 319.408 4.022 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3ccoc3Cl)cc2[nH+]1 ZINC000192291490 336027409 /nfs/dbraw/zinc/02/74/09/336027409.db2.gz LTWJGOPMIAVLFQ-UHFFFAOYSA-N 1 2 317.776 4.404 20 0 DIADLO Cc1nn(C)cc1[C@H](C)Nc1cc(C(C)(C)C)[nH+]c(C(C)C)n1 ZINC000192302375 336027988 /nfs/dbraw/zinc/02/79/88/336027988.db2.gz RWVDSIBXXMWKDG-LBPRGKRZSA-N 1 2 315.465 4.113 20 0 DIADLO Cc1nc([C@@H](C)[N@H+]2Cc3ccccc3[C@H](c3ccccc3)C2)no1 ZINC000351390091 336031798 /nfs/dbraw/zinc/03/17/98/336031798.db2.gz VLDVEIYEIJIBDV-KUHUBIRLSA-N 1 2 319.408 4.087 20 0 DIADLO Cc1nc([C@@H](C)[N@@H+]2Cc3ccccc3[C@H](c3ccccc3)C2)no1 ZINC000351390091 336031800 /nfs/dbraw/zinc/03/18/00/336031800.db2.gz VLDVEIYEIJIBDV-KUHUBIRLSA-N 1 2 319.408 4.087 20 0 DIADLO Cc1nc([C@H](C)[N@H+]2Cc3ccccc3[C@H](c3ccccc3)C2)no1 ZINC000351390092 336031913 /nfs/dbraw/zinc/03/19/13/336031913.db2.gz VLDVEIYEIJIBDV-LIRRHRJNSA-N 1 2 319.408 4.087 20 0 DIADLO Cc1nc([C@H](C)[N@@H+]2Cc3ccccc3[C@H](c3ccccc3)C2)no1 ZINC000351390092 336031915 /nfs/dbraw/zinc/03/19/15/336031915.db2.gz VLDVEIYEIJIBDV-LIRRHRJNSA-N 1 2 319.408 4.087 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2cc(C)ccc2[nH]1)c1ccc(F)cc1F ZINC000351390047 336031960 /nfs/dbraw/zinc/03/19/60/336031960.db2.gz UTXPPKKMDPSVPK-OAHLLOKOSA-N 1 2 315.367 4.390 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2ccc(C)cc2[nH]1)c1ccc(F)cc1F ZINC000351390047 336031961 /nfs/dbraw/zinc/03/19/61/336031961.db2.gz UTXPPKKMDPSVPK-OAHLLOKOSA-N 1 2 315.367 4.390 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C3(c4ccccc4C)CCC3)cc2[nH+]1 ZINC000351539529 336041652 /nfs/dbraw/zinc/04/16/52/336041652.db2.gz AKUGZSOOYSOGST-UHFFFAOYSA-N 1 2 319.408 4.240 20 0 DIADLO CCn1cc(C[N@H+](Cc2ccccc2)Cc2ccccc2F)cn1 ZINC000351661434 336055852 /nfs/dbraw/zinc/05/58/52/336055852.db2.gz LJTJCCFWEDTAGR-UHFFFAOYSA-N 1 2 323.415 4.245 20 0 DIADLO CCn1cc(C[N@@H+](Cc2ccccc2)Cc2ccccc2F)cn1 ZINC000351661434 336055854 /nfs/dbraw/zinc/05/58/54/336055854.db2.gz LJTJCCFWEDTAGR-UHFFFAOYSA-N 1 2 323.415 4.245 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+](C)Cc3cccnc3)n2)cc1 ZINC000351718882 336062076 /nfs/dbraw/zinc/06/20/76/336062076.db2.gz KWNNRXKEALEYIH-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+](C)Cc3cccnc3)n2)cc1 ZINC000351718882 336062077 /nfs/dbraw/zinc/06/20/77/336062077.db2.gz KWNNRXKEALEYIH-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)[C@@H](C)c3ccccn3)co2)cc1 ZINC000351794382 336069405 /nfs/dbraw/zinc/06/94/05/336069405.db2.gz BBWSRVJKOCGAKS-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)[C@@H](C)c3ccccn3)co2)cc1 ZINC000351794382 336069406 /nfs/dbraw/zinc/06/94/06/336069406.db2.gz BBWSRVJKOCGAKS-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+](C)Cc3cccc(C)n3)n2)cc1 ZINC000351877003 336075602 /nfs/dbraw/zinc/07/56/02/336075602.db2.gz AFHYIAGZGUOAAX-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+](C)Cc3cccc(C)n3)n2)cc1 ZINC000351877003 336075603 /nfs/dbraw/zinc/07/56/03/336075603.db2.gz AFHYIAGZGUOAAX-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO COC(=O)[C@@H]([NH2+]C1CCC(c2ccccc2)CC1)c1ccccc1 ZINC000324284431 336129857 /nfs/dbraw/zinc/12/98/57/336129857.db2.gz PXITZTIMGQIEOE-UUKMXZOPSA-N 1 2 323.436 4.217 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC000332484327 336172740 /nfs/dbraw/zinc/17/27/40/336172740.db2.gz NIOBKLSGNDRWPV-BZUAXINKSA-N 1 2 301.434 4.179 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000351930621 336180533 /nfs/dbraw/zinc/18/05/33/336180533.db2.gz IMBKIVROQGOOHE-GJZGRUSLSA-N 1 2 315.804 4.029 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1ncc(Cl)s1 ZINC000352001656 336187552 /nfs/dbraw/zinc/18/75/52/336187552.db2.gz HBANWUZYFYPOGX-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1ncc(Cl)s1 ZINC000352001656 336187554 /nfs/dbraw/zinc/18/75/54/336187554.db2.gz HBANWUZYFYPOGX-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO CCSc1cccc(C[N@H+](C)Cc2ncc(CC)s2)c1 ZINC000352010662 336188502 /nfs/dbraw/zinc/18/85/02/336188502.db2.gz HQLIFIVFNKMQDF-UHFFFAOYSA-N 1 2 306.500 4.450 20 0 DIADLO CCSc1cccc(C[N@@H+](C)Cc2ncc(CC)s2)c1 ZINC000352010662 336188505 /nfs/dbraw/zinc/18/85/05/336188505.db2.gz HQLIFIVFNKMQDF-UHFFFAOYSA-N 1 2 306.500 4.450 20 0 DIADLO OC[C@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1ccsc1 ZINC000352030947 336190754 /nfs/dbraw/zinc/19/07/54/336190754.db2.gz BSMLGEIVKLHREV-HNNXBMFYSA-N 1 2 322.499 4.076 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2cc(Cl)ccc2Cl)s1 ZINC000352296250 336210747 /nfs/dbraw/zinc/21/07/47/336210747.db2.gz DVGUOKMPYCMFFB-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2cc(Cl)ccc2Cl)s1 ZINC000352296250 336210746 /nfs/dbraw/zinc/21/07/46/336210746.db2.gz DVGUOKMPYCMFFB-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1nccn1-c1ccccc1 ZINC000352334899 336212944 /nfs/dbraw/zinc/21/29/44/336212944.db2.gz MWMUBSUDLOWMQY-RLFYNMQTSA-N 1 2 321.424 4.440 20 0 DIADLO Fc1cc(C[N@@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)ccc1Cl ZINC000352429233 336218054 /nfs/dbraw/zinc/21/80/54/336218054.db2.gz ATLUFVKMIVLWOT-JKSUJKDBSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cc(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)ccc1Cl ZINC000352429233 336218055 /nfs/dbraw/zinc/21/80/55/336218055.db2.gz ATLUFVKMIVLWOT-JKSUJKDBSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cc(C[N@@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)ccc1Cl ZINC000352429231 336218136 /nfs/dbraw/zinc/21/81/36/336218136.db2.gz ATLUFVKMIVLWOT-HOTGVXAUSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cc(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)ccc1Cl ZINC000352429231 336218137 /nfs/dbraw/zinc/21/81/37/336218137.db2.gz ATLUFVKMIVLWOT-HOTGVXAUSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c1 ZINC000352449280 336219662 /nfs/dbraw/zinc/21/96/62/336219662.db2.gz YLGGXZLBOSFIEX-JKSUJKDBSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c1 ZINC000352449280 336219663 /nfs/dbraw/zinc/21/96/63/336219663.db2.gz YLGGXZLBOSFIEX-JKSUJKDBSA-N 1 2 309.812 4.013 20 0 DIADLO C[C@@H](c1noc(-c2ccccc2)n1)[N@@H+]1CCC=C(c2ccco2)C1 ZINC000352543542 336223569 /nfs/dbraw/zinc/22/35/69/336223569.db2.gz GJIQKDDQIUYTMX-AWEZNQCLSA-N 1 2 321.380 4.180 20 0 DIADLO C[C@@H](c1noc(-c2ccccc2)n1)[N@H+]1CCC=C(c2ccco2)C1 ZINC000352543542 336223570 /nfs/dbraw/zinc/22/35/70/336223570.db2.gz GJIQKDDQIUYTMX-AWEZNQCLSA-N 1 2 321.380 4.180 20 0 DIADLO CC1(C)C[C@@H]1CNC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000352597503 336226272 /nfs/dbraw/zinc/22/62/72/336226272.db2.gz JRIMAQLOJLEPCL-CYBMUJFWSA-N 1 2 311.385 4.042 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000352669695 336229604 /nfs/dbraw/zinc/22/96/04/336229604.db2.gz AQELJXYRKXHXJO-UHFFFAOYSA-N 1 2 301.283 4.378 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000352669695 336229605 /nfs/dbraw/zinc/22/96/05/336229605.db2.gz AQELJXYRKXHXJO-UHFFFAOYSA-N 1 2 301.283 4.378 20 0 DIADLO c1coc(C2=CCC[N@@H+](Cc3nnc(-c4ccccc4)s3)C2)c1 ZINC000367134349 336232074 /nfs/dbraw/zinc/23/20/74/336232074.db2.gz WZCTZIGIRPYAJO-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO c1coc(C2=CCC[N@H+](Cc3nnc(-c4ccccc4)s3)C2)c1 ZINC000367134349 336232075 /nfs/dbraw/zinc/23/20/75/336232075.db2.gz WZCTZIGIRPYAJO-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cccc(C(F)F)c1 ZINC000352750971 336234727 /nfs/dbraw/zinc/23/47/27/336234727.db2.gz SBZYLFMSBLPSRQ-UHFFFAOYSA-N 1 2 313.307 4.062 20 0 DIADLO C[N@H+](Cc1cccc(F)c1)Cc1ccccc1Br ZINC000042206060 336237296 /nfs/dbraw/zinc/23/72/96/336237296.db2.gz ZFJCJAYJLWRJAU-UHFFFAOYSA-N 1 2 308.194 4.220 20 0 DIADLO C[N@@H+](Cc1cccc(F)c1)Cc1ccccc1Br ZINC000042206060 336237297 /nfs/dbraw/zinc/23/72/97/336237297.db2.gz ZFJCJAYJLWRJAU-UHFFFAOYSA-N 1 2 308.194 4.220 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1ncc(C(C)(C)C)o1 ZINC000103483999 336242047 /nfs/dbraw/zinc/24/20/47/336242047.db2.gz BOHHQMJKOOVHNG-UHFFFAOYSA-N 1 2 302.418 4.006 20 0 DIADLO CCCn1cc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)cn1 ZINC000532359294 336243176 /nfs/dbraw/zinc/24/31/76/336243176.db2.gz XGSZFMSVXXJJKL-UHFFFAOYSA-N 1 2 324.255 4.379 20 0 DIADLO Oc1cccc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)c1 ZINC000532359107 336243217 /nfs/dbraw/zinc/24/32/17/336243217.db2.gz HJDMPCLELANCSN-UHFFFAOYSA-N 1 2 308.208 4.478 20 0 DIADLO Cc1cccc2[nH+]c(CNC(=O)Nc3cccc(C(C)C)c3)cn21 ZINC000532351300 336243683 /nfs/dbraw/zinc/24/36/83/336243683.db2.gz NBPQIDKIEFFTBJ-UHFFFAOYSA-N 1 2 322.412 4.088 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(Cl)c2)C[C@@H](c2ccsc2)O1 ZINC000532352201 336243743 /nfs/dbraw/zinc/24/37/43/336243743.db2.gz SGMHVIYEXXZLCG-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(Cl)c2)C[C@@H](c2ccsc2)O1 ZINC000532352201 336243744 /nfs/dbraw/zinc/24/37/44/336243744.db2.gz SGMHVIYEXXZLCG-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](Cc1nnc(C2CC2)n1C1CC1)C1CC1 ZINC000352817440 336253323 /nfs/dbraw/zinc/25/33/23/336253323.db2.gz QMKUBVYGAFQNDH-AWEZNQCLSA-N 1 2 322.456 4.216 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](Cc1nnc(C2CC2)n1C1CC1)C1CC1 ZINC000352817440 336253324 /nfs/dbraw/zinc/25/33/24/336253324.db2.gz QMKUBVYGAFQNDH-AWEZNQCLSA-N 1 2 322.456 4.216 20 0 DIADLO CC(C)[N@@H+](Cc1cccc(OCC(F)(F)F)c1)CC(F)F ZINC000532623847 336257796 /nfs/dbraw/zinc/25/77/96/336257796.db2.gz FSWNVWLCPAGXFU-UHFFFAOYSA-N 1 2 311.294 4.103 20 0 DIADLO CC(C)[N@H+](Cc1cccc(OCC(F)(F)F)c1)CC(F)F ZINC000532623847 336257797 /nfs/dbraw/zinc/25/77/97/336257797.db2.gz FSWNVWLCPAGXFU-UHFFFAOYSA-N 1 2 311.294 4.103 20 0 DIADLO CC1(C)Cc2cc(CNc3cccc(-n4cc[nH+]c4)c3)ccc2O1 ZINC000324807377 336259003 /nfs/dbraw/zinc/25/90/03/336259003.db2.gz RGYHUBLYDXDNAK-UHFFFAOYSA-N 1 2 319.408 4.198 20 0 DIADLO FCC[NH2+]C1(c2noc(C3CCCCC3)n2)CCCCCC1 ZINC000580363781 336260258 /nfs/dbraw/zinc/26/02/58/336260258.db2.gz NHZYWEIFDZZYCT-UHFFFAOYSA-N 1 2 309.429 4.226 20 0 DIADLO c1ccc2c(c1)SCC[C@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000192751509 336260642 /nfs/dbraw/zinc/26/06/42/336260642.db2.gz DOIULOHQQACKTP-MRXNPFEDSA-N 1 2 311.454 4.331 20 0 DIADLO Cc1cccn2c(CNc3ccccc3OC(C)(C)C)c[nH+]c12 ZINC000532743451 336269260 /nfs/dbraw/zinc/26/92/60/336269260.db2.gz HPFKESWAPHCRBI-UHFFFAOYSA-N 1 2 309.413 4.432 20 0 DIADLO CN(C)c1cccc(C[N@H+](C)Cc2csc(C(C)(C)C)n2)c1 ZINC000532747938 336269541 /nfs/dbraw/zinc/26/95/41/336269541.db2.gz QNIVTLXOEFGNLR-UHFFFAOYSA-N 1 2 317.502 4.139 20 0 DIADLO CN(C)c1cccc(C[N@@H+](C)Cc2csc(C(C)(C)C)n2)c1 ZINC000532747938 336269542 /nfs/dbraw/zinc/26/95/42/336269542.db2.gz QNIVTLXOEFGNLR-UHFFFAOYSA-N 1 2 317.502 4.139 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@@H](C)c2cc3ccccc3o2)n1 ZINC000182635452 336277648 /nfs/dbraw/zinc/27/76/48/336277648.db2.gz YAXQSQLYRQNYMO-ZDUSSCGKSA-N 1 2 313.401 4.255 20 0 DIADLO COc1ccc2c(c1)CCC[C@@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000325066759 336278553 /nfs/dbraw/zinc/27/85/53/336278553.db2.gz VTYPTPWGRXUMLR-IBGZPJMESA-N 1 2 323.440 4.180 20 0 DIADLO Cc1cc(C)c(NC(=O)CNc2ccc3ccccc3[nH+]2)c(C)c1 ZINC000301055718 336287535 /nfs/dbraw/zinc/28/75/35/336287535.db2.gz GZNHUORHYJCNRF-UHFFFAOYSA-N 1 2 319.408 4.211 20 0 DIADLO Cc1cc(NCc2cccc(Cl)c2)nc(-c2cccnc2)[nH+]1 ZINC000301080211 336288938 /nfs/dbraw/zinc/28/89/38/336288938.db2.gz JVWQBLBAXGETRN-UHFFFAOYSA-N 1 2 310.788 4.113 20 0 DIADLO CC(C)C(=O)Nc1ccc(CNc2ccc3ccccc3[nH+]2)cc1 ZINC000301088301 336289429 /nfs/dbraw/zinc/28/94/29/336289429.db2.gz QDRLWJWUNLESFJ-UHFFFAOYSA-N 1 2 319.408 4.441 20 0 DIADLO CC(C)Cc1ccc(C(=O)C2CCN(c3cccc[nH+]3)CC2)cc1 ZINC000301122933 336291121 /nfs/dbraw/zinc/29/11/21/336291121.db2.gz YGLJFBWUQSETLH-UHFFFAOYSA-N 1 2 322.452 4.379 20 0 DIADLO c1ccc2[nH+]c(NCc3ccc4c(c3)OCCCO4)ccc2c1 ZINC000301153960 336292279 /nfs/dbraw/zinc/29/22/79/336292279.db2.gz PAILEQTXTNGMDF-UHFFFAOYSA-N 1 2 306.365 4.008 20 0 DIADLO CCc1cc(N[C@H](C)c2cccs2)nc(-c2ccncc2)[nH+]1 ZINC000301165575 336292918 /nfs/dbraw/zinc/29/29/18/336292918.db2.gz HFNVHFQCAJEPEC-GFCCVEGCSA-N 1 2 310.426 4.336 20 0 DIADLO FC(F)COc1cccc(CNc2ccc3ccccc3[nH+]2)c1 ZINC000301189835 336294044 /nfs/dbraw/zinc/29/40/44/336294044.db2.gz RCZHYGQWLWWXBL-UHFFFAOYSA-N 1 2 314.335 4.491 20 0 DIADLO CC(C)c1nc(NCc2sccc2Br)cc[nH+]1 ZINC000301245760 336296441 /nfs/dbraw/zinc/29/64/41/336296441.db2.gz OATFILUHRANFHO-UHFFFAOYSA-N 1 2 312.236 4.036 20 0 DIADLO Cc1cc(NCC(C)(C)c2cccs2)nc(-c2cccnc2)[nH+]1 ZINC000301260221 336297330 /nfs/dbraw/zinc/29/73/30/336297330.db2.gz GNYJDQQTHWLKOY-UHFFFAOYSA-N 1 2 324.453 4.298 20 0 DIADLO Cc1ccccc1CNc1nc(-c2ccncc2)[nH+]c(C)c1C ZINC000301268101 336297771 /nfs/dbraw/zinc/29/77/71/336297771.db2.gz MUYSCPJBXIJJKD-UHFFFAOYSA-N 1 2 304.397 4.076 20 0 DIADLO Cc1[nH+]c(-c2ccncc2)nc(N[C@@H]2CCc3ccccc32)c1C ZINC000301277505 336298314 /nfs/dbraw/zinc/29/83/14/336298314.db2.gz PDPAORQEGXFJKU-GOSISDBHSA-N 1 2 316.408 4.255 20 0 DIADLO Fc1ccc2c(c1)[C@H](Nc1cc[nH+]c(C3CC3)n1)CCS2 ZINC000301297165 336299546 /nfs/dbraw/zinc/29/95/46/336299546.db2.gz WCXBOOSCNXLNEG-CYBMUJFWSA-N 1 2 301.390 4.142 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CCN2c2cc[nH+]c(C3CC3)n2)o1 ZINC000301425770 336305847 /nfs/dbraw/zinc/30/58/47/336305847.db2.gz GQUORVALQCPIJG-XJKSGUPXSA-N 1 2 311.429 4.487 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CCN2c2cc[nH+]c(C3CC3)n2)o1 ZINC000301425769 336305950 /nfs/dbraw/zinc/30/59/50/336305950.db2.gz GQUORVALQCPIJG-CZUORRHYSA-N 1 2 311.429 4.487 20 0 DIADLO COc1ccc([C@@H]2CCN(c3cc(C(F)(F)F)cc[nH+]3)C2)cc1 ZINC000301440827 336306873 /nfs/dbraw/zinc/30/68/73/336306873.db2.gz MPBDLVACSNDRBA-CYBMUJFWSA-N 1 2 322.330 4.103 20 0 DIADLO c1ccc([C@@H]2OCC[C@H]2CNc2ccc3ccccc3[nH+]2)cc1 ZINC000301442465 336307072 /nfs/dbraw/zinc/30/70/72/336307072.db2.gz UTUMMZZRAONZPW-PXNSSMCTSA-N 1 2 304.393 4.425 20 0 DIADLO C[C@H]1CN(c2cc(C(F)(F)F)cc[nH+]2)C[C@H](c2ccccc2)O1 ZINC000301456079 336307872 /nfs/dbraw/zinc/30/78/72/336307872.db2.gz WOCITLHCQPBJJK-SWLSCSKDSA-N 1 2 322.330 4.067 20 0 DIADLO Clc1ccc(NCc2ccc(N3CCCCCC3)[nH+]c2)nc1 ZINC000301464011 336308426 /nfs/dbraw/zinc/30/84/26/336308426.db2.gz VZJYZPPPCLXZPB-UHFFFAOYSA-N 1 2 316.836 4.123 20 0 DIADLO c1ccc([C@H](Nc2cc(N3CCCCC3)nc[nH+]2)C2CC2)cc1 ZINC000301494882 336310271 /nfs/dbraw/zinc/31/02/71/336310271.db2.gz AGSLKOQOJUEZBR-IBGZPJMESA-N 1 2 308.429 4.030 20 0 DIADLO c1ccc([C@H](Nc2cc(N3CCCCC3)[nH+]cn2)C2CC2)cc1 ZINC000301494882 336310272 /nfs/dbraw/zinc/31/02/72/336310272.db2.gz AGSLKOQOJUEZBR-IBGZPJMESA-N 1 2 308.429 4.030 20 0 DIADLO Cc1cc(N(Cc2cccs2)Cc2cccs2)nc[nH+]1 ZINC000301509744 336311547 /nfs/dbraw/zinc/31/15/47/336311547.db2.gz CTOOOSOSMLAAFU-UHFFFAOYSA-N 1 2 301.440 4.115 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CC[C@@H](Cc3ccccc3)C2)c1 ZINC000301525502 336312493 /nfs/dbraw/zinc/31/24/93/336312493.db2.gz FXQQVWOTOUQTKN-AWEZNQCLSA-N 1 2 306.331 4.169 20 0 DIADLO COCCOc1cc(C)ccc1CNc1ccc2ccccc2[nH+]1 ZINC000301536833 336313170 /nfs/dbraw/zinc/31/31/70/336313170.db2.gz AGYHGAIYWCUOLF-UHFFFAOYSA-N 1 2 322.408 4.181 20 0 DIADLO C[C@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1nc2ccccc2[nH]1 ZINC000301545406 336313861 /nfs/dbraw/zinc/31/38/61/336313861.db2.gz WPASITRLJXGZOA-VIFPVBQESA-N 1 2 306.291 4.150 20 0 DIADLO Cc1cnc([C@@H](Nc2cc[nH+]c(C(C)(C)C)n2)C2CC2)s1 ZINC000301583749 336316406 /nfs/dbraw/zinc/31/64/06/336316406.db2.gz OGDQULKOLFMMHQ-ZDUSSCGKSA-N 1 2 302.447 4.102 20 0 DIADLO O=C(Nc1ccc(F)cc1)c1ccc(CNc2cccc[nH+]2)cc1 ZINC000301628304 336319271 /nfs/dbraw/zinc/31/92/71/336319271.db2.gz BQNIBFWHGOAUJS-UHFFFAOYSA-N 1 2 321.355 4.085 20 0 DIADLO Cc1cc(N2CCC[C@@H]2c2nc3ccccc3[nH]2)nc(C(C)C)[nH+]1 ZINC000301633548 336319557 /nfs/dbraw/zinc/31/95/57/336319557.db2.gz JZIZKZCNQUIVOE-MRXNPFEDSA-N 1 2 321.428 4.126 20 0 DIADLO CC(C)[C@H](Nc1cc[nH+]c(C2CC2)n1)c1ccc(F)cc1F ZINC000301639333 336320005 /nfs/dbraw/zinc/32/00/05/336320005.db2.gz MRDRQFBTQVCUKW-INIZCTEOSA-N 1 2 303.356 4.441 20 0 DIADLO Cc1cc(N[C@@H]2CCC[C@@H]3OCC[C@@H]32)c2cccc(F)c2[nH+]1 ZINC000301653751 336320970 /nfs/dbraw/zinc/32/09/70/336320970.db2.gz ABDDRIUSKYNAMX-VMGRFDJRSA-N 1 2 300.377 4.052 20 0 DIADLO CCOC1CCN(c2cc(C(C)(C)C)[nH+]c(C(C)(C)C)n2)CC1 ZINC000301668091 336322146 /nfs/dbraw/zinc/32/21/46/336322146.db2.gz MXVKJEKPJQKJFM-UHFFFAOYSA-N 1 2 319.493 4.077 20 0 DIADLO CC(C)(C)c1nc(N[C@@H]2CCOC3(CCCCC3)C2)cc[nH+]1 ZINC000301694874 336324084 /nfs/dbraw/zinc/32/40/84/336324084.db2.gz MIDGYVKHTCYBHB-CQSZACIVSA-N 1 2 303.450 4.068 20 0 DIADLO C[C@H](Nc1nc(N)c2ccccc2[nH+]1)c1cc2ccccc2o1 ZINC000301796639 336330571 /nfs/dbraw/zinc/33/05/71/336330571.db2.gz QOAZPLVKAHOXTL-NSHDSACASA-N 1 2 304.353 4.131 20 0 DIADLO C[C@H](Nc1cc(C(F)(F)F)cc[nH+]1)[C@@H]1COc2ccccc21 ZINC000301825810 336332674 /nfs/dbraw/zinc/33/26/74/336332674.db2.gz IVYYLYGILOLLBK-GWCFXTLKSA-N 1 2 308.303 4.077 20 0 DIADLO CC(C)Cn1ccnc1CNc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC000301828479 336332710 /nfs/dbraw/zinc/33/27/10/336332710.db2.gz QJCZAGVWZRZKFL-UHFFFAOYSA-N 1 2 315.465 4.188 20 0 DIADLO CSC1(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)CCOCC1 ZINC000301833208 336333050 /nfs/dbraw/zinc/33/30/50/336333050.db2.gz UPNONOISSXNPOO-UHFFFAOYSA-N 1 2 323.506 4.048 20 0 DIADLO Nc1nc(N2CCC[C@H]2c2ccccc2Cl)[nH+]c2ccccc12 ZINC000301858029 336334588 /nfs/dbraw/zinc/33/45/88/336334588.db2.gz DPALZYDAEUFWJS-INIZCTEOSA-N 1 2 324.815 4.207 20 0 DIADLO CC(C)c1cc(NCc2ccc(Cl)nc2)nc(C(C)C)[nH+]1 ZINC000301872305 336335444 /nfs/dbraw/zinc/33/54/44/336335444.db2.gz KSBOUHZRIUAKMQ-UHFFFAOYSA-N 1 2 304.825 4.384 20 0 DIADLO CC(C)c1cc(N[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)nc(C(C)C)[nH+]1 ZINC000301875374 336335735 /nfs/dbraw/zinc/33/57/35/336335735.db2.gz RQOPFXAIXBHOMP-IAOVAPTHSA-N 1 2 315.461 4.093 20 0 DIADLO Cc1cc(N2CCc3ccccc3[C@@H]2Cc2ccccc2)nc[nH+]1 ZINC000301881485 336335964 /nfs/dbraw/zinc/33/59/64/336335964.db2.gz WDUKUTLIJUSCNR-FQEVSTJZSA-N 1 2 315.420 4.132 20 0 DIADLO CC[C@@H](Nc1[nH+]cnc2c1cnn2C(C)(C)C)c1ccc(C)cc1 ZINC000301884466 336336103 /nfs/dbraw/zinc/33/61/03/336336103.db2.gz LNQDDZIQDNNIFN-MRXNPFEDSA-N 1 2 323.444 4.453 20 0 DIADLO CC(C)COC1CCN(c2cc(C(C)C)[nH+]c(C(C)C)n2)CC1 ZINC000301886837 336336309 /nfs/dbraw/zinc/33/63/09/336336309.db2.gz QJEMFMNTXPQINP-UHFFFAOYSA-N 1 2 319.493 4.365 20 0 DIADLO COC[C@H](Nc1cc(C)[nH+]c2c(F)cccc12)c1ccccc1 ZINC000301922389 336338146 /nfs/dbraw/zinc/33/81/46/336338146.db2.gz DXEMWQMWNYHQHB-SFHVURJKSA-N 1 2 310.372 4.482 20 0 DIADLO COC[C@@H](Nc1ccc2ccccc2[nH+]1)c1ccc(F)c(F)c1 ZINC000301994038 336342028 /nfs/dbraw/zinc/34/20/28/336342028.db2.gz RKWIMQYVZGJUCU-QGZVFWFLSA-N 1 2 314.335 4.313 20 0 DIADLO CCc1cc(N(Cc2ccco2)Cc2cccs2)nc(C)[nH+]1 ZINC000302027308 336344045 /nfs/dbraw/zinc/34/40/45/336344045.db2.gz AIFMELLRNWVUFF-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CCc1cc(N2CC[C@@]3(CC[C@H](C)C3)C2)nc(-c2ccncc2)[nH+]1 ZINC000302033325 336344482 /nfs/dbraw/zinc/34/44/82/336344482.db2.gz DBBVLOLNIWWRKJ-MGPUTAFESA-N 1 2 322.456 4.118 20 0 DIADLO COc1ccccc1[C@@H]1CCCN1c1nc(C)[nH+]c2c1CCCC2 ZINC000302041967 336345029 /nfs/dbraw/zinc/34/50/29/336345029.db2.gz IPVOHYKTFSXLIS-SFHVURJKSA-N 1 2 323.440 4.014 20 0 DIADLO COc1cccc([C@@H]2CCCN2c2nc(C)[nH+]c3c2CCCC3)c1 ZINC000302059695 336346189 /nfs/dbraw/zinc/34/61/89/336346189.db2.gz SHEIXTBUEOAGMM-IBGZPJMESA-N 1 2 323.440 4.014 20 0 DIADLO CCc1cc(Nc2cccc(OCc3ccccn3)c2)nc(C)[nH+]1 ZINC000302066186 336346476 /nfs/dbraw/zinc/34/64/76/336346476.db2.gz WDCWZGJDZWCGSE-UHFFFAOYSA-N 1 2 320.396 4.065 20 0 DIADLO CCc1cc(N2C[C@H](C)[C@H]3CCCC[C@H]32)nc(-c2ccncc2)[nH+]1 ZINC000302066106 336346541 /nfs/dbraw/zinc/34/65/41/336346541.db2.gz AWEJQJAECIROMY-BMGDILEWSA-N 1 2 322.456 4.116 20 0 DIADLO Fc1cc(Br)cc([C@@H]2CCCN2c2cccc[nH+]2)c1 ZINC000302233867 336355552 /nfs/dbraw/zinc/35/55/52/336355552.db2.gz ZRVSRVQBIZTNLT-AWEZNQCLSA-N 1 2 321.193 4.325 20 0 DIADLO COCc1ccccc1CNc1cc[nH+]c2c(OC)cccc12 ZINC000302432372 336358774 /nfs/dbraw/zinc/35/87/74/336358774.db2.gz LNIYYVNUHVSJOL-UHFFFAOYSA-N 1 2 308.381 4.002 20 0 DIADLO Cc1cc(N2CCC(c3ccsc3)CC2)nc(C(C)C)[nH+]1 ZINC000302446186 336358929 /nfs/dbraw/zinc/35/89/29/336358929.db2.gz MYOBBIPXNCGBCW-UHFFFAOYSA-N 1 2 301.459 4.354 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCCc1nn(C)c2ccccc12 ZINC000302454488 336359070 /nfs/dbraw/zinc/35/90/70/336359070.db2.gz UDWDXDHSQOUNIU-UHFFFAOYSA-N 1 2 316.408 4.085 20 0 DIADLO CCOCc1ccc(CNc2cc[nH+]c3c(OC)cccc23)cc1 ZINC000302484504 336359708 /nfs/dbraw/zinc/35/97/08/336359708.db2.gz XKZFKWMBEUAUJF-UHFFFAOYSA-N 1 2 322.408 4.392 20 0 DIADLO COc1cccc2c(NCc3cccc4cccnc43)cc[nH+]c12 ZINC000302492125 336359862 /nfs/dbraw/zinc/35/98/62/336359862.db2.gz ZHXUKLHDZCWPPC-UHFFFAOYSA-N 1 2 315.376 4.404 20 0 DIADLO COc1cccc2c(N[C@H](C)C[C@@H](O)c3ccccc3)cc[nH+]c12 ZINC000302516068 336360612 /nfs/dbraw/zinc/36/06/12/336360612.db2.gz HHEAFIBPSYJZMF-RDTXWAMCSA-N 1 2 322.408 4.168 20 0 DIADLO COc1cccc2c(NC[C@H](C)c3nc(C)cs3)cc[nH+]c12 ZINC000302548445 336361269 /nfs/dbraw/zinc/36/12/69/336361269.db2.gz POZPMEIVIRIQOO-NSHDSACASA-N 1 2 313.426 4.224 20 0 DIADLO Cc1nc(C)c(CNc2cc(C)[nH+]c3c(F)cccc23)s1 ZINC000302614713 336362644 /nfs/dbraw/zinc/36/26/44/336362644.db2.gz CEACAEJZOGDBMU-UHFFFAOYSA-N 1 2 301.390 4.368 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CCc3cc(Cl)ccc3C2)c1 ZINC000302651526 336363520 /nfs/dbraw/zinc/36/35/20/336363520.db2.gz BWQRHXREKONGQH-UHFFFAOYSA-N 1 2 312.722 4.317 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NCc2cc(-c3ccccc3)on2)c1 ZINC000302678514 336364595 /nfs/dbraw/zinc/36/45/95/336364595.db2.gz QVRKFNMMFDZRMT-UHFFFAOYSA-N 1 2 319.286 4.368 20 0 DIADLO Clc1ccc(N2CC[C@H](Nc3cccc[nH+]3)C2)c(Cl)c1 ZINC000302752074 336367807 /nfs/dbraw/zinc/36/78/07/336367807.db2.gz HOFROMKXFCVZEQ-LBPRGKRZSA-N 1 2 308.212 4.079 20 0 DIADLO CC(C)c1nc(NCc2ccccc2CO)cc(C(C)(C)C)[nH+]1 ZINC000302785980 336369003 /nfs/dbraw/zinc/36/90/03/336369003.db2.gz VWXKYFPAACFSRR-UHFFFAOYSA-N 1 2 313.445 4.002 20 0 DIADLO C[C@@H](Nc1nc[nH+]c(N)c1Cl)c1cc(Cl)ccc1Cl ZINC000302830017 336371169 /nfs/dbraw/zinc/37/11/69/336371169.db2.gz KFAFJJBLPVOHTE-ZCFIWIBFSA-N 1 2 317.607 4.192 20 0 DIADLO C[C@@H](Nc1[nH+]cnc(N)c1Cl)c1cc(Cl)ccc1Cl ZINC000302830017 336371170 /nfs/dbraw/zinc/37/11/70/336371170.db2.gz KFAFJJBLPVOHTE-ZCFIWIBFSA-N 1 2 317.607 4.192 20 0 DIADLO COC[C@H](Nc1cc(C)[nH+]c(C(C)C)n1)c1ccc(Cl)cc1 ZINC000302842212 336371707 /nfs/dbraw/zinc/37/17/07/336371707.db2.gz DMTLOEXAZXHKAV-HNNXBMFYSA-N 1 2 319.836 4.361 20 0 DIADLO C[C@@H](Nc1nc[nH+]c(N)c1Cl)c1cc2ccccc2s1 ZINC000302879789 336373030 /nfs/dbraw/zinc/37/30/30/336373030.db2.gz HCGDXCBNUWYCKS-MRVPVSSYSA-N 1 2 304.806 4.100 20 0 DIADLO C[C@@H](Nc1[nH+]cnc(N)c1Cl)c1cc2ccccc2s1 ZINC000302879789 336373031 /nfs/dbraw/zinc/37/30/31/336373031.db2.gz HCGDXCBNUWYCKS-MRVPVSSYSA-N 1 2 304.806 4.100 20 0 DIADLO CC(C)c1nc(N(C)[C@H](C)c2cccnc2)cc(C(C)(C)C)[nH+]1 ZINC000302901173 336373869 /nfs/dbraw/zinc/37/38/69/336373869.db2.gz QQDIKYTXLNZREM-CQSZACIVSA-N 1 2 312.461 4.490 20 0 DIADLO CN(Cc1ccccc1)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000352903023 336375552 /nfs/dbraw/zinc/37/55/52/336375552.db2.gz OLXBQEVCCOOGGB-UHFFFAOYSA-N 1 2 318.376 4.146 20 0 DIADLO Cc1nnc([C@H](C)[NH+]2CCC(=Cc3cccc(F)c3)CC2)s1 ZINC000565155804 336384375 /nfs/dbraw/zinc/38/43/75/336384375.db2.gz GBVCOWBNCGAWBI-LBPRGKRZSA-N 1 2 317.433 4.226 20 0 DIADLO CCCCN(C(=O)Cc1cn2cccc(C)c2[nH+]1)c1ccccc1 ZINC000261382689 336384579 /nfs/dbraw/zinc/38/45/79/336384579.db2.gz HWVCLHVSRJQCIQ-UHFFFAOYSA-N 1 2 321.424 4.019 20 0 DIADLO C[C@H]1CC[C@H](c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)CC1 ZINC000563963205 336388582 /nfs/dbraw/zinc/38/85/82/336388582.db2.gz ITWAHVKLOMXKPX-KOMQPUFPSA-N 1 2 322.412 4.275 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H](C)C(C)(F)F)cc1Br ZINC000389474872 336394746 /nfs/dbraw/zinc/39/47/46/336394746.db2.gz XRKJGQJEQGRHBT-DTWKUNHWSA-N 1 2 322.193 4.152 20 0 DIADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1ccc(OC(F)F)cc1 ZINC000110127755 336396003 /nfs/dbraw/zinc/39/60/03/336396003.db2.gz BQZVNBGZBGHOMY-JTQLQIEISA-N 1 2 305.328 4.129 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(C(C)(C)C(F)(F)F)cc1 ZINC000418041038 336397903 /nfs/dbraw/zinc/39/79/03/336397903.db2.gz WNRQVMFKXUBGNY-UHFFFAOYSA-N 1 2 311.351 4.355 20 0 DIADLO C[C@H]([NH2+]Cc1nccn1C(F)F)c1cc2cccc(F)c2o1 ZINC000353241493 336407833 /nfs/dbraw/zinc/40/78/33/336407833.db2.gz WGBSFWRDGCAZRN-VIFPVBQESA-N 1 2 309.291 4.014 20 0 DIADLO Cc1ccc(CCCNc2cccc(NC(=O)C(C)C)c2)c[nH+]1 ZINC000353833183 336443050 /nfs/dbraw/zinc/44/30/50/336443050.db2.gz SCGVTWHOLNYFQL-UHFFFAOYSA-N 1 2 311.429 4.029 20 0 DIADLO C[C@H]([NH2+][C@H](c1nccn1C)C1CC1)c1ccc(F)cc1Cl ZINC000353879756 336445488 /nfs/dbraw/zinc/44/54/88/336445488.db2.gz IDORXMMYVVHVMO-BONVTDFDSA-N 1 2 307.800 4.015 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccccc1OC ZINC000353924527 336448965 /nfs/dbraw/zinc/44/89/65/336448965.db2.gz SKWWTIBFZYNCKO-NHYWBVRUSA-N 1 2 306.356 4.170 20 0 DIADLO CC(C)(C)[C@@H]1C[C@H](Nc2[nH+]ccc3ccc(F)cc32)CCO1 ZINC000354881068 336486178 /nfs/dbraw/zinc/48/61/78/336486178.db2.gz DOYANSRWCINSTD-ZBFHGGJFSA-N 1 2 302.393 4.380 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(CNc2ccc(-n3cc[nH+]c3)c(F)c2)o1 ZINC000355494350 336511696 /nfs/dbraw/zinc/51/16/96/336511696.db2.gz UUYVBBOGBFWCHJ-SWLSCSKDSA-N 1 2 311.360 4.340 20 0 DIADLO CCC1(CC)CN(C(=O)c2ccc(C)c(Oc3cc[nH+]cc3)c2)C1 ZINC000355860739 336525152 /nfs/dbraw/zinc/52/51/52/336525152.db2.gz HJCDIPIIGLGUHC-UHFFFAOYSA-N 1 2 324.424 4.445 20 0 DIADLO Cc1ccc(NC(=O)C2(Cc3ccc(Cl)cc3)CC2)c(C)[nH+]1 ZINC000355952784 336529624 /nfs/dbraw/zinc/52/96/24/336529624.db2.gz YBCWYXKPLPVXKW-UHFFFAOYSA-N 1 2 314.816 4.313 20 0 DIADLO CCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ncc(C)o2)cc1OC ZINC000356265960 336543316 /nfs/dbraw/zinc/54/33/16/336543316.db2.gz BLDZDQUXQPOVEQ-KBPBESRZSA-N 1 2 318.417 4.192 20 0 DIADLO Cc1scc(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)c1C ZINC000356592874 336555562 /nfs/dbraw/zinc/55/55/62/336555562.db2.gz FUIGXEQJKVSGED-UHFFFAOYSA-N 1 2 322.393 4.268 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2sc3ccccc3c2Cl)n1 ZINC000356862685 336563756 /nfs/dbraw/zinc/56/37/56/336563756.db2.gz JNHWVCNXOCKISW-MRVPVSSYSA-N 1 2 307.806 4.097 20 0 DIADLO C[C@H](NC(=O)[C@@H]1CC12CCCCC2)c1cccc(-n2cc[nH+]c2)c1 ZINC000357011164 336569984 /nfs/dbraw/zinc/56/99/84/336569984.db2.gz JFDSTSDAUPDBOQ-YJBOKZPZSA-N 1 2 323.440 4.020 20 0 DIADLO Cc1cnc(C[NH+]2CCC(=Cc3ccccc3F)CC2)s1 ZINC000357310645 336580248 /nfs/dbraw/zinc/58/02/48/336580248.db2.gz UWKBVLGEUOVRDX-UHFFFAOYSA-N 1 2 302.418 4.270 20 0 DIADLO CSc1cccc(NC(=O)c2cc(C)ccc2-n2cc[nH+]c2)c1 ZINC000357599984 336591970 /nfs/dbraw/zinc/59/19/70/336591970.db2.gz PZRKTWWGTMJZKL-UHFFFAOYSA-N 1 2 323.421 4.155 20 0 DIADLO c1cn(-c2ccc(CSc3nc4ccccc4o3)cc2)c[nH+]1 ZINC000358318599 336623764 /nfs/dbraw/zinc/62/37/64/336623764.db2.gz DGONMSDDHWVEQS-UHFFFAOYSA-N 1 2 307.378 4.306 20 0 DIADLO CCn1ncnc1C[NH2+][C@@H](C)c1cc2c(ccc3ccccc23)o1 ZINC000359062571 336655771 /nfs/dbraw/zinc/65/57/71/336655771.db2.gz YOEWAQYQFZRSIT-ZDUSSCGKSA-N 1 2 320.396 4.048 20 0 DIADLO O=C(c1cccc(Oc2cc[nH+]cc2)c1)N(CC1CC1)CC1CC1 ZINC000359659170 336682011 /nfs/dbraw/zinc/68/20/11/336682011.db2.gz TZWZCKOPCOMBTH-UHFFFAOYSA-N 1 2 322.408 4.136 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1nccn1-c1ccccc1 ZINC000359681664 336683266 /nfs/dbraw/zinc/68/32/66/336683266.db2.gz TVZINMKMPTYELI-UHFFFAOYSA-N 1 2 322.412 4.057 20 0 DIADLO CC[C@H](C)n1ncc(NCc2c[nH+]c(C)n2-c2ccccc2)c1C ZINC000359794062 336687821 /nfs/dbraw/zinc/68/78/21/336687821.db2.gz GNBOJHNUBBCOKF-AWEZNQCLSA-N 1 2 323.444 4.269 20 0 DIADLO Cc1nn(-c2ccccc2)cc1CNc1c[nH+]c2c(c1)CCCC2 ZINC000359823474 336688786 /nfs/dbraw/zinc/68/87/86/336688786.db2.gz VMLQXYQBJJFSJG-UHFFFAOYSA-N 1 2 318.424 4.067 20 0 DIADLO COc1c(C[NH2+][C@@H](C)c2csc(C)n2)oc2ccccc21 ZINC000360987349 336731023 /nfs/dbraw/zinc/73/10/23/336731023.db2.gz OPCHMCADZURERZ-JTQLQIEISA-N 1 2 302.399 4.057 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@H]2CCOc3c(F)ccc(F)c32)o1 ZINC000361190118 336743549 /nfs/dbraw/zinc/74/35/49/336743549.db2.gz YBEAMQYGFBLERZ-HZMBPMFUSA-N 1 2 307.340 4.295 20 0 DIADLO CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]Cc1cscn1 ZINC000361292392 336748999 /nfs/dbraw/zinc/74/89/99/336748999.db2.gz DFQRTVOPIASJMX-INIZCTEOSA-N 1 2 302.443 4.270 20 0 DIADLO Cc1[nH+]c2ccc(C(=O)N(C(C)C)C3CCCCC3)cc2n1C ZINC000361663911 336767904 /nfs/dbraw/zinc/76/79/04/336767904.db2.gz YBBTXOXDHJQJEF-UHFFFAOYSA-N 1 2 313.445 4.065 20 0 DIADLO Cn1ccnc1[C@H]([NH2+]Cc1cc(Cl)sc1Cl)C1CC1 ZINC000362377200 336794159 /nfs/dbraw/zinc/79/41/59/336794159.db2.gz XGZJTMPYMFMSOI-LLVKDONJSA-N 1 2 316.257 4.029 20 0 DIADLO Cn1ccnc1[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)C1CC1 ZINC000362377204 336794265 /nfs/dbraw/zinc/79/42/65/336794265.db2.gz XGZJTMPYMFMSOI-NSHDSACASA-N 1 2 316.257 4.029 20 0 DIADLO Cc1ccc(C(=O)N2CCCCCC2)cc1Oc1cc[nH+]cc1 ZINC000114994771 336807163 /nfs/dbraw/zinc/80/71/63/336807163.db2.gz FGLMSXVKTABGJI-UHFFFAOYSA-N 1 2 310.397 4.199 20 0 DIADLO Cc1ccnc([C@H](Nc2[nH+]ccc3ccc(F)cc32)C2CC2)n1 ZINC000362637931 336807443 /nfs/dbraw/zinc/80/74/43/336807443.db2.gz RABAJRQREBUVSF-MRXNPFEDSA-N 1 2 308.360 4.036 20 0 DIADLO Clc1cc([NH2+][C@@H]2CCC23CCOCC3)ccc1N1CCCC1 ZINC000368524978 336846757 /nfs/dbraw/zinc/84/67/57/336846757.db2.gz CKZSBMXVXQWKGW-QGZVFWFLSA-N 1 2 320.864 4.311 20 0 DIADLO CSc1ccc(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)cc1 ZINC000368772317 336852282 /nfs/dbraw/zinc/85/22/82/336852282.db2.gz ICZHVRLNQFASIL-UHFFFAOYSA-N 1 2 323.421 4.061 20 0 DIADLO Cc1csc(C[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)n1 ZINC000117385619 336854590 /nfs/dbraw/zinc/85/45/90/336854590.db2.gz ZSRFAULZTHNGMT-LBPRGKRZSA-N 1 2 315.467 4.426 20 0 DIADLO Cc1cc(NC(=O)N2C[C@@H](c3ccccc3C)C[C@@H]2C)cc[nH+]1 ZINC000119366807 336886345 /nfs/dbraw/zinc/88/63/45/336886345.db2.gz YUCCHAPROMISBK-HOTGVXAUSA-N 1 2 309.413 4.108 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc2ccc(F)cc2o1)c1nc(C)cs1 ZINC000119507905 336892593 /nfs/dbraw/zinc/89/25/93/336892593.db2.gz VEQUDVPSXWARJV-INIZCTEOSA-N 1 2 319.405 4.147 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)C=Cc2ccc(F)cc2)[nH+]1 ZINC000371246383 336898310 /nfs/dbraw/zinc/89/83/10/336898310.db2.gz DARTWCWYZLUUTQ-DHZHZOJOSA-N 1 2 321.355 4.176 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)CCc2ccc(F)cc2)[nH+]1 ZINC000371247757 336898479 /nfs/dbraw/zinc/89/84/79/336898479.db2.gz QDQWSMAMABFEMM-UHFFFAOYSA-N 1 2 323.371 4.096 20 0 DIADLO CC(C)n1cc[nH+]c1CN1CCCC[C@H]1c1nc2ccccc2o1 ZINC000372012996 336918948 /nfs/dbraw/zinc/91/89/48/336918948.db2.gz KLZUFWWXPWAZNB-INIZCTEOSA-N 1 2 324.428 4.332 20 0 DIADLO Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)Nc2cc[nH+]cc2C)C1 ZINC000120913666 336925302 /nfs/dbraw/zinc/92/53/02/336925302.db2.gz JNQVEQFIHLZBNS-JKSUJKDBSA-N 1 2 309.413 4.108 20 0 DIADLO COc1cc(Cl)c(C)cc1NC(=O)Nc1cc[nH+]cc1C ZINC000122030808 336990943 /nfs/dbraw/zinc/99/09/43/336990943.db2.gz KUXQTYKKWSJTQF-UHFFFAOYSA-N 1 2 305.765 4.004 20 0 DIADLO Clc1ccc(Cl)c(OCCSCCn2cc[nH+]c2)c1 ZINC000122253262 337000377 /nfs/dbraw/zinc/00/03/77/337000377.db2.gz CQQWFQASUKRSKH-UHFFFAOYSA-N 1 2 317.241 4.002 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)Cc2c(C)cccc2C)[nH+]1 ZINC000375055357 337002261 /nfs/dbraw/zinc/00/22/61/337002261.db2.gz AMJMDEJXWKBTCH-UHFFFAOYSA-N 1 2 319.408 4.183 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2nc(Cl)ccc2Cl)n1 ZINC000375127730 337004121 /nfs/dbraw/zinc/00/41/21/337004121.db2.gz RQNNXQYRSKYWTI-OAHLLOKOSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2nc(Cl)ccc2Cl)n1 ZINC000375127730 337004122 /nfs/dbraw/zinc/00/41/22/337004122.db2.gz RQNNXQYRSKYWTI-OAHLLOKOSA-N 1 2 322.239 4.429 20 0 DIADLO CC[C@@H](Nc1cc[nH+]c2c(OC)cccc12)c1c(C)noc1C ZINC000193489205 337014285 /nfs/dbraw/zinc/01/42/85/337014285.db2.gz LZYGMFRIAAKHIP-CQSZACIVSA-N 1 2 311.385 4.411 20 0 DIADLO CCC[C@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc(F)cc1F ZINC000375812073 337020178 /nfs/dbraw/zinc/02/01/78/337020178.db2.gz XMMLGSFHSLEAHG-HOTGVXAUSA-N 1 2 305.372 4.196 20 0 DIADLO Fc1ccc(C=C2CC[NH+](Cc3cscn3)CC2)cc1F ZINC000376064768 337026201 /nfs/dbraw/zinc/02/62/01/337026201.db2.gz FEGGUPUFCXUAND-UHFFFAOYSA-N 1 2 306.381 4.101 20 0 DIADLO COCCC[C@H](C)Nc1cccc(-c2cn3c([nH+]2)CCCC3)c1 ZINC000376167505 337028737 /nfs/dbraw/zinc/02/87/37/337028737.db2.gz RLURTQXKANRZSA-HNNXBMFYSA-N 1 2 313.445 4.113 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](c1ccco1)c1ccccc1 ZINC000376596123 337037598 /nfs/dbraw/zinc/03/75/98/337037598.db2.gz BIIMKBFJSMWPAX-GOSISDBHSA-N 1 2 321.380 4.203 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@H](C)c1ccc(F)cc1F ZINC000425595477 337040942 /nfs/dbraw/zinc/04/09/42/337040942.db2.gz HXLMRPHYZFZHTH-NSHDSACASA-N 1 2 304.340 4.109 20 0 DIADLO c1csc([C@@H]2CCC[N@H+]2Cc2nc3ccccc3s2)n1 ZINC000377200070 337048606 /nfs/dbraw/zinc/04/86/06/337048606.db2.gz ZUZBSBSFRFZUIJ-LBPRGKRZSA-N 1 2 301.440 4.090 20 0 DIADLO c1csc([C@@H]2CCC[N@@H+]2Cc2nc3ccccc3s2)n1 ZINC000377200070 337048607 /nfs/dbraw/zinc/04/86/07/337048607.db2.gz ZUZBSBSFRFZUIJ-LBPRGKRZSA-N 1 2 301.440 4.090 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)[C@H]1C[C@H](C)C[C@H](C)C1 ZINC000377212879 337048831 /nfs/dbraw/zinc/04/88/31/337048831.db2.gz DJUPONXCEPFMPV-HZMVEIRTSA-N 1 2 317.477 4.029 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)C[C@H]1CCC[C@@H](C)C1 ZINC000377228253 337048910 /nfs/dbraw/zinc/04/89/10/337048910.db2.gz ZYZOWUNHRBRGIH-IKGGRYGDSA-N 1 2 317.477 4.173 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1cc2ccccc2[nH]1 ZINC000377391941 337051692 /nfs/dbraw/zinc/05/16/92/337051692.db2.gz NTIOVVKXQNEKJA-GOSISDBHSA-N 1 2 308.429 4.112 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC000377391941 337051693 /nfs/dbraw/zinc/05/16/93/337051693.db2.gz NTIOVVKXQNEKJA-GOSISDBHSA-N 1 2 308.429 4.112 20 0 DIADLO c1cc([C@@H]2CCCC[N@H+]2Cc2cnc(C3CCCC3)s2)n[nH]1 ZINC000377633210 337057088 /nfs/dbraw/zinc/05/70/88/337057088.db2.gz WZJFRDLDPKKKOU-INIZCTEOSA-N 1 2 316.474 4.251 20 0 DIADLO c1cc([C@@H]2CCCC[N@@H+]2Cc2cnc(C3CCCC3)s2)n[nH]1 ZINC000377633210 337057089 /nfs/dbraw/zinc/05/70/89/337057089.db2.gz WZJFRDLDPKKKOU-INIZCTEOSA-N 1 2 316.474 4.251 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000377787076 337061095 /nfs/dbraw/zinc/06/10/95/337061095.db2.gz RZVHQRMGCNPISI-IIAWOOMASA-N 1 2 318.461 4.067 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000377787076 337061096 /nfs/dbraw/zinc/06/10/96/337061096.db2.gz RZVHQRMGCNPISI-IIAWOOMASA-N 1 2 318.461 4.067 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2c1ccc(Cl)c2Cl)c1ccccn1 ZINC000378145484 337067212 /nfs/dbraw/zinc/06/72/12/337067212.db2.gz BLJAIZNRSKZPRX-ZANVPECISA-N 1 2 309.196 4.173 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ncoc2-c2ccccc2)o1 ZINC000378153535 337067323 /nfs/dbraw/zinc/06/73/23/337067323.db2.gz JMYPSWFIDUYMDN-XJKSGUPXSA-N 1 2 308.381 4.348 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccncc2)cs1 ZINC000378202842 337068176 /nfs/dbraw/zinc/06/81/76/337068176.db2.gz PMQSOYOQXRDLDP-ACJLOTCBSA-N 1 2 309.438 4.287 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1ccoc1 ZINC000378471929 337073609 /nfs/dbraw/zinc/07/36/09/337073609.db2.gz KEVUFZUMQPURRP-AWEZNQCLSA-N 1 2 305.381 4.368 20 0 DIADLO Clc1ccc(C[N@H+]2CC=C(c3ccc(Cl)nc3)CC2)nc1 ZINC000378487178 337073991 /nfs/dbraw/zinc/07/39/91/337073991.db2.gz YREAVPMGLISNLT-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1ccc(C[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)nc1 ZINC000378487178 337073992 /nfs/dbraw/zinc/07/39/92/337073992.db2.gz YREAVPMGLISNLT-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+]([C@@H](C)c2nc3ccccc3o2)CCO1 ZINC000378483561 337074093 /nfs/dbraw/zinc/07/40/93/337074093.db2.gz ITALRBGTRWUBOZ-HNAYVOBHSA-N 1 2 322.408 4.271 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+]([C@@H](C)c2nc3ccccc3o2)CCO1 ZINC000378483561 337074094 /nfs/dbraw/zinc/07/40/94/337074094.db2.gz ITALRBGTRWUBOZ-HNAYVOBHSA-N 1 2 322.408 4.271 20 0 DIADLO Fc1cc(NCc2ccc(N3CCCC3)[nH+]c2)ccc1Cl ZINC000193641712 337078844 /nfs/dbraw/zinc/07/88/44/337078844.db2.gz OQGOUACCHYIJRQ-UHFFFAOYSA-N 1 2 305.784 4.086 20 0 DIADLO CC(C)c1nc(N[C@H](c2ccccc2)c2cccnc2)cc[nH+]1 ZINC000171925906 337090434 /nfs/dbraw/zinc/09/04/34/337090434.db2.gz MFZNVPUYKQOCHV-GOSISDBHSA-N 1 2 304.397 4.197 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(CC3CCC3)c3ccccc3)ccn12 ZINC000582614986 337114900 /nfs/dbraw/zinc/11/49/00/337114900.db2.gz SQXKTEJSXHEDFP-UHFFFAOYSA-N 1 2 319.408 4.090 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)cs1 ZINC000172909400 337132295 /nfs/dbraw/zinc/13/22/95/337132295.db2.gz HQVIDMGCWHCAEK-UONOGXRCSA-N 1 2 316.470 4.187 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+]2Cc3ccccc3C[C@@H]2C)cs1 ZINC000172909400 337132296 /nfs/dbraw/zinc/13/22/96/337132296.db2.gz HQVIDMGCWHCAEK-UONOGXRCSA-N 1 2 316.470 4.187 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nc(-c3cccc(F)c3)no2)cc1 ZINC000174664820 337142956 /nfs/dbraw/zinc/14/29/56/337142956.db2.gz XBDIXVDKOPPLBM-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1[nH+]cccc1Cc1noc(C[C@@H]2CCCc3ccccc32)n1 ZINC000582776357 337146835 /nfs/dbraw/zinc/14/68/35/337146835.db2.gz ULQHHLHGNQFUNH-KRWDZBQOSA-N 1 2 319.408 4.026 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)s1 ZINC000175522934 337147813 /nfs/dbraw/zinc/14/78/13/337147813.db2.gz ZUOWHHQLBZNZBV-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2)s1 ZINC000175522934 337147814 /nfs/dbraw/zinc/14/78/14/337147814.db2.gz ZUOWHHQLBZNZBV-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@@H](C)[C@@H]2C)cc1Oc1cc[nH+]cc1 ZINC000177040069 337153026 /nfs/dbraw/zinc/15/30/26/337153026.db2.gz IAEOOFPXKBSYHC-HIFRSBDPSA-N 1 2 310.397 4.053 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@H](C)[C@@H]2C)cc1Oc1cc[nH+]cc1 ZINC000177040051 337153036 /nfs/dbraw/zinc/15/30/36/337153036.db2.gz IAEOOFPXKBSYHC-ZFWWWQNUSA-N 1 2 310.397 4.053 20 0 DIADLO CCC[N@H+](Cc1nc([C@@H](C)SCC)no1)Cc1ccccc1 ZINC000178254307 337161725 /nfs/dbraw/zinc/16/17/25/337161725.db2.gz FCROGZAZNDVFRB-CQSZACIVSA-N 1 2 319.474 4.296 20 0 DIADLO CCC[N@@H+](Cc1nc([C@@H](C)SCC)no1)Cc1ccccc1 ZINC000178254307 337161726 /nfs/dbraw/zinc/16/17/26/337161726.db2.gz FCROGZAZNDVFRB-CQSZACIVSA-N 1 2 319.474 4.296 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1c(F)cccc1Cl)CCO2 ZINC000178166974 337162855 /nfs/dbraw/zinc/16/28/55/337162855.db2.gz MDMIQXQJCNJHLX-OAHLLOKOSA-N 1 2 309.743 4.232 20 0 DIADLO Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000178666916 337166011 /nfs/dbraw/zinc/16/60/11/337166011.db2.gz PRZBDKADLFJCSA-UONOGXRCSA-N 1 2 300.427 4.119 20 0 DIADLO CCCCc1nc(C[N@H+](C)[C@H](CC)c2ccncc2)cs1 ZINC000179704034 337169140 /nfs/dbraw/zinc/16/91/40/337169140.db2.gz TXDXMHRHZLOWNE-MRXNPFEDSA-N 1 2 303.475 4.464 20 0 DIADLO CCCCc1nc(C[N@@H+](C)[C@H](CC)c2ccncc2)cs1 ZINC000179704034 337169141 /nfs/dbraw/zinc/16/91/41/337169141.db2.gz TXDXMHRHZLOWNE-MRXNPFEDSA-N 1 2 303.475 4.464 20 0 DIADLO Cc1ncsc1C[N@H+](C)Cc1cnc(C2CCCC2)s1 ZINC000179426466 337169416 /nfs/dbraw/zinc/16/94/16/337169416.db2.gz IBTJFODBKPSRJR-UHFFFAOYSA-N 1 2 307.488 4.198 20 0 DIADLO Cc1ncsc1C[N@@H+](C)Cc1cnc(C2CCCC2)s1 ZINC000179426466 337169417 /nfs/dbraw/zinc/16/94/17/337169417.db2.gz IBTJFODBKPSRJR-UHFFFAOYSA-N 1 2 307.488 4.198 20 0 DIADLO Oc1ccc(C2=CC[N@H+](Cc3csc(C4CC4)n3)CC2)cc1 ZINC000179458736 337169596 /nfs/dbraw/zinc/16/95/96/337169596.db2.gz PADBBFLWPITEDB-UHFFFAOYSA-N 1 2 312.438 4.015 20 0 DIADLO Oc1ccc(C2=CC[N@@H+](Cc3csc(C4CC4)n3)CC2)cc1 ZINC000179458736 337169597 /nfs/dbraw/zinc/16/95/97/337169597.db2.gz PADBBFLWPITEDB-UHFFFAOYSA-N 1 2 312.438 4.015 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1ncc(-c2ccccc2F)o1 ZINC000179664953 337170833 /nfs/dbraw/zinc/17/08/33/337170833.db2.gz XMVMEMWIDKEZIC-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ncc(-c2ccccc2F)o1 ZINC000179664953 337170834 /nfs/dbraw/zinc/17/08/34/337170834.db2.gz XMVMEMWIDKEZIC-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2csnn2)c2cccs2)cc1 ZINC000179842953 337172236 /nfs/dbraw/zinc/17/22/36/337172236.db2.gz CZFNSEHJXDKVAR-AWEZNQCLSA-N 1 2 321.858 4.132 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)s1 ZINC000180408754 337174248 /nfs/dbraw/zinc/17/42/48/337174248.db2.gz PAHCDQFRNNIVNP-XHDPSFHLSA-N 1 2 302.443 4.333 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)s1 ZINC000180408754 337174249 /nfs/dbraw/zinc/17/42/49/337174249.db2.gz PAHCDQFRNNIVNP-XHDPSFHLSA-N 1 2 302.443 4.333 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+](Cc2ccccn2)C2CC2)o1 ZINC000180861433 337178318 /nfs/dbraw/zinc/17/83/18/337178318.db2.gz BJMLXKPFWOGGTB-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+](Cc2ccccn2)C2CC2)o1 ZINC000180861433 337178319 /nfs/dbraw/zinc/17/83/19/337178319.db2.gz BJMLXKPFWOGGTB-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)oc1C ZINC000180920247 337178664 /nfs/dbraw/zinc/17/86/64/337178664.db2.gz PVVGTOVZOBRTSG-CQSZACIVSA-N 1 2 307.397 4.204 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccccc1F ZINC000180969731 337178970 /nfs/dbraw/zinc/17/89/70/337178970.db2.gz LJQHWAAQMXOQJO-GOSISDBHSA-N 1 2 301.409 4.378 20 0 DIADLO COC[C@H]([NH2+]Cc1ccc(Oc2ccccc2)o1)c1ccco1 ZINC000180990985 337179097 /nfs/dbraw/zinc/17/90/97/337179097.db2.gz GKZPQTJZIYWEGV-INIZCTEOSA-N 1 2 313.353 4.142 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@H](CC2CCC2)c2ccccc2)n1 ZINC000181351479 337181500 /nfs/dbraw/zinc/18/15/00/337181500.db2.gz YIRFQYJBDRWNQR-QGZVFWFLSA-N 1 2 313.445 4.289 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(-c2cccc(Cl)c2)o1)c1ccccn1 ZINC000181900425 337185100 /nfs/dbraw/zinc/18/51/00/337185100.db2.gz QQMQOOHSQPBWKT-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(-c2ccc(Cl)cc2)o1)c1ccccn1 ZINC000182175625 337187157 /nfs/dbraw/zinc/18/71/57/337187157.db2.gz MEEMNAYIERZJIV-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H](C)c1nc(C2CC2)no1 ZINC000183534997 337192069 /nfs/dbraw/zinc/19/20/69/337192069.db2.gz LDMTZRKXIBVQDB-NWDGAFQWSA-N 1 2 311.385 4.413 20 0 DIADLO COc1ccc(Br)c(NCc2ccc(C)[nH+]c2C)c1 ZINC000184427523 337197219 /nfs/dbraw/zinc/19/72/19/337197219.db2.gz AVNREJGXPBOJRC-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO Cc1ccc(CNc2cccc(Oc3ccccn3)c2)c(C)[nH+]1 ZINC000184476685 337198882 /nfs/dbraw/zinc/19/88/82/337198882.db2.gz VGXHBMQFNCXISV-UHFFFAOYSA-N 1 2 305.381 4.498 20 0 DIADLO Cc1cc(NCc2ccc(C)[nH+]c2C)nn1-c1ccc(C)cc1 ZINC000184503213 337199282 /nfs/dbraw/zinc/19/92/82/337199282.db2.gz VWZGGZFCKFYWRC-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO Cc1ccc(CS(=O)(=O)[C@H](C)c2cccc(Cl)c2)c(C)[nH+]1 ZINC000185197931 337202613 /nfs/dbraw/zinc/20/26/13/337202613.db2.gz PCIOQSDIIAPDNU-CYBMUJFWSA-N 1 2 323.845 4.028 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000185230940 337203543 /nfs/dbraw/zinc/20/35/43/337203543.db2.gz UTTAVKSFTMIKAU-APPDUMDISA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000185230940 337203544 /nfs/dbraw/zinc/20/35/44/337203544.db2.gz UTTAVKSFTMIKAU-APPDUMDISA-N 1 2 306.331 4.082 20 0 DIADLO Cc1oc2ccccc2c1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000185381481 337204549 /nfs/dbraw/zinc/20/45/49/337204549.db2.gz NTAVGWHLNJYFRZ-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO C[C@H](CSCCc1[nH+]c2ccccc2n1C)C(F)(F)F ZINC000582927461 337215694 /nfs/dbraw/zinc/21/56/94/337215694.db2.gz HYYDVCFEJMYBEH-SNVBAGLBSA-N 1 2 302.365 4.047 20 0 DIADLO Cc1sc2nc(C)nc(N[C@@H](c3[nH]cc[nH+]3)C(C)C)c2c1C ZINC000582937415 337219707 /nfs/dbraw/zinc/21/97/07/337219707.db2.gz QIPDKKHPPWCRIN-CYBMUJFWSA-N 1 2 315.446 4.149 20 0 DIADLO CC1(C)C[N@H+](C/C=C\c2ccc(F)cc2F)[C@@H]1c1ccncc1 ZINC000582980437 337222571 /nfs/dbraw/zinc/22/25/71/337222571.db2.gz IFKVTLNMBAWJSF-DDKKJVIOSA-N 1 2 314.379 4.456 20 0 DIADLO CC1(C)C[N@@H+](C/C=C\c2ccc(F)cc2F)[C@@H]1c1ccncc1 ZINC000582980437 337222572 /nfs/dbraw/zinc/22/25/72/337222572.db2.gz IFKVTLNMBAWJSF-DDKKJVIOSA-N 1 2 314.379 4.456 20 0 DIADLO C[C@@H]1Oc2cc(F)ccc2[C@H]1[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000582986576 337222938 /nfs/dbraw/zinc/22/29/38/337222938.db2.gz CHFKICJKMBDSCG-QFYYESIMSA-N 1 2 320.433 4.192 20 0 DIADLO CN(c1cc[nH+]c2ccncc21)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000583046151 337229829 /nfs/dbraw/zinc/22/98/29/337229829.db2.gz FLTSPBZDDYLFON-TXEJJXNPSA-N 1 2 309.335 4.187 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+]CCc2ccncc2)C(F)F)c1 ZINC000583093129 337239924 /nfs/dbraw/zinc/23/99/24/337239924.db2.gz FTWPIRDPBQBLTC-KRWDZBQOSA-N 1 2 320.383 4.007 20 0 DIADLO Cc1coc2ccc(NC(=O)c3cccc(-n4cc[nH+]c4)c3)cc12 ZINC000185804655 337250469 /nfs/dbraw/zinc/25/04/69/337250469.db2.gz WFLQGFURMNKSIU-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cc(O)cc(F)c1 ZINC000186165080 337254055 /nfs/dbraw/zinc/25/40/55/337254055.db2.gz KRXBRVGANMLVTF-NSHDSACASA-N 1 2 316.401 4.334 20 0 DIADLO CCSc1cccc(C[N@@H+]2CCCC[C@@H]2c2ncc[nH]2)c1 ZINC000186203118 337254643 /nfs/dbraw/zinc/25/46/43/337254643.db2.gz WSNKEYSXTUCLER-MRXNPFEDSA-N 1 2 301.459 4.249 20 0 DIADLO CCSc1cccc(C[N@H+]2CCCC[C@@H]2c2ncc[nH]2)c1 ZINC000186203118 337254644 /nfs/dbraw/zinc/25/46/44/337254644.db2.gz WSNKEYSXTUCLER-MRXNPFEDSA-N 1 2 301.459 4.249 20 0 DIADLO c1csc([C@H]2CSCC[N@H+]2Cc2coc3ccccc23)n1 ZINC000186639461 337258102 /nfs/dbraw/zinc/25/81/02/337258102.db2.gz IVBWHBZCSDASKX-CQSZACIVSA-N 1 2 316.451 4.179 20 0 DIADLO c1csc([C@H]2CSCC[N@@H+]2Cc2coc3ccccc23)n1 ZINC000186639461 337258103 /nfs/dbraw/zinc/25/81/03/337258103.db2.gz IVBWHBZCSDASKX-CQSZACIVSA-N 1 2 316.451 4.179 20 0 DIADLO CC[C@H]1C[N@H+](Cc2nc(-c3ccccc3Cl)cs2)CCO1 ZINC000186651337 337258215 /nfs/dbraw/zinc/25/82/15/337258215.db2.gz ZCCJCXUPZXKFAN-LBPRGKRZSA-N 1 2 322.861 4.074 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2nc(-c3ccccc3Cl)cs2)CCO1 ZINC000186651337 337258216 /nfs/dbraw/zinc/25/82/16/337258216.db2.gz ZCCJCXUPZXKFAN-LBPRGKRZSA-N 1 2 322.861 4.074 20 0 DIADLO Cc1ccc(C[S@@](=O)Cc2ccc(C(C)(C)C)cc2)c(C)[nH+]1 ZINC000187134433 337262855 /nfs/dbraw/zinc/26/28/55/337262855.db2.gz BDRHFYMBGDGJAL-QFIPXVFZSA-N 1 2 315.482 4.445 20 0 DIADLO Cc1cc(C[S@](=O)Cc2ccc(C)[nH+]c2C)c2ccccc2n1 ZINC000187161468 337263437 /nfs/dbraw/zinc/26/34/37/337263437.db2.gz ABVCIVRQWMUYEA-HSZRJFAPSA-N 1 2 324.449 4.004 20 0 DIADLO Cc1cc(C[S@@](=O)Cc2ccc(C)[nH+]c2C)c2ccccc2n1 ZINC000187161484 337263460 /nfs/dbraw/zinc/26/34/60/337263460.db2.gz ABVCIVRQWMUYEA-QHCPKHFHSA-N 1 2 324.449 4.004 20 0 DIADLO CC[C@H]1[C@H](C)CCN1C(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000187480050 337266139 /nfs/dbraw/zinc/26/61/39/337266139.db2.gz WFIVWEUJJZZQKI-KDOFPFPSSA-N 1 2 324.424 4.443 20 0 DIADLO COc1ccc(-c2ccncc2)cc1CNc1c[nH+]ccc1C ZINC000187606814 337267549 /nfs/dbraw/zinc/26/75/49/337267549.db2.gz ZEWZGCMRMCXKFS-UHFFFAOYSA-N 1 2 305.381 4.073 20 0 DIADLO Fc1ccc(CNc2ccc(-c3cn4c([nH+]3)CCCC4)cc2)cn1 ZINC000189155972 337277102 /nfs/dbraw/zinc/27/71/02/337277102.db2.gz OPLQEPLIDQUEFN-UHFFFAOYSA-N 1 2 322.387 4.033 20 0 DIADLO Fc1ccc(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)cn1 ZINC000189155157 337277134 /nfs/dbraw/zinc/27/71/34/337277134.db2.gz DIFMQKMYTOUUAR-UHFFFAOYSA-N 1 2 322.387 4.033 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000189930806 337283911 /nfs/dbraw/zinc/28/39/11/337283911.db2.gz PNBSAAFBJAFACO-OAHLLOKOSA-N 1 2 322.861 4.451 20 0 DIADLO COc1cccc(Cl)c1C[N@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000189930806 337283912 /nfs/dbraw/zinc/28/39/12/337283912.db2.gz PNBSAAFBJAFACO-OAHLLOKOSA-N 1 2 322.861 4.451 20 0 DIADLO CCN(C)c1ccc(CNc2ccc3oc(C4CC4)nc3c2)c[nH+]1 ZINC000190830261 337290184 /nfs/dbraw/zinc/29/01/84/337290184.db2.gz GGCQLQDLWCZLCB-UHFFFAOYSA-N 1 2 322.412 4.168 20 0 DIADLO CCO[C@H](C)c1nc(COc2ccc(C)[nH+]c2CC)cs1 ZINC000190768183 337290719 /nfs/dbraw/zinc/29/07/19/337290719.db2.gz DPGBZSHAQAGJPG-GFCCVEGCSA-N 1 2 306.431 4.085 20 0 DIADLO CC(C)N(C)c1ccc(CNc2ccc3ncccc3c2)c[nH+]1 ZINC000191381182 337296434 /nfs/dbraw/zinc/29/64/34/337296434.db2.gz PYABBTPTNJQAAI-UHFFFAOYSA-N 1 2 306.413 4.087 20 0 DIADLO CC[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccc(F)cn1 ZINC000321914641 337302816 /nfs/dbraw/zinc/30/28/16/337302816.db2.gz XSXFAIXKJLHIPZ-MRXNPFEDSA-N 1 2 314.408 4.169 20 0 DIADLO COc1ccc(Cl)c(C[NH2+]C(C)(C)c2ncc(C)s2)c1 ZINC000192181418 337303719 /nfs/dbraw/zinc/30/37/19/337303719.db2.gz OILCHNWWKSCZNG-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO COc1ccccc1C[N@H+](Cc1nc2ccccc2s1)C1CC1 ZINC000532920598 337305861 /nfs/dbraw/zinc/30/58/61/337305861.db2.gz LFQHYRGIZIIZSA-UHFFFAOYSA-N 1 2 324.449 4.470 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1nc2ccccc2s1)C1CC1 ZINC000532920598 337305862 /nfs/dbraw/zinc/30/58/62/337305862.db2.gz LFQHYRGIZIIZSA-UHFFFAOYSA-N 1 2 324.449 4.470 20 0 DIADLO Clc1ccccc1C[N@@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000064482739 337306726 /nfs/dbraw/zinc/30/67/26/337306726.db2.gz YPSMGYHLXGCQAY-INIZCTEOSA-N 1 2 305.805 4.114 20 0 DIADLO Clc1ccccc1C[N@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000064482739 337306727 /nfs/dbraw/zinc/30/67/27/337306727.db2.gz YPSMGYHLXGCQAY-INIZCTEOSA-N 1 2 305.805 4.114 20 0 DIADLO Cc1csc([C@@H](C)Nc2[nH+]ccc(C)c2Br)n1 ZINC000235291796 337307545 /nfs/dbraw/zinc/30/75/45/337307545.db2.gz LYKHYWHAXICORW-SECBINFHSA-N 1 2 312.236 4.091 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@H+]2CC=C(c3ccc(F)cc3)CC2)n1 ZINC000193020066 337308863 /nfs/dbraw/zinc/30/88/63/337308863.db2.gz QBIBIPHHIHNLHC-CYBMUJFWSA-N 1 2 315.392 4.182 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@@H+]2CC=C(c3ccc(F)cc3)CC2)n1 ZINC000193020066 337308864 /nfs/dbraw/zinc/30/88/64/337308864.db2.gz QBIBIPHHIHNLHC-CYBMUJFWSA-N 1 2 315.392 4.182 20 0 DIADLO Cc1csc(C(=O)Nc2ccc(-c3c[nH]c[nH+]3)cc2)c1Cl ZINC000583727763 337319722 /nfs/dbraw/zinc/31/97/22/337319722.db2.gz NKNYFPVXZHTLMD-UHFFFAOYSA-N 1 2 317.801 4.352 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+](C)Cc2ccc(SC(C)C)cc2)n1 ZINC000584418923 337322980 /nfs/dbraw/zinc/32/29/80/337322980.db2.gz PKGBCWUZCPXNOF-GFCCVEGCSA-N 1 2 305.447 4.072 20 0 DIADLO Cc1noc([C@@H](C)[N@H+](C)Cc2ccc(SC(C)C)cc2)n1 ZINC000584418923 337322981 /nfs/dbraw/zinc/32/29/81/337322981.db2.gz PKGBCWUZCPXNOF-GFCCVEGCSA-N 1 2 305.447 4.072 20 0 DIADLO Fc1ccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)c(F)c1 ZINC000584567336 337364450 /nfs/dbraw/zinc/36/44/50/337364450.db2.gz NJDPKJFJXCBBBI-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO Cc1[nH]c(CNCc2ccc(C)cc2Oc2ccccc2)[nH+]c1C ZINC000583883003 337377428 /nfs/dbraw/zinc/37/74/28/337377428.db2.gz BTPYNRBHFJFLBU-UHFFFAOYSA-N 1 2 321.424 4.417 20 0 DIADLO c1c2ccccc2[nH]c1[C@H]1CCCC[N@H+]1Cc1nc(C2CC2)no1 ZINC000108385398 337387957 /nfs/dbraw/zinc/38/79/57/337387957.db2.gz MUDKFBMKJXYQKG-QGZVFWFLSA-N 1 2 322.412 4.156 20 0 DIADLO c1c2ccccc2[nH]c1[C@H]1CCCC[N@@H+]1Cc1nc(C2CC2)no1 ZINC000108385398 337387958 /nfs/dbraw/zinc/38/79/58/337387958.db2.gz MUDKFBMKJXYQKG-QGZVFWFLSA-N 1 2 322.412 4.156 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1cncc(Br)c1 ZINC000029707953 337389585 /nfs/dbraw/zinc/38/95/85/337389585.db2.gz NQQNJELQFWLTSQ-SNVBAGLBSA-N 1 2 323.259 4.025 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1cncc(Br)c1 ZINC000029707953 337389586 /nfs/dbraw/zinc/38/95/86/337389586.db2.gz NQQNJELQFWLTSQ-SNVBAGLBSA-N 1 2 323.259 4.025 20 0 DIADLO C[C@H](CC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1)C1CCCCC1 ZINC000120120258 337395480 /nfs/dbraw/zinc/39/54/80/337395480.db2.gz AQJUQSGRTGEYNN-GDBMZVCRSA-N 1 2 303.450 4.070 20 0 DIADLO c1csc([C@@H]2c3ccsc3CC[N@H+]2Cc2cncs2)c1 ZINC000121130297 337396329 /nfs/dbraw/zinc/39/63/29/337396329.db2.gz SJBYQXLJVCYFFV-HNNXBMFYSA-N 1 2 318.492 4.414 20 0 DIADLO c1csc([C@@H]2c3ccsc3CC[N@@H+]2Cc2cncs2)c1 ZINC000121130297 337396330 /nfs/dbraw/zinc/39/63/30/337396330.db2.gz SJBYQXLJVCYFFV-HNNXBMFYSA-N 1 2 318.492 4.414 20 0 DIADLO Fc1ccc(F)c(C[NH2+]Cc2cscc2Br)c1 ZINC000336690479 337398238 /nfs/dbraw/zinc/39/82/38/337398238.db2.gz GZZAJKQFOMETTK-UHFFFAOYSA-N 1 2 318.186 4.079 20 0 DIADLO CC(C)c1nc2n(n1)CCC[C@@H]2[NH2+][C@@H](C)c1ccccc1Cl ZINC000126128286 337415515 /nfs/dbraw/zinc/41/55/15/337415515.db2.gz VMZCUZPFPRCFFY-WFASDCNBSA-N 1 2 318.852 4.241 20 0 DIADLO CCc1nnc([C@H](C)SCc2ccc(C(C)C)[nH+]c2C)o1 ZINC000419497424 337488140 /nfs/dbraw/zinc/48/81/40/337488140.db2.gz XIIICNGSEKBLQL-LBPRGKRZSA-N 1 2 305.447 4.453 20 0 DIADLO CCc1ccc([C@@H](C)c2nc(Cc3ccc[nH+]c3C)no2)cc1 ZINC000420510638 337505878 /nfs/dbraw/zinc/50/58/78/337505878.db2.gz JQERPACVWMENIB-CYBMUJFWSA-N 1 2 307.397 4.078 20 0 DIADLO CC[C@H]1C[NH+](Cc2nc(-c3ccccc3)oc2C)C[C@H](CC)O1 ZINC000420951045 337514548 /nfs/dbraw/zinc/51/45/48/337514548.db2.gz QJAOUDKAUKFMKV-IRXDYDNUSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1C[NH+](Cc2nc(-c3ccsc3)oc2C)C[C@@H](CC)O1 ZINC000420955414 337514990 /nfs/dbraw/zinc/51/49/90/337514990.db2.gz LLXUIHWVTXKDBO-HUUCEWRRSA-N 1 2 320.458 4.101 20 0 DIADLO Cn1cc(Cl)c(C[NH2+][C@@H](c2cccc(F)c2)C(C)(C)C)n1 ZINC000420929327 337516591 /nfs/dbraw/zinc/51/65/91/337516591.db2.gz DLACXVLCZJBTDW-HNNXBMFYSA-N 1 2 309.816 4.090 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@@H](c3ccccc3)C2(C)C)c(C)[nH+]1 ZINC000421073687 337520487 /nfs/dbraw/zinc/52/04/87/337520487.db2.gz WESUDOIXIKVRDU-KRWDZBQOSA-N 1 2 323.440 4.498 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccccc2C(F)(F)F)cc(C)[nH+]1 ZINC000421034455 337520918 /nfs/dbraw/zinc/52/09/18/337520918.db2.gz KIMSBEUAJKFMAH-UHFFFAOYSA-N 1 2 323.318 4.039 20 0 DIADLO CCC(CC)(C(=O)NCc1cc(C)[nH+]c(C)c1)c1ccccc1 ZINC000421574020 337542187 /nfs/dbraw/zinc/54/21/87/337542187.db2.gz DFRBFLJYCPMDPK-UHFFFAOYSA-N 1 2 310.441 4.073 20 0 DIADLO Cc1cc(CNC(=O)[C@@H](CC(C)C)c2ccccc2)cc(C)[nH+]1 ZINC000421573949 337542203 /nfs/dbraw/zinc/54/22/03/337542203.db2.gz CODPGELIGSIPGP-IBGZPJMESA-N 1 2 310.441 4.145 20 0 DIADLO Cc1cc(NC(=O)N[C@@H](c2ccc(F)cc2)C(C)C)cc[nH+]1 ZINC000074630733 337552375 /nfs/dbraw/zinc/55/23/75/337552375.db2.gz SGOSSWIHPJUJJO-MRXNPFEDSA-N 1 2 301.365 4.048 20 0 DIADLO Cn1cc[nH+]c1CSc1nc2ccccc2n1-c1ccccc1 ZINC000248143369 337562703 /nfs/dbraw/zinc/56/27/03/337562703.db2.gz RAEPBDPBWPVFKK-UHFFFAOYSA-N 1 2 320.421 4.051 20 0 DIADLO CCOc1cccc(Cl)c1C[NH2+][C@H](C)c1ncc(C)s1 ZINC000572254517 337600157 /nfs/dbraw/zinc/60/01/57/337600157.db2.gz QTXDGKVFMLIZAT-LLVKDONJSA-N 1 2 310.850 4.354 20 0 DIADLO C[C@@H](Oc1ccc[nH+]c1NCc1cncs1)c1ccccc1 ZINC000162404428 337618052 /nfs/dbraw/zinc/61/80/52/337618052.db2.gz UGLKCCKFAINXOF-CYBMUJFWSA-N 1 2 311.410 4.290 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@@H](C)c1ccncc1Cl)c1ccco1 ZINC000421823911 337646169 /nfs/dbraw/zinc/64/61/69/337646169.db2.gz FYVZWLPHHRNMAV-BBRMVZONSA-N 1 2 322.836 4.393 20 0 DIADLO CCCCOc1ncccc1C[NH2+][C@H](C)c1ccncc1Cl ZINC000421824950 337646384 /nfs/dbraw/zinc/64/63/84/337646384.db2.gz LATYLNLQECFJRL-CYBMUJFWSA-N 1 2 319.836 4.160 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(OC(F)F)cc1 ZINC000423212934 337704591 /nfs/dbraw/zinc/70/45/91/337704591.db2.gz JHDZQSWOFJSZKQ-NSHDSACASA-N 1 2 304.340 4.429 20 0 DIADLO c1ccc([C@H](C[C@@H]2CCOC2)Nc2ccc3c(c2)CC[NH2+]3)cc1 ZINC000423215539 337704716 /nfs/dbraw/zinc/70/47/16/337704716.db2.gz MYABNKPRYXVJRY-YWZLYKJASA-N 1 2 308.425 4.234 20 0 DIADLO C[C@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1cc2ccccc2o1 ZINC000536870864 337751565 /nfs/dbraw/zinc/75/15/65/337751565.db2.gz QOBZBKZUIBLUJG-NHYWBVRUSA-N 1 2 317.335 4.095 20 0 DIADLO CC(C)Oc1cc(Cl)c(C[NH2+]Cc2cocn2)cc1Cl ZINC000527656727 337756596 /nfs/dbraw/zinc/75/65/96/337756596.db2.gz JMMCYAKAZXAXGI-UHFFFAOYSA-N 1 2 315.200 4.058 20 0 DIADLO COc1ccccc1[C@H]1CCN(c2[nH+]ccc3ccccc32)C1 ZINC000527904166 337769965 /nfs/dbraw/zinc/76/99/65/337769965.db2.gz WWPLWLOJSZSGGW-INIZCTEOSA-N 1 2 304.393 4.237 20 0 DIADLO Cc1ccc(NCc2c[nH+]cn2C(C)C)cc1OCC(F)F ZINC000424152655 337777487 /nfs/dbraw/zinc/77/74/87/337777487.db2.gz JUFWPFDHGKTHOM-UHFFFAOYSA-N 1 2 309.360 4.028 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cccc(N2CCC(C)CC2)c1 ZINC000424154558 337781792 /nfs/dbraw/zinc/78/17/92/337781792.db2.gz MOWCPKXDRZILOG-UHFFFAOYSA-N 1 2 312.461 4.312 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2ccc(OC)cc2Cl)s1 ZINC000424313206 337819491 /nfs/dbraw/zinc/81/94/91/337819491.db2.gz NJHPEUWUXUMMFZ-JTQLQIEISA-N 1 2 310.850 4.218 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccc2c(c1)Cc1ccccc1-2 ZINC000107290539 337828338 /nfs/dbraw/zinc/82/83/38/337828338.db2.gz HGGRBQGLAJQOIQ-UHFFFAOYSA-N 1 2 300.361 4.214 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1cccc(Oc2ccccc2)c1 ZINC000107289962 337828483 /nfs/dbraw/zinc/82/84/83/337828483.db2.gz LWLZIKUODBONIF-UHFFFAOYSA-N 1 2 304.349 4.435 20 0 DIADLO Cc1ccc(SCCC(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000119169054 337854796 /nfs/dbraw/zinc/85/47/96/337854796.db2.gz YKLOXFVYFGOSEO-UHFFFAOYSA-N 1 2 300.427 4.128 20 0 DIADLO CC[C@@H](Sc1ccccc1)C(=O)Nc1ccc(C)[nH+]c1C ZINC000119269932 337855793 /nfs/dbraw/zinc/85/57/93/337855793.db2.gz YBDVWLPHZVTQLD-MRXNPFEDSA-N 1 2 300.427 4.208 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@H]2c2ccc(C)c(C)c2)cc[nH+]1 ZINC000119744601 337865048 /nfs/dbraw/zinc/86/50/48/337865048.db2.gz HJTRNCZZUXZARQ-SFHVURJKSA-N 1 2 309.413 4.376 20 0 DIADLO CC[C@H](CSc1ccccc1)NC(=O)Nc1cc[nH+]cc1C ZINC000120383300 337874954 /nfs/dbraw/zinc/87/49/54/337874954.db2.gz KOYMRBLXVHDHBQ-CQSZACIVSA-N 1 2 315.442 4.082 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2nc(C3CC3)cs2)c(F)c1 ZINC000090460499 337881320 /nfs/dbraw/zinc/88/13/20/337881320.db2.gz GANDSERIQNOAPC-JTQLQIEISA-N 1 2 306.406 4.019 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)Oc2ccccc2Cl)c(C)[nH+]1 ZINC000121125351 337886512 /nfs/dbraw/zinc/88/65/12/337886512.db2.gz SPBODFDGVKLKHN-CYBMUJFWSA-N 1 2 318.804 4.066 20 0 DIADLO COC[C@H]([NH2+]Cc1ncc(-c2ccccc2C)o1)c1ccccc1 ZINC000537108783 337892393 /nfs/dbraw/zinc/89/23/93/337892393.db2.gz JNDDMHIUONOKNC-SFHVURJKSA-N 1 2 322.408 4.127 20 0 DIADLO Cc1cccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1Cl ZINC000122081896 337906069 /nfs/dbraw/zinc/90/60/69/337906069.db2.gz BFDNDDZWCGGGRW-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](CC(C)C)c2ccccc2OC)o1 ZINC000537173884 337906594 /nfs/dbraw/zinc/90/65/94/337906594.db2.gz NBIOHJNTFYYPOL-INIZCTEOSA-N 1 2 302.418 4.123 20 0 DIADLO C[C@@H]([NH2+]Cc1ccnc(OC2CCCCC2)c1)c1nccs1 ZINC000093403838 337916443 /nfs/dbraw/zinc/91/64/43/337916443.db2.gz IUEVVZBPELOZPJ-CYBMUJFWSA-N 1 2 317.458 4.100 20 0 DIADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ncc(C)s1 ZINC000122910611 337927959 /nfs/dbraw/zinc/92/79/59/337927959.db2.gz ZNOBEBLFMCOFTA-LLVKDONJSA-N 1 2 310.850 4.354 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](c2ccccc2)C(C)(C)C)n1 ZINC000123064245 337943122 /nfs/dbraw/zinc/94/31/22/337943122.db2.gz AUOIEMJBOBTXNE-QGZVFWFLSA-N 1 2 301.434 4.289 20 0 DIADLO Fc1cc(Cl)cc(Cl)c1NCc1cn2ccccc2[nH+]1 ZINC000514234503 337967100 /nfs/dbraw/zinc/96/71/00/337967100.db2.gz OUIDRMUDUOCKFU-UHFFFAOYSA-N 1 2 310.159 4.392 20 0 DIADLO CCOC(C)(C)C[NH2+][C@H](c1cccc(OC(C)C)c1)C(F)F ZINC000515048683 337978603 /nfs/dbraw/zinc/97/86/03/337978603.db2.gz OQKGISQTJRVXOP-OAHLLOKOSA-N 1 2 315.404 4.185 20 0 DIADLO Cc1cc[nH+]c(NC[C@@H](C[C@H](C)O)c2ccccc2)c1Cl ZINC000515262623 337983910 /nfs/dbraw/zinc/98/39/10/337983910.db2.gz XKMSPOLFNWBODH-DZGCQCFKSA-N 1 2 304.821 4.010 20 0 DIADLO COc1cc(C)ccc1[C@@H](C)[NH2+][C@@H](C)c1c(F)cncc1F ZINC000515390586 337987684 /nfs/dbraw/zinc/98/76/84/337987684.db2.gz HBQJDAIMNGWQOT-NEPJUHHUSA-N 1 2 306.356 4.089 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](CCC(F)(F)F)CC2CC2)cs1 ZINC000084137558 338000312 /nfs/dbraw/zinc/00/03/12/338000312.db2.gz WFFPMNNCWDEKFV-JTQLQIEISA-N 1 2 322.396 4.015 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](CCC(F)(F)F)CC2CC2)cs1 ZINC000084137558 338000313 /nfs/dbraw/zinc/00/03/13/338000313.db2.gz WFFPMNNCWDEKFV-JTQLQIEISA-N 1 2 322.396 4.015 20 0 DIADLO CC(C)C(C)(C)NC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000515907412 338000960 /nfs/dbraw/zinc/00/09/60/338000960.db2.gz HWTPYEXEGMUURZ-UHFFFAOYSA-N 1 2 313.401 4.430 20 0 DIADLO Cc1ccc(C[NH2+]Cc2ccn(C3CCCC3)n2)c(Cl)c1 ZINC000516187029 338006166 /nfs/dbraw/zinc/00/61/66/338006166.db2.gz DWLFLTKDXSJMJA-UHFFFAOYSA-N 1 2 303.837 4.250 20 0 DIADLO CC(C)(C)C1=CC[N@H+](CC(=O)Nc2ccc(F)cc2Cl)CC1 ZINC000516319614 338009921 /nfs/dbraw/zinc/00/99/21/338009921.db2.gz ACRHVHAQJORCDI-UHFFFAOYSA-N 1 2 324.827 4.096 20 0 DIADLO CC(C)(C)C1=CC[N@@H+](CC(=O)Nc2ccc(F)cc2Cl)CC1 ZINC000516319614 338009922 /nfs/dbraw/zinc/00/99/22/338009922.db2.gz ACRHVHAQJORCDI-UHFFFAOYSA-N 1 2 324.827 4.096 20 0 DIADLO CCCc1noc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)n1 ZINC000516308035 338010327 /nfs/dbraw/zinc/01/03/27/338010327.db2.gz BZGYAHRPXGPSFB-UHFFFAOYSA-N 1 2 321.424 4.340 20 0 DIADLO CCCc1noc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)n1 ZINC000516308035 338010328 /nfs/dbraw/zinc/01/03/28/338010328.db2.gz BZGYAHRPXGPSFB-UHFFFAOYSA-N 1 2 321.424 4.340 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc(-c2occc2C(C)C)no1 ZINC000426228952 338023333 /nfs/dbraw/zinc/02/33/33/338023333.db2.gz XKGGXMWPNYXKIY-UHFFFAOYSA-N 1 2 322.368 4.159 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[NH+]1CCC(O)(C(F)F)CC1 ZINC000426468158 338033105 /nfs/dbraw/zinc/03/31/05/338033105.db2.gz LOCIMGGGGUNFRN-SECBINFHSA-N 1 2 324.198 4.146 20 0 DIADLO COc1ccc(CC[C@@H](C)[NH2+]c2ccc(C)cc2OC)cc1O ZINC000426404496 338030849 /nfs/dbraw/zinc/03/08/49/338030849.db2.gz ZXVFZWJFMNCHEP-CQSZACIVSA-N 1 2 315.413 4.151 20 0 DIADLO Cc1c[nH+]cc(CCc2nc(-c3cccc4ccccc43)no2)c1 ZINC000426409327 338031026 /nfs/dbraw/zinc/03/10/26/338031026.db2.gz DPVPLAQDPXMOCJ-UHFFFAOYSA-N 1 2 315.376 4.378 20 0 DIADLO CC(C)C1(C)CC[NH+](Cc2nc(C(F)(F)F)cs2)CC1 ZINC000426753280 338040837 /nfs/dbraw/zinc/04/08/37/338040837.db2.gz HNRUWNRNZNGDLC-UHFFFAOYSA-N 1 2 306.397 4.420 20 0 DIADLO CC1(CC(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)CC1 ZINC000428182969 338041961 /nfs/dbraw/zinc/04/19/61/338041961.db2.gz LLUDAHPLJDJBBF-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC000428245151 338044040 /nfs/dbraw/zinc/04/40/40/338044040.db2.gz LUGYJEFAVYLWQO-WMLDXEAASA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC000428245151 338044041 /nfs/dbraw/zinc/04/40/41/338044041.db2.gz LUGYJEFAVYLWQO-WMLDXEAASA-N 1 2 314.429 4.068 20 0 DIADLO COC(=O)c1oc([C@H](C)[N@H+](C)Cc2ccccc2Cl)cc1C ZINC000428257757 338044720 /nfs/dbraw/zinc/04/47/20/338044720.db2.gz BPMDEJCMDINBHF-LBPRGKRZSA-N 1 2 321.804 4.221 20 0 DIADLO COC(=O)c1oc([C@H](C)[N@@H+](C)Cc2ccccc2Cl)cc1C ZINC000428257757 338044721 /nfs/dbraw/zinc/04/47/21/338044721.db2.gz BPMDEJCMDINBHF-LBPRGKRZSA-N 1 2 321.804 4.221 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCc2ccc(Cl)cc2C1 ZINC000428295654 338046062 /nfs/dbraw/zinc/04/60/62/338046062.db2.gz LSCPGMSJVFDRBX-UHFFFAOYSA-N 1 2 304.821 4.318 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1CCc2ccc(Cl)cc2C1 ZINC000428295654 338046063 /nfs/dbraw/zinc/04/60/63/338046063.db2.gz LSCPGMSJVFDRBX-UHFFFAOYSA-N 1 2 304.821 4.318 20 0 DIADLO CCc1nc(C)c(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)o1 ZINC000428360830 338048834 /nfs/dbraw/zinc/04/88/34/338048834.db2.gz LFPQOYUZVLUBTK-LLVKDONJSA-N 1 2 307.463 4.150 20 0 DIADLO CC[C@@H](C)[N@H+](CC(=O)OC(C)(C)C)Cc1oc(C(C)C)nc1C ZINC000428371199 338049189 /nfs/dbraw/zinc/04/91/89/338049189.db2.gz VNHCCYNEUHZHFH-CYBMUJFWSA-N 1 2 324.465 4.049 20 0 DIADLO CC[C@@H](C)[N@@H+](CC(=O)OC(C)(C)C)Cc1oc(C(C)C)nc1C ZINC000428371199 338049190 /nfs/dbraw/zinc/04/91/90/338049190.db2.gz VNHCCYNEUHZHFH-CYBMUJFWSA-N 1 2 324.465 4.049 20 0 DIADLO CCCc1nc(C)c(C[N@H+](C)Cc2nc3ccccc3s2)o1 ZINC000428451643 338052336 /nfs/dbraw/zinc/05/23/36/338052336.db2.gz DDGYYMSETDZMTJ-UHFFFAOYSA-N 1 2 315.442 4.177 20 0 DIADLO CCCc1nc(C)c(C[N@@H+](C)Cc2nc3ccccc3s2)o1 ZINC000428451643 338052337 /nfs/dbraw/zinc/05/23/37/338052337.db2.gz DDGYYMSETDZMTJ-UHFFFAOYSA-N 1 2 315.442 4.177 20 0 DIADLO CC(C)C1(C)CC[NH+](Cc2ncc(Br)s2)CC1 ZINC000428483855 338054535 /nfs/dbraw/zinc/05/45/35/338054535.db2.gz KTNFUVZSTHPYPZ-UHFFFAOYSA-N 1 2 317.296 4.164 20 0 DIADLO Clc1ccc(C2CC[NH+](Cc3c[nH]cn3)CC2)c(Cl)c1 ZINC000428750152 338060473 /nfs/dbraw/zinc/06/04/73/338060473.db2.gz RKRWUDVNJRBHPR-UHFFFAOYSA-N 1 2 310.228 4.096 20 0 DIADLO Clc1ccc(C2CC[NH+](Cc3cnc[nH]3)CC2)c(Cl)c1 ZINC000428750152 338060474 /nfs/dbraw/zinc/06/04/74/338060474.db2.gz RKRWUDVNJRBHPR-UHFFFAOYSA-N 1 2 310.228 4.096 20 0 DIADLO CC[C@H](F)C[N@@H+]1C[C@@H](c2cccc(C(F)(F)F)c2)OC[C@@H]1C ZINC000428809739 338061347 /nfs/dbraw/zinc/06/13/47/338061347.db2.gz GKVTUOVBCHMVDH-CQDKDKBSSA-N 1 2 319.342 4.215 20 0 DIADLO CC[C@H](F)C[N@H+]1C[C@@H](c2cccc(C(F)(F)F)c2)OC[C@@H]1C ZINC000428809739 338061348 /nfs/dbraw/zinc/06/13/48/338061348.db2.gz GKVTUOVBCHMVDH-CQDKDKBSSA-N 1 2 319.342 4.215 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2ccc(F)cc2s1)c1nc(C)cs1 ZINC000428861623 338062892 /nfs/dbraw/zinc/06/28/92/338062892.db2.gz KJDJOSXMFQHOHU-NSHDSACASA-N 1 2 321.446 4.441 20 0 DIADLO Cc1sc(C[NH2+]Cc2cocn2)nc1-c1ccc(Cl)cc1 ZINC000428862210 338063124 /nfs/dbraw/zinc/06/31/24/338063124.db2.gz MSCUZPDXFSELBT-UHFFFAOYSA-N 1 2 319.817 4.050 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2ccc(F)cc2s1)c1nccs1 ZINC000428869971 338063599 /nfs/dbraw/zinc/06/35/99/338063599.db2.gz DMBNDEXWYJVJKU-SNVBAGLBSA-N 1 2 307.419 4.133 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccc(C(F)(F)F)s2)cs1 ZINC000428873384 338064036 /nfs/dbraw/zinc/06/40/36/338064036.db2.gz UQVOKFNKADKBQO-SSDOTTSWSA-N 1 2 306.378 4.383 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2nc3ccc(F)cc3s2)n1 ZINC000428881015 338064383 /nfs/dbraw/zinc/06/43/83/338064383.db2.gz LGJZUVFBJYHSOE-SECBINFHSA-N 1 2 307.419 4.051 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(C(F)F)c2)C[C@@H](C(F)(F)F)O1 ZINC000428929373 338065251 /nfs/dbraw/zinc/06/52/51/338065251.db2.gz UDZLXGNKKPINGN-LBPRGKRZSA-N 1 2 323.305 4.166 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(C(F)F)c2)C[C@@H](C(F)(F)F)O1 ZINC000428929373 338065252 /nfs/dbraw/zinc/06/52/52/338065252.db2.gz UDZLXGNKKPINGN-LBPRGKRZSA-N 1 2 323.305 4.166 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCc2cc(Cl)ccc2C1 ZINC000428985745 338067813 /nfs/dbraw/zinc/06/78/13/338067813.db2.gz LAVSVGLJCOHYBN-UHFFFAOYSA-N 1 2 304.821 4.318 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1CCc2cc(Cl)ccc2C1 ZINC000428985745 338067814 /nfs/dbraw/zinc/06/78/14/338067814.db2.gz LAVSVGLJCOHYBN-UHFFFAOYSA-N 1 2 304.821 4.318 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(-c3ccccc3)on2)Cc2ccccc2O1 ZINC000429150329 338072144 /nfs/dbraw/zinc/07/21/44/338072144.db2.gz IIDVGWSWSPGQFW-HNNXBMFYSA-N 1 2 320.392 4.125 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(-c3ccccc3)on2)Cc2ccccc2O1 ZINC000429150329 338072145 /nfs/dbraw/zinc/07/21/45/338072145.db2.gz IIDVGWSWSPGQFW-HNNXBMFYSA-N 1 2 320.392 4.125 20 0 DIADLO Cc1ccc(C(=O)N(C)[C@H]2CC[C@@H](C)C2)cc1Oc1cc[nH+]cc1 ZINC000429255819 338074995 /nfs/dbraw/zinc/07/49/95/338074995.db2.gz QSVPPSKXHXCELB-PBHICJAKSA-N 1 2 324.424 4.443 20 0 DIADLO CC[C@H]1CC[N@@H+]1Cc1cccc(Br)c1OC(F)F ZINC000429281361 338076176 /nfs/dbraw/zinc/07/61/76/338076176.db2.gz VFFNXXZGCZKFOL-JTQLQIEISA-N 1 2 320.177 4.035 20 0 DIADLO CC[C@H]1CC[N@H+]1Cc1cccc(Br)c1OC(F)F ZINC000429281361 338076177 /nfs/dbraw/zinc/07/61/77/338076177.db2.gz VFFNXXZGCZKFOL-JTQLQIEISA-N 1 2 320.177 4.035 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+](C)Cc2cc(C)ccc2C)n1 ZINC000429285853 338076373 /nfs/dbraw/zinc/07/63/73/338076373.db2.gz PHQFDLBXSHNYGQ-OAHLLOKOSA-N 1 2 301.434 4.222 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+](C)Cc2cc(C)ccc2C)n1 ZINC000429285853 338076374 /nfs/dbraw/zinc/07/63/74/338076374.db2.gz PHQFDLBXSHNYGQ-OAHLLOKOSA-N 1 2 301.434 4.222 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@H](C)C(=O)Nc1ccc(C)cc1Cl ZINC000429375732 338079022 /nfs/dbraw/zinc/07/90/22/338079022.db2.gz CAGUVHHAUPBURF-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@H](C)C(=O)Nc1ccc(C)cc1Cl ZINC000429375732 338079023 /nfs/dbraw/zinc/07/90/23/338079023.db2.gz CAGUVHHAUPBURF-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO COC1(C[C@@H](C)[NH2+]c2ccc(N3CCCC3)cc2C)CCC1 ZINC000429430510 338080733 /nfs/dbraw/zinc/08/07/33/338080733.db2.gz RSWYJNVXQGGNBL-MRXNPFEDSA-N 1 2 302.462 4.355 20 0 DIADLO C[C@@H](c1cccc(Cl)c1F)N(C)Cc1cn2c([nH+]1)CCCC2 ZINC000429542490 338083356 /nfs/dbraw/zinc/08/33/56/338083356.db2.gz QTPUJLGHEPGDHL-LBPRGKRZSA-N 1 2 321.827 4.205 20 0 DIADLO CN(C/C=C\c1ccc(Cl)cc1)Cc1cn2c([nH+]1)CCCC2 ZINC000429546725 338083553 /nfs/dbraw/zinc/08/35/53/338083553.db2.gz INHNWWFUVKPYRY-PLNGDYQASA-N 1 2 315.848 4.018 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CCSC[C@H]2c2ccccc2)no1 ZINC000429685749 338087244 /nfs/dbraw/zinc/08/72/44/338087244.db2.gz MKCFFIULHRZOGT-INIZCTEOSA-N 1 2 316.470 4.262 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CCSC[C@H]2c2ccccc2)no1 ZINC000429685749 338087245 /nfs/dbraw/zinc/08/72/45/338087245.db2.gz MKCFFIULHRZOGT-INIZCTEOSA-N 1 2 316.470 4.262 20 0 DIADLO CCn1nccc1C[N@H+](C)Cc1sc2ccccc2c1Cl ZINC000429711311 338088049 /nfs/dbraw/zinc/08/80/49/338088049.db2.gz DPQMHPVFXGAONC-UHFFFAOYSA-N 1 2 319.861 4.403 20 0 DIADLO CCn1nccc1C[N@@H+](C)Cc1sc2ccccc2c1Cl ZINC000429711311 338088050 /nfs/dbraw/zinc/08/80/50/338088050.db2.gz DPQMHPVFXGAONC-UHFFFAOYSA-N 1 2 319.861 4.403 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc(C(C)(C)C)on2)cc1 ZINC000429729315 338088632 /nfs/dbraw/zinc/08/86/32/338088632.db2.gz XBPJOLPHCMKVHY-QGZVFWFLSA-N 1 2 314.429 4.318 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(C(C)(C)C)on2)cc1 ZINC000429729315 338088633 /nfs/dbraw/zinc/08/86/33/338088633.db2.gz XBPJOLPHCMKVHY-QGZVFWFLSA-N 1 2 314.429 4.318 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000429778393 338089703 /nfs/dbraw/zinc/08/97/03/338089703.db2.gz BESOXUOASJCVNE-AWEZNQCLSA-N 1 2 313.269 4.159 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccc(F)cc1 ZINC000429786855 338089932 /nfs/dbraw/zinc/08/99/32/338089932.db2.gz NZPUBNOMARXMKB-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1cc(F)ccc1F ZINC000429791081 338090042 /nfs/dbraw/zinc/09/00/42/338090042.db2.gz WZBLGVBPEVIOKW-SSDOTTSWSA-N 1 2 319.248 4.372 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2ccc(Cl)s2)c(F)c1F ZINC000430032765 338094071 /nfs/dbraw/zinc/09/40/71/338094071.db2.gz HQJRLVYCGKUNQR-UHFFFAOYSA-N 1 2 309.715 4.248 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2ccccc2Cl)c(F)c1F ZINC000430036999 338094134 /nfs/dbraw/zinc/09/41/34/338094134.db2.gz QWWWLCZNKXITBQ-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO CC(C)c1ncc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)s1 ZINC000430036634 338094183 /nfs/dbraw/zinc/09/41/83/338094183.db2.gz PNGSFBOMDAVBPK-UHFFFAOYSA-N 1 2 318.339 4.113 20 0 DIADLO CC1(C)C[N@H+](Cc2cc3c(cccc3F)[nH]2)[C@H]1c1cccnc1 ZINC000430085428 338095428 /nfs/dbraw/zinc/09/54/28/338095428.db2.gz MUKJNQMBRRQCRP-SFHVURJKSA-N 1 2 309.388 4.285 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc3c(cccc3F)[nH]2)[C@H]1c1cccnc1 ZINC000430085428 338095429 /nfs/dbraw/zinc/09/54/29/338095429.db2.gz MUKJNQMBRRQCRP-SFHVURJKSA-N 1 2 309.388 4.285 20 0 DIADLO C[C@]12CC[N@H+](Cc3cc(C(F)(F)F)ccc3F)C[C@H]1C2(F)F ZINC000430097522 338096487 /nfs/dbraw/zinc/09/64/87/338096487.db2.gz UPWMFOOXXUJIPG-OLZOCXBDSA-N 1 2 323.280 4.322 20 0 DIADLO C[C@]12CC[N@@H+](Cc3cc(C(F)(F)F)ccc3F)C[C@H]1C2(F)F ZINC000430097522 338096488 /nfs/dbraw/zinc/09/64/88/338096488.db2.gz UPWMFOOXXUJIPG-OLZOCXBDSA-N 1 2 323.280 4.322 20 0 DIADLO CSc1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccnc2)s1 ZINC000430108566 338097231 /nfs/dbraw/zinc/09/72/31/338097231.db2.gz VZQPMUKQKUFUBK-HNNXBMFYSA-N 1 2 304.484 4.448 20 0 DIADLO CSc1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccnc2)s1 ZINC000430108566 338097232 /nfs/dbraw/zinc/09/72/32/338097232.db2.gz VZQPMUKQKUFUBK-HNNXBMFYSA-N 1 2 304.484 4.448 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc3ccccc3n2C)cc1Cl ZINC000430110788 338097307 /nfs/dbraw/zinc/09/73/07/338097307.db2.gz KNDMGCPPSRGYJV-UHFFFAOYSA-N 1 2 313.832 4.167 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc3ccccc3n2C)cc1Cl ZINC000430110788 338097308 /nfs/dbraw/zinc/09/73/08/338097308.db2.gz KNDMGCPPSRGYJV-UHFFFAOYSA-N 1 2 313.832 4.167 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ncc(C(C)(C)C)s2)Cc2ccccc2O1 ZINC000430120769 338098079 /nfs/dbraw/zinc/09/80/79/338098079.db2.gz FVCGUCBHHVJFGY-CYBMUJFWSA-N 1 2 316.470 4.224 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ncc(C(C)(C)C)s2)Cc2ccccc2O1 ZINC000430120769 338098080 /nfs/dbraw/zinc/09/80/80/338098080.db2.gz FVCGUCBHHVJFGY-CYBMUJFWSA-N 1 2 316.470 4.224 20 0 DIADLO CC1=C[C@H](C)C[N@H+](Cc2csc(COc3ccccc3)n2)C1 ZINC000430283704 338104303 /nfs/dbraw/zinc/10/43/03/338104303.db2.gz IWXUFCYIUDHWRZ-AWEZNQCLSA-N 1 2 314.454 4.120 20 0 DIADLO CC1=C[C@H](C)C[N@@H+](Cc2csc(COc3ccccc3)n2)C1 ZINC000430283704 338104304 /nfs/dbraw/zinc/10/43/04/338104304.db2.gz IWXUFCYIUDHWRZ-AWEZNQCLSA-N 1 2 314.454 4.120 20 0 DIADLO COc1ccsc1[C@@H](C)[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000430725137 338112380 /nfs/dbraw/zinc/11/23/80/338112380.db2.gz PZWLOXBYDJAJCC-SSDOTTSWSA-N 1 2 319.323 4.164 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1cccc(F)c1F ZINC000430748920 338113519 /nfs/dbraw/zinc/11/35/19/338113519.db2.gz SBSUHWWTEBHZNM-ZETCQYMHSA-N 1 2 319.248 4.372 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000430866287 338117508 /nfs/dbraw/zinc/11/75/08/338117508.db2.gz GFTNQSCCPXMQCV-OIISXLGYSA-N 1 2 313.445 4.347 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000430866287 338117509 /nfs/dbraw/zinc/11/75/09/338117509.db2.gz GFTNQSCCPXMQCV-OIISXLGYSA-N 1 2 313.445 4.347 20 0 DIADLO Cn1c2cc(F)ccc2[nH+]c1N1CCC[C@@H]1c1cccs1 ZINC000431037051 338120952 /nfs/dbraw/zinc/12/09/52/338120952.db2.gz LCTVAWVNAWAODB-CYBMUJFWSA-N 1 2 301.390 4.115 20 0 DIADLO CC(C)(C)C(C)(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000431324889 338128011 /nfs/dbraw/zinc/12/80/11/338128011.db2.gz YHIDNHRMPQUPRN-UHFFFAOYSA-N 1 2 303.381 4.022 20 0 DIADLO Cc1ccc(NC(=O)c2c(Cl)cc(F)cc2Cl)c(C)[nH+]1 ZINC000431903110 338141424 /nfs/dbraw/zinc/14/14/24/338141424.db2.gz RUVIPLWIDCSLJQ-UHFFFAOYSA-N 1 2 313.159 4.397 20 0 DIADLO Clc1cccc([C@@H]2CCN(c3cc[nH+]c4ccncc43)C2)c1 ZINC000432136290 338146588 /nfs/dbraw/zinc/14/65/88/338146588.db2.gz BSYZUZRJANESQK-CQSZACIVSA-N 1 2 309.800 4.277 20 0 DIADLO CCOc1ncccc1C[NH2+]Cc1csc(Cl)c1Cl ZINC000432229644 338149170 /nfs/dbraw/zinc/14/91/70/338149170.db2.gz SPKFMTQVXFUKBI-UHFFFAOYSA-N 1 2 317.241 4.138 20 0 DIADLO COC[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1Cl)c1ccco1 ZINC000432249222 338150724 /nfs/dbraw/zinc/15/07/24/338150724.db2.gz DQMMTPPXUKYTEY-LLVKDONJSA-N 1 2 318.175 4.203 20 0 DIADLO COc1ccc(Br)c(OCc2ccc(C)[nH+]c2C)c1 ZINC000432316782 338152903 /nfs/dbraw/zinc/15/29/03/338152903.db2.gz AIQIFZFBOUUEQA-UHFFFAOYSA-N 1 2 322.202 4.049 20 0 DIADLO CC(C)CO[C@@H]1CC[N@H+](Cc2csc(Cl)c2Cl)C1 ZINC000432718652 338164009 /nfs/dbraw/zinc/16/40/09/338164009.db2.gz KXMFMKCTCCFUKK-LLVKDONJSA-N 1 2 308.274 4.302 20 0 DIADLO CC(C)CO[C@@H]1CC[N@@H+](Cc2csc(Cl)c2Cl)C1 ZINC000432718652 338164010 /nfs/dbraw/zinc/16/40/10/338164010.db2.gz KXMFMKCTCCFUKK-LLVKDONJSA-N 1 2 308.274 4.302 20 0 DIADLO Cc1nc2ccc(C(=O)Nc3c(C)cc(C)[nH+]c3C)cc2s1 ZINC000432712417 338163850 /nfs/dbraw/zinc/16/38/50/338163850.db2.gz CVRZYZSEMTWNNM-UHFFFAOYSA-N 1 2 311.410 4.177 20 0 DIADLO C[N@H+](Cc1nc2ccc(F)cc2s1)Cc1ccc(F)cc1F ZINC000432735722 338164929 /nfs/dbraw/zinc/16/49/29/338164929.db2.gz ODLAANVHOKVMOY-UHFFFAOYSA-N 1 2 322.355 4.346 20 0 DIADLO C[N@@H+](Cc1nc2ccc(F)cc2s1)Cc1ccc(F)cc1F ZINC000432735722 338164930 /nfs/dbraw/zinc/16/49/30/338164930.db2.gz ODLAANVHOKVMOY-UHFFFAOYSA-N 1 2 322.355 4.346 20 0 DIADLO CC[C@]1(CO)CCC[N@H+](Cc2ccc(F)c(Cl)c2Cl)C1 ZINC000432919537 338173163 /nfs/dbraw/zinc/17/31/63/338173163.db2.gz ULBACTNBLLUAPS-HNNXBMFYSA-N 1 2 320.235 4.117 20 0 DIADLO CC[C@]1(CO)CCC[N@@H+](Cc2ccc(F)c(Cl)c2Cl)C1 ZINC000432919537 338173164 /nfs/dbraw/zinc/17/31/64/338173164.db2.gz ULBACTNBLLUAPS-HNNXBMFYSA-N 1 2 320.235 4.117 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3Cc4ccccc4C4(CC4)C3)sc2c1 ZINC000432926009 338173564 /nfs/dbraw/zinc/17/35/64/338173564.db2.gz VFEBEROQXKIGSW-UHFFFAOYSA-N 1 2 324.424 4.483 20 0 DIADLO Fc1ccc2nc(C[N@H+]3Cc4ccccc4C4(CC4)C3)sc2c1 ZINC000432926009 338173565 /nfs/dbraw/zinc/17/35/65/338173565.db2.gz VFEBEROQXKIGSW-UHFFFAOYSA-N 1 2 324.424 4.483 20 0 DIADLO Cc1ccc(C(=O)CC[NH2+][C@@H](c2ccccc2)C(F)F)cc1 ZINC000433044328 338178151 /nfs/dbraw/zinc/17/81/51/338178151.db2.gz ASJGCJQDLYOWLP-KRWDZBQOSA-N 1 2 303.352 4.164 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@H+](C)Cc2ccc(F)c(Cl)c2)n1 ZINC000433263481 338188598 /nfs/dbraw/zinc/18/85/98/338188598.db2.gz VVVPAHJZNGZOAH-SNVBAGLBSA-N 1 2 311.788 4.179 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@@H+](C)Cc2ccc(F)c(Cl)c2)n1 ZINC000433263481 338188599 /nfs/dbraw/zinc/18/85/99/338188599.db2.gz VVVPAHJZNGZOAH-SNVBAGLBSA-N 1 2 311.788 4.179 20 0 DIADLO FC(F)(F)c1cnc(C[NH2+][C@H]2CSc3ccccc32)s1 ZINC000433324690 338192360 /nfs/dbraw/zinc/19/23/60/338192360.db2.gz FOCKTSKWPMBOMB-VIFPVBQESA-N 1 2 316.373 4.099 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2cc[nH]n2)o1)c1c(F)cccc1Cl ZINC000433340908 338193358 /nfs/dbraw/zinc/19/33/58/338193358.db2.gz GBJWYBAOVNNDRW-SNVBAGLBSA-N 1 2 319.767 4.313 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@H]2CCSc3ccc(F)cc32)[nH+]1 ZINC000433763400 338200935 /nfs/dbraw/zinc/20/09/35/338200935.db2.gz ASRDIYUHJOXUGK-ZDUSSCGKSA-N 1 2 314.389 4.054 20 0 DIADLO COC[C@@H]1CCCCN(c2cc(C(C)(C)C)[nH+]c(C(C)C)n2)C1 ZINC000433762836 338201014 /nfs/dbraw/zinc/20/10/14/338201014.db2.gz BHIIYOUJUMAHMU-OAHLLOKOSA-N 1 2 319.493 4.150 20 0 DIADLO Cc1nc2[nH]ccc2c(N2CCC[C@H]2c2ccccc2Cl)[nH+]1 ZINC000433773455 338201345 /nfs/dbraw/zinc/20/13/45/338201345.db2.gz IIPVBBVSQGXXLX-HNNXBMFYSA-N 1 2 312.804 4.261 20 0 DIADLO Cc1cc(N2CC[C@H](CC(F)(F)F)C2)c2cccc(F)c2[nH+]1 ZINC000433809454 338202580 /nfs/dbraw/zinc/20/25/80/338202580.db2.gz VAODRRAHFSFEDM-LLVKDONJSA-N 1 2 312.310 4.461 20 0 DIADLO CC(C)(C)c1ccccc1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000433987368 338206252 /nfs/dbraw/zinc/20/62/52/338206252.db2.gz DXFKFVWUUXDFOE-UHFFFAOYSA-N 1 2 319.408 4.422 20 0 DIADLO CC(C)c1noc([C@@H](C)[NH+]2CCC(F)(c3ccccc3)CC2)n1 ZINC000434499679 338218630 /nfs/dbraw/zinc/21/86/30/338218630.db2.gz ZWYMIWKAYFQSLD-CQSZACIVSA-N 1 2 317.408 4.215 20 0 DIADLO CC(C)[C@@H](c1ccccc1Cl)[N@H+](C)Cc1ncnn1C(C)C ZINC000434543294 338219821 /nfs/dbraw/zinc/21/98/21/338219821.db2.gz QBDIPMOAMOPRQL-KRWDZBQOSA-N 1 2 320.868 4.342 20 0 DIADLO CC(C)[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1ncnn1C(C)C ZINC000434543294 338219822 /nfs/dbraw/zinc/21/98/22/338219822.db2.gz QBDIPMOAMOPRQL-KRWDZBQOSA-N 1 2 320.868 4.342 20 0 DIADLO CCCCC[N@H+](Cc1ncnn1C(C)C)Cc1ccc(F)cc1 ZINC000434547622 338220340 /nfs/dbraw/zinc/22/03/40/338220340.db2.gz OUGYEYAQDJTLNW-UHFFFAOYSA-N 1 2 318.440 4.191 20 0 DIADLO CCCCC[N@@H+](Cc1ncnn1C(C)C)Cc1ccc(F)cc1 ZINC000434547622 338220341 /nfs/dbraw/zinc/22/03/41/338220341.db2.gz OUGYEYAQDJTLNW-UHFFFAOYSA-N 1 2 318.440 4.191 20 0 DIADLO CC(C)[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1nc(C(C)(C)C)no1 ZINC000434618817 338221375 /nfs/dbraw/zinc/22/13/75/338221375.db2.gz AZOBQNINDXROBV-INIZCTEOSA-N 1 2 319.424 4.335 20 0 DIADLO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc(C(C)(C)C)no1 ZINC000434618817 338221376 /nfs/dbraw/zinc/22/13/76/338221376.db2.gz AZOBQNINDXROBV-INIZCTEOSA-N 1 2 319.424 4.335 20 0 DIADLO CC[C@@H](c1ccccc1)[S@](=O)Cc1[nH+]ccn1-c1ccccc1 ZINC000434623606 338221575 /nfs/dbraw/zinc/22/15/75/338221575.db2.gz DENSRGVAVRVMAZ-FDDCHVKYSA-N 1 2 324.449 4.272 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)n1 ZINC000434891045 338226735 /nfs/dbraw/zinc/22/67/35/338226735.db2.gz DHVCSGBWMKJXRH-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)n1 ZINC000434891045 338226736 /nfs/dbraw/zinc/22/67/36/338226736.db2.gz DHVCSGBWMKJXRH-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO Cn1c[nH+]cc1CN(Cc1ccc(Cl)cc1)c1ccccc1 ZINC000435050508 338230939 /nfs/dbraw/zinc/23/09/39/338230939.db2.gz MNMHXWNYZWZZDP-UHFFFAOYSA-N 1 2 311.816 4.280 20 0 DIADLO Cc1cc(C)c(NC(=O)C2CCC(C(F)(F)F)CC2)c(C)[nH+]1 ZINC000435529499 338241703 /nfs/dbraw/zinc/24/17/03/338241703.db2.gz GFEYMDFKTZAJFI-UHFFFAOYSA-N 1 2 314.351 4.314 20 0 DIADLO Cc1cc[nH+]cc1NCc1ccc(N(C)c2ccccc2)nc1 ZINC000435712639 338246046 /nfs/dbraw/zinc/24/60/46/338246046.db2.gz DTMDSELQSPGNCX-UHFFFAOYSA-N 1 2 304.397 4.165 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)CC1CCC(C)CC1 ZINC000435985701 338255179 /nfs/dbraw/zinc/25/51/79/338255179.db2.gz TXSXNVURSSWXLX-OFLPRAFFSA-N 1 2 317.477 4.173 20 0 DIADLO C[C@@H](C(=O)Nc1cccc2ccccc21)[NH+]1Cc2ccccc2C1 ZINC000436123191 338258974 /nfs/dbraw/zinc/25/89/74/338258974.db2.gz LJHIUYWDWRXTNN-HNNXBMFYSA-N 1 2 316.404 4.183 20 0 DIADLO CCC[C@H](NC(=O)[C@@H](C)[NH+]1Cc2ccccc2C1)c1ccccc1 ZINC000436133989 338259245 /nfs/dbraw/zinc/25/92/45/338259245.db2.gz UFSKZADLHWTNIF-UZLBHIALSA-N 1 2 322.452 4.048 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NCc2cc3c(cccc3F)[nH]2)c1 ZINC000436299029 338267379 /nfs/dbraw/zinc/26/73/79/338267379.db2.gz RACAWFBXRQHBEK-UHFFFAOYSA-N 1 2 320.371 4.320 20 0 DIADLO Cc1cccc2[nH+]cc(CNc3cccc(C(C)(F)F)c3)n21 ZINC000436406353 338271239 /nfs/dbraw/zinc/27/12/39/338271239.db2.gz CRVNFFPEOYGILS-UHFFFAOYSA-N 1 2 301.340 4.367 20 0 DIADLO Cc1[nH+]c2ccccn2c1CNc1cccc(C(C)(F)F)c1 ZINC000436408701 338271376 /nfs/dbraw/zinc/27/13/76/338271376.db2.gz JSHFZIFHGIMTML-UHFFFAOYSA-N 1 2 301.340 4.367 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1)c1ccon1 ZINC000436410973 338271462 /nfs/dbraw/zinc/27/14/62/338271462.db2.gz OKUHUPQCHAAWEQ-QMMMGPOBSA-N 1 2 304.699 4.198 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)Cc2cc3ccccc3o2)c(C)[nH+]1 ZINC000436487472 338273775 /nfs/dbraw/zinc/27/37/75/338273775.db2.gz CUFIWYVTOUTWQC-UHFFFAOYSA-N 1 2 323.396 4.417 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@H](c3ccccc3)C2)c(C)[nH+]1 ZINC000436489718 338274012 /nfs/dbraw/zinc/27/40/12/338274012.db2.gz GCTLTRLDNCPWDI-KRWDZBQOSA-N 1 2 309.413 4.028 20 0 DIADLO CCC1CCC(N(C)C(=O)Nc2c(C)cc(C)[nH+]c2C)CC1 ZINC000436494301 338274124 /nfs/dbraw/zinc/27/41/24/338274124.db2.gz NIYKWWJZMVQVPT-UHFFFAOYSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)Cc2cccc(Cl)c2)c(C)[nH+]1 ZINC000436494868 338274318 /nfs/dbraw/zinc/27/43/18/338274318.db2.gz OJKXNSJWEBYJPV-UHFFFAOYSA-N 1 2 317.820 4.324 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@H](C)c1cc(Cl)ccc1Cl ZINC000436863411 338290355 /nfs/dbraw/zinc/29/03/55/338290355.db2.gz KGKYUJJOOJLXTG-SNVBAGLBSA-N 1 2 324.211 4.001 20 0 DIADLO COc1cnccc1[C@H](C)[NH2+][C@@H](CCc1ccccc1)C(F)F ZINC000437087403 338300208 /nfs/dbraw/zinc/30/02/08/338300208.db2.gz IZDLBOFEARGKCL-BBRMVZONSA-N 1 2 320.383 4.007 20 0 DIADLO Cc1cc(C)cc(CSCc2[nH+]ccn2CC(F)(F)F)c1 ZINC000437252185 338304823 /nfs/dbraw/zinc/30/48/23/338304823.db2.gz DPPHNQAGZJIWCE-UHFFFAOYSA-N 1 2 314.376 4.496 20 0 DIADLO C[C@H](SCc1[nH+]ccn1CC(F)(F)F)c1ccccc1 ZINC000437265677 338305184 /nfs/dbraw/zinc/30/51/84/338305184.db2.gz INWJIGBHSCVSGP-NSHDSACASA-N 1 2 300.349 4.440 20 0 DIADLO CC1=C(C(=O)Nc2ccc3c(c2)[nH+]c2n3CCCCC2)CCC1 ZINC000437363620 338307965 /nfs/dbraw/zinc/30/79/65/338307965.db2.gz JEOMSCCAALTSFA-UHFFFAOYSA-N 1 2 309.413 4.202 20 0 DIADLO Fc1cccc2[nH]c(C[N@@H+]3CCCC[C@@H]3c3nccs3)cc21 ZINC000437745350 338319914 /nfs/dbraw/zinc/31/99/14/338319914.db2.gz GBYDKZUWRARXAF-MRXNPFEDSA-N 1 2 315.417 4.491 20 0 DIADLO Fc1cccc2[nH]c(C[N@H+]3CCCC[C@@H]3c3nccs3)cc21 ZINC000437745350 338319915 /nfs/dbraw/zinc/31/99/15/338319915.db2.gz GBYDKZUWRARXAF-MRXNPFEDSA-N 1 2 315.417 4.491 20 0 DIADLO CC(C)CCOc1ccc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)cc1 ZINC000437983622 338327295 /nfs/dbraw/zinc/32/72/95/338327295.db2.gz HKLYSDLNJMHUDW-SFHVURJKSA-N 1 2 313.445 4.172 20 0 DIADLO CC(C)CCOc1ccc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)cc1 ZINC000437983622 338327296 /nfs/dbraw/zinc/32/72/96/338327296.db2.gz HKLYSDLNJMHUDW-SFHVURJKSA-N 1 2 313.445 4.172 20 0 DIADLO COCC[N@H+](Cc1ccc(C)o1)Cc1ccc(Cl)cc1F ZINC000438094325 338331226 /nfs/dbraw/zinc/33/12/26/338331226.db2.gz FLUOVSTXLVJZRK-UHFFFAOYSA-N 1 2 311.784 4.029 20 0 DIADLO COCC[N@@H+](Cc1ccc(C)o1)Cc1ccc(Cl)cc1F ZINC000438094325 338331227 /nfs/dbraw/zinc/33/12/27/338331227.db2.gz FLUOVSTXLVJZRK-UHFFFAOYSA-N 1 2 311.784 4.029 20 0 DIADLO CC[C@@H](F)C[N@@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000440489003 338388423 /nfs/dbraw/zinc/38/84/23/338388423.db2.gz CLZDXQHJBFAKAU-ZJUUUORDSA-N 1 2 306.244 4.396 20 0 DIADLO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000440489003 338388424 /nfs/dbraw/zinc/38/84/24/338388424.db2.gz CLZDXQHJBFAKAU-ZJUUUORDSA-N 1 2 306.244 4.396 20 0 DIADLO C[C@@H](c1noc([C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2)n1)C1CC1 ZINC000438241120 338337667 /nfs/dbraw/zinc/33/76/67/338337667.db2.gz QNNVUNBYZPUUOG-WBMJQRKESA-N 1 2 315.392 4.059 20 0 DIADLO C[C@@H](c1noc([C@@H]2CCC[N@H+]2Cc2ccc(F)cc2)n1)C1CC1 ZINC000438241120 338337668 /nfs/dbraw/zinc/33/76/68/338337668.db2.gz QNNVUNBYZPUUOG-WBMJQRKESA-N 1 2 315.392 4.059 20 0 DIADLO C[C@H](c1noc([C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2)n1)C1CC1 ZINC000438241118 338337740 /nfs/dbraw/zinc/33/77/40/338337740.db2.gz QNNVUNBYZPUUOG-LRDDRELGSA-N 1 2 315.392 4.059 20 0 DIADLO C[C@H](c1noc([C@@H]2CCC[N@H+]2Cc2ccc(F)cc2)n1)C1CC1 ZINC000438241118 338337741 /nfs/dbraw/zinc/33/77/41/338337741.db2.gz QNNVUNBYZPUUOG-LRDDRELGSA-N 1 2 315.392 4.059 20 0 DIADLO CCCc1ccccc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438302220 338338953 /nfs/dbraw/zinc/33/89/53/338338953.db2.gz UTUAOGVJHWFRJD-UHFFFAOYSA-N 1 2 305.425 4.496 20 0 DIADLO CCc1ccccc1Cn1nc(C(F)(F)F)c2c[nH+]ccc21 ZINC000438305841 338339107 /nfs/dbraw/zinc/33/91/07/338339107.db2.gz OHQNIBUMTUTSRN-UHFFFAOYSA-N 1 2 305.303 4.061 20 0 DIADLO Fc1ccc(Cl)cc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438310612 338339251 /nfs/dbraw/zinc/33/92/51/338339251.db2.gz BXOJFDKQARSZTH-UHFFFAOYSA-N 1 2 315.779 4.336 20 0 DIADLO Fc1cc(Cl)cc(NCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000438320660 338339562 /nfs/dbraw/zinc/33/95/62/338339562.db2.gz YPXMNVCGSCYVBX-UHFFFAOYSA-N 1 2 315.779 4.336 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3C[C@H](C)O[C@H](C)[C@H]3C)cs2)cc1 ZINC000438366079 338341489 /nfs/dbraw/zinc/34/14/89/338341489.db2.gz UNKXVJWWARSZEY-RRFJBIMHSA-N 1 2 316.470 4.116 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3C[C@H](C)O[C@H](C)[C@H]3C)cs2)cc1 ZINC000438366079 338341490 /nfs/dbraw/zinc/34/14/90/338341490.db2.gz UNKXVJWWARSZEY-RRFJBIMHSA-N 1 2 316.470 4.116 20 0 DIADLO Cc1ccc(SCC[N@@H+]2CCO[C@@H](c3ccco3)C2)cc1C ZINC000438554365 338347972 /nfs/dbraw/zinc/34/79/72/338347972.db2.gz OGPMSPCJTDFFLK-GOSISDBHSA-N 1 2 317.454 4.062 20 0 DIADLO Cc1ccc(SCC[N@H+]2CCO[C@@H](c3ccco3)C2)cc1C ZINC000438554365 338347973 /nfs/dbraw/zinc/34/79/73/338347973.db2.gz OGPMSPCJTDFFLK-GOSISDBHSA-N 1 2 317.454 4.062 20 0 DIADLO Cc1ccsc1CCCC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000439017165 338358546 /nfs/dbraw/zinc/35/85/46/338358546.db2.gz AOPAUXYFVAYIFB-UHFFFAOYSA-N 1 2 313.426 4.203 20 0 DIADLO CCCCCn1c2ccccc2nc1SCc1c[nH+]cn1C ZINC000439509839 338372145 /nfs/dbraw/zinc/37/21/45/338372145.db2.gz KRZVUFVAJMEUOM-UHFFFAOYSA-N 1 2 314.458 4.252 20 0 DIADLO Fc1cc2cccnc2c(CSCc2cn3ccccc3[nH+]2)c1 ZINC000439539324 338372644 /nfs/dbraw/zinc/37/26/44/338372644.db2.gz FRSWUWCTCVZOSC-UHFFFAOYSA-N 1 2 323.396 4.455 20 0 DIADLO CCC[C@H]([NH2+][C@H](C)c1ccc(C(F)(F)F)cc1)C(=O)OCC ZINC000439545594 338372845 /nfs/dbraw/zinc/37/28/45/338372845.db2.gz HQLOANJXVFPRBP-RISCZKNCSA-N 1 2 317.351 4.088 20 0 DIADLO Cc1ccccc1CCCn1nc(C(F)(F)F)c2c[nH+]ccc21 ZINC000439893944 338380402 /nfs/dbraw/zinc/38/04/02/338380402.db2.gz ZAYBKAUQHIJTHK-UHFFFAOYSA-N 1 2 319.330 4.391 20 0 DIADLO CCC(CC)(C(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000440396805 338386737 /nfs/dbraw/zinc/38/67/37/338386737.db2.gz GNFIZORLWQXMJP-UHFFFAOYSA-N 1 2 321.424 4.339 20 0 DIADLO C[C@H](SCC(C)(C)C)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000440582310 338391045 /nfs/dbraw/zinc/39/10/45/338391045.db2.gz GQDYQMRBEHHPGG-LBPRGKRZSA-N 1 2 317.458 4.183 20 0 DIADLO Cc1ccc(/C=C/CC(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000440592818 338391592 /nfs/dbraw/zinc/39/15/92/338391592.db2.gz XPTAWOBIZQPXTI-NSCUHMNNSA-N 1 2 317.392 4.427 20 0 DIADLO COc1cccc2c(N3CCC[C@H](C(F)(F)F)[C@H]3C)cc[nH+]c12 ZINC000440643691 338394023 /nfs/dbraw/zinc/39/40/23/338394023.db2.gz ABEDVWXZSPIBAX-YPMHNXCESA-N 1 2 324.346 4.411 20 0 DIADLO COc1cccc([C@H](C)Nc2cc[nH+]c3c(OC)cccc23)c1 ZINC000440664097 338394729 /nfs/dbraw/zinc/39/47/29/338394729.db2.gz OWTQIZYIRNULNZ-ZDUSSCGKSA-N 1 2 308.381 4.425 20 0 DIADLO CN(C)c1ccc(Nc2ncnc3sc4ccccc4c32)c[nH+]1 ZINC000440664911 338394820 /nfs/dbraw/zinc/39/48/20/338394820.db2.gz MBSSITFWGOVQCL-UHFFFAOYSA-N 1 2 321.409 4.049 20 0 DIADLO CC[C@H](F)C[N@@H+]1CCC[C@H]1c1nc(-c2ccc(F)cc2)c[nH]1 ZINC000440785570 338397404 /nfs/dbraw/zinc/39/74/04/338397404.db2.gz PRPYYNGSPBGWEF-BBRMVZONSA-N 1 2 305.372 4.101 20 0 DIADLO CC[C@H](F)C[N@H+]1CCC[C@H]1c1nc(-c2ccc(F)cc2)c[nH]1 ZINC000440785570 338397405 /nfs/dbraw/zinc/39/74/05/338397405.db2.gz PRPYYNGSPBGWEF-BBRMVZONSA-N 1 2 305.372 4.101 20 0 DIADLO Cc1ccc(Cl)c(N(Cc2[nH]cc[nH+]2)C(=O)C2CCCC2)c1 ZINC000440883770 338399210 /nfs/dbraw/zinc/39/92/10/338399210.db2.gz GBINGEIDROKHRE-UHFFFAOYSA-N 1 2 317.820 4.095 20 0 DIADLO Cc1cc(C)cc(NC(=O)C[N@@H+]([C@@H](C)c2ccco2)C2CC2)c1 ZINC000440895816 338399448 /nfs/dbraw/zinc/39/94/48/338399448.db2.gz YXMAJGLVVBROJT-HNNXBMFYSA-N 1 2 312.413 4.061 20 0 DIADLO Cc1cc(C)cc(NC(=O)C[N@H+]([C@@H](C)c2ccco2)C2CC2)c1 ZINC000440895816 338399449 /nfs/dbraw/zinc/39/94/49/338399449.db2.gz YXMAJGLVVBROJT-HNNXBMFYSA-N 1 2 312.413 4.061 20 0 DIADLO CCC[C@H](C)C(=O)N(Cc1[nH]cc[nH+]1)c1cc(C)ccc1Cl ZINC000440906928 338399812 /nfs/dbraw/zinc/39/98/12/338399812.db2.gz VMKHUPVGGHYOSX-ZDUSSCGKSA-N 1 2 319.836 4.341 20 0 DIADLO Cc1cc(N[C@H](c2[nH]cc[nH+]2)c2cccnc2)cc(C)c1Cl ZINC000442805380 338432804 /nfs/dbraw/zinc/43/28/04/338432804.db2.gz AFRSHSWNXGBIJQ-INIZCTEOSA-N 1 2 312.804 4.276 20 0 DIADLO Cc1ccc(NC(=O)[C@H](Sc2ccccc2)C(C)C)c(C)[nH+]1 ZINC000446439190 338528141 /nfs/dbraw/zinc/52/81/41/338528141.db2.gz VQTLVBRFPALWTG-QGZVFWFLSA-N 1 2 314.454 4.454 20 0 DIADLO Cc1ccc(NC(=O)CCc2ccc3ccccc3c2)c(C)[nH+]1 ZINC000446438002 338528194 /nfs/dbraw/zinc/52/81/94/338528194.db2.gz MDITWGKXLJJHCQ-UHFFFAOYSA-N 1 2 304.393 4.423 20 0 DIADLO Cc1ccc(NC(=O)c2[nH]c3ccc(F)cc3c2Cl)c(C)[nH+]1 ZINC000446878242 338539244 /nfs/dbraw/zinc/53/92/44/338539244.db2.gz VQJORMMKNMBFAG-UHFFFAOYSA-N 1 2 317.751 4.225 20 0 DIADLO CCSCCNc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000446902046 338540174 /nfs/dbraw/zinc/54/01/74/338540174.db2.gz HYHJUUOURBOGCK-UHFFFAOYSA-N 1 2 301.459 4.051 20 0 DIADLO Cc1cc(N2CCC[C@H]2c2nc3ccccc3n2C(C)C)nc[nH+]1 ZINC000447045478 338543533 /nfs/dbraw/zinc/54/35/33/338543533.db2.gz BFRDZMLTEHULJX-KRWDZBQOSA-N 1 2 321.428 4.057 20 0 DIADLO CC(C)[C@@H]1CN(Cc2[nH+]ccn2CC(F)(F)F)c2ccccc21 ZINC000447058415 338543852 /nfs/dbraw/zinc/54/38/52/338543852.db2.gz SYFOKNZRVUCMEB-AWEZNQCLSA-N 1 2 323.362 4.205 20 0 DIADLO Cc1ccc(NC(=O)NCc2csc3ccccc23)c(C)[nH+]1 ZINC000447164936 338546658 /nfs/dbraw/zinc/54/66/58/338546658.db2.gz FYKLRGPLUAVYOX-UHFFFAOYSA-N 1 2 311.410 4.235 20 0 DIADLO Cc1ccc(NC(=O)NCc2ccc(-c3ccccc3)o2)c(C)[nH+]1 ZINC000447164891 338546708 /nfs/dbraw/zinc/54/67/08/338546708.db2.gz FMJZEVOHIKCTEV-UHFFFAOYSA-N 1 2 321.380 4.280 20 0 DIADLO Cc1ccc(NC(=O)NC[C@@H](c2ccccc2)C(C)C)c(C)[nH+]1 ZINC000447177810 338547070 /nfs/dbraw/zinc/54/70/70/338547070.db2.gz OQTYDMSEMDRJTH-QGZVFWFLSA-N 1 2 311.429 4.260 20 0 DIADLO CC(C)c1nc2ccccc2c(SCCCn2cc[nH+]c2)n1 ZINC000447333058 338549894 /nfs/dbraw/zinc/54/98/94/338549894.db2.gz WLTWENFBOSOAQY-UHFFFAOYSA-N 1 2 312.442 4.132 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)c(C)c2)ccn1 ZINC000447571232 338557822 /nfs/dbraw/zinc/55/78/22/338557822.db2.gz JIJLXEFSEGZMLZ-UHFFFAOYSA-N 1 2 319.364 4.138 20 0 DIADLO C[C@@H]1CC(C)(C)C[C@H]1Nc1ccccc1OCCn1cc[nH+]c1 ZINC000447595406 338560953 /nfs/dbraw/zinc/56/09/53/338560953.db2.gz NISQJJDXGGZGEE-NVXWUHKLSA-N 1 2 313.445 4.199 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+]C2(c3ccccc3F)CC2)s1 ZINC000447928138 338571521 /nfs/dbraw/zinc/57/15/21/338571521.db2.gz CYVDEHIOVZCTLB-UHFFFAOYSA-N 1 2 304.434 4.359 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)[C@@H]1C[C@H]1C(F)(F)F ZINC000448969812 338581563 /nfs/dbraw/zinc/58/15/63/338581563.db2.gz OUUMFPNMTZIFLO-ZIAGYGMSSA-N 1 2 322.286 4.011 20 0 DIADLO Fc1ccccc1C=C1CC[NH+](Cc2ccncc2F)CC1 ZINC000449044124 338587401 /nfs/dbraw/zinc/58/74/01/338587401.db2.gz BQMHUELOGQTECO-UHFFFAOYSA-N 1 2 300.352 4.039 20 0 DIADLO C[C@H]1CSC[C@@H]1Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000449047557 338587827 /nfs/dbraw/zinc/58/78/27/338587827.db2.gz BZQYKJSJCPPLML-GUYCJALGSA-N 1 2 313.470 4.050 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)n1 ZINC000449117048 338594853 /nfs/dbraw/zinc/59/48/53/338594853.db2.gz NFKSLNILUNEBNI-KCJUWKMLSA-N 1 2 312.360 4.207 20 0 DIADLO CCCc1nc(C)c(C[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)o1 ZINC000449340220 338614967 /nfs/dbraw/zinc/61/49/67/338614967.db2.gz NFGZAPBUIRXHGU-LBPRGKRZSA-N 1 2 324.346 4.130 20 0 DIADLO CCCc1cccc(C[NH2+]Cc2noc(-c3cccs3)n2)c1 ZINC000449554209 338636909 /nfs/dbraw/zinc/63/69/09/338636909.db2.gz NMQXHTUCBZNAJT-UHFFFAOYSA-N 1 2 313.426 4.040 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(-c2ccc(C)cc2)o1 ZINC000449562270 338637944 /nfs/dbraw/zinc/63/79/44/338637944.db2.gz IPFOZAGQAIMXJO-OAHLLOKOSA-N 1 2 309.413 4.322 20 0 DIADLO Cc1c[nH+]c(CN2CCCC[C@@H]2c2ccc(Cl)cc2)n1C ZINC000449570751 338638909 /nfs/dbraw/zinc/63/89/09/338638909.db2.gz KGYMIQYBCJRAJP-MRXNPFEDSA-N 1 2 303.837 4.109 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3)cc2F)c2nccn21 ZINC000449574280 338639354 /nfs/dbraw/zinc/63/93/54/338639354.db2.gz UILDVUFTTOYOHJ-AUUYWEPGSA-N 1 2 321.399 4.485 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H]2CCCCC2(F)F)[nH+]1 ZINC000450208474 338671133 /nfs/dbraw/zinc/67/11/33/338671133.db2.gz NGZBUMJKOXZQPY-CYBMUJFWSA-N 1 2 319.355 4.149 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nc(C)no1)c1ccc(Cl)cc1Cl ZINC000450729165 338701930 /nfs/dbraw/zinc/70/19/30/338701930.db2.gz OANALGAVBSBQOL-OQPBUACISA-N 1 2 314.216 4.487 20 0 DIADLO CO[C@@H]1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C[C@@H]1C ZINC000450769577 338704727 /nfs/dbraw/zinc/70/47/27/338704727.db2.gz WLWKWTJHUFZHEI-XHDPSFHLSA-N 1 2 324.346 4.115 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2cc3cccc(F)c3o2)s1 ZINC000450835243 338707747 /nfs/dbraw/zinc/70/77/47/338707747.db2.gz NPQAQQWYBQZLPO-SNVBAGLBSA-N 1 2 319.405 4.398 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)Nc1nc(C)nc2sc(C)c(C)c21 ZINC000450836365 338707790 /nfs/dbraw/zinc/70/77/90/338707790.db2.gz YRPFLJATGOCYHT-SNVBAGLBSA-N 1 2 315.446 4.006 20 0 DIADLO CC(C)c1nnc(C[NH+]2CCC(F)(c3ccccc3)CC2)s1 ZINC000450878584 338710194 /nfs/dbraw/zinc/71/01/94/338710194.db2.gz MIUCZLBVYHUFNM-UHFFFAOYSA-N 1 2 319.449 4.122 20 0 DIADLO C[C@H](c1csnn1)[NH+]1CCC(c2cccc(Cl)c2)CC1 ZINC000450893150 338710994 /nfs/dbraw/zinc/71/09/94/338710994.db2.gz QWPIRSHALXNCTB-LLVKDONJSA-N 1 2 307.850 4.132 20 0 DIADLO Cc1cc(N2CCC[C@H]2c2ccc(F)cc2F)nc(C2CC2)[nH+]1 ZINC000450914299 338712289 /nfs/dbraw/zinc/71/22/89/338712289.db2.gz PNIHIGZBXYSWOH-INIZCTEOSA-N 1 2 315.367 4.282 20 0 DIADLO COc1cc[nH+]cc1CSC1CCC(C(F)(F)F)CC1 ZINC000451035430 338718589 /nfs/dbraw/zinc/71/85/89/338718589.db2.gz BMZOTAWHQYJWRA-UHFFFAOYSA-N 1 2 305.365 4.445 20 0 DIADLO O=C(Nc1c[nH+]c2n1CCCC2)c1ccc(C2=CCCC2)cc1 ZINC000452332497 338763857 /nfs/dbraw/zinc/76/38/57/338763857.db2.gz NHTOUDUIIAPEFX-UHFFFAOYSA-N 1 2 307.397 4.039 20 0 DIADLO Cc1csc(-c2cccc(N[C@H]3C[C@@H](C)n4cc[nH+]c43)c2)n1 ZINC000453186199 338804426 /nfs/dbraw/zinc/80/44/26/338804426.db2.gz MGTGITWOFZKASB-DOMZBBRYSA-N 1 2 310.426 4.433 20 0 DIADLO Cc1csc(-c2cccc(N[C@H]3C[C@H](C)n4cc[nH+]c43)c2)n1 ZINC000453186221 338804477 /nfs/dbraw/zinc/80/44/77/338804477.db2.gz MGTGITWOFZKASB-WFASDCNBSA-N 1 2 310.426 4.433 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)Nc1cnn(-c2cc(C)ccc2C)c1C ZINC000453187159 338804666 /nfs/dbraw/zinc/80/46/66/338804666.db2.gz CEOREKNAGPCMDM-HNNXBMFYSA-N 1 2 323.444 4.187 20 0 DIADLO CCCCn1ncc(N[C@H](C)c2[nH+]ccn2CC)c1C(C)C ZINC000453206141 338807709 /nfs/dbraw/zinc/80/77/09/338807709.db2.gz HZCJQUMLGKMIBW-CQSZACIVSA-N 1 2 303.454 4.196 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@@H]1C[C@H](C)n2ccnc21 ZINC000453225846 338810607 /nfs/dbraw/zinc/81/06/07/338810607.db2.gz XIBXLQRWPNAZIH-CFVMTHIKSA-N 1 2 323.362 4.481 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1ccc(OC)c(Br)c1)C(F)F ZINC000453231974 338811582 /nfs/dbraw/zinc/81/15/82/338811582.db2.gz FVTCPEPJLJAXLD-GZMMTYOYSA-N 1 2 322.193 4.152 20 0 DIADLO CC[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1cccc(Cl)c1F ZINC000453332481 338826155 /nfs/dbraw/zinc/82/61/55/338826155.db2.gz AQUFIGRBNIUNOL-DDTOSNHZSA-N 1 2 307.800 4.422 20 0 DIADLO COc1ccc([C@H]([NH2+][C@@H](C)c2cncc(C)c2)c2ccco2)cc1 ZINC000453391843 338837036 /nfs/dbraw/zinc/83/70/36/338837036.db2.gz DONFBRJFOIMNMQ-YWZLYKJASA-N 1 2 322.408 4.432 20 0 DIADLO CC(C)CC[C@H](NC(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21)C(C)(C)C ZINC000454513366 338865550 /nfs/dbraw/zinc/86/55/50/338865550.db2.gz IKSXAPOGLWCAQM-KFWWJZLASA-N 1 2 320.481 4.039 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC=C(c3ccccc3)C2)c(C)[nH+]1 ZINC000455468560 338895420 /nfs/dbraw/zinc/89/54/20/338895420.db2.gz BMGSNSXVEOUPLU-UHFFFAOYSA-N 1 2 321.424 4.328 20 0 DIADLO CCSCC[C@@H](C)N(C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455475688 338895719 /nfs/dbraw/zinc/89/57/19/338895719.db2.gz DQIQLQZWRKCBLG-CYBMUJFWSA-N 1 2 309.479 4.002 20 0 DIADLO Cc1oc2ccccc2c1CNC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455479359 338895795 /nfs/dbraw/zinc/89/57/95/338895795.db2.gz GLAMHXBMGHPDPN-UHFFFAOYSA-N 1 2 323.396 4.383 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@H]2c2ccsc2)c(C)[nH+]1 ZINC000455486264 338896242 /nfs/dbraw/zinc/89/62/42/338896242.db2.gz RPOPRDVMJTWNOR-HNNXBMFYSA-N 1 2 315.442 4.437 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2c3ccccc3C[C@H]2C)c(C)[nH+]1 ZINC000455487571 338896277 /nfs/dbraw/zinc/89/62/77/338896277.db2.gz SUVWCLQNPGOXNN-KZULUSFZSA-N 1 2 309.413 4.062 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H]2CC(C)(C)C)c(C)[nH+]1 ZINC000455491236 338896546 /nfs/dbraw/zinc/89/65/46/338896546.db2.gz YGCYOLJAAHVKNW-OAHLLOKOSA-N 1 2 303.450 4.439 20 0 DIADLO CSCC1CCC(NC(=O)Nc2c(C)cc(C)[nH+]c2C)CC1 ZINC000455518666 338897529 /nfs/dbraw/zinc/89/75/29/338897529.db2.gz LTMUZXFNEUNOOR-UHFFFAOYSA-N 1 2 321.490 4.050 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)C2=CCC(C)(C)CC2)[nH+]1 ZINC000455988166 338915765 /nfs/dbraw/zinc/91/57/65/338915765.db2.gz LSRUCNDXKGJHLA-UHFFFAOYSA-N 1 2 309.413 4.460 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456360817 338927621 /nfs/dbraw/zinc/92/76/21/338927621.db2.gz DGZAVOBBMNRVNV-FVQBIDKESA-N 1 2 303.450 4.002 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000456360816 338927684 /nfs/dbraw/zinc/92/76/84/338927684.db2.gz DGZAVOBBMNRVNV-BMFZPTHFSA-N 1 2 303.450 4.002 20 0 DIADLO Cc1cc(CCCC(=O)NCc2c[nH+]c(C)cc2C)c(C)s1 ZINC000456840241 338943356 /nfs/dbraw/zinc/94/33/56/338943356.db2.gz NGLYHRLQQGRGRI-UHFFFAOYSA-N 1 2 316.470 4.016 20 0 DIADLO CCCCCN(C(=O)N[C@H](C)c1[nH+]ccn1CC)[C@H](C)CCC ZINC000459053758 339012208 /nfs/dbraw/zinc/01/22/08/339012208.db2.gz HKQKGXYJFZTXEH-HZPDHXFCSA-N 1 2 322.497 4.354 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)N(CCC(C)C)CCC(C)C ZINC000459109637 339013931 /nfs/dbraw/zinc/01/39/31/339013931.db2.gz KVDGYYMLPJALJA-MRXNPFEDSA-N 1 2 322.497 4.068 20 0 DIADLO C[C@]1(NC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)CC=CCC1 ZINC000459396217 339026901 /nfs/dbraw/zinc/02/69/01/339026901.db2.gz BZKFRQISIJZGLC-IBGZPJMESA-N 1 2 323.396 4.494 20 0 DIADLO COCc1cc(C[NH2+][C@H](C)c2ccc(SC(C)C)cc2)no1 ZINC000459405465 339027406 /nfs/dbraw/zinc/02/74/06/339027406.db2.gz KIBWBZAEOHWNRF-CYBMUJFWSA-N 1 2 320.458 4.172 20 0 DIADLO Cc1cc(C[NH2+]Cc2ccc(C)cc2O[C@@H](C)CC(C)C)no1 ZINC000459438561 339029220 /nfs/dbraw/zinc/02/92/20/339029220.db2.gz HWZHOQPRNKNJDI-HNNXBMFYSA-N 1 2 316.445 4.395 20 0 DIADLO CCOc1cc(CNc2cc(CSCC)cc[nH+]2)ccc1O ZINC000459443770 339029518 /nfs/dbraw/zinc/02/95/18/339029518.db2.gz BBURHQNCUASUNL-UHFFFAOYSA-N 1 2 318.442 4.051 20 0 DIADLO CCCc1nc(C)c(C[NH2+]Cc2c(F)cc(C)cc2Cl)o1 ZINC000459562532 339035822 /nfs/dbraw/zinc/03/58/22/339035822.db2.gz SXBOHISBHYGAIN-UHFFFAOYSA-N 1 2 310.800 4.326 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2nc(-c3ccccc3)c[nH]2)cc(C)c1O ZINC000459570631 339036604 /nfs/dbraw/zinc/03/66/04/339036604.db2.gz BPOOZPPLYBFNOL-UHFFFAOYSA-N 1 2 321.424 4.031 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2nc(-c3ccccc3)c[nH]2)cc(C)c1O ZINC000459570631 339036605 /nfs/dbraw/zinc/03/66/05/339036605.db2.gz BPOOZPPLYBFNOL-UHFFFAOYSA-N 1 2 321.424 4.031 20 0 DIADLO CCC1(c2ccccc2)CN(C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000459574263 339036808 /nfs/dbraw/zinc/03/68/08/339036808.db2.gz DCCJCTGHCAOAMK-UHFFFAOYSA-N 1 2 323.440 4.202 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2c1c(F)ccc2F)c1nc2c(s1)CCC2 ZINC000459630674 339039350 /nfs/dbraw/zinc/03/93/50/339039350.db2.gz IYLZKSORPTVTIK-YMTOWFKASA-N 1 2 320.408 4.248 20 0 DIADLO COc1ccc(Cl)c(C[NH2+][C@H](C)c2nc3c(s2)CCC3)c1 ZINC000459634847 339039533 /nfs/dbraw/zinc/03/95/33/339039533.db2.gz SSOPCSDVRBGKOU-SNVBAGLBSA-N 1 2 322.861 4.145 20 0 DIADLO CC1(CC(F)(F)F)C[NH+](Cc2cc3c(cccc3F)[nH]2)C1 ZINC000459639493 339039788 /nfs/dbraw/zinc/03/97/88/339039788.db2.gz OFORKRPERVXWEJ-UHFFFAOYSA-N 1 2 300.299 4.081 20 0 DIADLO COc1cc(C[NH+]2CC(C)(CC(F)(F)F)C2)ccc1SC ZINC000459638017 339039807 /nfs/dbraw/zinc/03/98/07/339039807.db2.gz MMYBSJJOTTXJRT-UHFFFAOYSA-N 1 2 319.392 4.191 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1nc2c(s1)CCC2 ZINC000459649878 339040313 /nfs/dbraw/zinc/04/03/13/339040313.db2.gz MQSUBUALWUTJAP-SNVBAGLBSA-N 1 2 321.515 4.237 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1nc2ccc(F)cc2o1 ZINC000459662522 339041362 /nfs/dbraw/zinc/04/13/62/339041362.db2.gz BCNDSTXMZXVAEV-GFCCVEGCSA-N 1 2 314.360 4.135 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](CCc2ccccc2)C(F)F)nc1C ZINC000459682026 339042878 /nfs/dbraw/zinc/04/28/78/339042878.db2.gz YVYPSBCTDPKBHD-KRWDZBQOSA-N 1 2 304.384 4.055 20 0 DIADLO Cc1ncc(C[NH2+]Cc2c(Cl)cccc2SC(C)C)o1 ZINC000459683057 339042951 /nfs/dbraw/zinc/04/29/51/339042951.db2.gz ZFLYNECCEUXVII-UHFFFAOYSA-N 1 2 310.850 4.427 20 0 DIADLO CC(C)n1ncnc1C[N@@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000459730898 339044804 /nfs/dbraw/zinc/04/48/04/339044804.db2.gz CCBLNPDYQQPWHZ-LJQANCHMSA-N 1 2 324.472 4.366 20 0 DIADLO CC(C)n1ncnc1C[N@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000459730898 339044805 /nfs/dbraw/zinc/04/48/05/339044805.db2.gz CCBLNPDYQQPWHZ-LJQANCHMSA-N 1 2 324.472 4.366 20 0 DIADLO CCc1ccc(-c2ccc(C[NH2+][C@@H](C)c3ccn(C)n3)o2)cc1 ZINC000459757245 339046589 /nfs/dbraw/zinc/04/65/89/339046589.db2.gz PULFLMGEJQHKLK-AWEZNQCLSA-N 1 2 309.413 4.093 20 0 DIADLO CCCCCOc1ccc(C(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC000460337681 339055689 /nfs/dbraw/zinc/05/56/89/339055689.db2.gz FHNMUVULGVAEPI-UHFFFAOYSA-N 1 2 323.396 4.156 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ccc(C(F)F)cc1)C(=O)OC(C)(C)C ZINC000461379919 339062758 /nfs/dbraw/zinc/06/27/58/339062758.db2.gz LVRGJGXLLKPTHS-AWEZNQCLSA-N 1 2 313.388 4.080 20 0 DIADLO FC(F)(F)Cn1cc[nH+]c1CNc1cc(Cl)ccc1Cl ZINC000462206964 339073991 /nfs/dbraw/zinc/07/39/91/339073991.db2.gz DRZFRPYTVGAMJK-UHFFFAOYSA-N 1 2 324.133 4.364 20 0 DIADLO CC(C)C[C@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000462487341 339079962 /nfs/dbraw/zinc/07/99/62/339079962.db2.gz UBAVQYUTHMITNL-LBPRGKRZSA-N 1 2 305.809 4.146 20 0 DIADLO Brc1ccsc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000462782225 339088286 /nfs/dbraw/zinc/08/82/86/339088286.db2.gz ANUIZPPZFNXGOD-CYBMUJFWSA-N 1 2 308.244 4.458 20 0 DIADLO Brc1ccsc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000462782225 339088285 /nfs/dbraw/zinc/08/82/85/339088285.db2.gz ANUIZPPZFNXGOD-CYBMUJFWSA-N 1 2 308.244 4.458 20 0 DIADLO Brc1ccsc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000462782226 339088297 /nfs/dbraw/zinc/08/82/97/339088297.db2.gz ANUIZPPZFNXGOD-ZDUSSCGKSA-N 1 2 308.244 4.458 20 0 DIADLO Brc1ccsc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000462782226 339088298 /nfs/dbraw/zinc/08/82/98/339088298.db2.gz ANUIZPPZFNXGOD-ZDUSSCGKSA-N 1 2 308.244 4.458 20 0 DIADLO CCCOc1cc(C)ccc1C[NH2+][C@@H](C)c1csc(C)n1 ZINC000462805580 339090202 /nfs/dbraw/zinc/09/02/02/339090202.db2.gz VDZGMLVMAWLLIE-ZDUSSCGKSA-N 1 2 304.459 4.400 20 0 DIADLO Cc1ccccc1CN(Cc1ccccc1)c1cc[nH+]c(C)n1 ZINC000462811948 339091053 /nfs/dbraw/zinc/09/10/53/339091053.db2.gz YFTXWPILSPWNGJ-UHFFFAOYSA-N 1 2 303.409 4.300 20 0 DIADLO CCc1cc(N2CCCC(C)(C)CC2)nc(-c2ccncc2)[nH+]1 ZINC000462889408 339096286 /nfs/dbraw/zinc/09/62/86/339096286.db2.gz JQNIBFRHKWPCEW-UHFFFAOYSA-N 1 2 310.445 4.118 20 0 DIADLO COc1ccc(F)cc1C[NH2+]Cc1cc(F)c(Cl)cc1F ZINC000462915866 339097882 /nfs/dbraw/zinc/09/78/82/339097882.db2.gz XEUQTGHNVAISFF-UHFFFAOYSA-N 1 2 315.722 4.056 20 0 DIADLO Cc1[nH+]cn(-c2ccc(NC3Cc4ccccc4C3)cc2)c1C ZINC000463028696 339101458 /nfs/dbraw/zinc/10/14/58/339101458.db2.gz OHIRZKRXBIQUMG-UHFFFAOYSA-N 1 2 303.409 4.068 20 0 DIADLO CC(C)C[C@@H](C)CC(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000463031247 339101906 /nfs/dbraw/zinc/10/19/06/339101906.db2.gz FJWSIRFZMVBFAS-HZPDHXFCSA-N 1 2 322.518 4.026 20 0 DIADLO Cc1cc(N2C[C@H](C)C[C@H]2c2ccccc2F)nc(C2CC2)[nH+]1 ZINC000463088914 339105314 /nfs/dbraw/zinc/10/53/14/339105314.db2.gz YZHLFEINVZYPFR-PXAZEXFGSA-N 1 2 311.404 4.389 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cncc(C(F)(F)F)c2)[C@@H]1c1ccccc1 ZINC000463098732 339105625 /nfs/dbraw/zinc/10/56/25/339105625.db2.gz ZRKYTHCKYKLJQN-WBMJQRKESA-N 1 2 306.331 4.293 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cncc(C(F)(F)F)c2)[C@@H]1c1ccccc1 ZINC000463098732 339105626 /nfs/dbraw/zinc/10/56/26/339105626.db2.gz ZRKYTHCKYKLJQN-WBMJQRKESA-N 1 2 306.331 4.293 20 0 DIADLO Fc1ccc(CNc2[nH+]cccc2OC(F)F)cc1Cl ZINC000463249786 339112041 /nfs/dbraw/zinc/11/20/41/339112041.db2.gz HEJUYEUSAGGIAG-UHFFFAOYSA-N 1 2 302.683 4.088 20 0 DIADLO CC(C)Oc1ccccc1CNc1[nH+]cccc1OC(F)F ZINC000463248793 339112047 /nfs/dbraw/zinc/11/20/47/339112047.db2.gz BOVIHFFDYWYQAO-UHFFFAOYSA-N 1 2 308.328 4.082 20 0 DIADLO CCC[C@@H]1C[C@H]1C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000463586558 339122241 /nfs/dbraw/zinc/12/22/41/339122241.db2.gz BYVXFDMTPLRWGP-CRAIPNDOSA-N 1 2 323.440 4.261 20 0 DIADLO CCCC[C@@H](CC)C(=O)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1 ZINC000464094334 339134292 /nfs/dbraw/zinc/13/42/92/339134292.db2.gz RAESRVXOKCIJFA-CQSZACIVSA-N 1 2 317.408 4.298 20 0 DIADLO CCCCc1noc(C[N@@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)n1 ZINC000464725503 339150116 /nfs/dbraw/zinc/15/01/16/339150116.db2.gz OCBBKMDBJZDCBU-BBRMVZONSA-N 1 2 317.408 4.134 20 0 DIADLO CCCCc1noc(C[N@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)n1 ZINC000464725503 339150117 /nfs/dbraw/zinc/15/01/17/339150117.db2.gz OCBBKMDBJZDCBU-BBRMVZONSA-N 1 2 317.408 4.134 20 0 DIADLO CCCCc1noc(C[N@@H+]2C[C@H](C)C[C@H]2c2ccccc2F)n1 ZINC000464725504 339150123 /nfs/dbraw/zinc/15/01/23/339150123.db2.gz OCBBKMDBJZDCBU-CJNGLKHVSA-N 1 2 317.408 4.134 20 0 DIADLO CCCCc1noc(C[N@H+]2C[C@H](C)C[C@H]2c2ccccc2F)n1 ZINC000464725504 339150124 /nfs/dbraw/zinc/15/01/24/339150124.db2.gz OCBBKMDBJZDCBU-CJNGLKHVSA-N 1 2 317.408 4.134 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(Cl)c2)[C@@H](c2ccccc2)CO1 ZINC000464826264 339155417 /nfs/dbraw/zinc/15/54/17/339155417.db2.gz ZJKJUTUHDJFGQR-KBXCAEBGSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(Cl)c2)[C@@H](c2ccccc2)CO1 ZINC000464826264 339155418 /nfs/dbraw/zinc/15/54/18/339155418.db2.gz ZJKJUTUHDJFGQR-KBXCAEBGSA-N 1 2 301.817 4.302 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2nc(C(C)C)no2)o1 ZINC000464831957 339155942 /nfs/dbraw/zinc/15/59/42/339155942.db2.gz KZNFEMXYGBYGPR-UKRRQHHQSA-N 1 2 317.433 4.322 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2nc(C(C)C)no2)o1 ZINC000464831957 339155943 /nfs/dbraw/zinc/15/59/43/339155943.db2.gz KZNFEMXYGBYGPR-UKRRQHHQSA-N 1 2 317.433 4.322 20 0 DIADLO CCCCc1noc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccc(C)o2)n1 ZINC000464834821 339156102 /nfs/dbraw/zinc/15/61/02/339156102.db2.gz HHXWEEBAWIUZLR-HIFRSBDPSA-N 1 2 317.433 4.287 20 0 DIADLO CCCCc1noc(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccc(C)o2)n1 ZINC000464834821 339156103 /nfs/dbraw/zinc/15/61/03/339156103.db2.gz HHXWEEBAWIUZLR-HIFRSBDPSA-N 1 2 317.433 4.287 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(Cl)c1Cl)CO2 ZINC000466458801 339205819 /nfs/dbraw/zinc/20/58/19/339205819.db2.gz QJAUTCHOBIWXQN-ZDUSSCGKSA-N 1 2 312.171 4.356 20 0 DIADLO COc1ccc(CNc2[nH+]cccc2-c2ccccc2)cc1OC ZINC000466619011 339210701 /nfs/dbraw/zinc/21/07/01/339210701.db2.gz VQZCOJZFYIRNEZ-UHFFFAOYSA-N 1 2 320.392 4.378 20 0 DIADLO c1c(CSC[C@@H]2CCC3(CCCCC3)O2)[nH+]c2ccccn12 ZINC000466733773 339214931 /nfs/dbraw/zinc/21/49/31/339214931.db2.gz FBGYVKBNGGMCSZ-INIZCTEOSA-N 1 2 316.470 4.449 20 0 DIADLO Fc1ccc(C[N@@H+]2CCO[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000467175096 339227298 /nfs/dbraw/zinc/22/72/98/339227298.db2.gz HZLWEYUSBZAUKW-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc(C[N@H+]2CCO[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000467175096 339227299 /nfs/dbraw/zinc/22/72/99/339227299.db2.gz HZLWEYUSBZAUKW-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO CC(=O)c1cc(Cl)ccc1OCc1ccc2[nH]c(C)[nH+]c2c1 ZINC000467205191 339228218 /nfs/dbraw/zinc/22/82/18/339228218.db2.gz FPSXFIMVXXZNAS-UHFFFAOYSA-N 1 2 314.772 4.306 20 0 DIADLO CC(=O)c1cc(Cl)ccc1OCc1ccc2[nH+]c(C)[nH]c2c1 ZINC000467205191 339228219 /nfs/dbraw/zinc/22/82/19/339228219.db2.gz FPSXFIMVXXZNAS-UHFFFAOYSA-N 1 2 314.772 4.306 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1CN1CCC=Cc2ccccc21 ZINC000467285333 339229829 /nfs/dbraw/zinc/22/98/29/339229829.db2.gz DIELBWSPVICSOZ-UHFFFAOYSA-N 1 2 315.420 4.355 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@H](Nc2ccc3n[nH]cc3c2)C1 ZINC000467352935 339233384 /nfs/dbraw/zinc/23/33/84/339233384.db2.gz IQUBAAZBFQPJJY-HOCLYGCPSA-N 1 2 306.413 4.405 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@@H](Nc2ccc3n[nH]cc3c2)C1 ZINC000467352934 339233440 /nfs/dbraw/zinc/23/34/40/339233440.db2.gz IQUBAAZBFQPJJY-GOEBONIOSA-N 1 2 306.413 4.405 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)cc1F ZINC000467742525 339245428 /nfs/dbraw/zinc/24/54/28/339245428.db2.gz WACKVAAACKTWRO-SECBINFHSA-N 1 2 318.339 4.460 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)c1ccc(C(C)C)c(Cl)c1 ZINC000468023394 339251482 /nfs/dbraw/zinc/25/14/82/339251482.db2.gz AQONVAJDPFZPIT-UHFFFAOYSA-N 1 2 302.805 4.095 20 0 DIADLO C[C@@H]1c2cc(F)cc(F)c2CC[N@H+]1Cc1nc2ccccc2o1 ZINC000468117390 339254645 /nfs/dbraw/zinc/25/46/45/339254645.db2.gz PXMSHXVZNGGNIJ-LLVKDONJSA-N 1 2 314.335 4.225 20 0 DIADLO C[C@@H]1c2cc(F)cc(F)c2CC[N@@H+]1Cc1nc2ccccc2o1 ZINC000468117390 339254646 /nfs/dbraw/zinc/25/46/46/339254646.db2.gz PXMSHXVZNGGNIJ-LLVKDONJSA-N 1 2 314.335 4.225 20 0 DIADLO Fc1ccccc1SCC[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000468126915 339254921 /nfs/dbraw/zinc/25/49/21/339254921.db2.gz OPBQTZRHBCENDX-OAHLLOKOSA-N 1 2 323.458 4.053 20 0 DIADLO Fc1ccccc1SCC[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000468126915 339254922 /nfs/dbraw/zinc/25/49/22/339254922.db2.gz OPBQTZRHBCENDX-OAHLLOKOSA-N 1 2 323.458 4.053 20 0 DIADLO CCCCOc1ccccc1C[N@@H+]1CCO[C@H](c2ccco2)C1 ZINC000468395283 339261711 /nfs/dbraw/zinc/26/17/11/339261711.db2.gz YSCXNMPLTWGASG-IBGZPJMESA-N 1 2 315.413 4.032 20 0 DIADLO CCCCOc1ccccc1C[N@H+]1CCO[C@H](c2ccco2)C1 ZINC000468395283 339261712 /nfs/dbraw/zinc/26/17/12/339261712.db2.gz YSCXNMPLTWGASG-IBGZPJMESA-N 1 2 315.413 4.032 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)c1cc[nH+]c(C)n1 ZINC000468883995 339273629 /nfs/dbraw/zinc/27/36/29/339273629.db2.gz IKEKCNAKDUMIDX-CYBMUJFWSA-N 1 2 324.453 4.414 20 0 DIADLO CCCCCc1ccc(NC(=O)[C@@H]2CCCc3[nH+]c[nH]c32)cc1 ZINC000469074085 339279395 /nfs/dbraw/zinc/27/93/95/339279395.db2.gz XPWNCTHTAGTLSM-MRXNPFEDSA-N 1 2 311.429 4.201 20 0 DIADLO Cc1c2cc(C)c(C)cc2sc1C(=O)Nc1cc[nH+]cc1C ZINC000469372038 339287162 /nfs/dbraw/zinc/28/71/62/339287162.db2.gz VOMBFVIABVIRJA-UHFFFAOYSA-N 1 2 310.422 4.204 20 0 DIADLO CCc1nc(C[N@H+](Cc2ccccc2)[C@H](C)C(C)(C)C)no1 ZINC000469445680 339289484 /nfs/dbraw/zinc/28/94/84/339289484.db2.gz FQAZNHUBAYQFSV-CQSZACIVSA-N 1 2 301.434 4.069 20 0 DIADLO CCc1nc(C[N@@H+](Cc2ccccc2)[C@H](C)C(C)(C)C)no1 ZINC000469445680 339289485 /nfs/dbraw/zinc/28/94/85/339289485.db2.gz FQAZNHUBAYQFSV-CQSZACIVSA-N 1 2 301.434 4.069 20 0 DIADLO C[C@H]([N@H+](Cc1noc(C2CC2)n1)Cc1ccccc1)C(C)(C)C ZINC000469447088 339289735 /nfs/dbraw/zinc/28/97/35/339289735.db2.gz XSCSCJVAMXPBSB-AWEZNQCLSA-N 1 2 313.445 4.384 20 0 DIADLO C[C@H]([N@@H+](Cc1noc(C2CC2)n1)Cc1ccccc1)C(C)(C)C ZINC000469447088 339289736 /nfs/dbraw/zinc/28/97/36/339289736.db2.gz XSCSCJVAMXPBSB-AWEZNQCLSA-N 1 2 313.445 4.384 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)Cc2cccc(CC)c2)cs1 ZINC000469603379 339294177 /nfs/dbraw/zinc/29/41/77/339294177.db2.gz STQBZLOILRSXGU-CQSZACIVSA-N 1 2 318.486 4.435 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)Cc2cccc(CC)c2)cs1 ZINC000469603379 339294178 /nfs/dbraw/zinc/29/41/78/339294178.db2.gz STQBZLOILRSXGU-CQSZACIVSA-N 1 2 318.486 4.435 20 0 DIADLO C[C@H]1c2cc(Cl)c(Cl)cc2CC[N@H+]1CCOCC(F)F ZINC000469714135 339296156 /nfs/dbraw/zinc/29/61/56/339296156.db2.gz TXJPGQXTDICXFM-VIFPVBQESA-N 1 2 324.198 4.194 20 0 DIADLO C[C@H]1c2cc(Cl)c(Cl)cc2CC[N@@H+]1CCOCC(F)F ZINC000469714135 339296157 /nfs/dbraw/zinc/29/61/57/339296157.db2.gz TXJPGQXTDICXFM-VIFPVBQESA-N 1 2 324.198 4.194 20 0 DIADLO Clc1cc(C[N@@H+]2CCC23CCC3)ccc1Br ZINC000469715755 339296321 /nfs/dbraw/zinc/29/63/21/339296321.db2.gz FUFPISKUZXYXBJ-UHFFFAOYSA-N 1 2 300.627 4.231 20 0 DIADLO Clc1cc(C[N@H+]2CCC23CCC3)ccc1Br ZINC000469715755 339296322 /nfs/dbraw/zinc/29/63/22/339296322.db2.gz FUFPISKUZXYXBJ-UHFFFAOYSA-N 1 2 300.627 4.231 20 0 DIADLO CCc1ccc([C@@H](CO)[NH2+][C@H](C)c2csc(C(C)C)n2)cc1 ZINC000469784193 339299743 /nfs/dbraw/zinc/29/97/43/339299743.db2.gz VQZJHOPQUZUWQF-CZUORRHYSA-N 1 2 318.486 4.213 20 0 DIADLO CCc1ccc(-c2ccc(C(=O)N[C@@H](CC)c3[nH]cc[nH+]3)o2)cc1 ZINC000470696949 339325291 /nfs/dbraw/zinc/32/52/91/339325291.db2.gz JYOKSSBRGFMFAA-HNNXBMFYSA-N 1 2 323.396 4.113 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@H+](Cc2cccc(C(F)F)c2)CCO1 ZINC000470771004 339327351 /nfs/dbraw/zinc/32/73/51/339327351.db2.gz DIWGJPGFTYHKHO-KRWDZBQOSA-N 1 2 321.342 4.337 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@@H+](Cc2cccc(C(F)F)c2)CCO1 ZINC000470771004 339327352 /nfs/dbraw/zinc/32/73/52/339327352.db2.gz DIWGJPGFTYHKHO-KRWDZBQOSA-N 1 2 321.342 4.337 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)C(C)(C)C(F)F)cc2[nH+]1 ZINC000470848488 339329268 /nfs/dbraw/zinc/32/92/68/339329268.db2.gz SWYVSJWBZRDZCP-UHFFFAOYSA-N 1 2 309.360 4.135 20 0 DIADLO CC[C@H]1CN(c2cc[nH+]c(C3CC3)n2)CC[C@H]1c1ccccc1 ZINC000470869346 339329576 /nfs/dbraw/zinc/32/95/76/339329576.db2.gz BDQUJYVEFWYYND-MAUKXSAKSA-N 1 2 307.441 4.374 20 0 DIADLO C[C@H]1C[N@H+](Cc2nc(C3CCCCC3)cs2)C[C@H](C2CC2)O1 ZINC000470907596 339330903 /nfs/dbraw/zinc/33/09/03/339330903.db2.gz TYDUANDNRPHDFE-SUMWQHHRSA-N 1 2 320.502 4.190 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nc(C3CCCCC3)cs2)C[C@H](C2CC2)O1 ZINC000470907596 339330904 /nfs/dbraw/zinc/33/09/04/339330904.db2.gz TYDUANDNRPHDFE-SUMWQHHRSA-N 1 2 320.502 4.190 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1csc(-c2ccco2)n1 ZINC000470949672 339332517 /nfs/dbraw/zinc/33/25/17/339332517.db2.gz XIZCZXOKHORIHG-MWLCHTKSSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1csc(-c2ccco2)n1 ZINC000470949672 339332518 /nfs/dbraw/zinc/33/25/18/339332518.db2.gz XIZCZXOKHORIHG-MWLCHTKSSA-N 1 2 316.348 4.176 20 0 DIADLO Cc1cccc(-c2noc(C[N@H+]3C[C@H](C)[C@@H]3c3ccccc3)n2)c1 ZINC000471045301 339335439 /nfs/dbraw/zinc/33/54/39/339335439.db2.gz YLZFOQJXYVCAGD-HNAYVOBHSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1cccc(-c2noc(C[N@@H+]3C[C@H](C)[C@@H]3c3ccccc3)n2)c1 ZINC000471045301 339335440 /nfs/dbraw/zinc/33/54/40/339335440.db2.gz YLZFOQJXYVCAGD-HNAYVOBHSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1cccc(-c2noc(C[N@H+]3C[C@@H](C)[C@@H]3c3ccccc3)n2)c1 ZINC000471045300 339335502 /nfs/dbraw/zinc/33/55/02/339335502.db2.gz YLZFOQJXYVCAGD-DNVCBOLYSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1cccc(-c2noc(C[N@@H+]3C[C@@H](C)[C@@H]3c3ccccc3)n2)c1 ZINC000471045300 339335503 /nfs/dbraw/zinc/33/55/03/339335503.db2.gz YLZFOQJXYVCAGD-DNVCBOLYSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000471167428 339339305 /nfs/dbraw/zinc/33/93/05/339339305.db2.gz BRBMEDSFILAECN-KRWDZBQOSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)C[N@H+]1CC[C@H]1c1ccccc1 ZINC000471167428 339339306 /nfs/dbraw/zinc/33/93/06/339339306.db2.gz BRBMEDSFILAECN-KRWDZBQOSA-N 1 2 314.816 4.034 20 0 DIADLO CCc1ccc(-c2noc(C[N@@H+]3CC[C@@H]3c3ccccc3)n2)cc1 ZINC000471183241 339339888 /nfs/dbraw/zinc/33/98/88/339339888.db2.gz QSAUVYORYDNETL-GOSISDBHSA-N 1 2 319.408 4.246 20 0 DIADLO CCc1ccc(-c2noc(C[N@H+]3CC[C@@H]3c3ccccc3)n2)cc1 ZINC000471183241 339339889 /nfs/dbraw/zinc/33/98/89/339339889.db2.gz QSAUVYORYDNETL-GOSISDBHSA-N 1 2 319.408 4.246 20 0 DIADLO Cc1ccc(CCC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)o1 ZINC000471931292 339357770 /nfs/dbraw/zinc/35/77/70/339357770.db2.gz KMXCQONINQOTED-UHFFFAOYSA-N 1 2 322.364 4.347 20 0 DIADLO Fc1cccc(C[C@@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)c1 ZINC000473136799 339382140 /nfs/dbraw/zinc/38/21/40/339382140.db2.gz ACNLFLKOCXLCQW-ZDUSSCGKSA-N 1 2 310.825 4.143 20 0 DIADLO Fc1cccc(C[C@@H]2CCC[N@H+]2Cc2ncc(Cl)s2)c1 ZINC000473136799 339382141 /nfs/dbraw/zinc/38/21/41/339382141.db2.gz ACNLFLKOCXLCQW-ZDUSSCGKSA-N 1 2 310.825 4.143 20 0 DIADLO Cc1ccccc1OCCC[N@@H+](C)Cc1ncc(Cl)s1 ZINC000473144292 339382628 /nfs/dbraw/zinc/38/26/28/339382628.db2.gz NSHVDIFGSQALIR-UHFFFAOYSA-N 1 2 310.850 4.006 20 0 DIADLO Cc1ccccc1OCCC[N@H+](C)Cc1ncc(Cl)s1 ZINC000473144292 339382629 /nfs/dbraw/zinc/38/26/29/339382629.db2.gz NSHVDIFGSQALIR-UHFFFAOYSA-N 1 2 310.850 4.006 20 0 DIADLO COc1c2ccccc2oc1C[NH2+][C@H](C)c1ccc(Cl)cn1 ZINC000474038495 339398356 /nfs/dbraw/zinc/39/83/56/339398356.db2.gz UTHZMGMRPGDHBS-LLVKDONJSA-N 1 2 316.788 4.341 20 0 DIADLO COc1cc(NCCCc2ccc(C)[nH+]c2)c(OC)cc1Cl ZINC000474476803 339416574 /nfs/dbraw/zinc/41/65/74/339416574.db2.gz QFDAARFGHNWWJA-UHFFFAOYSA-N 1 2 320.820 4.105 20 0 DIADLO C[C@H]1CCc2nc(C[NH2+][C@H]3CSc4ccccc43)sc2C1 ZINC000498353548 339420900 /nfs/dbraw/zinc/42/09/00/339420900.db2.gz MIEYCRQGRYKNNK-FZMZJTMJSA-N 1 2 316.495 4.205 20 0 DIADLO Cc1nc(N2CCC(=Cc3ccccc3F)CC2)c(C)c(C)[nH+]1 ZINC000474792183 339426030 /nfs/dbraw/zinc/42/60/30/339426030.db2.gz LBOIDKVZJLQZMV-UHFFFAOYSA-N 1 2 311.404 4.225 20 0 DIADLO CCC[C@@](C)(CC)C(=O)NCCCn1c(C)[nH+]c2ccccc21 ZINC000474875730 339429395 /nfs/dbraw/zinc/42/93/95/339429395.db2.gz BYCPWUSJLNGPBG-LJQANCHMSA-N 1 2 315.461 4.067 20 0 DIADLO COc1ccc([C@H](C)[C@H](C)Nc2ccc[nH+]c2C)cc1OC ZINC000474885574 339429941 /nfs/dbraw/zinc/42/99/41/339429941.db2.gz FSJATGUIONMGMA-OLZOCXBDSA-N 1 2 300.402 4.011 20 0 DIADLO CCC[C@](C)(CC)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000475019183 339435327 /nfs/dbraw/zinc/43/53/27/339435327.db2.gz UKYYKLSTAHPGGC-KRWDZBQOSA-N 1 2 303.381 4.166 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@@H](C(C)(C)C)C[C@@H]2C)c(C)[nH+]1 ZINC000477160147 339488208 /nfs/dbraw/zinc/48/82/08/339488208.db2.gz HWWRTJCQXQQPSO-DZGCQCFKSA-N 1 2 303.450 4.377 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2ncc(C)o2)c2ccc(C)cc2)cc1 ZINC000477582601 339497563 /nfs/dbraw/zinc/49/75/63/339497563.db2.gz UFSITGJIOGCIOQ-FQEVSTJZSA-N 1 2 322.408 4.179 20 0 DIADLO Cc1ccc(C)c(CC(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1 ZINC000477981292 339506737 /nfs/dbraw/zinc/50/67/37/339506737.db2.gz RSUVQMMDHPHJHD-UHFFFAOYSA-N 1 2 319.408 4.183 20 0 DIADLO CC(C)(C(=O)Nc1ccc2c(c1)[nH+]c1n2CCCCC1)C1CC1 ZINC000478301330 339513047 /nfs/dbraw/zinc/51/30/47/339513047.db2.gz WGKHLAHHFXFJSK-UHFFFAOYSA-N 1 2 311.429 4.137 20 0 DIADLO CCc1cc(NC(=O)c2ccc(Cn3cc[nH+]c3)cc2)ccc1C ZINC000479432398 339534914 /nfs/dbraw/zinc/53/49/14/339534914.db2.gz YQIZHPBJBCIGNX-UHFFFAOYSA-N 1 2 319.408 4.055 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@H](C)c2cncs2)c2ccccn2)cc1 ZINC000479508276 339538610 /nfs/dbraw/zinc/53/86/10/339538610.db2.gz YWIBGHLBBMIJPY-RDTXWAMCSA-N 1 2 309.438 4.287 20 0 DIADLO Cc1cc(C)cc(NC(=O)NCc2cccc(-c3[nH]cc[nH+]3)c2)c1 ZINC000479670542 339545267 /nfs/dbraw/zinc/54/52/67/339545267.db2.gz BNPCFFHQRHQMAC-UHFFFAOYSA-N 1 2 320.396 4.015 20 0 DIADLO C[C@@H]([NH2+]Cc1ncoc1-c1ccccc1)c1ccc(Cl)cn1 ZINC000480194750 339562973 /nfs/dbraw/zinc/56/29/73/339562973.db2.gz LKRDHTUWDDPFQI-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO CCN(C)c1ccc(CNc2ccc(C(F)(F)F)cc2)c[nH+]1 ZINC000480271243 339566441 /nfs/dbraw/zinc/56/64/41/339566441.db2.gz YPESAOZBJTXNLZ-UHFFFAOYSA-N 1 2 309.335 4.169 20 0 DIADLO Cc1cc(N2C[C@@H](C)C[C@@H]2c2ccc(C(F)(F)F)cc2)nc[nH+]1 ZINC000482098740 339622981 /nfs/dbraw/zinc/62/29/81/339622981.db2.gz LZXQJXLTOWBKGT-XHDPSFHLSA-N 1 2 321.346 4.391 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)cc(Cl)c1)c1nc(C(C)(C)C)no1 ZINC000483648605 339670603 /nfs/dbraw/zinc/67/06/03/339670603.db2.gz DSEHWLSBFXTTGX-SECBINFHSA-N 1 2 311.788 4.010 20 0 DIADLO CCC[C@@H](C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000485145223 339699103 /nfs/dbraw/zinc/69/91/03/339699103.db2.gz DBWIZKHXCVHANL-LJQANCHMSA-N 1 2 319.408 4.395 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCCCCCc1ccccc1 ZINC000485449424 339703562 /nfs/dbraw/zinc/70/35/62/339703562.db2.gz COFPPOIUTRPPHI-UHFFFAOYSA-N 1 2 311.429 4.233 20 0 DIADLO Cc1ccc(SCCC(=O)Nc2c(C)cc[nH+]c2C)cc1C ZINC000485475870 339704020 /nfs/dbraw/zinc/70/40/20/339704020.db2.gz CYNAZJMAXUGQFW-UHFFFAOYSA-N 1 2 314.454 4.436 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)Cc1c(Cl)cccc1Cl ZINC000485485937 339704278 /nfs/dbraw/zinc/70/42/78/339704278.db2.gz CKBILYGLAZIGRF-UHFFFAOYSA-N 1 2 309.196 4.186 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)C(c1ccccc1)c1ccccc1 ZINC000485491450 339704307 /nfs/dbraw/zinc/70/43/07/339704307.db2.gz PHYXEBVXQVVBRQ-UHFFFAOYSA-N 1 2 316.404 4.469 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccc(-c2ccccc2F)o1 ZINC000485493329 339704424 /nfs/dbraw/zinc/70/44/24/339704424.db2.gz QVBFKWLXYHNICL-UHFFFAOYSA-N 1 2 310.328 4.350 20 0 DIADLO Cc1cc(C)cc(C[C@@H](C)NC(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000485531473 339705051 /nfs/dbraw/zinc/70/50/51/339705051.db2.gz YYWBFAIAXDUOGK-OAHLLOKOSA-N 1 2 311.429 4.068 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)Cc2ccccc2)c1C(C)C ZINC000485675969 339709092 /nfs/dbraw/zinc/70/90/92/339709092.db2.gz UVGLYIXJHZZVRI-UHFFFAOYSA-N 1 2 318.420 4.270 20 0 DIADLO Cc1cccc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)c(C)c2)n1 ZINC000487696663 339761163 /nfs/dbraw/zinc/76/11/63/339761163.db2.gz IKSGSVMFNLGWCH-UHFFFAOYSA-N 1 2 319.364 4.138 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2C[C@H]2C(C)C)ccc1Oc1cc[nH+]cc1 ZINC000487708171 339761471 /nfs/dbraw/zinc/76/14/71/339761471.db2.gz LWHHKXGBIAYLOV-DLBZAZTESA-N 1 2 310.397 4.413 20 0 DIADLO CC(C)(C)[C@@H]1C[C@H](Nc2ccc(-n3cc[nH+]c3)c(F)c2)CS1 ZINC000488314714 339776792 /nfs/dbraw/zinc/77/67/92/339776792.db2.gz CCDFMABAJPLLHH-BBRMVZONSA-N 1 2 319.449 4.344 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(N[C@@H]2CS[C@H](C(C)(C)C)C2)c1 ZINC000488349948 339778080 /nfs/dbraw/zinc/77/80/80/339778080.db2.gz CRNFMXCDHQUEOQ-HOTGVXAUSA-N 1 2 315.486 4.419 20 0 DIADLO Clc1cccc2c(N3CCOC[C@H](C4CCC4)C3)cc[nH+]c12 ZINC000488723671 339791406 /nfs/dbraw/zinc/79/14/06/339791406.db2.gz QZTACVWMXUITPF-CQSZACIVSA-N 1 2 316.832 4.141 20 0 DIADLO Cc1ccncc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(C)c1 ZINC000489342319 339806488 /nfs/dbraw/zinc/80/64/88/339806488.db2.gz NODTXXUWJSXJOR-UHFFFAOYSA-N 1 2 319.364 4.138 20 0 DIADLO CCC(CC)[C@@H](C)C(=O)N(C)[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000492937997 339912976 /nfs/dbraw/zinc/91/29/76/339912976.db2.gz WMRLPTUNZQMJMY-RHSMWYFYSA-N 1 2 313.445 4.030 20 0 DIADLO O=C(C=Cc1c[nH]c[nH+]1)Nc1ccccc1SC1CCCC1 ZINC000493111473 339917558 /nfs/dbraw/zinc/91/75/58/339917558.db2.gz CITXJWIQYOJUGQ-KTKRTIGZSA-N 1 2 313.426 4.096 20 0 DIADLO Cc1cc(SC(C)(C)C)ccc1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000493324575 339923080 /nfs/dbraw/zinc/92/30/80/339923080.db2.gz QZGUYRPBGJAQJE-VMPITWQZSA-N 1 2 315.442 4.261 20 0 DIADLO Cc1c(Cl)cccc1C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000494219380 339943916 /nfs/dbraw/zinc/94/39/16/339943916.db2.gz JCBTYXFOGMVSQV-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Fc1cncc(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)c1 ZINC000494560462 339953554 /nfs/dbraw/zinc/95/35/54/339953554.db2.gz AYVRIRUEGKUWEC-UHFFFAOYSA-N 1 2 322.387 4.033 20 0 DIADLO C[C@H]1CCCC[C@H]1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000494697323 339957935 /nfs/dbraw/zinc/95/79/35/339957935.db2.gz PAFITDSOHPCPIO-KBXCAEBGSA-N 1 2 310.397 4.182 20 0 DIADLO C[C@@H]1CCC[C@@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)[C@H]1C ZINC000494699020 339957964 /nfs/dbraw/zinc/95/79/64/339957964.db2.gz YIDOYPFLGUJGEX-ZRGWGRIASA-N 1 2 324.424 4.428 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCC(=O)N[C@H](C)CCC(C)(C)C ZINC000498641679 340021407 /nfs/dbraw/zinc/02/14/07/340021407.db2.gz YNEWGGMZTQIGEO-CQSZACIVSA-N 1 2 315.461 4.066 20 0 DIADLO CCCN(c1cc[nH+]c(C2CC2)n1)[C@@H](C)c1ccccc1OC ZINC000498982953 340027366 /nfs/dbraw/zinc/02/73/66/340027366.db2.gz POAXJOPZFABPPM-AWEZNQCLSA-N 1 2 311.429 4.340 20 0 DIADLO O=C(CCC1CCCC1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000499045048 340028236 /nfs/dbraw/zinc/02/82/36/340028236.db2.gz KOSUPXRZUWDHTH-UHFFFAOYSA-N 1 2 317.820 4.435 20 0 DIADLO CCC[C@@]1(C(F)(F)F)CCCN1Cc1cn2ccccc2[nH+]1 ZINC000499066257 340029081 /nfs/dbraw/zinc/02/90/81/340029081.db2.gz XMVGXQLTWFDFKL-HNNXBMFYSA-N 1 2 311.351 4.031 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@@H+]1CCOC2(CCC2)C1 ZINC000499240018 340033028 /nfs/dbraw/zinc/03/30/28/340033028.db2.gz AYUGVWITOWBVLU-LLVKDONJSA-N 1 2 300.229 4.309 20 0 DIADLO C[C@H](c1cc(Cl)ccc1Cl)[N@H+]1CCOC2(CCC2)C1 ZINC000499240018 340033029 /nfs/dbraw/zinc/03/30/29/340033029.db2.gz AYUGVWITOWBVLU-LLVKDONJSA-N 1 2 300.229 4.309 20 0 DIADLO COc1cc[nH+]cc1NC(=O)c1sccc1-c1ccc(C)cc1 ZINC000499816448 340045145 /nfs/dbraw/zinc/04/51/45/340045145.db2.gz CYTULHSVWHYKRG-UHFFFAOYSA-N 1 2 324.405 4.379 20 0 DIADLO CCC[C@H](C)CC(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1 ZINC000500005350 340048524 /nfs/dbraw/zinc/04/85/24/340048524.db2.gz JJFKICHPIRNCAY-AWEZNQCLSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1cc(C[NH+]2CCC(F)(c3ccc(Cl)cc3)CC2)no1 ZINC000500141886 340051250 /nfs/dbraw/zinc/05/12/50/340051250.db2.gz VBVOKFSRVTZYDC-UHFFFAOYSA-N 1 2 308.784 4.097 20 0 DIADLO C[C@@H](c1ccsc1)[NH+]1CCN(C(=O)C(C)(C)C(C)(C)C)CC1 ZINC000500200615 340052828 /nfs/dbraw/zinc/05/28/28/340052828.db2.gz DUKBOLJHZXCNKT-AWEZNQCLSA-N 1 2 322.518 4.026 20 0 DIADLO CCc1cc(OC)ccc1CNc1cccc(-n2cc[nH+]c2)c1 ZINC000500400585 340056906 /nfs/dbraw/zinc/05/69/06/340056906.db2.gz UHZDXPYGKNOZNT-UHFFFAOYSA-N 1 2 307.397 4.055 20 0 DIADLO CCc1nc(C[NH2+][C@@]2(c3ccc(Cl)cc3)C[C@@H]2C)cs1 ZINC000500417585 340057342 /nfs/dbraw/zinc/05/73/42/340057342.db2.gz TZEZEKZHJLHVBS-ZBEGNZNMSA-N 1 2 306.862 4.384 20 0 DIADLO CCC(CC)(CC)CNC(=O)CCn1c(C)[nH+]c2ccccc21 ZINC000500867137 340068797 /nfs/dbraw/zinc/06/87/97/340068797.db2.gz ISZQMGGBCDEZGC-UHFFFAOYSA-N 1 2 315.461 4.067 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)Cc1ccccc1F ZINC000501357703 340079061 /nfs/dbraw/zinc/07/90/61/340079061.db2.gz IAWHRJNWUUUICD-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)Cc1ccccc1F ZINC000501357703 340079062 /nfs/dbraw/zinc/07/90/62/340079062.db2.gz IAWHRJNWUUUICD-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO CC(C)c1nc(C[N@H+](C)CCOc2cccc(Cl)c2)cs1 ZINC000501524064 340082630 /nfs/dbraw/zinc/08/26/30/340082630.db2.gz WHCMUHMGMJRQPF-UHFFFAOYSA-N 1 2 324.877 4.431 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)CCOc2cccc(Cl)c2)cs1 ZINC000501524064 340082631 /nfs/dbraw/zinc/08/26/31/340082631.db2.gz WHCMUHMGMJRQPF-UHFFFAOYSA-N 1 2 324.877 4.431 20 0 DIADLO Cn1c2ccccc2[nH+]c1CCSc1ccc(N)cc1Cl ZINC000502121921 340095628 /nfs/dbraw/zinc/09/56/28/340095628.db2.gz IBNCLFIHTDSDBS-UHFFFAOYSA-N 1 2 317.845 4.144 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nc(C2CCCC2)no1)c1ccc(F)cc1 ZINC000502536325 340107220 /nfs/dbraw/zinc/10/72/20/340107220.db2.gz UVFWPESHBMEBRP-QGZVFWFLSA-N 1 2 317.408 4.353 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](c2ccc(F)cc2)C(C)C)no1 ZINC000502546156 340107285 /nfs/dbraw/zinc/10/72/85/340107285.db2.gz ZEPXNGYKAXJGHB-KRWDZBQOSA-N 1 2 305.397 4.038 20 0 DIADLO CCCCc1nc(C[NH2+][C@@]2(c3cccc(C)c3)C[C@H]2CC)no1 ZINC000502552497 340107582 /nfs/dbraw/zinc/10/75/82/340107582.db2.gz QGEOPMROGPMNRW-BEFAXECRSA-N 1 2 313.445 4.136 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000502573648 340108180 /nfs/dbraw/zinc/10/81/80/340108180.db2.gz UHRKDHCHAASKTF-KSSFIOAISA-N 1 2 301.817 4.475 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000502573648 340108181 /nfs/dbraw/zinc/10/81/81/340108181.db2.gz UHRKDHCHAASKTF-KSSFIOAISA-N 1 2 301.817 4.475 20 0 DIADLO C[C@@H]([NH2+]C1(C(F)F)CC1)c1ccc(Br)c(F)c1 ZINC000503858192 340135290 /nfs/dbraw/zinc/13/52/90/340135290.db2.gz RBTYAWRAWZQUQA-SSDOTTSWSA-N 1 2 308.141 4.037 20 0 DIADLO Cc1cccc2cc(C(=O)Nc3ccc(-c4[nH]cc[nH+]4)cc3)oc21 ZINC000502753827 340113001 /nfs/dbraw/zinc/11/30/01/340113001.db2.gz RLJSVLDCSCBHHN-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO Cc1cc(F)cc([C@@]2(F)CC[N@H+](C/C=C/c3ccncc3)C2)c1 ZINC000503030265 340119179 /nfs/dbraw/zinc/11/91/79/340119179.db2.gz GMKBPGWGWJSEEZ-LSTKMXGYSA-N 1 2 314.379 4.113 20 0 DIADLO Cc1cc(F)cc([C@@]2(F)CC[N@@H+](C/C=C/c3ccncc3)C2)c1 ZINC000503030265 340119180 /nfs/dbraw/zinc/11/91/80/340119180.db2.gz GMKBPGWGWJSEEZ-LSTKMXGYSA-N 1 2 314.379 4.113 20 0 DIADLO COc1ccc(C2([NH2+]Cc3cc(-c4ccccc4)on3)CC2)cc1 ZINC000503166478 340122449 /nfs/dbraw/zinc/12/24/49/340122449.db2.gz KEYWLMRHFXYQJF-UHFFFAOYSA-N 1 2 320.392 4.129 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1cc(-c2ccccc2)on1 ZINC000503202656 340123196 /nfs/dbraw/zinc/12/31/96/340123196.db2.gz YIJILJBODSTMOD-CQSZACIVSA-N 1 2 308.381 4.240 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1cc(-c2ccccc2)on1 ZINC000503202656 340123197 /nfs/dbraw/zinc/12/31/97/340123197.db2.gz YIJILJBODSTMOD-CQSZACIVSA-N 1 2 308.381 4.240 20 0 DIADLO CCCCc1noc(C[NH2+][C@@]2(c3ccc(Cl)cc3)C[C@H]2C)n1 ZINC000503390154 340127133 /nfs/dbraw/zinc/12/71/33/340127133.db2.gz JCRAPXXERKALRM-PXAZEXFGSA-N 1 2 319.836 4.091 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ncnn1C(C)(C)C)c1ccccc1Cl ZINC000503899402 340136093 /nfs/dbraw/zinc/13/60/93/340136093.db2.gz BFPHQQBECYTFPM-MRXNPFEDSA-N 1 2 320.868 4.173 20 0 DIADLO C[C@@H]([NH2+]C1(C(F)F)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000503903931 340136244 /nfs/dbraw/zinc/13/62/44/340136244.db2.gz RMPZNTSBTMBUGD-SECBINFHSA-N 1 2 309.278 4.076 20 0 DIADLO CCN(Cc1ccc2ccccc2c1)C(=O)Nc1cc[nH+]c(C)c1 ZINC000504156752 340141904 /nfs/dbraw/zinc/14/19/04/340141904.db2.gz MQEGFRDSJJWVJG-UHFFFAOYSA-N 1 2 319.408 4.019 20 0 DIADLO Cc1cc(NC(=O)N[C@@H](C)c2ccc(Cl)c(Cl)c2)cc[nH+]1 ZINC000504157534 340142103 /nfs/dbraw/zinc/14/21/03/340142103.db2.gz RKDBGIIRWSYNHV-JTQLQIEISA-N 1 2 324.211 4.001 20 0 DIADLO Cc1cc(C(=O)Nc2ccc3[nH+]c(N(C)C)ccc3c2)ccc1F ZINC000504304087 340144715 /nfs/dbraw/zinc/14/47/15/340144715.db2.gz LYOWPAWYYRGNGS-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO Cc1ccc2oc(SCc3cn4c(cccc4C)[nH+]3)nc2c1 ZINC000504550099 340149164 /nfs/dbraw/zinc/14/91/64/340149164.db2.gz YKMPKQBFRVFXJH-UHFFFAOYSA-N 1 2 309.394 4.385 20 0 DIADLO CC(C)CC(CC(C)C)NC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000504558635 340149254 /nfs/dbraw/zinc/14/92/54/340149254.db2.gz HTTVRTHABIJMQD-UHFFFAOYSA-N 1 2 313.445 4.063 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1csc(-c2ccc(C)cc2)n1 ZINC000505596726 340172148 /nfs/dbraw/zinc/17/21/48/340172148.db2.gz NFQBNQRIXZVDGX-PBHICJAKSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1csc(-c2ccc(C)cc2)n1 ZINC000505596726 340172149 /nfs/dbraw/zinc/17/21/49/340172149.db2.gz NFQBNQRIXZVDGX-PBHICJAKSA-N 1 2 316.470 4.118 20 0 DIADLO CCCn1c2ccccc2nc1C[N@H+](C)Cc1ccccc1F ZINC000505615314 340173100 /nfs/dbraw/zinc/17/31/00/340173100.db2.gz SUVWNAVSDLEERS-UHFFFAOYSA-N 1 2 311.404 4.217 20 0 DIADLO CCCn1c2ccccc2nc1C[N@@H+](C)Cc1ccccc1F ZINC000505615314 340173101 /nfs/dbraw/zinc/17/31/01/340173101.db2.gz SUVWNAVSDLEERS-UHFFFAOYSA-N 1 2 311.404 4.217 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+](C)Cc3ccccc3F)s2)o1 ZINC000505640902 340174162 /nfs/dbraw/zinc/17/41/62/340174162.db2.gz TUQLBMHEYQKUSD-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+](C)Cc3ccccc3F)s2)o1 ZINC000505640902 340174163 /nfs/dbraw/zinc/17/41/63/340174163.db2.gz TUQLBMHEYQKUSD-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccccc1OCC(F)(F)F ZINC000505659800 340174482 /nfs/dbraw/zinc/17/44/82/340174482.db2.gz KISBUROTHQLKKS-CYBMUJFWSA-N 1 2 324.346 4.006 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccccc1OCC(F)(F)F ZINC000505659800 340174483 /nfs/dbraw/zinc/17/44/83/340174483.db2.gz KISBUROTHQLKKS-CYBMUJFWSA-N 1 2 324.346 4.006 20 0 DIADLO Cc1sc2ncnc(NCCCc3cccc(C)[nH+]3)c2c1C ZINC000505761198 340176887 /nfs/dbraw/zinc/17/68/87/340176887.db2.gz DSLPDUCNJOKOHX-UHFFFAOYSA-N 1 2 312.442 4.056 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@H]2/C=C\c2ccccc2)no1 ZINC000505885468 340180739 /nfs/dbraw/zinc/18/07/39/340180739.db2.gz RNSYASQHAYPAGZ-QOHRORDFSA-N 1 2 311.429 4.090 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@H]2/C=C\c2ccccc2)no1 ZINC000505885468 340180740 /nfs/dbraw/zinc/18/07/40/340180740.db2.gz RNSYASQHAYPAGZ-QOHRORDFSA-N 1 2 311.429 4.090 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)no1 ZINC000505885469 340180804 /nfs/dbraw/zinc/18/08/04/340180804.db2.gz RNSYASQHAYPAGZ-UJGDBWEASA-N 1 2 311.429 4.090 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)no1 ZINC000505885469 340180805 /nfs/dbraw/zinc/18/08/05/340180805.db2.gz RNSYASQHAYPAGZ-UJGDBWEASA-N 1 2 311.429 4.090 20 0 DIADLO C[N@H+](CCOc1ccccc1F)Cc1csc(C(C)(C)C)n1 ZINC000506141327 340186582 /nfs/dbraw/zinc/18/65/82/340186582.db2.gz ULXNRWQGGJKSAD-UHFFFAOYSA-N 1 2 322.449 4.091 20 0 DIADLO C[N@@H+](CCOc1ccccc1F)Cc1csc(C(C)(C)C)n1 ZINC000506141327 340186583 /nfs/dbraw/zinc/18/65/83/340186583.db2.gz ULXNRWQGGJKSAD-UHFFFAOYSA-N 1 2 322.449 4.091 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC000506202021 340188430 /nfs/dbraw/zinc/18/84/30/340188430.db2.gz GXTNGVNAHDKOBE-UHFFFAOYSA-N 1 2 321.424 4.107 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC000506202021 340188431 /nfs/dbraw/zinc/18/84/31/340188431.db2.gz GXTNGVNAHDKOBE-UHFFFAOYSA-N 1 2 321.424 4.107 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1c[nH]c(-c2ccccc2)n1 ZINC000506202021 340188432 /nfs/dbraw/zinc/18/84/32/340188432.db2.gz GXTNGVNAHDKOBE-UHFFFAOYSA-N 1 2 321.424 4.107 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1c[nH]c(-c2ccccc2)n1 ZINC000506202021 340188433 /nfs/dbraw/zinc/18/84/33/340188433.db2.gz GXTNGVNAHDKOBE-UHFFFAOYSA-N 1 2 321.424 4.107 20 0 DIADLO C[N@H+](Cc1cnc(C(C)(C)C)s1)Cc1ccc(F)c(F)c1 ZINC000506221814 340189028 /nfs/dbraw/zinc/18/90/28/340189028.db2.gz WBFJROJFCIJJOI-UHFFFAOYSA-N 1 2 310.413 4.351 20 0 DIADLO C[N@@H+](Cc1cnc(C(C)(C)C)s1)Cc1ccc(F)c(F)c1 ZINC000506221814 340189029 /nfs/dbraw/zinc/18/90/29/340189029.db2.gz WBFJROJFCIJJOI-UHFFFAOYSA-N 1 2 310.413 4.351 20 0 DIADLO FC(F)(F)c1ccccc1C[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000506385328 340193827 /nfs/dbraw/zinc/19/38/27/340193827.db2.gz KMQFZXJUYXDAFZ-KRWDZBQOSA-N 1 2 321.342 4.279 20 0 DIADLO FC(F)(F)c1ccccc1C[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000506385328 340193828 /nfs/dbraw/zinc/19/38/28/340193828.db2.gz KMQFZXJUYXDAFZ-KRWDZBQOSA-N 1 2 321.342 4.279 20 0 DIADLO CC(C)(C)c1n[nH]cc1C[N@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000506601264 340197449 /nfs/dbraw/zinc/19/74/49/340197449.db2.gz PQNBCQWJLVLZHI-UHFFFAOYSA-N 1 2 319.399 4.150 20 0 DIADLO CC(C)(C)c1n[nH]cc1C[N@@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000506601264 340197450 /nfs/dbraw/zinc/19/74/50/340197450.db2.gz PQNBCQWJLVLZHI-UHFFFAOYSA-N 1 2 319.399 4.150 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1cnc2ccc(Cl)cn12 ZINC000506737282 340200440 /nfs/dbraw/zinc/20/04/40/340200440.db2.gz WSHGUJYMBVCYEW-LLVKDONJSA-N 1 2 317.845 4.169 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1cnc2ccc(Cl)cn12 ZINC000506737282 340200441 /nfs/dbraw/zinc/20/04/41/340200441.db2.gz WSHGUJYMBVCYEW-LLVKDONJSA-N 1 2 317.845 4.169 20 0 DIADLO C[C@@H]1c2ccsc2CCN1Cc1c[nH+]c2ccc(Cl)cn12 ZINC000506737282 340200442 /nfs/dbraw/zinc/20/04/42/340200442.db2.gz WSHGUJYMBVCYEW-LLVKDONJSA-N 1 2 317.845 4.169 20 0 DIADLO CCCCN(C)C(=O)Nc1c[nH+]c(N2CCCC[C@H]2C)c(C)c1 ZINC000506981565 340204666 /nfs/dbraw/zinc/20/46/66/340204666.db2.gz CRUHFKCLILZGKD-OAHLLOKOSA-N 1 2 318.465 4.033 20 0 DIADLO Cc1ncsc1CCSCc1ccc(-n2cc[nH+]c2)cc1 ZINC000507102097 340207440 /nfs/dbraw/zinc/20/74/40/340207440.db2.gz HWKSGOLSRGSMMX-UHFFFAOYSA-N 1 2 315.467 4.113 20 0 DIADLO Cc1c(C[N@@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cnn1C ZINC000507131672 340208692 /nfs/dbraw/zinc/20/86/92/340208692.db2.gz KCQKHEKKIFDGJP-INIZCTEOSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1c(C[N@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cnn1C ZINC000507131672 340208693 /nfs/dbraw/zinc/20/86/93/340208693.db2.gz KCQKHEKKIFDGJP-INIZCTEOSA-N 1 2 324.255 4.372 20 0 DIADLO CCn1cc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)cn1 ZINC000507191896 340212379 /nfs/dbraw/zinc/21/23/79/340212379.db2.gz QEGURJJHFLRHLU-UHFFFAOYSA-N 1 2 309.413 4.007 20 0 DIADLO CCn1cc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)cn1 ZINC000507191896 340212380 /nfs/dbraw/zinc/21/23/80/340212380.db2.gz QEGURJJHFLRHLU-UHFFFAOYSA-N 1 2 309.413 4.007 20 0 DIADLO CCCn1cc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)cn1 ZINC000507196094 340212525 /nfs/dbraw/zinc/21/25/25/340212525.db2.gz WUXNPJJIPHZMNY-UHFFFAOYSA-N 1 2 323.440 4.397 20 0 DIADLO CCCn1cc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)cn1 ZINC000507196094 340212526 /nfs/dbraw/zinc/21/25/26/340212526.db2.gz WUXNPJJIPHZMNY-UHFFFAOYSA-N 1 2 323.440 4.397 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1ccc(F)cc1Br ZINC000507208823 340213585 /nfs/dbraw/zinc/21/35/85/340213585.db2.gz GEMUVDSDLLAQNP-JTQLQIEISA-N 1 2 312.182 4.374 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccc(F)cc1Br ZINC000507208823 340213586 /nfs/dbraw/zinc/21/35/86/340213586.db2.gz GEMUVDSDLLAQNP-JTQLQIEISA-N 1 2 312.182 4.374 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1nc2ccccc2n1C ZINC000507222874 340214311 /nfs/dbraw/zinc/21/43/11/340214311.db2.gz XEWCLZNCFVVCOB-CYBMUJFWSA-N 1 2 313.832 4.420 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1nc2ccccc2n1C ZINC000507222874 340214312 /nfs/dbraw/zinc/21/43/12/340214312.db2.gz XEWCLZNCFVVCOB-CYBMUJFWSA-N 1 2 313.832 4.420 20 0 DIADLO Cc1c(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)cnn1C ZINC000507227252 340214771 /nfs/dbraw/zinc/21/47/71/340214771.db2.gz DVUQIJXIVLDNDV-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO Cc1c(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)cnn1C ZINC000507227252 340214772 /nfs/dbraw/zinc/21/47/72/340214772.db2.gz DVUQIJXIVLDNDV-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO COCc1nc(C[N@H+](C)[C@H](C)c2ccc(C)cc2C)cs1 ZINC000507243116 340215150 /nfs/dbraw/zinc/21/51/50/340215150.db2.gz KCYDISFGHUKRIQ-CQSZACIVSA-N 1 2 304.459 4.099 20 0 DIADLO COCc1nc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2C)cs1 ZINC000507243116 340215151 /nfs/dbraw/zinc/21/51/51/340215151.db2.gz KCYDISFGHUKRIQ-CQSZACIVSA-N 1 2 304.459 4.099 20 0 DIADLO COc1ccc(OC)c(C[N@H+](Cc2ccc(Cl)o2)C2CC2)c1 ZINC000507243036 340215228 /nfs/dbraw/zinc/21/52/28/340215228.db2.gz JEHJKORVKHYAFB-UHFFFAOYSA-N 1 2 321.804 4.115 20 0 DIADLO COc1ccc(OC)c(C[N@@H+](Cc2ccc(Cl)o2)C2CC2)c1 ZINC000507243036 340215229 /nfs/dbraw/zinc/21/52/29/340215229.db2.gz JEHJKORVKHYAFB-UHFFFAOYSA-N 1 2 321.804 4.115 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+](C)Cc1ccc2c[nH]nc2c1 ZINC000507243171 340215260 /nfs/dbraw/zinc/21/52/60/340215260.db2.gz KKIWHEULHCXZGY-LLVKDONJSA-N 1 2 301.340 4.034 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccc2c[nH]nc2c1 ZINC000507243171 340215261 /nfs/dbraw/zinc/21/52/61/340215261.db2.gz KKIWHEULHCXZGY-LLVKDONJSA-N 1 2 301.340 4.034 20 0 DIADLO CC(=O)Nc1ccc(C[N@@H+](C)[C@H](C)c2c(F)cccc2F)cc1 ZINC000507252339 340215612 /nfs/dbraw/zinc/21/56/12/340215612.db2.gz MRVMXPUNUHUQTI-GFCCVEGCSA-N 1 2 318.367 4.116 20 0 DIADLO CC(=O)Nc1ccc(C[N@H+](C)[C@H](C)c2c(F)cccc2F)cc1 ZINC000507252339 340215613 /nfs/dbraw/zinc/21/56/13/340215613.db2.gz MRVMXPUNUHUQTI-GFCCVEGCSA-N 1 2 318.367 4.116 20 0 DIADLO Cc1ccn2c(CN(C)[C@@H](C)c3c(F)cccc3F)c[nH+]c2c1 ZINC000507252774 340215712 /nfs/dbraw/zinc/21/57/12/340215712.db2.gz NZWYZLZZWHZTRH-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO CCc1ncc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)s1 ZINC000507342174 340217655 /nfs/dbraw/zinc/21/76/55/340217655.db2.gz RDXPGOWHICTTCI-IBGZPJMESA-N 1 2 323.465 4.112 20 0 DIADLO CCc1ncc(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)s1 ZINC000507342174 340217656 /nfs/dbraw/zinc/21/76/56/340217656.db2.gz RDXPGOWHICTTCI-IBGZPJMESA-N 1 2 323.465 4.112 20 0 DIADLO CC[C@H](C)CCC(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1 ZINC000507467578 340221001 /nfs/dbraw/zinc/22/10/01/340221001.db2.gz XGQGOXFZIGUUDV-ZDUSSCGKSA-N 1 2 323.506 4.140 20 0 DIADLO COCC[N@H+](Cc1ccco1)Cc1cccc(Cl)c1Cl ZINC000507748274 340230319 /nfs/dbraw/zinc/23/03/19/340230319.db2.gz OHBQGCXWSRXOKR-UHFFFAOYSA-N 1 2 314.212 4.235 20 0 DIADLO COCC[N@@H+](Cc1ccco1)Cc1cccc(Cl)c1Cl ZINC000507748274 340230320 /nfs/dbraw/zinc/23/03/20/340230320.db2.gz OHBQGCXWSRXOKR-UHFFFAOYSA-N 1 2 314.212 4.235 20 0 DIADLO Cc1ccc(N[C@H](c2[nH+]ccn2C)c2cccc(F)c2)c(F)c1 ZINC000507813617 340232828 /nfs/dbraw/zinc/23/28/28/340232828.db2.gz JZTNYVJUMBNGRP-KRWDZBQOSA-N 1 2 313.351 4.208 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1cccc(O)c1Cl ZINC000508171144 340240053 /nfs/dbraw/zinc/24/00/53/340240053.db2.gz CZSVIZISECDXDT-GUYCJALGSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1cccc(O)c1Cl ZINC000508171144 340240054 /nfs/dbraw/zinc/24/00/54/340240054.db2.gz CZSVIZISECDXDT-GUYCJALGSA-N 1 2 317.816 4.008 20 0 DIADLO CCOc1ccc(C2=CCN(c3cc[nH+]c(C(C)C)n3)CC2)cc1 ZINC000508354832 340242826 /nfs/dbraw/zinc/24/28/26/340242826.db2.gz MDXYKRVPXWAWMT-UHFFFAOYSA-N 1 2 323.440 4.292 20 0 DIADLO CC(C)(C)c1ncc(CNc2[nH]c3cccc(Cl)c3[nH+]2)s1 ZINC000508501820 340244933 /nfs/dbraw/zinc/24/49/33/340244933.db2.gz GBOWENFUKCSBEZ-UHFFFAOYSA-N 1 2 320.849 4.004 20 0 DIADLO CC(C)(C)c1cnc(CNc2[nH]c3cccc(Cl)c3[nH+]2)s1 ZINC000508515698 340245374 /nfs/dbraw/zinc/24/53/74/340245374.db2.gz FGWRMVFQKBNLCY-UHFFFAOYSA-N 1 2 320.849 4.004 20 0 DIADLO Cc1cccn2cc(CSCCCCC3CCOCC3)[nH+]c12 ZINC000508571479 340246816 /nfs/dbraw/zinc/24/68/16/340246816.db2.gz SKNBLMZAMZDUMA-UHFFFAOYSA-N 1 2 318.486 4.473 20 0 DIADLO CCC[N@H+](Cc1c(C)nn(C)c1C)Cc1c(F)cccc1Cl ZINC000508618131 340248370 /nfs/dbraw/zinc/24/83/70/340248370.db2.gz IZXATIQIJVRVPC-UHFFFAOYSA-N 1 2 323.843 4.242 20 0 DIADLO CCC[N@@H+](Cc1c(C)nn(C)c1C)Cc1c(F)cccc1Cl ZINC000508618131 340248371 /nfs/dbraw/zinc/24/83/71/340248371.db2.gz IZXATIQIJVRVPC-UHFFFAOYSA-N 1 2 323.843 4.242 20 0 DIADLO CCC[N@H+](Cc1ccnn1CC)Cc1c(F)cccc1Cl ZINC000508618420 340248389 /nfs/dbraw/zinc/24/83/89/340248389.db2.gz JDMZYRKMGMTNPU-UHFFFAOYSA-N 1 2 309.816 4.108 20 0 DIADLO CCC[N@@H+](Cc1ccnn1CC)Cc1c(F)cccc1Cl ZINC000508618420 340248390 /nfs/dbraw/zinc/24/83/90/340248390.db2.gz JDMZYRKMGMTNPU-UHFFFAOYSA-N 1 2 309.816 4.108 20 0 DIADLO CCC[N@H+](Cc1ccccn1)Cc1ccccc1Br ZINC000508643212 340249259 /nfs/dbraw/zinc/24/92/59/340249259.db2.gz FHOJYDVRDFAAOL-UHFFFAOYSA-N 1 2 319.246 4.256 20 0 DIADLO CCC[N@@H+](Cc1ccccn1)Cc1ccccc1Br ZINC000508643212 340249260 /nfs/dbraw/zinc/24/92/60/340249260.db2.gz FHOJYDVRDFAAOL-UHFFFAOYSA-N 1 2 319.246 4.256 20 0 DIADLO CCCC[N@H+](Cc1csc(COC)n1)Cc1ccccc1F ZINC000508685759 340250537 /nfs/dbraw/zinc/25/05/37/340250537.db2.gz IUDKIWAHQGHTQX-UHFFFAOYSA-N 1 2 322.449 4.231 20 0 DIADLO CCCC[N@@H+](Cc1csc(COC)n1)Cc1ccccc1F ZINC000508685759 340250538 /nfs/dbraw/zinc/25/05/38/340250538.db2.gz IUDKIWAHQGHTQX-UHFFFAOYSA-N 1 2 322.449 4.231 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3cc[nH]c3CC)cc2[nH+]1 ZINC000508704783 340251071 /nfs/dbraw/zinc/25/10/71/340251071.db2.gz XINSOVGQMANIQY-UHFFFAOYSA-N 1 2 310.401 4.048 20 0 DIADLO CCOc1ccc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000508795288 340253250 /nfs/dbraw/zinc/25/32/50/340253250.db2.gz ZLUTXPSSRULWMA-UHFFFAOYSA-N 1 2 321.424 4.011 20 0 DIADLO CCOc1ccc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000508795288 340253251 /nfs/dbraw/zinc/25/32/51/340253251.db2.gz ZLUTXPSSRULWMA-UHFFFAOYSA-N 1 2 321.424 4.011 20 0 DIADLO C[N@H+](CCOc1ccccc1F)Cc1c(F)cccc1Cl ZINC000301579709 340255895 /nfs/dbraw/zinc/25/58/95/340255895.db2.gz IHGHQSZQXYMZSA-UHFFFAOYSA-N 1 2 311.759 4.129 20 0 DIADLO C[N@@H+](CCOc1ccccc1F)Cc1c(F)cccc1Cl ZINC000301579709 340255896 /nfs/dbraw/zinc/25/58/96/340255896.db2.gz IHGHQSZQXYMZSA-UHFFFAOYSA-N 1 2 311.759 4.129 20 0 DIADLO CCC[C@H]1C[N@H+](Cc2nc(-c3ccc(C)cc3)cs2)CCO1 ZINC000509023440 340258674 /nfs/dbraw/zinc/25/86/74/340258674.db2.gz QJHSEUPCUBYGLE-INIZCTEOSA-N 1 2 316.470 4.119 20 0 DIADLO CCC[C@H]1C[N@@H+](Cc2nc(-c3ccc(C)cc3)cs2)CCO1 ZINC000509023440 340258675 /nfs/dbraw/zinc/25/86/75/340258675.db2.gz QJHSEUPCUBYGLE-INIZCTEOSA-N 1 2 316.470 4.119 20 0 DIADLO O=C(c1ccccc1Oc1cc[nH+]cc1)N1CCc2ccccc21 ZINC000509030651 340258725 /nfs/dbraw/zinc/25/87/25/340258725.db2.gz CFSCVGROXSDISJ-UHFFFAOYSA-N 1 2 316.360 4.077 20 0 DIADLO Cc1cc([NH+]2CCCC2)ccc1NCc1c(F)ccc(O)c1F ZINC000509124852 340261835 /nfs/dbraw/zinc/26/18/35/340261835.db2.gz JOHIRJQTCQHNSI-UHFFFAOYSA-N 1 2 318.367 4.191 20 0 DIADLO Cc1cscc1NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509166189 340262812 /nfs/dbraw/zinc/26/28/12/340262812.db2.gz SDVQVJGBUFILKK-UHFFFAOYSA-N 1 2 310.378 4.496 20 0 DIADLO C[C@@H]1CC[C@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)C[C@@H]1C ZINC000509305141 340265773 /nfs/dbraw/zinc/26/57/73/340265773.db2.gz SQEHPACBTYSYRG-PMPSAXMXSA-N 1 2 324.424 4.428 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1nc(-c2ccc(C)cc2)cs1 ZINC000509310737 340265905 /nfs/dbraw/zinc/26/59/05/340265905.db2.gz QIQHWMVFWBBUGL-GDBMZVCRSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1nc(-c2ccc(C)cc2)cs1 ZINC000509310737 340265906 /nfs/dbraw/zinc/26/59/06/340265906.db2.gz QIQHWMVFWBBUGL-GDBMZVCRSA-N 1 2 316.470 4.118 20 0 DIADLO C[C@H]1CCCCCN1C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509334299 340266559 /nfs/dbraw/zinc/26/65/59/340266559.db2.gz ZMVTXQQHGFKXHO-HNNXBMFYSA-N 1 2 310.397 4.279 20 0 DIADLO C[C@@H]1CC[C@@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)[C@@H](C)C1 ZINC000509430034 340269326 /nfs/dbraw/zinc/26/93/26/340269326.db2.gz NQMYDBPVTNCPRT-RVKKMQEKSA-N 1 2 324.424 4.428 20 0 DIADLO C[C@H]1c2cccc(Br)c2CC[N@H+]1CCC(F)(F)F ZINC000509437851 340269488 /nfs/dbraw/zinc/26/94/88/340269488.db2.gz QLTZTRWRIKCPSM-VIFPVBQESA-N 1 2 322.168 4.321 20 0 DIADLO C[C@H]1c2cccc(Br)c2CC[N@@H+]1CCC(F)(F)F ZINC000509437851 340269489 /nfs/dbraw/zinc/26/94/89/340269489.db2.gz QLTZTRWRIKCPSM-VIFPVBQESA-N 1 2 322.168 4.321 20 0 DIADLO COc1cc(C[N@@H+]2CCc3cc(F)ccc3C2)ccc1SC ZINC000509450754 340269975 /nfs/dbraw/zinc/26/99/75/340269975.db2.gz OYROARMOVYLEAR-UHFFFAOYSA-N 1 2 317.429 4.115 20 0 DIADLO COc1cc(C[N@H+]2CCc3cc(F)ccc3C2)ccc1SC ZINC000509450754 340269976 /nfs/dbraw/zinc/26/99/76/340269976.db2.gz OYROARMOVYLEAR-UHFFFAOYSA-N 1 2 317.429 4.115 20 0 DIADLO Cc1ccc([C@H]2OCCC[C@@H]2Nc2[nH+]c3ccccc3n2C)cc1 ZINC000509555130 340273396 /nfs/dbraw/zinc/27/33/96/340273396.db2.gz SULUDPLKTBRXJM-PKOBYXMFSA-N 1 2 321.424 4.214 20 0 DIADLO Cc1nc2ccccc2nc1C[N@H+](C)Cc1ccccc1Cl ZINC000302737786 340280363 /nfs/dbraw/zinc/28/03/63/340280363.db2.gz GQVXKZAUJDUKRE-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO Cc1nc2ccccc2nc1C[N@@H+](C)Cc1ccccc1Cl ZINC000302737786 340280364 /nfs/dbraw/zinc/28/03/64/340280364.db2.gz GQVXKZAUJDUKRE-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Oc2ccccc2)o1)c1ccncc1F ZINC000509988444 340284798 /nfs/dbraw/zinc/28/47/98/340284798.db2.gz FNMLJNXPHGVXEE-CYBMUJFWSA-N 1 2 312.344 4.457 20 0 DIADLO O=C(c1ccccc1Oc1cc[nH+]cc1)N1CCC[C@H]2CCC[C@H]21 ZINC000509993381 340284839 /nfs/dbraw/zinc/28/48/39/340284839.db2.gz FSZOMXIFAMOQPQ-CRAIPNDOSA-N 1 2 322.408 4.279 20 0 DIADLO Oc1ccc(F)c(C[NH2+]Cc2ccc(-c3ccccc3)o2)c1F ZINC000510027715 340285677 /nfs/dbraw/zinc/28/56/77/340285677.db2.gz FLLLELQBBZXLAK-UHFFFAOYSA-N 1 2 315.319 4.220 20 0 DIADLO CC(C)CCC[C@@H](C)NC(=O)C[N@H+](C)[C@@H](C)c1ccccc1F ZINC000510080825 340288003 /nfs/dbraw/zinc/28/80/03/340288003.db2.gz BFVAARSENBIZEE-CVEARBPZSA-N 1 2 322.468 4.150 20 0 DIADLO CC(C)CCC[C@@H](C)NC(=O)C[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000510080825 340288004 /nfs/dbraw/zinc/28/80/04/340288004.db2.gz BFVAARSENBIZEE-CVEARBPZSA-N 1 2 322.468 4.150 20 0 DIADLO C[C@@H](CC1CCCC1)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000510087316 340288189 /nfs/dbraw/zinc/28/81/89/340288189.db2.gz GPVGTAAZUJDUJT-ZDUSSCGKSA-N 1 2 315.392 4.166 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NC(=O)C2(C)CCCCCC2)c1 ZINC000510295310 340295280 /nfs/dbraw/zinc/29/52/80/340295280.db2.gz IRUFBKOSFIMIIS-UHFFFAOYSA-N 1 2 311.429 4.386 20 0 DIADLO C[N@H+](Cc1nc2ccccc2[nH]1)Cc1cccc(C(F)(F)F)c1 ZINC000510396070 340297860 /nfs/dbraw/zinc/29/78/60/340297860.db2.gz NWRZTGPGSBUFQL-UHFFFAOYSA-N 1 2 319.330 4.214 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2[nH]1)Cc1cccc(C(F)(F)F)c1 ZINC000510396070 340297861 /nfs/dbraw/zinc/29/78/61/340297861.db2.gz NWRZTGPGSBUFQL-UHFFFAOYSA-N 1 2 319.330 4.214 20 0 DIADLO CCCCc1nc(CSc2[nH+]cc3ccccn32)cs1 ZINC000510649551 340305058 /nfs/dbraw/zinc/30/50/58/340305058.db2.gz RKHUXPYVHMXDAQ-UHFFFAOYSA-N 1 2 303.456 4.426 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2nccs2)c2cccc(F)c2)c1 ZINC000510734662 340308606 /nfs/dbraw/zinc/30/86/06/340308606.db2.gz MPIMHTXYNZDREL-SFHVURJKSA-N 1 2 312.413 4.470 20 0 DIADLO C[C@@H]1CC[C@H](CNC(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000510781672 340310764 /nfs/dbraw/zinc/31/07/64/340310764.db2.gz NOONOQMTDNNILN-CABCVRRESA-N 1 2 310.397 4.040 20 0 DIADLO CC[C@@]1(C)C[N@H+](Cc2nc(-c3ccc(C)cc3)cs2)CCO1 ZINC000510793442 340311168 /nfs/dbraw/zinc/31/11/68/340311168.db2.gz YBBKTLIZUIAZCY-SFHVURJKSA-N 1 2 316.470 4.119 20 0 DIADLO CC[C@@]1(C)C[N@@H+](Cc2nc(-c3ccc(C)cc3)cs2)CCO1 ZINC000510793442 340311169 /nfs/dbraw/zinc/31/11/69/340311169.db2.gz YBBKTLIZUIAZCY-SFHVURJKSA-N 1 2 316.470 4.119 20 0 DIADLO COC(=O)c1ccc(Cl)c(C[N@@H+]2CC[C@H]2c2ccccc2)c1 ZINC000511110698 340321104 /nfs/dbraw/zinc/32/11/04/340321104.db2.gz MXAYTNDPBHRDEB-KRWDZBQOSA-N 1 2 315.800 4.074 20 0 DIADLO COC(=O)c1ccc(Cl)c(C[N@H+]2CC[C@H]2c2ccccc2)c1 ZINC000511110698 340321105 /nfs/dbraw/zinc/32/11/05/340321105.db2.gz MXAYTNDPBHRDEB-KRWDZBQOSA-N 1 2 315.800 4.074 20 0 DIADLO Clc1ccc([C@H]2CC[N@@H+]2Cc2cccc3c2OCCO3)cc1 ZINC000511544594 340330242 /nfs/dbraw/zinc/33/02/42/340330242.db2.gz BZGVTPABTBTFAQ-MRXNPFEDSA-N 1 2 315.800 4.058 20 0 DIADLO Clc1ccc([C@H]2CC[N@H+]2Cc2cccc3c2OCCO3)cc1 ZINC000511544594 340330243 /nfs/dbraw/zinc/33/02/43/340330243.db2.gz BZGVTPABTBTFAQ-MRXNPFEDSA-N 1 2 315.800 4.058 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1)[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511603960 340332063 /nfs/dbraw/zinc/33/20/63/340332063.db2.gz DAQHLIVYHSWNAK-SUMWQHHRSA-N 1 2 314.816 4.114 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1)[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511603960 340332064 /nfs/dbraw/zinc/33/20/64/340332064.db2.gz DAQHLIVYHSWNAK-SUMWQHHRSA-N 1 2 314.816 4.114 20 0 DIADLO CC(C)N(C(=O)[C@@H](C)[N@@H+]1CC[C@H]1c1ccc(Cl)cc1)C(C)C ZINC000511621241 340332749 /nfs/dbraw/zinc/33/27/49/340332749.db2.gz BWWHKWMUTPEMNL-PBHICJAKSA-N 1 2 322.880 4.121 20 0 DIADLO CC(C)N(C(=O)[C@@H](C)[N@H+]1CC[C@H]1c1ccc(Cl)cc1)C(C)C ZINC000511621241 340332750 /nfs/dbraw/zinc/33/27/50/340332750.db2.gz BWWHKWMUTPEMNL-PBHICJAKSA-N 1 2 322.880 4.121 20 0 DIADLO Cc1ccc2oc(SCc3cn4cccc(C)c4[nH+]3)nc2c1 ZINC000303617261 340338109 /nfs/dbraw/zinc/33/81/09/340338109.db2.gz PEAGYNHRPHIIJQ-UHFFFAOYSA-N 1 2 309.394 4.385 20 0 DIADLO Oc1ccc(F)c(C[NH2+]Cc2cc(Cl)sc2Cl)c1F ZINC000511920402 340342860 /nfs/dbraw/zinc/34/28/60/340342860.db2.gz FKXVKYAMXPKCPT-UHFFFAOYSA-N 1 2 324.179 4.329 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccon2)sc1Br ZINC000511969135 340344001 /nfs/dbraw/zinc/34/40/01/340344001.db2.gz BHXKJMKLPQQPJW-RKDXNWHRSA-N 1 2 315.236 4.219 20 0 DIADLO Fc1ccc(/C=C/CNc2ccc(-n3cc[nH+]c3)cc2)cc1F ZINC000512083708 340348110 /nfs/dbraw/zinc/34/81/10/340348110.db2.gz LLOYHUSUXDDUQN-OWOJBTEDSA-N 1 2 311.335 4.276 20 0 DIADLO C[C@H]1CCCCC[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000512173912 340350878 /nfs/dbraw/zinc/35/08/78/340350878.db2.gz CGWSIVCRIHBXLN-NSHDSACASA-N 1 2 315.244 4.196 20 0 DIADLO C[C@H]1CCCCC[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000512173912 340350879 /nfs/dbraw/zinc/35/08/79/340350879.db2.gz CGWSIVCRIHBXLN-NSHDSACASA-N 1 2 315.244 4.196 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+]1C[C@H](C)[S@@](=O)[C@@H](CC)C1 ZINC000512426061 340361498 /nfs/dbraw/zinc/36/14/98/340361498.db2.gz DSPCLOLBPYVMKA-DKIXSGTJSA-N 1 2 313.894 4.023 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+]1C[C@H](C)[S@@](=O)[C@@H](CC)C1 ZINC000512426061 340361499 /nfs/dbraw/zinc/36/14/99/340361499.db2.gz DSPCLOLBPYVMKA-DKIXSGTJSA-N 1 2 313.894 4.023 20 0 DIADLO COc1ccc2sc(C(=O)Nc3cc[nH+]cc3C)c(C)c2c1 ZINC000173604121 340368594 /nfs/dbraw/zinc/36/85/94/340368594.db2.gz IZGASTNPNODBMN-UHFFFAOYSA-N 1 2 312.394 4.174 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cccc(O)c1Cl ZINC000512677208 340372568 /nfs/dbraw/zinc/37/25/68/340372568.db2.gz HTPKDTKFHQKYIZ-MWLCHTKSSA-N 1 2 307.743 4.208 20 0 DIADLO CCCC(CCC)[S@](=O)Cc1[nH+]ccn1Cc1ccccc1 ZINC000174040642 340380716 /nfs/dbraw/zinc/38/07/16/340380716.db2.gz CHIJCELCNIBLFT-JOCHJYFZSA-N 1 2 318.486 4.149 20 0 DIADLO CCCC(CCC)[S@@](=O)Cc1[nH+]ccn1Cc1ccccc1 ZINC000174040632 340380806 /nfs/dbraw/zinc/38/08/06/340380806.db2.gz CHIJCELCNIBLFT-QFIPXVFZSA-N 1 2 318.486 4.149 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000512907598 340383567 /nfs/dbraw/zinc/38/35/67/340383567.db2.gz SCELFCCPFVWBTL-HBUWYVDXSA-N 1 2 317.379 4.488 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000512907598 340383568 /nfs/dbraw/zinc/38/35/68/340383568.db2.gz SCELFCCPFVWBTL-HBUWYVDXSA-N 1 2 317.379 4.488 20 0 DIADLO CC(C)(C)c1nc(C[NH+]2CCC(C(F)(F)F)CC2)cs1 ZINC000174181206 340383655 /nfs/dbraw/zinc/38/36/55/340383655.db2.gz XRZGTYJPRXJWBZ-UHFFFAOYSA-N 1 2 306.397 4.215 20 0 DIADLO CC[N@H+](Cc1c[nH]c2ccccc12)Cc1c(F)ccc(O)c1F ZINC000513052025 340390986 /nfs/dbraw/zinc/39/09/86/340390986.db2.gz PVVKJFXSKKSOTK-UHFFFAOYSA-N 1 2 316.351 4.174 20 0 DIADLO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1c(F)ccc(O)c1F ZINC000513052025 340390987 /nfs/dbraw/zinc/39/09/87/340390987.db2.gz PVVKJFXSKKSOTK-UHFFFAOYSA-N 1 2 316.351 4.174 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(Cl)c1F)c1c(F)cncc1F ZINC000513055639 340391330 /nfs/dbraw/zinc/39/13/30/340391330.db2.gz CZGAOPYVZQBZIW-QMMMGPOBSA-N 1 2 300.711 4.003 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)ccc1F)c1c(F)cncc1F ZINC000513067317 340391808 /nfs/dbraw/zinc/39/18/08/340391808.db2.gz DJQYBSDLBIQGTD-MRVPVSSYSA-N 1 2 300.711 4.003 20 0 DIADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000513133441 340394594 /nfs/dbraw/zinc/39/45/94/340394594.db2.gz IFIBSLVBXUDKEU-NSHDSACASA-N 1 2 321.779 4.140 20 0 DIADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@H+]1CCOc2cc(O)ccc2C1 ZINC000513133441 340394595 /nfs/dbraw/zinc/39/45/95/340394595.db2.gz IFIBSLVBXUDKEU-NSHDSACASA-N 1 2 321.779 4.140 20 0 DIADLO CCn1nccc1C[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC000513150919 340395183 /nfs/dbraw/zinc/39/51/83/340395183.db2.gz TXZYLRBNUJCBTN-UHFFFAOYSA-N 1 2 303.409 4.086 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000513154719 340395385 /nfs/dbraw/zinc/39/53/85/340395385.db2.gz QWFFTWKJMDLMDN-GFCCVEGCSA-N 1 2 303.789 4.001 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+]1CCOc2cc(O)ccc2C1 ZINC000513154719 340395386 /nfs/dbraw/zinc/39/53/86/340395386.db2.gz QWFFTWKJMDLMDN-GFCCVEGCSA-N 1 2 303.789 4.001 20 0 DIADLO CC1(C)C[N@H+](Cc2c(F)ccc(O)c2F)CC[C@@H]1C(F)(F)F ZINC000513183376 340396028 /nfs/dbraw/zinc/39/60/28/340396028.db2.gz KWYNZWYTLDOEEQ-LBPRGKRZSA-N 1 2 323.305 4.081 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(F)ccc(O)c2F)CC[C@@H]1C(F)(F)F ZINC000513183376 340396029 /nfs/dbraw/zinc/39/60/29/340396029.db2.gz KWYNZWYTLDOEEQ-LBPRGKRZSA-N 1 2 323.305 4.081 20 0 DIADLO CCCn1c2ccc(Cl)cc2nc1SCCn1cc[nH+]c1 ZINC000513300607 340401424 /nfs/dbraw/zinc/40/14/24/340401424.db2.gz LSNQIONVDQGLMQ-UHFFFAOYSA-N 1 2 320.849 4.089 20 0 DIADLO COc1cc[nH+]cc1NC(=O)[C@H](c1cccc(Cl)c1)C(C)C ZINC000176299664 340426470 /nfs/dbraw/zinc/42/64/70/340426470.db2.gz CTFIPNRURPYUDK-INIZCTEOSA-N 1 2 318.804 4.122 20 0 DIADLO Cn1c[nH+]cc1CN1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000177014495 340435141 /nfs/dbraw/zinc/43/51/41/340435141.db2.gz GAWMIEYKKUXZML-OAHLLOKOSA-N 1 2 310.228 4.064 20 0 DIADLO C[C@H]1CC=C(c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)CC1 ZINC000517072810 340463201 /nfs/dbraw/zinc/46/32/01/340463201.db2.gz HHNZMFOTWHYINL-AWEZNQCLSA-N 1 2 320.396 4.185 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@@]2(C)Cc2ccccc2)c(C)[nH+]1 ZINC000185398996 340500688 /nfs/dbraw/zinc/50/06/88/340500688.db2.gz STOFYDJOMMETPF-FQEVSTJZSA-N 1 2 323.440 4.328 20 0 DIADLO CCCOc1ncccc1C[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000186278005 340510442 /nfs/dbraw/zinc/51/04/42/340510442.db2.gz BGQKRPGFVIFDRT-ZDUSSCGKSA-N 1 2 319.474 4.301 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(Br)s2)o1 ZINC000220950694 340520312 /nfs/dbraw/zinc/52/03/12/340520312.db2.gz SEKFALKWSYXIIC-IUCAKERBSA-N 1 2 315.236 4.219 20 0 DIADLO C/C=C/c1ccc(NC(=O)N2CC(C)(C)[C@H]2c2[nH+]ccn2C)cc1 ZINC000521557426 340525008 /nfs/dbraw/zinc/52/50/08/340525008.db2.gz QHQOWRFSYSWQRN-SQRWCISFSA-N 1 2 324.428 4.068 20 0 DIADLO Cc1[nH+]cc(CNc2cccc3ccn(C)c32)n1-c1ccccc1 ZINC000189189263 340529186 /nfs/dbraw/zinc/52/91/86/340529186.db2.gz GZNZPLQDUZENSZ-UHFFFAOYSA-N 1 2 316.408 4.285 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(Cl)s1 ZINC000195150931 340575282 /nfs/dbraw/zinc/57/52/82/340575282.db2.gz MIVBCVDQVBICPB-UHFFFAOYSA-N 1 2 303.774 4.044 20 0 DIADLO COC[C@H]([NH2+]Cc1csc(C(C)C)n1)c1ccc(Cl)cc1 ZINC000193275285 340575512 /nfs/dbraw/zinc/57/55/12/340575512.db2.gz AEUYIVVQSMRZQS-HNNXBMFYSA-N 1 2 324.877 4.397 20 0 DIADLO C[C@@H](C(=O)Nc1ccc2c(c1)[nH+]c1n2CCCCC1)C(C)(C)C ZINC000522320412 340598839 /nfs/dbraw/zinc/59/88/39/340598839.db2.gz UTXOYTCFQLZTKX-ZDUSSCGKSA-N 1 2 313.445 4.383 20 0 DIADLO Cc1cccn2cc(CNc3ccccc3OC(C)(C)C)[nH+]c12 ZINC000522404726 340600773 /nfs/dbraw/zinc/60/07/73/340600773.db2.gz HPILSFNGLDYPHF-UHFFFAOYSA-N 1 2 309.413 4.432 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1c(F)cccc1Cl ZINC000227600309 340601036 /nfs/dbraw/zinc/60/10/36/340601036.db2.gz NGAUBNCANXLJRP-UHFFFAOYSA-N 1 2 314.187 4.431 20 0 DIADLO c1cc2ncnc(Nc3ccc(NC4CCCC4)[nH+]c3)c2s1 ZINC000522623385 340605858 /nfs/dbraw/zinc/60/58/58/340605858.db2.gz JHRQBEPTAYVVDO-UHFFFAOYSA-N 1 2 311.414 4.184 20 0 DIADLO Cc1cn2cc(NC(=O)N3CCC[C@H]3CC(C)(C)C)ccc2[nH+]1 ZINC000523418934 340623498 /nfs/dbraw/zinc/62/34/98/340623498.db2.gz KNZUFZAUQHSIFX-HNNXBMFYSA-N 1 2 314.433 4.075 20 0 DIADLO CS[C@@H](C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1ccccc1 ZINC000523484222 340626072 /nfs/dbraw/zinc/62/60/72/340626072.db2.gz ZKWXITVPZUMOCX-QGZVFWFLSA-N 1 2 323.421 4.120 20 0 DIADLO Cc1cc(N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000524067903 340646971 /nfs/dbraw/zinc/64/69/71/340646971.db2.gz NLNXEDNTMKHTTA-XJKSGUPXSA-N 1 2 311.404 4.184 20 0 DIADLO C[C@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C(C)(C)C ZINC000524187268 340649458 /nfs/dbraw/zinc/64/94/58/340649458.db2.gz RLLKPKXPZGEBLY-LLVKDONJSA-N 1 2 305.809 4.146 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C)c1ccco1 ZINC000528923078 340739521 /nfs/dbraw/zinc/73/95/21/340739521.db2.gz ZXBAMWCHYUJXEF-LBPRGKRZSA-N 1 2 323.396 4.176 20 0 DIADLO FC(F)(F)c1sccc1CN1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000529527088 340759230 /nfs/dbraw/zinc/75/92/30/340759230.db2.gz AMWVMZNALQFNFT-LLVKDONJSA-N 1 2 315.364 4.217 20 0 DIADLO Cc1c(Cl)cccc1NC1CCN(c2cccc[nH+]2)CC1 ZINC000037196591 340772486 /nfs/dbraw/zinc/77/24/86/340772486.db2.gz VWOZEGMXPMMZHG-UHFFFAOYSA-N 1 2 301.821 4.124 20 0 DIADLO CC(C)c1ccc([C@@H](C)[NH2+][C@@H](CO)c2c(F)cccc2F)cc1 ZINC000537986540 340805568 /nfs/dbraw/zinc/80/55/68/340805568.db2.gz JNXHMXUULITLRC-ACJLOTCBSA-N 1 2 319.395 4.472 20 0 DIADLO CCc1cnc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)o1 ZINC000538224407 340814075 /nfs/dbraw/zinc/81/40/75/340814075.db2.gz ATALFZGCCSGVGK-MRXNPFEDSA-N 1 2 308.372 4.392 20 0 DIADLO C[C@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1c(F)cccc1F ZINC000539226850 340877480 /nfs/dbraw/zinc/87/74/80/340877480.db2.gz PTJCPMKXYHLACM-VIFPVBQESA-N 1 2 306.287 4.096 20 0 DIADLO CCOCc1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)cc1 ZINC000128660813 340901901 /nfs/dbraw/zinc/90/19/01/340901901.db2.gz LOECSSVZAZASQV-SFHVURJKSA-N 1 2 307.397 4.148 20 0 DIADLO Clc1cc(CNc2cc[nH+]c3ccncc23)c(Cl)s1 ZINC000540026797 340912686 /nfs/dbraw/zinc/91/26/86/340912686.db2.gz INJIUPKIKKSSMY-UHFFFAOYSA-N 1 2 310.209 4.032 20 0 DIADLO Fc1ccc2nc(C[NH2+]C3(c4cccc(Cl)c4)CC3)oc2c1 ZINC000540415424 340930314 /nfs/dbraw/zinc/93/03/14/340930314.db2.gz QPSMUUYZMBWZEJ-UHFFFAOYSA-N 1 2 316.763 4.399 20 0 DIADLO Cc1cc(OCC(=O)Nc2ccccc2C)c2cccc(C)c2[nH+]1 ZINC000540844482 340948495 /nfs/dbraw/zinc/94/84/95/340948495.db2.gz UVFYWMKWJRHYFW-UHFFFAOYSA-N 1 2 320.392 4.178 20 0 DIADLO c1csc([C@H]([NH2+]Cc2nc(C3CCCC3)no2)C2CC2)c1 ZINC000541580459 340975771 /nfs/dbraw/zinc/97/57/71/340975771.db2.gz LONLUBKATBRCKR-OAHLLOKOSA-N 1 2 303.431 4.030 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[NH2+][C@H](C)c1ccon1 ZINC000541726631 340981069 /nfs/dbraw/zinc/98/10/69/340981069.db2.gz BKUSECDKDHETOM-CQSZACIVSA-N 1 2 310.397 4.466 20 0 DIADLO COc1cccc([C@H]2C[C@H](C)CN2c2[nH+]c3ccccc3n2C)c1 ZINC000542203419 340999756 /nfs/dbraw/zinc/99/97/56/340999756.db2.gz AJUMYVGTJVLKER-IFXJQAMLSA-N 1 2 321.424 4.169 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[NH2+][C@@H](C)c1cnn(C(C)C)c1 ZINC000542574270 341014142 /nfs/dbraw/zinc/01/41/42/341014142.db2.gz MDKUYTBKLWTROX-AWEZNQCLSA-N 1 2 324.428 4.278 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](c2ccc(C)o2)C2CCC2)cs1 ZINC000542664278 341016097 /nfs/dbraw/zinc/01/60/97/341016097.db2.gz UQTGOVDJHRZRSL-WBMJQRKESA-N 1 2 320.458 4.383 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1csc(-c2ccccc2)n1 ZINC000542693696 341017508 /nfs/dbraw/zinc/01/75/08/341017508.db2.gz RVSACXJUHZIUES-AWEZNQCLSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1csc(-c2ccccc2)n1 ZINC000542693696 341017509 /nfs/dbraw/zinc/01/75/09/341017509.db2.gz RVSACXJUHZIUES-AWEZNQCLSA-N 1 2 309.438 4.398 20 0 DIADLO Cc1c(C(=O)Nc2cc[nH+]c(C)c2)sc2cccc(F)c12 ZINC000070888842 341018240 /nfs/dbraw/zinc/01/82/40/341018240.db2.gz CJCVENHLGNZPBL-UHFFFAOYSA-N 1 2 300.358 4.305 20 0 DIADLO CCCCOc1ccc(C[NH2+][C@@H](C)c2ccon2)cc1OCC ZINC000542708459 341018450 /nfs/dbraw/zinc/01/84/50/341018450.db2.gz YBUTXEWRDSOFJI-AWEZNQCLSA-N 1 2 318.417 4.103 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2Cl)o1)c1ccon1 ZINC000542709965 341018656 /nfs/dbraw/zinc/01/86/56/341018656.db2.gz NQGFFNMINJFVOL-LLVKDONJSA-N 1 2 302.761 4.439 20 0 DIADLO Cc1ccc(COc2ccc(C[NH2+][C@H](C)c3ccon3)cc2)cc1 ZINC000542712539 341018675 /nfs/dbraw/zinc/01/86/75/341018675.db2.gz SMVYFUMZDPVNEC-MRXNPFEDSA-N 1 2 322.408 4.413 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1nc(C2CCCC2)no1 ZINC000130342036 341018879 /nfs/dbraw/zinc/01/88/79/341018879.db2.gz BLAKIKFWUQEXML-GFCCVEGCSA-N 1 2 303.381 4.059 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc(C2CCCC2)no1 ZINC000130342036 341018880 /nfs/dbraw/zinc/01/88/80/341018880.db2.gz BLAKIKFWUQEXML-GFCCVEGCSA-N 1 2 303.381 4.059 20 0 DIADLO c1csc(C[NH+](Cc2cscn2)Cc2cccs2)c1 ZINC000071115312 341022623 /nfs/dbraw/zinc/02/26/23/341022623.db2.gz PAKCGUSREKWKEY-UHFFFAOYSA-N 1 2 306.481 4.469 20 0 DIADLO CC(C)Cn1cc(C[N@H+](C)[C@H](C)c2ccccc2Cl)cn1 ZINC000543058291 341029747 /nfs/dbraw/zinc/02/97/47/341029747.db2.gz KTEUGLRPDCUUQQ-CQSZACIVSA-N 1 2 305.853 4.386 20 0 DIADLO CC(C)Cn1cc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)cn1 ZINC000543058291 341029748 /nfs/dbraw/zinc/02/97/48/341029748.db2.gz KTEUGLRPDCUUQQ-CQSZACIVSA-N 1 2 305.853 4.386 20 0 DIADLO CSc1c(F)cc(NCc2cn3cc(C)ccc3[nH+]2)cc1F ZINC000543151893 341034467 /nfs/dbraw/zinc/03/44/67/341034467.db2.gz RBRGCVWEMBBKRN-UHFFFAOYSA-N 1 2 319.380 4.255 20 0 DIADLO CCc1cnc(C[N@H+]2[C@H](C)c3ccc(OC)cc3C[C@@H]2C)s1 ZINC000543415001 341043245 /nfs/dbraw/zinc/04/32/45/341043245.db2.gz VLMZBUTXPKFBGA-QWHCGFSZSA-N 1 2 316.470 4.222 20 0 DIADLO CCc1cnc(C[N@@H+]2[C@H](C)c3ccc(OC)cc3C[C@@H]2C)s1 ZINC000543415001 341043246 /nfs/dbraw/zinc/04/32/46/341043246.db2.gz VLMZBUTXPKFBGA-QWHCGFSZSA-N 1 2 316.470 4.222 20 0 DIADLO Cc1cc(-c2noc([C@H](C)[NH2+]Cc3ccccc3)n2)ccc1F ZINC000543548357 341048919 /nfs/dbraw/zinc/04/89/19/341048919.db2.gz IIQRYMSHELYALB-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1ccccc1C1CC[NH+](Cc2noc(C(C)(C)C)n2)CC1 ZINC000543560419 341049193 /nfs/dbraw/zinc/04/91/93/341049193.db2.gz CGKQQUBSWMBCKQ-UHFFFAOYSA-N 1 2 313.445 4.055 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@H](c2ccccc2)c2cncnc2)o1 ZINC000543600164 341050516 /nfs/dbraw/zinc/05/05/16/341050516.db2.gz CDCUMKLXDDXVNE-LXGCGDOSSA-N 1 2 319.408 4.072 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1ccccc1)c1ccc(F)cc1)c1ccn(C)n1 ZINC000543603341 341050815 /nfs/dbraw/zinc/05/08/15/341050815.db2.gz VZDUJTUNSQUMTM-ICSRJNTNSA-N 1 2 323.415 4.390 20 0 DIADLO CCc1nc(C[N@H+](C)C/C=C/c2ccc(F)cc2F)cs1 ZINC000543629401 341051999 /nfs/dbraw/zinc/05/19/99/341051999.db2.gz CGKHNABEKIDZAR-SNAWJCMRSA-N 1 2 308.397 4.129 20 0 DIADLO CCc1nc(C[N@@H+](C)C/C=C/c2ccc(F)cc2F)cs1 ZINC000543629401 341052000 /nfs/dbraw/zinc/05/20/00/341052000.db2.gz CGKHNABEKIDZAR-SNAWJCMRSA-N 1 2 308.397 4.129 20 0 DIADLO Fc1ccc(CNc2c[nH+]c3c(c2)CCCC3)c2ncccc12 ZINC000543867016 341062018 /nfs/dbraw/zinc/06/20/18/341062018.db2.gz AWCDKTWGPHZGGV-UHFFFAOYSA-N 1 2 307.372 4.260 20 0 DIADLO CCc1ccccc1NC(=O)[C@@H](C)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000543988033 341065180 /nfs/dbraw/zinc/06/51/80/341065180.db2.gz VOVJUIHGMBTUKV-HUUCEWRRSA-N 1 2 308.425 4.153 20 0 DIADLO CCc1ccccc1NC(=O)[C@@H](C)[N@H+]1Cc2ccccc2[C@H]1C ZINC000543988033 341065181 /nfs/dbraw/zinc/06/51/81/341065181.db2.gz VOVJUIHGMBTUKV-HUUCEWRRSA-N 1 2 308.425 4.153 20 0 DIADLO CC(C)(Cc1[nH]c2ccccc2[nH+]1)c1nc(-c2cccs2)no1 ZINC000543991382 341065547 /nfs/dbraw/zinc/06/55/47/341065547.db2.gz COCJTHZEGADHCW-UHFFFAOYSA-N 1 2 324.409 4.195 20 0 DIADLO CC(C)[C@@H]1CCC[N@H+](Cc2ncc(Br)s2)CC1 ZINC000544022269 341066936 /nfs/dbraw/zinc/06/69/36/341066936.db2.gz MOMCAWMCBKQSKH-LLVKDONJSA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)[C@@H]1CCC[N@@H+](Cc2ncc(Br)s2)CC1 ZINC000544022269 341066937 /nfs/dbraw/zinc/06/69/37/341066937.db2.gz MOMCAWMCBKQSKH-LLVKDONJSA-N 1 2 317.296 4.164 20 0 DIADLO COc1cccc([C@H]2C[C@H](C)CN2c2cc(C)[nH+]c(C3CC3)n2)c1 ZINC000544068919 341069043 /nfs/dbraw/zinc/06/90/43/341069043.db2.gz FTQCKBPNRGWCRS-SCLBCKFNSA-N 1 2 323.440 4.259 20 0 DIADLO COc1cccc([C@@H]2C[C@H](C)CN2c2cc(C)[nH+]c(C3CC3)n2)c1 ZINC000544068920 341069149 /nfs/dbraw/zinc/06/91/49/341069149.db2.gz FTQCKBPNRGWCRS-UGSOOPFHSA-N 1 2 323.440 4.259 20 0 DIADLO Cc1cccc(NC(=O)[C@H](c2cccc(Cl)c2)[NH+](C)C)c1F ZINC000544341835 341077040 /nfs/dbraw/zinc/07/70/40/341077040.db2.gz HEPSLGLPDGAAFO-INIZCTEOSA-N 1 2 320.795 4.029 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]Cc2ncc(-c3cccs3)o2)cn1 ZINC000544471304 341083662 /nfs/dbraw/zinc/08/36/62/341083662.db2.gz OOAKCWVIJWPBDJ-LBPRGKRZSA-N 1 2 316.430 4.031 20 0 DIADLO Cc1cccc(C)c1C[NH2+][C@@H](C)c1noc(Cc2ccccc2)n1 ZINC000544514413 341084595 /nfs/dbraw/zinc/08/45/95/341084595.db2.gz KLTOSDMLYQYODP-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1)c1ccon1 ZINC000544548764 341085371 /nfs/dbraw/zinc/08/53/71/341085371.db2.gz KJKDKLLCWNLCAC-OAHLLOKOSA-N 1 2 308.381 4.104 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1)c1ccon1 ZINC000544548763 341085373 /nfs/dbraw/zinc/08/53/73/341085373.db2.gz KJKDKLLCWNLCAC-HNNXBMFYSA-N 1 2 308.381 4.104 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2ccn(-c3ccccc3)n2)C2CCC2)o1 ZINC000544578062 341086841 /nfs/dbraw/zinc/08/68/41/341086841.db2.gz QYJZZFXBGOXQNM-FQEVSTJZSA-N 1 2 321.424 4.405 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c(F)c1 ZINC000544610626 341088894 /nfs/dbraw/zinc/08/88/94/341088894.db2.gz AARCEDJRRQFSKR-BQHGXPCASA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCO[C@@H](c3ccccc3)C2)c(F)c1 ZINC000544610626 341088895 /nfs/dbraw/zinc/08/88/95/341088895.db2.gz AARCEDJRRQFSKR-BQHGXPCASA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCO[C@H](c3cccs3)C2)c(F)c1 ZINC000544609868 341088972 /nfs/dbraw/zinc/08/89/72/341088972.db2.gz QQWLDMSUEQAOMS-VQRJYJFOSA-N 1 2 321.392 4.113 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCO[C@H](c3cccs3)C2)c(F)c1 ZINC000544609868 341088973 /nfs/dbraw/zinc/08/89/73/341088973.db2.gz QQWLDMSUEQAOMS-VQRJYJFOSA-N 1 2 321.392 4.113 20 0 DIADLO COc1ccc(Oc2ccc(C[NH2+][C@H](C)c3ccon3)cc2)cc1 ZINC000544616673 341089360 /nfs/dbraw/zinc/08/93/60/341089360.db2.gz CCZMBDQSBTVFKF-CQSZACIVSA-N 1 2 324.380 4.326 20 0 DIADLO Cc1cccn2cc(Cc3noc(C4CCCCCC4)n3)[nH+]c12 ZINC000544666763 341090584 /nfs/dbraw/zinc/09/05/84/341090584.db2.gz JUUUECQYAVOVGC-UHFFFAOYSA-N 1 2 310.401 4.054 20 0 DIADLO Cc1nc(CSCc2[nH+]ccn2Cc2ccccc2)cs1 ZINC000072702239 341099720 /nfs/dbraw/zinc/09/97/20/341099720.db2.gz MIQRFWYITJEXHO-UHFFFAOYSA-N 1 2 315.467 4.130 20 0 DIADLO C[N@H+](Cc1nc(C2CCCC2)no1)Cc1ccc(Cl)cc1 ZINC000131609481 341102273 /nfs/dbraw/zinc/10/22/73/341102273.db2.gz VFGFRHMZIMIILY-UHFFFAOYSA-N 1 2 305.809 4.013 20 0 DIADLO C[N@@H+](Cc1nc(C2CCCC2)no1)Cc1ccc(Cl)cc1 ZINC000131609481 341102274 /nfs/dbraw/zinc/10/22/74/341102274.db2.gz VFGFRHMZIMIILY-UHFFFAOYSA-N 1 2 305.809 4.013 20 0 DIADLO C[C@H](c1noc(-c2ccc(Cn3cc[nH+]c3)cc2)n1)C(C)(C)C ZINC000544983080 341102773 /nfs/dbraw/zinc/10/27/73/341102773.db2.gz VYLSWTUFJFXNCW-CYBMUJFWSA-N 1 2 310.401 4.131 20 0 DIADLO Cc1cccn2cc(C[NH2+]Cc3ccc(Cl)cc3Cl)nc12 ZINC000072816917 341107546 /nfs/dbraw/zinc/10/75/46/341107546.db2.gz ZIZJQAPPIPTZGI-UHFFFAOYSA-N 1 2 320.223 4.239 20 0 DIADLO CCCC[C@H](C)[NH2+]c1ccc(NS(=O)(=O)CCCC)cc1 ZINC000545239836 341116582 /nfs/dbraw/zinc/11/65/82/341116582.db2.gz OSGWSZUAEKSKAC-AWEZNQCLSA-N 1 2 312.479 4.219 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)c1ccc(Cl)cc1 ZINC000132141474 341117182 /nfs/dbraw/zinc/11/71/82/341117182.db2.gz KQYIUJQJDLNGDA-UHFFFAOYSA-N 1 2 304.777 4.165 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1ccc(F)c(F)c1 ZINC000073637235 341119360 /nfs/dbraw/zinc/11/93/60/341119360.db2.gz VURMNGQJILHWKL-ZJUUUORDSA-N 1 2 309.360 4.057 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1ccc(Cl)cc1 ZINC000073984224 341124541 /nfs/dbraw/zinc/12/45/41/341124541.db2.gz FCECOALHUYTJJD-MNOVXSKESA-N 1 2 307.825 4.432 20 0 DIADLO Cc1cccc(C)c1[C@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000545517548 341128008 /nfs/dbraw/zinc/12/80/08/341128008.db2.gz UTBIWWGNMAXXSV-UONOGXRCSA-N 1 2 301.434 4.396 20 0 DIADLO Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1nc(CCC(C)C)no1 ZINC000545518551 341128261 /nfs/dbraw/zinc/12/82/61/341128261.db2.gz NDORLZPUHZLWET-OAHLLOKOSA-N 1 2 301.434 4.126 20 0 DIADLO CC(C)c1ccc(-c2nc(Cc3cn4ccccc4[nH+]3)no2)cc1 ZINC000545600483 341132546 /nfs/dbraw/zinc/13/25/46/341132546.db2.gz LBUDKFUMLCZDJJ-UHFFFAOYSA-N 1 2 318.380 4.099 20 0 DIADLO Cc1ccc(Cc2noc([C@H](C)OC3CCCCCC3)n2)c[nH+]1 ZINC000545638104 341134391 /nfs/dbraw/zinc/13/43/91/341134391.db2.gz HASZIFRAKXXSPI-AWEZNQCLSA-N 1 2 315.417 4.164 20 0 DIADLO Cc1ccc(CCCCc2nc(Cc3ccc(C)[nH+]c3)no2)cc1 ZINC000545644386 341134618 /nfs/dbraw/zinc/13/46/18/341134618.db2.gz HOMQYUUTHDOWFQ-UHFFFAOYSA-N 1 2 321.424 4.238 20 0 DIADLO C[C@H]1CCCC[C@@H]1c1noc(CCc2[nH]c3ccccc3[nH+]2)n1 ZINC000545686757 341136338 /nfs/dbraw/zinc/13/63/38/341136338.db2.gz KLAVYIXZYCLEFR-STQMWFEESA-N 1 2 310.401 4.025 20 0 DIADLO CC(C)(C)Cc1noc(/C=C/c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000545747821 341139339 /nfs/dbraw/zinc/13/93/39/341139339.db2.gz NMBYPYRAPYPRRI-RMKNXTFCSA-N 1 2 308.385 4.014 20 0 DIADLO CCCc1nc(C[N@H+](C)[C@@H](C)c2ccc(OC)cc2)cs1 ZINC000074255250 341139505 /nfs/dbraw/zinc/13/95/05/341139505.db2.gz ZMONVVHTOSAFCV-ZDUSSCGKSA-N 1 2 304.459 4.297 20 0 DIADLO CCCc1nc(C[N@@H+](C)[C@@H](C)c2ccc(OC)cc2)cs1 ZINC000074255250 341139506 /nfs/dbraw/zinc/13/95/06/341139506.db2.gz ZMONVVHTOSAFCV-ZDUSSCGKSA-N 1 2 304.459 4.297 20 0 DIADLO CCCc1[nH+]c2ccccc2n1CCc1nc([C@@H](C)C2CC2)no1 ZINC000545806276 341141903 /nfs/dbraw/zinc/14/19/03/341141903.db2.gz PZHUTTTXSBIZQS-ZDUSSCGKSA-N 1 2 324.428 4.128 20 0 DIADLO CC(C)c1nc(C[N@H+](Cc2ccc(F)cc2)C(C)(C)C)no1 ZINC000132826809 341146494 /nfs/dbraw/zinc/14/64/94/341146494.db2.gz WJHDNAJUDUILAP-UHFFFAOYSA-N 1 2 305.397 4.133 20 0 DIADLO CC(C)c1nc(C[N@@H+](Cc2ccc(F)cc2)C(C)(C)C)no1 ZINC000132826809 341146495 /nfs/dbraw/zinc/14/64/95/341146495.db2.gz WJHDNAJUDUILAP-UHFFFAOYSA-N 1 2 305.397 4.133 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@@H](C)CCOC)c1 ZINC000545954421 341148319 /nfs/dbraw/zinc/14/83/19/341148319.db2.gz PMMWTAHPIRVERQ-HNNXBMFYSA-N 1 2 301.434 4.187 20 0 DIADLO CC(C)c1ccc(C(=O)Nc2ccccc2-n2cc[nH+]c2)s1 ZINC000546160231 341155126 /nfs/dbraw/zinc/15/51/26/341155126.db2.gz HUSACLYOKCYGDW-UHFFFAOYSA-N 1 2 311.410 4.310 20 0 DIADLO Cc1ccc(-c2noc(/C=C3/CC[C@@H](C)C3)n2)c(N2CCCC2)[nH+]1 ZINC000546368180 341165325 /nfs/dbraw/zinc/16/53/25/341165325.db2.gz PGTDJCJWWIAQMY-DKXRRRNBSA-N 1 2 324.428 4.244 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](C)Cc1nccn1Cc1ccccc1 ZINC000075608688 341179528 /nfs/dbraw/zinc/17/95/28/341179528.db2.gz OXXBTXJWBJLBHG-KRWDZBQOSA-N 1 2 305.425 4.124 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1nccn1Cc1ccccc1 ZINC000075608688 341179529 /nfs/dbraw/zinc/17/95/29/341179529.db2.gz OXXBTXJWBJLBHG-KRWDZBQOSA-N 1 2 305.425 4.124 20 0 DIADLO Cc1cccc(C)c1[C@H](C)[NH2+]Cc1noc(Cc2ccccc2)n1 ZINC000546932513 341187275 /nfs/dbraw/zinc/18/72/75/341187275.db2.gz MDQARYCNYPYKCU-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)Cc2cc(C)ccc2C)cs1 ZINC000075887823 341188303 /nfs/dbraw/zinc/18/83/03/341188303.db2.gz RRSVHFDOOHHSHW-HNNXBMFYSA-N 1 2 318.486 4.489 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)Cc2cc(C)ccc2C)cs1 ZINC000075887823 341188304 /nfs/dbraw/zinc/18/83/04/341188304.db2.gz RRSVHFDOOHHSHW-HNNXBMFYSA-N 1 2 318.486 4.489 20 0 DIADLO Cc1ccc(Cc2nc(-c3ccc(C(F)(F)F)cc3)no2)c[nH+]1 ZINC000546995223 341190527 /nfs/dbraw/zinc/19/05/27/341190527.db2.gz NHYOJPGQZTWGLG-UHFFFAOYSA-N 1 2 319.286 4.050 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc([C@H]2CCC[C@@H](C)C2)no1 ZINC000547061011 341194090 /nfs/dbraw/zinc/19/40/90/341194090.db2.gz WBQHBGSQVSURDG-OCCSQVGLSA-N 1 2 310.401 4.070 20 0 DIADLO CC(C)Oc1ccccc1C[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000236684049 341194330 /nfs/dbraw/zinc/19/43/30/341194330.db2.gz DTBQIAFUEZWAHB-CYBMUJFWSA-N 1 2 317.433 4.005 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccccc2OCC2CC2)c(C)[nH+]1 ZINC000134147789 341207676 /nfs/dbraw/zinc/20/76/76/341207676.db2.gz HHRQRJZDUAVRGJ-UHFFFAOYSA-N 1 2 310.397 4.048 20 0 DIADLO Cc1[nH]c2ccc(CSc3ncnc4sccc43)cc2[nH+]1 ZINC000547348596 341207813 /nfs/dbraw/zinc/20/78/13/341207813.db2.gz MGSGUICTKDGYLM-UHFFFAOYSA-N 1 2 312.423 4.168 20 0 DIADLO Cc1[nH]c2cc(CSc3ncnc4sccc43)ccc2[nH+]1 ZINC000547348596 341207814 /nfs/dbraw/zinc/20/78/14/341207814.db2.gz MGSGUICTKDGYLM-UHFFFAOYSA-N 1 2 312.423 4.168 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(s1)C[C@@H](C)CC2)c1ccc(F)cc1F ZINC000134196577 341209069 /nfs/dbraw/zinc/20/90/69/341209069.db2.gz IDCDODPMQMHNEJ-WDEREUQCSA-N 1 2 322.424 4.397 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2nc3ccccc3[nH]2)[C@@H]1c1ccccc1 ZINC000547506284 341218765 /nfs/dbraw/zinc/21/87/65/341218765.db2.gz UEXMEDCQSRIYBJ-KUHUBIRLSA-N 1 2 323.465 4.242 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2nc3ccccc3[nH]2)[C@@H]1c1ccccc1 ZINC000547506284 341218766 /nfs/dbraw/zinc/21/87/66/341218766.db2.gz UEXMEDCQSRIYBJ-KUHUBIRLSA-N 1 2 323.465 4.242 20 0 DIADLO c1c[nH]c([C@H]2CCC[N@H+]2Cc2csc(Cc3ccccc3)n2)c1 ZINC000077171094 341219862 /nfs/dbraw/zinc/21/98/62/341219862.db2.gz JXAAKCUUVDRSTI-GOSISDBHSA-N 1 2 323.465 4.399 20 0 DIADLO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2csc(Cc3ccccc3)n2)c1 ZINC000077171094 341219863 /nfs/dbraw/zinc/21/98/63/341219863.db2.gz JXAAKCUUVDRSTI-GOSISDBHSA-N 1 2 323.465 4.399 20 0 DIADLO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000564327329 341225786 /nfs/dbraw/zinc/22/57/86/341225786.db2.gz YUKLJJVJRFIBDA-ZDUSSCGKSA-N 1 2 318.490 4.118 20 0 DIADLO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000564327329 341225787 /nfs/dbraw/zinc/22/57/87/341225787.db2.gz YUKLJJVJRFIBDA-ZDUSSCGKSA-N 1 2 318.490 4.118 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1nc2c(s1)CCC2 ZINC000134895680 341226047 /nfs/dbraw/zinc/22/60/47/341226047.db2.gz DNDKSFKLRVPMSQ-JTQLQIEISA-N 1 2 321.515 4.237 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2ccc(CSC(F)F)o2)s1 ZINC000134909726 341226573 /nfs/dbraw/zinc/22/65/73/341226573.db2.gz CHLRPBMFOZTEQR-VIFPVBQESA-N 1 2 318.414 4.351 20 0 DIADLO Cc1cc(Cl)ccc1NC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000078264167 341239237 /nfs/dbraw/zinc/23/92/37/341239237.db2.gz LDTVFENGOXAJHD-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO CC[C@H](C(=O)Nc1cccc(-c2[nH+]ccn2C)c1)c1ccccc1 ZINC000079586860 341261645 /nfs/dbraw/zinc/26/16/45/341261645.db2.gz XMJWIBUULLCOLK-SFHVURJKSA-N 1 2 319.408 4.219 20 0 DIADLO CC[C@]1(C)COCC[N@@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000548504969 341264739 /nfs/dbraw/zinc/26/47/39/341264739.db2.gz OCRLGFGDGJXNGA-QGZVFWFLSA-N 1 2 308.491 4.192 20 0 DIADLO CC[C@]1(C)COCC[N@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000548504969 341264740 /nfs/dbraw/zinc/26/47/40/341264740.db2.gz OCRLGFGDGJXNGA-QGZVFWFLSA-N 1 2 308.491 4.192 20 0 DIADLO Cc1[nH+]cccc1NCc1ccc(Cl)c(Br)c1 ZINC000137133558 341273065 /nfs/dbraw/zinc/27/30/65/341273065.db2.gz WNNSTWNJLCPDOU-UHFFFAOYSA-N 1 2 311.610 4.418 20 0 DIADLO Cc1noc([C@H](C)[N@H+](C)Cc2cccc(-c3ccccc3)c2)n1 ZINC000548779617 341275441 /nfs/dbraw/zinc/27/54/41/341275441.db2.gz CCVWADNBXZEDAV-AWEZNQCLSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1noc([C@H](C)[N@@H+](C)Cc2cccc(-c3ccccc3)c2)n1 ZINC000548779617 341275442 /nfs/dbraw/zinc/27/54/42/341275442.db2.gz CCVWADNBXZEDAV-AWEZNQCLSA-N 1 2 307.397 4.238 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000548787027 341275672 /nfs/dbraw/zinc/27/56/72/341275672.db2.gz WNUOVRCRCKNODT-CMPLNLGQSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000548787027 341275673 /nfs/dbraw/zinc/27/56/73/341275673.db2.gz WNUOVRCRCKNODT-CMPLNLGQSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000548787031 341275684 /nfs/dbraw/zinc/27/56/84/341275684.db2.gz WNUOVRCRCKNODT-ZYHUDNBSSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000548787031 341275685 /nfs/dbraw/zinc/27/56/85/341275685.db2.gz WNUOVRCRCKNODT-ZYHUDNBSSA-N 1 2 323.305 4.069 20 0 DIADLO CCc1nc(C[N@H+](C)C[C@@H](OC)c2ccc(Cl)cc2)cs1 ZINC000548910744 341280705 /nfs/dbraw/zinc/28/07/05/341280705.db2.gz LBFFXXPPBZOABS-OAHLLOKOSA-N 1 2 324.877 4.178 20 0 DIADLO CCc1nc(C[N@@H+](C)C[C@@H](OC)c2ccc(Cl)cc2)cs1 ZINC000548910744 341280706 /nfs/dbraw/zinc/28/07/06/341280706.db2.gz LBFFXXPPBZOABS-OAHLLOKOSA-N 1 2 324.877 4.178 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000548941554 341281850 /nfs/dbraw/zinc/28/18/50/341281850.db2.gz XUTRGTWLQCIBKA-SUMWQHHRSA-N 1 2 304.796 4.367 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000548941554 341281851 /nfs/dbraw/zinc/28/18/51/341281851.db2.gz XUTRGTWLQCIBKA-SUMWQHHRSA-N 1 2 304.796 4.367 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+]1CC[C@H](OC(F)F)C1 ZINC000549080754 341285594 /nfs/dbraw/zinc/28/55/94/341285594.db2.gz FMPSUHCTGMGPNB-WPRPVWTQSA-N 1 2 310.171 4.368 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+]1CC[C@H](OC(F)F)C1 ZINC000549080754 341285595 /nfs/dbraw/zinc/28/55/95/341285595.db2.gz FMPSUHCTGMGPNB-WPRPVWTQSA-N 1 2 310.171 4.368 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@H+](Cc2nc3ccccc3[nH]2)CC12CCC2 ZINC000549169714 341287837 /nfs/dbraw/zinc/28/78/37/341287837.db2.gz AXWBWPVHNLQVBI-CQSZACIVSA-N 1 2 323.362 4.117 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@@H+](Cc2nc3ccccc3[nH]2)CC12CCC2 ZINC000549169714 341287838 /nfs/dbraw/zinc/28/78/38/341287838.db2.gz AXWBWPVHNLQVBI-CQSZACIVSA-N 1 2 323.362 4.117 20 0 DIADLO Cc1ccc2nc(C[N@@H+](C)[C@H](C)c3ccc(F)c(F)c3)cn2c1 ZINC000549181175 341288232 /nfs/dbraw/zinc/28/82/32/341288232.db2.gz LNWVGQDLAUDSTI-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1ccc2nc(C[N@H+](C)[C@H](C)c3ccc(F)c(F)c3)cn2c1 ZINC000549181175 341288233 /nfs/dbraw/zinc/28/82/33/341288233.db2.gz LNWVGQDLAUDSTI-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO CC(=O)c1ccc(OCc2ccc(C(C)C)[nH+]c2C)cc1F ZINC000549336833 341291516 /nfs/dbraw/zinc/29/15/16/341291516.db2.gz MFSQHKOWLQLGFU-UHFFFAOYSA-N 1 2 301.361 4.434 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Br)cn2)[C@H]1c1ccccc1 ZINC000245441092 341294269 /nfs/dbraw/zinc/29/42/69/341294269.db2.gz VDGDKZXOGLICGW-BLLLJJGKSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Br)cn2)[C@H]1c1ccccc1 ZINC000245441092 341294270 /nfs/dbraw/zinc/29/42/70/341294270.db2.gz VDGDKZXOGLICGW-BLLLJJGKSA-N 1 2 317.230 4.037 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1C[C@@H](C)OC[C@H]1c1ccccc1 ZINC000549463995 341295218 /nfs/dbraw/zinc/29/52/18/341295218.db2.gz BJAVNDIGPUZXFB-IERDGZPVSA-N 1 2 324.468 4.475 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1C[C@@H](C)OC[C@H]1c1ccccc1 ZINC000549463995 341295219 /nfs/dbraw/zinc/29/52/19/341295219.db2.gz BJAVNDIGPUZXFB-IERDGZPVSA-N 1 2 324.468 4.475 20 0 DIADLO Cc1csc(C[N@@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)n1 ZINC000081649268 341300788 /nfs/dbraw/zinc/30/07/88/341300788.db2.gz REFLUKVBVAZVCS-XHDPSFHLSA-N 1 2 302.443 4.333 20 0 DIADLO Cc1csc(C[N@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)n1 ZINC000081649268 341300789 /nfs/dbraw/zinc/30/07/89/341300789.db2.gz REFLUKVBVAZVCS-XHDPSFHLSA-N 1 2 302.443 4.333 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+]Cc2ccc(C3CCC3)cc2)s1 ZINC000549780866 341303000 /nfs/dbraw/zinc/30/30/00/341303000.db2.gz VJXKWPNBIKUEOF-UHFFFAOYSA-N 1 2 315.486 4.393 20 0 DIADLO COc1cc(C[NH2+]CC(C)(F)F)ccc1OCc1ccccc1 ZINC000549866270 341305469 /nfs/dbraw/zinc/30/54/69/341305469.db2.gz NAEGFBNPAWPLRU-UHFFFAOYSA-N 1 2 321.367 4.019 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+](CC(=O)OC(C)(C)C)C(C)C ZINC000549921558 341306733 /nfs/dbraw/zinc/30/67/33/341306733.db2.gz BZEXTTIQJLDTHC-UHFFFAOYSA-N 1 2 320.477 4.066 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+](CC(=O)OC(C)(C)C)C(C)C ZINC000549921558 341306734 /nfs/dbraw/zinc/30/67/34/341306734.db2.gz BZEXTTIQJLDTHC-UHFFFAOYSA-N 1 2 320.477 4.066 20 0 DIADLO CCc1ccc(-c2nc(C[N@@H+]3CCC[C@H]3CF)cs2)cc1 ZINC000550410048 341316357 /nfs/dbraw/zinc/31/63/57/341316357.db2.gz KFGGDPSXYIJDDT-INIZCTEOSA-N 1 2 304.434 4.306 20 0 DIADLO CCc1ccc(-c2nc(C[N@H+]3CCC[C@H]3CF)cs2)cc1 ZINC000550410048 341316358 /nfs/dbraw/zinc/31/63/58/341316358.db2.gz KFGGDPSXYIJDDT-INIZCTEOSA-N 1 2 304.434 4.306 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)no1 ZINC000245898806 341317608 /nfs/dbraw/zinc/31/76/08/341317608.db2.gz NOZTUKKSKRZPQT-JDSLSITLSA-N 1 2 319.836 4.162 20 0 DIADLO CC(C)C(=O)Nc1cccc(N[C@@H](C)c2cn3ccccc3[nH+]2)c1 ZINC000550921588 341326881 /nfs/dbraw/zinc/32/68/81/341326881.db2.gz TYJMIOFHDXVJIN-AWEZNQCLSA-N 1 2 322.412 4.102 20 0 DIADLO Cc1nc(-c2cc([C@H](C)[NH2+]CC(C)(F)F)cs2)cs1 ZINC000551240758 341334705 /nfs/dbraw/zinc/33/47/05/341334705.db2.gz HAZNQQXCNXVEAR-QMMMGPOBSA-N 1 2 302.415 4.486 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1cn2ccccc2n1 ZINC000551273000 341336583 /nfs/dbraw/zinc/33/65/83/341336583.db2.gz ZHWOAYLFHDYZLA-QRWLVFNGSA-N 1 2 317.392 4.368 20 0 DIADLO Cc1nc(C[NH+]2CCC(CC(F)(F)F)CC2)nc2ccccc12 ZINC000551406198 341340750 /nfs/dbraw/zinc/34/07/50/341340750.db2.gz IJRTWAMTZHFGPJ-UHFFFAOYSA-N 1 2 323.362 4.103 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1c1noc(Cn2c(C)[nH+]c3ccccc32)n1 ZINC000551536068 341344595 /nfs/dbraw/zinc/34/45/95/341344595.db2.gz PCTQYZVVROLLEC-CABCVRRESA-N 1 2 324.428 4.460 20 0 DIADLO Cc1ncc(-c2ccc(NCc3cn4cc(C)ccc4[nH+]3)cc2)o1 ZINC000551596844 341346889 /nfs/dbraw/zinc/34/68/89/341346889.db2.gz KLRMIJSHMNLWMX-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO CC(C)CN(C(=O)c1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000551764622 341350785 /nfs/dbraw/zinc/35/07/85/341350785.db2.gz VJQHQHWBWXQRJP-UHFFFAOYSA-N 1 2 319.408 4.175 20 0 DIADLO Cc1c[nH+]c(C)nc1N[C@H]1CCCc2cc(OC(F)F)ccc21 ZINC000564383210 341352002 /nfs/dbraw/zinc/35/20/02/341352002.db2.gz WCYPHMUEMXPXBK-HNNXBMFYSA-N 1 2 319.355 4.184 20 0 DIADLO CC(C)[N@H+](Cc1cc(-c2ccccc2)on1)Cc1ccccn1 ZINC000551899837 341354452 /nfs/dbraw/zinc/35/44/52/341354452.db2.gz UHYYSJDGTSRKCH-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO CC(C)[N@@H+](Cc1cc(-c2ccccc2)on1)Cc1ccccn1 ZINC000551899837 341354453 /nfs/dbraw/zinc/35/44/53/341354453.db2.gz UHYYSJDGTSRKCH-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2F)o1)c1cscn1 ZINC000551917680 341354940 /nfs/dbraw/zinc/35/49/40/341354940.db2.gz UJWZBRJYVOBWSV-LLVKDONJSA-N 1 2 302.374 4.393 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)[C@H]2CCc3ccccc32)cs1 ZINC000247051317 341360403 /nfs/dbraw/zinc/36/04/03/341360403.db2.gz WPDULEBFYKJVGJ-GUYCJALGSA-N 1 2 316.470 4.360 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)[C@H]2CCc3ccccc32)cs1 ZINC000247051317 341360404 /nfs/dbraw/zinc/36/04/04/341360404.db2.gz WPDULEBFYKJVGJ-GUYCJALGSA-N 1 2 316.470 4.360 20 0 DIADLO c1ccc(-c2noc(C[NH2+]Cc3ccc(C4CCC4)cc3)n2)cc1 ZINC000552015078 341360811 /nfs/dbraw/zinc/36/08/11/341360811.db2.gz OQCGQOBWAVCOMO-UHFFFAOYSA-N 1 2 319.408 4.294 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+]2CCO[C@@H](c3cccc(F)c3)C2)o1 ZINC000552033127 341363298 /nfs/dbraw/zinc/36/32/98/341363298.db2.gz NPUXNIWMRCKTIM-OMWUSAIZSA-N 1 2 315.388 4.116 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+]2CCO[C@@H](c3cccc(F)c3)C2)o1 ZINC000552033127 341363299 /nfs/dbraw/zinc/36/32/99/341363299.db2.gz NPUXNIWMRCKTIM-OMWUSAIZSA-N 1 2 315.388 4.116 20 0 DIADLO CC[N@@H+](Cc1csc(-c2ccco2)n1)Cc1cccs1 ZINC000248271236 341375227 /nfs/dbraw/zinc/37/52/27/341375227.db2.gz VZPYLAXJVUDZEM-UHFFFAOYSA-N 1 2 304.440 4.487 20 0 DIADLO CC[N@H+](Cc1csc(-c2ccco2)n1)Cc1cccs1 ZINC000248271236 341375228 /nfs/dbraw/zinc/37/52/28/341375228.db2.gz VZPYLAXJVUDZEM-UHFFFAOYSA-N 1 2 304.440 4.487 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cncc(Br)c2)[C@H]1c1ccccc1 ZINC000248341815 341375551 /nfs/dbraw/zinc/37/55/51/341375551.db2.gz JEOARSYFUGSIOY-MLGOLLRUSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cncc(Br)c2)[C@H]1c1ccccc1 ZINC000248341815 341375552 /nfs/dbraw/zinc/37/55/52/341375552.db2.gz JEOARSYFUGSIOY-MLGOLLRUSA-N 1 2 317.230 4.037 20 0 DIADLO Cc1nn(C)cc1C[N@@H+]1CCc2cc(Cl)c(Cl)cc2[C@H]1C ZINC000552175045 341375711 /nfs/dbraw/zinc/37/57/11/341375711.db2.gz GLMJZTLLXCFRDV-LLVKDONJSA-N 1 2 324.255 4.155 20 0 DIADLO Cc1nn(C)cc1C[N@H+]1CCc2cc(Cl)c(Cl)cc2[C@H]1C ZINC000552175045 341375712 /nfs/dbraw/zinc/37/57/12/341375712.db2.gz GLMJZTLLXCFRDV-LLVKDONJSA-N 1 2 324.255 4.155 20 0 DIADLO Cc1c(C(=O)Nc2ccn3cc[nH+]c3c2)oc2c1c(C)ccc2C ZINC000552195917 341377564 /nfs/dbraw/zinc/37/75/64/341377564.db2.gz GODOVSHUFIFOAH-UHFFFAOYSA-N 1 2 319.364 4.258 20 0 DIADLO CC(C)c1cnc(C[N@H+]2C[C@@H](c3ccccc3)O[C@@H](C)C2)s1 ZINC000248509253 341379007 /nfs/dbraw/zinc/37/90/07/341379007.db2.gz YUZSRFZKNDFRBO-HOCLYGCPSA-N 1 2 316.470 4.229 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2C[C@@H](c3ccccc3)O[C@@H](C)C2)s1 ZINC000248509253 341379008 /nfs/dbraw/zinc/37/90/08/341379008.db2.gz YUZSRFZKNDFRBO-HOCLYGCPSA-N 1 2 316.470 4.229 20 0 DIADLO OCCCc1cccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000552282149 341383839 /nfs/dbraw/zinc/38/38/39/341383839.db2.gz XPZOLJXLXHZZCY-SFHVURJKSA-N 1 2 313.445 4.068 20 0 DIADLO C[C@H]([NH2+]Cc1nc2ccccc2[nH]1)c1nc(C(C)(C)C)cs1 ZINC000552641262 341401105 /nfs/dbraw/zinc/40/11/05/341401105.db2.gz PAUJNFNEWZUELV-NSHDSACASA-N 1 2 314.458 4.168 20 0 DIADLO Cc1occc1C(=O)Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000089871093 341410204 /nfs/dbraw/zinc/41/02/04/341410204.db2.gz CMKAFAQMJWQAEN-UHFFFAOYSA-N 1 2 311.385 4.025 20 0 DIADLO Cc1cc(C)c(NC(=O)CCCc2cc(F)ccc2F)c(C)[nH+]1 ZINC000090467500 341416127 /nfs/dbraw/zinc/41/61/27/341416127.db2.gz MOTJMGLFYQIKOL-UHFFFAOYSA-N 1 2 318.367 4.246 20 0 DIADLO COc1cccc2c(N3CCC=C(c4ccco4)C3)cc[nH+]c12 ZINC000553241540 341421547 /nfs/dbraw/zinc/42/15/47/341421547.db2.gz HTOMATRHZONIND-UHFFFAOYSA-N 1 2 306.365 4.130 20 0 DIADLO COc1ccc(C(C)=O)c(OCc2ccc(C(C)C)[nH+]c2C)c1 ZINC000554971256 341470878 /nfs/dbraw/zinc/47/08/78/341470878.db2.gz OOIPYJJVPZHCDY-UHFFFAOYSA-N 1 2 313.397 4.304 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1cn2ccccc2n1 ZINC000556235964 341498615 /nfs/dbraw/zinc/49/86/15/341498615.db2.gz LKFYWXQEOOEHQD-LLVKDONJSA-N 1 2 320.223 4.492 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc2c(s1)C[C@@H](C)CC2)c1nccs1 ZINC000152763598 341505213 /nfs/dbraw/zinc/50/52/13/341505213.db2.gz KMVHUGUKOCTXIF-MEDUHNTESA-N 1 2 321.515 4.139 20 0 DIADLO CCC(CC)[C@@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)c1cccs1 ZINC000565660592 341534367 /nfs/dbraw/zinc/53/43/67/341534367.db2.gz JLZCNEABEKQCGD-CXAGYDPISA-N 1 2 319.474 4.189 20 0 DIADLO Cc1cc(NC(=O)[C@@]23C[C@@H]2CCC3)ccc1Oc1cc[nH+]cc1 ZINC000565885708 341541529 /nfs/dbraw/zinc/54/15/29/341541529.db2.gz PAANFLGQXHXKLC-LIRRHRJNSA-N 1 2 308.381 4.311 20 0 DIADLO c1ccc(COc2ccc[nH+]c2N2Cc3ccccc3C2)cc1 ZINC000566885859 341570773 /nfs/dbraw/zinc/57/07/73/341570773.db2.gz JHDJHCYLVAIQGF-UHFFFAOYSA-N 1 2 302.377 4.181 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1cnc(C2CC2)s1 ZINC000158433975 341656861 /nfs/dbraw/zinc/65/68/61/341656861.db2.gz ZTJHHJAUBUFTJS-UHFFFAOYSA-N 1 2 303.431 4.205 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccc(-c3ccco3)cc2F)s1 ZINC000568590443 341675892 /nfs/dbraw/zinc/67/58/92/341675892.db2.gz JLSUWQWNXOKCFS-UHFFFAOYSA-N 1 2 316.401 4.394 20 0 DIADLO Cc1[nH+]cccc1Cc1nc(-c2ccc(C(C)(F)F)cc2)no1 ZINC000573707669 341736567 /nfs/dbraw/zinc/73/65/67/341736567.db2.gz UOWGTTBCKMNXIY-UHFFFAOYSA-N 1 2 315.323 4.143 20 0 DIADLO CCCC[C@@H](C)c1nc(CCn2c(C)[nH+]c3ccccc32)no1 ZINC000575051629 341773935 /nfs/dbraw/zinc/77/39/35/341773935.db2.gz YYJJVCOHYKBWNA-CYBMUJFWSA-N 1 2 312.417 4.264 20 0 DIADLO COC[C@H]([NH2+]Cc1cc2cc(C)c(C)cc2o1)c1ccc(C)o1 ZINC000174979017 341833503 /nfs/dbraw/zinc/83/35/03/341833503.db2.gz JAHCXPQKKXUTGH-KRWDZBQOSA-N 1 2 313.397 4.428 20 0 DIADLO CC(C)[C@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC000576587428 341853980 /nfs/dbraw/zinc/85/39/80/341853980.db2.gz JDXBLYIFQVLTJR-DYVFJYSZSA-N 1 2 319.836 4.001 20 0 DIADLO Cc1ccn2cc(CN[C@H](c3ccccc3)C(F)(F)F)[nH+]c2c1 ZINC000580672611 341896047 /nfs/dbraw/zinc/89/60/47/341896047.db2.gz QEQQREIBSCUNED-MRXNPFEDSA-N 1 2 319.330 4.036 20 0 DIADLO CCO[C@H](C)c1noc(C[NH2+][C@@H](CC(C)C)c2ccccc2)n1 ZINC000177381490 341919242 /nfs/dbraw/zinc/91/92/42/341919242.db2.gz NUGDHQPKAUPQGL-ZBFHGGJFSA-N 1 2 317.433 4.044 20 0 DIADLO O=C(NC1CCC2(CC2)CC1)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000577810913 341938477 /nfs/dbraw/zinc/93/84/77/341938477.db2.gz IJCBJGHIJPCRAZ-UHFFFAOYSA-N 1 2 322.408 4.327 20 0 DIADLO Clc1ccc([C@H](CNc2cccc[nH+]2)OCC2CC2)cc1 ZINC000577972049 341961478 /nfs/dbraw/zinc/96/14/78/341961478.db2.gz IDMDXBORENFIPG-INIZCTEOSA-N 1 2 302.805 4.315 20 0 DIADLO COCCC1CCN(c2cc[nH+]c3c(Cl)cccc23)CC1 ZINC000528090794 518049950 /nfs/dbraw/zinc/04/99/50/518049950.db2.gz UFONLDSZGCIRFD-UHFFFAOYSA-N 1 2 304.821 4.141 20 0 DIADLO COc1cccc([C@@H]2C[C@@H](C)CN2c2[nH+]c3ccccc3n2C)c1 ZINC000542203420 518167103 /nfs/dbraw/zinc/16/71/03/518167103.db2.gz AJUMYVGTJVLKER-KUHUBIRLSA-N 1 2 321.424 4.169 20 0 DIADLO Cc1cc(N[C@H](C)C(c2ccccc2)c2ccccc2)nc[nH+]1 ZINC000493132414 518187674 /nfs/dbraw/zinc/18/76/74/518187674.db2.gz RWCAISKLGMAUER-MRXNPFEDSA-N 1 2 303.409 4.418 20 0 DIADLO CC(C)(C)n1ncnc1C[N@H+](C1CC1)[C@@H]1CCCc2ccccc21 ZINC000338277712 519175914 /nfs/dbraw/zinc/17/59/14/519175914.db2.gz GGDHUBTWWKNEIL-GOSISDBHSA-N 1 2 324.472 4.075 20 0 DIADLO CC(C)(C)n1ncnc1C[N@@H+](C1CC1)[C@@H]1CCCc2ccccc21 ZINC000338277712 519175922 /nfs/dbraw/zinc/17/59/22/519175922.db2.gz GGDHUBTWWKNEIL-GOSISDBHSA-N 1 2 324.472 4.075 20 0 DIADLO CC(C)(C)n1ncnc1C[N@H+](C1CC1)[C@H]1CCCc2ccccc21 ZINC000338277716 519176830 /nfs/dbraw/zinc/17/68/30/519176830.db2.gz GGDHUBTWWKNEIL-SFHVURJKSA-N 1 2 324.472 4.075 20 0 DIADLO CC(C)(C)n1ncnc1C[N@@H+](C1CC1)[C@H]1CCCc2ccccc21 ZINC000338277716 519176836 /nfs/dbraw/zinc/17/68/36/519176836.db2.gz GGDHUBTWWKNEIL-SFHVURJKSA-N 1 2 324.472 4.075 20 0 DIADLO CC(C)[N@H+](Cc1cccs1)Cc1nc(C2CCCC2)no1 ZINC000336839402 519662066 /nfs/dbraw/zinc/66/20/66/519662066.db2.gz TUENEQBMULSVMG-UHFFFAOYSA-N 1 2 305.447 4.199 20 0 DIADLO CC(C)[N@@H+](Cc1cccs1)Cc1nc(C2CCCC2)no1 ZINC000336839402 519662069 /nfs/dbraw/zinc/66/20/69/519662069.db2.gz TUENEQBMULSVMG-UHFFFAOYSA-N 1 2 305.447 4.199 20 0 DIADLO CC(C)C[N@H+](Cc1nccn1C(C)C)Cc1ccccc1F ZINC000337349835 519718526 /nfs/dbraw/zinc/71/85/26/519718526.db2.gz QSUQHLHSXIHEPI-UHFFFAOYSA-N 1 2 303.425 4.261 20 0 DIADLO CC(C)C[N@@H+](Cc1nccn1C(C)C)Cc1ccccc1F ZINC000337349835 519718528 /nfs/dbraw/zinc/71/85/28/519718528.db2.gz QSUQHLHSXIHEPI-UHFFFAOYSA-N 1 2 303.425 4.261 20 0 DIADLO CC(=O)Nc1cccc([C@@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)c1 ZINC000182954717 519747610 /nfs/dbraw/zinc/74/76/10/519747610.db2.gz DKCVFANCXKOVGG-CQSZACIVSA-N 1 2 323.440 4.201 20 0 DIADLO CC(=O)Nc1cccc([C@@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)c1 ZINC000182954717 519747613 /nfs/dbraw/zinc/74/76/13/519747613.db2.gz DKCVFANCXKOVGG-CQSZACIVSA-N 1 2 323.440 4.201 20 0 DIADLO CC(C)OCCCC(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000182506346 519758387 /nfs/dbraw/zinc/75/83/87/519758387.db2.gz HPXMGVOBTOQKHV-UHFFFAOYSA-N 1 2 314.385 4.018 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1F ZINC000180264022 519799353 /nfs/dbraw/zinc/79/93/53/519799353.db2.gz FOYQSAVCYOFJOD-OAHLLOKOSA-N 1 2 323.799 4.226 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ccc(Cl)cc1F)c1nc(C2CC2)no1 ZINC000189172485 519820912 /nfs/dbraw/zinc/82/09/12/519820912.db2.gz HQVMRPDTTMJYHX-AWEZNQCLSA-N 1 2 323.799 4.226 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)no1 ZINC000182579304 519863686 /nfs/dbraw/zinc/86/36/86/519863686.db2.gz XSURBTHIDZFEMG-MRXNPFEDSA-N 1 2 319.836 4.477 20 0 DIADLO CC(C)c1nc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccnc2)cs1 ZINC000363812415 519863878 /nfs/dbraw/zinc/86/38/78/519863878.db2.gz DAFPQAVYVDJHHS-CJNGLKHVSA-N 1 2 301.459 4.245 20 0 DIADLO CC(C)c1nc(C[N@H+]2C[C@H](C)C[C@H]2c2cccnc2)cs1 ZINC000363812415 519863880 /nfs/dbraw/zinc/86/38/80/519863880.db2.gz DAFPQAVYVDJHHS-CJNGLKHVSA-N 1 2 301.459 4.245 20 0 DIADLO CC(C)c1noc(C[NH2+]C(C)(c2ccccc2)c2ccccc2)n1 ZINC000182188716 519905184 /nfs/dbraw/zinc/90/51/84/519905184.db2.gz IZBVBMQIGCHVQZ-UHFFFAOYSA-N 1 2 321.424 4.246 20 0 DIADLO CC(F)(F)c1cccc(NCc2ccc(N3CCCC3)[nH+]c2)c1 ZINC000189548008 520175073 /nfs/dbraw/zinc/17/50/73/520175073.db2.gz INAZZEKBJPECNS-UHFFFAOYSA-N 1 2 317.383 4.406 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+]Cc2ncc(C)o2)cc1OC ZINC000180341898 520895073 /nfs/dbraw/zinc/89/50/73/520895073.db2.gz XRDYAAXNEWXMLN-CQSZACIVSA-N 1 2 318.417 4.021 20 0 DIADLO CCCC[C@@H]1CCC[C@H]1NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000247576482 521113975 /nfs/dbraw/zinc/11/39/75/521113975.db2.gz HWHXDGQKVHEMRC-OAGGEKHMSA-N 1 2 318.465 4.005 20 0 DIADLO CCC[C@H]([NH2+]Cc1nccn1C(C)C)c1ccc(F)cc1F ZINC000181669546 521166662 /nfs/dbraw/zinc/16/66/62/521166662.db2.gz RCZBQGOQGRELGC-INIZCTEOSA-N 1 2 307.388 4.373 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1cccc(F)c1Br ZINC000158081594 521396956 /nfs/dbraw/zinc/39/69/56/521396956.db2.gz PCOYCEWQFFFKHU-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1cccc(F)c1Br ZINC000158081594 521396962 /nfs/dbraw/zinc/39/69/62/521396962.db2.gz PCOYCEWQFFFKHU-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CCCc1occc1C(=O)Nc1ccc2[nH+]c(N(C)C)ccc2c1 ZINC000336910479 521610587 /nfs/dbraw/zinc/61/05/87/521610587.db2.gz IJMKQOHADCWQPW-UHFFFAOYSA-N 1 2 323.396 4.099 20 0 DIADLO CN(C)c1cc(Cl)cc(Cl)c1C[N@H+](C)Cc1ccncc1 ZINC000356407597 522120288 /nfs/dbraw/zinc/12/02/88/522120288.db2.gz ICJXVXKEXPZNCF-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1cc(Cl)cc(Cl)c1C[N@@H+](C)Cc1ccncc1 ZINC000356407597 522120291 /nfs/dbraw/zinc/12/02/91/522120291.db2.gz ICJXVXKEXPZNCF-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CCc1nc(C[NH2+][C@@H](c2cccc(Cl)c2)C2CCCC2)no1 ZINC000181042486 522347501 /nfs/dbraw/zinc/34/75/01/522347501.db2.gz ISDYEBDFXKVUDY-QGZVFWFLSA-N 1 2 319.836 4.307 20 0 DIADLO CCc1nc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCCC2)no1 ZINC000182544925 522349549 /nfs/dbraw/zinc/34/95/49/522349549.db2.gz HKODMMRFSRIULU-QGZVFWFLSA-N 1 2 319.836 4.307 20 0 DIADLO COC[C@@H]([NH2+]Cc1csc(C2CCCC2)n1)c1ccccc1 ZINC000181663671 522368973 /nfs/dbraw/zinc/36/89/73/522368973.db2.gz QOXRCVMJLDDZFX-QGZVFWFLSA-N 1 2 316.470 4.278 20 0 DIADLO COC(=O)c1oc([C@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)cc1C ZINC000181954116 522410544 /nfs/dbraw/zinc/41/05/44/522410544.db2.gz SCBRHBCRLGBWMM-QWRGUYRKSA-N 1 2 323.339 4.065 20 0 DIADLO COc1cc(Cl)c(C[NH2+][C@H](C)c2ncc(C)o2)cc1Cl ZINC000337246741 522522318 /nfs/dbraw/zinc/52/23/18/522522318.db2.gz HUBKYBSNHCUJQV-SECBINFHSA-N 1 2 315.200 4.149 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(Br)o1)c1nc(C)cs1 ZINC000190970587 522641542 /nfs/dbraw/zinc/64/15/42/522641542.db2.gz VLGOXIYRTGDOMR-JTQLQIEISA-N 1 2 315.236 4.048 20 0 DIADLO COC[C@H]([NH2+]Cc1csc(C2CCCC2)n1)c1ccccc1 ZINC000181663655 522754081 /nfs/dbraw/zinc/75/40/81/522754081.db2.gz QOXRCVMJLDDZFX-KRWDZBQOSA-N 1 2 316.470 4.278 20 0 DIADLO COC[C@H]([NH2+][C@@H](CC(C)C)c1ccccn1)c1ccc(C)o1 ZINC000182229202 522762867 /nfs/dbraw/zinc/76/28/67/522762867.db2.gz TZOKPFJOVXVZHE-IRXDYDNUSA-N 1 2 302.418 4.048 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1cc(Cl)ccc1OC)c1ccc(C)o1 ZINC000156503768 522765805 /nfs/dbraw/zinc/76/58/05/522765805.db2.gz VXKPBMGEQXVNLO-DOMZBBRYSA-N 1 2 323.820 4.288 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nc(C(C)C)no1)c1ccc(OC)cc1 ZINC000181828324 522941102 /nfs/dbraw/zinc/94/11/02/522941102.db2.gz JFCFIUATQXQFCB-IUODEOHRSA-N 1 2 303.406 4.004 20 0 DIADLO CC[C@H](c1ccccc1)[S@](=O)Cc1cn2cccc(C)c2[nH+]1 ZINC000176517388 522950633 /nfs/dbraw/zinc/95/06/33/522950633.db2.gz KXXCSAHETIDZIL-VGOFRKELSA-N 1 2 312.438 4.043 20 0 DIADLO CC[C@@H](Nc1ccc(N2CCCC2)c(Cl)c1)c1[nH+]ccn1C ZINC000183012561 522957823 /nfs/dbraw/zinc/95/78/23/522957823.db2.gz VAEAXLSJYACEKB-OAHLLOKOSA-N 1 2 318.852 4.237 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155723746 523119667 /nfs/dbraw/zinc/11/96/67/523119667.db2.gz AIODGZJPNZXCHW-INIZCTEOSA-N 1 2 324.453 4.183 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000155723746 523119677 /nfs/dbraw/zinc/11/96/77/523119677.db2.gz AIODGZJPNZXCHW-INIZCTEOSA-N 1 2 324.453 4.183 20 0 DIADLO COCc1nc(C[NH2+][C@H](C)c2oc3ccccc3c2C)cs1 ZINC000266173763 523207578 /nfs/dbraw/zinc/20/75/78/523207578.db2.gz DFSJVDFRUMBPFD-GFCCVEGCSA-N 1 2 316.426 4.195 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc(C(F)(F)F)cs1)c1nccs1 ZINC000157617568 523492190 /nfs/dbraw/zinc/49/21/90/523492190.db2.gz NLHCUZJLJRBZAS-NSHDSACASA-N 1 2 321.393 4.033 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1csc(C(C)C)n1 ZINC000339151119 523558375 /nfs/dbraw/zinc/55/83/75/523558375.db2.gz ZLIVTTRSDARHNZ-OAHLLOKOSA-N 1 2 318.490 4.210 20 0 DIADLO COC(=O)[C@@H](c1ccsc1)[N@@H+]1CCC[C@H]1c1ccc(C)s1 ZINC000337190419 523658707 /nfs/dbraw/zinc/65/87/07/523658707.db2.gz RVPTXKIHGFRLKO-DZGCQCFKSA-N 1 2 321.467 4.169 20 0 DIADLO COC(=O)[C@@H](c1ccsc1)[N@H+]1CCC[C@H]1c1ccc(C)s1 ZINC000337190419 523658717 /nfs/dbraw/zinc/65/87/17/523658717.db2.gz RVPTXKIHGFRLKO-DZGCQCFKSA-N 1 2 321.467 4.169 20 0 DIADLO CC[C@@]1(C)CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000337967484 523712295 /nfs/dbraw/zinc/71/22/95/523712295.db2.gz GCUOZWJNWOFLHK-IBGZPJMESA-N 1 2 310.397 4.136 20 0 DIADLO CO[C@H](C)c1noc(C[N@H+](C)[C@H](C)c2ccc(C(C)C)cc2)n1 ZINC000267037674 523919577 /nfs/dbraw/zinc/91/95/77/523919577.db2.gz OBAJQKICKXSVKW-ZIAGYGMSSA-N 1 2 317.433 4.093 20 0 DIADLO CO[C@H](C)c1noc(C[N@@H+](C)[C@H](C)c2ccc(C(C)C)cc2)n1 ZINC000267037674 523919582 /nfs/dbraw/zinc/91/95/82/523919582.db2.gz OBAJQKICKXSVKW-ZIAGYGMSSA-N 1 2 317.433 4.093 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cccc(Cl)c2Cl)nc1 ZINC000338251094 524007528 /nfs/dbraw/zinc/00/75/28/524007528.db2.gz CFYHYLBXBWXSGE-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)nc1 ZINC000338251094 524007529 /nfs/dbraw/zinc/00/75/29/524007529.db2.gz CFYHYLBXBWXSGE-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@H+](C)[C@@H](C)c2ccco2)c(Cl)c1OC ZINC000131142006 524009957 /nfs/dbraw/zinc/00/99/57/524009957.db2.gz DOBAUBOTQZUVPY-NSHDSACASA-N 1 2 309.793 4.143 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccco2)c(Cl)c1OC ZINC000131142006 524009961 /nfs/dbraw/zinc/00/99/61/524009961.db2.gz DOBAUBOTQZUVPY-NSHDSACASA-N 1 2 309.793 4.143 20 0 DIADLO COc1cccc([C@H](C)[NH2+][C@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000267017532 524156298 /nfs/dbraw/zinc/15/62/98/524156298.db2.gz IMALZZDJPCXDJM-QWHCGFSZSA-N 1 2 302.418 4.393 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)co1 ZINC000188220973 524163487 /nfs/dbraw/zinc/16/34/87/524163487.db2.gz IGNSYGVSGITMQE-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO C[C@@H]1CCCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000264831584 524213499 /nfs/dbraw/zinc/21/34/99/524213499.db2.gz ADLFTWLWQMBYMI-OAHLLOKOSA-N 1 2 310.397 4.136 20 0 DIADLO Cc1cccc(C)c1C[NH2+]C1(c2noc(C3CC3)n2)CCCC1 ZINC000266235035 524259161 /nfs/dbraw/zinc/25/91/61/524259161.db2.gz UHJPCBCHXIFZMV-UHFFFAOYSA-N 1 2 311.429 4.123 20 0 DIADLO COc1ccc(F)c(CNc2c[nH+]ccc2OC(C)(C)C)c1 ZINC000339322183 524284395 /nfs/dbraw/zinc/28/43/95/524284395.db2.gz WAHWQDFSOXJSKI-UHFFFAOYSA-N 1 2 304.365 4.019 20 0 DIADLO Cc1ccc(CCCC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000338269384 524313267 /nfs/dbraw/zinc/31/32/67/524313267.db2.gz DWOWCYGUPCKVCY-UHFFFAOYSA-N 1 2 319.408 4.142 20 0 DIADLO Cc1cccc(C[NH2+][C@H](C)c2nccs2)c1Br ZINC000191540833 524441204 /nfs/dbraw/zinc/44/12/04/524441204.db2.gz JNXRWPKESGDTAN-SNVBAGLBSA-N 1 2 311.248 4.065 20 0 DIADLO Cc1cccc(NC2CCN(c3cc[nH+]c4ccncc43)CC2)c1 ZINC000267927966 524671924 /nfs/dbraw/zinc/67/19/24/524671924.db2.gz DVCTWEPIDWPRHW-UHFFFAOYSA-N 1 2 318.424 4.019 20 0 DIADLO COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nc(C(C)C)no1 ZINC000181703141 524788570 /nfs/dbraw/zinc/78/85/70/524788570.db2.gz ZQYTVFNNLPDIPS-HNNXBMFYSA-N 1 2 317.433 4.079 20 0 DIADLO COc1ccc(OC)c(C[NH2+][C@@H](C)c2csc(C(C)C)n2)c1 ZINC000124360354 524839999 /nfs/dbraw/zinc/83/99/99/524839999.db2.gz GYVWRVRCSNFSPG-LBPRGKRZSA-N 1 2 320.458 4.135 20 0 DIADLO C[C@@H]1CN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C(C)(C)C1 ZINC000266880158 524874221 /nfs/dbraw/zinc/87/42/21/524874221.db2.gz ADLZMHUYXMCWOR-AWEZNQCLSA-N 1 2 310.397 4.135 20 0 DIADLO Cc1ccccc1-c1noc([C@@H](C)[N@H+](C)Cc2cccs2)n1 ZINC000266737792 525020415 /nfs/dbraw/zinc/02/04/15/525020415.db2.gz PJOYGCMGCQJSCI-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccccc1-c1noc([C@@H](C)[N@@H+](C)Cc2cccs2)n1 ZINC000266737792 525020427 /nfs/dbraw/zinc/02/04/27/525020427.db2.gz PJOYGCMGCQJSCI-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000124456105 525159489 /nfs/dbraw/zinc/15/94/89/525159489.db2.gz HRODIMLDEBOUGK-KGLIPLIRSA-N 1 2 323.396 4.157 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000124456566 525163436 /nfs/dbraw/zinc/16/34/36/525163436.db2.gz HRODIMLDEBOUGK-ZIAGYGMSSA-N 1 2 323.396 4.157 20 0 DIADLO Cc1cc(NCc2csc(-c3ccco3)n2)nc(C(C)C)[nH+]1 ZINC000154885464 525282673 /nfs/dbraw/zinc/28/26/73/525282673.db2.gz WBXZMFBRHXKKLP-UHFFFAOYSA-N 1 2 314.414 4.237 20 0 DIADLO Cc1ccccc1[C@H](C)[NH2+][C@H](C)c1noc(-c2ccccc2)n1 ZINC000124422728 525416732 /nfs/dbraw/zinc/41/67/32/525416732.db2.gz IIBNAJRTICDVJP-LSDHHAIUSA-N 1 2 307.397 4.457 20 0 DIADLO Cc1ccccc1[C@H]([NH2+]Cc1noc(C(C)C)n1)C(C)(C)C ZINC000180088445 525429348 /nfs/dbraw/zinc/42/93/48/525429348.db2.gz VITFNWJYACQDHZ-INIZCTEOSA-N 1 2 301.434 4.378 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nc(-c3cccs3)no2)c(C)s1 ZINC000182981409 525467549 /nfs/dbraw/zinc/46/75/49/525467549.db2.gz UBZCOMPZCPCUPY-SNVBAGLBSA-N 1 2 319.455 4.327 20 0 DIADLO C[C@H]([NH2+]Cc1nc2cc(C(F)(F)F)ccc2o1)c1cccnc1 ZINC000182886622 525485691 /nfs/dbraw/zinc/48/56/91/525485691.db2.gz PCZZQIOHNHBZQT-JTQLQIEISA-N 1 2 321.302 4.092 20 0 DIADLO C[C@@H]1C[C@H]1[C@H]([NH2+]Cc1noc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000180029206 525501758 /nfs/dbraw/zinc/50/17/58/525501758.db2.gz OZUKFESVGBIESG-QSGSBWRWSA-N 1 2 317.820 4.087 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(F)c1)c1nc(C2CCCCC2)no1 ZINC000173866890 525534156 /nfs/dbraw/zinc/53/41/56/525534156.db2.gz QLVJHNQAZDNECY-GFCCVEGCSA-N 1 2 303.381 4.107 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1ccccn1 ZINC000181810727 525557426 /nfs/dbraw/zinc/55/74/26/525557426.db2.gz RQVLBJYZYBXZOC-CYBMUJFWSA-N 1 2 301.459 4.437 20 0 DIADLO C[C@@H]([NH2+]Cc1nccs1)c1cc(Cl)ccc1OC(F)F ZINC000128207844 525564477 /nfs/dbraw/zinc/56/44/77/525564477.db2.gz MLSLQYICBYAIQJ-MRVPVSSYSA-N 1 2 318.776 4.249 20 0 DIADLO C[C@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1ccccc1Cl ZINC000267289542 525595121 /nfs/dbraw/zinc/59/51/21/525595121.db2.gz XICBRPOXVBRESM-ZUZCIYMTSA-N 1 2 311.759 4.002 20 0 DIADLO Cc1ccnc(C[N@H+](Cc2ccccc2)Cc2ccccc2C)n1 ZINC000339588886 525643885 /nfs/dbraw/zinc/64/38/85/525643885.db2.gz DAFYWIOPSGUMRG-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO Cc1ccnc(C[N@@H+](Cc2ccccc2)Cc2ccccc2C)n1 ZINC000339588886 525643897 /nfs/dbraw/zinc/64/38/97/525643897.db2.gz DAFYWIOPSGUMRG-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccncc1F)c1nc(C(F)(F)F)cs1 ZINC000338012526 525664422 /nfs/dbraw/zinc/66/44/22/525664422.db2.gz ROPLMEJSNNYYCA-HTQZYQBOSA-N 1 2 319.327 4.108 20 0 DIADLO COc1ccc2oc(C[NH2+]Cc3nc(C(C)C)cs3)cc2c1 ZINC000126812357 525687801 /nfs/dbraw/zinc/68/78/01/525687801.db2.gz XQKBFONEJNEYJK-UHFFFAOYSA-N 1 2 316.426 4.311 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2ccccc21)c1noc(-c2ccccc2)n1 ZINC000124304165 525693763 /nfs/dbraw/zinc/69/37/63/525693763.db2.gz VRECXTYUURBZLK-DYVFJYSZSA-N 1 2 305.381 4.075 20 0 DIADLO C[C@@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1ccncc1 ZINC000182884553 525700530 /nfs/dbraw/zinc/70/05/30/525700530.db2.gz LKANDUBGQIHHLT-OAHLLOKOSA-N 1 2 318.424 4.455 20 0 DIADLO Cc1ccc(-c2cc(C[N@H+](Cc3ccccn3)C3CC3)on2)cc1 ZINC000180862449 525732233 /nfs/dbraw/zinc/73/22/33/525732233.db2.gz MVEKWMYPSMPZJH-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1ccc(-c2cc(C[N@@H+](Cc3ccccn3)C3CC3)on2)cc1 ZINC000180862449 525732238 /nfs/dbraw/zinc/73/22/38/525732238.db2.gz MVEKWMYPSMPZJH-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2c(F)cccc2Cl)s1 ZINC000339220626 525752564 /nfs/dbraw/zinc/75/25/64/525752564.db2.gz OHTGWOAZQBYUSH-UHFFFAOYSA-N 1 2 316.854 4.088 20 0 DIADLO Cc1ccsc1C[NH2+][C@H](C)c1nc(C2CCCCC2)no1 ZINC000237373329 525861752 /nfs/dbraw/zinc/86/17/52/525861752.db2.gz RTIWIQUEGDPIKK-GFCCVEGCSA-N 1 2 305.447 4.338 20 0 DIADLO Cc1cn2cc(NC(=O)c3cccc(C4CCC4)c3)ccc2[nH+]1 ZINC000336948925 525950304 /nfs/dbraw/zinc/95/03/04/525950304.db2.gz OPESOQGHPVLEFZ-UHFFFAOYSA-N 1 2 305.381 4.163 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H](C)Cc2ccccc2)[nH+]1 ZINC000366027567 525961897 /nfs/dbraw/zinc/96/18/97/525961897.db2.gz ZWOWSTXBYWKJDE-AWEZNQCLSA-N 1 2 319.408 4.202 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc(C)cc2C)[nH+]1 ZINC000366354305 525962883 /nfs/dbraw/zinc/96/28/83/525962883.db2.gz IMLMTUYRQVKQBR-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO Cc1cnc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)o1 ZINC000179999306 526036611 /nfs/dbraw/zinc/03/66/11/526036611.db2.gz MOOHRJUGQZRIDL-UHFFFAOYSA-N 1 2 310.319 4.171 20 0 DIADLO Cc1cnc(C[NH2+]C(c2cccc(C)c2)c2cccc(C)c2)o1 ZINC000128049792 526037466 /nfs/dbraw/zinc/03/74/66/526037466.db2.gz MMUWIRBYOLFUTP-UHFFFAOYSA-N 1 2 306.409 4.479 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)no1 ZINC000299047750 534901231 /nfs/dbraw/zinc/90/12/31/534901231.db2.gz FSWJPKTYQXHMOA-OAHLLOKOSA-N 1 2 319.424 4.383 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCCOCC(C)C ZINC000336978019 526077575 /nfs/dbraw/zinc/07/75/75/526077575.db2.gz ZGFMUEBVWSUXPS-UHFFFAOYSA-N 1 2 304.459 4.087 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1ccccc1Br ZINC000267085557 526112907 /nfs/dbraw/zinc/11/29/07/526112907.db2.gz SGNWCBKFINLNRX-LBPRGKRZSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccccc1Br ZINC000267085557 526112916 /nfs/dbraw/zinc/11/29/16/526112916.db2.gz SGNWCBKFINLNRX-LBPRGKRZSA-N 1 2 305.219 4.037 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cn(-c3ccccc3)nc2C(C)C)o1 ZINC000337211724 526159252 /nfs/dbraw/zinc/15/92/52/526159252.db2.gz AQOKESIUHAPFRY-HNNXBMFYSA-N 1 2 324.428 4.143 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000181148670 526175027 /nfs/dbraw/zinc/17/50/27/526175027.db2.gz HOINRZSFQVJHKF-WFASDCNBSA-N 1 2 314.410 4.024 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000181148670 526175035 /nfs/dbraw/zinc/17/50/35/526175035.db2.gz HOINRZSFQVJHKF-WFASDCNBSA-N 1 2 314.410 4.024 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1CCc2c(cccc2C(C)C)C1 ZINC000189826907 526238889 /nfs/dbraw/zinc/23/88/89/526238889.db2.gz WKPHVCMZTNXYFF-UHFFFAOYSA-N 1 2 309.413 4.104 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1cc(-c2ccc(Cl)s2)on1 ZINC000107288150 526240463 /nfs/dbraw/zinc/24/04/63/526240463.db2.gz HOLWIYDXHWERLH-UHFFFAOYSA-N 1 2 319.773 4.012 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@H](OC1CCCC1)c1ccccc1 ZINC000107286633 526240767 /nfs/dbraw/zinc/24/07/67/526240767.db2.gz AHURRCUJKKAGSV-GOSISDBHSA-N 1 2 310.397 4.029 20 0 DIADLO Cc1coc(-c2ccc(C)c(NCc3[nH+]ccn3C(C)C)c2)n1 ZINC000127901899 526272769 /nfs/dbraw/zinc/27/27/69/526272769.db2.gz FIAMFJFHLIWFNQ-UHFFFAOYSA-N 1 2 310.401 4.348 20 0 DIADLO Oc1cccc(C[NH2+][C@@H]2CCCOc3ccc(F)cc32)c1Cl ZINC000339205952 526361357 /nfs/dbraw/zinc/36/13/57/526361357.db2.gz NGAAZAHTQZEMSD-CQSZACIVSA-N 1 2 321.779 4.188 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2noc(C3CC3)n2)C2CCCC2)cc1 ZINC000180280072 526366797 /nfs/dbraw/zinc/36/67/97/526366797.db2.gz HFJADDQENLQFIJ-QGZVFWFLSA-N 1 2 315.392 4.107 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+][C@@H](c1ncc[nH]1)c1ccccc1)CCC2 ZINC000127801334 526373368 /nfs/dbraw/zinc/37/33/68/526373368.db2.gz AOVUCWLLNFIMBN-RTBURBONSA-N 1 2 321.399 4.305 20 0 DIADLO Fc1cccc(C[N@@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)c1Cl ZINC000339202739 526385139 /nfs/dbraw/zinc/38/51/39/526385139.db2.gz QFHRARSGUNIXAY-GDBMZVCRSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cccc(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)c1Cl ZINC000339202739 526385143 /nfs/dbraw/zinc/38/51/43/526385143.db2.gz QFHRARSGUNIXAY-GDBMZVCRSA-N 1 2 309.812 4.013 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)o1 ZINC000180264459 526396830 /nfs/dbraw/zinc/39/68/30/526396830.db2.gz CZCBCUOHHMYDDX-YMTOWFKASA-N 1 2 311.788 4.218 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)o1 ZINC000180021008 526397167 /nfs/dbraw/zinc/39/71/67/526397167.db2.gz CSXABLUCWCKPEQ-UNNXFLIFSA-N 1 2 305.809 4.079 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CCc3c(cccc3C(C)C)C2)s1 ZINC000338359424 526404345 /nfs/dbraw/zinc/40/43/45/526404345.db2.gz MRXRBSMAEAAWHV-LBPRGKRZSA-N 1 2 301.459 4.089 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CCc3c(cccc3C(C)C)C2)s1 ZINC000338359424 526404347 /nfs/dbraw/zinc/40/43/47/526404347.db2.gz MRXRBSMAEAAWHV-LBPRGKRZSA-N 1 2 301.459 4.089 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCc4ccsc4C3)cs2)co1 ZINC000132499376 526414834 /nfs/dbraw/zinc/41/48/34/526414834.db2.gz VIEFALFMMHINTL-UHFFFAOYSA-N 1 2 302.424 4.023 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCc4ccsc4C3)cs2)co1 ZINC000132499376 526414838 /nfs/dbraw/zinc/41/48/38/526414838.db2.gz VIEFALFMMHINTL-UHFFFAOYSA-N 1 2 302.424 4.023 20 0 DIADLO Cc1noc(C)c1C[N@@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000338369707 526505397 /nfs/dbraw/zinc/50/53/97/526505397.db2.gz KCTDMHNABFLCCS-INIZCTEOSA-N 1 2 308.784 4.016 20 0 DIADLO Cc1noc(C)c1C[N@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000338369707 526505404 /nfs/dbraw/zinc/50/54/04/526505404.db2.gz KCTDMHNABFLCCS-INIZCTEOSA-N 1 2 308.784 4.016 20 0 DIADLO c1ccc2c(c1)NCCC[C@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000193102202 526509958 /nfs/dbraw/zinc/50/99/58/526509958.db2.gz ZWFHLXTZZDMBMR-GOSISDBHSA-N 1 2 308.429 4.041 20 0 DIADLO c1cncc([C@@H]2CCC[C@H](Nc3ccc(N4CCCC4)c[nH+]3)C2)c1 ZINC000337372521 526548877 /nfs/dbraw/zinc/54/88/77/526548877.db2.gz DIVWWQCXMGPXHL-AEFFLSMTSA-N 1 2 322.456 4.215 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@@H]1CCc2ccc(-c3ccccc3)cc21 ZINC000189576658 526554914 /nfs/dbraw/zinc/55/49/14/526554914.db2.gz LBVZHUKIBKMMJL-HXUWFJFHSA-N 1 2 303.409 4.162 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@H](c1ccc(C(F)(F)F)cc1)C(C)C ZINC000130372015 526555965 /nfs/dbraw/zinc/55/59/65/526555965.db2.gz PXRHPOTZSMNVCN-HNNXBMFYSA-N 1 2 311.351 4.224 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)Cc3cccc(F)c3)c2)[nH+]c1C ZINC000365101511 526588048 /nfs/dbraw/zinc/58/80/48/526588048.db2.gz SRKBKAVPVWALOL-UHFFFAOYSA-N 1 2 323.371 4.014 20 0 DIADLO c1sc(C2CCCC2)nc1C[N@H+](Cc1ccncc1)C1CC1 ZINC000180754319 526631031 /nfs/dbraw/zinc/63/10/31/526631031.db2.gz WZJWLZGGCKQTGA-UHFFFAOYSA-N 1 2 313.470 4.360 20 0 DIADLO c1sc(C2CCCC2)nc1C[N@@H+](Cc1ccncc1)C1CC1 ZINC000180754319 526631036 /nfs/dbraw/zinc/63/10/36/526631036.db2.gz WZJWLZGGCKQTGA-UHFFFAOYSA-N 1 2 313.470 4.360 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+](C)[C@H](C)c1ccncc1 ZINC000127655311 526740788 /nfs/dbraw/zinc/74/07/88/526740788.db2.gz ZPLDAKUXNIFJQH-CQSZACIVSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+](C)[C@H](C)c1ccncc1 ZINC000127655311 526740792 /nfs/dbraw/zinc/74/07/92/526740792.db2.gz ZPLDAKUXNIFJQH-CQSZACIVSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)oc1C ZINC000182518649 526891630 /nfs/dbraw/zinc/89/16/30/526891630.db2.gz AZSGKAZUTJGPIV-JTQLQIEISA-N 1 2 314.307 4.041 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccc(-c3cccnc3)cc2)oc1C ZINC000181314827 526893491 /nfs/dbraw/zinc/89/34/91/526893491.db2.gz OXAJUDIVBIFLDW-CQSZACIVSA-N 1 2 307.397 4.204 20 0 DIADLO Cc1nc([C@@H]([NH2+]C2CCCCC2)c2ccc(Cl)cc2)no1 ZINC000182682149 527039360 /nfs/dbraw/zinc/03/93/60/527039360.db2.gz UYKQARSHSGACPH-HNNXBMFYSA-N 1 2 305.809 4.043 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2cn(C(C)(C)C)nc2C)cs1 ZINC000268962055 527065948 /nfs/dbraw/zinc/06/59/48/527065948.db2.gz XOBDTAMOXQHAPW-JQWIXIFHSA-N 1 2 306.479 4.123 20 0 DIADLO Cc1[nH]c(C(=O)N[C@@H](C)c2ccc(Oc3ccccc3)cc2)c[nH+]1 ZINC000339226434 527238739 /nfs/dbraw/zinc/23/87/39/527238739.db2.gz HGLNFIRXOIMURV-ZDUSSCGKSA-N 1 2 321.380 4.001 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1cccc(C2CCC2)c1 ZINC000336904631 527404579 /nfs/dbraw/zinc/40/45/79/527404579.db2.gz YZPMZIDBDHNVQI-UHFFFAOYSA-N 1 2 317.392 4.392 20 0 DIADLO Cc1nccnc1[C@@H](C)[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000188185719 527454628 /nfs/dbraw/zinc/45/46/28/527454628.db2.gz PSRBQPQCRLOTLY-KGLIPLIRSA-N 1 2 324.453 4.320 20 0 DIADLO Cn1cc[nH+]c1[C@H](Nc1cccc(-c2nccs2)c1)C1CC1 ZINC000128964893 527466770 /nfs/dbraw/zinc/46/67/70/527466770.db2.gz KTWKNIQVBDKNQL-OAHLLOKOSA-N 1 2 310.426 4.107 20 0 DIADLO Cn1c[nH+]cc1CNc1ccc(OC2CCCC2)c(Cl)c1 ZINC000157349108 527511140 /nfs/dbraw/zinc/51/11/40/527511140.db2.gz ZUAFZCSWKDUPDU-UHFFFAOYSA-N 1 2 305.809 4.007 20 0 DIADLO FC(F)(F)c1csc(C[N@H+](Cc2cccs2)C2CC2)n1 ZINC000130909245 527689719 /nfs/dbraw/zinc/68/97/19/527689719.db2.gz UTWYKMRHSLOIQI-UHFFFAOYSA-N 1 2 318.389 4.388 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+](Cc2cccs2)C2CC2)n1 ZINC000130909245 527689720 /nfs/dbraw/zinc/68/97/20/527689720.db2.gz UTWYKMRHSLOIQI-UHFFFAOYSA-N 1 2 318.389 4.388 20 0 DIADLO FC(F)(F)c1cscc1C[N@@H+]1CCc2sccc2C1 ZINC000356057695 527690090 /nfs/dbraw/zinc/69/00/90/527690090.db2.gz OAFKBJVONYVPOG-UHFFFAOYSA-N 1 2 303.374 4.387 20 0 DIADLO FC(F)(F)c1cscc1C[N@H+]1CCc2sccc2C1 ZINC000356057695 527690093 /nfs/dbraw/zinc/69/00/93/527690093.db2.gz OAFKBJVONYVPOG-UHFFFAOYSA-N 1 2 303.374 4.387 20 0 DIADLO CC(C)CC[C@H]1CCC[C@@H]1[NH2+]Cc1nc(=O)c2sccc2[nH]1 ZINC000298480978 534957242 /nfs/dbraw/zinc/95/72/42/534957242.db2.gz JEIOWHIYUUAAHO-OLZOCXBDSA-N 1 2 319.474 4.091 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1ccc(Cl)s1 ZINC000273480305 535808800 /nfs/dbraw/zinc/80/88/00/535808800.db2.gz HZGJBKHRGKTHES-PSASIEDQSA-N 1 2 311.838 4.464 20 0 DIADLO CCc1ccc(NCc2[nH+]ccn2CC(F)(F)F)cc1Cl ZINC000285115497 536189945 /nfs/dbraw/zinc/18/99/45/536189945.db2.gz MVMNETWIVAKMPB-UHFFFAOYSA-N 1 2 317.742 4.273 20 0 DIADLO COc1ccc([NH2+]C[C@@H]2CC(C)=C[C@@H](C)C2)cc1NC(C)=O ZINC000289428064 536815617 /nfs/dbraw/zinc/81/56/17/536815617.db2.gz DJBNJSNAWRRBID-DOMZBBRYSA-N 1 2 302.418 4.058 20 0 DIADLO COCC[C@H]([NH2+][C@H](C)c1nc2c(s1)CCCC2)c1ccco1 ZINC000272540118 536819668 /nfs/dbraw/zinc/81/96/68/536819668.db2.gz KNBZVKREFMMWPX-OLZOCXBDSA-N 1 2 320.458 4.043 20 0 DIADLO CC(C)c1cc([C@H]2CCC[N@@H+](C/C(Cl)=C\Cl)C2)[nH]n1 ZINC000879920103 1044000840 /nfs/dbraw/zinc/00/08/40/1044000840.db2.gz WCRRWUARVPQRHK-WBOGTDJTSA-N 1 2 302.249 4.032 20 0 DIADLO Cc1cc(Br)c(F)cc1C[N@@H+]1C[C@@H](C)C[C@H]1CF ZINC001140791740 1046900321 /nfs/dbraw/zinc/90/03/21/1046900321.db2.gz VZRPQAXHEIBLKF-CABZTGNLSA-N 1 2 318.205 4.077 20 0 DIADLO Cc1cc(Br)c(F)cc1C[N@H+]1C[C@@H](C)C[C@H]1CF ZINC001140791740 1046900333 /nfs/dbraw/zinc/90/03/33/1046900333.db2.gz VZRPQAXHEIBLKF-CABZTGNLSA-N 1 2 318.205 4.077 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CC[C@@]1(C)O ZINC001235592620 1054752039 /nfs/dbraw/zinc/75/20/39/1054752039.db2.gz SHPJMEUWIXAGLY-YMTOWFKASA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CC[C@@]1(C)O ZINC001235592620 1054752056 /nfs/dbraw/zinc/75/20/56/1054752056.db2.gz SHPJMEUWIXAGLY-YMTOWFKASA-N 1 2 322.663 4.240 20 0 DIADLO Clc1ccccc1C[NH2+]Cc1csc(-c2ccccn2)n1 ZINC000035054520 1035534688 /nfs/dbraw/zinc/53/46/88/1035534688.db2.gz MUBRSYMKKUOBGX-UHFFFAOYSA-N 1 2 315.829 4.148 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1c(F)c(F)c(N)c(F)c1F ZINC001213501408 1035572645 /nfs/dbraw/zinc/57/26/45/1035572645.db2.gz XBJUTJHGYZMNMO-UHFFFAOYSA-N 1 2 311.282 4.150 20 0 DIADLO C[C@H]1CCN(C(=O)CCC2CCCCCC2)C[C@@H]1n1cc[nH+]c1 ZINC000654893796 1035615293 /nfs/dbraw/zinc/61/52/93/1035615293.db2.gz UGDMQTKEXFETKS-WMZOPIPTSA-N 1 2 317.477 4.043 20 0 DIADLO O=C(C[N@H+](Cc1cccs1)C1CC1)Nc1ccccc1Cl ZINC000044898009 1035625146 /nfs/dbraw/zinc/62/51/46/1035625146.db2.gz IVOCHAIOEPWPBP-UHFFFAOYSA-N 1 2 320.845 4.005 20 0 DIADLO O=C(C[N@@H+](Cc1cccs1)C1CC1)Nc1ccccc1Cl ZINC000044898009 1035625149 /nfs/dbraw/zinc/62/51/49/1035625149.db2.gz IVOCHAIOEPWPBP-UHFFFAOYSA-N 1 2 320.845 4.005 20 0 DIADLO Cc1cc(C)c(Nc2ccc(Cl)nc2Br)c[nH+]1 ZINC001213505278 1035634204 /nfs/dbraw/zinc/63/42/04/1035634204.db2.gz AKKKNHJLJHIWHW-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO c1csc(C[N@@H+](Cc2nc(-c3ccsc3)no2)C2CC2)c1 ZINC000045006730 1035663925 /nfs/dbraw/zinc/66/39/25/1035663925.db2.gz NSQIQUXPGGBVLW-UHFFFAOYSA-N 1 2 317.439 4.024 20 0 DIADLO c1csc(C[N@H+](Cc2nc(-c3ccsc3)no2)C2CC2)c1 ZINC000045006730 1035663931 /nfs/dbraw/zinc/66/39/31/1035663931.db2.gz NSQIQUXPGGBVLW-UHFFFAOYSA-N 1 2 317.439 4.024 20 0 DIADLO CCc1ccc(C[N@H+](Cn2ccc(C(F)(F)F)n2)C2CC2)cc1 ZINC000065941419 1035744200 /nfs/dbraw/zinc/74/42/00/1035744200.db2.gz KIXAEYDFEFMPCD-UHFFFAOYSA-N 1 2 323.362 4.086 20 0 DIADLO CCc1ccc(C[N@@H+](Cn2ccc(C(F)(F)F)n2)C2CC2)cc1 ZINC000065941419 1035744216 /nfs/dbraw/zinc/74/42/16/1035744216.db2.gz KIXAEYDFEFMPCD-UHFFFAOYSA-N 1 2 323.362 4.086 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3cscn3)CCCCC2)c(F)c1 ZINC000154150176 1035766648 /nfs/dbraw/zinc/76/66/48/1035766648.db2.gz IGXHFDCDXGCBGQ-UHFFFAOYSA-N 1 2 308.397 4.371 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccco2)no1)c1ccc2c(c1)CCCC2 ZINC000154326063 1035868612 /nfs/dbraw/zinc/86/86/12/1035868612.db2.gz MNCUNUZREDDXMG-ZDUSSCGKSA-N 1 2 323.396 4.059 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(F)c(F)c(F)c2)n1 ZINC000127008933 1035880100 /nfs/dbraw/zinc/88/01/00/1035880100.db2.gz XGRKUKIRSATNCN-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc(F)c(F)c(F)c2)n1 ZINC000127008933 1035880113 /nfs/dbraw/zinc/88/01/13/1035880113.db2.gz XGRKUKIRSATNCN-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO CC(C)n1cc(C[N@H+](Cc2ccco2)Cc2cccs2)cn1 ZINC000179604072 1035900783 /nfs/dbraw/zinc/90/07/83/1035900783.db2.gz ORHNFULESRPKGG-UHFFFAOYSA-N 1 2 315.442 4.321 20 0 DIADLO CC(C)n1cc(C[N@@H+](Cc2ccco2)Cc2cccs2)cn1 ZINC000179604072 1035900792 /nfs/dbraw/zinc/90/07/92/1035900792.db2.gz ORHNFULESRPKGG-UHFFFAOYSA-N 1 2 315.442 4.321 20 0 DIADLO Cc1ccnc(C[N@@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)n1 ZINC000339661909 1035903712 /nfs/dbraw/zinc/90/37/12/1035903712.db2.gz RYWGJHAOECQQSH-ZDUSSCGKSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1ccnc(C[N@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)n1 ZINC000339661909 1035903720 /nfs/dbraw/zinc/90/37/20/1035903720.db2.gz RYWGJHAOECQQSH-ZDUSSCGKSA-N 1 2 301.821 4.164 20 0 DIADLO Clc1nc(C[NH+]2CCC3(C=Cc4ccccc43)CC2)cs1 ZINC001139975406 1035908481 /nfs/dbraw/zinc/90/84/81/1035908481.db2.gz ABTIMYIIEMBOFV-UHFFFAOYSA-N 1 2 316.857 4.357 20 0 DIADLO FC(F)C[N@@H+](Cc1ccc(OC(F)F)cc1)CC1CCC1 ZINC000535622674 1035992903 /nfs/dbraw/zinc/99/29/03/1035992903.db2.gz GSWQVMZKLHERDJ-UHFFFAOYSA-N 1 2 305.315 4.155 20 0 DIADLO FC(F)C[N@H+](Cc1ccc(OC(F)F)cc1)CC1CCC1 ZINC000535622674 1035992915 /nfs/dbraw/zinc/99/29/15/1035992915.db2.gz GSWQVMZKLHERDJ-UHFFFAOYSA-N 1 2 305.315 4.155 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1C[C@@H]1C1CCCC1 ZINC000651955912 1036003511 /nfs/dbraw/zinc/00/35/11/1036003511.db2.gz FLRSXGGFGDQPQR-HZPDHXFCSA-N 1 2 309.413 4.150 20 0 DIADLO CC(C)Cn1ccnc1C[NH2+]C(c1ccccc1)c1ccccc1 ZINC000180627682 1036077707 /nfs/dbraw/zinc/07/77/07/1036077707.db2.gz DDCBTEYJCGPDDE-UHFFFAOYSA-N 1 2 319.452 4.418 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCOC[C@@H]2c2ccccc2)cc1F ZINC000579885926 1036152311 /nfs/dbraw/zinc/15/23/11/1036152311.db2.gz RLVKQXXPQASKMW-VZSQWMKGSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCOC[C@@H]2c2ccccc2)cc1F ZINC000579885926 1036152320 /nfs/dbraw/zinc/15/23/20/1036152320.db2.gz RLVKQXXPQASKMW-VZSQWMKGSA-N 1 2 315.363 4.052 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2nc(C(C)C)ns2)c1 ZINC001167138215 1036176026 /nfs/dbraw/zinc/17/60/26/1036176026.db2.gz KKXFECBRGUAIJE-HNNXBMFYSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2nc(C(C)C)ns2)c1 ZINC001167138215 1036176033 /nfs/dbraw/zinc/17/60/33/1036176033.db2.gz KKXFECBRGUAIJE-HNNXBMFYSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1ccc(C[N@H+](Cc2nnc(C(C)C)s2)C(C)C)s1 ZINC000295604616 1036187741 /nfs/dbraw/zinc/18/77/41/1036187741.db2.gz UUWFSHMAEMONLA-UHFFFAOYSA-N 1 2 309.504 4.442 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2nnc(C(C)C)s2)C(C)C)s1 ZINC000295604616 1036187756 /nfs/dbraw/zinc/18/77/56/1036187756.db2.gz UUWFSHMAEMONLA-UHFFFAOYSA-N 1 2 309.504 4.442 20 0 DIADLO COCC[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccc(C)o1 ZINC000348132683 1036188514 /nfs/dbraw/zinc/18/85/14/1036188514.db2.gz ZJWPCLXKLRFZKE-CYBMUJFWSA-N 1 2 322.474 4.209 20 0 DIADLO CCOC1CC[NH+](Cc2ccc(F)c(Cl)c2Cl)CC1 ZINC000683351121 1036195066 /nfs/dbraw/zinc/19/50/66/1036195066.db2.gz UQCDZWBCVQZZNM-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1ncc(-c2ccccc2)o1 ZINC000109783623 1036222216 /nfs/dbraw/zinc/22/22/16/1036222216.db2.gz NYTMDOPDJKNOAH-CQSZACIVSA-N 1 2 308.381 4.240 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ncc(-c2ccccc2)o1 ZINC000109783623 1036222234 /nfs/dbraw/zinc/22/22/34/1036222234.db2.gz NYTMDOPDJKNOAH-CQSZACIVSA-N 1 2 308.381 4.240 20 0 DIADLO OCc1ccc2c(c1)CC[N@@H+](Cc1ccc(Cl)cc1Cl)C2 ZINC001203389011 1036234841 /nfs/dbraw/zinc/23/48/41/1036234841.db2.gz UXWPGGJPEFYOMB-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO OCc1ccc2c(c1)CC[N@H+](Cc1ccc(Cl)cc1Cl)C2 ZINC001203389011 1036234851 /nfs/dbraw/zinc/23/48/51/1036234851.db2.gz UXWPGGJPEFYOMB-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO Oc1ccc(Nc2ccccc2-n2cc[nH+]c2)cc1C(F)(F)F ZINC001209985492 1036337643 /nfs/dbraw/zinc/33/76/43/1036337643.db2.gz FXIGEIRRLBXVLI-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO COC(=O)[C@H](c1cc(Cl)cc(Cl)c1)[N@H+](C)CC(C)(C)C ZINC001167291179 1036464561 /nfs/dbraw/zinc/46/45/61/1036464561.db2.gz ICYUZXJSCGNCSQ-ZDUSSCGKSA-N 1 2 318.244 4.185 20 0 DIADLO COC(=O)[C@H](c1cc(Cl)cc(Cl)c1)[N@@H+](C)CC(C)(C)C ZINC001167291179 1036464562 /nfs/dbraw/zinc/46/45/62/1036464562.db2.gz ICYUZXJSCGNCSQ-ZDUSSCGKSA-N 1 2 318.244 4.185 20 0 DIADLO Cc1ccsc1C[N@H+](C)Cc1nnc(-c2ccc(C)cc2)o1 ZINC000046503076 1036469512 /nfs/dbraw/zinc/46/95/12/1036469512.db2.gz ULVPJAYVLGZTEX-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccsc1C[N@@H+](C)Cc1nnc(-c2ccc(C)cc2)o1 ZINC000046503076 1036469515 /nfs/dbraw/zinc/46/95/15/1036469515.db2.gz ULVPJAYVLGZTEX-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2cc(O)ccc2Cl)C2CC2)n1 ZINC000625303260 1036477632 /nfs/dbraw/zinc/47/76/32/1036477632.db2.gz XGAMJNZVKHCXJW-AWEZNQCLSA-N 1 2 308.834 4.051 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1nc2cc(C)ccc2s1 ZINC000625303478 1036478365 /nfs/dbraw/zinc/47/83/65/1036478365.db2.gz RKLPZVBLZKFHLA-JTQLQIEISA-N 1 2 301.415 4.060 20 0 DIADLO c1oc(-c2ccccc2)nc1C[NH2+]Cc1cc2ccccc2o1 ZINC001648811158 1036491367 /nfs/dbraw/zinc/49/13/67/1036491367.db2.gz FZFUIOFBIZLQRI-UHFFFAOYSA-N 1 2 304.349 4.378 20 0 DIADLO Fc1ccc([C@H]([NH2+][C@H]2CCCn3ccnc32)c2ccccc2)cc1 ZINC000655701737 1036493773 /nfs/dbraw/zinc/49/37/73/1036493773.db2.gz YXGPAKSQINULTE-RBUKOAKNSA-N 1 2 321.399 4.236 20 0 DIADLO Fc1cccnc1C[NH2+]Cc1ccc(-c2c(F)cccc2F)o1 ZINC000126227131 1036503180 /nfs/dbraw/zinc/50/31/80/1036503180.db2.gz PBFNWVLLVBGKOS-UHFFFAOYSA-N 1 2 318.298 4.049 20 0 DIADLO COc1ccc(OC)c([C@H](C)[NH2+][C@H](C)c2nc(C)sc2C)c1 ZINC000315848018 1036661875 /nfs/dbraw/zinc/66/18/75/1036661875.db2.gz LGQUKZGHCUGNBN-WDEREUQCSA-N 1 2 320.458 4.189 20 0 DIADLO C(CC1CCCC1)C[N@@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000674860629 1036668126 /nfs/dbraw/zinc/66/81/26/1036668126.db2.gz CWTHNLZNHVNVQN-INIZCTEOSA-N 1 2 303.450 4.444 20 0 DIADLO C(CC1CCCC1)C[N@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000674860629 1036668135 /nfs/dbraw/zinc/66/81/35/1036668135.db2.gz CWTHNLZNHVNVQN-INIZCTEOSA-N 1 2 303.450 4.444 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccccc1)c1cccnc1)c1ccncc1F ZINC000340472259 1036692469 /nfs/dbraw/zinc/69/24/69/1036692469.db2.gz HPQZJHPZBHNSBG-IFXJQAMLSA-N 1 2 307.372 4.056 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1cccnc1)c1ccncc1F ZINC000340472258 1036692729 /nfs/dbraw/zinc/69/27/29/1036692729.db2.gz HPQZJHPZBHNSBG-AUUYWEPGSA-N 1 2 307.372 4.056 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2cc3ccccc3o2)cs1)c1cn[nH]c1 ZINC000340502454 1036765161 /nfs/dbraw/zinc/76/51/61/1036765161.db2.gz KHPKCIHNPLTKPE-LLVKDONJSA-N 1 2 324.409 4.130 20 0 DIADLO c1csc(CNc2[nH+]c3ccccc3n2-c2ccccc2)n1 ZINC000683722729 1036770260 /nfs/dbraw/zinc/77/02/60/1036770260.db2.gz WNBZLMVOQNOTGS-UHFFFAOYSA-N 1 2 306.394 4.094 20 0 DIADLO CCc1nc(C)c(C[NH2+]Cc2cc(Cl)sc2Cl)o1 ZINC000312608158 1036776616 /nfs/dbraw/zinc/77/66/16/1036776616.db2.gz DYVZTRVPEYNMHC-UHFFFAOYSA-N 1 2 305.230 4.204 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2cc(C)ccc2OC)c1 ZINC000533784660 1036811219 /nfs/dbraw/zinc/81/12/19/1036811219.db2.gz IRFVBZAHLXMZPU-UHFFFAOYSA-N 1 2 303.427 4.149 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1ccc2cnccc2c1 ZINC000683750593 1036820081 /nfs/dbraw/zinc/82/00/81/1036820081.db2.gz PZTKHMNLOGSKGR-UHFFFAOYSA-N 1 2 302.381 4.217 20 0 DIADLO CC(C)(O)c1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)cc1 ZINC001210616489 1036877584 /nfs/dbraw/zinc/87/75/84/1036877584.db2.gz IMYFKEDUWGICEZ-UHFFFAOYSA-N 1 2 311.429 4.043 20 0 DIADLO C[N@H+](CCCOc1cccc2ccccc21)Cc1cscn1 ZINC000063592675 1036901428 /nfs/dbraw/zinc/90/14/28/1036901428.db2.gz WEQRNTFHOSWAGF-UHFFFAOYSA-N 1 2 312.438 4.197 20 0 DIADLO C[N@@H+](CCCOc1cccc2ccccc21)Cc1cscn1 ZINC000063592675 1036901443 /nfs/dbraw/zinc/90/14/43/1036901443.db2.gz WEQRNTFHOSWAGF-UHFFFAOYSA-N 1 2 312.438 4.197 20 0 DIADLO FC1(F)CC2(C[NH+](CCc3cc(Cl)ccc3Cl)C2)C1 ZINC000683785970 1036926164 /nfs/dbraw/zinc/92/61/64/1036926164.db2.gz SJZIVEVLZVNTFC-UHFFFAOYSA-N 1 2 306.183 4.267 20 0 DIADLO Cc1[nH]c(CNc2ccc(C(C)(C)C(F)(F)F)cc2)[nH+]c1C ZINC000565490861 1036927688 /nfs/dbraw/zinc/92/76/88/1036927688.db2.gz LOQRMKVDFXEIJN-UHFFFAOYSA-N 1 2 311.351 4.479 20 0 DIADLO Cc1nc(C[NH2+]Cc2cc(Cl)sc2Cl)sc1C ZINC000312749743 1037009673 /nfs/dbraw/zinc/00/96/73/1037009673.db2.gz UNXBXRMZQVVXNZ-UHFFFAOYSA-N 1 2 307.271 4.418 20 0 DIADLO COc1ccc(C[NH2+]Cc2cc(Cl)sc2Cl)cc1O ZINC000312749678 1037010622 /nfs/dbraw/zinc/01/06/22/1037010622.db2.gz UIGLDAPLPBDOGH-UHFFFAOYSA-N 1 2 318.225 4.059 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccncc2)n1 ZINC000316354193 1037042285 /nfs/dbraw/zinc/04/22/85/1037042285.db2.gz ZNCZIEDKUWYWMA-PBHICJAKSA-N 1 2 309.438 4.287 20 0 DIADLO Cc1nc(C)c(C[N@@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)o1 ZINC000683896981 1037075295 /nfs/dbraw/zinc/07/52/95/1037075295.db2.gz GXRHIWFTXQRLRH-BZNIZROVSA-N 1 2 300.402 4.172 20 0 DIADLO Cc1nc(C)c(C[N@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)o1 ZINC000683896981 1037075316 /nfs/dbraw/zinc/07/53/16/1037075316.db2.gz GXRHIWFTXQRLRH-BZNIZROVSA-N 1 2 300.402 4.172 20 0 DIADLO Fc1ccc(CNc2cc3cc[nH]c3c[nH+]2)c(C(F)(F)F)c1 ZINC000683893348 1037076316 /nfs/dbraw/zinc/07/63/16/1037076316.db2.gz MXTFPIUCDNCSJM-UHFFFAOYSA-N 1 2 309.266 4.333 20 0 DIADLO Brc1cc(C[NH+]2CC(c3ccccc3)C2)cs1 ZINC000397999277 1037076765 /nfs/dbraw/zinc/07/67/65/1037076765.db2.gz UZBFAVJVRVZYKT-UHFFFAOYSA-N 1 2 308.244 4.110 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)cc1O ZINC000564429199 1037125606 /nfs/dbraw/zinc/12/56/06/1037125606.db2.gz NPQVIIBCJKCYFK-XOBRGWDASA-N 1 2 323.392 4.434 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3ccccc3[nH]2)[C@@H](c2ccccc2)CO1 ZINC000684021326 1037244154 /nfs/dbraw/zinc/24/41/54/1037244154.db2.gz OARFMFSEBHWZNJ-MGPUTAFESA-N 1 2 306.409 4.130 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)[C@@H](c2ccccc2)CO1 ZINC000684021326 1037244159 /nfs/dbraw/zinc/24/41/59/1037244159.db2.gz OARFMFSEBHWZNJ-MGPUTAFESA-N 1 2 306.409 4.130 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3ccccc3[nH]2)C[C@@H](c2ccsc2)O1 ZINC000684020407 1037246228 /nfs/dbraw/zinc/24/62/28/1037246228.db2.gz CBCRLKRUWYWALJ-UGSOOPFHSA-N 1 2 312.438 4.191 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3ccccc3[nH]2)C[C@@H](c2ccsc2)O1 ZINC000684020407 1037246238 /nfs/dbraw/zinc/24/62/38/1037246238.db2.gz CBCRLKRUWYWALJ-UGSOOPFHSA-N 1 2 312.438 4.191 20 0 DIADLO Cc1ncc(C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2F)o1 ZINC000692303463 1037287272 /nfs/dbraw/zinc/28/72/72/1037287272.db2.gz YQCGACXRDSPMAB-ZETCQYMHSA-N 1 2 303.164 4.280 20 0 DIADLO CCOc1cccc(/C=C\C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC001125473969 1037303592 /nfs/dbraw/zinc/30/35/92/1037303592.db2.gz QPMNAZJHXJDGLK-KTKRTIGZSA-N 1 2 310.397 4.057 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)no1 ZINC000580861641 1037335207 /nfs/dbraw/zinc/33/52/07/1037335207.db2.gz LAFPRRJTODNNGX-LBPRGKRZSA-N 1 2 318.383 4.383 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)no1 ZINC000580861641 1037335229 /nfs/dbraw/zinc/33/52/29/1037335229.db2.gz LAFPRRJTODNNGX-LBPRGKRZSA-N 1 2 318.383 4.383 20 0 DIADLO COc1cccc(Br)c1Nc1c[nH+]c(C)cc1C ZINC001213518487 1037343694 /nfs/dbraw/zinc/34/36/94/1037343694.db2.gz QOTXOBJIAUPRIR-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO COCCCNc1cccc(F)c1Nc1c[nH+]c(C)cc1C ZINC001213521161 1037360322 /nfs/dbraw/zinc/36/03/22/1037360322.db2.gz XFLAMUUIBPMZMV-UHFFFAOYSA-N 1 2 303.381 4.030 20 0 DIADLO Cc1nc([C@@H](C)[NH+]2CCC(c3cccc4ccccc43)CC2)no1 ZINC000581278745 1037512180 /nfs/dbraw/zinc/51/21/80/1037512180.db2.gz ADMBVFBMWGSHTA-CQSZACIVSA-N 1 2 321.424 4.472 20 0 DIADLO Cc1nc([C@H](C)[NH+]2CCC(c3cccc4ccccc43)CC2)no1 ZINC000581278733 1037513666 /nfs/dbraw/zinc/51/36/66/1037513666.db2.gz ADMBVFBMWGSHTA-AWEZNQCLSA-N 1 2 321.424 4.472 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2csc(-c3ccco3)n2)o1 ZINC000067975093 1037527700 /nfs/dbraw/zinc/52/77/00/1037527700.db2.gz QIVOTNZPFFPTBZ-FZMZJTMJSA-N 1 2 314.410 4.409 20 0 DIADLO Fc1ccc([C@H](CC(F)(F)F)[NH2+]Cc2ccc(F)cn2)cc1 ZINC000276158556 1037571176 /nfs/dbraw/zinc/57/11/76/1037571176.db2.gz CVZIZDIXGUDPDI-AWEZNQCLSA-N 1 2 316.273 4.143 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1CCO[C@H](c2ccccc2)C1 ZINC000581426361 1037636745 /nfs/dbraw/zinc/63/67/45/1037636745.db2.gz POIPUSSNLIOJDS-IBGZPJMESA-N 1 2 304.393 4.121 20 0 DIADLO Cc1cc2c(s1)N(c1cccc(F)n1)c1ccccc1NC2=[NH2+] ZINC001167463392 1037645972 /nfs/dbraw/zinc/64/59/72/1037645972.db2.gz NYTDPXJYJDSRGZ-UHFFFAOYSA-N 1 2 324.384 4.411 20 0 DIADLO Cc1c[nH+]c(CNc2ccc(SC3CCCC3)cc2)n1C ZINC000341128699 1037684315 /nfs/dbraw/zinc/68/43/15/1037684315.db2.gz XOCTWOYRJSASAI-UHFFFAOYSA-N 1 2 301.459 4.375 20 0 DIADLO Cc1c[nH+]c(CN[C@@H](C)c2c(Cl)ccc(F)c2Cl)n1C ZINC000341147409 1037692818 /nfs/dbraw/zinc/69/28/18/1037692818.db2.gz MCDSBZKWFNSTSY-VIFPVBQESA-N 1 2 316.207 4.025 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1cc(F)cc(F)c1 ZINC000090228921 1037760422 /nfs/dbraw/zinc/76/04/22/1037760422.db2.gz MMKUGBKGSUCMAZ-SSDOTTSWSA-N 1 2 319.248 4.372 20 0 DIADLO CSc1ncc(Cl)cc1Nc1ccc2c(c1)[nH+]cn2C ZINC001215915745 1037766466 /nfs/dbraw/zinc/76/64/66/1037766466.db2.gz ANRXITHAZNJRHB-UHFFFAOYSA-N 1 2 304.806 4.087 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@H+](Cc2nc(C3CC3)cs2)C1 ZINC000581619773 1037785569 /nfs/dbraw/zinc/78/55/69/1037785569.db2.gz NXIQKCUXLIELAM-KRWDZBQOSA-N 1 2 302.418 4.091 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@@H+](Cc2nc(C3CC3)cs2)C1 ZINC000581619773 1037785596 /nfs/dbraw/zinc/78/55/96/1037785596.db2.gz NXIQKCUXLIELAM-KRWDZBQOSA-N 1 2 302.418 4.091 20 0 DIADLO FC(F)(F)CC1C[NH+](Cc2cnc(C3CCCC3)s2)C1 ZINC000656686477 1037792824 /nfs/dbraw/zinc/79/28/24/1037792824.db2.gz OOEDAALONNRGER-UHFFFAOYSA-N 1 2 304.381 4.185 20 0 DIADLO C[N@H+](Cc1coc(-c2ccc(F)cc2)n1)Cc1cccc(F)c1 ZINC000097098207 1037796453 /nfs/dbraw/zinc/79/64/53/1037796453.db2.gz FTKAKCKNDMXPRD-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1coc(-c2ccc(F)cc2)n1)Cc1cccc(F)c1 ZINC000097098207 1037796467 /nfs/dbraw/zinc/79/64/67/1037796467.db2.gz FTKAKCKNDMXPRD-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO CC(C)([NH2+]Cc1ccc(OCc2ccccc2)cc1)C(F)F ZINC000684413721 1037965785 /nfs/dbraw/zinc/96/57/85/1037965785.db2.gz XYLIZHWDACXBJG-UHFFFAOYSA-N 1 2 305.368 4.399 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2coc(-c3cccs3)n2)s1 ZINC000090404821 1037970523 /nfs/dbraw/zinc/97/05/23/1037970523.db2.gz RJRDTSUJSYMNMJ-SECBINFHSA-N 1 2 305.428 4.019 20 0 DIADLO C[N@H+](Cc1nnsc1Cl)[C@H]1CCCC[C@H]1c1ccccc1 ZINC000581772260 1037989274 /nfs/dbraw/zinc/98/92/74/1037989274.db2.gz NTFMUIOPSQODPB-ZFWWWQNUSA-N 1 2 321.877 4.350 20 0 DIADLO C[N@@H+](Cc1nnsc1Cl)[C@H]1CCCC[C@H]1c1ccccc1 ZINC000581772260 1037989281 /nfs/dbraw/zinc/98/92/81/1037989281.db2.gz NTFMUIOPSQODPB-ZFWWWQNUSA-N 1 2 321.877 4.350 20 0 DIADLO Clc1cccc2c(NCc3cn4ccsc4n3)cc[nH+]c12 ZINC000341449680 1038035111 /nfs/dbraw/zinc/03/51/11/1038035111.db2.gz DTNRTNKKEWJYOY-UHFFFAOYSA-N 1 2 314.801 4.210 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2nc(C(C)(C)C)co2)cc1 ZINC000891567998 1038043876 /nfs/dbraw/zinc/04/38/76/1038043876.db2.gz UUEYHHJNLUANMF-CYBMUJFWSA-N 1 2 302.418 4.174 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2nc(C(C)(C)C)co2)cc1 ZINC000891567998 1038043905 /nfs/dbraw/zinc/04/39/05/1038043905.db2.gz UUEYHHJNLUANMF-CYBMUJFWSA-N 1 2 302.418 4.174 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2nc(C(C)(C)C)co2)cc1 ZINC000891567999 1038044630 /nfs/dbraw/zinc/04/46/30/1038044630.db2.gz UUEYHHJNLUANMF-ZDUSSCGKSA-N 1 2 302.418 4.174 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2nc(C(C)(C)C)co2)cc1 ZINC000891567999 1038044652 /nfs/dbraw/zinc/04/46/52/1038044652.db2.gz UUEYHHJNLUANMF-ZDUSSCGKSA-N 1 2 302.418 4.174 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1cc(F)c(F)cc1OC ZINC001143399728 1038047138 /nfs/dbraw/zinc/04/71/38/1038047138.db2.gz CQMCTWJEWUOBQT-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1cc(F)c(F)cc1OC ZINC001143399728 1038047160 /nfs/dbraw/zinc/04/71/60/1038047160.db2.gz CQMCTWJEWUOBQT-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nc(Cl)ccc2Br)[C@@H](C)C1 ZINC001232060908 1038051409 /nfs/dbraw/zinc/05/14/09/1038051409.db2.gz JOTDGLHFMDNIEW-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nc(Cl)ccc2Br)[C@@H](C)C1 ZINC001232060908 1038051389 /nfs/dbraw/zinc/05/13/89/1038051389.db2.gz JOTDGLHFMDNIEW-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO CCCCc1noc([C@@H](C)SCCc2[nH+]cc(C)cc2C)n1 ZINC000581884577 1038081879 /nfs/dbraw/zinc/08/18/79/1038081879.db2.gz OQMKVEBHUQKWRE-CQSZACIVSA-N 1 2 319.474 4.461 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001143405208 1038142674 /nfs/dbraw/zinc/14/26/74/1038142674.db2.gz VSLUYFWFWGHKAG-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001143405208 1038142681 /nfs/dbraw/zinc/14/26/81/1038142681.db2.gz VSLUYFWFWGHKAG-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nccn2-c2ccccc2)[C@H](c2ccco2)C1 ZINC001167490734 1038164224 /nfs/dbraw/zinc/16/42/24/1038164224.db2.gz HHVLQDJXLSVRGH-WMZOPIPTSA-N 1 2 321.424 4.439 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nccn2-c2ccccc2)[C@H](c2ccco2)C1 ZINC001167490734 1038164228 /nfs/dbraw/zinc/16/42/28/1038164228.db2.gz HHVLQDJXLSVRGH-WMZOPIPTSA-N 1 2 321.424 4.439 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1OC(F)(F)F)c1cscn1 ZINC000581955158 1038172524 /nfs/dbraw/zinc/17/25/24/1038172524.db2.gz WMEIKXCNCHTARP-UWVGGRQHSA-N 1 2 316.348 4.454 20 0 DIADLO CCc1ccc(-c2noc([C@H](C)[NH2+]Cc3ccsc3)n2)cc1 ZINC000276746655 1038178806 /nfs/dbraw/zinc/17/88/06/1038178806.db2.gz JYEPFZIIRPDTND-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO Cc1cc(NC(=O)c2sc3cccc(F)c3c2Cl)cc[nH+]1 ZINC001266882344 1038190559 /nfs/dbraw/zinc/19/05/59/1038190559.db2.gz BQMCRLIPODQWAB-UHFFFAOYSA-N 1 2 320.776 4.071 20 0 DIADLO CCc1noc(C)c1C[NH2+]Cc1oc2ccccc2c1Cl ZINC000631143786 1038245345 /nfs/dbraw/zinc/24/53/45/1038245345.db2.gz UWICEGNFMKMWGO-UHFFFAOYSA-N 1 2 304.777 4.235 20 0 DIADLO C[C@H]1CC[N@H+](Cc2noc3c2CCCC3)[C@@H](c2ccco2)C1 ZINC000247475268 1038257635 /nfs/dbraw/zinc/25/76/35/1038257635.db2.gz JPHUPXKRFHUZEM-XJKSGUPXSA-N 1 2 300.402 4.120 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2noc3c2CCCC3)[C@@H](c2ccco2)C1 ZINC000247475268 1038257651 /nfs/dbraw/zinc/25/76/51/1038257651.db2.gz JPHUPXKRFHUZEM-XJKSGUPXSA-N 1 2 300.402 4.120 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+]1CCC[C@@H]1c1ccc(C)nc1 ZINC001143412838 1038259566 /nfs/dbraw/zinc/25/95/66/1038259566.db2.gz HNYVTKPTJMIGSG-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+]1CCC[C@@H]1c1ccc(C)nc1 ZINC001143412838 1038259577 /nfs/dbraw/zinc/25/95/77/1038259577.db2.gz HNYVTKPTJMIGSG-MRXNPFEDSA-N 1 2 318.367 4.014 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1)Cc1c(F)c(F)ccc1OC ZINC001143413967 1038270576 /nfs/dbraw/zinc/27/05/76/1038270576.db2.gz XAQUCTWXXWKCIS-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1)Cc1c(F)c(F)ccc1OC ZINC001143413967 1038270588 /nfs/dbraw/zinc/27/05/88/1038270588.db2.gz XAQUCTWXXWKCIS-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC(C)(C)c1cccc(OCC[NH2+]Cc2n[nH]c3ccccc32)c1 ZINC000603723005 1038271557 /nfs/dbraw/zinc/27/15/57/1038271557.db2.gz JLNWUKBVKRUOSH-UHFFFAOYSA-N 1 2 323.440 4.029 20 0 DIADLO CC(C)N(C)c1ccc(CNc2ccc([NH+]3CCCC3)cc2)cn1 ZINC000276937251 1038288521 /nfs/dbraw/zinc/28/85/21/1038288521.db2.gz FSBJOTBKPBFWEQ-UHFFFAOYSA-N 1 2 324.472 4.139 20 0 DIADLO CCC1(Cc2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)CCC1 ZINC001211527502 1038288852 /nfs/dbraw/zinc/28/88/52/1038288852.db2.gz KTVPRBSMZNQZRK-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000603865362 1038306641 /nfs/dbraw/zinc/30/66/41/1038306641.db2.gz BUTYNLZHUDSMES-ZWKOTPCHSA-N 1 2 317.477 4.043 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2ncc(-c3cccs3)o2)s1 ZINC000639995102 1038309941 /nfs/dbraw/zinc/30/99/41/1038309941.db2.gz QXEAOWHSJGEAML-VIFPVBQESA-N 1 2 305.428 4.019 20 0 DIADLO Cn1c2ccccc2[nH+]c1N[C@H](c1ccccc1)c1ccccn1 ZINC000535690004 1038317509 /nfs/dbraw/zinc/31/75/09/1038317509.db2.gz OEILRPJOPNMAFY-LJQANCHMSA-N 1 2 314.392 4.170 20 0 DIADLO C[N@H+](Cc1cccc(C(F)(F)F)c1)Cc1cccnc1Cl ZINC000171078565 1038320279 /nfs/dbraw/zinc/32/02/79/1038320279.db2.gz LSESMQWMEXNYMN-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1cccc(C(F)(F)F)c1)Cc1cccnc1Cl ZINC000171078565 1038320294 /nfs/dbraw/zinc/32/02/94/1038320294.db2.gz LSESMQWMEXNYMN-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1noc(-c2ccccc2)n1 ZINC000603968525 1038333239 /nfs/dbraw/zinc/33/32/39/1038333239.db2.gz ZDMWAYXHXMPXGV-GOSISDBHSA-N 1 2 319.408 4.246 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1noc(-c2ccccc2)n1 ZINC000603968525 1038333253 /nfs/dbraw/zinc/33/32/53/1038333253.db2.gz ZDMWAYXHXMPXGV-GOSISDBHSA-N 1 2 319.408 4.246 20 0 DIADLO CCS[C@H](C)c1noc(C[NH+]2CCC(C3CCCC3)CC2)n1 ZINC000610820850 1038375370 /nfs/dbraw/zinc/37/53/70/1038375370.db2.gz GPTSOQFBHKQBBR-CYBMUJFWSA-N 1 2 323.506 4.286 20 0 DIADLO COc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)s2)n1 ZINC001137533401 1038385081 /nfs/dbraw/zinc/38/50/81/1038385081.db2.gz UGMAYLUJSAFTBU-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)n1 ZINC001137533401 1038385094 /nfs/dbraw/zinc/38/50/94/1038385094.db2.gz UGMAYLUJSAFTBU-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO O=C(C[C@H]1CCc2ccccc21)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000604321105 1038400510 /nfs/dbraw/zinc/40/05/10/1038400510.db2.gz FKONRZQEQOMEIH-MRXNPFEDSA-N 1 2 317.392 4.135 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[NH+]1CCC(F)(F)CC1 ZINC000684624627 1038405587 /nfs/dbraw/zinc/40/55/87/1038405587.db2.gz WDTVHONOWCVSGU-CQSZACIVSA-N 1 2 324.415 4.177 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)[C@H](C)[NH+]1CCC(F)(F)CC1 ZINC000684624626 1038406454 /nfs/dbraw/zinc/40/64/54/1038406454.db2.gz WDTVHONOWCVSGU-AWEZNQCLSA-N 1 2 324.415 4.177 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+]1CC(C)(C)OCC1(C)C ZINC000604386349 1038409847 /nfs/dbraw/zinc/40/98/47/1038409847.db2.gz IOSPPJQRSXTCMI-UHFFFAOYSA-N 1 2 314.429 4.039 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+]1CC(C)(C)OCC1(C)C ZINC000604386349 1038409853 /nfs/dbraw/zinc/40/98/53/1038409853.db2.gz IOSPPJQRSXTCMI-UHFFFAOYSA-N 1 2 314.429 4.039 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(-c3ccccc3)n2)C(C)(C)CO1 ZINC000604386630 1038409902 /nfs/dbraw/zinc/40/99/02/1038409902.db2.gz OJDPUXPNDDCAQS-UHFFFAOYSA-N 1 2 316.470 4.200 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(-c3ccccc3)n2)C(C)(C)CO1 ZINC000604386630 1038409904 /nfs/dbraw/zinc/40/99/04/1038409904.db2.gz OJDPUXPNDDCAQS-UHFFFAOYSA-N 1 2 316.470 4.200 20 0 DIADLO Cc1ccc([C@@H](C)NC[C@@H](c2cccs2)[NH+]2CCCC2)o1 ZINC000150908523 1038424078 /nfs/dbraw/zinc/42/40/78/1038424078.db2.gz NNJOVTGGXFOOQK-CABCVRRESA-N 1 2 304.459 4.137 20 0 DIADLO Cn1c[nH+]cc1CNc1cccc(CSCc2ccccc2)c1 ZINC000151040660 1038430818 /nfs/dbraw/zinc/43/08/18/1038430818.db2.gz PPPHYYCYBHLNEK-UHFFFAOYSA-N 1 2 323.465 4.466 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)CN(c1cc(C)[nH+]c(C2CC2)n1)CC3 ZINC000604757084 1038449063 /nfs/dbraw/zinc/44/90/63/1038449063.db2.gz DZULEFLZVFBLFS-UHFFFAOYSA-N 1 2 318.424 4.015 20 0 DIADLO CC(C)n1ccc(C[N@H+](C)Cc2ccc(Cl)c(Cl)c2)n1 ZINC000604884018 1038461390 /nfs/dbraw/zinc/46/13/90/1038461390.db2.gz ADEGYCIHVFGLAH-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1ccc(C[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)n1 ZINC000604884018 1038461395 /nfs/dbraw/zinc/46/13/95/1038461395.db2.gz ADEGYCIHVFGLAH-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)n1 ZINC000604884306 1038461853 /nfs/dbraw/zinc/46/18/53/1038461853.db2.gz CAWLFCXHGKBJTA-QGZVFWFLSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)n1 ZINC000604884306 1038461855 /nfs/dbraw/zinc/46/18/55/1038461855.db2.gz CAWLFCXHGKBJTA-QGZVFWFLSA-N 1 2 303.837 4.455 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000061858340 1038467918 /nfs/dbraw/zinc/46/79/18/1038467918.db2.gz FLWQEIIYQFOIAZ-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000061858340 1038467925 /nfs/dbraw/zinc/46/79/25/1038467925.db2.gz FLWQEIIYQFOIAZ-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)n1 ZINC000892053144 1038489041 /nfs/dbraw/zinc/48/90/41/1038489041.db2.gz STUNMOKFVVCEBC-HNNXBMFYSA-N 1 2 316.470 4.262 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2CCS[C@H](c3ccccc3)C2)n1 ZINC000892053144 1038489046 /nfs/dbraw/zinc/48/90/46/1038489046.db2.gz STUNMOKFVVCEBC-HNNXBMFYSA-N 1 2 316.470 4.262 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)o1 ZINC000605155202 1038494318 /nfs/dbraw/zinc/49/43/18/1038494318.db2.gz KYPYJCFXSWDACN-HNNXBMFYSA-N 1 2 316.470 4.262 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCS[C@H](c3ccccc3)C2)o1 ZINC000605155202 1038494322 /nfs/dbraw/zinc/49/43/22/1038494322.db2.gz KYPYJCFXSWDACN-HNNXBMFYSA-N 1 2 316.470 4.262 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)s2)[nH]1 ZINC000277350262 1038516930 /nfs/dbraw/zinc/51/69/30/1038516930.db2.gz VOUDUDVQZPZYNT-LPEHRKFASA-N 1 2 312.870 4.445 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC[C@@H](C)C[C@H]1c1ccc(CC)o1 ZINC001167509768 1038524732 /nfs/dbraw/zinc/52/47/32/1038524732.db2.gz PVIDDMXOAHARIQ-VYDXJSESSA-N 1 2 321.461 4.347 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CC[C@@H](C)C[C@H]1c1ccc(CC)o1 ZINC001167509768 1038524744 /nfs/dbraw/zinc/52/47/44/1038524744.db2.gz PVIDDMXOAHARIQ-VYDXJSESSA-N 1 2 321.461 4.347 20 0 DIADLO CC(C)c1noc([C@@H](C)[NH+]2CCC(c3ccccc3F)CC2)n1 ZINC000605576674 1038536895 /nfs/dbraw/zinc/53/68/95/1038536895.db2.gz YSUULZLNTHVDBK-CYBMUJFWSA-N 1 2 317.408 4.273 20 0 DIADLO C[C@H](c1ccc(-c2ccccc2)cc1)[N@H+](C)Cc1cnns1 ZINC001167521810 1038546467 /nfs/dbraw/zinc/54/64/67/1038546467.db2.gz JWNSXOAWEVAGFQ-CQSZACIVSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@H](c1ccc(-c2ccccc2)cc1)[N@@H+](C)Cc1cnns1 ZINC001167521810 1038546471 /nfs/dbraw/zinc/54/64/71/1038546471.db2.gz JWNSXOAWEVAGFQ-CQSZACIVSA-N 1 2 309.438 4.398 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C12CCC(CC1)C2 ZINC000342387975 1038567460 /nfs/dbraw/zinc/56/74/60/1038567460.db2.gz NXDANGUEJXYXMV-UHFFFAOYSA-N 1 2 315.804 4.045 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1nc(C(C)C)ns1)C(C)(C)C ZINC000934285927 1038580139 /nfs/dbraw/zinc/58/01/39/1038580139.db2.gz ADLVJYVRQIRAPX-HNNXBMFYSA-N 1 2 318.490 4.242 20 0 DIADLO CCc1ccc([C@@H](C)CC(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC000606199012 1038584898 /nfs/dbraw/zinc/58/48/98/1038584898.db2.gz UDHUOSHTHHQBDM-AWEZNQCLSA-N 1 2 307.397 4.029 20 0 DIADLO Cc1ccoc1C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000277504946 1038607980 /nfs/dbraw/zinc/60/79/80/1038607980.db2.gz FFKVQRUEHLAINJ-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO C=C(Br)C[N@@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000062640513 1038611812 /nfs/dbraw/zinc/61/18/12/1038611812.db2.gz BPSJIXFTRDOTSM-UHFFFAOYSA-N 1 2 300.627 4.213 20 0 DIADLO C=C(Br)C[N@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000062640513 1038611818 /nfs/dbraw/zinc/61/18/18/1038611818.db2.gz BPSJIXFTRDOTSM-UHFFFAOYSA-N 1 2 300.627 4.213 20 0 DIADLO CCCC[C@H]1CCC[C@H]1NC(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000606570052 1038615208 /nfs/dbraw/zinc/61/52/08/1038615208.db2.gz OPBITEQZWFGTTJ-GOEBONIOSA-N 1 2 314.433 4.123 20 0 DIADLO CC(C)CCN(CCC(C)C)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606581472 1038616352 /nfs/dbraw/zinc/61/63/52/1038616352.db2.gz FDTOJIZGGQLGCM-UHFFFAOYSA-N 1 2 316.449 4.260 20 0 DIADLO Cc1c[nH]c(C[NH2+]C(c2cccc(C)c2)c2cccc(C)c2)n1 ZINC000657392346 1038633023 /nfs/dbraw/zinc/63/30/23/1038633023.db2.gz VOZKLPPCUFDSCW-UHFFFAOYSA-N 1 2 305.425 4.214 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]Cc2ccc(C)cc2Cl)cs1 ZINC000582364617 1038640536 /nfs/dbraw/zinc/64/05/36/1038640536.db2.gz MQQBEUJGYGKNTM-NSHDSACASA-N 1 2 310.850 4.102 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CCCc3ccccc3C2)n1 ZINC000062944598 1038644312 /nfs/dbraw/zinc/64/43/12/1038644312.db2.gz STYAJNUKVFVXBD-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CCCc3ccccc3C2)n1 ZINC000062944598 1038644314 /nfs/dbraw/zinc/64/43/14/1038644314.db2.gz STYAJNUKVFVXBD-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO CC[N@H+](Cc1coc(-c2ccccc2)n1)[C@H](C)c1cccnc1 ZINC000342535144 1038656956 /nfs/dbraw/zinc/65/69/56/1038656956.db2.gz JZBHGCAVUUBNMU-OAHLLOKOSA-N 1 2 307.397 4.320 20 0 DIADLO CC[N@@H+](Cc1coc(-c2ccccc2)n1)[C@H](C)c1cccnc1 ZINC000342535144 1038656959 /nfs/dbraw/zinc/65/69/59/1038656959.db2.gz JZBHGCAVUUBNMU-OAHLLOKOSA-N 1 2 307.397 4.320 20 0 DIADLO CCc1cccc2cc(C[NH2+][C@H](C)c3nnc(C(C)C)[nH]3)oc21 ZINC000657420143 1038657020 /nfs/dbraw/zinc/65/70/20/1038657020.db2.gz LGFFONYYKPWYEV-GFCCVEGCSA-N 1 2 312.417 4.088 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cn2ncsc2=S)c1C ZINC000172912921 1038659786 /nfs/dbraw/zinc/65/97/86/1038659786.db2.gz SMFDGRLJSKNDRR-AWEZNQCLSA-N 1 2 305.472 4.086 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cn2ncsc2=S)c1C ZINC000172912921 1038659791 /nfs/dbraw/zinc/65/97/91/1038659791.db2.gz SMFDGRLJSKNDRR-AWEZNQCLSA-N 1 2 305.472 4.086 20 0 DIADLO Cc1nc[nH]c1C[NH+]1CCC(c2c(Cl)cccc2Cl)CC1 ZINC001204588799 1038673985 /nfs/dbraw/zinc/67/39/85/1038673985.db2.gz KUMKIFMXKJYFLO-UHFFFAOYSA-N 1 2 324.255 4.405 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)[C@H](C)[N@H+](C)Cc1ccoc1 ZINC000342642246 1038697538 /nfs/dbraw/zinc/69/75/38/1038697538.db2.gz ZKHWGIAYRLQPOB-HNNXBMFYSA-N 1 2 314.429 4.170 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)[C@H](C)[N@@H+](C)Cc1ccoc1 ZINC000342642246 1038697541 /nfs/dbraw/zinc/69/75/41/1038697541.db2.gz ZKHWGIAYRLQPOB-HNNXBMFYSA-N 1 2 314.429 4.170 20 0 DIADLO CCc1cccc2cc(C[NH2+]Cc3noc4c3CCCC4)oc21 ZINC000657468265 1038705949 /nfs/dbraw/zinc/70/59/49/1038705949.db2.gz HLSHOAOCOZQBQM-UHFFFAOYSA-N 1 2 310.397 4.152 20 0 DIADLO CCc1nnc(C[NH2+]Cc2ccc(-c3cccs3)cc2)s1 ZINC000657471018 1038706474 /nfs/dbraw/zinc/70/64/74/1038706474.db2.gz YCBPSLHKWDMBDM-UHFFFAOYSA-N 1 2 315.467 4.119 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+](C)Cc1ccc2c(c1)ncn2C ZINC000342680996 1038718277 /nfs/dbraw/zinc/71/82/77/1038718277.db2.gz MWSVLCNDYIBHNB-GFCCVEGCSA-N 1 2 315.367 4.045 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccc2c(c1)ncn2C ZINC000342680996 1038718285 /nfs/dbraw/zinc/71/82/85/1038718285.db2.gz MWSVLCNDYIBHNB-GFCCVEGCSA-N 1 2 315.367 4.045 20 0 DIADLO C[N@H+](Cc1nc(C2CC2)cs1)Cc1ccc(OC(F)F)cc1 ZINC000342716131 1038735797 /nfs/dbraw/zinc/73/57/97/1038735797.db2.gz UQTFTVKVAYFSJA-UHFFFAOYSA-N 1 2 324.396 4.254 20 0 DIADLO C[N@@H+](Cc1nc(C2CC2)cs1)Cc1ccc(OC(F)F)cc1 ZINC000342716131 1038735806 /nfs/dbraw/zinc/73/58/06/1038735806.db2.gz UQTFTVKVAYFSJA-UHFFFAOYSA-N 1 2 324.396 4.254 20 0 DIADLO COc1cc(NCc2[nH]c(C)c(C)[nH+]2)c(C2CC2)cc1Cl ZINC000657508232 1038735895 /nfs/dbraw/zinc/73/58/95/1038735895.db2.gz KAFOTOYKASWBAE-UHFFFAOYSA-N 1 2 305.809 4.178 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H]3CCCc4cccnc43)co2)cc1 ZINC000684957022 1038740434 /nfs/dbraw/zinc/74/04/34/1038740434.db2.gz FWGIBBIPDIEWKK-SFHVURJKSA-N 1 2 319.408 4.212 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccco1 ZINC000684955912 1038741962 /nfs/dbraw/zinc/74/19/62/1038741962.db2.gz SASOBLQZTLZIKF-IAGOWNOFSA-N 1 2 314.429 4.056 20 0 DIADLO COCc1cnc(C[N@H+](Cc2cccc(Cl)c2)C(C)C)s1 ZINC000342726138 1038745769 /nfs/dbraw/zinc/74/57/69/1038745769.db2.gz QISZQGHSVUIOKP-UHFFFAOYSA-N 1 2 324.877 4.354 20 0 DIADLO COCc1cnc(C[N@@H+](Cc2cccc(Cl)c2)C(C)C)s1 ZINC000342726138 1038745778 /nfs/dbraw/zinc/74/57/78/1038745778.db2.gz QISZQGHSVUIOKP-UHFFFAOYSA-N 1 2 324.877 4.354 20 0 DIADLO Cc1csc(C2([NH2+]Cc3nc(C4CC4)cs3)CCCC2)n1 ZINC000342754566 1038760462 /nfs/dbraw/zinc/76/04/62/1038760462.db2.gz SCDDPUCWELHIMG-UHFFFAOYSA-N 1 2 319.499 4.345 20 0 DIADLO CCN(Cc1[nH+]cc(C)n1C)Cc1ccc(Cl)c(Cl)c1 ZINC000342773380 1038767964 /nfs/dbraw/zinc/76/79/64/1038767964.db2.gz CXZHYGUVNONJHU-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO Cc1cnc(C[N@@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)n1C ZINC000342790879 1038789408 /nfs/dbraw/zinc/78/94/08/1038789408.db2.gz BLUABHKQADNPBL-ZDUSSCGKSA-N 1 2 303.837 4.108 20 0 DIADLO Cc1cnc(C[N@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)n1C ZINC000342790879 1038789414 /nfs/dbraw/zinc/78/94/14/1038789414.db2.gz BLUABHKQADNPBL-ZDUSSCGKSA-N 1 2 303.837 4.108 20 0 DIADLO Cc1c[nH+]c(CN([C@@H](C)c2ccc(Cl)cc2)C2CC2)n1C ZINC000342790879 1038789419 /nfs/dbraw/zinc/78/94/19/1038789419.db2.gz BLUABHKQADNPBL-ZDUSSCGKSA-N 1 2 303.837 4.108 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)n1C ZINC000342801793 1038798578 /nfs/dbraw/zinc/79/85/78/1038798578.db2.gz YRRYZEURZCQUGY-UHFFFAOYSA-N 1 2 305.425 4.046 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)n1C ZINC000342801793 1038798593 /nfs/dbraw/zinc/79/85/93/1038798593.db2.gz YRRYZEURZCQUGY-UHFFFAOYSA-N 1 2 305.425 4.046 20 0 DIADLO Cc1c[nH+]c(CN(Cc2ccc3ccccc3c2)C2CC2)n1C ZINC000342801793 1038798612 /nfs/dbraw/zinc/79/86/12/1038798612.db2.gz YRRYZEURZCQUGY-UHFFFAOYSA-N 1 2 305.425 4.046 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+]2CCc3sccc3C2)o1 ZINC000075613654 1038808255 /nfs/dbraw/zinc/80/82/55/1038808255.db2.gz FFKPHBZQYXJLCI-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+]2CCc3sccc3C2)o1 ZINC000075613654 1038808282 /nfs/dbraw/zinc/80/82/82/1038808282.db2.gz FFKPHBZQYXJLCI-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO COCc1nc(C[N@@H+]2C[C@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000075900330 1038817706 /nfs/dbraw/zinc/81/77/06/1038817706.db2.gz SMPRXOKJBHPWIJ-WBMJQRKESA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@H+]2C[C@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000075900330 1038817734 /nfs/dbraw/zinc/81/77/34/1038817734.db2.gz SMPRXOKJBHPWIJ-WBMJQRKESA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@@H+]2CCCCC[C@@H]2c2ccc(C)o2)cs1 ZINC000075765151 1038825030 /nfs/dbraw/zinc/82/50/30/1038825030.db2.gz UJTDPGJQUFFEPO-OAHLLOKOSA-N 1 2 320.458 4.308 20 0 DIADLO COCc1nc(C[N@H+]2CCCCC[C@@H]2c2ccc(C)o2)cs1 ZINC000075765151 1038825048 /nfs/dbraw/zinc/82/50/48/1038825048.db2.gz UJTDPGJQUFFEPO-OAHLLOKOSA-N 1 2 320.458 4.308 20 0 DIADLO CCC[N@H+](Cc1nc(C)c(C)[nH]1)[C@@H](C)c1ccccc1OC ZINC000628139302 1038836132 /nfs/dbraw/zinc/83/61/32/1038836132.db2.gz AQNARSZFMSZCOD-HNNXBMFYSA-N 1 2 301.434 4.008 20 0 DIADLO CCC[N@@H+](Cc1nc(C)c(C)[nH]1)[C@@H](C)c1ccccc1OC ZINC000628139302 1038836156 /nfs/dbraw/zinc/83/61/56/1038836156.db2.gz AQNARSZFMSZCOD-HNNXBMFYSA-N 1 2 301.434 4.008 20 0 DIADLO CCCN(Cc1[nH]c(C)c(C)[nH+]1)[C@@H](C)c1ccccc1OC ZINC000628139302 1038836186 /nfs/dbraw/zinc/83/61/86/1038836186.db2.gz AQNARSZFMSZCOD-HNNXBMFYSA-N 1 2 301.434 4.008 20 0 DIADLO c1ccc(COCc2ccc(CNc3cccc[nH+]3)cc2)cc1 ZINC000076745715 1038855130 /nfs/dbraw/zinc/85/51/30/1038855130.db2.gz UCDYSHRPRLHHOI-UHFFFAOYSA-N 1 2 304.393 4.411 20 0 DIADLO Fc1ccc(-c2cnc(C[NH2+]C3(c4ccccc4)CC3)o2)cc1 ZINC000077377885 1038864068 /nfs/dbraw/zinc/86/40/68/1038864068.db2.gz JMNIOCBQBNFSHI-UHFFFAOYSA-N 1 2 308.356 4.260 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2nccn2Cc2ccccc2)c1 ZINC000608503030 1038872860 /nfs/dbraw/zinc/87/28/60/1038872860.db2.gz WNWPFTVENBKTKU-UHFFFAOYSA-N 1 2 319.452 4.180 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2nccn2Cc2ccccc2)c1 ZINC000608503030 1038872877 /nfs/dbraw/zinc/87/28/77/1038872877.db2.gz WNWPFTVENBKTKU-UHFFFAOYSA-N 1 2 319.452 4.180 20 0 DIADLO COc1ccc(-c2nc(C[NH2+]Cc3ccc(C)o3)cs2)cc1 ZINC000608578868 1038889257 /nfs/dbraw/zinc/88/92/57/1038889257.db2.gz LCSXHLXRKZOCKX-UHFFFAOYSA-N 1 2 314.410 4.010 20 0 DIADLO FC(F)(F)c1csc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)n1 ZINC001213085719 1038955774 /nfs/dbraw/zinc/95/57/74/1038955774.db2.gz TYUWNUMBIOXPIR-UHFFFAOYSA-N 1 2 310.304 4.296 20 0 DIADLO CC(C)(C)c1nc(C[NH+]2CCC(OC3CCCCC3)CC2)co1 ZINC000929425232 1038982504 /nfs/dbraw/zinc/98/25/04/1038982504.db2.gz SGIYJIKHQTWACS-UHFFFAOYSA-N 1 2 320.477 4.286 20 0 DIADLO CSc1ccccc1[C@H](C)[NH2+]Cc1noc2c1CCCC2 ZINC000685041256 1038995610 /nfs/dbraw/zinc/99/56/10/1038995610.db2.gz JHSDIKWWEADIPX-LBPRGKRZSA-N 1 2 302.443 4.126 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccc(CC(C)C)cc2)C(C)C)no1 ZINC000120638306 1039005399 /nfs/dbraw/zinc/00/53/99/1039005399.db2.gz TWLYGFDNNLNAHV-SFHVURJKSA-N 1 2 301.434 4.063 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc(F)cc1F ZINC000120904596 1039022822 /nfs/dbraw/zinc/02/28/22/1039022822.db2.gz TZECOFRSQQAGAL-LBPRGKRZSA-N 1 2 305.372 4.127 20 0 DIADLO c1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)n(Cc2ccccc2)n1 ZINC001213086146 1039026422 /nfs/dbraw/zinc/02/64/22/1039026422.db2.gz HXMPKNZQHUMOOT-UHFFFAOYSA-N 1 2 315.380 4.065 20 0 DIADLO CC[C@H](NC(=O)Nc1cc(C)[nH+]cc1C)c1ccc(Cl)cc1 ZINC000534325844 1039027191 /nfs/dbraw/zinc/02/71/91/1039027191.db2.gz XPMXMHTXEJNUDX-HNNXBMFYSA-N 1 2 317.820 4.047 20 0 DIADLO COCc1cnc(C[N@@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)s1 ZINC000342930996 1039028970 /nfs/dbraw/zinc/02/89/70/1039028970.db2.gz JCOIEFADOJFWSM-MLGOLLRUSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1cnc(C[N@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)s1 ZINC000342930996 1039028988 /nfs/dbraw/zinc/02/89/88/1039028988.db2.gz JCOIEFADOJFWSM-MLGOLLRUSA-N 1 2 320.433 4.012 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(OC2CCCCC2)nc1)c1cscn1 ZINC000534329599 1039030593 /nfs/dbraw/zinc/03/05/93/1039030593.db2.gz OHSZQWSWEUIVJJ-CYBMUJFWSA-N 1 2 317.458 4.100 20 0 DIADLO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@@H](C)c1nc(C)cs1 ZINC000091318665 1039041110 /nfs/dbraw/zinc/04/11/10/1039041110.db2.gz GAXNBJGSCRTXIG-OLZOCXBDSA-N 1 2 314.458 4.233 20 0 DIADLO COC[C@H]([NH2+]Cc1c(F)cccc1F)c1cccc(Cl)c1 ZINC000685059396 1039057201 /nfs/dbraw/zinc/05/72/01/1039057201.db2.gz FMACNFJWYNLNBW-INIZCTEOSA-N 1 2 311.759 4.096 20 0 DIADLO Fc1cnc(Cl)cc1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001140608642 1039059688 /nfs/dbraw/zinc/05/96/88/1039059688.db2.gz FQTSJYSAGMXXPH-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Fc1cnc(Cl)cc1C[N@@H+]1CC=C(c2ccccc2)CC1 ZINC001140608642 1039059705 /nfs/dbraw/zinc/05/97/05/1039059705.db2.gz FQTSJYSAGMXXPH-UHFFFAOYSA-N 1 2 302.780 4.163 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)N(C)Cc1[nH]c(C)c(C)[nH+]1 ZINC000628187133 1039067736 /nfs/dbraw/zinc/06/77/36/1039067736.db2.gz GOHFGBVXGLULGQ-ZDUSSCGKSA-N 1 2 306.479 4.108 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)[C@@H](C)c2ccccc2C)n1 ZINC000121821008 1039069714 /nfs/dbraw/zinc/06/97/14/1039069714.db2.gz ZYGZOJMSRTZMTI-KBPBESRZSA-N 1 2 319.474 4.385 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)[C@@H](C)c2ccccc2C)n1 ZINC000121821008 1039069727 /nfs/dbraw/zinc/06/97/27/1039069727.db2.gz ZYGZOJMSRTZMTI-KBPBESRZSA-N 1 2 319.474 4.385 20 0 DIADLO Cc1cc(C)c(CNC(=O)C[C@H](c2ccccc2)C(C)C)c[nH+]1 ZINC000456830753 1039082590 /nfs/dbraw/zinc/08/25/90/1039082590.db2.gz DHJPDYUGVIXQPY-IBGZPJMESA-N 1 2 310.441 4.145 20 0 DIADLO CC[C@@H](C)[C@@H](C(=O)NCc1c[nH+]c(C)cc1C)c1ccccc1 ZINC000456826200 1039083597 /nfs/dbraw/zinc/08/35/97/1039083597.db2.gz AGWCNUNPNDBBRE-AUUYWEPGSA-N 1 2 310.441 4.145 20 0 DIADLO Cc1cc(C)c(CNC(=O)C2CCC(c3ccccc3)CC2)c[nH+]1 ZINC000456840268 1039086750 /nfs/dbraw/zinc/08/67/50/1039086750.db2.gz NMFBPEAMOGQFMC-UHFFFAOYSA-N 1 2 322.452 4.289 20 0 DIADLO Fc1cccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1OC(F)F ZINC000659993862 1039091561 /nfs/dbraw/zinc/09/15/61/1039091561.db2.gz KDRDRFOECOZENM-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(C[N@H+]2CCC[C@@H]2c2ccccn2)c1OC(F)F ZINC000659993862 1039091582 /nfs/dbraw/zinc/09/15/82/1039091582.db2.gz KDRDRFOECOZENM-OAHLLOKOSA-N 1 2 322.330 4.159 20 0 DIADLO Cc1noc(C[NH2+][C@H](CCC(C)C)c2ccc(Cl)cc2)n1 ZINC000122252774 1039091991 /nfs/dbraw/zinc/09/19/91/1039091991.db2.gz RGYSVRIOPWKNRK-OAHLLOKOSA-N 1 2 307.825 4.299 20 0 DIADLO CCCc1nc(C[N@H+]2CC=C(c3ccc(O)cc3)CC2)cs1 ZINC000343006090 1039095358 /nfs/dbraw/zinc/09/53/58/1039095358.db2.gz DJOBRCLAMBPALI-UHFFFAOYSA-N 1 2 314.454 4.091 20 0 DIADLO CCCc1nc(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)cs1 ZINC000343006090 1039095373 /nfs/dbraw/zinc/09/53/73/1039095373.db2.gz DJOBRCLAMBPALI-UHFFFAOYSA-N 1 2 314.454 4.091 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H]2CCCC2(F)F)ccc1OC(F)F ZINC000672621697 1039114908 /nfs/dbraw/zinc/11/49/08/1039114908.db2.gz DZYSIINMFGHMOP-NOZJJQNGSA-N 1 2 321.314 4.135 20 0 DIADLO CC(C)n1ccc(Nc2cc(Br)cn3cc[nH+]c23)c1 ZINC001203159337 1039135603 /nfs/dbraw/zinc/13/56/03/1039135603.db2.gz KDBGJYSXLJNESD-UHFFFAOYSA-N 1 2 319.206 4.223 20 0 DIADLO CC(C)[N@H+](Cc1ccco1)Cc1nc2cc(Cl)ccc2n1C ZINC000349840622 1039179609 /nfs/dbraw/zinc/17/96/09/1039179609.db2.gz ROZLKHJAWRHWTQ-UHFFFAOYSA-N 1 2 317.820 4.230 20 0 DIADLO CC(C)[N@@H+](Cc1ccco1)Cc1nc2cc(Cl)ccc2n1C ZINC000349840622 1039179617 /nfs/dbraw/zinc/17/96/17/1039179617.db2.gz ROZLKHJAWRHWTQ-UHFFFAOYSA-N 1 2 317.820 4.230 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](C)c2nc(-c3ccncc3)cs2)o1 ZINC000150803225 1039186936 /nfs/dbraw/zinc/18/69/36/1039186936.db2.gz DUXCOUGKLKMIPD-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO Brc1cc(C[N@@H+]2CCC[C@@H]2c2ccncc2)cs1 ZINC000125600918 1039259657 /nfs/dbraw/zinc/25/96/57/1039259657.db2.gz HXTZEKZTOLHPIP-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cc(C[N@H+]2CCC[C@@H]2c2ccncc2)cs1 ZINC000125600918 1039259667 /nfs/dbraw/zinc/25/96/67/1039259667.db2.gz HXTZEKZTOLHPIP-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO CCCOc1ccc(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000126015725 1039280942 /nfs/dbraw/zinc/28/09/42/1039280942.db2.gz HPWVVHMYNBORFR-IBGZPJMESA-N 1 2 321.424 4.078 20 0 DIADLO Clc1cccc2nc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cn21 ZINC001213087942 1039286487 /nfs/dbraw/zinc/28/64/87/1039286487.db2.gz ICZPYABDTQTWEU-UHFFFAOYSA-N 1 2 309.760 4.121 20 0 DIADLO COc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC000155938200 1039294485 /nfs/dbraw/zinc/29/44/85/1039294485.db2.gz BXESTGFJFKXYNF-UHFFFAOYSA-N 1 2 313.788 4.146 20 0 DIADLO FC(F)(F)Oc1ccncc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213088195 1039296225 /nfs/dbraw/zinc/29/62/25/1039296225.db2.gz VMBKJCFWUBCRIP-UHFFFAOYSA-N 1 2 320.274 4.114 20 0 DIADLO Fc1c(Cl)ccc(C[N@H+]2CC[C@@H](F)C(F)(F)CC2)c1F ZINC001233207779 1039325731 /nfs/dbraw/zinc/32/57/31/1039325731.db2.gz PYOSCBXXVSRVKM-SNVBAGLBSA-N 1 2 313.697 4.187 20 0 DIADLO Fc1c(Cl)ccc(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c1F ZINC001233207779 1039325753 /nfs/dbraw/zinc/32/57/53/1039325753.db2.gz PYOSCBXXVSRVKM-SNVBAGLBSA-N 1 2 313.697 4.187 20 0 DIADLO Cn1cccc1C[N@H+](C)Cc1cnc(C2CCCCC2)s1 ZINC000539819531 1039347000 /nfs/dbraw/zinc/34/70/00/1039347000.db2.gz JOFZQOLKZPKPMO-UHFFFAOYSA-N 1 2 303.475 4.161 20 0 DIADLO Cn1cccc1C[N@@H+](C)Cc1cnc(C2CCCCC2)s1 ZINC000539819531 1039347016 /nfs/dbraw/zinc/34/70/16/1039347016.db2.gz JOFZQOLKZPKPMO-UHFFFAOYSA-N 1 2 303.475 4.161 20 0 DIADLO COc1ccccc1[C@@H](C)CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000343272201 1039361052 /nfs/dbraw/zinc/36/10/52/1039361052.db2.gz TVEHOMQAFOZMSM-LBPRGKRZSA-N 1 2 323.396 4.012 20 0 DIADLO COCC[N@H+](Cc1occc1C)Cc1ccc(F)cc1Cl ZINC000539834326 1039362333 /nfs/dbraw/zinc/36/23/33/1039362333.db2.gz SOFXUINPDDVGFP-UHFFFAOYSA-N 1 2 311.784 4.029 20 0 DIADLO COCC[N@@H+](Cc1occc1C)Cc1ccc(F)cc1Cl ZINC000539834326 1039362347 /nfs/dbraw/zinc/36/23/47/1039362347.db2.gz SOFXUINPDDVGFP-UHFFFAOYSA-N 1 2 311.784 4.029 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1c(F)cccc1F)CCC2 ZINC000539851043 1039375139 /nfs/dbraw/zinc/37/51/39/1039375139.db2.gz KDZOHKJDWPUABZ-HNNXBMFYSA-N 1 2 322.424 4.493 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1c(F)cccc1F)CCC2 ZINC000539851043 1039375155 /nfs/dbraw/zinc/37/51/55/1039375155.db2.gz KDZOHKJDWPUABZ-HNNXBMFYSA-N 1 2 322.424 4.493 20 0 DIADLO CC(=O)c1cc(C[N@@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)on1 ZINC000563722827 1039391054 /nfs/dbraw/zinc/39/10/54/1039391054.db2.gz LLMPSLYAZDLLQC-LLVKDONJSA-N 1 2 318.804 4.256 20 0 DIADLO CC(=O)c1cc(C[N@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)on1 ZINC000563722827 1039391070 /nfs/dbraw/zinc/39/10/70/1039391070.db2.gz LLMPSLYAZDLLQC-LLVKDONJSA-N 1 2 318.804 4.256 20 0 DIADLO CC(C)n1cnnc1C[N@H+](C)[C@H](C)c1cccc2ccccc21 ZINC000583601189 1039392598 /nfs/dbraw/zinc/39/25/98/1039392598.db2.gz JKCRICZTCKCAHW-OAHLLOKOSA-N 1 2 308.429 4.205 20 0 DIADLO CC(C)n1cnnc1C[N@@H+](C)[C@H](C)c1cccc2ccccc21 ZINC000583601189 1039392611 /nfs/dbraw/zinc/39/26/11/1039392611.db2.gz JKCRICZTCKCAHW-OAHLLOKOSA-N 1 2 308.429 4.205 20 0 DIADLO Cc1cc(=O)[nH]c2cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)ccc12 ZINC001213090184 1039423095 /nfs/dbraw/zinc/42/30/95/1039423095.db2.gz YJDKJHCGSXLVLF-UHFFFAOYSA-N 1 2 316.364 4.383 20 0 DIADLO Cc1nc2ccc(Nc3ccc[nH+]c3N3CCCCC3)cc2o1 ZINC001213063872 1039430249 /nfs/dbraw/zinc/43/02/49/1039430249.db2.gz IJSXVHUQYQXCMF-UHFFFAOYSA-N 1 2 308.385 4.265 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000278433951 1039468494 /nfs/dbraw/zinc/46/84/94/1039468494.db2.gz KKFDGNGTDGZIMG-LBPRGKRZSA-N 1 2 315.417 4.332 20 0 DIADLO Cc1nc(F)ccc1C[N@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000278433951 1039468500 /nfs/dbraw/zinc/46/85/00/1039468500.db2.gz KKFDGNGTDGZIMG-LBPRGKRZSA-N 1 2 315.417 4.332 20 0 DIADLO C[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1csc(C(F)(F)F)c1 ZINC000926530623 1039472127 /nfs/dbraw/zinc/47/21/27/1039472127.db2.gz BPNMLKZZNGNBOD-QXEWZRGKSA-N 1 2 315.364 4.320 20 0 DIADLO CC(=O)c1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc(C(C)=O)c1 ZINC001213090770 1039474845 /nfs/dbraw/zinc/47/48/45/1039474845.db2.gz FPKAOQBJFOTXEM-UHFFFAOYSA-N 1 2 319.364 4.226 20 0 DIADLO Clc1ccc(C[N@@H+]2CCC23CCC3)cc1Br ZINC000540482657 1039501668 /nfs/dbraw/zinc/50/16/68/1039501668.db2.gz VUKUBQKVUCINAN-UHFFFAOYSA-N 1 2 300.627 4.231 20 0 DIADLO Clc1ccc(C[N@H+]2CCC23CCC3)cc1Br ZINC000540482657 1039501686 /nfs/dbraw/zinc/50/16/86/1039501686.db2.gz VUKUBQKVUCINAN-UHFFFAOYSA-N 1 2 300.627 4.231 20 0 DIADLO CN(Cc1cccc(Cl)c1Cl)Cc1cccc2[nH+]ccn21 ZINC000540505401 1039506993 /nfs/dbraw/zinc/50/69/93/1039506993.db2.gz PDQYWJAEAJAUBH-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1cccc(Cl)c1Cl)Cc1cccc2nccn21 ZINC000540505401 1039507006 /nfs/dbraw/zinc/50/70/06/1039507006.db2.gz PDQYWJAEAJAUBH-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@H+](Cc1cccc(Cl)c1Cl)Cc1cccc2nccn21 ZINC000540505401 1039507019 /nfs/dbraw/zinc/50/70/19/1039507019.db2.gz PDQYWJAEAJAUBH-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1ccc(Cl)nc1Cl ZINC000278506580 1039514266 /nfs/dbraw/zinc/51/42/66/1039514266.db2.gz AWVKIGUVWJFNNY-JTQLQIEISA-N 1 2 311.212 4.287 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc(Cl)nc1Cl ZINC000278506580 1039514276 /nfs/dbraw/zinc/51/42/76/1039514276.db2.gz AWVKIGUVWJFNNY-JTQLQIEISA-N 1 2 311.212 4.287 20 0 DIADLO C[C@H]1CSCC[N@@H+]1Cc1ccc(Cl)cc1Br ZINC000583998991 1039542792 /nfs/dbraw/zinc/54/27/92/1039542792.db2.gz ROZLGTXFIIPFRI-VIFPVBQESA-N 1 2 320.683 4.040 20 0 DIADLO C[C@H]1CSCC[N@H+]1Cc1ccc(Cl)cc1Br ZINC000583998991 1039542799 /nfs/dbraw/zinc/54/27/99/1039542799.db2.gz ROZLGTXFIIPFRI-VIFPVBQESA-N 1 2 320.683 4.040 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1ncc(C(F)(F)F)s1 ZINC000278568110 1039553317 /nfs/dbraw/zinc/55/33/17/1039553317.db2.gz DEKBPYKPHACPLV-UHFFFAOYSA-N 1 2 315.364 4.148 20 0 DIADLO C[C@@H](Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1cc(F)cc(F)c1 ZINC000540834717 1039574417 /nfs/dbraw/zinc/57/44/17/1039574417.db2.gz ZFZPOJKIFSHCDQ-LLVKDONJSA-N 1 2 317.314 4.463 20 0 DIADLO CC(C)[C@@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)CCO1 ZINC000540917313 1039594210 /nfs/dbraw/zinc/59/42/10/1039594210.db2.gz ZQAZSFKTCMHCKL-INIZCTEOSA-N 1 2 308.491 4.048 20 0 DIADLO CC(C)[C@@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)CCO1 ZINC000540917313 1039594226 /nfs/dbraw/zinc/59/42/26/1039594226.db2.gz ZQAZSFKTCMHCKL-INIZCTEOSA-N 1 2 308.491 4.048 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)s1 ZINC000540952989 1039600743 /nfs/dbraw/zinc/60/07/43/1039600743.db2.gz CVZKQTWATFODIL-QMMMGPOBSA-N 1 2 307.806 4.097 20 0 DIADLO c1cc2c(s1)CC[N@@H+](Cc1nc(-c3ccccc3)cs1)C2 ZINC000349991067 1039609309 /nfs/dbraw/zinc/60/93/09/1039609309.db2.gz OAGPSUNYNHSQAN-UHFFFAOYSA-N 1 2 312.463 4.430 20 0 DIADLO c1cc2c(s1)CC[N@H+](Cc1nc(-c3ccccc3)cs1)C2 ZINC000349991067 1039609321 /nfs/dbraw/zinc/60/93/21/1039609321.db2.gz OAGPSUNYNHSQAN-UHFFFAOYSA-N 1 2 312.463 4.430 20 0 DIADLO CN(C)c1ccccc1C[N@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000584136993 1039617909 /nfs/dbraw/zinc/61/79/09/1039617909.db2.gz YTAJKETWFFHCRZ-UHFFFAOYSA-N 1 2 317.502 4.139 20 0 DIADLO CN(C)c1ccccc1C[N@@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000584136993 1039617916 /nfs/dbraw/zinc/61/79/16/1039617916.db2.gz YTAJKETWFFHCRZ-UHFFFAOYSA-N 1 2 317.502 4.139 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ncc(Br)s1)c1ccsc1 ZINC000381318336 1039672614 /nfs/dbraw/zinc/67/26/14/1039672614.db2.gz NWIXNYSAAKSINO-HTQZYQBOSA-N 1 2 317.277 4.379 20 0 DIADLO CC(C)([NH2+]Cc1ncc(C(F)(F)F)s1)c1cccc(F)c1 ZINC000278708951 1039662123 /nfs/dbraw/zinc/66/21/23/1039662123.db2.gz RRAXFTDCAQUQRZ-UHFFFAOYSA-N 1 2 318.339 4.326 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@H](C)c2ncc(-c3ccccc3)o2)[nH+]1 ZINC000081002624 1039697993 /nfs/dbraw/zinc/69/79/93/1039697993.db2.gz QLJUEZAKFQVZIQ-LLVKDONJSA-N 1 2 319.368 4.094 20 0 DIADLO Cc1ccc(-c2nnc(C[N@H+]3C[C@H](C)[C@@H]3c3ccccc3)o2)cc1 ZINC000081573659 1039719451 /nfs/dbraw/zinc/71/94/51/1039719451.db2.gz QJMAHCSCFXLYDC-HNAYVOBHSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccc(-c2nnc(C[N@@H+]3C[C@H](C)[C@@H]3c3ccccc3)o2)cc1 ZINC000081573659 1039719467 /nfs/dbraw/zinc/71/94/67/1039719467.db2.gz QJMAHCSCFXLYDC-HNAYVOBHSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2ccc(F)cc2Cl)C2CC2)n1 ZINC000136224567 1039724248 /nfs/dbraw/zinc/72/42/48/1039724248.db2.gz YKMPTSDIHGRYCA-CQSZACIVSA-N 1 2 310.825 4.485 20 0 DIADLO COC[C@@H]([NH2+]Cc1cnc(C2CCCCC2)s1)c1ccco1 ZINC000084050142 1039739585 /nfs/dbraw/zinc/73/95/85/1039739585.db2.gz GKADRHFFCVBBNG-OAHLLOKOSA-N 1 2 320.458 4.261 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(C2CCCCC2)s1)c1nccs1 ZINC000084022668 1039740689 /nfs/dbraw/zinc/74/06/89/1039740689.db2.gz WFSZWDNQEGLMDH-NSHDSACASA-N 1 2 307.488 4.498 20 0 DIADLO O=C(C[N@H+](CCC(F)(F)F)CC1CC1)c1c[nH]c2ccccc12 ZINC000084138260 1039741174 /nfs/dbraw/zinc/74/11/74/1039741174.db2.gz XCAPTEKOZVYCKZ-UHFFFAOYSA-N 1 2 324.346 4.015 20 0 DIADLO O=C(C[N@@H+](CCC(F)(F)F)CC1CC1)c1c[nH]c2ccccc12 ZINC000084138260 1039741195 /nfs/dbraw/zinc/74/11/95/1039741195.db2.gz XCAPTEKOZVYCKZ-UHFFFAOYSA-N 1 2 324.346 4.015 20 0 DIADLO Cc1cc(N(Cc2ccco2)Cc2cccnc2)nc(C(C)C)[nH+]1 ZINC000089634825 1039780058 /nfs/dbraw/zinc/78/00/58/1039780058.db2.gz DDUZSPSSHPFERX-UHFFFAOYSA-N 1 2 322.412 4.103 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+]1CCOCC2(CC2)C1 ZINC000542059560 1039786673 /nfs/dbraw/zinc/78/66/73/1039786673.db2.gz OHHBFXATJVWVNT-NSHDSACASA-N 1 2 300.229 4.167 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+]1CCOCC2(CC2)C1 ZINC000542059560 1039786692 /nfs/dbraw/zinc/78/66/92/1039786692.db2.gz OHHBFXATJVWVNT-NSHDSACASA-N 1 2 300.229 4.167 20 0 DIADLO Cc1ncc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2Cl)c(C)n1 ZINC000090180301 1039794101 /nfs/dbraw/zinc/79/41/01/1039794101.db2.gz RMHZJJLCOMZEJG-GXSJLCMTSA-N 1 2 307.800 4.298 20 0 DIADLO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2Cl)c(C)n1 ZINC000090180299 1039794658 /nfs/dbraw/zinc/79/46/58/1039794658.db2.gz RMHZJJLCOMZEJG-ONGXEEELSA-N 1 2 307.800 4.298 20 0 DIADLO Cc1noc(C)c1C[C@H](C)Nc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC000090094239 1039800762 /nfs/dbraw/zinc/80/07/62/1039800762.db2.gz HRTGSMOPEFERQS-LBPRGKRZSA-N 1 2 316.449 4.371 20 0 DIADLO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cc1ncc(Br)s1 ZINC000542156136 1039802562 /nfs/dbraw/zinc/80/25/62/1039802562.db2.gz XKRLGKSOEFFMFW-QWRGUYRKSA-N 1 2 317.296 4.306 20 0 DIADLO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1ncc(Br)s1 ZINC000542156136 1039802580 /nfs/dbraw/zinc/80/25/80/1039802580.db2.gz XKRLGKSOEFFMFW-QWRGUYRKSA-N 1 2 317.296 4.306 20 0 DIADLO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cc1ncc(Br)s1 ZINC000542156134 1039803051 /nfs/dbraw/zinc/80/30/51/1039803051.db2.gz XKRLGKSOEFFMFW-GHMZBOCLSA-N 1 2 317.296 4.306 20 0 DIADLO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1ncc(Br)s1 ZINC000542156134 1039803072 /nfs/dbraw/zinc/80/30/72/1039803072.db2.gz XKRLGKSOEFFMFW-GHMZBOCLSA-N 1 2 317.296 4.306 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000090546957 1039812895 /nfs/dbraw/zinc/81/28/95/1039812895.db2.gz PGXGEFIXCOCRAN-HNNXBMFYSA-N 1 2 313.445 4.248 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)[C@H](C)c1ccncc1 ZINC000091986411 1039865313 /nfs/dbraw/zinc/86/53/13/1039865313.db2.gz UVGHRRUFTPZUGH-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)[C@H](C)c1ccncc1 ZINC000091986411 1039865340 /nfs/dbraw/zinc/86/53/40/1039865340.db2.gz UVGHRRUFTPZUGH-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO CCn1c(C[N@H+]([C@H](C)c2ccco2)C2CC2)nc2ccccc21 ZINC000092484137 1039872211 /nfs/dbraw/zinc/87/22/11/1039872211.db2.gz ONJQTNAVNXBHDB-CQSZACIVSA-N 1 2 309.413 4.375 20 0 DIADLO CCn1c(C[N@@H+]([C@H](C)c2ccco2)C2CC2)nc2ccccc21 ZINC000092484137 1039872241 /nfs/dbraw/zinc/87/22/41/1039872241.db2.gz ONJQTNAVNXBHDB-CQSZACIVSA-N 1 2 309.413 4.375 20 0 DIADLO CCCc1csc(CNc2ccc(N3CCCCC3)[nH+]c2)n1 ZINC000491876139 1039886664 /nfs/dbraw/zinc/88/66/64/1039886664.db2.gz XIWZFPZXBYZLBV-UHFFFAOYSA-N 1 2 316.474 4.093 20 0 DIADLO Cc1cccnc1C[NH2+][C@H](c1cccc(Cl)c1)c1ccccn1 ZINC000093200182 1039896482 /nfs/dbraw/zinc/89/64/82/1039896482.db2.gz JGMJCYWRVRMCIR-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO CCn1nc(C)c(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1C ZINC000093686115 1039899960 /nfs/dbraw/zinc/89/99/60/1039899960.db2.gz IHLMYXILUWRQRW-QGZVFWFLSA-N 1 2 303.837 4.120 20 0 DIADLO CCn1nc(C)c(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1C ZINC000093686115 1039899979 /nfs/dbraw/zinc/89/99/79/1039899979.db2.gz IHLMYXILUWRQRW-QGZVFWFLSA-N 1 2 303.837 4.120 20 0 DIADLO FC(F)(F)c1cccnc1C[N@@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000669942756 1039904219 /nfs/dbraw/zinc/90/42/19/1039904219.db2.gz UWEYPGWIDWNFAQ-MRXNPFEDSA-N 1 2 324.321 4.171 20 0 DIADLO FC(F)(F)c1cccnc1C[N@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000669942756 1039904238 /nfs/dbraw/zinc/90/42/38/1039904238.db2.gz UWEYPGWIDWNFAQ-MRXNPFEDSA-N 1 2 324.321 4.171 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](Cc3ccccc3)CCO2)c(Cl)c1 ZINC000143666725 1039947006 /nfs/dbraw/zinc/94/70/06/1039947006.db2.gz JPCVKIQFCZHGIY-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](Cc3ccccc3)CCO2)c(Cl)c1 ZINC000143666725 1039947021 /nfs/dbraw/zinc/94/70/21/1039947021.db2.gz JPCVKIQFCZHGIY-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(-c3ccsc3)cc2)s1 ZINC000278774943 1039964481 /nfs/dbraw/zinc/96/44/81/1039964481.db2.gz NIFUNLINYFNIMA-LLVKDONJSA-N 1 2 315.467 4.426 20 0 DIADLO Cc1ncccc1C[NH2+][C@H](c1cccc(Cl)c1)c1ccccn1 ZINC000153382098 1039995136 /nfs/dbraw/zinc/99/51/36/1039995136.db2.gz CVOJLQWHNQOBNI-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO C[C@H]1C[N@H+](Cc2nc(-c3ccc(F)cc3)no2)[C@@H]1c1ccccc1 ZINC000174986254 1039999269 /nfs/dbraw/zinc/99/92/69/1039999269.db2.gz IWCBXPZQXRUIQG-UGSOOPFHSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nc(-c3ccc(F)cc3)no2)[C@@H]1c1ccccc1 ZINC000174986254 1039999283 /nfs/dbraw/zinc/99/92/83/1039999283.db2.gz IWCBXPZQXRUIQG-UGSOOPFHSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)Cc1nccs1 ZINC000175076211 1040005732 /nfs/dbraw/zinc/00/57/32/1040005732.db2.gz GMEHAFCHWNEDHX-SNVBAGLBSA-N 1 2 300.349 4.355 20 0 DIADLO C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)Cc1nccs1 ZINC000175076211 1040005746 /nfs/dbraw/zinc/00/57/46/1040005746.db2.gz GMEHAFCHWNEDHX-SNVBAGLBSA-N 1 2 300.349 4.355 20 0 DIADLO c1cn(Cc2ccc(N[C@H]3CCC[C@@H]3c3ccccc3)nc2)c[nH+]1 ZINC000685447610 1040055409 /nfs/dbraw/zinc/05/54/09/1040055409.db2.gz PKDQHAAVCCJFRJ-MOPGFXCFSA-N 1 2 318.424 4.075 20 0 DIADLO CC(C)C[C@H](C)C[C@H](C)Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000685447455 1040057919 /nfs/dbraw/zinc/05/79/19/1040057919.db2.gz WXPYWVCIMONZQN-HOTGVXAUSA-N 1 2 300.450 4.199 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2cc3cnccc3o2)o1 ZINC000657892304 1040082199 /nfs/dbraw/zinc/08/21/99/1040082199.db2.gz XPBSKMPNRGYCDI-DOMZBBRYSA-N 1 2 314.385 4.022 20 0 DIADLO Cc1c(F)cccc1-c1ccc(C[NH2+]Cc2nccs2)o1 ZINC000115612910 1040109854 /nfs/dbraw/zinc/10/98/54/1040109854.db2.gz GAORBKWSKVAUMH-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO CCCC[C@@H](CC)C(=O)N1CC[NH2+][C@@H](c2cccc(Cl)c2)C1 ZINC000513997324 1040121399 /nfs/dbraw/zinc/12/13/99/1040121399.db2.gz QUVINZNFPGHQTR-RHSMWYFYSA-N 1 2 322.880 4.029 20 0 DIADLO CC(C)c1noc(C[N@H+](Cc2ccc(F)cc2)C(C)(C)C)n1 ZINC000177868044 1040146035 /nfs/dbraw/zinc/14/60/35/1040146035.db2.gz OFZXMIBXDQZVRJ-UHFFFAOYSA-N 1 2 305.397 4.133 20 0 DIADLO CC(C)c1noc(C[N@@H+](Cc2ccc(F)cc2)C(C)(C)C)n1 ZINC000177868044 1040146040 /nfs/dbraw/zinc/14/60/40/1040146040.db2.gz OFZXMIBXDQZVRJ-UHFFFAOYSA-N 1 2 305.397 4.133 20 0 DIADLO Cc1cn[nH]c1C[NH2+]Cc1ccc(C)cc1O[C@@H](C)CC(C)C ZINC000685618500 1040161241 /nfs/dbraw/zinc/16/12/41/1040161241.db2.gz DHFFKSQMWDADGA-INIZCTEOSA-N 1 2 315.461 4.130 20 0 DIADLO Cc1c[nH]nc1C[NH2+]Cc1ccc(C)cc1O[C@@H](C)CC(C)C ZINC000685618500 1040161252 /nfs/dbraw/zinc/16/12/52/1040161252.db2.gz DHFFKSQMWDADGA-INIZCTEOSA-N 1 2 315.461 4.130 20 0 DIADLO C/C(=C/c1ccccc1OC(F)F)C[NH2+][C@@H]1CCCC1(F)F ZINC000685623522 1040166660 /nfs/dbraw/zinc/16/66/60/1040166660.db2.gz MSDZZEJRIAFEBP-RBJHHQRMSA-N 1 2 317.326 4.469 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1cn2c(n1)CCCC2 ZINC000924524192 1040197988 /nfs/dbraw/zinc/19/79/88/1040197988.db2.gz JQOHNSAELLZWPM-QWHCGFSZSA-N 1 2 303.837 4.285 20 0 DIADLO C[N@H+](Cc1cscn1)Cc1cccc(NCC(C)(C)C)c1 ZINC000131880854 1040200322 /nfs/dbraw/zinc/20/03/22/1040200322.db2.gz OYWFWEHNMCXYDP-UHFFFAOYSA-N 1 2 303.475 4.233 20 0 DIADLO C[N@@H+](Cc1cscn1)Cc1cccc(NCC(C)(C)C)c1 ZINC000131880854 1040200329 /nfs/dbraw/zinc/20/03/29/1040200329.db2.gz OYWFWEHNMCXYDP-UHFFFAOYSA-N 1 2 303.475 4.233 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1cc2cnccc2o1 ZINC000657942081 1040203719 /nfs/dbraw/zinc/20/37/19/1040203719.db2.gz ABINVYUBTSIMHR-CQSZACIVSA-N 1 2 322.412 4.386 20 0 DIADLO c1[nH+]c(-c2cccc(N[C@H]3COC4(CCC4)C3)c2)n2c1CCCC2 ZINC000657995000 1040256587 /nfs/dbraw/zinc/25/65/87/1040256587.db2.gz XRBNIMBTNBGERF-QGZVFWFLSA-N 1 2 323.440 4.010 20 0 DIADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ncnc21)c1cc2cc(Cl)ccc2o1 ZINC000658101072 1040312651 /nfs/dbraw/zinc/31/26/51/1040312651.db2.gz KHWWBEUWJFKPPF-GBIKHYSHSA-N 1 2 316.792 4.034 20 0 DIADLO COc1cccc(OC)c1C[NH2+][C@H](C)c1ccc(F)cc1Cl ZINC000658120480 1040320330 /nfs/dbraw/zinc/32/03/30/1040320330.db2.gz IUQPEWZZWBQYPA-LLVKDONJSA-N 1 2 323.795 4.347 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+]1CCc2c(F)cccc2C1 ZINC001140730709 1040518854 /nfs/dbraw/zinc/51/88/54/1040518854.db2.gz XMVBHNURHNIQEH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc(Cl)c1C[N@H+]1CCc2c(F)cccc2C1 ZINC001140730709 1040518872 /nfs/dbraw/zinc/51/88/72/1040518872.db2.gz XMVBHNURHNIQEH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CCC[C@@H](C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000023889305 1040527504 /nfs/dbraw/zinc/52/75/04/1040527504.db2.gz HZPNJILGZITJGH-LJQANCHMSA-N 1 2 319.408 4.395 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000924540754 1040571986 /nfs/dbraw/zinc/57/19/86/1040571986.db2.gz GKDOXENAUGERTE-SFYZADRCSA-N 1 2 300.189 4.097 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC000926672118 1040602334 /nfs/dbraw/zinc/60/23/34/1040602334.db2.gz LJEDNTKIUCZKBU-CYBMUJFWSA-N 1 2 311.212 4.457 20 0 DIADLO C[C@@H]([NH2+]Cc1ccsc1C(F)(F)F)c1c(F)cncc1F ZINC000628275927 1040633088 /nfs/dbraw/zinc/63/30/88/1040633088.db2.gz KBYKNNPWYNNWCZ-SSDOTTSWSA-N 1 2 322.302 4.291 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]Cc2ccc(Cl)c(Cl)c2)nn1 ZINC000926701854 1040707432 /nfs/dbraw/zinc/70/74/32/1040707432.db2.gz CFDREDZWHLCVKI-JTQLQIEISA-N 1 2 313.232 4.017 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000066155370 1040723354 /nfs/dbraw/zinc/72/33/54/1040723354.db2.gz YCNJPUXMDYSFFB-LBPRGKRZSA-N 1 2 317.820 4.321 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000066155370 1040723370 /nfs/dbraw/zinc/72/33/70/1040723370.db2.gz YCNJPUXMDYSFFB-LBPRGKRZSA-N 1 2 317.820 4.321 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3)C2)s1 ZINC000685833963 1040766280 /nfs/dbraw/zinc/76/62/80/1040766280.db2.gz XDSPONIGOULICQ-OAHLLOKOSA-N 1 2 323.458 4.183 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3)C2)s1 ZINC000685833963 1040766298 /nfs/dbraw/zinc/76/62/98/1040766298.db2.gz XDSPONIGOULICQ-OAHLLOKOSA-N 1 2 323.458 4.183 20 0 DIADLO Cc1cn[nH]c1C[N@H+](Cc1ccccc1F)C1CCCCC1 ZINC000685836157 1040772838 /nfs/dbraw/zinc/77/28/38/1040772838.db2.gz QCEUKBVNQRWGQU-UHFFFAOYSA-N 1 2 301.409 4.192 20 0 DIADLO Cc1cn[nH]c1C[N@@H+](Cc1ccccc1F)C1CCCCC1 ZINC000685836157 1040772852 /nfs/dbraw/zinc/77/28/52/1040772852.db2.gz QCEUKBVNQRWGQU-UHFFFAOYSA-N 1 2 301.409 4.192 20 0 DIADLO FC(F)(F)c1cscc1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000685838054 1040775932 /nfs/dbraw/zinc/77/59/32/1040775932.db2.gz YTSCEMOWSKPGBL-UHFFFAOYSA-N 1 2 315.282 4.461 20 0 DIADLO FC(F)(F)c1cscc1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000685838054 1040775948 /nfs/dbraw/zinc/77/59/48/1040775948.db2.gz YTSCEMOWSKPGBL-UHFFFAOYSA-N 1 2 315.282 4.461 20 0 DIADLO CC(C)(C)[C@@H]1C[N@H+](Cc2cnc(C3CCCC3)s2)CCO1 ZINC000448358677 1040790012 /nfs/dbraw/zinc/79/00/12/1040790012.db2.gz GIHADOAXIYUVKF-HNNXBMFYSA-N 1 2 308.491 4.048 20 0 DIADLO CC(C)(C)[C@@H]1C[N@@H+](Cc2cnc(C3CCCC3)s2)CCO1 ZINC000448358677 1040790024 /nfs/dbraw/zinc/79/00/24/1040790024.db2.gz GIHADOAXIYUVKF-HNNXBMFYSA-N 1 2 308.491 4.048 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2nc3ccccc3s2)o1)c1ncc[nH]1 ZINC000322138742 1040791111 /nfs/dbraw/zinc/79/11/11/1040791111.db2.gz AYHVCEBCOJQHSD-LLVKDONJSA-N 1 2 324.409 4.130 20 0 DIADLO COc1ccccc1C/C(C)=C\C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000255882504 1040792567 /nfs/dbraw/zinc/79/25/67/1040792567.db2.gz JLIDVXWAHRCNIH-QBFSEMIESA-N 1 2 324.424 4.143 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccn(C)n1 ZINC000414057906 1040800184 /nfs/dbraw/zinc/80/01/84/1040800184.db2.gz SIOANYWAVVNXLU-IUCAKERBSA-N 1 2 316.207 4.278 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@@H](C)c2ccn(C)n2)c2ccccc2)cc1 ZINC000414060649 1040802835 /nfs/dbraw/zinc/80/28/35/1040802835.db2.gz YBMBNSNXUZDBFN-JXFKEZNVSA-N 1 2 305.425 4.169 20 0 DIADLO Cc1ccc(-c2noc([C@H](CC(C)C)n3cc[nH+]c3)n2)cc1F ZINC000923783690 1040806480 /nfs/dbraw/zinc/80/64/80/1040806480.db2.gz JGVCWRRBPBRFLL-HNNXBMFYSA-N 1 2 314.364 4.016 20 0 DIADLO CC[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@H]1C[C@H]1C ZINC000414091327 1040843286 /nfs/dbraw/zinc/84/32/86/1040843286.db2.gz DGFBMZKBHJQTOI-HFTRVMKXSA-N 1 2 307.441 4.448 20 0 DIADLO CCC[C@H]([NH2+][C@H](C)c1cc2n(n1)CCC2)c1ccc(F)cc1F ZINC000414097625 1040858781 /nfs/dbraw/zinc/85/87/81/1040858781.db2.gz IIFKAMUXUFBLLJ-PXAZEXFGSA-N 1 2 319.399 4.300 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2ccn(C)n2)c(OCCC(C)C)c1 ZINC000414113733 1040882123 /nfs/dbraw/zinc/88/21/23/1040882123.db2.gz OHPFXDAPDBHVAQ-MRXNPFEDSA-N 1 2 315.461 4.004 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C)c1ccn(C)n1 ZINC000414115252 1040882993 /nfs/dbraw/zinc/88/29/93/1040882993.db2.gz PIIVDGGBUITVFX-BDJLRTHQSA-N 1 2 307.388 4.136 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1ccn(-c2ccc(F)cc2)n1 ZINC000173538982 1040900415 /nfs/dbraw/zinc/90/04/15/1040900415.db2.gz FOGNGDAUFWLOHN-ZDUSSCGKSA-N 1 2 315.417 4.266 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccn(-c2ccc(F)cc2)n1 ZINC000173538982 1040900431 /nfs/dbraw/zinc/90/04/31/1040900431.db2.gz FOGNGDAUFWLOHN-ZDUSSCGKSA-N 1 2 315.417 4.266 20 0 DIADLO COc1ccc(C[N@H+](C)[C@@H](C)c2c(F)cccc2F)cc1F ZINC000613418177 1040937853 /nfs/dbraw/zinc/93/78/53/1040937853.db2.gz NXRDEXRAFVTVFE-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@@H](C)c2c(F)cccc2F)cc1F ZINC000613418177 1040937867 /nfs/dbraw/zinc/93/78/67/1040937867.db2.gz NXRDEXRAFVTVFE-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO Cc1cnc(C[N@@H+]2Cc3ccccc3C[C@H]2c2ccccc2)o1 ZINC000174037062 1040940339 /nfs/dbraw/zinc/94/03/39/1040940339.db2.gz SJVIFEVDXZSTQF-IBGZPJMESA-N 1 2 304.393 4.283 20 0 DIADLO Cc1cnc(C[N@H+]2Cc3ccccc3C[C@H]2c2ccccc2)o1 ZINC000174037062 1040940357 /nfs/dbraw/zinc/94/03/57/1040940357.db2.gz SJVIFEVDXZSTQF-IBGZPJMESA-N 1 2 304.393 4.283 20 0 DIADLO COc1ccc(C)cc1C[N@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000613465575 1040972654 /nfs/dbraw/zinc/97/26/54/1040972654.db2.gz RAEIBQPMIMOEPN-CYBMUJFWSA-N 1 2 305.368 4.475 20 0 DIADLO COc1ccc(C)cc1C[N@@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000613465575 1040972676 /nfs/dbraw/zinc/97/26/76/1040972676.db2.gz RAEIBQPMIMOEPN-CYBMUJFWSA-N 1 2 305.368 4.475 20 0 DIADLO CCCCCC(C)(C)C[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000808702071 1041011064 /nfs/dbraw/zinc/01/10/64/1041011064.db2.gz RHHZITJYERSLNA-MRXNPFEDSA-N 1 2 300.450 4.090 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@@H](c2ccccc2)[C@H](O)c2ccccc2)o1 ZINC000808787438 1041029247 /nfs/dbraw/zinc/02/92/47/1041029247.db2.gz GUSNATFHGLKOEB-AYOQOUSVSA-N 1 2 322.408 4.109 20 0 DIADLO Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001131515774 1041054544 /nfs/dbraw/zinc/05/45/44/1041054544.db2.gz BFJTUYIPIMAZFN-GJZGRUSLSA-N 1 2 319.408 4.262 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]Cc1nccc(C(F)(F)F)n1 ZINC000414258662 1041056668 /nfs/dbraw/zinc/05/66/68/1041056668.db2.gz PMOVXFVUIGTIJD-DGCLKSJQSA-N 1 2 321.346 4.142 20 0 DIADLO c1csc(-c2nc(C[NH2+]Cc3scnc3C3CC3)co2)c1 ZINC000515783980 1041067264 /nfs/dbraw/zinc/06/72/64/1041067264.db2.gz HRHWBGQDQCZSMV-UHFFFAOYSA-N 1 2 317.439 4.027 20 0 DIADLO Cc1cc2c(cc1C)[C@@H]([NH2+][C@H](C)c1csnn1)CCS2 ZINC000414293549 1041088380 /nfs/dbraw/zinc/08/83/80/1041088380.db2.gz CZYDITYEINNVIS-YPMHNXCESA-N 1 2 305.472 4.043 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2Cc2cccc3ccccc32)no1 ZINC000613529419 1041103088 /nfs/dbraw/zinc/10/30/88/1041103088.db2.gz MDXBIPNHDMOKRN-GOSISDBHSA-N 1 2 307.397 4.258 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2Cc2cccc3ccccc32)no1 ZINC000613529419 1041103099 /nfs/dbraw/zinc/10/30/99/1041103099.db2.gz MDXBIPNHDMOKRN-GOSISDBHSA-N 1 2 307.397 4.258 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+][C@H](C)c2csnn2)cc1 ZINC000414310915 1041108432 /nfs/dbraw/zinc/10/84/32/1041108432.db2.gz XKWOERRVAJZCPI-QWHCGFSZSA-N 1 2 305.447 4.129 20 0 DIADLO Fc1ccc2oc(/C(Cl)=C/c3cccc4[nH+]ccn43)nc2c1 ZINC000180315347 1041118833 /nfs/dbraw/zinc/11/88/33/1041118833.db2.gz LDTKCHLLTWAGNI-XFXZXTDPSA-N 1 2 313.719 4.352 20 0 DIADLO CCC[C@@H](Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1cccnc1 ZINC000186422253 1041139946 /nfs/dbraw/zinc/13/99/46/1041139946.db2.gz DBHNGKDQUNSAOY-QGZVFWFLSA-N 1 2 310.376 4.360 20 0 DIADLO c1ccc2c(c1)ccnc2CNc1cc(-c2ccncc2)cc[nH+]1 ZINC001167699465 1041160103 /nfs/dbraw/zinc/16/01/03/1041160103.db2.gz IPRAJKVYUJSZFT-UHFFFAOYSA-N 1 2 312.376 4.304 20 0 DIADLO COc1cccc([C@@H](C)[NH2+]Cc2csc(C(F)(F)F)n2)c1 ZINC000892634142 1041169141 /nfs/dbraw/zinc/16/91/41/1041169141.db2.gz NTFNHBUJNLIJQX-SECBINFHSA-N 1 2 316.348 4.021 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccoc1C)c1nc(C(F)(F)F)cs1 ZINC000414359804 1041172625 /nfs/dbraw/zinc/17/26/25/1041172625.db2.gz FLGRLPCQXLMSQS-SNVBAGLBSA-N 1 2 304.337 4.304 20 0 DIADLO COc1cccc2[nH+]c(NCc3nccc4ccccc43)ccc21 ZINC001167700880 1041174612 /nfs/dbraw/zinc/17/46/12/1041174612.db2.gz ORYJOGUIAVXIHV-UHFFFAOYSA-N 1 2 315.376 4.404 20 0 DIADLO Cc1ccc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)nn1 ZINC000414374393 1041192562 /nfs/dbraw/zinc/19/25/62/1041192562.db2.gz VHYPDPAIYFVNCS-ZDUSSCGKSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1ccc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)nn1 ZINC000414374393 1041192570 /nfs/dbraw/zinc/19/25/70/1041192570.db2.gz VHYPDPAIYFVNCS-ZDUSSCGKSA-N 1 2 301.821 4.164 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2c(Cl)nc(Cl)n2C)C1 ZINC000809716845 1041233634 /nfs/dbraw/zinc/23/36/34/1041233634.db2.gz ZRQHSVLJGWBMDM-YPMHNXCESA-N 1 2 324.255 4.310 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2c(Cl)nc(Cl)n2C)C1 ZINC000809716845 1041233645 /nfs/dbraw/zinc/23/36/45/1041233645.db2.gz ZRQHSVLJGWBMDM-YPMHNXCESA-N 1 2 324.255 4.310 20 0 DIADLO CCc1nn(C)c(Cl)c1C[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000809783168 1041254909 /nfs/dbraw/zinc/25/49/09/1041254909.db2.gz TVSHPZMYETVNGB-AWEZNQCLSA-N 1 2 323.893 4.281 20 0 DIADLO CCc1nn(C)c(Cl)c1C[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000809783168 1041254921 /nfs/dbraw/zinc/25/49/21/1041254921.db2.gz TVSHPZMYETVNGB-AWEZNQCLSA-N 1 2 323.893 4.281 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)sc1C ZINC000756048051 1041268889 /nfs/dbraw/zinc/26/88/89/1041268889.db2.gz MRZOHTUTSCKGIQ-HNNXBMFYSA-N 1 2 308.397 4.375 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)sc1C ZINC000756048051 1041268905 /nfs/dbraw/zinc/26/89/05/1041268905.db2.gz MRZOHTUTSCKGIQ-HNNXBMFYSA-N 1 2 308.397 4.375 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2ccc(Cl)cc2)cs1 ZINC000177637345 1041284534 /nfs/dbraw/zinc/28/45/34/1041284534.db2.gz WOAPGJMIOWAWNU-MNOVXSKESA-N 1 2 310.850 4.355 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[NH2+]Cc1csc(C(F)(F)F)n1 ZINC000892681238 1041317847 /nfs/dbraw/zinc/31/78/47/1041317847.db2.gz XSRDDPDSRKRVLB-LBPRGKRZSA-N 1 2 316.323 4.078 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2nccn2C2CC2)c2ccccc2)cc1 ZINC000892714293 1041370060 /nfs/dbraw/zinc/37/00/60/1041370060.db2.gz LYJSFZZAGZEUTK-FQEVSTJZSA-N 1 2 321.399 4.236 20 0 DIADLO C[C@H]([NH2+]Cc1nc2ccccc2s1)c1cccc(F)c1F ZINC000181949184 1041371811 /nfs/dbraw/zinc/37/18/11/1041371811.db2.gz DIRPLIYXOKAQQQ-JTQLQIEISA-N 1 2 304.365 4.425 20 0 DIADLO COc1cc(C[NH+](Cc2cccs2)Cc2cccs2)on1 ZINC000659810082 1041376899 /nfs/dbraw/zinc/37/68/99/1041376899.db2.gz JPGXZZOYICTXEO-UHFFFAOYSA-N 1 2 320.439 4.009 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2csc(C(F)(F)F)n2)cc1 ZINC000892743897 1041392850 /nfs/dbraw/zinc/39/28/50/1041392850.db2.gz VJKPYHJUWHMBSW-SECBINFHSA-N 1 2 316.348 4.021 20 0 DIADLO C[C@H](c1nc(C(C)(C)c2cccc3ccccc32)no1)[NH+](C)C ZINC000924085281 1041394120 /nfs/dbraw/zinc/39/41/20/1041394120.db2.gz ACINELQIPRCPQB-CYBMUJFWSA-N 1 2 309.413 4.171 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1noc2c1CCCC2)c1ccccc1F ZINC000661484462 1041396436 /nfs/dbraw/zinc/39/64/36/1041396436.db2.gz HGSHBNMVXKPPKF-SFHVURJKSA-N 1 2 302.393 4.179 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccc(C(F)F)c(F)c2)cs1 ZINC000892895285 1041416031 /nfs/dbraw/zinc/41/60/31/1041416031.db2.gz PYVAPEAATWWYGZ-UHFFFAOYSA-N 1 2 300.349 4.072 20 0 DIADLO CCOc1ccc(C[NH2+]C2(c3nc(C)cs3)CCCC2)o1 ZINC000892950857 1041437422 /nfs/dbraw/zinc/43/74/22/1041437422.db2.gz IBRJDBAANBFPOV-UHFFFAOYSA-N 1 2 306.431 4.002 20 0 DIADLO CC(C)([NH2+]Cc1csc(C(F)(F)F)n1)c1cccc(F)c1 ZINC000892956024 1041439733 /nfs/dbraw/zinc/43/97/33/1041439733.db2.gz RZBKUKHHSAATRL-UHFFFAOYSA-N 1 2 318.339 4.326 20 0 DIADLO C[C@@H]([NH2+]Cc1nccn1C1CC1)c1cccc(Cl)c1Cl ZINC000892995408 1041453152 /nfs/dbraw/zinc/45/31/52/1041453152.db2.gz QZWARELGMLRJAS-SNVBAGLBSA-N 1 2 310.228 4.376 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C3CC(c4ccc(F)cc4)C3)cc2[nH+]1 ZINC000644657245 1041459013 /nfs/dbraw/zinc/45/90/13/1041459013.db2.gz IOZUSKKZENZCQI-UHFFFAOYSA-N 1 2 323.371 4.143 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)s1 ZINC000282525948 1041480724 /nfs/dbraw/zinc/48/07/24/1041480724.db2.gz PXENXOKZXBUCGW-RKDXNWHRSA-N 1 2 315.364 4.277 20 0 DIADLO O=C(C[C@H]1CCC[N@H+]1Cc1ccnc(Cl)c1)c1cccs1 ZINC000177400277 1041480968 /nfs/dbraw/zinc/48/09/68/1041480968.db2.gz WPGKFZHMXZGNBB-CYBMUJFWSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@H]1CCC[N@@H+]1Cc1ccnc(Cl)c1)c1cccs1 ZINC000177400277 1041480970 /nfs/dbraw/zinc/48/09/70/1041480970.db2.gz WPGKFZHMXZGNBB-CYBMUJFWSA-N 1 2 320.845 4.034 20 0 DIADLO Brc1csc(C[N@@H+]2CCC[C@H]2c2ccncc2)c1 ZINC000271000604 1041484595 /nfs/dbraw/zinc/48/45/95/1041484595.db2.gz KCIJQUFAVYRQMS-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1csc(C[N@H+]2CCC[C@H]2c2ccncc2)c1 ZINC000271000604 1041484603 /nfs/dbraw/zinc/48/46/03/1041484603.db2.gz KCIJQUFAVYRQMS-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC[C@@H](C3CCC3)CC2)c(C)[nH+]1 ZINC001132683763 1041494286 /nfs/dbraw/zinc/49/42/86/1041494286.db2.gz SZPUUOCGMHBVFA-QGZVFWFLSA-N 1 2 300.446 4.049 20 0 DIADLO C[C@]12CC[N@H+](Cc3c(F)ccc(F)c3Cl)C[C@H]1C2(F)F ZINC000628290412 1041497273 /nfs/dbraw/zinc/49/72/73/1041497273.db2.gz CSGQCDRKRKOHQI-YPMHNXCESA-N 1 2 307.718 4.095 20 0 DIADLO C[C@]12CC[N@@H+](Cc3c(F)ccc(F)c3Cl)C[C@H]1C2(F)F ZINC000628290412 1041497276 /nfs/dbraw/zinc/49/72/76/1041497276.db2.gz CSGQCDRKRKOHQI-YPMHNXCESA-N 1 2 307.718 4.095 20 0 DIADLO Fc1cccc([C@@H]([NH2+]Cc2nccn2C2CC2)c2ccccc2)c1 ZINC000893152906 1041506479 /nfs/dbraw/zinc/50/64/79/1041506479.db2.gz KPVMQCZVBTVDLO-FQEVSTJZSA-N 1 2 321.399 4.236 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2c(F)c(F)cc(F)c2F)cs1 ZINC000651268147 1041515377 /nfs/dbraw/zinc/51/53/77/1041515377.db2.gz MKAQPMXKZQFLAB-QMMMGPOBSA-N 1 2 303.324 4.464 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2cc3cc(C)c(C)cc3o2)[nH]1 ZINC000271460814 1041517551 /nfs/dbraw/zinc/51/75/51/1041517551.db2.gz HGNPJLOFZLPVCR-OLZOCXBDSA-N 1 2 312.417 4.142 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)ncn1 ZINC000271489596 1041517968 /nfs/dbraw/zinc/51/79/68/1041517968.db2.gz KTHOUAQMWMTIOA-VIFPVBQESA-N 1 2 314.191 4.082 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2ccnc(Cl)c2Cl)cc1 ZINC000811458470 1041519924 /nfs/dbraw/zinc/51/99/24/1041519924.db2.gz MBKAWACYIBSOQW-AWEZNQCLSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@H+]2Cc2ccnc(Cl)c2Cl)cc1 ZINC000811458470 1041519932 /nfs/dbraw/zinc/51/99/32/1041519932.db2.gz MBKAWACYIBSOQW-AWEZNQCLSA-N 1 2 323.223 4.431 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1cccnc1Cl ZINC000179921120 1041520242 /nfs/dbraw/zinc/52/02/42/1041520242.db2.gz PXMKOHSDUUPSMM-ZDUSSCGKSA-N 1 2 316.836 4.293 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(C(C)(C)C)s1)c1cc2ccccc2[nH]1 ZINC000925518252 1041520949 /nfs/dbraw/zinc/52/09/49/1041520949.db2.gz OACJSDWBCYLWTJ-LLVKDONJSA-N 1 2 314.458 4.168 20 0 DIADLO CN(C)c1cccc(C[N@H+](C)Cc2ccnc(Cl)c2Cl)c1 ZINC000811465242 1041521640 /nfs/dbraw/zinc/52/16/40/1041521640.db2.gz HUGXQOKNFYTNMM-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1cccc(C[N@@H+](C)Cc2ccnc(Cl)c2Cl)c1 ZINC000811465242 1041521645 /nfs/dbraw/zinc/52/16/45/1041521645.db2.gz HUGXQOKNFYTNMM-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(C(C)(C)C)s1)c1coc2ccccc21 ZINC000925520455 1041526577 /nfs/dbraw/zinc/52/65/77/1041526577.db2.gz VRHDCRCILSBVMV-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO CN(C)c1ccccc1C[N@H+](C)Cc1ccnc(Cl)c1Cl ZINC000811507481 1041532823 /nfs/dbraw/zinc/53/28/23/1041532823.db2.gz DNEPBFLZLMJTSK-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1ccccc1C[N@@H+](C)Cc1ccnc(Cl)c1Cl ZINC000811507481 1041532826 /nfs/dbraw/zinc/53/28/26/1041532826.db2.gz DNEPBFLZLMJTSK-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CCCCn1nc(C)c(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)c1Cl ZINC000811513474 1041534456 /nfs/dbraw/zinc/53/44/56/1041534456.db2.gz ZGMAGNYQKZDXHC-NSHDSACASA-N 1 2 319.827 4.122 20 0 DIADLO CCCCn1nc(C)c(C[N@H+]2CCC(F)(F)[C@@H](C)C2)c1Cl ZINC000811513474 1041534464 /nfs/dbraw/zinc/53/44/64/1041534464.db2.gz ZGMAGNYQKZDXHC-NSHDSACASA-N 1 2 319.827 4.122 20 0 DIADLO CCCCn1nc(C)c(C[N@@H+]2CCC(F)(F)[C@H](C)C2)c1Cl ZINC000811513473 1041535288 /nfs/dbraw/zinc/53/52/88/1041535288.db2.gz ZGMAGNYQKZDXHC-LLVKDONJSA-N 1 2 319.827 4.122 20 0 DIADLO CCCCn1nc(C)c(C[N@H+]2CCC(F)(F)[C@H](C)C2)c1Cl ZINC000811513473 1041535294 /nfs/dbraw/zinc/53/52/94/1041535294.db2.gz ZGMAGNYQKZDXHC-LLVKDONJSA-N 1 2 319.827 4.122 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)C1(C(F)(F)F)CCCC1 ZINC000416147889 1041535511 /nfs/dbraw/zinc/53/55/11/1041535511.db2.gz YIQYWASDKGOZKQ-UHFFFAOYSA-N 1 2 323.318 4.138 20 0 DIADLO Cc1nc(C[N@H+](CCc2ccc(C)cc2)Cc2ccco2)c(C)o1 ZINC000659961419 1041560556 /nfs/dbraw/zinc/56/05/56/1041560556.db2.gz ARNLLDWRLUZYNX-UHFFFAOYSA-N 1 2 324.424 4.438 20 0 DIADLO Cc1nc(C[N@@H+](CCc2ccc(C)cc2)Cc2ccco2)c(C)o1 ZINC000659961419 1041560561 /nfs/dbraw/zinc/56/05/61/1041560561.db2.gz ARNLLDWRLUZYNX-UHFFFAOYSA-N 1 2 324.424 4.438 20 0 DIADLO Cc1nc(C[NH+]2CCC(=Cc3ccccc3F)CC2)c(C)o1 ZINC000659998356 1041575759 /nfs/dbraw/zinc/57/57/59/1041575759.db2.gz ODTWBUHTVGGHNQ-UHFFFAOYSA-N 1 2 300.377 4.110 20 0 DIADLO CSc1cccc(C[N@@H+]2CCO[C@@H](c3ccsc3)C2)c1 ZINC000660000464 1041577699 /nfs/dbraw/zinc/57/76/99/1041577699.db2.gz BAKIQKZJKQKTTK-MRXNPFEDSA-N 1 2 305.468 4.044 20 0 DIADLO CSc1cccc(C[N@H+]2CCO[C@@H](c3ccsc3)C2)c1 ZINC000660000464 1041577703 /nfs/dbraw/zinc/57/77/03/1041577703.db2.gz BAKIQKZJKQKTTK-MRXNPFEDSA-N 1 2 305.468 4.044 20 0 DIADLO CCc1ccc(CCC(=O)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC000613708227 1041583876 /nfs/dbraw/zinc/58/38/76/1041583876.db2.gz VPPIZRULXROVGO-UHFFFAOYSA-N 1 2 319.408 4.006 20 0 DIADLO CC(=O)C1CC[NH+](Cc2ccc(Cl)cc2C(F)(F)F)CC1 ZINC001143505413 1041587713 /nfs/dbraw/zinc/58/77/13/1041587713.db2.gz GZKQDMXGWWXPFD-UHFFFAOYSA-N 1 2 319.754 4.160 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ccco2)Cc2cc(C)nc(C)n2)c1 ZINC000660036617 1041588144 /nfs/dbraw/zinc/58/81/44/1041588144.db2.gz RATCZFOKYFYOAV-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ccco2)Cc2cc(C)nc(C)n2)c1 ZINC000660036617 1041588150 /nfs/dbraw/zinc/58/81/50/1041588150.db2.gz RATCZFOKYFYOAV-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO CC(=O)[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2C(F)(F)F)C1 ZINC001143505632 1041595311 /nfs/dbraw/zinc/59/53/11/1041595311.db2.gz LQMVURPCUAIENI-NSHDSACASA-N 1 2 319.754 4.160 20 0 DIADLO CC(=O)[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2C(F)(F)F)C1 ZINC001143505632 1041595318 /nfs/dbraw/zinc/59/53/18/1041595318.db2.gz LQMVURPCUAIENI-NSHDSACASA-N 1 2 319.754 4.160 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)cc[nH+]1 ZINC000010634836 1041606073 /nfs/dbraw/zinc/60/60/73/1041606073.db2.gz VLWXWFMMCBAIDF-LSDHHAIUSA-N 1 2 320.314 4.151 20 0 DIADLO Fc1cccc(C=C2CC[NH+](Cc3cc(C4CC4)no3)CC2)c1 ZINC000660107754 1041617090 /nfs/dbraw/zinc/61/70/90/1041617090.db2.gz JQGRZZFGSBDDMZ-UHFFFAOYSA-N 1 2 312.388 4.371 20 0 DIADLO CSc1ccc(C[NH2+]Cc2c(F)cccc2OC(F)F)o1 ZINC000641731604 1041636658 /nfs/dbraw/zinc/63/66/58/1041636658.db2.gz DAZLCKCSYATPOF-UHFFFAOYSA-N 1 2 317.332 4.032 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1cc(C2CC2)no1 ZINC000660163398 1041640292 /nfs/dbraw/zinc/64/02/92/1041640292.db2.gz GUMUTYYPWWTYNV-NEPJUHHUSA-N 1 2 300.377 4.199 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1cc(C2CC2)no1 ZINC000660163398 1041640296 /nfs/dbraw/zinc/64/02/96/1041640296.db2.gz GUMUTYYPWWTYNV-NEPJUHHUSA-N 1 2 300.377 4.199 20 0 DIADLO Cc1ccc(C[S@@](=O)Cc2c(C)cccc2Cl)c(C)[nH+]1 ZINC000417166994 1041640504 /nfs/dbraw/zinc/64/05/04/1041640504.db2.gz WARXDXFZCFVOLA-HXUWFJFHSA-N 1 2 307.846 4.109 20 0 DIADLO Cc1nc(C[NH2+][C@H](COc2ccccc2)c2ccccc2)c(C)o1 ZINC000660197780 1041661338 /nfs/dbraw/zinc/66/13/38/1041661338.db2.gz QOHQNBBVNUMLNZ-HXUWFJFHSA-N 1 2 322.408 4.201 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1ccccc1OC(C)C ZINC000584761987 1041665470 /nfs/dbraw/zinc/66/54/70/1041665470.db2.gz IVWBYUPVCQUSBS-HUUCEWRRSA-N 1 2 301.434 4.102 20 0 DIADLO Cc1noc(C)c1[C@H](C)C[NH2+][C@H](C)C(F)(F)c1ccccc1 ZINC000925603676 1041670944 /nfs/dbraw/zinc/67/09/44/1041670944.db2.gz CRCCKKDRJVSTSX-BXUZGUMPSA-N 1 2 308.372 4.165 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2nnc(C(C)C)s2)C2CCC2)o1 ZINC000584808209 1041678246 /nfs/dbraw/zinc/67/82/46/1041678246.db2.gz HMMBNNPSSBBXPW-HNNXBMFYSA-N 1 2 305.447 4.194 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C=C1CCC(C(C)(C)C)CC1 ZINC001133682149 1041689971 /nfs/dbraw/zinc/68/99/71/1041689971.db2.gz MESIRIJIYSUFCQ-UHFFFAOYSA-N 1 2 300.446 4.222 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1ccc(-c2cccs2)s1 ZINC001133681917 1041690214 /nfs/dbraw/zinc/69/02/14/1041690214.db2.gz BTIMWZOSIHCXDK-UHFFFAOYSA-N 1 2 314.435 4.163 20 0 DIADLO CCOc1cccc2cc([C@H](C)[NH2+]Cc3nc(C)oc3C)oc21 ZINC000660258019 1041691879 /nfs/dbraw/zinc/69/18/79/1041691879.db2.gz XDALMVUVFMKJAX-NSHDSACASA-N 1 2 314.385 4.287 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2cccc(OC)c2Cl)cs1 ZINC000660267218 1041697678 /nfs/dbraw/zinc/69/76/78/1041697678.db2.gz LDHDXUGDKGGREB-JTQLQIEISA-N 1 2 310.850 4.218 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)nc(C)n1 ZINC000660329745 1041717101 /nfs/dbraw/zinc/71/71/01/1041717101.db2.gz DXQXSHXISSYUHX-JTQLQIEISA-N 1 2 310.228 4.251 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nc(C3CC3)no2)o1 ZINC000150725776 1041717574 /nfs/dbraw/zinc/71/75/74/1041717574.db2.gz CJOWAORZQZHGOB-HNNXBMFYSA-N 1 2 315.417 4.220 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@H+]2Cc2nc(C3CC3)no2)o1 ZINC000150725776 1041717583 /nfs/dbraw/zinc/71/75/83/1041717583.db2.gz CJOWAORZQZHGOB-HNNXBMFYSA-N 1 2 315.417 4.220 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Br)o1)c1cc(F)ccc1F ZINC000036921849 1041723232 /nfs/dbraw/zinc/72/32/32/1041723232.db2.gz GARRDCUCXILLIG-MRVPVSSYSA-N 1 2 316.145 4.171 20 0 DIADLO CCc1cnc(C[N@@H+]2CCc3ccc(-c4ccccc4)cc3C2)o1 ZINC001170711578 1041728307 /nfs/dbraw/zinc/72/83/07/1041728307.db2.gz NPFCEHWPHFBKDP-UHFFFAOYSA-N 1 2 318.420 4.462 20 0 DIADLO CCc1cnc(C[N@H+]2CCc3ccc(-c4ccccc4)cc3C2)o1 ZINC001170711578 1041728314 /nfs/dbraw/zinc/72/83/14/1041728314.db2.gz NPFCEHWPHFBKDP-UHFFFAOYSA-N 1 2 318.420 4.462 20 0 DIADLO C[C@H]([NH2+]Cc1cocn1)c1cc2cc(Br)ccc2o1 ZINC000397890040 1041736044 /nfs/dbraw/zinc/73/60/44/1041736044.db2.gz OHGSJTHHEBHJKK-VIFPVBQESA-N 1 2 321.174 4.034 20 0 DIADLO C[C@@H]([NH2+]Cc1cocn1)c1cc2cc(Br)ccc2o1 ZINC000397890039 1041736091 /nfs/dbraw/zinc/73/60/91/1041736091.db2.gz OHGSJTHHEBHJKK-SECBINFHSA-N 1 2 321.174 4.034 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCC1(F)F)c1ccc(Br)cc1 ZINC000397935066 1041738861 /nfs/dbraw/zinc/73/88/61/1041738861.db2.gz DEPBDPIPGRWTAL-CABZTGNLSA-N 1 2 304.178 4.288 20 0 DIADLO C[C@H]([NH2+]Cc1cocn1)c1ccc(OCc2ccccc2)cc1 ZINC000397930045 1041740007 /nfs/dbraw/zinc/74/00/07/1041740007.db2.gz LVXQGRJCDKPVPR-HNNXBMFYSA-N 1 2 308.381 4.104 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCC[N@@H+]1C/C=C\Cl ZINC000759805839 1041744018 /nfs/dbraw/zinc/74/40/18/1041744018.db2.gz ZRSNGJWGQOYVOO-SCXUMTSISA-N 1 2 316.276 4.390 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCC[N@H+]1C/C=C\Cl ZINC000759805839 1041744025 /nfs/dbraw/zinc/74/40/25/1041744025.db2.gz ZRSNGJWGQOYVOO-SCXUMTSISA-N 1 2 316.276 4.390 20 0 DIADLO Fc1cc2[nH+]ccc(N3CC[C@]4(CC4(F)F)C3)c2cc1Cl ZINC000651489020 1041746385 /nfs/dbraw/zinc/74/63/85/1041746385.db2.gz KHDSFYDVBVBCNG-AWEZNQCLSA-N 1 2 312.722 4.263 20 0 DIADLO COc1ccc2cc(NCc3ccc4oc(C)nc4c3)[nH+]cc2c1 ZINC001167757501 1041761999 /nfs/dbraw/zinc/76/19/99/1041761999.db2.gz RSWIRJGLFFNPPE-UHFFFAOYSA-N 1 2 319.364 4.305 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ncco1 ZINC000925680778 1041768276 /nfs/dbraw/zinc/76/82/76/1041768276.db2.gz UHTOOFDTQNAVDO-QMTHXVAHSA-N 1 2 310.319 4.495 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cnc(-c3ccccc3)nc2)C2CC2)o1 ZINC000613742306 1041768517 /nfs/dbraw/zinc/76/85/17/1041768517.db2.gz VZTMZBQWCFSCGK-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cnc(-c3ccccc3)nc2)C2CC2)o1 ZINC000613742306 1041768525 /nfs/dbraw/zinc/76/85/25/1041768525.db2.gz VZTMZBQWCFSCGK-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO CC(C)n1cnnc1C[N@H+](C)Cc1ccccc1-c1ccccc1 ZINC000814178904 1041780021 /nfs/dbraw/zinc/78/00/21/1041780021.db2.gz IOCFBIKJIFWJBB-UHFFFAOYSA-N 1 2 320.440 4.158 20 0 DIADLO CC(C)n1cnnc1C[N@@H+](C)Cc1ccccc1-c1ccccc1 ZINC000814178904 1041780025 /nfs/dbraw/zinc/78/00/25/1041780025.db2.gz IOCFBIKJIFWJBB-UHFFFAOYSA-N 1 2 320.440 4.158 20 0 DIADLO Fc1cccc(F)c1-c1ncc(C[N@H+]2CCC[C@@H](F)C2)s1 ZINC000652076009 1041780557 /nfs/dbraw/zinc/78/05/57/1041780557.db2.gz IWHRFPFYQNJTSU-SNVBAGLBSA-N 1 2 312.360 4.022 20 0 DIADLO Fc1cccc(F)c1-c1ncc(C[N@@H+]2CCC[C@@H](F)C2)s1 ZINC000652076009 1041780562 /nfs/dbraw/zinc/78/05/62/1041780562.db2.gz IWHRFPFYQNJTSU-SNVBAGLBSA-N 1 2 312.360 4.022 20 0 DIADLO CCn1c(C[NH2+]Cc2ccsc2Cl)nc2ccccc21 ZINC000312752580 1041781019 /nfs/dbraw/zinc/78/10/19/1041781019.db2.gz BSSKZNVDFNQGCO-UHFFFAOYSA-N 1 2 305.834 4.061 20 0 DIADLO C[C@@H](CF)[NH2+]Cc1sc(Sc2ccccc2)nc1Cl ZINC000814299632 1041807065 /nfs/dbraw/zinc/80/70/65/1041807065.db2.gz APVAOIWKKZOGGY-VIFPVBQESA-N 1 2 316.854 4.395 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[NH+]1CCC(C)(C2CC2)CC1 ZINC001170745056 1041817070 /nfs/dbraw/zinc/81/70/70/1041817070.db2.gz PVVCGQWDRDTQOC-INIZCTEOSA-N 1 2 321.848 4.066 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2Cl)CC2CC2)c(C)o1 ZINC000660535147 1041827751 /nfs/dbraw/zinc/82/77/51/1041827751.db2.gz MPZASOTVSSKLHE-UHFFFAOYSA-N 1 2 304.821 4.357 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2Cl)CC2CC2)c(C)o1 ZINC000660535147 1041827753 /nfs/dbraw/zinc/82/77/53/1041827753.db2.gz MPZASOTVSSKLHE-UHFFFAOYSA-N 1 2 304.821 4.357 20 0 DIADLO c1cc(-c2ccccc2)oc1C[NH2+]Cc1nc2ccccc2o1 ZINC000613754760 1041841939 /nfs/dbraw/zinc/84/19/39/1041841939.db2.gz DXBAUFFDGCNTEJ-UHFFFAOYSA-N 1 2 304.349 4.378 20 0 DIADLO C[C@H]([N@H+](C)Cn1nc(-c2ccc(F)cc2)oc1=S)C(C)(C)C ZINC000026629733 1041842517 /nfs/dbraw/zinc/84/25/17/1041842517.db2.gz SBKJRJJZFZEKFM-NSHDSACASA-N 1 2 323.437 4.336 20 0 DIADLO C[C@H]([N@@H+](C)Cn1nc(-c2ccc(F)cc2)oc1=S)C(C)(C)C ZINC000026629733 1041842521 /nfs/dbraw/zinc/84/25/21/1041842521.db2.gz SBKJRJJZFZEKFM-NSHDSACASA-N 1 2 323.437 4.336 20 0 DIADLO C[C@@H](c1nc2cc(Cl)ccc2[nH]1)[N@H+](C)CCC(F)(F)F ZINC000660707161 1041855215 /nfs/dbraw/zinc/85/52/15/1041855215.db2.gz DFMPFYDEQXHTDU-QMMMGPOBSA-N 1 2 305.731 4.162 20 0 DIADLO C[C@@H](c1nc2cc(Cl)ccc2[nH]1)[N@@H+](C)CCC(F)(F)F ZINC000660707161 1041855220 /nfs/dbraw/zinc/85/52/20/1041855220.db2.gz DFMPFYDEQXHTDU-QMMMGPOBSA-N 1 2 305.731 4.162 20 0 DIADLO C[C@H](c1nc2ccc(Cl)cc2[nH]1)[N@H+](C)CCOC(C)(C)C ZINC000660707198 1041855546 /nfs/dbraw/zinc/85/55/46/1041855546.db2.gz FCVWQXJWLPIXPG-LLVKDONJSA-N 1 2 309.841 4.024 20 0 DIADLO C[C@H](c1nc2ccc(Cl)cc2[nH]1)[N@@H+](C)CCOC(C)(C)C ZINC000660707198 1041855548 /nfs/dbraw/zinc/85/55/48/1041855548.db2.gz FCVWQXJWLPIXPG-LLVKDONJSA-N 1 2 309.841 4.024 20 0 DIADLO C[N@H+](C[C@@H]1CCCCC1(C)C)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660764306 1041860410 /nfs/dbraw/zinc/86/04/10/1041860410.db2.gz JDKYVOYYWSXUIJ-DLBZAZTESA-N 1 2 312.461 4.042 20 0 DIADLO C[N@@H+](C[C@@H]1CCCCC1(C)C)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000660764306 1041860419 /nfs/dbraw/zinc/86/04/19/1041860419.db2.gz JDKYVOYYWSXUIJ-DLBZAZTESA-N 1 2 312.461 4.042 20 0 DIADLO C[N@H+](C[C@@H]1CCCCC1(C)C)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660764308 1041860596 /nfs/dbraw/zinc/86/05/96/1041860596.db2.gz JDKYVOYYWSXUIJ-IRXDYDNUSA-N 1 2 312.461 4.042 20 0 DIADLO C[N@@H+](C[C@@H]1CCCCC1(C)C)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660764308 1041860598 /nfs/dbraw/zinc/86/05/98/1041860598.db2.gz JDKYVOYYWSXUIJ-IRXDYDNUSA-N 1 2 312.461 4.042 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H]1CCc2c1nccc2Cl ZINC000925719566 1041865103 /nfs/dbraw/zinc/86/51/03/1041865103.db2.gz AHQIRJKBTDHZTC-INIZCTEOSA-N 1 2 301.821 4.209 20 0 DIADLO CCO[C@H](C)c1nc(C[NH+]2CCC(c3ccco3)CC2)cs1 ZINC000661161899 1041898914 /nfs/dbraw/zinc/89/89/14/1041898914.db2.gz AGCKBPJQQDDZMB-CYBMUJFWSA-N 1 2 320.458 4.213 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000044736764 1041900485 /nfs/dbraw/zinc/90/04/85/1041900485.db2.gz MXDFXYXBZITVCX-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000044736764 1041900491 /nfs/dbraw/zinc/90/04/91/1041900491.db2.gz MXDFXYXBZITVCX-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO CC/C(=C\C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000728815137 1041900611 /nfs/dbraw/zinc/90/06/11/1041900611.db2.gz PMHHIYAFEMCZJJ-DTQAZKPQSA-N 1 2 317.392 4.304 20 0 DIADLO C[C@@H]([NH2+]Cc1cnn(C)c1Cl)c1cc(Cl)ccc1Cl ZINC000815122602 1041914844 /nfs/dbraw/zinc/91/48/44/1041914844.db2.gz PFNSIPBBOINYSE-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO CCC(CC)CCCN(C)C(=O)NCc1c[nH+]c(C)cc1C ZINC000661291427 1041915796 /nfs/dbraw/zinc/91/57/96/1041915796.db2.gz GXICIAPJNDRDLG-UHFFFAOYSA-N 1 2 305.466 4.056 20 0 DIADLO COc1ccc(C[NH2+]Cc2c(F)cc(F)cc2F)c(Cl)c1 ZINC000815152884 1041919132 /nfs/dbraw/zinc/91/91/32/1041919132.db2.gz YYMSCTSRFNSYMD-UHFFFAOYSA-N 1 2 315.722 4.056 20 0 DIADLO CCc1nc(C)c(C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)o1 ZINC000651816311 1041921087 /nfs/dbraw/zinc/92/10/87/1041921087.db2.gz NFZVFMWJKREQMN-CQSZACIVSA-N 1 2 321.424 4.458 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1nnc(-c3ccccc3)s1)CC2 ZINC000661371915 1041927935 /nfs/dbraw/zinc/92/79/35/1041927935.db2.gz RYYKFWPNOGRMKE-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1nnc(-c3ccccc3)s1)CC2 ZINC000661371915 1041927944 /nfs/dbraw/zinc/92/79/44/1041927944.db2.gz RYYKFWPNOGRMKE-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1nc(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccco2)sc1C ZINC000661435211 1041937757 /nfs/dbraw/zinc/93/77/57/1041937757.db2.gz NSWHUSBOTVTELV-INIZCTEOSA-N 1 2 302.443 4.470 20 0 DIADLO Cc1nc(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccco2)sc1C ZINC000661435211 1041937764 /nfs/dbraw/zinc/93/77/64/1041937764.db2.gz NSWHUSBOTVTELV-INIZCTEOSA-N 1 2 302.443 4.470 20 0 DIADLO Cc1cc(-c2cccc(Br)c2F)cn2cc[nH+]c12 ZINC001245484723 1041954262 /nfs/dbraw/zinc/95/42/62/1041954262.db2.gz UNXMLCJZIXRJSR-UHFFFAOYSA-N 1 2 305.150 4.211 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893479377 1041964489 /nfs/dbraw/zinc/96/44/89/1041964489.db2.gz VFKJZPSHBUVTCA-MNOVXSKESA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893479377 1041964490 /nfs/dbraw/zinc/96/44/90/1041964490.db2.gz VFKJZPSHBUVTCA-MNOVXSKESA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H](C1CC1)[N@H+](Cc1noc(C(C)(C)C)n1)Cc1ccccc1 ZINC000047826025 1041972092 /nfs/dbraw/zinc/97/20/92/1041972092.db2.gz WIFDAYWCZHYMBI-CQSZACIVSA-N 1 2 313.445 4.168 20 0 DIADLO C[C@H](C1CC1)[N@@H+](Cc1noc(C(C)(C)C)n1)Cc1ccccc1 ZINC000047826025 1041972101 /nfs/dbraw/zinc/97/21/01/1041972101.db2.gz WIFDAYWCZHYMBI-CQSZACIVSA-N 1 2 313.445 4.168 20 0 DIADLO CC[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccc(C(=O)OC)cc1 ZINC000815610240 1041972632 /nfs/dbraw/zinc/97/26/32/1041972632.db2.gz GGALOKCOCYRDJG-GOSISDBHSA-N 1 2 312.413 4.102 20 0 DIADLO COC(=O)CCC[C@@H]1CCC[C@H](Nc2ccc([NH+](C)C)cc2)C1 ZINC000815610900 1041973961 /nfs/dbraw/zinc/97/39/61/1041973961.db2.gz XYYIWIMYUQHQKL-RDJZCZTQSA-N 1 2 318.461 4.067 20 0 DIADLO COC(=O)CCC[C@@H]1CCC[C@H]([NH2+]c2ccc(N(C)C)cc2)C1 ZINC000815610900 1041973962 /nfs/dbraw/zinc/97/39/62/1041973962.db2.gz XYYIWIMYUQHQKL-RDJZCZTQSA-N 1 2 318.461 4.067 20 0 DIADLO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1cc(COC(C)(C)C)on1 ZINC000815618042 1041975546 /nfs/dbraw/zinc/97/55/46/1041975546.db2.gz CDGYYXWONWHYPC-ZDUSSCGKSA-N 1 2 320.408 4.288 20 0 DIADLO COc1ccsc1[C@H](C)[NH2+]Cc1c(F)cc(F)cc1F ZINC000815650027 1041984039 /nfs/dbraw/zinc/98/40/39/1041984039.db2.gz GFCMQGWLMRMCPU-QMMMGPOBSA-N 1 2 301.333 4.025 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccccn1 ZINC000815649458 1041984744 /nfs/dbraw/zinc/98/47/44/1041984744.db2.gz QJXMIDNVAMCRDT-KRWDZBQOSA-N 1 2 308.347 4.376 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2c(F)cc(F)cc2F)c(F)c1 ZINC000815650191 1041985569 /nfs/dbraw/zinc/98/55/69/1041985569.db2.gz LEWSAMANGCPCDC-VIFPVBQESA-N 1 2 313.294 4.102 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccc(F)cn1 ZINC000815649725 1041985791 /nfs/dbraw/zinc/98/57/91/1041985791.db2.gz XJSNXOBLSPICCL-INIZCTEOSA-N 1 2 312.310 4.125 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cn3cc(Cl)ccc3n2)C2CC2)o1 ZINC000048333245 1041988536 /nfs/dbraw/zinc/98/85/36/1041988536.db2.gz MONBYVUROYJKSM-UHFFFAOYSA-N 1 2 315.804 4.054 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cn3cc(Cl)ccc3n2)C2CC2)o1 ZINC000048333245 1041988541 /nfs/dbraw/zinc/98/85/41/1041988541.db2.gz MONBYVUROYJKSM-UHFFFAOYSA-N 1 2 315.804 4.054 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CCSc3ccc(F)cc32)c1 ZINC000652330347 1042009289 /nfs/dbraw/zinc/00/92/89/1042009289.db2.gz CYWQZDXWFYKZOP-AWEZNQCLSA-N 1 2 304.390 4.016 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2cc(C)ccc2OC(F)F)c1 ZINC000652330435 1042009625 /nfs/dbraw/zinc/00/96/25/1042009625.db2.gz GCGMUTQFOLPBLY-LBPRGKRZSA-N 1 2 322.355 4.311 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CC3(CCC3)Oc3ccccc32)c1 ZINC000652330920 1042011042 /nfs/dbraw/zinc/01/10/42/1042011042.db2.gz SROGDXIMHCGKAN-INIZCTEOSA-N 1 2 310.397 4.086 20 0 DIADLO Cc1ccc(NC(=O)c2c[nH+]ccc2Nc2ccccc2)c(C)c1 ZINC001135498830 1042040231 /nfs/dbraw/zinc/04/02/31/1042040231.db2.gz YVEMFPAYRZGPCI-UHFFFAOYSA-N 1 2 317.392 4.116 20 0 DIADLO Cn1ncc(C[N@H+](C)C2c3ccccc3-c3ccccc32)c1Cl ZINC000816515755 1042060948 /nfs/dbraw/zinc/06/09/48/1042060948.db2.gz JVWNZMIWGRMFFF-UHFFFAOYSA-N 1 2 323.827 4.275 20 0 DIADLO Cn1ncc(C[N@@H+](C)C2c3ccccc3-c3ccccc32)c1Cl ZINC000816515755 1042060952 /nfs/dbraw/zinc/06/09/52/1042060952.db2.gz JVWNZMIWGRMFFF-UHFFFAOYSA-N 1 2 323.827 4.275 20 0 DIADLO CCC[N@H+](Cc1ccno1)[C@H](C)c1ccccc1Br ZINC000599203721 1042064806 /nfs/dbraw/zinc/06/48/06/1042064806.db2.gz BSNNMXUOFSEJIS-GFCCVEGCSA-N 1 2 323.234 4.410 20 0 DIADLO CCC[N@@H+](Cc1ccno1)[C@H](C)c1ccccc1Br ZINC000599203721 1042064810 /nfs/dbraw/zinc/06/48/10/1042064810.db2.gz BSNNMXUOFSEJIS-GFCCVEGCSA-N 1 2 323.234 4.410 20 0 DIADLO CCOc1nnc(C[N@H+](C(C)C)[C@H](CC)c2ccccc2)s1 ZINC000662109446 1042066603 /nfs/dbraw/zinc/06/66/03/1042066603.db2.gz WYLONSIEYYAVAI-OAHLLOKOSA-N 1 2 319.474 4.299 20 0 DIADLO CCOc1nnc(C[N@@H+](C(C)C)[C@H](CC)c2ccccc2)s1 ZINC000662109446 1042066610 /nfs/dbraw/zinc/06/66/10/1042066610.db2.gz WYLONSIEYYAVAI-OAHLLOKOSA-N 1 2 319.474 4.299 20 0 DIADLO FC(F)[C@H](CCc1ccccc1)[NH2+]CCSC(F)(F)F ZINC000779393561 1042078293 /nfs/dbraw/zinc/07/82/93/1042078293.db2.gz SVOVYUSPHFGPBT-NSHDSACASA-N 1 2 313.335 4.096 20 0 DIADLO CCCCOc1ccc(-c2csc(Cn3cc[nH+]c3)n2)cc1 ZINC000663219780 1042079264 /nfs/dbraw/zinc/07/92/64/1042079264.db2.gz KQVQSNJHZLBMPB-UHFFFAOYSA-N 1 2 313.426 4.234 20 0 DIADLO FC(F)(F)C[C@@H]1C[N@H+](Cc2csc3ccccc23)CCO1 ZINC000662230560 1042093947 /nfs/dbraw/zinc/09/39/47/1042093947.db2.gz BHOMXOMHUPAPIA-GFCCVEGCSA-N 1 2 315.360 4.055 20 0 DIADLO FC(F)(F)C[C@@H]1C[N@@H+](Cc2csc3ccccc23)CCO1 ZINC000662230560 1042093955 /nfs/dbraw/zinc/09/39/55/1042093955.db2.gz BHOMXOMHUPAPIA-GFCCVEGCSA-N 1 2 315.360 4.055 20 0 DIADLO C[N@H+](CC1=CCSC1)Cc1nc(C2CCCCC2)cs1 ZINC000662265383 1042103189 /nfs/dbraw/zinc/10/31/89/1042103189.db2.gz YLWVPMYURSHCNC-UHFFFAOYSA-N 1 2 308.516 4.296 20 0 DIADLO C[N@@H+](CC1=CCSC1)Cc1nc(C2CCCCC2)cs1 ZINC000662265383 1042103190 /nfs/dbraw/zinc/10/31/90/1042103190.db2.gz YLWVPMYURSHCNC-UHFFFAOYSA-N 1 2 308.516 4.296 20 0 DIADLO CC(C)c1cccc(C[NH2+]Cc2nnc(-c3ccc(F)cc3)[nH]2)c1 ZINC000663319050 1042113816 /nfs/dbraw/zinc/11/38/16/1042113816.db2.gz OVXGZBIDKCQJBK-UHFFFAOYSA-N 1 2 324.403 4.024 20 0 DIADLO CC(C)c1cccc(C[NH2+]Cc2nc(-c3ccc(F)cc3)n[nH]2)c1 ZINC000663319050 1042113821 /nfs/dbraw/zinc/11/38/21/1042113821.db2.gz OVXGZBIDKCQJBK-UHFFFAOYSA-N 1 2 324.403 4.024 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@]2(c3ccccc3)CC2(C)C)cs1 ZINC000662342377 1042116096 /nfs/dbraw/zinc/11/60/96/1042116096.db2.gz ARPVADRVCFDDGS-SCLBCKFNSA-N 1 2 316.470 4.266 20 0 DIADLO CC1(C)C[C@]1([NH2+]Cc1nc(-c2ccccc2)no1)c1ccccc1 ZINC000662342603 1042116447 /nfs/dbraw/zinc/11/64/47/1042116447.db2.gz BAFYCZAHOIGODX-FQEVSTJZSA-N 1 2 319.408 4.152 20 0 DIADLO COc1ccc([C@H]2CCCN2c2[nH+]ccc3c(N)cccc32)cc1 ZINC000663331079 1042120756 /nfs/dbraw/zinc/12/07/56/1042120756.db2.gz GVBIDWLUMXGYCA-LJQANCHMSA-N 1 2 319.408 4.167 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](C)c2cc3ccccc3o2)cs1 ZINC000165275507 1042136508 /nfs/dbraw/zinc/13/65/08/1042136508.db2.gz ADFJITZYKXXNBN-VXGBXAGGSA-N 1 2 316.426 4.448 20 0 DIADLO Clc1ccccc1-c1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]32)s1 ZINC000644837593 1042146306 /nfs/dbraw/zinc/14/63/06/1042146306.db2.gz KWTYRBHOROUDAI-LSDHHAIUSA-N 1 2 305.830 4.042 20 0 DIADLO Clc1ccccc1-c1ccc(C[N@H+]2CCO[C@@H]3C[C@@H]32)s1 ZINC000644837593 1042146312 /nfs/dbraw/zinc/14/63/12/1042146312.db2.gz KWTYRBHOROUDAI-LSDHHAIUSA-N 1 2 305.830 4.042 20 0 DIADLO CCn1nccc1C[NH2+][C@H](C)c1cc(Cl)sc1Cl ZINC000663467655 1042180849 /nfs/dbraw/zinc/18/08/49/1042180849.db2.gz LNPXBSKDIVXEQC-MRVPVSSYSA-N 1 2 304.246 4.122 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2cnccc2C(F)(F)F)c(C)s1 ZINC000663471578 1042183646 /nfs/dbraw/zinc/18/36/46/1042183646.db2.gz SNFXCTRXNZHASK-QMMMGPOBSA-N 1 2 315.364 4.025 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cc(Cl)nc(Cl)c2)C1 ZINC000805750826 1042220783 /nfs/dbraw/zinc/22/07/83/1042220783.db2.gz VPFLWCASAVWAOU-RISCZKNCSA-N 1 2 322.239 4.367 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(Cl)nc(Cl)c2)C1 ZINC000805750826 1042220788 /nfs/dbraw/zinc/22/07/88/1042220788.db2.gz VPFLWCASAVWAOU-RISCZKNCSA-N 1 2 322.239 4.367 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](c2ccccc2)[C@H]2CCCO2)cs1 ZINC001648933403 1042221937 /nfs/dbraw/zinc/22/19/37/1042221937.db2.gz UBCVPMBOETWBMU-IAGOWNOFSA-N 1 2 316.470 4.276 20 0 DIADLO C[C@H](N[C@@H](c1ccco1)c1ccccc1)c1cn2c([nH+]1)CCCC2 ZINC000820805973 1042228448 /nfs/dbraw/zinc/22/84/48/1042228448.db2.gz WFDGQRAYLYEKTC-MGPUTAFESA-N 1 2 321.424 4.253 20 0 DIADLO CC(C)C[C@@H](C(=O)N(C)c1cccc2ccccc21)n1cc[nH+]c1 ZINC001136407612 1042239529 /nfs/dbraw/zinc/23/95/29/1042239529.db2.gz HUJCMYYLYQEZGR-IBGZPJMESA-N 1 2 321.424 4.287 20 0 DIADLO C[C@H](CCCC(F)(F)F)[NH2+]c1ccc(N2CCOCC2)cc1 ZINC000317675519 1042241008 /nfs/dbraw/zinc/24/10/08/1042241008.db2.gz CFCXIQSKCJYVPP-CYBMUJFWSA-N 1 2 316.367 4.056 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc(OCC(F)(F)F)cc1 ZINC000317701679 1042247270 /nfs/dbraw/zinc/24/72/70/1042247270.db2.gz KPZUXCCESOWUBY-UHFFFAOYSA-N 1 2 313.323 4.017 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2cccc(OCc3ccccc3)c2)no1 ZINC000278940770 1042249533 /nfs/dbraw/zinc/24/95/33/1042249533.db2.gz YBFJLWRXKYMURL-INIZCTEOSA-N 1 2 322.408 4.413 20 0 DIADLO CC(C)(C)[C@H]1CCCC[C@H]1CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001136512699 1042267673 /nfs/dbraw/zinc/26/76/73/1042267673.db2.gz HEJQIHVOLJTFSL-ZFWWWQNUSA-N 1 2 313.445 4.145 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000279088697 1042270500 /nfs/dbraw/zinc/27/05/00/1042270500.db2.gz HZWKGCGSGPINGG-LLVKDONJSA-N 1 2 322.449 4.439 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+][C@H]2CCOc3c(F)cccc32)s1 ZINC000279176458 1042280419 /nfs/dbraw/zinc/28/04/19/1042280419.db2.gz RHYKJSSXFNWDTM-ZDUSSCGKSA-N 1 2 320.433 4.193 20 0 DIADLO Cc1ccccc1[C@@H](NC(=O)Nc1ccc2[nH+]ccn2c1)C(C)C ZINC000606580189 1042288138 /nfs/dbraw/zinc/28/81/38/1042288138.db2.gz DGBRRAGLHUXQTE-SFHVURJKSA-N 1 2 322.412 4.162 20 0 DIADLO Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc3[nH+]ccn3c2)c(C)c1 ZINC000606582770 1042289119 /nfs/dbraw/zinc/28/91/19/1042289119.db2.gz CMUHNMBLLFUIAH-HNNXBMFYSA-N 1 2 322.412 4.176 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2c(C)nn(C(C)C)c2C)cs1 ZINC000893679142 1042299739 /nfs/dbraw/zinc/29/97/39/1042299739.db2.gz QFPOGZGJKGOHLS-QGZVFWFLSA-N 1 2 318.490 4.183 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2c(C)nn(C(C)C)c2C)cs1 ZINC000893679142 1042299744 /nfs/dbraw/zinc/29/97/44/1042299744.db2.gz QFPOGZGJKGOHLS-QGZVFWFLSA-N 1 2 318.490 4.183 20 0 DIADLO Cn1cc(Nc2cccc(Cn3cc[nH+]c3)c2)c2ccccc21 ZINC001203422838 1042304238 /nfs/dbraw/zinc/30/42/38/1042304238.db2.gz SFZLOYYVTMIJOY-UHFFFAOYSA-N 1 2 302.381 4.167 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ccnc(Cl)c2F)C2CC2)cc1 ZINC000823371539 1042322052 /nfs/dbraw/zinc/32/20/52/1042322052.db2.gz CNFHGTZUDIICPR-UHFFFAOYSA-N 1 2 308.759 4.178 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ccnc(Cl)c2F)C2CC2)cc1 ZINC000823371539 1042322065 /nfs/dbraw/zinc/32/20/65/1042322065.db2.gz CNFHGTZUDIICPR-UHFFFAOYSA-N 1 2 308.759 4.178 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1ccnc(Cl)c1F ZINC000823395009 1042323927 /nfs/dbraw/zinc/32/39/27/1042323927.db2.gz IKIAXTZPRMRMJC-SECBINFHSA-N 1 2 314.738 4.345 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccnc(Cl)c1F ZINC000823395009 1042323934 /nfs/dbraw/zinc/32/39/34/1042323934.db2.gz IKIAXTZPRMRMJC-SECBINFHSA-N 1 2 314.738 4.345 20 0 DIADLO CC[N@H+](Cc1ccnc(Cl)c1F)[C@H](C)c1cccc(O)c1 ZINC000823409269 1042324886 /nfs/dbraw/zinc/32/48/86/1042324886.db2.gz WOIWUGISFDUUSX-LLVKDONJSA-N 1 2 308.784 4.163 20 0 DIADLO CC[N@@H+](Cc1ccnc(Cl)c1F)[C@H](C)c1cccc(O)c1 ZINC000823409269 1042324891 /nfs/dbraw/zinc/32/48/91/1042324891.db2.gz WOIWUGISFDUUSX-LLVKDONJSA-N 1 2 308.784 4.163 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2cc(F)ncc2F)C1 ZINC000823459172 1042325865 /nfs/dbraw/zinc/32/58/65/1042325865.db2.gz RCTIHAIUJFEMNR-BDJLRTHQSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2cc(F)ncc2F)C1 ZINC000823459172 1042325877 /nfs/dbraw/zinc/32/58/77/1042325877.db2.gz RCTIHAIUJFEMNR-BDJLRTHQSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2F)[N@H+](Cc2cc(F)ncc2F)C1 ZINC000823459445 1042326121 /nfs/dbraw/zinc/32/61/21/1042326121.db2.gz UGPVYCZUNACQQE-MEDUHNTESA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2cc(F)ncc2F)C1 ZINC000823459445 1042326127 /nfs/dbraw/zinc/32/61/27/1042326127.db2.gz UGPVYCZUNACQQE-MEDUHNTESA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(F)ncc2F)[C@H]1c1cccc(F)c1 ZINC000823470957 1042327929 /nfs/dbraw/zinc/32/79/29/1042327929.db2.gz PHUMCYQXSOJTOI-APPDUMDISA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(F)ncc2F)[C@H]1c1cccc(F)c1 ZINC000823470957 1042327935 /nfs/dbraw/zinc/32/79/35/1042327935.db2.gz PHUMCYQXSOJTOI-APPDUMDISA-N 1 2 306.331 4.082 20 0 DIADLO CC(C)(C)n1cc(C[NH2+][C@H](c2ccco2)c2ccccc2)cn1 ZINC000124798929 1042359704 /nfs/dbraw/zinc/35/97/04/1042359704.db2.gz MZOZYODJKXOQTI-SFHVURJKSA-N 1 2 309.413 4.110 20 0 DIADLO CCc1nnc(C[NH2+]Cc2ccc(-c3ccccc3)c(C)c2)s1 ZINC000893711475 1042360389 /nfs/dbraw/zinc/36/03/89/1042360389.db2.gz LHXDVAMOBXRXOH-UHFFFAOYSA-N 1 2 323.465 4.366 20 0 DIADLO Cc1cc(N2CC(C)(C)[C@@H]2c2cccnc2)nc(C2CCC2)[nH+]1 ZINC000893947626 1042397422 /nfs/dbraw/zinc/39/74/22/1042397422.db2.gz JVGMZJWYWALBQV-KRWDZBQOSA-N 1 2 308.429 4.035 20 0 DIADLO CN(c1[nH+]ccc2c(N)cccc21)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000663917560 1042424025 /nfs/dbraw/zinc/42/40/25/1042424025.db2.gz ZWULWYCZONLJAE-TXEJJXNPSA-N 1 2 323.362 4.374 20 0 DIADLO CCC[N@H+](Cc1ccc(F)cc1)[C@H](C)c1nc(C2CC2)no1 ZINC000411204203 1042430729 /nfs/dbraw/zinc/43/07/29/1042430729.db2.gz UXJHCZWSQPVFCP-GFCCVEGCSA-N 1 2 303.381 4.059 20 0 DIADLO CCC[N@@H+](Cc1ccc(F)cc1)[C@H](C)c1nc(C2CC2)no1 ZINC000411204203 1042430732 /nfs/dbraw/zinc/43/07/32/1042430732.db2.gz UXJHCZWSQPVFCP-GFCCVEGCSA-N 1 2 303.381 4.059 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1ncoc1C(C)C)CCC2 ZINC000092805955 1042445497 /nfs/dbraw/zinc/44/54/97/1042445497.db2.gz NVTRGHNJMVFDPI-AWEZNQCLSA-N 1 2 319.474 4.326 20 0 DIADLO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ncoc1C(C)C)CCC2 ZINC000092805955 1042445498 /nfs/dbraw/zinc/44/54/98/1042445498.db2.gz NVTRGHNJMVFDPI-AWEZNQCLSA-N 1 2 319.474 4.326 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cc(F)cc2c1OCOC2 ZINC000052073685 1042465792 /nfs/dbraw/zinc/46/57/92/1042465792.db2.gz WNHDCVINXNCXSQ-GFCCVEGCSA-N 1 2 319.351 4.024 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cc(F)cc2c1OCOC2 ZINC000052073685 1042465797 /nfs/dbraw/zinc/46/57/97/1042465797.db2.gz WNHDCVINXNCXSQ-GFCCVEGCSA-N 1 2 319.351 4.024 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+](C)Cc1nc(-c2ccco2)no1 ZINC000052162044 1042483453 /nfs/dbraw/zinc/48/34/53/1042483453.db2.gz DUTVLYDKKFHVGL-LLVKDONJSA-N 1 2 317.776 4.176 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1nc(-c2ccco2)no1 ZINC000052162044 1042483456 /nfs/dbraw/zinc/48/34/56/1042483456.db2.gz DUTVLYDKKFHVGL-LLVKDONJSA-N 1 2 317.776 4.176 20 0 DIADLO Cc1c2ccccc2oc1C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000052909432 1042522322 /nfs/dbraw/zinc/52/23/22/1042522322.db2.gz YCVUXLGQBBBONG-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO C[C@@H](CC(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccccc1 ZINC000052909422 1042522395 /nfs/dbraw/zinc/52/23/95/1042522395.db2.gz ZVWYYXCCYDZTOF-HNNXBMFYSA-N 1 2 305.381 4.005 20 0 DIADLO FC(F)(F)c1ccc(Nc2ccn3cc[nH+]c3c2)c(Cl)n1 ZINC001204951701 1042523261 /nfs/dbraw/zinc/52/32/61/1042523261.db2.gz XGMXBOLFIJXQQE-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO Oc1ccc(F)c(C[NH2+]Cc2ccc(C3CCC3)cc2)c1F ZINC000513233566 1042530620 /nfs/dbraw/zinc/53/06/20/1042530620.db2.gz YYWPXGBWNFDMOM-UHFFFAOYSA-N 1 2 303.352 4.228 20 0 DIADLO Cc1ncsc1C[N@@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000513439903 1042541555 /nfs/dbraw/zinc/54/15/55/1042541555.db2.gz RCMFOSBDAUQXOF-UHFFFAOYSA-N 1 2 306.818 4.483 20 0 DIADLO Cc1ncsc1C[N@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000513439903 1042541558 /nfs/dbraw/zinc/54/15/58/1042541558.db2.gz RCMFOSBDAUQXOF-UHFFFAOYSA-N 1 2 306.818 4.483 20 0 DIADLO Cc1cc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)ccc1F ZINC000513443212 1042541869 /nfs/dbraw/zinc/54/18/69/1042541869.db2.gz MQKJZZXJSWGTCA-UHFFFAOYSA-N 1 2 309.388 4.060 20 0 DIADLO Cc1cc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)ccc1F ZINC000513443212 1042541874 /nfs/dbraw/zinc/54/18/74/1042541874.db2.gz MQKJZZXJSWGTCA-UHFFFAOYSA-N 1 2 309.388 4.060 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+](Cc1nnc(C2CC2)o1)C1CC1 ZINC000072579490 1042592860 /nfs/dbraw/zinc/59/28/60/1042592860.db2.gz QVZVAGVSPUMGTH-LLVKDONJSA-N 1 2 317.820 4.326 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](Cc1nnc(C2CC2)o1)C1CC1 ZINC000072579490 1042592864 /nfs/dbraw/zinc/59/28/64/1042592864.db2.gz QVZVAGVSPUMGTH-LLVKDONJSA-N 1 2 317.820 4.326 20 0 DIADLO CCC[C@H](NC(=O)NCc1cc(C)[nH+]c(C)c1)c1ccccc1 ZINC000420769467 1042612842 /nfs/dbraw/zinc/61/28/42/1042612842.db2.gz XWLKYKILRHWEBA-SFHVURJKSA-N 1 2 311.429 4.039 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)cs1 ZINC000420951142 1042616351 /nfs/dbraw/zinc/61/63/51/1042616351.db2.gz QOHYWJSOLGVVTD-MNOVXSKESA-N 1 2 322.396 4.015 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cs1 ZINC000420951142 1042616354 /nfs/dbraw/zinc/61/63/54/1042616354.db2.gz QOHYWJSOLGVVTD-MNOVXSKESA-N 1 2 322.396 4.015 20 0 DIADLO CCCn1c(C)nnc1C[N@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000421004828 1042620564 /nfs/dbraw/zinc/62/05/64/1042620564.db2.gz IQXYBMADTXVFPQ-CYBMUJFWSA-N 1 2 306.479 4.030 20 0 DIADLO CCCn1c(C)nnc1C[N@@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000421004828 1042620566 /nfs/dbraw/zinc/62/05/66/1042620566.db2.gz IQXYBMADTXVFPQ-CYBMUJFWSA-N 1 2 306.479 4.030 20 0 DIADLO FC(F)(F)c1ccnc(C[NH2+]Cc2ccc(C3CCC3)cc2)n1 ZINC000414503100 1042626956 /nfs/dbraw/zinc/62/69/56/1042626956.db2.gz HUBQIVZYZMWJMP-UHFFFAOYSA-N 1 2 321.346 4.053 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nn(C)c(C)c2Cl)s1 ZINC000421319459 1042629873 /nfs/dbraw/zinc/62/98/73/1042629873.db2.gz NAQWPTIQZSYRAQ-ZDUSSCGKSA-N 1 2 309.866 4.089 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nn(C)c(C)c2Cl)s1 ZINC000421319459 1042629875 /nfs/dbraw/zinc/62/98/75/1042629875.db2.gz NAQWPTIQZSYRAQ-ZDUSSCGKSA-N 1 2 309.866 4.089 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+]Cc2nn(C)c(C)c2Cl)cc1 ZINC000421329086 1042630685 /nfs/dbraw/zinc/63/06/85/1042630685.db2.gz UOQXTZHOKPHHJS-NSHDSACASA-N 1 2 323.893 4.345 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H](c2ccc(F)c(C)c2)C2CC2)nn1C ZINC000421340740 1042630812 /nfs/dbraw/zinc/63/08/12/1042630812.db2.gz JTWHVPLGFQCHDA-KRWDZBQOSA-N 1 2 321.827 4.070 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cccc(C2CC2)c1)c1nc(C2CC2)no1 ZINC000421341117 1042630979 /nfs/dbraw/zinc/63/09/79/1042630979.db2.gz KYAKGASHNBECJJ-QGZVFWFLSA-N 1 2 311.429 4.311 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H](C)c2ccc(OC(C)C)cc2)nn1C ZINC000421337351 1042632517 /nfs/dbraw/zinc/63/25/17/1042632517.db2.gz YTFFNCGQZOPYQW-GFCCVEGCSA-N 1 2 321.852 4.020 20 0 DIADLO COCc1cnc(C[N@H+](C(C)C)[C@@H](C)c2ccsc2)s1 ZINC000421371181 1042633623 /nfs/dbraw/zinc/63/36/23/1042633623.db2.gz KKYFAVVQCWVLKV-LBPRGKRZSA-N 1 2 310.488 4.323 20 0 DIADLO COCc1cnc(C[N@@H+](C(C)C)[C@@H](C)c2ccsc2)s1 ZINC000421371181 1042633626 /nfs/dbraw/zinc/63/36/26/1042633626.db2.gz KKYFAVVQCWVLKV-LBPRGKRZSA-N 1 2 310.488 4.323 20 0 DIADLO CC[C@H]1C[C@H](C)C[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000072698381 1042641558 /nfs/dbraw/zinc/64/15/58/1042641558.db2.gz YJLFWDZFTREGAK-QWRGUYRKSA-N 1 2 315.244 4.052 20 0 DIADLO CC[C@H]1C[C@H](C)C[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000072698381 1042641562 /nfs/dbraw/zinc/64/15/62/1042641562.db2.gz YJLFWDZFTREGAK-QWRGUYRKSA-N 1 2 315.244 4.052 20 0 DIADLO CC[C@H]1C[C@@H](C)C[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000072698383 1042641573 /nfs/dbraw/zinc/64/15/73/1042641573.db2.gz YJLFWDZFTREGAK-MNOVXSKESA-N 1 2 315.244 4.052 20 0 DIADLO CC[C@H]1C[C@@H](C)C[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000072698383 1042641574 /nfs/dbraw/zinc/64/15/74/1042641574.db2.gz YJLFWDZFTREGAK-MNOVXSKESA-N 1 2 315.244 4.052 20 0 DIADLO CSc1ccc(Cl)c(C(=O)NCc2cc(C)[nH+]c(C)c2)c1 ZINC000421562500 1042643340 /nfs/dbraw/zinc/64/33/40/1042643340.db2.gz VPNSQWPJMZUFSK-UHFFFAOYSA-N 1 2 320.845 4.004 20 0 DIADLO Cc1sc(C[NH2+][C@@H](C)c2ccncc2Cl)nc1C(C)C ZINC000421828635 1042654541 /nfs/dbraw/zinc/65/45/41/1042654541.db2.gz DQIDQACIXYYOIH-JTQLQIEISA-N 1 2 309.866 4.474 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H](C)c1ccncc1Cl ZINC000421828141 1042654595 /nfs/dbraw/zinc/65/45/95/1042654595.db2.gz BHBXLLXSZQXWJI-WDEREUQCSA-N 1 2 308.784 4.295 20 0 DIADLO COc1cc(Cl)ccc1[C@H](C)[NH2+][C@@H](C)c1nnc(C(C)C)[nH]1 ZINC000421837539 1042656065 /nfs/dbraw/zinc/65/60/65/1042656065.db2.gz RHVGBZLLZRYKBI-QWRGUYRKSA-N 1 2 322.840 4.002 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@@H](C)c2ccncc2Cl)on1 ZINC000421836692 1042656299 /nfs/dbraw/zinc/65/62/99/1042656299.db2.gz REXNBYVSMWAVEH-NSHDSACASA-N 1 2 307.825 4.477 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2cscn2)c(OC(C)(C)C)c1 ZINC000271071821 1042662067 /nfs/dbraw/zinc/66/20/67/1042662067.db2.gz FJVQBJKSHHFEID-CYBMUJFWSA-N 1 2 304.459 4.480 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@@H](CC)c2ccccc2)n1 ZINC000271715762 1042666197 /nfs/dbraw/zinc/66/61/97/1042666197.db2.gz VUZAFBIWAYALOJ-OCCSQVGLSA-N 1 2 305.447 4.125 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc([C@H](C)OCC(C)C)no1)c1ccccc1 ZINC000271701107 1042666420 /nfs/dbraw/zinc/66/64/20/1042666420.db2.gz SNGJKOSZXYIBDV-GOEBONIOSA-N 1 2 317.433 4.044 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@H](C)c2cc(F)ccc2OC)n1 ZINC000271704425 1042666579 /nfs/dbraw/zinc/66/65/79/1042666579.db2.gz UPLSEELKBXJQFB-CYBMUJFWSA-N 1 2 319.424 4.243 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1cccc(-n2cccn2)c1 ZINC000271751913 1042667052 /nfs/dbraw/zinc/66/70/52/1042667052.db2.gz GAAPFXXENFHJBH-AWEZNQCLSA-N 1 2 324.428 4.009 20 0 DIADLO Cc1cc([C@H]([NH2+]Cc2ncc(C3CC3)o2)C2CC2)ccc1F ZINC000271775604 1042667818 /nfs/dbraw/zinc/66/78/18/1042667818.db2.gz AOQQYYKINGMMHE-GOSISDBHSA-N 1 2 300.377 4.240 20 0 DIADLO Cc1cc([C@@H]([NH2+]Cc2ncc(C3CC3)o2)C2CC2)ccc1F ZINC000271775605 1042667824 /nfs/dbraw/zinc/66/78/24/1042667824.db2.gz AOQQYYKINGMMHE-SFHVURJKSA-N 1 2 300.377 4.240 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(-c2cccnc2)cc1 ZINC000271803078 1042668861 /nfs/dbraw/zinc/66/88/61/1042668861.db2.gz PVICTEZMRAJNJG-AWEZNQCLSA-N 1 2 319.408 4.465 20 0 DIADLO Cc1cc([C@H]([NH2+][C@@H](C)c2nc(C3CC3)no2)C2CC2)ccc1F ZINC000272055860 1042676055 /nfs/dbraw/zinc/67/60/55/1042676055.db2.gz HBAIKCDZWVZBGR-MEDUHNTESA-N 1 2 315.392 4.196 20 0 DIADLO Cc1cc(CNC(=O)N(C)[C@@H]2CCC[C@H]2C(C)(C)C)cc(C)[nH+]1 ZINC000422215291 1042682332 /nfs/dbraw/zinc/68/23/32/1042682332.db2.gz UEXJDCKUPLAIFF-IAGOWNOFSA-N 1 2 317.477 4.055 20 0 DIADLO CC[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(OC)c(OC)c1 ZINC000423205738 1042699560 /nfs/dbraw/zinc/69/95/60/1042699560.db2.gz BGQXDSABFUSPMB-INIZCTEOSA-N 1 2 312.413 4.235 20 0 DIADLO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]c2ccc3c(c2)CCN3)cc1 ZINC000423212597 1042699585 /nfs/dbraw/zinc/69/95/85/1042699585.db2.gz IMLZLVFNFPOECS-UPRAQXHNSA-N 1 2 308.425 4.267 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccccc1OC(F)F ZINC000423206259 1042700148 /nfs/dbraw/zinc/70/01/48/1042700148.db2.gz BQIDXLROTSADOH-LLVKDONJSA-N 1 2 304.340 4.429 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cccc(N2CCCCCC2)c1 ZINC000424136921 1042727227 /nfs/dbraw/zinc/72/72/27/1042727227.db2.gz ADPZUGMYUJPDER-UHFFFAOYSA-N 1 2 312.461 4.457 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1ccc(OC)cc1Cl)c1ccc(C)o1 ZINC000424289175 1042731566 /nfs/dbraw/zinc/73/15/66/1042731566.db2.gz AFKRGAKDBVYIOV-WBMJQRKESA-N 1 2 323.820 4.288 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccnn1C1CCC1 ZINC000924969749 1042739692 /nfs/dbraw/zinc/73/96/92/1042739692.db2.gz KWYGPSMWLVPOBQ-GFCCVEGCSA-N 1 2 318.490 4.213 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@H]2CCc3c2nccc3Cl)n1 ZINC000924970079 1042740254 /nfs/dbraw/zinc/74/02/54/1042740254.db2.gz NXCHIMIHCUOVPK-LBPRGKRZSA-N 1 2 321.877 4.266 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1ccc(C(F)F)nc1 ZINC000637903654 1042740884 /nfs/dbraw/zinc/74/08/84/1042740884.db2.gz RFBJTAUAHUZCDF-SNVBAGLBSA-N 1 2 312.310 4.490 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1ccc(C(F)F)nc1 ZINC000637903654 1042740888 /nfs/dbraw/zinc/74/08/88/1042740888.db2.gz RFBJTAUAHUZCDF-SNVBAGLBSA-N 1 2 312.310 4.490 20 0 DIADLO Cc1ncc([C@H](C)[N@H+](C)[C@H](C)c2cc(F)ccc2F)c(C)n1 ZINC000637902200 1042741139 /nfs/dbraw/zinc/74/11/39/1042741139.db2.gz JYYUNLPHVLYIOK-NEPJUHHUSA-N 1 2 305.372 4.126 20 0 DIADLO Cc1ncc([C@H](C)[N@@H+](C)[C@H](C)c2cc(F)ccc2F)c(C)n1 ZINC000637902200 1042741143 /nfs/dbraw/zinc/74/11/43/1042741143.db2.gz JYYUNLPHVLYIOK-NEPJUHHUSA-N 1 2 305.372 4.126 20 0 DIADLO Brc1sccc1C[N@@H+]1CCc2ccsc2C1 ZINC000711814713 1042754614 /nfs/dbraw/zinc/75/46/14/1042754614.db2.gz AKCLAAZFKBQBHE-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO Brc1sccc1C[N@H+]1CCc2ccsc2C1 ZINC000711814713 1042754617 /nfs/dbraw/zinc/75/46/17/1042754617.db2.gz AKCLAAZFKBQBHE-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO C[N@H+](CCC(F)(F)F)Cc1coc(-c2cccc(Cl)c2)n1 ZINC000514010059 1042766847 /nfs/dbraw/zinc/76/68/47/1042766847.db2.gz RVIQQJYWDBWWIK-UHFFFAOYSA-N 1 2 318.726 4.379 20 0 DIADLO C[N@@H+](CCC(F)(F)F)Cc1coc(-c2cccc(Cl)c2)n1 ZINC000514010059 1042766854 /nfs/dbraw/zinc/76/68/54/1042766854.db2.gz RVIQQJYWDBWWIK-UHFFFAOYSA-N 1 2 318.726 4.379 20 0 DIADLO CCCOc1cccc2c(NCc3oc(C)nc3C)cc[nH+]c12 ZINC000425268239 1042786391 /nfs/dbraw/zinc/78/63/91/1042786391.db2.gz NWOXLJHOEXZMCS-UHFFFAOYSA-N 1 2 311.385 4.241 20 0 DIADLO FC(F)CC1C[NH+](Cc2cc(Cl)ccc2Br)C1 ZINC000425368898 1042799720 /nfs/dbraw/zinc/79/97/20/1042799720.db2.gz YEVJQMJWIRSVQH-UHFFFAOYSA-N 1 2 324.596 4.190 20 0 DIADLO COc1c(F)cc(F)cc1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001143560782 1042811192 /nfs/dbraw/zinc/81/11/92/1042811192.db2.gz DUCYSEDJYRXJPH-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cc(F)cc1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001143560782 1042811197 /nfs/dbraw/zinc/81/11/97/1042811197.db2.gz DUCYSEDJYRXJPH-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO CC(C)(C)C[N@H+](Cc1nc(C(F)F)no1)Cc1ccccc1 ZINC000425401133 1042812160 /nfs/dbraw/zinc/81/21/60/1042812160.db2.gz ZZHULMRFNIETAI-UHFFFAOYSA-N 1 2 309.360 4.056 20 0 DIADLO CC(C)(C)C[N@@H+](Cc1nc(C(F)F)no1)Cc1ccccc1 ZINC000425401133 1042812164 /nfs/dbraw/zinc/81/21/64/1042812164.db2.gz ZZHULMRFNIETAI-UHFFFAOYSA-N 1 2 309.360 4.056 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(F)F)no1)c1cc2ccccc2s1 ZINC000425431352 1042821135 /nfs/dbraw/zinc/82/11/35/1042821135.db2.gz IAQWEVLLHYMFRN-MRVPVSSYSA-N 1 2 309.341 4.073 20 0 DIADLO FC(F)c1noc(C[NH2+][C@H](CC2CCC2)c2ccccc2)n1 ZINC000425452819 1042825301 /nfs/dbraw/zinc/82/53/01/1042825301.db2.gz DLGZZZKMMGWNOY-CYBMUJFWSA-N 1 2 307.344 4.028 20 0 DIADLO CCCc1nc(C[N@H+](C)CCOc2ccc(Cl)cc2)cs1 ZINC000515539526 1042825430 /nfs/dbraw/zinc/82/54/30/1042825430.db2.gz URZPSSNUICZKHS-UHFFFAOYSA-N 1 2 324.877 4.260 20 0 DIADLO CCCc1nc(C[N@@H+](C)CCOc2ccc(Cl)cc2)cs1 ZINC000515539526 1042825435 /nfs/dbraw/zinc/82/54/35/1042825435.db2.gz URZPSSNUICZKHS-UHFFFAOYSA-N 1 2 324.877 4.260 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(F)F)no1)c1cccc2ccccc21 ZINC000425461290 1042827499 /nfs/dbraw/zinc/82/74/99/1042827499.db2.gz RVCBQZUHMISOAC-SNVBAGLBSA-N 1 2 303.312 4.011 20 0 DIADLO Cc1cc(C)c(C(=O)N2C[C@@H](c3ccccc3C)C[C@@H]2C)c(C)[nH+]1 ZINC001126443537 1042828186 /nfs/dbraw/zinc/82/81/86/1042828186.db2.gz IKIMNLOETRTUCJ-WMZOPIPTSA-N 1 2 322.452 4.333 20 0 DIADLO CC(C)(C)c1ncc(CNc2ccc(N3CCCC3)c[nH+]2)s1 ZINC000515817356 1042836456 /nfs/dbraw/zinc/83/64/56/1042836456.db2.gz OBTGTELZGKZDSL-UHFFFAOYSA-N 1 2 316.474 4.048 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1cc(F)cc(F)c1OC ZINC001143563232 1042861736 /nfs/dbraw/zinc/86/17/36/1042861736.db2.gz RGTWEBSXNLBDKF-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1cc(F)cc(F)c1OC ZINC001143563232 1042861740 /nfs/dbraw/zinc/86/17/40/1042861740.db2.gz RGTWEBSXNLBDKF-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO Cc1nc(Cc2[nH+]ccn2Cc2ccccc2)sc1C(C)C ZINC000516971504 1042862303 /nfs/dbraw/zinc/86/23/03/1042862303.db2.gz YUSFBIGHYVHHOJ-UHFFFAOYSA-N 1 2 311.454 4.411 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(-c3ccccc3)n2)CCC1(F)F ZINC000516962906 1042862372 /nfs/dbraw/zinc/86/23/72/1042862372.db2.gz KXPRNRGYKXPVRA-GFCCVEGCSA-N 1 2 308.397 4.287 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(-c3ccccc3)n2)CCC1(F)F ZINC000516962906 1042862377 /nfs/dbraw/zinc/86/23/77/1042862377.db2.gz KXPRNRGYKXPVRA-GFCCVEGCSA-N 1 2 308.397 4.287 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@H](c2cnn(C)c2)c2ccccc2)o1 ZINC000366673052 1042863065 /nfs/dbraw/zinc/86/30/65/1042863065.db2.gz CXBYLLQBRHYHDK-LIRRHRJNSA-N 1 2 309.413 4.016 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1ccc2ccccc2n1 ZINC000517550954 1042885848 /nfs/dbraw/zinc/88/58/48/1042885848.db2.gz WRFVMPVYHWJHAU-UHFFFAOYSA-N 1 2 300.764 4.317 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H]2CCCc3c(Cl)ccnc32)cs1 ZINC000925033677 1042899942 /nfs/dbraw/zinc/89/99/42/1042899942.db2.gz NASLTWGGXSMGFV-MFKMUULPSA-N 1 2 321.877 4.482 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccnn2C2CCC2)cs1 ZINC000925034523 1042902198 /nfs/dbraw/zinc/90/21/98/1042902198.db2.gz SZZRPYLODQBNHX-NEPJUHHUSA-N 1 2 304.463 4.039 20 0 DIADLO FC[C@H]1CCC[N@@H+]1Cc1cc2cccc(Cl)c2nc1Cl ZINC001141551863 1042908454 /nfs/dbraw/zinc/90/84/54/1042908454.db2.gz SUYVWAOJRAFYLY-GFCCVEGCSA-N 1 2 313.203 4.476 20 0 DIADLO FC[C@H]1CCC[N@H+]1Cc1cc2cccc(Cl)c2nc1Cl ZINC001141551863 1042908455 /nfs/dbraw/zinc/90/84/55/1042908455.db2.gz SUYVWAOJRAFYLY-GFCCVEGCSA-N 1 2 313.203 4.476 20 0 DIADLO CC(C)c1cc(N[C@@H](C)c2ccc(Cl)cn2)nc(C(C)C)[nH+]1 ZINC000439128733 1042914483 /nfs/dbraw/zinc/91/44/83/1042914483.db2.gz OVUKJOMMPYFYKR-LBPRGKRZSA-N 1 2 318.852 4.945 20 0 DIADLO CCOc1cc(F)c(C[N@@H+]2CCC[C@H]2c2cccnc2)c(F)c1 ZINC001143565579 1042915515 /nfs/dbraw/zinc/91/55/15/1042915515.db2.gz ZLJLPJMXHJHRQR-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(F)c(C[N@H+]2CCC[C@H]2c2cccnc2)c(F)c1 ZINC001143565579 1042915519 /nfs/dbraw/zinc/91/55/19/1042915519.db2.gz ZLJLPJMXHJHRQR-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)c(F)c1 ZINC001143565574 1042915828 /nfs/dbraw/zinc/91/58/28/1042915828.db2.gz ZLJLPJMXHJHRQR-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(F)c(C[N@H+]2CCC[C@@H]2c2cccnc2)c(F)c1 ZINC001143565574 1042915830 /nfs/dbraw/zinc/91/58/30/1042915830.db2.gz ZLJLPJMXHJHRQR-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CCn1cc([C@H](C)[NH2+]Cc2csc(C3CCCCC3)n2)cn1 ZINC000296157462 1042916007 /nfs/dbraw/zinc/91/60/07/1042916007.db2.gz SPKONONEBXAEAD-ZDUSSCGKSA-N 1 2 318.490 4.258 20 0 DIADLO C[N@H+](Cc1nc(-c2ccsc2)no1)Cc1ccc(Cl)cc1 ZINC000015301833 1042923825 /nfs/dbraw/zinc/92/38/25/1042923825.db2.gz ODVAVPQKLHFPGQ-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccsc2)no1)Cc1ccc(Cl)cc1 ZINC000015301833 1042923826 /nfs/dbraw/zinc/92/38/26/1042923826.db2.gz ODVAVPQKLHFPGQ-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCc3ccccc3C2)cs1 ZINC000518912421 1042925363 /nfs/dbraw/zinc/92/53/63/1042925363.db2.gz HZHWFZMHPYPAKQ-UHFFFAOYSA-N 1 2 300.471 4.290 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCc3ccccc3C2)cs1 ZINC000518912421 1042925365 /nfs/dbraw/zinc/92/53/65/1042925365.db2.gz HZHWFZMHPYPAKQ-UHFFFAOYSA-N 1 2 300.471 4.290 20 0 DIADLO CC(C)[C@@H](C)NC(=O)C[N@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000519193071 1042937034 /nfs/dbraw/zinc/93/70/34/1042937034.db2.gz YMCFYBGNAOCSGX-KGLIPLIRSA-N 1 2 322.880 4.026 20 0 DIADLO CC(C)[C@@H](C)NC(=O)C[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000519193071 1042937038 /nfs/dbraw/zinc/93/70/38/1042937038.db2.gz YMCFYBGNAOCSGX-KGLIPLIRSA-N 1 2 322.880 4.026 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(C(F)(F)F)cn2)[C@@H]1c1ccncc1 ZINC000664829391 1042967124 /nfs/dbraw/zinc/96/71/24/1042967124.db2.gz MSCFHTDMRUSGIV-OAHLLOKOSA-N 1 2 321.346 4.079 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(C(F)(F)F)cn2)[C@@H]1c1ccncc1 ZINC000664829391 1042967129 /nfs/dbraw/zinc/96/71/29/1042967129.db2.gz MSCFHTDMRUSGIV-OAHLLOKOSA-N 1 2 321.346 4.079 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@H+](Cc2c[nH]c(-c3ccccc3)n2)C1 ZINC000519557071 1042968014 /nfs/dbraw/zinc/96/80/14/1042968014.db2.gz PEVJZWNTAGLSAB-HXUWFJFHSA-N 1 2 321.399 4.147 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@@H+](Cc2c[nH]c(-c3ccccc3)n2)C1 ZINC000519557071 1042968020 /nfs/dbraw/zinc/96/80/20/1042968020.db2.gz PEVJZWNTAGLSAB-HXUWFJFHSA-N 1 2 321.399 4.147 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000664832373 1042968667 /nfs/dbraw/zinc/96/86/67/1042968667.db2.gz JMBINZLLPQEIFW-CXAGYDPISA-N 1 2 307.397 4.367 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000664832373 1042968669 /nfs/dbraw/zinc/96/86/69/1042968669.db2.gz JMBINZLLPQEIFW-CXAGYDPISA-N 1 2 307.397 4.367 20 0 DIADLO Cc1cccc(OCC[N@@H+](C)Cc2csc(C(C)C)n2)c1 ZINC000058563470 1042973906 /nfs/dbraw/zinc/97/39/06/1042973906.db2.gz JVKODMZXXMBOMW-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO Cc1cccc(OCC[N@H+](C)Cc2csc(C(C)C)n2)c1 ZINC000058563470 1042973910 /nfs/dbraw/zinc/97/39/10/1042973910.db2.gz JVKODMZXXMBOMW-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO Cc1cc(NCc2cccc(Br)c2)nc(C(C)C)[nH+]1 ZINC000048819039 1042979244 /nfs/dbraw/zinc/97/92/44/1042979244.db2.gz BDDCOPVQKWOVPF-UHFFFAOYSA-N 1 2 320.234 4.283 20 0 DIADLO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1c(F)c(F)c(F)c(F)c1F ZINC000729473987 1042984845 /nfs/dbraw/zinc/98/48/45/1042984845.db2.gz ARSMATBCXCRLNU-SECBINFHSA-N 1 2 307.306 4.393 20 0 DIADLO CC(C)(C)[C@H]1CCC[N@H+]1Cc1c(F)c(F)c(F)c(F)c1F ZINC000729473987 1042984847 /nfs/dbraw/zinc/98/48/47/1042984847.db2.gz ARSMATBCXCRLNU-SECBINFHSA-N 1 2 307.306 4.393 20 0 DIADLO Cc1ccccc1C[N@@H+](Cc1nc(CCC(C)C)no1)C1CC1 ZINC000519903690 1043008824 /nfs/dbraw/zinc/00/88/24/1043008824.db2.gz SYHKQCQGTKVSAR-UHFFFAOYSA-N 1 2 313.445 4.131 20 0 DIADLO Cc1ccccc1C[N@H+](Cc1nc(CCC(C)C)no1)C1CC1 ZINC000519903690 1043008829 /nfs/dbraw/zinc/00/88/29/1043008829.db2.gz SYHKQCQGTKVSAR-UHFFFAOYSA-N 1 2 313.445 4.131 20 0 DIADLO CCOc1nnc(C[N@@H+]2CCCCC[C@@H]2c2ccccc2)s1 ZINC000519904099 1043008925 /nfs/dbraw/zinc/00/89/25/1043008925.db2.gz SUWXBFYWVNNAGY-OAHLLOKOSA-N 1 2 317.458 4.054 20 0 DIADLO CCOc1nnc(C[N@H+]2CCCCC[C@@H]2c2ccccc2)s1 ZINC000519904099 1043008929 /nfs/dbraw/zinc/00/89/29/1043008929.db2.gz SUWXBFYWVNNAGY-OAHLLOKOSA-N 1 2 317.458 4.054 20 0 DIADLO Cc1ccc(S[C@@H](C)C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000519963858 1043011781 /nfs/dbraw/zinc/01/17/81/1043011781.db2.gz WYCVAWHLFFRLGH-HNNXBMFYSA-N 1 2 314.454 4.435 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2nc(-c3ccccc3)c[nH]2)c(C)s1 ZINC000441019340 1043016092 /nfs/dbraw/zinc/01/60/92/1043016092.db2.gz WSIPQVCQVOLXFW-UHFFFAOYSA-N 1 2 311.454 4.387 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2nc(-c3ccccc3)c[nH]2)c(C)s1 ZINC000441019340 1043016096 /nfs/dbraw/zinc/01/60/96/1043016096.db2.gz WSIPQVCQVOLXFW-UHFFFAOYSA-N 1 2 311.454 4.387 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+]1CCc2ccc(F)cc2C1 ZINC000441048294 1043017746 /nfs/dbraw/zinc/01/77/46/1043017746.db2.gz IPVGMXPFMDDSCZ-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+]1CCc2ccc(F)cc2C1 ZINC000441048294 1043017748 /nfs/dbraw/zinc/01/77/48/1043017748.db2.gz IPVGMXPFMDDSCZ-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO CCCN(C(=O)C[C@H](C)n1cc[nH+]c1)c1cccc2ccccc21 ZINC000520235345 1043027109 /nfs/dbraw/zinc/02/71/09/1043027109.db2.gz YEIJMXDZLKQMRW-INIZCTEOSA-N 1 2 321.424 4.431 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@@H]3c3ccccn3)sc2c1 ZINC000520321622 1043033371 /nfs/dbraw/zinc/03/33/71/1043033371.db2.gz NXNHYQUWOKKCKE-OAHLLOKOSA-N 1 2 313.401 4.168 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@@H]3c3ccccn3)sc2c1 ZINC000520321622 1043033375 /nfs/dbraw/zinc/03/33/75/1043033375.db2.gz NXNHYQUWOKKCKE-OAHLLOKOSA-N 1 2 313.401 4.168 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2cn3ccsc3n2)C1 ZINC000441329019 1043036963 /nfs/dbraw/zinc/03/69/63/1043036963.db2.gz DODCSTJETVXQKY-LRDDRELGSA-N 1 2 315.417 4.118 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2cn3ccsc3n2)C1 ZINC000441329019 1043036967 /nfs/dbraw/zinc/03/69/67/1043036967.db2.gz DODCSTJETVXQKY-LRDDRELGSA-N 1 2 315.417 4.118 20 0 DIADLO Cc1[nH]ncc1C[NH2+]Cc1sc2ccc(Cl)cc2c1C ZINC000441354981 1043038426 /nfs/dbraw/zinc/03/84/26/1043038426.db2.gz OPHSJFWYBCIOGU-UHFFFAOYSA-N 1 2 305.834 4.184 20 0 DIADLO CCCCc1noc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccc(F)c2)n1 ZINC000441345095 1043039217 /nfs/dbraw/zinc/03/92/17/1043039217.db2.gz ZRKCLSBWRXRTFH-XJKSGUPXSA-N 1 2 317.408 4.134 20 0 DIADLO CCCCc1noc(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccc(F)c2)n1 ZINC000441345095 1043039221 /nfs/dbraw/zinc/03/92/21/1043039221.db2.gz ZRKCLSBWRXRTFH-XJKSGUPXSA-N 1 2 317.408 4.134 20 0 DIADLO CC[C@@H](C[N@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894963400 1043055455 /nfs/dbraw/zinc/05/54/55/1043055455.db2.gz YUVZLKHNOBJOOI-QFBILLFUSA-N 1 2 320.440 4.020 20 0 DIADLO CC[C@@H](C[N@@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894963400 1043055462 /nfs/dbraw/zinc/05/54/62/1043055462.db2.gz YUVZLKHNOBJOOI-QFBILLFUSA-N 1 2 320.440 4.020 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)n1 ZINC000894974577 1043057229 /nfs/dbraw/zinc/05/72/29/1043057229.db2.gz GNDXKHTXBLXQQG-LLVKDONJSA-N 1 2 304.356 4.137 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)n1 ZINC000894974577 1043057243 /nfs/dbraw/zinc/05/72/43/1043057243.db2.gz GNDXKHTXBLXQQG-LLVKDONJSA-N 1 2 304.356 4.137 20 0 DIADLO Cc1cc(N[C@H](C)c2cc3cnccc3o2)nc(C2CCC2)[nH+]1 ZINC000895037136 1043066917 /nfs/dbraw/zinc/06/69/17/1043066917.db2.gz DPANECDJZMGPHL-GFCCVEGCSA-N 1 2 308.385 4.367 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000174962766 1043073043 /nfs/dbraw/zinc/07/30/43/1043073043.db2.gz OBUGXXGYVXDWFK-SNVBAGLBSA-N 1 2 300.349 4.355 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000174962766 1043073056 /nfs/dbraw/zinc/07/30/56/1043073056.db2.gz OBUGXXGYVXDWFK-SNVBAGLBSA-N 1 2 300.349 4.355 20 0 DIADLO Cc1ccc(C[N@H+](Cc2nnc(C(C)(C)C)o2)C2CC2)cc1C ZINC000120454763 1043072965 /nfs/dbraw/zinc/07/29/65/1043072965.db2.gz AOBBJLKMWHZCHH-UHFFFAOYSA-N 1 2 313.445 4.149 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2nnc(C(C)(C)C)o2)C2CC2)cc1C ZINC000120454763 1043072976 /nfs/dbraw/zinc/07/29/76/1043072976.db2.gz AOBBJLKMWHZCHH-UHFFFAOYSA-N 1 2 313.445 4.149 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CCC[C@@H]2c2cccs2)cs1 ZINC000175030558 1043073491 /nfs/dbraw/zinc/07/34/91/1043073491.db2.gz NKPUWXVLWCUXFI-WCQYABFASA-N 1 2 308.472 4.249 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CCC[C@@H]2c2cccs2)cs1 ZINC000175030558 1043073502 /nfs/dbraw/zinc/07/35/02/1043073502.db2.gz NKPUWXVLWCUXFI-WCQYABFASA-N 1 2 308.472 4.249 20 0 DIADLO CCC[N@H+](Cc1csc([C@@H](C)OC)n1)Cc1ccccc1 ZINC000175026658 1043073784 /nfs/dbraw/zinc/07/37/84/1043073784.db2.gz XPERJERBAZFUMC-CQSZACIVSA-N 1 2 304.459 4.263 20 0 DIADLO CCC[N@@H+](Cc1csc([C@@H](C)OC)n1)Cc1ccccc1 ZINC000175026658 1043073796 /nfs/dbraw/zinc/07/37/96/1043073796.db2.gz XPERJERBAZFUMC-CQSZACIVSA-N 1 2 304.459 4.263 20 0 DIADLO C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@H+](C)Cc1nccs1 ZINC000175048206 1043076245 /nfs/dbraw/zinc/07/62/45/1043076245.db2.gz SIBHKXDLKCODOO-JTQLQIEISA-N 1 2 316.348 4.235 20 0 DIADLO C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@@H+](C)Cc1nccs1 ZINC000175048206 1043076256 /nfs/dbraw/zinc/07/62/56/1043076256.db2.gz SIBHKXDLKCODOO-JTQLQIEISA-N 1 2 316.348 4.235 20 0 DIADLO CCC[C@H](O)CCCSCc1c[nH+]cn1Cc1ccccc1 ZINC000865379162 1043087681 /nfs/dbraw/zinc/08/76/81/1043087681.db2.gz LZJGIXPFWDACNU-SFHVURJKSA-N 1 2 318.486 4.106 20 0 DIADLO CC(C)O[C@H](COc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000427568083 1043096936 /nfs/dbraw/zinc/09/69/36/1043096936.db2.gz CQZBUNGCIIILKU-HXUWFJFHSA-N 1 2 322.408 4.417 20 0 DIADLO c1csc(C([NH2+]Cc2cn(C3CC3)cn2)c2cccs2)c1 ZINC000865470932 1043103255 /nfs/dbraw/zinc/10/32/55/1043103255.db2.gz LXDZHAWTWYFYQE-UHFFFAOYSA-N 1 2 315.467 4.220 20 0 DIADLO CC(C)(C)c1csc(C[NH2+]Cc2ccc3c(n2)CCCC3)n1 ZINC000865545077 1043112399 /nfs/dbraw/zinc/11/23/99/1043112399.db2.gz RIPWALZAHFXXSJ-UHFFFAOYSA-N 1 2 315.486 4.004 20 0 DIADLO Cc1cc(Cl)nc(C[NH2+]Cc2nc(C(C)(C)C)cs2)c1 ZINC000865555428 1043112918 /nfs/dbraw/zinc/11/29/18/1043112918.db2.gz ZJPPIRFMUCGING-UHFFFAOYSA-N 1 2 309.866 4.087 20 0 DIADLO Cc1cc(C)c(CNc2ccc(-c3cnn(C)c3)c(C)[nH+]2)c(C)c1 ZINC001202519015 1043120448 /nfs/dbraw/zinc/12/04/48/1043120448.db2.gz CUIXTWWUXKHBBE-UHFFFAOYSA-N 1 2 320.440 4.328 20 0 DIADLO COc1cc(C(F)(F)F)ccc1C[NH+]1Cc2ccccc2C1 ZINC001141602847 1043130894 /nfs/dbraw/zinc/13/08/94/1043130894.db2.gz RBEUIPVMRVDCEW-UHFFFAOYSA-N 1 2 307.315 4.230 20 0 DIADLO C[C@H]1C[N@H+](Cc2nc(-c3ccccc3F)no2)[C@@H]1c1ccccc1 ZINC000189067172 1043136821 /nfs/dbraw/zinc/13/68/21/1043136821.db2.gz BFNYUHVLTNATLC-UGSOOPFHSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nc(-c3ccccc3F)no2)[C@@H]1c1ccccc1 ZINC000189067172 1043136828 /nfs/dbraw/zinc/13/68/28/1043136828.db2.gz BFNYUHVLTNATLC-UGSOOPFHSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc(-c3ccccc3F)no2)[C@@H]1c1ccccc1 ZINC000189067149 1043137198 /nfs/dbraw/zinc/13/71/98/1043137198.db2.gz BFNYUHVLTNATLC-ACJLOTCBSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc(-c3ccccc3F)no2)[C@@H]1c1ccccc1 ZINC000189067149 1043137204 /nfs/dbraw/zinc/13/72/04/1043137204.db2.gz BFNYUHVLTNATLC-ACJLOTCBSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1cc2cnccc2o1 ZINC000865854611 1043142114 /nfs/dbraw/zinc/14/21/14/1043142114.db2.gz QZVKOZNNDYEYKE-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2ccc(CSC(F)F)o2)s1 ZINC000179383510 1043145052 /nfs/dbraw/zinc/14/50/52/1043145052.db2.gz HCDOHSITGONZEG-UHFFFAOYSA-N 1 2 318.414 4.132 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2ccc(CSC(F)F)o2)s1 ZINC000179383510 1043145062 /nfs/dbraw/zinc/14/50/62/1043145062.db2.gz HCDOHSITGONZEG-UHFFFAOYSA-N 1 2 318.414 4.132 20 0 DIADLO CC(C)n1cc(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)cn1 ZINC000179733831 1043150496 /nfs/dbraw/zinc/15/04/96/1043150496.db2.gz HRGMLXKKEXBMAX-CYBMUJFWSA-N 1 2 314.458 4.267 20 0 DIADLO CC(C)n1cc(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)cn1 ZINC000179733831 1043150506 /nfs/dbraw/zinc/15/05/06/1043150506.db2.gz HRGMLXKKEXBMAX-CYBMUJFWSA-N 1 2 314.458 4.267 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccn(-c3ccccc3F)n2)c(C)o1 ZINC000189441609 1043150979 /nfs/dbraw/zinc/15/09/79/1043150979.db2.gz UVTJTYRWUYLCTN-CYBMUJFWSA-N 1 2 313.376 4.072 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000189387930 1043154089 /nfs/dbraw/zinc/15/40/89/1043154089.db2.gz ZVTQRRGKDUSPMM-UHFFFAOYSA-N 1 2 307.800 4.081 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1cc(C)ccn1 ZINC000866249506 1043165384 /nfs/dbraw/zinc/16/53/84/1043165384.db2.gz KLZGRQISZPXURC-LJQANCHMSA-N 1 2 320.440 4.207 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)cs1 ZINC000866262815 1043167491 /nfs/dbraw/zinc/16/74/91/1043167491.db2.gz GWZUSBZHJKVZNV-VIFPVBQESA-N 1 2 321.833 4.351 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+](C)[C@@H](C)c2ccncc2)s1 ZINC000183634769 1043168974 /nfs/dbraw/zinc/16/89/74/1043168974.db2.gz AYCNWUCRPKUVAH-VIFPVBQESA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+](C)[C@@H](C)c2ccncc2)s1 ZINC000183634769 1043168986 /nfs/dbraw/zinc/16/89/86/1043168986.db2.gz AYCNWUCRPKUVAH-VIFPVBQESA-N 1 2 315.364 4.058 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1ccccn1 ZINC000866302708 1043175999 /nfs/dbraw/zinc/17/59/99/1043175999.db2.gz KAJHWKMVIBKQNW-INIZCTEOSA-N 1 2 312.310 4.125 20 0 DIADLO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1nc(C2CCCC2)no1 ZINC000190479789 1043180818 /nfs/dbraw/zinc/18/08/18/1043180818.db2.gz BQKZMTYCPYBPQZ-UHFFFAOYSA-N 1 2 324.428 4.231 20 0 DIADLO CC[N@H+](Cc1c[nH]c2ccccc12)Cc1nc(C2CCCC2)no1 ZINC000190479789 1043180827 /nfs/dbraw/zinc/18/08/27/1043180827.db2.gz BQKZMTYCPYBPQZ-UHFFFAOYSA-N 1 2 324.428 4.231 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](C)c2cc3ccccc3s2)n1 ZINC000184365635 1043183327 /nfs/dbraw/zinc/18/33/27/1043183327.db2.gz CSUBCBOOKBTTFB-GFCCVEGCSA-N 1 2 315.442 4.478 20 0 DIADLO C[C@@H]([NH2+][C@@H](CCO)c1ccco1)c1cccc(Cl)c1Cl ZINC000186541815 1043228390 /nfs/dbraw/zinc/22/83/90/1043228390.db2.gz HNCOBQAGOPAXTR-MFKMUULPSA-N 1 2 314.212 4.361 20 0 DIADLO C[C@@H]([NH2+][C@H](CCO)c1ccco1)c1cc(Cl)sc1Cl ZINC000186563121 1043229532 /nfs/dbraw/zinc/22/95/32/1043229532.db2.gz LDSYKIDITXJPJZ-PSASIEDQSA-N 1 2 320.241 4.422 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1ccccc1F ZINC000186827336 1043235633 /nfs/dbraw/zinc/23/56/33/1043235633.db2.gz DCNRRRHCNYIHDD-QGZVFWFLSA-N 1 2 320.408 4.370 20 0 DIADLO CC(C)c1cccc2c1CC[N@H+](Cc1nnc(-c3ccco3)o1)C2 ZINC000191890969 1043263704 /nfs/dbraw/zinc/26/37/04/1043263704.db2.gz QMRWEVBLCOJVDN-UHFFFAOYSA-N 1 2 323.396 4.011 20 0 DIADLO CC(C)c1cccc2c1CC[N@@H+](Cc1nnc(-c3ccco3)o1)C2 ZINC000191890969 1043263717 /nfs/dbraw/zinc/26/37/17/1043263717.db2.gz QMRWEVBLCOJVDN-UHFFFAOYSA-N 1 2 323.396 4.011 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccccc1OC ZINC001203438662 1043263845 /nfs/dbraw/zinc/26/38/45/1043263845.db2.gz OCHNHLRSDCAWMN-GOSISDBHSA-N 1 2 311.425 4.179 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccccc1OC ZINC001203438662 1043263859 /nfs/dbraw/zinc/26/38/59/1043263859.db2.gz OCHNHLRSDCAWMN-GOSISDBHSA-N 1 2 311.425 4.179 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](Cc1cocn1)C1CC1 ZINC000191926199 1043264821 /nfs/dbraw/zinc/26/48/21/1043264821.db2.gz NNENDKKIWSUOKV-LLVKDONJSA-N 1 2 310.319 4.419 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](Cc1cocn1)C1CC1 ZINC000191926199 1043264832 /nfs/dbraw/zinc/26/48/32/1043264832.db2.gz NNENDKKIWSUOKV-LLVKDONJSA-N 1 2 310.319 4.419 20 0 DIADLO COC[C@@H]([NH2+]Cc1nc(C(C)C)cs1)c1ccc(Cl)cc1 ZINC000194084875 1043289048 /nfs/dbraw/zinc/28/90/48/1043289048.db2.gz XIILKWPPEWPNCV-CQSZACIVSA-N 1 2 324.877 4.397 20 0 DIADLO Cc1ccc(C[NH2+][C@H](c2nc(C3CC3)no2)C(C)C)cc1Cl ZINC000195443115 1043299153 /nfs/dbraw/zinc/29/91/53/1043299153.db2.gz DIGHJAGXTDGOFJ-HNNXBMFYSA-N 1 2 319.836 4.396 20 0 DIADLO COc1cccc(C[N@H+](C)[C@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000267014080 1043303596 /nfs/dbraw/zinc/30/35/96/1043303596.db2.gz NZNNGURVFOGJTP-CYBMUJFWSA-N 1 2 302.418 4.174 20 0 DIADLO COc1cccc(C[N@@H+](C)[C@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000267014080 1043303610 /nfs/dbraw/zinc/30/36/10/1043303610.db2.gz NZNNGURVFOGJTP-CYBMUJFWSA-N 1 2 302.418 4.174 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@H+](Cc2cc(-c3cccs3)on2)C1 ZINC000268241991 1043315258 /nfs/dbraw/zinc/31/52/58/1043315258.db2.gz NAQXJQSFKCUQRG-SNVBAGLBSA-N 1 2 316.348 4.177 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2cc(-c3cccs3)on2)C1 ZINC000268241991 1043315261 /nfs/dbraw/zinc/31/52/61/1043315261.db2.gz NAQXJQSFKCUQRG-SNVBAGLBSA-N 1 2 316.348 4.177 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@@H](c2nccn2C)c2ccc(F)cc2)cc1 ZINC000268746796 1043326420 /nfs/dbraw/zinc/32/64/20/1043326420.db2.gz FYCBHVVJPXALLO-HNAYVOBHSA-N 1 2 323.415 4.308 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@H](c2nccn2C)c2ccc(F)cc2)c1 ZINC000268739192 1043327943 /nfs/dbraw/zinc/32/79/43/1043327943.db2.gz CMTSLSGHHZDRKJ-BEFAXECRSA-N 1 2 323.415 4.308 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1nccn1C)c1ccc(F)cc1)c1ccccc1 ZINC000268777625 1043329692 /nfs/dbraw/zinc/32/96/92/1043329692.db2.gz SCVMEBWJEXJSBH-RBUKOAKNSA-N 1 2 323.415 4.390 20 0 DIADLO COc1cc(F)c([C@@H](C)[NH2+][C@@H](C)c2csc(C)n2)cc1OC ZINC000268840264 1043335953 /nfs/dbraw/zinc/33/59/53/1043335953.db2.gz AONJWTOFARHNMD-ZJUUUORDSA-N 1 2 324.421 4.020 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@@H]2CCSc3ccccc32)cs1 ZINC000269025884 1043351767 /nfs/dbraw/zinc/35/17/67/1043351767.db2.gz COISBQXRHKHINM-BXUZGUMPSA-N 1 2 320.483 4.177 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000123419489 1043358917 /nfs/dbraw/zinc/35/89/17/1043358917.db2.gz ROHFCJBUDXCPPZ-OKZBNKHCSA-N 1 2 319.493 4.289 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2cc(C)ccc2OC(F)F)cs1 ZINC000269411437 1043365127 /nfs/dbraw/zinc/36/51/27/1043365127.db2.gz JKIOUEBXTRAEPJ-SNVBAGLBSA-N 1 2 312.385 4.212 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccccc2OCC(C)C)cs1 ZINC000269400419 1043366160 /nfs/dbraw/zinc/36/61/60/1043366160.db2.gz GBAIGJUANUFOMN-ZDUSSCGKSA-N 1 2 304.459 4.337 20 0 DIADLO Cc1ccc2c(c1)[C@H](NC(=O)c1c(C)cc(C)[nH+]c1C)CCC2 ZINC001274478586 1043369390 /nfs/dbraw/zinc/36/93/90/1043369390.db2.gz SZDYYSLASPZKQQ-GOSISDBHSA-N 1 2 308.425 4.123 20 0 DIADLO Cc1ccc(-c2noc(C[N@@H+](Cc3ccco3)C(C)C)n2)cc1 ZINC000521187409 1043373035 /nfs/dbraw/zinc/37/30/35/1043373035.db2.gz MMTJPMHMUFLUIE-UHFFFAOYSA-N 1 2 311.385 4.049 20 0 DIADLO Cc1ccc(-c2noc(C[N@H+](Cc3ccco3)C(C)C)n2)cc1 ZINC000521187409 1043373042 /nfs/dbraw/zinc/37/30/42/1043373042.db2.gz MMTJPMHMUFLUIE-UHFFFAOYSA-N 1 2 311.385 4.049 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2ncc(C3CC3)o2)[C@@H]1c1ccccc1 ZINC000270618814 1043391244 /nfs/dbraw/zinc/39/12/44/1043391244.db2.gz OOFQCXYKBPDYIL-ACJLOTCBSA-N 1 2 314.454 4.231 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2ncc(C3CC3)o2)[C@@H]1c1ccccc1 ZINC000270618814 1043391258 /nfs/dbraw/zinc/39/12/58/1043391258.db2.gz OOFQCXYKBPDYIL-ACJLOTCBSA-N 1 2 314.454 4.231 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ncc(C3CC3)o2)[C@H]1c1cccc(F)c1 ZINC000270648514 1043392478 /nfs/dbraw/zinc/39/24/78/1043392478.db2.gz SXCCSVRPZMGKMX-KPZWWZAWSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ncc(C3CC3)o2)[C@H]1c1cccc(F)c1 ZINC000270648514 1043392487 /nfs/dbraw/zinc/39/24/87/1043392487.db2.gz SXCCSVRPZMGKMX-KPZWWZAWSA-N 1 2 300.377 4.274 20 0 DIADLO CC[N@H+](Cc1ncc(-c2ccc(C)cc2)o1)Cc1ccncc1 ZINC000270996469 1043397319 /nfs/dbraw/zinc/39/73/19/1043397319.db2.gz JIUZPYSJBBKVQM-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO CC[N@@H+](Cc1ncc(-c2ccc(C)cc2)o1)Cc1ccncc1 ZINC000270996469 1043397329 /nfs/dbraw/zinc/39/73/29/1043397329.db2.gz JIUZPYSJBBKVQM-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO CC[N@H+](Cc1ccncc1)[C@H](C)c1ncc(-c2ccccc2)o1 ZINC000271054860 1043399163 /nfs/dbraw/zinc/39/91/63/1043399163.db2.gz YTQZSRBDHRAAOM-OAHLLOKOSA-N 1 2 307.397 4.320 20 0 DIADLO CC[N@@H+](Cc1ccncc1)[C@H](C)c1ncc(-c2ccccc2)o1 ZINC000271054860 1043399171 /nfs/dbraw/zinc/39/91/71/1043399171.db2.gz YTQZSRBDHRAAOM-OAHLLOKOSA-N 1 2 307.397 4.320 20 0 DIADLO CCC[C@@H]([NH2+][C@H](C)c1nn(CC)nc1C)c1ccc(F)cc1F ZINC000925264331 1043405698 /nfs/dbraw/zinc/40/56/98/1043405698.db2.gz MAJKARLENVOQAO-BDJLRTHQSA-N 1 2 322.403 4.077 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)on1 ZINC000925265087 1043406076 /nfs/dbraw/zinc/40/60/76/1043406076.db2.gz QLXKCHXNSGGETQ-QFYYESIMSA-N 1 2 324.371 4.399 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(OCC2CC2)c(F)c1)c1cscn1 ZINC000271195485 1043407072 /nfs/dbraw/zinc/40/70/72/1043407072.db2.gz YIKZOAQSVPQONO-NWDGAFQWSA-N 1 2 320.433 4.483 20 0 DIADLO COc1ccc(Cl)cc1[C@H](C)[NH2+][C@H](C)c1nnc(C(C)C)[nH]1 ZINC000271431700 1043417436 /nfs/dbraw/zinc/41/74/36/1043417436.db2.gz DGRSQNJPAIDYLN-WDEREUQCSA-N 1 2 322.840 4.002 20 0 DIADLO CCc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1csc(C)n1 ZINC000271458611 1043422283 /nfs/dbraw/zinc/42/22/83/1043422283.db2.gz JQKNRJYUFMQFPW-IAQYHMDHSA-N 1 2 302.443 4.188 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+][C@H](C)c1cc(O)ccc1F ZINC000872025591 1043423130 /nfs/dbraw/zinc/42/31/30/1043423130.db2.gz PPNMAVIWYVCMDW-GHMZBOCLSA-N 1 2 307.340 4.091 20 0 DIADLO CC(C)c1nnc([C@H](C)[NH2+][C@H]2C[C@H](C)Sc3sccc32)[nH]1 ZINC000271481570 1043423539 /nfs/dbraw/zinc/42/35/39/1043423539.db2.gz JSIZSZVWUDLCAE-NHCYSSNCSA-N 1 2 322.503 4.266 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1cccc(O)c1F ZINC000872024396 1043424618 /nfs/dbraw/zinc/42/46/18/1043424618.db2.gz AGCHUWBHGZQBRZ-WDEREUQCSA-N 1 2 307.340 4.091 20 0 DIADLO CCOC(=O)[C@H](c1ccccc1)[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000558054353 1043429102 /nfs/dbraw/zinc/42/91/02/1043429102.db2.gz URYZWXIHKWTZGU-SJORKVTESA-N 1 2 315.438 4.189 20 0 DIADLO CCOC(=O)[C@H](c1ccccc1)[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000558054353 1043429104 /nfs/dbraw/zinc/42/91/04/1043429104.db2.gz URYZWXIHKWTZGU-SJORKVTESA-N 1 2 315.438 4.189 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@@H](C)c2cc(O)ccc2F)on1 ZINC000872040578 1043430552 /nfs/dbraw/zinc/43/05/52/1043430552.db2.gz ZGJRNZSFGRNBIR-NSHDSACASA-N 1 2 306.381 4.274 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nnc(C(C)C)[nH]1)c1cc(F)ccc1F ZINC000271535652 1043432067 /nfs/dbraw/zinc/43/20/67/1043432067.db2.gz QGHUXQJDIRDASP-QMTHXVAHSA-N 1 2 308.376 4.008 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@@H](C)c1cnccc1C)c1ccco1 ZINC000271561427 1043436687 /nfs/dbraw/zinc/43/66/87/1043436687.db2.gz WVPAAJULFPHVHI-YWZLYKJASA-N 1 2 322.408 4.432 20 0 DIADLO Cc1csc(C2([NH2+][C@@H](C)c3cc(O)ccc3F)CCC2)n1 ZINC000872055099 1043437013 /nfs/dbraw/zinc/43/70/13/1043437013.db2.gz FWPKRFJSVBGAGY-NSHDSACASA-N 1 2 306.406 4.026 20 0 DIADLO CSc1ccccc1[C@H](C)[NH2+][C@@H](C)c1nnc(C(C)C)[nH]1 ZINC000442872467 1043441527 /nfs/dbraw/zinc/44/15/27/1043441527.db2.gz NMUCMGQTCHOYAN-RYUDHWBXSA-N 1 2 304.463 4.062 20 0 DIADLO CCSCc1cc[nH+]c(N[C@H]2CCOC3(CCCC3)C2)c1 ZINC000872058161 1043441737 /nfs/dbraw/zinc/44/17/37/1043441737.db2.gz OFYMWAIOUNSMHH-HNNXBMFYSA-N 1 2 306.475 4.238 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H](C)c1cccc(O)c1F ZINC000872067061 1043447782 /nfs/dbraw/zinc/44/77/82/1043447782.db2.gz USNMNCHZAFJQKS-SNVBAGLBSA-N 1 2 309.768 4.044 20 0 DIADLO COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1ncc(C2CC2)o1 ZINC000271686427 1043450163 /nfs/dbraw/zinc/45/01/63/1043450163.db2.gz DEHKQGNRFGCENT-INIZCTEOSA-N 1 2 314.429 4.438 20 0 DIADLO COC(=O)c1oc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)cc1C ZINC000558175864 1043450103 /nfs/dbraw/zinc/45/01/03/1043450103.db2.gz KOARBCUUBUQMBC-OAHLLOKOSA-N 1 2 319.426 4.019 20 0 DIADLO COC(=O)c1oc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)cc1C ZINC000558175864 1043450109 /nfs/dbraw/zinc/45/01/09/1043450109.db2.gz KOARBCUUBUQMBC-OAHLLOKOSA-N 1 2 319.426 4.019 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCOc2ccc(F)cc2C1 ZINC000339135234 1043455223 /nfs/dbraw/zinc/45/52/23/1043455223.db2.gz YUWMBWRKOODZHM-UHFFFAOYSA-N 1 2 314.404 4.047 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCOc2ccc(F)cc2C1 ZINC000339135234 1043455233 /nfs/dbraw/zinc/45/52/33/1043455233.db2.gz YUWMBWRKOODZHM-UHFFFAOYSA-N 1 2 314.404 4.047 20 0 DIADLO Cc1[nH]ncc1C[N@@H+](Cc1ccccc1C(F)(F)F)CC1CC1 ZINC000348631847 1043459225 /nfs/dbraw/zinc/45/92/25/1043459225.db2.gz FYNJOUDZJRDMOP-UHFFFAOYSA-N 1 2 323.362 4.149 20 0 DIADLO Cc1[nH]ncc1C[N@H+](Cc1ccccc1C(F)(F)F)CC1CC1 ZINC000348631847 1043459232 /nfs/dbraw/zinc/45/92/32/1043459232.db2.gz FYNJOUDZJRDMOP-UHFFFAOYSA-N 1 2 323.362 4.149 20 0 DIADLO CC(C)c1ccc([C@H](C)[NH2+]Cc2nnc(-c3ccccc3)[nH]2)cc1 ZINC000777574140 1043461095 /nfs/dbraw/zinc/46/10/95/1043461095.db2.gz HFTYOUUUOISFQH-HNNXBMFYSA-N 1 2 320.440 4.446 20 0 DIADLO C[C@H](Nc1ccc2oc(C3CC3)nc2c1)c1cn2c([nH+]1)CCCC2 ZINC000925760903 1043465234 /nfs/dbraw/zinc/46/52/34/1043465234.db2.gz RQPALNPECTUXCT-LBPRGKRZSA-N 1 2 322.412 4.411 20 0 DIADLO CCSc1cccc(C[N@@H+]2CCCC[C@H]2c2nc(C)no2)c1 ZINC000348834885 1043472630 /nfs/dbraw/zinc/47/26/30/1043472630.db2.gz RJXAAWZIULJEEL-INIZCTEOSA-N 1 2 317.458 4.217 20 0 DIADLO CCSc1cccc(C[N@H+]2CCCC[C@H]2c2nc(C)no2)c1 ZINC000348834885 1043472637 /nfs/dbraw/zinc/47/26/37/1043472637.db2.gz RJXAAWZIULJEEL-INIZCTEOSA-N 1 2 317.458 4.217 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]C1(c2ccc(Cl)cc2)CC1 ZINC000925844268 1043480404 /nfs/dbraw/zinc/48/04/04/1043480404.db2.gz JHWDHCXIHLMRDM-CQSZACIVSA-N 1 2 302.805 4.293 20 0 DIADLO FCc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3Cl)C2)cc1 ZINC000777577115 1043481657 /nfs/dbraw/zinc/48/16/57/1043481657.db2.gz BVHJUTDCZINDSY-GOSISDBHSA-N 1 2 319.807 4.383 20 0 DIADLO FCc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3Cl)C2)cc1 ZINC000777577115 1043481667 /nfs/dbraw/zinc/48/16/67/1043481667.db2.gz BVHJUTDCZINDSY-GOSISDBHSA-N 1 2 319.807 4.383 20 0 DIADLO Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]Cc1nnc(-c2ccccc2)[nH]1 ZINC000777578003 1043484520 /nfs/dbraw/zinc/48/45/20/1043484520.db2.gz GIVZZWHNKWMAQR-WMLDXEAASA-N 1 2 318.424 4.118 20 0 DIADLO CCCCc1nc(C[N@H+](CCC)[C@H]2CCc3ccccc32)no1 ZINC000521819643 1043485555 /nfs/dbraw/zinc/48/55/55/1043485555.db2.gz DMQMXSMBXFJBJR-KRWDZBQOSA-N 1 2 313.445 4.312 20 0 DIADLO CCCCc1nc(C[N@@H+](CCC)[C@H]2CCc3ccccc32)no1 ZINC000521819643 1043485561 /nfs/dbraw/zinc/48/55/61/1043485561.db2.gz DMQMXSMBXFJBJR-KRWDZBQOSA-N 1 2 313.445 4.312 20 0 DIADLO CCC[C@H]([NH2+]Cc1nnc(-c2ccccc2)[nH]1)c1ccccc1 ZINC000777579174 1043486395 /nfs/dbraw/zinc/48/63/95/1043486395.db2.gz SEMIDQVPORGGBU-KRWDZBQOSA-N 1 2 306.413 4.103 20 0 DIADLO O=c1[nH]nc(Cl)cc1Nc1ccc([NH2+]C2CCCCC2)cc1 ZINC000872442202 1043499012 /nfs/dbraw/zinc/49/90/12/1043499012.db2.gz VVTMWMMCUJXBKK-UHFFFAOYSA-N 1 2 318.808 4.324 20 0 DIADLO CC(C)C[C@@H](C)CNc1ccccc1OCCn1cc[nH+]c1 ZINC000558403291 1043501290 /nfs/dbraw/zinc/50/12/90/1043501290.db2.gz XOPGICCMPWABKN-MRXNPFEDSA-N 1 2 301.434 4.056 20 0 DIADLO CCOc1cccc(F)c1C[NH2+][C@H](CC)c1nc(C)cs1 ZINC000873046230 1043513086 /nfs/dbraw/zinc/51/30/86/1043513086.db2.gz NDXOYGCJESRGNB-CQSZACIVSA-N 1 2 308.422 4.230 20 0 DIADLO Clc1cnc(C[NH2+]Cc2ccccc2OC2CCC2)s1 ZINC000349596389 1043514029 /nfs/dbraw/zinc/51/40/29/1043514029.db2.gz GBRVKTKGOFBNNV-UHFFFAOYSA-N 1 2 308.834 4.018 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CC(C)(C)[C@@H]2[C@H]2CCCO2)cs1 ZINC000558469961 1043515406 /nfs/dbraw/zinc/51/54/06/1043515406.db2.gz KNPKCXKYGZJUNW-WBVHZDCISA-N 1 2 322.518 4.121 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CC(C)(C)[C@@H]2[C@H]2CCCO2)cs1 ZINC000558469961 1043515409 /nfs/dbraw/zinc/51/54/09/1043515409.db2.gz KNPKCXKYGZJUNW-WBVHZDCISA-N 1 2 322.518 4.121 20 0 DIADLO c1sc2ccccc2c1CNc1cc(N2CCCCC2)nc[nH+]1 ZINC000521953505 1043516300 /nfs/dbraw/zinc/51/63/00/1043516300.db2.gz GXRSEHBDKVWPEX-UHFFFAOYSA-N 1 2 324.453 4.294 20 0 DIADLO c1sc2ccccc2c1CNc1cc(N2CCCCC2)[nH+]cn1 ZINC000521953505 1043516311 /nfs/dbraw/zinc/51/63/11/1043516311.db2.gz GXRSEHBDKVWPEX-UHFFFAOYSA-N 1 2 324.453 4.294 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccnn1C1CCC1 ZINC000926067201 1043517689 /nfs/dbraw/zinc/51/76/89/1043517689.db2.gz VJVQSCIDPBLSBJ-AWEZNQCLSA-N 1 2 310.445 4.164 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccnn1C1CCC1 ZINC000926067201 1043517700 /nfs/dbraw/zinc/51/77/00/1043517700.db2.gz VJVQSCIDPBLSBJ-AWEZNQCLSA-N 1 2 310.445 4.164 20 0 DIADLO Cc1noc(C)c1[C@@H](C)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000926079841 1043519133 /nfs/dbraw/zinc/51/91/33/1043519133.db2.gz WYLBOVGOSOHPJY-SNVBAGLBSA-N 1 2 316.792 4.304 20 0 DIADLO CCc1ccc(C[NH2+]Cc2cc(C(F)(F)F)cc(Cl)n2)o1 ZINC000873170402 1043520703 /nfs/dbraw/zinc/52/07/03/1043520703.db2.gz VDURFWJIQMCGDY-UHFFFAOYSA-N 1 2 318.726 4.199 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000191124563 1043521676 /nfs/dbraw/zinc/52/16/76/1043521676.db2.gz GYXWCXNOUPGELJ-HNNXBMFYSA-N 1 2 309.743 4.232 20 0 DIADLO Clc1cnc(C[NH2+]Cc2cnc(C3CCCC3)s2)s1 ZINC000873166114 1043522152 /nfs/dbraw/zinc/52/21/52/1043522152.db2.gz UWIAYATXYUIHCC-UHFFFAOYSA-N 1 2 313.879 4.200 20 0 DIADLO CC(C)n1ncc2cc(N[C@@H](C)c3cn4c([nH+]3)CCCC4)ccc21 ZINC000926090168 1043522995 /nfs/dbraw/zinc/52/29/95/1043522995.db2.gz DPGOOQBDUYCVDA-AWEZNQCLSA-N 1 2 323.444 4.323 20 0 DIADLO C[C@@H](N[C@@H](CC(C)(C)C)C(F)(F)F)c1cn2c([nH+]1)CCCC2 ZINC000926109547 1043531101 /nfs/dbraw/zinc/53/11/01/1043531101.db2.gz LTHZGAUZISMFNW-YPMHNXCESA-N 1 2 317.399 4.237 20 0 DIADLO CCCCOc1ccc(C[NH2+][C@@H](C)c2nonc2C)cc1Cl ZINC000926254302 1043552420 /nfs/dbraw/zinc/55/24/20/1043552420.db2.gz XJWPSKJBELDRQF-NSHDSACASA-N 1 2 323.824 4.061 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ncc(-c2ccccc2)cn1)c1cccnc1 ZINC000558633606 1043562599 /nfs/dbraw/zinc/56/25/99/1043562599.db2.gz JWFYRHSTQZUSMA-HXUWFJFHSA-N 1 2 318.424 4.026 20 0 DIADLO CCc1nc(C)c(C[NH2+][C@H](c2ccc(C)cc2)c2cccnc2)o1 ZINC000926477026 1043583337 /nfs/dbraw/zinc/58/33/37/1043583337.db2.gz IQMQMKUQTSMXDD-HXUWFJFHSA-N 1 2 321.424 4.128 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C2CC2)ccc1F)c1cn2c(n1)CCCC2 ZINC000926503059 1043588798 /nfs/dbraw/zinc/58/87/98/1043588798.db2.gz RZNBSTDCKKZASC-CYBMUJFWSA-N 1 2 313.420 4.087 20 0 DIADLO Clc1ccc(C[N@@H+]2CCC[C@H]2c2cccc3c2OCCO3)o1 ZINC000353145464 1043589095 /nfs/dbraw/zinc/58/90/95/1043589095.db2.gz WQNFZBNOIYJCNA-AWEZNQCLSA-N 1 2 319.788 4.041 20 0 DIADLO Clc1ccc(C[N@H+]2CCC[C@H]2c2cccc3c2OCCO3)o1 ZINC000353145464 1043589100 /nfs/dbraw/zinc/58/91/00/1043589100.db2.gz WQNFZBNOIYJCNA-AWEZNQCLSA-N 1 2 319.788 4.041 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](Cc1ccccc1C)c1ccco1 ZINC000926533516 1043594685 /nfs/dbraw/zinc/59/46/85/1043594685.db2.gz QKZZFLCKIGJMSN-SJLPKXTDSA-N 1 2 323.440 4.439 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@H](Cc1ccccc1C)c1ccco1 ZINC000926533515 1043595146 /nfs/dbraw/zinc/59/51/46/1043595146.db2.gz QKZZFLCKIGJMSN-FUHWJXTLSA-N 1 2 323.440 4.439 20 0 DIADLO CCc1ncc(C[NH2+][C@H](c2cccnc2)c2cc(C)cc(C)c2)o1 ZINC000926540808 1043596003 /nfs/dbraw/zinc/59/60/03/1043596003.db2.gz MOAOEANIKZDSGW-HXUWFJFHSA-N 1 2 321.424 4.128 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)cn1 ZINC001137081936 1043596625 /nfs/dbraw/zinc/59/66/25/1043596625.db2.gz WIWQDYZZSPZSIK-MRXNPFEDSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1cc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)cn1 ZINC001137081936 1043596635 /nfs/dbraw/zinc/59/66/35/1043596635.db2.gz WIWQDYZZSPZSIK-MRXNPFEDSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)Cc1ncc(C[N@@H+]2CCc3c(F)cccc3C2)s1 ZINC000353562685 1043617760 /nfs/dbraw/zinc/61/77/60/1043617760.db2.gz BMCMCODGSVKPII-UHFFFAOYSA-N 1 2 304.434 4.039 20 0 DIADLO CC(C)Cc1ncc(C[N@H+]2CCc3c(F)cccc3C2)s1 ZINC000353562685 1043617767 /nfs/dbraw/zinc/61/77/67/1043617767.db2.gz BMCMCODGSVKPII-UHFFFAOYSA-N 1 2 304.434 4.039 20 0 DIADLO C[N@@H+](Cc1coc(-c2c(F)cccc2F)n1)Cc1cccs1 ZINC000443620369 1043622287 /nfs/dbraw/zinc/62/22/87/1043622287.db2.gz FVCOQUIZJWBOMS-UHFFFAOYSA-N 1 2 320.364 4.313 20 0 DIADLO C[N@H+](Cc1coc(-c2c(F)cccc2F)n1)Cc1cccs1 ZINC000443620369 1043622295 /nfs/dbraw/zinc/62/22/95/1043622295.db2.gz FVCOQUIZJWBOMS-UHFFFAOYSA-N 1 2 320.364 4.313 20 0 DIADLO C[C@@H]([NH2+]C1(c2ccc(C(F)(F)F)cc2)CCC1)c1ncco1 ZINC000926739203 1043624793 /nfs/dbraw/zinc/62/47/93/1043624793.db2.gz YIIUYJVBISZYIG-LLVKDONJSA-N 1 2 310.319 4.423 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CC[C@H]3CCCC[C@H]3C2)n1 ZINC001141764021 1043629664 /nfs/dbraw/zinc/62/96/64/1043629664.db2.gz MNFCDERJFJECTL-MNOVXSKESA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CC[C@H]3CCCC[C@H]3C2)n1 ZINC001141764021 1043629666 /nfs/dbraw/zinc/62/96/66/1043629666.db2.gz MNFCDERJFJECTL-MNOVXSKESA-N 1 2 304.381 4.174 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+]Cc1csc(C(F)(F)F)c1 ZINC000926773397 1043630247 /nfs/dbraw/zinc/63/02/47/1043630247.db2.gz WVYYOAMNLWCFKQ-JTQLQIEISA-N 1 2 316.348 4.231 20 0 DIADLO Cc1ccncc1C[N@@H+](C)[C@@H](C)c1ccccc1Br ZINC000474116602 1043631686 /nfs/dbraw/zinc/63/16/86/1043631686.db2.gz IVPWPLXZPZQRSA-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccncc1C[N@H+](C)[C@@H](C)c1ccccc1Br ZINC000474116602 1043631689 /nfs/dbraw/zinc/63/16/89/1043631689.db2.gz IVPWPLXZPZQRSA-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@@H+]2Cc2c(C)oc3ccccc32)o1 ZINC000353684808 1043633771 /nfs/dbraw/zinc/63/37/71/1043633771.db2.gz TUJWJRPVRRCWNE-KRWDZBQOSA-N 1 2 311.381 4.216 20 0 DIADLO Cc1ccc([C@@H]2COCC[N@H+]2Cc2c(C)oc3ccccc32)o1 ZINC000353684808 1043633772 /nfs/dbraw/zinc/63/37/72/1043633772.db2.gz TUJWJRPVRRCWNE-KRWDZBQOSA-N 1 2 311.381 4.216 20 0 DIADLO C[C@H]([NH2+]Cc1c(Cl)cccc1OC(F)F)c1ccns1 ZINC000926801872 1043635768 /nfs/dbraw/zinc/63/57/68/1043635768.db2.gz PDKOBWRLSIBLQG-QMMMGPOBSA-N 1 2 318.776 4.249 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(-c3ccccc3)n[nH]2)[C@H]1c1ccncc1 ZINC000353725248 1043636563 /nfs/dbraw/zinc/63/65/63/1043636563.db2.gz WKWHKIUALIOUBT-IBGZPJMESA-N 1 2 318.424 4.055 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(-c3ccccc3)n[nH]2)[C@H]1c1ccncc1 ZINC000353725248 1043636569 /nfs/dbraw/zinc/63/65/69/1043636569.db2.gz WKWHKIUALIOUBT-IBGZPJMESA-N 1 2 318.424 4.055 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2cnc(C3CCCC3)s2)n1 ZINC000353747604 1043639538 /nfs/dbraw/zinc/63/95/38/1043639538.db2.gz PCDBZXZIKAVMOR-UHFFFAOYSA-N 1 2 301.459 4.136 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2cnc(C3CCCC3)s2)n1 ZINC000353747604 1043639547 /nfs/dbraw/zinc/63/95/47/1043639547.db2.gz PCDBZXZIKAVMOR-UHFFFAOYSA-N 1 2 301.459 4.136 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2cnc(-c3cccs3)s2)n1 ZINC000353756968 1043642081 /nfs/dbraw/zinc/64/20/81/1043642081.db2.gz XJPHKAOTTBBOQU-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2cnc(-c3cccs3)s2)n1 ZINC000353756968 1043642088 /nfs/dbraw/zinc/64/20/88/1043642088.db2.gz XJPHKAOTTBBOQU-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO Cc1ccc(C[NH2+][C@H]2COCc3cccc(Cl)c32)c(Cl)n1 ZINC000926849971 1043642522 /nfs/dbraw/zinc/64/25/22/1043642522.db2.gz IWZUMAGBTZRDHQ-AWEZNQCLSA-N 1 2 323.223 4.058 20 0 DIADLO Cc1nc(N[C@H](C)CC(C)(C)C)c(Br)c(C)[nH+]1 ZINC000322756798 1043642548 /nfs/dbraw/zinc/64/25/48/1043642548.db2.gz BNQACEKBQGHDQD-MRVPVSSYSA-N 1 2 300.244 4.093 20 0 DIADLO Clc1ccnc2c1CC[C@H]2[NH2+]Cc1nsc2ccccc12 ZINC000926862937 1043643900 /nfs/dbraw/zinc/64/39/00/1043643900.db2.gz BTPBLBFYLMACKS-CYBMUJFWSA-N 1 2 315.829 4.122 20 0 DIADLO C[C@H]([NH2+][C@@H]1c2ccccc2OC[C@@H]1F)c1cc2ccccc2[nH]1 ZINC000926889292 1043647761 /nfs/dbraw/zinc/64/77/61/1043647761.db2.gz NUJDWUFQGVTDKB-VRHCTWJESA-N 1 2 310.372 4.290 20 0 DIADLO C[C@H]([NH2+][C@H]1c2ccccc2OC[C@@H]1F)c1cc2ccccc2[nH]1 ZINC000926889291 1043648717 /nfs/dbraw/zinc/64/87/17/1043648717.db2.gz NUJDWUFQGVTDKB-ODYMNIRHSA-N 1 2 310.372 4.290 20 0 DIADLO Clc1cccc2c1[C@H]([NH2+][C@H](c1ccccn1)C1CC1)COC2 ZINC000926895824 1043650021 /nfs/dbraw/zinc/65/00/21/1043650021.db2.gz YBRAKCAERWLWFA-AEFFLSMTSA-N 1 2 314.816 4.047 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2nc3c(s2)CCCC3)c(F)c1 ZINC000926918097 1043655875 /nfs/dbraw/zinc/65/58/75/1043655875.db2.gz GOGFMXQIAQTECE-LLVKDONJSA-N 1 2 320.433 4.020 20 0 DIADLO COCc1nc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccc(C)o2)cs1 ZINC000353934317 1043661598 /nfs/dbraw/zinc/66/15/98/1043661598.db2.gz PQYRZCDSDKEADA-SWLSCSKDSA-N 1 2 320.458 4.164 20 0 DIADLO COCc1nc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccc(C)o2)cs1 ZINC000353934317 1043661606 /nfs/dbraw/zinc/66/16/06/1043661606.db2.gz PQYRZCDSDKEADA-SWLSCSKDSA-N 1 2 320.458 4.164 20 0 DIADLO C[C@@H]([NH2+]c1ccc(N2CCC(C)CC2)cc1)C1CCOCC1 ZINC000777613227 1043664231 /nfs/dbraw/zinc/66/42/31/1043664231.db2.gz KLMJHDNOVPLUOU-MRXNPFEDSA-N 1 2 302.462 4.150 20 0 DIADLO Fc1ccc(F)c2c1CC[N@H+](Cc1ccc3ncccc3c1)C2 ZINC000354019055 1043671683 /nfs/dbraw/zinc/67/16/83/1043671683.db2.gz TXGZCBPTJWCWCF-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1ccc(F)c2c1CC[N@@H+](Cc1ccc3ncccc3c1)C2 ZINC000354019055 1043671692 /nfs/dbraw/zinc/67/16/92/1043671692.db2.gz TXGZCBPTJWCWCF-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO CCCCCC[C@H](C)C(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927089254 1043684002 /nfs/dbraw/zinc/68/40/02/1043684002.db2.gz KIJGEHAVAVECCN-INIZCTEOSA-N 1 2 317.477 4.091 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@@H](C)c2ccnn2C2CCC2)c(F)c1 ZINC000927094405 1043685088 /nfs/dbraw/zinc/68/50/88/1043685088.db2.gz VONJRZYIEVYRRS-LBPRGKRZSA-N 1 2 305.372 4.046 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000876518807 1043691253 /nfs/dbraw/zinc/69/12/53/1043691253.db2.gz KATDTAAHPGCOBS-PEBXRYMYSA-N 1 2 321.361 4.007 20 0 DIADLO O=C(C/C=C\c1ccc(F)cc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000354318631 1043693882 /nfs/dbraw/zinc/69/38/82/1043693882.db2.gz MMVDJHLHVGYGIM-UPHRSURJSA-N 1 2 321.355 4.053 20 0 DIADLO CCC[C@H]([NH2+]Cc1c(C)noc1CC)c1ncccc1Cl ZINC000927133373 1043695112 /nfs/dbraw/zinc/69/51/12/1043695112.db2.gz CLWZDWFPPYNQDE-AWEZNQCLSA-N 1 2 307.825 4.225 20 0 DIADLO C[N@H+](Cc1ccn(-c2ccccc2)n1)Cc1cccc(Cl)c1 ZINC000559084285 1043695320 /nfs/dbraw/zinc/69/53/20/1043695320.db2.gz ZTKSJPITXZUAHO-UHFFFAOYSA-N 1 2 311.816 4.158 20 0 DIADLO C[N@@H+](Cc1ccn(-c2ccccc2)n1)Cc1cccc(Cl)c1 ZINC000559084285 1043695324 /nfs/dbraw/zinc/69/53/24/1043695324.db2.gz ZTKSJPITXZUAHO-UHFFFAOYSA-N 1 2 311.816 4.158 20 0 DIADLO Brc1ncccc1C[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000876579611 1043695490 /nfs/dbraw/zinc/69/54/90/1043695490.db2.gz ISFYIQAISDLELA-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ncccc1C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000876579611 1043695494 /nfs/dbraw/zinc/69/54/94/1043695494.db2.gz ISFYIQAISDLELA-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO CCc1onc(C)c1C[NH2+][C@@H](c1ccc(C)cc1)c1ccccn1 ZINC000927131833 1043695475 /nfs/dbraw/zinc/69/54/75/1043695475.db2.gz LCKDFOCRZRHOFS-FQEVSTJZSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)cc3c2OCC3)n1 ZINC000927140395 1043697791 /nfs/dbraw/zinc/69/77/91/1043697791.db2.gz NQXGEQYKGZYZEB-QWRGUYRKSA-N 1 2 322.861 4.452 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)cc3c2OCC3)n1 ZINC000927140396 1043698042 /nfs/dbraw/zinc/69/80/42/1043698042.db2.gz NQXGEQYKGZYZEB-WDEREUQCSA-N 1 2 322.861 4.452 20 0 DIADLO Fc1ccc(-c2noc([C@@H]3CCC[C@@H](c4ccccc4)[NH2+]3)n2)cc1 ZINC001211884383 1043702396 /nfs/dbraw/zinc/70/23/96/1043702396.db2.gz FWJOTUKPIAFSCP-IRXDYDNUSA-N 1 2 323.371 4.432 20 0 DIADLO CC(C)CO[C@@H](C)c1noc(C[N@H+](C)[C@H]2C=CCCCCC2)n1 ZINC000559105526 1043702509 /nfs/dbraw/zinc/70/25/09/1043702509.db2.gz CEXRFWIDLVZGDT-HOTGVXAUSA-N 1 2 321.465 4.124 20 0 DIADLO CC(C)CO[C@@H](C)c1noc(C[N@@H+](C)[C@H]2C=CCCCCC2)n1 ZINC000559105526 1043702513 /nfs/dbraw/zinc/70/25/13/1043702513.db2.gz CEXRFWIDLVZGDT-HOTGVXAUSA-N 1 2 321.465 4.124 20 0 DIADLO Cc1cc(OCc2nccn2C(F)F)c2cccc(C)c2[nH+]1 ZINC000354552352 1043707588 /nfs/dbraw/zinc/70/75/88/1043707588.db2.gz ZIIIWTVUFMJGFH-UHFFFAOYSA-N 1 2 303.312 4.022 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)Nc1ccc([NH+]2CCCC2)cc1 ZINC000876820694 1043713524 /nfs/dbraw/zinc/71/35/24/1043713524.db2.gz QSTYNJXSDSHVJO-QRQCRPRQSA-N 1 2 324.405 4.422 20 0 DIADLO CCO[P@](C)(=O)CC[C@@H](C)[NH2+]c1ccc(N2CCCC2)cc1 ZINC000876820694 1043713538 /nfs/dbraw/zinc/71/35/38/1043713538.db2.gz QSTYNJXSDSHVJO-QRQCRPRQSA-N 1 2 324.405 4.422 20 0 DIADLO Nc1c(Cl)cccc1CNc1ccc([NH+]2CCCC2)cc1 ZINC000876820714 1043713578 /nfs/dbraw/zinc/71/35/78/1043713578.db2.gz RPIKMTJHSQLLLE-UHFFFAOYSA-N 1 2 301.821 4.135 20 0 DIADLO CCc1cccc(F)c1C[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000474260232 1043715216 /nfs/dbraw/zinc/71/52/16/1043715216.db2.gz RBVLOHKQUMMYRQ-QGZVFWFLSA-N 1 2 305.418 4.023 20 0 DIADLO CCc1cccc(F)c1C[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000474260232 1043715229 /nfs/dbraw/zinc/71/52/29/1043715229.db2.gz RBVLOHKQUMMYRQ-QGZVFWFLSA-N 1 2 305.418 4.023 20 0 DIADLO c1nc(C2CCCC2)sc1C[N@H+]1CCOC[C@H]1CC1CCC1 ZINC000354739439 1043715973 /nfs/dbraw/zinc/71/59/73/1043715973.db2.gz YLURZUUXJJRFNK-MRXNPFEDSA-N 1 2 320.502 4.192 20 0 DIADLO c1nc(C2CCCC2)sc1C[N@@H+]1CCOC[C@H]1CC1CCC1 ZINC000354739439 1043715984 /nfs/dbraw/zinc/71/59/84/1043715984.db2.gz YLURZUUXJJRFNK-MRXNPFEDSA-N 1 2 320.502 4.192 20 0 DIADLO Cc1cccc(N2CCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)[nH+]1 ZINC000354795377 1043721763 /nfs/dbraw/zinc/72/17/63/1043721763.db2.gz TZIIGIJKRMPIOE-OAHLLOKOSA-N 1 2 312.804 4.261 20 0 DIADLO COc1cc([C@@H](C)Nc2ccc([NH+](C)C)c(C)c2)ccc1F ZINC000777643580 1043725847 /nfs/dbraw/zinc/72/58/47/1043725847.db2.gz PVQMLDSJTGWOAV-CYBMUJFWSA-N 1 2 302.393 4.382 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc([NH+](C)C)c(C)c2)cc1F ZINC000777643219 1043725893 /nfs/dbraw/zinc/72/58/93/1043725893.db2.gz KUTUCUBDQJQGJN-CYBMUJFWSA-N 1 2 302.393 4.382 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccc2c(c1)COC2 ZINC000777655461 1043728074 /nfs/dbraw/zinc/72/80/74/1043728074.db2.gz KRTLABBCHKDGRR-AWEZNQCLSA-N 1 2 308.425 4.272 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccc2c(c1)COC2 ZINC000777655461 1043728089 /nfs/dbraw/zinc/72/80/89/1043728089.db2.gz KRTLABBCHKDGRR-AWEZNQCLSA-N 1 2 308.425 4.272 20 0 DIADLO Cc1nc2ccccc2nc1C[NH2+][C@H]1c2ccccc2CC[C@H]1F ZINC000895692694 1043731877 /nfs/dbraw/zinc/73/18/77/1043731877.db2.gz VUEFNSHRFJRPRV-UZLBHIALSA-N 1 2 321.399 4.053 20 0 DIADLO Cc1nc2ccccc2nc1C[NH2+][C@@H]1c2ccccc2CC[C@H]1F ZINC000895692693 1043733164 /nfs/dbraw/zinc/73/31/64/1043733164.db2.gz VUEFNSHRFJRPRV-OXQOHEQNSA-N 1 2 321.399 4.053 20 0 DIADLO CC[N@H+](Cc1c(F)cc(Cl)cc1Br)C1CC1 ZINC001141837955 1043742009 /nfs/dbraw/zinc/74/20/09/1043742009.db2.gz WGEQSYSVZNZHAZ-UHFFFAOYSA-N 1 2 306.606 4.226 20 0 DIADLO CC[N@@H+](Cc1c(F)cc(Cl)cc1Br)C1CC1 ZINC001141837955 1043742017 /nfs/dbraw/zinc/74/20/17/1043742017.db2.gz WGEQSYSVZNZHAZ-UHFFFAOYSA-N 1 2 306.606 4.226 20 0 DIADLO c1ccc2oc(C[NH2+][C@@H]3CC4(CCC4)Oc4ccccc43)nc2c1 ZINC000877095258 1043742163 /nfs/dbraw/zinc/74/21/63/1043742163.db2.gz QDVLGUWUSZUENT-MRXNPFEDSA-N 1 2 320.392 4.364 20 0 DIADLO CC(C)c1csc(C[NH2+]Cc2cc3c(ccnc3Cl)o2)n1 ZINC000877108396 1043743612 /nfs/dbraw/zinc/74/36/12/1043743612.db2.gz RIJILTTWASDPQT-UHFFFAOYSA-N 1 2 321.833 4.351 20 0 DIADLO CC(C)CN(CC(C)(C)C)C(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000355134505 1043744982 /nfs/dbraw/zinc/74/49/82/1043744982.db2.gz PCDNHCQSAZAHLG-UHFFFAOYSA-N 1 2 313.445 4.017 20 0 DIADLO Cc1ccncc1CNc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000355131799 1043745577 /nfs/dbraw/zinc/74/55/77/1043745577.db2.gz LIJBEHDQWCCUCP-UHFFFAOYSA-N 1 2 318.424 4.202 20 0 DIADLO CCO[P@@](C)(=O)CC[C@H](C)[NH2+]c1ccc2c(c1)CCCN2C ZINC000877160259 1043751089 /nfs/dbraw/zinc/75/10/89/1043751089.db2.gz UKRRYIDFFCDEMX-RCDICMHDSA-N 1 2 324.405 4.204 20 0 DIADLO CCO[P@@](C)(=O)CC[C@H](C)Nc1ccc2c(c1)CCC[N@H+]2C ZINC000877160259 1043751092 /nfs/dbraw/zinc/75/10/92/1043751092.db2.gz UKRRYIDFFCDEMX-RCDICMHDSA-N 1 2 324.405 4.204 20 0 DIADLO CCO[P@@](C)(=O)CC[C@H](C)Nc1ccc2c(c1)CCC[N@@H+]2C ZINC000877160259 1043751096 /nfs/dbraw/zinc/75/10/96/1043751096.db2.gz UKRRYIDFFCDEMX-RCDICMHDSA-N 1 2 324.405 4.204 20 0 DIADLO CCO[P@@](C)(=O)CC[C@@H](C)[NH2+]c1ccc2c(c1)CCCN2C ZINC000877160257 1043751576 /nfs/dbraw/zinc/75/15/76/1043751576.db2.gz UKRRYIDFFCDEMX-JLCFBVMHSA-N 1 2 324.405 4.204 20 0 DIADLO CCO[P@@](C)(=O)CC[C@@H](C)Nc1ccc2c(c1)CCC[N@H+]2C ZINC000877160257 1043751590 /nfs/dbraw/zinc/75/15/90/1043751590.db2.gz UKRRYIDFFCDEMX-JLCFBVMHSA-N 1 2 324.405 4.204 20 0 DIADLO CCO[P@@](C)(=O)CC[C@@H](C)Nc1ccc2c(c1)CCC[N@@H+]2C ZINC000877160257 1043751603 /nfs/dbraw/zinc/75/16/03/1043751603.db2.gz UKRRYIDFFCDEMX-JLCFBVMHSA-N 1 2 324.405 4.204 20 0 DIADLO CC(C)=CCC[C@@H](C)[NH2+]c1ccc(N2CCO[C@H](C)C2)cc1 ZINC000777693857 1043760236 /nfs/dbraw/zinc/76/02/36/1043760236.db2.gz NWKVBUQMBGTGIZ-IAGOWNOFSA-N 1 2 302.462 4.459 20 0 DIADLO CCC(C)(C)OCc1cccc(NCc2c[nH+]cn2C)c1C ZINC000355391021 1043763563 /nfs/dbraw/zinc/76/35/63/1043763563.db2.gz NWMFSMJGGCFNGX-UHFFFAOYSA-N 1 2 301.434 4.046 20 0 DIADLO CC1(C)C[N@H+](Cc2cc3c(cc[nH]c3=O)o2)[C@H]1c1cccs1 ZINC000877534262 1043772499 /nfs/dbraw/zinc/77/24/99/1043772499.db2.gz CWCMINCOEDNACV-HNNXBMFYSA-N 1 2 314.410 4.178 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc3c(cc[nH]c3=O)o2)[C@H]1c1cccs1 ZINC000877534262 1043772506 /nfs/dbraw/zinc/77/25/06/1043772506.db2.gz CWCMINCOEDNACV-HNNXBMFYSA-N 1 2 314.410 4.178 20 0 DIADLO CC1(CC(F)(F)F)C[NH+](Cc2cc3c(ccnc3Cl)o2)C1 ZINC000877582283 1043776831 /nfs/dbraw/zinc/77/68/31/1043776831.db2.gz PKEQAJFBZSHQOH-UHFFFAOYSA-N 1 2 318.726 4.256 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C/c2nc3ccccc3s2)c(C)[nH+]1 ZINC000097040140 1043781127 /nfs/dbraw/zinc/78/11/27/1043781127.db2.gz LGCZDZKJYGJWHF-CMDGGOBGSA-N 1 2 323.421 4.268 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)Oc2cccc(Cl)c2)c(C)[nH+]1 ZINC000097040242 1043781431 /nfs/dbraw/zinc/78/14/31/1043781431.db2.gz ISRYFFXIASODRM-CYBMUJFWSA-N 1 2 318.804 4.066 20 0 DIADLO Cc1cc(Br)cc(CNc2ccc([NH+](C)C)cc2)c1 ZINC001308324182 1043788963 /nfs/dbraw/zinc/78/89/63/1043788963.db2.gz DJZVTFHBIRMKRE-UHFFFAOYSA-N 1 2 319.246 4.436 20 0 DIADLO FC(F)(F)c1ccc(CSCCCn2cc[nH+]c2)cc1 ZINC000355945210 1043797285 /nfs/dbraw/zinc/79/72/85/1043797285.db2.gz SQQODFCHOQOXRP-UHFFFAOYSA-N 1 2 300.349 4.225 20 0 DIADLO Cc1ccc(-c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)s1 ZINC000355982725 1043799583 /nfs/dbraw/zinc/79/95/83/1043799583.db2.gz JAEQWHWNIIXRNV-UHFFFAOYSA-N 1 2 322.393 4.018 20 0 DIADLO Cc1ccc(-c2cc(C(=O)Nc3c(C)cc(C)[nH+]c3C)on2)cc1 ZINC000097263068 1043800489 /nfs/dbraw/zinc/80/04/89/1043800489.db2.gz UIWAFNUVEBSNLL-UHFFFAOYSA-N 1 2 321.380 4.223 20 0 DIADLO CC[N@H+](Cc1coc(C(C)(C)C)n1)Cc1ccc(OC)cc1 ZINC000929286982 1043807419 /nfs/dbraw/zinc/80/74/19/1043807419.db2.gz APCPSAGSZRKBFR-UHFFFAOYSA-N 1 2 302.418 4.003 20 0 DIADLO CC[N@@H+](Cc1coc(C(C)(C)C)n1)Cc1ccc(OC)cc1 ZINC000929286982 1043807442 /nfs/dbraw/zinc/80/74/42/1043807442.db2.gz APCPSAGSZRKBFR-UHFFFAOYSA-N 1 2 302.418 4.003 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2nc(C)c(C(C)(C)C)s2)on1 ZINC000929288487 1043807929 /nfs/dbraw/zinc/80/79/29/1043807929.db2.gz QPIFHSJBRCXAIO-CYBMUJFWSA-N 1 2 319.474 4.383 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2nc(C)c(C(C)(C)C)s2)on1 ZINC000929288487 1043807949 /nfs/dbraw/zinc/80/79/49/1043807949.db2.gz QPIFHSJBRCXAIO-CYBMUJFWSA-N 1 2 319.474 4.383 20 0 DIADLO c1cc(C[N@H+](Cc2ccccc2)Cc2ccc3c(c2)CCC3)n[nH]1 ZINC000522445830 1043809611 /nfs/dbraw/zinc/80/96/11/1043809611.db2.gz WJLPXKBOOKYHQH-UHFFFAOYSA-N 1 2 317.436 4.101 20 0 DIADLO c1cc(C[N@@H+](Cc2ccccc2)Cc2ccc3c(c2)CCC3)n[nH]1 ZINC000522445830 1043809633 /nfs/dbraw/zinc/80/96/33/1043809633.db2.gz WJLPXKBOOKYHQH-UHFFFAOYSA-N 1 2 317.436 4.101 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1ccc(C(C)C)cn1 ZINC000356115757 1043811512 /nfs/dbraw/zinc/81/15/12/1043811512.db2.gz ZLEDWQHSFGWIJF-UHFFFAOYSA-N 1 2 320.396 4.156 20 0 DIADLO Cc1cc(C)c2cc(NCc3cnn(C)c3C3CC3)ccc2[nH+]1 ZINC000896063432 1043818052 /nfs/dbraw/zinc/81/80/52/1043818052.db2.gz FALRMUVABZTPOH-UHFFFAOYSA-N 1 2 306.413 4.075 20 0 DIADLO C[C@@H]([NH2+]Cc1cscc1C(F)(F)F)c1c(F)cncc1F ZINC000356290383 1043831547 /nfs/dbraw/zinc/83/15/47/1043831547.db2.gz BHINZUDNBBCWPD-SSDOTTSWSA-N 1 2 322.302 4.291 20 0 DIADLO FC(F)(F)c1cscc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000356301972 1043831764 /nfs/dbraw/zinc/83/17/64/1043831764.db2.gz LLZPRINCFNIIIW-CQSZACIVSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cscc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000356301972 1043831782 /nfs/dbraw/zinc/83/17/82/1043831782.db2.gz LLZPRINCFNIIIW-CQSZACIVSA-N 1 2 312.360 4.499 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@H]2c2ccncc2)cc(C(F)(F)F)c1 ZINC000356313109 1043833343 /nfs/dbraw/zinc/83/33/43/1043833343.db2.gz DDFCKWQABDQPSV-INIZCTEOSA-N 1 2 322.330 4.143 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@H]2c2ccncc2)cc(C(F)(F)F)c1 ZINC000356313109 1043833356 /nfs/dbraw/zinc/83/33/56/1043833356.db2.gz DDFCKWQABDQPSV-INIZCTEOSA-N 1 2 322.330 4.143 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1scnc1Cl ZINC000878046076 1043842869 /nfs/dbraw/zinc/84/28/69/1043842869.db2.gz YEGCLSNWDZQAAK-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1scnc1Cl ZINC000878046076 1043842859 /nfs/dbraw/zinc/84/28/59/1043842859.db2.gz YEGCLSNWDZQAAK-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO Clc1ncsc1C[N@@H+]1CCS[C@H](c2ccccc2)C1 ZINC000878114320 1043849630 /nfs/dbraw/zinc/84/96/30/1043849630.db2.gz INDKADLCHXKHFJ-LBPRGKRZSA-N 1 2 310.875 4.087 20 0 DIADLO Clc1ncsc1C[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000878114320 1043849652 /nfs/dbraw/zinc/84/96/52/1043849652.db2.gz INDKADLCHXKHFJ-LBPRGKRZSA-N 1 2 310.875 4.087 20 0 DIADLO C[N@H+](Cc1noc(-c2cccc(Cl)c2Cl)n1)C1CCC1 ZINC000878135787 1043850315 /nfs/dbraw/zinc/85/03/15/1043850315.db2.gz NEITYABYAQCZMU-UHFFFAOYSA-N 1 2 312.200 4.028 20 0 DIADLO C[N@@H+](Cc1noc(-c2cccc(Cl)c2Cl)n1)C1CCC1 ZINC000878135787 1043850331 /nfs/dbraw/zinc/85/03/31/1043850331.db2.gz NEITYABYAQCZMU-UHFFFAOYSA-N 1 2 312.200 4.028 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nc3c(o2)CCCC3)[C@@H](c2ccco2)C1 ZINC000878152621 1043853670 /nfs/dbraw/zinc/85/36/70/1043853670.db2.gz LXEMENPHHHROSG-DZGCQCFKSA-N 1 2 300.402 4.120 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nc3c(o2)CCCC3)[C@@H](c2ccco2)C1 ZINC000878152621 1043853687 /nfs/dbraw/zinc/85/36/87/1043853687.db2.gz LXEMENPHHHROSG-DZGCQCFKSA-N 1 2 300.402 4.120 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cnc(-c2ccccc2)o1)c1nccs1 ZINC000929990098 1043861927 /nfs/dbraw/zinc/86/19/27/1043861927.db2.gz BRUZYYFOFKSVFO-QGZVFWFLSA-N 1 2 313.426 4.213 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1coc(C(C)(C)C)n1)C(C)C ZINC000929982373 1043862562 /nfs/dbraw/zinc/86/25/62/1043862562.db2.gz SULVEYROUGOTEJ-OAHLLOKOSA-N 1 2 301.434 4.162 20 0 DIADLO Cc1conc1C[N@H+](Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000878284146 1043866478 /nfs/dbraw/zinc/86/64/78/1043866478.db2.gz PCIKVKLVKXDWHV-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1conc1C[N@@H+](Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000878284146 1043866496 /nfs/dbraw/zinc/86/64/96/1043866496.db2.gz PCIKVKLVKXDWHV-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)s1 ZINC000289747412 1043871156 /nfs/dbraw/zinc/87/11/56/1043871156.db2.gz IXLQTSKSSYSQQY-HNNXBMFYSA-N 1 2 317.458 4.434 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)s1 ZINC000289747412 1043871171 /nfs/dbraw/zinc/87/11/71/1043871171.db2.gz IXLQTSKSSYSQQY-HNNXBMFYSA-N 1 2 317.458 4.434 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccc(Cl)cc1 ZINC000878348430 1043874652 /nfs/dbraw/zinc/87/46/52/1043874652.db2.gz MMHGQIQBJBWBEF-CQSZACIVSA-N 1 2 304.821 4.448 20 0 DIADLO COc1cccc([C@@H](C)[NH2+]Cc2noc3c2CC(C)(C)CC3)c1 ZINC000878351467 1043876634 /nfs/dbraw/zinc/87/66/34/1043876634.db2.gz YSYKLFMCTYOTAC-CYBMUJFWSA-N 1 2 314.429 4.049 20 0 DIADLO C[C@H]([NH2+]Cc1scnc1Cl)c1ccc(F)cc1Cl ZINC000878363957 1043878572 /nfs/dbraw/zinc/87/85/72/1043878572.db2.gz BXOCWNCIUXZRDU-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO COc1ccc(C2([NH2+]Cc3c(Cl)cncc3Cl)CC2)cc1 ZINC000878362885 1043879708 /nfs/dbraw/zinc/87/97/08/1043879708.db2.gz KGZHXQMACFYQSW-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2ccc(C)c(Cl)n2)C2CC2)s1 ZINC000878412429 1043886711 /nfs/dbraw/zinc/88/67/11/1043886711.db2.gz VGLYODLRWSUBSL-ZDUSSCGKSA-N 1 2 307.850 4.049 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2nc(C(C)C)ns2)c1 ZINC000930198016 1043890402 /nfs/dbraw/zinc/89/04/02/1043890402.db2.gz IDMFWIKPHRTXMV-ZDUSSCGKSA-N 1 2 319.474 4.300 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+]Cc1nc(C(C)C)ns1 ZINC000930200497 1043890813 /nfs/dbraw/zinc/89/08/13/1043890813.db2.gz IWGQVVLFXVOLRL-AWEZNQCLSA-N 1 2 319.474 4.301 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cc(C(F)(F)F)co2)C1 ZINC000878429078 1043893366 /nfs/dbraw/zinc/89/33/66/1043893366.db2.gz WAPHZKBWVVZJAS-NHYWBVRUSA-N 1 2 310.319 4.277 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(C(F)(F)F)co2)C1 ZINC000878429078 1043893382 /nfs/dbraw/zinc/89/33/82/1043893382.db2.gz WAPHZKBWVVZJAS-NHYWBVRUSA-N 1 2 310.319 4.277 20 0 DIADLO CC[C@H]([NH2+]Cc1coc(C(C)(C)C)n1)c1ccccc1OC ZINC000930202997 1043895016 /nfs/dbraw/zinc/89/50/16/1043895016.db2.gz YALJJILBSLRHTG-HNNXBMFYSA-N 1 2 302.418 4.222 20 0 DIADLO CCCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nncs1 ZINC000930233463 1043902428 /nfs/dbraw/zinc/90/24/28/1043902428.db2.gz QUVMBAGTPKALOH-HNNXBMFYSA-N 1 2 319.474 4.204 20 0 DIADLO COc1ccccc1[C@H](CC(C)C)[NH2+][C@@H](C)c1cc(C)on1 ZINC000290035785 1043910928 /nfs/dbraw/zinc/91/09/28/1043910928.db2.gz BEUFQHXIEDBNQD-YOEHRIQHSA-N 1 2 302.418 4.430 20 0 DIADLO CCc1nnc(C[NH2+][C@@H]2CCSc3cc(C)c(C)cc32)s1 ZINC000290030700 1043912405 /nfs/dbraw/zinc/91/24/05/1043912405.db2.gz CWEODDSCFAYSSP-CYBMUJFWSA-N 1 2 319.499 4.044 20 0 DIADLO COCc1nc(C[NH2+]C(c2ccccc2)c2ccccc2)cs1 ZINC000561310707 1043923895 /nfs/dbraw/zinc/92/38/95/1043923895.db2.gz LXFWYDNTGSNNBQ-UHFFFAOYSA-N 1 2 324.449 4.169 20 0 DIADLO c1cc([C@@H]2CCC[N@H+]2Cc2ccn(C3CCCC3)n2)cs1 ZINC000357174202 1043924853 /nfs/dbraw/zinc/92/48/53/1043924853.db2.gz CASPDBLSJJEZMH-KRWDZBQOSA-N 1 2 301.459 4.397 20 0 DIADLO c1cc([C@@H]2CCC[N@@H+]2Cc2ccn(C3CCCC3)n2)cs1 ZINC000357174202 1043924862 /nfs/dbraw/zinc/92/48/62/1043924862.db2.gz CASPDBLSJJEZMH-KRWDZBQOSA-N 1 2 301.459 4.397 20 0 DIADLO CC(C)(C)[N@H+](Cc1ccsc1)Cc1nccn1CC(F)F ZINC000878885238 1043927493 /nfs/dbraw/zinc/92/74/93/1043927493.db2.gz AAGUNPABLZRODV-UHFFFAOYSA-N 1 2 313.417 4.010 20 0 DIADLO CC(C)(C)[N@@H+](Cc1ccsc1)Cc1nccn1CC(F)F ZINC000878885238 1043927498 /nfs/dbraw/zinc/92/74/98/1043927498.db2.gz AAGUNPABLZRODV-UHFFFAOYSA-N 1 2 313.417 4.010 20 0 DIADLO Clc1ccc2ccc(C[N@@H+]3CCC[C@@H]3c3ncccn3)nc2c1 ZINC000878977843 1043932756 /nfs/dbraw/zinc/93/27/56/1043932756.db2.gz MGFFRCXHVNDOMI-QGZVFWFLSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1ccc2ccc(C[N@H+]3CCC[C@@H]3c3ncccn3)nc2c1 ZINC000878977843 1043932765 /nfs/dbraw/zinc/93/27/65/1043932765.db2.gz MGFFRCXHVNDOMI-QGZVFWFLSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@@H]2c2ncccn2)c2ccccc2n1 ZINC000878978716 1043933479 /nfs/dbraw/zinc/93/34/79/1043933479.db2.gz SSVQQORALLDRGA-MRXNPFEDSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@@H]2c2ncccn2)c2ccccc2n1 ZINC000878978716 1043933488 /nfs/dbraw/zinc/93/34/88/1043933488.db2.gz SSVQQORALLDRGA-MRXNPFEDSA-N 1 2 324.815 4.015 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1nc(-c2ccoc2)no1 ZINC000357251613 1043933572 /nfs/dbraw/zinc/93/35/72/1043933572.db2.gz CRYISSMKYKLCNE-GFCCVEGCSA-N 1 2 323.352 4.269 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nc(-c2ccoc2)no1 ZINC000357251613 1043933577 /nfs/dbraw/zinc/93/35/77/1043933577.db2.gz CRYISSMKYKLCNE-GFCCVEGCSA-N 1 2 323.352 4.269 20 0 DIADLO Cc1nc(N2CC[C@H]2c2ccc(Cl)cc2)c2c([nH+]1)CCCC2 ZINC000561357461 1043935867 /nfs/dbraw/zinc/93/58/67/1043935867.db2.gz CHLJELHZVXAJDG-KRWDZBQOSA-N 1 2 313.832 4.269 20 0 DIADLO Cc1cn(C)nc1C[NH2+][C@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000930507486 1043936892 /nfs/dbraw/zinc/93/68/92/1043936892.db2.gz GZQSTWZSGCWSQO-INIZCTEOSA-N 1 2 324.255 4.276 20 0 DIADLO CCOc1ccccc1C1=CC[N@H+](Cc2ncc(C)s2)CC1 ZINC000357308323 1043938523 /nfs/dbraw/zinc/93/85/23/1043938523.db2.gz SWFDATWLWNIXJA-UHFFFAOYSA-N 1 2 314.454 4.140 20 0 DIADLO CCOc1ccccc1C1=CC[N@@H+](Cc2ncc(C)s2)CC1 ZINC000357308323 1043938531 /nfs/dbraw/zinc/93/85/31/1043938531.db2.gz SWFDATWLWNIXJA-UHFFFAOYSA-N 1 2 314.454 4.140 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+](Cc2cccnc2)C2CC2)s1 ZINC000290366286 1043945271 /nfs/dbraw/zinc/94/52/71/1043945271.db2.gz HDPUMTBDIQCNKW-UHFFFAOYSA-N 1 2 301.459 4.000 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+](Cc2cccnc2)C2CC2)s1 ZINC000290366286 1043945284 /nfs/dbraw/zinc/94/52/84/1043945284.db2.gz HDPUMTBDIQCNKW-UHFFFAOYSA-N 1 2 301.459 4.000 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2csnn2)C2CCCCC2)cc1 ZINC000639377467 1043956204 /nfs/dbraw/zinc/95/62/04/1043956204.db2.gz DRZAXAMEBVFXBZ-MRXNPFEDSA-N 1 2 305.422 4.088 20 0 DIADLO Cc1cc(Cl)cc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000357483715 1043958373 /nfs/dbraw/zinc/95/83/73/1043958373.db2.gz VDKRCYHRMGTWRI-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](C)c2cc3cnccc3o2)cs1 ZINC000879714796 1043983654 /nfs/dbraw/zinc/98/36/54/1043983654.db2.gz ZCIHKVLFZJYOSV-NSHDSACASA-N 1 2 301.415 4.088 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C3(c4ccccc4)CCCC3)cc2[nH+]1 ZINC000561655447 1043984105 /nfs/dbraw/zinc/98/41/05/1043984105.db2.gz CXDKWHUQFDJKJY-UHFFFAOYSA-N 1 2 319.408 4.322 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2nccc3ccccc32)[nH]1 ZINC000290790167 1043986076 /nfs/dbraw/zinc/98/60/76/1043986076.db2.gz UPFBDDQUVFENAM-IHRRRGAJSA-N 1 2 323.444 4.278 20 0 DIADLO Cc1ccc(C[S@](=O)c2ccc(Cl)c(Cl)c2)c(C)[nH+]1 ZINC000357836268 1043994016 /nfs/dbraw/zinc/99/40/16/1043994016.db2.gz MJJVNDRLMWEJIE-IBGZPJMESA-N 1 2 314.237 4.313 20 0 DIADLO CC(C)c1cc([C@H]2CCC[N@H+](C/C(Cl)=C\Cl)C2)[nH]n1 ZINC000879920103 1044000827 /nfs/dbraw/zinc/00/08/27/1044000827.db2.gz WCRRWUARVPQRHK-WBOGTDJTSA-N 1 2 302.249 4.032 20 0 DIADLO CC[C@H]([NH2+]Cc1ccnc(Cl)c1Cl)c1nc(C)cs1 ZINC000290937863 1044002819 /nfs/dbraw/zinc/00/28/19/1044002819.db2.gz SVBOVEDIDZWQSE-JTQLQIEISA-N 1 2 316.257 4.394 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@H+](Cc2cc(-c3cccs3)on2)C1 ZINC000880000895 1044003243 /nfs/dbraw/zinc/00/32/43/1044003243.db2.gz ZGHVTAVHZTVMLU-ZDUSSCGKSA-N 1 2 316.348 4.177 20 0 DIADLO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2cc(-c3cccs3)on2)C1 ZINC000880000895 1044003253 /nfs/dbraw/zinc/00/32/53/1044003253.db2.gz ZGHVTAVHZTVMLU-ZDUSSCGKSA-N 1 2 316.348 4.177 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1nc2c(s1)CCCC2 ZINC000358033111 1044009413 /nfs/dbraw/zinc/00/94/13/1044009413.db2.gz KWIQFGWZCYYOOP-UHFFFAOYSA-N 1 2 318.511 4.376 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1nc2c(s1)CCCC2 ZINC000358033111 1044009423 /nfs/dbraw/zinc/00/94/23/1044009423.db2.gz KWIQFGWZCYYOOP-UHFFFAOYSA-N 1 2 318.511 4.376 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1cc(-c2ccco2)on1 ZINC000358038479 1044009837 /nfs/dbraw/zinc/00/98/37/1044009837.db2.gz GLBUMPQTRAMQLR-UHFFFAOYSA-N 1 2 314.410 4.289 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1cc(-c2ccco2)on1 ZINC000358038479 1044009847 /nfs/dbraw/zinc/00/98/47/1044009847.db2.gz GLBUMPQTRAMQLR-UHFFFAOYSA-N 1 2 314.410 4.289 20 0 DIADLO Clc1cccc(C[N@@H+]2CC[C@@H](Oc3ccccc3Cl)C2)n1 ZINC000128311448 1044023450 /nfs/dbraw/zinc/02/34/50/1044023450.db2.gz PTTMETGXLKPGPU-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cccc(C[N@H+]2CC[C@@H](Oc3ccccc3Cl)C2)n1 ZINC000128311448 1044023466 /nfs/dbraw/zinc/02/34/66/1044023466.db2.gz PTTMETGXLKPGPU-CYBMUJFWSA-N 1 2 323.223 4.042 20 0 DIADLO CC(C)c1nnc([C@@H](C)[NH2+][C@@H]2C[C@@H](C)Sc3sccc32)[nH]1 ZINC000358249853 1044041843 /nfs/dbraw/zinc/04/18/43/1044041843.db2.gz JSIZSZVWUDLCAE-CKYFFXLPSA-N 1 2 322.503 4.266 20 0 DIADLO CC(C)c1nnc([C@@H](C)[NH2+][C@H]2C[C@@H](C)Sc3sccc32)[nH]1 ZINC000358249868 1044042508 /nfs/dbraw/zinc/04/25/08/1044042508.db2.gz JSIZSZVWUDLCAE-FOGDFJRCSA-N 1 2 322.503 4.266 20 0 DIADLO Cc1cc(N2CC[C@H](c3ccc(Cl)cc3)C2)nc(C2CC2)[nH+]1 ZINC000522567501 1044046094 /nfs/dbraw/zinc/04/60/94/1044046094.db2.gz IKTLVGCDKUJYIA-HNNXBMFYSA-N 1 2 313.832 4.310 20 0 DIADLO FC(F)[C@H]([NH2+]CCC[C@H]1CCOC1)c1cccc(Cl)c1 ZINC000880534677 1044046576 /nfs/dbraw/zinc/04/65/76/1044046576.db2.gz UHXWOGOWRCXZGT-SMDDNHRTSA-N 1 2 303.780 4.053 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)C1CCC(c2ccccc2)CC1 ZINC000443874696 1044046957 /nfs/dbraw/zinc/04/69/57/1044046957.db2.gz BLAIVWKJJXSAGP-UHFFFAOYSA-N 1 2 319.408 4.247 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2nnc(C(C)C)s2)cc1 ZINC000358289613 1044047420 /nfs/dbraw/zinc/04/74/20/1044047420.db2.gz PKDWEPWVBSNZAY-ZDUSSCGKSA-N 1 2 319.474 4.300 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1nc(C2CC2)cs1 ZINC000358291203 1044048694 /nfs/dbraw/zinc/04/86/94/1044048694.db2.gz SPIMMIUCKQDDAE-JTQLQIEISA-N 1 2 306.406 4.019 20 0 DIADLO Cc1cn2c([nH+]1)[C@H](CNc1cc(C)nc3c(F)cccc13)CCC2 ZINC000443888264 1044051836 /nfs/dbraw/zinc/05/18/36/1044051836.db2.gz YXDABZMEIKHCNG-AWEZNQCLSA-N 1 2 324.403 4.177 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)no1 ZINC000562034266 1044052623 /nfs/dbraw/zinc/05/26/23/1044052623.db2.gz YNPHPDPCKUNCII-INIZCTEOSA-N 1 2 302.393 4.448 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)no1 ZINC000562034266 1044052639 /nfs/dbraw/zinc/05/26/39/1044052639.db2.gz YNPHPDPCKUNCII-INIZCTEOSA-N 1 2 302.393 4.448 20 0 DIADLO c1cn(-c2ccc(CSc3ncnc4ccsc43)cc2)c[nH+]1 ZINC000358338632 1044057979 /nfs/dbraw/zinc/05/79/79/1044057979.db2.gz VQOCDZBNKAQFPP-UHFFFAOYSA-N 1 2 324.434 4.169 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2ccc(F)c(C(F)F)c2)c[nH+]1 ZINC000880691556 1044059599 /nfs/dbraw/zinc/05/95/99/1044059599.db2.gz QBJLQPFMKZWKSZ-UHFFFAOYSA-N 1 2 323.318 4.097 20 0 DIADLO Fc1cncc(F)c1C[N@@H+]1CCCSC[C@@H]1c1ccccc1 ZINC000931694661 1044060658 /nfs/dbraw/zinc/06/06/58/1044060658.db2.gz NBURTLDWLFTBBS-QGZVFWFLSA-N 1 2 320.408 4.040 20 0 DIADLO Fc1cncc(F)c1C[N@H+]1CCCSC[C@@H]1c1ccccc1 ZINC000931694661 1044060669 /nfs/dbraw/zinc/06/06/69/1044060669.db2.gz NBURTLDWLFTBBS-QGZVFWFLSA-N 1 2 320.408 4.040 20 0 DIADLO FCCCCC[N@@H+]1CCc2nc[nH]c2[C@H]1c1ccc(Cl)cc1 ZINC000931796867 1044073038 /nfs/dbraw/zinc/07/30/38/1044073038.db2.gz OGVWWSZXRBSBEU-QGZVFWFLSA-N 1 2 321.827 4.150 20 0 DIADLO FCCCCC[N@H+]1CCc2nc[nH]c2[C@H]1c1ccc(Cl)cc1 ZINC000931796867 1044073052 /nfs/dbraw/zinc/07/30/52/1044073052.db2.gz OGVWWSZXRBSBEU-QGZVFWFLSA-N 1 2 321.827 4.150 20 0 DIADLO CCCCc1noc(C[NH2+][C@H]2CCc3cccc4cccc2c43)n1 ZINC000931807944 1044075237 /nfs/dbraw/zinc/07/52/37/1044075237.db2.gz XPKOBZOIYQRNNY-KRWDZBQOSA-N 1 2 321.424 4.343 20 0 DIADLO c1cc2cccc3c2c(c1)CC[C@H]3[NH2+]Cc1nc(C2CCC2)no1 ZINC000931810310 1044075361 /nfs/dbraw/zinc/07/53/61/1044075361.db2.gz ZDLKAZQIEUVTOA-QGZVFWFLSA-N 1 2 319.408 4.267 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1ccc(Oc2ccccc2)nn1 ZINC000346335161 1044093296 /nfs/dbraw/zinc/09/32/96/1044093296.db2.gz YKAPPYQETKSWKT-CQSZACIVSA-N 1 2 309.369 4.055 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1ccc(Oc2ccccc2)nn1 ZINC000346335161 1044093314 /nfs/dbraw/zinc/09/33/14/1044093314.db2.gz YKAPPYQETKSWKT-CQSZACIVSA-N 1 2 309.369 4.055 20 0 DIADLO CN(C)c1cc[nH+]cc1CN[C@@H]1CCCc2sc(Cl)cc21 ZINC000291712331 1044096253 /nfs/dbraw/zinc/09/62/53/1044096253.db2.gz LMURSWIJYXJNOC-CYBMUJFWSA-N 1 2 321.877 4.030 20 0 DIADLO Cc1nc(C)c([C@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)s1 ZINC000281105185 1044096679 /nfs/dbraw/zinc/09/66/79/1044096679.db2.gz LLCNEASGHJBJQK-LURJTMIESA-N 1 2 318.339 4.167 20 0 DIADLO CC(C)[C@]1(C)C[C@@H]1c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000346378452 1044098727 /nfs/dbraw/zinc/09/87/27/1044098727.db2.gz BMMDVRMSCREOBQ-QAPCUYQASA-N 1 2 308.385 4.072 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@H]2CCCOc3ccc(Cl)cc32)n1 ZINC000562318108 1044100195 /nfs/dbraw/zinc/10/01/95/1044100195.db2.gz UUHYYLSNAPGIMN-INIZCTEOSA-N 1 2 319.836 4.121 20 0 DIADLO CC1(c2ccccc2)CC([NH2+][C@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC000562340252 1044101732 /nfs/dbraw/zinc/10/17/32/1044101732.db2.gz GWSAIAVDILGNHH-FDYSRKEFSA-N 1 2 324.472 4.136 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2ccsc2)c2cccnc2)c(F)c1 ZINC000346436860 1044102497 /nfs/dbraw/zinc/10/24/97/1044102497.db2.gz FGSOKVJSTYIJDD-KRWDZBQOSA-N 1 2 316.376 4.301 20 0 DIADLO Cc1ncsc1CC[N@@H+](C)[C@H](CCc1ccccc1)C(F)F ZINC000626137125 1044103277 /nfs/dbraw/zinc/10/32/77/1044103277.db2.gz VGVZALMRCLGSQB-OAHLLOKOSA-N 1 2 324.440 4.192 20 0 DIADLO Cc1ncsc1CC[N@H+](C)[C@H](CCc1ccccc1)C(F)F ZINC000626137125 1044103284 /nfs/dbraw/zinc/10/32/84/1044103284.db2.gz VGVZALMRCLGSQB-OAHLLOKOSA-N 1 2 324.440 4.192 20 0 DIADLO Cc1ccccc1C1(C[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)CC1 ZINC000562365552 1044105201 /nfs/dbraw/zinc/10/52/01/1044105201.db2.gz YVDNRJHKVURQGM-GOSISDBHSA-N 1 2 324.472 4.056 20 0 DIADLO Cc1nnc(C[N@H+]2CCC[C@@H]2c2ccc(C(C)C)cc2)s1 ZINC000358858067 1044105872 /nfs/dbraw/zinc/10/58/72/1044105872.db2.gz IMMCRYYKCYUYJJ-MRXNPFEDSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1nnc(C[N@@H+]2CCC[C@@H]2c2ccc(C(C)C)cc2)s1 ZINC000358858067 1044105875 /nfs/dbraw/zinc/10/58/75/1044105875.db2.gz IMMCRYYKCYUYJJ-MRXNPFEDSA-N 1 2 301.459 4.307 20 0 DIADLO Fc1ccc(-c2nc(C[NH2+][C@H](c3ccccn3)C3CC3)co2)cc1 ZINC000932382099 1044121407 /nfs/dbraw/zinc/12/14/07/1044121407.db2.gz SEAULPYOHLSGDJ-SFHVURJKSA-N 1 2 323.371 4.117 20 0 DIADLO c1cc(-c2nc(C[NH2+][C@H](c3ccccn3)C3CC3)cs2)co1 ZINC000932382995 1044124143 /nfs/dbraw/zinc/12/41/43/1044124143.db2.gz VMDQRHMXNRCGLE-INIZCTEOSA-N 1 2 311.410 4.039 20 0 DIADLO c1cc(-c2nc(C[NH2+][C@@H](c3ccccn3)C3CC3)cs2)co1 ZINC000932382997 1044124473 /nfs/dbraw/zinc/12/44/73/1044124473.db2.gz VMDQRHMXNRCGLE-MRXNPFEDSA-N 1 2 311.410 4.039 20 0 DIADLO Cc1ccncc1C[N@H+](Cc1nc2ccccc2s1)C1CC1 ZINC000932398672 1044126067 /nfs/dbraw/zinc/12/60/67/1044126067.db2.gz LQRKYXBZJHZEFV-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO Cc1ccncc1C[N@@H+](Cc1nc2ccccc2s1)C1CC1 ZINC000932398672 1044126070 /nfs/dbraw/zinc/12/60/70/1044126070.db2.gz LQRKYXBZJHZEFV-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+](Cc2ccccn2)CC(C)C)n1 ZINC000932442242 1044129424 /nfs/dbraw/zinc/12/94/24/1044129424.db2.gz NJFSPGZMOYKJQM-HNNXBMFYSA-N 1 2 316.449 4.026 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+](Cc2ccccn2)CC(C)C)n1 ZINC000932442242 1044129431 /nfs/dbraw/zinc/12/94/31/1044129431.db2.gz NJFSPGZMOYKJQM-HNNXBMFYSA-N 1 2 316.449 4.026 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1nnc(-c2cccc(Cl)c2)o1 ZINC000359132239 1044134138 /nfs/dbraw/zinc/13/41/38/1044134138.db2.gz STWFETUACOZEIT-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1nnc(-c2cccc(Cl)c2)o1 ZINC000359132239 1044134151 /nfs/dbraw/zinc/13/41/51/1044134151.db2.gz STWFETUACOZEIT-UHFFFAOYSA-N 1 2 319.817 4.084 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2C[C@H](c3ccccc3)C2)c(C)[nH+]1 ZINC000562608184 1044134797 /nfs/dbraw/zinc/13/47/97/1044134797.db2.gz ZLJFLJAEMXBBBB-QAQDUYKDSA-N 1 2 309.413 4.075 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)ccc1Cl ZINC000292107722 1044137994 /nfs/dbraw/zinc/13/79/94/1044137994.db2.gz JYQILNZYBCSPMS-MRXNPFEDSA-N 1 2 318.852 4.178 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ncc(C(C)(C)C)s2)n1 ZINC000562628427 1044140650 /nfs/dbraw/zinc/14/06/50/1044140650.db2.gz VZBHYXGRVQXWJX-HNNXBMFYSA-N 1 2 315.486 4.481 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ncc(C(C)(C)C)s2)n1 ZINC000562628427 1044140654 /nfs/dbraw/zinc/14/06/54/1044140654.db2.gz VZBHYXGRVQXWJX-HNNXBMFYSA-N 1 2 315.486 4.481 20 0 DIADLO CC(C)(C[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1)c1cccs1 ZINC000292223959 1044150478 /nfs/dbraw/zinc/15/04/78/1044150478.db2.gz QRTIYIJVZOIUJF-OAHLLOKOSA-N 1 2 318.490 4.055 20 0 DIADLO c1coc([C@@H]([NH2+]Cc2ccc3c(n2)CCC3)c2ccccc2)c1 ZINC000562685742 1044150548 /nfs/dbraw/zinc/15/05/48/1044150548.db2.gz AGDMYMMXOJLWNB-FQEVSTJZSA-N 1 2 304.393 4.043 20 0 DIADLO CC(C)(C[NH2+][C@H](c1ncn[nH]1)C1CCCCC1)c1cccs1 ZINC000292223952 1044151113 /nfs/dbraw/zinc/15/11/13/1044151113.db2.gz QRTIYIJVZOIUJF-HNNXBMFYSA-N 1 2 318.490 4.055 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)c(C)c1 ZINC000292259475 1044154041 /nfs/dbraw/zinc/15/40/41/1044154041.db2.gz SPYLGIYEJPOXRS-SFHVURJKSA-N 1 2 312.461 4.141 20 0 DIADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+]Cc1nccs1 ZINC000444019005 1044154166 /nfs/dbraw/zinc/15/41/66/1044154166.db2.gz WPUKMVAINIAYMR-GFCCVEGCSA-N 1 2 300.349 4.235 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1C(C)C ZINC000292409697 1044170815 /nfs/dbraw/zinc/17/08/15/1044170815.db2.gz UMUJBNQXCBSCHH-HNNXBMFYSA-N 1 2 314.429 4.170 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@@H](C)C(=O)Nc1ccccc1C(C)C ZINC000292409697 1044170819 /nfs/dbraw/zinc/17/08/19/1044170819.db2.gz UMUJBNQXCBSCHH-HNNXBMFYSA-N 1 2 314.429 4.170 20 0 DIADLO CCO[C@@H](C)c1nc(C[NH2+]C2(c3ccc(F)cc3)CC2)cs1 ZINC000346964102 1044176994 /nfs/dbraw/zinc/17/69/94/1044176994.db2.gz PQZJDPAWGVHJQI-LBPRGKRZSA-N 1 2 320.433 4.159 20 0 DIADLO C[C@H]1CC[C@]2(CC[N@H+](Cc3noc(C4CCCCC4)n3)C2)C1 ZINC000359570594 1044179656 /nfs/dbraw/zinc/17/96/56/1044179656.db2.gz ZWNDSPKTIZTSQS-KSSFIOAISA-N 1 2 303.450 4.129 20 0 DIADLO C[C@H]1CC[C@]2(CC[N@@H+](Cc3noc(C4CCCCC4)n3)C2)C1 ZINC000359570594 1044179659 /nfs/dbraw/zinc/17/96/59/1044179659.db2.gz ZWNDSPKTIZTSQS-KSSFIOAISA-N 1 2 303.450 4.129 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@H]2c2cccnc2)cs1 ZINC000346991790 1044183504 /nfs/dbraw/zinc/18/35/04/1044183504.db2.gz XMFOREPJAFABTH-INIZCTEOSA-N 1 2 301.459 4.218 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@H]2c2cccnc2)cs1 ZINC000346991790 1044183512 /nfs/dbraw/zinc/18/35/12/1044183512.db2.gz XMFOREPJAFABTH-INIZCTEOSA-N 1 2 301.459 4.218 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncccc1C)c1nc(C(F)(F)F)cs1 ZINC000359692967 1044191575 /nfs/dbraw/zinc/19/15/75/1044191575.db2.gz WLJLXJLNMZJROU-SNVBAGLBSA-N 1 2 315.364 4.106 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)c(C)n1 ZINC000359844124 1044206355 /nfs/dbraw/zinc/20/63/55/1044206355.db2.gz JOERMLYFYXKIFV-UHFFFAOYSA-N 1 2 302.368 4.141 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)c(C)n1 ZINC000359844124 1044206360 /nfs/dbraw/zinc/20/63/60/1044206360.db2.gz JOERMLYFYXKIFV-UHFFFAOYSA-N 1 2 302.368 4.141 20 0 DIADLO CSc1ccc(C[NH2+][C@@H](C)c2nc3ccccc3s2)o1 ZINC000883001797 1044214592 /nfs/dbraw/zinc/21/45/92/1044214592.db2.gz NURZWFKSJDQZBJ-JTQLQIEISA-N 1 2 304.440 4.462 20 0 DIADLO COCCCC[C@H](Nc1[nH+]c(C)nc2[nH]ccc21)c1ccccc1 ZINC000359906531 1044215570 /nfs/dbraw/zinc/21/55/70/1044215570.db2.gz VOWXWTDCRHKMCF-KRWDZBQOSA-N 1 2 324.428 4.236 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+]C2(c3ccc(F)cc3F)CCCC2)n1 ZINC000883077711 1044217588 /nfs/dbraw/zinc/21/75/88/1044217588.db2.gz SYAQLLKJGDWHFO-UHFFFAOYSA-N 1 2 319.399 4.370 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+][C@H]2CC(C)(C)Oc3cc(F)ccc32)n1 ZINC000883049819 1044217759 /nfs/dbraw/zinc/21/77/59/1044217759.db2.gz WDMWAAQEAZRPKC-AWEZNQCLSA-N 1 2 317.408 4.064 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C2CC2)s1)c1sccc1Cl ZINC000883230003 1044239334 /nfs/dbraw/zinc/23/93/34/1044239334.db2.gz VIJLCOGWRAIZFV-JTQLQIEISA-N 1 2 313.879 4.371 20 0 DIADLO CCC[C@](C)([NH2+]Cc1nc(C(C)(C)C)no1)c1ccccc1 ZINC000934184568 1044229601 /nfs/dbraw/zinc/22/96/01/1044229601.db2.gz TUIVRYIAXNVHSR-SFHVURJKSA-N 1 2 301.434 4.172 20 0 DIADLO Cc1cccc(C2([NH2+]Cc3nc(C4CCC4)no3)CCCC2)c1 ZINC000639526259 1044237649 /nfs/dbraw/zinc/23/76/49/1044237649.db2.gz APPFNJVALLDFGL-UHFFFAOYSA-N 1 2 311.429 4.205 20 0 DIADLO CC[C@H]([NH2+]Cc1nn(C)cc1C(F)F)c1sccc1Cl ZINC000883242741 1044244644 /nfs/dbraw/zinc/24/46/44/1044244644.db2.gz PRQXWRRVQDVQNQ-JTQLQIEISA-N 1 2 319.808 4.314 20 0 DIADLO COc1ccc(C2CC2)cc1C[NH2+]Cc1nc2ccccc2o1 ZINC000883258196 1044248352 /nfs/dbraw/zinc/24/83/52/1044248352.db2.gz UBFPPWWZEWLRGH-UHFFFAOYSA-N 1 2 308.381 4.004 20 0 DIADLO FCCC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1nc(C(F)(F)F)cs1 ZINC000934455476 1044250384 /nfs/dbraw/zinc/25/03/84/1044250384.db2.gz IHJJTJGVTKOOQX-FGWVZKOKSA-N 1 2 322.371 4.265 20 0 DIADLO FCCC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1nc(C(F)(F)F)cs1 ZINC000934455476 1044250399 /nfs/dbraw/zinc/25/03/99/1044250399.db2.gz IHJJTJGVTKOOQX-FGWVZKOKSA-N 1 2 322.371 4.265 20 0 DIADLO Cc1cc(C(=O)C[N@@H+]2CC[C@@H]2c2ccccc2)c(C)n1C1CC1 ZINC000444291906 1044253979 /nfs/dbraw/zinc/25/39/79/1044253979.db2.gz MPDMSYUHVMRKKL-LJQANCHMSA-N 1 2 308.425 4.070 20 0 DIADLO Cc1cc(C(=O)C[N@H+]2CC[C@@H]2c2ccccc2)c(C)n1C1CC1 ZINC000444291906 1044253986 /nfs/dbraw/zinc/25/39/86/1044253986.db2.gz MPDMSYUHVMRKKL-LJQANCHMSA-N 1 2 308.425 4.070 20 0 DIADLO Cc1ccccc1C(C)(C)[NH2+]Cc1noc(-c2ccsc2)n1 ZINC000293219910 1044261472 /nfs/dbraw/zinc/26/14/72/1044261472.db2.gz YPZGVRCNJRYJNI-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)c(Cl)n1 ZINC000883301738 1044264132 /nfs/dbraw/zinc/26/41/32/1044264132.db2.gz HRSVYBLNBJPWNX-OAHLLOKOSA-N 1 2 318.852 4.178 20 0 DIADLO Cc1cn2cc(NC(=O)CCc3ccc(C(C)C)cc3)ccc2[nH+]1 ZINC000522996037 1044265652 /nfs/dbraw/zinc/26/56/52/1044265652.db2.gz ALICGVPVTYQCRH-UHFFFAOYSA-N 1 2 321.424 4.337 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]C1(c2ncccn2)CCC1 ZINC000883313963 1044266309 /nfs/dbraw/zinc/26/63/09/1044266309.db2.gz REPRYDALJQDGCX-AWEZNQCLSA-N 1 2 307.397 4.261 20 0 DIADLO CCCc1nc(C)c(C[NH2+][C@@H](C)c2nc3c(s2)CCCC3)o1 ZINC000293389649 1044278286 /nfs/dbraw/zinc/27/82/86/1044278286.db2.gz IUOOXTCWFILSNO-LBPRGKRZSA-N 1 2 319.474 4.122 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)c[nH+]c1C ZINC000883342311 1044279725 /nfs/dbraw/zinc/27/97/25/1044279725.db2.gz SHRRKCFNINJQQG-CYBMUJFWSA-N 1 2 309.413 4.101 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)[nH]1 ZINC000293383915 1044279903 /nfs/dbraw/zinc/27/99/03/1044279903.db2.gz ZYAOWMBYBITCJW-OAHLLOKOSA-N 1 2 322.403 4.083 20 0 DIADLO Brc1cc(C[N@@H+]2CCC[C@@H]2c2ccsc2)ccn1 ZINC000293452919 1044285986 /nfs/dbraw/zinc/28/59/86/1044285986.db2.gz KSZVAFVJTFXWBU-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cc(C[N@H+]2CCC[C@@H]2c2ccsc2)ccn1 ZINC000293452919 1044285994 /nfs/dbraw/zinc/28/59/94/1044285994.db2.gz KSZVAFVJTFXWBU-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO C[C@H]([NH2+][C@@H]1c2ccccc2CC[C@H]1F)c1nc2ccccc2n1C ZINC000883376590 1044289221 /nfs/dbraw/zinc/28/92/21/1044289221.db2.gz OOLDFCQDFNHFND-URKNILKWSA-N 1 2 323.415 4.250 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cnc(Cl)c(F)c1 ZINC000883377827 1044292174 /nfs/dbraw/zinc/29/21/74/1044292174.db2.gz RGWBTRQJTKMYCK-UHFFFAOYSA-N 1 2 311.813 4.134 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1nc2cc(F)ccc2o1 ZINC000883378137 1044293074 /nfs/dbraw/zinc/29/30/74/1044293074.db2.gz ZWFLBVNSGPDZQE-UHFFFAOYSA-N 1 2 317.389 4.227 20 0 DIADLO O=c1[nH]c2ccccc2cc1C[N@H+]1Cc2ccc(Cl)cc2C1 ZINC001137188927 1044306194 /nfs/dbraw/zinc/30/61/94/1044306194.db2.gz YVGOEKFCMPVORW-UHFFFAOYSA-N 1 2 310.784 4.110 20 0 DIADLO O=c1[nH]c2ccccc2cc1C[N@@H+]1Cc2ccc(Cl)cc2C1 ZINC001137188927 1044306209 /nfs/dbraw/zinc/30/62/09/1044306209.db2.gz YVGOEKFCMPVORW-UHFFFAOYSA-N 1 2 310.784 4.110 20 0 DIADLO CSCc1cnc(C[NH2+][C@@H](C)c2ccc(F)cc2F)s1 ZINC000293623593 1044308499 /nfs/dbraw/zinc/30/84/99/1044308499.db2.gz QNJCECLXRFQRBC-VIFPVBQESA-N 1 2 314.426 4.135 20 0 DIADLO CCCCc1nc(C[N@H+](C)[C@H](C)Cc2ccc(Cl)cc2)no1 ZINC000523010207 1044315415 /nfs/dbraw/zinc/31/54/15/1044315415.db2.gz ZAGVZMILQLWRND-CYBMUJFWSA-N 1 2 321.852 4.129 20 0 DIADLO CCCCc1nc(C[N@@H+](C)[C@H](C)Cc2ccc(Cl)cc2)no1 ZINC000523010207 1044315427 /nfs/dbraw/zinc/31/54/27/1044315427.db2.gz ZAGVZMILQLWRND-CYBMUJFWSA-N 1 2 321.852 4.129 20 0 DIADLO Cc1ccc2c(Nc3cncc(C(F)(F)F)n3)cccc2[nH+]1 ZINC001212795086 1044317130 /nfs/dbraw/zinc/31/71/30/1044317130.db2.gz NGHKBUUDWMROLK-UHFFFAOYSA-N 1 2 304.275 4.096 20 0 DIADLO CCC[NH+](CCC)Cn1nc2sc3ccccc3n2c1=S ZINC000935192349 1044318742 /nfs/dbraw/zinc/31/87/42/1044318742.db2.gz VGQMQZYZGZLXAG-UHFFFAOYSA-N 1 2 320.487 4.159 20 0 DIADLO Cc1ccc2c(Nc3ncc(C(F)(F)F)cn3)cccc2[nH+]1 ZINC001212795172 1044319196 /nfs/dbraw/zinc/31/91/96/1044319196.db2.gz SFXRKOKXYBMVDK-UHFFFAOYSA-N 1 2 304.275 4.096 20 0 DIADLO CCN(CC)c1ccc(N[C@@H](c2cccnc2)C2CCC2)c[nH+]1 ZINC000360884670 1044322162 /nfs/dbraw/zinc/32/21/62/1044322162.db2.gz PZSMKHAWSXEBFT-LJQANCHMSA-N 1 2 310.445 4.276 20 0 DIADLO Cc1ccc2c(Nc3c(Cl)cnnc3Cl)cccc2[nH+]1 ZINC001212796229 1044325265 /nfs/dbraw/zinc/32/52/65/1044325265.db2.gz UXJPGNKVLFUGEE-UHFFFAOYSA-N 1 2 305.168 4.384 20 0 DIADLO Cc1ccc2c(Nc3cnc(C(F)(F)F)cc3N)cccc2[nH+]1 ZINC001212796189 1044326052 /nfs/dbraw/zinc/32/60/52/1044326052.db2.gz SKNSCLLUYRHRJZ-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@H]2c2ccc(Cl)cc2)cn1 ZINC000360966186 1044335947 /nfs/dbraw/zinc/33/59/47/1044335947.db2.gz LMJQTLMBQQNZFJ-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@H]2c2ccc(Cl)cc2)cn1 ZINC000360966186 1044335962 /nfs/dbraw/zinc/33/59/62/1044335962.db2.gz LMJQTLMBQQNZFJ-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)cn1 ZINC000360974959 1044338040 /nfs/dbraw/zinc/33/80/40/1044338040.db2.gz LCUJNVWNLMXYQA-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)cn1 ZINC000360974959 1044338049 /nfs/dbraw/zinc/33/80/49/1044338049.db2.gz LCUJNVWNLMXYQA-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000475276780 1044339888 /nfs/dbraw/zinc/33/98/88/1044339888.db2.gz BTDFYKNKLPUNBY-UWVGGRQHSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000475276780 1044339899 /nfs/dbraw/zinc/33/98/99/1044339899.db2.gz BTDFYKNKLPUNBY-UWVGGRQHSA-N 1 2 306.397 4.213 20 0 DIADLO Cc1cnn(C2CCOCC2)c1Nc1cccc2[nH+]c(C)ccc12 ZINC001212796875 1044346414 /nfs/dbraw/zinc/34/64/14/1044346414.db2.gz JRKDQDANUHSQBI-UHFFFAOYSA-N 1 2 322.412 4.143 20 0 DIADLO COc1cc(F)c([C@H](C)[NH2+][C@H](C)c2nc(C)cs2)cc1OC ZINC000361012315 1044347870 /nfs/dbraw/zinc/34/78/70/1044347870.db2.gz IQTZIIIQAUFNPF-WDEREUQCSA-N 1 2 324.421 4.020 20 0 DIADLO C[C@@H](c1nnc(-c2ccccc2)o1)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000361075510 1044356334 /nfs/dbraw/zinc/35/63/34/1044356334.db2.gz ZHZMXNJKYOAWKF-KBPBESRZSA-N 1 2 305.381 4.374 20 0 DIADLO C[C@@H](c1nnc(-c2ccccc2)o1)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000361075510 1044356346 /nfs/dbraw/zinc/35/63/46/1044356346.db2.gz ZHZMXNJKYOAWKF-KBPBESRZSA-N 1 2 305.381 4.374 20 0 DIADLO CCn1nc(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)c2ccccc21 ZINC000293994938 1044361968 /nfs/dbraw/zinc/36/19/68/1044361968.db2.gz SHDHXCXPTFADFT-LJQANCHMSA-N 1 2 320.440 4.034 20 0 DIADLO CCn1nc(C[N@H+]2CC(C)(C)[C@H]2c2ccncc2)c2ccccc21 ZINC000293994938 1044361978 /nfs/dbraw/zinc/36/19/78/1044361978.db2.gz SHDHXCXPTFADFT-LJQANCHMSA-N 1 2 320.440 4.034 20 0 DIADLO c1ccc(CNc2cccc3c2CN(c2cccc[nH+]2)C3)cc1 ZINC000361168101 1044368565 /nfs/dbraw/zinc/36/85/65/1044368565.db2.gz MVQSZOAIJSXMAT-UHFFFAOYSA-N 1 2 301.393 4.214 20 0 DIADLO CCC[C@H]([NH2+][C@@H]1CCOc2c(F)ccc(F)c21)c1ccccn1 ZINC000361185749 1044372654 /nfs/dbraw/zinc/37/26/54/1044372654.db2.gz HUTAEVDCBZYSFV-JKSUJKDBSA-N 1 2 318.367 4.314 20 0 DIADLO Fc1ccc(F)c2c1OCC[C@H]2[NH2+]Cc1ccsc1Cl ZINC000361252145 1044380101 /nfs/dbraw/zinc/38/01/01/1044380101.db2.gz PSSVOLFCBKZEJQ-LLVKDONJSA-N 1 2 315.772 4.293 20 0 DIADLO Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]Cc2ccn(C(C)C)n2)c1 ZINC000564825768 1044405616 /nfs/dbraw/zinc/40/56/16/1044405616.db2.gz VHTNIYKNNNIOHX-CYBMUJFWSA-N 1 2 323.387 4.225 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@@H+]2CCS[C@@H](c3ccccc3)C2)n1 ZINC000361476912 1044407497 /nfs/dbraw/zinc/40/74/97/1044407497.db2.gz FCAUPMIYBORXAN-UKRRQHHQSA-N 1 2 317.458 4.044 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@H+]2CCS[C@@H](c3ccccc3)C2)n1 ZINC000361476912 1044407499 /nfs/dbraw/zinc/40/74/99/1044407499.db2.gz FCAUPMIYBORXAN-UKRRQHHQSA-N 1 2 317.458 4.044 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@@H+]2CCS[C@H](c3ccccc3)C2)n1 ZINC000361476911 1044408414 /nfs/dbraw/zinc/40/84/14/1044408414.db2.gz FCAUPMIYBORXAN-HIFRSBDPSA-N 1 2 317.458 4.044 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@H+]2CCS[C@H](c3ccccc3)C2)n1 ZINC000361476911 1044408419 /nfs/dbraw/zinc/40/84/19/1044408419.db2.gz FCAUPMIYBORXAN-HIFRSBDPSA-N 1 2 317.458 4.044 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1nccn1-c1ccccc1 ZINC000361494892 1044410354 /nfs/dbraw/zinc/41/03/54/1044410354.db2.gz ARZYZUCUXLYYKX-HNNXBMFYSA-N 1 2 309.388 4.204 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1nccn1-c1ccccc1 ZINC000361494892 1044410358 /nfs/dbraw/zinc/41/03/58/1044410358.db2.gz ARZYZUCUXLYYKX-HNNXBMFYSA-N 1 2 309.388 4.204 20 0 DIADLO Fc1ccc(C[N@H+](Cc2nccn2-c2ccccc2)C2CC2)cc1 ZINC000361508521 1044411930 /nfs/dbraw/zinc/41/19/30/1044411930.db2.gz NAPNFPWUHMEKHI-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2nccn2-c2ccccc2)C2CC2)cc1 ZINC000361508521 1044411934 /nfs/dbraw/zinc/41/19/34/1044411934.db2.gz NAPNFPWUHMEKHI-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nccn2-c2ccccc2)[C@@H]1c1ccccc1 ZINC000361573282 1044420501 /nfs/dbraw/zinc/42/05/01/1044420501.db2.gz YSEPUHBSFFHLLM-UZLBHIALSA-N 1 2 303.409 4.065 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nccn2-c2ccccc2)[C@@H]1c1ccccc1 ZINC000361573282 1044420512 /nfs/dbraw/zinc/42/05/12/1044420512.db2.gz YSEPUHBSFFHLLM-UZLBHIALSA-N 1 2 303.409 4.065 20 0 DIADLO CC(C)COc1ccccc1C[N@@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000361586903 1044422130 /nfs/dbraw/zinc/42/21/30/1044422130.db2.gz NAXIYXULHUHVKM-QGZVFWFLSA-N 1 2 313.445 4.172 20 0 DIADLO CC(C)COc1ccccc1C[N@H+]1CCCC[C@@H]1c1ncc[nH]1 ZINC000361586903 1044422138 /nfs/dbraw/zinc/42/21/38/1044422138.db2.gz NAXIYXULHUHVKM-QGZVFWFLSA-N 1 2 313.445 4.172 20 0 DIADLO CCCc1nc(C[N@H+](C)[C@@H]2CCCc3nc(C)sc32)cs1 ZINC000114722414 1044456877 /nfs/dbraw/zinc/45/68/77/1044456877.db2.gz PLRMNIMZHRLFMI-CQSZACIVSA-N 1 2 321.515 4.370 20 0 DIADLO CCCc1nc(C[N@@H+](C)[C@@H]2CCCc3nc(C)sc32)cs1 ZINC000114722414 1044456881 /nfs/dbraw/zinc/45/68/81/1044456881.db2.gz PLRMNIMZHRLFMI-CQSZACIVSA-N 1 2 321.515 4.370 20 0 DIADLO Cc1ccccc1[C@@H](NC(=O)C[C@H](C)n1cc[nH+]c1)C(C)(C)C ZINC000565894566 1044461297 /nfs/dbraw/zinc/46/12/97/1044461297.db2.gz KALFWOTYGHUFEM-MAUKXSAKSA-N 1 2 313.445 4.046 20 0 DIADLO CC[C@H](CC(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccc(C)cc1 ZINC000523091981 1044461601 /nfs/dbraw/zinc/46/16/01/1044461601.db2.gz IBAXKDHRWVPPQI-MRXNPFEDSA-N 1 2 321.424 4.474 20 0 DIADLO CC(C)(C[NH2+][C@@H](c1cccs1)c1nnc[nH]1)C1CCCCC1 ZINC000294803933 1044462136 /nfs/dbraw/zinc/46/21/36/1044462136.db2.gz PCKMUIDUCQCPCO-HNNXBMFYSA-N 1 2 318.490 4.152 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cccc(O)c2Cl)o1 ZINC000294828705 1044462661 /nfs/dbraw/zinc/46/26/61/1044462661.db2.gz YHJNBOHLMNJQHA-CQSZACIVSA-N 1 2 321.804 4.122 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2cccc(O)c2Cl)o1 ZINC000294828705 1044462670 /nfs/dbraw/zinc/46/26/70/1044462670.db2.gz YHJNBOHLMNJQHA-CQSZACIVSA-N 1 2 321.804 4.122 20 0 DIADLO CSCc1cnc(C[N@H+](C)[C@H](C)c2ccc(F)cc2)s1 ZINC000294891159 1044470089 /nfs/dbraw/zinc/47/00/89/1044470089.db2.gz LQJNQRRKNHCHDY-LLVKDONJSA-N 1 2 310.463 4.338 20 0 DIADLO CSCc1cnc(C[N@@H+](C)[C@H](C)c2ccc(F)cc2)s1 ZINC000294891159 1044470098 /nfs/dbraw/zinc/47/00/98/1044470098.db2.gz LQJNQRRKNHCHDY-LLVKDONJSA-N 1 2 310.463 4.338 20 0 DIADLO CC(C)([NH2+]Cc1cc(C(F)(F)F)ccc1F)c1nccs1 ZINC000116381114 1044471066 /nfs/dbraw/zinc/47/10/66/1044471066.db2.gz AHLFHKLPCVGZPJ-UHFFFAOYSA-N 1 2 318.339 4.326 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)N(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000566149080 1044475670 /nfs/dbraw/zinc/47/56/70/1044475670.db2.gz HKCMPDRWGCSXBD-SCLBCKFNSA-N 1 2 307.372 4.356 20 0 DIADLO Cc1ccc(-c2ccc(C)c(NC(=O)C[C@H](C)n3cc[nH+]c3)c2)o1 ZINC000566304608 1044481447 /nfs/dbraw/zinc/48/14/47/1044481447.db2.gz PMFOOFVZQBKQTK-AWEZNQCLSA-N 1 2 323.396 4.350 20 0 DIADLO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ncn(-c3ccccc3)n2)cc1C ZINC000295047695 1044484212 /nfs/dbraw/zinc/48/42/12/1044484212.db2.gz QAAMGSHTTXIUKR-QGZVFWFLSA-N 1 2 320.440 4.043 20 0 DIADLO c1n[nH]c([C@H]([NH2+]C[C@@H](c2ccccc2)C2CC2)C2CCCCC2)n1 ZINC000566350738 1044484839 /nfs/dbraw/zinc/48/48/39/1044484839.db2.gz ODUIEDHOOIWFSB-RBUKOAKNSA-N 1 2 324.472 4.210 20 0 DIADLO CC(C)Oc1ccc[nH+]c1N[C@@H]1C[C@H]1c1ccc(F)c(F)c1 ZINC001168070191 1044490945 /nfs/dbraw/zinc/49/09/45/1044490945.db2.gz PZNPKXPMRRVIMW-SWLSCSKDSA-N 1 2 304.340 4.115 20 0 DIADLO CCCC(C)(C)C(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC001142036917 1044495717 /nfs/dbraw/zinc/49/57/17/1044495717.db2.gz QMZLMMFWUHSMNV-ZDUSSCGKSA-N 1 2 323.506 4.140 20 0 DIADLO CCCC(C)(C)C(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC001142036917 1044495730 /nfs/dbraw/zinc/49/57/30/1044495730.db2.gz QMZLMMFWUHSMNV-ZDUSSCGKSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](Cc2ccc(C)cc2)c2ccccn2)s1 ZINC000295157769 1044495860 /nfs/dbraw/zinc/49/58/60/1044495860.db2.gz KGGHMLPVPBJUQD-SFHVURJKSA-N 1 2 323.465 4.229 20 0 DIADLO CSc1ccc(C[N@H+](C)Cc2nc(-c3ccccc3)c[nH]2)cc1 ZINC000362314511 1044498929 /nfs/dbraw/zinc/49/89/29/1044498929.db2.gz ZZLQVGOVFSMZOE-UHFFFAOYSA-N 1 2 323.465 4.431 20 0 DIADLO CSc1ccc(C[N@@H+](C)Cc2nc(-c3ccccc3)c[nH]2)cc1 ZINC000362314511 1044498939 /nfs/dbraw/zinc/49/89/39/1044498939.db2.gz ZZLQVGOVFSMZOE-UHFFFAOYSA-N 1 2 323.465 4.431 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H]1CCCCC1(F)F ZINC000295221973 1044503850 /nfs/dbraw/zinc/50/38/50/1044503850.db2.gz VUJKVYCRZKLZEC-CYBMUJFWSA-N 1 2 319.355 4.149 20 0 DIADLO CC[N@H+](Cc1ncc(CSC)s1)Cc1ccc(OC)cc1 ZINC000295277007 1044505400 /nfs/dbraw/zinc/50/54/00/1044505400.db2.gz IDVCRDRFAMCJSI-UHFFFAOYSA-N 1 2 322.499 4.037 20 0 DIADLO CC[N@@H+](Cc1ncc(CSC)s1)Cc1ccc(OC)cc1 ZINC000295277007 1044505413 /nfs/dbraw/zinc/50/54/13/1044505413.db2.gz IDVCRDRFAMCJSI-UHFFFAOYSA-N 1 2 322.499 4.037 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2cn3ccsc3n2)o1 ZINC000362436306 1044509992 /nfs/dbraw/zinc/50/99/92/1044509992.db2.gz ZWXPYRHYPLLPGT-WFASDCNBSA-N 1 2 315.442 4.270 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2cn3ccsc3n2)o1 ZINC000362436306 1044510000 /nfs/dbraw/zinc/51/00/00/1044510000.db2.gz ZWXPYRHYPLLPGT-WFASDCNBSA-N 1 2 315.442 4.270 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1ccc(Cl)cn1)[C@H]2C ZINC000566934326 1044527493 /nfs/dbraw/zinc/52/74/93/1044527493.db2.gz GDVZABWIVYNXNQ-OLZOCXBDSA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1ccc(Cl)cn1)[C@H]2C ZINC000566934326 1044527503 /nfs/dbraw/zinc/52/75/03/1044527503.db2.gz GDVZABWIVYNXNQ-OLZOCXBDSA-N 1 2 316.832 4.251 20 0 DIADLO CC[N@H+](Cc1ncc(CSC)s1)[C@H](C)c1cccc(O)c1 ZINC000295436017 1044527908 /nfs/dbraw/zinc/52/79/08/1044527908.db2.gz UDVGKGNMDIPUIZ-GFCCVEGCSA-N 1 2 322.499 4.295 20 0 DIADLO CC[N@@H+](Cc1ncc(CSC)s1)[C@H](C)c1cccc(O)c1 ZINC000295436017 1044527922 /nfs/dbraw/zinc/52/79/22/1044527922.db2.gz UDVGKGNMDIPUIZ-GFCCVEGCSA-N 1 2 322.499 4.295 20 0 DIADLO Cc1nsc(C)c1C[NH2+][C@@H](c1ccc(C)cc1)c1ccccn1 ZINC000567058751 1044538756 /nfs/dbraw/zinc/53/87/56/1044538756.db2.gz CVUKSSWTIJIIMV-IBGZPJMESA-N 1 2 323.465 4.343 20 0 DIADLO CCCCc1noc(C[N@H+](C)[C@@H](CC)c2cccc(OC)c2)n1 ZINC000567142582 1044545494 /nfs/dbraw/zinc/54/54/94/1044545494.db2.gz WSGVUJUVPUNPNK-INIZCTEOSA-N 1 2 317.433 4.004 20 0 DIADLO CCCCc1noc(C[N@@H+](C)[C@@H](CC)c2cccc(OC)c2)n1 ZINC000567142582 1044545508 /nfs/dbraw/zinc/54/55/08/1044545508.db2.gz WSGVUJUVPUNPNK-INIZCTEOSA-N 1 2 317.433 4.004 20 0 DIADLO Fc1ccc2cc(CNc3ccc(-n4cc[nH+]c4)cc3)[nH]c2c1 ZINC000362924646 1044564236 /nfs/dbraw/zinc/56/42/36/1044564236.db2.gz ZEHKJOZNWOXEJP-UHFFFAOYSA-N 1 2 306.344 4.105 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(F)c(OC)c(C(F)(F)F)c1 ZINC001214635473 1044568680 /nfs/dbraw/zinc/56/86/80/1044568680.db2.gz RHMHUEYDTRJGPB-UHFFFAOYSA-N 1 2 316.254 4.000 20 0 DIADLO FC(F)(F)C[C@H]1CC[N@H+](Cc2ncc(Cl)cc2Cl)C1 ZINC000444700912 1044605168 /nfs/dbraw/zinc/60/51/68/1044605168.db2.gz GOXNYBXFBJNFDK-MRVPVSSYSA-N 1 2 313.150 4.163 20 0 DIADLO FC(F)(F)C[C@H]1CC[N@@H+](Cc2ncc(Cl)cc2Cl)C1 ZINC000444700912 1044605173 /nfs/dbraw/zinc/60/51/73/1044605173.db2.gz GOXNYBXFBJNFDK-MRVPVSSYSA-N 1 2 313.150 4.163 20 0 DIADLO C[N@@H+](Cc1nc(C2CCCCC2)cs1)C[C@H]1CCCCO1 ZINC000444597821 1044577501 /nfs/dbraw/zinc/57/75/01/1044577501.db2.gz QBCGETYYPXPXJX-OAHLLOKOSA-N 1 2 308.491 4.192 20 0 DIADLO C[N@H+](Cc1nc(C2CCCCC2)cs1)C[C@H]1CCCCO1 ZINC000444597821 1044577517 /nfs/dbraw/zinc/57/75/17/1044577517.db2.gz QBCGETYYPXPXJX-OAHLLOKOSA-N 1 2 308.491 4.192 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC(C3CCOCC3)CC2)c1 ZINC000567749186 1044582726 /nfs/dbraw/zinc/58/27/26/1044582726.db2.gz YVGKUVVONJNGPG-UHFFFAOYSA-N 1 2 314.404 4.017 20 0 DIADLO CCn1cc([C@@H](C)[NH2+]Cc2csc(C3CCCCC3)n2)cn1 ZINC000296157459 1044593712 /nfs/dbraw/zinc/59/37/12/1044593712.db2.gz SPKONONEBXAEAD-CYBMUJFWSA-N 1 2 318.490 4.258 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2)c2ccc(F)cc2)c2nccn21 ZINC000296186197 1044596336 /nfs/dbraw/zinc/59/63/36/1044596336.db2.gz YGHOSUYRCUKWGM-NIKGAXFTSA-N 1 2 321.399 4.407 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(-c3cccs3)cc2)s1 ZINC000444670989 1044598900 /nfs/dbraw/zinc/59/89/00/1044598900.db2.gz HINAMADELHEDDA-NSHDSACASA-N 1 2 315.467 4.426 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(-c3cccs3)cc2)s1 ZINC000444670985 1044599077 /nfs/dbraw/zinc/59/90/77/1044599077.db2.gz HINAMADELHEDDA-LLVKDONJSA-N 1 2 315.467 4.426 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@H](C)c2cccc3c2OCO3)on1 ZINC000925158521 1044604042 /nfs/dbraw/zinc/60/40/42/1044604042.db2.gz VABUTVQHEHLCNB-GFCCVEGCSA-N 1 2 316.401 4.158 20 0 DIADLO CCC[C@@H](CC1CCCC1)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000363410915 1044614873 /nfs/dbraw/zinc/61/48/73/1044614873.db2.gz HVJZWKDBJLAPPK-IRXDYDNUSA-N 1 2 317.477 4.112 20 0 DIADLO Cc1occc1C[N@@H+](C)CC(=O)Nc1c(C)cccc1C(C)C ZINC000055053135 1044620151 /nfs/dbraw/zinc/62/01/51/1044620151.db2.gz TUALFFFMMMVGTN-UHFFFAOYSA-N 1 2 314.429 4.090 20 0 DIADLO Cc1occc1C[N@H+](C)CC(=O)Nc1c(C)cccc1C(C)C ZINC000055053135 1044620159 /nfs/dbraw/zinc/62/01/59/1044620159.db2.gz TUALFFFMMMVGTN-UHFFFAOYSA-N 1 2 314.429 4.090 20 0 DIADLO Clc1ccc2cccnc2c1C[NH2+]Cc1cc(C2CC2)no1 ZINC000886270551 1044628479 /nfs/dbraw/zinc/62/84/79/1044628479.db2.gz GUHTVXGRLMIKPN-UHFFFAOYSA-N 1 2 313.788 4.043 20 0 DIADLO Cc1cc(NC(=O)[C@H](C)Sc2ccccc2Cl)cc[nH+]1 ZINC000195655926 1044633258 /nfs/dbraw/zinc/63/32/58/1044633258.db2.gz CPVZOCHDSUAXDF-NSHDSACASA-N 1 2 306.818 4.163 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1ccsc1 ZINC000296609716 1044633599 /nfs/dbraw/zinc/63/35/99/1044633599.db2.gz YKIQMQTVUZKNEO-OAHLLOKOSA-N 1 2 308.447 4.292 20 0 DIADLO Cc1cc(C)c2cc(NCc3cn(C)nc3C(F)F)ccc2[nH+]1 ZINC000886369343 1044636723 /nfs/dbraw/zinc/63/67/23/1044636723.db2.gz CPOIXZQFDWQROY-UHFFFAOYSA-N 1 2 316.355 4.135 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]C(c2cccs2)c2cccs2)c2nccn21 ZINC000296760080 1044646428 /nfs/dbraw/zinc/64/64/28/1044646428.db2.gz KCCALCZFILEECS-NEPJUHHUSA-N 1 2 315.467 4.391 20 0 DIADLO C[C@@H](c1ccc2ccccc2c1)[N@H+](Cc1cnns1)C1CC1 ZINC000296940060 1044652638 /nfs/dbraw/zinc/65/26/38/1044652638.db2.gz BOPWICAYVMKYLE-ZDUSSCGKSA-N 1 2 309.438 4.417 20 0 DIADLO C[C@@H](c1ccc2ccccc2c1)[N@@H+](Cc1cnns1)C1CC1 ZINC000296940060 1044652645 /nfs/dbraw/zinc/65/26/45/1044652645.db2.gz BOPWICAYVMKYLE-ZDUSSCGKSA-N 1 2 309.438 4.417 20 0 DIADLO CCCCCn1cc(C[NH2+]Cc2csc(C3CC3)n2)c(C)n1 ZINC000348390848 1044659278 /nfs/dbraw/zinc/65/92/78/1044659278.db2.gz LYXWFQBZERAENI-UHFFFAOYSA-N 1 2 318.490 4.005 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccn(C(C)C)n1)c1cc(Cl)ccc1OC ZINC000568944212 1044663333 /nfs/dbraw/zinc/66/33/33/1044663333.db2.gz NJQOHJPNIZBVQW-MRXNPFEDSA-N 1 2 321.852 4.367 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccc(-c3ccc(F)cc3)o2)c[nH+]1 ZINC001275909806 1044666316 /nfs/dbraw/zinc/66/63/16/1044666316.db2.gz ARYICTUNTXXNDU-UHFFFAOYSA-N 1 2 324.355 4.028 20 0 DIADLO CCCCCN(C(=O)[C@@H]1CCc2[nH+]c(C(C)C)[nH]c2C1)C(C)C ZINC000364545900 1044668160 /nfs/dbraw/zinc/66/81/60/1044668160.db2.gz XTAHYTZEFHAAEK-OAHLLOKOSA-N 1 2 319.493 4.065 20 0 DIADLO CCCCCN(C(=O)[C@@H]1CCc2[nH]c(C(C)C)[nH+]c2C1)C(C)C ZINC000364545900 1044668166 /nfs/dbraw/zinc/66/81/66/1044668166.db2.gz XTAHYTZEFHAAEK-OAHLLOKOSA-N 1 2 319.493 4.065 20 0 DIADLO C/C(=C/c1ccc(Cl)cc1)C(=O)NCc1c[nH+]c(C)cc1C ZINC001275917176 1044669175 /nfs/dbraw/zinc/66/91/75/1044669175.db2.gz HLMWHAIFIIHGPJ-LCYFTJDESA-N 1 2 314.816 4.072 20 0 DIADLO COc1cc(Cl)ccc1[C@@H](C)[NH2+]Cc1cc(C2CC2)no1 ZINC000886684964 1044679026 /nfs/dbraw/zinc/67/90/26/1044679026.db2.gz XGIANRPSOWOHBP-SNVBAGLBSA-N 1 2 306.793 4.065 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(C(C)(C)C)on1 ZINC000569173109 1044680781 /nfs/dbraw/zinc/68/07/81/1044680781.db2.gz HBHGOWQCOSGTLA-MRXNPFEDSA-N 1 2 314.429 4.318 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1cc(C(C)(C)C)on1 ZINC000569173109 1044680784 /nfs/dbraw/zinc/68/07/84/1044680784.db2.gz HBHGOWQCOSGTLA-MRXNPFEDSA-N 1 2 314.429 4.318 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)Cc1nccn1C(F)F ZINC000076191578 1044691759 /nfs/dbraw/zinc/69/17/59/1044691759.db2.gz MGUQEHIIPAEOEO-UHFFFAOYSA-N 1 2 319.355 4.219 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)Cc1nccn1C(F)F ZINC000076191578 1044691764 /nfs/dbraw/zinc/69/17/64/1044691764.db2.gz MGUQEHIIPAEOEO-UHFFFAOYSA-N 1 2 319.355 4.219 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000365457868 1044692703 /nfs/dbraw/zinc/69/27/03/1044692703.db2.gz IIFKMWLWKZYNKO-IRXDYDNUSA-N 1 2 319.493 4.123 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cnc(Cl)s2)c1 ZINC000078670208 1044710920 /nfs/dbraw/zinc/71/09/20/1044710920.db2.gz FBVXWDBCFRAUQN-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2cnc(Cl)s2)c1 ZINC000078670208 1044710933 /nfs/dbraw/zinc/71/09/33/1044710933.db2.gz FBVXWDBCFRAUQN-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1conc1C[NH2+][C@H](C)c1cccc(SC(F)(F)F)c1 ZINC000886932457 1044721062 /nfs/dbraw/zinc/72/10/62/1044721062.db2.gz AQXMBZUDUWHTBQ-SNVBAGLBSA-N 1 2 316.348 4.446 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](c2cccs2)C2CC2)c(C)[nH+]1 ZINC000570019919 1044726353 /nfs/dbraw/zinc/72/63/53/1044726353.db2.gz VCCWCOOVCGCPJB-MRXNPFEDSA-N 1 2 315.442 4.341 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)[C@@H](C)CO1 ZINC000570149267 1044734672 /nfs/dbraw/zinc/73/46/72/1044734672.db2.gz WXOMVNXSPZJGRH-NWDGAFQWSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)[C@@H](C)CO1 ZINC000570149267 1044734690 /nfs/dbraw/zinc/73/46/90/1044734690.db2.gz WXOMVNXSPZJGRH-NWDGAFQWSA-N 1 2 322.861 4.073 20 0 DIADLO CC1(C)Cc2cccc(C[NH2+]Cc3c(F)cccc3Cl)c2O1 ZINC000524114603 1044741721 /nfs/dbraw/zinc/74/17/21/1044741721.db2.gz BZDRVLJCEPMGFK-UHFFFAOYSA-N 1 2 319.807 4.482 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc(F)c2ccccc21 ZINC000367492039 1044743836 /nfs/dbraw/zinc/74/38/36/1044743836.db2.gz XVFUIPHBCDUNCH-XIKOKIGWSA-N 1 2 309.388 4.430 20 0 DIADLO c1csc([C@@H](Cc2ccccc2)[NH2+][C@H]2CCCc3[nH]ncc32)c1 ZINC000367597817 1044748080 /nfs/dbraw/zinc/74/80/80/1044748080.db2.gz CELMIZKWESJUQB-FUHWJXTLSA-N 1 2 323.465 4.422 20 0 DIADLO c1csc([C@H](Cc2ccccc2)[NH2+][C@H]2CCCc3[nH]ncc32)c1 ZINC000367597819 1044748603 /nfs/dbraw/zinc/74/86/03/1044748603.db2.gz CELMIZKWESJUQB-WMZOPIPTSA-N 1 2 323.465 4.422 20 0 DIADLO Cc1nnc(C[N@@H+]2CCCCC[C@@H]2/C=C/c2cccs2)s1 ZINC000367791025 1044752762 /nfs/dbraw/zinc/75/27/62/1044752762.db2.gz CAUFMTJETLGEGQ-MYSGNRETSA-N 1 2 319.499 4.366 20 0 DIADLO Cc1nnc(C[N@H+]2CCCCC[C@@H]2/C=C/c2cccs2)s1 ZINC000367791025 1044752777 /nfs/dbraw/zinc/75/27/77/1044752777.db2.gz CAUFMTJETLGEGQ-MYSGNRETSA-N 1 2 319.499 4.366 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1CSc1nc2ccccc2[nH]1 ZINC000445601335 1044767809 /nfs/dbraw/zinc/76/78/09/1044767809.db2.gz QFWFTVAMEJIQRC-UHFFFAOYSA-N 1 2 320.421 4.100 20 0 DIADLO CCc1cnc(C[N@H+](C)CCOc2ccccc2C(C)(C)C)o1 ZINC000570619055 1044769873 /nfs/dbraw/zinc/76/98/73/1044769873.db2.gz IQPUKDVWIHJYOG-UHFFFAOYSA-N 1 2 316.445 4.045 20 0 DIADLO CCc1cnc(C[N@@H+](C)CCOc2ccccc2C(C)(C)C)o1 ZINC000570619055 1044769887 /nfs/dbraw/zinc/76/98/87/1044769887.db2.gz IQPUKDVWIHJYOG-UHFFFAOYSA-N 1 2 316.445 4.045 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1CSc1nc2ccccc2o1 ZINC000445598728 1044771586 /nfs/dbraw/zinc/77/15/86/1044771586.db2.gz BKOURZMMLGMKSE-UHFFFAOYSA-N 1 2 321.405 4.365 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1cccc(Cl)c1Cl ZINC000368423177 1044774841 /nfs/dbraw/zinc/77/48/41/1044774841.db2.gz BJIBXELQNODDNY-RNCFNFMXSA-N 1 2 310.228 4.445 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1Cl ZINC000368423177 1044774854 /nfs/dbraw/zinc/77/48/54/1044774854.db2.gz BJIBXELQNODDNY-RNCFNFMXSA-N 1 2 310.228 4.445 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000570838906 1044786255 /nfs/dbraw/zinc/78/62/55/1044786255.db2.gz FYWWUSNVSXZFOU-HUUCEWRRSA-N 1 2 312.413 4.046 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000570838906 1044786267 /nfs/dbraw/zinc/78/62/67/1044786267.db2.gz FYWWUSNVSXZFOU-HUUCEWRRSA-N 1 2 312.413 4.046 20 0 DIADLO Brc1cc(C[N@H+](Cc2ccccn2)C2CC2)cs1 ZINC000125144056 1044798820 /nfs/dbraw/zinc/79/88/20/1044798820.db2.gz RKHORMCGTWZELK-UHFFFAOYSA-N 1 2 323.259 4.070 20 0 DIADLO Brc1cc(C[N@@H+](Cc2ccccn2)C2CC2)cs1 ZINC000125144056 1044798832 /nfs/dbraw/zinc/79/88/32/1044798832.db2.gz RKHORMCGTWZELK-UHFFFAOYSA-N 1 2 323.259 4.070 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2cc(Cl)ccc2OC(F)F)on1 ZINC000125658083 1044805357 /nfs/dbraw/zinc/80/53/57/1044805357.db2.gz ZDZLMFMGGYSWRB-SECBINFHSA-N 1 2 316.735 4.089 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1nc(C)cs1 ZINC000126224641 1044810670 /nfs/dbraw/zinc/81/06/70/1044810670.db2.gz NAQALXVDKRQIQC-NSHDSACASA-N 1 2 310.850 4.354 20 0 DIADLO CCC[N@H+](Cc1cnoc1C)Cc1ccccc1Br ZINC000445799725 1044818631 /nfs/dbraw/zinc/81/86/31/1044818631.db2.gz QASKFIHMFMHAER-UHFFFAOYSA-N 1 2 323.234 4.158 20 0 DIADLO CCC[N@@H+](Cc1cnoc1C)Cc1ccccc1Br ZINC000445799725 1044818650 /nfs/dbraw/zinc/81/86/50/1044818650.db2.gz QASKFIHMFMHAER-UHFFFAOYSA-N 1 2 323.234 4.158 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)o1 ZINC000263952578 1044837096 /nfs/dbraw/zinc/83/70/96/1044837096.db2.gz KBUKMIWNNVFBPR-OAHLLOKOSA-N 1 2 307.825 4.333 20 0 DIADLO C[N@H+](Cc1cc(Cl)cc(Cl)c1)Cc1ccc(Cl)nn1 ZINC001142078922 1044849189 /nfs/dbraw/zinc/84/91/89/1044849189.db2.gz YEUCKTAZJOMRIU-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO C[N@@H+](Cc1cc(Cl)cc(Cl)c1)Cc1ccc(Cl)nn1 ZINC001142078922 1044849211 /nfs/dbraw/zinc/84/92/11/1044849211.db2.gz YEUCKTAZJOMRIU-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO CCc1cccc(C[NH2+][C@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000572904387 1044882480 /nfs/dbraw/zinc/88/24/80/1044882480.db2.gz FPYKEQRTOLAJOL-CQSZACIVSA-N 1 2 307.397 4.150 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc2c(n1)CCC2)c1nc(C(C)(C)C)cs1 ZINC000572961808 1044886971 /nfs/dbraw/zinc/88/69/71/1044886971.db2.gz HKYPLCFVNCYYIP-GFCCVEGCSA-N 1 2 315.486 4.175 20 0 DIADLO C[N@H+](Cc1c(F)cccc1Cl)[C@H](CCO)c1ccccc1 ZINC000524757670 1044917939 /nfs/dbraw/zinc/91/79/39/1044917939.db2.gz ZPBRUWXSQCJGPT-QGZVFWFLSA-N 1 2 307.796 4.035 20 0 DIADLO C[N@@H+](Cc1c(F)cccc1Cl)[C@H](CCO)c1ccccc1 ZINC000524757670 1044917948 /nfs/dbraw/zinc/91/79/48/1044917948.db2.gz ZPBRUWXSQCJGPT-QGZVFWFLSA-N 1 2 307.796 4.035 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+]Cc3ccc(-c4ccccc4)o3)nc2c1 ZINC000524773542 1044920422 /nfs/dbraw/zinc/92/04/22/1044920422.db2.gz WLPBXYMBFVNKPA-UHFFFAOYSA-N 1 2 317.392 4.421 20 0 DIADLO Cc1ccc2nc(C[NH2+]Cc3ccc(-c4ccccc4)o3)[nH]c2c1 ZINC000524773542 1044920433 /nfs/dbraw/zinc/92/04/33/1044920433.db2.gz WLPBXYMBFVNKPA-UHFFFAOYSA-N 1 2 317.392 4.421 20 0 DIADLO CC(C)(C)c1cc(C[NH+]2CCC(CC(F)(F)F)CC2)no1 ZINC000573765651 1044922950 /nfs/dbraw/zinc/92/29/50/1044922950.db2.gz IOPNXXYUDSKGIH-UHFFFAOYSA-N 1 2 304.356 4.137 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000373063176 1044938186 /nfs/dbraw/zinc/93/81/86/1044938186.db2.gz KHTNPESGROYAEG-LPHOPBHVSA-N 1 2 319.493 4.123 20 0 DIADLO C[C@@H]([NH2+]Cc1ncoc1-c1ccccc1)c1cccc(F)c1F ZINC000373181344 1044948999 /nfs/dbraw/zinc/94/89/99/1044948999.db2.gz ZZCLKQDJJQQVRO-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3cc(C(C)C)c(O)cc3C)ccn12 ZINC000574336919 1044951097 /nfs/dbraw/zinc/95/10/97/1044951097.db2.gz MFDGQLATCQTTAO-UHFFFAOYSA-N 1 2 323.396 4.032 20 0 DIADLO Cc1ccccc1[C@H](c1noc(C[C@@H](C)n2cc[nH+]c2)n1)C(C)C ZINC000574457931 1044955582 /nfs/dbraw/zinc/95/55/82/1044955582.db2.gz SJZJROAFPSDLCW-CRAIPNDOSA-N 1 2 324.428 4.166 20 0 DIADLO CCc1cc(C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)on1 ZINC000524945461 1044955998 /nfs/dbraw/zinc/95/59/98/1044955998.db2.gz XGWLZGABDLLNEO-UHFFFAOYSA-N 1 2 314.360 4.234 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3cccnc3-c3ccccc3)n2c1 ZINC000574685239 1044966733 /nfs/dbraw/zinc/96/67/33/1044966733.db2.gz UEMXDHGHUQFOFR-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO CCC[N@H+](Cc1ccc(F)cc1)[C@@H](C)c1nc(C(C)C)no1 ZINC000411204872 1044983152 /nfs/dbraw/zinc/98/31/52/1044983152.db2.gz YHRWYGQWDAOSRD-ZDUSSCGKSA-N 1 2 305.397 4.305 20 0 DIADLO CCC[N@@H+](Cc1ccc(F)cc1)[C@@H](C)c1nc(C(C)C)no1 ZINC000411204872 1044983169 /nfs/dbraw/zinc/98/31/69/1044983169.db2.gz YHRWYGQWDAOSRD-ZDUSSCGKSA-N 1 2 305.397 4.305 20 0 DIADLO CCC[N@H+](Cc1ccc(F)cc1)[C@H](C)c1nc(C(C)C)no1 ZINC000411204871 1044984828 /nfs/dbraw/zinc/98/48/28/1044984828.db2.gz YHRWYGQWDAOSRD-CYBMUJFWSA-N 1 2 305.397 4.305 20 0 DIADLO CCC[N@@H+](Cc1ccc(F)cc1)[C@H](C)c1nc(C(C)C)no1 ZINC000411204871 1044984846 /nfs/dbraw/zinc/98/48/46/1044984846.db2.gz YHRWYGQWDAOSRD-CYBMUJFWSA-N 1 2 305.397 4.305 20 0 DIADLO Cc1cnc(C[N@H+](Cc2cccc(-c3cccnc3)c2)C2CC2)o1 ZINC000136108839 1044986627 /nfs/dbraw/zinc/98/66/27/1044986627.db2.gz FBXXEEYRUPGYKQ-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2cccc(-c3cccnc3)c2)C2CC2)o1 ZINC000136108839 1044986640 /nfs/dbraw/zinc/98/66/40/1044986640.db2.gz FBXXEEYRUPGYKQ-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO C/C=C\c1ccc(NC(=O)[C@@H]2CCc3[nH+]c(C(C)C)[nH]c3C2)cc1 ZINC000575210093 1044991361 /nfs/dbraw/zinc/99/13/61/1044991361.db2.gz UZJOFRHYYPIJQW-FOSCPCJNSA-N 1 2 323.440 4.310 20 0 DIADLO CC=Cc1ccc(NC(=O)[C@@H]2CCc3[nH]c(C(C)C)[nH+]c3C2)cc1 ZINC000575210093 1044991370 /nfs/dbraw/zinc/99/13/70/1044991370.db2.gz UZJOFRHYYPIJQW-FOSCPCJNSA-N 1 2 323.440 4.310 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1csc(-c2ccco2)n1 ZINC000114721677 1044999241 /nfs/dbraw/zinc/99/92/41/1044999241.db2.gz FCPMDTPQEOGDIZ-LBPRGKRZSA-N 1 2 314.410 4.302 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1csc(-c2ccco2)n1 ZINC000114721677 1044999256 /nfs/dbraw/zinc/99/92/56/1044999256.db2.gz FCPMDTPQEOGDIZ-LBPRGKRZSA-N 1 2 314.410 4.302 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C1(c2ccccc2)CC1 ZINC000373691887 1045002359 /nfs/dbraw/zinc/00/23/59/1045002359.db2.gz BLHCLFRWPIQBFN-UHFFFAOYSA-N 1 2 317.392 4.055 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2ccc(-c3ncco3)cc2F)n1 ZINC000411519451 1045016894 /nfs/dbraw/zinc/01/68/94/1045016894.db2.gz MQBBUUOFHPXCTC-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1ccoc1C1CC1 ZINC000374109226 1045029717 /nfs/dbraw/zinc/02/97/17/1045029717.db2.gz RGDIQXDBPTVCRE-UHFFFAOYSA-N 1 2 307.353 4.108 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](C[C@@H]1CCC3(CCCCC3)O1)C2 ZINC000411934043 1045037650 /nfs/dbraw/zinc/03/76/50/1045037650.db2.gz DKCSDAPSHIWDMM-IBGZPJMESA-N 1 2 313.441 4.087 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](C[C@@H]1CCC3(CCCCC3)O1)C2 ZINC000411934043 1045037663 /nfs/dbraw/zinc/03/76/63/1045037663.db2.gz DKCSDAPSHIWDMM-IBGZPJMESA-N 1 2 313.441 4.087 20 0 DIADLO CC[N@H+](Cc1coc(-c2ccc(F)cc2)n1)Cc1occc1C ZINC000412036826 1045048398 /nfs/dbraw/zinc/04/83/98/1045048398.db2.gz HVUFWTXCPYBTOR-UHFFFAOYSA-N 1 2 314.360 4.404 20 0 DIADLO CC[N@@H+](Cc1coc(-c2ccc(F)cc2)n1)Cc1occc1C ZINC000412036826 1045048410 /nfs/dbraw/zinc/04/84/10/1045048410.db2.gz HVUFWTXCPYBTOR-UHFFFAOYSA-N 1 2 314.360 4.404 20 0 DIADLO CC[N@H+](CC(=O)Nc1sc(C)c(C)c1C)Cc1occc1C ZINC000412026047 1045048602 /nfs/dbraw/zinc/04/86/02/1045048602.db2.gz KRYFAFTUXNWKFG-UHFFFAOYSA-N 1 2 320.458 4.035 20 0 DIADLO CC[N@@H+](CC(=O)Nc1sc(C)c(C)c1C)Cc1occc1C ZINC000412026047 1045048615 /nfs/dbraw/zinc/04/86/15/1045048615.db2.gz KRYFAFTUXNWKFG-UHFFFAOYSA-N 1 2 320.458 4.035 20 0 DIADLO Clc1sc(C[NH+]2C3CCC2CC3)cc1Br ZINC000576327018 1045052967 /nfs/dbraw/zinc/05/29/67/1045052967.db2.gz AEZTWQLYRNSFFM-UHFFFAOYSA-N 1 2 306.656 4.291 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2)N(c2cc(N3CCCCC3)[nH+]cn2)C1 ZINC000576538500 1045064346 /nfs/dbraw/zinc/06/43/46/1045064346.db2.gz JRTNLJVXQHOBJZ-FUHWJXTLSA-N 1 2 322.456 4.054 20 0 DIADLO C[C@H]1C[C@H](c2ccccc2)N(c2cc(N3CCCCC3)nc[nH+]2)C1 ZINC000576538500 1045064354 /nfs/dbraw/zinc/06/43/54/1045064354.db2.gz JRTNLJVXQHOBJZ-FUHWJXTLSA-N 1 2 322.456 4.054 20 0 DIADLO CC(C)[C@@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC000576587424 1045066066 /nfs/dbraw/zinc/06/60/66/1045066066.db2.gz JDXBLYIFQVLTJR-CXAGYDPISA-N 1 2 319.836 4.001 20 0 DIADLO C[N@@H+](Cc1cc[nH]n1)Cc1ccc(-c2ccc(Cl)cc2)s1 ZINC000576724943 1045076033 /nfs/dbraw/zinc/07/60/33/1045076033.db2.gz PXMYXUYRYVJKII-UHFFFAOYSA-N 1 2 317.845 4.424 20 0 DIADLO C[N@H+](Cc1cc[nH]n1)Cc1ccc(-c2ccc(Cl)cc2)s1 ZINC000576724943 1045076039 /nfs/dbraw/zinc/07/60/39/1045076039.db2.gz PXMYXUYRYVJKII-UHFFFAOYSA-N 1 2 317.845 4.424 20 0 DIADLO CCC(C)(CC)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000680998444 1045082401 /nfs/dbraw/zinc/08/24/01/1045082401.db2.gz HWDFTRYBFIOJMW-UHFFFAOYSA-N 1 2 305.809 4.291 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](C)Cc2cc(C(C)(C)C)n[nH]2)o1 ZINC000447077741 1045093678 /nfs/dbraw/zinc/09/36/78/1045093678.db2.gz MEXVHELYOUAVHO-WFASDCNBSA-N 1 2 301.434 4.056 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2cc(C(C)(C)C)n[nH]2)o1 ZINC000447077741 1045093694 /nfs/dbraw/zinc/09/36/94/1045093694.db2.gz MEXVHELYOUAVHO-WFASDCNBSA-N 1 2 301.434 4.056 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2ccc(C)cc2OC)[nH]1 ZINC000577129239 1045102311 /nfs/dbraw/zinc/10/23/11/1045102311.db2.gz BXTQUPUJJWJGAL-MJBXVCDLSA-N 1 2 316.449 4.047 20 0 DIADLO CCCCc1nc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)cs1 ZINC000525637905 1045103522 /nfs/dbraw/zinc/10/35/22/1045103522.db2.gz KCPGVCAODYNLDI-AWEZNQCLSA-N 1 2 300.471 4.433 20 0 DIADLO CCCCc1nc(C[N@H+]2Cc3ccccc3C[C@@H]2C)cs1 ZINC000525637905 1045103529 /nfs/dbraw/zinc/10/35/29/1045103529.db2.gz KCPGVCAODYNLDI-AWEZNQCLSA-N 1 2 300.471 4.433 20 0 DIADLO COC(=O)c1sccc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000447375486 1045124222 /nfs/dbraw/zinc/12/42/22/1045124222.db2.gz QNWWACLJQVJZOM-OAHLLOKOSA-N 1 2 319.401 4.011 20 0 DIADLO COC(=O)c1sccc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000447375486 1045124229 /nfs/dbraw/zinc/12/42/29/1045124229.db2.gz QNWWACLJQVJZOM-OAHLLOKOSA-N 1 2 319.401 4.011 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](Cc1cncn1Cc1ccccc1)C1CC1 ZINC000525832985 1045126879 /nfs/dbraw/zinc/12/68/79/1045126879.db2.gz VQIJOPXZJRPGMY-INIZCTEOSA-N 1 2 321.424 4.250 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](Cc1cncn1Cc1ccccc1)C1CC1 ZINC000525832985 1045126883 /nfs/dbraw/zinc/12/68/83/1045126883.db2.gz VQIJOPXZJRPGMY-INIZCTEOSA-N 1 2 321.424 4.250 20 0 DIADLO CCSc1nn(C[N@@H+]2CC[C@@H]3CCCC[C@@H]32)c(=S)s1 ZINC000159342231 1045141263 /nfs/dbraw/zinc/14/12/63/1045141263.db2.gz JVHWLMACOTZVPE-QWRGUYRKSA-N 1 2 315.533 4.008 20 0 DIADLO CCSc1nn(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)c(=S)s1 ZINC000159342231 1045141271 /nfs/dbraw/zinc/14/12/71/1045141271.db2.gz JVHWLMACOTZVPE-QWRGUYRKSA-N 1 2 315.533 4.008 20 0 DIADLO Cc1ccccc1[C@@H](C)c1noc([C@H](CC(C)C)n2cc[nH+]c2)n1 ZINC000923955728 1045143505 /nfs/dbraw/zinc/14/35/05/1045143505.db2.gz INLHLTAZMJZBGS-WBVHZDCISA-N 1 2 324.428 4.362 20 0 DIADLO Cc1cc(F)cc(-c2noc([C@H](CC(C)C)n3cc[nH+]c3)n2)c1 ZINC000923815958 1045144749 /nfs/dbraw/zinc/14/47/49/1045144749.db2.gz XLPUZIXNFFFQIX-HNNXBMFYSA-N 1 2 314.364 4.016 20 0 DIADLO FC1(C[N@@H+]2CCC[C@@H]2c2ccc(Br)s2)CC1 ZINC000525992064 1045145453 /nfs/dbraw/zinc/14/54/53/1045145453.db2.gz HMSFDHVZQHYOOA-SECBINFHSA-N 1 2 304.228 4.150 20 0 DIADLO FC1(C[N@H+]2CCC[C@@H]2c2ccc(Br)s2)CC1 ZINC000525992064 1045145457 /nfs/dbraw/zinc/14/54/57/1045145457.db2.gz HMSFDHVZQHYOOA-SECBINFHSA-N 1 2 304.228 4.150 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1cnc(Cl)c(C)c1 ZINC000777505245 1045159303 /nfs/dbraw/zinc/15/93/03/1045159303.db2.gz OPSAFIWKLDKNCL-UHFFFAOYSA-N 1 2 314.820 4.415 20 0 DIADLO Fc1ccccc1-c1cnc(C[NH2+][C@@H](c2cccnc2)C2CC2)o1 ZINC000526083119 1045166008 /nfs/dbraw/zinc/16/60/08/1045166008.db2.gz VFNRQGKYOPTRDP-LJQANCHMSA-N 1 2 323.371 4.117 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1cnc(C(F)(F)F)s1 ZINC000447736591 1045172378 /nfs/dbraw/zinc/17/23/78/1045172378.db2.gz NSHGUEACFBRRHE-MRVPVSSYSA-N 1 2 306.378 4.416 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1cnc(C(F)(F)F)s1 ZINC000447736591 1045172385 /nfs/dbraw/zinc/17/23/85/1045172385.db2.gz NSHGUEACFBRRHE-MRVPVSSYSA-N 1 2 306.378 4.416 20 0 DIADLO CCn1nc(C)c([C@@H](C)[NH2+]C(c2ccccc2)c2ccccc2)n1 ZINC000924526437 1045174129 /nfs/dbraw/zinc/17/41/29/1045174129.db2.gz DUSWOBDXBQVXLB-OAHLLOKOSA-N 1 2 320.440 4.047 20 0 DIADLO CC(C)[N@H+](Cc1ccco1)Cc1cnc(C(F)(F)F)s1 ZINC000447793220 1045177976 /nfs/dbraw/zinc/17/79/76/1045177976.db2.gz AVLGGYXNUJEPKE-UHFFFAOYSA-N 1 2 304.337 4.166 20 0 DIADLO CC(C)[N@@H+](Cc1ccco1)Cc1cnc(C(F)(F)F)s1 ZINC000447793220 1045177978 /nfs/dbraw/zinc/17/79/78/1045177978.db2.gz AVLGGYXNUJEPKE-UHFFFAOYSA-N 1 2 304.337 4.166 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@@H](C)c1ccccc1OC(F)F ZINC000924603045 1045181804 /nfs/dbraw/zinc/18/18/04/1045181804.db2.gz ZRLFBEHZZRYSDE-GWCFXTLKSA-N 1 2 322.355 4.313 20 0 DIADLO CC(C)(C)[C@H]1C[N@H+](Cc2nc(-c3ccccc3)cs2)CCO1 ZINC000447836565 1045182876 /nfs/dbraw/zinc/18/28/76/1045182876.db2.gz QQSBFXABPUEHFB-MRXNPFEDSA-N 1 2 316.470 4.057 20 0 DIADLO CC(C)(C)[C@H]1C[N@@H+](Cc2nc(-c3ccccc3)cs2)CCO1 ZINC000447836565 1045182879 /nfs/dbraw/zinc/18/28/79/1045182879.db2.gz QQSBFXABPUEHFB-MRXNPFEDSA-N 1 2 316.470 4.057 20 0 DIADLO Cc1csc(C[NH2+][C@@H](Cc2ccccc2C)c2ccco2)n1 ZINC000924614316 1045183360 /nfs/dbraw/zinc/18/33/60/1045183360.db2.gz JETZIFJCXZMEDB-INIZCTEOSA-N 1 2 312.438 4.427 20 0 DIADLO CC(C)(C)c1ncc(C[NH2+]Cc2c(Cl)cccc2Cl)cn1 ZINC000577896157 1045186252 /nfs/dbraw/zinc/18/62/52/1045186252.db2.gz QQZVYYWGBRNWSB-UHFFFAOYSA-N 1 2 324.255 4.371 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@@H](C)c1ccccc1OC(C)C ZINC000924692130 1045189109 /nfs/dbraw/zinc/18/91/09/1045189109.db2.gz LBJRJFVJGZIPAP-XJKSGUPXSA-N 1 2 314.429 4.498 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)c(Cl)c2)nn1 ZINC000924768300 1045196200 /nfs/dbraw/zinc/19/62/00/1045196200.db2.gz FAXNTDRBPDQNRL-WDEREUQCSA-N 1 2 310.804 4.063 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+][C@@H](C)c2ccc(F)c(Cl)c2)nn1 ZINC000924768298 1045197050 /nfs/dbraw/zinc/19/70/50/1045197050.db2.gz FAXNTDRBPDQNRL-QWRGUYRKSA-N 1 2 310.804 4.063 20 0 DIADLO c1cc2cccc(NCc3c[nH+]cn3Cc3ccccc3)c2[nH]1 ZINC000527112581 1045198051 /nfs/dbraw/zinc/19/80/51/1045198051.db2.gz IDDPKJIZVWTZQK-UHFFFAOYSA-N 1 2 302.381 4.025 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2c(C)noc2C)c2cccnc2)cc1 ZINC000924782691 1045198477 /nfs/dbraw/zinc/19/84/77/1045198477.db2.gz QXRIMAAWDLRDOZ-FQEVSTJZSA-N 1 2 321.424 4.128 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)on1 ZINC000924859534 1045205490 /nfs/dbraw/zinc/20/54/90/1045205490.db2.gz UEKGDNDYVFXLAL-IUCAKERBSA-N 1 2 315.200 4.402 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1cccc(Cl)c1Cl ZINC000924859434 1045206433 /nfs/dbraw/zinc/20/64/33/1045206433.db2.gz VUZJXDOBNNJLDO-GFCCVEGCSA-N 1 2 311.212 4.457 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@@H](C)c1ccc(OCCC(C)C)cc1 ZINC000924889467 1045207916 /nfs/dbraw/zinc/20/79/16/1045207916.db2.gz MHDFZWFLFSCIPZ-KBPBESRZSA-N 1 2 317.433 4.215 20 0 DIADLO CCCc1ccc([C@H]([NH2+][C@@H](C)c2noc(C)n2)C(C)C)cc1 ZINC000578101772 1045208119 /nfs/dbraw/zinc/20/81/19/1045208119.db2.gz YJKDULMRKUGNEJ-SUMWQHHRSA-N 1 2 301.434 4.378 20 0 DIADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1cnn(C2CCC2)c1 ZINC000924897263 1045209554 /nfs/dbraw/zinc/20/95/54/1045209554.db2.gz GLNCAHIKGDRYLR-AWEZNQCLSA-N 1 2 322.412 4.114 20 0 DIADLO C[C@@H]1N(c2cc[nH+]c3c(Cl)cccc23)CCC12CCOCC2 ZINC000557634138 1045211100 /nfs/dbraw/zinc/21/11/00/1045211100.db2.gz VCMIECRNUMZHTB-ZDUSSCGKSA-N 1 2 316.832 4.284 20 0 DIADLO Cc1oncc1C[N@H+]1CCC[C@H]1c1nc2ccccc2n1C(C)C ZINC000527324630 1045215691 /nfs/dbraw/zinc/21/56/91/1045215691.db2.gz ZGAOVPBIJFWPSZ-SFHVURJKSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1oncc1C[N@@H+]1CCC[C@H]1c1nc2ccccc2n1C(C)C ZINC000527324630 1045215705 /nfs/dbraw/zinc/21/57/05/1045215705.db2.gz ZGAOVPBIJFWPSZ-SFHVURJKSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1ccccc1C[C@H]([NH2+]Cc1ccn(C(C)C)n1)c1ccco1 ZINC000925106287 1045227341 /nfs/dbraw/zinc/22/73/41/1045227341.db2.gz NBLZYCAASLRKJV-IBGZPJMESA-N 1 2 323.440 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2CCc3c2cccc3C)c(C)[nH+]1 ZINC000578296798 1045229203 /nfs/dbraw/zinc/22/92/03/1045229203.db2.gz XOJTYRIEUFGVGR-KRWDZBQOSA-N 1 2 309.413 4.124 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+]Cc1ccc2c(n1)CCC2 ZINC000578299974 1045230777 /nfs/dbraw/zinc/23/07/77/1045230777.db2.gz DYRMSLXSBQSANO-UHFFFAOYSA-N 1 2 307.224 4.167 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2ncc(C(C)(C)C)s2)C1 ZINC000448336303 1045233893 /nfs/dbraw/zinc/23/38/93/1045233893.db2.gz BPQDQBSADWNAHS-UKRRQHHQSA-N 1 2 315.486 4.419 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ncc(C(C)(C)C)s2)C1 ZINC000448336303 1045233903 /nfs/dbraw/zinc/23/39/03/1045233903.db2.gz BPQDQBSADWNAHS-UKRRQHHQSA-N 1 2 315.486 4.419 20 0 DIADLO Cc1noc(C)c1C[N@@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000116326896 1045245772 /nfs/dbraw/zinc/24/57/72/1045245772.db2.gz RYHMCCSPTWPDDK-MRXNPFEDSA-N 1 2 322.861 4.235 20 0 DIADLO Cc1noc(C)c1C[N@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000116326896 1045245784 /nfs/dbraw/zinc/24/57/84/1045245784.db2.gz RYHMCCSPTWPDDK-MRXNPFEDSA-N 1 2 322.861 4.235 20 0 DIADLO Cc1noc(C)c1C[N@@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000116326900 1045246470 /nfs/dbraw/zinc/24/64/70/1045246470.db2.gz RYHMCCSPTWPDDK-INIZCTEOSA-N 1 2 322.861 4.235 20 0 DIADLO Cc1noc(C)c1C[N@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000116326900 1045246472 /nfs/dbraw/zinc/24/64/72/1045246472.db2.gz RYHMCCSPTWPDDK-INIZCTEOSA-N 1 2 322.861 4.235 20 0 DIADLO FC(F)(F)c1sccc1C[NH2+]Cc1nc(C2CC2)cs1 ZINC000527676583 1045248622 /nfs/dbraw/zinc/24/86/22/1045248622.db2.gz UDBCCXMANOJHGX-UHFFFAOYSA-N 1 2 318.389 4.391 20 0 DIADLO COCc1ccc(C[NH2+]C(C)(C)c2nc3ccccc3s2)o1 ZINC000527742574 1045257803 /nfs/dbraw/zinc/25/78/03/1045257803.db2.gz CVILBMRTPTWUGJ-UHFFFAOYSA-N 1 2 316.426 4.061 20 0 DIADLO CC(C)CC1(c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)CC1 ZINC000578676948 1045263155 /nfs/dbraw/zinc/26/31/55/1045263155.db2.gz PGRAJICOEUWNJX-UHFFFAOYSA-N 1 2 322.412 4.059 20 0 DIADLO CC(C)c1cccc([C@H](C)[NH2+][C@@H](CO)c2c(F)cccc2F)c1 ZINC000527872262 1045271696 /nfs/dbraw/zinc/27/16/96/1045271696.db2.gz VWDLUVYARLODTM-UGSOOPFHSA-N 1 2 319.395 4.472 20 0 DIADLO c1ccc2c(c1)cc[nH+]c2N1CCC(OCC2CCCC2)CC1 ZINC000527917265 1045282637 /nfs/dbraw/zinc/28/26/37/1045282637.db2.gz SOYVRVHHMIHHNP-UHFFFAOYSA-N 1 2 310.441 4.410 20 0 DIADLO CCCCOC1CCN(c2[nH+]ccc3cc(F)ccc32)CC1 ZINC000579106393 1045294998 /nfs/dbraw/zinc/29/49/98/1045294998.db2.gz RZHDVKSRJISRFC-UHFFFAOYSA-N 1 2 302.393 4.159 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1ccccc1Br ZINC000528035190 1045296359 /nfs/dbraw/zinc/29/63/59/1045296359.db2.gz DTRXUQVSDOLEFF-MNOVXSKESA-N 1 2 323.209 4.395 20 0 DIADLO CCOC(=O)c1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)o1 ZINC000579153007 1045296791 /nfs/dbraw/zinc/29/67/91/1045296791.db2.gz IBNRVVHPAKRMRV-HNNXBMFYSA-N 1 2 319.426 4.101 20 0 DIADLO CCOC(=O)c1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)o1 ZINC000579153007 1045296794 /nfs/dbraw/zinc/29/67/94/1045296794.db2.gz IBNRVVHPAKRMRV-HNNXBMFYSA-N 1 2 319.426 4.101 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccc(Cl)c(F)c1 ZINC000579195789 1045299421 /nfs/dbraw/zinc/29/94/21/1045299421.db2.gz VEAXNUQTNMYAKU-QMMMGPOBSA-N 1 2 311.813 4.059 20 0 DIADLO FC1(F)CC12C[C@H]1CC[C@@H](C2)N1c1[nH+]ccc2ccccc21 ZINC000528098576 1045303766 /nfs/dbraw/zinc/30/37/66/1045303766.db2.gz QLRQQHOBSYTJRT-VMZNBEPHSA-N 1 2 300.352 4.391 20 0 DIADLO Cc1nc(N[C@H](c2ccccn2)C2CCC2)c2c([nH+]1)CCCC2 ZINC000528141086 1045309217 /nfs/dbraw/zinc/30/92/17/1045309217.db2.gz ULWWMGOHXHZVEF-SFHVURJKSA-N 1 2 308.429 4.012 20 0 DIADLO CC(C)CC(CC(C)C)Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000579407524 1045312645 /nfs/dbraw/zinc/31/26/45/1045312645.db2.gz GIURJZMBSZSBCE-UHFFFAOYSA-N 1 2 300.450 4.199 20 0 DIADLO COc1ccccc1[C@H]1CCN(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000579587212 1045323791 /nfs/dbraw/zinc/32/37/91/1045323791.db2.gz XUXZALPGAHVUJR-HNNXBMFYSA-N 1 2 322.383 4.376 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000118001134 1045331469 /nfs/dbraw/zinc/33/14/69/1045331469.db2.gz HAJKPJDQGWSALI-ZDUSSCGKSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1occc1C[N@H+](C)[C@@H](C)c1nnc(-c2ccc(C)cc2)o1 ZINC000118001134 1045331476 /nfs/dbraw/zinc/33/14/76/1045331476.db2.gz HAJKPJDQGWSALI-ZDUSSCGKSA-N 1 2 311.385 4.139 20 0 DIADLO Fc1cnccc1C[N@H+](Cc1ccccc1C(F)(F)F)C1CC1 ZINC000449009102 1045333428 /nfs/dbraw/zinc/33/34/28/1045333428.db2.gz GUUJPUPFCJBMJB-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO Fc1cnccc1C[N@@H+](Cc1ccccc1C(F)(F)F)C1CC1 ZINC000449009102 1045333431 /nfs/dbraw/zinc/33/34/31/1045333431.db2.gz GUUJPUPFCJBMJB-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1ccnn1C1CCCC1 ZINC000449008130 1045334008 /nfs/dbraw/zinc/33/40/08/1045334008.db2.gz OGUQCXDGKGEFCM-ZDUSSCGKSA-N 1 2 301.459 4.179 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1ccnn1C1CCCC1 ZINC000449008130 1045334015 /nfs/dbraw/zinc/33/40/15/1045334015.db2.gz OGUQCXDGKGEFCM-ZDUSSCGKSA-N 1 2 301.459 4.179 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1cccnc1C(F)(F)F ZINC000528345090 1045338874 /nfs/dbraw/zinc/33/88/74/1045338874.db2.gz MNANALHECHLLBC-JTQLQIEISA-N 1 2 312.360 4.281 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1cccnc1C(F)(F)F ZINC000528345090 1045338877 /nfs/dbraw/zinc/33/88/77/1045338877.db2.gz MNANALHECHLLBC-JTQLQIEISA-N 1 2 312.360 4.281 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)n1 ZINC000449117047 1045349026 /nfs/dbraw/zinc/34/90/26/1045349026.db2.gz NFKSLNILUNEBNI-GZMMTYOYSA-N 1 2 312.360 4.207 20 0 DIADLO CCC(F)(F)C(C)(C)CNC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000626569009 1045351460 /nfs/dbraw/zinc/35/14/60/1045351460.db2.gz NMWZNMRVLUCEPB-UHFFFAOYSA-N 1 2 313.392 4.200 20 0 DIADLO C/C=C/C[C@@H]1CCCN(C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000626568335 1045351495 /nfs/dbraw/zinc/35/14/95/1045351495.db2.gz ALVDAXJPSYZUSY-SQRWCISFSA-N 1 2 301.434 4.217 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cccnc2C(F)(F)F)n1 ZINC000528408220 1045352666 /nfs/dbraw/zinc/35/26/66/1045352666.db2.gz SGNXTXPWXUEENK-OAHLLOKOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2cccnc2C(F)(F)F)n1 ZINC000528408220 1045352668 /nfs/dbraw/zinc/35/26/68/1045352668.db2.gz SGNXTXPWXUEENK-OAHLLOKOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+]Cc3ccccc3OCC(C)C)nc2c1 ZINC000449170521 1045353416 /nfs/dbraw/zinc/35/34/16/1045353416.db2.gz GJTWMFNWQLGTHQ-UHFFFAOYSA-N 1 2 323.440 4.196 20 0 DIADLO Cc1ccc2nc(C[NH2+]Cc3ccccc3OCC(C)C)[nH]c2c1 ZINC000449170521 1045353419 /nfs/dbraw/zinc/35/34/19/1045353419.db2.gz GJTWMFNWQLGTHQ-UHFFFAOYSA-N 1 2 323.440 4.196 20 0 DIADLO Cc1ccc2sc(C[N@H+]3CC=C(C(F)(F)F)CC3)nc2c1 ZINC000528427086 1045357355 /nfs/dbraw/zinc/35/73/55/1045357355.db2.gz NLKIHYZTXYIPKV-UHFFFAOYSA-N 1 2 312.360 4.299 20 0 DIADLO Cc1ccc2sc(C[N@@H+]3CC=C(C(F)(F)F)CC3)nc2c1 ZINC000528427086 1045357361 /nfs/dbraw/zinc/35/73/61/1045357361.db2.gz NLKIHYZTXYIPKV-UHFFFAOYSA-N 1 2 312.360 4.299 20 0 DIADLO CCc1noc(CC)c1C[NH2+]Cc1cc(Cl)sc1Cl ZINC000449195751 1045359513 /nfs/dbraw/zinc/35/95/13/1045359513.db2.gz VRAISUCKZRYLNA-UHFFFAOYSA-N 1 2 319.257 4.458 20 0 DIADLO Cc1nc(C[NH2+]C(C)(C)c2nc3ccccc3s2)sc1C ZINC000528601537 1045383396 /nfs/dbraw/zinc/38/33/96/1045383396.db2.gz CFSMCIDNURWPQM-UHFFFAOYSA-N 1 2 317.483 4.395 20 0 DIADLO CCc1nc(C)c(C[NH2+]C(C)(C)c2nc3ccccc3s2)o1 ZINC000528601538 1045383597 /nfs/dbraw/zinc/38/35/97/1045383597.db2.gz CHLXIQKRUXLURH-UHFFFAOYSA-N 1 2 315.442 4.180 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc(Cl)s2)CC[C@H]1C(F)(F)F ZINC000190166681 1045386045 /nfs/dbraw/zinc/38/60/45/1045386045.db2.gz URGBULZANULJSC-SECBINFHSA-N 1 2 312.788 4.207 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc(Cl)s2)CC[C@H]1C(F)(F)F ZINC000190166681 1045386051 /nfs/dbraw/zinc/38/60/51/1045386051.db2.gz URGBULZANULJSC-SECBINFHSA-N 1 2 312.788 4.207 20 0 DIADLO Cn1ccnc1[C@H]1[N@H+](Cc2csc3ccccc23)CC1(C)C ZINC000449413575 1045388824 /nfs/dbraw/zinc/38/88/24/1045388824.db2.gz JIIUDKPIUBJZBY-MRXNPFEDSA-N 1 2 311.454 4.218 20 0 DIADLO Cn1ccnc1[C@H]1[N@@H+](Cc2csc3ccccc23)CC1(C)C ZINC000449413575 1045388829 /nfs/dbraw/zinc/38/88/29/1045388829.db2.gz JIIUDKPIUBJZBY-MRXNPFEDSA-N 1 2 311.454 4.218 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)s1 ZINC000449456896 1045396285 /nfs/dbraw/zinc/39/62/85/1045396285.db2.gz DTMWATBLKDFGDM-MNOVXSKESA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)s1 ZINC000449456896 1045396278 /nfs/dbraw/zinc/39/62/78/1045396278.db2.gz DTMWATBLKDFGDM-MNOVXSKESA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)cs1 ZINC000449462002 1045399714 /nfs/dbraw/zinc/39/97/14/1045399714.db2.gz RLSGRHRRIYPCBZ-MNOVXSKESA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)cs1 ZINC000449462002 1045399720 /nfs/dbraw/zinc/39/97/20/1045399720.db2.gz RLSGRHRRIYPCBZ-MNOVXSKESA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)cs1 ZINC000449462004 1045399825 /nfs/dbraw/zinc/39/98/25/1045399825.db2.gz RLSGRHRRIYPCBZ-WDEREUQCSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)cs1 ZINC000449462004 1045399828 /nfs/dbraw/zinc/39/98/28/1045399828.db2.gz RLSGRHRRIYPCBZ-WDEREUQCSA-N 1 2 306.397 4.429 20 0 DIADLO Cc1ncsc1C[N@@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000528713109 1045402411 /nfs/dbraw/zinc/40/24/11/1045402411.db2.gz AXZCBIRGEBDWAP-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1ncsc1C[N@H+]1CCc2c(cccc2C(F)(F)F)C1 ZINC000528713109 1045402412 /nfs/dbraw/zinc/40/24/12/1045402412.db2.gz AXZCBIRGEBDWAP-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2cc(Cl)sc2Cl)CC1(C)C ZINC000449506125 1045405940 /nfs/dbraw/zinc/40/59/40/1045405940.db2.gz YHKPRJBTWKEIDY-JTQLQIEISA-N 1 2 308.274 4.302 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2cc(Cl)sc2Cl)CC1(C)C ZINC000449506125 1045405941 /nfs/dbraw/zinc/40/59/41/1045405941.db2.gz YHKPRJBTWKEIDY-JTQLQIEISA-N 1 2 308.274 4.302 20 0 DIADLO Cc1nc(C[N@H+]2CC=C(c3ccc(Cl)cc3C)CC2)co1 ZINC000528741449 1045406474 /nfs/dbraw/zinc/40/64/74/1045406474.db2.gz GTLNTVJQXXCILN-UHFFFAOYSA-N 1 2 302.805 4.234 20 0 DIADLO Cc1nc(C[N@@H+]2CC=C(c3ccc(Cl)cc3C)CC2)co1 ZINC000528741449 1045406480 /nfs/dbraw/zinc/40/64/80/1045406480.db2.gz GTLNTVJQXXCILN-UHFFFAOYSA-N 1 2 302.805 4.234 20 0 DIADLO Cc1noc([C@@H](C)[N@H+]2CC=C(c3ccc(Cl)cc3C)CC2)n1 ZINC000528740507 1045406740 /nfs/dbraw/zinc/40/67/40/1045406740.db2.gz ILFIFSKLADYCGH-GFCCVEGCSA-N 1 2 317.820 4.190 20 0 DIADLO Cc1noc([C@@H](C)[N@@H+]2CC=C(c3ccc(Cl)cc3C)CC2)n1 ZINC000528740507 1045406743 /nfs/dbraw/zinc/40/67/43/1045406743.db2.gz ILFIFSKLADYCGH-GFCCVEGCSA-N 1 2 317.820 4.190 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1cscc1Br ZINC000528766092 1045411241 /nfs/dbraw/zinc/41/12/41/1045411241.db2.gz COCBAFAIDKFZIJ-QMMMGPOBSA-N 1 2 310.207 4.130 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1cscc1Br ZINC000528766092 1045411245 /nfs/dbraw/zinc/41/12/45/1045411245.db2.gz COCBAFAIDKFZIJ-QMMMGPOBSA-N 1 2 310.207 4.130 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1ncc(-c2ccc(F)cc2)o1 ZINC000528765031 1045411735 /nfs/dbraw/zinc/41/17/35/1045411735.db2.gz FVCYNFRDQZKEJH-NSHDSACASA-N 1 2 310.319 4.100 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1ncc(-c2ccc(F)cc2)o1 ZINC000528765031 1045411736 /nfs/dbraw/zinc/41/17/36/1045411736.db2.gz FVCYNFRDQZKEJH-NSHDSACASA-N 1 2 310.319 4.100 20 0 DIADLO c1coc([C@@H]2[N@H+](Cc3ccnn3-c3ccccc3)CC23CCC3)c1 ZINC000449640159 1045422548 /nfs/dbraw/zinc/42/25/48/1045422548.db2.gz RUQKULPJMORJQW-IBGZPJMESA-N 1 2 319.408 4.193 20 0 DIADLO c1coc([C@@H]2[N@@H+](Cc3ccnn3-c3ccccc3)CC23CCC3)c1 ZINC000449640159 1045422550 /nfs/dbraw/zinc/42/25/50/1045422550.db2.gz RUQKULPJMORJQW-IBGZPJMESA-N 1 2 319.408 4.193 20 0 DIADLO CCn1nc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)c2ccccc21 ZINC000449638509 1045424750 /nfs/dbraw/zinc/42/47/50/1045424750.db2.gz KXLJMKMWHGIDJP-LJQANCHMSA-N 1 2 321.424 4.376 20 0 DIADLO CCn1nc(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)c2ccccc21 ZINC000449638509 1045424751 /nfs/dbraw/zinc/42/47/51/1045424751.db2.gz KXLJMKMWHGIDJP-LJQANCHMSA-N 1 2 321.424 4.376 20 0 DIADLO COCc1cnc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2C)s1 ZINC000449730035 1045429763 /nfs/dbraw/zinc/42/97/63/1045429763.db2.gz CKTFIOTWHNFJSL-MRXNPFEDSA-N 1 2 320.433 4.074 20 0 DIADLO COCc1cnc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2C)s1 ZINC000449730035 1045429767 /nfs/dbraw/zinc/42/97/67/1045429767.db2.gz CKTFIOTWHNFJSL-MRXNPFEDSA-N 1 2 320.433 4.074 20 0 DIADLO C[C@@H](c1csnn1)[N@H+]1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000450247243 1045480295 /nfs/dbraw/zinc/48/02/95/1045480295.db2.gz XMZUHLCOOOBCCF-KSSFIOAISA-N 1 2 321.449 4.247 20 0 DIADLO C[C@@H](c1csnn1)[N@@H+]1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000450247243 1045480297 /nfs/dbraw/zinc/48/02/97/1045480297.db2.gz XMZUHLCOOOBCCF-KSSFIOAISA-N 1 2 321.449 4.247 20 0 DIADLO CC[C@@H](c1ccccc1)[N@H+](CC)Cc1nnc(C2CC2)s1 ZINC000450304470 1045484869 /nfs/dbraw/zinc/48/48/69/1045484869.db2.gz MGGZGDQKEBQBLP-HNNXBMFYSA-N 1 2 301.459 4.389 20 0 DIADLO CC[C@@H](c1ccccc1)[N@@H+](CC)Cc1nnc(C2CC2)s1 ZINC000450304470 1045484872 /nfs/dbraw/zinc/48/48/72/1045484872.db2.gz MGGZGDQKEBQBLP-HNNXBMFYSA-N 1 2 301.459 4.389 20 0 DIADLO C[N@H+](CCc1c(Cl)cccc1Cl)Cc1cscn1 ZINC000450290835 1045485634 /nfs/dbraw/zinc/48/56/34/1045485634.db2.gz UWKAOLGJSAMTDA-UHFFFAOYSA-N 1 2 301.242 4.124 20 0 DIADLO C[N@@H+](CCc1c(Cl)cccc1Cl)Cc1cscn1 ZINC000450290835 1045485636 /nfs/dbraw/zinc/48/56/36/1045485636.db2.gz UWKAOLGJSAMTDA-UHFFFAOYSA-N 1 2 301.242 4.124 20 0 DIADLO COC(=O)c1cccc(C[N@H+](Cc2ccco2)C(C)C)c1Cl ZINC000450296465 1045485738 /nfs/dbraw/zinc/48/57/38/1045485738.db2.gz DHHIQKCWJGIVRQ-UHFFFAOYSA-N 1 2 321.804 4.130 20 0 DIADLO COC(=O)c1cccc(C[N@@H+](Cc2ccco2)C(C)C)c1Cl ZINC000450296465 1045485739 /nfs/dbraw/zinc/48/57/39/1045485739.db2.gz DHHIQKCWJGIVRQ-UHFFFAOYSA-N 1 2 321.804 4.130 20 0 DIADLO CC[N@H+](Cc1cnns1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000450311425 1045486474 /nfs/dbraw/zinc/48/64/74/1045486474.db2.gz ZCPCPGGFVIEUIO-SNVBAGLBSA-N 1 2 315.364 4.140 20 0 DIADLO CC[N@@H+](Cc1cnns1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000450311425 1045486477 /nfs/dbraw/zinc/48/64/77/1045486477.db2.gz ZCPCPGGFVIEUIO-SNVBAGLBSA-N 1 2 315.364 4.140 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+]2CCCc3ccccc3C2)cs1 ZINC000120751658 1045487718 /nfs/dbraw/zinc/48/77/18/1045487718.db2.gz SUIYRSKNNKCERY-CQSZACIVSA-N 1 2 316.470 4.189 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+]2CCCc3ccccc3C2)cs1 ZINC000120751658 1045487721 /nfs/dbraw/zinc/48/77/21/1045487721.db2.gz SUIYRSKNNKCERY-CQSZACIVSA-N 1 2 316.470 4.189 20 0 DIADLO Fc1ccc(F)c(C[NH+]2CCC(OCC3CC3)CC2)c1Cl ZINC000529529144 1045488073 /nfs/dbraw/zinc/48/80/73/1045488073.db2.gz MLEVYFWLFIQCEF-UHFFFAOYSA-N 1 2 315.791 4.009 20 0 DIADLO FC(F)(F)c1ccc2c(cc[nH+]c2N2CCC(F)(F)C2)c1 ZINC000450423306 1045503228 /nfs/dbraw/zinc/50/32/28/1045503228.db2.gz IJOZRSHVPDXKHJ-UHFFFAOYSA-N 1 2 302.246 4.099 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2nnc(C3CC3)s2)C1 ZINC000450437190 1045504589 /nfs/dbraw/zinc/50/45/89/1045504589.db2.gz HXJDGTVBRPUVCG-XHDPSFHLSA-N 1 2 317.433 4.138 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2nnc(C3CC3)s2)C1 ZINC000450437190 1045504599 /nfs/dbraw/zinc/50/45/99/1045504599.db2.gz HXJDGTVBRPUVCG-XHDPSFHLSA-N 1 2 317.433 4.138 20 0 DIADLO c1coc(CC2C[NH+](Cc3csc(-c4cccs4)n3)C2)c1 ZINC000529648450 1045506339 /nfs/dbraw/zinc/50/63/39/1045506339.db2.gz DZXBBMFSTCWAQH-UHFFFAOYSA-N 1 2 316.451 4.139 20 0 DIADLO O=C(Nc1cccc(C2CCCCC2)c1)[C@H]1CCc2c[nH+]cn2C1 ZINC000529649535 1045507456 /nfs/dbraw/zinc/50/74/56/1045507456.db2.gz PQUSEHVFMPNSLQ-KRWDZBQOSA-N 1 2 323.440 4.132 20 0 DIADLO O=C(Nc1cccc(C2CCCCC2)c1)[C@@H]1CCc2[nH+]ccn2C1 ZINC000529650656 1045507903 /nfs/dbraw/zinc/50/79/03/1045507903.db2.gz UKAHHYHEHGDGHU-QGZVFWFLSA-N 1 2 323.440 4.132 20 0 DIADLO CC(C)c1ccc([C@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc1 ZINC000450496939 1045511238 /nfs/dbraw/zinc/51/12/38/1045511238.db2.gz AMNSEBOPVABEDB-LBPRGKRZSA-N 1 2 301.459 4.390 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nncs1)c1cccc(C(F)(F)F)c1 ZINC001119770712 1045525282 /nfs/dbraw/zinc/52/52/82/1045525282.db2.gz VPHVMFKPEGHYPT-GFCCVEGCSA-N 1 2 315.364 4.188 20 0 DIADLO Cc1[nH]c(CN(Cc2ccc(C(F)(F)F)cc2)C2CC2)[nH+]c1C ZINC000628131095 1045526881 /nfs/dbraw/zinc/52/68/81/1045526881.db2.gz RBXKVWPDOBIYTF-UHFFFAOYSA-N 1 2 323.362 4.210 20 0 DIADLO Cc1c[nH]c(C[N@H+](Cc2ccccc2)Cc2ccccc2C)n1 ZINC000628142996 1045528767 /nfs/dbraw/zinc/52/87/67/1045528767.db2.gz XUEIUTXICQTXDR-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO Cc1c[nH]c(C[N@@H+](Cc2ccccc2)Cc2ccccc2C)n1 ZINC000628142996 1045528777 /nfs/dbraw/zinc/52/87/77/1045528777.db2.gz XUEIUTXICQTXDR-UHFFFAOYSA-N 1 2 305.425 4.229 20 0 DIADLO Cc1[nH]c(CN(Cc2ccccc2)Cc2ccccc2F)[nH+]c1C ZINC000628142946 1045529133 /nfs/dbraw/zinc/52/91/33/1045529133.db2.gz WKHSYGMJLCDNBU-UHFFFAOYSA-N 1 2 323.415 4.368 20 0 DIADLO Cc1ccnc(C2CCN(c3cc(C)c4ccccc4[nH+]3)CC2)n1 ZINC001119959838 1045531357 /nfs/dbraw/zinc/53/13/57/1045531357.db2.gz QSGQZHHDTAUCJN-UHFFFAOYSA-N 1 2 318.424 4.026 20 0 DIADLO Fc1ccccc1C=C1CC[NH+](Cc2cnc(C3CC3)o2)CC1 ZINC000628189611 1045537770 /nfs/dbraw/zinc/53/77/70/1045537770.db2.gz HFMNUZIBXYFTHJ-UHFFFAOYSA-N 1 2 312.388 4.371 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2nc(C)c(C)[nH]2)o1 ZINC000628188844 1045539591 /nfs/dbraw/zinc/53/95/91/1045539591.db2.gz LFCHYXQOJAPNLW-LRDDRELGSA-N 1 2 301.434 4.155 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2nc(C)c(C)[nH]2)o1 ZINC000628188844 1045539600 /nfs/dbraw/zinc/53/96/00/1045539600.db2.gz LFCHYXQOJAPNLW-LRDDRELGSA-N 1 2 301.434 4.155 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CCN2Cc2[nH]c(C)c(C)[nH+]2)o1 ZINC000628188844 1045539611 /nfs/dbraw/zinc/53/96/11/1045539611.db2.gz LFCHYXQOJAPNLW-LRDDRELGSA-N 1 2 301.434 4.155 20 0 DIADLO Cc1nc(C)c(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)o1 ZINC000628195928 1045540472 /nfs/dbraw/zinc/54/04/72/1045540472.db2.gz UFTAGUXJWHHAMT-UHFFFAOYSA-N 1 2 322.412 4.103 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(CCC(C)C)C3CCCC3)ccn12 ZINC000654643146 1045553192 /nfs/dbraw/zinc/55/31/92/1045553192.db2.gz ZHEFOOIIJNFFCD-UHFFFAOYSA-N 1 2 313.445 4.074 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)N1CCC(c2c[nH+]cn2C)CC1 ZINC001121215828 1045555444 /nfs/dbraw/zinc/55/54/44/1045555444.db2.gz BQRWXUAHGKFECT-LJQANCHMSA-N 1 2 319.493 4.123 20 0 DIADLO CCC(CC)CC(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001121286767 1045559548 /nfs/dbraw/zinc/55/95/48/1045559548.db2.gz ZYVUFXOSECSFBN-MRXNPFEDSA-N 1 2 319.493 4.170 20 0 DIADLO Cc1nc(C[NH+]2CCC([C@H](F)c3ccccc3F)CC2)[nH]c1C ZINC000628271123 1045560895 /nfs/dbraw/zinc/56/08/95/1045560895.db2.gz NGKDOFVONWAVBJ-SFHVURJKSA-N 1 2 319.399 4.088 20 0 DIADLO FC(F)(F)CC1C[NH+](Cc2ccsc2C(F)(F)F)C1 ZINC000628306965 1045565800 /nfs/dbraw/zinc/56/58/00/1045565800.db2.gz GJLCSBXQOAXSGP-UHFFFAOYSA-N 1 2 303.271 4.151 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(Cl)c2)C[N@@H+]1CC1CC(F)(F)C1 ZINC000450813218 1045569785 /nfs/dbraw/zinc/56/97/85/1045569785.db2.gz VINUGPAOMPWNAR-IAQYHMDHSA-N 1 2 315.791 4.147 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(Cl)c2)C[N@H+]1CC1CC(F)(F)C1 ZINC000450813218 1045569792 /nfs/dbraw/zinc/56/97/92/1045569792.db2.gz VINUGPAOMPWNAR-IAQYHMDHSA-N 1 2 315.791 4.147 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2)n1 ZINC000121397206 1045574198 /nfs/dbraw/zinc/57/41/98/1045574198.db2.gz GXQUYEXWQSTOEQ-KBPBESRZSA-N 1 2 319.474 4.385 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2)n1 ZINC000121397206 1045574207 /nfs/dbraw/zinc/57/42/07/1045574207.db2.gz GXQUYEXWQSTOEQ-KBPBESRZSA-N 1 2 319.474 4.385 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2)n1 ZINC000121397363 1045575380 /nfs/dbraw/zinc/57/53/80/1045575380.db2.gz GXQUYEXWQSTOEQ-UONOGXRCSA-N 1 2 319.474 4.385 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2)n1 ZINC000121397363 1045575389 /nfs/dbraw/zinc/57/53/89/1045575389.db2.gz GXQUYEXWQSTOEQ-UONOGXRCSA-N 1 2 319.474 4.385 20 0 DIADLO CCCOc1cccc2c(NCc3cnc(CC)o3)cc[nH+]c12 ZINC000450848571 1045576891 /nfs/dbraw/zinc/57/68/91/1045576891.db2.gz SBWFMKJOSKZHRD-UHFFFAOYSA-N 1 2 311.385 4.186 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3ccc(C)c(Cl)c3)ccc2[nH+]1 ZINC001202800980 1045577191 /nfs/dbraw/zinc/57/71/91/1045577191.db2.gz UXCZMGYJPQAGPM-UHFFFAOYSA-N 1 2 314.776 4.249 20 0 DIADLO CC(C)([NH2+]Cc1cnc(C2CC2)o1)c1nc2ccccc2s1 ZINC000628418826 1045582217 /nfs/dbraw/zinc/58/22/17/1045582217.db2.gz AONXVSQRVXTOEE-UHFFFAOYSA-N 1 2 313.426 4.187 20 0 DIADLO CC(C)[C@H](c1ccc(F)cc1)[N@H+](C)Cc1nnc(C2CC2)s1 ZINC000450885936 1045587918 /nfs/dbraw/zinc/58/79/18/1045587918.db2.gz VWZQBEGPSYKBMT-MRXNPFEDSA-N 1 2 319.449 4.384 20 0 DIADLO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1nnc(C2CC2)s1 ZINC000450885936 1045587929 /nfs/dbraw/zinc/58/79/29/1045587929.db2.gz VWZQBEGPSYKBMT-MRXNPFEDSA-N 1 2 319.449 4.384 20 0 DIADLO Fc1cc(Cl)cc(F)c1C[NH+]1CCC2(CC(F)C2)CC1 ZINC001139048677 1045588374 /nfs/dbraw/zinc/58/83/74/1045588374.db2.gz AXRPJFYPZDYWTB-UHFFFAOYSA-N 1 2 303.755 4.332 20 0 DIADLO Fc1cc2[nH+]ccc(N3CCC[C@@]4(CCOC4)C3)c2cc1Cl ZINC000450880744 1045589141 /nfs/dbraw/zinc/58/91/41/1045589141.db2.gz KZXKLLSJNFATRS-QGZVFWFLSA-N 1 2 320.795 4.034 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+](C)Cc1cnc(C(C)C)nc1 ZINC000450904050 1045590238 /nfs/dbraw/zinc/59/02/38/1045590238.db2.gz DMFFMARGLNLVBL-UHFFFAOYSA-N 1 2 303.837 4.194 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+](C)Cc1cnc(C(C)C)nc1 ZINC000450904050 1045590247 /nfs/dbraw/zinc/59/02/47/1045590247.db2.gz DMFFMARGLNLVBL-UHFFFAOYSA-N 1 2 303.837 4.194 20 0 DIADLO CC[C@@H]1C[C@]1([NH2+]Cc1nnc(C(C)C)s1)c1cccc(C)c1 ZINC000450921554 1045595985 /nfs/dbraw/zinc/59/59/85/1045595985.db2.gz IQSCJLQCUYZTAR-RDTXWAMCSA-N 1 2 315.486 4.385 20 0 DIADLO COC[C@H]1CCCN(c2cc[nH+]c3c(Cl)cccc23)CC1 ZINC000450941626 1045598292 /nfs/dbraw/zinc/59/82/92/1045598292.db2.gz FNEAXEAGHYBGJM-ZDUSSCGKSA-N 1 2 304.821 4.141 20 0 DIADLO C[C@H](OC(=O)CCc1ccc(N)[nH+]c1)c1ccc2ccccc2c1 ZINC000751456703 1045604884 /nfs/dbraw/zinc/60/48/84/1045604884.db2.gz VOTPQUFEGAERNP-AWEZNQCLSA-N 1 2 320.392 4.054 20 0 DIADLO CC[C@@H](C)CCCCC(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000751427590 1045605708 /nfs/dbraw/zinc/60/57/08/1045605708.db2.gz JDJQOMXHAWWZDI-HZPDHXFCSA-N 1 2 307.482 4.021 20 0 DIADLO Fc1cc(F)c(F)c(C[NH2+]Cc2cnc3ccccc3c2)c1F ZINC000751503892 1045609215 /nfs/dbraw/zinc/60/92/15/1045609215.db2.gz DFHIRAXNIAEFPY-UHFFFAOYSA-N 1 2 320.289 4.081 20 0 DIADLO C[C@H]1c2nnc(C3CCCC3)n2CC[N@H+]1CCC1=CCCCC1 ZINC000451025901 1045614111 /nfs/dbraw/zinc/61/41/11/1045614111.db2.gz LXZVSJFYYUBQMF-HNNXBMFYSA-N 1 2 314.477 4.203 20 0 DIADLO C[C@H]1c2nnc(C3CCCC3)n2CC[N@@H+]1CCC1=CCCCC1 ZINC000451025901 1045614119 /nfs/dbraw/zinc/61/41/19/1045614119.db2.gz LXZVSJFYYUBQMF-HNNXBMFYSA-N 1 2 314.477 4.203 20 0 DIADLO COc1ccc([NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)c(OC)c1 ZINC000800483791 1045626872 /nfs/dbraw/zinc/62/68/72/1045626872.db2.gz PELQXAROVXINDQ-ZBFHGGJFSA-N 1 2 312.413 4.237 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CCC34CCC4)cc2)C[C@@H](C)O1 ZINC000800487437 1045629367 /nfs/dbraw/zinc/62/93/67/1045629367.db2.gz CTEBRFGKGLDNRZ-RKVPGOIHSA-N 1 2 300.446 4.045 20 0 DIADLO COc1ccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)c(OC)c1 ZINC000192900059 1045633570 /nfs/dbraw/zinc/63/35/70/1045633570.db2.gz VMQCEKUUZDUGFH-AWEZNQCLSA-N 1 2 323.396 4.063 20 0 DIADLO Cc1cc(F)cc([C@@]2(F)CC[N@H+](Cc3ccc(F)nc3C)C2)c1 ZINC000800536829 1045638692 /nfs/dbraw/zinc/63/86/92/1045638692.db2.gz XOSVMCLFZVNJNJ-GOSISDBHSA-N 1 2 320.358 4.047 20 0 DIADLO Cc1cc(F)cc([C@@]2(F)CC[N@@H+](Cc3ccc(F)nc3C)C2)c1 ZINC000800536829 1045638699 /nfs/dbraw/zinc/63/86/99/1045638699.db2.gz XOSVMCLFZVNJNJ-GOSISDBHSA-N 1 2 320.358 4.047 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2c1cccc2O)c1ncc(-c2ccccc2)o1 ZINC000451182482 1045642281 /nfs/dbraw/zinc/64/22/81/1045642281.db2.gz XQMLZWPAVZWQDD-GUYCJALGSA-N 1 2 320.392 4.385 20 0 DIADLO Cc1cc([NH2+]C[C@@H]2CC=CCC2)ccc1OC1CCOCC1 ZINC000752086406 1045656568 /nfs/dbraw/zinc/65/65/68/1045656568.db2.gz BNFRYEFJNKAWIL-MRXNPFEDSA-N 1 2 301.430 4.321 20 0 DIADLO CC[N@@H+](c1ccc(Nc2nc([C@H](C)OC)ns2)cc1)C(C)C ZINC000800844759 1045657025 /nfs/dbraw/zinc/65/70/25/1045657025.db2.gz KCUULSCJBTVVNR-LBPRGKRZSA-N 1 2 320.462 4.224 20 0 DIADLO CC[N@H+](c1ccc(Nc2nc([C@H](C)OC)ns2)cc1)C(C)C ZINC000800844759 1045657032 /nfs/dbraw/zinc/65/70/32/1045657032.db2.gz KCUULSCJBTVVNR-LBPRGKRZSA-N 1 2 320.462 4.224 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@H](c1ccccc1)C1CC1 ZINC000121741488 1045657191 /nfs/dbraw/zinc/65/71/91/1045657191.db2.gz FULYKKYWLMVTIH-LJQANCHMSA-N 1 2 317.392 4.005 20 0 DIADLO CCOc1cccc(CNc2ccc([NH2+]C)cc2)c1OC(F)F ZINC000629389344 1045664639 /nfs/dbraw/zinc/66/46/39/1045664639.db2.gz JWWDZOWJMFLRKN-UHFFFAOYSA-N 1 2 322.355 4.341 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)o1 ZINC000451351504 1045668940 /nfs/dbraw/zinc/66/89/40/1045668940.db2.gz FMHGFDIMOOXAEB-HNNXBMFYSA-N 1 2 323.799 4.226 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2ncccc2F)c2ccccc2)cc1 ZINC000530470785 1045671781 /nfs/dbraw/zinc/67/17/81/1045671781.db2.gz ITWOJIDNUYOUJG-HXUWFJFHSA-N 1 2 322.383 4.109 20 0 DIADLO Cc1cc([NH2+][C@H]2CCC[C@@H]2CCCF)ccc1N1CCOCC1 ZINC000800982225 1045675923 /nfs/dbraw/zinc/67/59/23/1045675923.db2.gz FFCXUAPGZJCDEQ-AEFFLSMTSA-N 1 2 320.452 4.162 20 0 DIADLO c1cc(N2CCSCC2)ccc1[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000800982398 1045676207 /nfs/dbraw/zinc/67/62/07/1045676207.db2.gz RYDFPCNKIYWAJE-ROUUACIJSA-N 1 2 302.487 4.230 20 0 DIADLO CC[C@@H](C)c1ccccc1OC(=O)c1ccn2c(C)c[nH+]c2c1 ZINC001124417748 1045686762 /nfs/dbraw/zinc/68/67/62/1045686762.db2.gz TXQKXUNNCRTPFL-CYBMUJFWSA-N 1 2 308.381 4.375 20 0 DIADLO C[C@H](CC(=O)NC(C)(C)c1ccc2ccccc2c1)n1cc[nH+]c1 ZINC000629649439 1045689226 /nfs/dbraw/zinc/68/92/26/1045689226.db2.gz AIBIVQNKWPLWAM-OAHLLOKOSA-N 1 2 321.424 4.039 20 0 DIADLO Cc1cc(N[C@@H](c2ccc(F)cn2)C(C)C)ccc1[NH+](C)C ZINC000779421015 1045699276 /nfs/dbraw/zinc/69/92/76/1045699276.db2.gz BCGUVBUYDLHARG-GOSISDBHSA-N 1 2 301.409 4.404 20 0 DIADLO C[C@@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1cccc(F)c1F ZINC000191528645 1045723638 /nfs/dbraw/zinc/72/36/38/1045723638.db2.gz VNXLMIWEXXFDMJ-MRVPVSSYSA-N 1 2 315.722 4.314 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(Br)n2)[C@@H]1c1ccccc1 ZINC000779436141 1045727331 /nfs/dbraw/zinc/72/73/31/1045727331.db2.gz BXYQDDLVAXZQAU-LRDDRELGSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(Br)n2)[C@@H]1c1ccccc1 ZINC000779436141 1045727346 /nfs/dbraw/zinc/72/73/46/1045727346.db2.gz BXYQDDLVAXZQAU-LRDDRELGSA-N 1 2 317.230 4.037 20 0 DIADLO C[N@H+](Cc1nc2c(s1)CCCC2)Cc1ccc(Cl)cc1 ZINC000530865508 1045741647 /nfs/dbraw/zinc/74/16/47/1045741647.db2.gz ZTTMVTMJQRUPKY-UHFFFAOYSA-N 1 2 306.862 4.307 20 0 DIADLO C[N@@H+](Cc1nc2c(s1)CCCC2)Cc1ccc(Cl)cc1 ZINC000530865508 1045741652 /nfs/dbraw/zinc/74/16/52/1045741652.db2.gz ZTTMVTMJQRUPKY-UHFFFAOYSA-N 1 2 306.862 4.307 20 0 DIADLO CC[N@H+](Cc1c[nH]nc1C(C)(C)C)Cc1cccc(F)c1F ZINC001138580871 1045743703 /nfs/dbraw/zinc/74/37/03/1045743703.db2.gz MINLHAXMMFSOAN-UHFFFAOYSA-N 1 2 307.388 4.008 20 0 DIADLO CC[N@@H+](Cc1c[nH]nc1C(C)(C)C)Cc1cccc(F)c1F ZINC001138580871 1045743718 /nfs/dbraw/zinc/74/37/18/1045743718.db2.gz MINLHAXMMFSOAN-UHFFFAOYSA-N 1 2 307.388 4.008 20 0 DIADLO CC[C@@H](OC(=O)c1cccc(Cn2cc[nH+]c2)c1)c1ccccc1 ZINC000779455525 1045749008 /nfs/dbraw/zinc/74/90/08/1045749008.db2.gz SIJCHODNGCRGTD-LJQANCHMSA-N 1 2 320.392 4.240 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)c(F)c(F)c(F)c1F)c1ccccc1 ZINC000753344904 1045749767 /nfs/dbraw/zinc/74/97/67/1045749767.db2.gz YFIZFVLWFASPPI-QMMMGPOBSA-N 1 2 301.258 4.233 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1ccccc1C(F)(F)F ZINC000078670552 1045750937 /nfs/dbraw/zinc/75/09/37/1045750937.db2.gz PILLNONBMSGKNV-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1ccccc1C(F)(F)F ZINC000078670552 1045750945 /nfs/dbraw/zinc/75/09/45/1045750945.db2.gz PILLNONBMSGKNV-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1cnc(Cl)s1 ZINC000078670455 1045751432 /nfs/dbraw/zinc/75/14/32/1045751432.db2.gz UPZWLPJKYAADNU-MRVPVSSYSA-N 1 2 302.777 4.268 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1cnc(Cl)s1 ZINC000078670455 1045751444 /nfs/dbraw/zinc/75/14/44/1045751444.db2.gz UPZWLPJKYAADNU-MRVPVSSYSA-N 1 2 302.777 4.268 20 0 DIADLO FC(F)(F)[C@@H]1CCC[C@H](c2csc(Cn3cc[nH+]c3)n2)C1 ZINC000630386620 1045757573 /nfs/dbraw/zinc/75/75/73/1045757573.db2.gz SGCUUOMXSJPOKP-WDEREUQCSA-N 1 2 315.364 4.224 20 0 DIADLO CCCCC[N@@H+]1CCO[C@@H](c2ccccc2Br)C1 ZINC000078775076 1045769801 /nfs/dbraw/zinc/76/98/01/1045769801.db2.gz FZUYQRNLTYADMR-OAHLLOKOSA-N 1 2 312.251 4.013 20 0 DIADLO CCCCC[N@H+]1CCO[C@@H](c2ccccc2Br)C1 ZINC000078775076 1045769806 /nfs/dbraw/zinc/76/98/06/1045769806.db2.gz FZUYQRNLTYADMR-OAHLLOKOSA-N 1 2 312.251 4.013 20 0 DIADLO Cc1cccc([C@H](C)[NH2+]Cc2nc(Cc3ccccc3C)no2)c1 ZINC000452090819 1045772133 /nfs/dbraw/zinc/77/21/33/1045772133.db2.gz RBDUCPQVGSCWFZ-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO C[C@H](C[NH2+]c1ccc(N2CCO[C@@H](C)C2)cc1)Cc1ccccc1 ZINC000753969398 1045826248 /nfs/dbraw/zinc/82/62/48/1045826248.db2.gz SHPWARAVTMJWPP-ROUUACIJSA-N 1 2 324.468 4.202 20 0 DIADLO C[C@@H](C[NH2+]c1ccc(N2CCO[C@@H](C)C2)cc1)Cc1ccccc1 ZINC000753969396 1045827767 /nfs/dbraw/zinc/82/77/67/1045827767.db2.gz SHPWARAVTMJWPP-MSOLQXFVSA-N 1 2 324.468 4.202 20 0 DIADLO CN(C)c1cc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)ccn1 ZINC000753996859 1045828839 /nfs/dbraw/zinc/82/88/39/1045828839.db2.gz WTYILCNIWFXLEN-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1cc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)ccn1 ZINC000753996859 1045828855 /nfs/dbraw/zinc/82/88/55/1045828855.db2.gz WTYILCNIWFXLEN-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc2c(c1)oc1ccccc12)n1cc[nH+]c1 ZINC001125004726 1045829757 /nfs/dbraw/zinc/82/97/57/1045829757.db2.gz BXRAZILTDMZWJA-ZDUSSCGKSA-N 1 2 319.364 4.372 20 0 DIADLO O[C@@]1(CNc2cc3ccccc3c[nH+]2)CCC[C@@H](C(F)(F)F)C1 ZINC000631232814 1045839739 /nfs/dbraw/zinc/83/97/39/1045839739.db2.gz IBCXYVOHSOJQJK-ZBFHGGJFSA-N 1 2 324.346 4.130 20 0 DIADLO C[C@H]1CN(c2ccc([NH2+]C3CCC4(CC4)CC3)cc2)CCO1 ZINC000754102202 1045848380 /nfs/dbraw/zinc/84/83/80/1045848380.db2.gz RCZDGINBMSXFBY-HNNXBMFYSA-N 1 2 300.446 4.046 20 0 DIADLO CC(C)[C@H]1C[C@H]([NH2+]c2ccc(N3CCSCC3)cc2)CS1 ZINC000754130808 1045853148 /nfs/dbraw/zinc/85/31/48/1045853148.db2.gz RUGVWFAYOIGDDC-DOTOQJQBSA-N 1 2 322.543 4.182 20 0 DIADLO CCc1ccc(C[NH2+][C@@H]2COc3c2ccc(Cl)c3Cl)o1 ZINC000531612083 1045879759 /nfs/dbraw/zinc/87/97/59/1045879759.db2.gz YUJNKTQZKYPAQN-CYBMUJFWSA-N 1 2 312.196 4.372 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1cc(C)ccn1 ZINC000631600017 1045882892 /nfs/dbraw/zinc/88/28/92/1045882892.db2.gz AFHFVBPKIWYCHQ-CQSZACIVSA-N 1 2 301.459 4.355 20 0 DIADLO CCC[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1cc(C)ccn1 ZINC000631599254 1045883577 /nfs/dbraw/zinc/88/35/77/1045883577.db2.gz DZQZSTVAYJJRQY-SFHVURJKSA-N 1 2 312.461 4.333 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)c1 ZINC000531688393 1045891603 /nfs/dbraw/zinc/89/16/03/1045891603.db2.gz SDFNEMVRJITFPK-APWZRJJASA-N 1 2 305.425 4.169 20 0 DIADLO Clc1cc(Br)ccc1C[N@@H+]1CCC[C@@H]2C[C@@H]21 ZINC001137565124 1045896704 /nfs/dbraw/zinc/89/67/04/1045896704.db2.gz AJVOJEBPICFDBT-RNCFNFMXSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1cc(Br)ccc1C[N@H+]1CCC[C@@H]2C[C@@H]21 ZINC001137565124 1045896711 /nfs/dbraw/zinc/89/67/11/1045896711.db2.gz AJVOJEBPICFDBT-RNCFNFMXSA-N 1 2 300.627 4.087 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2c(Cl)cccc2Cl)c(C)n1 ZINC000531694372 1045905348 /nfs/dbraw/zinc/90/53/48/1045905348.db2.gz YIOFUEGIAKYKGU-SECBINFHSA-N 1 2 310.228 4.251 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1c(C)nn(C(C)C)c1C ZINC000902067394 1045905432 /nfs/dbraw/zinc/90/54/32/1045905432.db2.gz XNWZAOBYGHURBZ-UHFFFAOYSA-N 1 2 311.433 4.063 20 0 DIADLO C[C@@H]([NH2+]Cc1c(Cl)cccc1OC(F)F)c1ccccn1 ZINC000631772850 1045916724 /nfs/dbraw/zinc/91/67/24/1045916724.db2.gz QWPCHYCGCYFILQ-SNVBAGLBSA-N 1 2 312.747 4.187 20 0 DIADLO COc1ccc(OC)c([C@@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)c1 ZINC000631795140 1045920372 /nfs/dbraw/zinc/92/03/72/1045920372.db2.gz GPIMCTMPYQJCHR-PXAZEXFGSA-N 1 2 321.367 4.204 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)ccc1F ZINC000631798425 1045920607 /nfs/dbraw/zinc/92/06/07/1045920607.db2.gz SLHPHKVNWUIYGB-BDJLRTHQSA-N 1 2 309.331 4.335 20 0 DIADLO Cc1ccn2cc(C[N@@H+](C)Cc3ccc(Cl)c(F)c3)nc2c1 ZINC001137655524 1045921115 /nfs/dbraw/zinc/92/11/15/1045921115.db2.gz RWNDTRPXEQRZRV-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1ccn2cc(C[N@H+](C)Cc3ccc(Cl)c(F)c3)nc2c1 ZINC001137655524 1045921123 /nfs/dbraw/zinc/92/11/23/1045921123.db2.gz RWNDTRPXEQRZRV-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO CC[N@H+](CC(=O)OC(C)(C)C)Cc1cc2ccccc2s1 ZINC001137685260 1045932399 /nfs/dbraw/zinc/93/23/99/1045932399.db2.gz GJNDMBHXVNNNPE-UHFFFAOYSA-N 1 2 305.443 4.065 20 0 DIADLO CC[N@@H+](CC(=O)OC(C)(C)C)Cc1cc2ccccc2s1 ZINC001137685260 1045932411 /nfs/dbraw/zinc/93/24/11/1045932411.db2.gz GJNDMBHXVNNNPE-UHFFFAOYSA-N 1 2 305.443 4.065 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2c[nH]c3ccc(Cl)cc23)no1 ZINC001137708385 1045940821 /nfs/dbraw/zinc/94/08/21/1045940821.db2.gz RPCIJAWUECRQRZ-KRWDZBQOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2c[nH]c3ccc(Cl)cc23)no1 ZINC001137708385 1045940829 /nfs/dbraw/zinc/94/08/29/1045940829.db2.gz RPCIJAWUECRQRZ-KRWDZBQOSA-N 1 2 315.804 4.455 20 0 DIADLO CCOc1ccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000192899815 1045952523 /nfs/dbraw/zinc/95/25/23/1045952523.db2.gz WQZLNPLGTZJWDJ-OAHLLOKOSA-N 1 2 307.397 4.444 20 0 DIADLO CCOc1ccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000192899802 1045953572 /nfs/dbraw/zinc/95/35/72/1045953572.db2.gz WQZLNPLGTZJWDJ-HNNXBMFYSA-N 1 2 307.397 4.444 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)c2nccn21 ZINC000453160310 1045960824 /nfs/dbraw/zinc/96/08/24/1045960824.db2.gz FKQUNSKELVBFGQ-YGRLFVJLSA-N 1 2 322.239 4.475 20 0 DIADLO C[N@H+](Cc1nc(Br)cs1)[C@@H]1CCc2ccccc21 ZINC001137783535 1045965375 /nfs/dbraw/zinc/96/53/75/1045965375.db2.gz XTIVJINAGUDRIH-GFCCVEGCSA-N 1 2 323.259 4.025 20 0 DIADLO C[N@@H+](Cc1nc(Br)cs1)[C@@H]1CCc2ccccc21 ZINC001137783535 1045965383 /nfs/dbraw/zinc/96/53/83/1045965383.db2.gz XTIVJINAGUDRIH-GFCCVEGCSA-N 1 2 323.259 4.025 20 0 DIADLO Brc1csc(C[N@@H+]2CCC3(C2)CCCCC3)n1 ZINC001137783046 1045965402 /nfs/dbraw/zinc/96/54/02/1045965402.db2.gz FGAKSRCOSRPISY-UHFFFAOYSA-N 1 2 315.280 4.062 20 0 DIADLO Brc1csc(C[N@H+]2CCC3(C2)CCCCC3)n1 ZINC001137783046 1045965403 /nfs/dbraw/zinc/96/54/03/1045965403.db2.gz FGAKSRCOSRPISY-UHFFFAOYSA-N 1 2 315.280 4.062 20 0 DIADLO CN(C)c1cc[nH+]c(NC(=O)c2ccc(-c3ccccc3)cc2)c1 ZINC001137799580 1045968195 /nfs/dbraw/zinc/96/81/95/1045968195.db2.gz CZKMKIHDUKEPMF-UHFFFAOYSA-N 1 2 317.392 4.067 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000531841937 1045971469 /nfs/dbraw/zinc/97/14/69/1045971469.db2.gz LQWZLRGPRCKDIO-KUHUBIRLSA-N 1 2 317.379 4.273 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000531841937 1045971479 /nfs/dbraw/zinc/97/14/79/1045971479.db2.gz LQWZLRGPRCKDIO-KUHUBIRLSA-N 1 2 317.379 4.273 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000531841936 1045971773 /nfs/dbraw/zinc/97/17/73/1045971773.db2.gz LQWZLRGPRCKDIO-IFXJQAMLSA-N 1 2 317.379 4.273 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000531841936 1045971783 /nfs/dbraw/zinc/97/17/83/1045971783.db2.gz LQWZLRGPRCKDIO-IFXJQAMLSA-N 1 2 317.379 4.273 20 0 DIADLO Cc1ccc(C[NH2+]C2(c3ccccc3Cl)CC2)c(Cl)n1 ZINC000829482797 1045978498 /nfs/dbraw/zinc/97/84/98/1045978498.db2.gz ABYFBHXKPIESKL-UHFFFAOYSA-N 1 2 307.224 4.476 20 0 DIADLO C[C@@H]1CC[C@H]([NH2+]Cc2ncn(-c3ccccc3)n2)c2sccc21 ZINC000453214593 1045986105 /nfs/dbraw/zinc/98/61/05/1045986105.db2.gz BWKVIIAHSHCKPI-CJNGLKHVSA-N 1 2 324.453 4.057 20 0 DIADLO Cc1cccc(F)c1NC(=O)C[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC001137875622 1045993931 /nfs/dbraw/zinc/99/39/31/1045993931.db2.gz DJXIJNZFDPMNIG-OAHLLOKOSA-N 1 2 323.371 4.018 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)cc(F)c2F)cc1 ZINC001137872575 1045993950 /nfs/dbraw/zinc/99/39/50/1045993950.db2.gz WAWQZTCFNXQCLT-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)cc(F)c2F)cc1 ZINC001137872575 1045993956 /nfs/dbraw/zinc/99/39/56/1045993956.db2.gz WAWQZTCFNXQCLT-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1sc(-c2cccnc2)nc1C)C(F)F ZINC000453233121 1045997057 /nfs/dbraw/zinc/99/70/57/1045997057.db2.gz HDPUXYYVAIIMDI-SKDRFNHKSA-N 1 2 311.401 4.208 20 0 DIADLO CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]Cc1csc(N)n1 ZINC000902497928 1046005933 /nfs/dbraw/zinc/00/59/33/1046005933.db2.gz BUPBBEOQGMOWRK-NSHDSACASA-N 1 2 315.442 4.193 20 0 DIADLO C[N@@H+](Cc1cc(Cl)cc(Cl)c1)Cn1cccnc1=S ZINC000193423574 1046007407 /nfs/dbraw/zinc/00/74/07/1046007407.db2.gz KSARZBUHPLCODF-UHFFFAOYSA-N 1 2 314.241 4.009 20 0 DIADLO C[N@H+](Cc1cc(Cl)cc(Cl)c1)Cn1cccnc1=S ZINC000193423574 1046007414 /nfs/dbraw/zinc/00/74/14/1046007414.db2.gz KSARZBUHPLCODF-UHFFFAOYSA-N 1 2 314.241 4.009 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1csc(N)n1)c1ccc(Cl)cc1F ZINC000902497850 1046007569 /nfs/dbraw/zinc/00/75/69/1046007569.db2.gz ANDYAHKWENCXIG-CYBMUJFWSA-N 1 2 313.829 4.005 20 0 DIADLO Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+][C@H](C)C(C)(F)F ZINC000453283845 1046013561 /nfs/dbraw/zinc/01/35/61/1046013561.db2.gz IQFGRQLCPGICJC-MWLCHTKSSA-N 1 2 311.401 4.208 20 0 DIADLO FC[C@]1(C(F)(F)F)CC[N@H+](Cc2cccc(Cl)c2F)C1 ZINC001137957869 1046032915 /nfs/dbraw/zinc/03/29/15/1046032915.db2.gz RXMNVFNYYNOBFD-GFCCVEGCSA-N 1 2 313.697 4.203 20 0 DIADLO Cc1ccc2nc(Cl)c(C[N@@H+](C)C3CC(F)(F)C3)cc2c1 ZINC001137918692 1046013750 /nfs/dbraw/zinc/01/37/50/1046013750.db2.gz MBFGOJFZRVGMGR-UHFFFAOYSA-N 1 2 310.775 4.426 20 0 DIADLO Cc1ccc2nc(Cl)c(C[N@H+](C)C3CC(F)(F)C3)cc2c1 ZINC001137918692 1046013765 /nfs/dbraw/zinc/01/37/65/1046013765.db2.gz MBFGOJFZRVGMGR-UHFFFAOYSA-N 1 2 310.775 4.426 20 0 DIADLO FC[C@]1(C(F)(F)F)CC[N@@H+](Cc2cccc(Cl)c2F)C1 ZINC001137957869 1046032933 /nfs/dbraw/zinc/03/29/33/1046032933.db2.gz RXMNVFNYYNOBFD-GFCCVEGCSA-N 1 2 313.697 4.203 20 0 DIADLO Cc1ccc2nc(Cl)c(C[N@H+]3CCOC[C@H]3C(C)C)cc2c1 ZINC001137922599 1046015066 /nfs/dbraw/zinc/01/50/66/1046015066.db2.gz DBBNQMMEGSNNMU-KRWDZBQOSA-N 1 2 318.848 4.053 20 0 DIADLO Cc1ccc2nc(Cl)c(C[N@@H+]3CCOC[C@H]3C(C)C)cc2c1 ZINC001137922599 1046015082 /nfs/dbraw/zinc/01/50/82/1046015082.db2.gz DBBNQMMEGSNNMU-KRWDZBQOSA-N 1 2 318.848 4.053 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@H](C)c2nc3ccccc3s2)n1 ZINC000080273951 1046016114 /nfs/dbraw/zinc/01/61/14/1046016114.db2.gz ZEWDOKKXRGTQOO-WDEREUQCSA-N 1 2 303.456 4.473 20 0 DIADLO C[N@H+](Cn1c(-c2ccccc2)csc1=S)[C@H]1CCSC1 ZINC000755791175 1046016392 /nfs/dbraw/zinc/01/63/92/1046016392.db2.gz BVCNXBKEKVHRSK-ZDUSSCGKSA-N 1 2 322.524 4.341 20 0 DIADLO C[N@@H+](Cn1c(-c2ccccc2)csc1=S)[C@H]1CCSC1 ZINC000755791175 1046016405 /nfs/dbraw/zinc/01/64/05/1046016405.db2.gz BVCNXBKEKVHRSK-ZDUSSCGKSA-N 1 2 322.524 4.341 20 0 DIADLO Cc1ccc2[nH]c([C@H]3CCC[N@@H+]3C[C@H]3CC3(Cl)Cl)nc2c1 ZINC000829859426 1046019644 /nfs/dbraw/zinc/01/96/44/1046019644.db2.gz RBBSUWXSIGJBTR-BXUZGUMPSA-N 1 2 324.255 4.202 20 0 DIADLO Cc1ccc2[nH]c([C@H]3CCC[N@H+]3C[C@H]3CC3(Cl)Cl)nc2c1 ZINC000829859426 1046019658 /nfs/dbraw/zinc/01/96/58/1046019658.db2.gz RBBSUWXSIGJBTR-BXUZGUMPSA-N 1 2 324.255 4.202 20 0 DIADLO Cc1ccc2nc([C@H]3CCC[N@@H+]3C[C@H]3CC3(Cl)Cl)[nH]c2c1 ZINC000829859426 1046019666 /nfs/dbraw/zinc/01/96/66/1046019666.db2.gz RBBSUWXSIGJBTR-BXUZGUMPSA-N 1 2 324.255 4.202 20 0 DIADLO Cc1ccc2nc([C@H]3CCC[N@H+]3C[C@H]3CC3(Cl)Cl)[nH]c2c1 ZINC000829859426 1046019682 /nfs/dbraw/zinc/01/96/82/1046019682.db2.gz RBBSUWXSIGJBTR-BXUZGUMPSA-N 1 2 324.255 4.202 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)cnc1Cl ZINC000802656618 1046024808 /nfs/dbraw/zinc/02/48/08/1046024808.db2.gz NFNPAMDZTDJLAG-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@](F)(c3ccccc3)C2)cnc1Cl ZINC000802656618 1046024825 /nfs/dbraw/zinc/02/48/25/1046024825.db2.gz NFNPAMDZTDJLAG-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1csc(Cl)n1 ZINC000829910741 1046026217 /nfs/dbraw/zinc/02/62/17/1046026217.db2.gz LKAYKKNXDBIPHJ-CQSZACIVSA-N 1 2 310.850 4.388 20 0 DIADLO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1csc(Cl)n1 ZINC000829910741 1046026232 /nfs/dbraw/zinc/02/62/32/1046026232.db2.gz LKAYKKNXDBIPHJ-CQSZACIVSA-N 1 2 310.850 4.388 20 0 DIADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1ccc(SC(F)(F)F)cc1 ZINC001137956440 1046032329 /nfs/dbraw/zinc/03/23/29/1046032329.db2.gz OAEPOJFPXNPALU-CQSZACIVSA-N 1 2 317.376 4.242 20 0 DIADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1ccc(SC(F)(F)F)cc1 ZINC001137956440 1046032340 /nfs/dbraw/zinc/03/23/40/1046032340.db2.gz OAEPOJFPXNPALU-CQSZACIVSA-N 1 2 317.376 4.242 20 0 DIADLO Cn1cc(Cl)c(C[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)n1 ZINC000453322433 1046037561 /nfs/dbraw/zinc/03/75/61/1046037561.db2.gz OYEQSBXWYNUSHG-HNNXBMFYSA-N 1 2 323.843 4.480 20 0 DIADLO CCC[C@@H]1CCCC[C@H]1C[NH2+][C@H](c1cccs1)c1nnc[nH]1 ZINC000453339390 1046042198 /nfs/dbraw/zinc/04/21/98/1046042198.db2.gz BKYWFSJAOVPZSJ-IJEWVQPXSA-N 1 2 318.490 4.152 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nccn1CC)c1cccc(Cl)c1F ZINC000453353041 1046052119 /nfs/dbraw/zinc/05/21/19/1046052119.db2.gz NGCAANWWMHUEKA-BXUZGUMPSA-N 1 2 309.816 4.497 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cccc(C(F)(F)F)c2F)cn1 ZINC001138012171 1046058149 /nfs/dbraw/zinc/05/81/49/1046058149.db2.gz ZKNYKKWMFHJFAV-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cccc(C(F)(F)F)c2F)cn1 ZINC001138012171 1046058164 /nfs/dbraw/zinc/05/81/64/1046058164.db2.gz ZKNYKKWMFHJFAV-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO CCCn1cc([C@H](C)[NH2+][C@H](C)c2oc3ccccc3c2C)nn1 ZINC000902765630 1046063894 /nfs/dbraw/zinc/06/38/94/1046063894.db2.gz REUVPLNSHFPTGD-UONOGXRCSA-N 1 2 312.417 4.155 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(C)ns1)c1nc(C(F)(F)F)cs1 ZINC000634532961 1046074342 /nfs/dbraw/zinc/07/43/42/1046074342.db2.gz XVVQDLACJQFSQA-VIFPVBQESA-N 1 2 321.393 4.168 20 0 DIADLO CC(=O)[C@@H]1CCC[N@H+](Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC001138052076 1046074608 /nfs/dbraw/zinc/07/46/08/1046074608.db2.gz SSCVUQIKOUHJJS-GFCCVEGCSA-N 1 2 319.754 4.160 20 0 DIADLO CC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC001138052076 1046074622 /nfs/dbraw/zinc/07/46/22/1046074622.db2.gz SSCVUQIKOUHJJS-GFCCVEGCSA-N 1 2 319.754 4.160 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2)C[C@H](c2ccsc2)O1 ZINC000532098069 1046098749 /nfs/dbraw/zinc/09/87/49/1046098749.db2.gz FIXZMCXYJJVQKK-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2)C[C@H](c2ccsc2)O1 ZINC000532098069 1046098760 /nfs/dbraw/zinc/09/87/60/1046098760.db2.gz FIXZMCXYJJVQKK-MLGOLLRUSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)ccc(C)c2F)cn1 ZINC001138119749 1046100022 /nfs/dbraw/zinc/10/00/22/1046100022.db2.gz RMVOKEHQNBJIIX-KRWDZBQOSA-N 1 2 302.368 4.314 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)ccc(C)c2F)cn1 ZINC001138119749 1046100025 /nfs/dbraw/zinc/10/00/25/1046100025.db2.gz RMVOKEHQNBJIIX-KRWDZBQOSA-N 1 2 302.368 4.314 20 0 DIADLO Fc1c(Cl)cccc1C[NH2+]Cc1ncoc1-c1ccccc1 ZINC000532171205 1046105644 /nfs/dbraw/zinc/10/56/44/1046105644.db2.gz DBDJBMDVNXKAQO-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO C[C@@H]1COCC[C@@H]1[NH2+]c1ccc(N(C)Cc2ccccc2)cc1 ZINC000195085958 1046113422 /nfs/dbraw/zinc/11/34/22/1046113422.db2.gz JPOWKROBWGLUDF-UZLBHIALSA-N 1 2 310.441 4.160 20 0 DIADLO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1nc2ccc(C)cc2[nH]1 ZINC000532240772 1046124444 /nfs/dbraw/zinc/12/44/44/1046124444.db2.gz WKKMAYOTBUXFJT-CQSZACIVSA-N 1 2 309.413 4.039 20 0 DIADLO Fc1cc(F)c(F)c(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)c1F ZINC001138236351 1046124926 /nfs/dbraw/zinc/12/49/26/1046124926.db2.gz WKGACSQHVJWIKI-LLVKDONJSA-N 1 2 324.321 4.018 20 0 DIADLO Fc1cc(F)c(F)c(C[N@H+]2CCC[C@@H](c3ccccn3)C2)c1F ZINC001138236351 1046124929 /nfs/dbraw/zinc/12/49/29/1046124929.db2.gz WKGACSQHVJWIKI-LLVKDONJSA-N 1 2 324.321 4.018 20 0 DIADLO C[C@H](C1CC1)n1cc(N[C@@H](C)c2cccc(-n3cc[nH+]c3)c2)cn1 ZINC000902962582 1046130759 /nfs/dbraw/zinc/13/07/59/1046130759.db2.gz HJRODWGMVPLESE-LSDHHAIUSA-N 1 2 321.428 4.213 20 0 DIADLO CC[N@H+](Cc1cccc(OC(C)(C)C)n1)Cc1ccccc1F ZINC001138283801 1046138619 /nfs/dbraw/zinc/13/86/19/1046138619.db2.gz KFXAYOPLZAXRAQ-UHFFFAOYSA-N 1 2 316.420 4.420 20 0 DIADLO CC[N@@H+](Cc1cccc(OC(C)(C)C)n1)Cc1ccccc1F ZINC001138283801 1046138623 /nfs/dbraw/zinc/13/86/23/1046138623.db2.gz KFXAYOPLZAXRAQ-UHFFFAOYSA-N 1 2 316.420 4.420 20 0 DIADLO Cc1ccccc1C(N)=[NH+]OCc1ncc(-c2ccccc2C)o1 ZINC000756847523 1046142571 /nfs/dbraw/zinc/14/25/71/1046142571.db2.gz DBDHVHSVZVJONJ-UHFFFAOYSA-N 1 2 321.380 4.005 20 0 DIADLO C[C@@H]([NH2+]Cc1noc2ccccc12)c1ccc(C(F)(F)F)cn1 ZINC000903046332 1046147091 /nfs/dbraw/zinc/14/70/91/1046147091.db2.gz ZWGYAUYEKHOLKM-SNVBAGLBSA-N 1 2 321.302 4.092 20 0 DIADLO CC(C)[C@@H]([NH2+][C@H](C)c1ccc(-c2ccccc2)o1)c1nncn1C ZINC000903062358 1046153038 /nfs/dbraw/zinc/15/30/38/1046153038.db2.gz ULPAMIDQFAVQDS-RDTXWAMCSA-N 1 2 324.428 4.123 20 0 DIADLO CC(C)[C@H]([NH2+][C@H](C)c1ccc(-c2ccccc2)o1)c1nncn1C ZINC000903062356 1046153309 /nfs/dbraw/zinc/15/33/09/1046153309.db2.gz ULPAMIDQFAVQDS-KDOFPFPSSA-N 1 2 324.428 4.123 20 0 DIADLO CC/C(C)=C(\C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000779886746 1046154793 /nfs/dbraw/zinc/15/47/93/1046154793.db2.gz DPPDYDNRTCVYRA-VAWYXSNFSA-N 1 2 303.793 4.211 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1F)Cc1cc(F)ccc1OC ZINC001138376838 1046160236 /nfs/dbraw/zinc/16/02/36/1046160236.db2.gz VJBHXWVACGZZLT-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1F)Cc1cc(F)ccc1OC ZINC001138376838 1046160241 /nfs/dbraw/zinc/16/02/41/1046160241.db2.gz VJBHXWVACGZZLT-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO Cn1c2ccccc2nc1C[N@@H+]1CCCC[C@@H]1c1ccccc1F ZINC001138378628 1046160327 /nfs/dbraw/zinc/16/03/27/1046160327.db2.gz HSMOCYUYVAVTAA-GOSISDBHSA-N 1 2 323.415 4.440 20 0 DIADLO Cn1c2ccccc2nc1C[N@H+]1CCCC[C@@H]1c1ccccc1F ZINC001138378628 1046160330 /nfs/dbraw/zinc/16/03/30/1046160330.db2.gz HSMOCYUYVAVTAA-GOSISDBHSA-N 1 2 323.415 4.440 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000903089701 1046160433 /nfs/dbraw/zinc/16/04/33/1046160433.db2.gz ZMANNZIKCXYROC-OAHLLOKOSA-N 1 2 319.836 4.018 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000903089701 1046160440 /nfs/dbraw/zinc/16/04/40/1046160440.db2.gz ZMANNZIKCXYROC-OAHLLOKOSA-N 1 2 319.836 4.018 20 0 DIADLO COc1cccc(F)c1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001138387088 1046161641 /nfs/dbraw/zinc/16/16/41/1046161641.db2.gz XSRVECYVFGZAJV-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(F)c1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001138387088 1046161646 /nfs/dbraw/zinc/16/16/46/1046161646.db2.gz XSRVECYVFGZAJV-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2ccc(C(F)(F)F)s2)s1 ZINC000717957851 1046163433 /nfs/dbraw/zinc/16/34/33/1046163433.db2.gz PKMWRJNHRRVKHB-ZETCQYMHSA-N 1 2 321.393 4.032 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@@H]2[NH2+]Cc1ncccc1F ZINC000903128493 1046169527 /nfs/dbraw/zinc/16/95/27/1046169527.db2.gz ZPTKDZUEPMAOEL-AWEZNQCLSA-N 1 2 320.795 4.050 20 0 DIADLO COc1cc(C[N@@H+]2CCc3c(F)cccc3C2)ccc1SC ZINC000757148932 1046170356 /nfs/dbraw/zinc/17/03/56/1046170356.db2.gz JETVXLIBUGNLKA-UHFFFAOYSA-N 1 2 317.429 4.115 20 0 DIADLO COc1cc(C[N@H+]2CCc3c(F)cccc3C2)ccc1SC ZINC000757148932 1046170361 /nfs/dbraw/zinc/17/03/61/1046170361.db2.gz JETVXLIBUGNLKA-UHFFFAOYSA-N 1 2 317.429 4.115 20 0 DIADLO CCCCC[C@@H]1CCC[N@@H+]1Cc1ncc(Br)s1 ZINC001168152718 1046171149 /nfs/dbraw/zinc/17/11/49/1046171149.db2.gz BOPXINVUZXANCH-LLVKDONJSA-N 1 2 317.296 4.450 20 0 DIADLO CCCCC[C@@H]1CCC[N@H+]1Cc1ncc(Br)s1 ZINC001168152718 1046171157 /nfs/dbraw/zinc/17/11/57/1046171157.db2.gz BOPXINVUZXANCH-LLVKDONJSA-N 1 2 317.296 4.450 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccc(Cn3cc[nH+]c3)cc2)cc1C ZINC001202826391 1046172132 /nfs/dbraw/zinc/17/21/32/1046172132.db2.gz BBTALHWUKOYMPC-UHFFFAOYSA-N 1 2 320.396 4.192 20 0 DIADLO Cc1c2cc(F)ccc2[nH]c1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC001138413970 1046172918 /nfs/dbraw/zinc/17/29/18/1046172918.db2.gz JSNFUKJQEDAISQ-MRXNPFEDSA-N 1 2 315.417 4.409 20 0 DIADLO Cc1c2cc(F)ccc2[nH]c1C[N@H+]1CCC[C@@H]1c1nccs1 ZINC001138413970 1046172924 /nfs/dbraw/zinc/17/29/24/1046172924.db2.gz JSNFUKJQEDAISQ-MRXNPFEDSA-N 1 2 315.417 4.409 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCC[C@@H]2c2ccc(C)nc2)cc1F ZINC001138426089 1046178063 /nfs/dbraw/zinc/17/80/63/1046178063.db2.gz LTUQRTLWJFVWJF-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCC[C@@H]2c2ccc(C)nc2)cc1F ZINC001138426089 1046178071 /nfs/dbraw/zinc/17/80/71/1046178071.db2.gz LTUQRTLWJFVWJF-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CCCc3ccc(OC)c(Cl)c32)co1 ZINC000903188103 1046187234 /nfs/dbraw/zinc/18/72/34/1046187234.db2.gz YCNNDTWTOTYURE-CYBMUJFWSA-N 1 2 320.820 4.066 20 0 DIADLO CCCc1nc(C[N@H+](C)[C@H](C)[C@H](C)c2ccc(Cl)cc2)no1 ZINC000475743769 1046193418 /nfs/dbraw/zinc/19/34/18/1046193418.db2.gz LDEUBSXZDAXUHU-QWHCGFSZSA-N 1 2 321.852 4.300 20 0 DIADLO CCCc1nc(C[N@@H+](C)[C@H](C)[C@H](C)c2ccc(Cl)cc2)no1 ZINC000475743769 1046193424 /nfs/dbraw/zinc/19/34/24/1046193424.db2.gz LDEUBSXZDAXUHU-QWHCGFSZSA-N 1 2 321.852 4.300 20 0 DIADLO C[C@@H]1C[C@H](C)[C@H](C)[N@H+](CCC(=O)Nc2ccccc2Cl)C1 ZINC000475745651 1046195082 /nfs/dbraw/zinc/19/50/82/1046195082.db2.gz GIULNGURHYRDKQ-RDBSUJKOSA-N 1 2 308.853 4.035 20 0 DIADLO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](CCC(=O)Nc2ccccc2Cl)C1 ZINC000475745651 1046195089 /nfs/dbraw/zinc/19/50/89/1046195089.db2.gz GIULNGURHYRDKQ-RDBSUJKOSA-N 1 2 308.853 4.035 20 0 DIADLO C[C@H](Cc1ccc(Cl)cc1)N1CC[C@H]([NH3+])c2ccccc21 ZINC001168154567 1046195152 /nfs/dbraw/zinc/19/51/52/1046195152.db2.gz NCPJSZSLNGXXRT-DYVFJYSZSA-N 1 2 300.833 4.181 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1CCc2ccc(F)cc2C1 ZINC001138482487 1046196297 /nfs/dbraw/zinc/19/62/97/1046196297.db2.gz AHUHHYBGIJFCJT-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1CCc2ccc(F)cc2C1 ZINC001138482487 1046196303 /nfs/dbraw/zinc/19/63/03/1046196303.db2.gz AHUHHYBGIJFCJT-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CC(C)CC[C@@H]([NH2+]Cc1nc(CN(C)C)cs1)c1ccoc1 ZINC000903220939 1046197865 /nfs/dbraw/zinc/19/78/65/1046197865.db2.gz RMJMIJLPXQNDIE-MRXNPFEDSA-N 1 2 321.490 4.065 20 0 DIADLO CC(=O)c1c(C)cc(C)c(C[N@@H+]2CCn3cccc3[C@@H]2C)c1C ZINC000023706855 1046207067 /nfs/dbraw/zinc/20/70/67/1046207067.db2.gz GLRQACFOCKPUNK-INIZCTEOSA-N 1 2 310.441 4.193 20 0 DIADLO CC(=O)c1c(C)cc(C)c(C[N@H+]2CCn3cccc3[C@@H]2C)c1C ZINC000023706855 1046207077 /nfs/dbraw/zinc/20/70/77/1046207077.db2.gz GLRQACFOCKPUNK-INIZCTEOSA-N 1 2 310.441 4.193 20 0 DIADLO CCc1nc(C)c([C@H](C)[NH2+][C@@H]2c3ccccc3OC[C@@H]2F)s1 ZINC000903270373 1046215049 /nfs/dbraw/zinc/21/50/49/1046215049.db2.gz DKOMICPRRXIUKH-DETPVDSQSA-N 1 2 320.433 4.136 20 0 DIADLO CSc1ccc(Cl)c(NC(=O)[C@@H]2CC[N@@H+]2C2CCCC2)c1 ZINC000636159052 1046216187 /nfs/dbraw/zinc/21/61/87/1046216187.db2.gz BLZSMCWAYKRJSP-HNNXBMFYSA-N 1 2 324.877 4.017 20 0 DIADLO CSc1ccc(Cl)c(NC(=O)[C@@H]2CC[N@H+]2C2CCCC2)c1 ZINC000636159052 1046216199 /nfs/dbraw/zinc/21/61/99/1046216199.db2.gz BLZSMCWAYKRJSP-HNNXBMFYSA-N 1 2 324.877 4.017 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1cc(Cl)ccc1C ZINC000102517544 1046216683 /nfs/dbraw/zinc/21/66/83/1046216683.db2.gz LLTARFYNWSXZNT-CYBMUJFWSA-N 1 2 320.820 4.091 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1cc(Cl)ccc1C ZINC000102517544 1046216697 /nfs/dbraw/zinc/21/66/97/1046216697.db2.gz LLTARFYNWSXZNT-CYBMUJFWSA-N 1 2 320.820 4.091 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1cccc(Cl)c1C ZINC000102517732 1046217436 /nfs/dbraw/zinc/21/74/36/1046217436.db2.gz BBFHKUJFXZFJGE-ZDUSSCGKSA-N 1 2 320.820 4.091 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1cccc(Cl)c1C ZINC000102517732 1046217455 /nfs/dbraw/zinc/21/74/55/1046217455.db2.gz BBFHKUJFXZFJGE-ZDUSSCGKSA-N 1 2 320.820 4.091 20 0 DIADLO Cc1ccc2c(c1)OCCC[C@H]2[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000903313085 1046235308 /nfs/dbraw/zinc/23/53/08/1046235308.db2.gz HXFYTRVKGGGVSA-OAHLLOKOSA-N 1 2 314.429 4.284 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1cnn(-c3ccccc3)c1)CC2 ZINC001138599170 1046235319 /nfs/dbraw/zinc/23/53/19/1046235319.db2.gz XVHBCQXAVJITIJ-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1cnn(-c3ccccc3)c1)CC2 ZINC001138599170 1046235330 /nfs/dbraw/zinc/23/53/30/1046235330.db2.gz XVHBCQXAVJITIJ-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Cc1cc(C)cc(NC(=O)Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001202845607 1046236587 /nfs/dbraw/zinc/23/65/87/1046236587.db2.gz XDSMDPGMJUBQEO-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO CC[C@@H]([NH2+][C@@H](c1ncccn1)C1CC1)c1cccc(Cl)c1F ZINC000903327470 1046241379 /nfs/dbraw/zinc/24/13/79/1046241379.db2.gz UKIVQBDYFLOUQK-GDBMZVCRSA-N 1 2 319.811 4.461 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1ncccn1)C1CC1)c1cccc(Cl)c1F ZINC000903327471 1046241676 /nfs/dbraw/zinc/24/16/76/1046241676.db2.gz UKIVQBDYFLOUQK-GOEBONIOSA-N 1 2 319.811 4.461 20 0 DIADLO CSc1ccc([C@H](C)[NH2+][C@H](c2ncccn2)C2CC2)cc1F ZINC000903327768 1046242335 /nfs/dbraw/zinc/24/23/35/1046242335.db2.gz YNYUUMHBGMTPDZ-ZBEGNZNMSA-N 1 2 317.433 4.140 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@H](c2ccccn2)C2CC2)cs1 ZINC000903334953 1046246522 /nfs/dbraw/zinc/24/65/22/1046246522.db2.gz JDBXOTXFHONGJG-LRDDRELGSA-N 1 2 301.459 4.463 20 0 DIADLO Cc1nc(CSCc2ccc(-n3cc[nH+]c3)cc2C)cs1 ZINC000190936800 1046252987 /nfs/dbraw/zinc/25/29/87/1046252987.db2.gz GKZLPBPIPMQAPB-UHFFFAOYSA-N 1 2 315.467 4.379 20 0 DIADLO CCC[C@H]([NH2+]Cc1cn(C)cn1)c1ccc(Cl)cc1Cl ZINC000903350934 1046254722 /nfs/dbraw/zinc/25/47/22/1046254722.db2.gz FZQBAUHUGBXGGF-HNNXBMFYSA-N 1 2 312.244 4.358 20 0 DIADLO C[C@H]([NH2+]Cc1cn(C)cn1)c1ccc(Cl)c(Cl)c1Cl ZINC000903351664 1046254992 /nfs/dbraw/zinc/25/49/92/1046254992.db2.gz OBLFHLRYCJSMED-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO C[NH+](C)c1ccc(NCc2nc3ccc(F)cc3s2)cc1 ZINC000758379591 1046265609 /nfs/dbraw/zinc/26/56/09/1046265609.db2.gz DMLMOGPVSUOVGO-UHFFFAOYSA-N 1 2 301.390 4.114 20 0 DIADLO F[C@H]1C[N@H+](Cc2c(Cl)[nH]c3ccccc32)CCCC1(F)F ZINC001138686561 1046269250 /nfs/dbraw/zinc/26/92/50/1046269250.db2.gz QKADCRDKYXSRDA-ZDUSSCGKSA-N 1 2 316.754 4.391 20 0 DIADLO F[C@H]1C[N@@H+](Cc2c(Cl)[nH]c3ccccc32)CCCC1(F)F ZINC001138686561 1046269258 /nfs/dbraw/zinc/26/92/58/1046269258.db2.gz QKADCRDKYXSRDA-ZDUSSCGKSA-N 1 2 316.754 4.391 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2c(C)cccc2Cl)c(OC)c1 ZINC001138722510 1046276042 /nfs/dbraw/zinc/27/60/42/1046276042.db2.gz VTWHRNHZRXZCBY-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2c(C)cccc2Cl)c(OC)c1 ZINC001138722510 1046276053 /nfs/dbraw/zinc/27/60/53/1046276053.db2.gz VTWHRNHZRXZCBY-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cc1OC ZINC000637813559 1046279331 /nfs/dbraw/zinc/27/93/31/1046279331.db2.gz BWOWPLLFYCBRJX-OAHLLOKOSA-N 1 2 320.820 4.022 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)cc1OC ZINC000637813559 1046279341 /nfs/dbraw/zinc/27/93/41/1046279341.db2.gz BWOWPLLFYCBRJX-OAHLLOKOSA-N 1 2 320.820 4.022 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@](C)(F)C2)c1OC ZINC001138741807 1046286020 /nfs/dbraw/zinc/28/60/20/1046286020.db2.gz BIFNNEJOUXSYBK-MRXNPFEDSA-N 1 2 315.816 4.071 20 0 DIADLO COc1cc(Cl)cc(C[N@H+]2CCCC[C@@](C)(F)C2)c1OC ZINC001138741807 1046286029 /nfs/dbraw/zinc/28/60/29/1046286029.db2.gz BIFNNEJOUXSYBK-MRXNPFEDSA-N 1 2 315.816 4.071 20 0 DIADLO CC[N@H+](Cc1cnc(CCOC)s1)Cc1ccccc1Cl ZINC000637911799 1046286064 /nfs/dbraw/zinc/28/60/64/1046286064.db2.gz JXIHFUQMVDHJQS-UHFFFAOYSA-N 1 2 324.877 4.008 20 0 DIADLO CC[N@@H+](Cc1cnc(CCOC)s1)Cc1ccccc1Cl ZINC000637911799 1046286073 /nfs/dbraw/zinc/28/60/73/1046286073.db2.gz JXIHFUQMVDHJQS-UHFFFAOYSA-N 1 2 324.877 4.008 20 0 DIADLO C[C@@H]1CCCCC[N@@H+]1Cc1cc(Br)cnc1Cl ZINC001138944514 1046333856 /nfs/dbraw/zinc/33/38/56/1046333856.db2.gz QJERTKSPFSIWGM-SNVBAGLBSA-N 1 2 317.658 4.262 20 0 DIADLO C[C@@H]1CCCCC[N@H+]1Cc1cc(Br)cnc1Cl ZINC001138944514 1046333869 /nfs/dbraw/zinc/33/38/69/1046333869.db2.gz QJERTKSPFSIWGM-SNVBAGLBSA-N 1 2 317.658 4.262 20 0 DIADLO C[C@@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)[C@@H]1CC1(F)F ZINC000638227017 1046304605 /nfs/dbraw/zinc/30/46/05/1046304605.db2.gz LWTNXMWDGAFLDW-WBMJQRKESA-N 1 2 317.383 4.342 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)c(C)c1 ZINC000638399055 1046319324 /nfs/dbraw/zinc/31/93/24/1046319324.db2.gz XZAWETJIKHPPOE-QAPCUYQASA-N 1 2 312.461 4.394 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(F)cnc2Cl)c1 ZINC001138895300 1046320785 /nfs/dbraw/zinc/32/07/85/1046320785.db2.gz FTDWULZBYAOENC-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2cc(F)cnc2Cl)c1 ZINC001138895300 1046320801 /nfs/dbraw/zinc/32/08/01/1046320801.db2.gz FTDWULZBYAOENC-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)CCOc1ccccc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000638478793 1046324855 /nfs/dbraw/zinc/32/48/55/1046324855.db2.gz OCQXTZKTPULCFH-UHFFFAOYSA-N 1 2 314.429 4.267 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@@H]3CC[C@H](C)C3)c2)[nH+]c1C ZINC000759164452 1046327882 /nfs/dbraw/zinc/32/78/82/1046327882.db2.gz YDWLDMKSMVIDMB-SWLSCSKDSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1cccc2c1CC[C@@H]2[NH2+][C@H](c1nnc[nH]1)C1CCCCC1 ZINC000638544813 1046329936 /nfs/dbraw/zinc/32/99/36/1046329936.db2.gz LEDSQFVPFWCSGI-ROUUACIJSA-N 1 2 310.445 4.012 20 0 DIADLO CCc1cccc2c1OCC[C@H]2[NH2+]Cc1nc2ccccc2o1 ZINC000638574963 1046331459 /nfs/dbraw/zinc/33/14/59/1046331459.db2.gz AJCOOZDHKPIOFH-OAHLLOKOSA-N 1 2 308.381 4.004 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Br)cnc2Cl)[C@@H](C)C1 ZINC001138945262 1046332722 /nfs/dbraw/zinc/33/27/22/1046332722.db2.gz XQDBVDPLFINOTI-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Br)cnc2Cl)[C@@H](C)C1 ZINC001138945262 1046332731 /nfs/dbraw/zinc/33/27/31/1046332731.db2.gz XQDBVDPLFINOTI-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc2ccc(F)c(F)c2n1)c1nccs1 ZINC000638664233 1046334275 /nfs/dbraw/zinc/33/42/75/1046334275.db2.gz UDRVEKOWROVBJA-CYBMUJFWSA-N 1 2 319.380 4.210 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)cc1F ZINC000638762203 1046340949 /nfs/dbraw/zinc/34/09/49/1046340949.db2.gz BWKVNCBXPIPBOY-SUMWQHHRSA-N 1 2 316.424 4.224 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@@H]1CC1(F)F ZINC000638803653 1046342196 /nfs/dbraw/zinc/34/21/96/1046342196.db2.gz GSMLJPICLVPFKF-WFASDCNBSA-N 1 2 315.367 4.057 20 0 DIADLO CC(C)c1cc(C[NH2+]Cc2csc(C(F)(F)F)c2)on1 ZINC000623419335 1046345233 /nfs/dbraw/zinc/34/52/33/1046345233.db2.gz DUNHFLFHYKLMMD-UHFFFAOYSA-N 1 2 304.337 4.168 20 0 DIADLO Fc1ccccc1OCC[NH+](Cc1ccco1)Cc1ccco1 ZINC000053138261 1046348409 /nfs/dbraw/zinc/34/84/09/1046348409.db2.gz DNULIXSSPBOKRT-UHFFFAOYSA-N 1 2 315.344 4.093 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CCc3cc(Cl)ccc3C2)cn1 ZINC000639099964 1046358464 /nfs/dbraw/zinc/35/84/64/1046358464.db2.gz PQMBOFWKCSBJGY-UHFFFAOYSA-N 1 2 308.759 4.231 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CCc3cc(Cl)ccc3C2)cn1 ZINC000639099964 1046358473 /nfs/dbraw/zinc/35/84/73/1046358473.db2.gz PQMBOFWKCSBJGY-UHFFFAOYSA-N 1 2 308.759 4.231 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000041392570 1046363922 /nfs/dbraw/zinc/36/39/22/1046363922.db2.gz RWAOGEODPCUOAR-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000041392570 1046363934 /nfs/dbraw/zinc/36/39/34/1046363934.db2.gz RWAOGEODPCUOAR-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@@H]2c2c(C)cccc2C)c(C)c[nH+]1 ZINC000666496662 1046364997 /nfs/dbraw/zinc/36/49/97/1046364997.db2.gz RUFQLCADWFWLDO-GOSISDBHSA-N 1 2 323.440 4.106 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@H]2c2c(C)cccc2C)c(C)c[nH+]1 ZINC000666496663 1046365146 /nfs/dbraw/zinc/36/51/46/1046365146.db2.gz RUFQLCADWFWLDO-SFHVURJKSA-N 1 2 323.440 4.106 20 0 DIADLO CC[N@H+](CCC(F)(F)F)CC(=O)Nc1ccc2ccccc2c1 ZINC000748305459 1046365871 /nfs/dbraw/zinc/36/58/71/1046365871.db2.gz LRDURGFHZBZWLL-UHFFFAOYSA-N 1 2 324.346 4.053 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)CC(=O)Nc1ccc2ccccc2c1 ZINC000748305459 1046365888 /nfs/dbraw/zinc/36/58/88/1046365888.db2.gz LRDURGFHZBZWLL-UHFFFAOYSA-N 1 2 324.346 4.053 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccc(Cl)cn1 ZINC000681393827 1046367285 /nfs/dbraw/zinc/36/72/85/1046367285.db2.gz FFXFWKDQTWPXRO-YMTOWFKASA-N 1 2 309.196 4.173 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(F)cc(Cl)cc2F)CCC1(F)F ZINC001139046987 1046367908 /nfs/dbraw/zinc/36/79/08/1046367908.db2.gz BQCBHQLALJVFRQ-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(F)cc(Cl)cc2F)CCC1(F)F ZINC001139046987 1046367912 /nfs/dbraw/zinc/36/79/12/1046367912.db2.gz BQCBHQLALJVFRQ-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO CC(C)c1nc(C[N@H+](C)Cc2ccc3ccn(C)c3c2)cs1 ZINC001139206420 1046369587 /nfs/dbraw/zinc/36/95/87/1046369587.db2.gz ABDHDBXAJQHQHH-UHFFFAOYSA-N 1 2 313.470 4.390 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)Cc2ccc3ccn(C)c3c2)cs1 ZINC001139206420 1046369599 /nfs/dbraw/zinc/36/95/99/1046369599.db2.gz ABDHDBXAJQHQHH-UHFFFAOYSA-N 1 2 313.470 4.390 20 0 DIADLO Cn1c[nH+]cc1CNc1ccccc1SCc1ccccc1 ZINC000759768713 1046378067 /nfs/dbraw/zinc/37/80/67/1046378067.db2.gz OJWNXVCCEVTFKZ-UHFFFAOYSA-N 1 2 309.438 4.325 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)o1 ZINC000780396462 1046384546 /nfs/dbraw/zinc/38/45/46/1046384546.db2.gz CVVYZVCCNKOEFB-YUQCYMQKSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+]2CCC[C@@H]2/C=C\c2ccccc2)o1 ZINC000780396462 1046384556 /nfs/dbraw/zinc/38/45/56/1046384556.db2.gz CVVYZVCCNKOEFB-YUQCYMQKSA-N 1 2 311.429 4.045 20 0 DIADLO CC1(C)CC[NH+](Cc2ccc(Br)nc2Cl)CC1 ZINC001139113191 1046390337 /nfs/dbraw/zinc/39/03/37/1046390337.db2.gz MDXNUKAQDXCDJE-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1ncc(Cl)s1 ZINC000225315027 1046391541 /nfs/dbraw/zinc/39/15/41/1046391541.db2.gz NLELAEXDBCSLST-NSHDSACASA-N 1 2 310.850 4.435 20 0 DIADLO CCn1ccc2c1cccc2C[N@@H+]1CCCC[C@@H]1c1noc(C)n1 ZINC001139153046 1046396263 /nfs/dbraw/zinc/39/62/63/1046396263.db2.gz CSCFNPNKRQBPEH-GOSISDBHSA-N 1 2 324.428 4.080 20 0 DIADLO CCn1ccc2c1cccc2C[N@H+]1CCCC[C@@H]1c1noc(C)n1 ZINC001139153046 1046396278 /nfs/dbraw/zinc/39/62/78/1046396278.db2.gz CSCFNPNKRQBPEH-GOSISDBHSA-N 1 2 324.428 4.080 20 0 DIADLO CC(C)c1nc(C[N@H+](C)Cc2ccc3cccnc3c2)cs1 ZINC001139167943 1046399542 /nfs/dbraw/zinc/39/95/42/1046399542.db2.gz GSMHKJLEPOHZSL-UHFFFAOYSA-N 1 2 311.454 4.447 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)Cc2ccc3cccnc3c2)cs1 ZINC001139167943 1046399554 /nfs/dbraw/zinc/39/95/54/1046399554.db2.gz GSMHKJLEPOHZSL-UHFFFAOYSA-N 1 2 311.454 4.447 20 0 DIADLO CN(C(=O)c1ccc(-n2cc[nH+]c2)cc1)C1CCCCCCC1 ZINC000748750845 1046401147 /nfs/dbraw/zinc/40/11/47/1046401147.db2.gz XHCUHRDDABUGQU-UHFFFAOYSA-N 1 2 311.429 4.057 20 0 DIADLO Clc1cc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)ccn1 ZINC000748798873 1046403817 /nfs/dbraw/zinc/40/38/17/1046403817.db2.gz SUTNEAFDWFHFMH-SFHVURJKSA-N 1 2 309.800 4.009 20 0 DIADLO O[C@H](C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1)c1cc(F)ccc1F ZINC000748825821 1046408606 /nfs/dbraw/zinc/40/86/06/1046408606.db2.gz ZGJJLLBVCBCXSF-IAGOWNOFSA-N 1 2 323.770 4.099 20 0 DIADLO O[C@H](C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1)c1cc(F)ccc1F ZINC000748825821 1046408614 /nfs/dbraw/zinc/40/86/14/1046408614.db2.gz ZGJJLLBVCBCXSF-IAGOWNOFSA-N 1 2 323.770 4.099 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+](C)Cc1cscn1 ZINC000171065022 1046410786 /nfs/dbraw/zinc/41/07/86/1046410786.db2.gz GLEPUAORJAECFJ-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+](C)Cc1cscn1 ZINC000171065022 1046410796 /nfs/dbraw/zinc/41/07/96/1046410796.db2.gz GLEPUAORJAECFJ-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO CC(C)(C)[C@@H]([NH2+]Cc1nc(CC2CC2)no1)c1ccc(F)cc1 ZINC000639538421 1046411441 /nfs/dbraw/zinc/41/14/41/1046411441.db2.gz OJCSUHJGIKGVBV-KRWDZBQOSA-N 1 2 317.408 4.038 20 0 DIADLO CC/C(C)=C(\C)C(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC000780905745 1046412339 /nfs/dbraw/zinc/41/23/39/1046412339.db2.gz ZJETURNGDNZQJF-FWJVZWRSSA-N 1 2 321.490 4.060 20 0 DIADLO CC/C(C)=C(\C)C(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC000780905745 1046412346 /nfs/dbraw/zinc/41/23/46/1046412346.db2.gz ZJETURNGDNZQJF-FWJVZWRSSA-N 1 2 321.490 4.060 20 0 DIADLO C[C@H]([NH2+]Cc1nc(CC2CC2)no1)c1cc2ccccc2s1 ZINC000639580107 1046415173 /nfs/dbraw/zinc/41/51/73/1046415173.db2.gz KQFZOFFSVYCCGI-NSHDSACASA-N 1 2 313.426 4.088 20 0 DIADLO C[N@H+](Cc1cnc(N)s1)Cc1sc2ccccc2c1Cl ZINC001139227561 1046416868 /nfs/dbraw/zinc/41/68/68/1046416868.db2.gz KMHDWCKWVSEYPS-UHFFFAOYSA-N 1 2 323.874 4.225 20 0 DIADLO C[N@@H+](Cc1cnc(N)s1)Cc1sc2ccccc2c1Cl ZINC001139227561 1046416873 /nfs/dbraw/zinc/41/68/73/1046416873.db2.gz KMHDWCKWVSEYPS-UHFFFAOYSA-N 1 2 323.874 4.225 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(Cl)cc2Cl)sc1C ZINC000719546558 1046441804 /nfs/dbraw/zinc/44/18/04/1046441804.db2.gz DBIBOQRIAMQCGM-UHFFFAOYSA-N 1 2 301.242 4.357 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(N[C@H](CCSC)C(C)(C)O)c1 ZINC001168217495 1046425539 /nfs/dbraw/zinc/42/55/39/1046425539.db2.gz REVBEIGVKIPGEZ-QGZVFWFLSA-N 1 2 324.534 4.146 20 0 DIADLO Fc1ccc(C[NH2+]Cc2ncc(Cl)s2)cc1C(F)(F)F ZINC000719395101 1046425816 /nfs/dbraw/zinc/42/58/16/1046425816.db2.gz PGFGAKSTTXTIAU-UHFFFAOYSA-N 1 2 324.730 4.244 20 0 DIADLO Clc1cnc(Cl)c(C[N@@H+]2CCCc3ccccc3C2)c1 ZINC001139355084 1046436579 /nfs/dbraw/zinc/43/65/79/1046436579.db2.gz KKCIYTGBVZJQKF-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO Clc1cnc(Cl)c(C[N@H+]2CCCc3ccccc3C2)c1 ZINC001139355084 1046436582 /nfs/dbraw/zinc/43/65/82/1046436582.db2.gz KKCIYTGBVZJQKF-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO CC(C)n1ncc2cc(C[N@@H+]3CC(C)(C)[C@@H]3c3ccco3)cnc21 ZINC000639927452 1046438760 /nfs/dbraw/zinc/43/87/60/1046438760.db2.gz RRITWMJBRDQURQ-KRWDZBQOSA-N 1 2 324.428 4.188 20 0 DIADLO CC(C)n1ncc2cc(C[N@H+]3CC(C)(C)[C@@H]3c3ccco3)cnc21 ZINC000639927452 1046438767 /nfs/dbraw/zinc/43/87/67/1046438767.db2.gz RRITWMJBRDQURQ-KRWDZBQOSA-N 1 2 324.428 4.188 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCc3c(F)cccc3C2)c1 ZINC001137265685 1046439380 /nfs/dbraw/zinc/43/93/80/1046439380.db2.gz SOGYXKIAEUVYLL-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCc3c(F)cccc3C2)c1 ZINC001137265685 1046439384 /nfs/dbraw/zinc/43/93/84/1046439384.db2.gz SOGYXKIAEUVYLL-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CC(C)c1noc(C[NH2+][C@H](C)c2ccc(F)c3ccccc32)n1 ZINC000676857016 1046440830 /nfs/dbraw/zinc/44/08/30/1046440830.db2.gz QMDQBNOBMRJTKA-GFCCVEGCSA-N 1 2 313.376 4.336 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2cc(-c3cccs3)on2)s1 ZINC000639994791 1046441673 /nfs/dbraw/zinc/44/16/73/1046441673.db2.gz MVKMOFWWTJQUIU-VIFPVBQESA-N 1 2 305.428 4.019 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2ncc(-c3ccccc3F)o2)s1 ZINC000639993684 1046442201 /nfs/dbraw/zinc/44/22/01/1046442201.db2.gz CEGSEXRWUWVEJO-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000676882209 1046443291 /nfs/dbraw/zinc/44/32/91/1046443291.db2.gz HSOMCCJHBGJBSH-UHFFFAOYSA-N 1 2 324.771 4.030 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCCCC2)o1 ZINC000640012805 1046443591 /nfs/dbraw/zinc/44/35/91/1046443591.db2.gz JTXLCJWZIIABSI-GOSISDBHSA-N 1 2 317.408 4.182 20 0 DIADLO CCn1cc(C[N@H+](C)[C@@H](C)c2cc(Cl)ccc2Cl)cn1 ZINC000676889121 1046444800 /nfs/dbraw/zinc/44/48/00/1046444800.db2.gz OFXGAOWKRAHMBK-NSHDSACASA-N 1 2 312.244 4.403 20 0 DIADLO CCn1cc(C[N@@H+](C)[C@@H](C)c2cc(Cl)ccc2Cl)cn1 ZINC000676889121 1046444807 /nfs/dbraw/zinc/44/48/07/1046444807.db2.gz OFXGAOWKRAHMBK-NSHDSACASA-N 1 2 312.244 4.403 20 0 DIADLO Cc1c(CN(C)[C@@H](C)c2ccccc2Cl)[nH+]c2ccccn12 ZINC001137275623 1046451087 /nfs/dbraw/zinc/45/10/87/1046451087.db2.gz DWRVNEXHDLWPCQ-ZDUSSCGKSA-N 1 2 313.832 4.489 20 0 DIADLO Cc1ccc(CC[N@@H+](C)Cc2c(Cl)ccnc2Cl)cc1 ZINC001139478962 1046454607 /nfs/dbraw/zinc/45/46/07/1046454607.db2.gz HZYYNXHEZWCMAV-UHFFFAOYSA-N 1 2 309.240 4.371 20 0 DIADLO Cc1ccc(CC[N@H+](C)Cc2c(Cl)ccnc2Cl)cc1 ZINC001139478962 1046454611 /nfs/dbraw/zinc/45/46/11/1046454611.db2.gz HZYYNXHEZWCMAV-UHFFFAOYSA-N 1 2 309.240 4.371 20 0 DIADLO CCC[C@]1(C)CCC[N@H+](Cn2nc(C3CCC3)n(C)c2=S)C1 ZINC000781566170 1046457468 /nfs/dbraw/zinc/45/74/68/1046457468.db2.gz NZGOKRLJEZDCBM-QGZVFWFLSA-N 1 2 322.522 4.078 20 0 DIADLO CCC[C@]1(C)CCC[N@@H+](Cn2nc(C3CCC3)n(C)c2=S)C1 ZINC000781566170 1046457473 /nfs/dbraw/zinc/45/74/73/1046457473.db2.gz NZGOKRLJEZDCBM-QGZVFWFLSA-N 1 2 322.522 4.078 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2ccc(-c3ccsc3)nc2)C[C@@H]1F ZINC001139501516 1046458285 /nfs/dbraw/zinc/45/82/85/1046458285.db2.gz UBPWCJMJSHZHNY-HOTGVXAUSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2ccc(-c3ccsc3)nc2)C[C@@H]1F ZINC001139501516 1046458296 /nfs/dbraw/zinc/45/82/96/1046458296.db2.gz UBPWCJMJSHZHNY-HOTGVXAUSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@H]1CC[C@@]2(CC[N@H+](Cn3nc(C4CC4)sc3=S)C2)C1 ZINC000781588966 1046459228 /nfs/dbraw/zinc/45/92/28/1046459228.db2.gz YWOBZSQOUWNPOY-XHDPSFHLSA-N 1 2 309.504 4.021 20 0 DIADLO C[C@H]1CC[C@@]2(CC[N@@H+](Cn3nc(C4CC4)sc3=S)C2)C1 ZINC000781588966 1046459230 /nfs/dbraw/zinc/45/92/30/1046459230.db2.gz YWOBZSQOUWNPOY-XHDPSFHLSA-N 1 2 309.504 4.021 20 0 DIADLO Fc1ccc(-c2nc(C[N@H+](Cc3ccncc3)C3CC3)co2)cc1 ZINC000124868494 1046460648 /nfs/dbraw/zinc/46/06/48/1046460648.db2.gz BMIWQTIIBRXGEA-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1ccc(-c2nc(C[N@@H+](Cc3ccncc3)C3CC3)co2)cc1 ZINC000124868494 1046460652 /nfs/dbraw/zinc/46/06/52/1046460652.db2.gz BMIWQTIIBRXGEA-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO CC(C)[N@H+](Cc1ccc(-c2ccccc2)nc1)C1CC[NH+](C)CC1 ZINC001139523202 1046461754 /nfs/dbraw/zinc/46/17/54/1046461754.db2.gz ZCEZDTKFSYWSSE-UHFFFAOYSA-N 1 2 323.484 4.053 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc(-c2ccccc2)nc1 ZINC001139519464 1046461963 /nfs/dbraw/zinc/46/19/63/1046461963.db2.gz QUDDYUFKBQZQLH-INIZCTEOSA-N 1 2 303.409 4.127 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccc(-c2ccccc2)nc1 ZINC001139519464 1046461969 /nfs/dbraw/zinc/46/19/69/1046461969.db2.gz QUDDYUFKBQZQLH-INIZCTEOSA-N 1 2 303.409 4.127 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2ccc(-c3ccccc3)nc2)C[C@@H]1F ZINC001139520737 1046462079 /nfs/dbraw/zinc/46/20/79/1046462079.db2.gz PNXNFCUVSORYOG-ROUUACIJSA-N 1 2 302.368 4.021 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2ccc(-c3ccccc3)nc2)C[C@@H]1F ZINC001139520737 1046462083 /nfs/dbraw/zinc/46/20/83/1046462083.db2.gz PNXNFCUVSORYOG-ROUUACIJSA-N 1 2 302.368 4.021 20 0 DIADLO Cc1ccc([C@H]2COCC[N@@H+]2Cc2cc(C)nc3ccccc23)o1 ZINC000125047520 1046462322 /nfs/dbraw/zinc/46/23/22/1046462322.db2.gz HCJYXBIFVIPQFS-LJQANCHMSA-N 1 2 322.408 4.018 20 0 DIADLO Cc1ccc([C@H]2COCC[N@H+]2Cc2cc(C)nc3ccccc23)o1 ZINC000125047520 1046462328 /nfs/dbraw/zinc/46/23/28/1046462328.db2.gz HCJYXBIFVIPQFS-LJQANCHMSA-N 1 2 322.408 4.018 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1cccc(Br)c1F ZINC001139533375 1046464592 /nfs/dbraw/zinc/46/45/92/1046464592.db2.gz ZDYWZNRPWKCINE-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1cccc(Br)c1F ZINC001139533375 1046464602 /nfs/dbraw/zinc/46/46/02/1046464602.db2.gz ZDYWZNRPWKCINE-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO c1csc(-c2cnc(C[N@@H+]3CCC[C@H]3c3ccncc3)o2)c1 ZINC000125463481 1046467812 /nfs/dbraw/zinc/46/78/12/1046467812.db2.gz LIZYDRBPLLXAGQ-AWEZNQCLSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2cnc(C[N@H+]3CCC[C@H]3c3ccncc3)o2)c1 ZINC000125463481 1046467816 /nfs/dbraw/zinc/46/78/16/1046467816.db2.gz LIZYDRBPLLXAGQ-AWEZNQCLSA-N 1 2 311.410 4.135 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)[C@H]1CCCc2sccc21 ZINC000125528017 1046470084 /nfs/dbraw/zinc/47/00/84/1046470084.db2.gz AFSNGXYRGJSXOP-HNNXBMFYSA-N 1 2 323.421 4.197 20 0 DIADLO Cc1cnc(Cl)c(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC001139590924 1046478115 /nfs/dbraw/zinc/47/81/15/1046478115.db2.gz FSPRTKKXCYMDFE-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cnc(Cl)c(C[N@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC001139590924 1046478120 /nfs/dbraw/zinc/47/81/20/1046478120.db2.gz FSPRTKKXCYMDFE-INIZCTEOSA-N 1 2 318.873 4.334 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3c(O)cccc3C2)cc1Cl ZINC001139592941 1046480329 /nfs/dbraw/zinc/48/03/29/1046480329.db2.gz JZPXUXVOGZIHMA-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3c(O)cccc3C2)cc1Cl ZINC001139592941 1046480340 /nfs/dbraw/zinc/48/03/40/1046480340.db2.gz JZPXUXVOGZIHMA-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1ccc(C)cc1C[N@@H+]1CCc2ccc(C(C)=O)cc2C1 ZINC001139607184 1046484575 /nfs/dbraw/zinc/48/45/75/1046484575.db2.gz JFLCAVXLEGLPLR-UHFFFAOYSA-N 1 2 323.436 4.155 20 0 DIADLO CCOc1ccc(C)cc1C[N@H+]1CCc2ccc(C(C)=O)cc2C1 ZINC001139607184 1046484580 /nfs/dbraw/zinc/48/45/80/1046484580.db2.gz JFLCAVXLEGLPLR-UHFFFAOYSA-N 1 2 323.436 4.155 20 0 DIADLO Cc1cccc(C)c1C[NH2+][C@@H](c1ccn(C)n1)c1ccc(F)cc1 ZINC000781906391 1046485572 /nfs/dbraw/zinc/48/55/72/1046485572.db2.gz CBLUNHPTTCKWKX-HXUWFJFHSA-N 1 2 323.415 4.055 20 0 DIADLO CC(=O)Nc1ccc([C@H](C)Nc2ccc([NH+]3CCCC3)cc2)cc1 ZINC000781908864 1046485768 /nfs/dbraw/zinc/48/57/68/1046485768.db2.gz AVYCTMZZILYCJU-HNNXBMFYSA-N 1 2 323.440 4.418 20 0 DIADLO CN(C)c1ccc(NCc2ccc(SC(F)F)cc2)[nH+]c1 ZINC000781918876 1046487411 /nfs/dbraw/zinc/48/74/11/1046487411.db2.gz VIMGRTYOQUUCSE-UHFFFAOYSA-N 1 2 309.385 4.074 20 0 DIADLO CCOc1ccncc1C[N@@H+]1CCCC[C@H]1c1ccccc1F ZINC001139630861 1046491018 /nfs/dbraw/zinc/49/10/18/1046491018.db2.gz NGQUEOGKTNLKKQ-SFHVURJKSA-N 1 2 314.404 4.347 20 0 DIADLO CCOc1ccncc1C[N@H+]1CCCC[C@H]1c1ccccc1F ZINC001139630861 1046491020 /nfs/dbraw/zinc/49/10/20/1046491020.db2.gz NGQUEOGKTNLKKQ-SFHVURJKSA-N 1 2 314.404 4.347 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1ncc(C(C)C)o1)[C@@H]2C ZINC000782096782 1046494674 /nfs/dbraw/zinc/49/46/74/1046494674.db2.gz GCCDTRFZCMETTG-ZIAGYGMSSA-N 1 2 314.429 4.314 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1ncc(C(C)C)o1)[C@@H]2C ZINC000782096782 1046494682 /nfs/dbraw/zinc/49/46/82/1046494682.db2.gz GCCDTRFZCMETTG-ZIAGYGMSSA-N 1 2 314.429 4.314 20 0 DIADLO CN(C)c1cc(CSc2ccccc2Br)cc[nH+]1 ZINC000782112430 1046495661 /nfs/dbraw/zinc/49/56/61/1046495661.db2.gz QUJDEAGHXWVCSW-UHFFFAOYSA-N 1 2 323.259 4.202 20 0 DIADLO C[C@H](C1CC1)[N@@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000782184439 1046497956 /nfs/dbraw/zinc/49/79/56/1046497956.db2.gz SKHYAUZIGNTIAY-BMIGLBTASA-N 1 2 300.229 4.165 20 0 DIADLO C[C@H](C1CC1)[N@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000782184439 1046497959 /nfs/dbraw/zinc/49/79/59/1046497959.db2.gz SKHYAUZIGNTIAY-BMIGLBTASA-N 1 2 300.229 4.165 20 0 DIADLO COCOc1cccc(Nc2cc[nH+]c3ccc(Cl)cc23)c1 ZINC001212896081 1046498008 /nfs/dbraw/zinc/49/80/08/1046498008.db2.gz SPKIWYMRCHAUCO-UHFFFAOYSA-N 1 2 314.772 4.036 20 0 DIADLO CCc1nc(C[N@H+](C)[C@@H]2CCc3cc(Cl)ccc32)cs1 ZINC000782180104 1046498180 /nfs/dbraw/zinc/49/81/80/1046498180.db2.gz DXQPUDXIWYWRET-OAHLLOKOSA-N 1 2 306.862 4.478 20 0 DIADLO CCc1nc(C[N@@H+](C)[C@@H]2CCc3cc(Cl)ccc32)cs1 ZINC000782180104 1046498182 /nfs/dbraw/zinc/49/81/82/1046498182.db2.gz DXQPUDXIWYWRET-OAHLLOKOSA-N 1 2 306.862 4.478 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cccc([C@H]3CCCOC3)c2)c(C)[nH+]1 ZINC000536578044 1046501285 /nfs/dbraw/zinc/50/12/85/1046501285.db2.gz BEKXCGCZECNSSW-SFHVURJKSA-N 1 2 324.424 4.153 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+]Cc3ccc(C)cn3)cs2)cc1 ZINC001202963464 1046504750 /nfs/dbraw/zinc/50/47/50/1046504750.db2.gz ARVBHAFYOZSCJG-UHFFFAOYSA-N 1 2 309.438 4.112 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@@H](C)c2ccc(OC(F)F)cc2)cs1 ZINC000130021857 1046508833 /nfs/dbraw/zinc/50/88/33/1046508833.db2.gz AIHORUAEGWDPGE-JTQLQIEISA-N 1 2 312.385 4.246 20 0 DIADLO Cc1nc(C[N@H+](C)[C@@H](C)c2ccc(OC(F)F)cc2)cs1 ZINC000130021857 1046508846 /nfs/dbraw/zinc/50/88/46/1046508846.db2.gz AIHORUAEGWDPGE-JTQLQIEISA-N 1 2 312.385 4.246 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2nc3ccccc3[nH]2)s1 ZINC000130190928 1046509227 /nfs/dbraw/zinc/50/92/27/1046509227.db2.gz UHOAZCNCEDTCFP-GFCCVEGCSA-N 1 2 314.458 4.083 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2nc3ccccc3[nH]2)s1 ZINC000130190928 1046509241 /nfs/dbraw/zinc/50/92/41/1046509241.db2.gz UHOAZCNCEDTCFP-GFCCVEGCSA-N 1 2 314.458 4.083 20 0 DIADLO COc1ncc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001139749963 1046512684 /nfs/dbraw/zinc/51/26/84/1046512684.db2.gz PGBLIESDNUJGEJ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(Cl)cc1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001139749963 1046512689 /nfs/dbraw/zinc/51/26/89/1046512689.db2.gz PGBLIESDNUJGEJ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO Clc1ccc([C@H]2CSCC[N@@H+]2Cc2ccncc2)cc1 ZINC000130629154 1046512992 /nfs/dbraw/zinc/51/29/92/1046512992.db2.gz YPGUWELHNQDXMJ-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccc([C@H]2CSCC[N@H+]2Cc2ccncc2)cc1 ZINC000130629154 1046513001 /nfs/dbraw/zinc/51/30/01/1046513001.db2.gz YPGUWELHNQDXMJ-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Cc1ccc2ncc(C[N@@H+](C)[C@H](C)c3ccccc3Cl)n2c1 ZINC001137310786 1046519951 /nfs/dbraw/zinc/51/99/51/1046519951.db2.gz QJJYFNOJAPWSRG-CQSZACIVSA-N 1 2 313.832 4.489 20 0 DIADLO Cc1ccc2ncc(C[N@H+](C)[C@H](C)c3ccccc3Cl)n2c1 ZINC001137310786 1046519959 /nfs/dbraw/zinc/51/99/59/1046519959.db2.gz QJJYFNOJAPWSRG-CQSZACIVSA-N 1 2 313.832 4.489 20 0 DIADLO Cc1c(Cl)c(C[NH+]2CC3(C2)CC(F)(F)C3)nc2ccccc12 ZINC000677736681 1046520188 /nfs/dbraw/zinc/52/01/88/1046520188.db2.gz WTHWGESHAOSFDH-UHFFFAOYSA-N 1 2 322.786 4.428 20 0 DIADLO Cc1ncccc1CNc1[nH+]c2ccccc2n1C1CCCC1 ZINC000677742650 1046520377 /nfs/dbraw/zinc/52/03/77/1046520377.db2.gz SNMXWUXPWLGTHI-UHFFFAOYSA-N 1 2 306.413 4.467 20 0 DIADLO Cc1ccccc1Nc1nc(C[N@@H+]2CC[C@H](C(F)F)C2)cs1 ZINC000677736220 1046521029 /nfs/dbraw/zinc/52/10/29/1046521029.db2.gz ZNHGKSDIVQSDQW-LBPRGKRZSA-N 1 2 323.412 4.282 20 0 DIADLO Cc1ccccc1Nc1nc(C[N@H+]2CC[C@H](C(F)F)C2)cs1 ZINC000677736220 1046521041 /nfs/dbraw/zinc/52/10/41/1046521041.db2.gz ZNHGKSDIVQSDQW-LBPRGKRZSA-N 1 2 323.412 4.282 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+]Cc1ccc(Cl)cc1F)CCC2 ZINC000782530794 1046533610 /nfs/dbraw/zinc/53/36/10/1046533610.db2.gz MLIPRDHQQUQBCB-INIZCTEOSA-N 1 2 321.827 4.424 20 0 DIADLO O=C(C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1)Nc1ccccc1 ZINC000641976647 1046534227 /nfs/dbraw/zinc/53/42/27/1046534227.db2.gz SWCGDVVUBFTXNR-KRWDZBQOSA-N 1 2 314.816 4.116 20 0 DIADLO O=C(C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1)Nc1ccccc1 ZINC000641976647 1046534236 /nfs/dbraw/zinc/53/42/36/1046534236.db2.gz SWCGDVVUBFTXNR-KRWDZBQOSA-N 1 2 314.816 4.116 20 0 DIADLO CCOCOc1ccc(CNc2ccc([NH+](C)C)cc2C)cc1 ZINC000782953592 1046548540 /nfs/dbraw/zinc/54/85/40/1046548540.db2.gz TXDZCYYLEJOLKS-UHFFFAOYSA-N 1 2 314.429 4.046 20 0 DIADLO C[C@@H]([NH2+]Cc1ccnc(Oc2ccccc2)c1)c1cscn1 ZINC000678113179 1046554663 /nfs/dbraw/zinc/55/46/63/1046554663.db2.gz IBGCXTXGYIPBSC-CYBMUJFWSA-N 1 2 311.410 4.181 20 0 DIADLO Cc1cc(C)c(C[N@@H+](C)Cc2ccccc2Br)[nH]1 ZINC001137321549 1046555222 /nfs/dbraw/zinc/55/52/22/1046555222.db2.gz QESAEFARJKBEDU-UHFFFAOYSA-N 1 2 307.235 4.026 20 0 DIADLO Cc1cc(C)c(C[N@H+](C)Cc2ccccc2Br)[nH]1 ZINC001137321549 1046555232 /nfs/dbraw/zinc/55/52/32/1046555232.db2.gz QESAEFARJKBEDU-UHFFFAOYSA-N 1 2 307.235 4.026 20 0 DIADLO c1ccc(C[N@@H+](Cc2noc(C3CC3)n2)C2CCCCC2)cc1 ZINC000053611363 1046555742 /nfs/dbraw/zinc/55/57/42/1046555742.db2.gz HXKFKHSJQLVGMQ-UHFFFAOYSA-N 1 2 311.429 4.282 20 0 DIADLO c1ccc(C[N@H+](Cc2noc(C3CC3)n2)C2CCCCC2)cc1 ZINC000053611363 1046555753 /nfs/dbraw/zinc/55/57/53/1046555753.db2.gz HXKFKHSJQLVGMQ-UHFFFAOYSA-N 1 2 311.429 4.282 20 0 DIADLO c1coc(C[N@H+](Cc2[nH]nc3ccccc32)Cc2ccccc2)c1 ZINC000678124259 1046558860 /nfs/dbraw/zinc/55/88/60/1046558860.db2.gz UVRBPZSASVOKMY-UHFFFAOYSA-N 1 2 317.392 4.358 20 0 DIADLO c1coc(C[N@@H+](Cc2[nH]nc3ccccc32)Cc2ccccc2)c1 ZINC000678124259 1046558875 /nfs/dbraw/zinc/55/88/75/1046558875.db2.gz UVRBPZSASVOKMY-UHFFFAOYSA-N 1 2 317.392 4.358 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@H](C)C(=O)Nc1cccc(Cl)c1C ZINC000055082711 1046559733 /nfs/dbraw/zinc/55/97/33/1046559733.db2.gz XADXNODBEYTGKO-GFCCVEGCSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1occc1C[N@H+](C)[C@H](C)C(=O)Nc1cccc(Cl)c1C ZINC000055082711 1046559745 /nfs/dbraw/zinc/55/97/45/1046559745.db2.gz XADXNODBEYTGKO-GFCCVEGCSA-N 1 2 320.820 4.009 20 0 DIADLO NC(Cc1cccc(F)c1)=[NH+]OC/C=C\c1ccc(Cl)cc1 ZINC000783152048 1046559708 /nfs/dbraw/zinc/55/97/08/1046559708.db2.gz MKABMBXWNKBNKN-RQOWECAXSA-N 1 2 318.779 4.233 20 0 DIADLO C[N@H+](Cc1nc2ccccc2s1)Cc1nccc2ccccc21 ZINC000678126099 1046559837 /nfs/dbraw/zinc/55/98/37/1046559837.db2.gz AZEQYVCCGSXXNX-UHFFFAOYSA-N 1 2 319.433 4.477 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2s1)Cc1nccc2ccccc21 ZINC000678126099 1046559848 /nfs/dbraw/zinc/55/98/48/1046559848.db2.gz AZEQYVCCGSXXNX-UHFFFAOYSA-N 1 2 319.433 4.477 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3cnc(Cl)nc3)CC2)cc1 ZINC001139987221 1046562015 /nfs/dbraw/zinc/56/20/15/1046562015.db2.gz KYDBURKXPQSAEL-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3cnc(Cl)nc3)CC2)cc1 ZINC001139987221 1046562031 /nfs/dbraw/zinc/56/20/31/1046562031.db2.gz KYDBURKXPQSAEL-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ncc(C(C)C)s2)o1 ZINC000137079108 1046562301 /nfs/dbraw/zinc/56/23/01/1046562301.db2.gz PFVJFNIJCWBLPP-CQSZACIVSA-N 1 2 320.458 4.343 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2ncc(C(C)C)s2)o1 ZINC000137079108 1046562315 /nfs/dbraw/zinc/56/23/15/1046562315.db2.gz PFVJFNIJCWBLPP-CQSZACIVSA-N 1 2 320.458 4.343 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cnc3ccc(Cl)cn23)C2CC2)o1 ZINC000678136228 1046564893 /nfs/dbraw/zinc/56/48/93/1046564893.db2.gz YZSVXMWAAHNGSS-UHFFFAOYSA-N 1 2 315.804 4.054 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cnc3ccc(Cl)cn23)C2CC2)o1 ZINC000678136228 1046564909 /nfs/dbraw/zinc/56/49/09/1046564909.db2.gz YZSVXMWAAHNGSS-UHFFFAOYSA-N 1 2 315.804 4.054 20 0 DIADLO Cc1ccc(-c2csc(C[NH2+][C@@H](C)c3nccnc3C)n2)cc1 ZINC000783225591 1046565208 /nfs/dbraw/zinc/56/52/08/1046565208.db2.gz WLCZEESGTDNWQB-AWEZNQCLSA-N 1 2 324.453 4.068 20 0 DIADLO Cc1c2cccc(F)c2oc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000642135744 1046569508 /nfs/dbraw/zinc/56/95/08/1046569508.db2.gz XYAALZMIBUUJKO-UHFFFAOYSA-N 1 2 312.344 4.453 20 0 DIADLO CN(CCO)c1ccc([NH2+][C@H]2CC[C@@](C)(c3ccccc3)C2)cc1 ZINC000783280090 1046572634 /nfs/dbraw/zinc/57/26/34/1046572634.db2.gz IXFIJSBXHDFBFV-PZJWPPBQSA-N 1 2 324.468 4.037 20 0 DIADLO COc1cc(C[N@H+](C)Cc2cscc2Cl)cc(OC)c1 ZINC000678153525 1046574713 /nfs/dbraw/zinc/57/47/13/1046574713.db2.gz OHTDDWVTJIDUEO-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2cscc2Cl)cc(OC)c1 ZINC000678153525 1046574726 /nfs/dbraw/zinc/57/47/26/1046574726.db2.gz OHTDDWVTJIDUEO-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@H+](Cc1c[nH]nc1C(C)(C)C)CC3 ZINC000678171849 1046576182 /nfs/dbraw/zinc/57/61/82/1046576182.db2.gz MCMXXDFHJFCZGC-UHFFFAOYSA-N 1 2 322.456 4.055 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](Cc1c[nH]nc1C(C)(C)C)CC3 ZINC000678171849 1046576192 /nfs/dbraw/zinc/57/61/92/1046576192.db2.gz MCMXXDFHJFCZGC-UHFFFAOYSA-N 1 2 322.456 4.055 20 0 DIADLO CCC[N@H+](CC(=O)Nc1ccccc1C)Cc1ccc(Cl)o1 ZINC000536637512 1046577686 /nfs/dbraw/zinc/57/76/86/1046577686.db2.gz NKNYTTWMDOPECD-UHFFFAOYSA-N 1 2 320.820 4.092 20 0 DIADLO CCC[N@@H+](CC(=O)Nc1ccccc1C)Cc1ccc(Cl)o1 ZINC000536637512 1046577702 /nfs/dbraw/zinc/57/77/02/1046577702.db2.gz NKNYTTWMDOPECD-UHFFFAOYSA-N 1 2 320.820 4.092 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1cnc(Br)cc1Cl ZINC001140078584 1046584404 /nfs/dbraw/zinc/58/44/04/1046584404.db2.gz MDPCSPROGFXLHD-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1cnc(Br)cc1Cl ZINC001140078584 1046584417 /nfs/dbraw/zinc/58/44/17/1046584417.db2.gz MDPCSPROGFXLHD-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cnc(Br)cc1Cl ZINC001140078510 1046584748 /nfs/dbraw/zinc/58/47/48/1046584748.db2.gz IPPRBSRQGXSSSB-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cnc(Br)cc1Cl ZINC001140078510 1046584759 /nfs/dbraw/zinc/58/47/59/1046584759.db2.gz IPPRBSRQGXSSSB-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1cc(C[NH+](CCC2CCCCC2)Cc2cc(C)no2)on1 ZINC000642243053 1046585775 /nfs/dbraw/zinc/58/57/75/1046585775.db2.gz PPJUOXBIKBYERO-UHFFFAOYSA-N 1 2 317.433 4.252 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(C(F)(F)F)ccn2)cn1 ZINC001140108948 1046592107 /nfs/dbraw/zinc/59/21/07/1046592107.db2.gz UPXMBBNWZLPAQA-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc(C(F)(F)F)ccn2)cn1 ZINC001140108948 1046592121 /nfs/dbraw/zinc/59/21/21/1046592121.db2.gz UPXMBBNWZLPAQA-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cc(C(F)(F)F)ccn1 ZINC001140108956 1046592356 /nfs/dbraw/zinc/59/23/56/1046592356.db2.gz UYUJGIQRMGCTPE-LBPRGKRZSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cc(C(F)(F)F)ccn1 ZINC001140108956 1046592367 /nfs/dbraw/zinc/59/23/67/1046592367.db2.gz UYUJGIQRMGCTPE-LBPRGKRZSA-N 1 2 306.331 4.047 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](C)[C@H](C)c2ccc(C)cc2)cs1 ZINC000245458801 1046605439 /nfs/dbraw/zinc/60/54/39/1046605439.db2.gz DCYXOZPORMXAPB-KGLIPLIRSA-N 1 2 304.459 4.352 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2)cs1 ZINC000245458801 1046605441 /nfs/dbraw/zinc/60/54/41/1046605441.db2.gz DCYXOZPORMXAPB-KGLIPLIRSA-N 1 2 304.459 4.352 20 0 DIADLO CCN(CC)c1ncc(C[N@@H+]2CC[C@H]2c2cccc(F)c2)s1 ZINC000678283278 1046611431 /nfs/dbraw/zinc/61/14/31/1046611431.db2.gz HNJSIMCPJYRCCR-INIZCTEOSA-N 1 2 319.449 4.075 20 0 DIADLO CCN(CC)c1ncc(C[N@H+]2CC[C@H]2c2cccc(F)c2)s1 ZINC000678283278 1046611440 /nfs/dbraw/zinc/61/14/40/1046611440.db2.gz HNJSIMCPJYRCCR-INIZCTEOSA-N 1 2 319.449 4.075 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ncccc2C(F)(F)F)[C@H]1c1ccccc1 ZINC000678295544 1046615321 /nfs/dbraw/zinc/61/53/21/1046615321.db2.gz HEEGVJAWQCNSNQ-MLGOLLRUSA-N 1 2 306.331 4.293 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ncccc2C(F)(F)F)[C@H]1c1ccccc1 ZINC000678295544 1046615322 /nfs/dbraw/zinc/61/53/22/1046615322.db2.gz HEEGVJAWQCNSNQ-MLGOLLRUSA-N 1 2 306.331 4.293 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@H]2CCn3ccnc32)c2ccccc2)c(C)c1 ZINC000834548733 1046630470 /nfs/dbraw/zinc/63/04/70/1046630470.db2.gz QSRRVXHRIZGEJS-PMACEKPBSA-N 1 2 317.436 4.324 20 0 DIADLO CCOc1ccc2[nH]cc(C[N@@H+]3Cc4cccc(F)c4C3)c2c1 ZINC001140271086 1046636134 /nfs/dbraw/zinc/63/61/34/1046636134.db2.gz VYXJMGRSBMAHBX-UHFFFAOYSA-N 1 2 310.372 4.222 20 0 DIADLO CCOc1ccc2[nH]cc(C[N@H+]3Cc4cccc(F)c4C3)c2c1 ZINC001140271086 1046636139 /nfs/dbraw/zinc/63/61/39/1046636139.db2.gz VYXJMGRSBMAHBX-UHFFFAOYSA-N 1 2 310.372 4.222 20 0 DIADLO Cc1cccc(F)c1C[NH2+][C@H](C)c1ncc(-c2ccccc2)n1C ZINC000834601783 1046637827 /nfs/dbraw/zinc/63/78/27/1046637827.db2.gz ADTSOAZDULPNIZ-OAHLLOKOSA-N 1 2 323.415 4.385 20 0 DIADLO O=C(Nc1ccc(C2CC2)cc1)c1cccc(Cn2cc[nH+]c2)c1 ZINC000678484752 1046647160 /nfs/dbraw/zinc/64/71/60/1046647160.db2.gz XVPRURHQBPRTDR-UHFFFAOYSA-N 1 2 317.392 4.061 20 0 DIADLO CC[C@@H](C)CCCCC(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000783943039 1046648559 /nfs/dbraw/zinc/64/85/59/1046648559.db2.gz YKSWHDGJUWMVDJ-MRXNPFEDSA-N 1 2 313.445 4.095 20 0 DIADLO FC1(F)CCCC[N@H+](Cc2ccccc2-c2cccnc2)C1 ZINC001140312294 1046650417 /nfs/dbraw/zinc/65/04/17/1046650417.db2.gz AKXDIUBKASTEGM-UHFFFAOYSA-N 1 2 302.368 4.370 20 0 DIADLO FC1(F)CCCC[N@@H+](Cc2ccccc2-c2cccnc2)C1 ZINC001140312294 1046650422 /nfs/dbraw/zinc/65/04/22/1046650422.db2.gz AKXDIUBKASTEGM-UHFFFAOYSA-N 1 2 302.368 4.370 20 0 DIADLO Cn1ccnc1[C@H]([NH2+]Cc1cccc(C2CC2)c1)c1ccccc1 ZINC000643287209 1046654564 /nfs/dbraw/zinc/65/45/64/1046654564.db2.gz HMSAILRHYPHHAB-HXUWFJFHSA-N 1 2 317.436 4.177 20 0 DIADLO C[C@@H]([NH2+]C1(c2ccccc2)CC1)c1nc(Br)cs1 ZINC000834718422 1046655112 /nfs/dbraw/zinc/65/51/12/1046655112.db2.gz VDHHYDSNBPZWBG-SNVBAGLBSA-N 1 2 323.259 4.246 20 0 DIADLO Cc1ccc2[nH]nc(C[N@@H+]3CCSC[C@H]3c3ccccc3)c2c1 ZINC001140330122 1046658653 /nfs/dbraw/zinc/65/86/53/1046658653.db2.gz NDJNQDCZOFCPLC-IBGZPJMESA-N 1 2 323.465 4.161 20 0 DIADLO Cc1ccc2[nH]nc(C[N@H+]3CCSC[C@H]3c3ccccc3)c2c1 ZINC001140330122 1046658655 /nfs/dbraw/zinc/65/86/55/1046658655.db2.gz NDJNQDCZOFCPLC-IBGZPJMESA-N 1 2 323.465 4.161 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccncc1Cl ZINC000643347057 1046660936 /nfs/dbraw/zinc/66/09/36/1046660936.db2.gz SXXXPTJEVTWZQW-LKFCYVNXSA-N 1 2 309.196 4.173 20 0 DIADLO Cc1nn(C[N@@H+]2C[C@@H](C)C[C@H]2c2ccccc2)c(=S)s1 ZINC000795744222 1046675186 /nfs/dbraw/zinc/67/51/86/1046675186.db2.gz LOHVZGRMNGSMOX-FZMZJTMJSA-N 1 2 305.472 4.023 20 0 DIADLO Cc1nn(C[N@H+]2C[C@@H](C)C[C@H]2c2ccccc2)c(=S)s1 ZINC000795744222 1046675187 /nfs/dbraw/zinc/67/51/87/1046675187.db2.gz LOHVZGRMNGSMOX-FZMZJTMJSA-N 1 2 305.472 4.023 20 0 DIADLO CC[C@H]([NH2+][C@H]1CCn2ccnc21)c1ccc(Cl)cc1Cl ZINC000834835703 1046680999 /nfs/dbraw/zinc/68/09/99/1046680999.db2.gz IPQSSTALYOKRJF-KBPBESRZSA-N 1 2 310.228 4.376 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(F)cnc1Cl)c1ccc(F)cc1F ZINC000834839631 1046682338 /nfs/dbraw/zinc/68/23/38/1046682338.db2.gz BZUWFGCHZJUMEI-AWEZNQCLSA-N 1 2 314.738 4.393 20 0 DIADLO Cl/C=C/C[N@@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000784525416 1046695198 /nfs/dbraw/zinc/69/51/98/1046695198.db2.gz DRFVCNWARWOKSR-BBJBCUTESA-N 1 2 306.656 4.400 20 0 DIADLO Cl/C=C/C[N@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000784525416 1046695200 /nfs/dbraw/zinc/69/52/00/1046695200.db2.gz DRFVCNWARWOKSR-BBJBCUTESA-N 1 2 306.656 4.400 20 0 DIADLO Cc1noc(C[NH2+]C2(c3ccc(C(C)(C)C)cc3)CCCC2)n1 ZINC000678796451 1046701673 /nfs/dbraw/zinc/70/16/73/1046701673.db2.gz VEGSBFOXBWIUTF-UHFFFAOYSA-N 1 2 313.445 4.235 20 0 DIADLO COC[C@@H]1CCCC[N@H+]1Cc1c(Cl)ccc(F)c1Cl ZINC001137353557 1046721762 /nfs/dbraw/zinc/72/17/62/1046721762.db2.gz QTPUIZQVZYPQBY-JTQLQIEISA-N 1 2 306.208 4.133 20 0 DIADLO Clc1ccc(C[N@H+](Cc2nc3c(s2)CCC3)C2CC2)cc1 ZINC000678813521 1046707614 /nfs/dbraw/zinc/70/76/14/1046707614.db2.gz BPFKQWHNYOZALH-UHFFFAOYSA-N 1 2 318.873 4.450 20 0 DIADLO Clc1ccc(C[N@@H+](Cc2nc3c(s2)CCC3)C2CC2)cc1 ZINC000678813521 1046707631 /nfs/dbraw/zinc/70/76/31/1046707631.db2.gz BPFKQWHNYOZALH-UHFFFAOYSA-N 1 2 318.873 4.450 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CCCOc3ccc(C(C)C)cc32)co1 ZINC000834899931 1046711260 /nfs/dbraw/zinc/71/12/60/1046711260.db2.gz ROYROVMYQLBATD-KRWDZBQOSA-N 1 2 314.429 4.364 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1[nH]nc2ccccc21 ZINC001137352269 1046711968 /nfs/dbraw/zinc/71/19/68/1046711968.db2.gz UYBIUEGDSWRVDY-LJQANCHMSA-N 1 2 321.424 4.046 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2sc(C(C)(C)C)nc2C)co1 ZINC000834901582 1046711985 /nfs/dbraw/zinc/71/19/85/1046711985.db2.gz WLFRAJDFUBHRLK-SNVBAGLBSA-N 1 2 307.463 4.150 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1[nH]nc2ccccc21 ZINC001137352269 1046711982 /nfs/dbraw/zinc/71/19/82/1046711982.db2.gz UYBIUEGDSWRVDY-LJQANCHMSA-N 1 2 321.424 4.046 20 0 DIADLO c1n[nH]c([C@H]([NH2+]CCCCc2ccccc2)C2CCCCC2)n1 ZINC000644532499 1046719393 /nfs/dbraw/zinc/71/93/93/1046719393.db2.gz FTJFAXJSNMZXGL-GOSISDBHSA-N 1 2 312.461 4.039 20 0 DIADLO COC[C@@H]1CCCC[N@@H+]1Cc1c(Cl)ccc(F)c1Cl ZINC001137353557 1046721748 /nfs/dbraw/zinc/72/17/48/1046721748.db2.gz QTPUIZQVZYPQBY-JTQLQIEISA-N 1 2 306.208 4.133 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cccnc1OCc1ccccc1 ZINC000644587863 1046726864 /nfs/dbraw/zinc/72/68/64/1046726864.db2.gz FZBBTMOJIQQKSE-UHFFFAOYSA-N 1 2 322.412 4.050 20 0 DIADLO CSc1ccc(C)c(NC(=O)Nc2ccc3[nH+]ccn3c2)c1 ZINC000678891332 1046728294 /nfs/dbraw/zinc/72/82/94/1046728294.db2.gz SGZYGLJNGMCIIZ-UHFFFAOYSA-N 1 2 312.398 4.009 20 0 DIADLO Clc1cccc([C@H]([NH2+]Cc2csnn2)C2CCCC2)c1 ZINC000678938674 1046738807 /nfs/dbraw/zinc/73/88/07/1046738807.db2.gz GYMDZHHOVHTXGE-OAHLLOKOSA-N 1 2 307.850 4.213 20 0 DIADLO FC(F)(F)c1nn(Cc2ccccc2Cl)c2cc[nH+]cc21 ZINC000533508695 1046739205 /nfs/dbraw/zinc/73/92/05/1046739205.db2.gz FMIOZRGYPLSTGS-UHFFFAOYSA-N 1 2 311.694 4.152 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2nc3c(s2)CCCC3)o1 ZINC000678945146 1046741356 /nfs/dbraw/zinc/74/13/56/1046741356.db2.gz CMQSTIASXKTBAI-AAEUAGOBSA-N 1 2 302.443 4.028 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(s1)CCCC2)c1ccc(F)cc1F ZINC000678955209 1046744497 /nfs/dbraw/zinc/74/44/97/1046744497.db2.gz BSMRKELNWVBOLT-SNVBAGLBSA-N 1 2 308.397 4.151 20 0 DIADLO COC(=O)c1csc([C@H](C)Nc2ccc([NH+](C)C)cc2C)c1 ZINC000796856717 1046746439 /nfs/dbraw/zinc/74/64/39/1046746439.db2.gz SKVFEMJSIZCJFL-LBPRGKRZSA-N 1 2 318.442 4.082 20 0 DIADLO CCCc1ccc([C@H]([NH2+]Cc2noc(CC)n2)C(C)C)cc1 ZINC000533547804 1046750907 /nfs/dbraw/zinc/75/09/07/1046750907.db2.gz CPAJNKZKYYPFRO-GOSISDBHSA-N 1 2 301.434 4.071 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2c(Cl)ccc(F)c2Cl)[C@@H](C)C1 ZINC001137358770 1046755306 /nfs/dbraw/zinc/75/53/06/1046755306.db2.gz CULIOBYDGJZLJT-UWVGGRQHSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2c(Cl)ccc(F)c2Cl)[C@@H](C)C1 ZINC001137358770 1046755317 /nfs/dbraw/zinc/75/53/17/1046755317.db2.gz CULIOBYDGJZLJT-UWVGGRQHSA-N 1 2 306.208 4.132 20 0 DIADLO CC[C@@H](C)Oc1cccc(NC(=O)Nc2ccc3[nH+]ccn3c2)c1 ZINC000645009758 1046755968 /nfs/dbraw/zinc/75/59/68/1046755968.db2.gz ABFDNUPSVPXBEC-CYBMUJFWSA-N 1 2 324.384 4.156 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)c(C)[nH+]1 ZINC000455476400 1046768760 /nfs/dbraw/zinc/76/87/60/1046768760.db2.gz DUPVVUFKZGPKOQ-SJLPKXTDSA-N 1 2 323.440 4.417 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@H](C)c2nc3c(s2)CCCC3)c1 ZINC000645156546 1046769235 /nfs/dbraw/zinc/76/92/35/1046769235.db2.gz LAQHJVDKTPLUDT-LLVKDONJSA-N 1 2 320.433 4.020 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c(F)cc(F)cc1F ZINC001140532158 1046769899 /nfs/dbraw/zinc/76/98/99/1046769899.db2.gz AFLQESNCZYOCAU-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1c(F)cc(F)cc1F ZINC001140532158 1046769914 /nfs/dbraw/zinc/76/99/14/1046769914.db2.gz AFLQESNCZYOCAU-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO CCc1cccc2c1OCC[C@H]2[NH2+]Cc1cccc(O)c1Cl ZINC000645154320 1046770490 /nfs/dbraw/zinc/77/04/90/1046770490.db2.gz ZPSPODVRSHRGEF-OAHLLOKOSA-N 1 2 317.816 4.221 20 0 DIADLO Cc1ccsc1CN(C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455480607 1046770599 /nfs/dbraw/zinc/77/05/99/1046770599.db2.gz OHDODYFUOFRFOA-UHFFFAOYSA-N 1 2 303.431 4.041 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCCC[C@@H]2CC(C)C)c(C)[nH+]1 ZINC000455478492 1046770938 /nfs/dbraw/zinc/77/09/38/1046770938.db2.gz GBTYMFSIGVSSHJ-MRXNPFEDSA-N 1 2 303.450 4.439 20 0 DIADLO Oc1cccc(C[NH2+][C@H](c2ccccc2)c2ccncc2)c1Cl ZINC000645150597 1046771466 /nfs/dbraw/zinc/77/14/66/1046771466.db2.gz HPPAILIWMJVPSL-LJQANCHMSA-N 1 2 324.811 4.320 20 0 DIADLO CCOc1cc(C)ccc1C[NH2+]Cc1cccc(O)c1Cl ZINC000645161339 1046771984 /nfs/dbraw/zinc/77/19/84/1046771984.db2.gz JAFJCDHWGAUEMS-UHFFFAOYSA-N 1 2 305.805 4.043 20 0 DIADLO C[N@H+](Cc1nc2ccccc2o1)Cc1cc(F)cc(Cl)c1 ZINC001140542593 1046774589 /nfs/dbraw/zinc/77/45/89/1046774589.db2.gz OVPQXLIKIKZGBI-UHFFFAOYSA-N 1 2 304.752 4.252 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2o1)Cc1cc(F)cc(Cl)c1 ZINC001140542593 1046774606 /nfs/dbraw/zinc/77/46/06/1046774606.db2.gz OVPQXLIKIKZGBI-UHFFFAOYSA-N 1 2 304.752 4.252 20 0 DIADLO CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455492809 1046775495 /nfs/dbraw/zinc/77/54/95/1046775495.db2.gz LLPUCMYMPWRZJY-BLLLJJGKSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H]2c2ccsc2)c(C)[nH+]1 ZINC000455486276 1046775755 /nfs/dbraw/zinc/77/57/55/1046775755.db2.gz RPOPRDVMJTWNOR-OAHLLOKOSA-N 1 2 315.442 4.437 20 0 DIADLO Cc1cc(C)c(NC(=O)NC[C@@H](C)c2ccc(F)cc2)c(C)[nH+]1 ZINC000455491589 1046775961 /nfs/dbraw/zinc/77/59/61/1046775961.db2.gz YPKRWIGOSHOFKQ-GFCCVEGCSA-N 1 2 315.392 4.071 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@H](CC(C)(C)C)C2)c(C)[nH+]1 ZINC000455523416 1046779166 /nfs/dbraw/zinc/77/91/66/1046779166.db2.gz OKGJQYULPOBOOP-HNNXBMFYSA-N 1 2 303.450 4.297 20 0 DIADLO C=Cc1ccc(CCNC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000455522328 1046779197 /nfs/dbraw/zinc/77/91/97/1046779197.db2.gz NMFYTPHPYHCSLT-UHFFFAOYSA-N 1 2 309.413 4.014 20 0 DIADLO Cc1cc(C)c2c(c1)CN(C(=O)Nc1c(C)cc(C)[nH+]c1C)CC2 ZINC000455525544 1046781423 /nfs/dbraw/zinc/78/14/23/1046781423.db2.gz PLACVSZFEQJKNB-UHFFFAOYSA-N 1 2 323.440 4.214 20 0 DIADLO Oc1ccc([C@H]2CCC[N@@H+]2Cc2ncc(Cl)cc2Cl)cc1 ZINC000679134755 1046782778 /nfs/dbraw/zinc/78/27/78/1046782778.db2.gz XQYQIXJLCAIZTJ-MRXNPFEDSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@H]2CCC[N@H+]2Cc2ncc(Cl)cc2Cl)cc1 ZINC000679134755 1046782789 /nfs/dbraw/zinc/78/27/89/1046782789.db2.gz XQYQIXJLCAIZTJ-MRXNPFEDSA-N 1 2 323.223 4.431 20 0 DIADLO Clc1cc(C[NH+]2CCC3(CCCO3)CC2)c(Cl)s1 ZINC001140588665 1046797146 /nfs/dbraw/zinc/79/71/46/1046797146.db2.gz GQBVFXSZZPDGGJ-UHFFFAOYSA-N 1 2 306.258 4.200 20 0 DIADLO COc1ccc(-c2cnc(C[N@H+](C)[C@H](C)c3ccco3)o2)cc1 ZINC000069065041 1046790572 /nfs/dbraw/zinc/79/05/72/1046790572.db2.gz YMBALUAIRHQULD-CYBMUJFWSA-N 1 2 312.369 4.136 20 0 DIADLO COc1ccc(-c2cnc(C[N@@H+](C)[C@H](C)c3ccco3)o2)cc1 ZINC000069065041 1046790582 /nfs/dbraw/zinc/79/05/82/1046790582.db2.gz YMBALUAIRHQULD-CYBMUJFWSA-N 1 2 312.369 4.136 20 0 DIADLO CCC1(CC)CCC([NH2+][C@H](c2cccs2)c2nnc[nH]2)CC1 ZINC000645454820 1046792284 /nfs/dbraw/zinc/79/22/84/1046792284.db2.gz UFYJUGFVCCEOTR-OAHLLOKOSA-N 1 2 318.490 4.294 20 0 DIADLO CC[N@H+](Cc1coc(-c2ccc(C)cc2)n1)Cc1ccncc1 ZINC000072185793 1046796855 /nfs/dbraw/zinc/79/68/55/1046796855.db2.gz XODNAQQQNANAIJ-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO CC[N@@H+](Cc1coc(-c2ccc(C)cc2)n1)Cc1ccncc1 ZINC000072185793 1046796866 /nfs/dbraw/zinc/79/68/66/1046796866.db2.gz XODNAQQQNANAIJ-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cc[nH+]1 ZINC000073409131 1046800083 /nfs/dbraw/zinc/80/00/83/1046800083.db2.gz OZOUYRSSNOUDDD-UONOGXRCSA-N 1 2 320.314 4.151 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)[N@H+]1CC=CCC1 ZINC000679322069 1046810704 /nfs/dbraw/zinc/81/07/04/1046810704.db2.gz UGHISOKTISLDLM-MRXNPFEDSA-N 1 2 322.408 4.068 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)[N@@H+]1CC=CCC1 ZINC000679322069 1046810717 /nfs/dbraw/zinc/81/07/17/1046810717.db2.gz UGHISOKTISLDLM-MRXNPFEDSA-N 1 2 322.408 4.068 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H](C)COc1ccc(C(C)(C)C)cc1 ZINC000679333932 1046813124 /nfs/dbraw/zinc/81/31/24/1046813124.db2.gz WZYOZJSWEBXSEB-KGLIPLIRSA-N 1 2 315.461 4.134 20 0 DIADLO COCC[C@@H]([NH2+][C@H](C)c1nc(C)sc1C)c1ccc(C)o1 ZINC000679359915 1046828273 /nfs/dbraw/zinc/82/82/73/1046828273.db2.gz GDJKAIFGPSUWLX-BXUZGUMPSA-N 1 2 308.447 4.090 20 0 DIADLO FC(F)C(F)(F)C[N@@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000796282218 1046831225 /nfs/dbraw/zinc/83/12/25/1046831225.db2.gz KHMGATQPXUZZNI-MGPQQGTHSA-N 1 2 301.327 4.155 20 0 DIADLO FC(F)C(F)(F)C[N@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000796282218 1046831247 /nfs/dbraw/zinc/83/12/47/1046831247.db2.gz KHMGATQPXUZZNI-MGPQQGTHSA-N 1 2 301.327 4.155 20 0 DIADLO COc1c(C)cnc(C[NH2+]C2(c3ccccc3Cl)CC2)c1C ZINC000645976488 1046838179 /nfs/dbraw/zinc/83/81/79/1046838179.db2.gz GVGAGDIHOYIKHV-UHFFFAOYSA-N 1 2 316.832 4.139 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c4ccccc4oc3C2)cc(C)c1O ZINC001140659522 1046838456 /nfs/dbraw/zinc/83/84/56/1046838456.db2.gz HAWVUYFMNFENKH-UHFFFAOYSA-N 1 2 307.393 4.314 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c4ccccc4oc3C2)cc(C)c1O ZINC001140659522 1046838472 /nfs/dbraw/zinc/83/84/72/1046838472.db2.gz HAWVUYFMNFENKH-UHFFFAOYSA-N 1 2 307.393 4.314 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)cc(Cl)n1 ZINC000797589560 1046856902 /nfs/dbraw/zinc/85/69/02/1046856902.db2.gz YQMVRUUYVVUFIR-UHFFFAOYSA-N 1 2 322.786 4.486 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)cc(Cl)n1 ZINC000797589560 1046856920 /nfs/dbraw/zinc/85/69/20/1046856920.db2.gz YQMVRUUYVVUFIR-UHFFFAOYSA-N 1 2 322.786 4.486 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[N@@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646116852 1046860665 /nfs/dbraw/zinc/86/06/65/1046860665.db2.gz HJERXXJRSBAQJM-YOEHRIQHSA-N 1 2 321.424 4.401 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[N@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646116852 1046860686 /nfs/dbraw/zinc/86/06/86/1046860686.db2.gz HJERXXJRSBAQJM-YOEHRIQHSA-N 1 2 321.424 4.401 20 0 DIADLO Cc1nc(C[N@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)cs1 ZINC000076731864 1046866882 /nfs/dbraw/zinc/86/68/82/1046866882.db2.gz DCUBXVOYTLKZHS-MLGOLLRUSA-N 1 2 304.484 4.130 20 0 DIADLO Cc1nc(C[N@@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)cs1 ZINC000076731864 1046866895 /nfs/dbraw/zinc/86/68/95/1046866895.db2.gz DCUBXVOYTLKZHS-MLGOLLRUSA-N 1 2 304.484 4.130 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(Cl)c(Cl)c1 ZINC000393327946 1046870760 /nfs/dbraw/zinc/87/07/60/1046870760.db2.gz WFKXMLKIAZIJFF-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1c(Cl)ncc2ccccc21 ZINC001140724848 1046878411 /nfs/dbraw/zinc/87/84/11/1046878411.db2.gz RCVOUECTJIZLMG-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1c(Cl)ncc2ccccc21 ZINC001140724848 1046878426 /nfs/dbraw/zinc/87/84/26/1046878426.db2.gz RCVOUECTJIZLMG-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000679583742 1046878869 /nfs/dbraw/zinc/87/88/69/1046878869.db2.gz HCUXNCLUWJMUKM-GXTWGEPZSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000679583742 1046878890 /nfs/dbraw/zinc/87/88/90/1046878890.db2.gz HCUXNCLUWJMUKM-GXTWGEPZSA-N 1 2 323.362 4.240 20 0 DIADLO Brc1ccnc(C[N@@H+]2CCC[C@@H]2c2cccs2)c1 ZINC001140765458 1046889516 /nfs/dbraw/zinc/88/95/16/1046889516.db2.gz WLAAXYRGPUGFDH-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccnc(C[N@H+]2CCC[C@@H]2c2cccs2)c1 ZINC001140765458 1046889536 /nfs/dbraw/zinc/88/95/36/1046889536.db2.gz WLAAXYRGPUGFDH-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO FC(F)O[C@H]1CCC[N@H+](Cc2ccc(Cl)c(Cl)c2)C1 ZINC000679685480 1046891878 /nfs/dbraw/zinc/89/18/78/1046891878.db2.gz YWBOPTUXKPCAQM-JTQLQIEISA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@H]1CCC[N@@H+](Cc2ccc(Cl)c(Cl)c2)C1 ZINC000679685480 1046891890 /nfs/dbraw/zinc/89/18/90/1046891890.db2.gz YWBOPTUXKPCAQM-JTQLQIEISA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@@H]1CCC[N@H+](Cc2ccc(Cl)c(Cl)c2)C1 ZINC000679685481 1046892663 /nfs/dbraw/zinc/89/26/63/1046892663.db2.gz YWBOPTUXKPCAQM-SNVBAGLBSA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@@H]1CCC[N@@H+](Cc2ccc(Cl)c(Cl)c2)C1 ZINC000679685481 1046892678 /nfs/dbraw/zinc/89/26/78/1046892678.db2.gz YWBOPTUXKPCAQM-SNVBAGLBSA-N 1 2 310.171 4.197 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC3(CC=CC3)[C@@H]2C(C)C)c(C)[nH+]1 ZINC000646408292 1046896355 /nfs/dbraw/zinc/89/63/55/1046896355.db2.gz IKNSLOBHCLVWBS-KRWDZBQOSA-N 1 2 313.445 4.215 20 0 DIADLO FC(F)(F)c1cc(C[NH2+]Cc2cscn2)ccc1Cl ZINC000237826482 1046896602 /nfs/dbraw/zinc/89/66/02/1046896602.db2.gz GRRCHWZNCRPGAN-UHFFFAOYSA-N 1 2 306.740 4.105 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c(Cl)c1 ZINC001140798546 1046904225 /nfs/dbraw/zinc/90/42/25/1046904225.db2.gz NZEXCCOKQDRUBE-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@H](c3ccccc3)C2)c(Cl)c1 ZINC001140798546 1046904237 /nfs/dbraw/zinc/90/42/37/1046904237.db2.gz NZEXCCOKQDRUBE-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO c1cn(-c2ccc(NCc3cccc4cnccc43)cc2)c[nH+]1 ZINC000679927479 1046913226 /nfs/dbraw/zinc/91/32/26/1046913226.db2.gz AHCYAQIEPBUICS-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+]Cc1csc(Nc2ccccc2)n1 ZINC000679939997 1046913460 /nfs/dbraw/zinc/91/34/60/1046913460.db2.gz ISGAYCBJNDFVMW-CQSZACIVSA-N 1 2 324.453 4.441 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3cc(F)ccc3C2)c(Cl)c1 ZINC001140823090 1046916563 /nfs/dbraw/zinc/91/65/63/1046916563.db2.gz TVQZGWNUVMXAFW-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(C[N@H+]2CCc3cc(F)ccc3C2)c(Cl)c1 ZINC001140823090 1046916580 /nfs/dbraw/zinc/91/65/80/1046916580.db2.gz TVQZGWNUVMXAFW-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(C[N@@H+]2CCC(=O)[C@@H](C)C23CCCC3)c(Cl)c1 ZINC001140823346 1046917207 /nfs/dbraw/zinc/91/72/07/1046917207.db2.gz CUNFBCYRBKPIGD-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO COc1ccc(C[N@H+]2CCC(=O)[C@@H](C)C23CCCC3)c(Cl)c1 ZINC001140823346 1046917211 /nfs/dbraw/zinc/91/72/11/1046917211.db2.gz CUNFBCYRBKPIGD-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c(F)c1 ZINC001140826185 1046918746 /nfs/dbraw/zinc/91/87/46/1046918746.db2.gz DPNBXKXXAQFVMU-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c(F)c1 ZINC001140826185 1046918760 /nfs/dbraw/zinc/91/87/60/1046918760.db2.gz DPNBXKXXAQFVMU-SFHVURJKSA-N 1 2 321.342 4.450 20 0 DIADLO CC[N@H+](Cc1ccc(F)cc1)Cc1c(F)cc(OC)cc1F ZINC001140827768 1046919196 /nfs/dbraw/zinc/91/91/96/1046919196.db2.gz KCYSXVDVRQNFLF-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccc(F)cc1)Cc1c(F)cc(OC)cc1F ZINC001140827768 1046919209 /nfs/dbraw/zinc/91/92/09/1046919209.db2.gz KCYSXVDVRQNFLF-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO C[C@@H](Cc1ccsc1)[N@@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000679983986 1046920681 /nfs/dbraw/zinc/92/06/81/1046920681.db2.gz HPVWOUGBFOCOSE-WFASDCNBSA-N 1 2 317.458 4.167 20 0 DIADLO C[C@@H](Cc1ccsc1)[N@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000679983986 1046920690 /nfs/dbraw/zinc/92/06/90/1046920690.db2.gz HPVWOUGBFOCOSE-WFASDCNBSA-N 1 2 317.458 4.167 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1cc(Cl)c(O)c(Cl)c1 ZINC001140834602 1046923395 /nfs/dbraw/zinc/92/33/95/1046923395.db2.gz RCMQPWGXEVYJKJ-UHFFFAOYSA-N 1 2 302.226 4.393 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1cc(Cl)c(O)c(Cl)c1 ZINC001140834602 1046923401 /nfs/dbraw/zinc/92/34/01/1046923401.db2.gz RCMQPWGXEVYJKJ-UHFFFAOYSA-N 1 2 302.226 4.393 20 0 DIADLO COc1cc(C)ccc1C[NH2+][C@@H]1COCc2cccc(Cl)c21 ZINC000798180938 1046933753 /nfs/dbraw/zinc/93/37/53/1046933753.db2.gz DXSMKUQMOGCZMX-MRXNPFEDSA-N 1 2 317.816 4.018 20 0 DIADLO COc1cc(C)ccc1C[NH2+][C@H]1COCc2cccc(Cl)c21 ZINC000798180928 1046934877 /nfs/dbraw/zinc/93/48/77/1046934877.db2.gz DXSMKUQMOGCZMX-INIZCTEOSA-N 1 2 317.816 4.018 20 0 DIADLO CC[C@@H]([NH2+][C@@H]1COCc2cccc(Cl)c21)c1c(C)noc1C ZINC000798181501 1046935081 /nfs/dbraw/zinc/93/50/81/1046935081.db2.gz KRBJBQFYANNKCX-HUUCEWRRSA-N 1 2 320.820 4.257 20 0 DIADLO Clc1cc(Nc2ccc(-n3cc[nH+]c3)cc2)cc(Cl)n1 ZINC001212094575 1046936545 /nfs/dbraw/zinc/93/65/45/1046936545.db2.gz WSZJKQDUMONIRB-UHFFFAOYSA-N 1 2 305.168 4.318 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1cccc(Cl)c1 ZINC000680041914 1046937772 /nfs/dbraw/zinc/93/77/72/1046937772.db2.gz PGWIWZHRQWCZFJ-LKFCYVNXSA-N 1 2 309.743 4.403 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1ccc(F)c(F)c1 ZINC000680040994 1046937967 /nfs/dbraw/zinc/93/79/67/1046937967.db2.gz DYSQFBIIAZQCRZ-CLAHSXSESA-N 1 2 311.278 4.027 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cnc(C2CC2)s1 ZINC000162055833 1046941316 /nfs/dbraw/zinc/94/13/16/1046941316.db2.gz POZOUFIFVFVYGA-UHFFFAOYSA-N 1 2 316.405 4.141 20 0 DIADLO C[N@H+](Cc1ccc(O)c(F)c1F)Cc1cccc2ccccc21 ZINC001140890891 1046942980 /nfs/dbraw/zinc/94/29/80/1046942980.db2.gz PFNXMAKMDPKUAM-UHFFFAOYSA-N 1 2 313.347 4.456 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc(O)c(F)c1F ZINC001140892881 1046943847 /nfs/dbraw/zinc/94/38/47/1046943847.db2.gz CVDOTKRHBCHFPR-OAHLLOKOSA-N 1 2 303.352 4.180 20 0 DIADLO COCC[C@H](Cc1ccco1)Nc1[nH+]c2ccccc2cc1C ZINC000680065652 1046943887 /nfs/dbraw/zinc/94/38/87/1046943887.db2.gz XCILOFVDEQUTOX-MRXNPFEDSA-N 1 2 310.397 4.196 20 0 DIADLO CC[N@H+](Cc1ccc(OC)c(N)c1)Cc1c(F)cccc1Cl ZINC001140902410 1046946457 /nfs/dbraw/zinc/94/64/57/1046946457.db2.gz YAYABIVXIKHNRE-UHFFFAOYSA-N 1 2 322.811 4.092 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)c(N)c1)Cc1c(F)cccc1Cl ZINC001140902410 1046946467 /nfs/dbraw/zinc/94/64/67/1046946467.db2.gz YAYABIVXIKHNRE-UHFFFAOYSA-N 1 2 322.811 4.092 20 0 DIADLO COCc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2)o1 ZINC000162204490 1046948912 /nfs/dbraw/zinc/94/89/12/1046948912.db2.gz HQNXPOVRCNZCPB-UHFFFAOYSA-N 1 2 311.381 4.221 20 0 DIADLO COCc1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2)o1 ZINC000162204490 1046948923 /nfs/dbraw/zinc/94/89/23/1046948923.db2.gz HQNXPOVRCNZCPB-UHFFFAOYSA-N 1 2 311.381 4.221 20 0 DIADLO Cc1nccnc1C[N@H+](C)Cc1ccccc1Oc1ccccc1 ZINC001140938514 1046956416 /nfs/dbraw/zinc/95/64/16/1046956416.db2.gz WROIJPBNRCSUQX-UHFFFAOYSA-N 1 2 319.408 4.209 20 0 DIADLO Cc1nccnc1C[N@@H+](C)Cc1ccccc1Oc1ccccc1 ZINC001140938514 1046956422 /nfs/dbraw/zinc/95/64/22/1046956422.db2.gz WROIJPBNRCSUQX-UHFFFAOYSA-N 1 2 319.408 4.209 20 0 DIADLO CCc1noc(C)c1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC000162372627 1046963920 /nfs/dbraw/zinc/96/39/20/1046963920.db2.gz BLFFGRVZSPPJGU-UHFFFAOYSA-N 1 2 310.397 4.341 20 0 DIADLO CCc1noc(C)c1C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000162372627 1046963932 /nfs/dbraw/zinc/96/39/32/1046963932.db2.gz BLFFGRVZSPPJGU-UHFFFAOYSA-N 1 2 310.397 4.341 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1ccccc1Cl ZINC000162367093 1046964763 /nfs/dbraw/zinc/96/47/63/1046964763.db2.gz BPBNKZRATQPBFK-SNVBAGLBSA-N 1 2 304.752 4.471 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CCC[C@@H]2c2ccccc2F)cc1F ZINC001140990904 1046970214 /nfs/dbraw/zinc/97/02/14/1046970214.db2.gz CHBGAEXEWLDTAS-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1c(F)cc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)cc1F ZINC001140987742 1046970701 /nfs/dbraw/zinc/97/07/01/1046970701.db2.gz BSOUNSVGVBWPLU-QGZVFWFLSA-N 1 2 303.352 4.398 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CCCC[C@@H]2c2ccccc2)cc1F ZINC001140987742 1046970707 /nfs/dbraw/zinc/97/07/07/1046970707.db2.gz BSOUNSVGVBWPLU-QGZVFWFLSA-N 1 2 303.352 4.398 20 0 DIADLO Fc1cc2c(c(F)c1)[C@@H]([NH2+][C@@H]1CCSc3ccccc31)CO2 ZINC000680354885 1046972348 /nfs/dbraw/zinc/97/23/48/1046972348.db2.gz KCIAXVHCJHWPPE-KGLIPLIRSA-N 1 2 319.376 4.225 20 0 DIADLO c1snnc1C[NH+]1CCC(c2ccc3ccccc3c2)CC1 ZINC001140996807 1046972600 /nfs/dbraw/zinc/97/26/00/1046972600.db2.gz DKUZIKBLGYKKFC-UHFFFAOYSA-N 1 2 309.438 4.071 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1c[nH]nc1C(F)(F)F ZINC001141017973 1046979780 /nfs/dbraw/zinc/97/97/80/1046979780.db2.gz DMQXRJKVQIJTID-VIFPVBQESA-N 1 2 317.742 4.275 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1c[nH]nc1C(F)(F)F ZINC001141017973 1046979788 /nfs/dbraw/zinc/97/97/88/1046979788.db2.gz DMQXRJKVQIJTID-VIFPVBQESA-N 1 2 317.742 4.275 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2cc(Cl)cc3c2OCC3)c(C)s1 ZINC000680469317 1046986433 /nfs/dbraw/zinc/98/64/33/1046986433.db2.gz CPNLCGXDDVILEH-SECBINFHSA-N 1 2 322.861 4.199 20 0 DIADLO Cc1ccncc1C[N@@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001141036354 1046986547 /nfs/dbraw/zinc/98/65/47/1046986547.db2.gz XAPJLXQTEXESKH-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccncc1C[N@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001141036354 1046986555 /nfs/dbraw/zinc/98/65/55/1046986555.db2.gz XAPJLXQTEXESKH-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc([NH2+][C@@H]2CCC[C@@H]([C@@H]3CCOC3)C2)ccc1N(C)C ZINC000798931699 1046986707 /nfs/dbraw/zinc/98/67/07/1046986707.db2.gz DFNQNOIUQBUUDR-BRWVUGGUSA-N 1 2 302.462 4.068 20 0 DIADLO Cc1cc(N[C@@H]2CCC[C@@H]([C@@H]3CCOC3)C2)ccc1[NH+](C)C ZINC000798931699 1046986717 /nfs/dbraw/zinc/98/67/17/1046986717.db2.gz DFNQNOIUQBUUDR-BRWVUGGUSA-N 1 2 302.462 4.068 20 0 DIADLO Fc1cccc(C[C@H]2CCC[N@@H+]2Cc2csc(Cl)n2)c1 ZINC000827430447 1046989788 /nfs/dbraw/zinc/98/97/88/1046989788.db2.gz MTBDQBLHDXLKDQ-CQSZACIVSA-N 1 2 310.825 4.143 20 0 DIADLO Fc1cccc(C[C@H]2CCC[N@H+]2Cc2csc(Cl)n2)c1 ZINC000827430447 1046989793 /nfs/dbraw/zinc/98/97/93/1046989793.db2.gz MTBDQBLHDXLKDQ-CQSZACIVSA-N 1 2 310.825 4.143 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@@H]2c2ccccc2OC)c[nH]1 ZINC001141070105 1046996377 /nfs/dbraw/zinc/99/63/77/1046996377.db2.gz OYMNYJGWLFGZQU-QGZVFWFLSA-N 1 2 313.445 4.098 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@@H]2c2ccccc2OC)c[nH]1 ZINC001141070105 1046996393 /nfs/dbraw/zinc/99/63/93/1046996393.db2.gz OYMNYJGWLFGZQU-QGZVFWFLSA-N 1 2 313.445 4.098 20 0 DIADLO CCCCc1[nH]c(CN2CCC[C@H]2c2c(F)cccc2F)c[nH+]1 ZINC001141071420 1046999460 /nfs/dbraw/zinc/99/94/60/1046999460.db2.gz OEKZPHNZWMAFKN-INIZCTEOSA-N 1 2 319.399 4.368 20 0 DIADLO CCCCc1[nH]cc(CN2CCC[C@H]2c2c(F)cccc2F)[nH+]1 ZINC001141071420 1046999466 /nfs/dbraw/zinc/99/94/66/1046999466.db2.gz OEKZPHNZWMAFKN-INIZCTEOSA-N 1 2 319.399 4.368 20 0 DIADLO C[N@H+](CC(=O)OC(C)(C)C)Cc1ccccc1-c1cccs1 ZINC001141093447 1047008456 /nfs/dbraw/zinc/00/84/56/1047008456.db2.gz AFPPHUPBLXUHQZ-UHFFFAOYSA-N 1 2 317.454 4.189 20 0 DIADLO C[N@@H+](CC(=O)OC(C)(C)C)Cc1ccccc1-c1cccs1 ZINC001141093447 1047008470 /nfs/dbraw/zinc/00/84/70/1047008470.db2.gz AFPPHUPBLXUHQZ-UHFFFAOYSA-N 1 2 317.454 4.189 20 0 DIADLO C/C(=C\c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1)C(C)(C)C ZINC000680695502 1047011575 /nfs/dbraw/zinc/01/15/75/1047011575.db2.gz GHAAIUOMCPSXQL-GXDHUFHOSA-N 1 2 322.412 4.431 20 0 DIADLO CC[N@H+](Cc1ccc(C)c(C)c1)Cc1ncc(Cl)nc1Cl ZINC001141137749 1047024676 /nfs/dbraw/zinc/02/46/76/1047024676.db2.gz PAEIRXSJIXLPHE-UHFFFAOYSA-N 1 2 324.255 4.422 20 0 DIADLO CC[N@@H+](Cc1ccc(C)c(C)c1)Cc1ncc(Cl)nc1Cl ZINC001141137749 1047024690 /nfs/dbraw/zinc/02/46/90/1047024690.db2.gz PAEIRXSJIXLPHE-UHFFFAOYSA-N 1 2 324.255 4.422 20 0 DIADLO CC[C@@H](c1ccccc1)[N@H+](C)Cc1ncc(Cl)nc1Cl ZINC001141138269 1047025667 /nfs/dbraw/zinc/02/56/67/1047025667.db2.gz HMEPYGPNCAPMPY-ZDUSSCGKSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1ncc(Cl)nc1Cl ZINC001141138269 1047025679 /nfs/dbraw/zinc/02/56/79/1047025679.db2.gz HMEPYGPNCAPMPY-ZDUSSCGKSA-N 1 2 310.228 4.367 20 0 DIADLO C(=C\c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1)\c1cccs1 ZINC000680750283 1047027930 /nfs/dbraw/zinc/02/79/30/1047027930.db2.gz TUCPSYUDHKNXCX-SREVYHEPSA-N 1 2 320.377 4.154 20 0 DIADLO CC(C)[N@H+](Cc1nnc(C(C)(C)C)[nH]1)Cc1cccc(Cl)c1 ZINC000432940812 1047028132 /nfs/dbraw/zinc/02/81/32/1047028132.db2.gz TVKQYAAAUDLAFL-UHFFFAOYSA-N 1 2 320.868 4.166 20 0 DIADLO CC(C)[N@@H+](Cc1nnc(C(C)(C)C)[nH]1)Cc1cccc(Cl)c1 ZINC000432940812 1047028145 /nfs/dbraw/zinc/02/81/45/1047028145.db2.gz TVKQYAAAUDLAFL-UHFFFAOYSA-N 1 2 320.868 4.166 20 0 DIADLO F[C@@H]1CC[N@H+](Cc2ccc(OCc3ccccc3)c(Cl)c2)C1 ZINC001141197977 1047044655 /nfs/dbraw/zinc/04/46/55/1047044655.db2.gz QCKBDFJNUFJRSH-MRXNPFEDSA-N 1 2 319.807 4.463 20 0 DIADLO F[C@@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)c(Cl)c2)C1 ZINC001141197977 1047044675 /nfs/dbraw/zinc/04/46/75/1047044675.db2.gz QCKBDFJNUFJRSH-MRXNPFEDSA-N 1 2 319.807 4.463 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)C[C@@H](C)O1 ZINC000536654382 1047045490 /nfs/dbraw/zinc/04/54/90/1047045490.db2.gz PPHFHDKXCODYHJ-UKRRQHHQSA-N 1 2 308.491 4.190 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)C[C@@H](C)O1 ZINC000536654382 1047045501 /nfs/dbraw/zinc/04/55/01/1047045501.db2.gz PPHFHDKXCODYHJ-UKRRQHHQSA-N 1 2 308.491 4.190 20 0 DIADLO CCc1ccccc1C[NH+](Cc1ccccn1)Cc1ccccn1 ZINC001141224197 1047052576 /nfs/dbraw/zinc/05/25/76/1047052576.db2.gz JDYSRWKKESXEJE-UHFFFAOYSA-N 1 2 317.436 4.241 20 0 DIADLO c1nc(C2CC2)sc1CNc1[nH+]c2ccccc2n1C1CC1 ZINC000680852638 1047054459 /nfs/dbraw/zinc/05/44/59/1047054459.db2.gz LVONATGBGBLQEQ-UHFFFAOYSA-N 1 2 310.426 4.317 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1nccc2ccccc21 ZINC000680851248 1047056088 /nfs/dbraw/zinc/05/60/88/1047056088.db2.gz FEFSLAJYVZIGJJ-UHFFFAOYSA-N 1 2 302.381 4.217 20 0 DIADLO Cc1cc(C[N@H+]2CCC(=O)C[C@@H]2C)ccc1OCc1ccccc1 ZINC001141251042 1047064760 /nfs/dbraw/zinc/06/47/60/1047064760.db2.gz IVHUROYRRZUKIH-KRWDZBQOSA-N 1 2 323.436 4.127 20 0 DIADLO Cc1cc(C[N@@H+]2CCC(=O)C[C@@H]2C)ccc1OCc1ccccc1 ZINC001141251042 1047064771 /nfs/dbraw/zinc/06/47/71/1047064771.db2.gz IVHUROYRRZUKIH-KRWDZBQOSA-N 1 2 323.436 4.127 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)o1 ZINC000536698021 1047076695 /nfs/dbraw/zinc/07/66/95/1047076695.db2.gz MONQHZVVDROILG-FAELENHSSA-N 1 2 317.454 4.427 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)o1 ZINC000536698021 1047076711 /nfs/dbraw/zinc/07/67/11/1047076711.db2.gz MONQHZVVDROILG-FAELENHSSA-N 1 2 317.454 4.427 20 0 DIADLO C[C@@H](Nc1cc(N)nc[nH+]1)c1ccccc1Oc1ccccc1 ZINC001115994415 1047098369 /nfs/dbraw/zinc/09/83/69/1047098369.db2.gz YXIRIHSVHIXNJF-CYBMUJFWSA-N 1 2 306.369 4.024 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[N@@H+]1CCO[C@H](c2ccccc2F)C1 ZINC001116188372 1047116771 /nfs/dbraw/zinc/11/67/71/1047116771.db2.gz YVCSMKVABIFZTC-OALUTQOASA-N 1 2 315.363 4.026 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[N@H+]1CCO[C@H](c2ccccc2F)C1 ZINC001116188372 1047116774 /nfs/dbraw/zinc/11/67/74/1047116774.db2.gz YVCSMKVABIFZTC-OALUTQOASA-N 1 2 315.363 4.026 20 0 DIADLO Fc1cc2[nH+]ccc(N3CC[C@H](C(F)F)C3)c2cc1Cl ZINC000649355429 1047121467 /nfs/dbraw/zinc/12/14/67/1047121467.db2.gz RFLILQPPIMYSQT-QMMMGPOBSA-N 1 2 300.711 4.119 20 0 DIADLO FC1(F)CC2(C[NH+](CCc3c(Cl)cccc3Cl)C2)C1 ZINC000649401608 1047124671 /nfs/dbraw/zinc/12/46/71/1047124671.db2.gz KDEQICCAFBZAPP-UHFFFAOYSA-N 1 2 306.183 4.267 20 0 DIADLO CCOc1ccc(C)cc1C[N@@H+]1CCC[C@H]1c1nccs1 ZINC001139605425 1047124831 /nfs/dbraw/zinc/12/48/31/1047124831.db2.gz YYATWQQELFKTKY-HNNXBMFYSA-N 1 2 302.443 4.187 20 0 DIADLO CCOc1ccc(C)cc1C[N@H+]1CCC[C@H]1c1nccs1 ZINC001139605425 1047124837 /nfs/dbraw/zinc/12/48/37/1047124837.db2.gz YYATWQQELFKTKY-HNNXBMFYSA-N 1 2 302.443 4.187 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1nccn1C(C)C ZINC000537024808 1047133338 /nfs/dbraw/zinc/13/33/38/1047133338.db2.gz ZPTYYDMLDDXNAH-OAHLLOKOSA-N 1 2 301.434 4.102 20 0 DIADLO Cc1nc2ccccc2nc1C[NH2+][C@@H](C)c1c(F)cccc1F ZINC000537026272 1047133623 /nfs/dbraw/zinc/13/36/23/1047133623.db2.gz AIEZFHIJPIQVKT-LBPRGKRZSA-N 1 2 313.351 4.067 20 0 DIADLO COc1cc(CNc2c[nH+]ccc2OC(C)(C)C)ccc1F ZINC001116377012 1047134282 /nfs/dbraw/zinc/13/42/82/1047134282.db2.gz CPVQBNITXGGFBL-UHFFFAOYSA-N 1 2 304.365 4.019 20 0 DIADLO CC[N@H+](Cc1cc2n(n1)CCC2)Cc1ccc(Cl)c(Cl)c1 ZINC000649491830 1047138162 /nfs/dbraw/zinc/13/81/62/1047138162.db2.gz BRIZGUBEEPHLQZ-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO CC[N@@H+](Cc1cc2n(n1)CCC2)Cc1ccc(Cl)c(Cl)c1 ZINC000649491830 1047138167 /nfs/dbraw/zinc/13/81/67/1047138167.db2.gz BRIZGUBEEPHLQZ-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO C[N@H+](Cc1cc2n(n1)CCCC2)Cc1csc2ccccc12 ZINC000649487148 1047138206 /nfs/dbraw/zinc/13/82/06/1047138206.db2.gz RRZMQBCDJRCDNJ-UHFFFAOYSA-N 1 2 311.454 4.066 20 0 DIADLO C[N@@H+](Cc1cc2n(n1)CCCC2)Cc1csc2ccccc12 ZINC000649487148 1047138212 /nfs/dbraw/zinc/13/82/12/1047138212.db2.gz RRZMQBCDJRCDNJ-UHFFFAOYSA-N 1 2 311.454 4.066 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccc(OCC3CC3)c(F)c2)o1 ZINC000537126003 1047139472 /nfs/dbraw/zinc/13/94/72/1047139472.db2.gz SIQZQPPLKDRWEZ-CHWSQXEVSA-N 1 2 318.392 4.323 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1nc2c(s1)CCCC2 ZINC000681697509 1047141856 /nfs/dbraw/zinc/14/18/56/1047141856.db2.gz NUNSJRKYZXJOMJ-UHFFFAOYSA-N 1 2 310.825 4.104 20 0 DIADLO CC(C)(C)C(F)(F)C[NH2+]Cc1ccc2c(c1)COC(C)(C)O2 ZINC000827722208 1047149812 /nfs/dbraw/zinc/14/98/12/1047149812.db2.gz CQZAGJJTOQKNFR-UHFFFAOYSA-N 1 2 313.388 4.103 20 0 DIADLO Fc1cccc(Br)c1C[NH+]1CC(c2ccccc2)C1 ZINC001137467617 1047150764 /nfs/dbraw/zinc/15/07/64/1047150764.db2.gz FCDBQGIBYJDWQA-UHFFFAOYSA-N 1 2 320.205 4.188 20 0 DIADLO CC(C)Oc1ccnc(C[NH2+]C2(c3ccccc3Cl)CC2)c1 ZINC000649635238 1047154981 /nfs/dbraw/zinc/15/49/81/1047154981.db2.gz LHNWCWJICPOJFK-UHFFFAOYSA-N 1 2 316.832 4.301 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1nccc2ccccc21 ZINC000681963839 1047155604 /nfs/dbraw/zinc/15/56/04/1047155604.db2.gz UWCPAKYPHZCVSY-UHFFFAOYSA-N 1 2 320.371 4.356 20 0 DIADLO FC(F)n1ccnc1C[NH2+]C1(c2ccccc2Cl)CCC1 ZINC000649642600 1047157799 /nfs/dbraw/zinc/15/77/99/1047157799.db2.gz GTERPTDNYPXYPE-UHFFFAOYSA-N 1 2 311.763 4.101 20 0 DIADLO COCc1ccc(C[NH2+]Cc2c(Cl)cccc2Cl)o1 ZINC000537263589 1047159365 /nfs/dbraw/zinc/15/93/65/1047159365.db2.gz JBIJULGKUIXLPQ-UHFFFAOYSA-N 1 2 300.185 4.023 20 0 DIADLO CC(C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2)=C1CCC1 ZINC000827787127 1047161425 /nfs/dbraw/zinc/16/14/25/1047161425.db2.gz HABMDPSZJUKHHZ-UHFFFAOYSA-N 1 2 319.408 4.041 20 0 DIADLO CC(C)c1ccc(C(C)(C)NC(=O)C[C@H](C)n2cc[nH+]c2)cc1 ZINC000649693508 1047165804 /nfs/dbraw/zinc/16/58/04/1047165804.db2.gz GMDRYDUNJGEPRQ-HNNXBMFYSA-N 1 2 313.445 4.009 20 0 DIADLO CC[C@H]1C[N@H+](Cc2ncc(-c3ccccc3C)o2)[C@@H](CC)CO1 ZINC000649721576 1047166945 /nfs/dbraw/zinc/16/69/45/1047166945.db2.gz ZXIVFEGFXSNDHH-HOTGVXAUSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2ncc(-c3ccccc3C)o2)[C@@H](CC)CO1 ZINC000649721576 1047166951 /nfs/dbraw/zinc/16/69/51/1047166951.db2.gz ZXIVFEGFXSNDHH-HOTGVXAUSA-N 1 2 314.429 4.039 20 0 DIADLO CCc1ccc(-c2nc(C(=O)Nc3cc[nH+]c(C)c3)cs2)cc1 ZINC000010165086 1047185058 /nfs/dbraw/zinc/18/50/58/1047185058.db2.gz DPRBKKQGSCNVGF-UHFFFAOYSA-N 1 2 323.421 4.328 20 0 DIADLO CCCC(C)(C)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000649869902 1047185285 /nfs/dbraw/zinc/18/52/85/1047185285.db2.gz PCAWVUNHUUWHHA-UHFFFAOYSA-N 1 2 323.440 4.367 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccccc1N(C)C ZINC000537426884 1047185812 /nfs/dbraw/zinc/18/58/12/1047185812.db2.gz UEYJIWMXXYJXQQ-INIZCTEOSA-N 1 2 324.472 4.311 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1n[nH]c2ccc(Br)cc21 ZINC001139658714 1047192197 /nfs/dbraw/zinc/19/21/97/1047192197.db2.gz OPTXBDVINMGRRS-LBPRGKRZSA-N 1 2 322.250 4.090 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1n[nH]c2ccc(Br)cc21 ZINC001139658714 1047192204 /nfs/dbraw/zinc/19/22/04/1047192204.db2.gz OPTXBDVINMGRRS-LBPRGKRZSA-N 1 2 322.250 4.090 20 0 DIADLO Clc1cnc(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)cn1 ZINC000839127572 1047196273 /nfs/dbraw/zinc/19/62/73/1047196273.db2.gz UZDRIRVCTNMUER-QGZVFWFLSA-N 1 2 313.832 4.247 20 0 DIADLO Clc1cnc(C[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)cn1 ZINC000839127572 1047196281 /nfs/dbraw/zinc/19/62/81/1047196281.db2.gz UZDRIRVCTNMUER-QGZVFWFLSA-N 1 2 313.832 4.247 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1csc(Cl)c1 ZINC000682497392 1047200801 /nfs/dbraw/zinc/20/08/01/1047200801.db2.gz BGZJEPNCRDYUCS-WRWORJQWSA-N 1 2 315.772 4.464 20 0 DIADLO C[C@@H]1CCC[N@@H+]1Cc1cc(Br)cc(Cl)c1F ZINC001141593970 1047209072 /nfs/dbraw/zinc/20/90/72/1047209072.db2.gz XMYKZKOWVIGNSH-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@@H]1CCC[N@H+]1Cc1cc(Br)cc(Cl)c1F ZINC001141593970 1047209081 /nfs/dbraw/zinc/20/90/81/1047209081.db2.gz XMYKZKOWVIGNSH-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc(-c3ccncc3)cc2F)nc1 ZINC000682788643 1047224284 /nfs/dbraw/zinc/22/42/84/1047224284.db2.gz SOKMXTROURGXEO-UHFFFAOYSA-N 1 2 321.399 4.223 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc(-c3ccncc3)cc2F)nc1 ZINC000682788643 1047224293 /nfs/dbraw/zinc/22/42/93/1047224293.db2.gz SOKMXTROURGXEO-UHFFFAOYSA-N 1 2 321.399 4.223 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cnc(C3CCCC3)s2)nc1 ZINC000682788055 1047224678 /nfs/dbraw/zinc/22/46/78/1047224678.db2.gz PQWHICNUIFJDOI-UHFFFAOYSA-N 1 2 301.459 4.136 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cnc(C3CCCC3)s2)nc1 ZINC000682788055 1047224693 /nfs/dbraw/zinc/22/46/93/1047224693.db2.gz PQWHICNUIFJDOI-UHFFFAOYSA-N 1 2 301.459 4.136 20 0 DIADLO COCc1ccc(SCc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000682860877 1047232417 /nfs/dbraw/zinc/23/24/17/1047232417.db2.gz MEQATOKIAXPBJD-UHFFFAOYSA-N 1 2 310.422 4.311 20 0 DIADLO CC(C)(C)c1cnc(CO[NH+]=C(N)c2cccc3ccccc32)o1 ZINC000760443833 1047236559 /nfs/dbraw/zinc/23/65/59/1047236559.db2.gz DVAIVGCCLLWLQX-UHFFFAOYSA-N 1 2 323.396 4.172 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@@H+]2Cc2cccc3ccoc32)no1 ZINC001117744095 1047238990 /nfs/dbraw/zinc/23/89/90/1047238990.db2.gz VGGKRUHXPRHANZ-HNNXBMFYSA-N 1 2 311.385 4.105 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@H+]2Cc2cccc3ccoc32)no1 ZINC001117744095 1047238998 /nfs/dbraw/zinc/23/89/98/1047238998.db2.gz VGGKRUHXPRHANZ-HNNXBMFYSA-N 1 2 311.385 4.105 20 0 DIADLO Cc1cc(C[N@@H+]2CCn3c(Cl)ccc3[C@@H]2C)cc(Cl)n1 ZINC000839529692 1047242350 /nfs/dbraw/zinc/24/23/50/1047242350.db2.gz VEXBDMNOZPQUBE-NSHDSACASA-N 1 2 310.228 4.075 20 0 DIADLO Cc1cc(C[N@H+]2CCn3c(Cl)ccc3[C@@H]2C)cc(Cl)n1 ZINC000839529692 1047242356 /nfs/dbraw/zinc/24/23/56/1047242356.db2.gz VEXBDMNOZPQUBE-NSHDSACASA-N 1 2 310.228 4.075 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1ccc2cc(F)ccc2n1 ZINC001141640105 1047243582 /nfs/dbraw/zinc/24/35/82/1047243582.db2.gz NIZUOQPSJUXFQS-UHFFFAOYSA-N 1 2 321.808 4.116 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1ccc2cc(F)ccc2n1 ZINC001141640105 1047243593 /nfs/dbraw/zinc/24/35/93/1047243593.db2.gz NIZUOQPSJUXFQS-UHFFFAOYSA-N 1 2 321.808 4.116 20 0 DIADLO CCCC[N@H+](Cc1cn(C(C)(C)C)nn1)[C@H](C)c1ccc(C)o1 ZINC000682994065 1047247190 /nfs/dbraw/zinc/24/71/90/1047247190.db2.gz LITNDSSZANPEIV-OAHLLOKOSA-N 1 2 318.465 4.298 20 0 DIADLO CCCC[N@@H+](Cc1cn(C(C)(C)C)nn1)[C@H](C)c1ccc(C)o1 ZINC000682994065 1047247213 /nfs/dbraw/zinc/24/72/13/1047247213.db2.gz LITNDSSZANPEIV-OAHLLOKOSA-N 1 2 318.465 4.298 20 0 DIADLO C[N@H+](Cc1ccc2cc(F)ccc2n1)Cc1cccc(F)c1F ZINC001141652420 1047248073 /nfs/dbraw/zinc/24/80/73/1047248073.db2.gz LYECZQQIENHKGK-UHFFFAOYSA-N 1 2 316.326 4.284 20 0 DIADLO C[N@@H+](Cc1ccc2cc(F)ccc2n1)Cc1cccc(F)c1F ZINC001141652420 1047248080 /nfs/dbraw/zinc/24/80/80/1047248080.db2.gz LYECZQQIENHKGK-UHFFFAOYSA-N 1 2 316.326 4.284 20 0 DIADLO CC[N@H+](Cc1cc(C)ccn1)Cc1ccccc1Br ZINC000683005587 1047249632 /nfs/dbraw/zinc/24/96/32/1047249632.db2.gz YKGQOPFTNVHITK-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1cc(C)ccn1)Cc1ccccc1Br ZINC000683005587 1047249655 /nfs/dbraw/zinc/24/96/55/1047249655.db2.gz YKGQOPFTNVHITK-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CCn1ccc(C[N@H+](C)[C@@H](C)c2nc(-c3ccccc3C)no2)c1 ZINC000683031173 1047260350 /nfs/dbraw/zinc/26/03/50/1047260350.db2.gz KQAIRDZFPPCMCT-HNNXBMFYSA-N 1 2 324.428 4.059 20 0 DIADLO CCn1ccc(C[N@@H+](C)[C@@H](C)c2nc(-c3ccccc3C)no2)c1 ZINC000683031173 1047260366 /nfs/dbraw/zinc/26/03/66/1047260366.db2.gz KQAIRDZFPPCMCT-HNNXBMFYSA-N 1 2 324.428 4.059 20 0 DIADLO CCn1ccc(C[N@H+](C)[C@H](C)c2nc(-c3ccccc3C)no2)c1 ZINC000683031174 1047261869 /nfs/dbraw/zinc/26/18/69/1047261869.db2.gz KQAIRDZFPPCMCT-OAHLLOKOSA-N 1 2 324.428 4.059 20 0 DIADLO CCn1ccc(C[N@@H+](C)[C@H](C)c2nc(-c3ccccc3C)no2)c1 ZINC000683031174 1047261909 /nfs/dbraw/zinc/26/19/09/1047261909.db2.gz KQAIRDZFPPCMCT-OAHLLOKOSA-N 1 2 324.428 4.059 20 0 DIADLO Cc1cc2c(cn1)C[N@H+](Cc1ccc3c(c1)Cc1ccccc1-3)C2 ZINC001141739441 1047284368 /nfs/dbraw/zinc/28/43/68/1047284368.db2.gz IPVWKAKIKVMSNJ-UHFFFAOYSA-N 1 2 312.416 4.477 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+](Cc1ccc3c(c1)Cc1ccccc1-3)C2 ZINC001141739441 1047284376 /nfs/dbraw/zinc/28/43/76/1047284376.db2.gz IPVWKAKIKVMSNJ-UHFFFAOYSA-N 1 2 312.416 4.477 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Br)c(F)c2F)C2(CC2)C1 ZINC001141752068 1047285088 /nfs/dbraw/zinc/28/50/88/1047285088.db2.gz WNTNPYSGSUASIT-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Br)c(F)c2F)C2(CC2)C1 ZINC001141752068 1047285096 /nfs/dbraw/zinc/28/50/96/1047285096.db2.gz WNTNPYSGSUASIT-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(Br)cc(C[NH+]2CCC3(CC3)CC2)c1F ZINC001141797677 1047291369 /nfs/dbraw/zinc/29/13/69/1047291369.db2.gz WTYDVADSQBCKRN-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]Cc1c[nH]cn1 ZINC000796448651 1047293635 /nfs/dbraw/zinc/29/36/35/1047293635.db2.gz GEPJBNATUXBMGI-LBPRGKRZSA-N 1 2 312.442 4.001 20 0 DIADLO C[C@H](CC[NH2+]c1ccc(N2CCOCC2)cc1)c1ccccc1 ZINC000390269928 1047294603 /nfs/dbraw/zinc/29/46/03/1047294603.db2.gz JLRKXVFMQKZQIC-QGZVFWFLSA-N 1 2 310.441 4.129 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2coc3ccc(F)cc23)no1 ZINC001141846527 1047297381 /nfs/dbraw/zinc/29/73/81/1047297381.db2.gz BHRRXASLFFMINT-MRXNPFEDSA-N 1 2 300.333 4.205 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2coc3ccc(F)cc23)no1 ZINC001141846527 1047297392 /nfs/dbraw/zinc/29/73/92/1047297392.db2.gz BHRRXASLFFMINT-MRXNPFEDSA-N 1 2 300.333 4.205 20 0 DIADLO c1ccc2ncc(CNc3ccc([NH+]4CCCC4)cc3)cc2c1 ZINC000391168699 1047303584 /nfs/dbraw/zinc/30/35/84/1047303584.db2.gz FEMNOMRGYOFTBT-UHFFFAOYSA-N 1 2 303.409 4.447 20 0 DIADLO COc1cccc2cc(CNc3cccc(-n4cc[nH+]c4)c3)oc21 ZINC000391798902 1047305546 /nfs/dbraw/zinc/30/55/46/1047305546.db2.gz DZSCWDPTAYRKIS-UHFFFAOYSA-N 1 2 319.364 4.239 20 0 DIADLO CCC1(C)CC[NH+](Cn2nc(C3CC3)n(C3CC3)c2=S)CC1 ZINC000725777413 1047313306 /nfs/dbraw/zinc/31/33/06/1047313306.db2.gz HLWWZVTTYPAWEO-UHFFFAOYSA-N 1 2 320.506 4.096 20 0 DIADLO CCCOc1ccccc1C[N@@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001138995872 1047317852 /nfs/dbraw/zinc/31/78/52/1047317852.db2.gz XVNQBQTZXWNBBI-HNNXBMFYSA-N 1 2 301.352 4.045 20 0 DIADLO CCCOc1ccccc1C[N@H+]1CCCC(F)(F)[C@@H](F)C1 ZINC001138995872 1047317865 /nfs/dbraw/zinc/31/78/65/1047317865.db2.gz XVNQBQTZXWNBBI-HNNXBMFYSA-N 1 2 301.352 4.045 20 0 DIADLO Fc1cc2[nH+]ccc(N3CC[C@@]4(CC4(F)F)C3)c2cc1Cl ZINC000651489021 1047318515 /nfs/dbraw/zinc/31/85/15/1047318515.db2.gz KHDSFYDVBVBCNG-CQSZACIVSA-N 1 2 312.722 4.263 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@H](C)c1cccc(O)c1F)CCC2 ZINC001119067023 1047322663 /nfs/dbraw/zinc/32/26/63/1047322663.db2.gz ZKIAAASWEBXLIC-DOMZBBRYSA-N 1 2 317.408 4.037 20 0 DIADLO c1oc(C2CC2)nc1C[NH+]1CCC(c2nc3ccccc3o2)CC1 ZINC001119249391 1047324462 /nfs/dbraw/zinc/32/44/62/1047324462.db2.gz YTBDCTYWJHNSGL-UHFFFAOYSA-N 1 2 323.396 4.073 20 0 DIADLO Brc1ccccc1[C@@H]1C[N@H+](CC2CCCC2)CCO1 ZINC000726070906 1047332274 /nfs/dbraw/zinc/33/22/74/1047332274.db2.gz SBWCIYWEYBNZRB-INIZCTEOSA-N 1 2 324.262 4.013 20 0 DIADLO Brc1ccccc1[C@@H]1C[N@@H+](CC2CCCC2)CCO1 ZINC000726070906 1047332288 /nfs/dbraw/zinc/33/22/88/1047332288.db2.gz SBWCIYWEYBNZRB-INIZCTEOSA-N 1 2 324.262 4.013 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(F)ccc(Br)c2Cl)C1 ZINC001142080910 1047372822 /nfs/dbraw/zinc/37/28/22/1047372822.db2.gz PFVVNHRXEYAPCW-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO CCCc1ccc([C@@H](Nc2[nH+]cnc3c2cnn3C)C(C)C)cc1 ZINC000651960713 1047336848 /nfs/dbraw/zinc/33/68/48/1047336848.db2.gz SRPHFMZUHBMMHN-KRWDZBQOSA-N 1 2 323.444 4.125 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2sccc2Oc2ccccc2)CCC1=O ZINC001141994775 1047337808 /nfs/dbraw/zinc/33/78/08/1047337808.db2.gz YZCQEEIOKQRWSV-CQSZACIVSA-N 1 2 315.438 4.341 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2sccc2Oc2ccccc2)CCC1=O ZINC001141994775 1047337817 /nfs/dbraw/zinc/33/78/17/1047337817.db2.gz YZCQEEIOKQRWSV-CQSZACIVSA-N 1 2 315.438 4.341 20 0 DIADLO c1cc(Oc2ccccc2)c(C[N@@H+]2CCCCC23COC3)s1 ZINC001142000925 1047338957 /nfs/dbraw/zinc/33/89/57/1047338957.db2.gz BQEUGFSMBBVVSN-UHFFFAOYSA-N 1 2 315.438 4.295 20 0 DIADLO c1cc(Oc2ccccc2)c(C[N@H+]2CCCCC23COC3)s1 ZINC001142000925 1047338968 /nfs/dbraw/zinc/33/89/68/1047338968.db2.gz BQEUGFSMBBVVSN-UHFFFAOYSA-N 1 2 315.438 4.295 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CCC[C@@H](c3ncccc3C)C2)c1 ZINC000652067697 1047340970 /nfs/dbraw/zinc/34/09/70/1047340970.db2.gz DGZSIGFNMUUTBV-SJORKVTESA-N 1 2 311.429 4.070 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CC(C)(C)Oc2ccc(F)cc21)c1nccs1 ZINC000652267677 1047350169 /nfs/dbraw/zinc/35/01/69/1047350169.db2.gz ZCWDPQRTEQFWOZ-ZWNOBZJWSA-N 1 2 306.406 4.235 20 0 DIADLO CCC[C@H](Nc1cc(COC)cc[nH+]1)c1ccc(OC)cc1 ZINC000652330273 1047354647 /nfs/dbraw/zinc/35/46/47/1047354647.db2.gz BEXCYGHOEPDLKB-KRWDZBQOSA-N 1 2 300.402 4.190 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](c2ccc(OC)cc2)C(C)C)c1 ZINC000652330687 1047355800 /nfs/dbraw/zinc/35/58/00/1047355800.db2.gz MSGDSJQOBFMWIL-GOSISDBHSA-N 1 2 300.402 4.046 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2c3cccc(F)c3CC[C@@H]2C)c1 ZINC000652330671 1047356224 /nfs/dbraw/zinc/35/62/24/1047356224.db2.gz MKNFJZJUFNPENZ-SGTLLEGYSA-N 1 2 300.377 4.103 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CCSc3cc(C)c(C)cc32)c1 ZINC000652330307 1047356780 /nfs/dbraw/zinc/35/67/80/1047356780.db2.gz CCWVKIWWLLPWFA-INIZCTEOSA-N 1 2 314.454 4.494 20 0 DIADLO F[C@H]1CC[N@H+](Cc2ccc(Br)c3ccccc23)C1 ZINC001142049916 1047361609 /nfs/dbraw/zinc/36/16/09/1047361609.db2.gz LGRXRHZPFDSXCR-LBPRGKRZSA-N 1 2 308.194 4.146 20 0 DIADLO F[C@H]1CC[N@@H+](Cc2ccc(Br)c3ccccc23)C1 ZINC001142049916 1047361617 /nfs/dbraw/zinc/36/16/17/1047361617.db2.gz LGRXRHZPFDSXCR-LBPRGKRZSA-N 1 2 308.194 4.146 20 0 DIADLO CCCCCCOc1cccc(C[NH2+][C@H](C)c2csnn2)c1 ZINC000840970938 1047365128 /nfs/dbraw/zinc/36/51/28/1047365128.db2.gz YMVQOPXUKLJVFP-CQSZACIVSA-N 1 2 319.474 4.348 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(F)ccc(Br)c2Cl)C1 ZINC001142080910 1047372812 /nfs/dbraw/zinc/37/28/12/1047372812.db2.gz PFVVNHRXEYAPCW-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO CCCOC1CC[NH+](Cc2c(Cl)cc(O)cc2Cl)CC1 ZINC001142114874 1047382984 /nfs/dbraw/zinc/38/29/84/1047382984.db2.gz QWDGZVADONIDLW-UHFFFAOYSA-N 1 2 318.244 4.090 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1)Cc1ccc(C)nc1Cl ZINC001142140308 1047387459 /nfs/dbraw/zinc/38/74/59/1047387459.db2.gz WMRNKAWONLLUSL-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1)Cc1ccc(C)nc1Cl ZINC001142140308 1047387472 /nfs/dbraw/zinc/38/74/72/1047387472.db2.gz WMRNKAWONLLUSL-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO Cc1cc(C)c(NC(=O)CCCc2c(F)cccc2F)c(C)[nH+]1 ZINC000653540866 1047398001 /nfs/dbraw/zinc/39/80/01/1047398001.db2.gz WYYVCMGTCVGYQW-UHFFFAOYSA-N 1 2 318.367 4.246 20 0 DIADLO C/C(=C\c1ccc(F)cc1)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000749342723 1047411840 /nfs/dbraw/zinc/41/18/40/1047411840.db2.gz VTGDEZMYZAXSCV-WYMLVPIESA-N 1 2 321.355 4.053 20 0 DIADLO C/C(=C/c1ccc(F)cc1)C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000749341479 1047412600 /nfs/dbraw/zinc/41/26/00/1047412600.db2.gz GVBFTFFGBOVAJX-OWBHPGMISA-N 1 2 321.355 4.053 20 0 DIADLO C/C(=C\C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(F)cc1 ZINC000749380845 1047415034 /nfs/dbraw/zinc/41/50/34/1047415034.db2.gz CBAQQZVXULFPSK-OUKQBFOZSA-N 1 2 321.355 4.258 20 0 DIADLO Cc1csc(C(=O)Nc2cccc(-c3[nH]c(C)c(C)[nH+]3)c2)c1 ZINC001142247238 1047415253 /nfs/dbraw/zinc/41/52/53/1047415253.db2.gz QWIFJHZMXPMHJD-UHFFFAOYSA-N 1 2 311.410 4.316 20 0 DIADLO Clc1scc(C[NH+]2CCC(c3cn[nH]c3)CC2)c1Cl ZINC000432745595 1047422131 /nfs/dbraw/zinc/42/21/31/1047422131.db2.gz CQNSLMZTROPIQH-UHFFFAOYSA-N 1 2 316.257 4.158 20 0 DIADLO CC(C)C[C@@H](C(=O)NCC1(C)CCC(C)(C)CC1)n1cc[nH+]c1 ZINC001142305452 1047427137 /nfs/dbraw/zinc/42/71/37/1047427137.db2.gz YGRGSMUWZLEHRS-INIZCTEOSA-N 1 2 319.493 4.193 20 0 DIADLO Cc1cc(Oc2ccc(Nc3cccc(CCO)c3)cc2)cc[nH+]1 ZINC001203120729 1047442501 /nfs/dbraw/zinc/44/25/01/1047442501.db2.gz WAYPQYFWRVCRPK-UHFFFAOYSA-N 1 2 320.392 4.461 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CC=C(C(F)(F)F)CC2)s1 ZINC000537618939 1047458551 /nfs/dbraw/zinc/45/85/51/1047458551.db2.gz RVVYAFGHQBDCMY-UHFFFAOYSA-N 1 2 304.381 4.135 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CC=C(C(F)(F)F)CC2)s1 ZINC000537618939 1047458557 /nfs/dbraw/zinc/45/85/57/1047458557.db2.gz RVVYAFGHQBDCMY-UHFFFAOYSA-N 1 2 304.381 4.135 20 0 DIADLO Cc1csc(C[N@@H+]2CCSC[C@H]2c2ccc(C)cc2)n1 ZINC000088600097 1047466120 /nfs/dbraw/zinc/46/61/20/1047466120.db2.gz CVNLRXULBIHNDU-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1csc(C[N@H+]2CCSC[C@H]2c2ccc(C)cc2)n1 ZINC000088600097 1047466125 /nfs/dbraw/zinc/46/61/25/1047466125.db2.gz CVNLRXULBIHNDU-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO CC(C)=C(C)CC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001142604820 1047472859 /nfs/dbraw/zinc/47/28/59/1047472859.db2.gz VCCHORYKJPXXFW-UHFFFAOYSA-N 1 2 303.793 4.211 20 0 DIADLO CCn1c(=S)n(C[N@H+](C)CCC(C)(C)C)nc1-c1ccco1 ZINC000842632221 1047494342 /nfs/dbraw/zinc/49/43/42/1047494342.db2.gz VZISKONYRAAHRJ-UHFFFAOYSA-N 1 2 322.478 4.019 20 0 DIADLO CCn1c(=S)n(C[N@@H+](C)CCC(C)(C)C)nc1-c1ccco1 ZINC000842632221 1047494346 /nfs/dbraw/zinc/49/43/46/1047494346.db2.gz VZISKONYRAAHRJ-UHFFFAOYSA-N 1 2 322.478 4.019 20 0 DIADLO c1cn(CCSCc2csc(-c3ccsc3)n2)c[nH+]1 ZINC000090200853 1047499490 /nfs/dbraw/zinc/49/94/90/1047499490.db2.gz HCVCUODCXOVWRJ-UHFFFAOYSA-N 1 2 307.469 4.002 20 0 DIADLO Clc1ccc(CSCCn2cc[nH+]c2)c2ncccc12 ZINC000090200237 1047500006 /nfs/dbraw/zinc/50/00/06/1047500006.db2.gz NRILHWFPDYCQGW-UHFFFAOYSA-N 1 2 303.818 4.018 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C3CCC(F)(F)CC3)cc2)C[C@H](C)O1 ZINC000842862542 1047509843 /nfs/dbraw/zinc/50/98/43/1047509843.db2.gz RZYCMLYXYKWCHY-OKILXGFUSA-N 1 2 324.415 4.290 20 0 DIADLO Clc1ccc(-c2nccnc2C[NH+]2Cc3ccccc3C2)cc1 ZINC001142966502 1047521332 /nfs/dbraw/zinc/52/13/32/1047521332.db2.gz LFWQOTZKQJAGIT-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO CN(Cc1ccc2[nH+]ccn2c1)Cc1cccc(Cl)c1Cl ZINC001143028928 1047525843 /nfs/dbraw/zinc/52/58/43/1047525843.db2.gz MJRMKMDPOGYGOK-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@H+](Cc1ccc2nccn2c1)Cc1cccc(Cl)c1Cl ZINC001143028928 1047525850 /nfs/dbraw/zinc/52/58/50/1047525850.db2.gz MJRMKMDPOGYGOK-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1ccc2nccn2c1)Cc1cccc(Cl)c1Cl ZINC001143028928 1047525852 /nfs/dbraw/zinc/52/58/52/1047525852.db2.gz MJRMKMDPOGYGOK-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO CC[C@](C)([NH2+]Cc1ccc(OC)cc1Cl)c1nccs1 ZINC000152608076 1047530632 /nfs/dbraw/zinc/53/06/32/1047530632.db2.gz MWQGMOQOLSMRSA-HNNXBMFYSA-N 1 2 310.850 4.220 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(CCc2ccccc2)n1)c1cccnc1 ZINC000092766993 1047539381 /nfs/dbraw/zinc/53/93/81/1047539381.db2.gz NRLYNGRNWWTBQB-OAHLLOKOSA-N 1 2 323.465 4.174 20 0 DIADLO CC[N@H+](CC(=O)N(C)CCC(C)(C)C)Cc1ccccc1Cl ZINC001143186803 1047540501 /nfs/dbraw/zinc/54/05/01/1047540501.db2.gz UJFYHKLLFSWXEX-UHFFFAOYSA-N 1 2 324.896 4.057 20 0 DIADLO CC[N@@H+](CC(=O)N(C)CCC(C)(C)C)Cc1ccccc1Cl ZINC001143186803 1047540505 /nfs/dbraw/zinc/54/05/05/1047540505.db2.gz UJFYHKLLFSWXEX-UHFFFAOYSA-N 1 2 324.896 4.057 20 0 DIADLO COc1ccccc1C[N@H+](Cc1ccco1)Cc1ccc(O)cc1 ZINC000093015573 1047543000 /nfs/dbraw/zinc/54/30/00/1047543000.db2.gz HOCFKUSZSNRJEZ-UHFFFAOYSA-N 1 2 323.392 4.196 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1ccco1)Cc1ccc(O)cc1 ZINC000093015573 1047543004 /nfs/dbraw/zinc/54/30/04/1047543004.db2.gz HOCFKUSZSNRJEZ-UHFFFAOYSA-N 1 2 323.392 4.196 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CCc3nc(Cl)ccc3C2)cc1 ZINC001143251276 1047545203 /nfs/dbraw/zinc/54/52/03/1047545203.db2.gz OOKNKQJMAYKMLJ-UHFFFAOYSA-N 1 2 308.759 4.231 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CCc3nc(Cl)ccc3C2)cc1 ZINC001143251276 1047545209 /nfs/dbraw/zinc/54/52/09/1047545209.db2.gz OOKNKQJMAYKMLJ-UHFFFAOYSA-N 1 2 308.759 4.231 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ccc(F)cc2)c(F)c1F ZINC001143267235 1047546184 /nfs/dbraw/zinc/54/61/84/1047546184.db2.gz NUUSCMJOYACONH-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ccc(F)cc2)c(F)c1F ZINC001143267235 1047546185 /nfs/dbraw/zinc/54/61/85/1047546185.db2.gz NUUSCMJOYACONH-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)c(F)c1F ZINC001143276271 1047546973 /nfs/dbraw/zinc/54/69/73/1047546973.db2.gz LOQBFTFQGPPZQV-HNNXBMFYSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@H]2c2ccccn2)c(F)c1F ZINC001143276271 1047546978 /nfs/dbraw/zinc/54/69/78/1047546978.db2.gz LOQBFTFQGPPZQV-HNNXBMFYSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c(F)c1F ZINC001143276633 1047547634 /nfs/dbraw/zinc/54/76/34/1047547634.db2.gz RMLDGIIFTAFOPC-NSHDSACASA-N 1 2 323.305 4.138 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)c(F)c1F ZINC001143276633 1047547636 /nfs/dbraw/zinc/54/76/36/1047547636.db2.gz RMLDGIIFTAFOPC-NSHDSACASA-N 1 2 323.305 4.138 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2OC)c(F)c1 ZINC000122407141 1047547666 /nfs/dbraw/zinc/54/76/66/1047547666.db2.gz GQXYKEALSJQBKQ-NEPJUHHUSA-N 1 2 321.367 4.394 20 0 DIADLO FC(F)(F)c1cccc(Cl)c1C[N@@H+]1CCC[C@@]2(CCO2)C1 ZINC001143288868 1047549734 /nfs/dbraw/zinc/54/97/34/1047549734.db2.gz ZWUDDLQNDQDJEX-CQSZACIVSA-N 1 2 319.754 4.114 20 0 DIADLO FC(F)(F)c1cccc(Cl)c1C[N@H+]1CCC[C@@]2(CCO2)C1 ZINC001143288868 1047549740 /nfs/dbraw/zinc/54/97/40/1047549740.db2.gz ZWUDDLQNDQDJEX-CQSZACIVSA-N 1 2 319.754 4.114 20 0 DIADLO COc1c(F)ccc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c1F ZINC001143320212 1047553196 /nfs/dbraw/zinc/55/31/96/1047553196.db2.gz GIHRLATXRJKBQB-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(F)ccc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c1F ZINC001143320212 1047553200 /nfs/dbraw/zinc/55/32/00/1047553200.db2.gz GIHRLATXRJKBQB-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO Fc1ccc(Br)c(C[NH+]2CCC3(CC3)CC2)c1F ZINC001143329254 1047553921 /nfs/dbraw/zinc/55/39/21/1047553921.db2.gz NRJOFIXDGRJQPG-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Fc1ccc(Br)c(C[N@@H+]2CCC3(CCC3)C2)c1F ZINC001143335845 1047554194 /nfs/dbraw/zinc/55/41/94/1047554194.db2.gz KRQDCBNBASTZKC-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Fc1ccc(Br)c(C[N@H+]2CCC3(CCC3)C2)c1F ZINC001143335845 1047554198 /nfs/dbraw/zinc/55/41/98/1047554198.db2.gz KRQDCBNBASTZKC-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Cc1[nH]ncc1C[N@@H+]1CC[C@@H](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000537654480 1047568870 /nfs/dbraw/zinc/56/88/70/1047568870.db2.gz AOINWNHZMSMLEK-BZNIZROVSA-N 1 2 323.362 4.320 20 0 DIADLO Cc1c[nH+]c2c(c1)N(C(=O)C[C@@H]1C[C@H](C)CC(C)(C)C1)CCN2 ZINC001150485960 1047577377 /nfs/dbraw/zinc/57/73/77/1047577377.db2.gz MIXUMNYZTIEDMD-ZFWWWQNUSA-N 1 2 315.461 4.001 20 0 DIADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2ccn(C3CCCC3)n2)c1 ZINC000477154321 1047598992 /nfs/dbraw/zinc/59/89/92/1047598992.db2.gz UFWLEVQEYXMHEX-LJQANCHMSA-N 1 2 313.420 4.474 20 0 DIADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2ccn(C3CCCC3)n2)c1 ZINC000477154321 1047598996 /nfs/dbraw/zinc/59/89/96/1047598996.db2.gz UFWLEVQEYXMHEX-LJQANCHMSA-N 1 2 313.420 4.474 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000477161762 1047601927 /nfs/dbraw/zinc/60/19/27/1047601927.db2.gz JJHVCBJNAOHEMY-ZDUSSCGKSA-N 1 2 319.399 4.469 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000477161762 1047601930 /nfs/dbraw/zinc/60/19/30/1047601930.db2.gz JJHVCBJNAOHEMY-ZDUSSCGKSA-N 1 2 319.399 4.469 20 0 DIADLO CC(C)C[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1ccccc1 ZINC001151976323 1047605078 /nfs/dbraw/zinc/60/50/78/1047605078.db2.gz KXHDYZNNDDSNJZ-QGZVFWFLSA-N 1 2 307.397 4.080 20 0 DIADLO C[N@@H+](Cc1ccn(C2CCCC2)n1)Cc1cc2ccccc2o1 ZINC000477303373 1047612818 /nfs/dbraw/zinc/61/28/18/1047612818.db2.gz NUYGHZYLWVCUPI-UHFFFAOYSA-N 1 2 309.413 4.376 20 0 DIADLO C[N@H+](Cc1ccn(C2CCCC2)n1)Cc1cc2ccccc2o1 ZINC000477303373 1047612820 /nfs/dbraw/zinc/61/28/20/1047612820.db2.gz NUYGHZYLWVCUPI-UHFFFAOYSA-N 1 2 309.413 4.376 20 0 DIADLO COc1ccc(C[N@H+](C)[C@@H](C)c2ccc(F)cc2F)c(OC)c1 ZINC000060463996 1047625382 /nfs/dbraw/zinc/62/53/82/1047625382.db2.gz OIDYJBFJJVVJIN-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2F)c(OC)c1 ZINC000060463996 1047625385 /nfs/dbraw/zinc/62/53/85/1047625385.db2.gz OIDYJBFJJVVJIN-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COC(=O)/C=C/c1cc(C)c[nH+]c1N[C@@H](c1ccccc1)C1CC1 ZINC001154644190 1047652880 /nfs/dbraw/zinc/65/28/80/1047652880.db2.gz CZMWODAVIVJWBX-VYENPZKTSA-N 1 2 322.408 4.139 20 0 DIADLO Cc1cc(Cl)c(C)c(NCc2cnccc2C(F)(F)F)[nH+]1 ZINC001154900221 1047661420 /nfs/dbraw/zinc/66/14/20/1047661420.db2.gz CRRWFTCCDVKARN-UHFFFAOYSA-N 1 2 315.726 4.378 20 0 DIADLO CC[C@@H](C)[C@@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000538192990 1047662572 /nfs/dbraw/zinc/66/25/72/1047662572.db2.gz NXFGWKJHTTWHPV-BDJLRTHQSA-N 1 2 319.836 4.477 20 0 DIADLO CC(C)C[C@H](CO)Nc1cc(SCc2ccccc2)cc[nH+]1 ZINC001154961950 1047663197 /nfs/dbraw/zinc/66/31/97/1047663197.db2.gz HTYMSKJLLSFXTA-MRXNPFEDSA-N 1 2 316.470 4.193 20 0 DIADLO CCCCOc1ncccc1C[NH2+][C@H](C)c1cccc(F)c1F ZINC000538446060 1047678762 /nfs/dbraw/zinc/67/87/62/1047678762.db2.gz CITYYBOOACOSSQ-CYBMUJFWSA-N 1 2 320.383 4.390 20 0 DIADLO [NH2+]=C(Nc1ncnc2sccc21)C12CC3CC(CC(C3)C1)C2 ZINC001155956477 1047692719 /nfs/dbraw/zinc/69/27/19/1047692719.db2.gz QTODCSNTSLPPGP-UHFFFAOYSA-N 1 2 312.442 4.297 20 0 DIADLO C[C@@H](Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccc(F)c(F)c1 ZINC000538634921 1047693187 /nfs/dbraw/zinc/69/31/87/1047693187.db2.gz KRNUJXHHOVPKDZ-LLVKDONJSA-N 1 2 317.314 4.463 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@H](C3CCC3)C2)c(C)[nH+]1 ZINC000667119039 1047694907 /nfs/dbraw/zinc/69/49/07/1047694907.db2.gz GPZJXDVFBXPUIG-INIZCTEOSA-N 1 2 301.434 4.051 20 0 DIADLO FC(F)(F)[C@@H](Nc1cc2ccccc2c[nH+]1)c1cccnc1 ZINC001156157553 1047702835 /nfs/dbraw/zinc/70/28/35/1047702835.db2.gz YIXKXQRZEBWGQY-HNNXBMFYSA-N 1 2 303.287 4.345 20 0 DIADLO Cc1nc(N[C@@H](c2cccnc2)C(F)(F)F)cc(C(C)C)[nH+]1 ZINC001156156651 1047702852 /nfs/dbraw/zinc/70/28/52/1047702852.db2.gz SJYMJQJAUYUJIV-AWEZNQCLSA-N 1 2 310.323 4.019 20 0 DIADLO CCSc1cc[nH+]c(NCCCc2ccc(OC)cc2)c1 ZINC001156169314 1047703525 /nfs/dbraw/zinc/70/35/25/1047703525.db2.gz QNFMNBQYBPLWGF-UHFFFAOYSA-N 1 2 302.443 4.247 20 0 DIADLO C[C@@H]1C[N@H+](C/C=C\c2ccc(F)cc2)C[C@H](c2ccsc2)O1 ZINC000538750901 1047707743 /nfs/dbraw/zinc/70/77/43/1047707743.db2.gz GAECQPFUWKRNMM-GFNFTKFASA-N 1 2 317.429 4.362 20 0 DIADLO C[C@@H]1C[N@@H+](C/C=C\c2ccc(F)cc2)C[C@H](c2ccsc2)O1 ZINC000538750901 1047707747 /nfs/dbraw/zinc/70/77/47/1047707747.db2.gz GAECQPFUWKRNMM-GFNFTKFASA-N 1 2 317.429 4.362 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCOC[C@@H]2c2ccccc2)cc1 ZINC000538751939 1047708578 /nfs/dbraw/zinc/70/85/78/1047708578.db2.gz XVUYPUQJPZLUMR-HXUWFJFHSA-N 1 2 311.425 4.047 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCOC[C@@H]2c2ccccc2)cc1 ZINC000538751939 1047708582 /nfs/dbraw/zinc/70/85/82/1047708582.db2.gz XVUYPUQJPZLUMR-HXUWFJFHSA-N 1 2 311.425 4.047 20 0 DIADLO c1ccc([C@@H]2COCC[N@H+]2Cc2ccccc2OCC2CC2)cc1 ZINC000538752167 1047708661 /nfs/dbraw/zinc/70/86/61/1047708661.db2.gz MWLMJIBBCXDNQI-FQEVSTJZSA-N 1 2 323.436 4.049 20 0 DIADLO c1ccc([C@@H]2COCC[N@@H+]2Cc2ccccc2OCC2CC2)cc1 ZINC000538752167 1047708666 /nfs/dbraw/zinc/70/86/66/1047708666.db2.gz MWLMJIBBCXDNQI-FQEVSTJZSA-N 1 2 323.436 4.049 20 0 DIADLO CCc1cc(OCc2noc(C(C)(C)C)n2)c2ccccc2[nH+]1 ZINC000538853693 1047715771 /nfs/dbraw/zinc/71/57/71/1047715771.db2.gz WGEQKQUKQJOUAH-UHFFFAOYSA-N 1 2 311.385 4.057 20 0 DIADLO CC(=O)Nc1c(C)cc[nH+]c1N(C)Cc1ccc2ccccc2c1 ZINC001156872397 1047725347 /nfs/dbraw/zinc/72/53/47/1047725347.db2.gz YRUQDJGHVVPELD-UHFFFAOYSA-N 1 2 319.408 4.138 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@H](C)c2ccccc2Br)n1 ZINC000148984543 1047726660 /nfs/dbraw/zinc/72/66/60/1047726660.db2.gz OJKGARQBNFLUMH-GFCCVEGCSA-N 1 2 322.250 4.077 20 0 DIADLO Cc1ccc(C)c([C@H](C)[NH2+]Cc2nnc(-c3ccc(F)cc3)[nH]2)c1 ZINC000539056646 1047729040 /nfs/dbraw/zinc/72/90/40/1047729040.db2.gz UBSSAOPZXFQRQF-AWEZNQCLSA-N 1 2 324.403 4.078 20 0 DIADLO Cc1ccc(C)c([C@H](C)[NH2+]Cc2nc(-c3ccc(F)cc3)n[nH]2)c1 ZINC000539056646 1047729048 /nfs/dbraw/zinc/72/90/48/1047729048.db2.gz UBSSAOPZXFQRQF-AWEZNQCLSA-N 1 2 324.403 4.078 20 0 DIADLO CCCc1cc(N2CCC[C@H]2c2c(F)cccc2F)nc(C)[nH+]1 ZINC001156940765 1047729492 /nfs/dbraw/zinc/72/94/92/1047729492.db2.gz UTZICGNBYRFCIN-INIZCTEOSA-N 1 2 317.383 4.357 20 0 DIADLO COCc1cc[nH+]c(NC2c3ccccc3-c3ccccc32)c1 ZINC001156967291 1047730957 /nfs/dbraw/zinc/73/09/57/1047730957.db2.gz XJAAQSQUVKFTOQ-UHFFFAOYSA-N 1 2 302.377 4.410 20 0 DIADLO CC(C)c1ccc(N2CCc3c([nH]nc3C(F)(F)F)C2)[nH+]c1 ZINC001157343597 1047740146 /nfs/dbraw/zinc/74/01/46/1047740146.db2.gz VBEPWPAFTJKKLM-CQSZACIVSA-N 1 2 310.323 4.066 20 0 DIADLO Cc1ccc(-c2noc(C[NH2+][C@H](C)c3ccc(C)cc3)n2)cc1 ZINC000539233168 1047740874 /nfs/dbraw/zinc/74/08/74/1047740874.db2.gz JHRBHTZTAWYQFM-OAHLLOKOSA-N 1 2 307.397 4.204 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCc1cccc2cn(C)nc21 ZINC001157415615 1047743213 /nfs/dbraw/zinc/74/32/13/1047743213.db2.gz SSJXHKNCVWDWMC-UHFFFAOYSA-N 1 2 302.381 4.042 20 0 DIADLO CCSc1cc[nH+]c(N2CCC(c3cccc(O)c3)CC2)c1 ZINC001157573396 1047746142 /nfs/dbraw/zinc/74/61/42/1047746142.db2.gz QZLJCXSXYNPDBE-UHFFFAOYSA-N 1 2 314.454 4.283 20 0 DIADLO Cc1cc(Cl)c(C)c(N2CCC(c3ccc(N)cc3)CC2)[nH+]1 ZINC001157699430 1047749748 /nfs/dbraw/zinc/74/97/48/1047749748.db2.gz CTNGRBPNCGUTKV-UHFFFAOYSA-N 1 2 315.848 4.318 20 0 DIADLO COC[C@H]([NH2+]Cc1c(F)cccc1Cl)c1ccc(F)cc1 ZINC000539379961 1047751312 /nfs/dbraw/zinc/75/13/12/1047751312.db2.gz KAIOWWBMGOMNNR-INIZCTEOSA-N 1 2 311.759 4.096 20 0 DIADLO CC(C)(C)[C@H](CO)Nc1cc(SCc2ccccc2)cc[nH+]1 ZINC001157758397 1047752965 /nfs/dbraw/zinc/75/29/65/1047752965.db2.gz DZKOUIPYWNMJAJ-INIZCTEOSA-N 1 2 316.470 4.193 20 0 DIADLO CC[C@H](C)C[C@@H](C)Nc1cc([C@@H](CC(=O)OC)C2CC2)cc[nH+]1 ZINC001157885544 1047761504 /nfs/dbraw/zinc/76/15/04/1047761504.db2.gz BOUQGJPXRIVSTP-VBQJREDUSA-N 1 2 318.461 4.375 20 0 DIADLO Cc1cccc([C@H](C)C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1 ZINC000477997080 1047763201 /nfs/dbraw/zinc/76/32/01/1047763201.db2.gz DNCJWSSGOXKNPP-HNNXBMFYSA-N 1 2 319.408 4.436 20 0 DIADLO Cc1cccc([C@@H](C)C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1 ZINC000477997083 1047763251 /nfs/dbraw/zinc/76/32/51/1047763251.db2.gz DNCJWSSGOXKNPP-OAHLLOKOSA-N 1 2 319.408 4.436 20 0 DIADLO Cc1nc2[nH]ccc2c(NCCc2ccc3ccccc3c2)[nH+]1 ZINC001157909807 1047763530 /nfs/dbraw/zinc/76/35/30/1047763530.db2.gz ZMWJEXDAUGOSEV-UHFFFAOYSA-N 1 2 302.381 4.026 20 0 DIADLO Cc1ccc([C@H](C)Nc2[nH+]cnc3[nH]c4cc(F)ccc4c32)nc1 ZINC001158020428 1047768072 /nfs/dbraw/zinc/76/80/72/1047768072.db2.gz GHHBWBZRPUPNGZ-NSHDSACASA-N 1 2 321.359 4.127 20 0 DIADLO Clc1cccc2ccc(NCCc3cn4ccccc4[nH+]3)nc12 ZINC001158146330 1047769597 /nfs/dbraw/zinc/76/95/97/1047769597.db2.gz XXQDMRMSBMGYNU-UHFFFAOYSA-N 1 2 322.799 4.191 20 0 DIADLO Clc1cc(NCCc2cn3ccccc3[nH+]2)c2ccccc2n1 ZINC001158142590 1047770234 /nfs/dbraw/zinc/77/02/34/1047770234.db2.gz QZPPKYPBXXGEAS-UHFFFAOYSA-N 1 2 322.799 4.191 20 0 DIADLO Cc1ccnc(CCNc2cc(C3CCCCC3)[nH+]c(C)n2)c1 ZINC001158434064 1047780328 /nfs/dbraw/zinc/78/03/28/1047780328.db2.gz PAGCBYIMAASVGO-UHFFFAOYSA-N 1 2 310.445 4.191 20 0 DIADLO CCOC(=O)/C=C/c1ccc[nH+]c1N[C@@H]1C[C@H](C)c2ccccc21 ZINC001158469217 1047781452 /nfs/dbraw/zinc/78/14/52/1047781452.db2.gz RTBHKMFVLFVHIE-LVDURTMUSA-N 1 2 322.408 4.318 20 0 DIADLO C[C@@H]1C[C@@H](Nc2cc(N3CCCCC3)nc[nH+]2)c2ccccc21 ZINC001158474914 1047784187 /nfs/dbraw/zinc/78/41/87/1047784187.db2.gz WEQFUHADPYGAOR-RHSMWYFYSA-N 1 2 308.429 4.127 20 0 DIADLO C[C@@H]1C[C@@H](Nc2cc(N3CCCCC3)[nH+]cn2)c2ccccc21 ZINC001158474914 1047784194 /nfs/dbraw/zinc/78/41/94/1047784194.db2.gz WEQFUHADPYGAOR-RHSMWYFYSA-N 1 2 308.429 4.127 20 0 DIADLO C[C@@H](CNc1[nH+]cnc2[nH]c3ccccc3c21)c1ccc(O)cc1 ZINC001158606442 1047790690 /nfs/dbraw/zinc/79/06/90/1047790690.db2.gz RAQHTFLCBSVXHZ-LBPRGKRZSA-N 1 2 318.380 4.032 20 0 DIADLO COc1ccc[nH+]c1NC/C(=C/F)CCc1ccc(F)cc1 ZINC001159049037 1047809185 /nfs/dbraw/zinc/80/91/85/1047809185.db2.gz BRNDBMOIAQTYDN-SDNWHVSQSA-N 1 2 304.340 4.127 20 0 DIADLO CCOc1ccc[nH+]c1NCc1ccccc1-c1cccnc1 ZINC001159106698 1047812839 /nfs/dbraw/zinc/81/28/39/1047812839.db2.gz FTTXBNYADMGFCW-UHFFFAOYSA-N 1 2 305.381 4.154 20 0 DIADLO Nc1ccc(Nc2ccc(F)cc2OCc2ccccc2)c[nH+]1 ZINC001159281199 1047825420 /nfs/dbraw/zinc/82/54/20/1047825420.db2.gz RDONVCJIWLTNQH-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO Nc1ccc(Nc2ccc(F)c(OCc3ccccc3)c2)c[nH+]1 ZINC001159280914 1047825782 /nfs/dbraw/zinc/82/57/82/1047825782.db2.gz HDUISYFEZUEEOH-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO Fc1ccc(SCc2ccc(-n3cc[nH+]c3)cc2)c(F)c1 ZINC000553192958 1047829597 /nfs/dbraw/zinc/82/95/97/1047829597.db2.gz XQWIHHFYLDNWJM-UHFFFAOYSA-N 1 2 302.349 4.443 20 0 DIADLO CC(C)C[C@H](c1nc(CCCc2ccccc2)no1)n1cc[nH+]c1 ZINC000923806595 1047838016 /nfs/dbraw/zinc/83/80/16/1047838016.db2.gz PESHPYOVPQCPPM-QGZVFWFLSA-N 1 2 324.428 4.077 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@H](C)c2ccnn2CC2CCC2)c(F)c1 ZINC000927091592 1047838042 /nfs/dbraw/zinc/83/80/42/1047838042.db2.gz AAJFYRQWTIBKII-CYBMUJFWSA-N 1 2 319.399 4.121 20 0 DIADLO Cc1ccc(CSCc2cccc3nsnc32)c(C)[nH+]1 ZINC000774542678 1047843311 /nfs/dbraw/zinc/84/33/11/1047843311.db2.gz XPZZGAMRYAESOV-UHFFFAOYSA-N 1 2 301.440 4.137 20 0 DIADLO c1cn(-c2cccc(Nc3ccc(N4CCCC4)cc3)c2)c[nH+]1 ZINC001174525985 1047854661 /nfs/dbraw/zinc/85/46/61/1047854661.db2.gz BBCANQOAMNMANL-UHFFFAOYSA-N 1 2 304.397 4.216 20 0 DIADLO Nc1cc(Cl)cc2c1ccn2-c1ccc([NH+]2CCCC2)cc1 ZINC001174527955 1047857708 /nfs/dbraw/zinc/85/77/08/1047857708.db2.gz USSNTCHGHWQADN-UHFFFAOYSA-N 1 2 311.816 4.466 20 0 DIADLO Cc1c(C)n(-c2ccc([NH+]3CCCC3)cc2)c2c1cccc2N ZINC001174529798 1047858929 /nfs/dbraw/zinc/85/89/29/1047858929.db2.gz YHNLSIOIPRXPQO-UHFFFAOYSA-N 1 2 305.425 4.430 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@@H+](Cc1ccccc1F)CC1CC1 ZINC001182950795 1047864136 /nfs/dbraw/zinc/86/41/36/1047864136.db2.gz WYWKVXSDJNXDGC-UHFFFAOYSA-N 1 2 321.827 4.177 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@H+](Cc1ccccc1F)CC1CC1 ZINC001182950795 1047864151 /nfs/dbraw/zinc/86/41/51/1047864151.db2.gz WYWKVXSDJNXDGC-UHFFFAOYSA-N 1 2 321.827 4.177 20 0 DIADLO Cn1ccc2ccc(Nc3cccc(Cn4cc[nH+]c4)c3)cc21 ZINC001174517162 1047878261 /nfs/dbraw/zinc/87/82/61/1047878261.db2.gz QGPXOKLNSDHEKR-UHFFFAOYSA-N 1 2 302.381 4.167 20 0 DIADLO CCOC(=O)C[C@H]1CC[C@H](Nc2cc(SCC)cc[nH+]2)CC1 ZINC001159610253 1047881392 /nfs/dbraw/zinc/88/13/92/1047881392.db2.gz HTBGJPOUHMNDTH-HDJSIYSDSA-N 1 2 322.474 4.118 20 0 DIADLO CC(=O)c1ccc(F)cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523489 1047884067 /nfs/dbraw/zinc/88/40/67/1047884067.db2.gz LGTDQDAMWUNVSV-UHFFFAOYSA-N 1 2 313.376 4.157 20 0 DIADLO c1sc2cnccc2c1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523348 1047884652 /nfs/dbraw/zinc/88/46/52/1047884652.db2.gz YXFZNILBEVAQNT-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO Nc1cc(F)cc(Cl)c1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523595 1047885016 /nfs/dbraw/zinc/88/50/16/1047885016.db2.gz QBPIVWCUJDDRIW-UHFFFAOYSA-N 1 2 320.799 4.190 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc(Cl)c(Cl)c2)cc(C)[nH+]1 ZINC001197831784 1047884934 /nfs/dbraw/zinc/88/49/34/1047884934.db2.gz LNSJVSXAHAALIK-UHFFFAOYSA-N 1 2 324.211 4.327 20 0 DIADLO c1cnc2cc(Nc3ccc(N4CCCCC4)[nH+]c3)ccc2c1 ZINC001174522212 1047885377 /nfs/dbraw/zinc/88/53/77/1047885377.db2.gz LDZJZCJGFKSDBW-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO O=C1CCCc2cc(Nc3ccc(N4CCCCC4)[nH+]c3)ccc21 ZINC001174523594 1047886042 /nfs/dbraw/zinc/88/60/42/1047886042.db2.gz QAIUVYSMCAZYRD-UHFFFAOYSA-N 1 2 321.424 4.335 20 0 DIADLO O=C1CCCc2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc21 ZINC001174524820 1047887307 /nfs/dbraw/zinc/88/73/07/1047887307.db2.gz QDFFUCGQJFBJTR-UHFFFAOYSA-N 1 2 321.424 4.335 20 0 DIADLO FC(F)(F)[C@H]1C[N@@H+]([C@@H]2CCc3cc(Cl)ccc32)CCS1 ZINC001197817645 1047887835 /nfs/dbraw/zinc/88/78/35/1047887835.db2.gz DNECAIIPURLIQB-CHWSQXEVSA-N 1 2 321.795 4.307 20 0 DIADLO FC(F)(F)[C@H]1C[N@H+]([C@@H]2CCc3cc(Cl)ccc32)CCS1 ZINC001197817645 1047887850 /nfs/dbraw/zinc/88/78/50/1047887850.db2.gz DNECAIIPURLIQB-CHWSQXEVSA-N 1 2 321.795 4.307 20 0 DIADLO Cc1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)c(Cl)c1O ZINC001174523805 1047887764 /nfs/dbraw/zinc/88/77/64/1047887764.db2.gz RXWIKJWORKIBPT-UHFFFAOYSA-N 1 2 317.820 4.483 20 0 DIADLO COCc1csc(C[NH+](Cc2ccco2)Cc2ccco2)c1 ZINC000667481204 1047888549 /nfs/dbraw/zinc/88/85/49/1047888549.db2.gz KQYOSJWVZHJCJF-UHFFFAOYSA-N 1 2 317.410 4.283 20 0 DIADLO c1cnn(-c2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc2)c1 ZINC001174524908 1047888383 /nfs/dbraw/zinc/88/83/83/1047888383.db2.gz VHWDXJGDOKAEQU-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO CCn1cc2cc(Nc3ccc(N4CCCCC4)[nH+]c3)ccc2n1 ZINC001174524187 1047888554 /nfs/dbraw/zinc/88/85/54/1047888554.db2.gz HVCMFBWXRNJKAR-UHFFFAOYSA-N 1 2 321.428 4.185 20 0 DIADLO Cc1ccc(Nc2cc(Br)c(C)cc2N)c(C)[nH+]1 ZINC001203374504 1047890653 /nfs/dbraw/zinc/89/06/53/1047890653.db2.gz KKSUEAOCEPYINQ-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccnn1C1CCC1 ZINC000924721628 1047892610 /nfs/dbraw/zinc/89/26/10/1047892610.db2.gz PDRPIYCGGXHPOT-RYUDHWBXSA-N 1 2 305.372 4.298 20 0 DIADLO Cc1cc(O)ccc1Nc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001174559495 1047903062 /nfs/dbraw/zinc/90/30/62/1047903062.db2.gz NAMKKRUTLBWEQW-UHFFFAOYSA-N 1 2 315.373 4.186 20 0 DIADLO CSc1cc(Nc2ccc(NC(=O)C(C)C)cc2)cc[nH+]1 ZINC001197962324 1047909397 /nfs/dbraw/zinc/90/93/97/1047909397.db2.gz PEMVISJTDSQTJT-UHFFFAOYSA-N 1 2 301.415 4.142 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1cnn([C@@H]2CCCCO2)c1 ZINC001174597094 1047920455 /nfs/dbraw/zinc/92/04/55/1047920455.db2.gz GXOLEWCAQPIOBW-SFHVURJKSA-N 1 2 314.433 4.228 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1cc3ccccc3cc1OC)C2 ZINC001183336270 1047922016 /nfs/dbraw/zinc/92/20/16/1047922016.db2.gz OFHGLRPWKJPBRH-UHFFFAOYSA-N 1 2 319.404 4.373 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1cc3ccccc3cc1OC)C2 ZINC001183336270 1047922024 /nfs/dbraw/zinc/92/20/24/1047922024.db2.gz OFHGLRPWKJPBRH-UHFFFAOYSA-N 1 2 319.404 4.373 20 0 DIADLO Cc1cccc2c(C)cc(NCC(F)(F)c3ccccn3)[nH+]c12 ZINC001159792929 1047926445 /nfs/dbraw/zinc/92/64/45/1047926445.db2.gz FQVGKHOIBGIMHZ-UHFFFAOYSA-N 1 2 313.351 4.451 20 0 DIADLO C[C@@H]([NH2+]C/C(Cl)=C\Cl)c1cc(Cl)cc2c1OCC2 ZINC001198105326 1047927971 /nfs/dbraw/zinc/92/79/71/1047927971.db2.gz WTZPWWRBARRQJT-JMUHATKESA-N 1 2 306.620 4.245 20 0 DIADLO C[C@H]([NH2+]C/C(Cl)=C\Cl)c1cc(Cl)cc2c1OCC2 ZINC001198105332 1047928109 /nfs/dbraw/zinc/92/81/09/1047928109.db2.gz WTZPWWRBARRQJT-KIFNTFBYSA-N 1 2 306.620 4.245 20 0 DIADLO Fc1cc(C2CC2)ccc1NC1CCN(c2cccc[nH+]2)CC1 ZINC001183473206 1047930723 /nfs/dbraw/zinc/93/07/23/1047930723.db2.gz RNPNQVZWPGCLRM-UHFFFAOYSA-N 1 2 311.404 4.179 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2ccc(N)cc2F)c[nH+]1 ZINC001159837566 1047934131 /nfs/dbraw/zinc/93/41/31/1047934131.db2.gz RHFNKDBRWODEFO-UHFFFAOYSA-N 1 2 322.387 4.183 20 0 DIADLO CN(c1ccc(Nc2c(N)cccc2F)c[nH+]1)C1CCCCC1 ZINC001159904237 1047945512 /nfs/dbraw/zinc/94/55/12/1047945512.db2.gz VOVVIVIITHQWHR-UHFFFAOYSA-N 1 2 314.408 4.315 20 0 DIADLO COC(=O)c1cccc([C@@H](C)Nc2cc3ccccc3c[nH+]2)c1 ZINC001159954243 1047956757 /nfs/dbraw/zinc/95/67/57/1047956757.db2.gz IMIWARCARDYMFF-CYBMUJFWSA-N 1 2 306.365 4.195 20 0 DIADLO COc1nc(C)cc(C)c1C[NH2+][C@H](C)c1c(F)cccc1Cl ZINC000553879824 1047956825 /nfs/dbraw/zinc/95/68/25/1047956825.db2.gz XVXFTJDBJFLIPR-GFCCVEGCSA-N 1 2 322.811 4.350 20 0 DIADLO FC(F)(F)c1cncc(Nc2ccccc2-n2cc[nH+]c2)c1 ZINC001174739594 1047959582 /nfs/dbraw/zinc/95/95/82/1047959582.db2.gz GBRSUGZLUHCHGL-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3c(C)cccc3Cl)ccc2[nH+]1 ZINC001183719207 1047959741 /nfs/dbraw/zinc/95/97/41/1047959741.db2.gz MTPXBGVEGITECR-UHFFFAOYSA-N 1 2 314.776 4.249 20 0 DIADLO CCN(Cc1c[nH+]c2n1CCC2)Cc1ccc(Cl)c(Cl)c1 ZINC000667543049 1047959767 /nfs/dbraw/zinc/95/97/67/1047959767.db2.gz NZLMXPXDYPRNPJ-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO CC(C)n1ccn(C[N@@H+]2Cc3ccccc3C3(CC3)C2)c1=S ZINC000774673708 1047960878 /nfs/dbraw/zinc/96/08/78/1047960878.db2.gz ZGTZHTWKWMKALU-UHFFFAOYSA-N 1 2 313.470 4.105 20 0 DIADLO CC(C)n1ccn(C[N@H+]2Cc3ccccc3C3(CC3)C2)c1=S ZINC000774673708 1047960887 /nfs/dbraw/zinc/96/08/87/1047960887.db2.gz ZGTZHTWKWMKALU-UHFFFAOYSA-N 1 2 313.470 4.105 20 0 DIADLO CC(C)CC[C@H]([NH2+]Cc1nc2c(s1)COCC2)c1ccoc1 ZINC000927117299 1047961880 /nfs/dbraw/zinc/96/18/80/1047961880.db2.gz LUGAFLQGHNBGQN-AWEZNQCLSA-N 1 2 320.458 4.076 20 0 DIADLO CCO[C@@H](C)n1cc(Nc2cc[nH+]c3cc(Cl)ccc23)cn1 ZINC001174697533 1047962375 /nfs/dbraw/zinc/96/23/75/1047962375.db2.gz YUVRMYWVQJGXBK-NSHDSACASA-N 1 2 316.792 4.383 20 0 DIADLO CC(C)CC[C@@H]([NH2+]Cc1nc2c(s1)COCC2)c1ccoc1 ZINC000927117300 1047962843 /nfs/dbraw/zinc/96/28/43/1047962843.db2.gz LUGAFLQGHNBGQN-CQSZACIVSA-N 1 2 320.458 4.076 20 0 DIADLO CCCCCC[N@@H+](Cc1ccco1)[C@H](C)c1nc(C)cc(=O)[nH]1 ZINC001198518340 1047971170 /nfs/dbraw/zinc/97/11/70/1047971170.db2.gz YGESDKIHJWSSET-OAHLLOKOSA-N 1 2 317.433 4.227 20 0 DIADLO Cn1c(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)nc2ccccc21 ZINC000553991417 1047978058 /nfs/dbraw/zinc/97/80/58/1047978058.db2.gz IDEITWTVWAWOHS-QGZVFWFLSA-N 1 2 311.454 4.218 20 0 DIADLO Cn1c(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)nc2ccccc21 ZINC000553991417 1047978068 /nfs/dbraw/zinc/97/80/68/1047978068.db2.gz IDEITWTVWAWOHS-QGZVFWFLSA-N 1 2 311.454 4.218 20 0 DIADLO CC(C)c1ccc(NC(=S)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001198592098 1047981870 /nfs/dbraw/zinc/98/18/70/1047981870.db2.gz OLGZUHCAJZDITE-UHFFFAOYSA-N 1 2 310.426 4.267 20 0 DIADLO Brc1ccc([C@@H]2CC[N@@H+]2CCOCC2CCC2)cc1 ZINC001174797154 1047988731 /nfs/dbraw/zinc/98/87/31/1047988731.db2.gz FQFRLSBZCOKFAL-INIZCTEOSA-N 1 2 324.262 4.013 20 0 DIADLO Brc1ccc([C@@H]2CC[N@H+]2CCOCC2CCC2)cc1 ZINC001174797154 1047988737 /nfs/dbraw/zinc/98/87/37/1047988737.db2.gz FQFRLSBZCOKFAL-INIZCTEOSA-N 1 2 324.262 4.013 20 0 DIADLO CSc1nc(NCc2cccc3sccc32)cc(C)[nH+]1 ZINC001160182906 1047990373 /nfs/dbraw/zinc/99/03/73/1047990373.db2.gz PLHSZXKFRSRLSF-UHFFFAOYSA-N 1 2 301.440 4.334 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2nccn2C)c2cccc(F)c2)cc1 ZINC001198899523 1048014417 /nfs/dbraw/zinc/01/44/17/1048014417.db2.gz BWMXAVQWPDXCRT-FQEVSTJZSA-N 1 2 323.415 4.001 20 0 DIADLO Cc1cccc(C2=CC[N@H+](Cc3cc(F)ncc3F)CC2)c1C ZINC001184253078 1048018291 /nfs/dbraw/zinc/01/82/91/1048018291.db2.gz SVCFRWHEORDMDN-UHFFFAOYSA-N 1 2 314.379 4.266 20 0 DIADLO Cc1cccc(C2=CC[N@@H+](Cc3cc(F)ncc3F)CC2)c1C ZINC001184253078 1048018301 /nfs/dbraw/zinc/01/83/01/1048018301.db2.gz SVCFRWHEORDMDN-UHFFFAOYSA-N 1 2 314.379 4.266 20 0 DIADLO Cc1ccc(Nc2ccc(N(C)Cc3ccccc3)[nH+]c2)cc1N ZINC001160328960 1048033996 /nfs/dbraw/zinc/03/39/96/1048033996.db2.gz BRPZKUMDDJWQKS-UHFFFAOYSA-N 1 2 318.424 4.352 20 0 DIADLO C[C@H](Nc1cccc2c1OCCC2)c1ccc(-n2cc[nH+]c2)cc1 ZINC000554224412 1048035040 /nfs/dbraw/zinc/03/50/40/1048035040.db2.gz GFCDYFORTISYTB-HNNXBMFYSA-N 1 2 319.408 4.370 20 0 DIADLO CC[C@H](C)c1ccc(Nc2ccc(N3CCOCC3)[nH+]c2)cc1 ZINC001174974602 1048036730 /nfs/dbraw/zinc/03/67/30/1048036730.db2.gz QJUDFZFQARMMFP-HNNXBMFYSA-N 1 2 311.429 4.175 20 0 DIADLO Cc1cc(C[NH+]2CC(Oc3ccccc3)C2)ccc1C(F)(F)F ZINC001184427761 1048038602 /nfs/dbraw/zinc/03/86/02/1048038602.db2.gz APKFRHDDRFCNLT-UHFFFAOYSA-N 1 2 321.342 4.277 20 0 DIADLO Cc1c(F)nccc1CNc1[nH+]c2ccccc2n1C(C)(C)C ZINC001184450220 1048041249 /nfs/dbraw/zinc/04/12/49/1048041249.db2.gz IGURKHUPPIUKGZ-UHFFFAOYSA-N 1 2 312.392 4.246 20 0 DIADLO O=c1ccoc2ccc(Nc3ccc([NH+]4CCCC4)cc3)cc12 ZINC001174945172 1048041637 /nfs/dbraw/zinc/04/16/37/1048041637.db2.gz FVHSORVPNHBKJF-UHFFFAOYSA-N 1 2 306.365 4.137 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2csc(C(C)(C)C)n2)C1 ZINC000554265634 1048049771 /nfs/dbraw/zinc/04/97/71/1048049771.db2.gz UHGXPJSZSUFERI-CZUORRHYSA-N 1 2 315.486 4.419 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2csc(C(C)(C)C)n2)C1 ZINC000554265634 1048049784 /nfs/dbraw/zinc/04/97/84/1048049784.db2.gz UHGXPJSZSUFERI-CZUORRHYSA-N 1 2 315.486 4.419 20 0 DIADLO Cc1c(F)cc[nH+]c1N[C@H](c1ccccc1)c1ccc(O)cc1 ZINC001160494554 1048058791 /nfs/dbraw/zinc/05/87/91/1048058791.db2.gz CCFGXQGYUZBDRG-GOSISDBHSA-N 1 2 308.356 4.436 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@H](c2ccccc2)C2(O)CCC2)[nH+]1 ZINC001160542183 1048066697 /nfs/dbraw/zinc/06/66/97/1048066697.db2.gz YNMIGPWXCCUOEH-MRXNPFEDSA-N 1 2 316.832 4.420 20 0 DIADLO CN(c1ccc(OCc2ccccc2)c(F)c1)c1[nH+]cccc1N ZINC001175017270 1048073913 /nfs/dbraw/zinc/07/39/13/1048073913.db2.gz GUBRAVSCZQVZSH-UHFFFAOYSA-N 1 2 323.371 4.150 20 0 DIADLO c1[nH+]cn2c1c(NCCCOC1CCCCC1)nc1ccccc12 ZINC001184659063 1048077253 /nfs/dbraw/zinc/07/72/53/1048077253.db2.gz ZXBBJUQNGKCBOH-UHFFFAOYSA-N 1 2 324.428 4.034 20 0 DIADLO Cc1cc2c(ccnc2N[C@@H](C)c2c[nH+]c3c(C)cccn23)o1 ZINC001160687157 1048078532 /nfs/dbraw/zinc/07/85/32/1048078532.db2.gz DOSNEVDAYUJBMB-ZDUSSCGKSA-N 1 2 306.369 4.265 20 0 DIADLO Cc1ccc2cccc(Nc3ccc(N4CCOCC4)[nH+]c3)c2c1 ZINC001174979280 1048079162 /nfs/dbraw/zinc/07/91/62/1048079162.db2.gz JQAKOONQNOSLLS-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO Cc1ccc2sc(NCc3cc[nH+]c(N4CCCC4)c3)nc2c1 ZINC001184729184 1048086441 /nfs/dbraw/zinc/08/64/41/1048086441.db2.gz IZXXYXBUHOHJAW-UHFFFAOYSA-N 1 2 324.453 4.212 20 0 DIADLO CSc1cc[nH+]c(N[C@H](CC(=O)OC(C)(C)C)CC(C)C)c1 ZINC001160854758 1048089234 /nfs/dbraw/zinc/08/92/34/1048089234.db2.gz YBDQXVOQCPSZLE-ZDUSSCGKSA-N 1 2 324.490 4.362 20 0 DIADLO CCOc1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)cc1F ZINC001175067073 1048092773 /nfs/dbraw/zinc/09/27/73/1048092773.db2.gz ARKKOYBUBFDCJW-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO Clc1nccc(Nc2cccc3[nH+]c[nH]c32)c1Br ZINC001213027221 1048095609 /nfs/dbraw/zinc/09/56/09/1048095609.db2.gz PFZCWPSAXCULLS-UHFFFAOYSA-N 1 2 323.581 4.117 20 0 DIADLO CCOc1cc(C)ccc1C[N@H+](C)Cc1cnc(Cl)s1 ZINC001250171722 1048100542 /nfs/dbraw/zinc/10/05/42/1048100542.db2.gz SUIISAANBHSSAB-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CCOc1cc(C)ccc1C[N@@H+](C)Cc1cnc(Cl)s1 ZINC001250171722 1048100548 /nfs/dbraw/zinc/10/05/48/1048100548.db2.gz SUIISAANBHSSAB-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CCOc1ccc(F)c(Nc2cccc(-n3cc[nH+]c3)c2)c1F ZINC001175038770 1048103166 /nfs/dbraw/zinc/10/31/66/1048103166.db2.gz XRBSBCYFEMIPDC-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO CCOc1ccc(F)c(Nc2ccc(N3CCCC3)[nH+]c2)c1F ZINC001175039293 1048104026 /nfs/dbraw/zinc/10/40/26/1048104026.db2.gz PASYJMQIJYNBFF-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO CCc1nc(N2CCC[C@H]2c2cccc(Cl)c2)cc(C)[nH+]1 ZINC001184926756 1048105716 /nfs/dbraw/zinc/10/57/16/1048105716.db2.gz IXUNRGDWNSBVTP-HNNXBMFYSA-N 1 2 301.821 4.342 20 0 DIADLO c1ccc(-c2cccc(Nc3ccc[nH+]c3N3CCCC3)c2)nc1 ZINC001184968973 1048106971 /nfs/dbraw/zinc/10/69/71/1048106971.db2.gz RWKKQGHKXHITRJ-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Cc1nc(NCc2ccccc2OC(C)C)c2c([nH+]1)CCCC2 ZINC001184972601 1048107809 /nfs/dbraw/zinc/10/78/09/1048107809.db2.gz IYVPPGQYSNBDTG-UHFFFAOYSA-N 1 2 311.429 4.063 20 0 DIADLO CCOc1cc(F)c(Nc2ccc(N3CCCC3)[nH+]c2)cc1F ZINC001175054346 1048111643 /nfs/dbraw/zinc/11/16/43/1048111643.db2.gz NTEZCGJLJPPJSA-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO c1[nH]c2c(cccc2Nc2cccc(CCc3ccccn3)c2)[nH+]1 ZINC001213030574 1048113175 /nfs/dbraw/zinc/11/31/75/1048113175.db2.gz GAXFXYALXOLJHO-UHFFFAOYSA-N 1 2 314.392 4.487 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1c(Cl)ncc(Cl)c1Cl ZINC001161565672 1048139019 /nfs/dbraw/zinc/13/90/19/1048139019.db2.gz PIXDMOATAXXHID-UHFFFAOYSA-N 1 2 319.623 4.431 20 0 DIADLO c1[nH]c2c(cccc2Nc2ccccc2Oc2cccnc2)[nH+]1 ZINC001213031710 1048118874 /nfs/dbraw/zinc/11/88/74/1048118874.db2.gz NPUNCJNQRDQSTQ-UHFFFAOYSA-N 1 2 302.337 4.494 20 0 DIADLO CCN(CC)C(=O)c1cc(Nc2cc(C)cc[nH+]2)ccc1Cl ZINC001185042003 1048121936 /nfs/dbraw/zinc/12/19/36/1048121936.db2.gz AVQPIWDRGWOWCY-UHFFFAOYSA-N 1 2 317.820 4.269 20 0 DIADLO CC(C)Oc1cccc(F)c1Nc1ccc[nH+]c1N1CCCC1 ZINC001185042733 1048122252 /nfs/dbraw/zinc/12/22/52/1048122252.db2.gz HNKVYWSBTQBRJN-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO Nc1ccccc1N(c1ccc[nH+]c1N1CCCC1)C1CCCC1 ZINC001185044634 1048123781 /nfs/dbraw/zinc/12/37/81/1048123781.db2.gz XSEUSWJCDZKJDZ-UHFFFAOYSA-N 1 2 322.456 4.345 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1ccccc1 ZINC000774814700 1048123828 /nfs/dbraw/zinc/12/38/28/1048123828.db2.gz KRIAUASTWHXEDZ-OAHLLOKOSA-N 1 2 301.434 4.244 20 0 DIADLO Cc1cccc2c(C)cc(N[C@H]3CCCc4nccnc43)[nH+]c12 ZINC001161404090 1048126582 /nfs/dbraw/zinc/12/65/82/1048126582.db2.gz XGJZHFHTBVKDHB-INIZCTEOSA-N 1 2 304.397 4.131 20 0 DIADLO c1ccc(-c2cc[nH+]c(N[C@H]3CCCc4nccnc43)c2)cc1 ZINC001161407029 1048126691 /nfs/dbraw/zinc/12/66/91/1048126691.db2.gz JNTHCSGKJXDVKH-KRWDZBQOSA-N 1 2 302.381 4.028 20 0 DIADLO c1ccc(-c2cc[nH+]c(N[C@@H]3CCCc4nccnc43)c2)cc1 ZINC001161407030 1048126775 /nfs/dbraw/zinc/12/67/75/1048126775.db2.gz JNTHCSGKJXDVKH-QGZVFWFLSA-N 1 2 302.381 4.028 20 0 DIADLO Fc1c(Br)ccc(Nc2cccc3[nH+]c[nH]c32)c1F ZINC001213032375 1048126857 /nfs/dbraw/zinc/12/68/57/1048126857.db2.gz BYTJBTGNPZHCGY-UHFFFAOYSA-N 1 2 324.128 4.347 20 0 DIADLO Cc1cccc2sc(NCc3ccc(-n4cc[nH+]c4)cc3)nc21 ZINC001185116801 1048135631 /nfs/dbraw/zinc/13/56/31/1048135631.db2.gz LFBDIVUNNDRDSQ-UHFFFAOYSA-N 1 2 320.421 4.403 20 0 DIADLO Cc1cccc2c(C)cc(NCc3cncn3CC3CCC3)[nH+]c12 ZINC001161529694 1048136015 /nfs/dbraw/zinc/13/60/15/1048136015.db2.gz MKWQMCRVMCDLOM-UHFFFAOYSA-N 1 2 320.440 4.460 20 0 DIADLO Nc1cccc(Cc2cccc(Nc3cccc4[nH+]c[nH]c43)c2)c1 ZINC001213033395 1048136134 /nfs/dbraw/zinc/13/61/34/1048136134.db2.gz DNUBCQIILWWMHA-UHFFFAOYSA-N 1 2 314.392 4.480 20 0 DIADLO CSc1cc(Cl)ncc1NCc1c[nH+]cn1CC1CCC1 ZINC001161532012 1048136827 /nfs/dbraw/zinc/13/68/27/1048136827.db2.gz YOJCXDCLQRQDFL-UHFFFAOYSA-N 1 2 322.865 4.066 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc2cc(Cl)ccc2n1 ZINC001161563277 1048138112 /nfs/dbraw/zinc/13/81/12/1048138112.db2.gz XDRXJCRIWGWNRY-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cc(Cl)nc2ccc(F)cc21 ZINC001161562987 1048138149 /nfs/dbraw/zinc/13/81/49/1048138149.db2.gz LEFYLALCALIIIY-UHFFFAOYSA-N 1 2 318.783 4.417 20 0 DIADLO Fc1cc(F)c(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1F ZINC001175087139 1048138101 /nfs/dbraw/zinc/13/81/01/1048138101.db2.gz WXYCVCGLAPUBSJ-UHFFFAOYSA-N 1 2 303.287 4.092 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc2cccc(Cl)c2n1 ZINC001161563314 1048138310 /nfs/dbraw/zinc/13/83/10/1048138310.db2.gz YSJJJERNTWRCKW-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cc(Cl)nc2ccsc21 ZINC001161562931 1048138510 /nfs/dbraw/zinc/13/85/10/1048138510.db2.gz IAVQVICXYLSESY-UHFFFAOYSA-N 1 2 306.822 4.339 20 0 DIADLO Cc1ccc(F)c2cc(C)c(NCc3c[nH+]cn3C(C)C)nc12 ZINC001161564690 1048138894 /nfs/dbraw/zinc/13/88/94/1048138894.db2.gz BGLDHRFPWUXMHL-UHFFFAOYSA-N 1 2 312.392 4.380 20 0 DIADLO CC(C)c1cc(NCc2c[nH+]cn2C(C)C)nc(C(C)(C)C)n1 ZINC001161569169 1048141245 /nfs/dbraw/zinc/14/12/45/1048141245.db2.gz JPBYXJQOSADIKL-UHFFFAOYSA-N 1 2 315.465 4.287 20 0 DIADLO c1[nH]c2c(cccc2Nc2cccc(Oc3cccnc3)c2)[nH+]1 ZINC001213033721 1048145702 /nfs/dbraw/zinc/14/57/02/1048145702.db2.gz UEUZYIBHLPOSEC-UHFFFAOYSA-N 1 2 302.337 4.494 20 0 DIADLO COc1c(Br)cccc1Nc1cccc2[nH+]c[nH]c21 ZINC001213033759 1048145982 /nfs/dbraw/zinc/14/59/82/1048145982.db2.gz VUKWAQARAZWRNP-UHFFFAOYSA-N 1 2 318.174 4.078 20 0 DIADLO Cc1ccccc1CNc1c(Br)ccc2[nH+]ccn21 ZINC001161626667 1048147594 /nfs/dbraw/zinc/14/75/94/1048147594.db2.gz ZVTOGDQGTCQQKV-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO CCSc1cc[nH+]c(NCC2(CC3CC3)CCOCC2)c1 ZINC001161655868 1048150913 /nfs/dbraw/zinc/15/09/13/1048150913.db2.gz LUCOITYWCFVPFA-UHFFFAOYSA-N 1 2 306.475 4.202 20 0 DIADLO Cc1cc(NCC2(CC3CC3)CCOCC2)nc(C(C)(C)C)[nH+]1 ZINC001161655293 1048151653 /nfs/dbraw/zinc/15/16/53/1048151653.db2.gz DKRSNIGJXPEBHA-UHFFFAOYSA-N 1 2 317.477 4.091 20 0 DIADLO CCc1ccc2c(cc(Cl)nc2NCCCn2cc[nH+]c2)c1 ZINC001161682225 1048153860 /nfs/dbraw/zinc/15/38/60/1048153860.db2.gz KVLKYNTYZXGBEA-UHFFFAOYSA-N 1 2 314.820 4.149 20 0 DIADLO OCc1ccc(F)c(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001175131018 1048156108 /nfs/dbraw/zinc/15/61/08/1048156108.db2.gz NNIGJBAOCRAYEJ-UHFFFAOYSA-N 1 2 300.377 4.052 20 0 DIADLO Cn1ncc(C2CCC2)c1C[N@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000667684315 1048157166 /nfs/dbraw/zinc/15/71/66/1048157166.db2.gz RTBYKYFXHCPGDO-UHFFFAOYSA-N 1 2 321.827 4.112 20 0 DIADLO Cn1ncc(C2CCC2)c1C[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000667684315 1048157170 /nfs/dbraw/zinc/15/71/70/1048157170.db2.gz RTBYKYFXHCPGDO-UHFFFAOYSA-N 1 2 321.827 4.112 20 0 DIADLO CCCn1nccc1C[N@@H+](C)[C@@H](C)c1sc(C(C)C)nc1C ZINC000667685886 1048161735 /nfs/dbraw/zinc/16/17/35/1048161735.db2.gz NHJKOADRAMCHPC-AWEZNQCLSA-N 1 2 320.506 4.374 20 0 DIADLO CCCn1nccc1C[N@H+](C)[C@@H](C)c1sc(C(C)C)nc1C ZINC000667685886 1048161729 /nfs/dbraw/zinc/16/17/29/1048161729.db2.gz NHJKOADRAMCHPC-AWEZNQCLSA-N 1 2 320.506 4.374 20 0 DIADLO Fc1cc(F)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c(F)c1 ZINC001175144537 1048166279 /nfs/dbraw/zinc/16/62/79/1048166279.db2.gz FCSMMMBPSSKLSG-UHFFFAOYSA-N 1 2 303.287 4.092 20 0 DIADLO COc1ccc(-c2csc(C[NH2+]Cc3ncc(C)o3)c2)cc1 ZINC001200949508 1048169178 /nfs/dbraw/zinc/16/91/78/1048169178.db2.gz BRQXUBLYODTKCA-UHFFFAOYSA-N 1 2 314.410 4.010 20 0 DIADLO Nc1cc(Cl)[nH+]c(N[C@@H](CC2CC2)c2ccccc2F)c1 ZINC001161772626 1048170006 /nfs/dbraw/zinc/17/00/06/1048170006.db2.gz RRPDLCSQOXIKRN-AWEZNQCLSA-N 1 2 305.784 4.410 20 0 DIADLO Cc1cc(NC[C@H]2CCCO[C@H]2C(C)(C)C)nc(C2CCC2)[nH+]1 ZINC001185386950 1048170590 /nfs/dbraw/zinc/17/05/90/1048170590.db2.gz LOMOXYZQJMFVRD-NVXWUHKLSA-N 1 2 317.477 4.306 20 0 DIADLO CCc1cc(N(Cc2ccc(F)cc2)CC2CC2)nc(CC)[nH+]1 ZINC001185387140 1048171243 /nfs/dbraw/zinc/17/12/43/1048171243.db2.gz OAOBSRHAULCIQC-UHFFFAOYSA-N 1 2 313.420 4.157 20 0 DIADLO Cc1cccc2c(C)cc(NCc3cn(CC(C)C)cn3)[nH+]c12 ZINC001161792814 1048173181 /nfs/dbraw/zinc/17/31/81/1048173181.db2.gz DKSIWBAVOCYWCP-UHFFFAOYSA-N 1 2 308.429 4.316 20 0 DIADLO Cc1ccc(C[NH2+]Cc2nccs2)c(OCCC(C)C)c1 ZINC001200989251 1048175555 /nfs/dbraw/zinc/17/55/55/1048175555.db2.gz KSPLHLFUIMOKGH-UHFFFAOYSA-N 1 2 304.459 4.166 20 0 DIADLO CSCc1cc[nH+]c(N[C@H](c2cncc(F)c2)C2CC2)c1 ZINC001161818835 1048177295 /nfs/dbraw/zinc/17/72/95/1048177295.db2.gz RDILKGDDQQVYGA-INIZCTEOSA-N 1 2 303.406 4.042 20 0 DIADLO CCc1cc(NCC2(c3cccc(Cl)c3)CC2)nc(CC)[nH+]1 ZINC001185451840 1048180670 /nfs/dbraw/zinc/18/06/70/1048180670.db2.gz YNDNZQRQTIYPGV-UHFFFAOYSA-N 1 2 315.848 4.399 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@H](c2ccnc(F)c2)C2CC2)[nH+]1 ZINC001161841114 1048183223 /nfs/dbraw/zinc/18/32/23/1048183223.db2.gz PPLRNXQRVWBXJG-HNNXBMFYSA-N 1 2 305.784 4.449 20 0 DIADLO CCc1cc(NC[C@@H](C)c2ccc(F)cc2F)nc(CC)[nH+]1 ZINC001185507051 1048188535 /nfs/dbraw/zinc/18/85/35/1048188535.db2.gz DXFZMQPYKGNQQI-LLVKDONJSA-N 1 2 305.372 4.095 20 0 DIADLO CCc1cc(N2CC[C@@H](c3ccccc3)[C@@H](C)C2)nc(CC)[nH+]1 ZINC001185519088 1048190564 /nfs/dbraw/zinc/19/05/64/1048190564.db2.gz UIXYNPJUNXGEBD-MAUKXSAKSA-N 1 2 309.457 4.231 20 0 DIADLO CCc1cc(N2CC[C@@H](c3ccccc3)[C@H](C)C2)nc(CC)[nH+]1 ZINC001185519087 1048190781 /nfs/dbraw/zinc/19/07/81/1048190781.db2.gz UIXYNPJUNXGEBD-CRAIPNDOSA-N 1 2 309.457 4.231 20 0 DIADLO Cc1cc(NC[C@@H](C)Oc2ccccc2C)nc(C2CCC2)[nH+]1 ZINC001185519321 1048192416 /nfs/dbraw/zinc/19/24/16/1048192416.db2.gz YINOMKWUEXEYLZ-OAHLLOKOSA-N 1 2 311.429 4.240 20 0 DIADLO CCOc1ccc(OC)cc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001175212121 1048197145 /nfs/dbraw/zinc/19/71/45/1048197145.db2.gz BMNCTBWXOIVYCF-UHFFFAOYSA-N 1 2 317.776 4.139 20 0 DIADLO CCc1ccccc1NC(=S)Nc1ccccc1-n1cc[nH+]c1 ZINC001201137280 1048197960 /nfs/dbraw/zinc/19/79/60/1048197960.db2.gz IGAFNOKZIVSIBI-UHFFFAOYSA-N 1 2 322.437 4.244 20 0 DIADLO COc1c(C)[nH+]c(C2CC2)nc1N[C@H](c1ccccc1)C1CC1 ZINC001161958092 1048199115 /nfs/dbraw/zinc/19/91/15/1048199115.db2.gz IRRYVPQYBVMLEY-MRXNPFEDSA-N 1 2 309.413 4.234 20 0 DIADLO Clc1sccc1C[NH2+]Cc1cccnc1OC1CCCC1 ZINC000480632980 1048202500 /nfs/dbraw/zinc/20/25/00/1048202500.db2.gz DPIQWCIZPUSJIX-UHFFFAOYSA-N 1 2 322.861 4.408 20 0 DIADLO CCOc1cccc(F)c1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001175224611 1048203433 /nfs/dbraw/zinc/20/34/33/1048203433.db2.gz IQICDQVTJSTBJA-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO Cc1cc2cc(NCc3cccc(OC(F)F)c3)[nH+]cc2[nH]1 ZINC001161983979 1048207822 /nfs/dbraw/zinc/20/78/22/1048207822.db2.gz OEHQFXFSFLEFGM-UHFFFAOYSA-N 1 2 303.312 4.085 20 0 DIADLO CCOc1cccc(Nc2ccc[nH+]c2N2CCCCC2)c1F ZINC001175234459 1048209254 /nfs/dbraw/zinc/20/92/54/1048209254.db2.gz LMEUIVIEBNMEED-UHFFFAOYSA-N 1 2 315.392 4.353 20 0 DIADLO Cc1cc(NCc2cccc(OC(F)F)c2)ccc1[NH+](C)C ZINC001161991517 1048210095 /nfs/dbraw/zinc/21/00/95/1048210095.db2.gz XUOBHVULLXERJV-UHFFFAOYSA-N 1 2 306.356 4.275 20 0 DIADLO CCOc1cccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1F ZINC001175237309 1048210516 /nfs/dbraw/zinc/21/05/16/1048210516.db2.gz SLESJDMQGSXIDL-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO Cc1cc(NCC(C)(C)CC(F)(F)F)nc(C(C)(C)C)[nH+]1 ZINC001162254586 1048252309 /nfs/dbraw/zinc/25/23/09/1048252309.db2.gz LDVPEYAKBOCSOY-UHFFFAOYSA-N 1 2 303.372 4.473 20 0 DIADLO COc1cc[nH+]cc1N[C@@H]1CCCC[C@H]1OCc1ccccc1 ZINC001162051314 1048219240 /nfs/dbraw/zinc/21/92/40/1048219240.db2.gz LAEUNMVBPRRAGR-VQIMIIECSA-N 1 2 312.413 4.030 20 0 DIADLO c1cn2ccc(N[C@@H]3CCCC[C@H]3OCc3ccccc3)cc2[nH+]1 ZINC001162043207 1048219912 /nfs/dbraw/zinc/21/99/12/1048219912.db2.gz LPEDRPPZZBZTFQ-RTBURBONSA-N 1 2 321.424 4.274 20 0 DIADLO CNc1ccc(N[C@@H]2CCCC[C@H]2OCc2ccccc2)c[nH+]1 ZINC001162050977 1048220339 /nfs/dbraw/zinc/22/03/39/1048220339.db2.gz DAXMAIDSIKWDNT-QZTJIDSGSA-N 1 2 311.429 4.063 20 0 DIADLO Cc1cc(N2CCC[C@H]2Cc2ccccc2)nc(C2CCC2)[nH+]1 ZINC001162068069 1048221789 /nfs/dbraw/zinc/22/17/89/1048221789.db2.gz HCIORIGCSSFUHA-SFHVURJKSA-N 1 2 307.441 4.264 20 0 DIADLO CCc1cc(NCCCSc2ccc(F)cc2)nc(CC)[nH+]1 ZINC001162078929 1048223722 /nfs/dbraw/zinc/22/37/22/1048223722.db2.gz PWRZJJYQFPGQEU-UHFFFAOYSA-N 1 2 319.449 4.335 20 0 DIADLO CCc1cc(N2CCC[C@H]2c2ccc(Cl)cc2)nc(C)[nH+]1 ZINC001162099187 1048225119 /nfs/dbraw/zinc/22/51/19/1048225119.db2.gz OXPRNQKNJXGAAG-INIZCTEOSA-N 1 2 301.821 4.342 20 0 DIADLO Cc1cc(NCC2(C)Cc3ccccc3C2)nc(C2CCC2)[nH+]1 ZINC001185810528 1048229613 /nfs/dbraw/zinc/22/96/13/1048229613.db2.gz PVSJEKQHCAZDEI-UHFFFAOYSA-N 1 2 307.441 4.270 20 0 DIADLO C[C@@H](C[NH2+]c1ccc(N2CCO[C@H](C)C2)cc1)c1ccccc1 ZINC000774939409 1048231977 /nfs/dbraw/zinc/23/19/77/1048231977.db2.gz UUEWOWBEVFIUJP-DLBZAZTESA-N 1 2 310.441 4.127 20 0 DIADLO Cc1ccc(C(=O)CC[N@@H+]2CCc3[nH]c4ccccc4c3C2)cc1 ZINC000480726174 1048232226 /nfs/dbraw/zinc/23/22/26/1048232226.db2.gz HJGSRXNKHGFMPU-UHFFFAOYSA-N 1 2 318.420 4.107 20 0 DIADLO Cc1ccc(C(=O)CC[N@H+]2CCc3[nH]c4ccccc4c3C2)cc1 ZINC000480726174 1048232234 /nfs/dbraw/zinc/23/22/34/1048232234.db2.gz HJGSRXNKHGFMPU-UHFFFAOYSA-N 1 2 318.420 4.107 20 0 DIADLO Nc1ccc(Nc2ccc(OC(F)(F)F)cc2C2CC2)c[nH+]1 ZINC001201295931 1048232506 /nfs/dbraw/zinc/23/25/06/1048232506.db2.gz YHGUCRHZZJFLMD-UHFFFAOYSA-N 1 2 309.291 4.183 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H](C)c2ccc(OC(F)F)cc2)o1 ZINC000774940253 1048233022 /nfs/dbraw/zinc/23/30/22/1048233022.db2.gz WNNJKRGFXAXMQL-LLVKDONJSA-N 1 2 310.344 4.250 20 0 DIADLO Nc1ccc(Nc2cc(F)cc3c2-c2ccc(F)cc2C3)c[nH+]1 ZINC001201298799 1048233253 /nfs/dbraw/zinc/23/32/53/1048233253.db2.gz ACCLGMNUDLARQU-UHFFFAOYSA-N 1 2 309.319 4.257 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3cccc4cnccc43)ccc21 ZINC001201309779 1048234137 /nfs/dbraw/zinc/23/41/37/1048234137.db2.gz ZHNQCGQJMJERNU-UHFFFAOYSA-N 1 2 303.409 4.229 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3cccc4cnccc43)ccc21 ZINC001201309779 1048234158 /nfs/dbraw/zinc/23/41/58/1048234158.db2.gz ZHNQCGQJMJERNU-UHFFFAOYSA-N 1 2 303.409 4.229 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(C3CCCC3)n2)CCC1(F)F ZINC000554945813 1048235650 /nfs/dbraw/zinc/23/56/50/1048235650.db2.gz KPFKZKQBJVMLRM-LLVKDONJSA-N 1 2 300.418 4.278 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(C3CCCC3)n2)CCC1(F)F ZINC000554945813 1048235660 /nfs/dbraw/zinc/23/56/60/1048235660.db2.gz KPFKZKQBJVMLRM-LLVKDONJSA-N 1 2 300.418 4.278 20 0 DIADLO Cc1nc(N2CC=C(c3ccccc3Cl)CC2)c(C)c(C)[nH+]1 ZINC001185848591 1048236987 /nfs/dbraw/zinc/23/69/87/1048236987.db2.gz MXDLDEOPWZUENM-UHFFFAOYSA-N 1 2 313.832 4.349 20 0 DIADLO Clc1ccc([C@H]2C[N@H+](CCC3CC3)CCO2)cc1Cl ZINC000480769060 1048238626 /nfs/dbraw/zinc/23/86/26/1048238626.db2.gz KUZSCOYOFKQDNX-OAHLLOKOSA-N 1 2 300.229 4.167 20 0 DIADLO Clc1ccc([C@H]2C[N@@H+](CCC3CC3)CCO2)cc1Cl ZINC000480769060 1048238637 /nfs/dbraw/zinc/23/86/37/1048238637.db2.gz KUZSCOYOFKQDNX-OAHLLOKOSA-N 1 2 300.229 4.167 20 0 DIADLO Fc1ccc(Cl)cc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001175299505 1048239399 /nfs/dbraw/zinc/23/93/99/1048239399.db2.gz FLNHZKFIOHVQOO-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO Fc1ccc(Cl)cc1Nc1ccccc1C[NH+]1CCOCC1 ZINC001175299755 1048239491 /nfs/dbraw/zinc/23/94/91/1048239491.db2.gz JYTPIKDQAQRMNU-UHFFFAOYSA-N 1 2 320.795 4.055 20 0 DIADLO Fc1ccc(Cl)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001175300532 1048241053 /nfs/dbraw/zinc/24/10/53/1048241053.db2.gz YOVJGFAYUISJFZ-UHFFFAOYSA-N 1 2 301.752 4.468 20 0 DIADLO FC(F)(F)c1cccc2cc[nH+]c(NCCC3CCOCC3)c21 ZINC001162218005 1048243965 /nfs/dbraw/zinc/24/39/65/1048243965.db2.gz JQTIPVIKRWOQTD-UHFFFAOYSA-N 1 2 324.346 4.482 20 0 DIADLO CN(C)c1ccc(Nc2ccc(-c3ccc(O)cc3)cc2)c[nH+]1 ZINC001175344424 1048249536 /nfs/dbraw/zinc/24/95/36/1048249536.db2.gz YVUJVHNMSQJLPA-UHFFFAOYSA-N 1 2 305.381 4.264 20 0 DIADLO CN(C)c1ccc(Nc2cccc(C(=O)c3ccccc3)c2)c[nH+]1 ZINC001175343812 1048250236 /nfs/dbraw/zinc/25/02/36/1048250236.db2.gz PNBOUXIBTRDHOW-UHFFFAOYSA-N 1 2 317.392 4.122 20 0 DIADLO Oc1c(Nc2ccc(N3CCCC3)[nH+]c2)cccc1C(F)(F)F ZINC001175348174 1048251628 /nfs/dbraw/zinc/25/16/28/1048251628.db2.gz BXJDVZOUANGXLX-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO CN(C)c1ccc(Nc2ccccc2-c2ccccc2N)c[nH+]1 ZINC001175345257 1048251935 /nfs/dbraw/zinc/25/19/35/1048251935.db2.gz UBVNZKKKHQBOKS-UHFFFAOYSA-N 1 2 304.397 4.140 20 0 DIADLO CN(C)c1ccc(Nc2ccc(C(F)(F)F)c(F)c2F)c[nH+]1 ZINC001175345548 1048252378 /nfs/dbraw/zinc/25/23/78/1048252378.db2.gz DOYNGQBAACNLCN-UHFFFAOYSA-N 1 2 317.261 4.188 20 0 DIADLO Fc1cccc2ncc(Nc3ccc(N4CCCC4)[nH+]c3)cc12 ZINC001175347494 1048252518 /nfs/dbraw/zinc/25/25/18/1048252518.db2.gz MAGBRHATAQERFG-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO Cc1c(Nc2cccc3cc[nH+]cc32)cnn1-c1ccccc1 ZINC001201376013 1048253689 /nfs/dbraw/zinc/25/36/89/1048253689.db2.gz YLZADLCLYMAABW-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO CCc1cc(N(C)Cc2cccc(C(F)(F)F)c2)nc(CC)[nH+]1 ZINC001162325817 1048261875 /nfs/dbraw/zinc/26/18/75/1048261875.db2.gz BBLSDPLRMMPDKJ-UHFFFAOYSA-N 1 2 323.362 4.257 20 0 DIADLO Cc1cccc2nc(NCc3ccc(-n4cc[nH+]c4)cc3)sc21 ZINC001162327592 1048263232 /nfs/dbraw/zinc/26/32/32/1048263232.db2.gz WEXLYGXYTVJSFT-UHFFFAOYSA-N 1 2 320.421 4.403 20 0 DIADLO CCCCCOc1cc(C)ccc1C[NH2+]Cc1ccn(CC)n1 ZINC001201424813 1048263407 /nfs/dbraw/zinc/26/34/07/1048263407.db2.gz DOYLTIHQGMLBOV-UHFFFAOYSA-N 1 2 315.461 4.070 20 0 DIADLO Cc1ccccc1C[C@H](C)Nc1nc2ccccc2n2c[nH+]cc12 ZINC001162344906 1048264962 /nfs/dbraw/zinc/26/49/62/1048264962.db2.gz AQZXMTSQTNCJQJ-HNNXBMFYSA-N 1 2 316.408 4.234 20 0 DIADLO Oc1ccc2cccc(Nc3ccc(N4CCCC4)[nH+]c3)c2c1 ZINC001175350891 1048270749 /nfs/dbraw/zinc/27/07/49/1048270749.db2.gz DTFMTZWGJFWPJS-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO COc1c(Cl)cccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175349667 1048271772 /nfs/dbraw/zinc/27/17/72/1048271772.db2.gz BWBXYDGOFTZXRV-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO CC(=O)c1ccc(Cl)cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175350418 1048272016 /nfs/dbraw/zinc/27/20/16/1048272016.db2.gz XMQXKWCZJUTOAE-UHFFFAOYSA-N 1 2 315.804 4.281 20 0 DIADLO Nc1cc(Cl)c(Nc2ccc(N3CCCC3)[nH+]c2)cc1Cl ZINC001175352615 1048273233 /nfs/dbraw/zinc/27/32/33/1048273233.db2.gz YGMXULIETWPDSQ-UHFFFAOYSA-N 1 2 323.227 4.314 20 0 DIADLO Fc1cc(F)c(Nc2ccc(N3CCCC3)[nH+]c2)c(Cl)c1 ZINC001175352423 1048274175 /nfs/dbraw/zinc/27/41/75/1048274175.db2.gz OWANKNALHFPIQW-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO Brc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC001175352037 1048274501 /nfs/dbraw/zinc/27/45/01/1048274501.db2.gz YZTFHPVZVSPBIC-UHFFFAOYSA-N 1 2 318.218 4.188 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2nnc(C(C)(C)C)o2)c1 ZINC000774992181 1048278508 /nfs/dbraw/zinc/27/85/08/1048278508.db2.gz OLKKDXBSFGAIGO-CYBMUJFWSA-N 1 2 317.433 4.005 20 0 DIADLO CC(C)[NH2+]c1ccc(-n2cc(Cl)c(N)c3ccnc2-3)cc1 ZINC001201487987 1048280078 /nfs/dbraw/zinc/28/00/78/1048280078.db2.gz NIPGAVLMOZJGFT-UHFFFAOYSA-N 1 2 300.793 4.033 20 0 DIADLO c1cc2cccc(Nc3ccccc3C[NH+]3CCOCC3)c2s1 ZINC001175383555 1048289512 /nfs/dbraw/zinc/28/95/12/1048289512.db2.gz BDAYHRYMRJDSAK-UHFFFAOYSA-N 1 2 324.449 4.477 20 0 DIADLO F[C@@H]1CCCC[C@H]1Nc1cc[nH+]c2[nH]cc(C(F)(F)F)c21 ZINC001162512950 1048291567 /nfs/dbraw/zinc/29/15/67/1048291567.db2.gz QBTNEYIOTAEEJW-NXEZZACHSA-N 1 2 301.287 4.274 20 0 DIADLO CCCCn1c(S[C@@H](C)CCC)nnc1[C@H](CC)[NH+](C)C ZINC000481049659 1048300147 /nfs/dbraw/zinc/30/01/47/1048300147.db2.gz AJXWLOCTNFCFNU-KBPBESRZSA-N 1 2 312.527 4.372 20 0 DIADLO CC(C)CC[C@](C)(O)CNc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC001162568192 1048305842 /nfs/dbraw/zinc/30/58/42/1048305842.db2.gz PKMFIYHBWIURAG-SFHVURJKSA-N 1 2 307.482 4.323 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@H]3CCc4ccccc4C3)cc2[nH+]1 ZINC000481086501 1048306308 /nfs/dbraw/zinc/30/63/08/1048306308.db2.gz DSASQWWCEDYVJE-AWEZNQCLSA-N 1 2 319.408 4.005 20 0 DIADLO CC[C@H]1CCC[C@@H]1CNc1nc(C)[nH+]c(C)c1Br ZINC001186478807 1048307374 /nfs/dbraw/zinc/30/73/74/1048307374.db2.gz GIPIZCJZTXLLII-NWDGAFQWSA-N 1 2 312.255 4.094 20 0 DIADLO Cc1ccccc1[C@@H]1C[C@H](C)N(c2nc(C)[nH+]c3c2CCCC3)C1 ZINC001162590772 1048309049 /nfs/dbraw/zinc/30/90/49/1048309049.db2.gz FYZWDWHQEDSQNH-DOTOQJQBSA-N 1 2 321.468 4.355 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(NCc2c(C)cc(C)[nH]c2=O)c1 ZINC001162610875 1048313105 /nfs/dbraw/zinc/31/31/05/1048313105.db2.gz MRMDYLCRZCUIPX-UHFFFAOYSA-N 1 2 313.445 4.171 20 0 DIADLO CCc1cc(N2C[C@@H](C)C[C@@H]2c2cccc(F)c2)nc(CC)[nH+]1 ZINC001162625832 1048314869 /nfs/dbraw/zinc/31/48/69/1048314869.db2.gz JNUBEIFALMDKKF-SUMWQHHRSA-N 1 2 313.420 4.328 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@H+](Cc2ccnc(Cl)c2)C1 ZINC001175492664 1048327251 /nfs/dbraw/zinc/32/72/51/1048327251.db2.gz QGPUZHVJHPYJLU-QGZVFWFLSA-N 1 2 304.796 4.196 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@@H+](Cc2ccnc(Cl)c2)C1 ZINC001175492664 1048327268 /nfs/dbraw/zinc/32/72/68/1048327268.db2.gz QGPUZHVJHPYJLU-QGZVFWFLSA-N 1 2 304.796 4.196 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1ncnc2scc(-c3ccco3)c21 ZINC001162661286 1048331251 /nfs/dbraw/zinc/33/12/51/1048331251.db2.gz CXYMSAULRZXJBV-UHFFFAOYSA-N 1 2 300.387 4.387 20 0 DIADLO C[N@H+](Cc1nc(C(F)(F)F)cs1)[C@H]1C=CCCCCC1 ZINC000555378385 1048334866 /nfs/dbraw/zinc/33/48/66/1048334866.db2.gz RSBUKSDGTFVNFS-NSHDSACASA-N 1 2 304.381 4.483 20 0 DIADLO C[N@@H+](Cc1nc(C(F)(F)F)cs1)[C@H]1C=CCCCCC1 ZINC000555378385 1048334881 /nfs/dbraw/zinc/33/48/81/1048334881.db2.gz RSBUKSDGTFVNFS-NSHDSACASA-N 1 2 304.381 4.483 20 0 DIADLO Cc1ccc(O)c(Nc2ccc(NC(=O)OC(C)(C)C)cc2)[nH+]1 ZINC001175547721 1048336171 /nfs/dbraw/zinc/33/61/71/1048336171.db2.gz CASSHQGPAPPFNS-UHFFFAOYSA-N 1 2 315.373 4.186 20 0 DIADLO c1ccc(Nc2ccc(C3CC3)cc2)c(C[NH+]2CCOCC2)c1 ZINC001201681947 1048343654 /nfs/dbraw/zinc/34/36/54/1048343654.db2.gz ZOVHZCYSEFLBCQ-UHFFFAOYSA-N 1 2 308.425 4.140 20 0 DIADLO Cc1csc([C@@H]2COCC[N@H+]2C[C@H](C)C2CCCCC2)n1 ZINC000555427947 1048345767 /nfs/dbraw/zinc/34/57/67/1048345767.db2.gz XGHKABMBXCZODS-BBRMVZONSA-N 1 2 308.491 4.041 20 0 DIADLO Cc1csc([C@@H]2COCC[N@@H+]2C[C@H](C)C2CCCCC2)n1 ZINC000555427947 1048345782 /nfs/dbraw/zinc/34/57/82/1048345782.db2.gz XGHKABMBXCZODS-BBRMVZONSA-N 1 2 308.491 4.041 20 0 DIADLO CCCN(Cc1ccccc1)c1nc2ccccc2n2c[nH+]cc12 ZINC001162769910 1048355308 /nfs/dbraw/zinc/35/53/08/1048355308.db2.gz PKMSGRKUJGQMRP-UHFFFAOYSA-N 1 2 316.408 4.299 20 0 DIADLO Cc1c2cccc(C)c2oc1CN(C)c1nc(C)[nH+]c(C)c1C ZINC001186923319 1048360417 /nfs/dbraw/zinc/36/04/17/1048360417.db2.gz UAQGISXHLVTRJG-UHFFFAOYSA-N 1 2 309.413 4.401 20 0 DIADLO Cc1cc(N2CCc3ccccc3[C@@H](C)C2)nc(C2CCC2)[nH+]1 ZINC001186923337 1048360870 /nfs/dbraw/zinc/36/08/70/1048360870.db2.gz UQDJIJDAZJYMLT-AWEZNQCLSA-N 1 2 307.441 4.219 20 0 DIADLO C[C@@H]1CC(CNc2nc3ccccc3n3c[nH+]cc23)C[C@@H](C)C1 ZINC001186980846 1048363188 /nfs/dbraw/zinc/36/31/88/1048363188.db2.gz NKLQQTKNZZODSM-KBPBESRZSA-N 1 2 308.429 4.367 20 0 DIADLO Cc1cc([N@H+]2CCCC[C@H]2C)ccc1Nc1cc(F)ncn1 ZINC001162819465 1048364520 /nfs/dbraw/zinc/36/45/20/1048364520.db2.gz XWSGTOVVFFWSAV-CYBMUJFWSA-N 1 2 300.381 4.047 20 0 DIADLO Cc1cc([N@@H+]2CCCC[C@H]2C)ccc1Nc1cc(F)ncn1 ZINC001162819465 1048364535 /nfs/dbraw/zinc/36/45/35/1048364535.db2.gz XWSGTOVVFFWSAV-CYBMUJFWSA-N 1 2 300.381 4.047 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Cl)c(C(F)(F)F)c2)CCS1 ZINC001175600845 1048367921 /nfs/dbraw/zinc/36/79/21/1048367921.db2.gz CGYINIFIPUWBJP-SECBINFHSA-N 1 2 309.784 4.296 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Cl)c(C(F)(F)F)c2)CCS1 ZINC001175600845 1048367936 /nfs/dbraw/zinc/36/79/36/1048367936.db2.gz CGYINIFIPUWBJP-SECBINFHSA-N 1 2 309.784 4.296 20 0 DIADLO OCc1ccc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)cc1 ZINC001175562777 1048371944 /nfs/dbraw/zinc/37/19/44/1048371944.db2.gz NZZQXKPXZGZLDQ-UHFFFAOYSA-N 1 2 318.298 4.490 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2conc2Cc2ccccc2)o1 ZINC000555524687 1048375320 /nfs/dbraw/zinc/37/53/20/1048375320.db2.gz WUCAMNIIVMDAEB-KBXCAEBGSA-N 1 2 322.408 4.272 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cc(Cl)cnc2Br)c1 ZINC001203654946 1048377738 /nfs/dbraw/zinc/37/77/38/1048377738.db2.gz UKOPBMGLIFMKMT-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO CCNC(=O)c1ccc(Nc2ccc3c(C)cc[nH+]c3c2)cc1 ZINC001175633633 1048383667 /nfs/dbraw/zinc/38/36/67/1048383667.db2.gz JZHGYMRYTQTULX-UHFFFAOYSA-N 1 2 305.381 4.037 20 0 DIADLO Cc1cc(N2CCC3(CCSCC3)CC2)nc(C2CCC2)[nH+]1 ZINC001187234295 1048384894 /nfs/dbraw/zinc/38/48/94/1048384894.db2.gz WGXBPYZCPYDTAV-UHFFFAOYSA-N 1 2 317.502 4.166 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC000555550051 1048386281 /nfs/dbraw/zinc/38/62/81/1048386281.db2.gz HAHAFIKTVHJXOL-NSHDSACASA-N 1 2 322.449 4.439 20 0 DIADLO COc1ccc(Cn2ncc(C)c2Nc2cc(C)c[nH+]c2C)cc1 ZINC001203658044 1048388893 /nfs/dbraw/zinc/38/88/93/1048388893.db2.gz VGZKCKLCMOLDRK-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO CSc1ncc(Nc2ccc(Oc3cc[nH+]c(C)c3)cc2)cn1 ZINC001175652139 1048391220 /nfs/dbraw/zinc/39/12/20/1048391220.db2.gz NXSIWVSROXBWHP-UHFFFAOYSA-N 1 2 324.409 4.438 20 0 DIADLO CCc1cc(NCC2(Cc3ccc(F)cc3)CC2)nc(CC)[nH+]1 ZINC001162936554 1048392139 /nfs/dbraw/zinc/39/21/39/1048392139.db2.gz KRUNWJVFRBUMHE-UHFFFAOYSA-N 1 2 313.420 4.175 20 0 DIADLO CCC(CC)[C@H]1C[C@H](Nc2nc(C)[nH+]c3c2CCCC3)CCO1 ZINC001162944021 1048394306 /nfs/dbraw/zinc/39/43/06/1048394306.db2.gz WOLIRRGMJXKDPS-CRAIPNDOSA-N 1 2 317.477 4.060 20 0 DIADLO Cc1ccc([C@@H](CO)Nc2cc(-c3ccccc3)cc[nH+]2)cc1 ZINC001162944377 1048394435 /nfs/dbraw/zinc/39/44/35/1048394435.db2.gz CKGIFEDHBMVRDO-LJQANCHMSA-N 1 2 304.393 4.203 20 0 DIADLO CC[C@@H](CO)Nc1cc(-c2ccccc2)c2ccc(OC)cc2[nH+]1 ZINC001163045859 1048407421 /nfs/dbraw/zinc/40/74/21/1048407421.db2.gz ZXCNDJJWDFNTIN-HNNXBMFYSA-N 1 2 322.408 4.093 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2c2nc3cccc(C)c3s2)[nH+]c1C ZINC001187600139 1048411046 /nfs/dbraw/zinc/41/10/46/1048411046.db2.gz MCIZFFVAJWTBAY-CQSZACIVSA-N 1 2 312.442 4.286 20 0 DIADLO Cc1ccc(NC(=O)[C@H](CC(C)C)n2cc[nH+]c2)c(Cl)c1C ZINC001163062748 1048412024 /nfs/dbraw/zinc/41/20/24/1048412024.db2.gz RUZZVFVZDBIWJT-HNNXBMFYSA-N 1 2 319.836 4.379 20 0 DIADLO Fc1ccc2oc(C[NH2+][C@H]3COc4cc(F)cc(F)c43)cc2c1 ZINC001201963947 1048413394 /nfs/dbraw/zinc/41/33/94/1048413394.db2.gz YKLWYGILJDSCQR-AWEZNQCLSA-N 1 2 319.282 4.073 20 0 DIADLO Cc1c(Cl)cccc1C[NH2+][C@@H]1c2ccccc2OC[C@@H]1F ZINC001203665363 1048416073 /nfs/dbraw/zinc/41/60/73/1048416073.db2.gz MSMCLASKBXFYND-DOTOQJQBSA-N 1 2 305.780 4.210 20 0 DIADLO Cc1c(Cl)cccc1C[NH2+][C@H]1c2ccccc2OC[C@H]1F ZINC001203665366 1048416727 /nfs/dbraw/zinc/41/67/27/1048416727.db2.gz MSMCLASKBXFYND-WBVHZDCISA-N 1 2 305.780 4.210 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc(Cl)ccc2F)c[nH+]1 ZINC001175712690 1048418740 /nfs/dbraw/zinc/41/87/40/1048418740.db2.gz HCKSIIULSAKQDW-UHFFFAOYSA-N 1 2 305.662 4.219 20 0 DIADLO CC(C)(C)c1cncc(Nc2c[nH+]c(N)cc2C(F)(F)F)c1 ZINC001175712494 1048419189 /nfs/dbraw/zinc/41/91/89/1048419189.db2.gz NDCJDGRPWAZSMU-UHFFFAOYSA-N 1 2 310.323 4.119 20 0 DIADLO COc1ccc(Nc2c[nH+]c(N)cc2C(F)(F)F)c(Cl)c1 ZINC001175714589 1048420820 /nfs/dbraw/zinc/42/08/20/1048420820.db2.gz QYCVRQGOCWCHEE-UHFFFAOYSA-N 1 2 317.698 4.088 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(OCC3CC3)cc2)c[nH+]1 ZINC001175714864 1048420840 /nfs/dbraw/zinc/42/08/40/1048420840.db2.gz XCDDEXFYUQRBMW-UHFFFAOYSA-N 1 2 323.318 4.215 20 0 DIADLO Cc1cc(NCc2ccc3[nH+]ccn3c2)nc2c(Cl)cccc12 ZINC001163138896 1048420796 /nfs/dbraw/zinc/42/07/96/1048420796.db2.gz DCHZVHWRWXKDCH-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO Cc1ccc2c(c1)cc(Cl)nc2NCc1ccc2[nH+]ccn2c1 ZINC001163139396 1048420882 /nfs/dbraw/zinc/42/08/82/1048420882.db2.gz NFIKHWGCLQDEEB-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO Cc1cc(Cl)c(Nc2c[nH+]c(N)cc2C(F)(F)F)cc1O ZINC001175716009 1048421591 /nfs/dbraw/zinc/42/15/91/1048421591.db2.gz QSGXPFCFBPNMBF-UHFFFAOYSA-N 1 2 317.698 4.094 20 0 DIADLO Clc1cccc2c1ccnc2NCc1ccc2[nH+]ccn2c1 ZINC001163139031 1048421593 /nfs/dbraw/zinc/42/15/93/1048421593.db2.gz FWHWZILZKAFYSX-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2c(O)ccc3ccccc32)c[nH+]1 ZINC001175717680 1048422660 /nfs/dbraw/zinc/42/26/60/1048422660.db2.gz LWFUDMUZQNVQCC-UHFFFAOYSA-N 1 2 319.286 4.285 20 0 DIADLO C[C@H](Nc1nc2ccccc2n2c[nH+]cc12)c1c(F)cccc1F ZINC001187670001 1048422684 /nfs/dbraw/zinc/42/26/84/1048422684.db2.gz XFOFDKYOCXMFBL-NSHDSACASA-N 1 2 324.334 4.334 20 0 DIADLO CSCc1cc[nH+]c(N[C@@H](C)c2ccc(NC(C)=O)cc2)c1 ZINC001163155463 1048424288 /nfs/dbraw/zinc/42/42/88/1048424288.db2.gz WJLBHYFBVDYLJI-LBPRGKRZSA-N 1 2 315.442 4.076 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCCCC(=O)c1cccnc1 ZINC001163175703 1048428303 /nfs/dbraw/zinc/42/83/03/1048428303.db2.gz KSSSMYVHDJREFT-UHFFFAOYSA-N 1 2 305.381 4.013 20 0 DIADLO FC(F)(F)c1cccc(CNc2cc3ccccc3c[nH+]2)n1 ZINC001163181097 1048429995 /nfs/dbraw/zinc/42/99/95/1048429995.db2.gz PSZCLRWEASJFKD-UHFFFAOYSA-N 1 2 303.287 4.261 20 0 DIADLO CSc1ccccc1CN(C)c1nc(C)[nH+]c2c1CCCC2 ZINC001163199633 1048434331 /nfs/dbraw/zinc/43/43/31/1048434331.db2.gz FAGSUMLMUBWFFV-UHFFFAOYSA-N 1 2 313.470 4.022 20 0 DIADLO COc1cccc(Nc2cc(C)c[nH+]c2C)c1C(=O)C(F)(F)F ZINC001203668224 1048435192 /nfs/dbraw/zinc/43/51/92/1048435192.db2.gz CHHPVRVGMNKONH-UHFFFAOYSA-N 1 2 324.302 4.196 20 0 DIADLO CC(C)(C)Cc1cc(Nc2c[nH+]c(N)cc2C(F)(F)F)on1 ZINC001175710183 1048437648 /nfs/dbraw/zinc/43/76/48/1048437648.db2.gz XPAPLFZUVRJPGB-UHFFFAOYSA-N 1 2 314.311 4.003 20 0 DIADLO CC(C)(C)c1csc(Nc2c[nH+]c(N)cc2C(F)(F)F)n1 ZINC001175708500 1048437771 /nfs/dbraw/zinc/43/77/71/1048437771.db2.gz QTPPRDSKBICRPI-UHFFFAOYSA-N 1 2 316.352 4.180 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2c(Cl)ccnc2Cl)c[nH+]1 ZINC001175710141 1048437798 /nfs/dbraw/zinc/43/77/98/1048437798.db2.gz VJPPNPBLSFRKOB-UHFFFAOYSA-N 1 2 323.105 4.128 20 0 DIADLO COc1cccc2c1OC[C@@H]2Nc1cc(-c2ccccc2)cc[nH+]1 ZINC001163223361 1048439398 /nfs/dbraw/zinc/43/93/98/1048439398.db2.gz MSYKFHSYCDUGSS-KRWDZBQOSA-N 1 2 318.376 4.303 20 0 DIADLO COc1cc(CNc2[nH+]cccc2OC(C)C)ccc1SC ZINC001202031049 1048440333 /nfs/dbraw/zinc/44/03/33/1048440333.db2.gz CFXCWPWJIQWUEJ-UHFFFAOYSA-N 1 2 318.442 4.211 20 0 DIADLO CCc1cc(NCc2ccc(CSC)cc2)nc(CC)[nH+]1 ZINC001163261052 1048444908 /nfs/dbraw/zinc/44/49/08/1048444908.db2.gz XXZNAEBUURXFRI-UHFFFAOYSA-N 1 2 301.459 4.077 20 0 DIADLO COCc1ccc(Br)c(Nc2cc(C)c[nH+]c2C)c1 ZINC001203669344 1048445814 /nfs/dbraw/zinc/44/58/14/1048445814.db2.gz QPQZOFHHQJBWNF-UHFFFAOYSA-N 1 2 321.218 4.351 20 0 DIADLO Cc1cc(NC[C@@H]2C[C@H]2Cc2ccccc2)nc(C2CCC2)[nH+]1 ZINC001187898310 1048447712 /nfs/dbraw/zinc/44/77/12/1048447712.db2.gz ZSZYMWOOBHOTPR-MSOLQXFVSA-N 1 2 307.441 4.343 20 0 DIADLO Cc1cc(NC[C@H]2C[C@@H]2Cc2ccccc2)nc(C2CCC2)[nH+]1 ZINC001187898313 1048448095 /nfs/dbraw/zinc/44/80/95/1048448095.db2.gz ZSZYMWOOBHOTPR-ZWKOTPCHSA-N 1 2 307.441 4.343 20 0 DIADLO CCC[C@H](Nc1nc(C)[nH+]c(C)c1Br)C(C)(C)C ZINC001163326111 1048451552 /nfs/dbraw/zinc/45/15/52/1048451552.db2.gz AROZUMDFAVSZON-NSHDSACASA-N 1 2 314.271 4.483 20 0 DIADLO COc1c(F)cccc1[C@H](C)Nc1cc(C(C)C)[nH+]c(C)n1 ZINC001163335489 1048455836 /nfs/dbraw/zinc/45/58/36/1048455836.db2.gz PUXWMAGUCRMSGD-NSHDSACASA-N 1 2 303.381 4.229 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cnn(-c4ccccc4)c3)ccc12 ZINC001175795881 1048456075 /nfs/dbraw/zinc/45/60/75/1048456075.db2.gz YDDYWDZDMLLRCC-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO COc1c(F)cccc1[C@@H](C)Nc1cc(CSC)cc[nH+]1 ZINC001163341406 1048456919 /nfs/dbraw/zinc/45/69/19/1048456919.db2.gz VGLAKXGCWIWNHU-LLVKDONJSA-N 1 2 306.406 4.265 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(-c3ccccc3)nc2)[nH+]1 ZINC001175832186 1048458207 /nfs/dbraw/zinc/45/82/07/1048458207.db2.gz AHRVTMPREKFELI-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(-c3cccnc3)cc2)[nH+]1 ZINC001175884341 1048471316 /nfs/dbraw/zinc/47/13/16/1048471316.db2.gz DQLHWXHVTJOSJL-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(-c4cccnc4)cc3)ccc21 ZINC001175887542 1048473868 /nfs/dbraw/zinc/47/38/68/1048473868.db2.gz LXOYXNDBMDAXNV-UHFFFAOYSA-N 1 2 300.365 4.379 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[NH+]1CC(O)(c2ccc(F)cc2)C1 ZINC001175890606 1048475328 /nfs/dbraw/zinc/47/53/28/1048475328.db2.gz GBPOLFRZIHNRAZ-QGZVFWFLSA-N 1 2 319.807 4.134 20 0 DIADLO Cc1cc(N(C)[C@@H]2CCC[C@H]2c2ccccc2)nc(C2CC2)[nH+]1 ZINC001163474068 1048475485 /nfs/dbraw/zinc/47/54/85/1048475485.db2.gz YIDBVMQLQLHOBA-ZWKOTPCHSA-N 1 2 307.441 4.435 20 0 DIADLO Cc1cccc(C)c1NC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001202208332 1048482475 /nfs/dbraw/zinc/48/24/75/1048482475.db2.gz RCFNCWJBGPTONB-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)cs1 ZINC000481763095 1048483189 /nfs/dbraw/zinc/48/31/89/1048483189.db2.gz CVTZJLBFNZLCPR-PWSUYJOCSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)cs1 ZINC000481763095 1048483195 /nfs/dbraw/zinc/48/31/95/1048483195.db2.gz CVTZJLBFNZLCPR-PWSUYJOCSA-N 1 2 306.397 4.429 20 0 DIADLO CCCCC[C@@H]1CCCCN1C(=O)Nc1cc(C)[nH+]cc1C ZINC001202245770 1048502271 /nfs/dbraw/zinc/50/22/71/1048502271.db2.gz PTVDLQIQZQGRKZ-MRXNPFEDSA-N 1 2 303.450 4.087 20 0 DIADLO Cc1ccc(C(C)(C)CNc2cc(C)[nH+]c(C3CCC3)n2)nc1 ZINC001163729654 1048514243 /nfs/dbraw/zinc/51/42/43/1048514243.db2.gz XHIGCKISDUOOHP-UHFFFAOYSA-N 1 2 310.445 4.146 20 0 DIADLO CO[C@@H](CSCc1ccc(C)[nH+]c1C)c1ccc(F)cc1 ZINC000600630586 1048516459 /nfs/dbraw/zinc/51/64/59/1048516459.db2.gz VAMZBUBQPBMROE-KRWDZBQOSA-N 1 2 305.418 4.458 20 0 DIADLO FC(F)(F)CC[N@@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001202346694 1048520107 /nfs/dbraw/zinc/52/01/07/1048520107.db2.gz RNPHGVOVQDFVEK-LBPRGKRZSA-N 1 2 309.784 4.382 20 0 DIADLO FC(F)(F)CC[N@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001202346694 1048520117 /nfs/dbraw/zinc/52/01/17/1048520117.db2.gz RNPHGVOVQDFVEK-LBPRGKRZSA-N 1 2 309.784 4.382 20 0 DIADLO COC1(C[NH2+]CC(F)(F)c2ccc(Cl)cc2)CCCCC1 ZINC001202315612 1048522374 /nfs/dbraw/zinc/52/23/74/1048522374.db2.gz XXWAYVGHZMVLKX-UHFFFAOYSA-N 1 2 317.807 4.371 20 0 DIADLO Cc1cccc2c(C)cc(N3CCC(=O)[C@@H]4CCCC[C@@H]43)[nH+]c12 ZINC001163786868 1048524562 /nfs/dbraw/zinc/52/45/62/1048524562.db2.gz VJWIGESPNKCLEQ-SJORKVTESA-N 1 2 308.425 4.190 20 0 DIADLO Cc1cccc2c(C)cc(N3CCC(=O)[C@H]4CCCC[C@H]43)[nH+]c12 ZINC001163786865 1048525172 /nfs/dbraw/zinc/52/51/72/1048525172.db2.gz VJWIGESPNKCLEQ-DLBZAZTESA-N 1 2 308.425 4.190 20 0 DIADLO COC(=O)c1cc2[nH+]c[nH]c2c(NCc2ccc(C(C)C)cc2)c1 ZINC001163821410 1048529872 /nfs/dbraw/zinc/52/98/72/1048529872.db2.gz XOMVXPBGRUSRQX-UHFFFAOYSA-N 1 2 323.396 4.085 20 0 DIADLO Cc1cn2c(cccc2NC(=O)Nc2ccc3ccccc3c2)[nH+]1 ZINC001188577366 1048530739 /nfs/dbraw/zinc/53/07/39/1048530739.db2.gz VTSGVCYLSUUESH-UHFFFAOYSA-N 1 2 316.364 4.440 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3ccc4ccccc4c3)ccc2[nH+]1 ZINC001188583986 1048532294 /nfs/dbraw/zinc/53/22/94/1048532294.db2.gz MMLOKGAHKQTAAU-UHFFFAOYSA-N 1 2 316.364 4.440 20 0 DIADLO Cc1cn2cccc(Nc3ccc(-c4ccccn4)cc3)c2[nH+]1 ZINC001176037885 1048542500 /nfs/dbraw/zinc/54/25/00/1048542500.db2.gz ZYCAIUXLFAUBSW-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO Cc1cc(NCC(C)(C)[C@@H]2CCCCO2)nc(C2CCC2)[nH+]1 ZINC001163921004 1048548922 /nfs/dbraw/zinc/54/89/22/1048548922.db2.gz WPKCAVIEMLNUAX-HNNXBMFYSA-N 1 2 303.450 4.060 20 0 DIADLO COc1cccc2[nH]c(Nc3cc(OC(F)(F)F)cc[nH+]3)cc21 ZINC001176061435 1048556289 /nfs/dbraw/zinc/55/62/89/1048556289.db2.gz HWACJMIKUKHEIY-UHFFFAOYSA-N 1 2 323.274 4.214 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667986097 1048557843 /nfs/dbraw/zinc/55/78/43/1048557843.db2.gz PZYYCVFCCVWILQ-NHYWBVRUSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667986097 1048557860 /nfs/dbraw/zinc/55/78/60/1048557860.db2.gz PZYYCVFCCVWILQ-NHYWBVRUSA-N 1 2 306.331 4.082 20 0 DIADLO COc1cccc2[nH]c(Nc3cccc(Cn4cc[nH+]c4)c3)cc21 ZINC001176063743 1048557987 /nfs/dbraw/zinc/55/79/87/1048557987.db2.gz JMJBURRENRYBJF-UHFFFAOYSA-N 1 2 318.380 4.165 20 0 DIADLO F[C@H]1CCCN(c2cc(-c3ccccc3)cc[nH+]2)CC1(F)F ZINC001164059587 1048572904 /nfs/dbraw/zinc/57/29/04/1048572904.db2.gz JPPFDXSCPUYGHT-HNNXBMFYSA-N 1 2 306.331 4.322 20 0 DIADLO c1cc2cc(N[C@@H](c3ccccc3)c3ccncc3)[nH+]cc2[nH]1 ZINC001164065697 1048573297 /nfs/dbraw/zinc/57/32/97/1048573297.db2.gz IQDSRTJIKIWSEW-IBGZPJMESA-N 1 2 300.365 4.159 20 0 DIADLO COc1cc[nH+]cc1Nc1cnc2c(cccc2C(F)(F)F)c1 ZINC001176118925 1048573695 /nfs/dbraw/zinc/57/36/95/1048573695.db2.gz MPERIDXEASATAK-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(C(F)(F)F)nc2ccccc21 ZINC001176118667 1048573930 /nfs/dbraw/zinc/57/39/30/1048573930.db2.gz KVGAHAVGOJZZIH-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO COc1cc[nH+]cc1Nc1cccc(Br)c1Cl ZINC001176123125 1048575997 /nfs/dbraw/zinc/57/59/97/1048575997.db2.gz JNILBOJQDCEQRA-UHFFFAOYSA-N 1 2 313.582 4.250 20 0 DIADLO COc1cc[nH+]cc1Nc1cccc(CCc2ccccn2)c1 ZINC001176121942 1048576646 /nfs/dbraw/zinc/57/66/46/1048576646.db2.gz TVBATLGXTZPETE-UHFFFAOYSA-N 1 2 305.381 4.014 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(C2(C(F)(F)F)CC2)cc1 ZINC001176120953 1048576990 /nfs/dbraw/zinc/57/69/90/1048576990.db2.gz CCALITXBQDQIRO-UHFFFAOYSA-N 1 2 308.303 4.428 20 0 DIADLO Cn1c[nH+]c2ccc(N[C@@H](c3ccccc3)c3ccncc3)cc21 ZINC001164074753 1048577965 /nfs/dbraw/zinc/57/79/65/1048577965.db2.gz NGNOLRIXXWYKGG-FQEVSTJZSA-N 1 2 314.392 4.170 20 0 DIADLO CC(C)=CCC[C@H](C)CC[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000482254902 1048579142 /nfs/dbraw/zinc/57/91/42/1048579142.db2.gz VCVWERJOIBTLRA-WMZOPIPTSA-N 1 2 312.461 4.256 20 0 DIADLO Cc1cc(N[C@@H](c2ccccc2)c2ccncc2)[nH+]c2cc[nH]c21 ZINC001164083036 1048579561 /nfs/dbraw/zinc/57/95/61/1048579561.db2.gz WUPCVODVVAGMRG-FQEVSTJZSA-N 1 2 314.392 4.468 20 0 DIADLO COc1cc[nH+]cc1N[C@H](C)c1ccc(Br)s1 ZINC001164088728 1048581916 /nfs/dbraw/zinc/58/19/16/1048581916.db2.gz JXUAQSWXWHNNFW-MRVPVSSYSA-N 1 2 313.220 4.087 20 0 DIADLO CN(Cc1cnc(Cl)s1)c1cc(-c2ccccc2)cc[nH+]1 ZINC001164168977 1048596638 /nfs/dbraw/zinc/59/66/38/1048596638.db2.gz RMXJOMGYKIOXSM-UHFFFAOYSA-N 1 2 315.829 4.495 20 0 DIADLO Cc1cc(NC[C@@]2(C)CCOC3(CCC3)C2)nc(C2CCC2)[nH+]1 ZINC001164170353 1048596715 /nfs/dbraw/zinc/59/67/15/1048596715.db2.gz NDRZLGHHACYLOX-SFHVURJKSA-N 1 2 315.461 4.204 20 0 DIADLO CNc1cc(CNc2nc3c(cc(Cl)cc3F)s2)cc[nH+]1 ZINC001164190493 1048603540 /nfs/dbraw/zinc/60/35/40/1048603540.db2.gz DLMGFFOGZHBDTL-UHFFFAOYSA-N 1 2 322.796 4.138 20 0 DIADLO Cc1cc(-c2nnc(C[N@@H+](C)[C@H](C)c3cccs3)o2)c(C)o1 ZINC000158655887 1048603693 /nfs/dbraw/zinc/60/36/93/1048603693.db2.gz GPKKYKFRBOASBI-LLVKDONJSA-N 1 2 317.414 4.201 20 0 DIADLO Cc1cc(-c2nnc(C[N@H+](C)[C@H](C)c3cccs3)o2)c(C)o1 ZINC000158655887 1048603702 /nfs/dbraw/zinc/60/37/02/1048603702.db2.gz GPKKYKFRBOASBI-LLVKDONJSA-N 1 2 317.414 4.201 20 0 DIADLO COC(=O)c1ccc(-c2ccc(N(C)C3CC(C)C3)[nH+]c2C)cc1 ZINC001164200160 1048604933 /nfs/dbraw/zinc/60/49/33/1048604933.db2.gz ZFYQHCJLIAZKNP-UHFFFAOYSA-N 1 2 324.424 4.078 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1nc2ccc(F)cc2o1 ZINC000162937125 1048608057 /nfs/dbraw/zinc/60/80/57/1048608057.db2.gz FUANIFFNAJCCAZ-NSHDSACASA-N 1 2 302.324 4.299 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1nc2ccc(F)cc2o1 ZINC000162937125 1048608063 /nfs/dbraw/zinc/60/80/63/1048608063.db2.gz FUANIFFNAJCCAZ-NSHDSACASA-N 1 2 302.324 4.299 20 0 DIADLO Cc1cc(N2CCC[C@H]2/C=C/c2ccccc2)nc(C2CC2)[nH+]1 ZINC001164260966 1048613686 /nfs/dbraw/zinc/61/36/86/1048613686.db2.gz JYTYHZHXYCSFDA-PEKVBPLLSA-N 1 2 305.425 4.345 20 0 DIADLO CCc1cc(N2CCC[C@H]2/C=C/c2ccccc2)nc(CC)[nH+]1 ZINC001164261735 1048614601 /nfs/dbraw/zinc/61/46/01/1048614601.db2.gz YXZWPHMFPPLRKZ-HHNLSAEISA-N 1 2 307.441 4.284 20 0 DIADLO Cc1ccc(-c2cc[nH+]c(NCc3ccc4nonc4c3)c2)cc1 ZINC001164343588 1048621840 /nfs/dbraw/zinc/62/18/40/1048621840.db2.gz XDZAWOBYOKALMK-UHFFFAOYSA-N 1 2 316.364 4.205 20 0 DIADLO C[NH+](C)c1ccc(NCc2cccc(F)c2OC(F)F)cc1 ZINC000850198664 1048623025 /nfs/dbraw/zinc/62/30/25/1048623025.db2.gz LIVHYLGSAWQEPZ-UHFFFAOYSA-N 1 2 310.319 4.105 20 0 DIADLO Cc1[nH]c(CNc2ccc(F)cc2OC2CCCC2)[nH+]c1C ZINC000850226910 1048625088 /nfs/dbraw/zinc/62/50/88/1048625088.db2.gz VHMQOTFEQJBOOU-UHFFFAOYSA-N 1 2 303.381 4.099 20 0 DIADLO C[C@H](SCc1ccc[nH+]c1N)c1cccc(Br)c1 ZINC001189424119 1048627153 /nfs/dbraw/zinc/62/71/53/1048627153.db2.gz RZEFVCUVSPFZGR-JTQLQIEISA-N 1 2 323.259 4.421 20 0 DIADLO Oc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)c(C(F)(F)F)c1 ZINC001176339357 1048631120 /nfs/dbraw/zinc/63/11/20/1048631120.db2.gz XJHAIWBUDUKJEG-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO Oc1ccc(Nc2ccccc2-n2cc[nH+]c2)c(C(F)(F)F)c1 ZINC001176338997 1048631196 /nfs/dbraw/zinc/63/11/96/1048631196.db2.gz PXYYEYQFHPJVEX-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO Cc1c[nH+]c(Nc2ccc(OCc3ccccc3)nc2)c(C)c1 ZINC001176300264 1048639796 /nfs/dbraw/zinc/63/97/96/1048639796.db2.gz GQYNFBAFDIETMY-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO Clc1ccc2c(cc[nH+]c2N2CCC(OC3CCC3)CC2)c1 ZINC001164571587 1048645220 /nfs/dbraw/zinc/64/52/20/1048645220.db2.gz GBHXHKWDFKYNHC-UHFFFAOYSA-N 1 2 316.832 4.426 20 0 DIADLO Cc1cc(C)c(Nc2cccc3c2cnn3[C@H]2CCCCO2)c[nH+]1 ZINC001176319869 1048649259 /nfs/dbraw/zinc/64/92/59/1048649259.db2.gz UDXFVKTYGXXMSG-LJQANCHMSA-N 1 2 322.412 4.491 20 0 DIADLO COc1cccc(Nc2ccc(C)[nH+]c2C)c1C(=O)C(F)(F)F ZINC001203381474 1048651212 /nfs/dbraw/zinc/65/12/12/1048651212.db2.gz ZJJNCRTUEPWTNI-UHFFFAOYSA-N 1 2 324.302 4.196 20 0 DIADLO CC(C)(c1ccnc(Cl)c1)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC001165063232 1048657676 /nfs/dbraw/zinc/65/76/76/1048657676.db2.gz NAIIZNYHXSYWMK-INIZCTEOSA-N 1 2 316.832 4.044 20 0 DIADLO CC(C)(c1ccnc(Cl)c1)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC001165063232 1048657691 /nfs/dbraw/zinc/65/76/91/1048657691.db2.gz NAIIZNYHXSYWMK-INIZCTEOSA-N 1 2 316.832 4.044 20 0 DIADLO c1coc(-c2cccc(NCc3ccc(-n4cc[nH+]c4)cc3)c2)n1 ZINC000160249107 1048658506 /nfs/dbraw/zinc/65/85/06/1048658506.db2.gz PVNXGQMIRHGIPP-UHFFFAOYSA-N 1 2 316.364 4.139 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCCC34CC4)cc2)C[C@H](C)O1 ZINC000850458796 1048663701 /nfs/dbraw/zinc/66/37/01/1048663701.db2.gz PWVDKLGEDZVEJW-RVKKMQEKSA-N 1 2 300.446 4.045 20 0 DIADLO Cc1cc(Oc2ccc(Nc3csc(CO)c3)cc2)cc[nH+]1 ZINC001176371738 1048664038 /nfs/dbraw/zinc/66/40/38/1048664038.db2.gz OOZZONPSEBJILF-UHFFFAOYSA-N 1 2 312.394 4.480 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1cc2cnccc2o1 ZINC000850459154 1048665440 /nfs/dbraw/zinc/66/54/40/1048665440.db2.gz RTCIIEOXXHJZHY-CYBMUJFWSA-N 1 2 307.397 4.383 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1cc2cnccc2o1 ZINC000850459154 1048665445 /nfs/dbraw/zinc/66/54/45/1048665445.db2.gz RTCIIEOXXHJZHY-CYBMUJFWSA-N 1 2 307.397 4.383 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccc(C(F)F)nc1 ZINC000850471434 1048666931 /nfs/dbraw/zinc/66/69/31/1048666931.db2.gz QGPAAYKOACDWBA-QMMMGPOBSA-N 1 2 316.273 4.287 20 0 DIADLO O=C1Cc2cc(Nc3cc[nH+]c4cc(Cl)ccc34)ccc2N1 ZINC001176426815 1048667766 /nfs/dbraw/zinc/66/77/66/1048667766.db2.gz YFTUYVUSXAUPTP-UHFFFAOYSA-N 1 2 309.756 4.126 20 0 DIADLO CN(Cc1ncccc1C(F)(F)F)c1cc2ccccc2c[nH+]1 ZINC001165222211 1048669219 /nfs/dbraw/zinc/66/92/19/1048669219.db2.gz KRBAJAHIKXVBDD-UHFFFAOYSA-N 1 2 317.314 4.285 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Oc2ccc(F)cc2)ccn1)c1ccco1 ZINC000482749368 1048671498 /nfs/dbraw/zinc/67/14/98/1048671498.db2.gz ZJDXWAKXRPCDAK-CYBMUJFWSA-N 1 2 312.344 4.457 20 0 DIADLO CN(C)c1[nH+]cc(CSCc2ccccn2)c2ccccc21 ZINC001189832702 1048671759 /nfs/dbraw/zinc/67/17/59/1048671759.db2.gz ONLOSCSVHPGZOS-UHFFFAOYSA-N 1 2 309.438 4.129 20 0 DIADLO Cc1nonc1C[NH2+][C@H](C)c1ccccc1Oc1ccccc1 ZINC000775334455 1048676431 /nfs/dbraw/zinc/67/64/31/1048676431.db2.gz ZPKJKVUFMBVGPZ-CYBMUJFWSA-N 1 2 309.369 4.021 20 0 DIADLO CCc1cccc(C)c1NC(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001189940494 1048677921 /nfs/dbraw/zinc/67/79/21/1048677921.db2.gz UKZSDZALHRVEOL-UHFFFAOYSA-N 1 2 320.396 4.387 20 0 DIADLO CCc1cccc(C)c1NC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001189975053 1048678258 /nfs/dbraw/zinc/67/82/58/1048678258.db2.gz AZDFTCPWSWQGPE-UHFFFAOYSA-N 1 2 320.396 4.387 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+](C)Cc1nc2ccccc2o1 ZINC000482800780 1048680713 /nfs/dbraw/zinc/68/07/13/1048680713.db2.gz JVDFOOQSPRXEDD-UHFFFAOYSA-N 1 2 316.788 4.122 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+](C)Cc1nc2ccccc2o1 ZINC000482800780 1048680721 /nfs/dbraw/zinc/68/07/21/1048680721.db2.gz JVDFOOQSPRXEDD-UHFFFAOYSA-N 1 2 316.788 4.122 20 0 DIADLO O=C(Nc1ccc(F)c(C2CC2)c1)c1ccccc1-n1cc[nH+]c1 ZINC001190099778 1048694864 /nfs/dbraw/zinc/69/48/64/1048694864.db2.gz MZTQLPBUGMDQPJ-UHFFFAOYSA-N 1 2 321.355 4.141 20 0 DIADLO CCc1cccc2cc(C[N@@H+]3CCC[C@H]3c3nc(C)no3)oc21 ZINC000668151843 1048700949 /nfs/dbraw/zinc/70/09/49/1048700949.db2.gz PWNAWEFWENUOTA-INIZCTEOSA-N 1 2 311.385 4.024 20 0 DIADLO CCc1cccc2cc(C[N@H+]3CCC[C@H]3c3nc(C)no3)oc21 ZINC000668151843 1048700960 /nfs/dbraw/zinc/70/09/60/1048700960.db2.gz PWNAWEFWENUOTA-INIZCTEOSA-N 1 2 311.385 4.024 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@@H+]1CCO[C@@H](c3ccccc3F)C1)CC2 ZINC000482945910 1048709509 /nfs/dbraw/zinc/70/95/09/1048709509.db2.gz KLQPXBVDSQMERV-RTBURBONSA-N 1 2 315.363 4.026 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@H+]1CCO[C@@H](c3ccccc3F)C1)CC2 ZINC000482945910 1048709516 /nfs/dbraw/zinc/70/95/16/1048709516.db2.gz KLQPXBVDSQMERV-RTBURBONSA-N 1 2 315.363 4.026 20 0 DIADLO CC(C)(C)c1nc(C[NH2+]C2(c3cccc(Cl)c3)CC2)co1 ZINC000930229068 1048718182 /nfs/dbraw/zinc/71/81/82/1048718182.db2.gz YKTYQLNHQBHLHS-UHFFFAOYSA-N 1 2 304.821 4.404 20 0 DIADLO FC(F)(F)c1ccnnc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718366 1048719144 /nfs/dbraw/zinc/71/91/44/1048719144.db2.gz FEFVNHQIWCXDMG-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO COc1ccc(O)cc1Nc1cc[nH+]c2cc(Cl)ccc12 ZINC001176575528 1048733167 /nfs/dbraw/zinc/73/31/67/1048733167.db2.gz AFDMQBNZKUWKKF-UHFFFAOYSA-N 1 2 300.745 4.346 20 0 DIADLO c1ccc2cc(N3C[C@H]4[C@@H](C3)CCC[C@H]4OCC3CC3)[nH+]cc2c1 ZINC001166114582 1048735854 /nfs/dbraw/zinc/73/58/54/1048735854.db2.gz RJKQQNNLNUFHCS-HSALFYBXSA-N 1 2 322.452 4.266 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@](C)(CC)c2ccccc2)n1 ZINC000775386361 1048736210 /nfs/dbraw/zinc/73/62/10/1048736210.db2.gz CWONEWHNICRNKI-CXAGYDPISA-N 1 2 319.474 4.299 20 0 DIADLO CC[C@](C)([NH2+]Cc1noc(-c2ccsc2)n1)c1ccccc1 ZINC000775394202 1048748925 /nfs/dbraw/zinc/74/89/25/1048748925.db2.gz KEINSRFALCENLN-KRWDZBQOSA-N 1 2 313.426 4.213 20 0 DIADLO COc1cc(C[N@H+](C)Cc2ccsc2Cl)cc(OC)c1 ZINC000483183353 1048749108 /nfs/dbraw/zinc/74/91/08/1048749108.db2.gz NISLPXVXVZYPFG-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2ccsc2Cl)cc(OC)c1 ZINC000483183353 1048749124 /nfs/dbraw/zinc/74/91/24/1048749124.db2.gz NISLPXVXVZYPFG-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO Cc1ccc2c(Nc3c(F)cc(F)c(O)c3F)cccc2[nH+]1 ZINC001176672930 1048757933 /nfs/dbraw/zinc/75/79/33/1048757933.db2.gz OEXWJZTUIJFKTC-UHFFFAOYSA-N 1 2 304.271 4.410 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(-c3ccncc3)cc2)c[nH+]1 ZINC001176695766 1048760328 /nfs/dbraw/zinc/76/03/28/1048760328.db2.gz LPOCBVLSQFRYPH-UHFFFAOYSA-N 1 2 304.397 4.343 20 0 DIADLO FC(F)(F)c1ccc(C=CNc2ccn3cc[nH+]c3c2)cc1 ZINC001176662316 1048767313 /nfs/dbraw/zinc/76/73/13/1048767313.db2.gz PVSWZRVRXSRCSH-FNORWQNLSA-N 1 2 303.287 4.436 20 0 DIADLO CCCOc1ccc(C(C)(C)[NH2+]Cc2nc(C)c(C)o2)cc1 ZINC000483273112 1048770511 /nfs/dbraw/zinc/77/05/11/1048770511.db2.gz SIKOUKPIORPRLX-UHFFFAOYSA-N 1 2 302.418 4.105 20 0 DIADLO c1ccc(-c2cccnc2Nc2ccc[nH+]c2N2CCCC2)cc1 ZINC001176750462 1048777217 /nfs/dbraw/zinc/77/72/17/1048777217.db2.gz UHUUOBDTPQCLAM-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Cc1cc(C)c(C[NH2+]Cc2noc(-c3ccccc3C)n2)c(C)c1 ZINC000483311067 1048777880 /nfs/dbraw/zinc/77/78/80/1048777880.db2.gz UKBHZHZQAKGZTE-UHFFFAOYSA-N 1 2 321.424 4.260 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1CC[C@H]1COCc1ccccc1 ZINC001166669806 1048778716 /nfs/dbraw/zinc/77/87/16/1048778716.db2.gz CYTRVORALUQUIF-SFHVURJKSA-N 1 2 318.420 4.339 20 0 DIADLO Clc1ccnc(Cl)c1Nc1ccc[nH+]c1N1CCCC1 ZINC001176744355 1048779304 /nfs/dbraw/zinc/77/93/04/1048779304.db2.gz UQVANTACPZGBPH-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ccsc2Cl)o1 ZINC000483320163 1048780783 /nfs/dbraw/zinc/78/07/83/1048780783.db2.gz LVNFNQHMIXINDD-CYBMUJFWSA-N 1 2 311.834 4.478 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccsc2Cl)o1 ZINC000483320163 1048780796 /nfs/dbraw/zinc/78/07/96/1048780796.db2.gz LVNFNQHMIXINDD-CYBMUJFWSA-N 1 2 311.834 4.478 20 0 DIADLO CCCCc1oc2ccccc2c1C[NH2+][C@@H](C)c1nc(C)no1 ZINC000483342952 1048784458 /nfs/dbraw/zinc/78/44/58/1048784458.db2.gz QOGBLUVRCZYIIX-LBPRGKRZSA-N 1 2 313.401 4.318 20 0 DIADLO COc1ccc2[nH+]c(N3CCC[C@H](C(F)F)C3)cc(C)c2c1 ZINC001166773354 1048791626 /nfs/dbraw/zinc/79/16/26/1048791626.db2.gz QKSHXAHSUPVHMV-LBPRGKRZSA-N 1 2 306.356 4.033 20 0 DIADLO Cc1nc(N2CCC[C@@H](C(F)F)C2)cc(C2CCCCC2)[nH+]1 ZINC001166773854 1048793152 /nfs/dbraw/zinc/79/31/52/1048793152.db2.gz FHCFAOYRPPVRSZ-CQSZACIVSA-N 1 2 309.404 4.314 20 0 DIADLO COc1c(C)c[nH+]c(CSc2nc3ccc(F)cc3o2)c1C ZINC001166853844 1048806233 /nfs/dbraw/zinc/80/62/33/1048806233.db2.gz WNWQLQISPZHJTL-UHFFFAOYSA-N 1 2 318.373 4.280 20 0 DIADLO Fc1ccc([C@@H](CC(F)(F)F)[NH2+]Cc2cccc(F)n2)cc1 ZINC000851898231 1048811824 /nfs/dbraw/zinc/81/18/24/1048811824.db2.gz UHWPOYVUTSLGMP-CYBMUJFWSA-N 1 2 316.273 4.143 20 0 DIADLO Cc1cc(C[N@@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)ccn1 ZINC001190953546 1048815229 /nfs/dbraw/zinc/81/52/29/1048815229.db2.gz FCTWSNFXKNOIAT-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(C[N@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)ccn1 ZINC001190953546 1048815243 /nfs/dbraw/zinc/81/52/43/1048815243.db2.gz FCTWSNFXKNOIAT-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC001191038079 1048827765 /nfs/dbraw/zinc/82/77/65/1048827765.db2.gz DSLXOZSQBALBPY-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC001191038079 1048827786 /nfs/dbraw/zinc/82/77/86/1048827786.db2.gz DSLXOZSQBALBPY-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001167016332 1048828994 /nfs/dbraw/zinc/82/89/94/1048828994.db2.gz LETWGAUODWNFAQ-XHDPSFHLSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001167016332 1048829012 /nfs/dbraw/zinc/82/90/12/1048829012.db2.gz LETWGAUODWNFAQ-XHDPSFHLSA-N 1 2 302.245 4.035 20 0 DIADLO COc1c(C)[nH+]c(C2CC2)nc1NCc1ccccc1C1CC1 ZINC001167013111 1048829078 /nfs/dbraw/zinc/82/90/78/1048829078.db2.gz UKZLOCYDABNADJ-UHFFFAOYSA-N 1 2 309.413 4.161 20 0 DIADLO CCc1ccc([C@H](CNCc2ccc(C)cc2F)[NH+](C)C)cc1 ZINC001177097731 1048829774 /nfs/dbraw/zinc/82/97/74/1048829774.db2.gz AIUDHMKNAYKDPF-FQEVSTJZSA-N 1 2 314.448 4.089 20 0 DIADLO Clc1ccc(C[NH+]2CCC(c3ccco3)CC2)c(Cl)n1 ZINC000852321919 1048834683 /nfs/dbraw/zinc/83/46/83/1048834683.db2.gz WAQGZHFQAAFQDH-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO Clc1ccc(Cl)c(C[NH+]2CCC(c3ccco3)CC2)n1 ZINC000852321692 1048835697 /nfs/dbraw/zinc/83/56/97/1048835697.db2.gz QFCGDVMUFITCOI-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO COc1ccc2cc[nH+]c(N3CCC[C@@H]3c3nccs3)c2c1 ZINC001167040860 1048837222 /nfs/dbraw/zinc/83/72/22/1048837222.db2.gz CTSSLPUVBQMSMA-OAHLLOKOSA-N 1 2 311.410 4.041 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@@H+]2CC2CCC(F)(F)CC2)o1 ZINC001191120348 1048857603 /nfs/dbraw/zinc/85/76/03/1048857603.db2.gz FDMVZZAXOUXUHV-HNNXBMFYSA-N 1 2 313.388 4.041 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@H+]2CC2CCC(F)(F)CC2)o1 ZINC001191120348 1048857625 /nfs/dbraw/zinc/85/76/25/1048857625.db2.gz FDMVZZAXOUXUHV-HNNXBMFYSA-N 1 2 313.388 4.041 20 0 DIADLO Fc1c(F)c(F)c(C[NH+]2C[C@H]3CCCC[C@@H]3C2)c(F)c1F ZINC001203360973 1048879915 /nfs/dbraw/zinc/87/99/15/1048879915.db2.gz GNRZMIDIOGOADT-RKDXNWHRSA-N 1 2 305.290 4.004 20 0 DIADLO C[C@@]1(c2ccc(Cl)cc2)C[N@H+](Cc2ccccc2F)CCO1 ZINC001203353478 1048880923 /nfs/dbraw/zinc/88/09/23/1048880923.db2.gz INCHHQJAUMSMJP-SFHVURJKSA-N 1 2 319.807 4.227 20 0 DIADLO C[C@@]1(c2ccc(Cl)cc2)C[N@@H+](Cc2ccccc2F)CCO1 ZINC001203353478 1048880944 /nfs/dbraw/zinc/88/09/44/1048880944.db2.gz INCHHQJAUMSMJP-SFHVURJKSA-N 1 2 319.807 4.227 20 0 DIADLO c1cc2c(c(CNc3ccc(N4CCCCC4)c[nH+]3)c1)CCC2 ZINC001177403904 1048883654 /nfs/dbraw/zinc/88/36/54/1048883654.db2.gz JTLRJIIEWKYZGP-UHFFFAOYSA-N 1 2 307.441 4.173 20 0 DIADLO COc1cc(Nc2ccc(C)[nH+]c2C)ccc1Br ZINC001203374979 1048887255 /nfs/dbraw/zinc/88/72/55/1048887255.db2.gz RMKKWXBBYVOLCC-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1ncc(-c3ccccc3F)o1)C2 ZINC000483988964 1048890639 /nfs/dbraw/zinc/89/06/39/1048890639.db2.gz UGSCECIQSMXHGS-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1ncc(-c3ccccc3F)o1)C2 ZINC000483988964 1048890655 /nfs/dbraw/zinc/89/06/55/1048890655.db2.gz UGSCECIQSMXHGS-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CC=C(C(F)(F)F)CC2)c1 ZINC000484089071 1048899082 /nfs/dbraw/zinc/89/90/82/1048899082.db2.gz WWOZTLFEUXBPML-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CC=C(C(F)(F)F)CC2)c1 ZINC000484089071 1048899102 /nfs/dbraw/zinc/89/91/02/1048899102.db2.gz WWOZTLFEUXBPML-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO CCOc1cc(Nc2ccc(NC)[nH+]c2)ccc1Br ZINC001203462053 1048906100 /nfs/dbraw/zinc/90/61/00/1048906100.db2.gz HGKBTWQUPYJOCZ-UHFFFAOYSA-N 1 2 322.206 4.028 20 0 DIADLO CNc1ccc(Nc2ccc(-c3nc4ncccc4o3)cc2)c[nH+]1 ZINC001203460958 1048906130 /nfs/dbraw/zinc/90/61/30/1048906130.db2.gz ZZQUWQBYDHMBAB-UHFFFAOYSA-N 1 2 317.352 4.070 20 0 DIADLO CNc1ccc(Nc2ccc(C(=O)c3ccccc3)cc2)c[nH+]1 ZINC001203456378 1048906484 /nfs/dbraw/zinc/90/64/84/1048906484.db2.gz DPRQLMHKQDDLNV-UHFFFAOYSA-N 1 2 303.365 4.098 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC=C(c3ccc(Cl)nc3)CC2)o1 ZINC000773673765 1048909538 /nfs/dbraw/zinc/90/95/38/1048909538.db2.gz MOBICLUKLNHTAS-UHFFFAOYSA-N 1 2 317.820 4.136 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)o1 ZINC000773673765 1048909556 /nfs/dbraw/zinc/90/95/56/1048909556.db2.gz MOBICLUKLNHTAS-UHFFFAOYSA-N 1 2 317.820 4.136 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1CNc1[nH]c2cc(C)ccc2[nH+]1 ZINC001203470141 1048909867 /nfs/dbraw/zinc/90/98/67/1048909867.db2.gz BDBMLTWYSSUYDZ-UHFFFAOYSA-N 1 2 311.433 4.052 20 0 DIADLO Cc1ccc2[nH+]c(NCc3csc(-c4ccccn4)n3)[nH]c2c1 ZINC001203471374 1048910523 /nfs/dbraw/zinc/91/05/23/1048910523.db2.gz NRCHKAXUGJRUFS-UHFFFAOYSA-N 1 2 321.409 4.002 20 0 DIADLO CCCOc1cc(CNc2c[nH+]c(C)c(C)c2)ccc1OC ZINC001203485323 1048911465 /nfs/dbraw/zinc/91/14/65/1048911465.db2.gz KIBUQDKRJAHSQJ-UHFFFAOYSA-N 1 2 300.402 4.108 20 0 DIADLO COc1cccc(CNc2[nH+]c3ccccc3n2C(C)(C)C)c1 ZINC001203517076 1048917064 /nfs/dbraw/zinc/91/70/64/1048917064.db2.gz KPNNGCKDMLJXIM-UHFFFAOYSA-N 1 2 309.413 4.412 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1cnccc1C ZINC001203529853 1048923920 /nfs/dbraw/zinc/92/39/20/1048923920.db2.gz KVCOSJMFSTWMCP-UHFFFAOYSA-N 1 2 300.793 4.025 20 0 DIADLO COc1cccc2[nH]c(NCc3ccc(Cl)c(Cl)c3)[nH+]c21 ZINC001203547985 1048927615 /nfs/dbraw/zinc/92/76/15/1048927615.db2.gz LMDGRYXJNKDHEV-UHFFFAOYSA-N 1 2 322.195 4.490 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cccc(F)c1OC(F)F ZINC001191330551 1048928114 /nfs/dbraw/zinc/92/81/14/1048928114.db2.gz QUCSVABJWFRHGD-LBPRGKRZSA-N 1 2 321.342 4.374 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cccc(F)c1OC(F)F ZINC001191330551 1048928118 /nfs/dbraw/zinc/92/81/18/1048928118.db2.gz QUCSVABJWFRHGD-LBPRGKRZSA-N 1 2 321.342 4.374 20 0 DIADLO Cc1cc(Nc2cc(C)c[nH+]c2C)n(Cc2ccc(F)cc2)n1 ZINC001203657075 1048950856 /nfs/dbraw/zinc/95/08/56/1048950856.db2.gz IAOSRYVSNBQHLK-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO COc1cc(Br)ccc1Nc1cc(C)c[nH+]c1C ZINC001203660802 1048951054 /nfs/dbraw/zinc/95/10/54/1048951054.db2.gz NDZTZJXKQQJNLN-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO COc1ccc(Cn2nc(C)cc2Nc2cc(C)c[nH+]c2C)cc1 ZINC001203658057 1048951203 /nfs/dbraw/zinc/95/12/03/1048951203.db2.gz VNKMODJXBUIEQH-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2c(Cl)nccc2Br)c1 ZINC001203661697 1048952683 /nfs/dbraw/zinc/95/26/83/1048952683.db2.gz ZANJCOWUHMBGEJ-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cccc([C@H]3CN4C=CSC4=N3)c2)c1 ZINC001203667440 1048952999 /nfs/dbraw/zinc/95/29/99/1048952999.db2.gz LMQMJKAZQWBEPB-QGZVFWFLSA-N 1 2 322.437 4.373 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(OCc3ccncc3)cc2)c1 ZINC001203664086 1048953394 /nfs/dbraw/zinc/95/33/94/1048953394.db2.gz XLSCMFVEYKFMNV-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cc(Br)cc(C)c2N)c1 ZINC001203663940 1048955366 /nfs/dbraw/zinc/95/53/66/1048955366.db2.gz ZXZXMOJLPJYQFI-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO Cc1cc(C)c2cc(NCc3cn(C)nc3C(C)(C)C)ccc2[nH+]1 ZINC001203682323 1048961539 /nfs/dbraw/zinc/96/15/39/1048961539.db2.gz HBBHBXLCLDWQQD-UHFFFAOYSA-N 1 2 322.456 4.495 20 0 DIADLO CCCOc1ccc(Nc2ccn3cc[nH+]c3c2)c(F)c1F ZINC001203695226 1048967836 /nfs/dbraw/zinc/96/78/36/1048967836.db2.gz IQDZFTJXPBDGJH-UHFFFAOYSA-N 1 2 303.312 4.145 20 0 DIADLO Cc1nn(-c2ccc([NH+]3CCCCC3)cc2)c2cc(N)cc(F)c12 ZINC001203719266 1048974850 /nfs/dbraw/zinc/97/48/50/1048974850.db2.gz MQBMFVZZWZMXMR-UHFFFAOYSA-N 1 2 324.403 4.046 20 0 DIADLO Cc1cnc(Cl)c(Nc2ccc([NH+]3CCCCC3)cc2)c1N ZINC001203718297 1048974930 /nfs/dbraw/zinc/97/49/30/1048974930.db2.gz AQFONAIUXYRITM-UHFFFAOYSA-N 1 2 316.836 4.360 20 0 DIADLO O=c1[nH]cnc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc21 ZINC001203719199 1048974958 /nfs/dbraw/zinc/97/49/58/1048974958.db2.gz HVXYGJGVLQQGIP-UHFFFAOYSA-N 1 2 320.396 4.069 20 0 DIADLO c1cnc2snc(Nc3ccc([NH+]4CCCCC4)cc3)c2c1 ZINC001203718132 1048975070 /nfs/dbraw/zinc/97/50/70/1048975070.db2.gz RWYWKVKPZXDOMK-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO FC(F)(F)c1ncc(Nc2ccc([NH+]3CCCCC3)cc2)cn1 ZINC001203718264 1048975543 /nfs/dbraw/zinc/97/55/43/1048975543.db2.gz YSACFDWNTFVYDE-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO Oc1cnc(Nc2ccc([NH+]3CCCCC3)cc2)c(Cl)c1 ZINC001203718708 1048977333 /nfs/dbraw/zinc/97/73/33/1048977333.db2.gz LPDXCAZHXQYQEX-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO CCCCOc1ccccc1NCc1c[nH+]c2c(C)cccn12 ZINC001178045965 1048979259 /nfs/dbraw/zinc/97/92/59/1048979259.db2.gz BAFNRVASSBBHHK-UHFFFAOYSA-N 1 2 309.413 4.434 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3ccc(Cl)c(C)c3)ccc2[nH+]1 ZINC001191740928 1048992738 /nfs/dbraw/zinc/99/27/38/1048992738.db2.gz WBCDRXGIKMRYPC-UHFFFAOYSA-N 1 2 314.776 4.249 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H](C)c1ccc(-n2cccn2)cc1 ZINC000776767267 1049001993 /nfs/dbraw/zinc/00/19/93/1049001993.db2.gz UYBZKYQXADLQFS-MRXNPFEDSA-N 1 2 320.440 4.420 20 0 DIADLO OCc1ccc2c(c1)CC[N@@H+](Cc1ccc(Cl)c(Cl)c1)C2 ZINC001203804855 1049002157 /nfs/dbraw/zinc/00/21/57/1049002157.db2.gz YUHUBIISAJAYEH-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO OCc1ccc2c(c1)CC[N@H+](Cc1ccc(Cl)c(Cl)c1)C2 ZINC001203804855 1049002167 /nfs/dbraw/zinc/00/21/67/1049002167.db2.gz YUHUBIISAJAYEH-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO Cc1nc2c(s1)[C@@H](Nc1ccc([NH+](C)C)cc1C)CCC2 ZINC000776767161 1049002708 /nfs/dbraw/zinc/00/27/08/1049002708.db2.gz ZKJZQKHVFCLPLI-INIZCTEOSA-N 1 2 301.459 4.315 20 0 DIADLO c1ccc2c(c1)ccnc2CNc1ccc(N2CCCCC2)[nH+]c1 ZINC001178253691 1049003735 /nfs/dbraw/zinc/00/37/35/1049003735.db2.gz CTYAKOIVMVYMPA-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO Cc1cc(CNc2ccc(F)c(Br)c2)cc(C)[nH+]1 ZINC001178223144 1049005748 /nfs/dbraw/zinc/00/57/48/1049005748.db2.gz PKIFWVYLTPYKMY-UHFFFAOYSA-N 1 2 309.182 4.212 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC001191820521 1049007381 /nfs/dbraw/zinc/00/73/81/1049007381.db2.gz DWKRLWBFAZTRAR-CQSZACIVSA-N 1 2 321.848 4.161 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC001191820521 1049007397 /nfs/dbraw/zinc/00/73/97/1049007397.db2.gz DWKRLWBFAZTRAR-CQSZACIVSA-N 1 2 321.848 4.161 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1noc([C@H](F)CC2CCCCC2)n1 ZINC000904269258 1049010181 /nfs/dbraw/zinc/01/01/81/1049010181.db2.gz ZFCNJLWLVFZQDF-CYBMUJFWSA-N 1 2 304.369 4.003 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2ccc(Br)cc2)C1 ZINC001203908608 1049028068 /nfs/dbraw/zinc/02/80/68/1049028068.db2.gz FCOZVCUOXGQFLD-AWEZNQCLSA-N 1 2 300.215 4.163 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2ccc(Br)cc2)C1 ZINC001203908608 1049028080 /nfs/dbraw/zinc/02/80/80/1049028080.db2.gz FCOZVCUOXGQFLD-AWEZNQCLSA-N 1 2 300.215 4.163 20 0 DIADLO Cc1ccc(NCc2ccc(C(=O)OC(C)(C)C)s2)c(C)[nH+]1 ZINC001178259255 1049013663 /nfs/dbraw/zinc/01/36/63/1049013663.db2.gz AADWRFYUYQIARS-UHFFFAOYSA-N 1 2 318.442 4.327 20 0 DIADLO C[C@H]([NH2+]c1ccc(N2CCOCC2)cc1)C(C)(C)c1ccccc1 ZINC000776793301 1049013818 /nfs/dbraw/zinc/01/38/18/1049013818.db2.gz MMHRANXKTOGOTH-KRWDZBQOSA-N 1 2 324.468 4.301 20 0 DIADLO C[C@@H]([NH2+]c1ccc(N2CCOCC2)cc1)C(C)(C)c1ccccc1 ZINC000776793305 1049014134 /nfs/dbraw/zinc/01/41/34/1049014134.db2.gz MMHRANXKTOGOTH-QGZVFWFLSA-N 1 2 324.468 4.301 20 0 DIADLO Cc1ccc(C)c([N@@H+](CC2CCC3(CC2)OCCO3)C(C)C)c1 ZINC001191961311 1049025801 /nfs/dbraw/zinc/02/58/01/1049025801.db2.gz VMOUNSAZGKZMCX-UHFFFAOYSA-N 1 2 317.473 4.452 20 0 DIADLO Cc1ccc(C)c([N@H+](CC2CCC3(CC2)OCCO3)C(C)C)c1 ZINC001191961311 1049025807 /nfs/dbraw/zinc/02/58/07/1049025807.db2.gz VMOUNSAZGKZMCX-UHFFFAOYSA-N 1 2 317.473 4.452 20 0 DIADLO Fc1ccc(C[N@@H+]2CCSC[C@H]2c2ccc(F)cc2)cc1 ZINC001203917032 1049030272 /nfs/dbraw/zinc/03/02/72/1049030272.db2.gz DNMSWTISTPQDAP-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1ccc(C[N@H+]2CCSC[C@H]2c2ccc(F)cc2)cc1 ZINC001203917032 1049030286 /nfs/dbraw/zinc/03/02/86/1049030286.db2.gz DNMSWTISTPQDAP-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO c1ccc(Oc2ccc(C[NH+]3CC4(C3)CCCCO4)cc2)cc1 ZINC001203942273 1049038794 /nfs/dbraw/zinc/03/87/94/1049038794.db2.gz VJZYCDGXHLHCIX-UHFFFAOYSA-N 1 2 309.409 4.234 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]([NH2+][C@@H](c1ccccc1)C1CCC1)C1CC1 ZINC001192157696 1049043765 /nfs/dbraw/zinc/04/37/65/1049043765.db2.gz IXFLUVWYPPZIIT-ROUUACIJSA-N 1 2 315.457 4.238 20 0 DIADLO CC(C)(C)OC(=O)[C@H]([NH2+][C@H](c1ccccc1)C1CCC1)C1CC1 ZINC001192157695 1049045897 /nfs/dbraw/zinc/04/58/97/1049045897.db2.gz IXFLUVWYPPZIIT-QZTJIDSGSA-N 1 2 315.457 4.238 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@@H](CC(C)C)C1 ZINC001192197881 1049052247 /nfs/dbraw/zinc/05/22/47/1049052247.db2.gz HGKCCODHDFYVCU-YOEHRIQHSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H](CC(C)C)C1 ZINC001192197881 1049052256 /nfs/dbraw/zinc/05/22/56/1049052256.db2.gz HGKCCODHDFYVCU-YOEHRIQHSA-N 1 2 323.864 4.312 20 0 DIADLO O=C(c1cccc2[nH+]ccn21)N1CCCCC[C@@H]1c1ccccc1 ZINC000776832132 1049055543 /nfs/dbraw/zinc/05/55/43/1049055543.db2.gz CNKRQHIGQJUHPP-QGZVFWFLSA-N 1 2 319.408 4.092 20 0 DIADLO CC(C)(C)OC(=O)Nc1cccc(C[NH2+]C(C)(C)C(F)F)c1 ZINC001178606378 1049066751 /nfs/dbraw/zinc/06/67/51/1049066751.db2.gz YWXUOPUIICQWLZ-UHFFFAOYSA-N 1 2 314.376 4.167 20 0 DIADLO Cc1cccc(C[N@@H+]2CCSC[C@@H]2c2cccc(Cl)c2)n1 ZINC001204067964 1049076797 /nfs/dbraw/zinc/07/67/97/1049076797.db2.gz OKCWZDPLKCHKPI-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cccc(C[N@H+]2CCSC[C@@H]2c2cccc(Cl)c2)n1 ZINC001204067964 1049076811 /nfs/dbraw/zinc/07/68/11/1049076811.db2.gz OKCWZDPLKCHKPI-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CCc3ccc(Cl)s3)cc2[nH+]1 ZINC000338987800 1049080295 /nfs/dbraw/zinc/08/02/95/1049080295.db2.gz XVUIFIOTYSXQAJ-UHFFFAOYSA-N 1 2 319.817 4.158 20 0 DIADLO COC(=O)c1occc1C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000338990089 1049082931 /nfs/dbraw/zinc/08/29/31/1049082931.db2.gz KFNWZLIWUBEJJS-OAHLLOKOSA-N 1 2 319.788 4.057 20 0 DIADLO COC(=O)c1occc1C[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000338990089 1049082943 /nfs/dbraw/zinc/08/29/43/1049082943.db2.gz KFNWZLIWUBEJJS-OAHLLOKOSA-N 1 2 319.788 4.057 20 0 DIADLO CCOc1cc(C[N@@H+]2CCc3cc(Cl)ccc3C2)ccc1O ZINC001204133580 1049089722 /nfs/dbraw/zinc/08/97/22/1049089722.db2.gz WXUWYXNVQSZCND-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1cc(C[N@H+]2CCc3cc(Cl)ccc3C2)ccc1O ZINC001204133580 1049089737 /nfs/dbraw/zinc/08/97/37/1049089737.db2.gz WXUWYXNVQSZCND-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1cc(C[N@@H+]2CC[C@H]2c2ccccc2)c(F)cc1OC ZINC001204143953 1049092892 /nfs/dbraw/zinc/09/28/92/1049092892.db2.gz CMECYXJOHUNNHM-KRWDZBQOSA-N 1 2 315.388 4.180 20 0 DIADLO CCOc1cc(C[N@H+]2CC[C@H]2c2ccccc2)c(F)cc1OC ZINC001204143953 1049092906 /nfs/dbraw/zinc/09/29/06/1049092906.db2.gz CMECYXJOHUNNHM-KRWDZBQOSA-N 1 2 315.388 4.180 20 0 DIADLO CCOc1cc(C[N@@H+]2CC[C@@H]2c2ccccc2)c(F)cc1OC ZINC001204143966 1049094061 /nfs/dbraw/zinc/09/40/61/1049094061.db2.gz CMECYXJOHUNNHM-QGZVFWFLSA-N 1 2 315.388 4.180 20 0 DIADLO CCOc1cc(C[N@H+]2CC[C@@H]2c2ccccc2)c(F)cc1OC ZINC001204143966 1049094076 /nfs/dbraw/zinc/09/40/76/1049094076.db2.gz CMECYXJOHUNNHM-QGZVFWFLSA-N 1 2 315.388 4.180 20 0 DIADLO c1ccc(-c2ccc(C[NH+]3CC(Oc4cccnc4)C3)cc2)cc1 ZINC001204135970 1049094687 /nfs/dbraw/zinc/09/46/87/1049094687.db2.gz QEISFZWDVWPSNX-UHFFFAOYSA-N 1 2 316.404 4.012 20 0 DIADLO Cc1[nH+]c(NCc2ccc(Cl)s2)ccc1-c1cnn(C)c1 ZINC001178777624 1049095155 /nfs/dbraw/zinc/09/51/55/1049095155.db2.gz CMNGFGWOVQQDTD-UHFFFAOYSA-N 1 2 318.833 4.118 20 0 DIADLO CC(C)c1ccc(C[N@@H+]2CCc3ncc(Cl)cc3C2)cc1 ZINC001204168134 1049102445 /nfs/dbraw/zinc/10/24/45/1049102445.db2.gz ILRKHNOBZZSJDF-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc(C[N@H+]2CCc3ncc(Cl)cc3C2)cc1 ZINC001204168134 1049102447 /nfs/dbraw/zinc/10/24/47/1049102447.db2.gz ILRKHNOBZZSJDF-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO FC1(F)CCC[C@@H]1[NH2+]Cc1cc2nc(Cl)ccc2s1 ZINC001178859637 1049104157 /nfs/dbraw/zinc/10/41/57/1049104157.db2.gz CNXFYCKAPLDJFR-NSHDSACASA-N 1 2 302.777 4.227 20 0 DIADLO ClC(Cl)=CC[N@@H+]1CC[C@@H](Oc2ccccc2Cl)C1 ZINC001192443368 1049105663 /nfs/dbraw/zinc/10/56/63/1049105663.db2.gz MQLVXXASFDLQML-SNVBAGLBSA-N 1 2 306.620 4.112 20 0 DIADLO ClC(Cl)=CC[N@H+]1CC[C@@H](Oc2ccccc2Cl)C1 ZINC001192443368 1049105668 /nfs/dbraw/zinc/10/56/68/1049105668.db2.gz MQLVXXASFDLQML-SNVBAGLBSA-N 1 2 306.620 4.112 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2ncc(C(C)C)o2)c1C ZINC000776897097 1049109964 /nfs/dbraw/zinc/10/99/64/1049109964.db2.gz SJIWSZHTTIBTET-UHFFFAOYSA-N 1 2 306.431 4.252 20 0 DIADLO Fc1cc(F)cc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC001204234690 1049115605 /nfs/dbraw/zinc/11/56/05/1049115605.db2.gz VKMZMRDJGUPZEJ-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1cc(F)cc(C[N@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC001204234690 1049115610 /nfs/dbraw/zinc/11/56/10/1049115610.db2.gz VKMZMRDJGUPZEJ-KRWDZBQOSA-N 1 2 305.393 4.255 20 0 DIADLO OCc1cc[nH+]c(NCc2ccc3oc4ccccc4c3c2)c1 ZINC001178992310 1049119382 /nfs/dbraw/zinc/11/93/82/1049119382.db2.gz NICGLVLNWKXOSE-UHFFFAOYSA-N 1 2 304.349 4.085 20 0 DIADLO C/C(=C/c1ccccc1)CNc1ccc([NH+]2CCC(O)CC2)cc1 ZINC000114762756 1049119543 /nfs/dbraw/zinc/11/95/43/1049119543.db2.gz KXJSKPTVZZMFSY-ICFOKQHNSA-N 1 2 322.452 4.163 20 0 DIADLO Fc1ccc2[nH]ccc2c1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001204255425 1049123499 /nfs/dbraw/zinc/12/34/99/1049123499.db2.gz CJEVZOHBUXJALW-UHFFFAOYSA-N 1 2 310.376 4.436 20 0 DIADLO c1cn(-c2ccc(-c3nc(C4CCCCCC4)no3)cc2)c[nH+]1 ZINC000904679237 1049124416 /nfs/dbraw/zinc/12/44/16/1049124416.db2.gz HMCRHTAIYGLNGJ-UHFFFAOYSA-N 1 2 308.385 4.360 20 0 DIADLO CC[N@@H+](Cc1ccsc1Cl)C[C@@H]1COc2ccccc2O1 ZINC001204269939 1049126082 /nfs/dbraw/zinc/12/60/82/1049126082.db2.gz GUGJQNPFHJTIMU-CYBMUJFWSA-N 1 2 323.845 4.063 20 0 DIADLO CC[N@H+](Cc1ccsc1Cl)C[C@@H]1COc2ccccc2O1 ZINC001204269939 1049126087 /nfs/dbraw/zinc/12/60/87/1049126087.db2.gz GUGJQNPFHJTIMU-CYBMUJFWSA-N 1 2 323.845 4.063 20 0 DIADLO CCCCCCOc1ccccc1C[N@@H+]1CCOC2(CC2)C1 ZINC001204294994 1049131638 /nfs/dbraw/zinc/13/16/38/1049131638.db2.gz XZHBFWCNCZCMJI-UHFFFAOYSA-N 1 2 303.446 4.011 20 0 DIADLO CCCCCCOc1ccccc1C[N@H+]1CCOC2(CC2)C1 ZINC001204294994 1049131643 /nfs/dbraw/zinc/13/16/43/1049131643.db2.gz XZHBFWCNCZCMJI-UHFFFAOYSA-N 1 2 303.446 4.011 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H](C)c2cccc(N3CCCC3)c2)o1 ZINC000775550220 1049140101 /nfs/dbraw/zinc/14/01/01/1049140101.db2.gz VTYRNXYRLYHMLQ-OAHLLOKOSA-N 1 2 313.445 4.249 20 0 DIADLO c1cc(CNc2ccc(Nc3ccccc3)c[nH+]2)n(C2CCC2)n1 ZINC001179205180 1049141628 /nfs/dbraw/zinc/14/16/28/1049141628.db2.gz LAWLHZDNFPOFDX-UHFFFAOYSA-N 1 2 319.412 4.359 20 0 DIADLO CCCCCCOc1ccc(C[NH+]2CC3(C2)CCCO3)cc1 ZINC001204365730 1049151129 /nfs/dbraw/zinc/15/11/29/1049151129.db2.gz WGCIZVAANQRYGB-UHFFFAOYSA-N 1 2 303.446 4.011 20 0 DIADLO CCCCCCOc1ccc(C[N@@H+]2CCC(=O)C[C@H]2C)cc1 ZINC001204365122 1049151174 /nfs/dbraw/zinc/15/11/74/1049151174.db2.gz OFGSZXAOIHNUNK-MRXNPFEDSA-N 1 2 303.446 4.199 20 0 DIADLO CCCCCCOc1ccc(C[N@H+]2CCC(=O)C[C@H]2C)cc1 ZINC001204365122 1049151181 /nfs/dbraw/zinc/15/11/81/1049151181.db2.gz OFGSZXAOIHNUNK-MRXNPFEDSA-N 1 2 303.446 4.199 20 0 DIADLO CCCSc1cccc(NCc2c[nH+]c3ccc(C)cn23)n1 ZINC001179327998 1049157223 /nfs/dbraw/zinc/15/72/23/1049157223.db2.gz HOKLKEVUEMIYKY-UHFFFAOYSA-N 1 2 312.442 4.152 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1ccc(OC)cc1F ZINC001179432542 1049163793 /nfs/dbraw/zinc/16/37/93/1049163793.db2.gz FOFFBZCZVBSXKO-UHFFFAOYSA-N 1 2 306.406 4.095 20 0 DIADLO CC(C)n1c(CNc2[nH+]c3ccccc3n2C)nc2ccccc21 ZINC001179443858 1049166019 /nfs/dbraw/zinc/16/60/19/1049166019.db2.gz WCKATSAJBBDRRP-UHFFFAOYSA-N 1 2 319.412 4.116 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(F)cccc2C(F)(F)F)CCC1(F)F ZINC001204456484 1049166154 /nfs/dbraw/zinc/16/61/54/1049166154.db2.gz KDGTWOOXUYYSBU-SECBINFHSA-N 1 2 311.269 4.322 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(F)cccc2C(F)(F)F)CCC1(F)F ZINC001204456484 1049166165 /nfs/dbraw/zinc/16/61/65/1049166165.db2.gz KDGTWOOXUYYSBU-SECBINFHSA-N 1 2 311.269 4.322 20 0 DIADLO Cc1nc(N2CCCCC2)sc1CNc1c[nH+]c(C)c(C)c1 ZINC001179453875 1049168642 /nfs/dbraw/zinc/16/86/42/1049168642.db2.gz QXCCCGWNCASBFD-UHFFFAOYSA-N 1 2 316.474 4.066 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1cc(C(F)(F)F)ccc1F ZINC001204474125 1049170120 /nfs/dbraw/zinc/17/01/20/1049170120.db2.gz KUYMCDMGVGNPGE-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1cc(C(F)(F)F)ccc1F ZINC001204474125 1049170129 /nfs/dbraw/zinc/17/01/29/1049170129.db2.gz KUYMCDMGVGNPGE-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[C@H]1C[C@H](CNc2[nH+]c3cc(Cl)ccc3n2CC)CCO1 ZINC001179484071 1049170193 /nfs/dbraw/zinc/17/01/93/1049170193.db2.gz AQAQCQKNZZPDAN-OCCSQVGLSA-N 1 2 321.852 4.327 20 0 DIADLO Cc1cc(CNc2[nH]c3ccc(Br)cc3[nH+]2)cs1 ZINC001179484045 1049170762 /nfs/dbraw/zinc/17/07/62/1049170762.db2.gz AECSAPFLRFUWLQ-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO Cc1cc(CNc2[nH]c3cc(Br)ccc3[nH+]2)cs1 ZINC001179484045 1049170764 /nfs/dbraw/zinc/17/07/64/1049170764.db2.gz AECSAPFLRFUWLQ-UHFFFAOYSA-N 1 2 322.231 4.307 20 0 DIADLO COc1cc(C)ccc1CNc1[nH]c2ccc(Cl)cc2[nH+]1 ZINC001179516053 1049172901 /nfs/dbraw/zinc/17/29/01/1049172901.db2.gz PWDHEMRRWPOBQL-UHFFFAOYSA-N 1 2 301.777 4.145 20 0 DIADLO Clc1n[nH]c(C2CC2)c1CNc1[nH]c2ccc(Cl)cc2[nH+]1 ZINC001179516235 1049172946 /nfs/dbraw/zinc/17/29/46/1049172946.db2.gz VHSLMMXHSQQPLE-UHFFFAOYSA-N 1 2 322.199 4.082 20 0 DIADLO Cc1ccc([N@H+](C)CC2CCN(C(=O)C(C)(C)C)CC2)cc1C ZINC000775571178 1049179768 /nfs/dbraw/zinc/17/97/68/1049179768.db2.gz BQXUGSIMTLRLJY-UHFFFAOYSA-N 1 2 316.489 4.024 20 0 DIADLO Cc1ccc([N@@H+](C)CC2CCN(C(=O)C(C)(C)C)CC2)cc1C ZINC000775571178 1049179776 /nfs/dbraw/zinc/17/97/76/1049179776.db2.gz BQXUGSIMTLRLJY-UHFFFAOYSA-N 1 2 316.489 4.024 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1cc(F)c(F)c(F)c1 ZINC001204529603 1049182681 /nfs/dbraw/zinc/18/26/81/1049182681.db2.gz JZTGPGQMUFKYDQ-UHFFFAOYSA-N 1 2 321.342 4.197 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1cc(F)c(F)c(F)c1 ZINC001204529603 1049182684 /nfs/dbraw/zinc/18/26/84/1049182684.db2.gz JZTGPGQMUFKYDQ-UHFFFAOYSA-N 1 2 321.342 4.197 20 0 DIADLO Cc1occc1C[N@@H+]1CCCC[C@H]1c1nc(-c2ccccc2)no1 ZINC001204534714 1049184876 /nfs/dbraw/zinc/18/48/76/1049184876.db2.gz WBJGVMYFLMXNDH-KRWDZBQOSA-N 1 2 323.396 4.365 20 0 DIADLO Cc1occc1C[N@H+]1CCCC[C@H]1c1nc(-c2ccccc2)no1 ZINC001204534714 1049184880 /nfs/dbraw/zinc/18/48/80/1049184880.db2.gz WBJGVMYFLMXNDH-KRWDZBQOSA-N 1 2 323.396 4.365 20 0 DIADLO Cc1occc1C[N@@H+]1CCCC[C@@H]1c1nc(-c2ccccc2)no1 ZINC001204534715 1049185950 /nfs/dbraw/zinc/18/59/50/1049185950.db2.gz WBJGVMYFLMXNDH-QGZVFWFLSA-N 1 2 323.396 4.365 20 0 DIADLO Cc1occc1C[N@H+]1CCCC[C@@H]1c1nc(-c2ccccc2)no1 ZINC001204534715 1049185957 /nfs/dbraw/zinc/18/59/57/1049185957.db2.gz WBJGVMYFLMXNDH-QGZVFWFLSA-N 1 2 323.396 4.365 20 0 DIADLO Fc1cc(Br)cc([C@H]2CCC[N@@H+]2C/C=C/Cl)c1 ZINC001193189171 1049190370 /nfs/dbraw/zinc/19/03/70/1049190370.db2.gz XARZUIRZVNYCEC-CXLRFSCWSA-N 1 2 318.617 4.478 20 0 DIADLO Fc1cc(Br)cc([C@H]2CCC[N@H+]2C/C=C/Cl)c1 ZINC001193189171 1049190377 /nfs/dbraw/zinc/19/03/77/1049190377.db2.gz XARZUIRZVNYCEC-CXLRFSCWSA-N 1 2 318.617 4.478 20 0 DIADLO COCc1ccc(CNc2[nH+]c3ccccc3n2CC2CC2)cc1 ZINC001179631132 1049191313 /nfs/dbraw/zinc/19/13/13/1049191313.db2.gz ITVYSZCSQNQNPD-UHFFFAOYSA-N 1 2 321.424 4.205 20 0 DIADLO OCC[N@H+](Cc1cccs1)Cc1cc(Cl)ccc1Cl ZINC001204567283 1049192184 /nfs/dbraw/zinc/19/21/84/1049192184.db2.gz QUKUEEBOINIQKT-UHFFFAOYSA-N 1 2 316.253 4.049 20 0 DIADLO OCC[N@@H+](Cc1cccs1)Cc1cc(Cl)ccc1Cl ZINC001204567283 1049192197 /nfs/dbraw/zinc/19/21/97/1049192197.db2.gz QUKUEEBOINIQKT-UHFFFAOYSA-N 1 2 316.253 4.049 20 0 DIADLO CC[C@]1(C)C[N@@H+]([C@@H](C)c2cccc(Br)c2)CCO1 ZINC001193474339 1049214371 /nfs/dbraw/zinc/21/43/71/1049214371.db2.gz WMFJKOAIWJSNCM-SWLSCSKDSA-N 1 2 312.251 4.011 20 0 DIADLO CC[C@]1(C)C[N@H+]([C@@H](C)c2cccc(Br)c2)CCO1 ZINC001193474339 1049214375 /nfs/dbraw/zinc/21/43/75/1049214375.db2.gz WMFJKOAIWJSNCM-SWLSCSKDSA-N 1 2 312.251 4.011 20 0 DIADLO FC(F)C[N@@H+](Cc1ccccc1)C[C@H]1CCOc2ccccc21 ZINC001204581177 1049194881 /nfs/dbraw/zinc/19/48/81/1049194881.db2.gz SOMAUOHFQWUDSJ-MRXNPFEDSA-N 1 2 317.379 4.320 20 0 DIADLO FC(F)C[N@H+](Cc1ccccc1)C[C@H]1CCOc2ccccc21 ZINC001204581177 1049194883 /nfs/dbraw/zinc/19/48/83/1049194883.db2.gz SOMAUOHFQWUDSJ-MRXNPFEDSA-N 1 2 317.379 4.320 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cc(C(F)(F)F)co1 ZINC001193293646 1049196274 /nfs/dbraw/zinc/19/62/74/1049196274.db2.gz OVOPALBDBAUKNK-BDAKNGLRSA-N 1 2 315.257 4.461 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cc(C(F)(F)F)co1 ZINC001193293646 1049196278 /nfs/dbraw/zinc/19/62/78/1049196278.db2.gz OVOPALBDBAUKNK-BDAKNGLRSA-N 1 2 315.257 4.461 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1noc3c1CC(C)(C)CC3)CC2 ZINC001193354916 1049200489 /nfs/dbraw/zinc/20/04/89/1049200489.db2.gz JMEWNLGGBUQSIY-UHFFFAOYSA-N 1 2 310.441 4.056 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1noc3c1CC(C)(C)CC3)CC2 ZINC001193354916 1049200502 /nfs/dbraw/zinc/20/05/02/1049200502.db2.gz JMEWNLGGBUQSIY-UHFFFAOYSA-N 1 2 310.441 4.056 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1csc(Br)c1)CC2 ZINC001193355619 1049200850 /nfs/dbraw/zinc/20/08/50/1049200850.db2.gz WJTPJYDFYQOXBU-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1csc(Br)c1)CC2 ZINC001193355619 1049200860 /nfs/dbraw/zinc/20/08/60/1049200860.db2.gz WJTPJYDFYQOXBU-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO COCOc1cc(C)c(-c2ccc(-c3c[nH+]cn3C)cc2)c(C)c1 ZINC001204612683 1049201654 /nfs/dbraw/zinc/20/16/54/1049201654.db2.gz RNKKGRNHLRSSJM-UHFFFAOYSA-N 1 2 322.408 4.354 20 0 DIADLO CC(C)[C@H]1CCC[C@@H](NC(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC001204648836 1049210763 /nfs/dbraw/zinc/21/07/63/1049210763.db2.gz MSFBBEIJXBIUJW-LSDHHAIUSA-N 1 2 314.433 4.061 20 0 DIADLO CCCCCC[C@@](C)(CCC)C(=O)N[C@H]1CCn2c[nH+]cc21 ZINC000857982864 1049213097 /nfs/dbraw/zinc/21/30/97/1049213097.db2.gz NEIVSMQMNSYAOR-MAUKXSAKSA-N 1 2 305.466 4.221 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](CCCC3CCC3)CCO2)c(Cl)c1 ZINC001193544689 1049219439 /nfs/dbraw/zinc/21/94/39/1049219439.db2.gz ASIQTJJBNDIWDX-KRWDZBQOSA-N 1 2 311.828 4.433 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](CCCC3CCC3)CCO2)c(Cl)c1 ZINC001193544689 1049219448 /nfs/dbraw/zinc/21/94/48/1049219448.db2.gz ASIQTJJBNDIWDX-KRWDZBQOSA-N 1 2 311.828 4.433 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1Cl ZINC000195444844 1049232753 /nfs/dbraw/zinc/23/27/53/1049232753.db2.gz FGORGMFZMIOPTR-LLVKDONJSA-N 1 2 307.825 4.180 20 0 DIADLO CCCn1c[nH+]cc1CN(C)Cc1ccc(Cl)cc1Cl ZINC001179913902 1049237689 /nfs/dbraw/zinc/23/76/89/1049237689.db2.gz MIGAGZDODLBGSM-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO CC[N@H+](Cc1ccccc1Cl)Cc1c(OC)cccc1OC ZINC001179909492 1049239124 /nfs/dbraw/zinc/23/91/24/1049239124.db2.gz NPMNGSAPXTYMOE-UHFFFAOYSA-N 1 2 319.832 4.379 20 0 DIADLO CC[N@@H+](Cc1ccccc1Cl)Cc1c(OC)cccc1OC ZINC001179909492 1049239137 /nfs/dbraw/zinc/23/91/37/1049239137.db2.gz NPMNGSAPXTYMOE-UHFFFAOYSA-N 1 2 319.832 4.379 20 0 DIADLO C[N@H+](Cc1ccc(-c2cccc(Cl)c2)o1)Cc1ccncn1 ZINC001204718173 1049240731 /nfs/dbraw/zinc/24/07/31/1049240731.db2.gz WTRDCORZCKZUEU-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1ccc(-c2cccc(Cl)c2)o1)Cc1ccncn1 ZINC001204718173 1049240732 /nfs/dbraw/zinc/24/07/32/1049240732.db2.gz WTRDCORZCKZUEU-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@H+](Cc1ccn(-c2ccccc2)n1)Cc1cccc(C2CC2)c1 ZINC001204728255 1049242731 /nfs/dbraw/zinc/24/27/31/1049242731.db2.gz AZPLKZVBDFMJOP-UHFFFAOYSA-N 1 2 317.436 4.382 20 0 DIADLO C[N@@H+](Cc1ccn(-c2ccccc2)n1)Cc1cccc(C2CC2)c1 ZINC001204728255 1049242742 /nfs/dbraw/zinc/24/27/42/1049242742.db2.gz AZPLKZVBDFMJOP-UHFFFAOYSA-N 1 2 317.436 4.382 20 0 DIADLO CCc1cccc(F)c1C[N@@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC001204737166 1049246318 /nfs/dbraw/zinc/24/63/18/1049246318.db2.gz UPEKJAVQHLBIAQ-QGZVFWFLSA-N 1 2 317.404 4.162 20 0 DIADLO CCc1cccc(F)c1C[N@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC001204737166 1049246325 /nfs/dbraw/zinc/24/63/25/1049246325.db2.gz UPEKJAVQHLBIAQ-QGZVFWFLSA-N 1 2 317.404 4.162 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2cc(F)ncc2F)o1 ZINC001179955945 1049248186 /nfs/dbraw/zinc/24/81/86/1049248186.db2.gz BWNCCIYGWQGTBO-NHYWBVRUSA-N 1 2 306.356 4.234 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2cc(F)ncc2F)o1 ZINC001179955945 1049248199 /nfs/dbraw/zinc/24/81/99/1049248199.db2.gz BWNCCIYGWQGTBO-NHYWBVRUSA-N 1 2 306.356 4.234 20 0 DIADLO Cc1ccc(C2=CC[N@@H+](Cc3c(F)ccc(O)c3F)CC2)cc1 ZINC001204744483 1049248217 /nfs/dbraw/zinc/24/82/17/1049248217.db2.gz TZVKFIIWBSEUCL-UHFFFAOYSA-N 1 2 315.363 4.268 20 0 DIADLO CC(C)OC1C[NH+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC001204745684 1049250903 /nfs/dbraw/zinc/25/09/03/1049250903.db2.gz HWCRFWKOAVAGHR-UHFFFAOYSA-N 1 2 305.805 4.209 20 0 DIADLO Clc1csc(C[N@H+](C2CC2)[C@H]2CCc3ccccc32)n1 ZINC001179965881 1049251685 /nfs/dbraw/zinc/25/16/85/1049251685.db2.gz BOCAIUSADHKILG-AWEZNQCLSA-N 1 2 304.846 4.448 20 0 DIADLO Clc1csc(C[N@@H+](C2CC2)[C@H]2CCc3ccccc32)n1 ZINC001179965881 1049251693 /nfs/dbraw/zinc/25/16/93/1049251693.db2.gz BOCAIUSADHKILG-AWEZNQCLSA-N 1 2 304.846 4.448 20 0 DIADLO CC[C@H](C)[C@H]([NH2+][C@@H]1CC(C)(C)CCc2ccccc21)C(=O)OC ZINC001193743840 1049252222 /nfs/dbraw/zinc/25/22/22/1049252222.db2.gz VNZYWIIBLOINMY-QGTPRVQTSA-N 1 2 317.473 4.268 20 0 DIADLO CO[C@]1(C)C[C@H]([N@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001179962130 1049252165 /nfs/dbraw/zinc/25/21/65/1049252165.db2.gz LHQVTOBRLAFDBI-SWLSCSKDSA-N 1 2 317.260 4.024 20 0 DIADLO CO[C@]1(C)C[C@H]([N@@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001179962130 1049252171 /nfs/dbraw/zinc/25/21/71/1049252171.db2.gz LHQVTOBRLAFDBI-SWLSCSKDSA-N 1 2 317.260 4.024 20 0 DIADLO Clc1cccc2c1CC[C@H]2[N@@H+]1CCC=C(Br)C1 ZINC001193819646 1049269453 /nfs/dbraw/zinc/26/94/53/1049269453.db2.gz NNKHRESATRBWFM-CQSZACIVSA-N 1 2 312.638 4.312 20 0 DIADLO Clc1cccc2c1CC[C@H]2[N@H+]1CCC=C(Br)C1 ZINC001193819646 1049269470 /nfs/dbraw/zinc/26/94/70/1049269470.db2.gz NNKHRESATRBWFM-CQSZACIVSA-N 1 2 312.638 4.312 20 0 DIADLO CCCOc1ccc(-c2ccn3cc(N)[nH+]c3c2)cc1Cl ZINC001204786187 1049262692 /nfs/dbraw/zinc/26/26/92/1049262692.db2.gz PTZIUHALGKWEIX-UHFFFAOYSA-N 1 2 301.777 4.026 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2ccc(F)cc2F)C1 ZINC001193796532 1049264400 /nfs/dbraw/zinc/26/44/00/1049264400.db2.gz GYTQXBBWTLOCDU-GOSISDBHSA-N 1 2 305.343 4.344 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2ccc(F)cc2F)C1 ZINC001193796532 1049264413 /nfs/dbraw/zinc/26/44/13/1049264413.db2.gz GYTQXBBWTLOCDU-GOSISDBHSA-N 1 2 305.343 4.344 20 0 DIADLO CC[N@H+](Cc1c(Cl)n[nH]c1C1CC1)[C@H](C)c1cccc(O)c1 ZINC001204827329 1049278773 /nfs/dbraw/zinc/27/87/73/1049278773.db2.gz SNKQEMMORCEXEE-LLVKDONJSA-N 1 2 319.836 4.229 20 0 DIADLO CC[N@@H+](Cc1c(Cl)n[nH]c1C1CC1)[C@H](C)c1cccc(O)c1 ZINC001204827329 1049278781 /nfs/dbraw/zinc/27/87/81/1049278781.db2.gz SNKQEMMORCEXEE-LLVKDONJSA-N 1 2 319.836 4.229 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1nc(C(F)(F)F)cs1)c1ccns1 ZINC000858578703 1049281283 /nfs/dbraw/zinc/28/12/83/1049281283.db2.gz XQDARBMYPRXJFV-BQBZGAKWSA-N 1 2 307.366 4.030 20 0 DIADLO Clc1ccc2c(c1)[C@H]([NH2+][C@H]1CCCc3[nH]ncc31)CCC2 ZINC000858601548 1049282712 /nfs/dbraw/zinc/28/27/12/1049282712.db2.gz WRAKQLVROLPOMX-CVEARBPZSA-N 1 2 301.821 4.108 20 0 DIADLO CCCCC[N@H+](Cn1nc(-c2ccco2)n(C)c1=S)C(C)C ZINC000116256251 1049287376 /nfs/dbraw/zinc/28/73/76/1049287376.db2.gz NQYGJPOKAUCKML-UHFFFAOYSA-N 1 2 322.478 4.069 20 0 DIADLO CCCCC[N@@H+](Cn1nc(-c2ccco2)n(C)c1=S)C(C)C ZINC000116256251 1049287387 /nfs/dbraw/zinc/28/73/87/1049287387.db2.gz NQYGJPOKAUCKML-UHFFFAOYSA-N 1 2 322.478 4.069 20 0 DIADLO C[N@H+](Cc1ccc(O)c(F)c1)Cc1cccc(Cl)c1Cl ZINC001180107659 1049288978 /nfs/dbraw/zinc/28/89/78/1049288978.db2.gz IEUVXSKEHWGUCD-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO C[N@@H+](Cc1ccc(O)c(F)c1)Cc1cccc(Cl)c1Cl ZINC001180107659 1049288993 /nfs/dbraw/zinc/28/89/93/1049288993.db2.gz IEUVXSKEHWGUCD-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO CCCC[C@H](CC)COC(=O)NCc1c[nH+]c2c(C)cccn12 ZINC001193976054 1049289364 /nfs/dbraw/zinc/28/93/64/1049289364.db2.gz KPUGLHPRXLSOBD-HNNXBMFYSA-N 1 2 317.433 4.085 20 0 DIADLO CC(C)CCC1CC[NH+](Cc2cc(C(F)(F)F)n[nH]2)CC1 ZINC001180117414 1049290859 /nfs/dbraw/zinc/29/08/59/1049290859.db2.gz WLWWJDRJWYIYFB-UHFFFAOYSA-N 1 2 303.372 4.077 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1cc(Cl)n(C)n1 ZINC000859052082 1049307805 /nfs/dbraw/zinc/30/78/05/1049307805.db2.gz UFJBOBADGXSKPJ-NSHDSACASA-N 1 2 303.793 4.013 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1cc(Cl)n(C)n1 ZINC000859052082 1049307817 /nfs/dbraw/zinc/30/78/17/1049307817.db2.gz UFJBOBADGXSKPJ-NSHDSACASA-N 1 2 303.793 4.013 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2ccc(F)c(C(F)(F)F)c2)[C@H]1C ZINC001180199059 1049316321 /nfs/dbraw/zinc/31/63/21/1049316321.db2.gz OSHFLXMWDRSJEB-UWVGGRQHSA-N 1 2 307.356 4.170 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2ccc(F)c(C(F)(F)F)c2)[C@H]1C ZINC001180199059 1049316331 /nfs/dbraw/zinc/31/63/31/1049316331.db2.gz OSHFLXMWDRSJEB-UWVGGRQHSA-N 1 2 307.356 4.170 20 0 DIADLO Cc1cc(Nc2ccn3cc[nH+]c3c2)n(-c2ccc(Cl)cc2)n1 ZINC001204965402 1049323513 /nfs/dbraw/zinc/32/35/13/1049323513.db2.gz AVZXSQGFCNFMIH-UHFFFAOYSA-N 1 2 323.787 4.225 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+]Cc2cc(F)cc(Cl)c2)o1 ZINC000485724606 1049325699 /nfs/dbraw/zinc/32/56/99/1049325699.db2.gz ZLYSKVWTWGKYAH-OAHLLOKOSA-N 1 2 311.784 4.112 20 0 DIADLO Clc1ccc(-c2cc(Nc3ccn4cc[nH+]c4c3)no2)s1 ZINC001204971736 1049326263 /nfs/dbraw/zinc/32/62/63/1049326263.db2.gz ODUBNOVRSDSKNZ-UHFFFAOYSA-N 1 2 316.773 4.448 20 0 DIADLO O=C(c1ccccc1)c1cccc(Nc2ccn3cc[nH+]c3c2)c1 ZINC001204977627 1049327845 /nfs/dbraw/zinc/32/78/45/1049327845.db2.gz HUNMINKXVPLPNP-UHFFFAOYSA-N 1 2 313.360 4.309 20 0 DIADLO Fc1ccc(OC(F)(F)F)c(Nc2ccn3cc[nH+]c3c2)c1 ZINC001204982724 1049330254 /nfs/dbraw/zinc/33/02/54/1049330254.db2.gz GUBMCBYXXXUZJJ-UHFFFAOYSA-N 1 2 311.238 4.116 20 0 DIADLO Nc1ccc(-c2ccc(Nc3ccn4cc[nH+]c4c3)cc2)cc1 ZINC001204978541 1049330526 /nfs/dbraw/zinc/33/05/26/1049330526.db2.gz UVAUMHLRIWRJRZ-UHFFFAOYSA-N 1 2 300.365 4.327 20 0 DIADLO Fc1cc(OC(F)(F)F)ccc1Nc1ccn2cc[nH+]c2c1 ZINC001204983636 1049331388 /nfs/dbraw/zinc/33/13/88/1049331388.db2.gz XZMSLJYNRZKWOU-UHFFFAOYSA-N 1 2 311.238 4.116 20 0 DIADLO Fc1c(Nc2ccn3cc[nH+]c3c2)cccc1OC(F)(F)F ZINC001204990808 1049332534 /nfs/dbraw/zinc/33/25/34/1049332534.db2.gz GJOOHWADBWINIU-UHFFFAOYSA-N 1 2 311.238 4.116 20 0 DIADLO CC(C)([NH2+]Cc1cccc(Cl)n1)c1nc2ccccc2s1 ZINC000859468361 1049334421 /nfs/dbraw/zinc/33/44/21/1049334421.db2.gz PELZEEHVWTUPCG-UHFFFAOYSA-N 1 2 317.845 4.370 20 0 DIADLO CC(=O)c1cc(Cl)c(F)cc1Nc1ccn2cc[nH+]c2c1 ZINC001204997377 1049336172 /nfs/dbraw/zinc/33/61/72/1049336172.db2.gz JFIPLRMINZPCHD-UHFFFAOYSA-N 1 2 303.724 4.073 20 0 DIADLO Nc1cccc(Oc2cccc(Nc3ccn4cc[nH+]c4c3)c2)c1 ZINC001204997692 1049336223 /nfs/dbraw/zinc/33/62/23/1049336223.db2.gz OBXZEYFXBWUZFD-UHFFFAOYSA-N 1 2 316.364 4.452 20 0 DIADLO Clc1ccc(Cl)c(C[NH2+][C@@H](c2ccccn2)C2CCC2)n1 ZINC000859564788 1049338954 /nfs/dbraw/zinc/33/89/54/1049338954.db2.gz ONNSXFLSLXRLOH-MRXNPFEDSA-N 1 2 322.239 4.414 20 0 DIADLO CCSc1ccccc1C[C@H](C)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC001180350357 1049342989 /nfs/dbraw/zinc/34/29/89/1049342989.db2.gz ZDJPOGYBEQLHPK-KBPBESRZSA-N 1 2 323.502 4.049 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(C(C)(C)CC)cc2)C[C@@H](C)[S@]1=O ZINC001194239655 1049347481 /nfs/dbraw/zinc/34/74/81/1049347481.db2.gz FFHXIAZBNLLDDG-YBOAYWMSSA-N 1 2 321.530 4.106 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(C(C)(C)CC)cc2)C[C@@H](C)[S@]1=O ZINC001194239655 1049347492 /nfs/dbraw/zinc/34/74/92/1049347492.db2.gz FFHXIAZBNLLDDG-YBOAYWMSSA-N 1 2 321.530 4.106 20 0 DIADLO CCCn1cncc1C[N@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC001180403472 1049352451 /nfs/dbraw/zinc/35/24/51/1049352451.db2.gz LCNBBPZAWCZSIA-KDOFPFPSSA-N 1 2 313.445 4.174 20 0 DIADLO CCCn1cncc1C[N@@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC001180403472 1049352459 /nfs/dbraw/zinc/35/24/59/1049352459.db2.gz LCNBBPZAWCZSIA-KDOFPFPSSA-N 1 2 313.445 4.174 20 0 DIADLO CC(=O)C1CC[NH+](Cc2cccc(C(F)(F)F)c2Cl)CC1 ZINC001205049218 1049353912 /nfs/dbraw/zinc/35/39/12/1049353912.db2.gz CVCMEWFBNLTCPV-UHFFFAOYSA-N 1 2 319.754 4.160 20 0 DIADLO C[C@@H]1CCC[C@@H](c2nc(-c3ccccc3-n3cc[nH+]c3)no2)C1 ZINC001205075384 1049364624 /nfs/dbraw/zinc/36/46/24/1049364624.db2.gz OCMWBMIHSLYZTH-ZIAGYGMSSA-N 1 2 308.385 4.216 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[NH2+][C@@H](C)c1ccns1 ZINC000860053525 1049366250 /nfs/dbraw/zinc/36/62/50/1049366250.db2.gz DPVGQEJOJVQTDC-VIFPVBQESA-N 1 2 305.428 4.019 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1ccns1 ZINC000860053168 1049366280 /nfs/dbraw/zinc/36/62/80/1049366280.db2.gz RLOWKSBYPCVKQT-LLVKDONJSA-N 1 2 307.488 4.498 20 0 DIADLO C[C@H]1CCC[C@@H](c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)C1 ZINC001205076619 1049366666 /nfs/dbraw/zinc/36/66/66/1049366666.db2.gz XTZGQRULYOREHC-DZGCQCFKSA-N 1 2 308.385 4.216 20 0 DIADLO c1csc([C@@H]2c3ccsc3CC[N@H+]2Cc2ccns2)c1 ZINC001180586728 1049385738 /nfs/dbraw/zinc/38/57/38/1049385738.db2.gz WWYNZXDCTFHVGP-HNNXBMFYSA-N 1 2 318.492 4.414 20 0 DIADLO c1csc([C@@H]2c3ccsc3CC[N@@H+]2Cc2ccns2)c1 ZINC001180586728 1049385751 /nfs/dbraw/zinc/38/57/51/1049385751.db2.gz WWYNZXDCTFHVGP-HNNXBMFYSA-N 1 2 318.492 4.414 20 0 DIADLO C[N@@H+](Cc1c(F)cccc1F)C[C@@H]1CC[C@@H](c2ccccc2)O1 ZINC001194570810 1049393779 /nfs/dbraw/zinc/39/37/79/1049393779.db2.gz PTHGFFOKOXCRLX-KXBFYZLASA-N 1 2 317.379 4.317 20 0 DIADLO C[N@H+](Cc1c(F)cccc1F)C[C@@H]1CC[C@@H](c2ccccc2)O1 ZINC001194570810 1049393796 /nfs/dbraw/zinc/39/37/96/1049393796.db2.gz PTHGFFOKOXCRLX-KXBFYZLASA-N 1 2 317.379 4.317 20 0 DIADLO Cc1cc(OCc2nc(-c3ccccc3)no2)c2ccccc2[nH+]1 ZINC000486233568 1049404220 /nfs/dbraw/zinc/40/42/20/1049404220.db2.gz SDMWQYUASNFKHZ-UHFFFAOYSA-N 1 2 317.348 4.172 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2c(F)cc(F)c(F)c2F)c1 ZINC001205185438 1049405128 /nfs/dbraw/zinc/40/51/28/1049405128.db2.gz KJTTYFWLLYGMCC-UHFFFAOYSA-N 1 2 306.262 4.311 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ncccc2Br)c1C ZINC001194616313 1049406562 /nfs/dbraw/zinc/40/65/62/1049406562.db2.gz UUIJXSOOCIWRGZ-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ncccc2Br)c1C ZINC001194616313 1049406565 /nfs/dbraw/zinc/40/65/65/1049406565.db2.gz UUIJXSOOCIWRGZ-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(COc2ccccc2)cc1 ZINC001180780272 1049406676 /nfs/dbraw/zinc/40/66/76/1049406676.db2.gz RNFMZXQNMYLYHJ-UHFFFAOYSA-N 1 2 307.397 4.094 20 0 DIADLO COc1cc(C[N@H+](C)Cc2c(F)cccc2Cl)ccc1C ZINC001205216338 1049410902 /nfs/dbraw/zinc/41/09/02/1049410902.db2.gz SXGVEVQSGKLABB-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2c(F)cccc2Cl)ccc1C ZINC001205216338 1049410906 /nfs/dbraw/zinc/41/09/06/1049410906.db2.gz SXGVEVQSGKLABB-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO CCC1(C[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)CCCCC1 ZINC001205230221 1049413536 /nfs/dbraw/zinc/41/35/36/1049413536.db2.gz LMGRSHUSUFGCHU-INIZCTEOSA-N 1 2 304.482 4.376 20 0 DIADLO CC(C)Cc1ccc([C@@H](C)C(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC001180900972 1049414968 /nfs/dbraw/zinc/41/49/68/1049414968.db2.gz HMPMBPKIRMIRAP-OAHLLOKOSA-N 1 2 321.424 4.275 20 0 DIADLO CC(C)Cc1ccc([C@@H](C)C(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001180903634 1049416611 /nfs/dbraw/zinc/41/66/11/1049416611.db2.gz UATQMLHHSGCZBJ-OAHLLOKOSA-N 1 2 321.424 4.275 20 0 DIADLO CCOc1c(Cl)cccc1C[NH+]1CC(C)(C)OC(C)(C)C1 ZINC001180935308 1049420031 /nfs/dbraw/zinc/42/00/31/1049420031.db2.gz NCFYGBMSXXXYNN-UHFFFAOYSA-N 1 2 311.853 4.128 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2c(F)c(Cl)ccc2Br)C1 ZINC001181268351 1049458443 /nfs/dbraw/zinc/45/84/43/1049458443.db2.gz ZHXAVFQANQRXQI-VIFPVBQESA-N 1 2 320.633 4.474 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2c(F)c(Cl)ccc2Br)C1 ZINC001181268351 1049458447 /nfs/dbraw/zinc/45/84/47/1049458447.db2.gz ZHXAVFQANQRXQI-VIFPVBQESA-N 1 2 320.633 4.474 20 0 DIADLO COc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1ccc(Cl)s1)C2 ZINC001194864795 1049439425 /nfs/dbraw/zinc/43/94/25/1049439425.db2.gz OPPAGHNGDLTSPX-UHFFFAOYSA-N 1 2 319.857 4.458 20 0 DIADLO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1ccc(Cl)s1)C2 ZINC001194864795 1049439430 /nfs/dbraw/zinc/43/94/30/1049439430.db2.gz OPPAGHNGDLTSPX-UHFFFAOYSA-N 1 2 319.857 4.458 20 0 DIADLO C[C@]1(C[N@@H+]2CCn3c(cc4ccc(Cl)cc43)C2)CCCS1 ZINC001181336663 1049463226 /nfs/dbraw/zinc/46/32/26/1049463226.db2.gz KNWBMPDQXSCTAN-QGZVFWFLSA-N 1 2 320.889 4.396 20 0 DIADLO C[C@]1(C[N@H+]2CCn3c(cc4ccc(Cl)cc43)C2)CCCS1 ZINC001181336663 1049463229 /nfs/dbraw/zinc/46/32/29/1049463229.db2.gz KNWBMPDQXSCTAN-QGZVFWFLSA-N 1 2 320.889 4.396 20 0 DIADLO COCc1ccc(C[N@@H+]2CCc3[nH]c4ccc(F)cc4c3C2)cc1 ZINC000339033270 1049471359 /nfs/dbraw/zinc/47/13/59/1049471359.db2.gz MAPDEYRGGCRQHT-UHFFFAOYSA-N 1 2 324.399 4.012 20 0 DIADLO COCc1ccc(C[N@H+]2CCc3[nH]c4ccc(F)cc4c3C2)cc1 ZINC000339033270 1049471363 /nfs/dbraw/zinc/47/13/63/1049471363.db2.gz MAPDEYRGGCRQHT-UHFFFAOYSA-N 1 2 324.399 4.012 20 0 DIADLO CCOC(=O)[C@H]([NH2+][C@H]1CC(C)(C)C[C@H]1C)c1cccc(C)c1C ZINC001205465589 1049477888 /nfs/dbraw/zinc/47/78/88/1049477888.db2.gz JAUJAIZXPVZTET-FHLIZLRMSA-N 1 2 317.473 4.322 20 0 DIADLO CCN(CC)c1ccc(N[C@@H](C)c2ccnc(Cl)c2)c[nH+]1 ZINC000777251072 1049488591 /nfs/dbraw/zinc/48/85/91/1049488591.db2.gz JTRBMYKVMGIBQC-LBPRGKRZSA-N 1 2 304.825 4.149 20 0 DIADLO Cc1c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)ccnc1F ZINC000862391895 1049492948 /nfs/dbraw/zinc/49/29/48/1049492948.db2.gz WLGBXQMQFHDSTN-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1c(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)ccnc1F ZINC000862391895 1049492952 /nfs/dbraw/zinc/49/29/52/1049492952.db2.gz WLGBXQMQFHDSTN-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO CO[C@H](C[NH2+]CC(F)(F)c1ccc(Cl)cc1)C1CCCC1 ZINC001181621781 1049496813 /nfs/dbraw/zinc/49/68/13/1049496813.db2.gz ICTBEWDIXDQGCC-OAHLLOKOSA-N 1 2 317.807 4.227 20 0 DIADLO CC[C@@H]1C[NH+](CCc2cccc(Cl)c2Cl)C[C@@H](CC)O1 ZINC001195299294 1049513682 /nfs/dbraw/zinc/51/36/82/1049513682.db2.gz MXPWFXOXKQUGMH-ZIAGYGMSSA-N 1 2 316.272 4.425 20 0 DIADLO COc1cc(C)cc(NCc2cc(-n3cc[nH+]c3)cs2)c1C ZINC000487158024 1049520080 /nfs/dbraw/zinc/52/00/80/1049520080.db2.gz LZUFNVXLAYVADI-UHFFFAOYSA-N 1 2 313.426 4.171 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1ccc(O)c(F)c1F ZINC001205692909 1049534810 /nfs/dbraw/zinc/53/48/10/1049534810.db2.gz NZFHGJOHWJSZEI-HNNXBMFYSA-N 1 2 321.367 4.262 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1ccc(O)c(F)c1F ZINC001205692909 1049534828 /nfs/dbraw/zinc/53/48/28/1049534828.db2.gz NZFHGJOHWJSZEI-HNNXBMFYSA-N 1 2 321.367 4.262 20 0 DIADLO C[N@H+](CC1=CCSC1)Cc1c(Cl)cccc1OC(F)F ZINC000668775870 1049548758 /nfs/dbraw/zinc/54/87/58/1049548758.db2.gz RVQLDDWVGUTASN-UHFFFAOYSA-N 1 2 319.804 4.046 20 0 DIADLO C[N@@H+](CC1=CCSC1)Cc1c(Cl)cccc1OC(F)F ZINC000668775870 1049548770 /nfs/dbraw/zinc/54/87/70/1049548770.db2.gz RVQLDDWVGUTASN-UHFFFAOYSA-N 1 2 319.804 4.046 20 0 DIADLO CC(C)c1cc(C(C)C)c(C(=O)NC2C[NH+](C)C2)c(C(C)C)c1 ZINC001195685218 1049552456 /nfs/dbraw/zinc/55/24/56/1049552456.db2.gz ZFTHYDMYOFSJGZ-UHFFFAOYSA-N 1 2 316.489 4.101 20 0 DIADLO ClC1=CCC[N@H+](CCCc2ccccc2Br)C1 ZINC001195687296 1049552830 /nfs/dbraw/zinc/55/28/30/1049552830.db2.gz VHFSHBYHGAPMMV-UHFFFAOYSA-N 1 2 314.654 4.210 20 0 DIADLO ClC1=CCC[N@@H+](CCCc2ccccc2Br)C1 ZINC001195687296 1049552836 /nfs/dbraw/zinc/55/28/36/1049552836.db2.gz VHFSHBYHGAPMMV-UHFFFAOYSA-N 1 2 314.654 4.210 20 0 DIADLO COc1c(C)c[nH+]c(CSc2nc3cnccc3s2)c1C ZINC000863361631 1049560457 /nfs/dbraw/zinc/56/04/57/1049560457.db2.gz LUSSWPZJBSOUJZ-UHFFFAOYSA-N 1 2 317.439 4.004 20 0 DIADLO CC(C)Cc1ccccc1C[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000863377836 1049561631 /nfs/dbraw/zinc/56/16/31/1049561631.db2.gz ZZTUJUXROOBYON-CQSZACIVSA-N 1 2 315.461 4.416 20 0 DIADLO Cc1ncc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000339059127 1049572698 /nfs/dbraw/zinc/57/26/98/1049572698.db2.gz NBTKCFKVVCNNPL-JTQLQIEISA-N 1 2 310.228 4.285 20 0 DIADLO Cc1ncc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000339059127 1049572708 /nfs/dbraw/zinc/57/27/08/1049572708.db2.gz NBTKCFKVVCNNPL-JTQLQIEISA-N 1 2 310.228 4.285 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@H]1CCCOc2ccc(F)cc21 ZINC000924827838 1049577241 /nfs/dbraw/zinc/57/72/41/1049577241.db2.gz WKSCKTHLEOHUDK-GJZGRUSLSA-N 1 2 316.376 4.003 20 0 DIADLO CC1(C)CC(C[N@@H+]2CCO[C@H](c3c(F)cccc3Cl)C2)C1 ZINC001195841895 1049579925 /nfs/dbraw/zinc/57/99/25/1049579925.db2.gz AIFANNPSKZNBMC-HNNXBMFYSA-N 1 2 311.828 4.289 20 0 DIADLO CC1(C)CC(C[N@H+]2CCO[C@H](c3c(F)cccc3Cl)C2)C1 ZINC001195841895 1049579936 /nfs/dbraw/zinc/57/99/36/1049579936.db2.gz AIFANNPSKZNBMC-HNNXBMFYSA-N 1 2 311.828 4.289 20 0 DIADLO Cc1cn2c(cccc2-c2ccc(F)c(F)c2OC(C)C)[nH+]1 ZINC001205855467 1049583961 /nfs/dbraw/zinc/58/39/61/1049583961.db2.gz RESIWXGZSQGCPQ-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO CCC[C@@H](C)CCC[N@H+](C)[C@@H](C(=O)OC)c1cccc(OC)c1 ZINC001195883664 1049586797 /nfs/dbraw/zinc/58/67/97/1049586797.db2.gz JGACOMMGDLYUGB-CRAIPNDOSA-N 1 2 321.461 4.058 20 0 DIADLO CCC[C@@H](C)CCC[N@@H+](C)[C@@H](C(=O)OC)c1cccc(OC)c1 ZINC001195883664 1049586816 /nfs/dbraw/zinc/58/68/16/1049586816.db2.gz JGACOMMGDLYUGB-CRAIPNDOSA-N 1 2 321.461 4.058 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2CCC[C@H]2C(C)(C)C)c(C)[nH+]1 ZINC001205899524 1049595291 /nfs/dbraw/zinc/59/52/91/1049595291.db2.gz KNEZVYZMRGRULC-CABCVRRESA-N 1 2 303.450 4.343 20 0 DIADLO CC[N@H+](Cc1ccc(C(F)F)cc1)[C@@H](C)C(=O)OC(C)(C)C ZINC001196056565 1049606338 /nfs/dbraw/zinc/60/63/38/1049606338.db2.gz LPRWMAIKDPMHDG-LBPRGKRZSA-N 1 2 313.388 4.176 20 0 DIADLO CC[N@@H+](Cc1ccc(C(F)F)cc1)[C@@H](C)C(=O)OC(C)(C)C ZINC001196056565 1049606341 /nfs/dbraw/zinc/60/63/41/1049606341.db2.gz LPRWMAIKDPMHDG-LBPRGKRZSA-N 1 2 313.388 4.176 20 0 DIADLO Cc1cc(CNc2ccc(N(C)C)c(C(F)(F)F)c2)cc(C)[nH+]1 ZINC001182409407 1049639472 /nfs/dbraw/zinc/63/94/72/1049639472.db2.gz LCHFXCVMRBDYTN-UHFFFAOYSA-N 1 2 323.362 4.395 20 0 DIADLO CC(C)(C)c1cccc(C[N@@H+]2CCO[C@H](CC(F)(F)F)C2)c1 ZINC001196324108 1049641503 /nfs/dbraw/zinc/64/15/03/1049641503.db2.gz ZUPIRDMBAPHJBZ-OAHLLOKOSA-N 1 2 315.379 4.137 20 0 DIADLO CC(C)(C)c1cccc(C[N@H+]2CCO[C@H](CC(F)(F)F)C2)c1 ZINC001196324108 1049641510 /nfs/dbraw/zinc/64/15/10/1049641510.db2.gz ZUPIRDMBAPHJBZ-OAHLLOKOSA-N 1 2 315.379 4.137 20 0 DIADLO CCC[NH+](CCC)Cn1nc(-c2cccs2)n(CC)c1=S ZINC000864241626 1049646811 /nfs/dbraw/zinc/64/68/11/1049646811.db2.gz ZTEBIAOEWWHUNT-UHFFFAOYSA-N 1 2 324.519 4.242 20 0 DIADLO Cc1nc(C[N@@H+]2CCSC[C@H]2c2cccc3ccccc32)co1 ZINC001206086599 1049650486 /nfs/dbraw/zinc/65/04/86/1049650486.db2.gz FPFAWJGJIBSYJW-IBGZPJMESA-N 1 2 324.449 4.426 20 0 DIADLO Cc1nc(C[N@H+]2CCSC[C@H]2c2cccc3ccccc32)co1 ZINC001206086599 1049650490 /nfs/dbraw/zinc/65/04/90/1049650490.db2.gz FPFAWJGJIBSYJW-IBGZPJMESA-N 1 2 324.449 4.426 20 0 DIADLO Cc1nn(C[N@@H+]2CC[C@@H](c3ccc(C)cc3C)C2)c(=S)s1 ZINC000794655282 1049650998 /nfs/dbraw/zinc/65/09/98/1049650998.db2.gz MSXLOKCDNGNYDI-CQSZACIVSA-N 1 2 319.499 4.046 20 0 DIADLO Cc1nn(C[N@H+]2CC[C@@H](c3ccc(C)cc3C)C2)c(=S)s1 ZINC000794655282 1049651022 /nfs/dbraw/zinc/65/10/22/1049651022.db2.gz MSXLOKCDNGNYDI-CQSZACIVSA-N 1 2 319.499 4.046 20 0 DIADLO Fc1cc(-c2ccc(-n3cc[nH+]c3)cc2)cc(N2CCCC2)c1 ZINC001206114552 1049657313 /nfs/dbraw/zinc/65/73/13/1049657313.db2.gz ZYCPTGCVTVRIGG-UHFFFAOYSA-N 1 2 307.372 4.279 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3sccc3[C@H]2C)c(F)c1OC ZINC001206127996 1049661664 /nfs/dbraw/zinc/66/16/64/1049661664.db2.gz OMUQRVDBCLFGAT-LLVKDONJSA-N 1 2 321.417 4.024 20 0 DIADLO COc1ccc(C[N@H+]2CCc3sccc3[C@H]2C)c(F)c1OC ZINC001206127996 1049661669 /nfs/dbraw/zinc/66/16/69/1049661669.db2.gz OMUQRVDBCLFGAT-LLVKDONJSA-N 1 2 321.417 4.024 20 0 DIADLO CC(C)Cn1nccc1C[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC001206137021 1049665950 /nfs/dbraw/zinc/66/59/50/1049665950.db2.gz WWMGEWAESGYNHE-MRXNPFEDSA-N 1 2 303.475 4.184 20 0 DIADLO CC(C)Cn1nccc1C[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC001206137021 1049665954 /nfs/dbraw/zinc/66/59/54/1049665954.db2.gz WWMGEWAESGYNHE-MRXNPFEDSA-N 1 2 303.475 4.184 20 0 DIADLO CC(C)c1ccc(CCNc2ccc(N3CCCC3)c[nH+]2)cc1 ZINC001182499141 1049679072 /nfs/dbraw/zinc/67/90/72/1049679072.db2.gz LQZZZKLVNVTZMS-UHFFFAOYSA-N 1 2 309.457 4.460 20 0 DIADLO F[C@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1cncc(Cl)c1Cl ZINC001182499938 1049679524 /nfs/dbraw/zinc/67/95/24/1049679524.db2.gz REQAHDDEBLJTSK-ZFWWWQNUSA-N 1 2 311.187 4.115 20 0 DIADLO c1cc2c(cc1CNc1ccc(N3CCCC3)c[nH+]1)CCCC2 ZINC001182498739 1049679623 /nfs/dbraw/zinc/67/96/23/1049679623.db2.gz LAKGUBRZHPSIHX-UHFFFAOYSA-N 1 2 307.441 4.173 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@@H](C)[C@@H]2C(=O)OC(C)(C)C)c(F)c1 ZINC001182488580 1049680674 /nfs/dbraw/zinc/68/06/74/1049680674.db2.gz BTHVQJVEYFJYGF-RHSMWYFYSA-N 1 2 321.436 4.076 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@@H](C)[C@@H]2C(=O)OC(C)(C)C)c(F)c1 ZINC001182488580 1049680678 /nfs/dbraw/zinc/68/06/78/1049680678.db2.gz BTHVQJVEYFJYGF-RHSMWYFYSA-N 1 2 321.436 4.076 20 0 DIADLO Oc1ccccc1Nc1cc[nH+]c2cc(Br)ccc12 ZINC001206207988 1049682062 /nfs/dbraw/zinc/68/20/62/1049682062.db2.gz QAOKSCVEWBMVDL-UHFFFAOYSA-N 1 2 315.170 4.447 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@H](C)c2ccc(Br)cc2)C[C@H](C)O1 ZINC000488614977 1049684655 /nfs/dbraw/zinc/68/46/55/1049684655.db2.gz SUKQAIFBIOONAS-YWPYICTPSA-N 1 2 312.251 4.009 20 0 DIADLO CC[C@@H]1C[N@H+]([C@H](C)c2ccc(Br)cc2)C[C@H](C)O1 ZINC000488614977 1049684657 /nfs/dbraw/zinc/68/46/57/1049684657.db2.gz SUKQAIFBIOONAS-YWPYICTPSA-N 1 2 312.251 4.009 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2cnc(Cl)n2C)o1 ZINC001204346548 1049685959 /nfs/dbraw/zinc/68/59/59/1049685959.db2.gz ACQOOVQIPFPNQA-WFASDCNBSA-N 1 2 321.852 4.202 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2cnc(Cl)n2C)o1 ZINC001204346548 1049685961 /nfs/dbraw/zinc/68/59/61/1049685961.db2.gz ACQOOVQIPFPNQA-WFASDCNBSA-N 1 2 321.852 4.202 20 0 DIADLO CC[C@@H]([NH2+]C1CC(Sc2ccccc2)C1)C(=O)OC(C)(C)C ZINC001182567460 1049687375 /nfs/dbraw/zinc/68/73/75/1049687375.db2.gz YKZVGOMNYRTMPD-AVVWSFFYSA-N 1 2 321.486 4.020 20 0 DIADLO Cc1c(Cl)cccc1C[N@H+](CC(=O)OC(C)(C)C)C1CCC1 ZINC001182633422 1049691502 /nfs/dbraw/zinc/69/15/02/1049691502.db2.gz ASHLCCAGHHXDMO-UHFFFAOYSA-N 1 2 323.864 4.345 20 0 DIADLO Cc1c(Cl)cccc1C[N@@H+](CC(=O)OC(C)(C)C)C1CCC1 ZINC001182633422 1049691510 /nfs/dbraw/zinc/69/15/10/1049691510.db2.gz ASHLCCAGHHXDMO-UHFFFAOYSA-N 1 2 323.864 4.345 20 0 DIADLO Cc1ccc(C[S@](=O)[C@@H]2CCc3cc(Cl)ccc32)c(C)[nH+]1 ZINC000794782602 1049693150 /nfs/dbraw/zinc/69/31/50/1049693150.db2.gz YTDSYGCILOJDPO-UTKZUKDTSA-N 1 2 319.857 4.288 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1cc2ccc(C)cc2[nH]1 ZINC001182666354 1049695241 /nfs/dbraw/zinc/69/52/41/1049695241.db2.gz NAFFIARJVOBEPM-QGZVFWFLSA-N 1 2 316.445 4.028 20 0 DIADLO CC[C@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1cc2ccc(C)cc2[nH]1 ZINC001182666354 1049695245 /nfs/dbraw/zinc/69/52/45/1049695245.db2.gz NAFFIARJVOBEPM-QGZVFWFLSA-N 1 2 316.445 4.028 20 0 DIADLO COCc1cc(C)c(-c2ccc(F)c(-n3cc[nH+]c3)c2)c(C)c1 ZINC001206344876 1049716799 /nfs/dbraw/zinc/71/67/99/1049716799.db2.gz MEUQMRSMPJGMCL-UHFFFAOYSA-N 1 2 310.372 4.442 20 0 DIADLO C[C@H](CCc1ccsc1)Nc1ccc(N2CCCC2)c[nH+]1 ZINC001206376375 1049723191 /nfs/dbraw/zinc/72/31/91/1049723191.db2.gz FRQLQWFLLNETSI-CQSZACIVSA-N 1 2 301.459 4.177 20 0 DIADLO CC[C@H]([NH2+][C@H](C)Cc1coc2ccccc12)C(=O)OC(C)(C)C ZINC001206399674 1049727567 /nfs/dbraw/zinc/72/75/67/1049727567.db2.gz CZSKSCHWGBPKID-CJNGLKHVSA-N 1 2 317.429 4.074 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cnn(Cc3cccnc3)c2)c1 ZINC001206450012 1049736318 /nfs/dbraw/zinc/73/63/18/1049736318.db2.gz OXSVGTGVSJUZQO-UHFFFAOYSA-N 1 2 320.440 4.148 20 0 DIADLO CCSc1nn(C[N@@H+]2CCC[C@@H]2C2CCC2)c(=S)s1 ZINC000102885884 1049748096 /nfs/dbraw/zinc/74/80/96/1049748096.db2.gz XTTBRPVPVCRPPR-LLVKDONJSA-N 1 2 315.533 4.008 20 0 DIADLO CCSc1nn(C[N@H+]2CCC[C@@H]2C2CCC2)c(=S)s1 ZINC000102885884 1049748098 /nfs/dbraw/zinc/74/80/98/1049748098.db2.gz XTTBRPVPVCRPPR-LLVKDONJSA-N 1 2 315.533 4.008 20 0 DIADLO CC[C@@H]1CN(Cc2c[nH+]cn2C(C)C)c2cccc(Cl)c2O1 ZINC001206512800 1049749226 /nfs/dbraw/zinc/74/92/26/1049749226.db2.gz ALBHPIXPBDSZBQ-CQSZACIVSA-N 1 2 319.836 4.295 20 0 DIADLO CCCCc1nc(C[N@H+](C)Cc2ccc(OC)c(C)c2)cs1 ZINC000489358744 1049749898 /nfs/dbraw/zinc/74/98/98/1049749898.db2.gz JSMHRDXGUWPTCK-UHFFFAOYSA-N 1 2 318.486 4.435 20 0 DIADLO CCCCc1nc(C[N@@H+](C)Cc2ccc(OC)c(C)c2)cs1 ZINC000489358744 1049749903 /nfs/dbraw/zinc/74/99/03/1049749903.db2.gz JSMHRDXGUWPTCK-UHFFFAOYSA-N 1 2 318.486 4.435 20 0 DIADLO CC[C@H]1C[N@H+](Cc2ccc(Oc3ccccc3)o2)[C@@H](C)CO1 ZINC001206523316 1049750481 /nfs/dbraw/zinc/75/04/81/1049750481.db2.gz JHJZCUCLTXULQU-GJZGRUSLSA-N 1 2 301.386 4.071 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)o2)[C@@H](C)CO1 ZINC001206523316 1049750490 /nfs/dbraw/zinc/75/04/90/1049750490.db2.gz JHJZCUCLTXULQU-GJZGRUSLSA-N 1 2 301.386 4.071 20 0 DIADLO c1cn2c(cccc2-c2ccc3cnn([C@H]4CCCCO4)c3c2)[nH+]1 ZINC001206656977 1049775760 /nfs/dbraw/zinc/77/57/60/1049775760.db2.gz UDQKRJFPEUUXRH-LJQANCHMSA-N 1 2 318.380 4.050 20 0 DIADLO Cc1ccc2[nH]ccc2c1-c1ccc(C[NH+]2CCOCC2)cc1F ZINC001206703199 1049782203 /nfs/dbraw/zinc/78/22/03/1049782203.db2.gz GTMBAAJMNGJGQQ-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Fc1cc(C[NH+]2CCOCC2)ccc1-c1ccccc1C(F)F ZINC001206704201 1049782630 /nfs/dbraw/zinc/78/26/30/1049782630.db2.gz RXPRLEZYYRNYRH-UHFFFAOYSA-N 1 2 321.342 4.263 20 0 DIADLO Cc1cccc(CC2C[NH+](Cc3c(Cl)ccnc3Cl)C2)c1 ZINC001206763089 1049794049 /nfs/dbraw/zinc/79/40/49/1049794049.db2.gz TUJHRTXFZNBTKQ-UHFFFAOYSA-N 1 2 321.251 4.371 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2cc(-c3ccc(F)cc3)on2)C1 ZINC001206832117 1049811061 /nfs/dbraw/zinc/81/10/61/1049811061.db2.gz VUALEBNZHSTORF-QGZVFWFLSA-N 1 2 306.356 4.195 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2cc(-c3ccc(F)cc3)on2)C1 ZINC001206832117 1049811067 /nfs/dbraw/zinc/81/10/67/1049811067.db2.gz VUALEBNZHSTORF-QGZVFWFLSA-N 1 2 306.356 4.195 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2cc(-c3ccc(F)cc3)on2)C1 ZINC001206832116 1049811440 /nfs/dbraw/zinc/81/14/40/1049811440.db2.gz VUALEBNZHSTORF-KRWDZBQOSA-N 1 2 306.356 4.195 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2cc(-c3ccc(F)cc3)on2)C1 ZINC001206832116 1049811458 /nfs/dbraw/zinc/81/14/58/1049811458.db2.gz VUALEBNZHSTORF-KRWDZBQOSA-N 1 2 306.356 4.195 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cn2sc3ccccc3c2=O)cc1 ZINC000912854415 1049812215 /nfs/dbraw/zinc/81/22/15/1049812215.db2.gz APKZLHIIWQLVIT-QGZVFWFLSA-N 1 2 324.449 4.166 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cn2sc3ccccc3c2=O)cc1 ZINC000912854415 1049812224 /nfs/dbraw/zinc/81/22/24/1049812224.db2.gz APKZLHIIWQLVIT-QGZVFWFLSA-N 1 2 324.449 4.166 20 0 DIADLO Cc1ncsc1C[N@@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001206989822 1049816346 /nfs/dbraw/zinc/81/63/46/1049816346.db2.gz MVVJFZZTPMADBJ-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1ncsc1C[N@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001206989822 1049816354 /nfs/dbraw/zinc/81/63/54/1049816354.db2.gz MVVJFZZTPMADBJ-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1C[NH2+][C@@](CC)(C(=O)OC)c1ccccc1 ZINC001207049639 1049825415 /nfs/dbraw/zinc/82/54/15/1049825415.db2.gz MASKFZVRXNACMW-MBOZVWFJSA-N 1 2 317.473 4.271 20 0 DIADLO CC1(C)C[N@H+](Cc2c(F)cccc2OC(F)F)CCC1(F)F ZINC001207111735 1049837226 /nfs/dbraw/zinc/83/72/26/1049837226.db2.gz OFVQYIKMGODWEG-UHFFFAOYSA-N 1 2 323.305 4.294 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(F)cccc2OC(F)F)CCC1(F)F ZINC001207111735 1049837249 /nfs/dbraw/zinc/83/72/49/1049837249.db2.gz OFVQYIKMGODWEG-UHFFFAOYSA-N 1 2 323.305 4.294 20 0 DIADLO Fc1cc(C[NH2+]Cc2cc(Cl)cc(Cl)c2F)c(F)cn1 ZINC001207161336 1049848895 /nfs/dbraw/zinc/84/88/95/1049848895.db2.gz XWSPHYWCANSSJU-UHFFFAOYSA-N 1 2 321.129 4.096 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@H+](Cc1ccnn1CC(C)C)CC2 ZINC001207242207 1049868166 /nfs/dbraw/zinc/86/81/66/1049868166.db2.gz AXUXDGBBZQGKCL-UHFFFAOYSA-N 1 2 317.864 4.059 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@@H+](Cc1ccnn1CC(C)C)CC2 ZINC001207242207 1049868174 /nfs/dbraw/zinc/86/81/74/1049868174.db2.gz AXUXDGBBZQGKCL-UHFFFAOYSA-N 1 2 317.864 4.059 20 0 DIADLO COC(=O)c1cc(NCc2cc(C)[nH+]c(C)c2)cc2ccccc21 ZINC001207261833 1049870300 /nfs/dbraw/zinc/87/03/00/1049870300.db2.gz SBTYFOYCCCOPQA-UHFFFAOYSA-N 1 2 320.392 4.250 20 0 DIADLO CC(C)[C@H]1C[C@H]([NH2+]CC(F)(F)c2cc(F)cc(F)c2)CS1 ZINC001207302524 1049879573 /nfs/dbraw/zinc/87/95/73/1049879573.db2.gz QHKBJMKBUBZXQE-UONOGXRCSA-N 1 2 321.383 4.176 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ncc(C(C)(C)C)s2)o1 ZINC000570896760 1049892280 /nfs/dbraw/zinc/89/22/80/1049892280.db2.gz VASYQYJFYCXZGG-AAEUAGOBSA-N 1 2 304.459 4.447 20 0 DIADLO Fc1ccccc1CC[N@@H+]1Cc2ccc(Br)cc2C1 ZINC001207497318 1049899421 /nfs/dbraw/zinc/89/94/21/1049899421.db2.gz KAQLWHHWGAFCBY-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO Fc1ccccc1CC[N@H+]1Cc2ccc(Br)cc2C1 ZINC001207497318 1049899426 /nfs/dbraw/zinc/89/94/26/1049899426.db2.gz KAQLWHHWGAFCBY-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO CO[C@@H]1CCC[C@@H]([NH2+][C@H](c2cccc(Cl)c2)C(F)F)C1 ZINC001207553303 1049907744 /nfs/dbraw/zinc/90/77/44/1049907744.db2.gz IYEATWUDYGYIEE-MGPQQGTHSA-N 1 2 303.780 4.193 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCS[C@@H](C(F)(F)F)C2)c1 ZINC001207566504 1049910143 /nfs/dbraw/zinc/91/01/43/1049910143.db2.gz XONYBAZWVPBCTO-GFCCVEGCSA-N 1 2 309.784 4.128 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCS[C@@H](C(F)(F)F)C2)c1 ZINC001207566504 1049910149 /nfs/dbraw/zinc/91/01/49/1049910149.db2.gz XONYBAZWVPBCTO-GFCCVEGCSA-N 1 2 309.784 4.128 20 0 DIADLO c1nnc([C@H]([NH2+]Cc2ccc3ccccc3c2)C2CCCCC2)[nH]1 ZINC000570996596 1049918849 /nfs/dbraw/zinc/91/88/49/1049918849.db2.gz GLZCIYSFYLTBIP-LJQANCHMSA-N 1 2 320.440 4.369 20 0 DIADLO c1nnc([C@@H]([NH2+]Cc2ccc3ccccc3c2)C2CCCCC2)[nH]1 ZINC000570996595 1049919296 /nfs/dbraw/zinc/91/92/96/1049919296.db2.gz GLZCIYSFYLTBIP-IBGZPJMESA-N 1 2 320.440 4.369 20 0 DIADLO Cc1cc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)nc(C)n1 ZINC000659875538 1049936074 /nfs/dbraw/zinc/93/60/74/1049936074.db2.gz ZKNMHYPBKQLWPY-CYBMUJFWSA-N 1 2 315.848 4.472 20 0 DIADLO Cc1cc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)nc(C)n1 ZINC000659875538 1049936076 /nfs/dbraw/zinc/93/60/76/1049936076.db2.gz ZKNMHYPBKQLWPY-CYBMUJFWSA-N 1 2 315.848 4.472 20 0 DIADLO COc1ccc2c(c1)C[C@@H]([NH2+][C@H](c1ccccc1)C(F)F)CC2 ZINC001207872277 1049949163 /nfs/dbraw/zinc/94/91/63/1049949163.db2.gz BANAVGJVJIYWCT-FUHWJXTLSA-N 1 2 317.379 4.149 20 0 DIADLO COC1CCC(CNc2[nH+]c3ccccc3n2C(C)(C)C)CC1 ZINC001207873156 1049949244 /nfs/dbraw/zinc/94/92/44/1049949244.db2.gz MCRIBPSPBPBXMU-UHFFFAOYSA-N 1 2 315.461 4.408 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1ccc(F)cc1Br ZINC000588169631 1049972564 /nfs/dbraw/zinc/97/25/64/1049972564.db2.gz ZYQHAMOOKYYCJE-UHFFFAOYSA-N 1 2 312.182 4.203 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1ccc(F)cc1Br ZINC000588169631 1049972571 /nfs/dbraw/zinc/97/25/71/1049972571.db2.gz ZYQHAMOOKYYCJE-UHFFFAOYSA-N 1 2 312.182 4.203 20 0 DIADLO CC(C)(C)[C@@H]1CCCN(C(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC000572208973 1049998561 /nfs/dbraw/zinc/99/85/61/1049998561.db2.gz GMCYSACTHVWCQI-CQSZACIVSA-N 1 2 314.433 4.014 20 0 DIADLO C[C@@H](C[N@@H+]1CC(F)(F)C[C@@]1(C)CO)c1cccc2ccccc21 ZINC001208704280 1050003414 /nfs/dbraw/zinc/00/34/14/1050003414.db2.gz JLMPTHJYAJFACU-KSSFIOAISA-N 1 2 319.395 4.035 20 0 DIADLO C[C@@H](C[N@H+]1CC(F)(F)C[C@@]1(C)CO)c1cccc2ccccc21 ZINC001208704280 1050003420 /nfs/dbraw/zinc/00/34/20/1050003420.db2.gz JLMPTHJYAJFACU-KSSFIOAISA-N 1 2 319.395 4.035 20 0 DIADLO C[C@H](C[N@@H+]1CC(F)(F)CC[C@@H]1CO)c1cccc2ccccc21 ZINC001208707425 1050004143 /nfs/dbraw/zinc/00/41/43/1050004143.db2.gz SSWDRDNXERNTPB-GDBMZVCRSA-N 1 2 319.395 4.035 20 0 DIADLO C[C@H](C[N@H+]1CC(F)(F)CC[C@@H]1CO)c1cccc2ccccc21 ZINC001208707425 1050004146 /nfs/dbraw/zinc/00/41/46/1050004146.db2.gz SSWDRDNXERNTPB-GDBMZVCRSA-N 1 2 319.395 4.035 20 0 DIADLO Clc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cn2ccsc2n1 ZINC000588900161 1050007486 /nfs/dbraw/zinc/00/74/86/1050007486.db2.gz XYXNDDLCRKBEEZ-HNNXBMFYSA-N 1 2 317.845 4.386 20 0 DIADLO Clc1ccccc1[C@@H]1CCC[N@H+]1Cc1cn2ccsc2n1 ZINC000588900161 1050007493 /nfs/dbraw/zinc/00/74/93/1050007493.db2.gz XYXNDDLCRKBEEZ-HNNXBMFYSA-N 1 2 317.845 4.386 20 0 DIADLO C[C@@H]1CCc2nc(C[NH2+][C@H]3CSc4ccccc43)sc2C1 ZINC000498353549 1050014775 /nfs/dbraw/zinc/01/47/75/1050014775.db2.gz MIEYCRQGRYKNNK-RISCZKNCSA-N 1 2 316.495 4.205 20 0 DIADLO FC1(F)C[N@H+](CCCc2cccnc2)CC[C@H]1c1ccccc1 ZINC001209180809 1050041428 /nfs/dbraw/zinc/04/14/28/1050041428.db2.gz KCISMZJGVKERFO-SFHVURJKSA-N 1 2 316.395 4.139 20 0 DIADLO FC1(F)C[N@@H+](CCCc2cccnc2)CC[C@H]1c1ccccc1 ZINC001209180809 1050041433 /nfs/dbraw/zinc/04/14/33/1050041433.db2.gz KCISMZJGVKERFO-SFHVURJKSA-N 1 2 316.395 4.139 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2n[nH]c3ccccc32)C2CC2)cc1 ZINC000589635908 1050051060 /nfs/dbraw/zinc/05/10/60/1050051060.db2.gz UTRZWEIGYMMIJM-GOSISDBHSA-N 1 2 311.816 4.457 20 0 DIADLO Cc1ccccc1O[C@H]1CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC001209470613 1050061432 /nfs/dbraw/zinc/06/14/32/1050061432.db2.gz LLDFHAHEZUJMEL-ZDUSSCGKSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1ccccc1O[C@H]1CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC001209470613 1050061434 /nfs/dbraw/zinc/06/14/34/1050061434.db2.gz LLDFHAHEZUJMEL-ZDUSSCGKSA-N 1 2 322.861 4.148 20 0 DIADLO c1cc(C[N@@H+]2CCSC[C@@H]2c2cccc3ccccc32)no1 ZINC001209569666 1050069260 /nfs/dbraw/zinc/06/92/60/1050069260.db2.gz JSENIDAWTBTXAZ-GOSISDBHSA-N 1 2 310.422 4.118 20 0 DIADLO c1cc(C[N@H+]2CCSC[C@@H]2c2cccc3ccccc32)no1 ZINC001209569666 1050069271 /nfs/dbraw/zinc/06/92/71/1050069271.db2.gz JSENIDAWTBTXAZ-GOSISDBHSA-N 1 2 310.422 4.118 20 0 DIADLO Cc1ccc(C[N@H+]2Cc3c(Br)cccc3C[C@@H]2C)[nH]1 ZINC001209577032 1050069895 /nfs/dbraw/zinc/06/98/95/1050069895.db2.gz LLZISVHZIDEFMD-LBPRGKRZSA-N 1 2 319.246 4.032 20 0 DIADLO Cc1ccc(C[N@@H+]2Cc3c(Br)cccc3C[C@@H]2C)[nH]1 ZINC001209577032 1050069900 /nfs/dbraw/zinc/06/99/00/1050069900.db2.gz LLZISVHZIDEFMD-LBPRGKRZSA-N 1 2 319.246 4.032 20 0 DIADLO Cc1cc(Cl)ncc1C[N@@H+]1CCSc2ccccc2C1 ZINC001209634063 1050072588 /nfs/dbraw/zinc/07/25/88/1050072588.db2.gz NGOZFWNXLWQIHY-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO Cc1cc(Cl)ncc1C[N@H+]1CCSc2ccccc2C1 ZINC001209634063 1050072590 /nfs/dbraw/zinc/07/25/90/1050072590.db2.gz NGOZFWNXLWQIHY-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1cccc3[nH]cc(Cl)c31)C2 ZINC001209654920 1050074047 /nfs/dbraw/zinc/07/40/47/1050074047.db2.gz OLVQBHITAVITNG-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1cccc3[nH]cc(Cl)c31)C2 ZINC001209654920 1050074051 /nfs/dbraw/zinc/07/40/51/1050074051.db2.gz OLVQBHITAVITNG-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO COc1c(Cl)ccc(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c1F ZINC001209695692 1050076466 /nfs/dbraw/zinc/07/64/66/1050076466.db2.gz AZBNPMGNNOVYLV-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO COc1c(Cl)ccc(C[N@H+]2CCC(F)(F)C(C)(C)C2)c1F ZINC001209695692 1050076471 /nfs/dbraw/zinc/07/64/71/1050076471.db2.gz AZBNPMGNNOVYLV-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO COc1c(Cl)ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1F ZINC001209701092 1050078380 /nfs/dbraw/zinc/07/83/80/1050078380.db2.gz JAQHYGJBIPIFLD-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(Cl)ccc(C[N@H+]2CCC[C@@H]2c2ccccn2)c1F ZINC001209701092 1050078387 /nfs/dbraw/zinc/07/83/87/1050078387.db2.gz JAQHYGJBIPIFLD-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1cc2cc(Cl)ccc2[nH]1 ZINC001209726530 1050079345 /nfs/dbraw/zinc/07/93/45/1050079345.db2.gz ULKOBQJXMSWESS-UHFFFAOYSA-N 1 2 312.800 4.136 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1cc2cc(Cl)ccc2[nH]1 ZINC001209726530 1050079349 /nfs/dbraw/zinc/07/93/49/1050079349.db2.gz ULKOBQJXMSWESS-UHFFFAOYSA-N 1 2 312.800 4.136 20 0 DIADLO CSCc1cnc(C[NH2+][C@@H]2CSCc3ccccc32)s1 ZINC000590183979 1050080215 /nfs/dbraw/zinc/08/02/15/1050080215.db2.gz NFJUKCBXVBGDLD-CQSZACIVSA-N 1 2 322.524 4.084 20 0 DIADLO CC1(C)C[N@H+](Cc2n[nH]c3ccc(Cl)cc32)CCC1(F)F ZINC001209752633 1050080643 /nfs/dbraw/zinc/08/06/43/1050080643.db2.gz JJHQOPUMDSMGHG-UHFFFAOYSA-N 1 2 313.779 4.084 20 0 DIADLO CC1(C)C[N@@H+](Cc2n[nH]c3ccc(Cl)cc32)CCC1(F)F ZINC001209752633 1050080648 /nfs/dbraw/zinc/08/06/48/1050080648.db2.gz JJHQOPUMDSMGHG-UHFFFAOYSA-N 1 2 313.779 4.084 20 0 DIADLO Cc1cc(Nc2ccc3[nH]c[nH+]c3c2)nc(C)c1Br ZINC001209841494 1050093850 /nfs/dbraw/zinc/09/38/50/1050093850.db2.gz RMKXJPIMTYSSOZ-UHFFFAOYSA-N 1 2 317.190 4.081 20 0 DIADLO CCOc1ccc(Nc2ccc3c(c2)[nH+]cn3C)c(Cl)c1 ZINC001209895876 1050102260 /nfs/dbraw/zinc/10/22/60/1050102260.db2.gz ZYAWFAATZLITBC-UHFFFAOYSA-N 1 2 301.777 4.369 20 0 DIADLO CCCCOC(=O)Nc1ccc(Nc2ccn3cc[nH+]c3c2)cc1 ZINC001209916219 1050106110 /nfs/dbraw/zinc/10/61/10/1050106110.db2.gz BDOWQANBANMXPE-UHFFFAOYSA-N 1 2 324.384 4.427 20 0 DIADLO Cc1cccc(C2CC2)c1Nc1ccccc1C[NH+]1CCOCC1 ZINC001209932616 1050107983 /nfs/dbraw/zinc/10/79/83/1050107983.db2.gz FBSXXGGQJUFNSS-UHFFFAOYSA-N 1 2 322.452 4.448 20 0 DIADLO Cc1ccc(Nc2ccccc2C[NH+]2CCOCC2)cc1Cl ZINC001209926868 1050108216 /nfs/dbraw/zinc/10/82/16/1050108216.db2.gz FKKPYTOBAXGPBM-UHFFFAOYSA-N 1 2 316.832 4.224 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@@H](C)c2cccc(OCC)c2)n1 ZINC000068839568 1050111165 /nfs/dbraw/zinc/11/11/65/1050111165.db2.gz FPHWDMSWZWGGIY-KBPBESRZSA-N 1 2 317.433 4.223 20 0 DIADLO CCCC1CCC(N(C(=O)CCCn2cc[nH+]c2)C(C)C)CC1 ZINC000590893384 1050111404 /nfs/dbraw/zinc/11/14/04/1050111404.db2.gz KPXUQMITNAYQHO-UHFFFAOYSA-N 1 2 319.493 4.259 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccc(CSC(F)F)o2)cc1 ZINC000057784633 1050114964 /nfs/dbraw/zinc/11/49/64/1050114964.db2.gz DOHRXCITOKRWRG-UHFFFAOYSA-N 1 2 312.385 4.414 20 0 DIADLO Oc1ccc(C(F)(F)F)cc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001209982628 1050115653 /nfs/dbraw/zinc/11/56/53/1050115653.db2.gz VDJHMIALEORUIJ-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO Oc1ccc(C(F)(F)F)cc1Nc1ccccc1-n1cc[nH+]c1 ZINC001209981344 1050115726 /nfs/dbraw/zinc/11/57/26/1050115726.db2.gz AOKLOPMMYBAFHN-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO CC(C)Oc1ccccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001210022379 1050123978 /nfs/dbraw/zinc/12/39/78/1050123978.db2.gz FVGSXXUCDVPMNW-UHFFFAOYSA-N 1 2 307.397 4.462 20 0 DIADLO Cc1cc(Nc2cnc(F)c(Br)c2)ccc1[NH+](C)C ZINC001210038919 1050127086 /nfs/dbraw/zinc/12/70/86/1050127086.db2.gz DZDHHDOFCIQUJS-UHFFFAOYSA-N 1 2 324.197 4.101 20 0 DIADLO Cc1cc(Nc2ccc3nc(C4CCC4)nn3c2)ccc1[NH+](C)C ZINC001210041600 1050127570 /nfs/dbraw/zinc/12/75/70/1050127570.db2.gz PEYIFCULJFLMFC-UHFFFAOYSA-N 1 2 321.428 4.115 20 0 DIADLO COCCCOc1ccc(Nc2ccc([NH+](C)C)c(C)c2)cc1 ZINC001210041330 1050127658 /nfs/dbraw/zinc/12/76/58/1050127658.db2.gz LSMBQGPSEFTNKF-UHFFFAOYSA-N 1 2 314.429 4.220 20 0 DIADLO Brc1ccc(Nc2ccc3c[nH+]ccc3c2)nc1 ZINC001210043659 1050127782 /nfs/dbraw/zinc/12/77/82/1050127782.db2.gz HYXLTRDVEMTVQK-UHFFFAOYSA-N 1 2 300.159 4.136 20 0 DIADLO COc1cc(C(C)=O)c(Nc2ccc([NH+](C)C)c(C)c2)cc1F ZINC001210045460 1050128435 /nfs/dbraw/zinc/12/84/35/1050128435.db2.gz UEOMOIHJTSOQJB-UHFFFAOYSA-N 1 2 316.376 4.155 20 0 DIADLO CCc1ccc(-c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)cc1 ZINC000733739332 1050148948 /nfs/dbraw/zinc/14/89/48/1050148948.db2.gz GVEHFHYOGJDEJY-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO Cc1ccc2cc(N[C@H]3CCc4ccc(O)cc4C3)[nH+]cc2c1 ZINC001171026891 1050150422 /nfs/dbraw/zinc/15/04/22/1050150422.db2.gz CQRGAUWIIZRITR-SFHVURJKSA-N 1 2 304.393 4.218 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCC[N@@H+]1Cc1ccoc1 ZINC000770336217 1050152550 /nfs/dbraw/zinc/15/25/50/1050152550.db2.gz NCKMXOVAIZIDTQ-OAHLLOKOSA-N 1 2 321.852 4.431 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCC[N@H+]1Cc1ccoc1 ZINC000770336217 1050152553 /nfs/dbraw/zinc/15/25/53/1050152553.db2.gz NCKMXOVAIZIDTQ-OAHLLOKOSA-N 1 2 321.852 4.431 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@@H]2CCCC[C@H]2C)no1)c1ccccc1 ZINC000573246558 1050153397 /nfs/dbraw/zinc/15/33/97/1050153397.db2.gz QUYLJYZUOIXUAO-DJIMGWMZSA-N 1 2 313.445 4.404 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@@H]2CCCC[C@H]2C)no1)c1ccccc1 ZINC000573246558 1050153402 /nfs/dbraw/zinc/15/34/02/1050153402.db2.gz QUYLJYZUOIXUAO-DJIMGWMZSA-N 1 2 313.445 4.404 20 0 DIADLO Fc1ccc2c(c1F)C[N@@H+](Cc1cncc3ccccc31)CC2 ZINC000770354166 1050154995 /nfs/dbraw/zinc/15/49/95/1050154995.db2.gz FBMFRARFFPDHFJ-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1ccc2c(c1F)C[N@H+](Cc1cncc3ccccc31)CC2 ZINC000770354166 1050154998 /nfs/dbraw/zinc/15/49/98/1050154998.db2.gz FBMFRARFFPDHFJ-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+]C[C@H]2C[C@H]2c2ccccc2)cc1 ZINC000770428014 1050158656 /nfs/dbraw/zinc/15/86/56/1050158656.db2.gz GEFAZZINFMYZGE-BLIXFSHQSA-N 1 2 322.452 4.127 20 0 DIADLO CC[N@@H+](c1ccc(NCc2[nH]nc3ccccc32)cc1)C(C)C ZINC000770480754 1050165669 /nfs/dbraw/zinc/16/56/69/1050165669.db2.gz PNGFAMVGJYULCX-UHFFFAOYSA-N 1 2 308.429 4.410 20 0 DIADLO CC[N@H+](c1ccc(NCc2[nH]nc3ccccc32)cc1)C(C)C ZINC000770480754 1050165677 /nfs/dbraw/zinc/16/56/77/1050165677.db2.gz PNGFAMVGJYULCX-UHFFFAOYSA-N 1 2 308.429 4.410 20 0 DIADLO Brc1nc(Nc2cccc3cc[nH+]cc32)cs1 ZINC001210224064 1050165952 /nfs/dbraw/zinc/16/59/52/1050165952.db2.gz CEDUMUAZEVCZBA-UHFFFAOYSA-N 1 2 306.188 4.197 20 0 DIADLO Fc1ncc(Br)cc1Nc1cccc2cc[nH+]cc21 ZINC001210224325 1050166038 /nfs/dbraw/zinc/16/60/38/1050166038.db2.gz XEJXUSLVTMNRNK-UHFFFAOYSA-N 1 2 318.149 4.275 20 0 DIADLO Fc1nc(F)c(Cl)c(Nc2cccc3cc[nH+]cc32)c1F ZINC001210224018 1050166151 /nfs/dbraw/zinc/16/61/51/1050166151.db2.gz NZJJXFYCXMEPLI-UHFFFAOYSA-N 1 2 309.678 4.444 20 0 DIADLO COC(=O)c1ccc(F)c(F)c1Nc1cccc2cc[nH+]cc21 ZINC001210229929 1050167976 /nfs/dbraw/zinc/16/79/76/1050167976.db2.gz COBSMUDUYPWPPS-UHFFFAOYSA-N 1 2 314.291 4.043 20 0 DIADLO CO[C@H]1CCOc2c(Nc3cccc4cc[nH+]cc43)cccc21 ZINC001210232218 1050169409 /nfs/dbraw/zinc/16/94/09/1050169409.db2.gz JFOZSHHRAFIFCX-SFHVURJKSA-N 1 2 306.365 4.448 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3cnc4ccccc4c3)ccc21 ZINC000770539630 1050169660 /nfs/dbraw/zinc/16/96/60/1050169660.db2.gz BBLXBMXIZMXHFI-UHFFFAOYSA-N 1 2 303.409 4.229 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3cnc4ccccc4c3)ccc21 ZINC000770539630 1050169666 /nfs/dbraw/zinc/16/96/66/1050169666.db2.gz BBLXBMXIZMXHFI-UHFFFAOYSA-N 1 2 303.409 4.229 20 0 DIADLO Oc1ccc(Br)c(Nc2cccc3cc[nH+]cc32)c1 ZINC001210231821 1050169835 /nfs/dbraw/zinc/16/98/35/1050169835.db2.gz RDUHDXNPZNLIPI-UHFFFAOYSA-N 1 2 315.170 4.447 20 0 DIADLO COC(=O)c1cc(F)cc(F)c1Nc1cccc2cc[nH+]cc21 ZINC001210233374 1050172472 /nfs/dbraw/zinc/17/24/72/1050172472.db2.gz XGBNAYUHKOSBHZ-UHFFFAOYSA-N 1 2 314.291 4.043 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccnc(Cl)c1 ZINC000766191476 1050182023 /nfs/dbraw/zinc/18/20/23/1050182023.db2.gz GNMIDYXRJMWIPV-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1cc(Nc2cc(Br)c3[nH+]ccn3c2)c(C)o1 ZINC001210280066 1050190270 /nfs/dbraw/zinc/19/02/70/1050190270.db2.gz IUUBQQVTYUTLJP-UHFFFAOYSA-N 1 2 306.163 4.050 20 0 DIADLO Cc1[nH+]cc(Nc2cc(Cl)cc(OC(F)(F)F)c2)cc1N ZINC001210290154 1050191550 /nfs/dbraw/zinc/19/15/50/1050191550.db2.gz FCHAZPUJOIWLRA-UHFFFAOYSA-N 1 2 317.698 4.268 20 0 DIADLO Cc1[nH+]cc(Nc2cccc(OCc3ccccc3)c2)cc1N ZINC001210288661 1050191730 /nfs/dbraw/zinc/19/17/30/1050191730.db2.gz RHFIUEXSZIRQIP-UHFFFAOYSA-N 1 2 305.381 4.295 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(OCc3ccccc3)cc2)cc1N ZINC001210288015 1050191850 /nfs/dbraw/zinc/19/18/50/1050191850.db2.gz HDPSZTKWVGDVRP-UHFFFAOYSA-N 1 2 305.381 4.295 20 0 DIADLO Cc1[nH+]cc(Nc2cc(Cl)ccc2C(F)(F)F)cc1N ZINC001210290303 1050192761 /nfs/dbraw/zinc/19/27/61/1050192761.db2.gz JQSTXQLEDPHGHO-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccnc(Cl)c1F ZINC000824250415 1050195355 /nfs/dbraw/zinc/19/53/55/1050195355.db2.gz OCEPFBNNPCITTB-VIFPVBQESA-N 1 2 310.722 4.037 20 0 DIADLO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccnc(Cl)c1F ZINC000824250415 1050195357 /nfs/dbraw/zinc/19/53/57/1050195357.db2.gz OCEPFBNNPCITTB-VIFPVBQESA-N 1 2 310.722 4.037 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2n[nH]c3ccccc32)C2CCC2)cc1 ZINC000591698914 1050196124 /nfs/dbraw/zinc/19/61/24/1050196124.db2.gz OCZOVQSNNQRBSB-IBGZPJMESA-N 1 2 309.388 4.333 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2n[nH]c3ccccc32)C2CCC2)cc1 ZINC000591698915 1050197139 /nfs/dbraw/zinc/19/71/39/1050197139.db2.gz OCZOVQSNNQRBSB-LJQANCHMSA-N 1 2 309.388 4.333 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc(OC(F)F)nc3)ccc12 ZINC001210305743 1050199948 /nfs/dbraw/zinc/19/99/48/1050199948.db2.gz HOGPPQMBSWYNCI-UHFFFAOYSA-N 1 2 301.296 4.283 20 0 DIADLO CC(=O)c1ccc([C@H](C)Nc2cc(N(C)C)cc(Cl)[nH+]2)cc1 ZINC001171054624 1050207092 /nfs/dbraw/zinc/20/70/92/1050207092.db2.gz VHUVMJYCPNKBIE-NSHDSACASA-N 1 2 317.820 4.177 20 0 DIADLO CC1(F)CC[NH+](Cc2ccc(Br)cc2Cl)CC1 ZINC001137560807 1050207242 /nfs/dbraw/zinc/20/72/42/1050207242.db2.gz QUTIRDNZYGEXBH-UHFFFAOYSA-N 1 2 320.633 4.427 20 0 DIADLO Cc1ccn2c(C[N@@H+](C)[C@@H](C)c3ccccc3Cl)cnc2c1 ZINC001136892163 1050220236 /nfs/dbraw/zinc/22/02/36/1050220236.db2.gz AHJGUCIHQAMYLI-AWEZNQCLSA-N 1 2 313.832 4.489 20 0 DIADLO Cc1ccn2c(C[N@H+](C)[C@@H](C)c3ccccc3Cl)cnc2c1 ZINC001136892163 1050220243 /nfs/dbraw/zinc/22/02/43/1050220243.db2.gz AHJGUCIHQAMYLI-AWEZNQCLSA-N 1 2 313.832 4.489 20 0 DIADLO FCC(CF)[NH2+]Cc1cn(Cc2ccccc2)c2ccccc12 ZINC000824548712 1050224149 /nfs/dbraw/zinc/22/41/49/1050224149.db2.gz MJPCBTNFQPAMFU-UHFFFAOYSA-N 1 2 314.379 4.087 20 0 DIADLO Cn1ccnc1-c1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)cc1 ZINC001210432489 1050243842 /nfs/dbraw/zinc/24/38/42/1050243842.db2.gz WSWGROCEXQFBJW-UHFFFAOYSA-N 1 2 323.787 4.132 20 0 DIADLO O[C@@H](CNc1cc2cc[nH]c2c[nH+]1)c1c(Cl)cccc1Cl ZINC001170025493 1050246391 /nfs/dbraw/zinc/24/63/91/1050246391.db2.gz BXGVDULMTRILQE-ZDUSSCGKSA-N 1 2 322.195 4.015 20 0 DIADLO c1ccc(COC[C@@H]2CC[N@@H+]2Cc2nc3ccccc3s2)cc1 ZINC001136953602 1050249372 /nfs/dbraw/zinc/24/93/72/1050249372.db2.gz OJZGSOMBKUWIPW-INIZCTEOSA-N 1 2 324.449 4.087 20 0 DIADLO c1ccc(COC[C@@H]2CC[N@H+]2Cc2nc3ccccc3s2)cc1 ZINC001136953602 1050249384 /nfs/dbraw/zinc/24/93/84/1050249384.db2.gz OJZGSOMBKUWIPW-INIZCTEOSA-N 1 2 324.449 4.087 20 0 DIADLO CCC[C@@H](CCc1ccccc1)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001136957848 1050254824 /nfs/dbraw/zinc/25/48/24/1050254824.db2.gz XHPALMWJNSDVAK-KRWDZBQOSA-N 1 2 321.424 4.094 20 0 DIADLO Fc1cccc2[nH]cc(C[N@@H+]3CCc4cc(F)c(F)cc4C3)c21 ZINC001136988818 1050269997 /nfs/dbraw/zinc/26/99/97/1050269997.db2.gz VLUUJUAYBDFTOQ-UHFFFAOYSA-N 1 2 316.326 4.144 20 0 DIADLO Fc1cccc2[nH]cc(C[N@H+]3CCc4cc(F)c(F)cc4C3)c21 ZINC001136988818 1050270006 /nfs/dbraw/zinc/27/00/06/1050270006.db2.gz VLUUJUAYBDFTOQ-UHFFFAOYSA-N 1 2 316.326 4.144 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccc(OCc3ccccc3)cc2)co1 ZINC000825051204 1050271173 /nfs/dbraw/zinc/27/11/73/1050271173.db2.gz YBHSPUQSMRCSJD-UHFFFAOYSA-N 1 2 322.408 4.106 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@@H+]1Cc1coc(C2CC2)n1 ZINC000825215781 1050284174 /nfs/dbraw/zinc/28/41/74/1050284174.db2.gz VZVGXGMMFMQQGU-KRWDZBQOSA-N 1 2 300.377 4.337 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000825215781 1050284188 /nfs/dbraw/zinc/28/41/88/1050284188.db2.gz VZVGXGMMFMQQGU-KRWDZBQOSA-N 1 2 300.377 4.337 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)cc1C ZINC001137004961 1050286604 /nfs/dbraw/zinc/28/66/04/1050286604.db2.gz UJUWLMGXOHTOKN-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)cc1C ZINC001137004961 1050286614 /nfs/dbraw/zinc/28/66/14/1050286614.db2.gz UJUWLMGXOHTOKN-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO CCCCn1nc(C)c(C[N@H+](C)Cc2ccccc2)c1Cl ZINC000771927153 1050296447 /nfs/dbraw/zinc/29/64/47/1050296447.db2.gz HTPVJVCWWFTQRZ-UHFFFAOYSA-N 1 2 305.853 4.277 20 0 DIADLO CCCCn1nc(C)c(C[N@@H+](C)Cc2ccccc2)c1Cl ZINC000771927153 1050296464 /nfs/dbraw/zinc/29/64/64/1050296464.db2.gz HTPVJVCWWFTQRZ-UHFFFAOYSA-N 1 2 305.853 4.277 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2ccc(Cl)o2)c2cccnc2)cc1 ZINC000592456809 1050307332 /nfs/dbraw/zinc/30/73/32/1050307332.db2.gz IXZOCYJFLPLNOQ-QGZVFWFLSA-N 1 2 316.763 4.346 20 0 DIADLO Cc1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@@](C)(F)[C@H](F)C2)c1 ZINC001143672624 1050332974 /nfs/dbraw/zinc/33/29/74/1050332974.db2.gz NSWVHVRTCANQTQ-ZIAGYGMSSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@](C)(F)[C@H](F)C2)c1 ZINC001143672624 1050332984 /nfs/dbraw/zinc/33/29/84/1050332984.db2.gz NSWVHVRTCANQTQ-ZIAGYGMSSA-N 1 2 307.306 4.286 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)NCc1[nH+]cc(C)c(OC)c1C ZINC000735005687 1050336951 /nfs/dbraw/zinc/33/69/51/1050336951.db2.gz XHXPXNVJXZWOQH-MRXNPFEDSA-N 1 2 320.477 4.320 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2Cl)CCCC1=O ZINC001143709523 1050343730 /nfs/dbraw/zinc/34/37/30/1050343730.db2.gz FXQZTAZEPURYTJ-SNVBAGLBSA-N 1 2 319.754 4.160 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(C(F)(F)F)cc2Cl)CCCC1=O ZINC001143709523 1050343738 /nfs/dbraw/zinc/34/37/38/1050343738.db2.gz FXQZTAZEPURYTJ-SNVBAGLBSA-N 1 2 319.754 4.160 20 0 DIADLO C[N@@H+](Cc1ccccc1F)Cn1c2ccccc2oc1=S ZINC000058593818 1050346805 /nfs/dbraw/zinc/34/68/05/1050346805.db2.gz ASQPKSKQKBHLOZ-UHFFFAOYSA-N 1 2 302.374 4.192 20 0 DIADLO C[N@H+](Cc1ccccc1F)Cn1c2ccccc2oc1=S ZINC000058593818 1050346814 /nfs/dbraw/zinc/34/68/14/1050346814.db2.gz ASQPKSKQKBHLOZ-UHFFFAOYSA-N 1 2 302.374 4.192 20 0 DIADLO CCOc1cc[nH+]cc1Nc1ccc(OCC(F)(F)F)cc1 ZINC001210741207 1050357022 /nfs/dbraw/zinc/35/70/22/1050357022.db2.gz JSBLRQLMAVOYFX-UHFFFAOYSA-N 1 2 312.291 4.165 20 0 DIADLO Cc1cn2cccc(Nc3ccc(OCC(F)(F)F)cc3)c2[nH+]1 ZINC001210741816 1050357137 /nfs/dbraw/zinc/35/71/37/1050357137.db2.gz YXMBVTGKXWVNCI-UHFFFAOYSA-N 1 2 321.302 4.327 20 0 DIADLO C[N@@H+](Cc1c(F)ccc(Cl)c1Cl)C[C@@H]1CCCCO1 ZINC001143859968 1050379044 /nfs/dbraw/zinc/37/90/44/1050379044.db2.gz FKZPZEKMNILYQS-JTQLQIEISA-N 1 2 306.208 4.133 20 0 DIADLO C[N@H+](Cc1c(F)ccc(Cl)c1Cl)C[C@@H]1CCCCO1 ZINC001143859968 1050379051 /nfs/dbraw/zinc/37/90/51/1050379051.db2.gz FKZPZEKMNILYQS-JTQLQIEISA-N 1 2 306.208 4.133 20 0 DIADLO C[C@]1(F)CCC[N@H+](Cc2ccc(OC(F)(F)F)cc2F)C1 ZINC001143781278 1050358735 /nfs/dbraw/zinc/35/87/35/1050358735.db2.gz NHQPPGDCWWFWJE-ZDUSSCGKSA-N 1 2 309.278 4.048 20 0 DIADLO C[C@]1(F)CCC[N@@H+](Cc2ccc(OC(F)(F)F)cc2F)C1 ZINC001143781278 1050358742 /nfs/dbraw/zinc/35/87/42/1050358742.db2.gz NHQPPGDCWWFWJE-ZDUSSCGKSA-N 1 2 309.278 4.048 20 0 DIADLO CSc1cc(Nc2ccc(OCC(F)(F)F)cc2)cc[nH+]1 ZINC001210744924 1050358799 /nfs/dbraw/zinc/35/87/99/1050358799.db2.gz MMTFLEAHAHTUEE-UHFFFAOYSA-N 1 2 314.332 4.488 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCCc3sccc3C2)cs1 ZINC000592985190 1050359152 /nfs/dbraw/zinc/35/91/52/1050359152.db2.gz UYOCGVYQNVJZPD-UHFFFAOYSA-N 1 2 306.500 4.451 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCCc3sccc3C2)cs1 ZINC000592985190 1050359159 /nfs/dbraw/zinc/35/91/59/1050359159.db2.gz UYOCGVYQNVJZPD-UHFFFAOYSA-N 1 2 306.500 4.451 20 0 DIADLO COc1cc(Nc2ccccc2-c2ccccc2N)cc(C)[nH+]1 ZINC001210780491 1050369181 /nfs/dbraw/zinc/36/91/81/1050369181.db2.gz AMGFTOSHLIDSGV-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO COc1cc(Nc2ccc(Oc3nccs3)cc2)cc(C)[nH+]1 ZINC001210781640 1050370345 /nfs/dbraw/zinc/37/03/45/1050370345.db2.gz ZKHUCJFGJSQWCI-UHFFFAOYSA-N 1 2 313.382 4.391 20 0 DIADLO Cc1csc(C[NH2+][C@@H](c2cccnc2)c2cc(C)cc(C)c2)n1 ZINC000735321539 1050370558 /nfs/dbraw/zinc/37/05/58/1050370558.db2.gz VFDUVEPKWBKEDA-IBGZPJMESA-N 1 2 323.465 4.343 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3occc3Br)CCC2)cc1 ZINC000735322429 1050371426 /nfs/dbraw/zinc/37/14/26/1050371426.db2.gz GSCOEWCGWHCZKJ-UHFFFAOYSA-N 1 2 324.193 4.350 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@@H](c1ccccc1F)C1CCCC1 ZINC000826626309 1050373590 /nfs/dbraw/zinc/37/35/90/1050373590.db2.gz HROUPYAZRLHLNN-PIGZYNQJSA-N 1 2 303.381 4.099 20 0 DIADLO COC(=O)c1cccc([C@H](C)Nc2ccc([NH+](C)C)c(C)c2)c1 ZINC001171112126 1050375296 /nfs/dbraw/zinc/37/52/96/1050375296.db2.gz ZOBHRNAJFXOGCS-AWEZNQCLSA-N 1 2 312.413 4.021 20 0 DIADLO CCOc1c(Cl)ccc(C[N@H+](CC)Cc2ccccn2)c1F ZINC001143832684 1050375379 /nfs/dbraw/zinc/37/53/79/1050375379.db2.gz GGRYYUIJBJABGF-UHFFFAOYSA-N 1 2 322.811 4.295 20 0 DIADLO CCOc1c(Cl)ccc(C[N@@H+](CC)Cc2ccccn2)c1F ZINC001143832684 1050375385 /nfs/dbraw/zinc/37/53/85/1050375385.db2.gz GGRYYUIJBJABGF-UHFFFAOYSA-N 1 2 322.811 4.295 20 0 DIADLO CCO[C@@H]1CCC[N@H+](Cc2c(F)ccc(Cl)c2Cl)C1 ZINC001143860872 1050377628 /nfs/dbraw/zinc/37/76/28/1050377628.db2.gz VCZWRNGTIAJGOM-SNVBAGLBSA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@@H]1CCC[N@@H+](Cc2c(F)ccc(Cl)c2Cl)C1 ZINC001143860872 1050377634 /nfs/dbraw/zinc/37/76/34/1050377634.db2.gz VCZWRNGTIAJGOM-SNVBAGLBSA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@H]1CCC[N@H+](Cc2c(F)ccc(Cl)c2Cl)C1 ZINC001143860871 1050379105 /nfs/dbraw/zinc/37/91/05/1050379105.db2.gz VCZWRNGTIAJGOM-JTQLQIEISA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@H]1CCC[N@@H+](Cc2c(F)ccc(Cl)c2Cl)C1 ZINC001143860871 1050379107 /nfs/dbraw/zinc/37/91/07/1050379107.db2.gz VCZWRNGTIAJGOM-JTQLQIEISA-N 1 2 306.208 4.133 20 0 DIADLO CN(Cc1ccccc1)c1ccc([NH2+]C[C@@H]2CCSC2)cc1 ZINC000785491520 1050381885 /nfs/dbraw/zinc/38/18/85/1050381885.db2.gz ONAMTQRTQOFIEW-KRWDZBQOSA-N 1 2 312.482 4.488 20 0 DIADLO Cc1ccc(-c2cc[nH+]c(N[C@H](C)c3ncc(F)cn3)c2)cc1 ZINC001171113020 1050384042 /nfs/dbraw/zinc/38/40/42/1050384042.db2.gz UWVOODJOIKYERG-CYBMUJFWSA-N 1 2 308.360 4.159 20 0 DIADLO CN(c1ccc(Nc2cc(F)nc(F)c2)c[nH+]1)C1CCCCC1 ZINC001212613109 1050387490 /nfs/dbraw/zinc/38/74/90/1050387490.db2.gz DHGKGVZNMKDTAM-UHFFFAOYSA-N 1 2 318.371 4.267 20 0 DIADLO CC[C@@]1(C)Oc2ccc(NCc3c[nH+]c4c(C)cccn34)cc2O1 ZINC000785554213 1050389252 /nfs/dbraw/zinc/38/92/52/1050389252.db2.gz LNMQPWXXJCCJDX-IBGZPJMESA-N 1 2 323.396 4.152 20 0 DIADLO CCn1cc(Nc2ccc(N(C)C3CCCCC3)[nH+]c2)c(C)n1 ZINC001212613064 1050392082 /nfs/dbraw/zinc/39/20/82/1050392082.db2.gz AZDZTBHXPXFTFW-UHFFFAOYSA-N 1 2 313.449 4.119 20 0 DIADLO Cc1cc(C)c(C(=O)N(C)Cc2cccc3ccccc32)c(C)[nH+]1 ZINC001626003558 1050392423 /nfs/dbraw/zinc/39/24/23/1050392423.db2.gz BMRUZHKQQXTOLS-UHFFFAOYSA-N 1 2 318.420 4.432 20 0 DIADLO C[C@H](CC(=O)Oc1ccc2oc3c(c2c1)CCCC3)n1cc[nH+]c1 ZINC000844290713 1050394506 /nfs/dbraw/zinc/39/45/06/1050394506.db2.gz PULATJMENTZYOF-CYBMUJFWSA-N 1 2 324.380 4.065 20 0 DIADLO FC[C@@H]1CC[N@@H+]([C@@H]2CCc3cc(Cl)ccc3C2)CC1(F)F ZINC001171116326 1050396289 /nfs/dbraw/zinc/39/62/89/1050396289.db2.gz NKLUGZMYZIKXSG-DZGCQCFKSA-N 1 2 317.782 4.124 20 0 DIADLO FC[C@@H]1CC[N@H+]([C@@H]2CCc3cc(Cl)ccc3C2)CC1(F)F ZINC001171116326 1050396296 /nfs/dbraw/zinc/39/62/96/1050396296.db2.gz NKLUGZMYZIKXSG-DZGCQCFKSA-N 1 2 317.782 4.124 20 0 DIADLO FC[C@H]1CC[N@@H+]([C@H]2CCc3cc(Cl)ccc3C2)CC1(F)F ZINC001171116327 1050397320 /nfs/dbraw/zinc/39/73/20/1050397320.db2.gz NKLUGZMYZIKXSG-HIFRSBDPSA-N 1 2 317.782 4.124 20 0 DIADLO FC[C@H]1CC[N@H+]([C@H]2CCc3cc(Cl)ccc3C2)CC1(F)F ZINC001171116327 1050397333 /nfs/dbraw/zinc/39/73/33/1050397333.db2.gz NKLUGZMYZIKXSG-HIFRSBDPSA-N 1 2 317.782 4.124 20 0 DIADLO COc1ccc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c(F)c1F ZINC001143902928 1050398249 /nfs/dbraw/zinc/39/82/49/1050398249.db2.gz OASDKSNBRRCGCP-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c(F)c1F ZINC001143902928 1050398254 /nfs/dbraw/zinc/39/82/54/1050398254.db2.gz OASDKSNBRRCGCP-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(F)cc(F)cc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001210867448 1050398486 /nfs/dbraw/zinc/39/84/86/1050398486.db2.gz AFMDAXUEMHUCNA-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCC[C@H]2c2ccncc2)c1F ZINC001143895680 1050401649 /nfs/dbraw/zinc/40/16/49/1050401649.db2.gz DEMMMTFPYHCONO-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCC[C@H]2c2ccncc2)c1F ZINC001143895680 1050401653 /nfs/dbraw/zinc/40/16/53/1050401653.db2.gz DEMMMTFPYHCONO-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H](CSc1ccccc1)[N@H+](C)Cc1csc(Cl)n1 ZINC000844359437 1050407321 /nfs/dbraw/zinc/40/73/21/1050407321.db2.gz JXVLDVRVNDJAJR-NSHDSACASA-N 1 2 312.891 4.409 20 0 DIADLO C[C@@H](CSc1ccccc1)[N@@H+](C)Cc1csc(Cl)n1 ZINC000844359437 1050407326 /nfs/dbraw/zinc/40/73/26/1050407326.db2.gz JXVLDVRVNDJAJR-NSHDSACASA-N 1 2 312.891 4.409 20 0 DIADLO Clc1cccc2c(N[C@@H]3CCOC4(CCC4)C3)cc[nH+]c12 ZINC000574281739 1050408560 /nfs/dbraw/zinc/40/85/60/1050408560.db2.gz INMRNMSRAQCMLO-GFCCVEGCSA-N 1 2 302.805 4.402 20 0 DIADLO Cc1cc(NC(=O)CC2CCCCCC2)ccc1-n1cc[nH+]c1 ZINC001143940165 1050411153 /nfs/dbraw/zinc/41/11/53/1050411153.db2.gz VMHIHDNOBCXYEH-UHFFFAOYSA-N 1 2 311.429 4.480 20 0 DIADLO CCOc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2ccncc2)c1F ZINC001143937385 1050411208 /nfs/dbraw/zinc/41/12/08/1050411208.db2.gz LVESHAYRACHYQH-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(F)c(C[N@H+]2CCC[C@H]2c2ccncc2)c1F ZINC001143937385 1050411213 /nfs/dbraw/zinc/41/12/13/1050411213.db2.gz LVESHAYRACHYQH-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC[C@@H](F)C(F)(F)CC2)c1F ZINC001143946802 1050412401 /nfs/dbraw/zinc/41/24/01/1050412401.db2.gz WITCZVCDBXGTDM-LLVKDONJSA-N 1 2 313.697 4.187 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c1F ZINC001143946802 1050412403 /nfs/dbraw/zinc/41/24/03/1050412403.db2.gz WITCZVCDBXGTDM-LLVKDONJSA-N 1 2 313.697 4.187 20 0 DIADLO CCOc1ccc(F)c(C[N@H+](C)Cc2cccc(C)c2)c1F ZINC001143930312 1050412918 /nfs/dbraw/zinc/41/29/18/1050412918.db2.gz GCUHQQYWKWRMCB-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CCOc1ccc(F)c(C[N@@H+](C)Cc2cccc(C)c2)c1F ZINC001143930312 1050412927 /nfs/dbraw/zinc/41/29/27/1050412927.db2.gz GCUHQQYWKWRMCB-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO Oc1c(Cl)cc(Nc2ccnn2-c2cc[nH+]cc2)cc1Cl ZINC001210927854 1050418973 /nfs/dbraw/zinc/41/89/73/1050418973.db2.gz USKRQYUJJMELOA-UHFFFAOYSA-N 1 2 321.167 4.023 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(-c2ccccc2)n[nH]1)c1cccc(C)c1 ZINC000796895263 1050420862 /nfs/dbraw/zinc/42/08/62/1050420862.db2.gz ANIAXLCEBMHHIS-QGZVFWFLSA-N 1 2 306.413 4.021 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2cccnc2Cl)[C@H]1c1ccccc1 ZINC000735674596 1050422294 /nfs/dbraw/zinc/42/22/94/1050422294.db2.gz RROIGRWFRRUKDS-CZUORRHYSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2cccnc2Cl)[C@H]1c1ccccc1 ZINC000735674596 1050422303 /nfs/dbraw/zinc/42/23/03/1050422303.db2.gz RROIGRWFRRUKDS-CZUORRHYSA-N 1 2 318.873 4.414 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c1F ZINC001143979299 1050427615 /nfs/dbraw/zinc/42/76/15/1050427615.db2.gz YRKNLIRUTFVZPX-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2ccccc2F)c1F ZINC001143979299 1050427623 /nfs/dbraw/zinc/42/76/23/1050427623.db2.gz YRKNLIRUTFVZPX-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO CCCSc1ccc(COC(=O)C[C@@H](C)n2cc[nH+]c2)cc1 ZINC000844479949 1050428897 /nfs/dbraw/zinc/42/88/97/1050428897.db2.gz VLULBAVTACRTBF-CQSZACIVSA-N 1 2 318.442 4.080 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[N@H+](C)Cc1cnoc1C ZINC000844443805 1050429726 /nfs/dbraw/zinc/42/97/26/1050429726.db2.gz MSBPMGCJGMBGJX-OAHLLOKOSA-N 1 2 320.820 4.154 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[N@@H+](C)Cc1cnoc1C ZINC000844443805 1050429734 /nfs/dbraw/zinc/42/97/34/1050429734.db2.gz MSBPMGCJGMBGJX-OAHLLOKOSA-N 1 2 320.820 4.154 20 0 DIADLO C[N@H+](Cc1cncs1)Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC001143995834 1050434893 /nfs/dbraw/zinc/43/48/93/1050434893.db2.gz FMQHFMSOZYAZSI-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1cncs1)Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC001143995834 1050434899 /nfs/dbraw/zinc/43/48/99/1050434899.db2.gz FMQHFMSOZYAZSI-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO CC(C)[C@H](OC(=O)C[C@@H](C)n1cc[nH+]c1)c1ccc(F)c(F)c1 ZINC000844465397 1050435464 /nfs/dbraw/zinc/43/54/64/1050435464.db2.gz YWPJTUOXKOQVDU-PXAZEXFGSA-N 1 2 322.355 4.053 20 0 DIADLO CCc1ccc(N(CC(C)C)C(=O)C[C@@H](C)n2cc[nH+]c2)cc1 ZINC000844509307 1050436823 /nfs/dbraw/zinc/43/68/23/1050436823.db2.gz KMFRSVXXPRBJFI-MRXNPFEDSA-N 1 2 313.445 4.086 20 0 DIADLO Cc1cc(Nc2cccc(C(C)C)[nH+]2)ccc1N1CCOCC1 ZINC001210972517 1050437766 /nfs/dbraw/zinc/43/77/66/1050437766.db2.gz VDLPKQOYEDIEEZ-UHFFFAOYSA-N 1 2 311.429 4.094 20 0 DIADLO CC(C)[C@@H]1C[C@@H](OC(=O)C[C@@H](C)n2cc[nH+]c2)c2ccccc21 ZINC000844506729 1050445367 /nfs/dbraw/zinc/44/53/67/1050445367.db2.gz MAZQEAJOVRZYQM-FHLIZLRMSA-N 1 2 312.413 4.262 20 0 DIADLO Cc1ccc(Nc2cccc([C@H]3CN4C=CSC4=N3)c2)[nH+]c1 ZINC001211013473 1050446634 /nfs/dbraw/zinc/44/66/34/1050446634.db2.gz ZTZKUDAWFSHSNT-OAHLLOKOSA-N 1 2 308.410 4.064 20 0 DIADLO Cc1ccc(Nc2ccc(F)c(C(=O)OC(C)(C)C)c2)[nH+]c1 ZINC001211013127 1050446821 /nfs/dbraw/zinc/44/68/21/1050446821.db2.gz RIXVKPCXJOCDQU-UHFFFAOYSA-N 1 2 302.349 4.228 20 0 DIADLO Cc1cn2c(cccc2Nc2cncc(-c3ccccc3)c2)[nH+]1 ZINC001211019708 1050448475 /nfs/dbraw/zinc/44/84/75/1050448475.db2.gz AUUAMTWESPSLOL-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO Cc1ccc(Oc2cccc(C[N@@H+]3CCC(=O)[C@@H](C)C3)c2)cc1 ZINC001144086200 1050456382 /nfs/dbraw/zinc/45/63/82/1050456382.db2.gz NWADIPZDQVCHIA-INIZCTEOSA-N 1 2 309.409 4.198 20 0 DIADLO Cc1ccc(Oc2cccc(C[N@H+]3CCC(=O)[C@@H](C)C3)c2)cc1 ZINC001144086200 1050456386 /nfs/dbraw/zinc/45/63/86/1050456386.db2.gz NWADIPZDQVCHIA-INIZCTEOSA-N 1 2 309.409 4.198 20 0 DIADLO Cc1cc(Br)cc(C[N@@H+]2CCC[C@](C)(F)C2)c1 ZINC001144214624 1050495723 /nfs/dbraw/zinc/49/57/23/1050495723.db2.gz IZCQDOSRRXDQKM-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cc(Br)cc(C[N@H+]2CCC[C@](C)(F)C2)c1 ZINC001144214624 1050495731 /nfs/dbraw/zinc/49/57/31/1050495731.db2.gz IZCQDOSRRXDQKM-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CC[C@H](C(F)(F)F)C3)co2)cc1 ZINC000761044859 1050473675 /nfs/dbraw/zinc/47/36/75/1050473675.db2.gz GXHRCDVNSZHNJA-ZDUSSCGKSA-N 1 2 310.319 4.034 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CC[C@H](C(F)(F)F)C3)co2)cc1 ZINC000761044859 1050473685 /nfs/dbraw/zinc/47/36/85/1050473685.db2.gz GXHRCDVNSZHNJA-ZDUSSCGKSA-N 1 2 310.319 4.034 20 0 DIADLO Cc1ccc(N(CC(C)C)C(=O)C[C@@H](C)n2cc[nH+]c2)c(C)c1 ZINC000844660401 1050476961 /nfs/dbraw/zinc/47/69/61/1050476961.db2.gz GGSQEDHRXNLDKQ-QGZVFWFLSA-N 1 2 313.445 4.140 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+]3CC[C@@H](C(F)(F)F)C3)o2)cc1 ZINC000761049614 1050488028 /nfs/dbraw/zinc/48/80/28/1050488028.db2.gz IIUCEINTFUKTOJ-CYBMUJFWSA-N 1 2 310.319 4.034 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+]3CC[C@@H](C(F)(F)F)C3)o2)cc1 ZINC000761049614 1050488036 /nfs/dbraw/zinc/48/80/36/1050488036.db2.gz IIUCEINTFUKTOJ-CYBMUJFWSA-N 1 2 310.319 4.034 20 0 DIADLO Cc1cc(Br)cc(C[N@@H+]2CCCC[C@H](F)C2)c1 ZINC001144212842 1050495413 /nfs/dbraw/zinc/49/54/13/1050495413.db2.gz MIFYMXWUSMAHPY-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cc(Br)cc(C[N@H+]2CCCC[C@H](F)C2)c1 ZINC001144212842 1050495419 /nfs/dbraw/zinc/49/54/19/1050495419.db2.gz MIFYMXWUSMAHPY-AWEZNQCLSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1nn(C[N@H+]2C[C@H](c3ccccc3C)C[C@@H]2C)c(=S)s1 ZINC000738054888 1050523128 /nfs/dbraw/zinc/52/31/28/1050523128.db2.gz QGNAIHXVBANVLT-GXTWGEPZSA-N 1 2 319.499 4.126 20 0 DIADLO Cc1nn(C[N@@H+]2C[C@H](c3ccccc3C)C[C@@H]2C)c(=S)s1 ZINC000738054888 1050523139 /nfs/dbraw/zinc/52/31/39/1050523139.db2.gz QGNAIHXVBANVLT-GXTWGEPZSA-N 1 2 319.499 4.126 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cnccc2Br)cc1 ZINC001211237053 1050525166 /nfs/dbraw/zinc/52/51/66/1050525166.db2.gz GGAYDUYHCXADNG-UHFFFAOYSA-N 1 2 306.207 4.044 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cnccc2Br)cc1 ZINC001211237053 1050525181 /nfs/dbraw/zinc/52/51/81/1050525181.db2.gz GGAYDUYHCXADNG-UHFFFAOYSA-N 1 2 306.207 4.044 20 0 DIADLO CC[N@H+](Cn1nc(-c2ccc(C)cc2C)oc1=S)C1CCC1 ZINC000738052234 1050525514 /nfs/dbraw/zinc/52/55/14/1050525514.db2.gz GHNOUUQWTYWYJA-UHFFFAOYSA-N 1 2 317.458 4.321 20 0 DIADLO CC[N@@H+](Cn1nc(-c2ccc(C)cc2C)oc1=S)C1CCC1 ZINC000738052234 1050525527 /nfs/dbraw/zinc/52/55/27/1050525527.db2.gz GHNOUUQWTYWYJA-UHFFFAOYSA-N 1 2 317.458 4.321 20 0 DIADLO Cc1ccc([C@@H]2[C@H](C)CCC[N@@H+]2Cn2ncsc2=S)cc1 ZINC000738284972 1050527669 /nfs/dbraw/zinc/52/76/69/1050527669.db2.gz NSEXNUKFCAHLDR-HIFRSBDPSA-N 1 2 319.499 4.413 20 0 DIADLO Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2Cn2ncsc2=S)cc1 ZINC000738284972 1050527675 /nfs/dbraw/zinc/52/76/75/1050527675.db2.gz NSEXNUKFCAHLDR-HIFRSBDPSA-N 1 2 319.499 4.413 20 0 DIADLO COCCOc1cc(N[C@@H](c2ccc(F)cc2)C(C)C)cc[nH+]1 ZINC001170066277 1050536664 /nfs/dbraw/zinc/53/66/64/1050536664.db2.gz JWRZVUAKEMYIIV-GOSISDBHSA-N 1 2 318.392 4.055 20 0 DIADLO CCc1cccc(C[NH+](Cc2ccccn2)Cc2ccccn2)c1 ZINC001144315236 1050540923 /nfs/dbraw/zinc/54/09/23/1050540923.db2.gz MITWIFFSAHANHE-UHFFFAOYSA-N 1 2 317.436 4.241 20 0 DIADLO COc1cc(Nc2cccc3[nH+]c(C)cn32)cc(C(F)(F)F)c1 ZINC001211334336 1050548280 /nfs/dbraw/zinc/54/82/80/1050548280.db2.gz RMERLWTWFKASCB-UHFFFAOYSA-N 1 2 321.302 4.414 20 0 DIADLO COc1cc(Nc2cccn3cc(C)[nH+]c23)cc(C(F)(F)F)c1 ZINC001211334278 1050549088 /nfs/dbraw/zinc/54/90/88/1050549088.db2.gz JKKZTXIYEYYZED-UHFFFAOYSA-N 1 2 321.302 4.414 20 0 DIADLO Cc1cn2cc(NC(=O)N(C)C3CCCCCCC3)ccc2[nH+]1 ZINC000738920482 1050557549 /nfs/dbraw/zinc/55/75/49/1050557549.db2.gz RDLBLMOTHAJVDG-UHFFFAOYSA-N 1 2 314.433 4.219 20 0 DIADLO CCCOc1ccccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001211383144 1050558379 /nfs/dbraw/zinc/55/83/79/1050558379.db2.gz VBBGVSJQYVMROF-UHFFFAOYSA-N 1 2 307.397 4.464 20 0 DIADLO C[C@@H](CC(=O)O[C@@H](C)c1ccc2ccccc2c1)n1cc[nH+]c1 ZINC000845281522 1050560005 /nfs/dbraw/zinc/56/00/05/1050560005.db2.gz KUXKZFOMTNKMFL-GJZGRUSLSA-N 1 2 308.381 4.292 20 0 DIADLO CCCCOC(=O)C[N@H+](C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000746653276 1050560186 /nfs/dbraw/zinc/56/01/86/1050560186.db2.gz SJONJVJGRFALCH-LBPRGKRZSA-N 1 2 317.351 4.042 20 0 DIADLO CCCCOC(=O)C[N@@H+](C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000746653276 1050560194 /nfs/dbraw/zinc/56/01/94/1050560194.db2.gz SJONJVJGRFALCH-LBPRGKRZSA-N 1 2 317.351 4.042 20 0 DIADLO Fc1ccc(-n2nccc2Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001213086862 1050582346 /nfs/dbraw/zinc/58/23/46/1050582346.db2.gz DKFALVXRDMCFFN-UHFFFAOYSA-N 1 2 319.343 4.145 20 0 DIADLO COc1cccc2cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cnc21 ZINC001213087502 1050582412 /nfs/dbraw/zinc/58/24/12/1050582412.db2.gz QEYBNZZAXYJPMZ-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO Cc1cn(-c2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2)cn1 ZINC001213087789 1050583036 /nfs/dbraw/zinc/58/30/36/1050583036.db2.gz AMHNZMAYMNTFHO-UHFFFAOYSA-N 1 2 315.380 4.314 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3csc(-c4ccncc4)n3)cc2)[nH]1 ZINC001213088158 1050584238 /nfs/dbraw/zinc/58/42/38/1050584238.db2.gz SPVYRQNRSIMGLU-UHFFFAOYSA-N 1 2 319.393 4.339 20 0 DIADLO CC(=O)c1c(F)cc(F)cc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213090721 1050585004 /nfs/dbraw/zinc/58/50/04/1050585004.db2.gz CQQJPTRSYILVMM-UHFFFAOYSA-N 1 2 313.307 4.301 20 0 DIADLO CCn1cc2cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)ccc2n1 ZINC001213089770 1050585459 /nfs/dbraw/zinc/58/54/59/1050585459.db2.gz DAMFWBCWPJEYIZ-UHFFFAOYSA-N 1 2 303.369 4.190 20 0 DIADLO COC(=O)c1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(C)cc1C ZINC001213090940 1050585495 /nfs/dbraw/zinc/58/54/95/1050585495.db2.gz NSMAQBKWBUVETG-UHFFFAOYSA-N 1 2 321.380 4.224 20 0 DIADLO COc1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc2cccnc21 ZINC001213091133 1050585824 /nfs/dbraw/zinc/58/58/24/1050585824.db2.gz XYTMNBFBLHKHHA-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO O=c1ccc2c(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cccc2[nH]1 ZINC001213090141 1050585879 /nfs/dbraw/zinc/58/58/79/1050585879.db2.gz WGEDSCOBGWWNIA-UHFFFAOYSA-N 1 2 302.337 4.074 20 0 DIADLO COc1ccc2cccnc2c1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213091703 1050586378 /nfs/dbraw/zinc/58/63/78/1050586378.db2.gz GWNRBULSNFCTIH-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO COc1ccc(C(C)=O)c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1C ZINC001213090161 1050587173 /nfs/dbraw/zinc/58/71/73/1050587173.db2.gz XDNRHVBAUFAZCC-UHFFFAOYSA-N 1 2 321.380 4.340 20 0 DIADLO CN1c2ccc(Nc3cccc(C4CCC4)[nH+]3)cc2CCC1=O ZINC001213130846 1050597520 /nfs/dbraw/zinc/59/75/20/1050597520.db2.gz OWGHWFSROMZKON-UHFFFAOYSA-N 1 2 307.397 4.002 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1ccc2c(c1)CCC(=O)N2C ZINC001213130970 1050598010 /nfs/dbraw/zinc/59/80/10/1050598010.db2.gz SPPZXLLSEZSTQV-UHFFFAOYSA-N 1 2 323.440 4.241 20 0 DIADLO CN(c1ccc(Nc2cc(F)ncc2F)c[nH+]1)C1CCCCC1 ZINC001212614837 1050600621 /nfs/dbraw/zinc/60/06/21/1050600621.db2.gz XDDRVQHCSDSHAL-UHFFFAOYSA-N 1 2 318.371 4.267 20 0 DIADLO CC1(C)C[N@H+](Cc2cccnc2C(F)(F)F)Cc2ccccc21 ZINC001144538836 1050611308 /nfs/dbraw/zinc/61/13/08/1050611308.db2.gz SCOHIPYDHQWFJJ-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccnc2C(F)(F)F)Cc2ccccc21 ZINC001144538836 1050611317 /nfs/dbraw/zinc/61/13/17/1050611317.db2.gz SCOHIPYDHQWFJJ-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)cc(O)cc2F)cc1 ZINC001144554889 1050612283 /nfs/dbraw/zinc/61/22/83/1050612283.db2.gz LCSOCKZOPYGJKI-SFHVURJKSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)cc(O)cc2F)cc1 ZINC001144554889 1050612290 /nfs/dbraw/zinc/61/22/90/1050612290.db2.gz LCSOCKZOPYGJKI-SFHVURJKSA-N 1 2 303.352 4.316 20 0 DIADLO Clc1ccccc1[C@H]1CCC[N@@H+]1Cc1ncn2ccccc12 ZINC001144623674 1050632633 /nfs/dbraw/zinc/63/26/33/1050632633.db2.gz ZPYJWYMSQYNDSR-QGZVFWFLSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1ccccc1[C@H]1CCC[N@H+]1Cc1ncn2ccccc12 ZINC001144623674 1050632640 /nfs/dbraw/zinc/63/26/40/1050632640.db2.gz ZPYJWYMSQYNDSR-QGZVFWFLSA-N 1 2 311.816 4.325 20 0 DIADLO COc1cccc([C@H]2CCCCN2Cc2[nH+]cn3ccccc23)c1 ZINC001144623119 1050633021 /nfs/dbraw/zinc/63/30/21/1050633021.db2.gz QFUXRAJFHFYRLK-LJQANCHMSA-N 1 2 321.424 4.070 20 0 DIADLO CN(Cc1[nH+]cn2ccccc12)Cc1cccc2ccccc21 ZINC001144623680 1050633115 /nfs/dbraw/zinc/63/31/15/1050633115.db2.gz ZXQKHXWZIJAMLB-UHFFFAOYSA-N 1 2 301.393 4.120 20 0 DIADLO C[C@@H]1C[C@H](C)[N@H+](Cn2nc(-c3ccccc3Cl)oc2=S)C1 ZINC000740862022 1050634288 /nfs/dbraw/zinc/63/42/88/1050634288.db2.gz VBIGUQQWLNKNMA-MNOVXSKESA-N 1 2 323.849 4.214 20 0 DIADLO C[C@@H]1C[C@H](C)[N@@H+](Cn2nc(-c3ccccc3Cl)oc2=S)C1 ZINC000740862022 1050634293 /nfs/dbraw/zinc/63/42/93/1050634293.db2.gz VBIGUQQWLNKNMA-MNOVXSKESA-N 1 2 323.849 4.214 20 0 DIADLO C[C@H]1C[C@H](C)[N@H+](Cn2nc(-c3ccccc3Cl)oc2=S)C1 ZINC000740862023 1050634735 /nfs/dbraw/zinc/63/47/35/1050634735.db2.gz VBIGUQQWLNKNMA-QWRGUYRKSA-N 1 2 323.849 4.214 20 0 DIADLO C[C@H]1C[C@H](C)[N@@H+](Cn2nc(-c3ccccc3Cl)oc2=S)C1 ZINC000740862023 1050634747 /nfs/dbraw/zinc/63/47/47/1050634747.db2.gz VBIGUQQWLNKNMA-QWRGUYRKSA-N 1 2 323.849 4.214 20 0 DIADLO C[C@@H]1C[C@@H](C)[N@H+](Cn2nc(-c3ccccc3Cl)oc2=S)C1 ZINC000740862021 1050635198 /nfs/dbraw/zinc/63/51/98/1050635198.db2.gz VBIGUQQWLNKNMA-GHMZBOCLSA-N 1 2 323.849 4.214 20 0 DIADLO C[C@@H]1C[C@@H](C)[N@@H+](Cn2nc(-c3ccccc3Cl)oc2=S)C1 ZINC000740862021 1050635210 /nfs/dbraw/zinc/63/52/10/1050635210.db2.gz VBIGUQQWLNKNMA-GHMZBOCLSA-N 1 2 323.849 4.214 20 0 DIADLO COc1cccc(C(F)(F)F)c1Nc1ccc2c(c1)[nH+]cn2C ZINC001213345466 1050637005 /nfs/dbraw/zinc/63/70/05/1050637005.db2.gz UTGMGCVXZSAYAE-UHFFFAOYSA-N 1 2 321.302 4.344 20 0 DIADLO Oc1cc(F)c(C[NH+]2CCC(c3ccccc3F)CC2)cc1F ZINC001144667671 1050646210 /nfs/dbraw/zinc/64/62/10/1050646210.db2.gz XPJHMQFNGKFYRX-UHFFFAOYSA-N 1 2 321.342 4.189 20 0 DIADLO C[C@@H]([NH2+]Cc1noc2c1CCCC2)c1cccc(OC(F)F)c1 ZINC000179588381 1050646920 /nfs/dbraw/zinc/64/69/20/1050646920.db2.gz CVDUBSZIVNKICP-LLVKDONJSA-N 1 2 322.355 4.006 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)cc1F ZINC001144658481 1050649463 /nfs/dbraw/zinc/64/94/63/1050649463.db2.gz YDPZQYIVKFXQBU-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)cc1F ZINC001144658481 1050649470 /nfs/dbraw/zinc/64/94/70/1050649470.db2.gz YDPZQYIVKFXQBU-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO CCCCCC(=O)N[C@@H]1CCc2[nH+]c(C3CCCCC3)[nH]c2C1 ZINC000788246016 1050660638 /nfs/dbraw/zinc/66/06/38/1050660638.db2.gz IHUDRNITMBRKEV-OAHLLOKOSA-N 1 2 317.477 4.011 20 0 DIADLO CCCCCC(=O)N[C@@H]1CCc2[nH]c(C3CCCCC3)[nH+]c2C1 ZINC000788246016 1050660649 /nfs/dbraw/zinc/66/06/49/1050660649.db2.gz IHUDRNITMBRKEV-OAHLLOKOSA-N 1 2 317.477 4.011 20 0 DIADLO COC(=O)c1oc([C@H](C)[N@@H+]2CC[C@H]2c2ccc(F)cc2)cc1C ZINC000595701876 1050663170 /nfs/dbraw/zinc/66/31/70/1050663170.db2.gz GWQHSAFMQWJGQZ-WFASDCNBSA-N 1 2 317.360 4.022 20 0 DIADLO COC(=O)c1oc([C@H](C)[N@H+]2CC[C@H]2c2ccc(F)cc2)cc1C ZINC000595701876 1050663176 /nfs/dbraw/zinc/66/31/76/1050663176.db2.gz GWQHSAFMQWJGQZ-WFASDCNBSA-N 1 2 317.360 4.022 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccnc(F)c1Br ZINC001213495117 1050669588 /nfs/dbraw/zinc/66/95/88/1050669588.db2.gz QYSNXKPUZVNINC-UHFFFAOYSA-N 1 2 322.181 4.308 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ncc(C(F)(F)F)cc1N ZINC001213495012 1050669610 /nfs/dbraw/zinc/66/96/10/1050669610.db2.gz PKVDEFXCYWCPBU-UHFFFAOYSA-N 1 2 308.307 4.007 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnc2cc(C3CCC3)nn2c1 ZINC001213497108 1050671526 /nfs/dbraw/zinc/67/15/26/1050671526.db2.gz JBTIDWXCWGCKIA-UHFFFAOYSA-N 1 2 319.412 4.321 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(Br)cc1O ZINC001213499484 1050671749 /nfs/dbraw/zinc/67/17/49/1050671749.db2.gz LEXQMKVGZCEQMY-UHFFFAOYSA-N 1 2 319.202 4.479 20 0 DIADLO CCOC(=O)Cc1ccc(Nc2cc(C3CC3)c[nH+]c2C)cc1 ZINC001213499361 1050672122 /nfs/dbraw/zinc/67/21/22/1050672122.db2.gz HXUHTGKPKHFUFZ-UHFFFAOYSA-N 1 2 310.397 4.117 20 0 DIADLO Cc1cc(=O)oc2cc(Nc3cc(C4CC4)c[nH+]c3C)ccc12 ZINC001213499431 1050672498 /nfs/dbraw/zinc/67/24/98/1050672498.db2.gz JVZRJTRKKQJZNO-UHFFFAOYSA-N 1 2 306.365 4.426 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(O)c(Br)c1 ZINC001213499268 1050672616 /nfs/dbraw/zinc/67/26/16/1050672616.db2.gz GCDKMNAXOMXWQR-UHFFFAOYSA-N 1 2 319.202 4.479 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2c(c1)C(C)(C)NC(=O)N2 ZINC001213503801 1050673944 /nfs/dbraw/zinc/67/39/44/1050673944.db2.gz YSUHTAJMXDSRJQ-UHFFFAOYSA-N 1 2 322.412 4.381 20 0 DIADLO COC(=O)[C@@H]1CCc2cc(Nc3cc(C4CC4)c[nH+]c3C)ccc21 ZINC001213503703 1050674234 /nfs/dbraw/zinc/67/42/34/1050674234.db2.gz TUAXAZYYDAJXBE-GOSISDBHSA-N 1 2 322.408 4.214 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cccc2c1C(=O)N(C1CC1)C2 ZINC001213503487 1050674257 /nfs/dbraw/zinc/67/42/57/1050674257.db2.gz JECMJDFBLTVISZ-UHFFFAOYSA-N 1 2 319.408 4.129 20 0 DIADLO Cc1cc(C)c(Nc2ccc(F)c(Br)c2O)c[nH+]1 ZINC001213518568 1050678725 /nfs/dbraw/zinc/67/87/25/1050678725.db2.gz VRSAUQYPTFMROI-UHFFFAOYSA-N 1 2 311.154 4.049 20 0 DIADLO CC(C)OC1CC[NH+](Cc2cc(F)c(F)cc2Cl)CC1 ZINC001144726101 1050674616 /nfs/dbraw/zinc/67/46/16/1050674616.db2.gz DTILKIHNBPHMJJ-UHFFFAOYSA-N 1 2 303.780 4.008 20 0 DIADLO COC(=O)c1c(F)ccc(Nc2cc(C3CC3)c[nH+]c2C)c1F ZINC001213500923 1050674713 /nfs/dbraw/zinc/67/47/13/1050674713.db2.gz CTPISRKJPJXHBT-UHFFFAOYSA-N 1 2 318.323 4.076 20 0 DIADLO COCCOc1ccc(Nc2cc(C3CC3)c[nH+]c2C)cc1F ZINC001213501436 1050674736 /nfs/dbraw/zinc/67/47/36/1050674736.db2.gz YNNZOOBMPIVDII-UHFFFAOYSA-N 1 2 316.376 4.175 20 0 DIADLO Cc1cc(C)c(Nc2ccc(NC(=O)OC(C)(C)C)nc2)c[nH+]1 ZINC001213510939 1050676401 /nfs/dbraw/zinc/67/64/01/1050676401.db2.gz NEWHUQLWHSDJBL-UHFFFAOYSA-N 1 2 314.389 4.184 20 0 DIADLO Cc1cc(Nc2c[nH+]c(C)cc2C)n(Cc2ccc(F)cc2)n1 ZINC001213510929 1050676474 /nfs/dbraw/zinc/67/64/74/1050676474.db2.gz MTNBSDRSCSLOSH-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO CCc1cc(Br)ncc1Nc1c[nH+]c(C)cc1C ZINC001213510746 1050676792 /nfs/dbraw/zinc/67/67/92/1050676792.db2.gz IOVPEPNUGHNYGZ-UHFFFAOYSA-N 1 2 306.207 4.162 20 0 DIADLO Cc1nc([C@H]([NH2+][C@H](C)C2CCCC2)c2ccc(Cl)cc2)no1 ZINC000179894713 1050676778 /nfs/dbraw/zinc/67/67/78/1050676778.db2.gz DPQAXADHENLJDF-BDJLRTHQSA-N 1 2 319.836 4.289 20 0 DIADLO CC(=O)Nc1ccc(Nc2c[nH+]c(C)cc2C)cc1C(F)(F)F ZINC001213513329 1050677684 /nfs/dbraw/zinc/67/76/84/1050677684.db2.gz CVOIMBMJWBCBQR-UHFFFAOYSA-N 1 2 323.318 4.419 20 0 DIADLO Cc1cc(C)c(Nc2c(F)cccc2C(=O)C(F)(F)F)c[nH+]1 ZINC001213521112 1050678739 /nfs/dbraw/zinc/67/87/39/1050678739.db2.gz UMHJFULLWXCLAJ-UHFFFAOYSA-N 1 2 312.266 4.326 20 0 DIADLO COCc1ccc(Br)c(Nc2c[nH+]c(C)cc2C)c1 ZINC001213521090 1050680206 /nfs/dbraw/zinc/68/02/06/1050680206.db2.gz SPHVBDJZVBUEFS-UHFFFAOYSA-N 1 2 321.218 4.351 20 0 DIADLO COc1ccc(Nc2c[nH+]cc(C)c2C)c(Br)c1 ZINC001213530823 1050681897 /nfs/dbraw/zinc/68/18/97/1050681897.db2.gz NDNMPWDVIFISOK-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1c[nH+]cc(Nc2c(F)cccc2OC[C@@H]2CCCO2)c1C ZINC001213533944 1050682155 /nfs/dbraw/zinc/68/21/55/1050682155.db2.gz DDTPARVRDQIDLL-AWEZNQCLSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1c[nH+]cc(Nc2cccc(C(=O)Nc3cccnc3)c2)c1C ZINC001213532721 1050682400 /nfs/dbraw/zinc/68/24/00/1050682400.db2.gz RHIILAKEQYRVJF-UHFFFAOYSA-N 1 2 318.380 4.089 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(C(=O)OC(C)(C)C)cc2O)c1C ZINC001213536976 1050682412 /nfs/dbraw/zinc/68/24/12/1050682412.db2.gz VMWHPROUENQALE-UHFFFAOYSA-N 1 2 314.385 4.103 20 0 DIADLO Fc1cc(Cl)c(C[N@H+]2CC[C@H](F)C(F)(F)CC2)cc1F ZINC001144721977 1050684736 /nfs/dbraw/zinc/68/47/36/1050684736.db2.gz JQMPUCJUOGEBFA-LBPRGKRZSA-N 1 2 313.697 4.187 20 0 DIADLO Fc1cc(Cl)c(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)cc1F ZINC001144721977 1050684739 /nfs/dbraw/zinc/68/47/39/1050684739.db2.gz JQMPUCJUOGEBFA-LBPRGKRZSA-N 1 2 313.697 4.187 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2cnc(Cl)cn2)C2CC2)o1 ZINC000788471865 1050685826 /nfs/dbraw/zinc/68/58/26/1050685826.db2.gz VOPHORGDVHEFBX-XHDPSFHLSA-N 1 2 317.820 4.011 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cnc(Cl)cn2)C2CC2)o1 ZINC000788471865 1050685836 /nfs/dbraw/zinc/68/58/36/1050685836.db2.gz VOPHORGDVHEFBX-XHDPSFHLSA-N 1 2 317.820 4.011 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cnc(Cl)cn2)C2CC2)o1 ZINC000788471863 1050685947 /nfs/dbraw/zinc/68/59/47/1050685947.db2.gz VOPHORGDVHEFBX-NHYWBVRUSA-N 1 2 317.820 4.011 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cnc(Cl)cn2)C2CC2)o1 ZINC000788471863 1050685955 /nfs/dbraw/zinc/68/59/55/1050685955.db2.gz VOPHORGDVHEFBX-NHYWBVRUSA-N 1 2 317.820 4.011 20 0 DIADLO COCc1ccc(C)c(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001213576780 1050686888 /nfs/dbraw/zinc/68/68/88/1050686888.db2.gz WBLBSYMPMPGHIB-UHFFFAOYSA-N 1 2 307.397 4.130 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(Cl)cn1)c1ccc(Cl)cc1Cl ZINC000788487490 1050691388 /nfs/dbraw/zinc/69/13/88/1050691388.db2.gz HVSAROQIYNLFAP-MRVPVSSYSA-N 1 2 316.619 4.288 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC001144744584 1050695356 /nfs/dbraw/zinc/69/53/56/1050695356.db2.gz ADLGNNKYYIUVGL-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC001144744584 1050695359 /nfs/dbraw/zinc/69/53/59/1050695359.db2.gz ADLGNNKYYIUVGL-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2ccc(OC)cc2Cl)c1 ZINC000846216842 1050696973 /nfs/dbraw/zinc/69/69/73/1050696973.db2.gz VZQDKHNTZLAADC-NSHDSACASA-N 1 2 306.793 4.063 20 0 DIADLO CCn1cnnc1C[NH2+][C@H](C)c1ccccc1SC(C)(C)C ZINC000788525909 1050704071 /nfs/dbraw/zinc/70/40/71/1050704071.db2.gz GDQQYOIAOSHNSP-CYBMUJFWSA-N 1 2 318.490 4.039 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+][C@H]1CCc2ccc(Cl)nc21 ZINC000788575483 1050709215 /nfs/dbraw/zinc/70/92/15/1050709215.db2.gz XGBLQIZGIUJEPW-ZDUSSCGKSA-N 1 2 311.187 4.305 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccccc1SC(C)(C)C)c1nncn1C ZINC000788589415 1050711592 /nfs/dbraw/zinc/71/15/92/1050711592.db2.gz RFMJZXPGEVJVLQ-CHWSQXEVSA-N 1 2 318.490 4.118 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H](Cc1ccccc1)c1ccccc1 ZINC000180002002 1050711919 /nfs/dbraw/zinc/71/19/19/1050711919.db2.gz UMBIJTGCPPLEGY-MGPUTAFESA-N 1 2 305.425 4.353 20 0 DIADLO Clc1cccc2c1[C@H]([NH2+]Cc1cc3ccccc3o1)COC2 ZINC000788646854 1050715915 /nfs/dbraw/zinc/71/59/15/1050715915.db2.gz DRSBRPVNRROBLY-MRXNPFEDSA-N 1 2 313.784 4.447 20 0 DIADLO FC(F)(F)c1cc(CSCCn2cc[nH+]c2)ccc1Cl ZINC000596389572 1050716632 /nfs/dbraw/zinc/71/66/32/1050716632.db2.gz QAOQFNOMXZGWMT-UHFFFAOYSA-N 1 2 320.767 4.489 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CCC[C@@H](C)C3)c2)[nH+]c1C ZINC000741673437 1050726720 /nfs/dbraw/zinc/72/67/20/1050726720.db2.gz TWCSTXMKWADYHO-MLGOLLRUSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H]1CCc2ccc(Cl)nc21 ZINC000788693037 1050726964 /nfs/dbraw/zinc/72/69/64/1050726964.db2.gz UJLOSRKBIRECRN-HNNXBMFYSA-N 1 2 301.821 4.209 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000741783900 1050740130 /nfs/dbraw/zinc/74/01/30/1050740130.db2.gz DHNWKQHIENWLQS-RDTXWAMCSA-N 1 2 314.429 4.037 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000741783900 1050740143 /nfs/dbraw/zinc/74/01/43/1050740143.db2.gz DHNWKQHIENWLQS-RDTXWAMCSA-N 1 2 314.429 4.037 20 0 DIADLO Cc1cc2cc(Nc3ccc(Cn4cc[nH+]c4)cc3)ccc2[nH]1 ZINC001213791592 1050742528 /nfs/dbraw/zinc/74/25/28/1050742528.db2.gz KDUGSAUWDYNPBC-UHFFFAOYSA-N 1 2 302.381 4.465 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1cnc(Cl)c(F)c1)C1CC1 ZINC000846762500 1050744637 /nfs/dbraw/zinc/74/46/37/1050744637.db2.gz GEPWCOCBJOARNX-UHFFFAOYSA-N 1 2 308.759 4.178 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1cnc(Cl)c(F)c1)C1CC1 ZINC000846762500 1050744650 /nfs/dbraw/zinc/74/46/50/1050744650.db2.gz GEPWCOCBJOARNX-UHFFFAOYSA-N 1 2 308.759 4.178 20 0 DIADLO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846870565 1050767599 /nfs/dbraw/zinc/76/75/99/1050767599.db2.gz ZZKFDIQKZGBLCS-SNVBAGLBSA-N 1 2 310.722 4.037 20 0 DIADLO Cc1ncc(C(F)(F)F)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001213824389 1050754248 /nfs/dbraw/zinc/75/42/48/1050754248.db2.gz BJPLPJZOACCFRJ-UHFFFAOYSA-N 1 2 322.334 4.148 20 0 DIADLO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1cnc(Cl)c(F)c1 ZINC000846870565 1050767611 /nfs/dbraw/zinc/76/76/11/1050767611.db2.gz ZZKFDIQKZGBLCS-SNVBAGLBSA-N 1 2 310.722 4.037 20 0 DIADLO Cc1ncc(C(F)(F)F)cc1Nc1ccccc1-n1cc[nH+]c1 ZINC001213830786 1050755629 /nfs/dbraw/zinc/75/56/29/1050755629.db2.gz KVSFWZWMIPTJRQ-UHFFFAOYSA-N 1 2 318.302 4.338 20 0 DIADLO c1cc(N2CCSCC2)ccc1[NH2+][C@@H]1CCC12CCCC2 ZINC000788984025 1050771792 /nfs/dbraw/zinc/77/17/92/1050771792.db2.gz MGPXLZRXVOWTMS-QGZVFWFLSA-N 1 2 302.487 4.375 20 0 DIADLO FC(F)(F)Cc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)cn1 ZINC001213913411 1050777625 /nfs/dbraw/zinc/77/76/25/1050777625.db2.gz CTFCJBCBHFFRNC-UHFFFAOYSA-N 1 2 318.302 4.116 20 0 DIADLO COc1cccc(F)c1C[NH2+][C@@H](C)c1cc(F)c(F)c(F)c1 ZINC001120366763 1050779728 /nfs/dbraw/zinc/77/97/28/1050779728.db2.gz XCPNCHLMSUESIX-VIFPVBQESA-N 1 2 313.294 4.102 20 0 DIADLO CC(C)c1cc(NC[C@H](O)c2cccc(F)c2)nc(C(C)C)[nH+]1 ZINC000761209686 1050789111 /nfs/dbraw/zinc/78/91/11/1050789111.db2.gz ACAVZRKHINPXNB-INIZCTEOSA-N 1 2 317.408 4.008 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)cc2ccccc21)c1csnn1 ZINC001171259451 1050790915 /nfs/dbraw/zinc/79/09/15/1050790915.db2.gz UPABTCIVJZKADD-JTQLQIEISA-N 1 2 303.818 4.196 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1cc(F)c(CO)c(F)c1 ZINC001214029276 1050799378 /nfs/dbraw/zinc/79/93/78/1050799378.db2.gz PLNAJTXCZZBOIF-UHFFFAOYSA-N 1 2 306.356 4.103 20 0 DIADLO Cc1nn(C[N@@H+]2CC[C@@H](c3ccccc3)[C@@H](C)C2)c(=S)s1 ZINC000742167980 1050805580 /nfs/dbraw/zinc/80/55/80/1050805580.db2.gz XBTLBPXPGKCOOH-SWLSCSKDSA-N 1 2 319.499 4.066 20 0 DIADLO Cc1nn(C[N@H+]2CC[C@@H](c3ccccc3)[C@@H](C)C2)c(=S)s1 ZINC000742167980 1050805589 /nfs/dbraw/zinc/80/55/89/1050805589.db2.gz XBTLBPXPGKCOOH-SWLSCSKDSA-N 1 2 319.499 4.066 20 0 DIADLO CNc1ccc(Nc2cccnc2Oc2ccccc2F)c[nH+]1 ZINC001203449202 1050871380 /nfs/dbraw/zinc/87/13/80/1050871380.db2.gz CHAHGJAFCLUKBW-UHFFFAOYSA-N 1 2 310.332 4.193 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)CCCC2CCCC2)n1 ZINC000742573686 1050889865 /nfs/dbraw/zinc/88/98/65/1050889865.db2.gz PGSNKMJRHRNWCX-UHFFFAOYSA-N 1 2 323.506 4.284 20 0 DIADLO C/C(=C/C(=O)Nc1nc(C[NH+]2CCCCC2)cs1)C(C)(C)C ZINC000742572730 1050889990 /nfs/dbraw/zinc/88/99/90/1050889990.db2.gz IEYIOEGEGXBHMK-RAXLEYEMSA-N 1 2 321.490 4.060 20 0 DIADLO Cc1ccc([C@@H](C)C(=O)Nc2cccc(-c3[nH]c(C)c(C)[nH+]3)c2)o1 ZINC000742579455 1050890975 /nfs/dbraw/zinc/89/09/75/1050890975.db2.gz YYVFRMLOFLVVDR-GFCCVEGCSA-N 1 2 323.396 4.337 20 0 DIADLO CCCCC[C@H](C)CC(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000742575616 1050891030 /nfs/dbraw/zinc/89/10/30/1050891030.db2.gz GJFIZIJRGHGIMD-HOTGVXAUSA-N 1 2 307.482 4.021 20 0 DIADLO C/C(=C\C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C(C)(C)C ZINC000742600849 1050900197 /nfs/dbraw/zinc/90/01/97/1050900197.db2.gz WBJWQOIBRIWGPH-FMIVXFBMSA-N 1 2 317.820 4.457 20 0 DIADLO COCOc1cccc(F)c1Nc1c(C)cc[nH+]c1C(C)C ZINC001214438368 1050902910 /nfs/dbraw/zinc/90/29/10/1050902910.db2.gz PWJHXGAKWALVHD-UHFFFAOYSA-N 1 2 304.365 4.379 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+]C[C@H]2CCc3ccccc32)cc1 ZINC000790051596 1050909882 /nfs/dbraw/zinc/90/98/82/1050909882.db2.gz BBABJFKTFVUUAV-SJLPKXTDSA-N 1 2 322.452 4.054 20 0 DIADLO CCCCSCC(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC000746884947 1050920293 /nfs/dbraw/zinc/92/02/93/1050920293.db2.gz YUAIBUWHNISLJY-UHFFFAOYSA-N 1 2 317.458 4.165 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000790152452 1050921850 /nfs/dbraw/zinc/92/18/50/1050921850.db2.gz GACVLZHNQJJKOJ-MJGOQNOKSA-N 1 2 318.461 4.058 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)N1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000790152451 1050922472 /nfs/dbraw/zinc/92/24/72/1050922472.db2.gz GACVLZHNQJJKOJ-IEBWSBKVSA-N 1 2 318.461 4.058 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cccc2c1CCCC2 ZINC001148629960 1050962782 /nfs/dbraw/zinc/96/27/82/1050962782.db2.gz VVLHYPKBXWEJGI-UHFFFAOYSA-N 1 2 317.392 4.003 20 0 DIADLO CCCC1CCC([N@H+](C)Cn2nc(C(C)C)n(C)c2=S)CC1 ZINC000790482468 1050963424 /nfs/dbraw/zinc/96/34/24/1050963424.db2.gz ZJVAVDPGEDAGOG-UHFFFAOYSA-N 1 2 324.538 4.323 20 0 DIADLO CCCC1CCC([N@@H+](C)Cn2nc(C(C)C)n(C)c2=S)CC1 ZINC000790482468 1050963432 /nfs/dbraw/zinc/96/34/32/1050963432.db2.gz ZJVAVDPGEDAGOG-UHFFFAOYSA-N 1 2 324.538 4.323 20 0 DIADLO Fc1cc(-c2ccco2)ccc1C[NH2+]Cc1cccnc1Cl ZINC000790483900 1050963464 /nfs/dbraw/zinc/96/34/64/1050963464.db2.gz NLWKQCJDGIUSAD-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO Cn1nccc1[C@H]1CCC[C@H](Nc2ccc([NH+]3CCCC3)cc2)C1 ZINC000790493462 1050964442 /nfs/dbraw/zinc/96/44/42/1050964442.db2.gz ADCRYYLULGPXBD-WMZOPIPTSA-N 1 2 324.472 4.159 20 0 DIADLO Cn1nccc1[C@H]1CCC[C@H]([NH2+]c2ccc(N3CCCC3)cc2)C1 ZINC000790493462 1050964455 /nfs/dbraw/zinc/96/44/55/1050964455.db2.gz ADCRYYLULGPXBD-WMZOPIPTSA-N 1 2 324.472 4.159 20 0 DIADLO Cc1nc(N[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)cc[nH+]1 ZINC000348125219 1050992169 /nfs/dbraw/zinc/99/21/69/1050992169.db2.gz NLFZKHCHDZIQGA-KRWDZBQOSA-N 1 2 324.815 4.229 20 0 DIADLO CC(C)(C)OC1CC[NH+](Cc2ncc(Cl)cc2Cl)CC1 ZINC000348152050 1050993774 /nfs/dbraw/zinc/99/37/74/1050993774.db2.gz NYFQSZBNNHKRRH-UHFFFAOYSA-N 1 2 317.260 4.168 20 0 DIADLO CC(=O)c1ccc(F)c(Nc2ccc(-n3cc[nH+]c3)cc2)c1F ZINC001214760809 1050995902 /nfs/dbraw/zinc/99/59/02/1050995902.db2.gz YQUINOXFAVPQBM-UHFFFAOYSA-N 1 2 313.307 4.097 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)nn1C ZINC000282782281 1051000120 /nfs/dbraw/zinc/00/01/20/1051000120.db2.gz PPQVXJZCYCXUGR-QWRGUYRKSA-N 1 2 312.244 4.447 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1C[C@@H](O)c1ccc(C)cc1 ZINC000743257735 1051001921 /nfs/dbraw/zinc/00/19/21/1051001921.db2.gz PCACEYQCGKRWTE-LJQANCHMSA-N 1 2 323.440 4.290 20 0 DIADLO Cc1cc(OC(C)C)ccc1NC(=[NH2+])c1cccnc1Cl ZINC001171351351 1051011402 /nfs/dbraw/zinc/01/14/02/1051011402.db2.gz HOCQXVHHIMNRRK-UHFFFAOYSA-N 1 2 303.793 4.268 20 0 DIADLO COc1c(F)cc(Nc2ccccc2-n2cc[nH+]c2)cc1Cl ZINC001214971990 1051039722 /nfs/dbraw/zinc/03/97/22/1051039722.db2.gz TZGLLJMVTNXVDT-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1cnn(-c2ccccc2)c1 ZINC000773051627 1051041824 /nfs/dbraw/zinc/04/18/24/1051041824.db2.gz LVEDNCIUURHPFB-CYBMUJFWSA-N 1 2 324.453 4.057 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1COC(=O)[C@@H](C)c1ccccc1 ZINC000791443609 1051050160 /nfs/dbraw/zinc/05/01/60/1051050160.db2.gz YIUMYSBUGLUGCZ-INIZCTEOSA-N 1 2 320.392 4.028 20 0 DIADLO OCc1ccc(Nc2cc[nH+]c3cc(Cl)ccc23)c(F)c1F ZINC001215028260 1051053970 /nfs/dbraw/zinc/05/39/70/1051053970.db2.gz GVHOYBWPLWTYHT-UHFFFAOYSA-N 1 2 320.726 4.402 20 0 DIADLO Cc1cn2c(cccc2Nc2c(F)c(F)ccc2OC(C)C)[nH+]1 ZINC001215072168 1051067493 /nfs/dbraw/zinc/06/74/93/1051067493.db2.gz OTPHJEQJXPJUFG-UHFFFAOYSA-N 1 2 317.339 4.452 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1nnc(-c2cccc(F)c2)o1 ZINC000743841197 1051069519 /nfs/dbraw/zinc/06/95/19/1051069519.db2.gz OFWHUGCDPYCVNM-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1nnc(-c2cccc(F)c2)o1 ZINC000743841197 1051069529 /nfs/dbraw/zinc/06/95/29/1051069529.db2.gz OFWHUGCDPYCVNM-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1cccnc1Cl ZINC000773129416 1051071614 /nfs/dbraw/zinc/07/16/14/1051071614.db2.gz FXYCLPWHOSJJEN-GFCCVEGCSA-N 1 2 319.836 4.158 20 0 DIADLO Cc1ccc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)c(C)c1 ZINC001215164317 1051095113 /nfs/dbraw/zinc/09/51/13/1051095113.db2.gz HNDUUXGXMKAGDI-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Nc1cn2ccc(NC3(c4cccc(F)c4)CCCCC3)cc2[nH+]1 ZINC001171407143 1051095567 /nfs/dbraw/zinc/09/55/67/1051095567.db2.gz WWGGOSOZEORCPF-UHFFFAOYSA-N 1 2 324.403 4.327 20 0 DIADLO Cc1ccccc1Nc1nc(C[NH2+][C@H](C)c2cccnc2)cs1 ZINC000181299622 1051106672 /nfs/dbraw/zinc/10/66/72/1051106672.db2.gz LDGJYVSDDDDXHO-CQSZACIVSA-N 1 2 324.453 4.441 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1F ZINC000716457342 1051129547 /nfs/dbraw/zinc/12/95/47/1051129547.db2.gz ODSMOJSPILZLNC-MRVPVSSYSA-N 1 2 302.180 4.015 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1F ZINC000716457342 1051129555 /nfs/dbraw/zinc/12/95/55/1051129555.db2.gz ODSMOJSPILZLNC-MRVPVSSYSA-N 1 2 302.180 4.015 20 0 DIADLO CC(C)[C@@H]1C[C@@H](CC(=O)OCc2cc[nH+]c(N)c2)c2ccccc21 ZINC000792253469 1051130798 /nfs/dbraw/zinc/13/07/98/1051130798.db2.gz FXFNEKJVIXSDSP-YJBOKZPZSA-N 1 2 324.424 4.024 20 0 DIADLO Cc1ccc(F)cc1-c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001215250547 1051134892 /nfs/dbraw/zinc/13/48/92/1051134892.db2.gz PCBGHJUALJYAJX-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO COCOc1ccc(Nc2cccc3[nH+]c(C)cn32)cc1Cl ZINC001215252016 1051135043 /nfs/dbraw/zinc/13/50/43/1051135043.db2.gz XWUMRFFLDLVRED-UHFFFAOYSA-N 1 2 317.776 4.022 20 0 DIADLO Cc1cc(NCc2cccc3ncoc32)[nH+]cc1C(F)(F)F ZINC001171452313 1051136025 /nfs/dbraw/zinc/13/60/25/1051136025.db2.gz AGYGPQKKBYIZAI-UHFFFAOYSA-N 1 2 307.275 4.162 20 0 DIADLO COCOc1ccc(Nc2[nH+]cccc2C2CC2)cc1Cl ZINC001215257608 1051138176 /nfs/dbraw/zinc/13/81/76/1051138176.db2.gz KROQMQYQOODYSL-UHFFFAOYSA-N 1 2 304.777 4.339 20 0 DIADLO CCCc1cc(NCc2cccc3ncoc32)nc(CCC)[nH+]1 ZINC001171455864 1051138562 /nfs/dbraw/zinc/13/85/62/1051138562.db2.gz LOZOQKYXQXFDKG-UHFFFAOYSA-N 1 2 310.401 4.135 20 0 DIADLO CC(=O)CC(C)(C)Nc1ccc2c(c1)[nH+]cn2-c1ccccc1 ZINC001171498627 1051147708 /nfs/dbraw/zinc/14/77/08/1051147708.db2.gz DVEXORCCGQUMEB-UHFFFAOYSA-N 1 2 307.397 4.195 20 0 DIADLO CC(C)(Nc1cc[nH+]c(OCc2ccccc2)c1)c1ccncc1 ZINC001171514576 1051157323 /nfs/dbraw/zinc/15/73/23/1051157323.db2.gz NHMFSIKSBGINKY-UHFFFAOYSA-N 1 2 319.408 4.403 20 0 DIADLO Cc1nonc1C[N@@H+](C)[C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000744420087 1051172180 /nfs/dbraw/zinc/17/21/80/1051172180.db2.gz WSQULBVIXBSFNA-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1nonc1C[N@H+](C)[C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000744420087 1051172192 /nfs/dbraw/zinc/17/21/92/1051172192.db2.gz WSQULBVIXBSFNA-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1nonc1C[N@@H+](C)[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000744420085 1051172789 /nfs/dbraw/zinc/17/27/89/1051172789.db2.gz WSQULBVIXBSFNA-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1nonc1C[N@H+](C)[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000744420085 1051172793 /nfs/dbraw/zinc/17/27/93/1051172793.db2.gz WSQULBVIXBSFNA-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1cc(NCc2ccc(C3(C(F)(F)F)N=N3)cc2)c[nH+]c1C ZINC001170292520 1051177657 /nfs/dbraw/zinc/17/76/57/1051177657.db2.gz JGHBZAJVRXDFKD-UHFFFAOYSA-N 1 2 320.318 4.491 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2[C@H](C)Cc2ccccc2Cl)no1 ZINC001170286308 1051181870 /nfs/dbraw/zinc/18/18/70/1051181870.db2.gz XNPGFRLYTWXXSY-MLGOLLRUSA-N 1 2 319.836 4.190 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2[C@H](C)Cc2ccccc2Cl)no1 ZINC001170286308 1051181873 /nfs/dbraw/zinc/18/18/73/1051181873.db2.gz XNPGFRLYTWXXSY-MLGOLLRUSA-N 1 2 319.836 4.190 20 0 DIADLO Cc1ccc(CC[C@H](C)[NH2+]C(C)(C)C(=O)OC(C)(C)C)cc1 ZINC001171660624 1051185433 /nfs/dbraw/zinc/18/54/33/1051185433.db2.gz MTBFWHVOVOEVGE-HNNXBMFYSA-N 1 2 305.462 4.026 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+]1C[C@H](C)OC2(CCCC2)C1 ZINC001171735018 1051213424 /nfs/dbraw/zinc/21/34/24/1051213424.db2.gz NZYPVYKSHGBZCA-AWEZNQCLSA-N 1 2 323.864 4.272 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+]1C[C@H](C)OC2(CCCC2)C1 ZINC001171735018 1051213433 /nfs/dbraw/zinc/21/34/33/1051213433.db2.gz NZYPVYKSHGBZCA-AWEZNQCLSA-N 1 2 323.864 4.272 20 0 DIADLO Cc1noc(C(C)(C)[NH2+]Cc2ccc3oc4ccccc4c3c2)n1 ZINC000792930852 1051230716 /nfs/dbraw/zinc/23/07/16/1051230716.db2.gz LKDODFKCQGSMKT-UHFFFAOYSA-N 1 2 321.380 4.302 20 0 DIADLO Cc1nonc1C[N@@H+](CC(C)C)[C@H](C)c1ccccc1Cl ZINC000792929164 1051231117 /nfs/dbraw/zinc/23/11/17/1051231117.db2.gz XGRBWEHLMPSTOA-CYBMUJFWSA-N 1 2 307.825 4.251 20 0 DIADLO Cc1nonc1C[N@H+](CC(C)C)[C@H](C)c1ccccc1Cl ZINC000792929164 1051231130 /nfs/dbraw/zinc/23/11/30/1051231130.db2.gz XGRBWEHLMPSTOA-CYBMUJFWSA-N 1 2 307.825 4.251 20 0 DIADLO COC(=O)[C@@H](c1ccccc1F)[NH+]1CCC2(CCCCC2)CC1 ZINC001171834345 1051231566 /nfs/dbraw/zinc/23/15/66/1051231566.db2.gz NFGUVKNHBJFKCB-QGZVFWFLSA-N 1 2 319.420 4.086 20 0 DIADLO CCCCCCOc1cccc(C[NH2+]Cc2cc(C)on2)c1 ZINC000747095396 1051235139 /nfs/dbraw/zinc/23/51/39/1051235139.db2.gz RAHIFHNWAYXWMN-UHFFFAOYSA-N 1 2 302.418 4.232 20 0 DIADLO Cc1ccc[nH+]c1Nc1ccc2cnn([C@@H]3CCCCO3)c2c1 ZINC001215560086 1051243027 /nfs/dbraw/zinc/24/30/27/1051243027.db2.gz ZXZPLSRODIGLQR-KRWDZBQOSA-N 1 2 308.385 4.182 20 0 DIADLO COc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1coc(C2CC2)n1 ZINC000747100325 1051244884 /nfs/dbraw/zinc/24/48/84/1051244884.db2.gz WWCQXRFKKWPEEY-QGZVFWFLSA-N 1 2 314.429 4.438 20 0 DIADLO CC1(C)C[C@H]([N@H+](CC=C(Cl)Cl)Cc2ccccc2)CO1 ZINC001171936512 1051253483 /nfs/dbraw/zinc/25/34/83/1051253483.db2.gz BIMSFFNVDQTYSI-AWEZNQCLSA-N 1 2 314.256 4.375 20 0 DIADLO CC1(C)C[C@H]([N@@H+](CC=C(Cl)Cl)Cc2ccccc2)CO1 ZINC001171936512 1051253489 /nfs/dbraw/zinc/25/34/89/1051253489.db2.gz BIMSFFNVDQTYSI-AWEZNQCLSA-N 1 2 314.256 4.375 20 0 DIADLO COCc1ccc(Cl)c(Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001215596745 1051265693 /nfs/dbraw/zinc/26/56/93/1051265693.db2.gz WFGMAJCROARYMT-UHFFFAOYSA-N 1 2 313.788 4.416 20 0 DIADLO COCc1ccc(Cl)c(Nc2ccc3c(c2)[nH+]cn3C)c1 ZINC001215597290 1051265874 /nfs/dbraw/zinc/26/58/74/1051265874.db2.gz AEEIAKIGYBOGGQ-UHFFFAOYSA-N 1 2 301.777 4.117 20 0 DIADLO COCc1ccc(Cl)c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001215597756 1051267138 /nfs/dbraw/zinc/26/71/38/1051267138.db2.gz XMEDGGFPNLKNEQ-UHFFFAOYSA-N 1 2 317.820 4.225 20 0 DIADLO Cc1ccc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)c(F)c1 ZINC001215623220 1051279295 /nfs/dbraw/zinc/27/92/95/1051279295.db2.gz MJNMXNCJOITHDO-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CCCOc1ccc2cc(Nc3[nH+]cccc3CCO)ccc2c1 ZINC001215679618 1051296536 /nfs/dbraw/zinc/29/65/36/1051296536.db2.gz OOGGJMRRFHXCQJ-UHFFFAOYSA-N 1 2 322.408 4.302 20 0 DIADLO COc1cc(Nc2ccc[nH+]c2N2CCCCC2)cc(C)c1F ZINC001215700940 1051311822 /nfs/dbraw/zinc/31/18/22/1051311822.db2.gz RQHVYUIZJLZRCL-UHFFFAOYSA-N 1 2 315.392 4.272 20 0 DIADLO COc1ncc([C@@H](C)Nc2ccc([NH+](C)C)c(C)c2)cc1Cl ZINC000793542316 1051313838 /nfs/dbraw/zinc/31/38/38/1051313838.db2.gz INMVONHCNIZZLL-GFCCVEGCSA-N 1 2 319.836 4.291 20 0 DIADLO CCCOc1c(F)cc(F)c(Nc2ccn3cc[nH+]c3c2)c1F ZINC001212649067 1051327584 /nfs/dbraw/zinc/32/75/84/1051327584.db2.gz NDPJASVHVSSXDS-UHFFFAOYSA-N 1 2 321.302 4.284 20 0 DIADLO Cc1cn2cccc(Nc3ccc(F)c(OC(C)C)c3F)c2[nH+]1 ZINC001215727123 1051328185 /nfs/dbraw/zinc/32/81/85/1051328185.db2.gz BRLFFNJVAAFEFJ-UHFFFAOYSA-N 1 2 317.339 4.452 20 0 DIADLO CSc1cc(Nc2ccc(C3CCOCC3)cc2)cc[nH+]1 ZINC001212652345 1051347824 /nfs/dbraw/zinc/34/78/24/1051347824.db2.gz KDVGDKQQALKEQM-UHFFFAOYSA-N 1 2 300.427 4.441 20 0 DIADLO CCN(C)c1ccc(Nc2ccc(C3CCOCC3)cc2)c[nH+]1 ZINC001212652342 1051347962 /nfs/dbraw/zinc/34/79/62/1051347962.db2.gz KDEMFOOWFKAYHE-UHFFFAOYSA-N 1 2 311.429 4.175 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2sccc2Br)cs1 ZINC000041010680 1051349193 /nfs/dbraw/zinc/34/91/93/1051349193.db2.gz ZCJSKBMEYWDKIL-SSDOTTSWSA-N 1 2 317.277 4.126 20 0 DIADLO C/C(=C/C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C)c1ccccc1 ZINC000794205519 1051361947 /nfs/dbraw/zinc/36/19/47/1051361947.db2.gz IOLICNOCHXMKAS-QINSGFPZSA-N 1 2 317.392 4.427 20 0 DIADLO C/C(=C\C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C)c1ccccc1 ZINC000794205418 1051362533 /nfs/dbraw/zinc/36/25/33/1051362533.db2.gz IOLICNOCHXMKAS-NTCAYCPXSA-N 1 2 317.392 4.427 20 0 DIADLO CC[C@H](C)Sc1ccc(NC(=O)CCc2c[nH]c[nH+]2)c(C)c1 ZINC000193030256 1051369404 /nfs/dbraw/zinc/36/94/04/1051369404.db2.gz UHOWXYDXXNHRMC-ZDUSSCGKSA-N 1 2 317.458 4.180 20 0 DIADLO CC[C@H](C)Sc1ccc(NC(=O)CCc2c[nH+]c[nH]2)c(C)c1 ZINC000193030256 1051369415 /nfs/dbraw/zinc/36/94/15/1051369415.db2.gz UHOWXYDXXNHRMC-ZDUSSCGKSA-N 1 2 317.458 4.180 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@H](C(C)(C)C)C[C@H]2C)c(C)[nH+]1 ZINC001129395471 1051375018 /nfs/dbraw/zinc/37/50/18/1051375018.db2.gz PWBYEEPVDCVIDL-ZBFHGGJFSA-N 1 2 302.462 4.294 20 0 DIADLO CCC1CCC([N@H+](C)Cn2nc(C3CC3)sc2=S)CC1 ZINC000746372980 1051388670 /nfs/dbraw/zinc/38/86/70/1051388670.db2.gz KCYPWLSENUOFEX-UHFFFAOYSA-N 1 2 311.520 4.410 20 0 DIADLO CCC1CCC([N@@H+](C)Cn2nc(C3CC3)sc2=S)CC1 ZINC000746372980 1051388679 /nfs/dbraw/zinc/38/86/79/1051388679.db2.gz KCYPWLSENUOFEX-UHFFFAOYSA-N 1 2 311.520 4.410 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccccc3NC(=O)C(C)(C)C)ccc21 ZINC001215834997 1051399233 /nfs/dbraw/zinc/39/92/33/1051399233.db2.gz XNWYDYAUSGDEMR-UHFFFAOYSA-N 1 2 322.412 4.302 20 0 DIADLO CCSc1cc[nH+]c(N[C@H](c2cccnc2)C(F)(F)F)c1 ZINC001156162991 1051401593 /nfs/dbraw/zinc/40/15/93/1051401593.db2.gz IGXIDAOBSJPXOS-CYBMUJFWSA-N 1 2 313.348 4.304 20 0 DIADLO CSc1ccc(F)c(Nc2ccc3c(c2)[nH+]cn3C)c1F ZINC001215838128 1051403107 /nfs/dbraw/zinc/40/31/07/1051403107.db2.gz AMGSZMZXXZSWCF-UHFFFAOYSA-N 1 2 305.353 4.317 20 0 DIADLO Cc1cc(C)cc(-c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)c1 ZINC001215846033 1051410562 /nfs/dbraw/zinc/41/05/62/1051410562.db2.gz MZWSUXKUTWGOSO-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Cc1ccc(-c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)c(C)c1 ZINC001215845682 1051410780 /nfs/dbraw/zinc/41/07/80/1051410780.db2.gz FCICOEWSXUOUDB-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO CCc1cccc(-c2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)c1 ZINC001215850252 1051414226 /nfs/dbraw/zinc/41/42/26/1051414226.db2.gz ROAQYGNFBVRMNR-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO C[C@H]([NH2+]Cc1ccon1)c1ccc2ccccc2c1OC(F)F ZINC000766422311 1051418201 /nfs/dbraw/zinc/41/82/01/1051418201.db2.gz UQINXKZRRANCJZ-NSHDSACASA-N 1 2 318.323 4.280 20 0 DIADLO O=C(C[NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1)OCc1ccccc1 ZINC001172536603 1051418253 /nfs/dbraw/zinc/41/82/53/1051418253.db2.gz FFWKRCZQJITNMH-WOJBJXKFSA-N 1 2 323.436 4.046 20 0 DIADLO CCCCC[C@@H]1CCCN1c1[nH+]cnc2c1cnn2C(C)(C)C ZINC000766424814 1051418975 /nfs/dbraw/zinc/41/89/75/1051418975.db2.gz NTSFOIVZYFLVMK-CQSZACIVSA-N 1 2 315.465 4.130 20 0 DIADLO Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]Cc1ccon1 ZINC000766419204 1051419109 /nfs/dbraw/zinc/41/91/09/1051419109.db2.gz DYDCKPRHYIAXRF-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO C[C@](O)(CNc1cc[nH+]c2c(Cl)cccc12)c1ccsc1 ZINC000804497529 1051431611 /nfs/dbraw/zinc/43/16/11/1051431611.db2.gz DKWZVSLZUHVAFA-INIZCTEOSA-N 1 2 318.829 4.269 20 0 DIADLO Clc1cccc2c(NC[C@H]3CSCCS3)cc[nH+]c12 ZINC000804539336 1051452524 /nfs/dbraw/zinc/45/25/24/1051452524.db2.gz ZYQLQQZOGAGSQW-JTQLQIEISA-N 1 2 310.875 4.149 20 0 DIADLO CSc1c(F)cc(Nc2ccc[nH+]c2N2CCCC2)cc1F ZINC001215922659 1051457926 /nfs/dbraw/zinc/45/79/26/1051457926.db2.gz OMVRCBSSGLSZCZ-UHFFFAOYSA-N 1 2 321.396 4.426 20 0 DIADLO Cc1ccc(C)c([C@H](C)[NH2+]Cc2nnc(C(F)(F)F)s2)c1 ZINC001168925238 1051467671 /nfs/dbraw/zinc/46/76/71/1051467671.db2.gz MKJXCIHTYMGYOA-JTQLQIEISA-N 1 2 315.364 4.025 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1cccc(C(=O)C(F)(F)F)c1 ZINC001203341061 1051468600 /nfs/dbraw/zinc/46/86/00/1051468600.db2.gz KDKKLSWWQLCCQQ-UHFFFAOYSA-N 1 2 308.303 4.441 20 0 DIADLO Fc1ncc(C2CC2)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001215957876 1051481925 /nfs/dbraw/zinc/48/19/25/1051481925.db2.gz YKLGPSKLTMISSL-UHFFFAOYSA-N 1 2 308.360 4.087 20 0 DIADLO O=C(CCNc1[nH+]cccc1-c1ccccc1)Nc1ccccc1 ZINC001168971968 1051482655 /nfs/dbraw/zinc/48/26/55/1051482655.db2.gz CZPUYJXOWLLTLB-UHFFFAOYSA-N 1 2 317.392 4.189 20 0 DIADLO Clc1cnc(NCCc2cn3ccccc3[nH+]2)c2ccccc12 ZINC001169000242 1051485666 /nfs/dbraw/zinc/48/56/66/1051485666.db2.gz JKNYFZOHSIBKIW-UHFFFAOYSA-N 1 2 322.799 4.191 20 0 DIADLO Cc1ccc2cc(NCc3cc(F)cc4c3OCOC4)[nH+]cc2c1 ZINC001169095199 1051508683 /nfs/dbraw/zinc/50/86/83/1051508683.db2.gz SMXQHTZQMUTYKU-UHFFFAOYSA-N 1 2 324.355 4.161 20 0 DIADLO COc1ccc(/C=C/c2ccc(C)cc2)c(C[NH+]2CCOCC2)c1 ZINC001206176158 1051510630 /nfs/dbraw/zinc/51/06/30/1051510630.db2.gz IWULADIOPOOEKG-BQYQJAHWSA-N 1 2 323.436 4.006 20 0 DIADLO C[C@@H](Cc1c(F)cccc1Cl)[N@@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001172847473 1051534011 /nfs/dbraw/zinc/53/40/11/1051534011.db2.gz MRFXZBAIWFNYEN-IINYFYTJSA-N 1 2 323.761 4.479 20 0 DIADLO C[C@@H](Cc1c(F)cccc1Cl)[N@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001172847473 1051534025 /nfs/dbraw/zinc/53/40/25/1051534025.db2.gz MRFXZBAIWFNYEN-IINYFYTJSA-N 1 2 323.761 4.479 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001172845974 1051535140 /nfs/dbraw/zinc/53/51/40/1051535140.db2.gz AEQNAEUKYPJLFW-IGCXYCKISA-N 1 2 323.839 4.244 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001172845974 1051535157 /nfs/dbraw/zinc/53/51/57/1051535157.db2.gz AEQNAEUKYPJLFW-IGCXYCKISA-N 1 2 323.839 4.244 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CCC(=O)[C@H]2CCCC[C@H]21 ZINC001172845977 1051535587 /nfs/dbraw/zinc/53/55/87/1051535587.db2.gz AEQNAEUKYPJLFW-IIYDPXPESA-N 1 2 323.839 4.244 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CCC(=O)[C@H]2CCCC[C@H]21 ZINC001172845977 1051535601 /nfs/dbraw/zinc/53/56/01/1051535601.db2.gz AEQNAEUKYPJLFW-IIYDPXPESA-N 1 2 323.839 4.244 20 0 DIADLO Cc1cc(C)c(CNC(=O)[C@@H](CCc2ccccc2)C(C)C)c[nH+]1 ZINC001129842141 1051536360 /nfs/dbraw/zinc/53/63/60/1051536360.db2.gz RTQODJRNQZFYMS-FQEVSTJZSA-N 1 2 324.468 4.220 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NCc1c(Cl)cncc1Cl ZINC001169194501 1051544659 /nfs/dbraw/zinc/54/46/59/1051544659.db2.gz HAGRJHPKQXXLRJ-UHFFFAOYSA-N 1 2 312.200 4.183 20 0 DIADLO Clc1ccc(Nc2ccccc2-n2cc[nH+]c2)c2n[nH]cc21 ZINC001216056555 1051553960 /nfs/dbraw/zinc/55/39/60/1051553960.db2.gz LQHPOFJAAXQHKY-UHFFFAOYSA-N 1 2 309.760 4.146 20 0 DIADLO FC1(F)CCC[C@@H](Nc2cc[nH+]c(OCc3ccccn3)c2)C1 ZINC001169220978 1051556959 /nfs/dbraw/zinc/55/69/59/1051556959.db2.gz ZOWZVSZDMAWPGQ-CQSZACIVSA-N 1 2 319.355 4.045 20 0 DIADLO Cc1ccc(CCCNc2cc(C(C)C)[nH+]c(C(C)C)n2)cn1 ZINC001169255749 1051564493 /nfs/dbraw/zinc/56/44/93/1051564493.db2.gz AYTHUCGUNRJTOQ-UHFFFAOYSA-N 1 2 312.461 4.472 20 0 DIADLO Cc1nc2c(o1)CC[N@@H+]([C@@H](C)CSc1ccc(Cl)cc1)C2 ZINC001172884374 1051565490 /nfs/dbraw/zinc/56/54/90/1051565490.db2.gz CAGURSWMCDIRKP-NSHDSACASA-N 1 2 322.861 4.175 20 0 DIADLO Cc1nc2c(o1)CC[N@H+]([C@@H](C)CSc1ccc(Cl)cc1)C2 ZINC001172884374 1051565502 /nfs/dbraw/zinc/56/55/02/1051565502.db2.gz CAGURSWMCDIRKP-NSHDSACASA-N 1 2 322.861 4.175 20 0 DIADLO COc1ccc2cc(N[C@H](C3CCC3)C(F)(F)F)[nH+]cc2c1 ZINC001169281801 1051568323 /nfs/dbraw/zinc/56/83/23/1051568323.db2.gz NZWAWQLSUOEBBF-OAHLLOKOSA-N 1 2 310.319 4.386 20 0 DIADLO FC(F)(F)[C@H](Nc1cc(-c2ccncc2)cc[nH+]1)C1CCC1 ZINC001169281190 1051568917 /nfs/dbraw/zinc/56/89/17/1051568917.db2.gz HANHZZNGKUHRCF-OAHLLOKOSA-N 1 2 307.319 4.287 20 0 DIADLO Oc1cc(Nc2cc[nH+]c3ccc(Cl)cc23)ccc1Cl ZINC001212587922 1051570441 /nfs/dbraw/zinc/57/04/41/1051570441.db2.gz AIGJVNCIYFOUDB-UHFFFAOYSA-N 1 2 305.164 4.413 20 0 DIADLO c1cn(Cc2ccc(Nc3cc4ccccc4cn3)cc2)c[nH+]1 ZINC001212693077 1051571638 /nfs/dbraw/zinc/57/16/38/1051571638.db2.gz BFOIAVZNVPMWGA-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO Clc1cnc(Cl)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212693474 1051574285 /nfs/dbraw/zinc/57/42/85/1051574285.db2.gz YSSWRTBVCCOCMI-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO Cc1ccnc(CCNc2cc[nH+]c(OCc3ccccc3)c2)c1 ZINC001169318635 1051579099 /nfs/dbraw/zinc/57/90/99/1051579099.db2.gz RJMYDRCFISLFOJ-UHFFFAOYSA-N 1 2 319.408 4.019 20 0 DIADLO Fc1cccc2cc(Nc3ccc(Cn4cc[nH+]c4)cc3)cnc12 ZINC001212695029 1051581834 /nfs/dbraw/zinc/58/18/34/1051581834.db2.gz JWMODVVOOOMGQN-UHFFFAOYSA-N 1 2 318.355 4.362 20 0 DIADLO FC(F)c1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)cn1 ZINC001212694096 1051582474 /nfs/dbraw/zinc/58/24/74/1051582474.db2.gz JOXDGIGCPJNRKV-UHFFFAOYSA-N 1 2 300.312 4.008 20 0 DIADLO c1cn(Cc2ccc(Nc3csc4cnccc34)cc2)c[nH+]1 ZINC001212694141 1051583092 /nfs/dbraw/zinc/58/30/92/1051583092.db2.gz LOBQUPVXUHUYQM-UHFFFAOYSA-N 1 2 306.394 4.285 20 0 DIADLO CC[C@H]1CC(=O)N(C[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)C1 ZINC000766666766 1051583879 /nfs/dbraw/zinc/58/38/79/1051583879.db2.gz PMRMGPGWJYKKJJ-WMLDXEAASA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@H]1CC(=O)N(C[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)C1 ZINC000766666766 1051583887 /nfs/dbraw/zinc/58/38/87/1051583887.db2.gz PMRMGPGWJYKKJJ-WMLDXEAASA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@@H]1CC(=O)N(C[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)C1 ZINC000766666764 1051584044 /nfs/dbraw/zinc/58/40/44/1051584044.db2.gz PMRMGPGWJYKKJJ-PBHICJAKSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@@H]1CC(=O)N(C[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)C1 ZINC000766666764 1051584057 /nfs/dbraw/zinc/58/40/57/1051584057.db2.gz PMRMGPGWJYKKJJ-PBHICJAKSA-N 1 2 320.864 4.083 20 0 DIADLO O=C1CCCc2cc(Nc3ccc(Cn4cc[nH+]c4)cc3)ccc21 ZINC001212699222 1051586168 /nfs/dbraw/zinc/58/61/68/1051586168.db2.gz UUPJNXVZNCZSTF-UHFFFAOYSA-N 1 2 317.392 4.194 20 0 DIADLO O[C@@H]1CCCc2ccc(Nc3ccc(Cn4cc[nH+]c4)cc3)cc21 ZINC001212699018 1051586797 /nfs/dbraw/zinc/58/67/97/1051586797.db2.gz JKYHJQQJMLJOHT-HXUWFJFHSA-N 1 2 319.408 4.045 20 0 DIADLO Fc1cc2cccnc2c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212697960 1051587157 /nfs/dbraw/zinc/58/71/57/1051587157.db2.gz DMPVCEZWUIYHHP-UHFFFAOYSA-N 1 2 318.355 4.362 20 0 DIADLO Cc1cc(N)c(Cl)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212697553 1051587659 /nfs/dbraw/zinc/58/76/59/1051587659.db2.gz FRKUZYGDRAHNMQ-UHFFFAOYSA-N 1 2 312.804 4.219 20 0 DIADLO CC(=O)c1ccc(F)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212698364 1051587823 /nfs/dbraw/zinc/58/78/23/1051587823.db2.gz PRBCUMQUFZXGCF-UHFFFAOYSA-N 1 2 309.344 4.017 20 0 DIADLO CC(=O)c1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(F)c1 ZINC001212697671 1051588167 /nfs/dbraw/zinc/58/81/67/1051588167.db2.gz MTZXLPCLUZBSTF-UHFFFAOYSA-N 1 2 309.344 4.017 20 0 DIADLO Oc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(F)cc1Cl ZINC001212696940 1051588262 /nfs/dbraw/zinc/58/82/62/1051588262.db2.gz WHEAJGONKADASS-UHFFFAOYSA-N 1 2 317.751 4.173 20 0 DIADLO c1ccn(-c2ccccc2Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212697766 1051588718 /nfs/dbraw/zinc/58/87/18/1051588718.db2.gz ROSJASPFERUQLD-UHFFFAOYSA-N 1 2 314.392 4.466 20 0 DIADLO CCOc1cc(Nc2ccc(N)cc2C(F)(F)F)cc(C)[nH+]1 ZINC001216129219 1051593430 /nfs/dbraw/zinc/59/34/30/1051593430.db2.gz DXYWOUFFZXXYFO-UHFFFAOYSA-N 1 2 311.307 4.133 20 0 DIADLO Nc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)c(C(F)(F)F)c1 ZINC001216132244 1051595870 /nfs/dbraw/zinc/59/58/70/1051595870.db2.gz VPAGKKADMILXET-UHFFFAOYSA-N 1 2 318.302 4.217 20 0 DIADLO CC(=O)Nc1ccc(Nc2c[nH+]c(CC(C)C)cc2C)cc1F ZINC001212703454 1051597839 /nfs/dbraw/zinc/59/78/39/1051597839.db2.gz BEMSOFAYFDESGR-UHFFFAOYSA-N 1 2 315.392 4.430 20 0 DIADLO S=c1ncccn1C[N@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000766667750 1051602597 /nfs/dbraw/zinc/60/25/97/1051602597.db2.gz WBZXVDOVNJLUQF-HNNXBMFYSA-N 1 2 319.861 4.451 20 0 DIADLO S=c1ncccn1C[N@@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000766667750 1051602604 /nfs/dbraw/zinc/60/26/04/1051602604.db2.gz WBZXVDOVNJLUQF-HNNXBMFYSA-N 1 2 319.861 4.451 20 0 DIADLO C[C@H](c1ccc(Oc2ccccc2)cc1)[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC001169409771 1051604391 /nfs/dbraw/zinc/60/43/91/1051604391.db2.gz QGWHQQVVPRIQGR-JKSUJKDBSA-N 1 2 309.409 4.451 20 0 DIADLO C[C@H](c1ccc(Oc2ccccc2)cc1)[N@H+]1CCC(=O)[C@@H](C)C1 ZINC001169409771 1051604399 /nfs/dbraw/zinc/60/43/99/1051604399.db2.gz QGWHQQVVPRIQGR-JKSUJKDBSA-N 1 2 309.409 4.451 20 0 DIADLO Cc1ccc(CNc2cc(N3CCCC3)nc[nH+]2)c2ccccc12 ZINC001169414208 1051608063 /nfs/dbraw/zinc/60/80/63/1051608063.db2.gz SZADNVJCMPBPRU-UHFFFAOYSA-N 1 2 318.424 4.151 20 0 DIADLO Cc1ccc(CNc2cc(N3CCCC3)[nH+]cn2)c2ccccc12 ZINC001169414208 1051608077 /nfs/dbraw/zinc/60/80/77/1051608077.db2.gz SZADNVJCMPBPRU-UHFFFAOYSA-N 1 2 318.424 4.151 20 0 DIADLO Cc1c[nH+]cc(N[C@@H](CCO)c2cccc3ccccc32)c1C ZINC001169423253 1051609154 /nfs/dbraw/zinc/60/91/54/1051609154.db2.gz BUQYBZHTMRUWSC-IBGZPJMESA-N 1 2 306.409 4.387 20 0 DIADLO CC[C@@]1(CO)CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001169592536 1051651483 /nfs/dbraw/zinc/65/14/83/1051651483.db2.gz BCHCIQCRCQPPKZ-OAHLLOKOSA-N 1 2 320.235 4.117 20 0 DIADLO Fc1cc(Nc2ccn3cc[nH+]c3c2)cc(N2CCCCC2)c1 ZINC001216180144 1051616448 /nfs/dbraw/zinc/61/64/48/1051616448.db2.gz VBFJMZCVDOXGRL-UHFFFAOYSA-N 1 2 310.376 4.207 20 0 DIADLO COC(=O)c1sccc1C[NH2+][C@@H](C)c1ccccc1Cl ZINC000088484484 1051624032 /nfs/dbraw/zinc/62/40/32/1051624032.db2.gz FGWQDYFJUODKKB-JTQLQIEISA-N 1 2 309.818 4.039 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@H](C)c1ccnc(Cl)c1)c1ccco1 ZINC000152610752 1051626524 /nfs/dbraw/zinc/62/65/24/1051626524.db2.gz XMEAOGGZNOQRLO-HIFRSBDPSA-N 1 2 322.836 4.393 20 0 DIADLO C[C@H]([NH2+]Cc1cn2ccccc2n1)c1ccc(Cl)cc1Cl ZINC000007049805 1051627389 /nfs/dbraw/zinc/62/73/89/1051627389.db2.gz IMCKAHIZYJEUTE-NSHDSACASA-N 1 2 320.223 4.492 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@@H](C)c1ccnc(Cl)c1)c1ccco1 ZINC000152610635 1051627911 /nfs/dbraw/zinc/62/79/11/1051627911.db2.gz XMEAOGGZNOQRLO-DZGCQCFKSA-N 1 2 322.836 4.393 20 0 DIADLO O=C(/C=C/c1[nH]cc[nH+]1)Nc1ccccc1SC1CCCC1 ZINC000493492224 1051629743 /nfs/dbraw/zinc/62/97/43/1051629743.db2.gz KNIZOZGOSXAKCA-MDZDMXLPSA-N 1 2 313.426 4.096 20 0 DIADLO COc1cccc2[nH+]c(NC[C@@H](C)c3ccc(O)cc3)ccc21 ZINC001169534488 1051637533 /nfs/dbraw/zinc/63/75/33/1051637533.db2.gz HEMVFPSBNCRSQK-CYBMUJFWSA-N 1 2 308.381 4.165 20 0 DIADLO CC[C@@]1(CO)CCC[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001169592536 1051651473 /nfs/dbraw/zinc/65/14/73/1051651473.db2.gz BCHCIQCRCQPPKZ-OAHLLOKOSA-N 1 2 320.235 4.117 20 0 DIADLO Cc1ccc2cc(N[C@@H]3CCc4ccccc4[C@H]3O)[nH+]cc2c1 ZINC001169623527 1051658064 /nfs/dbraw/zinc/65/80/64/1051658064.db2.gz SLMKILCKTKYRAL-UYAOXDASSA-N 1 2 304.393 4.004 20 0 DIADLO CCCC[C@@H](CC(C)C)[N@@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001173259710 1051660454 /nfs/dbraw/zinc/66/04/54/1051660454.db2.gz JSJWPMLLXPWLGS-IRXDYDNUSA-N 1 2 321.509 4.401 20 0 DIADLO CCCC[C@@H](CC(C)C)[N@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001173259710 1051660460 /nfs/dbraw/zinc/66/04/60/1051660460.db2.gz JSJWPMLLXPWLGS-IRXDYDNUSA-N 1 2 321.509 4.401 20 0 DIADLO CCCc1csc(C[NH2+]Cc2cc(Cl)ccc2OC)n1 ZINC000494005824 1051675940 /nfs/dbraw/zinc/67/59/40/1051675940.db2.gz DBSIAVADRRBYCP-UHFFFAOYSA-N 1 2 310.850 4.047 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)n1 ZINC000766795184 1051678086 /nfs/dbraw/zinc/67/80/86/1051678086.db2.gz CAOUQRDZXSZNSC-QWHCGFSZSA-N 1 2 317.285 4.248 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)n1 ZINC000766795184 1051678093 /nfs/dbraw/zinc/67/80/93/1051678093.db2.gz CAOUQRDZXSZNSC-QWHCGFSZSA-N 1 2 317.285 4.248 20 0 DIADLO COc1cc(C)c(NCc2c[nH+]cn2Cc2ccccc2)cc1C ZINC000766797507 1051678776 /nfs/dbraw/zinc/67/87/76/1051678776.db2.gz MWJMCAZLYPDDSL-UHFFFAOYSA-N 1 2 321.424 4.169 20 0 DIADLO COc1ccc2c(c1)OCC[N@H+]([C@H](C)c1cccc(Cl)c1)C2 ZINC001169706130 1051678852 /nfs/dbraw/zinc/67/88/52/1051678852.db2.gz YXAMYWDHZUFSCS-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc2c(c1)OCC[N@@H+]([C@H](C)c1cccc(Cl)c1)C2 ZINC001169706130 1051678861 /nfs/dbraw/zinc/67/88/61/1051678861.db2.gz YXAMYWDHZUFSCS-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@@H+]1CCOc2cccc(F)c2C1 ZINC001169715103 1051682318 /nfs/dbraw/zinc/68/23/18/1051682318.db2.gz GYRVNGFRFIKQGV-KRWDZBQOSA-N 1 2 303.352 4.311 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@H+]1CCOc2cccc(F)c2C1 ZINC001169715103 1051682325 /nfs/dbraw/zinc/68/23/25/1051682325.db2.gz GYRVNGFRFIKQGV-KRWDZBQOSA-N 1 2 303.352 4.311 20 0 DIADLO Clc1ccnc(Cl)c1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001216303274 1051684978 /nfs/dbraw/zinc/68/49/78/1051684978.db2.gz LQFBXWJCULTQOK-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO CN(C)c1[nH+]cc(CN2CCc3cc(F)ccc32)c2ccccc21 ZINC001169754118 1051692313 /nfs/dbraw/zinc/69/23/13/1051692313.db2.gz GSMMBKWSWXSXMG-UHFFFAOYSA-N 1 2 321.399 4.003 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3nc(Cl)ccc3Cl)CC2)cc1 ZINC000766815510 1051695568 /nfs/dbraw/zinc/69/55/68/1051695568.db2.gz UOHQWMSSTGLJAV-UHFFFAOYSA-N 1 2 311.187 4.306 20 0 DIADLO CCCc1csc(CNc2ccc(-n3cc[nH+]c3)c(F)c2)n1 ZINC000494184146 1051698211 /nfs/dbraw/zinc/69/82/11/1051698211.db2.gz YPCZBMBYZJJMDH-UHFFFAOYSA-N 1 2 316.405 4.033 20 0 DIADLO CCCOc1cc(C)ccc1C[NH2+]Cc1nc(CCC)cs1 ZINC000494190060 1051703448 /nfs/dbraw/zinc/70/34/48/1051703448.db2.gz XPCYBPFTRVYULK-UHFFFAOYSA-N 1 2 318.486 4.483 20 0 DIADLO Cc1cn2cccc(Nc3c(Cl)cc(CO)cc3Cl)c2[nH+]1 ZINC001216360603 1051720915 /nfs/dbraw/zinc/72/09/15/1051720915.db2.gz OGFCAVXMMVDFTL-UHFFFAOYSA-N 1 2 322.195 4.185 20 0 DIADLO CCOc1cc(C)cc(F)c1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001216368714 1051724964 /nfs/dbraw/zinc/72/49/64/1051724964.db2.gz MUNFPZDEMWINBS-UHFFFAOYSA-N 1 2 311.360 4.462 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc(C(=O)N(C)C)cc3C)ccc12 ZINC001212732330 1051732375 /nfs/dbraw/zinc/73/23/75/1051732375.db2.gz MICBRBMXGMSGDL-UHFFFAOYSA-N 1 2 319.408 4.297 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(F)c(OC)c2OC)cc1 ZINC001216396650 1051745149 /nfs/dbraw/zinc/74/51/49/1051745149.db2.gz NLHLFAVFZBVDAZ-UHFFFAOYSA-N 1 2 304.365 4.043 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(F)c(OC)c2OC)cc1 ZINC001216396650 1051745157 /nfs/dbraw/zinc/74/51/57/1051745157.db2.gz NLHLFAVFZBVDAZ-UHFFFAOYSA-N 1 2 304.365 4.043 20 0 DIADLO CC/C=C(/C)C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000767091867 1051760992 /nfs/dbraw/zinc/76/09/92/1051760992.db2.gz KRHZSJWPSGIEEY-AUWJEWJLSA-N 1 2 309.413 4.181 20 0 DIADLO OCc1cc(Cl)cc(Nc2cc[nH+]c3ccc(Cl)cc23)c1 ZINC001216434116 1051764321 /nfs/dbraw/zinc/76/43/21/1051764321.db2.gz SKGSACMPBZKWPM-UHFFFAOYSA-N 1 2 319.191 4.199 20 0 DIADLO COc1ccc([NH2+]CC2CCC(C(F)(F)F)CC2)c(OC)c1 ZINC000767170487 1051767444 /nfs/dbraw/zinc/76/74/44/1051767444.db2.gz AGBPRMXJZQWZCR-UHFFFAOYSA-N 1 2 317.351 4.484 20 0 DIADLO OCc1cc(F)cc(Nc2cc[nH+]c3cc(Cl)ccc23)c1 ZINC001212744664 1051767846 /nfs/dbraw/zinc/76/78/46/1051767846.db2.gz MUCQYGZLTBRYTK-UHFFFAOYSA-N 1 2 302.736 4.263 20 0 DIADLO Cc1cc(C[NH2+]Cc2ncc(-c3ccccc3)cn2)ccc1Cl ZINC000185864534 1051788660 /nfs/dbraw/zinc/78/86/60/1051788660.db2.gz SNGFGZMOXGPUDZ-UHFFFAOYSA-N 1 2 323.827 4.395 20 0 DIADLO FC(F)(F)c1cccc(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001173821570 1051798313 /nfs/dbraw/zinc/79/83/13/1051798313.db2.gz RKZXRBNNWBYVCB-UHFFFAOYSA-N 1 2 307.319 4.444 20 0 DIADLO COc1ccc(Nc2cc[nH+]c(NC(=O)OC(C)(C)C)c2)cc1 ZINC001173806349 1051812483 /nfs/dbraw/zinc/81/24/83/1051812483.db2.gz UMRUNSOFYRNPAL-UHFFFAOYSA-N 1 2 315.373 4.181 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@@H](C)CCC2CC2)c2ccc(Cl)cc2)no1 ZINC000186471942 1051817437 /nfs/dbraw/zinc/81/74/37/1051817437.db2.gz LDRBPZHPBALCGY-ZBEGNZNMSA-N 1 2 319.836 4.289 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cc(SC)cc(F)c1OC ZINC001216580156 1051822783 /nfs/dbraw/zinc/82/27/83/1051822783.db2.gz SEZZANCKKGBQHF-UHFFFAOYSA-N 1 2 308.378 4.094 20 0 DIADLO C/C(=C\c1ccccc1)C[N@@H+]1CCSC[C@@H]1c1nccs1 ZINC000186641029 1051825417 /nfs/dbraw/zinc/82/54/17/1051825417.db2.gz BNHKAOWKWVIJEY-WSYSLRRZSA-N 1 2 316.495 4.337 20 0 DIADLO C/C(=C\c1ccccc1)C[N@H+]1CCSC[C@@H]1c1nccs1 ZINC000186641029 1051825423 /nfs/dbraw/zinc/82/54/23/1051825423.db2.gz BNHKAOWKWVIJEY-WSYSLRRZSA-N 1 2 316.495 4.337 20 0 DIADLO CCn1ncc2cc(Nc3cccc(Cn4cc[nH+]c4)c3)ccc21 ZINC001216591086 1051829402 /nfs/dbraw/zinc/82/94/02/1051829402.db2.gz XXMUWRKFCCIJTM-UHFFFAOYSA-N 1 2 317.396 4.045 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2ccc(F)c(F)c2)cc[nH+]1 ZINC001173865142 1051837227 /nfs/dbraw/zinc/83/72/27/1051837227.db2.gz JJXBIQPCXRBVIL-UHFFFAOYSA-N 1 2 321.327 4.450 20 0 DIADLO COc1c(Nc2cccc3[nH+]ccn32)cccc1C(F)(F)F ZINC001216634148 1051843123 /nfs/dbraw/zinc/84/31/23/1051843123.db2.gz VASCMPUIZWVDRH-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO COc1cc(C)c(NCc2ccc(-n3cc[nH+]c3)cc2)cc1C ZINC000767736989 1051844273 /nfs/dbraw/zinc/84/42/73/1051844273.db2.gz ADVXULOLNQIDLZ-UHFFFAOYSA-N 1 2 307.397 4.110 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccc(Br)cc2)o1 ZINC000220886687 1051845351 /nfs/dbraw/zinc/84/53/51/1051845351.db2.gz CRAVCKUVHIJNNT-GHMZBOCLSA-N 1 2 309.207 4.157 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nnc(-c3cccc(F)c3)o2)[C@@H]1c1ccccc1 ZINC000746490157 1051850478 /nfs/dbraw/zinc/85/04/78/1051850478.db2.gz QZRVYALFKVPBEM-ACJLOTCBSA-N 1 2 323.371 4.069 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nnc(-c3cccc(F)c3)o2)[C@@H]1c1ccccc1 ZINC000746490157 1051850487 /nfs/dbraw/zinc/85/04/87/1051850487.db2.gz QZRVYALFKVPBEM-ACJLOTCBSA-N 1 2 323.371 4.069 20 0 DIADLO Cc1ccc(-c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)c(C)c1 ZINC001216658003 1051853746 /nfs/dbraw/zinc/85/37/46/1051853746.db2.gz QHPGKFUIRSSBER-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Cc1cccc(C)c1-c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001216657792 1051854237 /nfs/dbraw/zinc/85/42/37/1051854237.db2.gz JVUIMWRLLXSFFN-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO CC(C)c1ccc(Nc2ccccc2C[NH+]2CCOCC2)cc1 ZINC001173894426 1051858756 /nfs/dbraw/zinc/85/87/56/1051858756.db2.gz WRMDHDSUTPRRLT-UHFFFAOYSA-N 1 2 310.441 4.386 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CC34CCCC4)c2)[nH+]c1C ZINC000747368462 1051870687 /nfs/dbraw/zinc/87/06/87/1051870687.db2.gz HZBXVWBSILLUCW-INIZCTEOSA-N 1 2 309.413 4.212 20 0 DIADLO Fc1cc(F)cc(Nc2ccc3[nH+]cc(Br)n3c2)c1 ZINC001173913579 1051873471 /nfs/dbraw/zinc/87/34/71/1051873471.db2.gz WKRGREIIJIROTQ-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Cc1c(F)cccc1-c1noc(-c2ccccc2-n2cc[nH+]c2)n1 ZINC001216755401 1051873357 /nfs/dbraw/zinc/87/33/57/1051873357.db2.gz LVVKKVRHVOGIGU-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Cc1cc(F)cc(-c2noc(-c3ccccc3-n3cc[nH+]c3)n2)c1 ZINC001216755402 1051873980 /nfs/dbraw/zinc/87/39/80/1051873980.db2.gz LXVJUBNWACUZFC-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Cc1ccc(-c2noc(-c3ccccc3-n3cc[nH+]c3)n2)c(C)c1 ZINC001216755588 1051874305 /nfs/dbraw/zinc/87/43/05/1051874305.db2.gz SPNYBQAYQSKZJV-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@H](C)c1ccccc1F)c1ccco1 ZINC000152562700 1051880991 /nfs/dbraw/zinc/88/09/91/1051880991.db2.gz YYXIQDCFHMEWCE-RHSMWYFYSA-N 1 2 305.393 4.483 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000189192565 1051887769 /nfs/dbraw/zinc/88/77/69/1051887769.db2.gz RLCNIYTVSACOTB-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1csc(-c2ccco2)n1 ZINC000189193215 1051889316 /nfs/dbraw/zinc/88/93/16/1051889316.db2.gz KNPVSGMIVOHNRS-UHFFFAOYSA-N 1 2 322.792 4.485 20 0 DIADLO COc1ccc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)cn1 ZINC001173958001 1051893613 /nfs/dbraw/zinc/89/36/13/1051893613.db2.gz QMJBKTRJMPAZNQ-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2c(Cl)nc(Cl)n2C)cc1 ZINC000768236712 1051905890 /nfs/dbraw/zinc/90/58/90/1051905890.db2.gz IMUBYUXTTNQKSN-CYBMUJFWSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2c(Cl)nc(Cl)n2C)cc1 ZINC000768236712 1051905897 /nfs/dbraw/zinc/90/58/97/1051905897.db2.gz IMUBYUXTTNQKSN-CYBMUJFWSA-N 1 2 324.255 4.372 20 0 DIADLO Fc1cccc(Nc2cc(Br)c3[nH+]ccn3c2)c1F ZINC001173946473 1051911659 /nfs/dbraw/zinc/91/16/59/1051911659.db2.gz ARVSXCGIXRIKRU-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Brc1ccoc1C[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000768330181 1051917962 /nfs/dbraw/zinc/91/79/62/1051917962.db2.gz OWDVLTMXACVKAQ-GFCCVEGCSA-N 1 2 312.232 4.441 20 0 DIADLO Brc1ccoc1C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000768330181 1051917970 /nfs/dbraw/zinc/91/79/70/1051917970.db2.gz OWDVLTMXACVKAQ-GFCCVEGCSA-N 1 2 312.232 4.441 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1occc1Br ZINC000768416230 1051931085 /nfs/dbraw/zinc/93/10/85/1051931085.db2.gz BPFMLQRYPKKTMR-VIFPVBQESA-N 1 2 300.221 4.297 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1occc1Br ZINC000768416230 1051931098 /nfs/dbraw/zinc/93/10/98/1051931098.db2.gz BPFMLQRYPKKTMR-VIFPVBQESA-N 1 2 300.221 4.297 20 0 DIADLO Cc1cc(Oc2ccc(Nc3cccc(C(N)=O)c3)cc2)cc[nH+]1 ZINC001174061472 1051944903 /nfs/dbraw/zinc/94/49/03/1051944903.db2.gz LTQWAPITAGBKIM-UHFFFAOYSA-N 1 2 319.364 4.025 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000768781948 1051965856 /nfs/dbraw/zinc/96/58/56/1051965856.db2.gz JJQPSBFDGURPSM-UHFFFAOYSA-N 1 2 304.777 4.323 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000768781948 1051965863 /nfs/dbraw/zinc/96/58/63/1051965863.db2.gz JJQPSBFDGURPSM-UHFFFAOYSA-N 1 2 304.777 4.323 20 0 DIADLO CC(C)Oc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001174109096 1051983619 /nfs/dbraw/zinc/98/36/19/1051983619.db2.gz PNVYGWIIQWUPOX-UHFFFAOYSA-N 1 2 307.397 4.462 20 0 DIADLO CC(C)Oc1cccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001174114659 1051988703 /nfs/dbraw/zinc/98/87/03/1051988703.db2.gz CYKABFBAICSIFE-UHFFFAOYSA-N 1 2 307.397 4.462 20 0 DIADLO CCc1cccc(Nc2ccc(C(=O)N3CCCCC3)cc2)[nH+]1 ZINC001174073267 1051993600 /nfs/dbraw/zinc/99/36/00/1051993600.db2.gz QJIXKIAYRXFEEE-UHFFFAOYSA-N 1 2 309.413 4.014 20 0 DIADLO CCCc1cc[nH+]c(Nc2ccc(C(=O)N3CCCCC3)cc2)c1 ZINC001174074101 1051993954 /nfs/dbraw/zinc/99/39/54/1051993954.db2.gz OSLYFDSPSAPIHF-UHFFFAOYSA-N 1 2 323.440 4.404 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(OC)ccc1Cl)c1nc(C)cs1 ZINC000192176962 1052003909 /nfs/dbraw/zinc/00/39/09/1052003909.db2.gz OQZYCCWRZMREBV-CQSZACIVSA-N 1 2 310.850 4.354 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1cnc(-c2ccco2)s1 ZINC000192756720 1052019137 /nfs/dbraw/zinc/01/91/37/1052019137.db2.gz CRSLNZVUARYKMY-UHFFFAOYSA-N 1 2 324.409 4.385 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc(C(=O)NC(C)C)cc3)ccc12 ZINC001174149415 1052019478 /nfs/dbraw/zinc/01/94/78/1052019478.db2.gz BUAJGLKPFCSVEV-UHFFFAOYSA-N 1 2 319.408 4.425 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000192837462 1052021194 /nfs/dbraw/zinc/02/11/94/1052021194.db2.gz HOYNZFKMMDYWDW-HNNXBMFYSA-N 1 2 303.475 4.116 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000192837462 1052021199 /nfs/dbraw/zinc/02/11/99/1052021199.db2.gz HOYNZFKMMDYWDW-HNNXBMFYSA-N 1 2 303.475 4.116 20 0 DIADLO CC(C)CC[C@H]1CCC[C@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001217318129 1052021707 /nfs/dbraw/zinc/02/17/07/1052021707.db2.gz HUBXSQLARUKURH-GDBMZVCRSA-N 1 2 314.433 4.061 20 0 DIADLO Cc1cc(C)c(NC(=O)COc2cccc3ccccc32)c(C)[nH+]1 ZINC000192830354 1052021902 /nfs/dbraw/zinc/02/19/02/1052021902.db2.gz SGSANSWINZESAD-UHFFFAOYSA-N 1 2 320.392 4.178 20 0 DIADLO CC[C@H](C)Oc1cccc(NC(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC001217319693 1052024396 /nfs/dbraw/zinc/02/43/96/1052024396.db2.gz YVRDQUIYCICQSX-ZDUSSCGKSA-N 1 2 324.384 4.156 20 0 DIADLO C[C@@H]1CC[C@](C)(/C=C\C(=O)Nc2ccc3[nH+]ccn3c2)C1(C)C ZINC001131309660 1052027579 /nfs/dbraw/zinc/02/75/79/1052027579.db2.gz UFCPPEATNKTKIB-WKZWABTMSA-N 1 2 311.429 4.291 20 0 DIADLO CC(C)c1ccc(C(=O)Nc2ccc3[nH+]ccn3c2)cc1Cl ZINC001131308845 1052027826 /nfs/dbraw/zinc/02/78/26/1052027826.db2.gz BGBHTUAQLVDJMG-UHFFFAOYSA-N 1 2 313.788 4.363 20 0 DIADLO CCCCCC/C(=C\c1ccccc1)C[N@@H+]1CCn2cnnc2C1 ZINC000769359465 1052030976 /nfs/dbraw/zinc/03/09/76/1052030976.db2.gz LENIMSGRMYWJLK-XMHGGMMESA-N 1 2 324.472 4.148 20 0 DIADLO CCCCCC/C(=C\c1ccccc1)C[N@H+]1CCn2cnnc2C1 ZINC000769359465 1052030983 /nfs/dbraw/zinc/03/09/83/1052030983.db2.gz LENIMSGRMYWJLK-XMHGGMMESA-N 1 2 324.472 4.148 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CCc3c(F)cccc3C2)s1 ZINC000769388112 1052036844 /nfs/dbraw/zinc/03/68/44/1052036844.db2.gz QOGNEABHKSSBKO-UHFFFAOYSA-N 1 2 304.434 4.138 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CCc3c(F)cccc3C2)s1 ZINC000769388112 1052036852 /nfs/dbraw/zinc/03/68/52/1052036852.db2.gz QOGNEABHKSSBKO-UHFFFAOYSA-N 1 2 304.434 4.138 20 0 DIADLO CN(C)c1ccc(Nc2ccc(C(=O)c3ccccc3)cc2)c[nH+]1 ZINC001174223069 1052059909 /nfs/dbraw/zinc/05/99/09/1052059909.db2.gz UBKFHIYSKQYGPR-UHFFFAOYSA-N 1 2 317.392 4.122 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2F)[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458736 1052062050 /nfs/dbraw/zinc/06/20/50/1052062050.db2.gz ZMVSJOGCCSGFSN-SJKOYZFVSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458736 1052062059 /nfs/dbraw/zinc/06/20/59/1052062059.db2.gz ZMVSJOGCCSGFSN-SJKOYZFVSA-N 1 2 300.377 4.274 20 0 DIADLO COc1ccc2c(c1F)CC[C@@H]2Nc1ccc([NH+](C)C)cc1C ZINC000808710211 1052070359 /nfs/dbraw/zinc/07/03/59/1052070359.db2.gz MVDXKYIYUWYDNE-KRWDZBQOSA-N 1 2 314.404 4.308 20 0 DIADLO Fc1cncc(Nc2cc[nH+]c3cc(Br)ccc23)c1 ZINC001174290273 1052071665 /nfs/dbraw/zinc/07/16/65/1052071665.db2.gz LNMUNRGQIWKQGH-UHFFFAOYSA-N 1 2 318.149 4.275 20 0 DIADLO Cc1cccc(-c2noc(-c3cccc4[nH+]ccn43)n2)c1Cl ZINC001217501065 1052075671 /nfs/dbraw/zinc/07/56/71/1052075671.db2.gz QPVQIGIQOLQHHW-UHFFFAOYSA-N 1 2 310.744 4.013 20 0 DIADLO c1cnn(-c2cccc(Nc3ccc[nH+]c3N3CCCCC3)c2)c1 ZINC001174299990 1052076935 /nfs/dbraw/zinc/07/69/35/1052076935.db2.gz XRGRIBWSYMEVPY-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO Cc1ccc2c(Nc3cccc(-n4cccn4)c3)cccc2[nH+]1 ZINC001174300511 1052077621 /nfs/dbraw/zinc/07/76/21/1052077621.db2.gz CUHSYMOJCYVRGM-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO C[C@H]1C[N@H+](Cc2occc2Br)[C@@H]1c1ccccc1 ZINC000769541955 1052078628 /nfs/dbraw/zinc/07/86/28/1052078628.db2.gz XIODTTMOZXBDLI-NHYWBVRUSA-N 1 2 306.203 4.235 20 0 DIADLO C[C@H]1C[N@@H+](Cc2occc2Br)[C@@H]1c1ccccc1 ZINC000769541955 1052078640 /nfs/dbraw/zinc/07/86/40/1052078640.db2.gz XIODTTMOZXBDLI-NHYWBVRUSA-N 1 2 306.203 4.235 20 0 DIADLO c1cc(Nc2ccc(N3CCCC3)[nH+]c2)cc(N2CCCCC2)c1 ZINC001174301750 1052078879 /nfs/dbraw/zinc/07/88/79/1052078879.db2.gz IDQGTQFUQIOGAO-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@@H]3CCC[C@@H]3C)c2)[nH+]c1C ZINC000769560358 1052082232 /nfs/dbraw/zinc/08/22/32/1052082232.db2.gz PNAVBAPCUGCIRU-WFASDCNBSA-N 1 2 311.429 4.458 20 0 DIADLO FC(F)(F)c1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)cn1 ZINC001174311311 1052093216 /nfs/dbraw/zinc/09/32/16/1052093216.db2.gz AOMTZBNBLGWXEM-UHFFFAOYSA-N 1 2 318.302 4.089 20 0 DIADLO Cc1cccc(NC(=O)C[N@H+](C)Cc2cc(Cl)cs2)c1C ZINC000194308540 1052105275 /nfs/dbraw/zinc/10/52/75/1052105275.db2.gz NTLBNWCOHVPGQA-UHFFFAOYSA-N 1 2 322.861 4.089 20 0 DIADLO Cc1cccc(NC(=O)C[N@@H+](C)Cc2cc(Cl)cs2)c1C ZINC000194308540 1052105269 /nfs/dbraw/zinc/10/52/69/1052105269.db2.gz NTLBNWCOHVPGQA-UHFFFAOYSA-N 1 2 322.861 4.089 20 0 DIADLO c1coc(-c2ncc(C[N@@H+]3CCc4sccc4C3)s2)c1 ZINC000194320660 1052105988 /nfs/dbraw/zinc/10/59/88/1052105988.db2.gz JHEWGKIWCIYAKV-UHFFFAOYSA-N 1 2 302.424 4.023 20 0 DIADLO c1coc(-c2ncc(C[N@H+]3CCc4sccc4C3)s2)c1 ZINC000194320660 1052105995 /nfs/dbraw/zinc/10/59/95/1052105995.db2.gz JHEWGKIWCIYAKV-UHFFFAOYSA-N 1 2 302.424 4.023 20 0 DIADLO CC(C)COc1ccc(C[NH2+]Cc2ncc(Cl)s2)cc1 ZINC000769910995 1052120133 /nfs/dbraw/zinc/12/01/33/1052120133.db2.gz VWOVOXZVSQEGGQ-UHFFFAOYSA-N 1 2 310.850 4.121 20 0 DIADLO Clc1cnc(C[NH2+]Cc2cnc(-c3ccccc3)s2)s1 ZINC000769916980 1052121896 /nfs/dbraw/zinc/12/18/96/1052121896.db2.gz LOQPVIRKYZOUER-UHFFFAOYSA-N 1 2 321.858 4.210 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1[C@@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC000769953070 1052128011 /nfs/dbraw/zinc/12/80/11/1052128011.db2.gz JMAYLDDWJIENHK-JQWIXIFHSA-N 1 2 321.827 4.029 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1[C@@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC000769953070 1052128014 /nfs/dbraw/zinc/12/80/14/1052128014.db2.gz JMAYLDDWJIENHK-JQWIXIFHSA-N 1 2 321.827 4.029 20 0 DIADLO c1nc2ccc(Nc3ccc[nH+]c3N3CCCCC3)cc2s1 ZINC001174364500 1052130329 /nfs/dbraw/zinc/13/03/29/1052130329.db2.gz YCMFRUCIADRCBP-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(cnn4C)c3)ccc21 ZINC001174381002 1052138854 /nfs/dbraw/zinc/13/88/54/1052138854.db2.gz FAYGSYFPGAFWKR-UHFFFAOYSA-N 1 2 305.385 4.248 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccccc3C(=O)N(C)C)ccc21 ZINC001174381113 1052139259 /nfs/dbraw/zinc/13/92/59/1052139259.db2.gz FTVACHWZIOFEEQ-UHFFFAOYSA-N 1 2 322.412 4.063 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(C(F)(F)F)no3)ccc21 ZINC001174381040 1052139296 /nfs/dbraw/zinc/13/92/96/1052139296.db2.gz QYALRJDLTKMNJG-UHFFFAOYSA-N 1 2 310.279 4.368 20 0 DIADLO COc1cnc(Cl)c(Nc2ccc3c(c2)[nH+]cn3C(C)C)c1 ZINC001174382127 1052141459 /nfs/dbraw/zinc/14/14/59/1052141459.db2.gz ZTZZUZUHEQOPRC-UHFFFAOYSA-N 1 2 316.792 4.418 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cnn4cc(F)ccc34)ccc21 ZINC001174381739 1052141492 /nfs/dbraw/zinc/14/14/92/1052141492.db2.gz QZQXOOYSZCKUEN-UHFFFAOYSA-N 1 2 309.348 4.148 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(Cl)[nH]c(=O)c3)ccc21 ZINC001174382551 1052142305 /nfs/dbraw/zinc/14/23/05/1052142305.db2.gz VZYYOJZNKQZZTC-UHFFFAOYSA-N 1 2 302.765 4.115 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4oc(=O)ccc4c3)ccc21 ZINC001174383952 1052142423 /nfs/dbraw/zinc/14/24/23/1052142423.db2.gz AYAMNFILXKWZMH-UHFFFAOYSA-N 1 2 319.364 4.467 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4c3COC4=O)ccc21 ZINC001174382641 1052143078 /nfs/dbraw/zinc/14/30/78/1052143078.db2.gz ABEVBBSHWLZUSS-UHFFFAOYSA-N 1 2 307.353 4.031 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(c3)CC(=O)C4)ccc21 ZINC001174383929 1052143517 /nfs/dbraw/zinc/14/35/17/1052143517.db2.gz AERMMJRWAJIQER-UHFFFAOYSA-N 1 2 305.381 4.029 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4nccnc43)ccc21 ZINC001174382940 1052143851 /nfs/dbraw/zinc/14/38/51/1052143851.db2.gz FEQZSEZJYQTXCU-UHFFFAOYSA-N 1 2 303.369 4.304 20 0 DIADLO CC(=O)c1cccc(O)c1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174384561 1052144419 /nfs/dbraw/zinc/14/44/19/1052144419.db2.gz ZLSKVSSIKYNEQF-UHFFFAOYSA-N 1 2 309.369 4.269 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(c3)CCN4C)ccc21 ZINC001174385639 1052145492 /nfs/dbraw/zinc/14/54/92/1052145492.db2.gz RVALHCNUHMTIHD-UHFFFAOYSA-N 1 2 306.413 4.353 20 0 DIADLO CC(C)n1c[nH+]c2cc(N3CCCc4cc(N)ccc43)ccc21 ZINC001174386038 1052145694 /nfs/dbraw/zinc/14/56/94/1052145694.db2.gz YGCQRORMUBNVDD-UHFFFAOYSA-N 1 2 306.413 4.284 20 0 DIADLO Cc1c(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)cnn1C ZINC001174389872 1052146387 /nfs/dbraw/zinc/14/63/87/1052146387.db2.gz WYTUQOVTWMKLIU-UHFFFAOYSA-N 1 2 306.291 4.039 20 0 DIADLO CCN(C(=O)c1cccc2[nH+]ccn21)c1cccc2ccccc21 ZINC000770072371 1052148690 /nfs/dbraw/zinc/14/86/90/1052148690.db2.gz XXVVRKNKCQXWSJ-UHFFFAOYSA-N 1 2 315.376 4.154 20 0 DIADLO c1csc([C@H]2CCC[N@H+]2Cc2noc(-c3ccccc3)n2)c1 ZINC000053399393 1052158447 /nfs/dbraw/zinc/15/84/47/1052158447.db2.gz XZKOVNITRORZGZ-CQSZACIVSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc([C@H]2CCC[N@@H+]2Cc2noc(-c3ccccc3)n2)c1 ZINC000053399393 1052158455 /nfs/dbraw/zinc/15/84/55/1052158455.db2.gz XZKOVNITRORZGZ-CQSZACIVSA-N 1 2 311.410 4.135 20 0 DIADLO CC[C@H](C[NH2+][C@H](c1ncn[nH]1)C1CCCCC1)c1ccccc1 ZINC000494901944 1052163869 /nfs/dbraw/zinc/16/38/69/1052163869.db2.gz GWONKMNXOISUJA-QAPCUYQASA-N 1 2 312.461 4.210 20 0 DIADLO Cc1ccccc1-c1nn(C[N@@H+](CC(C)C)C2CC2)c(=S)o1 ZINC000914566708 1052166900 /nfs/dbraw/zinc/16/69/00/1052166900.db2.gz FEUQCZRUQUMTCS-UHFFFAOYSA-N 1 2 317.458 4.259 20 0 DIADLO Cc1ccccc1-c1nn(C[N@H+](CC(C)C)C2CC2)c(=S)o1 ZINC000914566708 1052166910 /nfs/dbraw/zinc/16/69/10/1052166910.db2.gz FEUQCZRUQUMTCS-UHFFFAOYSA-N 1 2 317.458 4.259 20 0 DIADLO Nc1cccc(Cc2cccc(Nc3cc[nH+]c4[nH]ccc43)c2)c1 ZINC001174414599 1052167193 /nfs/dbraw/zinc/16/71/93/1052167193.db2.gz YEGGGWMVAUTBTR-UHFFFAOYSA-N 1 2 314.392 4.431 20 0 DIADLO CCCC[N@H+](CC)Cn1nc2sc3ccccc3n2c1=S ZINC000914567156 1052169833 /nfs/dbraw/zinc/16/98/33/1052169833.db2.gz FVPRXGNHQNMIMY-UHFFFAOYSA-N 1 2 320.487 4.159 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc2sc3ccccc3n2c1=S ZINC000914567156 1052169837 /nfs/dbraw/zinc/16/98/37/1052169837.db2.gz FVPRXGNHQNMIMY-UHFFFAOYSA-N 1 2 320.487 4.159 20 0 DIADLO Cc1cccc(-c2ccccc2)c1O[C@@H]1CC[NH2+]CC1(F)F ZINC001218005115 1052184083 /nfs/dbraw/zinc/18/40/83/1052184083.db2.gz DXJWNMXMNNHGDT-MRXNPFEDSA-N 1 2 303.352 4.038 20 0 DIADLO C[C@@H](c1ccccc1)c1ccccc1O[C@H]1CC[NH2+]CC1(F)F ZINC001218011435 1052185158 /nfs/dbraw/zinc/18/51/58/1052185158.db2.gz HOQUCNFZEFPTAO-KSSFIOAISA-N 1 2 317.379 4.214 20 0 DIADLO FC1(F)C[NH2+]CC[C@H]1Oc1cc(Cl)c(Cl)c(Cl)c1 ZINC001218012438 1052185721 /nfs/dbraw/zinc/18/57/21/1052185721.db2.gz PUMOVFHCTCQQIU-SECBINFHSA-N 1 2 316.562 4.023 20 0 DIADLO Nc1[nH+]cccc1O[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC001218191415 1052205217 /nfs/dbraw/zinc/20/52/17/1052205217.db2.gz AMQDMJHOOCOXSU-QGZVFWFLSA-N 1 2 310.784 4.486 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H](C)c3ccc(Cl)s3)ccc2[nH+]1 ZINC000495094245 1052216112 /nfs/dbraw/zinc/21/61/12/1052216112.db2.gz OTCZAKDUHFMRKL-JTQLQIEISA-N 1 2 319.817 4.100 20 0 DIADLO Cc1nn(C[N@@H+]2CCC[C@H]2c2cc(C)ccc2C)c(=S)s1 ZINC000761830892 1052242288 /nfs/dbraw/zinc/24/22/88/1052242288.db2.gz LCZGMKPKVMPXIY-HNNXBMFYSA-N 1 2 319.499 4.394 20 0 DIADLO Cc1nn(C[N@H+]2CCC[C@H]2c2cc(C)ccc2C)c(=S)s1 ZINC000761830892 1052242295 /nfs/dbraw/zinc/24/22/95/1052242295.db2.gz LCZGMKPKVMPXIY-HNNXBMFYSA-N 1 2 319.499 4.394 20 0 DIADLO CCCC[N@H+](Cn1nc(-c2ccccc2F)oc1=S)C1CC1 ZINC000914784098 1052251250 /nfs/dbraw/zinc/25/12/50/1052251250.db2.gz YKWRIUGHZJTELG-UHFFFAOYSA-N 1 2 321.421 4.234 20 0 DIADLO CCCC[N@@H+](Cn1nc(-c2ccccc2F)oc1=S)C1CC1 ZINC000914784098 1052251261 /nfs/dbraw/zinc/25/12/61/1052251261.db2.gz YKWRIUGHZJTELG-UHFFFAOYSA-N 1 2 321.421 4.234 20 0 DIADLO Cc1cc(C)c(NC(=O)NC[C@@H]2CCC[C@H](C)[C@@H]2C)c(C)[nH+]1 ZINC001219009523 1052267743 /nfs/dbraw/zinc/26/77/43/1052267743.db2.gz CZFDPNGWMDLQTL-PJODQICGSA-N 1 2 303.450 4.201 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1nc2ccccc2s1 ZINC000315098166 1052331962 /nfs/dbraw/zinc/33/19/62/1052331962.db2.gz IQXPEWMDOXWWIZ-NSHDSACASA-N 1 2 313.382 4.055 20 0 DIADLO CCCCOc1ncccc1C[NH2+][C@H](C)c1cc(F)ccc1F ZINC000495512384 1052364527 /nfs/dbraw/zinc/36/45/27/1052364527.db2.gz GCQORVILDPNPJV-CYBMUJFWSA-N 1 2 320.383 4.390 20 0 DIADLO CC(C)[C@H](C)[N@H+](C)Cn1[nH]c(/C=C\c2ccccc2)nc1=S ZINC000915208110 1052367058 /nfs/dbraw/zinc/36/70/58/1052367058.db2.gz CGHRHNWUHWUNCP-BMSUMIBZSA-N 1 2 316.474 4.045 20 0 DIADLO CC(C)[C@H](C)[N@@H+](C)Cn1[nH]c(/C=C\c2ccccc2)nc1=S ZINC000915208110 1052367064 /nfs/dbraw/zinc/36/70/64/1052367064.db2.gz CGHRHNWUHWUNCP-BMSUMIBZSA-N 1 2 316.474 4.045 20 0 DIADLO COCc1ccc(C[NH+](C/C=C/Cl)C/C=C/Cl)cc1 ZINC000915260069 1052378799 /nfs/dbraw/zinc/37/87/99/1052378799.db2.gz BNWAZPLFKYWAOW-CPJVMOPCSA-N 1 2 300.229 4.140 20 0 DIADLO Fc1cc(Cl)cc(CNc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC000319315615 1052422964 /nfs/dbraw/zinc/42/29/64/1052422964.db2.gz PUSDPRDWVWJGET-UHFFFAOYSA-N 1 2 319.811 4.477 20 0 DIADLO Nc1cc(F)c(F)cc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC000319892167 1052435567 /nfs/dbraw/zinc/43/55/67/1052435567.db2.gz JFQPQRACACMJIT-UHFFFAOYSA-N 1 2 303.356 4.281 20 0 DIADLO Cc1ccc2cccc(NCc3ccc(-n4cc[nH+]c4)cc3)c2n1 ZINC000237822007 1052445658 /nfs/dbraw/zinc/44/56/58/1052445658.db2.gz OFCGNVJUKOVDRL-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Clc1cccc([C@H](OCCn2cc[nH+]c2)c2ccccc2)c1 ZINC001222134840 1052448685 /nfs/dbraw/zinc/44/86/85/1052448685.db2.gz PVNUBAVPRNPJIY-GOSISDBHSA-N 1 2 312.800 4.343 20 0 DIADLO C(=C/[C@@H](OCCn1cc[nH+]c1)c1ccccc1)\c1ccccc1 ZINC001222138248 1052449513 /nfs/dbraw/zinc/44/95/13/1052449513.db2.gz CJOWUTITRQIXIF-YVNCXZRQSA-N 1 2 304.393 4.354 20 0 DIADLO c1cn(CCO[C@@H]2CCN(c3ccccc3)c3ccccc32)c[nH+]1 ZINC001222138966 1052449862 /nfs/dbraw/zinc/44/98/62/1052449862.db2.gz MMXYXRMKOIQXQS-HXUWFJFHSA-N 1 2 319.408 4.183 20 0 DIADLO Cc1ccc(Nc2ccc(N(C)Cc3ccccc3)[nH+]c2)c(F)n1 ZINC001203514363 1052458915 /nfs/dbraw/zinc/45/89/15/1052458915.db2.gz ZIAYLUIKZXIHPI-UHFFFAOYSA-N 1 2 322.387 4.304 20 0 DIADLO COCc1ccc(Cl)c(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1 ZINC001222278677 1052473002 /nfs/dbraw/zinc/47/30/02/1052473002.db2.gz BKEVYGXXKIADSZ-UHFFFAOYSA-N 1 2 316.763 4.478 20 0 DIADLO CO[C@@H]1CCC[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC001235589907 1052486498 /nfs/dbraw/zinc/48/64/98/1052486498.db2.gz FUHSUYJKKIPPTE-SNVBAGLBSA-N 1 2 308.636 4.258 20 0 DIADLO CO[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC001235589907 1052486501 /nfs/dbraw/zinc/48/65/01/1052486501.db2.gz FUHSUYJKKIPPTE-SNVBAGLBSA-N 1 2 308.636 4.258 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1cc(C)c(C)o1)c1nnc2n1CCCCC2 ZINC000282113741 1052488870 /nfs/dbraw/zinc/48/88/70/1052488870.db2.gz JDTBMPVEWCZEQK-UKRRQHHQSA-N 1 2 316.449 4.016 20 0 DIADLO Cc1cc(C)cc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000107072339 1052544541 /nfs/dbraw/zinc/54/45/41/1052544541.db2.gz UHUVKUMRPYUCGT-KGLIPLIRSA-N 1 2 301.434 4.396 20 0 DIADLO CC(C)(C)c1ncc(C[NH2+][C@H](c2ccco2)c2ccccc2)cn1 ZINC000326592009 1052565885 /nfs/dbraw/zinc/56/58/85/1052565885.db2.gz DGQYGMFEMKJZHV-SFHVURJKSA-N 1 2 321.424 4.246 20 0 DIADLO C[C@@H](c1nc2ccccc2c(=O)[nH]1)[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000916152346 1052594576 /nfs/dbraw/zinc/59/45/76/1052594576.db2.gz PQUKVFQMJMKOIT-KGLIPLIRSA-N 1 2 319.408 4.016 20 0 DIADLO C[C@@H](c1nc2ccccc2c(=O)[nH]1)[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000916152346 1052594582 /nfs/dbraw/zinc/59/45/82/1052594582.db2.gz PQUKVFQMJMKOIT-KGLIPLIRSA-N 1 2 319.408 4.016 20 0 DIADLO Cc1cc(CO[C@@H](C(=O)c2ccco2)c2ccco2)cc(C)[nH+]1 ZINC001223422623 1052598865 /nfs/dbraw/zinc/59/88/65/1052598865.db2.gz YEODFRRVHXIZAU-GOSISDBHSA-N 1 2 311.337 4.025 20 0 DIADLO O=C(/C=C/c1ccc(Cl)cc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000916419308 1052607131 /nfs/dbraw/zinc/60/71/31/1052607131.db2.gz VWOLTTGFVHSWLW-RMKNXTFCSA-N 1 2 323.783 4.178 20 0 DIADLO CCCOc1cccc(CNc2ccc(N(CC)CC)[nH+]c2)c1 ZINC000321018135 1052613827 /nfs/dbraw/zinc/61/38/27/1052613827.db2.gz QZGWINJZDJVTDR-UHFFFAOYSA-N 1 2 313.445 4.329 20 0 DIADLO CC[N@@H+](Cc1cn2ccsc2n1)Cc1ccc(Cl)s1 ZINC000064344779 1052646677 /nfs/dbraw/zinc/64/66/77/1052646677.db2.gz QOJBBFDAWUGZLR-UHFFFAOYSA-N 1 2 311.863 4.133 20 0 DIADLO CC[N@H+](Cc1cn2ccsc2n1)Cc1ccc(Cl)s1 ZINC000064344779 1052646680 /nfs/dbraw/zinc/64/66/80/1052646680.db2.gz QOJBBFDAWUGZLR-UHFFFAOYSA-N 1 2 311.863 4.133 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+]2CCO[C@H](c3ccsc3)C2)c1 ZINC000125869379 1052655636 /nfs/dbraw/zinc/65/56/36/1052655636.db2.gz MEDOWWYBGMTVOS-SFHVURJKSA-N 1 2 317.454 4.109 20 0 DIADLO CC(C)Oc1cccc(C[N@H+]2CCO[C@H](c3ccsc3)C2)c1 ZINC000125869379 1052655640 /nfs/dbraw/zinc/65/56/40/1052655640.db2.gz MEDOWWYBGMTVOS-SFHVURJKSA-N 1 2 317.454 4.109 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+]2CCO[C@@H](c3ccsc3)C2)c1 ZINC000125869616 1052655801 /nfs/dbraw/zinc/65/58/01/1052655801.db2.gz MEDOWWYBGMTVOS-GOSISDBHSA-N 1 2 317.454 4.109 20 0 DIADLO CC(C)Oc1cccc(C[N@H+]2CCO[C@@H](c3ccsc3)C2)c1 ZINC000125869616 1052655805 /nfs/dbraw/zinc/65/58/05/1052655805.db2.gz MEDOWWYBGMTVOS-GOSISDBHSA-N 1 2 317.454 4.109 20 0 DIADLO COc1cccc2cc(CNc3ccc(N4CCCC4)c[nH+]3)oc21 ZINC000916842312 1052659333 /nfs/dbraw/zinc/65/93/33/1052659333.db2.gz BVJPSVKAQXEPSC-UHFFFAOYSA-N 1 2 323.396 4.049 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@@H+]2Cc2cncs2)cc1 ZINC000126233539 1052668023 /nfs/dbraw/zinc/66/80/23/1052668023.db2.gz YPGCZTZRTZQRML-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc([C@@H]2CCC[N@H+]2Cc2cncs2)cc1 ZINC000126233539 1052668028 /nfs/dbraw/zinc/66/80/28/1052668028.db2.gz YPGCZTZRTZQRML-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cnc2ccsc2c1 ZINC000126489394 1052671905 /nfs/dbraw/zinc/67/19/05/1052671905.db2.gz QSQODGQADNCBBJ-ZDUSSCGKSA-N 1 2 324.453 4.465 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+]1CCO[C@H](c2cccc(O)c2)C1 ZINC000126828498 1052681127 /nfs/dbraw/zinc/68/11/27/1052681127.db2.gz UTUNFFZFUNXTDJ-UGSOOPFHSA-N 1 2 317.816 4.180 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+]1CCO[C@H](c2cccc(O)c2)C1 ZINC000126828498 1052681129 /nfs/dbraw/zinc/68/11/29/1052681129.db2.gz UTUNFFZFUNXTDJ-UGSOOPFHSA-N 1 2 317.816 4.180 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+]1CCO[C@H](c2cccc(O)c2)C1 ZINC000126828775 1052681534 /nfs/dbraw/zinc/68/15/34/1052681534.db2.gz UTUNFFZFUNXTDJ-ACJLOTCBSA-N 1 2 317.816 4.180 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+]1CCO[C@H](c2cccc(O)c2)C1 ZINC000126828775 1052681535 /nfs/dbraw/zinc/68/15/35/1052681535.db2.gz UTUNFFZFUNXTDJ-ACJLOTCBSA-N 1 2 317.816 4.180 20 0 DIADLO CC(C)Oc1cc(F)c(F)cc1Nc1cccc2[nH+]ccn21 ZINC001212220029 1052685909 /nfs/dbraw/zinc/68/59/09/1052685909.db2.gz FKKGVYYNPNDUAO-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)CC(=O)NC1CCCCCCC1 ZINC000917064112 1052689120 /nfs/dbraw/zinc/68/91/20/1052689120.db2.gz JFPPZGQTOUJXAY-HNNXBMFYSA-N 1 2 320.452 4.048 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)CC(=O)NC1CCCCCCC1 ZINC000917064112 1052689122 /nfs/dbraw/zinc/68/91/22/1052689122.db2.gz JFPPZGQTOUJXAY-HNNXBMFYSA-N 1 2 320.452 4.048 20 0 DIADLO C[N@H+](C/C=C\c1ccccc1)Cc1ccn(-c2ccccc2)n1 ZINC000917068287 1052691252 /nfs/dbraw/zinc/69/12/52/1052691252.db2.gz QJRUBUQDHBPMTD-FLIBITNWSA-N 1 2 303.409 4.018 20 0 DIADLO C[N@@H+](C/C=C\c1ccccc1)Cc1ccn(-c2ccccc2)n1 ZINC000917068287 1052691255 /nfs/dbraw/zinc/69/12/55/1052691255.db2.gz QJRUBUQDHBPMTD-FLIBITNWSA-N 1 2 303.409 4.018 20 0 DIADLO c1c[nH]c([C@H]([NH2+][C@@H]2CCSc3ccccc32)c2ccccc2)n1 ZINC000127804332 1052702924 /nfs/dbraw/zinc/70/29/24/1052702924.db2.gz BZKBOKNYIKUREJ-SJLPKXTDSA-N 1 2 321.449 4.326 20 0 DIADLO C[N@H+](Cc1ncc(-c2cccs2)o1)Cc1ccc(F)cc1 ZINC000067374910 1052703222 /nfs/dbraw/zinc/70/32/22/1052703222.db2.gz CVHFBEKHATZPCO-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1ncc(-c2cccs2)o1)Cc1ccc(F)cc1 ZINC000067374910 1052703225 /nfs/dbraw/zinc/70/32/25/1052703225.db2.gz CVHFBEKHATZPCO-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1ncc(-c2cccs2)o1 ZINC000067375167 1052704097 /nfs/dbraw/zinc/70/40/97/1052704097.db2.gz WFCQQHYPKSYVBW-UHFFFAOYSA-N 1 2 304.440 4.487 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1ncc(-c2cccs2)o1 ZINC000067375167 1052704103 /nfs/dbraw/zinc/70/41/03/1052704103.db2.gz WFCQQHYPKSYVBW-UHFFFAOYSA-N 1 2 304.440 4.487 20 0 DIADLO CC(C)C[C@@H](c1nc(C(C)(C)c2ccccc2)no1)n1cc[nH+]c1 ZINC000924009307 1052714722 /nfs/dbraw/zinc/71/47/22/1052714722.db2.gz XPIPGGYKOYJABJ-INIZCTEOSA-N 1 2 324.428 4.228 20 0 DIADLO C[C@@H]1CSC(SCc2c[nH+]c(N(C)C)c3ccccc23)=N1 ZINC000917367516 1052722383 /nfs/dbraw/zinc/72/23/83/1052722383.db2.gz ITXFDXKNOVBRMV-LLVKDONJSA-N 1 2 317.483 4.025 20 0 DIADLO CCSc1nn(C[N@H+](C)C2CCC(C)CC2)c(=S)s1 ZINC000917456235 1052730078 /nfs/dbraw/zinc/73/00/78/1052730078.db2.gz JZOHICLPSFQPFV-UHFFFAOYSA-N 1 2 317.549 4.254 20 0 DIADLO CCSc1nn(C[N@@H+](C)C2CCC(C)CC2)c(=S)s1 ZINC000917456235 1052730080 /nfs/dbraw/zinc/73/00/80/1052730080.db2.gz JZOHICLPSFQPFV-UHFFFAOYSA-N 1 2 317.549 4.254 20 0 DIADLO Brc1ccc2c(c1)[C@H](Oc1cc[nH+]cc1)CCC2 ZINC001225293969 1052769813 /nfs/dbraw/zinc/76/98/13/1052769813.db2.gz DCTLGJKAZGPMML-OAHLLOKOSA-N 1 2 304.187 4.301 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1nccn1Cc1ccccc1 ZINC000129971945 1052816507 /nfs/dbraw/zinc/81/65/07/1052816507.db2.gz KFLCUUAGMFCGMQ-HNNXBMFYSA-N 1 2 311.454 4.186 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1nccn1Cc1ccccc1 ZINC000129971945 1052816510 /nfs/dbraw/zinc/81/65/10/1052816510.db2.gz KFLCUUAGMFCGMQ-HNNXBMFYSA-N 1 2 311.454 4.186 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@H](C)c2ccncc2F)c2ccccn2)cc1 ZINC000556245048 1052826021 /nfs/dbraw/zinc/82/60/21/1052826021.db2.gz MAASNHIPWAJJSM-FOIQADDNSA-N 1 2 321.399 4.364 20 0 DIADLO CC(C)(C)OCCOc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000556288224 1052835267 /nfs/dbraw/zinc/83/52/67/1052835267.db2.gz PXNQQVOVKMMDKG-UHFFFAOYSA-N 1 2 314.429 4.080 20 0 DIADLO CC[C@H]1CCC[C@@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000556418223 1052851028 /nfs/dbraw/zinc/85/10/28/1052851028.db2.gz ZQJHYQQFIZRNDZ-RDJZCZTQSA-N 1 2 322.412 4.275 20 0 DIADLO Clc1nccc(Nc2cccc(-n3cc[nH+]c3)c2)c1Cl ZINC001212238207 1052851527 /nfs/dbraw/zinc/85/15/27/1052851527.db2.gz WBQYDPCFVJUAFX-UHFFFAOYSA-N 1 2 305.168 4.318 20 0 DIADLO CC1(C)CCc2onc(Cn3c[nH+]c(Cc4ccccc4)c3)c2C1 ZINC000919155784 1052853519 /nfs/dbraw/zinc/85/35/19/1052853519.db2.gz GQTBTBUDCPMRAI-UHFFFAOYSA-N 1 2 321.424 4.025 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCC[N@@H+]2Cc2cnccn2)c1 ZINC000556785122 1052883524 /nfs/dbraw/zinc/88/35/24/1052883524.db2.gz IVLJCGNVEIDDGO-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCC[N@H+]2Cc2cnccn2)c1 ZINC000556785122 1052883528 /nfs/dbraw/zinc/88/35/28/1052883528.db2.gz IVLJCGNVEIDDGO-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO C[C@H]([NH2+][C@H](c1cccs1)c1ccc(F)cc1)c1ncc[nH]1 ZINC000556860397 1052890184 /nfs/dbraw/zinc/89/01/84/1052890184.db2.gz IZMXOXSZVSBWHB-NHYWBVRUSA-N 1 2 301.390 4.051 20 0 DIADLO C[C@@H]([NH2+][C@H](c1cccs1)c1ccc(F)cc1)c1ncc[nH]1 ZINC000556860395 1052890326 /nfs/dbraw/zinc/89/03/26/1052890326.db2.gz IZMXOXSZVSBWHB-ABAIWWIYSA-N 1 2 301.390 4.051 20 0 DIADLO Cc1cccc2ncc(C[N@@H+]3CC[C@H]3c3ccc(Cl)cc3)n21 ZINC000556927736 1052901538 /nfs/dbraw/zinc/90/15/38/1052901538.db2.gz UVMQDKBYBTYUEK-KRWDZBQOSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1cccc2ncc(C[N@H+]3CC[C@H]3c3ccc(Cl)cc3)n21 ZINC000556927736 1052901544 /nfs/dbraw/zinc/90/15/44/1052901544.db2.gz UVMQDKBYBTYUEK-KRWDZBQOSA-N 1 2 311.816 4.243 20 0 DIADLO CCCOc1c(Cl)cc(C[N@@H+]2CCC[C@@H]2CF)cc1OC ZINC000556950781 1052903954 /nfs/dbraw/zinc/90/39/54/1052903954.db2.gz RBNGZWYTOAHYEP-CYBMUJFWSA-N 1 2 315.816 4.071 20 0 DIADLO CCCOc1c(Cl)cc(C[N@H+]2CCC[C@@H]2CF)cc1OC ZINC000556950781 1052903957 /nfs/dbraw/zinc/90/39/57/1052903957.db2.gz RBNGZWYTOAHYEP-CYBMUJFWSA-N 1 2 315.816 4.071 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1Cc1nc2ccccc2o1 ZINC000556980358 1052908358 /nfs/dbraw/zinc/90/83/58/1052908358.db2.gz DOELSERPUXVZMF-CHWSQXEVSA-N 1 2 310.372 4.475 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1Cc1nc2ccccc2o1 ZINC000556980358 1052908363 /nfs/dbraw/zinc/90/83/63/1052908363.db2.gz DOELSERPUXVZMF-CHWSQXEVSA-N 1 2 310.372 4.475 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1sccc1Cl ZINC000557044821 1052917667 /nfs/dbraw/zinc/91/76/67/1052917667.db2.gz JQZYCMBAMIYSOH-UHFFFAOYSA-N 1 2 317.801 4.352 20 0 DIADLO Cc1cc(C[N@H+](C)CC(=O)Nc2ccccc2Cl)c(C)s1 ZINC000920404512 1052937967 /nfs/dbraw/zinc/93/79/67/1052937967.db2.gz AVTFZTSYBMBKHA-UHFFFAOYSA-N 1 2 322.861 4.089 20 0 DIADLO Cc1cc(C[N@@H+](C)CC(=O)Nc2ccccc2Cl)c(C)s1 ZINC000920404512 1052937970 /nfs/dbraw/zinc/93/79/70/1052937970.db2.gz AVTFZTSYBMBKHA-UHFFFAOYSA-N 1 2 322.861 4.089 20 0 DIADLO CC(C)[C@H]1CCC[N@@H+]1Cn1nc(-c2ccccc2F)oc1=S ZINC000920484505 1052942521 /nfs/dbraw/zinc/94/25/21/1052942521.db2.gz FTKSXGNWGVRFNX-CQSZACIVSA-N 1 2 321.421 4.090 20 0 DIADLO CC(C)[C@H]1CCC[N@H+]1Cn1nc(-c2ccccc2F)oc1=S ZINC000920484505 1052942523 /nfs/dbraw/zinc/94/25/23/1052942523.db2.gz FTKSXGNWGVRFNX-CQSZACIVSA-N 1 2 321.421 4.090 20 0 DIADLO C/C(=C/C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccc(F)cc1 ZINC000921279997 1052969480 /nfs/dbraw/zinc/96/94/80/1052969480.db2.gz BECMYVCCQFWEHL-KAMYIIQDSA-N 1 2 321.355 4.053 20 0 DIADLO Cc1nc(N[C@H](C)C2CCCCC2)c(Br)c(C)[nH+]1 ZINC000322926660 1052976934 /nfs/dbraw/zinc/97/69/34/1052976934.db2.gz YAIPNPYYVFUYMK-SECBINFHSA-N 1 2 312.255 4.237 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccc(Cl)nc1 ZINC000179922499 1053034842 /nfs/dbraw/zinc/03/48/42/1053034842.db2.gz MVQWDAZLRCOPQC-ZDUSSCGKSA-N 1 2 316.836 4.293 20 0 DIADLO CC[C@@H](Oc1cc2c(cc1OC)CC[NH+]=C2)c1ccccc1F ZINC001228092254 1053043562 /nfs/dbraw/zinc/04/35/62/1053043562.db2.gz PKYGLZQHONZEAM-QGZVFWFLSA-N 1 2 313.372 4.339 20 0 DIADLO Cc1[nH]c2ccc(O[C@H]3CC[C@H](OCc4ccccc4)C3)cc2[nH+]1 ZINC001228330296 1053075576 /nfs/dbraw/zinc/07/55/76/1053075576.db2.gz XGTPNPRZOIFPPF-IRXDYDNUSA-N 1 2 322.408 4.388 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@H]1CCCC[C@@H]1C1CC1 ZINC001350618011 1053089340 /nfs/dbraw/zinc/08/93/40/1053089340.db2.gz SPSOTUCQLMQQOA-MSOLQXFVSA-N 1 2 309.413 4.027 20 0 DIADLO COc1ccnc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC001350932905 1053118393 /nfs/dbraw/zinc/11/83/93/1053118393.db2.gz RGNZZJKBGKEKJE-VXGBXAGGSA-N 1 2 319.474 4.256 20 0 DIADLO CC[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001351066397 1053133171 /nfs/dbraw/zinc/13/31/71/1053133171.db2.gz YRLLQNYFKXEXFA-UKRRQHHQSA-N 1 2 315.392 4.166 20 0 DIADLO CC[C@H]1CCCC[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001351066395 1053133253 /nfs/dbraw/zinc/13/32/53/1053133253.db2.gz YRLLQNYFKXEXFA-DZGCQCFKSA-N 1 2 315.392 4.166 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001351066396 1053133327 /nfs/dbraw/zinc/13/33/27/1053133327.db2.gz YRLLQNYFKXEXFA-HIFRSBDPSA-N 1 2 315.392 4.166 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+]1CCO[C@](C)(C2CC2)C1 ZINC001559992796 1053141570 /nfs/dbraw/zinc/14/15/70/1053141570.db2.gz ILEGDELGNKCFJD-WBMJQRKESA-N 1 2 324.262 4.011 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+]1CCO[C@](C)(C2CC2)C1 ZINC001559992796 1053141575 /nfs/dbraw/zinc/14/15/75/1053141575.db2.gz ILEGDELGNKCFJD-WBMJQRKESA-N 1 2 324.262 4.011 20 0 DIADLO CCC[C@@H](Cc1ccccc1)NC(=O)c1c(C)cc(C)[nH+]c1C ZINC001359849762 1053156359 /nfs/dbraw/zinc/15/63/59/1053156359.db2.gz WKHZDGCTHNPNPJ-SFHVURJKSA-N 1 2 310.441 4.148 20 0 DIADLO CC(C)OC(=O)C[N@H+]([C@@H](C)c1ccc2ccccc2c1)C1CC1 ZINC001318295656 1053161097 /nfs/dbraw/zinc/16/10/97/1053161097.db2.gz ZFDFCALTLQNNNO-HNNXBMFYSA-N 1 2 311.425 4.317 20 0 DIADLO CC(C)OC(=O)C[N@@H+]([C@@H](C)c1ccc2ccccc2c1)C1CC1 ZINC001318295656 1053161103 /nfs/dbraw/zinc/16/11/03/1053161103.db2.gz ZFDFCALTLQNNNO-HNNXBMFYSA-N 1 2 311.425 4.317 20 0 DIADLO CCc1ccc(-c2nc(=S)n(C[N@H+]3CCC[C@H]3CC)[nH]2)cc1 ZINC001318396656 1053167492 /nfs/dbraw/zinc/16/74/92/1053167492.db2.gz VGROQPPTSNTCHH-OAHLLOKOSA-N 1 2 316.474 4.002 20 0 DIADLO CCc1ccc(-c2nc(=S)n(C[N@@H+]3CCC[C@H]3CC)[nH]2)cc1 ZINC001318396656 1053167498 /nfs/dbraw/zinc/16/74/98/1053167498.db2.gz VGROQPPTSNTCHH-OAHLLOKOSA-N 1 2 316.474 4.002 20 0 DIADLO CCCCn1c(SC[C@H](C)CC)nnc1[C@@H](CC)[NH+](C)C ZINC000088484590 1053189397 /nfs/dbraw/zinc/18/93/97/1053189397.db2.gz PZGWZJCDMWMSMP-ZIAGYGMSSA-N 1 2 312.527 4.229 20 0 DIADLO Cc1cc(C)c(NC(=O)CC[C@@H]2CCc3ccccc32)c(C)[nH+]1 ZINC001351555146 1053194311 /nfs/dbraw/zinc/19/43/11/1053194311.db2.gz OPAVOGVWZHPTKW-KRWDZBQOSA-N 1 2 308.425 4.456 20 0 DIADLO COc1ccc2c(c1)OCC[C@H]2Nc1cc(C)c2ccccc2[nH+]1 ZINC001318849041 1053199035 /nfs/dbraw/zinc/19/90/35/1053199035.db2.gz XMWRVPQNCOGCAK-GOSISDBHSA-N 1 2 320.392 4.488 20 0 DIADLO C/C(=C/c1ccccc1Cl)C(=O)Nc1cccc2[nH+]ccn21 ZINC001360440993 1053227787 /nfs/dbraw/zinc/22/77/87/1053227787.db2.gz AFCMQBFDCXHNJV-QXMHVHEDSA-N 1 2 311.772 4.030 20 0 DIADLO CCc1nn(C)c(CC)c1CNc1cc(C)c2ccccc2[nH+]1 ZINC001319573035 1053252684 /nfs/dbraw/zinc/25/26/84/1053252684.db2.gz QUNVZBMFMBCPIR-UHFFFAOYSA-N 1 2 308.429 4.014 20 0 DIADLO C[S@](=O)c1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccccc2)cc1 ZINC001319706128 1053263406 /nfs/dbraw/zinc/26/34/06/1053263406.db2.gz VTCAIVKJDQPJHM-AVRDEDQJSA-N 1 2 313.466 4.007 20 0 DIADLO C[S@](=O)c1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2ccccc2)cc1 ZINC001319706128 1053263415 /nfs/dbraw/zinc/26/34/15/1053263415.db2.gz VTCAIVKJDQPJHM-AVRDEDQJSA-N 1 2 313.466 4.007 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2cccnc2Cl)c1C ZINC001319858876 1053280990 /nfs/dbraw/zinc/28/09/90/1053280990.db2.gz MZDNKGUVZHWEKP-UHFFFAOYSA-N 1 2 308.834 4.189 20 0 DIADLO CCCCn1cc(CNc2cc(C)c3ccccc3[nH+]2)c(C)n1 ZINC001319894220 1053285025 /nfs/dbraw/zinc/28/50/25/1053285025.db2.gz PMJIPZFJGPDLNS-UHFFFAOYSA-N 1 2 308.429 4.460 20 0 DIADLO COc1ccc(CNc2cc(C)c(Br)c(C)[nH+]2)cc1 ZINC001319964635 1053288209 /nfs/dbraw/zinc/28/82/09/1053288209.db2.gz MZNVRFDQQDLELX-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+](Cc1cnc(Cl)c(C)c1)CC2 ZINC001319946637 1053288786 /nfs/dbraw/zinc/28/87/86/1053288786.db2.gz ASLFEDJTXHWNRD-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+](Cc1cnc(Cl)c(C)c1)CC2 ZINC001319946637 1053288793 /nfs/dbraw/zinc/28/87/93/1053288793.db2.gz ASLFEDJTXHWNRD-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CC(C)c1ocnc1C[N@H+]1CC=C(c2ccc(Cl)nc2)CC1 ZINC001320021947 1053296501 /nfs/dbraw/zinc/29/65/01/1053296501.db2.gz DYYAYJPIWLVRBT-UHFFFAOYSA-N 1 2 317.820 4.136 20 0 DIADLO CC(C)c1ocnc1C[N@@H+]1CC=C(c2ccc(Cl)nc2)CC1 ZINC001320021947 1053296511 /nfs/dbraw/zinc/29/65/11/1053296511.db2.gz DYYAYJPIWLVRBT-UHFFFAOYSA-N 1 2 317.820 4.136 20 0 DIADLO CC(C)c1nc(CNc2[nH+]c3cc(Cl)ccc3n2C)cs1 ZINC001320281138 1053321448 /nfs/dbraw/zinc/32/14/48/1053321448.db2.gz FPLIONVCHBOQJG-UHFFFAOYSA-N 1 2 320.849 4.419 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1Cc1cn(C)nc1C(F)F ZINC001320464715 1053334851 /nfs/dbraw/zinc/33/48/51/1053334851.db2.gz YUQOXLHHNZWBOH-GHMZBOCLSA-N 1 2 323.362 4.005 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1Cc1cn(C)nc1C(F)F ZINC001320464715 1053334867 /nfs/dbraw/zinc/33/48/67/1053334867.db2.gz YUQOXLHHNZWBOH-GHMZBOCLSA-N 1 2 323.362 4.005 20 0 DIADLO Cc1nc(CNc2[nH+]c3ccccc3n2C(C)(C)C)cs1 ZINC001320586947 1053348256 /nfs/dbraw/zinc/34/82/56/1053348256.db2.gz MVGPKCCHIASKGS-UHFFFAOYSA-N 1 2 300.431 4.168 20 0 DIADLO Cn1c2ccccc2[nH+]c1N[C@H]1CCSc2ccc(F)cc21 ZINC001320629456 1053349696 /nfs/dbraw/zinc/34/96/96/1053349696.db2.gz WWIIHRPQUQVNJB-ZDUSSCGKSA-N 1 2 313.401 4.361 20 0 DIADLO Cc1cccc(C2=CC[N@H+]([C@@H](C)c3nc(C(C)C)no3)CC2)c1 ZINC000092822194 1053350209 /nfs/dbraw/zinc/35/02/09/1053350209.db2.gz SPLNEUFLDUBKDX-HNNXBMFYSA-N 1 2 311.429 4.352 20 0 DIADLO Cc1cccc(C2=CC[N@@H+]([C@@H](C)c3nc(C(C)C)no3)CC2)c1 ZINC000092822194 1053350225 /nfs/dbraw/zinc/35/02/25/1053350225.db2.gz SPLNEUFLDUBKDX-HNNXBMFYSA-N 1 2 311.429 4.352 20 0 DIADLO COc1ccc2c(c1)CCC[C@H]2[N@H+](C)C/C(Cl)=C/Cl ZINC000763511632 1053403007 /nfs/dbraw/zinc/40/30/07/1053403007.db2.gz PZLYSVPXTQNSRY-HMVFGEFZSA-N 1 2 300.229 4.323 20 0 DIADLO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)C/C(Cl)=C/Cl ZINC000763511632 1053403013 /nfs/dbraw/zinc/40/30/13/1053403013.db2.gz PZLYSVPXTQNSRY-HMVFGEFZSA-N 1 2 300.229 4.323 20 0 DIADLO CCc1cc(NC(=S)Nc2cccc3ccccc32)cc[nH+]1 ZINC001200094845 1053375002 /nfs/dbraw/zinc/37/50/02/1053375002.db2.gz KHUKPSBZDDILLF-UHFFFAOYSA-N 1 2 307.422 4.028 20 0 DIADLO Cc1cc(CNc2[nH+]c3ccccc3n2C(C)(C)C)sn1 ZINC001321009506 1053381612 /nfs/dbraw/zinc/38/16/12/1053381612.db2.gz FMWAZFIRHJDSBZ-UHFFFAOYSA-N 1 2 300.431 4.168 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2ncoc2C(C)C)C1 ZINC001321701205 1053428219 /nfs/dbraw/zinc/42/82/19/1053428219.db2.gz MZRAGQMSLJVKFZ-SFHVURJKSA-N 1 2 302.393 4.177 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2ncoc2C(C)C)C1 ZINC001321701205 1053428230 /nfs/dbraw/zinc/42/82/30/1053428230.db2.gz MZRAGQMSLJVKFZ-SFHVURJKSA-N 1 2 302.393 4.177 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2ncoc2C(C)C)C1 ZINC001321701204 1053428693 /nfs/dbraw/zinc/42/86/93/1053428693.db2.gz MZRAGQMSLJVKFZ-GOSISDBHSA-N 1 2 302.393 4.177 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2ncoc2C(C)C)C1 ZINC001321701204 1053428698 /nfs/dbraw/zinc/42/86/98/1053428698.db2.gz MZRAGQMSLJVKFZ-GOSISDBHSA-N 1 2 302.393 4.177 20 0 DIADLO C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H](c1ccccc1)C(F)F ZINC001474761590 1053430876 /nfs/dbraw/zinc/43/08/76/1053430876.db2.gz BEZRQQNMTHJETO-DYVFJYSZSA-N 1 2 305.368 4.309 20 0 DIADLO Cc1cc(C)c(/C=C/C[NH+]2CC(Oc3ccccc3)C2)c(C)c1 ZINC001474762668 1053432910 /nfs/dbraw/zinc/43/29/10/1053432910.db2.gz UHHHUESCHXRNEB-JXMROGBWSA-N 1 2 307.437 4.388 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2nc(C(F)(F)F)cs2)c1C ZINC000093814654 1053456169 /nfs/dbraw/zinc/45/61/69/1053456169.db2.gz ZWDDMQKZKJSYPJ-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2nc(C(F)(F)F)cs2)c1C ZINC000093814654 1053456178 /nfs/dbraw/zinc/45/61/78/1053456178.db2.gz ZWDDMQKZKJSYPJ-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO C[NH+](C)c1ccc(N[C@H]2CCCOc3ccc(F)cc32)cc1 ZINC000182491731 1053457825 /nfs/dbraw/zinc/45/78/25/1053457825.db2.gz JNPWEPHLISQTPZ-KRWDZBQOSA-N 1 2 300.377 4.218 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCc1ccccc1-n1cccn1 ZINC000324781334 1053464317 /nfs/dbraw/zinc/46/43/17/1053464317.db2.gz HZOQJAGBXJWQQM-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO Clc1ccc([C@H]2C[N@@H+]([C@H]3CCc4ccccc43)CCO2)s1 ZINC001322173730 1053466374 /nfs/dbraw/zinc/46/63/74/1053466374.db2.gz BNCVKRJHSVZGSZ-LSDHHAIUSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc([C@H]2C[N@H+]([C@H]3CCc4ccccc43)CCO2)s1 ZINC001322173730 1053466381 /nfs/dbraw/zinc/46/63/81/1053466381.db2.gz BNCVKRJHSVZGSZ-LSDHHAIUSA-N 1 2 319.857 4.462 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+]2CCc3oc(-c4ccccc4)cc3C2)cn1 ZINC000649676842 1053516208 /nfs/dbraw/zinc/51/62/08/1053516208.db2.gz XQRURWUHVBVMID-OAHLLOKOSA-N 1 2 319.408 4.164 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+]2CCc3oc(-c4ccccc4)cc3C2)cn1 ZINC000649676842 1053516217 /nfs/dbraw/zinc/51/62/17/1053516217.db2.gz XQRURWUHVBVMID-OAHLLOKOSA-N 1 2 319.408 4.164 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccc(F)cc1F ZINC000152714885 1053518394 /nfs/dbraw/zinc/51/83/94/1053518394.db2.gz AMGGZQRSUUXQPI-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO Cc1cc(N[C@@H](C)c2nc3ccccc3n2C)ccc1[NH+](C)C ZINC000182848925 1053531369 /nfs/dbraw/zinc/53/13/69/1053531369.db2.gz GGUQEKJWLRXHMM-AWEZNQCLSA-N 1 2 308.429 4.121 20 0 DIADLO CC(C)Oc1ccc[nH+]c1N[C@H]1CCC[C@@H](c2cccnc2)C1 ZINC001322653035 1053532938 /nfs/dbraw/zinc/53/29/38/1053532938.db2.gz SRUBTURERBHFGD-WBVHZDCISA-N 1 2 311.429 4.402 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccc([N+](=O)[O-])cc1 ZINC000182955658 1053560804 /nfs/dbraw/zinc/56/08/04/1053560804.db2.gz HXUSDTWAHACQCF-CYBMUJFWSA-N 1 2 311.385 4.150 20 0 DIADLO C[C@@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccc([N+](=O)[O-])cc1 ZINC000182955658 1053560816 /nfs/dbraw/zinc/56/08/16/1053560816.db2.gz HXUSDTWAHACQCF-CYBMUJFWSA-N 1 2 311.385 4.150 20 0 DIADLO Cc1nc(C)c([C@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)s1 ZINC000182954057 1053562675 /nfs/dbraw/zinc/56/26/75/1053562675.db2.gz HSCOFSKIYQTDRV-LBPRGKRZSA-N 1 2 301.459 4.315 20 0 DIADLO Cc1nc(C)c([C@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)s1 ZINC000182954057 1053562685 /nfs/dbraw/zinc/56/26/85/1053562685.db2.gz HSCOFSKIYQTDRV-LBPRGKRZSA-N 1 2 301.459 4.315 20 0 DIADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1ncoc1C(C)C ZINC001323425130 1053579652 /nfs/dbraw/zinc/57/96/52/1053579652.db2.gz GBFMQIYAMAYHEE-AWEZNQCLSA-N 1 2 302.418 4.436 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2cn(C)cn2)c2cccc(F)c2)cc1 ZINC001323441565 1053582735 /nfs/dbraw/zinc/58/27/35/1053582735.db2.gz FCFIPGQBDNZKAV-HXUWFJFHSA-N 1 2 323.415 4.001 20 0 DIADLO CC(C)Cc1ccc(CCC(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC001353494330 1053590470 /nfs/dbraw/zinc/59/04/70/1053590470.db2.gz IKSAHYHYNPYQBC-UHFFFAOYSA-N 1 2 321.424 4.104 20 0 DIADLO FC1(F)CCC[C@@H]1[NH2+]Cc1c[nH]nc1-c1ccc(Cl)cc1 ZINC001323676584 1053594782 /nfs/dbraw/zinc/59/47/82/1053594782.db2.gz GZBATQBUYVQOOF-ZDUSSCGKSA-N 1 2 311.763 4.008 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@@H](CC)c2ccc(F)cc2)n1 ZINC001323731981 1053597201 /nfs/dbraw/zinc/59/72/01/1053597201.db2.gz YYKSMEHCJKZREL-RISCZKNCSA-N 1 2 323.437 4.264 20 0 DIADLO COc1ccc(C[NH2+][C@H](c2ccco2)c2ccccc2)c(F)c1 ZINC000404601978 1053614897 /nfs/dbraw/zinc/61/48/97/1053614897.db2.gz YEAUBHWFDBIIJN-IBGZPJMESA-N 1 2 311.356 4.307 20 0 DIADLO CCS[C@H]1CCCC[N@H+](Cc2nc(C(F)(F)F)cs2)C1 ZINC000153506011 1053624029 /nfs/dbraw/zinc/62/40/29/1053624029.db2.gz HLXSSNZEYKJNAI-JTQLQIEISA-N 1 2 324.437 4.270 20 0 DIADLO CCS[C@H]1CCCC[N@@H+](Cc2nc(C(F)(F)F)cs2)C1 ZINC000153506011 1053624032 /nfs/dbraw/zinc/62/40/32/1053624032.db2.gz HLXSSNZEYKJNAI-JTQLQIEISA-N 1 2 324.437 4.270 20 0 DIADLO CC[C@@H](Oc1cc2c(cc1O)C=[NH+]CC2)c1cccc(F)c1C ZINC001230920228 1053625175 /nfs/dbraw/zinc/62/51/75/1053625175.db2.gz KGLNDSVBUHTNDO-GOSISDBHSA-N 1 2 313.372 4.345 20 0 DIADLO Cc1cc(NC(=O)[C@H](C)n2cc[nH+]c2)ccc1-c1ccccc1 ZINC001324127749 1053628049 /nfs/dbraw/zinc/62/80/49/1053628049.db2.gz HCBXARSEQMXHRM-HNNXBMFYSA-N 1 2 305.381 4.058 20 0 DIADLO Cc1ccc(NC(=O)C[C@@H]2CCCCC2(C)C)c(N(C)C)[nH+]1 ZINC001435645449 1053628718 /nfs/dbraw/zinc/62/87/18/1053628718.db2.gz RJHAKWJFLOGNQN-AWEZNQCLSA-N 1 2 303.450 4.001 20 0 DIADLO CCCn1c[nH+]cc1CNc1cccc(Cl)c1OC(C)C ZINC001200401645 1053634804 /nfs/dbraw/zinc/63/48/04/1053634804.db2.gz UKYQWBJRTGCLPO-UHFFFAOYSA-N 1 2 307.825 4.346 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2cccc(Cl)c2F)s1 ZINC001324326724 1053644019 /nfs/dbraw/zinc/64/40/19/1053644019.db2.gz ZGYUHKQKRVLQHQ-UHFFFAOYSA-N 1 2 316.854 4.088 20 0 DIADLO FC(F)c1cccc(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)c1 ZINC001324333389 1053644264 /nfs/dbraw/zinc/64/42/64/1053644264.db2.gz ABYRPTJVNFIDST-INIZCTEOSA-N 1 2 313.351 4.227 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H]2C[C@@H](C)Oc3ccccc32)cs1 ZINC001324379811 1053648669 /nfs/dbraw/zinc/64/86/69/1053648669.db2.gz YFHKWIBIJPEIQM-IUODEOHRSA-N 1 2 302.443 4.268 20 0 DIADLO Cc1ccc(N[C@H](C)c2nc(Br)cs2)c(C)[nH+]1 ZINC001324601947 1053665356 /nfs/dbraw/zinc/66/53/56/1053665356.db2.gz PKDULGZNFQWBMA-SECBINFHSA-N 1 2 312.236 4.091 20 0 DIADLO Cc1ccccc1OC[C@@H](C)Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231083938 1053670937 /nfs/dbraw/zinc/67/09/37/1053670937.db2.gz QDBDLAQKJONKJV-MRXNPFEDSA-N 1 2 322.408 4.242 20 0 DIADLO COc1ccc([C@@H](C)Oc2ccc(-c3[nH]cc[nH+]3)cc2)cc1OC ZINC001231082500 1053670984 /nfs/dbraw/zinc/67/09/84/1053670984.db2.gz WOSXHPUIPVDFPO-CYBMUJFWSA-N 1 2 324.380 4.234 20 0 DIADLO Cc1cnc(F)c([C@H](C)Oc2ccc(-c3c[nH+]cn3C)cc2)c1 ZINC001231084067 1053671122 /nfs/dbraw/zinc/67/11/22/1053671122.db2.gz VVPBKKPNTCBHCS-ZDUSSCGKSA-N 1 2 311.360 4.070 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(O[C@H]2CCc3ccccc3C2)cc1 ZINC001231083245 1053671177 /nfs/dbraw/zinc/67/11/77/1053671177.db2.gz GKMZVPPILBUFQZ-IBGZPJMESA-N 1 2 304.393 4.023 20 0 DIADLO C[C@H](Oc1ccc(-c2c[nH+]cn2C)cc1)c1cccc(N(C)C)c1 ZINC001231083676 1053672199 /nfs/dbraw/zinc/67/21/99/1053672199.db2.gz NEFNLOUZJWFQCC-HNNXBMFYSA-N 1 2 321.424 4.293 20 0 DIADLO C[C@@H](Oc1ccc(-c2c[nH+]cn2C)cc1)c1cccnc1Cl ZINC001231082163 1053672242 /nfs/dbraw/zinc/67/22/42/1053672242.db2.gz NTDWSBAHOTUPDV-GFCCVEGCSA-N 1 2 313.788 4.276 20 0 DIADLO C[C@H]([NH2+]Cc1nc2ccccc2o1)c1ccc(Cl)c(F)c1 ZINC001324891412 1053687593 /nfs/dbraw/zinc/68/75/93/1053687593.db2.gz PLDIZCOKFZXKPF-JTQLQIEISA-N 1 2 304.752 4.471 20 0 DIADLO CC[C@@H](C)NC(=S)Nc1ccc(Oc2cc[nH+]c(C)c2)cc1 ZINC001200491288 1053700953 /nfs/dbraw/zinc/70/09/53/1053700953.db2.gz XVBVIOMICDIFJT-GFCCVEGCSA-N 1 2 315.442 4.267 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCc3c4ccccc4[nH]c3C2)c(F)c1 ZINC001325159555 1053701996 /nfs/dbraw/zinc/70/19/96/1053701996.db2.gz UCKPOBCNVZBKTK-UHFFFAOYSA-N 1 2 312.363 4.047 20 0 DIADLO Fc1ccc(CC[N@H+]2CCc3c4ccccc4[nH]c3C2)c(F)c1 ZINC001325159555 1053702007 /nfs/dbraw/zinc/70/20/07/1053702007.db2.gz UCKPOBCNVZBKTK-UHFFFAOYSA-N 1 2 312.363 4.047 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)c2cc3ccccc3o2)c(C)[nH+]1 ZINC001435901004 1053716941 /nfs/dbraw/zinc/71/69/41/1053716941.db2.gz XBJLTTFMTZNCOP-CYBMUJFWSA-N 1 2 308.381 4.244 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2ccc3ncccc3c2)c1 ZINC001325653850 1053725285 /nfs/dbraw/zinc/72/52/85/1053725285.db2.gz DVWCDRUSHHNJKT-UHFFFAOYSA-N 1 2 310.422 4.380 20 0 DIADLO C[C@@H]1C[N@H+](CCCCC(F)(F)F)C[C@H](c2ccc(F)cc2)O1 ZINC000154298526 1053733812 /nfs/dbraw/zinc/73/38/12/1053733812.db2.gz AUWQKEBIFCJZMF-IUODEOHRSA-N 1 2 319.342 4.320 20 0 DIADLO C[C@@H]1C[N@@H+](CCCCC(F)(F)F)C[C@H](c2ccc(F)cc2)O1 ZINC000154298526 1053733829 /nfs/dbraw/zinc/73/38/29/1053733829.db2.gz AUWQKEBIFCJZMF-IUODEOHRSA-N 1 2 319.342 4.320 20 0 DIADLO C[C@@H]1CC[C@@H](CO)C[N@@H+]1Cc1c(Cl)ccc(Cl)c1Cl ZINC001231479403 1053760594 /nfs/dbraw/zinc/76/05/94/1053760594.db2.gz KKUDNDSNIMDWJO-NXEZZACHSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[C@@H](CO)C[N@H+]1Cc1c(Cl)ccc(Cl)c1Cl ZINC001231479403 1053760599 /nfs/dbraw/zinc/76/05/99/1053760599.db2.gz KKUDNDSNIMDWJO-NXEZZACHSA-N 1 2 322.663 4.240 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+](C)Cc1ccc(C)c(C)c1 ZINC001231414615 1053745590 /nfs/dbraw/zinc/74/55/90/1053745590.db2.gz ADMODYYLDZJVDC-UHFFFAOYSA-N 1 2 305.368 4.222 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+](C)Cc1ccc(C)c(C)c1 ZINC001231414615 1053745598 /nfs/dbraw/zinc/74/55/98/1053745598.db2.gz ADMODYYLDZJVDC-UHFFFAOYSA-N 1 2 305.368 4.222 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+]1CCC[C@H]1c1ccc(C)nc1 ZINC001231414129 1053746930 /nfs/dbraw/zinc/74/69/30/1053746930.db2.gz GMWPTVOMFRJZMZ-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+]1CCC[C@H]1c1ccc(C)nc1 ZINC001231414129 1053746940 /nfs/dbraw/zinc/74/69/40/1053746940.db2.gz GMWPTVOMFRJZMZ-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc2ccccc2n1C ZINC000154799754 1053750028 /nfs/dbraw/zinc/75/00/28/1053750028.db2.gz QVHRUSKXXKLYCG-GFCCVEGCSA-N 1 2 315.367 4.045 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc2ccccc2n1C ZINC000154799754 1053750037 /nfs/dbraw/zinc/75/00/37/1053750037.db2.gz QVHRUSKXXKLYCG-GFCCVEGCSA-N 1 2 315.367 4.045 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc2ccccc2n1C ZINC000154799649 1053750992 /nfs/dbraw/zinc/75/09/92/1053750992.db2.gz QVHRUSKXXKLYCG-LBPRGKRZSA-N 1 2 315.367 4.045 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc2ccccc2n1C ZINC000154799649 1053751005 /nfs/dbraw/zinc/75/10/05/1053751005.db2.gz QVHRUSKXXKLYCG-LBPRGKRZSA-N 1 2 315.367 4.045 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@H]3C[C@H]32)ccc1Br ZINC001231437521 1053752556 /nfs/dbraw/zinc/75/25/56/1053752556.db2.gz ZELWQYXQFKAWDR-GXFFZTMASA-N 1 2 300.627 4.087 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@H]3C[C@H]32)ccc1Br ZINC001231437521 1053752565 /nfs/dbraw/zinc/75/25/65/1053752565.db2.gz ZELWQYXQFKAWDR-GXFFZTMASA-N 1 2 300.627 4.087 20 0 DIADLO CC[N@H+](Cc1nnc(-c2ccccc2)s1)Cc1ccccc1 ZINC000155069404 1053759395 /nfs/dbraw/zinc/75/93/95/1053759395.db2.gz ZWDIBQDVVARUQG-UHFFFAOYSA-N 1 2 309.438 4.227 20 0 DIADLO CC[N@@H+](Cc1nnc(-c2ccccc2)s1)Cc1ccccc1 ZINC000155069404 1053759401 /nfs/dbraw/zinc/75/94/01/1053759401.db2.gz ZWDIBQDVVARUQG-UHFFFAOYSA-N 1 2 309.438 4.227 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccc4sccc4c3)ccn12 ZINC001354086679 1053759990 /nfs/dbraw/zinc/75/99/90/1053759990.db2.gz PVVJILRDDHDINT-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO O=C(/C=C/C1CCCCCC1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001354097909 1053762782 /nfs/dbraw/zinc/76/27/82/1053762782.db2.gz UWEQAWZJNXIFDM-ZHACJKMWSA-N 1 2 309.413 4.337 20 0 DIADLO C[N@H+](Cc1ccc(/C=C/c2ccccc2)cc1)Cc1ncccn1 ZINC001231486951 1053766991 /nfs/dbraw/zinc/76/69/91/1053766991.db2.gz SDHRIBMEPMEVEV-CMDGGOBGSA-N 1 2 315.420 4.279 20 0 DIADLO C[N@@H+](Cc1ccc(/C=C/c2ccccc2)cc1)Cc1ncccn1 ZINC001231486951 1053767002 /nfs/dbraw/zinc/76/70/02/1053767002.db2.gz SDHRIBMEPMEVEV-CMDGGOBGSA-N 1 2 315.420 4.279 20 0 DIADLO Cc1c(C)c(C)c(C[N@@H+]2CCOC[C@H]2c2cccnc2)c(C)c1C ZINC001231493810 1053768906 /nfs/dbraw/zinc/76/89/06/1053768906.db2.gz DYFONVFQEFOPDB-NRFANRHFSA-N 1 2 324.468 4.197 20 0 DIADLO Cc1c(C)c(C)c(C[N@H+]2CCOC[C@H]2c2cccnc2)c(C)c1C ZINC001231493810 1053768921 /nfs/dbraw/zinc/76/89/21/1053768921.db2.gz DYFONVFQEFOPDB-NRFANRHFSA-N 1 2 324.468 4.197 20 0 DIADLO CSc1cccc(C[NH2+][C@@H](c2nc(C3CC3)no2)C(C)C)c1 ZINC000660207227 1053771775 /nfs/dbraw/zinc/77/17/75/1053771775.db2.gz BGEPZLHIGLLXTJ-OAHLLOKOSA-N 1 2 317.458 4.156 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+](Cc1cccc(O)c1Cl)CC2 ZINC001326326624 1053774869 /nfs/dbraw/zinc/77/48/69/1053774869.db2.gz BITRXGCYVQLAPX-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+](Cc1cccc(O)c1Cl)CC2 ZINC001326326624 1053774880 /nfs/dbraw/zinc/77/48/80/1053774880.db2.gz BITRXGCYVQLAPX-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO Oc1ccc(C[N@H+]2CC[C@H]2c2ccccc2)cc1C(F)(F)F ZINC001231522802 1053777606 /nfs/dbraw/zinc/77/76/06/1053777606.db2.gz KVVIQUNHCCXGSI-HNNXBMFYSA-N 1 2 307.315 4.358 20 0 DIADLO Fc1ccc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)cc1Oc1ccccc1 ZINC001231535993 1053780960 /nfs/dbraw/zinc/78/09/60/1053780960.db2.gz BVULCIFJEPHCEO-ZVZYQTTQSA-N 1 2 315.363 4.408 20 0 DIADLO Fc1ccc(C[N@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)cc1Oc1ccccc1 ZINC001231535993 1053780971 /nfs/dbraw/zinc/78/09/71/1053780971.db2.gz BVULCIFJEPHCEO-ZVZYQTTQSA-N 1 2 315.363 4.408 20 0 DIADLO C[N@H+](Cc1cc(F)cc(F)c1)Cc1cc(Cl)nc(Cl)c1 ZINC001326466015 1053782576 /nfs/dbraw/zinc/78/25/76/1053782576.db2.gz NQHWMGLIKWJTJM-UHFFFAOYSA-N 1 2 317.166 4.299 20 0 DIADLO C[N@@H+](Cc1cc(F)cc(F)c1)Cc1cc(Cl)nc(Cl)c1 ZINC001326466015 1053782588 /nfs/dbraw/zinc/78/25/88/1053782588.db2.gz NQHWMGLIKWJTJM-UHFFFAOYSA-N 1 2 317.166 4.299 20 0 DIADLO Clc1ccc(C[NH+]2CC3(C2)CCCC3)cc1Br ZINC001231566893 1053784182 /nfs/dbraw/zinc/78/41/82/1053784182.db2.gz JWQHBQYSNXTFGJ-UHFFFAOYSA-N 1 2 314.654 4.479 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)CCC[Si](C)(C)C ZINC000848021533 1053796417 /nfs/dbraw/zinc/79/64/17/1053796417.db2.gz XPZLRLQEFDBSAU-UHFFFAOYSA-N 1 2 315.493 4.442 20 0 DIADLO C[C@@H](CC(=O)Nc1cccc(-c2ccccc2)c1)n1cc[nH+]c1 ZINC001436165321 1053798645 /nfs/dbraw/zinc/79/86/45/1053798645.db2.gz MONVWEKCYGQKPS-HNNXBMFYSA-N 1 2 305.381 4.140 20 0 DIADLO O=C(Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1ccccc1 ZINC001436227812 1053816936 /nfs/dbraw/zinc/81/69/36/1053816936.db2.gz NHIQGYUTOIHZBC-UHFFFAOYSA-N 1 2 318.376 4.106 20 0 DIADLO C[C@H]([NH2+]Cc1csc(N(C)C2CC2)n1)c1ccccc1Cl ZINC000156579394 1053817716 /nfs/dbraw/zinc/81/77/16/1053817716.db2.gz OTRVZDADIVJTHZ-NSHDSACASA-N 1 2 321.877 4.246 20 0 DIADLO C/C=C(\CC)C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001436226678 1053817898 /nfs/dbraw/zinc/81/78/98/1053817898.db2.gz ICTHKWAMODAPSE-LZWSPWQCSA-N 1 2 310.397 4.148 20 0 DIADLO Cn1c[nH+]cc1CCCSC1=Nc2ccccc2CS1 ZINC001327148444 1053837475 /nfs/dbraw/zinc/83/74/75/1053837475.db2.gz MRPFWRIFPFEJHC-UHFFFAOYSA-N 1 2 303.456 4.020 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)s1 ZINC000273255284 1053844187 /nfs/dbraw/zinc/84/41/87/1053844187.db2.gz YUJYLWHJXQUGJV-MRVPVSSYSA-N 1 2 316.257 4.258 20 0 DIADLO CCOc1ncccc1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001231764702 1053853439 /nfs/dbraw/zinc/85/34/39/1053853439.db2.gz IKBKECNLMOHDJE-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ncccc1C[N@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001231764702 1053853457 /nfs/dbraw/zinc/85/34/57/1053853457.db2.gz IKBKECNLMOHDJE-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2sc(C(C)(C)C)nc2C)s1 ZINC000274263697 1053862126 /nfs/dbraw/zinc/86/21/26/1053862126.db2.gz VIFVHOMLIGYRMU-PSASIEDQSA-N 1 2 324.519 4.321 20 0 DIADLO F[C@@H]1CCC[N@H+](Cc2cc(Cl)ncc2C(F)(F)F)CC1 ZINC001231930541 1053919961 /nfs/dbraw/zinc/91/99/61/1053919961.db2.gz PPYJLRFXJWQTTK-SNVBAGLBSA-N 1 2 310.722 4.078 20 0 DIADLO F[C@@H]1CCC[N@@H+](Cc2cc(Cl)ncc2C(F)(F)F)CC1 ZINC001231930541 1053919976 /nfs/dbraw/zinc/91/99/76/1053919976.db2.gz PPYJLRFXJWQTTK-SNVBAGLBSA-N 1 2 310.722 4.078 20 0 DIADLO Fc1cccc(Oc2ccccc2)c1C[NH+]1CCSCC1 ZINC001231865359 1053894690 /nfs/dbraw/zinc/89/46/90/1053894690.db2.gz YIJKXNHXLRFCHI-UHFFFAOYSA-N 1 2 303.402 4.167 20 0 DIADLO C[C@]1(F)CCC[N@H+](Cc2ccc(OC3CCCCC3)nc2)C1 ZINC001231873656 1053897166 /nfs/dbraw/zinc/89/71/66/1053897166.db2.gz NIKVTWVMJSKXHN-SFHVURJKSA-N 1 2 306.425 4.117 20 0 DIADLO C[C@]1(F)CCC[N@@H+](Cc2ccc(OC3CCCCC3)nc2)C1 ZINC001231873656 1053897178 /nfs/dbraw/zinc/89/71/78/1053897178.db2.gz NIKVTWVMJSKXHN-SFHVURJKSA-N 1 2 306.425 4.117 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@H]1CC[C@H](C2CCC2)CC1 ZINC001354541981 1053901296 /nfs/dbraw/zinc/90/12/96/1053901296.db2.gz NVOKOHZZQZDOKK-QAQDUYKDSA-N 1 2 323.440 4.417 20 0 DIADLO FC(F)c1cc(C[N@@H+]2CCCC[C@H]2c2cccnc2)ccn1 ZINC001231887969 1053904367 /nfs/dbraw/zinc/90/43/67/1053904367.db2.gz ANKMXZNRFYRWEV-INIZCTEOSA-N 1 2 303.356 4.141 20 0 DIADLO FC(F)c1cc(C[N@H+]2CCCC[C@H]2c2cccnc2)ccn1 ZINC001231887969 1053904380 /nfs/dbraw/zinc/90/43/80/1053904380.db2.gz ANKMXZNRFYRWEV-INIZCTEOSA-N 1 2 303.356 4.141 20 0 DIADLO Cc1nc2ccccn2c1C[N@@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000158528763 1053905749 /nfs/dbraw/zinc/90/57/49/1053905749.db2.gz CMBSURWQOCTAQM-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1nc2ccccn2c1C[N@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000158528763 1053905763 /nfs/dbraw/zinc/90/57/63/1053905763.db2.gz CMBSURWQOCTAQM-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Fc1ccc(C[NH+]2CCC(Nc3ccccc3)CC2)c(F)c1F ZINC001328186969 1053914475 /nfs/dbraw/zinc/91/44/75/1053914475.db2.gz ZOYOQKAHYICCDT-UHFFFAOYSA-N 1 2 320.358 4.180 20 0 DIADLO CCc1ccc(C2=CCN(c3cc(CC)[nH+]c(CC)n3)CC2)cc1 ZINC001472745709 1053917001 /nfs/dbraw/zinc/91/70/01/1053917001.db2.gz YLZXGODWKPCFFL-UHFFFAOYSA-N 1 2 321.468 4.458 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ncccc2C(F)(F)F)cn1 ZINC001231963876 1053923839 /nfs/dbraw/zinc/92/38/39/1053923839.db2.gz JXJZVDJCVRFTGE-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2ncccc2C(F)(F)F)cn1 ZINC001231963876 1053923847 /nfs/dbraw/zinc/92/38/47/1053923847.db2.gz JXJZVDJCVRFTGE-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1ccc2ccnc(Cl)c2c1 ZINC001231979074 1053925700 /nfs/dbraw/zinc/92/57/00/1053925700.db2.gz PPBMCCKNPLDNHX-UHFFFAOYSA-N 1 2 324.811 4.203 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1ccc2ccnc(Cl)c2c1 ZINC001231979074 1053925707 /nfs/dbraw/zinc/92/57/07/1053925707.db2.gz PPBMCCKNPLDNHX-UHFFFAOYSA-N 1 2 324.811 4.203 20 0 DIADLO Clc1cncc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC000621257583 1053928340 /nfs/dbraw/zinc/92/83/40/1053928340.db2.gz CTDGIEZWJBKCOQ-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cncc(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC000621257583 1053928353 /nfs/dbraw/zinc/92/83/53/1053928353.db2.gz CTDGIEZWJBKCOQ-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Fc1ccccc1C1CC[NH+](Cc2cc(Cl)cnc2F)CC1 ZINC001231993252 1053934436 /nfs/dbraw/zinc/93/44/36/1053934436.db2.gz QRNDLVJNYBJWIX-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Clc1cncc(C[N@@H+]2CC[C@H](Oc3ccccc3Cl)C2)c1 ZINC000621269047 1053936350 /nfs/dbraw/zinc/93/63/50/1053936350.db2.gz HUAQHLXLGQLRLP-AWEZNQCLSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cncc(C[N@H+]2CC[C@H](Oc3ccccc3Cl)C2)c1 ZINC000621269047 1053936360 /nfs/dbraw/zinc/93/63/60/1053936360.db2.gz HUAQHLXLGQLRLP-AWEZNQCLSA-N 1 2 323.223 4.042 20 0 DIADLO CCC[N@H+](Cc1cc(-c2ccco2)on1)Cc1ccccc1F ZINC000621296999 1053944702 /nfs/dbraw/zinc/94/47/02/1053944702.db2.gz XABRYEYLAQDAOF-UHFFFAOYSA-N 1 2 314.360 4.486 20 0 DIADLO CCC[N@@H+](Cc1cc(-c2ccco2)on1)Cc1ccccc1F ZINC000621296999 1053944717 /nfs/dbraw/zinc/94/47/17/1053944717.db2.gz XABRYEYLAQDAOF-UHFFFAOYSA-N 1 2 314.360 4.486 20 0 DIADLO CC[N@H+](Cc1cccc(C(F)(F)F)n1)Cc1ccccc1F ZINC001232071654 1053955713 /nfs/dbraw/zinc/95/57/13/1053955713.db2.gz LWEQNRPRVCQWPU-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1cccc(C(F)(F)F)n1)Cc1ccccc1F ZINC001232071654 1053955729 /nfs/dbraw/zinc/95/57/29/1053955729.db2.gz LWEQNRPRVCQWPU-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO Fc1cccc(F)c1[C@H]1CCC[N@@H+]1Cc1cc2ccncc2[nH]1 ZINC001232097997 1053962673 /nfs/dbraw/zinc/96/26/73/1053962673.db2.gz XGSSFXHENLUNKV-QGZVFWFLSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1cccc(F)c1[C@H]1CCC[N@H+]1Cc1cc2ccncc2[nH]1 ZINC001232097997 1053962683 /nfs/dbraw/zinc/96/26/83/1053962683.db2.gz XGSSFXHENLUNKV-QGZVFWFLSA-N 1 2 313.351 4.178 20 0 DIADLO Cc1nccnc1C[NH2+][C@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000621355066 1053963024 /nfs/dbraw/zinc/96/30/24/1053963024.db2.gz AKYIGXJPQOAMCH-INIZCTEOSA-N 1 2 322.239 4.333 20 0 DIADLO Fc1cc(F)c(C[NH+]2CCC(OC3CCC3)CC2)c(Cl)c1 ZINC001232096745 1053963714 /nfs/dbraw/zinc/96/37/14/1053963714.db2.gz FQNMIDIFLGSWEY-UHFFFAOYSA-N 1 2 315.791 4.152 20 0 DIADLO Cc1nccnc1C[NH2+][C@@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000621355067 1053964755 /nfs/dbraw/zinc/96/47/55/1053964755.db2.gz AKYIGXJPQOAMCH-MRXNPFEDSA-N 1 2 322.239 4.333 20 0 DIADLO Cc1cc(NC[C@]2(c3ccccc3)CC2(C)C)nc(C2CC2)[nH+]1 ZINC001472837944 1053968653 /nfs/dbraw/zinc/96/86/53/1053968653.db2.gz GPIVMKHHZWMZJG-FQEVSTJZSA-N 1 2 307.441 4.442 20 0 DIADLO CCC[N@H+](Cc1ccccc1)Cc1c(Cl)nccc1OC ZINC001232155634 1053976607 /nfs/dbraw/zinc/97/66/07/1053976607.db2.gz PZHFNJBVLIUHLB-UHFFFAOYSA-N 1 2 304.821 4.156 20 0 DIADLO CCC[N@@H+](Cc1ccccc1)Cc1c(Cl)nccc1OC ZINC001232155634 1053976624 /nfs/dbraw/zinc/97/66/24/1053976624.db2.gz PZHFNJBVLIUHLB-UHFFFAOYSA-N 1 2 304.821 4.156 20 0 DIADLO Brc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccns1 ZINC001232188115 1053983769 /nfs/dbraw/zinc/98/37/69/1053983769.db2.gz BGTNKMIBAIGLJG-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccccc1[C@H]1CCC[N@H+]1Cc1ccns1 ZINC001232188115 1053983776 /nfs/dbraw/zinc/98/37/76/1053983776.db2.gz BGTNKMIBAIGLJG-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C[C@@H]1F ZINC001232197201 1053985059 /nfs/dbraw/zinc/98/50/59/1053985059.db2.gz LLCVBQJTAHTGOQ-CALCHBBNSA-N 1 2 307.771 4.499 20 0 DIADLO F[C@@H]1C[N@H+](Cc2ccccc2-c2ccc(Cl)cc2)C[C@@H]1F ZINC001232197201 1053985074 /nfs/dbraw/zinc/98/50/74/1053985074.db2.gz LLCVBQJTAHTGOQ-CALCHBBNSA-N 1 2 307.771 4.499 20 0 DIADLO Cc1scnc1C[N@@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC001232204149 1053985417 /nfs/dbraw/zinc/98/54/17/1053985417.db2.gz TVSSDUBYEAWZON-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1scnc1C[N@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC001232204149 1053985429 /nfs/dbraw/zinc/98/54/29/1053985429.db2.gz TVSSDUBYEAWZON-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccnc(C(C)(C)C)c2)[C@@H](c2ccccc2)CO1 ZINC001232219017 1053993729 /nfs/dbraw/zinc/99/37/29/1053993729.db2.gz LJKKMUITSHKNKG-QFBILLFUSA-N 1 2 324.468 4.341 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccnc(C(C)(C)C)c2)[C@@H](c2ccccc2)CO1 ZINC001232219017 1053993739 /nfs/dbraw/zinc/99/37/39/1053993739.db2.gz LJKKMUITSHKNKG-QFBILLFUSA-N 1 2 324.468 4.341 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1ccnc(C(F)(F)F)c1 ZINC001232237483 1053997922 /nfs/dbraw/zinc/99/79/22/1053997922.db2.gz RFLLHDJSVHTAQQ-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccnc(C(F)(F)F)c1 ZINC001232237483 1053997933 /nfs/dbraw/zinc/99/79/33/1053997933.db2.gz RFLLHDJSVHTAQQ-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO Brc1cccc([C@H]2CCC[N@@H+]2Cc2cnsc2)c1 ZINC001232230841 1053998515 /nfs/dbraw/zinc/99/85/15/1053998515.db2.gz VXXFEPVIHYUUMC-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cccc([C@H]2CCC[N@H+]2Cc2cnsc2)c1 ZINC001232230841 1053998524 /nfs/dbraw/zinc/99/85/24/1053998524.db2.gz VXXFEPVIHYUUMC-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO CCCc1ccccc1C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001354919310 1054004284 /nfs/dbraw/zinc/00/42/84/1054004284.db2.gz VBNRLZAORVCFPB-UHFFFAOYSA-N 1 2 323.371 4.216 20 0 DIADLO CCCC[N@H+](Cc1nnc(C2CC2)o1)[C@H](C)c1ccc(C)o1 ZINC000621739189 1054006785 /nfs/dbraw/zinc/00/67/85/1054006785.db2.gz UEOJOZHXZNIOST-CYBMUJFWSA-N 1 2 303.406 4.212 20 0 DIADLO CCCC[N@@H+](Cc1nnc(C2CC2)o1)[C@H](C)c1ccc(C)o1 ZINC000621739189 1054006799 /nfs/dbraw/zinc/00/67/99/1054006799.db2.gz UEOJOZHXZNIOST-CYBMUJFWSA-N 1 2 303.406 4.212 20 0 DIADLO Cc1sc(C[N@@H+]2CCCC[C@@H](F)C2)cc1Br ZINC001232291806 1054016093 /nfs/dbraw/zinc/01/60/93/1054016093.db2.gz OWEXELFJKHWVGF-SNVBAGLBSA-N 1 2 306.244 4.143 20 0 DIADLO Cc1sc(C[N@H+]2CCCC[C@@H](F)C2)cc1Br ZINC001232291806 1054016098 /nfs/dbraw/zinc/01/60/98/1054016098.db2.gz OWEXELFJKHWVGF-SNVBAGLBSA-N 1 2 306.244 4.143 20 0 DIADLO CC(C)C[C@@H](C(=O)N[C@H]1CCCC12CCCCC2)n1cc[nH+]c1 ZINC001300770102 1054021367 /nfs/dbraw/zinc/02/13/67/1054021367.db2.gz NQZVGDLZIIESHZ-IRXDYDNUSA-N 1 2 317.477 4.090 20 0 DIADLO CSc1cc(C)c(C[N@@H+]2CCc3cccc(Cl)c3C2)cn1 ZINC001232350097 1054026530 /nfs/dbraw/zinc/02/65/30/1054026530.db2.gz NSYZTQSGTFXHNU-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CSc1cc(C)c(C[N@H+]2CCc3cccc(Cl)c3C2)cn1 ZINC001232350097 1054026540 /nfs/dbraw/zinc/02/65/40/1054026540.db2.gz NSYZTQSGTFXHNU-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO Cc1cccc(C[N@H+]2CCCC(F)(F)[C@H](F)C2)c1OC(C)C ZINC001232389706 1054036135 /nfs/dbraw/zinc/03/61/35/1054036135.db2.gz HPKAFEASSRFDJC-OAHLLOKOSA-N 1 2 315.379 4.351 20 0 DIADLO Cc1cccc(C[N@@H+]2CCCC(F)(F)[C@H](F)C2)c1OC(C)C ZINC001232389706 1054036124 /nfs/dbraw/zinc/03/61/24/1054036124.db2.gz HPKAFEASSRFDJC-OAHLLOKOSA-N 1 2 315.379 4.351 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ccno2)c1OCc1ccccc1 ZINC001232400955 1054039130 /nfs/dbraw/zinc/03/91/30/1054039130.db2.gz BZKOPUNZBLYLPE-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ccno2)c1OCc1ccccc1 ZINC001232400955 1054039138 /nfs/dbraw/zinc/03/91/38/1054039138.db2.gz BZKOPUNZBLYLPE-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1cnn2ccccc12 ZINC001330812576 1054052995 /nfs/dbraw/zinc/05/29/95/1054052995.db2.gz ZIVIMFIWIXQMQM-UHFFFAOYSA-N 1 2 319.412 4.051 20 0 DIADLO FCc1cccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)n1 ZINC001232536808 1054065569 /nfs/dbraw/zinc/06/55/69/1054065569.db2.gz PVVYCHZQRRVEQJ-KRWDZBQOSA-N 1 2 306.331 4.166 20 0 DIADLO FCc1cccc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)n1 ZINC001232536808 1054065578 /nfs/dbraw/zinc/06/55/78/1054065578.db2.gz PVVYCHZQRRVEQJ-KRWDZBQOSA-N 1 2 306.331 4.166 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ncc(Cl)cc2Cl)CCC1(F)F ZINC001232571585 1054074623 /nfs/dbraw/zinc/07/46/23/1054074623.db2.gz UWBAUDGWJOBBKL-SECBINFHSA-N 1 2 309.187 4.256 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2cc3ccoc3cn2)c(F)c1 ZINC001232556405 1054071033 /nfs/dbraw/zinc/07/10/33/1054071033.db2.gz JEPGHYBGZSEGQR-KRWDZBQOSA-N 1 2 314.335 4.443 20 0 DIADLO CCCC[C@@H](C)C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001355164390 1054071192 /nfs/dbraw/zinc/07/11/92/1054071192.db2.gz XFWOLKSAZGZDEE-HZPDHXFCSA-N 1 2 319.493 4.170 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2cc3ccoc3cn2)c(F)c1 ZINC001232556405 1054071045 /nfs/dbraw/zinc/07/10/45/1054071045.db2.gz JEPGHYBGZSEGQR-KRWDZBQOSA-N 1 2 314.335 4.443 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ncc(Cl)cc2Cl)CCC1(F)F ZINC001232571585 1054074609 /nfs/dbraw/zinc/07/46/09/1054074609.db2.gz UWBAUDGWJOBBKL-SECBINFHSA-N 1 2 309.187 4.256 20 0 DIADLO CCC[N@H+](Cc1cc(F)c(O)c(Br)c1)[C@@H](C)CC ZINC001232630034 1054087815 /nfs/dbraw/zinc/08/78/15/1054087815.db2.gz JAKYUAKKRBOAOX-JTQLQIEISA-N 1 2 318.230 4.304 20 0 DIADLO CCC[N@@H+](Cc1cc(F)c(O)c(Br)c1)[C@@H](C)CC ZINC001232630034 1054087823 /nfs/dbraw/zinc/08/78/23/1054087823.db2.gz JAKYUAKKRBOAOX-JTQLQIEISA-N 1 2 318.230 4.304 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1ccc2ccsc2c1 ZINC001232615732 1054086136 /nfs/dbraw/zinc/08/61/36/1054086136.db2.gz IFMLYCMEGHQRDX-LBPRGKRZSA-N 1 2 305.443 4.063 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1ccc2ccsc2c1 ZINC001232615732 1054086145 /nfs/dbraw/zinc/08/61/45/1054086145.db2.gz IFMLYCMEGHQRDX-LBPRGKRZSA-N 1 2 305.443 4.063 20 0 DIADLO Cc1nc(C(F)(F)F)c(Cn2c[nH+]c(C(C)(C)C)c2)s1 ZINC001331892460 1054097474 /nfs/dbraw/zinc/09/74/74/1054097474.db2.gz UFXFMDGSIIDOSZ-UHFFFAOYSA-N 1 2 303.353 4.013 20 0 DIADLO CC1(C)CC[NH+](Cc2cnc(Cl)cc2Br)CC1 ZINC001232682174 1054098555 /nfs/dbraw/zinc/09/85/55/1054098555.db2.gz WXNNIOZMEHHZLF-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO Brc1ccc(C[N@H+]2CC=C(c3ccccc3)CC2)[nH]1 ZINC001232695336 1054102219 /nfs/dbraw/zinc/10/22/19/1054102219.db2.gz YSKGBQJKXAPTHE-UHFFFAOYSA-N 1 2 317.230 4.067 20 0 DIADLO Brc1ccc(C[N@@H+]2CC=C(c3ccccc3)CC2)[nH]1 ZINC001232695336 1054102228 /nfs/dbraw/zinc/10/22/28/1054102228.db2.gz YSKGBQJKXAPTHE-UHFFFAOYSA-N 1 2 317.230 4.067 20 0 DIADLO CCO[C@@H]1CCC[N@H+](Cc2cc(F)c(Cl)cc2Cl)C1 ZINC001232700453 1054105115 /nfs/dbraw/zinc/10/51/15/1054105115.db2.gz KEORVDGGAWLRLI-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@@H]1CCC[N@@H+](Cc2cc(F)c(Cl)cc2Cl)C1 ZINC001232700453 1054105118 /nfs/dbraw/zinc/10/51/18/1054105118.db2.gz KEORVDGGAWLRLI-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1ccc2ncsc2c1 ZINC001232737507 1054113252 /nfs/dbraw/zinc/11/32/52/1054113252.db2.gz ZYHRZBXAKBUHIO-UHFFFAOYSA-N 1 2 309.847 4.038 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1ccc2ncsc2c1 ZINC001232737507 1054113265 /nfs/dbraw/zinc/11/32/65/1054113265.db2.gz ZYHRZBXAKBUHIO-UHFFFAOYSA-N 1 2 309.847 4.038 20 0 DIADLO CC[C@H]1CC[C@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)CC1 ZINC001355348514 1054114711 /nfs/dbraw/zinc/11/47/11/1054114711.db2.gz KOHQXELEVKNJOK-HDJSIYSDSA-N 1 2 315.392 4.166 20 0 DIADLO C[N@H+](Cc1cc(Br)co1)Cc1ccccc1Cl ZINC001232853928 1054132465 /nfs/dbraw/zinc/13/24/65/1054132465.db2.gz HDMUHCPJVZVPBC-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO C[N@@H+](Cc1cc(Br)co1)Cc1ccccc1Cl ZINC001232853928 1054132473 /nfs/dbraw/zinc/13/24/73/1054132473.db2.gz HDMUHCPJVZVPBC-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO CCCn1cnc(C[N@H+](C)Cc2ccc(Cl)c(Cl)c2)c1 ZINC001232797107 1054122457 /nfs/dbraw/zinc/12/24/57/1054122457.db2.gz HSCJKOOMMMPYRQ-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO CCCn1cnc(C[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)c1 ZINC001232797107 1054122460 /nfs/dbraw/zinc/12/24/60/1054122460.db2.gz HSCJKOOMMMPYRQ-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO Clc1cc(Cl)c(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)c(Cl)n1 ZINC001232847073 1054130020 /nfs/dbraw/zinc/13/00/20/1054130020.db2.gz SHBFGMBBUVTJFV-DTORHVGOSA-N 1 2 305.636 4.274 20 0 DIADLO Clc1cc(Cl)c(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)c(Cl)n1 ZINC001232847073 1054130025 /nfs/dbraw/zinc/13/00/25/1054130025.db2.gz SHBFGMBBUVTJFV-DTORHVGOSA-N 1 2 305.636 4.274 20 0 DIADLO Clc1cc(Cl)c(C[N@H+](CC2CC2)C2CC2)c(Cl)n1 ZINC001232852681 1054132026 /nfs/dbraw/zinc/13/20/26/1054132026.db2.gz DTXRIYIUBXIPGD-UHFFFAOYSA-N 1 2 305.636 4.416 20 0 DIADLO Clc1cc(Cl)c(C[N@@H+](CC2CC2)C2CC2)c(Cl)n1 ZINC001232852681 1054132037 /nfs/dbraw/zinc/13/20/37/1054132037.db2.gz DTXRIYIUBXIPGD-UHFFFAOYSA-N 1 2 305.636 4.416 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2cncc(-c3ccccc3)c2)C[C@@H]1F ZINC001232899796 1054143442 /nfs/dbraw/zinc/14/34/42/1054143442.db2.gz UIQZDLOQZZXHCD-ZWKOTPCHSA-N 1 2 302.368 4.021 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2cncc(-c3ccccc3)c2)C[C@@H]1F ZINC001232899796 1054143450 /nfs/dbraw/zinc/14/34/50/1054143450.db2.gz UIQZDLOQZZXHCD-ZWKOTPCHSA-N 1 2 302.368 4.021 20 0 DIADLO FC[C@H]1CCC[N@@H+]1Cc1ccc(OCc2ccccc2)cc1F ZINC001232920925 1054148903 /nfs/dbraw/zinc/14/89/03/1054148903.db2.gz DPLROJMQKKBUFJ-QGZVFWFLSA-N 1 2 317.379 4.339 20 0 DIADLO FC[C@H]1CCC[N@H+]1Cc1ccc(OCc2ccccc2)cc1F ZINC001232920925 1054148914 /nfs/dbraw/zinc/14/89/14/1054148914.db2.gz DPLROJMQKKBUFJ-QGZVFWFLSA-N 1 2 317.379 4.339 20 0 DIADLO Oc1c(F)ccc(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)c1F ZINC001232934969 1054149927 /nfs/dbraw/zinc/14/99/27/1054149927.db2.gz LQLNIOZHVTWOJS-LLVKDONJSA-N 1 2 323.770 4.313 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2cc(Cl)cnc2Br)[C@H]1C ZINC001232961573 1054158887 /nfs/dbraw/zinc/15/88/87/1054158887.db2.gz PTMIZSUACNZBMY-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2cc(Cl)cnc2Br)[C@H]1C ZINC001232961573 1054158892 /nfs/dbraw/zinc/15/88/92/1054158892.db2.gz PTMIZSUACNZBMY-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO CCc1ncc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)o1 ZINC001333459967 1054154669 /nfs/dbraw/zinc/15/46/69/1054154669.db2.gz CGQFJYHLBYUDHO-UHFFFAOYSA-N 1 2 312.335 4.192 20 0 DIADLO CCc1ncc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)o1 ZINC001333459967 1054154674 /nfs/dbraw/zinc/15/46/74/1054154674.db2.gz CGQFJYHLBYUDHO-UHFFFAOYSA-N 1 2 312.335 4.192 20 0 DIADLO Cc1ncc(F)cc1C[N@H+](Cc1ccccc1)Cc1ccccn1 ZINC001232986436 1054166448 /nfs/dbraw/zinc/16/64/48/1054166448.db2.gz PKRLUFZUIYUXTO-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ncc(F)cc1C[N@@H+](Cc1ccccc1)Cc1ccccn1 ZINC001232986436 1054166455 /nfs/dbraw/zinc/16/64/55/1054166455.db2.gz PKRLUFZUIYUXTO-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ncc(F)cc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001232991466 1054168872 /nfs/dbraw/zinc/16/88/72/1054168872.db2.gz BPZLKNQGUATDQY-KRWDZBQOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1ncc(F)cc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001232991466 1054168877 /nfs/dbraw/zinc/16/88/77/1054168877.db2.gz BPZLKNQGUATDQY-KRWDZBQOSA-N 1 2 306.331 4.144 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cc(F)cnc1C ZINC001232993776 1054168910 /nfs/dbraw/zinc/16/89/10/1054168910.db2.gz RYHINZXPZWYHNH-GOSISDBHSA-N 1 2 314.404 4.013 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cc(F)cnc1C ZINC001232993776 1054168919 /nfs/dbraw/zinc/16/89/19/1054168919.db2.gz RYHINZXPZWYHNH-GOSISDBHSA-N 1 2 314.404 4.013 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2c(F)cc(Cl)cc2OC)c1 ZINC001233004137 1054171716 /nfs/dbraw/zinc/17/17/16/1054171716.db2.gz LBVTWOYLHCBNTH-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2c(F)cc(Cl)cc2OC)c1 ZINC001233004137 1054171723 /nfs/dbraw/zinc/17/17/23/1054171723.db2.gz LBVTWOYLHCBNTH-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO CC(C)C[N@H+](Cc1ncc(C(C)C)s1)Cc1ccccn1 ZINC001333806833 1054174119 /nfs/dbraw/zinc/17/41/19/1054174119.db2.gz BBNGKFPNEJKJHM-UHFFFAOYSA-N 1 2 303.475 4.320 20 0 DIADLO CC(C)C[N@@H+](Cc1ncc(C(C)C)s1)Cc1ccccn1 ZINC001333806833 1054174123 /nfs/dbraw/zinc/17/41/23/1054174123.db2.gz BBNGKFPNEJKJHM-UHFFFAOYSA-N 1 2 303.475 4.320 20 0 DIADLO Cc1nc(C[N@@H+]2[C@H](C)CO[C@@H](c3ccccc3)[C@H]2C)c(C)s1 ZINC001333926332 1054177569 /nfs/dbraw/zinc/17/75/69/1054177569.db2.gz LICHJMRIEULIRG-SNUQEOBHSA-N 1 2 316.470 4.110 20 0 DIADLO Cc1nc(C[N@H+]2[C@H](C)CO[C@@H](c3ccccc3)[C@H]2C)c(C)s1 ZINC001333926332 1054177578 /nfs/dbraw/zinc/17/75/78/1054177578.db2.gz LICHJMRIEULIRG-SNUQEOBHSA-N 1 2 316.470 4.110 20 0 DIADLO CCC[N@@H+](Cc1nc(C)sc1Br)CC(C)C ZINC001233159018 1054191365 /nfs/dbraw/zinc/19/13/65/1054191365.db2.gz XHIQENGLUWUXII-UHFFFAOYSA-N 1 2 305.285 4.082 20 0 DIADLO CCC[N@H+](Cc1nc(C)sc1Br)CC(C)C ZINC001233159018 1054191368 /nfs/dbraw/zinc/19/13/68/1054191368.db2.gz XHIQENGLUWUXII-UHFFFAOYSA-N 1 2 305.285 4.082 20 0 DIADLO Fc1c(Cl)ccc(C[N@H+]2CC[C@H](F)C(F)(F)CC2)c1F ZINC001233207778 1054201749 /nfs/dbraw/zinc/20/17/49/1054201749.db2.gz PYOSCBXXVSRVKM-JTQLQIEISA-N 1 2 313.697 4.187 20 0 DIADLO Fc1c(Cl)ccc(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c1F ZINC001233207778 1054201764 /nfs/dbraw/zinc/20/17/64/1054201764.db2.gz PYOSCBXXVSRVKM-JTQLQIEISA-N 1 2 313.697 4.187 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2cnc(C)c(C)c2)on1 ZINC001233161058 1054194102 /nfs/dbraw/zinc/19/41/02/1054194102.db2.gz QUHFDZMUVVQYJU-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2cnc(C)c(C)c2)on1 ZINC001233161058 1054194114 /nfs/dbraw/zinc/19/41/14/1054194114.db2.gz QUHFDZMUVVQYJU-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)cnc1C ZINC001233161011 1054194473 /nfs/dbraw/zinc/19/44/73/1054194473.db2.gz OQKPOICJFKCYRF-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C[N@H+]2CCc3cccc(C(F)(F)F)c3C2)cnc1C ZINC001233161011 1054194478 /nfs/dbraw/zinc/19/44/78/1054194478.db2.gz OQKPOICJFKCYRF-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)CC2 ZINC000638543255 1054196173 /nfs/dbraw/zinc/19/61/73/1054196173.db2.gz HCUICERUFNBSDN-QZTJIDSGSA-N 1 2 310.445 4.012 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCc3ccsc3C2)cs1 ZINC001233175340 1054196449 /nfs/dbraw/zinc/19/64/49/1054196449.db2.gz AENLVRGBZYCDCA-UHFFFAOYSA-N 1 2 303.374 4.387 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCc3ccsc3C2)cs1 ZINC001233175340 1054196458 /nfs/dbraw/zinc/19/64/58/1054196458.db2.gz AENLVRGBZYCDCA-UHFFFAOYSA-N 1 2 303.374 4.387 20 0 DIADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1cccc(Oc2ccc(F)cc2)c1 ZINC001233206821 1054200940 /nfs/dbraw/zinc/20/09/40/1054200940.db2.gz DLLKITWRAZBNQQ-AWEZNQCLSA-N 1 2 313.372 4.171 20 0 DIADLO C[C@H]1CC(=O)CC[N@H+]1Cc1cccc(Oc2ccc(F)cc2)c1 ZINC001233206821 1054200945 /nfs/dbraw/zinc/20/09/45/1054200945.db2.gz DLLKITWRAZBNQQ-AWEZNQCLSA-N 1 2 313.372 4.171 20 0 DIADLO CCc1nnc(C[N@@H+]2C[C@@H]3CCCC[C@]32c2ccccc2)s1 ZINC001334885416 1054204361 /nfs/dbraw/zinc/20/43/61/1054204361.db2.gz ODLFRLCJAJZQNC-YJBOKZPZSA-N 1 2 313.470 4.002 20 0 DIADLO CCc1nnc(C[N@H+]2C[C@@H]3CCCC[C@]32c2ccccc2)s1 ZINC001334885416 1054204372 /nfs/dbraw/zinc/20/43/72/1054204372.db2.gz ODLFRLCJAJZQNC-YJBOKZPZSA-N 1 2 313.470 4.002 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)cc1O ZINC001233233550 1054210299 /nfs/dbraw/zinc/21/02/99/1054210299.db2.gz KSRGDQSSURDRTE-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)cc1O ZINC001233233550 1054210309 /nfs/dbraw/zinc/21/03/09/1054210309.db2.gz KSRGDQSSURDRTE-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO Cc1cnsc1C[N@H+](Cc1ccccc1)Cc1cccnc1 ZINC001233320476 1054233303 /nfs/dbraw/zinc/23/33/03/1054233303.db2.gz AWCHQULMKFRARY-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1cnsc1C[N@@H+](Cc1ccccc1)Cc1cccnc1 ZINC001233320476 1054233313 /nfs/dbraw/zinc/23/33/13/1054233313.db2.gz AWCHQULMKFRARY-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Fc1cc(Cl)c(Br)cc1C[N@@H+]1CCC2(CC2)C1 ZINC001233439667 1054273091 /nfs/dbraw/zinc/27/30/91/1054273091.db2.gz NXACPEIJTIIKEP-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO Fc1cc(Cl)c(Br)cc1C[N@H+]1CCC2(CC2)C1 ZINC001233439667 1054273104 /nfs/dbraw/zinc/27/31/04/1054273104.db2.gz NXACPEIJTIIKEP-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO COc1ccc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c(Cl)c1O ZINC001233397929 1054258518 /nfs/dbraw/zinc/25/85/18/1054258518.db2.gz QTLHIKSWYDEZDL-LBPRGKRZSA-N 1 2 317.816 4.174 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)c1F ZINC001233395640 1054259475 /nfs/dbraw/zinc/25/94/75/1054259475.db2.gz HGLGYUGXBCJLNB-LLVKDONJSA-N 1 2 323.770 4.313 20 0 DIADLO CC(C)c1ccccc1OC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC001356003674 1054259786 /nfs/dbraw/zinc/25/97/86/1054259786.db2.gz MXMJZQZXCCVLCD-UHFFFAOYSA-N 1 2 306.365 4.215 20 0 DIADLO Cc1ccc(N[C@@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)c(C)[nH+]1 ZINC001337320627 1054263877 /nfs/dbraw/zinc/26/38/77/1054263877.db2.gz INFPBKQSJNYLLP-LBPRGKRZSA-N 1 2 309.413 4.101 20 0 DIADLO CCCOc1ncccc1CNc1cc(C)c2ccccc2[nH+]1 ZINC001337827959 1054287578 /nfs/dbraw/zinc/28/75/78/1054287578.db2.gz OFMONXSHXUOFSU-UHFFFAOYSA-N 1 2 307.397 4.339 20 0 DIADLO Cc1cc(NCCCCNc2ccccn2)[nH+]c2ccccc12 ZINC001338822978 1054313629 /nfs/dbraw/zinc/31/36/29/1054313629.db2.gz MJVBAGPARLKEGD-UHFFFAOYSA-N 1 2 306.413 4.242 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccc(C2CC2)cc1 ZINC001356295849 1054316027 /nfs/dbraw/zinc/31/60/27/1054316027.db2.gz DXRSDODSDYCQCB-UHFFFAOYSA-N 1 2 321.355 4.141 20 0 DIADLO Cc1ncc2c(n1)CCC[C@@H]2Nc1cc(C)c2ccccc2[nH+]1 ZINC001339154465 1054325866 /nfs/dbraw/zinc/32/58/66/1054325866.db2.gz GEONJFSPSIFSMG-SFHVURJKSA-N 1 2 304.397 4.131 20 0 DIADLO CC[N@H+](Cc1nccn1C)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000171580669 1054376319 /nfs/dbraw/zinc/37/63/19/1054376319.db2.gz ZTZDRVSTYQQDLM-HXUWFJFHSA-N 1 2 323.415 4.171 20 0 DIADLO CC[N@@H+](Cc1nccn1C)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000171580669 1054376327 /nfs/dbraw/zinc/37/63/27/1054376327.db2.gz ZTZDRVSTYQQDLM-HXUWFJFHSA-N 1 2 323.415 4.171 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@H+](Cc2ncc(-c3cccs3)o2)C1 ZINC000171757750 1054385339 /nfs/dbraw/zinc/38/53/39/1054385339.db2.gz VQNPLTJBHFOHFS-SNVBAGLBSA-N 1 2 316.348 4.177 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2ncc(-c3cccs3)o2)C1 ZINC000171757750 1054385347 /nfs/dbraw/zinc/38/53/47/1054385347.db2.gz VQNPLTJBHFOHFS-SNVBAGLBSA-N 1 2 316.348 4.177 20 0 DIADLO Cc1cc2[nH]c(CNc3ccc(N4CCCC4)c[nH+]3)cc2c(C)c1 ZINC000478626077 1054387012 /nfs/dbraw/zinc/38/70/12/1054387012.db2.gz XJWMEHXDYYLBSP-UHFFFAOYSA-N 1 2 320.440 4.392 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1ccnn1C(C)C ZINC000479788443 1054389437 /nfs/dbraw/zinc/38/94/37/1054389437.db2.gz ZCTLHKSDUPPWCQ-UHFFFAOYSA-N 1 2 317.824 4.099 20 0 DIADLO Cc1cn2cc(NC(=O)c3csc4cc(C)ccc34)ccc2[nH+]1 ZINC001357170245 1054431925 /nfs/dbraw/zinc/43/19/25/1054431925.db2.gz GJEATGGCMNQCLD-UHFFFAOYSA-N 1 2 321.405 4.418 20 0 DIADLO CCC[C@H](CC)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001357253234 1054445537 /nfs/dbraw/zinc/44/55/37/1054445537.db2.gz AEAHPPSSLPCXNH-LBPRGKRZSA-N 1 2 305.809 4.291 20 0 DIADLO C[C@]1(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CC=CCC1 ZINC001357254697 1054445818 /nfs/dbraw/zinc/44/58/18/1054445818.db2.gz NLQGKWNHFDKORQ-KRWDZBQOSA-N 1 2 315.804 4.211 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2CCCC3(CC3)C2)ccc1-n1cc[nH+]c1 ZINC001443315242 1054446621 /nfs/dbraw/zinc/44/66/21/1054446621.db2.gz YJNPACMOTAPYIE-OAHLLOKOSA-N 1 2 309.413 4.090 20 0 DIADLO Oc1cccc2c1CCC[C@@H]2Nc1ccc([NH+]2CCCC2)cc1 ZINC001343635738 1054450143 /nfs/dbraw/zinc/45/01/43/1054450143.db2.gz SLIJHTQZRLFGEQ-IBGZPJMESA-N 1 2 308.425 4.482 20 0 DIADLO Cc1nc(C)c([C@@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)s1 ZINC000336851693 1054451676 /nfs/dbraw/zinc/45/16/76/1054451676.db2.gz ABDWCTYARBOMSV-CYBMUJFWSA-N 1 2 316.474 4.318 20 0 DIADLO Cc1ccccc1C[N@@H+](C)[C@H](C)c1noc(-c2ccccc2)n1 ZINC000671239750 1054457159 /nfs/dbraw/zinc/45/71/59/1054457159.db2.gz LNCKSXAUVUBXCE-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccccc1C[N@H+](C)[C@H](C)c1noc(-c2ccccc2)n1 ZINC000671239750 1054457163 /nfs/dbraw/zinc/45/71/63/1054457163.db2.gz LNCKSXAUVUBXCE-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(NC(=O)C2CC(C)(C)CC(C)(C)C2)c(N(C)C)[nH+]1 ZINC001357395303 1054471568 /nfs/dbraw/zinc/47/15/68/1054471568.db2.gz KCTWKWZMLDAHBX-UHFFFAOYSA-N 1 2 317.477 4.247 20 0 DIADLO CC(C)(C)C[N@H+](CCC#N)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000185246213 1054488598 /nfs/dbraw/zinc/48/85/98/1054488598.db2.gz MNIUIRVLYRUAFS-UHFFFAOYSA-N 1 2 309.797 4.010 20 0 DIADLO CC(C)(C)C[N@@H+](CCC#N)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000185246213 1054488603 /nfs/dbraw/zinc/48/86/03/1054488603.db2.gz MNIUIRVLYRUAFS-UHFFFAOYSA-N 1 2 309.797 4.010 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(CO)o1)c1cc(F)c(Cl)cc1Cl ZINC000174237784 1054505554 /nfs/dbraw/zinc/50/55/54/1054505554.db2.gz HBXQTBXDNVFMRZ-MRVPVSSYSA-N 1 2 318.175 4.069 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)C(=O)Nc1ccccc1 ZINC000175021261 1054519750 /nfs/dbraw/zinc/51/97/50/1054519750.db2.gz WLLHOBIFSWMDGP-NWDGAFQWSA-N 1 2 320.795 4.157 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2cscn2)cc1Cl ZINC000671295654 1054528238 /nfs/dbraw/zinc/52/82/38/1054528238.db2.gz YBVJUZNTPGRYAL-NSHDSACASA-N 1 2 310.850 4.435 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1nc2cc(Cl)ccc2n1C ZINC000623120904 1054535838 /nfs/dbraw/zinc/53/58/38/1054535838.db2.gz MOQFNMISLYRGTC-UHFFFAOYSA-N 1 2 319.758 4.001 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1nc2cc(Cl)ccc2n1C ZINC000623120904 1054535849 /nfs/dbraw/zinc/53/58/49/1054535849.db2.gz MOQFNMISLYRGTC-UHFFFAOYSA-N 1 2 319.758 4.001 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@H]2CCCN(c3ccccc3)C2)cc1 ZINC001234588425 1054551744 /nfs/dbraw/zinc/55/17/44/1054551744.db2.gz NXZHWOGXBIITMA-IBGZPJMESA-N 1 2 324.424 4.096 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@@H]2CCc3c2nccc3Cl)cc1 ZINC001234584577 1054551807 /nfs/dbraw/zinc/55/18/07/1054551807.db2.gz FIQFUNSIPLACKP-OAHLLOKOSA-N 1 2 316.788 4.163 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)n1 ZINC000192552463 1054559214 /nfs/dbraw/zinc/55/92/14/1054559214.db2.gz NTWDZSZBYGIICL-KRWDZBQOSA-N 1 2 319.836 4.307 20 0 DIADLO Cc1ccc(C)c([C@H]2CCCN2C(=O)c2cc3c[nH+]ccc3[nH]2)c1 ZINC001545693412 1054580242 /nfs/dbraw/zinc/58/02/42/1054580242.db2.gz UITJEUQYFSBATP-LJQANCHMSA-N 1 2 319.408 4.157 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1cnc(C2CC2)o1 ZINC001203530749 1054581503 /nfs/dbraw/zinc/58/15/03/1054581503.db2.gz YPDABSIYXKMPOU-UHFFFAOYSA-N 1 2 316.792 4.187 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1c(F)cc(F)cc1Br ZINC001234734798 1054583963 /nfs/dbraw/zinc/58/39/63/1054583963.db2.gz PQDAOQFCIMNGFG-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1c(F)cc(F)cc1Br ZINC001234734798 1054583973 /nfs/dbraw/zinc/58/39/73/1054583973.db2.gz PQDAOQFCIMNGFG-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CC[C@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)C[C@@H]1C ZINC001358066863 1054592586 /nfs/dbraw/zinc/59/25/86/1054592586.db2.gz HKSBYYDRXZWIIM-RDBSUJKOSA-N 1 2 315.392 4.022 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000176976881 1054604734 /nfs/dbraw/zinc/60/47/34/1054604734.db2.gz JZTXAEVMEYIYKE-SFHVURJKSA-N 1 2 317.454 4.109 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000176976881 1054604744 /nfs/dbraw/zinc/60/47/44/1054604744.db2.gz JZTXAEVMEYIYKE-SFHVURJKSA-N 1 2 317.454 4.109 20 0 DIADLO CCC(C)(C)C1CCC2(C[C@@H]2C(=O)Nc2cc[nH+]c(C)c2)CC1 ZINC001358136562 1054607148 /nfs/dbraw/zinc/60/71/48/1054607148.db2.gz HYXQPDBSULTIRE-RYZJOYRSSA-N 1 2 314.473 4.383 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(-c3cccs3)n2)CCS1 ZINC000177515633 1054620116 /nfs/dbraw/zinc/62/01/16/1054620116.db2.gz SXUQHNQDNJQKER-UHFFFAOYSA-N 1 2 310.513 4.199 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(-c3cccs3)n2)CCS1 ZINC000177515633 1054620125 /nfs/dbraw/zinc/62/01/25/1054620125.db2.gz SXUQHNQDNJQKER-UHFFFAOYSA-N 1 2 310.513 4.199 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCO2)c1ncc(C(C)(C)C)o1 ZINC000177418075 1054620490 /nfs/dbraw/zinc/62/04/90/1054620490.db2.gz JKNOBKPMYBXGFX-NWDGAFQWSA-N 1 2 316.401 4.113 20 0 DIADLO Fc1c(Br)cc(Cl)cc1C[N@@H+]1CCC2(CC2)C1 ZINC001234967119 1054635616 /nfs/dbraw/zinc/63/56/16/1054635616.db2.gz CIMWOKPNPUGCCV-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO Fc1c(Br)cc(Cl)cc1C[N@H+]1CCC2(CC2)C1 ZINC001234967119 1054635628 /nfs/dbraw/zinc/63/56/28/1054635628.db2.gz CIMWOKPNPUGCCV-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO Clc1oc2ccccc2c1C[NH2+]Cc1nc2c(s1)CCC2 ZINC000623645338 1054642065 /nfs/dbraw/zinc/64/20/65/1054642065.db2.gz YCFAUCCLXFIUOK-UHFFFAOYSA-N 1 2 318.829 4.321 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1c[nH]c(-c3ccccc3F)c1)C2 ZINC001235040902 1054646887 /nfs/dbraw/zinc/64/68/87/1054646887.db2.gz YAGIFTABPOBLTA-UHFFFAOYSA-N 1 2 322.383 4.345 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1c[nH]c(-c3ccccc3F)c1)C2 ZINC001235040902 1054646897 /nfs/dbraw/zinc/64/68/97/1054646897.db2.gz YAGIFTABPOBLTA-UHFFFAOYSA-N 1 2 322.383 4.345 20 0 DIADLO C[N@H+](Cc1nc(C(F)(F)F)cs1)[C@@H]1CCc2ccccc21 ZINC000178588157 1054654643 /nfs/dbraw/zinc/65/46/43/1054654643.db2.gz MWZCMXSXVXILHW-GFCCVEGCSA-N 1 2 312.360 4.281 20 0 DIADLO C[N@@H+](Cc1nc(C(F)(F)F)cs1)[C@@H]1CCc2ccccc21 ZINC000178588157 1054654645 /nfs/dbraw/zinc/65/46/45/1054654645.db2.gz MWZCMXSXVXILHW-GFCCVEGCSA-N 1 2 312.360 4.281 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)ccc1-c1ccccc1 ZINC001450708998 1054659852 /nfs/dbraw/zinc/65/98/52/1054659852.db2.gz FGCIUWOTTWGGIH-QZTJIDSGSA-N 1 2 317.392 4.127 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)ccc1-c1ccccc1 ZINC001450708998 1054659857 /nfs/dbraw/zinc/65/98/57/1054659857.db2.gz FGCIUWOTTWGGIH-QZTJIDSGSA-N 1 2 317.392 4.127 20 0 DIADLO CC1(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)CCC(F)(F)CC1 ZINC000623733892 1054677954 /nfs/dbraw/zinc/67/79/54/1054677954.db2.gz CCFRTCGLQSFKNZ-UHFFFAOYSA-N 1 2 319.355 4.026 20 0 DIADLO CCC[N@H+](CC(=O)OCC)Cc1cc(-c2ccsc2)cs1 ZINC001235189026 1054679186 /nfs/dbraw/zinc/67/91/86/1054679186.db2.gz NMBXQRAHUKFGJR-UHFFFAOYSA-N 1 2 323.483 4.252 20 0 DIADLO CCC[N@@H+](CC(=O)OCC)Cc1cc(-c2ccsc2)cs1 ZINC001235189026 1054679192 /nfs/dbraw/zinc/67/91/92/1054679192.db2.gz NMBXQRAHUKFGJR-UHFFFAOYSA-N 1 2 323.483 4.252 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1)Cc1c(F)cc(C)cc1F ZINC001235199063 1054684398 /nfs/dbraw/zinc/68/43/98/1054684398.db2.gz RVOHGEMEQLCJBX-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1)Cc1c(F)cc(C)cc1F ZINC001235199063 1054684403 /nfs/dbraw/zinc/68/44/03/1054684403.db2.gz RVOHGEMEQLCJBX-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO F[C@H]1CCC[N@H+](Cc2nc(Cl)ccc2C(F)(F)F)CC1 ZINC001235223050 1054686252 /nfs/dbraw/zinc/68/62/52/1054686252.db2.gz KOUXLHVKDMPDPL-VIFPVBQESA-N 1 2 310.722 4.078 20 0 DIADLO F[C@H]1CCC[N@@H+](Cc2nc(Cl)ccc2C(F)(F)F)CC1 ZINC001235223050 1054686256 /nfs/dbraw/zinc/68/62/56/1054686256.db2.gz KOUXLHVKDMPDPL-VIFPVBQESA-N 1 2 310.722 4.078 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1cccc2nccn21 ZINC000179607988 1054690461 /nfs/dbraw/zinc/69/04/61/1054690461.db2.gz ILESMZKYDKJWDF-ZDUSSCGKSA-N 1 2 322.437 4.137 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cccc2nccn21 ZINC000179607988 1054690468 /nfs/dbraw/zinc/69/04/68/1054690468.db2.gz ILESMZKYDKJWDF-ZDUSSCGKSA-N 1 2 322.437 4.137 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)N(C)Cc1cccc2[nH+]ccn21 ZINC000179607988 1054690477 /nfs/dbraw/zinc/69/04/77/1054690477.db2.gz ILESMZKYDKJWDF-ZDUSSCGKSA-N 1 2 322.437 4.137 20 0 DIADLO CCc1cccc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)n1 ZINC001235263990 1054695467 /nfs/dbraw/zinc/69/54/67/1054695467.db2.gz KOFSTSSNCSEHRU-QGZVFWFLSA-N 1 2 302.368 4.259 20 0 DIADLO CCc1cccc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)n1 ZINC001235263990 1054695468 /nfs/dbraw/zinc/69/54/68/1054695468.db2.gz KOFSTSSNCSEHRU-QGZVFWFLSA-N 1 2 302.368 4.259 20 0 DIADLO CC(C)OCc1ccccc1C[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000921502517 1054703568 /nfs/dbraw/zinc/70/35/68/1054703568.db2.gz OPPNKDYZXLANQJ-UHFFFAOYSA-N 1 2 316.445 4.187 20 0 DIADLO Fc1cc(C[NH+]2CCC(c3ccccn3)CC2)c(F)c(F)c1F ZINC001235355455 1054707329 /nfs/dbraw/zinc/70/73/29/1054707329.db2.gz SHSHJUIPLHNFGT-UHFFFAOYSA-N 1 2 324.321 4.018 20 0 DIADLO Cc1cc(N)nc(SCc2ccc(SC(C)C)cc2)[nH+]1 ZINC000510277604 1054713751 /nfs/dbraw/zinc/71/37/51/1054713751.db2.gz SXXGAMJUSFIHSG-UHFFFAOYSA-N 1 2 305.472 4.160 20 0 DIADLO Cc1nc(C)c([C@@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)s1 ZINC000179918673 1054715248 /nfs/dbraw/zinc/71/52/48/1054715248.db2.gz JHUTUQKCQZAGRG-CYBMUJFWSA-N 1 2 316.474 4.318 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](C)c2cc(F)ccc2OC)cs1 ZINC000179935176 1054716091 /nfs/dbraw/zinc/71/60/91/1054716091.db2.gz BOUNEWSQZRBGKW-LBPRGKRZSA-N 1 2 322.449 4.484 20 0 DIADLO CC(C)n1cc([C@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)cn1 ZINC000179924092 1054716301 /nfs/dbraw/zinc/71/63/01/1054716301.db2.gz FWZWHPARQMNQBM-HNNXBMFYSA-N 1 2 313.449 4.022 20 0 DIADLO c1snnc1C[NH2+][C@H](CCc1ccccc1)c1ccccc1 ZINC000180135200 1054739509 /nfs/dbraw/zinc/73/95/09/1054739509.db2.gz VKTNBJNYGKZRFY-GOSISDBHSA-N 1 2 309.438 4.002 20 0 DIADLO Cc1nc([C@@H]([NH2+]CC2CCCCC2)c2ccc(Cl)cc2)no1 ZINC000180195409 1054740829 /nfs/dbraw/zinc/74/08/29/1054740829.db2.gz WFJJAJRIWVAEOY-INIZCTEOSA-N 1 2 319.836 4.291 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1cc(C)cc(Cl)c1)CC2 ZINC001235539128 1054741009 /nfs/dbraw/zinc/74/10/09/1054741009.db2.gz XKRMCLDOZJTYPA-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1cc(C)cc(Cl)c1)CC2 ZINC001235539128 1054741026 /nfs/dbraw/zinc/74/10/26/1054741026.db2.gz XKRMCLDOZJTYPA-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO CCCC[C@H](CC)CCCN(C)C(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC001453695060 1054745046 /nfs/dbraw/zinc/74/50/46/1054745046.db2.gz OOWDCJKPKUWFHG-KRWDZBQOSA-N 1 2 321.509 4.382 20 0 DIADLO C[C@@H]1CO[C@@H]2C[N@H+](Cc3cc(Cl)c(Cl)c(Cl)c3)C[C@H]12 ZINC001235598906 1054751728 /nfs/dbraw/zinc/75/17/28/1054751728.db2.gz RONNWHDNSOCTBH-ZDSQKVDBSA-N 1 2 320.647 4.114 20 0 DIADLO C[C@@H]1CO[C@@H]2C[N@@H+](Cc3cc(Cl)c(Cl)c(Cl)c3)C[C@H]12 ZINC001235598906 1054751745 /nfs/dbraw/zinc/75/17/45/1054751745.db2.gz RONNWHDNSOCTBH-ZDSQKVDBSA-N 1 2 320.647 4.114 20 0 DIADLO Clc1cc(C[N@@H+]2CC[C@]3(CCCO3)C2)cc(Cl)c1Cl ZINC001235590460 1054746934 /nfs/dbraw/zinc/74/69/34/1054746934.db2.gz JIQDDMPSZHIHFL-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1cc(C[N@H+]2CC[C@]3(CCCO3)C2)cc(Cl)c1Cl ZINC001235590460 1054746953 /nfs/dbraw/zinc/74/69/53/1054746953.db2.gz JIQDDMPSZHIHFL-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2nccc(C)c2Cl)cc1 ZINC001235588625 1054748536 /nfs/dbraw/zinc/74/85/36/1054748536.db2.gz OHLDMNOFNUGJJX-ZDUSSCGKSA-N 1 2 304.821 4.245 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2nccc(C)c2Cl)cc1 ZINC001235588625 1054748549 /nfs/dbraw/zinc/74/85/49/1054748549.db2.gz OHLDMNOFNUGJJX-ZDUSSCGKSA-N 1 2 304.821 4.245 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@]23CCOC3)cc(Cl)c1Cl ZINC001235599101 1054750965 /nfs/dbraw/zinc/75/09/65/1054750965.db2.gz VDWFSAONFPWKDT-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@]23CCOC3)cc(Cl)c1Cl ZINC001235599101 1054750981 /nfs/dbraw/zinc/75/09/81/1054750981.db2.gz VDWFSAONFPWKDT-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO F[C@@H]1CCC[N@H+](Cc2ccccc2-c2ccncc2)CC1(F)F ZINC001235610769 1054753204 /nfs/dbraw/zinc/75/32/04/1054753204.db2.gz DFRZEAQIBVOMHZ-QGZVFWFLSA-N 1 2 320.358 4.318 20 0 DIADLO F[C@@H]1CCC[N@@H+](Cc2ccccc2-c2ccncc2)CC1(F)F ZINC001235610769 1054753220 /nfs/dbraw/zinc/75/32/20/1054753220.db2.gz DFRZEAQIBVOMHZ-QGZVFWFLSA-N 1 2 320.358 4.318 20 0 DIADLO FC1(F)CCCC[N@H+](Cc2ccccc2-c2ccncc2)C1 ZINC001235612153 1054755009 /nfs/dbraw/zinc/75/50/09/1054755009.db2.gz LSUAKULQXIOUFC-UHFFFAOYSA-N 1 2 302.368 4.370 20 0 DIADLO FC1(F)CCCC[N@@H+](Cc2ccccc2-c2ccncc2)C1 ZINC001235612153 1054755022 /nfs/dbraw/zinc/75/50/22/1054755022.db2.gz LSUAKULQXIOUFC-UHFFFAOYSA-N 1 2 302.368 4.370 20 0 DIADLO CCCCCC[C@H](CC)CN(C)C(=O)C(C)(C)n1c[nH+]c(C)c1 ZINC001454018530 1054756529 /nfs/dbraw/zinc/75/65/29/1054756529.db2.gz MKVLYVZXYWOSIY-KRWDZBQOSA-N 1 2 321.509 4.382 20 0 DIADLO CC(C)(C)OC(=O)n1cccc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC001235641798 1054759701 /nfs/dbraw/zinc/75/97/01/1054759701.db2.gz IYFDXFWCPIUKKH-KRWDZBQOSA-N 1 2 312.413 4.218 20 0 DIADLO CC(C)(C)OC(=O)n1cccc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC001235641798 1054759713 /nfs/dbraw/zinc/75/97/13/1054759713.db2.gz IYFDXFWCPIUKKH-KRWDZBQOSA-N 1 2 312.413 4.218 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCCC[C@H]1c1cc(C)[nH]n1 ZINC001473828114 1054760253 /nfs/dbraw/zinc/76/02/53/1054760253.db2.gz JQKOFVREWHNPGG-INIZCTEOSA-N 1 2 301.459 4.167 20 0 DIADLO CSc1ccccc1C[N@H+]1CCCC[C@H]1c1cc(C)[nH]n1 ZINC001473828114 1054760271 /nfs/dbraw/zinc/76/02/71/1054760271.db2.gz JQKOFVREWHNPGG-INIZCTEOSA-N 1 2 301.459 4.167 20 0 DIADLO C[N@H+](Cc1cccc2ccccc21)Cc1c(N)ccnc1Cl ZINC001235663754 1054764491 /nfs/dbraw/zinc/76/44/91/1054764491.db2.gz TZNVRSCQXFUOPC-UHFFFAOYSA-N 1 2 311.816 4.102 20 0 DIADLO C[N@@H+](Cc1cccc2ccccc21)Cc1c(N)ccnc1Cl ZINC001235663754 1054764500 /nfs/dbraw/zinc/76/45/00/1054764500.db2.gz TZNVRSCQXFUOPC-UHFFFAOYSA-N 1 2 311.816 4.102 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)C12CC3CC(CC(C3)C1)C2 ZINC000623791888 1054764925 /nfs/dbraw/zinc/76/49/25/1054764925.db2.gz PHCFGFWJLUCLEC-UHFFFAOYSA-N 1 2 321.424 4.232 20 0 DIADLO Nc1nccc(Cl)c1C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC001235673186 1054768151 /nfs/dbraw/zinc/76/81/51/1054768151.db2.gz CUBKXMVTYILFBS-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nccc(Cl)c1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC001235673186 1054768164 /nfs/dbraw/zinc/76/81/64/1054768164.db2.gz CUBKXMVTYILFBS-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO C[N@H+](CCc1ccc(Cl)cc1)Cc1nc2ccc(F)cc2[nH]1 ZINC001235696238 1054781748 /nfs/dbraw/zinc/78/17/48/1054781748.db2.gz HVIGGSOXQMDMMU-UHFFFAOYSA-N 1 2 317.795 4.030 20 0 DIADLO C[N@@H+](CCc1ccc(Cl)cc1)Cc1nc2ccc(F)cc2[nH]1 ZINC001235696238 1054781761 /nfs/dbraw/zinc/78/17/61/1054781761.db2.gz HVIGGSOXQMDMMU-UHFFFAOYSA-N 1 2 317.795 4.030 20 0 DIADLO Nc1ccc(Cl)nc1C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC001235694117 1054783813 /nfs/dbraw/zinc/78/38/13/1054783813.db2.gz LWQIGXNWMZYUAH-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccc(Cl)nc1C[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC001235694117 1054783825 /nfs/dbraw/zinc/78/38/25/1054783825.db2.gz LWQIGXNWMZYUAH-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO CCn1ccnc1CNc1[nH+]c2ccccc2n1C1CCCCC1 ZINC000525876335 1054784545 /nfs/dbraw/zinc/78/45/45/1054784545.db2.gz QHLLKORCRVSTDG-UHFFFAOYSA-N 1 2 323.444 4.370 20 0 DIADLO CCC/C(C)=C\C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001349682080 1054786106 /nfs/dbraw/zinc/78/61/06/1054786106.db2.gz LAILHFFWPQVASS-UVQBRAAOSA-N 1 2 317.477 4.091 20 0 DIADLO Cc1ccc(Br)c(C[N@H+]2C[C@@H](C)C[C@H]2CF)c1F ZINC001235741591 1054794663 /nfs/dbraw/zinc/79/46/63/1054794663.db2.gz IIHYUBLVPCNFGB-ONGXEEELSA-N 1 2 318.205 4.077 20 0 DIADLO COc1ccccc1C[NH2+]C1(c2c(F)cccc2F)CCC1 ZINC000623843378 1054788610 /nfs/dbraw/zinc/78/86/10/1054788610.db2.gz JSTAVMCTSIUTGQ-UHFFFAOYSA-N 1 2 303.352 4.142 20 0 DIADLO CC(C)O[C@@H]1CC[N@H+](Cc2c(F)cc(Cl)cc2Cl)C1 ZINC001235743131 1054794012 /nfs/dbraw/zinc/79/40/12/1054794012.db2.gz QFUMDMRHGMRHRY-LLVKDONJSA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@@H]1CC[N@@H+](Cc2c(F)cc(Cl)cc2Cl)C1 ZINC001235743131 1054794026 /nfs/dbraw/zinc/79/40/26/1054794026.db2.gz QFUMDMRHGMRHRY-LLVKDONJSA-N 1 2 306.208 4.132 20 0 DIADLO Cc1ccc(Br)c(C[N@@H+]2C[C@@H](C)C[C@H]2CF)c1F ZINC001235741591 1054794652 /nfs/dbraw/zinc/79/46/52/1054794652.db2.gz IIHYUBLVPCNFGB-ONGXEEELSA-N 1 2 318.205 4.077 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2c(F)cc(Cl)cc2Cl)[C@H](C)C1 ZINC001235740707 1054794819 /nfs/dbraw/zinc/79/48/19/1054794819.db2.gz BQISLLMTCPZJOX-KOLCDFICSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2c(F)cc(Cl)cc2Cl)[C@H](C)C1 ZINC001235740707 1054794832 /nfs/dbraw/zinc/79/48/32/1054794832.db2.gz BQISLLMTCPZJOX-KOLCDFICSA-N 1 2 306.208 4.132 20 0 DIADLO COC[C@H]1CCCC[N@@H+]1Cc1c(F)cc(Cl)cc1Cl ZINC001235742243 1054796430 /nfs/dbraw/zinc/79/64/30/1054796430.db2.gz VJQZASLEZIWYMM-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO COC[C@H]1CCCC[N@H+]1Cc1c(F)cc(Cl)cc1Cl ZINC001235742243 1054796443 /nfs/dbraw/zinc/79/64/43/1054796443.db2.gz VJQZASLEZIWYMM-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@H](c2nc3ccccc3[nH]2)C(C)C)n1 ZINC000623873724 1054796851 /nfs/dbraw/zinc/79/68/51/1054796851.db2.gz PTVZPEGQUPLXHH-DOMZBBRYSA-N 1 2 314.458 4.376 20 0 DIADLO CCO[C@H]1CCC[N@H+](Cc2c(F)cc(Cl)cc2Cl)C1 ZINC001235748403 1054797788 /nfs/dbraw/zinc/79/77/88/1054797788.db2.gz ZCJCGZMTYHRBTJ-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@H]1CCC[N@@H+](Cc2c(F)cc(Cl)cc2Cl)C1 ZINC001235748403 1054797804 /nfs/dbraw/zinc/79/78/04/1054797804.db2.gz ZCJCGZMTYHRBTJ-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO COc1cccc2c1OCC[C@H]2Nc1cc(C)c2ccccc2[nH+]1 ZINC001349823612 1054802712 /nfs/dbraw/zinc/80/27/12/1054802712.db2.gz NPBBXJVVANAYMB-QGZVFWFLSA-N 1 2 320.392 4.488 20 0 DIADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccc(OCc2ccccc2)c(F)c1 ZINC001235765803 1054804423 /nfs/dbraw/zinc/80/44/23/1054804423.db2.gz RKAQHKIQLCVKAW-RHSMWYFYSA-N 1 2 317.379 4.337 20 0 DIADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccc(OCc2ccccc2)c(F)c1 ZINC001235765803 1054804438 /nfs/dbraw/zinc/80/44/38/1054804438.db2.gz RKAQHKIQLCVKAW-RHSMWYFYSA-N 1 2 317.379 4.337 20 0 DIADLO c1nc2c(s1)CCC[C@@H]2[NH2+]Cc1ccccc1OCC1CC1 ZINC000623897165 1054804539 /nfs/dbraw/zinc/80/45/39/1054804539.db2.gz HVODZSJVXRRMOO-HNNXBMFYSA-N 1 2 314.454 4.099 20 0 DIADLO CC(C)(C)[C@@H]1CCC[N@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001474473974 1054811847 /nfs/dbraw/zinc/81/18/47/1054811847.db2.gz HCMHLXQDZWWDJE-SNVBAGLBSA-N 1 2 306.397 4.420 20 0 DIADLO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001474473974 1054811856 /nfs/dbraw/zinc/81/18/56/1054811856.db2.gz HCMHLXQDZWWDJE-SNVBAGLBSA-N 1 2 306.397 4.420 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001235813988 1054811952 /nfs/dbraw/zinc/81/19/52/1054811952.db2.gz FCXCZMISFMHXOY-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(F)ccc1C[N@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001235813988 1054811960 /nfs/dbraw/zinc/81/19/60/1054811960.db2.gz FCXCZMISFMHXOY-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO c1cc2cccc(CNc3ccc(N4CCCCC4)c[nH+]3)c2[nH]1 ZINC000532870271 1054812291 /nfs/dbraw/zinc/81/22/91/1054812291.db2.gz REPVFOHOCHLWPG-UHFFFAOYSA-N 1 2 306.413 4.165 20 0 DIADLO c1nc2c(s1)CCC[C@H]2[NH2+]Cc1ccccc1OC1CCC1 ZINC000623915383 1054817729 /nfs/dbraw/zinc/81/77/29/1054817729.db2.gz FLFKGJPLAUQQBA-OAHLLOKOSA-N 1 2 314.454 4.242 20 0 DIADLO C[C@@H](Nc1[nH+]c2ccccc2n1C)c1cccc(OC(F)F)c1 ZINC000536501824 1054827047 /nfs/dbraw/zinc/82/70/47/1054827047.db2.gz JLKAEDYDNDHEJJ-LLVKDONJSA-N 1 2 317.339 4.348 20 0 DIADLO Clc1ccc2sc(NCc3cccc4[nH+]ccn43)nc2c1 ZINC000537507104 1054838913 /nfs/dbraw/zinc/83/89/13/1054838913.db2.gz QURHLBLLIUXYBL-UHFFFAOYSA-N 1 2 314.801 4.210 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1nc(C)cs1)c1cccc(Cl)c1 ZINC000623985027 1054839374 /nfs/dbraw/zinc/83/93/74/1054839374.db2.gz BVWQQDZPLFCGBP-BXUZGUMPSA-N 1 2 310.850 4.143 20 0 DIADLO COC[C@H]([NH2+][C@H]1CCCc2scnc21)c1ccc(Cl)cc1 ZINC000623972251 1054842251 /nfs/dbraw/zinc/84/22/51/1054842251.db2.gz XADBBLJYKGCTSL-KBPBESRZSA-N 1 2 322.861 4.151 20 0 DIADLO CC[C@@H]([NH2+][C@@H](CCc1ccccc1)C(F)F)c1ccncc1 ZINC000624124630 1054887536 /nfs/dbraw/zinc/88/75/36/1054887536.db2.gz HYKJANIQAJCZCC-SJORKVTESA-N 1 2 304.384 4.389 20 0 DIADLO CCC(F)(F)C(C)(C)C[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1 ZINC000624156205 1054892529 /nfs/dbraw/zinc/89/25/29/1054892529.db2.gz UIZIFJWTYBHZHV-CYBMUJFWSA-N 1 2 314.424 4.087 20 0 DIADLO Fc1ccc(F)c([C@H]([NH2+][C@H]2CCOC2)c2ccccc2Cl)c1 ZINC000181165529 1054905569 /nfs/dbraw/zinc/90/55/69/1054905569.db2.gz QXRMLXDGAQPIDE-YVEFUNNKSA-N 1 2 323.770 4.086 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1cccc2ccccc21 ZINC000181667251 1054926792 /nfs/dbraw/zinc/92/67/92/1054926792.db2.gz XDSFSOWKGTZALH-CYBMUJFWSA-N 1 2 309.413 4.371 20 0 DIADLO CCC[C@@H]([NH2+]Cc1cn2ccsc2n1)c1ccc(F)cc1F ZINC000181681968 1054929973 /nfs/dbraw/zinc/92/99/73/1054929973.db2.gz LHISAPINKHNRKJ-OAHLLOKOSA-N 1 2 321.396 4.305 20 0 DIADLO CC[N@H+](CC1CCN(C(=O)C(C)(C)C)CC1)c1ccccc1C ZINC000181751298 1054934140 /nfs/dbraw/zinc/93/41/40/1054934140.db2.gz CMUNTWCELBZULR-UHFFFAOYSA-N 1 2 316.489 4.106 20 0 DIADLO CC[N@@H+](CC1CCN(C(=O)C(C)(C)C)CC1)c1ccccc1C ZINC000181751298 1054934145 /nfs/dbraw/zinc/93/41/45/1054934145.db2.gz CMUNTWCELBZULR-UHFFFAOYSA-N 1 2 316.489 4.106 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nc(Cc2ccccc2)no1)c1ccccc1 ZINC000181778847 1054936335 /nfs/dbraw/zinc/93/63/35/1054936335.db2.gz FNRVCDMOQRJTJN-GOSISDBHSA-N 1 2 321.424 4.291 20 0 DIADLO O=C(CC[NH+](Cc1ccco1)Cc1ccco1)c1ccccc1 ZINC000181931359 1054947644 /nfs/dbraw/zinc/94/76/44/1054947644.db2.gz PWRWAZIKDFLSTD-UHFFFAOYSA-N 1 2 309.365 4.148 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1N)Cc1c(F)cccc1Cl ZINC001236105130 1054949895 /nfs/dbraw/zinc/94/98/95/1054949895.db2.gz SYZKFBGZGJNAKJ-UHFFFAOYSA-N 1 2 322.811 4.092 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1N)Cc1c(F)cccc1Cl ZINC001236105130 1054949914 /nfs/dbraw/zinc/94/99/14/1054949914.db2.gz SYZKFBGZGJNAKJ-UHFFFAOYSA-N 1 2 322.811 4.092 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ncc(Cl)cc2Cl)cc1 ZINC000181993575 1054953543 /nfs/dbraw/zinc/95/35/43/1054953543.db2.gz SDIAAZHNHAIYDG-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ncc(Cl)cc2Cl)cc1 ZINC000181993575 1054953560 /nfs/dbraw/zinc/95/35/60/1054953560.db2.gz SDIAAZHNHAIYDG-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nc(CCc3ccccc3)no2)cc1 ZINC000182349151 1054982059 /nfs/dbraw/zinc/98/20/59/1054982059.db2.gz SRNYXVBJHHPWCZ-MRXNPFEDSA-N 1 2 321.424 4.014 20 0 DIADLO CC[C@H](C)c1ccc(C(=O)NC[C@H]2c3ccccc3C[N@H+]2C)cc1 ZINC001535620604 1054991593 /nfs/dbraw/zinc/99/15/93/1054991593.db2.gz TVWGKSMAPVHLKB-YWZLYKJASA-N 1 2 322.452 4.117 20 0 DIADLO CC[C@H](C)c1ccc(C(=O)NC[C@H]2c3ccccc3C[N@@H+]2C)cc1 ZINC001535620604 1054991604 /nfs/dbraw/zinc/99/16/04/1054991604.db2.gz TVWGKSMAPVHLKB-YWZLYKJASA-N 1 2 322.452 4.117 20 0 DIADLO CC(C)(C)[C@@H]1C[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001535692328 1055000188 /nfs/dbraw/zinc/00/01/88/1055000188.db2.gz KBAXKMCUMOONHL-CHWSQXEVSA-N 1 2 317.820 4.146 20 0 DIADLO FC(F)(F)c1cc(C[NH2+][C@@H]2CCCc3scnc32)cs1 ZINC000624261071 1055009479 /nfs/dbraw/zinc/00/94/79/1055009479.db2.gz HGQIYLHTZURXTL-SECBINFHSA-N 1 2 318.389 4.391 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc(-n3cc[nH+]c3)c(F)c2)cc1 ZINC000182913334 1055015955 /nfs/dbraw/zinc/01/59/55/1055015955.db2.gz RVYNQPPOOYQATC-CYBMUJFWSA-N 1 2 311.360 4.193 20 0 DIADLO CC(C)Oc1c(F)c(F)c(-c2cccc3[nH+]ccn32)c(F)c1F ZINC001236226871 1055017866 /nfs/dbraw/zinc/01/78/66/1055017866.db2.gz ZFOCLYBXUJVQAD-UHFFFAOYSA-N 1 2 324.277 4.345 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC=C(c3ccc(O)cc3)CC2)s1 ZINC000182967874 1055019762 /nfs/dbraw/zinc/01/97/62/1055019762.db2.gz BPXITSJYSSTXMD-UHFFFAOYSA-N 1 2 314.454 4.261 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)s1 ZINC000182967874 1055019775 /nfs/dbraw/zinc/01/97/75/1055019775.db2.gz BPXITSJYSSTXMD-UHFFFAOYSA-N 1 2 314.454 4.261 20 0 DIADLO Nc1ccc2c(c1)C[N@@H+](Cc1cc(Cl)cc(Cl)c1)CC2 ZINC001236230839 1055022224 /nfs/dbraw/zinc/02/22/24/1055022224.db2.gz BZSOHGWSCBSLLE-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1ccc2c(c1)C[N@H+](Cc1cc(Cl)cc(Cl)c1)CC2 ZINC001236230839 1055022238 /nfs/dbraw/zinc/02/22/38/1055022238.db2.gz BZSOHGWSCBSLLE-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO CC(=O)Nc1cccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c1 ZINC000183353831 1055042772 /nfs/dbraw/zinc/04/27/72/1055042772.db2.gz HHSNRTVUHCDDDY-HXUWFJFHSA-N 1 2 320.392 4.117 20 0 DIADLO Cc1c(F)cccc1-c1cccc(Cl)c1C[NH+]1CCOCC1 ZINC001236265514 1055043989 /nfs/dbraw/zinc/04/39/89/1055043989.db2.gz IHIARFKSGUBCPT-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccc(Cl)c3occc32)c[nH+]1 ZINC001536109339 1055048461 /nfs/dbraw/zinc/04/84/61/1055048461.db2.gz JOUFUQDAICFWFJ-UHFFFAOYSA-N 1 2 314.772 4.028 20 0 DIADLO COc1cc(C)ccc1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000183713474 1055054401 /nfs/dbraw/zinc/05/44/01/1055054401.db2.gz UKJUKCKEBSMHMY-HXUWFJFHSA-N 1 2 307.393 4.476 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+]Cc2nc(Cc3ccccc3)no2)c1C ZINC000183727369 1055057678 /nfs/dbraw/zinc/05/76/78/1055057678.db2.gz JJGDPQHQWAFDBK-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO CC[C@@](C)([NH2+]Cc1ncc(C(C)C)s1)c1nc(C)cs1 ZINC000183817171 1055059498 /nfs/dbraw/zinc/05/94/98/1055059498.db2.gz BTHBXKJPFPFACP-OAHLLOKOSA-N 1 2 309.504 4.446 20 0 DIADLO Cc1cn2c(cccc2-c2ccc(F)c(OC(C)C)c2F)[nH+]1 ZINC001236339738 1055066958 /nfs/dbraw/zinc/06/69/58/1055066958.db2.gz CAODDQXXTMRBDZ-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Cc1cc(-c2ccc(F)c(OC(C)C)c2F)cn2cc[nH+]c12 ZINC001236357847 1055070256 /nfs/dbraw/zinc/07/02/56/1055070256.db2.gz FUZUONAJDVALAT-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO C[C@H]([NH2+]Cc1ccncc1Cl)c1nc(C(C)(C)C)cs1 ZINC000184459873 1055076332 /nfs/dbraw/zinc/07/63/32/1055076332.db2.gz JMVWNIXTDVZUGH-JTQLQIEISA-N 1 2 309.866 4.340 20 0 DIADLO COC[C@@H]([NH2+]C1c2ccccc2-c2ccccc21)c1ccco1 ZINC000184582254 1055079925 /nfs/dbraw/zinc/07/99/25/1055079925.db2.gz LOLPJYWEKJNHIT-GOSISDBHSA-N 1 2 305.377 4.327 20 0 DIADLO COc1cc(OC(F)(F)F)ccc1-c1ccc2[nH+]c(C)cn2c1 ZINC001236383250 1055086554 /nfs/dbraw/zinc/08/65/54/1055086554.db2.gz SRJBZGKZGVVLSE-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO COc1cc(OC(F)(F)F)ccc1-c1cc(C)c2[nH+]ccn2c1 ZINC001236382800 1055086666 /nfs/dbraw/zinc/08/66/66/1055086666.db2.gz ONNRRQABGWYQHA-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000185409862 1055090669 /nfs/dbraw/zinc/09/06/69/1055090669.db2.gz HQNODFACQCBFBC-CVEARBPZSA-N 1 2 321.424 4.381 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2nc3ccccc3s2)C2CC2)s1 ZINC000185290434 1055090744 /nfs/dbraw/zinc/09/07/44/1055090744.db2.gz TVYKFKAVFXLIOI-HNNXBMFYSA-N 1 2 315.467 4.302 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c(C)s1 ZINC000193133557 1055099125 /nfs/dbraw/zinc/09/91/25/1055099125.db2.gz GDGXFLGKJJEKRR-QWRGUYRKSA-N 1 2 307.463 4.457 20 0 DIADLO CC[C@@H](C)c1ccc(C(=O)Nc2ccc(C)[nH+]c2N(C)C)cc1 ZINC001536522898 1055122649 /nfs/dbraw/zinc/12/26/49/1055122649.db2.gz GZYPPBXMRGTXKP-CYBMUJFWSA-N 1 2 311.429 4.222 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccccc2)c[nH]1)c1cccc(F)c1F ZINC000194404606 1055124804 /nfs/dbraw/zinc/12/48/04/1055124804.db2.gz GBTQOVUZFKTVPK-LBPRGKRZSA-N 1 2 313.351 4.206 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(NC(C)C)cc1 ZINC001236486519 1055141948 /nfs/dbraw/zinc/14/19/48/1055141948.db2.gz NNQLLISWEZOJLH-UHFFFAOYSA-N 1 2 307.397 4.368 20 0 DIADLO CC[C@H](OC(=O)CCCn1cc[nH+]c1)c1c(F)cccc1Cl ZINC000764275568 1055144970 /nfs/dbraw/zinc/14/49/70/1055144970.db2.gz SJEZXDVLYQOTLP-AWEZNQCLSA-N 1 2 324.783 4.150 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3nccnc3Cl)CC2)cc1 ZINC001236612049 1055204892 /nfs/dbraw/zinc/20/48/92/1055204892.db2.gz CAYKDILNASOAOZ-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3nccnc3Cl)CC2)cc1 ZINC001236612049 1055204897 /nfs/dbraw/zinc/20/48/97/1055204897.db2.gz CAYKDILNASOAOZ-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO CC1(C)CC[NH+](Cc2cnc(Cl)c(C(F)(F)F)c2)CC1 ZINC001236633561 1055208797 /nfs/dbraw/zinc/20/87/97/1055208797.db2.gz GEIJNRYWZOTQGI-UHFFFAOYSA-N 1 2 306.759 4.376 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@H](c2ccccc2)c2cccc(F)c2)o1 ZINC001620835392 1055224944 /nfs/dbraw/zinc/22/49/44/1055224944.db2.gz HGKUTFZOPWVWHS-LJQANCHMSA-N 1 2 310.372 4.310 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCCC3(CCCC3)CC2)c(C)[nH+]1 ZINC001587197162 1055238608 /nfs/dbraw/zinc/23/86/08/1055238608.db2.gz NQLAZJDKOTYJSJ-UHFFFAOYSA-N 1 2 300.446 4.193 20 0 DIADLO Cc1c(F)ccc(C[N@H+](C)Cc2ccc(Cl)nc2)c1Cl ZINC001236720096 1055239329 /nfs/dbraw/zinc/23/93/29/1055239329.db2.gz WOJYQULIIUNWTD-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1c(F)ccc(C[N@@H+](C)Cc2ccc(Cl)nc2)c1Cl ZINC001236720096 1055239341 /nfs/dbraw/zinc/23/93/41/1055239341.db2.gz WOJYQULIIUNWTD-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO CC[C@@H](NC(=O)Nc1cc(C)[nH+]cc1C)c1cc(C)ccc1C ZINC001562518407 1055241974 /nfs/dbraw/zinc/24/19/74/1055241974.db2.gz LGMFFBBNOKVSLT-QGZVFWFLSA-N 1 2 311.429 4.010 20 0 DIADLO CC(C)(C)c1ccc(NC(=O)c2cccc3[nH+]ccn32)cc1F ZINC001537244635 1055263692 /nfs/dbraw/zinc/26/36/92/1055263692.db2.gz YNDMRIITQFTTAM-UHFFFAOYSA-N 1 2 311.360 4.023 20 0 DIADLO Cc1cccc(C)c1-c1cccc(C[N@@H+](C)Cc2ncccn2)c1 ZINC001236822711 1055277486 /nfs/dbraw/zinc/27/74/86/1055277486.db2.gz JLQQZNMKDSELJM-UHFFFAOYSA-N 1 2 317.436 4.392 20 0 DIADLO Cc1cccc(C)c1-c1cccc(C[N@H+](C)Cc2ncccn2)c1 ZINC001236822711 1055277501 /nfs/dbraw/zinc/27/75/01/1055277501.db2.gz JLQQZNMKDSELJM-UHFFFAOYSA-N 1 2 317.436 4.392 20 0 DIADLO Cc1cc(Br)sc1C[N@@H+]1CCCC[C@@H](F)C1 ZINC001236830175 1055280650 /nfs/dbraw/zinc/28/06/50/1055280650.db2.gz RGQJWTDIIJQWIJ-SNVBAGLBSA-N 1 2 306.244 4.143 20 0 DIADLO Cc1cc(Br)sc1C[N@H+]1CCCC[C@@H](F)C1 ZINC001236830175 1055280659 /nfs/dbraw/zinc/28/06/59/1055280659.db2.gz RGQJWTDIIJQWIJ-SNVBAGLBSA-N 1 2 306.244 4.143 20 0 DIADLO Fc1cc(C[N@@H+]2CCC23CCCC3)cc(Br)c1F ZINC001236849200 1055291673 /nfs/dbraw/zinc/29/16/73/1055291673.db2.gz WWBDRDFUIVJXQK-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1cc(C[N@H+]2CCC23CCCC3)cc(Br)c1F ZINC001236849200 1055291680 /nfs/dbraw/zinc/29/16/80/1055291680.db2.gz WWBDRDFUIVJXQK-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@H](C)c1ccc(F)cc1F)CCC2 ZINC000764939854 1055294100 /nfs/dbraw/zinc/29/41/00/1055294100.db2.gz MNKWTLZSJVVDAJ-SJKOYZFVSA-N 1 2 319.399 4.470 20 0 DIADLO Cc1ccc(-c2cncc(C[N@@H+]3CC[C@](C)(F)[C@@H](F)C3)c2)cc1 ZINC001236990504 1055330119 /nfs/dbraw/zinc/33/01/19/1055330119.db2.gz HLFMNDWEKUAZMK-OALUTQOASA-N 1 2 316.395 4.329 20 0 DIADLO Cc1ccc(-c2cncc(C[N@H+]3CC[C@](C)(F)[C@@H](F)C3)c2)cc1 ZINC001236990504 1055330132 /nfs/dbraw/zinc/33/01/32/1055330132.db2.gz HLFMNDWEKUAZMK-OALUTQOASA-N 1 2 316.395 4.329 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cncc(-c2ccc(F)cc2)c1 ZINC001237002318 1055333217 /nfs/dbraw/zinc/33/32/17/1055333217.db2.gz QNIFKGMDFUDSGO-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cncc(-c2ccc(F)cc2)c1 ZINC001237002318 1055333233 /nfs/dbraw/zinc/33/32/33/1055333233.db2.gz QNIFKGMDFUDSGO-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO Cc1ccc(-c2cncc(C[N@@H+]3CCn4cccc4[C@@H]3C)c2)cc1 ZINC001237003768 1055338155 /nfs/dbraw/zinc/33/81/55/1055338155.db2.gz UMZGBCAWYYKQCY-KRWDZBQOSA-N 1 2 317.436 4.435 20 0 DIADLO Cc1ccc(-c2cncc(C[N@H+]3CCn4cccc4[C@@H]3C)c2)cc1 ZINC001237003768 1055338170 /nfs/dbraw/zinc/33/81/70/1055338170.db2.gz UMZGBCAWYYKQCY-KRWDZBQOSA-N 1 2 317.436 4.435 20 0 DIADLO CC(C)(C)Oc1ccccc1C[N@@H+]1CCC(=O)[C@@H]2CCCC[C@H]21 ZINC001237026114 1055341828 /nfs/dbraw/zinc/34/18/28/1055341828.db2.gz KSBXZLHJRDYPED-IAGOWNOFSA-N 1 2 315.457 4.198 20 0 DIADLO CC(C)(C)Oc1ccccc1C[N@H+]1CCC(=O)[C@@H]2CCCC[C@H]21 ZINC001237026114 1055341843 /nfs/dbraw/zinc/34/18/43/1055341843.db2.gz KSBXZLHJRDYPED-IAGOWNOFSA-N 1 2 315.457 4.198 20 0 DIADLO Clc1ccc2c(c1Cl)OCC[C@@H]2[NH2+]Cc1nccs1 ZINC000765242616 1055343952 /nfs/dbraw/zinc/34/39/52/1055343952.db2.gz GZZPEEHLXJZAOU-JTQLQIEISA-N 1 2 315.225 4.063 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccccc1OC(C)(C)C)C2 ZINC001237032160 1055347979 /nfs/dbraw/zinc/34/79/79/1055347979.db2.gz PZPPHVIWOCYYLS-UHFFFAOYSA-N 1 2 311.425 4.388 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccccc1OC(C)(C)C)C2 ZINC001237032160 1055347994 /nfs/dbraw/zinc/34/79/94/1055347994.db2.gz PZPPHVIWOCYYLS-UHFFFAOYSA-N 1 2 311.425 4.388 20 0 DIADLO Cc1c2cc(C)c(C)cc2sc1C(=O)Nc1cc[nH+]c(C)c1 ZINC001537535297 1055350803 /nfs/dbraw/zinc/35/08/03/1055350803.db2.gz PVZLMQFFIXSKDW-UHFFFAOYSA-N 1 2 310.422 4.204 20 0 DIADLO Cc1cc(NC(=O)c2cc3c(ccc4ccccc34)o2)c(C)c[nH+]1 ZINC001537540835 1055353554 /nfs/dbraw/zinc/35/35/54/1055353554.db2.gz YABVJTLYKAXOQM-UHFFFAOYSA-N 1 2 316.360 4.272 20 0 DIADLO Cc1cc(NC(=O)[C@@H](CC2CCCCC2)C(C)C)c(C)c[nH+]1 ZINC001537540142 1055353886 /nfs/dbraw/zinc/35/38/86/1055353886.db2.gz MSIUUKAXSGMKSY-KRWDZBQOSA-N 1 2 302.462 4.301 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N[C@H](c3cccc(C)c3)C(C)C)ccn12 ZINC001587756428 1055359661 /nfs/dbraw/zinc/35/96/61/1055359661.db2.gz DVVFFGMIXIXZAR-IBGZPJMESA-N 1 2 321.424 4.078 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@H](C)c3cc(F)ccc3C)ccn12 ZINC001537555190 1055359693 /nfs/dbraw/zinc/35/96/93/1055359693.db2.gz NKOALNWKMUHONL-CYBMUJFWSA-N 1 2 312.344 4.008 20 0 DIADLO CNc1ccc(Nc2c(N)cc(C(F)(F)F)cc2Cl)c[nH+]1 ZINC001203456727 1055360372 /nfs/dbraw/zinc/36/03/72/1055360372.db2.gz SUVMHBGDDQIZIR-UHFFFAOYSA-N 1 2 316.714 4.121 20 0 DIADLO CCC[C@H](C(=O)Nc1c(C)c[nH+]cc1C)c1cccc(Cl)c1 ZINC001537609713 1055380475 /nfs/dbraw/zinc/38/04/75/1055380475.db2.gz NPCZMCUJOKBCED-INIZCTEOSA-N 1 2 316.832 4.296 20 0 DIADLO Cc1nc2ccccc2nc1CNc1ccc([NH+]2CCCC2)cc1 ZINC000765453783 1055395227 /nfs/dbraw/zinc/39/52/27/1055395227.db2.gz SUHDLUCJWXAPGC-UHFFFAOYSA-N 1 2 318.424 4.151 20 0 DIADLO COC(=O)c1cccc2c1C[N@H+](Cc1ccc3cccccc1-3)C2 ZINC001237191345 1055399547 /nfs/dbraw/zinc/39/95/47/1055399547.db2.gz UBULEAPDEYYADY-UHFFFAOYSA-N 1 2 317.388 4.094 20 0 DIADLO COC(=O)c1cccc2c1C[N@@H+](Cc1ccc3cccccc1-3)C2 ZINC001237191345 1055399561 /nfs/dbraw/zinc/39/95/61/1055399561.db2.gz UBULEAPDEYYADY-UHFFFAOYSA-N 1 2 317.388 4.094 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)cc1F ZINC001587980735 1055408701 /nfs/dbraw/zinc/40/87/01/1055408701.db2.gz SDSMXZMCBCLVQU-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO FC(F)Oc1cccc(Br)c1C[NH+]1CCCCC1 ZINC001237251918 1055409209 /nfs/dbraw/zinc/40/92/09/1055409209.db2.gz XUDHOZHEFZEUHK-UHFFFAOYSA-N 1 2 320.177 4.036 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1ccc2nccc(Cl)c2c1 ZINC001237272095 1055413063 /nfs/dbraw/zinc/41/30/63/1055413063.db2.gz HBFAIYCLJJQDFV-UHFFFAOYSA-N 1 2 324.811 4.203 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1ccc2nccc(Cl)c2c1 ZINC001237272095 1055413070 /nfs/dbraw/zinc/41/30/70/1055413070.db2.gz HBFAIYCLJJQDFV-UHFFFAOYSA-N 1 2 324.811 4.203 20 0 DIADLO COc1ccc2cc([C@H](C)C(=O)Nc3cc[nH+]c(C)c3)ccc2c1 ZINC000010163389 1055415523 /nfs/dbraw/zinc/41/55/23/1055415523.db2.gz DDNIRDSQGMUUQY-AWEZNQCLSA-N 1 2 320.392 4.294 20 0 DIADLO Oc1cc(F)cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1 ZINC001237284018 1055416478 /nfs/dbraw/zinc/41/64/78/1055416478.db2.gz QZBNFSROFIJWOY-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cc(O)cc(F)c1 ZINC001237288441 1055417875 /nfs/dbraw/zinc/41/78/75/1055417875.db2.gz YPQKCUDQBYRZGD-SFHVURJKSA-N 1 2 315.388 4.015 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cc(O)cc(F)c1 ZINC001237288441 1055417888 /nfs/dbraw/zinc/41/78/88/1055417888.db2.gz YPQKCUDQBYRZGD-SFHVURJKSA-N 1 2 315.388 4.015 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cc(Cl)cc(Cl)c3)cc2[nH+]1 ZINC000010896057 1055419602 /nfs/dbraw/zinc/41/96/02/1055419602.db2.gz WZWVOARPEACEPI-UHFFFAOYSA-N 1 2 320.179 4.430 20 0 DIADLO CC[C@@H]1CCC[N@H+]1Cc1c(F)ccc(Br)c1F ZINC000230341031 1055455888 /nfs/dbraw/zinc/45/58/88/1055455888.db2.gz MXOSUKPXRHMUSN-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)Cc3ccc4ccccc4c3)cc2[nH+]1 ZINC000010895896 1055420190 /nfs/dbraw/zinc/42/01/90/1055420190.db2.gz LVGUASZLBPZJCR-UHFFFAOYSA-N 1 2 315.376 4.206 20 0 DIADLO Cc1cc(F)cc(C)c1C[N@@H+]1CCc2nc(Cl)ccc2C1 ZINC001237320350 1055426496 /nfs/dbraw/zinc/42/64/96/1055426496.db2.gz DFUMLMZGSJCWBY-UHFFFAOYSA-N 1 2 304.796 4.049 20 0 DIADLO Cc1cc(F)cc(C)c1C[N@H+]1CCc2nc(Cl)ccc2C1 ZINC001237320350 1055426501 /nfs/dbraw/zinc/42/65/01/1055426501.db2.gz DFUMLMZGSJCWBY-UHFFFAOYSA-N 1 2 304.796 4.049 20 0 DIADLO CCc1cccc(C)c1C[N@@H+]1CCc2c([nH]nc2C(F)(F)F)C1 ZINC001237330304 1055428210 /nfs/dbraw/zinc/42/82/10/1055428210.db2.gz PENSMNPCHYCICN-MRXNPFEDSA-N 1 2 323.362 4.414 20 0 DIADLO CCc1cccc(C)c1C[N@H+]1CCc2c([nH]nc2C(F)(F)F)C1 ZINC001237330304 1055428214 /nfs/dbraw/zinc/42/82/14/1055428214.db2.gz PENSMNPCHYCICN-MRXNPFEDSA-N 1 2 323.362 4.414 20 0 DIADLO C[N@H+](Cc1cnc(-c2ccccc2)o1)Cc1nc2ccccc2o1 ZINC001237363644 1055441662 /nfs/dbraw/zinc/44/16/62/1055441662.db2.gz APIXOKBBWYZKBJ-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO C[N@@H+](Cc1cnc(-c2ccccc2)o1)Cc1nc2ccccc2o1 ZINC001237363644 1055441669 /nfs/dbraw/zinc/44/16/69/1055441669.db2.gz APIXOKBBWYZKBJ-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2cnc(Cl)c(F)c2)c1 ZINC001237403131 1055447672 /nfs/dbraw/zinc/44/76/72/1055447672.db2.gz DICOOMBLSXDAOG-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2cnc(Cl)c(F)c2)c1 ZINC001237403131 1055447678 /nfs/dbraw/zinc/44/76/78/1055447678.db2.gz DICOOMBLSXDAOG-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO Clc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc2ccccn2n1 ZINC001237444698 1055453029 /nfs/dbraw/zinc/45/30/29/1055453029.db2.gz ZMMVJWJXFHVPAH-SFHVURJKSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc2ccccn2n1 ZINC001237444698 1055453034 /nfs/dbraw/zinc/45/30/34/1055453034.db2.gz ZMMVJWJXFHVPAH-SFHVURJKSA-N 1 2 311.816 4.325 20 0 DIADLO CC[C@@H]1CCC[N@@H+]1Cc1c(F)ccc(Br)c1F ZINC000230341031 1055455883 /nfs/dbraw/zinc/45/58/83/1055455883.db2.gz MXOSUKPXRHMUSN-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO Oc1c(C[N@@H+]2CCC[C@@H]2c2ccccc2)cc(Cl)nc1Cl ZINC001237522804 1055467330 /nfs/dbraw/zinc/46/73/30/1055467330.db2.gz LYMAZLCIRBYYCR-CYBMUJFWSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1c(C[N@H+]2CCC[C@@H]2c2ccccc2)cc(Cl)nc1Cl ZINC001237522804 1055467335 /nfs/dbraw/zinc/46/73/35/1055467335.db2.gz LYMAZLCIRBYYCR-CYBMUJFWSA-N 1 2 323.223 4.431 20 0 DIADLO c1ccc(OC2C[NH+](Cc3cccc(-c4ccccc4)n3)C2)cc1 ZINC001237551172 1055475591 /nfs/dbraw/zinc/47/55/91/1055475591.db2.gz TWOQOVRYCFZUPD-UHFFFAOYSA-N 1 2 316.404 4.012 20 0 DIADLO Fc1cc(Cl)c(C[N@@H+]2CC[C@@H]3CCCO[C@H]3C2)c(Cl)c1 ZINC001237594780 1055482537 /nfs/dbraw/zinc/48/25/37/1055482537.db2.gz WWIUMWKOQQGRED-BONVTDFDSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1cc(Cl)c(C[N@H+]2CC[C@@H]3CCCO[C@H]3C2)c(Cl)c1 ZINC001237594780 1055482541 /nfs/dbraw/zinc/48/25/41/1055482541.db2.gz WWIUMWKOQQGRED-BONVTDFDSA-N 1 2 318.219 4.133 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3CCCC34CC4)cc2)[nH+]c1C ZINC001589467725 1055485175 /nfs/dbraw/zinc/48/51/75/1055485175.db2.gz XECYQPMXDLPSRU-MRXNPFEDSA-N 1 2 309.413 4.212 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-c3[nH]c(C)c(C)[nH+]3)cc2)oc1C ZINC001589439168 1055485343 /nfs/dbraw/zinc/48/53/43/1055485343.db2.gz YNPWJNHJCYEJEG-UHFFFAOYSA-N 1 2 309.369 4.156 20 0 DIADLO CO[C@@H]1CC[N@H+](Cc2c(Cl)cc(F)cc2Cl)[C@@H](C)C1 ZINC001237603592 1055485841 /nfs/dbraw/zinc/48/58/41/1055485841.db2.gz UCRFCRYSAQZBFX-GXSJLCMTSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@@H]1CC[N@@H+](Cc2c(Cl)cc(F)cc2Cl)[C@@H](C)C1 ZINC001237603592 1055485844 /nfs/dbraw/zinc/48/58/44/1055485844.db2.gz UCRFCRYSAQZBFX-GXSJLCMTSA-N 1 2 306.208 4.132 20 0 DIADLO Cc1coc(C[N@@H+]2CCSC[C@H]2c2cccc3ccccc32)n1 ZINC001237641033 1055491549 /nfs/dbraw/zinc/49/15/49/1055491549.db2.gz PRIZSOXDEKNYOA-SFHVURJKSA-N 1 2 324.449 4.426 20 0 DIADLO Cc1coc(C[N@H+]2CCSC[C@H]2c2cccc3ccccc32)n1 ZINC001237641033 1055491551 /nfs/dbraw/zinc/49/15/51/1055491551.db2.gz PRIZSOXDEKNYOA-SFHVURJKSA-N 1 2 324.449 4.426 20 0 DIADLO Cc1coc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3Cl)C2)n1 ZINC001237645457 1055494867 /nfs/dbraw/zinc/49/48/67/1055494867.db2.gz LFNPQMAJDSYDFJ-LLVKDONJSA-N 1 2 311.212 4.279 20 0 DIADLO Cc1coc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3Cl)C2)n1 ZINC001237645457 1055494873 /nfs/dbraw/zinc/49/48/73/1055494873.db2.gz LFNPQMAJDSYDFJ-LLVKDONJSA-N 1 2 311.212 4.279 20 0 DIADLO CNc1ccc(C)cc1CNc1ccc(N2CCCCC2)[nH+]c1 ZINC001620869187 1055495901 /nfs/dbraw/zinc/49/59/01/1055495901.db2.gz ISXOJZXVEOGRFU-UHFFFAOYSA-N 1 2 310.445 4.034 20 0 DIADLO COc1cc[nH+]cc1NCc1ccc(-c2ccccc2)cc1OC ZINC001620869586 1055496330 /nfs/dbraw/zinc/49/63/30/1055496330.db2.gz IKVIBNZPXSNONE-UHFFFAOYSA-N 1 2 320.392 4.378 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1nccc2c1CCCC2 ZINC001620887218 1055511343 /nfs/dbraw/zinc/51/13/43/1055511343.db2.gz QYFCPJFZOCIUQU-UHFFFAOYSA-N 1 2 311.429 4.145 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ncc(Cl)cc1Br ZINC001237752555 1055522720 /nfs/dbraw/zinc/52/27/20/1055522720.db2.gz HTSQUNFTSQKDGL-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ncc(Cl)cc1Br ZINC001237752555 1055522724 /nfs/dbraw/zinc/52/27/24/1055522724.db2.gz HTSQUNFTSQKDGL-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO Cc1cc(C[NH2+][C@@H]2COc3cc(F)cc(F)c32)ccc1Cl ZINC001620898793 1055524733 /nfs/dbraw/zinc/52/47/33/1055524733.db2.gz FPMQZAJWGOIWID-CQSZACIVSA-N 1 2 309.743 4.150 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1ncc(Cl)cc1Br ZINC001237758663 1055525860 /nfs/dbraw/zinc/52/58/60/1055525860.db2.gz BPMDBTOCSGNWQI-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1ncc(Cl)cc1Br ZINC001237758663 1055525872 /nfs/dbraw/zinc/52/58/72/1055525872.db2.gz BPMDBTOCSGNWQI-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1cnc(C3CC3)s1)CC2 ZINC001237791456 1055528955 /nfs/dbraw/zinc/52/89/55/1055528955.db2.gz LGKNKRKCKLYHJR-UHFFFAOYSA-N 1 2 304.846 4.232 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1cnc(C3CC3)s1)CC2 ZINC001237791456 1055528967 /nfs/dbraw/zinc/52/89/67/1055528967.db2.gz LGKNKRKCKLYHJR-UHFFFAOYSA-N 1 2 304.846 4.232 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c(Cl)n1 ZINC001237792300 1055529460 /nfs/dbraw/zinc/52/94/60/1055529460.db2.gz OTJGWSVIGCDFFA-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c(Cl)n1 ZINC001237792300 1055529472 /nfs/dbraw/zinc/52/94/72/1055529472.db2.gz OTJGWSVIGCDFFA-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nc(C)c3ccccc3n2)ccc1F ZINC000765635227 1055531078 /nfs/dbraw/zinc/53/10/78/1055531078.db2.gz OTMIFKUXRXMXKD-ZDUSSCGKSA-N 1 2 309.388 4.237 20 0 DIADLO Cc1cnc(C[N@@H+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)nc1 ZINC001237808681 1055532884 /nfs/dbraw/zinc/53/28/84/1055532884.db2.gz OEQJTOOBTZRWFF-ZDUSSCGKSA-N 1 2 322.239 4.081 20 0 DIADLO Cc1cnc(C[N@H+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)nc1 ZINC001237808681 1055532893 /nfs/dbraw/zinc/53/28/93/1055532893.db2.gz OEQJTOOBTZRWFF-ZDUSSCGKSA-N 1 2 322.239 4.081 20 0 DIADLO COc1ccc(F)cc1C[NH2+]Cc1c(F)ccc(F)c1Cl ZINC001620910102 1055533414 /nfs/dbraw/zinc/53/34/14/1055533414.db2.gz HXCBKZJNEUYAKC-UHFFFAOYSA-N 1 2 315.722 4.056 20 0 DIADLO Cc1cc(CNc2cc(-c3ccnn3C)ccc2C)cc(C)[nH+]1 ZINC001620916502 1055538822 /nfs/dbraw/zinc/53/88/22/1055538822.db2.gz UNAXJYXLJJELHO-UHFFFAOYSA-N 1 2 306.413 4.019 20 0 DIADLO CCc1ncc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)s1 ZINC001237827793 1055540430 /nfs/dbraw/zinc/54/04/30/1055540430.db2.gz WGZMXELSDHNPOP-HNNXBMFYSA-N 1 2 308.397 4.321 20 0 DIADLO CCc1ncc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)s1 ZINC001237827793 1055540431 /nfs/dbraw/zinc/54/04/31/1055540431.db2.gz WGZMXELSDHNPOP-HNNXBMFYSA-N 1 2 308.397 4.321 20 0 DIADLO C[N@H+](Cc1cccc(-c2ccccn2)n1)Cc1ccccc1Cl ZINC001237831578 1055540675 /nfs/dbraw/zinc/54/06/75/1055540675.db2.gz IVQABHHBMYSQDA-UHFFFAOYSA-N 1 2 323.827 4.429 20 0 DIADLO C[N@@H+](Cc1cccc(-c2ccccn2)n1)Cc1ccccc1Cl ZINC001237831578 1055540688 /nfs/dbraw/zinc/54/06/88/1055540688.db2.gz IVQABHHBMYSQDA-UHFFFAOYSA-N 1 2 323.827 4.429 20 0 DIADLO CC(C)([NH2+]Cc1cccc(COc2ccccc2)c1)C(F)F ZINC001620920598 1055543432 /nfs/dbraw/zinc/54/34/32/1055543432.db2.gz VLSPMKZJDHRHNN-UHFFFAOYSA-N 1 2 305.368 4.399 20 0 DIADLO CCCOCc1ccccc1C[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000921552626 1055545256 /nfs/dbraw/zinc/54/52/56/1055545256.db2.gz XMLMWUJLXKXCNC-UHFFFAOYSA-N 1 2 316.445 4.189 20 0 DIADLO CC[N@H+](Cc1cnc(C(F)(F)F)s1)Cc1ccc(F)cc1 ZINC001237952095 1055564362 /nfs/dbraw/zinc/56/43/62/1055564362.db2.gz LWEAQAULZZXQKO-UHFFFAOYSA-N 1 2 318.339 4.323 20 0 DIADLO CC[N@@H+](Cc1cnc(C(F)(F)F)s1)Cc1ccc(F)cc1 ZINC001237952095 1055564371 /nfs/dbraw/zinc/56/43/71/1055564371.db2.gz LWEAQAULZZXQKO-UHFFFAOYSA-N 1 2 318.339 4.323 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(Cl)c(C)c2Cl)cs1 ZINC000921564364 1055566683 /nfs/dbraw/zinc/56/66/83/1055566683.db2.gz QGRJWCNOIGJOLI-UHFFFAOYSA-N 1 2 301.242 4.357 20 0 DIADLO Cc1sccc1C[NH+](Cc1ccccn1)Cc1ccccn1 ZINC001237965200 1055567894 /nfs/dbraw/zinc/56/78/94/1055567894.db2.gz XBQPIYHFQQCAPC-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO C[N@H+](Cc1csc(-c2cccc(F)c2)n1)C1CC(F)(F)C1 ZINC001237974229 1055571224 /nfs/dbraw/zinc/57/12/24/1055571224.db2.gz GDDBQQYJMVFHMR-UHFFFAOYSA-N 1 2 312.360 4.179 20 0 DIADLO C[N@@H+](Cc1csc(-c2cccc(F)c2)n1)C1CC(F)(F)C1 ZINC001237974229 1055571238 /nfs/dbraw/zinc/57/12/38/1055571238.db2.gz GDDBQQYJMVFHMR-UHFFFAOYSA-N 1 2 312.360 4.179 20 0 DIADLO Oc1c(F)cc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)cc1Cl ZINC001237984499 1055573471 /nfs/dbraw/zinc/57/34/71/1055573471.db2.gz QKAPNHKHRKDJHB-CQSZACIVSA-N 1 2 305.780 4.174 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CC[C@@H](c3ccccc3)C2)cc1Cl ZINC001237984499 1055573479 /nfs/dbraw/zinc/57/34/79/1055573479.db2.gz QKAPNHKHRKDJHB-CQSZACIVSA-N 1 2 305.780 4.174 20 0 DIADLO C[N@H+](Cc1cc(F)c(O)c(Cl)c1)[C@H]1CCc2ccccc21 ZINC001237991634 1055576300 /nfs/dbraw/zinc/57/63/00/1055576300.db2.gz CYFWPRYUGNELPM-INIZCTEOSA-N 1 2 305.780 4.304 20 0 DIADLO C[N@@H+](Cc1cc(F)c(O)c(Cl)c1)[C@H]1CCc2ccccc21 ZINC001237991634 1055576308 /nfs/dbraw/zinc/57/63/08/1055576308.db2.gz CYFWPRYUGNELPM-INIZCTEOSA-N 1 2 305.780 4.304 20 0 DIADLO C[N@H+](Cc1[nH]nc2cc(Cl)ccc21)Cc1ccc(F)cc1F ZINC001238003736 1055579583 /nfs/dbraw/zinc/57/95/83/1055579583.db2.gz KUTHTFVKWQXBRW-UHFFFAOYSA-N 1 2 321.758 4.127 20 0 DIADLO C[N@@H+](Cc1[nH]nc2cc(Cl)ccc21)Cc1ccc(F)cc1F ZINC001238003736 1055579595 /nfs/dbraw/zinc/57/95/95/1055579595.db2.gz KUTHTFVKWQXBRW-UHFFFAOYSA-N 1 2 321.758 4.127 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)n1 ZINC000921614080 1055583757 /nfs/dbraw/zinc/58/37/57/1055583757.db2.gz MGLHTVRFYITLMU-AWEZNQCLSA-N 1 2 304.821 4.403 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2cnc(F)cc2Cl)cc1 ZINC001238021559 1055585522 /nfs/dbraw/zinc/58/55/22/1055585522.db2.gz XUMOPLYSYVPMSA-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2cnc(F)cc2Cl)cc1 ZINC001238021559 1055585525 /nfs/dbraw/zinc/58/55/25/1055585525.db2.gz XUMOPLYSYVPMSA-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO C[C@H]([NH2+]Cc1cn2cc(Cl)ccc2n1)c1ccc(F)cc1F ZINC000102689667 1055587116 /nfs/dbraw/zinc/58/71/16/1055587116.db2.gz WXHHBILHSBIVRO-JTQLQIEISA-N 1 2 321.758 4.117 20 0 DIADLO Cc1ccc(-c2nc(C[NH+]3CC(c4cccnc4)C3)cs2)cc1 ZINC001238043017 1055591532 /nfs/dbraw/zinc/59/15/32/1055591532.db2.gz TZCARWBWHRNBOY-UHFFFAOYSA-N 1 2 321.449 4.113 20 0 DIADLO COc1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@](C)(F)C2)c1 ZINC001238047355 1055593343 /nfs/dbraw/zinc/59/33/43/1055593343.db2.gz FVKXZLFSTOECJN-AWEZNQCLSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@](C)(F)C2)c1 ZINC001238047355 1055593350 /nfs/dbraw/zinc/59/33/50/1055593350.db2.gz FVKXZLFSTOECJN-AWEZNQCLSA-N 1 2 305.315 4.038 20 0 DIADLO CC1(C)CCC(=CC(=O)Nc2ccccc2-n2cc[nH+]c2)CC1 ZINC001595396187 1055594701 /nfs/dbraw/zinc/59/47/01/1055594701.db2.gz VMDHYPIYVXKNJN-UHFFFAOYSA-N 1 2 309.413 4.337 20 0 DIADLO CCOc1cc(C[N@@H+]2CCc3ccc(C(C)=O)cc3C2)ccc1C ZINC001238075419 1055599696 /nfs/dbraw/zinc/59/96/96/1055599696.db2.gz JFQROGGCWWYZMY-UHFFFAOYSA-N 1 2 323.436 4.155 20 0 DIADLO CCOc1cc(C[N@H+]2CCc3ccc(C(C)=O)cc3C2)ccc1C ZINC001238075419 1055599704 /nfs/dbraw/zinc/59/97/04/1055599704.db2.gz JFQROGGCWWYZMY-UHFFFAOYSA-N 1 2 323.436 4.155 20 0 DIADLO Cc1cc(C[N@@H+]2CCC(=O)[C@@H]3CCCC[C@H]32)cc(C)c1Cl ZINC001238088998 1055602907 /nfs/dbraw/zinc/60/29/07/1055602907.db2.gz MQQCUXIQZDKCKW-HZPDHXFCSA-N 1 2 305.849 4.290 20 0 DIADLO Cc1cc(C[N@H+]2CCC(=O)[C@@H]3CCCC[C@H]32)cc(C)c1Cl ZINC001238088998 1055602918 /nfs/dbraw/zinc/60/29/18/1055602918.db2.gz MQQCUXIQZDKCKW-HZPDHXFCSA-N 1 2 305.849 4.290 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(F)c(Br)c2F)C2(CC2)C1 ZINC001238087764 1055603308 /nfs/dbraw/zinc/60/33/08/1055603308.db2.gz WPTOUZFCGVANHR-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(F)c(Br)c2F)C2(CC2)C1 ZINC001238087764 1055603315 /nfs/dbraw/zinc/60/33/15/1055603315.db2.gz WPTOUZFCGVANHR-SECBINFHSA-N 1 2 316.189 4.102 20 0 DIADLO Cc1cc(C[N@@H+]2CCC(=O)[C@H]3CCCC[C@H]32)cc(C)c1Cl ZINC001238088999 1055603630 /nfs/dbraw/zinc/60/36/30/1055603630.db2.gz MQQCUXIQZDKCKW-JKSUJKDBSA-N 1 2 305.849 4.290 20 0 DIADLO Cc1cc(C[N@H+]2CCC(=O)[C@H]3CCCC[C@H]32)cc(C)c1Cl ZINC001238088999 1055603633 /nfs/dbraw/zinc/60/36/33/1055603633.db2.gz MQQCUXIQZDKCKW-JKSUJKDBSA-N 1 2 305.849 4.290 20 0 DIADLO C[N@H+](CC/C=C/c1cccnc1)Cc1cc(Cl)c(O)cc1F ZINC001238149632 1055612059 /nfs/dbraw/zinc/61/20/59/1055612059.db2.gz KAONUHONVOADFE-GORDUTHDSA-N 1 2 320.795 4.115 20 0 DIADLO C[N@@H+](CC/C=C/c1cccnc1)Cc1cc(Cl)c(O)cc1F ZINC001238149632 1055612063 /nfs/dbraw/zinc/61/20/63/1055612063.db2.gz KAONUHONVOADFE-GORDUTHDSA-N 1 2 320.795 4.115 20 0 DIADLO CNc1ccc(Nc2cc(SC(F)(F)F)ccc2N)c[nH+]1 ZINC001203457988 1055618576 /nfs/dbraw/zinc/61/85/76/1055618576.db2.gz GNLVFOXZMXDVAJ-UHFFFAOYSA-N 1 2 314.336 4.061 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1ccc2c(c1)CCCC2 ZINC000029915927 1055624727 /nfs/dbraw/zinc/62/47/27/1055624727.db2.gz GEMDWXAIXBECAE-UHFFFAOYSA-N 1 2 317.392 4.003 20 0 DIADLO FCC1CC[NH+](Cc2ccc(F)c(C(F)(F)F)c2F)CC1 ZINC001238254417 1055629798 /nfs/dbraw/zinc/62/97/98/1055629798.db2.gz XOOAWMJRYSQJQT-UHFFFAOYSA-N 1 2 311.269 4.165 20 0 DIADLO CC(C)Oc1c(F)cccc1C[N@@H+]1CCc2sccc2C1 ZINC001238317796 1055637678 /nfs/dbraw/zinc/63/76/78/1055637678.db2.gz GVWVQAWESWLUDE-UHFFFAOYSA-N 1 2 305.418 4.233 20 0 DIADLO CC(C)Oc1c(F)cccc1C[N@H+]1CCc2sccc2C1 ZINC001238317796 1055637683 /nfs/dbraw/zinc/63/76/83/1055637683.db2.gz GVWVQAWESWLUDE-UHFFFAOYSA-N 1 2 305.418 4.233 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1c(Br)ccc(O)c1F ZINC001238307844 1055638572 /nfs/dbraw/zinc/63/85/72/1055638572.db2.gz YNYMQXUDOVJNOQ-AOOOYVTPSA-N 1 2 316.214 4.057 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1c(Br)ccc(O)c1F ZINC001238307844 1055638577 /nfs/dbraw/zinc/63/85/77/1055638577.db2.gz YNYMQXUDOVJNOQ-AOOOYVTPSA-N 1 2 316.214 4.057 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(F)c2OCc2ccccc2)C[C@@H]1F ZINC001238334260 1055641226 /nfs/dbraw/zinc/64/12/26/1055641226.db2.gz WREITHMSZIMZKT-KDOFPFPSSA-N 1 2 317.379 4.195 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(F)c2OCc2ccccc2)C[C@@H]1F ZINC001238334260 1055641233 /nfs/dbraw/zinc/64/12/33/1055641233.db2.gz WREITHMSZIMZKT-KDOFPFPSSA-N 1 2 317.379 4.195 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@H+](C)Cc1ccccc1C ZINC001238339354 1055641331 /nfs/dbraw/zinc/64/13/31/1055641331.db2.gz NPHNIWDDKQYEDT-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@@H+](C)Cc1ccccc1C ZINC001238339354 1055641337 /nfs/dbraw/zinc/64/13/37/1055641337.db2.gz NPHNIWDDKQYEDT-UHFFFAOYSA-N 1 2 307.796 4.428 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c(F)c1O ZINC001238361840 1055645838 /nfs/dbraw/zinc/64/58/38/1055645838.db2.gz YJXZFHABLRNHLI-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2F)c(F)c1O ZINC001238361840 1055645843 /nfs/dbraw/zinc/64/58/43/1055645843.db2.gz YJXZFHABLRNHLI-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c(Cl)cn1 ZINC001238361909 1055646073 /nfs/dbraw/zinc/64/60/73/1055646073.db2.gz RVUPLMARZUPTTE-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c(Cl)cn1 ZINC001238361909 1055646078 /nfs/dbraw/zinc/64/60/78/1055646078.db2.gz RVUPLMARZUPTTE-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c(F)c1O ZINC001238361298 1055646317 /nfs/dbraw/zinc/64/63/17/1055646317.db2.gz RNFIMEAPZHQTKC-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c(F)c1O ZINC001238361298 1055646323 /nfs/dbraw/zinc/64/63/23/1055646323.db2.gz RNFIMEAPZHQTKC-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO CC(C)Oc1ccc(C[N@H+](C)Cc2ccc(Cl)nc2)c(F)c1 ZINC001238450195 1055660001 /nfs/dbraw/zinc/66/00/01/1055660001.db2.gz RDFZRBIHNQAVAO-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+](C)Cc2ccc(Cl)nc2)c(F)c1 ZINC001238450195 1055660008 /nfs/dbraw/zinc/66/00/08/1055660008.db2.gz RDFZRBIHNQAVAO-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)cnc1F ZINC001238455517 1055662141 /nfs/dbraw/zinc/66/21/41/1055662141.db2.gz ZSEGEGNPANVMFY-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)cnc1F ZINC001238455517 1055662149 /nfs/dbraw/zinc/66/21/49/1055662149.db2.gz ZSEGEGNPANVMFY-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCOc3ccccc3C2)c(F)c1 ZINC001238452584 1055662359 /nfs/dbraw/zinc/66/23/59/1055662359.db2.gz ZQFDCMVJICDIQL-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCOc3ccccc3C2)c(F)c1 ZINC001238452584 1055662370 /nfs/dbraw/zinc/66/23/70/1055662370.db2.gz ZQFDCMVJICDIQL-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO COc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000921621576 1055662295 /nfs/dbraw/zinc/66/22/95/1055662295.db2.gz QEYHZKQCOPAFSI-MRXNPFEDSA-N 1 2 314.429 4.148 20 0 DIADLO COc1c(C[N@@H+]2CCC[C@H]2c2ccc(C)nc2)ccc(F)c1F ZINC001238469785 1055665549 /nfs/dbraw/zinc/66/55/49/1055665549.db2.gz PPHWNKJKDKXDSY-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1c(C[N@H+]2CCC[C@H]2c2ccc(C)nc2)ccc(F)c1F ZINC001238469785 1055665556 /nfs/dbraw/zinc/66/55/56/1055665556.db2.gz PPHWNKJKDKXDSY-INIZCTEOSA-N 1 2 318.367 4.014 20 0 DIADLO C[C@H]1CC[N@@H+]1Cc1c(F)ccc(OCc2ccccc2)c1F ZINC001238471595 1055665804 /nfs/dbraw/zinc/66/58/04/1055665804.db2.gz ATBKCUYHVDOKMO-ZDUSSCGKSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@H]1CC[N@H+]1Cc1c(F)ccc(OCc2ccccc2)c1F ZINC001238471595 1055665810 /nfs/dbraw/zinc/66/58/10/1055665810.db2.gz ATBKCUYHVDOKMO-ZDUSSCGKSA-N 1 2 303.352 4.138 20 0 DIADLO CC(C)Oc1cc(C[N@@H+]2CCOc3ccccc3C2)ccc1F ZINC001238461454 1055665895 /nfs/dbraw/zinc/66/58/95/1055665895.db2.gz XJUDBNZIUUFITR-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO CC(C)Oc1cc(C[N@H+]2CCOc3ccccc3C2)ccc1F ZINC001238461454 1055665899 /nfs/dbraw/zinc/66/58/99/1055665899.db2.gz XJUDBNZIUUFITR-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO CCCCc1noc(C[NH2+]C2(c3cccc(C)c3)CCCC2)n1 ZINC000104076589 1055666239 /nfs/dbraw/zinc/66/62/39/1055666239.db2.gz NFKGDNSYNWTLAH-UHFFFAOYSA-N 1 2 313.445 4.280 20 0 DIADLO Cc1cc(C[NH+]2CC3(C2)CCCO3)ccc1Oc1ccccc1 ZINC001238525384 1055677457 /nfs/dbraw/zinc/67/74/57/1055677457.db2.gz GXJQVAKMQIQLRO-UHFFFAOYSA-N 1 2 309.409 4.152 20 0 DIADLO Cc1cc(C[N@H+]2CCC(=O)C[C@@H]2C)ccc1Oc1ccccc1 ZINC001238519936 1055677825 /nfs/dbraw/zinc/67/78/25/1055677825.db2.gz AOBVLCRTWCUXIL-INIZCTEOSA-N 1 2 309.409 4.341 20 0 DIADLO Cc1cc(C[N@@H+]2CCC(=O)C[C@@H]2C)ccc1Oc1ccccc1 ZINC001238519936 1055677835 /nfs/dbraw/zinc/67/78/35/1055677835.db2.gz AOBVLCRTWCUXIL-INIZCTEOSA-N 1 2 309.409 4.341 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@@H+]2CCCC[C@](C)(F)C2)c1F ZINC001238528228 1055680088 /nfs/dbraw/zinc/68/00/88/1055680088.db2.gz PYWKLDAADNHRPT-KRWDZBQOSA-N 1 2 315.379 4.466 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@H+]2CCCC[C@](C)(F)C2)c1F ZINC001238528228 1055680096 /nfs/dbraw/zinc/68/00/96/1055680096.db2.gz PYWKLDAADNHRPT-KRWDZBQOSA-N 1 2 315.379 4.466 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@@H+]2CCc3ccccc3C2)c1F ZINC001238531012 1055680745 /nfs/dbraw/zinc/68/07/45/1055680745.db2.gz GCPWVHIFCZNEHM-UHFFFAOYSA-N 1 2 317.379 4.310 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@H+]2CCc3ccccc3C2)c1F ZINC001238531012 1055680750 /nfs/dbraw/zinc/68/07/50/1055680750.db2.gz GCPWVHIFCZNEHM-UHFFFAOYSA-N 1 2 317.379 4.310 20 0 DIADLO Cc1cc(C[N@@H+]2CCC(=O)[C@H](C)C2)ccc1Oc1ccccc1 ZINC001238527089 1055680851 /nfs/dbraw/zinc/68/08/51/1055680851.db2.gz UKIXWMVZKUXSLM-MRXNPFEDSA-N 1 2 309.409 4.198 20 0 DIADLO Cc1cc(C[N@H+]2CCC(=O)[C@H](C)C2)ccc1Oc1ccccc1 ZINC001238527089 1055680855 /nfs/dbraw/zinc/68/08/55/1055680855.db2.gz UKIXWMVZKUXSLM-MRXNPFEDSA-N 1 2 309.409 4.198 20 0 DIADLO Cc1cc(F)cc(Br)c1C[N@@H+]1C[C@@H](C)C[C@H]1CF ZINC001238562701 1055689281 /nfs/dbraw/zinc/68/92/81/1055689281.db2.gz NEMDJAUFDRBOIE-CABZTGNLSA-N 1 2 318.205 4.077 20 0 DIADLO Cc1cc(F)cc(Br)c1C[N@H+]1C[C@@H](C)C[C@H]1CF ZINC001238562701 1055689282 /nfs/dbraw/zinc/68/92/82/1055689282.db2.gz NEMDJAUFDRBOIE-CABZTGNLSA-N 1 2 318.205 4.077 20 0 DIADLO CC(C)Oc1cc(C[N@@H+]2CCc3ccccc3[C@H]2C)cnc1F ZINC001238601988 1055693323 /nfs/dbraw/zinc/69/33/23/1055693323.db2.gz BBZDDOOGUIFLFO-CQSZACIVSA-N 1 2 314.404 4.127 20 0 DIADLO CC(C)Oc1cc(C[N@H+]2CCc3ccccc3[C@H]2C)cnc1F ZINC001238601988 1055693331 /nfs/dbraw/zinc/69/33/31/1055693331.db2.gz BBZDDOOGUIFLFO-CQSZACIVSA-N 1 2 314.404 4.127 20 0 DIADLO Clc1cnc(-c2ccccc2)cc1C[N@@H+]1CCn2cccc2C1 ZINC001238628605 1055702872 /nfs/dbraw/zinc/70/28/72/1055702872.db2.gz GLGABANAZYRBBC-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO Clc1cnc(-c2ccccc2)cc1C[N@H+]1CCn2cccc2C1 ZINC001238628605 1055702878 /nfs/dbraw/zinc/70/28/78/1055702878.db2.gz GLGABANAZYRBBC-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@@H+]1CCCC[C@](C)(F)C1 ZINC001238651786 1055709676 /nfs/dbraw/zinc/70/96/76/1055709676.db2.gz JZYSWDOYNZPLDC-INIZCTEOSA-N 1 2 301.352 4.078 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@H+]1CCCC[C@](C)(F)C1 ZINC001238651786 1055709685 /nfs/dbraw/zinc/70/96/85/1055709685.db2.gz JZYSWDOYNZPLDC-INIZCTEOSA-N 1 2 301.352 4.078 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC001238654497 1055709752 /nfs/dbraw/zinc/70/97/52/1055709752.db2.gz XMSSLHSXDHJJOL-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC001238654497 1055709759 /nfs/dbraw/zinc/70/97/59/1055709759.db2.gz XMSSLHSXDHJJOL-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO Fc1ncc(-c2ccccc2)cc1C[N@H+]1CCCC[C@@H](F)C1 ZINC001238657686 1055710616 /nfs/dbraw/zinc/71/06/16/1055710616.db2.gz KDCOBADQXFRNSH-QGZVFWFLSA-N 1 2 302.368 4.212 20 0 DIADLO Fc1ncc(-c2ccccc2)cc1C[N@@H+]1CCCC[C@@H](F)C1 ZINC001238657686 1055710626 /nfs/dbraw/zinc/71/06/26/1055710626.db2.gz KDCOBADQXFRNSH-QGZVFWFLSA-N 1 2 302.368 4.212 20 0 DIADLO CSc1ccc(Cl)cc1C[N@@H+]1CCc2ncsc2C1 ZINC001238678100 1055718090 /nfs/dbraw/zinc/71/80/90/1055718090.db2.gz UXDLXYLNLTWYFM-UHFFFAOYSA-N 1 2 310.875 4.077 20 0 DIADLO CSc1ccc(Cl)cc1C[N@H+]1CCc2ncsc2C1 ZINC001238678100 1055718098 /nfs/dbraw/zinc/71/80/98/1055718098.db2.gz UXDLXYLNLTWYFM-UHFFFAOYSA-N 1 2 310.875 4.077 20 0 DIADLO CC(C)C[C@H](C(=O)N1CC[C@@H](C)c2ccccc21)n1cc[nH+]c1 ZINC001596529486 1055720190 /nfs/dbraw/zinc/72/01/90/1055720190.db2.gz ZOMIWDOIMKUIHA-CRAIPNDOSA-N 1 2 311.429 4.011 20 0 DIADLO CC(C)Oc1cc(F)ccc1C[N@@H+]1CCOc2ccccc2C1 ZINC001238695528 1055722221 /nfs/dbraw/zinc/72/22/21/1055722221.db2.gz HMZWRRXRAQGCFU-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO CC(C)Oc1cc(F)ccc1C[N@H+]1CCOc2ccccc2C1 ZINC001238695528 1055722231 /nfs/dbraw/zinc/72/22/31/1055722231.db2.gz HMZWRRXRAQGCFU-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO Cc1cc(C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)on1 ZINC000105455799 1055727520 /nfs/dbraw/zinc/72/75/20/1055727520.db2.gz CSIAAORGDBXSHK-UHFFFAOYSA-N 1 2 302.761 4.186 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000105493930 1055731286 /nfs/dbraw/zinc/73/12/86/1055731286.db2.gz CZZHYRLXEMZXFW-KRWDZBQOSA-N 1 2 303.837 4.393 20 0 DIADLO CSc1ncc(C)cc1C[N@@H+]1CCc2ccc(Cl)cc2C1 ZINC001238712610 1055731177 /nfs/dbraw/zinc/73/11/77/1055731177.db2.gz JGUJMDGNUKFJLH-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CSc1ncc(C)cc1C[N@H+]1CCc2ccc(Cl)cc2C1 ZINC001238712610 1055731188 /nfs/dbraw/zinc/73/11/88/1055731188.db2.gz JGUJMDGNUKFJLH-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CCOc1ccc(C)c(C[N@@H+]2CCc3nc(Cl)ccc3C2)c1 ZINC001238718237 1055732444 /nfs/dbraw/zinc/73/24/44/1055732444.db2.gz XPGLICWBZIELIW-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1ccc(C)c(C[N@H+]2CCc3nc(Cl)ccc3C2)c1 ZINC001238718237 1055732458 /nfs/dbraw/zinc/73/24/58/1055732458.db2.gz XPGLICWBZIELIW-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO Cc1cccc([C@H]2CCCN2C(=O)c2cc3c[nH+]ccc3[nH]2)c1C ZINC001565889179 1055734738 /nfs/dbraw/zinc/73/47/38/1055734738.db2.gz DROFGGXMSKZRJP-LJQANCHMSA-N 1 2 319.408 4.157 20 0 DIADLO CCOc1cc(C[N@H+](C)Cc2ccc3ccccc3c2)c(F)cn1 ZINC001238733705 1055737184 /nfs/dbraw/zinc/73/71/84/1055737184.db2.gz HDDBVDFEVSJRFI-UHFFFAOYSA-N 1 2 324.399 4.405 20 0 DIADLO CCOc1cc(C[N@@H+](C)Cc2ccc3ccccc3c2)c(F)cn1 ZINC001238733705 1055737192 /nfs/dbraw/zinc/73/71/92/1055737192.db2.gz HDDBVDFEVSJRFI-UHFFFAOYSA-N 1 2 324.399 4.405 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+](Cc1cc(C)c(OC(C)C)c(C)c1)C2 ZINC001238750537 1055740127 /nfs/dbraw/zinc/74/01/27/1055740127.db2.gz BRSROGODBQRZIJ-UHFFFAOYSA-N 1 2 310.441 4.310 20 0 DIADLO Cc1cc2c(cn1)C[N@H+](Cc1cc(C)c(OC(C)C)c(C)c1)C2 ZINC001238750537 1055740136 /nfs/dbraw/zinc/74/01/36/1055740136.db2.gz BRSROGODBQRZIJ-UHFFFAOYSA-N 1 2 310.441 4.310 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)s1 ZINC000047259190 1055754254 /nfs/dbraw/zinc/75/42/54/1055754254.db2.gz DYSSBKYAIIHVEF-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)s1 ZINC000047259190 1055754262 /nfs/dbraw/zinc/75/42/62/1055754262.db2.gz DYSSBKYAIIHVEF-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO CC(C)Oc1cc(C[N@H+](C)Cc2ccc(Cl)cc2)c(F)cn1 ZINC001238801233 1055754997 /nfs/dbraw/zinc/75/49/97/1055754997.db2.gz CUXJKUPCIDQMJD-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO CC(C)Oc1cc(C[N@@H+](C)Cc2ccc(Cl)cc2)c(F)cn1 ZINC001238801233 1055755008 /nfs/dbraw/zinc/75/50/08/1055755008.db2.gz CUXJKUPCIDQMJD-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO Clc1cc(Cl)c(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c(Br)c1 ZINC001238803018 1055755447 /nfs/dbraw/zinc/75/54/47/1055755447.db2.gz ZVPOQTKUDLWVGJ-OCAPTIKFSA-N 1 2 321.045 4.208 20 0 DIADLO Clc1cc(Cl)c(C[N@H+]2C[C@@H]3C[C@@H]3C2)c(Br)c1 ZINC001238803018 1055755454 /nfs/dbraw/zinc/75/54/54/1055755454.db2.gz ZVPOQTKUDLWVGJ-OCAPTIKFSA-N 1 2 321.045 4.208 20 0 DIADLO Clc1cc(Cl)c(C[NH+]2CCCC2)c(Br)c1 ZINC001238801397 1055755635 /nfs/dbraw/zinc/75/56/35/1055755635.db2.gz HMXWCYARFAUGSA-UHFFFAOYSA-N 1 2 309.034 4.352 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@]3(C)CCc4ccccc4C3)cc2[nH+]1 ZINC001566328720 1055763070 /nfs/dbraw/zinc/76/30/70/1055763070.db2.gz BOGHAWMXBQHUGL-FQEVSTJZSA-N 1 2 319.408 4.005 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H]3CC[C@@H]3c3ccc(F)cc3)cc2[nH+]1 ZINC001566329601 1055763158 /nfs/dbraw/zinc/76/31/58/1055763158.db2.gz DGNRKQIYCKPJIW-HZPDHXFCSA-N 1 2 323.371 4.143 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccnc(Oc2ccccc2)c1 ZINC001238846723 1055766870 /nfs/dbraw/zinc/76/68/70/1055766870.db2.gz CMOBBALRHOUGNJ-UHFFFAOYSA-N 1 2 317.348 4.197 20 0 DIADLO COc1ccc([C@@H](Nc2cccc[nH+]2)c2ccc(F)cc2)cc1 ZINC000057151100 1055774830 /nfs/dbraw/zinc/77/48/30/1055774830.db2.gz QDPHQIJZWIUKMU-IBGZPJMESA-N 1 2 308.356 4.431 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cc3ccccc3[nH]c2=O)cc1 ZINC001238880928 1055777564 /nfs/dbraw/zinc/77/75/64/1055777564.db2.gz CHKNOTFULRBEHN-UHFFFAOYSA-N 1 2 301.349 4.008 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc2ccccc2[nH]c1=O ZINC001238882769 1055778626 /nfs/dbraw/zinc/77/86/26/1055778626.db2.gz YDBOMVMMTVVJPY-UHFFFAOYSA-N 1 2 319.408 4.301 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1csc2ccccc12 ZINC001238887298 1055781284 /nfs/dbraw/zinc/78/12/84/1055781284.db2.gz LNXLFZMODLFKQC-UHFFFAOYSA-N 1 2 310.422 4.108 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccc(F)cc1 ZINC000057449718 1055781964 /nfs/dbraw/zinc/78/19/64/1055781964.db2.gz NDGQMQMGVHVZCQ-AWEZNQCLSA-N 1 2 323.371 4.144 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2coc(-c3cccs3)n2)oc1C ZINC000282191700 1055783145 /nfs/dbraw/zinc/78/31/45/1055783145.db2.gz NKDWTRLLNDMIDN-NSHDSACASA-N 1 2 302.399 4.464 20 0 DIADLO COc1ccc(C)cc1C[NH2+]Cc1coc(-c2cccs2)n1 ZINC000064411975 1055807191 /nfs/dbraw/zinc/80/71/91/1055807191.db2.gz MWRHPEKSEOBGBU-UHFFFAOYSA-N 1 2 314.410 4.010 20 0 DIADLO CCc1[nH]c(CNC(=O)C2(C3CCCCC3)CCCCC2)c[nH+]1 ZINC001597258289 1055807665 /nfs/dbraw/zinc/80/76/65/1055807665.db2.gz YDQXTMJJGPDKKD-UHFFFAOYSA-N 1 2 317.477 4.119 20 0 DIADLO CCc1[nH]cc(CNC(=O)C2(C3CCCCC3)CCCCC2)[nH+]1 ZINC001597258289 1055807681 /nfs/dbraw/zinc/80/76/81/1055807681.db2.gz YDQXTMJJGPDKKD-UHFFFAOYSA-N 1 2 317.477 4.119 20 0 DIADLO Fc1cc(F)c(F)c(C[NH2+]Cc2ccc3occc3c2)c1F ZINC000671716543 1055816469 /nfs/dbraw/zinc/81/64/69/1055816469.db2.gz DLYZYXLJGUAHJA-UHFFFAOYSA-N 1 2 309.262 4.279 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2coc3ccc(C(C)C)cc23)c[nH+]1 ZINC001597402974 1055824323 /nfs/dbraw/zinc/82/43/23/1055824323.db2.gz MDKPRAUTVRUILH-UHFFFAOYSA-N 1 2 322.408 4.498 20 0 DIADLO Cc1nnc(-c2ccc(-c3cccc(-c4c[nH+]cn4C)c3)cc2)o1 ZINC001239018659 1055824352 /nfs/dbraw/zinc/82/43/52/1055824352.db2.gz FLBGFGSPQIFGJP-UHFFFAOYSA-N 1 2 316.364 4.113 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cnn(Cc3ccncc3)c2)c1 ZINC001239051722 1055832205 /nfs/dbraw/zinc/83/22/05/1055832205.db2.gz DWBAAUAKGLOWPS-UHFFFAOYSA-N 1 2 320.440 4.148 20 0 DIADLO Cc1cccc(N2CC[NH+]([C@H](C)c3ccc(F)cc3F)CC2)c1 ZINC000060466325 1055837928 /nfs/dbraw/zinc/83/79/28/1055837928.db2.gz LHAYNIMLZPYVAC-OAHLLOKOSA-N 1 2 316.395 4.156 20 0 DIADLO O=C(N[C@@H]1CCC[C@@H](c2ccccc2)C1)c1cc2c[nH+]ccc2[nH]1 ZINC001568683581 1055844278 /nfs/dbraw/zinc/84/42/78/1055844278.db2.gz MVLHKOUQZDFEQL-NVXWUHKLSA-N 1 2 319.408 4.019 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccc(C)cc2OC(C)(C)C)nn1C ZINC000282227525 1055848291 /nfs/dbraw/zinc/84/82/91/1055848291.db2.gz PEUPNHZXAWRKLD-HNNXBMFYSA-N 1 2 315.461 4.065 20 0 DIADLO Cc1cccc2nc(C[N@@H+](C)[C@@H](C)c3ccc(F)c(F)c3)cn21 ZINC000060843538 1055851255 /nfs/dbraw/zinc/85/12/55/1055851255.db2.gz AYJDGHDSERPBCR-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1cccc2nc(C[N@H+](C)[C@@H](C)c3ccc(F)c(F)c3)cn21 ZINC000060843538 1055851258 /nfs/dbraw/zinc/85/12/58/1055851258.db2.gz AYJDGHDSERPBCR-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO CCc1ccc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)cn1 ZINC000347584093 1055864002 /nfs/dbraw/zinc/86/40/02/1055864002.db2.gz JRYZGMYJTKTXRW-UHFFFAOYSA-N 1 2 302.368 4.087 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)cn1 ZINC000347584093 1055864011 /nfs/dbraw/zinc/86/40/11/1055864011.db2.gz JRYZGMYJTKTXRW-UHFFFAOYSA-N 1 2 302.368 4.087 20 0 DIADLO Cc1cc(-c2cc(Cl)cnc2OC(C)C)cn2cc[nH+]c12 ZINC001239322204 1055869749 /nfs/dbraw/zinc/86/97/49/1055869749.db2.gz ASGVIADPUISHKL-UHFFFAOYSA-N 1 2 301.777 4.145 20 0 DIADLO CCCc1cc(C(=O)NCc2c[nH]c(C(C)C)[nH+]2)ccc1Cl ZINC001597811756 1055877860 /nfs/dbraw/zinc/87/78/60/1055877860.db2.gz LOZGFMPRUZXWED-UHFFFAOYSA-N 1 2 319.836 4.069 20 0 DIADLO CCCc1cc(C(=O)NCc2c[nH+]c(C(C)C)[nH]2)ccc1Cl ZINC001597811756 1055877868 /nfs/dbraw/zinc/87/78/68/1055877868.db2.gz LOZGFMPRUZXWED-UHFFFAOYSA-N 1 2 319.836 4.069 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC3(CCCCC3)[C@H]2C(C)C)c(C)[nH+]1 ZINC001570190963 1055888681 /nfs/dbraw/zinc/88/86/81/1055888681.db2.gz BNSUDXMIPVZXQT-GOSISDBHSA-N 1 2 314.473 4.438 20 0 DIADLO Cc1ccc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c(C)n1 ZINC001239470283 1055896225 /nfs/dbraw/zinc/89/62/25/1055896225.db2.gz JNJUQKKECKTKDZ-UHFFFAOYSA-N 1 2 319.408 4.008 20 0 DIADLO Cc1ccc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c(C)n1 ZINC001239470283 1055896235 /nfs/dbraw/zinc/89/62/35/1055896235.db2.gz JNJUQKKECKTKDZ-UHFFFAOYSA-N 1 2 319.408 4.008 20 0 DIADLO Cc1cc(CNC(=O)c2ccc(C)c3ccccc23)cc(C)[nH+]1 ZINC001597956383 1055897405 /nfs/dbraw/zinc/89/74/05/1055897405.db2.gz VPZJDRFVRHEDOV-UHFFFAOYSA-N 1 2 304.393 4.090 20 0 DIADLO C[N@@H+]1CCc2oc(-c3ccc(-c4ccc(F)cc4)cc3)nc2C1 ZINC001239477745 1055901492 /nfs/dbraw/zinc/90/14/92/1055901492.db2.gz JXHDRNHJSQDMBX-UHFFFAOYSA-N 1 2 308.356 4.136 20 0 DIADLO C[N@H+]1CCc2oc(-c3ccc(-c4ccc(F)cc4)cc3)nc2C1 ZINC001239477745 1055901502 /nfs/dbraw/zinc/90/15/02/1055901502.db2.gz JXHDRNHJSQDMBX-UHFFFAOYSA-N 1 2 308.356 4.136 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]C2(c3c(F)cccc3F)CCC2)cn1 ZINC000624344109 1055906729 /nfs/dbraw/zinc/90/67/29/1055906729.db2.gz GGCBLXDBPCLXGG-ZDUSSCGKSA-N 1 2 319.399 4.472 20 0 DIADLO Cc1nc(C[NH2+]C(C)(C)c2ccc(Br)cc2)oc1C ZINC000064142243 1055911824 /nfs/dbraw/zinc/91/18/24/1055911824.db2.gz QUOAZDAKUHVKAS-UHFFFAOYSA-N 1 2 323.234 4.079 20 0 DIADLO CC[N@H+](CC(=O)OC(C)(C)C)[C@H](C)c1cc2ccccc2o1 ZINC000064348908 1055915120 /nfs/dbraw/zinc/91/51/20/1055915120.db2.gz WXJIICISGXNSTQ-CYBMUJFWSA-N 1 2 303.402 4.157 20 0 DIADLO CC[N@@H+](CC(=O)OC(C)(C)C)[C@H](C)c1cc2ccccc2o1 ZINC000064348908 1055915129 /nfs/dbraw/zinc/91/51/29/1055915129.db2.gz WXJIICISGXNSTQ-CYBMUJFWSA-N 1 2 303.402 4.157 20 0 DIADLO CCC[N@H+](Cc1nc(CCC(C)C)no1)Cc1ccccc1 ZINC000064507836 1055920402 /nfs/dbraw/zinc/92/04/02/1055920402.db2.gz FUUHGDZXKIVGKC-UHFFFAOYSA-N 1 2 301.434 4.070 20 0 DIADLO CCC[N@@H+](Cc1nc(CCC(C)C)no1)Cc1ccccc1 ZINC000064507836 1055920413 /nfs/dbraw/zinc/92/04/13/1055920413.db2.gz FUUHGDZXKIVGKC-UHFFFAOYSA-N 1 2 301.434 4.070 20 0 DIADLO C[C@H]1CC[C@H](C)[N@H+](Cc2ncc(Br)cc2Cl)C1 ZINC001615640239 1055926720 /nfs/dbraw/zinc/92/67/20/1055926720.db2.gz UEKIMBKPRZYKKO-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[C@H](C)[N@@H+](Cc2ncc(Br)cc2Cl)C1 ZINC001615640239 1055926725 /nfs/dbraw/zinc/92/67/25/1055926725.db2.gz UEKIMBKPRZYKKO-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(OC(C)C)cc2)nc2ccccc12 ZINC001620763899 1055935508 /nfs/dbraw/zinc/93/55/08/1055935508.db2.gz RAUHYWNOSXSICE-UHFFFAOYSA-N 1 2 321.424 4.015 20 0 DIADLO CC(C)CC[C@H]([NH2+]Cc1csc(N(C)C)n1)c1ccoc1 ZINC000671749835 1055963289 /nfs/dbraw/zinc/96/32/89/1055963289.db2.gz XCBNKMYTNLCMNK-HNNXBMFYSA-N 1 2 307.463 4.069 20 0 DIADLO Cc1c(C)c(C)c(C[N@@H+]2Cc3cn[nH]c3C[C@@H](C)C2)c(C)c1C ZINC001620582951 1055971756 /nfs/dbraw/zinc/97/17/56/1055971756.db2.gz WCGQMEJDFPPMHH-GFCCVEGCSA-N 1 2 311.473 4.146 20 0 DIADLO Cc1c(C)c(C)c(C[N@H+]2Cc3cn[nH]c3C[C@@H](C)C2)c(C)c1C ZINC001620582951 1055971762 /nfs/dbraw/zinc/97/17/62/1055971762.db2.gz WCGQMEJDFPPMHH-GFCCVEGCSA-N 1 2 311.473 4.146 20 0 DIADLO CCn1cnc(Cl)c1C[NH2+]Cc1c(Cl)oc2ccccc21 ZINC001621005043 1055972507 /nfs/dbraw/zinc/97/25/07/1055972507.db2.gz RVSBNARAPRQJMH-UHFFFAOYSA-N 1 2 324.211 4.246 20 0 DIADLO COCc1ccc(C[NH2+][C@H](CCc2ccccc2)C(F)F)cc1 ZINC001621006181 1055973038 /nfs/dbraw/zinc/97/30/38/1055973038.db2.gz ABDRANWZXKCZDJ-GOSISDBHSA-N 1 2 319.395 4.189 20 0 DIADLO Cc1ccccc1C(F)(F)C[NH2+]Cc1ccc2ncccc2c1 ZINC001621018663 1055985164 /nfs/dbraw/zinc/98/51/64/1055985164.db2.gz GNQVCHCNEAYZQO-UHFFFAOYSA-N 1 2 312.363 4.425 20 0 DIADLO c1cn(-c2csc(CNc3cccc4c3CCCC4)c2)c[nH+]1 ZINC001620733098 1055989181 /nfs/dbraw/zinc/98/91/81/1055989181.db2.gz XKEXPACQJJXKCK-UHFFFAOYSA-N 1 2 309.438 4.425 20 0 DIADLO CSCCc1ccccc1NCc1c[nH+]c2ccc(C)cn12 ZINC001621028976 1055992310 /nfs/dbraw/zinc/99/23/10/1055992310.db2.gz YTYNPATVQRRFJS-UHFFFAOYSA-N 1 2 311.454 4.160 20 0 DIADLO COc1cccc2cc(C[NH2+][C@@H](CF)c3ccc(F)cc3)oc21 ZINC001621039910 1056001122 /nfs/dbraw/zinc/00/11/22/1056001122.db2.gz CJJIZKQFGVYMMA-INIZCTEOSA-N 1 2 317.335 4.381 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2cccc(-c3ccccc3)c2)cc1 ZINC001239652416 1056002900 /nfs/dbraw/zinc/00/29/00/1056002900.db2.gz RECHPRSWHBIPLP-FQEVSTJZSA-N 1 2 317.388 4.193 20 0 DIADLO F[C@H]1CCc2ccccc2[C@H]1[NH2+]Cc1nccc2c1CCCC2 ZINC001621043503 1056004978 /nfs/dbraw/zinc/00/49/78/1056004978.db2.gz IXCMEKCZWWPOIA-AZUAARDMSA-N 1 2 310.416 4.076 20 0 DIADLO C[C@H]([NH2+]Cc1cn(Cc2ccccc2)c2ccccc12)C(F)F ZINC001621045839 1056007327 /nfs/dbraw/zinc/00/73/27/1056007327.db2.gz JQDQSOJQAFYCFG-AWEZNQCLSA-N 1 2 314.379 4.433 20 0 DIADLO CCCn1nccc1CNc1[nH+]c2ccccc2n1C1CCCC1 ZINC001621051485 1056011349 /nfs/dbraw/zinc/01/13/49/1056011349.db2.gz GPLYHWJNFXZAGF-UHFFFAOYSA-N 1 2 323.444 4.370 20 0 DIADLO Clc1ccc2[nH]c(NCc3cnc4ccccc4c3)[nH+]c2c1 ZINC001621056926 1056013726 /nfs/dbraw/zinc/01/37/26/1056013726.db2.gz KLMXYBWODPGMGS-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2cc(C)on2)ccc1SC ZINC000068804541 1056018047 /nfs/dbraw/zinc/01/80/47/1056018047.db2.gz WHJFHUFYBRLUOK-HNNXBMFYSA-N 1 2 318.442 4.051 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2cc(C)on2)ccc1SC ZINC000068804541 1056018058 /nfs/dbraw/zinc/01/80/58/1056018058.db2.gz WHJFHUFYBRLUOK-HNNXBMFYSA-N 1 2 318.442 4.051 20 0 DIADLO COc1ccc([C@H](C)Nc2cccc[nH+]2)cc1Br ZINC000070792883 1056026320 /nfs/dbraw/zinc/02/63/20/1056026320.db2.gz TWGAWNARQJFGMO-JTQLQIEISA-N 1 2 307.191 4.026 20 0 DIADLO COc1ccc([C@@H](C)Nc2cccc[nH+]2)cc1Br ZINC000070792886 1056027797 /nfs/dbraw/zinc/02/77/97/1056027797.db2.gz TWGAWNARQJFGMO-SNVBAGLBSA-N 1 2 307.191 4.026 20 0 DIADLO c1cn(-c2cccc(OCc3cc(-c4ccccc4)no3)c2)c[nH+]1 ZINC000072674215 1056033529 /nfs/dbraw/zinc/03/35/29/1056033529.db2.gz IAYMMYJBNQNYBN-UHFFFAOYSA-N 1 2 317.348 4.106 20 0 DIADLO Cc1cc(F)c(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c(F)c1 ZINC001621331417 1056035783 /nfs/dbraw/zinc/03/57/83/1056035783.db2.gz KRBBBZCZKXDZHG-UONOGXRCSA-N 1 2 320.210 4.289 20 0 DIADLO Cc1cc(F)c(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c(F)c1 ZINC001621331417 1056035794 /nfs/dbraw/zinc/03/57/94/1056035794.db2.gz KRBBBZCZKXDZHG-UONOGXRCSA-N 1 2 320.210 4.289 20 0 DIADLO COc1ccc(F)cc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001239720938 1056040687 /nfs/dbraw/zinc/04/06/87/1056040687.db2.gz XSQAITMFXHUTQR-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1nc(-c2cccc(C)c2)no1 ZINC000073872298 1056047799 /nfs/dbraw/zinc/04/77/99/1056047799.db2.gz VYKACLQQWPEOHM-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1nc(-c2cccc(C)c2)no1 ZINC000073872298 1056047809 /nfs/dbraw/zinc/04/78/09/1056047809.db2.gz VYKACLQQWPEOHM-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO Cc1ccc(-n2cc[nH+]c2)c(C(=O)N(C)c2cc(C)cc(C)c2)c1 ZINC000074048656 1056049668 /nfs/dbraw/zinc/04/96/68/1056049668.db2.gz CEOMQDNJLQQITE-UHFFFAOYSA-N 1 2 319.408 4.074 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cc(C)cc(Cl)c1)CCO2 ZINC001621342768 1056053004 /nfs/dbraw/zinc/05/30/04/1056053004.db2.gz XZWATKJNBILJDZ-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cc(C)cc(Cl)c1)CCO2 ZINC001621342768 1056053009 /nfs/dbraw/zinc/05/30/09/1056053009.db2.gz XZWATKJNBILJDZ-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO Cc1c(-c2cncc(Oc3ccccc3)c2)ccc2[nH+]ccn21 ZINC001239759950 1056062916 /nfs/dbraw/zinc/06/29/16/1056062916.db2.gz NLMGDHOBDQYNLH-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)[C@@H]1CCC[C@@H]2CCCC[C@@H]12 ZINC001540719893 1056068364 /nfs/dbraw/zinc/06/83/64/1056068364.db2.gz ZETNSYYZAMWYLE-GVDBMIGSSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3CCCC[C@@H]3C)c2)[nH+]c1C ZINC001583354569 1056069648 /nfs/dbraw/zinc/06/96/48/1056069648.db2.gz GAIZPNSMDBZJFK-SJCJKPOMSA-N 1 2 311.429 4.458 20 0 DIADLO COc1cccc(-c2c[nH+]c(N3CCCCC3)cc2C)c1OC ZINC001239815325 1056086188 /nfs/dbraw/zinc/08/61/88/1056086188.db2.gz QTWOPMOLKUWTNN-UHFFFAOYSA-N 1 2 312.413 4.065 20 0 DIADLO Cc1cccc(Cl)c1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001542442239 1056124718 /nfs/dbraw/zinc/12/47/18/1056124718.db2.gz NYOYHHUDRHJGKP-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO COCOc1ccc(Cl)cc1Nc1cc[nH+]c(SC)c1 ZINC001214422786 1056134935 /nfs/dbraw/zinc/13/49/35/1056134935.db2.gz QRJHXZQYGQRFAW-UHFFFAOYSA-N 1 2 310.806 4.183 20 0 DIADLO CC(C)O[C@H]1C[C@H](Nc2ccc([NH+]3CCCC3)cc2)C1(C)C ZINC000765811334 1056152067 /nfs/dbraw/zinc/15/20/67/1056152067.db2.gz QAPCBEHOFDUFSE-ROUUACIJSA-N 1 2 302.462 4.291 20 0 DIADLO Cc1cc(NC(=O)C[C@H]2CCCC[C@H]2C)ccc1-n1cc[nH+]c1 ZINC001542875779 1056160781 /nfs/dbraw/zinc/16/07/81/1056160781.db2.gz TYZGVQAVTGDVSL-GDBMZVCRSA-N 1 2 311.429 4.336 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2CCCC[C@@H]2C2CC2)ccc1-n1cc[nH+]c1 ZINC001542877427 1056163334 /nfs/dbraw/zinc/16/33/34/1056163334.db2.gz VUCCHIHSSVPUIV-QZTJIDSGSA-N 1 2 323.440 4.336 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]C2(c3ccc(F)cc3)CCC2)n1 ZINC000921652407 1056164377 /nfs/dbraw/zinc/16/43/77/1056164377.db2.gz HXTJUAHVLUKODO-UHFFFAOYSA-N 1 2 302.393 4.280 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3ccoc3C3CC3)cc2)[nH+]c1C ZINC000921658085 1056168621 /nfs/dbraw/zinc/16/86/21/1056168621.db2.gz LABXJSZCSWMQQU-UHFFFAOYSA-N 1 2 321.380 4.416 20 0 DIADLO CSCCCCC(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1 ZINC000921661196 1056171629 /nfs/dbraw/zinc/17/16/29/1056171629.db2.gz GAJOTEJQWOAWGI-UHFFFAOYSA-N 1 2 317.458 4.165 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2c(F)cccc2OCOC)cc1 ZINC001214448971 1056178814 /nfs/dbraw/zinc/17/88/14/1056178814.db2.gz MFZFJFNJSWTNDS-UHFFFAOYSA-N 1 2 304.365 4.008 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2c(F)cccc2OCOC)cc1 ZINC001214448971 1056178825 /nfs/dbraw/zinc/17/88/25/1056178825.db2.gz MFZFJFNJSWTNDS-UHFFFAOYSA-N 1 2 304.365 4.008 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C3(C(F)F)CCC3)cc2)[nH+]c1C ZINC000921670188 1056179965 /nfs/dbraw/zinc/17/99/65/1056179965.db2.gz KXGKAYXHRZPQCX-UHFFFAOYSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3c(C)oc(C)c3C)cc2)[nH+]c1C ZINC000921669181 1056180769 /nfs/dbraw/zinc/18/07/69/1056180769.db2.gz ACCKVCCHZMUHMR-UHFFFAOYSA-N 1 2 323.396 4.464 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2cc3cccc(Cl)c3o2)c[nH+]1 ZINC001583839965 1056182674 /nfs/dbraw/zinc/18/26/74/1056182674.db2.gz YFZXVQJJQIIYGH-UHFFFAOYSA-N 1 2 314.772 4.028 20 0 DIADLO CCC[C@@H]1CCCC[C@H]1CNC(=O)c1c(C)cc(C)[nH+]c1C ZINC001583876296 1056191862 /nfs/dbraw/zinc/19/18/62/1056191862.db2.gz DICSXWQWIPBCEL-SJORKVTESA-N 1 2 302.462 4.343 20 0 DIADLO CCN(CCNc1cc(C)[nH+]c(C2CCC2)n1)c1ccccc1C ZINC001611809394 1056193614 /nfs/dbraw/zinc/19/36/14/1056193614.db2.gz KKDVMXBOQNJWDN-UHFFFAOYSA-N 1 2 324.472 4.299 20 0 DIADLO Cc1cc(NCCOc2ccc3c(c2)CCC3)nc(C2CCC2)[nH+]1 ZINC001611840117 1056197277 /nfs/dbraw/zinc/19/72/77/1056197277.db2.gz ZZOGYDXSEWJPFT-UHFFFAOYSA-N 1 2 323.440 4.032 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(OC(C)C)cc1 ZINC001239961039 1056200981 /nfs/dbraw/zinc/20/09/81/1056200981.db2.gz JEFCFOHVIDSEBP-UHFFFAOYSA-N 1 2 308.381 4.335 20 0 DIADLO CCCOc1ccc(-c2cn3cc[nH+]c3cc2C)c(F)c1F ZINC001239968015 1056206152 /nfs/dbraw/zinc/20/61/52/1056206152.db2.gz BKWXYDHPCMFQDE-UHFFFAOYSA-N 1 2 302.324 4.377 20 0 DIADLO CC(C)c1cc(NCCCc2ccc(O)cc2)nc(C(C)C)[nH+]1 ZINC001611965197 1056217618 /nfs/dbraw/zinc/21/76/18/1056217618.db2.gz SNOLWGNUPVFTJZ-UHFFFAOYSA-N 1 2 313.445 4.474 20 0 DIADLO Fc1ccc(-c2cc[nH+]c3c2CCN3)c(OCc2ccccc2)c1 ZINC001239982546 1056221039 /nfs/dbraw/zinc/22/10/39/1056221039.db2.gz YVTKOVKICQLAMN-UHFFFAOYSA-N 1 2 320.367 4.077 20 0 DIADLO CC(C)C1CCC(Nc2[nH+]cnc3c2cnn3C(C)(C)C)CC1 ZINC001612109191 1056240272 /nfs/dbraw/zinc/24/02/72/1056240272.db2.gz HPKXIORIEBUJTC-UHFFFAOYSA-N 1 2 315.465 4.208 20 0 DIADLO Cc1nc(N[C@@H](C)[C@@H](C)c2ccccc2C(F)(F)F)cc[nH+]1 ZINC001612148804 1056244730 /nfs/dbraw/zinc/24/47/30/1056244730.db2.gz IWSGACIJMAENAL-MNOVXSKESA-N 1 2 309.335 4.408 20 0 DIADLO Cc1cc(NCCCNc2cccc(F)c2)nc(C2CCC2)[nH+]1 ZINC001612181899 1056250312 /nfs/dbraw/zinc/25/03/12/1056250312.db2.gz ROUYHYULSVGUGN-UHFFFAOYSA-N 1 2 314.408 4.106 20 0 DIADLO COc1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc1Cl ZINC001240034038 1056270477 /nfs/dbraw/zinc/27/04/77/1056270477.db2.gz LLWFYOQWAPNPJZ-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO CC1CCC(C)(CNc2[nH+]cnc3c2cnn3C(C)(C)C)CC1 ZINC001612343357 1056275631 /nfs/dbraw/zinc/27/56/31/1056275631.db2.gz ULIGECLTBXREPP-UHFFFAOYSA-N 1 2 315.465 4.210 20 0 DIADLO CCc1cc(N2C[C@H](c3ccccc3)[C@@H]3CCC[C@@H]32)nc(CC)[nH+]1 ZINC001612357206 1056277824 /nfs/dbraw/zinc/27/78/24/1056277824.db2.gz CTWPQODKVJLXTD-OTWHNJEPSA-N 1 2 321.468 4.374 20 0 DIADLO Cc1cc(NCC[C@@]2(C)CC2(Cl)Cl)nc(C2CC2)[nH+]1 ZINC001612388488 1056281142 /nfs/dbraw/zinc/28/11/42/1056281142.db2.gz GXTKFEWVTQOVGK-ZDUSSCGKSA-N 1 2 300.233 4.048 20 0 DIADLO CCN(CC)C(=O)c1cccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001240055903 1056289929 /nfs/dbraw/zinc/28/99/29/1056289929.db2.gz DSIDTHWOBBVAQS-UHFFFAOYSA-N 1 2 319.408 4.226 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3cc(C)cc4ccccc43)ccn12 ZINC001543749651 1056291807 /nfs/dbraw/zinc/29/18/07/1056291807.db2.gz GJHXQMQMCGCORJ-UHFFFAOYSA-N 1 2 315.376 4.357 20 0 DIADLO CC(C)(C)[C@H]1CCC[C@@H]1Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001612471897 1056295694 /nfs/dbraw/zinc/29/56/94/1056295694.db2.gz ZXKDOCXYZVJTFL-KBPBESRZSA-N 1 2 315.465 4.208 20 0 DIADLO Cc1ccc(CN(C)c2nc3ccccc3n3c[nH+]cc23)cc1C ZINC001612487223 1056295749 /nfs/dbraw/zinc/29/57/49/1056295749.db2.gz BBKPIOLMZDEEJM-UHFFFAOYSA-N 1 2 316.408 4.136 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1ccc2c(c1)oc1ccccc12 ZINC001584256673 1056299272 /nfs/dbraw/zinc/29/92/72/1056299272.db2.gz JSZVCQGRTLXJET-UHFFFAOYSA-N 1 2 316.360 4.272 20 0 DIADLO CC(C)c1cc(N[C@@H](C2CC2)[C@H]2CCCCO2)nc(C(C)C)[nH+]1 ZINC001612549146 1056304427 /nfs/dbraw/zinc/30/44/27/1056304427.db2.gz WUAFJPORLMRTMZ-AEFFLSMTSA-N 1 2 317.477 4.483 20 0 DIADLO COc1ccc2cc(N[C@@H]3CCNc4ccccc43)[nH+]cc2c1 ZINC001168641244 1056315409 /nfs/dbraw/zinc/31/54/09/1056315409.db2.gz SGVWZXDINHCJBL-GOSISDBHSA-N 1 2 305.381 4.212 20 0 DIADLO COc1ccc2cc(N[C@H]3CCNc4ccccc43)[nH+]cc2c1 ZINC001168641245 1056316440 /nfs/dbraw/zinc/31/64/40/1056316440.db2.gz SGVWZXDINHCJBL-SFHVURJKSA-N 1 2 305.381 4.212 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cnn(C3CCOCC3)c2)c1 ZINC001240094343 1056321466 /nfs/dbraw/zinc/32/14/66/1056321466.db2.gz FUNGWFIYRXGALE-UHFFFAOYSA-N 1 2 313.445 4.056 20 0 DIADLO COc1ccc(-c2ccc(-c3nc4[nH]ccc4c[nH+]3)cc2)cc1 ZINC001240096849 1056321785 /nfs/dbraw/zinc/32/17/85/1056321785.db2.gz CTXWPJRZHASJSY-UHFFFAOYSA-N 1 2 301.349 4.252 20 0 DIADLO Cc1cc(N2CCC[C@](F)(c3ccccc3)C2)nc(C2CC2)[nH+]1 ZINC001612785669 1056327263 /nfs/dbraw/zinc/32/72/63/1056327263.db2.gz CUQIFQMJKOWWNN-LJQANCHMSA-N 1 2 311.404 4.128 20 0 DIADLO Cc1nc(N[C@H]2c3ccccc3CC[C@H]2F)c2c([nH+]1)CCCC2 ZINC001612807341 1056328925 /nfs/dbraw/zinc/32/89/25/1056328925.db2.gz SOXYSEPBXMSMJJ-AEFFLSMTSA-N 1 2 311.404 4.101 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(N[C@H]2CCNc3ccccc32)c1 ZINC001168645286 1056340577 /nfs/dbraw/zinc/34/05/77/1056340577.db2.gz ONVBJZFBSBOFRL-SFHVURJKSA-N 1 2 304.397 4.056 20 0 DIADLO CCNc1ccc(Nc2cc(C(C)(C)C)nc(C(C)C)n2)c[nH+]1 ZINC001613083127 1056350309 /nfs/dbraw/zinc/35/03/09/1056350309.db2.gz XOBPQRTUAVPHLA-UHFFFAOYSA-N 1 2 313.449 4.468 20 0 DIADLO CCCCn1c(SC[C@@H]2C[C@H]2CC)nnc1[C@H](CC)[NH+](C)C ZINC001613148739 1056352732 /nfs/dbraw/zinc/35/27/32/1056352732.db2.gz RWABZMKUAXVEMX-ILXRZTDVSA-N 1 2 324.538 4.229 20 0 DIADLO COC(=O)c1ccc(C(C)(C)C)c(-c2ccc3[nH+]ccn3c2)c1 ZINC001240218343 1056374865 /nfs/dbraw/zinc/37/48/65/1056374865.db2.gz BAPSEXCKWOZMGV-UHFFFAOYSA-N 1 2 308.381 4.085 20 0 DIADLO Cc1nc2sc3c(c2c(-c2ccc4[nH+]ccn4c2)n1)CCCC3 ZINC001240216940 1056375137 /nfs/dbraw/zinc/37/51/37/1056375137.db2.gz TWYMZBRWFFKTIS-UHFFFAOYSA-N 1 2 320.421 4.193 20 0 DIADLO CC(C)(C)C(=O)Nc1cc(F)ccc1-c1ccc2[nH+]ccn2c1 ZINC001240218407 1056376354 /nfs/dbraw/zinc/37/63/54/1056376354.db2.gz MUIYASDCLPYKGC-UHFFFAOYSA-N 1 2 311.360 4.125 20 0 DIADLO c1cn2cc(-c3nc(-c4ccncc4)nc4ccccc43)ccc2[nH+]1 ZINC001240216834 1056376725 /nfs/dbraw/zinc/37/67/25/1056376725.db2.gz OPEXBFNPBKJJAV-UHFFFAOYSA-N 1 2 323.359 4.007 20 0 DIADLO C[N@H+](Cc1noc2c1CCCC2)Cc1ccc(C(F)(F)F)cc1 ZINC000108850609 1056376930 /nfs/dbraw/zinc/37/69/30/1056376930.db2.gz GSSGRQAQAUVQLU-UHFFFAOYSA-N 1 2 324.346 4.204 20 0 DIADLO C[N@@H+](Cc1noc2c1CCCC2)Cc1ccc(C(F)(F)F)cc1 ZINC000108850609 1056376942 /nfs/dbraw/zinc/37/69/42/1056376942.db2.gz GSSGRQAQAUVQLU-UHFFFAOYSA-N 1 2 324.346 4.204 20 0 DIADLO Fc1cccc(COc2ccc(-c3ccc4[nH+]ccn4c3)cn2)c1 ZINC001240222133 1056377490 /nfs/dbraw/zinc/37/74/90/1056377490.db2.gz ZOMBUITYCCGSTC-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO Fc1ccccc1COc1ccc(-c2ccc3[nH+]ccn3c2)cn1 ZINC001240221034 1056378375 /nfs/dbraw/zinc/37/83/75/1056378375.db2.gz DSHLBLDFZQROES-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO c1coc(C[N@H+](Cc2noc3c2CCCC3)C2CCCC2)c1 ZINC000108854724 1056378777 /nfs/dbraw/zinc/37/87/77/1056378777.db2.gz IHEDSWRMNZDCKT-UHFFFAOYSA-N 1 2 300.402 4.091 20 0 DIADLO c1coc(C[N@@H+](Cc2noc3c2CCCC3)C2CCCC2)c1 ZINC000108854724 1056378782 /nfs/dbraw/zinc/37/87/82/1056378782.db2.gz IHEDSWRMNZDCKT-UHFFFAOYSA-N 1 2 300.402 4.091 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1noc2c1CCCC2 ZINC000108851961 1056379299 /nfs/dbraw/zinc/37/92/99/1056379299.db2.gz NKOOEIWPFVSYOB-ZDUSSCGKSA-N 1 2 310.397 4.493 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1noc2c1CCCC2 ZINC000108851961 1056379316 /nfs/dbraw/zinc/37/93/16/1056379316.db2.gz NKOOEIWPFVSYOB-ZDUSSCGKSA-N 1 2 310.397 4.493 20 0 DIADLO Fc1ccc(COc2ccccc2-c2cc[nH+]c3c2CCN3)cc1 ZINC001240266462 1056399357 /nfs/dbraw/zinc/39/93/57/1056399357.db2.gz QHSFQOSHDPXLNS-UHFFFAOYSA-N 1 2 320.367 4.435 20 0 DIADLO Cn1cc(-c2ccc(-c3cc[nH+]c(N4CCCCC4)c3)cc2)cn1 ZINC001240363786 1056449005 /nfs/dbraw/zinc/44/90/05/1056449005.db2.gz QWHNDUBYPMTNCK-UHFFFAOYSA-N 1 2 318.424 4.139 20 0 DIADLO Cc1cc(NC(=O)C2=CCC(C)(C)CC2)ccc1-n1cc[nH+]c1 ZINC001584949129 1056450293 /nfs/dbraw/zinc/45/02/93/1056450293.db2.gz XXPVEYKUWCFAKZ-UHFFFAOYSA-N 1 2 309.413 4.256 20 0 DIADLO C/C(=C/C(=O)NCc1c[nH+]c(C)cc1C)c1cccc(Cl)c1 ZINC001585012012 1056463572 /nfs/dbraw/zinc/46/35/72/1056463572.db2.gz REXAVOOYGGVGRU-JYRVWZFOSA-N 1 2 314.816 4.072 20 0 DIADLO CC[N@H+](Cc1nc2c(o1)CCCC2)Cc1cccc(Cl)c1 ZINC001615177098 1056471380 /nfs/dbraw/zinc/47/13/80/1056471380.db2.gz SFUCLVNFZKITCJ-UHFFFAOYSA-N 1 2 304.821 4.229 20 0 DIADLO CC[N@@H+](Cc1nc2c(o1)CCCC2)Cc1cccc(Cl)c1 ZINC001615177098 1056471386 /nfs/dbraw/zinc/47/13/86/1056471386.db2.gz SFUCLVNFZKITCJ-UHFFFAOYSA-N 1 2 304.821 4.229 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2ccncc2Br)cc1 ZINC001615175358 1056472330 /nfs/dbraw/zinc/47/23/30/1056472330.db2.gz FEQXWGNCYUHEEH-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2ccncc2Br)cc1 ZINC001615175358 1056472334 /nfs/dbraw/zinc/47/23/34/1056472334.db2.gz FEQXWGNCYUHEEH-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO CCc1nc([C@H]2CCCC[N@@H+]2CCCSC(C)(C)C)no1 ZINC001615214379 1056477979 /nfs/dbraw/zinc/47/79/79/1056477979.db2.gz BGOIMPUKNMZKDB-CYBMUJFWSA-N 1 2 311.495 4.081 20 0 DIADLO CCc1nc([C@H]2CCCC[N@H+]2CCCSC(C)(C)C)no1 ZINC001615214379 1056477987 /nfs/dbraw/zinc/47/79/87/1056477987.db2.gz BGOIMPUKNMZKDB-CYBMUJFWSA-N 1 2 311.495 4.081 20 0 DIADLO FC(F)(F)c1cc(C[NH2+]Cc2ccon2)cc(C(F)(F)F)c1 ZINC000388653881 1056480318 /nfs/dbraw/zinc/48/03/18/1056480318.db2.gz SCKGERLYBMGJLD-UHFFFAOYSA-N 1 2 324.224 4.002 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2cc(C)cnc2Cl)C2CC2)n1 ZINC000921783128 1056488140 /nfs/dbraw/zinc/48/81/40/1056488140.db2.gz NSXDXUCUAPKCLT-CYBMUJFWSA-N 1 2 307.850 4.049 20 0 DIADLO CCC[N@H+](Cc1ccc(F)cc1F)Cc1cc(CO)ccc1F ZINC001615314046 1056492407 /nfs/dbraw/zinc/49/24/07/1056492407.db2.gz SLZKMRBFUQCLFM-UHFFFAOYSA-N 1 2 323.358 4.008 20 0 DIADLO CCC[N@@H+](Cc1ccc(F)cc1F)Cc1cc(CO)ccc1F ZINC001615314046 1056492416 /nfs/dbraw/zinc/49/24/16/1056492416.db2.gz SLZKMRBFUQCLFM-UHFFFAOYSA-N 1 2 323.358 4.008 20 0 DIADLO CC[C@@H]1C[N@H+](CCc2c(Cl)cccc2Cl)C[C@@H](C)O1 ZINC001615535388 1056530953 /nfs/dbraw/zinc/53/09/53/1056530953.db2.gz DNSLHXRWLQZNPB-VXGBXAGGSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)C[C@@H](C)O1 ZINC001615535388 1056530967 /nfs/dbraw/zinc/53/09/67/1056530967.db2.gz DNSLHXRWLQZNPB-VXGBXAGGSA-N 1 2 302.245 4.035 20 0 DIADLO CC(C)CC(CC(C)C)NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001585346417 1056533552 /nfs/dbraw/zinc/53/35/52/1056533552.db2.gz HRYPDSQRJKYWGZ-QGZVFWFLSA-N 1 2 307.482 4.047 20 0 DIADLO Fc1ccc2nc(C(F)F)nc(-c3ccn4cc[nH+]c4c3)c2c1 ZINC001240504073 1056542717 /nfs/dbraw/zinc/54/27/17/1056542717.db2.gz XKVXAEKIIWSATL-UHFFFAOYSA-N 1 2 314.270 4.021 20 0 DIADLO Fc1cc(-c2ccn3cc[nH+]c3c2)cc(F)c1OC(F)(F)F ZINC001240508517 1056544257 /nfs/dbraw/zinc/54/42/57/1056544257.db2.gz APGGMBGTOHHGTG-UHFFFAOYSA-N 1 2 314.213 4.178 20 0 DIADLO C[C@H](Nc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)nn1)C(C)(C)C ZINC001168683321 1056546014 /nfs/dbraw/zinc/54/60/14/1056546014.db2.gz DZQXPZNCFWFDFH-AWEZNQCLSA-N 1 2 321.428 4.176 20 0 DIADLO O=C(c1ccc(F)cc1)[C@H]1CCC[N@H+](CC=C(Cl)Cl)C1 ZINC001615629545 1056546030 /nfs/dbraw/zinc/54/60/30/1056546030.db2.gz GHEHJQPPPOFKRH-LBPRGKRZSA-N 1 2 316.203 4.039 20 0 DIADLO O=C(c1ccc(F)cc1)[C@H]1CCC[N@@H+](CC=C(Cl)Cl)C1 ZINC001615629545 1056546041 /nfs/dbraw/zinc/54/60/41/1056546041.db2.gz GHEHJQPPPOFKRH-LBPRGKRZSA-N 1 2 316.203 4.039 20 0 DIADLO CC(C)(C)OC(=O)c1ccc(F)cc1-c1ccn2cc[nH+]c2c1 ZINC001240512580 1056547268 /nfs/dbraw/zinc/54/72/68/1056547268.db2.gz VWOMAGFVVDCWQG-UHFFFAOYSA-N 1 2 312.344 4.096 20 0 DIADLO c1cc(-c2cc[nH+]c(N3CCCCC3)c2)cc(N2CCCC2)c1 ZINC001240534762 1056558553 /nfs/dbraw/zinc/55/85/53/1056558553.db2.gz JJXOKIUWLVSXNS-UHFFFAOYSA-N 1 2 307.441 4.339 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+][C@H]2CCCc3cn[nH]c32)c1Cl ZINC000921862465 1056570450 /nfs/dbraw/zinc/57/04/50/1056570450.db2.gz RLUNAFZJQJEVJG-ZDUSSCGKSA-N 1 2 310.228 4.192 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+][C@H]2CCCc3c[nH]nc32)c1Cl ZINC000921862465 1056570464 /nfs/dbraw/zinc/57/04/64/1056570464.db2.gz RLUNAFZJQJEVJG-ZDUSSCGKSA-N 1 2 310.228 4.192 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)no1 ZINC000111305498 1056574417 /nfs/dbraw/zinc/57/44/17/1056574417.db2.gz GTTCTQMIJIYBIU-ZDUSSCGKSA-N 1 2 319.836 4.010 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)no1 ZINC000111305498 1056574431 /nfs/dbraw/zinc/57/44/31/1056574431.db2.gz GTTCTQMIJIYBIU-ZDUSSCGKSA-N 1 2 319.836 4.010 20 0 DIADLO CCC1(O)CCC(Nc2cc[nH+]c3c(Cl)cccc23)CC1 ZINC000672246120 1056586016 /nfs/dbraw/zinc/58/60/16/1056586016.db2.gz KCYZHMNGROBVEQ-UHFFFAOYSA-N 1 2 304.821 4.384 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+]1CCOC2(C1)CCCCCC2 ZINC001615868535 1056588629 /nfs/dbraw/zinc/58/86/29/1056588629.db2.gz RUGLMPNWTGRRKS-CQSZACIVSA-N 1 2 309.400 4.451 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+]1CCOC2(C1)CCCCCC2 ZINC001615868535 1056588646 /nfs/dbraw/zinc/58/86/46/1056588646.db2.gz RUGLMPNWTGRRKS-CQSZACIVSA-N 1 2 309.400 4.451 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(N3CCCCC3)nc2)c1 ZINC001240585620 1056593902 /nfs/dbraw/zinc/59/39/02/1056593902.db2.gz NMXHJBWTXSMINB-UHFFFAOYSA-N 1 2 318.424 4.139 20 0 DIADLO Cc1nc(C)c(C[N@H+](C)Cc2nc3ccccc3s2)s1 ZINC000172737412 1056599798 /nfs/dbraw/zinc/59/97/98/1056599798.db2.gz LELGPJIZZHRPSI-UHFFFAOYSA-N 1 2 303.456 4.002 20 0 DIADLO Cc1nc(C)c(C[N@@H+](C)Cc2nc3ccccc3s2)s1 ZINC000172737412 1056599810 /nfs/dbraw/zinc/59/98/10/1056599810.db2.gz LELGPJIZZHRPSI-UHFFFAOYSA-N 1 2 303.456 4.002 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc(N3CCCC3)cc2)cc1F ZINC001240591611 1056599996 /nfs/dbraw/zinc/59/99/96/1056599996.db2.gz MACUPZYTBJLWBX-UHFFFAOYSA-N 1 2 316.395 4.294 20 0 DIADLO CCc1ncc(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)o1 ZINC001616013937 1056605405 /nfs/dbraw/zinc/60/54/05/1056605405.db2.gz OSDFYIZYKQRHMV-IBGZPJMESA-N 1 2 310.372 4.255 20 0 DIADLO CCCN(Cc1cc[nH+]c(N(C)C)c1)c1ccc(Cl)cc1 ZINC001616026636 1056607573 /nfs/dbraw/zinc/60/75/73/1056607573.db2.gz SRQDHZVFSRHSQM-UHFFFAOYSA-N 1 2 303.837 4.218 20 0 DIADLO CCCCC[N@@H+]1CCc2[nH]c3c(cccc3Br)c2C1 ZINC001616158312 1056614718 /nfs/dbraw/zinc/61/47/18/1056614718.db2.gz CJLBKHWZMFGCHP-UHFFFAOYSA-N 1 2 321.262 4.479 20 0 DIADLO CCCCC[N@H+]1CCc2[nH]c3c(cccc3Br)c2C1 ZINC001616158312 1056614721 /nfs/dbraw/zinc/61/47/21/1056614721.db2.gz CJLBKHWZMFGCHP-UHFFFAOYSA-N 1 2 321.262 4.479 20 0 DIADLO CCSCc1cc[nH+]c(NCc2nc(C(C)(C)C)co2)c1 ZINC000921942721 1056657810 /nfs/dbraw/zinc/65/78/10/1056657810.db2.gz BOJHYCKJTQGXQN-UHFFFAOYSA-N 1 2 305.447 4.232 20 0 DIADLO COc1ccc(C)cc1C[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000076900769 1056665392 /nfs/dbraw/zinc/66/53/92/1056665392.db2.gz BJVDABAYHYZOGE-ZDUSSCGKSA-N 1 2 304.459 4.434 20 0 DIADLO Cc1[nH+]ccn1-c1ccc(Nc2cc(F)c(O)c(Cl)c2)cc1 ZINC001214488961 1056675267 /nfs/dbraw/zinc/67/52/67/1056675267.db2.gz RFHIMBHCQXQNQG-UHFFFAOYSA-N 1 2 317.751 4.422 20 0 DIADLO CSc1ccc([C@H](C)NC(=O)c2c(C)cc(C)[nH+]c2C)cc1 ZINC001586147579 1056682944 /nfs/dbraw/zinc/68/29/44/1056682944.db2.gz JOZNLHOMUKDGMU-ZDUSSCGKSA-N 1 2 314.454 4.220 20 0 DIADLO FC(F)(F)c1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)cc1 ZINC001240819443 1056712951 /nfs/dbraw/zinc/71/29/51/1056712951.db2.gz QPCJBUFHHWDPJQ-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO COc1ccc(C(F)(F)F)cc1-c1cc(C)cn2cc[nH+]c12 ZINC001240826293 1056721903 /nfs/dbraw/zinc/72/19/03/1056721903.db2.gz NSUOQWAPWNWSAO-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1noc2c1CCCC2 ZINC000672577372 1056727507 /nfs/dbraw/zinc/72/75/07/1056727507.db2.gz UXRMLWXCYLSZIA-QGZVFWFLSA-N 1 2 314.429 4.145 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1noc2c1CCCC2 ZINC000672577372 1056727519 /nfs/dbraw/zinc/72/75/19/1056727519.db2.gz UXRMLWXCYLSZIA-QGZVFWFLSA-N 1 2 314.429 4.145 20 0 DIADLO COCCC[C@@H]([NH2+][C@H]1CCCC1(F)F)c1ccc(F)cc1 ZINC000672622275 1056738496 /nfs/dbraw/zinc/73/84/96/1056738496.db2.gz VMWVKLQWBTULAA-CABCVRRESA-N 1 2 301.352 4.071 20 0 DIADLO FC(F)(F)c1cnc2c(c1)[C@H]([NH2+][C@@H]1CCCC1(F)F)CCC2 ZINC000672622513 1056738572 /nfs/dbraw/zinc/73/85/72/1056738572.db2.gz ZYGMOEXUHWCUCE-CHWSQXEVSA-N 1 2 320.305 4.255 20 0 DIADLO Nc1cc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc[nH+]1 ZINC001240885894 1056740594 /nfs/dbraw/zinc/74/05/94/1056740594.db2.gz PHZDKIKEPGDKOH-UHFFFAOYSA-N 1 2 306.209 4.368 20 0 DIADLO CC(C)[C@H]([NH2+][C@H]1CCCC1(F)F)c1ccc2[nH]c(=O)oc2c1 ZINC000672621894 1056741071 /nfs/dbraw/zinc/74/10/71/1056741071.db2.gz NDFDUZKGIZZNQI-KBPBESRZSA-N 1 2 310.344 4.008 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2ccn(C(F)F)n2)o1 ZINC000347680856 1056749557 /nfs/dbraw/zinc/74/95/57/1056749557.db2.gz KQJCREDBGGQLQP-CQSZACIVSA-N 1 2 309.360 4.297 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2ccn(C(F)F)n2)o1 ZINC000347680856 1056749562 /nfs/dbraw/zinc/74/95/62/1056749562.db2.gz KQJCREDBGGQLQP-CQSZACIVSA-N 1 2 309.360 4.297 20 0 DIADLO C[C@H](c1ccccc1)N(C(=O)Nc1ccc2[nH+]ccn2c1)C1CC1 ZINC000672668742 1056752725 /nfs/dbraw/zinc/75/27/25/1056752725.db2.gz WAWQUOSFLPZPQJ-CQSZACIVSA-N 1 2 320.396 4.092 20 0 DIADLO C[C@@H](c1ccccc1)N(C(=O)Nc1ccc2[nH+]ccn2c1)C1CC1 ZINC000672668732 1056753462 /nfs/dbraw/zinc/75/34/62/1056753462.db2.gz WAWQUOSFLPZPQJ-AWEZNQCLSA-N 1 2 320.396 4.092 20 0 DIADLO Cc1ccc(F)cc1-c1ncnc2c1C[N@H+](Cc1ccccc1)C2 ZINC001240916845 1056757807 /nfs/dbraw/zinc/75/78/07/1056757807.db2.gz HAQISYFRHLVEGG-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO Cc1ccc(F)cc1-c1ncnc2c1C[N@@H+](Cc1ccccc1)C2 ZINC001240916845 1056757821 /nfs/dbraw/zinc/75/78/21/1056757821.db2.gz HAQISYFRHLVEGG-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO CC(C)(C)OCc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)cc1 ZINC001240941706 1056770787 /nfs/dbraw/zinc/77/07/87/1056770787.db2.gz PVCACIRSMDFHEB-UHFFFAOYSA-N 1 2 321.424 4.309 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H]2CCC[C@H](C(C)C)CC2)c(C)[nH+]1 ZINC001128319218 1056779319 /nfs/dbraw/zinc/77/93/19/1056779319.db2.gz PDFQAEUXLBVJPC-IRXDYDNUSA-N 1 2 302.462 4.342 20 0 DIADLO CCc1ccc([C@H]2C[N@H+](Cc3ccc(C)c(F)c3)CCO2)cc1 ZINC001617215284 1056794653 /nfs/dbraw/zinc/79/46/53/1056794653.db2.gz FNNHNHNXHFSUKL-HXUWFJFHSA-N 1 2 313.416 4.270 20 0 DIADLO CCc1ccc([C@H]2C[N@@H+](Cc3ccc(C)c(F)c3)CCO2)cc1 ZINC001617215284 1056794667 /nfs/dbraw/zinc/79/46/67/1056794667.db2.gz FNNHNHNXHFSUKL-HXUWFJFHSA-N 1 2 313.416 4.270 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1NC(=O)CCc1[nH]cc[nH+]1 ZINC000672879551 1056796953 /nfs/dbraw/zinc/79/69/53/1056796953.db2.gz SUEVFFATJHPSFP-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO CCCCC[C@H]1CCCCN1C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC001586809164 1056809955 /nfs/dbraw/zinc/80/99/55/1056809955.db2.gz WXHAVUUGBMQTDC-KRWDZBQOSA-N 1 2 313.445 4.218 20 0 DIADLO CC(C)CCC[C@@H](C)N(CCC(C)C)C(=O)Cc1c[nH+]cn1C ZINC000672940414 1056818478 /nfs/dbraw/zinc/81/84/78/1056818478.db2.gz CNCAAFVBGUHSTC-QGZVFWFLSA-N 1 2 321.509 4.052 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(C)c(OC)c(C)c1 ZINC001241019416 1056822704 /nfs/dbraw/zinc/82/27/04/1056822704.db2.gz JFRBULJRURYYIW-UHFFFAOYSA-N 1 2 308.381 4.173 20 0 DIADLO Cc1ccc(F)cc1NC(=O)C[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC001586961443 1056839810 /nfs/dbraw/zinc/83/98/10/1056839810.db2.gz WDTSZCQIJUVVAC-INIZCTEOSA-N 1 2 323.371 4.018 20 0 DIADLO CCSc1cccc(C[NH2+]Cc2nc(C(C)(C)C)co2)c1 ZINC000922143531 1056843272 /nfs/dbraw/zinc/84/32/72/1056843272.db2.gz PRIUXQKHPMIWGL-UHFFFAOYSA-N 1 2 304.459 4.374 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1c(F)ccc(F)c1F ZINC001241047976 1056843767 /nfs/dbraw/zinc/84/37/67/1056843767.db2.gz VGKCGAUNNBIOAC-UHFFFAOYSA-N 1 2 306.331 4.465 20 0 DIADLO CC1=CCC[N@H+](Cc2ccc(Br)cc2Cl)C1 ZINC001617546286 1056846417 /nfs/dbraw/zinc/84/64/17/1056846417.db2.gz CWXPRGFPKINFLM-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO CC1=CCC[N@@H+](Cc2ccc(Br)cc2Cl)C1 ZINC001617546286 1056846423 /nfs/dbraw/zinc/84/64/23/1056846423.db2.gz CWXPRGFPKINFLM-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO CCOc1ccc(-c2ccn3cc(N)[nH+]c3c2)cc1C(F)(F)F ZINC001241055135 1056851726 /nfs/dbraw/zinc/85/17/26/1056851726.db2.gz ORGKAHYPMHGGDH-UHFFFAOYSA-N 1 2 321.302 4.001 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@H]2CCCc3c(F)cccc32)n1 ZINC000922150975 1056854937 /nfs/dbraw/zinc/85/49/37/1056854937.db2.gz WQSWPKDURWLLBR-HNNXBMFYSA-N 1 2 302.393 4.278 20 0 DIADLO CCOc1cc(F)c(-c2ccc(Cn3cc[nH+]c3)cc2)cc1F ZINC001241074686 1056866160 /nfs/dbraw/zinc/86/61/60/1056866160.db2.gz RYAIHEUTRITIBW-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO COc1ccc(-c2cccc3[nH+]c(C)cn32)cc1C(F)(F)F ZINC001241090627 1056882067 /nfs/dbraw/zinc/88/20/67/1056882067.db2.gz FFBHYCZLTHAQKI-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Fc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)cc1C(F)(F)F ZINC001241093647 1056886671 /nfs/dbraw/zinc/88/66/71/1056886671.db2.gz JMZOPNKDKZOBCK-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1CNc1ccc(C2CC2)cc1 ZINC000682154765 1056891307 /nfs/dbraw/zinc/89/13/07/1056891307.db2.gz BHVQFWZKEPOOAD-UHFFFAOYSA-N 1 2 303.409 4.421 20 0 DIADLO CC[N@H+](CC(=O)NC(CC)(CC)CC)Cc1ccccc1Cl ZINC001617877815 1056894827 /nfs/dbraw/zinc/89/48/27/1056894827.db2.gz NURYHQCPIUJUQF-UHFFFAOYSA-N 1 2 324.896 4.247 20 0 DIADLO CC[N@@H+](CC(=O)NC(CC)(CC)CC)Cc1ccccc1Cl ZINC001617877815 1056894832 /nfs/dbraw/zinc/89/48/32/1056894832.db2.gz NURYHQCPIUJUQF-UHFFFAOYSA-N 1 2 324.896 4.247 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(F)cc1C(F)(F)F ZINC001241124781 1056910147 /nfs/dbraw/zinc/91/01/47/1056910147.db2.gz AILXKZCGWNHBJI-UHFFFAOYSA-N 1 2 310.250 4.168 20 0 DIADLO Cc1cc(NC(=O)c2csc(-c3ccccc3C)n2)cc[nH+]1 ZINC000067105995 1056920686 /nfs/dbraw/zinc/92/06/86/1056920686.db2.gz CNNQHOBMXLCSPG-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1ccc(F)cc1Cl)C2 ZINC001618122199 1056925938 /nfs/dbraw/zinc/92/59/38/1056925938.db2.gz JCXQPVDCOQEYOZ-UHFFFAOYSA-N 1 2 317.791 4.232 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@H+](Cc1ccc(F)cc1Cl)C2 ZINC001618122199 1056925942 /nfs/dbraw/zinc/92/59/42/1056925942.db2.gz JCXQPVDCOQEYOZ-UHFFFAOYSA-N 1 2 317.791 4.232 20 0 DIADLO CCOc1ccc(C)cc1-c1ccc(-n2cc[nH+]c2)cc1OC ZINC001241148197 1056928236 /nfs/dbraw/zinc/92/82/36/1056928236.db2.gz ITZWDPLOARDQEZ-UHFFFAOYSA-N 1 2 308.381 4.255 20 0 DIADLO Cc1ccnc(C[N@@H+](C)[C@@H](C)c2ccccc2Br)c1 ZINC000683004764 1056928546 /nfs/dbraw/zinc/92/85/46/1056928546.db2.gz OSSWVKLJJJHUAE-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccnc(C[N@H+](C)[C@@H](C)c2ccccc2Br)c1 ZINC000683004764 1056928554 /nfs/dbraw/zinc/92/85/54/1056928554.db2.gz OSSWVKLJJJHUAE-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccnc1OC(C)(C)C ZINC001241152205 1056929030 /nfs/dbraw/zinc/92/90/30/1056929030.db2.gz QDMLGGHBEGYNCR-UHFFFAOYSA-N 1 2 323.396 4.120 20 0 DIADLO FC1(F)CCC(C[N@@H+]2CCn3c(cc4ccccc43)C2)CC1 ZINC001618220686 1056935571 /nfs/dbraw/zinc/93/55/71/1056935571.db2.gz GDODDVWDMJKSKD-UHFFFAOYSA-N 1 2 304.384 4.282 20 0 DIADLO FC1(F)CCC(C[N@H+]2CCn3c(cc4ccccc43)C2)CC1 ZINC001618220686 1056935578 /nfs/dbraw/zinc/93/55/78/1056935578.db2.gz GDODDVWDMJKSKD-UHFFFAOYSA-N 1 2 304.384 4.282 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)c1Cl ZINC000922163567 1056940135 /nfs/dbraw/zinc/94/01/35/1056940135.db2.gz CEFSDOUCDBRLOK-TVQRCGJNSA-N 1 2 310.228 4.294 20 0 DIADLO CCCC[C@@H](CC)CCCN(C)C(=O)c1cccc2[nH+]ccn21 ZINC001618243781 1056940499 /nfs/dbraw/zinc/94/04/99/1056940499.db2.gz KMGVZVLLGQDNTD-MRXNPFEDSA-N 1 2 315.461 4.403 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)Nc1ccccc1Cl ZINC000079816531 1056951659 /nfs/dbraw/zinc/95/16/59/1056951659.db2.gz KDBDYLNIESFTLA-UHFFFAOYSA-N 1 2 312.760 4.170 20 0 DIADLO c1cn(-c2ccc(-c3cccc(O[C@@H]4CCCCO4)c3)cc2)c[nH+]1 ZINC001241215097 1056963607 /nfs/dbraw/zinc/96/36/07/1056963607.db2.gz WWLQOBNQFMXURM-HXUWFJFHSA-N 1 2 320.392 4.445 20 0 DIADLO Cc1cc(-c2cccc(O[C@H]3CCCCO3)c2)c2[nH+]ccn2c1 ZINC001241214265 1056963662 /nfs/dbraw/zinc/96/36/62/1056963662.db2.gz RARVKXHPWYRTLY-SFHVURJKSA-N 1 2 308.381 4.215 20 0 DIADLO Cc1ccc(-c2ccnc(-c3c[nH+]c(N(C)C)cc3C)c2)cc1 ZINC001241232965 1056971464 /nfs/dbraw/zinc/97/14/64/1056971464.db2.gz BQALGGPRTOFPIG-UHFFFAOYSA-N 1 2 303.409 4.493 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)cc1-c1ccc(Cl)c(F)c1 ZINC001241232803 1056971836 /nfs/dbraw/zinc/97/18/36/1056971836.db2.gz SXNPXNDHQUNWIY-UHFFFAOYSA-N 1 2 323.770 4.117 20 0 DIADLO Cc1noc([C@@H](C)[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)n1 ZINC000080471984 1056973251 /nfs/dbraw/zinc/97/32/51/1056973251.db2.gz CNTCVIQXOMCPCW-ABAIWWIYSA-N 1 2 305.397 4.345 20 0 DIADLO COc1ccc(-c2ccncc2)cc1-c1c[nH+]c(N(C)C)cc1C ZINC001241242908 1056977405 /nfs/dbraw/zinc/97/74/05/1056977405.db2.gz LQYPOYUBOLFZEL-UHFFFAOYSA-N 1 2 319.408 4.194 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(OC(F)(F)F)cc1F ZINC001241243005 1056977466 /nfs/dbraw/zinc/97/74/66/1056977466.db2.gz CLELVUKPXBCZBE-UHFFFAOYSA-N 1 2 314.282 4.161 20 0 DIADLO COc1cc(-c2c[nH+]c(N(C)C)cc2C)c(OC)c2ccccc12 ZINC001241251681 1056980555 /nfs/dbraw/zinc/98/05/55/1056980555.db2.gz ZDOXEVPPLRFUAY-UHFFFAOYSA-N 1 2 322.408 4.293 20 0 DIADLO CC(=O)c1ccc(-c2c[nH+]c(N3CCCCC3)cc2C)cc1F ZINC001241258576 1056984375 /nfs/dbraw/zinc/98/43/75/1056984375.db2.gz FNOLELYRVCCFIN-UHFFFAOYSA-N 1 2 312.388 4.389 20 0 DIADLO Cc1cnc(Cl)c(C[NH2+]Cc2cccc(OC3CC3)c2F)c1 ZINC000922241191 1056986363 /nfs/dbraw/zinc/98/63/63/1056986363.db2.gz BRBIDXGLLNKIMR-UHFFFAOYSA-N 1 2 320.795 4.014 20 0 DIADLO CCOc1ccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)c(C)c1 ZINC001241273281 1056991061 /nfs/dbraw/zinc/99/10/61/1056991061.db2.gz HBCBWKUPBXUJRY-UHFFFAOYSA-N 1 2 305.368 4.401 20 0 DIADLO CC(C)OC(=O)c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001241285441 1056996272 /nfs/dbraw/zinc/99/62/72/1056996272.db2.gz UVQIMUWNCVZRED-UHFFFAOYSA-N 1 2 320.392 4.164 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cc2cc(F)ccc2o1 ZINC000117591363 1057003256 /nfs/dbraw/zinc/00/32/56/1057003256.db2.gz NVQXHMXLOBPNKS-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO CCN(C(=O)c1cccc(-n2cc[nH+]c2)c1)c1cc(C)cc(C)c1 ZINC000117599321 1057003316 /nfs/dbraw/zinc/00/33/16/1057003316.db2.gz MUOFLPSJXJWWLZ-UHFFFAOYSA-N 1 2 319.408 4.156 20 0 DIADLO C[C@@H](CC(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1F ZINC000338845783 1057010479 /nfs/dbraw/zinc/01/04/79/1057010479.db2.gz BFNLJVICCQQTLJ-AWEZNQCLSA-N 1 2 323.371 4.144 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCCc2occc2C1 ZINC000673519181 1057011965 /nfs/dbraw/zinc/01/19/65/1057011965.db2.gz CRQUGIBSCUPVHX-UHFFFAOYSA-N 1 2 308.381 4.098 20 0 DIADLO Cc1ccc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c(F)c1 ZINC001241356633 1057025212 /nfs/dbraw/zinc/02/52/12/1057025212.db2.gz XKWPAANFWJJSNH-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO Cc1ccc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c(F)c1 ZINC001241356633 1057025215 /nfs/dbraw/zinc/02/52/15/1057025215.db2.gz XKWPAANFWJJSNH-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO CC[N@H+](CC(=O)Nc1cccc(C)c1)Cc1ccc(Cl)s1 ZINC000018936077 1057027422 /nfs/dbraw/zinc/02/74/22/1057027422.db2.gz OPLWRDGDDMZBIO-UHFFFAOYSA-N 1 2 322.861 4.171 20 0 DIADLO CC[N@@H+](CC(=O)Nc1cccc(C)c1)Cc1ccc(Cl)s1 ZINC000018936077 1057027426 /nfs/dbraw/zinc/02/74/26/1057027426.db2.gz OPLWRDGDDMZBIO-UHFFFAOYSA-N 1 2 322.861 4.171 20 0 DIADLO Cc1ccc2cc(C[NH2+][C@@H]3c4ccccc4OC[C@H]3F)ccc2n1 ZINC000922520086 1057030680 /nfs/dbraw/zinc/03/06/80/1057030680.db2.gz KCXNHTVVUFVRAO-YLJYHZDGSA-N 1 2 322.383 4.105 20 0 DIADLO Cc1cccn2cc(C[NH2+]Cc3ccc(-c4ccccc4)o3)nc12 ZINC000124032214 1057033334 /nfs/dbraw/zinc/03/33/34/1057033334.db2.gz CMVQDKLVCYSFIG-UHFFFAOYSA-N 1 2 317.392 4.193 20 0 DIADLO c1sc(-c2ccccc2)nc1C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000922585163 1057036243 /nfs/dbraw/zinc/03/62/43/1057036243.db2.gz JBUNBBWEOFDVKB-GOSISDBHSA-N 1 2 321.449 4.446 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2ncccc2c1 ZINC001241401364 1057039993 /nfs/dbraw/zinc/03/99/93/1057039993.db2.gz MTTXWQDZWBWKIG-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO CCc1nc(C[NH2+][C@@H](CC)c2cc(F)ccc2OC)cs1 ZINC000922619187 1057041411 /nfs/dbraw/zinc/04/14/11/1057041411.db2.gz DHYLOTXLRXHIMH-AWEZNQCLSA-N 1 2 308.422 4.094 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2F)nn1C ZINC000922669984 1057046747 /nfs/dbraw/zinc/04/67/47/1057046747.db2.gz OHHGVERHDMRTIT-VIFPVBQESA-N 1 2 316.207 4.025 20 0 DIADLO CC[N@H+](Cc1ncc(Cl)n1C)[C@@H](C)c1cc2ccccc2o1 ZINC000140686069 1057052207 /nfs/dbraw/zinc/05/22/07/1057052207.db2.gz GTKYBHSNIFOZPT-LBPRGKRZSA-N 1 2 317.820 4.403 20 0 DIADLO CC[N@@H+](Cc1ncc(Cl)n1C)[C@@H](C)c1cc2ccccc2o1 ZINC000140686069 1057052210 /nfs/dbraw/zinc/05/22/10/1057052210.db2.gz GTKYBHSNIFOZPT-LBPRGKRZSA-N 1 2 317.820 4.403 20 0 DIADLO FC1(F)CCC[C@H]1[NH2+]Cc1c[nH]nc1-c1cccc(Cl)c1 ZINC000673618267 1057061601 /nfs/dbraw/zinc/06/16/01/1057061601.db2.gz YWPJITWCXQMALC-CYBMUJFWSA-N 1 2 311.763 4.008 20 0 DIADLO Brc1cnccc1C[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000625079764 1057084171 /nfs/dbraw/zinc/08/41/71/1057084171.db2.gz JKLYYEHCEMLYDR-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cnccc1C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000625079764 1057084175 /nfs/dbraw/zinc/08/41/75/1057084175.db2.gz JKLYYEHCEMLYDR-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2nc(C)cs2)c2ccccc2)cc1 ZINC000126012005 1057086934 /nfs/dbraw/zinc/08/69/34/1057086934.db2.gz NBJCIDFZUVYEPV-IBGZPJMESA-N 1 2 324.449 4.339 20 0 DIADLO Fc1ccccc1-c1nc(C[N@@H+]2CCC[C@H]2c2ccncc2)co1 ZINC000625269213 1057111552 /nfs/dbraw/zinc/11/15/52/1057111552.db2.gz BVTNIWROSNDQNK-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccccc1-c1nc(C[N@H+]2CCC[C@H]2c2ccncc2)co1 ZINC000625269213 1057111563 /nfs/dbraw/zinc/11/15/63/1057111563.db2.gz BVTNIWROSNDQNK-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1F)Cc1ccc2ccccc2c1 ZINC000673829104 1057138925 /nfs/dbraw/zinc/13/89/25/1057138925.db2.gz PDBLLUUCBHBKFC-UHFFFAOYSA-N 1 2 307.368 4.294 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1F)Cc1ccc2ccccc2c1 ZINC000673829104 1057138931 /nfs/dbraw/zinc/13/89/31/1057138931.db2.gz PDBLLUUCBHBKFC-UHFFFAOYSA-N 1 2 307.368 4.294 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1ncc(-c2cccc(F)c2)o1 ZINC000673855317 1057143106 /nfs/dbraw/zinc/14/31/06/1057143106.db2.gz MRZPLXNNFZAKBF-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1ncc(-c2cccc(F)c2)o1 ZINC000673855317 1057143108 /nfs/dbraw/zinc/14/31/08/1057143108.db2.gz MRZPLXNNFZAKBF-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO CCCC[N@H+](Cc1nc([C@H](C)OC)no1)[C@H](C)c1ccc(C)o1 ZINC000673856970 1057143547 /nfs/dbraw/zinc/14/35/47/1057143547.db2.gz ZBIHXEAVTSENQL-KGLIPLIRSA-N 1 2 321.421 4.042 20 0 DIADLO CCCC[N@@H+](Cc1nc([C@H](C)OC)no1)[C@H](C)c1ccc(C)o1 ZINC000673856970 1057143553 /nfs/dbraw/zinc/14/35/53/1057143553.db2.gz ZBIHXEAVTSENQL-KGLIPLIRSA-N 1 2 321.421 4.042 20 0 DIADLO C[C@H]([NH2+]Cc1nn(C)c2ccccc12)c1c(F)cccc1Cl ZINC000673929548 1057151857 /nfs/dbraw/zinc/15/18/57/1057151857.db2.gz KFFSWSMHARXANV-NSHDSACASA-N 1 2 317.795 4.217 20 0 DIADLO C[C@H]([NH2+]Cc1cnn(C(C)(C)C)c1)c1c(F)cccc1Cl ZINC000673929791 1057151870 /nfs/dbraw/zinc/15/18/70/1057151870.db2.gz MTYJQTTWGRKQRK-NSHDSACASA-N 1 2 309.816 4.281 20 0 DIADLO Cn1c2ccccc2nc1C[N@@H+]1CC(C)(C)[C@H]1c1ccccc1 ZINC000674010101 1057177766 /nfs/dbraw/zinc/17/77/66/1057177766.db2.gz PFOYBEXUVNYWNM-LJQANCHMSA-N 1 2 305.425 4.156 20 0 DIADLO Cn1c2ccccc2nc1C[N@H+]1CC(C)(C)[C@H]1c1ccccc1 ZINC000674010101 1057177768 /nfs/dbraw/zinc/17/77/68/1057177768.db2.gz PFOYBEXUVNYWNM-LJQANCHMSA-N 1 2 305.425 4.156 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccc3c(c2)CCCN3)cc1F ZINC001241838256 1057184049 /nfs/dbraw/zinc/18/40/49/1057184049.db2.gz CGMFVQQSWPSVBD-UHFFFAOYSA-N 1 2 302.368 4.052 20 0 DIADLO C[C@H]1C[NH+](Cc2ncc(Cl)cc2Cl)C[C@H](C)C1(F)F ZINC000625656087 1057185111 /nfs/dbraw/zinc/18/51/11/1057185111.db2.gz YZLZPCGUXNXSNR-IUCAKERBSA-N 1 2 309.187 4.112 20 0 DIADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2Cc1coc(-c2cccs2)n1 ZINC000625686223 1057188553 /nfs/dbraw/zinc/18/85/53/1057188553.db2.gz PCDACYDHHZJFKX-TXEJJXNPSA-N 1 2 310.369 4.165 20 0 DIADLO FC1(F)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1coc(-c2cccs2)n1 ZINC000625686223 1057188555 /nfs/dbraw/zinc/18/85/55/1057188555.db2.gz PCDACYDHHZJFKX-TXEJJXNPSA-N 1 2 310.369 4.165 20 0 DIADLO CCOc1ccc(-c2cn3cc[nH+]c3cc2OC)c(Cl)c1 ZINC001241854699 1057191475 /nfs/dbraw/zinc/19/14/75/1057191475.db2.gz OBUMBPKPTZTODU-UHFFFAOYSA-N 1 2 302.761 4.062 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+][C@@H]1COc2c1cccc2Cl ZINC000681742795 1057197299 /nfs/dbraw/zinc/19/72/99/1057197299.db2.gz PLMVCYDQVGGHQJ-CQSZACIVSA-N 1 2 312.171 4.356 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(C(F)(F)F)c(F)c1 ZINC001241916508 1057210820 /nfs/dbraw/zinc/21/08/20/1057210820.db2.gz VCLVOLKURPZNGE-UHFFFAOYSA-N 1 2 310.250 4.168 20 0 DIADLO FC(F)C1([NH2+]Cc2cccc(-c3ccccn3)c2)CCCC1 ZINC000674135537 1057211947 /nfs/dbraw/zinc/21/19/47/1057211947.db2.gz SXFXDGAWUAKJAP-UHFFFAOYSA-N 1 2 302.368 4.416 20 0 DIADLO CCOc1ccc(C[NH2+]C2(C(F)F)CCCC2)cc1OCC ZINC000674135167 1057211962 /nfs/dbraw/zinc/21/19/62/1057211962.db2.gz APSWKKGLUBIVLK-UHFFFAOYSA-N 1 2 313.388 4.152 20 0 DIADLO C[C@H](c1ccccc1Br)[N@H+](C)Cc1cccnc1 ZINC000171146452 1057213928 /nfs/dbraw/zinc/21/39/28/1057213928.db2.gz RJQJJGTZGINENC-GFCCVEGCSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@H](c1ccccc1Br)[N@@H+](C)Cc1cccnc1 ZINC000171146452 1057213932 /nfs/dbraw/zinc/21/39/32/1057213932.db2.gz RJQJJGTZGINENC-GFCCVEGCSA-N 1 2 305.219 4.037 20 0 DIADLO CCCCOC(=O)Nc1ccc(-c2ccn3cc[nH+]c3c2)cc1 ZINC001241929456 1057215418 /nfs/dbraw/zinc/21/54/18/1057215418.db2.gz QZBDNMIAXKCTQL-UHFFFAOYSA-N 1 2 309.369 4.350 20 0 DIADLO CCCCOC(=O)Nc1ccc(-c2ccc3[nH+]ccn3c2)cc1 ZINC001241932997 1057216663 /nfs/dbraw/zinc/21/66/63/1057216663.db2.gz HOURCQOHTMSMNM-UHFFFAOYSA-N 1 2 309.369 4.350 20 0 DIADLO CCCCOC(=O)Nc1ccc(-c2cc[nH+]c(N(C)C)c2)cc1 ZINC001241933690 1057217149 /nfs/dbraw/zinc/21/71/49/1057217149.db2.gz SDJMOJJWLVYCBC-UHFFFAOYSA-N 1 2 313.401 4.163 20 0 DIADLO C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1n[nH]c2ccccc21 ZINC000674336035 1057232001 /nfs/dbraw/zinc/23/20/01/1057232001.db2.gz WSGXBYRIHBTPBR-CWTRNNRKSA-N 1 2 309.388 4.115 20 0 DIADLO Cc1nc2[nH]ccc2c(NCc2ccc(OC(C)(C)C)cc2)[nH+]1 ZINC000674336814 1057232397 /nfs/dbraw/zinc/23/23/97/1057232397.db2.gz VFKIBOBBLVXOFO-UHFFFAOYSA-N 1 2 310.401 4.056 20 0 DIADLO Cc1cc(-c2cnc3[nH]c(-c4ccccc4)nc3c2)cc(C)[nH+]1 ZINC001241992568 1057232855 /nfs/dbraw/zinc/23/28/55/1057232855.db2.gz RZELNHNLAUGXKE-UHFFFAOYSA-N 1 2 300.365 4.304 20 0 DIADLO Cc1cc(-c2ccc(NC(=O)c3ccccn3)cc2)cc(C)[nH+]1 ZINC001241994744 1057233411 /nfs/dbraw/zinc/23/34/11/1057233411.db2.gz DYWYRHWSYPOCRO-UHFFFAOYSA-N 1 2 303.365 4.013 20 0 DIADLO Cc1cc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)cc(C)n1 ZINC001241994677 1057233474 /nfs/dbraw/zinc/23/34/74/1057233474.db2.gz AYFYGNLAAFFGNH-UHFFFAOYSA-N 1 2 319.408 4.008 20 0 DIADLO Cc1cc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)cc(C)n1 ZINC001241994677 1057233479 /nfs/dbraw/zinc/23/34/79/1057233479.db2.gz AYFYGNLAAFFGNH-UHFFFAOYSA-N 1 2 319.408 4.008 20 0 DIADLO Cc1cc(-c2cccc(-c3ncc4ncccn43)c2)cc(C)[nH+]1 ZINC001241994747 1057233867 /nfs/dbraw/zinc/23/38/67/1057233867.db2.gz FFHIUXLZTHQDKR-UHFFFAOYSA-N 1 2 300.365 4.075 20 0 DIADLO Cc1nnsc1C[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1F ZINC000701285611 1057251369 /nfs/dbraw/zinc/25/13/69/1057251369.db2.gz OABLUEMPYBJYGJ-ZCFIWIBFSA-N 1 2 320.220 4.143 20 0 DIADLO Cc1ccc2ccc(F)c(-c3cc(N4CCCC4)cc[nH+]3)c2n1 ZINC001242051120 1057251743 /nfs/dbraw/zinc/25/17/43/1057251743.db2.gz ZGQCXZAZFIHWKO-UHFFFAOYSA-N 1 2 307.372 4.345 20 0 DIADLO C[C@H](C(=O)Nc1ccc2[nH+]ccn2c1)c1ccc2ccccc2c1 ZINC000674658016 1057269405 /nfs/dbraw/zinc/26/94/05/1057269405.db2.gz CPSYBYRBEQHVIZ-AWEZNQCLSA-N 1 2 315.376 4.230 20 0 DIADLO Oc1ccc(C(F)(F)F)cc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001242138155 1057276247 /nfs/dbraw/zinc/27/62/47/1057276247.db2.gz QDOCIQUOZZKERI-UHFFFAOYSA-N 1 2 304.271 4.264 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)cs1 ZINC000040435615 1057286046 /nfs/dbraw/zinc/28/60/46/1057286046.db2.gz IWMLKQSCNGJFIE-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO CC1(C)CC[C@H]1C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001128841589 1057288926 /nfs/dbraw/zinc/28/89/26/1057288926.db2.gz NXAUBKZDNHIJTH-KRWDZBQOSA-N 1 2 324.424 4.228 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2cc(-c3ccccc3)on2)cc1 ZINC000674857579 1057290202 /nfs/dbraw/zinc/29/02/02/1057290202.db2.gz SFQXPZMPOGXQRJ-UHFFFAOYSA-N 1 2 322.408 4.372 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2cc(-c3ccccc3)on2)cc1 ZINC000674857579 1057290209 /nfs/dbraw/zinc/29/02/09/1057290209.db2.gz SFQXPZMPOGXQRJ-UHFFFAOYSA-N 1 2 322.408 4.372 20 0 DIADLO COC(=[NH2+])c1cccc(-c2cccnc2OC2CCCCC2)c1 ZINC001242229483 1057303745 /nfs/dbraw/zinc/30/37/45/1057303745.db2.gz HBOGYPIHAXZCSV-UHFFFAOYSA-N 1 2 310.397 4.432 20 0 DIADLO Cc1cc(-c2cccnc2OC2CCCCC2)c2[nH+]ccn2c1 ZINC001242229091 1057304079 /nfs/dbraw/zinc/30/40/79/1057304079.db2.gz PAQRUDRMACQRFO-UHFFFAOYSA-N 1 2 307.397 4.416 20 0 DIADLO Cc1cc(-c2cc(F)c(C[NH+](C)C)c(F)c2)ccc1N(C)C ZINC001242241216 1057307604 /nfs/dbraw/zinc/30/76/04/1057307604.db2.gz DDHFNOVSMXREHE-UHFFFAOYSA-N 1 2 304.384 4.068 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccc(F)cc1F ZINC000675088808 1057314755 /nfs/dbraw/zinc/31/47/55/1057314755.db2.gz AIUHXKZBSDFUCB-PSLIRLAXSA-N 1 2 309.743 4.403 20 0 DIADLO Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1cc(Cl)ccc1Cl ZINC000675251028 1057332292 /nfs/dbraw/zinc/33/22/92/1057332292.db2.gz CNBYKONRXATZOY-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1cc(Cl)ccc1Cl ZINC000675251028 1057332295 /nfs/dbraw/zinc/33/22/95/1057332295.db2.gz CNBYKONRXATZOY-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1cc(Cl)ccc1Cl ZINC000675251027 1057332567 /nfs/dbraw/zinc/33/25/67/1057332567.db2.gz CNBYKONRXATZOY-INIZCTEOSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1cc(Cl)ccc1Cl ZINC000675251027 1057332573 /nfs/dbraw/zinc/33/25/73/1057332573.db2.gz CNBYKONRXATZOY-INIZCTEOSA-N 1 2 324.255 4.372 20 0 DIADLO CCOc1c(F)cccc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001212534528 1057340170 /nfs/dbraw/zinc/34/01/70/1057340170.db2.gz WWIFFTZILPGVNI-UHFFFAOYSA-N 1 2 315.392 4.353 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cccc(Cl)c1O ZINC001242364151 1057346390 /nfs/dbraw/zinc/34/63/90/1057346390.db2.gz FAQBJLRCGNDFCT-UHFFFAOYSA-N 1 2 302.805 4.406 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(Cl)c(Cl)c3)ccc2[nH+]1 ZINC000041305325 1057348446 /nfs/dbraw/zinc/34/84/46/1057348446.db2.gz CCLNHVFOCQOEPT-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO CCOc1cc(Nc2cccc(-n3cc[nH+]c3)c2)ccc1OC ZINC001212541517 1057350207 /nfs/dbraw/zinc/35/02/07/1057350207.db2.gz JJCAUDLLQOPBBP-UHFFFAOYSA-N 1 2 309.369 4.023 20 0 DIADLO CCOc1cc(Nc2ccc(-n3cc[nH+]c3)cc2)ccc1OC ZINC001212541766 1057350541 /nfs/dbraw/zinc/35/05/41/1057350541.db2.gz WMRWNHDZRJQYTE-UHFFFAOYSA-N 1 2 309.369 4.023 20 0 DIADLO FC(F)(F)c1ncccc1-c1ccccc1Cn1cc[nH+]c1 ZINC001242375204 1057353033 /nfs/dbraw/zinc/35/30/33/1057353033.db2.gz OMHJZXJXMZXLGX-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO FC(F)Oc1ccc(-c2ccccc2Cn2cc[nH+]c2)cc1 ZINC001242440719 1057367780 /nfs/dbraw/zinc/36/77/80/1057367780.db2.gz HPXCRMVPNZGRNL-UHFFFAOYSA-N 1 2 300.308 4.200 20 0 DIADLO CCc1ccc(-c2noc([C@H](C)[NH2+][C@@H](C)c3ccncc3)n2)cc1 ZINC000675446454 1057370671 /nfs/dbraw/zinc/37/06/71/1057370671.db2.gz WQCYOOQBTWQSBT-KBPBESRZSA-N 1 2 322.412 4.106 20 0 DIADLO Cc1cc(-c2ccc3c(cnn3[C@@H]3CCCCO3)c2)cc(C)[nH+]1 ZINC001242447867 1057371467 /nfs/dbraw/zinc/37/14/67/1057371467.db2.gz TWDHVRPJUYXIOR-IBGZPJMESA-N 1 2 307.397 4.414 20 0 DIADLO c1cn2cccc(-c3ccc4c(cnn4[C@@H]4CCCCO4)c3)c2[nH+]1 ZINC001242447505 1057371609 /nfs/dbraw/zinc/37/16/09/1057371609.db2.gz PLCUQQYOUDTUNO-SFHVURJKSA-N 1 2 318.380 4.050 20 0 DIADLO CCC(CC)(CC)C(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000675512773 1057384660 /nfs/dbraw/zinc/38/46/60/1057384660.db2.gz KIFVYDQNYIIGPM-UHFFFAOYSA-N 1 2 323.506 4.284 20 0 DIADLO Fc1cccc(-c2cc(C[NH+]3CCOCC3)ccc2F)c1Cl ZINC001242574702 1057410991 /nfs/dbraw/zinc/41/09/91/1057410991.db2.gz FSZKSTRIBMKJKD-UHFFFAOYSA-N 1 2 323.770 4.117 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@H]2CCOc3c(Cl)cccc32)n1 ZINC000675809402 1057417474 /nfs/dbraw/zinc/41/74/74/1057417474.db2.gz HWTUBZGZFUHDLY-MFKMUULPSA-N 1 2 308.834 4.279 20 0 DIADLO COc1cc2ccccc2c(-c2cn3cc[nH+]c3cc2OC)c1 ZINC001242606082 1057421570 /nfs/dbraw/zinc/42/15/70/1057421570.db2.gz OOJUEAUUBFYEGO-UHFFFAOYSA-N 1 2 304.349 4.172 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1ccc(OCC(F)(F)F)cc1 ZINC001242720897 1057459386 /nfs/dbraw/zinc/45/93/86/1057459386.db2.gz DATBBKGNJXASOB-UHFFFAOYSA-N 1 2 306.287 4.251 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc4c(cnn4C(C)C)c3)n2c1 ZINC000676419743 1057472008 /nfs/dbraw/zinc/47/20/08/1057472008.db2.gz GHCJAZYOQMFNAK-UHFFFAOYSA-N 1 2 319.412 4.185 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1cccc2ccccc21 ZINC000676477813 1057474335 /nfs/dbraw/zinc/47/43/35/1057474335.db2.gz CLJWPNIZQMSUFG-HNNXBMFYSA-N 1 2 322.408 4.282 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1cccc2ccccc21 ZINC000676477813 1057474337 /nfs/dbraw/zinc/47/43/37/1057474337.db2.gz CLJWPNIZQMSUFG-HNNXBMFYSA-N 1 2 322.408 4.282 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccccc2OCC2CC2)c(C)s1 ZINC000676492938 1057477171 /nfs/dbraw/zinc/47/71/71/1057477171.db2.gz QOWCYTRZFLPBTA-LBPRGKRZSA-N 1 2 316.470 4.400 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCCc3sccc3C2)n1 ZINC000676557936 1057483458 /nfs/dbraw/zinc/48/34/58/1057483458.db2.gz DOYQJAFRNXXCAS-UHFFFAOYSA-N 1 2 303.475 4.254 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCCc3sccc3C2)n1 ZINC000676557936 1057483463 /nfs/dbraw/zinc/48/34/63/1057483463.db2.gz DOYQJAFRNXXCAS-UHFFFAOYSA-N 1 2 303.475 4.254 20 0 DIADLO Cc1cc(NC(=O)[C@H](C)c2c(Cl)cccc2Cl)c(C)c[nH+]1 ZINC000676588326 1057486313 /nfs/dbraw/zinc/48/63/13/1057486313.db2.gz VXHRNHISTHUORS-LLVKDONJSA-N 1 2 323.223 4.169 20 0 DIADLO Cc1cc(NC(=O)C(C)(C)c2ccc3ccccc3c2)c(C)c[nH+]1 ZINC000676588379 1057486510 /nfs/dbraw/zinc/48/65/10/1057486510.db2.gz ZIVVIHGKFIIWJM-UHFFFAOYSA-N 1 2 318.420 4.190 20 0 DIADLO Nc1cc[nH+]c2cc(-c3cc(Cl)c(O)c(Cl)c3)ccc12 ZINC001242852832 1057499246 /nfs/dbraw/zinc/49/92/46/1057499246.db2.gz DVEAFQICVKZNIT-UHFFFAOYSA-N 1 2 305.164 4.496 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F)c1cn(C)cn1 ZINC000710070024 1057502580 /nfs/dbraw/zinc/50/25/80/1057502580.db2.gz FBQLLVXCWPFPAA-DTWKUNHWSA-N 1 2 316.207 4.278 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc3c(c2)C(=O)CCC3)cc1 ZINC001242857939 1057502891 /nfs/dbraw/zinc/50/28/91/1057502891.db2.gz PGQFPAFHTPRFQG-UHFFFAOYSA-N 1 2 302.377 4.273 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000073637378 1057509314 /nfs/dbraw/zinc/50/93/14/1057509314.db2.gz PMNBVBLNEAGLBI-OLZOCXBDSA-N 1 2 317.433 4.178 20 0 DIADLO c1cn(Cc2ccc(-c3cncc(-c4ccccc4)c3)nc2)c[nH+]1 ZINC001242913000 1057517164 /nfs/dbraw/zinc/51/71/64/1057517164.db2.gz VJOBDJDZCJWNFU-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2cc(Cl)cc3c2OCC3)s1 ZINC000922986009 1057519598 /nfs/dbraw/zinc/51/95/98/1057519598.db2.gz QMIIIWZPAWRSPU-SNVBAGLBSA-N 1 2 322.861 4.145 20 0 DIADLO C[C@@]1([NH2+]Cc2coc(-c3ccccc3)n2)CCOc2ccccc21 ZINC000923025910 1057522238 /nfs/dbraw/zinc/52/22/38/1057522238.db2.gz ROUBZBAAXONIIA-HXUWFJFHSA-N 1 2 320.392 4.129 20 0 DIADLO Cc1cc2ccccc2c(NC(=O)c2cccc3[nH+]ccn32)c1 ZINC001273156288 1057523092 /nfs/dbraw/zinc/52/30/92/1057523092.db2.gz TWDWTWXITWHLTC-UHFFFAOYSA-N 1 2 301.349 4.048 20 0 DIADLO COCCOc1ccccc1CNc1[nH+]c2ccccc2cc1C ZINC000531758565 1057531852 /nfs/dbraw/zinc/53/18/52/1057531852.db2.gz OLQWWRLFDAAZAH-UHFFFAOYSA-N 1 2 322.408 4.181 20 0 DIADLO c1nc(C2CC2)oc1CNc1[nH+]c2ccccc2n1C1CCCC1 ZINC000641778032 1057541595 /nfs/dbraw/zinc/54/15/95/1057541595.db2.gz FRDKOCJJRQCINA-UHFFFAOYSA-N 1 2 322.412 4.629 20 0 DIADLO c1cn(Cc2ccc(-c3cccc(-c4cccnc4)c3)nc2)c[nH+]1 ZINC001243000937 1057541950 /nfs/dbraw/zinc/54/19/50/1057541950.db2.gz OEVMKLYNUCYPCM-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO CC[C@@H](Nc1cc(C)[nH+]c(C2CC2)n1)c1cccc(Cl)c1 ZINC000463016554 1057545813 /nfs/dbraw/zinc/54/58/13/1057545813.db2.gz URHXCLHJHWXIDF-OAHLLOKOSA-N 1 2 301.821 4.879 20 0 DIADLO CCc1ccc(C2CC[NH+](Cc3nccn3C(F)F)CC2)cc1 ZINC000626085415 1057555950 /nfs/dbraw/zinc/55/59/50/1057555950.db2.gz LZMRVDZHLJHJHM-UHFFFAOYSA-N 1 2 319.399 4.220 20 0 DIADLO Cc1cc(-c2cc(F)ccc2C[NH+]2CCOCC2)cc(C)c1F ZINC001243084271 1057565754 /nfs/dbraw/zinc/56/57/54/1057565754.db2.gz INOPZMXVYRJROC-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)c(-c2ccc3ccccc3c2)c1 ZINC001243086208 1057566564 /nfs/dbraw/zinc/56/65/64/1057566564.db2.gz WMBGLYPQZGATCE-UHFFFAOYSA-N 1 2 321.395 4.478 20 0 DIADLO CC(C)c1ccccc1-c1cc(F)ccc1C[NH+]1CCOCC1 ZINC001243085782 1057566639 /nfs/dbraw/zinc/56/66/39/1057566639.db2.gz QWWCLDVLVJMDKV-UHFFFAOYSA-N 1 2 313.416 4.448 20 0 DIADLO Cc1noc([C@@H](C)[NH2+][C@H](Cc2ccccc2)c2ccccc2)n1 ZINC000078541095 1057568647 /nfs/dbraw/zinc/56/86/47/1057568647.db2.gz VAHXWDRXCHYMQO-RDTXWAMCSA-N 1 2 307.397 4.013 20 0 DIADLO Cc1cc2[nH]ccc2cc1-c1cc(F)ccc1C[NH+]1CCOCC1 ZINC001243101120 1057573408 /nfs/dbraw/zinc/57/34/08/1057573408.db2.gz DWJZXWWEHFEHTG-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)c(-c2ccccc2C2CC2)c1 ZINC001243101748 1057573469 /nfs/dbraw/zinc/57/34/69/1057573469.db2.gz XTIFKHNRIRUOKO-UHFFFAOYSA-N 1 2 311.400 4.202 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1ccccc1NC(=O)C(C)(C)C ZINC001243177085 1057594105 /nfs/dbraw/zinc/59/41/05/1057594105.db2.gz OIOVNIJHRPCNQO-UHFFFAOYSA-N 1 2 307.397 4.294 20 0 DIADLO COc1ccc([C@H]([NH2+][C@@H](C)c2ncc[nH]2)c2ccc(C)cc2)cc1 ZINC000513713732 1057623560 /nfs/dbraw/zinc/62/35/60/1057623560.db2.gz SJHXBWLENBOKBP-HNAYVOBHSA-N 1 2 321.424 4.167 20 0 DIADLO CCCOc1cccc(F)c1-c1cc(N2CCCC2)cc[nH+]1 ZINC001243267164 1057627739 /nfs/dbraw/zinc/62/77/39/1057627739.db2.gz VOFARKTZSMBVIM-UHFFFAOYSA-N 1 2 300.377 4.277 20 0 DIADLO COc1c(F)c(F)ccc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001243302788 1057640162 /nfs/dbraw/zinc/64/01/62/1057640162.db2.gz JBIDBHXFHBFNOA-UHFFFAOYSA-N 1 2 318.367 4.334 20 0 DIADLO CC[N@H+](Cc1c(C)nn(C)c1Cl)Cc1cccc(Cl)c1 ZINC000727222110 1057642649 /nfs/dbraw/zinc/64/26/49/1057642649.db2.gz RDSBZCGTJCVZIJ-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO CC[N@@H+](Cc1c(C)nn(C)c1Cl)Cc1cccc(Cl)c1 ZINC000727222110 1057642657 /nfs/dbraw/zinc/64/26/57/1057642657.db2.gz RDSBZCGTJCVZIJ-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO CC[N@H+](Cc1c(C)nn(C)c1Cl)Cc1ccc(Cl)cc1 ZINC000727222544 1057642952 /nfs/dbraw/zinc/64/29/52/1057642952.db2.gz QUMFTQJEDWOAIT-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO CC[N@@H+](Cc1c(C)nn(C)c1Cl)Cc1ccc(Cl)cc1 ZINC000727222544 1057642953 /nfs/dbraw/zinc/64/29/53/1057642953.db2.gz QUMFTQJEDWOAIT-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](Cc1ccccc1F)CC(C)C ZINC000727222555 1057643056 /nfs/dbraw/zinc/64/30/56/1057643056.db2.gz RYTHVCBTWJKGNR-UHFFFAOYSA-N 1 2 323.843 4.179 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](Cc1ccccc1F)CC(C)C ZINC000727222555 1057643061 /nfs/dbraw/zinc/64/30/61/1057643061.db2.gz RYTHVCBTWJKGNR-UHFFFAOYSA-N 1 2 323.843 4.179 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(C2CC2)n1)c1cccc(OC(F)F)c1 ZINC000727465538 1057655021 /nfs/dbraw/zinc/65/50/21/1057655021.db2.gz AOURBTZFPRZASS-SNVBAGLBSA-N 1 2 308.328 4.004 20 0 DIADLO C[C@@H](CC(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C)C1CCCCC1 ZINC000727492047 1057655723 /nfs/dbraw/zinc/65/57/23/1057655723.db2.gz UCCKZOOSFXUCAH-RDJZCZTQSA-N 1 2 319.493 4.021 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2coc(C3CC3)n2)c1 ZINC000727467377 1057655908 /nfs/dbraw/zinc/65/59/08/1057655908.db2.gz UYWBBEYTVKPKGS-CYBMUJFWSA-N 1 2 300.402 4.190 20 0 DIADLO CC(C)(C)[C@H](Cn1cc[nH+]c1)NC(=O)CCCC1CCCCC1 ZINC000727494472 1057656674 /nfs/dbraw/zinc/65/66/74/1057656674.db2.gz AUHPMGIFWOSJLZ-KRWDZBQOSA-N 1 2 319.493 4.165 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)c2cccc(SC)c2)c1C ZINC000727585077 1057657601 /nfs/dbraw/zinc/65/76/01/1057657601.db2.gz DXFLQTMIHMTUKG-UHFFFAOYSA-N 1 2 302.443 4.065 20 0 DIADLO FC(F)Oc1cccc(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243356937 1057657683 /nfs/dbraw/zinc/65/76/83/1057657683.db2.gz XPMFZDWOFIADNZ-UHFFFAOYSA-N 1 2 300.308 4.200 20 0 DIADLO Nc1[nH+]cccc1-c1ccc(-c2nnc(-c3ccccc3)o2)cc1 ZINC001243474880 1057691091 /nfs/dbraw/zinc/69/10/91/1057691091.db2.gz AZSHBGFYIXERGD-UHFFFAOYSA-N 1 2 314.348 4.048 20 0 DIADLO c1cc(-c2ccc(C3CCCC3)cc2)cc(N2CCOCC2)[nH+]1 ZINC001243492842 1057695648 /nfs/dbraw/zinc/69/56/48/1057695648.db2.gz RHKJOTYGHAEMHL-UHFFFAOYSA-N 1 2 308.425 4.243 20 0 DIADLO CC(C)[C@H](C)[N@H+](C)Cn1nc(-c2ccccc2)sc1=S ZINC000729981772 1057699878 /nfs/dbraw/zinc/69/98/78/1057699878.db2.gz KSENMXHUVMUFCR-LBPRGKRZSA-N 1 2 307.488 4.275 20 0 DIADLO CC(C)[C@H](C)[N@@H+](C)Cn1nc(-c2ccccc2)sc1=S ZINC000729981772 1057699883 /nfs/dbraw/zinc/69/98/83/1057699883.db2.gz KSENMXHUVMUFCR-LBPRGKRZSA-N 1 2 307.488 4.275 20 0 DIADLO C[N@H+](Cn1nc(-c2ccccc2)sc1=S)C1CCCC1 ZINC000729982358 1057700019 /nfs/dbraw/zinc/70/00/19/1057700019.db2.gz YXMNULCWBGCMJI-UHFFFAOYSA-N 1 2 305.472 4.173 20 0 DIADLO C[N@@H+](Cn1nc(-c2ccccc2)sc1=S)C1CCCC1 ZINC000729982358 1057700020 /nfs/dbraw/zinc/70/00/20/1057700020.db2.gz YXMNULCWBGCMJI-UHFFFAOYSA-N 1 2 305.472 4.173 20 0 DIADLO CCOc1cc(-c2ccc(-n3cc[nH+]c3)cc2)c(F)cc1F ZINC001243528948 1057703734 /nfs/dbraw/zinc/70/37/34/1057703734.db2.gz IHBKOMBQPKQZLJ-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO CCOc1cc(-c2cc[nH+]c(N3CCCC3)c2)ccc1Cl ZINC001243571742 1057718039 /nfs/dbraw/zinc/71/80/39/1057718039.db2.gz IYIZIIPJXPIHTB-UHFFFAOYSA-N 1 2 302.805 4.401 20 0 DIADLO CCOc1cc(-c2cn3cc[nH+]c3cc2OC)ccc1Cl ZINC001243572571 1057718722 /nfs/dbraw/zinc/71/87/22/1057718722.db2.gz TVMLRLRCQCYYRG-UHFFFAOYSA-N 1 2 302.761 4.062 20 0 DIADLO Cc1c(-c2ccc(N(C)C3CCCCC3)nc2)ccc2[nH+]ccn21 ZINC001243597894 1057729081 /nfs/dbraw/zinc/72/90/81/1057729081.db2.gz WDLHBNWLKXVTKK-UHFFFAOYSA-N 1 2 320.440 4.474 20 0 DIADLO COC(=[NH2+])c1cccc(-c2ccc(N(C)C3CCCCC3)nc2)c1 ZINC001243597898 1057729093 /nfs/dbraw/zinc/72/90/93/1057729093.db2.gz MAOMGOZYPMTISQ-UHFFFAOYSA-N 1 2 323.440 4.489 20 0 DIADLO CSc1ccc(Cl)cc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001243598038 1057729298 /nfs/dbraw/zinc/72/92/98/1057729298.db2.gz JJOPPOXXMNSQBJ-UHFFFAOYSA-N 1 2 315.829 4.369 20 0 DIADLO Oc1cc(C(F)(F)F)ccc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001243605615 1057730249 /nfs/dbraw/zinc/73/02/49/1057730249.db2.gz IUZZCUZXVVMPTQ-UHFFFAOYSA-N 1 2 304.271 4.264 20 0 DIADLO Fc1cccc2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)nc12 ZINC001243656432 1057745414 /nfs/dbraw/zinc/74/54/14/1057745414.db2.gz IVUFSCBKQQWSGW-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO Fc1ccc2cnc(-c3ccc(Cn4cc[nH+]c4)cc3)cc2c1 ZINC001243656942 1057745452 /nfs/dbraw/zinc/74/54/52/1057745452.db2.gz PCLOIJCJXOMVMP-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO Fc1cccc2c1ccnc2-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243655665 1057745513 /nfs/dbraw/zinc/74/55/13/1057745513.db2.gz BDGQNPQCOJHNTR-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO COc1cccc2nc(-c3ccc(Cn4cc[nH+]c4)cc3)ccc21 ZINC001243658408 1057746650 /nfs/dbraw/zinc/74/66/50/1057746650.db2.gz XOFVZCGXAQKUTB-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO c1cn(Cc2ccc(-c3ncc(-c4ccccc4)cn3)cc2)c[nH+]1 ZINC001243658296 1057746702 /nfs/dbraw/zinc/74/67/02/1057746702.db2.gz VKTVIKROXWKEGD-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO COc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c2cc[nH]c21 ZINC001243659045 1057746730 /nfs/dbraw/zinc/74/67/30/1057746730.db2.gz ZJSLCWMTHBXKOP-UHFFFAOYSA-N 1 2 303.365 4.088 20 0 DIADLO CCOC(=O)c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c(C)c1 ZINC001243659588 1057747226 /nfs/dbraw/zinc/74/72/26/1057747226.db2.gz VXUKQOGSVCKGJJ-UHFFFAOYSA-N 1 2 320.392 4.084 20 0 DIADLO Fc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)c(F)c(F)c1F ZINC001243659593 1057747560 /nfs/dbraw/zinc/74/75/60/1057747560.db2.gz WEGXKIMHOMAWTG-UHFFFAOYSA-N 1 2 306.262 4.155 20 0 DIADLO Fc1cnc2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)cc2c1 ZINC001243661948 1057748085 /nfs/dbraw/zinc/74/80/85/1057748085.db2.gz GVMFCBYCUAILCL-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO COC(=O)c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c(C)c1C ZINC001243662349 1057748178 /nfs/dbraw/zinc/74/81/78/1057748178.db2.gz MHLIZTWBWTUJTM-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO Fc1cccc2cc(-c3ccc(Cn4cc[nH+]c4)cc3)cnc12 ZINC001243663568 1057748640 /nfs/dbraw/zinc/74/86/40/1057748640.db2.gz XFTMMFRDBWEGTH-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO CC(C)(C)Oc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)nc1 ZINC001243663531 1057748694 /nfs/dbraw/zinc/74/86/94/1057748694.db2.gz WTACQMVXGMQGFJ-UHFFFAOYSA-N 1 2 307.397 4.171 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1cccc(F)c1F ZINC000731893970 1057758199 /nfs/dbraw/zinc/75/81/99/1057758199.db2.gz WMBMXRGOYJBSPI-BIENJYKASA-N 1 2 317.379 4.315 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@H+]1Cc1cccc(F)c1F ZINC000731893970 1057758201 /nfs/dbraw/zinc/75/82/01/1057758201.db2.gz WMBMXRGOYJBSPI-BIENJYKASA-N 1 2 317.379 4.315 20 0 DIADLO COc1ccc(-c2ccc(-c3c[nH+]cn3C)cc2)cc1SC ZINC001243748548 1057769699 /nfs/dbraw/zinc/76/96/99/1057769699.db2.gz HOAYXHISBXVAER-UHFFFAOYSA-N 1 2 310.422 4.485 20 0 DIADLO CC(C)C[C@@H](c1nc(-c2cccc(Cl)c2)no1)n1cc[nH+]c1 ZINC000821004183 1057773133 /nfs/dbraw/zinc/77/31/33/1057773133.db2.gz VAGHRLYPIRQTQQ-AWEZNQCLSA-N 1 2 316.792 4.222 20 0 DIADLO COc1ccc(-c2cc(C)c3[nH+]ccn3c2)c(OC(F)(F)F)c1 ZINC001243812164 1057785802 /nfs/dbraw/zinc/78/58/02/1057785802.db2.gz BSBZGUJHNIUAOG-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2ccnc(Cl)c2)cc1F ZINC000732986833 1057796223 /nfs/dbraw/zinc/79/62/23/1057796223.db2.gz OCQPRMLBHJLNQO-HNNXBMFYSA-N 1 2 308.759 4.350 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2ccnc(Cl)c2)cc1F ZINC000732986833 1057796227 /nfs/dbraw/zinc/79/62/27/1057796227.db2.gz OCQPRMLBHJLNQO-HNNXBMFYSA-N 1 2 308.759 4.350 20 0 DIADLO CCN(CC)c1ccc(-c2ccccc2Cn2cc[nH+]c2)cc1 ZINC001243880796 1057797414 /nfs/dbraw/zinc/79/74/14/1057797414.db2.gz ISQCYVRBVKLPJV-UHFFFAOYSA-N 1 2 305.425 4.445 20 0 DIADLO CCN(CC)c1ccc(-c2ccc(-n3cc[nH+]c3)cc2OC)cc1 ZINC001243882355 1057798047 /nfs/dbraw/zinc/79/80/47/1057798047.db2.gz ZLHSEMBLPHYAOD-UHFFFAOYSA-N 1 2 321.424 4.394 20 0 DIADLO CCc1cc(C)cc(CC)c1-c1cc[nH+]c(N2CCOCC2)c1 ZINC001243899460 1057801736 /nfs/dbraw/zinc/80/17/36/1057801736.db2.gz LNSWGOCRFVYJGX-UHFFFAOYSA-N 1 2 310.441 4.018 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cc(F)nc(C(F)(F)F)c2)cc1 ZINC001243913903 1057804984 /nfs/dbraw/zinc/80/49/84/1057804984.db2.gz RHSROOWACPMCAT-UHFFFAOYSA-N 1 2 321.277 4.307 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ncc(C(C)C)o1 ZINC000733309191 1057810432 /nfs/dbraw/zinc/81/04/32/1057810432.db2.gz DXMHMXMHRYLVHY-HNNXBMFYSA-N 1 2 300.402 4.144 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1ncc(C(C)C)o1 ZINC000733309191 1057810438 /nfs/dbraw/zinc/81/04/38/1057810438.db2.gz DXMHMXMHRYLVHY-HNNXBMFYSA-N 1 2 300.402 4.144 20 0 DIADLO CC[N@H+](Cc1ncc(C(C)C)o1)[C@H](C)c1cccc(OC)c1 ZINC000733306501 1057810554 /nfs/dbraw/zinc/81/05/54/1057810554.db2.gz BXAMVUYAQLPHBQ-CQSZACIVSA-N 1 2 302.418 4.390 20 0 DIADLO CC[N@@H+](Cc1ncc(C(C)C)o1)[C@H](C)c1cccc(OC)c1 ZINC000733306501 1057810559 /nfs/dbraw/zinc/81/05/59/1057810559.db2.gz BXAMVUYAQLPHBQ-CQSZACIVSA-N 1 2 302.418 4.390 20 0 DIADLO CC(C)c1cnc(C[NH+]2CCC(OC3CCCCC3)CC2)o1 ZINC000733309336 1057812164 /nfs/dbraw/zinc/81/21/64/1057812164.db2.gz KMPWAXKZHCPIMJ-UHFFFAOYSA-N 1 2 306.450 4.112 20 0 DIADLO COc1ccc(-c2cccc3[nH+]c(C)cn32)c(C(F)(F)F)c1 ZINC001243943049 1057814835 /nfs/dbraw/zinc/81/48/35/1057814835.db2.gz DMILHOKSGUVTKI-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO CC(=O)N1CCCc2cc(-c3ccc(-c4[nH]cc[nH+]4)cc3)ccc21 ZINC001243975872 1057826660 /nfs/dbraw/zinc/82/66/60/1057826660.db2.gz DVARNISBMJKECU-UHFFFAOYSA-N 1 2 317.392 4.043 20 0 DIADLO Fc1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1OC(F)F ZINC001243977811 1057827216 /nfs/dbraw/zinc/82/72/16/1057827216.db2.gz YQRCDLSNYDGTAR-UHFFFAOYSA-N 1 2 304.271 4.484 20 0 DIADLO CC(=O)N1CCCc2ccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)cc21 ZINC001243977765 1057827433 /nfs/dbraw/zinc/82/74/33/1057827433.db2.gz WDPZIUMXQBSFAM-UHFFFAOYSA-N 1 2 317.392 4.043 20 0 DIADLO CC(=O)n1ccc2cc(-c3ccc(-c4[nH]cc[nH+]4)cc3)ccc21 ZINC001243977335 1057827563 /nfs/dbraw/zinc/82/75/63/1057827563.db2.gz ALZKFWNTCFNVQM-UHFFFAOYSA-N 1 2 301.349 4.359 20 0 DIADLO C=C(C(=O)OCC)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001243979219 1057827997 /nfs/dbraw/zinc/82/79/97/1057827997.db2.gz GBVQULPSKCNQTN-UHFFFAOYSA-N 1 2 318.376 4.320 20 0 DIADLO c1c[nH+]c(-c2ccc(-c3ccnc(OCC4CCC4)c3)cc2)[nH]1 ZINC001243981103 1057828079 /nfs/dbraw/zinc/82/80/79/1057828079.db2.gz QNNXRDRVIXKZJM-UHFFFAOYSA-N 1 2 305.381 4.318 20 0 DIADLO CC1(C)NC(=O)Nc2cc(-c3ccc(-c4[nH]cc[nH+]4)cc3)ccc21 ZINC001243980518 1057828084 /nfs/dbraw/zinc/82/80/84/1057828084.db2.gz PCJRHMLWFXQHCX-UHFFFAOYSA-N 1 2 318.380 4.114 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(-c3ncc[nH]3)cc2)cc1 ZINC001243980405 1057828291 /nfs/dbraw/zinc/82/82/91/1057828291.db2.gz XZSVBECXFBBUEV-UHFFFAOYSA-N 1 2 300.365 4.144 20 0 DIADLO COc1ccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)c(C)c1C ZINC001244002443 1057835325 /nfs/dbraw/zinc/83/53/25/1057835325.db2.gz BZYBTJIURMDYNE-UHFFFAOYSA-N 1 2 305.368 4.319 20 0 DIADLO Cc1cn2c(cccc2-c2cc(F)c(OC(C)C)c(F)c2)[nH+]1 ZINC001244110270 1057871713 /nfs/dbraw/zinc/87/17/13/1057871713.db2.gz MHLGQJKMUMMXLL-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Nc1cn2ccc(-c3ccc(COc4ccccc4)cc3)cc2[nH+]1 ZINC001244187048 1057895584 /nfs/dbraw/zinc/89/55/84/1057895584.db2.gz MZJMVHTZRVDRTH-UHFFFAOYSA-N 1 2 315.376 4.163 20 0 DIADLO Nc1ccc(OC(F)(F)F)cc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001244196910 1057898240 /nfs/dbraw/zinc/89/82/40/1057898240.db2.gz HYHGLWJEJDVIGN-UHFFFAOYSA-N 1 2 319.286 4.020 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(N3CCCC3)cc2F)c1 ZINC001244272923 1057919984 /nfs/dbraw/zinc/91/99/84/1057919984.db2.gz UJBVNDUOKRYTQQ-UHFFFAOYSA-N 1 2 321.399 4.493 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(CC(F)(F)F)nc2)c1 ZINC001244294480 1057924962 /nfs/dbraw/zinc/92/49/62/1057924962.db2.gz HXUJXSIQJHVUON-UHFFFAOYSA-N 1 2 308.303 4.215 20 0 DIADLO FC(F)(F)Cc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cn1 ZINC001244293987 1057925201 /nfs/dbraw/zinc/92/52/01/1057925201.db2.gz PWGJQELRUFKKOV-UHFFFAOYSA-N 1 2 317.314 4.098 20 0 DIADLO Cc1ccc(-c2ccc(C(=O)Nc3cccc(F)c3)cc2)[nH+]c1N ZINC001244378833 1057947879 /nfs/dbraw/zinc/94/78/79/1057947879.db2.gz BOUHHDNKRVPWJT-UHFFFAOYSA-N 1 2 321.355 4.031 20 0 DIADLO CCOc1cc(-c2ccc(-n3cc[nH+]c3)cc2OC)ccc1C ZINC001244443230 1057959830 /nfs/dbraw/zinc/95/98/30/1057959830.db2.gz PBWOZDJURREVKM-UHFFFAOYSA-N 1 2 308.381 4.255 20 0 DIADLO COCOc1ccc(C)c(-c2cccc(-c3c[nH+]cn3C)c2)c1 ZINC001244454927 1057962591 /nfs/dbraw/zinc/96/25/91/1057962591.db2.gz PMMHGVMPWBOOBG-UHFFFAOYSA-N 1 2 308.381 4.045 20 0 DIADLO COCOc1ccc(C)c(-c2ccc(-c3c[nH+]cn3C)cc2)c1 ZINC001244455432 1057963274 /nfs/dbraw/zinc/96/32/74/1057963274.db2.gz ULBDVBRCBSXZLF-UHFFFAOYSA-N 1 2 308.381 4.045 20 0 DIADLO Oc1cc(OC(F)(F)F)ccc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001244466484 1057966981 /nfs/dbraw/zinc/96/69/81/1057966981.db2.gz ZHFJHFBUNMWQEV-UHFFFAOYSA-N 1 2 320.270 4.144 20 0 DIADLO CSc1ccc(-c2ccn3cc(N)[nH+]c3c2)cc1C(F)(F)F ZINC001244491393 1057974341 /nfs/dbraw/zinc/97/43/41/1057974341.db2.gz ASLDTKOXXWXBJG-UHFFFAOYSA-N 1 2 323.343 4.324 20 0 DIADLO Fc1cc(Cl)c(-c2cc(-n3cc[nH+]c3)ccn2)c(Cl)c1 ZINC001244498646 1057976184 /nfs/dbraw/zinc/97/61/84/1057976184.db2.gz XYWXYJBCJDXTFS-UHFFFAOYSA-N 1 2 308.143 4.380 20 0 DIADLO COc1c(C)ccc(F)c1-c1cc(N2CCCCC2)cc[nH+]1 ZINC001244522094 1057984444 /nfs/dbraw/zinc/98/44/44/1057984444.db2.gz BFNOHOBVMQBCEE-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO CCCOc1cc(-c2ccc3[nH+]c(C)cn3c2)c(Cl)cn1 ZINC001244606920 1058007644 /nfs/dbraw/zinc/00/76/44/1058007644.db2.gz HQVFLIBHPSBBFX-UHFFFAOYSA-N 1 2 301.777 4.147 20 0 DIADLO CCCOc1cc(-c2cc(C)cn3cc[nH+]c23)c(Cl)cn1 ZINC001244607375 1058007758 /nfs/dbraw/zinc/00/77/58/1058007758.db2.gz MQKJRLVPALACNH-UHFFFAOYSA-N 1 2 301.777 4.147 20 0 DIADLO COCOc1ccc(C(F)(F)F)cc1-c1cccc2[nH+]ccn21 ZINC001244636617 1058016864 /nfs/dbraw/zinc/01/68/64/1058016864.db2.gz LYAHDEOCWPFUAE-UHFFFAOYSA-N 1 2 322.286 4.003 20 0 DIADLO CSc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)cc1Cl ZINC001244736876 1058037190 /nfs/dbraw/zinc/03/71/90/1058037190.db2.gz LHFHBIGSDNMLLS-UHFFFAOYSA-N 1 2 315.829 4.369 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(SC)c(Cl)c1 ZINC001244739385 1058038416 /nfs/dbraw/zinc/03/84/16/1058038416.db2.gz ASIBPVZMJMIHQV-UHFFFAOYSA-N 1 2 304.802 4.385 20 0 DIADLO COc1cc(-c2ccc(-n3cc[nH+]c3)cc2)ccc1OC(C)C ZINC001244887613 1058066148 /nfs/dbraw/zinc/06/61/48/1058066148.db2.gz HTYGJEFCDAAJHP-UHFFFAOYSA-N 1 2 308.381 4.335 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(F)c2ccoc21 ZINC001244931402 1058074090 /nfs/dbraw/zinc/07/40/90/1058074090.db2.gz CAZSQLYUNVBWMM-UHFFFAOYSA-N 1 2 308.312 4.433 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2ccc(CO)c(C)c2Cl)cc1 ZINC001244969267 1058082956 /nfs/dbraw/zinc/08/29/56/1058082956.db2.gz DOEKMCFGLVVIGW-UHFFFAOYSA-N 1 2 303.789 4.170 20 0 DIADLO Cc1c(Cl)c(-c2ccc(Cn3cc[nH+]c3)cc2)ccc1CO ZINC001244970022 1058083412 /nfs/dbraw/zinc/08/34/12/1058083412.db2.gz FJWCSZUHPAAQIA-UHFFFAOYSA-N 1 2 312.800 4.053 20 0 DIADLO CNc1cc(-c2cc(F)c(OCC(F)(F)F)c(F)c2)cc[nH+]1 ZINC001244971109 1058083944 /nfs/dbraw/zinc/08/39/44/1058083944.db2.gz FASBCNPXIAYYLD-UHFFFAOYSA-N 1 2 318.245 4.010 20 0 DIADLO CNc1cc(-c2ccc(-c3c(OC)cccc3OC)cc2)cc[nH+]1 ZINC001244976290 1058083947 /nfs/dbraw/zinc/08/39/47/1058083947.db2.gz HXIMSCNSKJFMFC-UHFFFAOYSA-N 1 2 320.392 4.475 20 0 DIADLO CCOc1c(F)cc(-c2cc[nH+]c(NC)c2)cc1C(F)(F)F ZINC001244975866 1058084186 /nfs/dbraw/zinc/08/41/86/1058084186.db2.gz DSHRKMJEBBZZTK-UHFFFAOYSA-N 1 2 314.282 4.347 20 0 DIADLO Cc1cc(-c2cccc(C3CCC3)c2)c[nH+]c1N1CCOCC1 ZINC001244980502 1058085450 /nfs/dbraw/zinc/08/54/50/1058085450.db2.gz YDIVBOABEBMGJW-UHFFFAOYSA-N 1 2 308.425 4.161 20 0 DIADLO CCOc1cc(C)cc(F)c1-c1ccccc1Cn1cc[nH+]c1 ZINC001245015443 1058093423 /nfs/dbraw/zinc/09/34/23/1058093423.db2.gz YBZAKBDFZIHUOJ-UHFFFAOYSA-N 1 2 310.372 4.445 20 0 DIADLO CCOc1ccc(Cl)cc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001245105265 1058115277 /nfs/dbraw/zinc/11/52/77/1058115277.db2.gz YTCLNHHMWDKCNG-UHFFFAOYSA-N 1 2 316.710 4.402 20 0 DIADLO Cc1cc(-c2cccc(OC(F)(F)F)c2F)cn2cc[nH+]c12 ZINC001245174935 1058123974 /nfs/dbraw/zinc/12/39/74/1058123974.db2.gz JYXGFUYXOBOALU-UHFFFAOYSA-N 1 2 310.250 4.347 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cccc(Cl)c1N ZINC001245178500 1058124760 /nfs/dbraw/zinc/12/47/60/1058124760.db2.gz LWYCCTJKMPXUNA-UHFFFAOYSA-N 1 2 301.821 4.283 20 0 DIADLO COc1cc(-c2c[nH+]cn2Cc2ccccc2)cc2ncccc21 ZINC001245196848 1058126286 /nfs/dbraw/zinc/12/62/86/1058126286.db2.gz IQJAHCFEHZVWLD-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO CCc1nc2cc(-c3c[nH+]cn3Cc3ccccc3)ccc2o1 ZINC001245197835 1058126318 /nfs/dbraw/zinc/12/63/18/1058126318.db2.gz CHNIEUVEJWXAPH-UHFFFAOYSA-N 1 2 303.365 4.302 20 0 DIADLO CC(C)C(=O)Nc1cccc(-c2c[nH+]cn2Cc2ccccc2)c1 ZINC001245197161 1058126339 /nfs/dbraw/zinc/12/63/39/1058126339.db2.gz ONEFAAYQCDBKJA-UHFFFAOYSA-N 1 2 319.408 4.193 20 0 DIADLO Fc1ccc(-c2c[nH+]cn2Cc2ccccc2)cc1OC(F)F ZINC001245197477 1058126421 /nfs/dbraw/zinc/12/64/21/1058126421.db2.gz VXYVNUPVGPSVLL-UHFFFAOYSA-N 1 2 318.298 4.339 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1-c1cccc(N2CCCC2)c1 ZINC001245196950 1058126534 /nfs/dbraw/zinc/12/65/34/1058126534.db2.gz OYRMKFDCEWPFKY-UHFFFAOYSA-N 1 2 303.409 4.199 20 0 DIADLO Fc1ccc2c(c1)nccc2-c1c[nH+]cn1Cc1ccccc1 ZINC001245197675 1058126576 /nfs/dbraw/zinc/12/65/76/1058126576.db2.gz XXFCQLVAUHWKLC-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO CCOc1cc(OC)cc(-c2c[nH+]cn2Cc2ccccc2)c1 ZINC001245200042 1058126791 /nfs/dbraw/zinc/12/67/91/1058126791.db2.gz DFWQTWAIUZFDIP-UHFFFAOYSA-N 1 2 308.381 4.006 20 0 DIADLO COc1ccc2ccc(-c3c[nH+]cn3Cc3ccccc3)cc2n1 ZINC001245198019 1058126850 /nfs/dbraw/zinc/12/68/50/1058126850.db2.gz LNOGQYZATVUWMX-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO COc1ccc2nccc(-c3c[nH+]cn3Cc3ccccc3)c2c1 ZINC001245198481 1058126947 /nfs/dbraw/zinc/12/69/47/1058126947.db2.gz HSRIUOKWKHSQNP-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO COCOc1ccc(-c2c[nH+]cn2Cc2ccccc2)c(C)c1C ZINC001245198421 1058127073 /nfs/dbraw/zinc/12/70/73/1058127073.db2.gz FLBOBLHFAZQSEO-UHFFFAOYSA-N 1 2 322.408 4.198 20 0 DIADLO CCOc1ccc(-c2c[nH+]cn2Cc2ccccc2)cc1OC ZINC001245201998 1058127565 /nfs/dbraw/zinc/12/75/65/1058127565.db2.gz UJYGYNBZKQIXKK-UHFFFAOYSA-N 1 2 308.381 4.006 20 0 DIADLO CC(=O)OCc1cc(-c2cc[nH+]c(N3CCCCC3)c2)ccc1C ZINC001245376654 1058156558 /nfs/dbraw/zinc/15/65/58/1058156558.db2.gz ITFGDGYVRTYITQ-UHFFFAOYSA-N 1 2 324.424 4.110 20 0 DIADLO FC(F)(F)CSc1cccc(-c2c[nH+]c3c(c2)CCCN3)c1 ZINC001245412095 1058162490 /nfs/dbraw/zinc/16/24/90/1058162490.db2.gz AGLVXYBLNKYQJJ-UHFFFAOYSA-N 1 2 324.371 4.404 20 0 DIADLO Cc1cc(NC(=O)C=C[C@]2(C)CC[C@@H](C)C2(C)C)c(C)c[nH+]1 ZINC001527662912 1058199420 /nfs/dbraw/zinc/19/94/20/1058199420.db2.gz XDPGDQNBFDGNOX-OYKHKUDJSA-N 1 2 300.446 4.077 20 0 DIADLO Cc1cc(-c2cnc3c(cccc3C(F)(F)F)c2)c[nH+]c1N ZINC001245538836 1058218156 /nfs/dbraw/zinc/21/81/56/1058218156.db2.gz IHMAJXYVDBPWOX-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO CCOC(=O)c1csc2cc(-c3c[nH+]c(N)c(C)c3)ccc12 ZINC001245540866 1058218334 /nfs/dbraw/zinc/21/83/34/1058218334.db2.gz JAQMIRVCFLZBAG-UHFFFAOYSA-N 1 2 312.394 4.031 20 0 DIADLO Cc1cc(-c2nc(C)nc3sc4c(c32)CCCCC4)c[nH+]c1N ZINC001245538914 1058219759 /nfs/dbraw/zinc/21/97/59/1058219759.db2.gz SBRYYQNKSZVADV-UHFFFAOYSA-N 1 2 324.453 4.221 20 0 DIADLO CCCC(CCC)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001517193098 1058236756 /nfs/dbraw/zinc/23/67/56/1058236756.db2.gz OSXFYZQALZYXPL-UHFFFAOYSA-N 1 2 303.381 4.166 20 0 DIADLO CCC1CCC(C(=O)N2CCCC[C@@H]2c2c[nH+]cn2CC)CC1 ZINC001548831467 1058262913 /nfs/dbraw/zinc/26/29/13/1058262913.db2.gz BMFIEZHFKJNXDV-OFLPRAFFSA-N 1 2 317.477 4.173 20 0 DIADLO COc1ccc2[nH]c(-c3ccccc3Cn3cc[nH+]c3)cc2c1 ZINC001245595621 1058269135 /nfs/dbraw/zinc/26/91/35/1058269135.db2.gz FHFAVYBYOGHBDO-UHFFFAOYSA-N 1 2 303.365 4.088 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc2c(c1)C(=O)CCCC2 ZINC001245601430 1058277722 /nfs/dbraw/zinc/27/77/22/1058277722.db2.gz WWJVGEKQBUCXRA-UHFFFAOYSA-N 1 2 306.365 4.148 20 0 DIADLO CCn1c[nH+]cc1[C@@H]1CCCCN1C(=O)[C@H]1C[C@H]1CC(C)(C)C ZINC001549059465 1058281969 /nfs/dbraw/zinc/28/19/69/1058281969.db2.gz FFTZOMHBCLJHNA-JYJNAYRXSA-N 1 2 317.477 4.029 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2Cc2ccnc(F)c2C)sc1C ZINC001549631724 1058299531 /nfs/dbraw/zinc/29/95/31/1058299531.db2.gz LAGZZZQLHCCHPA-HNNXBMFYSA-N 1 2 319.449 4.330 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2Cc2ccnc(F)c2C)sc1C ZINC001549631724 1058299544 /nfs/dbraw/zinc/29/95/44/1058299544.db2.gz LAGZZZQLHCCHPA-HNNXBMFYSA-N 1 2 319.449 4.330 20 0 DIADLO c1c(C[N@@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@H]32)noc1C1CC1 ZINC001550641067 1058351421 /nfs/dbraw/zinc/35/14/21/1058351421.db2.gz BDOJUWLFNIGYNW-QYZOEREBSA-N 1 2 324.424 4.047 20 0 DIADLO c1c(C[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@H]32)noc1C1CC1 ZINC001550641067 1058351438 /nfs/dbraw/zinc/35/14/38/1058351438.db2.gz BDOJUWLFNIGYNW-QYZOEREBSA-N 1 2 324.424 4.047 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)c(C)[nH+]1 ZINC001562900836 1058357444 /nfs/dbraw/zinc/35/74/44/1058357444.db2.gz SUDCASITPGQGAS-GVDBMIGSSA-N 1 2 315.461 4.487 20 0 DIADLO CC(C)Oc1cc(F)c(-c2cc[nH+]c3c2CCN3)cc1Cl ZINC001245710064 1058383257 /nfs/dbraw/zinc/38/32/57/1058383257.db2.gz WVAXOXZITNSSMN-UHFFFAOYSA-N 1 2 306.768 4.296 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCC(c2c[nH+]cn2C)CC1 ZINC001519058898 1058398226 /nfs/dbraw/zinc/39/82/26/1058398226.db2.gz HEXLOUGLZZCRND-MRXNPFEDSA-N 1 2 319.493 4.123 20 0 DIADLO COc1ccc2oc(C)c(C(=O)Nc3c(C)cc(C)[nH+]c3C)c2c1 ZINC001528347209 1058398259 /nfs/dbraw/zinc/39/82/59/1058398259.db2.gz KRXGQFDJZKJMIY-UHFFFAOYSA-N 1 2 324.380 4.322 20 0 DIADLO Cc1cc(C)c(NC(=O)CCc2cncc3ccccc32)c(C)[nH+]1 ZINC001528347188 1058398633 /nfs/dbraw/zinc/39/86/33/1058398633.db2.gz JRSHDPUAMFDXGM-UHFFFAOYSA-N 1 2 319.408 4.126 20 0 DIADLO CC[C@@H](CC(F)F)C(=O)Nc1ccccc1-c1[nH]c(C)c(C)[nH+]1 ZINC001551743669 1058410548 /nfs/dbraw/zinc/41/05/48/1058410548.db2.gz YHYNXEFNOJNSOJ-LBPRGKRZSA-N 1 2 321.371 4.313 20 0 DIADLO COc1c(Cl)ccc(F)c1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001245731259 1058411054 /nfs/dbraw/zinc/41/10/54/1058411054.db2.gz IOCPATRRISDYOQ-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H]3CC[C@@H]4CCCC[C@H]4C3)ccc2[nH+]1 ZINC001519733594 1058468605 /nfs/dbraw/zinc/46/86/05/1058468605.db2.gz VPZPZTFVMIQWEP-HRCADAONSA-N 1 2 311.429 4.188 20 0 DIADLO COc1c(F)c(Cl)ccc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001245800242 1058480778 /nfs/dbraw/zinc/48/07/78/1058480778.db2.gz ZBBCXAUSJOTSEO-UHFFFAOYSA-N 1 2 320.673 4.151 20 0 DIADLO COc1ccc(Cl)cc1-c1ccc(-n2cc[nH+]c2)cc1OC ZINC001245814798 1058500816 /nfs/dbraw/zinc/50/08/16/1058500816.db2.gz VVMFWUJQDQKSLZ-UHFFFAOYSA-N 1 2 314.772 4.210 20 0 DIADLO Cc1cc(N[C@@H]2CCO[C@H](c3ccccn3)C2)[nH+]c2ccccc12 ZINC001553701542 1058501159 /nfs/dbraw/zinc/50/11/59/1058501159.db2.gz BRWLOJXFRVRMDX-BEFAXECRSA-N 1 2 319.408 4.270 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)c2cc(C(C)C)no2)[nH+]c1C ZINC001553989378 1058510838 /nfs/dbraw/zinc/51/08/38/1058510838.db2.gz QKNBMYFLTQWREU-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO CCCc1occc1C(=O)Nc1ccccc1-c1[nH]c(C)c(C)[nH+]1 ZINC001553990111 1058511832 /nfs/dbraw/zinc/51/18/32/1058511832.db2.gz WMWHDUNKGXHPDL-UHFFFAOYSA-N 1 2 323.396 4.491 20 0 DIADLO CCc1oc(C(=O)Nc2ccccc2-c2[nH]c(C)c(C)[nH+]2)cc1C ZINC001553989482 1058512107 /nfs/dbraw/zinc/51/21/07/1058512107.db2.gz SZXYKGAIIWEVHD-UHFFFAOYSA-N 1 2 323.396 4.410 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2sccc2-c2ccccc2)c[nH+]1 ZINC001528920100 1058553990 /nfs/dbraw/zinc/55/39/90/1058553990.db2.gz LZQOEJULHSXJSW-UHFFFAOYSA-N 1 2 322.433 4.357 20 0 DIADLO CCC1(CC)CCCN(C(=O)[C@H](CC(C)C)n2cc[nH+]c2)CC1 ZINC001556210303 1058558508 /nfs/dbraw/zinc/55/85/08/1058558508.db2.gz UDTRDWAGLYGJJU-KRWDZBQOSA-N 1 2 319.493 4.289 20 0 DIADLO Cc1ccc(NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)c(N(C)C)[nH+]1 ZINC001520248529 1058569016 /nfs/dbraw/zinc/56/90/16/1058569016.db2.gz QMISHAVBXMBPHP-WKILWMFISA-N 1 2 315.461 4.001 20 0 DIADLO Cc1cc(C)c(C(=O)NC2CC(C)(C)CC(C)(C)C2)c(C)[nH+]1 ZINC001520309971 1058582279 /nfs/dbraw/zinc/58/22/79/1058582279.db2.gz DOPZCNQZDXQJRO-UHFFFAOYSA-N 1 2 302.462 4.342 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C)CCC2CCCCC2)c(C)[nH+]1 ZINC001529376055 1058690231 /nfs/dbraw/zinc/69/02/31/1058690231.db2.gz MABHBNJAGBNPRB-AWEZNQCLSA-N 1 2 302.462 4.486 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)CCCCC(C)C)n1 ZINC001557257060 1058722551 /nfs/dbraw/zinc/72/25/51/1058722551.db2.gz HKFFEBPJBXFNPH-UHFFFAOYSA-N 1 2 311.495 4.140 20 0 DIADLO Cc1cccc(-c2cccc(C(=O)Nc3cc(C)[nH+]cc3C)c2)c1 ZINC001521207898 1058785688 /nfs/dbraw/zinc/78/56/88/1058785688.db2.gz BFOPQALMKRZXGF-UHFFFAOYSA-N 1 2 316.404 4.348 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3CCCC[C@H]3C)cc2)[nH+]c1C ZINC001558135426 1058840655 /nfs/dbraw/zinc/84/06/55/1058840655.db2.gz QQBONBVESZSASA-PXAZEXFGSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C34CCC(CC3)C4)cc2)[nH+]c1C ZINC001558135593 1058841586 /nfs/dbraw/zinc/84/15/86/1058841586.db2.gz UISALLLKXQECAN-UHFFFAOYSA-N 1 2 309.413 4.212 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C(F)=C3CCCC3)cc2)[nH+]c1C ZINC001558134706 1058842654 /nfs/dbraw/zinc/84/26/54/1058842654.db2.gz IRJLYWBZQJHBOL-UHFFFAOYSA-N 1 2 313.376 4.430 20 0 DIADLO CCCCCC[C@@H](C)C(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001558351054 1058861458 /nfs/dbraw/zinc/86/14/58/1058861458.db2.gz FYDFLNLHIOKFNU-CZUORRHYSA-N 1 2 305.466 4.297 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)CC2(C)CCCCC2)[nH+]c1C ZINC001558353944 1058863885 /nfs/dbraw/zinc/86/38/85/1058863885.db2.gz ZPSUWWUZHNZEBR-HNNXBMFYSA-N 1 2 303.450 4.051 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@H]3CCSc4ccccc43)ccn12 ZINC001521455850 1058875988 /nfs/dbraw/zinc/87/59/88/1058875988.db2.gz SNBCJYCTVCIXDM-HNNXBMFYSA-N 1 2 324.405 4.037 20 0 DIADLO CC(C)(C)Cc1ccccc1C(=O)Nc1cccc2[nH+]ccn21 ZINC001521673337 1058937924 /nfs/dbraw/zinc/93/79/24/1058937924.db2.gz JJUAEZBYZYIFAF-UHFFFAOYSA-N 1 2 307.397 4.175 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3cccc4sccc43)ccn12 ZINC001530172398 1058960390 /nfs/dbraw/zinc/96/03/90/1058960390.db2.gz CMJXEVSWPMPVNJ-UHFFFAOYSA-N 1 2 308.362 4.077 20 0 DIADLO CCc1cc(N2CCC[C@](C)(c3ccccc3)C2)nc(CC)[nH+]1 ZINC001559102511 1058991096 /nfs/dbraw/zinc/99/10/96/1058991096.db2.gz TUZIIGVIZCHWNQ-FQEVSTJZSA-N 1 2 309.457 4.160 20 0 DIADLO Cc1cc(NCc2ccccc2OCC2CC2)nc(C2CCC2)[nH+]1 ZINC001559113125 1059001741 /nfs/dbraw/zinc/00/17/41/1059001741.db2.gz YQBLHPREMNXJJD-UHFFFAOYSA-N 1 2 323.440 4.453 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3ccc(Cl)cc3Cl)ccn12 ZINC001521861253 1059011638 /nfs/dbraw/zinc/01/16/38/1059011638.db2.gz DAMCZLCHZWKUKT-UHFFFAOYSA-N 1 2 321.163 4.169 20 0 DIADLO CO[C@]1(C)C[C@@H](N(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)C1(C)C ZINC001559125174 1059013832 /nfs/dbraw/zinc/01/38/32/1059013832.db2.gz FRHQXHKPJDHPOL-DNVCBOLYSA-N 1 2 319.493 4.363 20 0 DIADLO Cc1nc(N[C@@H](C)c2cccc(F)c2F)c2c([nH+]1)CCCC2 ZINC001559144564 1059031181 /nfs/dbraw/zinc/03/11/81/1059031181.db2.gz QFRXAHXJQSPCRL-JTQLQIEISA-N 1 2 303.356 4.115 20 0 DIADLO Cc1ccc([C@@H]2CCN(c3cc(C)[nH+]c(C4CCC4)n3)C2)cc1 ZINC001559163209 1059048059 /nfs/dbraw/zinc/04/80/59/1059048059.db2.gz MNLMRCPTFNQSQG-GOSISDBHSA-N 1 2 307.441 4.355 20 0 DIADLO Cc1cc(N(C)Cc2ccc(F)c(Cl)c2)nc(C2CCC2)[nH+]1 ZINC001559165144 1059051037 /nfs/dbraw/zinc/05/10/37/1059051037.db2.gz LMJMUFUUPYZJSK-UHFFFAOYSA-N 1 2 319.811 4.481 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)N(c3nc(C)[nH+]c4c3CCCC4)C2)cc1 ZINC001559179057 1059060716 /nfs/dbraw/zinc/06/07/16/1059060716.db2.gz KSUUBCBHIMDSCK-MAUKXSAKSA-N 1 2 321.468 4.355 20 0 DIADLO CCCC1CCC(N(C)c2nc(C)[nH+]c3c2CCCC3)CC1 ZINC001559182857 1059067094 /nfs/dbraw/zinc/06/70/94/1059067094.db2.gz XKMJTIBQBULLSE-UHFFFAOYSA-N 1 2 301.478 4.459 20 0 DIADLO Cc1cccc(CCCNc2cc(C(C)C)[nH+]c(C(C)C)n2)n1 ZINC001559186394 1059068285 /nfs/dbraw/zinc/06/82/85/1059068285.db2.gz CZDMMGVOXPMWSP-UHFFFAOYSA-N 1 2 312.461 4.472 20 0 DIADLO Cc1nc(N(C)[C@@H]2CCC[C@H]2C(C)(C)C)c2c([nH+]1)CCCC2 ZINC001559216043 1059096367 /nfs/dbraw/zinc/09/63/67/1059096367.db2.gz MILRSYWTYHLTPG-NVXWUHKLSA-N 1 2 301.478 4.315 20 0 DIADLO CCc1cc(NCc2ccccc2CC(F)(F)F)nc(CC)[nH+]1 ZINC001559251318 1059122735 /nfs/dbraw/zinc/12/27/35/1059122735.db2.gz LYASQBRBZBPNOZ-UHFFFAOYSA-N 1 2 323.362 4.318 20 0 DIADLO CCc1cn(CC/C=C/c2ccc(Br)cc2)c[nH+]1 ZINC001559466435 1059247035 /nfs/dbraw/zinc/24/70/35/1059247035.db2.gz UWPJYTNXYIKGDJ-HWKANZROSA-N 1 2 305.219 4.312 20 0 DIADLO CCC(C)(C)c1ccccc1C(=O)Nc1cccc2[nH+]ccn21 ZINC001531283697 1059268909 /nfs/dbraw/zinc/26/89/09/1059268909.db2.gz BUSIHFJZEATCAK-UHFFFAOYSA-N 1 2 307.397 4.274 20 0 DIADLO C[N@@H+](Cc1c(Cl)cccc1Cl)C[C@@H]1CC[C@H](C2CC2)O1 ZINC001559501633 1059288120 /nfs/dbraw/zinc/28/81/20/1059288120.db2.gz REQWIHKWNFMFJV-BLLLJJGKSA-N 1 2 314.256 4.383 20 0 DIADLO C[N@H+](Cc1c(Cl)cccc1Cl)C[C@@H]1CC[C@H](C2CC2)O1 ZINC001559501633 1059288140 /nfs/dbraw/zinc/28/81/40/1059288140.db2.gz REQWIHKWNFMFJV-BLLLJJGKSA-N 1 2 314.256 4.383 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+](Cc2ccco2)C(C)C)cc1Cl ZINC001559505043 1059291377 /nfs/dbraw/zinc/29/13/77/1059291377.db2.gz BEUNZDSCRDGIEK-UHFFFAOYSA-N 1 2 320.820 4.091 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+](Cc2ccco2)C(C)C)cc1Cl ZINC001559505043 1059291395 /nfs/dbraw/zinc/29/13/95/1059291395.db2.gz BEUNZDSCRDGIEK-UHFFFAOYSA-N 1 2 320.820 4.091 20 0 DIADLO Cc1ccc(-c2ccc(-c3noc(Cc4c[nH]c[nH+]4)n3)cc2)cc1 ZINC001247138431 1059310238 /nfs/dbraw/zinc/31/02/38/1059310238.db2.gz UPQXPDLBOQFBAF-UHFFFAOYSA-N 1 2 316.364 4.026 20 0 DIADLO C(=C/c1nc(-c2ccccc2-n2cc[nH+]c2)no1)\c1ccsc1 ZINC001247177240 1059325591 /nfs/dbraw/zinc/32/55/91/1059325591.db2.gz MZXLEQMGVINVSH-AATRIKPKSA-N 1 2 320.377 4.154 20 0 DIADLO CN(Cc1nc(-c2ccc(C(C)(C)C)cc2)no1)c1cccc[nH+]1 ZINC001247196927 1059334524 /nfs/dbraw/zinc/33/45/24/1059334524.db2.gz KEVKNSRJGXTAKR-UHFFFAOYSA-N 1 2 322.412 4.066 20 0 DIADLO Cc1ccc(-c2noc([C@H]3CCC[N@@H+]3Cc3ccco3)n2)cc1C ZINC001247223780 1059350858 /nfs/dbraw/zinc/35/08/58/1059350858.db2.gz MRNWFEDGLPDSOP-QGZVFWFLSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1ccc(-c2noc([C@H]3CCC[N@H+]3Cc3ccco3)n2)cc1C ZINC001247223780 1059350873 /nfs/dbraw/zinc/35/08/73/1059350873.db2.gz MRNWFEDGLPDSOP-QGZVFWFLSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cc(C)cc(-c2noc([C@H]3CCC[N@@H+]3Cc3ccco3)n2)c1 ZINC001247226338 1059352118 /nfs/dbraw/zinc/35/21/18/1059352118.db2.gz UDSQAVJFUQTSKG-QGZVFWFLSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cc(C)cc(-c2noc([C@H]3CCC[N@H+]3Cc3ccco3)n2)c1 ZINC001247226338 1059352135 /nfs/dbraw/zinc/35/21/35/1059352135.db2.gz UDSQAVJFUQTSKG-QGZVFWFLSA-N 1 2 323.396 4.284 20 0 DIADLO O=C(C[N@@H+]1CCCCC[C@@H]1c1ccco1)c1ccccc1F ZINC001559549527 1059358126 /nfs/dbraw/zinc/35/81/26/1059358126.db2.gz PLADRRXNAAGNSL-MRXNPFEDSA-N 1 2 301.361 4.219 20 0 DIADLO O=C(C[N@H+]1CCCCC[C@@H]1c1ccco1)c1ccccc1F ZINC001559549527 1059358144 /nfs/dbraw/zinc/35/81/44/1059358144.db2.gz PLADRRXNAAGNSL-MRXNPFEDSA-N 1 2 301.361 4.219 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC2(C1)CCCCC2 ZINC001559562257 1059379895 /nfs/dbraw/zinc/37/98/95/1059379895.db2.gz YRKYDDWKQRGWIW-MRXNPFEDSA-N 1 2 321.848 4.210 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CCC2(C1)CCCCC2 ZINC001559562257 1059379920 /nfs/dbraw/zinc/37/99/20/1059379920.db2.gz YRKYDDWKQRGWIW-MRXNPFEDSA-N 1 2 321.848 4.210 20 0 DIADLO CC(C)C[C@H]1CC[N@H+](Cc2c(F)c(F)c(F)c(F)c2F)C1 ZINC001559575537 1059407361 /nfs/dbraw/zinc/40/73/61/1059407361.db2.gz GRXZPTIOGCOPTB-SECBINFHSA-N 1 2 307.306 4.250 20 0 DIADLO CC(C)C[C@H]1CC[N@@H+](Cc2c(F)c(F)c(F)c(F)c2F)C1 ZINC001559575537 1059407367 /nfs/dbraw/zinc/40/73/67/1059407367.db2.gz GRXZPTIOGCOPTB-SECBINFHSA-N 1 2 307.306 4.250 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC001559603286 1059436720 /nfs/dbraw/zinc/43/67/20/1059436720.db2.gz QCVVCWCIEQTYJO-STQMWFEESA-N 1 2 309.837 4.207 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC001559603286 1059436728 /nfs/dbraw/zinc/43/67/28/1059436728.db2.gz QCVVCWCIEQTYJO-STQMWFEESA-N 1 2 309.837 4.207 20 0 DIADLO COc1cc(C)[nH+]c(CN(c2ccc(Cl)cc2)C(C)C)c1 ZINC001559623548 1059452673 /nfs/dbraw/zinc/45/26/73/1059452673.db2.gz ARZDHAPUUZSNGB-UHFFFAOYSA-N 1 2 304.821 4.467 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ccncc2F)C2CCCC2)c(F)c1 ZINC001559634977 1059461088 /nfs/dbraw/zinc/46/10/88/1059461088.db2.gz GQOSCCWCUZXGSY-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ccncc2F)C2CCCC2)c(F)c1 ZINC001559634977 1059461095 /nfs/dbraw/zinc/46/10/95/1059461095.db2.gz GQOSCCWCUZXGSY-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO CCOC(=O)C[N@H+](Cc1ccc(C)cc1)[C@@H]1CCc2ccccc21 ZINC001559640532 1059466958 /nfs/dbraw/zinc/46/69/58/1059466958.db2.gz XUDBXIPXHGVUDW-HXUWFJFHSA-N 1 2 323.436 4.048 20 0 DIADLO CCOC(=O)C[N@@H+](Cc1ccc(C)cc1)[C@@H]1CCc2ccccc21 ZINC001559640532 1059466968 /nfs/dbraw/zinc/46/69/68/1059466968.db2.gz XUDBXIPXHGVUDW-HXUWFJFHSA-N 1 2 323.436 4.048 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@H+](Cc3ccc(Cl)nn3)CC2)c1 ZINC001559657740 1059486671 /nfs/dbraw/zinc/48/66/71/1059486671.db2.gz PNXMWVNISZXXCE-UHFFFAOYSA-N 1 2 313.832 4.036 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@@H+](Cc3ccc(Cl)nn3)CC2)c1 ZINC001559657740 1059486684 /nfs/dbraw/zinc/48/66/84/1059486684.db2.gz PNXMWVNISZXXCE-UHFFFAOYSA-N 1 2 313.832 4.036 20 0 DIADLO Cc1ccc(N2CC[NH+]([C@H](C)c3ccc(F)cc3F)CC2)cc1 ZINC001559671545 1059499086 /nfs/dbraw/zinc/49/90/86/1059499086.db2.gz VOZFLXUMYDVCAD-OAHLLOKOSA-N 1 2 316.395 4.156 20 0 DIADLO C[C@@H]([NH2+]CCOC1CCCCC1)c1nc(C2CCCCC2)no1 ZINC001559730699 1059560724 /nfs/dbraw/zinc/56/07/24/1059560724.db2.gz NLIKIXYDSPYGAS-CQSZACIVSA-N 1 2 321.465 4.117 20 0 DIADLO CCOc1cccc2cc([C@@H](C)[NH2+]Cc3nccs3)oc21 ZINC001559729101 1059562416 /nfs/dbraw/zinc/56/24/16/1059562416.db2.gz METOVSJCACEVKD-LLVKDONJSA-N 1 2 302.399 4.139 20 0 DIADLO CCOC(=O)[C@@H](CC)[N@H+](C/C=C/c1ccc(Cl)cc1)C1CC1 ZINC001559766038 1059600804 /nfs/dbraw/zinc/60/08/04/1059600804.db2.gz WMFGKFSVHFBYGV-FUTAKVPZSA-N 1 2 321.848 4.159 20 0 DIADLO CCOC(=O)[C@@H](CC)[N@@H+](C/C=C/c1ccc(Cl)cc1)C1CC1 ZINC001559766038 1059600813 /nfs/dbraw/zinc/60/08/13/1059600813.db2.gz WMFGKFSVHFBYGV-FUTAKVPZSA-N 1 2 321.848 4.159 20 0 DIADLO C[C@@H]1CCCC[C@@H]1c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001247734537 1059604816 /nfs/dbraw/zinc/60/48/16/1059604816.db2.gz LOHIVSLZFLUZIF-KGLIPLIRSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@H]1CCCC[C@@H]1c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001247734535 1059604896 /nfs/dbraw/zinc/60/48/96/1059604896.db2.gz LOHIVSLZFLUZIF-KBPBESRZSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@@H]1CCCC[C@H]1c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001247734541 1059605257 /nfs/dbraw/zinc/60/52/57/1059605257.db2.gz LOHIVSLZFLUZIF-ZIAGYGMSSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@H]1CCCC[C@H]1c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001247733942 1059605404 /nfs/dbraw/zinc/60/54/04/1059605404.db2.gz HJMLQYSSWNJAON-XJKSGUPXSA-N 1 2 308.385 4.216 20 0 DIADLO COc1ccc2c(c1)OCC[N@@H+](Cc1ccc(C)cc1Cl)C2 ZINC001559785989 1059622064 /nfs/dbraw/zinc/62/20/64/1059622064.db2.gz NZWNDLVEXHJHMS-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO COc1ccc2c(c1)OCC[N@H+](Cc1ccc(C)cc1Cl)C2 ZINC001559785989 1059622071 /nfs/dbraw/zinc/62/20/71/1059622071.db2.gz NZWNDLVEXHJHMS-UHFFFAOYSA-N 1 2 317.816 4.052 20 0 DIADLO CCC(CC)([NH2+]Cc1c(C)c(C)c(C)c(C)c1C)C(=O)OC ZINC001559790238 1059626001 /nfs/dbraw/zinc/62/60/01/1059626001.db2.gz MPSHXOJATZCCQG-UHFFFAOYSA-N 1 2 305.462 4.050 20 0 DIADLO CC(C)Cc1ccccc1C[N@@H+]1C[C@H](C(F)(F)F)OC[C@H]1C ZINC001559825077 1059657682 /nfs/dbraw/zinc/65/76/82/1059657682.db2.gz DHRMGGJSUULJMK-CZUORRHYSA-N 1 2 315.379 4.037 20 0 DIADLO CC(C)Cc1ccccc1C[N@H+]1C[C@H](C(F)(F)F)OC[C@H]1C ZINC001559825077 1059657688 /nfs/dbraw/zinc/65/76/88/1059657688.db2.gz DHRMGGJSUULJMK-CZUORRHYSA-N 1 2 315.379 4.037 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@@H+](CC[C@H]1CC1(Cl)Cl)CC2 ZINC001559874992 1059692818 /nfs/dbraw/zinc/69/28/18/1059692818.db2.gz IBCXGYZYOVRTBK-JTQLQIEISA-N 1 2 322.638 4.421 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@H+](CC[C@H]1CC1(Cl)Cl)CC2 ZINC001559874992 1059692824 /nfs/dbraw/zinc/69/28/24/1059692824.db2.gz IBCXGYZYOVRTBK-JTQLQIEISA-N 1 2 322.638 4.421 20 0 DIADLO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1ncc(Br)cc1Cl ZINC001559913639 1059730162 /nfs/dbraw/zinc/73/01/62/1059730162.db2.gz QNPWBCMQBVUBJB-SECBINFHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC(C)(C)C[N@H+]1Cc1ncc(Br)cc1Cl ZINC001559913639 1059730180 /nfs/dbraw/zinc/73/01/80/1059730180.db2.gz QNPWBCMQBVUBJB-SECBINFHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3Cc4ccccc4C[N@H+]3C)n2)cc1C ZINC001248121258 1059734468 /nfs/dbraw/zinc/73/44/68/1059734468.db2.gz SGLFTGHOZXTKEO-SFHVURJKSA-N 1 2 319.408 4.083 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3Cc4ccccc4C[N@@H+]3C)n2)cc1C ZINC001248121258 1059734486 /nfs/dbraw/zinc/73/44/86/1059734486.db2.gz SGLFTGHOZXTKEO-SFHVURJKSA-N 1 2 319.408 4.083 20 0 DIADLO C[C@@H]1C[N@H+](CCc2c(Cl)cccc2Cl)C2(CCC2)CO1 ZINC001559967937 1059774754 /nfs/dbraw/zinc/77/47/54/1059774754.db2.gz OWWRJIMGHRDSSO-GFCCVEGCSA-N 1 2 314.256 4.179 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)C2(CCC2)CO1 ZINC001559967937 1059774770 /nfs/dbraw/zinc/77/47/70/1059774770.db2.gz OWWRJIMGHRDSSO-GFCCVEGCSA-N 1 2 314.256 4.179 20 0 DIADLO CC1(C)CO[C@@H](c2cccc(F)c2)C[N@@H+]1Cc1ccc(F)cc1 ZINC001560001588 1059807173 /nfs/dbraw/zinc/80/71/73/1059807173.db2.gz NBEMLCIRXWTILJ-GOSISDBHSA-N 1 2 317.379 4.317 20 0 DIADLO CC1(C)CO[C@@H](c2cccc(F)c2)C[N@H+]1Cc1ccc(F)cc1 ZINC001560001588 1059807201 /nfs/dbraw/zinc/80/72/01/1059807201.db2.gz NBEMLCIRXWTILJ-GOSISDBHSA-N 1 2 317.379 4.317 20 0 DIADLO CCc1onc(C)c1C[N@@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC001560048942 1059860240 /nfs/dbraw/zinc/86/02/40/1059860240.db2.gz HJVSJDJSUHNQIJ-UHFFFAOYSA-N 1 2 324.346 4.123 20 0 DIADLO CCc1onc(C)c1C[N@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC001560048942 1059860267 /nfs/dbraw/zinc/86/02/67/1059860267.db2.gz HJVSJDJSUHNQIJ-UHFFFAOYSA-N 1 2 324.346 4.123 20 0 DIADLO Fc1ccc(F)c(C[NH2+]C2(c3c(F)cccc3F)CCC2)c1 ZINC001560046469 1059861012 /nfs/dbraw/zinc/86/10/12/1059861012.db2.gz PYRIOHGVKDEAAQ-UHFFFAOYSA-N 1 2 309.306 4.412 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2c3ccoc3ccc2F)no1 ZINC001248523968 1059865354 /nfs/dbraw/zinc/86/53/54/1059865354.db2.gz IZDMQYGBNRZFMB-MRXNPFEDSA-N 1 2 300.333 4.205 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2c3ccoc3ccc2F)no1 ZINC001248523968 1059865384 /nfs/dbraw/zinc/86/53/84/1059865384.db2.gz IZDMQYGBNRZFMB-MRXNPFEDSA-N 1 2 300.333 4.205 20 0 DIADLO Fc1ccc2occc2c1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC001248542122 1059872099 /nfs/dbraw/zinc/87/20/99/1059872099.db2.gz YLQXMTLCFLOVGL-CQSZACIVSA-N 1 2 302.374 4.366 20 0 DIADLO Fc1ccc2occc2c1C[N@H+]1CCC[C@@H]1c1nccs1 ZINC001248542122 1059872129 /nfs/dbraw/zinc/87/21/29/1059872129.db2.gz YLQXMTLCFLOVGL-CQSZACIVSA-N 1 2 302.374 4.366 20 0 DIADLO C[N@H+](Cc1nc2ccccc2o1)Cc1c2ccoc2ccc1F ZINC001248541461 1059875757 /nfs/dbraw/zinc/87/57/57/1059875757.db2.gz BRGLPALUGHYXHM-UHFFFAOYSA-N 1 2 310.328 4.345 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2o1)Cc1c2ccoc2ccc1F ZINC001248541461 1059875778 /nfs/dbraw/zinc/87/57/78/1059875778.db2.gz BRGLPALUGHYXHM-UHFFFAOYSA-N 1 2 310.328 4.345 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@H+](Cc2ccc(Cl)nc2)C1 ZINC001560081005 1059892848 /nfs/dbraw/zinc/89/28/48/1059892848.db2.gz BIRWBNJYXPALTL-QGZVFWFLSA-N 1 2 304.796 4.196 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@@H+](Cc2ccc(Cl)nc2)C1 ZINC001560081005 1059892863 /nfs/dbraw/zinc/89/28/63/1059892863.db2.gz BIRWBNJYXPALTL-QGZVFWFLSA-N 1 2 304.796 4.196 20 0 DIADLO C[C@]1(C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C=CCC1 ZINC001525473871 1059905821 /nfs/dbraw/zinc/90/58/21/1059905821.db2.gz AJLTZIQSRRUINF-FQEVSTJZSA-N 1 2 321.424 4.181 20 0 DIADLO Cc1ccc(Oc2ccc(Nc3[nH+]cccc3CCO)cc2)cc1 ZINC001248614595 1059915339 /nfs/dbraw/zinc/91/53/39/1059915339.db2.gz OICQZAYEVVZNDB-UHFFFAOYSA-N 1 2 320.392 4.461 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CCCc3c(C)cccc32)c(C)[nH+]1 ZINC001533508352 1059916425 /nfs/dbraw/zinc/91/64/25/1059916425.db2.gz MQHBHTGOIQQJMW-GOSISDBHSA-N 1 2 308.425 4.123 20 0 DIADLO COc1c(C[NH+]2CC3(C2)CCCC3)ccc(Cl)c1Cl ZINC001248628329 1059918539 /nfs/dbraw/zinc/91/85/39/1059918539.db2.gz NCZFSEHVKJXKQA-UHFFFAOYSA-N 1 2 300.229 4.378 20 0 DIADLO COc1c(C[NH+]2CCC(C(F)F)CC2)ccc(Cl)c1Cl ZINC001248641337 1059920168 /nfs/dbraw/zinc/92/01/68/1059920168.db2.gz GZOCDRXPYUIDFR-UHFFFAOYSA-N 1 2 324.198 4.479 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CCC[C@@H](c3ccccc3)C2)c(C)[nH+]1 ZINC001525522465 1059922914 /nfs/dbraw/zinc/92/29/14/1059922914.db2.gz HHYRODPLNIOCTE-RTBURBONSA-N 1 2 322.452 4.463 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cnn(CC(F)(F)F)c3)ccc12 ZINC001248666208 1059927171 /nfs/dbraw/zinc/92/71/71/1059927171.db2.gz SEFRQXGTBOWJSZ-UHFFFAOYSA-N 1 2 306.291 4.046 20 0 DIADLO CCCCCCc1csc(C[N@H+]2CCC(=O)[C@H](F)CC2)c1 ZINC001248682722 1059934491 /nfs/dbraw/zinc/93/44/91/1059934491.db2.gz CMDVONSIKRTNSZ-MRXNPFEDSA-N 1 2 311.466 4.374 20 0 DIADLO CCCCCCc1csc(C[N@@H+]2CCC(=O)[C@H](F)CC2)c1 ZINC001248682722 1059934516 /nfs/dbraw/zinc/93/45/16/1059934516.db2.gz CMDVONSIKRTNSZ-MRXNPFEDSA-N 1 2 311.466 4.374 20 0 DIADLO C/C(=C\c1ccc(C)cc1)C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001525571544 1059940770 /nfs/dbraw/zinc/94/07/70/1059940770.db2.gz IFKWGXIDHWUAGZ-FOWTUZBSSA-N 1 2 317.392 4.223 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1cccc2c1CCCC2 ZINC001525572756 1059943139 /nfs/dbraw/zinc/94/31/39/1059943139.db2.gz VEPXADRWBWQHNE-UHFFFAOYSA-N 1 2 317.392 4.003 20 0 DIADLO CCc1cccc(C)c1NC(=S)Nc1cccc2[nH+]c(C)cn21 ZINC001248711645 1059949673 /nfs/dbraw/zinc/94/96/73/1059949673.db2.gz BGEIXPUYEWNTIB-UHFFFAOYSA-N 1 2 324.453 4.322 20 0 DIADLO Cc1ccccc1C1(C(=O)Nc2ccc3[nH+]ccn3c2)CCCC1 ZINC001533646077 1059957982 /nfs/dbraw/zinc/95/79/82/1059957982.db2.gz VRZYTKDFIRXBEJ-UHFFFAOYSA-N 1 2 319.408 4.093 20 0 DIADLO CCc1cccc(C)c1NC(=S)Nc1ccc2[nH+]ccn2c1 ZINC001248727434 1059957966 /nfs/dbraw/zinc/95/79/66/1059957966.db2.gz ZZYOSCDEGGATQQ-UHFFFAOYSA-N 1 2 310.426 4.014 20 0 DIADLO CCn1c[nH+]c2c1CCN([C@H](C)c1ccc(Cl)cc1Cl)C2 ZINC001560169054 1059962820 /nfs/dbraw/zinc/96/28/20/1059962820.db2.gz XTPPACVWTKSJTE-LLVKDONJSA-N 1 2 324.255 4.329 20 0 DIADLO CC[N@H+](Cc1ccc(C)cc1)Cc1c(Cl)ccnc1OC ZINC001248795344 1059981086 /nfs/dbraw/zinc/98/10/86/1059981086.db2.gz AGYKSGNOIQSBJD-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CC[N@@H+](Cc1ccc(C)cc1)Cc1c(Cl)ccnc1OC ZINC001248795344 1059981111 /nfs/dbraw/zinc/98/11/11/1059981111.db2.gz AGYKSGNOIQSBJD-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1ncc(C(F)(F)F)cc1F ZINC001248790361 1059981279 /nfs/dbraw/zinc/98/12/79/1059981279.db2.gz NOXFPOVIJHXOKD-UHFFFAOYSA-N 1 2 318.339 4.323 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1ncc(C(F)(F)F)cc1F ZINC001248790361 1059981296 /nfs/dbraw/zinc/98/12/96/1059981296.db2.gz NOXFPOVIJHXOKD-UHFFFAOYSA-N 1 2 318.339 4.323 20 0 DIADLO CCCCCC[N@H+](Cc1ccco1)[C@H](C)C(=O)OC(C)(C)C ZINC001560208842 1059988104 /nfs/dbraw/zinc/98/81/04/1059988104.db2.gz NOSMBBIHLAVCNZ-OAHLLOKOSA-N 1 2 309.450 4.392 20 0 DIADLO CCCCCC[N@@H+](Cc1ccco1)[C@H](C)C(=O)OC(C)(C)C ZINC001560208842 1059988123 /nfs/dbraw/zinc/98/81/23/1059988123.db2.gz NOSMBBIHLAVCNZ-OAHLLOKOSA-N 1 2 309.450 4.392 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)c(F)c2)nc1 ZINC001560215638 1059992761 /nfs/dbraw/zinc/99/27/61/1059992761.db2.gz OYDXQBZXTFPPGD-KRWDZBQOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)c(F)c2)nc1 ZINC001560215638 1059992781 /nfs/dbraw/zinc/99/27/81/1059992781.db2.gz OYDXQBZXTFPPGD-KRWDZBQOSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@H]1Cc2cc(Cl)ccc2N1Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001560238927 1060003557 /nfs/dbraw/zinc/00/35/57/1060003557.db2.gz ALZWIRZYAPALQI-AWEZNQCLSA-N 1 2 323.827 4.477 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1nc2cccc(Br)c2o1 ZINC001248847953 1060022524 /nfs/dbraw/zinc/02/25/24/1060022524.db2.gz IHHLTONBZPWWQC-PHIMTYICSA-N 1 2 323.234 4.353 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1nc2cccc(Br)c2o1 ZINC001248847953 1060022547 /nfs/dbraw/zinc/02/25/47/1060022547.db2.gz IHHLTONBZPWWQC-PHIMTYICSA-N 1 2 323.234 4.353 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1nc2cccc(Br)c2o1 ZINC001248847954 1060023206 /nfs/dbraw/zinc/02/32/06/1060023206.db2.gz IHHLTONBZPWWQC-QWRGUYRKSA-N 1 2 323.234 4.353 20 0 DIADLO Cc1nc(C[N@@H+](CC(=O)c2ccccc2)C(C)C)ccc1Cl ZINC001248876679 1060030117 /nfs/dbraw/zinc/03/01/17/1060030117.db2.gz OLPDDRIQICXMFS-UHFFFAOYSA-N 1 2 316.832 4.137 20 0 DIADLO Cc1nc(C[N@H+](CC(=O)c2ccccc2)C(C)C)ccc1Cl ZINC001248876679 1060030139 /nfs/dbraw/zinc/03/01/39/1060030139.db2.gz OLPDDRIQICXMFS-UHFFFAOYSA-N 1 2 316.832 4.137 20 0 DIADLO CC[C@H](C)CC(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001525788609 1060032542 /nfs/dbraw/zinc/03/25/42/1060032542.db2.gz ZCOIPZYETKRFMP-AWEZNQCLSA-N 1 2 312.413 4.228 20 0 DIADLO CN(C)c1[nH+]ccc2cc(NC(=O)/C=C/c3ccsc3)ccc21 ZINC001533841412 1060039615 /nfs/dbraw/zinc/03/96/15/1060039615.db2.gz RELNDBNCEXPTDZ-ZZXKWVIFSA-N 1 2 323.421 4.014 20 0 DIADLO Cc1ccc(-n2cc(CNc3cccc[nH+]3)c(C(C)(C)C)n2)cc1 ZINC001560278546 1060056586 /nfs/dbraw/zinc/05/65/86/1060056586.db2.gz IQQYECXSRUUHJU-UHFFFAOYSA-N 1 2 320.440 4.485 20 0 DIADLO Cc1cc(CNC(=O)/C=C/c2ccc(C(C)(C)C)cc2)cc(C)[nH+]1 ZINC001525866017 1060058760 /nfs/dbraw/zinc/05/87/60/1060058760.db2.gz SPGHYPRXTMXDCZ-DHZHZOJOSA-N 1 2 322.452 4.326 20 0 DIADLO CNc1ccc(C)cc1C[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC001560302710 1060089137 /nfs/dbraw/zinc/08/91/37/1060089137.db2.gz IQVYJXVUPIKESW-GOSISDBHSA-N 1 2 323.465 4.372 20 0 DIADLO Cc1nc(C[NH2+]Cc2cc3cc(F)ccc3o2)nc2ccccc12 ZINC001560305928 1060091291 /nfs/dbraw/zinc/09/12/91/1060091291.db2.gz IRQOPUDZKGPFCS-UHFFFAOYSA-N 1 2 321.355 4.113 20 0 DIADLO CC(C)c1ccccc1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001533988417 1060098587 /nfs/dbraw/zinc/09/85/87/1060098587.db2.gz LXOYUTZHDMRXIW-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO [NH3+][C@H](c1nc(-c2ccc(Cl)cc2)no1)c1ccc(Cl)cc1 ZINC001248997384 1060103764 /nfs/dbraw/zinc/10/37/64/1060103764.db2.gz GOLZLUGKLNWOGK-ZDUSSCGKSA-N 1 2 320.179 4.092 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2cccnc2)c(Cl)nc1C ZINC001249018922 1060112495 /nfs/dbraw/zinc/11/24/95/1060112495.db2.gz CRNNRSYKDLIPTK-KRWDZBQOSA-N 1 2 315.848 4.474 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2cccnc2)c(Cl)nc1C ZINC001249018922 1060112501 /nfs/dbraw/zinc/11/25/01/1060112501.db2.gz CRNNRSYKDLIPTK-KRWDZBQOSA-N 1 2 315.848 4.474 20 0 DIADLO Cc1cc(C[N@@H+]2CCOC[C@@H]2C2CCCCC2)c(Cl)nc1C ZINC001249036091 1060126222 /nfs/dbraw/zinc/12/62/22/1060126222.db2.gz GYTNEXDKIMLTOE-QGZVFWFLSA-N 1 2 322.880 4.133 20 0 DIADLO Cc1cc(C[N@H+]2CCOC[C@@H]2C2CCCCC2)c(Cl)nc1C ZINC001249036091 1060126231 /nfs/dbraw/zinc/12/62/31/1060126231.db2.gz GYTNEXDKIMLTOE-QGZVFWFLSA-N 1 2 322.880 4.133 20 0 DIADLO FC(F)(F)Cc1ccc(NCc2cccc3[nH+]ccn32)cc1 ZINC001560349389 1060136447 /nfs/dbraw/zinc/13/64/47/1060136447.db2.gz ILMYDQNQNOVRCC-UHFFFAOYSA-N 1 2 305.303 4.051 20 0 DIADLO Cc1cc(C)cc(-c2noc([C@@H]([NH3+])c3cccc(Cl)c3)n2)c1 ZINC001249067572 1060142257 /nfs/dbraw/zinc/14/22/57/1060142257.db2.gz NVNGUBZABGQEIN-HNNXBMFYSA-N 1 2 313.788 4.055 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CCc3ccc(Cl)cc32)c(C)[nH+]1 ZINC001534146868 1060153954 /nfs/dbraw/zinc/15/39/54/1060153954.db2.gz UIXABVQJGSXEDX-MRXNPFEDSA-N 1 2 314.816 4.078 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc2nc(C(C)(C)C)sc2c1 ZINC001560375376 1060162230 /nfs/dbraw/zinc/16/22/30/1060162230.db2.gz ZUMSXMLJMRLAHS-UHFFFAOYSA-N 1 2 314.458 4.422 20 0 DIADLO CC(C)c1ccc(-c2noc([C@@H]3[NH2+]Cc4ccccc43)n2)cc1 ZINC001249133628 1060168870 /nfs/dbraw/zinc/16/88/70/1060168870.db2.gz UGIPCKBCELAMDA-QGZVFWFLSA-N 1 2 305.381 4.053 20 0 DIADLO Fc1ccc(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)cc1F ZINC001560383569 1060169639 /nfs/dbraw/zinc/16/96/39/1060169639.db2.gz HFXKHSUGRUIKLM-UHFFFAOYSA-N 1 2 319.742 4.416 20 0 DIADLO CCCCC(C)(C)c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001249155836 1060172092 /nfs/dbraw/zinc/17/20/92/1060172092.db2.gz OXNNRCQKCAVWNL-UHFFFAOYSA-N 1 2 310.401 4.390 20 0 DIADLO c1cn2c(cccc2CNc2cccc(OC3CCCC3)c2)[nH+]1 ZINC001560390570 1060176111 /nfs/dbraw/zinc/17/61/11/1060176111.db2.gz HHYITBCFEZKWKH-UHFFFAOYSA-N 1 2 307.397 4.268 20 0 DIADLO CCOc1cccc(F)c1CNc1cc(CSCC)cc[nH+]1 ZINC001560398381 1060183914 /nfs/dbraw/zinc/18/39/14/1060183914.db2.gz PLGJQROIGNAXRD-UHFFFAOYSA-N 1 2 320.433 4.485 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC[C@@H](c3ccccc3)C2)c(C)[nH+]1 ZINC001526337736 1060191784 /nfs/dbraw/zinc/19/17/84/1060191784.db2.gz FGODJWPINUPWII-GOSISDBHSA-N 1 2 308.425 4.027 20 0 DIADLO COc1cc[nH+]cc1NCc1ccc(Cl)c(C(F)(F)F)c1 ZINC001560407882 1060193057 /nfs/dbraw/zinc/19/30/57/1060193057.db2.gz LMISFPXIUFEFRG-UHFFFAOYSA-N 1 2 316.710 4.375 20 0 DIADLO Cc1c(F)cccc1-c1noc([C@@H]2CC[N@@H+]2Cc2ccccc2)n1 ZINC001249253375 1060204770 /nfs/dbraw/zinc/20/47/70/1060204770.db2.gz XKZPPDKQCUWHRF-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1c(F)cccc1-c1noc([C@@H]2CC[N@H+]2Cc2ccccc2)n1 ZINC001249253375 1060204785 /nfs/dbraw/zinc/20/47/85/1060204785.db2.gz XKZPPDKQCUWHRF-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO CCc1ccc2c(c1)[C@H]([NH2+]Cc1c(F)cccc1F)CCO2 ZINC001560433171 1060219662 /nfs/dbraw/zinc/21/96/62/1060219662.db2.gz BFOVTNSXTCHIKM-QGZVFWFLSA-N 1 2 303.352 4.141 20 0 DIADLO [NH3+][C@H](c1nc(-c2ccc(F)cc2)no1)c1ccc2ccccc2c1 ZINC001249324775 1060219796 /nfs/dbraw/zinc/21/97/96/1060219796.db2.gz GPVWKDRUNGTZSM-KRWDZBQOSA-N 1 2 319.339 4.077 20 0 DIADLO [NH3+][C@@H](c1nc(-c2cccc(F)c2)no1)c1ccc2ccccc2c1 ZINC001249325632 1060220639 /nfs/dbraw/zinc/22/06/39/1060220639.db2.gz RYXRBMAPUUIDRJ-QGZVFWFLSA-N 1 2 319.339 4.077 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1coc(-c3ccccc3)n1)CCO2 ZINC001560441187 1060229809 /nfs/dbraw/zinc/22/98/09/1060229809.db2.gz SVJAXKWAYKHPDG-KRWDZBQOSA-N 1 2 324.355 4.094 20 0 DIADLO C[C@H]1C[C@@H](CF)[N@H+](Cc2coc(-c3ccc(Cl)cc3)n2)C1 ZINC001249372578 1060232307 /nfs/dbraw/zinc/23/23/07/1060232307.db2.gz VOGWCABUNSOCIN-NHYWBVRUSA-N 1 2 308.784 4.175 20 0 DIADLO C[C@H]1C[C@@H](CF)[N@@H+](Cc2coc(-c3ccc(Cl)cc3)n2)C1 ZINC001249372578 1060232340 /nfs/dbraw/zinc/23/23/40/1060232340.db2.gz VOGWCABUNSOCIN-NHYWBVRUSA-N 1 2 308.784 4.175 20 0 DIADLO CC[C@H](C)c1nn(C)cc1C[N@@H+]1CCc2c(Cl)cccc2C1 ZINC001249408341 1060236981 /nfs/dbraw/zinc/23/69/81/1060236981.db2.gz BKOMZGZLVUQOED-ZDUSSCGKSA-N 1 2 317.864 4.145 20 0 DIADLO CC[C@H](C)c1nn(C)cc1C[N@H+]1CCc2c(Cl)cccc2C1 ZINC001249408341 1060237003 /nfs/dbraw/zinc/23/70/03/1060237003.db2.gz BKOMZGZLVUQOED-ZDUSSCGKSA-N 1 2 317.864 4.145 20 0 DIADLO CC[C@@H](c1ccccc1)[N@H+](C)Cc1nc2ccc(OC)cc2[nH]1 ZINC001249414519 1060239451 /nfs/dbraw/zinc/23/94/51/1060239451.db2.gz KXOWRTQVWXZTFA-SFHVURJKSA-N 1 2 309.413 4.155 20 0 DIADLO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1nc2ccc(OC)cc2[nH]1 ZINC001249414519 1060239472 /nfs/dbraw/zinc/23/94/72/1060239472.db2.gz KXOWRTQVWXZTFA-SFHVURJKSA-N 1 2 309.413 4.155 20 0 DIADLO Cc1ccc(C[NH+]2CCC(C)(F)CC2)c(F)c1Br ZINC001249459680 1060258088 /nfs/dbraw/zinc/25/80/88/1060258088.db2.gz FAMJIRBVLHRIGU-UHFFFAOYSA-N 1 2 318.205 4.221 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+]2Cc3ccccc3C[C@H]2C)cn1 ZINC001249515697 1060269392 /nfs/dbraw/zinc/26/93/92/1060269392.db2.gz MRESPRDMAMGUHU-CYBMUJFWSA-N 1 2 320.358 4.356 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+]2Cc3ccccc3C[C@H]2C)cn1 ZINC001249515697 1060269407 /nfs/dbraw/zinc/26/94/07/1060269407.db2.gz MRESPRDMAMGUHU-CYBMUJFWSA-N 1 2 320.358 4.356 20 0 DIADLO Cc1[nH+]c(NC/C=C/c2ccc(F)cc2)ccc1-c1cnn(C)c1 ZINC001560482634 1060272541 /nfs/dbraw/zinc/27/25/41/1060272541.db2.gz XKCTVGJLTAOUKC-ONEGZZNKSA-N 1 2 322.387 4.055 20 0 DIADLO Cc1cc(C[NH+]2CCC(Oc3ccc(Cl)cc3)CC2)ns1 ZINC001249571279 1060297694 /nfs/dbraw/zinc/29/76/94/1060297694.db2.gz OWNGANDAFUGERU-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1ccc(NC(=O)CCC2CCCCCC2)c(N(C)C)[nH+]1 ZINC001526674441 1060298100 /nfs/dbraw/zinc/29/81/00/1060298100.db2.gz JBCZWMTXDXYBGI-UHFFFAOYSA-N 1 2 303.450 4.145 20 0 DIADLO Fc1ccc(-c2cc(Nc3cc[nH+]cc3C(F)(F)F)on2)cc1 ZINC001249584770 1060301377 /nfs/dbraw/zinc/30/13/77/1060301377.db2.gz MUUPMFOKZFQCNR-UHFFFAOYSA-N 1 2 323.249 4.060 20 0 DIADLO F[C@@]1(c2ccccc2)C[C@@H]1[NH2+]Cc1ccccc1Br ZINC001560511981 1060310600 /nfs/dbraw/zinc/31/06/00/1060310600.db2.gz WVLHCEJDJKISMM-JKSUJKDBSA-N 1 2 320.205 4.176 20 0 DIADLO Nc1cc(F)cc(Nc2cc(Cl)c3[nH+]ccn3c2)c1Cl ZINC001249649565 1060334573 /nfs/dbraw/zinc/33/45/73/1060334573.db2.gz RHKIUIJZZAMJEN-UHFFFAOYSA-N 1 2 311.147 4.106 20 0 DIADLO COc1ccc(CNc2c[nH+]cc3c2CCCC3)cc1OC1CC1 ZINC001560532252 1060335340 /nfs/dbraw/zinc/33/53/40/1060335340.db2.gz XLPZWONBTPPGRH-UHFFFAOYSA-N 1 2 324.424 4.122 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc(-c3ccccc3)ccn2)c(C)[nH+]1 ZINC001526805997 1060342772 /nfs/dbraw/zinc/34/27/72/1060342772.db2.gz DBNOWQQYXPKLIU-UHFFFAOYSA-N 1 2 317.392 4.321 20 0 DIADLO CC[C@H]1C[C@H](CNc2ccc(Nc3ccccc3)c[nH+]2)CCO1 ZINC001560538784 1060344102 /nfs/dbraw/zinc/34/41/02/1060344102.db2.gz DSNVVPLWIQUFQR-QAPCUYQASA-N 1 2 311.429 4.442 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc3c(ccnc3Cl)o2)c(C)[nH+]1 ZINC001526806082 1060344315 /nfs/dbraw/zinc/34/43/15/1060344315.db2.gz HGXDJJCTPAISTP-UHFFFAOYSA-N 1 2 315.760 4.054 20 0 DIADLO CCOc1cccc(F)c1C[NH2+]Cc1ccc(C(C)(C)C)o1 ZINC001560560835 1060370675 /nfs/dbraw/zinc/37/06/75/1060370675.db2.gz TXLIRBNOJQBLJS-UHFFFAOYSA-N 1 2 305.393 4.405 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cnc2ccccc2c1 ZINC001560568180 1060379460 /nfs/dbraw/zinc/37/94/60/1060379460.db2.gz FQUSGJZBULTXSW-UHFFFAOYSA-N 1 2 309.438 4.495 20 0 DIADLO Cc1cc(Oc2ccc(Nc3cnc(N)c(F)c3)cc2)cc[nH+]1 ZINC001249767859 1060389211 /nfs/dbraw/zinc/38/92/11/1060389211.db2.gz IDSMQQOBRJKWCG-UHFFFAOYSA-N 1 2 310.332 4.042 20 0 DIADLO Fc1cccc(/C=C\CNc2[nH]c3ccc(Cl)cc3[nH+]2)c1 ZINC001560579258 1060395494 /nfs/dbraw/zinc/39/54/94/1060395494.db2.gz DMVLCSBZSKECTB-RQOWECAXSA-N 1 2 301.752 4.481 20 0 DIADLO CC(C)(/C=C/Cl)[NH2+]Cc1nc(Cl)ccc1Br ZINC001560595012 1060406941 /nfs/dbraw/zinc/40/69/41/1060406941.db2.gz IYJWQXFGWLMKFF-AATRIKPKSA-N 1 2 324.049 4.118 20 0 DIADLO Cc1cc(CNc2nn(C(C)C)cc2Cl)c2c([nH+]1)CCCC2 ZINC001560595374 1060407063 /nfs/dbraw/zinc/40/70/63/1060407063.db2.gz YWADCWCYODWWFD-UHFFFAOYSA-N 1 2 318.852 4.312 20 0 DIADLO Fc1ccc2[nH]c(Nc3ccc[nH+]c3N3CCCCC3)cc2c1 ZINC001249849502 1060420078 /nfs/dbraw/zinc/42/00/78/1060420078.db2.gz ABSPYABVRGTJHC-UHFFFAOYSA-N 1 2 310.376 4.436 20 0 DIADLO COc1cc(C)ccc1CNc1[nH+]c2cc(Cl)ccc2n1C ZINC001560621509 1060432063 /nfs/dbraw/zinc/43/20/63/1060432063.db2.gz OMABOJNAUSMVJY-UHFFFAOYSA-N 1 2 315.804 4.156 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCC1=Cc2ccccc2OC1 ZINC001560622916 1060434104 /nfs/dbraw/zinc/43/41/04/1060434104.db2.gz OSHSHILMHCXPAH-UHFFFAOYSA-N 1 2 323.371 4.083 20 0 DIADLO Cc1c(F)cc(Br)c(C[N@@H+]2CCC3(CC3)C2)c1F ZINC001249869401 1060434974 /nfs/dbraw/zinc/43/49/74/1060434974.db2.gz YQZRNKQJLSDMTP-UHFFFAOYSA-N 1 2 316.189 4.022 20 0 DIADLO Cc1c(F)cc(Br)c(C[N@H+]2CCC3(CC3)C2)c1F ZINC001249869401 1060434982 /nfs/dbraw/zinc/43/49/82/1060434982.db2.gz YQZRNKQJLSDMTP-UHFFFAOYSA-N 1 2 316.189 4.022 20 0 DIADLO Fc1ccc2cc(Nc3cc(OC(F)(F)F)cc[nH+]3)[nH]c2c1 ZINC001249875974 1060439872 /nfs/dbraw/zinc/43/98/72/1060439872.db2.gz QGTZENYCGWBTOG-UHFFFAOYSA-N 1 2 311.238 4.344 20 0 DIADLO Cc1c(Cl)cc(NC(=O)c2cccc3[nH+]ccn32)cc1Cl ZINC001527143256 1060447657 /nfs/dbraw/zinc/44/76/57/1060447657.db2.gz QURNZHDNQREFOO-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO O=C1CCCCc2ccc(Nc3ccc[nH+]c3N3CCCC3)cc21 ZINC001249890226 1060453047 /nfs/dbraw/zinc/45/30/47/1060453047.db2.gz FYVCXDOQGJBGDD-UHFFFAOYSA-N 1 2 321.424 4.335 20 0 DIADLO Oc1ccc(F)c(C[N@H+](CCc2cccc(F)c2)C2CC2)c1F ZINC001560639849 1060457203 /nfs/dbraw/zinc/45/72/03/1060457203.db2.gz DRKTXAVLSQSKPP-UHFFFAOYSA-N 1 2 321.342 4.017 20 0 DIADLO Oc1ccc(F)c(C[N@@H+](CCc2cccc(F)c2)C2CC2)c1F ZINC001560639849 1060457213 /nfs/dbraw/zinc/45/72/13/1060457213.db2.gz DRKTXAVLSQSKPP-UHFFFAOYSA-N 1 2 321.342 4.017 20 0 DIADLO O=C1CCCCc2ccc(Nc3ccc(N4CCCC4)[nH+]c3)cc21 ZINC001249893992 1060459152 /nfs/dbraw/zinc/45/91/52/1060459152.db2.gz ACWYHGFNNQTATF-UHFFFAOYSA-N 1 2 321.424 4.335 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC001249945894 1060498975 /nfs/dbraw/zinc/49/89/75/1060498975.db2.gz VZDJFEDRLQUELR-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC001249945894 1060498992 /nfs/dbraw/zinc/49/89/92/1060498992.db2.gz VZDJFEDRLQUELR-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+](Cc1cscc1Cl)CC2 ZINC001560651264 1060474715 /nfs/dbraw/zinc/47/47/15/1060474715.db2.gz MSNVQZSQOXWNHC-UHFFFAOYSA-N 1 2 307.846 4.359 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+](Cc1cscc1Cl)CC2 ZINC001560651264 1060474726 /nfs/dbraw/zinc/47/47/26/1060474726.db2.gz MSNVQZSQOXWNHC-UHFFFAOYSA-N 1 2 307.846 4.359 20 0 DIADLO CCn1ccc(C[N@H+](Cc2ccccc2)Cc2ccc(F)cc2)n1 ZINC001560654843 1060476635 /nfs/dbraw/zinc/47/66/35/1060476635.db2.gz DOPALZJBGTVZKG-UHFFFAOYSA-N 1 2 323.415 4.245 20 0 DIADLO CCn1ccc(C[N@@H+](Cc2ccccc2)Cc2ccc(F)cc2)n1 ZINC001560654843 1060476648 /nfs/dbraw/zinc/47/66/48/1060476648.db2.gz DOPALZJBGTVZKG-UHFFFAOYSA-N 1 2 323.415 4.245 20 0 DIADLO CCCO[C@@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001249942447 1060495967 /nfs/dbraw/zinc/49/59/67/1060495967.db2.gz WEHOLMZAULDKPF-GFCCVEGCSA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001249942447 1060495983 /nfs/dbraw/zinc/49/59/83/1060495983.db2.gz WEHOLMZAULDKPF-GFCCVEGCSA-N 1 2 306.208 4.133 20 0 DIADLO C[C@@H]1c2cc(F)cc(F)c2CC[N@H+]1Cc1cccn1C1CC1 ZINC001560670917 1060498968 /nfs/dbraw/zinc/49/89/68/1060498968.db2.gz QEXVXXGMKNVJGG-GFCCVEGCSA-N 1 2 302.368 4.221 20 0 DIADLO C[C@@H]1c2cc(F)cc(F)c2CC[N@@H+]1Cc1cccn1C1CC1 ZINC001560670917 1060498986 /nfs/dbraw/zinc/49/89/86/1060498986.db2.gz QEXVXXGMKNVJGG-GFCCVEGCSA-N 1 2 302.368 4.221 20 0 DIADLO C[C@H]1c2cc(F)cc(F)c2CC[N@H+]1Cc1cccn1C1CC1 ZINC001560670918 1060503262 /nfs/dbraw/zinc/50/32/62/1060503262.db2.gz QEXVXXGMKNVJGG-LBPRGKRZSA-N 1 2 302.368 4.221 20 0 DIADLO C[C@H]1c2cc(F)cc(F)c2CC[N@@H+]1Cc1cccn1C1CC1 ZINC001560670918 1060503288 /nfs/dbraw/zinc/50/32/88/1060503288.db2.gz QEXVXXGMKNVJGG-LBPRGKRZSA-N 1 2 302.368 4.221 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cc(O)c(F)c(F)c3F)ccc12 ZINC001249965153 1060510604 /nfs/dbraw/zinc/51/06/04/1060510604.db2.gz XTKBRAKFSVFABI-UHFFFAOYSA-N 1 2 304.271 4.410 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1cc2c(cc[nH]c2=O)o1 ZINC001560681116 1060523733 /nfs/dbraw/zinc/52/37/33/1060523733.db2.gz FPGPRBKUJDWOHE-JTQLQIEISA-N 1 2 318.323 4.005 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cc2c(cc[nH]c2=O)o1 ZINC001560681116 1060523756 /nfs/dbraw/zinc/52/37/56/1060523756.db2.gz FPGPRBKUJDWOHE-JTQLQIEISA-N 1 2 318.323 4.005 20 0 DIADLO FC(F)(F)c1cccc(Cc2ccc[nH+]c2N2CCCC2)c1 ZINC001249993748 1060524816 /nfs/dbraw/zinc/52/48/16/1060524816.db2.gz CAFNRONZEJXBLJ-UHFFFAOYSA-N 1 2 306.331 4.291 20 0 DIADLO FC(F)(F)c1ccc(Cc2ccc[nH+]c2N2CCCC2)cc1 ZINC001249995061 1060527414 /nfs/dbraw/zinc/52/74/14/1060527414.db2.gz FCJGIAVNCVIJJO-UHFFFAOYSA-N 1 2 306.331 4.291 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)ccn1 ZINC001250009965 1060536694 /nfs/dbraw/zinc/53/66/94/1060536694.db2.gz RCHVNCBMBJJEDR-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)ccn1 ZINC001250009965 1060536714 /nfs/dbraw/zinc/53/67/14/1060536714.db2.gz RCHVNCBMBJJEDR-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1[nH+]ccn1-c1ccc(Nc2cc(Cl)c(O)cc2F)cc1 ZINC001250022863 1060549172 /nfs/dbraw/zinc/54/91/72/1060549172.db2.gz WZTXDWZIMSNFGN-UHFFFAOYSA-N 1 2 317.751 4.422 20 0 DIADLO CC1(c2ccccc2)CC(Nc2cccc(-n3cc[nH+]c3)c2)C1 ZINC001560703530 1060556734 /nfs/dbraw/zinc/55/67/34/1060556734.db2.gz IPPROEAKVPTPRH-UHFFFAOYSA-N 1 2 303.409 4.405 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)c(Cl)c1Cl)C[C@H]1CCCCO1 ZINC001250031463 1060559692 /nfs/dbraw/zinc/55/96/92/1060559692.db2.gz MQNCLKJBRNXIAW-SNVBAGLBSA-N 1 2 323.651 4.043 20 0 DIADLO C[N@H+](Cc1cnc(Cl)c(Cl)c1Cl)C[C@H]1CCCCO1 ZINC001250031463 1060559708 /nfs/dbraw/zinc/55/97/08/1060559708.db2.gz MQNCLKJBRNXIAW-SNVBAGLBSA-N 1 2 323.651 4.043 20 0 DIADLO COc1ccc([C@H](C)[C@H](C)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC001560703969 1060561945 /nfs/dbraw/zinc/56/19/45/1060561945.db2.gz UCHUGCCNTMQHIJ-CVEARBPZSA-N 1 2 321.424 4.485 20 0 DIADLO CC1=CC[C@H]([NH2+][C@H](Cc2ccccc2)C(=O)OC(C)(C)C)CC1 ZINC001560707897 1060563604 /nfs/dbraw/zinc/56/36/04/1060563604.db2.gz XLKGGOFNSGPXMX-ZWKOTPCHSA-N 1 2 315.457 4.028 20 0 DIADLO C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC001560712493 1060571363 /nfs/dbraw/zinc/57/13/63/1060571363.db2.gz MHHPCJFDJDWZNQ-CABCVRRESA-N 1 2 305.462 4.063 20 0 DIADLO CCOc1cc(F)c(Nc2cccc3[nH+]ccn32)cc1Cl ZINC001250063368 1060579070 /nfs/dbraw/zinc/57/90/70/1060579070.db2.gz QCSPJHFBGMQLCD-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(Cl)c(OC(C)C)cc1F ZINC001250069110 1060583439 /nfs/dbraw/zinc/58/34/39/1060583439.db2.gz CPXOTVYSLNKTGX-UHFFFAOYSA-N 1 2 310.756 4.414 20 0 DIADLO Cc1ccc(OCC[N@@H+](C)Cc2nc(C(C)(C)C)cs2)cc1 ZINC001560721560 1060586647 /nfs/dbraw/zinc/58/66/47/1060586647.db2.gz PPHZTVGNSMIRHX-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO Cc1ccc(OCC[N@H+](C)Cc2nc(C(C)(C)C)cs2)cc1 ZINC001560721560 1060586662 /nfs/dbraw/zinc/58/66/62/1060586662.db2.gz PPHZTVGNSMIRHX-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2sc(N(C)C)nc2Cl)cc1 ZINC001560724912 1060590951 /nfs/dbraw/zinc/59/09/51/1060590951.db2.gz BFOUSQFUROQUPF-UHFFFAOYSA-N 1 2 323.893 4.057 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2sc(N(C)C)nc2Cl)cc1 ZINC001560724912 1060590970 /nfs/dbraw/zinc/59/09/70/1060590970.db2.gz BFOUSQFUROQUPF-UHFFFAOYSA-N 1 2 323.893 4.057 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cc(O)cc(Cl)c2)o1 ZINC001560732891 1060601214 /nfs/dbraw/zinc/60/12/14/1060601214.db2.gz GIGDPYGOZFKIHE-MRXNPFEDSA-N 1 2 321.804 4.122 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2cc(O)cc(Cl)c2)o1 ZINC001560732891 1060601222 /nfs/dbraw/zinc/60/12/22/1060601222.db2.gz GIGDPYGOZFKIHE-MRXNPFEDSA-N 1 2 321.804 4.122 20 0 DIADLO C[C@@H](CC[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1)CC(C)(C)C ZINC001560759240 1060624500 /nfs/dbraw/zinc/62/45/00/1060624500.db2.gz WHPHIGZXXUTQFX-GOEBONIOSA-N 1 2 306.498 4.478 20 0 DIADLO CSc1ccc(F)c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001250118989 1060625981 /nfs/dbraw/zinc/62/59/81/1060625981.db2.gz KNBGPXYZBMQJSX-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO C[C@@H]([NH2+][C@H](C)C1(c2ccccc2)CCCC1)C(=O)OC(C)(C)C ZINC001560763865 1060630722 /nfs/dbraw/zinc/63/07/22/1060630722.db2.gz PMFDQVSHFSIURW-HZPDHXFCSA-N 1 2 317.473 4.207 20 0 DIADLO CSc1ccc(F)c(C)c1Nc1ccc2c(c1)[nH+]cn2C ZINC001250133553 1060634925 /nfs/dbraw/zinc/63/49/25/1060634925.db2.gz WRCJIVPYBSHLJZ-UHFFFAOYSA-N 1 2 301.390 4.486 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@@H+]2CCCC(F)(F)CC2)c(F)c1 ZINC001250140969 1060642314 /nfs/dbraw/zinc/64/23/14/1060642314.db2.gz DWFMRTMFTBUXOT-UHFFFAOYSA-N 1 2 319.342 4.373 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@H+]2CCCC(F)(F)CC2)c(F)c1 ZINC001250140969 1060642331 /nfs/dbraw/zinc/64/23/31/1060642331.db2.gz DWFMRTMFTBUXOT-UHFFFAOYSA-N 1 2 319.342 4.373 20 0 DIADLO Oc1cc(Cl)cc(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)c1 ZINC001560785405 1060647193 /nfs/dbraw/zinc/64/71/93/1060647193.db2.gz HOTUQFUJQKUCJS-QGZVFWFLSA-N 1 2 305.780 4.116 20 0 DIADLO Oc1cc(Cl)cc(C[N@H+]2CC[C@](F)(c3ccccc3)C2)c1 ZINC001560785405 1060647204 /nfs/dbraw/zinc/64/72/04/1060647204.db2.gz HOTUQFUJQKUCJS-QGZVFWFLSA-N 1 2 305.780 4.116 20 0 DIADLO CCCCCC[C@H](C)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)[nH+]c1 ZINC001560798368 1060658167 /nfs/dbraw/zinc/65/81/67/1060658167.db2.gz FOBFBGLKYFPAJM-GVDBMIGSSA-N 1 2 319.493 4.466 20 0 DIADLO CCc1cc(Nc2cccc(Cn3cc[nH+]c3)c2)ccc1OC ZINC001250175852 1060660270 /nfs/dbraw/zinc/66/02/70/1060660270.db2.gz JVBVBIDAVYSRGV-UHFFFAOYSA-N 1 2 307.397 4.246 20 0 DIADLO Clc1ncc(Nc2cccc3[nH+]ccn32)c(Cl)c1Cl ZINC001250195342 1060672969 /nfs/dbraw/zinc/67/29/69/1060672969.db2.gz MAUVLZAWHADJDT-UHFFFAOYSA-N 1 2 313.575 4.433 20 0 DIADLO FC(F)(F)Oc1ccc(Cc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC001250198998 1060677697 /nfs/dbraw/zinc/67/76/97/1060677697.db2.gz AJFSYQGGEYWMNN-UHFFFAOYSA-N 1 2 322.330 4.171 20 0 DIADLO CO[C@@H](C[NH2+]CC(F)(F)c1ccc(Cl)cc1)CC(C)C ZINC001560820607 1060679085 /nfs/dbraw/zinc/67/90/85/1060679085.db2.gz DQKIEWYZEHFWLS-CQSZACIVSA-N 1 2 305.796 4.083 20 0 DIADLO Cc1ccc(CC(=O)c2ccc(OC(F)(F)F)cc2)c(C)[nH+]1 ZINC001250201867 1060681564 /nfs/dbraw/zinc/68/15/64/1060681564.db2.gz OWWRXVCTRDTSFV-UHFFFAOYSA-N 1 2 309.287 4.022 20 0 DIADLO Cc1nn(C)c(C[N@@H+]([C@H](C)c2ccccc2)C2CC2)c1Cl ZINC001560823940 1060682502 /nfs/dbraw/zinc/68/25/02/1060682502.db2.gz ULKCHLWRBKNGEJ-CYBMUJFWSA-N 1 2 303.837 4.108 20 0 DIADLO Cc1nn(C)c(C[N@H+]([C@H](C)c2ccccc2)C2CC2)c1Cl ZINC001560823940 1060682513 /nfs/dbraw/zinc/68/25/13/1060682513.db2.gz ULKCHLWRBKNGEJ-CYBMUJFWSA-N 1 2 303.837 4.108 20 0 DIADLO Fc1ccc([C@H]2COCC[N@@H+]2Cc2cccc3ccoc32)cc1 ZINC001560836914 1060693331 /nfs/dbraw/zinc/69/33/31/1060693331.db2.gz YLDPXVDWDALYGW-GOSISDBHSA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccc([C@H]2COCC[N@H+]2Cc2cccc3ccoc32)cc1 ZINC001560836914 1060693337 /nfs/dbraw/zinc/69/33/37/1060693337.db2.gz YLDPXVDWDALYGW-GOSISDBHSA-N 1 2 311.356 4.145 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cc(F)c(OCC)c(Cl)c1 ZINC001250219089 1060698942 /nfs/dbraw/zinc/69/89/42/1060698942.db2.gz AKOVLRPZSZQSPT-UHFFFAOYSA-N 1 2 310.756 4.415 20 0 DIADLO C[N@H+](Cc1ccc2scnc2c1)Cc1c(F)cccc1F ZINC001560847908 1060705226 /nfs/dbraw/zinc/70/52/26/1060705226.db2.gz YORHRQISRVZGQG-UHFFFAOYSA-N 1 2 304.365 4.207 20 0 DIADLO C[N@@H+](Cc1ccc2scnc2c1)Cc1c(F)cccc1F ZINC001560847908 1060705241 /nfs/dbraw/zinc/70/52/41/1060705241.db2.gz YORHRQISRVZGQG-UHFFFAOYSA-N 1 2 304.365 4.207 20 0 DIADLO CC(C)[N@H+](Cc1cnc(-c2ccc(Cl)cc2)s1)C1COC1 ZINC001560849300 1060705668 /nfs/dbraw/zinc/70/56/68/1060705668.db2.gz SFBWCDMNBZRQBA-UHFFFAOYSA-N 1 2 322.861 4.073 20 0 DIADLO CC(C)[N@@H+](Cc1cnc(-c2ccc(Cl)cc2)s1)C1COC1 ZINC001560849300 1060705680 /nfs/dbraw/zinc/70/56/80/1060705680.db2.gz SFBWCDMNBZRQBA-UHFFFAOYSA-N 1 2 322.861 4.073 20 0 DIADLO CCOc1nccc(Nc2ccc(-n3cc[nH+]c3)cc2)c1Cl ZINC001250247510 1060728232 /nfs/dbraw/zinc/72/82/32/1060728232.db2.gz COPYAWUZSJAJOC-UHFFFAOYSA-N 1 2 314.776 4.063 20 0 DIADLO Clc1nc2cc(Cl)ccn2c1C[NH+]1CC2(C1)CCCCC2 ZINC001560875020 1060734517 /nfs/dbraw/zinc/73/45/17/1060734517.db2.gz XKQZJDUECLEAIE-UHFFFAOYSA-N 1 2 324.255 4.407 20 0 DIADLO FC(F)Oc1cccc(Cc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001250268320 1060745129 /nfs/dbraw/zinc/74/51/29/1060745129.db2.gz AYGFJHUSIXRRKR-UHFFFAOYSA-N 1 2 300.308 4.269 20 0 DIADLO Fc1ccccc1OCCCc1ccc(N2CCCCC2)[nH+]c1 ZINC001250275289 1060749953 /nfs/dbraw/zinc/74/99/53/1060749953.db2.gz LAXXUQQEZOEAHR-UHFFFAOYSA-N 1 2 314.404 4.223 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@H+]1C[C@@H](CC)O[C@@H](CC)C1 ZINC001560894315 1060757939 /nfs/dbraw/zinc/75/79/39/1060757939.db2.gz IDRWGMYMDCDLBM-IYBDPMFKSA-N 1 2 311.853 4.128 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@@H+]1C[C@@H](CC)O[C@@H](CC)C1 ZINC001560894315 1060757956 /nfs/dbraw/zinc/75/79/56/1060757956.db2.gz IDRWGMYMDCDLBM-IYBDPMFKSA-N 1 2 311.853 4.128 20 0 DIADLO CCOc1cc(C[N@H+](Cc2ccccc2)C2CC2)c(Cl)cn1 ZINC001250318476 1060777447 /nfs/dbraw/zinc/77/74/47/1060777447.db2.gz IAXWYIYWAXHQAE-UHFFFAOYSA-N 1 2 316.832 4.298 20 0 DIADLO CCOc1cc(C[N@@H+](Cc2ccccc2)C2CC2)c(Cl)cn1 ZINC001250318476 1060777457 /nfs/dbraw/zinc/77/74/57/1060777457.db2.gz IAXWYIYWAXHQAE-UHFFFAOYSA-N 1 2 316.832 4.298 20 0 DIADLO CCOc1nccc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c1Cl ZINC001250361780 1060789110 /nfs/dbraw/zinc/78/91/10/1060789110.db2.gz YKCWARLOFCDGSC-ZDUSSCGKSA-N 1 2 316.832 4.253 20 0 DIADLO CCOc1nccc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c1Cl ZINC001250361780 1060789125 /nfs/dbraw/zinc/78/91/25/1060789125.db2.gz YKCWARLOFCDGSC-ZDUSSCGKSA-N 1 2 316.832 4.253 20 0 DIADLO CCOc1nccc(C[N@H+](C)Cc2ccc(C)cc2)c1Cl ZINC001250378414 1060792519 /nfs/dbraw/zinc/79/25/19/1060792519.db2.gz RUXBVOZZRYDKBB-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCOc1nccc(C[N@@H+](C)Cc2ccc(C)cc2)c1Cl ZINC001250378414 1060792530 /nfs/dbraw/zinc/79/25/30/1060792530.db2.gz RUXBVOZZRYDKBB-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCCOc1cc2[nH]c(C3CCOCC3)[nH+]c2cc1OCCC ZINC001250432936 1060798964 /nfs/dbraw/zinc/79/89/64/1060798964.db2.gz DRROHTJFSXQPDP-UHFFFAOYSA-N 1 2 318.417 4.035 20 0 DIADLO FC(F)(F)c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)nc1 ZINC001250448992 1060808778 /nfs/dbraw/zinc/80/87/78/1060808778.db2.gz KEQFDBJSUNDNTJ-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO CCC1CC[NH+](Cc2cncc(Br)c2Cl)CC1 ZINC001250461828 1060819784 /nfs/dbraw/zinc/81/97/84/1060819784.db2.gz XEGHOUMDOUUHEC-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO C[N@H+](Cc1ccns1)Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC001560970951 1060834054 /nfs/dbraw/zinc/83/40/54/1060834054.db2.gz ODBGXJJRPYSPMI-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1ccns1)Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC001560970951 1060834062 /nfs/dbraw/zinc/83/40/62/1060834062.db2.gz ODBGXJJRPYSPMI-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO Cc1ccc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)cc1C ZINC001250488896 1060842775 /nfs/dbraw/zinc/84/27/75/1060842775.db2.gz QSKATEPGGJFOCT-UHFFFAOYSA-N 1 2 306.344 4.172 20 0 DIADLO CCSCc1ccc[nH+]c1N[C@@H]1C[C@H](OC(C)C)C1(C)C ZINC001560982086 1060844827 /nfs/dbraw/zinc/84/48/27/1060844827.db2.gz POKSMSNRRDPLBB-CABCVRRESA-N 1 2 308.491 4.339 20 0 DIADLO FC[C@@H]1CC[N@H+](Cc2c(F)c(Cl)ccc2Br)C1 ZINC001560984862 1060849035 /nfs/dbraw/zinc/84/90/35/1060849035.db2.gz KDIXJDGOXTTZKL-QMMMGPOBSA-N 1 2 324.596 4.033 20 0 DIADLO FC[C@@H]1CC[N@@H+](Cc2c(F)c(Cl)ccc2Br)C1 ZINC001560984862 1060849044 /nfs/dbraw/zinc/84/90/44/1060849044.db2.gz KDIXJDGOXTTZKL-QMMMGPOBSA-N 1 2 324.596 4.033 20 0 DIADLO Fc1cc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)cc(F)c1F ZINC001250495630 1060851360 /nfs/dbraw/zinc/85/13/60/1060851360.db2.gz QTOMXMJWIRFDIM-UHFFFAOYSA-N 1 2 317.314 4.247 20 0 DIADLO C/C(=C\c1ccccc1C(F)(F)F)C[NH+]1CC(OC(C)C)C1 ZINC001560992559 1060853120 /nfs/dbraw/zinc/85/31/20/1060853120.db2.gz KGSDDMKRKKDJAQ-MDWZMJQESA-N 1 2 313.363 4.218 20 0 DIADLO CC[C@@H]1C[C@H]([NH2+][C@@H](c2cccc(Cl)c2)C(F)F)CCO1 ZINC001561006868 1060866129 /nfs/dbraw/zinc/86/61/29/1060866129.db2.gz DKVQKBAPGLUGLP-MCIONIFRSA-N 1 2 303.780 4.193 20 0 DIADLO Clc1ccc([C@@H]2C[C@H]2c2[nH]c3cc4c(cc3[nH+]2)OCO4)cc1 ZINC001250536890 1060881474 /nfs/dbraw/zinc/88/14/74/1060881474.db2.gz DUGOCFXTXJKKOT-NWDGAFQWSA-N 1 2 312.756 4.216 20 0 DIADLO CCOc1cc2[nH]c(Cc3ccccc3F)[nH+]c2cc1OCC ZINC001250553144 1060890136 /nfs/dbraw/zinc/89/01/36/1060890136.db2.gz RUBAYCKSPVVOOK-UHFFFAOYSA-N 1 2 314.360 4.090 20 0 DIADLO Cc1cccc(-c2cccc(Cl)c2C[NH+]2CCOCC2)c1 ZINC001250555288 1060893279 /nfs/dbraw/zinc/89/32/79/1060893279.db2.gz WZWFIMPUDABDQV-UHFFFAOYSA-N 1 2 301.817 4.148 20 0 DIADLO COc1ccc2c(c1)[nH+]c(C[C@H](C)CCCC(C)(C)OC)n2C ZINC001250568427 1060903693 /nfs/dbraw/zinc/90/36/93/1060903693.db2.gz XFOXWGANSCGXJT-CQSZACIVSA-N 1 2 318.461 4.356 20 0 DIADLO COc1cc2[nH+]c(C[C@@H](C)CCCC(C)(C)OC)[nH]c2cc1F ZINC001250567572 1060904750 /nfs/dbraw/zinc/90/47/50/1060904750.db2.gz LRRATPZNDUMMGJ-LBPRGKRZSA-N 1 2 322.424 4.485 20 0 DIADLO COc1cc2[nH]c(C[C@@H](C)CCCC(C)(C)OC)[nH+]c2cc1F ZINC001250567572 1060904768 /nfs/dbraw/zinc/90/47/68/1060904768.db2.gz LRRATPZNDUMMGJ-LBPRGKRZSA-N 1 2 322.424 4.485 20 0 DIADLO COC(C)(C)CCC[C@@H](C)Cc1[nH]c2cc3c(cc2[nH+]1)OCC3 ZINC001250567048 1060904976 /nfs/dbraw/zinc/90/49/76/1060904976.db2.gz FUYMUMGXXSGFBW-CYBMUJFWSA-N 1 2 316.445 4.272 20 0 DIADLO Cc1c2[nH+]c(C3CCN(c4ccccc4)CC3)[nH]c2ccc1F ZINC001250584691 1060919608 /nfs/dbraw/zinc/91/96/08/1060919608.db2.gz NVGIENMVIFFUAD-UHFFFAOYSA-N 1 2 309.388 4.394 20 0 DIADLO CCCCn1c(CCc2cccnc2)[nH+]c2ccc(F)c(F)c21 ZINC001250599870 1060932439 /nfs/dbraw/zinc/93/24/39/1060932439.db2.gz SFPAPXINHASVEX-UHFFFAOYSA-N 1 2 315.367 4.295 20 0 DIADLO CCOc1cc2[nH]c(C3C[C@@H](C)O[C@H](C)C3)[nH+]c2cc1OCC ZINC001250612472 1060942829 /nfs/dbraw/zinc/94/28/29/1060942829.db2.gz PPIQEJNDKYMHEF-VXGBXAGGSA-N 1 2 318.417 4.031 20 0 DIADLO Cc1ccc(N2CC[N@H+](CC=C(Cl)Cl)[C@@H](C)C2)cc1C ZINC001473203998 1060968465 /nfs/dbraw/zinc/96/84/65/1060968465.db2.gz KKXYPUMPNVBWCE-AWEZNQCLSA-N 1 2 313.272 4.133 20 0 DIADLO Cc1ccc(N2CC[N@@H+](CC=C(Cl)Cl)[C@@H](C)C2)cc1C ZINC001473203998 1060968489 /nfs/dbraw/zinc/96/84/89/1060968489.db2.gz KKXYPUMPNVBWCE-AWEZNQCLSA-N 1 2 313.272 4.133 20 0 DIADLO COc1cccc(-c2nc(C[N@@H+]3CC[C@H]3c3ccccc3)co2)c1 ZINC001473206061 1060969004 /nfs/dbraw/zinc/96/90/04/1060969004.db2.gz DRMCSTQDPHRWGC-IBGZPJMESA-N 1 2 320.392 4.297 20 0 DIADLO COc1cccc(-c2nc(C[N@H+]3CC[C@H]3c3ccccc3)co2)c1 ZINC001473206061 1060969019 /nfs/dbraw/zinc/96/90/19/1060969019.db2.gz DRMCSTQDPHRWGC-IBGZPJMESA-N 1 2 320.392 4.297 20 0 DIADLO Oc1cc(C[N@@H+]2CC[C@H]2c2ccccc2)cc(C(F)(F)F)c1 ZINC001473205858 1060970414 /nfs/dbraw/zinc/97/04/14/1060970414.db2.gz BZUCNCYXONWUQE-INIZCTEOSA-N 1 2 307.315 4.358 20 0 DIADLO Oc1cc(C[N@H+]2CC[C@H]2c2ccccc2)cc(C(F)(F)F)c1 ZINC001473205858 1060970432 /nfs/dbraw/zinc/97/04/32/1060970432.db2.gz BZUCNCYXONWUQE-INIZCTEOSA-N 1 2 307.315 4.358 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[N@@H+]1CCc2c(F)ccc(F)c2C1 ZINC001473210052 1060980326 /nfs/dbraw/zinc/98/03/26/1060980326.db2.gz BWEVKQXZVGMBTG-SFHVURJKSA-N 1 2 303.327 4.150 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[N@H+]1CCc2c(F)ccc(F)c2C1 ZINC001473210052 1060980351 /nfs/dbraw/zinc/98/03/51/1060980351.db2.gz BWEVKQXZVGMBTG-SFHVURJKSA-N 1 2 303.327 4.150 20 0 DIADLO CC(C)(C)c1ccc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)[nH]1 ZINC001250651119 1060991075 /nfs/dbraw/zinc/99/10/75/1060991075.db2.gz LTBWCJXEMPILHU-UHFFFAOYSA-N 1 2 323.375 4.180 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1CCC[N@@H+]1C/C=C\c1ccc(Cl)cc1 ZINC001473219233 1060995796 /nfs/dbraw/zinc/99/57/96/1060995796.db2.gz CVAAHPMSPXHKIN-LEXSJLIMSA-N 1 2 321.848 4.159 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1CCC[N@H+]1C/C=C\c1ccc(Cl)cc1 ZINC001473219233 1060995820 /nfs/dbraw/zinc/99/58/20/1060995820.db2.gz CVAAHPMSPXHKIN-LEXSJLIMSA-N 1 2 321.848 4.159 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC(CC)(CC)C1 ZINC001473222492 1061003007 /nfs/dbraw/zinc/00/30/07/1061003007.db2.gz JMDJSERCWHBQGV-MRXNPFEDSA-N 1 2 323.864 4.456 20 0 DIADLO CCOC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CCC(CC)(CC)C1 ZINC001473222492 1061003015 /nfs/dbraw/zinc/00/30/15/1061003015.db2.gz JMDJSERCWHBQGV-MRXNPFEDSA-N 1 2 323.864 4.456 20 0 DIADLO Cc1cccc(C)c1-c1nc2cc(-n3cc[nH+]c3)c(F)cc2[nH]1 ZINC001250673547 1061007327 /nfs/dbraw/zinc/00/73/27/1061007327.db2.gz BGQNNLHREFUDQL-UHFFFAOYSA-N 1 2 306.344 4.172 20 0 DIADLO C/C=C/C[C@H]([NH2+][C@H](C)[C@H](C)c1ccc(Cl)cc1)C(=O)OCC ZINC001462194083 1061014353 /nfs/dbraw/zinc/01/43/53/1061014353.db2.gz WRNNYXPCVPTAOA-CUXVGACOSA-N 1 2 323.864 4.320 20 0 DIADLO CCCOc1cccc(C[N@@H+]2CCc3ccc(F)c(F)c3C2)c1 ZINC001473278079 1061047806 /nfs/dbraw/zinc/04/78/06/1061047806.db2.gz CBRLFNPJCGQSEQ-UHFFFAOYSA-N 1 2 317.379 4.312 20 0 DIADLO CCCOc1cccc(C[N@H+]2CCc3ccc(F)c(F)c3C2)c1 ZINC001473278079 1061047820 /nfs/dbraw/zinc/04/78/20/1061047820.db2.gz CBRLFNPJCGQSEQ-UHFFFAOYSA-N 1 2 317.379 4.312 20 0 DIADLO C[N@H+](CC=C(Cl)Cl)Cc1cccc(OC(F)(F)F)c1 ZINC001473274114 1061049981 /nfs/dbraw/zinc/04/99/81/1061049981.db2.gz XJZOSQPTQZVAOU-UHFFFAOYSA-N 1 2 314.134 4.336 20 0 DIADLO C[N@@H+](CC=C(Cl)Cl)Cc1cccc(OC(F)(F)F)c1 ZINC001473274114 1061049991 /nfs/dbraw/zinc/04/99/91/1061049991.db2.gz XJZOSQPTQZVAOU-UHFFFAOYSA-N 1 2 314.134 4.336 20 0 DIADLO C[C@@H](CNc1[nH+]cccc1CNC(=O)OC(C)(C)C)C(C)(C)C ZINC001462254074 1061056590 /nfs/dbraw/zinc/05/65/90/1061056590.db2.gz QJUBUQPOTOLBKQ-ZDUSSCGKSA-N 1 2 321.465 4.200 20 0 DIADLO CCCn1c2cc(F)ccc2nc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001250772190 1061062647 /nfs/dbraw/zinc/06/26/47/1061062647.db2.gz QSNAKJJWUXYCJG-UHFFFAOYSA-N 1 2 320.371 4.438 20 0 DIADLO Clc1cccc([C@@H]([NH2+]Cc2ccns2)c2ccccn2)c1 ZINC001473295146 1061063330 /nfs/dbraw/zinc/06/33/30/1061063330.db2.gz CFYAUCCWRATLOL-MRXNPFEDSA-N 1 2 315.829 4.071 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@H+]([C@H]1CCc3c1cccc3F)CC2 ZINC001473295974 1061063677 /nfs/dbraw/zinc/06/36/77/1061063677.db2.gz HCSIGHIDGXHUNI-SFHVURJKSA-N 1 2 303.327 4.150 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@@H+]([C@H]1CCc3c1cccc3F)CC2 ZINC001473295974 1061063687 /nfs/dbraw/zinc/06/36/87/1061063687.db2.gz HCSIGHIDGXHUNI-SFHVURJKSA-N 1 2 303.327 4.150 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(C3CC3)c2)C[C@@H](C(F)(F)F)O1 ZINC001462277529 1061070916 /nfs/dbraw/zinc/07/09/16/1061070916.db2.gz ZETUUTWNRXJUFH-HNNXBMFYSA-N 1 2 313.363 4.106 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(C3CC3)c2)C[C@@H](C(F)(F)F)O1 ZINC001462277529 1061070923 /nfs/dbraw/zinc/07/09/23/1061070923.db2.gz ZETUUTWNRXJUFH-HNNXBMFYSA-N 1 2 313.363 4.106 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(C(F)(F)F)ccc2Br)[C@@H]1C ZINC001462280041 1061073651 /nfs/dbraw/zinc/07/36/51/1061073651.db2.gz DOMDGDVERYYDRR-RKDXNWHRSA-N 1 2 322.168 4.308 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(C(F)(F)F)ccc2Br)[C@@H]1C ZINC001462280041 1061073656 /nfs/dbraw/zinc/07/36/56/1061073656.db2.gz DOMDGDVERYYDRR-RKDXNWHRSA-N 1 2 322.168 4.308 20 0 DIADLO C[C@@H]([NH2+]CC(=O)c1ccccc1F)c1cc(Cl)ccc1F ZINC001473310199 1061074297 /nfs/dbraw/zinc/07/42/97/1061074297.db2.gz YCDOPZYIELOWJX-SNVBAGLBSA-N 1 2 309.743 4.152 20 0 DIADLO Cc1noc2ncc(C[N@@H+]3CC(C)(C)[C@H]3c3cccs3)cc12 ZINC001462302828 1061091656 /nfs/dbraw/zinc/09/16/56/1061091656.db2.gz ABBHVUNLMMZCRA-OAHLLOKOSA-N 1 2 313.426 4.176 20 0 DIADLO Cc1noc2ncc(C[N@H+]3CC(C)(C)[C@H]3c3cccs3)cc12 ZINC001462302828 1061091670 /nfs/dbraw/zinc/09/16/70/1061091670.db2.gz ABBHVUNLMMZCRA-OAHLLOKOSA-N 1 2 313.426 4.176 20 0 DIADLO COc1ccc(F)cc1C[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC001462309581 1061096542 /nfs/dbraw/zinc/09/65/42/1061096542.db2.gz YOJQNDMGXKXABV-MRXNPFEDSA-N 1 2 305.418 4.479 20 0 DIADLO COc1ccc(F)cc1C[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC001462309581 1061096554 /nfs/dbraw/zinc/09/65/54/1061096554.db2.gz YOJQNDMGXKXABV-MRXNPFEDSA-N 1 2 305.418 4.479 20 0 DIADLO CCc1ccc(C2=CC[N@@H+]([C@H](C)C(=O)OC(C)(C)C)CC2)cc1 ZINC001473337135 1061098227 /nfs/dbraw/zinc/09/82/27/1061098227.db2.gz ZXZWXSIZJLHEMT-OAHLLOKOSA-N 1 2 315.457 4.068 20 0 DIADLO CCc1ccc(C2=CC[N@H+]([C@H](C)C(=O)OC(C)(C)C)CC2)cc1 ZINC001473337135 1061098237 /nfs/dbraw/zinc/09/82/37/1061098237.db2.gz ZXZWXSIZJLHEMT-OAHLLOKOSA-N 1 2 315.457 4.068 20 0 DIADLO C[C@H]([NH2+]Cc1nncs1)c1ccccc1Oc1ccccc1 ZINC001473341571 1061099082 /nfs/dbraw/zinc/09/90/82/1061099082.db2.gz AUBNSBAFGUMSGC-ZDUSSCGKSA-N 1 2 311.410 4.181 20 0 DIADLO Cc1ccccc1OCCC[N@@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001473349965 1061106480 /nfs/dbraw/zinc/10/64/80/1061106480.db2.gz STXGHPGLRZJBNQ-UHFFFAOYSA-N 1 2 320.436 4.304 20 0 DIADLO Cc1ccccc1OCCC[N@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001473349965 1061106494 /nfs/dbraw/zinc/10/64/94/1061106494.db2.gz STXGHPGLRZJBNQ-UHFFFAOYSA-N 1 2 320.436 4.304 20 0 DIADLO COC(=O)C1([NH2+]Cc2cccc3ccccc32)CCCCCC1 ZINC001473352791 1061108436 /nfs/dbraw/zinc/10/84/36/1061108436.db2.gz NJRUJIVSAZQSQB-UHFFFAOYSA-N 1 2 311.425 4.195 20 0 DIADLO Cc1ccc([C@H](CC(F)(F)F)[NH2+]Cc2cscn2)cc1 ZINC001473354493 1061109293 /nfs/dbraw/zinc/10/92/93/1061109293.db2.gz KHYDGLMCKTTYIB-ZDUSSCGKSA-N 1 2 300.349 4.235 20 0 DIADLO Cc1cccc(C[N@@H+](C)[C@@H](C)c2ccncc2)c1Br ZINC001473352415 1061109484 /nfs/dbraw/zinc/10/94/84/1061109484.db2.gz JDXFDAHDRWQPBO-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cccc(C[N@H+](C)[C@@H](C)c2ccncc2)c1Br ZINC001473352415 1061109491 /nfs/dbraw/zinc/10/94/91/1061109491.db2.gz JDXFDAHDRWQPBO-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc(C[N@@H+]([C@@H](C)C(=O)OC(C)(C)C)C2CC2)cc1Cl ZINC001462334340 1061110815 /nfs/dbraw/zinc/11/08/15/1061110815.db2.gz LYIGCBCLPOYPRH-ZDUSSCGKSA-N 1 2 323.864 4.343 20 0 DIADLO Cc1ccc(C[N@H+]([C@@H](C)C(=O)OC(C)(C)C)C2CC2)cc1Cl ZINC001462334340 1061110819 /nfs/dbraw/zinc/11/08/19/1061110819.db2.gz LYIGCBCLPOYPRH-ZDUSSCGKSA-N 1 2 323.864 4.343 20 0 DIADLO c1[nH]c2cc[nH+]cc2c1-c1nc2ccc(-c3ccncc3)cc2[nH]1 ZINC001250908651 1061122547 /nfs/dbraw/zinc/12/25/47/1061122547.db2.gz XXEKDNQJBHHGFJ-UHFFFAOYSA-N 1 2 311.348 4.168 20 0 DIADLO Cc1ccc(CNc2ccc(N3CCCC3)c[nH+]2)c(Cl)c1 ZINC001462362528 1061128104 /nfs/dbraw/zinc/12/81/04/1061128104.db2.gz DVUNPEBNGYKIFE-UHFFFAOYSA-N 1 2 301.821 4.256 20 0 DIADLO Clc1ccc2c(c1)nc(-c1ccn3cc[nH+]c3c1)n2CC1CC1 ZINC001250927826 1061129398 /nfs/dbraw/zinc/12/93/98/1061129398.db2.gz KVWGLSLZSVEQSN-UHFFFAOYSA-N 1 2 322.799 4.414 20 0 DIADLO Fc1ccc2[nH]c(-c3cccc(-n4cc[nH+]c4)c3)nc2c1Cl ZINC001250940504 1061138261 /nfs/dbraw/zinc/13/82/61/1061138261.db2.gz QLZPMKXVLYONJI-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO Cc1noc(C[N@@H+](C)Cc2ccccc2-c2ccc(C)cc2C)n1 ZINC001462385468 1061141845 /nfs/dbraw/zinc/14/18/45/1061141845.db2.gz GWLLERNRYIHDDM-UHFFFAOYSA-N 1 2 321.424 4.294 20 0 DIADLO Cc1noc(C[N@H+](C)Cc2ccccc2-c2ccc(C)cc2C)n1 ZINC001462385468 1061141849 /nfs/dbraw/zinc/14/18/49/1061141849.db2.gz GWLLERNRYIHDDM-UHFFFAOYSA-N 1 2 321.424 4.294 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1nc3ccc(F)cc3s1)C2 ZINC001462387702 1061144032 /nfs/dbraw/zinc/14/40/32/1061144032.db2.gz RREBCFLOSJVBET-UHFFFAOYSA-N 1 2 312.413 4.302 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1nc3ccc(F)cc3s1)C2 ZINC001462387702 1061144046 /nfs/dbraw/zinc/14/40/46/1061144046.db2.gz RREBCFLOSJVBET-UHFFFAOYSA-N 1 2 312.413 4.302 20 0 DIADLO Fc1ccc(C=C2CC[NH+](Cc3ccns3)CC2)cc1F ZINC001473411562 1061145740 /nfs/dbraw/zinc/14/57/40/1061145740.db2.gz DCDBPJWAZGOPQD-UHFFFAOYSA-N 1 2 306.381 4.101 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2cncc(Cl)c2)C1 ZINC001473422021 1061151536 /nfs/dbraw/zinc/15/15/36/1061151536.db2.gz LDBASFSKAFTERN-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2cncc(Cl)c2)C1 ZINC001473422021 1061151540 /nfs/dbraw/zinc/15/15/40/1061151540.db2.gz LDBASFSKAFTERN-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(C(F)(F)F)s2)CC2(CCCC2)O1 ZINC001462405303 1061152252 /nfs/dbraw/zinc/15/22/52/1061152252.db2.gz NRTKFKWVZDOIDV-NSHDSACASA-N 1 2 319.392 4.300 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(C(F)(F)F)s2)CC2(CCCC2)O1 ZINC001462405303 1061152259 /nfs/dbraw/zinc/15/22/59/1061152259.db2.gz NRTKFKWVZDOIDV-NSHDSACASA-N 1 2 319.392 4.300 20 0 DIADLO Cc1cc2[nH]c(-c3ccc4[nH+]ccn4c3)nc2cc1C(F)(F)F ZINC001250978234 1061154749 /nfs/dbraw/zinc/15/47/49/1061154749.db2.gz DMOWGPUGXNKOQE-UHFFFAOYSA-N 1 2 316.286 4.205 20 0 DIADLO CCCn1nccc1C[N@@H+]1CCc2oc(-c3ccccc3)cc2C1 ZINC001462410569 1061155939 /nfs/dbraw/zinc/15/59/39/1061155939.db2.gz LESWMDCNVZZCLJ-UHFFFAOYSA-N 1 2 321.424 4.111 20 0 DIADLO CCCn1nccc1C[N@H+]1CCc2oc(-c3ccccc3)cc2C1 ZINC001462410569 1061155946 /nfs/dbraw/zinc/15/59/46/1061155946.db2.gz LESWMDCNVZZCLJ-UHFFFAOYSA-N 1 2 321.424 4.111 20 0 DIADLO CC(C)CCn1c2ccccc2nc1-c1ccc2[nH+]ccn2c1 ZINC001250978572 1061158435 /nfs/dbraw/zinc/15/84/35/1061158435.db2.gz LVLMHNCTRGWZFC-UHFFFAOYSA-N 1 2 304.397 4.397 20 0 DIADLO FC(F)(F)c1cnc(C[NH2+]Cc2ccc3occc3c2)s1 ZINC001462415664 1061161072 /nfs/dbraw/zinc/16/10/72/1061161072.db2.gz MASBAVTXJUWEKA-UHFFFAOYSA-N 1 2 312.316 4.198 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCC[C@@H]1c1ccccc1Cl)C(=O)OC(C)(C)C ZINC001462426865 1061166222 /nfs/dbraw/zinc/16/62/22/1061166222.db2.gz MYLMOSJZPCWPHF-XNRPHZJLSA-N 1 2 323.864 4.296 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCC[C@H]1c1ccccc1)C(=O)OC(C)(C)C ZINC001462427331 1061166738 /nfs/dbraw/zinc/16/67/38/1061166738.db2.gz OVKGTKKRRBAHOC-PVAVHDDUSA-N 1 2 303.446 4.033 20 0 DIADLO C[C@@H](c1nc2ccc(Cl)cc2[nH]1)[N@H+](C)C[C@@H]1CCC(C)(C)O1 ZINC001473483475 1061184825 /nfs/dbraw/zinc/18/48/25/1061184825.db2.gz JKNOOGZHXPHBJB-AAEUAGOBSA-N 1 2 321.852 4.167 20 0 DIADLO C[C@@H](c1nc2ccc(Cl)cc2[nH]1)[N@@H+](C)C[C@@H]1CCC(C)(C)O1 ZINC001473483475 1061184833 /nfs/dbraw/zinc/18/48/33/1061184833.db2.gz JKNOOGZHXPHBJB-AAEUAGOBSA-N 1 2 321.852 4.167 20 0 DIADLO CCCc1cccc(C[N@@H+]2C[C@H](C)O[C@@H](CC(F)(F)F)C2)c1 ZINC001462458874 1061185470 /nfs/dbraw/zinc/18/54/70/1061185470.db2.gz WLEQPVYMLXUDKA-BBRMVZONSA-N 1 2 315.379 4.181 20 0 DIADLO CCCc1cccc(C[N@H+]2C[C@H](C)O[C@@H](CC(F)(F)F)C2)c1 ZINC001462458874 1061185478 /nfs/dbraw/zinc/18/54/78/1061185478.db2.gz WLEQPVYMLXUDKA-BBRMVZONSA-N 1 2 315.379 4.181 20 0 DIADLO C[C@H]1COCC[N@@H+]1Cc1cccc(SCc2ccccc2)c1 ZINC001473490305 1061187312 /nfs/dbraw/zinc/18/73/12/1061187312.db2.gz YMZYTCVCPYKFGU-INIZCTEOSA-N 1 2 313.466 4.200 20 0 DIADLO C[C@H]1COCC[N@H+]1Cc1cccc(SCc2ccccc2)c1 ZINC001473490305 1061187316 /nfs/dbraw/zinc/18/73/16/1061187316.db2.gz YMZYTCVCPYKFGU-INIZCTEOSA-N 1 2 313.466 4.200 20 0 DIADLO CC(C)[C@@]1(CO)CCC[N@H+](Cc2cc(Cl)sc2Cl)C1 ZINC001473500031 1061193029 /nfs/dbraw/zinc/19/30/29/1061193029.db2.gz WHPSPKMMHNEEEK-AWEZNQCLSA-N 1 2 322.301 4.285 20 0 DIADLO CC(C)[C@@]1(CO)CCC[N@@H+](Cc2cc(Cl)sc2Cl)C1 ZINC001473500031 1061193037 /nfs/dbraw/zinc/19/30/37/1061193037.db2.gz WHPSPKMMHNEEEK-AWEZNQCLSA-N 1 2 322.301 4.285 20 0 DIADLO CC(C)c1ccccc1-c1[nH]c2ccc(N3CCOCC3)cc2[nH+]1 ZINC001251049759 1061202875 /nfs/dbraw/zinc/20/28/75/1061202875.db2.gz KEACMLSKJNVTLI-UHFFFAOYSA-N 1 2 321.424 4.190 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(C(F)(F)F)c2)Cc2ccccc2O1 ZINC001473514002 1061210199 /nfs/dbraw/zinc/21/01/99/1061210199.db2.gz KZYMCYDCYFCXBU-ZDUSSCGKSA-N 1 2 321.342 4.489 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2)Cc2ccccc2O1 ZINC001473514002 1061210219 /nfs/dbraw/zinc/21/02/19/1061210219.db2.gz KZYMCYDCYFCXBU-ZDUSSCGKSA-N 1 2 321.342 4.489 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(Cl)ccc2Cl)[C@@H]1[C@@H]1CCCO1 ZINC001473523369 1061222373 /nfs/dbraw/zinc/22/23/73/1061222373.db2.gz QIRJMCRTNUVMHJ-LSDHHAIUSA-N 1 2 314.256 4.383 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(Cl)ccc2Cl)[C@@H]1[C@@H]1CCCO1 ZINC001473523369 1061222398 /nfs/dbraw/zinc/22/23/98/1061222398.db2.gz QIRJMCRTNUVMHJ-LSDHHAIUSA-N 1 2 314.256 4.383 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)/C=C\C2CCCCCC2)[nH+]c1C ZINC001455773803 1061232957 /nfs/dbraw/zinc/23/29/57/1061232957.db2.gz SAKRPCMDPUFORV-WFTPILKQSA-N 1 2 315.461 4.217 20 0 DIADLO CC[C@@H](CC(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1)C(C)(C)C ZINC001455770642 1061233773 /nfs/dbraw/zinc/23/37/73/1061233773.db2.gz NAGANLJKLFTFIM-GJZGRUSLSA-N 1 2 305.466 4.152 20 0 DIADLO COc1ccc(Cl)cc1C(C)(C)[NH2+]C/C(Cl)=C\Cl ZINC001473571976 1061256699 /nfs/dbraw/zinc/25/66/99/1061256699.db2.gz VVIJZKRPIOQBTI-JXMROGBWSA-N 1 2 308.636 4.492 20 0 DIADLO CCC(C)(C)N1CC[NH+](CCCCc2cccc(Cl)c2)CC1 ZINC001473596713 1061278764 /nfs/dbraw/zinc/27/87/64/1061278764.db2.gz ZNAGEHLPZVIBQE-UHFFFAOYSA-N 1 2 322.924 4.469 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(c3ccccc3)C3CCCC3)ccn12 ZINC001456209329 1061287082 /nfs/dbraw/zinc/28/70/82/1061287082.db2.gz FUMHVVIXMJKZCP-UHFFFAOYSA-N 1 2 319.408 4.232 20 0 DIADLO CCCCCC[N@H+](Cc1ccc(C)o1)Cc1nc(CO)cs1 ZINC001462605948 1061293689 /nfs/dbraw/zinc/29/36/89/1061293689.db2.gz OIBIZIWGTONKHJ-UHFFFAOYSA-N 1 2 322.474 4.119 20 0 DIADLO CCCCCC[N@@H+](Cc1ccc(C)o1)Cc1nc(CO)cs1 ZINC001462605948 1061293709 /nfs/dbraw/zinc/29/37/09/1061293709.db2.gz OIBIZIWGTONKHJ-UHFFFAOYSA-N 1 2 322.474 4.119 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@@H+](Cc1nc3ccccc3n1C)CC2 ZINC001473623737 1061294826 /nfs/dbraw/zinc/29/48/26/1061294826.db2.gz GZHBMLAHCICWLF-UHFFFAOYSA-N 1 2 319.452 4.255 20 0 DIADLO CC(C)c1ccc2c(c1)C[N@H+](Cc1nc3ccccc3n1C)CC2 ZINC001473623737 1061294841 /nfs/dbraw/zinc/29/48/41/1061294841.db2.gz GZHBMLAHCICWLF-UHFFFAOYSA-N 1 2 319.452 4.255 20 0 DIADLO COCC[N@H+](CCF)Cc1ccc(Oc2ccccc2)c(F)c1 ZINC001473625627 1061300823 /nfs/dbraw/zinc/30/08/23/1061300823.db2.gz SQZIDJDQEVUUAG-UHFFFAOYSA-N 1 2 321.367 4.036 20 0 DIADLO COCC[N@@H+](CCF)Cc1ccc(Oc2ccccc2)c(F)c1 ZINC001473625627 1061300842 /nfs/dbraw/zinc/30/08/42/1061300842.db2.gz SQZIDJDQEVUUAG-UHFFFAOYSA-N 1 2 321.367 4.036 20 0 DIADLO C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1Cc2ccc(O)cc2C1 ZINC001473657545 1061321829 /nfs/dbraw/zinc/32/18/29/1061321829.db2.gz ITEGZYMCPVZOSS-NSHDSACASA-N 1 2 323.314 4.368 20 0 DIADLO C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@H+]1Cc2ccc(O)cc2C1 ZINC001473657545 1061321838 /nfs/dbraw/zinc/32/18/38/1061321838.db2.gz ITEGZYMCPVZOSS-NSHDSACASA-N 1 2 323.314 4.368 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@@](C)(C(F)F)C1 ZINC001473661940 1061323205 /nfs/dbraw/zinc/32/32/05/1061323205.db2.gz ANFRXPNPENKZFU-UKRRQHHQSA-N 1 2 303.780 4.147 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@@](C)(C(F)F)C1 ZINC001473661940 1061323221 /nfs/dbraw/zinc/32/32/21/1061323221.db2.gz ANFRXPNPENKZFU-UKRRQHHQSA-N 1 2 303.780 4.147 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@](C)(C(F)F)C1 ZINC001473661937 1061326345 /nfs/dbraw/zinc/32/63/45/1061326345.db2.gz ANFRXPNPENKZFU-HIFRSBDPSA-N 1 2 303.780 4.147 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@](C)(C(F)F)C1 ZINC001473661937 1061326364 /nfs/dbraw/zinc/32/63/64/1061326364.db2.gz ANFRXPNPENKZFU-HIFRSBDPSA-N 1 2 303.780 4.147 20 0 DIADLO Cc1cc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)sc1C ZINC001251361279 1061331921 /nfs/dbraw/zinc/33/19/21/1061331921.db2.gz TVWBMZOCLDDLLF-UHFFFAOYSA-N 1 2 312.373 4.233 20 0 DIADLO Fc1cccc(/C=C\C[N@@H+]2CCc3cc(F)cc(F)c3C2)c1 ZINC001462676131 1061333802 /nfs/dbraw/zinc/33/38/02/1061333802.db2.gz VXDCNFDDEZNHDI-RQOWECAXSA-N 1 2 303.327 4.175 20 0 DIADLO Fc1cccc(/C=C\C[N@H+]2CCc3cc(F)cc(F)c3C2)c1 ZINC001462676131 1061333820 /nfs/dbraw/zinc/33/38/20/1061333820.db2.gz VXDCNFDDEZNHDI-RQOWECAXSA-N 1 2 303.327 4.175 20 0 DIADLO COc1cc(-c2nc3cc(Cl)ccc3[nH]2)ccc1-n1cc[nH+]c1 ZINC001251363785 1061334594 /nfs/dbraw/zinc/33/45/94/1061334594.db2.gz FUXFDZBTJGLENW-UHFFFAOYSA-N 1 2 324.771 4.078 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1cc(C2CC2)no1 ZINC001462692596 1061339517 /nfs/dbraw/zinc/33/95/17/1061339517.db2.gz YQERLOSVJHWIGH-UHFFFAOYSA-N 1 2 310.401 4.269 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@@H](C(=O)OC(C)(C)C)C2CC2)C(C)C)c1 ZINC001473702969 1061358534 /nfs/dbraw/zinc/35/85/34/1061358534.db2.gz VCNPELCIBGAZED-ZWKOTPCHSA-N 1 2 317.473 4.402 20 0 DIADLO CO[C@@H]1CC[C@H](C)[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001473713743 1061364114 /nfs/dbraw/zinc/36/41/14/1061364114.db2.gz XDPASIVAQGBTRP-JOYOIKCWSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@@H]1CC[C@H](C)[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001473713743 1061364127 /nfs/dbraw/zinc/36/41/27/1061364127.db2.gz XDPASIVAQGBTRP-JOYOIKCWSA-N 1 2 306.208 4.132 20 0 DIADLO FC(F)(F)SCC[N@@H+]1CCC[C@](F)(c2ccccc2)C1 ZINC001473730179 1061377441 /nfs/dbraw/zinc/37/74/41/1061377441.db2.gz NOBKADDZANFTHI-CYBMUJFWSA-N 1 2 307.356 4.200 20 0 DIADLO FC(F)(F)SCC[N@H+]1CCC[C@](F)(c2ccccc2)C1 ZINC001473730179 1061377458 /nfs/dbraw/zinc/37/74/58/1061377458.db2.gz NOBKADDZANFTHI-CYBMUJFWSA-N 1 2 307.356 4.200 20 0 DIADLO Cc1cccc2c1nc(-c1ccc(-n3cc[nH+]c3)cc1Cl)n2C ZINC001251507830 1061384978 /nfs/dbraw/zinc/38/49/78/1061384978.db2.gz USBZDBMQTCQIAO-UHFFFAOYSA-N 1 2 322.799 4.388 20 0 DIADLO CC(C)(C)OC(=O)C[NH2+][C@H]1CCC(C)(C)C[C@@H]1c1ccccc1 ZINC001473743373 1061388218 /nfs/dbraw/zinc/38/82/18/1061388218.db2.gz RPUBRQITPBWJKH-SJORKVTESA-N 1 2 317.473 4.280 20 0 DIADLO Cc1c(F)c(F)ccc1-c1[nH]c2ccc(N3CCCC3)cc2[nH+]1 ZINC001251546723 1061400663 /nfs/dbraw/zinc/40/06/63/1061400663.db2.gz JPNHYEZBVOIMND-UHFFFAOYSA-N 1 2 313.351 4.417 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccc4nccc(Cl)c4c3)[nH+]c2c1 ZINC001251566206 1061404523 /nfs/dbraw/zinc/40/45/23/1061404523.db2.gz PCFJTWNWWOZMJT-UHFFFAOYSA-N 1 2 322.799 4.498 20 0 DIADLO COc1ccc(C)c(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c1 ZINC001251648535 1061431992 /nfs/dbraw/zinc/43/19/92/1061431992.db2.gz ZCTPYDSKVBZGJT-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO CCCCCC[N@@H+](Cc1cc(Cl)n(C)n1)Cc1ccco1 ZINC001473867370 1061438946 /nfs/dbraw/zinc/43/89/46/1061438946.db2.gz YBCPYILSUOKLDQ-UHFFFAOYSA-N 1 2 309.841 4.249 20 0 DIADLO CCCCCC[N@H+](Cc1cc(Cl)n(C)n1)Cc1ccco1 ZINC001473867370 1061438952 /nfs/dbraw/zinc/43/89/52/1061438952.db2.gz YBCPYILSUOKLDQ-UHFFFAOYSA-N 1 2 309.841 4.249 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1 ZINC001457334568 1061440245 /nfs/dbraw/zinc/44/02/45/1061440245.db2.gz HKJSCIQKGXBOPP-KRWDZBQOSA-N 1 2 319.493 4.187 20 0 DIADLO COC(=O)[C@]1([NH2+]C[C@H](C)C(C)(C)C)CC[C@@H](C)c2ccccc21 ZINC001473887753 1061449446 /nfs/dbraw/zinc/44/94/46/1061449446.db2.gz IFHPAFINTNRKTK-SIFCLUCFSA-N 1 2 317.473 4.224 20 0 DIADLO COC(=O)[C@]1([NH2+]C[C@@H](C)C(C)(C)C)CC[C@H](C)c2ccccc21 ZINC001473887752 1061450313 /nfs/dbraw/zinc/45/03/13/1061450313.db2.gz IFHPAFINTNRKTK-MDOVXXIYSA-N 1 2 317.473 4.224 20 0 DIADLO Cc1noc2ccc(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)cc12 ZINC001251781188 1061482288 /nfs/dbraw/zinc/48/22/88/1061482288.db2.gz QIQYXCWXJYJYJB-UHFFFAOYSA-N 1 2 318.380 4.280 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2cnc[nH]2)c2cccs2)cc1 ZINC001473937939 1061482807 /nfs/dbraw/zinc/48/28/07/1061482807.db2.gz UITARFYKQRFMPK-OAHLLOKOSA-N 1 2 303.818 4.004 20 0 DIADLO Fc1c(Cl)ccc(Br)c1CNc1cccc[nH+]1 ZINC001473944846 1061488184 /nfs/dbraw/zinc/48/81/84/1061488184.db2.gz MFJABSPJWYSTMC-UHFFFAOYSA-N 1 2 315.573 4.249 20 0 DIADLO Cc1cc(C)c(CNC(=O)N2c3ccccc3C(C)(C)[C@H]2C)c[nH+]1 ZINC001251861706 1061514504 /nfs/dbraw/zinc/51/45/04/1061514504.db2.gz ICPQUIFNEMDZPS-OAHLLOKOSA-N 1 2 323.440 4.094 20 0 DIADLO Cc1nc(C[NH2+]Cc2cccc(Cl)c2C)nc2ccccc12 ZINC001473973067 1061518347 /nfs/dbraw/zinc/51/83/47/1061518347.db2.gz DXBHVVUAESXIRT-UHFFFAOYSA-N 1 2 311.816 4.190 20 0 DIADLO Cc1cccn2c(CNc3ccc(C)c(OC(F)F)c3)c[nH+]c12 ZINC001474016381 1061556306 /nfs/dbraw/zinc/55/63/06/1061556306.db2.gz QHFQZJNPPSRHHL-UHFFFAOYSA-N 1 2 317.339 4.165 20 0 DIADLO Cc1cc(N(Cc2ccco2)Cc2ccco2)nc(C2CCC2)[nH+]1 ZINC001458085127 1061563568 /nfs/dbraw/zinc/56/35/68/1061563568.db2.gz HMTSDVOJIXLSME-UHFFFAOYSA-N 1 2 323.396 4.445 20 0 DIADLO CCc1cc(N(Cc2ccccc2F)CC(C)C)nc(CC)[nH+]1 ZINC001458142906 1061595715 /nfs/dbraw/zinc/59/57/15/1061595715.db2.gz KULSNCRGUKJLKQ-UHFFFAOYSA-N 1 2 315.436 4.403 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1cc(C)nc(C)c1)c1ccco1 ZINC001474053267 1061599591 /nfs/dbraw/zinc/59/95/91/1061599591.db2.gz QEUBFZYIHYYHTI-HXUWFJFHSA-N 1 2 322.408 4.179 20 0 DIADLO Fc1ccc(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)c(F)c1 ZINC001474055099 1061603344 /nfs/dbraw/zinc/60/33/44/1061603344.db2.gz KOJAAWHBAFUCSM-UHFFFAOYSA-N 1 2 319.742 4.416 20 0 DIADLO C[C@H]1CC=C(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CC1 ZINC001464555603 1061606231 /nfs/dbraw/zinc/60/62/31/1061606231.db2.gz FHYILBJMNVVMGA-LBPRGKRZSA-N 1 2 315.804 4.211 20 0 DIADLO C[NH+](C)c1ccc(NCc2cc(Cl)cc(Cl)c2N)cc1 ZINC001474062131 1061607119 /nfs/dbraw/zinc/60/71/19/1061607119.db2.gz IHGCZJFZGFFUBP-UHFFFAOYSA-N 1 2 310.228 4.254 20 0 DIADLO CCc1cc(N(Cc2ccc(C)c(C)c2)C2CC2)nc(CC)[nH+]1 ZINC001458195936 1061625395 /nfs/dbraw/zinc/62/53/95/1061625395.db2.gz DWYSBIZDURZHDL-UHFFFAOYSA-N 1 2 309.457 4.387 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC[C@@H](c3ccccc3)CC2)c(C)[nH+]1 ZINC001464772389 1061631700 /nfs/dbraw/zinc/63/17/00/1061631700.db2.gz ZYRGQIBCELJHDJ-LJQANCHMSA-N 1 2 322.452 4.417 20 0 DIADLO CC[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001464831396 1061639879 /nfs/dbraw/zinc/63/98/79/1061639879.db2.gz RRLJRKKZZQYVLO-NVXWUHKLSA-N 1 2 311.429 4.336 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001464831399 1061640803 /nfs/dbraw/zinc/64/08/03/1061640803.db2.gz RRLJRKKZZQYVLO-WBVHZDCISA-N 1 2 311.429 4.336 20 0 DIADLO CCc1cc(N2C[C@H](C)C[C@H]2c2ccccc2F)nc(CC)[nH+]1 ZINC001458223216 1061642711 /nfs/dbraw/zinc/64/27/11/1061642711.db2.gz BZUPFYLPXYIMAJ-DYVFJYSZSA-N 1 2 313.420 4.328 20 0 DIADLO CCO[C@@H](CCNc1cc(C)[nH+]c(C2CC2)n1)C1CCCC1 ZINC001458234107 1061650160 /nfs/dbraw/zinc/65/01/60/1061650160.db2.gz YFENDVSCSRVXJI-INIZCTEOSA-N 1 2 303.450 4.060 20 0 DIADLO CCN(Cc1ccc(OC)cc1)c1cc(C)[nH+]c(C2CCC2)n1 ZINC001458246878 1061658085 /nfs/dbraw/zinc/65/80/85/1061658085.db2.gz ZELWEWZTFFUYLN-UHFFFAOYSA-N 1 2 311.429 4.088 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[NH2+][C@@H]1COc2cc(F)cc(F)c21 ZINC001474109257 1061658902 /nfs/dbraw/zinc/65/89/02/1061658902.db2.gz GPWLBXNBWSRVDL-CQSZACIVSA-N 1 2 321.367 4.387 20 0 DIADLO CCC1(CC)[C@H](Nc2cc(C)[nH+]c(C3CCC3)n2)[C@@H](C)[C@@H]1OC ZINC001458294182 1061682181 /nfs/dbraw/zinc/68/21/81/1061682181.db2.gz BSAJMVQNEZJLRE-XYPHTWIQSA-N 1 2 317.477 4.304 20 0 DIADLO CCCN(CCc1cccs1)c1nc(C)[nH+]c2c1CCCC2 ZINC001458306436 1061688588 /nfs/dbraw/zinc/68/85/88/1061688588.db2.gz BHTYQNUTGZOXEM-UHFFFAOYSA-N 1 2 315.486 4.184 20 0 DIADLO CC(C)(C)OC(=O)NCc1ccc[nH+]c1NCC1CCCCC1 ZINC001474150737 1061694824 /nfs/dbraw/zinc/69/48/24/1061694824.db2.gz XHBQETVPJXJBCB-UHFFFAOYSA-N 1 2 319.449 4.099 20 0 DIADLO CCc1cc(NC2(Cc3cccc(F)c3)CCC2)nc(CC)[nH+]1 ZINC001458329990 1061699209 /nfs/dbraw/zinc/69/92/09/1061699209.db2.gz HKZWBDLDNFBUSZ-UHFFFAOYSA-N 1 2 313.420 4.318 20 0 DIADLO CCC[C@@H](Nc1[nH+]cnc2c1cnn2C(C)(C)C)C(C)(C)C ZINC001458378827 1061731805 /nfs/dbraw/zinc/73/18/05/1061731805.db2.gz BLEKGZKVKOZKTM-CYBMUJFWSA-N 1 2 303.454 4.208 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2ccccc2F)s1)c1csnn1 ZINC001474185389 1061733115 /nfs/dbraw/zinc/73/31/15/1061733115.db2.gz QJZIEDGYBYOPIK-JTQLQIEISA-N 1 2 319.430 4.257 20 0 DIADLO Cc1nc(N2[C@H](C)C[C@H](c3ccccc3)[C@H]2C)c2c([nH+]1)CCCC2 ZINC001458402363 1061743926 /nfs/dbraw/zinc/74/39/26/1061743926.db2.gz QXQLOCUJDRWIEQ-CLCXKQKWSA-N 1 2 321.468 4.435 20 0 DIADLO Cc1cc(NCc2cnccc2C(C)(C)C)nc(C2CCC2)[nH+]1 ZINC001458426880 1061753173 /nfs/dbraw/zinc/75/31/73/1061753173.db2.gz CFZGBHOWFCBXCX-UHFFFAOYSA-N 1 2 310.445 4.357 20 0 DIADLO CO[C@H]1C[C@@H](Nc2cc(C(C)C)[nH+]c(C(C)C)n2)C12CCC2 ZINC001458428233 1061755849 /nfs/dbraw/zinc/75/58/49/1061755849.db2.gz IORPJUAEYUYNRT-CABCVRRESA-N 1 2 303.450 4.093 20 0 DIADLO Fc1cccc(C(F)(F)C[NH2+]Cc2cccc3cccnc32)c1 ZINC001474202768 1061757630 /nfs/dbraw/zinc/75/76/30/1061757630.db2.gz UNLLIAUFKNCEKO-UHFFFAOYSA-N 1 2 316.326 4.256 20 0 DIADLO COc1ccc(CC[C@H](C)Nc2c[nH+]cc3c2CCCC3)cc1 ZINC001474208398 1061762832 /nfs/dbraw/zinc/76/28/32/1061762832.db2.gz CVKPJXMXHZBXFK-HNNXBMFYSA-N 1 2 310.441 4.402 20 0 DIADLO CC(C)(C)c1cnc(CNc2c[nH+]cc3c2CCCC3)s1 ZINC001474208973 1061764614 /nfs/dbraw/zinc/76/46/14/1061764614.db2.gz WLVMYAZICBNMIG-UHFFFAOYSA-N 1 2 301.459 4.327 20 0 DIADLO COc1ccc(C[NH2+][C@@H](CCc2ccccc2)C(F)F)cc1F ZINC001474211631 1061768653 /nfs/dbraw/zinc/76/86/53/1061768653.db2.gz WMNHXWPHIWROAX-INIZCTEOSA-N 1 2 323.358 4.190 20 0 DIADLO CCc1ccc(-c2nnc([C@H]3Cc4ccccc4C[N@@H+]3C)o2)cc1 ZINC001252972579 1061770277 /nfs/dbraw/zinc/77/02/77/1061770277.db2.gz MGLQWDTXKFBBRV-GOSISDBHSA-N 1 2 319.408 4.028 20 0 DIADLO CCc1ccc(-c2nnc([C@H]3Cc4ccccc4C[N@H+]3C)o2)cc1 ZINC001252972579 1061770297 /nfs/dbraw/zinc/77/02/97/1061770297.db2.gz MGLQWDTXKFBBRV-GOSISDBHSA-N 1 2 319.408 4.028 20 0 DIADLO c1ccc(Nc2ccc(NCc3cccc4c3OCO4)[nH+]c2)cc1 ZINC001474216509 1061771617 /nfs/dbraw/zinc/77/16/17/1061771617.db2.gz SXNNXTGZGHJHRG-UHFFFAOYSA-N 1 2 319.364 4.166 20 0 DIADLO CCC[C@H](NC(=O)Nc1ccc2[nH+]c(C)cn2c1)C1CCCC1 ZINC001465531848 1061771956 /nfs/dbraw/zinc/77/19/56/1061771956.db2.gz IMDJIEODHZBAMK-INIZCTEOSA-N 1 2 314.433 4.123 20 0 DIADLO CCc1ccc(-c2nnc(-c3cccc(-n4cc[nH+]c4)c3)o2)cc1 ZINC001253021561 1061788083 /nfs/dbraw/zinc/78/80/83/1061788083.db2.gz WXIGVVZGLNOEEK-UHFFFAOYSA-N 1 2 316.364 4.152 20 0 DIADLO COc1ccc(C)cc1C[NH2+]C1(c2c(F)cccc2F)CCC1 ZINC001474228068 1061789994 /nfs/dbraw/zinc/78/99/94/1061789994.db2.gz ZOIWXUAHHXZWQX-UHFFFAOYSA-N 1 2 317.379 4.451 20 0 DIADLO Cc1cc(NC(=O)C=Cc2cc(Cl)cc(Cl)c2)c(C)c[nH+]1 ZINC001458489326 1061793965 /nfs/dbraw/zinc/79/39/65/1061793965.db2.gz PFFGZPXBWYHLQY-ONEGZZNKSA-N 1 2 321.207 4.079 20 0 DIADLO Cc1cc(NC(=O)C=Cc2cc(Cl)cc(Cl)c2)c(C)c[nH+]1 ZINC001458489324 1061795320 /nfs/dbraw/zinc/79/53/20/1061795320.db2.gz PFFGZPXBWYHLQY-ARJAWSKDSA-N 1 2 321.207 4.079 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C3(CCc4ccccc4)CC3)cc2[nH+]1 ZINC001465897099 1061834250 /nfs/dbraw/zinc/83/42/50/1061834250.db2.gz XNVNTEMYGCEYIR-UHFFFAOYSA-N 1 2 319.408 4.223 20 0 DIADLO Cc1[nH]c(CNc2cc(C(C)(C)C)nc(C(C)(C)C)n2)[nH+]c1C ZINC001458624598 1061858299 /nfs/dbraw/zinc/85/82/99/1061858299.db2.gz XIPIWDZTKQOOFM-UHFFFAOYSA-N 1 2 315.465 4.024 20 0 DIADLO CCn1c2ccc(Br)cc2[nH+]c1NCC1(C)CCC1 ZINC001474301482 1061869580 /nfs/dbraw/zinc/86/95/80/1061869580.db2.gz MFFLAYHGCQHKSU-UHFFFAOYSA-N 1 2 322.250 4.421 20 0 DIADLO CCn1c2ccc(Br)cc2[nH+]c1NCC(C)(C)C ZINC001474302120 1061869734 /nfs/dbraw/zinc/86/97/34/1061869734.db2.gz UECKUGOHFDBARM-UHFFFAOYSA-N 1 2 310.239 4.277 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccc(O)c(F)c2F)[C@@H](c2ccco2)C1 ZINC001474319929 1061898877 /nfs/dbraw/zinc/89/88/77/1061898877.db2.gz SYLFNOKOVDBUES-WCQYABFASA-N 1 2 307.340 4.237 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccc(O)c(F)c2F)[C@@H](c2ccco2)C1 ZINC001474319929 1061898900 /nfs/dbraw/zinc/89/89/00/1061898900.db2.gz SYLFNOKOVDBUES-WCQYABFASA-N 1 2 307.340 4.237 20 0 DIADLO Fc1cccc(CC[N@H+](Cc2c(Cl)ccnc2F)C2CC2)c1 ZINC001474321517 1061904650 /nfs/dbraw/zinc/90/46/50/1061904650.db2.gz KRGDHWPRCGNOLB-UHFFFAOYSA-N 1 2 322.786 4.220 20 0 DIADLO Fc1cccc(CC[N@@H+](Cc2c(Cl)ccnc2F)C2CC2)c1 ZINC001474321517 1061904681 /nfs/dbraw/zinc/90/46/81/1061904681.db2.gz KRGDHWPRCGNOLB-UHFFFAOYSA-N 1 2 322.786 4.220 20 0 DIADLO CCCCC[C@@H](O)C[N@@H+]1CCc2[nH]c3ccc(Cl)cc3c2C1 ZINC001253532631 1061913615 /nfs/dbraw/zinc/91/36/15/1061913615.db2.gz KXJVYOFJKGETQP-CQSZACIVSA-N 1 2 320.864 4.121 20 0 DIADLO CCCCC[C@@H](O)C[N@H+]1CCc2[nH]c3ccc(Cl)cc3c2C1 ZINC001253532631 1061913636 /nfs/dbraw/zinc/91/36/36/1061913636.db2.gz KXJVYOFJKGETQP-CQSZACIVSA-N 1 2 320.864 4.121 20 0 DIADLO C[C@@H](CCC1CCCCC1)NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001466417319 1061936646 /nfs/dbraw/zinc/93/66/46/1061936646.db2.gz CYNOMXICGHKVBM-AWEZNQCLSA-N 1 2 314.433 4.205 20 0 DIADLO CN(C(=O)Nc1ccn2cc[nH+]c2c1)c1cccc2ccccc21 ZINC001466419965 1061939171 /nfs/dbraw/zinc/93/91/71/1061939171.db2.gz SPCIEVBHEOOZTE-UHFFFAOYSA-N 1 2 316.364 4.156 20 0 DIADLO CC1(C[N@@H+]2CCO[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 ZINC001474343418 1061941489 /nfs/dbraw/zinc/94/14/89/1061941489.db2.gz OHUFNFQILDLTQP-AWEZNQCLSA-N 1 2 300.229 4.167 20 0 DIADLO CC1(C[N@H+]2CCO[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 ZINC001474343418 1061941509 /nfs/dbraw/zinc/94/15/09/1061941509.db2.gz OHUFNFQILDLTQP-AWEZNQCLSA-N 1 2 300.229 4.167 20 0 DIADLO C[C@@H]1C[C@H]1C[N@@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001474343768 1061944073 /nfs/dbraw/zinc/94/40/73/1061944073.db2.gz UKVLYZNDZIOTLC-IFUGULHKSA-N 1 2 300.229 4.023 20 0 DIADLO C[C@@H]1C[C@H]1C[N@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001474343768 1061944095 /nfs/dbraw/zinc/94/40/95/1061944095.db2.gz UKVLYZNDZIOTLC-IFUGULHKSA-N 1 2 300.229 4.023 20 0 DIADLO Cc1ccc2cc(C[N@@H+](CC(=O)OC(C)(C)C)C(C)C)[nH]c2c1 ZINC001474344935 1061945481 /nfs/dbraw/zinc/94/54/81/1061945481.db2.gz XPPNLTMULLUJAF-UHFFFAOYSA-N 1 2 316.445 4.028 20 0 DIADLO Cc1ccc2cc(C[N@H+](CC(=O)OC(C)(C)C)C(C)C)[nH]c2c1 ZINC001474344935 1061945498 /nfs/dbraw/zinc/94/54/98/1061945498.db2.gz XPPNLTMULLUJAF-UHFFFAOYSA-N 1 2 316.445 4.028 20 0 DIADLO Clc1cccc(-c2nnc(-c3cccc(-n4cc[nH+]c4)c3)o2)c1 ZINC001253801784 1061986505 /nfs/dbraw/zinc/98/65/05/1061986505.db2.gz TYWHCIJXFQUXRX-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO Cc1cc(C)c(NC(=O)N2Cc3ccccc3[C@@H](C)C2)c(C)[nH+]1 ZINC001466756072 1061999912 /nfs/dbraw/zinc/99/99/12/1061999912.db2.gz KAMJSUFNFJYLBW-ZDUSSCGKSA-N 1 2 309.413 4.158 20 0 DIADLO CC[NH+](CC)[C@@H](c1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC001254082240 1062024025 /nfs/dbraw/zinc/02/40/25/1062024025.db2.gz PIFNNCATQUOGOD-CQSZACIVSA-N 1 2 305.809 4.032 20 0 DIADLO CCc1nc(SCc2cn3cc(C)ccc3[nH+]2)sc1C ZINC001459165555 1062030314 /nfs/dbraw/zinc/03/03/14/1062030314.db2.gz OKKNZWCCWFMJGC-UHFFFAOYSA-N 1 2 303.456 4.262 20 0 DIADLO CC1(C)C[N@H+](CCCc2c(Cl)cccc2Cl)CCO1 ZINC001474381900 1062030322 /nfs/dbraw/zinc/03/03/22/1062030322.db2.gz VPTGNAIJHHFJMD-UHFFFAOYSA-N 1 2 302.245 4.037 20 0 DIADLO CC1(C)C[N@@H+](CCCc2c(Cl)cccc2Cl)CCO1 ZINC001474381900 1062030342 /nfs/dbraw/zinc/03/03/42/1062030342.db2.gz VPTGNAIJHHFJMD-UHFFFAOYSA-N 1 2 302.245 4.037 20 0 DIADLO CC(C)Cn1nccc1C[N@H+](C)[C@@H](C)c1ccccc1Cl ZINC001474401401 1062056757 /nfs/dbraw/zinc/05/67/57/1062056757.db2.gz MQGNPBWAYHHEMN-AWEZNQCLSA-N 1 2 305.853 4.386 20 0 DIADLO CC(C)Cn1nccc1C[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC001474401401 1062056782 /nfs/dbraw/zinc/05/67/82/1062056782.db2.gz MQGNPBWAYHHEMN-AWEZNQCLSA-N 1 2 305.853 4.386 20 0 DIADLO FC1(F)CCC([N@@H+]2CCOC[C@H]2c2ccc(Cl)cc2)CC1 ZINC001254225649 1062059184 /nfs/dbraw/zinc/05/91/84/1062059184.db2.gz BXEGSTBSINYZIY-HNNXBMFYSA-N 1 2 315.791 4.291 20 0 DIADLO FC1(F)CCC([N@H+]2CCOC[C@H]2c2ccc(Cl)cc2)CC1 ZINC001254225649 1062059207 /nfs/dbraw/zinc/05/92/07/1062059207.db2.gz BXEGSTBSINYZIY-HNNXBMFYSA-N 1 2 315.791 4.291 20 0 DIADLO CC1(C)CCN(C(=O)Nc2ccc3[nH+]ccn3c2)CC(C)(C)C1 ZINC001467065926 1062061694 /nfs/dbraw/zinc/06/16/94/1062061694.db2.gz LKJXHJIZFMUFBQ-UHFFFAOYSA-N 1 2 314.433 4.014 20 0 DIADLO CCCn1cc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)nn1 ZINC001474415121 1062084102 /nfs/dbraw/zinc/08/41/02/1062084102.db2.gz SXQDYNXSICDYSG-UHFFFAOYSA-N 1 2 320.440 4.006 20 0 DIADLO CCCn1cc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)nn1 ZINC001474415121 1062084127 /nfs/dbraw/zinc/08/41/27/1062084127.db2.gz SXQDYNXSICDYSG-UHFFFAOYSA-N 1 2 320.440 4.006 20 0 DIADLO Clc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc2n(n1)CCCC2 ZINC001459317078 1062086477 /nfs/dbraw/zinc/08/64/77/1062086477.db2.gz FWKTWMWKCRKQDF-SFHVURJKSA-N 1 2 315.848 4.210 20 0 DIADLO Clc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc2n(n1)CCCC2 ZINC001459317078 1062086500 /nfs/dbraw/zinc/08/65/00/1062086500.db2.gz FWKTWMWKCRKQDF-SFHVURJKSA-N 1 2 315.848 4.210 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCc3cc(F)ccc3C2)c(F)c1 ZINC001474433895 1062109344 /nfs/dbraw/zinc/10/93/44/1062109344.db2.gz CVQOGNKGKQAIGC-OWOJBTEDSA-N 1 2 303.327 4.175 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCc3cc(F)ccc3C2)c(F)c1 ZINC001474433895 1062109359 /nfs/dbraw/zinc/10/93/59/1062109359.db2.gz CVQOGNKGKQAIGC-OWOJBTEDSA-N 1 2 303.327 4.175 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NCCSCc1ccccc1 ZINC001474453451 1062132459 /nfs/dbraw/zinc/13/24/59/1062132459.db2.gz VWXNLVITZBEHIE-UHFFFAOYSA-N 1 2 302.443 4.214 20 0 DIADLO Cn1cc(C[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)c(Cl)n1 ZINC001474481722 1062161537 /nfs/dbraw/zinc/16/15/37/1062161537.db2.gz DSVPWIXDLRNGMF-OAHLLOKOSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1cc(C[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)c(Cl)n1 ZINC001474481722 1062161553 /nfs/dbraw/zinc/16/15/53/1062161553.db2.gz DSVPWIXDLRNGMF-OAHLLOKOSA-N 1 2 324.255 4.454 20 0 DIADLO Cc1ccn(-c2ccc([NH2+]C[C@H]3CCc4ccccc4C3)cc2)n1 ZINC001474514684 1062196575 /nfs/dbraw/zinc/19/65/75/1062196575.db2.gz DGXGXSUIBJPKCF-KRWDZBQOSA-N 1 2 317.436 4.398 20 0 DIADLO Clc1ccc([C@H]2CC[N@@H+]2Cc2cnn(CC3CCC3)c2)cc1 ZINC001474516232 1062201011 /nfs/dbraw/zinc/20/10/11/1062201011.db2.gz BOQCIPLBXDYNAF-GOSISDBHSA-N 1 2 315.848 4.284 20 0 DIADLO Clc1ccc([C@H]2CC[N@H+]2Cc2cnn(CC3CCC3)c2)cc1 ZINC001474516232 1062201037 /nfs/dbraw/zinc/20/10/37/1062201037.db2.gz BOQCIPLBXDYNAF-GOSISDBHSA-N 1 2 315.848 4.284 20 0 DIADLO CCn1ncc(C[N@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC001459553751 1062203386 /nfs/dbraw/zinc/20/33/86/1062203386.db2.gz GSJCYJSCDWNDIE-MRXNPFEDSA-N 1 2 320.440 4.158 20 0 DIADLO CCn1ncc(C[N@@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC001459553751 1062203401 /nfs/dbraw/zinc/20/34/01/1062203401.db2.gz GSJCYJSCDWNDIE-MRXNPFEDSA-N 1 2 320.440 4.158 20 0 DIADLO CC(C)[C@@H]1C[N@H+](Cc2ncc(Br)s2)[C@@H]1C(C)C ZINC001474521651 1062204314 /nfs/dbraw/zinc/20/43/14/1062204314.db2.gz OHYVVCQZQPNVQW-GXFFZTMASA-N 1 2 317.296 4.018 20 0 DIADLO CC(C)[C@@H]1C[N@@H+](Cc2ncc(Br)s2)[C@@H]1C(C)C ZINC001474521651 1062204331 /nfs/dbraw/zinc/20/43/31/1062204331.db2.gz OHYVVCQZQPNVQW-GXFFZTMASA-N 1 2 317.296 4.018 20 0 DIADLO C[C@]1(F)CCC[N@H+](Cc2ccc(Sc3ccccn3)o2)C1 ZINC001474543619 1062235751 /nfs/dbraw/zinc/23/57/51/1062235751.db2.gz YTZHJKSMXAJWDZ-INIZCTEOSA-N 1 2 306.406 4.150 20 0 DIADLO C[C@]1(F)CCC[N@@H+](Cc2ccc(Sc3ccccn3)o2)C1 ZINC001474543619 1062235771 /nfs/dbraw/zinc/23/57/71/1062235771.db2.gz YTZHJKSMXAJWDZ-INIZCTEOSA-N 1 2 306.406 4.150 20 0 DIADLO C[C@@]1(F)CCC[N@H+](Cc2ccc(Sc3ccccn3)o2)C1 ZINC001474543620 1062236513 /nfs/dbraw/zinc/23/65/13/1062236513.db2.gz YTZHJKSMXAJWDZ-MRXNPFEDSA-N 1 2 306.406 4.150 20 0 DIADLO C[C@@]1(F)CCC[N@@H+](Cc2ccc(Sc3ccccn3)o2)C1 ZINC001474543620 1062236533 /nfs/dbraw/zinc/23/65/33/1062236533.db2.gz YTZHJKSMXAJWDZ-MRXNPFEDSA-N 1 2 306.406 4.150 20 0 DIADLO Cc1[nH+]cn(-c2ccc(NC[C@H]3CC3(Cl)Cl)cc2)c1C ZINC001474553228 1062249257 /nfs/dbraw/zinc/24/92/57/1062249257.db2.gz YIPURZGVARPTJC-GFCCVEGCSA-N 1 2 310.228 4.095 20 0 DIADLO CCO[C@H]1C[C@@H]([N@H+](C)Cc2c(Cl)cncc2Cl)C1(C)C ZINC001459633100 1062265408 /nfs/dbraw/zinc/26/54/08/1062265408.db2.gz ZMLSLPBVLWHEQT-KGLIPLIRSA-N 1 2 317.260 4.024 20 0 DIADLO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2c(Cl)cncc2Cl)C1(C)C ZINC001459633100 1062265422 /nfs/dbraw/zinc/26/54/22/1062265422.db2.gz ZMLSLPBVLWHEQT-KGLIPLIRSA-N 1 2 317.260 4.024 20 0 DIADLO CC(C)c1ccc(-c2nnc(-c3cccc4[nH+]ccn43)o2)cc1 ZINC001254838302 1062263474 /nfs/dbraw/zinc/26/34/74/1062263474.db2.gz SJKCMXKDRGSMCE-UHFFFAOYSA-N 1 2 304.353 4.175 20 0 DIADLO CC[N@H+](CC1CCC2(CC1)OCCO2)c1cc(C)ccc1C ZINC001459678658 1062299784 /nfs/dbraw/zinc/29/97/84/1062299784.db2.gz XMLZSFMXGIULCD-UHFFFAOYSA-N 1 2 303.446 4.063 20 0 DIADLO CC[N@@H+](CC1CCC2(CC1)OCCO2)c1cc(C)ccc1C ZINC001459678658 1062299806 /nfs/dbraw/zinc/29/98/06/1062299806.db2.gz XMLZSFMXGIULCD-UHFFFAOYSA-N 1 2 303.446 4.063 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3c(ccnc3Cl)o2)CC2(CCCC2)O1 ZINC001474613578 1062330811 /nfs/dbraw/zinc/33/08/11/1062330811.db2.gz GZBXNTYZDXCSLA-LBPRGKRZSA-N 1 2 320.820 4.015 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3c(ccnc3Cl)o2)CC2(CCCC2)O1 ZINC001474613578 1062330835 /nfs/dbraw/zinc/33/08/35/1062330835.db2.gz GZBXNTYZDXCSLA-LBPRGKRZSA-N 1 2 320.820 4.015 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@H+]1Cc1ccc(F)c(Cl)c1 ZINC001459721871 1062332517 /nfs/dbraw/zinc/33/25/17/1062332517.db2.gz WIQABYGZXPPXFL-LBPRGKRZSA-N 1 2 305.780 4.435 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1ccc(F)c(Cl)c1 ZINC001459721871 1062332545 /nfs/dbraw/zinc/33/25/45/1062332545.db2.gz WIQABYGZXPPXFL-LBPRGKRZSA-N 1 2 305.780 4.435 20 0 DIADLO c1ccc([N@H+](CC2CCC2)CC2CCC3(CC2)OCCO3)cc1 ZINC001459738408 1062350893 /nfs/dbraw/zinc/35/08/93/1062350893.db2.gz BZRGGDSYEUPSLN-UHFFFAOYSA-N 1 2 315.457 4.226 20 0 DIADLO c1ccc([N@@H+](CC2CCC2)CC2CCC3(CC2)OCCO3)cc1 ZINC001459738408 1062350920 /nfs/dbraw/zinc/35/09/20/1062350920.db2.gz BZRGGDSYEUPSLN-UHFFFAOYSA-N 1 2 315.457 4.226 20 0 DIADLO CCC[C@H]1CCC[N@@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001459738489 1062352839 /nfs/dbraw/zinc/35/28/39/1062352839.db2.gz DOJGNVWLAYRVMC-BBRMVZONSA-N 1 2 309.837 4.066 20 0 DIADLO CCC[C@H]1CCC[N@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001459738489 1062352860 /nfs/dbraw/zinc/35/28/60/1062352860.db2.gz DOJGNVWLAYRVMC-BBRMVZONSA-N 1 2 309.837 4.066 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@H+]1C[C@H](C)O[C@](C)(C(F)F)C1 ZINC001474635757 1062359893 /nfs/dbraw/zinc/35/98/93/1062359893.db2.gz DSUAJSTZEFDUFX-GTNSWQLSSA-N 1 2 315.404 4.130 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@@H+]1C[C@H](C)O[C@](C)(C(F)F)C1 ZINC001474635757 1062359920 /nfs/dbraw/zinc/35/99/20/1062359920.db2.gz DSUAJSTZEFDUFX-GTNSWQLSSA-N 1 2 315.404 4.130 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cnon2)[C@H]2CCc3ccccc32)cc1 ZINC001459750245 1062362311 /nfs/dbraw/zinc/36/23/11/1062362311.db2.gz OUWBYSVUXCCSTD-FQEVSTJZSA-N 1 2 319.408 4.068 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cnon2)[C@H]2CCc3ccccc32)cc1 ZINC001459750245 1062362326 /nfs/dbraw/zinc/36/23/26/1062362326.db2.gz OUWBYSVUXCCSTD-FQEVSTJZSA-N 1 2 319.408 4.068 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@H+]1Cc1nc2ccccc2n1C ZINC001459775337 1062387773 /nfs/dbraw/zinc/38/77/73/1062387773.db2.gz LISNBPXSQZBODV-UONOGXRCSA-N 1 2 323.415 4.220 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@@H+]1Cc1nc2ccccc2n1C ZINC001459775337 1062387793 /nfs/dbraw/zinc/38/77/93/1062387793.db2.gz LISNBPXSQZBODV-UONOGXRCSA-N 1 2 323.415 4.220 20 0 DIADLO Cc1nc(C[N@@H+]2[C@H](C)Cc3cc(F)ccc3[C@H]2C)sc1C ZINC001459772988 1062390394 /nfs/dbraw/zinc/39/03/94/1062390394.db2.gz FEHOESZYZSDWME-ZYHUDNBSSA-N 1 2 304.434 4.407 20 0 DIADLO Cc1nc(C[N@H+]2[C@H](C)Cc3cc(F)ccc3[C@H]2C)sc1C ZINC001459772988 1062390416 /nfs/dbraw/zinc/39/04/16/1062390416.db2.gz FEHOESZYZSDWME-ZYHUDNBSSA-N 1 2 304.434 4.407 20 0 DIADLO CCN(Cc1ccc(-n2cc[nH+]c2)cc1C)c1cccc(F)c1 ZINC001459781538 1062394325 /nfs/dbraw/zinc/39/43/25/1062394325.db2.gz CJJJOAMBWJKNRC-UHFFFAOYSA-N 1 2 309.388 4.346 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@@H](Cc2ccccc2)C1 ZINC001459867407 1062460383 /nfs/dbraw/zinc/46/03/83/1062460383.db2.gz HCXCTXLEMLMHPU-BEFAXECRSA-N 1 2 315.844 4.345 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@@H](Cc2ccccc2)C1 ZINC001459867407 1062460391 /nfs/dbraw/zinc/46/03/91/1062460391.db2.gz HCXCTXLEMLMHPU-BEFAXECRSA-N 1 2 315.844 4.345 20 0 DIADLO Cc1conc1C[NH2+][C@H](Cc1ccccc1)c1ccccc1F ZINC001459885514 1062471608 /nfs/dbraw/zinc/47/16/08/1062471608.db2.gz OYMJMXAWEVWNOB-GOSISDBHSA-N 1 2 310.372 4.196 20 0 DIADLO C[C@@H](CC(F)(F)F)[N@@H+]1CCO[C@](C)(c2ccc(Cl)cc2)C1 ZINC001255654454 1062498539 /nfs/dbraw/zinc/49/85/39/1062498539.db2.gz DFQSXYWBLQMDAP-FZMZJTMJSA-N 1 2 321.770 4.228 20 0 DIADLO C[C@@H](CC(F)(F)F)[N@H+]1CCO[C@](C)(c2ccc(Cl)cc2)C1 ZINC001255654454 1062498544 /nfs/dbraw/zinc/49/85/44/1062498544.db2.gz DFQSXYWBLQMDAP-FZMZJTMJSA-N 1 2 321.770 4.228 20 0 DIADLO C[C@H](CC(F)(F)F)[N@@H+]1CCc2ccc(Br)cc2C1 ZINC001255657451 1062501640 /nfs/dbraw/zinc/50/16/40/1062501640.db2.gz HLIYTNDWBMMKAV-SECBINFHSA-N 1 2 322.168 4.148 20 0 DIADLO C[C@H](CC(F)(F)F)[N@H+]1CCc2ccc(Br)cc2C1 ZINC001255657451 1062501658 /nfs/dbraw/zinc/50/16/58/1062501658.db2.gz HLIYTNDWBMMKAV-SECBINFHSA-N 1 2 322.168 4.148 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)[C@H](C)CC(F)(F)F ZINC001255665480 1062506429 /nfs/dbraw/zinc/50/64/29/1062506429.db2.gz YJHUZSOJBGRTOK-OCCSQVGLSA-N 1 2 301.352 4.311 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)[C@H](C)CC(F)(F)F ZINC001255665480 1062506449 /nfs/dbraw/zinc/50/64/49/1062506449.db2.gz YJHUZSOJBGRTOK-OCCSQVGLSA-N 1 2 301.352 4.311 20 0 DIADLO CCOC(=O)[C@@H](C)[N@H+](Cc1ccc(C2CCCC2)cc1)C1CC1 ZINC001459956665 1062527420 /nfs/dbraw/zinc/52/74/20/1062527420.db2.gz GSLLVTWJOKVQOO-OAHLLOKOSA-N 1 2 315.457 4.260 20 0 DIADLO CCOC(=O)[C@@H](C)[N@@H+](Cc1ccc(C2CCCC2)cc1)C1CC1 ZINC001459956665 1062527444 /nfs/dbraw/zinc/52/74/44/1062527444.db2.gz GSLLVTWJOKVQOO-OAHLLOKOSA-N 1 2 315.457 4.260 20 0 DIADLO CC1(C)C[NH+](Cc2cc(Cl)ccc2Cl)CC(C)(C)O1 ZINC001459960814 1062528899 /nfs/dbraw/zinc/52/88/99/1062528899.db2.gz QXOJSNREDKDJCK-UHFFFAOYSA-N 1 2 302.245 4.383 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@@H+]1CCCC2(CCCC2)C1 ZINC001459969646 1062535632 /nfs/dbraw/zinc/53/56/32/1062535632.db2.gz OZJVPPCLYSMTBH-MRXNPFEDSA-N 1 2 321.848 4.210 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@H+]1CCCC2(CCCC2)C1 ZINC001459969646 1062535653 /nfs/dbraw/zinc/53/56/53/1062535653.db2.gz OZJVPPCLYSMTBH-MRXNPFEDSA-N 1 2 321.848 4.210 20 0 DIADLO Cc1cc(F)ccc1C[NH+]1CCN([C@H](C)c2ccsc2)CC1 ZINC001459995364 1062553006 /nfs/dbraw/zinc/55/30/06/1062553006.db2.gz UADKKYZEZKIFNF-OAHLLOKOSA-N 1 2 318.461 4.074 20 0 DIADLO C[C@H](CSc1ccc(F)cc1)[N@H+](C)CC(=O)c1ccccc1 ZINC001255745801 1062567228 /nfs/dbraw/zinc/56/72/28/1062567228.db2.gz AEKFMZNAYODLCX-CQSZACIVSA-N 1 2 317.429 4.121 20 0 DIADLO C[C@H](CSc1ccc(F)cc1)[N@@H+](C)CC(=O)c1ccccc1 ZINC001255745801 1062567248 /nfs/dbraw/zinc/56/72/48/1062567248.db2.gz AEKFMZNAYODLCX-CQSZACIVSA-N 1 2 317.429 4.121 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2c(F)cccc2F)C1 ZINC001460015020 1062573303 /nfs/dbraw/zinc/57/33/03/1062573303.db2.gz SJWDYRNOJJLYFP-SFHVURJKSA-N 1 2 305.343 4.344 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2c(F)cccc2F)C1 ZINC001460015020 1062573326 /nfs/dbraw/zinc/57/33/26/1062573326.db2.gz SJWDYRNOJJLYFP-SFHVURJKSA-N 1 2 305.343 4.344 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@H+](Cc2nsc3ccccc32)C1 ZINC001460025324 1062577898 /nfs/dbraw/zinc/57/78/98/1062577898.db2.gz ZZDUKPINUKAAFP-GOSISDBHSA-N 1 2 312.413 4.367 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@@H+](Cc2nsc3ccccc32)C1 ZINC001460025324 1062577921 /nfs/dbraw/zinc/57/79/21/1062577921.db2.gz ZZDUKPINUKAAFP-GOSISDBHSA-N 1 2 312.413 4.367 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1scnc1Cl ZINC001460066253 1062612890 /nfs/dbraw/zinc/61/28/90/1062612890.db2.gz FZEOUSAAXISENK-ZDUSSCGKSA-N 1 2 310.850 4.388 20 0 DIADLO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1scnc1Cl ZINC001460066253 1062612893 /nfs/dbraw/zinc/61/28/93/1062612893.db2.gz FZEOUSAAXISENK-ZDUSSCGKSA-N 1 2 310.850 4.388 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2ccc(CC(C)C)cc2)c[nH+]1 ZINC001476270624 1062616358 /nfs/dbraw/zinc/61/63/58/1062616358.db2.gz SLLPDEJJRHGSFU-UHFFFAOYSA-N 1 2 311.429 4.219 20 0 DIADLO Cc1cc(NC(=O)N[C@H]2CCC[C@@H](C(C)(C)C)CC2)c(C)c[nH+]1 ZINC001476303922 1062627777 /nfs/dbraw/zinc/62/77/77/1062627777.db2.gz VMYXSXANXRRCET-CVEARBPZSA-N 1 2 317.477 4.237 20 0 DIADLO CC(C)C[C@@H](C(=O)N1CCC2(CCCCC2)CC1)n1cc[nH+]c1 ZINC001469914809 1062656489 /nfs/dbraw/zinc/65/64/89/1062656489.db2.gz PSRVCDSQWMFTEU-KRWDZBQOSA-N 1 2 317.477 4.043 20 0 DIADLO C[N@H+](Cc1sccc1Cl)[C@H](CO)c1ccc(Cl)cc1 ZINC001460145059 1062659798 /nfs/dbraw/zinc/65/97/98/1062659798.db2.gz WYWDITFUFQZRPD-CYBMUJFWSA-N 1 2 316.253 4.220 20 0 DIADLO C[N@@H+](Cc1sccc1Cl)[C@H](CO)c1ccc(Cl)cc1 ZINC001460145059 1062659805 /nfs/dbraw/zinc/65/98/05/1062659805.db2.gz WYWDITFUFQZRPD-CYBMUJFWSA-N 1 2 316.253 4.220 20 0 DIADLO C[N@H+](Cc1ccc([Si](C)(C)C)cc1)Cc1c(F)cccc1F ZINC001460143377 1062660971 /nfs/dbraw/zinc/66/09/71/1062660971.db2.gz RCAVMVPTXIFUPP-UHFFFAOYSA-N 1 2 319.471 4.142 20 0 DIADLO C[N@@H+](Cc1ccc([Si](C)(C)C)cc1)Cc1c(F)cccc1F ZINC001460143377 1062660983 /nfs/dbraw/zinc/66/09/83/1062660983.db2.gz RCAVMVPTXIFUPP-UHFFFAOYSA-N 1 2 319.471 4.142 20 0 DIADLO CC1(C)CCC(C)(CNC(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC001476534386 1062675770 /nfs/dbraw/zinc/67/57/70/1062675770.db2.gz ZZVVQXUWLQWZCK-UHFFFAOYSA-N 1 2 314.433 4.062 20 0 DIADLO Cc1cnc(C[N@@H+]2CCc3ccc(-c4ccccc4)cc3C2)nc1 ZINC001460177079 1062682502 /nfs/dbraw/zinc/68/25/02/1062682502.db2.gz JBOZYNVKMJXKHC-UHFFFAOYSA-N 1 2 315.420 4.010 20 0 DIADLO Cc1cnc(C[N@H+]2CCc3ccc(-c4ccccc4)cc3C2)nc1 ZINC001460177079 1062682511 /nfs/dbraw/zinc/68/25/11/1062682511.db2.gz JBOZYNVKMJXKHC-UHFFFAOYSA-N 1 2 315.420 4.010 20 0 DIADLO Cc1nc(C[N@@H+]2CC(C)(C)[C@H]2[C@@H]2CCCO2)sc1C(C)(C)C ZINC001460195839 1062692583 /nfs/dbraw/zinc/69/25/83/1062692583.db2.gz LIWXCQZDGQVJMU-DZGCQCFKSA-N 1 2 322.518 4.138 20 0 DIADLO Cc1nc(C[N@H+]2CC(C)(C)[C@H]2[C@@H]2CCCO2)sc1C(C)(C)C ZINC001460195839 1062692593 /nfs/dbraw/zinc/69/25/93/1062692593.db2.gz LIWXCQZDGQVJMU-DZGCQCFKSA-N 1 2 322.518 4.138 20 0 DIADLO Cc1cncc([C@@H]2CCCN2C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC001476699129 1062703528 /nfs/dbraw/zinc/70/35/28/1062703528.db2.gz PYDPYOIESCVMNH-KRWDZBQOSA-N 1 2 324.428 4.079 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@H](C3CCC3)CC2)c(C)[nH+]1 ZINC001476698828 1062704253 /nfs/dbraw/zinc/70/42/53/1062704253.db2.gz MHHMAYGGKWFPPP-KRWDZBQOSA-N 1 2 315.461 4.441 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1c(F)ccc(C)c1F ZINC001460219995 1062705846 /nfs/dbraw/zinc/70/58/46/1062705846.db2.gz YKUIWEVZZWBAAA-CYBMUJFWSA-N 1 2 305.368 4.441 20 0 DIADLO CC1(C)c2ccccc2CC[N@H+]1Cc1cncc(C(F)(F)F)c1 ZINC001460279218 1062751858 /nfs/dbraw/zinc/75/18/58/1062751858.db2.gz PCJKKKSOHIVPDU-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO CC1(C)c2ccccc2CC[N@@H+]1Cc1cncc(C(F)(F)F)c1 ZINC001460279218 1062751878 /nfs/dbraw/zinc/75/18/78/1062751878.db2.gz PCJKKKSOHIVPDU-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO C[C@H](CCc1ccc(Br)cc1)[N@@H+]1CCC(F)(F)C1 ZINC001256221465 1062752983 /nfs/dbraw/zinc/75/29/83/1062752983.db2.gz CGAIDJGNAZWPKK-LLVKDONJSA-N 1 2 318.205 4.111 20 0 DIADLO C[C@H](CCc1ccc(Br)cc1)[N@H+]1CCC(F)(F)C1 ZINC001256221465 1062753003 /nfs/dbraw/zinc/75/30/03/1062753003.db2.gz CGAIDJGNAZWPKK-LLVKDONJSA-N 1 2 318.205 4.111 20 0 DIADLO FC1(F)CCC[N@@H+](C2CCN(c3ccc(Cl)cc3)CC2)C1 ZINC001256307581 1062771484 /nfs/dbraw/zinc/77/14/84/1062771484.db2.gz YVNJBUAWIPVLRV-UHFFFAOYSA-N 1 2 314.807 4.040 20 0 DIADLO FC1(F)CCC[N@H+](C2CCN(c3ccc(Cl)cc3)CC2)C1 ZINC001256307581 1062771494 /nfs/dbraw/zinc/77/14/94/1062771494.db2.gz YVNJBUAWIPVLRV-UHFFFAOYSA-N 1 2 314.807 4.040 20 0 DIADLO C[C@H]1C[N@H+](Cc2ncc(Cl)s2)CCc2ccc(F)cc21 ZINC001460334713 1062790450 /nfs/dbraw/zinc/79/04/50/1062790450.db2.gz QJKYLRGQPGBFDA-JTQLQIEISA-N 1 2 310.825 4.097 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ncc(Cl)s2)CCc2ccc(F)cc21 ZINC001460334713 1062790470 /nfs/dbraw/zinc/79/04/70/1062790470.db2.gz QJKYLRGQPGBFDA-JTQLQIEISA-N 1 2 310.825 4.097 20 0 DIADLO CCSc1ccccc1C[N@H+](C)[C@H](CC)C(=O)OC(C)(C)C ZINC001460336847 1062790888 /nfs/dbraw/zinc/79/08/88/1062790888.db2.gz WXDIUHTUBBLGJX-OAHLLOKOSA-N 1 2 323.502 4.351 20 0 DIADLO CCSc1ccccc1C[N@@H+](C)[C@H](CC)C(=O)OC(C)(C)C ZINC001460336847 1062790911 /nfs/dbraw/zinc/79/09/11/1062790911.db2.gz WXDIUHTUBBLGJX-OAHLLOKOSA-N 1 2 323.502 4.351 20 0 DIADLO Cc1cscc1NC(=O)Nc1cc[nH+]c(N2CCCCC2)c1 ZINC001477131814 1062791967 /nfs/dbraw/zinc/79/19/67/1062791967.db2.gz HYOXFSKRYULTHF-UHFFFAOYSA-N 1 2 316.430 4.086 20 0 DIADLO CC[C@@H](C)C[N@@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC001460368718 1062820666 /nfs/dbraw/zinc/82/06/66/1062820666.db2.gz YBXQIXZCVHEVDT-LLVKDONJSA-N 1 2 321.262 4.335 20 0 DIADLO CC[C@@H](C)C[N@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC001460368718 1062820693 /nfs/dbraw/zinc/82/06/93/1062820693.db2.gz YBXQIXZCVHEVDT-LLVKDONJSA-N 1 2 321.262 4.335 20 0 DIADLO CC(C)c1cccc(C[N@@H+]2Cc3ccccc3NC(=O)[C@@H]2C)c1 ZINC001460414014 1062843748 /nfs/dbraw/zinc/84/37/48/1062843748.db2.gz ZZLUZNRSLHXKKB-HNNXBMFYSA-N 1 2 308.425 4.153 20 0 DIADLO CC(C)c1cccc(C[N@H+]2Cc3ccccc3NC(=O)[C@@H]2C)c1 ZINC001460414014 1062843775 /nfs/dbraw/zinc/84/37/75/1062843775.db2.gz ZZLUZNRSLHXKKB-HNNXBMFYSA-N 1 2 308.425 4.153 20 0 DIADLO COc1ccc2c(c1)CC[N@H+]([C@@H](C)c1ccc(F)cc1F)C2 ZINC001460441232 1062855391 /nfs/dbraw/zinc/85/53/91/1062855391.db2.gz FHIMZGHGHNOMKW-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc2c(c1)CC[N@@H+]([C@@H](C)c1ccc(F)cc1F)C2 ZINC001460441232 1062855413 /nfs/dbraw/zinc/85/54/13/1062855413.db2.gz FHIMZGHGHNOMKW-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1nc(C)c(Br)s1 ZINC001460481068 1062871924 /nfs/dbraw/zinc/87/19/24/1062871924.db2.gz HJQMIFVUVLAYQL-GXSJLCMTSA-N 1 2 317.296 4.367 20 0 DIADLO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1nc(C)c(Br)s1 ZINC001460481068 1062871947 /nfs/dbraw/zinc/87/19/47/1062871947.db2.gz HJQMIFVUVLAYQL-GXSJLCMTSA-N 1 2 317.296 4.367 20 0 DIADLO Cc1ccc(-c2nnc([C@@H]3CCC[N@@H+]3Cc3ccco3)o2)cc1C ZINC001256555218 1062879261 /nfs/dbraw/zinc/87/92/61/1062879261.db2.gz MWDPHMUIJADTJJ-KRWDZBQOSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1ccc(-c2nnc([C@@H]3CCC[N@H+]3Cc3ccco3)o2)cc1C ZINC001256555218 1062879289 /nfs/dbraw/zinc/87/92/89/1062879289.db2.gz MWDPHMUIJADTJJ-KRWDZBQOSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1ccc(-c2nnc([C@@H]3CC[N@@H+]3Cc3ccccc3)o2)cc1C ZINC001256577017 1062898862 /nfs/dbraw/zinc/89/88/62/1062898862.db2.gz JDBHJGOISFKOAM-SFHVURJKSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1ccc(-c2nnc([C@@H]3CC[N@H+]3Cc3ccccc3)o2)cc1C ZINC001256577017 1062898882 /nfs/dbraw/zinc/89/88/82/1062898882.db2.gz JDBHJGOISFKOAM-SFHVURJKSA-N 1 2 319.408 4.300 20 0 DIADLO CC[NH+](CC)[C@@H](c1nnc([C@@H]2C[C@@H]2C)o1)c1ccc(Cl)cc1 ZINC001256683216 1062945083 /nfs/dbraw/zinc/94/50/83/1062945083.db2.gz OBBQEIUCHDAWBF-NILFDRSVSA-N 1 2 319.836 4.278 20 0 DIADLO Cc1cccc(Oc2cccc(NC(=O)[C@@H](C)n3cc[nH+]c3)c2)c1 ZINC001471333973 1062965974 /nfs/dbraw/zinc/96/59/74/1062965974.db2.gz USMNEENACGCFTG-OAHLLOKOSA-N 1 2 321.380 4.184 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@H+](Cc1ccc(C)cc1C)C3 ZINC001460699196 1062996289 /nfs/dbraw/zinc/99/62/89/1062996289.db2.gz IZBOWTPYGMDUBT-UHFFFAOYSA-N 1 2 320.436 4.352 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@@H+](Cc1ccc(C)cc1C)C3 ZINC001460699196 1062996305 /nfs/dbraw/zinc/99/63/05/1062996305.db2.gz IZBOWTPYGMDUBT-UHFFFAOYSA-N 1 2 320.436 4.352 20 0 DIADLO c1c(CCc2nnc(CCC3CCCCC3)o2)[nH+]c2ccccn12 ZINC001256816965 1062998826 /nfs/dbraw/zinc/99/88/26/1062998826.db2.gz OKIVCUMGGGRQQB-UHFFFAOYSA-N 1 2 324.428 4.015 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)CC/C=C/c2ccccc2)[nH+]c1C ZINC001471859695 1063026430 /nfs/dbraw/zinc/02/64/30/1063026430.db2.gz RPQXLXIYCKENLR-QKIXSCASSA-N 1 2 323.440 4.184 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)[C@@H](C)CC2CCCCC2)[nH+]c1C ZINC001471859755 1063027073 /nfs/dbraw/zinc/02/70/73/1063027073.db2.gz SKWZCVSOFNMMIL-SUMWQHHRSA-N 1 2 317.477 4.297 20 0 DIADLO CCc1[nH]c(CNC(=O)CC2CCC(C(C)(C)CC)CC2)c[nH+]1 ZINC001472020092 1063042390 /nfs/dbraw/zinc/04/23/90/1063042390.db2.gz CDGNFDYQOFWFGN-UHFFFAOYSA-N 1 2 319.493 4.221 20 0 DIADLO CCc1[nH]cc(CNC(=O)CC2CCC(C(C)(C)CC)CC2)[nH+]1 ZINC001472020092 1063042404 /nfs/dbraw/zinc/04/24/04/1063042404.db2.gz CDGNFDYQOFWFGN-UHFFFAOYSA-N 1 2 319.493 4.221 20 0 DIADLO CC[C@H](CC(=O)NCc1c[nH]c(C(C)C)[nH+]1)c1ccc(C)cc1 ZINC001472094755 1063047465 /nfs/dbraw/zinc/04/74/65/1063047465.db2.gz JNMMRMANHMZICT-OAHLLOKOSA-N 1 2 313.445 4.042 20 0 DIADLO CC[C@H](CC(=O)NCc1c[nH+]c(C(C)C)[nH]1)c1ccc(C)cc1 ZINC001472094755 1063047485 /nfs/dbraw/zinc/04/74/85/1063047485.db2.gz JNMMRMANHMZICT-OAHLLOKOSA-N 1 2 313.445 4.042 20 0 DIADLO CC(C)c1[nH]cc(CNC(=O)c2ccccc2-c2ccccc2)[nH+]1 ZINC001472093412 1063049714 /nfs/dbraw/zinc/04/97/14/1063049714.db2.gz XNVMHOAOACDGFQ-UHFFFAOYSA-N 1 2 319.408 4.130 20 0 DIADLO CC(C)c1[nH]c(CNC(=O)c2ccccc2-c2ccccc2)c[nH+]1 ZINC001472093412 1063049735 /nfs/dbraw/zinc/04/97/35/1063049735.db2.gz XNVMHOAOACDGFQ-UHFFFAOYSA-N 1 2 319.408 4.130 20 0 DIADLO CCCC[N@H+](Cc1c(C)oc(C)c1C)[C@@H](C)C(=O)OCCC ZINC001460819103 1063081003 /nfs/dbraw/zinc/08/10/03/1063081003.db2.gz TWHUBECIZGALHX-AWEZNQCLSA-N 1 2 309.450 4.149 20 0 DIADLO CCCC[N@@H+](Cc1c(C)oc(C)c1C)[C@@H](C)C(=O)OCCC ZINC001460819103 1063081023 /nfs/dbraw/zinc/08/10/23/1063081023.db2.gz TWHUBECIZGALHX-AWEZNQCLSA-N 1 2 309.450 4.149 20 0 DIADLO Cl/C=C(\Cl)C[N@@H+]1CCC[C@]2(C=Cc3ccccc3O2)C1 ZINC001460862320 1063105837 /nfs/dbraw/zinc/10/58/37/1063105837.db2.gz VKOMINSJECUZCC-DNXIFWLFSA-N 1 2 310.224 4.246 20 0 DIADLO Cl/C=C(\Cl)C[N@H+]1CCC[C@]2(C=Cc3ccccc3O2)C1 ZINC001460862320 1063105846 /nfs/dbraw/zinc/10/58/46/1063105846.db2.gz VKOMINSJECUZCC-DNXIFWLFSA-N 1 2 310.224 4.246 20 0 DIADLO CCN(Cc1cccc(Cl)c1)c1nc(C)[nH+]c2c1CCCC2 ZINC001472660987 1063128775 /nfs/dbraw/zinc/12/87/75/1063128775.db2.gz CGRNYEQWTBIWPM-UHFFFAOYSA-N 1 2 315.848 4.344 20 0 DIADLO Cc1nc(NCc2cc3c(s2)CCCC3)c2c([nH+]1)CCCC2 ZINC001472662271 1063130190 /nfs/dbraw/zinc/13/01/90/1063130190.db2.gz KLVZOPVIFWLGMH-UHFFFAOYSA-N 1 2 313.470 4.216 20 0 DIADLO Cc1ccc(C[C@H]2CCCN(c3nc(C)[nH+]c(C)c3C)C2)cc1 ZINC001472677329 1063142763 /nfs/dbraw/zinc/14/27/63/1063142763.db2.gz OUDCCNNCWHKEIR-LJQANCHMSA-N 1 2 309.457 4.169 20 0 DIADLO CC(C)(C)CCCCNc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001472689092 1063153547 /nfs/dbraw/zinc/15/35/47/1063153547.db2.gz CHEICMOOGHMXHN-UHFFFAOYSA-N 1 2 303.454 4.210 20 0 DIADLO CC(C)C1(O)CC[NH+](Cc2cc(Cl)sc2Cl)CC1 ZINC001460948970 1063154721 /nfs/dbraw/zinc/15/47/21/1063154721.db2.gz GIRHQXSCJSWYRF-UHFFFAOYSA-N 1 2 308.274 4.038 20 0 DIADLO C[C@H](CCC(C)(C)C)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001472700127 1063160798 /nfs/dbraw/zinc/16/07/98/1063160798.db2.gz KCGJCKXRQLUVFR-GFCCVEGCSA-N 1 2 303.454 4.208 20 0 DIADLO Cn1c[nH+]c2cc(Nc3nc(C4CCCCC4)ns3)ccc21 ZINC001472709142 1063166724 /nfs/dbraw/zinc/16/67/24/1063166724.db2.gz DTBNJWWWWANACZ-UHFFFAOYSA-N 1 2 313.430 4.216 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001461012683 1063188342 /nfs/dbraw/zinc/18/83/42/1063188342.db2.gz YRYNZEWEEREYJD-GOSISDBHSA-N 1 2 302.462 4.311 20 0 DIADLO Cc1nc(NCCc2ccc(Oc3ccc(F)cc3)cc2)cc[nH+]1 ZINC001472738495 1063195426 /nfs/dbraw/zinc/19/54/26/1063195426.db2.gz RWYJPMRILWBRQP-UHFFFAOYSA-N 1 2 323.371 4.371 20 0 DIADLO CCCC(CCC)[NH2+][C@@H](c1nnc(C)o1)c1ccccc1OC ZINC001257332986 1063214310 /nfs/dbraw/zinc/21/43/10/1063214310.db2.gz CBAQBEVETAZSRB-QGZVFWFLSA-N 1 2 317.433 4.034 20 0 DIADLO CCOc1cccc(F)c1C[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC001461063646 1063226762 /nfs/dbraw/zinc/22/67/62/1063226762.db2.gz JWOICYSDKBMOGJ-GXTWGEPZSA-N 1 2 303.377 4.231 20 0 DIADLO CC(C)Cc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)cn1 ZINC001461076372 1063236387 /nfs/dbraw/zinc/23/63/87/1063236387.db2.gz ZFTSCBJFZIHWBX-UHFFFAOYSA-N 1 2 306.413 4.078 20 0 DIADLO CC(C)c1cnc(CNc2ccc(N3CCCCC3)c[nH+]2)s1 ZINC001461084467 1063241399 /nfs/dbraw/zinc/24/13/99/1063241399.db2.gz ZZVAUJYYWWQKDF-UHFFFAOYSA-N 1 2 316.474 4.264 20 0 DIADLO CC[C@@H]1CCCC[C@H]1CNc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001472793095 1063241453 /nfs/dbraw/zinc/24/14/53/1063241453.db2.gz IVNLFKHHPXVOQD-KGLIPLIRSA-N 1 2 315.465 4.210 20 0 DIADLO CCCCOC(=O)CC[C@@H](C)[N@@H+]1Cc2ccc(Cl)cc2C1 ZINC001257401615 1063250666 /nfs/dbraw/zinc/25/06/66/1063250666.db2.gz CSECCTZCIAUGGY-CYBMUJFWSA-N 1 2 309.837 4.168 20 0 DIADLO CCCCOC(=O)CC[C@@H](C)[N@H+]1Cc2ccc(Cl)cc2C1 ZINC001257401615 1063250687 /nfs/dbraw/zinc/25/06/87/1063250687.db2.gz CSECCTZCIAUGGY-CYBMUJFWSA-N 1 2 309.837 4.168 20 0 DIADLO CC[C@@H](C)Oc1ccc(NCc2c[nH+]c3ccc(C)cn23)cc1 ZINC001461095803 1063251702 /nfs/dbraw/zinc/25/17/02/1063251702.db2.gz LHYBYUIEQRPYCF-OAHLLOKOSA-N 1 2 309.413 4.432 20 0 DIADLO CC[C@@H](Nc1nc(C)[nH+]c(C)c1Br)[C@@H]1CC1(C)C ZINC001472809172 1063255813 /nfs/dbraw/zinc/25/58/13/1063255813.db2.gz LFIKLQQYAVJTKJ-WDEREUQCSA-N 1 2 312.255 4.093 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+]Cc1cnn(CC2CCC2)c1 ZINC001461110301 1063259767 /nfs/dbraw/zinc/25/97/67/1063259767.db2.gz DMDRSCBWVQZJIU-UHFFFAOYSA-N 1 2 324.255 4.280 20 0 DIADLO CCCC[C@H](CC)[NH2+][C@H](c1nnc(C)o1)c1ccccc1OC ZINC001257416635 1063265042 /nfs/dbraw/zinc/26/50/42/1063265042.db2.gz NSDFCCNGDBHDCD-YOEHRIQHSA-N 1 2 317.433 4.034 20 0 DIADLO C[C@H]1CC(CNc2[nH+]cnc3c2cnn3C(C)(C)C)C[C@H](C)C1 ZINC001472826738 1063269131 /nfs/dbraw/zinc/26/91/31/1063269131.db2.gz HFPXNSVUVSBKCR-CHWSQXEVSA-N 1 2 315.465 4.066 20 0 DIADLO CCc1cc(N[C@H](CC)Cc2ccc(F)cc2)nc(CC)[nH+]1 ZINC001472829751 1063269667 /nfs/dbraw/zinc/26/96/67/1063269667.db2.gz YWXCYLMXKWMCLW-OAHLLOKOSA-N 1 2 301.409 4.174 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2nccs2)c2ccccc2)cc(C)n1 ZINC001461128581 1063280175 /nfs/dbraw/zinc/28/01/75/1063280175.db2.gz HYBSLPWTOBHUJU-KRWDZBQOSA-N 1 2 309.438 4.034 20 0 DIADLO CCC[C@H]1CCCC[C@H]1CNC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001478818336 1063297911 /nfs/dbraw/zinc/29/79/11/1063297911.db2.gz FRKFFYXLUXXXCW-ROUUACIJSA-N 1 2 317.477 4.104 20 0 DIADLO Cc1cc(C)c(CNC(=O)N2CC[C@@H](C(C)(C)C)C[C@@H]2C)c[nH+]1 ZINC001478814045 1063298687 /nfs/dbraw/zinc/29/86/87/1063298687.db2.gz IPENVQIQUMJECF-DOTOQJQBSA-N 1 2 317.477 4.055 20 0 DIADLO CCC[C@H]1CCCC[C@@H]1CNC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001478818339 1063301121 /nfs/dbraw/zinc/30/11/21/1063301121.db2.gz FRKFFYXLUXXXCW-ZWKOTPCHSA-N 1 2 317.477 4.104 20 0 DIADLO CCC[C@H](C)CC[C@@H](C)[N@@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001257484873 1063303278 /nfs/dbraw/zinc/30/32/78/1063303278.db2.gz FXJGNQDMCXIRQY-JKSUJKDBSA-N 1 2 319.493 4.155 20 0 DIADLO CCC[C@H](C)CC[C@@H](C)[N@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001257484873 1063303293 /nfs/dbraw/zinc/30/32/93/1063303293.db2.gz FXJGNQDMCXIRQY-JKSUJKDBSA-N 1 2 319.493 4.155 20 0 DIADLO Cc1cccc(C2=CCN(c3nc(C)[nH+]c(C)c3C)CC2)c1C ZINC001472898996 1063306591 /nfs/dbraw/zinc/30/65/91/1063306591.db2.gz LAILTYHUNLTIRU-UHFFFAOYSA-N 1 2 307.441 4.312 20 0 DIADLO Cc1nc(NCCC2CCC(F)(F)CC2)c2c([nH+]1)CCCC2 ZINC001472898576 1063306650 /nfs/dbraw/zinc/30/66/50/1063306650.db2.gz CFGAYGZBZDSPBV-UHFFFAOYSA-N 1 2 309.404 4.291 20 0 DIADLO Cc1nc(NC[C@H]2C[C@@H]2C2CCCC2)c(Br)c(C)[nH+]1 ZINC001472904124 1063307842 /nfs/dbraw/zinc/30/78/42/1063307842.db2.gz IZJOYGFILQGOGN-CHWSQXEVSA-N 1 2 324.266 4.094 20 0 DIADLO CCCCC[C@@H](C)[NH2+][C@H](c1nnc(C)o1)c1ccccc1OC ZINC001257506700 1063316615 /nfs/dbraw/zinc/31/66/15/1063316615.db2.gz SCJLNTYNBZBHHV-DYVFJYSZSA-N 1 2 317.433 4.034 20 0 DIADLO Cc1cccc(-n2ccnc2SCc2ccc(C)[nH+]c2C)c1 ZINC001472942877 1063326119 /nfs/dbraw/zinc/32/61/19/1063326119.db2.gz ZHCNYLPWYURYRF-UHFFFAOYSA-N 1 2 309.438 4.485 20 0 DIADLO Cc1cc(N)nc(SCC2CCC(c3ccccc3)CC2)[nH+]1 ZINC001472953810 1063329632 /nfs/dbraw/zinc/32/96/32/1063329632.db2.gz SKTBNGISRXVQOB-UHFFFAOYSA-N 1 2 313.470 4.433 20 0 DIADLO CC(C)[N@@H+]1CC[C@H]1c1nnc([C@H]2C[C@@H]2c2ccc(Cl)cc2)o1 ZINC001257685254 1063369624 /nfs/dbraw/zinc/36/96/24/1063369624.db2.gz WWAOSYBWTPTWIQ-ILXRZTDVSA-N 1 2 317.820 4.149 20 0 DIADLO CC(C)[N@H+]1CC[C@H]1c1nnc([C@H]2C[C@@H]2c2ccc(Cl)cc2)o1 ZINC001257685254 1063369642 /nfs/dbraw/zinc/36/96/42/1063369642.db2.gz WWAOSYBWTPTWIQ-ILXRZTDVSA-N 1 2 317.820 4.149 20 0 DIADLO CCc1cn(Cc2ccc(OCc3ccccc3F)cc2)c[nH+]1 ZINC001473086844 1063394389 /nfs/dbraw/zinc/39/43/89/1063394389.db2.gz ADSNHNCZIDSPHP-UHFFFAOYSA-N 1 2 310.372 4.212 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(OC(C)C)c(Cl)c1 ZINC001473105761 1063405988 /nfs/dbraw/zinc/40/59/88/1063405988.db2.gz NVPNXQRWDJWOGJ-HIFRSBDPSA-N 1 2 311.853 4.127 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccc(OC(C)C)c(Cl)c1 ZINC001473105761 1063405998 /nfs/dbraw/zinc/40/59/98/1063405998.db2.gz NVPNXQRWDJWOGJ-HIFRSBDPSA-N 1 2 311.853 4.127 20 0 DIADLO C[C@H]1CCCC[C@@H]1CNc1ccccc1OCCn1cc[nH+]c1 ZINC001461324780 1063419278 /nfs/dbraw/zinc/41/92/78/1063419278.db2.gz PESQMQJKGUJFSH-DLBZAZTESA-N 1 2 313.445 4.200 20 0 DIADLO c1cn(-c2cccc(NCc3nccc4ccccc43)c2)c[nH+]1 ZINC001461331093 1063424223 /nfs/dbraw/zinc/42/42/23/1063424223.db2.gz IWFYIWAXLBDHBW-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO C[C@H]1Cc2cc(CNc3ccc([NH+]4CCCC4)cc3)ccc2O1 ZINC001461331770 1063424564 /nfs/dbraw/zinc/42/45/64/1063424564.db2.gz LHLHXPXWTYWVFA-HNNXBMFYSA-N 1 2 308.425 4.222 20 0 DIADLO Cc1cc(CNc2cccc(-n3ccnc3)c2)c2c([nH+]1)CCCC2 ZINC001461333365 1063424644 /nfs/dbraw/zinc/42/46/44/1063424644.db2.gz UPVAKPOBGTVDCS-UHFFFAOYSA-N 1 2 318.424 4.067 20 0 DIADLO Cc1cc(CNc2ccn([C@H](C)c3ccccc3)n2)cc(C)[nH+]1 ZINC001461331852 1063424775 /nfs/dbraw/zinc/42/47/75/1063424775.db2.gz JFTBEJBWPQLBKV-MRXNPFEDSA-N 1 2 306.413 4.116 20 0 DIADLO C[C@@H]1Cc2cc(CNc3ccc([NH+]4CCCC4)cc3)ccc2O1 ZINC001461331775 1063425273 /nfs/dbraw/zinc/42/52/73/1063425273.db2.gz LHLHXPXWTYWVFA-OAHLLOKOSA-N 1 2 308.425 4.222 20 0 DIADLO CCCn1nc(C)c(CNc2ccc([NH+]3CCCC3)cc2)c1C ZINC001461333980 1063426396 /nfs/dbraw/zinc/42/63/96/1063426396.db2.gz TXQKHJOBRYCFEW-UHFFFAOYSA-N 1 2 312.461 4.122 20 0 DIADLO C[N@@H+](Cc1c(Cl)cccc1Cl)C[C@H]1CCC(C)(C)O1 ZINC001473125299 1063428744 /nfs/dbraw/zinc/42/87/44/1063428744.db2.gz WYZAERXBNCRYQL-LLVKDONJSA-N 1 2 302.245 4.383 20 0 DIADLO C[N@H+](Cc1c(Cl)cccc1Cl)C[C@H]1CCC(C)(C)O1 ZINC001473125299 1063428759 /nfs/dbraw/zinc/42/87/59/1063428759.db2.gz WYZAERXBNCRYQL-LLVKDONJSA-N 1 2 302.245 4.383 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+](C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC001473128935 1063434424 /nfs/dbraw/zinc/43/44/24/1063434424.db2.gz YQOYWFXJGWSRRV-MNOVXSKESA-N 1 2 318.244 4.328 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+](C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC001473128935 1063434439 /nfs/dbraw/zinc/43/44/39/1063434439.db2.gz YQOYWFXJGWSRRV-MNOVXSKESA-N 1 2 318.244 4.328 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@H+](C)CCC1CCCCC1 ZINC001473137148 1063443481 /nfs/dbraw/zinc/44/34/81/1063443481.db2.gz LNGOYQVYZPXGRK-QGZVFWFLSA-N 1 2 323.864 4.456 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+](C)CCC1CCCCC1 ZINC001473137148 1063443490 /nfs/dbraw/zinc/44/34/90/1063443490.db2.gz LNGOYQVYZPXGRK-QGZVFWFLSA-N 1 2 323.864 4.456 20 0 DIADLO Clc1cscc1CNc1ccc(N2CCCCC2)[nH+]c1 ZINC001461373853 1063455725 /nfs/dbraw/zinc/45/57/25/1063455725.db2.gz VBNVILFKZSBULB-UHFFFAOYSA-N 1 2 307.850 4.399 20 0 DIADLO Cc1cc(CNc2ccn(-c3ccccc3Cl)n2)cc(C)[nH+]1 ZINC001461384366 1063464864 /nfs/dbraw/zinc/46/48/64/1063464864.db2.gz WJLLBADLXWFLBQ-UHFFFAOYSA-N 1 2 312.804 4.150 20 0 DIADLO CC(C)C[C@@H](C)C[C@H](C)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258070325 1063496258 /nfs/dbraw/zinc/49/62/58/1063496258.db2.gz PBOVWWLTAPSCDT-OLZOCXBDSA-N 1 2 317.399 4.178 20 0 DIADLO CC(C)C[C@@H](C)C[C@H](C)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258070325 1063496279 /nfs/dbraw/zinc/49/62/79/1063496279.db2.gz PBOVWWLTAPSCDT-OLZOCXBDSA-N 1 2 317.399 4.178 20 0 DIADLO CCc1ccc(NCc2cc(C)[nH+]c3c2CCCC3)cc1OC ZINC001461511474 1063544946 /nfs/dbraw/zinc/54/49/46/1063544946.db2.gz DAQCOZSUIZKWHN-UHFFFAOYSA-N 1 2 310.441 4.452 20 0 DIADLO C[C@H](Cc1ccco1)[N@@H+]1CC[C@H](c2ccccc2)C(F)(F)C1 ZINC001258197765 1063558008 /nfs/dbraw/zinc/55/80/08/1063558008.db2.gz QXAPKUIPBJFQJF-RHSMWYFYSA-N 1 2 305.368 4.335 20 0 DIADLO C[C@H](Cc1ccco1)[N@H+]1CC[C@H](c2ccccc2)C(F)(F)C1 ZINC001258197765 1063558024 /nfs/dbraw/zinc/55/80/24/1063558024.db2.gz QXAPKUIPBJFQJF-RHSMWYFYSA-N 1 2 305.368 4.335 20 0 DIADLO CCCn1c(C[NH2+][C@H]2C[C@]2(F)c2ccccc2)nc2ccccc21 ZINC001461594792 1063601808 /nfs/dbraw/zinc/60/18/08/1063601808.db2.gz QDGLEKUZRKSIKS-ICSRJNTNSA-N 1 2 323.415 4.173 20 0 DIADLO COc1ccc(CNc2cc3cc[nH]c3c[nH+]2)c2ccccc12 ZINC001461604747 1063608022 /nfs/dbraw/zinc/60/80/22/1063608022.db2.gz GZXXXYDVTQFDDC-UHFFFAOYSA-N 1 2 303.365 4.337 20 0 DIADLO Cc1cc(C)c(C[NH2+]C[C@@H]2CC[N@@H+]2C2CCCCC2)c(C)c1 ZINC001461645169 1063632077 /nfs/dbraw/zinc/63/20/77/1063632077.db2.gz JZFUDRLLBIAALQ-IBGZPJMESA-N 1 2 300.490 4.108 20 0 DIADLO Cc1cc(C)c(C[NH2+]C[C@@H]2CC[N@H+]2C2CCCCC2)c(C)c1 ZINC001461645169 1063632083 /nfs/dbraw/zinc/63/20/83/1063632083.db2.gz JZFUDRLLBIAALQ-IBGZPJMESA-N 1 2 300.490 4.108 20 0 DIADLO COCc1ccc(CNc2ccc(Nc3ccccc3)c[nH+]2)o1 ZINC001461645962 1063632327 /nfs/dbraw/zinc/63/23/27/1063632327.db2.gz CNXDYCDCNCVTNN-UHFFFAOYSA-N 1 2 309.369 4.177 20 0 DIADLO CCCCC[C@H](CC)[N@@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001258441303 1063657467 /nfs/dbraw/zinc/65/74/67/1063657467.db2.gz HYBWSUPOQQBDAR-HOTGVXAUSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCC[C@H](CC)[N@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001258441303 1063657474 /nfs/dbraw/zinc/65/74/74/1063657474.db2.gz HYBWSUPOQQBDAR-HOTGVXAUSA-N 1 2 307.482 4.155 20 0 DIADLO C[C@H]1CCc2nc(C[NH2+]Cc3ccc(C(C)(C)C)o3)sc2C1 ZINC001461696537 1063662405 /nfs/dbraw/zinc/66/24/05/1063662405.db2.gz CBGASXBJUNKIDU-LBPRGKRZSA-N 1 2 318.486 4.448 20 0 DIADLO CCCC1CCC([N@@H+]2CCn3c(COCC)cnc3[C@@H]2C)CC1 ZINC001258532370 1063685644 /nfs/dbraw/zinc/68/56/44/1063685644.db2.gz XIWZQDMRYGAAGS-GTPINHCMSA-N 1 2 319.493 4.155 20 0 DIADLO CCCC1CCC([N@H+]2CCn3c(COCC)cnc3[C@@H]2C)CC1 ZINC001258532370 1063685649 /nfs/dbraw/zinc/68/56/49/1063685649.db2.gz XIWZQDMRYGAAGS-GTPINHCMSA-N 1 2 319.493 4.155 20 0 DIADLO C/C(=C/c1ccccc1Cl)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC001461749695 1063693269 /nfs/dbraw/zinc/69/32/69/1063693269.db2.gz XUORCZSDCISEAY-BENRWUELSA-N 1 2 311.772 4.030 20 0 DIADLO Cc1cc(C[NH2+][C@H]2c3ccccc3OC[C@@H]2F)ccc1Cl ZINC001461755233 1063697503 /nfs/dbraw/zinc/69/75/03/1063697503.db2.gz RITAKNHPSOOJEJ-RDJZCZTQSA-N 1 2 305.780 4.210 20 0 DIADLO CCC[C@H](Cc1ccccc1)[NH2+][C@@H](CC(C)(C)F)C(=O)OCC ZINC001258652221 1063724485 /nfs/dbraw/zinc/72/44/85/1063724485.db2.gz QDYLHJMKUUJQNR-SJORKVTESA-N 1 2 323.452 4.057 20 0 DIADLO CCCCC[C@@H](CCC)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258670530 1063737014 /nfs/dbraw/zinc/73/70/14/1063737014.db2.gz CJTJINSKNHKNNW-CYBMUJFWSA-N 1 2 317.399 4.467 20 0 DIADLO CCCCC[C@@H](CCC)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258670530 1063737025 /nfs/dbraw/zinc/73/70/25/1063737025.db2.gz CJTJINSKNHKNNW-CYBMUJFWSA-N 1 2 317.399 4.467 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1Cl)[N@@H+]1Cc2cccnc2C1 ZINC001258677856 1063744302 /nfs/dbraw/zinc/74/43/02/1063744302.db2.gz IRFVYQXAXJMGTN-NSHDSACASA-N 1 2 307.224 4.335 20 0 DIADLO C[C@@H](Cc1ccc(Cl)cc1Cl)[N@H+]1Cc2cccnc2C1 ZINC001258677856 1063744316 /nfs/dbraw/zinc/74/43/16/1063744316.db2.gz IRFVYQXAXJMGTN-NSHDSACASA-N 1 2 307.224 4.335 20 0 DIADLO Cn1c(C[N@@H+]2CCc3ccc(F)c(F)c3C2)cc2ccccc21 ZINC001461860714 1063753219 /nfs/dbraw/zinc/75/32/19/1063753219.db2.gz HNYQLTKSTLKLCU-UHFFFAOYSA-N 1 2 312.363 4.015 20 0 DIADLO Cn1c(C[N@H+]2CCc3ccc(F)c(F)c3C2)cc2ccccc21 ZINC001461860714 1063753230 /nfs/dbraw/zinc/75/32/30/1063753230.db2.gz HNYQLTKSTLKLCU-UHFFFAOYSA-N 1 2 312.363 4.015 20 0 DIADLO CC[N@H+](Cc1ccccc1C)Cc1cccnc1Br ZINC001461871563 1063763554 /nfs/dbraw/zinc/76/35/54/1063763554.db2.gz RFSPSPXNIOLOFA-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccccc1C)Cc1cccnc1Br ZINC001461871563 1063763567 /nfs/dbraw/zinc/76/35/67/1063763567.db2.gz RFSPSPXNIOLOFA-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC001461875493 1063766785 /nfs/dbraw/zinc/76/67/85/1063766785.db2.gz UVCDHUYSLHNGRY-QWHCGFSZSA-N 1 2 307.825 4.123 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC001461875493 1063766796 /nfs/dbraw/zinc/76/67/96/1063766796.db2.gz UVCDHUYSLHNGRY-QWHCGFSZSA-N 1 2 307.825 4.123 20 0 DIADLO CC(C)C1(C[N@@H+]2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)CC1 ZINC001461909296 1063791474 /nfs/dbraw/zinc/79/14/74/1063791474.db2.gz MMKVOBSWFOEFQY-MRXNPFEDSA-N 1 2 311.828 4.289 20 0 DIADLO CC(C)C1(C[N@H+]2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)CC1 ZINC001461909296 1063791486 /nfs/dbraw/zinc/79/14/86/1063791486.db2.gz MMKVOBSWFOEFQY-MRXNPFEDSA-N 1 2 311.828 4.289 20 0 DIADLO Fc1cccc([C@H]2C[N@H+](CCc3cccc(Cl)c3)CCO2)c1 ZINC001461907930 1063792054 /nfs/dbraw/zinc/79/20/54/1063792054.db2.gz IALLXKISFJWSPV-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1cccc([C@H]2C[N@@H+](CCc3cccc(Cl)c3)CCO2)c1 ZINC001461907930 1063792063 /nfs/dbraw/zinc/79/20/63/1063792063.db2.gz IALLXKISFJWSPV-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2ccc3c(c2)CCCC3)s1 ZINC001461911777 1063793047 /nfs/dbraw/zinc/79/30/47/1063793047.db2.gz IJHJUXNKPZQCQR-UHFFFAOYSA-N 1 2 300.471 4.216 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2ccc3c(c2)CCCC3)s1 ZINC001461911777 1063793035 /nfs/dbraw/zinc/79/30/35/1063793035.db2.gz IJHJUXNKPZQCQR-UHFFFAOYSA-N 1 2 300.471 4.216 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2[C@@H](C)Cc2cccc(Cl)c2)no1 ZINC001258750148 1063798306 /nfs/dbraw/zinc/79/83/06/1063798306.db2.gz PYHGDCALJYBRTG-BLLLJJGKSA-N 1 2 319.836 4.190 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2[C@@H](C)Cc2cccc(Cl)c2)no1 ZINC001258750148 1063798324 /nfs/dbraw/zinc/79/83/24/1063798324.db2.gz PYHGDCALJYBRTG-BLLLJJGKSA-N 1 2 319.836 4.190 20 0 DIADLO Cc1cccc(C[NH+]2CCN(c3ccccc3Cl)CC2)c1F ZINC001461921438 1063805367 /nfs/dbraw/zinc/80/53/67/1063805367.db2.gz IGVFGWJHIZHSTQ-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO C[C@H]1c2c(F)cccc2CC[N@H+]1Cc1ccnn1-c1ccccc1 ZINC001461959511 1063843053 /nfs/dbraw/zinc/84/30/53/1063843053.db2.gz IFZHGAITVNURTM-HNNXBMFYSA-N 1 2 321.399 4.131 20 0 DIADLO C[C@H]1c2c(F)cccc2CC[N@@H+]1Cc1ccnn1-c1ccccc1 ZINC001461959511 1063843072 /nfs/dbraw/zinc/84/30/72/1063843072.db2.gz IFZHGAITVNURTM-HNNXBMFYSA-N 1 2 321.399 4.131 20 0 DIADLO CC[C@@H]1C[N@H+](CCCc2c(Cl)cccc2Cl)C[C@H](C)O1 ZINC001461985165 1063858192 /nfs/dbraw/zinc/85/81/92/1063858192.db2.gz DRLLGBRHTFPPHG-QWHCGFSZSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@@H]1C[N@@H+](CCCc2c(Cl)cccc2Cl)C[C@H](C)O1 ZINC001461985165 1063858204 /nfs/dbraw/zinc/85/82/04/1063858204.db2.gz DRLLGBRHTFPPHG-QWHCGFSZSA-N 1 2 316.272 4.425 20 0 DIADLO C[C@@H](CCc1ccc(F)cc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001461986889 1063859285 /nfs/dbraw/zinc/85/92/85/1063859285.db2.gz DTSMMNGPUKYXGO-HNNXBMFYSA-N 1 2 309.388 4.445 20 0 DIADLO CC(C)c1cccc(CN2CC[NH+](Cc3ccsc3)CC2)c1 ZINC001462012014 1063878691 /nfs/dbraw/zinc/87/86/91/1063878691.db2.gz ZTPGMMDQIWBLAE-UHFFFAOYSA-N 1 2 314.498 4.189 20 0 DIADLO c1coc(C[NH+](Cc2ccco2)Cc2ccc3c(c2)CCCO3)c1 ZINC001462016508 1063880056 /nfs/dbraw/zinc/88/00/56/1063880056.db2.gz CSTUIPACWGNCIH-UHFFFAOYSA-N 1 2 323.392 4.400 20 0 DIADLO Cc1ccccc1OCC[N@@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC001462026642 1063890073 /nfs/dbraw/zinc/89/00/73/1063890073.db2.gz ORLVFJUNCPLMNI-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO Cc1ccccc1OCC[N@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC001462026642 1063890086 /nfs/dbraw/zinc/89/00/86/1063890086.db2.gz ORLVFJUNCPLMNI-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO COc1ccc([C@H](C)SCc2cc[nH+]c(N(C)C)c2)cc1 ZINC001307292651 1063892333 /nfs/dbraw/zinc/89/23/33/1063892333.db2.gz IERHLFIWQQVPTM-ZDUSSCGKSA-N 1 2 302.443 4.151 20 0 DIADLO CCc1cnc(C[N@H+](Cc2ccc(CC)cc2)C2CC2)s1 ZINC001462046150 1063900153 /nfs/dbraw/zinc/90/01/53/1063900153.db2.gz TXTRTHALMPNONA-UHFFFAOYSA-N 1 2 300.471 4.433 20 0 DIADLO CCc1cnc(C[N@@H+](Cc2ccc(CC)cc2)C2CC2)s1 ZINC001462046150 1063900162 /nfs/dbraw/zinc/90/01/62/1063900162.db2.gz TXTRTHALMPNONA-UHFFFAOYSA-N 1 2 300.471 4.433 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC(Nc3ccccc3)CC2)c1 ZINC001261452238 1063926712 /nfs/dbraw/zinc/92/67/12/1063926712.db2.gz XSLPKBDMYILHGC-UHFFFAOYSA-N 1 2 321.399 4.455 20 0 DIADLO CC(C)Oc1ccc[nH+]c1N[C@H]1CCc2cccc(Cl)c2C1 ZINC001462101099 1063929240 /nfs/dbraw/zinc/92/92/40/1063929240.db2.gz CNTIXJOBLILPCJ-AWEZNQCLSA-N 1 2 316.832 4.492 20 0 DIADLO CC[C@H](CC(F)F)C[N@@H+]1CCO[C@@H](c2ccc(Cl)s2)C1 ZINC001261638379 1063940114 /nfs/dbraw/zinc/94/01/14/1063940114.db2.gz ZQJZVROLXDQPSV-GHMZBOCLSA-N 1 2 323.836 4.456 20 0 DIADLO CC[C@H](CC(F)F)C[N@H+]1CCO[C@@H](c2ccc(Cl)s2)C1 ZINC001261638379 1063940125 /nfs/dbraw/zinc/94/01/25/1063940125.db2.gz ZQJZVROLXDQPSV-GHMZBOCLSA-N 1 2 323.836 4.456 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2cc(Cl)cc3ccccc32)o1 ZINC001262258847 1063961851 /nfs/dbraw/zinc/96/18/51/1063961851.db2.gz UNWKCZNQHHHTRL-JTQLQIEISA-N 1 2 301.777 4.035 20 0 DIADLO Cc1cnc(C2CC[NH+](Cc3nc(C(C)(C)C)co3)CC2)s1 ZINC001262366686 1063965591 /nfs/dbraw/zinc/96/55/91/1063965591.db2.gz RFLRXFVNINZHML-UHFFFAOYSA-N 1 2 319.474 4.117 20 0 DIADLO CSCC1CCC(Nc2cccc(-n3cc[nH+]c3)c2)CC1 ZINC000385455737 1064017359 /nfs/dbraw/zinc/01/73/59/1064017359.db2.gz UTPIGULWWSPRIF-UHFFFAOYSA-N 1 2 301.459 4.206 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccccc2[nH]1)c1nc2ccccc2s1 ZINC000386398640 1064050610 /nfs/dbraw/zinc/05/06/10/1064050610.db2.gz KPAUFHSPHMJTRW-LLVKDONJSA-N 1 2 308.410 4.023 20 0 DIADLO Nc1ccc(F)c(F)c1Nc1ccc([NH+]2CCCCC2)cc1 ZINC000388197528 1064101211 /nfs/dbraw/zinc/10/12/11/1064101211.db2.gz ODAUSMGJMRNQBQ-UHFFFAOYSA-N 1 2 303.356 4.281 20 0 DIADLO CCCc1ccccc1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001264605823 1064115160 /nfs/dbraw/zinc/11/51/60/1064115160.db2.gz UNYRGAQGNVHLIZ-UHFFFAOYSA-N 1 2 305.381 4.077 20 0 DIADLO CC1(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)CCCCCC1 ZINC001264719774 1064123966 /nfs/dbraw/zinc/12/39/66/1064123966.db2.gz NBDGEPZHEUHLBL-UHFFFAOYSA-N 1 2 315.392 4.310 20 0 DIADLO Cc1cn2cc(NC(=O)c3cccc(C(C)(C)C)c3)ccc2[nH+]1 ZINC001264857569 1064151815 /nfs/dbraw/zinc/15/18/15/1064151815.db2.gz ADLIDMVVIXXRPL-UHFFFAOYSA-N 1 2 307.397 4.193 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H]3CCC[C@H]4CCCC[C@H]43)ccc2[nH+]1 ZINC001264857946 1064151967 /nfs/dbraw/zinc/15/19/67/1064151967.db2.gz NWQSICWCYDOWIX-DJIMGWMZSA-N 1 2 311.429 4.188 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@H](c3ccccc3)[C@H](C)C2)c(C)[nH+]1 ZINC001265476309 1064234156 /nfs/dbraw/zinc/23/41/56/1064234156.db2.gz ZOCYBZDNEVVFBA-BEFAXECRSA-N 1 2 322.452 4.273 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ccc(Br)c(F)c2F)[C@@H]1C ZINC000701299013 1064246451 /nfs/dbraw/zinc/24/64/51/1064246451.db2.gz IZZVTNRIOAQABQ-NXEZZACHSA-N 1 2 318.205 4.348 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ccc(Br)c(F)c2F)[C@@H]1C ZINC000701299013 1064246456 /nfs/dbraw/zinc/24/64/56/1064246456.db2.gz IZZVTNRIOAQABQ-NXEZZACHSA-N 1 2 318.205 4.348 20 0 DIADLO c1ccc(C[NH2+]Cc2nc(-c3ccc4ccccc4c3)no2)cc1 ZINC000701360985 1064248951 /nfs/dbraw/zinc/24/89/51/1064248951.db2.gz ZBCMQVHAMVBJMK-UHFFFAOYSA-N 1 2 315.376 4.180 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)c2c(F)cccc2Cl)c(C)[nH+]1 ZINC001265762602 1064270703 /nfs/dbraw/zinc/27/07/03/1064270703.db2.gz YLCCDQNMWKRPQS-GFCCVEGCSA-N 1 2 320.795 4.290 20 0 DIADLO Cc1cccc([C@H](C)Nc2[nH+]cnc3c2cnn3C(C)(C)C)c1 ZINC000829561047 1064726843 /nfs/dbraw/zinc/72/68/43/1064726843.db2.gz RFLSMORBRHRADH-ZDUSSCGKSA-N 1 2 309.417 4.063 20 0 DIADLO Cc1ccc(C[C@@H](C)Nc2nc(C)[nH+]c3c2CCCC3)s1 ZINC001306974057 1064729618 /nfs/dbraw/zinc/72/96/18/1064729618.db2.gz FJUMLEXBBBCCBK-LLVKDONJSA-N 1 2 301.459 4.077 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1 ZINC001305934059 1065168076 /nfs/dbraw/zinc/16/80/76/1065168076.db2.gz NRYRAKCYDDXEPK-MRXNPFEDSA-N 1 2 319.493 4.187 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C[C@H](C)c1ccco1 ZINC001306837604 1065195486 /nfs/dbraw/zinc/19/54/86/1065195486.db2.gz JVFMRMZCRXPRKI-ZDUSSCGKSA-N 1 2 309.369 4.110 20 0 DIADLO Cc1cc(NCCc2nc3ccccc3s2)nc(C2CCC2)[nH+]1 ZINC001306920416 1065205107 /nfs/dbraw/zinc/20/51/07/1065205107.db2.gz NUKILSXNVFFYHV-UHFFFAOYSA-N 1 2 324.453 4.317 20 0 DIADLO CCc1cccc2c1OCC[C@@H]2Nc1nc(C)[nH+]c2c1CCCC2 ZINC001306952245 1065219092 /nfs/dbraw/zinc/21/90/92/1065219092.db2.gz COCYPOXNWOGPBO-SFHVURJKSA-N 1 2 323.440 4.162 20 0 DIADLO CCc1cc(N2CCC[C@@H]2Cc2ccccc2C)nc(CC)[nH+]1 ZINC001306971571 1065228500 /nfs/dbraw/zinc/22/85/00/1065228500.db2.gz KMQDJZWAPDILMS-GOSISDBHSA-N 1 2 309.457 4.121 20 0 DIADLO CCO[C@@H]1C[C@H](N(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)C1(C)C ZINC001306976282 1065231804 /nfs/dbraw/zinc/23/18/04/1065231804.db2.gz LZLKBUHFSYEPFC-JKSUJKDBSA-N 1 2 319.493 4.363 20 0 DIADLO Cc1nc(N2CC[C@H](Cc3ccccc3)[C@H]2C)c2c([nH+]1)CCCC2 ZINC001306988362 1065237189 /nfs/dbraw/zinc/23/71/89/1065237189.db2.gz BOAGEGPBIQDXDV-CRAIPNDOSA-N 1 2 321.468 4.121 20 0 DIADLO Cc1cc(NCCc2c(F)cccc2Cl)nc(C2CC2)[nH+]1 ZINC001306992175 1065239760 /nfs/dbraw/zinc/23/97/60/1065239760.db2.gz WCAZGMWTMRTOPN-UHFFFAOYSA-N 1 2 305.784 4.110 20 0 DIADLO Cc1cc(NCC2(c3ccc(F)cc3F)CC2)nc(C2CC2)[nH+]1 ZINC001307071987 1065249420 /nfs/dbraw/zinc/24/94/20/1065249420.db2.gz JIMJGEJAOWQADN-UHFFFAOYSA-N 1 2 315.367 4.084 20 0 DIADLO C/C(=C/c1ccccc1)CN(C)c1nc(C)[nH+]c2c1CCCC2 ZINC001307096886 1065261655 /nfs/dbraw/zinc/26/16/55/1065261655.db2.gz YMDHBCUTLLNDHV-SQFISAMPSA-N 1 2 307.441 4.204 20 0 DIADLO Cc1cc(Cl)nc(CNc2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC001307099786 1065262887 /nfs/dbraw/zinc/26/28/87/1065262887.db2.gz LBKXPLWMTWCRHX-UHFFFAOYSA-N 1 2 302.809 4.021 20 0 DIADLO CCc1cc(NCCCc2cccc(Cl)c2)nc(CC)[nH+]1 ZINC001307109515 1065267358 /nfs/dbraw/zinc/26/73/58/1065267358.db2.gz LQERZHNQOAZDHP-UHFFFAOYSA-N 1 2 303.837 4.300 20 0 DIADLO CCc1cc(N[C@@H]2CCCc3c(F)cc(F)cc32)nc(CC)[nH+]1 ZINC001307129197 1065276366 /nfs/dbraw/zinc/27/63/66/1065276366.db2.gz KQKWTROMOFTANS-MRXNPFEDSA-N 1 2 317.383 4.369 20 0 DIADLO CCc1cc(N(C)[C@H]2CCC[C@H]2c2ccccc2)nc(CC)[nH+]1 ZINC001307138015 1065279319 /nfs/dbraw/zinc/27/93/19/1065279319.db2.gz BVXGDSCRYWOBRS-ROUUACIJSA-N 1 2 309.457 4.374 20 0 DIADLO CC(C)c1cc(NCCCC(=O)OC(C)(C)C)nc(C(C)C)[nH+]1 ZINC001307150429 1065286144 /nfs/dbraw/zinc/28/61/44/1065286144.db2.gz JULFTFGLYXEXKA-UHFFFAOYSA-N 1 2 321.465 4.257 20 0 DIADLO CCc1cc(NCc2ccc3ncn(C(C)C)c3c2)nc(CC)[nH+]1 ZINC001307200961 1065300581 /nfs/dbraw/zinc/30/05/81/1065300581.db2.gz HQJWHDYWMGEYKI-UHFFFAOYSA-N 1 2 323.444 4.144 20 0 DIADLO CNc1cc(CNc2nc3cc(Cl)cc(Cl)c3o2)cc[nH+]1 ZINC001307214848 1065305383 /nfs/dbraw/zinc/30/53/83/1065305383.db2.gz VUZUYOJXEUHAFH-UHFFFAOYSA-N 1 2 323.183 4.183 20 0 DIADLO c1[nH+]c(SC[C@@H]2CCCC23CCOCC3)n2ccccc12 ZINC001307252967 1065314946 /nfs/dbraw/zinc/31/49/46/1065314946.db2.gz IXXDRPONUSWETG-AWEZNQCLSA-N 1 2 302.443 4.023 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)CC(C)(C)O1 ZINC001307436102 1065398114 /nfs/dbraw/zinc/39/81/14/1065398114.db2.gz XFYFCJFHDUHPAQ-LLVKDONJSA-N 1 2 302.245 4.035 20 0 DIADLO C[C@H]1C[N@H+](Cc2nsc3ccccc32)C[C@H](c2ccccc2)O1 ZINC001307428224 1065387613 /nfs/dbraw/zinc/38/76/13/1065387613.db2.gz OTEJQUSQSRVHFQ-KBXCAEBGSA-N 1 2 324.449 4.258 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nsc3ccccc32)C[C@H](c2ccccc2)O1 ZINC001307428224 1065387627 /nfs/dbraw/zinc/38/76/27/1065387627.db2.gz OTEJQUSQSRVHFQ-KBXCAEBGSA-N 1 2 324.449 4.258 20 0 DIADLO COCC[N@H+](Cc1scnc1Cl)Cc1ccc(C)cc1C ZINC001307436205 1065397050 /nfs/dbraw/zinc/39/70/50/1065397050.db2.gz YNYZSELXHSXZOY-UHFFFAOYSA-N 1 2 324.877 4.062 20 0 DIADLO COCC[N@@H+](Cc1scnc1Cl)Cc1ccc(C)cc1C ZINC001307436205 1065397068 /nfs/dbraw/zinc/39/70/68/1065397068.db2.gz YNYZSELXHSXZOY-UHFFFAOYSA-N 1 2 324.877 4.062 20 0 DIADLO C[C@@H]1C[N@H+](CCc2cccc(Cl)c2Cl)CC(C)(C)O1 ZINC001307436102 1065398109 /nfs/dbraw/zinc/39/81/09/1065398109.db2.gz XFYFCJFHDUHPAQ-LLVKDONJSA-N 1 2 302.245 4.035 20 0 DIADLO FC(F)C[N@H+](CCCc1ccc(C(F)(F)F)cc1)C1CC1 ZINC001307460123 1065413036 /nfs/dbraw/zinc/41/30/36/1065413036.db2.gz FKFVJBFLHVYUHX-UHFFFAOYSA-N 1 2 307.306 4.368 20 0 DIADLO FC(F)C[N@@H+](CCCc1ccc(C(F)(F)F)cc1)C1CC1 ZINC001307460123 1065413045 /nfs/dbraw/zinc/41/30/45/1065413045.db2.gz FKFVJBFLHVYUHX-UHFFFAOYSA-N 1 2 307.306 4.368 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ncc(Br)cc1Cl ZINC001307504513 1065446346 /nfs/dbraw/zinc/44/63/46/1065446346.db2.gz SACUVLQRZNQTEJ-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ncc(Br)cc1Cl ZINC001307504513 1065446353 /nfs/dbraw/zinc/44/63/53/1065446353.db2.gz SACUVLQRZNQTEJ-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2nc3c(o2)CCCC3)C1 ZINC001307502971 1065446821 /nfs/dbraw/zinc/44/68/21/1065446821.db2.gz ASCLCBZCPVIAOK-DYVFJYSZSA-N 1 2 314.404 4.276 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2nc3c(o2)CCCC3)C1 ZINC001307502971 1065446824 /nfs/dbraw/zinc/44/68/24/1065446824.db2.gz ASCLCBZCPVIAOK-DYVFJYSZSA-N 1 2 314.404 4.276 20 0 DIADLO CCCCCOc1ccc(Br)cc1Cn1cc[nH+]c1 ZINC001307538392 1065472286 /nfs/dbraw/zinc/47/22/86/1065472286.db2.gz GLFYIDWZQAZNJH-UHFFFAOYSA-N 1 2 323.234 4.263 20 0 DIADLO CC(C)(C)OC(=O)C1([NH2+]C[C@H]2CCCCC2(F)F)CCCC1 ZINC001307543551 1065475167 /nfs/dbraw/zinc/47/51/67/1065475167.db2.gz DOGYEXQCGPIGNU-CYBMUJFWSA-N 1 2 317.420 4.056 20 0 DIADLO CCOC(=O)[C@H](C)[N@H+](Cc1ccc(C(C)(C)CC)cc1)C1CC1 ZINC001307688151 1065563876 /nfs/dbraw/zinc/56/38/76/1065563876.db2.gz FPEWUYATNODMMZ-HNNXBMFYSA-N 1 2 317.473 4.290 20 0 DIADLO CCOC(=O)[C@H](C)[N@@H+](Cc1ccc(C(C)(C)CC)cc1)C1CC1 ZINC001307688151 1065563883 /nfs/dbraw/zinc/56/38/83/1065563883.db2.gz FPEWUYATNODMMZ-HNNXBMFYSA-N 1 2 317.473 4.290 20 0 DIADLO Clc1cc(C[N@@H+]2CCCC3(CC3)C2)ccc1Br ZINC001307711786 1065578511 /nfs/dbraw/zinc/57/85/11/1065578511.db2.gz CEYGDXMIUMQABP-UHFFFAOYSA-N 1 2 314.654 4.479 20 0 DIADLO Clc1cc(C[N@H+]2CCCC3(CC3)C2)ccc1Br ZINC001307711786 1065578522 /nfs/dbraw/zinc/57/85/22/1065578522.db2.gz CEYGDXMIUMQABP-UHFFFAOYSA-N 1 2 314.654 4.479 20 0 DIADLO C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+](C)CC(=O)OC(C)(C)C ZINC001307723523 1065586874 /nfs/dbraw/zinc/58/68/74/1065586874.db2.gz KEPZDRHVHOECTG-AWEZNQCLSA-N 1 2 305.462 4.319 20 0 DIADLO C[C@@H](c1ccc(C(C)(C)C)cc1)[N@@H+](C)CC(=O)OC(C)(C)C ZINC001307723523 1065586883 /nfs/dbraw/zinc/58/68/83/1065586883.db2.gz KEPZDRHVHOECTG-AWEZNQCLSA-N 1 2 305.462 4.319 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(C3CCCC3)cc2)C[C@@H](C)[S@]1=O ZINC001307758991 1065609591 /nfs/dbraw/zinc/60/95/91/1065609591.db2.gz DVLJTQFVUGVGEX-YIFZBPKDSA-N 1 2 319.514 4.076 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(C3CCCC3)cc2)C[C@@H](C)[S@]1=O ZINC001307758991 1065609596 /nfs/dbraw/zinc/60/95/96/1065609596.db2.gz DVLJTQFVUGVGEX-YIFZBPKDSA-N 1 2 319.514 4.076 20 0 DIADLO Cn1nc(C[N@@H+]2CC(C)(C)C[C@H]2c2ccccc2)cc1Cl ZINC001307863986 1065657973 /nfs/dbraw/zinc/65/79/73/1065657973.db2.gz XXYOUQYXYHYIKB-HNNXBMFYSA-N 1 2 303.837 4.047 20 0 DIADLO Cn1nc(C[N@H+]2CC(C)(C)C[C@H]2c2ccccc2)cc1Cl ZINC001307863986 1065657981 /nfs/dbraw/zinc/65/79/81/1065657981.db2.gz XXYOUQYXYHYIKB-HNNXBMFYSA-N 1 2 303.837 4.047 20 0 DIADLO CCCc1nc(C[N@@H+](Cc2ccc(C)cc2C)CC(C)C)no1 ZINC001307870428 1065663320 /nfs/dbraw/zinc/66/33/20/1065663320.db2.gz OPFAFLQRPJQPIT-UHFFFAOYSA-N 1 2 315.461 4.297 20 0 DIADLO CCCc1nc(C[N@H+](Cc2ccc(C)cc2C)CC(C)C)no1 ZINC001307870428 1065663329 /nfs/dbraw/zinc/66/33/29/1065663329.db2.gz OPFAFLQRPJQPIT-UHFFFAOYSA-N 1 2 315.461 4.297 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1c2ccccc2CC[N@@H+]1[C@H]1C=CCCC1 ZINC001307947579 1065695484 /nfs/dbraw/zinc/69/54/84/1065695484.db2.gz MLDPJHMTUSTESL-WMZOPIPTSA-N 1 2 313.441 4.036 20 0 DIADLO CC(C)(C)OC(=O)[C@@H]1c2ccccc2CC[N@H+]1[C@H]1C=CCCC1 ZINC001307947579 1065695488 /nfs/dbraw/zinc/69/54/88/1065695488.db2.gz MLDPJHMTUSTESL-WMZOPIPTSA-N 1 2 313.441 4.036 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCOc2ccc(O)cc2C1 ZINC001307953816 1065696617 /nfs/dbraw/zinc/69/66/17/1065696617.db2.gz DQJGDFFYTXOORF-KRWDZBQOSA-N 1 2 317.816 4.391 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CCOc2ccc(O)cc2C1 ZINC001307953816 1065696621 /nfs/dbraw/zinc/69/66/21/1065696621.db2.gz DQJGDFFYTXOORF-KRWDZBQOSA-N 1 2 317.816 4.391 20 0 DIADLO CCOC(=O)[C@H](CCc1ccccc1)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC001307964937 1065702687 /nfs/dbraw/zinc/70/26/87/1065702687.db2.gz PMAGGDAWMBXSSR-JXFKEZNVSA-N 1 2 323.436 4.128 20 0 DIADLO CCOC(=O)[C@H](CCc1ccccc1)[N@H+]1Cc2ccccc2[C@@H]1C ZINC001307964937 1065702704 /nfs/dbraw/zinc/70/27/04/1065702704.db2.gz PMAGGDAWMBXSSR-JXFKEZNVSA-N 1 2 323.436 4.128 20 0 DIADLO C[C@@H]1c2sccc2CC[N@H+]1Cc1cccc2c1OC(F)(F)O2 ZINC001308047084 1065740140 /nfs/dbraw/zinc/74/01/40/1065740140.db2.gz VGBVPLBQPIAFMW-SNVBAGLBSA-N 1 2 323.364 4.189 20 0 DIADLO C[C@@H]1c2sccc2CC[N@@H+]1Cc1cccc2c1OC(F)(F)O2 ZINC001308047084 1065740155 /nfs/dbraw/zinc/74/01/55/1065740155.db2.gz VGBVPLBQPIAFMW-SNVBAGLBSA-N 1 2 323.364 4.189 20 0 DIADLO C[C@H]1c2sccc2CC[N@H+]1Cc1cccc2c1OC(F)(F)O2 ZINC001308047082 1065740902 /nfs/dbraw/zinc/74/09/02/1065740902.db2.gz VGBVPLBQPIAFMW-JTQLQIEISA-N 1 2 323.364 4.189 20 0 DIADLO C[C@H]1c2sccc2CC[N@@H+]1Cc1cccc2c1OC(F)(F)O2 ZINC001308047082 1065740911 /nfs/dbraw/zinc/74/09/11/1065740911.db2.gz VGBVPLBQPIAFMW-JTQLQIEISA-N 1 2 323.364 4.189 20 0 DIADLO CC(C)c1ocnc1C[N@H+](Cc1cccc(F)c1)C1CCC1 ZINC001308090069 1065757410 /nfs/dbraw/zinc/75/74/10/1065757410.db2.gz KSCMDLGWWOMYNZ-UHFFFAOYSA-N 1 2 302.393 4.492 20 0 DIADLO CC(C)c1ocnc1C[N@@H+](Cc1cccc(F)c1)C1CCC1 ZINC001308090069 1065757421 /nfs/dbraw/zinc/75/74/21/1065757421.db2.gz KSCMDLGWWOMYNZ-UHFFFAOYSA-N 1 2 302.393 4.492 20 0 DIADLO CCC[C@H]([NH2+]Cc1csc(-c2ccccn2)n1)c1ccccn1 ZINC001308247778 1065852963 /nfs/dbraw/zinc/85/29/63/1065852963.db2.gz ADVHIJNMBQMZAV-HNNXBMFYSA-N 1 2 324.453 4.231 20 0 DIADLO Fc1ccc(C[NH2+]Cc2c(F)c(F)cc(F)c2F)cc1Cl ZINC001308302192 1065896117 /nfs/dbraw/zinc/89/61/17/1065896117.db2.gz VNYCOWPJHRTSIT-UHFFFAOYSA-N 1 2 321.676 4.325 20 0 DIADLO Cc1cc(CNc2cc(C(F)(F)F)ccc2N(C)C)cc(C)[nH+]1 ZINC001308308802 1065903280 /nfs/dbraw/zinc/90/32/80/1065903280.db2.gz GNZHFFJQLVQKLI-UHFFFAOYSA-N 1 2 323.362 4.395 20 0 DIADLO CO[C@H](C)c1cccc(NCc2cc(-n3cc[nH+]c3)cs2)c1 ZINC001308314728 1065908038 /nfs/dbraw/zinc/90/80/38/1065908038.db2.gz OEEKGMHATLGRAS-CYBMUJFWSA-N 1 2 313.426 4.253 20 0 DIADLO CC[C@@H]1CCC[C@@H](CNc2ccccc2C[NH+]2CCOCC2)C1 ZINC001308318227 1065909959 /nfs/dbraw/zinc/90/99/59/1065909959.db2.gz RMILRYFBOOFUPT-QZTJIDSGSA-N 1 2 316.489 4.147 20 0 DIADLO Cc1ccc(NCc2cccc(C)c2Br)c(C)[nH+]1 ZINC001308340442 1065924601 /nfs/dbraw/zinc/92/46/01/1065924601.db2.gz PNNIRILGZCNIHZ-UHFFFAOYSA-N 1 2 305.219 4.381 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+]Cc2cc(C(C)(C)C)oc2C)[nH]1 ZINC001308394461 1065960649 /nfs/dbraw/zinc/96/06/49/1065960649.db2.gz PONOZRHLCACGDM-NWDGAFQWSA-N 1 2 318.465 4.368 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1cccc(C(F)(F)F)n1 ZINC001308410496 1065970368 /nfs/dbraw/zinc/97/03/68/1065970368.db2.gz DNKYHSWJRZWRLH-UHFFFAOYSA-N 1 2 318.701 4.183 20 0 DIADLO C/C(=C/c1ccccc1C(F)(F)F)CNc1cc(CO)cc[nH+]1 ZINC001308442594 1065990311 /nfs/dbraw/zinc/99/03/11/1065990311.db2.gz LLDVVHRIUAVCPX-WQLSENKSSA-N 1 2 322.330 4.108 20 0 DIADLO C/C(=C\c1ccccc1C(F)(F)F)CNc1cc(CO)cc[nH+]1 ZINC001308442595 1065991079 /nfs/dbraw/zinc/99/10/79/1065991079.db2.gz LLDVVHRIUAVCPX-XYOKQWHBSA-N 1 2 322.330 4.108 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccc(OCCC(C)C)c(F)c1 ZINC001308451513 1065996892 /nfs/dbraw/zinc/99/68/92/1065996892.db2.gz WKXPPGAARVUMSU-UHFFFAOYSA-N 1 2 319.424 4.469 20 0 DIADLO Cc1cc(CNc2c[nH+]cc3c2CCCC3)cc2cccnc12 ZINC001308463301 1066004755 /nfs/dbraw/zinc/00/47/55/1066004755.db2.gz DTNVPHODLHUYFM-UHFFFAOYSA-N 1 2 303.409 4.429 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1nccc2c1CCCC2 ZINC001308499796 1066030307 /nfs/dbraw/zinc/03/03/07/1066030307.db2.gz KLNMONOSAXEDAC-UHFFFAOYSA-N 1 2 313.470 4.221 20 0 DIADLO Cn1c2ccccc2[nH+]c1NCc1ccc(CSC(F)F)o1 ZINC001308502436 1066032854 /nfs/dbraw/zinc/03/28/54/1066032854.db2.gz ZGLSFTWELURNJC-UHFFFAOYSA-N 1 2 323.368 4.234 20 0 DIADLO COc1cccc2[nH]c(NCc3c(C)oc4ccccc43)[nH+]c21 ZINC001308507658 1066036407 /nfs/dbraw/zinc/03/64/07/1066036407.db2.gz HJXPEEGKAPHPQJ-UHFFFAOYSA-N 1 2 307.353 4.238 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NC/C=C/c1ccc(F)cc1 ZINC001308550691 1066064546 /nfs/dbraw/zinc/06/45/46/1066064546.db2.gz BDFUCDOQDXZTSU-NSCUHMNNSA-N 1 2 315.779 4.491 20 0 DIADLO CC[N@H+](Cc1snc(OC)c1Cl)Cc1ccc(C)cc1 ZINC001308567432 1066078464 /nfs/dbraw/zinc/07/84/64/1066078464.db2.gz GATCCTKYRJNTFJ-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CC[N@@H+](Cc1snc(OC)c1Cl)Cc1ccc(C)cc1 ZINC001308567432 1066078477 /nfs/dbraw/zinc/07/84/77/1066078477.db2.gz GATCCTKYRJNTFJ-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CCc1cc(OC)ccc1C[N@@H+]1CCc2ccc(F)c(F)c2C1 ZINC001308569704 1066079803 /nfs/dbraw/zinc/07/98/03/1066079803.db2.gz JEUWKIIPWJDQGC-UHFFFAOYSA-N 1 2 317.379 4.094 20 0 DIADLO CCc1cc(OC)ccc1C[N@H+]1CCc2ccc(F)c(F)c2C1 ZINC001308569704 1066079818 /nfs/dbraw/zinc/07/98/18/1066079818.db2.gz JEUWKIIPWJDQGC-UHFFFAOYSA-N 1 2 317.379 4.094 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2c(Cl)c(C)nn2C)o1 ZINC001308578253 1066093786 /nfs/dbraw/zinc/09/37/86/1066093786.db2.gz NYRUPUILNVWROB-SMDDNHRTSA-N 1 2 321.852 4.257 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2c(Cl)c(C)nn2C)o1 ZINC001308578253 1066093796 /nfs/dbraw/zinc/09/37/96/1066093796.db2.gz NYRUPUILNVWROB-SMDDNHRTSA-N 1 2 321.852 4.257 20 0 DIADLO Oc1ccc([C@H]2CCC[N@@H+]2Cc2cncc(Cl)c2Cl)cc1 ZINC001308595994 1066107509 /nfs/dbraw/zinc/10/75/09/1066107509.db2.gz YDRYSGCLPPOZLK-OAHLLOKOSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@H]2CCC[N@H+]2Cc2cncc(Cl)c2Cl)cc1 ZINC001308595994 1066107511 /nfs/dbraw/zinc/10/75/11/1066107511.db2.gz YDRYSGCLPPOZLK-OAHLLOKOSA-N 1 2 323.223 4.431 20 0 DIADLO CC[C@@]1(C)CC[N@H+](Cc2cc(Br)cnc2Cl)C1 ZINC001308598067 1066108378 /nfs/dbraw/zinc/10/83/78/1066108378.db2.gz HXMSPCGSGJROOQ-ZDUSSCGKSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@@]1(C)CC[N@@H+](Cc2cc(Br)cnc2Cl)C1 ZINC001308598067 1066108384 /nfs/dbraw/zinc/10/83/84/1066108384.db2.gz HXMSPCGSGJROOQ-ZDUSSCGKSA-N 1 2 317.658 4.120 20 0 DIADLO CCc1cccc(F)c1C[N@@H+]1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC001308598252 1066108767 /nfs/dbraw/zinc/10/87/67/1066108767.db2.gz ISVDAVZAMFQSHO-SCLBCKFNSA-N 1 2 319.445 4.412 20 0 DIADLO CCc1cccc(F)c1C[N@H+]1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC001308598252 1066108773 /nfs/dbraw/zinc/10/87/73/1066108773.db2.gz ISVDAVZAMFQSHO-SCLBCKFNSA-N 1 2 319.445 4.412 20 0 DIADLO Fc1cc2[nH]c(C[NH+]3CCCCC3)cc2c(Br)c1 ZINC001308610451 1066116366 /nfs/dbraw/zinc/11/63/66/1066116366.db2.gz GNMPHXCZAPIFCY-UHFFFAOYSA-N 1 2 311.198 4.055 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cnc(CCc3ccccc3)s2)C[C@@H]1F ZINC001308642146 1066133631 /nfs/dbraw/zinc/13/36/31/1066133631.db2.gz OSAQFTUJWWULFR-PBHICJAKSA-N 1 2 318.461 4.108 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cnc(CCc3ccccc3)s2)C[C@@H]1F ZINC001308642146 1066133641 /nfs/dbraw/zinc/13/36/41/1066133641.db2.gz OSAQFTUJWWULFR-PBHICJAKSA-N 1 2 318.461 4.108 20 0 DIADLO Cc1cnc(C[N@@H+](C)[C@H](c2ccccc2)c2ccc(F)cc2)o1 ZINC001308659510 1066142267 /nfs/dbraw/zinc/14/22/67/1066142267.db2.gz WMMYTNSUANJZOR-LJQANCHMSA-N 1 2 310.372 4.344 20 0 DIADLO Cc1cnc(C[N@H+](C)[C@H](c2ccccc2)c2ccc(F)cc2)o1 ZINC001308659510 1066142269 /nfs/dbraw/zinc/14/22/69/1066142269.db2.gz WMMYTNSUANJZOR-LJQANCHMSA-N 1 2 310.372 4.344 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)cc(C)n1 ZINC001308662222 1066143986 /nfs/dbraw/zinc/14/39/86/1066143986.db2.gz GOQGPQAEIBMWLX-UHFFFAOYSA-N 1 2 302.368 4.141 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)cc(C)n1 ZINC001308662222 1066143988 /nfs/dbraw/zinc/14/39/88/1066143988.db2.gz GOQGPQAEIBMWLX-UHFFFAOYSA-N 1 2 302.368 4.141 20 0 DIADLO COc1ccc(C[N@H+](Cc2c(F)cc(C)cc2F)C2CC2)cc1 ZINC001308663074 1066144009 /nfs/dbraw/zinc/14/40/09/1066144009.db2.gz PUOKEEMBYLCPDN-UHFFFAOYSA-N 1 2 317.379 4.446 20 0 DIADLO COc1ccc(C[N@@H+](Cc2c(F)cc(C)cc2F)C2CC2)cc1 ZINC001308663074 1066144013 /nfs/dbraw/zinc/14/40/13/1066144013.db2.gz PUOKEEMBYLCPDN-UHFFFAOYSA-N 1 2 317.379 4.446 20 0 DIADLO Cc1nnc(C[NH2+]Cc2ccc(-c3ccccc3)c(C)c2)s1 ZINC001308707672 1066191039 /nfs/dbraw/zinc/19/10/39/1066191039.db2.gz ZXBWAPOHTFNQCA-UHFFFAOYSA-N 1 2 309.438 4.112 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1ccc(C3CCC3)cc1)CCO2 ZINC001308717045 1066194881 /nfs/dbraw/zinc/19/48/81/1066194881.db2.gz ZIMUUFYFJVDGLP-UHFFFAOYSA-N 1 2 311.400 4.488 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1ccc(C3CCC3)cc1)CCO2 ZINC001308717045 1066194883 /nfs/dbraw/zinc/19/48/83/1066194883.db2.gz ZIMUUFYFJVDGLP-UHFFFAOYSA-N 1 2 311.400 4.488 20 0 DIADLO Cc1ccc2[nH+]cc(CN3CCCc4cc(Cl)ccc43)n2c1 ZINC001308714990 1066195407 /nfs/dbraw/zinc/19/54/07/1066195407.db2.gz UAKBNUNWOHFWCI-UHFFFAOYSA-N 1 2 311.816 4.249 20 0 DIADLO Clc1ccc(C[NH+]2CC(Cc3ccccc3Cl)C2)nc1 ZINC001308748621 1066221717 /nfs/dbraw/zinc/22/17/17/1066221717.db2.gz ULWMEYNHPWJLJQ-UHFFFAOYSA-N 1 2 307.224 4.063 20 0 DIADLO CC(C)n1c[nH+]cc1CN1CC2(CCCC2)c2cccc(F)c21 ZINC001308748620 1066222408 /nfs/dbraw/zinc/22/24/08/1066222408.db2.gz UKVRLEPCDTUNIQ-UHFFFAOYSA-N 1 2 313.420 4.435 20 0 DIADLO CC(C)(C)CC[C@H]([NH2+]C1CC(C(F)F)C1)C(=O)OC(C)(C)C ZINC001308772577 1066246379 /nfs/dbraw/zinc/24/63/79/1066246379.db2.gz XGEHYXZHAPCIHL-BPCQOVAHSA-N 1 2 319.436 4.156 20 0 DIADLO Cc1[nH]nc(C[NH+]2CCC(Cc3ccc(C)c(C)c3)CC2)c1C ZINC001308799225 1066275620 /nfs/dbraw/zinc/27/56/20/1066275620.db2.gz ROJFUBPJSAOXOB-UHFFFAOYSA-N 1 2 311.473 4.098 20 0 DIADLO CCC1(c2ccccc2)C[NH+](Cc2nccn2-c2ccccc2)C1 ZINC001308809890 1066287086 /nfs/dbraw/zinc/28/70/86/1066287086.db2.gz RTTBMOUSBJIMQN-UHFFFAOYSA-N 1 2 317.436 4.036 20 0 DIADLO CC1(C)CCC[C@H](C[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC001308820989 1066296806 /nfs/dbraw/zinc/29/68/06/1066296806.db2.gz TUHUSUPQHMAFPK-GOEBONIOSA-N 1 2 304.482 4.232 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1ncc(C(C)(C)C)s1)C2 ZINC001308827224 1066304782 /nfs/dbraw/zinc/30/47/82/1066304782.db2.gz XQTCQTPWULUYSN-UHFFFAOYSA-N 1 2 300.471 4.307 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1ncc(C(C)(C)C)s1)C2 ZINC001308827224 1066304792 /nfs/dbraw/zinc/30/47/92/1066304792.db2.gz XQTCQTPWULUYSN-UHFFFAOYSA-N 1 2 300.471 4.307 20 0 DIADLO Fc1ccc(C[NH+]2CC(Cc3ccco3)C2)cc1C(F)(F)F ZINC001308866441 1066347049 /nfs/dbraw/zinc/34/70/49/1066347049.db2.gz TVQKOVDUFLGYSH-UHFFFAOYSA-N 1 2 313.294 4.112 20 0 DIADLO CO[C@@H](c1ccccc1)[C@H](C)[NH2+]CC(F)(F)c1ccc(F)cc1 ZINC001308880380 1066360401 /nfs/dbraw/zinc/36/04/01/1066360401.db2.gz LQJVZBIBXVKLRH-SUMWQHHRSA-N 1 2 323.358 4.283 20 0 DIADLO CO[C@H](c1ccccc1)[C@H](C)[NH2+]CC(F)(F)c1ccc(F)cc1 ZINC001308880379 1066360562 /nfs/dbraw/zinc/36/05/62/1066360562.db2.gz LQJVZBIBXVKLRH-GUYCJALGSA-N 1 2 323.358 4.283 20 0 DIADLO CC(C)COC(=O)[C@H](C)[NH2+][C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1 ZINC001308908088 1066386336 /nfs/dbraw/zinc/38/63/36/1066386336.db2.gz WGLWLOBMDSRIBT-PBWTXFEYSA-N 1 2 317.473 4.136 20 0 DIADLO CC[C@H](C)[C@@H](CNc1[nH+]c2ccccc2n1C(C)(C)C)OC ZINC001308989818 1066435571 /nfs/dbraw/zinc/43/55/71/1066435571.db2.gz LSNUUZSMTBMMEM-XJKSGUPXSA-N 1 2 303.450 4.264 20 0 DIADLO Cc1cc(NC(=O)N[C@@H](c2ccccc2)C2CCCC2)c(C)c[nH+]1 ZINC001310450607 1066525604 /nfs/dbraw/zinc/52/56/04/1066525604.db2.gz OEXAWOSRQYWCBD-IBGZPJMESA-N 1 2 323.440 4.173 20 0 DIADLO Cc1cc(NC(=O)N(C)C2CCC(C(C)(C)C)CC2)c(C)c[nH+]1 ZINC001310450889 1066525755 /nfs/dbraw/zinc/52/57/55/1066525755.db2.gz VCSWHWWSHOJEDD-UHFFFAOYSA-N 1 2 317.477 4.189 20 0 DIADLO CCCCN(C(=O)Nc1cc(C)[nH+]cc1C)C1CCCCC1 ZINC001310450483 1066525919 /nfs/dbraw/zinc/52/59/19/1066525919.db2.gz JSFRXHZAXMDLNE-UHFFFAOYSA-N 1 2 303.450 4.087 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2ccc(C(C)(C)C)o2)c(C)[nH+]1 ZINC001310833914 1066566256 /nfs/dbraw/zinc/56/62/56/1066566256.db2.gz FPILESBETACAEX-UHFFFAOYSA-N 1 2 315.417 4.219 20 0 DIADLO Cc1cc(C)c(CNC(=O)N(CC(C)(C)C)CC(C)(C)C)c[nH+]1 ZINC001312856986 1066870847 /nfs/dbraw/zinc/87/08/47/1066870847.db2.gz QDIZXRFDUBBTIR-UHFFFAOYSA-N 1 2 319.493 4.302 20 0 DIADLO CCC1(CC)CCCN(C(=O)NCc2cc(C)[nH+]c(C)c2)CC1 ZINC001312891532 1066878613 /nfs/dbraw/zinc/87/86/13/1066878613.db2.gz QHJRRPPMQYBZHZ-UHFFFAOYSA-N 1 2 317.477 4.200 20 0 DIADLO COc1cccc(C[NH2+][C@@H](C)c2csc(C(C)C)n2)c1OC ZINC000076900358 185052404 /nfs/dbraw/zinc/05/24/04/185052404.db2.gz UDIGOXCRBJPISH-LBPRGKRZSA-N 1 2 320.458 4.135 20 0 DIADLO CC(C)c1noc([C@H](C)[NH2+][C@@H](C)c2ccc3c(c2)CCCC3)n1 ZINC000079291089 185163460 /nfs/dbraw/zinc/16/34/60/185163460.db2.gz CNABWMNDTNFPQN-KBPBESRZSA-N 1 2 313.445 4.484 20 0 DIADLO FC(F)Sc1ccc(NCc2cn3ccccc3[nH+]2)cc1 ZINC000096954452 185393631 /nfs/dbraw/zinc/39/36/31/185393631.db2.gz KQZGWBKPUPOVOF-UHFFFAOYSA-N 1 2 305.353 4.261 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@H+](Cc3nnc(C(C)C)o3)CC2)c1 ZINC000092426896 185317424 /nfs/dbraw/zinc/31/74/24/185317424.db2.gz DFLWXGCRIDGEGI-UHFFFAOYSA-N 1 2 311.429 4.099 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@@H+](Cc3nnc(C(C)C)o3)CC2)c1 ZINC000092426896 185317425 /nfs/dbraw/zinc/31/74/25/185317425.db2.gz DFLWXGCRIDGEGI-UHFFFAOYSA-N 1 2 311.429 4.099 20 0 DIADLO c1c[nH+]c([C@H]2CCCCN2Cc2nc(-c3ccccc3)cs2)[nH]1 ZINC000092729165 185336429 /nfs/dbraw/zinc/33/64/29/185336429.db2.gz TWCKCHDAHCMRHA-MRXNPFEDSA-N 1 2 324.453 4.260 20 0 DIADLO C[C@H](c1ccc(F)c(Cl)c1)[N@H+](C)Cc1nccn1C(F)F ZINC000072766513 191227428 /nfs/dbraw/zinc/22/74/28/191227428.db2.gz UKSJFOLWZOXUPW-SECBINFHSA-N 1 2 317.742 4.264 20 0 DIADLO C[C@H](c1ccc(F)c(Cl)c1)[N@@H+](C)Cc1nccn1C(F)F ZINC000072766513 191227432 /nfs/dbraw/zinc/22/74/32/191227432.db2.gz UKSJFOLWZOXUPW-SECBINFHSA-N 1 2 317.742 4.264 20 0 DIADLO CC[C@H]([NH2+]Cc1ccc(C)o1)c1nc(C(F)(F)F)cs1 ZINC000072926708 191252643 /nfs/dbraw/zinc/25/26/43/191252643.db2.gz SYJIABPWJWJIRX-JTQLQIEISA-N 1 2 304.337 4.304 20 0 DIADLO Cc1ccc(-n2cc[nH+]c2)c(-c2nc(-c3ccc(F)cc3)no2)c1 ZINC000563775275 335008040 /nfs/dbraw/zinc/00/80/40/335008040.db2.gz YKGYPFYQQUMUEN-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1csc(-c2ccsc2)n1 ZINC000093236246 193219957 /nfs/dbraw/zinc/21/99/57/193219957.db2.gz OCFHDWRHLOVJRL-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1csc(-c2ccsc2)n1 ZINC000093236246 193219959 /nfs/dbraw/zinc/21/99/59/193219959.db2.gz OCFHDWRHLOVJRL-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO CC(C)(C)[C@@H]([NH2+]Cc1ccn[nH]1)c1cccc(C(F)(F)F)c1 ZINC000093969325 193332416 /nfs/dbraw/zinc/33/24/16/193332416.db2.gz YNDFCJSOEIWCMT-AWEZNQCLSA-N 1 2 311.351 4.306 20 0 DIADLO Cc1cccc2[nH+]c(CNc3ccccc3C(F)(F)F)cn21 ZINC000008415560 181555822 /nfs/dbraw/zinc/55/58/22/181555822.db2.gz INLSPGYCBHMPET-UHFFFAOYSA-N 1 2 305.303 4.274 20 0 DIADLO Cc1nc([C@H]([NH2+]CCCC(C)C)c2ccc(Cl)cc2)no1 ZINC000525864334 335032130 /nfs/dbraw/zinc/03/21/30/335032130.db2.gz JLOCNCNXZDVXHZ-OAHLLOKOSA-N 1 2 307.825 4.147 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2sccc2Br)o1 ZINC000043501893 183367222 /nfs/dbraw/zinc/36/72/22/183367222.db2.gz MCTZYVJNMVEZIL-UHFFFAOYSA-N 1 2 300.221 4.044 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2sccc2Br)o1 ZINC000043501893 183367224 /nfs/dbraw/zinc/36/72/24/183367224.db2.gz MCTZYVJNMVEZIL-UHFFFAOYSA-N 1 2 300.221 4.044 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2nc(C(C)(C)C)cs2)o1 ZINC000105498628 194107057 /nfs/dbraw/zinc/10/70/57/194107057.db2.gz FIZLJEBMUKKFBA-WCQYABFASA-N 1 2 304.459 4.447 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cccc4ccccc43)CCCC2)no1 ZINC000063511397 184284105 /nfs/dbraw/zinc/28/41/05/184284105.db2.gz MXWNTRJUIFDYTR-UHFFFAOYSA-N 1 2 307.397 4.090 20 0 DIADLO Brc1cscc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000289378326 532982001 /nfs/dbraw/zinc/98/20/01/532982001.db2.gz BORHVRALDHLRRN-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cscc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000289378326 532982006 /nfs/dbraw/zinc/98/20/06/532982006.db2.gz BORHVRALDHLRRN-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2noc(-c3ccsc3)n2)ccc1F ZINC000271682044 129947264 /nfs/dbraw/zinc/94/72/64/129947264.db2.gz BYFOIKRIXYXQGZ-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1noc(C[NH2+][C@@H](CC(C)(C)C)c2ccc(Cl)cc2)n1 ZINC000271751805 129956565 /nfs/dbraw/zinc/95/65/65/129956565.db2.gz FWAAKTXCYLJQKT-AWEZNQCLSA-N 1 2 307.825 4.299 20 0 DIADLO COc1cc(C)nc(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)c1 ZINC000272124207 130000722 /nfs/dbraw/zinc/00/07/22/130000722.db2.gz KNAZBVZGLFQWTP-NSHDSACASA-N 1 2 308.784 4.042 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H]2CCCOc3c(F)cccc32)cs1 ZINC000272672236 130051499 /nfs/dbraw/zinc/05/14/99/130051499.db2.gz TZJMVVMAYQSGIL-HZMBPMFUSA-N 1 2 306.406 4.155 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2nc(-c3ccccc3)oc2C)s1 ZINC000273253624 130100836 /nfs/dbraw/zinc/10/08/36/130100836.db2.gz COVVOSIGSKPGMB-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2csc(CCC(C)C)n2)s1 ZINC000273281977 130102837 /nfs/dbraw/zinc/10/28/37/130102837.db2.gz ISIIVWWABMOKFH-LBPRGKRZSA-N 1 2 309.504 4.347 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1ccc(Cl)s1 ZINC000273485753 130128277 /nfs/dbraw/zinc/12/82/77/130128277.db2.gz JBQFQXQKUOPGAB-VIFPVBQESA-N 1 2 313.854 4.323 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](CC)c2ccc(Cl)s2)n1 ZINC000273534317 130133308 /nfs/dbraw/zinc/13/33/08/130133308.db2.gz UKHVRGLVFSLBNZ-JTQLQIEISA-N 1 2 313.854 4.368 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](CC)c2ccc(Cl)s2)n1 ZINC000273534321 130134270 /nfs/dbraw/zinc/13/42/70/130134270.db2.gz UKHVRGLVFSLBNZ-SNVBAGLBSA-N 1 2 313.854 4.368 20 0 DIADLO CC[C@@H](Oc1ccccc1C)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000273971263 130193041 /nfs/dbraw/zinc/19/30/41/130193041.db2.gz QIEJXBDRXABTMA-MRXNPFEDSA-N 1 2 323.396 4.202 20 0 DIADLO CC[C@@H]([NH2+]Cc1cn2ccsc2n1)c1cccc(Cl)c1F ZINC000274048471 130200759 /nfs/dbraw/zinc/20/07/59/130200759.db2.gz KSIAGTASAHQHTF-CYBMUJFWSA-N 1 2 323.824 4.429 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2sc(C(C)C)nc2C)s1 ZINC000274146762 130210790 /nfs/dbraw/zinc/21/07/90/130210790.db2.gz DVPBUJHFPKAFEW-PSASIEDQSA-N 1 2 310.492 4.147 20 0 DIADLO CC(C)[N@H+](Cc1ccco1)Cc1nnc(-c2ccccc2)s1 ZINC000274344382 130226877 /nfs/dbraw/zinc/22/68/77/130226877.db2.gz VGWYWARVUQCPHQ-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)[N@@H+](Cc1ccco1)Cc1nnc(-c2ccccc2)s1 ZINC000274344382 130226878 /nfs/dbraw/zinc/22/68/78/130226878.db2.gz VGWYWARVUQCPHQ-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@H]2CCc3c2cccc3O)cs1 ZINC000274433862 130234082 /nfs/dbraw/zinc/23/40/82/130234082.db2.gz KLWYUFMAAUVPOV-RISCZKNCSA-N 1 2 302.443 4.310 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1cn(C)nc1C(F)F ZINC000274462947 130238520 /nfs/dbraw/zinc/23/85/20/130238520.db2.gz HVWBJNPWLZLPDG-JTQLQIEISA-N 1 2 313.779 4.204 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1cn(C)nc1C(F)F ZINC000274462947 130238521 /nfs/dbraw/zinc/23/85/21/130238521.db2.gz HVWBJNPWLZLPDG-JTQLQIEISA-N 1 2 313.779 4.204 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)c(F)c1)c1nc(C(F)(F)F)cs1 ZINC000274634503 130250261 /nfs/dbraw/zinc/25/02/61/130250261.db2.gz SBOYHSRCVSVGIL-SSDOTTSWSA-N 1 2 322.302 4.291 20 0 DIADLO Cc1nccnc1[C@@H](C)[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000275662897 130356370 /nfs/dbraw/zinc/35/63/70/130356370.db2.gz BNEHWVGZQGQXDR-LLVKDONJSA-N 1 2 322.239 4.432 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Oc2ccccc2)cc1)c1ncn(C)n1 ZINC000275709913 130369390 /nfs/dbraw/zinc/36/93/90/130369390.db2.gz LXQTZGVFRHNYJJ-LSDHHAIUSA-N 1 2 322.412 4.019 20 0 DIADLO Cc1coc(C)c1C(=O)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1 ZINC000283265822 130976218 /nfs/dbraw/zinc/97/62/18/130976218.db2.gz COXUCXYUKIHOIZ-UHFFFAOYSA-N 1 2 309.369 4.293 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c(C)s1 ZINC000340183820 131014729 /nfs/dbraw/zinc/01/47/29/131014729.db2.gz GXOOIPCAXSRCNK-KRWDZBQOSA-N 1 2 323.408 4.217 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@H](c3ccc(F)c(F)c3)C2)c(C)s1 ZINC000340183820 131014731 /nfs/dbraw/zinc/01/47/31/131014731.db2.gz GXOOIPCAXSRCNK-KRWDZBQOSA-N 1 2 323.408 4.217 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cccc(COCC4CC4)c3)cn2c1 ZINC000283956224 131036170 /nfs/dbraw/zinc/03/61/70/131036170.db2.gz MUKBMCAWJOIIIR-UHFFFAOYSA-N 1 2 321.424 4.181 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccc(OCC3CC3)c(F)c2)no1 ZINC000284023610 131042065 /nfs/dbraw/zinc/04/20/65/131042065.db2.gz IWSCGOIWCWNECI-OLZOCXBDSA-N 1 2 318.392 4.323 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2OC2CCCC2)no1 ZINC000284212085 131059160 /nfs/dbraw/zinc/05/91/60/131059160.db2.gz SSUDKFVZEQDARP-CQSZACIVSA-N 1 2 300.402 4.155 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2nnc(C)s2)cc1 ZINC000284329934 131070695 /nfs/dbraw/zinc/07/06/95/131070695.db2.gz MGKDHOQBORFWPG-STQMWFEESA-N 1 2 319.474 4.437 20 0 DIADLO Cc1nc(COc2ccc(-c3[nH+]cc4n3CCCC4)cc2)oc1C ZINC000284469314 131083682 /nfs/dbraw/zinc/08/36/82/131083682.db2.gz RDLIMJDVMSKZQO-UHFFFAOYSA-N 1 2 323.396 4.070 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCSc2ccc(F)cc21)c1c(F)cncc1F ZINC000285497264 131174508 /nfs/dbraw/zinc/17/45/08/131174508.db2.gz ACUJREYDPHBJIX-OTYXRUKQSA-N 1 2 324.371 4.387 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1cc(F)ccc1F ZINC000285626477 131188168 /nfs/dbraw/zinc/18/81/68/131188168.db2.gz KEPLQQFGAWDBBA-RFAUZJTJSA-N 1 2 312.310 4.440 20 0 DIADLO CCCCc1nc(C[NH2+]C(C)(C)c2c(C)noc2C)cs1 ZINC000285647230 131190185 /nfs/dbraw/zinc/19/01/85/131190185.db2.gz MAQHFRJJCFJGKQ-UHFFFAOYSA-N 1 2 307.463 4.115 20 0 DIADLO COc1ccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)cc1OC ZINC000285897732 131208024 /nfs/dbraw/zinc/20/80/24/131208024.db2.gz BDWOFUDTCUSJHB-QGZVFWFLSA-N 1 2 315.417 4.160 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+]Cc2cc(F)ccc2Br)c1 ZINC000286087124 131218845 /nfs/dbraw/zinc/21/88/45/131218845.db2.gz MOFQXBARUUWKJE-NSHDSACASA-N 1 2 323.209 4.142 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000286681169 131246038 /nfs/dbraw/zinc/24/60/38/131246038.db2.gz CHKWIVPDNPIAMW-GWCFXTLKSA-N 1 2 303.431 4.153 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000286681169 131246039 /nfs/dbraw/zinc/24/60/39/131246039.db2.gz CHKWIVPDNPIAMW-GWCFXTLKSA-N 1 2 303.431 4.153 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000286681175 131246522 /nfs/dbraw/zinc/24/65/22/131246522.db2.gz CHKWIVPDNPIAMW-MFKMUULPSA-N 1 2 303.431 4.153 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000286681175 131246523 /nfs/dbraw/zinc/24/65/23/131246523.db2.gz CHKWIVPDNPIAMW-MFKMUULPSA-N 1 2 303.431 4.153 20 0 DIADLO CSc1ccccc1[C@H](C)NC(=O)Nc1c(C)cc[nH+]c1C ZINC000286974362 131258597 /nfs/dbraw/zinc/25/85/97/131258597.db2.gz BKGJQHVTIXSSPJ-LBPRGKRZSA-N 1 2 315.442 4.303 20 0 DIADLO CSc1ccc([C@H](C)NC(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000286979831 131258700 /nfs/dbraw/zinc/25/87/00/131258700.db2.gz BTFQYYPMCGNZBP-LBPRGKRZSA-N 1 2 315.442 4.303 20 0 DIADLO Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)Nc2c(C)cc[nH+]c2C)C1 ZINC000286979863 131259015 /nfs/dbraw/zinc/25/90/15/131259015.db2.gz BTPQDVXIPUMPCS-NVXWUHKLSA-N 1 2 323.440 4.417 20 0 DIADLO Fc1ccc2cc[nH+]c(N3CCc4[nH]c5ccccc5c4C3)c2c1 ZINC000340253130 131276942 /nfs/dbraw/zinc/27/69/42/131276942.db2.gz HJZSCEDJKKJAIN-UHFFFAOYSA-N 1 2 317.367 4.418 20 0 DIADLO OCCC[C@@H](Nc1[nH+]ccc2ccc(F)cc21)c1ccccc1 ZINC000340252386 131278535 /nfs/dbraw/zinc/27/85/35/131278535.db2.gz DDDMPOFCPHTFBC-GOSISDBHSA-N 1 2 310.372 4.300 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCc2c1cccc2Cl ZINC000287468648 131282276 /nfs/dbraw/zinc/28/22/76/131282276.db2.gz JJPFLVICJNURQK-OAHLLOKOSA-N 1 2 315.804 4.161 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(Cc1cccc(F)c1)C(C)C ZINC000287548614 131285788 /nfs/dbraw/zinc/28/57/88/131285788.db2.gz OTNYNZDIAANWBA-UHFFFAOYSA-N 1 2 315.392 4.280 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000287565422 131287010 /nfs/dbraw/zinc/28/70/10/131287010.db2.gz PWXITUCBDAQWIQ-LSDHHAIUSA-N 1 2 315.804 4.029 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CCCc2ccc(F)cc21 ZINC000287557822 131287419 /nfs/dbraw/zinc/28/74/19/131287419.db2.gz PGJAJISANODXSY-INIZCTEOSA-N 1 2 313.376 4.037 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@H](C)c1ccccc1F ZINC000287571933 131287985 /nfs/dbraw/zinc/28/79/85/131287985.db2.gz QFUOEGRWTJOREQ-CYBMUJFWSA-N 1 2 301.365 4.062 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(Cc1ccc(F)cc1)C1CC1 ZINC000287588938 131288761 /nfs/dbraw/zinc/28/87/61/131288761.db2.gz RIQZYWUHPOOKKE-UHFFFAOYSA-N 1 2 313.376 4.034 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@@H](c2ccccc2)[C@H]1C ZINC000287621400 131290988 /nfs/dbraw/zinc/29/09/88/131290988.db2.gz UFOCRFPQRKZNFM-NVXWUHKLSA-N 1 2 309.413 4.108 20 0 DIADLO CC[C@H](NC(=O)Nc1c(C)cc[nH+]c1C)c1ccc(F)cc1F ZINC000287668096 131293084 /nfs/dbraw/zinc/29/30/84/131293084.db2.gz XMNHWNFNOPSHEA-HNNXBMFYSA-N 1 2 319.355 4.249 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCC1CC(c2ccccc2)C1 ZINC000287681518 131294722 /nfs/dbraw/zinc/29/47/22/131294722.db2.gz YJGGVROMCKGHES-UHFFFAOYSA-N 1 2 309.413 4.014 20 0 DIADLO Clc1cccc(C[NH2+]Cc2noc3c2CCCC3)c1Cl ZINC000288350046 131321451 /nfs/dbraw/zinc/32/14/51/131321451.db2.gz CADZSHGYVYRCQM-UHFFFAOYSA-N 1 2 311.212 4.150 20 0 DIADLO CC[N@H+](C)[C@H](c1nc([C@H]2CCCCS2)no1)c1ccccc1 ZINC000288958844 131348137 /nfs/dbraw/zinc/34/81/37/131348137.db2.gz BMWCBRCFNAWNDO-CABCVRRESA-N 1 2 317.458 4.069 20 0 DIADLO CC[N@@H+](C)[C@H](c1nc([C@H]2CCCCS2)no1)c1ccccc1 ZINC000288958844 131348139 /nfs/dbraw/zinc/34/81/39/131348139.db2.gz BMWCBRCFNAWNDO-CABCVRRESA-N 1 2 317.458 4.069 20 0 DIADLO C[N@H+](Cc1csc(Cl)n1)Cc1ccc(OC(F)F)cc1 ZINC000289244934 131368303 /nfs/dbraw/zinc/36/83/03/131368303.db2.gz BZMGJAYOBIVZOZ-UHFFFAOYSA-N 1 2 318.776 4.030 20 0 DIADLO C[N@@H+](Cc1csc(Cl)n1)Cc1ccc(OC(F)F)cc1 ZINC000289244934 131368304 /nfs/dbraw/zinc/36/83/04/131368304.db2.gz BZMGJAYOBIVZOZ-UHFFFAOYSA-N 1 2 318.776 4.030 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](c2ccc(CC(C)C)cc2)C2CC2)no1 ZINC000289300678 131371578 /nfs/dbraw/zinc/37/15/78/131371578.db2.gz BLULCMIKQGAJKH-UGSOOPFHSA-N 1 2 313.445 4.378 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cc(C(C)(C)C)on1 ZINC000289365475 131378974 /nfs/dbraw/zinc/37/89/74/131378974.db2.gz NMWFAEZYJQLQSR-ZDUSSCGKSA-N 1 2 302.418 4.140 20 0 DIADLO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]Cc1cc(C(C)(C)C)on1 ZINC000289458702 131387868 /nfs/dbraw/zinc/38/78/68/131387868.db2.gz FXJCUCDENWVVAW-LBPRGKRZSA-N 1 2 318.465 4.083 20 0 DIADLO COc1ccc([C@H](Cc2ccccc2)[NH2+]Cc2ncc(C)o2)cc1 ZINC000290090887 131452704 /nfs/dbraw/zinc/45/27/04/131452704.db2.gz HWGAKWXJJOGAEY-IBGZPJMESA-N 1 2 322.408 4.065 20 0 DIADLO CC[C@H]([NH2+]Cc1csc(Cl)n1)c1cc(F)ccc1F ZINC000290103247 131454026 /nfs/dbraw/zinc/45/40/26/131454026.db2.gz SEZHERNYQVPHGT-LBPRGKRZSA-N 1 2 302.777 4.316 20 0 DIADLO Cc1cc(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)ccc1Br ZINC000294155307 131805563 /nfs/dbraw/zinc/80/55/63/131805563.db2.gz QJHBQHWRHWMIOJ-ZWNOBZJWSA-N 1 2 306.207 4.072 20 0 DIADLO Fc1ccc(C2CC2)cc1CN[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000297250601 132005888 /nfs/dbraw/zinc/00/58/88/132005888.db2.gz JGMCKYUVHAHFAN-IBGZPJMESA-N 1 2 321.399 4.305 20 0 DIADLO Fc1ccc(C2CC2)cc1C[NH2+][C@H](c1ncc[nH]1)c1ccccc1 ZINC000297250601 132005889 /nfs/dbraw/zinc/00/58/89/132005889.db2.gz JGMCKYUVHAHFAN-IBGZPJMESA-N 1 2 321.399 4.305 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2cc(F)cnc2Cl)cs1 ZINC000297441463 132015249 /nfs/dbraw/zinc/01/52/49/132015249.db2.gz WFDOPFFUAJSIBO-SECBINFHSA-N 1 2 313.829 4.305 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+]Cc2cc(F)cnc2Cl)cs1 ZINC000297441468 132015820 /nfs/dbraw/zinc/01/58/20/132015820.db2.gz WFDOPFFUAJSIBO-VIFPVBQESA-N 1 2 313.829 4.305 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000297552316 132022507 /nfs/dbraw/zinc/02/25/07/132022507.db2.gz ZSPYVMLHLWDBKP-MSOLQXFVSA-N 1 2 323.440 4.498 20 0 DIADLO FCCCCCSc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC000340575276 132024938 /nfs/dbraw/zinc/02/49/38/132024938.db2.gz OEBCVWNXKNIZJY-UHFFFAOYSA-N 1 2 316.405 4.047 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000297655535 132027642 /nfs/dbraw/zinc/02/76/42/132027642.db2.gz DWQFEIMIMDLBGC-KRWDZBQOSA-N 1 2 307.397 4.149 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc(F)c2)c2nccn21 ZINC000297794769 132034968 /nfs/dbraw/zinc/03/49/68/132034968.db2.gz QBUWZRZDFNRDPX-ZMYBRWDISA-N 1 2 321.399 4.407 20 0 DIADLO CC(=O)Nc1ccc(C)cc1NCc1ccc(C(C)C)[nH+]c1C ZINC000297955602 132042311 /nfs/dbraw/zinc/04/23/11/132042311.db2.gz ZBQKPCRTMKJXLR-UHFFFAOYSA-N 1 2 311.429 4.392 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2ncc(C(C)(C)C)o2)cc1 ZINC000298274273 132053868 /nfs/dbraw/zinc/05/38/68/132053868.db2.gz JDBVQGSRWHECLB-ZDUSSCGKSA-N 1 2 302.418 4.174 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2ncc(C(C)(C)C)o2)cc1 ZINC000298274273 132053870 /nfs/dbraw/zinc/05/38/70/132053870.db2.gz JDBVQGSRWHECLB-ZDUSSCGKSA-N 1 2 302.418 4.174 20 0 DIADLO Clc1cccc2c(N3CCC(c4ccncn4)CC3)cc[nH+]c12 ZINC000298978802 132085081 /nfs/dbraw/zinc/08/50/81/132085081.db2.gz QXYHBSFRQPBMJH-UHFFFAOYSA-N 1 2 324.815 4.062 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC000340616126 132087693 /nfs/dbraw/zinc/08/76/93/132087693.db2.gz PDZJFUSBGRVJMP-UHFFFAOYSA-N 1 2 324.211 4.175 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC000340616126 132087694 /nfs/dbraw/zinc/08/76/94/132087694.db2.gz PDZJFUSBGRVJMP-UHFFFAOYSA-N 1 2 324.211 4.175 20 0 DIADLO CCC[N@H+](Cc1nc(C)c(C)o1)[C@H](C)c1ccccc1OC ZINC000299344250 132099987 /nfs/dbraw/zinc/09/99/87/132099987.db2.gz ARSNXWGLWVCNTC-CQSZACIVSA-N 1 2 302.418 4.273 20 0 DIADLO CCC[N@@H+](Cc1nc(C)c(C)o1)[C@H](C)c1ccccc1OC ZINC000299344250 132099988 /nfs/dbraw/zinc/09/99/88/132099988.db2.gz ARSNXWGLWVCNTC-CQSZACIVSA-N 1 2 302.418 4.273 20 0 DIADLO Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000164141671 132130279 /nfs/dbraw/zinc/13/02/79/132130279.db2.gz WQZLFQRVJZHWEY-LSDHHAIUSA-N 1 2 323.421 4.189 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@H](C)c1nc(C(C)(C)C)cs1 ZINC000121656243 132156506 /nfs/dbraw/zinc/15/65/06/132156506.db2.gz GMZWKHBPMCDOQH-LLVKDONJSA-N 1 2 318.446 4.027 20 0 DIADLO Cc1cc(Nc2nnc(C(C)C)o2)c[nH+]c1N1CCCC[C@H]1C ZINC000520505695 435751405 /nfs/dbraw/zinc/75/14/05/435751405.db2.gz GWTNACOHZCMOMU-CYBMUJFWSA-N 1 2 315.421 4.019 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc(C(C)(C)C2CC2)n1 ZINC000570725512 332807356 /nfs/dbraw/zinc/80/73/56/332807356.db2.gz PYFZARADJCDHLX-UHFFFAOYSA-N 1 2 324.428 4.279 20 0 DIADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1nccn1C ZINC000447567073 331528418 /nfs/dbraw/zinc/52/84/18/331528418.db2.gz YVWQNPRATOPGDS-TZMCWYRMSA-N 1 2 311.351 4.073 20 0 DIADLO CC(C)CC1(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)CCC1 ZINC000464935687 332915040 /nfs/dbraw/zinc/91/50/40/332915040.db2.gz MXSHIZYFCCAYLP-UHFFFAOYSA-N 1 2 311.429 4.242 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)no1 ZINC000370543553 331550724 /nfs/dbraw/zinc/55/07/24/331550724.db2.gz IEJRBHZMRQOXJR-PELKAZGASA-N 1 2 313.184 4.074 20 0 DIADLO Fc1cccc(C[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)c1F ZINC000568024489 331645867 /nfs/dbraw/zinc/64/58/67/331645867.db2.gz NHRBDDSVXBDSEP-LBPRGKRZSA-N 1 2 313.269 4.159 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2nc(-c3ccccc3)cs2)n1 ZINC000070941010 331664958 /nfs/dbraw/zinc/66/49/58/331664958.db2.gz URTMGZLJJWDTBJ-LBPRGKRZSA-N 1 2 315.467 4.426 20 0 DIADLO COc1cccc2c1cc[nH+]c2NCc1ccn(C2CCCC2)n1 ZINC000584094323 331711299 /nfs/dbraw/zinc/71/12/99/331711299.db2.gz XHVPQPHVOWHODM-UHFFFAOYSA-N 1 2 322.412 4.167 20 0 DIADLO C[C@@H]1C[C@@H](NC(=O)Nc2ccccc2C(C)(C)C)c2[nH+]ccn21 ZINC000556524834 331714281 /nfs/dbraw/zinc/71/42/81/331714281.db2.gz YZLLQRBUECMMKA-IUODEOHRSA-N 1 2 312.417 4.008 20 0 DIADLO C[C@H]1C[C@H](NC(=O)Nc2ccccc2C(C)(C)C)c2[nH+]ccn21 ZINC000556524838 331714464 /nfs/dbraw/zinc/71/44/64/331714464.db2.gz YZLLQRBUECMMKA-WFASDCNBSA-N 1 2 312.417 4.008 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)CO2 ZINC000557145140 331772642 /nfs/dbraw/zinc/77/26/42/331772642.db2.gz ZLOFQGRFRUOYJC-JTQLQIEISA-N 1 2 318.200 4.417 20 0 DIADLO C[C@@H]([NH2+]C/C=C\c1ccc(Cl)cc1)c1nc(C(C)(C)C)no1 ZINC000255657953 331784543 /nfs/dbraw/zinc/78/45/43/331784543.db2.gz ATBYBKRTXCZPPJ-FOQNGQEVSA-N 1 2 319.836 4.385 20 0 DIADLO Cc1cc(C)cc([C@@H]2CCN(c3cc[nH+]c4ccncc43)C2)c1 ZINC000584136844 331841016 /nfs/dbraw/zinc/84/10/16/331841016.db2.gz SIINXXKCYSWHTJ-MRXNPFEDSA-N 1 2 303.409 4.241 20 0 DIADLO Fc1cccc(C=C2CC[NH+](Cc3cncc(F)c3)CC2)c1 ZINC000558419542 331906139 /nfs/dbraw/zinc/90/61/39/331906139.db2.gz QWIHUIZXTYYXPP-UHFFFAOYSA-N 1 2 300.352 4.039 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CSc1nnc(OC(C)C)s1 ZINC000558832945 331948696 /nfs/dbraw/zinc/94/86/96/331948696.db2.gz RCZVZXNCDPJIIT-UHFFFAOYSA-N 1 2 323.487 4.444 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)s1 ZINC000559246219 332002247 /nfs/dbraw/zinc/00/22/47/332002247.db2.gz YFALPADLOBOTMZ-GXFFZTMASA-N 1 2 308.472 4.012 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)s1 ZINC000559246221 332002329 /nfs/dbraw/zinc/00/23/29/332002329.db2.gz YFALPADLOBOTMZ-ZWNOBZJWSA-N 1 2 308.472 4.012 20 0 DIADLO CC(C)(C)c1nc(C[NH2+]Cc2ccc3ccccc3n2)cs1 ZINC000518276825 332004937 /nfs/dbraw/zinc/00/49/37/332004937.db2.gz UDLYYVMBDYUPEV-UHFFFAOYSA-N 1 2 311.454 4.279 20 0 DIADLO CC(C)c1nc(N2CCC[C@H]2Cc2ccccc2Cl)cc[nH+]1 ZINC000518369180 332018675 /nfs/dbraw/zinc/01/86/75/332018675.db2.gz FVWSFZBLOIVOFO-HNNXBMFYSA-N 1 2 315.848 4.465 20 0 DIADLO CCc1nc(C[N@H+](C)CCSCc2ccccc2)cs1 ZINC000559324907 332026214 /nfs/dbraw/zinc/02/62/14/332026214.db2.gz DFTAUMQQKJNLKT-UHFFFAOYSA-N 1 2 306.500 4.071 20 0 DIADLO CCc1nc(C[N@@H+](C)CCSCc2ccccc2)cs1 ZINC000559324907 332026215 /nfs/dbraw/zinc/02/62/15/332026215.db2.gz DFTAUMQQKJNLKT-UHFFFAOYSA-N 1 2 306.500 4.071 20 0 DIADLO Cc1cc(N[C@@H]2CCC[C@H]2OC(F)F)c2cccc(F)c2[nH+]1 ZINC000409553135 332038435 /nfs/dbraw/zinc/03/84/35/332038435.db2.gz IKQWCESEZUEZAZ-TZMCWYRMSA-N 1 2 310.319 4.255 20 0 DIADLO C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)[N@H+]1Cc1ncc(Cl)s1 ZINC000449365322 332077245 /nfs/dbraw/zinc/07/72/45/332077245.db2.gz TTZCKLHDXHMCLK-YIZRAAEISA-N 1 2 312.788 4.348 20 0 DIADLO C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)[N@@H+]1Cc1ncc(Cl)s1 ZINC000449365322 332077247 /nfs/dbraw/zinc/07/72/47/332077247.db2.gz TTZCKLHDXHMCLK-YIZRAAEISA-N 1 2 312.788 4.348 20 0 DIADLO CC(C)n1nccc1C[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000410325230 332111034 /nfs/dbraw/zinc/11/10/34/332111034.db2.gz HTZNZXSTZSZVQD-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1nccc1C[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000410325230 332111035 /nfs/dbraw/zinc/11/10/35/332111035.db2.gz HTZNZXSTZSZVQD-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO Cc1c([C@H](C)[NH2+]CC(F)(F)c2ccccc2)cnn1C(C)(C)C ZINC000569512143 332116615 /nfs/dbraw/zinc/11/66/15/332116615.db2.gz BOLXXJJDWKXLKI-ZDUSSCGKSA-N 1 2 321.415 4.389 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cccc2ccoc21)c1nc(C2CC2)no1 ZINC000569543926 332132744 /nfs/dbraw/zinc/13/27/44/332132744.db2.gz NHNOAPDTFHXSAK-OAHLLOKOSA-N 1 2 311.385 4.180 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1nc2ccccc2o1 ZINC000569566863 332140561 /nfs/dbraw/zinc/14/05/61/332140561.db2.gz TWGPACYRHNBDKM-MNOVXSKESA-N 1 2 313.426 4.185 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2o1)c1nc2c(s1)CCC2 ZINC000569566865 332140634 /nfs/dbraw/zinc/14/06/34/332140634.db2.gz TWGPACYRHNBDKM-WDEREUQCSA-N 1 2 313.426 4.185 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCCC[C@H]1c1nccs1 ZINC000428416235 332162418 /nfs/dbraw/zinc/16/24/18/332162418.db2.gz FDGDFXVFBPGNRF-ZDUSSCGKSA-N 1 2 305.447 4.290 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1CCCC[C@H]1c1nccs1 ZINC000428416235 332162419 /nfs/dbraw/zinc/16/24/19/332162419.db2.gz FDGDFXVFBPGNRF-ZDUSSCGKSA-N 1 2 305.447 4.290 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CC[C@]4(C)[C@H](C3)C4(F)F)cs2)o1 ZINC000428714442 332163579 /nfs/dbraw/zinc/16/35/79/332163579.db2.gz VMINJAZBHMYTRV-DZGCQCFKSA-N 1 2 324.396 4.189 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CC[C@]4(C)[C@H](C3)C4(F)F)cs2)o1 ZINC000428714442 332163580 /nfs/dbraw/zinc/16/35/80/332163580.db2.gz VMINJAZBHMYTRV-DZGCQCFKSA-N 1 2 324.396 4.189 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H](C)c2ccccc2F)[nH+]1 ZINC000427183272 332182180 /nfs/dbraw/zinc/18/21/80/332182180.db2.gz CNXRPQYXMKKJBA-CYBMUJFWSA-N 1 2 323.371 4.266 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000181233792 332186691 /nfs/dbraw/zinc/18/66/91/332186691.db2.gz JADCTPIKJQUCDK-JTQLQIEISA-N 1 2 320.314 4.438 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000181233792 332186692 /nfs/dbraw/zinc/18/66/92/332186692.db2.gz JADCTPIKJQUCDK-JTQLQIEISA-N 1 2 320.314 4.438 20 0 DIADLO C[N@H+](Cc1csc(Cl)c1Cl)[C@@H](CO)c1ccccc1 ZINC000449453673 332207374 /nfs/dbraw/zinc/20/73/74/332207374.db2.gz NBSJXXNRORLKRH-LBPRGKRZSA-N 1 2 316.253 4.220 20 0 DIADLO C[N@@H+](Cc1csc(Cl)c1Cl)[C@@H](CO)c1ccccc1 ZINC000449453673 332207376 /nfs/dbraw/zinc/20/73/76/332207376.db2.gz NBSJXXNRORLKRH-LBPRGKRZSA-N 1 2 316.253 4.220 20 0 DIADLO Cn1cc([C@H](Nc2ccc3ccccc3[nH+]2)c2ccccc2)cn1 ZINC000363669822 332215904 /nfs/dbraw/zinc/21/59/04/332215904.db2.gz IMBNCPIXBQJBLS-HXUWFJFHSA-N 1 2 314.392 4.170 20 0 DIADLO FC(F)(F)C1=CC[N@H+](Cc2cccc(Br)c2)CC1 ZINC000533836025 332217383 /nfs/dbraw/zinc/21/73/83/332217383.db2.gz RNGWLCQZURSQER-UHFFFAOYSA-N 1 2 320.152 4.144 20 0 DIADLO FC(F)(F)C1=CC[N@@H+](Cc2cccc(Br)c2)CC1 ZINC000533836025 332217384 /nfs/dbraw/zinc/21/73/84/332217384.db2.gz RNGWLCQZURSQER-UHFFFAOYSA-N 1 2 320.152 4.144 20 0 DIADLO Cc1ccc2cc([C@@H](C)[NH2+]Cc3nccn3CC(C)C)oc2c1 ZINC000426048889 335095396 /nfs/dbraw/zinc/09/53/96/335095396.db2.gz JSPTZXOTFLEQHU-OAHLLOKOSA-N 1 2 311.429 4.445 20 0 DIADLO Cc1ccc2cc([C@H](C)[NH2+]Cc3nccn3CC(C)C)oc2c1 ZINC000426048888 335095480 /nfs/dbraw/zinc/09/54/80/335095480.db2.gz JSPTZXOTFLEQHU-HNNXBMFYSA-N 1 2 311.429 4.445 20 0 DIADLO Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(C)[nH+]c2C)s1 ZINC000152421177 335096046 /nfs/dbraw/zinc/09/60/46/335096046.db2.gz FMDBBWDKNGVNJC-HNNXBMFYSA-N 1 2 315.442 4.437 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccccc1C(F)(F)F ZINC000367518893 332233861 /nfs/dbraw/zinc/23/38/61/332233861.db2.gz KUCANGCIKXDNEW-IINYFYTJSA-N 1 2 309.335 4.157 20 0 DIADLO CC[N@H+](Cc1nccc(C)n1)C(c1ccccc1)c1ccccc1 ZINC000559396869 332255829 /nfs/dbraw/zinc/25/58/29/332255829.db2.gz NJTZEKLKBPWQSC-UHFFFAOYSA-N 1 2 317.436 4.397 20 0 DIADLO CC[N@@H+](Cc1nccc(C)n1)C(c1ccccc1)c1ccccc1 ZINC000559396869 332255830 /nfs/dbraw/zinc/25/58/30/332255830.db2.gz NJTZEKLKBPWQSC-UHFFFAOYSA-N 1 2 317.436 4.397 20 0 DIADLO CCCc1csc(C[N@@H+]2CCSC[C@H]2c2ccccc2)n1 ZINC000426068469 335097506 /nfs/dbraw/zinc/09/75/06/335097506.db2.gz YJGLOGTYVGZXOB-INIZCTEOSA-N 1 2 318.511 4.386 20 0 DIADLO CCCc1csc(C[N@H+]2CCSC[C@H]2c2ccccc2)n1 ZINC000426068469 335097507 /nfs/dbraw/zinc/09/75/07/335097507.db2.gz YJGLOGTYVGZXOB-INIZCTEOSA-N 1 2 318.511 4.386 20 0 DIADLO C[C@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1cccc(C2CC2)c1 ZINC000559785497 332282076 /nfs/dbraw/zinc/28/20/76/332282076.db2.gz CNMFIEJWPWBNDK-SGTLLEGYSA-N 1 2 317.379 4.226 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H]2CC3CCC2CC3)[nH+]1 ZINC000560320394 332330461 /nfs/dbraw/zinc/33/04/61/332330461.db2.gz QTVURUKHEQWGRU-XUJLQICISA-N 1 2 309.413 4.150 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2cccc(C)c2C)n1 ZINC000115602861 332333968 /nfs/dbraw/zinc/33/39/68/332333968.db2.gz VVPUOIHIALJYTJ-CABCVRRESA-N 1 2 301.434 4.441 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2nc(C)c(C)s2)c1C ZINC000180402402 332340865 /nfs/dbraw/zinc/34/08/65/332340865.db2.gz CTNAHFAXTHMCDU-UHFFFAOYSA-N 1 2 308.472 4.214 20 0 DIADLO Cc1cccc(NC(=O)NCc2cccc(-c3[nH]cc[nH+]3)c2)c1C ZINC000426083178 335102120 /nfs/dbraw/zinc/10/21/20/335102120.db2.gz AFPGVJIKGRMHPN-UHFFFAOYSA-N 1 2 320.396 4.015 20 0 DIADLO COc1cccc(Cl)c1C[N@H+](C)[C@H](C)c1cccc(O)c1 ZINC000560533014 332353664 /nfs/dbraw/zinc/35/36/64/332353664.db2.gz UPLZOYDLYXAUPO-GFCCVEGCSA-N 1 2 305.805 4.247 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+](C)[C@H](C)c1cccc(O)c1 ZINC000560533014 332353666 /nfs/dbraw/zinc/35/36/66/332353666.db2.gz UPLZOYDLYXAUPO-GFCCVEGCSA-N 1 2 305.805 4.247 20 0 DIADLO CCOc1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)cc1F ZINC000560552033 332358703 /nfs/dbraw/zinc/35/87/03/332358703.db2.gz JYALWDMMHIORLX-SFHVURJKSA-N 1 2 314.404 4.203 20 0 DIADLO CCOc1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2ccncc2)cc1F ZINC000560552033 332358704 /nfs/dbraw/zinc/35/87/04/332358704.db2.gz JYALWDMMHIORLX-SFHVURJKSA-N 1 2 314.404 4.203 20 0 DIADLO CSc1ccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)nc1 ZINC000560553648 332359167 /nfs/dbraw/zinc/35/91/67/332359167.db2.gz WZNLFMYOGUUVCX-OAHLLOKOSA-N 1 2 302.447 4.260 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+](C)Cc1nc2ccccc2o1 ZINC000097493203 332363259 /nfs/dbraw/zinc/36/32/59/332363259.db2.gz QMWPWACTTGVXNL-UHFFFAOYSA-N 1 2 310.397 4.247 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+](C)Cc1nc2ccccc2o1 ZINC000097493203 332363261 /nfs/dbraw/zinc/36/32/61/332363261.db2.gz QMWPWACTTGVXNL-UHFFFAOYSA-N 1 2 310.397 4.247 20 0 DIADLO COc1cccc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c1OC ZINC000560587998 332363933 /nfs/dbraw/zinc/36/39/33/332363933.db2.gz IRVNAFGLHDJPSM-INIZCTEOSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cccc(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)c1OC ZINC000560587998 332363934 /nfs/dbraw/zinc/36/39/34/332363934.db2.gz IRVNAFGLHDJPSM-INIZCTEOSA-N 1 2 317.816 4.304 20 0 DIADLO Clc1oc2ccccc2c1C[N@@H+]1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000560630342 332370874 /nfs/dbraw/zinc/37/08/74/332370874.db2.gz YQIWMHNRGVDEIC-AEFFLSMTSA-N 1 2 317.816 4.230 20 0 DIADLO Clc1oc2ccccc2c1C[N@H+]1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000560630342 332370876 /nfs/dbraw/zinc/37/08/76/332370876.db2.gz YQIWMHNRGVDEIC-AEFFLSMTSA-N 1 2 317.816 4.230 20 0 DIADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)[C@@H]1CC=CCC1 ZINC000560684755 332377525 /nfs/dbraw/zinc/37/75/25/332377525.db2.gz YPMFYPZFVLVERC-OAHLLOKOSA-N 1 2 321.424 4.181 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2ccc(-c3ccc(C)cc3)s2)n1 ZINC000560817119 332388221 /nfs/dbraw/zinc/38/82/21/332388221.db2.gz STENPCIQHCIUSY-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)CCc1ccccc1F ZINC000425589577 335108197 /nfs/dbraw/zinc/10/81/97/335108197.db2.gz UEXGXIKXDOTPGL-CYBMUJFWSA-N 1 2 300.377 4.045 20 0 DIADLO CC[C@H](CC(F)(F)F)Nc1[nH+]ccc(C)c1Br ZINC000561266645 332432028 /nfs/dbraw/zinc/43/20/28/332432028.db2.gz VMAGSJXNDGZWCJ-MRVPVSSYSA-N 1 2 311.145 4.295 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2cnc(C3CCC3)s2)o1 ZINC000150834523 332438647 /nfs/dbraw/zinc/43/86/47/332438647.db2.gz FTRXNHSSFJDPQE-HNNXBMFYSA-N 1 2 320.458 4.043 20 0 DIADLO CCCc1ncc(C[NH2+]Cc2cc(C(F)(F)F)ccc2F)o1 ZINC000449610702 332447045 /nfs/dbraw/zinc/44/70/45/332447045.db2.gz HNBKQPCTFRUBRA-UHFFFAOYSA-N 1 2 316.298 4.075 20 0 DIADLO Fc1c(Cl)cccc1C[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000561442627 332450662 /nfs/dbraw/zinc/45/06/62/332450662.db2.gz COMMIEJBLNSPNP-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc(C)c(F)cc2Cl)c(C)[nH+]1 ZINC000150922487 332457681 /nfs/dbraw/zinc/45/76/81/332457681.db2.gz RLEOCQHKBMFLEY-UHFFFAOYSA-N 1 2 306.768 4.360 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2cc(F)cc(F)c2)o1 ZINC000165270039 332504631 /nfs/dbraw/zinc/50/46/31/332504631.db2.gz CKZFVMWVMKAQHD-ZBEGNZNMSA-N 1 2 309.356 4.159 20 0 DIADLO C[C@H]([NH2+]C/C=C/c1ccc(F)cc1F)c1nc(C(C)(C)C)no1 ZINC000562034008 332534837 /nfs/dbraw/zinc/53/48/37/332534837.db2.gz NULPTUXMSQPMJL-QRGHLMKCSA-N 1 2 321.371 4.009 20 0 DIADLO c1ccc([C@H]([NH2+][C@@H]2COCc3ccccc32)c2ccccn2)cc1 ZINC000428216050 332557915 /nfs/dbraw/zinc/55/79/15/332557915.db2.gz BFDJEPFACLFTCD-RTWAWAEBSA-N 1 2 316.404 4.032 20 0 DIADLO Fc1cccc(Cl)c1NCc1cn2cc(Cl)ccc2[nH+]1 ZINC000168407493 332564033 /nfs/dbraw/zinc/56/40/33/332564033.db2.gz XUMOOMHDYNSAGE-UHFFFAOYSA-N 1 2 310.159 4.392 20 0 DIADLO Cc1[nH]c(CNc2cnn(CCC(C)C)c2C(C)C)[nH+]c1C ZINC000566926567 332613254 /nfs/dbraw/zinc/61/32/54/332613254.db2.gz NMUXOTFTBVRWMX-UHFFFAOYSA-N 1 2 303.454 4.005 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1cc(F)ccc1F ZINC000169282263 332627664 /nfs/dbraw/zinc/62/76/64/332627664.db2.gz YEDYCDVLLAFADK-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO Cc1cccnc1C(C)(C)CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000569753598 332675676 /nfs/dbraw/zinc/67/56/76/332675676.db2.gz ZSPFHBNDRDIHQY-UHFFFAOYSA-N 1 2 309.335 4.194 20 0 DIADLO CCCC(=O)Nc1cccc(NCCCc2c[nH+]ccc2C)c1 ZINC000570246728 332731269 /nfs/dbraw/zinc/73/12/69/332731269.db2.gz AADBBCYAYBMNGZ-UHFFFAOYSA-N 1 2 311.429 4.173 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)no1 ZINC000570430817 332753675 /nfs/dbraw/zinc/75/36/75/332753675.db2.gz REWBRQVUXNBUHY-LBPRGKRZSA-N 1 2 313.376 4.165 20 0 DIADLO CCCC(CCC)[S@@](=O)Cc1cn2cc(Cl)ccc2[nH+]1 ZINC000176640198 332951151 /nfs/dbraw/zinc/95/11/51/332951151.db2.gz VMNKGAJISGOKIP-FQEVSTJZSA-N 1 2 312.866 4.205 20 0 DIADLO O=C(c1cccc(Oc2cc[nH+]cc2)c1)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000178350541 333008222 /nfs/dbraw/zinc/00/82/22/333008222.db2.gz UDWZGZXPAYYSCC-CALCHBBNSA-N 1 2 322.408 4.136 20 0 DIADLO O=C(c1cccc(Oc2cc[nH+]cc2)c1)N1C[C@@H]2CCCC[C@H]2C1 ZINC000178350565 333008360 /nfs/dbraw/zinc/00/83/60/333008360.db2.gz UDWZGZXPAYYSCC-IRXDYDNUSA-N 1 2 322.408 4.136 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc2cc(C)ccc2s1)c1nccs1 ZINC000528420260 333012036 /nfs/dbraw/zinc/01/20/36/333012036.db2.gz YOQDRJJJQFMYQA-INIZCTEOSA-N 1 2 317.483 4.476 20 0 DIADLO Cc1ccc(NC(=O)c2cccc(C)c2Br)c(C)[nH+]1 ZINC000179384437 333025172 /nfs/dbraw/zinc/02/51/72/333025172.db2.gz GGERVOJQZRHWHZ-UHFFFAOYSA-N 1 2 319.202 4.022 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(Cc2ccccc2)n1)c1cccc(O)c1 ZINC000181501242 333030203 /nfs/dbraw/zinc/03/02/03/333030203.db2.gz PSMHDICQRBEERV-CQSZACIVSA-N 1 2 324.449 4.290 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@H](C)c2cc3ccccc3o2)n1 ZINC000182635470 333043663 /nfs/dbraw/zinc/04/36/63/333043663.db2.gz YAXQSQLYRQNYMO-CYBMUJFWSA-N 1 2 313.401 4.255 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cccc(F)c1F ZINC000183148054 333052654 /nfs/dbraw/zinc/05/26/54/333052654.db2.gz NMPKLTSBEHXODC-LBPRGKRZSA-N 1 2 303.356 4.133 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1cc(F)ccc1Cl ZINC000445807413 333077960 /nfs/dbraw/zinc/07/79/60/333077960.db2.gz IWPZCKISCWAXBF-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO CCCCCC(=O)N1CC[NH+]([C@H](C)c2ccc(Cl)cc2)CC1 ZINC000460517099 333100320 /nfs/dbraw/zinc/10/03/20/333100320.db2.gz FMVIRIXNEIOVJA-OAHLLOKOSA-N 1 2 322.880 4.126 20 0 DIADLO Clc1ccc(/C=C/C[N@@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000526056817 333107902 /nfs/dbraw/zinc/10/79/02/333107902.db2.gz KFXNQKRHEKGSRZ-IMLGJKEDSA-N 1 2 319.857 4.488 20 0 DIADLO Clc1ccc(/C=C/C[N@H+]2CCO[C@H](c3ccsc3)C2)cc1 ZINC000526056817 333107904 /nfs/dbraw/zinc/10/79/04/333107904.db2.gz KFXNQKRHEKGSRZ-IMLGJKEDSA-N 1 2 319.857 4.488 20 0 DIADLO CC(C)(C)[C@H]1C[C@@H](Nc2cc(C(F)(F)F)cc[nH+]2)CCO1 ZINC000487125301 333112704 /nfs/dbraw/zinc/11/27/04/333112704.db2.gz ZPPUIUFAMWOHNO-NWDGAFQWSA-N 1 2 302.340 4.106 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1sccc1Br ZINC000177371896 333128195 /nfs/dbraw/zinc/12/81/95/333128195.db2.gz GAAABLFROXUEJC-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1sccc1Br ZINC000177371896 333128197 /nfs/dbraw/zinc/12/81/97/333128197.db2.gz GAAABLFROXUEJC-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(C[C@H]2CC[C@H](C)C2)n1 ZINC000460745346 333132612 /nfs/dbraw/zinc/13/26/12/333132612.db2.gz HNXNDICPQPILRD-KBPBESRZSA-N 1 2 324.428 4.009 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(C2CCCCCC2)n1 ZINC000460746314 333132782 /nfs/dbraw/zinc/13/27/82/333132782.db2.gz CLQBGXRVEXLWPA-UHFFFAOYSA-N 1 2 324.428 4.468 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(CC(CC)CC)n1 ZINC000460746770 333132959 /nfs/dbraw/zinc/13/29/59/333132959.db2.gz FEQAQJOUJGUBOZ-UHFFFAOYSA-N 1 2 312.417 4.009 20 0 DIADLO CC[C@H](Oc1ccccc1Cl)C(=O)Nc1c(C)cc[nH+]c1C ZINC000425591496 335124406 /nfs/dbraw/zinc/12/44/06/335124406.db2.gz ZVZBKOHDAXNOHL-AWEZNQCLSA-N 1 2 318.804 4.148 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC000180896358 333165875 /nfs/dbraw/zinc/16/58/75/333165875.db2.gz IKMDURGYBXJUOH-CQSZACIVSA-N 1 2 322.412 4.106 20 0 DIADLO Fc1cccc2c1CC[C@H]2[NH2+]Cc1ncc(-c2ccccc2)cn1 ZINC000461094544 333179472 /nfs/dbraw/zinc/17/94/72/333179472.db2.gz UVLMHPYTIUXQSR-LJQANCHMSA-N 1 2 319.383 4.060 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncc(Cl)cc1Cl)c1nc(C)cs1 ZINC000184443222 333197182 /nfs/dbraw/zinc/19/71/82/333197182.db2.gz RTVONGIEWCMTJY-LLVKDONJSA-N 1 2 316.257 4.394 20 0 DIADLO Cc1cccc2[nH+]c(CSc3nc4ccccc4nc3C)cn21 ZINC000497325704 333236443 /nfs/dbraw/zinc/23/64/43/333236443.db2.gz HRPPOKKACYMRPS-UHFFFAOYSA-N 1 2 320.421 4.187 20 0 DIADLO Fc1ccc(COc2cccc(CNc3cccc[nH+]3)c2)cc1 ZINC000019778085 333245653 /nfs/dbraw/zinc/24/56/53/333245653.db2.gz OZICCLDGSDQLGG-UHFFFAOYSA-N 1 2 308.356 4.412 20 0 DIADLO CCN(Cc1[nH+]ccn1Cc1ccccc1)c1cccc(C)c1 ZINC000514087860 333260485 /nfs/dbraw/zinc/26/04/85/333260485.db2.gz IQGZJGBHTQBJBK-UHFFFAOYSA-N 1 2 305.425 4.266 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000497590681 333266318 /nfs/dbraw/zinc/26/63/18/333266318.db2.gz LZCGSXAZPKATDI-KSSFIOAISA-N 1 2 301.817 4.475 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000497590681 333266320 /nfs/dbraw/zinc/26/63/20/333266320.db2.gz LZCGSXAZPKATDI-KSSFIOAISA-N 1 2 301.817 4.475 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000497590686 333266381 /nfs/dbraw/zinc/26/63/81/333266381.db2.gz LZJVQJBVUADJEQ-SGTLLEGYSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000497590686 333266382 /nfs/dbraw/zinc/26/63/82/333266382.db2.gz LZJVQJBVUADJEQ-SGTLLEGYSA-N 1 2 321.342 4.238 20 0 DIADLO Cc1ccccc1Nc1nc(C[N@@H+]2CC[C@@](C)(F)C2)cs1 ZINC000501423574 333273527 /nfs/dbraw/zinc/27/35/27/333273527.db2.gz GWEFXVGBCKQLSC-MRXNPFEDSA-N 1 2 305.422 4.129 20 0 DIADLO Cc1ccccc1Nc1nc(C[N@H+]2CC[C@@](C)(F)C2)cs1 ZINC000501423574 333273529 /nfs/dbraw/zinc/27/35/29/333273529.db2.gz GWEFXVGBCKQLSC-MRXNPFEDSA-N 1 2 305.422 4.129 20 0 DIADLO CC(C)(C)c1[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc2[nH+]1 ZINC000390436696 333280398 /nfs/dbraw/zinc/28/03/98/333280398.db2.gz WGHIUJLQHYFERW-UHFFFAOYSA-N 1 2 311.360 4.252 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)Nc2cc[nH+]c(C)c2)o1 ZINC000120472056 333284756 /nfs/dbraw/zinc/28/47/56/333284756.db2.gz ROEWNDTZAPRUKU-MLGOLLRUSA-N 1 2 313.401 4.297 20 0 DIADLO Fc1ccc(C[NH2+]Cc2ccsc2Br)c(F)c1 ZINC000388421607 333303385 /nfs/dbraw/zinc/30/33/85/333303385.db2.gz HZTQIAQNJMEUHC-UHFFFAOYSA-N 1 2 318.186 4.079 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+]2CCOC[C@@H]2c2ccccc2)c1 ZINC000525781241 333305577 /nfs/dbraw/zinc/30/55/77/333305577.db2.gz OLIPBANQVJXDGT-HXUWFJFHSA-N 1 2 311.425 4.047 20 0 DIADLO CC(C)Oc1cccc(C[N@H+]2CCOC[C@@H]2c2ccccc2)c1 ZINC000525781241 333305578 /nfs/dbraw/zinc/30/55/78/333305578.db2.gz OLIPBANQVJXDGT-HXUWFJFHSA-N 1 2 311.425 4.047 20 0 DIADLO CCCCCC(=O)N1CC[NH+]([C@H](C)c2ccccc2Cl)CC1 ZINC000497890266 333305993 /nfs/dbraw/zinc/30/59/93/333305993.db2.gz OSEJYSDRRYHAQB-OAHLLOKOSA-N 1 2 322.880 4.126 20 0 DIADLO CCc1cnc(C[N@H+](C)[C@H](C)c2ccc(C(F)(F)F)cc2)o1 ZINC000525782251 333307095 /nfs/dbraw/zinc/30/70/95/333307095.db2.gz XGYOATBYRYKFBD-LLVKDONJSA-N 1 2 312.335 4.449 20 0 DIADLO CCc1cnc(C[N@@H+](C)[C@H](C)c2ccc(C(F)(F)F)cc2)o1 ZINC000525782251 333307097 /nfs/dbraw/zinc/30/70/97/333307097.db2.gz XGYOATBYRYKFBD-LLVKDONJSA-N 1 2 312.335 4.449 20 0 DIADLO CCCCc1nc(C[N@H+](C)CCOc2ccccc2F)cs1 ZINC000497970997 333316212 /nfs/dbraw/zinc/31/62/12/333316212.db2.gz IVLOGVRVTVITMJ-UHFFFAOYSA-N 1 2 322.449 4.136 20 0 DIADLO CCCCc1nc(C[N@@H+](C)CCOc2ccccc2F)cs1 ZINC000497970997 333316214 /nfs/dbraw/zinc/31/62/14/333316214.db2.gz IVLOGVRVTVITMJ-UHFFFAOYSA-N 1 2 322.449 4.136 20 0 DIADLO COC[C@@H]([NH2+]Cc1ccc(-c2ccccc2F)o1)c1ccco1 ZINC000531333227 333344247 /nfs/dbraw/zinc/34/42/47/333344247.db2.gz XBXHVWBJNTZKOG-MRXNPFEDSA-N 1 2 315.344 4.156 20 0 DIADLO O[C@]1(CNc2ccc3ccccc3[nH+]2)CCC[C@@H](C(F)(F)F)C1 ZINC000186727446 333377496 /nfs/dbraw/zinc/37/74/96/333377496.db2.gz MFKRDWCEVCMSIJ-CZUORRHYSA-N 1 2 324.346 4.130 20 0 DIADLO Cc1cc(-c2nnc(C[N@H+]3C[C@@H](C)[C@@H]3c3ccccc3)o2)c(C)o1 ZINC000162085189 333378873 /nfs/dbraw/zinc/37/88/73/333378873.db2.gz CRKOWEQIWMCALE-KZULUSFZSA-N 1 2 323.396 4.139 20 0 DIADLO Cc1cc(-c2nnc(C[N@@H+]3C[C@@H](C)[C@@H]3c3ccccc3)o2)c(C)o1 ZINC000162085189 333378875 /nfs/dbraw/zinc/37/88/75/333378875.db2.gz CRKOWEQIWMCALE-KZULUSFZSA-N 1 2 323.396 4.139 20 0 DIADLO CO[C@H](C)c1nc(CSCCc2cccc(C)[nH+]2)cs1 ZINC000563142956 333396419 /nfs/dbraw/zinc/39/64/19/333396419.db2.gz SMOYRHSGWWEZON-GFCCVEGCSA-N 1 2 308.472 4.030 20 0 DIADLO CC[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccccc1OC ZINC000319782324 333405588 /nfs/dbraw/zinc/40/55/88/333405588.db2.gz MFTACHSKNIKNFI-KRWDZBQOSA-N 1 2 311.429 4.254 20 0 DIADLO COc1cccc([C@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC000319906685 333417306 /nfs/dbraw/zinc/41/73/06/333417306.db2.gz YBKHLDPONDITBL-HNNXBMFYSA-N 1 2 311.429 4.254 20 0 DIADLO O=C(Cc1cccs1)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000338387673 333486270 /nfs/dbraw/zinc/48/62/70/333486270.db2.gz ZFTJWOUOTLXJRP-UHFFFAOYSA-N 1 2 310.378 4.117 20 0 DIADLO Clc1csc(CNc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC000093093826 333499274 /nfs/dbraw/zinc/49/92/74/333499274.db2.gz IELKBNICIFNJGN-UHFFFAOYSA-N 1 2 307.850 4.399 20 0 DIADLO CCC(CC)[C@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000534173183 333565752 /nfs/dbraw/zinc/56/57/52/333565752.db2.gz UHWGQLGXPFKQLY-LBPRGKRZSA-N 1 2 303.381 4.022 20 0 DIADLO Clc1sc(Cl)c2c1CCC[C@H]2[NH2+]Cc1ncccn1 ZINC000563550495 333622862 /nfs/dbraw/zinc/62/28/62/333622862.db2.gz SISNXAMKBTXUMI-SECBINFHSA-N 1 2 314.241 4.012 20 0 DIADLO CC(C)CC[C@@H]([NH2+]Cc1nc(=O)c2sccc2[nH]1)C(C)(C)C ZINC000411485641 333679997 /nfs/dbraw/zinc/67/99/97/333679997.db2.gz GPALHJKMZRJPKR-CYBMUJFWSA-N 1 2 321.490 4.337 20 0 DIADLO c1cn(Cc2cccc(-c3nc(CC4CCCCC4)no3)c2)c[nH+]1 ZINC000571205478 333682133 /nfs/dbraw/zinc/68/21/33/333682133.db2.gz RKTKCGCCCKNOCQ-UHFFFAOYSA-N 1 2 322.412 4.104 20 0 DIADLO C[C@@H](CC(F)F)C(=O)Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000412217189 333739780 /nfs/dbraw/zinc/73/97/80/333739780.db2.gz KYNTZDVEYXZZPB-JTQLQIEISA-N 1 2 323.387 4.101 20 0 DIADLO Cc1ccc(Br)c(NCc2c[nH+]cn2C(C)C)c1 ZINC000163769622 333809598 /nfs/dbraw/zinc/80/95/98/333809598.db2.gz UPDVUMTVRMAIHS-UHFFFAOYSA-N 1 2 308.223 4.147 20 0 DIADLO CC(C)[C@H](C)S[C@H](C)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000412999895 333824684 /nfs/dbraw/zinc/82/46/84/333824684.db2.gz NRAJENCQCPRAAF-QWHCGFSZSA-N 1 2 317.458 4.181 20 0 DIADLO CCC(CC)[C@@H](C)C(=O)N1CCCC[C@H]1c1[nH+]ccn1CC ZINC000435981209 333831561 /nfs/dbraw/zinc/83/15/61/333831561.db2.gz IOGYISZPHSQPSK-ZBFHGGJFSA-N 1 2 305.466 4.029 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccn(C)n1 ZINC000414057907 333888580 /nfs/dbraw/zinc/88/85/80/333888580.db2.gz SIOANYWAVVNXLU-RKDXNWHRSA-N 1 2 316.207 4.278 20 0 DIADLO C[C@@H]([NH2+]C(c1ccccc1)c1ccccc1)c1cc2n(n1)CCC2 ZINC000414059289 333888879 /nfs/dbraw/zinc/88/88/79/333888879.db2.gz VZVZHKJDSVYOEX-MRXNPFEDSA-N 1 2 317.436 4.270 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1)c1csnn1 ZINC000414309350 333937070 /nfs/dbraw/zinc/93/70/70/333937070.db2.gz UVWAYJBZRSAUKA-JGVFFNPUSA-N 1 2 302.230 4.257 20 0 DIADLO Cn1ccnc1[C@H]([NH2+][C@@H]1CCCC[C@H]1F)c1ccc(Cl)cc1 ZINC000414313615 333937882 /nfs/dbraw/zinc/93/78/82/333937882.db2.gz PAFKXHGEKZCCSF-BZUAXINKSA-N 1 2 321.827 4.033 20 0 DIADLO CC(C)Cc1cccc([C@H](C)[NH2+]Cc2nnc(C3CC3)s2)c1 ZINC000414320739 333939114 /nfs/dbraw/zinc/93/91/14/333939114.db2.gz CKKVKEFVMHFIDC-ZDUSSCGKSA-N 1 2 315.486 4.465 20 0 DIADLO CSc1cc(C)ccc1NCc1[nH+]ccn1CC(F)(F)F ZINC000414491099 333995949 /nfs/dbraw/zinc/99/59/49/333995949.db2.gz BXGKBLYHFWQHRZ-UHFFFAOYSA-N 1 2 315.364 4.088 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)c(Cl)c1Cl)c1nccs1 ZINC000414497624 333998297 /nfs/dbraw/zinc/99/82/97/333998297.db2.gz UKUBOIVAWSYZHL-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO Cc1csc(C[NH2+][C@@H](C)c2nc3ccccc3n2C(F)F)n1 ZINC000271877891 334027990 /nfs/dbraw/zinc/02/79/90/334027990.db2.gz SBAHHBMWYPCZRY-JTQLQIEISA-N 1 2 322.384 4.047 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)[C@H]1CCCCS1 ZINC000272968615 334041458 /nfs/dbraw/zinc/04/14/58/334041458.db2.gz MXNKNILWIMIECI-MRXNPFEDSA-N 1 2 314.410 4.098 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+][C@@H](C)c2nnc(C)s2)cc1F ZINC000274255929 334058117 /nfs/dbraw/zinc/05/81/17/334058117.db2.gz TURKOIJGARUHKY-BDAKNGLRSA-N 1 2 311.451 4.119 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ncn(C)n1)c1cc2c(ccc3ccccc23)o1 ZINC000275629003 334072378 /nfs/dbraw/zinc/07/23/78/334072378.db2.gz BASHIUPTYFLDLF-CHWSQXEVSA-N 1 2 320.396 4.126 20 0 DIADLO C[C@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1csc(Cl)c1 ZINC000276462996 334079207 /nfs/dbraw/zinc/07/92/07/334079207.db2.gz CLZMEAZIFXTDEA-UFBFGSQYSA-N 1 2 317.788 4.064 20 0 DIADLO CC(C)[C@H](NC(=O)[C@@H](C)c1ccc2ccccc2c1)c1[nH]cc[nH+]1 ZINC000278515556 334097306 /nfs/dbraw/zinc/09/73/06/334097306.db2.gz BHSLPZIKNFCNDN-KSSFIOAISA-N 1 2 321.424 4.180 20 0 DIADLO Cc1ccoc1C[N@@H+]1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000438296348 334101266 /nfs/dbraw/zinc/10/12/66/334101266.db2.gz XJEGZMSHLPLKBD-OAHLLOKOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1ccoc1C[N@H+]1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000438296348 334101267 /nfs/dbraw/zinc/10/12/67/334101267.db2.gz XJEGZMSHLPLKBD-OAHLLOKOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1ccoc1C[N@@H+]1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000438296348 334101268 /nfs/dbraw/zinc/10/12/68/334101268.db2.gz XJEGZMSHLPLKBD-OAHLLOKOSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1ccoc1C[N@H+]1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000438296348 334101269 /nfs/dbraw/zinc/10/12/69/334101269.db2.gz XJEGZMSHLPLKBD-OAHLLOKOSA-N 1 2 315.804 4.455 20 0 DIADLO CCOc1cc(CNc2ccc3c(c2)CCC[NH2+]3)ccc1OC ZINC000414853262 334127281 /nfs/dbraw/zinc/12/72/81/334127281.db2.gz RNJVPOYTNHGKQR-UHFFFAOYSA-N 1 2 312.413 4.064 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2F)cc1O ZINC000289844042 334168464 /nfs/dbraw/zinc/16/84/64/334168464.db2.gz QUUQDTFTNZLFPG-WDEREUQCSA-N 1 2 307.340 4.091 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2cc(C3CC3)ccc2F)s1 ZINC000295140220 334219496 /nfs/dbraw/zinc/21/94/96/334219496.db2.gz PTEYSCGCXDEYEW-UHFFFAOYSA-N 1 2 322.474 4.312 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+]Cc1ncc(C)s1 ZINC000295727550 334227116 /nfs/dbraw/zinc/22/71/16/334227116.db2.gz NYLVXIIAPTYKJF-ZDUSSCGKSA-N 1 2 304.459 4.227 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1cc(Cl)c(OC)cc1OC)C(F)F ZINC000453250665 334244390 /nfs/dbraw/zinc/24/43/90/334244390.db2.gz SDVIMBILCQDKBF-LDYMZIIASA-N 1 2 307.768 4.052 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)cc1F)c1nc2ccccc2n1C ZINC000187581478 334265798 /nfs/dbraw/zinc/26/57/98/334265798.db2.gz GQBKXFHWPIDUFT-NSHDSACASA-N 1 2 317.795 4.217 20 0 DIADLO Cc1ccc2cc(CNc3ccc(N4CCCC4)[nH+]c3)ccc2n1 ZINC000187638469 334266157 /nfs/dbraw/zinc/26/61/57/334266157.db2.gz OVQHYGKGCPRKJX-UHFFFAOYSA-N 1 2 318.424 4.151 20 0 DIADLO Fc1ccc([C@@H](NCc2ccccc2Cl)c2[nH]cc[nH+]2)cc1 ZINC000187673647 334268638 /nfs/dbraw/zinc/26/86/38/334268638.db2.gz WEROKGYYTGOILT-MRXNPFEDSA-N 1 2 315.779 4.081 20 0 DIADLO c1ccc(N2Cc3cccc(NC[C@@H]4CC=CCC4)c3C2)[nH+]c1 ZINC000534514956 334278422 /nfs/dbraw/zinc/27/84/22/334278422.db2.gz POSLSKKKYGYOPF-MRXNPFEDSA-N 1 2 305.425 4.370 20 0 DIADLO CCC[C@@H](C)CC(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000534552488 334281862 /nfs/dbraw/zinc/28/18/62/334281862.db2.gz WDUNSBYIVDTFGG-OAHLLOKOSA-N 1 2 323.440 4.367 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1n[nH]cc1Br)c1ccccc1 ZINC000531968798 334330416 /nfs/dbraw/zinc/33/04/16/334330416.db2.gz IOOGZYOOPYJCCE-AWEZNQCLSA-N 1 2 322.250 4.049 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccccc2Cl)C[C@@H](c2ccc(F)cc2)O1 ZINC000303840369 334336317 /nfs/dbraw/zinc/33/63/17/334336317.db2.gz BNZHRFRDJRFSJB-ACJLOTCBSA-N 1 2 319.807 4.441 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccccc2Cl)C[C@@H](c2ccc(F)cc2)O1 ZINC000303840369 334336318 /nfs/dbraw/zinc/33/63/18/334336318.db2.gz BNZHRFRDJRFSJB-ACJLOTCBSA-N 1 2 319.807 4.441 20 0 DIADLO CC(C)c1cc(N2CCC[C@H]2c2ccccn2)nc(C(C)C)[nH+]1 ZINC000534881613 334343262 /nfs/dbraw/zinc/34/32/62/334343262.db2.gz SQQJDBODBBNJPB-KRWDZBQOSA-N 1 2 310.445 4.460 20 0 DIADLO CCCCc1noc(C[N@@H+]2CCCC[C@H]2c2ccc(C)cc2)n1 ZINC000303931974 334346319 /nfs/dbraw/zinc/34/63/19/334346319.db2.gz QVLCYINTRCTCKJ-KRWDZBQOSA-N 1 2 313.445 4.448 20 0 DIADLO CCCCc1noc(C[N@H+]2CCCC[C@H]2c2ccc(C)cc2)n1 ZINC000303931974 334346320 /nfs/dbraw/zinc/34/63/20/334346320.db2.gz QVLCYINTRCTCKJ-KRWDZBQOSA-N 1 2 313.445 4.448 20 0 DIADLO CC(C)Cn1cc[nH+]c1CNC(=O)C[C@H]1C[C@H](C)CC(C)(C)C1 ZINC000303927528 334347647 /nfs/dbraw/zinc/34/76/47/334347647.db2.gz PENWXYLTKYANGF-JKSUJKDBSA-N 1 2 319.493 4.008 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2)C[C@H](c2ccc(F)cc2)O1 ZINC000303957572 334348992 /nfs/dbraw/zinc/34/89/92/334348992.db2.gz XZHHNKTYHXVOMD-FZKQIMNGSA-N 1 2 319.807 4.441 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2)C[C@H](c2ccc(F)cc2)O1 ZINC000303957572 334348993 /nfs/dbraw/zinc/34/89/93/334348993.db2.gz XZHHNKTYHXVOMD-FZKQIMNGSA-N 1 2 319.807 4.441 20 0 DIADLO Cc1cc(NC(=O)[C@H](C)c2ccc3ccccc3c2)c(C)c[nH+]1 ZINC000535036257 334359062 /nfs/dbraw/zinc/35/90/62/334359062.db2.gz QPIXGTRFUIUSHO-OAHLLOKOSA-N 1 2 304.393 4.016 20 0 DIADLO Cc1cc(NC(=O)[C@@H](Oc2ccccc2)c2ccccc2)cc[nH+]1 ZINC000112298412 334381460 /nfs/dbraw/zinc/38/14/60/334381460.db2.gz WZNXTSZOQWYDOI-IBGZPJMESA-N 1 2 318.376 4.149 20 0 DIADLO CC(C)Cn1cc(C[N@H+](C)[C@H](C)c2c(F)cccc2F)cn1 ZINC000340948600 334395886 /nfs/dbraw/zinc/39/58/86/334395886.db2.gz MHHWPISGDRAVTM-CYBMUJFWSA-N 1 2 307.388 4.010 20 0 DIADLO CC(C)Cn1cc(C[N@@H+](C)[C@H](C)c2c(F)cccc2F)cn1 ZINC000340948600 334395887 /nfs/dbraw/zinc/39/58/87/334395887.db2.gz MHHWPISGDRAVTM-CYBMUJFWSA-N 1 2 307.388 4.010 20 0 DIADLO C[C@@H](SCCn1cc[nH+]c1)c1ccccc1Br ZINC000341446746 334441063 /nfs/dbraw/zinc/44/10/63/334441063.db2.gz FMEJJKKOZPOSSY-LLVKDONJSA-N 1 2 311.248 4.140 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3cccc(O)c3)cs2)o1 ZINC000341806560 334484223 /nfs/dbraw/zinc/48/42/23/334484223.db2.gz JTVXANCWBSDGEO-LBPRGKRZSA-N 1 2 314.410 4.268 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)c(C)o1 ZINC000341899265 334493393 /nfs/dbraw/zinc/49/33/93/334493393.db2.gz GVNLMVMHFYVDCY-OLZOCXBDSA-N 1 2 311.385 4.358 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)c(C)o1 ZINC000341899264 334493627 /nfs/dbraw/zinc/49/36/27/334493627.db2.gz GVNLMVMHFYVDCY-CHWSQXEVSA-N 1 2 311.385 4.358 20 0 DIADLO Cc1oc2ccccc2c1C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000342198350 334520742 /nfs/dbraw/zinc/52/07/42/334520742.db2.gz YEXZRMVDOUYGPI-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO CCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nccc(C)n1 ZINC000342231310 334523188 /nfs/dbraw/zinc/52/31/88/334523188.db2.gz NWPYZKCTXPWPDJ-KRWDZBQOSA-N 1 2 313.445 4.061 20 0 DIADLO Cc1cn2cc(NC(=O)c3cccc4ccsc43)ccc2[nH+]1 ZINC000342301817 334526457 /nfs/dbraw/zinc/52/64/57/334526457.db2.gz OPVSWEZTMIGMFD-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO Cc1c[nH+]c(CN2CCc3c(Cl)cc(Cl)cc3[C@@H]2C)n1C ZINC000342795604 334572420 /nfs/dbraw/zinc/57/24/20/334572420.db2.gz XPHOZFNKCUIWTB-NSHDSACASA-N 1 2 324.255 4.155 20 0 DIADLO CC(C)=CCOc1cccc(CC(=O)Nc2ccc(C)[nH+]c2C)c1 ZINC000415286929 334609449 /nfs/dbraw/zinc/60/94/49/334609449.db2.gz WBGWAFPSJKXTJG-UHFFFAOYSA-N 1 2 324.424 4.225 20 0 DIADLO FC(F)(F)Cn1cc[nH+]c1CSc1ccc2c(c1)CCC2 ZINC000343195440 334655048 /nfs/dbraw/zinc/65/50/48/334655048.db2.gz JDDQYXZVOAHETN-UHFFFAOYSA-N 1 2 312.360 4.226 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(Oc2cccc(C)c2C)nc1 ZINC000416425923 334667527 /nfs/dbraw/zinc/66/75/27/334667527.db2.gz KFBSJRQXDDLSGD-UHFFFAOYSA-N 1 2 322.412 4.319 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2c(Cl)cccc2OC)c(F)c1 ZINC000188278108 334672162 /nfs/dbraw/zinc/67/21/62/334672162.db2.gz NKBASAWFOMLGKN-NSHDSACASA-N 1 2 323.795 4.347 20 0 DIADLO CC1(C)CCC[C@H](c2noc(CCc3[nH]c4ccccc4[nH+]3)n2)C1 ZINC000535354792 334719895 /nfs/dbraw/zinc/71/98/95/334719895.db2.gz PEQJLVUBZXCWER-ZDUSSCGKSA-N 1 2 324.428 4.415 20 0 DIADLO C[C@H](NC(=O)c1cccc(Oc2cc[nH+]cc2)c1)c1ccccc1 ZINC000112637086 334720418 /nfs/dbraw/zinc/72/04/18/334720418.db2.gz FQBSMTACGAKHJO-HNNXBMFYSA-N 1 2 318.376 4.365 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H]2CCc3cc(Cl)ccc32)c(C)[nH+]1 ZINC000152295665 334741103 /nfs/dbraw/zinc/74/11/03/334741103.db2.gz RQGGBYLUBJGRKY-MRXNPFEDSA-N 1 2 315.804 4.161 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(C(F)(F)F)s1)c1c(F)cccc1F ZINC000443983180 338465299 /nfs/dbraw/zinc/46/52/99/338465299.db2.gz RJLOTUZBAMWXLH-SSDOTTSWSA-N 1 2 322.302 4.291 20 0 DIADLO CC(C)c1csc(C[NH2+]Cc2cnc(C(F)(F)F)s2)n1 ZINC000444001432 338466613 /nfs/dbraw/zinc/46/66/13/338466613.db2.gz KHISNQCXQQZMOJ-UHFFFAOYSA-N 1 2 321.393 4.032 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+]Cc1nccs1 ZINC000444019008 338467421 /nfs/dbraw/zinc/46/74/21/338467421.db2.gz WPUKMVAINIAYMR-LBPRGKRZSA-N 1 2 300.349 4.235 20 0 DIADLO CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)Nc1ccc(C)[nH+]c1C ZINC000331336733 334854623 /nfs/dbraw/zinc/85/46/23/334854623.db2.gz YRTGVECEZVVLLF-NUTKFTJISA-N 1 2 304.434 4.011 20 0 DIADLO C[C@@H]1C[C@H](c2ccc(F)cc2)CN1c1cc[nH+]c2ccncc21 ZINC000444092249 338468175 /nfs/dbraw/zinc/46/81/75/338468175.db2.gz SKSJFVHQOMRNLE-HIFRSBDPSA-N 1 2 307.372 4.151 20 0 DIADLO Clc1ccc([C@H]2CCN(c3cc[nH+]c4ccncc43)C2)cc1 ZINC000444091073 338468204 /nfs/dbraw/zinc/46/82/04/338468204.db2.gz VDLAVSQBLIHCLC-AWEZNQCLSA-N 1 2 309.800 4.277 20 0 DIADLO c1ccc(CC[C@H]2CCCN2c2cc[nH+]c3ccncc32)cc1 ZINC000444110199 338468358 /nfs/dbraw/zinc/46/83/58/338468358.db2.gz PNDFNVKCBGEVEB-QGZVFWFLSA-N 1 2 303.409 4.231 20 0 DIADLO CSCc1cccc(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)c1 ZINC000188714328 334872834 /nfs/dbraw/zinc/87/28/34/334872834.db2.gz IMGALGSUPHTZGG-SFHVURJKSA-N 1 2 323.465 4.152 20 0 DIADLO Cc1ccn2c(CNc3cccc(C(C)(F)F)c3)c[nH+]c2c1 ZINC000189544536 334900078 /nfs/dbraw/zinc/90/00/78/334900078.db2.gz RVCBWTQZPBJGJW-UHFFFAOYSA-N 1 2 301.340 4.367 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3cccc(C(C)(F)F)c3)n2c1 ZINC000189550554 334900280 /nfs/dbraw/zinc/90/02/80/334900280.db2.gz AHDNENTWPVMLMF-UHFFFAOYSA-N 1 2 301.340 4.367 20 0 DIADLO CSc1ccc(C)c(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC000343275077 334903313 /nfs/dbraw/zinc/90/33/13/334903313.db2.gz JEPZWZOEGOHSJF-UHFFFAOYSA-N 1 2 323.421 4.155 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)o1)c1nc(C(F)(F)F)cs1 ZINC000343852916 335197738 /nfs/dbraw/zinc/19/77/38/335197738.db2.gz RLZLMRSEUAEWGG-LURJTMIESA-N 1 2 310.728 4.259 20 0 DIADLO C[C@H](Nc1[nH+]ccc2ccc(F)cc21)c1c(F)cncc1F ZINC000343884157 335199555 /nfs/dbraw/zinc/19/95/55/335199555.db2.gz YSVFJCRIXFILLL-VIFPVBQESA-N 1 2 303.287 4.220 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NCC2(c3ccccn3)CCC2)c1 ZINC000343976693 335204886 /nfs/dbraw/zinc/20/48/86/335204886.db2.gz RHRBLCQRMWDLRQ-UHFFFAOYSA-N 1 2 307.319 4.029 20 0 DIADLO c1cc2c(o1)CCC[N@@H+](Cc1ncc(-c3ccccc3)s1)C2 ZINC000344228736 335230397 /nfs/dbraw/zinc/23/03/97/335230397.db2.gz BVOOGRRFCRFNLS-UHFFFAOYSA-N 1 2 310.422 4.352 20 0 DIADLO c1cc2c(o1)CCC[N@H+](Cc1ncc(-c3ccccc3)s1)C2 ZINC000344228736 335230399 /nfs/dbraw/zinc/23/03/99/335230399.db2.gz BVOOGRRFCRFNLS-UHFFFAOYSA-N 1 2 310.422 4.352 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+]1CCCc2occc2C1 ZINC000344292633 335237344 /nfs/dbraw/zinc/23/73/44/335237344.db2.gz OFKFANMBMQICGI-UHFFFAOYSA-N 1 2 314.410 4.253 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+]1CCCc2occc2C1 ZINC000344292633 335237346 /nfs/dbraw/zinc/23/73/46/335237346.db2.gz OFKFANMBMQICGI-UHFFFAOYSA-N 1 2 314.410 4.253 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cncc(F)c2)C2CC2)o1 ZINC000344699045 335267876 /nfs/dbraw/zinc/26/78/76/335267876.db2.gz XGYMGFADDOOIRU-PXAZEXFGSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cncc(F)c2)C2CC2)o1 ZINC000344699045 335267877 /nfs/dbraw/zinc/26/78/77/335267877.db2.gz XGYMGFADDOOIRU-PXAZEXFGSA-N 1 2 300.377 4.102 20 0 DIADLO CO[C@H](CCNc1cc(C)[nH+]c2c(F)cccc12)C(F)(F)F ZINC000345004419 335290469 /nfs/dbraw/zinc/29/04/69/335290469.db2.gz AOZKEIBGWHXDIJ-CYBMUJFWSA-N 1 2 316.298 4.062 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)sc1C ZINC000345013762 335291429 /nfs/dbraw/zinc/29/14/29/335291429.db2.gz HLIROXLCAWOVPA-JTQLQIEISA-N 1 2 308.397 4.157 20 0 DIADLO Cc1nc(C[N@H+]2CCc3c(F)cc(F)cc3[C@@H]2C)sc1C ZINC000345013762 335291432 /nfs/dbraw/zinc/29/14/32/335291432.db2.gz HLIROXLCAWOVPA-JTQLQIEISA-N 1 2 308.397 4.157 20 0 DIADLO CC1(C)C[C@H]([NH2+]Cc2c(F)cccc2F)c2ccc(F)cc2O1 ZINC000345032949 335293658 /nfs/dbraw/zinc/29/36/58/335293658.db2.gz YFNSIQNVTDWZSW-INIZCTEOSA-N 1 2 321.342 4.496 20 0 DIADLO C[C@@H]1CC[C@H](C(=O)Nc2ccc(-c3cn4c([nH+]3)CCCC4)cc2)C1 ZINC000345133629 335304324 /nfs/dbraw/zinc/30/43/24/335304324.db2.gz AUIIHBZZUFZRFN-ZBFHGGJFSA-N 1 2 323.440 4.261 20 0 DIADLO Cc1cccc2[nH+]cc(CNc3ccc(Br)cc3)n21 ZINC000345323261 335317268 /nfs/dbraw/zinc/31/72/68/335317268.db2.gz AOYYUKMGOLAVOH-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO O=C(Nc1cc(C(F)F)ccc1Cl)c1ccc2[nH+]ccn2c1 ZINC000345276218 335318280 /nfs/dbraw/zinc/31/82/80/335318280.db2.gz IULPQZUTRGGGAC-UHFFFAOYSA-N 1 2 321.714 4.178 20 0 DIADLO C[C@H]1CN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC(C)(C)C1 ZINC000345435316 335329709 /nfs/dbraw/zinc/32/97/09/335329709.db2.gz XOBBLPPRTFRUAS-OAHLLOKOSA-N 1 2 324.424 4.382 20 0 DIADLO Cc1sccc1CC(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000345585155 335336326 /nfs/dbraw/zinc/33/63/26/335336326.db2.gz MTMQVMGIQRURGY-UHFFFAOYSA-N 1 2 324.405 4.425 20 0 DIADLO Cc1ccccc1C(=O)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1 ZINC000345871877 335357150 /nfs/dbraw/zinc/35/71/50/335357150.db2.gz STIFYQXKYOXZIU-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO Cc1oc2ccccc2c1Cc1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000346125254 335376651 /nfs/dbraw/zinc/37/66/51/335376651.db2.gz UBYPGKKQAMDLOD-UHFFFAOYSA-N 1 2 319.364 4.009 20 0 DIADLO Cc1oc2ccccc2c1-c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000346144500 335381408 /nfs/dbraw/zinc/38/14/08/335381408.db2.gz FQSBJKNVNMSDIS-UHFFFAOYSA-N 1 2 305.337 4.085 20 0 DIADLO CCc1cnc(C[NH+]2CCC(Oc3ccc(C)cc3)CC2)s1 ZINC000346150104 335382233 /nfs/dbraw/zinc/38/22/33/335382233.db2.gz MMULGEZDBYLSCC-UHFFFAOYSA-N 1 2 316.470 4.057 20 0 DIADLO CC(C)C[C@H]1C[C@@H](Nc2[nH+]ccc3ccc(F)cc32)CCO1 ZINC000346229188 335386299 /nfs/dbraw/zinc/38/62/99/335386299.db2.gz LSTSEAXAYMTBCW-HOTGVXAUSA-N 1 2 302.393 4.380 20 0 DIADLO CC(C)[C@H]([NH2+][C@H]1CCSc2ccccc21)C(=O)OC(C)(C)C ZINC000347118337 335467392 /nfs/dbraw/zinc/46/73/92/335467392.db2.gz APQKCMQLUYPBGL-HOCLYGCPSA-N 1 2 321.486 4.179 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)c(C(F)(F)F)cc1F)c1nccs1 ZINC000347233026 335476792 /nfs/dbraw/zinc/47/67/92/335476792.db2.gz PNJVEVRDFSXNEL-SSDOTTSWSA-N 1 2 322.302 4.291 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nccn1-c1ccccc1)c1c(C)noc1C ZINC000347252577 335478668 /nfs/dbraw/zinc/47/86/68/335478668.db2.gz QSCSKEJVMJWWKY-WMLDXEAASA-N 1 2 324.428 4.279 20 0 DIADLO Clc1cccc2c1CN(Cc1[nH+]ccn1Cc1ccccc1)C2 ZINC000347441182 335496880 /nfs/dbraw/zinc/49/68/80/335496880.db2.gz CXEDNSQFPRTULT-UHFFFAOYSA-N 1 2 323.827 4.101 20 0 DIADLO CCO[C@H](C)c1noc(C[NH2+][C@H](CC(C)C)c2cccs2)n1 ZINC000347611663 335510366 /nfs/dbraw/zinc/51/03/66/335510366.db2.gz NEHCPAIJRYLKFZ-CHWSQXEVSA-N 1 2 323.462 4.106 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2nc(C3CC3)cs2)C2CC2)n1 ZINC000347788572 335525159 /nfs/dbraw/zinc/52/51/59/335525159.db2.gz DARNCQSETSJEHS-CQSZACIVSA-N 1 2 305.472 4.026 20 0 DIADLO Cc1cc(Sc2ccccc2)ccc1NCc1c[nH+]cn1C ZINC000347741869 335526120 /nfs/dbraw/zinc/52/61/20/335526120.db2.gz PFCDXGJRVQBACY-UHFFFAOYSA-N 1 2 309.438 4.492 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(-c2ccccc2)oc1C)c1nccs1 ZINC000347914487 335538222 /nfs/dbraw/zinc/53/82/22/335538222.db2.gz CGBGQBYJLQGBFR-CQSZACIVSA-N 1 2 313.426 4.347 20 0 DIADLO CC(=O)Nc1ccc(NCCCc2c[nH+]ccc2C)cc1Cl ZINC000347935209 335540072 /nfs/dbraw/zinc/54/00/72/335540072.db2.gz ZWMNEDLLTBNWTJ-UHFFFAOYSA-N 1 2 317.820 4.047 20 0 DIADLO CSC1(CNc2ccc(-c3cn4c([nH+]3)CCCC4)cc2)CC1 ZINC000347952145 335541239 /nfs/dbraw/zinc/54/12/39/335541239.db2.gz KBWRAVSXWLXINJ-UHFFFAOYSA-N 1 2 313.470 4.194 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@@H]2CCc3c2cc(Cl)cc3Cl)n1 ZINC000348094814 335552885 /nfs/dbraw/zinc/55/28/85/335552885.db2.gz ZNXCALMJTAOXMV-WPPNPWJKSA-N 1 2 312.200 4.023 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)c(C)s1 ZINC000348187966 335563695 /nfs/dbraw/zinc/56/36/95/335563695.db2.gz QRUGROOXHBIPJM-VIFPVBQESA-N 1 2 309.504 4.365 20 0 DIADLO Cc1ccc(NC(=O)N(C)[C@H](C)Cc2ccccc2C)c(C)[nH+]1 ZINC000444898363 338491663 /nfs/dbraw/zinc/49/16/63/338491663.db2.gz HIJDIATYIYOCNQ-OAHLLOKOSA-N 1 2 311.429 4.102 20 0 DIADLO CCn1c[nH+]cc1CNc1ccccc1N(C)Cc1ccccc1 ZINC000417827815 335642733 /nfs/dbraw/zinc/64/27/33/335642733.db2.gz OEFNYBCOEHHXCJ-UHFFFAOYSA-N 1 2 320.440 4.152 20 0 DIADLO CCc1c2ccccc2oc1[C@H](C)[NH2+][C@@H](C)c1csnn1 ZINC000398398372 335648313 /nfs/dbraw/zinc/64/83/13/335648313.db2.gz VHTFUBRACSFCDC-QWRGUYRKSA-N 1 2 301.415 4.259 20 0 DIADLO CSc1ccccc1C(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000367099783 335690723 /nfs/dbraw/zinc/69/07/23/335690723.db2.gz MQCRIYXUQVUGCQ-UHFFFAOYSA-N 1 2 323.421 4.359 20 0 DIADLO Cc1ccc(O[C@@H](C)c2nc(CCc3[nH+]cccc3C)no2)cc1 ZINC000518908483 335698925 /nfs/dbraw/zinc/69/89/25/335698925.db2.gz ALJJNZXCBYTTNA-HNNXBMFYSA-N 1 2 323.396 4.007 20 0 DIADLO CC(C)Sc1ccc(C(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC000350146306 335730801 /nfs/dbraw/zinc/73/08/01/335730801.db2.gz LHVYLBYVFJXFLN-UHFFFAOYSA-N 1 2 311.410 4.087 20 0 DIADLO Cc1cccc(C2(C(=O)Nc3ccc(-c4c[nH]c[nH+]4)cc3)CC2)c1 ZINC000519059564 335791476 /nfs/dbraw/zinc/79/14/76/335791476.db2.gz CQNPCXBLXFOWAB-UHFFFAOYSA-N 1 2 317.392 4.055 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)Cc2cccc(Cl)c2)c(C)[nH+]1 ZINC000535898389 335799275 /nfs/dbraw/zinc/79/92/75/335799275.db2.gz OBJOYQZRBSJAJY-NSHDSACASA-N 1 2 302.805 4.169 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)no1 ZINC000097079501 335839469 /nfs/dbraw/zinc/83/94/69/335839469.db2.gz RFEIHHKSNTWZNL-KRWDZBQOSA-N 1 2 319.424 4.428 20 0 DIADLO Cc1cc(NC(=O)c2cccc(OC3CCCCC3)c2)c(C)c[nH+]1 ZINC000536575008 335840621 /nfs/dbraw/zinc/84/06/21/335840621.db2.gz ARDOJWDOMYCVJE-UHFFFAOYSA-N 1 2 324.424 4.084 20 0 DIADLO O=C(C[C@@H]1CC[C@H]2C[C@H]21)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000519521167 335870016 /nfs/dbraw/zinc/87/00/16/335870016.db2.gz QUQIAQZFACGFOO-SUNYJGFJSA-N 1 2 308.381 4.249 20 0 DIADLO CC(C)=C(F)c1nc(Cn2c3ccccc3[nH+]c2C(C)C)no1 ZINC000445658268 338504924 /nfs/dbraw/zinc/50/49/24/338504924.db2.gz RBXJLZUFQVXITL-UHFFFAOYSA-N 1 2 314.364 4.311 20 0 DIADLO CCc1cc(C[NH2+][C@@H](CC)c2ccccc2Br)on1 ZINC000532232674 335922384 /nfs/dbraw/zinc/92/23/84/335922384.db2.gz WQUOMYFULSYRHR-HNNXBMFYSA-N 1 2 323.234 4.240 20 0 DIADLO CC(C)c1nc(N2CCCC[C@@H]2c2nc3ccccc3o2)cc[nH+]1 ZINC000329274291 335958495 /nfs/dbraw/zinc/95/84/95/335958495.db2.gz IKHUOWSMDVOJAT-OAHLLOKOSA-N 1 2 322.412 4.473 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cccc3c2OC(C)(C)C3)s1 ZINC000354011264 336015139 /nfs/dbraw/zinc/01/51/39/336015139.db2.gz UXJQUPHOIPGKBE-UHFFFAOYSA-N 1 2 316.470 4.051 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cccc3c2OC(C)(C)C3)s1 ZINC000354011264 336015140 /nfs/dbraw/zinc/01/51/40/336015140.db2.gz UXJQUPHOIPGKBE-UHFFFAOYSA-N 1 2 316.470 4.051 20 0 DIADLO Fc1c[nH+]ccc1NCc1cc(Br)c(Cl)s1 ZINC000192150038 336019857 /nfs/dbraw/zinc/01/98/57/336019857.db2.gz KROHQPWTRYRURP-UHFFFAOYSA-N 1 2 321.602 4.310 20 0 DIADLO Cc1c([C@H](C)Nc2cc(C(C)(C)C)[nH+]c(C(C)C)n2)cnn1C ZINC000192275802 336024540 /nfs/dbraw/zinc/02/45/40/336024540.db2.gz CTDOQBRTWUZXSR-LBPRGKRZSA-N 1 2 315.465 4.113 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCc3ccccc3[C@@H]2C)s1 ZINC000351475980 336036456 /nfs/dbraw/zinc/03/64/56/336036456.db2.gz HJKYEQSBXVZFGT-LBPRGKRZSA-N 1 2 304.484 4.125 20 0 DIADLO CSCc1cnc(C[N@H+]2CCc3ccccc3[C@@H]2C)s1 ZINC000351475980 336036458 /nfs/dbraw/zinc/03/64/58/336036458.db2.gz HJKYEQSBXVZFGT-LBPRGKRZSA-N 1 2 304.484 4.125 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(C2CCCCC2)n1 ZINC000329678170 336037621 /nfs/dbraw/zinc/03/76/21/336037621.db2.gz VMEPCYXGZVWNIR-UHFFFAOYSA-N 1 2 310.401 4.078 20 0 DIADLO CC(C)c1[nH]ccc1C(=O)Nc1ccc2[nH+]c(N(C)C)ccc2c1 ZINC000351530722 336040877 /nfs/dbraw/zinc/04/08/77/336040877.db2.gz AWAJXLXMSAGEKU-UHFFFAOYSA-N 1 2 322.412 4.005 20 0 DIADLO CC(C)Sc1cccc(Cl)c1CNc1cccc(CO)[nH+]1 ZINC000351570368 336045847 /nfs/dbraw/zinc/04/58/47/336045847.db2.gz ZEMACQZNQKESRX-UHFFFAOYSA-N 1 2 322.861 4.340 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2ccc(SC(C)C)cc2)no1 ZINC000351572198 336046119 /nfs/dbraw/zinc/04/61/19/336046119.db2.gz CHNYPRQCSBVMDK-NEPJUHHUSA-N 1 2 305.447 4.290 20 0 DIADLO COCC[N@H+](Cc1ccco1)Cc1c(Cl)oc2ccccc21 ZINC000351585648 336047334 /nfs/dbraw/zinc/04/73/34/336047334.db2.gz SGZSIHHGKRTOMS-UHFFFAOYSA-N 1 2 319.788 4.328 20 0 DIADLO COCC[N@@H+](Cc1ccco1)Cc1c(Cl)oc2ccccc21 ZINC000351585648 336047336 /nfs/dbraw/zinc/04/73/36/336047336.db2.gz SGZSIHHGKRTOMS-UHFFFAOYSA-N 1 2 319.788 4.328 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1cccc(O)c1Cl)CCC2 ZINC000351605286 336049442 /nfs/dbraw/zinc/04/94/42/336049442.db2.gz YQGUDPQCGSFOEE-ZDUSSCGKSA-N 1 2 322.861 4.320 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cccc(O)c1Cl)CCC2 ZINC000351605286 336049443 /nfs/dbraw/zinc/04/94/43/336049443.db2.gz YQGUDPQCGSFOEE-ZDUSSCGKSA-N 1 2 322.861 4.320 20 0 DIADLO Cc1ccccc1Cc1nnc(C[N@@H+](C)[C@H](C)c2ccccc2)o1 ZINC000351619913 336051157 /nfs/dbraw/zinc/05/11/57/336051157.db2.gz OAQLCVGFNOUBFT-MRXNPFEDSA-N 1 2 321.424 4.162 20 0 DIADLO Cc1ccccc1Cc1nnc(C[N@H+](C)[C@H](C)c2ccccc2)o1 ZINC000351619913 336051158 /nfs/dbraw/zinc/05/11/58/336051158.db2.gz OAQLCVGFNOUBFT-MRXNPFEDSA-N 1 2 321.424 4.162 20 0 DIADLO COc1ccc(C[N@H+](Cc2nccs2)Cc2ccccc2)cc1 ZINC000351673997 336056876 /nfs/dbraw/zinc/05/68/76/336056876.db2.gz OGNIRDFKWJRNOQ-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO COc1ccc(C[N@@H+](Cc2nccs2)Cc2ccccc2)cc1 ZINC000351673997 336056877 /nfs/dbraw/zinc/05/68/77/336056877.db2.gz OGNIRDFKWJRNOQ-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO Cc1cc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)c(C)n1C ZINC000351747222 336064563 /nfs/dbraw/zinc/06/45/63/336064563.db2.gz IUFLNGVJGKNANX-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)[C@H](C)c3ccccn3)cs2)o1 ZINC000351759318 336065702 /nfs/dbraw/zinc/06/57/02/336065702.db2.gz SBEIWQOSVQXJNI-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)[C@H](C)c3ccccn3)cs2)o1 ZINC000351759318 336065703 /nfs/dbraw/zinc/06/57/03/336065703.db2.gz SBEIWQOSVQXJNI-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)[C@H](C)c3ccccn3)co2)cc1 ZINC000351794383 336069465 /nfs/dbraw/zinc/06/94/65/336069465.db2.gz BBWSRVJKOCGAKS-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)[C@H](C)c3ccccn3)co2)cc1 ZINC000351794383 336069467 /nfs/dbraw/zinc/06/94/67/336069467.db2.gz BBWSRVJKOCGAKS-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1nnc2n1CCCCC2)c1cc2ccccc2o1 ZINC000324181624 336103283 /nfs/dbraw/zinc/10/32/83/336103283.db2.gz HWKWTQIWOJMECS-KBPBESRZSA-N 1 2 324.428 4.163 20 0 DIADLO CCc1ccc([C@H]2CCC[N@@H+]2[C@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331403835 336134758 /nfs/dbraw/zinc/13/47/58/336134758.db2.gz NSPHKJUDNONMJR-TZMCWYRMSA-N 1 2 317.433 4.421 20 0 DIADLO CCc1ccc([C@H]2CCC[N@H+]2[C@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331403835 336134760 /nfs/dbraw/zinc/13/47/60/336134760.db2.gz NSPHKJUDNONMJR-TZMCWYRMSA-N 1 2 317.433 4.421 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2[C@@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331405991 336135179 /nfs/dbraw/zinc/13/51/79/336135179.db2.gz OCZQKWFWINJASN-QWHCGFSZSA-N 1 2 303.406 4.167 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2[C@@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331405991 336135180 /nfs/dbraw/zinc/13/51/80/336135180.db2.gz OCZQKWFWINJASN-QWHCGFSZSA-N 1 2 303.406 4.167 20 0 DIADLO CCc1ccc(NC(=O)N2CCCC[C@H]2c2[nH]cc[nH+]2)cc1C ZINC000331977049 336154956 /nfs/dbraw/zinc/15/49/56/336154956.db2.gz APKUXONJNDBARJ-INIZCTEOSA-N 1 2 312.417 4.040 20 0 DIADLO CC[C@H]1Cc2ccccc2CN1C(=O)Nc1c(C)cc[nH+]c1C ZINC000351923676 336178929 /nfs/dbraw/zinc/17/89/29/336178929.db2.gz ZOKXTFKYLUOVHY-KRWDZBQOSA-N 1 2 309.413 4.067 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1C[C@@H]1c1ccc(Cl)cc1 ZINC000351930622 336180431 /nfs/dbraw/zinc/18/04/31/336180431.db2.gz IMBKIVROQGOOHE-HUUCEWRRSA-N 1 2 315.804 4.029 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@H]2c2nccs2)cc1C ZINC000351940226 336181754 /nfs/dbraw/zinc/18/17/54/336181754.db2.gz AFTUKEGYNJWNNI-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@H]2c2nccs2)cc1C ZINC000351940226 336181756 /nfs/dbraw/zinc/18/17/56/336181756.db2.gz AFTUKEGYNJWNNI-HNNXBMFYSA-N 1 2 304.484 4.050 20 0 DIADLO C[N@H+](Cc1ncc(Cl)s1)Cc1cccc(C(F)(F)F)c1 ZINC000351996581 336187002 /nfs/dbraw/zinc/18/70/02/336187002.db2.gz POLGCLKGTCGTCK-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1ncc(Cl)s1)Cc1cccc(C(F)(F)F)c1 ZINC000351996581 336187004 /nfs/dbraw/zinc/18/70/04/336187004.db2.gz POLGCLKGTCGTCK-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO Cc1cnc(C[N@H+]2CC=C(c3c(F)cccc3F)CC2)s1 ZINC000352018672 336189506 /nfs/dbraw/zinc/18/95/06/336189506.db2.gz AYRMDHSRKZSBKD-UHFFFAOYSA-N 1 2 306.381 4.019 20 0 DIADLO Cc1cnc(C[N@@H+]2CC=C(c3c(F)cccc3F)CC2)s1 ZINC000352018672 336189507 /nfs/dbraw/zinc/18/95/07/336189507.db2.gz AYRMDHSRKZSBKD-UHFFFAOYSA-N 1 2 306.381 4.019 20 0 DIADLO Cn1c[nH+]cc1CNc1ccccc1Nc1c(F)cccc1F ZINC000352035271 336190920 /nfs/dbraw/zinc/19/09/20/336190920.db2.gz OQWTXZXMJYBPIJ-UHFFFAOYSA-N 1 2 314.339 4.054 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CCCc3sccc32)c(C)[nH+]1 ZINC000333014231 336196724 /nfs/dbraw/zinc/19/67/24/336196724.db2.gz BTKXSHBMKOODID-CQSZACIVSA-N 1 2 315.442 4.267 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)[C@@H](C)[C@H](C)O1 ZINC000526121303 336213052 /nfs/dbraw/zinc/21/30/52/336213052.db2.gz JFKWKJXMDHWSQI-RDBSUJKOSA-N 1 2 308.491 4.189 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)[C@@H](C)[C@H](C)O1 ZINC000526121303 336213053 /nfs/dbraw/zinc/21/30/53/336213053.db2.gz JFKWKJXMDHWSQI-RDBSUJKOSA-N 1 2 308.491 4.189 20 0 DIADLO c1nc2c(s1)C[N@H+](Cc1cnc(C3CCCCC3)s1)CC2 ZINC000526121382 336213060 /nfs/dbraw/zinc/21/30/60/336213060.db2.gz VALBAAMCPSCTMO-UHFFFAOYSA-N 1 2 319.499 4.206 20 0 DIADLO c1nc2c(s1)C[N@@H+](Cc1cnc(C3CCCCC3)s1)CC2 ZINC000526121382 336213061 /nfs/dbraw/zinc/21/30/61/336213061.db2.gz VALBAAMCPSCTMO-UHFFFAOYSA-N 1 2 319.499 4.206 20 0 DIADLO Fc1cc(C[N@@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)ccc1Cl ZINC000352429230 336218148 /nfs/dbraw/zinc/21/81/48/336218148.db2.gz ATLUFVKMIVLWOT-CVEARBPZSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cc(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)ccc1Cl ZINC000352429230 336218149 /nfs/dbraw/zinc/21/81/49/336218149.db2.gz ATLUFVKMIVLWOT-CVEARBPZSA-N 1 2 309.812 4.013 20 0 DIADLO CCn1cc[nH+]c1CN(Cc1ccc(F)cc1Cl)CC1CC1 ZINC000352544318 336223612 /nfs/dbraw/zinc/22/36/12/336223612.db2.gz QBALMSNESKDUHP-UHFFFAOYSA-N 1 2 321.827 4.108 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1cc(F)ccc1Br ZINC000352672515 336229802 /nfs/dbraw/zinc/22/98/02/336229802.db2.gz SXJZGXZOCLIEEY-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1cc(F)ccc1Br ZINC000352672515 336229803 /nfs/dbraw/zinc/22/98/03/336229803.db2.gz SXJZGXZOCLIEEY-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO CCSCc1cc[nH+]c(N[C@H](C)Cc2ccc(O)cc2)c1 ZINC000352704874 336231594 /nfs/dbraw/zinc/23/15/94/336231594.db2.gz LTICRBCLYNQTIB-CYBMUJFWSA-N 1 2 302.443 4.083 20 0 DIADLO CCc1ccc(C[NH2+][C@H](c2cccc(F)c2)c2ccccn2)cn1 ZINC000352741954 336232657 /nfs/dbraw/zinc/23/26/57/336232657.db2.gz KJHDBZGUXYXZME-HXUWFJFHSA-N 1 2 321.399 4.057 20 0 DIADLO CCc1ccc(C[NH2+][C@H](c2ccco2)c2ccccc2OC)cn1 ZINC000352747679 336234540 /nfs/dbraw/zinc/23/45/40/336234540.db2.gz FZFFLGYHIJKBGV-FQEVSTJZSA-N 1 2 322.408 4.125 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C3CC3)no2)cc1 ZINC000103499726 336242083 /nfs/dbraw/zinc/24/20/83/336242083.db2.gz NNSUZHNSGTWDDB-VXGBXAGGSA-N 1 2 317.458 4.471 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccc(F)cc1Cl ZINC000103966776 336244106 /nfs/dbraw/zinc/24/41/06/336244106.db2.gz DJKJHQJBTPMJSE-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](c2ccccc2)c2cccc(F)c2)o1 ZINC000532369326 336244692 /nfs/dbraw/zinc/24/46/92/336244692.db2.gz VRLNZTCPHBEXBP-IBGZPJMESA-N 1 2 310.372 4.255 20 0 DIADLO Cc1ccc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)nc1 ZINC000532393536 336245286 /nfs/dbraw/zinc/24/52/86/336245286.db2.gz AWLGEKRBRZUQMN-UHFFFAOYSA-N 1 2 307.224 4.476 20 0 DIADLO Cc1nc(C[NH2+][C@@H](CC(C)C)c2ccccn2)nc2ccccc12 ZINC000532490353 336250330 /nfs/dbraw/zinc/25/03/30/336250330.db2.gz UYMBBEGKLACASA-IBGZPJMESA-N 1 2 320.440 4.210 20 0 DIADLO CC(C)c1ccc([C@@H](C)[NH2+]Cc2n[nH]cc2Br)cc1 ZINC000532502705 336252302 /nfs/dbraw/zinc/25/23/02/336252302.db2.gz BZKKZMVRZLCYNF-LLVKDONJSA-N 1 2 322.250 4.146 20 0 DIADLO CCN(Cc1c[nH]c2ccccc12)C(=O)Nc1ccc(C)[nH+]c1C ZINC000190086436 336258947 /nfs/dbraw/zinc/25/89/47/336258947.db2.gz YGDAPRYDGKXPAF-UHFFFAOYSA-N 1 2 322.412 4.234 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc(F)cc1F ZINC000192751591 336260609 /nfs/dbraw/zinc/26/06/09/336260609.db2.gz LYMFGSIRWXQOCS-GFCCVEGCSA-N 1 2 303.356 4.133 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1scnc1C ZINC000167826634 336264202 /nfs/dbraw/zinc/26/42/02/336264202.db2.gz GUCFHZHFISZTMI-UHFFFAOYSA-N 1 2 306.822 4.087 20 0 DIADLO CCc1cnc(C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)o1 ZINC000532735974 336268799 /nfs/dbraw/zinc/26/87/99/336268799.db2.gz NCRNYUMOCBKENN-UHFFFAOYSA-N 1 2 302.805 4.180 20 0 DIADLO CCc1cnc(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)o1 ZINC000532735974 336268800 /nfs/dbraw/zinc/26/88/00/336268800.db2.gz NCRNYUMOCBKENN-UHFFFAOYSA-N 1 2 302.805 4.180 20 0 DIADLO COc1cc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc(OC)c1 ZINC000192901993 336283018 /nfs/dbraw/zinc/28/30/18/336283018.db2.gz UIDGHKQRWCHTKC-CQSZACIVSA-N 1 2 323.396 4.063 20 0 DIADLO CC(C)c1nc2n(n1)CCC[C@H]2[NH2+][C@H](C)c1cc2ccccc2o1 ZINC000168037533 336285755 /nfs/dbraw/zinc/28/57/55/336285755.db2.gz OBSSVFVEXKTAJB-UKRRQHHQSA-N 1 2 324.428 4.333 20 0 DIADLO c1nn(-c2ccccc2)cc1CNc1ccc2ccccc2[nH+]1 ZINC000301067544 336288194 /nfs/dbraw/zinc/28/81/94/336288194.db2.gz GGKXMQZMBYMUGI-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO CCc1cc(N2CCC[C@H]2C2CCCC2)nc(-c2ccncc2)[nH+]1 ZINC000301153969 336292319 /nfs/dbraw/zinc/29/23/19/336292319.db2.gz ABZJLUWWDNBDFQ-SFHVURJKSA-N 1 2 322.456 4.260 20 0 DIADLO Cc1[nH+]c(-c2ccncc2)nc(NCc2cccc(Cl)c2)c1C ZINC000301183668 336293743 /nfs/dbraw/zinc/29/37/43/336293743.db2.gz QKKGPQDJSJFTDB-UHFFFAOYSA-N 1 2 324.815 4.421 20 0 DIADLO COc1ccc2[nH+]c(N[C@H]3CCOc4ccc(F)cc43)ccc2c1 ZINC000301192870 336294325 /nfs/dbraw/zinc/29/43/25/336294325.db2.gz ITKHFTXILRJNPA-KRWDZBQOSA-N 1 2 324.355 4.318 20 0 DIADLO CCc1cc(N(C)Cc2ccc(C)s2)nc(-c2ccncc2)[nH+]1 ZINC000301204654 336294819 /nfs/dbraw/zinc/29/48/19/336294819.db2.gz PDTOCHPHOKSEIM-UHFFFAOYSA-N 1 2 324.453 4.107 20 0 DIADLO Cc1cc(NC2CCN(c3ccc(C(C)(C)C)cc3)CC2)nc[nH+]1 ZINC000301229491 336295861 /nfs/dbraw/zinc/29/58/61/336295861.db2.gz HAKGTPIIAVGIJF-UHFFFAOYSA-N 1 2 324.472 4.163 20 0 DIADLO Cc1cccc(CNc2nc(-c3ccncc3)[nH+]c(C)c2C)c1 ZINC000301236348 336296076 /nfs/dbraw/zinc/29/60/76/336296076.db2.gz DFRNPXTYNOFFTD-UHFFFAOYSA-N 1 2 304.397 4.076 20 0 DIADLO CN(Cc1ccccc1C(F)(F)F)c1cc[nH+]c(C2CC2)n1 ZINC000301235376 336296137 /nfs/dbraw/zinc/29/61/37/336296137.db2.gz KBEYGUQDIJNRLF-UHFFFAOYSA-N 1 2 307.319 4.009 20 0 DIADLO c1ccc(Nc2ccc(Nc3ccnc(C4CC4)n3)c[nH+]2)cc1 ZINC000301260824 336297325 /nfs/dbraw/zinc/29/73/25/336297325.db2.gz UZZMMYZMRHBZFC-UHFFFAOYSA-N 1 2 303.369 4.236 20 0 DIADLO COc1cc([C@H](C)Nc2cc(C)[nH+]cn2)ccc1OCC(C)C ZINC000301265494 336297587 /nfs/dbraw/zinc/29/75/87/336297587.db2.gz TZOATZMNNLWTNA-AWEZNQCLSA-N 1 2 315.417 4.002 20 0 DIADLO Cc1cc([C@@H](C)Nc2cc(N3CCC[C@H](C)C3)nc[nH+]2)c(C)o1 ZINC000301265561 336297599 /nfs/dbraw/zinc/29/75/99/336297599.db2.gz UBIHPYXJXDEZHI-GXTWGEPZSA-N 1 2 314.433 4.096 20 0 DIADLO Cc1cc([C@@H](C)Nc2cc(N3CCC[C@H](C)C3)[nH+]cn2)c(C)o1 ZINC000301265561 336297600 /nfs/dbraw/zinc/29/76/00/336297600.db2.gz UBIHPYXJXDEZHI-GXTWGEPZSA-N 1 2 314.433 4.096 20 0 DIADLO Cc1cc(NCc2cccc(COCc3ccccc3)c2)nc[nH+]1 ZINC000301279387 336298405 /nfs/dbraw/zinc/29/84/05/336298405.db2.gz XECMACQWTJNXSW-UHFFFAOYSA-N 1 2 319.408 4.114 20 0 DIADLO CC(C)Oc1ccc([C@H](O)CNc2ccc3ccccc3[nH+]2)cc1 ZINC000301323100 336300681 /nfs/dbraw/zinc/30/06/81/336300681.db2.gz VHNNYUUETNKVFL-LJQANCHMSA-N 1 2 322.408 4.168 20 0 DIADLO CCc1cc(N2[C@H](C)C[C@@H]3CCCC[C@@H]32)nc(-c2ccncc2)[nH+]1 ZINC000301349996 336302005 /nfs/dbraw/zinc/30/20/05/336302005.db2.gz JMXOMOGNTYPROB-HFTRVMKXSA-N 1 2 322.456 4.258 20 0 DIADLO Clc1ccc2c(c1)ncnc2Oc1cccc(-n2cc[nH+]c2)c1 ZINC000301373110 336303219 /nfs/dbraw/zinc/30/32/19/336303219.db2.gz RCZMFECUIBAWDW-UHFFFAOYSA-N 1 2 322.755 4.261 20 0 DIADLO C[C@H]1CN(c2cc(C(F)(F)F)cc[nH+]2)C[C@@H](c2ccccc2)O1 ZINC000301456080 336307831 /nfs/dbraw/zinc/30/78/31/336307831.db2.gz WOCITLHCQPBJJK-WFASDCNBSA-N 1 2 322.330 4.067 20 0 DIADLO COc1ccc([C@H]2CCCN2c2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000301458286 336308152 /nfs/dbraw/zinc/30/81/52/336308152.db2.gz XUNDUECVZKXGDN-OAHLLOKOSA-N 1 2 322.330 4.451 20 0 DIADLO COc1cccc(C(Nc2cccc[nH+]2)c2cccc(OC)c2)c1 ZINC000301495467 336310334 /nfs/dbraw/zinc/31/03/34/336310334.db2.gz SOAXNDDZDIZGSZ-UHFFFAOYSA-N 1 2 320.392 4.300 20 0 DIADLO CCOc1ccc(CNc2cc(C(F)(F)F)cc[nH+]2)cc1F ZINC000301499456 336310617 /nfs/dbraw/zinc/31/06/17/336310617.db2.gz FGGOZWDNASXNTI-UHFFFAOYSA-N 1 2 314.282 4.250 20 0 DIADLO Fc1ccc2c(c1)[C@@H](Nc1cc(C(F)(F)F)cc[nH+]1)CCO2 ZINC000301512725 336311600 /nfs/dbraw/zinc/31/16/00/336311600.db2.gz KZOCHMMXMSSLDS-LBPRGKRZSA-N 1 2 312.266 4.175 20 0 DIADLO Fc1ccc2c(c1)[C@H](Nc1cc(C(F)(F)F)cc[nH+]1)CCO2 ZINC000301512723 336311613 /nfs/dbraw/zinc/31/16/13/336311613.db2.gz KZOCHMMXMSSLDS-GFCCVEGCSA-N 1 2 312.266 4.175 20 0 DIADLO Cc1cccc2[nH+]c(CNc3ncc(-c4ccccc4)s3)cn21 ZINC000301523094 336312212 /nfs/dbraw/zinc/31/22/12/336312212.db2.gz OIAOSRJMQVBGAI-UHFFFAOYSA-N 1 2 320.421 4.378 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N[C@@H]2CCCN(c3ccccc3)C2)c1 ZINC000301529889 336312739 /nfs/dbraw/zinc/31/27/39/336312739.db2.gz RIYULVCBHKSEEC-CQSZACIVSA-N 1 2 321.346 4.181 20 0 DIADLO Cc1cnc([C@H](Nc2cc(C(F)(F)F)cc[nH+]2)C2CC2)s1 ZINC000301557426 336314800 /nfs/dbraw/zinc/31/48/00/336314800.db2.gz NSXRUODYAQWERU-GFCCVEGCSA-N 1 2 313.348 4.429 20 0 DIADLO COc1cccc(F)c1[C@H](C)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000301561403 336315091 /nfs/dbraw/zinc/31/50/91/336315091.db2.gz OSHWWEXIXVCIMI-VIFPVBQESA-N 1 2 314.282 4.421 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NC[C@@H]2CCO[C@H]2c2ccccc2)c1 ZINC000301582197 336316363 /nfs/dbraw/zinc/31/63/63/336316363.db2.gz VCBKLNDENOJPHU-BBRMVZONSA-N 1 2 322.330 4.290 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NC[C@H]2CCO[C@@H]2c2ccccc2)c1 ZINC000301582200 336316389 /nfs/dbraw/zinc/31/63/89/336316389.db2.gz VCBKLNDENOJPHU-CZUORRHYSA-N 1 2 322.330 4.290 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CC[C@H](Nc2ccccc2)C1 ZINC000301581932 336316445 /nfs/dbraw/zinc/31/64/45/336316445.db2.gz SXOMNCAHRFMGMA-SFHVURJKSA-N 1 2 303.409 4.234 20 0 DIADLO COc1cccc(F)c1[C@H](C)Nc1cc[nH+]c(C(C)(C)C)n1 ZINC000301607378 336318018 /nfs/dbraw/zinc/31/80/18/336318018.db2.gz ZEPBJSUVLHPMPT-NSHDSACASA-N 1 2 303.381 4.095 20 0 DIADLO Cc1csc(CCCCNc2cc(C)[nH+]c(C(C)C)n2)n1 ZINC000301628741 336319257 /nfs/dbraw/zinc/31/92/57/336319257.db2.gz IGIVVKJPFSJKAK-UHFFFAOYSA-N 1 2 304.463 4.108 20 0 DIADLO Clc1ccc(O[C@H]2CCN(c3cccc[nH+]3)C2)cc1Cl ZINC000301657739 336321229 /nfs/dbraw/zinc/32/12/29/336321229.db2.gz SMJHHZATYYGPDH-LBPRGKRZSA-N 1 2 309.196 4.046 20 0 DIADLO COc1ccc(CNc2cc(C)[nH+]c(C(C)C)n2)cc1Cl ZINC000301656542 336321257 /nfs/dbraw/zinc/32/12/57/336321257.db2.gz BAOAYBHMKKXZEO-UHFFFAOYSA-N 1 2 305.809 4.183 20 0 DIADLO COCc1ccc(CNc2cc(C)[nH+]c3c(F)cccc23)cc1 ZINC000301661351 336321401 /nfs/dbraw/zinc/32/14/01/336321401.db2.gz JPEJMEDPJNTERQ-UHFFFAOYSA-N 1 2 310.372 4.441 20 0 DIADLO Cc1cc(NCc2ccc(Cl)nc2)c2cccc(F)c2[nH+]1 ZINC000301666145 336322072 /nfs/dbraw/zinc/32/20/72/336322072.db2.gz LODPMUDKGQYAIY-UHFFFAOYSA-N 1 2 301.752 4.343 20 0 DIADLO Cc1nc(N2CC[C@@H](CSc3ccccc3)C2)c(C)c(C)[nH+]1 ZINC000301692418 336323739 /nfs/dbraw/zinc/32/37/39/336323739.db2.gz OGAGSFVVWWYZHM-MRXNPFEDSA-N 1 2 313.470 4.020 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCO[C@H](c2cccs2)C1 ZINC000301704516 336324501 /nfs/dbraw/zinc/32/45/01/336324501.db2.gz FYWLNSWILUDACN-INIZCTEOSA-N 1 2 310.422 4.183 20 0 DIADLO COCc1cc(CNc2[nH+]c3ccccc3cc2C)ccc1F ZINC000301704467 336324526 /nfs/dbraw/zinc/32/45/26/336324526.db2.gz FWEPJMVGHGXOKJ-UHFFFAOYSA-N 1 2 310.372 4.441 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N[C@@H]1CCO[C@]2(CCSC2)C1 ZINC000301718178 336325375 /nfs/dbraw/zinc/32/53/75/336325375.db2.gz LHYCQEILEUYSBI-CRAIPNDOSA-N 1 2 314.454 4.010 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N[C@H]1CCO[C@]2(CCSC2)C1 ZINC000301718179 336325420 /nfs/dbraw/zinc/32/54/20/336325420.db2.gz LHYCQEILEUYSBI-MAUKXSAKSA-N 1 2 314.454 4.010 20 0 DIADLO COc1ccc(CNc2cc(C(F)(F)F)cc[nH+]2)cc1Cl ZINC000301721309 336325593 /nfs/dbraw/zinc/32/55/93/336325593.db2.gz QLQHITHVWBXHAN-UHFFFAOYSA-N 1 2 316.710 4.375 20 0 DIADLO C[C@@H](Nc1nc(N)c2ccccc2[nH+]1)c1cc2ccccc2o1 ZINC000301796638 336330592 /nfs/dbraw/zinc/33/05/92/336330592.db2.gz QOAZPLVKAHOXTL-LLVKDONJSA-N 1 2 304.353 4.131 20 0 DIADLO Cc1nc(CN(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)cs1 ZINC000301833278 336332933 /nfs/dbraw/zinc/33/29/33/336332933.db2.gz UTCAZKIMUTXBHC-UHFFFAOYSA-N 1 2 304.463 4.125 20 0 DIADLO CCc1noc(CC)c1CNc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC000301847952 336333915 /nfs/dbraw/zinc/33/39/15/336333915.db2.gz CDWGCANBADLXKF-UHFFFAOYSA-N 1 2 316.449 4.448 20 0 DIADLO CCc1nc(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)cs1 ZINC000301876036 336335665 /nfs/dbraw/zinc/33/56/65/336335665.db2.gz SABVGPNYKJIRGG-UHFFFAOYSA-N 1 2 304.463 4.354 20 0 DIADLO CC(C)c1cc(N[C@@H]2CCC[C@@H]3OCC[C@@H]32)nc(C(C)C)[nH+]1 ZINC000301875922 336335682 /nfs/dbraw/zinc/33/56/82/336335682.db2.gz RWMQJRWWECCXGT-FMKPAKJESA-N 1 2 303.450 4.093 20 0 DIADLO CC(C)c1cc(N[C@@H]2CCC[C@H]3OCC[C@H]32)nc(C(C)C)[nH+]1 ZINC000301875925 336335703 /nfs/dbraw/zinc/33/57/03/336335703.db2.gz RWMQJRWWECCXGT-SQWLQELKSA-N 1 2 303.450 4.093 20 0 DIADLO Cc1noc(C)c1CCCNc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC000301882519 336336090 /nfs/dbraw/zinc/33/60/90/336336090.db2.gz WXXZXCWVNHBZSJ-UHFFFAOYSA-N 1 2 316.449 4.373 20 0 DIADLO O[C@@H](CNc1ccc2ccccc2[nH+]1)c1ccc(Cl)c(F)c1 ZINC000301885492 336336296 /nfs/dbraw/zinc/33/62/96/336336296.db2.gz OTBQZNCNSTURBA-INIZCTEOSA-N 1 2 316.763 4.173 20 0 DIADLO C[C@@H](CCNc1[nH+]cnc2c1cnn2C(C)(C)C)c1ccccc1 ZINC000301898670 336336956 /nfs/dbraw/zinc/33/69/56/336336956.db2.gz SJSFEVISKQEBJP-AWEZNQCLSA-N 1 2 323.444 4.187 20 0 DIADLO COC[C@@H](Nc1cc(C)[nH+]c2c(F)cccc12)c1ccccc1 ZINC000301922388 336338166 /nfs/dbraw/zinc/33/81/66/336338166.db2.gz DXEMWQMWNYHQHB-GOSISDBHSA-N 1 2 310.372 4.482 20 0 DIADLO Cc1cc(NCc2ccc(Cl)cn2)c2cccc(F)c2[nH+]1 ZINC000301982036 336341214 /nfs/dbraw/zinc/34/12/14/336341214.db2.gz BGESKPUOJJSDNR-UHFFFAOYSA-N 1 2 301.752 4.343 20 0 DIADLO CCc1cc(N2CCCC[C@@H]2C(C)C)nc(-c2ccncc2)[nH+]1 ZINC000301991202 336341770 /nfs/dbraw/zinc/34/17/70/336341770.db2.gz YGCOFFYQKAAFIS-QGZVFWFLSA-N 1 2 310.445 4.116 20 0 DIADLO CN(Cc1cc(F)c(F)c(F)c1)c1cc(C(F)(F)F)cc[nH+]1 ZINC000302036247 336344504 /nfs/dbraw/zinc/34/45/04/336344504.db2.gz MBAJIVCLSPVAGV-UHFFFAOYSA-N 1 2 320.236 4.154 20 0 DIADLO Clc1ccc2c(c1)OCCC[C@H]2Nc1cc[nH+]c(C2CC2)n1 ZINC000302035789 336344565 /nfs/dbraw/zinc/34/45/65/336344565.db2.gz UQPRVWQSMDNGHS-CQSZACIVSA-N 1 2 315.804 4.333 20 0 DIADLO Cc1nc(N2CCC[C@@H]2c2cccc(F)c2)c2c([nH+]1)CCCC2 ZINC000302067141 336346684 /nfs/dbraw/zinc/34/66/84/336346684.db2.gz WOBWGROGMPDDNQ-GOSISDBHSA-N 1 2 311.404 4.144 20 0 DIADLO CC(C)c1nc(N[C@H]2CCCOc3cc(F)ccc32)cc[nH+]1 ZINC000302074750 336347125 /nfs/dbraw/zinc/34/71/25/336347125.db2.gz XFEPKVAMLUQKKO-AWEZNQCLSA-N 1 2 301.365 4.065 20 0 DIADLO CCC(CC)[C@@H]1C[C@H](Nc2cc(C(F)(F)F)cc[nH+]2)CCO1 ZINC000302081866 336347512 /nfs/dbraw/zinc/34/75/12/336347512.db2.gz YDCWSDMNGNODFR-KGLIPLIRSA-N 1 2 316.367 4.496 20 0 DIADLO Clc1ccc(Br)c2c1CN(c1cccc[nH+]1)CC2 ZINC000302203151 336353803 /nfs/dbraw/zinc/35/38/03/336353803.db2.gz UEUJQHMHPZLXPD-UHFFFAOYSA-N 1 2 323.621 4.060 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2Cc3ccccc3C3(CC3)C2)c1 ZINC000302374535 336357659 /nfs/dbraw/zinc/35/76/59/336357659.db2.gz CSEAETVZUIRATM-UHFFFAOYSA-N 1 2 304.315 4.152 20 0 DIADLO COc1ccc2[nH+]c(NCc3ccc(C(C)(C)O)cc3)ccc2c1 ZINC000302439574 336358906 /nfs/dbraw/zinc/35/89/06/336358906.db2.gz RAJGOVIMDVBKNZ-UHFFFAOYSA-N 1 2 322.408 4.083 20 0 DIADLO COc1cccc2c(N3C[C@@H](C)C[C@@H]3c3cccnc3)cc[nH+]c12 ZINC000302523727 336360831 /nfs/dbraw/zinc/36/08/31/336360831.db2.gz JJXHLECGOACUMA-KBXCAEBGSA-N 1 2 319.408 4.226 20 0 DIADLO COc1cccc2c(NCc3nccn3CC(C)C)c(C)c[nH+]c12 ZINC000302683764 336364836 /nfs/dbraw/zinc/36/48/36/336364836.db2.gz XRGBWGPAZYJPNA-UHFFFAOYSA-N 1 2 324.428 4.016 20 0 DIADLO CC(C)c1nc(N[C@H](CO)c2ccccc2)cc(C(C)(C)C)[nH+]1 ZINC000302783090 336368892 /nfs/dbraw/zinc/36/88/92/336368892.db2.gz KTVHXYJIKLQRNY-OAHLLOKOSA-N 1 2 313.445 4.043 20 0 DIADLO CC(C)c1nc(N[C@H]2CCO[C@H](C3CC3)C2)cc(C(C)(C)C)[nH+]1 ZINC000302840292 336371657 /nfs/dbraw/zinc/37/16/57/336371657.db2.gz LKTYEVLKAPHISH-GJZGRUSLSA-N 1 2 317.477 4.267 20 0 DIADLO Cc1cccc([C@H]2CCCCN2c2nc[nH+]c(N)c2Cl)c1C ZINC000302876256 336372899 /nfs/dbraw/zinc/37/28/99/336372899.db2.gz FLRMNFCFBMAELX-CQSZACIVSA-N 1 2 316.836 4.061 20 0 DIADLO Cc1oc2ccccc2c1C[NH2+]Cc1c(F)ccc(O)c1F ZINC000352926822 336377628 /nfs/dbraw/zinc/37/76/28/336377628.db2.gz RPUNPMGLPLOBBV-UHFFFAOYSA-N 1 2 303.308 4.015 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+]Cc2ccc(C)cc2Cl)[nH]1 ZINC000514609238 336386171 /nfs/dbraw/zinc/38/61/71/336386171.db2.gz OKOZXQXXKHYIBY-NWDGAFQWSA-N 1 2 306.841 4.131 20 0 DIADLO Cn1ccnc1[C@@H]([NH2+]Cc1c(Cl)oc2ccccc21)C1CC1 ZINC000353039598 336387822 /nfs/dbraw/zinc/38/78/22/336387822.db2.gz QTHGCEHEPSLYBN-HNNXBMFYSA-N 1 2 315.804 4.061 20 0 DIADLO Cc1cc(C(=O)Nc2ccc3[nH]c(C4CCC4)[nH+]c3c2)c(C)n1C ZINC000353045623 336390576 /nfs/dbraw/zinc/39/05/76/336390576.db2.gz PFIRFRUFJKIGFH-UHFFFAOYSA-N 1 2 322.412 4.038 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2sc(Br)cc21)C(C)(F)F ZINC000389437722 336390931 /nfs/dbraw/zinc/39/09/31/336390931.db2.gz FFSGWZYVVPGSSG-XPUUQOCRSA-N 1 2 310.207 4.131 20 0 DIADLO CCOc1ccc([C@@H]2CCCN2c2cc[nH+]c(C3CC3)n2)cc1 ZINC000110118722 336395768 /nfs/dbraw/zinc/39/57/68/336395768.db2.gz BSESTVJWLIBCCH-KRWDZBQOSA-N 1 2 309.413 4.094 20 0 DIADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1nc(C(C)(C)C)cs1 ZINC000110586609 336396938 /nfs/dbraw/zinc/39/69/38/336396938.db2.gz VAFRSTGWOYAMPI-SNVBAGLBSA-N 1 2 302.447 4.281 20 0 DIADLO CCn1c[nH+]cc1CNc1cc2sc(C)nc2cc1Cl ZINC000418049783 336397976 /nfs/dbraw/zinc/39/79/76/336397976.db2.gz URXMTKOMZLAKID-UHFFFAOYSA-N 1 2 306.822 4.087 20 0 DIADLO Brc1cccc2c(NCc3nccs3)cc[nH+]c12 ZINC000112074750 336399065 /nfs/dbraw/zinc/39/90/65/336399065.db2.gz AVPNVENCTGELOZ-UHFFFAOYSA-N 1 2 320.215 4.066 20 0 DIADLO CCn1cc(C[NH+]2Cc3ccccc3-c3ccccc3C2)cn1 ZINC000353151032 336404840 /nfs/dbraw/zinc/40/48/40/336404840.db2.gz DXYYROPZLPRHLX-UHFFFAOYSA-N 1 2 303.409 4.086 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1csc(C2CC2)n1 ZINC000353237825 336407706 /nfs/dbraw/zinc/40/77/06/336407706.db2.gz OGWWRRLWDLQZKM-UHFFFAOYSA-N 1 2 314.410 4.065 20 0 DIADLO CC(=O)Nc1ccc(NCCCc2ccc(C)[nH+]c2)cc1Cl ZINC000353850570 336443871 /nfs/dbraw/zinc/44/38/71/336443871.db2.gz QCWHBLYPGUJIRI-UHFFFAOYSA-N 1 2 317.820 4.047 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2n1)c1c(F)cncc1F ZINC000353934932 336450058 /nfs/dbraw/zinc/45/00/58/336450058.db2.gz RWGUPACSCYNOPL-NWDGAFQWSA-N 1 2 313.351 4.320 20 0 DIADLO COC[C@@H](Cc1ccccc1)Nc1[nH+]ccc2ccc(F)cc21 ZINC000354535756 336474002 /nfs/dbraw/zinc/47/40/02/336474002.db2.gz GBNRPMMCDVPUQO-QGZVFWFLSA-N 1 2 310.372 4.044 20 0 DIADLO Cn1cc[nH+]c1CNc1cccc(CSC2CCCC2)c1 ZINC000355465019 336510176 /nfs/dbraw/zinc/51/01/76/336510176.db2.gz LMYZWXOBVYUCJH-UHFFFAOYSA-N 1 2 301.459 4.208 20 0 DIADLO Cc1ccc(F)c(C[NH2+]Cc2nc3ccccc3n2C2CC2)c1 ZINC000355510984 336512484 /nfs/dbraw/zinc/51/24/84/336512484.db2.gz NCNDMCCYHARNHP-UHFFFAOYSA-N 1 2 309.388 4.109 20 0 DIADLO C/C(=C/c1nc(Cc2ccc(C)[nH+]c2)no1)c1ccc(F)cc1 ZINC000356118137 336536673 /nfs/dbraw/zinc/53/66/73/336536673.db2.gz XRPULJBBXFPZRP-XFXZXTDPSA-N 1 2 309.344 4.063 20 0 DIADLO Cc1ccc(Cc2noc(-c3cc4ccc(Cl)cc4[nH]3)n2)c[nH+]1 ZINC000356164244 336538957 /nfs/dbraw/zinc/53/89/57/336538957.db2.gz GLCSJNMCGDBSMM-UHFFFAOYSA-N 1 2 324.771 4.166 20 0 DIADLO Cc1c[nH+]c(CN2C[C@H](C)CSc3ccc(Cl)cc32)n1C ZINC000356335425 336546644 /nfs/dbraw/zinc/54/66/44/336546644.db2.gz DNRSOUCSCPPAIV-NSHDSACASA-N 1 2 321.877 4.130 20 0 DIADLO FC1(F)CCC12C[NH+](Cc1nc(-c3ccccc3)cs1)C2 ZINC000356529353 336553301 /nfs/dbraw/zinc/55/33/01/336553301.db2.gz QVUOISBVTDOHAY-UHFFFAOYSA-N 1 2 306.381 4.041 20 0 DIADLO CC1(C)CC[C@H](c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)C1 ZINC000356642538 336556967 /nfs/dbraw/zinc/55/69/67/336556967.db2.gz KCGWRLGYLZVHOX-AWEZNQCLSA-N 1 2 308.385 4.216 20 0 DIADLO COc1cccc2c(NCc3ccc4cc[nH]c4n3)c(C)c[nH+]c12 ZINC000357561915 336590700 /nfs/dbraw/zinc/59/07/00/336590700.db2.gz DNOWBBLESHZOJA-UHFFFAOYSA-N 1 2 318.380 4.040 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H]2CCCOc3ccc(F)cc32)cs1 ZINC000358027137 336607381 /nfs/dbraw/zinc/60/73/81/336607381.db2.gz VYMIHJKCBWESNB-QMTHXVAHSA-N 1 2 306.406 4.155 20 0 DIADLO Fc1ccc(-c2noc(-c3[nH+]c(C4CC4)n4ccccc34)n2)cc1 ZINC000358526547 336633588 /nfs/dbraw/zinc/63/35/88/336633588.db2.gz LGJPJFDZPWDWMC-UHFFFAOYSA-N 1 2 320.327 4.068 20 0 DIADLO Cc1ccc(CSCCOCCOc2ccccc2)c(C)[nH+]1 ZINC000358642624 336637941 /nfs/dbraw/zinc/63/79/41/336637941.db2.gz AGFCRVMEZISHOY-UHFFFAOYSA-N 1 2 317.454 4.027 20 0 DIADLO CC(C)c1ccccc1-n1ccnc1SCc1c[nH+]cn1C ZINC000360740562 336721126 /nfs/dbraw/zinc/72/11/26/336721126.db2.gz WORZWAGMZQTGDT-UHFFFAOYSA-N 1 2 312.442 4.022 20 0 DIADLO CCc1cccc2c(C3CCN(c4cc[nH+]c(C)n4)CC3)c[nH]c21 ZINC000360953119 336729322 /nfs/dbraw/zinc/72/93/22/336729322.db2.gz FOGQDPSHYMUFQL-UHFFFAOYSA-N 1 2 320.440 4.213 20 0 DIADLO COc1ccc(F)cc1CNc1c[nH+]ccc1OC(C)(C)C ZINC000360974676 336730398 /nfs/dbraw/zinc/73/03/98/336730398.db2.gz JUJXSBQTNMWLLL-UHFFFAOYSA-N 1 2 304.365 4.019 20 0 DIADLO c1cc(CNc2cccc3c2CN(c2cccc[nH+]2)C3)cs1 ZINC000361167001 336741966 /nfs/dbraw/zinc/74/19/66/336741966.db2.gz JJZRACUIMYXGHP-UHFFFAOYSA-N 1 2 307.422 4.275 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCOc2c(F)ccc(F)c21)c1ccccc1F ZINC000361177769 336742470 /nfs/dbraw/zinc/74/24/70/336742470.db2.gz JTDJFFDVSOZNIQ-BMIGLBTASA-N 1 2 307.315 4.278 20 0 DIADLO C[C@H]([NH2+][C@H]1CCOc2c(F)ccc(F)c21)c1ccc(Cl)cn1 ZINC000361182334 336742818 /nfs/dbraw/zinc/74/28/18/336742818.db2.gz YSGZYLUNHMPGQM-XPTSAGLGSA-N 1 2 324.758 4.188 20 0 DIADLO Fc1ccc(F)c2c1OCC[C@@H]2[NH2+]Cc1ccccc1Cl ZINC000361229385 336745431 /nfs/dbraw/zinc/74/54/31/336745431.db2.gz RDOXHHTYXHESEW-AWEZNQCLSA-N 1 2 309.743 4.232 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@H]2CCOc3c(F)ccc(F)c32)s1 ZINC000361253847 336747166 /nfs/dbraw/zinc/74/71/66/336747166.db2.gz VDFNFZXMDHLGTK-LBPRGKRZSA-N 1 2 324.396 4.158 20 0 DIADLO Cc1ccc(C(=O)N2CCC(C)=C(C)C2)cc1Oc1cc[nH+]cc1 ZINC000361347286 336752728 /nfs/dbraw/zinc/75/27/28/336752728.db2.gz UHJHBCWDTWHAOZ-UHFFFAOYSA-N 1 2 322.408 4.365 20 0 DIADLO C[C@H]([NH2+]Cc1cncc(C(F)(F)F)c1)c1c(F)cccc1F ZINC000361352212 336752931 /nfs/dbraw/zinc/75/29/31/336752931.db2.gz CZUPLHTXSSJXAH-VIFPVBQESA-N 1 2 316.273 4.229 20 0 DIADLO CCCOc1ccc(C(C)(C)[NH2+]Cc2nnc(C(C)C)o2)cc1 ZINC000361550360 336762132 /nfs/dbraw/zinc/76/21/32/336762132.db2.gz FBNGTLNLBRLKNG-UHFFFAOYSA-N 1 2 317.433 4.007 20 0 DIADLO CC(C)CC1(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)CCC1 ZINC000362496547 336800636 /nfs/dbraw/zinc/80/06/36/336800636.db2.gz CRSVBRRYRREWFM-UHFFFAOYSA-N 1 2 315.392 4.166 20 0 DIADLO CC[C@@H](Nc1cc[nH+]c(C)n1)c1cc(F)cc(Br)c1 ZINC000362692907 336809207 /nfs/dbraw/zinc/80/92/07/336809207.db2.gz LNLPSSLZTYJXHC-CYBMUJFWSA-N 1 2 324.197 4.250 20 0 DIADLO Cc1cccc(NC(=O)c2ccc(C)c(Oc3cc[nH+]cc3)c2)n1 ZINC000115008513 336822241 /nfs/dbraw/zinc/82/22/41/336822241.db2.gz OTZVKGVQQYUVDA-UHFFFAOYSA-N 1 2 319.364 4.138 20 0 DIADLO Cc1cc(NC[C@H]2CCCO[C@@H]2c2ccccc2)nc(C2CC2)[nH+]1 ZINC000116260289 336834977 /nfs/dbraw/zinc/83/49/77/336834977.db2.gz JVNDRNXBZNGUAJ-IEBWSBKVSA-N 1 2 323.440 4.242 20 0 DIADLO Fc1cccc2c1OCC[C@@H]2[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000369048007 336857767 /nfs/dbraw/zinc/85/77/67/336857767.db2.gz MPYVBMWKWXIPJK-KRWDZBQOSA-N 1 2 324.355 4.094 20 0 DIADLO Cc1csc(C[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)n1 ZINC000369311307 336862215 /nfs/dbraw/zinc/86/22/15/336862215.db2.gz FVJFZHDSTQJCKA-GOSISDBHSA-N 1 2 309.438 4.034 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc3[nH]ccc3c2)[nH+]1 ZINC000370270726 336881349 /nfs/dbraw/zinc/88/13/49/336881349.db2.gz MCENAKKBEXHUFJ-UHFFFAOYSA-N 1 2 316.364 4.119 20 0 DIADLO Cc1cc(NC(=O)N2C[C@@H](c3ccccc3C)C[C@H]2C)cc[nH+]1 ZINC000119367075 336886366 /nfs/dbraw/zinc/88/63/66/336886366.db2.gz YUCCHAPROMISBK-CVEARBPZSA-N 1 2 309.413 4.108 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)CCc2ccsc2)[nH+]1 ZINC000371248068 336898504 /nfs/dbraw/zinc/89/85/04/336898504.db2.gz TUYVLRJXKHIQAI-UHFFFAOYSA-N 1 2 311.410 4.018 20 0 DIADLO CCc1ccc(CC(=O)Nc2ccccc2-c2[nH]cc(C)[nH+]2)cc1 ZINC000371253184 336898581 /nfs/dbraw/zinc/89/85/81/336898581.db2.gz HLTDSIWNNQDWOV-UHFFFAOYSA-N 1 2 319.408 4.129 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1cccnc1 ZINC000371485092 336906126 /nfs/dbraw/zinc/90/61/26/336906126.db2.gz KKEAAZBYERUVSP-OAHLLOKOSA-N 1 2 316.408 4.170 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)c(C)o1 ZINC000303009159 336932832 /nfs/dbraw/zinc/93/28/32/336932832.db2.gz JAPLNYXIKUUBFE-UHFFFAOYSA-N 1 2 308.337 4.336 20 0 DIADLO CCSc1ccc([C@@H](C)NC(=O)Nc2cc[nH+]cc2C)cc1 ZINC000121432950 336954332 /nfs/dbraw/zinc/95/43/32/336954332.db2.gz CGZPBTKYUUOWPT-CYBMUJFWSA-N 1 2 315.442 4.385 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)NC(=O)Nc1cc[nH+]cc1C ZINC000121609934 336968799 /nfs/dbraw/zinc/96/87/99/336968799.db2.gz WSUUENNPJKVBRQ-ZDUSSCGKSA-N 1 2 309.369 4.327 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N[C@H](C)c1ccc(F)cc1Cl ZINC000121846790 336981496 /nfs/dbraw/zinc/98/14/96/336981496.db2.gz OMSOMHGPSUQJKK-SNVBAGLBSA-N 1 2 307.756 4.065 20 0 DIADLO CN(C)c1ccccc1C[NH+](Cc1ccco1)Cc1ccco1 ZINC000122154001 336996178 /nfs/dbraw/zinc/99/61/78/336996178.db2.gz UEJOCFDHKFOSDX-UHFFFAOYSA-N 1 2 310.397 4.141 20 0 DIADLO Cc1csc([C@@H]2CCCC[N@H+]2Cc2cnn(CC(C)C)c2)n1 ZINC000375829101 337020669 /nfs/dbraw/zinc/02/06/69/337020669.db2.gz IGBOGOYEAZWHHB-INIZCTEOSA-N 1 2 318.490 4.031 20 0 DIADLO Cc1csc([C@@H]2CCCC[N@@H+]2Cc2cnn(CC(C)C)c2)n1 ZINC000375829101 337020670 /nfs/dbraw/zinc/02/06/70/337020670.db2.gz IGBOGOYEAZWHHB-INIZCTEOSA-N 1 2 318.490 4.031 20 0 DIADLO Clc1ccc(C[NH+]2CCC(c3ncccc3Cl)CC2)nc1 ZINC000375932548 337023482 /nfs/dbraw/zinc/02/34/82/337023482.db2.gz MGUPMNTVNAMNAW-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1F)c1nccn1-c1ccccc1 ZINC000376506125 337035347 /nfs/dbraw/zinc/03/53/47/337035347.db2.gz JLWNIWILIVVYCA-LSDHHAIUSA-N 1 2 309.388 4.423 20 0 DIADLO Cc1ccc([C@H]2CCN(C(=O)Nc3c(C)cc[nH+]c3C)C2)cc1 ZINC000376640261 337038770 /nfs/dbraw/zinc/03/87/70/337038770.db2.gz HMDICTKTDLPLJG-KRWDZBQOSA-N 1 2 309.413 4.028 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@H](c2ccccc2)C[C@@H]1C ZINC000376638853 337038827 /nfs/dbraw/zinc/03/88/27/337038827.db2.gz CUVNBQYPVJVJFZ-YJBOKZPZSA-N 1 2 323.440 4.498 20 0 DIADLO Cc1cc[nH+]cc1CCCNc1ccc(NC(=O)C(C)C)cc1 ZINC000521455365 337050446 /nfs/dbraw/zinc/05/04/46/337050446.db2.gz ADNJJYRESMWICV-UHFFFAOYSA-N 1 2 311.429 4.029 20 0 DIADLO Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC000377752615 337060119 /nfs/dbraw/zinc/06/01/19/337060119.db2.gz VPZBIHZTBARZRP-KRWDZBQOSA-N 1 2 320.396 4.012 20 0 DIADLO Fc1ccccc1CNc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000378266212 337069032 /nfs/dbraw/zinc/06/90/32/337069032.db2.gz AGBFBLXHQMEJQT-UHFFFAOYSA-N 1 2 319.383 4.353 20 0 DIADLO CCCCCC[C@](C)(CC)C(=O)N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000378269672 337069173 /nfs/dbraw/zinc/06/91/73/337069173.db2.gz YZCJRGSGUHQGOA-LPHOPBHVSA-N 1 2 319.493 4.123 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1ccoc1 ZINC000378471930 337073619 /nfs/dbraw/zinc/07/36/19/337073619.db2.gz KEVUFZUMQPURRP-CQSZACIVSA-N 1 2 305.381 4.368 20 0 DIADLO c1c2ccccc2oc1[C@H]([NH2+]Cc1cncnc1)c1ccccc1 ZINC000171131782 337086797 /nfs/dbraw/zinc/08/67/97/337086797.db2.gz DODSDMUDGACOOL-HXUWFJFHSA-N 1 2 315.376 4.102 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)Cc2ccc(F)cc2)cs1 ZINC000172317146 337091748 /nfs/dbraw/zinc/09/17/48/337091748.db2.gz BSCGEUFHGNXCIP-GFCCVEGCSA-N 1 2 308.422 4.012 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)Cc2ccc(F)cc2)cs1 ZINC000172317146 337091749 /nfs/dbraw/zinc/09/17/49/337091749.db2.gz BSCGEUFHGNXCIP-GFCCVEGCSA-N 1 2 308.422 4.012 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)Cc2cccc(C)c2)cs1 ZINC000172320104 337091773 /nfs/dbraw/zinc/09/17/73/337091773.db2.gz UUDOKRKQCVDZQH-AWEZNQCLSA-N 1 2 304.459 4.181 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)Cc2cccc(C)c2)cs1 ZINC000172320104 337091774 /nfs/dbraw/zinc/09/17/74/337091774.db2.gz UUDOKRKQCVDZQH-AWEZNQCLSA-N 1 2 304.459 4.181 20 0 DIADLO CSc1ccc(CNc2ccc(N3CCCCC3)c[nH+]2)s1 ZINC000582515966 337099973 /nfs/dbraw/zinc/09/99/73/337099973.db2.gz QCUMHQLRTGIJIU-UHFFFAOYSA-N 1 2 319.499 4.467 20 0 DIADLO CC1(Cc2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)CCCC1 ZINC000582571513 337107508 /nfs/dbraw/zinc/10/75/08/337107508.db2.gz IURGUZCEHBWFAS-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO CC(=O)c1cc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)on1 ZINC000582733958 337124677 /nfs/dbraw/zinc/12/46/77/337124677.db2.gz OSCOTJQKBFHHNU-UHFFFAOYSA-N 1 2 320.392 4.195 20 0 DIADLO CC(=O)c1cc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)on1 ZINC000582733958 337124678 /nfs/dbraw/zinc/12/46/78/337124678.db2.gz OSCOTJQKBFHHNU-UHFFFAOYSA-N 1 2 320.392 4.195 20 0 DIADLO Cc1c2cc(C)c(C)cc2sc1C(=O)N[C@H](C)c1[nH]cc[nH+]1 ZINC000582735707 337127791 /nfs/dbraw/zinc/12/77/91/337127791.db2.gz KYMRUGWTZRAUQH-GFCCVEGCSA-N 1 2 313.426 4.041 20 0 DIADLO O=C(CCC(F)(F)F)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000173358146 337134836 /nfs/dbraw/zinc/13/48/36/337134836.db2.gz WGWYLGOVYSSCIW-UHFFFAOYSA-N 1 2 310.275 4.155 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCS[C@H]1CCCOC1 ZINC000460882788 337139132 /nfs/dbraw/zinc/13/91/32/337139132.db2.gz OMKAJRLRPTULCO-INIZCTEOSA-N 1 2 318.486 4.427 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2nc(C(F)(F)F)cs2)c(C)s1 ZINC000174957474 337143786 /nfs/dbraw/zinc/14/37/86/337143786.db2.gz LRAHAPRYJOFTBQ-UHFFFAOYSA-N 1 2 320.405 4.472 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2nc(C(F)(F)F)cs2)c(C)s1 ZINC000174957474 337143787 /nfs/dbraw/zinc/14/37/87/337143787.db2.gz LRAHAPRYJOFTBQ-UHFFFAOYSA-N 1 2 320.405 4.472 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000425597989 337143890 /nfs/dbraw/zinc/14/38/90/337143890.db2.gz VGHMNJXIQZBAPL-LSDHHAIUSA-N 1 2 300.789 4.094 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](Cc2ccccc2)C(C)C)cs1 ZINC000175075799 337144261 /nfs/dbraw/zinc/14/42/61/337144261.db2.gz DFUPZJCOYOJSGT-CQSZACIVSA-N 1 2 304.459 4.261 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](Cc2ccccc2)C(C)C)cs1 ZINC000175075799 337144262 /nfs/dbraw/zinc/14/42/62/337144262.db2.gz DFUPZJCOYOJSGT-CQSZACIVSA-N 1 2 304.459 4.261 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccco2)on1)Cc1cc2ccccc2o1 ZINC000175197327 337146211 /nfs/dbraw/zinc/14/62/11/337146211.db2.gz OFRBCCHYKDIFFZ-UHFFFAOYSA-N 1 2 308.337 4.313 20 0 DIADLO C[N@H+](Cc1cc(-c2ccco2)on1)Cc1cc2ccccc2o1 ZINC000175197327 337146212 /nfs/dbraw/zinc/14/62/12/337146212.db2.gz OFRBCCHYKDIFFZ-UHFFFAOYSA-N 1 2 308.337 4.313 20 0 DIADLO c1cn(-c2ccc(CSc3nc4ccccc4s3)cn2)c[nH+]1 ZINC000175226703 337146430 /nfs/dbraw/zinc/14/64/30/337146430.db2.gz YRSDWBMVSCYBNQ-UHFFFAOYSA-N 1 2 324.434 4.169 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cccc(C(F)(F)F)c2)s1 ZINC000175525203 337147825 /nfs/dbraw/zinc/14/78/25/337147825.db2.gz XUYMKYXFKODWII-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cccc(C(F)(F)F)c2)s1 ZINC000175525203 337147826 /nfs/dbraw/zinc/14/78/26/337147826.db2.gz XUYMKYXFKODWII-UHFFFAOYSA-N 1 2 314.376 4.356 20 0 DIADLO O=C(C/C=C/c1cccc(F)c1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000176026163 337150219 /nfs/dbraw/zinc/15/02/19/337150219.db2.gz BOZFJCIHACLEIS-GORDUTHDSA-N 1 2 321.355 4.053 20 0 DIADLO CCn1ccnc1C[N@H+](C)C1c2ccccc2-c2ccccc21 ZINC000176433206 337151263 /nfs/dbraw/zinc/15/12/63/337151263.db2.gz NLVORAOGZMDUBM-UHFFFAOYSA-N 1 2 303.409 4.105 20 0 DIADLO CCn1ccnc1C[N@@H+](C)C1c2ccccc2-c2ccccc21 ZINC000176433206 337151264 /nfs/dbraw/zinc/15/12/64/337151264.db2.gz NLVORAOGZMDUBM-UHFFFAOYSA-N 1 2 303.409 4.105 20 0 DIADLO FC(F)(F)c1cccc(CN2CCCC[C@@H]2c2[nH]cc[nH+]2)c1 ZINC000177039850 337152985 /nfs/dbraw/zinc/15/29/85/337152985.db2.gz SIHBMJIGHFNPHU-CQSZACIVSA-N 1 2 309.335 4.156 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000176986921 337154051 /nfs/dbraw/zinc/15/40/51/337154051.db2.gz WGPSZCINYYLXNW-MRXNPFEDSA-N 1 2 305.468 4.044 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@@H](c3ccsc3)C2)cc1 ZINC000176986921 337154052 /nfs/dbraw/zinc/15/40/52/337154052.db2.gz WGPSZCINYYLXNW-MRXNPFEDSA-N 1 2 305.468 4.044 20 0 DIADLO CCCC(CCC)[NH2+][C@@H](c1noc(C)n1)c1ccccc1OC ZINC000177338354 337156983 /nfs/dbraw/zinc/15/69/83/337156983.db2.gz IBGJURXEAITERS-QGZVFWFLSA-N 1 2 317.433 4.034 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2cc(C(F)(F)F)ccc2F)s1 ZINC000179383077 337167587 /nfs/dbraw/zinc/16/75/87/337167587.db2.gz ZTMHHKJNXGEGAI-UHFFFAOYSA-N 1 2 318.339 4.241 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2cc(C(F)(F)F)ccc2F)s1 ZINC000179383077 337167588 /nfs/dbraw/zinc/16/75/88/337167588.db2.gz ZTMHHKJNXGEGAI-UHFFFAOYSA-N 1 2 318.339 4.241 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Oc2ccccc2)nc1)c1nccs1 ZINC000179418221 337167781 /nfs/dbraw/zinc/16/77/81/337167781.db2.gz SKEDYCMAISINOB-ZDUSSCGKSA-N 1 2 311.410 4.181 20 0 DIADLO CCCCc1nc(C[N@H+](C)[C@@H](CC)c2ccncc2)cs1 ZINC000179704018 337169089 /nfs/dbraw/zinc/16/90/89/337169089.db2.gz TXDXMHRHZLOWNE-INIZCTEOSA-N 1 2 303.475 4.464 20 0 DIADLO CCCCc1nc(C[N@@H+](C)[C@@H](CC)c2ccncc2)cs1 ZINC000179704018 337169090 /nfs/dbraw/zinc/16/90/90/337169090.db2.gz TXDXMHRHZLOWNE-INIZCTEOSA-N 1 2 303.475 4.464 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@@H](C)c1ccoc1)c1ccccn1 ZINC000179482568 337169742 /nfs/dbraw/zinc/16/97/42/337169742.db2.gz MIBGHBFODZWHOD-IFXJQAMLSA-N 1 2 308.381 4.123 20 0 DIADLO CC(C)([NH2+]Cc1nc(C2CCCC2)no1)c1cccc(Cl)c1 ZINC000179608568 337170569 /nfs/dbraw/zinc/17/05/69/337170569.db2.gz JRYDMSJGKIJQMS-UHFFFAOYSA-N 1 2 319.836 4.406 20 0 DIADLO Cc1cnc(C[N@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)s1 ZINC000180501707 337176010 /nfs/dbraw/zinc/17/60/10/337176010.db2.gz NUZCRNCTMOLPLP-CZUORRHYSA-N 1 2 304.484 4.130 20 0 DIADLO Cc1cnc(C[N@@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)s1 ZINC000180501707 337176011 /nfs/dbraw/zinc/17/60/11/337176011.db2.gz NUZCRNCTMOLPLP-CZUORRHYSA-N 1 2 304.484 4.130 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@@H](CC)c2ccccc2F)o1 ZINC000180631507 337176785 /nfs/dbraw/zinc/17/67/85/337176785.db2.gz BLJZOBMNLIOOAI-IRXDYDNUSA-N 1 2 305.393 4.410 20 0 DIADLO Cc1csc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)n1 ZINC000180787105 337177817 /nfs/dbraw/zinc/17/78/17/337177817.db2.gz JWAJRVDKJRVSRP-UHFFFAOYSA-N 1 2 300.383 4.127 20 0 DIADLO C(=C/[C@@H]1CCCCC[N@H+]1Cc1csnn1)\c1cccs1 ZINC000180843374 337178051 /nfs/dbraw/zinc/17/80/51/337178051.db2.gz FAHUTSFBYZYOEB-NPQIQWPPSA-N 1 2 305.472 4.058 20 0 DIADLO C(=C/[C@@H]1CCCCC[N@@H+]1Cc1csnn1)\c1cccs1 ZINC000180843374 337178052 /nfs/dbraw/zinc/17/80/52/337178052.db2.gz FAHUTSFBYZYOEB-NPQIQWPPSA-N 1 2 305.472 4.058 20 0 DIADLO Cc1cc(-c2noc(C[NH2+][C@H](C)c3ccccc3)n2)ccc1F ZINC000181347241 337181571 /nfs/dbraw/zinc/18/15/71/337181571.db2.gz AALMBBOSAMNHFF-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO Cc1cncc([C@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)c1 ZINC000184329664 337197860 /nfs/dbraw/zinc/19/78/60/337197860.db2.gz ZDVAPPGSMDOSPX-WMLDXEAASA-N 1 2 309.438 4.287 20 0 DIADLO COc1cc(NCc2ccc(C)[nH+]c2C)ccc1Br ZINC000184479345 337198943 /nfs/dbraw/zinc/19/89/43/337198943.db2.gz LYGFSPNXLHRGAX-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO Cc1ccc(CNc2ccc(F)cc2OCC2CC2)c(C)[nH+]1 ZINC000184467231 337198980 /nfs/dbraw/zinc/19/89/80/337198980.db2.gz XLAXVCXLUFVPOM-UHFFFAOYSA-N 1 2 300.377 4.238 20 0 DIADLO COCc1cc(N2CCC(C)=C(C)C2)c2cc(F)ccc2[nH+]1 ZINC000582818808 337200044 /nfs/dbraw/zinc/20/00/44/337200044.db2.gz ORDCOIUFQXFBOX-UHFFFAOYSA-N 1 2 300.377 4.067 20 0 DIADLO Cc1ccc(COc2ccc(NC(=O)c3ccco3)cc2)c(C)[nH+]1 ZINC000185252091 337203663 /nfs/dbraw/zinc/20/36/63/337203663.db2.gz DINSBGVHEQILAR-UHFFFAOYSA-N 1 2 322.364 4.123 20 0 DIADLO Cc1sc2nc(C)nc(N[C@H](c3[nH]cc[nH+]3)C(C)C)c2c1C ZINC000582937420 337219742 /nfs/dbraw/zinc/21/97/42/337219742.db2.gz QIPDKKHPPWCRIN-ZDUSSCGKSA-N 1 2 315.446 4.149 20 0 DIADLO C[C@@H]1Oc2cc(F)ccc2[C@@H]1[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000582986575 337222876 /nfs/dbraw/zinc/22/28/76/337222876.db2.gz CHFKICJKMBDSCG-MGPLVRAMSA-N 1 2 320.433 4.192 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2cc(O)cc(F)c2)c2ccccn2)c1 ZINC000185614569 337249580 /nfs/dbraw/zinc/24/95/80/337249580.db2.gz HILHSIRIKHYDCB-FQEVSTJZSA-N 1 2 322.383 4.114 20 0 DIADLO CCC[C@H]1CCCC[N@@H+]1Cc1noc(Cc2ccccc2C)n1 ZINC000583170825 337251134 /nfs/dbraw/zinc/25/11/34/337251134.db2.gz OOFVNYUQKPHPHT-KRWDZBQOSA-N 1 2 313.445 4.123 20 0 DIADLO CCC[C@H]1CCCC[N@H+]1Cc1noc(Cc2ccccc2C)n1 ZINC000583170825 337251135 /nfs/dbraw/zinc/25/11/35/337251135.db2.gz OOFVNYUQKPHPHT-KRWDZBQOSA-N 1 2 313.445 4.123 20 0 DIADLO Cc1coc2ccc(NC(=O)c3ccc(-n4cc[nH+]c4)cc3)cc12 ZINC000185794733 337251383 /nfs/dbraw/zinc/25/13/83/337251383.db2.gz RFPAUPWJIGDSKM-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO CCc1noc([C@@H](C)[N@H+](C)Cc2ccc(C(C)(C)C)cc2)n1 ZINC000532904073 337254699 /nfs/dbraw/zinc/25/46/99/337254699.db2.gz AMRYYTLEBIBGMS-CYBMUJFWSA-N 1 2 301.434 4.123 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+](C)Cc2ccc(C(C)(C)C)cc2)n1 ZINC000532904073 337254700 /nfs/dbraw/zinc/25/47/00/337254700.db2.gz AMRYYTLEBIBGMS-CYBMUJFWSA-N 1 2 301.434 4.123 20 0 DIADLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1nc(-c2ccccc2Cl)cs1 ZINC000187180689 337263554 /nfs/dbraw/zinc/26/35/54/337263554.db2.gz UPZGYEIOGUQGTL-NEPJUHHUSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1nc(-c2ccccc2Cl)cs1 ZINC000187180689 337263555 /nfs/dbraw/zinc/26/35/55/337263555.db2.gz UPZGYEIOGUQGTL-NEPJUHHUSA-N 1 2 322.861 4.073 20 0 DIADLO CCOc1ccc(OCC)c(NCc2ccc(C)[nH+]c2C)c1 ZINC000187706832 337269603 /nfs/dbraw/zinc/26/96/03/337269603.db2.gz PWGUCIJBBHLWQO-UHFFFAOYSA-N 1 2 300.402 4.108 20 0 DIADLO COCCCOC1(Cn2c[nH+]c3cc(C)c(C)cc32)CCCC1 ZINC000446073584 338520091 /nfs/dbraw/zinc/52/00/91/338520091.db2.gz ZCNKBJBAEXGVQR-UHFFFAOYSA-N 1 2 316.445 4.019 20 0 DIADLO c1c[nH]c([C@H]([NH2+]Cc2ccc(C3CC3)cc2)c2ccccc2)n1 ZINC000188720362 337274569 /nfs/dbraw/zinc/27/45/69/337274569.db2.gz XSQFWOHEDXRPLH-LJQANCHMSA-N 1 2 303.409 4.166 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nc(-c3ccccc3F)no2)cc1 ZINC000189155043 337277177 /nfs/dbraw/zinc/27/71/77/337277177.db2.gz PEANAYKVHLKCMN-ZDUSSCGKSA-N 1 2 311.360 4.035 20 0 DIADLO CC(C)(C)C1CC[NH+](Cc2noc(-c3ccsc3)n2)CC1 ZINC000530413892 337278916 /nfs/dbraw/zinc/27/89/16/337278916.db2.gz FMKQYAJGBIWCBR-UHFFFAOYSA-N 1 2 305.447 4.056 20 0 DIADLO CCOc1cccc2cc([C@H](C)[NH2+]Cc3ncccc3F)oc21 ZINC000530418730 337279324 /nfs/dbraw/zinc/27/93/24/337279324.db2.gz DONLCQNHSMOZSR-LBPRGKRZSA-N 1 2 314.360 4.216 20 0 DIADLO O=C(c1ccc(C2CCC2)cc1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000190789386 337290868 /nfs/dbraw/zinc/29/08/68/337290868.db2.gz YZOFPNDVHZYLIN-KRWDZBQOSA-N 1 2 309.413 4.045 20 0 DIADLO CC(C)c1nc2n(n1)CCC[C@@H]2[NH2+][C@H](C)c1csc(Cl)c1 ZINC000191337239 337296008 /nfs/dbraw/zinc/29/60/08/337296008.db2.gz KKLLJNJVMGVRIG-PWSUYJOCSA-N 1 2 324.881 4.302 20 0 DIADLO CCN(C)c1ccc(CNc2cccc3ccc(C)nc32)c[nH+]1 ZINC000191381879 337296368 /nfs/dbraw/zinc/29/63/68/337296368.db2.gz YJHZINKXALVIMS-UHFFFAOYSA-N 1 2 306.413 4.006 20 0 DIADLO CCN(C)c1ccc(CNc2ccc3nc(C4CC4)oc3c2)c[nH+]1 ZINC000191444976 337297081 /nfs/dbraw/zinc/29/70/81/337297081.db2.gz ULBJQHWJCSVDGX-UHFFFAOYSA-N 1 2 322.412 4.168 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccc(Br)o2)C1 ZINC000191493425 337297361 /nfs/dbraw/zinc/29/73/61/337297361.db2.gz IYEPPJUNKOFUME-FZMZJTMJSA-N 1 2 321.218 4.020 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc(Br)o2)C1 ZINC000191493425 337297362 /nfs/dbraw/zinc/29/73/62/337297362.db2.gz IYEPPJUNKOFUME-FZMZJTMJSA-N 1 2 321.218 4.020 20 0 DIADLO CCN(C)c1ccc(CNc2cc(C)cc3cccnc32)c[nH+]1 ZINC000191538415 337298815 /nfs/dbraw/zinc/29/88/15/337298815.db2.gz ACANFFRSGGOXRZ-UHFFFAOYSA-N 1 2 306.413 4.006 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)c2cccnc2)c1C(C)C ZINC000191956481 337301364 /nfs/dbraw/zinc/30/13/64/337301364.db2.gz OKVGLZMYPMIYKF-UHFFFAOYSA-N 1 2 305.381 4.314 20 0 DIADLO Clc1ccc([C@@H]2CCCCC[N@@H+]2Cc2ncccn2)cc1 ZINC000192030312 337301991 /nfs/dbraw/zinc/30/19/91/337301991.db2.gz YKIXJQNFYTYKTG-INIZCTEOSA-N 1 2 301.821 4.247 20 0 DIADLO Clc1ccc([C@@H]2CCCCC[N@H+]2Cc2ncccn2)cc1 ZINC000192030312 337301992 /nfs/dbraw/zinc/30/19/92/337301992.db2.gz YKIXJQNFYTYKTG-INIZCTEOSA-N 1 2 301.821 4.247 20 0 DIADLO CC[N@H+](Cc1ncccn1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000192101879 337302900 /nfs/dbraw/zinc/30/29/00/337302900.db2.gz BSZLTKLNVKOHKH-HXUWFJFHSA-N 1 2 321.399 4.227 20 0 DIADLO CC[N@@H+](Cc1ncccn1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000192101879 337302901 /nfs/dbraw/zinc/30/29/01/337302901.db2.gz BSZLTKLNVKOHKH-HXUWFJFHSA-N 1 2 321.399 4.227 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ncccn1)c1cccc(C(F)(F)F)c1 ZINC000192155488 337303422 /nfs/dbraw/zinc/30/34/22/337303422.db2.gz HAJIMLYEYJWSHN-CQSZACIVSA-N 1 2 309.335 4.126 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1noc(-c2ccsc2)n1 ZINC000192667087 337306021 /nfs/dbraw/zinc/30/60/21/337306021.db2.gz YFHWVMFGEXQXTL-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1noc(-c2ccsc2)n1 ZINC000192667087 337306022 /nfs/dbraw/zinc/30/60/22/337306022.db2.gz YFHWVMFGEXQXTL-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO FC(F)Oc1ccc[nH+]c1NCc1cnc(-c2ccco2)s1 ZINC000192756636 337307269 /nfs/dbraw/zinc/30/72/69/337307269.db2.gz DKIXDIYPDGZJEA-UHFFFAOYSA-N 1 2 323.324 4.012 20 0 DIADLO COc1c(C)cnc(C[N@H+]([C@H](C)c2ccco2)C2CC2)c1C ZINC000086235951 337309825 /nfs/dbraw/zinc/30/98/25/337309825.db2.gz UFZREQYPPIRYPL-CQSZACIVSA-N 1 2 300.402 4.026 20 0 DIADLO COc1c(C)cnc(C[N@@H+]([C@H](C)c2ccco2)C2CC2)c1C ZINC000086235951 337309826 /nfs/dbraw/zinc/30/98/26/337309826.db2.gz UFZREQYPPIRYPL-CQSZACIVSA-N 1 2 300.402 4.026 20 0 DIADLO CC[N@@H+](C/C(C)=C/c1ccccc1OC(F)F)CC(F)F ZINC000583725187 337318415 /nfs/dbraw/zinc/31/84/15/337318415.db2.gz XNFCXOMXVKWAGF-DHZHZOJOSA-N 1 2 305.315 4.278 20 0 DIADLO CC[N@H+](C/C(C)=C/c1ccccc1OC(F)F)CC(F)F ZINC000583725187 337318416 /nfs/dbraw/zinc/31/84/16/337318416.db2.gz XNFCXOMXVKWAGF-DHZHZOJOSA-N 1 2 305.315 4.278 20 0 DIADLO CC(C)=CCC[C@@H](C)CC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000584412374 337321422 /nfs/dbraw/zinc/32/14/22/337321422.db2.gz KRAMIBHEKBDBOY-CVEARBPZSA-N 1 2 303.450 4.236 20 0 DIADLO CC(C)=CCC[C@H](C)CC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000584412377 337321484 /nfs/dbraw/zinc/32/14/84/337321484.db2.gz KRAMIBHEKBDBOY-JKSUJKDBSA-N 1 2 303.450 4.236 20 0 DIADLO C[C@@H]1c2cc(F)cc(F)c2CC[N@H+]1Cc1c[nH]nc1C(C)(C)C ZINC000583803444 337335132 /nfs/dbraw/zinc/33/51/32/337335132.db2.gz WDOHKPSZBWOJLZ-LLVKDONJSA-N 1 2 319.399 4.105 20 0 DIADLO C[C@@H]1c2cc(F)cc(F)c2CC[N@@H+]1Cc1c[nH]nc1C(C)(C)C ZINC000583803444 337335133 /nfs/dbraw/zinc/33/51/33/337335133.db2.gz WDOHKPSZBWOJLZ-LLVKDONJSA-N 1 2 319.399 4.105 20 0 DIADLO C[C@@H](C(=O)Nc1cccc(Cl)c1Cl)[NH+]1CCC(C)CC1 ZINC000021848146 337338615 /nfs/dbraw/zinc/33/86/15/337338615.db2.gz MRXIBZADUPQPSG-NSHDSACASA-N 1 2 315.244 4.052 20 0 DIADLO Cc1ccc[nH+]c1CCc1noc(C2(c3ccccc3)CCC2)n1 ZINC000584511668 337353631 /nfs/dbraw/zinc/35/36/31/337353631.db2.gz CRSUFOMYEQGZMD-UHFFFAOYSA-N 1 2 319.408 4.028 20 0 DIADLO Cc1cccc(-c2nc(CC(=O)Nc3cc[nH+]cc3C)cs2)c1 ZINC000107288599 337387461 /nfs/dbraw/zinc/38/74/61/337387461.db2.gz WTMXWQAUOBDAIS-UHFFFAOYSA-N 1 2 323.421 4.003 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1cncc(Br)c1 ZINC000029707947 337389545 /nfs/dbraw/zinc/38/95/45/337389545.db2.gz NQQNJELQFWLTSQ-JTQLQIEISA-N 1 2 323.259 4.025 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1cncc(Br)c1 ZINC000029707947 337389546 /nfs/dbraw/zinc/38/95/46/337389546.db2.gz NQQNJELQFWLTSQ-JTQLQIEISA-N 1 2 323.259 4.025 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)[C@@H]1C[C@H]1c1ccco1 ZINC000112183322 337390182 /nfs/dbraw/zinc/39/01/82/337390182.db2.gz USJQXWSEOQBIEZ-IAGOWNOFSA-N 1 2 320.348 4.209 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[NH+]3Cc4ccccc4C3)o2)cc1C ZINC000120260734 337395673 /nfs/dbraw/zinc/39/56/73/337395673.db2.gz YDFNMQLORZHVEG-HNNXBMFYSA-N 1 2 319.408 4.430 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)cs1 ZINC000122060050 337396642 /nfs/dbraw/zinc/39/66/42/337396642.db2.gz JVTSSSBQYQGLDD-CQSZACIVSA-N 1 2 315.467 4.398 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)cs1 ZINC000122060050 337396643 /nfs/dbraw/zinc/39/66/43/337396643.db2.gz JVTSSSBQYQGLDD-CQSZACIVSA-N 1 2 315.467 4.398 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@@H](C)c1cccnc1)c1ccco1 ZINC000130786710 337434275 /nfs/dbraw/zinc/43/42/75/337434275.db2.gz HBUXKPLBQXTECJ-LIRRHRJNSA-N 1 2 308.381 4.123 20 0 DIADLO CCCCC[C@H](C)[NH2+][C@H](c1noc(C)n1)c1ccccc1OC ZINC000130832612 337434525 /nfs/dbraw/zinc/43/45/25/337434525.db2.gz HBLGWURSBBZVGR-GUYCJALGSA-N 1 2 317.433 4.034 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@H](C)CCC(C)C)c2ccccc2F)no1 ZINC000130854206 337434740 /nfs/dbraw/zinc/43/47/40/337434740.db2.gz KLNQAHJQICXONT-WBMJQRKESA-N 1 2 305.397 4.021 20 0 DIADLO Cc1ccc(NC(=O)Nc2cccc(Br)c2)c(C)[nH+]1 ZINC000132647454 337442877 /nfs/dbraw/zinc/44/28/77/337442877.db2.gz JKBUIOQHYOVJSK-UHFFFAOYSA-N 1 2 320.190 4.105 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1cccc(O)c1 ZINC000194874167 337463922 /nfs/dbraw/zinc/46/39/22/337463922.db2.gz UEHKGAWOPGOURR-CXAGYDPISA-N 1 2 310.422 4.289 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccco2)no1)c1ccc(C2CC2)cc1 ZINC000419355496 337480661 /nfs/dbraw/zinc/48/06/61/337480661.db2.gz NFMHMCMNEMIUGS-GFCCVEGCSA-N 1 2 309.369 4.058 20 0 DIADLO CC(=O)c1cccc(CSCCc2[nH+]c3ccccc3n2C)c1 ZINC000419501037 337485811 /nfs/dbraw/zinc/48/58/11/337485811.db2.gz CSDGAHXDQRVXDC-UHFFFAOYSA-N 1 2 324.449 4.252 20 0 DIADLO Cc1[nH+]cccc1Cc1noc(/C=C\c2ccc([C@@H]3C[C@@H]3C)o2)n1 ZINC000420513910 337506475 /nfs/dbraw/zinc/50/64/75/337506475.db2.gz YLPKDTOPGGQMJM-YTCBSGDJSA-N 1 2 321.380 4.251 20 0 DIADLO OCC[C@@H]1CCCN(c2cc[nH+]c3cc(F)c(Cl)cc32)CC1 ZINC000420634463 337509397 /nfs/dbraw/zinc/50/93/97/337509397.db2.gz DAVRHQHAMVPFBD-GFCCVEGCSA-N 1 2 322.811 4.016 20 0 DIADLO Cn1cc(Cl)c(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)n1 ZINC000420935542 337516949 /nfs/dbraw/zinc/51/69/49/337516949.db2.gz LYDUWHWITUHLBR-OAHLLOKOSA-N 1 2 309.816 4.090 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@]2(c3ccc(Cl)cc3)C[C@@H]2C)nn1C ZINC000421358802 337531889 /nfs/dbraw/zinc/53/18/89/337531889.db2.gz UWMQEIXYHRUAKZ-MGPLVRAMSA-N 1 2 324.255 4.060 20 0 DIADLO CC[C@@H]1C[C@]1([NH2+]Cc1nn(C)c(C)c1Cl)c1cccc(C)c1 ZINC000421359466 337531955 /nfs/dbraw/zinc/53/19/55/337531955.db2.gz WVBXHOZQRSNQCV-RDTXWAMCSA-N 1 2 317.864 4.105 20 0 DIADLO O=C(Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)[C@]12C[C@H]1CCC2 ZINC000421559172 337541322 /nfs/dbraw/zinc/54/13/22/337541322.db2.gz OEXPAMBEUADZHX-FOIQADDNSA-N 1 2 321.424 4.015 20 0 DIADLO O=C(Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)[C@@]12C[C@@H]1CCC2 ZINC000421559180 337541335 /nfs/dbraw/zinc/54/13/35/337541335.db2.gz OEXPAMBEUADZHX-YWZLYKJASA-N 1 2 321.424 4.015 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccccc2OCC(C)C)cs1 ZINC000067216458 337543500 /nfs/dbraw/zinc/54/35/00/337543500.db2.gz AXXFELMCFRFINF-UHFFFAOYSA-N 1 2 304.459 4.030 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1nc(C2CC2)no1 ZINC000247220840 337558508 /nfs/dbraw/zinc/55/85/08/337558508.db2.gz MHPQLIDHLJNUDB-PEYYIBSZSA-N 1 2 315.417 4.150 20 0 DIADLO C[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(Cl)cc1Cl ZINC000393327900 337574726 /nfs/dbraw/zinc/57/47/26/337574726.db2.gz VZYWOMOCTOLENN-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO Cc1[nH+]cccc1Cc1noc(CC2CC(c3ccccc3)C2)n1 ZINC000572139519 337593341 /nfs/dbraw/zinc/59/33/41/337593341.db2.gz CIZJCAYHHJDXGF-UHFFFAOYSA-N 1 2 319.408 4.100 20 0 DIADLO CC[C@@H](Nc1cc(C)[nH+]c(-c2ccncc2)n1)c1c(C)noc1C ZINC000161646256 337594032 /nfs/dbraw/zinc/59/40/32/337594032.db2.gz FFGUWGOGVROEDN-OAHLLOKOSA-N 1 2 323.400 4.015 20 0 DIADLO CC[C@H](Nc1cc(C)[nH+]c(-c2ccncc2)n1)c1c(C)noc1C ZINC000161646124 337594057 /nfs/dbraw/zinc/59/40/57/337594057.db2.gz FFGUWGOGVROEDN-HNNXBMFYSA-N 1 2 323.400 4.015 20 0 DIADLO CC(C)CCn1ncc(NCc2[nH+]ccn2C(C)C)c1C(C)C ZINC000572354022 337614765 /nfs/dbraw/zinc/61/47/65/337614765.db2.gz MPEOWHKUJVLRLZ-UHFFFAOYSA-N 1 2 317.481 4.442 20 0 DIADLO CCn1cc(CNc2[nH+]cccc2O[C@@H](C)c2ccccc2)cn1 ZINC000162402148 337618945 /nfs/dbraw/zinc/61/89/45/337618945.db2.gz KUAOZHGZEJBGPD-HNNXBMFYSA-N 1 2 322.412 4.050 20 0 DIADLO Cc1nc(CNc2[nH+]ccc3ccc(F)cc32)nc2ccccc12 ZINC000572387726 337626456 /nfs/dbraw/zinc/62/64/56/337626456.db2.gz PWVYLBKGNLJDIM-UHFFFAOYSA-N 1 2 318.355 4.238 20 0 DIADLO Cc1ccc2[nH+]cc(CN(Cc3ccco3)Cc3ccco3)n2c1 ZINC000162578946 337641033 /nfs/dbraw/zinc/64/10/33/337641033.db2.gz FHSPBUTVOFYSGN-UHFFFAOYSA-N 1 2 321.380 4.031 20 0 DIADLO CC(=O)Nc1ccccc1C[NH+](Cc1ccco1)Cc1ccco1 ZINC000162574409 337643460 /nfs/dbraw/zinc/64/34/60/337643460.db2.gz WBMDJLSJSMZDKD-UHFFFAOYSA-N 1 2 324.380 4.033 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1ccncc1Cl ZINC000421829945 337647204 /nfs/dbraw/zinc/64/72/04/337647204.db2.gz ARQVECPKRWUSPW-LBPRGKRZSA-N 1 2 319.836 4.158 20 0 DIADLO CCCCc1nc(C[NH+]2CCC(OC(C)(C)C)CC2)cs1 ZINC000162626313 337647814 /nfs/dbraw/zinc/64/78/14/337647814.db2.gz XWGDHOOTAARZJT-UHFFFAOYSA-N 1 2 310.507 4.265 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2ccc(Cl)cc2OC)cs1 ZINC000421838840 337652817 /nfs/dbraw/zinc/65/28/17/337652817.db2.gz VWPFEGRKLMQCFQ-SNVBAGLBSA-N 1 2 310.850 4.218 20 0 DIADLO Fc1cc2c(c(F)c1F)[C@@H](Nc1ccc3c(c1)CC[NH2+]3)CC2 ZINC000423217863 337705000 /nfs/dbraw/zinc/70/50/00/337705000.db2.gz QTEAVMLVKFEYOT-AWEZNQCLSA-N 1 2 304.315 4.171 20 0 DIADLO C[C@H](Nc1ccccc1OCCn1cc[nH+]c1)C1CCCCC1 ZINC000527522674 337748643 /nfs/dbraw/zinc/74/86/43/337748643.db2.gz ICLXANMQBVYAJB-INIZCTEOSA-N 1 2 313.445 4.343 20 0 DIADLO COc1cc(C[NH2+][C@H](C)c2cscn2)cc(C(F)(F)F)c1 ZINC000527723873 337759029 /nfs/dbraw/zinc/75/90/29/337759029.db2.gz FLDVCSQQSDATQS-SECBINFHSA-N 1 2 316.348 4.021 20 0 DIADLO Cc1coc(-c2ccc(C)c(NCc3c[nH+]cn3C(C)C)c2)n1 ZINC000424138990 337759424 /nfs/dbraw/zinc/75/94/24/337759424.db2.gz CWCPOLNRTACNSE-UHFFFAOYSA-N 1 2 310.401 4.348 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ncccc1F ZINC000527828918 337767284 /nfs/dbraw/zinc/76/72/84/337767284.db2.gz YXNTYFGEFFAGQF-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO C[C@]12CCN(c3[nH+]ccc4ccccc43)C[C@H]1C2(Cl)Cl ZINC000528011715 337783535 /nfs/dbraw/zinc/78/35/35/337783535.db2.gz WMOFUYYDMMOCCU-HIFRSBDPSA-N 1 2 307.224 4.255 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc([C@@H]2CCCC23CC3)n1 ZINC000528155688 337790498 /nfs/dbraw/zinc/79/04/98/337790498.db2.gz AVOONWRCGGMCOP-AWEZNQCLSA-N 1 2 322.412 4.018 20 0 DIADLO Cc1ccccc1C[C@@H](C)c1nc(Cc2ccc[nH+]c2C)no1 ZINC000528213755 337795957 /nfs/dbraw/zinc/79/59/57/337795957.db2.gz POCGIEOGYIMGOS-CQSZACIVSA-N 1 2 307.397 4.018 20 0 DIADLO C[C@@H]1CC[C@H](c2noc(-c3cccc(Oc4cc[nH+]cc4)c3)n2)O1 ZINC000528238048 337797769 /nfs/dbraw/zinc/79/77/69/337797769.db2.gz LXHOTKSIZLQAFS-MLGOLLRUSA-N 1 2 323.352 4.164 20 0 DIADLO CCC[C@H](C(=O)Nc1c[nH+]ccc1OC)c1cccc(Cl)c1 ZINC000528317578 337801719 /nfs/dbraw/zinc/80/17/19/337801719.db2.gz FPZUBKKLZPGOTQ-AWEZNQCLSA-N 1 2 318.804 4.266 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H]2COc3ccc(F)cc32)c(Cl)c1 ZINC000424286457 337815474 /nfs/dbraw/zinc/81/54/74/337815474.db2.gz WCDRGTHXWXOZIN-QLJPJBMISA-N 1 2 321.779 4.272 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000107293746 337828335 /nfs/dbraw/zinc/82/83/35/337828335.db2.gz KVKVUDDAWFIVQU-CHWSQXEVSA-N 1 2 321.207 4.439 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000119134736 337855404 /nfs/dbraw/zinc/85/54/04/337855404.db2.gz XOXMLCUNJSHPKO-LSDHHAIUSA-N 1 2 300.789 4.094 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(-c3ccccc3F)o2)c(C)[nH+]1 ZINC000119298141 337856332 /nfs/dbraw/zinc/85/63/32/337856332.db2.gz LENKFAPQRJJRHF-UHFFFAOYSA-N 1 2 310.328 4.350 20 0 DIADLO Cc1ccsc1[C@H](CO)Nc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC000119936370 337866485 /nfs/dbraw/zinc/86/64/85/337866485.db2.gz OHMYBVRREGOSRQ-AWEZNQCLSA-N 1 2 319.474 4.239 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@@H](C)c1ccco1)c1ccccn1 ZINC000090913508 337887019 /nfs/dbraw/zinc/88/70/19/337887019.db2.gz MNGRNQHSMKKHEN-LIRRHRJNSA-N 1 2 308.381 4.123 20 0 DIADLO C[C@H]([NH2+][C@@H](c1cccc(F)c1)c1ccccn1)c1ccccn1 ZINC000090955963 337887463 /nfs/dbraw/zinc/88/74/63/337887463.db2.gz APFAOGVREZCYOY-LIRRHRJNSA-N 1 2 307.372 4.056 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccccc1Cl ZINC000537085627 337887869 /nfs/dbraw/zinc/88/78/69/337887869.db2.gz JOMXLFKVQAUQHK-HNNXBMFYSA-N 1 2 305.809 4.087 20 0 DIADLO CC[C@@H](C)[C@@H]([NH2+]Cc1noc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000537086039 337887907 /nfs/dbraw/zinc/88/79/07/337887907.db2.gz YVKHOTFUJYYGBW-BDJLRTHQSA-N 1 2 319.836 4.477 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)NC(C)(C)c1cccc(Cl)c1 ZINC000121684321 337897158 /nfs/dbraw/zinc/89/71/58/337897158.db2.gz CJJTVKYGKSEJNG-UHFFFAOYSA-N 1 2 303.793 4.100 20 0 DIADLO CC[C@@H](Cc1ccccc1)N(CC)C(=O)Nc1cc[nH+]cc1C ZINC000121893221 337902945 /nfs/dbraw/zinc/90/29/45/337902945.db2.gz VSUPWTSTEXGPDH-KRWDZBQOSA-N 1 2 311.429 4.265 20 0 DIADLO CC[C@H]1CN(C(=O)Nc2cc[nH+]cc2C)CC[C@@H]1c1ccccc1 ZINC000122073345 337906071 /nfs/dbraw/zinc/90/60/71/337906071.db2.gz WRHOCVNPZRNXCN-WMZOPIPTSA-N 1 2 323.440 4.438 20 0 DIADLO c1nc(C[NH2+]Cc2cccc(OCc3ccccc3)c2)cs1 ZINC000060526603 337913834 /nfs/dbraw/zinc/91/38/34/337913834.db2.gz IOSHLYOJVIYRFV-UHFFFAOYSA-N 1 2 310.422 4.012 20 0 DIADLO Cc1[nH+]c2ccccn2c1CNc1ccccc1OC(C)(C)C ZINC000537729063 337961219 /nfs/dbraw/zinc/96/12/19/337961219.db2.gz CJPDJBSWCLVIHR-UHFFFAOYSA-N 1 2 309.413 4.432 20 0 DIADLO COc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1cscn1)CCS2 ZINC000515357157 337986129 /nfs/dbraw/zinc/98/61/29/337986129.db2.gz WFXCZLRWIVWHSE-MFKMUULPSA-N 1 2 306.456 4.039 20 0 DIADLO CCSc1ccc(Cl)cc1C(=O)Nc1c[nH+]ccc1OC ZINC000084089514 338000036 /nfs/dbraw/zinc/00/00/36/338000036.db2.gz CUZQLTFTPZOFLI-UHFFFAOYSA-N 1 2 322.817 4.108 20 0 DIADLO Cc1cnc(C[NH2+]C(c2cccc(C)c2)c2cccc(C)c2)nc1 ZINC000516304530 338010289 /nfs/dbraw/zinc/01/02/89/338010289.db2.gz FFBSUVVOTAAFDK-UHFFFAOYSA-N 1 2 317.436 4.281 20 0 DIADLO C[C@H]([NH2+]CC(F)(F)c1ccccc1)c1ccc2c(c1)COC2 ZINC000516353891 338010554 /nfs/dbraw/zinc/01/05/54/338010554.db2.gz AJFOHLAVGWSIBP-ZDUSSCGKSA-N 1 2 303.352 4.159 20 0 DIADLO CC(C)c1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)cc1 ZINC000516528292 338013475 /nfs/dbraw/zinc/01/34/75/338013475.db2.gz PBLWBSVFIPPRCV-UHFFFAOYSA-N 1 2 323.371 4.387 20 0 DIADLO C[C@H](c1ccco1)[N@H+](CC(=O)Nc1ccccc1Cl)C1CC1 ZINC000086233798 338013717 /nfs/dbraw/zinc/01/37/17/338013717.db2.gz UFFIDHNICGODOU-GFCCVEGCSA-N 1 2 318.804 4.097 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](CC(=O)Nc1ccccc1Cl)C1CC1 ZINC000086233798 338013718 /nfs/dbraw/zinc/01/37/18/338013718.db2.gz UFFIDHNICGODOU-GFCCVEGCSA-N 1 2 318.804 4.097 20 0 DIADLO COc1ccc(C[NH2+][C@H](C)c2cscn2)cc1OCC(C)C ZINC000516492243 338013729 /nfs/dbraw/zinc/01/37/29/338013729.db2.gz ILRHHKDTMLABLO-CYBMUJFWSA-N 1 2 320.458 4.037 20 0 DIADLO CC(C)(C)c1cc(N2CC(CC(F)F)C2)nc(C(C)(C)C)[nH+]1 ZINC000425287425 338015645 /nfs/dbraw/zinc/01/56/45/338015645.db2.gz RLUBTMMFULDBOT-UHFFFAOYSA-N 1 2 311.420 4.163 20 0 DIADLO CCSCc1ccccc1C(=O)Nc1c(C)cc[nH+]c1C ZINC000425594214 338015794 /nfs/dbraw/zinc/01/57/94/338015794.db2.gz GJORISYQEVHTGE-UHFFFAOYSA-N 1 2 300.427 4.204 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)Cc1ccccc1Cl ZINC000425596083 338015804 /nfs/dbraw/zinc/01/58/04/338015804.db2.gz LKMVEGQOPXHTRR-LBPRGKRZSA-N 1 2 302.805 4.169 20 0 DIADLO CCCc1csc(C[N@H+](Cc2cccc(F)c2)C2CC2)n1 ZINC000426028195 338019749 /nfs/dbraw/zinc/01/97/49/338019749.db2.gz KXVNDGZSOSRCLR-UHFFFAOYSA-N 1 2 304.434 4.399 20 0 DIADLO CCCc1csc(C[N@@H+](Cc2cccc(F)c2)C2CC2)n1 ZINC000426028195 338019750 /nfs/dbraw/zinc/01/97/50/338019750.db2.gz KXVNDGZSOSRCLR-UHFFFAOYSA-N 1 2 304.434 4.399 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2)cc1F)c1nccn1C ZINC000426305294 338025949 /nfs/dbraw/zinc/02/59/49/338025949.db2.gz WCXAQFYVQVXTKH-CQSZACIVSA-N 1 2 309.388 4.077 20 0 DIADLO Cc1c[nH+]cc(CCc2nc([C@@H](C)c3ccccc3C)no2)c1 ZINC000426452505 338032392 /nfs/dbraw/zinc/03/23/92/338032392.db2.gz ZYYBLMRGVZGXFN-HNNXBMFYSA-N 1 2 307.397 4.018 20 0 DIADLO Cc1c[nH+]cc(CCc2nc([C@H](C)c3ccccc3C)no2)c1 ZINC000426452506 338032409 /nfs/dbraw/zinc/03/24/09/338032409.db2.gz ZYYBLMRGVZGXFN-OAHLLOKOSA-N 1 2 307.397 4.018 20 0 DIADLO CC(C)OC1CC(Nc2cccc([NH+]3CCCCCC3)c2)C1 ZINC000428247689 338044028 /nfs/dbraw/zinc/04/40/28/338044028.db2.gz ADXUAOTXFNFRQC-UHFFFAOYSA-N 1 2 302.462 4.435 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccccc2Cl)C(C)C)[nH]1 ZINC000428318225 338047023 /nfs/dbraw/zinc/04/70/23/338047023.db2.gz FWWZDCDOOJCEGH-HNNXBMFYSA-N 1 2 306.841 4.068 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2oc(C(C)C)nc2C)C2CC2)s1 ZINC000428346155 338048162 /nfs/dbraw/zinc/04/81/62/338048162.db2.gz NEIMEJKYGIGIQO-AWEZNQCLSA-N 1 2 305.447 4.112 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000428394137 338050019 /nfs/dbraw/zinc/05/00/19/338050019.db2.gz SMLFHBHSFBZIKU-UHFFFAOYSA-N 1 2 309.413 4.146 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000428394137 338050020 /nfs/dbraw/zinc/05/00/20/338050020.db2.gz SMLFHBHSFBZIKU-UHFFFAOYSA-N 1 2 309.413 4.146 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@@H]2COCc3ccccc32)cs1 ZINC000428451476 338052269 /nfs/dbraw/zinc/05/22/69/338052269.db2.gz BRICIQJPXHYPNE-SWLSCSKDSA-N 1 2 302.443 4.189 20 0 DIADLO CCCc1nc(C)c(C[N@H+](Cc2ccccc2OC)C2CC2)o1 ZINC000428464606 338053532 /nfs/dbraw/zinc/05/35/32/338053532.db2.gz QJCFWETUWGUGRD-UHFFFAOYSA-N 1 2 314.429 4.109 20 0 DIADLO CCCc1nc(C)c(C[N@@H+](Cc2ccccc2OC)C2CC2)o1 ZINC000428464606 338053533 /nfs/dbraw/zinc/05/35/33/338053533.db2.gz QJCFWETUWGUGRD-UHFFFAOYSA-N 1 2 314.429 4.109 20 0 DIADLO Cc1cc(N2CCc3c(Cl)cc(Cl)cc3[C@@H]2C)nc[nH+]1 ZINC000428693940 338058735 /nfs/dbraw/zinc/05/87/35/338058735.db2.gz RORCNMOCNUDSLP-JTQLQIEISA-N 1 2 308.212 4.216 20 0 DIADLO CC[C@H](F)C[N@@H+]1C[C@H](c2cccc(C(F)(F)F)c2)OC[C@H]1C ZINC000428809737 338061293 /nfs/dbraw/zinc/06/12/93/338061293.db2.gz GKVTUOVBCHMVDH-BYCMXARLSA-N 1 2 319.342 4.215 20 0 DIADLO CC[C@H](F)C[N@H+]1C[C@H](c2cccc(C(F)(F)F)c2)OC[C@H]1C ZINC000428809737 338061294 /nfs/dbraw/zinc/06/12/94/338061294.db2.gz GKVTUOVBCHMVDH-BYCMXARLSA-N 1 2 319.342 4.215 20 0 DIADLO C[C@H]1C[N@H+](Cc2coc(-c3ccccc3)n2)Cc2ccccc2O1 ZINC000429157320 338072148 /nfs/dbraw/zinc/07/21/48/338072148.db2.gz UWESJVFXWRPNSG-HNNXBMFYSA-N 1 2 320.392 4.125 20 0 DIADLO C[C@H]1C[N@@H+](Cc2coc(-c3ccccc3)n2)Cc2ccccc2O1 ZINC000429157320 338072149 /nfs/dbraw/zinc/07/21/49/338072149.db2.gz UWESJVFXWRPNSG-HNNXBMFYSA-N 1 2 320.392 4.125 20 0 DIADLO CC(C)([NH2+]Cc1nc2ccc(F)cc2o1)c1ccccc1F ZINC000429234090 338074124 /nfs/dbraw/zinc/07/41/24/338074124.db2.gz GIBKGCIEVXTFAB-UHFFFAOYSA-N 1 2 302.324 4.131 20 0 DIADLO CCO[C@@H](C)c1nc(C[NH2+]C(C)(C)c2ccccc2F)cs1 ZINC000429236921 338074164 /nfs/dbraw/zinc/07/41/64/338074164.db2.gz NCTDBKLPRFMRPS-LBPRGKRZSA-N 1 2 322.449 4.405 20 0 DIADLO Cc1ccc(-c2cnc(C[NH2+][C@H](C)c3cccc(O)c3)o2)cc1 ZINC000429299777 338077075 /nfs/dbraw/zinc/07/70/75/338077075.db2.gz GQZTWVRTSOAPLU-CQSZACIVSA-N 1 2 308.381 4.206 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@H](C)C(=O)Nc1ccc(Cl)cc1C ZINC000429393483 338079478 /nfs/dbraw/zinc/07/94/78/338079478.db2.gz LULMGMPIZYGSAW-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@H](C)C(=O)Nc1ccc(Cl)cc1C ZINC000429393483 338079479 /nfs/dbraw/zinc/07/94/79/338079479.db2.gz LULMGMPIZYGSAW-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO COC1(C[C@H](C)[NH2+]c2ccc(N3CCCC3)cc2C)CCC1 ZINC000429430509 338080807 /nfs/dbraw/zinc/08/08/07/338080807.db2.gz RSWYJNVXQGGNBL-INIZCTEOSA-N 1 2 302.462 4.355 20 0 DIADLO Cc1nc([C@H](C)[NH+]2CCC(CCc3ccc(C)cc3)CC2)no1 ZINC000429714100 338087945 /nfs/dbraw/zinc/08/79/45/338087945.db2.gz FOMJDHTZSUVXNW-HNNXBMFYSA-N 1 2 313.445 4.092 20 0 DIADLO C[N@H+](Cc1cc(C(C)(C)C)on1)Cc1ccc(OC(F)F)cc1 ZINC000429715920 338088195 /nfs/dbraw/zinc/08/81/95/338088195.db2.gz OHPQQDARQLECSX-UHFFFAOYSA-N 1 2 324.371 4.206 20 0 DIADLO C[N@@H+](Cc1cc(C(C)(C)C)on1)Cc1ccc(OC(F)F)cc1 ZINC000429715920 338088196 /nfs/dbraw/zinc/08/81/96/338088196.db2.gz OHPQQDARQLECSX-UHFFFAOYSA-N 1 2 324.371 4.206 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(C(C)(C)C)on2)cc1 ZINC000429729311 338088587 /nfs/dbraw/zinc/08/85/87/338088587.db2.gz XBPJOLPHCMKVHY-KRWDZBQOSA-N 1 2 314.429 4.318 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(C(C)(C)C)on2)cc1 ZINC000429729311 338088588 /nfs/dbraw/zinc/08/85/88/338088588.db2.gz XBPJOLPHCMKVHY-KRWDZBQOSA-N 1 2 314.429 4.318 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000430038083 338094151 /nfs/dbraw/zinc/09/41/51/338094151.db2.gz UPPIBYNYKHPVKN-UHFFFAOYSA-N 1 2 321.676 4.325 20 0 DIADLO CC1(C)C[N@H+](Cc2cc3c(cccc3F)[nH]2)[C@@H]1c1cccnc1 ZINC000430085426 338095443 /nfs/dbraw/zinc/09/54/43/338095443.db2.gz MUKJNQMBRRQCRP-GOSISDBHSA-N 1 2 309.388 4.285 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc3c(cccc3F)[nH]2)[C@@H]1c1cccnc1 ZINC000430085426 338095444 /nfs/dbraw/zinc/09/54/44/338095444.db2.gz MUKJNQMBRRQCRP-GOSISDBHSA-N 1 2 309.388 4.285 20 0 DIADLO CC1(C)C[N@H+](C/C=C\c2ccc(F)cc2F)[C@@H]1c1cccnc1 ZINC000430095571 338096283 /nfs/dbraw/zinc/09/62/83/338096283.db2.gz PUKCHTXEDQYOBO-WLPBJKJWSA-N 1 2 314.379 4.456 20 0 DIADLO CC1(C)C[N@@H+](C/C=C\c2ccc(F)cc2F)[C@@H]1c1cccnc1 ZINC000430095571 338096284 /nfs/dbraw/zinc/09/62/84/338096284.db2.gz PUKCHTXEDQYOBO-WLPBJKJWSA-N 1 2 314.379 4.456 20 0 DIADLO CC1(C)C[N@H+](Cc2cc3ccc(F)cc3[nH]2)[C@@H]1c1cccnc1 ZINC000430105409 338096814 /nfs/dbraw/zinc/09/68/14/338096814.db2.gz NVKZJQQIDYBRIW-GOSISDBHSA-N 1 2 309.388 4.285 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc3ccc(F)cc3[nH]2)[C@@H]1c1cccnc1 ZINC000430105409 338096815 /nfs/dbraw/zinc/09/68/15/338096815.db2.gz NVKZJQQIDYBRIW-GOSISDBHSA-N 1 2 309.388 4.285 20 0 DIADLO CSc1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccnc2)s1 ZINC000430108568 338097226 /nfs/dbraw/zinc/09/72/26/338097226.db2.gz VZQPMUKQKUFUBK-OAHLLOKOSA-N 1 2 304.484 4.448 20 0 DIADLO CSc1ccc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)s1 ZINC000430108568 338097227 /nfs/dbraw/zinc/09/72/27/338097227.db2.gz VZQPMUKQKUFUBK-OAHLLOKOSA-N 1 2 304.484 4.448 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2CC(C)(C)[C@H]2c2cccnc2)s1 ZINC000430111039 338097422 /nfs/dbraw/zinc/09/74/22/338097422.db2.gz NGJPKTFVOKWQBQ-OAHLLOKOSA-N 1 2 301.459 4.245 20 0 DIADLO CC(C)c1ncc(C[N@H+]2CC(C)(C)[C@H]2c2cccnc2)s1 ZINC000430111039 338097423 /nfs/dbraw/zinc/09/74/23/338097423.db2.gz NGJPKTFVOKWQBQ-OAHLLOKOSA-N 1 2 301.459 4.245 20 0 DIADLO Clc1ccc(C2CC[NH+](Cc3cc[nH]n3)CC2)c(Cl)c1 ZINC000430112089 338097594 /nfs/dbraw/zinc/09/75/94/338097594.db2.gz WEJBPKTZUKQMMO-UHFFFAOYSA-N 1 2 310.228 4.096 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)Nc1ccc(C)s1 ZINC000430373863 338106063 /nfs/dbraw/zinc/10/60/63/338106063.db2.gz JSQBNTHSTRQVJF-ZDUSSCGKSA-N 1 2 318.446 4.032 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1ccc(F)c(C)c1 ZINC000430861810 338117303 /nfs/dbraw/zinc/11/73/03/338117303.db2.gz CHLFHXUSGDHVGN-KRWDZBQOSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1ccc(F)c(C)c1 ZINC000430861810 338117304 /nfs/dbraw/zinc/11/73/04/338117304.db2.gz CHLFHXUSGDHVGN-KRWDZBQOSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1ccc(C)c(F)c1 ZINC000430862033 338117323 /nfs/dbraw/zinc/11/73/23/338117323.db2.gz CODFKNJEUPNLAI-KRWDZBQOSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1ccc(C)c(F)c1 ZINC000430862033 338117324 /nfs/dbraw/zinc/11/73/24/338117324.db2.gz CODFKNJEUPNLAI-KRWDZBQOSA-N 1 2 301.409 4.078 20 0 DIADLO Cc1ccc([C@@H]2CCCN2c2[nH+]c3ccc(F)cc3n2C)s1 ZINC000431410003 338130084 /nfs/dbraw/zinc/13/00/84/338130084.db2.gz LIURRQPDQYPRFX-AWEZNQCLSA-N 1 2 315.417 4.424 20 0 DIADLO FC(F)(F)c1ccc(-c2nc(COc3cc[nH+]cc3)co2)cc1 ZINC000431485465 338131943 /nfs/dbraw/zinc/13/19/43/338131943.db2.gz UQYUWFNHHALJEZ-UHFFFAOYSA-N 1 2 320.270 4.334 20 0 DIADLO Clc1ccc(-c2nnc(COc3cc[nH+]cc3)o2)c(Cl)c1 ZINC000431494763 338132295 /nfs/dbraw/zinc/13/22/95/338132295.db2.gz NJYNFSBXNWUABR-UHFFFAOYSA-N 1 2 322.151 4.017 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(F)cc1 ZINC000162829409 338136908 /nfs/dbraw/zinc/13/69/08/338136908.db2.gz GFIRDPUAYUXWCH-ZDUSSCGKSA-N 1 2 323.371 4.348 20 0 DIADLO CC(C)c1nc(N2CC[C@H](c3cccc(Cl)c3)C2)cc[nH+]1 ZINC000432132350 338146505 /nfs/dbraw/zinc/14/65/05/338146505.db2.gz BPDKBMHJBPYDED-AWEZNQCLSA-N 1 2 301.821 4.247 20 0 DIADLO COc1cnccc1[C@H](C)[NH2+]Cc1csc(Cl)c1Cl ZINC000432236421 338149729 /nfs/dbraw/zinc/14/97/29/338149729.db2.gz UMCCMTGCXGUPHE-QMMMGPOBSA-N 1 2 317.241 4.309 20 0 DIADLO COc1ccc(F)cc1C[NH2+]Cc1csc(Cl)c1Cl ZINC000432246758 338150639 /nfs/dbraw/zinc/15/06/39/338150639.db2.gz NVYMVVDVIGAQKP-UHFFFAOYSA-N 1 2 320.216 4.492 20 0 DIADLO CN(C)c1ccc(NCc2csc(Cl)c2Cl)c[nH+]1 ZINC000432251338 338150893 /nfs/dbraw/zinc/15/08/93/338150893.db2.gz SECWXIXINCTLST-UHFFFAOYSA-N 1 2 302.230 4.128 20 0 DIADLO Cc1csc(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)n1 ZINC000432259720 338151807 /nfs/dbraw/zinc/15/18/07/338151807.db2.gz URIRZEKUTODUOH-UHFFFAOYSA-N 1 2 305.205 4.187 20 0 DIADLO Cn1cccc1CNc1ccc(-c2ccc(Cl)s2)c[nH+]1 ZINC000432729987 338164581 /nfs/dbraw/zinc/16/45/81/338164581.db2.gz JINBNNGORLTTKH-UHFFFAOYSA-N 1 2 303.818 4.414 20 0 DIADLO Clc1scc(C[N@@H+]2CCC[C@@H](n3cccn3)C2)c1Cl ZINC000432737273 338165212 /nfs/dbraw/zinc/16/52/12/338165212.db2.gz BRRLUTCDFWSDTM-LLVKDONJSA-N 1 2 316.257 4.089 20 0 DIADLO Clc1scc(C[N@H+]2CCC[C@@H](n3cccn3)C2)c1Cl ZINC000432737273 338165213 /nfs/dbraw/zinc/16/52/13/338165213.db2.gz BRRLUTCDFWSDTM-LLVKDONJSA-N 1 2 316.257 4.089 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCc4ccsc4C3)sc2c1 ZINC000432751607 338166159 /nfs/dbraw/zinc/16/61/59/338166159.db2.gz YNEQFAZDBOHCQY-UHFFFAOYSA-N 1 2 304.415 4.055 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCc4ccsc4C3)sc2c1 ZINC000432751607 338166160 /nfs/dbraw/zinc/16/61/60/338166160.db2.gz YNEQFAZDBOHCQY-UHFFFAOYSA-N 1 2 304.415 4.055 20 0 DIADLO C[N@H+](Cc1csc(C2CC2)n1)Cc1ccc(F)c(Cl)c1 ZINC000432785748 338167716 /nfs/dbraw/zinc/16/77/16/338167716.db2.gz ABMGGDYCBYYOLM-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO C[N@@H+](Cc1csc(C2CC2)n1)Cc1ccc(F)c(Cl)c1 ZINC000432785748 338167717 /nfs/dbraw/zinc/16/77/17/338167717.db2.gz ABMGGDYCBYYOLM-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO Cn1c2ccccc2[nH+]c1N1CCC(F)(c2ccccc2)CC1 ZINC000432832206 338169993 /nfs/dbraw/zinc/16/99/93/338169993.db2.gz NDNDRKYIITVZNF-UHFFFAOYSA-N 1 2 309.388 4.039 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432919900 338173051 /nfs/dbraw/zinc/17/30/51/338173051.db2.gz WCDSHSGQOFIPPD-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432919900 338173052 /nfs/dbraw/zinc/17/30/52/338173052.db2.gz WCDSHSGQOFIPPD-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432919568 338173215 /nfs/dbraw/zinc/17/32/15/338173215.db2.gz UQYLLJGAKQELGR-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432919568 338173216 /nfs/dbraw/zinc/17/32/16/338173216.db2.gz UQYLLJGAKQELGR-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO C[C@H](c1cnn(C)c1)[N@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432922671 338173334 /nfs/dbraw/zinc/17/33/34/338173334.db2.gz OXLCJHJGEVEHBR-SECBINFHSA-N 1 2 316.207 4.059 20 0 DIADLO C[C@H](c1cnn(C)c1)[N@@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432922671 338173335 /nfs/dbraw/zinc/17/33/35/338173335.db2.gz OXLCJHJGEVEHBR-SECBINFHSA-N 1 2 316.207 4.059 20 0 DIADLO Cc1cccc2nc(C[N@@H+](C)Cc3ccc(F)c(Cl)c3)cn21 ZINC000433230122 338186799 /nfs/dbraw/zinc/18/67/99/338186799.db2.gz DTVSSVJFUKUTFL-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1cccc2nc(C[N@H+](C)Cc3ccc(F)c(Cl)c3)cn21 ZINC000433230122 338186800 /nfs/dbraw/zinc/18/68/00/338186800.db2.gz DTVSSVJFUKUTFL-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO C[N@H+](Cc1nc2cc(F)ccc2o1)Cc1ccc(F)c(Cl)c1 ZINC000433238614 338187346 /nfs/dbraw/zinc/18/73/46/338187346.db2.gz BMEIFNTYSKWAQI-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO C[N@@H+](Cc1nc2cc(F)ccc2o1)Cc1ccc(F)c(Cl)c1 ZINC000433238614 338187347 /nfs/dbraw/zinc/18/73/47/338187347.db2.gz BMEIFNTYSKWAQI-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO CCCCc1noc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)n1 ZINC000433307994 338191053 /nfs/dbraw/zinc/19/10/53/338191053.db2.gz WOCFGSZPRNCCQL-AWEZNQCLSA-N 1 2 319.836 4.055 20 0 DIADLO CCCCc1noc(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)n1 ZINC000433307994 338191054 /nfs/dbraw/zinc/19/10/54/338191054.db2.gz WOCFGSZPRNCCQL-AWEZNQCLSA-N 1 2 319.836 4.055 20 0 DIADLO CC[C@H]([NH2+]Cc1ncc(C(F)(F)F)s1)c1c(C)noc1C ZINC000433333566 338192896 /nfs/dbraw/zinc/19/28/96/338192896.db2.gz HKXVAHMDGMONIG-VIFPVBQESA-N 1 2 319.352 4.008 20 0 DIADLO Cc1ccc([C@@]2(C)CCN(C(=O)Nc3ccc(C)[nH+]c3C)C2)cc1 ZINC000433590995 338197620 /nfs/dbraw/zinc/19/76/20/338197620.db2.gz OGSYHMSRVKIRFT-FQEVSTJZSA-N 1 2 323.440 4.202 20 0 DIADLO CC[C@H](Nc1[nH+]c(C)nc2[nH]ccc21)c1ccc(F)cc1F ZINC000433789592 338201990 /nfs/dbraw/zinc/20/19/90/338201990.db2.gz NZLYUNWZGGVWOQ-AWEZNQCLSA-N 1 2 302.328 4.108 20 0 DIADLO Cc1ccc([C@H]2CCCN2c2[nH+]c(C)nc3[nH]ccc32)cc1C ZINC000433792850 338201994 /nfs/dbraw/zinc/20/19/94/338201994.db2.gz KCHASILWJOCUEB-QGZVFWFLSA-N 1 2 306.413 4.225 20 0 DIADLO FC1(c2ccccc2)CC[NH+](Cc2ncc(Cl)s2)CC1 ZINC000434490408 338218098 /nfs/dbraw/zinc/21/80/98/338218098.db2.gz CUVNYMQPIXKUHW-UHFFFAOYSA-N 1 2 310.825 4.257 20 0 DIADLO CC(C)(C)c1cnc(C[NH+]2CCC(F)(c3ccccc3)CC2)o1 ZINC000434503390 338218892 /nfs/dbraw/zinc/21/88/92/338218892.db2.gz OOOYUYKUODLUHB-UHFFFAOYSA-N 1 2 316.420 4.433 20 0 DIADLO CC(C)n1ncnc1C[N@@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000434510684 338218983 /nfs/dbraw/zinc/21/89/83/338218983.db2.gz NXAYXUZMBSUPKR-INIZCTEOSA-N 1 2 318.852 4.240 20 0 DIADLO CC(C)n1ncnc1C[N@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000434510684 338218984 /nfs/dbraw/zinc/21/89/84/338218984.db2.gz NXAYXUZMBSUPKR-INIZCTEOSA-N 1 2 318.852 4.240 20 0 DIADLO CC[C@H](c1ccccc1)[S@](=O)Cc1[nH+]ccn1-c1ccccc1 ZINC000434623611 338221519 /nfs/dbraw/zinc/22/15/19/338221519.db2.gz DENSRGVAVRVMAZ-WZONZLPQSA-N 1 2 324.449 4.272 20 0 DIADLO CC[C@@H](c1ccccc1)[S@@](=O)Cc1[nH+]ccn1-c1ccccc1 ZINC000434623609 338221569 /nfs/dbraw/zinc/22/15/69/338221569.db2.gz DENSRGVAVRVMAZ-MBSDFSHPSA-N 1 2 324.449 4.272 20 0 DIADLO C[C@@H]1CC[C@]2(CC[N@H+](Cc3ncc(C(F)(F)F)s3)C2)C1 ZINC000434980871 338228416 /nfs/dbraw/zinc/22/84/16/338228416.db2.gz HHHDIKJRCWEIHJ-MFKMUULPSA-N 1 2 304.381 4.174 20 0 DIADLO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3ncc(C(F)(F)F)s3)C2)C1 ZINC000434980871 338228417 /nfs/dbraw/zinc/22/84/17/338228417.db2.gz HHHDIKJRCWEIHJ-MFKMUULPSA-N 1 2 304.381 4.174 20 0 DIADLO Cc1ccc(C)c(C[N@H+](C)Cc2ncc(C(F)(F)F)s2)c1 ZINC000434986830 338228978 /nfs/dbraw/zinc/22/89/78/338228978.db2.gz JGDYFBPLKMUGIJ-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1ccc(C)c(C[N@@H+](C)Cc2ncc(C(F)(F)F)s2)c1 ZINC000434986830 338228979 /nfs/dbraw/zinc/22/89/79/338228979.db2.gz JGDYFBPLKMUGIJ-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)C[C@H](C)O1 ZINC000435768380 338248414 /nfs/dbraw/zinc/24/84/14/338248414.db2.gz PTYTZXOCOYZTOA-BETUJISGSA-N 1 2 321.367 4.050 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(OC(F)F)ccc3ccccc32)C[C@H](C)O1 ZINC000435768380 338248415 /nfs/dbraw/zinc/24/84/15/338248415.db2.gz PTYTZXOCOYZTOA-BETUJISGSA-N 1 2 321.367 4.050 20 0 DIADLO FC(F)(F)Oc1ccccc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000435769312 338248504 /nfs/dbraw/zinc/24/85/04/338248504.db2.gz VNXRITPROXVDSP-CQSZACIVSA-N 1 2 310.319 4.250 20 0 DIADLO FC(F)(F)Oc1ccccc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000435769312 338248505 /nfs/dbraw/zinc/24/85/05/338248505.db2.gz VNXRITPROXVDSP-CQSZACIVSA-N 1 2 310.319 4.250 20 0 DIADLO CCC[C@@H](NC(=O)[C@H](C)[NH+]1Cc2ccccc2C1)c1ccccc1 ZINC000436133986 338259239 /nfs/dbraw/zinc/25/92/39/338259239.db2.gz UFSKZADLHWTNIF-OXJNMPFZSA-N 1 2 322.452 4.048 20 0 DIADLO O=C(Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)c1ccsc1 ZINC000436161981 338260037 /nfs/dbraw/zinc/26/00/37/338260037.db2.gz QEZGIQLPJQRLSM-UHFFFAOYSA-N 1 2 323.421 4.200 20 0 DIADLO CC1(CC(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)CC1 ZINC000436167998 338260382 /nfs/dbraw/zinc/26/03/82/338260382.db2.gz HSKPKPDRESTWQV-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO CC(C)CCC(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436170460 338260469 /nfs/dbraw/zinc/26/04/69/338260469.db2.gz ASWMKGFZEHVFRW-UHFFFAOYSA-N 1 2 311.429 4.261 20 0 DIADLO O=C(Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)C1CCCCC1 ZINC000436178181 338260827 /nfs/dbraw/zinc/26/08/27/338260827.db2.gz GWTARYVZUGKAJC-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO CC(C)[C@H]1C[C@H]1C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436185671 338261092 /nfs/dbraw/zinc/26/10/92/338261092.db2.gz FKPZPRGMPAAYGW-QZTJIDSGSA-N 1 2 323.440 4.117 20 0 DIADLO CC(C)[C@@H]1C[C@H]1C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436185676 338261145 /nfs/dbraw/zinc/26/11/45/338261145.db2.gz FKPZPRGMPAAYGW-ZWKOTPCHSA-N 1 2 323.440 4.117 20 0 DIADLO COc1cccc2c(NCc3ccc(F)c(F)c3)cc[nH+]c12 ZINC000436196159 338261563 /nfs/dbraw/zinc/26/15/63/338261563.db2.gz GQXRQVWHFRXNEV-UHFFFAOYSA-N 1 2 300.308 4.134 20 0 DIADLO CC1=CCC[N@H+](Cc2csc(COc3ccc(F)cc3)n2)C1 ZINC000436263773 338264366 /nfs/dbraw/zinc/26/43/66/338264366.db2.gz OJWOVVJOWFDZPS-UHFFFAOYSA-N 1 2 318.417 4.013 20 0 DIADLO CC1=CCC[N@@H+](Cc2csc(COc3ccc(F)cc3)n2)C1 ZINC000436263773 338264367 /nfs/dbraw/zinc/26/43/67/338264367.db2.gz OJWOVVJOWFDZPS-UHFFFAOYSA-N 1 2 318.417 4.013 20 0 DIADLO Cc1ccc(OCc2nc(C[N@H+]3CCC=C(C)C3)cs2)cc1 ZINC000436269271 338264653 /nfs/dbraw/zinc/26/46/53/338264653.db2.gz JLGIIGOELRZOMM-UHFFFAOYSA-N 1 2 314.454 4.183 20 0 DIADLO Cc1ccc(OCc2nc(C[N@@H+]3CCC=C(C)C3)cs2)cc1 ZINC000436269271 338264654 /nfs/dbraw/zinc/26/46/54/338264654.db2.gz JLGIIGOELRZOMM-UHFFFAOYSA-N 1 2 314.454 4.183 20 0 DIADLO CC1=CCCN(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000436357178 338269602 /nfs/dbraw/zinc/26/96/02/338269602.db2.gz CZHBBDAUJXPNFP-UHFFFAOYSA-N 1 2 309.369 4.058 20 0 DIADLO CCCCOC1CCN(c2cc[nH+]c3c(OC)cccc23)CC1 ZINC000436428836 338272261 /nfs/dbraw/zinc/27/22/61/338272261.db2.gz CFGYPNZBYXVYEA-UHFFFAOYSA-N 1 2 314.429 4.029 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@H](C)[C@H]3CCCC[C@H]32)c(C)[nH+]1 ZINC000436488226 338273993 /nfs/dbraw/zinc/27/39/93/338273993.db2.gz DNHUESHJOCDYTI-APHBMKBZSA-N 1 2 301.434 4.049 20 0 DIADLO Cc1[nH]ncc1C[N@H+](Cc1ccccc1)[C@H](C)c1ccccc1 ZINC000436655176 338281611 /nfs/dbraw/zinc/28/16/11/338281611.db2.gz ZFRBBUMCUTZTKO-QGZVFWFLSA-N 1 2 305.425 4.482 20 0 DIADLO Cc1[nH]ncc1C[N@@H+](Cc1ccccc1)[C@H](C)c1ccccc1 ZINC000436655176 338281612 /nfs/dbraw/zinc/28/16/12/338281612.db2.gz ZFRBBUMCUTZTKO-QGZVFWFLSA-N 1 2 305.425 4.482 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2O)ccc1Oc1cc[nH+]cc1 ZINC000436728023 338284435 /nfs/dbraw/zinc/28/44/35/338284435.db2.gz GSPGZBKCIXCELJ-UHFFFAOYSA-N 1 2 320.348 4.140 20 0 DIADLO Cc1ccc(-c2noc([C@H](C)[NH+]3Cc4ccccc4C3)n2)cc1F ZINC000155520566 338286966 /nfs/dbraw/zinc/28/69/66/338286966.db2.gz HQEHMIQZMXWYFX-ZDUSSCGKSA-N 1 2 323.371 4.261 20 0 DIADLO CCCCCc1ccc([C@H](CC)[NH2+][C@H](C)c2ncn(C)n2)cc1 ZINC000437057677 338299014 /nfs/dbraw/zinc/29/90/14/338299014.db2.gz VOSDSRKDTGHLTC-QAPCUYQASA-N 1 2 314.477 4.350 20 0 DIADLO CC1=C(C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)CCC1 ZINC000437284090 338306113 /nfs/dbraw/zinc/30/61/13/338306113.db2.gz AAEKEFNCXZLOBY-UHFFFAOYSA-N 1 2 321.424 4.325 20 0 DIADLO Fc1cccc(CSCc2[nH+]ccn2CC(F)(F)F)c1F ZINC000437294928 338306404 /nfs/dbraw/zinc/30/64/04/338306404.db2.gz NUZFPTGACUWBEH-UHFFFAOYSA-N 1 2 322.302 4.157 20 0 DIADLO C1=CC[C@@]2(CC1)CCC[N@@H+](Cc1noc(C3CCCCC3)n1)C2 ZINC000437542548 338313124 /nfs/dbraw/zinc/31/31/24/338313124.db2.gz UOCUPTSQBJBJNT-LJQANCHMSA-N 1 2 315.461 4.440 20 0 DIADLO C1=CC[C@@]2(CC1)CCC[N@H+](Cc1noc(C3CCCCC3)n1)C2 ZINC000437542548 338313125 /nfs/dbraw/zinc/31/31/25/338313125.db2.gz UOCUPTSQBJBJNT-LJQANCHMSA-N 1 2 315.461 4.440 20 0 DIADLO Cc1ccc(OCc2c[nH+]cn2Cc2ccccc2)c(Cl)c1 ZINC000437611727 338316144 /nfs/dbraw/zinc/31/61/44/338316144.db2.gz DPMXHIWTHPAWOM-UHFFFAOYSA-N 1 2 312.800 4.472 20 0 DIADLO Fc1ccc(Cl)cc1OCc1c[nH+]cn1Cc1ccccc1 ZINC000437613615 338316160 /nfs/dbraw/zinc/31/61/60/338316160.db2.gz BTGJZNCHIKCYKN-UHFFFAOYSA-N 1 2 316.763 4.303 20 0 DIADLO CCCOc1ccc(OCc2c[nH+]cn2Cc2ccccc2)cc1 ZINC000437621244 338316353 /nfs/dbraw/zinc/31/63/53/338316353.db2.gz OWBLMLBMBYECAP-UHFFFAOYSA-N 1 2 322.408 4.299 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3c(cccc3F)[nH]2)C[C@@H](c2ccccc2)O1 ZINC000437683930 338318248 /nfs/dbraw/zinc/31/82/48/338318248.db2.gz BONGLHZJOTZHFU-VLIAUNLRSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3c(cccc3F)[nH]2)C[C@@H](c2ccccc2)O1 ZINC000437683930 338318249 /nfs/dbraw/zinc/31/82/49/338318249.db2.gz BONGLHZJOTZHFU-VLIAUNLRSA-N 1 2 324.399 4.269 20 0 DIADLO Fc1cccc2[nH]c(C[N@@H+]3CCCC[C@H]3c3nccs3)cc21 ZINC000437745348 338319875 /nfs/dbraw/zinc/31/98/75/338319875.db2.gz GBYDKZUWRARXAF-INIZCTEOSA-N 1 2 315.417 4.491 20 0 DIADLO Fc1cccc2[nH]c(C[N@H+]3CCCC[C@H]3c3nccs3)cc21 ZINC000437745348 338319876 /nfs/dbraw/zinc/31/98/76/338319876.db2.gz GBYDKZUWRARXAF-INIZCTEOSA-N 1 2 315.417 4.491 20 0 DIADLO Oc1ccc([N@H+](CCc2ccccc2)CCc2cccnc2)cc1 ZINC000437895267 338324394 /nfs/dbraw/zinc/32/43/94/338324394.db2.gz KQJCGJXZOOFUHG-UHFFFAOYSA-N 1 2 318.420 4.079 20 0 DIADLO Oc1ccc([N@@H+](CCc2ccccc2)CCc2cccnc2)cc1 ZINC000437895267 338324395 /nfs/dbraw/zinc/32/43/95/338324395.db2.gz KQJCGJXZOOFUHG-UHFFFAOYSA-N 1 2 318.420 4.079 20 0 DIADLO CCCCCOc1ccc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)cc1 ZINC000437960923 338326487 /nfs/dbraw/zinc/32/64/87/338326487.db2.gz GSHMCJCHMFHMHU-SFHVURJKSA-N 1 2 313.445 4.316 20 0 DIADLO CCCCCOc1ccc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)cc1 ZINC000437960923 338326488 /nfs/dbraw/zinc/32/64/88/338326488.db2.gz GSHMCJCHMFHMHU-SFHVURJKSA-N 1 2 313.445 4.316 20 0 DIADLO CC[C@@H](C)C[C@@H](C)NC(=O)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000437980005 338327168 /nfs/dbraw/zinc/32/71/68/338327168.db2.gz RYITZGCXDNMXNO-ZIAGYGMSSA-N 1 2 314.433 4.033 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NCc2ccc(Cl)cc2F)c1 ZINC000438077803 338330223 /nfs/dbraw/zinc/33/02/23/338330223.db2.gz MNIZXNXBKIGAGJ-UHFFFAOYSA-N 1 2 315.779 4.492 20 0 DIADLO CCc1ccc(NCc2c[nH+]cn2Cc2ccccc2)cc1C ZINC000438301259 338339003 /nfs/dbraw/zinc/33/90/03/338339003.db2.gz FTYYLLGCACJINO-UHFFFAOYSA-N 1 2 305.425 4.414 20 0 DIADLO CCC(=O)c1cccc(NCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000438327572 338339694 /nfs/dbraw/zinc/33/96/94/338339694.db2.gz XETKHJSEIVYJNM-UHFFFAOYSA-N 1 2 319.408 4.136 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(Cl)c2)C[N@@H+]1Cc1cccc(O)c1 ZINC000438538401 338347398 /nfs/dbraw/zinc/34/73/98/338347398.db2.gz CPCKXRZZVFQBOH-ACJLOTCBSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(Cl)c2)C[N@H+]1Cc1cccc(O)c1 ZINC000438538401 338347399 /nfs/dbraw/zinc/34/73/99/338347399.db2.gz CPCKXRZZVFQBOH-ACJLOTCBSA-N 1 2 317.816 4.008 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@H](c3cccc(Cl)c3)OC[C@@H]2C)cn1 ZINC000438550804 338347785 /nfs/dbraw/zinc/34/77/85/338347785.db2.gz BPGONHZIGBDWLU-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@H](c3cccc(Cl)c3)OC[C@@H]2C)cn1 ZINC000438550804 338347786 /nfs/dbraw/zinc/34/77/86/338347786.db2.gz BPGONHZIGBDWLU-KBXCAEBGSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H](c3cccc(Cl)c3)OC[C@@H]2C)o1 ZINC000438555349 338348036 /nfs/dbraw/zinc/34/80/36/338348036.db2.gz QVPFOOZVLHRQRQ-SJCJKPOMSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H](c3cccc(Cl)c3)OC[C@@H]2C)o1 ZINC000438555349 338348037 /nfs/dbraw/zinc/34/80/37/338348037.db2.gz QVPFOOZVLHRQRQ-SJCJKPOMSA-N 1 2 305.805 4.203 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cs1 ZINC000438758756 338351796 /nfs/dbraw/zinc/35/17/96/338351796.db2.gz WAVNESAIZXRKFZ-INIZCTEOSA-N 1 2 303.475 4.397 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)cs1 ZINC000438758756 338351797 /nfs/dbraw/zinc/35/17/97/338351797.db2.gz WAVNESAIZXRKFZ-INIZCTEOSA-N 1 2 303.475 4.397 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+]1CCCc2c3cccc(F)c3[nH]c2C1 ZINC000439463403 338370466 /nfs/dbraw/zinc/37/04/66/338370466.db2.gz BLXUSQPRPGRDQM-ZDUSSCGKSA-N 1 2 309.388 4.211 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+]1CCCc2c3cccc(F)c3[nH]c2C1 ZINC000439463403 338370467 /nfs/dbraw/zinc/37/04/67/338370467.db2.gz BLXUSQPRPGRDQM-ZDUSSCGKSA-N 1 2 309.388 4.211 20 0 DIADLO CC(C)=CC[N@H+](Cc1ccc(Cl)cc1)Cc1nccc(C)n1 ZINC000439483072 338371297 /nfs/dbraw/zinc/37/12/97/338371297.db2.gz DLMSPUFESGWOKL-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO CC(C)=CC[N@@H+](Cc1ccc(Cl)cc1)Cc1nccc(C)n1 ZINC000439483072 338371298 /nfs/dbraw/zinc/37/12/98/338371298.db2.gz DLMSPUFESGWOKL-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO FC(F)Oc1ccccc1CSCc1cn2ccccc2[nH+]1 ZINC000439540039 338372746 /nfs/dbraw/zinc/37/27/46/338372746.db2.gz GTOKBTNYVQQRBH-UHFFFAOYSA-N 1 2 320.364 4.369 20 0 DIADLO CCC[C@@H]([NH2+][C@H](C)c1cccc(C(F)(F)F)c1)C(=O)OCC ZINC000439557999 338373053 /nfs/dbraw/zinc/37/30/53/338373053.db2.gz QIKKJMXXBVPJCH-BXUZGUMPSA-N 1 2 317.351 4.088 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000440409745 338386890 /nfs/dbraw/zinc/38/68/90/338386890.db2.gz AVAOYOZPGAITTD-GFCCVEGCSA-N 1 2 304.459 4.339 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000440409745 338386891 /nfs/dbraw/zinc/38/68/91/338386891.db2.gz AVAOYOZPGAITTD-GFCCVEGCSA-N 1 2 304.459 4.339 20 0 DIADLO CC(C)c1ncc(C[N@H+](C)[C@H](C)c2ccc(F)cc2F)cn1 ZINC000440478564 338388311 /nfs/dbraw/zinc/38/83/11/338388311.db2.gz LNBMGWCWUKKXQQ-GFCCVEGCSA-N 1 2 305.372 4.071 20 0 DIADLO CC(C)c1ncc(C[N@@H+](C)[C@H](C)c2ccc(F)cc2F)cn1 ZINC000440478564 338388312 /nfs/dbraw/zinc/38/83/12/338388312.db2.gz LNBMGWCWUKKXQQ-GFCCVEGCSA-N 1 2 305.372 4.071 20 0 DIADLO CC[C@@H](F)C[N@@H+]1CCCC[C@H]1c1nc(-c2cccc(F)c2)c[nH]1 ZINC000440500159 338388567 /nfs/dbraw/zinc/38/85/67/338388567.db2.gz YJMIUGNMEUQFPD-PBHICJAKSA-N 1 2 319.399 4.491 20 0 DIADLO CC[C@@H](F)C[N@H+]1CCCC[C@H]1c1nc(-c2cccc(F)c2)c[nH]1 ZINC000440500159 338388568 /nfs/dbraw/zinc/38/85/68/338388568.db2.gz YJMIUGNMEUQFPD-PBHICJAKSA-N 1 2 319.399 4.491 20 0 DIADLO CO[C@H]1CCN(c2cc(C(C)(C)C)[nH+]c(C(C)(C)C)n2)[C@H](C)C1 ZINC000440669271 338394891 /nfs/dbraw/zinc/39/48/91/338394891.db2.gz DUZAPGDAXOAULB-KGLIPLIRSA-N 1 2 319.493 4.075 20 0 DIADLO COc1cccc2c(NCc3ccc4c(n3)CCCC4)cc[nH+]c12 ZINC000440671104 338394925 /nfs/dbraw/zinc/39/49/25/338394925.db2.gz KFPMNAOHZJRSQD-UHFFFAOYSA-N 1 2 319.408 4.129 20 0 DIADLO CC[C@H](F)C[N@@H+]1CCCC[C@H]1c1nc(-c2ccccc2)no1 ZINC000440690713 338395185 /nfs/dbraw/zinc/39/51/85/338395185.db2.gz DEPSYOPTIUYVDQ-GJZGRUSLSA-N 1 2 303.381 4.012 20 0 DIADLO CC[C@H](F)C[N@H+]1CCCC[C@H]1c1nc(-c2ccccc2)no1 ZINC000440690713 338395186 /nfs/dbraw/zinc/39/51/86/338395186.db2.gz DEPSYOPTIUYVDQ-GJZGRUSLSA-N 1 2 303.381 4.012 20 0 DIADLO Cc1[nH]c2ccccc2c1C(=O)C[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000440903363 338399545 /nfs/dbraw/zinc/39/95/45/338399545.db2.gz AAUUZSYQRJMHGF-AWEZNQCLSA-N 1 2 322.408 4.478 20 0 DIADLO Cc1[nH]c2ccccc2c1C(=O)C[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000440903363 338399546 /nfs/dbraw/zinc/39/95/46/338399546.db2.gz AAUUZSYQRJMHGF-AWEZNQCLSA-N 1 2 322.408 4.478 20 0 DIADLO CCc1ccc(NC(=O)C[N@H+]([C@@H](C)c2ccco2)C2CC2)cc1 ZINC000440912579 338399718 /nfs/dbraw/zinc/39/97/18/338399718.db2.gz WFAOVLQJHNXGDD-AWEZNQCLSA-N 1 2 312.413 4.006 20 0 DIADLO CCc1ccc(NC(=O)C[N@@H+]([C@@H](C)c2ccco2)C2CC2)cc1 ZINC000440912579 338399719 /nfs/dbraw/zinc/39/97/19/338399719.db2.gz WFAOVLQJHNXGDD-AWEZNQCLSA-N 1 2 312.413 4.006 20 0 DIADLO CC1(C)C[NH+](Cc2csc(-c3cccs3)n2)CC(C)(C)O1 ZINC000442870943 338436784 /nfs/dbraw/zinc/43/67/84/338436784.db2.gz DXXRWLBBXHBQLA-UHFFFAOYSA-N 1 2 322.499 4.261 20 0 DIADLO Cc1ccc(NC(=O)c2cccc(-c3cscn3)c2)c(C)[nH+]1 ZINC000446435342 338528086 /nfs/dbraw/zinc/52/80/86/338528086.db2.gz XNMCSAAOVYYSTH-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H](c2ccccc2)C2CCC2)c(C)[nH+]1 ZINC000447178924 338547026 /nfs/dbraw/zinc/54/70/26/338547026.db2.gz WQFRKZOFJJPATH-SFHVURJKSA-N 1 2 309.413 4.361 20 0 DIADLO Cc1ccc(NC(=O)N[C@H]2CCC[C@@H]2Cc2ccccc2)c(C)[nH+]1 ZINC000447197013 338547367 /nfs/dbraw/zinc/54/73/67/338547367.db2.gz ZLFDZKSWJNMBJT-MJGOQNOKSA-N 1 2 323.440 4.231 20 0 DIADLO COCCSCCCOc1cc(C)[nH+]c2c(C)cccc12 ZINC000447326281 338549639 /nfs/dbraw/zinc/54/96/39/338549639.db2.gz OBTZGSGRJRIADY-UHFFFAOYSA-N 1 2 305.443 4.000 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@H](C)c1nccn1C ZINC000447567072 338557469 /nfs/dbraw/zinc/55/74/69/338557469.db2.gz YVWQNPRATOPGDS-OCCSQVGLSA-N 1 2 311.351 4.073 20 0 DIADLO COc1cc(C)ccc1C[NH2+][C@H](COCC(C)C)c1ccco1 ZINC000449109398 338594314 /nfs/dbraw/zinc/59/43/14/338594314.db2.gz WIGXPSBZLHLIEY-QGZVFWFLSA-N 1 2 317.429 4.100 20 0 DIADLO Cc1cccn2c(CNc3cn(C)nc3C3CCCCC3)c[nH+]c12 ZINC000449369302 338618267 /nfs/dbraw/zinc/61/82/67/338618267.db2.gz BSKDKQBFHOKKFH-UHFFFAOYSA-N 1 2 323.444 4.036 20 0 DIADLO Cc1cccc2[nH+]cc(CNc3cn(C)nc3C3CCCCC3)n21 ZINC000449369621 338618491 /nfs/dbraw/zinc/61/84/91/338618491.db2.gz FLPWBSGQUGVZFT-UHFFFAOYSA-N 1 2 323.444 4.036 20 0 DIADLO Cc1cc2[nH]c(CN3CC(C)(C)[C@@H]3c3[nH+]ccn3C)cc2c(C)c1 ZINC000449417489 338622671 /nfs/dbraw/zinc/62/26/71/338622671.db2.gz YIPOAHDHENOXFT-SFHVURJKSA-N 1 2 322.456 4.101 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]Cc2ccc(Oc3ccccc3)o2)c2nccn21 ZINC000449574505 338639332 /nfs/dbraw/zinc/63/93/32/338639332.db2.gz UYLIHHPTJPNWGS-XJKSGUPXSA-N 1 2 309.369 4.064 20 0 DIADLO CCSCc1ccc(NC2CC[NH+](CC(F)F)CC2)cc1 ZINC000449596519 338640266 /nfs/dbraw/zinc/64/02/66/338640266.db2.gz BQWBVIUVXHBMEN-UHFFFAOYSA-N 1 2 314.445 4.081 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H]2CC[C@@H](C)[C@@H](C)C2)[nH+]1 ZINC000450209054 338671258 /nfs/dbraw/zinc/67/12/58/338671258.db2.gz SLABSKVEAAGMDV-VNHYZAJKSA-N 1 2 311.429 4.396 20 0 DIADLO COCC1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)CC1 ZINC000450333838 338678219 /nfs/dbraw/zinc/67/82/19/338678219.db2.gz YAUAQBRMHVEPIU-UHFFFAOYSA-N 1 2 324.346 4.116 20 0 DIADLO Cc1ccc(C(=O)N2CCC[C@H]2c2[nH]cc[nH+]2)c(Cl)c1Cl ZINC000450369268 338680207 /nfs/dbraw/zinc/68/02/07/338680207.db2.gz NVHRLAKYAHAAJZ-NSHDSACASA-N 1 2 324.211 4.002 20 0 DIADLO COc1cccc2c1cc[nH+]c2N[C@@H]1CCOC2(CCCC2)C1 ZINC000450386161 338681163 /nfs/dbraw/zinc/68/11/63/338681163.db2.gz DFMZEDZOMCUEKJ-CQSZACIVSA-N 1 2 312.413 4.147 20 0 DIADLO CN(CC1CCOCC1)c1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000450415551 338682642 /nfs/dbraw/zinc/68/26/42/338682642.db2.gz BSGGACLVCPQAFZ-UHFFFAOYSA-N 1 2 324.346 4.116 20 0 DIADLO COc1cccc2c1cc[nH+]c2NC[C@@H](C)c1nc(C)cs1 ZINC000450437627 338684032 /nfs/dbraw/zinc/68/40/32/338684032.db2.gz JALJMGYMJWEPBB-LLVKDONJSA-N 1 2 313.426 4.224 20 0 DIADLO CC[C@@H]1CN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)CCCO1 ZINC000450499488 338688048 /nfs/dbraw/zinc/68/80/48/338688048.db2.gz KDJZGFSROISGQD-CQSZACIVSA-N 1 2 324.346 4.259 20 0 DIADLO Cc1cc(N2[C@H](C)[C@@H](CC(F)(F)F)C[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000450573179 338691587 /nfs/dbraw/zinc/69/15/87/338691587.db2.gz WFQRTWFEJDZGSL-DMDPSCGWSA-N 1 2 313.367 4.218 20 0 DIADLO CC(C)c1nnc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)s1 ZINC000450676926 338698097 /nfs/dbraw/zinc/69/80/97/338698097.db2.gz DPOHGILQRSGIIC-UHFFFAOYSA-N 1 2 323.412 4.109 20 0 DIADLO Cc1cc(N2CC[C@@H](C(F)(F)F)C[C@H]2C)nc(C(C)C)[nH+]1 ZINC000450714924 338700700 /nfs/dbraw/zinc/70/07/00/338700700.db2.gz YNHNPSVJQGARNN-VXGBXAGGSA-N 1 2 301.356 4.076 20 0 DIADLO Fc1ccc2cc[nH+]c(N[C@H]3CCO[C@@H](c4cccnc4)C3)c2c1 ZINC000450795419 338705898 /nfs/dbraw/zinc/70/58/98/338705898.db2.gz OBSZAGACRFZQEM-FUHWJXTLSA-N 1 2 323.371 4.101 20 0 DIADLO CCn1cc([C@@H](C)Nc2cc[nH+]c3c(Cl)cccc23)cn1 ZINC000450879756 338710238 /nfs/dbraw/zinc/71/02/38/338710238.db2.gz VEUGSBICQRMMPR-LLVKDONJSA-N 1 2 300.793 4.278 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)c2ccccc21)c1csnn1 ZINC000451038282 338718893 /nfs/dbraw/zinc/71/88/93/338718893.db2.gz NBRICOIMMFELHJ-GHMZBOCLSA-N 1 2 301.390 4.242 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@H](C)[C@H](C)C1 ZINC000451398321 338732738 /nfs/dbraw/zinc/73/27/38/338732738.db2.gz WDOUWULSKSWRIR-HZMVEIRTSA-N 1 2 317.477 4.029 20 0 DIADLO CC(F)(F)CCCNC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000452199311 338757989 /nfs/dbraw/zinc/75/79/89/338757989.db2.gz GTCVGDNOWBYXED-UHFFFAOYSA-N 1 2 320.339 4.039 20 0 DIADLO CCn1cc[nH+]c1CNC(=O)C1(C2CCCCC2)CCCCC1 ZINC000452569663 338771575 /nfs/dbraw/zinc/77/15/75/338771575.db2.gz GXJKXJBQNKUKJK-UHFFFAOYSA-N 1 2 317.477 4.050 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](CC(F)(F)F)c1ccccc1 ZINC000453059484 338788588 /nfs/dbraw/zinc/78/85/88/338788588.db2.gz KZKLSZPRQVMPOC-TZMCWYRMSA-N 1 2 311.351 4.247 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CNc1ccccc1-n1cccn1 ZINC000453073421 338790560 /nfs/dbraw/zinc/79/05/60/338790560.db2.gz QXJQSXOZKOZRLN-UHFFFAOYSA-N 1 2 306.413 4.311 20 0 DIADLO Cc1nn(C)c2cc(NCc3ccc(C(C)C)[nH+]c3C)ccc12 ZINC000453114438 338795477 /nfs/dbraw/zinc/79/54/77/338795477.db2.gz FNHLFROUKYRHMY-UHFFFAOYSA-N 1 2 308.429 4.321 20 0 DIADLO c1cn2c([nH+]1)[C@H](Nc1cccc(OCCc3ccccc3)c1)CC2 ZINC000453179981 338803519 /nfs/dbraw/zinc/80/35/19/338803519.db2.gz QJJORZBKFFAVNG-LJQANCHMSA-N 1 2 319.408 4.062 20 0 DIADLO Fc1cccc2c1CCC[C@H]2[NH2+][C@@H](c1ncc[nH]1)c1ccccc1 ZINC000453223889 338810272 /nfs/dbraw/zinc/81/02/72/338810272.db2.gz BQXIGJHPIKFJBQ-RTBURBONSA-N 1 2 321.399 4.305 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+][C@H](CC)C(F)F)cc1OCC ZINC000453246114 338813626 /nfs/dbraw/zinc/81/36/26/338813626.db2.gz MEMYVXYLEAACTN-WCQYABFASA-N 1 2 301.377 4.178 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1)C(F)F ZINC000453252763 338814649 /nfs/dbraw/zinc/81/46/49/338814649.db2.gz VQGWIBFODQTOKK-CABZTGNLSA-N 1 2 311.294 4.322 20 0 DIADLO CCCc1ncc(C[NH2+][C@H](C)c2ccccc2Br)o1 ZINC000453352139 338829910 /nfs/dbraw/zinc/82/99/10/338829910.db2.gz CGPAVYXVLHOSJV-LLVKDONJSA-N 1 2 323.234 4.240 20 0 DIADLO COc1ccc([C@H]([NH2+][C@H](C)c2cncc(C)c2)c2ccco2)cc1 ZINC000453391841 338837044 /nfs/dbraw/zinc/83/70/44/338837044.db2.gz DONFBRJFOIMNMQ-QRWLVFNGSA-N 1 2 322.408 4.432 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)Nc1ccccc1C(C)(C)C ZINC000454209258 338857422 /nfs/dbraw/zinc/85/74/22/338857422.db2.gz SDBMLZKNQZDULF-CYBMUJFWSA-N 1 2 314.433 4.083 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)Nc1cc(C)c(Cl)c(C)c1 ZINC000455393865 338892868 /nfs/dbraw/zinc/89/28/68/338892868.db2.gz XXEWBZMPIMTJKJ-GFCCVEGCSA-N 1 2 320.824 4.056 20 0 DIADLO CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455492819 338896556 /nfs/dbraw/zinc/89/65/56/338896556.db2.gz LLPUCMYMPWRZJY-WBMJQRKESA-N 1 2 303.450 4.439 20 0 DIADLO CC[C@@H](NC(=O)Nc1c(C)cc(C)[nH+]c1C)c1cccs1 ZINC000455491664 338896586 /nfs/dbraw/zinc/89/65/86/338896586.db2.gz YUYZXYPMXNLPEI-CYBMUJFWSA-N 1 2 303.431 4.341 20 0 DIADLO CCS[C@@H]1CC[C@@H](N(C)C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000455508414 338897140 /nfs/dbraw/zinc/89/71/40/338897140.db2.gz ZTSRTLATPQRLKW-HUUCEWRRSA-N 1 2 321.490 4.145 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)Cc2ccc(F)c(C)c2)c(C)[nH+]1 ZINC000455510720 338897263 /nfs/dbraw/zinc/89/72/63/338897263.db2.gz HGNFAJZTRBFUOY-UHFFFAOYSA-N 1 2 315.392 4.118 20 0 DIADLO Cc1ccc(C[NH2+]Cc2ncc(-c3ccccc3)cn2)cc1Cl ZINC000195450109 338900304 /nfs/dbraw/zinc/90/03/04/338900304.db2.gz WBFCESLODSSWRZ-UHFFFAOYSA-N 1 2 323.827 4.395 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000456355973 338927471 /nfs/dbraw/zinc/92/74/71/338927471.db2.gz ONBIEKWCNNJIRA-LSDHHAIUSA-N 1 2 321.424 4.037 20 0 DIADLO CCC[C@@H](CC1CCCC1)C(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000456367661 338927762 /nfs/dbraw/zinc/92/77/62/338927762.db2.gz WYOZAPOFIDBSJV-ZBFHGGJFSA-N 1 2 305.466 4.077 20 0 DIADLO CCC(C)(C)c1ccc(C(=O)N[C@@H]2C[C@@H](C)n3cc[nH+]c32)cc1 ZINC000456439144 338930129 /nfs/dbraw/zinc/93/01/29/338930129.db2.gz XYNOGLVHGULRJR-CZUORRHYSA-N 1 2 311.429 4.007 20 0 DIADLO CC[C@@H](C)[C@H](C(=O)NCc1c[nH+]c(C)cc1C)c1ccccc1 ZINC000456826206 338942453 /nfs/dbraw/zinc/94/24/53/338942453.db2.gz AGWCNUNPNDBBRE-KUHUBIRLSA-N 1 2 310.441 4.145 20 0 DIADLO CCCCCN(C(=O)N[C@@H](C)c1[nH+]ccn1CC)[C@@H](C)CCC ZINC000459053755 339012222 /nfs/dbraw/zinc/01/22/22/339012222.db2.gz HKQKGXYJFZTXEH-HOTGVXAUSA-N 1 2 322.497 4.354 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)NC(=O)N(CC(C)(C)C)CC(C)(C)C ZINC000459071402 339012785 /nfs/dbraw/zinc/01/27/85/339012785.db2.gz YTBZKWNMIYKCOJ-AWEZNQCLSA-N 1 2 322.497 4.068 20 0 DIADLO Cc1cc(C)c(CNC(=O)N(CCC(C)C)C2CCCC2)c[nH+]1 ZINC000459112311 339014006 /nfs/dbraw/zinc/01/40/06/339014006.db2.gz GUERTFAOSGNZLK-UHFFFAOYSA-N 1 2 317.477 4.199 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1cnc(C2CC2)nc1 ZINC000459297484 339020021 /nfs/dbraw/zinc/02/00/21/339020021.db2.gz JHXPSCZYKRBYPM-GFCCVEGCSA-N 1 2 301.821 4.200 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1cnc(C2CC2)nc1 ZINC000459297484 339020022 /nfs/dbraw/zinc/02/00/22/339020022.db2.gz JHXPSCZYKRBYPM-GFCCVEGCSA-N 1 2 301.821 4.200 20 0 DIADLO Cc1nc2scc(C3CC3)n2c1C[N@H+](C)Cc1ccoc1C ZINC000459317834 339021383 /nfs/dbraw/zinc/02/13/83/339021383.db2.gz BJHWTYAYPFVELQ-UHFFFAOYSA-N 1 2 315.442 4.115 20 0 DIADLO Cc1nc2scc(C3CC3)n2c1C[N@@H+](C)Cc1ccoc1C ZINC000459317834 339021384 /nfs/dbraw/zinc/02/13/84/339021384.db2.gz BJHWTYAYPFVELQ-UHFFFAOYSA-N 1 2 315.442 4.115 20 0 DIADLO CCCCOc1ccc(C[NH2+]Cc2cc(C)on2)cc1Cl ZINC000459498844 339032802 /nfs/dbraw/zinc/03/28/02/339032802.db2.gz VZONJRIDSBMYQB-UHFFFAOYSA-N 1 2 308.809 4.105 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)o1 ZINC000459567714 339036380 /nfs/dbraw/zinc/03/63/80/339036380.db2.gz AECNHWIYEGIPCR-RHSMWYFYSA-N 1 2 311.429 4.310 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)o1 ZINC000459567714 339036381 /nfs/dbraw/zinc/03/63/81/339036381.db2.gz AECNHWIYEGIPCR-RHSMWYFYSA-N 1 2 311.429 4.310 20 0 DIADLO FCC(CF)[NH2+]C/C=C/c1ccc(OCc2ccccc2)cc1 ZINC000459573108 339036720 /nfs/dbraw/zinc/03/67/20/339036720.db2.gz ROJHDLBHOHYKPQ-QPJJXVBHSA-N 1 2 317.379 4.176 20 0 DIADLO COCc1cc(C[N@@H+]2CCCC[C@H]2c2ccc(Cl)cc2)no1 ZINC000459574674 339036838 /nfs/dbraw/zinc/03/68/38/339036838.db2.gz SIWZBGCNWDZRES-KRWDZBQOSA-N 1 2 320.820 4.202 20 0 DIADLO COCc1cc(C[N@H+]2CCCC[C@H]2c2ccc(Cl)cc2)no1 ZINC000459574674 339036839 /nfs/dbraw/zinc/03/68/39/339036839.db2.gz SIWZBGCNWDZRES-KRWDZBQOSA-N 1 2 320.820 4.202 20 0 DIADLO COCCC1(C)C[NH+](Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000459629560 339039173 /nfs/dbraw/zinc/03/91/73/339039173.db2.gz HLQZSSTVJITQQC-UHFFFAOYSA-N 1 2 321.770 4.217 20 0 DIADLO CC(C)c1cnc(C[NH+]2CC(Cc3ccc(F)c(F)c3)C2)s1 ZINC000459634489 339039552 /nfs/dbraw/zinc/03/95/52/339039552.db2.gz WXIIGYDEPVDISD-UHFFFAOYSA-N 1 2 322.424 4.219 20 0 DIADLO COc1ccc(C[NH+]2CC(C)(CC(F)(F)F)C2)cc1Cl ZINC000459634000 339039625 /nfs/dbraw/zinc/03/96/25/339039625.db2.gz GZHZABIJINHNDD-UHFFFAOYSA-N 1 2 307.743 4.123 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCc2cccc(Cl)c2C1 ZINC000459691905 339043263 /nfs/dbraw/zinc/04/32/63/339043263.db2.gz VDBSOKWGRSWVQH-UHFFFAOYSA-N 1 2 304.821 4.318 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1CCc2cccc(Cl)c2C1 ZINC000459691905 339043264 /nfs/dbraw/zinc/04/32/64/339043264.db2.gz VDBSOKWGRSWVQH-UHFFFAOYSA-N 1 2 304.821 4.318 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)o1 ZINC000459733218 339044958 /nfs/dbraw/zinc/04/49/58/339044958.db2.gz FBADTAQVWUCBRG-YOEHRIQHSA-N 1 2 311.429 4.446 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)o1 ZINC000459733218 339044959 /nfs/dbraw/zinc/04/49/59/339044959.db2.gz FBADTAQVWUCBRG-YOEHRIQHSA-N 1 2 311.429 4.446 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)o1 ZINC000459733211 339045003 /nfs/dbraw/zinc/04/50/03/339045003.db2.gz FBADTAQVWUCBRG-WMLDXEAASA-N 1 2 311.429 4.446 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)o1 ZINC000459733211 339045004 /nfs/dbraw/zinc/04/50/04/339045004.db2.gz FBADTAQVWUCBRG-WMLDXEAASA-N 1 2 311.429 4.446 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)o1 ZINC000459733177 339045037 /nfs/dbraw/zinc/04/50/37/339045037.db2.gz FBADTAQVWUCBRG-PBHICJAKSA-N 1 2 311.429 4.446 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)o1 ZINC000459733177 339045038 /nfs/dbraw/zinc/04/50/38/339045038.db2.gz FBADTAQVWUCBRG-PBHICJAKSA-N 1 2 311.429 4.446 20 0 DIADLO FC(F)c1ccc(C[N@@H+]2CCOC[C@@H]2c2ccccc2)cc1 ZINC000461404513 339063277 /nfs/dbraw/zinc/06/32/77/339063277.db2.gz WCDGJXIRPFUDBL-QGZVFWFLSA-N 1 2 303.352 4.198 20 0 DIADLO FC(F)c1ccc(C[N@H+]2CCOC[C@@H]2c2ccccc2)cc1 ZINC000461404513 339063278 /nfs/dbraw/zinc/06/32/78/339063278.db2.gz WCDGJXIRPFUDBL-QGZVFWFLSA-N 1 2 303.352 4.198 20 0 DIADLO Cc1cccc(C)c1C[NH2+]Cc1ncc(-c2ccccc2)cn1 ZINC000461421614 339063635 /nfs/dbraw/zinc/06/36/35/339063635.db2.gz CWDVNFGZTZNHLR-UHFFFAOYSA-N 1 2 303.409 4.050 20 0 DIADLO COc1ccc([C@@H](Nc2cc[nH+]c(C)n2)c2ccc(C)cc2)cc1 ZINC000462378976 339077471 /nfs/dbraw/zinc/07/74/71/339077471.db2.gz GCEXBMMORFGNCW-FQEVSTJZSA-N 1 2 319.408 4.304 20 0 DIADLO Fc1ccccc1C1C[NH+](Cc2coc(-c3ccccc3)n2)C1 ZINC000462824480 339092366 /nfs/dbraw/zinc/09/23/66/339092366.db2.gz CBWPODDTUPCNPQ-UHFFFAOYSA-N 1 2 308.356 4.080 20 0 DIADLO c1c2ccccc2n2c1C[N@H+](Cc1ccc3ncccc3c1)CC2 ZINC000462830005 339092838 /nfs/dbraw/zinc/09/28/38/339092838.db2.gz RNKWUFQNDAMBAJ-UHFFFAOYSA-N 1 2 313.404 4.205 20 0 DIADLO c1c2ccccc2n2c1C[N@@H+](Cc1ccc3ncccc3c1)CC2 ZINC000462830005 339092839 /nfs/dbraw/zinc/09/28/39/339092839.db2.gz RNKWUFQNDAMBAJ-UHFFFAOYSA-N 1 2 313.404 4.205 20 0 DIADLO CC1(C)[C@@H]2CN(c3cc[nH+]c4c(Br)cccc34)C[C@@H]21 ZINC000462896824 339096598 /nfs/dbraw/zinc/09/65/98/339096598.db2.gz PBKQZMBNLXLZBF-TXEJJXNPSA-N 1 2 317.230 4.090 20 0 DIADLO CC1(C)CCN(c2cc[nH+]c3c(Br)cccc23)C1 ZINC000462942986 339098697 /nfs/dbraw/zinc/09/86/97/339098697.db2.gz LQAAVEURERXQSB-UHFFFAOYSA-N 1 2 305.219 4.234 20 0 DIADLO COC1(C[C@H](C)Nc2ccc(-n3c[nH+]c(C)c3C)cc2)CCC1 ZINC000463027854 339101370 /nfs/dbraw/zinc/10/13/70/339101370.db2.gz JHSVXWJJWZPWFD-AWEZNQCLSA-N 1 2 313.445 4.249 20 0 DIADLO CCCC[C@@H](CC)C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000463033915 339101918 /nfs/dbraw/zinc/10/19/18/339101918.db2.gz CUJZQWGZUKHOSH-JKSUJKDBSA-N 1 2 322.518 4.170 20 0 DIADLO CC(C)CC(C)(C)C(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000463033103 339102001 /nfs/dbraw/zinc/10/20/01/339102001.db2.gz IUBSKWXARIYALJ-OAHLLOKOSA-N 1 2 322.518 4.026 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@@H](C)C3CCSCC3)cc2)c1C ZINC000463041237 339102739 /nfs/dbraw/zinc/10/27/39/339102739.db2.gz GSPQNSUSZHPBIY-AWEZNQCLSA-N 1 2 315.486 4.433 20 0 DIADLO CCC[C@H](C(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1)C(C)C ZINC000463044818 339102791 /nfs/dbraw/zinc/10/27/91/339102791.db2.gz SYAGIOSOMIWSBK-WBVHZDCISA-N 1 2 322.518 4.026 20 0 DIADLO CCC[C@H](C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1)C(C)C ZINC000463044817 339102825 /nfs/dbraw/zinc/10/28/25/339102825.db2.gz SYAGIOSOMIWSBK-RDJZCZTQSA-N 1 2 322.518 4.026 20 0 DIADLO COCC[C@H](c1ccccc1)[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000463359779 339115690 /nfs/dbraw/zinc/11/56/90/339115690.db2.gz VUXACVHLHMMHJB-HXUWFJFHSA-N 1 2 320.436 4.235 20 0 DIADLO COCC[C@H](c1ccccc1)[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000463359779 339115691 /nfs/dbraw/zinc/11/56/91/339115691.db2.gz VUXACVHLHMMHJB-HXUWFJFHSA-N 1 2 320.436 4.235 20 0 DIADLO COc1cccc([C@H](C)[N@@H+]2CCn3c(cc4ccccc43)C2)c1 ZINC000463416620 339117132 /nfs/dbraw/zinc/11/71/32/339117132.db2.gz MHXUXYRBXZTZSB-HNNXBMFYSA-N 1 2 306.409 4.227 20 0 DIADLO COc1cccc([C@H](C)[N@H+]2CCn3c(cc4ccccc43)C2)c1 ZINC000463416620 339117133 /nfs/dbraw/zinc/11/71/33/339117133.db2.gz MHXUXYRBXZTZSB-HNNXBMFYSA-N 1 2 306.409 4.227 20 0 DIADLO Cc1cc(N2CCc3cc(Cl)c(Cl)cc3[C@H]2C)nc[nH+]1 ZINC000463474559 339119163 /nfs/dbraw/zinc/11/91/63/339119163.db2.gz AIAJIPNNUWHTDI-SNVBAGLBSA-N 1 2 308.212 4.216 20 0 DIADLO CC(C)[C@H](C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccccc1 ZINC000463489618 339119465 /nfs/dbraw/zinc/11/94/65/339119465.db2.gz JPMBRWJLDXUKCL-SFHVURJKSA-N 1 2 319.408 4.455 20 0 DIADLO c1cn(CCCN2CCc3c2cccc3-c2ccccc2)c[nH+]1 ZINC000464573231 339145684 /nfs/dbraw/zinc/14/56/84/339145684.db2.gz UMLDRDWFIOLOGJ-UHFFFAOYSA-N 1 2 303.409 4.003 20 0 DIADLO CC[C@H]1C[N@H+](Cc2csc(Cc3ccccc3)n2)CCS1 ZINC000464788646 339153965 /nfs/dbraw/zinc/15/39/65/339153965.db2.gz LFLFKOHTXNRNSI-INIZCTEOSA-N 1 2 318.511 4.061 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2csc(Cc3ccccc3)n2)CCS1 ZINC000464788646 339153966 /nfs/dbraw/zinc/15/39/66/339153966.db2.gz LFLFKOHTXNRNSI-INIZCTEOSA-N 1 2 318.511 4.061 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Cl)cc2)[C@@H](c2ccccc2)CO1 ZINC000464842911 339156862 /nfs/dbraw/zinc/15/68/62/339156862.db2.gz NIMBFIPCWCUJGE-KBXCAEBGSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Cl)cc2)[C@@H](c2ccccc2)CO1 ZINC000464842911 339156863 /nfs/dbraw/zinc/15/68/63/339156863.db2.gz NIMBFIPCWCUJGE-KBXCAEBGSA-N 1 2 301.817 4.302 20 0 DIADLO C[N@H+](CCOCc1ccccc1)Cc1nc(C(C)(C)C)cs1 ZINC000464848419 339157488 /nfs/dbraw/zinc/15/74/88/339157488.db2.gz IINZKKLEWYFJGR-UHFFFAOYSA-N 1 2 318.486 4.089 20 0 DIADLO C[N@@H+](CCOCc1ccccc1)Cc1nc(C(C)(C)C)cs1 ZINC000464848419 339157489 /nfs/dbraw/zinc/15/74/89/339157489.db2.gz IINZKKLEWYFJGR-UHFFFAOYSA-N 1 2 318.486 4.089 20 0 DIADLO C[C@H]1CC[N@H+](Cc2noc(-c3ccccc3)n2)[C@H](c2ccco2)C1 ZINC000464850422 339157758 /nfs/dbraw/zinc/15/77/58/339157758.db2.gz KCSPZICDXZUJTQ-HOCLYGCPSA-N 1 2 323.396 4.303 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2noc(-c3ccccc3)n2)[C@H](c2ccco2)C1 ZINC000464850422 339157759 /nfs/dbraw/zinc/15/77/59/339157759.db2.gz KCSPZICDXZUJTQ-HOCLYGCPSA-N 1 2 323.396 4.303 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccccc2Cl)[C@@H](c2ccccc2)CO1 ZINC000464854367 339158091 /nfs/dbraw/zinc/15/80/91/339158091.db2.gz SOTNNDBWLAVJHH-KBXCAEBGSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccccc2Cl)[C@@H](c2ccccc2)CO1 ZINC000464854367 339158092 /nfs/dbraw/zinc/15/80/92/339158092.db2.gz SOTNNDBWLAVJHH-KBXCAEBGSA-N 1 2 301.817 4.302 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cc1nc2cc(F)ccc2o1 ZINC000464867691 339159226 /nfs/dbraw/zinc/15/92/26/339159226.db2.gz IZTWMRVIGKFDCK-UHFFFAOYSA-N 1 2 310.781 4.314 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1nc2cc(F)ccc2o1 ZINC000464867691 339159227 /nfs/dbraw/zinc/15/92/27/339159227.db2.gz IZTWMRVIGKFDCK-UHFFFAOYSA-N 1 2 310.781 4.314 20 0 DIADLO C[N@H+](Cc1nc2cc(F)ccc2o1)Cc1ccc(F)cc1Cl ZINC000464869814 339159489 /nfs/dbraw/zinc/15/94/89/339159489.db2.gz AVAVQQMLQJLOQO-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO C[N@@H+](Cc1nc2cc(F)ccc2o1)Cc1ccc(F)cc1Cl ZINC000464869814 339159490 /nfs/dbraw/zinc/15/94/90/339159490.db2.gz AVAVQQMLQJLOQO-UHFFFAOYSA-N 1 2 322.742 4.391 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@H](CO)c2cccc(Cl)c2F)o1 ZINC000466381857 339201657 /nfs/dbraw/zinc/20/16/57/339201657.db2.gz DKSUATBIWZDJBP-WDBKCZKBSA-N 1 2 323.795 4.019 20 0 DIADLO COCC[C@@H]1CCCCN(c2cc(C(C)C)[nH+]c(C(C)C)n2)C1 ZINC000466625029 339210814 /nfs/dbraw/zinc/21/08/14/339210814.db2.gz DCPCECIULZMOOJ-INIZCTEOSA-N 1 2 319.493 4.366 20 0 DIADLO CCc1nn(C)c(CC)c1CNc1ccc(-c2ccccc2)c[nH+]1 ZINC000466628896 339211039 /nfs/dbraw/zinc/21/10/39/339211039.db2.gz WFNDSPZQOQACOF-UHFFFAOYSA-N 1 2 320.440 4.219 20 0 DIADLO c1csc(CNc2cccc(-c3ccc4c(c3)CCO4)[nH+]2)c1 ZINC000466636774 339211321 /nfs/dbraw/zinc/21/13/21/339211321.db2.gz VQTFHEMVBFAGCL-UHFFFAOYSA-N 1 2 308.406 4.357 20 0 DIADLO c1ccc(-c2ccc[nH+]c2NCc2ccc3c(c2)OCCO3)cc1 ZINC000466636776 339211414 /nfs/dbraw/zinc/21/14/14/339211414.db2.gz DYUCYBCYHZWRBQ-UHFFFAOYSA-N 1 2 318.376 4.132 20 0 DIADLO COc1cccc(CNc2[nH+]cccc2-c2ccccc2)c1OC ZINC000466637652 339211476 /nfs/dbraw/zinc/21/14/76/339211476.db2.gz NXRYFPBZYOBSCH-UHFFFAOYSA-N 1 2 320.392 4.378 20 0 DIADLO C[N@@H+](Cc1ccn(-c2ccc(Cl)cc2)n1)Cc1cccs1 ZINC000466829050 339218323 /nfs/dbraw/zinc/21/83/23/339218323.db2.gz OENAAVMFGYHWRQ-UHFFFAOYSA-N 1 2 317.845 4.219 20 0 DIADLO C[N@H+](Cc1ccn(-c2ccc(Cl)cc2)n1)Cc1cccs1 ZINC000466829050 339218324 /nfs/dbraw/zinc/21/83/24/339218324.db2.gz OENAAVMFGYHWRQ-UHFFFAOYSA-N 1 2 317.845 4.219 20 0 DIADLO Cc1ccc2c(CCC(=O)Nc3c(C)cc(C)[nH+]c3C)c[nH]c2c1 ZINC000466998134 339224000 /nfs/dbraw/zinc/22/40/00/339224000.db2.gz KIYBKKPYGBXKPN-UHFFFAOYSA-N 1 2 321.424 4.368 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)CCOc2ccccc2)c(C)[nH+]1 ZINC000466997683 339224036 /nfs/dbraw/zinc/22/40/36/339224036.db2.gz GLRMPIPWNRRGQV-ZDUSSCGKSA-N 1 2 312.413 4.051 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+]1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000467180125 339227443 /nfs/dbraw/zinc/22/74/43/339227443.db2.gz JEJWSOBACMJQCB-RDTXWAMCSA-N 1 2 301.817 4.475 20 0 DIADLO C[C@H](c1ccccc1)[N@H+]1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000467180125 339227444 /nfs/dbraw/zinc/22/74/44/339227444.db2.gz JEJWSOBACMJQCB-RDTXWAMCSA-N 1 2 301.817 4.475 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@H](Nc2cccc(CCCO)c2)C1 ZINC000467350878 339233217 /nfs/dbraw/zinc/23/32/17/339233217.db2.gz VSABGADATCILAO-ICSRJNTNSA-N 1 2 324.468 4.453 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@H](Nc2cccc3c2CCO3)C1 ZINC000467374894 339235112 /nfs/dbraw/zinc/23/51/12/339235112.db2.gz BYKDTZRILXICEH-HOTGVXAUSA-N 1 2 308.425 4.463 20 0 DIADLO CC[C@H]1CCCC[C@H]1N(C)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000467469953 339240044 /nfs/dbraw/zinc/24/00/44/339240044.db2.gz ZYDKJYWWTWVKEZ-GOEBONIOSA-N 1 2 314.433 4.075 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2cc(Cl)cc(Cl)c2OC)CCCO1 ZINC000467560827 339242676 /nfs/dbraw/zinc/24/26/76/339242676.db2.gz VWVCDHRDBJFFCP-CYBMUJFWSA-N 1 2 318.244 4.003 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2OC)CCCO1 ZINC000467560827 339242677 /nfs/dbraw/zinc/24/26/77/339242677.db2.gz VWVCDHRDBJFFCP-CYBMUJFWSA-N 1 2 318.244 4.003 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2ccc(F)cc21)c1ccc(F)cc1Cl ZINC000468030023 339251754 /nfs/dbraw/zinc/25/17/54/339251754.db2.gz IJCNXCNFGNBYDL-BJOHPYRUSA-N 1 2 309.743 4.403 20 0 DIADLO CCC1(CC)C[N@@H+]([C@@H](C)c2cccc(Cl)c2)CC[S@@]1=O ZINC000469443241 339289381 /nfs/dbraw/zinc/28/93/81/339289381.db2.gz UHIIMNJRBVHWEP-RBZFPXEDSA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@H+]([C@@H](C)c2cccc(Cl)c2)CC[S@@]1=O ZINC000469443241 339289382 /nfs/dbraw/zinc/28/93/82/339289382.db2.gz UHIIMNJRBVHWEP-RBZFPXEDSA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@@H+]([C@H](C)c2cccc(Cl)c2)CC[S@@]1=O ZINC000469443243 339289404 /nfs/dbraw/zinc/28/94/04/339289404.db2.gz UHIIMNJRBVHWEP-XCLFUZPHSA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@H+]([C@H](C)c2cccc(Cl)c2)CC[S@@]1=O ZINC000469443243 339289405 /nfs/dbraw/zinc/28/94/05/339289405.db2.gz UHIIMNJRBVHWEP-XCLFUZPHSA-N 1 2 313.894 4.024 20 0 DIADLO Fc1cccc(Cl)c1CNc1[nH+]cccc1OC(F)F ZINC000469471088 339290698 /nfs/dbraw/zinc/29/06/98/339290698.db2.gz TWUQRASJEVWALI-UHFFFAOYSA-N 1 2 302.683 4.088 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@H+](C)Cc1ccc(F)cn1 ZINC000469599263 339294056 /nfs/dbraw/zinc/29/40/56/339294056.db2.gz RPLFXSGATNSKMQ-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@@H+](C)Cc1ccc(F)cn1 ZINC000469599263 339294057 /nfs/dbraw/zinc/29/40/57/339294057.db2.gz RPLFXSGATNSKMQ-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO Cc1[nH+]c[nH]c1CC(=O)Nc1cc(C)ccc1Oc1ccccc1 ZINC000469715473 339296081 /nfs/dbraw/zinc/29/60/81/339296081.db2.gz BQSNZMFWCJVHKD-UHFFFAOYSA-N 1 2 321.380 4.000 20 0 DIADLO CCc1cccc(C[NH2+][C@@H](C)c2noc(Cc3ccccc3)n2)c1 ZINC000469762185 339298040 /nfs/dbraw/zinc/29/80/40/339298040.db2.gz DXRJNWRXAPHLNK-HNNXBMFYSA-N 1 2 321.424 4.074 20 0 DIADLO CCc1cccc(C[NH2+][C@H](C)c2noc(Cc3ccccc3)n2)c1 ZINC000469762186 339298046 /nfs/dbraw/zinc/29/80/46/339298046.db2.gz DXRJNWRXAPHLNK-OAHLLOKOSA-N 1 2 321.424 4.074 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470213307 339314516 /nfs/dbraw/zinc/31/45/16/339314516.db2.gz GLOSVKMHDGJQKE-XNJGSVPQSA-N 1 2 305.418 4.410 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470213307 339314517 /nfs/dbraw/zinc/31/45/17/339314517.db2.gz GLOSVKMHDGJQKE-XNJGSVPQSA-N 1 2 305.418 4.410 20 0 DIADLO CC[C@H]([NH2+]C1CCC(c2ccc(O)cc2)CC1)C(F)(F)F ZINC000470253498 339315369 /nfs/dbraw/zinc/31/53/69/339315369.db2.gz CIOCACHDSMYDDY-HGMXIMQMSA-N 1 2 301.352 4.349 20 0 DIADLO COc1ccc(C[C@H](C)C[NH2+][C@@H](C(C)C)C(F)(F)F)cc1F ZINC000470257229 339315421 /nfs/dbraw/zinc/31/54/21/339315421.db2.gz YJHNZYSSQOUAGO-NHYWBVRUSA-N 1 2 321.358 4.189 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCC[N@@H+]2Cc2cc[nH]n2)c1 ZINC000470548303 339321993 /nfs/dbraw/zinc/32/19/93/339321993.db2.gz RTSBNHBEWKKGBZ-HNNXBMFYSA-N 1 2 309.335 4.156 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCC[N@H+]2Cc2cc[nH]n2)c1 ZINC000470548303 339321994 /nfs/dbraw/zinc/32/19/94/339321994.db2.gz RTSBNHBEWKKGBZ-HNNXBMFYSA-N 1 2 309.335 4.156 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ncc(Cl)cc1Cl ZINC000470940846 339331726 /nfs/dbraw/zinc/33/17/26/339331726.db2.gz QNSJJSNBPCMJJJ-APPZFPTMSA-N 1 2 313.150 4.161 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)cs1 ZINC000470946896 339332051 /nfs/dbraw/zinc/33/20/51/339332051.db2.gz GZAXCCUHWFLGLT-CMPLNLGQSA-N 1 2 306.397 4.258 20 0 DIADLO CC[C@@H]1CN(c2cc[nH+]c(C3CC3)n2)CC[C@@H]1c1ccccc1 ZINC000470869347 339329601 /nfs/dbraw/zinc/32/96/01/339329601.db2.gz BDQUJYVEFWYYND-QAPCUYQASA-N 1 2 307.441 4.374 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ncc(Cl)cc1Cl ZINC000470940846 339331725 /nfs/dbraw/zinc/33/17/25/339331725.db2.gz QNSJJSNBPCMJJJ-APPZFPTMSA-N 1 2 313.150 4.161 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ncc(Cl)cc1Cl ZINC000470940848 339331752 /nfs/dbraw/zinc/33/17/52/339331752.db2.gz QNSJJSNBPCMJJJ-IONNQARKSA-N 1 2 313.150 4.161 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ncc(Cl)cc1Cl ZINC000470940848 339331753 /nfs/dbraw/zinc/33/17/53/339331753.db2.gz QNSJJSNBPCMJJJ-IONNQARKSA-N 1 2 313.150 4.161 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)cs1 ZINC000470946896 339332050 /nfs/dbraw/zinc/33/20/50/339332050.db2.gz GZAXCCUHWFLGLT-CMPLNLGQSA-N 1 2 306.397 4.258 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)Oc2ccc3ccccc3c2)c(C)[nH+]1 ZINC000471041522 339335342 /nfs/dbraw/zinc/33/53/42/339335342.db2.gz OINDMSBPUJTSKZ-HNNXBMFYSA-N 1 2 320.392 4.258 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+]2CC[C@H]2c2ccccc2)c(Cl)c1 ZINC000471182902 339339613 /nfs/dbraw/zinc/33/96/13/339339613.db2.gz UXXQBZGFSPBLMC-KRWDZBQOSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+]2CC[C@H]2c2ccccc2)c(Cl)c1 ZINC000471182902 339339614 /nfs/dbraw/zinc/33/96/14/339339614.db2.gz UXXQBZGFSPBLMC-KRWDZBQOSA-N 1 2 314.816 4.034 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NCCOc2ccc(Cl)cc2)c1 ZINC000471252708 339341137 /nfs/dbraw/zinc/34/11/37/339341137.db2.gz ARTLYNNWIMDNEF-UHFFFAOYSA-N 1 2 316.710 4.245 20 0 DIADLO CN(Cc1ccc(Cl)s1)c1cc(C(F)(F)F)cc[nH+]1 ZINC000471257827 339341279 /nfs/dbraw/zinc/34/12/79/339341279.db2.gz ONVJKTCOVNUGGT-UHFFFAOYSA-N 1 2 306.740 4.452 20 0 DIADLO CCN(CC)c1ccc(N[C@H](C)c2sccc2OC)c[nH+]1 ZINC000471614241 339349587 /nfs/dbraw/zinc/34/95/87/339349587.db2.gz TVKVGFBBSPXJQW-GFCCVEGCSA-N 1 2 305.447 4.171 20 0 DIADLO CCN(Cc1c[nH+]c2cccc(C)n12)c1ccc2[nH]ccc2c1 ZINC000471810030 339354904 /nfs/dbraw/zinc/35/49/04/339354904.db2.gz MJPVOBCRXDWQAL-UHFFFAOYSA-N 1 2 304.397 4.151 20 0 DIADLO CC(C)(C(=O)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1)C(F)F ZINC000471953164 339358186 /nfs/dbraw/zinc/35/81/86/339358186.db2.gz KNVIQUDPLIVVOE-UHFFFAOYSA-N 1 2 307.344 4.060 20 0 DIADLO OCc1cccc(NCc2ccc(-c3ccccc3F)s2)[nH+]1 ZINC000472577796 339374171 /nfs/dbraw/zinc/37/41/71/339374171.db2.gz CODJFUBIEDZRHF-UHFFFAOYSA-N 1 2 314.385 4.054 20 0 DIADLO C[C@@H](c1cn(-c2ccccc2)nn1)[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000472590462 339374571 /nfs/dbraw/zinc/37/45/71/339374571.db2.gz GASCWHGORWHJOM-GQIGUUNPSA-N 1 2 318.424 4.021 20 0 DIADLO C[C@@H](c1cn(-c2ccccc2)nn1)[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000472590462 339374572 /nfs/dbraw/zinc/37/45/72/339374572.db2.gz GASCWHGORWHJOM-GQIGUUNPSA-N 1 2 318.424 4.021 20 0 DIADLO Clc1cnc(C[N@@H+]2CCSC3(CCCCC3)C2)s1 ZINC000473146068 339382781 /nfs/dbraw/zinc/38/27/81/339382781.db2.gz SDTZYJCZDWJWRQ-UHFFFAOYSA-N 1 2 302.896 4.048 20 0 DIADLO Clc1cnc(C[N@H+]2CCSC3(CCCCC3)C2)s1 ZINC000473146068 339382782 /nfs/dbraw/zinc/38/27/82/339382782.db2.gz SDTZYJCZDWJWRQ-UHFFFAOYSA-N 1 2 302.896 4.048 20 0 DIADLO CCOc1ccccc1C[N@H+](C)Cc1nn(CC)c2ccccc12 ZINC000473145692 339382977 /nfs/dbraw/zinc/38/29/77/339382977.db2.gz KEGBOEQBCBGYSZ-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO CCOc1ccccc1C[N@@H+](C)Cc1nn(CC)c2ccccc12 ZINC000473145692 339382978 /nfs/dbraw/zinc/38/29/78/339382978.db2.gz KEGBOEQBCBGYSZ-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO C[C@H]1C[N@H+](Cc2ncc(Cl)s2)CC[C@@H]1c1ccccc1 ZINC000473149107 339383187 /nfs/dbraw/zinc/38/31/87/339383187.db2.gz SLYLPVAPPJMQDI-JSGCOSHPSA-N 1 2 306.862 4.422 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ncc(Cl)s2)CC[C@@H]1c1ccccc1 ZINC000473149107 339383188 /nfs/dbraw/zinc/38/31/88/339383188.db2.gz SLYLPVAPPJMQDI-JSGCOSHPSA-N 1 2 306.862 4.422 20 0 DIADLO CC(C)[C@H](NC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1)c1[nH]cc[nH+]1 ZINC000473295978 339384282 /nfs/dbraw/zinc/38/42/82/339384282.db2.gz MKQPDCIBNNOULM-YCPHGPKFSA-N 1 2 305.466 4.076 20 0 DIADLO CCc1[nH+]c(C)ccc1OCc1coc(-c2cccs2)n1 ZINC000473660718 339389788 /nfs/dbraw/zinc/38/97/88/339389788.db2.gz DUIMZZHEXBAHDZ-UHFFFAOYSA-N 1 2 300.383 4.248 20 0 DIADLO C[C@H](Nc1cc[nH+]c2ccncc12)c1cc2cccc(F)c2o1 ZINC000473911479 339394790 /nfs/dbraw/zinc/39/47/90/339394790.db2.gz OQINVZQPNMQNIH-NSHDSACASA-N 1 2 307.328 4.110 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1nnc(C(C)(C)C)s1 ZINC000474356401 339410711 /nfs/dbraw/zinc/41/07/11/339410711.db2.gz ZWSRNWFJHCMLPL-UHFFFAOYSA-N 1 2 323.893 4.341 20 0 DIADLO Cc1ccc(CCCNc2ccc(F)cc2OC(F)F)c[nH+]1 ZINC000474470821 339416037 /nfs/dbraw/zinc/41/60/37/339416037.db2.gz MJGQGLLNGSBGKA-UHFFFAOYSA-N 1 2 310.319 4.175 20 0 DIADLO COc1ccsc1C[NH2+][C@@H](c1ccc(C)cc1)c1ccccn1 ZINC000475338814 339447702 /nfs/dbraw/zinc/44/77/02/339447702.db2.gz STUYGCHTGFCJOT-IBGZPJMESA-N 1 2 324.449 4.339 20 0 DIADLO CC(C)[C@@H]1C[C@H]1C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000475617083 339457338 /nfs/dbraw/zinc/45/73/38/339457338.db2.gz JHAGIRPMUHOQGG-DLBZAZTESA-N 1 2 323.440 4.117 20 0 DIADLO COc1cc(NCc2[nH+]ccn2Cc2ccccc2)c(C)cc1C ZINC000475666477 339458614 /nfs/dbraw/zinc/45/86/14/339458614.db2.gz CPXNGQDCKJMSNF-UHFFFAOYSA-N 1 2 321.424 4.169 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1cc2cccc(F)c2o1 ZINC000475713276 339460140 /nfs/dbraw/zinc/46/01/40/339460140.db2.gz BTNRXJKBJVMVPK-JTQLQIEISA-N 1 2 317.364 4.103 20 0 DIADLO Cc1cc(F)cc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1 ZINC000477994759 339506844 /nfs/dbraw/zinc/50/68/44/339506844.db2.gz WOTWKZNNTINNKO-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)CC2CCC2)c1 ZINC000478620074 339519509 /nfs/dbraw/zinc/51/95/09/339519509.db2.gz HZRIQSKSRFKEQG-UHFFFAOYSA-N 1 2 311.429 4.479 20 0 DIADLO Cc1cccc(-c2nnc(SCc3ccc(C)[nH+]c3C)n2C)c1 ZINC000478860107 339523750 /nfs/dbraw/zinc/52/37/50/339523750.db2.gz SSNQYLNCDSQSHO-UHFFFAOYSA-N 1 2 324.453 4.095 20 0 DIADLO N#CN(Cc1[nH+]ccn1Cc1ccccc1)c1cccc(Cl)c1 ZINC000478880501 339523920 /nfs/dbraw/zinc/52/39/20/339523920.db2.gz PRDXVIXEQAXRAB-UHFFFAOYSA-N 1 2 322.799 4.072 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2ncc(Cl)s2)c1C ZINC000478918706 339524747 /nfs/dbraw/zinc/52/47/47/339524747.db2.gz FCRNFPVKVJTDDQ-UHFFFAOYSA-N 1 2 314.863 4.250 20 0 DIADLO CC(C)Cn1ccnc1C[NH2+][C@H](c1cc(F)ccc1F)C(C)C ZINC000479072207 339526984 /nfs/dbraw/zinc/52/69/84/339526984.db2.gz BBMAFDAKLUCVEC-SFHVURJKSA-N 1 2 321.415 4.304 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@@H](C)c2ccc(F)cn2)c2ccccn2)cc1 ZINC000479463783 339536433 /nfs/dbraw/zinc/53/64/33/339536433.db2.gz GJCMOHJLLOGFHQ-MGPUTAFESA-N 1 2 321.399 4.364 20 0 DIADLO C[C@H]([NH2+][C@H](CO)c1c(Cl)cccc1Cl)c1ccsc1 ZINC000479560989 339541232 /nfs/dbraw/zinc/54/12/32/339541232.db2.gz SNFLOIGILDJZFN-TVQRCGJNSA-N 1 2 316.253 4.439 20 0 DIADLO Cc1cc(N2CCC[C@@H](C(C)(C)C)C2)nc(-c2ccncc2)[nH+]1 ZINC000481068340 339594827 /nfs/dbraw/zinc/59/48/27/339594827.db2.gz FXNWTJFAIQPORS-MRXNPFEDSA-N 1 2 310.445 4.110 20 0 DIADLO Cc1cccc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)c1 ZINC000482762428 339641943 /nfs/dbraw/zinc/64/19/43/339641943.db2.gz ODZMMCYIVYSCBR-UHFFFAOYSA-N 1 2 304.349 4.435 20 0 DIADLO CCC(CC)[C@H](NC(=O)c1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000482810965 339643042 /nfs/dbraw/zinc/64/30/42/339643042.db2.gz HELDCICLMWMRDV-IBGZPJMESA-N 1 2 321.424 4.242 20 0 DIADLO Cc1nc2ccccc2nc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000483623007 339669860 /nfs/dbraw/zinc/66/98/60/339669860.db2.gz OTGFNOHSVHZNNQ-UHFFFAOYSA-N 1 2 319.412 4.067 20 0 DIADLO CCCCN(C)c1ccc(C(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000485486528 339704367 /nfs/dbraw/zinc/70/43/67/339704367.db2.gz DGHNRGUXUPMRFL-UHFFFAOYSA-N 1 2 311.429 4.187 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCC1(c2ccccc2)CCCC1 ZINC000485530086 339705056 /nfs/dbraw/zinc/70/50/56/339705056.db2.gz TZCIYPXPHHUIPY-UHFFFAOYSA-N 1 2 323.440 4.332 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)C2CC(F)(F)C2)c1C(C)C ZINC000485674044 339708949 /nfs/dbraw/zinc/70/89/49/339708949.db2.gz YKRLCBAYEBDRQJ-UHFFFAOYSA-N 1 2 318.367 4.072 20 0 DIADLO Fc1cc(Cl)cc(CNc2ccc(-n3cc[nH+]c3)c(F)c2)c1 ZINC000485694705 339709609 /nfs/dbraw/zinc/70/96/09/339709609.db2.gz QDAQZLYAGIYANF-UHFFFAOYSA-N 1 2 319.742 4.416 20 0 DIADLO CC(C)O[C@@H](Cn1c[nH+]c2cc(F)c(F)cc21)c1ccccc1 ZINC000488246178 339774370 /nfs/dbraw/zinc/77/43/70/339774370.db2.gz SQYCLAPXGLEREI-SFHVURJKSA-N 1 2 316.351 4.481 20 0 DIADLO CC(C)(C)[C@H]1C[C@@H](Nc2ccc(-n3cc[nH+]c3)c(F)c2)CS1 ZINC000488314718 339776755 /nfs/dbraw/zinc/77/67/55/339776755.db2.gz CCDFMABAJPLLHH-CZUORRHYSA-N 1 2 319.449 4.344 20 0 DIADLO CSC[C@H]1CCCN(c2cc(C)[nH+]c3c(F)cccc23)C1 ZINC000488965249 339798491 /nfs/dbraw/zinc/79/84/91/339798491.db2.gz CMOTYCOCGOEBIL-ZDUSSCGKSA-N 1 2 304.434 4.262 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+][C@@H](C1CC1)C(F)(F)F)CC3 ZINC000489883394 339820511 /nfs/dbraw/zinc/82/05/11/339820511.db2.gz LFOOMJHEWFBXCN-PXAZEXFGSA-N 1 2 322.374 4.264 20 0 DIADLO COc1cc(C)[nH+]c(CNc2cc(Cl)c(Cl)cc2F)c1 ZINC000490542851 339833871 /nfs/dbraw/zinc/83/38/71/339833871.db2.gz KCTUALKUBRMEHA-UHFFFAOYSA-N 1 2 315.175 4.457 20 0 DIADLO CCCOc1cccc2c(NCc3cccc(CO)c3)cc[nH+]c12 ZINC000492227552 339894689 /nfs/dbraw/zinc/89/46/89/339894689.db2.gz ZQDAIVAFOAWKGV-UHFFFAOYSA-N 1 2 322.408 4.128 20 0 DIADLO CCn1cc[nH+]c1/C=C\C(=O)Nc1ccccc1-c1ccccc1 ZINC000492314094 339897456 /nfs/dbraw/zinc/89/74/56/339897456.db2.gz TXEWURXCORFJPD-SEYXRHQNSA-N 1 2 317.392 4.222 20 0 DIADLO C[C@H]1CC[C@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000493619877 339929695 /nfs/dbraw/zinc/92/96/95/339929695.db2.gz HQHWKJDYMMITTP-KOMQPUFPSA-N 1 2 310.397 4.182 20 0 DIADLO CCN(c1cc(C)[nH+]cn1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000498950482 340026978 /nfs/dbraw/zinc/02/69/78/340026978.db2.gz RPRPWJNAPRLYAY-GFCCVEGCSA-N 1 2 309.335 4.391 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+]1CCOC2(CCC2)C1 ZINC000499244767 340033130 /nfs/dbraw/zinc/03/31/30/340033130.db2.gz RZOPIAOYIVRBRQ-NSHDSACASA-N 1 2 300.229 4.309 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+]1CCOC2(CCC2)C1 ZINC000499244767 340033131 /nfs/dbraw/zinc/03/31/31/340033131.db2.gz RZOPIAOYIVRBRQ-NSHDSACASA-N 1 2 300.229 4.309 20 0 DIADLO CC(C)n1nccc1C[N@@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC000499553772 340039362 /nfs/dbraw/zinc/03/93/62/340039362.db2.gz RZIMIWIPRWIPAL-UHFFFAOYSA-N 1 2 321.424 4.282 20 0 DIADLO CC(C)n1nccc1C[N@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC000499553772 340039363 /nfs/dbraw/zinc/03/93/63/340039363.db2.gz RZIMIWIPRWIPAL-UHFFFAOYSA-N 1 2 321.424 4.282 20 0 DIADLO C[C@H](c1ccsc1)[NH+]1CCN(C(=O)C(C)(C)C(C)(C)C)CC1 ZINC000500200616 340052839 /nfs/dbraw/zinc/05/28/39/340052839.db2.gz DUKBOLJHZXCNKT-CQSZACIVSA-N 1 2 322.518 4.026 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@@H+]1Cc1ccccc1C(F)(F)F ZINC000500415091 340057417 /nfs/dbraw/zinc/05/74/17/340057417.db2.gz JISJWRRDWWESOM-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@H+]1Cc1ccccc1C(F)(F)F ZINC000500415091 340057418 /nfs/dbraw/zinc/05/74/18/340057418.db2.gz JISJWRRDWWESOM-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO CC(C)OC[C@H](C)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000500424661 340058069 /nfs/dbraw/zinc/05/80/69/340058069.db2.gz LWCTVIPIDGVDOB-HNNXBMFYSA-N 1 2 313.445 4.112 20 0 DIADLO C[C@@H]1C[C@]1([NH2+]Cc1ncc(Cl)s1)c1ccc(Cl)cc1 ZINC000500449912 340059060 /nfs/dbraw/zinc/05/90/60/340059060.db2.gz FAMVBWADYHCQLJ-YMTOWFKASA-N 1 2 313.253 4.475 20 0 DIADLO Cc1ccc(-c2ccc(C(=O)Nc3cc[nH+]cc3C)c(F)c2)cc1 ZINC000501244618 340077014 /nfs/dbraw/zinc/07/70/14/340077014.db2.gz KDPJJUOSMSLWOC-UHFFFAOYSA-N 1 2 320.367 4.179 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+]1CCc2c(cnn2-c2ccccc2)C1 ZINC000501999304 340092439 /nfs/dbraw/zinc/09/24/39/340092439.db2.gz ILHRFEIXRAHZMQ-HNNXBMFYSA-N 1 2 321.399 4.131 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+]1CCc2c(cnn2-c2ccccc2)C1 ZINC000501999304 340092440 /nfs/dbraw/zinc/09/24/40/340092440.db2.gz ILHRFEIXRAHZMQ-HNNXBMFYSA-N 1 2 321.399 4.131 20 0 DIADLO c1cncc([C@H]2CCC[C@H](Nc3ccc(N4CCCC4)[nH+]c3)C2)c1 ZINC000502402247 340101948 /nfs/dbraw/zinc/10/19/48/340101948.db2.gz CCFSCRAPCIXVGW-WMZOPIPTSA-N 1 2 322.456 4.215 20 0 DIADLO C[C@@H]([NH2+]CC(F)(F)c1ccccc1)c1cnn(C2CCCC2)c1 ZINC000502435559 340103544 /nfs/dbraw/zinc/10/35/44/340103544.db2.gz OJNQSXWQHZCPGW-CQSZACIVSA-N 1 2 319.399 4.441 20 0 DIADLO CC(C)c1noc([C@@H](C)[NH2+][C@@H](c2ccc(F)cc2)C(C)C)n1 ZINC000502488436 340105914 /nfs/dbraw/zinc/10/59/14/340105914.db2.gz SCGIFEXSXIVHHT-IUODEOHRSA-N 1 2 305.397 4.380 20 0 DIADLO CC[C@H]1C[C@]1([NH2+]Cc1nc(C(C)(C)C)no1)c1cccc(C)c1 ZINC000502544290 340107322 /nfs/dbraw/zinc/10/73/22/340107322.db2.gz SNHAUPRYVKPDTF-IFXJQAMLSA-N 1 2 313.445 4.091 20 0 DIADLO Cc1nc(CC[N@@H+](C)Cc2c(Cl)cccc2Cl)cs1 ZINC000502683926 340110245 /nfs/dbraw/zinc/11/02/45/340110245.db2.gz ODEDDEWOJGOGML-UHFFFAOYSA-N 1 2 315.269 4.433 20 0 DIADLO Cc1nc(CC[N@H+](C)Cc2c(Cl)cccc2Cl)cs1 ZINC000502683926 340110246 /nfs/dbraw/zinc/11/02/46/340110246.db2.gz ODEDDEWOJGOGML-UHFFFAOYSA-N 1 2 315.269 4.433 20 0 DIADLO Cc1cccc(C2(C(=O)Nc3ccc(-c4[nH]cc[nH+]4)cc3)CC2)c1 ZINC000502759094 340113070 /nfs/dbraw/zinc/11/30/70/340113070.db2.gz FQBHDPHDPUENRV-UHFFFAOYSA-N 1 2 317.392 4.055 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000503010401 340118720 /nfs/dbraw/zinc/11/87/20/340118720.db2.gz IEIYHNIFBVYQEQ-UYAOXDASSA-N 1 2 322.452 4.047 20 0 DIADLO CCC(CC)C[N@@H+]1CCOC[C@H]1c1nc2ccccc2s1 ZINC000503061516 340120037 /nfs/dbraw/zinc/12/00/37/340120037.db2.gz NKAPOQPEPVOJRU-HNNXBMFYSA-N 1 2 304.459 4.106 20 0 DIADLO CCC(CC)C[N@H+]1CCOC[C@H]1c1nc2ccccc2s1 ZINC000503061516 340120038 /nfs/dbraw/zinc/12/00/38/340120038.db2.gz NKAPOQPEPVOJRU-HNNXBMFYSA-N 1 2 304.459 4.106 20 0 DIADLO C(=C\[C@@H]1CCCN1c1cc[nH+]c2ccncc21)\c1ccccc1 ZINC000503317192 340125305 /nfs/dbraw/zinc/12/53/05/340125305.db2.gz SHQSHAQAGQEARY-JJEJIETFSA-N 1 2 301.393 4.312 20 0 DIADLO C(=C/[C@H]1CCCN1c1cc[nH+]c2ccncc21)\c1ccccc1 ZINC000503317195 340125311 /nfs/dbraw/zinc/12/53/11/340125311.db2.gz SHQSHAQAGQEARY-KBOKABMXSA-N 1 2 301.393 4.312 20 0 DIADLO C[N@H+](Cc1nc2ccccc2o1)Cc1ccc(Cl)cc1F ZINC000503599382 340132354 /nfs/dbraw/zinc/13/23/54/340132354.db2.gz KDLJKVYNDMSMPG-UHFFFAOYSA-N 1 2 304.752 4.252 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2o1)Cc1ccc(Cl)cc1F ZINC000503599382 340132355 /nfs/dbraw/zinc/13/23/55/340132355.db2.gz KDLJKVYNDMSMPG-UHFFFAOYSA-N 1 2 304.752 4.252 20 0 DIADLO C[C@H](Nc1cccc(OCCc2ccccc2)c1)c1[nH+]ccn1C ZINC000503937114 340137573 /nfs/dbraw/zinc/13/75/73/340137573.db2.gz KYHQSCOXXDXCER-INIZCTEOSA-N 1 2 321.424 4.215 20 0 DIADLO Cc1cccc2nc(C[N@@H+](C)[C@H](C)c3ccccc3Cl)cn21 ZINC000504000487 340139399 /nfs/dbraw/zinc/13/93/99/340139399.db2.gz BPTFKJSCYXVVTA-CQSZACIVSA-N 1 2 313.832 4.489 20 0 DIADLO Cc1cccc2nc(C[N@H+](C)[C@H](C)c3ccccc3Cl)cn21 ZINC000504000487 340139400 /nfs/dbraw/zinc/13/94/00/340139400.db2.gz BPTFKJSCYXVVTA-CQSZACIVSA-N 1 2 313.832 4.489 20 0 DIADLO CCCN(C(=O)Nc1cc[nH+]c(C)c1)[C@@H](CC)c1ccccc1 ZINC000504131941 340141473 /nfs/dbraw/zinc/14/14/73/340141473.db2.gz QVUOPTHKLABLMP-SFHVURJKSA-N 1 2 311.429 4.207 20 0 DIADLO C[NH+](C)[C@@H](c1nc(-c2cccs2)no1)c1cccc(Cl)c1 ZINC000504247219 340143751 /nfs/dbraw/zinc/14/37/51/340143751.db2.gz QGMKMTOVHPJYGL-CYBMUJFWSA-N 1 2 319.817 4.103 20 0 DIADLO C[NH+](C)[C@H](c1nc(-c2ccccc2)no1)c1cccc(Cl)c1 ZINC000504281078 340144325 /nfs/dbraw/zinc/14/43/25/340144325.db2.gz WGRAASSMFBXBDL-HNNXBMFYSA-N 1 2 313.788 4.041 20 0 DIADLO C(=C/c1ccc(-n2cc[nH+]c2)cc1)\c1nc(-c2ccccc2)no1 ZINC000504373942 340146306 /nfs/dbraw/zinc/14/63/06/340146306.db2.gz IESCUSVIVVVSDX-DHZHZOJOSA-N 1 2 314.348 4.093 20 0 DIADLO Cc1cc(C(=O)Nc2c[nH+]ccc2OC(C)(C)C)ccc1Cl ZINC000504634007 340150322 /nfs/dbraw/zinc/15/03/22/340150322.db2.gz DBEVWIJBHIHHJI-UHFFFAOYSA-N 1 2 318.804 4.473 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)[C@H]1CCCc2ccccc21 ZINC000504677868 340150899 /nfs/dbraw/zinc/15/08/99/340150899.db2.gz QRZGKWDVHGSRAP-INIZCTEOSA-N 1 2 324.424 4.318 20 0 DIADLO C(=C/c1ccc(-n2cc[nH+]c2)cc1)\c1nc(C2CCCCC2)no1 ZINC000505083380 340160914 /nfs/dbraw/zinc/16/09/14/340160914.db2.gz GMCRJDCKPGPWSY-DHZHZOJOSA-N 1 2 320.396 4.473 20 0 DIADLO Cn1c2cc(Cl)ccc2nc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000505291733 340165808 /nfs/dbraw/zinc/16/58/08/340165808.db2.gz YESXJISZXJDNIX-MRXNPFEDSA-N 1 2 311.816 4.174 20 0 DIADLO Cn1c2cc(Cl)ccc2nc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000505291733 340165809 /nfs/dbraw/zinc/16/58/09/340165809.db2.gz YESXJISZXJDNIX-MRXNPFEDSA-N 1 2 311.816 4.174 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc(-c2cccs2)n1 ZINC000505489533 340169596 /nfs/dbraw/zinc/16/95/96/340169596.db2.gz UFGBUGLWLWQPII-UHFFFAOYSA-N 1 2 324.409 4.320 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1cc(F)ccc1Br ZINC000505602368 340172385 /nfs/dbraw/zinc/17/23/85/340172385.db2.gz NVJUXSRHKJHRHT-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1cc(F)ccc1Br ZINC000505602368 340172386 /nfs/dbraw/zinc/17/23/86/340172386.db2.gz NVJUXSRHKJHRHT-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO O=C(C[C@@H]1C[C@H]1c1ccccc1)Nc1ccccc1-n1cc[nH+]c1 ZINC000505630598 340173484 /nfs/dbraw/zinc/17/34/84/340173484.db2.gz COTUKLWUTRMBFX-IRXDYDNUSA-N 1 2 317.392 4.005 20 0 DIADLO COc1cccc(Cl)c1Cn1c[nH+]c2cc(F)c(F)cc21 ZINC000505636049 340173702 /nfs/dbraw/zinc/17/37/02/340173702.db2.gz LBSYOJLRNLMWMT-UHFFFAOYSA-N 1 2 308.715 4.025 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2cnc(-c3ccccc3)[nH]2)cc1 ZINC000505640028 340174027 /nfs/dbraw/zinc/17/40/27/340174027.db2.gz WQZJUVPJAHFBLC-UHFFFAOYSA-N 1 2 321.424 4.107 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2cnc(-c3ccccc3)[nH]2)cc1 ZINC000505640028 340174028 /nfs/dbraw/zinc/17/40/28/340174028.db2.gz WQZJUVPJAHFBLC-UHFFFAOYSA-N 1 2 321.424 4.107 20 0 DIADLO Cc1cc(Nc2ccc3c(c2)OC2(CCCCC2)O3)nc(C)[nH+]1 ZINC000505670640 340174813 /nfs/dbraw/zinc/17/48/13/340174813.db2.gz FAQKGSCCKZQZGW-UHFFFAOYSA-N 1 2 311.385 4.269 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cnc(-c2ccsc2)s1 ZINC000505689894 340175024 /nfs/dbraw/zinc/17/50/24/340175024.db2.gz KTFLCXHVIOSBJW-GFCCVEGCSA-N 1 2 315.467 4.250 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cnc(-c2ccsc2)s1 ZINC000505689894 340175025 /nfs/dbraw/zinc/17/50/25/340175025.db2.gz KTFLCXHVIOSBJW-GFCCVEGCSA-N 1 2 315.467 4.250 20 0 DIADLO C(=C\[C@H]1CCC[N@H+]1Cc1nc(C2CCCC2)no1)\c1ccccc1 ZINC000505819233 340178797 /nfs/dbraw/zinc/17/87/97/340178797.db2.gz LXTWPCXSZSSXIJ-MENFKHAKSA-N 1 2 323.440 4.405 20 0 DIADLO C(=C\[C@H]1CCC[N@@H+]1Cc1nc(C2CCCC2)no1)\c1ccccc1 ZINC000505819233 340178798 /nfs/dbraw/zinc/17/87/98/340178798.db2.gz LXTWPCXSZSSXIJ-MENFKHAKSA-N 1 2 323.440 4.405 20 0 DIADLO Cc1ccc(C(=O)N[C@H](C)CC(C)C)cc1Oc1cc[nH+]cc1 ZINC000505865757 340180047 /nfs/dbraw/zinc/18/00/47/340180047.db2.gz GQEMYDRKZLXWDD-OAHLLOKOSA-N 1 2 312.413 4.347 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)no1 ZINC000505885467 340180862 /nfs/dbraw/zinc/18/08/62/340180862.db2.gz RNSYASQHAYPAGZ-MUSGIIIZSA-N 1 2 311.429 4.090 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@@H]2/C=C\c2ccccc2)no1 ZINC000505885467 340180863 /nfs/dbraw/zinc/18/08/63/340180863.db2.gz RNSYASQHAYPAGZ-MUSGIIIZSA-N 1 2 311.429 4.090 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@H+](C)Cc1ccco1 ZINC000506099734 340185529 /nfs/dbraw/zinc/18/55/29/340185529.db2.gz PPRUCGPTHZOBLY-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[N@@H+](C)Cc1ccco1 ZINC000506099734 340185530 /nfs/dbraw/zinc/18/55/30/340185530.db2.gz PPRUCGPTHZOBLY-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO CCOc1ccccc1C[N@@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000506283465 340191092 /nfs/dbraw/zinc/19/10/92/340191092.db2.gz VPFDTLAEWWRVFU-UHFFFAOYSA-N 1 2 306.409 4.125 20 0 DIADLO CCOc1ccccc1C[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000506283465 340191093 /nfs/dbraw/zinc/19/10/93/340191093.db2.gz VPFDTLAEWWRVFU-UHFFFAOYSA-N 1 2 306.409 4.125 20 0 DIADLO C[N@H+](Cc1cnc(C(C)(C)C)s1)Cc1ccc(F)cc1F ZINC000506358594 340193220 /nfs/dbraw/zinc/19/32/20/340193220.db2.gz WTYWGDMJCJAMQC-UHFFFAOYSA-N 1 2 310.413 4.351 20 0 DIADLO C[N@@H+](Cc1cnc(C(C)(C)C)s1)Cc1ccc(F)cc1F ZINC000506358594 340193221 /nfs/dbraw/zinc/19/32/21/340193221.db2.gz WTYWGDMJCJAMQC-UHFFFAOYSA-N 1 2 310.413 4.351 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC000506557955 340196806 /nfs/dbraw/zinc/19/68/06/340196806.db2.gz ZFYIMDSNTXDAPZ-AWEZNQCLSA-N 1 2 309.388 4.409 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC000506557955 340196807 /nfs/dbraw/zinc/19/68/07/340196807.db2.gz ZFYIMDSNTXDAPZ-AWEZNQCLSA-N 1 2 309.388 4.409 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1c[nH]c(-c2ccccc2)n1 ZINC000506557955 340196808 /nfs/dbraw/zinc/19/68/08/340196808.db2.gz ZFYIMDSNTXDAPZ-AWEZNQCLSA-N 1 2 309.388 4.409 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1c[nH]c(-c2ccccc2)n1 ZINC000506557955 340196809 /nfs/dbraw/zinc/19/68/09/340196809.db2.gz ZFYIMDSNTXDAPZ-AWEZNQCLSA-N 1 2 309.388 4.409 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2nc3ccccc3s2)c1 ZINC000506719899 340200074 /nfs/dbraw/zinc/20/00/74/340200074.db2.gz PVAAZBRZVTWZPH-UHFFFAOYSA-N 1 2 300.402 4.376 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2nc3ccccc3s2)c1 ZINC000506719899 340200075 /nfs/dbraw/zinc/20/00/75/340200075.db2.gz PVAAZBRZVTWZPH-UHFFFAOYSA-N 1 2 300.402 4.376 20 0 DIADLO C[N@H+](Cc1cnc2ccccn12)Cc1cccc(Cl)c1Cl ZINC000506751214 340200801 /nfs/dbraw/zinc/20/08/01/340200801.db2.gz IALSEIZYARFYCT-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1cnc2ccccn12)Cc1cccc(Cl)c1Cl ZINC000506751214 340200802 /nfs/dbraw/zinc/20/08/02/340200802.db2.gz IALSEIZYARFYCT-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO CN(Cc1c[nH+]c2ccccn12)Cc1cccc(Cl)c1Cl ZINC000506751214 340200803 /nfs/dbraw/zinc/20/08/03/340200803.db2.gz IALSEIZYARFYCT-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO Cc1ccc2[nH+]cc(CN(C)Cc3c(F)cccc3Cl)n2c1 ZINC000506790538 340201961 /nfs/dbraw/zinc/20/19/61/340201961.db2.gz QZUCPTDQXAUNDQ-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2cccc(O)c2Cl)cc1 ZINC000506933823 340203951 /nfs/dbraw/zinc/20/39/51/340203951.db2.gz XGTUCIBOJQJONM-UHFFFAOYSA-N 1 2 305.805 4.076 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2cccc(O)c2Cl)cc1 ZINC000506933823 340203952 /nfs/dbraw/zinc/20/39/52/340203952.db2.gz XGTUCIBOJQJONM-UHFFFAOYSA-N 1 2 305.805 4.076 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](c2ccc(CC)cc2)C(C)C)no1 ZINC000506943038 340204107 /nfs/dbraw/zinc/20/41/07/340204107.db2.gz CLDFYIXRQPXFFL-LJQANCHMSA-N 1 2 315.461 4.462 20 0 DIADLO CCOC1CC(CSCc2cn3cc(Cl)ccc3[nH+]2)C1 ZINC000507119254 340208343 /nfs/dbraw/zinc/20/83/43/340208343.db2.gz WGPMKFQJOSBXII-UHFFFAOYSA-N 1 2 310.850 4.036 20 0 DIADLO Cc1c(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cnn1C ZINC000507131673 340208620 /nfs/dbraw/zinc/20/86/20/340208620.db2.gz KCQKHEKKIFDGJP-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1c(C[N@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cnn1C ZINC000507131673 340208621 /nfs/dbraw/zinc/20/86/21/340208621.db2.gz KCQKHEKKIFDGJP-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO Oc1cccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1Cl ZINC000507133027 340209055 /nfs/dbraw/zinc/20/90/55/340209055.db2.gz RRUAOMBXDSAIJX-OAHLLOKOSA-N 1 2 319.857 4.336 20 0 DIADLO Oc1cccc(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1Cl ZINC000507133027 340209056 /nfs/dbraw/zinc/20/90/56/340209056.db2.gz RRUAOMBXDSAIJX-OAHLLOKOSA-N 1 2 319.857 4.336 20 0 DIADLO Cc1nccc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)n1 ZINC000507157686 340210057 /nfs/dbraw/zinc/21/00/57/340210057.db2.gz BNAGRLQKHRNXKW-GFCCVEGCSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1nccc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)n1 ZINC000507157686 340210058 /nfs/dbraw/zinc/21/00/58/340210058.db2.gz BNAGRLQKHRNXKW-GFCCVEGCSA-N 1 2 301.821 4.164 20 0 DIADLO COCc1cccc(C[N@H+](C)[C@H](C)c2c(F)cccc2F)c1 ZINC000507190794 340212202 /nfs/dbraw/zinc/21/22/02/340212202.db2.gz FQUWHSIPLIRYJF-CYBMUJFWSA-N 1 2 305.368 4.304 20 0 DIADLO COCc1cccc(C[N@@H+](C)[C@H](C)c2c(F)cccc2F)c1 ZINC000507190794 340212203 /nfs/dbraw/zinc/21/22/03/340212203.db2.gz FQUWHSIPLIRYJF-CYBMUJFWSA-N 1 2 305.368 4.304 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1cc(F)ccc1Br ZINC000507251250 340215650 /nfs/dbraw/zinc/21/56/50/340215650.db2.gz GLHCBQAHMRMHBC-SNVBAGLBSA-N 1 2 312.182 4.374 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+](C)Cc1cnn(C(C)(C)C)c1 ZINC000507202684 340212931 /nfs/dbraw/zinc/21/29/31/340212931.db2.gz KJIWETWEUVANKK-GFCCVEGCSA-N 1 2 307.388 4.109 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)Cc1cnn(C(C)(C)C)c1 ZINC000507202684 340212932 /nfs/dbraw/zinc/21/29/32/340212932.db2.gz KJIWETWEUVANKK-GFCCVEGCSA-N 1 2 307.388 4.109 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)Cc1cnn(C(C)(C)C)c1 ZINC000507202685 340212951 /nfs/dbraw/zinc/21/29/51/340212951.db2.gz KJIWETWEUVANKK-LBPRGKRZSA-N 1 2 307.388 4.109 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)Cc1cnn(C(C)(C)C)c1 ZINC000507202685 340212952 /nfs/dbraw/zinc/21/29/52/340212952.db2.gz KJIWETWEUVANKK-LBPRGKRZSA-N 1 2 307.388 4.109 20 0 DIADLO Cc1ccn2c(C[N@@H+](C)[C@H](C)c3cc(F)ccc3F)cnc2c1 ZINC000507203957 340213087 /nfs/dbraw/zinc/21/30/87/340213087.db2.gz OZMVVWIUYJZZRX-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1ccn2c(C[N@H+](C)[C@H](C)c3cc(F)ccc3F)cnc2c1 ZINC000507203957 340213088 /nfs/dbraw/zinc/21/30/88/340213088.db2.gz OZMVVWIUYJZZRX-CYBMUJFWSA-N 1 2 315.367 4.114 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1cc(F)ccc1Br ZINC000507251250 340215651 /nfs/dbraw/zinc/21/56/51/340215651.db2.gz GLHCBQAHMRMHBC-SNVBAGLBSA-N 1 2 312.182 4.374 20 0 DIADLO Cc1ccc2[nH+]cc(CN(C)[C@@H](C)c3c(F)cccc3F)n2c1 ZINC000507213947 340213950 /nfs/dbraw/zinc/21/39/50/340213950.db2.gz QYQAHQMFUSZNQA-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@H]2c2ccsc2)s1 ZINC000507230764 340214624 /nfs/dbraw/zinc/21/46/24/340214624.db2.gz OZCWMLQLFXIGLU-ZDUSSCGKSA-N 1 2 310.513 4.405 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@H]2c2ccsc2)s1 ZINC000507230764 340214625 /nfs/dbraw/zinc/21/46/25/340214625.db2.gz OZCWMLQLFXIGLU-ZDUSSCGKSA-N 1 2 310.513 4.405 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)s1 ZINC000507229438 340214759 /nfs/dbraw/zinc/21/47/59/340214759.db2.gz MAHAHDCUMUECFD-HNNXBMFYSA-N 1 2 322.474 4.482 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)s1 ZINC000507229438 340214760 /nfs/dbraw/zinc/21/47/60/340214760.db2.gz MAHAHDCUMUECFD-HNNXBMFYSA-N 1 2 322.474 4.482 20 0 DIADLO CCOC(=O)c1ccc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)o1 ZINC000507233251 340214801 /nfs/dbraw/zinc/21/48/01/340214801.db2.gz QKALIFYBLGUIIU-LBPRGKRZSA-N 1 2 321.804 4.303 20 0 DIADLO CCOC(=O)c1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)o1 ZINC000507233251 340214802 /nfs/dbraw/zinc/21/48/02/340214802.db2.gz QKALIFYBLGUIIU-LBPRGKRZSA-N 1 2 321.804 4.303 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000507252208 340215581 /nfs/dbraw/zinc/21/55/81/340215581.db2.gz MGRIDQAEQSOQAT-NSHDSACASA-N 1 2 321.396 4.175 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000507252208 340215582 /nfs/dbraw/zinc/21/55/82/340215582.db2.gz MGRIDQAEQSOQAT-NSHDSACASA-N 1 2 321.396 4.175 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](Cc3ccc(Cl)cc3)CCO2)cc1 ZINC000507340147 340217580 /nfs/dbraw/zinc/21/75/80/340217580.db2.gz LWCFHRQERRPZAK-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](Cc3ccc(Cl)cc3)CCO2)cc1 ZINC000507340147 340217581 /nfs/dbraw/zinc/21/75/81/340217581.db2.gz LWCFHRQERRPZAK-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](Cc3ccccc3Cl)CCO2)cc1 ZINC000507357798 340217964 /nfs/dbraw/zinc/21/79/64/340217964.db2.gz KXXVAUQVCUMLFJ-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](Cc3ccccc3Cl)CCO2)cc1 ZINC000507357798 340217965 /nfs/dbraw/zinc/21/79/65/340217965.db2.gz KXXVAUQVCUMLFJ-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000507362390 340218019 /nfs/dbraw/zinc/21/80/19/340218019.db2.gz YQGPIDFJAOSDFW-AHUOSZMWSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000507362390 340218020 /nfs/dbraw/zinc/21/80/20/340218020.db2.gz YQGPIDFJAOSDFW-AHUOSZMWSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000507362391 340218064 /nfs/dbraw/zinc/21/80/64/340218064.db2.gz YQGPIDFJAOSDFW-COLJXDCZSA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000507362391 340218065 /nfs/dbraw/zinc/21/80/65/340218065.db2.gz YQGPIDFJAOSDFW-COLJXDCZSA-N 1 2 315.363 4.052 20 0 DIADLO CCc1cccnc1[C@@H](C)Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000507481271 340221904 /nfs/dbraw/zinc/22/19/04/340221904.db2.gz CIPKAQLXJXASHM-OAHLLOKOSA-N 1 2 310.445 4.202 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1coc(-c2ccc(C)cc2)n1 ZINC000507483996 340222004 /nfs/dbraw/zinc/22/20/04/340222004.db2.gz IQPQWPUGOJDLQA-OAHLLOKOSA-N 1 2 321.424 4.458 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1c(F)cccc1OC(F)F ZINC000507497777 340222882 /nfs/dbraw/zinc/22/28/82/340222882.db2.gz SQTJVANPBRJDIS-LLVKDONJSA-N 1 2 324.346 4.235 20 0 DIADLO c1ccc(CCNc2cccc3c2CN(c2cccc[nH+]2)C3)cc1 ZINC000507637001 340226963 /nfs/dbraw/zinc/22/69/63/340226963.db2.gz PZYWMZYETQXMGL-UHFFFAOYSA-N 1 2 315.420 4.256 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(O)c2Cl)C[C@@H](c2ccccc2)O1 ZINC000507783999 340231440 /nfs/dbraw/zinc/23/14/40/340231440.db2.gz HHTTZIOMMUZNHW-GUYCJALGSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(O)c2Cl)C[C@@H](c2ccccc2)O1 ZINC000507783999 340231441 /nfs/dbraw/zinc/23/14/41/340231441.db2.gz HHTTZIOMMUZNHW-GUYCJALGSA-N 1 2 317.816 4.008 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H]1CCc2c1c(F)ccc2F ZINC000507794806 340231657 /nfs/dbraw/zinc/23/16/57/340231657.db2.gz QSOKFCDXSWYBAM-MEBBXXQBSA-N 1 2 321.342 4.451 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(F)c(-c3cccs3)c2)no1 ZINC000508544364 340246237 /nfs/dbraw/zinc/24/62/37/340246237.db2.gz LZYWKZRIBGCMDE-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(F)c(-c3cccs3)c2)no1 ZINC000508544364 340246238 /nfs/dbraw/zinc/24/62/38/340246238.db2.gz LZYWKZRIBGCMDE-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO CCc1ccc(-c2ccc(C[N@H+](C)Cc3cc(C)on3)o2)cc1 ZINC000508562007 340246525 /nfs/dbraw/zinc/24/65/25/340246525.db2.gz UDJZPURHXYTNIL-UHFFFAOYSA-N 1 2 310.397 4.437 20 0 DIADLO CCc1ccc(-c2ccc(C[N@@H+](C)Cc3cc(C)on3)o2)cc1 ZINC000508562007 340246526 /nfs/dbraw/zinc/24/65/26/340246526.db2.gz UDJZPURHXYTNIL-UHFFFAOYSA-N 1 2 310.397 4.437 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1F)Cc1ccc(OC)cc1OC ZINC000508643290 340249312 /nfs/dbraw/zinc/24/93/12/340249312.db2.gz GLXDKXJMGMVOLV-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1F)Cc1ccc(OC)cc1OC ZINC000508643290 340249313 /nfs/dbraw/zinc/24/93/13/340249313.db2.gz GLXDKXJMGMVOLV-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO Cc1c2cccc(Cl)c2sc1C[N@H+](C)Cc1ccon1 ZINC000508687028 340250692 /nfs/dbraw/zinc/25/06/92/340250692.db2.gz BEGULZSTTQWWPG-UHFFFAOYSA-N 1 2 306.818 4.483 20 0 DIADLO Cc1c2cccc(Cl)c2sc1C[N@@H+](C)Cc1ccon1 ZINC000508687028 340250693 /nfs/dbraw/zinc/25/06/93/340250693.db2.gz BEGULZSTTQWWPG-UHFFFAOYSA-N 1 2 306.818 4.483 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1cncs1)Cc1ccccc1 ZINC000508759373 340252563 /nfs/dbraw/zinc/25/25/63/340252563.db2.gz QWHQCTJQHNXGNZ-UHFFFAOYSA-N 1 2 312.413 4.485 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1cncs1)Cc1ccccc1 ZINC000508759373 340252564 /nfs/dbraw/zinc/25/25/64/340252564.db2.gz QWHQCTJQHNXGNZ-UHFFFAOYSA-N 1 2 312.413 4.485 20 0 DIADLO C[C@@H](CC(=O)Nc1cccc(-n2cc[nH+]c2)c1)C1CCCCC1 ZINC000508988784 340257010 /nfs/dbraw/zinc/25/70/10/340257010.db2.gz UZCZDNYDKXIAFE-HNNXBMFYSA-N 1 2 311.429 4.417 20 0 DIADLO Cc1ccc(CNC(=O)c2ccccc2Oc2cc[nH+]cc2)cc1 ZINC000509010320 340258158 /nfs/dbraw/zinc/25/81/58/340258158.db2.gz FKTTUHDPMMTZQP-UHFFFAOYSA-N 1 2 318.376 4.112 20 0 DIADLO O=C(NCC1CCCCC1)c1ccccc1Oc1cc[nH+]cc1 ZINC000509015700 340258296 /nfs/dbraw/zinc/25/82/96/340258296.db2.gz WRGPRGVTZUHMKE-UHFFFAOYSA-N 1 2 310.397 4.184 20 0 DIADLO Cc1nocc1C[N@@H+]1CCc2cc(Cl)cc(Cl)c2[C@H]1C ZINC000509030710 340258802 /nfs/dbraw/zinc/25/88/02/340258802.db2.gz JQRPZJZATAVKPI-SNVBAGLBSA-N 1 2 311.212 4.409 20 0 DIADLO Cc1nocc1C[N@H+]1CCc2cc(Cl)cc(Cl)c2[C@H]1C ZINC000509030710 340258803 /nfs/dbraw/zinc/25/88/03/340258803.db2.gz JQRPZJZATAVKPI-SNVBAGLBSA-N 1 2 311.212 4.409 20 0 DIADLO C[N@H+](CCCCOc1cccc(C(F)(F)F)c1)CC(F)F ZINC000509120693 340261701 /nfs/dbraw/zinc/26/17/01/340261701.db2.gz GHTOZAQDIPJPDV-UHFFFAOYSA-N 1 2 311.294 4.061 20 0 DIADLO C[N@@H+](CCCCOc1cccc(C(F)(F)F)c1)CC(F)F ZINC000509120693 340261702 /nfs/dbraw/zinc/26/17/02/340261702.db2.gz GHTOZAQDIPJPDV-UHFFFAOYSA-N 1 2 311.294 4.061 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+][C@H]1CCCC12CCCC2 ZINC000509118901 340261770 /nfs/dbraw/zinc/26/17/70/340261770.db2.gz AEFNGQXEJFDSQB-IBGZPJMESA-N 1 2 314.473 4.356 20 0 DIADLO CCc1cccnc1NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509297969 340265583 /nfs/dbraw/zinc/26/55/83/340265583.db2.gz HXKXQMBLOOSHQO-UHFFFAOYSA-N 1 2 319.364 4.084 20 0 DIADLO COC(=O)c1cccc(Cl)c1C[N@H+](C)[C@@H](C)c1cccs1 ZINC000509295842 340265649 /nfs/dbraw/zinc/26/56/49/340265649.db2.gz WDAGHKQAOMCWEA-NSHDSACASA-N 1 2 323.845 4.381 20 0 DIADLO COC(=O)c1cccc(Cl)c1C[N@@H+](C)[C@@H](C)c1cccs1 ZINC000509295842 340265650 /nfs/dbraw/zinc/26/56/50/340265650.db2.gz WDAGHKQAOMCWEA-NSHDSACASA-N 1 2 323.845 4.381 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1nc(-c2ccc(C)cc2)cs1 ZINC000509310738 340265916 /nfs/dbraw/zinc/26/59/16/340265916.db2.gz QIQHWMVFWBBUGL-GOEBONIOSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1nc(-c2ccc(C)cc2)cs1 ZINC000509310738 340265917 /nfs/dbraw/zinc/26/59/17/340265917.db2.gz QIQHWMVFWBBUGL-GOEBONIOSA-N 1 2 316.470 4.118 20 0 DIADLO C[C@H]1CCCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509330434 340266502 /nfs/dbraw/zinc/26/65/02/340266502.db2.gz GJWKQOFTXLYXQR-HNNXBMFYSA-N 1 2 310.397 4.136 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2ccc(C3CCCCC3)cc2)no1 ZINC000509386388 340267939 /nfs/dbraw/zinc/26/79/39/340267939.db2.gz JZVKDXIYBODDMG-UHFFFAOYSA-N 1 2 313.445 4.451 20 0 DIADLO C[C@@H]1CC[C@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)[C@@H](C)C1 ZINC000509430035 340269281 /nfs/dbraw/zinc/26/92/81/340269281.db2.gz NQMYDBPVTNCPRT-VKJFTORMSA-N 1 2 324.424 4.428 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)n1 ZINC000509439313 340269458 /nfs/dbraw/zinc/26/94/58/340269458.db2.gz UKZTWKSNQXXTOE-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)n1 ZINC000509439313 340269459 /nfs/dbraw/zinc/26/94/59/340269459.db2.gz UKZTWKSNQXXTOE-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO FC(F)(F)COCC[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000509449691 340269932 /nfs/dbraw/zinc/26/99/32/340269932.db2.gz NIGQIGJJPBLUMW-UHFFFAOYSA-N 1 2 319.754 4.008 20 0 DIADLO FC(F)(F)COCC[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000509449691 340269933 /nfs/dbraw/zinc/26/99/33/340269933.db2.gz NIGQIGJJPBLUMW-UHFFFAOYSA-N 1 2 319.754 4.008 20 0 DIADLO CC1(CNC(=O)c2ccccc2Oc2cc[nH+]cc2)CCCC1 ZINC000509471126 340270712 /nfs/dbraw/zinc/27/07/12/340270712.db2.gz NGZYWVNJXCSPKS-UHFFFAOYSA-N 1 2 310.397 4.184 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)C(C1CCC1)C1CCC1 ZINC000509515699 340271962 /nfs/dbraw/zinc/27/19/62/340271962.db2.gz GUAZPTDLPZSDMJ-UHFFFAOYSA-N 1 2 309.413 4.232 20 0 DIADLO COc1cc[nH+]cc1NC(=O)[C@@H](C)c1cccc(CC(C)C)c1 ZINC000509536838 340272792 /nfs/dbraw/zinc/27/27/92/340272792.db2.gz BSZJCWKIOKBBJU-AWEZNQCLSA-N 1 2 312.413 4.031 20 0 DIADLO Cc1ccc([C@@H]2OCCC[C@@H]2Nc2[nH+]c3ccccc3n2C)cc1 ZINC000509555117 340273313 /nfs/dbraw/zinc/27/33/13/340273313.db2.gz SULUDPLKTBRXJM-HKUYNNGSSA-N 1 2 321.424 4.214 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)c1sccc1-c1ccc(C)cc1 ZINC000509797601 340279297 /nfs/dbraw/zinc/27/92/97/340279297.db2.gz ZPFMDOCQQASPBE-UHFFFAOYSA-N 1 2 322.433 4.355 20 0 DIADLO O=C(Nc1ccc2c(c1)[nH+]c1n2CCCCC1)C(C1CC1)C1CC1 ZINC000509885024 340282093 /nfs/dbraw/zinc/28/20/93/340282093.db2.gz XGTZWPKVEQQPAM-UHFFFAOYSA-N 1 2 323.440 4.137 20 0 DIADLO Cc1ccc(C(=O)N[C@H]2CCC(C)(C)C2)cc1Oc1cc[nH+]cc1 ZINC000509946338 340283489 /nfs/dbraw/zinc/28/34/89/340283489.db2.gz RUNJSHVFRONQBX-INIZCTEOSA-N 1 2 324.424 4.491 20 0 DIADLO Cn1c(CCSc2nc3ccccc3o2)[nH+]c2ccccc21 ZINC000509985902 340284666 /nfs/dbraw/zinc/28/46/66/340284666.db2.gz YIYZKKZTDJDQQX-UHFFFAOYSA-N 1 2 309.394 4.049 20 0 DIADLO FC(F)(F)c1cccc(C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)c1 ZINC000510069963 340287236 /nfs/dbraw/zinc/28/72/36/340287236.db2.gz GZAOTPDOQIRXOU-OAHLLOKOSA-N 1 2 309.335 4.156 20 0 DIADLO FC(F)(F)c1cccc(C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)c1 ZINC000510069963 340287237 /nfs/dbraw/zinc/28/72/37/340287237.db2.gz GZAOTPDOQIRXOU-OAHLLOKOSA-N 1 2 309.335 4.156 20 0 DIADLO CC[C@H](CC1CCCC1)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000510073952 340287480 /nfs/dbraw/zinc/28/74/80/340287480.db2.gz YSLQNWCHADOAPL-MRXNPFEDSA-N 1 2 311.429 4.417 20 0 DIADLO FC(F)Oc1cccc(C[NH2+]C2(C(F)F)CCCCC2)c1 ZINC000510079526 340287747 /nfs/dbraw/zinc/28/77/47/340287747.db2.gz OBRJVSNMWQRKPY-UHFFFAOYSA-N 1 2 305.315 4.346 20 0 DIADLO CCn1cc[nH+]c1CNc1c(F)cc(F)cc1-c1ccccc1 ZINC000510123099 340289584 /nfs/dbraw/zinc/28/95/84/340289584.db2.gz ALWRENIEUSPGHQ-UHFFFAOYSA-N 1 2 313.351 4.460 20 0 DIADLO CC(C)(C)CCCC(=O)Nc1nc(C[NH+]2CCCCC2)cs1 ZINC000303186583 340310766 /nfs/dbraw/zinc/31/07/66/340310766.db2.gz JCBGYLCDCYUTEM-UHFFFAOYSA-N 1 2 323.506 4.284 20 0 DIADLO C[C@H]1CC[C@@H](CNC(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000510781675 340310773 /nfs/dbraw/zinc/31/07/73/340310773.db2.gz NOONOQMTDNNILN-LSDHHAIUSA-N 1 2 310.397 4.040 20 0 DIADLO CC[C@]1(C)C[N@H+](Cc2nc(-c3ccc(C)cc3)cs2)CCO1 ZINC000510793441 340311223 /nfs/dbraw/zinc/31/12/23/340311223.db2.gz YBBKTLIZUIAZCY-GOSISDBHSA-N 1 2 316.470 4.119 20 0 DIADLO CC[C@]1(C)C[N@@H+](Cc2nc(-c3ccc(C)cc3)cs2)CCO1 ZINC000510793441 340311224 /nfs/dbraw/zinc/31/12/24/340311224.db2.gz YBBKTLIZUIAZCY-GOSISDBHSA-N 1 2 316.470 4.119 20 0 DIADLO CSc1ccccc1C[N@@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000511117862 340321270 /nfs/dbraw/zinc/32/12/70/340321270.db2.gz ZFFNVHNWIYFDOC-KRWDZBQOSA-N 1 2 317.429 4.121 20 0 DIADLO CSc1ccccc1C[N@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000511117862 340321271 /nfs/dbraw/zinc/32/12/71/340321271.db2.gz ZFFNVHNWIYFDOC-KRWDZBQOSA-N 1 2 317.429 4.121 20 0 DIADLO COC(=O)c1ccc(Cl)c(C[N@H+](Cc2ccco2)C(C)C)c1 ZINC000511150788 340322501 /nfs/dbraw/zinc/32/25/01/340322501.db2.gz QVBRSDSDLPLADP-UHFFFAOYSA-N 1 2 321.804 4.130 20 0 DIADLO COC(=O)c1ccc(Cl)c(C[N@@H+](Cc2ccco2)C(C)C)c1 ZINC000511150788 340322502 /nfs/dbraw/zinc/32/25/02/340322502.db2.gz QVBRSDSDLPLADP-UHFFFAOYSA-N 1 2 321.804 4.130 20 0 DIADLO CC1(c2ccccc2)CCN(c2cc[nH+]c3ccncc32)CC1 ZINC000511631433 340333162 /nfs/dbraw/zinc/33/31/62/340333162.db2.gz VMVHSNBAXNVPCI-UHFFFAOYSA-N 1 2 303.409 4.188 20 0 DIADLO Clc1ccc(/C=C\C[N@@H+]2CCO[C@@H](c3cccs3)C2)cc1 ZINC000512240561 340353606 /nfs/dbraw/zinc/35/36/06/340353606.db2.gz DUHCNGUORQNBBR-SSCKWRJFSA-N 1 2 319.857 4.488 20 0 DIADLO Clc1ccc(/C=C\C[N@H+]2CCO[C@@H](c3cccs3)C2)cc1 ZINC000512240561 340353607 /nfs/dbraw/zinc/35/36/07/340353607.db2.gz DUHCNGUORQNBBR-SSCKWRJFSA-N 1 2 319.857 4.488 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1ncc(-c3ccccc3)o1)CCO2 ZINC000512292066 340355844 /nfs/dbraw/zinc/35/58/44/340355844.db2.gz FYECMPFJDPIIDX-UHFFFAOYSA-N 1 2 320.392 4.045 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1ncc(-c3ccccc3)o1)CCO2 ZINC000512292066 340355845 /nfs/dbraw/zinc/35/58/45/340355845.db2.gz FYECMPFJDPIIDX-UHFFFAOYSA-N 1 2 320.392 4.045 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](Cc1noc(-c2ccccc2)n1)C1CC1 ZINC000512295088 340355976 /nfs/dbraw/zinc/35/59/76/340355976.db2.gz RJWLGKLCZIRERL-HNNXBMFYSA-N 1 2 319.408 4.462 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](Cc1noc(-c2ccccc2)n1)C1CC1 ZINC000512295088 340355977 /nfs/dbraw/zinc/35/59/77/340355977.db2.gz RJWLGKLCZIRERL-HNNXBMFYSA-N 1 2 319.408 4.462 20 0 DIADLO Clc1ccc(CN2CCCC[C@H]2c2[nH]cc[nH+]2)cc1Cl ZINC000512527933 340365678 /nfs/dbraw/zinc/36/56/78/340365678.db2.gz ZXUYXIKMXFXNMV-AWEZNQCLSA-N 1 2 310.228 4.444 20 0 DIADLO Clc1ccc(Cl)c(CN2CCCC[C@H]2c2[nH]cc[nH+]2)c1 ZINC000512542416 340366014 /nfs/dbraw/zinc/36/60/14/340366014.db2.gz OWUMTMXOFVAYQM-AWEZNQCLSA-N 1 2 310.228 4.444 20 0 DIADLO CCC[C@H](C)C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000512623973 340369668 /nfs/dbraw/zinc/36/96/68/340369668.db2.gz VKPSCGJUHVPBOX-AWEZNQCLSA-N 1 2 311.429 4.261 20 0 DIADLO CC1(C(=O)Nc2ccc(-c3cn4c([nH+]3)CCCC4)cc2)CCCC1 ZINC000512632862 340370136 /nfs/dbraw/zinc/37/01/36/340370136.db2.gz IJBFMXOACYQPEC-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO C[C@H]1CC[C@H](C)[N@H+](CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000174008139 340380046 /nfs/dbraw/zinc/38/00/46/340380046.db2.gz PLZBJAPGSOIOHJ-QWRGUYRKSA-N 1 2 315.244 4.052 20 0 DIADLO C[C@H]1CC[C@H](C)[N@@H+](CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000174008139 340380047 /nfs/dbraw/zinc/38/00/47/340380047.db2.gz PLZBJAPGSOIOHJ-QWRGUYRKSA-N 1 2 315.244 4.052 20 0 DIADLO Cc1nn(-c2ccccc2)cc1C[NH2+]C1(C(F)F)CCCCC1 ZINC000512855728 340380997 /nfs/dbraw/zinc/38/09/97/340380997.db2.gz JDOXGJZFNAKGGS-UHFFFAOYSA-N 1 2 319.399 4.238 20 0 DIADLO FC(F)C1([NH2+]Cc2cnc(-c3ccccn3)s2)CCCCC1 ZINC000512862827 340381211 /nfs/dbraw/zinc/38/12/11/340381211.db2.gz WZNGYWDCVRTVJK-UHFFFAOYSA-N 1 2 323.412 4.263 20 0 DIADLO Cc1ccccc1-c1noc([C@H](C)[NH+]2Cc3ccccc3C2)n1 ZINC000174138208 340382725 /nfs/dbraw/zinc/38/27/25/340382725.db2.gz WRPWFPJSJKYRRQ-AWEZNQCLSA-N 1 2 305.381 4.122 20 0 DIADLO Cc1ccc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)c(O)c1 ZINC000512910805 340383690 /nfs/dbraw/zinc/38/36/90/340383690.db2.gz YAXDUBSJXKJTGB-UHFFFAOYSA-N 1 2 320.348 4.140 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2ccccc2)o1)c1c(F)cncc1F ZINC000513089333 340392885 /nfs/dbraw/zinc/39/28/85/340392885.db2.gz MYXHRVNFHGYTGU-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000513137922 340394693 /nfs/dbraw/zinc/39/46/93/340394693.db2.gz BXSSKLXWHXQDFL-QGZVFWFLSA-N 1 2 319.351 4.016 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@H+]1CCOc2cc(O)ccc2C1 ZINC000513137922 340394694 /nfs/dbraw/zinc/39/46/94/340394694.db2.gz BXSSKLXWHXQDFL-QGZVFWFLSA-N 1 2 319.351 4.016 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC2)c1nc(C(C)(C)C)no1 ZINC000513195415 340396480 /nfs/dbraw/zinc/39/64/80/340396480.db2.gz BHVSCQFMWICVOL-STQMWFEESA-N 1 2 313.445 4.268 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2conc2Cc2ccccc2)c1 ZINC000513262407 340399998 /nfs/dbraw/zinc/39/99/98/340399998.db2.gz SFYSKZQWPJNHPM-UHFFFAOYSA-N 1 2 324.399 4.345 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2conc2Cc2ccccc2)c1 ZINC000513262407 340399999 /nfs/dbraw/zinc/39/99/99/340399999.db2.gz SFYSKZQWPJNHPM-UHFFFAOYSA-N 1 2 324.399 4.345 20 0 DIADLO CC[C@H](CC1CCCC1)C(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000513458966 340408651 /nfs/dbraw/zinc/40/86/51/340408651.db2.gz WGGNFLWEIHDXJU-CVEARBPZSA-N 1 2 303.450 4.070 20 0 DIADLO CC1(C)CCN(Cc2[nH+]ccn2CC(F)(F)F)c2ccccc21 ZINC000516974831 340460374 /nfs/dbraw/zinc/46/03/74/340460374.db2.gz JFNMDUQAJAFAGJ-UHFFFAOYSA-N 1 2 323.362 4.133 20 0 DIADLO Cc1ccc[nH+]c1CCc1noc(C(C)(C)Cc2ccccc2)n1 ZINC000517296117 340467618 /nfs/dbraw/zinc/46/76/18/340467618.db2.gz JBXTVNFOIONAIM-UHFFFAOYSA-N 1 2 321.424 4.079 20 0 DIADLO CCc1nc2cc(NCc3ccc(N(C)C(C)C)[nH+]c3)ccc2o1 ZINC000190830234 340547400 /nfs/dbraw/zinc/54/74/00/340547400.db2.gz UEOFYCMRCJQGGF-UHFFFAOYSA-N 1 2 324.428 4.242 20 0 DIADLO CCN(CC)c1ccc(N[C@@H](C)c2cnn(C(C)C)c2C)c[nH+]1 ZINC000191451236 340554387 /nfs/dbraw/zinc/55/43/87/340554387.db2.gz NRBZXGYJWMBPCD-AWEZNQCLSA-N 1 2 315.465 4.187 20 0 DIADLO Cc1cnc(C[NH2+]C(c2cccs2)c2cccs2)s1 ZINC000224404544 340554521 /nfs/dbraw/zinc/55/45/21/340554521.db2.gz HUZRPTUADSJQAQ-UHFFFAOYSA-N 1 2 306.481 4.454 20 0 DIADLO CO[C@H](C)CCC(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000191957970 340560500 /nfs/dbraw/zinc/56/05/00/340560500.db2.gz JQZXKLKGNRMJCH-CYBMUJFWSA-N 1 2 314.429 4.420 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NCc1cc(Cl)cs1 ZINC000192756998 340569542 /nfs/dbraw/zinc/56/95/42/340569542.db2.gz PYNSEMBIKXZVKZ-UHFFFAOYSA-N 1 2 321.833 4.010 20 0 DIADLO Cc1cc(NC(=O)c2ccsc2)ccc1Oc1cc[nH+]cc1 ZINC000193189201 340573822 /nfs/dbraw/zinc/57/38/22/340573822.db2.gz WDRFHIUYDIDAQV-UHFFFAOYSA-N 1 2 310.378 4.496 20 0 DIADLO COC[C@@H]([NH2+]Cc1csc(C(C)C)n1)c1ccc(Cl)cc1 ZINC000193275298 340575506 /nfs/dbraw/zinc/57/55/06/340575506.db2.gz AEUYIVVQSMRZQS-OAHLLOKOSA-N 1 2 324.877 4.397 20 0 DIADLO C[C@@H](Cc1cccc(F)c1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000195178313 340575592 /nfs/dbraw/zinc/57/55/92/340575592.db2.gz WUWDAZRLKSIWAM-ZDUSSCGKSA-N 1 2 323.371 4.033 20 0 DIADLO CCc1nc(COc2cc(C)[nH+]c3ccc(OC)cc32)cs1 ZINC000195533515 340581114 /nfs/dbraw/zinc/58/11/14/340581114.db2.gz NUWRTBPKRFIRKS-UHFFFAOYSA-N 1 2 314.410 4.150 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1nc(C)cs1)c1ccc(Cl)cc1 ZINC000194019841 340588172 /nfs/dbraw/zinc/58/81/72/340588172.db2.gz QQMYNQYDPBAIMY-SMDDNHRTSA-N 1 2 310.850 4.143 20 0 DIADLO C[C@H](C(=O)Nc1ccc2c(c1)[nH+]c1n2CCCCC1)C(C)(C)C ZINC000522320411 340598810 /nfs/dbraw/zinc/59/88/10/340598810.db2.gz UTXOYTCFQLZTKX-CYBMUJFWSA-N 1 2 313.445 4.383 20 0 DIADLO CN(Cc1ccco1)c1cc[nH+]c2c(Br)cccc12 ZINC000523298725 340619012 /nfs/dbraw/zinc/61/90/12/340619012.db2.gz BSDNUSIICRFSRY-UHFFFAOYSA-N 1 2 317.186 4.227 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1cccc(Cl)c1F ZINC000230708674 340620842 /nfs/dbraw/zinc/62/08/42/340620842.db2.gz JHRHXCLQJVZKLF-UHFFFAOYSA-N 1 2 314.187 4.431 20 0 DIADLO COc1cc(Cl)c(C)cc1NCc1cn2cccc(C)c2[nH+]1 ZINC000524494304 340655353 /nfs/dbraw/zinc/65/53/53/340655353.db2.gz PHAYMELCJJIKDA-UHFFFAOYSA-N 1 2 315.804 4.225 20 0 DIADLO Cc1cccn2cc(CNc3cc(C(F)(F)F)ccc3F)[nH+]c12 ZINC000524495183 340655364 /nfs/dbraw/zinc/65/53/64/340655364.db2.gz BNAVBHBBRXDBDS-UHFFFAOYSA-N 1 2 323.293 4.413 20 0 DIADLO Cc1cc[nH+]cc1NCc1ccc(Br)c(Cl)c1 ZINC000235787168 340661620 /nfs/dbraw/zinc/66/16/20/340661620.db2.gz OQBGFECPDIELDR-UHFFFAOYSA-N 1 2 311.610 4.418 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1NCc1cn2ccccc2[nH+]1 ZINC000315710521 340676445 /nfs/dbraw/zinc/67/64/45/340676445.db2.gz LUTJFMBYDOZKEN-UHFFFAOYSA-N 1 2 309.266 4.104 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1Cl)c1nnc2n1CCCCC2 ZINC000315934017 340677470 /nfs/dbraw/zinc/67/74/70/340677470.db2.gz WEFJSGRVNBZNNV-STQMWFEESA-N 1 2 318.852 4.070 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3ccc4c(c3)CCCC4)ccc2n1C ZINC000525211970 340695413 /nfs/dbraw/zinc/69/54/13/340695413.db2.gz GDKNYHJUVGILAZ-UHFFFAOYSA-N 1 2 319.408 4.013 20 0 DIADLO COc1cccc(OC(F)(F)F)c1C[NH2+][C@@H](C)c1ccoc1 ZINC000575010257 340702130 /nfs/dbraw/zinc/70/21/30/340702130.db2.gz JBRZWYCIMFLUFB-JTQLQIEISA-N 1 2 315.291 4.038 20 0 DIADLO Clc1ccc(CNc2ccc(N3CCCCC3)[nH+]c2)s1 ZINC000036983274 340726303 /nfs/dbraw/zinc/72/63/03/340726303.db2.gz CYZZTBOSGOHDRU-UHFFFAOYSA-N 1 2 307.850 4.399 20 0 DIADLO Fc1cc2c(cc1Cl)[C@@H]([NH2+]Cc1noc3c1CCCC3)CC2 ZINC000529570534 340763856 /nfs/dbraw/zinc/76/38/56/340763856.db2.gz OKFONAHMPUEABG-HNNXBMFYSA-N 1 2 320.795 4.123 20 0 DIADLO Cn1c[nH+]cc1[C@@H]1C[C@H]1C(=O)Nc1cccc(C2CCCCC2)c1 ZINC000529651951 340766863 /nfs/dbraw/zinc/76/68/63/340766863.db2.gz YMAFBNODFLXCIW-QZTJIDSGSA-N 1 2 323.440 4.210 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(C(C)(C)C)s1)c1cc2ccccc2o1 ZINC000537956167 340793392 /nfs/dbraw/zinc/79/33/92/340793392.db2.gz CTCPPSHDOWCDMR-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@@H](c1ccccc1)C1CC1 ZINC000124016484 340796768 /nfs/dbraw/zinc/79/67/68/340796768.db2.gz OTYQYZHQTKSPPY-IBGZPJMESA-N 1 2 317.392 4.005 20 0 DIADLO CC(C)c1ccc([C@H](C)[NH2+][C@H](CO)c2c(F)cccc2F)cc1 ZINC000537986681 340805573 /nfs/dbraw/zinc/80/55/73/340805573.db2.gz JNXHMXUULITLRC-SCLBCKFNSA-N 1 2 319.395 4.472 20 0 DIADLO COc1ccccc1-c1ccc(CNc2[nH+]cccc2OC)cc1 ZINC000538464112 340824987 /nfs/dbraw/zinc/82/49/87/340824987.db2.gz QHDQVYBJGVPJKI-UHFFFAOYSA-N 1 2 320.392 4.378 20 0 DIADLO CC(C)[C@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1cccnc1 ZINC000538527126 340831511 /nfs/dbraw/zinc/83/15/11/340831511.db2.gz RWLRWODLEXENRG-IBGZPJMESA-N 1 2 310.445 4.276 20 0 DIADLO FC(F)(F)c1nn(Cc2cc3ccccc3o2)c2cc[nH+]cc21 ZINC000538940130 340862906 /nfs/dbraw/zinc/86/29/06/340862906.db2.gz GMKFMMKRBQIXJU-UHFFFAOYSA-N 1 2 317.270 4.245 20 0 DIADLO Cc1ccc(-c2noc(C[NH2+][C@@H](C)c3ccc(C)cc3)n2)cc1 ZINC000539233167 340877802 /nfs/dbraw/zinc/87/78/02/340877802.db2.gz JHRBHTZTAWYQFM-HNNXBMFYSA-N 1 2 307.397 4.204 20 0 DIADLO C[C@@H]1C[C@H]1[C@@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000539426858 340885087 /nfs/dbraw/zinc/88/50/87/340885087.db2.gz VZDVHOZCEWFPEV-HQQWDMGQSA-N 1 2 317.820 4.087 20 0 DIADLO c1ccc2c(c1)OCCC[C@@H]2Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000539626521 340893319 /nfs/dbraw/zinc/89/33/19/340893319.db2.gz SUHPQNXBBIRPQS-SFHVURJKSA-N 1 2 323.440 4.398 20 0 DIADLO CCCc1[nH+]c2ccccc2n1CCC(=O)NC(C)(CC)CC ZINC000539842935 340905565 /nfs/dbraw/zinc/90/55/65/340905565.db2.gz NZDKZKNSOGZQSH-UHFFFAOYSA-N 1 2 315.461 4.074 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccccc2C(F)(F)F)c(C)[nH+]1 ZINC000128693942 340907944 /nfs/dbraw/zinc/90/79/44/340907944.db2.gz PVTCAASOGHBRFS-UHFFFAOYSA-N 1 2 309.291 4.361 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1ccn(C(C)C)n1 ZINC000540327856 340927046 /nfs/dbraw/zinc/92/70/46/340927046.db2.gz UXYWNTYUENTACI-OAHLLOKOSA-N 1 2 301.434 4.102 20 0 DIADLO COC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1-c1ccc(Cl)cc1 ZINC000540414341 340930436 /nfs/dbraw/zinc/93/04/36/340930436.db2.gz NVLMGMZOEQQIOK-OLZOCXBDSA-N 1 2 317.816 4.219 20 0 DIADLO CC(C)(Cc1[nH]c2ccccc2[nH+]1)c1nc(-c2ccccc2)no1 ZINC000541222120 340962515 /nfs/dbraw/zinc/96/25/15/340962515.db2.gz HDJKPQDDIPWRPE-UHFFFAOYSA-N 1 2 318.380 4.133 20 0 DIADLO Cn1c2ccc(Cl)cc2nc1-c1cc(-n2cc[nH+]c2)cs1 ZINC000541268777 340964611 /nfs/dbraw/zinc/96/46/11/340964611.db2.gz AZADYJAJUZVTDF-UHFFFAOYSA-N 1 2 314.801 4.141 20 0 DIADLO c1csc([C@@H]([NH2+]Cc2noc(C3CCCCC3)n2)C2CC2)c1 ZINC000541580520 340975659 /nfs/dbraw/zinc/97/56/59/340975659.db2.gz OLWFNDMSFIUQNA-INIZCTEOSA-N 1 2 317.458 4.420 20 0 DIADLO CCc1ccc(-c2noc([C@H](C)[NH2+][C@H](C)c3cccnc3)n2)cc1 ZINC000541691547 340980369 /nfs/dbraw/zinc/98/03/69/340980369.db2.gz PBOPGAQGLVWHFY-KGLIPLIRSA-N 1 2 322.412 4.106 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1CNc1c[nH+]c2c(c1)CCCC2 ZINC000542008303 340993061 /nfs/dbraw/zinc/99/30/61/340993061.db2.gz BOKGJBQWPMMDHC-UHFFFAOYSA-N 1 2 312.461 4.141 20 0 DIADLO Fc1ccc(C[N@H+](Cc2cnc(C3CC3)s2)C2CC2)c(F)c1 ZINC000130130647 341001266 /nfs/dbraw/zinc/00/12/66/341001266.db2.gz MVNNNFXHZQNYDZ-UHFFFAOYSA-N 1 2 320.408 4.463 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2cnc(C3CC3)s2)C2CC2)c(F)c1 ZINC000130130647 341001267 /nfs/dbraw/zinc/00/12/67/341001267.db2.gz MVNNNFXHZQNYDZ-UHFFFAOYSA-N 1 2 320.408 4.463 20 0 DIADLO Clc1ccc2c(c1)[C@@H]([N@@H+]1CCO[C@@H](c3ccsc3)C1)CC2 ZINC000542279022 341003416 /nfs/dbraw/zinc/00/34/16/341003416.db2.gz COSZHDCLXKXASR-DLBZAZTESA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)[C@@H]([N@H+]1CCO[C@@H](c3ccsc3)C1)CC2 ZINC000542279022 341003417 /nfs/dbraw/zinc/00/34/17/341003417.db2.gz COSZHDCLXKXASR-DLBZAZTESA-N 1 2 319.857 4.462 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2cccs2)c2cccnc2)c(F)c1 ZINC000542479793 341009383 /nfs/dbraw/zinc/00/93/83/341009383.db2.gz WFPONCDJQIBSRW-KRWDZBQOSA-N 1 2 316.376 4.301 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1cccs1 ZINC000542555891 341013491 /nfs/dbraw/zinc/01/34/91/341013491.db2.gz XNOHKRWBYSRDAS-LBPRGKRZSA-N 1 2 307.463 4.306 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2oc3ccc(OC)cc3c2C)o1 ZINC000542582536 341014687 /nfs/dbraw/zinc/01/46/87/341014687.db2.gz IYPIOPGEQDZILZ-GFCCVEGCSA-N 1 2 314.385 4.151 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1csc(-c2ccccc2)n1 ZINC000542693697 341017610 /nfs/dbraw/zinc/01/76/10/341017610.db2.gz RVSACXJUHZIUES-CQSZACIVSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1csc(-c2ccccc2)n1 ZINC000542693697 341017611 /nfs/dbraw/zinc/01/76/11/341017611.db2.gz RVSACXJUHZIUES-CQSZACIVSA-N 1 2 309.438 4.398 20 0 DIADLO FC(F)(F)c1ccc2oc(C[NH+]3Cc4ccccc4C3)nc2c1 ZINC000130413975 341021076 /nfs/dbraw/zinc/02/10/76/341021076.db2.gz VNXRAKANKVOSMA-UHFFFAOYSA-N 1 2 318.298 4.362 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1nnc(-c2ccccc2)s1 ZINC000542811809 341021758 /nfs/dbraw/zinc/02/17/58/341021758.db2.gz DUAFISPEKPJCDQ-CYBMUJFWSA-N 1 2 324.453 4.013 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2ccccc2OC(C)C)o1 ZINC000543487303 341047051 /nfs/dbraw/zinc/04/70/51/341047051.db2.gz KAACLCRQWDCMKC-KRWDZBQOSA-N 1 2 317.429 4.107 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]Cc2csc(-c3ccoc3)n2)cn1 ZINC000543504824 341047736 /nfs/dbraw/zinc/04/77/36/341047736.db2.gz LRNQPELBDINUDJ-LBPRGKRZSA-N 1 2 316.430 4.031 20 0 DIADLO CC[C@@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)c1ccn(C)n1 ZINC000543595250 341049975 /nfs/dbraw/zinc/04/99/75/341049975.db2.gz LTQUDBQPITVZFH-UKRRQHHQSA-N 1 2 311.351 4.155 20 0 DIADLO CC[C@@H]([NH2+][C@@H](CC(F)(F)F)c1ccccc1)c1ccn(C)n1 ZINC000543595247 341050055 /nfs/dbraw/zinc/05/00/55/341050055.db2.gz LTQUDBQPITVZFH-HIFRSBDPSA-N 1 2 311.351 4.155 20 0 DIADLO COc1c(C)cnc(C[N@H+](C)Cc2ccc(F)c(Cl)c2)c1C ZINC000543623897 341051536 /nfs/dbraw/zinc/05/15/36/341051536.db2.gz OCIDMKKGBYKFMH-UHFFFAOYSA-N 1 2 322.811 4.132 20 0 DIADLO COc1c(C)cnc(C[N@@H+](C)Cc2ccc(F)c(Cl)c2)c1C ZINC000543623897 341051537 /nfs/dbraw/zinc/05/15/37/341051537.db2.gz OCIDMKKGBYKFMH-UHFFFAOYSA-N 1 2 322.811 4.132 20 0 DIADLO CCCCCOc1ccc([C@H](C)[NH2+]Cc2nnc(C)s2)cc1 ZINC000543739736 341056044 /nfs/dbraw/zinc/05/60/44/341056044.db2.gz HSMLFUHXBMEUNC-ZDUSSCGKSA-N 1 2 319.474 4.266 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@H+](C)Cc1cncs1 ZINC000131011938 341056227 /nfs/dbraw/zinc/05/62/27/341056227.db2.gz UBZIAMDFPHVDAY-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@@H+](C)Cc1cncs1 ZINC000131011938 341056228 /nfs/dbraw/zinc/05/62/28/341056228.db2.gz UBZIAMDFPHVDAY-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2csc(C(C)C)n2)o1 ZINC000131016783 341056398 /nfs/dbraw/zinc/05/63/98/341056398.db2.gz SDTJIWRDNGCASL-HNNXBMFYSA-N 1 2 320.458 4.343 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2csc(C(C)C)n2)o1 ZINC000131016783 341056399 /nfs/dbraw/zinc/05/63/99/341056399.db2.gz SDTJIWRDNGCASL-HNNXBMFYSA-N 1 2 320.458 4.343 20 0 DIADLO COc1cccc2c1CC[N@H+](Cc1csc(C(C)(C)C)n1)C2 ZINC000543870711 341062221 /nfs/dbraw/zinc/06/22/21/341062221.db2.gz JVPIWSDNJNJINH-UHFFFAOYSA-N 1 2 316.470 4.008 20 0 DIADLO COc1cccc2c1CC[N@@H+](Cc1csc(C(C)(C)C)n1)C2 ZINC000543870711 341062222 /nfs/dbraw/zinc/06/22/22/341062222.db2.gz JVPIWSDNJNJINH-UHFFFAOYSA-N 1 2 316.470 4.008 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1c(F)cccc1N1CCCC1 ZINC000131142699 341062717 /nfs/dbraw/zinc/06/27/17/341062717.db2.gz AZIAQRMPAGZJFL-CQSZACIVSA-N 1 2 302.393 4.212 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1c(F)cccc1N1CCCC1 ZINC000131142699 341062718 /nfs/dbraw/zinc/06/27/18/341062718.db2.gz AZIAQRMPAGZJFL-CQSZACIVSA-N 1 2 302.393 4.212 20 0 DIADLO CCc1ccccc1NC(=O)[C@@H](C)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000543988034 341065231 /nfs/dbraw/zinc/06/52/31/341065231.db2.gz VOVJUIHGMBTUKV-LSDHHAIUSA-N 1 2 308.425 4.153 20 0 DIADLO CCc1ccccc1NC(=O)[C@@H](C)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000543988034 341065232 /nfs/dbraw/zinc/06/52/32/341065232.db2.gz VOVJUIHGMBTUKV-LSDHHAIUSA-N 1 2 308.425 4.153 20 0 DIADLO CC[C@](C)([NH2+]Cc1cc(Cl)cc2c1OCC2)c1nccs1 ZINC000543989527 341065287 /nfs/dbraw/zinc/06/52/87/341065287.db2.gz NEXCATZZXIYQMP-INIZCTEOSA-N 1 2 322.861 4.146 20 0 DIADLO c1[nH+]c2c(cc1NC1CCC3(CCOCC3)CC1)CCCC2 ZINC000544043618 341067867 /nfs/dbraw/zinc/06/78/67/341067867.db2.gz YDJHQKXGSXVVDO-UHFFFAOYSA-N 1 2 300.446 4.112 20 0 DIADLO Fc1ccc2c(c1)nc(-c1cc(-n3cc[nH+]c3)cs1)n2C1CC1 ZINC000544055116 341068396 /nfs/dbraw/zinc/06/83/96/341068396.db2.gz DZBJVQHHOLYENW-UHFFFAOYSA-N 1 2 324.384 4.425 20 0 DIADLO Cc1ccc(Cc2noc(-c3cc(Cl)ccc3Cl)n2)c[nH+]1 ZINC000544164806 341072536 /nfs/dbraw/zinc/07/25/36/341072536.db2.gz RBYASOLAXBAPGB-UHFFFAOYSA-N 1 2 320.179 4.338 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCO[C@H](c3cccs3)C2)c(F)c1 ZINC000544609867 341088911 /nfs/dbraw/zinc/08/89/11/341088911.db2.gz QQWLDMSUEQAOMS-SWQCVOCJSA-N 1 2 321.392 4.113 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCO[C@H](c3cccs3)C2)c(F)c1 ZINC000544609867 341088912 /nfs/dbraw/zinc/08/89/12/341088912.db2.gz QQWLDMSUEQAOMS-SWQCVOCJSA-N 1 2 321.392 4.113 20 0 DIADLO CCCc1noc(C[NH2+]C(CC)(CC)c2ccc(Cl)cc2)n1 ZINC000072599731 341093020 /nfs/dbraw/zinc/09/30/20/341093020.db2.gz YUNXVIRCVNSCDS-UHFFFAOYSA-N 1 2 321.852 4.481 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000072630263 341094583 /nfs/dbraw/zinc/09/45/83/341094583.db2.gz WHIKYAMZIMZFDZ-AWEZNQCLSA-N 1 2 308.381 4.240 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000072630263 341094584 /nfs/dbraw/zinc/09/45/84/341094584.db2.gz WHIKYAMZIMZFDZ-AWEZNQCLSA-N 1 2 308.381 4.240 20 0 DIADLO CCCc1noc(C[N@@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)n1 ZINC000072629209 341094586 /nfs/dbraw/zinc/09/45/86/341094586.db2.gz FLVKCPMLKQZRQC-KRWDZBQOSA-N 1 2 324.428 4.231 20 0 DIADLO CCCc1noc(C[N@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)n1 ZINC000072629209 341094587 /nfs/dbraw/zinc/09/45/87/341094587.db2.gz FLVKCPMLKQZRQC-KRWDZBQOSA-N 1 2 324.428 4.231 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000072630264 341094592 /nfs/dbraw/zinc/09/45/92/341094592.db2.gz WHIKYAMZIMZFDZ-CQSZACIVSA-N 1 2 308.381 4.240 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000072630264 341094593 /nfs/dbraw/zinc/09/45/93/341094593.db2.gz WHIKYAMZIMZFDZ-CQSZACIVSA-N 1 2 308.381 4.240 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1cnn(C(C)(C)C)c1 ZINC000131601653 341100969 /nfs/dbraw/zinc/10/09/69/341100969.db2.gz BKFJVHOALUWULD-GFCCVEGCSA-N 1 2 307.388 4.109 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cnn(C(C)(C)C)c1 ZINC000131601653 341100970 /nfs/dbraw/zinc/10/09/70/341100970.db2.gz BKFJVHOALUWULD-GFCCVEGCSA-N 1 2 307.388 4.109 20 0 DIADLO C[C@@H](c1noc(-c2ccc(Cn3cc[nH+]c3)cc2)n1)C(C)(C)C ZINC000544983081 341102793 /nfs/dbraw/zinc/10/27/93/341102793.db2.gz VYLSWTUFJFXNCW-ZDUSSCGKSA-N 1 2 310.401 4.131 20 0 DIADLO Brc1ccccc1C[N@H+](Cc1ccncc1)C1CC1 ZINC000072981876 341111911 /nfs/dbraw/zinc/11/19/11/341111911.db2.gz ZRLGXDQQGYCQHR-UHFFFAOYSA-N 1 2 317.230 4.009 20 0 DIADLO Brc1ccccc1C[N@@H+](Cc1ccncc1)C1CC1 ZINC000072981876 341111912 /nfs/dbraw/zinc/11/19/12/341111912.db2.gz ZRLGXDQQGYCQHR-UHFFFAOYSA-N 1 2 317.230 4.009 20 0 DIADLO CCCCS[C@H](C)C(=O)Nc1c[nH+]ccc1OC(C)(C)C ZINC000131818992 341112262 /nfs/dbraw/zinc/11/22/62/341112262.db2.gz BELJOBCLOGPKKS-GFCCVEGCSA-N 1 2 310.463 4.119 20 0 DIADLO C[C@@H](C(=O)Nc1c[nH+]ccc1OC(C)(C)C)c1ccccc1F ZINC000131829368 341112409 /nfs/dbraw/zinc/11/24/09/341112409.db2.gz BPHSCZSKQCFWMB-GFCCVEGCSA-N 1 2 316.376 4.140 20 0 DIADLO CC(C)COC[C@@H]([NH2+]Cc1cnc(C(C)C)s1)c1ccco1 ZINC000131880258 341113066 /nfs/dbraw/zinc/11/30/66/341113066.db2.gz CNIMJIVHSWJXKH-OAHLLOKOSA-N 1 2 322.474 4.363 20 0 DIADLO CC[N@H+](Cc1ccccc1)[C@H](C)c1nc(Cc2ccccc2)no1 ZINC000132057669 341115640 /nfs/dbraw/zinc/11/56/40/341115640.db2.gz OSNDFZYUDOMJOR-MRXNPFEDSA-N 1 2 321.424 4.244 20 0 DIADLO CC[N@@H+](Cc1ccccc1)[C@H](C)c1nc(Cc2ccccc2)no1 ZINC000132057669 341115641 /nfs/dbraw/zinc/11/56/41/341115641.db2.gz OSNDFZYUDOMJOR-MRXNPFEDSA-N 1 2 321.424 4.244 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@H]2CCc3c2cc(Cl)cc3Cl)no1 ZINC000132083462 341116032 /nfs/dbraw/zinc/11/60/32/341116032.db2.gz BZXSDDZLXVNDEL-HNNXBMFYSA-N 1 2 311.212 4.409 20 0 DIADLO Cc1cc(C[N@H+](C)[C@H]2CCc3c2cc(Cl)cc3Cl)no1 ZINC000132083462 341116033 /nfs/dbraw/zinc/11/60/33/341116033.db2.gz BZXSDDZLXVNDEL-HNNXBMFYSA-N 1 2 311.212 4.409 20 0 DIADLO O=C(c1ccccc1)C1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000073387800 341116126 /nfs/dbraw/zinc/11/61/26/341116126.db2.gz PCZRZVKPNBWAPY-UHFFFAOYSA-N 1 2 315.363 4.060 20 0 DIADLO C[N@H+](Cc1nccn1C(F)F)[C@@H]1CCc2c1cccc2Cl ZINC000132090823 341116198 /nfs/dbraw/zinc/11/61/98/341116198.db2.gz SGYNEQBWOBYDKM-CYBMUJFWSA-N 1 2 311.763 4.051 20 0 DIADLO C[N@@H+](Cc1nccn1C(F)F)[C@@H]1CCc2c1cccc2Cl ZINC000132090823 341116199 /nfs/dbraw/zinc/11/61/99/341116199.db2.gz SGYNEQBWOBYDKM-CYBMUJFWSA-N 1 2 311.763 4.051 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)[C@@H](C)c1nc(C(C)C)no1 ZINC000132167407 341117692 /nfs/dbraw/zinc/11/76/92/341117692.db2.gz YRJPKCRARIKZIJ-JTQLQIEISA-N 1 2 313.854 4.491 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)[C@@H](C)c1nc(C(C)C)no1 ZINC000132167407 341117693 /nfs/dbraw/zinc/11/76/93/341117693.db2.gz YRJPKCRARIKZIJ-JTQLQIEISA-N 1 2 313.854 4.491 20 0 DIADLO Cc1cccc(-c2noc(Cn3c[nH+]c4cc(C)c(C)cc43)n2)c1 ZINC000073529737 341117881 /nfs/dbraw/zinc/11/78/81/341117881.db2.gz PJVUAHZVWQRFIF-UHFFFAOYSA-N 1 2 318.380 4.060 20 0 DIADLO Cc1noc(C[NH2+][C@H](CCCc2ccccc2)c2ccccc2)n1 ZINC000073646192 341119576 /nfs/dbraw/zinc/11/95/76/341119576.db2.gz WSWYYDKBSYDOJL-LJQANCHMSA-N 1 2 321.424 4.232 20 0 DIADLO Clc1ccc(COc2cccc(NCc3[nH]cc[nH+]3)c2)cc1 ZINC000132292366 341120251 /nfs/dbraw/zinc/12/02/51/341120251.db2.gz SVHTZODXMSTGNS-UHFFFAOYSA-N 1 2 313.788 4.254 20 0 DIADLO Cn1ncc(Cl)c1CNc1cccc([NH+]2CCCCCC2)c1 ZINC000132389406 341121772 /nfs/dbraw/zinc/12/17/72/341121772.db2.gz VFSVIUUBJDZRGW-UHFFFAOYSA-N 1 2 318.852 4.066 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1nc(C(C)(C)C)no1 ZINC000073984221 341124529 /nfs/dbraw/zinc/12/45/29/341124529.db2.gz FCECOALHUYTJJD-QWRGUYRKSA-N 1 2 307.825 4.432 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)c(C)[nH+]1 ZINC000132534352 341126392 /nfs/dbraw/zinc/12/63/92/341126392.db2.gz QTYWPILMIOVSRI-JKSUJKDBSA-N 1 2 314.816 4.402 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@H](C)c2c(C)cccc2C)n1 ZINC000545519215 341128151 /nfs/dbraw/zinc/12/81/51/341128151.db2.gz GHKRHMVGFJANRB-ZIAGYGMSSA-N 1 2 319.474 4.351 20 0 DIADLO Fc1cccc(C[N@H+](Cc2nc(C3CCCC3)no2)C2CC2)c1 ZINC000132612879 341131760 /nfs/dbraw/zinc/13/17/60/341131760.db2.gz KZJUMEFNOLKXHJ-UHFFFAOYSA-N 1 2 315.392 4.031 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2nc(C3CCCC3)no2)C2CC2)c1 ZINC000132612879 341131761 /nfs/dbraw/zinc/13/17/61/341131761.db2.gz KZJUMEFNOLKXHJ-UHFFFAOYSA-N 1 2 315.392 4.031 20 0 DIADLO Cc1ccc(Cc2noc([C@@H]3CC[C@@H]4CCCC[C@H]4C3)n2)c[nH+]1 ZINC000545636718 341134322 /nfs/dbraw/zinc/13/43/22/341134322.db2.gz MVZLDZIBDUFBGP-YESZJQIVSA-N 1 2 311.429 4.438 20 0 DIADLO Cc1ccc(Cc2noc([C@@H](C)OC3CCCCCC3)n2)c[nH+]1 ZINC000545638105 341134473 /nfs/dbraw/zinc/13/44/73/341134473.db2.gz HASZIFRAKXXSPI-CQSZACIVSA-N 1 2 315.417 4.164 20 0 DIADLO FC(F)(F)CCCC[N@@H+]1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000132753802 341144760 /nfs/dbraw/zinc/14/47/60/341144760.db2.gz KGLLPTDYRSDYAA-AWEZNQCLSA-N 1 2 321.770 4.446 20 0 DIADLO FC(F)(F)CCCC[N@H+]1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000132753802 341144761 /nfs/dbraw/zinc/14/47/61/341144761.db2.gz KGLLPTDYRSDYAA-AWEZNQCLSA-N 1 2 321.770 4.446 20 0 DIADLO FC(F)c1ccc(CN2CC[NH+](Cc3ccsc3)CC2)cc1 ZINC000545894860 341144855 /nfs/dbraw/zinc/14/48/55/341144855.db2.gz NFZSLEIZYKLOCN-UHFFFAOYSA-N 1 2 322.424 4.004 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+]1CCc2ccsc2C1 ZINC000132768803 341145042 /nfs/dbraw/zinc/14/50/42/341145042.db2.gz GTVNPUJQFIOSEO-UHFFFAOYSA-N 1 2 316.451 4.331 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+]1CCc2ccsc2C1 ZINC000132768803 341145043 /nfs/dbraw/zinc/14/50/43/341145043.db2.gz GTVNPUJQFIOSEO-UHFFFAOYSA-N 1 2 316.451 4.331 20 0 DIADLO Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1noc(-c2ccccc2)n1 ZINC000546224554 341157582 /nfs/dbraw/zinc/15/75/82/341157582.db2.gz BYHTVWGBIDSHBQ-OAHLLOKOSA-N 1 2 307.397 4.204 20 0 DIADLO Cc1cn2cc(NC(=O)N[C@@H](C)c3c(C)cccc3C)ccc2[nH+]1 ZINC000546222881 341157625 /nfs/dbraw/zinc/15/76/25/341157625.db2.gz NWVZZFAABUKTHC-HNNXBMFYSA-N 1 2 322.412 4.142 20 0 DIADLO CC1(C)CC[C@H](c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)C1 ZINC000546285845 341161148 /nfs/dbraw/zinc/16/11/48/341161148.db2.gz VTTVBWGEPUPXFR-INIZCTEOSA-N 1 2 322.412 4.275 20 0 DIADLO Cc1ccc(Cc2noc(-c3ccc(Cl)c(Cl)c3)n2)c[nH+]1 ZINC000546343151 341164293 /nfs/dbraw/zinc/16/42/93/341164293.db2.gz SGFZDLJSVCPEAS-UHFFFAOYSA-N 1 2 320.179 4.338 20 0 DIADLO CCc1ccc(/C=C/c2nc(Cc3ccc(C)[nH+]c3)no2)cc1 ZINC000546347161 341164512 /nfs/dbraw/zinc/16/45/12/341164512.db2.gz RFTXERUKRLLKAK-ZHACJKMWSA-N 1 2 305.381 4.097 20 0 DIADLO CCc1ccc(/C(C)=C/c2nc(Cc3ccc(C)[nH+]c3)no2)cc1 ZINC000546350035 341164657 /nfs/dbraw/zinc/16/46/57/341164657.db2.gz ALHMGSXUDGEFIO-SDNWHVSQSA-N 1 2 319.408 4.487 20 0 DIADLO c1cn(Cc2ccc(-c3nc(CC4CCCCC4)no3)cc2)c[nH+]1 ZINC000546365894 341165199 /nfs/dbraw/zinc/16/51/99/341165199.db2.gz BTDAJZFQIFOYTK-UHFFFAOYSA-N 1 2 322.412 4.104 20 0 DIADLO c1cn(-c2cccc(-c3noc(C4CCCCCC4)n3)c2)c[nH+]1 ZINC000546400399 341166680 /nfs/dbraw/zinc/16/66/80/341166680.db2.gz CGNJNETYVYJKHX-UHFFFAOYSA-N 1 2 308.385 4.360 20 0 DIADLO CC1(C)CCC(C)(C[NH2+][C@H](c2cccs2)c2nnc[nH]2)CC1 ZINC000564305685 341175592 /nfs/dbraw/zinc/17/55/92/341175592.db2.gz RNRFDDPQBXILEK-CQSZACIVSA-N 1 2 318.490 4.152 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccc(Cl)c(Cl)c2)C2CC2)o1 ZINC000075643020 341180255 /nfs/dbraw/zinc/18/02/55/341180255.db2.gz GHOKRGNHTIJLSL-UHFFFAOYSA-N 1 2 311.212 4.454 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccc(Cl)c(Cl)c2)C2CC2)o1 ZINC000075643020 341180256 /nfs/dbraw/zinc/18/02/56/341180256.db2.gz GHOKRGNHTIJLSL-UHFFFAOYSA-N 1 2 311.212 4.454 20 0 DIADLO c1coc([C@@H]([NH2+]Cc2cnc(C3CC3)s2)c2ccccc2)c1 ZINC000133667574 341181255 /nfs/dbraw/zinc/18/12/55/341181255.db2.gz MSSKBTPILIYFBU-KRWDZBQOSA-N 1 2 310.422 4.493 20 0 DIADLO C[C@@H]1CC(Nc2[nH+]cccc2OCc2ccccc2)C[C@@H](C)O1 ZINC000546887784 341185603 /nfs/dbraw/zinc/18/56/03/341185603.db2.gz SWUVCLFFLSLCQW-HUUCEWRRSA-N 1 2 312.413 4.029 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1csc(-c3ccoc3)n1)CC2 ZINC000133850636 341194112 /nfs/dbraw/zinc/19/41/12/341194112.db2.gz OFLIBJPTBZOSSU-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1csc(-c3ccoc3)n1)CC2 ZINC000133850636 341194113 /nfs/dbraw/zinc/19/41/13/341194113.db2.gz OFLIBJPTBZOSSU-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO C[C@H]([NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1)c1nccn1C ZINC000547395646 341210809 /nfs/dbraw/zinc/21/08/09/341210809.db2.gz YTNFLQJZNNOQCU-JTQLQIEISA-N 1 2 310.228 4.067 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2noc(C(C)(C)C)n2)C(C)C)cc1 ZINC000076676588 341212148 /nfs/dbraw/zinc/21/21/48/341212148.db2.gz PQSCUHNTKWOGKO-QGZVFWFLSA-N 1 2 315.461 4.416 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2noc(C(C)(C)C)n2)C(C)C)cc1 ZINC000076676592 341212164 /nfs/dbraw/zinc/21/21/64/341212164.db2.gz PQSCUHNTKWOGKO-KRWDZBQOSA-N 1 2 315.461 4.416 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1ccc(C)cn1)c1ccccc1 ZINC000134301177 341212443 /nfs/dbraw/zinc/21/24/43/341212443.db2.gz WXIOGKSIHZGTQU-OAQYLSRUSA-N 1 2 318.420 4.278 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)nc1 ZINC000134299447 341212563 /nfs/dbraw/zinc/21/25/63/341212563.db2.gz QXNADHWKBAQUAY-AWEZNQCLSA-N 1 2 309.438 4.364 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)[C@@H](C)c2ccccc2)cs1 ZINC000076716647 341212846 /nfs/dbraw/zinc/21/28/46/341212846.db2.gz FDWJDTACGHQPOC-UONOGXRCSA-N 1 2 304.459 4.434 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)[C@@H](C)c2ccccc2)cs1 ZINC000076716647 341212847 /nfs/dbraw/zinc/21/28/47/341212847.db2.gz FDWJDTACGHQPOC-UONOGXRCSA-N 1 2 304.459 4.434 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2cc3c(ccc(C)c3C)[nH]2)cs1 ZINC000547448963 341214271 /nfs/dbraw/zinc/21/42/71/341214271.db2.gz UNOFCCISMKEGAJ-UHFFFAOYSA-N 1 2 313.470 4.436 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2cc3c(ccc(C)c3C)[nH]2)cs1 ZINC000547448963 341214272 /nfs/dbraw/zinc/21/42/72/341214272.db2.gz UNOFCCISMKEGAJ-UHFFFAOYSA-N 1 2 313.470 4.436 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1ccc(Br)cn1 ZINC000134538347 341217509 /nfs/dbraw/zinc/21/75/09/341217509.db2.gz KHYYYOIZPHGFST-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccc(Br)cn1 ZINC000134538347 341217510 /nfs/dbraw/zinc/21/75/10/341217510.db2.gz KHYYYOIZPHGFST-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2nc3ccccc3[nH]2)[C@@H]1c1ccccc1 ZINC000547506285 341218737 /nfs/dbraw/zinc/21/87/37/341218737.db2.gz UEXMEDCQSRIYBJ-LIRRHRJNSA-N 1 2 323.465 4.242 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2nc3ccccc3[nH]2)[C@@H]1c1ccccc1 ZINC000547506285 341218738 /nfs/dbraw/zinc/21/87/38/341218738.db2.gz UEXMEDCQSRIYBJ-LIRRHRJNSA-N 1 2 323.465 4.242 20 0 DIADLO FC(F)(F)c1ccc([C@H]2CCCC[N@@H+]2Cc2ccon2)cc1 ZINC000077277218 341222195 /nfs/dbraw/zinc/22/21/95/341222195.db2.gz BACFNUBCXDBFAA-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1ccc([C@H]2CCCC[N@H+]2Cc2ccon2)cc1 ZINC000077277218 341222196 /nfs/dbraw/zinc/22/21/96/341222196.db2.gz BACFNUBCXDBFAA-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO Brc1cccc([C@@H]2CCC[N@H+]2Cc2nccs2)c1 ZINC000134996586 341228370 /nfs/dbraw/zinc/22/83/70/341228370.db2.gz HHLRRBYDRKPGIV-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO C[C@H]1CSCC[N@@H+]1Cc1ccc(Br)cc1Cl ZINC000134895795 341226077 /nfs/dbraw/zinc/22/60/77/341226077.db2.gz ZTOUCIJCZJKUKE-VIFPVBQESA-N 1 2 320.683 4.040 20 0 DIADLO C[C@H]1CSCC[N@H+]1Cc1ccc(Br)cc1Cl ZINC000134895795 341226078 /nfs/dbraw/zinc/22/60/78/341226078.db2.gz ZTOUCIJCZJKUKE-VIFPVBQESA-N 1 2 320.683 4.040 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+][C@H](C)c1nc2c(s1)CCC2 ZINC000134912121 341226658 /nfs/dbraw/zinc/22/66/58/341226658.db2.gz MYSBMOSQELPXSI-SNVBAGLBSA-N 1 2 322.861 4.145 20 0 DIADLO Brc1cccc([C@@H]2CCC[N@@H+]2Cc2nccs2)c1 ZINC000134996586 341228369 /nfs/dbraw/zinc/22/83/69/341228369.db2.gz HHLRRBYDRKPGIV-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO COc1c(C)cc(C[N@H+](C)Cc2csc(C3CC3)n2)cc1C ZINC000135325259 341236821 /nfs/dbraw/zinc/23/68/21/341236821.db2.gz PXYLPEQKWABQOR-UHFFFAOYSA-N 1 2 316.470 4.278 20 0 DIADLO COc1c(C)cc(C[N@@H+](C)Cc2csc(C3CC3)n2)cc1C ZINC000135325259 341236822 /nfs/dbraw/zinc/23/68/22/341236822.db2.gz PXYLPEQKWABQOR-UHFFFAOYSA-N 1 2 316.470 4.278 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)N[C@H]1C=CCCC1 ZINC000135815430 341246379 /nfs/dbraw/zinc/24/63/79/341246379.db2.gz MULSMRXISNJKAA-AWEZNQCLSA-N 1 2 309.369 4.104 20 0 DIADLO CC(C)C(=O)Nc1ccc(N[C@H](C)c2cn3ccccc3[nH+]2)cc1 ZINC000548385024 341258187 /nfs/dbraw/zinc/25/81/87/341258187.db2.gz PZYNZASSRVALBG-CQSZACIVSA-N 1 2 322.412 4.102 20 0 DIADLO Cc1cc(NC(=O)c2cc(C3CC3)nc3ccc(F)cc32)cc[nH+]1 ZINC000080220800 341271014 /nfs/dbraw/zinc/27/10/14/341271014.db2.gz MSQKRRHFAALGND-UHFFFAOYSA-N 1 2 321.355 4.207 20 0 DIADLO Cc1nc(-c2cccc(C(=O)Nc3cc[nH+]c(C)c3)c2)cs1 ZINC000080221008 341271040 /nfs/dbraw/zinc/27/10/40/341271040.db2.gz RMDGGDWJVQHDGM-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO C[C@@H]1C[C@@H](C)[NH+]1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000548754184 341272480 /nfs/dbraw/zinc/27/24/80/341272480.db2.gz VYURXTYPLYTFEN-VXGBXAGGSA-N 1 2 322.861 4.358 20 0 DIADLO CN(C)C[C@H]([NH2+]Cc1ccc(F)cc1F)c1ccc(Cl)cc1 ZINC000548992021 341283031 /nfs/dbraw/zinc/28/30/31/341283031.db2.gz SGTTZDXXKJMVQX-KRWDZBQOSA-N 1 2 324.802 4.011 20 0 DIADLO C[C@@]1(c2ccccc2)C[N@H+](Cc2sccc2Cl)CCO1 ZINC000549041484 341284579 /nfs/dbraw/zinc/28/45/79/341284579.db2.gz KAESCDPCOOHCCC-INIZCTEOSA-N 1 2 307.846 4.149 20 0 DIADLO C[C@@]1(c2ccccc2)C[N@@H+](Cc2sccc2Cl)CCO1 ZINC000549041484 341284580 /nfs/dbraw/zinc/28/45/80/341284580.db2.gz KAESCDPCOOHCCC-INIZCTEOSA-N 1 2 307.846 4.149 20 0 DIADLO FC(F)(F)[C@H]1CC[N@H+](Cc2nc3ccccc3[nH]2)CC12CCC2 ZINC000549169713 341287718 /nfs/dbraw/zinc/28/77/18/341287718.db2.gz AXWBWPVHNLQVBI-AWEZNQCLSA-N 1 2 323.362 4.117 20 0 DIADLO FC(F)(F)[C@H]1CC[N@@H+](Cc2nc3ccccc3[nH]2)CC12CCC2 ZINC000549169713 341287719 /nfs/dbraw/zinc/28/77/19/341287719.db2.gz AXWBWPVHNLQVBI-AWEZNQCLSA-N 1 2 323.362 4.117 20 0 DIADLO Cc1ccc2nc(C[N@@H+](C)[C@@H](C)c3ccc(F)c(F)c3)cn2c1 ZINC000549181176 341288195 /nfs/dbraw/zinc/28/81/95/341288195.db2.gz LNWVGQDLAUDSTI-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO Cc1ccc2nc(C[N@H+](C)[C@@H](C)c3ccc(F)c(F)c3)cn2c1 ZINC000549181176 341288196 /nfs/dbraw/zinc/28/81/96/341288196.db2.gz LNWVGQDLAUDSTI-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO CCc1cc(N2CC(C)(C)[C@@H]3CCC[C@@H]32)nc(-c2ccncc2)[nH+]1 ZINC000549267595 341290084 /nfs/dbraw/zinc/29/00/84/341290084.db2.gz LTSMLWLHSWYKSU-SJORKVTESA-N 1 2 322.456 4.116 20 0 DIADLO CCc1cc(N2CC(C)(C)[C@H]3CCC[C@@H]32)nc(-c2ccncc2)[nH+]1 ZINC000549267594 341290104 /nfs/dbraw/zinc/29/01/04/341290104.db2.gz LTSMLWLHSWYKSU-IRXDYDNUSA-N 1 2 322.456 4.116 20 0 DIADLO CC(C)c1noc(C[N@H+](C)C2c3ccccc3-c3ccccc32)n1 ZINC000081596706 341298259 /nfs/dbraw/zinc/29/82/59/341298259.db2.gz YJHOXKMHBGTJRW-UHFFFAOYSA-N 1 2 319.408 4.395 20 0 DIADLO CC(C)c1noc(C[N@@H+](C)C2c3ccccc3-c3ccccc32)n1 ZINC000081596706 341298260 /nfs/dbraw/zinc/29/82/60/341298260.db2.gz YJHOXKMHBGTJRW-UHFFFAOYSA-N 1 2 319.408 4.395 20 0 DIADLO CCc1nc(C(C)C)ccc1C[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000549709396 341301039 /nfs/dbraw/zinc/30/10/39/341301039.db2.gz BLNIEMZEWKIPIS-LJQANCHMSA-N 1 2 312.461 4.218 20 0 DIADLO CCc1nc(C(C)C)ccc1C[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000549709396 341301040 /nfs/dbraw/zinc/30/10/40/341301040.db2.gz BLNIEMZEWKIPIS-LJQANCHMSA-N 1 2 312.461 4.218 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000245553992 341301638 /nfs/dbraw/zinc/30/16/38/341301638.db2.gz RYHPKCFDSCSEJT-QRWLVFNGSA-N 1 2 322.408 4.136 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000245553992 341301639 /nfs/dbraw/zinc/30/16/39/341301639.db2.gz RYHPKCFDSCSEJT-QRWLVFNGSA-N 1 2 322.408 4.136 20 0 DIADLO Cc1cc(Cl)cc(C[NH2+][C@H](c2nc(C3CC3)no2)C(C)C)c1 ZINC000549754595 341302305 /nfs/dbraw/zinc/30/23/05/341302305.db2.gz FDNWVEKZLUZDQT-HNNXBMFYSA-N 1 2 319.836 4.396 20 0 DIADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1csc(Cc2ccc(Cl)cc2)n1 ZINC000549924332 341306916 /nfs/dbraw/zinc/30/69/16/341306916.db2.gz WQRUNRBIUGCJBF-NWDGAFQWSA-N 1 2 306.862 4.228 20 0 DIADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1csc(Cc2ccc(Cl)cc2)n1 ZINC000549924332 341306917 /nfs/dbraw/zinc/30/69/17/341306917.db2.gz WQRUNRBIUGCJBF-NWDGAFQWSA-N 1 2 306.862 4.228 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cc(F)ccc1Cl ZINC000549940535 341307609 /nfs/dbraw/zinc/30/76/09/341307609.db2.gz DRKCDQLWAFAEML-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO CC[C@H](C)Oc1cccc(NCc2c[nH+]c3c(C)cccn23)c1 ZINC000550239326 341313104 /nfs/dbraw/zinc/31/31/04/341313104.db2.gz ACAMKNZPJHNPAK-HNNXBMFYSA-N 1 2 309.413 4.432 20 0 DIADLO c1nc(-c2ccccc2)[nH]c1CNc1ccc(C2CCC2)c[nH+]1 ZINC000550306654 341314827 /nfs/dbraw/zinc/31/48/27/341314827.db2.gz GMHCPHIOOIRYMG-UHFFFAOYSA-N 1 2 304.397 4.351 20 0 DIADLO Cc1cc(C)cc(N(C)Cc2[nH+]ccn2Cc2ccccc2)c1 ZINC000550306550 341314837 /nfs/dbraw/zinc/31/48/37/341314837.db2.gz BFSZTTLDICIFRW-UHFFFAOYSA-N 1 2 305.425 4.185 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)n1 ZINC000245831782 341315689 /nfs/dbraw/zinc/31/56/89/341315689.db2.gz BURCSPMMVGTCNM-HYSWKAIVSA-N 1 2 319.836 4.162 20 0 DIADLO CCc1ccc(-c2nc(C[N@@H+]3CCC[C@@H]3CF)cs2)cc1 ZINC000550410049 341316354 /nfs/dbraw/zinc/31/63/54/341316354.db2.gz KFGGDPSXYIJDDT-MRXNPFEDSA-N 1 2 304.434 4.306 20 0 DIADLO CCc1ccc(-c2nc(C[N@H+]3CCC[C@@H]3CF)cs2)cc1 ZINC000550410049 341316355 /nfs/dbraw/zinc/31/63/55/341316355.db2.gz KFGGDPSXYIJDDT-MRXNPFEDSA-N 1 2 304.434 4.306 20 0 DIADLO COc1cccc(C[C@H]([NH2+]CC(C)(F)F)c2ccccc2)c1 ZINC000550875455 341325246 /nfs/dbraw/zinc/32/52/46/341325246.db2.gz RGTFYXSIYJLXNT-KRWDZBQOSA-N 1 2 305.368 4.224 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccnc(O[C@H](C)CC(C)C)c2)no1 ZINC000550887753 341325735 /nfs/dbraw/zinc/32/57/35/341325735.db2.gz RXWGWEJOAGGEEJ-UKRRQHHQSA-N 1 2 317.433 4.042 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccnc(O[C@@H](C)CC(C)C)c2)no1 ZINC000550887536 341325776 /nfs/dbraw/zinc/32/57/76/341325776.db2.gz RXWGWEJOAGGEEJ-DZGCQCFKSA-N 1 2 317.433 4.042 20 0 DIADLO CCOc1cc(C[N@@H+]2CCc3ccccc3C2)cc(Cl)c1O ZINC000550957134 341327832 /nfs/dbraw/zinc/32/78/32/341327832.db2.gz JCCHXZGDHDCUEH-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO CCOc1cc(C[N@H+]2CCc3ccccc3C2)cc(Cl)c1O ZINC000550957134 341327833 /nfs/dbraw/zinc/32/78/33/341327833.db2.gz JCCHXZGDHDCUEH-UHFFFAOYSA-N 1 2 317.816 4.003 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1ccc(Cl)cc1 ZINC000551011918 341329110 /nfs/dbraw/zinc/32/91/10/341329110.db2.gz HGPOAJFHJMWOGB-KDOFPFPSSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1ccc(Cl)cc1 ZINC000551011918 341329111 /nfs/dbraw/zinc/32/91/11/341329111.db2.gz HGPOAJFHJMWOGB-KDOFPFPSSA-N 1 2 301.817 4.302 20 0 DIADLO Cc1ccc2[nH+]c(CNc3ccc(-c4ccccc4)cn3)cn2c1 ZINC000551072295 341330930 /nfs/dbraw/zinc/33/09/30/341330930.db2.gz NXUWPVBYLQHGQA-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1cn2ccccc2n1 ZINC000551277409 341336845 /nfs/dbraw/zinc/33/68/45/341336845.db2.gz DBVIMAFTRGQSRS-SNVBAGLBSA-N 1 2 321.758 4.117 20 0 DIADLO O=C(C[NH+]1CCC(CC(F)(F)F)CC1)c1c[nH]c2ccccc12 ZINC000551401750 341340609 /nfs/dbraw/zinc/34/06/09/341340609.db2.gz PCVDKFAHRSGTBC-UHFFFAOYSA-N 1 2 324.346 4.015 20 0 DIADLO Cc1[nH]ncc1C[NH2+]Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC000551536999 341344725 /nfs/dbraw/zinc/34/47/25/341344725.db2.gz XTOOYQMBCYEMKZ-UHFFFAOYSA-N 1 2 311.816 4.328 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)cn1 ZINC000551560594 341345421 /nfs/dbraw/zinc/34/54/21/341345421.db2.gz ZICPQXQNEIHACU-MRXNPFEDSA-N 1 2 315.848 4.375 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)cn1 ZINC000551560594 341345422 /nfs/dbraw/zinc/34/54/22/341345422.db2.gz ZICPQXQNEIHACU-MRXNPFEDSA-N 1 2 315.848 4.375 20 0 DIADLO FC(F)(F)CC1CC[NH+](Cc2cnc(-c3ccccc3)[nH]2)CC1 ZINC000551587045 341346625 /nfs/dbraw/zinc/34/66/25/341346625.db2.gz WJZKWFQSCMKWTF-UHFFFAOYSA-N 1 2 323.362 4.241 20 0 DIADLO CCc1nc(C[N@H+](CC(C)C)[C@H](C)c2ccccc2C)no1 ZINC000551721553 341349928 /nfs/dbraw/zinc/34/99/28/341349928.db2.gz YSAYWLGNXDENMK-OAHLLOKOSA-N 1 2 301.434 4.160 20 0 DIADLO CCc1nc(C[N@@H+](CC(C)C)[C@H](C)c2ccccc2C)no1 ZINC000551721553 341349929 /nfs/dbraw/zinc/34/99/29/341349929.db2.gz YSAYWLGNXDENMK-OAHLLOKOSA-N 1 2 301.434 4.160 20 0 DIADLO Cc1cc(NC(=O)[C@@H](c2cccc(Cl)c2)C(C)C)c(C)c[nH+]1 ZINC000551957757 341356158 /nfs/dbraw/zinc/35/61/58/341356158.db2.gz ACIXSEVYDKDNDC-QGZVFWFLSA-N 1 2 316.832 4.152 20 0 DIADLO CC[C@H]1C[N@@H+]([C@H](C)c2ncc(-c3ccc(Cl)cc3)o2)CCO1 ZINC000246894023 341358309 /nfs/dbraw/zinc/35/83/09/341358309.db2.gz XJIXXPPBVUELEZ-DOMZBBRYSA-N 1 2 320.820 4.167 20 0 DIADLO CC[C@H]1C[N@H+]([C@H](C)c2ncc(-c3ccc(Cl)cc3)o2)CCO1 ZINC000246894023 341358310 /nfs/dbraw/zinc/35/83/10/341358310.db2.gz XJIXXPPBVUELEZ-DOMZBBRYSA-N 1 2 320.820 4.167 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+](C)Cc1ccc(F)c(C)c1 ZINC000552010052 341359971 /nfs/dbraw/zinc/35/99/71/341359971.db2.gz YXDATSISPNZYIT-UHFFFAOYSA-N 1 2 311.404 4.136 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+](C)Cc1ccc(F)c(C)c1 ZINC000552010052 341359972 /nfs/dbraw/zinc/35/99/72/341359972.db2.gz YXDATSISPNZYIT-UHFFFAOYSA-N 1 2 311.404 4.136 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc3ccccc3n2)[C@@H](c2ccccc2)CO1 ZINC000247503435 341365851 /nfs/dbraw/zinc/36/58/51/341365851.db2.gz LXMIKARNWYLISI-IIBYNOLFSA-N 1 2 318.420 4.197 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc3ccccc3n2)[C@@H](c2ccccc2)CO1 ZINC000247503435 341365852 /nfs/dbraw/zinc/36/58/52/341365852.db2.gz LXMIKARNWYLISI-IIBYNOLFSA-N 1 2 318.420 4.197 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+](C)Cc3cccc(O)c3)n2)cc1 ZINC000552080179 341368109 /nfs/dbraw/zinc/36/81/09/341368109.db2.gz HIVZBDYGCPURJN-UHFFFAOYSA-N 1 2 324.449 4.456 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+](C)Cc3cccc(O)c3)n2)cc1 ZINC000552080179 341368110 /nfs/dbraw/zinc/36/81/10/341368110.db2.gz HIVZBDYGCPURJN-UHFFFAOYSA-N 1 2 324.449 4.456 20 0 DIADLO COc1cccc(SCc2[nH+]ccn2Cc2ccccc2)c1 ZINC000247905969 341371063 /nfs/dbraw/zinc/37/10/63/341371063.db2.gz ICSBDFLVEFOKFA-UHFFFAOYSA-N 1 2 310.422 4.232 20 0 DIADLO C[C@H]1C[N@H+](Cc2cncc(Br)c2)[C@H]1c1ccccc1 ZINC000248341814 341375568 /nfs/dbraw/zinc/37/55/68/341375568.db2.gz JEOARSYFUGSIOY-BLLLJJGKSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cncc(Br)c2)[C@H]1c1ccccc1 ZINC000248341814 341375569 /nfs/dbraw/zinc/37/55/69/341375569.db2.gz JEOARSYFUGSIOY-BLLLJJGKSA-N 1 2 317.230 4.037 20 0 DIADLO CC1=CC[C@H](Nc2ccc(Cl)c(C[NH+]3CCOCC3)c2)CC1 ZINC000552215497 341378755 /nfs/dbraw/zinc/37/87/55/341378755.db2.gz HVHFJGPCKYJHQZ-INIZCTEOSA-N 1 2 320.864 4.083 20 0 DIADLO C[C@H](Nc1cccc(OCc2ccc(F)cc2)c1)c1[nH]cc[nH+]1 ZINC000552276615 341383349 /nfs/dbraw/zinc/38/33/49/341383349.db2.gz DKXXYBINASUDEC-ZDUSSCGKSA-N 1 2 311.360 4.301 20 0 DIADLO Cc1ccnc([C@@H](C)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)c1 ZINC000552289698 341384452 /nfs/dbraw/zinc/38/44/52/341384452.db2.gz HNUDJWIQWPWXIF-CYBMUJFWSA-N 1 2 312.804 4.402 20 0 DIADLO Cn1c2ccccc2nc1C[N@@H+]1CC2(CCC2)[C@H]1c1ccccc1 ZINC000552316660 341386014 /nfs/dbraw/zinc/38/60/14/341386014.db2.gz ISCMSCPABRBACH-HXUWFJFHSA-N 1 2 317.436 4.301 20 0 DIADLO Cn1c2ccccc2nc1C[N@H+]1CC2(CCC2)[C@H]1c1ccccc1 ZINC000552316660 341386015 /nfs/dbraw/zinc/38/60/15/341386015.db2.gz ISCMSCPABRBACH-HXUWFJFHSA-N 1 2 317.436 4.301 20 0 DIADLO CC(C)c1noc([C@H](C)[N@@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)n1 ZINC000248791021 341387020 /nfs/dbraw/zinc/38/70/20/341387020.db2.gz NOKORCHLQKSVKS-WDEREUQCSA-N 1 2 319.371 4.164 20 0 DIADLO CC(C)c1noc([C@H](C)[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)n1 ZINC000248791021 341387021 /nfs/dbraw/zinc/38/70/21/341387021.db2.gz NOKORCHLQKSVKS-WDEREUQCSA-N 1 2 319.371 4.164 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)c(F)cc1Br)c1ccco1 ZINC000552333550 341387270 /nfs/dbraw/zinc/38/72/70/341387270.db2.gz IJDBWIJEPYUIFN-QMMMGPOBSA-N 1 2 316.145 4.171 20 0 DIADLO c1cc([C@H]2C[N@H+](C[C@H]3CCC4(CCCCC4)O3)CCO2)cs1 ZINC000248811066 341387352 /nfs/dbraw/zinc/38/73/52/341387352.db2.gz HSKYVQLICORLCB-IAGOWNOFSA-N 1 2 321.486 4.003 20 0 DIADLO c1cc([C@H]2C[N@@H+](C[C@H]3CCC4(CCCCC4)O3)CCO2)cs1 ZINC000248811066 341387353 /nfs/dbraw/zinc/38/73/53/341387353.db2.gz HSKYVQLICORLCB-IAGOWNOFSA-N 1 2 321.486 4.003 20 0 DIADLO Cc1cncc(C[N@H+]2C[C@H](c3ccccc3Cl)OC[C@H]2C)c1 ZINC000248937367 341390306 /nfs/dbraw/zinc/39/03/06/341390306.db2.gz NJOCOKQZDCBARP-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cncc(C[N@@H+]2C[C@H](c3ccccc3Cl)OC[C@H]2C)c1 ZINC000248937367 341390307 /nfs/dbraw/zinc/39/03/07/341390307.db2.gz NJOCOKQZDCBARP-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO Clc1cccc2c(N[C@@H]3CCC[C@H]4OCC[C@@H]43)cc[nH+]c12 ZINC000553148908 341417764 /nfs/dbraw/zinc/41/77/64/341417764.db2.gz KBDOWVJDKXBQJD-DJSGYFEHSA-N 1 2 302.805 4.258 20 0 DIADLO CCN(Cc1c[nH]c2ccccc12)C(=O)Nc1c(C)cc[nH+]c1C ZINC000554386839 341452901 /nfs/dbraw/zinc/45/29/01/341452901.db2.gz JSUOXIDUMNKDDU-UHFFFAOYSA-N 1 2 322.412 4.234 20 0 DIADLO C[C@H]1C[C@H]([NH2+]CC(C)(F)F)c2cccc(Br)c21 ZINC000556230832 341498352 /nfs/dbraw/zinc/49/83/52/341498352.db2.gz ATIPAKFTUKGNNS-KWQFWETISA-N 1 2 304.178 4.242 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2nc3c(s2)C[C@@H](C)CC3)s1 ZINC000152916899 341511440 /nfs/dbraw/zinc/51/14/40/341511440.db2.gz SKIKPDZNBSDQPG-JTQLQIEISA-N 1 2 321.515 4.058 20 0 DIADLO CO[C@H](c1ccccc1)[C@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000565392986 341526118 /nfs/dbraw/zinc/52/61/18/341526118.db2.gz QCUXZUVWXZSUIH-YOEHRIQHSA-N 1 2 305.368 4.144 20 0 DIADLO CCC(CC)N(C(=O)C[C@@H](C)n1cc[nH+]c1)c1cccc(C)c1 ZINC000565540787 341530453 /nfs/dbraw/zinc/53/04/53/341530453.db2.gz FGNWRTDGHLWXED-MRXNPFEDSA-N 1 2 313.445 4.364 20 0 DIADLO CC(C)C[C@@H]1CCC[C@@H](Nc2ccc(Cn3cc[nH+]c3)cn2)C1 ZINC000565565735 341531121 /nfs/dbraw/zinc/53/11/21/341531121.db2.gz GTOXVGRGEVHBJN-FUHWJXTLSA-N 1 2 312.461 4.343 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3cc(C)ccc3C3CC3)ccc2n1C ZINC000566063764 341546788 /nfs/dbraw/zinc/54/67/88/341546788.db2.gz LNFTUMAYLQGNKY-UHFFFAOYSA-N 1 2 319.408 4.320 20 0 DIADLO CC[C@@H](C)Oc1cccc(NC(=O)c2ccn3c(C)c[nH+]c3c2)c1 ZINC000566435957 341558128 /nfs/dbraw/zinc/55/81/28/341558128.db2.gz UTLOQDIJXQQDCI-CQSZACIVSA-N 1 2 323.396 4.072 20 0 DIADLO Cn1ccnc1[C@@H]([NH2+]Cc1ccc(C2CC2)cc1)c1ccccc1 ZINC000567218964 341588995 /nfs/dbraw/zinc/58/89/95/341588995.db2.gz ZRXISPLCDJMFRC-FQEVSTJZSA-N 1 2 317.436 4.177 20 0 DIADLO CCc1cccc(C[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000572904386 341708921 /nfs/dbraw/zinc/70/89/21/341708921.db2.gz FPYKEQRTOLAJOL-AWEZNQCLSA-N 1 2 307.397 4.150 20 0 DIADLO Cc1cccc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)c1Cl ZINC000165597125 341713323 /nfs/dbraw/zinc/71/33/23/341713323.db2.gz IVMPTLWUABMEEB-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1ncncc1[C@@H](C)[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000573107488 341717300 /nfs/dbraw/zinc/71/73/00/341717300.db2.gz WMABAKUUCAQJFB-LLVKDONJSA-N 1 2 322.239 4.432 20 0 DIADLO CCCC[C@H](C)N(CCCC)C(=O)[C@@H]1CCCc2[nH+]c[nH]c21 ZINC000573259391 341722774 /nfs/dbraw/zinc/72/27/74/341722774.db2.gz VOIAQURKQJTKDU-LSDHHAIUSA-N 1 2 305.466 4.037 20 0 DIADLO COc1ccc(-c2ccccc2C)cc1C[NH2+]Cc1cc(C)on1 ZINC000573569709 341732138 /nfs/dbraw/zinc/73/21/38/341732138.db2.gz PUWVYCGZMPDTKB-UHFFFAOYSA-N 1 2 322.408 4.257 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccccc1F ZINC000171121921 341772029 /nfs/dbraw/zinc/77/20/29/341772029.db2.gz SJXBSDZCPBIUCB-LLVKDONJSA-N 1 2 302.374 4.393 20 0 DIADLO c1csc([C@@H](Nc2cc[nH+]c(C3CC3)n2)c2ccccc2)n1 ZINC000171926081 341788023 /nfs/dbraw/zinc/78/80/23/341788023.db2.gz LVELMENSPKOYNX-HNNXBMFYSA-N 1 2 308.410 4.012 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CCCC2)no1)c1ccc(C2CC2)cc1 ZINC000577209069 341897322 /nfs/dbraw/zinc/89/73/22/341897322.db2.gz BFANYXOJHKZCGN-ZDUSSCGKSA-N 1 2 311.429 4.455 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)c2ccc(C(=O)C(C)C)cc2)c(C)[nH+]1 ZINC000577393484 341907839 /nfs/dbraw/zinc/90/78/39/341907839.db2.gz BIZGRWJVSNXCRA-CQSZACIVSA-N 1 2 324.424 4.279 20 0 DIADLO COc1cc(C)[nH+]c(COc2ccc(C(F)(F)F)cc2F)c1 ZINC000577545694 341916817 /nfs/dbraw/zinc/91/68/17/341916817.db2.gz AYQCRQGSEVKISN-UHFFFAOYSA-N 1 2 315.266 4.136 20 0 DIADLO CC(C)C[C@@H]1CCCCCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000577564345 341918208 /nfs/dbraw/zinc/91/82/08/341918208.db2.gz BBFGYXAHCJROQX-INIZCTEOSA-N 1 2 314.433 4.157 20 0 DIADLO COC[C@H]([NH2+]Cc1ccc(-c2ccc(C)cc2)o1)c1ccco1 ZINC000177576624 341921408 /nfs/dbraw/zinc/92/14/08/341921408.db2.gz BNXBRPDQURVXHV-KRWDZBQOSA-N 1 2 311.381 4.325 20 0 DIADLO Clc1oc2ccccc2c1C[NH2+]Cc1cnc(C2CC2)o1 ZINC000577696352 341929649 /nfs/dbraw/zinc/92/96/49/341929649.db2.gz FZZHMSLXPDHYEE-UHFFFAOYSA-N 1 2 302.761 4.241 20 0 DIADLO CC[C@@H](NC(=O)c1ccc(C(C)(C)C)c(Cl)c1)c1[nH]cc[nH+]1 ZINC000577907467 341948016 /nfs/dbraw/zinc/94/80/16/341948016.db2.gz BNVYIOBQQIJSGN-CQSZACIVSA-N 1 2 319.836 4.242 20 0 DIADLO CC[C@H]([NH2+]Cc1cn2cc(C)ccc2n1)c1cc(F)ccc1F ZINC000178725789 341962886 /nfs/dbraw/zinc/96/28/86/341962886.db2.gz VBWHLADZJBTENB-KRWDZBQOSA-N 1 2 315.367 4.162 20 0 DIADLO CC(C)(C)c1csc(C[N@H+](Cc2ccncc2)C2CC2)n1 ZINC000124873842 519079750 /nfs/dbraw/zinc/07/97/50/519079750.db2.gz BRDDVPZCXKFNMQ-UHFFFAOYSA-N 1 2 301.459 4.000 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+](Cc2ccncc2)C2CC2)n1 ZINC000124873842 519079755 /nfs/dbraw/zinc/07/97/55/519079755.db2.gz BRDDVPZCXKFNMQ-UHFFFAOYSA-N 1 2 301.459 4.000 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1ccccc1 ZINC000181799611 519398926 /nfs/dbraw/zinc/39/89/26/519398926.db2.gz ALBQRPUUHNWAII-HNNXBMFYSA-N 1 2 301.434 4.244 20 0 DIADLO CC(C)CCc1nc(C[NH2+][C@@H](C)c2cccc(O)c2)cs1 ZINC000181566431 519697893 /nfs/dbraw/zinc/69/78/93/519697893.db2.gz MJOFWOBQGHJQNA-ZDUSSCGKSA-N 1 2 304.459 4.288 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@H](C)c1cnn(C(C)C)c1)c1ccco1 ZINC000152630923 519755855 /nfs/dbraw/zinc/75/58/55/519755855.db2.gz IMLPCORZOZSPKF-NVXWUHKLSA-N 1 2 319.449 4.122 20 0 DIADLO CC(C)[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1ncnn1C(C)(C)C ZINC000338362565 519801386 /nfs/dbraw/zinc/80/13/86/519801386.db2.gz QDIOYNVCVSQGND-KRWDZBQOSA-N 1 2 318.440 4.001 20 0 DIADLO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ncnn1C(C)(C)C ZINC000338362565 519801387 /nfs/dbraw/zinc/80/13/87/519801387.db2.gz QDIOYNVCVSQGND-KRWDZBQOSA-N 1 2 318.440 4.001 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)no1 ZINC000180291747 519863614 /nfs/dbraw/zinc/86/36/14/519863614.db2.gz AXLNWYVYKWXPDB-QGZVFWFLSA-N 1 2 317.408 4.353 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)no1 ZINC000182428590 519863945 /nfs/dbraw/zinc/86/39/45/519863945.db2.gz SWVRZWUCNWNPRL-JTQLQIEISA-N 1 2 313.323 4.063 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)no1 ZINC000180020899 519864225 /nfs/dbraw/zinc/86/42/25/519864225.db2.gz ZEHKXIIPEBMCCQ-SGIREYDYSA-N 1 2 319.836 4.333 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)no1 ZINC000182428610 519864341 /nfs/dbraw/zinc/86/43/41/519864341.db2.gz SWVRZWUCNWNPRL-SNVBAGLBSA-N 1 2 313.323 4.063 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2)o1 ZINC000267672050 519886300 /nfs/dbraw/zinc/88/63/00/519886300.db2.gz OUNNIKGUCLVGPK-HNNXBMFYSA-N 1 2 303.381 4.059 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2)o1 ZINC000267672050 519886301 /nfs/dbraw/zinc/88/63/01/519886301.db2.gz OUNNIKGUCLVGPK-HNNXBMFYSA-N 1 2 303.381 4.059 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2ccc(C3CCC3)cc2)s1 ZINC000339295091 519887324 /nfs/dbraw/zinc/88/73/24/519887324.db2.gz FLBDUVBLNPSHII-UHFFFAOYSA-N 1 2 301.459 4.219 20 0 DIADLO CC(C)c1noc([C@H](C)[N@H+](C)Cc2ccc(Cl)c(F)c2)n1 ZINC000127695088 519909628 /nfs/dbraw/zinc/90/96/28/519909628.db2.gz IVARPVWHWYFYRY-JTQLQIEISA-N 1 2 311.788 4.179 20 0 DIADLO CC(C)c1noc([C@H](C)[N@@H+](C)Cc2ccc(Cl)c(F)c2)n1 ZINC000127695088 519909632 /nfs/dbraw/zinc/90/96/32/519909632.db2.gz IVARPVWHWYFYRY-JTQLQIEISA-N 1 2 311.788 4.179 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)n1 ZINC000265233994 520003206 /nfs/dbraw/zinc/00/32/06/520003206.db2.gz CWGXZDNPURLSSM-HXUWFJFHSA-N 1 2 323.415 4.482 20 0 DIADLO CC(C)n1cc[nH+]c1CNc1ccc(F)cc1OC(C)(C)C ZINC000270780959 520032703 /nfs/dbraw/zinc/03/27/03/520032703.db2.gz JLRKPEBEBJFMIP-UHFFFAOYSA-N 1 2 305.397 4.393 20 0 DIADLO CC(C)n1nccc1C[N@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000337138570 520101927 /nfs/dbraw/zinc/10/19/27/520101927.db2.gz QTJKQVOYLAKWHO-KDOFPFPSSA-N 1 2 313.445 4.345 20 0 DIADLO CC(C)n1nccc1C[N@@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000337138570 520101931 /nfs/dbraw/zinc/10/19/31/520101931.db2.gz QTJKQVOYLAKWHO-KDOFPFPSSA-N 1 2 313.445 4.345 20 0 DIADLO CCCCC[C@H]([NH2+]Cc1nc([C@H](C)OC)no1)c1ccccc1 ZINC000181744799 520313276 /nfs/dbraw/zinc/31/32/76/520313276.db2.gz GAGPJKLBJGXRQA-HOCLYGCPSA-N 1 2 317.433 4.188 20 0 DIADLO CCCOc1cccc(CNc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000338151842 520456913 /nfs/dbraw/zinc/45/69/13/520456913.db2.gz SIRCVPBMPHIJSK-UHFFFAOYSA-N 1 2 307.397 4.273 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nccn1C(C)C)c1ccc(F)cc1F ZINC000181669565 520786814 /nfs/dbraw/zinc/78/68/14/520786814.db2.gz RCZBQGOQGRELGC-MRXNPFEDSA-N 1 2 307.388 4.373 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+]Cc2ncc(C)o2)cc1OC ZINC000180341919 520897408 /nfs/dbraw/zinc/89/74/08/520897408.db2.gz XRDYAAXNEWXMLN-AWEZNQCLSA-N 1 2 318.417 4.021 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2csc(C3CC3)n2)cc1 ZINC000336835164 520960454 /nfs/dbraw/zinc/96/04/54/520960454.db2.gz IQGIIZGFZJRJJG-UHFFFAOYSA-N 1 2 302.443 4.051 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2csc(C3CC3)n2)cc1 ZINC000336835164 520960462 /nfs/dbraw/zinc/96/04/62/520960462.db2.gz IQGIIZGFZJRJJG-UHFFFAOYSA-N 1 2 302.443 4.051 20 0 DIADLO CCC[C@H]([NH2+]Cc1nnc(C)o1)c1cccc(C(F)(F)F)c1 ZINC000181865802 521166012 /nfs/dbraw/zinc/16/60/12/521166012.db2.gz DFDDFGDCTKBSTR-ZDUSSCGKSA-N 1 2 313.323 4.028 20 0 DIADLO CCCCc1nc(C[N@H+](Cc2ccncc2)C2CC2)cs1 ZINC000180763900 521289913 /nfs/dbraw/zinc/28/99/13/521289913.db2.gz FBWYIWINRQJWQZ-UHFFFAOYSA-N 1 2 301.459 4.045 20 0 DIADLO CCCCc1nc(C[N@@H+](Cc2ccncc2)C2CC2)cs1 ZINC000180763900 521289925 /nfs/dbraw/zinc/28/99/25/521289925.db2.gz FBWYIWINRQJWQZ-UHFFFAOYSA-N 1 2 301.459 4.045 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](C)c2ccc(OC(C)C)cc2)n1 ZINC000182623367 521338750 /nfs/dbraw/zinc/33/87/50/521338750.db2.gz QTROUYBQXAHVPZ-CQSZACIVSA-N 1 2 317.433 4.050 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2ccc(F)c(C)c2)n1 ZINC000267737368 521345961 /nfs/dbraw/zinc/34/59/61/521345961.db2.gz WKAZFEXGVVUDPC-CHWSQXEVSA-N 1 2 305.397 4.272 20 0 DIADLO CC[N@H+](Cc1csc(COc2ccc(C)cc2)n1)C1CC1 ZINC000338384086 521441447 /nfs/dbraw/zinc/44/14/47/521441447.db2.gz NKSKUOSYGLMHHI-UHFFFAOYSA-N 1 2 302.443 4.015 20 0 DIADLO CC[N@@H+](Cc1csc(COc2ccc(C)cc2)n1)C1CC1 ZINC000338384086 521441453 /nfs/dbraw/zinc/44/14/53/521441453.db2.gz NKSKUOSYGLMHHI-UHFFFAOYSA-N 1 2 302.443 4.015 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)no1 ZINC000180020929 521517070 /nfs/dbraw/zinc/51/70/70/521517070.db2.gz NOZTUKKSKRZPQT-FABXCBLPSA-N 1 2 319.836 4.162 20 0 DIADLO CCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1ncc(C)o1 ZINC000181267777 521586143 /nfs/dbraw/zinc/58/61/43/521586143.db2.gz YLFYMDZJPKYBPM-INIZCTEOSA-N 1 2 302.418 4.259 20 0 DIADLO CCCn1c(C)nnc1C[N@@H+]1CCCCC[C@@H]1c1ccc(C)o1 ZINC000159174118 521622197 /nfs/dbraw/zinc/62/21/97/521622197.db2.gz AHTLBZJYAHVJFB-MRXNPFEDSA-N 1 2 316.449 4.015 20 0 DIADLO CCCn1c(C)nnc1C[N@H+]1CCCCC[C@@H]1c1ccc(C)o1 ZINC000159174118 521622202 /nfs/dbraw/zinc/62/22/02/521622202.db2.gz AHTLBZJYAHVJFB-MRXNPFEDSA-N 1 2 316.449 4.015 20 0 DIADLO CCC(CC)n1ccc(C[NH2+]C(C)(C)c2ccccc2OC)n1 ZINC000269646919 521640846 /nfs/dbraw/zinc/64/08/46/521640846.db2.gz HVPFAPGPOANDRZ-UHFFFAOYSA-N 1 2 315.461 4.278 20 0 DIADLO CCOCCC(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000191321985 521676488 /nfs/dbraw/zinc/67/64/88/521676488.db2.gz UWCMKSIRXURYJO-UHFFFAOYSA-N 1 2 300.402 4.032 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)no1 ZINC000181424286 522345063 /nfs/dbraw/zinc/34/50/63/522345063.db2.gz AJGUHEZSQNNDRN-AWEZNQCLSA-N 1 2 307.397 4.150 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)no1 ZINC000181811732 522346564 /nfs/dbraw/zinc/34/65/64/522346564.db2.gz BKRCIZPHBJQIFH-AWEZNQCLSA-N 1 2 323.396 4.275 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CCCOc3ccc(Cl)cc32)cs1 ZINC000156404553 522355789 /nfs/dbraw/zinc/35/57/89/522355789.db2.gz MRKCWUDNGULCER-AWEZNQCLSA-N 1 2 322.861 4.362 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2cnn(C(C)C)c2C)cs1 ZINC000191280811 522452923 /nfs/dbraw/zinc/45/29/23/522452923.db2.gz FWZVFKQMJQGZQM-RYUDHWBXSA-N 1 2 306.479 4.203 20 0 DIADLO CCc1nc([C@H](C)Nc2cc(C(F)(F)F)cc[nH+]2)cs1 ZINC000267426401 522457709 /nfs/dbraw/zinc/45/77/09/522457709.db2.gz VQDAIZWEPIQQFG-QMMMGPOBSA-N 1 2 301.337 4.292 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@H](C)c2ccc(-c3cccnc3)cc2)n1 ZINC000181314360 522915960 /nfs/dbraw/zinc/91/59/60/522915960.db2.gz MWFRGMGHZPVMJE-KGLIPLIRSA-N 1 2 322.412 4.106 20 0 DIADLO CC[C@@H](Nc1ccc(OC2CCC2)c(F)c1)c1[nH+]ccn1C ZINC000180020873 522959004 /nfs/dbraw/zinc/95/90/04/522959004.db2.gz PNLKIKFPIKLLEJ-OAHLLOKOSA-N 1 2 303.381 4.054 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](C)[C@H](C)c2ccccc2C)cs1 ZINC000267024803 523466156 /nfs/dbraw/zinc/46/61/56/523466156.db2.gz LAMQTXVFDZIRDJ-KGLIPLIRSA-N 1 2 304.459 4.352 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](C)[C@H](C)c2ccccc2C)cs1 ZINC000267024803 523466165 /nfs/dbraw/zinc/46/61/65/523466165.db2.gz LAMQTXVFDZIRDJ-KGLIPLIRSA-N 1 2 304.459 4.352 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cs1 ZINC000267050990 523468942 /nfs/dbraw/zinc/46/89/42/523468942.db2.gz QRRNSVQNHLYGJA-BLLLJJGKSA-N 1 2 320.433 4.327 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cs1 ZINC000267050990 523468950 /nfs/dbraw/zinc/46/89/50/523468950.db2.gz QRRNSVQNHLYGJA-BLLLJJGKSA-N 1 2 320.433 4.327 20 0 DIADLO CCn1ccnc1C[NH+]1CCC(F)(c2ccc(Cl)cc2)CC1 ZINC000337254453 523527818 /nfs/dbraw/zinc/52/78/18/523527818.db2.gz QQHZSVALOBWMSW-UHFFFAOYSA-N 1 2 321.827 4.017 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@@H+]2[C@@H](C)c2nc(C(C)C)no2)o1 ZINC000265383653 524037975 /nfs/dbraw/zinc/03/79/75/524037975.db2.gz DFDRGMIFFSYENS-JSGCOSHPSA-N 1 2 303.406 4.247 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@H+]2[C@@H](C)c2nc(C(C)C)no2)o1 ZINC000265383653 524037979 /nfs/dbraw/zinc/03/79/79/524037979.db2.gz DFDRGMIFFSYENS-JSGCOSHPSA-N 1 2 303.406 4.247 20 0 DIADLO COc1cccc([C@@H](C)[NH2+][C@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000267017530 524091721 /nfs/dbraw/zinc/09/17/21/524091721.db2.gz IMALZZDJPCXDJM-CHWSQXEVSA-N 1 2 302.418 4.393 20 0 DIADLO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000124340960 524092243 /nfs/dbraw/zinc/09/22/43/524092243.db2.gz QRSPRMOVRUPPJJ-KGLIPLIRSA-N 1 2 323.396 4.157 20 0 DIADLO C[C@H](CC1CC1)[NH2+]c1ccc(OCc2noc(C3CC3)n2)cc1 ZINC000179852815 524099062 /nfs/dbraw/zinc/09/90/62/524099062.db2.gz HPGBCXKMTVITHV-GFCCVEGCSA-N 1 2 313.401 4.127 20 0 DIADLO C[C@H](CCC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1)c1ccccc1 ZINC000158341693 524114254 /nfs/dbraw/zinc/11/42/54/524114254.db2.gz BQPSFAOSMFXSPZ-NVXWUHKLSA-N 1 2 311.429 4.047 20 0 DIADLO C[C@@H]1CCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)[C@H]1C ZINC000337946793 524213729 /nfs/dbraw/zinc/21/37/29/524213729.db2.gz QBCULAAPNSNVFI-CABCVRRESA-N 1 2 310.397 4.135 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)c(C)c1 ZINC000126421473 524272773 /nfs/dbraw/zinc/27/27/73/524272773.db2.gz RBZORPNUWJPVTQ-LJQANCHMSA-N 1 2 305.425 4.214 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)c(C)c1 ZINC000126421234 524272934 /nfs/dbraw/zinc/27/29/34/524272934.db2.gz RBZORPNUWJPVTQ-IBGZPJMESA-N 1 2 305.425 4.214 20 0 DIADLO C[C@H]1C[N@H+](CC(=O)Nc2c(Cl)cccc2Cl)C(C)(C)C1 ZINC000266912097 524582335 /nfs/dbraw/zinc/58/23/35/524582335.db2.gz DIPXDGUIUMHMST-SNVBAGLBSA-N 1 2 315.244 4.052 20 0 DIADLO C[C@H]1C[N@@H+](CC(=O)Nc2c(Cl)cccc2Cl)C(C)(C)C1 ZINC000266912097 524582346 /nfs/dbraw/zinc/58/23/46/524582346.db2.gz DIPXDGUIUMHMST-SNVBAGLBSA-N 1 2 315.244 4.052 20 0 DIADLO C[C@H](C[C@H](O)c1cccs1)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000128871146 524646292 /nfs/dbraw/zinc/64/62/92/524646292.db2.gz BKJVGKYPARDSNO-KOLCDFICSA-N 1 2 316.348 4.086 20 0 DIADLO Cc1cc(C[N@H+](Cc2cccc(-c3cccnc3)c2)C2CC2)no1 ZINC000136108200 524669923 /nfs/dbraw/zinc/66/99/23/524669923.db2.gz QWYPFEKNEYXWLW-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1cc(C[N@@H+](Cc2cccc(-c3cccnc3)c2)C2CC2)no1 ZINC000136108200 524669934 /nfs/dbraw/zinc/66/99/34/524669934.db2.gz QWYPFEKNEYXWLW-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO C[C@@H]1C[N@H+](CC(=O)Nc2c(Cl)cccc2Cl)C(C)(C)C1 ZINC000266912094 524932288 /nfs/dbraw/zinc/93/22/88/524932288.db2.gz DIPXDGUIUMHMST-JTQLQIEISA-N 1 2 315.244 4.052 20 0 DIADLO C[C@@H]1C[N@@H+](CC(=O)Nc2c(Cl)cccc2Cl)C(C)(C)C1 ZINC000266912094 524932298 /nfs/dbraw/zinc/93/22/98/524932298.db2.gz DIPXDGUIUMHMST-JTQLQIEISA-N 1 2 315.244 4.052 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@@H](C)C[C@@H]2c2ccco2)c(C)[nH+]1 ZINC000162259428 525139307 /nfs/dbraw/zinc/13/93/07/525139307.db2.gz ONNPJIGAZWGUCE-MLGOLLRUSA-N 1 2 313.401 4.297 20 0 DIADLO C[C@@H]1COC[C@H](c2ccccc2)[N@@H+]1Cc1cnc2ccccc2c1 ZINC000337178762 525147586 /nfs/dbraw/zinc/14/75/86/525147586.db2.gz KPQYLWYUEXBSQR-IIBYNOLFSA-N 1 2 318.420 4.197 20 0 DIADLO C[C@@H]1COC[C@H](c2ccccc2)[N@H+]1Cc1cnc2ccccc2c1 ZINC000337178762 525147598 /nfs/dbraw/zinc/14/75/98/525147598.db2.gz KPQYLWYUEXBSQR-IIBYNOLFSA-N 1 2 318.420 4.197 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)C)cs2)c(OC)c1 ZINC000128668869 525157074 /nfs/dbraw/zinc/15/70/74/525157074.db2.gz SQCDEJQLKPXBGY-GFCCVEGCSA-N 1 2 320.458 4.135 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncc(C(C)(C)C)o2)cc1 ZINC000267093630 525160487 /nfs/dbraw/zinc/16/04/87/525160487.db2.gz XQDVVJBLXRPRGU-OLZOCXBDSA-N 1 2 302.418 4.393 20 0 DIADLO Cc1ccc(NC(=O)[C@H]2CCCC[C@H]2C(F)(F)F)c(C)[nH+]1 ZINC000268031074 525221554 /nfs/dbraw/zinc/22/15/54/525221554.db2.gz XRSMWGISQCTQAV-NWDGAFQWSA-N 1 2 300.324 4.006 20 0 DIADLO Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1noc(-c2ccccc2)n1 ZINC000124422494 525362152 /nfs/dbraw/zinc/36/21/52/525362152.db2.gz IIBNAJRTICDVJP-HUUCEWRRSA-N 1 2 307.397 4.457 20 0 DIADLO Cc1cc(SC(C)(C)C)ccc1NC(=O)CCn1cc[nH+]c1 ZINC000263667102 525431481 /nfs/dbraw/zinc/43/14/81/525431481.db2.gz DUFGSOIHNVZSQV-UHFFFAOYSA-N 1 2 317.458 4.111 20 0 DIADLO C[C@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1cccnc1 ZINC000181663487 525483546 /nfs/dbraw/zinc/48/35/46/525483546.db2.gz GNYBTJACHRVISP-ZDUSSCGKSA-N 1 2 301.459 4.437 20 0 DIADLO C[C@H]([NH2+]Cc1nccs1)c1cc(Cl)ccc1OC(F)F ZINC000128207647 525492875 /nfs/dbraw/zinc/49/28/75/525492875.db2.gz MLSLQYICBYAIQJ-QMMMGPOBSA-N 1 2 318.776 4.249 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2coc(-c3cccs3)n2)o1 ZINC000237469300 525509425 /nfs/dbraw/zinc/50/94/25/525509425.db2.gz GMJJSQBYWGITTA-BXUZGUMPSA-N 1 2 314.410 4.409 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)C(C)C ZINC000118839648 525549074 /nfs/dbraw/zinc/54/90/74/525549074.db2.gz MCBHONIPCMOSBU-INIZCTEOSA-N 1 2 301.434 4.162 20 0 DIADLO Cc1cccnc1[C@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)C(C)C ZINC000118839395 525556643 /nfs/dbraw/zinc/55/66/43/525556643.db2.gz QAWPKNODNKCOGC-UONOGXRCSA-N 1 2 316.449 4.118 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2cc(C(F)(F)F)ccc2o1)c1cccnc1 ZINC000182886643 525558498 /nfs/dbraw/zinc/55/84/98/525558498.db2.gz PCZZQIOHNHBZQT-SNVBAGLBSA-N 1 2 321.302 4.092 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2ccccc21)c1noc(-c2ccccc2)n1 ZINC000124454554 525613893 /nfs/dbraw/zinc/61/38/93/525613893.db2.gz XQAFSRGTGDHRFS-KSSFIOAISA-N 1 2 319.408 4.465 20 0 DIADLO C[C@@H]([NH2+]c1ccc(OCc2noc(C3CC3)n2)cc1)C1CCC1 ZINC000179853795 525709617 /nfs/dbraw/zinc/70/96/17/525709617.db2.gz ALJJWGANBJOIEV-GFCCVEGCSA-N 1 2 313.401 4.127 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000124490683 525742728 /nfs/dbraw/zinc/74/27/28/525742728.db2.gz AEPZZPATXKTQAF-CABCVRRESA-N 1 2 307.397 4.457 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3ccncc3F)cs2)o1 ZINC000338374174 525814941 /nfs/dbraw/zinc/81/49/41/525814941.db2.gz SNPQKLFYSYRCMC-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000124490837 525937501 /nfs/dbraw/zinc/93/75/01/525937501.db2.gz AEPZZPATXKTQAF-GJZGRUSLSA-N 1 2 307.397 4.457 20 0 DIADLO Cc1cn2cc(NC(=O)Cc3csc4ccccc34)ccc2[nH+]1 ZINC000339272534 525946976 /nfs/dbraw/zinc/94/69/76/525946976.db2.gz VXISTCHSBGSWMC-UHFFFAOYSA-N 1 2 321.405 4.039 20 0 DIADLO Cc1ccc(Br)cc1NCc1[nH+]ccn1C(C)C ZINC000124116439 525987237 /nfs/dbraw/zinc/98/72/37/525987237.db2.gz VOTWLKYOGRABSJ-UHFFFAOYSA-N 1 2 308.223 4.147 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccc(F)cc2F)C2CCCC2)o1 ZINC000266744665 526009983 /nfs/dbraw/zinc/00/99/83/526009983.db2.gz OFZUFEPZQOLGHZ-UHFFFAOYSA-N 1 2 306.356 4.206 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccc(F)cc2F)C2CCCC2)o1 ZINC000266744665 526009996 /nfs/dbraw/zinc/00/99/96/526009996.db2.gz OFZUFEPZQOLGHZ-UHFFFAOYSA-N 1 2 306.356 4.206 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccccc2OC2CCCC2)s1 ZINC000266145881 526040516 /nfs/dbraw/zinc/04/05/16/526040516.db2.gz IUCXQZBFHIOVKU-UHFFFAOYSA-N 1 2 302.443 4.063 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+][C@H](CO)c2c(F)cccc2F)cc1 ZINC000266797727 526064096 /nfs/dbraw/zinc/06/40/96/526064096.db2.gz RBCHIALYVNUVOU-BDJLRTHQSA-N 1 2 323.408 4.071 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](Cc1cnc[nH]1)C1CC1 ZINC000180031473 526068797 /nfs/dbraw/zinc/06/87/97/526068797.db2.gz DVZOPCXEAZMMRR-NSHDSACASA-N 1 2 309.335 4.154 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](Cc1cnc[nH]1)C1CC1 ZINC000180031473 526068805 /nfs/dbraw/zinc/06/88/05/526068805.db2.gz DVZOPCXEAZMMRR-NSHDSACASA-N 1 2 309.335 4.154 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1csc(C2CCCC2)n1 ZINC000129363765 526113332 /nfs/dbraw/zinc/11/33/32/526113332.db2.gz FWAMBQAKEHSOGD-ZDUSSCGKSA-N 1 2 301.459 4.389 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1csc(C2CCCC2)n1 ZINC000129363765 526113335 /nfs/dbraw/zinc/11/33/35/526113335.db2.gz FWAMBQAKEHSOGD-ZDUSSCGKSA-N 1 2 301.459 4.389 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000127839379 526132783 /nfs/dbraw/zinc/13/27/83/526132783.db2.gz NOWBOYBEVQXMQU-GFCCVEGCSA-N 1 2 316.355 4.019 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000127839379 526132790 /nfs/dbraw/zinc/13/27/90/526132790.db2.gz NOWBOYBEVQXMQU-GFCCVEGCSA-N 1 2 316.355 4.019 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+](C)Cc1ccc(Cl)nc1 ZINC000181135640 526177685 /nfs/dbraw/zinc/17/76/85/526177685.db2.gz JDLMHFIIQFRTPH-LLVKDONJSA-N 1 2 301.777 4.069 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000181135640 526177692 /nfs/dbraw/zinc/17/76/92/526177692.db2.gz JDLMHFIIQFRTPH-LLVKDONJSA-N 1 2 301.777 4.069 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+]Cc1nc(C2CCCC2)no1 ZINC000337381769 526184726 /nfs/dbraw/zinc/18/47/26/526184726.db2.gz UYDNCDMIZSJOLW-GFCCVEGCSA-N 1 2 317.458 4.300 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)C(C)(C)c1ccc(Cl)cc1F ZINC000191560445 526236642 /nfs/dbraw/zinc/23/66/42/526236642.db2.gz KFPLBGYYIAEFAL-UHFFFAOYSA-N 1 2 306.768 4.099 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@H](C)Sc1ccc(Cl)cc1 ZINC000107286120 526239894 /nfs/dbraw/zinc/23/98/94/526239894.db2.gz ABHNKTHJJSWTRW-NSHDSACASA-N 1 2 306.818 4.163 20 0 DIADLO Cc1coc2ccc(NC(=O)N3CCCC[C@@H]3c3[nH]cc[nH+]3)cc12 ZINC000187958728 526293896 /nfs/dbraw/zinc/29/38/96/526293896.db2.gz BPCPSQQOMSFWRF-OAHLLOKOSA-N 1 2 324.384 4.223 20 0 DIADLO Cc1csc(C2([NH2+][C@@H](C)c3cc(F)ccc3F)CCC2)n1 ZINC000264824122 526325737 /nfs/dbraw/zinc/32/57/37/526325737.db2.gz BFMUISMFMOKNEP-NSHDSACASA-N 1 2 308.397 4.460 20 0 DIADLO Cc1csc(C2([NH2+][C@H](C)c3c(F)cccc3F)CCC2)n1 ZINC000264909321 526328752 /nfs/dbraw/zinc/32/87/52/526328752.db2.gz YOHBUVCEQUQPSX-LLVKDONJSA-N 1 2 308.397 4.460 20 0 DIADLO Cc1nnc(C[N@@H+](C)[C@H](c2ccccc2Cl)C(C)C)s1 ZINC000358492853 526333392 /nfs/dbraw/zinc/33/33/92/526333392.db2.gz BLOGUCWPNOASJK-HNNXBMFYSA-N 1 2 309.866 4.329 20 0 DIADLO Cc1nnc(C[N@H+](C)[C@H](c2ccccc2Cl)C(C)C)s1 ZINC000358492853 526333394 /nfs/dbraw/zinc/33/33/94/526333394.db2.gz BLOGUCWPNOASJK-HNNXBMFYSA-N 1 2 309.866 4.329 20 0 DIADLO Oc1cccc(C[NH2+]Cc2csc(-c3ccco3)n2)c1Cl ZINC000339304203 526361505 /nfs/dbraw/zinc/36/15/05/526361505.db2.gz SFPHGZFGGKAHFO-UHFFFAOYSA-N 1 2 320.801 4.052 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@@H+]1Cc3cnn(-c4ccccc4)c3C1)CC2 ZINC000339804358 526373386 /nfs/dbraw/zinc/37/33/86/526373386.db2.gz QIGMQGZWEATUSL-LJQANCHMSA-N 1 2 319.383 4.015 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@H+]1Cc3cnn(-c4ccccc4)c3C1)CC2 ZINC000339804358 526373391 /nfs/dbraw/zinc/37/33/91/526373391.db2.gz QIGMQGZWEATUSL-LJQANCHMSA-N 1 2 319.383 4.015 20 0 DIADLO c1c[nH]c([C@H]([NH2+][C@@H]2CCCc3sccc32)c2ccccc2)n1 ZINC000129723131 526409762 /nfs/dbraw/zinc/40/97/62/526409762.db2.gz LHRHBTRMLUWZDT-NVXWUHKLSA-N 1 2 309.438 4.228 20 0 DIADLO Cc1csc([C@@H]2CCCC[N@H+]2Cc2nc(C)sc2C)n1 ZINC000336824798 526417892 /nfs/dbraw/zinc/41/78/92/526417892.db2.gz WDMANPAIBBYZGJ-AWEZNQCLSA-N 1 2 307.488 4.252 20 0 DIADLO Cc1csc([C@@H]2CCCC[N@@H+]2Cc2nc(C)sc2C)n1 ZINC000336824798 526417895 /nfs/dbraw/zinc/41/78/95/526417895.db2.gz WDMANPAIBBYZGJ-AWEZNQCLSA-N 1 2 307.488 4.252 20 0 DIADLO c1ccc(C2([NH2+]Cc3noc(C4CCCCC4)n3)CCC2)cc1 ZINC000157399631 526461545 /nfs/dbraw/zinc/46/15/45/526461545.db2.gz UPKWCLKSYLBEJR-UHFFFAOYSA-N 1 2 311.429 4.286 20 0 DIADLO Cc1cscc1CNC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000338033952 526466902 /nfs/dbraw/zinc/46/69/02/526466902.db2.gz FCYSLAAMKGEPHY-UHFFFAOYSA-N 1 2 324.405 4.174 20 0 DIADLO Cc1noc(C)c1C[N@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000339247483 526501501 /nfs/dbraw/zinc/50/15/01/526501501.db2.gz SEGBSNIZTSJYFT-UHFFFAOYSA-N 1 2 310.397 4.395 20 0 DIADLO Cc1noc(C)c1C[N@@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000339247483 526501507 /nfs/dbraw/zinc/50/15/07/526501507.db2.gz SEGBSNIZTSJYFT-UHFFFAOYSA-N 1 2 310.397 4.395 20 0 DIADLO c1csc(C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)n1 ZINC000129844536 526581384 /nfs/dbraw/zinc/58/13/84/526581384.db2.gz AHCHCNGENKHDBJ-OAHLLOKOSA-N 1 2 314.454 4.459 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000127882205 526740140 /nfs/dbraw/zinc/74/01/40/526740140.db2.gz JNMIRDTYHNPALX-AWEZNQCLSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+](C)[C@@H](C)c1cccnc1 ZINC000127882205 526740143 /nfs/dbraw/zinc/74/01/43/526740143.db2.gz JNMIRDTYHNPALX-AWEZNQCLSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2csc(C3CC3)n2)s1 ZINC000162958521 526742392 /nfs/dbraw/zinc/74/23/92/526742392.db2.gz QJDJQRLHNWPNFD-SNVBAGLBSA-N 1 2 307.488 4.287 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2csc(C3CC3)n2)s1 ZINC000162958521 526742401 /nfs/dbraw/zinc/74/24/01/526742401.db2.gz QJDJQRLHNWPNFD-SNVBAGLBSA-N 1 2 307.488 4.287 20 0 DIADLO Cc1nc(C)c([C@@H](C)[NH2+][C@H](c2nc(C3CC3)no2)C(C)C)s1 ZINC000180852547 526747168 /nfs/dbraw/zinc/74/71/68/526747168.db2.gz WFNIIFMVJCRGMB-MFKMUULPSA-N 1 2 320.462 4.068 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@@](F)(c3cc(C)cc(F)c3)C2)c(C)s1 ZINC000337376361 526868752 /nfs/dbraw/zinc/86/87/52/526868752.db2.gz AFRWTTXBUMPKTL-KRWDZBQOSA-N 1 2 322.424 4.278 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@@](F)(c3cc(C)cc(F)c3)C2)c(C)s1 ZINC000337376361 526868759 /nfs/dbraw/zinc/86/87/59/526868759.db2.gz AFRWTTXBUMPKTL-KRWDZBQOSA-N 1 2 322.424 4.278 20 0 DIADLO Cc1nc(C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)cs1 ZINC000182521449 526893242 /nfs/dbraw/zinc/89/32/42/526893242.db2.gz SPZQJZJTBUEEQU-CQSZACIVSA-N 1 2 308.834 4.108 20 0 DIADLO Cc1nc(COc2ccc([NH2+][C@H]3CCC34CCCC4)cc2)no1 ZINC000189211898 526908670 /nfs/dbraw/zinc/90/86/70/526908670.db2.gz JEUZFUGKVZIAKE-INIZCTEOSA-N 1 2 313.401 4.092 20 0 DIADLO Clc1ccc(C2([NH2+][C@@H]3CCCc4[nH]ncc43)CC2)cc1Cl ZINC000368607942 526941482 /nfs/dbraw/zinc/94/14/82/526941482.db2.gz JSAKRVZVPPMNHT-CQSZACIVSA-N 1 2 322.239 4.373 20 0 DIADLO Cc1[nH+]c2cc(CNC(=O)CC3=CCCCC3)ccc2n1C1CC1 ZINC000339289464 527118689 /nfs/dbraw/zinc/11/86/89/527118689.db2.gz DDOZRQCIIDGNBW-UHFFFAOYSA-N 1 2 323.440 4.186 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3coc(C4CCCCC4)n3)cc2[nH+]1 ZINC000338339440 527147144 /nfs/dbraw/zinc/14/71/44/527147144.db2.gz QPXHOOPBUYDTMG-UHFFFAOYSA-N 1 2 324.384 4.159 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)c1sccc1F ZINC000339544420 527252974 /nfs/dbraw/zinc/25/29/74/527252974.db2.gz CQZFVXRDAKNCTK-UHFFFAOYSA-N 1 2 314.341 4.327 20 0 DIADLO Cc1ncc(CNc2ccc(C3CCC3)c[nH+]2)n1-c1ccccc1 ZINC000339566501 527280601 /nfs/dbraw/zinc/28/06/01/527280601.db2.gz XTVPRCNQNRZXFB-UHFFFAOYSA-N 1 2 318.424 4.455 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000266922369 527404444 /nfs/dbraw/zinc/40/44/44/527404444.db2.gz IXIPMLDEOCVMHJ-HNNXBMFYSA-N 1 2 301.434 4.038 20 0 DIADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000266922369 527404445 /nfs/dbraw/zinc/40/44/45/527404445.db2.gz IXIPMLDEOCVMHJ-HNNXBMFYSA-N 1 2 301.434 4.038 20 0 DIADLO Cn1cc[nH+]c1[C@@H](Nc1cccc(-c2nccs2)c1)C1CC1 ZINC000128965126 527454116 /nfs/dbraw/zinc/45/41/16/527454116.db2.gz KTWKNIQVBDKNQL-HNNXBMFYSA-N 1 2 310.426 4.107 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCC[N@@H+]2Cc2cncnc2)c1 ZINC000364883734 527686558 /nfs/dbraw/zinc/68/65/58/527686558.db2.gz VEADBPDPYIIPBI-MRXNPFEDSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCC[N@H+]2Cc2cncnc2)c1 ZINC000364883734 527686561 /nfs/dbraw/zinc/68/65/61/527686561.db2.gz VEADBPDPYIIPBI-MRXNPFEDSA-N 1 2 321.346 4.223 20 0 DIADLO CC(C)c1nnc(C[N@H+](CCc2cccc(F)c2)C2CC2)s1 ZINC000297527767 534969356 /nfs/dbraw/zinc/96/93/56/534969356.db2.gz OYVBOPXWCQSVKF-UHFFFAOYSA-N 1 2 319.449 4.008 20 0 DIADLO CC(C)c1nnc(C[N@@H+](CCc2cccc(F)c2)C2CC2)s1 ZINC000297527767 534969360 /nfs/dbraw/zinc/96/93/60/534969360.db2.gz OYVBOPXWCQSVKF-UHFFFAOYSA-N 1 2 319.449 4.008 20 0 DIADLO CCCC(=O)Nc1cccc(N[C@H]2C[C@H](C)n3cc[nH+]c32)c1C ZINC000297126743 535352626 /nfs/dbraw/zinc/35/26/26/535352626.db2.gz YSFIAPXXTJEMET-LRDDRELGSA-N 1 2 312.417 4.048 20 0 DIADLO CCOC1CC2(C1)CCN(c1cc(C)[nH+]c3c(F)cccc13)C2 ZINC000286214888 535399361 /nfs/dbraw/zinc/39/93/61/535399361.db2.gz BRHJUYOTLJXLDS-UHFFFAOYSA-N 1 2 314.404 4.078 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1nc(C)cs1 ZINC000285081707 535805286 /nfs/dbraw/zinc/80/52/86/535805286.db2.gz PRKHPRSJWQKIHF-OAHLLOKOSA-N 1 2 313.426 4.347 20 0 DIADLO CC[C@H](c1cccc(OC)c1)N(C)C(=O)Nc1cc[nH+]c(C)c1 ZINC000288898438 536062613 /nfs/dbraw/zinc/06/26/13/536062613.db2.gz RWSRBJQRFGPPOY-QGZVFWFLSA-N 1 2 313.401 4.014 20 0 DIADLO COc1ccc([NH2+]C[C@H]2CC(C)=C[C@H](C)C2)cc1NC(C)=O ZINC000289428071 536815694 /nfs/dbraw/zinc/81/56/94/536815694.db2.gz DJBNJSNAWRRBID-SWLSCSKDSA-N 1 2 302.418 4.058 20 0 DIADLO COCC[C@H]([NH2+][C@H](C)c1csc(C(C)C)n1)c1ccco1 ZINC000274428568 536819087 /nfs/dbraw/zinc/81/90/87/536819087.db2.gz JMWIXBWRPKNXIQ-OLZOCXBDSA-N 1 2 308.447 4.288 20 0 DIADLO COc1ccc2ccccc2c1C[NH2+]Cc1noc2c1CCCC2 ZINC000288427110 537043289 /nfs/dbraw/zinc/04/32/89/537043289.db2.gz KMWNCWKLGBVODA-UHFFFAOYSA-N 1 2 322.408 4.005 20 0 DIADLO CC(C)CCOCC[N@@H+]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001167629497 1038993259 /nfs/dbraw/zinc/99/32/59/1038993259.db2.gz LDURKKKJXVBVOQ-UHFFFAOYSA-N 1 2 316.272 4.414 20 0 DIADLO CC(C)CCOCC[N@H+]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001167629497 1038993279 /nfs/dbraw/zinc/99/32/79/1038993279.db2.gz LDURKKKJXVBVOQ-UHFFFAOYSA-N 1 2 316.272 4.414 20 0 DIADLO CCCCC1CC[NH+](Cc2cnc(Br)s2)CC1 ZINC001139912429 1046551757 /nfs/dbraw/zinc/55/17/57/1046551757.db2.gz LYBXFSIWKQHDFR-UHFFFAOYSA-N 1 2 317.296 4.308 20 0 DIADLO Cc1cc(C[N@H+]2CC=C(C(C)(C)C)CC2)cnc1Br ZINC001193020939 1049167197 /nfs/dbraw/zinc/16/71/97/1049167197.db2.gz FJRJIHWYUQNAEY-UHFFFAOYSA-N 1 2 323.278 4.331 20 0 DIADLO Cc1cc(C[N@@H+]2CC=C(C(C)(C)C)CC2)cnc1Br ZINC001193020939 1049167206 /nfs/dbraw/zinc/16/72/06/1049167206.db2.gz FJRJIHWYUQNAEY-UHFFFAOYSA-N 1 2 323.278 4.331 20 0 DIADLO C[C@@H]1C[NH+](Cc2ccc(Cl)nc2Cl)C[C@@H](C)C1(F)F ZINC000859413776 1049331344 /nfs/dbraw/zinc/33/13/44/1049331344.db2.gz BRQAPZQMEVTWGB-RKDXNWHRSA-N 1 2 309.187 4.112 20 0 DIADLO C[N@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)Cc1ccncn1 ZINC001235598051 1054752111 /nfs/dbraw/zinc/75/21/11/1054752111.db2.gz OLVLPNBFFWLCDG-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO C[N@@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)Cc1ccncn1 ZINC001235598051 1054752131 /nfs/dbraw/zinc/75/21/31/1054752131.db2.gz OLVLPNBFFWLCDG-UHFFFAOYSA-N 1 2 316.619 4.069 20 0 DIADLO CCC(CC)C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000044568505 1035506098 /nfs/dbraw/zinc/50/60/98/1035506098.db2.gz FGZOCOOIKOTZJS-UHFFFAOYSA-N 1 2 311.429 4.261 20 0 DIADLO CC[N@H+](Cc1nc([C@@H](c2ccc(C)cc2)C(C)C)no1)C1CC1 ZINC000579774166 1035581136 /nfs/dbraw/zinc/58/11/36/1035581136.db2.gz IOBRUMCOZLAKGK-GOSISDBHSA-N 1 2 313.445 4.150 20 0 DIADLO CC[N@@H+](Cc1nc([C@@H](c2ccc(C)cc2)C(C)C)no1)C1CC1 ZINC000579774166 1035581150 /nfs/dbraw/zinc/58/11/50/1035581150.db2.gz IOBRUMCOZLAKGK-GOSISDBHSA-N 1 2 313.445 4.150 20 0 DIADLO CCCCC[N@H+](Cc1nc(C2CC2)no1)Cc1ccc(F)cc1 ZINC000045004080 1035660758 /nfs/dbraw/zinc/66/07/58/1035660758.db2.gz LVAUPAAINCTMEV-UHFFFAOYSA-N 1 2 317.408 4.279 20 0 DIADLO CCCCC[N@@H+](Cc1nc(C2CC2)no1)Cc1ccc(F)cc1 ZINC000045004080 1035660766 /nfs/dbraw/zinc/66/07/66/1035660766.db2.gz LVAUPAAINCTMEV-UHFFFAOYSA-N 1 2 317.408 4.279 20 0 DIADLO Cc1cc(C)c(Nc2ccc(Br)nc2Cl)c[nH+]1 ZINC001213505964 1035662563 /nfs/dbraw/zinc/66/25/63/1035662563.db2.gz WETBPQQRJOLZOB-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO CC(C)c1ccc(CCC(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC000607715042 1035691164 /nfs/dbraw/zinc/69/11/64/1035691164.db2.gz INCBCQJMRHBSCG-UHFFFAOYSA-N 1 2 307.397 4.029 20 0 DIADLO Cc1ccc2cc(NCc3ccc(-c4ncon4)cc3)[nH+]cc2c1 ZINC001167064838 1035698475 /nfs/dbraw/zinc/69/84/75/1035698475.db2.gz DUBMLCSZSJKWIC-UHFFFAOYSA-N 1 2 316.364 4.205 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2nc3ccc(F)cc3s2)o1 ZINC000683200511 1035720713 /nfs/dbraw/zinc/72/07/13/1035720713.db2.gz APVUIOUCGVNXFB-GXFFZTMASA-N 1 2 316.401 4.442 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@H+](C)Cc2cccs2)cc1 ZINC000007846591 1035739233 /nfs/dbraw/zinc/73/92/33/1035739233.db2.gz AMDWMNPQISXHNU-CQSZACIVSA-N 1 2 316.470 4.332 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@@H+](C)Cc2cccs2)cc1 ZINC000007846591 1035739242 /nfs/dbraw/zinc/73/92/42/1035739242.db2.gz AMDWMNPQISXHNU-CQSZACIVSA-N 1 2 316.470 4.332 20 0 DIADLO CCn1ccnc1C[N@@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC000339608075 1035810761 /nfs/dbraw/zinc/81/07/61/1035810761.db2.gz ROLMQKDXDRJWNX-NRFANRHFSA-N 1 2 317.436 4.051 20 0 DIADLO CCn1ccnc1C[N@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC000339608075 1035810780 /nfs/dbraw/zinc/81/07/80/1035810780.db2.gz ROLMQKDXDRJWNX-NRFANRHFSA-N 1 2 317.436 4.051 20 0 DIADLO Clc1cccc(Cl)c1C1CC[NH+](Cc2cccnn2)CC1 ZINC001139970273 1035864176 /nfs/dbraw/zinc/86/41/76/1035864176.db2.gz QTDRUBKWHYESNO-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Cc1ccccc1C[N@H+](Cc1cncs1)Cc1cccnc1 ZINC000349063610 1035877470 /nfs/dbraw/zinc/87/74/70/1035877470.db2.gz QXRWFKISBSACMT-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1ccccc1C[N@@H+](Cc1cncs1)Cc1cccnc1 ZINC000349063610 1035877476 /nfs/dbraw/zinc/87/74/76/1035877476.db2.gz QXRWFKISBSACMT-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO CCC[C@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccccn1 ZINC000179464773 1035879525 /nfs/dbraw/zinc/87/95/25/1035879525.db2.gz LVUNTWOXJDWFJT-AWEZNQCLSA-N 1 2 313.426 4.429 20 0 DIADLO O=C(c1ccc(-n2cc[nH+]c2)cc1)N1CCC[C@@H]1CC1CCCC1 ZINC000655365837 1035889412 /nfs/dbraw/zinc/88/94/12/1035889412.db2.gz AXQDRHLMWJSFPF-LJQANCHMSA-N 1 2 323.440 4.057 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc(-c2ccncc2)cc1F ZINC000179564085 1035895982 /nfs/dbraw/zinc/89/59/82/1035895982.db2.gz FXJSLEFIJBOJPO-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccc(-c2ccncc2)cc1F ZINC000179564085 1035896001 /nfs/dbraw/zinc/89/60/01/1035896001.db2.gz FXJSLEFIJBOJPO-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO CC(C)[N@H+](Cc1cccnn1)Cc1ccc(Cl)cc1Cl ZINC001139973818 1035896303 /nfs/dbraw/zinc/89/63/03/1035896303.db2.gz KTMQRKKLBDIMSH-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO CC(C)[N@@H+](Cc1cccnn1)Cc1ccc(Cl)cc1Cl ZINC001139973818 1035896326 /nfs/dbraw/zinc/89/63/26/1035896326.db2.gz KTMQRKKLBDIMSH-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc(-c2ccncc2)cc1F ZINC000179564096 1035898508 /nfs/dbraw/zinc/89/85/08/1035898508.db2.gz FXJSLEFIJBOJPO-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccc(-c2ccncc2)cc1F ZINC000179564096 1035898531 /nfs/dbraw/zinc/89/85/31/1035898531.db2.gz FXJSLEFIJBOJPO-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO Cc1nc([C@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)cs1 ZINC000036988694 1035916959 /nfs/dbraw/zinc/91/69/59/1035916959.db2.gz LYXWLHNSHBEAHY-LBPRGKRZSA-N 1 2 302.447 4.010 20 0 DIADLO Cc1nccnc1C[NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl ZINC000621325724 1035953234 /nfs/dbraw/zinc/95/32/34/1035953234.db2.gz ILDIXHIPNJMUFR-QMMMGPOBSA-N 1 2 314.191 4.082 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)cc1Cl)c1nc2ccccc2n1C ZINC000120224991 1036084483 /nfs/dbraw/zinc/08/44/83/1036084483.db2.gz RFCMHQXVDPEJLV-NSHDSACASA-N 1 2 317.795 4.217 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)c1c(Cl)cc(F)cc1Cl ZINC000683318194 1036123681 /nfs/dbraw/zinc/12/36/81/1036123681.db2.gz GLUITDPEOPLDMQ-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1ccc(Cl)s1 ZINC001204443142 1036185227 /nfs/dbraw/zinc/18/52/27/1036185227.db2.gz RVTVONJLGBIGQY-UHFFFAOYSA-N 1 2 307.846 4.495 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1ccc(Cl)s1 ZINC001204443142 1036185234 /nfs/dbraw/zinc/18/52/34/1036185234.db2.gz RVTVONJLGBIGQY-UHFFFAOYSA-N 1 2 307.846 4.495 20 0 DIADLO Clc1scc(CN2CCC[C@@H](n3cc[nH+]c3)C2)c1Cl ZINC000683352918 1036197169 /nfs/dbraw/zinc/19/71/69/1036197169.db2.gz MWGORRTVAMRLIC-LLVKDONJSA-N 1 2 316.257 4.089 20 0 DIADLO Fc1ccc(COC2CC[NH+](C/C(Cl)=C/Cl)CC2)cc1 ZINC000091889635 1036203958 /nfs/dbraw/zinc/20/39/58/1036203958.db2.gz FKORGRRHDKQTPH-LCYFTJDESA-N 1 2 318.219 4.126 20 0 DIADLO CCC[N@H+](CCc1ccc(OC(F)(F)F)cc1)CC(F)F ZINC001167268251 1036350618 /nfs/dbraw/zinc/35/06/18/1036350618.db2.gz YWPWXTGKMFLFFL-UHFFFAOYSA-N 1 2 311.294 4.105 20 0 DIADLO CCC[N@@H+](CCc1ccc(OC(F)(F)F)cc1)CC(F)F ZINC001167268251 1036350633 /nfs/dbraw/zinc/35/06/33/1036350633.db2.gz YWPWXTGKMFLFFL-UHFFFAOYSA-N 1 2 311.294 4.105 20 0 DIADLO Clc1oc2ccccc2c1C[N@@H+]1CCOc2ccccc2C1 ZINC001167270954 1036353907 /nfs/dbraw/zinc/35/39/07/1036353907.db2.gz QIWFCZIXISKEBY-UHFFFAOYSA-N 1 2 313.784 4.481 20 0 DIADLO Clc1oc2ccccc2c1C[N@H+]1CCOc2ccccc2C1 ZINC001167270954 1036353920 /nfs/dbraw/zinc/35/39/20/1036353920.db2.gz QIWFCZIXISKEBY-UHFFFAOYSA-N 1 2 313.784 4.481 20 0 DIADLO O=C(Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)[C@@H]1CC12CCC2 ZINC000683454688 1036425421 /nfs/dbraw/zinc/42/54/21/1036425421.db2.gz MHXZVZUBSASPOT-KRWDZBQOSA-N 1 2 321.424 4.015 20 0 DIADLO O=C(Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)[C@H]1CC12CCC2 ZINC000683454691 1036425509 /nfs/dbraw/zinc/42/55/09/1036425509.db2.gz MHXZVZUBSASPOT-QGZVFWFLSA-N 1 2 321.424 4.015 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2cc(O)ccc2Cl)C2CC2)s1 ZINC000625321171 1036501580 /nfs/dbraw/zinc/50/15/80/1036501580.db2.gz ZSYOROLVLDAIMZ-CQSZACIVSA-N 1 2 308.834 4.051 20 0 DIADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@@H]1CCCn2ccnc21 ZINC000655760899 1036526473 /nfs/dbraw/zinc/52/64/73/1036526473.db2.gz AHJNUPXWNLPXOH-HUUCEWRRSA-N 1 2 323.362 4.310 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@@H]3CC[C@@H](C)SC3)cc2)c1C ZINC000655776818 1036534043 /nfs/dbraw/zinc/53/40/43/1036534043.db2.gz PICLZIUGNZFTQW-MLGOLLRUSA-N 1 2 301.459 4.185 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)CC2CCCCC2)c(N(C)C)[nH+]1 ZINC001266515944 1036587599 /nfs/dbraw/zinc/58/75/99/1036587599.db2.gz NEURUVJDTCXQRU-ZDUSSCGKSA-N 1 2 303.450 4.001 20 0 DIADLO COc1ccc(NCc2cc(-n3cc[nH+]c3)cs2)cc1Cl ZINC001648856780 1036648072 /nfs/dbraw/zinc/64/80/72/1036648072.db2.gz BKODMYQZFSYVGP-UHFFFAOYSA-N 1 2 319.817 4.208 20 0 DIADLO Fc1ccc(F)c(CNc2ccc(-n3cc[nH+]c3)cc2)c1Cl ZINC001648864763 1036659991 /nfs/dbraw/zinc/65/99/91/1036659991.db2.gz YJOFLOMEEVJCQM-UHFFFAOYSA-N 1 2 319.742 4.416 20 0 DIADLO COc1ccc(OC)c([C@@H](C)[NH2+][C@@H](C)c2nc(C)sc2C)c1 ZINC000315848014 1036662072 /nfs/dbraw/zinc/66/20/72/1036662072.db2.gz LGQUKZGHCUGNBN-MNOVXSKESA-N 1 2 320.458 4.189 20 0 DIADLO COc1ccc(OC)c([C@H](C)[NH2+][C@@H](C)c2nc(C)sc2C)c1 ZINC000315848016 1036662521 /nfs/dbraw/zinc/66/25/21/1036662521.db2.gz LGQUKZGHCUGNBN-QWRGUYRKSA-N 1 2 320.458 4.189 20 0 DIADLO Fc1cccc(F)c1C[N@@H+]1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC001167318828 1036686684 /nfs/dbraw/zinc/68/66/84/1036686684.db2.gz VNWQYWXKVYXNPD-MRXNPFEDSA-N 1 2 317.335 4.031 20 0 DIADLO Fc1cccc(F)c1C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC001167318828 1036686687 /nfs/dbraw/zinc/68/66/87/1036686687.db2.gz VNWQYWXKVYXNPD-MRXNPFEDSA-N 1 2 317.335 4.031 20 0 DIADLO Cc1cccn2c(CN(C)Cc3cc(Cl)ccc3F)c[nH+]c12 ZINC000683718205 1036761690 /nfs/dbraw/zinc/76/16/90/1036761690.db2.gz BPYFYRQXZUKSTR-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO CCc1cnc(C[NH+]2CCC(F)(c3cccc(Cl)c3)CC2)o1 ZINC000580030929 1036792716 /nfs/dbraw/zinc/79/27/16/1036792716.db2.gz PFPOBFPQJDVHPH-UHFFFAOYSA-N 1 2 322.811 4.351 20 0 DIADLO Nc1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000315165061 1036809001 /nfs/dbraw/zinc/80/90/01/1036809001.db2.gz RLUOMMUQHGOZMZ-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000315165061 1036809017 /nfs/dbraw/zinc/80/90/17/1036809017.db2.gz RLUOMMUQHGOZMZ-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Cn1c(NCc2ccc3cnccc3c2)[nH+]c2cccc(Cl)c21 ZINC000683750446 1036819495 /nfs/dbraw/zinc/81/94/95/1036819495.db2.gz GIHSYWHCDRLHPL-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2nc(CCC(C)C)no2)C(C)C)s1 ZINC000064515313 1036847257 /nfs/dbraw/zinc/84/72/57/1036847257.db2.gz UVNNDOJJALXAHH-UHFFFAOYSA-N 1 2 321.490 4.439 20 0 DIADLO Cc1ccc(C[N@H+](Cc2nc(CCC(C)C)no2)C(C)C)s1 ZINC000064515313 1036847279 /nfs/dbraw/zinc/84/72/79/1036847279.db2.gz UVNNDOJJALXAHH-UHFFFAOYSA-N 1 2 321.490 4.439 20 0 DIADLO Cc1ccc(CNc2cc[nH+]c(OCC(F)(F)F)c2)s1 ZINC000340557149 1036867336 /nfs/dbraw/zinc/86/73/36/1036867336.db2.gz MCWXBFXJNODSMM-UHFFFAOYSA-N 1 2 302.321 4.005 20 0 DIADLO CC(C)(O)c1ccc(Nc2[nH+]cccc2N2CCCCC2)cc1 ZINC001210616621 1036875969 /nfs/dbraw/zinc/87/59/69/1036875969.db2.gz FLCCZNAUPZOCSK-UHFFFAOYSA-N 1 2 311.429 4.043 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1ccc2cnccc2c1 ZINC000683774136 1036889406 /nfs/dbraw/zinc/88/94/06/1036889406.db2.gz TYYAUFAKMLLPHI-UHFFFAOYSA-N 1 2 307.397 4.419 20 0 DIADLO CCSc1ccc(C(=O)Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC000349292995 1036935475 /nfs/dbraw/zinc/93/54/75/1036935475.db2.gz YKQQVUWCVNMWGD-UHFFFAOYSA-N 1 2 311.410 4.007 20 0 DIADLO CO[C@H](c1ccccc1)[C@H](C)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000683816072 1036963058 /nfs/dbraw/zinc/96/30/58/1036963058.db2.gz IZGOLCZGGFYTCV-KXBFYZLASA-N 1 2 307.397 4.060 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2sccc2Cl)c(OC)c1 ZINC000683822742 1036974133 /nfs/dbraw/zinc/97/41/33/1036974133.db2.gz MRIXOHUMHFOCGI-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2sccc2Cl)c(OC)c1 ZINC000683822742 1036974148 /nfs/dbraw/zinc/97/41/48/1036974148.db2.gz MRIXOHUMHFOCGI-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO C[C@@]1(c2ccccc2)C[N@H+](Cc2cc(Cl)cs2)CCO1 ZINC000683829692 1036985814 /nfs/dbraw/zinc/98/58/14/1036985814.db2.gz CALBNFFANGEXPU-INIZCTEOSA-N 1 2 307.846 4.149 20 0 DIADLO C[C@@]1(c2ccccc2)C[N@@H+](Cc2cc(Cl)cs2)CCO1 ZINC000683829692 1036985831 /nfs/dbraw/zinc/98/58/31/1036985831.db2.gz CALBNFFANGEXPU-INIZCTEOSA-N 1 2 307.846 4.149 20 0 DIADLO CCOc1ccc(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)cc1F ZINC000683833055 1036994093 /nfs/dbraw/zinc/99/40/93/1036994093.db2.gz QWRXCJGKWITHKL-QGZVFWFLSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1ccc(C[N@H+]2CC[C@@H]2c2cccc(F)c2)cc1F ZINC000683833055 1036994108 /nfs/dbraw/zinc/99/41/08/1036994108.db2.gz QWRXCJGKWITHKL-QGZVFWFLSA-N 1 2 303.352 4.311 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@@H+]2Cc2ncccc2Cl)cc1 ZINC001167371802 1037014805 /nfs/dbraw/zinc/01/48/05/1037014805.db2.gz ISBJWDNFACGNHL-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@H+]2Cc2ncccc2Cl)cc1 ZINC001167371802 1037014820 /nfs/dbraw/zinc/01/48/20/1037014820.db2.gz ISBJWDNFACGNHL-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO CC(C)n1cncc1C[NH2+]Cc1cc(Cl)sc1Cl ZINC000312787141 1037053919 /nfs/dbraw/zinc/05/39/19/1037053919.db2.gz WRFNSPLTAGAZOR-UHFFFAOYSA-N 1 2 304.246 4.122 20 0 DIADLO FC1(F)CCC[C@H]1[NH2+]Cc1ccc(Cl)c(Br)c1 ZINC000397971735 1037054738 /nfs/dbraw/zinc/05/47/38/1037054738.db2.gz UELBICWBHJWOQP-LLVKDONJSA-N 1 2 324.596 4.380 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ncc(C(F)(F)F)s1)c1ccccn1 ZINC000683926637 1037111701 /nfs/dbraw/zinc/11/17/01/1037111701.db2.gz CXMXIOYOUOELLE-SNVBAGLBSA-N 1 2 315.364 4.188 20 0 DIADLO Cc1cc(C[N@H+](Cc2cc(C)c(C)o2)Cc2ccccc2)on1 ZINC001204539002 1037133764 /nfs/dbraw/zinc/13/37/64/1037133764.db2.gz IYTNDZGKLNACDV-UHFFFAOYSA-N 1 2 310.397 4.395 20 0 DIADLO Cc1cc(C[N@@H+](Cc2cc(C)c(C)o2)Cc2ccccc2)on1 ZINC001204539002 1037133773 /nfs/dbraw/zinc/13/37/73/1037133773.db2.gz IYTNDZGKLNACDV-UHFFFAOYSA-N 1 2 310.397 4.395 20 0 DIADLO COc1ccc([C@@H]2C[C@H]2CC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000622776526 1037196010 /nfs/dbraw/zinc/19/60/10/1037196010.db2.gz KKVFCVPNJAHGCW-WMZOPIPTSA-N 1 2 324.424 4.148 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccco2)no1)Cc1cccc(Cl)c1 ZINC000047958390 1037214409 /nfs/dbraw/zinc/21/44/09/1037214409.db2.gz GIGDQJKLEMWFJM-UHFFFAOYSA-N 1 2 317.776 4.005 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccco2)no1)Cc1cccc(Cl)c1 ZINC000047958390 1037214415 /nfs/dbraw/zinc/21/44/15/1037214415.db2.gz GIGDQJKLEMWFJM-UHFFFAOYSA-N 1 2 317.776 4.005 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1nc(C2CC2)no1 ZINC000089670914 1037259662 /nfs/dbraw/zinc/25/96/62/1037259662.db2.gz IPXQVUOPUDTHDN-CVEARBPZSA-N 1 2 315.392 4.060 20 0 DIADLO Clc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)c(Cl)n1 ZINC001211274118 1037265863 /nfs/dbraw/zinc/26/58/63/1037265863.db2.gz CAIXMDNTQBHKSD-UHFFFAOYSA-N 1 2 305.168 4.318 20 0 DIADLO Cc1nccnc1C[N@@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000621711202 1037435417 /nfs/dbraw/zinc/43/54/17/1037435417.db2.gz JGKAFNHBQJLVFV-LLVKDONJSA-N 1 2 310.228 4.285 20 0 DIADLO Cc1nccnc1C[N@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000621711202 1037435428 /nfs/dbraw/zinc/43/54/28/1037435428.db2.gz JGKAFNHBQJLVFV-LLVKDONJSA-N 1 2 310.228 4.285 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)c1Cl ZINC001204553743 1037489475 /nfs/dbraw/zinc/48/94/75/1037489475.db2.gz YAQXVRNHGBYBIE-KBPBESRZSA-N 1 2 317.832 4.478 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c1Cl ZINC001204553743 1037489478 /nfs/dbraw/zinc/48/94/78/1037489478.db2.gz YAQXVRNHGBYBIE-KBPBESRZSA-N 1 2 317.832 4.478 20 0 DIADLO COc1ccc(C(C)=O)c(Nc2c[nH+]cc(C)c2C)c1Cl ZINC001213532504 1037490152 /nfs/dbraw/zinc/49/01/52/1037490152.db2.gz LUCCYANCMAEPBG-UHFFFAOYSA-N 1 2 304.777 4.307 20 0 DIADLO CCCc1csc(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)n1 ZINC000581264557 1037505889 /nfs/dbraw/zinc/50/58/89/1037505889.db2.gz PDQLADPRENEBGS-QGZVFWFLSA-N 1 2 304.434 4.166 20 0 DIADLO CCCc1csc(C[N@H+]2CC[C@](F)(c3ccccc3)C2)n1 ZINC000581264557 1037505899 /nfs/dbraw/zinc/50/58/99/1037505899.db2.gz PDQLADPRENEBGS-QGZVFWFLSA-N 1 2 304.434 4.166 20 0 DIADLO Cc1nc(C[NH2+][C@H](CC(F)(F)F)c2ccccc2)cs1 ZINC000040443789 1037534697 /nfs/dbraw/zinc/53/46/97/1037534697.db2.gz XGVFODKRZNCDKZ-CYBMUJFWSA-N 1 2 300.349 4.235 20 0 DIADLO Cc1cc(N(C)C2CCC(C(F)(F)F)CC2)nc(C2CC2)[nH+]1 ZINC000341055039 1037664145 /nfs/dbraw/zinc/66/41/45/1037664145.db2.gz RHMCMUVIQLUGDI-UHFFFAOYSA-N 1 2 313.367 4.220 20 0 DIADLO CCc1nc(C[NH2+][C@@H](C)c2cc(C)c(OC)c(Cl)c2)co1 ZINC000834901143 1037739167 /nfs/dbraw/zinc/73/91/67/1037739167.db2.gz ZRWIFTBSLFUUAB-NSHDSACASA-N 1 2 308.809 4.058 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(CCc2ccccc2)no1)c1ccccc1 ZINC000341230856 1037770060 /nfs/dbraw/zinc/77/00/60/1037770060.db2.gz SXJJHFAOZZKFED-GOSISDBHSA-N 1 2 321.424 4.096 20 0 DIADLO CC(C)(C)CCCCC(=O)NCc1cccc(-n2cc[nH+]c2)c1 ZINC000581612463 1037781051 /nfs/dbraw/zinc/78/10/51/1037781051.db2.gz RNUVIMDLGVHMJN-UHFFFAOYSA-N 1 2 313.445 4.095 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1nn(C)c2ccccc12 ZINC000656781359 1037861083 /nfs/dbraw/zinc/86/10/83/1037861083.db2.gz QHNKRUYRRCKZGN-UHFFFAOYSA-N 1 2 319.412 4.116 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1CNc1c[nH+]cc2c1CCCC2 ZINC000656776201 1037862884 /nfs/dbraw/zinc/86/28/84/1037862884.db2.gz KXCKDPCQVAOOCW-UHFFFAOYSA-N 1 2 312.461 4.141 20 0 DIADLO CCc1cccc(F)c1C[NH2+]Cc1c(F)c(F)cc(F)c1F ZINC000684382170 1037905335 /nfs/dbraw/zinc/90/53/35/1037905335.db2.gz QCNSDQNDTFYXIQ-UHFFFAOYSA-N 1 2 315.285 4.234 20 0 DIADLO C[C@@H]1CSCC[N@@H+]1Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC001167478596 1037914673 /nfs/dbraw/zinc/91/46/73/1037914673.db2.gz UGXWPMNSWDZRSC-SECBINFHSA-N 1 2 309.784 4.296 20 0 DIADLO C[C@@H]1CSCC[N@H+]1Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC001167478596 1037914679 /nfs/dbraw/zinc/91/46/79/1037914679.db2.gz UGXWPMNSWDZRSC-SECBINFHSA-N 1 2 309.784 4.296 20 0 DIADLO Fc1cc2c(c(F)c1)[C@@H]([NH2+]Cc1ccc(C(F)F)cc1)CO2 ZINC000684395207 1037932155 /nfs/dbraw/zinc/93/21/55/1037932155.db2.gz STRHMNVDPNAIDN-ZDUSSCGKSA-N 1 2 311.278 4.126 20 0 DIADLO CCc1noc(C[NH2+][C@@H](c2ccc(C(C)(C)C)cc2)C(C)C)n1 ZINC000078645398 1037935111 /nfs/dbraw/zinc/93/51/11/1037935111.db2.gz AZHMCUCUZLTAPQ-GOSISDBHSA-N 1 2 315.461 4.416 20 0 DIADLO COc1ccc2cc(C[N@H+](C)Cc3nccn3C3CC3)ccc2c1 ZINC000891516203 1038005053 /nfs/dbraw/zinc/00/50/53/1038005053.db2.gz FYAGGFNLWPWBDB-UHFFFAOYSA-N 1 2 321.424 4.012 20 0 DIADLO COc1ccc2cc(C[N@@H+](C)Cc3nccn3C3CC3)ccc2c1 ZINC000891516203 1038005073 /nfs/dbraw/zinc/00/50/73/1038005073.db2.gz FYAGGFNLWPWBDB-UHFFFAOYSA-N 1 2 321.424 4.012 20 0 DIADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1cnc(C2CCC2)s1 ZINC000341490722 1038057909 /nfs/dbraw/zinc/05/79/09/1038057909.db2.gz UKEKLQPMPOYDRY-ZDUSSCGKSA-N 1 2 314.454 4.194 20 0 DIADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1cnc(C2CCC2)s1 ZINC000341490722 1038057926 /nfs/dbraw/zinc/05/79/26/1038057926.db2.gz UKEKLQPMPOYDRY-ZDUSSCGKSA-N 1 2 314.454 4.194 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@@H]2c2ccccc2Cl)c(C)[nH+]1 ZINC000097214011 1038083092 /nfs/dbraw/zinc/08/30/92/1038083092.db2.gz QHAHXXZHHMDYKP-HUUCEWRRSA-N 1 2 314.816 4.402 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc(C(F)F)c(F)c2)no1 ZINC000891648843 1038100475 /nfs/dbraw/zinc/10/04/75/1038100475.db2.gz UUSSKCBMXGGUOA-HNNXBMFYSA-N 1 2 310.319 4.397 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc(C(F)F)c(F)c2)no1 ZINC000891648843 1038100490 /nfs/dbraw/zinc/10/04/90/1038100490.db2.gz UUSSKCBMXGGUOA-HNNXBMFYSA-N 1 2 310.319 4.397 20 0 DIADLO CCC[N@H+](Cc1nccn1C1CC1)[C@@H](C)c1ccccc1OC ZINC000891652007 1038107204 /nfs/dbraw/zinc/10/72/04/1038107204.db2.gz ALRFLCZRVHSRKZ-HNNXBMFYSA-N 1 2 313.445 4.200 20 0 DIADLO CCC[N@@H+](Cc1nccn1C1CC1)[C@@H](C)c1ccccc1OC ZINC000891652007 1038107213 /nfs/dbraw/zinc/10/72/13/1038107213.db2.gz ALRFLCZRVHSRKZ-HNNXBMFYSA-N 1 2 313.445 4.200 20 0 DIADLO FC(F)Oc1cccc(Cl)c1C[NH2+]Cc1ccc(Cl)o1 ZINC000602901985 1038109420 /nfs/dbraw/zinc/10/94/20/1038109420.db2.gz JEFKYVMRATUWRM-UHFFFAOYSA-N 1 2 322.138 4.478 20 0 DIADLO COc1ccc2c(c1)[C@H]([NH2+]Cc1c(F)cccc1Cl)CCO2 ZINC000341554677 1038132393 /nfs/dbraw/zinc/13/23/93/1038132393.db2.gz PQPFDBQUWZHTRN-MRXNPFEDSA-N 1 2 321.779 4.101 20 0 DIADLO CSc1cc(NC(=O)NCc2cc(C)[nH+]c(C)c2)ccc1C ZINC000650531334 1038156768 /nfs/dbraw/zinc/15/67/68/1038156768.db2.gz HYSGKHVYVSJCJO-UHFFFAOYSA-N 1 2 315.442 4.050 20 0 DIADLO CC[N@H+](Cc1cnn(C)c1C)Cc1ccc(Cl)cc1Cl ZINC001204574850 1038159220 /nfs/dbraw/zinc/15/92/20/1038159220.db2.gz MPBOONALKXPOLN-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO CC[N@@H+](Cc1cnn(C)c1C)Cc1ccc(Cl)cc1Cl ZINC001204574850 1038159228 /nfs/dbraw/zinc/15/92/28/1038159228.db2.gz MPBOONALKXPOLN-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nccn2-c2ccccc2)[C@@H](c2ccco2)C1 ZINC001167490733 1038163417 /nfs/dbraw/zinc/16/34/17/1038163417.db2.gz HHVLQDJXLSVRGH-SJLPKXTDSA-N 1 2 321.424 4.439 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nccn2-c2ccccc2)[C@@H](c2ccco2)C1 ZINC001167490733 1038163423 /nfs/dbraw/zinc/16/34/23/1038163423.db2.gz HHVLQDJXLSVRGH-SJLPKXTDSA-N 1 2 321.424 4.439 20 0 DIADLO Cc1oc(C)c(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)c1C ZINC000684509476 1038196603 /nfs/dbraw/zinc/19/66/03/1038196603.db2.gz LKUJNBHCDPQIRS-UHFFFAOYSA-N 1 2 309.369 4.156 20 0 DIADLO CCC(=CC(=O)Nc1cc(C)[nH+]cc1C)c1cccc(Cl)c1 ZINC001266899468 1038205962 /nfs/dbraw/zinc/20/59/62/1038205962.db2.gz DSLBHROJDGZAQS-UVTDQMKNSA-N 1 2 314.816 4.206 20 0 DIADLO CC[C@H]([NH2+]Cc1csc([C@@H](C)OC)n1)c1ccccc1OC ZINC000341661953 1038212427 /nfs/dbraw/zinc/21/24/27/1038212427.db2.gz SFANFVZXRGZBBI-DOMZBBRYSA-N 1 2 320.458 4.100 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@@H+]2CCc3ccccc3C2)o1 ZINC000158178804 1038214090 /nfs/dbraw/zinc/21/40/90/1038214090.db2.gz DETQEWHEAXWFNG-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1ccccc1-c1cnc(C[N@H+]2CCc3ccccc3C2)o1 ZINC000158178804 1038214105 /nfs/dbraw/zinc/21/41/05/1038214105.db2.gz DETQEWHEAXWFNG-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000603469751 1038215060 /nfs/dbraw/zinc/21/50/60/1038215060.db2.gz HYJFLXAVZRYSPM-MSOLQXFVSA-N 1 2 317.477 4.043 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nnc([C@@H](C)CC)[nH]1)c1ccc(F)cc1F ZINC000276845895 1038251303 /nfs/dbraw/zinc/25/13/03/1038251303.db2.gz CNHNERQOUVPXQB-FIXISWKDSA-N 1 2 322.403 4.398 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+]Cc1noc2c1CCCC2 ZINC000669694391 1038269154 /nfs/dbraw/zinc/26/91/54/1038269154.db2.gz JHSDIKWWEADIPX-GFCCVEGCSA-N 1 2 302.443 4.126 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+][C@H](C)c2nnc(CC)o2)cc1 ZINC000341803903 1038272245 /nfs/dbraw/zinc/27/22/45/1038272245.db2.gz NRAGIYPGMFCRSR-NWDGAFQWSA-N 1 2 305.447 4.156 20 0 DIADLO CCCCCOc1ccc(C(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC000603785195 1038280457 /nfs/dbraw/zinc/28/04/57/1038280457.db2.gz FERHMCVMAZRXKZ-UHFFFAOYSA-N 1 2 323.396 4.156 20 0 DIADLO CCc1nnc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H](C)CC)o1 ZINC000341857944 1038298391 /nfs/dbraw/zinc/29/83/91/1038298391.db2.gz FRYHAHRTELQTGR-ZBEGNZNMSA-N 1 2 307.825 4.162 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000603865360 1038306789 /nfs/dbraw/zinc/30/67/89/1038306789.db2.gz BUTYNLZHUDSMES-QZTJIDSGSA-N 1 2 317.477 4.043 20 0 DIADLO CC(C)(CCCc1ccccc1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000603882718 1038310811 /nfs/dbraw/zinc/31/08/11/1038310811.db2.gz WGAFJHMERPTOBP-UHFFFAOYSA-N 1 2 321.424 4.322 20 0 DIADLO CC(C)[C@H](CC(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000603884928 1038313912 /nfs/dbraw/zinc/31/39/12/1038313912.db2.gz NVKNTWMJUGUODU-KRWDZBQOSA-N 1 2 307.397 4.103 20 0 DIADLO Cc1cc(NC(=O)N[C@@H](C)c2cccc3ccccc32)c(C)c[nH+]1 ZINC000535774168 1038333222 /nfs/dbraw/zinc/33/32/22/1038333222.db2.gz QARIIDVXZOSMKU-HNNXBMFYSA-N 1 2 319.408 4.156 20 0 DIADLO COCc1ccc(C[N@H+](C)Cc2c(F)cccc2Cl)cc1 ZINC000535780305 1038340207 /nfs/dbraw/zinc/34/02/07/1038340207.db2.gz GNBXVCPCDYWELP-UHFFFAOYSA-N 1 2 307.796 4.258 20 0 DIADLO COCc1ccc(C[N@@H+](C)Cc2c(F)cccc2Cl)cc1 ZINC000535780305 1038340219 /nfs/dbraw/zinc/34/02/19/1038340219.db2.gz GNBXVCPCDYWELP-UHFFFAOYSA-N 1 2 307.796 4.258 20 0 DIADLO c1nc(C[N@@H+]2Cc3ccccc3C[C@H]2c2ccccc2)cs1 ZINC000535807644 1038342888 /nfs/dbraw/zinc/34/28/88/1038342888.db2.gz XFFYYJRVLJGDIU-IBGZPJMESA-N 1 2 306.434 4.443 20 0 DIADLO c1nc(C[N@H+]2Cc3ccccc3C[C@H]2c2ccccc2)cs1 ZINC000535807644 1038342899 /nfs/dbraw/zinc/34/28/99/1038342899.db2.gz XFFYYJRVLJGDIU-IBGZPJMESA-N 1 2 306.434 4.443 20 0 DIADLO FC(F)(F)CC1CC[NH+](Cc2nc(C3CC3)cs2)CC1 ZINC000341983120 1038361499 /nfs/dbraw/zinc/36/14/99/1038361499.db2.gz UBIKQOSCFWYJEK-UHFFFAOYSA-N 1 2 304.381 4.185 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1cc(F)ccc1F ZINC000341989844 1038364254 /nfs/dbraw/zinc/36/42/54/1038364254.db2.gz AWSKOUHSTGRHCW-CQSZACIVSA-N 1 2 320.314 4.486 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@@](F)(c3cc(F)cc(F)c3)C2)c(C)n1 ZINC000341999893 1038366001 /nfs/dbraw/zinc/36/60/01/1038366001.db2.gz VQSKNXDFALSDDN-SFHVURJKSA-N 1 2 320.358 4.047 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@@](F)(c3cc(F)cc(F)c3)C2)c(C)n1 ZINC000341999893 1038366016 /nfs/dbraw/zinc/36/60/16/1038366016.db2.gz VQSKNXDFALSDDN-SFHVURJKSA-N 1 2 320.358 4.047 20 0 DIADLO CC(C)c1nnc(C[NH+]2CCC(c3ccc(F)cc3)CC2)s1 ZINC000828020740 1038372540 /nfs/dbraw/zinc/37/25/40/1038372540.db2.gz MFFNDBHMYNORNB-UHFFFAOYSA-N 1 2 319.449 4.180 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2cccc(-c3ccncc3)c2)cs1 ZINC000535824840 1038380922 /nfs/dbraw/zinc/38/09/22/1038380922.db2.gz GZVXZXKONZLMHZ-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2cccc(-c3ccncc3)c2)cs1 ZINC000535824840 1038380936 /nfs/dbraw/zinc/38/09/36/1038380936.db2.gz GZVXZXKONZLMHZ-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)n1 ZINC000097120365 1038412632 /nfs/dbraw/zinc/41/26/32/1038412632.db2.gz JNTCGABUXKSFTC-VXGBXAGGSA-N 1 2 307.825 4.477 20 0 DIADLO Cc1noc([C@@H](C)[NH2+][C@H](Cc2ccccc2)c2cccs2)n1 ZINC000604891896 1038462814 /nfs/dbraw/zinc/46/28/14/1038462814.db2.gz FSOHDYQTDYMBBB-IUODEOHRSA-N 1 2 313.426 4.074 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+](C)[C@H](C)c1cccc(Cl)c1 ZINC000061858350 1038468153 /nfs/dbraw/zinc/46/81/53/1038468153.db2.gz DVXFMCMXXPDFIA-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+](C)[C@H](C)c1cccc(Cl)c1 ZINC000061858350 1038468157 /nfs/dbraw/zinc/46/81/57/1038468157.db2.gz DVXFMCMXXPDFIA-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO CCc1nc(C)c([C@H](C)[NH2+][C@H](C)c2nnc([C@@H](C)CC)[nH]2)s1 ZINC000277264044 1038472407 /nfs/dbraw/zinc/47/24/07/1038472407.db2.gz PHGZDONTPHHCQP-JBLDHEPKSA-N 1 2 321.494 4.057 20 0 DIADLO CC(C)c1cccc(NC(=O)c2cccc(-n3cc[nH+]c3)c2)c1 ZINC000605079452 1038484938 /nfs/dbraw/zinc/48/49/38/1038484938.db2.gz DYLKDSXCUUOTQK-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1ccnc(Cl)c1 ZINC000171792987 1038488621 /nfs/dbraw/zinc/48/86/21/1038488621.db2.gz FHTNCNHMHPJVBU-QWQRMKEZSA-N 1 2 316.832 4.086 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@H+]1Cc1ccnc(Cl)c1 ZINC000171792987 1038488622 /nfs/dbraw/zinc/48/86/22/1038488622.db2.gz FHTNCNHMHPJVBU-QWQRMKEZSA-N 1 2 316.832 4.086 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H]2CC(C)(C)Cc3occc32)[nH]1 ZINC000277296332 1038491111 /nfs/dbraw/zinc/49/11/11/1038491111.db2.gz RPQANIJXUVIPMB-OBJOEFQTSA-N 1 2 316.449 4.276 20 0 DIADLO CCCCC[N@@H+]1CCO[C@H](c2cccc(Br)c2)C1 ZINC000605150217 1038493563 /nfs/dbraw/zinc/49/35/63/1038493563.db2.gz LZWITKWWVXHMDI-HNNXBMFYSA-N 1 2 312.251 4.013 20 0 DIADLO CCCCC[N@H+]1CCO[C@H](c2cccc(Br)c2)C1 ZINC000605150217 1038493568 /nfs/dbraw/zinc/49/35/68/1038493568.db2.gz LZWITKWWVXHMDI-HNNXBMFYSA-N 1 2 312.251 4.013 20 0 DIADLO FC(F)(F)Oc1cc(Cl)ccc1C[N@@H+]1CCCC12CC2 ZINC001143427205 1038494215 /nfs/dbraw/zinc/49/42/15/1038494215.db2.gz AFGPGWGJRBXYOE-UHFFFAOYSA-N 1 2 305.727 4.367 20 0 DIADLO FC(F)(F)Oc1cc(Cl)ccc1C[N@H+]1CCCC12CC2 ZINC001143427205 1038494220 /nfs/dbraw/zinc/49/42/20/1038494220.db2.gz AFGPGWGJRBXYOE-UHFFFAOYSA-N 1 2 305.727 4.367 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC[C@H](C)C[C@@H]1c1ccc(CC)o1 ZINC001167509769 1038525121 /nfs/dbraw/zinc/52/51/21/1038525121.db2.gz PVIDDMXOAHARIQ-YQQAZPJKSA-N 1 2 321.461 4.347 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CC[C@H](C)C[C@@H]1c1ccc(CC)o1 ZINC001167509769 1038525125 /nfs/dbraw/zinc/52/51/25/1038525125.db2.gz PVIDDMXOAHARIQ-YQQAZPJKSA-N 1 2 321.461 4.347 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc3ccccc3n2)[nH]1 ZINC000277402854 1038542743 /nfs/dbraw/zinc/54/27/43/1038542743.db2.gz YZTSJVFKXPEDFP-MELADBBJSA-N 1 2 323.444 4.278 20 0 DIADLO Cc1c[nH]c(C[NH2+][C@H](C)c2ccccc2OCc2ccccc2)n1 ZINC000657325163 1038568778 /nfs/dbraw/zinc/56/87/78/1038568778.db2.gz BTESRABDHDRXLL-MRXNPFEDSA-N 1 2 321.424 4.148 20 0 DIADLO O=C(CC/C=C\c1ccccc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000606177523 1038576838 /nfs/dbraw/zinc/57/68/38/1038576838.db2.gz HEPGLKWDOJWJTP-WTKPLQERSA-N 1 2 317.392 4.304 20 0 DIADLO CC(C)CCOc1ccccc1C[NH2+]Cc1nccn1C(C)C ZINC000657341791 1038583804 /nfs/dbraw/zinc/58/38/04/1038583804.db2.gz LRGIXMHYWMYXEN-UHFFFAOYSA-N 1 2 315.461 4.179 20 0 DIADLO Fc1ccc2oc(C[NH2+][C@@H]3COc4cccc(Cl)c43)cc2c1 ZINC000342419259 1038586615 /nfs/dbraw/zinc/58/66/15/1038586615.db2.gz APUYTGIBXZIKBI-CQSZACIVSA-N 1 2 317.747 4.449 20 0 DIADLO Fc1ccc(C[NH+]2Cc3ccccc3C2)cc1OC(F)(F)F ZINC001143436986 1038587830 /nfs/dbraw/zinc/58/78/30/1038587830.db2.gz UHFXNKFTNATGTH-UHFFFAOYSA-N 1 2 311.278 4.240 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(F)c(F)c1F)c1nc(C)cs1 ZINC000657352952 1038595488 /nfs/dbraw/zinc/59/54/88/1038595488.db2.gz WUWJYGMTPIXBHU-LLVKDONJSA-N 1 2 300.349 4.110 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000606432798 1038601537 /nfs/dbraw/zinc/60/15/37/1038601537.db2.gz MAGVMRXRKBUTHU-RBUKOAKNSA-N 1 2 317.379 4.489 20 0 DIADLO CC[C@@H](c1ccc(F)cc1)[N@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000606432798 1038601540 /nfs/dbraw/zinc/60/15/40/1038601540.db2.gz MAGVMRXRKBUTHU-RBUKOAKNSA-N 1 2 317.379 4.489 20 0 DIADLO C=C(Br)C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000062640409 1038612128 /nfs/dbraw/zinc/61/21/28/1038612128.db2.gz LBTBFEAPSNWHLS-ZDUSSCGKSA-N 1 2 300.627 4.386 20 0 DIADLO C=C(Br)C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000062640409 1038612130 /nfs/dbraw/zinc/61/21/30/1038612130.db2.gz LBTBFEAPSNWHLS-ZDUSSCGKSA-N 1 2 300.627 4.386 20 0 DIADLO CCN(Cc1ccccc1C)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000606568892 1038614165 /nfs/dbraw/zinc/61/41/65/1038614165.db2.gz GTQXWARQZKZEEP-UHFFFAOYSA-N 1 2 322.412 4.005 20 0 DIADLO Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc3[nH+]ccn3c2)c1 ZINC000606584162 1038616105 /nfs/dbraw/zinc/61/61/05/1038616105.db2.gz DZNVEMGFXBQGJG-QGZVFWFLSA-N 1 2 320.396 4.012 20 0 DIADLO CCCN(Cc1ccc(C)cc1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606580713 1038616216 /nfs/dbraw/zinc/61/62/16/1038616216.db2.gz BGWKHPAMOXRBCV-UHFFFAOYSA-N 1 2 322.412 4.087 20 0 DIADLO Cc1nc(C[NH2+][C@@H](Cc2ccccc2)c2ccccc2F)[nH]c1C ZINC000657373060 1038617238 /nfs/dbraw/zinc/61/72/38/1038617238.db2.gz OTKHKLPDOYKJKY-IBGZPJMESA-N 1 2 323.415 4.239 20 0 DIADLO CC[C@@](C)([NH2+]Cc1ccc(F)c(F)c1F)c1nc(C)cs1 ZINC000657375096 1038619364 /nfs/dbraw/zinc/61/93/64/1038619364.db2.gz CXZXHQVYIIMXEE-OAHLLOKOSA-N 1 2 314.376 4.284 20 0 DIADLO Cc1c[nH]c(C[NH2+]Cc2ccc(C)cc2O[C@H](C)CC(C)C)n1 ZINC000657394980 1038634965 /nfs/dbraw/zinc/63/49/65/1038634965.db2.gz YAPPHKMYSBQIQZ-MRXNPFEDSA-N 1 2 315.461 4.130 20 0 DIADLO C[C@@H](c1ccc2ccccc2c1)[N@@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000606904635 1038639285 /nfs/dbraw/zinc/63/92/85/1038639285.db2.gz OBYCQMDHVAVYRC-BLLLJJGKSA-N 1 2 309.331 4.164 20 0 DIADLO C[C@@H](c1ccc2ccccc2c1)[N@H+]1CCO[C@@H](C(F)(F)F)C1 ZINC000606904635 1038639287 /nfs/dbraw/zinc/63/92/87/1038639287.db2.gz OBYCQMDHVAVYRC-BLLLJJGKSA-N 1 2 309.331 4.164 20 0 DIADLO FC(F)(F)CC[N@@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000607153024 1038660113 /nfs/dbraw/zinc/66/01/13/1038660113.db2.gz MARFIZBAEODMPW-LBPRGKRZSA-N 1 2 309.784 4.382 20 0 DIADLO FC(F)(F)CC[N@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000607153024 1038660120 /nfs/dbraw/zinc/66/01/20/1038660120.db2.gz MARFIZBAEODMPW-LBPRGKRZSA-N 1 2 309.784 4.382 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cn2ncsc2=S)c1C ZINC000172912925 1038660144 /nfs/dbraw/zinc/66/01/44/1038660144.db2.gz SMFDGRLJSKNDRR-CQSZACIVSA-N 1 2 305.472 4.086 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cn2ncsc2=S)c1C ZINC000172912925 1038660149 /nfs/dbraw/zinc/66/01/49/1038660149.db2.gz SMFDGRLJSKNDRR-CQSZACIVSA-N 1 2 305.472 4.086 20 0 DIADLO CC(C)C[C@H]1CCCCCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000607213209 1038665050 /nfs/dbraw/zinc/66/50/50/1038665050.db2.gz JBPBIIJFYGJANG-MRXNPFEDSA-N 1 2 314.433 4.157 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@@H]2c2cccc(F)c2F)c(C)[nH+]1 ZINC000607454912 1038678529 /nfs/dbraw/zinc/67/85/29/1038678529.db2.gz AAGUMXVDVRPREJ-ZIAGYGMSSA-N 1 2 316.351 4.027 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc3c(s2)CC[C@H](C)C3)c(C)[nH+]1 ZINC000097040200 1038684901 /nfs/dbraw/zinc/68/49/01/1038684901.db2.gz ZGANUYDNWNXZDF-JTQLQIEISA-N 1 2 314.454 4.445 20 0 DIADLO Cc1ncc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)s1 ZINC000277665301 1038691941 /nfs/dbraw/zinc/69/19/41/1038691941.db2.gz HLLGJOSKLDDFFM-UHFFFAOYSA-N 1 2 324.453 4.263 20 0 DIADLO COCc1cnc(C[N@H+]([C@H](C)c2ccccc2)C2CC2)s1 ZINC000342686890 1038722741 /nfs/dbraw/zinc/72/27/41/1038722741.db2.gz ZVACAGHGDJJZNV-CYBMUJFWSA-N 1 2 302.443 4.015 20 0 DIADLO COCc1cnc(C[N@@H+]([C@H](C)c2ccccc2)C2CC2)s1 ZINC000342686890 1038722748 /nfs/dbraw/zinc/72/27/48/1038722748.db2.gz ZVACAGHGDJJZNV-CYBMUJFWSA-N 1 2 302.443 4.015 20 0 DIADLO CCCC[C@H](C)[NH2+][C@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000133076752 1038725987 /nfs/dbraw/zinc/72/59/87/1038725987.db2.gz LZALKVKWZRNXDF-NHYWBVRUSA-N 1 2 307.825 4.289 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cc2cccc(F)c2o1 ZINC000607779623 1038732738 /nfs/dbraw/zinc/73/27/38/1038732738.db2.gz VEUSOYXJXKZTAT-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]Cc2ccc(C)c(Cl)c2)cs1 ZINC000277759288 1038735774 /nfs/dbraw/zinc/73/57/74/1038735774.db2.gz RUSUMQYIKXRBBP-LLVKDONJSA-N 1 2 310.850 4.102 20 0 DIADLO c1sc(-c2ccccc2)nc1C[NH2+][C@H]1CCCc2cccnc21 ZINC000684954320 1038739726 /nfs/dbraw/zinc/73/97/26/1038739726.db2.gz BPSARRPCORWWPS-KRWDZBQOSA-N 1 2 321.449 4.372 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccco1 ZINC000684955915 1038741315 /nfs/dbraw/zinc/74/13/15/1038741315.db2.gz SASOBLQZTLZIKF-SJORKVTESA-N 1 2 314.429 4.056 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc4ccccc4cc3F)ccc2[nH+]1 ZINC001125612626 1038746407 /nfs/dbraw/zinc/74/64/07/1038746407.db2.gz CKLBCZUWSLJDDJ-UHFFFAOYSA-N 1 2 319.339 4.187 20 0 DIADLO CC(C)([NH2+]Cc1ccc(Cl)cc1Cl)c1nccs1 ZINC000116379922 1038752700 /nfs/dbraw/zinc/75/27/00/1038752700.db2.gz BROKHAYLRKNCFD-UHFFFAOYSA-N 1 2 301.242 4.475 20 0 DIADLO Cc1cccc(C)c1C[NH2+]C1(c2noc(C(C)C)n2)CCCC1 ZINC000608003040 1038758436 /nfs/dbraw/zinc/75/84/36/1038758436.db2.gz HBADGRWWFYJIMB-UHFFFAOYSA-N 1 2 313.445 4.369 20 0 DIADLO C[C@@H]1c2c(Cl)cc(Cl)cc2CC[N@H+]1CCOCC(F)F ZINC001167602777 1038769854 /nfs/dbraw/zinc/76/98/54/1038769854.db2.gz PVDWWQGSUMGDRQ-SECBINFHSA-N 1 2 324.198 4.194 20 0 DIADLO C[C@@H]1c2c(Cl)cc(Cl)cc2CC[N@@H+]1CCOCC(F)F ZINC001167602777 1038769862 /nfs/dbraw/zinc/76/98/62/1038769862.db2.gz PVDWWQGSUMGDRQ-SECBINFHSA-N 1 2 324.198 4.194 20 0 DIADLO Cc1c[nH+]c(CN2CCc3cc(Cl)c(Cl)cc3[C@H]2C)n1C ZINC000342793656 1038786522 /nfs/dbraw/zinc/78/65/22/1038786522.db2.gz RMBOQGKKHDDRQU-LLVKDONJSA-N 1 2 324.255 4.155 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ncc(-c3ccc(C)cc3)o2)on1 ZINC000075640366 1038810546 /nfs/dbraw/zinc/81/05/46/1038810546.db2.gz UFOFBEQFTVFMSW-MRXNPFEDSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ncc(-c3ccc(C)cc3)o2)on1 ZINC000075640366 1038810570 /nfs/dbraw/zinc/81/05/70/1038810570.db2.gz UFOFBEQFTVFMSW-MRXNPFEDSA-N 1 2 323.396 4.284 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)n1 ZINC000075900505 1038818258 /nfs/dbraw/zinc/81/82/58/1038818258.db2.gz FHPFQCGIKUYCPV-KSSFIOAISA-N 1 2 301.409 4.186 20 0 DIADLO CC(C)n1ccc(C[N@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)n1 ZINC000075900505 1038818283 /nfs/dbraw/zinc/81/82/83/1038818283.db2.gz FHPFQCGIKUYCPV-KSSFIOAISA-N 1 2 301.409 4.186 20 0 DIADLO COCc1nc(C[N@@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000075900332 1038819941 /nfs/dbraw/zinc/81/99/41/1038819941.db2.gz SMPRXOKJBHPWIJ-LRDDRELGSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000075900332 1038819970 /nfs/dbraw/zinc/81/99/70/1038819970.db2.gz SMPRXOKJBHPWIJ-LRDDRELGSA-N 1 2 320.433 4.012 20 0 DIADLO Cc1ccccc1-c1cnc(C[NH+]2CCC(C(F)(F)F)CC2)o1 ZINC000075997550 1038821541 /nfs/dbraw/zinc/82/15/41/1038821541.db2.gz BTQUWGGYRCKGGS-UHFFFAOYSA-N 1 2 324.346 4.424 20 0 DIADLO Cc1c[nH+]c(CN(Cc2ccccc2)Cc2ccccc2C)n1C ZINC000342811063 1038843399 /nfs/dbraw/zinc/84/33/99/1038843399.db2.gz ZKBCCMKHYLWSFK-UHFFFAOYSA-N 1 2 319.452 4.239 20 0 DIADLO COc1cc([C@@H](C)Nc2cccc[nH+]2)ccc1OCC(C)C ZINC000076683310 1038847114 /nfs/dbraw/zinc/84/71/14/1038847114.db2.gz QDTQRTQXVWHCFO-CQSZACIVSA-N 1 2 300.402 4.298 20 0 DIADLO Cc1[nH]c(CN(Cc2ccc(F)cc2F)C2CCCC2)[nH+]c1C ZINC000628142387 1038853453 /nfs/dbraw/zinc/85/34/53/1038853453.db2.gz AZEQLOZVZFFQQF-UHFFFAOYSA-N 1 2 319.399 4.250 20 0 DIADLO CCc1cnc(C[N@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)o1 ZINC000608491730 1038861374 /nfs/dbraw/zinc/86/13/74/1038861374.db2.gz NHYGYLVEWOZZOB-UHFFFAOYSA-N 1 2 324.346 4.420 20 0 DIADLO CCc1cnc(C[N@@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)o1 ZINC000608491730 1038861398 /nfs/dbraw/zinc/86/13/98/1038861398.db2.gz NHYGYLVEWOZZOB-UHFFFAOYSA-N 1 2 324.346 4.420 20 0 DIADLO CCc1ccc(CCC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000029917142 1038863329 /nfs/dbraw/zinc/86/33/29/1038863329.db2.gz USMPVDPIMALQET-UHFFFAOYSA-N 1 2 319.408 4.006 20 0 DIADLO CCCOc1c(C[NH2+][C@@H](C)c2cscn2)cccc1OCC ZINC000657599600 1038900988 /nfs/dbraw/zinc/90/09/88/1038900988.db2.gz NQKSTHSMOGJGOT-ZDUSSCGKSA-N 1 2 320.458 4.181 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H](c2ccccc2F)C(C)C)nn1C ZINC000657614876 1038913017 /nfs/dbraw/zinc/91/30/17/1038913017.db2.gz TYGCBDJYKFIESE-MRXNPFEDSA-N 1 2 309.816 4.008 20 0 DIADLO CCc1ccc2c(cc(Cl)nc2NCc2cc[nH+]c(N)c2)c1 ZINC001167614482 1038919334 /nfs/dbraw/zinc/91/93/34/1038919334.db2.gz SMNXQTUPGUIFNZ-UHFFFAOYSA-N 1 2 312.804 4.040 20 0 DIADLO COc1cc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)ccn1 ZINC000342864956 1038932287 /nfs/dbraw/zinc/93/22/87/1038932287.db2.gz ROCNDODIMLZWPU-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1cc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)ccn1 ZINC000342864956 1038932306 /nfs/dbraw/zinc/93/23/06/1038932306.db2.gz ROCNDODIMLZWPU-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO CC(C)c1cc(Br)cc(NCc2cc[nH+]c(N)c2)c1 ZINC001167617993 1038934077 /nfs/dbraw/zinc/93/40/77/1038934077.db2.gz CBBUQJNUSLZFHZ-UHFFFAOYSA-N 1 2 320.234 4.162 20 0 DIADLO Fc1nc(F)c(Cl)c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1F ZINC001213085611 1038936848 /nfs/dbraw/zinc/93/68/48/1038936848.db2.gz NZEGOFSNRVVUTJ-UHFFFAOYSA-N 1 2 324.693 4.286 20 0 DIADLO COc1cccc2c(N3C[C@@H](C(F)(F)F)CC[C@@H]3C)cc[nH+]c12 ZINC000685039671 1038984745 /nfs/dbraw/zinc/98/47/45/1038984745.db2.gz YYAWFIOQZUPSTJ-RYUDHWBXSA-N 1 2 324.346 4.411 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2Oc2ccccc2)c(C)c[nH+]1 ZINC000534300022 1039021790 /nfs/dbraw/zinc/02/17/90/1039021790.db2.gz IXADVOFHIHGXAF-UHFFFAOYSA-N 1 2 318.376 4.165 20 0 DIADLO COCc1cnc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccc(F)c2)s1 ZINC000342935217 1039027457 /nfs/dbraw/zinc/02/74/57/1039027457.db2.gz RZALUXHAWODDAW-BLLLJJGKSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1cnc(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccc(F)c2)s1 ZINC000342935217 1039027477 /nfs/dbraw/zinc/02/74/77/1039027477.db2.gz RZALUXHAWODDAW-BLLLJJGKSA-N 1 2 320.433 4.012 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2nc3ccccc3n2CC)cc1 ZINC000534327274 1039028402 /nfs/dbraw/zinc/02/84/02/1039028402.db2.gz XYHNVHSOBUMLOV-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2nc3ccccc3n2CC)cc1 ZINC000534327274 1039028422 /nfs/dbraw/zinc/02/84/22/1039028422.db2.gz XYHNVHSOBUMLOV-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO COCOc1ccccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001211562530 1039049680 /nfs/dbraw/zinc/04/96/80/1039049680.db2.gz PXRDIVJAXRXYET-UHFFFAOYSA-N 1 2 312.413 4.403 20 0 DIADLO COCc1cnc(C[N@@H+]2CC[C@H](C)[C@H]2c2cccc(F)c2)s1 ZINC000342954940 1039051733 /nfs/dbraw/zinc/05/17/33/1039051733.db2.gz ZOPKUERPPNTUKF-SJCJKPOMSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1cnc(C[N@H+]2CC[C@H](C)[C@H]2c2cccc(F)c2)s1 ZINC000342954940 1039051752 /nfs/dbraw/zinc/05/17/52/1039051752.db2.gz ZOPKUERPPNTUKF-SJCJKPOMSA-N 1 2 320.433 4.012 20 0 DIADLO Cc1cnc(C[N@H+]2CC=C(c3ccccc3C(F)(F)F)CC2)o1 ZINC000153625635 1039060124 /nfs/dbraw/zinc/06/01/24/1039060124.db2.gz VNRKRPSVFIFONR-UHFFFAOYSA-N 1 2 322.330 4.291 20 0 DIADLO Cc1cnc(C[N@@H+]2CC=C(c3ccccc3C(F)(F)F)CC2)o1 ZINC000153625635 1039060137 /nfs/dbraw/zinc/06/01/37/1039060137.db2.gz VNRKRPSVFIFONR-UHFFFAOYSA-N 1 2 322.330 4.291 20 0 DIADLO CC[C@H]1CCC[N@H+](Cc2cc(Cl)cnc2Br)C1 ZINC001232963184 1039088574 /nfs/dbraw/zinc/08/85/74/1039088574.db2.gz PQOOGLCPOFKQHT-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@H]1CCC[N@@H+](Cc2cc(Cl)cnc2Br)C1 ZINC001232963184 1039088597 /nfs/dbraw/zinc/08/85/97/1039088597.db2.gz PQOOGLCPOFKQHT-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000728539908 1039105288 /nfs/dbraw/zinc/10/52/88/1039105288.db2.gz ZRGIQQIPZIQCPN-SJORKVTESA-N 1 2 305.466 4.043 20 0 DIADLO CCOC(=O)[C@@H]1CCCC[N@@H+]1C/C=C/c1c(C)cc(C)cc1C ZINC001204601252 1039111187 /nfs/dbraw/zinc/11/11/87/1039111187.db2.gz DJXLJVVFLSBSOT-SGQUHAKNSA-N 1 2 315.457 4.043 20 0 DIADLO CCOC(=O)[C@@H]1CCCC[N@H+]1C/C=C/c1c(C)cc(C)cc1C ZINC001204601252 1039111193 /nfs/dbraw/zinc/11/11/93/1039111193.db2.gz DJXLJVVFLSBSOT-SGQUHAKNSA-N 1 2 315.457 4.043 20 0 DIADLO Oc1ccccc1-c1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)on1 ZINC001213086832 1039114563 /nfs/dbraw/zinc/11/45/63/1039114563.db2.gz BYEMLZRJBMEKFY-UHFFFAOYSA-N 1 2 318.336 4.181 20 0 DIADLO CCOc1cccc2cc([C@H](C)[NH2+]Cc3nc(C)c(C)[nH]3)oc21 ZINC000583451898 1039146588 /nfs/dbraw/zinc/14/65/88/1039146588.db2.gz MDDAOOMZZCZPOY-ZDUSSCGKSA-N 1 2 313.401 4.022 20 0 DIADLO COc1cc(C)[nH+]c(CN(C)[C@@H](C)c2cccc(Cl)c2)c1 ZINC000535279127 1039175318 /nfs/dbraw/zinc/17/53/18/1039175318.db2.gz ASTSCEGWIDUMOD-ZDUSSCGKSA-N 1 2 304.821 4.245 20 0 DIADLO Clc1cnc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c(Cl)c1 ZINC000574808064 1039182544 /nfs/dbraw/zinc/18/25/44/1039182544.db2.gz QSDWHYKUDHRJTJ-AWEZNQCLSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1cnc(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c(Cl)c1 ZINC000574808064 1039182549 /nfs/dbraw/zinc/18/25/49/1039182549.db2.gz QSDWHYKUDHRJTJ-AWEZNQCLSA-N 1 2 323.223 4.042 20 0 DIADLO CCCCCC[C@@](C)(CC)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000079839764 1039205913 /nfs/dbraw/zinc/20/59/13/1039205913.db2.gz SRRXBAUWESFORU-LJQANCHMSA-N 1 2 319.493 4.433 20 0 DIADLO CC(C)Oc1ccc(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000125803357 1039272664 /nfs/dbraw/zinc/27/26/64/1039272664.db2.gz MNKREADLJLXSPX-IBGZPJMESA-N 1 2 321.424 4.076 20 0 DIADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1csc(C)n1 ZINC000126571887 1039282677 /nfs/dbraw/zinc/28/26/77/1039282677.db2.gz QMDREGAPUWAPJF-SNVBAGLBSA-N 1 2 310.850 4.354 20 0 DIADLO Cc1nc(C[NH2+][C@@H]2CCCOc3c(Cl)cc(C)cc32)cs1 ZINC000126575448 1039288908 /nfs/dbraw/zinc/28/89/08/1039288908.db2.gz HLMWNOKWLCGLIQ-OAHLLOKOSA-N 1 2 322.861 4.417 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccc(F)cc2OC(F)F)cs1 ZINC000126626780 1039314293 /nfs/dbraw/zinc/31/42/93/1039314293.db2.gz KISJZYQQBWJQDH-MRVPVSSYSA-N 1 2 316.348 4.043 20 0 DIADLO Cc1ccc2c(c1)[C@H](Nc1ccc(N3CCCC3)[nH+]c1)CCCO2 ZINC000539657857 1039314242 /nfs/dbraw/zinc/31/42/42/1039314242.db2.gz BYHHQZCPOKBESE-GOSISDBHSA-N 1 2 323.440 4.316 20 0 DIADLO CCc1cc2c(ncnc2NCCCc2cccc(C)[nH+]2)s1 ZINC000343222921 1039321800 /nfs/dbraw/zinc/32/18/00/1039321800.db2.gz OIERIFHPEHRWHI-UHFFFAOYSA-N 1 2 312.442 4.002 20 0 DIADLO O=C(c1ccc(-n2cc[nH+]c2)cc1)N1CCC[C@H]1C1CCCCC1 ZINC000080375796 1039326281 /nfs/dbraw/zinc/32/62/81/1039326281.db2.gz YXEBFGAAAGHNME-IBGZPJMESA-N 1 2 323.440 4.057 20 0 DIADLO CC(C)[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1cccnc1 ZINC000539738752 1039331241 /nfs/dbraw/zinc/33/12/41/1039331241.db2.gz ZUOBWRKKDPNPCU-LJQANCHMSA-N 1 2 310.445 4.276 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)cc1F)c1nc2ccccc2s1 ZINC000051016592 1039331326 /nfs/dbraw/zinc/33/13/26/1039331326.db2.gz BGJCCETWLAGWKJ-JTQLQIEISA-N 1 2 304.365 4.425 20 0 DIADLO C[C@@]1([NH2+]Cc2noc(-c3ccccc3)n2)CCCc2ccccc21 ZINC000539798397 1039340379 /nfs/dbraw/zinc/34/03/79/1039340379.db2.gz NAXPVDIYKWCILF-HXUWFJFHSA-N 1 2 319.408 4.078 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@]3(CCOC3)C2)c(Cl)s1 ZINC000449679482 1039343661 /nfs/dbraw/zinc/34/36/61/1039343661.db2.gz HVBPVEGUUPXDTO-ZDUSSCGKSA-N 1 2 306.258 4.057 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@]3(CCOC3)C2)c(Cl)s1 ZINC000449679482 1039343672 /nfs/dbraw/zinc/34/36/72/1039343672.db2.gz HVBPVEGUUPXDTO-ZDUSSCGKSA-N 1 2 306.258 4.057 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc(C(F)(F)F)cs2)c(C)c1 ZINC000539826241 1039352808 /nfs/dbraw/zinc/35/28/08/1039352808.db2.gz YLNFSAYFEDEIJY-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc(C(F)(F)F)cs2)c(C)c1 ZINC000539826241 1039352824 /nfs/dbraw/zinc/35/28/24/1039352824.db2.gz YLNFSAYFEDEIJY-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nccn2Cc2ccccc2)cc1C ZINC000539829229 1039358568 /nfs/dbraw/zinc/35/85/68/1039358568.db2.gz KVDBPRWYCTZJOQ-UHFFFAOYSA-N 1 2 319.452 4.180 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nccn2Cc2ccccc2)cc1C ZINC000539829229 1039358585 /nfs/dbraw/zinc/35/85/85/1039358585.db2.gz KVDBPRWYCTZJOQ-UHFFFAOYSA-N 1 2 319.452 4.180 20 0 DIADLO C[C@]1(c2ccccc2)C[N@H+](Cc2ccc(Cl)s2)CCO1 ZINC000539830155 1039362588 /nfs/dbraw/zinc/36/25/88/1039362588.db2.gz FQEYMTRKYODGCI-MRXNPFEDSA-N 1 2 307.846 4.149 20 0 DIADLO C[C@]1(c2ccccc2)C[N@@H+](Cc2ccc(Cl)s2)CCO1 ZINC000539830155 1039362608 /nfs/dbraw/zinc/36/26/08/1039362608.db2.gz FQEYMTRKYODGCI-MRXNPFEDSA-N 1 2 307.846 4.149 20 0 DIADLO Cc1nnsc1C[N@@H+](C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000565046792 1039363247 /nfs/dbraw/zinc/36/32/47/1039363247.db2.gz JEVPUODALDPXBG-JTQLQIEISA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nnsc1C[N@H+](C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000565046792 1039363259 /nfs/dbraw/zinc/36/32/59/1039363259.db2.gz JEVPUODALDPXBG-JTQLQIEISA-N 1 2 315.364 4.058 20 0 DIADLO COCCCOc1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001213089096 1039364200 /nfs/dbraw/zinc/36/42/00/1039364200.db2.gz UAEHIOSOIHSDRT-UHFFFAOYSA-N 1 2 323.396 4.236 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1ccc(Cl)s1 ZINC000539838989 1039370528 /nfs/dbraw/zinc/37/05/28/1039370528.db2.gz CERVRBGRPQANDW-SWLSCSKDSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1ccc(Cl)s1 ZINC000539838989 1039370542 /nfs/dbraw/zinc/37/05/42/1039370542.db2.gz CERVRBGRPQANDW-SWLSCSKDSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1ccc(Cl)s1 ZINC000539838987 1039371616 /nfs/dbraw/zinc/37/16/16/1039371616.db2.gz CERVRBGRPQANDW-DOMZBBRYSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1ccc(Cl)s1 ZINC000539838987 1039371628 /nfs/dbraw/zinc/37/16/28/1039371628.db2.gz CERVRBGRPQANDW-DOMZBBRYSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1nc(N[C@H](C)c2ccc(Oc3ccccc3)c(F)c2)cc[nH+]1 ZINC000462792008 1039397441 /nfs/dbraw/zinc/39/74/41/1039397441.db2.gz UTYNYUQXTHBPKW-CYBMUJFWSA-N 1 2 323.371 4.890 20 0 DIADLO Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)Nc1cc[nH+]c(C)n1 ZINC000462848612 1039405171 /nfs/dbraw/zinc/40/51/71/1039405171.db2.gz UHWNJLJVJIWQKR-LBPRGKRZSA-N 1 2 324.453 4.698 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1coc(-c2ccc(F)cc2)n1 ZINC000124279287 1039419104 /nfs/dbraw/zinc/41/91/04/1039419104.db2.gz VAKPGLSUUDUYLW-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1coc(-c2ccc(F)cc2)n1 ZINC000124279287 1039419108 /nfs/dbraw/zinc/41/91/08/1039419108.db2.gz VAKPGLSUUDUYLW-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1nc(-c2ccccc2)cs1 ZINC000540163044 1039429266 /nfs/dbraw/zinc/42/92/66/1039429266.db2.gz JDVYSRPCICTBKB-DOMZBBRYSA-N 1 2 324.453 4.261 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1nc(-c2ccccc2)cs1 ZINC000540163044 1039429274 /nfs/dbraw/zinc/42/92/74/1039429274.db2.gz JDVYSRPCICTBKB-DOMZBBRYSA-N 1 2 324.453 4.261 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@@H](C)c2cncs2)c2ccccn2)c1 ZINC000540155892 1039434565 /nfs/dbraw/zinc/43/45/65/1039434565.db2.gz KONCIEXWQZYALD-KBXCAEBGSA-N 1 2 309.438 4.287 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@H](C)c2cncs2)c2ccccn2)c1 ZINC000540155901 1039435441 /nfs/dbraw/zinc/43/54/41/1039435441.db2.gz KONCIEXWQZYALD-RDTXWAMCSA-N 1 2 309.438 4.287 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1cc(F)ccc1F ZINC000540165133 1039441971 /nfs/dbraw/zinc/44/19/71/1039441971.db2.gz WXJCKFVTGFMAMM-BJOHPYRUSA-N 1 2 309.743 4.403 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1cc(C)oc1C)c1nnc2n1CCCCC2 ZINC000278399231 1039442882 /nfs/dbraw/zinc/44/28/82/1039442882.db2.gz FLKGJXMUWRWQDL-BBRMVZONSA-N 1 2 316.449 4.016 20 0 DIADLO Brc1csc(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)n1 ZINC001137781002 1039451873 /nfs/dbraw/zinc/45/18/73/1039451873.db2.gz QDNQLPBSKYGCAH-WDEREUQCSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1csc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)n1 ZINC001137781002 1039451879 /nfs/dbraw/zinc/45/18/79/1039451879.db2.gz QDNQLPBSKYGCAH-WDEREUQCSA-N 1 2 315.280 4.060 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nnc(-c3ccc(F)cc3)[nH]2)cc1C ZINC000540219653 1039459734 /nfs/dbraw/zinc/45/97/34/1039459734.db2.gz HENYBSDCSWWYCZ-CQSZACIVSA-N 1 2 324.403 4.078 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nc(-c3ccc(F)cc3)n[nH]2)cc1C ZINC000540219653 1039459743 /nfs/dbraw/zinc/45/97/43/1039459743.db2.gz HENYBSDCSWWYCZ-CQSZACIVSA-N 1 2 324.403 4.078 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1csc(C(F)(F)F)c1 ZINC000926534328 1039485236 /nfs/dbraw/zinc/48/52/36/1039485236.db2.gz YHQALLHVNUPNMY-ZJUUUORDSA-N 1 2 317.380 4.395 20 0 DIADLO COC[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccc(F)cc1 ZINC000540478660 1039502230 /nfs/dbraw/zinc/50/22/30/1039502230.db2.gz SYMXDKCQPOPGOX-AWEZNQCLSA-N 1 2 322.449 4.057 20 0 DIADLO c1[nH+]c(-c2cccc(NC3CCSCC3)c2)n2c1CCCC2 ZINC000278491961 1039502789 /nfs/dbraw/zinc/50/27/89/1039502789.db2.gz PRRCYGOLMCUUAT-UHFFFAOYSA-N 1 2 313.470 4.194 20 0 DIADLO COc1ccc2oc(C[N@@H+]3CCOC[C@@H]3c3ccccc3)cc2c1 ZINC000583950600 1039519260 /nfs/dbraw/zinc/51/92/60/1039519260.db2.gz KSFISWDNMZWTAI-LJQANCHMSA-N 1 2 323.392 4.015 20 0 DIADLO COc1ccc2oc(C[N@H+]3CCOC[C@@H]3c3ccccc3)cc2c1 ZINC000583950600 1039519270 /nfs/dbraw/zinc/51/92/70/1039519270.db2.gz KSFISWDNMZWTAI-LJQANCHMSA-N 1 2 323.392 4.015 20 0 DIADLO CC(C)[C@@]1(C)C[C@@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000685242866 1039529998 /nfs/dbraw/zinc/52/99/98/1039529998.db2.gz GCPVEMAZDFBQDD-VQIMIIECSA-N 1 2 322.412 4.131 20 0 DIADLO Cc1[nH]c(CN(Cc2ccc(Cl)c(Cl)c2)C2CC2)[nH+]c1C ZINC000628149803 1039543146 /nfs/dbraw/zinc/54/31/46/1039543146.db2.gz OBCWXUYJNTYIHF-UHFFFAOYSA-N 1 2 324.255 4.498 20 0 DIADLO Cc1cc(NCc2cccc(-c3cccnc3)c2)nc(C(C)C)[nH+]1 ZINC000463575290 1039556345 /nfs/dbraw/zinc/55/63/45/1039556345.db2.gz LQMNLEXOJVVWIJ-UHFFFAOYSA-N 1 2 318.424 4.583 20 0 DIADLO C[C@H](Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)c1cccnc1 ZINC000278590651 1039575455 /nfs/dbraw/zinc/57/54/55/1039575455.db2.gz YVNGNERQKYMOOS-HNNXBMFYSA-N 1 2 318.424 4.455 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[NH2+]Cc1ncc(C(F)(F)F)s1 ZINC000278604560 1039584311 /nfs/dbraw/zinc/58/43/11/1039584311.db2.gz ICUBANZCTCSQJM-NSHDSACASA-N 1 2 316.323 4.078 20 0 DIADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1nc2ccccc2s1 ZINC000541085714 1039619068 /nfs/dbraw/zinc/61/90/68/1039619068.db2.gz JDFUARPCDLFRNP-ZDUSSCGKSA-N 1 2 310.422 4.079 20 0 DIADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1nc2ccccc2s1 ZINC000541085714 1039619072 /nfs/dbraw/zinc/61/90/72/1039619072.db2.gz JDFUARPCDLFRNP-ZDUSSCGKSA-N 1 2 310.422 4.079 20 0 DIADLO CCC(C)(C)[C@@H]1CCC[N@@H+]1Cc1ncc(Br)s1 ZINC000541235212 1039641738 /nfs/dbraw/zinc/64/17/38/1039641738.db2.gz ISBKMQGAFQDJTQ-JTQLQIEISA-N 1 2 317.296 4.306 20 0 DIADLO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1ncc(Br)s1 ZINC000541235212 1039641747 /nfs/dbraw/zinc/64/17/47/1039641747.db2.gz ISBKMQGAFQDJTQ-JTQLQIEISA-N 1 2 317.296 4.306 20 0 DIADLO Oc1cccc2ccc(/C=C\c3cc(-n4cc[nH+]c4)cs3)nc12 ZINC000541259749 1039648178 /nfs/dbraw/zinc/64/81/78/1039648178.db2.gz RTVDERWWFGFZJJ-SREVYHEPSA-N 1 2 319.389 4.358 20 0 DIADLO COc1cccc([C@@H](C)[NH2+]Cc2ncc(C(F)(F)F)s2)c1 ZINC000278717669 1039672463 /nfs/dbraw/zinc/67/24/63/1039672463.db2.gz SNYAQYPDVHLHCS-SECBINFHSA-N 1 2 316.348 4.021 20 0 DIADLO Cc1cc(C[N@H+](CC(F)F)CC2CCC2)cc2cccnc12 ZINC000541536032 1039700726 /nfs/dbraw/zinc/70/07/26/1039700726.db2.gz SFFRTBPMFBXGQN-UHFFFAOYSA-N 1 2 304.384 4.410 20 0 DIADLO Cc1cc(C[N@@H+](CC(F)F)CC2CCC2)cc2cccnc12 ZINC000541536032 1039700745 /nfs/dbraw/zinc/70/07/45/1039700745.db2.gz SFFRTBPMFBXGQN-UHFFFAOYSA-N 1 2 304.384 4.410 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](CC(C)C)c2cccs2)n1 ZINC000541626065 1039718369 /nfs/dbraw/zinc/71/83/69/1039718369.db2.gz RGVIOUQOBSEXFN-ZDUSSCGKSA-N 1 2 307.463 4.351 20 0 DIADLO CCc1ccc(-c2noc([C@@H](C)[NH2+][C@@H](C)c3cccnc3)n2)cc1 ZINC000541691548 1039729519 /nfs/dbraw/zinc/72/95/19/1039729519.db2.gz PBOPGAQGLVWHFY-UONOGXRCSA-N 1 2 322.412 4.106 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)o1 ZINC000083422611 1039735095 /nfs/dbraw/zinc/73/50/95/1039735095.db2.gz RNVFFQOEGRAYKI-GFCCVEGCSA-N 1 2 317.820 4.136 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)o1 ZINC000083422611 1039735111 /nfs/dbraw/zinc/73/51/11/1039735111.db2.gz RNVFFQOEGRAYKI-GFCCVEGCSA-N 1 2 317.820 4.136 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2nccn2CC(C)C)C2CCC2)o1 ZINC000541735733 1039734952 /nfs/dbraw/zinc/73/49/52/1039734952.db2.gz CFOAOYMIOWANHK-SFHVURJKSA-N 1 2 301.434 4.072 20 0 DIADLO CCC[C@@H]1CCCC[N@@H+]1Cc1ncc(Br)s1 ZINC000541780029 1039742408 /nfs/dbraw/zinc/74/24/08/1039742408.db2.gz WWIIBNVJQGATHV-SNVBAGLBSA-N 1 2 303.269 4.060 20 0 DIADLO CCC[C@@H]1CCCC[N@H+]1Cc1ncc(Br)s1 ZINC000541780029 1039742424 /nfs/dbraw/zinc/74/24/24/1039742424.db2.gz WWIIBNVJQGATHV-SNVBAGLBSA-N 1 2 303.269 4.060 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](C)c2cc3cc(C)c(C)cc3o2)s1 ZINC000541882190 1039754468 /nfs/dbraw/zinc/75/44/68/1039754468.db2.gz LKNJJHFURKTFTR-NSHDSACASA-N 1 2 301.415 4.060 20 0 DIADLO Cc1cc(N[C@@H](C)c2cccc(N3CCCC3)c2)nc(C2CC2)[nH+]1 ZINC000088758992 1039768708 /nfs/dbraw/zinc/76/87/08/1039768708.db2.gz AFKUYNLIKLWKNT-HNNXBMFYSA-N 1 2 322.456 4.436 20 0 DIADLO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1nc3c(s1)CCCC3)CO2 ZINC000090452316 1039797383 /nfs/dbraw/zinc/79/73/83/1039797383.db2.gz MVXGHHNKJDBXSX-DOMZBBRYSA-N 1 2 314.454 4.115 20 0 DIADLO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1nc3c(s1)CCCC3)CO2 ZINC000090452313 1039799017 /nfs/dbraw/zinc/79/90/17/1039799017.db2.gz MVXGHHNKJDBXSX-SWLSCSKDSA-N 1 2 314.454 4.115 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccccc2OC(F)F)c(C)s1 ZINC000090888618 1039805028 /nfs/dbraw/zinc/80/50/28/1039805028.db2.gz NWZJQQSGDLPEFG-SECBINFHSA-N 1 2 312.385 4.212 20 0 DIADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ncccc1F ZINC000090721406 1039816091 /nfs/dbraw/zinc/81/60/91/1039816091.db2.gz RUILGQLHBUKSHT-LLVKDONJSA-N 1 2 308.784 4.124 20 0 DIADLO O=C(CCC1CC1)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000347429701 1039827925 /nfs/dbraw/zinc/82/79/25/1039827925.db2.gz CEGGOTARSWAJOB-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO CC(C)(C)SCCCC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000151665589 1039852668 /nfs/dbraw/zinc/85/26/68/1039852668.db2.gz JTRSGEGDDSCCCK-UHFFFAOYSA-N 1 2 317.458 4.327 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(-c2ccccc2F)o1)c1ccsc1 ZINC000669937308 1039869455 /nfs/dbraw/zinc/86/94/55/1039869455.db2.gz ZYRACZBDRBFKNU-LLVKDONJSA-N 1 2 302.374 4.393 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1nnc(-c2cccs2)o1)c1ccsc1 ZINC000669937936 1039871330 /nfs/dbraw/zinc/87/13/30/1039871330.db2.gz YFPOJBJFIQDWMH-NXEZZACHSA-N 1 2 305.428 4.271 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccsc1)c1nnc(-c2cccs2)o1 ZINC000669937938 1039871964 /nfs/dbraw/zinc/87/19/64/1039871964.db2.gz YFPOJBJFIQDWMH-VHSXEESVSA-N 1 2 305.428 4.271 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(-c2ccccc2Cl)o1)c1ccsc1 ZINC000669938767 1039874315 /nfs/dbraw/zinc/87/43/15/1039874315.db2.gz XQXIPVICXRIKPN-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccc(F)cn1 ZINC000092720084 1039876686 /nfs/dbraw/zinc/87/66/86/1039876686.db2.gz LGGNYWOLMXGRKW-LIRRHRJNSA-N 1 2 307.372 4.056 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2ccccc2)n1)c1ccc(F)cn1 ZINC000092741776 1039880075 /nfs/dbraw/zinc/88/00/75/1039880075.db2.gz YLWRIYAMCSKZMH-LBPRGKRZSA-N 1 2 313.401 4.195 20 0 DIADLO Fc1cccc(Br)c1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000093191647 1039895485 /nfs/dbraw/zinc/89/54/85/1039895485.db2.gz SRDZMBMXTJDJAF-HNNXBMFYSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1cccc(Br)c1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000093191647 1039895508 /nfs/dbraw/zinc/89/55/08/1039895508.db2.gz SRDZMBMXTJDJAF-HNNXBMFYSA-N 1 2 323.209 4.253 20 0 DIADLO CCCc1csc(CNc2ccc(N3CCCCC3)c[nH+]2)n1 ZINC000491954056 1039898099 /nfs/dbraw/zinc/89/80/99/1039898099.db2.gz IGGXVSQZVZEUGI-UHFFFAOYSA-N 1 2 316.474 4.093 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000093234620 1039898207 /nfs/dbraw/zinc/89/82/07/1039898207.db2.gz CMYWUNXOUYPIBU-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)[C@H](C)c1cccnc1 ZINC000093234620 1039898232 /nfs/dbraw/zinc/89/82/32/1039898232.db2.gz CMYWUNXOUYPIBU-GFCCVEGCSA-N 1 2 313.426 4.300 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)cc1O ZINC000093686112 1039900166 /nfs/dbraw/zinc/90/01/66/1039900166.db2.gz HEPMOHZHSMCSMX-HNNXBMFYSA-N 1 2 303.789 4.001 20 0 DIADLO COc1ccc(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)cc1O ZINC000093686112 1039900172 /nfs/dbraw/zinc/90/01/72/1039900172.db2.gz HEPMOHZHSMCSMX-HNNXBMFYSA-N 1 2 303.789 4.001 20 0 DIADLO CC(=O)Nc1ccccc1C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000093686294 1039901505 /nfs/dbraw/zinc/90/15/05/1039901505.db2.gz QZXPQCVVNBVFRO-SFHVURJKSA-N 1 2 314.816 4.245 20 0 DIADLO CC(=O)Nc1ccccc1C[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000093686294 1039901524 /nfs/dbraw/zinc/90/15/24/1039901524.db2.gz QZXPQCVVNBVFRO-SFHVURJKSA-N 1 2 314.816 4.245 20 0 DIADLO CC(C)([NH2+]Cc1c[nH]c(-c2ccccc2)n1)c1ccccc1F ZINC000491997688 1039902589 /nfs/dbraw/zinc/90/25/89/1039902589.db2.gz IJBKOYUKGHYHMO-UHFFFAOYSA-N 1 2 309.388 4.241 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@H](C)C(C)(C)C)no1)c1ccccc1 ZINC000685315085 1039914963 /nfs/dbraw/zinc/91/49/63/1039914963.db2.gz IVOWRLOXMVLXRJ-DZGCQCFKSA-N 1 2 301.434 4.260 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@H](C)C(C)(C)C)no1)c1ccccc1 ZINC000685315085 1039914972 /nfs/dbraw/zinc/91/49/72/1039914972.db2.gz IVOWRLOXMVLXRJ-DZGCQCFKSA-N 1 2 301.434 4.260 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2ccccc2Br)n1 ZINC000069168363 1039992972 /nfs/dbraw/zinc/99/29/72/1039992972.db2.gz UEHQCMCXWJEDPA-SNVBAGLBSA-N 1 2 311.248 4.065 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C/c2cc(F)c(F)c(F)c2)c(C)[nH+]1 ZINC000492570800 1039982589 /nfs/dbraw/zinc/98/25/89/1039982589.db2.gz XTBIZTHCASMBJV-SNAWJCMRSA-N 1 2 320.314 4.076 20 0 DIADLO C[N@H+](Cc1c(Cl)ccc(Cl)c1Cl)[C@H]1CCCOC1 ZINC000685438557 1040053471 /nfs/dbraw/zinc/05/34/71/1040053471.db2.gz FOPPDCBZFAAZCB-VIFPVBQESA-N 1 2 308.636 4.258 20 0 DIADLO C[N@@H+](Cc1c(Cl)ccc(Cl)c1Cl)[C@H]1CCCOC1 ZINC000685438557 1040053486 /nfs/dbraw/zinc/05/34/86/1040053486.db2.gz FOPPDCBZFAAZCB-VIFPVBQESA-N 1 2 308.636 4.258 20 0 DIADLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2ccc(C(C)(C)C)s2)n1 ZINC000685448291 1040056383 /nfs/dbraw/zinc/05/63/83/1040056383.db2.gz ZWJJDYANGVJJSG-ZDUSSCGKSA-N 1 2 305.447 4.074 20 0 DIADLO Cc1noc([C@@H]2CCC[N@H+]2Cc2ccc(C(C)(C)C)s2)n1 ZINC000685448291 1040056398 /nfs/dbraw/zinc/05/63/98/1040056398.db2.gz ZWJJDYANGVJJSG-ZDUSSCGKSA-N 1 2 305.447 4.074 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nc2c(s1)CCCC2 ZINC000685470012 1040068695 /nfs/dbraw/zinc/06/86/95/1040068695.db2.gz FIDPMIFWXKZOOI-HNNXBMFYSA-N 1 2 301.459 4.000 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nc2c(s1)CCCC2 ZINC000685470012 1040068707 /nfs/dbraw/zinc/06/87/07/1040068707.db2.gz FIDPMIFWXKZOOI-HNNXBMFYSA-N 1 2 301.459 4.000 20 0 DIADLO COc1cccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)c1F ZINC000685473629 1040071387 /nfs/dbraw/zinc/07/13/87/1040071387.db2.gz YFVUJWYRHXRMHI-INIZCTEOSA-N 1 2 305.418 4.479 20 0 DIADLO COc1cccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)c1F ZINC000685473629 1040071402 /nfs/dbraw/zinc/07/14/02/1040071402.db2.gz YFVUJWYRHXRMHI-INIZCTEOSA-N 1 2 305.418 4.479 20 0 DIADLO O=C(C/C=C/c1cccc(F)c1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000176302299 1040072365 /nfs/dbraw/zinc/07/23/65/1040072365.db2.gz CVHKPWKXGCGXOX-DUXPYHPUSA-N 1 2 321.355 4.258 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2ccc(F)cc2Cl)C2CC2)s1 ZINC000136225911 1040080053 /nfs/dbraw/zinc/08/00/53/1040080053.db2.gz UXSZBDGDAZEEED-AWEZNQCLSA-N 1 2 310.825 4.485 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2cc3cnccc3o2)o1 ZINC000657892307 1040082736 /nfs/dbraw/zinc/08/27/36/1040082736.db2.gz XPBSKMPNRGYCDI-IUODEOHRSA-N 1 2 314.385 4.022 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2cc3cnccc3o2)o1 ZINC000657892309 1040084319 /nfs/dbraw/zinc/08/43/19/1040084319.db2.gz XPBSKMPNRGYCDI-SWLSCSKDSA-N 1 2 314.385 4.022 20 0 DIADLO Fc1cc(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c(F)cc1Cl ZINC001140699413 1040104383 /nfs/dbraw/zinc/10/43/83/1040104383.db2.gz ORCKDDKPSXBPAJ-GFCCVEGCSA-N 1 2 313.697 4.187 20 0 DIADLO Fc1cc(C[N@H+]2CC[C@@H](F)C(F)(F)CC2)c(F)cc1Cl ZINC001140699413 1040104381 /nfs/dbraw/zinc/10/43/81/1040104381.db2.gz ORCKDDKPSXBPAJ-GFCCVEGCSA-N 1 2 313.697 4.187 20 0 DIADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1ccccc1Br ZINC000294267367 1040117011 /nfs/dbraw/zinc/11/70/11/1040117011.db2.gz XTDFTPCYHOMLGA-UHIISALHSA-N 1 2 320.234 4.002 20 0 DIADLO CCCOC1CC[NH+](Cc2cc(F)c(Cl)cc2F)CC1 ZINC001140701699 1040120080 /nfs/dbraw/zinc/12/00/80/1040120080.db2.gz WTIHUDWNUKBIOQ-UHFFFAOYSA-N 1 2 303.780 4.009 20 0 DIADLO Cc1nc(C)c(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)o1 ZINC000685567329 1040131806 /nfs/dbraw/zinc/13/18/06/1040131806.db2.gz YNWYJGPOKLULEC-UHFFFAOYSA-N 1 2 310.397 4.395 20 0 DIADLO Cc1nc(C)c(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)o1 ZINC000685567329 1040131820 /nfs/dbraw/zinc/13/18/20/1040131820.db2.gz YNWYJGPOKLULEC-UHFFFAOYSA-N 1 2 310.397 4.395 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)no1 ZINC000685564761 1040132839 /nfs/dbraw/zinc/13/28/39/1040132839.db2.gz JGOSKIVRNZADPX-INIZCTEOSA-N 1 2 316.470 4.262 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CCS[C@H](c3ccccc3)C2)no1 ZINC000685564761 1040132847 /nfs/dbraw/zinc/13/28/47/1040132847.db2.gz JGOSKIVRNZADPX-INIZCTEOSA-N 1 2 316.470 4.262 20 0 DIADLO COc1ccc(C[N@H+](C)[C@H](C)c2ncc(C(C)(C)C)o2)cc1C ZINC000177671837 1040133300 /nfs/dbraw/zinc/13/33/00/1040133300.db2.gz UXJASTLEKOXXTI-CQSZACIVSA-N 1 2 316.445 4.482 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@H](C)c2ncc(C(C)(C)C)o2)cc1C ZINC000177671837 1040133310 /nfs/dbraw/zinc/13/33/10/1040133310.db2.gz UXJASTLEKOXXTI-CQSZACIVSA-N 1 2 316.445 4.482 20 0 DIADLO Cc1nc(C)c(C[N@H+](CCC(F)(F)F)Cc2ccccc2)o1 ZINC000685575198 1040141216 /nfs/dbraw/zinc/14/12/16/1040141216.db2.gz CPFJRPQGGHMFLM-UHFFFAOYSA-N 1 2 312.335 4.246 20 0 DIADLO Cc1nc(C)c(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)o1 ZINC000685575198 1040141234 /nfs/dbraw/zinc/14/12/34/1040141234.db2.gz CPFJRPQGGHMFLM-UHFFFAOYSA-N 1 2 312.335 4.246 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@@H](C)c3ccc(F)cc3Cl)cn2c1 ZINC000178725766 1040149399 /nfs/dbraw/zinc/14/93/99/1040149399.db2.gz YEKWXRAZIPTELG-LBPRGKRZSA-N 1 2 317.795 4.286 20 0 DIADLO C/C(=C/c1ccccc1OC(F)F)C[NH2+]C(C)(C)C(F)F ZINC000685621580 1040159643 /nfs/dbraw/zinc/15/96/43/1040159643.db2.gz FTOOPDXBENEQCW-NTMALXAHSA-N 1 2 305.315 4.325 20 0 DIADLO C[C@H]([NH2+]Cc1cocn1)c1ccc(-c2c(F)cccc2F)cc1 ZINC000685652800 1040188959 /nfs/dbraw/zinc/18/89/59/1040188959.db2.gz WGXFEEBUMVPMIJ-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+][C@H]1C[C@@H](C)n2ncnc21 ZINC000658104125 1040314714 /nfs/dbraw/zinc/31/47/14/1040314714.db2.gz ZUSHNLYVMZDULF-WWGRRREGSA-N 1 2 324.428 4.252 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2cccc(OC3CC3)c2F)c(C)s1 ZINC000658171915 1040343519 /nfs/dbraw/zinc/34/35/19/1040343519.db2.gz NDOWWULHPMVUJK-JTQLQIEISA-N 1 2 320.433 4.291 20 0 DIADLO COc1ccc([C@H](C)[NH2+]CC(F)(F)C(C)(C)C)cc1OC ZINC000658337072 1040427723 /nfs/dbraw/zinc/42/77/23/1040427723.db2.gz LBUOCDPKKDDBPM-NSHDSACASA-N 1 2 301.377 4.036 20 0 DIADLO C[C@H]([NH2+]Cc1c(O)ccc(Cl)c1F)c1cccc(F)c1F ZINC000191528634 1040451877 /nfs/dbraw/zinc/45/18/77/1040451877.db2.gz VNXLMIWEXXFDMJ-QMMMGPOBSA-N 1 2 315.722 4.314 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cc1ccnn1-c1ccccc1 ZINC000448221740 1040485160 /nfs/dbraw/zinc/48/51/60/1040485160.db2.gz BOEIBGRFZXPADI-UHFFFAOYSA-N 1 2 317.845 4.219 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1ccnn1-c1ccccc1 ZINC000448221740 1040485169 /nfs/dbraw/zinc/48/51/69/1040485169.db2.gz BOEIBGRFZXPADI-UHFFFAOYSA-N 1 2 317.845 4.219 20 0 DIADLO CCCc1ncc(C[NH2+]Cc2oc3ccccc3c2Cl)o1 ZINC000631152751 1040542801 /nfs/dbraw/zinc/54/28/01/1040542801.db2.gz LMUKLPBAKVCLCP-UHFFFAOYSA-N 1 2 304.777 4.317 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+]Cc2cc(Cl)cc(Cl)c2)nn1 ZINC000926671268 1040602097 /nfs/dbraw/zinc/60/20/97/1040602097.db2.gz IAAGSEZPTGBEFW-JTQLQIEISA-N 1 2 313.232 4.017 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2cc(Cl)cc(Cl)c2)nn1 ZINC000926671276 1040603814 /nfs/dbraw/zinc/60/38/14/1040603814.db2.gz IAAGSEZPTGBEFW-SNVBAGLBSA-N 1 2 313.232 4.017 20 0 DIADLO CC(C)Cc1ccc(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000612504010 1040615572 /nfs/dbraw/zinc/61/55/72/1040615572.db2.gz ALKOTKRSTHHIHP-UHFFFAOYSA-N 1 2 319.408 4.323 20 0 DIADLO FC(F)(F)c1nc(C[NH2+]Cc2ccc(Cl)s2)cs1 ZINC000892500490 1040619364 /nfs/dbraw/zinc/61/93/64/1040619364.db2.gz WUHBATJCSRNFFJ-UHFFFAOYSA-N 1 2 312.769 4.167 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCC1(F)F)c1cc(Br)cs1 ZINC000309506255 1040710745 /nfs/dbraw/zinc/71/07/45/1040710745.db2.gz BZRGLFOZZWAIER-XCBNKYQSSA-N 1 2 310.207 4.349 20 0 DIADLO CSc1ccc(Cl)c(NC(=O)[C@H]2CC[N@@H+]2C2CCCC2)c1 ZINC000636159053 1040727020 /nfs/dbraw/zinc/72/70/20/1040727020.db2.gz BLZSMCWAYKRJSP-OAHLLOKOSA-N 1 2 324.877 4.017 20 0 DIADLO CSc1ccc(Cl)c(NC(=O)[C@H]2CC[N@H+]2C2CCCC2)c1 ZINC000636159053 1040727033 /nfs/dbraw/zinc/72/70/33/1040727033.db2.gz BLZSMCWAYKRJSP-OAHLLOKOSA-N 1 2 324.877 4.017 20 0 DIADLO CC[N@H+](Cc1[nH]ncc1C)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000685836164 1040773712 /nfs/dbraw/zinc/77/37/12/1040773712.db2.gz SDUFPOOJYBAFGR-HXUWFJFHSA-N 1 2 323.415 4.469 20 0 DIADLO CC[N@@H+](Cc1[nH]ncc1C)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000685836164 1040773722 /nfs/dbraw/zinc/77/37/22/1040773722.db2.gz SDUFPOOJYBAFGR-HXUWFJFHSA-N 1 2 323.415 4.469 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccn(C)n1 ZINC000414057905 1040800114 /nfs/dbraw/zinc/80/01/14/1040800114.db2.gz SIOANYWAVVNXLU-DTWKUNHWSA-N 1 2 316.207 4.278 20 0 DIADLO CCC[C@@H]([NH2+][C@H](C)c1cc2n(n1)CCC2)c1ccc(F)cc1F ZINC000414097631 1040857791 /nfs/dbraw/zinc/85/77/91/1040857791.db2.gz IIFKAMUXUFBLLJ-SJKOYZFVSA-N 1 2 319.399 4.300 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cncc(F)c1)c1ncc(-c2ccccc2)n1C ZINC000414139887 1040915740 /nfs/dbraw/zinc/91/57/40/1040915740.db2.gz IJXWATVDOJQEKM-KBPBESRZSA-N 1 2 324.403 4.033 20 0 DIADLO CCOc1ccc(CCC2CCN(c3cccc[nH+]3)CC2)cc1 ZINC000613398287 1040916909 /nfs/dbraw/zinc/91/69/09/1040916909.db2.gz SMCMGVBWAIARJZ-UHFFFAOYSA-N 1 2 310.441 4.330 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccc(CSC(F)F)o2)s1 ZINC000174626543 1040994854 /nfs/dbraw/zinc/99/48/54/1040994854.db2.gz JHEUKKRJZGGYLC-UHFFFAOYSA-N 1 2 318.414 4.044 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)CC(=O)NC1CCC(C)CC1 ZINC000613485525 1040996745 /nfs/dbraw/zinc/99/67/45/1040996745.db2.gz ZFEOEHVTGCNNBI-SLTAFYQDSA-N 1 2 322.880 4.028 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)CC(=O)NC1CCC(C)CC1 ZINC000613485525 1040996762 /nfs/dbraw/zinc/99/67/62/1040996762.db2.gz ZFEOEHVTGCNNBI-SLTAFYQDSA-N 1 2 322.880 4.028 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)CCc2ccccc2F)c(C)[nH+]1 ZINC000175102295 1041032074 /nfs/dbraw/zinc/03/20/74/1041032074.db2.gz ZGPUALKMWKTWMQ-GFCCVEGCSA-N 1 2 314.404 4.353 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@@]23CCCc2ccccc23)c(C)[nH+]1 ZINC000175102221 1041033201 /nfs/dbraw/zinc/03/32/01/1041033201.db2.gz XNYAOQCQVHCUKB-WIYYLYMNSA-N 1 2 320.436 4.240 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001131515775 1041053984 /nfs/dbraw/zinc/05/39/84/1041053984.db2.gz BFJTUYIPIMAZFN-HUUCEWRRSA-N 1 2 319.408 4.262 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000170838316 1041054379 /nfs/dbraw/zinc/05/43/79/1041054379.db2.gz AZHFDQUSHCLLRV-MRXNPFEDSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000170838316 1041054389 /nfs/dbraw/zinc/05/43/89/1041054389.db2.gz AZHFDQUSHCLLRV-MRXNPFEDSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)c1ccc(/C=C/CC(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001131515884 1041054975 /nfs/dbraw/zinc/05/49/75/1041054975.db2.gz DXLSEGBQXGLYGT-ONEGZZNKSA-N 1 2 319.408 4.500 20 0 DIADLO Clc1cccc2c(N3CCNc4ccccc4C3)cc[nH+]c12 ZINC000685903907 1041099693 /nfs/dbraw/zinc/09/96/93/1041099693.db2.gz VQZWBKNHGHADCU-UHFFFAOYSA-N 1 2 309.800 4.320 20 0 DIADLO C[C@H]1C[C@H]([NH2+]Cc2nnc(C3CC3)s2)c2ccsc2S1 ZINC000414329516 1041137072 /nfs/dbraw/zinc/13/70/72/1041137072.db2.gz QRBFHCPMDOQYQW-KWQFWETISA-N 1 2 323.512 4.192 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccc(Cl)cc2)no1)c1ccccc1 ZINC000007335658 1041180333 /nfs/dbraw/zinc/18/03/33/1041180333.db2.gz MQKGQPXSYWEWAB-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO C[C@@]1(c2ccccc2)CCC[N@H+](Cc2csc(Cl)n2)C1 ZINC000809575325 1041190536 /nfs/dbraw/zinc/19/05/36/1041190536.db2.gz YXJGMJPPTRQPRA-MRXNPFEDSA-N 1 2 306.862 4.350 20 0 DIADLO C[C@@]1(c2ccccc2)CCC[N@@H+](Cc2csc(Cl)n2)C1 ZINC000809575325 1041190544 /nfs/dbraw/zinc/19/05/44/1041190544.db2.gz YXJGMJPPTRQPRA-MRXNPFEDSA-N 1 2 306.862 4.350 20 0 DIADLO C[C@]1(c2ccccc2)CCC[N@H+](Cc2csc(Cl)n2)C1 ZINC000809575324 1041190702 /nfs/dbraw/zinc/19/07/02/1041190702.db2.gz YXJGMJPPTRQPRA-INIZCTEOSA-N 1 2 306.862 4.350 20 0 DIADLO C[C@]1(c2ccccc2)CCC[N@@H+](Cc2csc(Cl)n2)C1 ZINC000809575324 1041190709 /nfs/dbraw/zinc/19/07/09/1041190709.db2.gz YXJGMJPPTRQPRA-INIZCTEOSA-N 1 2 306.862 4.350 20 0 DIADLO c1cn(Cc2ccc(NCc3nccc4ccccc43)cc2)c[nH+]1 ZINC001167702720 1041205394 /nfs/dbraw/zinc/20/53/94/1041205394.db2.gz FYRUWCGGDGUXSP-UHFFFAOYSA-N 1 2 314.392 4.092 20 0 DIADLO Cn1cc(C[N@@H+]2Cc3cccc(Cl)c3C2)c(-c2ccccc2)n1 ZINC000809771958 1041236192 /nfs/dbraw/zinc/23/61/92/1041236192.db2.gz RDTVISKVSXXHJE-UHFFFAOYSA-N 1 2 323.827 4.256 20 0 DIADLO Cn1cc(C[N@H+]2Cc3cccc(Cl)c3C2)c(-c2ccccc2)n1 ZINC000809771958 1041236208 /nfs/dbraw/zinc/23/62/08/1041236208.db2.gz RDTVISKVSXXHJE-UHFFFAOYSA-N 1 2 323.827 4.256 20 0 DIADLO Cc1nonc1C[NH2+]Cc1ccc(-c2ccccc2Cl)s1 ZINC000809743817 1041242292 /nfs/dbraw/zinc/24/22/92/1041242292.db2.gz HIHKTYDWEIWOGO-UHFFFAOYSA-N 1 2 319.817 4.050 20 0 DIADLO CCc1nn(C)c(Cl)c1C[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000809783169 1041254867 /nfs/dbraw/zinc/25/48/67/1041254867.db2.gz TVSHPZMYETVNGB-CQSZACIVSA-N 1 2 323.893 4.281 20 0 DIADLO CCc1nn(C)c(Cl)c1C[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000809783169 1041254879 /nfs/dbraw/zinc/25/48/79/1041254879.db2.gz TVSHPZMYETVNGB-CQSZACIVSA-N 1 2 323.893 4.281 20 0 DIADLO CSc1ccc(C[NH2+]Cc2csc(C(F)(F)F)n2)cc1 ZINC000892674884 1041287855 /nfs/dbraw/zinc/28/78/55/1041287855.db2.gz RSOHQYDWUUMZAH-UHFFFAOYSA-N 1 2 318.389 4.174 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@@H+]2CCC(F)(F)[C@H](C)C2)cc1 ZINC000810044518 1041301727 /nfs/dbraw/zinc/30/17/27/1041301727.db2.gz CALOQXISVZTISG-UONOGXRCSA-N 1 2 324.415 4.116 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@H+]2CCC(F)(F)[C@H](C)C2)cc1 ZINC000810044518 1041301735 /nfs/dbraw/zinc/30/17/35/1041301735.db2.gz CALOQXISVZTISG-UONOGXRCSA-N 1 2 324.415 4.116 20 0 DIADLO COc1ccc([NH2+]C[C@@H]2CC(C)=C[C@H](C)C2)c(OC)c1OC ZINC000810149897 1041325164 /nfs/dbraw/zinc/32/51/64/1041325164.db2.gz WTFMEEXUDCKZNZ-JSGCOSHPSA-N 1 2 305.418 4.117 20 0 DIADLO COC[C@@H](Nc1ccc([NH+](C)C)cc1)c1cccc(Cl)c1 ZINC000810233772 1041345170 /nfs/dbraw/zinc/34/51/70/1041345170.db2.gz OVMBLPXXKBAWFH-QGZVFWFLSA-N 1 2 304.821 4.206 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nnc(C(F)(F)F)s1)c1ccccc1 ZINC000659824457 1041380296 /nfs/dbraw/zinc/38/02/96/1041380296.db2.gz CFNJCEQQGBPVKD-LBPRGKRZSA-N 1 2 315.364 4.044 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@@H](C)c1ccccc1OC(F)F ZINC000924603050 1041395093 /nfs/dbraw/zinc/39/50/93/1041395093.db2.gz ZRLFBEHZZRYSDE-GXFFZTMASA-N 1 2 322.355 4.313 20 0 DIADLO CCOc1ccc(F)c(F)c1C[N@H+](C)Cc1ccc(OC)cc1 ZINC001143487172 1041396316 /nfs/dbraw/zinc/39/63/16/1041396316.db2.gz JYQOPJWMXFYOBE-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CCOc1ccc(F)c(F)c1C[N@@H+](C)Cc1ccc(OC)cc1 ZINC001143487172 1041396324 /nfs/dbraw/zinc/39/63/24/1041396324.db2.gz JYQOPJWMXFYOBE-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CCOc1ccc(F)c(F)c1C[NH+]1CCC(C(F)(F)F)CC1 ZINC001143488143 1041401521 /nfs/dbraw/zinc/40/15/21/1041401521.db2.gz QAAKNJAAUVZMBC-UHFFFAOYSA-N 1 2 323.305 4.138 20 0 DIADLO CCCCc1noc([C@@H](C)[N@@H+]2CCC[C@H]2c2ccsc2)n1 ZINC000613670592 1041421065 /nfs/dbraw/zinc/42/10/65/1041421065.db2.gz HRZUZZCOQFTWOV-OCCSQVGLSA-N 1 2 305.447 4.372 20 0 DIADLO CCCCc1noc([C@@H](C)[N@H+]2CCC[C@H]2c2ccsc2)n1 ZINC000613670592 1041421070 /nfs/dbraw/zinc/42/10/70/1041421070.db2.gz HRZUZZCOQFTWOV-OCCSQVGLSA-N 1 2 305.447 4.372 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2occc2Br)s1 ZINC000769317451 1041439421 /nfs/dbraw/zinc/43/94/21/1041439421.db2.gz QGVCENWVEGPQHT-UHFFFAOYSA-N 1 2 300.221 4.044 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2occc2Br)s1 ZINC000769317451 1041439428 /nfs/dbraw/zinc/43/94/28/1041439428.db2.gz QGVCENWVEGPQHT-UHFFFAOYSA-N 1 2 300.221 4.044 20 0 DIADLO C[N@H+](Cc1ccco1)Cc1cc(-c2ccc(Cl)cc2)no1 ZINC000042669826 1041439683 /nfs/dbraw/zinc/43/96/83/1041439683.db2.gz NQKXHIBQCGQRNJ-UHFFFAOYSA-N 1 2 302.761 4.220 20 0 DIADLO C[N@@H+](Cc1ccco1)Cc1cc(-c2ccc(Cl)cc2)no1 ZINC000042669826 1041439686 /nfs/dbraw/zinc/43/96/86/1041439686.db2.gz NQKXHIBQCGQRNJ-UHFFFAOYSA-N 1 2 302.761 4.220 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2)Cc2ccccc2C)co1 ZINC000659859260 1041462405 /nfs/dbraw/zinc/46/24/05/1041462405.db2.gz IFRLAJFLYLBJMC-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2)Cc2ccccc2C)co1 ZINC000659859260 1041462410 /nfs/dbraw/zinc/46/24/10/1041462410.db2.gz IFRLAJFLYLBJMC-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2cc(O)cc(Cl)c2)on1 ZINC000893064516 1041473020 /nfs/dbraw/zinc/47/30/20/1041473020.db2.gz SLSPZWXQOHWIQI-UHFFFAOYSA-N 1 2 308.809 4.227 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)s1 ZINC000282525942 1041480849 /nfs/dbraw/zinc/48/08/49/1041480849.db2.gz PXENXOKZXBUCGW-BDAKNGLRSA-N 1 2 315.364 4.277 20 0 DIADLO Fc1cc(F)c(F)c(C[NH2+][C@H](c2ccccn2)C2CCC2)c1F ZINC000925502795 1041482471 /nfs/dbraw/zinc/48/24/71/1041482471.db2.gz HTMAXBGESMVPMB-KRWDZBQOSA-N 1 2 324.321 4.269 20 0 DIADLO CN(C)c1cc(-c2ccc(Cl)c(OC(F)(F)F)c2)cc[nH+]1 ZINC001244674128 1041489133 /nfs/dbraw/zinc/48/91/33/1041489133.db2.gz SNLBVYWQAYPRTH-UHFFFAOYSA-N 1 2 316.710 4.367 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1ncc(-c2ccccc2)n1C ZINC000651229816 1041506950 /nfs/dbraw/zinc/50/69/50/1041506950.db2.gz OQKAUDSGQCMPEL-TZMCWYRMSA-N 1 2 324.428 4.104 20 0 DIADLO Cc1c[nH]nc1C[N@@H+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000811460994 1041519776 /nfs/dbraw/zinc/51/97/76/1041519776.db2.gz DHNGHGVSUBGBKW-HNNXBMFYSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1c[nH]nc1C[N@H+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000811460994 1041519783 /nfs/dbraw/zinc/51/97/83/1041519783.db2.gz DHNGHGVSUBGBKW-HNNXBMFYSA-N 1 2 309.335 4.074 20 0 DIADLO Cc1ccccc1[C@@H](C)[NH2+]Cc1nc(CCc2ccccc2)no1 ZINC000181563473 1041552889 /nfs/dbraw/zinc/55/28/89/1041552889.db2.gz UTKMNLIKANNBSG-MRXNPFEDSA-N 1 2 321.424 4.014 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)oc1C ZINC000181907363 1041560252 /nfs/dbraw/zinc/56/02/52/1041560252.db2.gz YUCHRLRUDPYBRG-JTQLQIEISA-N 1 2 314.307 4.041 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1ccc([NH+](C)C)cc1)CCCO2 ZINC000182495793 1041568229 /nfs/dbraw/zinc/56/82/29/1041568229.db2.gz XVUYRQOZHLBALP-SFHVURJKSA-N 1 2 312.413 4.087 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2nccn2Cc2ccccc2)cc1 ZINC000613707085 1041577218 /nfs/dbraw/zinc/57/72/18/1041577218.db2.gz BMGBBQSZDSHNGJ-SFHVURJKSA-N 1 2 319.452 4.433 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2nccn2Cc2ccccc2)cc1 ZINC000613707085 1041577226 /nfs/dbraw/zinc/57/72/26/1041577226.db2.gz BMGBBQSZDSHNGJ-SFHVURJKSA-N 1 2 319.452 4.433 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@H](C)c2cccc(C)c2C)n1 ZINC000183707375 1041586239 /nfs/dbraw/zinc/58/62/39/1041586239.db2.gz KQOAYPHFRYNANO-ZIAGYGMSSA-N 1 2 319.474 4.351 20 0 DIADLO CN(C)c1ccc(N[C@@H](Cc2ccccc2)c2nccs2)[nH+]c1 ZINC001170661312 1041596286 /nfs/dbraw/zinc/59/62/86/1041596286.db2.gz RIIMYZCPMNLTNY-INIZCTEOSA-N 1 2 324.453 4.000 20 0 DIADLO Cc1nc(C[N@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)co1 ZINC000660077926 1041603323 /nfs/dbraw/zinc/60/33/23/1041603323.db2.gz LPSIKXQFLHUDCH-UHFFFAOYSA-N 1 2 307.397 4.062 20 0 DIADLO Cc1nc(C[N@@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)co1 ZINC000660077926 1041603327 /nfs/dbraw/zinc/60/33/27/1041603327.db2.gz LPSIKXQFLHUDCH-UHFFFAOYSA-N 1 2 307.397 4.062 20 0 DIADLO c1c(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3o2)onc1C1CC1 ZINC000660102176 1041615475 /nfs/dbraw/zinc/61/54/75/1041615475.db2.gz VAPCYSHNYIHZIM-KRWDZBQOSA-N 1 2 323.396 4.420 20 0 DIADLO c1c(C[N@H+]2CCCC[C@H]2c2nc3ccccc3o2)onc1C1CC1 ZINC000660102176 1041615479 /nfs/dbraw/zinc/61/54/79/1041615479.db2.gz VAPCYSHNYIHZIM-KRWDZBQOSA-N 1 2 323.396 4.420 20 0 DIADLO Cc1ccc(C[S@@](=O)[C@@H](C)c2ccc3c(c2)CCC3)c(C)[nH+]1 ZINC000417160643 1041638516 /nfs/dbraw/zinc/63/85/16/1041638516.db2.gz HZWJKPRVQALMJR-OYHNWAKOSA-N 1 2 313.466 4.197 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1cc(C2CC2)no1 ZINC000660163401 1041639962 /nfs/dbraw/zinc/63/99/62/1041639962.db2.gz GUMUTYYPWWTYNV-RYUDHWBXSA-N 1 2 300.377 4.199 20 0 DIADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1cc(C2CC2)no1 ZINC000660163401 1041639966 /nfs/dbraw/zinc/63/99/66/1041639966.db2.gz GUMUTYYPWWTYNV-RYUDHWBXSA-N 1 2 300.377 4.199 20 0 DIADLO CCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1coc(C)n1 ZINC000660200387 1041665074 /nfs/dbraw/zinc/66/50/74/1041665074.db2.gz BOAKCIDMPRIYHD-QGZVFWFLSA-N 1 2 302.418 4.259 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1ccccc1OC(C)C ZINC000584761986 1041665276 /nfs/dbraw/zinc/66/52/76/1041665276.db2.gz IVWBYUPVCQUSBS-GJZGRUSLSA-N 1 2 301.434 4.102 20 0 DIADLO Brc1scnc1C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000660206966 1041667469 /nfs/dbraw/zinc/66/74/69/1041667469.db2.gz AWRUAOOKQXNRNG-ZDUSSCGKSA-N 1 2 323.259 4.147 20 0 DIADLO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H](C)C(F)(F)c1ccccc1 ZINC000925603678 1041670934 /nfs/dbraw/zinc/67/09/34/1041670934.db2.gz CRCCKKDRJVSTSX-RISCZKNCSA-N 1 2 308.372 4.165 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CC(C)(C)[C@H]3c3cccs3)cn2c1 ZINC000584798357 1041674800 /nfs/dbraw/zinc/67/48/00/1041674800.db2.gz JHVMCDMQOZLUKC-QGZVFWFLSA-N 1 2 311.454 4.287 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CC(C)(C)[C@H]3c3cccs3)cn2c1 ZINC000584798357 1041674803 /nfs/dbraw/zinc/67/48/03/1041674803.db2.gz JHVMCDMQOZLUKC-QGZVFWFLSA-N 1 2 311.454 4.287 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)[nH]1 ZINC000660238190 1041683366 /nfs/dbraw/zinc/68/33/66/1041683366.db2.gz HYJMDWYLHBBDAW-BONVTDFDSA-N 1 2 324.831 4.208 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2nsc3ccccc23)C2CC2)s1 ZINC000660254063 1041692117 /nfs/dbraw/zinc/69/21/17/1041692117.db2.gz PRASKDPRNOMEHF-OAHLLOKOSA-N 1 2 315.467 4.302 20 0 DIADLO CC[C@H]([NH2+]Cc1nsc2ccccc12)c1c(C)noc1C ZINC000660258516 1041693820 /nfs/dbraw/zinc/69/38/20/1041693820.db2.gz FDCLSUCWYXPRIK-ZDUSSCGKSA-N 1 2 301.415 4.142 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2cccc(F)c2OC(F)F)n1 ZINC000660266450 1041697201 /nfs/dbraw/zinc/69/72/01/1041697201.db2.gz QVNOQHGSXQKFPP-SECBINFHSA-N 1 2 316.348 4.043 20 0 DIADLO CCCCn1ccnc1-c1cccc(NCc2c[nH+]cn2CC)c1 ZINC000417823875 1041703440 /nfs/dbraw/zinc/70/34/40/1041703440.db2.gz ARUDHCHXEDFYSZ-UHFFFAOYSA-N 1 2 323.444 4.179 20 0 DIADLO Cc1cc(F)cc(Cl)c1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001245054899 1041722311 /nfs/dbraw/zinc/72/23/11/1041722311.db2.gz ABAUXFRYKCQRCH-UHFFFAOYSA-N 1 2 304.674 4.451 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(NC2(C3CCOCC3)CC2)c1 ZINC001167748277 1041731293 /nfs/dbraw/zinc/73/12/93/1041731293.db2.gz HGLFHDMQPHICSN-UHFFFAOYSA-N 1 2 302.462 4.212 20 0 DIADLO C[C@H]1CCC[C@H]([N@H+](C)Cn2nc(-c3ccccc3)[nH]c2=S)C1 ZINC000025484845 1041753043 /nfs/dbraw/zinc/75/30/43/1041753043.db2.gz XXTGBNQVAWSGIW-ZFWWWQNUSA-N 1 2 316.474 4.076 20 0 DIADLO C[C@H]1CCC[C@H]([N@@H+](C)Cn2nc(-c3ccccc3)[nH]c2=S)C1 ZINC000025484845 1041753051 /nfs/dbraw/zinc/75/30/51/1041753051.db2.gz XXTGBNQVAWSGIW-ZFWWWQNUSA-N 1 2 316.474 4.076 20 0 DIADLO CCc1cccc(C[NH2+]Cc2ncc(C(F)(F)F)s2)c1 ZINC000652033025 1041762186 /nfs/dbraw/zinc/76/21/86/1041762186.db2.gz WHNPESUFALWQMS-UHFFFAOYSA-N 1 2 300.349 4.014 20 0 DIADLO Cc1cccc2ncc(C[NH2+][C@@H](c3ccco3)c3ccccc3)n21 ZINC000364388976 1041771487 /nfs/dbraw/zinc/77/14/87/1041771487.db2.gz SORKXBZJPNFUFQ-HXUWFJFHSA-N 1 2 317.392 4.115 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2ccccc2C(F)(F)F)c1 ZINC000652068876 1041773362 /nfs/dbraw/zinc/77/33/62/1041773362.db2.gz RDRABBSQIUEDFT-NSHDSACASA-N 1 2 310.319 4.420 20 0 DIADLO Cc1ccc([C@H](C)Nc2ccc(Cn3cc[nH+]c3)cn2)c(C)c1 ZINC001170726449 1041774240 /nfs/dbraw/zinc/77/42/40/1041774240.db2.gz NPPSDPZYTWYVMB-INIZCTEOSA-N 1 2 306.413 4.116 20 0 DIADLO Cc1nc2cc(CNc3cc[nH+]c(OCC(C)C)c3)ccc2o1 ZINC001167761480 1041791126 /nfs/dbraw/zinc/79/11/26/1041791126.db2.gz XCULZNALTNFYOB-UHFFFAOYSA-N 1 2 311.385 4.178 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ccc(Cl)cn1)c1ncccc1Cl ZINC000925695272 1041797939 /nfs/dbraw/zinc/79/79/39/1041797939.db2.gz VLEXOGNOPKOITL-CQSZACIVSA-N 1 2 310.228 4.414 20 0 DIADLO CCSc1nn(C[N@H+](CC)C2CCCC2)c(=S)s1 ZINC000123992190 1041809040 /nfs/dbraw/zinc/80/90/40/1041809040.db2.gz DOFGRVHSWUAQBD-UHFFFAOYSA-N 1 2 303.522 4.008 20 0 DIADLO CCSc1nn(C[N@@H+](CC)C2CCCC2)c(=S)s1 ZINC000123992190 1041809047 /nfs/dbraw/zinc/80/90/47/1041809047.db2.gz DOFGRVHSWUAQBD-UHFFFAOYSA-N 1 2 303.522 4.008 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1cccc(SC)c1 ZINC000660459733 1041812055 /nfs/dbraw/zinc/81/20/55/1041812055.db2.gz OIWKYNCBCPMWIF-QGZVFWFLSA-N 1 2 315.486 4.352 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1cccc(SC)c1 ZINC000660459733 1041812064 /nfs/dbraw/zinc/81/20/64/1041812064.db2.gz OIWKYNCBCPMWIF-QGZVFWFLSA-N 1 2 315.486 4.352 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cccc(C(F)F)c2F)c(C)[nH+]1 ZINC000636582236 1041822869 /nfs/dbraw/zinc/82/28/69/1041822869.db2.gz ZGESJQZUTYIWAR-UHFFFAOYSA-N 1 2 308.303 4.336 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ncccc2C(F)(F)F)[C@@H]1c1ccccc1 ZINC000093867424 1041836623 /nfs/dbraw/zinc/83/66/23/1041836623.db2.gz HEEGVJAWQCNSNQ-WBMJQRKESA-N 1 2 306.331 4.293 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ncccc2C(F)(F)F)[C@@H]1c1ccccc1 ZINC000093867424 1041836629 /nfs/dbraw/zinc/83/66/29/1041836629.db2.gz HEEGVJAWQCNSNQ-WBMJQRKESA-N 1 2 306.331 4.293 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2cc(C3CC3)no2)c(F)c1 ZINC000660753536 1041859251 /nfs/dbraw/zinc/85/92/51/1041859251.db2.gz JJTFRBBPHFSYQA-QGZVFWFLSA-N 1 2 304.340 4.167 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2cc(C3CC3)no2)c(F)c1 ZINC000660753536 1041859262 /nfs/dbraw/zinc/85/92/62/1041859262.db2.gz JJTFRBBPHFSYQA-QGZVFWFLSA-N 1 2 304.340 4.167 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2nsc3ccccc23)CC1 ZINC000660900056 1041868568 /nfs/dbraw/zinc/86/85/68/1041868568.db2.gz NQOQWGBUOMGINW-UHFFFAOYSA-N 1 2 310.422 4.084 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1nc(C(C)C)n2ccccc12 ZINC000651665939 1041870837 /nfs/dbraw/zinc/87/08/37/1041870837.db2.gz KAXCLMIAEXJKCO-HNNXBMFYSA-N 1 2 323.440 4.317 20 0 DIADLO COCc1nc(C[N@H+](Cc2ccsc2)C(C)(C)C)cs1 ZINC000661136797 1041893491 /nfs/dbraw/zinc/89/34/91/1041893491.db2.gz VQXDLARIPFZXEC-UHFFFAOYSA-N 1 2 310.488 4.152 20 0 DIADLO COCc1nc(C[N@@H+](Cc2ccsc2)C(C)(C)C)cs1 ZINC000661136797 1041893501 /nfs/dbraw/zinc/89/35/01/1041893501.db2.gz VQXDLARIPFZXEC-UHFFFAOYSA-N 1 2 310.488 4.152 20 0 DIADLO COC[C@H]([NH2+][C@@H]1CCc2ccc(F)c(Cl)c21)c1ccc(C)o1 ZINC000651728646 1041897146 /nfs/dbraw/zinc/89/71/46/1041897146.db2.gz FVEUEIAEWNHBRB-KGLIPLIRSA-N 1 2 323.795 4.345 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000044736762 1041901055 /nfs/dbraw/zinc/90/10/55/1041901055.db2.gz MXDFXYXBZITVCX-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000044736762 1041901057 /nfs/dbraw/zinc/90/10/57/1041901057.db2.gz MXDFXYXBZITVCX-UGSOOPFHSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H]([NH2+][C@@H](CCO)c1ccco1)c1ccc(-c2ccccc2)cn1 ZINC000651764160 1041907551 /nfs/dbraw/zinc/90/75/51/1041907551.db2.gz HOOCYGMJBJLOKO-KXBFYZLASA-N 1 2 322.408 4.116 20 0 DIADLO C[C@H]([NH2+]Cc1cnn(C)c1Cl)c1cc(Cl)ccc1Cl ZINC000815122603 1041916746 /nfs/dbraw/zinc/91/67/46/1041916746.db2.gz PFNSIPBBOINYSE-QMMMGPOBSA-N 1 2 318.635 4.231 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3cccc(O)c3Cl)ccc21 ZINC000815130675 1041918521 /nfs/dbraw/zinc/91/85/21/1041918521.db2.gz DVXBYIFRDARKRY-UHFFFAOYSA-N 1 2 302.805 4.040 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3cccc(O)c3Cl)ccc21 ZINC000815130675 1041918530 /nfs/dbraw/zinc/91/85/30/1041918530.db2.gz DVXBYIFRDARKRY-UHFFFAOYSA-N 1 2 302.805 4.040 20 0 DIADLO CC(C)Oc1ccc(C[NH2+][C@@H](C)c2cscn2)cc1Cl ZINC000661419346 1041935269 /nfs/dbraw/zinc/93/52/69/1041935269.db2.gz OQPGKHSUJVSHAW-NSHDSACASA-N 1 2 310.850 4.435 20 0 DIADLO CCOc1ccc(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccco2)nc1 ZINC000661444967 1041937805 /nfs/dbraw/zinc/93/78/05/1041937805.db2.gz CZZUJFPECQKGOF-SFHVURJKSA-N 1 2 312.413 4.191 20 0 DIADLO CCOc1ccc(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccco2)nc1 ZINC000661444967 1041937811 /nfs/dbraw/zinc/93/78/11/1041937811.db2.gz CZZUJFPECQKGOF-SFHVURJKSA-N 1 2 312.413 4.191 20 0 DIADLO O=C(Nc1cccc2ccccc21)c1ccc(-n2cc[nH+]c2)cc1 ZINC000045762661 1041940465 /nfs/dbraw/zinc/94/04/65/1041940465.db2.gz CIVDNXOGMJPNLP-UHFFFAOYSA-N 1 2 313.360 4.278 20 0 DIADLO C[N@H+](Cc1coc(-c2cccc(F)c2)n1)Cc1cccc(F)c1 ZINC000045735313 1041940508 /nfs/dbraw/zinc/94/05/08/1041940508.db2.gz KTBWQHSUBCQHIS-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1coc(-c2cccc(F)c2)n1)Cc1cccc(F)c1 ZINC000045735313 1041940517 /nfs/dbraw/zinc/94/05/17/1041940517.db2.gz KTBWQHSUBCQHIS-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccccc1F ZINC000661484547 1041943947 /nfs/dbraw/zinc/94/39/47/1041943947.db2.gz LVBTYIPFGHTHGS-HNNXBMFYSA-N 1 2 305.422 4.042 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1ccc2ccccc2c1 ZINC000045859922 1041944865 /nfs/dbraw/zinc/94/48/65/1041944865.db2.gz VSTKOSAQRFCMAM-UHFFFAOYSA-N 1 2 313.360 4.278 20 0 DIADLO CCCc1ccc(CCCC(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC001126097143 1041948085 /nfs/dbraw/zinc/94/80/85/1041948085.db2.gz LDSMKISBHRNLFP-UHFFFAOYSA-N 1 2 321.424 4.248 20 0 DIADLO CCc1cnc(C[NH2+][C@@H]2CC(C)(C)Oc3ccc(F)cc32)s1 ZINC000651949195 1041965640 /nfs/dbraw/zinc/96/56/40/1041965640.db2.gz GDRWFMYXXYSCFR-CQSZACIVSA-N 1 2 320.433 4.237 20 0 DIADLO CCc1cnc(C[NH2+][C@H]2CC(C)(C)Oc3ccc(F)cc32)s1 ZINC000651949194 1041965797 /nfs/dbraw/zinc/96/57/97/1041965797.db2.gz GDRWFMYXXYSCFR-AWEZNQCLSA-N 1 2 320.433 4.237 20 0 DIADLO CC[C@H](Nc1cc(CC(=O)OC)cc[nH+]1)c1ccc(Cl)cc1 ZINC000596065665 1041971387 /nfs/dbraw/zinc/97/13/87/1041971387.db2.gz IYYKUGFNKPXNQP-HNNXBMFYSA-N 1 2 318.804 4.014 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccccn1 ZINC000815649459 1041984526 /nfs/dbraw/zinc/98/45/26/1041984526.db2.gz QJXMIDNVAMCRDT-QGZVFWFLSA-N 1 2 308.347 4.376 20 0 DIADLO Fc1cc(F)c(C[NH2+][C@@H]2CCc3c2c(F)ccc3F)c(F)c1 ZINC000815650532 1041985635 /nfs/dbraw/zinc/98/56/35/1041985635.db2.gz UCYGNVRDOJWDGY-OAHLLOKOSA-N 1 2 313.269 4.159 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N[C@H](CCC(C)C)C(C)(C)C)ccn12 ZINC001126138628 1041989617 /nfs/dbraw/zinc/98/96/17/1041989617.db2.gz GWVUUFKTVAFDIS-MRXNPFEDSA-N 1 2 315.461 4.223 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CCSc3ccc(F)cc32)c1 ZINC000652330348 1042009273 /nfs/dbraw/zinc/00/92/73/1042009273.db2.gz CYWQZDXWFYKZOP-CQSZACIVSA-N 1 2 304.390 4.016 20 0 DIADLO CC[C@@H](Nc1cc(COC)cc[nH+]1)c1ccc2c(c1)CCCO2 ZINC000652330639 1042010212 /nfs/dbraw/zinc/01/02/12/1042010212.db2.gz LKJDBGHLVWZLRV-QGZVFWFLSA-N 1 2 312.413 4.116 20 0 DIADLO Cn1ncc(C[N@H+](C)Cc2ccc(C(C)(C)C)cc2)c1Cl ZINC000816481359 1042056555 /nfs/dbraw/zinc/05/65/55/1042056555.db2.gz RUNMTPYLGREJTM-UHFFFAOYSA-N 1 2 305.853 4.003 20 0 DIADLO Cn1ncc(C[N@@H+](C)Cc2ccc(C(C)(C)C)cc2)c1Cl ZINC000816481359 1042056560 /nfs/dbraw/zinc/05/65/60/1042056560.db2.gz RUNMTPYLGREJTM-UHFFFAOYSA-N 1 2 305.853 4.003 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(Cl)c2O)C[C@@H](c2ccccc2)O1 ZINC000245950882 1042058959 /nfs/dbraw/zinc/05/89/59/1042058959.db2.gz XBIHJDHHIHXHJB-GUYCJALGSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(Cl)c2O)C[C@@H](c2ccccc2)O1 ZINC000245950882 1042058962 /nfs/dbraw/zinc/05/89/62/1042058962.db2.gz XBIHJDHHIHXHJB-GUYCJALGSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+]1CC[C@H]1c1ccc(Br)cc1 ZINC000662098056 1042064593 /nfs/dbraw/zinc/06/45/93/1042064593.db2.gz DTUHADYBHCPOPE-LRDDRELGSA-N 1 2 317.230 4.352 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+]1CC[C@H]1c1ccc(Br)cc1 ZINC000662098056 1042064598 /nfs/dbraw/zinc/06/45/98/1042064598.db2.gz DTUHADYBHCPOPE-LRDDRELGSA-N 1 2 317.230 4.352 20 0 DIADLO FC(F)(F)C[C@@H]1C[N@H+](Cc2cc3ccccc3s2)CCO1 ZINC000662229747 1042094436 /nfs/dbraw/zinc/09/44/36/1042094436.db2.gz XRKUHEJQOVCXRD-GFCCVEGCSA-N 1 2 315.360 4.055 20 0 DIADLO FC(F)(F)C[C@@H]1C[N@@H+](Cc2cc3ccccc3s2)CCO1 ZINC000662229747 1042094442 /nfs/dbraw/zinc/09/44/42/1042094442.db2.gz XRKUHEJQOVCXRD-GFCCVEGCSA-N 1 2 315.360 4.055 20 0 DIADLO FC(F)(F)C[C@H]1C[N@H+](Cc2cc3ccccc3s2)CCO1 ZINC000662229749 1042094652 /nfs/dbraw/zinc/09/46/52/1042094652.db2.gz XRKUHEJQOVCXRD-LBPRGKRZSA-N 1 2 315.360 4.055 20 0 DIADLO FC(F)(F)C[C@H]1C[N@@H+](Cc2cc3ccccc3s2)CCO1 ZINC000662229749 1042094658 /nfs/dbraw/zinc/09/46/58/1042094658.db2.gz XRKUHEJQOVCXRD-LBPRGKRZSA-N 1 2 315.360 4.055 20 0 DIADLO CCCc1[nH]ccc1C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC000817522890 1042113535 /nfs/dbraw/zinc/11/35/35/1042113535.db2.gz SGHOQCITQPNARV-UHFFFAOYSA-N 1 2 322.412 4.226 20 0 DIADLO CC1(C)C[C@@]1([NH2+]Cc1nnc(-c2ccccc2)o1)c1ccccc1 ZINC000662343747 1042116210 /nfs/dbraw/zinc/11/62/10/1042116210.db2.gz NKVLTMNPUACSQL-HXUWFJFHSA-N 1 2 319.408 4.152 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@]2(c3ccccc3)CC2(C)C)cs1 ZINC000662342375 1042116217 /nfs/dbraw/zinc/11/62/17/1042116217.db2.gz ARPVADRVCFDDGS-ACJLOTCBSA-N 1 2 316.470 4.266 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1csc([C@@H](C)OC)n1 ZINC000165240895 1042121021 /nfs/dbraw/zinc/12/10/21/1042121021.db2.gz AWBFPXORMSDEPV-CHWSQXEVSA-N 1 2 320.458 4.018 20 0 DIADLO CC(C)(C)c1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)n1 ZINC000063492425 1042121190 /nfs/dbraw/zinc/12/11/90/1042121190.db2.gz KUDRCPKEOVRXKN-OAHLLOKOSA-N 1 2 319.836 4.261 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@H](C)c2cc(F)c(F)c(F)c2)n1 ZINC000162347127 1042124737 /nfs/dbraw/zinc/12/47/37/1042124737.db2.gz UIIAGCZPLHDSQU-RKDXNWHRSA-N 1 2 300.349 4.281 20 0 DIADLO Cc1nc(N[C@@H](c2ccccc2)C(F)(F)F)c2c([nH+]1)CCCC2 ZINC001170883463 1042133680 /nfs/dbraw/zinc/13/36/80/1042133680.db2.gz UNSKVZRJDNUVLR-HNNXBMFYSA-N 1 2 321.346 4.379 20 0 DIADLO Cc1cc(NCC(F)(F)c2ccccn2)[nH+]cc1C(F)(F)F ZINC001170904416 1042153051 /nfs/dbraw/zinc/15/30/51/1042153051.db2.gz BYGHOUJYDRKJEE-UHFFFAOYSA-N 1 2 317.261 4.008 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(NCC(F)(F)c2ccccn2)c1 ZINC001170913388 1042157762 /nfs/dbraw/zinc/15/77/62/1042157762.db2.gz SEBHGHWFDRRJPG-UHFFFAOYSA-N 1 2 319.399 4.440 20 0 DIADLO Cc1cc(C(F)(F)F)cc(N2CCC[C@@H]2c2ccccn2)[nH+]1 ZINC000663417062 1042159049 /nfs/dbraw/zinc/15/90/49/1042159049.db2.gz GLIDRSGCCLVDSA-CQSZACIVSA-N 1 2 307.319 4.145 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N3CCCCC[C@@H]3CC(C)C)ccn12 ZINC001126278475 1042160025 /nfs/dbraw/zinc/16/00/25/1042160025.db2.gz PQQJNJCDMVNXDI-QGZVFWFLSA-N 1 2 313.445 4.074 20 0 DIADLO C[C@@H](c1ccccc1Cl)N(C)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001136186364 1042169254 /nfs/dbraw/zinc/16/92/54/1042169254.db2.gz JZZKXPNWRUEAAD-NSHDSACASA-N 1 2 313.788 4.050 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc(SC(F)(F)F)nc1 ZINC000819145903 1042172120 /nfs/dbraw/zinc/17/21/20/1042172120.db2.gz DHKZNNRQMCHJMF-UHFFFAOYSA-N 1 2 316.352 4.083 20 0 DIADLO C[C@H](c1nc2ccccc2n1C(F)F)[N@@H+]1CC[C@@H](C(F)F)C1 ZINC000663463831 1042176795 /nfs/dbraw/zinc/17/67/95/1042176795.db2.gz KQXLOVPBBMOQRJ-NXEZZACHSA-N 1 2 315.314 4.079 20 0 DIADLO C[C@H](c1nc2ccccc2n1C(F)F)[N@H+]1CC[C@@H](C(F)F)C1 ZINC000663463831 1042176800 /nfs/dbraw/zinc/17/68/00/1042176800.db2.gz KQXLOVPBBMOQRJ-NXEZZACHSA-N 1 2 315.314 4.079 20 0 DIADLO CC1(C)C[C@H](c2ccccc2)[N@H+](Cn2ncsc2=S)C1 ZINC000819901323 1042198748 /nfs/dbraw/zinc/19/87/48/1042198748.db2.gz ZEIGCVDBDSQWLU-CYBMUJFWSA-N 1 2 305.472 4.105 20 0 DIADLO CC1(C)C[C@H](c2ccccc2)[N@@H+](Cn2ncsc2=S)C1 ZINC000819901323 1042198750 /nfs/dbraw/zinc/19/87/50/1042198750.db2.gz ZEIGCVDBDSQWLU-CYBMUJFWSA-N 1 2 305.472 4.105 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2nc3ccccc3c(C)c2Cl)C[C@H](C)O1 ZINC000303429497 1042203874 /nfs/dbraw/zinc/20/38/74/1042203874.db2.gz BQDGYIVWJFSUJM-GXTWGEPZSA-N 1 2 318.848 4.196 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2nc3ccccc3c(C)c2Cl)C[C@H](C)O1 ZINC000303429497 1042203880 /nfs/dbraw/zinc/20/38/80/1042203880.db2.gz BQDGYIVWJFSUJM-GXTWGEPZSA-N 1 2 318.848 4.196 20 0 DIADLO C[C@@H](N[C@H](c1ccco1)c1ccccc1)c1cn2c([nH+]1)CCCC2 ZINC000820805974 1042228256 /nfs/dbraw/zinc/22/82/56/1042228256.db2.gz WFDGQRAYLYEKTC-QRWLVFNGSA-N 1 2 321.424 4.253 20 0 DIADLO C[C@@H]([NH2+]Cc1ccco1)c1ccc(C(F)(F)F)nc1Cl ZINC000820847278 1042231864 /nfs/dbraw/zinc/23/18/64/1042231864.db2.gz XQIXHGRPBSHYMZ-MRVPVSSYSA-N 1 2 304.699 4.198 20 0 DIADLO Cc1csc(C2([NH2+][C@@H](C)c3cc(O)cc(F)c3)CCC2)n1 ZINC000925804462 1042251684 /nfs/dbraw/zinc/25/16/84/1042251684.db2.gz IBDDEXWLRXOFHH-NSHDSACASA-N 1 2 306.406 4.026 20 0 DIADLO Cc1cccc(C[N@@H+](C)[C@@H](C)c2ncc(-c3ccccc3)o2)n1 ZINC000348554228 1042258743 /nfs/dbraw/zinc/25/87/43/1042258743.db2.gz PXVDGLORDDLKBW-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1cccc(C[N@H+](C)[C@@H](C)c2ncc(-c3ccccc3)o2)n1 ZINC000348554228 1042258747 /nfs/dbraw/zinc/25/87/47/1042258747.db2.gz PXVDGLORDDLKBW-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO C[C@H]([NH2+]Cc1ccnc(Cl)c1)c1nc(C(F)(F)F)cs1 ZINC000279048242 1042265381 /nfs/dbraw/zinc/26/53/81/1042265381.db2.gz YGBRYVFKLWZMTO-ZETCQYMHSA-N 1 2 321.755 4.061 20 0 DIADLO Cc1nccc(C[NH2+][C@H](C)c2cc(F)c(Cl)cc2Cl)n1 ZINC000038037736 1042268073 /nfs/dbraw/zinc/26/80/73/1042268073.db2.gz DNZJMVYJBRKJBE-MRVPVSSYSA-N 1 2 314.191 4.082 20 0 DIADLO C[C@@H]1CCN(c2[nH+]ccc3c(N)cccc32)[C@@H](c2ccco2)C1 ZINC000663674285 1042277423 /nfs/dbraw/zinc/27/74/23/1042277423.db2.gz HUBYXCBNCYQYAL-CXAGYDPISA-N 1 2 307.397 4.388 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2csc(C3CC3)n2)c1 ZINC000162723998 1042296014 /nfs/dbraw/zinc/29/60/14/1042296014.db2.gz OJLOSVNBJDDVSV-QGZVFWFLSA-N 1 2 314.454 4.366 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2csc(C3CC3)n2)c1 ZINC000162723998 1042296017 /nfs/dbraw/zinc/29/60/17/1042296017.db2.gz OJLOSVNBJDDVSV-QGZVFWFLSA-N 1 2 314.454 4.366 20 0 DIADLO COc1cccc([C@@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC000319906687 1042296495 /nfs/dbraw/zinc/29/64/95/1042296495.db2.gz YBKHLDPONDITBL-OAHLLOKOSA-N 1 2 311.429 4.254 20 0 DIADLO CSCc1ccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000162799042 1042296654 /nfs/dbraw/zinc/29/66/54/1042296654.db2.gz SPFCADYWKNZOPU-UHFFFAOYSA-N 1 2 323.421 4.192 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C(C)(C)C3CCC3)c2)[nH+]c1C ZINC000822730231 1042298759 /nfs/dbraw/zinc/29/87/59/1042298759.db2.gz HZQUGKTZSMSKRG-UHFFFAOYSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1cccc([C@H]2CCCN2c2cc(C(F)(F)F)cc(C)[nH+]2)n1 ZINC000663722383 1042300079 /nfs/dbraw/zinc/30/00/79/1042300079.db2.gz PGNYVEXCDIPETA-OAHLLOKOSA-N 1 2 321.346 4.454 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1csc(C3CC3)n1)CCC2 ZINC000162989091 1042303901 /nfs/dbraw/zinc/30/39/01/1042303901.db2.gz PZLYHTYAORKHBZ-AWEZNQCLSA-N 1 2 319.499 4.295 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1csc(C3CC3)n1)CCC2 ZINC000162989091 1042303907 /nfs/dbraw/zinc/30/39/07/1042303907.db2.gz PZLYHTYAORKHBZ-AWEZNQCLSA-N 1 2 319.499 4.295 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893686285 1042305264 /nfs/dbraw/zinc/30/52/64/1042305264.db2.gz XKXLOPHEKIDKKL-QWRGUYRKSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893686285 1042305267 /nfs/dbraw/zinc/30/52/67/1042305267.db2.gz XKXLOPHEKIDKKL-QWRGUYRKSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893686284 1042305420 /nfs/dbraw/zinc/30/54/20/1042305420.db2.gz XKXLOPHEKIDKKL-MNOVXSKESA-N 1 2 304.356 4.135 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893686284 1042305424 /nfs/dbraw/zinc/30/54/24/1042305424.db2.gz XKXLOPHEKIDKKL-MNOVXSKESA-N 1 2 304.356 4.135 20 0 DIADLO Cc1ncc([C@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)c(C)n1 ZINC000163190388 1042309792 /nfs/dbraw/zinc/30/97/92/1042309792.db2.gz WMZYNLVTLYODPC-IFXJQAMLSA-N 1 2 307.397 4.127 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1nc(C(F)(F)F)cs1)c1cncs1 ZINC000279492084 1042319257 /nfs/dbraw/zinc/31/92/57/1042319257.db2.gz LTXVTWFBOBXWDS-BQBZGAKWSA-N 1 2 307.366 4.030 20 0 DIADLO c1cn(-c2cccc(NCc3ccc4cnccc4c3)c2)c[nH+]1 ZINC000324078884 1042321110 /nfs/dbraw/zinc/32/11/10/1042321110.db2.gz AWPOFIPIVJLIDP-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO CCC[N@H+](Cc1cc(F)ncc1F)[C@H](C)c1ccccc1OC ZINC000823404126 1042323540 /nfs/dbraw/zinc/32/35/40/1042323540.db2.gz MGIKAUXJTDDBPI-CYBMUJFWSA-N 1 2 320.383 4.342 20 0 DIADLO CCC[N@@H+](Cc1cc(F)ncc1F)[C@H](C)c1ccccc1OC ZINC000823404126 1042323544 /nfs/dbraw/zinc/32/35/44/1042323544.db2.gz MGIKAUXJTDDBPI-CYBMUJFWSA-N 1 2 320.383 4.342 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccnc(Cl)c2F)C2CC2)cc1 ZINC000823390819 1042323658 /nfs/dbraw/zinc/32/36/58/1042323658.db2.gz MGEDXADWTIOSDW-UHFFFAOYSA-N 1 2 320.795 4.047 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccnc(Cl)c2F)C2CC2)cc1 ZINC000823390819 1042323663 /nfs/dbraw/zinc/32/36/63/1042323663.db2.gz MGEDXADWTIOSDW-UHFFFAOYSA-N 1 2 320.795 4.047 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2cnn(C(C)C)c2)c2ccccn2)cc1 ZINC000279655704 1042328907 /nfs/dbraw/zinc/32/89/07/1042328907.db2.gz LEXWOZJOZKSYLM-FQEVSTJZSA-N 1 2 320.440 4.047 20 0 DIADLO C[NH+](C)c1ccc(N[C@H]2CCc3cc(F)c(F)c(F)c32)cc1 ZINC000823529080 1042329707 /nfs/dbraw/zinc/32/97/07/1042329707.db2.gz CYRCRWJUHUAHSG-AWEZNQCLSA-N 1 2 306.331 4.269 20 0 DIADLO COCc1ccc(C[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)o1 ZINC000279690774 1042332153 /nfs/dbraw/zinc/33/21/53/1042332153.db2.gz PVIIQFVATBXAKO-HXUWFJFHSA-N 1 2 322.408 4.009 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CCCC34CCC4)cc2)CCO1 ZINC000823554089 1042334308 /nfs/dbraw/zinc/33/43/08/1042334308.db2.gz HGTCHPDWARXUDT-QAPCUYQASA-N 1 2 300.446 4.046 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)s1 ZINC000274146419 1042343182 /nfs/dbraw/zinc/34/31/82/1042343182.db2.gz DUNHQOXVRSOKKH-BDAKNGLRSA-N 1 2 315.364 4.277 20 0 DIADLO O=C(Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)C1CC2(CC2)C1 ZINC000614055877 1042368621 /nfs/dbraw/zinc/36/86/21/1042368621.db2.gz OUFMBYSRLNKNKC-UHFFFAOYSA-N 1 2 321.424 4.015 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[N@H+](C)Cc1ccc2ccccc2c1 ZINC000051679195 1042382302 /nfs/dbraw/zinc/38/23/02/1042382302.db2.gz PMVVYDWBXNARRE-ZDUSSCGKSA-N 1 2 307.397 4.293 20 0 DIADLO C[C@@H](c1nc(C2CC2)no1)[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000051679195 1042382305 /nfs/dbraw/zinc/38/23/05/1042382305.db2.gz PMVVYDWBXNARRE-ZDUSSCGKSA-N 1 2 307.397 4.293 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1F)Cc1cccc(F)c1OC ZINC001143537438 1042391285 /nfs/dbraw/zinc/39/12/85/1042391285.db2.gz WYYUOMNAVOBYOA-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1F)Cc1cccc(F)c1OC ZINC001143537438 1042391290 /nfs/dbraw/zinc/39/12/90/1042391290.db2.gz WYYUOMNAVOBYOA-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO Cc1cc(N2CC(C)(C)[C@@H]2c2ccncc2)nc(C2CCC2)[nH+]1 ZINC000893971618 1042399641 /nfs/dbraw/zinc/39/96/41/1042399641.db2.gz VSGKJPCJEDIQPQ-KRWDZBQOSA-N 1 2 308.429 4.035 20 0 DIADLO COc1c(F)cc(F)cc1C[N@@H+]1CCc2ccccc2[C@@H]1C ZINC001143551923 1042407593 /nfs/dbraw/zinc/40/75/93/1042407593.db2.gz NFILTOLOJXXOTR-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(F)cc(F)cc1C[N@H+]1CCc2ccccc2[C@@H]1C ZINC001143551923 1042407595 /nfs/dbraw/zinc/40/75/95/1042407595.db2.gz NFILTOLOJXXOTR-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO CC(C)c1ocnc1C[N@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000092792715 1042442380 /nfs/dbraw/zinc/44/23/80/1042442380.db2.gz AEGDWYTXFQHRPT-UHFFFAOYSA-N 1 2 312.335 4.449 20 0 DIADLO CC(C)c1ocnc1C[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000092792715 1042442383 /nfs/dbraw/zinc/44/23/83/1042442383.db2.gz AEGDWYTXFQHRPT-UHFFFAOYSA-N 1 2 312.335 4.449 20 0 DIADLO CC(=O)c1ccc2c(c1)CN(c1cc(C(F)(F)F)cc(C)[nH+]1)C2 ZINC000664011983 1042442427 /nfs/dbraw/zinc/44/24/27/1042442427.db2.gz AHAXVSHNUFSTTM-UHFFFAOYSA-N 1 2 320.314 4.132 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2cc(OC(F)F)ccc21)c1ncco1 ZINC000924873004 1042445305 /nfs/dbraw/zinc/44/53/05/1042445305.db2.gz UDCVEYBECNLZQC-QMTHXVAHSA-N 1 2 308.328 4.004 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1CCCC2(CC2)C1 ZINC000614281858 1042452660 /nfs/dbraw/zinc/45/26/60/1042452660.db2.gz MUJGRCMWPHBXFI-OAHLLOKOSA-N 1 2 309.413 4.294 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(-c3ncco3)cc2F)s1 ZINC000411533348 1042455774 /nfs/dbraw/zinc/45/57/74/1042455774.db2.gz BHYZZORIPZJUQT-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO COc1cc(F)c(Nc2cccn3cc(C)[nH+]c23)cc1Cl ZINC001214060597 1042459762 /nfs/dbraw/zinc/45/97/62/1042459762.db2.gz YYDCQMUYEGWBAO-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO CC[N@H+](Cc1occc1C)[C@@H](C)c1nnc(-c2cccs2)o1 ZINC000412042693 1042465070 /nfs/dbraw/zinc/46/50/70/1042465070.db2.gz OJMHAWRBTDQSAG-LBPRGKRZSA-N 1 2 317.414 4.283 20 0 DIADLO CC[N@@H+](Cc1occc1C)[C@@H](C)c1nnc(-c2cccs2)o1 ZINC000412042693 1042465073 /nfs/dbraw/zinc/46/50/73/1042465073.db2.gz OJMHAWRBTDQSAG-LBPRGKRZSA-N 1 2 317.414 4.283 20 0 DIADLO CCCc1ccc([C@@H]([NH2+]Cc2cnc[nH]2)c2cccs2)cc1 ZINC000894152606 1042474462 /nfs/dbraw/zinc/47/44/62/1042474462.db2.gz OTPZRQPFBNRNKY-GOSISDBHSA-N 1 2 311.454 4.303 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+](C)Cc1nnc(-c2ccco2)o1 ZINC000052162041 1042476617 /nfs/dbraw/zinc/47/66/17/1042476617.db2.gz MNCIGHCVYHEOGC-NSHDSACASA-N 1 2 317.776 4.176 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1nnc(-c2ccco2)o1 ZINC000052162041 1042476622 /nfs/dbraw/zinc/47/66/22/1042476622.db2.gz MNCIGHCVYHEOGC-NSHDSACASA-N 1 2 317.776 4.176 20 0 DIADLO CC1(C)CC[C@@H]1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000614354384 1042481282 /nfs/dbraw/zinc/48/12/82/1042481282.db2.gz VUZBZKLIMVLLBT-MRXNPFEDSA-N 1 2 323.440 4.261 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@@H](C)c1cc(O)cc(F)c1)c1ccco1 ZINC000924889003 1042487340 /nfs/dbraw/zinc/48/73/40/1042487340.db2.gz JGPBAMWVOCVSTQ-SUMWQHHRSA-N 1 2 321.392 4.189 20 0 DIADLO CCc1nc(C)c(C[NH2+][C@@H](C)c2ccccc2Br)o1 ZINC000291813633 1042487476 /nfs/dbraw/zinc/48/74/76/1042487476.db2.gz CWUZAKMLFPGBOE-JTQLQIEISA-N 1 2 323.234 4.159 20 0 DIADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2nc(-c3ccccc3)no2)c1 ZINC000052454909 1042490265 /nfs/dbraw/zinc/49/02/65/1042490265.db2.gz VPRYVJVSHWVBKV-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2nc(-c3ccccc3)no2)c1 ZINC000052454909 1042490269 /nfs/dbraw/zinc/49/02/69/1042490269.db2.gz VPRYVJVSHWVBKV-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[N@H+](C)Cc1csc2ccccc12 ZINC000052806507 1042518859 /nfs/dbraw/zinc/51/88/59/1042518859.db2.gz DUFREEOIIINCGX-LLVKDONJSA-N 1 2 313.426 4.355 20 0 DIADLO C[C@H](c1nc(C2CC2)no1)[N@@H+](C)Cc1csc2ccccc12 ZINC000052806507 1042518865 /nfs/dbraw/zinc/51/88/65/1042518865.db2.gz DUFREEOIIINCGX-LLVKDONJSA-N 1 2 313.426 4.355 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc3ccc(Cl)cc3n2C)s1 ZINC000513425361 1042540358 /nfs/dbraw/zinc/54/03/58/1042540358.db2.gz UQHDAOGVJKKXQS-UHFFFAOYSA-N 1 2 319.861 4.229 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc3ccc(Cl)cc3n2C)s1 ZINC000513425361 1042540360 /nfs/dbraw/zinc/54/03/60/1042540360.db2.gz UQHDAOGVJKKXQS-UHFFFAOYSA-N 1 2 319.861 4.229 20 0 DIADLO CSc1ccc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000513442317 1042541853 /nfs/dbraw/zinc/54/18/53/1042541853.db2.gz GNBPLJNDVKZJBS-UHFFFAOYSA-N 1 2 323.465 4.334 20 0 DIADLO CSc1ccc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000513442317 1042541857 /nfs/dbraw/zinc/54/18/57/1042541857.db2.gz GNBPLJNDVKZJBS-UHFFFAOYSA-N 1 2 323.465 4.334 20 0 DIADLO O=C(Nc1ccc(Cl)cc1)Nc1ccccc1-n1cc[nH+]c1 ZINC000039338999 1042582721 /nfs/dbraw/zinc/58/27/21/1042582721.db2.gz JRKLATIIVYBQCV-UHFFFAOYSA-N 1 2 312.760 4.170 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](Cc1nnc(C2CC2)o1)C1CC1 ZINC000072579488 1042592425 /nfs/dbraw/zinc/59/24/25/1042592425.db2.gz QVZVAGVSPUMGTH-NSHDSACASA-N 1 2 317.820 4.326 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](Cc1nnc(C2CC2)o1)C1CC1 ZINC000072579488 1042592431 /nfs/dbraw/zinc/59/24/31/1042592431.db2.gz QVZVAGVSPUMGTH-NSHDSACASA-N 1 2 317.820 4.326 20 0 DIADLO COc1cccc([C@H]2C[N@H+](C/C(C)=C\c3ccccc3)CCO2)c1 ZINC000513713151 1042594111 /nfs/dbraw/zinc/59/41/11/1042594111.db2.gz LFEGUBOKOZLKHH-WYPWOVKWSA-N 1 2 323.436 4.172 20 0 DIADLO COc1cccc([C@H]2C[N@@H+](C/C(C)=C\c3ccccc3)CCO2)c1 ZINC000513713151 1042594114 /nfs/dbraw/zinc/59/41/14/1042594114.db2.gz LFEGUBOKOZLKHH-WYPWOVKWSA-N 1 2 323.436 4.172 20 0 DIADLO COc1cccc([C@H]2C[N@H+](C/C(C)=C/c3ccccc3)CCO2)c1 ZINC000513713150 1042594585 /nfs/dbraw/zinc/59/45/85/1042594585.db2.gz LFEGUBOKOZLKHH-RYEVTAHJSA-N 1 2 323.436 4.172 20 0 DIADLO COc1cccc([C@H]2C[N@@H+](C/C(C)=C/c3ccccc3)CCO2)c1 ZINC000513713150 1042594588 /nfs/dbraw/zinc/59/45/88/1042594588.db2.gz LFEGUBOKOZLKHH-RYEVTAHJSA-N 1 2 323.436 4.172 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420939597 1042616587 /nfs/dbraw/zinc/61/65/87/1042616587.db2.gz BVCUYLLGQHBQEP-GHMZBOCLSA-N 1 2 319.371 4.093 20 0 DIADLO C[C@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420939597 1042616591 /nfs/dbraw/zinc/61/65/91/1042616591.db2.gz BVCUYLLGQHBQEP-GHMZBOCLSA-N 1 2 319.371 4.093 20 0 DIADLO FC(F)(F)C[C@@H]1CCC[N@H+](Cc2csc(C3CC3)n2)C1 ZINC000420950711 1042616629 /nfs/dbraw/zinc/61/66/29/1042616629.db2.gz QBVXACAXFXOICL-JTQLQIEISA-N 1 2 304.381 4.185 20 0 DIADLO FC(F)(F)C[C@@H]1CCC[N@@H+](Cc2csc(C3CC3)n2)C1 ZINC000420950711 1042616631 /nfs/dbraw/zinc/61/66/31/1042616631.db2.gz QBVXACAXFXOICL-JTQLQIEISA-N 1 2 304.381 4.185 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)cs1 ZINC000420948848 1042616741 /nfs/dbraw/zinc/61/67/41/1042616741.db2.gz OFLPJAKQRCHNTD-NSHDSACASA-N 1 2 306.397 4.431 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cs1 ZINC000420948848 1042616742 /nfs/dbraw/zinc/61/67/42/1042616742.db2.gz OFLPJAKQRCHNTD-NSHDSACASA-N 1 2 306.397 4.431 20 0 DIADLO O=C(C[N@H+]1CCC[C@@H](CC(F)(F)F)C1)c1c[nH]c2ccccc12 ZINC000420955279 1042617399 /nfs/dbraw/zinc/61/73/99/1042617399.db2.gz WCJFJEMGTSVYLO-LBPRGKRZSA-N 1 2 324.346 4.015 20 0 DIADLO O=C(C[N@@H+]1CCC[C@@H](CC(F)(F)F)C1)c1c[nH]c2ccccc12 ZINC000420955279 1042617404 /nfs/dbraw/zinc/61/74/04/1042617404.db2.gz WCJFJEMGTSVYLO-LBPRGKRZSA-N 1 2 324.346 4.015 20 0 DIADLO FC(F)C[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1 ZINC000420990460 1042619126 /nfs/dbraw/zinc/61/91/26/1042619126.db2.gz FTLZWPPAZAKIOP-JTQLQIEISA-N 1 2 302.777 4.283 20 0 DIADLO CC(C)[N@H+](Cc1nnc2n1CCCCC2)[C@H](C)c1ccsc1 ZINC000421004130 1042621013 /nfs/dbraw/zinc/62/10/13/1042621013.db2.gz HTKWBVQIZZBWAU-CQSZACIVSA-N 1 2 318.490 4.038 20 0 DIADLO CC(C)[N@@H+](Cc1nnc2n1CCCCC2)[C@H](C)c1ccsc1 ZINC000421004130 1042621018 /nfs/dbraw/zinc/62/10/18/1042621018.db2.gz HTKWBVQIZZBWAU-CQSZACIVSA-N 1 2 318.490 4.038 20 0 DIADLO C[C@H]([NH2+]Cc1c(Cl)cccc1N1CCCC1)c1nccs1 ZINC000414492958 1042623435 /nfs/dbraw/zinc/62/34/35/1042623435.db2.gz HFSVOBKVUVYWKZ-LBPRGKRZSA-N 1 2 321.877 4.248 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccccc2C(C)(F)F)cc(C)[nH+]1 ZINC000421117450 1042625650 /nfs/dbraw/zinc/62/56/50/1042625650.db2.gz TXFFZQKTJOPVNU-UHFFFAOYSA-N 1 2 319.355 4.132 20 0 DIADLO Cc1cc(CNC(=O)Nc2cc(C)c(F)cc2Cl)cc(C)[nH+]1 ZINC000421106094 1042626294 /nfs/dbraw/zinc/62/62/94/1042626294.db2.gz DUXPNFUFQIDMRB-UHFFFAOYSA-N 1 2 321.783 4.121 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@H](C3CCCC3)C2)c(C)[nH+]1 ZINC000421109007 1042626317 /nfs/dbraw/zinc/62/63/17/1042626317.db2.gz FUKXWXDORBYFNP-INIZCTEOSA-N 1 2 301.434 4.051 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H](C)c2cccc(OC(C)C)c2)nn1C ZINC000421322758 1042629993 /nfs/dbraw/zinc/62/99/93/1042629993.db2.gz FHUGCLHJAYPQNO-LBPRGKRZSA-N 1 2 321.852 4.020 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H](c2ccc(F)cc2)C2CCC2)nn1C ZINC000421330601 1042630756 /nfs/dbraw/zinc/63/07/56/1042630756.db2.gz YEQNIMNNURGRBN-QGZVFWFLSA-N 1 2 321.827 4.152 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H](C)c2ccc3c(c2)CCCC3)nn1C ZINC000421335528 1042631838 /nfs/dbraw/zinc/63/18/38/1042631838.db2.gz SRDISTOWXKIZRD-GFCCVEGCSA-N 1 2 317.864 4.112 20 0 DIADLO O[C@@H]1CC[N@H+](Cc2ccc(F)c(Cl)c2Cl)C2(CCC2)C1 ZINC000421410914 1042637135 /nfs/dbraw/zinc/63/71/35/1042637135.db2.gz PTPGLHQJTHKHCB-LLVKDONJSA-N 1 2 318.219 4.012 20 0 DIADLO O[C@@H]1CC[N@@H+](Cc2ccc(F)c(Cl)c2Cl)C2(CCC2)C1 ZINC000421410914 1042637140 /nfs/dbraw/zinc/63/71/40/1042637140.db2.gz PTPGLHQJTHKHCB-LLVKDONJSA-N 1 2 318.219 4.012 20 0 DIADLO Cc1ccc(CCCCC(=O)NCc2cc(C)[nH+]c(C)c2)cc1 ZINC000421575016 1042644568 /nfs/dbraw/zinc/64/45/68/1042644568.db2.gz IIVBSIBUPBPCQQ-UHFFFAOYSA-N 1 2 310.441 4.036 20 0 DIADLO COc1cc(Cl)ccc1[C@@H](C)[NH2+]Cc1nccn1CC(C)C ZINC000421832025 1042654555 /nfs/dbraw/zinc/65/45/55/1042654555.db2.gz MBTNJXYXGZJNSG-CYBMUJFWSA-N 1 2 321.852 4.052 20 0 DIADLO CCc1nc(C[NH2+][C@@H](c2ccc(OC)cc2F)C(C)C)cs1 ZINC000421839121 1042655122 /nfs/dbraw/zinc/65/51/22/1042655122.db2.gz WJUDFHUJZDTKEK-QGZVFWFLSA-N 1 2 322.449 4.340 20 0 DIADLO Cc1[nH]c2nc[nH+]c(N3CC4(CCCC4)[C@H]3c3ccco3)c2c1C ZINC000664276105 1042664756 /nfs/dbraw/zinc/66/47/56/1042664756.db2.gz MQMIVBMDNGWZEE-MRXNPFEDSA-N 1 2 322.412 4.289 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc([C@@H](C)OCC(C)C)no1)c1ccccc1 ZINC000271701105 1042666553 /nfs/dbraw/zinc/66/65/53/1042666553.db2.gz SNGJKOSZXYIBDV-GDBMZVCRSA-N 1 2 317.433 4.044 20 0 DIADLO Cc1cc([C@@H]([NH2+]Cc2nc(C(C)(C)C)no2)C2CC2)ccc1F ZINC000271771729 1042667830 /nfs/dbraw/zinc/66/78/30/1042667830.db2.gz ACLAEICJUTYAIZ-INIZCTEOSA-N 1 2 317.408 4.056 20 0 DIADLO ClC1(Cl)C[C@@H]1C[NH+](Cc1ccco1)Cc1ccco1 ZINC000838548788 1042670311 /nfs/dbraw/zinc/67/03/11/1042670311.db2.gz VYWRJKGGMWKHMA-LLVKDONJSA-N 1 2 300.185 4.069 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)[nH]1 ZINC000271881136 1042671653 /nfs/dbraw/zinc/67/16/53/1042671653.db2.gz PMHBREMCNUMRCN-NXEZZACHSA-N 1 2 318.808 4.179 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)[nH]1 ZINC000271881142 1042671666 /nfs/dbraw/zinc/67/16/66/1042671666.db2.gz PMHBREMCNUMRCN-VHSXEESVSA-N 1 2 318.808 4.179 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)[nH]1 ZINC000271881139 1042671754 /nfs/dbraw/zinc/67/17/54/1042671754.db2.gz PMHBREMCNUMRCN-UWVGGRQHSA-N 1 2 318.808 4.179 20 0 DIADLO COc1ccc([C@H](C)[NH2+]C2(c3nc(C)cs3)CCC2)c(F)c1 ZINC000271929528 1042673024 /nfs/dbraw/zinc/67/30/24/1042673024.db2.gz DFVFOUZDIXLHCX-LBPRGKRZSA-N 1 2 320.433 4.329 20 0 DIADLO CCc1nc(C[N@H+](Cc2ccc(F)cc2)C2CCCCC2)no1 ZINC000513785028 1042684385 /nfs/dbraw/zinc/68/43/85/1042684385.db2.gz DNPMRJCGNBVVRM-UHFFFAOYSA-N 1 2 317.408 4.106 20 0 DIADLO CCc1nc(C[N@@H+](Cc2ccc(F)cc2)C2CCCCC2)no1 ZINC000513785028 1042684386 /nfs/dbraw/zinc/68/43/86/1042684386.db2.gz DNPMRJCGNBVVRM-UHFFFAOYSA-N 1 2 317.408 4.106 20 0 DIADLO CC[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(C(=O)OC)cc1 ZINC000423213308 1042700477 /nfs/dbraw/zinc/70/04/77/1042700477.db2.gz JPYSOYICKDHDPR-QGZVFWFLSA-N 1 2 310.397 4.004 20 0 DIADLO CCc1ccccc1NC(=O)C[C@@H](C)[NH2+]c1ccc2c(c1)CCN2 ZINC000423216850 1042701667 /nfs/dbraw/zinc/70/16/67/1042701667.db2.gz PFDSIFIHSNYJDY-CQSZACIVSA-N 1 2 323.440 4.046 20 0 DIADLO Cc1cc(C)c(NCc2c[nH+]cn2C(C)C)cc1Br ZINC000424174588 1042728443 /nfs/dbraw/zinc/72/84/43/1042728443.db2.gz MRAPQTYLGSTLDH-UHFFFAOYSA-N 1 2 322.250 4.455 20 0 DIADLO CC(C)CCn1ncc(NCc2c[nH+]cn2C(C)C)c1C(C)C ZINC000424190960 1042729022 /nfs/dbraw/zinc/72/90/22/1042729022.db2.gz NGZNZOGSUQHINL-UHFFFAOYSA-N 1 2 317.481 4.442 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cc(Cl)ccc1OC(F)F ZINC000424195383 1042729485 /nfs/dbraw/zinc/72/94/85/1042729485.db2.gz CVKGZUCYXXXPGW-UHFFFAOYSA-N 1 2 315.751 4.331 20 0 DIADLO CCCc1ncc(C[NH2+][C@@H](C)c2ccc(OC)cc2Cl)o1 ZINC000424331246 1042734706 /nfs/dbraw/zinc/73/47/06/1042734706.db2.gz JIPAVFPYWNTOKR-NSHDSACASA-N 1 2 308.809 4.140 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@@H]2CCc3c2nccc3Cl)n1 ZINC000924970078 1042739922 /nfs/dbraw/zinc/73/99/22/1042739922.db2.gz NXCHIMIHCUOVPK-GFCCVEGCSA-N 1 2 321.877 4.266 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cccc2c1OCO2 ZINC000924971828 1042745833 /nfs/dbraw/zinc/74/58/33/1042745833.db2.gz YZQLQVRNVDKSMI-NSHDSACASA-N 1 2 318.442 4.020 20 0 DIADLO Brc1ccc(C[N@@H+]2CCc3ccsc3C2)cc1 ZINC000711804477 1042753573 /nfs/dbraw/zinc/75/35/73/1042753573.db2.gz VHXKDLPZPQDXML-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1ccc(C[N@H+]2CCc3ccsc3C2)cc1 ZINC000711804477 1042753575 /nfs/dbraw/zinc/75/35/75/1042753575.db2.gz VHXKDLPZPQDXML-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Fc1cncc([C@@H]([NH2+]Cc2coc(-c3ccccc3)n2)C2CC2)c1 ZINC000281747940 1042781774 /nfs/dbraw/zinc/78/17/74/1042781774.db2.gz VWDHEDWHEYHHHS-SFHVURJKSA-N 1 2 323.371 4.117 20 0 DIADLO CCCOc1cccc2c(N[C@@H](C)c3csnn3)cc[nH+]c12 ZINC000514719025 1042788710 /nfs/dbraw/zinc/78/87/10/1042788710.db2.gz BYKQOCMECWTOTP-NSHDSACASA-N 1 2 314.414 4.048 20 0 DIADLO CCCN(C(=O)C[C@@H](C)n1cc[nH+]c1)[C@H](CC)c1ccccc1 ZINC000514791677 1042791385 /nfs/dbraw/zinc/79/13/85/1042791385.db2.gz BOVZQPLUJIWNJQ-SJLPKXTDSA-N 1 2 313.445 4.224 20 0 DIADLO CC(C)n1cncc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC000425341867 1042795358 /nfs/dbraw/zinc/79/53/58/1042795358.db2.gz FFLUWXNOHHBLSJ-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1cncc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC000425341867 1042795364 /nfs/dbraw/zinc/79/53/64/1042795364.db2.gz FFLUWXNOHHBLSJ-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO CS[C@H]1CC[C@H]1Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000425344955 1042795518 /nfs/dbraw/zinc/79/55/18/1042795518.db2.gz UVHFFIGLDQRMNX-SJORKVTESA-N 1 2 313.470 4.192 20 0 DIADLO Fc1ccc2c(cc[nH+]c2N2CCC[C@H]([C@@H]3CCCCO3)C2)c1 ZINC000664489379 1042804260 /nfs/dbraw/zinc/80/42/60/1042804260.db2.gz WSHNIFUQRWDCKZ-YJBOKZPZSA-N 1 2 314.404 4.159 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nc(C(F)F)no1)c1ccc(Cl)cc1 ZINC000425386633 1042804617 /nfs/dbraw/zinc/80/46/17/1042804617.db2.gz SDVKXKFHPTVTFH-GFCCVEGCSA-N 1 2 315.751 4.148 20 0 DIADLO CC[N@H+](Cc1nc(C(F)F)no1)[C@@H](C)c1cc2ccccc2o1 ZINC000425411533 1042816264 /nfs/dbraw/zinc/81/62/64/1042816264.db2.gz YIUYUZSOOOSXAX-JTQLQIEISA-N 1 2 321.327 4.337 20 0 DIADLO CC[N@@H+](Cc1nc(C(F)F)no1)[C@@H](C)c1cc2ccccc2o1 ZINC000425411533 1042816267 /nfs/dbraw/zinc/81/62/67/1042816267.db2.gz YIUYUZSOOOSXAX-JTQLQIEISA-N 1 2 321.327 4.337 20 0 DIADLO Cc1ccc([C@H]2[C@H](C)CCC[N@@H+]2Cc2nc(C(F)F)no2)cc1 ZINC000425414416 1042818250 /nfs/dbraw/zinc/81/82/50/1042818250.db2.gz FXSVROSXFACODB-IUODEOHRSA-N 1 2 321.371 4.289 20 0 DIADLO Cc1ccc([C@H]2[C@H](C)CCC[N@H+]2Cc2nc(C(F)F)no2)cc1 ZINC000425414416 1042818255 /nfs/dbraw/zinc/81/82/55/1042818255.db2.gz FXSVROSXFACODB-IUODEOHRSA-N 1 2 321.371 4.289 20 0 DIADLO C[NH+](C)[C@@H](c1nc(CCC2CCCCC2)no1)c1ccccc1 ZINC000515707817 1042832536 /nfs/dbraw/zinc/83/25/36/1042832536.db2.gz NHRGNGYMRAZJMR-GOSISDBHSA-N 1 2 313.445 4.234 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000515781235 1042835218 /nfs/dbraw/zinc/83/52/18/1042835218.db2.gz SCYZLSIGOCSFPO-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000515781235 1042835226 /nfs/dbraw/zinc/83/52/26/1042835226.db2.gz SCYZLSIGOCSFPO-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO CCC[C@@H]1CCC[N@H+](Cc2nc(C)c(Br)s2)C1 ZINC001167960917 1042840077 /nfs/dbraw/zinc/84/00/77/1042840077.db2.gz YRQQORSWUGEGKL-LLVKDONJSA-N 1 2 317.296 4.226 20 0 DIADLO CCC[C@@H]1CCC[N@@H+](Cc2nc(C)c(Br)s2)C1 ZINC001167960917 1042840081 /nfs/dbraw/zinc/84/00/81/1042840081.db2.gz YRQQORSWUGEGKL-LLVKDONJSA-N 1 2 317.296 4.226 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(-c3ccccc3)n2)CCC1(F)F ZINC000516962907 1042862330 /nfs/dbraw/zinc/86/23/30/1042862330.db2.gz KXPRNRGYKXPVRA-LBPRGKRZSA-N 1 2 308.397 4.287 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(-c3ccccc3)n2)CCC1(F)F ZINC000516962907 1042862335 /nfs/dbraw/zinc/86/23/35/1042862335.db2.gz KXPRNRGYKXPVRA-LBPRGKRZSA-N 1 2 308.397 4.287 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@@H](c2cnn(C)c2)c2ccccc2)o1 ZINC000366673046 1042862724 /nfs/dbraw/zinc/86/27/24/1042862724.db2.gz CXBYLLQBRHYHDK-AUUYWEPGSA-N 1 2 309.413 4.016 20 0 DIADLO CCCc1noc(C[N@@H+]2CCCCC[C@H]2c2ccc(C)o2)n1 ZINC000151198224 1042899078 /nfs/dbraw/zinc/89/90/78/1042899078.db2.gz VISBPXUVLWBTBS-AWEZNQCLSA-N 1 2 303.406 4.041 20 0 DIADLO CCCc1noc(C[N@H+]2CCCCC[C@H]2c2ccc(C)o2)n1 ZINC000151198224 1042899082 /nfs/dbraw/zinc/89/90/82/1042899082.db2.gz VISBPXUVLWBTBS-AWEZNQCLSA-N 1 2 303.406 4.041 20 0 DIADLO CCOc1cc(F)c(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c(F)c1 ZINC001143564895 1042912173 /nfs/dbraw/zinc/91/21/73/1042912173.db2.gz NMWYTGWVCKFIEU-UHFFFAOYSA-N 1 2 319.342 4.231 20 0 DIADLO CCOc1cc(F)c(C[N@H+]2CCC(F)(F)C(C)(C)C2)c(F)c1 ZINC001143564895 1042912175 /nfs/dbraw/zinc/91/21/75/1042912175.db2.gz NMWYTGWVCKFIEU-UHFFFAOYSA-N 1 2 319.342 4.231 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+][C@H]2COCc3cccc(Cl)c32)cn1 ZINC000925045885 1042913898 /nfs/dbraw/zinc/91/38/98/1042913898.db2.gz NGCHDSHEIUHJGD-WBMJQRKESA-N 1 2 319.836 4.040 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+][C@@H]2COCc3cccc(Cl)c32)cn1 ZINC000925045881 1042914255 /nfs/dbraw/zinc/91/42/55/1042914255.db2.gz NGCHDSHEIUHJGD-MLGOLLRUSA-N 1 2 319.836 4.040 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)c1C ZINC000638599613 1042915533 /nfs/dbraw/zinc/91/55/33/1042915533.db2.gz LQEXSTGOQWKPBT-YJBOKZPZSA-N 1 2 312.461 4.394 20 0 DIADLO Cc1cccn2cc(Cc3noc(C4CCC5(CC5)CC4)n3)[nH+]c12 ZINC000664776799 1042933594 /nfs/dbraw/zinc/93/35/94/1042933594.db2.gz FOBBADQUCFRFLV-UHFFFAOYSA-N 1 2 322.412 4.054 20 0 DIADLO C[C@H](CC(=O)N1CCC[C@H]1CCC1CCCCC1)n1cc[nH+]c1 ZINC000519161746 1042935492 /nfs/dbraw/zinc/93/54/92/1042935492.db2.gz MUAHNLBNEVRTDU-AEFFLSMTSA-N 1 2 317.477 4.186 20 0 DIADLO C[C@@H](CC(=O)N1CCC[C@H]1CCC1CCCCC1)n1cc[nH+]c1 ZINC000519161749 1042935810 /nfs/dbraw/zinc/93/58/10/1042935810.db2.gz MUAHNLBNEVRTDU-WMZOPIPTSA-N 1 2 317.477 4.186 20 0 DIADLO COc1ccc2c(c1)C[N@H+]([C@H](C)c1ccc(F)cc1F)CC2 ZINC000519214504 1042938487 /nfs/dbraw/zinc/93/84/87/1042938487.db2.gz IYMUNCVBMDYXHN-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc2c(c1)C[N@@H+]([C@H](C)c1ccc(F)cc1F)CC2 ZINC000519214504 1042938489 /nfs/dbraw/zinc/93/84/89/1042938489.db2.gz IYMUNCVBMDYXHN-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc(Cc2cccc(C)c2)no1)c1ccccc1 ZINC000519225538 1042938708 /nfs/dbraw/zinc/93/87/08/1042938708.db2.gz PSVCXOQHJARIFI-LJQANCHMSA-N 1 2 321.424 4.010 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc(Cc2cccc(C)c2)no1)c1ccccc1 ZINC000519225538 1042938711 /nfs/dbraw/zinc/93/87/11/1042938711.db2.gz PSVCXOQHJARIFI-LJQANCHMSA-N 1 2 321.424 4.010 20 0 DIADLO CCOc1cc(F)c(C[N@H+](CC)Cc2cccs2)c(F)c1 ZINC001143575857 1042975146 /nfs/dbraw/zinc/97/51/46/1042975146.db2.gz ONDZLHKYZJXLKV-UHFFFAOYSA-N 1 2 311.397 4.447 20 0 DIADLO CCOc1cc(F)c(C[N@@H+](CC)Cc2cccs2)c(F)c1 ZINC001143575857 1042975147 /nfs/dbraw/zinc/97/51/47/1042975147.db2.gz ONDZLHKYZJXLKV-UHFFFAOYSA-N 1 2 311.397 4.447 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1csc(C(C)(C)C)n1)C2 ZINC000729479019 1042994755 /nfs/dbraw/zinc/99/47/55/1042994755.db2.gz APVDNBJZZKLGKG-UHFFFAOYSA-N 1 2 300.471 4.307 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1csc(C(C)(C)C)n1)C2 ZINC000729479019 1042994757 /nfs/dbraw/zinc/99/47/57/1042994757.db2.gz APVDNBJZZKLGKG-UHFFFAOYSA-N 1 2 300.471 4.307 20 0 DIADLO Clc1cccc(Cl)c1C1CC[NH+](Cc2cncnc2)CC1 ZINC000519671417 1042998827 /nfs/dbraw/zinc/99/88/27/1042998827.db2.gz NOZICMWRIZQIEM-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](C)CC(=O)OC(C)(C)C ZINC000519903347 1043008945 /nfs/dbraw/zinc/00/89/45/1043008945.db2.gz XSGNGUMUVDMGFL-NSHDSACASA-N 1 2 317.351 4.040 20 0 DIADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CC(=O)OC(C)(C)C ZINC000519903347 1043008949 /nfs/dbraw/zinc/00/89/49/1043008949.db2.gz XSGNGUMUVDMGFL-NSHDSACASA-N 1 2 317.351 4.040 20 0 DIADLO CCc1nc(C[N@@H+]2CCCCC[C@H]2/C=C/c2ccccc2)no1 ZINC000441171802 1043024719 /nfs/dbraw/zinc/02/47/19/1043024719.db2.gz SINSDRQKBIVKQS-UJGDBWEASA-N 1 2 311.429 4.090 20 0 DIADLO CCc1nc(C[N@H+]2CCCCC[C@H]2/C=C/c2ccccc2)no1 ZINC000441171802 1043024724 /nfs/dbraw/zinc/02/47/24/1043024724.db2.gz SINSDRQKBIVKQS-UJGDBWEASA-N 1 2 311.429 4.090 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+](C)Cc3cccc(F)c3)o2)cc1 ZINC000441178428 1043025522 /nfs/dbraw/zinc/02/55/22/1043025522.db2.gz SPSMFPITXMNEKM-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+](C)Cc3cccc(F)c3)o2)cc1 ZINC000441178428 1043025528 /nfs/dbraw/zinc/02/55/28/1043025528.db2.gz SPSMFPITXMNEKM-UHFFFAOYSA-N 1 2 310.372 4.421 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+](C)Cc1ccccc1N(C)C ZINC000441227212 1043029770 /nfs/dbraw/zinc/02/97/70/1043029770.db2.gz HIWPSMQRQOOGSJ-CYBMUJFWSA-N 1 2 304.384 4.224 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccccc1N(C)C ZINC000441227212 1043029772 /nfs/dbraw/zinc/02/97/72/1043029772.db2.gz HIWPSMQRQOOGSJ-CYBMUJFWSA-N 1 2 304.384 4.224 20 0 DIADLO Cc1cnc(C[N@@H+]2CCc3ccccc3[C@@H]2c2ccccc2)o1 ZINC000441307390 1043034584 /nfs/dbraw/zinc/03/45/84/1043034584.db2.gz VSPHJNMUVZAIHQ-FQEVSTJZSA-N 1 2 304.393 4.131 20 0 DIADLO Cc1cnc(C[N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)o1 ZINC000441307390 1043034587 /nfs/dbraw/zinc/03/45/87/1043034587.db2.gz VSPHJNMUVZAIHQ-FQEVSTJZSA-N 1 2 304.393 4.131 20 0 DIADLO C[C@H](CC[N@H+](C)[C@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894960514 1043051685 /nfs/dbraw/zinc/05/16/85/1043051685.db2.gz MYYJEIDNHVHFRU-APWZRJJASA-N 1 2 320.440 4.020 20 0 DIADLO C[C@H](CC[N@@H+](C)[C@H](c1nnc[nH]1)c1ccccc1)c1ccccc1 ZINC000894960514 1043051695 /nfs/dbraw/zinc/05/16/95/1043051695.db2.gz MYYJEIDNHVHFRU-APWZRJJASA-N 1 2 320.440 4.020 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cc2ccccc2nc1Cl ZINC000015417192 1043054010 /nfs/dbraw/zinc/05/40/10/1043054010.db2.gz GITIIILQVMGYNH-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cc2ccccc2nc1Cl ZINC000015417192 1043054022 /nfs/dbraw/zinc/05/40/22/1043054022.db2.gz GITIIILQVMGYNH-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO CC(C)[C@@H](c1ccccc1)[N@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000112699429 1043054402 /nfs/dbraw/zinc/05/44/02/1043054402.db2.gz QHHXPRBUDUBYDJ-INIZCTEOSA-N 1 2 301.434 4.196 20 0 DIADLO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1noc(C(C)(C)C)n1 ZINC000112699429 1043054412 /nfs/dbraw/zinc/05/44/12/1043054412.db2.gz QHHXPRBUDUBYDJ-INIZCTEOSA-N 1 2 301.434 4.196 20 0 DIADLO CC(C)(C)C1=CC[N@H+](Cc2nccn2Cc2ccccc2)CC1 ZINC000535407467 1043061345 /nfs/dbraw/zinc/06/13/45/1043061345.db2.gz UWPCKKGKOUMUNQ-UHFFFAOYSA-N 1 2 309.457 4.110 20 0 DIADLO CC(C)(C)C1=CC[N@@H+](Cc2nccn2Cc2ccccc2)CC1 ZINC000535407467 1043061359 /nfs/dbraw/zinc/06/13/59/1043061359.db2.gz UWPCKKGKOUMUNQ-UHFFFAOYSA-N 1 2 309.457 4.110 20 0 DIADLO C[C@@H]([NH2+]Cc1cccnc1F)c1nc(-c2ccccc2)cs1 ZINC000794831946 1043071180 /nfs/dbraw/zinc/07/11/80/1043071180.db2.gz AIQQWYSUIWTHSA-GFCCVEGCSA-N 1 2 313.401 4.195 20 0 DIADLO CCC[N@H+](Cc1csc([C@H](C)OC)n1)Cc1ccccc1 ZINC000175026679 1043074254 /nfs/dbraw/zinc/07/42/54/1043074254.db2.gz XPERJERBAZFUMC-AWEZNQCLSA-N 1 2 304.459 4.263 20 0 DIADLO CCC[N@@H+](Cc1csc([C@H](C)OC)n1)Cc1ccccc1 ZINC000175026679 1043074261 /nfs/dbraw/zinc/07/42/61/1043074261.db2.gz XPERJERBAZFUMC-AWEZNQCLSA-N 1 2 304.459 4.263 20 0 DIADLO C[C@@H]([NH2+]Cc1cn(C2CC2)cn1)c1cc(Cl)ccc1Cl ZINC000865436312 1043097239 /nfs/dbraw/zinc/09/72/39/1043097239.db2.gz ALQLBJJMLQWSCQ-SNVBAGLBSA-N 1 2 310.228 4.376 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cccc(Cl)c3C)CCCCC2)no1 ZINC000865439827 1043097287 /nfs/dbraw/zinc/09/72/87/1043097287.db2.gz FSTYYJDRGJICFM-UHFFFAOYSA-N 1 2 319.836 4.289 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](Cc2ccc(F)c(F)c2)[C@@H](C)CO1 ZINC000441437880 1043102785 /nfs/dbraw/zinc/10/27/85/1043102785.db2.gz IHQMYSLOLALBCJ-IFXJQAMLSA-N 1 2 317.379 4.235 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2ccc(F)c(F)c2)[C@@H](C)CO1 ZINC000441437880 1043102787 /nfs/dbraw/zinc/10/27/87/1043102787.db2.gz IHQMYSLOLALBCJ-IFXJQAMLSA-N 1 2 317.379 4.235 20 0 DIADLO CCC[C@H]([NH2+]Cc1cn(C2CC2)cn1)c1ccc(F)cc1F ZINC000865492383 1043104937 /nfs/dbraw/zinc/10/49/37/1043104937.db2.gz XRSILCXKQYNMSU-KRWDZBQOSA-N 1 2 305.372 4.127 20 0 DIADLO O=C(C[C@@H]1CCC[N@H+]1Cc1ccnc(Cl)c1)c1cccs1 ZINC000177400259 1043106143 /nfs/dbraw/zinc/10/61/43/1043106143.db2.gz WPGKFZHMXZGNBB-ZDUSSCGKSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@@H]1CCC[N@@H+]1Cc1ccnc(Cl)c1)c1cccs1 ZINC000177400259 1043106147 /nfs/dbraw/zinc/10/61/47/1043106147.db2.gz WPGKFZHMXZGNBB-ZDUSSCGKSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@H]1CCC[N@H+]1Cc1ccc(Cl)nc1)c1cccs1 ZINC000177395605 1043106804 /nfs/dbraw/zinc/10/68/04/1043106804.db2.gz LKYCNFJUOCVKQU-CYBMUJFWSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@H]1CCC[N@@H+]1Cc1ccc(Cl)nc1)c1cccs1 ZINC000177395605 1043106809 /nfs/dbraw/zinc/10/68/09/1043106809.db2.gz LKYCNFJUOCVKQU-CYBMUJFWSA-N 1 2 320.845 4.034 20 0 DIADLO Cc1ncc(C[N@H+](Cc2cccc(C)c2)Cc2ccccn2)s1 ZINC000177647240 1043111720 /nfs/dbraw/zinc/11/17/20/1043111720.db2.gz AJEGJWPHBPPSFX-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2cccc(C)c2)Cc2ccccn2)s1 ZINC000177647240 1043111731 /nfs/dbraw/zinc/11/17/31/1043111731.db2.gz AJEGJWPHBPPSFX-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl)c1cnccn1 ZINC000178053327 1043118890 /nfs/dbraw/zinc/11/88/90/1043118890.db2.gz HCNWMGSSFNPNRU-RKDXNWHRSA-N 1 2 314.191 4.334 20 0 DIADLO COc1cnccc1[C@H](C)[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000188774528 1043125484 /nfs/dbraw/zinc/12/54/84/1043125484.db2.gz YWECIZPMRKAMNS-RYUDHWBXSA-N 1 2 305.447 4.082 20 0 DIADLO c1cncc([C@@H](Nc2ccc(N3CCCC3)[nH+]c2)C2CCC2)c1 ZINC000280805786 1043131070 /nfs/dbraw/zinc/13/10/70/1043131070.db2.gz IUBVSBHPXCVZHX-IBGZPJMESA-N 1 2 308.429 4.030 20 0 DIADLO Fc1ccccc1-c1noc(C[N@H+](Cc2ccccc2)C2CC2)n1 ZINC000188941241 1043134791 /nfs/dbraw/zinc/13/47/91/1043134791.db2.gz YFGMPHBRUPNQDW-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1ccccc1-c1noc(C[N@@H+](Cc2ccccc2)C2CC2)n1 ZINC000188941241 1043134797 /nfs/dbraw/zinc/13/47/97/1043134797.db2.gz YFGMPHBRUPNQDW-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+]Cc2cc(F)ccc2Cl)o1 ZINC000189436826 1043151867 /nfs/dbraw/zinc/15/18/67/1043151867.db2.gz BGEVHQWYVIRPIQ-OAHLLOKOSA-N 1 2 311.784 4.112 20 0 DIADLO COc1cnccc1[C@@H](C)[NH2+]Cc1ccc(Oc2ccccc2)o1 ZINC000189549861 1043157924 /nfs/dbraw/zinc/15/79/24/1043157924.db2.gz MYFJNQCJVXFJRJ-CQSZACIVSA-N 1 2 324.380 4.326 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+](C)Cc2ccoc2C)s1 ZINC000183572353 1043166589 /nfs/dbraw/zinc/16/65/89/1043166589.db2.gz YBSFQGYKXFWWKI-UHFFFAOYSA-N 1 2 304.337 4.004 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+](C)Cc2ccoc2C)s1 ZINC000183572353 1043166597 /nfs/dbraw/zinc/16/65/97/1043166597.db2.gz YBSFQGYKXFWWKI-UHFFFAOYSA-N 1 2 304.337 4.004 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1nc(C(C)(C)C)no1 ZINC000073984209 1043168149 /nfs/dbraw/zinc/16/81/49/1043168149.db2.gz IDSMVJYQEREAIA-QWRGUYRKSA-N 1 2 307.825 4.432 20 0 DIADLO c1ccc(COCc2cccc(CNc3cccc[nH+]3)c2)cc1 ZINC000076746070 1043171471 /nfs/dbraw/zinc/17/14/71/1043171471.db2.gz VYKBOIOYFWCUDP-UHFFFAOYSA-N 1 2 304.393 4.411 20 0 DIADLO C[C@H]([NH2+]Cc1ccon1)c1cccc(SC(F)(F)F)c1 ZINC000866278059 1043172122 /nfs/dbraw/zinc/17/21/22/1043172122.db2.gz LRUFSNQUBMQTOZ-VIFPVBQESA-N 1 2 302.321 4.137 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)s1 ZINC000866335829 1043182867 /nfs/dbraw/zinc/18/28/67/1043182867.db2.gz AXYSVUZWXSEICG-SFYZADRCSA-N 1 2 322.821 4.053 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1cc2ccccc2s1 ZINC000184365679 1043183018 /nfs/dbraw/zinc/18/30/18/1043183018.db2.gz NHSZHLHHYIURJC-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO F[C@@H]1COc2ccccc2[C@@H]1[NH2+][C@H]1CCCc2sccc21 ZINC000866339425 1043183132 /nfs/dbraw/zinc/18/31/32/1043183132.db2.gz BMBSEBJNBREBIJ-KEYYUXOJSA-N 1 2 303.402 4.187 20 0 DIADLO F[C@@H]1COc2ccccc2[C@H]1[NH2+][C@@H]1CCCc2sccc21 ZINC000866339422 1043183221 /nfs/dbraw/zinc/18/32/21/1043183221.db2.gz BMBSEBJNBREBIJ-CKEIUWERSA-N 1 2 303.402 4.187 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@@H](C)c2cc3ccccc3s2)n1 ZINC000184357022 1043183625 /nfs/dbraw/zinc/18/36/25/1043183625.db2.gz AZBPZTZDBHEOEG-LBPRGKRZSA-N 1 2 315.442 4.334 20 0 DIADLO COc1ccccc1[C@H]([NH2+][C@@H](C)c1cncc(C)c1)c1ccco1 ZINC000184416783 1043185234 /nfs/dbraw/zinc/18/52/34/1043185234.db2.gz XGWXKQQJBZTJDQ-YWZLYKJASA-N 1 2 322.408 4.432 20 0 DIADLO CCc1nc(C[NH2+][C@@H](CCc2ccccc2)c2ccccn2)co1 ZINC000866370739 1043191907 /nfs/dbraw/zinc/19/19/07/1043191907.db2.gz BWPNBIKRAWMTLB-IBGZPJMESA-N 1 2 321.424 4.096 20 0 DIADLO Cc1nn(C(C)(C)C)cc1[C@H](C)Nc1[nH+]c2ccccc2n1C ZINC000185316651 1043198365 /nfs/dbraw/zinc/19/83/65/1043198365.db2.gz QKVUKGFXVPMKTG-LBPRGKRZSA-N 1 2 311.433 4.006 20 0 DIADLO CC[C@@H]1[C@@H](C)CC[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000185599787 1043205698 /nfs/dbraw/zinc/20/56/98/1043205698.db2.gz YVZCKXRJOYTZJY-GXFFZTMASA-N 1 2 315.244 4.052 20 0 DIADLO CC[C@@H]1[C@@H](C)CC[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000185599787 1043205704 /nfs/dbraw/zinc/20/57/04/1043205704.db2.gz YVZCKXRJOYTZJY-GXFFZTMASA-N 1 2 315.244 4.052 20 0 DIADLO C[C@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1cccc(Cl)c1 ZINC000186059071 1043213074 /nfs/dbraw/zinc/21/30/74/1043213074.db2.gz DHXWWHNRUBOERG-LBPRGKRZSA-N 1 2 322.836 4.494 20 0 DIADLO COc1ccsc1[C@@H](C)[NH2+][C@H](COCC(C)C)c1ccco1 ZINC000186145105 1043215890 /nfs/dbraw/zinc/21/58/90/1043215890.db2.gz KZUIQHIOZRKUKG-ZIAGYGMSSA-N 1 2 323.458 4.414 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)cc1C(F)F)c1ccc(F)cc1Cl ZINC000866563703 1043224331 /nfs/dbraw/zinc/22/43/31/1043224331.db2.gz PQNRQWACOWYAIG-MRVPVSSYSA-N 1 2 317.742 4.001 20 0 DIADLO FC[C@H]([NH2+][C@H]1CCc2nc(Cl)ccc21)c1ccc(F)cc1 ZINC000866597469 1043230056 /nfs/dbraw/zinc/23/00/56/1043230056.db2.gz TWRDVXMZGGKKMX-ZFWWWQNUSA-N 1 2 308.759 4.162 20 0 DIADLO FC[C@@H]([NH2+][C@H]1CCc2nc(Cl)ccc21)c1ccc(F)cc1 ZINC000866597466 1043230231 /nfs/dbraw/zinc/23/02/31/1043230231.db2.gz TWRDVXMZGGKKMX-DZGCQCFKSA-N 1 2 308.759 4.162 20 0 DIADLO FC[C@@H]([NH2+][C@@H]1CCc2nc(Cl)ccc21)c1ccc(F)cc1 ZINC000866597468 1043230636 /nfs/dbraw/zinc/23/06/36/1043230636.db2.gz TWRDVXMZGGKKMX-UKRRQHHQSA-N 1 2 308.759 4.162 20 0 DIADLO c1csc([C@@H]2CSCC[N@H+]2CCSc2ccccc2)n1 ZINC000187028495 1043238926 /nfs/dbraw/zinc/23/89/26/1043238926.db2.gz XRVKHBHCEZXBGQ-AWEZNQCLSA-N 1 2 322.524 4.025 20 0 DIADLO c1csc([C@@H]2CSCC[N@@H+]2CCSc2ccccc2)n1 ZINC000187028495 1043238942 /nfs/dbraw/zinc/23/89/42/1043238942.db2.gz XRVKHBHCEZXBGQ-AWEZNQCLSA-N 1 2 322.524 4.025 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cc(F)c(F)c(F)c2)cnc1Cl ZINC000777439992 1043253403 /nfs/dbraw/zinc/25/34/03/1043253403.db2.gz BTIJXPLJTRZBHL-UHFFFAOYSA-N 1 2 314.738 4.093 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cc(F)c(F)c(F)c2)cnc1Cl ZINC000777439992 1043253411 /nfs/dbraw/zinc/25/34/11/1043253411.db2.gz BTIJXPLJTRZBHL-UHFFFAOYSA-N 1 2 314.738 4.093 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2ccc(Cl)nc2Cl)n1 ZINC000141606960 1043262956 /nfs/dbraw/zinc/26/29/56/1043262956.db2.gz VAYDVMIAVOIJAP-MRVPVSSYSA-N 1 2 302.230 4.004 20 0 DIADLO CCCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1cocn1 ZINC000192321600 1043268330 /nfs/dbraw/zinc/26/83/30/1043268330.db2.gz BSHVXRWJIVSJOS-KRWDZBQOSA-N 1 2 302.418 4.340 20 0 DIADLO Cc1cccc(C)c1OC[C@H]([NH2+]Cc1cocn1)c1ccccc1 ZINC000192324536 1043269447 /nfs/dbraw/zinc/26/94/47/1043269447.db2.gz KUAYCYOCFGQYTC-IBGZPJMESA-N 1 2 322.408 4.201 20 0 DIADLO Cc1cc(C[NH2+]Cc2c(Cl)cccc2SC(C)C)on1 ZINC000192681911 1043273506 /nfs/dbraw/zinc/27/35/06/1043273506.db2.gz HEJNSLUJXIHQHS-UHFFFAOYSA-N 1 2 310.850 4.427 20 0 DIADLO CC(C)c1cccc(C(C)C)c1NC(=O)CCc1c[nH+]cn1C ZINC000192824593 1043275189 /nfs/dbraw/zinc/27/51/89/1043275189.db2.gz JEGBNNOJXGLPMX-UHFFFAOYSA-N 1 2 313.445 4.238 20 0 DIADLO COC[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(Cl)cc1 ZINC000193677328 1043286002 /nfs/dbraw/zinc/28/60/02/1043286002.db2.gz NJAMJXNXZSOQFL-AWEZNQCLSA-N 1 2 322.861 4.151 20 0 DIADLO CCCc1nc(C[NH2+][C@H](COC)c2ccc(Cl)cc2)cs1 ZINC000193690740 1043286713 /nfs/dbraw/zinc/28/67/13/1043286713.db2.gz FYQVGJMBHYGSHQ-OAHLLOKOSA-N 1 2 324.877 4.226 20 0 DIADLO c1cn(Cc2ccc(-c3cccc(N4CCCC4)c3)cc2)c[nH+]1 ZINC000665211668 1043286893 /nfs/dbraw/zinc/28/68/93/1043286893.db2.gz BVQDBQGHSYRXDD-UHFFFAOYSA-N 1 2 303.409 4.199 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ncc(Cl)n2C)c1C ZINC000122277567 1043291827 /nfs/dbraw/zinc/29/18/27/1043291827.db2.gz XNRBCMPIAXHDOT-HNNXBMFYSA-N 1 2 303.837 4.027 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)n2C)c1C ZINC000122277567 1043291835 /nfs/dbraw/zinc/29/18/35/1043291835.db2.gz XNRBCMPIAXHDOT-HNNXBMFYSA-N 1 2 303.837 4.027 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)nn1C ZINC000487403481 1043295478 /nfs/dbraw/zinc/29/54/78/1043295478.db2.gz YSNMVXMPWVBLEH-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO Cc1cc(C[N@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)nn1C ZINC000487403481 1043295486 /nfs/dbraw/zinc/29/54/86/1043295486.db2.gz YSNMVXMPWVBLEH-LLVKDONJSA-N 1 2 312.244 4.228 20 0 DIADLO Cc1cnc([C@@H](C)SCc2ccc(-n3cc[nH+]c3)cc2C)cn1 ZINC000427664258 1043295567 /nfs/dbraw/zinc/29/55/67/1043295567.db2.gz HWOPXWCHDZDROC-OAHLLOKOSA-N 1 2 324.453 4.274 20 0 DIADLO Cc1nc([C@H](C)Nc2ccc3c(c2)CCC[N@H+]3C)c(C)s1 ZINC000777492318 1043295521 /nfs/dbraw/zinc/29/55/21/1043295521.db2.gz HZFZJRHOYWRYGL-NSHDSACASA-N 1 2 301.459 4.315 20 0 DIADLO Cc1nc([C@H](C)Nc2ccc3c(c2)CCC[N@@H+]3C)c(C)s1 ZINC000777492318 1043295531 /nfs/dbraw/zinc/29/55/31/1043295531.db2.gz HZFZJRHOYWRYGL-NSHDSACASA-N 1 2 301.459 4.315 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@H](c2nccn2C)c2ccc(F)cc2)cc1 ZINC000268746801 1043326395 /nfs/dbraw/zinc/32/63/95/1043326395.db2.gz FYCBHVVJPXALLO-KXBFYZLASA-N 1 2 323.415 4.308 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@H](c2nccn2C)c2ccc(F)cc2)cc1 ZINC000268746785 1043326791 /nfs/dbraw/zinc/32/67/91/1043326791.db2.gz FYCBHVVJPXALLO-BEFAXECRSA-N 1 2 323.415 4.308 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2cc3ccccc3o2)s1 ZINC000269114696 1043356171 /nfs/dbraw/zinc/35/61/71/1043356171.db2.gz WKGXYXURAHQAJE-LLVKDONJSA-N 1 2 301.415 4.259 20 0 DIADLO COc1cccc([C@@H](C)[NH2+][C@H](C)c2nc(-c3ccccc3)no2)c1 ZINC000269085069 1043357150 /nfs/dbraw/zinc/35/71/50/1043357150.db2.gz MBYKNNIFLYQYEC-ZIAGYGMSSA-N 1 2 323.396 4.157 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H]2CC(C)(C)Cc3occc32)cs1 ZINC000269087701 1043357188 /nfs/dbraw/zinc/35/71/88/1043357188.db2.gz PWDSVZWAOFOXFH-FZMZJTMJSA-N 1 2 320.458 4.247 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000123419881 1043360281 /nfs/dbraw/zinc/36/02/81/1043360281.db2.gz ROHFCJBUDXCPPZ-FGTMMUONSA-N 1 2 319.493 4.289 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccc(F)cc2C(F)(F)F)cs1 ZINC000269388356 1043363772 /nfs/dbraw/zinc/36/37/72/1043363772.db2.gz BSCLDKIRNMLBLG-QMMMGPOBSA-N 1 2 318.339 4.460 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccccc2OC(F)(F)F)cs1 ZINC000269433181 1043366366 /nfs/dbraw/zinc/36/63/66/1043366366.db2.gz QGWPVILQFNEHQV-SECBINFHSA-N 1 2 316.348 4.201 20 0 DIADLO CC(C)[N@H+](Cc1ccco1)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000521187647 1043372216 /nfs/dbraw/zinc/37/22/16/1043372216.db2.gz UWSVCCAFRNVQPH-UHFFFAOYSA-N 1 2 314.360 4.484 20 0 DIADLO CC(C)[N@@H+](Cc1ccco1)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000521187647 1043372224 /nfs/dbraw/zinc/37/22/24/1043372224.db2.gz UWSVCCAFRNVQPH-UHFFFAOYSA-N 1 2 314.360 4.484 20 0 DIADLO Cc1nnsc1C[N@@H+](C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000521253143 1043381078 /nfs/dbraw/zinc/38/10/78/1043381078.db2.gz UZIPQELOXMHGQN-VIFPVBQESA-N 1 2 316.257 4.346 20 0 DIADLO Cc1nnsc1C[N@H+](C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000521253143 1043381091 /nfs/dbraw/zinc/38/10/91/1043381091.db2.gz UZIPQELOXMHGQN-VIFPVBQESA-N 1 2 316.257 4.346 20 0 DIADLO C[C@H](c1nc2ccccc2c(=O)[nH]1)[N@H+]1CC=C(C(C)(C)C)CC1 ZINC000270352713 1043384377 /nfs/dbraw/zinc/38/43/77/1043384377.db2.gz ICEJHPLIFIFBGN-CYBMUJFWSA-N 1 2 311.429 4.075 20 0 DIADLO C[C@H](c1nc2ccccc2c(=O)[nH]1)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000270352713 1043384388 /nfs/dbraw/zinc/38/43/88/1043384388.db2.gz ICEJHPLIFIFBGN-CYBMUJFWSA-N 1 2 311.429 4.075 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2cccc(C)c2)c2ccccn2)c(C)o1 ZINC000123735882 1043387198 /nfs/dbraw/zinc/38/71/98/1043387198.db2.gz XPMUFQGCPQEOFY-FQEVSTJZSA-N 1 2 306.409 4.479 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270663530 1043393399 /nfs/dbraw/zinc/39/33/99/1043393399.db2.gz WBGAOEWXYBRMSX-LRDDRELGSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270663530 1043393410 /nfs/dbraw/zinc/39/34/10/1043393410.db2.gz WBGAOEWXYBRMSX-LRDDRELGSA-N 1 2 300.377 4.274 20 0 DIADLO CC(C)c1nnc([C@@H](C)[NH2+]Cc2ccc(-c3ccccc3)o2)[nH]1 ZINC000270713839 1043395503 /nfs/dbraw/zinc/39/55/03/1043395503.db2.gz MAIMXXURKCALMU-CYBMUJFWSA-N 1 2 310.401 4.039 20 0 DIADLO Cc1conc1C[NH2+]C(c1cccc(C)c1)c1cccc(C)c1 ZINC000871829454 1043399802 /nfs/dbraw/zinc/39/98/02/1043399802.db2.gz NKLJLENDMIVJJK-UHFFFAOYSA-N 1 2 306.409 4.479 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cnc([C@@H]2CCCO2)s1 ZINC000271051793 1043400131 /nfs/dbraw/zinc/40/01/31/1043400131.db2.gz PUAAIAPVSUWDMC-LRDDRELGSA-N 1 2 320.433 4.327 20 0 DIADLO Brc1csc(C[N@@H+]2CCC[C@H]2c2cccnc2)c1 ZINC000346988053 1043400269 /nfs/dbraw/zinc/40/02/69/1043400269.db2.gz QYRKFTIRAXQTLP-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1csc(C[N@H+]2CCC[C@H]2c2cccnc2)c1 ZINC000346988053 1043400275 /nfs/dbraw/zinc/40/02/75/1043400275.db2.gz QYRKFTIRAXQTLP-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cnc([C@@H]2CCCO2)s1 ZINC000271051793 1043400140 /nfs/dbraw/zinc/40/01/40/1043400140.db2.gz PUAAIAPVSUWDMC-LRDDRELGSA-N 1 2 320.433 4.327 20 0 DIADLO C[C@H](c1cccs1)[N@H+](Cc1ccn(C)n1)Cc1ccccc1 ZINC000271092933 1043402403 /nfs/dbraw/zinc/40/24/03/1043402403.db2.gz WMBKCKGWXXXJOY-OAHLLOKOSA-N 1 2 311.454 4.245 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](Cc1ccn(C)n1)Cc1ccccc1 ZINC000271092933 1043402416 /nfs/dbraw/zinc/40/24/16/1043402416.db2.gz WMBKCKGWXXXJOY-OAHLLOKOSA-N 1 2 311.454 4.245 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)cc1C(F)(F)F)c1cscn1 ZINC000271069934 1043402582 /nfs/dbraw/zinc/40/25/82/1043402582.db2.gz DVLVJEQBRJMMPK-MRVPVSSYSA-N 1 2 304.312 4.152 20 0 DIADLO CC(C)c1csc(C[NH2+][C@H](C)c2ccnn2CC2CCC2)n1 ZINC000925283602 1043405426 /nfs/dbraw/zinc/40/54/26/1043405426.db2.gz RVULHDAAZLLJMD-CYBMUJFWSA-N 1 2 318.490 4.114 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@H]1CC(C)(C)Oc2ccccc21 ZINC000925274638 1043406380 /nfs/dbraw/zinc/40/63/80/1043406380.db2.gz NOWOZILDEYWFAN-GJZGRUSLSA-N 1 2 312.413 4.252 20 0 DIADLO CC(C)c1nc([C@@H]2CCC[N@@H+]2Cc2cccc3cc[nH]c32)no1 ZINC000271199089 1043406487 /nfs/dbraw/zinc/40/64/87/1043406487.db2.gz VQMPWCXVEGISDZ-HNNXBMFYSA-N 1 2 310.401 4.011 20 0 DIADLO CC(C)c1nc([C@@H]2CCC[N@H+]2Cc2cccc3cc[nH]c32)no1 ZINC000271199089 1043406495 /nfs/dbraw/zinc/40/64/95/1043406495.db2.gz VQMPWCXVEGISDZ-HNNXBMFYSA-N 1 2 310.401 4.011 20 0 DIADLO CCc1cccc2c1OCC[C@H]2[NH2+][C@@H]1CCCc2oc(C)nc21 ZINC000925359701 1043413060 /nfs/dbraw/zinc/41/30/60/1043413060.db2.gz CVBFCNWJJKUOIF-HZPDHXFCSA-N 1 2 312.413 4.036 20 0 DIADLO C[C@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1ccc(Cl)s1 ZINC000271425294 1043415902 /nfs/dbraw/zinc/41/59/02/1043415902.db2.gz CRKNOFPMBFMCDD-KWQFWETISA-N 1 2 317.788 4.064 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nnc(C)s2)o1 ZINC000271428903 1043417742 /nfs/dbraw/zinc/41/77/42/1043417742.db2.gz NQWSFVUWSNDJLY-AWEZNQCLSA-N 1 2 305.447 4.119 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@H+]2Cc2nnc(C)s2)o1 ZINC000271428903 1043417748 /nfs/dbraw/zinc/41/77/48/1043417748.db2.gz NQWSFVUWSNDJLY-AWEZNQCLSA-N 1 2 305.447 4.119 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1cn2c(n1)CCCC2)c1cc(F)ccc1F ZINC000925454784 1043419149 /nfs/dbraw/zinc/41/91/49/1043419149.db2.gz ZOWCPODONZEWCX-WBMJQRKESA-N 1 2 319.399 4.300 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1cn2c(n1)CCCC2)c1cc(F)ccc1F ZINC000925454781 1043419183 /nfs/dbraw/zinc/41/91/83/1043419183.db2.gz ZOWCPODONZEWCX-BLLLJJGKSA-N 1 2 319.399 4.300 20 0 DIADLO C[C@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1ccc(Cl)cc1 ZINC000271485394 1043424483 /nfs/dbraw/zinc/42/44/83/1043424483.db2.gz OERUKIQJFDTMFR-BONVTDFDSA-N 1 2 311.759 4.002 20 0 DIADLO Clc1ccc2c(c1)[C@@H]([NH2+][C@H]1CCc3c1nccc3Cl)CO2 ZINC000925532078 1043426553 /nfs/dbraw/zinc/42/65/53/1043426553.db2.gz QDRVDTFRBQULQE-KBPBESRZSA-N 1 2 321.207 4.099 20 0 DIADLO Clc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCc3c1nccc3Cl)CO2 ZINC000925532079 1043426642 /nfs/dbraw/zinc/42/66/42/1043426642.db2.gz QDRVDTFRBQULQE-KGLIPLIRSA-N 1 2 321.207 4.099 20 0 DIADLO Clc1ccnc2c1CCC[C@H]2[NH2+]Cc1nc(C2CC2)cs1 ZINC000925546719 1043428517 /nfs/dbraw/zinc/42/85/17/1043428517.db2.gz MOHWWGLHJNSGPY-CYBMUJFWSA-N 1 2 319.861 4.236 20 0 DIADLO CCOC(=O)[C@@H](c1ccccc1)[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000558054348 1043429059 /nfs/dbraw/zinc/42/90/59/1043429059.db2.gz URYZWXIHKWTZGU-DLBZAZTESA-N 1 2 315.438 4.189 20 0 DIADLO CCOC(=O)[C@@H](c1ccccc1)[N@H+]1CCC[C@H]1c1ccsc1 ZINC000558054348 1043429062 /nfs/dbraw/zinc/42/90/62/1043429062.db2.gz URYZWXIHKWTZGU-DLBZAZTESA-N 1 2 315.438 4.189 20 0 DIADLO FC(F)C1CCC(Nc2ccc(N3CCCCC3)[nH+]c2)CC1 ZINC000442841678 1043433788 /nfs/dbraw/zinc/43/37/88/1043433788.db2.gz ANMZFLAMMURNFF-UHFFFAOYSA-N 1 2 309.404 4.308 20 0 DIADLO CC[C@@H](CCC(F)(F)F)[NH2+]c1ccc(N2CCOCC2)cc1 ZINC000872055723 1043439484 /nfs/dbraw/zinc/43/94/84/1043439484.db2.gz KFFOSPVTRHZWHT-ZDUSSCGKSA-N 1 2 316.367 4.056 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+](C)[C@@H](C)c3cccnc3)o2)cc1 ZINC000271615929 1043444782 /nfs/dbraw/zinc/44/47/82/1043444782.db2.gz XDGBKQJUVZNYIZ-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+](C)[C@@H](C)c3cccnc3)o2)cc1 ZINC000271615929 1043444790 /nfs/dbraw/zinc/44/47/90/1043444790.db2.gz XDGBKQJUVZNYIZ-HNNXBMFYSA-N 1 2 307.397 4.238 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1cc(O)ccc1F ZINC000872086407 1043454103 /nfs/dbraw/zinc/45/41/03/1043454103.db2.gz WBQDBMYLZNSLMJ-NSHDSACASA-N 1 2 319.351 4.062 20 0 DIADLO C[C@@H](Nc1ccc([NH+]2CCCC2)cc1)c1ccnn1CC1CCC1 ZINC000925729222 1043457490 /nfs/dbraw/zinc/45/74/90/1043457490.db2.gz ZERCWFHFXVPPPE-MRXNPFEDSA-N 1 2 324.472 4.457 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(-c2ccccc2)[nH]1)c1ccc(C)cc1 ZINC000777574132 1043460845 /nfs/dbraw/zinc/46/08/45/1043460845.db2.gz HCYGEBIFAZZMKV-QGZVFWFLSA-N 1 2 306.413 4.021 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(-c2ccccc2)n[nH]1)c1ccc(C)cc1 ZINC000777574132 1043460849 /nfs/dbraw/zinc/46/08/49/1043460849.db2.gz HCYGEBIFAZZMKV-QGZVFWFLSA-N 1 2 306.413 4.021 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nnc(-c3ccccc3)[nH]2)cc(C)c1F ZINC000777573569 1043461897 /nfs/dbraw/zinc/46/18/97/1043461897.db2.gz BGNQNUZZIVPVQE-AWEZNQCLSA-N 1 2 324.403 4.078 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncc(Cl)s1)c1cc(C)ccc1OC ZINC000872115158 1043465092 /nfs/dbraw/zinc/46/50/92/1043465092.db2.gz IBBCEZGCCITBFU-GFCCVEGCSA-N 1 2 310.850 4.354 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+][C@@H](C)c1nnc(C)s1 ZINC000283187703 1043465904 /nfs/dbraw/zinc/46/59/04/1043465904.db2.gz QKZNMAJWWCMOOO-FZMZJTMJSA-N 1 2 305.447 4.047 20 0 DIADLO CC(C)c1ncc(C[N@H+](C)Cc2cc(F)cc(Cl)c2)cn1 ZINC000443059806 1043474008 /nfs/dbraw/zinc/47/40/08/1043474008.db2.gz DJQWSFWZJQVADN-UHFFFAOYSA-N 1 2 307.800 4.025 20 0 DIADLO CC(C)c1ncc(C[N@@H+](C)Cc2cc(F)cc(Cl)c2)cn1 ZINC000443059806 1043474024 /nfs/dbraw/zinc/47/40/24/1043474024.db2.gz DJQWSFWZJQVADN-UHFFFAOYSA-N 1 2 307.800 4.025 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)s1 ZINC000348924216 1043481145 /nfs/dbraw/zinc/48/11/45/1043481145.db2.gz VSKGTLZVEAZXEW-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCC[C@H]2c2ccncc2)s1 ZINC000348924216 1043481150 /nfs/dbraw/zinc/48/11/50/1043481150.db2.gz VSKGTLZVEAZXEW-ZDUSSCGKSA-N 1 2 312.360 4.499 20 0 DIADLO CCC(CC)c1noc([C@H]([NH3+])c2cccc(C(F)(F)F)c2)n1 ZINC000872176272 1043484625 /nfs/dbraw/zinc/48/46/25/1043484625.db2.gz XQQYYOUAZFXQRM-GFCCVEGCSA-N 1 2 313.323 4.040 20 0 DIADLO CCC[C@@H](C)c1noc([C@H]([NH3+])c2ccc(C(F)(F)F)cc2)n1 ZINC000872174905 1043484836 /nfs/dbraw/zinc/48/48/36/1043484836.db2.gz FYXAJTIBTHRXJN-BXKDBHETSA-N 1 2 313.323 4.040 20 0 DIADLO C[C@H](Nc1ccc2nc(C3CC3)oc2c1)c1cn2c([nH+]1)CCCC2 ZINC000925917552 1043492756 /nfs/dbraw/zinc/49/27/56/1043492756.db2.gz BVPLNEKPWZYOJS-LBPRGKRZSA-N 1 2 322.412 4.411 20 0 DIADLO c1ccc([C@H](Nc2ccc(N3CCCC3)[nH+]c2)C2CCC2)nc1 ZINC000925932361 1043495333 /nfs/dbraw/zinc/49/53/33/1043495333.db2.gz JRFLYDOQIYXABU-LJQANCHMSA-N 1 2 308.429 4.030 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1c[nH]c3c1cccc3F)CC2 ZINC001137059383 1043495753 /nfs/dbraw/zinc/49/57/53/1043495753.db2.gz YZLYFJRISPSZLR-UHFFFAOYSA-N 1 2 322.383 4.068 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1c[nH]c3c1cccc3F)CC2 ZINC001137059383 1043495762 /nfs/dbraw/zinc/49/57/62/1043495762.db2.gz YZLYFJRISPSZLR-UHFFFAOYSA-N 1 2 322.383 4.068 20 0 DIADLO c1nc(C2CCCC2)sc1C[N@H+](Cc1ccccn1)C1CC1 ZINC000349278357 1043500532 /nfs/dbraw/zinc/50/05/32/1043500532.db2.gz MVZWPVMVIXYUES-UHFFFAOYSA-N 1 2 313.470 4.360 20 0 DIADLO c1nc(C2CCCC2)sc1C[N@@H+](Cc1ccccn1)C1CC1 ZINC000349278357 1043500544 /nfs/dbraw/zinc/50/05/44/1043500544.db2.gz MVZWPVMVIXYUES-UHFFFAOYSA-N 1 2 313.470 4.360 20 0 DIADLO CC(=O)C1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)CC1 ZINC000872668131 1043506078 /nfs/dbraw/zinc/50/60/78/1043506078.db2.gz XGWDJVOSNGOHNB-UHFFFAOYSA-N 1 2 322.330 4.059 20 0 DIADLO FCc1ccc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000777583399 1043512777 /nfs/dbraw/zinc/51/27/77/1043512777.db2.gz OYPWTARKKSASIT-UHFFFAOYSA-N 1 2 309.388 4.082 20 0 DIADLO FCc1ccc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000777583399 1043512787 /nfs/dbraw/zinc/51/27/87/1043512787.db2.gz OYPWTARKKSASIT-UHFFFAOYSA-N 1 2 309.388 4.082 20 0 DIADLO Fc1ccc2oc(CNc3ccc([NH+]4CCCC4)cc3)nc2c1 ZINC000873018394 1043514297 /nfs/dbraw/zinc/51/42/97/1043514297.db2.gz UFOKNXVVXVMSIG-UHFFFAOYSA-N 1 2 311.360 4.179 20 0 DIADLO Fc1cccc2c1SCC[C@H]2[NH2+]Cc1ncc(Cl)s1 ZINC000349645661 1043515794 /nfs/dbraw/zinc/51/57/94/1043515794.db2.gz LXKDAVPZSQSRIO-SNVBAGLBSA-N 1 2 314.838 4.262 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CC(C)(C)[C@H]2[C@@H]2CCCO2)cs1 ZINC000558469952 1043515927 /nfs/dbraw/zinc/51/59/27/1043515927.db2.gz KNPKCXKYGZJUNW-DOTOQJQBSA-N 1 2 322.518 4.121 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CC(C)(C)[C@H]2[C@@H]2CCCO2)cs1 ZINC000558469952 1043515935 /nfs/dbraw/zinc/51/59/35/1043515935.db2.gz KNPKCXKYGZJUNW-DOTOQJQBSA-N 1 2 322.518 4.121 20 0 DIADLO Fc1cccc2c1SCC[C@@H]2[NH2+]Cc1ncc(Cl)s1 ZINC000349645571 1043516961 /nfs/dbraw/zinc/51/69/61/1043516961.db2.gz LXKDAVPZSQSRIO-JTQLQIEISA-N 1 2 314.838 4.262 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)Cc1nc(C)cs1 ZINC000349678280 1043517086 /nfs/dbraw/zinc/51/70/86/1043517086.db2.gz IIAQMZUNVTYIAM-UHFFFAOYSA-N 1 2 300.427 4.392 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)Cc1nc(C)cs1 ZINC000349678280 1043517102 /nfs/dbraw/zinc/51/71/02/1043517102.db2.gz IIAQMZUNVTYIAM-UHFFFAOYSA-N 1 2 300.427 4.392 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](C)Cc2cnn(-c3ccccc3)c2)o1 ZINC000349642264 1043517649 /nfs/dbraw/zinc/51/76/49/1043517649.db2.gz PTUKZFCHCROEKE-DNVCBOLYSA-N 1 2 321.424 4.221 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)o1 ZINC000349642264 1043517656 /nfs/dbraw/zinc/51/76/56/1043517656.db2.gz PTUKZFCHCROEKE-DNVCBOLYSA-N 1 2 321.424 4.221 20 0 DIADLO Cc1cccc(Nc2ccn3cc[nH+]c3c2)c1Br ZINC001204983044 1043518555 /nfs/dbraw/zinc/51/85/55/1043518555.db2.gz NDALTVBYQXNXDD-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO Cc1cc(C[NH2+]Cc2ncc(Cl)s2)ccc1C(F)(F)F ZINC000873165156 1043520740 /nfs/dbraw/zinc/52/07/40/1043520740.db2.gz QGGLNJLULFUYBW-UHFFFAOYSA-N 1 2 320.767 4.414 20 0 DIADLO CSc1ccc(C[NH2+]Cc2noc3c2CC(C)(C)CC3)cc1 ZINC000873175801 1043523508 /nfs/dbraw/zinc/52/35/08/1043523508.db2.gz RSYUINIBRJBSQY-UHFFFAOYSA-N 1 2 316.470 4.201 20 0 DIADLO CCc1cccc(C[NH2+]Cc2csc(C(F)(F)F)n2)c1 ZINC000895176494 1043528021 /nfs/dbraw/zinc/52/80/21/1043528021.db2.gz AZTOHXMELKFQIF-UHFFFAOYSA-N 1 2 300.349 4.014 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@H]1CCCOc2c(F)cccc21 ZINC000926111836 1043530120 /nfs/dbraw/zinc/53/01/20/1043530120.db2.gz KIGIEEYKUHTZAG-GJZGRUSLSA-N 1 2 316.376 4.003 20 0 DIADLO CC(C)c1nn(-c2ccccc2)cc1C[N@H+](C)Cc1ccccn1 ZINC000350388103 1043545450 /nfs/dbraw/zinc/54/54/50/1043545450.db2.gz GJXNVLFTPUXRDK-UHFFFAOYSA-N 1 2 320.440 4.023 20 0 DIADLO CC(C)c1nn(-c2ccccc2)cc1C[N@@H+](C)Cc1ccccn1 ZINC000350388103 1043545458 /nfs/dbraw/zinc/54/54/58/1043545458.db2.gz GJXNVLFTPUXRDK-UHFFFAOYSA-N 1 2 320.440 4.023 20 0 DIADLO FC1(F)CC([NH2+][C@H](c2cc3ccccc3o2)c2ccccn2)C1 ZINC000926282724 1043558240 /nfs/dbraw/zinc/55/82/40/1043558240.db2.gz GMOGTXIUWGMYIG-KRWDZBQOSA-N 1 2 314.335 4.305 20 0 DIADLO CC(C)n1cc(C[N@H+](Cc2ccccc2)Cc2ccccn2)cn1 ZINC001137072707 1043558616 /nfs/dbraw/zinc/55/86/16/1043558616.db2.gz DLISQIAICWZDEY-UHFFFAOYSA-N 1 2 320.440 4.061 20 0 DIADLO CC(C)n1cc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)cn1 ZINC001137072707 1043558628 /nfs/dbraw/zinc/55/86/28/1043558628.db2.gz DLISQIAICWZDEY-UHFFFAOYSA-N 1 2 320.440 4.061 20 0 DIADLO Fc1cc(Nc2ccn3cc[nH+]c3c2)cc(Br)c1F ZINC001204990877 1043560807 /nfs/dbraw/zinc/56/08/07/1043560807.db2.gz HULJWOJGVHNMEP-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Fc1cc(F)c(C[NH2+][C@H](c2ccccn2)C2CCC2)c(F)c1F ZINC000926321004 1043562509 /nfs/dbraw/zinc/56/25/09/1043562509.db2.gz LCGMYWBFQJDQAN-KRWDZBQOSA-N 1 2 324.321 4.269 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ncc(-c2ccccc2)cn1)c1cccnc1 ZINC000558633605 1043562714 /nfs/dbraw/zinc/56/27/14/1043562714.db2.gz JWFYRHSTQZUSMA-FQEVSTJZSA-N 1 2 318.424 4.026 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)C1CCC(F)(F)CC1 ZINC000474066993 1043564424 /nfs/dbraw/zinc/56/44/24/1043564424.db2.gz NYRVCOONSUPBGG-CYBMUJFWSA-N 1 2 309.404 4.308 20 0 DIADLO Fc1c(Br)ccc(Nc2ccn3cc[nH+]c3c2)c1F ZINC001204992000 1043566038 /nfs/dbraw/zinc/56/60/38/1043566038.db2.gz WSRHGUNUGPULDD-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2csc(C(F)(F)F)c2)no1 ZINC000926364743 1043569740 /nfs/dbraw/zinc/56/97/40/1043569740.db2.gz NQBSWTMMQHYDEP-IUCAKERBSA-N 1 2 304.337 4.475 20 0 DIADLO Cc1ccc(Cl)c2c1N(Cc1cc[nH+]c(N(C)C)c1)CCC2 ZINC001307824576 1043570652 /nfs/dbraw/zinc/57/06/52/1043570652.db2.gz JZEAZDWJEOKVNT-UHFFFAOYSA-N 1 2 315.848 4.062 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C3(C)CC(F)(F)C3)c2)[nH+]c1C ZINC000874160792 1043572138 /nfs/dbraw/zinc/57/21/38/1043572138.db2.gz HTTWUCASPQIUTR-UHFFFAOYSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1cc(N2CCSCC2)ccc1[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000558698449 1043576683 /nfs/dbraw/zinc/57/66/83/1043576683.db2.gz YASVEBOBUNVILV-LESCRADOSA-N 1 2 302.487 4.149 20 0 DIADLO C[C@H]1CCCN1c1cc[nH+]c2c(Br)ccc(F)c12 ZINC000443507591 1043580854 /nfs/dbraw/zinc/58/08/54/1043580854.db2.gz GOOXQRVMJFURDM-VIFPVBQESA-N 1 2 309.182 4.125 20 0 DIADLO Fc1cc(F)c(C[NH2+][C@H](c2ccccn2)C2CCC2)c(F)c1 ZINC000926490756 1043584518 /nfs/dbraw/zinc/58/45/18/1043584518.db2.gz XRXFTTNICQWZBU-KRWDZBQOSA-N 1 2 306.331 4.130 20 0 DIADLO CCc1noc(C)c1C[NH2+][C@H](c1ccc(C)cc1)c1cccnc1 ZINC000926483518 1043584810 /nfs/dbraw/zinc/58/48/10/1043584810.db2.gz WJNIHNRMBOPFIX-HXUWFJFHSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1nn(Cc2ccccc2)c(C)c1CNc1ccc(C)[nH+]c1C ZINC000353222747 1043591513 /nfs/dbraw/zinc/59/15/13/1043591513.db2.gz QUUNKMVQYPTJDF-UHFFFAOYSA-N 1 2 320.440 4.172 20 0 DIADLO C/C=C/c1ccc(NC(=O)N2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)cc1 ZINC000353243929 1043593773 /nfs/dbraw/zinc/59/37/73/1043593773.db2.gz NNZVSTMMZLKFTL-AIWSSPEVSA-N 1 2 324.428 4.031 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](c1ccc(C)cc1)c1cccnc1 ZINC000926532941 1043594772 /nfs/dbraw/zinc/59/47/72/1043594772.db2.gz OCDGURVFMUCGFJ-VQIMIIECSA-N 1 2 320.440 4.047 20 0 DIADLO COc1cccnc1C[NH2+][C@@H](C)c1csc(C(F)(F)F)c1 ZINC000926552618 1043599341 /nfs/dbraw/zinc/59/93/41/1043599341.db2.gz VFIYSRRXTWEULD-VIFPVBQESA-N 1 2 316.348 4.021 20 0 DIADLO CCOC(=O)c1coc(C[N@H+](C)[C@H](C)c2ccccc2Cl)c1 ZINC000474096204 1043600435 /nfs/dbraw/zinc/60/04/35/1043600435.db2.gz IFVUJDPFQKFIED-GFCCVEGCSA-N 1 2 321.804 4.303 20 0 DIADLO CCOC(=O)c1coc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)c1 ZINC000474096204 1043600439 /nfs/dbraw/zinc/60/04/39/1043600439.db2.gz IFVUJDPFQKFIED-GFCCVEGCSA-N 1 2 321.804 4.303 20 0 DIADLO Cc1cc(NC(=O)N2CCC[C@@H](c3[nH]cc[nH+]3)C2)ccc1C1CC1 ZINC000558794305 1043602539 /nfs/dbraw/zinc/60/25/39/1043602539.db2.gz OANCSTPNRIDEPA-OAHLLOKOSA-N 1 2 324.428 4.007 20 0 DIADLO COc1ccnc([C@@H](C)[NH2+]C2(c3ccccc3Cl)CC2)c1 ZINC000926625654 1043608721 /nfs/dbraw/zinc/60/87/21/1043608721.db2.gz CRCJCBAEBHVGCV-GFCCVEGCSA-N 1 2 302.805 4.084 20 0 DIADLO C[C@@H]([NH2+]C1(c2ccccc2F)CCC1)c1cn2c(n1)CCCC2 ZINC000926632986 1043609693 /nfs/dbraw/zinc/60/96/93/1043609693.db2.gz JAZBQPWHPKDMAX-CQSZACIVSA-N 1 2 313.420 4.089 20 0 DIADLO CC(C)Cc1ncc(C[N@@H+]2CCc3ccc(F)cc3C2)s1 ZINC000353473598 1043609860 /nfs/dbraw/zinc/60/98/60/1043609860.db2.gz STDRYBYNLAISOV-UHFFFAOYSA-N 1 2 304.434 4.039 20 0 DIADLO CC(C)Cc1ncc(C[N@H+]2CCc3ccc(F)cc3C2)s1 ZINC000353473598 1043609865 /nfs/dbraw/zinc/60/98/65/1043609865.db2.gz STDRYBYNLAISOV-UHFFFAOYSA-N 1 2 304.434 4.039 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1c(Cl)cccc1OC ZINC000429687539 1043610745 /nfs/dbraw/zinc/61/07/45/1043610745.db2.gz TUTHMPBIMHMWLQ-MRXNPFEDSA-N 1 2 304.821 4.327 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1c(Cl)cccc1OC ZINC000429687539 1043610750 /nfs/dbraw/zinc/61/07/50/1043610750.db2.gz TUTHMPBIMHMWLQ-MRXNPFEDSA-N 1 2 304.821 4.327 20 0 DIADLO Cn1nccc1-c1ccccc1C[N@@H+]1Cc2cccc(Cl)c2C1 ZINC000353526517 1043613596 /nfs/dbraw/zinc/61/35/96/1043613596.db2.gz JJTJZYGQMPWGRG-UHFFFAOYSA-N 1 2 323.827 4.256 20 0 DIADLO Cn1nccc1-c1ccccc1C[N@H+]1Cc2cccc(Cl)c2C1 ZINC000353526517 1043613602 /nfs/dbraw/zinc/61/36/02/1043613602.db2.gz JJTJZYGQMPWGRG-UHFFFAOYSA-N 1 2 323.827 4.256 20 0 DIADLO CC(C)C[C@@H]1CCC[N@H+](Cc2nc(C(F)(F)F)cs2)C1 ZINC000443612695 1043620133 /nfs/dbraw/zinc/62/01/33/1043620133.db2.gz GMNMESRDWNSSNX-NSHDSACASA-N 1 2 306.397 4.420 20 0 DIADLO CC(C)C[C@@H]1CCC[N@@H+](Cc2nc(C(F)(F)F)cs2)C1 ZINC000443612695 1043620148 /nfs/dbraw/zinc/62/01/48/1043620148.db2.gz GMNMESRDWNSSNX-NSHDSACASA-N 1 2 306.397 4.420 20 0 DIADLO Cc1c([C@H](C)Nc2ccc([NH+](C)C)cc2)cnn1-c1ccccc1 ZINC000777602729 1043622299 /nfs/dbraw/zinc/62/22/99/1043622299.db2.gz VGJXKKBQXVZLGH-HNNXBMFYSA-N 1 2 320.440 4.420 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F)c1nccn1C ZINC000926728310 1043622353 /nfs/dbraw/zinc/62/23/53/1043622353.db2.gz SCBBMHOPUJTTKZ-IUCAKERBSA-N 1 2 316.207 4.278 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nccn1C)c1cc(Cl)cc(Cl)c1F ZINC000926728308 1043622379 /nfs/dbraw/zinc/62/23/79/1043622379.db2.gz SCBBMHOPUJTTKZ-BDAKNGLRSA-N 1 2 316.207 4.278 20 0 DIADLO Clc1cccc2c1CC[C@H]2[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000443620191 1043622512 /nfs/dbraw/zinc/62/25/12/1043622512.db2.gz JFXSKKYCIGMUOR-SJORKVTESA-N 1 2 319.857 4.462 20 0 DIADLO Clc1cccc2c1CC[C@H]2[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000443620191 1043622520 /nfs/dbraw/zinc/62/25/20/1043622520.db2.gz JFXSKKYCIGMUOR-SJORKVTESA-N 1 2 319.857 4.462 20 0 DIADLO Fc1ccc(Br)c(F)c1C[N@H+]1CCC[C@@H](F)CC1 ZINC001141769599 1043641809 /nfs/dbraw/zinc/64/18/09/1043641809.db2.gz RIPOGIYHYQOOFR-SECBINFHSA-N 1 2 322.168 4.051 20 0 DIADLO Fc1ccc(Br)c(F)c1C[N@@H+]1CCC[C@@H](F)CC1 ZINC001141769599 1043641814 /nfs/dbraw/zinc/64/18/14/1043641814.db2.gz RIPOGIYHYQOOFR-SECBINFHSA-N 1 2 322.168 4.051 20 0 DIADLO Cc1nc(C2([NH2+]C/C=C/c3ccccc3)CCCCCC2)no1 ZINC000558937096 1043641822 /nfs/dbraw/zinc/64/18/22/1043641822.db2.gz ZBNAHZLGJHZAOC-FMIVXFBMSA-N 1 2 311.429 4.231 20 0 DIADLO Clc1ccnc2c1CC[C@@H]2[NH2+]Cc1nsc2ccccc12 ZINC000926862940 1043643802 /nfs/dbraw/zinc/64/38/02/1043643802.db2.gz BTPBLBFYLMACKS-ZDUSSCGKSA-N 1 2 315.829 4.122 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@@H]1CCc2c1nccc2Cl ZINC000926859786 1043643911 /nfs/dbraw/zinc/64/39/11/1043643911.db2.gz CTKJNWTZCILVGU-ZACQAIPSSA-N 1 2 316.807 4.338 20 0 DIADLO C[C@H]([NH2+][C@H]1c2ccccc2CC[C@@H]1F)c1ccnn1C1CCC1 ZINC000926860999 1043644143 /nfs/dbraw/zinc/64/41/43/1043644143.db2.gz LQTKYMIIVXMEOF-IXDGSTSKSA-N 1 2 313.420 4.284 20 0 DIADLO C[C@H]([NH2+][C@H]1c2ccccc2CC[C@H]1F)c1ccnn1C1CCC1 ZINC000926860997 1043644502 /nfs/dbraw/zinc/64/45/02/1043644502.db2.gz LQTKYMIIVXMEOF-IRWQIABSSA-N 1 2 313.420 4.284 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cc(Cl)cc(Cl)c1F)c1cnccn1 ZINC000926903419 1043653087 /nfs/dbraw/zinc/65/30/87/1043653087.db2.gz VHCHXVBGRZBMIY-RKDXNWHRSA-N 1 2 314.191 4.334 20 0 DIADLO FCc1ccc(C[N@@H+]2CCc3[nH]c4ccc(F)cc4c3C2)cc1 ZINC000777612261 1043654120 /nfs/dbraw/zinc/65/41/20/1043654120.db2.gz BXNRBBXEZVFGJW-UHFFFAOYSA-N 1 2 312.363 4.335 20 0 DIADLO FCc1ccc(C[N@H+]2CCc3[nH]c4ccc(F)cc4c3C2)cc1 ZINC000777612261 1043654125 /nfs/dbraw/zinc/65/41/25/1043654125.db2.gz BXNRBBXEZVFGJW-UHFFFAOYSA-N 1 2 312.363 4.335 20 0 DIADLO C[C@H]([NH2+]c1ccc(N2CCC(C)CC2)cc1)C1CCOCC1 ZINC000777613225 1043664376 /nfs/dbraw/zinc/66/43/76/1043664376.db2.gz KLMJHDNOVPLUOU-INIZCTEOSA-N 1 2 302.462 4.150 20 0 DIADLO Cc1cc(N2CC[C@H](C)[C@H]2c2cccc(F)c2)nc(C2CC2)[nH+]1 ZINC000474152961 1043667462 /nfs/dbraw/zinc/66/74/62/1043667462.db2.gz JOAVPKVLSCDVSA-SGTLLEGYSA-N 1 2 311.404 4.389 20 0 DIADLO CSCc1ccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000353980226 1043669666 /nfs/dbraw/zinc/66/96/66/1043669666.db2.gz AKXQNDGLKKDQTI-GOSISDBHSA-N 1 2 323.465 4.152 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc(F)cn1 ZINC000354028225 1043674588 /nfs/dbraw/zinc/67/45/88/1043674588.db2.gz GMZOPWPEGPAFLB-GOSISDBHSA-N 1 2 316.424 4.019 20 0 DIADLO C[C@H]([NH2+][C@@H]1C[C@@H](c2ccccc2)Oc2ccccc21)c1ncc[nH]1 ZINC000927064169 1043678360 /nfs/dbraw/zinc/67/83/60/1043678360.db2.gz LKIQYGHIORKHSS-YJLNNSPDSA-N 1 2 319.408 4.325 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+](C)Cc3ccns3)s2)cc1 ZINC000895453491 1043684059 /nfs/dbraw/zinc/68/40/59/1043684059.db2.gz KIVGSJKKHMAEOH-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+](C)Cc3ccns3)s2)cc1 ZINC000895453491 1043684070 /nfs/dbraw/zinc/68/40/70/1043684070.db2.gz KIVGSJKKHMAEOH-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1ccc(Cl)cc1Cl ZINC000927113497 1043691030 /nfs/dbraw/zinc/69/10/30/1043691030.db2.gz ZMCNQCPARSQPGX-JTQLQIEISA-N 1 2 324.255 4.455 20 0 DIADLO Fc1cccc(-c2noc([C@H]3CCC[C@H](c4ccccc4)[NH2+]3)n2)c1 ZINC001211883598 1043696038 /nfs/dbraw/zinc/69/60/38/1043696038.db2.gz BAGUDYVVGRFMTC-IAGOWNOFSA-N 1 2 323.371 4.432 20 0 DIADLO COc1c(C)c[nH+]c(CSc2nc3cc(C)ccc3[nH]2)c1C ZINC000095910948 1043696265 /nfs/dbraw/zinc/69/62/65/1043696265.db2.gz AQHHXFDMPZJASC-UHFFFAOYSA-N 1 2 313.426 4.184 20 0 DIADLO COc1c(C)c[nH+]c(CSc2nc3ccc(C)cc3[nH]2)c1C ZINC000095910948 1043696273 /nfs/dbraw/zinc/69/62/73/1043696273.db2.gz AQHHXFDMPZJASC-UHFFFAOYSA-N 1 2 313.426 4.184 20 0 DIADLO CCc1onc(C)c1C[NH2+][C@H](C)c1nc2ccccc2s1 ZINC000927139392 1043697061 /nfs/dbraw/zinc/69/70/61/1043697061.db2.gz IIAZZGOAIABLEL-LLVKDONJSA-N 1 2 301.415 4.006 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3ccc(Cl)nn3)CC2)cc1 ZINC000876564943 1043697421 /nfs/dbraw/zinc/69/74/21/1043697421.db2.gz OROOAJNAMSRSOZ-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3ccc(Cl)nn3)CC2)cc1 ZINC000876564943 1043697432 /nfs/dbraw/zinc/69/74/32/1043697432.db2.gz OROOAJNAMSRSOZ-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO COCC[N@H+](Cc1nc(Cl)cs1)[C@@H](C)c1ccccc1 ZINC000876599968 1043700981 /nfs/dbraw/zinc/70/09/81/1043700981.db2.gz BQHLFCOXTHVPRR-LBPRGKRZSA-N 1 2 310.850 4.006 20 0 DIADLO COCC[N@@H+](Cc1nc(Cl)cs1)[C@@H](C)c1ccccc1 ZINC000876599968 1043700996 /nfs/dbraw/zinc/70/09/96/1043700996.db2.gz BQHLFCOXTHVPRR-LBPRGKRZSA-N 1 2 310.850 4.006 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)[C@@H]2C=CCCCCC2)n1 ZINC000559113662 1043700970 /nfs/dbraw/zinc/70/09/70/1043700970.db2.gz XBYZSPUUOHRQDS-ZIAGYGMSSA-N 1 2 309.479 4.204 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)[C@@H]2C=CCCCCC2)n1 ZINC000559113662 1043700982 /nfs/dbraw/zinc/70/09/82/1043700982.db2.gz XBYZSPUUOHRQDS-ZIAGYGMSSA-N 1 2 309.479 4.204 20 0 DIADLO Fc1ccc(-c2noc([C@@H]3CCC[C@H](c4ccccc4)[NH2+]3)n2)cc1 ZINC001211884384 1043703244 /nfs/dbraw/zinc/70/32/44/1043703244.db2.gz FWJOTUKPIAFSCP-SJORKVTESA-N 1 2 323.371 4.432 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccc(COC(C)C)cc2)c1C ZINC000876823353 1043714138 /nfs/dbraw/zinc/71/41/38/1043714138.db2.gz GIFXWUHZELURLF-UHFFFAOYSA-N 1 2 314.429 4.244 20 0 DIADLO Cc1ccncc1C[N@@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000474275204 1043716533 /nfs/dbraw/zinc/71/65/33/1043716533.db2.gz HIGDDOZLZOPFBQ-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccncc1C[N@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000474275204 1043716544 /nfs/dbraw/zinc/71/65/44/1043716544.db2.gz HIGDDOZLZOPFBQ-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)[C@H](C)c3ccncc3)co2)cc1 ZINC000354800442 1043722545 /nfs/dbraw/zinc/72/25/45/1043722545.db2.gz XXMSKXFSFQELSD-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)[C@H](C)c3ccncc3)co2)cc1 ZINC000354800442 1043722554 /nfs/dbraw/zinc/72/25/54/1043722554.db2.gz XXMSKXFSFQELSD-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc([NH+](C)C)c(C)c2)c(OC)c1 ZINC000777642947 1043725395 /nfs/dbraw/zinc/72/53/95/1043725395.db2.gz GPFHUFFNHPAEOO-CQSZACIVSA-N 1 2 314.429 4.251 20 0 DIADLO COc1ccc(OC)c([C@H](C)Nc2ccc([NH+](C)C)c(C)c2)c1 ZINC000777643920 1043725453 /nfs/dbraw/zinc/72/54/53/1043725453.db2.gz WYTYWTSJTDSMMZ-AWEZNQCLSA-N 1 2 314.429 4.251 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@H]3CCCOc4ccccc43)ccc21 ZINC000777653250 1043727110 /nfs/dbraw/zinc/72/71/10/1043727110.db2.gz JMGXGUHKMDUUBU-SFHVURJKSA-N 1 2 308.425 4.395 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@H]3CCCOc4ccccc43)ccc21 ZINC000777653250 1043727113 /nfs/dbraw/zinc/72/71/13/1043727113.db2.gz JMGXGUHKMDUUBU-SFHVURJKSA-N 1 2 308.425 4.395 20 0 DIADLO COc1ccc2c(c1)[C@H](Nc1ccc3c(c1)CCC[N@H+]3C)CC2 ZINC000777658151 1043730541 /nfs/dbraw/zinc/73/05/41/1043730541.db2.gz XHPMJLUGRKXMRJ-LJQANCHMSA-N 1 2 308.425 4.177 20 0 DIADLO COc1ccc2c(c1)[C@H](Nc1ccc3c(c1)CCC[N@@H+]3C)CC2 ZINC000777658151 1043730546 /nfs/dbraw/zinc/73/05/46/1043730546.db2.gz XHPMJLUGRKXMRJ-LJQANCHMSA-N 1 2 308.425 4.177 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1ccnc(Cl)c1F ZINC000895689522 1043732089 /nfs/dbraw/zinc/73/20/89/1043732089.db2.gz XCKOREFEKICEFT-UHFFFAOYSA-N 1 2 311.813 4.134 20 0 DIADLO CC(C)(C)c1ccc([C@@H]2CCC[N@@H+]2Cc2nnc(C3CC3)[nH]2)cc1 ZINC000355027994 1043740397 /nfs/dbraw/zinc/74/03/97/1043740397.db2.gz FQEXOYHHKJJTPF-KRWDZBQOSA-N 1 2 324.472 4.317 20 0 DIADLO CC(C)(C)c1ccc([C@@H]2CCC[N@H+]2Cc2nnc(C3CC3)[nH]2)cc1 ZINC000355027994 1043740409 /nfs/dbraw/zinc/74/04/09/1043740409.db2.gz FQEXOYHHKJJTPF-KRWDZBQOSA-N 1 2 324.472 4.317 20 0 DIADLO Cc1scc(C[NH2+]Cc2csc(C(F)(F)F)n2)c1C ZINC000895739069 1043740619 /nfs/dbraw/zinc/74/06/19/1043740619.db2.gz VYXBYOFXTJAAGY-UHFFFAOYSA-N 1 2 306.378 4.130 20 0 DIADLO Clc1nccc2oc(C[NH2+]Cc3nc(C4CC4)cs3)cc21 ZINC000877109945 1043745486 /nfs/dbraw/zinc/74/54/86/1043745486.db2.gz JGHWQXXTFLQRON-UHFFFAOYSA-N 1 2 319.817 4.105 20 0 DIADLO CCO[P@](C)(=O)CC[C@H](C)Nc1c[nH+]c2c(c1)CCCC2 ZINC000877194843 1043753665 /nfs/dbraw/zinc/75/36/65/1043753665.db2.gz CYJYBFWLEVZWNK-ZSEKCTLFSA-N 1 2 310.378 4.095 20 0 DIADLO CC(C)=CCC[C@@H](C)[NH2+]c1ccc(N2CCOC[C@@H]2C)cc1 ZINC000777691820 1043756737 /nfs/dbraw/zinc/75/67/37/1043756737.db2.gz GHEFNQFCPWNVJZ-SJORKVTESA-N 1 2 302.462 4.459 20 0 DIADLO Cc1nc(C)c(C[N@@H+]2CCc3c(F)cc(F)cc3[C@H]2C)s1 ZINC000355277585 1043758143 /nfs/dbraw/zinc/75/81/43/1043758143.db2.gz WHTQIWRUEDUXMF-SNVBAGLBSA-N 1 2 308.397 4.157 20 0 DIADLO Cc1nc(C)c(C[N@H+]2CCc3c(F)cc(F)cc3[C@H]2C)s1 ZINC000355277585 1043758154 /nfs/dbraw/zinc/75/81/54/1043758154.db2.gz WHTQIWRUEDUXMF-SNVBAGLBSA-N 1 2 308.397 4.157 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1sccc1C1CC1 ZINC000355319568 1043760573 /nfs/dbraw/zinc/76/05/73/1043760573.db2.gz MOVQMKJSGLMYAT-UHFFFAOYSA-N 1 2 309.394 4.268 20 0 DIADLO CCc1onc(C)c1C[NH2+]Cc1cc(Cl)cc(Cl)c1F ZINC000895841786 1043762819 /nfs/dbraw/zinc/76/28/19/1043762819.db2.gz SYTREYLMCYKGJN-UHFFFAOYSA-N 1 2 317.191 4.281 20 0 DIADLO CCc1noc(C)c1[C@@H](C)Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000777704897 1043769588 /nfs/dbraw/zinc/76/95/88/1043769588.db2.gz MQLTVSHTKYNUQA-CYBMUJFWSA-N 1 2 314.433 4.104 20 0 DIADLO C[N@H+](Cc1cc(-c2ccco2)on1)Cc1cccc(Cl)c1 ZINC000053094684 1043769838 /nfs/dbraw/zinc/76/98/38/1043769838.db2.gz BEAOCIUHSSFQAG-UHFFFAOYSA-N 1 2 302.761 4.220 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccco2)on1)Cc1cccc(Cl)c1 ZINC000053094684 1043769847 /nfs/dbraw/zinc/76/98/47/1043769847.db2.gz BEAOCIUHSSFQAG-UHFFFAOYSA-N 1 2 302.761 4.220 20 0 DIADLO C[N@H+](Cc1c(Cl)n[nH]c1C1CC1)Cc1ccc2cc[nH]c2c1 ZINC000895868478 1043771160 /nfs/dbraw/zinc/77/11/60/1043771160.db2.gz DRFPSTBJYXQDMW-UHFFFAOYSA-N 1 2 314.820 4.054 20 0 DIADLO C[N@@H+](Cc1c(Cl)n[nH]c1C1CC1)Cc1ccc2cc[nH]c2c1 ZINC000895868478 1043771185 /nfs/dbraw/zinc/77/11/85/1043771185.db2.gz DRFPSTBJYXQDMW-UHFFFAOYSA-N 1 2 314.820 4.054 20 0 DIADLO CC(C)c1ccc(-c2ncc(C[N@@H+]3CCO[C@@H](C)C3)s2)cc1 ZINC000096999564 1043775157 /nfs/dbraw/zinc/77/51/57/1043775157.db2.gz XPSGJZJMVVQZPX-AWEZNQCLSA-N 1 2 316.470 4.154 20 0 DIADLO CC(C)c1ccc(-c2ncc(C[N@H+]3CCO[C@@H](C)C3)s2)cc1 ZINC000096999564 1043775165 /nfs/dbraw/zinc/77/51/65/1043775165.db2.gz XPSGJZJMVVQZPX-AWEZNQCLSA-N 1 2 316.470 4.154 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)C)ns2)cc1 ZINC000930192565 1043777422 /nfs/dbraw/zinc/77/74/22/1043777422.db2.gz AHPYJAPVQPQVJK-CYBMUJFWSA-N 1 2 319.474 4.300 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)c(C)nn1 ZINC000929138995 1043793675 /nfs/dbraw/zinc/79/36/75/1043793675.db2.gz MPEYRXFJIGFFCN-UHFFFAOYSA-N 1 2 310.228 4.032 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)c(C)nn1 ZINC000929138995 1043793679 /nfs/dbraw/zinc/79/36/79/1043793679.db2.gz MPEYRXFJIGFFCN-UHFFFAOYSA-N 1 2 310.228 4.032 20 0 DIADLO Cc1cc(C)c(NC(=O)CCc2cccc(Cl)c2)c(C)[nH+]1 ZINC000097213982 1043797600 /nfs/dbraw/zinc/79/76/00/1043797600.db2.gz BTXYFNNGWGXSTR-UHFFFAOYSA-N 1 2 302.805 4.232 20 0 DIADLO C[C@@H](c1ccc(F)nc1)[N@H+](C)Cc1nc2ccccc2s1 ZINC000929231051 1043801913 /nfs/dbraw/zinc/80/19/13/1043801913.db2.gz CWBBHBIVXRMCQK-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO C[C@@H](c1ccc(F)nc1)[N@@H+](C)Cc1nc2ccccc2s1 ZINC000929231051 1043801923 /nfs/dbraw/zinc/80/19/23/1043801923.db2.gz CWBBHBIVXRMCQK-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO FC(F)(F)c1cscc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000356048237 1043804864 /nfs/dbraw/zinc/80/48/64/1043804864.db2.gz BMNZKXQVWSQJLG-CYBMUJFWSA-N 1 2 300.349 4.432 20 0 DIADLO FC(F)(F)c1cscc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000356048237 1043804884 /nfs/dbraw/zinc/80/48/84/1043804884.db2.gz BMNZKXQVWSQJLG-CYBMUJFWSA-N 1 2 300.349 4.432 20 0 DIADLO Cc1nnsc1[C@H](C)[N@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC000929286932 1043807307 /nfs/dbraw/zinc/80/73/07/1043807307.db2.gz KMJZUKWPZTYSPT-JTQLQIEISA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nnsc1[C@H](C)[N@@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC000929286932 1043807327 /nfs/dbraw/zinc/80/73/27/1043807327.db2.gz KMJZUKWPZTYSPT-JTQLQIEISA-N 1 2 315.364 4.058 20 0 DIADLO CC(C)(C)c1ccc([C@H]2CCC[N@@H+]2Cc2nncs2)cc1 ZINC000929288552 1043808897 /nfs/dbraw/zinc/80/88/97/1043808897.db2.gz UMPSELWXBQCZCF-OAHLLOKOSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1ccc([C@H]2CCC[N@H+]2Cc2nncs2)cc1 ZINC000929288552 1043808914 /nfs/dbraw/zinc/80/89/14/1043808914.db2.gz UMPSELWXBQCZCF-OAHLLOKOSA-N 1 2 301.459 4.173 20 0 DIADLO CCc1ncc(C[N@H+](Cc2ccco2)Cc2ccc(C)s2)o1 ZINC000929352035 1043810093 /nfs/dbraw/zinc/81/00/93/1043810093.db2.gz JHJXPNKCHOIJIL-UHFFFAOYSA-N 1 2 316.426 4.402 20 0 DIADLO CCc1ncc(C[N@@H+](Cc2ccco2)Cc2ccc(C)s2)o1 ZINC000929352035 1043810112 /nfs/dbraw/zinc/81/01/12/1043810112.db2.gz JHJXPNKCHOIJIL-UHFFFAOYSA-N 1 2 316.426 4.402 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)SCc2ccccc2)c(C)[nH+]1 ZINC000097403305 1043810662 /nfs/dbraw/zinc/81/06/62/1043810662.db2.gz MKSGXQAVMCXKKP-OAHLLOKOSA-N 1 2 314.454 4.267 20 0 DIADLO CCCC[N@H+](Cc1noc2c1COCC2)[C@@H](C)c1ccc(C)o1 ZINC000929402486 1043817179 /nfs/dbraw/zinc/81/71/79/1043817179.db2.gz JERRTDVRZPMTST-AWEZNQCLSA-N 1 2 318.417 4.012 20 0 DIADLO CCCC[N@@H+](Cc1noc2c1COCC2)[C@@H](C)c1ccc(C)o1 ZINC000929402486 1043817196 /nfs/dbraw/zinc/81/71/96/1043817196.db2.gz JERRTDVRZPMTST-AWEZNQCLSA-N 1 2 318.417 4.012 20 0 DIADLO FC(F)(F)c1coc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000877900544 1043818625 /nfs/dbraw/zinc/81/86/25/1043818625.db2.gz BJPXQWLDGOOIFC-MRVPVSSYSA-N 1 2 301.230 4.073 20 0 DIADLO FC(F)(F)c1coc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000877900544 1043818641 /nfs/dbraw/zinc/81/86/41/1043818641.db2.gz BJPXQWLDGOOIFC-MRVPVSSYSA-N 1 2 301.230 4.073 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)[C@@H](C)[N@H+](C)Cc1ccsc1 ZINC000877921135 1043824313 /nfs/dbraw/zinc/82/43/13/1043824313.db2.gz DYQXHJMPPNLAKC-GFCCVEGCSA-N 1 2 322.861 4.169 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccsc1 ZINC000877921135 1043824324 /nfs/dbraw/zinc/82/43/24/1043824324.db2.gz DYQXHJMPPNLAKC-GFCCVEGCSA-N 1 2 322.861 4.169 20 0 DIADLO C[C@@H](C1CC1)[N@@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000777792376 1043825670 /nfs/dbraw/zinc/82/56/70/1043825670.db2.gz XRWLTMQUECJFFC-JTQLQIEISA-N 1 2 319.246 4.087 20 0 DIADLO C[C@@H](C1CC1)[N@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000777792376 1043825688 /nfs/dbraw/zinc/82/56/88/1043825688.db2.gz XRWLTMQUECJFFC-JTQLQIEISA-N 1 2 319.246 4.087 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2c(C)cccc2Cl)o1 ZINC000877933974 1043828219 /nfs/dbraw/zinc/82/82/19/1043828219.db2.gz XRABIKQRSUOXAF-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2c(C)cccc2Cl)o1 ZINC000877933974 1043828221 /nfs/dbraw/zinc/82/82/21/1043828221.db2.gz XRABIKQRSUOXAF-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO COCCSc1ccc([C@H](C)[NH2+][C@@H](C)c2ncc(C)o2)cc1 ZINC000356273038 1043828386 /nfs/dbraw/zinc/82/83/86/1043828386.db2.gz QSHATBCDMGWLGT-KBPBESRZSA-N 1 2 320.458 4.133 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@@H](C)C(=O)Nc1c(C)cccc1Cl ZINC000877991980 1043835319 /nfs/dbraw/zinc/83/53/19/1043835319.db2.gz PZLJUXHMBWVVTA-LBPRGKRZSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1occc1C[N@H+](C)[C@@H](C)C(=O)Nc1c(C)cccc1Cl ZINC000877991980 1043835338 /nfs/dbraw/zinc/83/53/38/1043835338.db2.gz PZLJUXHMBWVVTA-LBPRGKRZSA-N 1 2 320.820 4.009 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+](C)Cc1sccc1C ZINC000383987262 1043834978 /nfs/dbraw/zinc/83/49/78/1043834978.db2.gz UCPOLMPEUJGLHB-UHFFFAOYSA-N 1 2 317.454 4.290 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+](C)Cc1sccc1C ZINC000383987262 1043834998 /nfs/dbraw/zinc/83/49/98/1043834998.db2.gz UCPOLMPEUJGLHB-UHFFFAOYSA-N 1 2 317.454 4.290 20 0 DIADLO COCC[N@H+](Cc1scnc1Cl)[C@@H](C)c1ccccc1 ZINC000878010726 1043838921 /nfs/dbraw/zinc/83/89/21/1043838921.db2.gz KYAFEJOSIWZGHA-LBPRGKRZSA-N 1 2 310.850 4.006 20 0 DIADLO COCC[N@@H+](Cc1scnc1Cl)[C@@H](C)c1ccccc1 ZINC000878010726 1043838937 /nfs/dbraw/zinc/83/89/37/1043838937.db2.gz KYAFEJOSIWZGHA-LBPRGKRZSA-N 1 2 310.850 4.006 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@H]2c2ccccn2)sc1C(C)(C)C ZINC000929813108 1043841261 /nfs/dbraw/zinc/84/12/61/1043841261.db2.gz XOTSCEURRZLVLS-HNNXBMFYSA-N 1 2 315.486 4.481 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@H]2c2ccccn2)sc1C(C)(C)C ZINC000929813108 1043841269 /nfs/dbraw/zinc/84/12/69/1043841269.db2.gz XOTSCEURRZLVLS-HNNXBMFYSA-N 1 2 315.486 4.481 20 0 DIADLO C[C@@H]1CCCC[C@H]1c1noc(-c2cccc(-n3cc[nH+]c3)c2)n1 ZINC000356586487 1043850878 /nfs/dbraw/zinc/85/08/78/1043850878.db2.gz XZNGLRBHHISHBT-CZUORRHYSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@@H]1CCCC[C@@H]1c1noc(-c2cccc(-n3cc[nH+]c3)c2)n1 ZINC000356586482 1043851521 /nfs/dbraw/zinc/85/15/21/1043851521.db2.gz XZNGLRBHHISHBT-CJNGLKHVSA-N 1 2 308.385 4.216 20 0 DIADLO FC(F)(F)c1coc(C[NH+]2CCC(C(F)(F)F)CC2)c1 ZINC000878149372 1043851897 /nfs/dbraw/zinc/85/18/97/1043851897.db2.gz WUUJERANBQMVMR-UHFFFAOYSA-N 1 2 301.230 4.073 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1scnc1Cl)CCC2 ZINC000878244575 1043863085 /nfs/dbraw/zinc/86/30/85/1043863085.db2.gz RIPVAVVPERVSFM-SNVBAGLBSA-N 1 2 313.879 4.071 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1scnc1Cl)CCC2 ZINC000878244575 1043863102 /nfs/dbraw/zinc/86/31/02/1043863102.db2.gz RIPVAVVPERVSFM-SNVBAGLBSA-N 1 2 313.879 4.071 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1coc(C(C)(C)C)n1)C(C)C ZINC000929982371 1043863574 /nfs/dbraw/zinc/86/35/74/1043863574.db2.gz SULVEYROUGOTEJ-HNNXBMFYSA-N 1 2 301.434 4.162 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2cc(C(F)(F)F)co2)sc1C ZINC000878261427 1043863817 /nfs/dbraw/zinc/86/38/17/1043863817.db2.gz JZTMSEXFYMMJTB-UHFFFAOYSA-N 1 2 318.364 4.397 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2c(o1)CCCC2)c1cccc(Cl)c1 ZINC000878349584 1043874047 /nfs/dbraw/zinc/87/40/47/1043874047.db2.gz DEVHVPJCIDVEDH-AWEZNQCLSA-N 1 2 304.821 4.448 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccc2c(c1)CCCC2 ZINC000878346977 1043874232 /nfs/dbraw/zinc/87/42/32/1043874232.db2.gz WSWACZAOCRPDDM-CQSZACIVSA-N 1 2 310.441 4.283 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2nc3c(o2)CCCC3)cc1 ZINC000878351394 1043876318 /nfs/dbraw/zinc/87/63/18/1043876318.db2.gz WCPKWHFYQMZWFA-AWEZNQCLSA-N 1 2 314.429 4.191 20 0 DIADLO CC(C)n1cc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)nn1 ZINC000289818108 1043880991 /nfs/dbraw/zinc/88/09/91/1043880991.db2.gz SLOGPUGCVUYMCJ-MRXNPFEDSA-N 1 2 322.403 4.014 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl ZINC000289810277 1043882604 /nfs/dbraw/zinc/88/26/04/1043882604.db2.gz IUFMUYMTTANHOA-MRVPVSSYSA-N 1 2 302.180 4.015 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl ZINC000289810277 1043882616 /nfs/dbraw/zinc/88/26/16/1043882616.db2.gz IUFMUYMTTANHOA-MRVPVSSYSA-N 1 2 302.180 4.015 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2c(Cl)cncc2Cl)cn1 ZINC000878417414 1043889892 /nfs/dbraw/zinc/88/98/92/1043889892.db2.gz AEVYKSULTAVVEY-SNVBAGLBSA-N 1 2 313.232 4.017 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(Cl)ccc(Br)c2F)C1 ZINC001141887606 1043891818 /nfs/dbraw/zinc/89/18/18/1043891818.db2.gz MRHZRUCCFXGZQE-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(Cl)ccc(Br)c2F)C1 ZINC001141887606 1043891834 /nfs/dbraw/zinc/89/18/34/1043891834.db2.gz MRHZRUCCFXGZQE-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO CCc1ncc(C[NH2+][C@H](CC(F)(F)F)c2ccc(F)cc2)o1 ZINC000930207465 1043892271 /nfs/dbraw/zinc/89/22/71/1043892271.db2.gz NZJVMIAEZIOYPI-CYBMUJFWSA-N 1 2 316.298 4.159 20 0 DIADLO FC1(F)CCC[C@@H]1CC[N@@H+]1CCSC[C@@H]1c1nccs1 ZINC000878447301 1043893086 /nfs/dbraw/zinc/89/30/86/1043893086.db2.gz LISFUQCISVFMRM-VXGBXAGGSA-N 1 2 318.458 4.059 20 0 DIADLO FC1(F)CCC[C@@H]1CC[N@H+]1CCSC[C@@H]1c1nccs1 ZINC000878447301 1043893100 /nfs/dbraw/zinc/89/31/00/1043893100.db2.gz LISFUQCISVFMRM-VXGBXAGGSA-N 1 2 318.458 4.059 20 0 DIADLO Cc1nc(-c2ccc([C@@H](C)[NH2+][C@H](C)c3ncccn3)cc2)cs1 ZINC000930205576 1043893404 /nfs/dbraw/zinc/89/34/04/1043893404.db2.gz TYDXHLCICBDQBB-CHWSQXEVSA-N 1 2 324.453 4.320 20 0 DIADLO Cc1ccc(C(C)(C)[NH2+]Cc2c(Cl)cncc2Cl)cn1 ZINC000878431361 1043893590 /nfs/dbraw/zinc/89/35/90/1043893590.db2.gz KVGZNYKVQGAWPO-UHFFFAOYSA-N 1 2 310.228 4.117 20 0 DIADLO CCC[C@H]([NH2+]Cc1nncs1)c1ccc(Cl)c(Cl)c1 ZINC000930213082 1043894791 /nfs/dbraw/zinc/89/47/91/1043894791.db2.gz LYQPWMLPPFOJSN-LBPRGKRZSA-N 1 2 316.257 4.476 20 0 DIADLO Cc1cnc([C@H](C)[N@H+](C)Cc2ccc(OC(F)(F)F)cc2)o1 ZINC000356970410 1043901564 /nfs/dbraw/zinc/90/15/64/1043901564.db2.gz DIBLWSVLXKEAPI-NSHDSACASA-N 1 2 314.307 4.075 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+](C)Cc2ccc(OC(F)(F)F)cc2)o1 ZINC000356970410 1043901578 /nfs/dbraw/zinc/90/15/78/1043901578.db2.gz DIBLWSVLXKEAPI-NSHDSACASA-N 1 2 314.307 4.075 20 0 DIADLO C[C@@H](NC(=O)[C@H]1CC12CCCCC2)c1cccc(-n2cc[nH+]c2)c1 ZINC000357011161 1043905968 /nfs/dbraw/zinc/90/59/68/1043905968.db2.gz JFDSTSDAUPDBOQ-CRAIPNDOSA-N 1 2 323.440 4.020 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1nc2c(o1)CCCC2 ZINC000878620698 1043908549 /nfs/dbraw/zinc/90/85/49/1043908549.db2.gz UOTIMAQHXCUBMM-INIZCTEOSA-N 1 2 314.429 4.145 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1nc2c(o1)CCCC2 ZINC000878620698 1043908554 /nfs/dbraw/zinc/90/85/54/1043908554.db2.gz UOTIMAQHXCUBMM-INIZCTEOSA-N 1 2 314.429 4.145 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)Cc3ccc(C)cc3Cl)cc2[nH+]1 ZINC000474768188 1043915226 /nfs/dbraw/zinc/91/52/26/1043915226.db2.gz KYITUIHZVIAWSV-UHFFFAOYSA-N 1 2 313.788 4.014 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1nc(-c2ccoc2)no1 ZINC000357251618 1043932749 /nfs/dbraw/zinc/93/27/49/1043932749.db2.gz CRYISSMKYKLCNE-LBPRGKRZSA-N 1 2 323.352 4.269 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nc(-c2ccoc2)no1 ZINC000357251618 1043932757 /nfs/dbraw/zinc/93/27/57/1043932757.db2.gz CRYISSMKYKLCNE-LBPRGKRZSA-N 1 2 323.352 4.269 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC001137139601 1043933551 /nfs/dbraw/zinc/93/35/51/1043933551.db2.gz KNJZAQBCJQVFAS-OAHLLOKOSA-N 1 2 302.443 4.267 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCC[C@@H]1c1nccs1 ZINC001137139601 1043933559 /nfs/dbraw/zinc/93/35/59/1043933559.db2.gz KNJZAQBCJQVFAS-OAHLLOKOSA-N 1 2 302.443 4.267 20 0 DIADLO FC(F)(F)C1(CNc2[nH+]cccc2OCc2ccccc2)CC1 ZINC000561382528 1043940501 /nfs/dbraw/zinc/94/05/01/1043940501.db2.gz ZJIKEYAIGGPRMG-UHFFFAOYSA-N 1 2 322.330 4.415 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc2c(o1)CCCC2)c1ccc(F)cc1 ZINC000879129404 1043946970 /nfs/dbraw/zinc/94/69/70/1043946970.db2.gz XILWABJICRYWAW-GOSISDBHSA-N 1 2 302.393 4.108 20 0 DIADLO Cc1cnc(C[N@@H+]2CCC[C@H](Oc3ccccc3Cl)C2)s1 ZINC000357393734 1043947852 /nfs/dbraw/zinc/94/78/52/1043947852.db2.gz VGLFEFKHWFRGNL-ZDUSSCGKSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1cnc(C[N@H+]2CCC[C@H](Oc3ccccc3Cl)C2)s1 ZINC000357393734 1043947858 /nfs/dbraw/zinc/94/78/58/1043947858.db2.gz VGLFEFKHWFRGNL-ZDUSSCGKSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1cccc(C[NH2+]C(C)(C)c2nc3cc(Cl)ccc3o2)n1 ZINC000879157937 1043948460 /nfs/dbraw/zinc/94/84/60/1043948460.db2.gz BKDXNYSSCDTIPQ-UHFFFAOYSA-N 1 2 315.804 4.210 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1cc(C)on1 ZINC000290578350 1043964775 /nfs/dbraw/zinc/96/47/75/1043964775.db2.gz FSKIGPWMBAQYML-UKRRQHHQSA-N 1 2 302.418 4.320 20 0 DIADLO Cc1ccc(-n2cc[nH+]c2)c(C(=O)Nc2cccc(Cl)c2)c1 ZINC000357600481 1043967485 /nfs/dbraw/zinc/96/74/85/1043967485.db2.gz QYSXMDAQVCCWHN-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+](Cc3cccnc3)C(C)C)o2)cc1 ZINC000357611198 1043968919 /nfs/dbraw/zinc/96/89/19/1043968919.db2.gz DBZNEUIMXKESSP-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+](Cc3cccnc3)C(C)C)o2)cc1 ZINC000357611198 1043968925 /nfs/dbraw/zinc/96/89/25/1043968925.db2.gz DBZNEUIMXKESSP-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO Fc1cc2c(cc1F)C[NH+](C[C@@H]1[C@@H](c3ccccc3)C1(F)F)C2 ZINC000930888191 1043973146 /nfs/dbraw/zinc/97/31/46/1043973146.db2.gz VTEWJMKFOIVSCF-RHSMWYFYSA-N 1 2 321.317 4.329 20 0 DIADLO C[C@H](SCc1cc[nH+]c(N(C)C)c1)c1nc2ccccc2o1 ZINC000127846832 1043974279 /nfs/dbraw/zinc/97/42/79/1043974279.db2.gz XZKQTTOCUSSSAR-LBPRGKRZSA-N 1 2 313.426 4.283 20 0 DIADLO CC(F)(F)CCC[N@H+]1CCC[C@H]1c1nccc(C(F)(F)F)n1 ZINC000930970600 1043978027 /nfs/dbraw/zinc/97/80/27/1043978027.db2.gz DNLHWZOHSWDCNG-JTQLQIEISA-N 1 2 323.309 4.068 20 0 DIADLO CC(F)(F)CCC[N@@H+]1CCC[C@H]1c1nccc(C(F)(F)F)n1 ZINC000930970600 1043978015 /nfs/dbraw/zinc/97/80/15/1043978015.db2.gz DNLHWZOHSWDCNG-JTQLQIEISA-N 1 2 323.309 4.068 20 0 DIADLO COc1c(C)c[nH+]c(CNc2ccc(-c3ocnc3C)cc2)c1C ZINC000896702414 1043983140 /nfs/dbraw/zinc/98/31/40/1043983140.db2.gz MFQZPPCNDHNBHS-UHFFFAOYSA-N 1 2 323.396 4.283 20 0 DIADLO C/C=C/c1ccc(NC(=O)c2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC000561647170 1043983160 /nfs/dbraw/zinc/98/31/60/1043983160.db2.gz JBIHKSSMQLVSQU-NSCUHMNNSA-N 1 2 317.392 4.217 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1csc(-c2ccoc2)n1 ZINC000357776503 1043986454 /nfs/dbraw/zinc/98/64/54/1043986454.db2.gz WFMHQPAQDVXCME-CYBMUJFWSA-N 1 2 310.422 4.350 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1csc(-c2ccoc2)n1 ZINC000357776503 1043986462 /nfs/dbraw/zinc/98/64/62/1043986462.db2.gz WFMHQPAQDVXCME-CYBMUJFWSA-N 1 2 310.422 4.350 20 0 DIADLO C[C@@H](Cc1ccccc1)[N@H+](Cc1nncs1)Cc1ccccc1 ZINC000931066000 1043988722 /nfs/dbraw/zinc/98/87/22/1043988722.db2.gz GUMSQMRRAXRPIS-INIZCTEOSA-N 1 2 323.465 4.172 20 0 DIADLO C[C@@H](Cc1ccccc1)[N@@H+](Cc1nncs1)Cc1ccccc1 ZINC000931066000 1043988732 /nfs/dbraw/zinc/98/87/32/1043988732.db2.gz GUMSQMRRAXRPIS-INIZCTEOSA-N 1 2 323.465 4.172 20 0 DIADLO CC(C)c1cc([C@@H]2CCC[N@H+](Cc3cnc(Cl)s3)C2)n[nH]1 ZINC000879919723 1044002076 /nfs/dbraw/zinc/00/20/76/1044002076.db2.gz SSCGQHKRYXZLHT-LLVKDONJSA-N 1 2 324.881 4.023 20 0 DIADLO CC(C)c1cc([C@@H]2CCC[N@@H+](Cc3cnc(Cl)s3)C2)n[nH]1 ZINC000879919723 1044002088 /nfs/dbraw/zinc/00/20/88/1044002088.db2.gz SSCGQHKRYXZLHT-LLVKDONJSA-N 1 2 324.881 4.023 20 0 DIADLO Cc1cccc2c(C[N@@H+]3CCc4c(Cl)cccc4C3)[nH]nc21 ZINC001137149126 1044005540 /nfs/dbraw/zinc/00/55/40/1044005540.db2.gz GPRZOYXAVHAGNG-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1cccc2c(C[N@H+]3CCc4c(Cl)cccc4C3)[nH]nc21 ZINC001137149126 1044005555 /nfs/dbraw/zinc/00/55/55/1044005555.db2.gz GPRZOYXAVHAGNG-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[S@@](=O)Cc1ccc(C)[nH+]c1C ZINC000358116189 1044022363 /nfs/dbraw/zinc/02/23/63/1044022363.db2.gz GJROKLUOBQQIDK-VGSWGCGISA-N 1 2 323.408 4.377 20 0 DIADLO CC1(C)C[N@H+](CC(=O)c2c[nH]c3ccccc23)[C@@H]1c1cccs1 ZINC000561956257 1044034986 /nfs/dbraw/zinc/03/49/86/1044034986.db2.gz GANCQYTVIRTPKN-GOSISDBHSA-N 1 2 324.449 4.495 20 0 DIADLO CC1(C)C[N@@H+](CC(=O)c2c[nH]c3ccccc23)[C@@H]1c1cccs1 ZINC000561956257 1044035000 /nfs/dbraw/zinc/03/50/00/1044035000.db2.gz GANCQYTVIRTPKN-GOSISDBHSA-N 1 2 324.449 4.495 20 0 DIADLO COC(=O)c1ccccc1C[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000561961804 1044037168 /nfs/dbraw/zinc/03/71/68/1044037168.db2.gz OAWFHBIXFAKRPX-INIZCTEOSA-N 1 2 315.438 4.118 20 0 DIADLO COC(=O)c1ccccc1C[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000561961804 1044037182 /nfs/dbraw/zinc/03/71/82/1044037182.db2.gz OAWFHBIXFAKRPX-INIZCTEOSA-N 1 2 315.438 4.118 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)[nH]1 ZINC000358237291 1044038166 /nfs/dbraw/zinc/03/81/66/1044038166.db2.gz LAPLIDXGCDDTSH-QWHCGFSZSA-N 1 2 310.401 4.039 20 0 DIADLO Cc1cc(N2CCC[C@@H](Cc3ccccc3)C2)nc(C2CC2)[nH+]1 ZINC000522568872 1044045815 /nfs/dbraw/zinc/04/58/15/1044045815.db2.gz MRQUEOXRQQWCLH-KRWDZBQOSA-N 1 2 307.441 4.122 20 0 DIADLO COc1ccc(C(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)cc1C1CC1 ZINC000443914947 1044055067 /nfs/dbraw/zinc/05/50/67/1044055067.db2.gz UMJNDRILNSIMID-UHFFFAOYSA-N 1 2 321.380 4.010 20 0 DIADLO Cc1nnc(C[N@H+]2CC=C(c3cccc4ccccc43)CC2)s1 ZINC000358502552 1044076066 /nfs/dbraw/zinc/07/60/66/1044076066.db2.gz VVHIPDJMUFKYSK-UHFFFAOYSA-N 1 2 321.449 4.289 20 0 DIADLO Cc1nnc(C[N@@H+]2CC=C(c3cccc4ccccc43)CC2)s1 ZINC000358502552 1044076081 /nfs/dbraw/zinc/07/60/81/1044076081.db2.gz VVHIPDJMUFKYSK-UHFFFAOYSA-N 1 2 321.449 4.289 20 0 DIADLO Cc1nnc(C[N@H+](C2CC2)C2CC(c3ccccc3C)C2)s1 ZINC000358496808 1044076367 /nfs/dbraw/zinc/07/63/67/1044076367.db2.gz JFTVCRLIFFDSSS-UHFFFAOYSA-N 1 2 313.470 4.066 20 0 DIADLO Cc1nnc(C[N@@H+](C2CC2)C2CC(c3ccccc3C)C2)s1 ZINC000358496808 1044076382 /nfs/dbraw/zinc/07/63/82/1044076382.db2.gz JFTVCRLIFFDSSS-UHFFFAOYSA-N 1 2 313.470 4.066 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+]Cc1cnc(C(F)(F)F)s1 ZINC000443971343 1044076799 /nfs/dbraw/zinc/07/67/99/1044076799.db2.gz VIBSZNGDEHTWCH-UHFFFAOYSA-N 1 2 324.730 4.244 20 0 DIADLO Cc1cc(NC(=O)N2C[C@@H](C)CC[C@H]2c2ccccc2)c(C)c[nH+]1 ZINC000562250204 1044092842 /nfs/dbraw/zinc/09/28/42/1044092842.db2.gz OGMGBPVALHBFAU-LIRRHRJNSA-N 1 2 323.440 4.125 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@@H+]1CCC(F)(F)[C@H](CO)C1 ZINC000291700346 1044096626 /nfs/dbraw/zinc/09/66/26/1044096626.db2.gz IAJZJRLLBAXQQB-UWVGGRQHSA-N 1 2 324.198 4.004 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@H+]1CCC(F)(F)[C@H](CO)C1 ZINC000291700346 1044096640 /nfs/dbraw/zinc/09/66/40/1044096640.db2.gz IAJZJRLLBAXQQB-UWVGGRQHSA-N 1 2 324.198 4.004 20 0 DIADLO CC(C)(C)SCCCC(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000128803261 1044103593 /nfs/dbraw/zinc/10/35/93/1044103593.db2.gz HUPUEAMLUPHVFL-UHFFFAOYSA-N 1 2 317.458 4.123 20 0 DIADLO Cc1ccccc1C1(C[NH2+][C@H](c2ncn[nH]2)C2CCCCC2)CC1 ZINC000562365555 1044105083 /nfs/dbraw/zinc/10/50/83/1044105083.db2.gz YVDNRJHKVURQGM-SFHVURJKSA-N 1 2 324.472 4.056 20 0 DIADLO c1ccc2c(c1)OC1(CCC1)C[C@H]2[NH2+]Cc1noc2c1CCCC2 ZINC000932215521 1044110529 /nfs/dbraw/zinc/11/05/29/1044110529.db2.gz JCIUSASVWGNPGR-MRXNPFEDSA-N 1 2 324.424 4.090 20 0 DIADLO Cc1ccsc1[C@@H](CO)[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000346517207 1044111190 /nfs/dbraw/zinc/11/11/90/1044111190.db2.gz DDNPGKACOXLJSW-VXGBXAGGSA-N 1 2 310.488 4.021 20 0 DIADLO Brc1cnc(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)s1 ZINC000713672978 1044115215 /nfs/dbraw/zinc/11/52/15/1044115215.db2.gz LYAYASSVSVDIFD-MNOVXSKESA-N 1 2 315.280 4.060 20 0 DIADLO Brc1cnc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)s1 ZINC000713672978 1044115219 /nfs/dbraw/zinc/11/52/19/1044115219.db2.gz LYAYASSVSVDIFD-MNOVXSKESA-N 1 2 315.280 4.060 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC000932375277 1044122157 /nfs/dbraw/zinc/12/21/57/1044122157.db2.gz NAZVAAWHKXCMNU-IBGZPJMESA-N 1 2 319.408 4.286 20 0 DIADLO Cc1cnccc1C[N@H+](Cc1nc2ccccc2s1)C1CC1 ZINC000932393367 1044125727 /nfs/dbraw/zinc/12/57/27/1044125727.db2.gz ACHBWSSSTRYHOY-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO Cc1cnccc1C[N@@H+](Cc1nc2ccccc2s1)C1CC1 ZINC000932393367 1044125732 /nfs/dbraw/zinc/12/57/32/1044125732.db2.gz ACHBWSSSTRYHOY-UHFFFAOYSA-N 1 2 309.438 4.164 20 0 DIADLO Fc1ccc(C[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)cc1Cl ZINC000292065845 1044133131 /nfs/dbraw/zinc/13/31/31/1044133131.db2.gz HBKWLNDBCPOECQ-HNNXBMFYSA-N 1 2 322.815 4.008 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2C)n1 ZINC000932557131 1044142225 /nfs/dbraw/zinc/14/22/25/1044142225.db2.gz XPHLQYIPWABFCE-OLZOCXBDSA-N 1 2 305.397 4.272 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@H](C)c3cc4ccccc4o3)cc2[nH+]1 ZINC000359306971 1044152918 /nfs/dbraw/zinc/15/29/18/1044152918.db2.gz NRKNEUAQMBMHPD-LLVKDONJSA-N 1 2 319.364 4.360 20 0 DIADLO c1[nH+]c(-c2cccc(N[C@@H]3CCCSC3)c2)n2c1CCCC2 ZINC000444014917 1044154122 /nfs/dbraw/zinc/15/41/22/1044154122.db2.gz RWCNQESKUPDALF-MRXNPFEDSA-N 1 2 313.470 4.194 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C/C=C/c3ccccc3F)cc2[nH+]1 ZINC000359309723 1044154528 /nfs/dbraw/zinc/15/45/28/1044154528.db2.gz RQIXZMRBUJHVFT-GQCTYLIASA-N 1 2 309.344 4.052 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)c(C)c1 ZINC000292259473 1044154629 /nfs/dbraw/zinc/15/46/29/1044154629.db2.gz SPYLGIYEJPOXRS-GOSISDBHSA-N 1 2 312.461 4.141 20 0 DIADLO CC[C@@H]([NH2+][C@H](c1nccn1C)c1ccccc1)c1ccsc1 ZINC000562774806 1044156119 /nfs/dbraw/zinc/15/61/19/1044156119.db2.gz IAJZBWDRKMEREN-SJORKVTESA-N 1 2 311.454 4.312 20 0 DIADLO Cc1cc(Cl)ccc1C[NH2+][C@@H](c1nc(C2CC2)no1)C(C)C ZINC000129701307 1044172379 /nfs/dbraw/zinc/17/23/79/1044172379.db2.gz IJPUPOLAGHAKNE-OAHLLOKOSA-N 1 2 319.836 4.396 20 0 DIADLO Cc1cc(Cl)ccc1C[NH2+][C@H](c1nc(C2CC2)no1)C(C)C ZINC000129701505 1044172755 /nfs/dbraw/zinc/17/27/55/1044172755.db2.gz IJPUPOLAGHAKNE-HNNXBMFYSA-N 1 2 319.836 4.396 20 0 DIADLO CCN(CC)c1ccc(N[C@H]2CCCc3nc(C)sc32)c[nH+]1 ZINC000346947988 1044175055 /nfs/dbraw/zinc/17/50/55/1044175055.db2.gz VZOMSBMLRVMZTH-HNNXBMFYSA-N 1 2 316.474 4.182 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCC[C@H]3c3cccnc3)cs2)co1 ZINC000346999293 1044179913 /nfs/dbraw/zinc/17/99/13/1044179913.db2.gz QCENOOAGPIZZAJ-INIZCTEOSA-N 1 2 311.410 4.135 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCC[C@H]3c3cccnc3)cs2)co1 ZINC000346999293 1044179919 /nfs/dbraw/zinc/17/99/19/1044179919.db2.gz QCENOOAGPIZZAJ-INIZCTEOSA-N 1 2 311.410 4.135 20 0 DIADLO Brc1cc(C[N@@H+]2CCC[C@H]2c2cccnc2)cs1 ZINC000346996325 1044182512 /nfs/dbraw/zinc/18/25/12/1044182512.db2.gz LQMSGPHHTJTMIS-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cc(C[N@H+]2CCC[C@H]2c2cccnc2)cs1 ZINC000346996325 1044182519 /nfs/dbraw/zinc/18/25/19/1044182519.db2.gz LQMSGPHHTJTMIS-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO FC(F)c1ccc(C[NH+]2CCN(Cc3cccs3)CC2)cc1 ZINC000359619420 1044183892 /nfs/dbraw/zinc/18/38/92/1044183892.db2.gz SBWAXYVYJLWAMG-UHFFFAOYSA-N 1 2 322.424 4.004 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](CC)Cc2ccccc2)cs1 ZINC000347042438 1044189558 /nfs/dbraw/zinc/18/95/58/1044189558.db2.gz LLVMOBIMPQUAEG-AWEZNQCLSA-N 1 2 304.459 4.263 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](CC)Cc2ccccc2)cs1 ZINC000347042438 1044189562 /nfs/dbraw/zinc/18/95/62/1044189562.db2.gz LLVMOBIMPQUAEG-AWEZNQCLSA-N 1 2 304.459 4.263 20 0 DIADLO Cc1ccc(-c2ccc(Cl)cc2NCc2c[nH+]cn2C)o1 ZINC000359697153 1044191079 /nfs/dbraw/zinc/19/10/79/1044191079.db2.gz BCFUXPVZVZDIDT-UHFFFAOYSA-N 1 2 301.777 4.254 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+]Cc2ccccc2OC2CCCC2)n1 ZINC000882902514 1044202475 /nfs/dbraw/zinc/20/24/75/1044202475.db2.gz IMMSMCWCAGABBC-UHFFFAOYSA-N 1 2 313.445 4.144 20 0 DIADLO CCO[C@H]1C[C@@H](Nc2cc(CSCC)cc[nH+]2)C12CCC2 ZINC000347205756 1044207117 /nfs/dbraw/zinc/20/71/17/1044207117.db2.gz QDPFPPGNZVVEHT-CABCVRRESA-N 1 2 306.475 4.094 20 0 DIADLO CC(C)c1c[nH]c(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)n1 ZINC000882970025 1044209337 /nfs/dbraw/zinc/20/93/37/1044209337.db2.gz NKEKYXYUHGVQDA-UHFFFAOYSA-N 1 2 323.362 4.331 20 0 DIADLO FC(F)(F)c1nn(CC[C@H]2CCCC2(F)F)c2cc[nH+]cc21 ZINC000882986246 1044209791 /nfs/dbraw/zinc/20/97/91/1044209791.db2.gz NNBIIJRUISSRLY-SECBINFHSA-N 1 2 319.277 4.276 20 0 DIADLO FC(F)(F)c1nn(CC[C@@H]2CCCC2(F)F)c2cc[nH+]cc21 ZINC000882986247 1044209929 /nfs/dbraw/zinc/20/99/29/1044209929.db2.gz NNBIIJRUISSRLY-VIFPVBQESA-N 1 2 319.277 4.276 20 0 DIADLO COCCCC[C@@H](Nc1[nH+]c(C)nc2[nH]ccc21)c1ccccc1 ZINC000359907300 1044215456 /nfs/dbraw/zinc/21/54/56/1044215456.db2.gz VOWXWTDCRHKMCF-QGZVFWFLSA-N 1 2 324.428 4.236 20 0 DIADLO Cc1ncc(C[N@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)s1 ZINC000347263891 1044220226 /nfs/dbraw/zinc/22/02/26/1044220226.db2.gz HVYNAELKHORJFV-BDJLRTHQSA-N 1 2 302.443 4.333 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)s1 ZINC000347263891 1044220216 /nfs/dbraw/zinc/22/02/16/1044220216.db2.gz HVYNAELKHORJFV-BDJLRTHQSA-N 1 2 302.443 4.333 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)c2ccccc2Cl)c(C)[nH+]1 ZINC001271397636 1044220883 /nfs/dbraw/zinc/22/08/83/1044220883.db2.gz XEXBRDUGOJZBNM-GFCCVEGCSA-N 1 2 302.805 4.151 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+][C@@H](C)c1cncs1 ZINC000934201343 1044230265 /nfs/dbraw/zinc/23/02/65/1044230265.db2.gz REQHIXTYGDPMQO-VIFPVBQESA-N 1 2 305.428 4.019 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3cncs3)cs2)cc1 ZINC000934201806 1044230589 /nfs/dbraw/zinc/23/05/89/1044230589.db2.gz UXXFGWUEZBNAPB-LBPRGKRZSA-N 1 2 315.467 4.426 20 0 DIADLO CC[C@@H]([NH2+]Cc1csc(COC)n1)c1sccc1Cl ZINC000883223574 1044239505 /nfs/dbraw/zinc/23/95/05/1044239505.db2.gz RTBMCUIULFNAMN-LLVKDONJSA-N 1 2 316.879 4.245 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+]C(C)(C)c2ccccc2C)n1 ZINC000293067086 1044243035 /nfs/dbraw/zinc/24/30/35/1044243035.db2.gz VCXCBRZNPDYNGI-ZDUSSCGKSA-N 1 2 319.474 4.217 20 0 DIADLO CCc1noc(C)c1C[NH2+]Cc1ccc(Oc2ccccc2)o1 ZINC000293107069 1044249243 /nfs/dbraw/zinc/24/92/43/1044249243.db2.gz YFISQIBSGQCGII-UHFFFAOYSA-N 1 2 312.369 4.221 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+][C@H]1C[C@H](C)n2ccnc21 ZINC000883267620 1044255568 /nfs/dbraw/zinc/25/55/68/1044255568.db2.gz LFFPNKDCRBEUJS-WFASDCNBSA-N 1 2 319.836 4.119 20 0 DIADLO Cc1ccc(C[NH2+]Cc2nc(C(C)(C)C)cs2)c(Cl)n1 ZINC000883293824 1044260680 /nfs/dbraw/zinc/26/06/80/1044260680.db2.gz HUNFRGYHIMOEEH-UHFFFAOYSA-N 1 2 309.866 4.087 20 0 DIADLO CCC(CC)N(CC(C)C)C(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000360347081 1044262593 /nfs/dbraw/zinc/26/25/93/1044262593.db2.gz RWGLDFKUZFKBDK-UHFFFAOYSA-N 1 2 313.445 4.159 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2cc3ccccc3c(OC)c2)o1 ZINC000934631311 1044264552 /nfs/dbraw/zinc/26/45/52/1044264552.db2.gz KBVRHNYVJSJLJY-ZDUSSCGKSA-N 1 2 310.397 4.250 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C1(c2ncccn2)CCC1 ZINC000883312323 1044265728 /nfs/dbraw/zinc/26/57/28/1044265728.db2.gz AHFIUUZKGMWSRI-CYBMUJFWSA-N 1 2 316.474 4.095 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+]C2(c3ncccn3)CCC2)cc1 ZINC000883312583 1044266460 /nfs/dbraw/zinc/26/64/60/1044266460.db2.gz HZQHROVMQBZAGM-CQSZACIVSA-N 1 2 313.470 4.319 20 0 DIADLO Cc1sccc1C[NH2+][C@@H](C)c1nc(C2CCCCC2)no1 ZINC000293427745 1044282595 /nfs/dbraw/zinc/28/25/95/1044282595.db2.gz AWYAYVNTJRYTIG-NSHDSACASA-N 1 2 305.447 4.338 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CC=C(c3cccc(C)c3C)CC2)s1 ZINC000934841730 1044285613 /nfs/dbraw/zinc/28/56/13/1044285613.db2.gz RICWLBNOUQTBMJ-CQSZACIVSA-N 1 2 313.470 4.314 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CC=C(c3cccc(C)c3C)CC2)s1 ZINC000934841730 1044285622 /nfs/dbraw/zinc/28/56/22/1044285622.db2.gz RICWLBNOUQTBMJ-CQSZACIVSA-N 1 2 313.470 4.314 20 0 DIADLO C[C@H]([NH2+][C@H]1c2ccccc2CC[C@H]1F)c1ccncc1Cl ZINC000883377537 1044289763 /nfs/dbraw/zinc/28/97/63/1044289763.db2.gz KIGVBGNJUCKVKR-JECHBYEQSA-N 1 2 304.796 4.411 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@@H]1CCc2ccc(Cl)nc21 ZINC000883377010 1044290097 /nfs/dbraw/zinc/29/00/97/1044290097.db2.gz XSXIQTQUJNVXTH-RKVPGOIHSA-N 1 2 316.807 4.338 20 0 DIADLO F[C@H]1CCc2ccccc2[C@H]1[NH2+]Cc1cnc(C2CC2)s1 ZINC000883382963 1044295362 /nfs/dbraw/zinc/29/53/62/1044295362.db2.gz QSGFAZMAWYGLNU-JKSUJKDBSA-N 1 2 302.418 4.136 20 0 DIADLO Clc1ccc2c(n1)[C@@H]([NH2+]Cc1nsc3ccccc13)CC2 ZINC000883402822 1044307057 /nfs/dbraw/zinc/30/70/57/1044307057.db2.gz BFIPGVOQFGNJJB-LBPRGKRZSA-N 1 2 315.829 4.122 20 0 DIADLO Cc1nc(C(C)C)oc1C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000293636397 1044306986 /nfs/dbraw/zinc/30/69/86/1044306986.db2.gz NNDDCERJWUFXHI-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO Cc1ccc2c(Nc3ncccc3Br)cccc2[nH+]1 ZINC001212794247 1044311465 /nfs/dbraw/zinc/31/14/65/1044311465.db2.gz QJJMSQSASJZOFA-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO CC(C)c1c[nH]c(SCc2c[nH+]cn2Cc2ccccc2)n1 ZINC000629222836 1044313327 /nfs/dbraw/zinc/31/33/27/1044313327.db2.gz AXHVXXKNSJKENO-UHFFFAOYSA-N 1 2 312.442 4.070 20 0 DIADLO Cc1ccc2c(Nc3cc(Cl)nnc3Cl)cccc2[nH+]1 ZINC001212795002 1044316725 /nfs/dbraw/zinc/31/67/25/1044316725.db2.gz JCAQEURYLHBHKS-UHFFFAOYSA-N 1 2 305.168 4.384 20 0 DIADLO CCc1ccc(C[NH2+]C2(c3c(F)cccc3F)CCC2)nc1 ZINC000626178784 1044327952 /nfs/dbraw/zinc/32/79/52/1044327952.db2.gz JGLFQVNWSJMHBG-UHFFFAOYSA-N 1 2 302.368 4.091 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000475276778 1044338900 /nfs/dbraw/zinc/33/89/00/1044338900.db2.gz BTDFYKNKLPUNBY-NXEZZACHSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000475276778 1044338915 /nfs/dbraw/zinc/33/89/15/1044338915.db2.gz BTDFYKNKLPUNBY-NXEZZACHSA-N 1 2 306.397 4.213 20 0 DIADLO Cc1ccc2c(Nc3ccc4nc(C5CC5)nn4c3)cccc2[nH+]1 ZINC001212796794 1044343816 /nfs/dbraw/zinc/34/38/16/1044343816.db2.gz CYYSSXQFKWPEIR-UHFFFAOYSA-N 1 2 315.380 4.207 20 0 DIADLO Cc1ccc2c(cccc2N(c2ccc(N)cn2)C2CCC2)[nH+]1 ZINC001212796920 1044348685 /nfs/dbraw/zinc/34/86/85/1044348685.db2.gz MQKLIASXPGXWLV-UHFFFAOYSA-N 1 2 304.397 4.211 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1cc(Cl)cs1)C2 ZINC000361022335 1044349279 /nfs/dbraw/zinc/34/92/79/1044349279.db2.gz LGDAITJUAFUXMN-UHFFFAOYSA-N 1 2 305.830 4.155 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@H+](Cc1cc(Cl)cs1)C2 ZINC000361022335 1044349286 /nfs/dbraw/zinc/34/92/86/1044349286.db2.gz LGDAITJUAFUXMN-UHFFFAOYSA-N 1 2 305.830 4.155 20 0 DIADLO Cc1ccc2c(Nc3ccc4nnc(C(C)C)n4c3)cccc2[nH+]1 ZINC001212797097 1044355447 /nfs/dbraw/zinc/35/54/47/1044355447.db2.gz XUWWOBXRPFUSIL-UHFFFAOYSA-N 1 2 317.396 4.453 20 0 DIADLO CC(C)[N@@H+](Cc1ccccc1)Cn1nc(C(C)(C)C)[nH]c1=S ZINC000029219195 1044362241 /nfs/dbraw/zinc/36/22/41/1044362241.db2.gz NHKQONJHPPKYDL-UHFFFAOYSA-N 1 2 318.490 4.106 20 0 DIADLO CC(C)[N@H+](Cc1ccccc1)Cn1nc(C(C)(C)C)[nH]c1=S ZINC000029219195 1044362246 /nfs/dbraw/zinc/36/22/46/1044362246.db2.gz NHKQONJHPPKYDL-UHFFFAOYSA-N 1 2 318.490 4.106 20 0 DIADLO C[C@H]([NH2+]Cc1csc(C2CCCC2)n1)c1cncc(F)c1 ZINC000361129564 1044364891 /nfs/dbraw/zinc/36/48/91/1044364891.db2.gz DXEMKGHBGRXSDI-NSHDSACASA-N 1 2 305.422 4.186 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+][C@@H](C)c1cncc(F)c1 ZINC000361131536 1044365629 /nfs/dbraw/zinc/36/56/29/1044365629.db2.gz JVNNOJXMELBULZ-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO Cc1cn2cc(NC(=O)[C@H](C)c3cc4ccccc4o3)ccc2[nH+]1 ZINC000361154892 1044367892 /nfs/dbraw/zinc/36/78/92/1044367892.db2.gz RKDXRVHVTIVYMR-CYBMUJFWSA-N 1 2 319.364 4.131 20 0 DIADLO Cc1ccc2c(Nc3c(F)c(F)c(N)c(F)c3F)cccc2[nH+]1 ZINC001212797882 1044377235 /nfs/dbraw/zinc/37/72/35/1044377235.db2.gz PVNKUDALZZPGNC-UHFFFAOYSA-N 1 2 321.277 4.425 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000564474598 1044384696 /nfs/dbraw/zinc/38/46/96/1044384696.db2.gz VQDCKOXAWXUTBE-FQEVSTJZSA-N 1 2 323.415 4.127 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000564474598 1044384712 /nfs/dbraw/zinc/38/47/12/1044384712.db2.gz VQDCKOXAWXUTBE-FQEVSTJZSA-N 1 2 323.415 4.127 20 0 DIADLO Cc1ccc2c(Nc3ccccc3C(=O)NC3CC3)cccc2[nH+]1 ZINC001212798035 1044389107 /nfs/dbraw/zinc/38/91/07/1044389107.db2.gz ZWVJIIWPRFTZDD-UHFFFAOYSA-N 1 2 317.392 4.179 20 0 DIADLO Cc1ccccc1[C@H](C)[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000564547831 1044390810 /nfs/dbraw/zinc/39/08/10/1044390810.db2.gz AJHWRJDUKYGZID-INIZCTEOSA-N 1 2 303.409 4.258 20 0 DIADLO Cc1ccccc1[C@H](C)[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000564547831 1044390826 /nfs/dbraw/zinc/39/08/26/1044390826.db2.gz AJHWRJDUKYGZID-INIZCTEOSA-N 1 2 303.409 4.258 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C2CCC2)no1)c1ccc(Cl)cc1 ZINC000639561083 1044391276 /nfs/dbraw/zinc/39/12/76/1044391276.db2.gz FGCRODOUDGGHGP-CQSZACIVSA-N 1 2 305.809 4.231 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CCC2)no1)c1ccc2c(c1)CCCC2 ZINC000639561393 1044394238 /nfs/dbraw/zinc/39/42/38/1044394238.db2.gz GQHWPSMCMYLCDQ-CYBMUJFWSA-N 1 2 311.429 4.067 20 0 DIADLO CC(C)c1noc([C@H](C)[N@@H+]2CCS[C@@H](c3ccccc3)C2)n1 ZINC000361476910 1044407042 /nfs/dbraw/zinc/40/70/42/1044407042.db2.gz FCAUPMIYBORXAN-DZGCQCFKSA-N 1 2 317.458 4.044 20 0 DIADLO CC(C)c1noc([C@H](C)[N@H+]2CCS[C@@H](c3ccccc3)C2)n1 ZINC000361476910 1044407052 /nfs/dbraw/zinc/40/70/52/1044407052.db2.gz FCAUPMIYBORXAN-DZGCQCFKSA-N 1 2 317.458 4.044 20 0 DIADLO COc1ccncc1C[NH2+][C@@H](C)c1cc(Cl)sc1Cl ZINC000294364605 1044412297 /nfs/dbraw/zinc/41/22/97/1044412297.db2.gz QPFLBCVJUPIKDC-QMMMGPOBSA-N 1 2 317.241 4.309 20 0 DIADLO Cc1ccc([C@H](c2noc(C[C@@H](C)n3cc[nH+]c3)n2)C(C)C)cc1 ZINC000565063104 1044412559 /nfs/dbraw/zinc/41/25/59/1044412559.db2.gz RKIGLIZPLUPFQH-CRAIPNDOSA-N 1 2 324.428 4.166 20 0 DIADLO Cc1cc(N2CCc3c(F)cc(F)cc3[C@@H]2C)nc(C2CC2)[nH+]1 ZINC000361633610 1044427486 /nfs/dbraw/zinc/42/74/86/1044427486.db2.gz ZGJTYQJCNCIOGF-NSHDSACASA-N 1 2 315.367 4.064 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[N@H+](C)Cc1ncccc1F ZINC001204790477 1044431871 /nfs/dbraw/zinc/43/18/71/1044431871.db2.gz LLPITYZKBHVZJM-LBPRGKRZSA-N 1 2 307.438 4.302 20 0 DIADLO Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)Cc1ncccc1F ZINC001204790477 1044431880 /nfs/dbraw/zinc/43/18/80/1044431880.db2.gz LLPITYZKBHVZJM-LBPRGKRZSA-N 1 2 307.438 4.302 20 0 DIADLO CC(C)(C[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1)C1=CCCC1 ZINC000565463488 1044437588 /nfs/dbraw/zinc/43/75/88/1044437588.db2.gz VYHRPNSOFLHHIZ-MRXNPFEDSA-N 1 2 302.466 4.152 20 0 DIADLO Cc1ccc2c(Nc3c(CO)ccc(F)c3F)cccc2[nH+]1 ZINC001212798308 1044443721 /nfs/dbraw/zinc/44/37/21/1044443721.db2.gz DLQZMTCTHULOJD-UHFFFAOYSA-N 1 2 300.308 4.057 20 0 DIADLO Cc1ccc2c(Nc3c(F)cccc3OC3COC3)cccc2[nH+]1 ZINC001212798425 1044445711 /nfs/dbraw/zinc/44/57/11/1044445711.db2.gz GMWUNLNQRZGALF-UHFFFAOYSA-N 1 2 324.355 4.204 20 0 DIADLO CCC(CC)[C@@H](NC(=O)C[C@H](C)n1cc[nH+]c1)c1cccs1 ZINC000565660599 1044448049 /nfs/dbraw/zinc/44/80/49/1044448049.db2.gz JLZCNEABEKQCGD-SUMWQHHRSA-N 1 2 319.474 4.189 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ncccn1)c1ccc(Cl)c(Cl)c1 ZINC000361863658 1044454154 /nfs/dbraw/zinc/45/41/54/1044454154.db2.gz XZJHFWYWAKMGOP-CQSZACIVSA-N 1 2 310.228 4.414 20 0 DIADLO Cc1ccccc1[C@@H](NC(=O)C[C@@H](C)n1cc[nH+]c1)C(C)(C)C ZINC000565894562 1044460938 /nfs/dbraw/zinc/46/09/38/1044460938.db2.gz KALFWOTYGHUFEM-CRAIPNDOSA-N 1 2 313.445 4.046 20 0 DIADLO CC[N@H+](Cc1snnc1C)Cc1ccc(Cl)c(Cl)c1 ZINC000566301746 1044481367 /nfs/dbraw/zinc/48/13/67/1044481367.db2.gz OPPZDKHXHMODTE-UHFFFAOYSA-N 1 2 316.257 4.175 20 0 DIADLO CC[N@@H+](Cc1snnc1C)Cc1ccc(Cl)c(Cl)c1 ZINC000566301746 1044481374 /nfs/dbraw/zinc/48/13/74/1044481374.db2.gz OPPZDKHXHMODTE-UHFFFAOYSA-N 1 2 316.257 4.175 20 0 DIADLO COc1nc2ccccc2cc1C[N@H+](C)Cc1ccccc1F ZINC001137205802 1044483430 /nfs/dbraw/zinc/48/34/30/1044483430.db2.gz RRMYLOCOIZOVMC-UHFFFAOYSA-N 1 2 310.372 4.015 20 0 DIADLO COc1nc2ccccc2cc1C[N@@H+](C)Cc1ccccc1F ZINC001137205802 1044483435 /nfs/dbraw/zinc/48/34/35/1044483435.db2.gz RRMYLOCOIZOVMC-UHFFFAOYSA-N 1 2 310.372 4.015 20 0 DIADLO c1n[nH]c([C@H]([NH2+]C[C@H](c2ccccc2)C2CC2)C2CCCCC2)n1 ZINC000566350739 1044486045 /nfs/dbraw/zinc/48/60/45/1044486045.db2.gz ODUIEDHOOIWFSB-RTBURBONSA-N 1 2 324.472 4.210 20 0 DIADLO CC(C)CCCO[C@@H]1CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC001205977125 1044498598 /nfs/dbraw/zinc/49/85/98/1044498598.db2.gz SKTIQVCTPRGIIM-CYBMUJFWSA-N 1 2 316.898 4.214 20 0 DIADLO CC(C)CCCO[C@@H]1CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC001205977125 1044498602 /nfs/dbraw/zinc/49/86/02/1044498602.db2.gz SKTIQVCTPRGIIM-CYBMUJFWSA-N 1 2 316.898 4.214 20 0 DIADLO Cc1cc(C)c(NC(=O)NC2CCc3ccccc3CC2)c(C)[nH+]1 ZINC000566661702 1044507042 /nfs/dbraw/zinc/50/70/42/1044507042.db2.gz JCHCQRQSKRZLFK-UHFFFAOYSA-N 1 2 323.440 4.076 20 0 DIADLO c1n[nH]c([C@@H]([NH2+]CC2CC(c3ccccc3)C2)C2CCCCC2)n1 ZINC000566685097 1044507699 /nfs/dbraw/zinc/50/76/99/1044507699.db2.gz JKYSGRUCFHGWBE-PPSBMQLTSA-N 1 2 324.472 4.210 20 0 DIADLO Clc1cccc(Cl)c1C1CC[NH+](Cc2ccno2)CC1 ZINC000566701802 1044510012 /nfs/dbraw/zinc/51/00/12/1044510012.db2.gz LCBTWKKFDJULLV-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@]34CCCC[C@H]3C4(F)F)cc2[nH+]1 ZINC000665796274 1044509900 /nfs/dbraw/zinc/50/99/00/1044509900.db2.gz SWSNZIWZXFKOCZ-GDBMZVCRSA-N 1 2 319.355 4.025 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000362431845 1044510651 /nfs/dbraw/zinc/51/06/51/1044510651.db2.gz WCGRCDPPUDLROL-YOEHRIQHSA-N 1 2 301.434 4.339 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000362431845 1044510666 /nfs/dbraw/zinc/51/06/66/1044510666.db2.gz WCGRCDPPUDLROL-YOEHRIQHSA-N 1 2 301.434 4.339 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2csc(C(F)(F)F)c2)s1 ZINC000925151892 1044511726 /nfs/dbraw/zinc/51/17/26/1044511726.db2.gz MMDQKFBXBDDAAX-QMMMGPOBSA-N 1 2 306.378 4.383 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSC[C@H]1CCO[C@H](C)C1 ZINC000362457693 1044515084 /nfs/dbraw/zinc/51/50/84/1044515084.db2.gz QIZPEZGNVQFKEG-CVEARBPZSA-N 1 2 316.470 4.229 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2nn(-c3ccccc3)cc21)c1cscn1 ZINC000567250512 1044553522 /nfs/dbraw/zinc/55/35/22/1044553522.db2.gz NBZZLKFCUWPNPK-CJNGLKHVSA-N 1 2 324.453 4.057 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]Cc1ncc(C(F)(F)F)cn1 ZINC000295833107 1044563836 /nfs/dbraw/zinc/56/38/36/1044563836.db2.gz AABNGUWVLUCANM-BXUZGUMPSA-N 1 2 321.346 4.142 20 0 DIADLO Cc1ccc2nc(C[N@@H+](C)Cc3ccc(F)cc3F)ccc2c1 ZINC001137217317 1044563822 /nfs/dbraw/zinc/56/38/22/1044563822.db2.gz SIPOQAMGMBJXBR-UHFFFAOYSA-N 1 2 312.363 4.453 20 0 DIADLO Cc1ccc2nc(C[N@H+](C)Cc3ccc(F)cc3F)ccc2c1 ZINC001137217317 1044563838 /nfs/dbraw/zinc/56/38/38/1044563838.db2.gz SIPOQAMGMBJXBR-UHFFFAOYSA-N 1 2 312.363 4.453 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2nnc(-c3ccccc3)s2)c1 ZINC000444690402 1044603902 /nfs/dbraw/zinc/60/39/02/1044603902.db2.gz JRYWCFSTMWPMSP-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2nnc(-c3ccccc3)s2)c1 ZINC000444690402 1044603912 /nfs/dbraw/zinc/60/39/12/1044603912.db2.gz JRYWCFSTMWPMSP-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)[nH]1 ZINC000296386446 1044614896 /nfs/dbraw/zinc/61/48/96/1044614896.db2.gz JWMHPIMIGNTLRV-HNNXBMFYSA-N 1 2 324.831 4.208 20 0 DIADLO c1nc([C@H]2CCC[N@H+]2Cc2ccc(-c3ccccc3)cc2)no1 ZINC000523370739 1044621509 /nfs/dbraw/zinc/62/15/09/1044621509.db2.gz OGGYWTCQNWBNCJ-GOSISDBHSA-N 1 2 305.381 4.074 20 0 DIADLO c1nc([C@H]2CCC[N@@H+]2Cc2ccc(-c3ccccc3)cc2)no1 ZINC000523370739 1044621517 /nfs/dbraw/zinc/62/15/17/1044621517.db2.gz OGGYWTCQNWBNCJ-GOSISDBHSA-N 1 2 305.381 4.074 20 0 DIADLO CCn1ccnc1C[NH2+][C@@H](c1cccc(C)c1)c1cccc(F)c1 ZINC000296479692 1044622861 /nfs/dbraw/zinc/62/28/61/1044622861.db2.gz OEPUNEGMIFNEIH-FQEVSTJZSA-N 1 2 323.415 4.230 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@H+](Cc2ccc3occc3c2)CCO1 ZINC000568447189 1044625869 /nfs/dbraw/zinc/62/58/69/1044625869.db2.gz HOBPEYXHFXYRGQ-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccccc1[C@@H]1C[N@@H+](Cc2ccc3occc3c2)CCO1 ZINC000568447189 1044625871 /nfs/dbraw/zinc/62/58/71/1044625871.db2.gz HOBPEYXHFXYRGQ-IBGZPJMESA-N 1 2 311.356 4.145 20 0 DIADLO CCCCCCC(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC000886212129 1044627037 /nfs/dbraw/zinc/62/70/37/1044627037.db2.gz JLFYRHPXLFMYLY-CQSZACIVSA-N 1 2 323.506 4.284 20 0 DIADLO CCCCCCC(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000886212129 1044627043 /nfs/dbraw/zinc/62/70/43/1044627043.db2.gz JLFYRHPXLFMYLY-CQSZACIVSA-N 1 2 323.506 4.284 20 0 DIADLO Cc1cc([C@H](C)[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)nn1C ZINC000282954489 1044629547 /nfs/dbraw/zinc/62/95/47/1044629547.db2.gz ZITZOHUASVMBQQ-NSHDSACASA-N 1 2 324.255 4.375 20 0 DIADLO Cc1cc(C)c([C@H](C)[NH2+]Cc2ncc(C(F)(F)F)cn2)cc1C ZINC000296600818 1044633947 /nfs/dbraw/zinc/63/39/47/1044633947.db2.gz VOUQZXGIFBUPGW-ZDUSSCGKSA-N 1 2 323.362 4.271 20 0 DIADLO Cc1cc(C)c2cc(NCc3c(C4CC4)cnn3C)ccc2[nH+]1 ZINC000886369384 1044636049 /nfs/dbraw/zinc/63/60/49/1044636049.db2.gz DNBUMKIWNUMAQO-UHFFFAOYSA-N 1 2 306.413 4.075 20 0 DIADLO Cc1ccc2[nH]c([C@@H]3CCC[N@@H+]3Cc3ccc(F)cc3)nc2c1 ZINC000568565536 1044636231 /nfs/dbraw/zinc/63/62/31/1044636231.db2.gz LHZFMFZSQUNNJE-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2[nH]c([C@@H]3CCC[N@H+]3Cc3ccc(F)cc3)nc2c1 ZINC000568565536 1044636238 /nfs/dbraw/zinc/63/62/38/1044636238.db2.gz LHZFMFZSQUNNJE-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc([C@@H]3CCC[N@@H+]3Cc3ccc(F)cc3)[nH]c2c1 ZINC000568565536 1044636245 /nfs/dbraw/zinc/63/62/45/1044636245.db2.gz LHZFMFZSQUNNJE-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc([C@@H]3CCC[N@H+]3Cc3ccc(F)cc3)[nH]c2c1 ZINC000568565536 1044636252 /nfs/dbraw/zinc/63/62/52/1044636252.db2.gz LHZFMFZSQUNNJE-SFHVURJKSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2[nH]c([C@H]3CCC[N@@H+]3Cc3ccc(F)cc3)nc2c1 ZINC000568565535 1044636831 /nfs/dbraw/zinc/63/68/31/1044636831.db2.gz LHZFMFZSQUNNJE-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2[nH]c([C@H]3CCC[N@H+]3Cc3ccc(F)cc3)nc2c1 ZINC000568565535 1044636841 /nfs/dbraw/zinc/63/68/41/1044636841.db2.gz LHZFMFZSQUNNJE-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc([C@H]3CCC[N@@H+]3Cc3ccc(F)cc3)[nH]c2c1 ZINC000568565535 1044636848 /nfs/dbraw/zinc/63/68/48/1044636848.db2.gz LHZFMFZSQUNNJE-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccc2nc([C@H]3CCC[N@H+]3Cc3ccc(F)cc3)[nH]c2c1 ZINC000568565535 1044636853 /nfs/dbraw/zinc/63/68/53/1044636853.db2.gz LHZFMFZSQUNNJE-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000523443941 1044638701 /nfs/dbraw/zinc/63/87/01/1044638701.db2.gz KABNUULREZYQTK-PWSUYJOCSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000523443941 1044638707 /nfs/dbraw/zinc/63/87/07/1044638707.db2.gz KABNUULREZYQTK-PWSUYJOCSA-N 1 2 323.305 4.069 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1Br)c1nccs1 ZINC000070984370 1044661086 /nfs/dbraw/zinc/66/10/86/1044661086.db2.gz MUZVUTAWWYYVFA-UWVGGRQHSA-N 1 2 311.248 4.317 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](CO)c2c(Cl)cccc2Cl)cc1C ZINC000475620727 1044672048 /nfs/dbraw/zinc/67/20/48/1044672048.db2.gz DGOYRQDSANGPPM-INIZCTEOSA-N 1 2 324.251 4.433 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cccc(-c2noc(C3CC3)n2)c1 ZINC000569212562 1044683632 /nfs/dbraw/zinc/68/36/32/1044683632.db2.gz PCAMFDLORNIJLN-UHFFFAOYSA-N 1 2 323.400 4.004 20 0 DIADLO Cc1cc(N(Cc2ccc(F)cc2)CC2CC2)nc(C2CC2)[nH+]1 ZINC000523875351 1044699130 /nfs/dbraw/zinc/69/91/30/1044699130.db2.gz UTOSYNVZDSEECK-UHFFFAOYSA-N 1 2 311.404 4.218 20 0 DIADLO O=C(Nc1ccccc1-c1ccccc1)[C@H]1CCCc2[nH+]c[nH]c21 ZINC000366190914 1044712711 /nfs/dbraw/zinc/71/27/11/1044712711.db2.gz LHGNPSQABSWIKE-INIZCTEOSA-N 1 2 317.392 4.135 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C(F)F)no1)c1cccc2ccccc21 ZINC000886919300 1044717129 /nfs/dbraw/zinc/71/71/29/1044717129.db2.gz HAJYQZHMNAOYKP-CQSZACIVSA-N 1 2 317.339 4.401 20 0 DIADLO CC[C@@H]([NH2+]Cc1noc(C2CC2)n1)c1cccc2ccccc21 ZINC000886917657 1044717930 /nfs/dbraw/zinc/71/79/30/1044717930.db2.gz HKNBRKDXZMEIRC-QGZVFWFLSA-N 1 2 307.397 4.341 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@@H](C)c2ccccn2)c2ccccn2)cc1 ZINC000366276929 1044718631 /nfs/dbraw/zinc/71/86/31/1044718631.db2.gz ZYKZLRQNMFPPBD-OXJNMPFZSA-N 1 2 303.409 4.225 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@@H](C)c2cncc(F)c2)c2ccccn2)cc1 ZINC000366435289 1044718736 /nfs/dbraw/zinc/71/87/36/1044718736.db2.gz WPJLTVQLDMJGOU-YWZLYKJASA-N 1 2 321.399 4.364 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@@H](C)c2cncc(F)c2)c2ccccn2)cc1 ZINC000366435287 1044718929 /nfs/dbraw/zinc/71/89/29/1044718929.db2.gz WPJLTVQLDMJGOU-MGPUTAFESA-N 1 2 321.399 4.364 20 0 DIADLO C[N@H+](Cc1cccc(C(F)(F)F)c1)Cc1cnccc1Cl ZINC001137236855 1044729412 /nfs/dbraw/zinc/72/94/12/1044729412.db2.gz QYVUUNNVJYFFEP-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1cccc(C(F)(F)F)c1)Cc1cnccc1Cl ZINC001137236855 1044729430 /nfs/dbraw/zinc/72/94/30/1044729430.db2.gz QYVUUNNVJYFFEP-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(Br)ccc2F)CCC1(F)F ZINC000570130792 1044735321 /nfs/dbraw/zinc/73/53/21/1044735321.db2.gz VVJSKVUCXOYDOE-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(Br)ccc2F)CCC1(F)F ZINC000570130792 1044735339 /nfs/dbraw/zinc/73/53/39/1044735339.db2.gz VVJSKVUCXOYDOE-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO c1cc2c(cccc2C[N@@H+]2CCCC[C@H]2c2noc(C3CC3)n2)[nH]1 ZINC000367472295 1044743362 /nfs/dbraw/zinc/74/33/62/1044743362.db2.gz HXQKQSQVBLEYOH-KRWDZBQOSA-N 1 2 322.412 4.156 20 0 DIADLO c1cc2c(cccc2C[N@H+]2CCCC[C@H]2c2noc(C3CC3)n2)[nH]1 ZINC000367472295 1044743375 /nfs/dbraw/zinc/74/33/75/1044743375.db2.gz HXQKQSQVBLEYOH-KRWDZBQOSA-N 1 2 322.412 4.156 20 0 DIADLO CCC(C)(C)CC[S@](=O)Cc1c[nH+]cn1Cc1ccccc1 ZINC000445540192 1044747306 /nfs/dbraw/zinc/74/73/06/1044747306.db2.gz OBQBUJWAXBGZON-QFIPXVFZSA-N 1 2 318.486 4.006 20 0 DIADLO CC(C)[C@H](C)[N@H+](C)Cn1nc2sc3ccccc3n2c1=S ZINC000029541605 1044750867 /nfs/dbraw/zinc/75/08/67/1044750867.db2.gz ZRXIFFMGRNQPBW-NSHDSACASA-N 1 2 320.487 4.014 20 0 DIADLO CC(C)[C@H](C)[N@@H+](C)Cn1nc2sc3ccccc3n2c1=S ZINC000029541605 1044750881 /nfs/dbraw/zinc/75/08/81/1044750881.db2.gz ZRXIFFMGRNQPBW-NSHDSACASA-N 1 2 320.487 4.014 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C(C)(C)C ZINC000524187269 1044762678 /nfs/dbraw/zinc/76/26/78/1044762678.db2.gz RLLKPKXPZGEBLY-NSHDSACASA-N 1 2 305.809 4.146 20 0 DIADLO CCc1nc(C[N@@H+]2CCC[C@H]2CC(=O)c2cccs2)cs1 ZINC000121818644 1044766252 /nfs/dbraw/zinc/76/62/52/1044766252.db2.gz KZEIIIONJHWZAI-ZDUSSCGKSA-N 1 2 320.483 4.004 20 0 DIADLO CCc1nc(C[N@H+]2CCC[C@H]2CC(=O)c2cccs2)cs1 ZINC000121818644 1044766264 /nfs/dbraw/zinc/76/62/64/1044766264.db2.gz KZEIIIONJHWZAI-ZDUSSCGKSA-N 1 2 320.483 4.004 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1nc2cc(Cl)ccc2n1C ZINC000122902644 1044779650 /nfs/dbraw/zinc/77/96/50/1044779650.db2.gz IASUQFDDLATWBA-NSHDSACASA-N 1 2 303.793 4.013 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1nc2cc(Cl)ccc2n1C ZINC000122902644 1044779662 /nfs/dbraw/zinc/77/96/62/1044779662.db2.gz IASUQFDDLATWBA-NSHDSACASA-N 1 2 303.793 4.013 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2C/C=C/c2ccc(F)c(F)c2)no1 ZINC000368565262 1044780713 /nfs/dbraw/zinc/78/07/13/1044780713.db2.gz BYMADGFKMQSOQX-NKEDHYFDSA-N 1 2 304.340 4.112 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2C/C=C/c2ccc(F)c(F)c2)no1 ZINC000368565262 1044780727 /nfs/dbraw/zinc/78/07/27/1044780727.db2.gz BYMADGFKMQSOQX-NKEDHYFDSA-N 1 2 304.340 4.112 20 0 DIADLO CC(C)n1ccnc1C[NH+]1CCC(c2cccc(F)c2F)CC1 ZINC000368732741 1044788131 /nfs/dbraw/zinc/78/81/31/1044788131.db2.gz PRZVFHXGMBCTIA-UHFFFAOYSA-N 1 2 319.399 4.122 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CCC(F)(F)C3)c2)[nH+]c1C ZINC000369085050 1044795585 /nfs/dbraw/zinc/79/55/85/1044795585.db2.gz POQOZLCFXFJOAJ-CYBMUJFWSA-N 1 2 319.355 4.067 20 0 DIADLO c1csc(-c2nc(C[N@@H+]3CCC[C@H]3c3ccncc3)co2)c1 ZINC000125369623 1044798974 /nfs/dbraw/zinc/79/89/74/1044798974.db2.gz BJICGKDAHPBQNK-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO c1csc(-c2nc(C[N@H+]3CCC[C@H]3c3ccncc3)co2)c1 ZINC000125369623 1044798989 /nfs/dbraw/zinc/79/89/89/1044798989.db2.gz BJICGKDAHPBQNK-HNNXBMFYSA-N 1 2 311.410 4.135 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@H]2c2ccncc2)s1 ZINC000125377957 1044801958 /nfs/dbraw/zinc/80/19/58/1044801958.db2.gz YHZXTBSYLIINHM-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)s1 ZINC000125377957 1044801944 /nfs/dbraw/zinc/80/19/44/1044801944.db2.gz YHZXTBSYLIINHM-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2ccc(Cl)nc2)c2ccccn2)cc1 ZINC000369304660 1044804388 /nfs/dbraw/zinc/80/43/88/1044804388.db2.gz FBAPJJGKUKMXAC-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO C[C@H]1c2ccccc2C[N@H+]1Cc1cncn1Cc1ccccc1 ZINC000445756342 1044808029 /nfs/dbraw/zinc/80/80/29/1044808029.db2.gz DMLXSTBCYNWTJF-INIZCTEOSA-N 1 2 303.409 4.008 20 0 DIADLO C[C@H]1c2ccccc2C[N@@H+]1Cc1cncn1Cc1ccccc1 ZINC000445756342 1044808056 /nfs/dbraw/zinc/80/80/56/1044808056.db2.gz DMLXSTBCYNWTJF-INIZCTEOSA-N 1 2 303.409 4.008 20 0 DIADLO CC(C)(CC(=O)N1CCC(c2c[nH]c[nH+]2)CC1)C1CCCCC1 ZINC000369528798 1044808813 /nfs/dbraw/zinc/80/88/13/1044808813.db2.gz CAMYQHLCOVFQMR-UHFFFAOYSA-N 1 2 317.477 4.112 20 0 DIADLO CC(C)(CC(=O)N1CCC(c2c[nH+]c[nH]2)CC1)C1CCCCC1 ZINC000369528798 1044808827 /nfs/dbraw/zinc/80/88/27/1044808827.db2.gz CAMYQHLCOVFQMR-UHFFFAOYSA-N 1 2 317.477 4.112 20 0 DIADLO Cc1csc(C[NH2+][C@@H](C)c2cc(C)ccc2OC(F)F)n1 ZINC000126201221 1044811425 /nfs/dbraw/zinc/81/14/25/1044811425.db2.gz ANBSIKQZJBOXKE-NSHDSACASA-N 1 2 312.385 4.212 20 0 DIADLO Cc1csc(C[NH2+][C@H](C)c2ccccc2OC(F)(F)F)n1 ZINC000126202612 1044811942 /nfs/dbraw/zinc/81/19/42/1044811942.db2.gz CNWAKQJGJOGZRL-SNVBAGLBSA-N 1 2 316.348 4.201 20 0 DIADLO Cc1csc(C[NH2+][C@@H](C)c2ccccc2OC(F)(F)F)n1 ZINC000126202405 1044812538 /nfs/dbraw/zinc/81/25/38/1044812538.db2.gz CNWAKQJGJOGZRL-JTQLQIEISA-N 1 2 316.348 4.201 20 0 DIADLO Cc1nn(C(C)C)cc1C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000369749882 1044814773 /nfs/dbraw/zinc/81/47/73/1044814773.db2.gz KFUMDVJXRZLIBJ-FQEVSTJZSA-N 1 2 320.440 4.047 20 0 DIADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccn(C(C)C)n1 ZINC000571468852 1044815825 /nfs/dbraw/zinc/81/58/25/1044815825.db2.gz VVOCVGSBOJPKGF-CYBMUJFWSA-N 1 2 321.852 4.367 20 0 DIADLO CC1=CCC[N@@H+]([C@@H](C)c2nnc(-c3ccccc3F)s2)C1 ZINC000571770762 1044823575 /nfs/dbraw/zinc/82/35/75/1044823575.db2.gz SWPYMGATWHRBSR-LBPRGKRZSA-N 1 2 303.406 4.057 20 0 DIADLO CC1=CCC[N@H+]([C@@H](C)c2nnc(-c3ccccc3F)s2)C1 ZINC000571770762 1044823586 /nfs/dbraw/zinc/82/35/86/1044823586.db2.gz SWPYMGATWHRBSR-LBPRGKRZSA-N 1 2 303.406 4.057 20 0 DIADLO CCCC(C)(C)Cc1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000571718535 1044825145 /nfs/dbraw/zinc/82/51/45/1044825145.db2.gz PXEYJCFTJCGOBA-UHFFFAOYSA-N 1 2 324.428 4.350 20 0 DIADLO CC(C)c1nnc(C[N@H+](Cc2cccc(Cl)c2)C(C)C)o1 ZINC000263765339 1044825250 /nfs/dbraw/zinc/82/52/50/1044825250.db2.gz LZXVSCRQEZOKHY-UHFFFAOYSA-N 1 2 307.825 4.257 20 0 DIADLO CC(C)c1nnc(C[N@@H+](Cc2cccc(Cl)c2)C(C)C)o1 ZINC000263765339 1044825263 /nfs/dbraw/zinc/82/52/63/1044825263.db2.gz LZXVSCRQEZOKHY-UHFFFAOYSA-N 1 2 307.825 4.257 20 0 DIADLO C[C@H](Cc1noc([C@H](c2ccccc2)[NH+](C)C)n1)c1ccccc1 ZINC000571840268 1044826805 /nfs/dbraw/zinc/82/68/05/1044826805.db2.gz RNLUOIKBELQROT-BEFAXECRSA-N 1 2 321.424 4.067 20 0 DIADLO CC(C)[N@@H+](Cc1ccn(-c2ccccc2F)n1)Cc1ccco1 ZINC000445797602 1044828457 /nfs/dbraw/zinc/82/84/57/1044828457.db2.gz JZSQNXFLOFAVDA-UHFFFAOYSA-N 1 2 313.376 4.015 20 0 DIADLO CC(C)[N@H+](Cc1ccn(-c2ccccc2F)n1)Cc1ccco1 ZINC000445797602 1044828480 /nfs/dbraw/zinc/82/84/80/1044828480.db2.gz JZSQNXFLOFAVDA-UHFFFAOYSA-N 1 2 313.376 4.015 20 0 DIADLO CC(C)c1ccc(C[N@H+](C)Cc2nnc(-c3ccco3)o2)cc1 ZINC000263845555 1044831977 /nfs/dbraw/zinc/83/19/77/1044831977.db2.gz SYKLCUDTSAJFQO-UHFFFAOYSA-N 1 2 311.385 4.085 20 0 DIADLO CC(C)c1ccc(C[N@@H+](C)Cc2nnc(-c3ccco3)o2)cc1 ZINC000263845555 1044831999 /nfs/dbraw/zinc/83/19/99/1044831999.db2.gz SYKLCUDTSAJFQO-UHFFFAOYSA-N 1 2 311.385 4.085 20 0 DIADLO CCc1nc(C[NH+]2CCC(c3ncccc3Cl)CC2)cs1 ZINC000370580309 1044843256 /nfs/dbraw/zinc/84/32/56/1044843256.db2.gz SOFYRZREOOVOAN-UHFFFAOYSA-N 1 2 321.877 4.134 20 0 DIADLO O=C(CCC1CC1)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000524492162 1044851698 /nfs/dbraw/zinc/85/16/98/1044851698.db2.gz GONZAGVSEBEZJG-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO CC[C@@H](C)[C@H](C(=O)Nc1ccn2cc[nH+]c2c1)c1ccccc1 ZINC000572549203 1044861918 /nfs/dbraw/zinc/86/19/18/1044861918.db2.gz LTNCXZYLUCIVED-KDOFPFPSSA-N 1 2 307.397 4.103 20 0 DIADLO Cc1c[nH+]c(CCSc2nnc(-c3cccs3)o2)c(C)c1 ZINC000572761047 1044876337 /nfs/dbraw/zinc/87/63/37/1044876337.db2.gz QQMGPOQWYPQAAC-UHFFFAOYSA-N 1 2 317.439 4.145 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2cn(-c3ccccc3)nn2)c1 ZINC000524594027 1044882821 /nfs/dbraw/zinc/88/28/21/1044882821.db2.gz BHKDRZXVQCGMMP-QGZVFWFLSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@@H+](C)Cc2cn(-c3ccccc3)nn2)c1 ZINC000524594027 1044882845 /nfs/dbraw/zinc/88/28/45/1044882845.db2.gz BHKDRZXVQCGMMP-QGZVFWFLSA-N 1 2 320.440 4.077 20 0 DIADLO O=C(Nc1cccc2ccsc21)c1ccc(-n2cc[nH+]c2)cc1 ZINC000337428520 1044898140 /nfs/dbraw/zinc/89/81/40/1044898140.db2.gz AEPQEUHLXFEAQE-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO Cc1cnc(C[NH+]2CCC(Oc3ccc(C(C)C)cc3)CC2)o1 ZINC000524759307 1044917467 /nfs/dbraw/zinc/91/74/67/1044917467.db2.gz LKBMAWXPUGVXDV-UHFFFAOYSA-N 1 2 314.429 4.150 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccc(-c3csc(C)n3)cc2)no1 ZINC000573767003 1044922660 /nfs/dbraw/zinc/92/26/60/1044922660.db2.gz RYEKDHIAGRUHLB-LBPRGKRZSA-N 1 2 313.426 4.266 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)n1 ZINC000573893221 1044932640 /nfs/dbraw/zinc/93/26/40/1044932640.db2.gz OHTSVLAMDATUKQ-RFAUZJTJSA-N 1 2 323.799 4.226 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cccnc1Cl ZINC000133505249 1044938545 /nfs/dbraw/zinc/93/85/45/1044938545.db2.gz WNTHFRARXOEVSZ-SNVBAGLBSA-N 1 2 309.866 4.340 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c2ccccn21 ZINC000574331065 1044949474 /nfs/dbraw/zinc/94/94/74/1044949474.db2.gz GANFXUJVIPUNHX-GOSISDBHSA-N 1 2 320.440 4.190 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCC[C@@H]2c2ccncc2)c2ccccn21 ZINC000574331065 1044949486 /nfs/dbraw/zinc/94/94/86/1044949486.db2.gz GANFXUJVIPUNHX-GOSISDBHSA-N 1 2 320.440 4.190 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2nc(-c3ccccc3)c[nH]2)o1 ZINC000574361626 1044949872 /nfs/dbraw/zinc/94/98/72/1044949872.db2.gz QGOIJKRRUGMQGN-BBRMVZONSA-N 1 2 307.397 4.083 20 0 DIADLO COc1cccc2c(N[C@H](C)c3ccncc3F)c(C)c[nH+]c12 ZINC000337799388 1044950061 /nfs/dbraw/zinc/95/00/61/1044950061.db2.gz HKVQMJDYTCPEID-GFCCVEGCSA-N 1 2 311.360 4.259 20 0 DIADLO CC(C)CO[C@@H]1CCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000575011960 1044984398 /nfs/dbraw/zinc/98/43/98/1044984398.db2.gz WORSDNLGCNMHIZ-CYBMUJFWSA-N 1 2 304.821 4.140 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2ccccc2Cl)CCO1 ZINC000525122938 1044988782 /nfs/dbraw/zinc/98/87/82/1044988782.db2.gz RCESMQPSGPBCSR-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2ccccc2Cl)CCO1 ZINC000525122938 1044988793 /nfs/dbraw/zinc/98/87/93/1044988793.db2.gz RCESMQPSGPBCSR-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO C/C=C/c1ccc(NC(=O)[C@@H]2CCc3[nH+]c(C(C)C)[nH]c3C2)cc1 ZINC000575210094 1044991276 /nfs/dbraw/zinc/99/12/76/1044991276.db2.gz UZJOFRHYYPIJQW-MBVDDHJVSA-N 1 2 323.440 4.310 20 0 DIADLO CC=Cc1ccc(NC(=O)[C@@H]2CCc3[nH]c(C(C)C)[nH+]c3C2)cc1 ZINC000575210094 1044991289 /nfs/dbraw/zinc/99/12/89/1044991289.db2.gz UZJOFRHYYPIJQW-MBVDDHJVSA-N 1 2 323.440 4.310 20 0 DIADLO Cc1noc([C@H](C)[N@H+](C)Cc2ccc(-c3ccsc3)cc2)n1 ZINC000575426862 1045000872 /nfs/dbraw/zinc/00/08/72/1045000872.db2.gz BQMRTPWXQJABDE-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1noc([C@H](C)[N@@H+](C)Cc2ccc(-c3ccsc3)cc2)n1 ZINC000575426862 1045000882 /nfs/dbraw/zinc/00/08/82/1045000882.db2.gz BQMRTPWXQJABDE-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO FC1(F)CC[C@H](C[N@@H+]2CCO[C@H](c3ccccc3Cl)C2)C1 ZINC000575436168 1045001224 /nfs/dbraw/zinc/00/12/24/1045001224.db2.gz LFWPMYPDLLRUFQ-WFASDCNBSA-N 1 2 315.791 4.149 20 0 DIADLO FC1(F)CC[C@H](C[N@H+]2CCO[C@H](c3ccccc3Cl)C2)C1 ZINC000575436168 1045001230 /nfs/dbraw/zinc/00/12/30/1045001230.db2.gz LFWPMYPDLLRUFQ-WFASDCNBSA-N 1 2 315.791 4.149 20 0 DIADLO Fc1cc(-c2ncco2)ccc1C[N@H+](Cc1ccncc1)C1CC1 ZINC000411412914 1045006675 /nfs/dbraw/zinc/00/66/75/1045006675.db2.gz GCXLRVCSUBJMFE-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1cc(-c2ncco2)ccc1C[N@@H+](Cc1ccncc1)C1CC1 ZINC000411412914 1045006690 /nfs/dbraw/zinc/00/66/90/1045006690.db2.gz GCXLRVCSUBJMFE-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Clc1cccc(-c2ccc(C[NH2+]Cc3cc[nH]n3)o2)c1Cl ZINC000525182727 1045008144 /nfs/dbraw/zinc/00/81/44/1045008144.db2.gz VOMPLTDRWLKHLN-UHFFFAOYSA-N 1 2 322.195 4.266 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@@H]2CCC[C@@H](C)C2)no1)c1ccccc1 ZINC000575834973 1045011562 /nfs/dbraw/zinc/01/15/62/1045011562.db2.gz KOTDUKPPULVBKH-DJIMGWMZSA-N 1 2 313.445 4.404 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@@H]2CCC[C@@H](C)C2)no1)c1ccccc1 ZINC000575834973 1045011573 /nfs/dbraw/zinc/01/15/73/1045011573.db2.gz KOTDUKPPULVBKH-DJIMGWMZSA-N 1 2 313.445 4.404 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+][C@@H](COCC(C)C)c1ccco1 ZINC000152583674 1045043031 /nfs/dbraw/zinc/04/30/31/1045043031.db2.gz YDWMGLHDDNXXNU-RDJZCZTQSA-N 1 2 317.429 4.353 20 0 DIADLO CC[N@H+](Cc1occc1C)[C@H](C)c1nc(-c2cccs2)no1 ZINC000412025513 1045047628 /nfs/dbraw/zinc/04/76/28/1045047628.db2.gz IXUNPMNVYSILNW-GFCCVEGCSA-N 1 2 317.414 4.283 20 0 DIADLO CC[N@@H+](Cc1occc1C)[C@H](C)c1nc(-c2cccs2)no1 ZINC000412025513 1045047635 /nfs/dbraw/zinc/04/76/35/1045047635.db2.gz IXUNPMNVYSILNW-GFCCVEGCSA-N 1 2 317.414 4.283 20 0 DIADLO CC[N@H+](Cc1occc1C)Cc1ccc(-c2ncco2)cc1F ZINC000412031380 1045049375 /nfs/dbraw/zinc/04/93/75/1045049375.db2.gz XUDMKZSAOSMMKM-UHFFFAOYSA-N 1 2 314.360 4.404 20 0 DIADLO CC[N@@H+](Cc1occc1C)Cc1ccc(-c2ncco2)cc1F ZINC000412031380 1045049384 /nfs/dbraw/zinc/04/93/84/1045049384.db2.gz XUDMKZSAOSMMKM-UHFFFAOYSA-N 1 2 314.360 4.404 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](c2cnn(C)c2)c2ccccc2)oc1C ZINC000374346088 1045050818 /nfs/dbraw/zinc/05/08/18/1045050818.db2.gz PRZDEWWDVLXWTJ-LIRRHRJNSA-N 1 2 309.413 4.070 20 0 DIADLO CC[N@@H+](Cc1cc(-c2cccs2)on1)Cc1occc1C ZINC000412048275 1045050853 /nfs/dbraw/zinc/05/08/53/1045050853.db2.gz WKUVRGHVQSGZSM-UHFFFAOYSA-N 1 2 302.399 4.327 20 0 DIADLO CC[N@H+](Cc1cc(-c2cccs2)on1)Cc1occc1C ZINC000412048275 1045050870 /nfs/dbraw/zinc/05/08/70/1045050870.db2.gz WKUVRGHVQSGZSM-UHFFFAOYSA-N 1 2 302.399 4.327 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2nc(C)c(C)s2)cc1Cl ZINC000412049053 1045053155 /nfs/dbraw/zinc/05/31/55/1045053155.db2.gz XPVCXQQROKKEQW-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2nc(C)c(C)s2)cc1Cl ZINC000412049053 1045053166 /nfs/dbraw/zinc/05/31/66/1045053166.db2.gz XPVCXQQROKKEQW-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000374507153 1045064074 /nfs/dbraw/zinc/06/40/74/1045064074.db2.gz QPQMAOTYSULUEF-CYBMUJFWSA-N 1 2 315.383 4.019 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000374507153 1045064083 /nfs/dbraw/zinc/06/40/83/1045064083.db2.gz QPQMAOTYSULUEF-CYBMUJFWSA-N 1 2 315.383 4.019 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cs1 ZINC000374529746 1045066036 /nfs/dbraw/zinc/06/60/36/1045066036.db2.gz KAFOPVYDMGGLBB-GFCCVEGCSA-N 1 2 304.381 4.006 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cs1 ZINC000374529746 1045066027 /nfs/dbraw/zinc/06/60/27/1045066027.db2.gz KAFOPVYDMGGLBB-GFCCVEGCSA-N 1 2 304.381 4.006 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@@H+](Cc2ncc(C3CC3)o2)CC12CCC2 ZINC000374553483 1045069811 /nfs/dbraw/zinc/06/98/11/1045069811.db2.gz ZSHHMXIVAIEBQC-CYBMUJFWSA-N 1 2 314.351 4.107 20 0 DIADLO FC(F)(F)[C@@H]1CC[N@H+](Cc2ncc(C3CC3)o2)CC12CCC2 ZINC000374553483 1045069797 /nfs/dbraw/zinc/06/97/97/1045069797.db2.gz ZSHHMXIVAIEBQC-CYBMUJFWSA-N 1 2 314.351 4.107 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@H](C)c2ccccc2Br)C[C@@H](C)O1 ZINC000600702762 1045130541 /nfs/dbraw/zinc/13/05/41/1045130541.db2.gz ZURCNFHFAFFJNE-JHJVBQTASA-N 1 2 312.251 4.009 20 0 DIADLO CC[C@@H]1C[N@H+]([C@H](C)c2ccccc2Br)C[C@@H](C)O1 ZINC000600702762 1045130545 /nfs/dbraw/zinc/13/05/45/1045130545.db2.gz ZURCNFHFAFFJNE-JHJVBQTASA-N 1 2 312.251 4.009 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cnc(C3CCC3)s2)c1 ZINC000446973961 1045082174 /nfs/dbraw/zinc/08/21/74/1045082174.db2.gz GRVTXEMKYAUJGH-UHFFFAOYSA-N 1 2 304.434 4.490 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cnc(C3CCC3)s2)c1 ZINC000446973961 1045082181 /nfs/dbraw/zinc/08/21/81/1045082181.db2.gz GRVTXEMKYAUJGH-UHFFFAOYSA-N 1 2 304.434 4.490 20 0 DIADLO C=Cn1cc(C[NH2+]C2(c3c(Cl)cccc3Cl)CCC2)cn1 ZINC000447067073 1045092095 /nfs/dbraw/zinc/09/20/95/1045092095.db2.gz MLEHEPMWRVQKTL-UHFFFAOYSA-N 1 2 322.239 4.459 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000428469349 1045100202 /nfs/dbraw/zinc/10/02/02/1045100202.db2.gz JKMGVDFNSTWNEY-RDTXWAMCSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000428469349 1045100209 /nfs/dbraw/zinc/10/02/09/1045100209.db2.gz JKMGVDFNSTWNEY-RDTXWAMCSA-N 1 2 314.429 4.068 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)cc2OC)[nH]1 ZINC000577129238 1045102891 /nfs/dbraw/zinc/10/28/91/1045102891.db2.gz BXTQUPUJJWJGAL-MELADBBJSA-N 1 2 316.449 4.047 20 0 DIADLO Cc1ccccc1OCCCOc1cccc(-n2cc[nH+]c2)c1 ZINC000525641300 1045103739 /nfs/dbraw/zinc/10/37/39/1045103739.db2.gz JGGSMZHROULHAO-UHFFFAOYSA-N 1 2 308.381 4.029 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1coc(-c2cccs2)n1 ZINC000525638609 1045103857 /nfs/dbraw/zinc/10/38/57/1045103857.db2.gz UGOWDNKVNWGOGS-CYBMUJFWSA-N 1 2 310.422 4.350 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1coc(-c2cccs2)n1 ZINC000525638609 1045103859 /nfs/dbraw/zinc/10/38/59/1045103859.db2.gz UGOWDNKVNWGOGS-CYBMUJFWSA-N 1 2 310.422 4.350 20 0 DIADLO CCCC[C@@H](CC)C(=O)Nc1nc(C[NH+](CC)CC)cs1 ZINC000890223584 1045104997 /nfs/dbraw/zinc/10/49/97/1045104997.db2.gz LFSOEAGMRXQQTC-CYBMUJFWSA-N 1 2 311.495 4.140 20 0 DIADLO Clc1cccc2c(N3CCC([C@H]4CCCO4)CC3)cc[nH+]c12 ZINC000577237838 1045108954 /nfs/dbraw/zinc/10/89/54/1045108954.db2.gz HNGOUTQEBCNHHC-QGZVFWFLSA-N 1 2 316.832 4.284 20 0 DIADLO Clc1cccc2c(N3CCC([C@@H]4CCCO4)CC3)cc[nH+]c12 ZINC000577237837 1045109594 /nfs/dbraw/zinc/10/95/94/1045109594.db2.gz HNGOUTQEBCNHHC-KRWDZBQOSA-N 1 2 316.832 4.284 20 0 DIADLO FCC1CCN(c2[nH+]ccc3cc(Br)ccc32)CC1 ZINC000413314675 1045130324 /nfs/dbraw/zinc/13/03/24/1045130324.db2.gz MYOJEQBMTZSANM-UHFFFAOYSA-N 1 2 323.209 4.183 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1ccns1)c1nc(C(F)(F)F)cs1 ZINC000925196365 1045135143 /nfs/dbraw/zinc/13/51/43/1045135143.db2.gz ZPARSESGNQGMJE-YUMQZZPRSA-N 1 2 321.393 4.420 20 0 DIADLO CCc1cccc(Cn2nc(C(F)(F)F)c3c[nH+]ccc32)c1 ZINC000468398926 1045138003 /nfs/dbraw/zinc/13/80/03/1045138003.db2.gz ZLTDFBPDWLJMDG-UHFFFAOYSA-N 1 2 305.303 4.061 20 0 DIADLO Cc1cc(F)ccc1-c1noc([C@H](CC(C)C)n2cc[nH+]c2)n1 ZINC000923881355 1045144287 /nfs/dbraw/zinc/14/42/87/1045144287.db2.gz MSLRUCBGYBIXDM-HNNXBMFYSA-N 1 2 314.364 4.016 20 0 DIADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1nccn1C ZINC000447567070 1045151720 /nfs/dbraw/zinc/15/17/20/1045151720.db2.gz YVWQNPRATOPGDS-GXTWGEPZSA-N 1 2 311.351 4.073 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3F)C2)s1 ZINC000577689040 1045156481 /nfs/dbraw/zinc/15/64/81/1045156481.db2.gz NYPWPOVAQKXXFL-KRWDZBQOSA-N 1 2 323.408 4.162 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@H](c3ccc(F)cc3F)C2)s1 ZINC000577689040 1045156485 /nfs/dbraw/zinc/15/64/85/1045156485.db2.gz NYPWPOVAQKXXFL-KRWDZBQOSA-N 1 2 323.408 4.162 20 0 DIADLO C=Cn1cc(C[NH+]2Cc3ccccc3-c3ccccc3C2)cn1 ZINC000447735656 1045172795 /nfs/dbraw/zinc/17/27/95/1045172795.db2.gz GGNUCKVGXFIWAC-UHFFFAOYSA-N 1 2 301.393 4.166 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cnc(C(F)(F)F)s2)s1 ZINC000447735051 1045173307 /nfs/dbraw/zinc/17/33/07/1045173307.db2.gz BEOCCGBBKRRGFD-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cnc(C(F)(F)F)s2)s1 ZINC000447735051 1045173309 /nfs/dbraw/zinc/17/33/09/1045173309.db2.gz BEOCCGBBKRRGFD-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO CCc1nn(-c2ccccc2)c(CC)c1CNc1cccc[nH+]1 ZINC000447806561 1045180772 /nfs/dbraw/zinc/18/07/72/1045180772.db2.gz NIJCKEBIVFGFFP-UHFFFAOYSA-N 1 2 306.413 4.004 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000447850121 1045182563 /nfs/dbraw/zinc/18/25/63/1045182563.db2.gz LKDJXNGPZZFVIN-RHSMWYFYSA-N 1 2 314.429 4.150 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000447850121 1045182569 /nfs/dbraw/zinc/18/25/69/1045182569.db2.gz LKDJXNGPZZFVIN-RHSMWYFYSA-N 1 2 314.429 4.150 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2c1nccc2Cl)c1c(F)cccc1F ZINC000924723189 1045195450 /nfs/dbraw/zinc/19/54/50/1045195450.db2.gz ZIKAODJQFWXGNQ-LKFCYVNXSA-N 1 2 308.759 4.351 20 0 DIADLO Cc1cncc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3n2C)c1 ZINC000527191289 1045199882 /nfs/dbraw/zinc/19/98/82/1045199882.db2.gz ZSPNMCDSRLMXLN-LJQANCHMSA-N 1 2 320.440 4.004 20 0 DIADLO Cc1cncc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3n2C)c1 ZINC000527191289 1045199886 /nfs/dbraw/zinc/19/98/86/1045199886.db2.gz ZSPNMCDSRLMXLN-LJQANCHMSA-N 1 2 320.440 4.004 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@H]1CCSc2ccc(F)cc21 ZINC000924808378 1045200080 /nfs/dbraw/zinc/20/00/80/1045200080.db2.gz BNICEVBDTNCDII-UONOGXRCSA-N 1 2 318.417 4.326 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(Cl)c1Cl)c1cn2c(n1)CCCC2 ZINC000924858406 1045205428 /nfs/dbraw/zinc/20/54/28/1045205428.db2.gz MVWYPEVMPDMCPA-LLVKDONJSA-N 1 2 324.255 4.377 20 0 DIADLO C[C@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)C[C@H](C2CC2)O1 ZINC000527239218 1045206110 /nfs/dbraw/zinc/20/61/10/1045206110.db2.gz VGZJINVDUTVURM-SUMWQHHRSA-N 1 2 320.502 4.190 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)C[C@H](C2CC2)O1 ZINC000527239218 1045206119 /nfs/dbraw/zinc/20/61/19/1045206119.db2.gz VGZJINVDUTVURM-SUMWQHHRSA-N 1 2 320.502 4.190 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cc(O)cc(F)c1 ZINC000924970826 1045214909 /nfs/dbraw/zinc/21/49/09/1045214909.db2.gz UMNXDUBFEBIAKW-SNVBAGLBSA-N 1 2 308.422 4.136 20 0 DIADLO Cc1cc(CNC(=O)N[C@H](C)c2cccc(C3CC3)c2)cc(C)[nH+]1 ZINC000557652058 1045215875 /nfs/dbraw/zinc/21/58/75/1045215875.db2.gz WBXKVIVPMGAFJK-OAHLLOKOSA-N 1 2 323.440 4.136 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ncc(C(C)(C)C)s2)cc1 ZINC000448220622 1045221609 /nfs/dbraw/zinc/22/16/09/1045221609.db2.gz QUKIKXJQVFBSCA-UHFFFAOYSA-N 1 2 318.486 4.471 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ncc(C(C)(C)C)s2)cc1 ZINC000448220622 1045221616 /nfs/dbraw/zinc/22/16/16/1045221616.db2.gz QUKIKXJQVFBSCA-UHFFFAOYSA-N 1 2 318.486 4.471 20 0 DIADLO CC1(C)C[N@H+](Cc2cscc2C(F)(F)F)[C@H]1[C@@H]1CCCO1 ZINC000578288035 1045228794 /nfs/dbraw/zinc/22/87/94/1045228794.db2.gz HOJISHKJVXSMOE-STQMWFEESA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2cscc2C(F)(F)F)[C@H]1[C@@H]1CCCO1 ZINC000578288035 1045228798 /nfs/dbraw/zinc/22/87/98/1045228798.db2.gz HOJISHKJVXSMOE-STQMWFEESA-N 1 2 319.392 4.156 20 0 DIADLO CCc1cc(C[NH2+][C@H](Cc2ccccc2C)c2ccco2)on1 ZINC000925127869 1045229938 /nfs/dbraw/zinc/22/99/38/1045229938.db2.gz IKPPVLMGDIJLJR-GOSISDBHSA-N 1 2 310.397 4.212 20 0 DIADLO CCc1cc(C[NH2+][C@H](c2ccc(CC)cc2)c2cccnc2)on1 ZINC000925129596 1045229819 /nfs/dbraw/zinc/22/98/19/1045229819.db2.gz PULXJFFFCWCQSJ-HXUWFJFHSA-N 1 2 321.424 4.074 20 0 DIADLO CCc1cnc(C[NH2+][C@H](c2ccc(C)cc2)c2cccnc2)s1 ZINC000925161513 1045231588 /nfs/dbraw/zinc/23/15/88/1045231588.db2.gz ASELATMNNIMPDI-LJQANCHMSA-N 1 2 323.465 4.288 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2ncc(C(C)(C)C)s2)C1 ZINC000448336301 1045234800 /nfs/dbraw/zinc/23/48/00/1045234800.db2.gz BPQDQBSADWNAHS-DZGCQCFKSA-N 1 2 315.486 4.419 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ncc(C(C)(C)C)s2)C1 ZINC000448336301 1045234808 /nfs/dbraw/zinc/23/48/08/1045234808.db2.gz BPQDQBSADWNAHS-DZGCQCFKSA-N 1 2 315.486 4.419 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CC[C@](F)(c4ccccc4)C3)oc2c1 ZINC000578455217 1045243357 /nfs/dbraw/zinc/24/33/57/1045243357.db2.gz XMFQNGVPVQZPIN-GOSISDBHSA-N 1 2 314.335 4.038 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CC[C@](F)(c4ccccc4)C3)oc2c1 ZINC000578455217 1045243369 /nfs/dbraw/zinc/24/33/69/1045243369.db2.gz XMFQNGVPVQZPIN-GOSISDBHSA-N 1 2 314.335 4.038 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3cccc(C4CCOCC4)c3)n2c1 ZINC000527798964 1045265506 /nfs/dbraw/zinc/26/55/06/1045265506.db2.gz UZLYKSVFPBPFLO-UHFFFAOYSA-N 1 2 321.424 4.149 20 0 DIADLO Cc1nsc(C)c1C[N@@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000578717549 1045267308 /nfs/dbraw/zinc/26/73/08/1045267308.db2.gz XRWHNCVCUBEFQY-IBGZPJMESA-N 1 2 323.465 4.167 20 0 DIADLO Cc1nsc(C)c1C[N@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC000578717549 1045267317 /nfs/dbraw/zinc/26/73/17/1045267317.db2.gz XRWHNCVCUBEFQY-IBGZPJMESA-N 1 2 323.465 4.167 20 0 DIADLO CO[C@H](C)c1nc(CSCCc2[nH+]cc(C)cc2C)cs1 ZINC000578748975 1045269394 /nfs/dbraw/zinc/26/93/94/1045269394.db2.gz KNYLWUFPMSUJHZ-CYBMUJFWSA-N 1 2 322.499 4.338 20 0 DIADLO C[C@H]1CN(c2[nH+]ccc3ccccc32)C[C@@H](c2ccccc2)O1 ZINC000527865864 1045270424 /nfs/dbraw/zinc/27/04/24/1045270424.db2.gz VNDWAHMDZFYNAT-KXBFYZLASA-N 1 2 304.393 4.201 20 0 DIADLO CCCCCC[C@@](C)(CCC)C(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000779096517 1045272923 /nfs/dbraw/zinc/27/29/23/1045272923.db2.gz QUMXJMCRTGEJGT-QFBILLFUSA-N 1 2 319.493 4.091 20 0 DIADLO CCCCCC[C@](C)(CCC)C(=O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000779096512 1045273079 /nfs/dbraw/zinc/27/30/79/1045273079.db2.gz QUMXJMCRTGEJGT-LPHOPBHVSA-N 1 2 319.493 4.091 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cncc(F)c1)c1cc(-c2ccccc2)n(C)n1 ZINC000527906858 1045279760 /nfs/dbraw/zinc/27/97/60/1045279760.db2.gz APHIKKNIXFPQEH-UONOGXRCSA-N 1 2 324.403 4.033 20 0 DIADLO CC(C)Cc1ccccc1C[NH2+][C@H](c1ncc[nH]1)c1ccccc1 ZINC000527916710 1045282458 /nfs/dbraw/zinc/28/24/58/1045282458.db2.gz BSYLQUDHYSFDSO-FQEVSTJZSA-N 1 2 319.452 4.487 20 0 DIADLO C[C@H]1CN(c2[nH+]ccc3ccccc32)C[C@H](c2ccsc2)O1 ZINC000527931568 1045285834 /nfs/dbraw/zinc/28/58/34/1045285834.db2.gz SYQMFHLVMXVJQO-SUMWQHHRSA-N 1 2 310.422 4.263 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3ccc(F)cc3C2)cc1Cl ZINC001138474320 1045304265 /nfs/dbraw/zinc/30/42/65/1045304265.db2.gz CGUWTWJVRGDNRL-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(C[N@H+]2CCc3ccc(F)cc3C2)cc1Cl ZINC001138474320 1045304270 /nfs/dbraw/zinc/30/42/70/1045304270.db2.gz CGUWTWJVRGDNRL-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CC(C)n1ccc(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)n1 ZINC000579282393 1045304592 /nfs/dbraw/zinc/30/45/92/1045304592.db2.gz HBCNHOVNKDCMIZ-UHFFFAOYSA-N 1 2 323.362 4.262 20 0 DIADLO C[C@H]1CCC[C@@H](c2noc(-c3ccc(Cn4cc[nH+]c4)cc3)n2)C1 ZINC000579299353 1045306904 /nfs/dbraw/zinc/30/69/04/1045306904.db2.gz TZYASWIFLVKPNR-WMLDXEAASA-N 1 2 322.412 4.275 20 0 DIADLO CC(C)c1ccccc1NC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117564244 1045306996 /nfs/dbraw/zinc/30/69/96/1045306996.db2.gz DAOKLGKCONMIGE-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO O=C(CCC1CCC1)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000579506096 1045318817 /nfs/dbraw/zinc/31/88/17/1045318817.db2.gz KUMSUMPRZFPPFC-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO O=C(c1cccc(-n2cc[nH+]c2)c1)N1CCCC2(CCCCC2)C1 ZINC000117800601 1045320512 /nfs/dbraw/zinc/32/05/12/1045320512.db2.gz IMMGGVNSVKYUTA-UHFFFAOYSA-N 1 2 323.440 4.059 20 0 DIADLO Clc1ccc(C[NH2+][C@H](c2ccccc2)c2ccncc2)nc1 ZINC000779149278 1045323012 /nfs/dbraw/zinc/32/30/12/1045323012.db2.gz FERWDYKNUPPGNH-GOSISDBHSA-N 1 2 309.800 4.009 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2nnc(C(C)(C)C)o2)C1 ZINC000075843129 1045340291 /nfs/dbraw/zinc/34/02/91/1045340291.db2.gz PHDRYHWKXAJCKR-SWLSCSKDSA-N 1 2 317.408 4.089 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2nnc(C(C)(C)C)o2)C1 ZINC000075843129 1045340295 /nfs/dbraw/zinc/34/02/95/1045340295.db2.gz PHDRYHWKXAJCKR-SWLSCSKDSA-N 1 2 317.408 4.089 20 0 DIADLO C[C@H]1c2cc(F)cc(F)c2CC[N@H+]1Cc1cc2cccnc2o1 ZINC000449052266 1045340926 /nfs/dbraw/zinc/34/09/26/1045340926.db2.gz YXEGTRISBIBFAJ-NSHDSACASA-N 1 2 314.335 4.225 20 0 DIADLO C[C@H]1c2cc(F)cc(F)c2CC[N@@H+]1Cc1cc2cccnc2o1 ZINC000449052266 1045340928 /nfs/dbraw/zinc/34/09/28/1045340928.db2.gz YXEGTRISBIBFAJ-NSHDSACASA-N 1 2 314.335 4.225 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccc(F)nc1 ZINC000189286893 1045344715 /nfs/dbraw/zinc/34/47/15/1045344715.db2.gz XGXZAEUGASJXQG-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccc(F)nc1 ZINC000189286893 1045344718 /nfs/dbraw/zinc/34/47/18/1045344718.db2.gz XGXZAEUGASJXQG-NSHDSACASA-N 1 2 301.390 4.023 20 0 DIADLO Cc1ccc2sc(C[N@H+](Cc3ccccn3)C(C)C)nc2c1 ZINC000528357177 1045345519 /nfs/dbraw/zinc/34/55/19/1045345519.db2.gz UYZOJIWWMNABAO-UHFFFAOYSA-N 1 2 311.454 4.410 20 0 DIADLO Cc1ccc2sc(C[N@@H+](Cc3ccccn3)C(C)C)nc2c1 ZINC000528357177 1045345522 /nfs/dbraw/zinc/34/55/22/1045345522.db2.gz UYZOJIWWMNABAO-UHFFFAOYSA-N 1 2 311.454 4.410 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ccc(F)nc2)Cc2ccccn2)c1 ZINC000189329009 1045345725 /nfs/dbraw/zinc/34/57/25/1045345725.db2.gz XONUAFDMOSZGOI-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ccc(F)nc2)Cc2ccccn2)c1 ZINC000189329009 1045345729 /nfs/dbraw/zinc/34/57/29/1045345729.db2.gz XONUAFDMOSZGOI-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO CC[C@@H]([NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21)c1nccs1 ZINC000449159813 1045355324 /nfs/dbraw/zinc/35/53/24/1045355324.db2.gz IWVCHDWOXAEHFK-GHMZBOCLSA-N 1 2 312.360 4.289 20 0 DIADLO Cc1cccc2nc(C[NH2+]Cc3ccccc3OCC(C)C)[nH]c21 ZINC000449203909 1045359898 /nfs/dbraw/zinc/35/98/98/1045359898.db2.gz ISASVXRLNUCWKW-UHFFFAOYSA-N 1 2 323.440 4.196 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2nc3cc(C)ccc3s2)n1 ZINC000528449758 1045362138 /nfs/dbraw/zinc/36/21/38/1045362138.db2.gz PXZGNDUNICNKGV-LLVKDONJSA-N 1 2 303.456 4.220 20 0 DIADLO c1coc([C@@H]([NH2+]Cc2ccnn2C2CCCC2)c2ccccc2)c1 ZINC000449222918 1045364851 /nfs/dbraw/zinc/36/48/51/1045364851.db2.gz WZROYDXKDCFJCI-FQEVSTJZSA-N 1 2 321.424 4.470 20 0 DIADLO CCC[C@@]1(CO)CC[N@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449328793 1045375310 /nfs/dbraw/zinc/37/53/10/1045375310.db2.gz LJENSJJDARFSEA-CYBMUJFWSA-N 1 2 308.274 4.039 20 0 DIADLO CCC[C@@]1(CO)CC[N@@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449328793 1045375314 /nfs/dbraw/zinc/37/53/14/1045375314.db2.gz LJENSJJDARFSEA-CYBMUJFWSA-N 1 2 308.274 4.039 20 0 DIADLO CCC[C@]1(CO)CC[N@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449328794 1045375837 /nfs/dbraw/zinc/37/58/37/1045375837.db2.gz LJENSJJDARFSEA-ZDUSSCGKSA-N 1 2 308.274 4.039 20 0 DIADLO CCC[C@]1(CO)CC[N@@H+](Cc2cc(Cl)sc2Cl)C1 ZINC000449328794 1045375844 /nfs/dbraw/zinc/37/58/44/1045375844.db2.gz LJENSJJDARFSEA-ZDUSSCGKSA-N 1 2 308.274 4.039 20 0 DIADLO Fc1ccc(C2CC2)cc1C[NH2+]Cc1ccn(-c2ccccc2)n1 ZINC000449372685 1045383415 /nfs/dbraw/zinc/38/34/15/1045383415.db2.gz KSFZFPYNGUINOT-UHFFFAOYSA-N 1 2 321.399 4.179 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@@H+]1CCc2nc(C(C)(C)C)ncc2C1 ZINC000528589870 1045385692 /nfs/dbraw/zinc/38/56/92/1045385692.db2.gz AZOQPIUWXGYDLW-ZDUSSCGKSA-N 1 2 313.420 4.033 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@H+]1CCc2nc(C(C)(C)C)ncc2C1 ZINC000528589870 1045385698 /nfs/dbraw/zinc/38/56/98/1045385698.db2.gz AZOQPIUWXGYDLW-ZDUSSCGKSA-N 1 2 313.420 4.033 20 0 DIADLO Cc1ccccc1CC[N@@H+](C)Cc1ncc(C(F)(F)F)s1 ZINC000449379089 1045387345 /nfs/dbraw/zinc/38/73/45/1045387345.db2.gz GSTZAVXQSRCMBJ-UHFFFAOYSA-N 1 2 314.376 4.145 20 0 DIADLO Cc1ccccc1CC[N@H+](C)Cc1ncc(C(F)(F)F)s1 ZINC000449379089 1045387351 /nfs/dbraw/zinc/38/73/51/1045387351.db2.gz GSTZAVXQSRCMBJ-UHFFFAOYSA-N 1 2 314.376 4.145 20 0 DIADLO C[C@H](C[N@@H+]1CC(C)(C)[C@H]1c1nccn1C)c1cccc(Cl)c1 ZINC000449414158 1045388134 /nfs/dbraw/zinc/38/81/34/1045388134.db2.gz LJOVMVDPULYWFS-CZUORRHYSA-N 1 2 317.864 4.260 20 0 DIADLO C[C@H](C[N@H+]1CC(C)(C)[C@H]1c1nccn1C)c1cccc(Cl)c1 ZINC000449414158 1045388138 /nfs/dbraw/zinc/38/81/38/1045388138.db2.gz LJOVMVDPULYWFS-CZUORRHYSA-N 1 2 317.864 4.260 20 0 DIADLO C[C@@H](C[N@@H+]1CC(C)(C)[C@@H]1c1nccn1C)c1cccc(Cl)c1 ZINC000449414154 1045388305 /nfs/dbraw/zinc/38/83/05/1045388305.db2.gz LJOVMVDPULYWFS-BBRMVZONSA-N 1 2 317.864 4.260 20 0 DIADLO C[C@@H](C[N@H+]1CC(C)(C)[C@@H]1c1nccn1C)c1cccc(Cl)c1 ZINC000449414154 1045388311 /nfs/dbraw/zinc/38/83/11/1045388311.db2.gz LJOVMVDPULYWFS-BBRMVZONSA-N 1 2 317.864 4.260 20 0 DIADLO Cn1ccnc1[C@@H]1[N@H+](Cc2csc3ccccc23)CC1(C)C ZINC000449413574 1045388376 /nfs/dbraw/zinc/38/83/76/1045388376.db2.gz JIIUDKPIUBJZBY-INIZCTEOSA-N 1 2 311.454 4.218 20 0 DIADLO Cn1ccnc1[C@@H]1[N@@H+](Cc2csc3ccccc23)CC1(C)C ZINC000449413574 1045388382 /nfs/dbraw/zinc/38/83/82/1045388382.db2.gz JIIUDKPIUBJZBY-INIZCTEOSA-N 1 2 311.454 4.218 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2csc(C3CC3)n2)c2ccccc2O1 ZINC000449422038 1045393892 /nfs/dbraw/zinc/39/38/92/1045393892.db2.gz CBMGLKGIJKIZHZ-IAQYHMDHSA-N 1 2 300.427 4.022 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000449456535 1045395441 /nfs/dbraw/zinc/39/54/41/1045395441.db2.gz CZVMJWLKQAVGGP-TZMCWYRMSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000449456535 1045395443 /nfs/dbraw/zinc/39/54/43/1045395443.db2.gz CZVMJWLKQAVGGP-TZMCWYRMSA-N 1 2 323.362 4.240 20 0 DIADLO CC[C@H](C)[N@H+](C)Cc1csc(N(C(C)=O)c2ccccc2)n1 ZINC000119240573 1045411281 /nfs/dbraw/zinc/41/12/81/1045411281.db2.gz MVIZCLVOMGFPSP-ZDUSSCGKSA-N 1 2 317.458 4.058 20 0 DIADLO CC[C@H](C)[N@@H+](C)Cc1csc(N(C(C)=O)c2ccccc2)n1 ZINC000119240573 1045411284 /nfs/dbraw/zinc/41/12/84/1045411284.db2.gz MVIZCLVOMGFPSP-ZDUSSCGKSA-N 1 2 317.458 4.058 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1cscc1Br ZINC000528766090 1045411822 /nfs/dbraw/zinc/41/18/22/1045411822.db2.gz COCBAFAIDKFZIJ-MRVPVSSYSA-N 1 2 310.207 4.130 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1cscc1Br ZINC000528766090 1045411825 /nfs/dbraw/zinc/41/18/25/1045411825.db2.gz COCBAFAIDKFZIJ-MRVPVSSYSA-N 1 2 310.207 4.130 20 0 DIADLO Cc1ccc(-c2ccc(C[NH2+][C@H]3C[C@H](C)n4ccnc43)o2)cc1 ZINC000449575298 1045415530 /nfs/dbraw/zinc/41/55/30/1045415530.db2.gz XPUHGSQBNOBIPY-YOEHRIQHSA-N 1 2 307.397 4.247 20 0 DIADLO Clc1cc(C[NH2+]Cc2cnc(C3CC3)o2)c(Cl)s1 ZINC000449707251 1045429261 /nfs/dbraw/zinc/42/92/61/1045429261.db2.gz QFKQIHUZDGZWOD-UHFFFAOYSA-N 1 2 303.214 4.210 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000528792467 1045415945 /nfs/dbraw/zinc/41/59/45/1045415945.db2.gz DTXAOVIZJNXBMU-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000528792467 1045415950 /nfs/dbraw/zinc/41/59/50/1045415950.db2.gz DTXAOVIZJNXBMU-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO Cc1cnc(C[N@@H+]2CCCC[C@H]2c2ccc(Cl)cc2)cn1 ZINC000449570756 1045416111 /nfs/dbraw/zinc/41/61/11/1045416111.db2.gz KHXXXYIJSATNQQ-KRWDZBQOSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1cnc(C[N@H+]2CCCC[C@H]2c2ccc(Cl)cc2)cn1 ZINC000449570756 1045416116 /nfs/dbraw/zinc/41/61/16/1045416116.db2.gz KHXXXYIJSATNQQ-KRWDZBQOSA-N 1 2 301.821 4.166 20 0 DIADLO COc1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)cc1OC ZINC000449636845 1045424465 /nfs/dbraw/zinc/42/44/65/1045424465.db2.gz XGUROMCWRCFVLS-SFHVURJKSA-N 1 2 313.397 4.024 20 0 DIADLO COc1ccc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)cc1OC ZINC000449636845 1045424468 /nfs/dbraw/zinc/42/44/68/1045424468.db2.gz XGUROMCWRCFVLS-SFHVURJKSA-N 1 2 313.397 4.024 20 0 DIADLO CCn1nc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)c2ccccc21 ZINC000449638508 1045424824 /nfs/dbraw/zinc/42/48/24/1045424824.db2.gz KXLJMKMWHGIDJP-IBGZPJMESA-N 1 2 321.424 4.376 20 0 DIADLO CCn1nc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)c2ccccc21 ZINC000449638508 1045424827 /nfs/dbraw/zinc/42/48/27/1045424827.db2.gz KXLJMKMWHGIDJP-IBGZPJMESA-N 1 2 321.424 4.376 20 0 DIADLO Fc1ccccc1-c1ccc(C[NH2+]Cc2cnc(C3CC3)o2)o1 ZINC000449695978 1045427508 /nfs/dbraw/zinc/42/75/08/1045427508.db2.gz GSJYXOFTJDNLMM-UHFFFAOYSA-N 1 2 312.344 4.241 20 0 DIADLO CC(C)n1cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)cn1 ZINC000449730702 1045431030 /nfs/dbraw/zinc/43/10/30/1045431030.db2.gz GGKHHEFGQVOXPI-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO CC(C)n1cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)cn1 ZINC000449730702 1045431031 /nfs/dbraw/zinc/43/10/31/1045431031.db2.gz GGKHHEFGQVOXPI-KRWDZBQOSA-N 1 2 305.372 4.079 20 0 DIADLO Cc1ccc(Cl)cc1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000120229884 1045455556 /nfs/dbraw/zinc/45/55/56/1045455556.db2.gz XDTBCSINEVHFOL-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1cocc1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000529231743 1045462926 /nfs/dbraw/zinc/46/29/26/1045462926.db2.gz HJOCDQNMJADTCI-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](Cc2ccccc2)C(C)C)n1 ZINC000120414008 1045473077 /nfs/dbraw/zinc/47/30/77/1045473077.db2.gz DKFBFMUMPYXBDH-CQSZACIVSA-N 1 2 319.474 4.294 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](Cc2ccccc2)C(C)C)n1 ZINC000120414008 1045473079 /nfs/dbraw/zinc/47/30/79/1045473079.db2.gz DKFBFMUMPYXBDH-CQSZACIVSA-N 1 2 319.474 4.294 20 0 DIADLO CC(C)CCCC(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000450253592 1045478835 /nfs/dbraw/zinc/47/88/35/1045478835.db2.gz DXXTULUDIXWZEV-UHFFFAOYSA-N 1 2 323.440 4.367 20 0 DIADLO C[C@@H](c1csnn1)[N@H+]1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000450247241 1045480497 /nfs/dbraw/zinc/48/04/97/1045480497.db2.gz XMZUHLCOOOBCCF-KBXCAEBGSA-N 1 2 321.449 4.247 20 0 DIADLO C[C@@H](c1csnn1)[N@@H+]1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000450247241 1045480501 /nfs/dbraw/zinc/48/05/01/1045480501.db2.gz XMZUHLCOOOBCCF-KBXCAEBGSA-N 1 2 321.449 4.247 20 0 DIADLO CC[N@H+](Cc1cn(CC2CC2)nn1)[C@H](C)c1cc2ccccc2o1 ZINC000450289391 1045483254 /nfs/dbraw/zinc/48/32/54/1045483254.db2.gz VBBKVYOHOJKHSV-CQSZACIVSA-N 1 2 324.428 4.017 20 0 DIADLO CC[N@@H+](Cc1cn(CC2CC2)nn1)[C@H](C)c1cc2ccccc2o1 ZINC000450289391 1045483257 /nfs/dbraw/zinc/48/32/57/1045483257.db2.gz VBBKVYOHOJKHSV-CQSZACIVSA-N 1 2 324.428 4.017 20 0 DIADLO COC[C@@H]1CCCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C1 ZINC000450328361 1045487482 /nfs/dbraw/zinc/48/74/82/1045487482.db2.gz HJFVXOUQUFHIQB-GFCCVEGCSA-N 1 2 324.346 4.116 20 0 DIADLO CN(C[C@H]1CCCOC1)c1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000450326750 1045490556 /nfs/dbraw/zinc/49/05/56/1045490556.db2.gz ZMYZAHBZICKYDE-GFCCVEGCSA-N 1 2 324.346 4.116 20 0 DIADLO Fc1ccc(CNc2ccc(-c3[nH+]cc4n3CCCC4)cc2)nc1 ZINC000529535947 1045494020 /nfs/dbraw/zinc/49/40/20/1045494020.db2.gz YZFBAWSUJFXMKX-UHFFFAOYSA-N 1 2 322.387 4.033 20 0 DIADLO Fc1ccc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)nc1 ZINC000529556219 1045496790 /nfs/dbraw/zinc/49/67/90/1045496790.db2.gz RAMMKBCSNRNTIM-UHFFFAOYSA-N 1 2 322.387 4.033 20 0 DIADLO Brc1sccc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000529567014 1045497453 /nfs/dbraw/zinc/49/74/53/1045497453.db2.gz SJOMQDAPJCGJEP-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1sccc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000529567014 1045497454 /nfs/dbraw/zinc/49/74/54/1045497454.db2.gz SJOMQDAPJCGJEP-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO FC(F)(F)c1sccc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000529567934 1045498048 /nfs/dbraw/zinc/49/80/48/1045498048.db2.gz XREUCQNPNNMWRY-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1sccc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000529567934 1045498052 /nfs/dbraw/zinc/49/80/52/1045498052.db2.gz XREUCQNPNNMWRY-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO Cc1ccccc1C1CC[NH+](Cc2nnc(C(C)C)s2)CC1 ZINC000450391786 1045499978 /nfs/dbraw/zinc/49/99/78/1045499978.db2.gz RKNODKOVVCQQTF-UHFFFAOYSA-N 1 2 315.486 4.350 20 0 DIADLO Cc1cccc(NC(=O)[C@H](C)[N@H+](C)Cc2ccc(Cl)s2)c1 ZINC000016343327 1045501811 /nfs/dbraw/zinc/50/18/11/1045501811.db2.gz ASSMZZSURKIMII-LBPRGKRZSA-N 1 2 322.861 4.169 20 0 DIADLO Cc1cccc(NC(=O)[C@H](C)[N@@H+](C)Cc2ccc(Cl)s2)c1 ZINC000016343327 1045501819 /nfs/dbraw/zinc/50/18/19/1045501819.db2.gz ASSMZZSURKIMII-LBPRGKRZSA-N 1 2 322.861 4.169 20 0 DIADLO COC1(C)CCN(c2cc[nH+]c3cc(F)c(Cl)cc32)CC1 ZINC000450421921 1045503654 /nfs/dbraw/zinc/50/36/54/1045503654.db2.gz MDLFCZYGKNVKMF-UHFFFAOYSA-N 1 2 308.784 4.033 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CC[C@@H](C)[C@H]2c2cccc(F)c2)s1 ZINC000450455929 1045509642 /nfs/dbraw/zinc/50/96/42/1045509642.db2.gz RONPFUHNEZDIJB-WBMJQRKESA-N 1 2 319.449 4.384 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CC[C@@H](C)[C@H]2c2cccc(F)c2)s1 ZINC000450455929 1045509646 /nfs/dbraw/zinc/50/96/46/1045509646.db2.gz RONPFUHNEZDIJB-WBMJQRKESA-N 1 2 319.449 4.384 20 0 DIADLO CC(C)([NH2+]Cc1nnc(C2CC2)s1)c1ccc(Cl)cc1 ZINC000450561410 1045519308 /nfs/dbraw/zinc/51/93/08/1045519308.db2.gz ZUMMWSFVPGUAES-UHFFFAOYSA-N 1 2 307.850 4.094 20 0 DIADLO Clc1ccc(C2([NH2+]Cc3nnc(C4CC4)s3)CCC2)cc1 ZINC000450550357 1045522249 /nfs/dbraw/zinc/52/22/49/1045522249.db2.gz DECDQODEKOTOGM-UHFFFAOYSA-N 1 2 319.861 4.238 20 0 DIADLO CC[N@H+](Cc1nc(C)c[nH]1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000628139415 1045528547 /nfs/dbraw/zinc/52/85/47/1045528547.db2.gz FIWFIEJMLLRMJR-GFCCVEGCSA-N 1 2 311.351 4.320 20 0 DIADLO CC[N@@H+](Cc1nc(C)c[nH]1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000628139415 1045528557 /nfs/dbraw/zinc/52/85/57/1045528557.db2.gz FIWFIEJMLLRMJR-GFCCVEGCSA-N 1 2 311.351 4.320 20 0 DIADLO Cc1c[nH]c(C[N@H+](Cc2ccc(Cl)c(Cl)c2)C(C)C)n1 ZINC000628149839 1045531531 /nfs/dbraw/zinc/53/15/31/1045531531.db2.gz PPRNMUCWAFVQOB-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO Cc1c[nH]c(C[N@@H+](Cc2ccc(Cl)c(Cl)c2)C(C)C)n1 ZINC000628149839 1045531536 /nfs/dbraw/zinc/53/15/36/1045531536.db2.gz PPRNMUCWAFVQOB-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO Cc1nc(C[N@@H+](C)C2c3ccccc3-c3ccccc32)[nH]c1C ZINC000628184744 1045536205 /nfs/dbraw/zinc/53/62/05/1045536205.db2.gz WXMYHJMNOWBKCD-UHFFFAOYSA-N 1 2 303.409 4.228 20 0 DIADLO Cc1nc(C[N@H+](C)C2c3ccccc3-c3ccccc32)[nH]c1C ZINC000628184744 1045536218 /nfs/dbraw/zinc/53/62/18/1045536218.db2.gz WXMYHJMNOWBKCD-UHFFFAOYSA-N 1 2 303.409 4.228 20 0 DIADLO CC(C)Cc1ccc([C@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc1 ZINC000450653151 1045537093 /nfs/dbraw/zinc/53/70/93/1045537093.db2.gz SBBFZTCMSDVPNY-ZDUSSCGKSA-N 1 2 315.486 4.465 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)n1 ZINC000628183037 1045537176 /nfs/dbraw/zinc/53/71/76/1045537176.db2.gz OMVRLKDFXGDBAQ-LJQANCHMSA-N 1 2 303.409 4.018 20 0 DIADLO Cc1c[nH]c(C[N@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)n1 ZINC000628183037 1045537180 /nfs/dbraw/zinc/53/71/80/1045537180.db2.gz OMVRLKDFXGDBAQ-LJQANCHMSA-N 1 2 303.409 4.018 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C)c1csnn1 ZINC000450692575 1045546905 /nfs/dbraw/zinc/54/69/05/1045546905.db2.gz KWLDSRSHFYVHRJ-YJKIEOBBSA-N 1 2 307.850 4.239 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccc(F)cc1F ZINC000450674149 1045547015 /nfs/dbraw/zinc/54/70/15/1045547015.db2.gz AYLYBXDHNBFWNE-HNNXBMFYSA-N 1 2 323.412 4.181 20 0 DIADLO Cc1nc(C)c(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)o1 ZINC000628252928 1045556774 /nfs/dbraw/zinc/55/67/74/1045556774.db2.gz NKCHWQZKPJVKMR-UHFFFAOYSA-N 1 2 322.412 4.103 20 0 DIADLO CCO[C@H]1CCN(c2cc[nH+]c3cc(F)c(Cl)cc32)C[C@H]1C ZINC000450749156 1045557910 /nfs/dbraw/zinc/55/79/10/1045557910.db2.gz WZAQTELFEYUKIK-DIFFPNOSSA-N 1 2 322.811 4.279 20 0 DIADLO C[C@H]([NH2+]Cc1ccsc1C(F)(F)F)c1c(F)cncc1F ZINC000628275928 1045561035 /nfs/dbraw/zinc/56/10/35/1045561035.db2.gz KBYKNNPWYNNWCZ-ZETCQYMHSA-N 1 2 322.302 4.291 20 0 DIADLO FC1(F)CC[C@@H](C[N@@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)C1 ZINC000450752587 1045563953 /nfs/dbraw/zinc/56/39/53/1045563953.db2.gz GCALIIDBKDSKTR-IUODEOHRSA-N 1 2 315.791 4.149 20 0 DIADLO FC1(F)CC[C@@H](C[N@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)C1 ZINC000450752587 1045563966 /nfs/dbraw/zinc/56/39/66/1045563966.db2.gz GCALIIDBKDSKTR-IUODEOHRSA-N 1 2 315.791 4.149 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(C(F)(F)F)c2)[C@H]1[C@H]1CCCO1 ZINC000628284147 1045564879 /nfs/dbraw/zinc/56/48/79/1045564879.db2.gz BRNWUGWAVDVJMO-YPMHNXCESA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(C(F)(F)F)c2)[C@H]1[C@H]1CCCO1 ZINC000628284147 1045564888 /nfs/dbraw/zinc/56/48/88/1045564888.db2.gz BRNWUGWAVDVJMO-YPMHNXCESA-N 1 2 319.392 4.156 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2cnc(C3CC3)o2)c(F)c1 ZINC000628302758 1045566966 /nfs/dbraw/zinc/56/69/66/1045566966.db2.gz QPUVLJNOSLIQHZ-MRXNPFEDSA-N 1 2 304.340 4.167 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2cnc(C3CC3)o2)c(F)c1 ZINC000628302758 1045566971 /nfs/dbraw/zinc/56/69/71/1045566971.db2.gz QPUVLJNOSLIQHZ-MRXNPFEDSA-N 1 2 304.340 4.167 20 0 DIADLO C[N@@H+](Cc1ccc(F)cc1)CN1c2cccc3cccc(c23)C1=O ZINC000018897028 1045575632 /nfs/dbraw/zinc/57/56/32/1045575632.db2.gz FOKALJACQZLBSR-UHFFFAOYSA-N 1 2 320.367 4.029 20 0 DIADLO C[N@H+](Cc1ccc(F)cc1)CN1c2cccc3cccc(c23)C1=O ZINC000018897028 1045575641 /nfs/dbraw/zinc/57/56/41/1045575641.db2.gz FOKALJACQZLBSR-UHFFFAOYSA-N 1 2 320.367 4.029 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CCC[C@H]2CC(=O)c2cccs2)o1 ZINC000751033118 1045578538 /nfs/dbraw/zinc/57/85/38/1045578538.db2.gz LQGSSGWCMACVFT-ZDUSSCGKSA-N 1 2 318.442 4.097 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CCC[C@H]2CC(=O)c2cccs2)o1 ZINC000751033118 1045578545 /nfs/dbraw/zinc/57/85/45/1045578545.db2.gz LQGSSGWCMACVFT-ZDUSSCGKSA-N 1 2 318.442 4.097 20 0 DIADLO COCC[N@H+](Cc1scnc1C)Cc1c(C)cccc1Cl ZINC000450874126 1045582090 /nfs/dbraw/zinc/58/20/90/1045582090.db2.gz DOGPQMLGKBIDGP-UHFFFAOYSA-N 1 2 324.877 4.062 20 0 DIADLO COCC[N@@H+](Cc1scnc1C)Cc1c(C)cccc1Cl ZINC000450874126 1045582099 /nfs/dbraw/zinc/58/20/99/1045582099.db2.gz DOGPQMLGKBIDGP-UHFFFAOYSA-N 1 2 324.877 4.062 20 0 DIADLO FC(F)(F)c1sccc1C[NH+]1CC(Cc2ccco2)C1 ZINC000628433002 1045582933 /nfs/dbraw/zinc/58/29/33/1045582933.db2.gz BOHGQYYGEIEOIU-UHFFFAOYSA-N 1 2 301.333 4.034 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)cn1)c1nc(C(C)(C)C)cs1 ZINC000583686263 1045583130 /nfs/dbraw/zinc/58/31/30/1045583130.db2.gz WWEUPUDEVMWBCA-SNVBAGLBSA-N 1 2 309.866 4.340 20 0 DIADLO C[C@H](c1csnn1)[NH+]1CCC(C)(c2cccc(Cl)c2)CC1 ZINC000450896595 1045587225 /nfs/dbraw/zinc/58/72/25/1045587225.db2.gz NMXOPBBJPDCYPX-GFCCVEGCSA-N 1 2 321.877 4.306 20 0 DIADLO CCCN(C)c1ccccc1NC1CCN(c2cccc[nH+]2)CC1 ZINC000628477892 1045587236 /nfs/dbraw/zinc/58/72/36/1045587236.db2.gz LIJSMWPIUAVCGZ-UHFFFAOYSA-N 1 2 324.472 4.009 20 0 DIADLO Fc1cc(Cl)cc(F)c1C[NH+]1CCC(c2ccccn2)CC1 ZINC001139051765 1045589157 /nfs/dbraw/zinc/58/91/57/1045589157.db2.gz YEJXJSMBDNYQJM-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO CC(C)CO[C@@H]1CC[N@H+](Cc2cc(Cl)sc2Cl)C1 ZINC001168126217 1045597252 /nfs/dbraw/zinc/59/72/52/1045597252.db2.gz ORYLXLQECARVSC-LLVKDONJSA-N 1 2 308.274 4.302 20 0 DIADLO CC(C)CO[C@@H]1CC[N@@H+](Cc2cc(Cl)sc2Cl)C1 ZINC001168126217 1045597265 /nfs/dbraw/zinc/59/72/65/1045597265.db2.gz ORYLXLQECARVSC-LLVKDONJSA-N 1 2 308.274 4.302 20 0 DIADLO CC(C)=C(C)C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000751352310 1045600634 /nfs/dbraw/zinc/60/06/34/1045600634.db2.gz QRVPPICKQHHKET-UHFFFAOYSA-N 1 2 309.413 4.181 20 0 DIADLO C[C@@H](OC(=O)CCc1ccc(N)[nH+]c1)c1ccc2ccccc2c1 ZINC000751456704 1045605321 /nfs/dbraw/zinc/60/53/21/1045605321.db2.gz VOTPQUFEGAERNP-CQSZACIVSA-N 1 2 320.392 4.054 20 0 DIADLO C[C@H](OC(=O)CCc1ccc(N)[nH+]c1)c1cccc2ccccc21 ZINC000751441317 1045605840 /nfs/dbraw/zinc/60/58/40/1045605840.db2.gz DDYADJIIMWIRBQ-AWEZNQCLSA-N 1 2 320.392 4.054 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C)s1)c1ccc(Cl)cc1Cl ZINC000391936424 1045624015 /nfs/dbraw/zinc/62/40/15/1045624015.db2.gz PJOJGWGKRUPIIX-LBPRGKRZSA-N 1 2 316.257 4.394 20 0 DIADLO CC(C)(C)[C@@H](Cn1cc[nH+]c1)NC(=O)CC1CCC(C)(C)CC1 ZINC000751688044 1045625262 /nfs/dbraw/zinc/62/52/62/1045625262.db2.gz PTCKGSSIEIEENL-MRXNPFEDSA-N 1 2 319.493 4.021 20 0 DIADLO CC(C)(C)[C@H](Cn1cc[nH+]c1)NC(=O)CC1CCC(C)(C)CC1 ZINC000751688041 1045625743 /nfs/dbraw/zinc/62/57/43/1045625743.db2.gz PTCKGSSIEIEENL-INIZCTEOSA-N 1 2 319.493 4.021 20 0 DIADLO COc1ccc([NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)c(OC)c1 ZINC000800483788 1045627011 /nfs/dbraw/zinc/62/70/11/1045627011.db2.gz PELQXAROVXINDQ-GOEBONIOSA-N 1 2 312.413 4.237 20 0 DIADLO C[C@]12C[C@H]1CCC[C@H]2[NH2+]c1ccc(N2CCSCC2)cc1 ZINC000800489323 1045628451 /nfs/dbraw/zinc/62/84/51/1045628451.db2.gz RXZKQEYKNRTHIK-OLMNPRSZSA-N 1 2 302.487 4.230 20 0 DIADLO C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+]1CCC[C@](C)(F)C1 ZINC000451123197 1045629541 /nfs/dbraw/zinc/62/95/41/1045629541.db2.gz UXKIGVYJZXROHA-BZNIZROVSA-N 1 2 323.799 4.275 20 0 DIADLO C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[N@H+]1CCC[C@](C)(F)C1 ZINC000451123197 1045629546 /nfs/dbraw/zinc/62/95/46/1045629546.db2.gz UXKIGVYJZXROHA-BZNIZROVSA-N 1 2 323.799 4.275 20 0 DIADLO C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+]1CCC[C@@](C)(F)C1 ZINC000451123198 1045630951 /nfs/dbraw/zinc/63/09/51/1045630951.db2.gz UXKIGVYJZXROHA-MEDUHNTESA-N 1 2 323.799 4.275 20 0 DIADLO C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)[N@H+]1CCC[C@@](C)(F)C1 ZINC000451123198 1045630958 /nfs/dbraw/zinc/63/09/58/1045630958.db2.gz UXKIGVYJZXROHA-MEDUHNTESA-N 1 2 323.799 4.275 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3cc(F)cc(C)c3C2)cnc1Cl ZINC000800535675 1045639642 /nfs/dbraw/zinc/63/96/42/1045639642.db2.gz FRCUZZIHPIBFDQ-UHFFFAOYSA-N 1 2 304.796 4.049 20 0 DIADLO Cc1cc(C[N@H+]2CCc3cc(F)cc(C)c3C2)cnc1Cl ZINC000800535675 1045639648 /nfs/dbraw/zinc/63/96/48/1045639648.db2.gz FRCUZZIHPIBFDQ-UHFFFAOYSA-N 1 2 304.796 4.049 20 0 DIADLO C[C@@H]1CC[N@H+](Cn2nc(-c3ccccc3)sc2=S)[C@H]1C ZINC000751938869 1045643318 /nfs/dbraw/zinc/64/33/18/1045643318.db2.gz BKQUFOCNBQKZHQ-NEPJUHHUSA-N 1 2 305.472 4.029 20 0 DIADLO C[C@@H]1CC[N@@H+](Cn2nc(-c3ccccc3)sc2=S)[C@H]1C ZINC000751938869 1045643325 /nfs/dbraw/zinc/64/33/25/1045643325.db2.gz BKQUFOCNBQKZHQ-NEPJUHHUSA-N 1 2 305.472 4.029 20 0 DIADLO CC[NH+](CC)[C@@H](C(=O)Oc1ccccc1Cl)c1ccccc1 ZINC001124293070 1045643692 /nfs/dbraw/zinc/64/36/92/1045643692.db2.gz ZXKAYFIIYNAIAZ-QGZVFWFLSA-N 1 2 317.816 4.329 20 0 DIADLO CC1(C)Cc2cccc(NCc3ccc(-n4cc[nH+]c4)cc3)c2O1 ZINC000530386930 1045654164 /nfs/dbraw/zinc/65/41/64/1045654164.db2.gz WZLKSAVQWFDYLT-UHFFFAOYSA-N 1 2 319.408 4.198 20 0 DIADLO CC(C)[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccc(F)cn1 ZINC000779422894 1045701782 /nfs/dbraw/zinc/70/17/82/1045701782.db2.gz MCSZECCBHLHNNW-IBGZPJMESA-N 1 2 313.420 4.412 20 0 DIADLO CC(C)[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccc(F)cn1 ZINC000779422894 1045701796 /nfs/dbraw/zinc/70/17/96/1045701796.db2.gz MCSZECCBHLHNNW-IBGZPJMESA-N 1 2 313.420 4.412 20 0 DIADLO C[C@@H]([N@H+](C)Cn1nc(-c2cccs2)oc1=S)C1(C)CC1 ZINC000753113558 1045729066 /nfs/dbraw/zinc/72/90/66/1045729066.db2.gz XSHMMIXXGVRYFX-SNVBAGLBSA-N 1 2 309.460 4.012 20 0 DIADLO C[C@@H]([N@@H+](C)Cn1nc(-c2cccs2)oc1=S)C1(C)CC1 ZINC000753113558 1045729081 /nfs/dbraw/zinc/72/90/81/1045729081.db2.gz XSHMMIXXGVRYFX-SNVBAGLBSA-N 1 2 309.460 4.012 20 0 DIADLO CC(C)c1[nH+]cc(-c2ccc(OCc3ccccn3)cc2)n1C ZINC000630050107 1045734381 /nfs/dbraw/zinc/73/43/81/1045734381.db2.gz BUAZYMZNJLMGPS-UHFFFAOYSA-N 1 2 307.397 4.185 20 0 DIADLO FC(F)[C@H]1C[N@H+](Cc2ccc3oc4ccccc4c3c2)CCO1 ZINC000801562528 1045741161 /nfs/dbraw/zinc/74/11/61/1045741161.db2.gz AMRLOPSOWRPWSA-QGZVFWFLSA-N 1 2 317.335 4.052 20 0 DIADLO FC(F)[C@H]1C[N@@H+](Cc2ccc3oc4ccccc4c3c2)CCO1 ZINC000801562528 1045741180 /nfs/dbraw/zinc/74/11/80/1045741180.db2.gz AMRLOPSOWRPWSA-QGZVFWFLSA-N 1 2 317.335 4.052 20 0 DIADLO CC[C@H](OC(=O)c1cccc(Cn2cc[nH+]c2)c1)c1ccccc1 ZINC000779455524 1045750173 /nfs/dbraw/zinc/75/01/73/1045750173.db2.gz SIJCHODNGCRGTD-IBGZPJMESA-N 1 2 320.392 4.240 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(CCC(C)C)CCC(C)C)ccn12 ZINC001124755449 1045758317 /nfs/dbraw/zinc/75/83/17/1045758317.db2.gz OZCJYDYQUIKXMD-UHFFFAOYSA-N 1 2 315.461 4.177 20 0 DIADLO COc1ccc(Cl)c(C[NH2+]C2(c3ccccc3F)CC2)c1 ZINC000192158082 1045788560 /nfs/dbraw/zinc/78/85/60/1045788560.db2.gz AHWRCMNHNOQBPT-UHFFFAOYSA-N 1 2 305.780 4.267 20 0 DIADLO CCC(=O)CC[N@@H+]1CCc2cc(Cl)c(Cl)cc2[C@H]1C ZINC000753739411 1045799205 /nfs/dbraw/zinc/79/92/05/1045799205.db2.gz SGVIOHBCEDHVHU-SNVBAGLBSA-N 1 2 300.229 4.282 20 0 DIADLO CCC(=O)CC[N@H+]1CCc2cc(Cl)c(Cl)cc2[C@H]1C ZINC000753739411 1045799214 /nfs/dbraw/zinc/79/92/14/1045799214.db2.gz SGVIOHBCEDHVHU-SNVBAGLBSA-N 1 2 300.229 4.282 20 0 DIADLO CCN(Cc1cccc(Cl)c1)C(=O)c1c(C)cc(C)[nH+]c1C ZINC001124921374 1045802409 /nfs/dbraw/zinc/80/24/09/1045802409.db2.gz BFESMIXUVGVFKQ-UHFFFAOYSA-N 1 2 316.832 4.323 20 0 DIADLO CCOc1ccc([C@H]2CCC[N@@H+]2Cn2ncc(Cl)c2C)cc1 ZINC000753790534 1045802889 /nfs/dbraw/zinc/80/28/89/1045802889.db2.gz QBMUNNSAESNMKE-QGZVFWFLSA-N 1 2 319.836 4.038 20 0 DIADLO CCOc1ccc([C@H]2CCC[N@H+]2Cn2ncc(Cl)c2C)cc1 ZINC000753790534 1045802919 /nfs/dbraw/zinc/80/29/19/1045802919.db2.gz QBMUNNSAESNMKE-QGZVFWFLSA-N 1 2 319.836 4.038 20 0 DIADLO C[C@H]([NH2+]Cc1ccnn1CC1CCC1)c1c(F)cccc1Cl ZINC000631083687 1045810241 /nfs/dbraw/zinc/81/02/41/1045810241.db2.gz QBMGMKTVUJKVMP-LBPRGKRZSA-N 1 2 321.827 4.327 20 0 DIADLO C[C@H](C[NH2+]c1ccc(N2CCO[C@H](C)C2)cc1)Cc1ccccc1 ZINC000753969399 1045826187 /nfs/dbraw/zinc/82/61/87/1045826187.db2.gz SHPWARAVTMJWPP-ZWKOTPCHSA-N 1 2 324.468 4.202 20 0 DIADLO c1ccc2cc(N[C@@H]3CCOC4(CCSCC4)C3)[nH+]cc2c1 ZINC000631173750 1045828749 /nfs/dbraw/zinc/82/87/49/1045828749.db2.gz RGPCZARYSPICHJ-MRXNPFEDSA-N 1 2 314.454 4.092 20 0 DIADLO CCOc1ccc(C[NH2+][C@@H](CF)c2ccc(F)cc2)cc1F ZINC000631283059 1045845030 /nfs/dbraw/zinc/84/50/30/1045845030.db2.gz GUJYELFGVNMHJO-INIZCTEOSA-N 1 2 309.331 4.164 20 0 DIADLO Fc1ccc(-c2nc(C[N@@H+]3CCC[C@@H]3c3ccccn3)co2)cc1 ZINC000531440195 1045845506 /nfs/dbraw/zinc/84/55/06/1045845506.db2.gz SWYWBEGGQWWRKC-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(-c2nc(C[N@H+]3CCC[C@@H]3c3ccccn3)co2)cc1 ZINC000531440195 1045845528 /nfs/dbraw/zinc/84/55/28/1045845528.db2.gz SWYWBEGGQWWRKC-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO CC(C)[C@@H]1C[C@H]([NH2+]c2ccc(N3CCSCC3)cc2)CS1 ZINC000754130811 1045853237 /nfs/dbraw/zinc/85/32/37/1045853237.db2.gz RUGVWFAYOIGDDC-RDJZCZTQSA-N 1 2 322.543 4.182 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+]2CCC[C@H]2c2ccccn2)n1 ZINC000531523813 1045862180 /nfs/dbraw/zinc/86/21/80/1045862180.db2.gz VOEXIURNOXCUFH-AWEZNQCLSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1csc(C[N@H+]2CCC[C@H]2c2ccccn2)n1 ZINC000531523813 1045862185 /nfs/dbraw/zinc/86/21/85/1045862185.db2.gz VOEXIURNOXCUFH-AWEZNQCLSA-N 1 2 301.459 4.173 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1coc(-c2ccc(C)cc2)n1 ZINC000754342922 1045878889 /nfs/dbraw/zinc/87/88/89/1045878889.db2.gz VBWVHJFGNQQCIW-GFCCVEGCSA-N 1 2 311.385 4.106 20 0 DIADLO CCC[C@@H]([NH2+]Cc1csc([C@H](C)OC)n1)c1cc(C)ccn1 ZINC000631587162 1045879383 /nfs/dbraw/zinc/87/93/83/1045879383.db2.gz PLCBEDJLUCNGKX-DZGCQCFKSA-N 1 2 319.474 4.185 20 0 DIADLO CC[C@H](CC(C)C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001125233090 1045879770 /nfs/dbraw/zinc/87/97/70/1045879770.db2.gz OCWRVGIKFAFMKV-CYBMUJFWSA-N 1 2 303.381 4.022 20 0 DIADLO Cn1ccnc1[C@@H]([NH2+][C@H]1CCCc2sccc21)c1ccccc1 ZINC000531687554 1045891727 /nfs/dbraw/zinc/89/17/27/1045891727.db2.gz IUXYEBGXUSCNCH-WMZOPIPTSA-N 1 2 323.465 4.238 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)cc1 ZINC000531687485 1045891927 /nfs/dbraw/zinc/89/19/27/1045891927.db2.gz AWHAWVIFDBQSHV-JXFKEZNVSA-N 1 2 319.452 4.423 20 0 DIADLO Cc1nc(C[NH2+][C@@H]2CCSc3ccccc32)nc2ccccc12 ZINC000531707177 1045902058 /nfs/dbraw/zinc/90/20/58/1045902058.db2.gz CODOXGGVMOMCOK-MRXNPFEDSA-N 1 2 321.449 4.265 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](CC)Cc2ccc(C)cc2)n1 ZINC000531713506 1045903252 /nfs/dbraw/zinc/90/32/52/1045903252.db2.gz BTLHNYSGFBUTQT-AWEZNQCLSA-N 1 2 319.474 4.214 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](CC)Cc2ccc(C)cc2)n1 ZINC000531713506 1045903256 /nfs/dbraw/zinc/90/32/56/1045903256.db2.gz BTLHNYSGFBUTQT-AWEZNQCLSA-N 1 2 319.474 4.214 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2noc(-c3ccsc3)n2)s1 ZINC000754674932 1045910087 /nfs/dbraw/zinc/91/00/87/1045910087.db2.gz NIDWXKFHCKKMOT-JTQLQIEISA-N 1 2 305.428 4.019 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2ccc3oc4ccccc4c3c2)n1 ZINC000754682657 1045912167 /nfs/dbraw/zinc/91/21/67/1045912167.db2.gz AMHFRXZNDNSFAW-LLVKDONJSA-N 1 2 307.353 4.128 20 0 DIADLO Cc1c([C@@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)cnn1C(C)C ZINC000631798518 1045919665 /nfs/dbraw/zinc/91/96/65/1045919665.db2.gz UMXNVTCPLRMKFY-PXAZEXFGSA-N 1 2 307.388 4.273 20 0 DIADLO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](CF)c2ccc(F)cc2)c1 ZINC000631795120 1045920229 /nfs/dbraw/zinc/92/02/29/1045920229.db2.gz GILHJHCSUBTUGF-SGTLLEGYSA-N 1 2 318.367 4.146 20 0 DIADLO C[C@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1cnn(C2CCCC2)c1 ZINC000631798659 1045920437 /nfs/dbraw/zinc/92/04/37/1045920437.db2.gz XBKDGENIDJHFPP-UGSOOPFHSA-N 1 2 319.399 4.499 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+][C@@H](CC(F)(F)F)c2ccccc2)c2nccn21 ZINC000453057128 1045920795 /nfs/dbraw/zinc/92/07/95/1045920795.db2.gz GZCMMKLEXUMNSU-BNOWGMLFSA-N 1 2 309.335 4.172 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](C)c2csc3ccccc23)n1 ZINC000754744987 1045924028 /nfs/dbraw/zinc/92/40/28/1045924028.db2.gz URQNATZZTVJNEB-LBPRGKRZSA-N 1 2 315.442 4.478 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1csc2ccccc12 ZINC000754746550 1045924184 /nfs/dbraw/zinc/92/41/84/1045924184.db2.gz ZONZMYWYQLNRRB-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO C[C@H]([NH2+]Cc1cscn1)c1cc(Cl)c(Cl)cc1O ZINC000192785849 1045933150 /nfs/dbraw/zinc/93/31/50/1045933150.db2.gz MWQSUURYHQEVHQ-ZETCQYMHSA-N 1 2 303.214 4.006 20 0 DIADLO C[C@@H](c1ccc2ccccc2c1)[N@@H+]1CCc2cc(Cl)nnc2C1 ZINC000829136653 1045958117 /nfs/dbraw/zinc/95/81/17/1045958117.db2.gz MZJLXWSOKOXZHK-ZDUSSCGKSA-N 1 2 323.827 4.403 20 0 DIADLO C[C@@H](c1ccc2ccccc2c1)[N@H+]1CCc2cc(Cl)nnc2C1 ZINC000829136653 1045958129 /nfs/dbraw/zinc/95/81/29/1045958129.db2.gz MZJLXWSOKOXZHK-ZDUSSCGKSA-N 1 2 323.827 4.403 20 0 DIADLO C[N@H+](Cc1nc(Br)cs1)[C@H]1CCc2ccccc21 ZINC001137783536 1045966750 /nfs/dbraw/zinc/96/67/50/1045966750.db2.gz XTIVJINAGUDRIH-LBPRGKRZSA-N 1 2 323.259 4.025 20 0 DIADLO C[N@@H+](Cc1nc(Br)cs1)[C@H]1CCc2ccccc21 ZINC001137783536 1045966758 /nfs/dbraw/zinc/96/67/58/1045966758.db2.gz XTIVJINAGUDRIH-LBPRGKRZSA-N 1 2 323.259 4.025 20 0 DIADLO Clc1ccc(Br)cc1C[N@@H+]1CCC[C@@H]2C[C@@H]21 ZINC001137830433 1045977494 /nfs/dbraw/zinc/97/74/94/1045977494.db2.gz BYWUAZLDHDJWKN-RNCFNFMXSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1ccc(Br)cc1C[N@H+]1CCC[C@@H]2C[C@@H]21 ZINC001137830433 1045977505 /nfs/dbraw/zinc/97/75/05/1045977505.db2.gz BYWUAZLDHDJWKN-RNCFNFMXSA-N 1 2 300.627 4.087 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)cc(F)c2F)cc1 ZINC001137872576 1045994324 /nfs/dbraw/zinc/99/43/24/1045994324.db2.gz WAWQZTCFNXQCLT-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)cc(F)c2F)cc1 ZINC001137872576 1045994332 /nfs/dbraw/zinc/99/43/32/1045994332.db2.gz WAWQZTCFNXQCLT-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[NH+]1CCC(c2cccnc2)CC1 ZINC001137884187 1045998545 /nfs/dbraw/zinc/99/85/45/1045998545.db2.gz LXQHUYZKNSGAIY-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2nc3ccccc3s2)n1 ZINC000080273943 1046015103 /nfs/dbraw/zinc/01/51/03/1046015103.db2.gz ZEWDOKKXRGTQOO-MNOVXSKESA-N 1 2 303.456 4.473 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2c(F)ccc(F)c2F)cc1 ZINC001137932447 1046022091 /nfs/dbraw/zinc/02/20/91/1046022091.db2.gz YGBAEZDURMQASH-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2c(F)ccc(F)c2F)cc1 ZINC001137932447 1046022106 /nfs/dbraw/zinc/02/21/06/1046022106.db2.gz YGBAEZDURMQASH-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO Fc1ccc(C[NH+]2CCC3(CC(F)(F)C3)CC2)c(F)c1F ZINC001137935700 1046026154 /nfs/dbraw/zinc/02/61/54/1046026154.db2.gz GNBUWZDNGNWNMA-UHFFFAOYSA-N 1 2 305.290 4.115 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1nc(C)c(C)s1 ZINC000755940090 1046029197 /nfs/dbraw/zinc/02/91/97/1046029197.db2.gz MUMAQFAWSLICPN-UHFFFAOYSA-N 1 2 314.458 4.370 20 0 DIADLO CC[C@H]1CC[N@H+](Cn2nc(-c3ccccc3)sc2=S)C1 ZINC000755920570 1046029562 /nfs/dbraw/zinc/02/95/62/1046029562.db2.gz AIRQBTIHQVJOQR-LBPRGKRZSA-N 1 2 305.472 4.030 20 0 DIADLO CC[C@H]1CC[N@@H+](Cn2nc(-c3ccccc3)sc2=S)C1 ZINC000755920570 1046029578 /nfs/dbraw/zinc/02/95/78/1046029578.db2.gz AIRQBTIHQVJOQR-LBPRGKRZSA-N 1 2 305.472 4.030 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000453310995 1046032368 /nfs/dbraw/zinc/03/23/68/1046032368.db2.gz BHUVDTBWXSMDLF-NSHDSACASA-N 1 2 309.866 4.036 20 0 DIADLO FC[C@@H]1C[N@H+](Cc2cccc(Cl)c2F)C[C@H]1C(F)(F)F ZINC001137957680 1046034162 /nfs/dbraw/zinc/03/41/62/1046034162.db2.gz IQPSXBRFUDVPCM-NXEZZACHSA-N 1 2 313.697 4.059 20 0 DIADLO FC[C@@H]1C[N@@H+](Cc2cccc(Cl)c2F)C[C@H]1C(F)(F)F ZINC001137957680 1046034176 /nfs/dbraw/zinc/03/41/76/1046034176.db2.gz IQPSXBRFUDVPCM-NXEZZACHSA-N 1 2 313.697 4.059 20 0 DIADLO Cc1cc(CNc2cncc(C(F)F)c2)c2c([nH+]1)CCCC2 ZINC000902639167 1046039089 /nfs/dbraw/zinc/03/90/89/1046039089.db2.gz OPCLRBVFDVMRSV-UHFFFAOYSA-N 1 2 303.356 4.214 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(F)ccc(F)c2Cl)CCC1(F)F ZINC001137999820 1046052630 /nfs/dbraw/zinc/05/26/30/1046052630.db2.gz ZUDZKSMTLOOYSA-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(F)ccc(F)c2Cl)CCC1(F)F ZINC001137999820 1046052642 /nfs/dbraw/zinc/05/26/42/1046052642.db2.gz ZUDZKSMTLOOYSA-VIFPVBQESA-N 1 2 309.734 4.485 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nccn1CC)c1cc(Cl)ccc1OC ZINC000453356001 1046056367 /nfs/dbraw/zinc/05/63/67/1046056367.db2.gz OVMWTNRMBXXEKB-IUODEOHRSA-N 1 2 321.852 4.367 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2CCc3cc(O)ccc3C2)c1Cl ZINC001138024557 1046063209 /nfs/dbraw/zinc/06/32/09/1046063209.db2.gz DXSKEFNQQRJDEL-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2CCc3cc(O)ccc3C2)c1Cl ZINC001138024557 1046063216 /nfs/dbraw/zinc/06/32/16/1046063216.db2.gz DXSKEFNQQRJDEL-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO CSc1ncc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)cn1 ZINC001138705706 1046071798 /nfs/dbraw/zinc/07/17/98/1046071798.db2.gz ZFLGMUDQTBCCKR-OAHLLOKOSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1ncc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)cn1 ZINC001138705706 1046071815 /nfs/dbraw/zinc/07/18/15/1046071815.db2.gz ZFLGMUDQTBCCKR-OAHLLOKOSA-N 1 2 319.861 4.189 20 0 DIADLO CCc1ncc(C[NH2+][C@H](c2ccccc2)c2ccc(OC)cc2)o1 ZINC000453375739 1046073912 /nfs/dbraw/zinc/07/39/12/1046073912.db2.gz JSNWUIFRKTUUQZ-HXUWFJFHSA-N 1 2 322.408 4.125 20 0 DIADLO c1cn(Cc2cccc(-c3noc(C4CCC=CCC4)n3)c2)c[nH+]1 ZINC000634565819 1046076528 /nfs/dbraw/zinc/07/65/28/1046076528.db2.gz ZEXUDDFNMKLIMM-UHFFFAOYSA-N 1 2 320.396 4.195 20 0 DIADLO Cc1cc(Br)c(C[N@H+](C)Cc2ccoc2)s1 ZINC000453562395 1046091157 /nfs/dbraw/zinc/09/11/57/1046091157.db2.gz KSSPNPPFDIWGEI-UHFFFAOYSA-N 1 2 300.221 4.044 20 0 DIADLO Cc1cc(Br)c(C[N@@H+](C)Cc2ccoc2)s1 ZINC000453562395 1046091174 /nfs/dbraw/zinc/09/11/74/1046091174.db2.gz KSSPNPPFDIWGEI-UHFFFAOYSA-N 1 2 300.221 4.044 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CC(C)(C)c3ccccc3)cc2[nH+]1 ZINC000532185990 1046107697 /nfs/dbraw/zinc/10/76/97/1046107697.db2.gz RVGOPDDLOXTQSH-UHFFFAOYSA-N 1 2 307.397 4.178 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccc(C(F)(F)F)cn1 ZINC000902928360 1046115357 /nfs/dbraw/zinc/11/53/57/1046115357.db2.gz LCXOFOUYWUJJDC-LLVKDONJSA-N 1 2 309.335 4.340 20 0 DIADLO C[N@H+](CC/C=C/c1cccnc1)Cc1c(F)c(F)cc(F)c1F ZINC001138236511 1046125499 /nfs/dbraw/zinc/12/54/99/1046125499.db2.gz DMZYKQONMLCEDD-GORDUTHDSA-N 1 2 324.321 4.173 20 0 DIADLO C[N@@H+](CC/C=C/c1cccnc1)Cc1c(F)c(F)cc(F)c1F ZINC001138236511 1046125515 /nfs/dbraw/zinc/12/55/15/1046125515.db2.gz DMZYKQONMLCEDD-GORDUTHDSA-N 1 2 324.321 4.173 20 0 DIADLO CC(C)c1ccc([C@H](C)[N@H+](C)Cc2ncc(Cl)n2C)cc1 ZINC000195732486 1046133845 /nfs/dbraw/zinc/13/38/45/1046133845.db2.gz VSFUMVQAOYOIFE-ZDUSSCGKSA-N 1 2 305.853 4.390 20 0 DIADLO CC(C)c1ccc([C@H](C)[N@@H+](C)Cc2ncc(Cl)n2C)cc1 ZINC000195732486 1046133852 /nfs/dbraw/zinc/13/38/52/1046133852.db2.gz VSFUMVQAOYOIFE-ZDUSSCGKSA-N 1 2 305.853 4.390 20 0 DIADLO CCCn1cc([C@@H](C)[NH2+]C2(c3ccccc3Cl)CCC2)nn1 ZINC000903037528 1046144697 /nfs/dbraw/zinc/14/46/97/1046144697.db2.gz AKKLIWYNTDZLQV-CYBMUJFWSA-N 1 2 318.852 4.072 20 0 DIADLO CC(C)(C)c1[nH]c2ccccc2c1C[N@@H+]1CCn2cccc2C1 ZINC001138313442 1046146422 /nfs/dbraw/zinc/14/64/22/1046146422.db2.gz ULBJLSJSRZPFTE-UHFFFAOYSA-N 1 2 307.441 4.283 20 0 DIADLO CC(C)(C)c1[nH]c2ccccc2c1C[N@H+]1CCn2cccc2C1 ZINC001138313442 1046146430 /nfs/dbraw/zinc/14/64/30/1046146430.db2.gz ULBJLSJSRZPFTE-UHFFFAOYSA-N 1 2 307.441 4.283 20 0 DIADLO CCCO[C@H]1CC[N@H+](Cc2c(Cl)cc(OC)cc2Cl)C1 ZINC001142292559 1046147151 /nfs/dbraw/zinc/14/71/51/1046147151.db2.gz GJVLHLCCUGDGPV-NSHDSACASA-N 1 2 318.244 4.003 20 0 DIADLO CCCO[C@H]1CC[N@@H+](Cc2c(Cl)cc(OC)cc2Cl)C1 ZINC001142292559 1046147158 /nfs/dbraw/zinc/14/71/58/1046147158.db2.gz GJVLHLCCUGDGPV-NSHDSACASA-N 1 2 318.244 4.003 20 0 DIADLO COc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001138373541 1046159489 /nfs/dbraw/zinc/15/94/89/1046159489.db2.gz FHLUELRLOPWWQJ-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)cc1C[N@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001138373541 1046159494 /nfs/dbraw/zinc/15/94/94/1046159494.db2.gz FHLUELRLOPWWQJ-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO Cn1c2ccccc2nc1C[N@@H+]1CCC[C@@H]1c1ccccc1F ZINC001138379477 1046159614 /nfs/dbraw/zinc/15/96/14/1046159614.db2.gz XOJQLDOSZVBCAY-QGZVFWFLSA-N 1 2 309.388 4.050 20 0 DIADLO Cn1c2ccccc2nc1C[N@H+]1CCC[C@@H]1c1ccccc1F ZINC001138379477 1046159625 /nfs/dbraw/zinc/15/96/25/1046159625.db2.gz XOJQLDOSZVBCAY-QGZVFWFLSA-N 1 2 309.388 4.050 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000903079786 1046159651 /nfs/dbraw/zinc/15/96/51/1046159651.db2.gz KQTFJBMBZXRMOQ-LBPRGKRZSA-N 1 2 314.191 4.023 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000903079786 1046159658 /nfs/dbraw/zinc/15/96/58/1046159658.db2.gz KQTFJBMBZXRMOQ-LBPRGKRZSA-N 1 2 314.191 4.023 20 0 DIADLO Cc1c2ccccc2[nH]c1C[N@@H+](C)Cc1cccc(F)c1F ZINC001138401553 1046165644 /nfs/dbraw/zinc/16/56/44/1046165644.db2.gz QTCVCMBIYGIINR-UHFFFAOYSA-N 1 2 300.352 4.387 20 0 DIADLO Cc1c2ccccc2[nH]c1C[N@H+](C)Cc1cccc(F)c1F ZINC001138401553 1046165654 /nfs/dbraw/zinc/16/56/54/1046165654.db2.gz QTCVCMBIYGIINR-UHFFFAOYSA-N 1 2 300.352 4.387 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2[nH]c3ccc(F)cc3c2C)no1 ZINC001138412065 1046169542 /nfs/dbraw/zinc/16/95/42/1046169542.db2.gz WRGGCJQXAAAATB-SFHVURJKSA-N 1 2 313.376 4.249 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2[nH]c3ccc(F)cc3c2C)no1 ZINC001138412065 1046169547 /nfs/dbraw/zinc/16/95/47/1046169547.db2.gz WRGGCJQXAAAATB-SFHVURJKSA-N 1 2 313.376 4.249 20 0 DIADLO c1ccc([C@H](Nc2ccc(N3CCCCC3)c[nH+]2)C2CC2)nc1 ZINC000903134786 1046172449 /nfs/dbraw/zinc/17/24/49/1046172449.db2.gz FKZHITDHDCCCDP-LJQANCHMSA-N 1 2 308.429 4.030 20 0 DIADLO CCc1cccc2cc(C[N@@H+]3C[C@@H](C)[C@@H](F)C3)c(Cl)nc21 ZINC001138726187 1046177204 /nfs/dbraw/zinc/17/72/04/1046177204.db2.gz FVSWZNXCKRGSKM-ABAIWWIYSA-N 1 2 306.812 4.240 20 0 DIADLO CCc1cccc2cc(C[N@H+]3C[C@@H](C)[C@@H](F)C3)c(Cl)nc21 ZINC001138726187 1046177208 /nfs/dbraw/zinc/17/72/08/1046177208.db2.gz FVSWZNXCKRGSKM-ABAIWWIYSA-N 1 2 306.812 4.240 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@@H](C)c2cc3cccc(F)c3o2)n1 ZINC000475716022 1046177849 /nfs/dbraw/zinc/17/78/49/1046177849.db2.gz NZVMYBAYRRGSLT-LBPRGKRZSA-N 1 2 301.365 4.200 20 0 DIADLO Cc1cc([C@@H](C)NC(=O)[C@@H](CC(C)C)n2cc[nH+]c2)c(C)s1 ZINC000635252251 1046182250 /nfs/dbraw/zinc/18/22/50/1046182250.db2.gz LUPSOXOITULTAT-CZUORRHYSA-N 1 2 319.474 4.026 20 0 DIADLO Fc1ccccc1[C@H]([NH2+][C@@H]1CCCC1(F)F)C1CCOCC1 ZINC000903171068 1046182538 /nfs/dbraw/zinc/18/25/38/1046182538.db2.gz MIMCLVJEQXVYEC-HZPDHXFCSA-N 1 2 313.363 4.071 20 0 DIADLO Cc1ccc(-c2n[nH]cc2C[N@@H+]2Cc3cccc(F)c3C2)cc1 ZINC001138446499 1046184755 /nfs/dbraw/zinc/18/47/55/1046184755.db2.gz AJYVNBHULSXOCU-UHFFFAOYSA-N 1 2 307.372 4.040 20 0 DIADLO Cc1ccc(-c2n[nH]cc2C[N@H+]2Cc3cccc(F)c3C2)cc1 ZINC001138446499 1046184762 /nfs/dbraw/zinc/18/47/62/1046184762.db2.gz AJYVNBHULSXOCU-UHFFFAOYSA-N 1 2 307.372 4.040 20 0 DIADLO COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1nc2c(s1)CCC2 ZINC000903193067 1046189291 /nfs/dbraw/zinc/18/92/91/1046189291.db2.gz QDHWTTMUMTUCKX-JTQLQIEISA-N 1 2 322.861 4.145 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1c(C)onc1CC ZINC000757611505 1046193499 /nfs/dbraw/zinc/19/34/99/1046193499.db2.gz DGQMIBBIKLOIDG-UHFFFAOYSA-N 1 2 312.417 4.155 20 0 DIADLO CCCc1nc(C[N@H+](C)[C@H](C)[C@@H](C)c2ccc(Cl)cc2)no1 ZINC000475743767 1046193795 /nfs/dbraw/zinc/19/37/95/1046193795.db2.gz LDEUBSXZDAXUHU-CHWSQXEVSA-N 1 2 321.852 4.300 20 0 DIADLO CCCc1nc(C[N@@H+](C)[C@H](C)[C@@H](C)c2ccc(Cl)cc2)no1 ZINC000475743767 1046193805 /nfs/dbraw/zinc/19/38/05/1046193805.db2.gz LDEUBSXZDAXUHU-CHWSQXEVSA-N 1 2 321.852 4.300 20 0 DIADLO CC/C(C)=C(/C)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000780012111 1046194383 /nfs/dbraw/zinc/19/43/83/1046194383.db2.gz AQHGJAQRSDEVAI-PFONDFGASA-N 1 2 321.424 4.287 20 0 DIADLO CC(C)CC[C@H]([NH2+]Cc1nc(CN(C)C)cs1)c1ccoc1 ZINC000903220937 1046198353 /nfs/dbraw/zinc/19/83/53/1046198353.db2.gz RMJMIJLPXQNDIE-INIZCTEOSA-N 1 2 321.490 4.065 20 0 DIADLO CSc1cc(C)ccc1NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000636023613 1046214202 /nfs/dbraw/zinc/21/42/02/1046214202.db2.gz PEXDSCZZASBFLK-OAHLLOKOSA-N 1 2 317.458 4.139 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc3ccccc3c2)o1 ZINC000007975088 1046219115 /nfs/dbraw/zinc/21/91/15/1046219115.db2.gz UXDYDZOHQSABIJ-HNNXBMFYSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc3ccccc3c2)o1 ZINC000007975088 1046219121 /nfs/dbraw/zinc/21/91/21/1046219121.db2.gz UXDYDZOHQSABIJ-HNNXBMFYSA-N 1 2 322.408 4.200 20 0 DIADLO Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000903313084 1046234298 /nfs/dbraw/zinc/23/42/98/1046234298.db2.gz HXFYTRVKGGGVSA-HNNXBMFYSA-N 1 2 314.429 4.284 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@@H](C)c2ccccc2F)c(C)[nH+]1 ZINC000102602853 1046234810 /nfs/dbraw/zinc/23/48/10/1046234810.db2.gz ORYGJKRIRKEREE-LLVKDONJSA-N 1 2 300.377 4.278 20 0 DIADLO COc1ccc2c(C[N@@H+]3Cc4ccc(Cl)cc4C3)c[nH]c2c1 ZINC001138590563 1046236661 /nfs/dbraw/zinc/23/66/61/1046236661.db2.gz SGGZQLMNJZWVLW-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccc2c(C[N@H+]3Cc4ccc(Cl)cc4C3)c[nH]c2c1 ZINC001138590563 1046236669 /nfs/dbraw/zinc/23/66/69/1046236669.db2.gz SGGZQLMNJZWVLW-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO CC(C)c1ccc([C@H](C)CC(=O)OCCCn2cc[nH+]c2)cc1 ZINC000783748013 1046240407 /nfs/dbraw/zinc/24/04/07/1046240407.db2.gz YXJHMZDTHJGISC-MRXNPFEDSA-N 1 2 314.429 4.134 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@@H](c1ncccc1C)C(C)(C)C ZINC000903328045 1046242486 /nfs/dbraw/zinc/24/24/86/1046242486.db2.gz DDKLFZAGDBDUPV-KSSFIOAISA-N 1 2 313.445 4.441 20 0 DIADLO COc1ccc(-c2cccc(C[N@H+](C)Cc3nccs3)c2)cc1 ZINC001138617937 1046244067 /nfs/dbraw/zinc/24/40/67/1046244067.db2.gz NKDWBNXMVMHIIE-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1ccc(-c2cccc(C[N@@H+](C)Cc3nccs3)c2)cc1 ZINC001138617937 1046244077 /nfs/dbraw/zinc/24/40/77/1046244077.db2.gz NKDWBNXMVMHIIE-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2cc3cc(Cl)cnc3o2)cs1 ZINC000648456726 1046245876 /nfs/dbraw/zinc/24/58/76/1046245876.db2.gz HZCGDCCDNJLFQR-VIFPVBQESA-N 1 2 321.833 4.351 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1nc(-c2ccsc2)oc1C ZINC000102656015 1046251447 /nfs/dbraw/zinc/25/14/47/1046251447.db2.gz XXSAMJBGKVHXOE-UHFFFAOYSA-N 1 2 302.399 4.327 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1nc(-c2ccsc2)oc1C ZINC000102656015 1046251454 /nfs/dbraw/zinc/25/14/54/1046251454.db2.gz XXSAMJBGKVHXOE-UHFFFAOYSA-N 1 2 302.399 4.327 20 0 DIADLO FC(F)(F)OCCNc1ccc2[nH]c(-c3ccccc3)[nH+]c2c1 ZINC001168171947 1046252282 /nfs/dbraw/zinc/25/22/82/1046252282.db2.gz APJHBMWZHVLDQB-UHFFFAOYSA-N 1 2 321.302 4.178 20 0 DIADLO CC[C@H]([NH2+][C@H]1CCCc2scnc21)c1cc(F)ccc1OC ZINC000903370366 1046259282 /nfs/dbraw/zinc/25/92/82/1046259282.db2.gz FZDVFCZJLGQPSB-KBPBESRZSA-N 1 2 320.433 4.409 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2c(Cl)[nH]c3ccccc32)no1 ZINC001138684690 1046266822 /nfs/dbraw/zinc/26/68/22/1046266822.db2.gz MXUYOLQBHKPYCU-MRXNPFEDSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2c(Cl)[nH]c3ccccc32)no1 ZINC001138684690 1046266830 /nfs/dbraw/zinc/26/68/30/1046266830.db2.gz MXUYOLQBHKPYCU-MRXNPFEDSA-N 1 2 315.804 4.455 20 0 DIADLO O=C1CC[N@@H+](Cc2c(Cl)[nH]c3ccccc32)[C@@H]2CCCC[C@@H]12 ZINC001138684769 1046268175 /nfs/dbraw/zinc/26/81/75/1046268175.db2.gz PZSBEOPCYAPQKW-CZUORRHYSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c(Cl)[nH]c3ccccc32)[C@@H]2CCCC[C@@H]12 ZINC001138684769 1046268181 /nfs/dbraw/zinc/26/81/81/1046268181.db2.gz PZSBEOPCYAPQKW-CZUORRHYSA-N 1 2 316.832 4.155 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc(Cl)cc2C)o1 ZINC000073605983 1046278731 /nfs/dbraw/zinc/27/87/31/1046278731.db2.gz AXHHGMAZXIJXIE-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc(Cl)cc2C)o1 ZINC000073605983 1046278743 /nfs/dbraw/zinc/27/87/43/1046278743.db2.gz AXHHGMAZXIJXIE-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)[C@@H](c1nccn1C)C1CC1 ZINC000637866055 1046280491 /nfs/dbraw/zinc/28/04/91/1046280491.db2.gz KTMJUNKEDPWHBB-CQSZACIVSA-N 1 2 309.866 4.108 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)[C@@H](c1nccn1C)C1CC1 ZINC000637866055 1046280504 /nfs/dbraw/zinc/28/05/04/1046280504.db2.gz KTMJUNKEDPWHBB-CQSZACIVSA-N 1 2 309.866 4.108 20 0 DIADLO Cc1ncc([C@@H](C)[N@H+](Cc2ccco2)Cc2ccccc2)c(C)n1 ZINC000637859632 1046280867 /nfs/dbraw/zinc/28/08/67/1046280867.db2.gz GAVAPQOVGPPCFB-MRXNPFEDSA-N 1 2 321.424 4.450 20 0 DIADLO Cc1ncc([C@@H](C)[N@@H+](Cc2ccco2)Cc2ccccc2)c(C)n1 ZINC000637859632 1046280881 /nfs/dbraw/zinc/28/08/81/1046280881.db2.gz GAVAPQOVGPPCFB-MRXNPFEDSA-N 1 2 321.424 4.450 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)[C@H](c1nccn1C)C1CC1 ZINC000637900732 1046284188 /nfs/dbraw/zinc/28/41/88/1046284188.db2.gz FRIBIVOYKGAZEQ-LRDDRELGSA-N 1 2 303.837 4.218 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)[C@H](c1nccn1C)C1CC1 ZINC000637900732 1046284193 /nfs/dbraw/zinc/28/41/93/1046284193.db2.gz FRIBIVOYKGAZEQ-LRDDRELGSA-N 1 2 303.837 4.218 20 0 DIADLO CC[N@H+](Cc1cnc2[nH]ccc2c1)Cc1c(F)cccc1Cl ZINC001138738385 1046284342 /nfs/dbraw/zinc/28/43/42/1046284342.db2.gz UGLWXIKYIUSFCC-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO CC[N@@H+](Cc1cnc2[nH]ccc2c1)Cc1c(F)cccc1Cl ZINC001138738385 1046284348 /nfs/dbraw/zinc/28/43/48/1046284348.db2.gz UGLWXIKYIUSFCC-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)[C@@H](c1nccn1C)C1CC1 ZINC000637900733 1046284940 /nfs/dbraw/zinc/28/49/40/1046284940.db2.gz FRIBIVOYKGAZEQ-MLGOLLRUSA-N 1 2 303.837 4.218 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)[C@@H](c1nccn1C)C1CC1 ZINC000637900733 1046284954 /nfs/dbraw/zinc/28/49/54/1046284954.db2.gz FRIBIVOYKGAZEQ-MLGOLLRUSA-N 1 2 303.837 4.218 20 0 DIADLO c1cc([C@H]2CCC[N@@H+]2[C@@H](c2nnc[nH]2)C2CCCCC2)cs1 ZINC000637909995 1046285762 /nfs/dbraw/zinc/28/57/62/1046285762.db2.gz MUCYUWQHMBWPGA-HZPDHXFCSA-N 1 2 316.474 4.325 20 0 DIADLO c1cc([C@H]2CCC[N@H+]2[C@@H](c2nnc[nH]2)C2CCCCC2)cs1 ZINC000637909995 1046285769 /nfs/dbraw/zinc/28/57/69/1046285769.db2.gz MUCYUWQHMBWPGA-HZPDHXFCSA-N 1 2 316.474 4.325 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+]2CC[C@H]2c2ccccc2)c1OC ZINC001138746188 1046286633 /nfs/dbraw/zinc/28/66/33/1046286633.db2.gz SLLDJXRSDDZJLD-INIZCTEOSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(Cl)cc(C[N@H+]2CC[C@H]2c2ccccc2)c1OC ZINC001138746188 1046286645 /nfs/dbraw/zinc/28/66/45/1046286645.db2.gz SLLDJXRSDDZJLD-INIZCTEOSA-N 1 2 317.816 4.304 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cc3cc(Cl)cnc3o2)s1 ZINC000648468839 1046290127 /nfs/dbraw/zinc/29/01/27/1046290127.db2.gz PFWJXWMYTGXAMZ-VIFPVBQESA-N 1 2 307.806 4.097 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3o2)sn1 ZINC000638138938 1046296663 /nfs/dbraw/zinc/29/66/63/1046296663.db2.gz QCSIIHFUGZGPON-OAHLLOKOSA-N 1 2 313.426 4.320 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3o2)sn1 ZINC000638138938 1046296677 /nfs/dbraw/zinc/29/66/77/1046296677.db2.gz QCSIIHFUGZGPON-OAHLLOKOSA-N 1 2 313.426 4.320 20 0 DIADLO CCc1ccc([C@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)cc1 ZINC000638291966 1046308687 /nfs/dbraw/zinc/30/86/87/1046308687.db2.gz CLKBKTRJRAOCNZ-KSSFIOAISA-N 1 2 312.461 4.339 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CCOC[C@H]3C(C)C)c(Cl)nc2c1 ZINC001138862501 1046311966 /nfs/dbraw/zinc/31/19/66/1046311966.db2.gz NHSRGTJFSGTSHT-KRWDZBQOSA-N 1 2 318.848 4.053 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CCOC[C@H]3C(C)C)c(Cl)nc2c1 ZINC001138862501 1046311981 /nfs/dbraw/zinc/31/19/81/1046311981.db2.gz NHSRGTJFSGTSHT-KRWDZBQOSA-N 1 2 318.848 4.053 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)c1ccc(F)c(F)c1 ZINC000638302322 1046312747 /nfs/dbraw/zinc/31/27/47/1046312747.db2.gz SPQOHIJLQVESLB-BDJLRTHQSA-N 1 2 320.387 4.055 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1ccccc1C)c1ccccn1 ZINC000089797129 1046313697 /nfs/dbraw/zinc/31/36/97/1046313697.db2.gz XHNBWIFNAJWJJA-NRFANRHFSA-N 1 2 318.420 4.278 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)c(C)s1 ZINC000638336630 1046315328 /nfs/dbraw/zinc/31/53/28/1046315328.db2.gz WRVTTWDVXNZMSJ-WBMJQRKESA-N 1 2 318.490 4.455 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)c(C)s1 ZINC000638336620 1046315580 /nfs/dbraw/zinc/31/55/80/1046315580.db2.gz WRVTTWDVXNZMSJ-BLLLJJGKSA-N 1 2 318.490 4.455 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2cc(F)cnc2Cl)cc1 ZINC001138896317 1046320620 /nfs/dbraw/zinc/32/06/20/1046320620.db2.gz XZAYKQJIZHAXSI-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2cc(F)cnc2Cl)cc1 ZINC001138896317 1046320628 /nfs/dbraw/zinc/32/06/28/1046320628.db2.gz XZAYKQJIZHAXSI-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(F)cnc1Cl ZINC001138894699 1046321098 /nfs/dbraw/zinc/32/10/98/1046321098.db2.gz XZTVOVUIIAUSBU-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1cc(F)cnc1Cl ZINC001138894699 1046321110 /nfs/dbraw/zinc/32/11/10/1046321110.db2.gz XZTVOVUIIAUSBU-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)c1csc(C[NH2+]Cc2cc3cc(Cl)cnc3o2)n1 ZINC000648482957 1046322179 /nfs/dbraw/zinc/32/21/79/1046322179.db2.gz AJNDTHOEOFAYIT-UHFFFAOYSA-N 1 2 321.833 4.351 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000103226059 1046322214 /nfs/dbraw/zinc/32/22/14/1046322214.db2.gz LCPNAWWLZITMLU-UHFFFAOYSA-N 1 2 320.364 4.313 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000103226059 1046322228 /nfs/dbraw/zinc/32/22/28/1046322228.db2.gz LCPNAWWLZITMLU-UHFFFAOYSA-N 1 2 320.364 4.313 20 0 DIADLO C[C@@H]1C(=O)CC[N@H+](Cc2ccccc2OC(F)F)C12CCCC2 ZINC001138911718 1046324338 /nfs/dbraw/zinc/32/43/38/1046324338.db2.gz GHIRVZSAGHMXMI-CYBMUJFWSA-N 1 2 323.383 4.012 20 0 DIADLO C[C@@H]1C(=O)CC[N@@H+](Cc2ccccc2OC(F)F)C12CCCC2 ZINC001138911718 1046324348 /nfs/dbraw/zinc/32/43/48/1046324348.db2.gz GHIRVZSAGHMXMI-CYBMUJFWSA-N 1 2 323.383 4.012 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)n1 ZINC001138939971 1046332306 /nfs/dbraw/zinc/33/23/06/1046332306.db2.gz YCLJWSOJYKQPTL-GFCCVEGCSA-N 1 2 310.228 4.014 20 0 DIADLO Cc1c[nH]c(C[N@H+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)n1 ZINC001138939971 1046332314 /nfs/dbraw/zinc/33/23/14/1046332314.db2.gz YCLJWSOJYKQPTL-GFCCVEGCSA-N 1 2 310.228 4.014 20 0 DIADLO Cc1cccc(C(C)(C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000638667136 1046333181 /nfs/dbraw/zinc/33/31/81/1046333181.db2.gz LBVIBDYIRXYVNV-KRWDZBQOSA-N 1 2 312.461 4.259 20 0 DIADLO CC(C)([NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)c1cccc(F)c1 ZINC000638629042 1046334313 /nfs/dbraw/zinc/33/43/13/1046334313.db2.gz MUXPQWUNNVHUHH-MRXNPFEDSA-N 1 2 316.424 4.090 20 0 DIADLO CCCCOc1cccc(C[N@@H+]2Cc3ccc(OC)cc3C2)c1 ZINC001138954193 1046339308 /nfs/dbraw/zinc/33/93/08/1046339308.db2.gz QYWYIZBADSGJFL-UHFFFAOYSA-N 1 2 311.425 4.390 20 0 DIADLO CCCCOc1cccc(C[N@H+]2Cc3ccc(OC)cc3C2)c1 ZINC001138954193 1046339315 /nfs/dbraw/zinc/33/93/15/1046339315.db2.gz QYWYIZBADSGJFL-UHFFFAOYSA-N 1 2 311.425 4.390 20 0 DIADLO c1nnc([C@H](Nc2cccc3cc[nH+]cc32)C2CCCCC2)[nH]1 ZINC000638887121 1046349011 /nfs/dbraw/zinc/34/90/11/1046349011.db2.gz TYDPLGMBTCIVNQ-QGZVFWFLSA-N 1 2 307.401 4.086 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc(OC(F)F)c(Cl)c1 ZINC000090207601 1046350415 /nfs/dbraw/zinc/35/04/15/1046350415.db2.gz RWEHJERZLBQITR-UHFFFAOYSA-N 1 2 315.751 4.331 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC001139011100 1046355238 /nfs/dbraw/zinc/35/52/38/1046355238.db2.gz MENVFMGPNOUXKH-ZDUSSCGKSA-N 1 2 304.821 4.117 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC001139011100 1046355253 /nfs/dbraw/zinc/35/52/53/1046355253.db2.gz MENVFMGPNOUXKH-ZDUSSCGKSA-N 1 2 304.821 4.117 20 0 DIADLO CC1=C(C)C[C@H]([C@@H](C)[NH2+][C@@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000639062623 1046356327 /nfs/dbraw/zinc/35/63/27/1046356327.db2.gz RNFAQEQCDDBULP-KBAYOESNSA-N 1 2 310.445 4.009 20 0 DIADLO c1csc(-c2ccc(C[NH+]3CCN(C4CCC4)CC3)s2)c1 ZINC001139017145 1046359118 /nfs/dbraw/zinc/35/91/18/1046359118.db2.gz JIXOHSYDBWXBJX-UHFFFAOYSA-N 1 2 318.511 4.147 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cn1c2ccccc2oc1=S ZINC000748297114 1046364750 /nfs/dbraw/zinc/36/47/50/1046364750.db2.gz QQWGZKSDOMBWNE-UHFFFAOYSA-N 1 2 304.337 4.196 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cn1c2ccccc2oc1=S ZINC000748297114 1046364756 /nfs/dbraw/zinc/36/47/56/1046364756.db2.gz QQWGZKSDOMBWNE-UHFFFAOYSA-N 1 2 304.337 4.196 20 0 DIADLO CC[C@H](C(=O)OCc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000748491041 1046378081 /nfs/dbraw/zinc/37/80/81/1046378081.db2.gz GADFBIXHJWMKBB-IBGZPJMESA-N 1 2 320.392 4.109 20 0 DIADLO Fc1ccc(-c2cccc(C[N@@H+]3Cc4ccncc4C3)c2)cc1 ZINC001139068667 1046378604 /nfs/dbraw/zinc/37/86/04/1046378604.db2.gz WJPQKHOJNQPVIX-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Fc1ccc(-c2cccc(C[N@H+]3Cc4ccncc4C3)c2)cc1 ZINC001139068667 1046378615 /nfs/dbraw/zinc/37/86/15/1046378615.db2.gz WJPQKHOJNQPVIX-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO O=C(/C=C/c1ccccc1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000748517714 1046379786 /nfs/dbraw/zinc/37/97/86/1046379786.db2.gz ZTHWKPMJNQORFJ-RMKNXTFCSA-N 1 2 323.783 4.178 20 0 DIADLO COc1ccc(-c2ccccc2)cc1C[N@@H+]1CCn2cccc2C1 ZINC001139070912 1046381612 /nfs/dbraw/zinc/38/16/12/1046381612.db2.gz ZABVAZHGLQXFBU-UHFFFAOYSA-N 1 2 318.420 4.180 20 0 DIADLO COc1ccc(-c2ccccc2)cc1C[N@H+]1CCn2cccc2C1 ZINC001139070912 1046381627 /nfs/dbraw/zinc/38/16/27/1046381627.db2.gz ZABVAZHGLQXFBU-UHFFFAOYSA-N 1 2 318.420 4.180 20 0 DIADLO OCc1cc[nH+]c(NCc2ccc(-c3ccc(F)cc3)s2)c1 ZINC001202892931 1046384555 /nfs/dbraw/zinc/38/45/55/1046384555.db2.gz PCOHDRIVNRIWQS-UHFFFAOYSA-N 1 2 314.385 4.054 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1ccc(Br)nc1Cl ZINC001139112197 1046386268 /nfs/dbraw/zinc/38/62/68/1046386268.db2.gz KGKAEMNLEWURFT-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1ccc(Br)nc1Cl ZINC001139112197 1046386283 /nfs/dbraw/zinc/38/62/83/1046386283.db2.gz KGKAEMNLEWURFT-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2ccccc2OCc2ccccc2)o1 ZINC000639377018 1046387896 /nfs/dbraw/zinc/38/78/96/1046387896.db2.gz FRAJDDHUYHQNRW-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2ccccc2OCc2ccccc2)o1 ZINC000639377018 1046387908 /nfs/dbraw/zinc/38/79/08/1046387908.db2.gz FRAJDDHUYHQNRW-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2nc(C(C)C)n3ccccc23)s1 ZINC000639383324 1046388091 /nfs/dbraw/zinc/38/80/91/1046388091.db2.gz ZNXNEGNBTNLDOA-GFCCVEGCSA-N 1 2 314.458 4.073 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nc(CC2CC2)no1)c1ccc(Cl)cc1 ZINC000639439152 1046401827 /nfs/dbraw/zinc/40/18/27/1046401827.db2.gz BQLZOWODDKQPIP-QGZVFWFLSA-N 1 2 319.836 4.162 20 0 DIADLO CCOc1ccc(C2=CC[N@H+](Cc3coc(C4CC4)n3)CC2)cc1 ZINC000780767333 1046403294 /nfs/dbraw/zinc/40/32/94/1046403294.db2.gz KWHNEQAJZBMKFC-UHFFFAOYSA-N 1 2 324.424 4.240 20 0 DIADLO CCOc1ccc(C2=CC[N@@H+](Cc3coc(C4CC4)n3)CC2)cc1 ZINC000780767333 1046403299 /nfs/dbraw/zinc/40/32/99/1046403299.db2.gz KWHNEQAJZBMKFC-UHFFFAOYSA-N 1 2 324.424 4.240 20 0 DIADLO CC[N@H+](Cc1nc(C2CCC2)no1)[C@H](C)c1ccc(F)cc1 ZINC000639460264 1046403345 /nfs/dbraw/zinc/40/33/45/1046403345.db2.gz SLIIHEQDGHVVNX-GFCCVEGCSA-N 1 2 303.381 4.059 20 0 DIADLO CC[N@@H+](Cc1nc(C2CCC2)no1)[C@H](C)c1ccc(F)cc1 ZINC000639460264 1046403347 /nfs/dbraw/zinc/40/33/47/1046403347.db2.gz SLIIHEQDGHVVNX-GFCCVEGCSA-N 1 2 303.381 4.059 20 0 DIADLO Clc1cc(C[NH2+][C@H](c2ccccc2)c2ccccn2)ccn1 ZINC000748798872 1046404445 /nfs/dbraw/zinc/40/44/45/1046404445.db2.gz SUTNEAFDWFHFMH-GOSISDBHSA-N 1 2 309.800 4.009 20 0 DIADLO C[N@H+](Cc1ccn(-c2ccccc2)n1)[C@@H]1CCc2ccc(F)cc21 ZINC000748813972 1046406692 /nfs/dbraw/zinc/40/66/92/1046406692.db2.gz RTOROQGERVMAKW-HXUWFJFHSA-N 1 2 321.399 4.131 20 0 DIADLO C[N@@H+](Cc1ccn(-c2ccccc2)n1)[C@@H]1CCc2ccc(F)cc21 ZINC000748813972 1046406700 /nfs/dbraw/zinc/40/67/00/1046406700.db2.gz RTOROQGERVMAKW-HXUWFJFHSA-N 1 2 321.399 4.131 20 0 DIADLO O[C@@H](C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1)c1cc(F)ccc1F ZINC000748825824 1046408530 /nfs/dbraw/zinc/40/85/30/1046408530.db2.gz ZGJJLLBVCBCXSF-SJORKVTESA-N 1 2 323.770 4.099 20 0 DIADLO O[C@@H](C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1)c1cc(F)ccc1F ZINC000748825824 1046408532 /nfs/dbraw/zinc/40/85/32/1046408532.db2.gz ZGJJLLBVCBCXSF-SJORKVTESA-N 1 2 323.770 4.099 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3nc(C4CCC4)no3)CCCC2)cc1 ZINC000639526974 1046409649 /nfs/dbraw/zinc/40/96/49/1046409649.db2.gz MNCMLYKEYCMSKW-UHFFFAOYSA-N 1 2 315.392 4.035 20 0 DIADLO CC(C)c1ccc(C(C)(C)[NH2+]Cc2nc(CC3CC3)no2)cc1 ZINC000639529705 1046409847 /nfs/dbraw/zinc/40/98/47/1046409847.db2.gz KPWIVAAMBTUKDC-UHFFFAOYSA-N 1 2 313.445 4.170 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C2CCC2)no1)c1ccc(Cl)cc1 ZINC000639561079 1046410731 /nfs/dbraw/zinc/41/07/31/1046410731.db2.gz FGCRODOUDGGHGP-AWEZNQCLSA-N 1 2 305.809 4.231 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@H+](C)Cc1cscn1 ZINC000171065029 1046411120 /nfs/dbraw/zinc/41/11/20/1046411120.db2.gz HYAUXBIKUXNVHS-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO C[C@@H](c1cccc(Br)c1)[N@@H+](C)Cc1cscn1 ZINC000171065029 1046411126 /nfs/dbraw/zinc/41/11/26/1046411126.db2.gz HYAUXBIKUXNVHS-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO CC(C)([NH2+]Cc1nc(C2CCC2)no1)c1cccc(Cl)c1 ZINC000639565919 1046412828 /nfs/dbraw/zinc/41/28/28/1046412828.db2.gz NBJUVBIVNYZBFI-UHFFFAOYSA-N 1 2 305.809 4.015 20 0 DIADLO CC(=O)C[NH2+][C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 ZINC000639583682 1046414508 /nfs/dbraw/zinc/41/45/08/1046414508.db2.gz HBVKFUWVXYESKG-SNVBAGLBSA-N 1 2 308.834 4.012 20 0 DIADLO C[C@]1(F)CCC[N@H+](Cc2ccc(Oc3ccccc3)nc2)C1 ZINC001139245248 1046418291 /nfs/dbraw/zinc/41/82/91/1046418291.db2.gz SODOVWMYVQBBAN-SFHVURJKSA-N 1 2 300.377 4.198 20 0 DIADLO C[C@]1(F)CCC[N@@H+](Cc2ccc(Oc3ccccc3)nc2)C1 ZINC001139245248 1046418295 /nfs/dbraw/zinc/41/82/95/1046418295.db2.gz SODOVWMYVQBBAN-SFHVURJKSA-N 1 2 300.377 4.198 20 0 DIADLO C[N@H+](Cc1[nH]c(-c2ccccc2)nc1Cl)Cc1ccccc1 ZINC001139277006 1046421750 /nfs/dbraw/zinc/42/17/50/1046421750.db2.gz HTIUNFOPRFKYDU-UHFFFAOYSA-N 1 2 311.816 4.362 20 0 DIADLO C[N@@H+](Cc1[nH]c(-c2ccccc2)nc1Cl)Cc1ccccc1 ZINC001139277006 1046421756 /nfs/dbraw/zinc/42/17/56/1046421756.db2.gz HTIUNFOPRFKYDU-UHFFFAOYSA-N 1 2 311.816 4.362 20 0 DIADLO COc1ccc(-c2ccc(C[N@@H+]3C[C@@H](F)C[C@H]3CF)s2)cc1 ZINC001139286486 1046426275 /nfs/dbraw/zinc/42/62/75/1046426275.db2.gz RIBRTQIWXYMMAK-KBPBESRZSA-N 1 2 323.408 4.306 20 0 DIADLO COc1ccc(-c2ccc(C[N@H+]3C[C@@H](F)C[C@H]3CF)s2)cc1 ZINC001139286486 1046426283 /nfs/dbraw/zinc/42/62/83/1046426283.db2.gz RIBRTQIWXYMMAK-KBPBESRZSA-N 1 2 323.408 4.306 20 0 DIADLO Clc1cc(Cl)cc(CC[N@@H+]2CCC[C@H]2c2ncccn2)c1 ZINC000639873773 1046431776 /nfs/dbraw/zinc/43/17/76/1046431776.db2.gz VEPXTDYKDQYNAJ-HNNXBMFYSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1cc(Cl)cc(CC[N@H+]2CCC[C@H]2c2ncccn2)c1 ZINC000639873773 1046431782 /nfs/dbraw/zinc/43/17/82/1046431782.db2.gz VEPXTDYKDQYNAJ-HNNXBMFYSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1cccc(CC[N@@H+]2CCC[C@@H]2c2ncccn2)c1Cl ZINC000639872905 1046432669 /nfs/dbraw/zinc/43/26/69/1046432669.db2.gz SGQRRHFYWCQBQE-CQSZACIVSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1cccc(CC[N@H+]2CCC[C@@H]2c2ncccn2)c1Cl ZINC000639872905 1046432673 /nfs/dbraw/zinc/43/26/73/1046432673.db2.gz SGQRRHFYWCQBQE-CQSZACIVSA-N 1 2 322.239 4.163 20 0 DIADLO Fc1c(Br)cccc1C[N@@H+]1CCC[C@H](C(F)F)C1 ZINC001139533216 1046465480 /nfs/dbraw/zinc/46/54/80/1046465480.db2.gz WMZWXNACNGFNAT-JTQLQIEISA-N 1 2 322.168 4.065 20 0 DIADLO CN(Cc1ccc(-n2cc[nH+]c2)cc1)[C@@H](C1CCC1)C(F)(F)F ZINC001139361886 1046438710 /nfs/dbraw/zinc/43/87/10/1046438710.db2.gz CXFAZCAXEBSGOX-INIZCTEOSA-N 1 2 323.362 4.035 20 0 DIADLO FC(F)(F)Sc1cccc(C[N@@H+]2CCOCC23CCC3)c1 ZINC000781337664 1046440471 /nfs/dbraw/zinc/44/04/71/1046440471.db2.gz IULBIJQPXCEHPY-UHFFFAOYSA-N 1 2 317.376 4.053 20 0 DIADLO FC(F)(F)Sc1cccc(C[N@H+]2CCOCC23CCC3)c1 ZINC000781337664 1046440481 /nfs/dbraw/zinc/44/04/81/1046440481.db2.gz IULBIJQPXCEHPY-UHFFFAOYSA-N 1 2 317.376 4.053 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3cnc(C)s3)cs2)o1 ZINC000639993712 1046441355 /nfs/dbraw/zinc/44/13/55/1046441355.db2.gz CTOBWVVTVADIGC-JTQLQIEISA-N 1 2 319.455 4.327 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1ccc(-c3cnccn3)cc1)C2 ZINC001139392909 1046441520 /nfs/dbraw/zinc/44/15/20/1046441520.db2.gz DWQPLGAFBLDJGN-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1ccc(-c3cnccn3)cc1)C2 ZINC001139392909 1046441526 /nfs/dbraw/zinc/44/15/26/1046441526.db2.gz DWQPLGAFBLDJGN-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Cc1noc([C@@H](C)[NH2+][C@@H](c2ccc(CC(C)C)cc2)C2CC2)n1 ZINC000676842789 1046441568 /nfs/dbraw/zinc/44/15/68/1046441568.db2.gz DGRMICLXDBRUGZ-ACJLOTCBSA-N 1 2 313.445 4.378 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2nc(-c3cccs3)oc2C)s1 ZINC000639993561 1046442141 /nfs/dbraw/zinc/44/21/41/1046442141.db2.gz BUAGZPUNKMPUAP-SECBINFHSA-N 1 2 319.455 4.327 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@@H]1CC(C)(C)Oc2ccccc21 ZINC000925274639 1046443410 /nfs/dbraw/zinc/44/34/10/1046443410.db2.gz NOWOZILDEYWFAN-HUUCEWRRSA-N 1 2 312.413 4.252 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1nc(C2CCCC2)no1 ZINC000676889197 1046444298 /nfs/dbraw/zinc/44/42/98/1046444298.db2.gz OTCUAVRXKSNACD-QGZVFWFLSA-N 1 2 311.429 4.237 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1nc(C2CCCC2)no1 ZINC000676889197 1046444303 /nfs/dbraw/zinc/44/43/03/1046444303.db2.gz OTCUAVRXKSNACD-QGZVFWFLSA-N 1 2 311.429 4.237 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCC(=O)[C@@H](C)C23CCCC3)c1 ZINC001137267387 1046444927 /nfs/dbraw/zinc/44/49/27/1046444927.db2.gz YMKIGJMIADZSFM-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCC(=O)[C@@H](C)C23CCCC3)c1 ZINC001137267387 1046444933 /nfs/dbraw/zinc/44/49/33/1046444933.db2.gz YMKIGJMIADZSFM-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO O=C1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)CC[C@@H]1F ZINC001139414895 1046447256 /nfs/dbraw/zinc/44/72/56/1046447256.db2.gz CZFQKIPOWJGOEI-HNNXBMFYSA-N 1 2 321.779 4.103 20 0 DIADLO O=C1CC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)CC[C@@H]1F ZINC001139414895 1046447260 /nfs/dbraw/zinc/44/72/60/1046447260.db2.gz CZFQKIPOWJGOEI-HNNXBMFYSA-N 1 2 321.779 4.103 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)CCC1=O ZINC001139418835 1046449407 /nfs/dbraw/zinc/44/94/07/1046449407.db2.gz YUFSPRUSPSYOKI-UHFFFAOYSA-N 1 2 317.816 4.401 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)CCC1=O ZINC001139418835 1046449410 /nfs/dbraw/zinc/44/94/10/1046449410.db2.gz YUFSPRUSPSYOKI-UHFFFAOYSA-N 1 2 317.816 4.401 20 0 DIADLO C[C@@H]1CCC[C@H](OCc2cccc(NCc3c[nH+]cn3C)c2)C1 ZINC000123860498 1046450908 /nfs/dbraw/zinc/45/09/08/1046450908.db2.gz KUFCZZHQTCDIRM-BEFAXECRSA-N 1 2 313.445 4.128 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(Cl)ccnc2Cl)CCC1(F)F ZINC001139475021 1046452236 /nfs/dbraw/zinc/45/22/36/1046452236.db2.gz LYMWKUCCTUZICA-VIFPVBQESA-N 1 2 309.187 4.256 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(Cl)ccnc2Cl)CCC1(F)F ZINC001139475021 1046452244 /nfs/dbraw/zinc/45/22/44/1046452244.db2.gz LYMWKUCCTUZICA-VIFPVBQESA-N 1 2 309.187 4.256 20 0 DIADLO C[N@H+](CCc1ccc(F)cc1)Cc1c(Cl)ccnc1Cl ZINC001139480038 1046454656 /nfs/dbraw/zinc/45/46/56/1046454656.db2.gz RAOMNFDJGDBOMS-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1ccc(F)cc1)Cc1c(Cl)ccnc1Cl ZINC001139480038 1046454660 /nfs/dbraw/zinc/45/46/60/1046454660.db2.gz RAOMNFDJGDBOMS-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO Fc1ccc(F)c2c1CC[C@H]2[NH2+][C@H]1COc2c1cccc2Cl ZINC000677042299 1046457047 /nfs/dbraw/zinc/45/70/47/1046457047.db2.gz FYKHRUVIRSPSTO-CABCVRRESA-N 1 2 321.754 4.329 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2)cs1 ZINC000042365027 1046458420 /nfs/dbraw/zinc/45/84/20/1046458420.db2.gz JPGLQPOFXVBGDE-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)cs1 ZINC000042365027 1046458423 /nfs/dbraw/zinc/45/84/23/1046458423.db2.gz JPGLQPOFXVBGDE-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc(-c3ccccc3)nc1)C2 ZINC001139519472 1046461945 /nfs/dbraw/zinc/46/19/45/1046461945.db2.gz QXSGYVBVYPKADK-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc(-c3ccccc3)nc1)C2 ZINC001139519472 1046461950 /nfs/dbraw/zinc/46/19/50/1046461950.db2.gz QXSGYVBVYPKADK-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2ccc(OCC(C)C)cc2)cs1 ZINC000125022307 1046462508 /nfs/dbraw/zinc/46/25/08/1046462508.db2.gz FXPGXZFWIKFHMV-UHFFFAOYSA-N 1 2 304.459 4.118 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2ccc(OCC(C)C)cc2)cs1 ZINC000125022307 1046462514 /nfs/dbraw/zinc/46/25/14/1046462514.db2.gz FXPGXZFWIKFHMV-UHFFFAOYSA-N 1 2 304.459 4.118 20 0 DIADLO Fc1c(Br)cccc1C[N@H+]1CCC[C@H](C(F)F)C1 ZINC001139533216 1046465478 /nfs/dbraw/zinc/46/54/78/1046465478.db2.gz WMZWXNACNGFNAT-JTQLQIEISA-N 1 2 322.168 4.065 20 0 DIADLO Clc1cccc(C[N@H+](Cc2ccccc2)Cc2ccccn2)n1 ZINC001139547506 1046468090 /nfs/dbraw/zinc/46/80/90/1046468090.db2.gz IOSMACUTFVEFDR-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1cccc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)n1 ZINC001139547506 1046468097 /nfs/dbraw/zinc/46/80/97/1046468097.db2.gz IOSMACUTFVEFDR-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO CC(C)[N@H+](Cc1csc(-c2ccco2)n1)Cc1cccnc1 ZINC000125666874 1046470376 /nfs/dbraw/zinc/47/03/76/1046470376.db2.gz VVDCNKJYTFXILA-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)[N@@H+](Cc1csc(-c2ccco2)n1)Cc1cccnc1 ZINC000125666874 1046470379 /nfs/dbraw/zinc/47/03/79/1046470379.db2.gz VVDCNKJYTFXILA-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)[N@H+](Cc1ncc(-c2ccccc2)o1)Cc1cccnc1 ZINC000125697913 1046472145 /nfs/dbraw/zinc/47/21/45/1046472145.db2.gz OWUTYYHLKGLNEE-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO CC(C)[N@@H+](Cc1ncc(-c2ccccc2)o1)Cc1cccnc1 ZINC000125697913 1046472148 /nfs/dbraw/zinc/47/21/48/1046472148.db2.gz OWUTYYHLKGLNEE-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO Clc1ccnc(C[N@H+](Cc2ccccc2)Cc2cccnc2)c1 ZINC001139562070 1046472722 /nfs/dbraw/zinc/47/27/22/1046472722.db2.gz HBCXRNRKEHGTDD-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1ccnc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)c1 ZINC001139562070 1046472728 /nfs/dbraw/zinc/47/27/28/1046472728.db2.gz HBCXRNRKEHGTDD-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Cc1occc1C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000044568405 1046476226 /nfs/dbraw/zinc/47/62/26/1046476226.db2.gz UEIIFNKNPMOTRE-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO CCCCC[C@H](CC)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258446671 1046479300 /nfs/dbraw/zinc/47/93/00/1046479300.db2.gz TXRBPUPJFBZGJD-LBPRGKRZSA-N 1 2 303.372 4.076 20 0 DIADLO CCCCC[C@H](CC)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258446671 1046479305 /nfs/dbraw/zinc/47/93/05/1046479305.db2.gz TXRBPUPJFBZGJD-LBPRGKRZSA-N 1 2 303.372 4.076 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)Cc1cc(C)c(C)cc1OC(F)F ZINC000091812851 1046483416 /nfs/dbraw/zinc/48/34/16/1046483416.db2.gz QAWYLPPBXMKRBD-UHFFFAOYSA-N 1 2 324.371 4.142 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)Cc1cc(C)c(C)cc1OC(F)F ZINC000091812851 1046483422 /nfs/dbraw/zinc/48/34/22/1046483422.db2.gz QAWYLPPBXMKRBD-UHFFFAOYSA-N 1 2 324.371 4.142 20 0 DIADLO Clc1nccc(C[NH+]2CCC(c3ccco3)CC2)c1Cl ZINC000826878113 1046489207 /nfs/dbraw/zinc/48/92/07/1046489207.db2.gz TVQIDBDDTZAIJN-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO Cc1csc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c1Cl ZINC001137291346 1046489713 /nfs/dbraw/zinc/48/97/13/1046489713.db2.gz PCFICFIJTSBRPN-AWEZNQCLSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1csc(C[N@H+]2CCO[C@H](c3ccccc3)C2)c1Cl ZINC001137291346 1046489715 /nfs/dbraw/zinc/48/97/15/1046489715.db2.gz PCFICFIJTSBRPN-AWEZNQCLSA-N 1 2 307.846 4.283 20 0 DIADLO CCOc1ccncc1C[N@@H+]1CCCC[C@@H]1c1ccccc1F ZINC001139630858 1046490613 /nfs/dbraw/zinc/49/06/13/1046490613.db2.gz NGQUEOGKTNLKKQ-GOSISDBHSA-N 1 2 314.404 4.347 20 0 DIADLO CCOc1ccncc1C[N@H+]1CCCC[C@@H]1c1ccccc1F ZINC001139630858 1046490619 /nfs/dbraw/zinc/49/06/19/1046490619.db2.gz NGQUEOGKTNLKKQ-GOSISDBHSA-N 1 2 314.404 4.347 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1nccn1C)c1cccc(F)c1)c1cccs1 ZINC000128403904 1046493401 /nfs/dbraw/zinc/49/34/01/1046493401.db2.gz NIQGUYIWOSQKQG-MLGOLLRUSA-N 1 2 315.417 4.061 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1ncc(C(C)C)o1)[C@H]2C ZINC000782096778 1046494369 /nfs/dbraw/zinc/49/43/69/1046494369.db2.gz GCCDTRFZCMETTG-KGLIPLIRSA-N 1 2 314.429 4.314 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1ncc(C(C)C)o1)[C@H]2C ZINC000782096778 1046494375 /nfs/dbraw/zinc/49/43/75/1046494375.db2.gz GCCDTRFZCMETTG-KGLIPLIRSA-N 1 2 314.429 4.314 20 0 DIADLO CCc1nc(C[N@H+](C)[C@H]2CCc3cc(Cl)ccc32)cs1 ZINC000782180103 1046497081 /nfs/dbraw/zinc/49/70/81/1046497081.db2.gz DXQPUDXIWYWRET-HNNXBMFYSA-N 1 2 306.862 4.478 20 0 DIADLO CCc1nc(C[N@@H+](C)[C@H]2CCc3cc(Cl)ccc32)cs1 ZINC000782180103 1046497085 /nfs/dbraw/zinc/49/70/85/1046497085.db2.gz DXQPUDXIWYWRET-HNNXBMFYSA-N 1 2 306.862 4.478 20 0 DIADLO Cc1cccc2nc(C[N@@H+]3CCC[C@H]3c3ccccc3F)cn21 ZINC001137300733 1046498260 /nfs/dbraw/zinc/49/82/60/1046498260.db2.gz OZDMPKAKYIGSER-SFHVURJKSA-N 1 2 309.388 4.119 20 0 DIADLO Cc1cccc2nc(C[N@H+]3CCC[C@H]3c3ccccc3F)cn21 ZINC001137300733 1046498263 /nfs/dbraw/zinc/49/82/63/1046498263.db2.gz OZDMPKAKYIGSER-SFHVURJKSA-N 1 2 309.388 4.119 20 0 DIADLO c1sc(C2CC2)nc1C[N@@H+]1CCS[C@H](c2ccccc2)C1 ZINC000677555571 1046502622 /nfs/dbraw/zinc/50/26/22/1046502622.db2.gz IOKXFGVWUHZBGE-INIZCTEOSA-N 1 2 316.495 4.311 20 0 DIADLO c1sc(C2CC2)nc1C[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000677555571 1046502632 /nfs/dbraw/zinc/50/26/32/1046502632.db2.gz IOKXFGVWUHZBGE-INIZCTEOSA-N 1 2 316.495 4.311 20 0 DIADLO Cc1cc(O)cc(C)c1C[N@@H+](C)Cc1csc(C(C)C)n1 ZINC001139714443 1046504150 /nfs/dbraw/zinc/50/41/50/1046504150.db2.gz ARUXNPGSSQIJHX-UHFFFAOYSA-N 1 2 304.459 4.221 20 0 DIADLO Cc1cc(O)cc(C)c1C[N@H+](C)Cc1csc(C(C)C)n1 ZINC001139714443 1046504158 /nfs/dbraw/zinc/50/41/58/1046504158.db2.gz ARUXNPGSSQIJHX-UHFFFAOYSA-N 1 2 304.459 4.221 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@@](C)(F)C2)cc1Br ZINC001139728664 1046505956 /nfs/dbraw/zinc/50/59/56/1046505956.db2.gz CRQMFBXDDTVWIR-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@@](C)(F)C2)cc1Br ZINC001139728664 1046505966 /nfs/dbraw/zinc/50/59/66/1046505966.db2.gz CRQMFBXDDTVWIR-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2nc3ccccc3[nH]2)s1 ZINC000130191163 1046510158 /nfs/dbraw/zinc/51/01/58/1046510158.db2.gz UHOAZCNCEDTCFP-LBPRGKRZSA-N 1 2 314.458 4.083 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2nc3ccccc3[nH]2)s1 ZINC000130191163 1046510169 /nfs/dbraw/zinc/51/01/69/1046510169.db2.gz UHOAZCNCEDTCFP-LBPRGKRZSA-N 1 2 314.458 4.083 20 0 DIADLO Nc1cnccc1C[NH2+]C1(c2c(Cl)cccc2Cl)CCC1 ZINC000641750121 1046510501 /nfs/dbraw/zinc/51/05/01/1046510501.db2.gz HZSADJROXNQXDW-UHFFFAOYSA-N 1 2 322.239 4.140 20 0 DIADLO C[C@H](c1cccc(Br)c1)[NH+]1CC2(C1)CC(F)(F)C2 ZINC000677730133 1046519526 /nfs/dbraw/zinc/51/95/26/1046519526.db2.gz CIAOCMHBIDMALN-SNVBAGLBSA-N 1 2 316.189 4.241 20 0 DIADLO C[C@@H](c1ncc(-c2ccccc2)o1)[NH+]1CC2(C1)CC(F)(F)C2 ZINC000677738502 1046520703 /nfs/dbraw/zinc/52/07/03/1046520703.db2.gz IMISSTHNHSQLPW-LBPRGKRZSA-N 1 2 304.340 4.134 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)s2)s1 ZINC001139818310 1046523345 /nfs/dbraw/zinc/52/33/45/1046523345.db2.gz BRVITVMDOBLLKX-SNVBAGLBSA-N 1 2 314.863 4.204 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)s1 ZINC001139818310 1046523350 /nfs/dbraw/zinc/52/33/50/1046523350.db2.gz BRVITVMDOBLLKX-SNVBAGLBSA-N 1 2 314.863 4.204 20 0 DIADLO COc1ncc(C[N@H+](C)Cc2cc(Cl)cc(Cl)c2)s1 ZINC001139818154 1046523558 /nfs/dbraw/zinc/52/35/58/1046523558.db2.gz WCEUOJXAIJZNLX-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO COc1ncc(C[N@@H+](C)Cc2cc(Cl)cc(Cl)c2)s1 ZINC001139818154 1046523566 /nfs/dbraw/zinc/52/35/66/1046523566.db2.gz WCEUOJXAIJZNLX-UHFFFAOYSA-N 1 2 317.241 4.091 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)s1 ZINC001139817237 1046524134 /nfs/dbraw/zinc/52/41/34/1046524134.db2.gz DGCZIJCPUOCRIU-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)s1 ZINC001139817237 1046524142 /nfs/dbraw/zinc/52/41/42/1046524142.db2.gz DGCZIJCPUOCRIU-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000641959458 1046532315 /nfs/dbraw/zinc/53/23/15/1046532315.db2.gz CSYKSFWZFPVEOV-KSSFIOAISA-N 1 2 301.817 4.475 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000641959458 1046532325 /nfs/dbraw/zinc/53/23/25/1046532325.db2.gz CSYKSFWZFPVEOV-KSSFIOAISA-N 1 2 301.817 4.475 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@H]2c2cccc(F)c2)cc1Cl ZINC000677891723 1046535234 /nfs/dbraw/zinc/53/52/34/1046535234.db2.gz DZACVYQULDRIRS-INIZCTEOSA-N 1 2 305.780 4.435 20 0 DIADLO COc1ccc(C[N@H+]2CC[C@H]2c2cccc(F)c2)cc1Cl ZINC000677891723 1046535245 /nfs/dbraw/zinc/53/52/45/1046535245.db2.gz DZACVYQULDRIRS-INIZCTEOSA-N 1 2 305.780 4.435 20 0 DIADLO C[NH+](C)c1ccc(N[C@H](c2ccccc2)C2CCOCC2)cc1 ZINC000782782584 1046544196 /nfs/dbraw/zinc/54/41/96/1046544196.db2.gz WIXGODGPYYONMG-HXUWFJFHSA-N 1 2 310.441 4.332 20 0 DIADLO Cc1cccc(-c2nnc([C@@H](C)[NH2+][C@H](C)c3cnccc3C)o2)c1 ZINC000783001379 1046551847 /nfs/dbraw/zinc/55/18/47/1046551847.db2.gz FWJADSPOOBOEMG-HUUCEWRRSA-N 1 2 322.412 4.160 20 0 DIADLO OCCC1CC[NH+](Cc2c(Cl)ccc(Cl)c2Cl)CC1 ZINC000678133818 1046559888 /nfs/dbraw/zinc/55/98/88/1046559888.db2.gz KYPBLTZKRDVEKA-UHFFFAOYSA-N 1 2 322.663 4.241 20 0 DIADLO Clc1nc(C[NH+]2CCC3(CCc4ccccc43)CC2)cs1 ZINC001139975445 1046561206 /nfs/dbraw/zinc/56/12/06/1046561206.db2.gz BTXPWWDWZLQGLS-UHFFFAOYSA-N 1 2 318.873 4.277 20 0 DIADLO NC(Cc1cccc(F)c1)=[NH+]OCCCc1ccccc1Cl ZINC000783156446 1046561114 /nfs/dbraw/zinc/56/11/14/1046561114.db2.gz FVQUWLOYBLRPPZ-UHFFFAOYSA-N 1 2 320.795 4.153 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1[nH]nc2ccccc21 ZINC000678126470 1046563113 /nfs/dbraw/zinc/56/31/13/1046563113.db2.gz UUHSBZDMJOJVFB-GFCCVEGCSA-N 1 2 322.437 4.366 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1[nH]nc2ccccc21 ZINC000678126470 1046563127 /nfs/dbraw/zinc/56/31/27/1046563127.db2.gz UUHSBZDMJOJVFB-GFCCVEGCSA-N 1 2 322.437 4.366 20 0 DIADLO CC[N@H+](Cc1nn(C)c2ccccc12)Cc1ccccc1Cl ZINC000678141744 1046568702 /nfs/dbraw/zinc/56/87/02/1046568702.db2.gz PXSUZZLINHNAQU-UHFFFAOYSA-N 1 2 313.832 4.249 20 0 DIADLO CC[N@@H+](Cc1nn(C)c2ccccc12)Cc1ccccc1Cl ZINC000678141744 1046568716 /nfs/dbraw/zinc/56/87/16/1046568716.db2.gz PXSUZZLINHNAQU-UHFFFAOYSA-N 1 2 313.832 4.249 20 0 DIADLO c1ccc([C@H]2CC[C@@H]([NH2+]c3ccc(N4CCOCC4)cc3)C2)cc1 ZINC000783267889 1046570786 /nfs/dbraw/zinc/57/07/86/1046570786.db2.gz LUZGFFAPXMJVIL-AZUAARDMSA-N 1 2 322.452 4.271 20 0 DIADLO CSc1nccc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)n1 ZINC001140038074 1046574648 /nfs/dbraw/zinc/57/46/48/1046574648.db2.gz MOVQPWATXKHHJF-OAHLLOKOSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1nccc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)n1 ZINC001140038074 1046574665 /nfs/dbraw/zinc/57/46/65/1046574665.db2.gz MOVQPWATXKHHJF-OAHLLOKOSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1nccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)n1 ZINC001140037841 1046575425 /nfs/dbraw/zinc/57/54/25/1046575425.db2.gz DXSLEXDABRSWDM-MRXNPFEDSA-N 1 2 317.433 4.065 20 0 DIADLO CSc1nccc(C[N@H+]2CCCC[C@@H]2c2ccccc2F)n1 ZINC001140037841 1046575438 /nfs/dbraw/zinc/57/54/38/1046575438.db2.gz DXSLEXDABRSWDM-MRXNPFEDSA-N 1 2 317.433 4.065 20 0 DIADLO C[C@@H]1CCCC[N@H+](Cc2cnc(Br)cc2Cl)C1 ZINC001140074804 1046581409 /nfs/dbraw/zinc/58/14/09/1046581409.db2.gz TZIGKWSUTHNJDE-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1CCCC[N@@H+](Cc2cnc(Br)cc2Cl)C1 ZINC001140074804 1046581419 /nfs/dbraw/zinc/58/14/19/1046581419.db2.gz TZIGKWSUTHNJDE-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO c1nc(C2CCCC2)sc1C[N@@H+]1CCOc2ccccc2C1 ZINC000678196400 1046582173 /nfs/dbraw/zinc/58/21/73/1046582173.db2.gz PKCWFRAHCPJDHC-UHFFFAOYSA-N 1 2 314.454 4.195 20 0 DIADLO c1nc(C2CCCC2)sc1C[N@H+]1CCOc2ccccc2C1 ZINC000678196400 1046582188 /nfs/dbraw/zinc/58/21/88/1046582188.db2.gz PKCWFRAHCPJDHC-UHFFFAOYSA-N 1 2 314.454 4.195 20 0 DIADLO CCC1CC[NH+](Cc2cnc(Br)cc2Cl)CC1 ZINC001140074485 1046582445 /nfs/dbraw/zinc/58/24/45/1046582445.db2.gz MTGHFLMCEDHKRR-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@@H](c1ccccc1)[N@H+](C)Cc1n[nH]c2ccc(OC)cc21 ZINC001140069305 1046582660 /nfs/dbraw/zinc/58/26/60/1046582660.db2.gz RDCUPCWTDHAMPR-IBGZPJMESA-N 1 2 309.413 4.155 20 0 DIADLO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1n[nH]c2ccc(OC)cc21 ZINC001140069305 1046582663 /nfs/dbraw/zinc/58/26/63/1046582663.db2.gz RDCUPCWTDHAMPR-IBGZPJMESA-N 1 2 309.413 4.155 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1cc(-c2ccccc2)n[nH]1 ZINC000678196831 1046584786 /nfs/dbraw/zinc/58/47/86/1046584786.db2.gz JNPMAZODZFMLNZ-OAHLLOKOSA-N 1 2 319.408 4.032 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1cc(-c2ccccc2)n[nH]1 ZINC000678196831 1046584800 /nfs/dbraw/zinc/58/48/00/1046584800.db2.gz JNPMAZODZFMLNZ-OAHLLOKOSA-N 1 2 319.408 4.032 20 0 DIADLO C[N@H+](Cc1cncs1)Cc1cnc(-c2ccc(F)cc2)s1 ZINC001140099220 1046589197 /nfs/dbraw/zinc/58/91/97/1046589197.db2.gz XXFSNZMWLVKIAA-UHFFFAOYSA-N 1 2 319.430 4.038 20 0 DIADLO C[N@@H+](Cc1cncs1)Cc1cnc(-c2ccc(F)cc2)s1 ZINC001140099220 1046589210 /nfs/dbraw/zinc/58/92/10/1046589210.db2.gz XXFSNZMWLVKIAA-UHFFFAOYSA-N 1 2 319.430 4.038 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cc(C(F)(F)F)ccn1 ZINC001140108955 1046592767 /nfs/dbraw/zinc/59/27/67/1046592767.db2.gz UYUJGIQRMGCTPE-GFCCVEGCSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cc(C(F)(F)F)ccn1 ZINC001140108955 1046592784 /nfs/dbraw/zinc/59/27/84/1046592784.db2.gz UYUJGIQRMGCTPE-GFCCVEGCSA-N 1 2 306.331 4.047 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c(F)c1 ZINC001140128126 1046594600 /nfs/dbraw/zinc/59/46/00/1046594600.db2.gz IALLXCPKJVRNBF-KRWDZBQOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)c(F)c1 ZINC001140128126 1046594614 /nfs/dbraw/zinc/59/46/14/1046594614.db2.gz IALLXCPKJVRNBF-KRWDZBQOSA-N 1 2 307.315 4.147 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)cc1F ZINC000678236600 1046597146 /nfs/dbraw/zinc/59/71/46/1046597146.db2.gz PCFNGWPSEWFPDE-SFHVURJKSA-N 1 2 321.342 4.068 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)Cc3ccc(F)cc3)cs2)o1 ZINC000642328661 1046597031 /nfs/dbraw/zinc/59/70/31/1046597031.db2.gz ABGSETZSMLEQEC-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)Cc3ccc(F)cc3)cs2)o1 ZINC000642328661 1046597039 /nfs/dbraw/zinc/59/70/39/1046597039.db2.gz ABGSETZSMLEQEC-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CCCO[C@H](c3ccccc3)C2)cc1F ZINC000678236600 1046597160 /nfs/dbraw/zinc/59/71/60/1046597160.db2.gz PCFNGWPSEWFPDE-SFHVURJKSA-N 1 2 321.342 4.068 20 0 DIADLO Cc1ccc(OCC[N@@H+](C)Cc2csc(C(C)(C)C)n2)cc1 ZINC000642328896 1046597496 /nfs/dbraw/zinc/59/74/96/1046597496.db2.gz HOHWNKKKZORHIA-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO Cc1ccc(OCC[N@H+](C)Cc2csc(C(C)(C)C)n2)cc1 ZINC000642328896 1046597507 /nfs/dbraw/zinc/59/75/07/1046597507.db2.gz HOHWNKKKZORHIA-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c(F)c1 ZINC001140130079 1046597608 /nfs/dbraw/zinc/59/76/08/1046597608.db2.gz HHLHZSXHYXCFBG-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c(F)c1 ZINC001140130079 1046597618 /nfs/dbraw/zinc/59/76/18/1046597618.db2.gz HHLHZSXHYXCFBG-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO COCc1ccc(C[N@H+](C)[C@@H](C)c2c(F)cccc2F)cc1 ZINC000536638040 1046598385 /nfs/dbraw/zinc/59/83/85/1046598385.db2.gz QYBLEUUAKGISIU-ZDUSSCGKSA-N 1 2 305.368 4.304 20 0 DIADLO COCc1ccc(C[N@@H+](C)[C@@H](C)c2c(F)cccc2F)cc1 ZINC000536638040 1046598391 /nfs/dbraw/zinc/59/83/91/1046598391.db2.gz QYBLEUUAKGISIU-ZDUSSCGKSA-N 1 2 305.368 4.304 20 0 DIADLO OCC[C@H]1CCC[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC000678240715 1046598443 /nfs/dbraw/zinc/59/84/43/1046598443.db2.gz YEGWKCXKFKNUOZ-SNVBAGLBSA-N 1 2 322.663 4.241 20 0 DIADLO OCC[C@H]1CCC[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC000678240715 1046598454 /nfs/dbraw/zinc/59/84/54/1046598454.db2.gz YEGWKCXKFKNUOZ-SNVBAGLBSA-N 1 2 322.663 4.241 20 0 DIADLO COc1ccc(Br)c(C[N@H+](C)[C@@H](C)c2ccco2)c1 ZINC000536638589 1046600435 /nfs/dbraw/zinc/60/04/35/1046600435.db2.gz TVXIKKUMJVZZOR-NSHDSACASA-N 1 2 324.218 4.244 20 0 DIADLO COc1ccc(Br)c(C[N@@H+](C)[C@@H](C)c2ccco2)c1 ZINC000536638589 1046600439 /nfs/dbraw/zinc/60/04/39/1046600439.db2.gz TVXIKKUMJVZZOR-NSHDSACASA-N 1 2 324.218 4.244 20 0 DIADLO COc1ccc(OC)c(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)c1 ZINC000536637874 1046601457 /nfs/dbraw/zinc/60/14/57/1046601457.db2.gz YTKYHIVRPAIDLZ-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc(OC)c(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)c1 ZINC000536637874 1046601464 /nfs/dbraw/zinc/60/14/64/1046601464.db2.gz YTKYHIVRPAIDLZ-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO Fc1cc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)cc(F)c1F ZINC000678266715 1046603674 /nfs/dbraw/zinc/60/36/74/1046603674.db2.gz HHZREORHVNJZST-INIZCTEOSA-N 1 2 323.383 4.394 20 0 DIADLO Fc1cc(C[N@H+]2CCS[C@H](c3ccccc3)C2)cc(F)c1F ZINC000678266715 1046603684 /nfs/dbraw/zinc/60/36/84/1046603684.db2.gz HHZREORHVNJZST-INIZCTEOSA-N 1 2 323.383 4.394 20 0 DIADLO C[N@H+](Cc1cn[nH]c1)Cc1cc(Cl)ccc1OC1CCCC1 ZINC000678266782 1046603820 /nfs/dbraw/zinc/60/38/20/1046603820.db2.gz UBMZCUSJQMVIJP-UHFFFAOYSA-N 1 2 319.836 4.017 20 0 DIADLO C[N@@H+](Cc1cn[nH]c1)Cc1cc(Cl)ccc1OC1CCCC1 ZINC000678266782 1046603824 /nfs/dbraw/zinc/60/38/24/1046603824.db2.gz UBMZCUSJQMVIJP-UHFFFAOYSA-N 1 2 319.836 4.017 20 0 DIADLO CC(C)=CCC[C@H](C)[NH2+]c1ccc(N2CCOCC2)c(C)c1 ZINC000783538039 1046605185 /nfs/dbraw/zinc/60/51/85/1046605185.db2.gz VAAHBBHYLREJIE-KRWDZBQOSA-N 1 2 302.462 4.378 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2c(s1)CCC2)c1ccc(F)cc1F ZINC000093076159 1046607017 /nfs/dbraw/zinc/60/70/17/1046607017.db2.gz MDDLFVMPNRCYEH-CYBMUJFWSA-N 1 2 308.397 4.151 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CCC[C@H]2c2cccs2)cs1 ZINC000245470979 1046606853 /nfs/dbraw/zinc/60/68/53/1046606853.db2.gz NKPUWXVLWCUXFI-AAEUAGOBSA-N 1 2 308.472 4.249 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CCC[C@H]2c2cccs2)cs1 ZINC000245470979 1046606861 /nfs/dbraw/zinc/60/68/61/1046606861.db2.gz NKPUWXVLWCUXFI-AAEUAGOBSA-N 1 2 308.472 4.249 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2c(s1)CCC2)c1cc(F)ccc1F ZINC000093076508 1046607690 /nfs/dbraw/zinc/60/76/90/1046607690.db2.gz ZTEAJZDUCJHOMJ-CYBMUJFWSA-N 1 2 308.397 4.151 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ncccc1C(F)(F)F ZINC000678279183 1046608347 /nfs/dbraw/zinc/60/83/47/1046608347.db2.gz KJAVUAMAPUFGJX-LBPRGKRZSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ncccc1C(F)(F)F ZINC000678279183 1046608356 /nfs/dbraw/zinc/60/83/56/1046608356.db2.gz KJAVUAMAPUFGJX-LBPRGKRZSA-N 1 2 306.331 4.047 20 0 DIADLO Clc1cscc1C[N@@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000678278053 1046608909 /nfs/dbraw/zinc/60/89/09/1046608909.db2.gz SLTPBFVFEGPTRV-QGZVFWFLSA-N 1 2 319.857 4.075 20 0 DIADLO Clc1cscc1C[N@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000678278053 1046608915 /nfs/dbraw/zinc/60/89/15/1046608915.db2.gz SLTPBFVFEGPTRV-QGZVFWFLSA-N 1 2 319.857 4.075 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cn3cccc(F)c3n2)[C@H](c2ccco2)C1 ZINC000678285960 1046613884 /nfs/dbraw/zinc/61/38/84/1046613884.db2.gz QXESUJCTLADFEG-BBRMVZONSA-N 1 2 313.376 4.040 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cn3cccc(F)c3n2)[C@H](c2ccco2)C1 ZINC000678285960 1046613889 /nfs/dbraw/zinc/61/38/89/1046613889.db2.gz QXESUJCTLADFEG-BBRMVZONSA-N 1 2 313.376 4.040 20 0 DIADLO C[N@H+](Cc1ccc2oc3ccccc3c2c1)[C@H]1CC(C)(C)OC1=O ZINC000795663214 1046614763 /nfs/dbraw/zinc/61/47/63/1046614763.db2.gz YWYHHCAZZOSSJU-INIZCTEOSA-N 1 2 323.392 4.112 20 0 DIADLO C[N@@H+](Cc1ccc2oc3ccccc3c2c1)[C@H]1CC(C)(C)OC1=O ZINC000795663214 1046614768 /nfs/dbraw/zinc/61/47/68/1046614768.db2.gz YWYHHCAZZOSSJU-INIZCTEOSA-N 1 2 323.392 4.112 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2n[nH]c3ccccc32)s1 ZINC000678314639 1046617924 /nfs/dbraw/zinc/61/79/24/1046617924.db2.gz MZELKHGJVPFSLQ-LBPRGKRZSA-N 1 2 314.458 4.083 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2n[nH]c3ccccc32)s1 ZINC000678314639 1046617927 /nfs/dbraw/zinc/61/79/27/1046617927.db2.gz MZELKHGJVPFSLQ-LBPRGKRZSA-N 1 2 314.458 4.083 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@H+]1Cc1noc2c1CCCC2 ZINC000678316136 1046620011 /nfs/dbraw/zinc/62/00/11/1046620011.db2.gz ZVEUTQHDIPJECV-QWHCGFSZSA-N 1 2 314.404 4.200 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@@H+]1Cc1noc2c1CCCC2 ZINC000678316136 1046620015 /nfs/dbraw/zinc/62/00/15/1046620015.db2.gz ZVEUTQHDIPJECV-QWHCGFSZSA-N 1 2 314.404 4.200 20 0 DIADLO Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1cccc(Cl)c1Cl ZINC000678337464 1046620759 /nfs/dbraw/zinc/62/07/59/1046620759.db2.gz QNJJGQVXKSGFLX-OAHLLOKOSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1cccc(Cl)c1Cl ZINC000678337464 1046620766 /nfs/dbraw/zinc/62/07/66/1046620766.db2.gz QNJJGQVXKSGFLX-OAHLLOKOSA-N 1 2 324.255 4.372 20 0 DIADLO C[N@@H+](Cc1c[nH]c2cccc(O)c12)Cc1nc2ccccc2s1 ZINC001140230065 1046620843 /nfs/dbraw/zinc/62/08/43/1046620843.db2.gz MRLRKEOGHBFLGA-UHFFFAOYSA-N 1 2 323.421 4.115 20 0 DIADLO C[N@H+](Cc1c[nH]c2cccc(O)c12)Cc1nc2ccccc2s1 ZINC001140230065 1046620850 /nfs/dbraw/zinc/62/08/50/1046620850.db2.gz MRLRKEOGHBFLGA-UHFFFAOYSA-N 1 2 323.421 4.115 20 0 DIADLO Oc1cccc2[nH]cc(C[N@@H+]3CCc4c5ccccc5oc4C3)c21 ZINC001140235019 1046621486 /nfs/dbraw/zinc/62/14/86/1046621486.db2.gz OBDXBSOKNSSHTF-UHFFFAOYSA-N 1 2 318.376 4.178 20 0 DIADLO Oc1cccc2[nH]cc(C[N@H+]3CCc4c5ccccc5oc4C3)c21 ZINC001140235019 1046621492 /nfs/dbraw/zinc/62/14/92/1046621492.db2.gz OBDXBSOKNSSHTF-UHFFFAOYSA-N 1 2 318.376 4.178 20 0 DIADLO Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1cccc(Cl)c1Cl ZINC000678337463 1046622049 /nfs/dbraw/zinc/62/20/49/1046622049.db2.gz QNJJGQVXKSGFLX-HNNXBMFYSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1cccc(Cl)c1Cl ZINC000678337463 1046622054 /nfs/dbraw/zinc/62/20/54/1046622054.db2.gz QNJJGQVXKSGFLX-HNNXBMFYSA-N 1 2 324.255 4.372 20 0 DIADLO C[C@@H]1CSCC[N@@H+]1Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000532967843 1046630617 /nfs/dbraw/zinc/63/06/17/1046630617.db2.gz IWHMLXPEMNSVKC-LLVKDONJSA-N 1 2 324.902 4.401 20 0 DIADLO C[C@@H]1CSCC[N@H+]1Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000532967843 1046630624 /nfs/dbraw/zinc/63/06/24/1046630624.db2.gz IWHMLXPEMNSVKC-LLVKDONJSA-N 1 2 324.902 4.401 20 0 DIADLO CCC[C@H]([NH2+]c1ccc(N2CCC(O)CC2)cc1)C1CCC1 ZINC000834709918 1046654101 /nfs/dbraw/zinc/65/41/01/1046654101.db2.gz OHSSYGYHQTWMMB-IBGZPJMESA-N 1 2 302.462 4.028 20 0 DIADLO c1csc(-c2cccc(C[NH+]3CC(Oc4ccccc4)C3)c2)n1 ZINC001140335064 1046662495 /nfs/dbraw/zinc/66/24/95/1046662495.db2.gz MZIMUUIVGNCNPI-UHFFFAOYSA-N 1 2 322.433 4.073 20 0 DIADLO Cc1ccc2n[nH]c(C[N@@H+]3CCc4cccc(Cl)c4C3)c2c1 ZINC001140333964 1046663053 /nfs/dbraw/zinc/66/30/53/1046663053.db2.gz YEWCQBDSRAGSGA-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1ccc2n[nH]c(C[N@H+]3CCc4cccc(Cl)c4C3)c2c1 ZINC001140333964 1046663059 /nfs/dbraw/zinc/66/30/59/1046663059.db2.gz YEWCQBDSRAGSGA-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H]2CCOc3ccc(F)cc32)c(C)s1 ZINC000678584012 1046663309 /nfs/dbraw/zinc/66/33/09/1046663309.db2.gz KWUOJCCDPUZPCY-LKFCYVNXSA-N 1 2 306.406 4.073 20 0 DIADLO Cc1nc(C)c([C@@H](C)[NH2+]Cc2c(F)c(F)cc(F)c2F)s1 ZINC000678594368 1046667939 /nfs/dbraw/zinc/66/79/39/1046667939.db2.gz BOYQOEOCKDJPQY-ZCFIWIBFSA-N 1 2 318.339 4.167 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)c(C)s1 ZINC000678597947 1046670927 /nfs/dbraw/zinc/67/09/27/1046670927.db2.gz NFKNNVYKRRBOIF-SDBXPKJASA-N 1 2 308.834 4.198 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H]2COc3c2cccc3Cl)c(C)s1 ZINC000678597282 1046671032 /nfs/dbraw/zinc/67/10/32/1046671032.db2.gz CMSKHXIWCUIECD-SDBXPKJASA-N 1 2 308.834 4.198 20 0 DIADLO Clc1cc2c(c(Cl)c1)[C@@H]([NH2+][C@@H]1CCCc3cn[nH]c31)CC2 ZINC000678598345 1046672212 /nfs/dbraw/zinc/67/22/12/1046672212.db2.gz FWADYMRRZPQFPH-UONOGXRCSA-N 1 2 322.239 4.371 20 0 DIADLO Clc1cc2c(c(Cl)c1)[C@@H]([NH2+][C@@H]1CCCc3c[nH]nc31)CC2 ZINC000678598345 1046672213 /nfs/dbraw/zinc/67/22/13/1046672213.db2.gz FWADYMRRZPQFPH-UONOGXRCSA-N 1 2 322.239 4.371 20 0 DIADLO CCCCCn1cc(C[NH2+][C@@H](C)c2nc(C)sc2C)c(C)n1 ZINC000678610172 1046678316 /nfs/dbraw/zinc/67/83/16/1046678316.db2.gz HMQXCOAIRCJZHB-ZDUSSCGKSA-N 1 2 320.506 4.306 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@@H]2CCn3ccnc32)c2cccc(F)c2)c1 ZINC000834830903 1046678613 /nfs/dbraw/zinc/67/86/13/1046678613.db2.gz HJHMHFHPAZZQQE-MOPGFXCFSA-N 1 2 321.399 4.155 20 0 DIADLO CC(C)c1ccc(/C=C/CC(=O)OCCCn2cc[nH+]c2)cc1 ZINC000784447582 1046690282 /nfs/dbraw/zinc/69/02/82/1046690282.db2.gz LXUFZZZBNIDUPW-HWKANZROSA-N 1 2 312.413 4.043 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+]Cc2ncc(C(C)(C)C)o2)cc1 ZINC000678734954 1046691027 /nfs/dbraw/zinc/69/10/27/1046691027.db2.gz NJASAESHYIURND-CYBMUJFWSA-N 1 2 302.418 4.222 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@H](C)c2nccn2C)c2ccccc2)cc1 ZINC000678763417 1046694844 /nfs/dbraw/zinc/69/48/44/1046694844.db2.gz FQARDPCHISAJOL-APWZRJJASA-N 1 2 305.425 4.169 20 0 DIADLO CC(C)c1nc(C[N@H+](C)Cc2ccc3c(c2)CCC3)cs1 ZINC001203034140 1046699866 /nfs/dbraw/zinc/69/98/66/1046699866.db2.gz PVZNYTADYRKHJI-UHFFFAOYSA-N 1 2 300.471 4.387 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)Cc2ccc3c(c2)CCC3)cs1 ZINC001203034140 1046699872 /nfs/dbraw/zinc/69/98/72/1046699872.db2.gz PVZNYTADYRKHJI-UHFFFAOYSA-N 1 2 300.471 4.387 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@@H](CC2CC2)c2ccccc2)n1 ZINC000678775739 1046700514 /nfs/dbraw/zinc/70/05/14/1046700514.db2.gz BHHDAUHUHJOASE-KRWDZBQOSA-N 1 2 313.445 4.289 20 0 DIADLO Fc1cccc(F)c1[C@H]1CCC[N@@H+]1Cc1[nH]nc2ccccc21 ZINC001137351057 1046702646 /nfs/dbraw/zinc/70/26/46/1046702646.db2.gz NIKYBTVMJZVHPZ-QGZVFWFLSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1cccc(F)c1[C@H]1CCC[N@H+]1Cc1[nH]nc2ccccc21 ZINC001137351057 1046702659 /nfs/dbraw/zinc/70/26/59/1046702659.db2.gz NIKYBTVMJZVHPZ-QGZVFWFLSA-N 1 2 313.351 4.178 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CCSc3c(Cl)cccc32)co1 ZINC000834901295 1046712267 /nfs/dbraw/zinc/71/22/67/1046712267.db2.gz RZFOIFAHOAXCME-ZDUSSCGKSA-N 1 2 308.834 4.217 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CCC=C(c3ccco3)C2)n1 ZINC000796125754 1046716665 /nfs/dbraw/zinc/71/66/65/1046716665.db2.gz YXSKBEHFOXEACL-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CCC=C(c3ccco3)C2)n1 ZINC000796125754 1046716680 /nfs/dbraw/zinc/71/66/80/1046716680.db2.gz YXSKBEHFOXEACL-UHFFFAOYSA-N 1 2 309.196 4.271 20 0 DIADLO Fc1ccc([C@H](C[C@@H]2CCOC2)[NH2+][C@H]2CCCC2(F)F)cc1 ZINC000644547204 1046720502 /nfs/dbraw/zinc/72/05/02/1046720502.db2.gz GUUFBECBTHXIOT-RCBQFDQVSA-N 1 2 313.363 4.071 20 0 DIADLO Cc1ccoc1C[NH2+][C@H](C)c1nc2ccccc2n1C(F)F ZINC000644557038 1046723258 /nfs/dbraw/zinc/72/32/58/1046723258.db2.gz XLKYDJYIFIAGAW-LLVKDONJSA-N 1 2 305.328 4.184 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)n1 ZINC000678900269 1046730209 /nfs/dbraw/zinc/73/02/09/1046730209.db2.gz YDKNPVAOCQTBAQ-FCIDVOKBSA-N 1 2 305.809 4.079 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2[nH]ncc21)c1ccc(-c2cccnc2)cc1 ZINC000796778166 1046731241 /nfs/dbraw/zinc/73/12/41/1046731241.db2.gz GBAGMQVJTFRNET-KUHUBIRLSA-N 1 2 318.424 4.200 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1csnn1)c1ccc(C(F)(F)F)cc1 ZINC000678938127 1046738243 /nfs/dbraw/zinc/73/82/43/1046738243.db2.gz BBXHHYGDJBPRLT-ZDUSSCGKSA-N 1 2 315.364 4.044 20 0 DIADLO Cc1cc(C)c(NC(=O)C[NH+]2CCC(C3CC3)CC2)c(Cl)c1 ZINC000644718603 1046738311 /nfs/dbraw/zinc/73/83/11/1046738311.db2.gz IWILYUUJWDZABJ-UHFFFAOYSA-N 1 2 320.864 4.017 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2CCc3c2cccc3Cl)c(C)[nH+]1 ZINC000678932355 1046739666 /nfs/dbraw/zinc/73/96/66/1046739666.db2.gz SFSNZQBIFZTIIR-OAHLLOKOSA-N 1 2 314.816 4.329 20 0 DIADLO COc1ccc[nH+]c1NCc1ccc(Cl)c(C(F)(F)F)c1 ZINC000678941774 1046740409 /nfs/dbraw/zinc/74/04/09/1046740409.db2.gz WAOPQKXIDKFRIP-UHFFFAOYSA-N 1 2 316.710 4.375 20 0 DIADLO C[N@H+](Cc1ccc(Cl)cc1Br)C1CC(F)(F)C1 ZINC001140482730 1046744639 /nfs/dbraw/zinc/74/46/39/1046744639.db2.gz XJAWQLIDGBFLDA-UHFFFAOYSA-N 1 2 324.596 4.332 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)cc1Br)C1CC(F)(F)C1 ZINC001140482730 1046744650 /nfs/dbraw/zinc/74/46/50/1046744650.db2.gz XJAWQLIDGBFLDA-UHFFFAOYSA-N 1 2 324.596 4.332 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1Cl ZINC000533555651 1046750460 /nfs/dbraw/zinc/75/04/60/1046750460.db2.gz ORNCLFCPBIVROH-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1Cl ZINC000533555651 1046750468 /nfs/dbraw/zinc/75/04/68/1046750468.db2.gz ORNCLFCPBIVROH-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2nc3c(s2)CCCC3)s1 ZINC000678984719 1046750508 /nfs/dbraw/zinc/75/05/08/1046750508.db2.gz FQCDDSBAHSDQBQ-NSHDSACASA-N 1 2 321.515 4.288 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2nc3c(s2)CCCC3)s1 ZINC000678984719 1046750523 /nfs/dbraw/zinc/75/05/23/1046750523.db2.gz FQCDDSBAHSDQBQ-NSHDSACASA-N 1 2 321.515 4.288 20 0 DIADLO C[C@H]([NH2+]Cc1cocn1)c1ccc(SCC(F)(F)F)cc1 ZINC000679047993 1046764610 /nfs/dbraw/zinc/76/46/10/1046764610.db2.gz MAGQDXIYCKKVFX-JTQLQIEISA-N 1 2 316.348 4.180 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)Cc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000455476021 1046767671 /nfs/dbraw/zinc/76/76/71/1046767671.db2.gz KZORTTHGGMVHJF-UHFFFAOYSA-N 1 2 317.820 4.324 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2c(F)cc(F)cc2F)cc1 ZINC001140533608 1046769395 /nfs/dbraw/zinc/76/93/95/1046769395.db2.gz AKMAWWFSHNMLIZ-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2c(F)cc(F)cc2F)cc1 ZINC001140533608 1046769410 /nfs/dbraw/zinc/76/94/10/1046769410.db2.gz AKMAWWFSHNMLIZ-NSHDSACASA-N 1 2 309.331 4.306 20 0 DIADLO Cc1ccccc1O[C@@H]1CC[N@H+](Cc2c(F)cc(F)cc2F)C1 ZINC001140532659 1046769662 /nfs/dbraw/zinc/76/96/62/1046769662.db2.gz LECUKYZEWBNRNC-CQSZACIVSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1ccccc1O[C@@H]1CC[N@@H+](Cc2c(F)cc(F)cc2F)C1 ZINC001140532659 1046769674 /nfs/dbraw/zinc/76/96/74/1046769674.db2.gz LECUKYZEWBNRNC-CQSZACIVSA-N 1 2 321.342 4.066 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@@H](C)c2ccc(F)cc2)c(C)[nH+]1 ZINC000455469255 1046769661 /nfs/dbraw/zinc/76/96/61/1046769661.db2.gz HLRWMDXOWNRBBW-AWEZNQCLSA-N 1 2 315.392 4.371 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CC=C(c3ccccc3)CC2)c(F)c1 ZINC001140535085 1046770094 /nfs/dbraw/zinc/77/00/94/1046770094.db2.gz ZEPYUFUJPVSWAB-UHFFFAOYSA-N 1 2 303.327 4.393 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CC=C(c3ccccc3)CC2)c(F)c1 ZINC001140535085 1046770108 /nfs/dbraw/zinc/77/01/08/1046770108.db2.gz ZEPYUFUJPVSWAB-UHFFFAOYSA-N 1 2 303.327 4.393 20 0 DIADLO CCS[C@@H]1CCCCN(C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000455460050 1046770052 /nfs/dbraw/zinc/77/00/52/1046770052.db2.gz AGLGSLQTMILOHN-OAHLLOKOSA-N 1 2 321.490 4.146 20 0 DIADLO Cc1cc(C)c(NC(=O)N(CC2CC2)CC2CCC2)c(C)[nH+]1 ZINC000455495263 1046771180 /nfs/dbraw/zinc/77/11/80/1046771180.db2.gz FUWKYCLWXCLZQZ-UHFFFAOYSA-N 1 2 301.434 4.051 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCCC[C@H]2c2ccco2)c(C)[nH+]1 ZINC000455493691 1046771368 /nfs/dbraw/zinc/77/13/68/1046771368.db2.gz MHHQTCVFJHMDAV-HNNXBMFYSA-N 1 2 313.401 4.359 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(OC(F)(F)F)c(Cl)c2)C[C@@H]1F ZINC001140555893 1046778508 /nfs/dbraw/zinc/77/85/08/1046778508.db2.gz AJVUVSKMNJVQJN-KCJUWKMLSA-N 1 2 311.706 4.028 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(OC(F)(F)F)c(Cl)c2)C[C@@H]1F ZINC001140555893 1046778518 /nfs/dbraw/zinc/77/85/18/1046778518.db2.gz AJVUVSKMNJVQJN-KCJUWKMLSA-N 1 2 311.706 4.028 20 0 DIADLO Cc1cc(C)c(NC(=O)NC[C@@H](C)Cc2cccs2)c(C)[nH+]1 ZINC000455497125 1046772897 /nfs/dbraw/zinc/77/28/97/1046772897.db2.gz PUAMFWQGXLHMNL-NSHDSACASA-N 1 2 317.458 4.069 20 0 DIADLO Oc1cccc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)c1Cl ZINC000645170062 1046774018 /nfs/dbraw/zinc/77/40/18/1046774018.db2.gz UVALWMCWBCSBJQ-UHFFFAOYSA-N 1 2 323.770 4.493 20 0 DIADLO CC[C@H](NC(=O)Nc1c(C)cc(C)[nH+]c1C)c1cccs1 ZINC000455491669 1046774812 /nfs/dbraw/zinc/77/48/12/1046774812.db2.gz YUYZXYPMXNLPEI-ZDUSSCGKSA-N 1 2 303.431 4.341 20 0 DIADLO C[C@H](c1ccc(F)c(Cl)c1)[N@H+](C)Cc1cn2c(n1)CCCC2 ZINC000429535738 1046775077 /nfs/dbraw/zinc/77/50/77/1046775077.db2.gz IVLQRCDRHARKER-GFCCVEGCSA-N 1 2 321.827 4.205 20 0 DIADLO C[C@H](c1ccc(F)c(Cl)c1)[N@@H+](C)Cc1cn2c(n1)CCCC2 ZINC000429535738 1046775087 /nfs/dbraw/zinc/77/50/87/1046775087.db2.gz IVLQRCDRHARKER-GFCCVEGCSA-N 1 2 321.827 4.205 20 0 DIADLO Cc1cc(C)c(NC(=O)NC[C@H](C)c2ccc(F)cc2)c(C)[nH+]1 ZINC000455491590 1046775119 /nfs/dbraw/zinc/77/51/19/1046775119.db2.gz YPKRWIGOSHOFKQ-LBPRGKRZSA-N 1 2 315.392 4.071 20 0 DIADLO CCN(Cc1cccs1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455491558 1046776108 /nfs/dbraw/zinc/77/61/08/1046776108.db2.gz YLMQHGIEQGRNDT-UHFFFAOYSA-N 1 2 303.431 4.122 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@H](C)C3(CCC3)C2)c(C)[nH+]1 ZINC000455501383 1046777679 /nfs/dbraw/zinc/77/76/79/1046777679.db2.gz UMLDXQWAMOEOLJ-ZDUSSCGKSA-N 1 2 301.434 4.051 20 0 DIADLO Cc1cc(C)c(NC(=O)N2C[C@H](C)C[C@H]2c2cccnc2)c(C)[nH+]1 ZINC000455504368 1046778511 /nfs/dbraw/zinc/77/85/11/1046778511.db2.gz WNMGFMNFBSIYAI-PXAZEXFGSA-N 1 2 324.428 4.017 20 0 DIADLO F[C@H]1C[N@H+](Cc2ccc(OC(F)(F)F)c(Cl)c2)C[C@@H]2C[C@@H]21 ZINC001140558456 1046781981 /nfs/dbraw/zinc/78/19/81/1046781981.db2.gz UVPGGLUPYZBYFC-NHCYSSNCSA-N 1 2 323.717 4.028 20 0 DIADLO F[C@H]1C[N@@H+](Cc2ccc(OC(F)(F)F)c(Cl)c2)C[C@@H]2C[C@@H]21 ZINC001140558456 1046781989 /nfs/dbraw/zinc/78/19/89/1046781989.db2.gz UVPGGLUPYZBYFC-NHCYSSNCSA-N 1 2 323.717 4.028 20 0 DIADLO C[N@H+](CCC(=O)c1ccccc1)Cc1cccc(F)c1Cl ZINC001140562868 1046783357 /nfs/dbraw/zinc/78/33/57/1046783357.db2.gz JDHQRRGHLMGNIK-UHFFFAOYSA-N 1 2 305.780 4.184 20 0 DIADLO C[N@@H+](CCC(=O)c1ccccc1)Cc1cccc(F)c1Cl ZINC001140562868 1046783368 /nfs/dbraw/zinc/78/33/68/1046783368.db2.gz JDHQRRGHLMGNIK-UHFFFAOYSA-N 1 2 305.780 4.184 20 0 DIADLO C[C@H](c1nnc(-c2ccccc2)o1)[N@H+](C)Cc1ccc(F)cc1 ZINC000066562466 1046785027 /nfs/dbraw/zinc/78/50/27/1046785027.db2.gz LYCZSYXWCOHQRD-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1nnc(-c2ccccc2)o1)[N@@H+](C)Cc1ccc(F)cc1 ZINC000066562466 1046785037 /nfs/dbraw/zinc/78/50/37/1046785037.db2.gz LYCZSYXWCOHQRD-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO O=C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(Cl)ccc1C(F)(F)F ZINC001140565769 1046785392 /nfs/dbraw/zinc/78/53/92/1046785392.db2.gz VVYMVSNTGUNCQE-TXEJJXNPSA-N 1 2 317.738 4.055 20 0 DIADLO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(Cl)ccc1C(F)(F)F ZINC001140565769 1046785401 /nfs/dbraw/zinc/78/54/01/1046785401.db2.gz VVYMVSNTGUNCQE-TXEJJXNPSA-N 1 2 317.738 4.055 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@H]2c2cccn2C)cs1 ZINC000067961125 1046787076 /nfs/dbraw/zinc/78/70/76/1046787076.db2.gz FUWZITCQLONAER-INIZCTEOSA-N 1 2 303.475 4.161 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@H]2c2cccn2C)cs1 ZINC000067961125 1046787087 /nfs/dbraw/zinc/78/70/87/1046787087.db2.gz FUWZITCQLONAER-INIZCTEOSA-N 1 2 303.475 4.161 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ncc(-c3cccs3)o2)s1 ZINC000067399368 1046787959 /nfs/dbraw/zinc/78/79/59/1046787959.db2.gz HVIGYAHNKAAHFW-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ncc(-c3cccs3)o2)s1 ZINC000067399368 1046787972 /nfs/dbraw/zinc/78/79/72/1046787972.db2.gz HVIGYAHNKAAHFW-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1nc2ccccc2c(C)c1Cl ZINC000679186262 1046789392 /nfs/dbraw/zinc/78/93/92/1046789392.db2.gz GQXBONPHGSKTEG-JSGCOSHPSA-N 1 2 318.848 4.196 20 0 DIADLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1nc2ccccc2c(C)c1Cl ZINC000679186262 1046789403 /nfs/dbraw/zinc/78/94/03/1046789403.db2.gz GQXBONPHGSKTEG-JSGCOSHPSA-N 1 2 318.848 4.196 20 0 DIADLO F[C@H]1COC2(C1)CC[NH+](Cc1cc(Cl)sc1Cl)CC2 ZINC001140589651 1046797833 /nfs/dbraw/zinc/79/78/33/1046797833.db2.gz PRVYMURWCFNXLD-SNVBAGLBSA-N 1 2 324.248 4.148 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H](C)COc1ccc(C(C)(C)C)cc1 ZINC000679333931 1046811865 /nfs/dbraw/zinc/81/18/65/1046811865.db2.gz WZYOZJSWEBXSEB-KBPBESRZSA-N 1 2 315.461 4.134 20 0 DIADLO CC1=C(C)C[N@H+](Cc2noc(-c3c(F)cccc3Cl)n2)CC1 ZINC000645896736 1046828730 /nfs/dbraw/zinc/82/87/30/1046828730.db2.gz URCKUJZNQQIAAR-UHFFFAOYSA-N 1 2 321.783 4.071 20 0 DIADLO CC1=C(C)C[N@@H+](Cc2noc(-c3c(F)cccc3Cl)n2)CC1 ZINC000645896736 1046828746 /nfs/dbraw/zinc/82/87/46/1046828746.db2.gz URCKUJZNQQIAAR-UHFFFAOYSA-N 1 2 321.783 4.071 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+][C@@H](CCc1ccccc1)C(F)F ZINC000679387837 1046833858 /nfs/dbraw/zinc/83/38/58/1046833858.db2.gz FVAMBYFTBAAEQZ-YOEHRIQHSA-N 1 2 304.384 4.307 20 0 DIADLO Fc1cccc(C(F)(F)C[NH2+]Cc2cccc3cc[nH]c32)c1 ZINC001203056425 1046843114 /nfs/dbraw/zinc/84/31/14/1046843114.db2.gz YKLOLTOXCUXAIN-UHFFFAOYSA-N 1 2 304.315 4.189 20 0 DIADLO Cn1c(Nc2ccc(Cn3cc[nH+]c3)cc2)cc2ccccc21 ZINC001212047101 1046843759 /nfs/dbraw/zinc/84/37/59/1046843759.db2.gz ZJJNLAZPSDGLKX-UHFFFAOYSA-N 1 2 302.381 4.167 20 0 DIADLO Cc1cccc(C2([NH2+]Cc3nc(-c4ccccc4)no3)CCC2)c1 ZINC000646020919 1046846541 /nfs/dbraw/zinc/84/65/41/1046846541.db2.gz HIDJVORQEYLMJR-UHFFFAOYSA-N 1 2 319.408 4.214 20 0 DIADLO Fc1ccc2oc(C[NH2+]C3(c4ccccc4F)CCC3)nc2c1 ZINC000646026449 1046848194 /nfs/dbraw/zinc/84/81/94/1046848194.db2.gz PDCFUVPNBPHHFZ-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@@H+]2CC[C@@H](c3c(F)cccc3F)C2)n1 ZINC000248906194 1046854847 /nfs/dbraw/zinc/85/48/47/1046854847.db2.gz BEZPENYCPQIDCP-VXGBXAGGSA-N 1 2 321.371 4.022 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)n1 ZINC000248906194 1046854868 /nfs/dbraw/zinc/85/48/68/1046854868.db2.gz BEZPENYCPQIDCP-VXGBXAGGSA-N 1 2 321.371 4.022 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccn(C2CCCC2)n1 ZINC000679540900 1046860524 /nfs/dbraw/zinc/86/05/24/1046860524.db2.gz IFZJYYZYVZWAET-OLZOCXBDSA-N 1 2 315.383 4.161 20 0 DIADLO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccn(C2CCCC2)n1 ZINC000679540900 1046860543 /nfs/dbraw/zinc/86/05/43/1046860543.db2.gz IFZJYYZYVZWAET-OLZOCXBDSA-N 1 2 315.383 4.161 20 0 DIADLO c1csc(C[NH+](CCN2CCCCC2)Cc2cccs2)c1 ZINC000679537115 1046861200 /nfs/dbraw/zinc/86/12/00/1046861200.db2.gz URTPOWDEIMTUMX-UHFFFAOYSA-N 1 2 320.527 4.298 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2ccccc2)c2ccccn2)cc(Cl)n1 ZINC000797594778 1046864382 /nfs/dbraw/zinc/86/43/82/1046864382.db2.gz URNDFTLPGGWGRJ-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO Fc1cc(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c(F)cc1Cl ZINC001140701762 1046866277 /nfs/dbraw/zinc/86/62/77/1046866277.db2.gz ZCYBOOUTLKYWCS-CQSZACIVSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1cc(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c(F)cc1Cl ZINC001140701762 1046866292 /nfs/dbraw/zinc/86/62/92/1046866292.db2.gz ZCYBOOUTLKYWCS-CQSZACIVSA-N 1 2 323.770 4.272 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccc(Sc3ccccn3)o2)C[C@H]1F ZINC000646153398 1046868331 /nfs/dbraw/zinc/86/83/31/1046868331.db2.gz XBBYZRNWEAOJSV-GXTWGEPZSA-N 1 2 306.406 4.006 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccc(Sc3ccccn3)o2)C[C@H]1F ZINC000646153398 1046868350 /nfs/dbraw/zinc/86/83/50/1046868350.db2.gz XBBYZRNWEAOJSV-GXTWGEPZSA-N 1 2 306.406 4.006 20 0 DIADLO Nc1ccc(Cl)cc1C[N@@H+]1CCc2ccc(Cl)cc2C1 ZINC001140716411 1046872430 /nfs/dbraw/zinc/87/24/30/1046872430.db2.gz NCEYZVJCOXBIED-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1ccc(Cl)cc1C[N@H+]1CCc2ccc(Cl)cc2C1 ZINC001140716411 1046872448 /nfs/dbraw/zinc/87/24/48/1046872448.db2.gz NCEYZVJCOXBIED-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO CCc1noc([C@H](C)[N@H+](C)Cc2csc3ccccc23)n1 ZINC000076991011 1046873606 /nfs/dbraw/zinc/87/36/06/1046873606.db2.gz GOGWHGALUHLWDF-NSHDSACASA-N 1 2 301.415 4.040 20 0 DIADLO CCc1noc([C@H](C)[N@@H+](C)Cc2csc3ccccc23)n1 ZINC000076991011 1046873620 /nfs/dbraw/zinc/87/36/20/1046873620.db2.gz GOGWHGALUHLWDF-NSHDSACASA-N 1 2 301.415 4.040 20 0 DIADLO Cc1cccc(C2=CC[N@H+](Cc3cn4cccc(F)c4n3)CC2)c1 ZINC000679582298 1046875276 /nfs/dbraw/zinc/87/52/76/1046875276.db2.gz JKPMBGOUVGTLNN-UHFFFAOYSA-N 1 2 321.399 4.071 20 0 DIADLO Cc1cccc(C2=CC[N@@H+](Cc3cn4cccc(F)c4n3)CC2)c1 ZINC000679582298 1046875289 /nfs/dbraw/zinc/87/52/89/1046875289.db2.gz JKPMBGOUVGTLNN-UHFFFAOYSA-N 1 2 321.399 4.071 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1c(Cl)ncc2ccccc21 ZINC001140723284 1046875854 /nfs/dbraw/zinc/87/58/54/1046875854.db2.gz DEGUDQJAUHIUOT-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1c(Cl)ncc2ccccc21 ZINC001140723284 1046875867 /nfs/dbraw/zinc/87/58/67/1046875867.db2.gz DEGUDQJAUHIUOT-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO Cc1ccc(Nc2nc(C[NH2+][C@H](C)c3cccnc3)cs2)cc1 ZINC000679661110 1046888417 /nfs/dbraw/zinc/88/84/17/1046888417.db2.gz AUYAPUJXCBEBJY-CQSZACIVSA-N 1 2 324.453 4.441 20 0 DIADLO FC(F)O[C@@H]1CCC[N@H+](Cc2ncc(-c3ccccc3)s2)C1 ZINC000679678407 1046890660 /nfs/dbraw/zinc/89/06/60/1046890660.db2.gz AYFWUZSHHGMNEY-CYBMUJFWSA-N 1 2 324.396 4.014 20 0 DIADLO FC(F)O[C@@H]1CCC[N@@H+](Cc2ncc(-c3ccccc3)s2)C1 ZINC000679678407 1046890679 /nfs/dbraw/zinc/89/06/79/1046890679.db2.gz AYFWUZSHHGMNEY-CYBMUJFWSA-N 1 2 324.396 4.014 20 0 DIADLO FC(F)(F)c1cc(Br)ccc1C[NH+]1CCCCC1 ZINC001140775331 1046892688 /nfs/dbraw/zinc/89/26/88/1046892688.db2.gz RZWYTJRPIRVYKP-UHFFFAOYSA-N 1 2 322.168 4.454 20 0 DIADLO COc1cc(C)ccc1[C@@H](C)Nc1ccc(N2CCCC2)[nH+]c1 ZINC000320025667 1046899796 /nfs/dbraw/zinc/89/97/96/1046899796.db2.gz GPJPGSQLZJLHGO-OAHLLOKOSA-N 1 2 311.429 4.172 20 0 DIADLO CC[N@H+](Cc1cc(O)cc(Cl)c1)Cc1cccc(F)c1F ZINC001140790609 1046901269 /nfs/dbraw/zinc/90/12/69/1046901269.db2.gz CSNMPIUTLRJIRC-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO CC[N@@H+](Cc1cc(O)cc(Cl)c1)Cc1cccc(F)c1F ZINC001140790609 1046901281 /nfs/dbraw/zinc/90/12/81/1046901281.db2.gz CSNMPIUTLRJIRC-UHFFFAOYSA-N 1 2 311.759 4.346 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ccc(C)cc2Cl)c1OC ZINC001140800552 1046904961 /nfs/dbraw/zinc/90/49/61/1046904961.db2.gz LLVJMHBCNABBHI-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ccc(C)cc2Cl)c1OC ZINC001140800552 1046904971 /nfs/dbraw/zinc/90/49/71/1046904971.db2.gz LLVJMHBCNABBHI-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H]3CC[C@@H]4CCCC[C@@H]4C3)cc2[nH+]1 ZINC001137392756 1046910188 /nfs/dbraw/zinc/91/01/88/1046910188.db2.gz IRPNEXMZIZNKQJ-RRFJBIMHSA-N 1 2 311.429 4.416 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@H]3CCCc4ccccc43)cc2[nH+]1 ZINC001137392710 1046911438 /nfs/dbraw/zinc/91/14/38/1046911438.db2.gz HBAVPKGQVZGLOI-OAHLLOKOSA-N 1 2 319.408 4.320 20 0 DIADLO Cc1cc(Br)ccc1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC001140815209 1046913340 /nfs/dbraw/zinc/91/33/40/1046913340.db2.gz JBZRGTVOMMDZDR-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cc(Br)ccc1C[N@H+]1CCC[C@@](C)(F)C1 ZINC001140815209 1046913345 /nfs/dbraw/zinc/91/33/45/1046913345.db2.gz JBZRGTVOMMDZDR-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO CCc1noc(C[N@@H+]2CCCCC[C@@H]2/C=C/c2cccs2)n1 ZINC000679952469 1046914869 /nfs/dbraw/zinc/91/48/69/1046914869.db2.gz KJTZZTOJFRRPJB-ATWMFIQVSA-N 1 2 317.458 4.152 20 0 DIADLO CCc1noc(C[N@H+]2CCCCC[C@@H]2/C=C/c2cccs2)n1 ZINC000679952469 1046914880 /nfs/dbraw/zinc/91/48/80/1046914880.db2.gz KJTZZTOJFRRPJB-ATWMFIQVSA-N 1 2 317.458 4.152 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+]Cc1csc(CCC(C)C)n1 ZINC000679942647 1046914900 /nfs/dbraw/zinc/91/49/00/1046914900.db2.gz MYCWGQFZANHLIS-CQSZACIVSA-N 1 2 303.475 4.286 20 0 DIADLO CCc1noc(C[N@@H+]2CCCCC[C@H]2/C=C\c2cccs2)n1 ZINC000679952474 1046915015 /nfs/dbraw/zinc/91/50/15/1046915015.db2.gz KJTZZTOJFRRPJB-CMUBDUJZSA-N 1 2 317.458 4.152 20 0 DIADLO CCc1noc(C[N@H+]2CCCCC[C@H]2/C=C\c2cccs2)n1 ZINC000679952474 1046915023 /nfs/dbraw/zinc/91/50/23/1046915023.db2.gz KJTZZTOJFRRPJB-CMUBDUJZSA-N 1 2 317.458 4.152 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc2ccccc21 ZINC000161791201 1046916621 /nfs/dbraw/zinc/91/66/21/1046916621.db2.gz HNGZDTOKTDFUOT-UHFFFAOYSA-N 1 2 313.360 4.482 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccc(C)nc2)c(F)c1 ZINC001140827590 1046918602 /nfs/dbraw/zinc/91/86/02/1046918602.db2.gz DRSAETQIDXQRFV-SFHVURJKSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@H]2c2ccc(C)nc2)c(F)c1 ZINC001140827590 1046918614 /nfs/dbraw/zinc/91/86/14/1046918614.db2.gz DRSAETQIDXQRFV-SFHVURJKSA-N 1 2 318.367 4.014 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc(C)cc2Cl)o1 ZINC000078621953 1046934063 /nfs/dbraw/zinc/93/40/63/1046934063.db2.gz KSTKSHPLDQQZLN-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc(C)cc2Cl)o1 ZINC000078621953 1046934072 /nfs/dbraw/zinc/93/40/72/1046934072.db2.gz KSTKSHPLDQQZLN-ZDUSSCGKSA-N 1 2 320.820 4.009 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1ccc(F)c(F)c1 ZINC000680040996 1046936960 /nfs/dbraw/zinc/93/69/60/1046936960.db2.gz DYSQFBIIAZQCRZ-RTHLEPHNSA-N 1 2 311.278 4.027 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCCC[C@H]2c2ccc(C)o2)s1 ZINC000680052867 1046941620 /nfs/dbraw/zinc/94/16/20/1046941620.db2.gz BHKQXFOPMWIDTE-ZDUSSCGKSA-N 1 2 305.447 4.119 20 0 DIADLO CCc1nnc(C[N@H+]2CCCCC[C@H]2c2ccc(C)o2)s1 ZINC000680052867 1046941626 /nfs/dbraw/zinc/94/16/26/1046941626.db2.gz BHKQXFOPMWIDTE-ZDUSSCGKSA-N 1 2 305.447 4.119 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCC[C@H]2c2ccc(C)cc2)s1 ZINC000680055077 1046942667 /nfs/dbraw/zinc/94/26/67/1046942667.db2.gz NUTARZOIPPHRTD-HNNXBMFYSA-N 1 2 301.459 4.136 20 0 DIADLO CCc1nnc(C[N@H+]2CCCC[C@H]2c2ccc(C)cc2)s1 ZINC000680055077 1046942675 /nfs/dbraw/zinc/94/26/75/1046942675.db2.gz NUTARZOIPPHRTD-HNNXBMFYSA-N 1 2 301.459 4.136 20 0 DIADLO Oc1ccc(C[N@@H+]2CCCC[C@H]2c2ccccc2)c(F)c1F ZINC001140889973 1046944215 /nfs/dbraw/zinc/94/42/15/1046944215.db2.gz RZBQFLZAWFFASL-HNNXBMFYSA-N 1 2 303.352 4.398 20 0 DIADLO Cc1cc(C[NH+]2CCC(CCc3ccc(Cl)cc3)CC2)n[nH]1 ZINC001203077042 1046945692 /nfs/dbraw/zinc/94/56/92/1046945692.db2.gz PONWGXMYRDHXFZ-UHFFFAOYSA-N 1 2 317.864 4.216 20 0 DIADLO CCC[C@H]([NH2+]Cc1nnc(CC)s1)c1ccc(F)cc1F ZINC000680076124 1046946068 /nfs/dbraw/zinc/94/60/68/1046946068.db2.gz TYQOVNVOSIAJJB-ZDUSSCGKSA-N 1 2 311.401 4.010 20 0 DIADLO CC(C)c1cc(N2CC[C@H](c3ccccn3)C2)nc(C(C)C)[nH+]1 ZINC000798417096 1046952655 /nfs/dbraw/zinc/95/26/55/1046952655.db2.gz RHGSTMZQASNCIZ-HNNXBMFYSA-N 1 2 310.445 4.112 20 0 DIADLO CC(C)[C@@H]1C[C@H]1C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000476006391 1046960981 /nfs/dbraw/zinc/96/09/81/1046960981.db2.gz GMPPRTBKKBEJLS-ZWKOTPCHSA-N 1 2 323.440 4.117 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1cc2n(n1)CCCC2 ZINC000647279910 1046966379 /nfs/dbraw/zinc/96/63/79/1046966379.db2.gz FMSVXYDKVDQKCP-NSHDSACASA-N 1 2 324.255 4.377 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2)o1)c1cc2n(n1)CCCC2 ZINC000647283768 1046968510 /nfs/dbraw/zinc/96/85/10/1046968510.db2.gz MQNNWFHXURNVST-OAHLLOKOSA-N 1 2 321.424 4.330 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+][C@@H]1COc2cc(F)cc(F)c21 ZINC000680355277 1046972175 /nfs/dbraw/zinc/97/21/75/1046972175.db2.gz ULWLRYZCLUXWKQ-XHDPSFHLSA-N 1 2 319.351 4.148 20 0 DIADLO COc1cc(C)ccc1[C@@H](C)[NH2+][C@@H]1COc2cc(F)cc(F)c21 ZINC000680355427 1046973869 /nfs/dbraw/zinc/97/38/69/1046973869.db2.gz PJHAFYDVZBTYHE-IAQYHMDHSA-N 1 2 319.351 4.066 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1c[nH]nc1C(F)(F)F ZINC001141017972 1046978742 /nfs/dbraw/zinc/97/87/42/1046978742.db2.gz DMQXRJKVQIJTID-SECBINFHSA-N 1 2 317.742 4.275 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1c[nH]nc1C(F)(F)F ZINC001141017972 1046978752 /nfs/dbraw/zinc/97/87/52/1046978752.db2.gz DMQXRJKVQIJTID-SECBINFHSA-N 1 2 317.742 4.275 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(C(C)C)cc2C(C)C)o1 ZINC000680427442 1046983222 /nfs/dbraw/zinc/98/32/22/1046983222.db2.gz MXWHZSYNEQJXFG-CYBMUJFWSA-N 1 2 301.434 4.476 20 0 DIADLO Cc1cc([NH2+][C@@H]2CCC[C@H]([C@H]3CCOC3)C2)ccc1N(C)C ZINC000798931705 1046986644 /nfs/dbraw/zinc/98/66/44/1046986644.db2.gz DFNQNOIUQBUUDR-YESZJQIVSA-N 1 2 302.462 4.068 20 0 DIADLO Cc1cc(N[C@@H]2CCC[C@H]([C@H]3CCOC3)C2)ccc1[NH+](C)C ZINC000798931705 1046986655 /nfs/dbraw/zinc/98/66/55/1046986655.db2.gz DFNQNOIUQBUUDR-YESZJQIVSA-N 1 2 302.462 4.068 20 0 DIADLO Cc1cc([NH2+][C@@H]2CCC[C@H]([C@@H]3CCOC3)C2)ccc1N(C)C ZINC000798931701 1046987701 /nfs/dbraw/zinc/98/77/01/1046987701.db2.gz DFNQNOIUQBUUDR-GVDBMIGSSA-N 1 2 302.462 4.068 20 0 DIADLO Cc1cc(N[C@@H]2CCC[C@H]([C@@H]3CCOC3)C2)ccc1[NH+](C)C ZINC000798931701 1046987710 /nfs/dbraw/zinc/98/77/10/1046987710.db2.gz DFNQNOIUQBUUDR-GVDBMIGSSA-N 1 2 302.462 4.068 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000798931347 1046989005 /nfs/dbraw/zinc/98/90/05/1046989005.db2.gz KJNSUZPROHQJIG-BRWVUGGUSA-N 1 2 302.462 4.068 20 0 DIADLO Cc1cc(N(C)C)ccc1[NH2+][C@@H]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000798931347 1046989016 /nfs/dbraw/zinc/98/90/16/1046989016.db2.gz KJNSUZPROHQJIG-BRWVUGGUSA-N 1 2 302.462 4.068 20 0 DIADLO CC(C)c1cc(NCc2nn(C)c3ccccc23)nc(C(C)C)[nH+]1 ZINC000680531361 1046990529 /nfs/dbraw/zinc/99/05/29/1046990529.db2.gz PXJKXRXJKCYXNJ-UHFFFAOYSA-N 1 2 323.444 4.222 20 0 DIADLO CN1CCCc2cc([NH2+][C@@H]3CCC[C@@H]([C@@H]4CCOC4)C3)ccc21 ZINC000798932770 1046991075 /nfs/dbraw/zinc/99/10/75/1046991075.db2.gz KAGWSPJPJSTKTH-KBAYOESNSA-N 1 2 314.473 4.076 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)Nc1nc2c(s1)C[N@H+](C)CC2 ZINC000303839891 1046993701 /nfs/dbraw/zinc/99/37/01/1046993701.db2.gz MSUTXBVFVIBHKS-CYBMUJFWSA-N 1 2 323.506 4.066 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)Nc1nc2c(s1)C[N@@H+](C)CC2 ZINC000303839891 1046993708 /nfs/dbraw/zinc/99/37/08/1046993708.db2.gz MSUTXBVFVIBHKS-CYBMUJFWSA-N 1 2 323.506 4.066 20 0 DIADLO COc1ccc2nc(Cl)c(C[N@@H+]3C[C@@H](C)C[C@H]3CF)cc2c1 ZINC001141062429 1046994532 /nfs/dbraw/zinc/99/45/32/1046994532.db2.gz IKISBFCKVFSNSR-FZMZJTMJSA-N 1 2 322.811 4.077 20 0 DIADLO COc1ccc2nc(Cl)c(C[N@H+]3C[C@@H](C)C[C@H]3CF)cc2c1 ZINC001141062429 1046994537 /nfs/dbraw/zinc/99/45/37/1046994537.db2.gz IKISBFCKVFSNSR-FZMZJTMJSA-N 1 2 322.811 4.077 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)nn1C ZINC000282070267 1046999701 /nfs/dbraw/zinc/99/97/01/1046999701.db2.gz HBPFYKUFEPVDPT-YVEFUNNKSA-N 1 2 321.415 4.445 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124886 1047003947 /nfs/dbraw/zinc/00/39/47/1047003947.db2.gz AIGMTJNXTVKFIS-SWLSCSKDSA-N 1 2 319.836 4.259 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2cnc(Cl)cn2)o1 ZINC000799124886 1047003955 /nfs/dbraw/zinc/00/39/55/1047003955.db2.gz AIGMTJNXTVKFIS-SWLSCSKDSA-N 1 2 319.836 4.259 20 0 DIADLO CCc1noc(C)c1C[N@H+](Cc1ccco1)Cc1cccs1 ZINC000162596815 1047011819 /nfs/dbraw/zinc/01/18/19/1047011819.db2.gz ITQMCVJLRCJAEC-UHFFFAOYSA-N 1 2 316.426 4.402 20 0 DIADLO CCc1noc(C)c1C[N@@H+](Cc1ccco1)Cc1cccs1 ZINC000162596815 1047011833 /nfs/dbraw/zinc/01/18/33/1047011833.db2.gz ITQMCVJLRCJAEC-UHFFFAOYSA-N 1 2 316.426 4.402 20 0 DIADLO CCC(CC)(CC)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000680696524 1047012720 /nfs/dbraw/zinc/01/27/20/1047012720.db2.gz QJAKZUSSRZXUKF-UHFFFAOYSA-N 1 2 324.428 4.449 20 0 DIADLO C[N@H+](Cc1cc2ccccc2o1)Cc1nnc(-c2ccccc2)o1 ZINC000080068307 1047016827 /nfs/dbraw/zinc/01/68/27/1047016827.db2.gz SWKHKDQVAQOOHN-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2o1)Cc1nnc(-c2ccccc2)o1 ZINC000080068307 1047016843 /nfs/dbraw/zinc/01/68/43/1047016843.db2.gz SWKHKDQVAQOOHN-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO Cc1cc(Br)c(C[NH+]2CC(C)(CC(F)F)C2)s1 ZINC000648058903 1047032465 /nfs/dbraw/zinc/03/24/65/1047032465.db2.gz KEJODMUZEVTLIE-UHFFFAOYSA-N 1 2 324.234 4.296 20 0 DIADLO Cc1ccc2cc(C(=O)Nc3ccc(-c4[nH]cc[nH+]4)cc3)[nH]c2c1 ZINC000162799172 1047037248 /nfs/dbraw/zinc/03/72/48/1047037248.db2.gz PUHQZHTVEWVAGI-UHFFFAOYSA-N 1 2 316.364 4.119 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2cccc(-c3ccc(F)cc3)n2)C[C@H]1F ZINC001141206119 1047046199 /nfs/dbraw/zinc/04/61/99/1047046199.db2.gz SXBNSXLCGYDWDX-MSOLQXFVSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2cccc(-c3ccc(F)cc3)n2)C[C@H]1F ZINC001141206119 1047046215 /nfs/dbraw/zinc/04/62/15/1047046215.db2.gz SXBNSXLCGYDWDX-MSOLQXFVSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2cccc(-c3ccc(F)cc3)n2)C[C@H]1F ZINC001141206120 1047046354 /nfs/dbraw/zinc/04/63/54/1047046354.db2.gz SXBNSXLCGYDWDX-QZTJIDSGSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2cccc(-c3ccc(F)cc3)n2)C[C@H]1F ZINC001141206120 1047046366 /nfs/dbraw/zinc/04/63/66/1047046366.db2.gz SXBNSXLCGYDWDX-QZTJIDSGSA-N 1 2 320.358 4.160 20 0 DIADLO Clc1cc(CN2CCC[C@@H](n3cc[nH+]c3)C2)c(Cl)s1 ZINC000648366950 1047047786 /nfs/dbraw/zinc/04/77/86/1047047786.db2.gz VQYCQGUYYDCSLI-LLVKDONJSA-N 1 2 316.257 4.089 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@H+](Cc1cc2cccnc2o1)CC3 ZINC000648360244 1047048699 /nfs/dbraw/zinc/04/86/99/1047048699.db2.gz UCSCZXUJHPZNNH-UHFFFAOYSA-N 1 2 317.392 4.176 20 0 DIADLO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](Cc1cc2cccnc2o1)CC3 ZINC000648360244 1047048711 /nfs/dbraw/zinc/04/87/11/1047048711.db2.gz UCSCZXUJHPZNNH-UHFFFAOYSA-N 1 2 317.392 4.176 20 0 DIADLO COc1cccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c1F ZINC001141222938 1047051226 /nfs/dbraw/zinc/05/12/26/1047051226.db2.gz CCOXSANPUDTINE-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)c1F ZINC001141222938 1047051241 /nfs/dbraw/zinc/05/12/41/1047051241.db2.gz CCOXSANPUDTINE-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO O=C(c1ccc(F)cc1)[C@H]1CCC[N@H+](Cc2ccc(Cl)o2)C1 ZINC000536661209 1047053300 /nfs/dbraw/zinc/05/33/00/1047053300.db2.gz NIASTJVCDIRPBK-ZDUSSCGKSA-N 1 2 321.779 4.167 20 0 DIADLO O=C(c1ccc(F)cc1)[C@H]1CCC[N@@H+](Cc2ccc(Cl)o2)C1 ZINC000536661209 1047053315 /nfs/dbraw/zinc/05/33/15/1047053315.db2.gz NIASTJVCDIRPBK-ZDUSSCGKSA-N 1 2 321.779 4.167 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)ccc1Cl ZINC001141238249 1047060764 /nfs/dbraw/zinc/06/07/64/1047060764.db2.gz QRNMGSSUZFHNGB-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@H](c3ccccc3)C2)ccc1Cl ZINC001141238249 1047060778 /nfs/dbraw/zinc/06/07/78/1047060778.db2.gz QRNMGSSUZFHNGB-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO CCc1noc(C[NH2+][C@H](C)c2ccc(Cl)c3ccccc32)n1 ZINC000680897565 1047064604 /nfs/dbraw/zinc/06/46/04/1047064604.db2.gz BGOBBRCNQTXDFT-LLVKDONJSA-N 1 2 315.804 4.289 20 0 DIADLO CN(C)c1cccc(C[N@@H+]2CCc3c4ccccc4oc3C2)c1 ZINC001141268447 1047069673 /nfs/dbraw/zinc/06/96/73/1047069673.db2.gz KXRNAACWLZKYPF-UHFFFAOYSA-N 1 2 306.409 4.057 20 0 DIADLO CN(C)c1cccc(C[N@H+]2CCc3c4ccccc4oc3C2)c1 ZINC001141268447 1047069686 /nfs/dbraw/zinc/06/96/86/1047069686.db2.gz KXRNAACWLZKYPF-UHFFFAOYSA-N 1 2 306.409 4.057 20 0 DIADLO COCCOc1ccc(CNc2cc(C)c3ccccc3[nH+]2)cc1 ZINC001115843359 1047085767 /nfs/dbraw/zinc/08/57/67/1047085767.db2.gz BCADNOQVGBPLSQ-UHFFFAOYSA-N 1 2 322.408 4.181 20 0 DIADLO Clc1ccc(C[N@@H+]2CC[C@H](Oc3ccccc3Cl)C2)o1 ZINC000536711541 1047085907 /nfs/dbraw/zinc/08/59/07/1047085907.db2.gz XORBWDRITJJVBU-LBPRGKRZSA-N 1 2 312.196 4.240 20 0 DIADLO Clc1ccc(C[N@H+]2CC[C@H](Oc3ccccc3Cl)C2)o1 ZINC000536711541 1047085923 /nfs/dbraw/zinc/08/59/23/1047085923.db2.gz XORBWDRITJJVBU-LBPRGKRZSA-N 1 2 312.196 4.240 20 0 DIADLO CC(C)=CCC[C@H](C)CC(=O)N1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000648823870 1047093477 /nfs/dbraw/zinc/09/34/77/1047093477.db2.gz VZDAZRVDCXFYQM-RCCFBDPRSA-N 1 2 317.477 4.065 20 0 DIADLO Cc1cc(NC[C@@]2(O)CCCc3ccccc32)[nH+]c2ccccc12 ZINC001116014280 1047100694 /nfs/dbraw/zinc/10/06/94/1047100694.db2.gz HKIHGXCDWZJGQJ-NRFANRHFSA-N 1 2 318.420 4.179 20 0 DIADLO Cn1c2ccccc2nc1C(C)(C)[NH2+]Cc1cscc1Cl ZINC000681134874 1047101117 /nfs/dbraw/zinc/10/11/17/1047101117.db2.gz WUELSFLRMJYIHH-UHFFFAOYSA-N 1 2 319.861 4.313 20 0 DIADLO Cc1cc(NC[C@@H]2OCCc3ccccc32)[nH+]c2ccccc12 ZINC001116051078 1047103407 /nfs/dbraw/zinc/10/34/07/1047103407.db2.gz XICVRDOPJMGVOB-IBGZPJMESA-N 1 2 304.393 4.269 20 0 DIADLO CCn1nc(C[N@H+](Cc2ccc(C)o2)C2CC2)c2ccccc21 ZINC000681162800 1047105215 /nfs/dbraw/zinc/10/52/15/1047105215.db2.gz AZWGMRPGLBYKSF-UHFFFAOYSA-N 1 2 309.413 4.122 20 0 DIADLO CCn1nc(C[N@@H+](Cc2ccc(C)o2)C2CC2)c2ccccc21 ZINC000681162800 1047105225 /nfs/dbraw/zinc/10/52/25/1047105225.db2.gz AZWGMRPGLBYKSF-UHFFFAOYSA-N 1 2 309.413 4.122 20 0 DIADLO COc1ccc(C[N@H+](C)[C@H](C)c2cccc(Cl)c2F)cn1 ZINC000681407109 1047121962 /nfs/dbraw/zinc/12/19/62/1047121962.db2.gz KYTVIEZSBZVXQI-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@H](C)c2cccc(Cl)c2F)cn1 ZINC000681407109 1047121966 /nfs/dbraw/zinc/12/19/66/1047121966.db2.gz KYTVIEZSBZVXQI-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO CO[C@@H]1CCCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)CC1 ZINC000649323404 1047122016 /nfs/dbraw/zinc/12/20/16/1047122016.db2.gz IBKIZUNEWZTCFW-CQSZACIVSA-N 1 2 324.346 4.259 20 0 DIADLO CC(C)(C)[C@@H]([NH2+]Cn1ncsc1=S)c1ccc(F)cc1 ZINC000098051592 1047122885 /nfs/dbraw/zinc/12/28/85/1047122885.db2.gz AXPCRPJAVOMXFJ-LBPRGKRZSA-N 1 2 311.451 4.148 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccccc2C)[C@H]2CCC[C@@H](C)C2)no1 ZINC000537059505 1047134009 /nfs/dbraw/zinc/13/40/09/1047134009.db2.gz LERJMVIKNGCGOM-AZOIQLNYSA-N 1 2 313.445 4.344 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+](C)Cc1cc2n(n1)CCCC2 ZINC000649489855 1047137480 /nfs/dbraw/zinc/13/74/80/1047137480.db2.gz JPJMSVPEIQTIRL-ZDUSSCGKSA-N 1 2 303.837 4.066 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1cc2n(n1)CCCC2 ZINC000649489855 1047137491 /nfs/dbraw/zinc/13/74/91/1047137491.db2.gz JPJMSVPEIQTIRL-ZDUSSCGKSA-N 1 2 303.837 4.066 20 0 DIADLO Cc1nnsc1C[N@H+](Cc1ccccc1)Cc1ccccc1C ZINC000649501237 1047138882 /nfs/dbraw/zinc/13/88/82/1047138882.db2.gz CRMONUMNGQBPHJ-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO Cc1nnsc1C[N@@H+](Cc1ccccc1)Cc1ccccc1C ZINC000649501237 1047138890 /nfs/dbraw/zinc/13/88/90/1047138890.db2.gz CRMONUMNGQBPHJ-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(OCC3CC3)c(F)c2)o1 ZINC000537126006 1047140299 /nfs/dbraw/zinc/14/02/99/1047140299.db2.gz SIQZQPPLKDRWEZ-STQMWFEESA-N 1 2 318.392 4.323 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1ncccc1C(F)(F)F ZINC000681697417 1047141108 /nfs/dbraw/zinc/14/11/08/1047141108.db2.gz HTEICYKTPVDICL-UHFFFAOYSA-N 1 2 318.701 4.183 20 0 DIADLO CC(C)c1ccc2c(c1)[C@H]([NH2+]Cc1n[nH]c3ccccc31)CC2 ZINC000681699990 1047141894 /nfs/dbraw/zinc/14/18/94/1047141894.db2.gz CVQUDWVOMOAJGO-GOSISDBHSA-N 1 2 305.425 4.463 20 0 DIADLO Cc1ccc(OCc2nc(C[N@H+]3CC[C@H]3C(C)C)cs2)cc1 ZINC000537201215 1047149413 /nfs/dbraw/zinc/14/94/13/1047149413.db2.gz VFXTWOCORLUAEJ-KRWDZBQOSA-N 1 2 316.470 4.261 20 0 DIADLO Cc1ccc(OCc2nc(C[N@@H+]3CC[C@H]3C(C)C)cs2)cc1 ZINC000537201215 1047149421 /nfs/dbraw/zinc/14/94/21/1047149421.db2.gz VFXTWOCORLUAEJ-KRWDZBQOSA-N 1 2 316.470 4.261 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1ccc(Cl)nc1F ZINC001137477947 1047151712 /nfs/dbraw/zinc/15/17/12/1047151712.db2.gz NVUKEYOSUUFKMK-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1ccc(Cl)nc1F ZINC001137477947 1047151718 /nfs/dbraw/zinc/15/17/18/1047151718.db2.gz NVUKEYOSUUFKMK-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO Fc1cccc(Cl)c1-c1nc(C[N@@H+]2CCC23CCCC3)no1 ZINC000649658258 1047159530 /nfs/dbraw/zinc/15/95/30/1047159530.db2.gz DTHSURUUAFQUCW-UHFFFAOYSA-N 1 2 321.783 4.048 20 0 DIADLO Fc1cccc(Cl)c1-c1nc(C[N@H+]2CCC23CCCC3)no1 ZINC000649658258 1047159537 /nfs/dbraw/zinc/15/95/37/1047159537.db2.gz DTHSURUUAFQUCW-UHFFFAOYSA-N 1 2 321.783 4.048 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc(C)nc2Cl)s1 ZINC000838837130 1047163431 /nfs/dbraw/zinc/16/34/31/1047163431.db2.gz DCFCSOHJSXDOJJ-LLVKDONJSA-N 1 2 309.866 4.310 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccc(C)nc2Cl)s1 ZINC000838837130 1047163437 /nfs/dbraw/zinc/16/34/37/1047163437.db2.gz DCFCSOHJSXDOJJ-LLVKDONJSA-N 1 2 309.866 4.310 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccc(C)nc2Cl)s1 ZINC000838837165 1047163627 /nfs/dbraw/zinc/16/36/27/1047163627.db2.gz DCFCSOHJSXDOJJ-NSHDSACASA-N 1 2 309.866 4.310 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccc(C)nc2Cl)s1 ZINC000838837165 1047163629 /nfs/dbraw/zinc/16/36/29/1047163629.db2.gz DCFCSOHJSXDOJJ-NSHDSACASA-N 1 2 309.866 4.310 20 0 DIADLO Cc1ccccc1[C@@H]([NH2+]Cc1nc(CCC(C)C)no1)C1CC1 ZINC000537289073 1047164281 /nfs/dbraw/zinc/16/42/81/1047164281.db2.gz BECSNLPFEFWYNC-IBGZPJMESA-N 1 2 313.445 4.208 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@@H]2c2cccn2C)c(Cl)n1 ZINC000838865655 1047164492 /nfs/dbraw/zinc/16/44/92/1047164492.db2.gz SXXCVQSWPNWUDN-MRXNPFEDSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)c(Cl)n1 ZINC000838865655 1047164497 /nfs/dbraw/zinc/16/44/97/1047164497.db2.gz SXXCVQSWPNWUDN-MRXNPFEDSA-N 1 2 303.837 4.109 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@@H+]([C@@H](C)c2c(F)cccc2F)C1 ZINC000682038638 1047164390 /nfs/dbraw/zinc/16/43/90/1047164390.db2.gz DYUQCZIYXSRUTR-IINYFYTJSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@H+]([C@@H](C)c2c(F)cccc2F)C1 ZINC000682038638 1047164396 /nfs/dbraw/zinc/16/43/96/1047164396.db2.gz DYUQCZIYXSRUTR-IINYFYTJSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@@H+]([C@@H](C)c2ccc(F)c(F)c2)C1 ZINC000682038364 1047164428 /nfs/dbraw/zinc/16/44/28/1047164428.db2.gz CWUXTTLHGCXSLN-IINYFYTJSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@H+]([C@@H](C)c2ccc(F)c(F)c2)C1 ZINC000682038364 1047164430 /nfs/dbraw/zinc/16/44/30/1047164430.db2.gz CWUXTTLHGCXSLN-IINYFYTJSA-N 1 2 323.305 4.069 20 0 DIADLO CC[N@H+](Cc1ccc(C)nc1Cl)[C@@H](C)c1cccc(O)c1 ZINC000838866161 1047166820 /nfs/dbraw/zinc/16/68/20/1047166820.db2.gz SOKNZOGKAMQVKJ-ZDUSSCGKSA-N 1 2 304.821 4.332 20 0 DIADLO CC[N@@H+](Cc1ccc(C)nc1Cl)[C@@H](C)c1cccc(O)c1 ZINC000838866161 1047166822 /nfs/dbraw/zinc/16/68/22/1047166822.db2.gz SOKNZOGKAMQVKJ-ZDUSSCGKSA-N 1 2 304.821 4.332 20 0 DIADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1nc(-c2ccsc2)oc1C ZINC000649720958 1047167121 /nfs/dbraw/zinc/16/71/21/1047167121.db2.gz RLHNDTWFJOUCHT-CABCVRRESA-N 1 2 320.458 4.101 20 0 DIADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1Cc1nc(-c2ccsc2)oc1C ZINC000649720958 1047167126 /nfs/dbraw/zinc/16/71/26/1047167126.db2.gz RLHNDTWFJOUCHT-CABCVRRESA-N 1 2 320.458 4.101 20 0 DIADLO C[C@H]1CN(c2ccc([NH2+]C3CC4(CCC4)C3)cc2)C[C@H](C)O1 ZINC000838878408 1047168391 /nfs/dbraw/zinc/16/83/91/1047168391.db2.gz LLGWNNHGCGSPEC-GJZGRUSLSA-N 1 2 300.446 4.045 20 0 DIADLO Cc1ccc(C[N@@H+]2CCn3c(Cl)ccc3[C@H]2C)c(Cl)n1 ZINC000838905196 1047171940 /nfs/dbraw/zinc/17/19/40/1047171940.db2.gz QIOHWUUMGANZCR-LLVKDONJSA-N 1 2 310.228 4.075 20 0 DIADLO Cc1ccc(C[N@H+]2CCn3c(Cl)ccc3[C@H]2C)c(Cl)n1 ZINC000838905196 1047171945 /nfs/dbraw/zinc/17/19/45/1047171945.db2.gz QIOHWUUMGANZCR-LLVKDONJSA-N 1 2 310.228 4.075 20 0 DIADLO Cc1ccc(C[N@@H+]2CCn3c(Cl)ccc3[C@@H]2C)c(Cl)n1 ZINC000838905198 1047172383 /nfs/dbraw/zinc/17/23/83/1047172383.db2.gz QIOHWUUMGANZCR-NSHDSACASA-N 1 2 310.228 4.075 20 0 DIADLO Cc1ccc(C[N@H+]2CCn3c(Cl)ccc3[C@@H]2C)c(Cl)n1 ZINC000838905198 1047172392 /nfs/dbraw/zinc/17/23/92/1047172392.db2.gz QIOHWUUMGANZCR-NSHDSACASA-N 1 2 310.228 4.075 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1ccc(C)nc1Cl ZINC000838917961 1047173217 /nfs/dbraw/zinc/17/32/17/1047173217.db2.gz PYUFVJCZDPBNHM-LLVKDONJSA-N 1 2 308.784 4.042 20 0 DIADLO Cc1cc(C)c(C(=O)NCCc2ccc3ccccc3c2)c(C)[nH+]1 ZINC001141543926 1047176165 /nfs/dbraw/zinc/17/61/65/1047176165.db2.gz DUIQSSNJGHXNJP-UHFFFAOYSA-N 1 2 318.420 4.133 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2C[C@@H](C)c2cccc(Cl)c2)no1 ZINC000682150900 1047178225 /nfs/dbraw/zinc/17/82/25/1047178225.db2.gz BQKNFWHXHBAVFH-WBMJQRKESA-N 1 2 319.836 4.362 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2C[C@@H](C)c2cccc(Cl)c2)no1 ZINC000682150900 1047178230 /nfs/dbraw/zinc/17/82/30/1047178230.db2.gz BQKNFWHXHBAVFH-WBMJQRKESA-N 1 2 319.836 4.362 20 0 DIADLO Cc1ccccc1[C@H](O)C1CC[NH+](C/C(Cl)=C\Cl)CC1 ZINC000796406225 1047197811 /nfs/dbraw/zinc/19/78/11/1047197811.db2.gz JWTGOTJWWOWXHB-HFQYIWAZSA-N 1 2 314.256 4.059 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)ccc1F)c1nc2ccccc2n1C ZINC000682533594 1047203588 /nfs/dbraw/zinc/20/35/88/1047203588.db2.gz DFKCEZAKBRWSJZ-LLVKDONJSA-N 1 2 317.795 4.217 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1cnc(Cl)s1 ZINC000760342542 1047216898 /nfs/dbraw/zinc/21/68/98/1047216898.db2.gz MPTCZPFVBUGMHV-UHFFFAOYSA-N 1 2 320.849 4.407 20 0 DIADLO CCc1cccc(Cl)c1C[N@@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000682777465 1047222799 /nfs/dbraw/zinc/22/27/99/1047222799.db2.gz AFLYOVCTTMTUHU-CQSZACIVSA-N 1 2 303.837 4.005 20 0 DIADLO CCc1cccc(Cl)c1C[N@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000682777465 1047222805 /nfs/dbraw/zinc/22/28/05/1047222805.db2.gz AFLYOVCTTMTUHU-CQSZACIVSA-N 1 2 303.837 4.005 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000682842737 1047229954 /nfs/dbraw/zinc/22/99/54/1047229954.db2.gz QYZMCITUBXRTHI-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000682842737 1047229962 /nfs/dbraw/zinc/22/99/62/1047229962.db2.gz QYZMCITUBXRTHI-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2cnc(-c3ccccc3)s2)cs1 ZINC001117657528 1047234903 /nfs/dbraw/zinc/23/49/03/1047234903.db2.gz MMHNOKSXZCYULP-NSHDSACASA-N 1 2 315.467 4.426 20 0 DIADLO Cc1cc(N[C@H]2CCO[C@@H](c3ccncc3)C2)[nH+]c2ccccc12 ZINC001117758603 1047243041 /nfs/dbraw/zinc/24/30/41/1047243041.db2.gz RLAGGRAWNHMLSG-QFBILLFUSA-N 1 2 319.408 4.270 20 0 DIADLO Cc1ccnc(C[N@@H+]2CCSC[C@H]2c2ccc(Cl)cc2)c1 ZINC000683008899 1047254258 /nfs/dbraw/zinc/25/42/58/1047254258.db2.gz FHLYBVFSLNUCNQ-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccnc(C[N@H+]2CCSC[C@H]2c2ccc(Cl)cc2)c1 ZINC000683008899 1047254269 /nfs/dbraw/zinc/25/42/69/1047254269.db2.gz FHLYBVFSLNUCNQ-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2cc(C)nc(Cl)c2)c1 ZINC001117979149 1047253911 /nfs/dbraw/zinc/25/39/11/1047253911.db2.gz UCDRQPVXDSKBND-UHFFFAOYSA-N 1 2 308.834 4.189 20 0 DIADLO Cc1ccnc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)c1 ZINC000683017787 1047257631 /nfs/dbraw/zinc/25/76/31/1047257631.db2.gz QRRQRGAPMVMTGK-GOSISDBHSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1ccnc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)c1 ZINC000683017787 1047257650 /nfs/dbraw/zinc/25/76/50/1047257650.db2.gz QRRQRGAPMVMTGK-GOSISDBHSA-N 1 2 302.368 4.395 20 0 DIADLO CCn1ccc(C[N@H+](C)Cc2nc(-c3cccs3)oc2C)c1 ZINC000683031807 1047260309 /nfs/dbraw/zinc/26/03/09/1047260309.db2.gz ZCMAAJJRKOHCNG-UHFFFAOYSA-N 1 2 315.442 4.165 20 0 DIADLO CCn1ccc(C[N@@H+](C)Cc2nc(-c3cccs3)oc2C)c1 ZINC000683031807 1047260319 /nfs/dbraw/zinc/26/03/19/1047260319.db2.gz ZCMAAJJRKOHCNG-UHFFFAOYSA-N 1 2 315.442 4.165 20 0 DIADLO CCn1ccc(C[N@H+](C)Cc2ncc(-c3ccccc3C)o2)c1 ZINC000683028907 1047260676 /nfs/dbraw/zinc/26/06/76/1047260676.db2.gz DAAVULRISGJHPI-UHFFFAOYSA-N 1 2 309.413 4.103 20 0 DIADLO CCn1ccc(C[N@@H+](C)Cc2ncc(-c3ccccc3C)o2)c1 ZINC000683028907 1047260684 /nfs/dbraw/zinc/26/06/84/1047260684.db2.gz DAAVULRISGJHPI-UHFFFAOYSA-N 1 2 309.413 4.103 20 0 DIADLO CCn1ccc(C[N@H+](C)Cc2nc(-c3ccccc3)oc2C)c1 ZINC000683029687 1047260900 /nfs/dbraw/zinc/26/09/00/1047260900.db2.gz NRCMRMFGOLNOFX-UHFFFAOYSA-N 1 2 309.413 4.103 20 0 DIADLO CCn1ccc(C[N@@H+](C)Cc2nc(-c3ccccc3)oc2C)c1 ZINC000683029687 1047260926 /nfs/dbraw/zinc/26/09/26/1047260926.db2.gz NRCMRMFGOLNOFX-UHFFFAOYSA-N 1 2 309.413 4.103 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(F)c(Cl)ccc2Br)C1 ZINC001141692801 1047266505 /nfs/dbraw/zinc/26/65/05/1047266505.db2.gz LJGNIFDZCUNZFL-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(F)c(Cl)ccc2Br)C1 ZINC001141692801 1047266511 /nfs/dbraw/zinc/26/65/11/1047266511.db2.gz LJGNIFDZCUNZFL-MRVPVSSYSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(F)c(Cl)ccc2Br)C1 ZINC001141692802 1047267578 /nfs/dbraw/zinc/26/75/78/1047267578.db2.gz LJGNIFDZCUNZFL-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(F)c(Cl)ccc2Br)C1 ZINC001141692802 1047267595 /nfs/dbraw/zinc/26/75/95/1047267595.db2.gz LJGNIFDZCUNZFL-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO Cc1nc2c(o1)CC[N@H+](Cc1ccc3c(c1)Cc1ccccc1-3)C2 ZINC001141741506 1047284990 /nfs/dbraw/zinc/28/49/90/1047284990.db2.gz UJYMRBJSERTNGW-UHFFFAOYSA-N 1 2 316.404 4.113 20 0 DIADLO Cc1nc2c(o1)CC[N@@H+](Cc1ccc3c(c1)Cc1ccccc1-3)C2 ZINC001141741506 1047284994 /nfs/dbraw/zinc/28/49/94/1047284994.db2.gz UJYMRBJSERTNGW-UHFFFAOYSA-N 1 2 316.404 4.113 20 0 DIADLO CCO[C@H]1C[C@H](Nc2ccc([NH+]3CCCC3)cc2)C12CCC2 ZINC000388266406 1047286355 /nfs/dbraw/zinc/28/63/55/1047286355.db2.gz MWJKZAWPDRQMKW-ROUUACIJSA-N 1 2 300.446 4.046 20 0 DIADLO CCO[C@@H]1C[C@@H](Nc2ccc([NH+]3CCCC3)cc2)C12CCC2 ZINC000388266405 1047287086 /nfs/dbraw/zinc/28/70/86/1047287086.db2.gz MWJKZAWPDRQMKW-QZTJIDSGSA-N 1 2 300.446 4.046 20 0 DIADLO Fc1cc(Br)cc(C[N@@H+]2CCC3(CCC3)C2)c1F ZINC001141802692 1047293206 /nfs/dbraw/zinc/29/32/06/1047293206.db2.gz DSFRSNNSKVWGGE-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Fc1cc(Br)cc(C[N@H+]2CCC3(CCC3)C2)c1F ZINC001141802692 1047293210 /nfs/dbraw/zinc/29/32/10/1047293210.db2.gz DSFRSNNSKVWGGE-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Cc1ccc2cc(C[NH2+]Cc3nc(C(C)(C)C)co3)ccc2n1 ZINC000897944020 1047303728 /nfs/dbraw/zinc/30/37/28/1047303728.db2.gz FERTZWAYQBVSOV-UHFFFAOYSA-N 1 2 309.413 4.119 20 0 DIADLO Fc1cc(C[N@@H+]2CCC3(CC3)C2)c(Cl)cc1Br ZINC001141923345 1047310860 /nfs/dbraw/zinc/31/08/60/1047310860.db2.gz WYQHBPGBQDYUHY-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO Fc1cc(C[N@H+]2CCC3(CC3)C2)c(Cl)cc1Br ZINC001141923345 1047310875 /nfs/dbraw/zinc/31/08/75/1047310875.db2.gz WYQHBPGBQDYUHY-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO Cc1ccc(Nc2nn(C[N@H+]3CC[C@H](C)C3)c(=S)s2)cc1 ZINC000725779847 1047313472 /nfs/dbraw/zinc/31/34/72/1047313472.db2.gz RXYNGHDCJROBFC-LBPRGKRZSA-N 1 2 320.487 4.025 20 0 DIADLO Cc1ccc(Nc2nn(C[N@@H+]3CC[C@H](C)C3)c(=S)s2)cc1 ZINC000725779847 1047313484 /nfs/dbraw/zinc/31/34/84/1047313484.db2.gz RXYNGHDCJROBFC-LBPRGKRZSA-N 1 2 320.487 4.025 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1nc(-c2ccccc2)c[nH]1 ZINC001118851962 1047313979 /nfs/dbraw/zinc/31/39/79/1047313979.db2.gz GZKKFLYLAUQFCQ-UHFFFAOYSA-N 1 2 306.413 4.063 20 0 DIADLO CCCOc1ccccc1C[N@@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001138995873 1047316867 /nfs/dbraw/zinc/31/68/67/1047316867.db2.gz XVNQBQTZXWNBBI-OAHLLOKOSA-N 1 2 301.352 4.045 20 0 DIADLO CCCOc1ccccc1C[N@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001138995873 1047316878 /nfs/dbraw/zinc/31/68/78/1047316878.db2.gz XVNQBQTZXWNBBI-OAHLLOKOSA-N 1 2 301.352 4.045 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001118944809 1047318368 /nfs/dbraw/zinc/31/83/68/1047318368.db2.gz UARUOXXQFVDWRN-JSGCOSHPSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001118944809 1047318388 /nfs/dbraw/zinc/31/83/88/1047318388.db2.gz UARUOXXQFVDWRN-JSGCOSHPSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1cccc2c1OCO2 ZINC001141960553 1047319015 /nfs/dbraw/zinc/31/90/15/1047319015.db2.gz VSDRSZALLATAIA-LBPRGKRZSA-N 1 2 303.789 4.262 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1cccc2c1OCO2 ZINC001141960553 1047319027 /nfs/dbraw/zinc/31/90/27/1047319027.db2.gz VSDRSZALLATAIA-LBPRGKRZSA-N 1 2 303.789 4.262 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001118944810 1047319918 /nfs/dbraw/zinc/31/99/18/1047319918.db2.gz UARUOXXQFVDWRN-OCCSQVGLSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001118944810 1047319934 /nfs/dbraw/zinc/31/99/34/1047319934.db2.gz UARUOXXQFVDWRN-OCCSQVGLSA-N 1 2 323.362 4.240 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1nc3ccccc3[nH]1)[C@H]2C ZINC001119293374 1047326411 /nfs/dbraw/zinc/32/64/11/1047326411.db2.gz CGCGLRKJEIMAEY-KBPBESRZSA-N 1 2 321.424 4.079 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1nc3ccccc3[nH]1)[C@H]2C ZINC001119293374 1047326428 /nfs/dbraw/zinc/32/64/28/1047326428.db2.gz CGCGLRKJEIMAEY-KBPBESRZSA-N 1 2 321.424 4.079 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1nc3ccccc3[nH]1)[C@H]2C ZINC001119293375 1047327109 /nfs/dbraw/zinc/32/71/09/1047327109.db2.gz CGCGLRKJEIMAEY-KGLIPLIRSA-N 1 2 321.424 4.079 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1nc3ccccc3[nH]1)[C@H]2C ZINC001119293375 1047327124 /nfs/dbraw/zinc/32/71/24/1047327124.db2.gz CGCGLRKJEIMAEY-KGLIPLIRSA-N 1 2 321.424 4.079 20 0 DIADLO CCc1nc(C)c(C[NH2+][C@H]2CCc3ccc(F)c(Cl)c32)o1 ZINC000651816549 1047328709 /nfs/dbraw/zinc/32/87/09/1047328709.db2.gz ZJPPTHZEEPSIII-LBPRGKRZSA-N 1 2 308.784 4.115 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1nc3ccccc3[nH]1)[C@@H]2C ZINC001119293377 1047329113 /nfs/dbraw/zinc/32/91/13/1047329113.db2.gz CGCGLRKJEIMAEY-ZIAGYGMSSA-N 1 2 321.424 4.079 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1nc3ccccc3[nH]1)[C@@H]2C ZINC001119293377 1047329123 /nfs/dbraw/zinc/32/91/23/1047329123.db2.gz CGCGLRKJEIMAEY-ZIAGYGMSSA-N 1 2 321.424 4.079 20 0 DIADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1ccc(-c2ccccc2)cn1 ZINC000651822534 1047329440 /nfs/dbraw/zinc/32/94/40/1047329440.db2.gz AQFFNKPDSUQVNO-ZRGWGRIASA-N 1 2 318.424 4.302 20 0 DIADLO FC(F)(F)Sc1ccccc1C[NH2+]Cc1nccs1 ZINC000898280670 1047335376 /nfs/dbraw/zinc/33/53/76/1047335376.db2.gz GKOIMPSLSSKJHS-UHFFFAOYSA-N 1 2 304.362 4.045 20 0 DIADLO CC(=O)[C@H]1CCCC[N@@H+]1Cc1sccc1Oc1ccccc1 ZINC001142000938 1047339599 /nfs/dbraw/zinc/33/95/99/1047339599.db2.gz BUYQJMJMYBPENJ-MRXNPFEDSA-N 1 2 315.438 4.484 20 0 DIADLO CC(=O)[C@H]1CCCC[N@H+]1Cc1sccc1Oc1ccccc1 ZINC001142000938 1047339609 /nfs/dbraw/zinc/33/96/09/1047339609.db2.gz BUYQJMJMYBPENJ-MRXNPFEDSA-N 1 2 315.438 4.484 20 0 DIADLO CC[C@@H]1COCC[N@@H+]1Cc1sccc1Oc1ccccc1 ZINC001142000953 1047339984 /nfs/dbraw/zinc/33/99/84/1047339984.db2.gz CMXKIAITVKCVIE-CQSZACIVSA-N 1 2 303.427 4.151 20 0 DIADLO CC[C@@H]1COCC[N@H+]1Cc1sccc1Oc1ccccc1 ZINC001142000953 1047339995 /nfs/dbraw/zinc/33/99/95/1047339995.db2.gz CMXKIAITVKCVIE-CQSZACIVSA-N 1 2 303.427 4.151 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CCC[C@@H](c3ncccc3C)C2)c1 ZINC000652067695 1047340951 /nfs/dbraw/zinc/34/09/51/1047340951.db2.gz DGZSIGFNMUUTBV-IAGOWNOFSA-N 1 2 311.429 4.070 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CCC[C@H](c3ncccc3C)C2)c1 ZINC000652067694 1047341589 /nfs/dbraw/zinc/34/15/89/1047341589.db2.gz DGZSIGFNMUUTBV-DLBZAZTESA-N 1 2 311.429 4.070 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]C2(c3ccccc3Cl)CCC2)c2nccn21 ZINC000652216946 1047349018 /nfs/dbraw/zinc/34/90/18/1047349018.db2.gz KGWAHVVRXJRPPL-DOMZBBRYSA-N 1 2 301.821 4.211 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@H](Cc2ccccc2)c2nccn2C)o1 ZINC000652274424 1047352502 /nfs/dbraw/zinc/35/25/02/1047352502.db2.gz NQDSCBPPPCTZMX-CRAIPNDOSA-N 1 2 323.440 4.210 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2ccccc2Br)c1 ZINC000652330143 1047353844 /nfs/dbraw/zinc/35/38/44/1047353844.db2.gz WHHLMFBGADMWHO-NSHDSACASA-N 1 2 321.218 4.164 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2cccc(C(F)(F)F)c2)c1 ZINC000652330096 1047354209 /nfs/dbraw/zinc/35/42/09/1047354209.db2.gz ULXVKPIECWEWBN-LLVKDONJSA-N 1 2 310.319 4.420 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2ccc(Cl)cc2OC)c1 ZINC000652331537 1047355327 /nfs/dbraw/zinc/35/53/27/1047355327.db2.gz KAZJFQLXQYUNRU-NSHDSACASA-N 1 2 306.793 4.063 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2cc(Cl)ccc2OC)c1 ZINC000652330402 1047355891 /nfs/dbraw/zinc/35/58/91/1047355891.db2.gz FFXCPCSOBUVPKS-NSHDSACASA-N 1 2 306.793 4.063 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@H+](CC)Cc2ccoc2)cc1 ZINC000726598821 1047368787 /nfs/dbraw/zinc/36/87/87/1047368787.db2.gz YYIHHRSSRPFBPN-HNNXBMFYSA-N 1 2 314.429 4.254 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@@H+](CC)Cc2ccoc2)cc1 ZINC000726598821 1047368797 /nfs/dbraw/zinc/36/87/97/1047368797.db2.gz YYIHHRSSRPFBPN-HNNXBMFYSA-N 1 2 314.429 4.254 20 0 DIADLO FC1(F)CC[NH+](Cc2coc(-c3ccc(Cl)cc3)n2)CC1 ZINC000796542977 1047383131 /nfs/dbraw/zinc/38/31/31/1047383131.db2.gz NYFFOAYZRQLIDV-UHFFFAOYSA-N 1 2 312.747 4.226 20 0 DIADLO Cc1cc(C)c(NC(=O)NCCCCc2ccccc2)c(C)[nH+]1 ZINC000653177553 1047385176 /nfs/dbraw/zinc/38/51/76/1047385176.db2.gz LDCVHVHLSRNBRA-UHFFFAOYSA-N 1 2 311.429 4.151 20 0 DIADLO COc1ccc2c(c1)[C@H](C(=O)Nc1c(C)cc(C)[nH+]c1C)CCC2 ZINC000653540349 1047398203 /nfs/dbraw/zinc/39/82/03/1047398203.db2.gz DKHXASPSUIOBLB-QGZVFWFLSA-N 1 2 324.424 4.074 20 0 DIADLO Cc1nc(C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)oc1C ZINC000083422631 1047411241 /nfs/dbraw/zinc/41/12/41/1047411241.db2.gz FHFSONVNCDJOGO-UHFFFAOYSA-N 1 2 302.805 4.234 20 0 DIADLO Cc1nc(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)oc1C ZINC000083422631 1047411253 /nfs/dbraw/zinc/41/12/53/1047411253.db2.gz FHFSONVNCDJOGO-UHFFFAOYSA-N 1 2 302.805 4.234 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ccsc3C)c2)[nH+]c1C ZINC001142247011 1047415736 /nfs/dbraw/zinc/41/57/36/1047415736.db2.gz HCTXJBPUCBHYET-UHFFFAOYSA-N 1 2 311.410 4.316 20 0 DIADLO CC[C@@H]([NH2+]Cc1nccn1Cc1ccccc1)c1ccccc1F ZINC000653792515 1047423998 /nfs/dbraw/zinc/42/39/98/1047423998.db2.gz JUIATXNOYARSJQ-LJQANCHMSA-N 1 2 323.415 4.311 20 0 DIADLO COc1cc(Nc2ccc(N)c(Cl)c2)[nH+]cc1C(F)(F)F ZINC001212112683 1047425163 /nfs/dbraw/zinc/42/51/63/1047425163.db2.gz NCCOGXUKRMVHHI-UHFFFAOYSA-N 1 2 317.698 4.088 20 0 DIADLO COc1cc(C[NH2+][C@@H](Cc2ccccc2)c2ncco2)ccc1C ZINC000653913199 1047434283 /nfs/dbraw/zinc/43/42/83/1047434283.db2.gz QIWABHDWOACTFJ-SFHVURJKSA-N 1 2 322.408 4.065 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2cc[nH]n2)c2ccc(Cl)cc2)cc1 ZINC000537612346 1047444629 /nfs/dbraw/zinc/44/46/29/1047444629.db2.gz WLZCINYHBCNNHU-KRWDZBQOSA-N 1 2 315.779 4.081 20 0 DIADLO CCc1cc(C[NH2+][C@@H](c2ccccc2)c2ccc(OC)cc2)on1 ZINC000537610881 1047446118 /nfs/dbraw/zinc/44/61/18/1047446118.db2.gz SZXJUUWOUINCFF-FQEVSTJZSA-N 1 2 322.408 4.125 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](C)Cc2c(C)cccc2C)cs1 ZINC000750061877 1047455080 /nfs/dbraw/zinc/45/50/80/1047455080.db2.gz XHOPNGQVHXMGJG-CQSZACIVSA-N 1 2 304.459 4.099 20 0 DIADLO COc1ccc(C[N@H+]2CC=C(C(F)(F)F)CC2)c(Cl)c1 ZINC000537615692 1047455134 /nfs/dbraw/zinc/45/51/34/1047455134.db2.gz ALFRIQLUBOLIOW-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO COc1ccc(C[N@@H+]2CC=C(C(F)(F)F)CC2)c(Cl)c1 ZINC000537615692 1047455145 /nfs/dbraw/zinc/45/51/45/1047455145.db2.gz ALFRIQLUBOLIOW-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](C)Cc2c(C)cccc2C)cs1 ZINC000750061877 1047455087 /nfs/dbraw/zinc/45/50/87/1047455087.db2.gz XHOPNGQVHXMGJG-CQSZACIVSA-N 1 2 304.459 4.099 20 0 DIADLO CCOc1c(Cl)cc(NCc2c[nH+]cn2CC)cc1Cl ZINC000841876087 1047461597 /nfs/dbraw/zinc/46/15/97/1047461597.db2.gz WBTHNDULQJGMSS-UHFFFAOYSA-N 1 2 314.216 4.221 20 0 DIADLO Cc1nc(C[N@H+]2C[C@@H](c3ccccc3C)OC[C@H]2C)sc1C ZINC000088601984 1047466053 /nfs/dbraw/zinc/46/60/53/1047466053.db2.gz YWZMDBYLWXRIMM-DYVFJYSZSA-N 1 2 316.470 4.030 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@@H](c3ccccc3C)OC[C@H]2C)sc1C ZINC000088601984 1047466058 /nfs/dbraw/zinc/46/60/58/1047466058.db2.gz YWZMDBYLWXRIMM-DYVFJYSZSA-N 1 2 316.470 4.030 20 0 DIADLO CC[N@H+](Cc1cnc(C)nc1)Cc1ccc(Cl)cc1Cl ZINC001203122310 1047469601 /nfs/dbraw/zinc/46/96/01/1047469601.db2.gz WNYAWTSDOZDCAB-UHFFFAOYSA-N 1 2 310.228 4.114 20 0 DIADLO CC[N@@H+](Cc1cnc(C)nc1)Cc1ccc(Cl)cc1Cl ZINC001203122310 1047469607 /nfs/dbraw/zinc/46/96/07/1047469607.db2.gz WNYAWTSDOZDCAB-UHFFFAOYSA-N 1 2 310.228 4.114 20 0 DIADLO CC(C)(C)Sc1ccccc1NC(=O)[C@H]1CC2CC[NH+]1CC2 ZINC001142632574 1047473964 /nfs/dbraw/zinc/47/39/64/1047473964.db2.gz FLYSYHKDOHHTFE-OAHLLOKOSA-N 1 2 318.486 4.000 20 0 DIADLO CC(C)CO[C@H]1CC[N@H+](Cc2csc(-c3cccs3)n2)C1 ZINC000119979401 1047478726 /nfs/dbraw/zinc/47/87/26/1047478726.db2.gz AEAVHMHJALEFHS-AWEZNQCLSA-N 1 2 322.499 4.119 20 0 DIADLO CC(C)CO[C@H]1CC[N@@H+](Cc2csc(-c3cccs3)n2)C1 ZINC000119979401 1047478735 /nfs/dbraw/zinc/47/87/35/1047478735.db2.gz AEAVHMHJALEFHS-AWEZNQCLSA-N 1 2 322.499 4.119 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2Cl)C[N@@H+]1Cc1ccsc1 ZINC000537627486 1047485848 /nfs/dbraw/zinc/48/58/48/1047485848.db2.gz UUEXEQGMVWFUKT-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2Cl)C[N@H+]1Cc1ccsc1 ZINC000537627486 1047485854 /nfs/dbraw/zinc/48/58/54/1047485854.db2.gz UUEXEQGMVWFUKT-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO CC(C)C[C@H]1COCC[N@@H+]1Cc1cnc(C2CCCC2)s1 ZINC000537628256 1047489093 /nfs/dbraw/zinc/48/90/93/1047489093.db2.gz XKGQCNXRTPMDDN-HNNXBMFYSA-N 1 2 308.491 4.048 20 0 DIADLO CC(C)C[C@H]1COCC[N@H+]1Cc1cnc(C2CCCC2)s1 ZINC000537628256 1047489095 /nfs/dbraw/zinc/48/90/95/1047489095.db2.gz XKGQCNXRTPMDDN-HNNXBMFYSA-N 1 2 308.491 4.048 20 0 DIADLO CCO[C@H](C)c1noc(C[NH2+][C@@H](c2ccccc2)C(C)(C)C)n1 ZINC000120510670 1047493956 /nfs/dbraw/zinc/49/39/56/1047493956.db2.gz JWCTYHYHPMYLKN-CJNGLKHVSA-N 1 2 317.433 4.044 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCSC[C@@H]3C)cs2)cc1 ZINC000537630141 1047496818 /nfs/dbraw/zinc/49/68/18/1047496818.db2.gz PPMVDHRHNUOJHN-ZDUSSCGKSA-N 1 2 304.484 4.056 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCSC[C@@H]3C)cs2)cc1 ZINC000537630141 1047496819 /nfs/dbraw/zinc/49/68/19/1047496819.db2.gz PPMVDHRHNUOJHN-ZDUSSCGKSA-N 1 2 304.484 4.056 20 0 DIADLO c1csc(-c2nc(CSCCn3cc[nH+]c3)cs2)c1 ZINC000090199784 1047499462 /nfs/dbraw/zinc/49/94/62/1047499462.db2.gz QJCSTAHNIXOUOP-UHFFFAOYSA-N 1 2 307.469 4.002 20 0 DIADLO FC1(F)CCCC[N@H+](Cc2cccc(-c3ccccn3)c2)C1 ZINC001142828895 1047500365 /nfs/dbraw/zinc/50/03/65/1047500365.db2.gz MEEVJBBMPSLUHI-UHFFFAOYSA-N 1 2 302.368 4.370 20 0 DIADLO FC1(F)CCCC[N@@H+](Cc2cccc(-c3ccccn3)c2)C1 ZINC001142828895 1047500368 /nfs/dbraw/zinc/50/03/68/1047500368.db2.gz MEEVJBBMPSLUHI-UHFFFAOYSA-N 1 2 302.368 4.370 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+][C@@H](CN1CCCC1)c1ccccc1 ZINC000120826702 1047503789 /nfs/dbraw/zinc/50/37/89/1047503789.db2.gz BNYBLUMJZFAAKW-XLIONFOSSA-N 1 2 324.468 4.183 20 0 DIADLO Clc1ccc(Sc2ccccc2C[NH+]2CCOCC2)cc1 ZINC001142863096 1047505576 /nfs/dbraw/zinc/50/55/76/1047505576.db2.gz LSOPZUXWFARHNS-UHFFFAOYSA-N 1 2 319.857 4.323 20 0 DIADLO C[C@H]([NH2+][C@H](c1cccc(F)c1)c1ccccn1)c1cccnc1 ZINC000090955973 1047513732 /nfs/dbraw/zinc/51/37/32/1047513732.db2.gz VSTRFGKVDVDKKJ-IFXJQAMLSA-N 1 2 307.372 4.056 20 0 DIADLO C[N@H+](Cc1cccn2ccnc12)Cc1ccc(Cl)cc1Cl ZINC001142944013 1047519220 /nfs/dbraw/zinc/51/92/20/1047519220.db2.gz GNAVLNWRDLYYDI-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1cccn2ccnc12)Cc1ccc(Cl)cc1Cl ZINC001142944013 1047519223 /nfs/dbraw/zinc/51/92/23/1047519223.db2.gz GNAVLNWRDLYYDI-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1csc(-c2ccsc2)n1 ZINC000091990593 1047527519 /nfs/dbraw/zinc/52/75/19/1047527519.db2.gz OYFKQTSSVXWXCX-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1csc(-c2ccsc2)n1 ZINC000091990593 1047527525 /nfs/dbraw/zinc/52/75/25/1047527525.db2.gz OYFKQTSSVXWXCX-GFCCVEGCSA-N 1 2 315.467 4.460 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccccc3)C2)s1 ZINC000092486142 1047535449 /nfs/dbraw/zinc/53/54/49/1047535449.db2.gz ZFADSFOFVQHXGZ-RHSMWYFYSA-N 1 2 316.470 4.229 20 0 DIADLO CC(C)c1ncc(C[N@H+]2C[C@@H](C)O[C@@H](c3ccccc3)C2)s1 ZINC000092486142 1047535454 /nfs/dbraw/zinc/53/54/54/1047535454.db2.gz ZFADSFOFVQHXGZ-RHSMWYFYSA-N 1 2 316.470 4.229 20 0 DIADLO Fc1ccc2oc(C[N@@H+]3CCO[C@H](c4cccs4)C3)cc2c1 ZINC000092593460 1047536545 /nfs/dbraw/zinc/53/65/45/1047536545.db2.gz WYIYWYGWRKDPBC-INIZCTEOSA-N 1 2 317.385 4.207 20 0 DIADLO Fc1ccc2oc(C[N@H+]3CCO[C@H](c4cccs4)C3)cc2c1 ZINC000092593460 1047536550 /nfs/dbraw/zinc/53/65/50/1047536550.db2.gz WYIYWYGWRKDPBC-INIZCTEOSA-N 1 2 317.385 4.207 20 0 DIADLO Cc1csc(C[NH2+][C@H](CC(F)(F)F)c2ccc(F)cc2)n1 ZINC000092850486 1047539925 /nfs/dbraw/zinc/53/99/25/1047539925.db2.gz BNYZBELIJPVRLH-GFCCVEGCSA-N 1 2 318.339 4.374 20 0 DIADLO Fc1cccc(F)c1[C@H]1CCC[N@@H+]1Cc1cc2cccnc2[nH]1 ZINC001143228565 1047543195 /nfs/dbraw/zinc/54/31/95/1047543195.db2.gz FPFMLPNMBQSIAJ-MRXNPFEDSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1cccc(F)c1[C@H]1CCC[N@H+]1Cc1cc2cccnc2[nH]1 ZINC001143228565 1047543199 /nfs/dbraw/zinc/54/31/99/1047543199.db2.gz FPFMLPNMBQSIAJ-MRXNPFEDSA-N 1 2 313.351 4.178 20 0 DIADLO CCc1nc(C[NH2+][C@@H](CC)c2cc(C)ccc2OC)cs1 ZINC000093406207 1047546176 /nfs/dbraw/zinc/54/61/76/1047546176.db2.gz KDXNWPHRWUEUOX-HNNXBMFYSA-N 1 2 304.459 4.263 20 0 DIADLO CCOc1ccc(C[N@H+](Cc2ccco2)C2CC2)c(F)c1F ZINC001143278658 1047547556 /nfs/dbraw/zinc/54/75/56/1047547556.db2.gz LZHUHSMWWOARBP-UHFFFAOYSA-N 1 2 307.340 4.121 20 0 DIADLO CCOc1ccc(C[N@@H+](Cc2ccco2)C2CC2)c(F)c1F ZINC001143278658 1047547561 /nfs/dbraw/zinc/54/75/61/1047547561.db2.gz LZHUHSMWWOARBP-UHFFFAOYSA-N 1 2 307.340 4.121 20 0 DIADLO CC(=O)[C@H]1CCC[N@H+](Cc2c(Cl)cccc2C(F)(F)F)C1 ZINC001143288373 1047548171 /nfs/dbraw/zinc/54/81/71/1047548171.db2.gz GDHHWEQOFXCNSK-NSHDSACASA-N 1 2 319.754 4.160 20 0 DIADLO CC(=O)[C@H]1CCC[N@@H+](Cc2c(Cl)cccc2C(F)(F)F)C1 ZINC001143288373 1047548177 /nfs/dbraw/zinc/54/81/77/1047548177.db2.gz GDHHWEQOFXCNSK-NSHDSACASA-N 1 2 319.754 4.160 20 0 DIADLO C[N@H+](Cc1cccc2nonc21)Cc1c(Cl)cccc1Cl ZINC001203137344 1047552245 /nfs/dbraw/zinc/55/22/45/1047552245.db2.gz FIJZGGWACQDKIP-UHFFFAOYSA-N 1 2 322.195 4.162 20 0 DIADLO C[N@@H+](Cc1cccc2nonc21)Cc1c(Cl)cccc1Cl ZINC001203137344 1047552262 /nfs/dbraw/zinc/55/22/62/1047552262.db2.gz FIJZGGWACQDKIP-UHFFFAOYSA-N 1 2 322.195 4.162 20 0 DIADLO CCCn1cc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3o2)cn1 ZINC000537661389 1047571745 /nfs/dbraw/zinc/57/17/45/1047571745.db2.gz OXMAIGNVXBIKRS-KRWDZBQOSA-N 1 2 324.428 4.162 20 0 DIADLO CCCn1cc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3o2)cn1 ZINC000537661389 1047571751 /nfs/dbraw/zinc/57/17/51/1047571751.db2.gz OXMAIGNVXBIKRS-KRWDZBQOSA-N 1 2 324.428 4.162 20 0 DIADLO CC(=CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1)c1ccc(F)cc1 ZINC001150105789 1047573822 /nfs/dbraw/zinc/57/38/22/1047573822.db2.gz APLPLMYSSISADY-LUAWRHEFSA-N 1 2 309.344 4.052 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2ccn(C3CCCC3)n2)c1 ZINC000477154319 1047599733 /nfs/dbraw/zinc/59/97/33/1047599733.db2.gz UFWLEVQEYXMHEX-IBGZPJMESA-N 1 2 313.420 4.474 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2ccn(C3CCCC3)n2)c1 ZINC000477154319 1047599741 /nfs/dbraw/zinc/59/97/41/1047599741.db2.gz UFWLEVQEYXMHEX-IBGZPJMESA-N 1 2 313.420 4.474 20 0 DIADLO CC(C)N(C(=O)c1cc2c[nH+]ccc2[nH]1)[C@@H](C)c1ccccc1 ZINC001151971130 1047605165 /nfs/dbraw/zinc/60/51/65/1047605165.db2.gz DQHGTFYKUBQWKP-AWEZNQCLSA-N 1 2 307.397 4.175 20 0 DIADLO O=C(N[C@@H](c1ccccc1)C1CCCC1)c1cc2c[nH+]ccc2[nH]1 ZINC001151976707 1047605447 /nfs/dbraw/zinc/60/54/47/1047605447.db2.gz QSCHVZZAPWIBRR-IBGZPJMESA-N 1 2 319.408 4.224 20 0 DIADLO Cc1ccc(Nc2ccc(F)c(Br)c2O)c(C)[nH+]1 ZINC001203375863 1047610304 /nfs/dbraw/zinc/61/03/04/1047610304.db2.gz DFFWQJFGPVABRD-UHFFFAOYSA-N 1 2 311.154 4.049 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3C[C@H]3C3CCC3)cc2)[nH+]c1C ZINC001153555324 1047627809 /nfs/dbraw/zinc/62/78/09/1047627809.db2.gz JUGXSOSRRWBIIQ-DLBZAZTESA-N 1 2 309.413 4.068 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@]3(C)CCC[C@H]3C)cc2)[nH+]c1C ZINC001153557063 1047627875 /nfs/dbraw/zinc/62/78/75/1047627875.db2.gz TXTOKUHVBLOFHB-BLVKFPJESA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3C[C@@H]4C[C@@H]4C[C@H]3C)cc2)[nH+]c1C ZINC001153554966 1047628043 /nfs/dbraw/zinc/62/80/43/1047628043.db2.gz HXPYFWSHATWIIS-HJSDFSPCSA-N 1 2 323.440 4.314 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc(C4CCC4)cc3)cc2[nH+]1 ZINC000477673957 1047630564 /nfs/dbraw/zinc/63/05/64/1047630564.db2.gz ATYJKKDEYBVGBK-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO Cc1cc(C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)co1 ZINC000347412870 1047635830 /nfs/dbraw/zinc/63/58/30/1047635830.db2.gz LHRQWFZLBRPKOS-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)nc1 ZINC000538152703 1047660526 /nfs/dbraw/zinc/66/05/26/1047660526.db2.gz IDQKUMSFFGQZEB-MRXNPFEDSA-N 1 2 319.408 4.428 20 0 DIADLO Cc1oncc1CNc1cc(SCc2ccccc2)cc[nH+]1 ZINC001154887816 1047660767 /nfs/dbraw/zinc/66/07/67/1047660767.db2.gz UXSCDRORJBQYJJ-UHFFFAOYSA-N 1 2 311.410 4.282 20 0 DIADLO CC(=O)c1ccc2c(c1)CN(c1[nH+]ccc3c(C)cccc31)CC2 ZINC001155070938 1047666894 /nfs/dbraw/zinc/66/68/94/1047666894.db2.gz BXIVIBJRVIVCPJ-UHFFFAOYSA-N 1 2 316.404 4.309 20 0 DIADLO Cc1ccc2c(c1)[C@H](Nc1[nH+]ccc3cc(Cl)ccc31)C(=O)N2 ZINC001155109112 1047667893 /nfs/dbraw/zinc/66/78/93/1047667893.db2.gz ZXVLSXHIEVXXQP-INIZCTEOSA-N 1 2 323.783 4.302 20 0 DIADLO Cc1ccc2c(c1)[C@@H](Nc1cc(C)c3cccc(C)c3[nH+]1)C(=O)N2 ZINC001155106474 1047667928 /nfs/dbraw/zinc/66/79/28/1047667928.db2.gz AAQIWPLMRHYZQO-LJQANCHMSA-N 1 2 317.392 4.265 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)c2oc3ccccc3c2C)[nH+]c1C ZINC001155173287 1047670006 /nfs/dbraw/zinc/67/00/06/1047670006.db2.gz DNPOQHGZFQKTIY-OAHLLOKOSA-N 1 2 323.396 4.058 20 0 DIADLO COc1cc2ccc(NC[C@@H]3CCC(F)(F)C3)[nH+]c2cc1OC ZINC001155172278 1047670039 /nfs/dbraw/zinc/67/00/39/1047670039.db2.gz BMMMWQZRYRCFJV-LLVKDONJSA-N 1 2 322.355 4.099 20 0 DIADLO Cc1nc(N2CCC(n3ccc4ccccc43)CC2)c(C)c(C)[nH+]1 ZINC001155262539 1047674247 /nfs/dbraw/zinc/67/42/47/1047674247.db2.gz BKGJKVQIKPQYIR-UHFFFAOYSA-N 1 2 320.440 4.198 20 0 DIADLO CC(C)=CCC[C@@H](C)[NH2+]c1ccc(N2CCOCC2)cc1C ZINC000538509510 1047684401 /nfs/dbraw/zinc/68/44/01/1047684401.db2.gz YBITVVSDZZJLGD-QGZVFWFLSA-N 1 2 302.462 4.378 20 0 DIADLO CC[C@@H](Nc1ccc([NH+]2CCCC2)cc1C)C1CCOCC1 ZINC000538508194 1047684575 /nfs/dbraw/zinc/68/45/75/1047684575.db2.gz AWSDPNDSNBUALQ-GOSISDBHSA-N 1 2 302.462 4.212 20 0 DIADLO CCOC(CCCNc1[nH+]ccc2cc(Cl)ccc21)OCC ZINC001155721789 1047687660 /nfs/dbraw/zinc/68/76/60/1047687660.db2.gz AKIOMZWONOITOJ-UHFFFAOYSA-N 1 2 322.836 4.479 20 0 DIADLO C[C@H]1Cc2ccc(F)cc2[C@H]1Nc1ccc(N2CCCC2)[nH+]c1 ZINC000538558433 1047687825 /nfs/dbraw/zinc/68/78/25/1047687825.db2.gz AZLUIEGMKSNUML-DJJJIMSYSA-N 1 2 311.404 4.166 20 0 DIADLO CCOC(=O)/C=C/c1ccc[nH+]c1NCc1ccc(C(C)C)cc1 ZINC001155946311 1047692096 /nfs/dbraw/zinc/69/20/96/1047692096.db2.gz YCHABIRGCIQGCJ-VAWYXSNFSA-N 1 2 324.424 4.393 20 0 DIADLO COc1cc(Cl)nc(NC(=[NH2+])C23CC4CC(CC(C4)C2)C3)c1 ZINC001155960663 1047693445 /nfs/dbraw/zinc/69/34/45/1047693445.db2.gz WMWQLMWYEKVXRJ-UHFFFAOYSA-N 1 2 319.836 4.349 20 0 DIADLO [NH2+]=C(Nc1cc(C2CCC2)ncn1)C12CC3CC(CC(C3)C1)C2 ZINC001155962483 1047693480 /nfs/dbraw/zinc/69/34/80/1047693480.db2.gz PICFRVAVFNTTSW-UHFFFAOYSA-N 1 2 310.445 4.350 20 0 DIADLO C[C@@]12c3ccccc3[C@@H](Cc3ccccc31)N2c1[nH+]cccc1N ZINC001156005007 1047696019 /nfs/dbraw/zinc/69/60/19/1047696019.db2.gz OCOMYUAWMVCUJH-CTNGQTDRSA-N 1 2 313.404 4.045 20 0 DIADLO CNc1ccc(CNc2[nH+]c3ccc(OC)cc3cc2C)cc1 ZINC001156135040 1047702267 /nfs/dbraw/zinc/70/22/67/1047702267.db2.gz SNDSLGSDYVZPHO-UHFFFAOYSA-N 1 2 307.397 4.206 20 0 DIADLO COc1ccccc1/C=C/C[N@@H+]1CCO[C@@H](c2ccccc2C)C1 ZINC000538729123 1047702357 /nfs/dbraw/zinc/70/23/57/1047702357.db2.gz RVBZLCFPYUGICP-TYOLEZHBSA-N 1 2 323.436 4.090 20 0 DIADLO COc1ccccc1/C=C/C[N@H+]1CCO[C@@H](c2ccccc2C)C1 ZINC000538729123 1047702363 /nfs/dbraw/zinc/70/23/63/1047702363.db2.gz RVBZLCFPYUGICP-TYOLEZHBSA-N 1 2 323.436 4.090 20 0 DIADLO C[N@H+](Cc1c[nH]nc1C(C)(C)C)Cc1ccc(F)cc1Cl ZINC000538734432 1047703191 /nfs/dbraw/zinc/70/31/91/1047703191.db2.gz AQXNXUUDJYIQFR-UHFFFAOYSA-N 1 2 309.816 4.132 20 0 DIADLO C[N@@H+](Cc1c[nH]nc1C(C)(C)C)Cc1ccc(F)cc1Cl ZINC000538734432 1047703193 /nfs/dbraw/zinc/70/31/93/1047703193.db2.gz AQXNXUUDJYIQFR-UHFFFAOYSA-N 1 2 309.816 4.132 20 0 DIADLO CC(C)(C)c1ccc(N[C@H](c2cccnc2)C(F)(F)F)[nH+]c1 ZINC001156163634 1047703917 /nfs/dbraw/zinc/70/39/17/1047703917.db2.gz VFDPLNQESXFXLH-CQSZACIVSA-N 1 2 309.335 4.490 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3F)C2)s1 ZINC000538739154 1047704789 /nfs/dbraw/zinc/70/47/89/1047704789.db2.gz RMHXQNLFNZBFBB-QGZVFWFLSA-N 1 2 305.418 4.023 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3F)C2)s1 ZINC000538739154 1047704792 /nfs/dbraw/zinc/70/47/92/1047704792.db2.gz RMHXQNLFNZBFBB-QGZVFWFLSA-N 1 2 305.418 4.023 20 0 DIADLO C[C@@H]1C[N@H+](C/C=C/c2ccc(F)cc2)C[C@H](c2ccsc2)O1 ZINC000538750902 1047707222 /nfs/dbraw/zinc/70/72/22/1047707222.db2.gz GAECQPFUWKRNMM-HEFFKOALSA-N 1 2 317.429 4.362 20 0 DIADLO C[C@@H]1C[N@@H+](C/C=C/c2ccc(F)cc2)C[C@H](c2ccsc2)O1 ZINC000538750902 1047707228 /nfs/dbraw/zinc/70/72/28/1047707228.db2.gz GAECQPFUWKRNMM-HEFFKOALSA-N 1 2 317.429 4.362 20 0 DIADLO Cc1nc(NCCCc2ccncc2)cc(C2CCCCC2)[nH+]1 ZINC001156408385 1047710540 /nfs/dbraw/zinc/71/05/40/1047710540.db2.gz NJQHRGBLESEIMC-UHFFFAOYSA-N 1 2 310.445 4.272 20 0 DIADLO CCCOc1c(Cl)cc(C[N@@H+]2CC[C@@](C)(F)C2)cc1OC ZINC000538823888 1047715251 /nfs/dbraw/zinc/71/52/51/1047715251.db2.gz LKPVKMPFPLLWEC-MRXNPFEDSA-N 1 2 315.816 4.071 20 0 DIADLO CCCOc1c(Cl)cc(C[N@H+]2CC[C@@](C)(F)C2)cc1OC ZINC000538823888 1047715253 /nfs/dbraw/zinc/71/52/53/1047715253.db2.gz LKPVKMPFPLLWEC-MRXNPFEDSA-N 1 2 315.816 4.071 20 0 DIADLO Clc1ccc([C@@H]2COCCN2c2[nH+]ccc3ccccc32)cc1 ZINC001156714030 1047721431 /nfs/dbraw/zinc/72/14/31/1047721431.db2.gz JYQWUFPBTIVJGI-SFHVURJKSA-N 1 2 324.811 4.466 20 0 DIADLO Nc1cc(CNc2c(Cl)ccc3ccc(Cl)nc32)cc[nH+]1 ZINC001156764056 1047722132 /nfs/dbraw/zinc/72/21/32/1047722132.db2.gz QFJUYNSPAZDJPE-UHFFFAOYSA-N 1 2 319.195 4.131 20 0 DIADLO CN(Cc1ccc(-n2cc[nH+]c2)cc1)c1ccc2ccccc2n1 ZINC001156776217 1047722863 /nfs/dbraw/zinc/72/28/63/1047722863.db2.gz XFRXLPYAWPOGQZ-UHFFFAOYSA-N 1 2 314.392 4.057 20 0 DIADLO CN(Cc1ccc(-n2cc[nH+]c2)cc1)c1nccc2ccsc21 ZINC001156784803 1047722929 /nfs/dbraw/zinc/72/29/29/1047722929.db2.gz VAYRUMBPKXNPMF-UHFFFAOYSA-N 1 2 320.421 4.118 20 0 DIADLO Cc1nc(N2CCC[C@@H]2c2c(F)cccc2F)c(C)c(C)[nH+]1 ZINC001156948377 1047730576 /nfs/dbraw/zinc/73/05/76/1047730576.db2.gz SGDCHXZTOHHDOO-OAHLLOKOSA-N 1 2 303.356 4.022 20 0 DIADLO Cc1nc(NC2c3ccccc3-c3ccccc32)c2c([nH+]1)CCC2 ZINC001156966819 1047731020 /nfs/dbraw/zinc/73/10/20/1047731020.db2.gz WIMZDCJTAJGMLB-UHFFFAOYSA-N 1 2 313.404 4.456 20 0 DIADLO CC(C)c1[nH]cc(CNC(=O)c2cc3ccc(C(C)C)cc3[nH]2)[nH+]1 ZINC001157118568 1047735287 /nfs/dbraw/zinc/73/52/87/1047735287.db2.gz BVSMSYUBGMCRIS-UHFFFAOYSA-N 1 2 324.428 4.068 20 0 DIADLO CC(C)c1[nH]c(CNC(=O)c2cc3ccc(C(C)C)cc3[nH]2)c[nH+]1 ZINC001157118568 1047735290 /nfs/dbraw/zinc/73/52/90/1047735290.db2.gz BVSMSYUBGMCRIS-UHFFFAOYSA-N 1 2 324.428 4.068 20 0 DIADLO FC(F)(F)c1n[nH]c2c1CCN(c1cc3ccccc3c[nH+]1)C2 ZINC001157341403 1047739837 /nfs/dbraw/zinc/73/98/37/1047739837.db2.gz DFCAGXNOUBCBSM-OAHLLOKOSA-N 1 2 318.302 4.096 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nccn2C)c(OCCC(C)C)c1 ZINC000539319371 1047746215 /nfs/dbraw/zinc/74/62/15/1047746215.db2.gz IZTPKODLWSCMKN-MRXNPFEDSA-N 1 2 315.461 4.004 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1cn(C(C)C)nn1 ZINC000924692736 1047749539 /nfs/dbraw/zinc/74/95/39/1047749539.db2.gz RJFUHIPFKLDDAI-CABCVRRESA-N 1 2 316.449 4.058 20 0 DIADLO COC[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1ccc(F)cc1 ZINC000539379962 1047750663 /nfs/dbraw/zinc/75/06/63/1047750663.db2.gz KAIOWWBMGOMNNR-MRXNPFEDSA-N 1 2 311.759 4.096 20 0 DIADLO COc1ccc2[nH+]c(N[C@H]3CCCc4cccnc43)cc(C)c2c1 ZINC001157842896 1047758699 /nfs/dbraw/zinc/75/86/99/1047758699.db2.gz JZMWLVVCRMEQCF-SFHVURJKSA-N 1 2 319.408 4.436 20 0 DIADLO COc1ccc2[nH+]c(N[C@H]3CCCc4cccnc43)c(C)cc2c1 ZINC001157839069 1047758823 /nfs/dbraw/zinc/75/88/23/1047758823.db2.gz FILBISWQSFIFGM-SFHVURJKSA-N 1 2 319.408 4.436 20 0 DIADLO COc1ccc2[nH+]c(N[C@H](C)CCCC(C)(C)O)c(C)cc2c1 ZINC001157886370 1047761767 /nfs/dbraw/zinc/76/17/67/1047761767.db2.gz HQAZRBCRRVLRSX-CQSZACIVSA-N 1 2 316.445 4.293 20 0 DIADLO CCc1cc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)oc1CC ZINC000478022933 1047765067 /nfs/dbraw/zinc/76/50/67/1047765067.db2.gz ZCLKLMUPUIWJCC-UHFFFAOYSA-N 1 2 323.396 4.355 20 0 DIADLO Cc1cc(Cl)c(C)c(N2C[C@H](C)OC[C@@H]2c2ccccc2)[nH+]1 ZINC001158289235 1047773514 /nfs/dbraw/zinc/77/35/14/1047773514.db2.gz UBWSARYLQSUHTK-SUMWQHHRSA-N 1 2 316.832 4.318 20 0 DIADLO Fc1ccc2c(c1)[nH]c1nc[nH+]c(N[C@H]3CCCC(F)(F)C3)c21 ZINC001158339037 1047775851 /nfs/dbraw/zinc/77/58/51/1047775851.db2.gz YCHRZPPQSRHLJV-JTQLQIEISA-N 1 2 320.318 4.240 20 0 DIADLO COCc1cc[nH+]c(NCCCc2ccc(C(F)(F)F)cc2)c1 ZINC001158460629 1047780753 /nfs/dbraw/zinc/78/07/53/1047780753.db2.gz TXYKGTXYSBUSAE-UHFFFAOYSA-N 1 2 324.346 4.292 20 0 DIADLO CSc1cc[nH+]c(N[C@H](CCO)c2cccc3ccccc32)c1 ZINC001158510036 1047787886 /nfs/dbraw/zinc/78/78/86/1047787886.db2.gz SWMMULJVWKXHHH-GOSISDBHSA-N 1 2 324.449 4.492 20 0 DIADLO Cc1cc(N[C@@H]2CCc3ccccc3[C@@H]2O)[nH+]c2ccccc12 ZINC001158686072 1047794375 /nfs/dbraw/zinc/79/43/75/1047794375.db2.gz WBGPEMSTJMBCCB-QUCCMNQESA-N 1 2 304.393 4.004 20 0 DIADLO Cc1cc(N[C@H]2CCc3ccccc3[C@H]2O)[nH+]c2ccccc12 ZINC001158686068 1047794399 /nfs/dbraw/zinc/79/43/99/1047794399.db2.gz WBGPEMSTJMBCCB-AZUAARDMSA-N 1 2 304.393 4.004 20 0 DIADLO Cc1c(F)cc[nH+]c1N1CCC2(CC1)O[C@H](C)c1ccccc12 ZINC001158749802 1047796660 /nfs/dbraw/zinc/79/66/60/1047796660.db2.gz LBCYQDMCGWCOEV-CQSZACIVSA-N 1 2 312.388 4.116 20 0 DIADLO Clc1cc2c(cn1)CN(c1cc(-c3ccccc3)cc[nH+]1)C2 ZINC001158753841 1047797172 /nfs/dbraw/zinc/79/71/72/1047797172.db2.gz LUTATHNYCWVRAG-UHFFFAOYSA-N 1 2 307.784 4.317 20 0 DIADLO CC(C)[C@H](Nc1cc(N2CCCC2)nc[nH+]1)c1ccc(F)cc1 ZINC000552909991 1047804848 /nfs/dbraw/zinc/80/48/48/1047804848.db2.gz ZHVSPSOMZKVKRS-SFHVURJKSA-N 1 2 314.408 4.025 20 0 DIADLO CC(C)[C@H](Nc1cc(N2CCCC2)[nH+]cn1)c1ccc(F)cc1 ZINC000552909991 1047804854 /nfs/dbraw/zinc/80/48/54/1047804854.db2.gz ZHVSPSOMZKVKRS-SFHVURJKSA-N 1 2 314.408 4.025 20 0 DIADLO Fc1cnc2[nH]cc(Nc3cc[nH+]c4ccc(Cl)cc34)c2c1 ZINC001159154036 1047817246 /nfs/dbraw/zinc/81/72/46/1047817246.db2.gz MREVWIAGANAIEW-UHFFFAOYSA-N 1 2 312.735 4.069 20 0 DIADLO Nc1ccc(Nc2ccc(OCc3ccc(F)cc3)cc2)c[nH+]1 ZINC001159280782 1047825472 /nfs/dbraw/zinc/82/54/72/1047825472.db2.gz FGDXTVXYCRKFNW-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO CC(C)(C)C(=O)Nc1cccc(Cl)c1Nc1ccc(N)[nH+]c1 ZINC001159281856 1047825684 /nfs/dbraw/zinc/82/56/84/1047825684.db2.gz FEJXTGBUBASNHW-UHFFFAOYSA-N 1 2 318.808 4.045 20 0 DIADLO CCc1ccc(NC(=O)C[C@@H](c2[nH]cc[nH+]2)c2ccccc2)cc1 ZINC000553202544 1047830144 /nfs/dbraw/zinc/83/01/44/1047830144.db2.gz XBYJVGFKILAOET-GOSISDBHSA-N 1 2 319.408 4.133 20 0 DIADLO CCc1ccccc1-c1noc([C@@H](CC(C)C)n2cc[nH+]c2)n1 ZINC000923806669 1047838320 /nfs/dbraw/zinc/83/83/20/1047838320.db2.gz FGKOHMKMXGFHEU-MRXNPFEDSA-N 1 2 310.401 4.131 20 0 DIADLO FC(F)(F)Oc1cc[nH+]c(Nc2ccc3c(c2)CCCN3)c1 ZINC001159416446 1047841995 /nfs/dbraw/zinc/84/19/95/1047841995.db2.gz ZLVZCBXGSARICX-UHFFFAOYSA-N 1 2 309.291 4.082 20 0 DIADLO Nc1ccc2cc(Nc3ccccc3-n3cc[nH+]c3)ccc2c1 ZINC001159448016 1047846233 /nfs/dbraw/zinc/84/62/33/1047846233.db2.gz PLXJCINUHMEKMI-UHFFFAOYSA-N 1 2 300.365 4.351 20 0 DIADLO Cc1cccc(NC(=O)C[C@H](C)Nc2c[nH+]cc3c2CCCC3)c1 ZINC001182843694 1047846760 /nfs/dbraw/zinc/84/67/60/1047846760.db2.gz FWZUQRJAJFZVAX-HNNXBMFYSA-N 1 2 323.440 4.098 20 0 DIADLO COc1c(Nc2ccc(N3CCCCC3)[nH+]c2)ccc(F)c1F ZINC001174525420 1047854351 /nfs/dbraw/zinc/85/43/51/1047854351.db2.gz YBJBYGSXOMCOHM-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO COCCOc1ccc(Nc2ccc([NH+]3CCCC3)cc2)cc1 ZINC001174525987 1047854709 /nfs/dbraw/zinc/85/47/09/1047854709.db2.gz BBZSRYMITXAVOL-UHFFFAOYSA-N 1 2 312.413 4.056 20 0 DIADLO c1cnn(-c2ccc(Nc3ccc([NH+]4CCCC4)cc3)cc2)c1 ZINC001174526378 1047855543 /nfs/dbraw/zinc/85/55/43/1047855543.db2.gz QGLPOJQMRLBWLT-UHFFFAOYSA-N 1 2 304.397 4.216 20 0 DIADLO COC(=O)Cc1cc(Nc2ccc([NH+]3CCCC3)cc2)ccc1C ZINC001174527623 1047856843 /nfs/dbraw/zinc/85/68/43/1047856843.db2.gz KIUSDGDZBGHKTN-UHFFFAOYSA-N 1 2 324.424 4.054 20 0 DIADLO CC(=O)Nc1ccc(Nc2ccc(C)[nH+]c2C)cc1C(F)(F)F ZINC001203374298 1047859461 /nfs/dbraw/zinc/85/94/61/1047859461.db2.gz XFOPZRWYEYVUND-UHFFFAOYSA-N 1 2 323.318 4.419 20 0 DIADLO Cc1cc(C[NH2+][C@@H](CCc2ccccc2)C(F)F)cc(C)c1O ZINC001182910947 1047862236 /nfs/dbraw/zinc/86/22/36/1047862236.db2.gz SMHVZPHTUQZXTK-KRWDZBQOSA-N 1 2 319.395 4.365 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@H+]2C[C@H](C)O[C@](C)(C(F)F)C2)cc1C ZINC001182970253 1047869501 /nfs/dbraw/zinc/86/95/01/1047869501.db2.gz LZCLVIOFGOQJLL-FQEKARNZSA-N 1 2 323.427 4.370 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@@H+]2C[C@H](C)O[C@](C)(C(F)F)C2)cc1C ZINC001182970253 1047869513 /nfs/dbraw/zinc/86/95/13/1047869513.db2.gz LZCLVIOFGOQJLL-FQEKARNZSA-N 1 2 323.427 4.370 20 0 DIADLO c1cc(-c2cccc(Nc3ccc[nH+]c3N3CCCCC3)c2)n[nH]1 ZINC001174506759 1047873637 /nfs/dbraw/zinc/87/36/37/1047873637.db2.gz WAYDIEYWEHBGMT-UHFFFAOYSA-N 1 2 319.412 4.206 20 0 DIADLO c1cc(-c2cccc(Nc3ccccc3-n3cc[nH+]c3)c2)n[nH]1 ZINC001174508764 1047873695 /nfs/dbraw/zinc/87/36/95/1047873695.db2.gz WBVHLYXMXMPTGN-UHFFFAOYSA-N 1 2 301.353 4.006 20 0 DIADLO CO[C@@]1(C)CCCN(c2cc[nH+]c3c(Cl)cccc23)CC1 ZINC000553561625 1047875528 /nfs/dbraw/zinc/87/55/28/1047875528.db2.gz AQALGNQEEKJXTG-KRWDZBQOSA-N 1 2 304.821 4.284 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccnn1CC1CCC1)c1c(F)cccc1F ZINC000924719893 1047877495 /nfs/dbraw/zinc/87/74/95/1047877495.db2.gz AXIGSKKNSXTOBR-QWHCGFSZSA-N 1 2 319.399 4.373 20 0 DIADLO c1cnn(-c2ccccc2Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174521639 1047882792 /nfs/dbraw/zinc/88/27/92/1047882792.db2.gz AOMBHVOOBXYZAE-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO Nc1cccc(Cl)c1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001159615732 1047883252 /nfs/dbraw/zinc/88/32/52/1047883252.db2.gz GQSPOEBVTQMDCH-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO FC(F)c1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)cn1 ZINC001174522973 1047883921 /nfs/dbraw/zinc/88/39/21/1047883921.db2.gz SLTVEDQXDGJYJC-UHFFFAOYSA-N 1 2 304.344 4.148 20 0 DIADLO Oc1ccc2ncc(Nc3ccc(N4CCCCC4)[nH+]c3)cc2c1 ZINC001174523198 1047884927 /nfs/dbraw/zinc/88/49/27/1047884927.db2.gz WZOWIYLFPDUVSR-UHFFFAOYSA-N 1 2 320.396 4.069 20 0 DIADLO Cc1nc(NCc2cccc3ccnn32)cc(C2CCCCC2)[nH+]1 ZINC001159617479 1047885066 /nfs/dbraw/zinc/88/50/66/1047885066.db2.gz ICNSWPONHHTEOA-UHFFFAOYSA-N 1 2 321.428 4.093 20 0 DIADLO O[C@@H]1CCCc2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc21 ZINC001174522778 1047885237 /nfs/dbraw/zinc/88/52/37/1047885237.db2.gz BRMSGNOMBNPCEX-LJQANCHMSA-N 1 2 323.440 4.185 20 0 DIADLO O=c1ccc2c(Nc3ccc(N4CCCCC4)[nH+]c3)cccc2[nH]1 ZINC001174522984 1047885336 /nfs/dbraw/zinc/88/53/36/1047885336.db2.gz FTPJEBXOOJNUIT-UHFFFAOYSA-N 1 2 320.396 4.069 20 0 DIADLO c1cc(N2CCCCC2)[nH+]cc1Nc1cncc(C2CCC2)c1 ZINC001174522545 1047885461 /nfs/dbraw/zinc/88/54/61/1047885461.db2.gz QXYPEDIUGQBHKP-UHFFFAOYSA-N 1 2 308.429 4.478 20 0 DIADLO Cc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)n(C(C)(C)C)n1 ZINC001174523623 1047885478 /nfs/dbraw/zinc/88/54/78/1047885478.db2.gz RXRLPWACRGTWDK-UHFFFAOYSA-N 1 2 313.449 4.075 20 0 DIADLO c1nc(C2CC2)sc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174521880 1047885798 /nfs/dbraw/zinc/88/57/98/1047885798.db2.gz BCPWWMGAGDSURY-UHFFFAOYSA-N 1 2 300.431 4.149 20 0 DIADLO c1cc(C2CCC2)c(Nc2ccc(N3CCCCC3)[nH+]c2)cn1 ZINC001174521847 1047886082 /nfs/dbraw/zinc/88/60/82/1047886082.db2.gz FXSBWJQGILYYEF-UHFFFAOYSA-N 1 2 308.429 4.478 20 0 DIADLO CC1(c2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc2)COC1 ZINC001174525204 1047886467 /nfs/dbraw/zinc/88/64/67/1047886467.db2.gz SFJKNXFVZJBAQL-UHFFFAOYSA-N 1 2 323.440 4.103 20 0 DIADLO CCC(=O)Nc1cccc(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174524831 1047887005 /nfs/dbraw/zinc/88/70/05/1047887005.db2.gz QXZBCRQKIPLZKY-UHFFFAOYSA-N 1 2 324.428 4.164 20 0 DIADLO Oc1cc(Cl)ccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174524888 1047887164 /nfs/dbraw/zinc/88/71/64/1047887164.db2.gz UNYUIIFRCAOLCM-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO CC1(C)C[C@]1([NH2+]Cc1ccc(O)c(F)c1F)c1ccccc1 ZINC001183065173 1047888541 /nfs/dbraw/zinc/88/85/41/1047888541.db2.gz HRHWGASWKFIRIC-SFHVURJKSA-N 1 2 303.352 4.085 20 0 DIADLO CC(C)c1ccc(C[N@H+](Cc2cn(C3CCC3)nn2)C2CC2)cc1 ZINC000667487896 1047890568 /nfs/dbraw/zinc/89/05/68/1047890568.db2.gz LHLJFENTKLFWGF-UHFFFAOYSA-N 1 2 324.472 4.291 20 0 DIADLO CC(C)c1ccc(C[N@@H+](Cc2cn(C3CCC3)nn2)C2CC2)cc1 ZINC000667487896 1047890588 /nfs/dbraw/zinc/89/05/88/1047890588.db2.gz LHLJFENTKLFWGF-UHFFFAOYSA-N 1 2 324.472 4.291 20 0 DIADLO CCOC[C@H]1CCC[C@@H]1Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000479428199 1047891773 /nfs/dbraw/zinc/89/17/73/1047891773.db2.gz UHNKVDISCQVZMT-CJNGLKHVSA-N 1 2 319.836 4.143 20 0 DIADLO Cc1nc2c(s1)C[N@H+](Cc1cccc(C(F)(F)F)c1)CC2 ZINC001203886227 1047893421 /nfs/dbraw/zinc/89/34/21/1047893421.db2.gz UPIDBRHRWCZNNX-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1nc2c(s1)C[N@@H+](Cc1cccc(C(F)(F)F)c1)CC2 ZINC001203886227 1047893438 /nfs/dbraw/zinc/89/34/38/1047893438.db2.gz UPIDBRHRWCZNNX-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc3ccccc3c2)cc(C)[nH+]1 ZINC001197894434 1047895017 /nfs/dbraw/zinc/89/50/17/1047895017.db2.gz NUTYTVLOZNPGNB-UHFFFAOYSA-N 1 2 305.381 4.173 20 0 DIADLO Cc1[nH+]cc(CN(Cc2ccccc2)[C@H](C)c2ccccc2)n1C ZINC000667495349 1047896021 /nfs/dbraw/zinc/89/60/21/1047896021.db2.gz FOVDIMGQZTXSJW-QGZVFWFLSA-N 1 2 319.452 4.492 20 0 DIADLO Cc1c(Cl)cccc1C[N@@H+]1CCC[C@]1(C)C(=O)OC(C)(C)C ZINC001183179854 1047898514 /nfs/dbraw/zinc/89/85/14/1047898514.db2.gz JQEHYGMREIAVQJ-GOSISDBHSA-N 1 2 323.864 4.345 20 0 DIADLO Cc1c(Cl)cccc1C[N@H+]1CCC[C@]1(C)C(=O)OC(C)(C)C ZINC001183179854 1047898527 /nfs/dbraw/zinc/89/85/27/1047898527.db2.gz JQEHYGMREIAVQJ-GOSISDBHSA-N 1 2 323.864 4.345 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@H](C)c2ccc(F)cn2)c2ccccn2)cc1 ZINC000479463780 1047900295 /nfs/dbraw/zinc/90/02/95/1047900295.db2.gz GJCMOHJLLOGFHQ-FOIQADDNSA-N 1 2 321.399 4.364 20 0 DIADLO CC(C)C(=O)Nc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001197962617 1047908495 /nfs/dbraw/zinc/90/84/95/1047908495.db2.gz UPWNQTKIMAFEOO-UHFFFAOYSA-N 1 2 320.396 4.210 20 0 DIADLO C[C@H]1COCC[C@H]1Nc1cc(SCc2ccccc2)cc[nH+]1 ZINC001159719051 1047908763 /nfs/dbraw/zinc/90/87/63/1047908763.db2.gz OOKBXBHSJOIFDV-WMLDXEAASA-N 1 2 314.454 4.211 20 0 DIADLO Cc1cccc(Oc2ccc(NC(=O)CCc3[nH]cc[nH+]3)cc2)c1 ZINC000479470866 1047909254 /nfs/dbraw/zinc/90/92/54/1047909254.db2.gz CJUGEOBGTJHAJS-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1cnn2c1CCC2 ZINC000667499798 1047911763 /nfs/dbraw/zinc/91/17/63/1047911763.db2.gz VOLWRLPKJQZFDG-LLVKDONJSA-N 1 2 324.255 4.329 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1cnn2c1CCC2 ZINC000667499798 1047911772 /nfs/dbraw/zinc/91/17/72/1047911772.db2.gz VOLWRLPKJQZFDG-LLVKDONJSA-N 1 2 324.255 4.329 20 0 DIADLO CCCc1cc(N[C@@H](c2ccccc2)C(F)(F)F)nc(C)[nH+]1 ZINC001159763515 1047917825 /nfs/dbraw/zinc/91/78/25/1047917825.db2.gz GDXDTHHSWNDWLW-HNNXBMFYSA-N 1 2 309.335 4.453 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1cnn([C@H]2CCCCO2)c1 ZINC001174597093 1047920475 /nfs/dbraw/zinc/92/04/75/1047920475.db2.gz GXOLEWCAQPIOBW-GOSISDBHSA-N 1 2 314.433 4.228 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1cnn([C@H]2CCCCO2)c1 ZINC001174601472 1047921483 /nfs/dbraw/zinc/92/14/83/1047921483.db2.gz BDPZNEFPBDYMII-OAHLLOKOSA-N 1 2 300.406 4.153 20 0 DIADLO COc1cc(OC)cc([C@H](C)Nc2cc3ccccc3c[nH+]2)c1 ZINC001159809942 1047927902 /nfs/dbraw/zinc/92/79/02/1047927902.db2.gz NWFQDIDJINGZJY-ZDUSSCGKSA-N 1 2 308.381 4.425 20 0 DIADLO Cc1ccc2c(Nc3ccc4nc(N)sc4c3)cccc2[nH+]1 ZINC001159820341 1047929985 /nfs/dbraw/zinc/92/99/85/1047929985.db2.gz FUYYAVCFWGGYJW-UHFFFAOYSA-N 1 2 306.394 4.479 20 0 DIADLO Nc1nc2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2s1 ZINC001159823476 1047931681 /nfs/dbraw/zinc/93/16/81/1047931681.db2.gz YRRFMHIQLVATOJ-UHFFFAOYSA-N 1 2 307.382 4.012 20 0 DIADLO Cn1c2ccccc2nc1[C@H]1CCCC[N@@H+]1Cc1cccc(F)c1 ZINC000553761734 1047934732 /nfs/dbraw/zinc/93/47/32/1047934732.db2.gz WQCHLNITVXTLNZ-LJQANCHMSA-N 1 2 323.415 4.440 20 0 DIADLO Cn1c2ccccc2nc1[C@H]1CCCC[N@H+]1Cc1cccc(F)c1 ZINC000553761734 1047934739 /nfs/dbraw/zinc/93/47/39/1047934739.db2.gz WQCHLNITVXTLNZ-LJQANCHMSA-N 1 2 323.415 4.440 20 0 DIADLO CCO[C@H](C)n1cc(Nc2ccc([NH+]3CCCCC3)cc2)cn1 ZINC001174700669 1047943884 /nfs/dbraw/zinc/94/38/84/1047943884.db2.gz WHQSPJJUZUZZFR-OAHLLOKOSA-N 1 2 314.433 4.172 20 0 DIADLO Cc1cn2c(cccc2NC(=S)Nc2c(C)cccc2C)[nH+]1 ZINC001198321852 1047945582 /nfs/dbraw/zinc/94/55/82/1047945582.db2.gz GRCDJURIZIBQPB-UHFFFAOYSA-N 1 2 310.426 4.068 20 0 DIADLO Cn1ncc(C2CC2)c1C[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000667532311 1047945819 /nfs/dbraw/zinc/94/58/19/1047945819.db2.gz ICMBTEYWOQERNX-UHFFFAOYSA-N 1 2 324.255 4.236 20 0 DIADLO Cn1ncc(C2CC2)c1C[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000667532311 1047945825 /nfs/dbraw/zinc/94/58/25/1047945825.db2.gz ICMBTEYWOQERNX-UHFFFAOYSA-N 1 2 324.255 4.236 20 0 DIADLO Cc1cn2cc(NC(=S)Nc3c(C)cccc3C)ccc2[nH+]1 ZINC001198332505 1047947284 /nfs/dbraw/zinc/94/72/84/1047947284.db2.gz LJRIZTZWQXYTMD-UHFFFAOYSA-N 1 2 310.426 4.068 20 0 DIADLO Fc1cc2c(cc1Br)CC[N@@H+]([C@H]1C=CCCC1)C2 ZINC001198311372 1047948106 /nfs/dbraw/zinc/94/81/06/1047948106.db2.gz YDTFQWCNAXBMDN-ZDUSSCGKSA-N 1 2 310.210 4.055 20 0 DIADLO Fc1cc2c(cc1Br)CC[N@H+]([C@H]1C=CCCC1)C2 ZINC001198311372 1047948111 /nfs/dbraw/zinc/94/81/11/1047948111.db2.gz YDTFQWCNAXBMDN-ZDUSSCGKSA-N 1 2 310.210 4.055 20 0 DIADLO CCO[C@H](C)n1cc(Nc2cc[nH+]c3cc(Cl)ccc23)cn1 ZINC001174697531 1047962459 /nfs/dbraw/zinc/96/24/59/1047962459.db2.gz YUVRMYWVQJGXBK-LLVKDONJSA-N 1 2 316.792 4.383 20 0 DIADLO O=C(Nc1cc2ccccc2s1)[C@H]1CC[N@@H+]1Cc1ccccc1 ZINC001183748832 1047962438 /nfs/dbraw/zinc/96/24/38/1047962438.db2.gz SCGLICDKQFPHEU-MRXNPFEDSA-N 1 2 322.433 4.114 20 0 DIADLO O=C(Nc1cc2ccccc2s1)[C@H]1CC[N@H+]1Cc1ccccc1 ZINC001183748832 1047962446 /nfs/dbraw/zinc/96/24/46/1047962446.db2.gz SCGLICDKQFPHEU-MRXNPFEDSA-N 1 2 322.433 4.114 20 0 DIADLO CC(C)(C)c1cccc(NC(=O)[C@H]2CC[N@@H+]2Cc2ccccc2)c1 ZINC001183749587 1047963559 /nfs/dbraw/zinc/96/35/59/1047963559.db2.gz BSVAZDQLSSIGPI-LJQANCHMSA-N 1 2 322.452 4.197 20 0 DIADLO CC(C)(C)c1cccc(NC(=O)[C@H]2CC[N@H+]2Cc2ccccc2)c1 ZINC001183749587 1047963566 /nfs/dbraw/zinc/96/35/66/1047963566.db2.gz BSVAZDQLSSIGPI-LJQANCHMSA-N 1 2 322.452 4.197 20 0 DIADLO COc1ccc(C(F)(F)F)cc1Nc1[nH+]c2ccccc2n1C ZINC001174775040 1047968422 /nfs/dbraw/zinc/96/84/22/1047968422.db2.gz RHHKWLRGLUFVDK-UHFFFAOYSA-N 1 2 321.302 4.344 20 0 DIADLO COc1ccc(C(F)(F)F)cc1Nc1cccn2cc(C)[nH+]c12 ZINC001174775055 1047969327 /nfs/dbraw/zinc/96/93/27/1047969327.db2.gz GMMIMTZPXMVPQJ-UHFFFAOYSA-N 1 2 321.302 4.414 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H]3COCc4ccccc43)c(C)cc2c1 ZINC001160115225 1047981371 /nfs/dbraw/zinc/98/13/71/1047981371.db2.gz BDPFCEUAEVMXBQ-LJQANCHMSA-N 1 2 320.392 4.235 20 0 DIADLO Cc1cc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)n(C)n1 ZINC001174822526 1047983764 /nfs/dbraw/zinc/98/37/64/1047983764.db2.gz WBGUNZKGTLHBLY-UHFFFAOYSA-N 1 2 306.291 4.039 20 0 DIADLO Cc1c[nH+]c(NC=C2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1 ZINC001174845444 1047996290 /nfs/dbraw/zinc/99/62/90/1047996290.db2.gz LDBGTPRBZNVLEC-UHFFFAOYSA-N 1 2 317.433 4.025 20 0 DIADLO CCOc1cc[nH+]cc1Nc1ccc(Oc2cccnc2)cc1 ZINC001174848118 1047997453 /nfs/dbraw/zinc/99/74/53/1047997453.db2.gz ZUBMYLIBKYONMJ-UHFFFAOYSA-N 1 2 307.353 4.411 20 0 DIADLO CC(C)(C)[C@H]1CC[N@H+](Cc2csc(C3CCCC3)n2)CCO1 ZINC001198790954 1048003140 /nfs/dbraw/zinc/00/31/40/1048003140.db2.gz QOYOFNHMOHGQCL-MRXNPFEDSA-N 1 2 322.518 4.438 20 0 DIADLO CC(C)(C)[C@H]1CC[N@@H+](Cc2csc(C3CCCC3)n2)CCO1 ZINC001198790954 1048003153 /nfs/dbraw/zinc/00/31/53/1048003153.db2.gz QOYOFNHMOHGQCL-MRXNPFEDSA-N 1 2 322.518 4.438 20 0 DIADLO Cc1cccc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)c1F ZINC001198917443 1048016794 /nfs/dbraw/zinc/01/67/94/1048016794.db2.gz ARRFTRSWSYIXSO-FQEVSTJZSA-N 1 2 306.384 4.408 20 0 DIADLO COc1ccc(Nc2c(C)cc[nH+]c2C(C)C)c(OC)c1OC ZINC001174900325 1048017195 /nfs/dbraw/zinc/01/71/95/1048017195.db2.gz WEDLQKSOHZMWQN-UHFFFAOYSA-N 1 2 316.401 4.283 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(COC(C)(C)C)cc1 ZINC001174911421 1048023418 /nfs/dbraw/zinc/02/34/18/1048023418.db2.gz XQMRKWIOMOCSTQ-UHFFFAOYSA-N 1 2 309.413 4.231 20 0 DIADLO CC(C)OC(=O)c1cccc(Nc2ccccc2-n2cc[nH+]c2)c1 ZINC001174916299 1048027027 /nfs/dbraw/zinc/02/70/27/1048027027.db2.gz UKPZUMNRTQCCBW-UHFFFAOYSA-N 1 2 321.380 4.181 20 0 DIADLO Cc1c(C)c(C)c(CC(=O)Nc2cccc3[nH+]ccn32)c(C)c1C ZINC001184421142 1048038512 /nfs/dbraw/zinc/03/85/12/1048038512.db2.gz HGWGEXPMWFJYBL-UHFFFAOYSA-N 1 2 321.424 4.058 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2csc(C(C)(C)C)n2)C1 ZINC000554265630 1048051110 /nfs/dbraw/zinc/05/11/10/1048051110.db2.gz UHGXPJSZSUFERI-BBRMVZONSA-N 1 2 315.486 4.419 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2csc(C(C)(C)C)n2)C1 ZINC000554265630 1048051118 /nfs/dbraw/zinc/05/11/18/1048051118.db2.gz UHGXPJSZSUFERI-BBRMVZONSA-N 1 2 315.486 4.419 20 0 DIADLO Fc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(F)c1F ZINC001174968579 1048055845 /nfs/dbraw/zinc/05/58/45/1048055845.db2.gz MLSOMDJAXODKFH-UHFFFAOYSA-N 1 2 303.287 4.092 20 0 DIADLO C[C@H]1C[C@@H](C(C)(C)C)CC[N@@H+]1Cc1nccn1CC(F)(F)F ZINC000554308853 1048062661 /nfs/dbraw/zinc/06/26/61/1048062661.db2.gz HBCXGUZEDYAKBV-STQMWFEESA-N 1 2 317.399 4.092 20 0 DIADLO C[C@H]1C[C@@H](C(C)(C)C)CC[N@H+]1Cc1nccn1CC(F)(F)F ZINC000554308853 1048062677 /nfs/dbraw/zinc/06/26/77/1048062677.db2.gz HBCXGUZEDYAKBV-STQMWFEESA-N 1 2 317.399 4.092 20 0 DIADLO COc1c(C)cc(Nc2cccc(Cn3cc[nH+]c3)c2)cc1C ZINC001174998958 1048063974 /nfs/dbraw/zinc/06/39/74/1048063974.db2.gz GAKBNSVRMSMBSN-UHFFFAOYSA-N 1 2 307.397 4.300 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccccc2OC2CCCC2)s1 ZINC001199413885 1048065197 /nfs/dbraw/zinc/06/51/97/1048065197.db2.gz RIXOJGSBTFAWKG-UHFFFAOYSA-N 1 2 316.470 4.317 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1nc2ccccc2[nH]1 ZINC000554311418 1048065433 /nfs/dbraw/zinc/06/54/33/1048065433.db2.gz YWJFSIDQXRMJOH-KRWDZBQOSA-N 1 2 309.413 4.155 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1nc2ccccc2[nH]1 ZINC000554311418 1048065449 /nfs/dbraw/zinc/06/54/49/1048065449.db2.gz YWJFSIDQXRMJOH-KRWDZBQOSA-N 1 2 309.413 4.155 20 0 DIADLO CCc1ccc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)o1 ZINC001204389417 1048065569 /nfs/dbraw/zinc/06/55/69/1048065569.db2.gz OIOVFFHKFWYSPX-FQEVSTJZSA-N 1 2 306.409 4.249 20 0 DIADLO CCc1ccc(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)o1 ZINC001204389417 1048065585 /nfs/dbraw/zinc/06/55/85/1048065585.db2.gz OIOVFFHKFWYSPX-FQEVSTJZSA-N 1 2 306.409 4.249 20 0 DIADLO Fc1cccc(F)c1-c1ncc(CNc2cccc[nH+]2)s1 ZINC001199491211 1048068630 /nfs/dbraw/zinc/06/86/30/1048068630.db2.gz SBABMYLYHXWWOO-UHFFFAOYSA-N 1 2 303.337 4.095 20 0 DIADLO COc1ccc2ccc(NC3CC4(C3)CC(F)(F)C4)[nH+]c2c1 ZINC001160591799 1048069778 /nfs/dbraw/zinc/06/97/78/1048069778.db2.gz XQTJWVMKRPMXFS-UHFFFAOYSA-N 1 2 304.340 4.233 20 0 DIADLO Cc1ccc(N(CCCn2cc[nH+]c2)Cc2ccco2)cc1C ZINC000775981874 1048070473 /nfs/dbraw/zinc/07/04/73/1048070473.db2.gz NZFOPQJEXHMSNC-UHFFFAOYSA-N 1 2 309.413 4.190 20 0 DIADLO COC1CCC(CCNc2cc(C)[nH+]c(C(C)(C)C)n2)CC1 ZINC001160643656 1048073088 /nfs/dbraw/zinc/07/30/88/1048073088.db2.gz OIJUTPSZPBDAHV-UHFFFAOYSA-N 1 2 305.466 4.090 20 0 DIADLO c1cc2c(cc1CNc1ccc(N3CCCCC3)c[nH+]1)CCCO2 ZINC001199554011 1048073895 /nfs/dbraw/zinc/07/38/95/1048073895.db2.gz CRUPJAREROZJJN-UHFFFAOYSA-N 1 2 323.440 4.009 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cc(F)cc(C(F)(F)F)c3)ccc21 ZINC001175064515 1048091292 /nfs/dbraw/zinc/09/12/92/1048091292.db2.gz ZBFQUMRXICLAIX-UHFFFAOYSA-N 1 2 309.266 4.475 20 0 DIADLO Clc1ccc(Nc2cccc3[nH+]c[nH]c32)c(Br)n1 ZINC001213027367 1048095121 /nfs/dbraw/zinc/09/51/21/1048095121.db2.gz WTXUKNWTGYDGSE-UHFFFAOYSA-N 1 2 323.581 4.117 20 0 DIADLO CCOc1ccc(F)c(Nc2ccccc2-n2cc[nH+]c2)c1F ZINC001175037173 1048101124 /nfs/dbraw/zinc/10/11/24/1048101124.db2.gz CZJKTESOIXWPKX-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO CCc1cc(N(C)[C@@H](C)c2cc(F)ccc2F)nc(CC)[nH+]1 ZINC001184916231 1048103564 /nfs/dbraw/zinc/10/35/64/1048103564.db2.gz LBUKZONIIJGBQA-NSHDSACASA-N 1 2 305.372 4.077 20 0 DIADLO CC(=O)c1ccc(Cl)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001184964210 1048106131 /nfs/dbraw/zinc/10/61/31/1048106131.db2.gz JCRQAMCVEBQNKI-UHFFFAOYSA-N 1 2 315.804 4.281 20 0 DIADLO Fc1ccc(Nc2ccc[nH+]c2N2CCCC2)c2ccncc12 ZINC001184965038 1048106272 /nfs/dbraw/zinc/10/62/72/1048106272.db2.gz QUJMUAFEGXAHKY-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO Oc1ccc(Cl)c(Nc2ccc[nH+]c2N2CCCC2)c1Cl ZINC001184968464 1048107356 /nfs/dbraw/zinc/10/73/56/1048107356.db2.gz MOKMLXZMBWSGCQ-UHFFFAOYSA-N 1 2 324.211 4.438 20 0 DIADLO Oc1cc2ccccc2cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001184967377 1048107408 /nfs/dbraw/zinc/10/74/08/1048107408.db2.gz BADURTLRSVXDGT-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO Oc1ccc(Nc2cc[nH+]c3cc(Br)ccc23)cc1 ZINC001175043287 1048107544 /nfs/dbraw/zinc/10/75/44/1048107544.db2.gz ISLMFLQSGXRVSJ-UHFFFAOYSA-N 1 2 315.170 4.447 20 0 DIADLO Nc1cccc(C(F)(F)F)c1Nc1ccc[nH+]c1N1CCCC1 ZINC001184965558 1048107747 /nfs/dbraw/zinc/10/77/47/1048107747.db2.gz XROZIWZMXWDPHB-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO Oc1c(Cl)cc(Cl)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001184969012 1048108161 /nfs/dbraw/zinc/10/81/61/1048108161.db2.gz VCMAPHCPJMPYED-UHFFFAOYSA-N 1 2 324.211 4.438 20 0 DIADLO Fc1cc(Nc2cccc3[nH+]c[nH]c32)ccc1Br ZINC001213030651 1048112138 /nfs/dbraw/zinc/11/21/38/1048112138.db2.gz KZHMMWIPKFGXIX-UHFFFAOYSA-N 1 2 306.138 4.208 20 0 DIADLO CCN(CC)c1ccc(N[C@@H](C)c2ccc(Cl)cn2)c[nH+]1 ZINC000480285304 1048112988 /nfs/dbraw/zinc/11/29/88/1048112988.db2.gz POUGMGHWATURRR-LBPRGKRZSA-N 1 2 304.825 4.149 20 0 DIADLO Fc1ccc(Nc2cccc3[nH+]c[nH]c32)cc1Br ZINC001213030634 1048113334 /nfs/dbraw/zinc/11/33/34/1048113334.db2.gz KARMYPYSCIRSJG-UHFFFAOYSA-N 1 2 306.138 4.208 20 0 DIADLO Fc1ccc(Br)c(Nc2cccc3[nH+]c[nH]c32)c1 ZINC001213030768 1048113918 /nfs/dbraw/zinc/11/39/18/1048113918.db2.gz QEGUVEDPLRGNPR-UHFFFAOYSA-N 1 2 306.138 4.208 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2ccc(Cl)cn2)[C@H]1c1ccccc1 ZINC000554496251 1048114754 /nfs/dbraw/zinc/11/47/54/1048114754.db2.gz HSUUFFXUIQXSEG-CXAGYDPISA-N 1 2 318.873 4.414 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2ccc(Cl)cn2)[C@H]1c1ccccc1 ZINC000554496251 1048114760 /nfs/dbraw/zinc/11/47/60/1048114760.db2.gz HSUUFFXUIQXSEG-CXAGYDPISA-N 1 2 318.873 4.414 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1cccc2ccccc21 ZINC000774805543 1048115238 /nfs/dbraw/zinc/11/52/38/1048115238.db2.gz FSSMWMYSGDGBOV-CYBMUJFWSA-N 1 2 309.413 4.371 20 0 DIADLO Fc1cc(Nc2cccc3[nH+]c[nH]c32)c(F)cc1Br ZINC001213030881 1048115558 /nfs/dbraw/zinc/11/55/58/1048115558.db2.gz VQKZILGPNPAFTC-UHFFFAOYSA-N 1 2 324.128 4.347 20 0 DIADLO Clc1ccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)nc1 ZINC000554497817 1048116857 /nfs/dbraw/zinc/11/68/57/1048116857.db2.gz DLFJQQHQBZCWHT-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccc(C[N@H+]2CCSC[C@H]2c2ccccc2)nc1 ZINC000554497817 1048116863 /nfs/dbraw/zinc/11/68/63/1048116863.db2.gz DLFJQQHQBZCWHT-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1coc(C(F)F)c1 ZINC001161260765 1048117083 /nfs/dbraw/zinc/11/70/83/1048117083.db2.gz HKPUZBAHVZZILY-UHFFFAOYSA-N 1 2 317.295 4.168 20 0 DIADLO Clc1ccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)nc1 ZINC000554497818 1048117056 /nfs/dbraw/zinc/11/70/56/1048117056.db2.gz DLFJQQHQBZCWHT-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccc(C[N@H+]2CCSC[C@@H]2c2ccccc2)nc1 ZINC000554497818 1048117058 /nfs/dbraw/zinc/11/70/58/1048117058.db2.gz DLFJQQHQBZCWHT-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO COc1cc(Nc2cccc3[nH+]c[nH]c32)ccc1Br ZINC001213031713 1048118764 /nfs/dbraw/zinc/11/87/64/1048118764.db2.gz NXLPCTRHGCQMCX-UHFFFAOYSA-N 1 2 318.174 4.078 20 0 DIADLO CCOC(=O)c1cc2cc(Nc3cccc4[nH+]c[nH]c43)ccc2o1 ZINC001213031721 1048118960 /nfs/dbraw/zinc/11/89/60/1048118960.db2.gz OFEIOSFAWBWDFH-UHFFFAOYSA-N 1 2 321.336 4.229 20 0 DIADLO CC(=O)c1cccc(Cl)c1Nc1ccc[nH+]c1N1CCCC1 ZINC001185042705 1048122671 /nfs/dbraw/zinc/12/26/71/1048122671.db2.gz GQBPPCVZTLYCBN-UHFFFAOYSA-N 1 2 315.804 4.281 20 0 DIADLO Cc1cccc2c(C)cc(NCC(=O)Nc3ccc(F)cc3)[nH+]c12 ZINC001161342894 1048123884 /nfs/dbraw/zinc/12/38/84/1048123884.db2.gz MKCQPNFQESRMAC-UHFFFAOYSA-N 1 2 323.371 4.041 20 0 DIADLO O=C(c1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1)C1CC1 ZINC001185044578 1048124253 /nfs/dbraw/zinc/12/42/53/1048124253.db2.gz ULDZRGQMBPCENO-UHFFFAOYSA-N 1 2 307.397 4.018 20 0 DIADLO COc1ccc(-n2cccc2)c(Nc2cccc3[nH+]c[nH]c32)c1 ZINC001213032227 1048125399 /nfs/dbraw/zinc/12/53/99/1048125399.db2.gz YVVUXXKGCXUQEN-UHFFFAOYSA-N 1 2 304.353 4.106 20 0 DIADLO Fc1ccc(Nc2cccc3[nH+]c[nH]c32)cc1OC(F)(F)F ZINC001213032481 1048127229 /nfs/dbraw/zinc/12/72/29/1048127229.db2.gz IIQKLHHUNDHNPU-UHFFFAOYSA-N 1 2 311.238 4.344 20 0 DIADLO O=C(c1cccc(C2CCCC2)c1)N1CCC(n2cc[nH+]c2)CC1 ZINC000667666108 1048130247 /nfs/dbraw/zinc/13/02/47/1048130247.db2.gz CORPRCVYHOBYSB-UHFFFAOYSA-N 1 2 323.440 4.018 20 0 DIADLO Fc1cc(F)c(Nc2ccc[nH+]c2N2CCCCC2)cc1F ZINC001175086054 1048136206 /nfs/dbraw/zinc/13/62/06/1048136206.db2.gz PDNLGMUWVHRRSE-UHFFFAOYSA-N 1 2 307.319 4.233 20 0 DIADLO Cc1cccc2ccc(NCc3c[nH+]cn3CC3CCC3)nc12 ZINC001161528924 1048136701 /nfs/dbraw/zinc/13/67/01/1048136701.db2.gz AWDKKCXRTVWUDA-UHFFFAOYSA-N 1 2 306.413 4.152 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1nc2ccccc2cc1Cl ZINC001161563140 1048138958 /nfs/dbraw/zinc/13/89/58/1048138958.db2.gz PEOXYBIYQWNPLW-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO CCOc1ccccc1C[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000105498822 1048139760 /nfs/dbraw/zinc/13/97/60/1048139760.db2.gz NNSXGFMVMKYUCD-UHFFFAOYSA-N 1 2 304.459 4.129 20 0 DIADLO CCOc1ccc(Nc2cccn3cc(C)[nH+]c23)c(F)c1F ZINC001175150199 1048143142 /nfs/dbraw/zinc/14/31/42/1048143142.db2.gz IYHDMKKKLGIKLV-UHFFFAOYSA-N 1 2 303.312 4.063 20 0 DIADLO C[C@@H](CCc1ccccc1)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001161612900 1048143978 /nfs/dbraw/zinc/14/39/78/1048143978.db2.gz NCEXUYRMBYIMRO-KRWDZBQOSA-N 1 2 305.425 4.365 20 0 DIADLO CC[C@H](Cc1ccccc1)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001185220944 1048148828 /nfs/dbraw/zinc/14/88/28/1048148828.db2.gz GLYFYPIAEOOAEX-OAHLLOKOSA-N 1 2 323.444 4.015 20 0 DIADLO CCCC[C@@H]1CCC[C@@H]1Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001185241240 1048150174 /nfs/dbraw/zinc/15/01/74/1048150174.db2.gz HHGJIDXHKOVRCT-HIFRSBDPSA-N 1 2 315.465 4.352 20 0 DIADLO COc1ccc(F)c(Nc2cc(Cl)c3[nH+]ccn3c2)c1F ZINC001175121061 1048151498 /nfs/dbraw/zinc/15/14/98/1048151498.db2.gz NRWDUKVTVZTLGG-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO Cc1cc(Cl)c(C)c(NCC2(CC3CC3)CCOCC2)[nH+]1 ZINC001161651703 1048151757 /nfs/dbraw/zinc/15/17/57/1048151757.db2.gz FVOLYMSBQSDGNR-UHFFFAOYSA-N 1 2 308.853 4.361 20 0 DIADLO CCOc1ccc(C)cc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001175123784 1048153156 /nfs/dbraw/zinc/15/31/56/1048153156.db2.gz VQZVBIMSHQXWLZ-UHFFFAOYSA-N 1 2 307.397 4.382 20 0 DIADLO COC(=O)c1cc2cccc(Nc3cccc4[nH+]c[nH]c43)c2s1 ZINC001213034571 1048153910 /nfs/dbraw/zinc/15/39/10/1048153910.db2.gz RFBLLKOXLABSCH-UHFFFAOYSA-N 1 2 323.377 4.308 20 0 DIADLO C[C@H]1C[C@@H](Nc2cc(SCc3ccccc3)cc[nH+]2)CCO1 ZINC001161695691 1048155219 /nfs/dbraw/zinc/15/52/19/1048155219.db2.gz GBRHUYAOAHDVLS-HOCLYGCPSA-N 1 2 314.454 4.353 20 0 DIADLO CCCn1nccc1C[N@@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000667684407 1048157406 /nfs/dbraw/zinc/15/74/06/1048157406.db2.gz VTLAYJMRZPSPIL-QGZVFWFLSA-N 1 2 324.428 4.162 20 0 DIADLO CCCn1nccc1C[N@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000667684407 1048157411 /nfs/dbraw/zinc/15/74/11/1048157411.db2.gz VTLAYJMRZPSPIL-QGZVFWFLSA-N 1 2 324.428 4.162 20 0 DIADLO CCCC[N@H+](C)c1ccc(Nc2cc(C(F)F)ncn2)cc1 ZINC001185298598 1048159933 /nfs/dbraw/zinc/15/99/33/1048159933.db2.gz IYNRSYYWAMISLF-UHFFFAOYSA-N 1 2 306.360 4.394 20 0 DIADLO CCCC[N@@H+](C)c1ccc(Nc2cc(C(F)F)ncn2)cc1 ZINC001185298598 1048159940 /nfs/dbraw/zinc/15/99/40/1048159940.db2.gz IYNRSYYWAMISLF-UHFFFAOYSA-N 1 2 306.360 4.394 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](CC2CC2)c2ccccc2F)c1 ZINC001161772142 1048167512 /nfs/dbraw/zinc/16/75/12/1048167512.db2.gz GRCJOKHBNUCQOL-KRWDZBQOSA-N 1 2 300.377 4.320 20 0 DIADLO Cc1nc(N[C@@H](CC2CC2)c2ccccc2F)c2c([nH+]1)CCC2 ZINC001161776573 1048169231 /nfs/dbraw/zinc/16/92/31/1048169231.db2.gz ILBOVDSUNGCFJY-SFHVURJKSA-N 1 2 311.404 4.366 20 0 DIADLO COc1c[nH+]c(N[C@@H](CC2CC2)c2ccccc2F)c(C)c1 ZINC001161773418 1048169292 /nfs/dbraw/zinc/16/92/92/1048169292.db2.gz WZOTWKPNGQOADA-KRWDZBQOSA-N 1 2 300.377 4.491 20 0 DIADLO Cc1cc(NC[C@@H]2CCCO[C@H]2C(C)(C)C)nc(C2CCC2)[nH+]1 ZINC001185386949 1048170567 /nfs/dbraw/zinc/17/05/67/1048170567.db2.gz LOMOXYZQJMFVRD-DOTOQJQBSA-N 1 2 317.477 4.306 20 0 DIADLO COc1ncccc1[C@@H](Nc1cc2ccccc2c[nH+]1)C1CC1 ZINC001161787168 1048171360 /nfs/dbraw/zinc/17/13/60/1048171360.db2.gz YOCOYOWJEYZMTO-SFHVURJKSA-N 1 2 305.381 4.202 20 0 DIADLO Nc1[nH+]c(N[C@H](CC2CC2)c2ccccc2F)ccc1Cl ZINC001161778195 1048171616 /nfs/dbraw/zinc/17/16/16/1048171616.db2.gz XLCUJXSSJFBJMK-CQSZACIVSA-N 1 2 305.784 4.410 20 0 DIADLO CCc1ccc([C@@H](COC)Nc2cc(C)[nH+]c(C3CCC3)n2)o1 ZINC001185420916 1048176245 /nfs/dbraw/zinc/17/62/45/1048176245.db2.gz NMTJEBMWHVZGHZ-OAHLLOKOSA-N 1 2 315.417 4.008 20 0 DIADLO CCc1cc(NCCc2c[nH]c3c2cccc3C)nc(CC)[nH+]1 ZINC001185439315 1048178930 /nfs/dbraw/zinc/17/89/30/1048178930.db2.gz PPAPBZCTFRZIGV-UHFFFAOYSA-N 1 2 308.429 4.046 20 0 DIADLO CC[N@H+](CC1CCN(C(=O)C(C)(C)C)CC1)c1cccc(C)c1 ZINC000480595305 1048190075 /nfs/dbraw/zinc/19/00/75/1048190075.db2.gz ZVIGAGKULVAJLB-UHFFFAOYSA-N 1 2 316.489 4.106 20 0 DIADLO CC[N@@H+](CC1CCN(C(=O)C(C)(C)C)CC1)c1cccc(C)c1 ZINC000480595305 1048190078 /nfs/dbraw/zinc/19/00/78/1048190078.db2.gz ZVIGAGKULVAJLB-UHFFFAOYSA-N 1 2 316.489 4.106 20 0 DIADLO Nc1cc(Cl)[nH+]c(NC2(CC3CC3)CCC(F)(F)CC2)c1 ZINC001161898185 1048191474 /nfs/dbraw/zinc/19/14/74/1048191474.db2.gz ROASSIXIJDAMAV-UHFFFAOYSA-N 1 2 315.795 4.477 20 0 DIADLO Cc1cc(NC2(CC3CCC3)CCOCC2)nc(C(C)C)[nH+]1 ZINC001161922689 1048193520 /nfs/dbraw/zinc/19/35/20/1048193520.db2.gz HFAWCMPMFMBAIA-UHFFFAOYSA-N 1 2 303.450 4.060 20 0 DIADLO Cc1cc(NC2(CC3CCC3)CCOCC2)nc(C(C)(C)C)[nH+]1 ZINC001161923113 1048195017 /nfs/dbraw/zinc/19/50/17/1048195017.db2.gz QVDGTPYDIUOOPQ-UHFFFAOYSA-N 1 2 317.477 4.234 20 0 DIADLO Cc1ccccc1-c1nsc(Nc2ccc3c(c2)[nH+]cn3C)n1 ZINC001185534902 1048198379 /nfs/dbraw/zinc/19/83/79/1048198379.db2.gz JMRZZABNSNFAQL-UHFFFAOYSA-N 1 2 321.409 4.144 20 0 DIADLO c1ccc([C@H](Nc2cc[nH+]c(OC3CCOCC3)c2)C2CC2)cc1 ZINC001161962255 1048200658 /nfs/dbraw/zinc/20/06/58/1048200658.db2.gz WATZINVLQXNTQF-FQEVSTJZSA-N 1 2 324.424 4.203 20 0 DIADLO CCO[C@H](CCNc1cc(C)[nH+]c(C2CCC2)n1)C1CCCC1 ZINC001185649107 1048207382 /nfs/dbraw/zinc/20/73/82/1048207382.db2.gz FVYLBFZDIYCBSI-QGZVFWFLSA-N 1 2 317.477 4.450 20 0 DIADLO Cc1cc(C)cc(NC(=S)Nc2ccccc2-n2cc[nH+]c2)c1 ZINC001201194652 1048214696 /nfs/dbraw/zinc/21/46/96/1048214696.db2.gz ICUWKUZKABPRKM-UHFFFAOYSA-N 1 2 322.437 4.298 20 0 DIADLO O=C(Nc1ccc2c(c1)CCC2)Nc1ccccc1-n1cc[nH+]c1 ZINC001185720173 1048217819 /nfs/dbraw/zinc/21/78/19/1048217819.db2.gz BMAACULUIHTCPV-UHFFFAOYSA-N 1 2 318.380 4.005 20 0 DIADLO Cc1cc(-c2ccc(Nc3ccc(N)[nH+]c3)c(C)c2)ccc1N ZINC001201285749 1048226822 /nfs/dbraw/zinc/22/68/22/1048226822.db2.gz OHHQUOJTAFSLCM-UHFFFAOYSA-N 1 2 304.397 4.273 20 0 DIADLO COc1cc2c(cc1Nc1ccc(N)[nH+]c1)oc1ccccc12 ZINC001201292067 1048227785 /nfs/dbraw/zinc/22/77/85/1048227785.db2.gz IPXJSVZNNGNKCD-UHFFFAOYSA-N 1 2 305.337 4.315 20 0 DIADLO COc1cc[nH+]c(C(C)(C)CNc2ccc3cc(C)ccc3n2)c1 ZINC001162128940 1048228008 /nfs/dbraw/zinc/22/80/08/1048228008.db2.gz XOUHWORFXZPBEH-UHFFFAOYSA-N 1 2 321.424 4.337 20 0 DIADLO COc1cc[nH+]c(C(C)(C)CNc2cc(Cl)nc(C)c2C)c1 ZINC001162130138 1048228222 /nfs/dbraw/zinc/22/82/22/1048228222.db2.gz YNNAMHJSVFVPPT-UHFFFAOYSA-N 1 2 319.836 4.145 20 0 DIADLO Cc1scc(CNc2ccc(-n3cc[nH+]c3)c(F)c2)c1C ZINC001201257628 1048229524 /nfs/dbraw/zinc/22/95/24/1048229524.db2.gz SFHZLNFCGAXCSA-UHFFFAOYSA-N 1 2 301.390 4.302 20 0 DIADLO Nc1ccc(Nc2cc(Cl)c(Cl)c(Cl)c2O)c[nH+]1 ZINC001201299104 1048232017 /nfs/dbraw/zinc/23/20/17/1048232017.db2.gz BTCRIMMALXVFEI-UHFFFAOYSA-N 1 2 304.564 4.073 20 0 DIADLO Cc1c(NC(=O)OC(C)(C)C)cccc1Nc1ccc(N)[nH+]c1 ZINC001201300362 1048232643 /nfs/dbraw/zinc/23/26/43/1048232643.db2.gz PLABZLSVYOSQRW-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO Cc1ccc(Nc2ccc(N)[nH+]c2)c(NC(=O)OC(C)(C)C)c1 ZINC001201300903 1048233492 /nfs/dbraw/zinc/23/34/92/1048233492.db2.gz YVEXILMNJYWZEW-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO Cc1ccc(Nc2ccc(NC(=O)c3ccccc3)cc2)[nH+]c1 ZINC001201305206 1048234011 /nfs/dbraw/zinc/23/40/11/1048234011.db2.gz OUIPRNAKFCYWIJ-UHFFFAOYSA-N 1 2 303.365 4.386 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3cncc4ccccc43)ccc21 ZINC001201309608 1048234735 /nfs/dbraw/zinc/23/47/35/1048234735.db2.gz YESNPVRMMALWNB-UHFFFAOYSA-N 1 2 303.409 4.229 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3cncc4ccccc43)ccc21 ZINC001201309608 1048234742 /nfs/dbraw/zinc/23/47/42/1048234742.db2.gz YESNPVRMMALWNB-UHFFFAOYSA-N 1 2 303.409 4.229 20 0 DIADLO C[C@H](C[NH2+]c1ccc(N2CCSCC2)cc1)c1ccccc1 ZINC000774936417 1048235634 /nfs/dbraw/zinc/23/56/34/1048235634.db2.gz LBIPROFMOQISEL-MRXNPFEDSA-N 1 2 312.482 4.455 20 0 DIADLO COc1cccc2[nH+]c(NCc3ccc4c(ccn4C)c3)ccc21 ZINC001162166728 1048236351 /nfs/dbraw/zinc/23/63/51/1048236351.db2.gz YOBBTNOCUVWJAE-UHFFFAOYSA-N 1 2 317.392 4.347 20 0 DIADLO CCCCn1c(S[C@@H]2CC[C@H](C)C2)nnc1[C@H](CC)[NH+](C)C ZINC000554969176 1048241414 /nfs/dbraw/zinc/24/14/14/1048241414.db2.gz FVMSHFFUYWTUJX-ZNMIVQPWSA-N 1 2 324.538 4.372 20 0 DIADLO COc1ccc2[nH+]c(NC(C)(C)Cc3cccnc3)c(C)cc2c1 ZINC001162237295 1048248025 /nfs/dbraw/zinc/24/80/25/1048248025.db2.gz JLBWMYCNCCUTBI-UHFFFAOYSA-N 1 2 321.424 4.380 20 0 DIADLO COc1ccc2[nH+]c(NC(C)(C)Cc3cccnc3)cc(C)c2c1 ZINC001162238781 1048248202 /nfs/dbraw/zinc/24/82/02/1048248202.db2.gz GYRAUBHUCLKVML-UHFFFAOYSA-N 1 2 321.424 4.380 20 0 DIADLO CC(=O)c1cc(Cl)c(Nc2ccc(N(C)C)[nH+]c2)c(Cl)c1 ZINC001175343475 1048250214 /nfs/dbraw/zinc/25/02/14/1048250214.db2.gz KIMBXZWNJFHQTJ-UHFFFAOYSA-N 1 2 324.211 4.401 20 0 DIADLO Cc1nc(-c2ccc(Nc3ccc(N(C)C)[nH+]c3)cc2)cs1 ZINC001175343060 1048250545 /nfs/dbraw/zinc/25/05/45/1048250545.db2.gz FLCPOXWLLNMGNS-UHFFFAOYSA-N 1 2 310.426 4.323 20 0 DIADLO Cc1nc(NCC2(c3ccc(Cl)cc3)CCCC2)cc[nH+]1 ZINC001162243496 1048251254 /nfs/dbraw/zinc/25/12/54/1048251254.db2.gz BKSYPPVAGFDQRV-UHFFFAOYSA-N 1 2 301.821 4.362 20 0 DIADLO c1ccc(-c2ccncc2)c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175348179 1048251575 /nfs/dbraw/zinc/25/15/75/1048251575.db2.gz BZSRDNJWOKNSDZ-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Clc1cc(Nc2ccc(N3CCCC3)[nH+]c2)cc(Cl)n1 ZINC001175346476 1048251591 /nfs/dbraw/zinc/25/15/91/1048251591.db2.gz VWTGITLNFHHOPR-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO Fc1cccc2cc(Nc3ccc(N4CCCC4)[nH+]c3)cnc12 ZINC001175347709 1048251732 /nfs/dbraw/zinc/25/17/32/1048251732.db2.gz SBWZABYLLYOSFW-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO Oc1ccc2c(cccc2Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175348615 1048251810 /nfs/dbraw/zinc/25/18/10/1048251810.db2.gz HJSYUVZUUPSRPL-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO CN(C)c1ccc(Nc2cccc(Oc3cccc(N)c3)c2)c[nH+]1 ZINC001175346678 1048252165 /nfs/dbraw/zinc/25/21/65/1048252165.db2.gz XJGGITOGHSQZOS-UHFFFAOYSA-N 1 2 320.396 4.266 20 0 DIADLO Cc1cc(NC[C@H](O)c2ccco2)[nH+]c2c1cccc2C(C)C ZINC001162253811 1048252027 /nfs/dbraw/zinc/25/20/27/1048252027.db2.gz PEIMISPCVWZSKM-INIZCTEOSA-N 1 2 310.397 4.405 20 0 DIADLO Cc1cc(Nc2ccc(N3CCCC3)[nH+]c2)c2cccc(F)c2n1 ZINC001175348278 1048252202 /nfs/dbraw/zinc/25/22/02/1048252202.db2.gz CERLQVDFSYCBBJ-UHFFFAOYSA-N 1 2 322.387 4.421 20 0 DIADLO Cc1cc(Oc2ccc(Nc3ccc(N(C)C)nc3)cc2)cc[nH+]1 ZINC001175346656 1048252688 /nfs/dbraw/zinc/25/26/88/1048252688.db2.gz WMFZBSMWBHJFFZ-UHFFFAOYSA-N 1 2 320.396 4.387 20 0 DIADLO Cc1cc(C(F)(F)F)ncc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175346432 1048252800 /nfs/dbraw/zinc/25/28/00/1048252800.db2.gz UBEBNEGFWVSBCJ-UHFFFAOYSA-N 1 2 322.334 4.148 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1ccccc1[S@@](C)=O ZINC001175304626 1048254951 /nfs/dbraw/zinc/25/49/51/1048254951.db2.gz DMYYOXGDJDUIAZ-OAQYLSRUSA-N 1 2 302.443 4.070 20 0 DIADLO CC(C)c1cc(NCc2cccc(N(C)C)c2)nc(C(C)C)[nH+]1 ZINC001162333324 1048262751 /nfs/dbraw/zinc/26/27/51/1048262751.db2.gz DUHVQAKPJBWABA-UHFFFAOYSA-N 1 2 312.461 4.402 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)cn1)c1nc2ccccc2s1 ZINC000776168238 1048265870 /nfs/dbraw/zinc/26/58/70/1048265870.db2.gz AKBYGJLEAUKIEF-JTQLQIEISA-N 1 2 303.818 4.196 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(NCc2cnc3cccc(C)n23)c1 ZINC001162354252 1048265985 /nfs/dbraw/zinc/26/59/85/1048265985.db2.gz MKMURWRUNJDEAV-UHFFFAOYSA-N 1 2 322.456 4.409 20 0 DIADLO CCOc1cc(Nc2ccc([NH2+]CC3CCCC3)cc2)ncn1 ZINC001162361716 1048267609 /nfs/dbraw/zinc/26/76/09/1048267609.db2.gz YNNWRBZLYBZAHV-UHFFFAOYSA-N 1 2 312.417 4.221 20 0 DIADLO Fc1ccc2nc(Nc3ccc(NC4CCCC4)[nH+]c3)oc2c1 ZINC001162361201 1048268334 /nfs/dbraw/zinc/26/83/34/1048268334.db2.gz JVCCPXYBBLCTJS-UHFFFAOYSA-N 1 2 312.348 4.460 20 0 DIADLO Fc1cc(Nc2ccc(N3CCCC3)[nH+]c2)c(F)cc1Cl ZINC001175349207 1048269640 /nfs/dbraw/zinc/26/96/40/1048269640.db2.gz MHCMIEABEOFBBB-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO CC(C)C[C@H](CO)Nc1[nH+]ccc2cccc(C(F)(F)F)c21 ZINC001162363834 1048270225 /nfs/dbraw/zinc/27/02/25/1048270225.db2.gz BRQOGDMMMCRGSX-GFCCVEGCSA-N 1 2 312.335 4.073 20 0 DIADLO COc1ccc(Cl)cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175351295 1048270864 /nfs/dbraw/zinc/27/08/64/1048270864.db2.gz PXRHPEPOUSKZLV-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO Cc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c2cccnc12 ZINC001175350503 1048270891 /nfs/dbraw/zinc/27/08/91/1048270891.db2.gz AGAIBNKTTTVEBP-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO Oc1ccc2ccc(Nc3ccc(N4CCCC4)[nH+]c3)cc2c1 ZINC001175352896 1048273188 /nfs/dbraw/zinc/27/31/88/1048273188.db2.gz WLQNGPWQIDGEFW-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO Cc1ccc2c(CCNc3cc(C)[nH+]c(C4CC4)n3)c[nH]c2c1 ZINC001186174644 1048274108 /nfs/dbraw/zinc/27/41/08/1048274108.db2.gz GNZDXOLHXGJYMK-UHFFFAOYSA-N 1 2 306.413 4.107 20 0 DIADLO Cc1cc(N[C@@H]2CCOc3c(F)cc(F)cc32)nc(C(C)C)[nH+]1 ZINC001162404740 1048274963 /nfs/dbraw/zinc/27/49/63/1048274963.db2.gz AYKDJZZALPXRKE-CQSZACIVSA-N 1 2 319.355 4.122 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H]2CCOc3c(F)cc(F)cc32)c1 ZINC001162405046 1048275026 /nfs/dbraw/zinc/27/50/26/1048275026.db2.gz CMRWQHMPYXCVMY-CQSZACIVSA-N 1 2 322.380 4.408 20 0 DIADLO Cc1cc(N[C@@H]2CCCO[C@@H]2CC(C)C)nc(C2CCC2)[nH+]1 ZINC001186212521 1048276825 /nfs/dbraw/zinc/27/68/25/1048276825.db2.gz QNPCLXSBXQOTOG-HZPDHXFCSA-N 1 2 303.450 4.058 20 0 DIADLO COc1cccc2c1C[N@H+](CCSc1ccc(F)cc1F)C2 ZINC001175362161 1048278438 /nfs/dbraw/zinc/27/84/38/1048278438.db2.gz RJSJAMIFZWLYBF-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO COc1cccc2c1C[N@@H+](CCSc1ccc(F)cc1F)C2 ZINC001175362161 1048278445 /nfs/dbraw/zinc/27/84/45/1048278445.db2.gz RJSJAMIFZWLYBF-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2c[nH]c(C(F)(F)F)cc2=O)cc1 ZINC001201488858 1048280158 /nfs/dbraw/zinc/28/01/58/1048280158.db2.gz KDLQDIURSWRJCJ-UHFFFAOYSA-N 1 2 311.307 4.370 20 0 DIADLO Cc1cnn(Cc2ccncc2)c1Nc1ccc([NH2+]C(C)C)cc1 ZINC001201487970 1048280857 /nfs/dbraw/zinc/28/08/57/1048280857.db2.gz MVIIXCUZWWYCDX-UHFFFAOYSA-N 1 2 321.428 4.199 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2sccc2Cl)c1OC ZINC001205347290 1048280784 /nfs/dbraw/zinc/28/07/84/1048280784.db2.gz KVPBBEHLGBPOSH-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2sccc2Cl)c1OC ZINC001205347290 1048280793 /nfs/dbraw/zinc/28/07/93/1048280793.db2.gz KVPBBEHLGBPOSH-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COC(=O)c1ncc(Cl)cc1Nc1ccc([NH2+]C(C)C)cc1 ZINC001201491222 1048281996 /nfs/dbraw/zinc/28/19/96/1048281996.db2.gz PHJBTMDCFUCAEO-UHFFFAOYSA-N 1 2 319.792 4.086 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2ccc3nc(C(C)C)nn3c2)cc1 ZINC001201497859 1048284569 /nfs/dbraw/zinc/28/45/69/1048284569.db2.gz KWYATNBDYAMZKT-UHFFFAOYSA-N 1 2 309.417 4.417 20 0 DIADLO Cc1nc(NCC(C)(C)c2cccc(F)c2)c2c([nH+]1)CCCC2 ZINC001162489479 1048287346 /nfs/dbraw/zinc/28/73/46/1048287346.db2.gz HQCVDJUNNQBGIH-UHFFFAOYSA-N 1 2 313.420 4.193 20 0 DIADLO Cc1cc(N[C@@H](Cc2ccccc2)C2CC2)nc(C2CCC2)[nH+]1 ZINC001162503264 1048288141 /nfs/dbraw/zinc/28/81/41/1048288141.db2.gz XKPZUDCAZFNXJX-SFHVURJKSA-N 1 2 307.441 4.486 20 0 DIADLO CCc1cc(N2Cc3ccccc3C3(CCC3)C2)nc(CC)[nH+]1 ZINC001186405397 1048297006 /nfs/dbraw/zinc/29/70/06/1048297006.db2.gz KOPLDRSCLNOFNW-UHFFFAOYSA-N 1 2 307.441 4.043 20 0 DIADLO Cc1ccc2c(c1)[C@@H](Nc1cc(C(C)C)[nH+]c(C(C)C)n1)C(=O)N2 ZINC001162566561 1048303533 /nfs/dbraw/zinc/30/35/33/1048303533.db2.gz REMAUDCOKIKEPC-QGZVFWFLSA-N 1 2 324.428 4.137 20 0 DIADLO Cc1ccc2c(c1)[C@H](Nc1cc(C(C)C)[nH+]c(C(C)C)n1)C(=O)N2 ZINC001162566559 1048304691 /nfs/dbraw/zinc/30/46/91/1048304691.db2.gz REMAUDCOKIKEPC-KRWDZBQOSA-N 1 2 324.428 4.137 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(N[C@H]2c3cc(C)ccc3NC2=O)c1 ZINC001162572572 1048306598 /nfs/dbraw/zinc/30/65/98/1048306598.db2.gz GUHDZUFTVILYKW-IBGZPJMESA-N 1 2 323.440 4.255 20 0 DIADLO CC(C)(C)OC(=O)C(C)(C)CNc1[nH+]ccc2ccccc21 ZINC001162596552 1048310196 /nfs/dbraw/zinc/31/01/96/1048310196.db2.gz GXMOSNKGKGUXHS-UHFFFAOYSA-N 1 2 300.402 4.015 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cc(F)cc(C(=O)N(C)C)c3)ccc12 ZINC001201527035 1048311456 /nfs/dbraw/zinc/31/14/56/1048311456.db2.gz STAYHENZFVZMMB-UHFFFAOYSA-N 1 2 323.371 4.128 20 0 DIADLO Cc1cc(NCCOc2cc(Cl)ccn2)[nH+]c2ccccc12 ZINC001162622606 1048315080 /nfs/dbraw/zinc/31/50/80/1048315080.db2.gz UFKRUYOBIWZBMV-UHFFFAOYSA-N 1 2 313.788 4.083 20 0 DIADLO CCc1cc(N2[C@H](C)C[C@H](c3ccccc3)[C@H]2C)nc(CC)[nH+]1 ZINC001186572202 1048318234 /nfs/dbraw/zinc/31/82/34/1048318234.db2.gz SMQANSRSRBWTKF-RKVPGOIHSA-N 1 2 309.457 4.372 20 0 DIADLO CCN(CC)c1ccc(NCc2cc3ccc(C)cc3[nH]2)c[nH+]1 ZINC001201572813 1048321030 /nfs/dbraw/zinc/32/10/30/1048321030.db2.gz AJHYGSRBEOLESS-UHFFFAOYSA-N 1 2 308.429 4.330 20 0 DIADLO CCc1cc(NCc2cc(C(CC)CC)no2)nc(CC)[nH+]1 ZINC001162637812 1048322508 /nfs/dbraw/zinc/32/25/08/1048322508.db2.gz KZBGPSAHBONIHM-UHFFFAOYSA-N 1 2 302.422 4.105 20 0 DIADLO Cc1cc(NC[C@@H]2CCC(F)(F)C2)nc(-c2ccccc2)[nH+]1 ZINC001162642419 1048323824 /nfs/dbraw/zinc/32/38/24/1048323824.db2.gz NWXWHWWZEUWTJK-CYBMUJFWSA-N 1 2 303.356 4.299 20 0 DIADLO FC1(F)CC[C@H](C[NH2+]c2ccc3c(c2)C2(CN3)CCOCC2)C1 ZINC001162647726 1048325873 /nfs/dbraw/zinc/32/58/73/1048325873.db2.gz FBZKLPITXTXIJO-ZDUSSCGKSA-N 1 2 322.399 4.008 20 0 DIADLO Cc1cn2c(cccc2Nc2cccnc2-c2ccccc2)[nH+]1 ZINC001203643018 1048327451 /nfs/dbraw/zinc/32/74/51/1048327451.db2.gz GLYKMOSGVOPFFH-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1ccc(Oc2ccc(Cl)cc2)nn1 ZINC001162662587 1048331116 /nfs/dbraw/zinc/33/11/16/1048331116.db2.gz ZXJMDILSIIPNTD-UHFFFAOYSA-N 1 2 304.781 4.358 20 0 DIADLO Cc1cccc2nc(NCCc3cn4cccc(C)c4[nH+]3)sc21 ZINC001162675484 1048334138 /nfs/dbraw/zinc/33/41/38/1048334138.db2.gz ULHZZMYOIDYYAQ-UHFFFAOYSA-N 1 2 322.437 4.215 20 0 DIADLO c1cn2ccc(Nc3cncc(OCc4ccccc4)c3)cc2[nH+]1 ZINC001201622649 1048334976 /nfs/dbraw/zinc/33/49/76/1048334976.db2.gz IDKITVRIZDMRNG-UHFFFAOYSA-N 1 2 316.364 4.052 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1cccc(F)c1Cl ZINC000555420957 1048340735 /nfs/dbraw/zinc/34/07/35/1048340735.db2.gz RHONYXJPIMBEDP-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO Cc1cc(NCCCSc2ccccn2)nc(C2CCC2)[nH+]1 ZINC001186757206 1048340921 /nfs/dbraw/zinc/34/09/21/1048340921.db2.gz NYJCLQBCEVPXGC-UHFFFAOYSA-N 1 2 314.458 4.042 20 0 DIADLO Cc1cc(NCc2cncc3ccccc32)nc(C(C)(C)C)[nH+]1 ZINC001162750045 1048347592 /nfs/dbraw/zinc/34/75/92/1048347592.db2.gz YMGFHCOAIJUGNJ-UHFFFAOYSA-N 1 2 306.413 4.243 20 0 DIADLO Cn1cc(CNc2ccc(Cn3cc[nH+]c3)cc2)c2ccccc21 ZINC001162831361 1048369653 /nfs/dbraw/zinc/36/96/53/1048369653.db2.gz PYYJTJFGKDILQL-UHFFFAOYSA-N 1 2 316.408 4.035 20 0 DIADLO Cc1cccc(C)c1C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC001273535177 1048379983 /nfs/dbraw/zinc/37/99/83/1048379983.db2.gz AHEZIBHJGYLKCT-UHFFFAOYSA-N 1 2 319.408 4.170 20 0 DIADLO Clc1ccc2nc([C@@H]3CCC[N@@H+]3C[C@H]3CCC=CO3)[nH]c2c1 ZINC000775097831 1048381002 /nfs/dbraw/zinc/38/10/02/1048381002.db2.gz VYGRWRAAZJVYDH-CJNGLKHVSA-N 1 2 317.820 4.046 20 0 DIADLO Clc1ccc2nc([C@@H]3CCC[N@H+]3C[C@H]3CCC=CO3)[nH]c2c1 ZINC000775097831 1048381016 /nfs/dbraw/zinc/38/10/16/1048381016.db2.gz VYGRWRAAZJVYDH-CJNGLKHVSA-N 1 2 317.820 4.046 20 0 DIADLO COc1ccccc1[C@@H](Nc1[nH+]ccc(F)c1C)C(F)(F)F ZINC001162901235 1048381739 /nfs/dbraw/zinc/38/17/39/1048381739.db2.gz AACYCNUFLDZKBE-CYBMUJFWSA-N 1 2 314.282 4.253 20 0 DIADLO Cc1nc(N[C@@H](C)c2nc3cc(Cl)c(Cl)cc3[nH]2)cc[nH+]1 ZINC001187281336 1048387477 /nfs/dbraw/zinc/38/74/77/1048387477.db2.gz PNMIXAAGSKOVHR-ZETCQYMHSA-N 1 2 322.199 4.141 20 0 DIADLO Cc1ccc([C@@H](CO)Nc2[nH+]ccc3cc(Cl)ccc32)cc1 ZINC001162944589 1048394167 /nfs/dbraw/zinc/39/41/67/1048394167.db2.gz INJUXLYFQCCSHC-QGZVFWFLSA-N 1 2 312.800 4.342 20 0 DIADLO CCC(CC)[C@@H]1C[C@@H](Nc2cc(C)[nH+]c(C3CCC3)n2)CCO1 ZINC001162942218 1048394590 /nfs/dbraw/zinc/39/45/90/1048394590.db2.gz CKXXCMXKCUHJSC-IRXDYDNUSA-N 1 2 317.477 4.448 20 0 DIADLO Fc1cc(Cl)cc2sc(NCCCCn3cc[nH+]c3)nc21 ZINC001162949058 1048395613 /nfs/dbraw/zinc/39/56/13/1048395613.db2.gz LLOSDNPGHXJVRF-UHFFFAOYSA-N 1 2 324.812 4.178 20 0 DIADLO COc1ccc2c(c1)CCC[C@@H]2CNc1cc(C)[nH+]c(C2CC2)n1 ZINC001163004979 1048404294 /nfs/dbraw/zinc/40/42/94/1048404294.db2.gz HRKGBWFFQWNQLV-MRXNPFEDSA-N 1 2 323.440 4.203 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(Oc3cc[nH]c(=O)c3)cc2)c1 ZINC001203664077 1048407363 /nfs/dbraw/zinc/40/73/63/1048407363.db2.gz WVKOONZPGCYVCH-UHFFFAOYSA-N 1 2 307.353 4.335 20 0 DIADLO CC[C@H](NC(=O)[C@H](C)Cc1c[nH]c[nH+]1)c1cccc2ccccc21 ZINC000899654074 1048410435 /nfs/dbraw/zinc/41/04/35/1048410435.db2.gz FTGOQUVIZFUXDG-KUHUBIRLSA-N 1 2 321.424 4.009 20 0 DIADLO CC[C@H](NC(=O)[C@H](C)Cc1c[nH+]c[nH]1)c1cccc2ccccc21 ZINC000899654074 1048410438 /nfs/dbraw/zinc/41/04/38/1048410438.db2.gz FTGOQUVIZFUXDG-KUHUBIRLSA-N 1 2 321.424 4.009 20 0 DIADLO Cc1cc(N[C@@H](CC(F)(F)F)C(C)C)nc(C2CCC2)[nH+]1 ZINC001163076445 1048413266 /nfs/dbraw/zinc/41/32/66/1048413266.db2.gz QIMDAHVUSHYFMC-LBPRGKRZSA-N 1 2 301.356 4.441 20 0 DIADLO CN1CCOc2cc(Nc3ccc([NH+]4CCCCC4)cc3)ccc21 ZINC001213044482 1048415017 /nfs/dbraw/zinc/41/50/17/1048415017.db2.gz JZZMGKJRHDNSKA-UHFFFAOYSA-N 1 2 323.440 4.249 20 0 DIADLO COc1ccc(Cl)cc1Nc1c[nH+]c(N)cc1C(F)(F)F ZINC001175712477 1048418689 /nfs/dbraw/zinc/41/86/89/1048418689.db2.gz MSBFLUQQAQVAQB-UHFFFAOYSA-N 1 2 317.698 4.088 20 0 DIADLO Cc1c(Cl)ccc2ccc(NCc3ccc4[nH+]ccn4c3)nc21 ZINC001163139299 1048420509 /nfs/dbraw/zinc/42/05/09/1048420509.db2.gz KKPFCTUDCHTIIN-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO Cc1cc(Nc2c[nH+]c(N)cc2C(F)(F)F)ccc1Cl ZINC001175713267 1048420551 /nfs/dbraw/zinc/42/05/51/1048420551.db2.gz ZJKFLWWQFVYJEL-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc3cc(F)cnc32)c[nH+]1 ZINC001175713399 1048421081 /nfs/dbraw/zinc/42/10/81/1048421081.db2.gz GKHXXPOWXPVLPF-UHFFFAOYSA-N 1 2 322.265 4.114 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc(F)c(Cl)cc2F)c[nH+]1 ZINC001175713293 1048421307 /nfs/dbraw/zinc/42/13/07/1048421307.db2.gz BGIZSPMWLIMCID-UHFFFAOYSA-N 1 2 323.652 4.358 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(O)c3ccccc23)c[nH+]1 ZINC001175717833 1048422781 /nfs/dbraw/zinc/42/27/81/1048422781.db2.gz RZWBUHMATIGWNL-UHFFFAOYSA-N 1 2 319.286 4.285 20 0 DIADLO CCCc1ccc(Nc2ccccc2C[NH+]2CCOCC2)cc1 ZINC001175718781 1048423363 /nfs/dbraw/zinc/42/33/63/1048423363.db2.gz YKBRCCTZSIYPRO-UHFFFAOYSA-N 1 2 310.441 4.215 20 0 DIADLO COc1ccc2[nH+]c(N[C@H]3CCCc4ccncc43)cc(C)c2c1 ZINC001163166406 1048426573 /nfs/dbraw/zinc/42/65/73/1048426573.db2.gz GONICPMZVFTLOT-SFHVURJKSA-N 1 2 319.408 4.436 20 0 DIADLO Cc1[nH]c(CN2CCC[C@H]2c2ccccc2C(F)(F)F)[nH+]c1C ZINC001175725005 1048427002 /nfs/dbraw/zinc/42/70/02/1048427002.db2.gz QHZSRWLPFVZJTB-HNNXBMFYSA-N 1 2 323.362 4.382 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc(Cl)ncc2Cl)c[nH+]1 ZINC001175706223 1048436453 /nfs/dbraw/zinc/43/64/53/1048436453.db2.gz LSRAJUIJMMWJCA-UHFFFAOYSA-N 1 2 323.105 4.128 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cnc(Cl)c(Cl)c2)c[nH+]1 ZINC001175706764 1048436776 /nfs/dbraw/zinc/43/67/76/1048436776.db2.gz SLWINSWPPPFZDT-UHFFFAOYSA-N 1 2 323.105 4.128 20 0 DIADLO COc1cccc2c1OC[C@H]2Nc1cc(-c2ccccc2)cc[nH+]1 ZINC001163223362 1048439576 /nfs/dbraw/zinc/43/95/76/1048439576.db2.gz MSYKFHSYCDUGSS-QGZVFWFLSA-N 1 2 318.376 4.303 20 0 DIADLO CSc1cc[nH+]c(NCCC(C(F)(F)F)C(F)(F)F)c1 ZINC001163236660 1048442880 /nfs/dbraw/zinc/44/28/80/1048442880.db2.gz JUMLJKKHXUCOEM-UHFFFAOYSA-N 1 2 318.286 4.346 20 0 DIADLO CC(C)c1cc(NC2CC3(C2)COC(C)(C)C3)nc(C(C)C)[nH+]1 ZINC001187816233 1048443538 /nfs/dbraw/zinc/44/35/38/1048443538.db2.gz JVPXJGAMGYXPAW-UHFFFAOYSA-N 1 2 317.477 4.483 20 0 DIADLO COc1cc(Nc2cc(Cl)c3[nH+]ccn3c2)ccc1Cl ZINC001175772413 1048447060 /nfs/dbraw/zinc/44/70/60/1048447060.db2.gz FEOITRACJQWOGR-UHFFFAOYSA-N 1 2 308.168 4.393 20 0 DIADLO Cc1nc(N2CCC[C@@](C)(c3ccccc3)CC2)c(C)c(C)[nH+]1 ZINC001163278752 1048447130 /nfs/dbraw/zinc/44/71/30/1048447130.db2.gz UDLBBGHFCKDRJF-HXUWFJFHSA-N 1 2 309.457 4.350 20 0 DIADLO COc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)ccc1Cl ZINC001175771565 1048447577 /nfs/dbraw/zinc/44/75/77/1048447577.db2.gz JEAFTJVUKXYZSF-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(-c4ccccc4)nc3)ccc21 ZINC001175833926 1048459935 /nfs/dbraw/zinc/45/99/35/1048459935.db2.gz JGQDKCMTNJENFG-UHFFFAOYSA-N 1 2 300.365 4.379 20 0 DIADLO c1cn(Cc2ccc(Nc3cnn(C4CCCCC4)c3)cc2)c[nH+]1 ZINC001175883777 1048470286 /nfs/dbraw/zinc/47/02/86/1048470286.db2.gz BPNGYFPBPBVVSW-UHFFFAOYSA-N 1 2 321.428 4.377 20 0 DIADLO CCOC(CCCNc1cc([NH+](CC)CC)ccc1C)OCC ZINC001163489868 1048478861 /nfs/dbraw/zinc/47/88/61/1048478861.db2.gz HYTHXMLQHXJWAQ-UHFFFAOYSA-N 1 2 322.493 4.432 20 0 DIADLO Cc1csc(SCc2c[nH+]c(N(C)C)c3ccccc23)n1 ZINC001188169596 1048482036 /nfs/dbraw/zinc/48/20/36/1048482036.db2.gz KNNHDRGTMDHFEL-UHFFFAOYSA-N 1 2 315.467 4.358 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000481770596 1048481998 /nfs/dbraw/zinc/48/19/98/1048481998.db2.gz YEWWGZIDNMZZNQ-CZUORRHYSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000481770596 1048482002 /nfs/dbraw/zinc/48/20/02/1048482002.db2.gz YEWWGZIDNMZZNQ-CZUORRHYSA-N 1 2 323.362 4.035 20 0 DIADLO Cc1cccc2c(C)cc(N3CC[C@H](F)C(F)(F)CC3)[nH+]c12 ZINC001163773912 1048522203 /nfs/dbraw/zinc/52/22/03/1048522203.db2.gz YURDQAODTSNWPM-AWEZNQCLSA-N 1 2 308.347 4.425 20 0 DIADLO COc1ccccc1[C@@H]1CCN(c2cc3ccccc3c[nH+]2)C1 ZINC001163806330 1048528537 /nfs/dbraw/zinc/52/85/37/1048528537.db2.gz IOYRSEUZYBDUDI-QGZVFWFLSA-N 1 2 304.393 4.237 20 0 DIADLO CC[NH+](CC)[C@@H](CN[C@H](C)c1ccc(F)cc1F)c1ccco1 ZINC000481944130 1048530900 /nfs/dbraw/zinc/53/09/00/1048530900.db2.gz GVFZYJZEESTKFY-DYVFJYSZSA-N 1 2 322.399 4.292 20 0 DIADLO CC[NH+](CC)[C@@H](CN[C@@H](C)c1ccc(F)cc1F)c1ccco1 ZINC000481944132 1048531173 /nfs/dbraw/zinc/53/11/73/1048531173.db2.gz GVFZYJZEESTKFY-GUYCJALGSA-N 1 2 322.399 4.292 20 0 DIADLO [NH2+]=C(Nc1cc(-c2ccco2)ncn1)C12CC3CC(CC(C3)C1)C2 ZINC001163844004 1048536700 /nfs/dbraw/zinc/53/67/00/1048536700.db2.gz CWQJZXJVPVICDB-UHFFFAOYSA-N 1 2 322.412 4.342 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc(-c3ccccn3)cc2)[nH+]1 ZINC001176034354 1048539560 /nfs/dbraw/zinc/53/95/60/1048539560.db2.gz OZOWREXZWCGTSG-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO Cc1cn2c(cccc2NC(=O)Nc2cc(Cl)ccc2C)[nH+]1 ZINC001188695759 1048541189 /nfs/dbraw/zinc/54/11/89/1048541189.db2.gz KTCCNGWTHWUMLV-UHFFFAOYSA-N 1 2 314.776 4.249 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H](C)c1cn(C(C)C)nn1 ZINC000924772517 1048543743 /nfs/dbraw/zinc/54/37/43/1048543743.db2.gz HUXUXPTXDOIJHO-KBPBESRZSA-N 1 2 312.417 4.325 20 0 DIADLO CCN(CC)C(=O)c1ccc(F)c(Nc2ccc(C)[nH+]c2C)c1 ZINC001176071576 1048545685 /nfs/dbraw/zinc/54/56/85/1048545685.db2.gz SAUNQHDZUTZJQY-UHFFFAOYSA-N 1 2 315.392 4.063 20 0 DIADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2ccccc2OC(C)C)[nH]c1C ZINC001176076960 1048547304 /nfs/dbraw/zinc/54/73/04/1048547304.db2.gz IQRBFIYNBBLMNR-KRWDZBQOSA-N 1 2 313.445 4.151 20 0 DIADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2ccccc2OC(C)C)[nH]c1C ZINC001176076960 1048547318 /nfs/dbraw/zinc/54/73/18/1048547318.db2.gz IQRBFIYNBBLMNR-KRWDZBQOSA-N 1 2 313.445 4.151 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2Cc2ccccc2OC(C)C)[nH+]c1C ZINC001176076960 1048547331 /nfs/dbraw/zinc/54/73/31/1048547331.db2.gz IQRBFIYNBBLMNR-KRWDZBQOSA-N 1 2 313.445 4.151 20 0 DIADLO CC(C)c1cc(NC[C@H]2CCC23CCOCC3)nc(C(C)C)[nH+]1 ZINC001163942378 1048553864 /nfs/dbraw/zinc/55/38/64/1048553864.db2.gz VNWZTCZBSYWKAU-OAHLLOKOSA-N 1 2 317.477 4.342 20 0 DIADLO C[C@H]1c2ccccc2CCN1c1[nH+]ccc2c3c([nH]c21)CCC3 ZINC001163961245 1048562110 /nfs/dbraw/zinc/56/21/10/1048562110.db2.gz VAPONHSDFNXUOG-ZDUSSCGKSA-N 1 2 303.409 4.175 20 0 DIADLO Cc1ccc2ccc(F)c(Nc3ccc[nH+]c3N3CCCC3)c2n1 ZINC001176113029 1048571110 /nfs/dbraw/zinc/57/11/10/1048571110.db2.gz FLPYLKVGDJARAY-UHFFFAOYSA-N 1 2 322.387 4.421 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+]1CCc2sccc2C1 ZINC000338914618 1048573341 /nfs/dbraw/zinc/57/33/41/1048573341.db2.gz VTTJPOGJFVNTLZ-UHFFFAOYSA-N 1 2 316.451 4.331 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+]1CCc2sccc2C1 ZINC000338914618 1048573364 /nfs/dbraw/zinc/57/33/64/1048573364.db2.gz VTTJPOGJFVNTLZ-UHFFFAOYSA-N 1 2 316.451 4.331 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(Oc2ccc(F)cc2)nc1 ZINC001176118277 1048574606 /nfs/dbraw/zinc/57/46/06/1048574606.db2.gz HWXCCDZIJLYPPV-UHFFFAOYSA-N 1 2 311.316 4.160 20 0 DIADLO COc1cc[nH+]cc1Nc1ccc(C(C)=O)cc1C(F)(F)F ZINC001176124980 1048575257 /nfs/dbraw/zinc/57/52/57/1048575257.db2.gz VOLLVVJZBBDGRB-UHFFFAOYSA-N 1 2 310.275 4.055 20 0 DIADLO O=c1ccc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)c[nH]1 ZINC001176126073 1048576026 /nfs/dbraw/zinc/57/60/26/1048576026.db2.gz FPLAHMACLFHOBL-UHFFFAOYSA-N 1 2 305.259 4.098 20 0 DIADLO COc1cc[nH+]cc1Nc1c(O)cc(C(F)(F)F)cc1Cl ZINC001176124981 1048576103 /nfs/dbraw/zinc/57/61/03/1048576103.db2.gz VOORKZMPUQGMJU-UHFFFAOYSA-N 1 2 318.682 4.212 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(-c2ccc(Cl)s2)on1 ZINC001176122002 1048576585 /nfs/dbraw/zinc/57/65/85/1048576585.db2.gz YMMAUXUUOKGEEQ-UHFFFAOYSA-N 1 2 307.762 4.204 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(F)c(C)c(Br)c1 ZINC001176124522 1048576616 /nfs/dbraw/zinc/57/66/16/1048576616.db2.gz QCQCWMOIEZTVHH-UHFFFAOYSA-N 1 2 311.154 4.044 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(F)c(OCC2CCC2)c(F)c1 ZINC001176124548 1048576700 /nfs/dbraw/zinc/57/67/00/1048576700.db2.gz QRUFGVNUOBSYKP-UHFFFAOYSA-N 1 2 320.339 4.291 20 0 DIADLO COc1cc[nH+]cc1-n1c(-c2ccc(N)cc2)cc2ccccc21 ZINC001176124372 1048577237 /nfs/dbraw/zinc/57/72/37/1048577237.db2.gz LNEWGFBKALDIDJ-UHFFFAOYSA-N 1 2 315.376 4.283 20 0 DIADLO COc1cc[nH+]cc1Nc1cccc(F)c1OC1CCCC1 ZINC001176122958 1048577270 /nfs/dbraw/zinc/57/72/70/1048577270.db2.gz DEDQEFPTSNQTTF-UHFFFAOYSA-N 1 2 302.349 4.294 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(F)c(OC2CCC2)c(F)c1 ZINC001176123049 1048577704 /nfs/dbraw/zinc/57/77/04/1048577704.db2.gz HRYBNAWEPFXTGY-UHFFFAOYSA-N 1 2 306.312 4.043 20 0 DIADLO CC(C)=CCC[C@@H](C)CC[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000482254893 1048580119 /nfs/dbraw/zinc/58/01/19/1048580119.db2.gz VCVWERJOIBTLRA-AEFFLSMTSA-N 1 2 312.461 4.256 20 0 DIADLO CNc1ccc(N[C@H](C)c2ccc(Br)s2)c[nH+]1 ZINC001164089447 1048580976 /nfs/dbraw/zinc/58/09/76/1048580976.db2.gz RCYSWPFTMKOFJJ-MRVPVSSYSA-N 1 2 312.236 4.120 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001176178036 1048581958 /nfs/dbraw/zinc/58/19/58/1048581958.db2.gz WSKDPXQKDGOXOG-GFCCVEGCSA-N 1 2 309.784 4.128 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001176178036 1048581974 /nfs/dbraw/zinc/58/19/74/1048581974.db2.gz WSKDPXQKDGOXOG-GFCCVEGCSA-N 1 2 309.784 4.128 20 0 DIADLO FC[C@@H]1CCN(c2cc(-c3ccccc3)cc[nH+]2)CC1(F)F ZINC001164092886 1048581712 /nfs/dbraw/zinc/58/17/12/1048581712.db2.gz WWBGKXADTFBHKF-HNNXBMFYSA-N 1 2 306.331 4.180 20 0 DIADLO COCOc1ccc(Nc2c(C)cc[nH+]c2C(C)C)cc1F ZINC001176188723 1048586478 /nfs/dbraw/zinc/58/64/78/1048586478.db2.gz KLCCURQFKDNIHD-UHFFFAOYSA-N 1 2 304.365 4.379 20 0 DIADLO COCCOc1cc(N[C@H](C)c2ccc3ccccc3c2)cc[nH+]1 ZINC001164143397 1048589462 /nfs/dbraw/zinc/58/94/62/1048589462.db2.gz NWULRAQLLHXFPJ-OAHLLOKOSA-N 1 2 322.408 4.433 20 0 DIADLO C[C@@H](Nc1ccc2c([nH+]1)CCOC2)c1ccc2ccccc2c1 ZINC001164145778 1048592289 /nfs/dbraw/zinc/59/22/89/1048592289.db2.gz QMKXFPGZTDJVKR-CQSZACIVSA-N 1 2 304.393 4.481 20 0 DIADLO Cc1cc(Cl)c(C)c(N(C)Cc2cnc(Cl)s2)[nH+]1 ZINC001164169005 1048597087 /nfs/dbraw/zinc/59/70/87/1048597087.db2.gz STMPGRSDXHTSKP-UHFFFAOYSA-N 1 2 302.230 4.098 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)C(C)(C)c1ccnc(Cl)c1 ZINC001164174131 1048597348 /nfs/dbraw/zinc/59/73/48/1048597348.db2.gz UKPAHYWNOBRZGV-UHFFFAOYSA-N 1 2 316.257 4.212 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)C(C)(C)c1ccnc(Cl)c1 ZINC001164174131 1048597365 /nfs/dbraw/zinc/59/73/65/1048597365.db2.gz UKPAHYWNOBRZGV-UHFFFAOYSA-N 1 2 316.257 4.212 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3ccccc3F)cc2)[nH+]c1C ZINC001176209754 1048605365 /nfs/dbraw/zinc/60/53/65/1048605365.db2.gz AOMVQUDHYICWQI-UHFFFAOYSA-N 1 2 309.344 4.085 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C[C@@H]3CC[C@@H]4C[C@@H]43)cc2)[nH+]c1C ZINC001176209867 1048606281 /nfs/dbraw/zinc/60/62/81/1048606281.db2.gz BZIAYBLNOFYNSR-VYDXJSESSA-N 1 2 309.413 4.068 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3CC[C@@H]4C[C@@H]4CC3)cc2)[nH+]c1C ZINC001176219706 1048607476 /nfs/dbraw/zinc/60/74/76/1048607476.db2.gz NCMHSOWHWHQVHH-OSYLJGHBSA-N 1 2 323.440 4.458 20 0 DIADLO CCc1cc(N2CCC[C@H]2/C=C\c2ccccc2)nc(CC)[nH+]1 ZINC001164261738 1048613792 /nfs/dbraw/zinc/61/37/92/1048613792.db2.gz YXZWPHMFPPLRKZ-SQVRQVGWSA-N 1 2 307.441 4.284 20 0 DIADLO Cc1cc(N2CCC[C@H]2/C=C\c2ccccc2)nc(C2CC2)[nH+]1 ZINC001164260964 1048614235 /nfs/dbraw/zinc/61/42/35/1048614235.db2.gz JYTYHZHXYCSFDA-DVESRUBUSA-N 1 2 305.425 4.345 20 0 DIADLO CC(C)(C)c1ccc(N2CC[C@@](CF)(C(F)(F)F)C2)[nH+]c1 ZINC001164271577 1048615867 /nfs/dbraw/zinc/61/58/67/1048615867.db2.gz DAZRTQQRBFNSLC-AWEZNQCLSA-N 1 2 304.331 4.107 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)s1 ZINC000482500670 1048617517 /nfs/dbraw/zinc/61/75/17/1048617517.db2.gz AZYBLAHBIMENDQ-WDEREUQCSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)s1 ZINC000482500670 1048617525 /nfs/dbraw/zinc/61/75/25/1048617525.db2.gz AZYBLAHBIMENDQ-WDEREUQCSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)s1 ZINC000482500665 1048619234 /nfs/dbraw/zinc/61/92/34/1048619234.db2.gz AZYBLAHBIMENDQ-QWRGUYRKSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)s1 ZINC000482500665 1048619236 /nfs/dbraw/zinc/61/92/36/1048619236.db2.gz AZYBLAHBIMENDQ-QWRGUYRKSA-N 1 2 306.397 4.429 20 0 DIADLO C[NH+](C)c1ccc(NCc2cccc(OC3CC3)c2F)cc1 ZINC000850198661 1048622850 /nfs/dbraw/zinc/62/28/50/1048622850.db2.gz LIBACRCUGPYMIX-UHFFFAOYSA-N 1 2 300.377 4.045 20 0 DIADLO CCOc1ccc(C(F)(F)F)cc1NCc1[nH]c(C)c(C)[nH+]1 ZINC000850208390 1048623881 /nfs/dbraw/zinc/62/38/81/1048623881.db2.gz LCICXMGKFNNBDQ-UHFFFAOYSA-N 1 2 313.323 4.056 20 0 DIADLO Clc1cc(SCCn2cc[nH+]c2)ccc1Br ZINC001189399515 1048625491 /nfs/dbraw/zinc/62/54/91/1048625491.db2.gz SURDLLHRHJTYCF-UHFFFAOYSA-N 1 2 317.639 4.091 20 0 DIADLO Clc1cccc([C@@H]2CCCCN2Cc2c[nH+]c3n2CCC3)c1 ZINC000668071433 1048633319 /nfs/dbraw/zinc/63/33/19/1048633319.db2.gz MKPMWHCSSILUAX-KRWDZBQOSA-N 1 2 315.848 4.210 20 0 DIADLO Clc1cccc([C@H]2CCCCN2Cc2c[nH+]c3n2CCC3)c1 ZINC000668071434 1048633464 /nfs/dbraw/zinc/63/34/64/1048633464.db2.gz MKPMWHCSSILUAX-QGZVFWFLSA-N 1 2 315.848 4.210 20 0 DIADLO COc1cc(Cl)cc(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001176343413 1048634542 /nfs/dbraw/zinc/63/45/42/1048634542.db2.gz FJHJYACUKXULHL-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO Cc1cc(C)c(Nc2ccc(OCc3ccccc3)nc2)c[nH+]1 ZINC001176299898 1048639719 /nfs/dbraw/zinc/63/97/19/1048639719.db2.gz CEDBCCPYGWJUJV-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO c1ccc(-c2cc[nH+]c(N3CCC(OC4CCC4)CC3)c2)cc1 ZINC001164571597 1048644712 /nfs/dbraw/zinc/64/47/12/1048644712.db2.gz GTEYUDBDOAJPQQ-UHFFFAOYSA-N 1 2 308.425 4.287 20 0 DIADLO Cc1ccc(Nc2cccc3c2cnn3[C@@H]2CCCCO2)c(C)[nH+]1 ZINC001176314899 1048647782 /nfs/dbraw/zinc/64/77/82/1048647782.db2.gz FPZCCPSHFPQPJQ-IBGZPJMESA-N 1 2 322.412 4.491 20 0 DIADLO Cc1ccc(C)c(Nc2cccc3c2cnn3[C@H]2CCCCO2)[nH+]1 ZINC001176319799 1048649717 /nfs/dbraw/zinc/64/97/17/1048649717.db2.gz SQDWVKTWEHDJRZ-GOSISDBHSA-N 1 2 322.412 4.491 20 0 DIADLO COc1cccc(C(=O)C(F)(F)F)c1Nc1ccc(C)[nH+]c1C ZINC001203381490 1048651087 /nfs/dbraw/zinc/65/10/87/1048651087.db2.gz ZZWATUIHTPEMTD-UHFFFAOYSA-N 1 2 324.302 4.196 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3nc[nH]c3[C@@H]2c2ccccc2)cc1F ZINC001176322653 1048651258 /nfs/dbraw/zinc/65/12/58/1048651258.db2.gz MZXBYDKRDKIGOD-FQEVSTJZSA-N 1 2 321.399 4.005 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3nc[nH]c3[C@@H]2c2ccccc2)cc1F ZINC001176322653 1048651264 /nfs/dbraw/zinc/65/12/64/1048651264.db2.gz MZXBYDKRDKIGOD-FQEVSTJZSA-N 1 2 321.399 4.005 20 0 DIADLO CCc1ccc(C[N@@H+]2CCSC[C@H]2c2ccc(F)cc2)o1 ZINC001204392657 1048655128 /nfs/dbraw/zinc/65/51/28/1048655128.db2.gz IRHVETRNJAGHQD-KRWDZBQOSA-N 1 2 305.418 4.271 20 0 DIADLO CCc1ccc(C[N@H+]2CCSC[C@H]2c2ccc(F)cc2)o1 ZINC001204392657 1048655136 /nfs/dbraw/zinc/65/51/36/1048655136.db2.gz IRHVETRNJAGHQD-KRWDZBQOSA-N 1 2 305.418 4.271 20 0 DIADLO Clc1ccnc(C[NH2+][C@@H](c2ccccn2)C2CC2)c1Cl ZINC001176364407 1048660144 /nfs/dbraw/zinc/66/01/44/1048660144.db2.gz CNGLSHDBVNLVRD-OAHLLOKOSA-N 1 2 308.212 4.024 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCCC34CC4)cc2)C[C@@H](C)O1 ZINC000850458794 1048664229 /nfs/dbraw/zinc/66/42/29/1048664229.db2.gz PWVDKLGEDZVEJW-IIDMSEBBSA-N 1 2 300.446 4.045 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(Oc2ccccc2)nc1 ZINC001176375013 1048666664 /nfs/dbraw/zinc/66/66/64/1048666664.db2.gz IUEODICMECTNMG-UHFFFAOYSA-N 1 2 316.364 4.103 20 0 DIADLO c1cc(C[NH2+]Cc2nc(-c3cc4ccccc4o3)cs2)co1 ZINC000775321621 1048670128 /nfs/dbraw/zinc/67/01/28/1048670128.db2.gz YBCVJPWSTDMEQL-UHFFFAOYSA-N 1 2 310.378 4.439 20 0 DIADLO Cc1cn(C(C)(C)C(=O)Nc2ccc(C(C)(C)C)c(F)c2)c[nH+]1 ZINC001176442106 1048675328 /nfs/dbraw/zinc/67/53/28/1048675328.db2.gz XHRMPQIZLWFZAR-UHFFFAOYSA-N 1 2 317.408 4.002 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@@H]2C[C@H](O)c3ccccc32)cs1 ZINC000850527610 1048680201 /nfs/dbraw/zinc/68/02/01/1048680201.db2.gz HBQWKXAQOIHCQZ-PEYYIBSZSA-N 1 2 302.443 4.096 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000482788312 1048681002 /nfs/dbraw/zinc/68/10/02/1048681002.db2.gz CMIDSLBAVFAQNF-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000482788312 1048681008 /nfs/dbraw/zinc/68/10/08/1048681008.db2.gz CMIDSLBAVFAQNF-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@H+](C)Cc1cc(OC)ns1 ZINC001176473955 1048693470 /nfs/dbraw/zinc/69/34/70/1048693470.db2.gz DWWAUCCILNQDDI-AWEZNQCLSA-N 1 2 312.385 4.013 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@@H+](C)Cc1cc(OC)ns1 ZINC001176473955 1048693477 /nfs/dbraw/zinc/69/34/77/1048693477.db2.gz DWWAUCCILNQDDI-AWEZNQCLSA-N 1 2 312.385 4.013 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@H+](C)Cc1cc(OC)ns1 ZINC001176473958 1048693634 /nfs/dbraw/zinc/69/36/34/1048693634.db2.gz DWWAUCCILNQDDI-CQSZACIVSA-N 1 2 312.385 4.013 20 0 DIADLO CC[C@H](c1ccc(F)cc1F)[N@@H+](C)Cc1cc(OC)ns1 ZINC001176473958 1048693637 /nfs/dbraw/zinc/69/36/37/1048693637.db2.gz DWWAUCCILNQDDI-CQSZACIVSA-N 1 2 312.385 4.013 20 0 DIADLO O=C(c1ccccc1-n1cc[nH+]c1)N1CCC[C@H]1C1CCCCC1 ZINC001190098525 1048694745 /nfs/dbraw/zinc/69/47/45/1048694745.db2.gz SRPWZHXNSBJDGF-SFHVURJKSA-N 1 2 323.440 4.057 20 0 DIADLO Cc1cc([C@H]2CCCC[N@@H+]2Cc2ccc(C)cc2Cl)[nH]n1 ZINC001176486330 1048695137 /nfs/dbraw/zinc/69/51/37/1048695137.db2.gz SKOONLXYFKPHOD-QGZVFWFLSA-N 1 2 303.837 4.407 20 0 DIADLO Cc1cc([C@H]2CCCC[N@H+]2Cc2ccc(C)cc2Cl)[nH]n1 ZINC001176486330 1048695140 /nfs/dbraw/zinc/69/51/40/1048695140.db2.gz SKOONLXYFKPHOD-QGZVFWFLSA-N 1 2 303.837 4.407 20 0 DIADLO c1c[nH+]c(Nc2cccc(OCC3CC3)c2)c(N2CCCC2)c1 ZINC001176493767 1048698132 /nfs/dbraw/zinc/69/81/32/1048698132.db2.gz WYERBVFFHUTMJB-UHFFFAOYSA-N 1 2 309.413 4.214 20 0 DIADLO COc1cc(Cl)ccc1NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000775353688 1048699466 /nfs/dbraw/zinc/69/94/66/1048699466.db2.gz YEBHSJBOTXSNIV-UHFFFAOYSA-N 1 2 313.788 4.146 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+]Cc2nnc(C(C)(C)C)o2)cc1 ZINC000775354786 1048701290 /nfs/dbraw/zinc/70/12/90/1048701290.db2.gz CIBUVHLDNQRUMT-LBPRGKRZSA-N 1 2 319.474 4.330 20 0 DIADLO Fc1cccc(-c2nc(C[N@@H+]3CC[C@H]3c3ccccc3)co2)c1 ZINC000482951351 1048707911 /nfs/dbraw/zinc/70/79/11/1048707911.db2.gz WPNXASIECBILPD-SFHVURJKSA-N 1 2 308.356 4.428 20 0 DIADLO Fc1cccc(-c2nc(C[N@H+]3CC[C@H]3c3ccccc3)co2)c1 ZINC000482951351 1048707920 /nfs/dbraw/zinc/70/79/20/1048707920.db2.gz WPNXASIECBILPD-SFHVURJKSA-N 1 2 308.356 4.428 20 0 DIADLO CC(C)c1cccc(NC(=O)C[N@@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000482936192 1048708043 /nfs/dbraw/zinc/70/80/43/1048708043.db2.gz JHPASARGDMZHDS-LJQANCHMSA-N 1 2 308.425 4.196 20 0 DIADLO CC(C)c1cccc(NC(=O)C[N@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000482936192 1048708050 /nfs/dbraw/zinc/70/80/50/1048708050.db2.gz JHPASARGDMZHDS-LJQANCHMSA-N 1 2 308.425 4.196 20 0 DIADLO Cc1ncc(Nc2ccc([NH+]3CCCCC3)cc2)c(Cl)n1 ZINC001203717692 1048712678 /nfs/dbraw/zinc/71/26/78/1048712678.db2.gz LQLJVVCVKRYFBR-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO COC[C@@]12CCC[C@@H]1CN(c1cc(-c3ccccc3)cc[nH+]1)C2 ZINC001165926021 1048724993 /nfs/dbraw/zinc/72/49/93/1048724993.db2.gz KBCDCRVIOISBCN-QUCCMNQESA-N 1 2 308.425 4.002 20 0 DIADLO O=C(c1cccc(C2CCCC2)c1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000668191567 1048725461 /nfs/dbraw/zinc/72/54/61/1048725461.db2.gz FZPYVEADCHCAMB-IBGZPJMESA-N 1 2 323.440 4.018 20 0 DIADLO Cc1ccc(C(C)(C)C(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000483040042 1048726641 /nfs/dbraw/zinc/72/66/41/1048726641.db2.gz KZQDPQVPKOKYDN-UHFFFAOYSA-N 1 2 319.408 4.097 20 0 DIADLO C(=C/c1ccccc1)\CNc1cccc(Cc2ccncc2)[nH+]1 ZINC001166097237 1048734263 /nfs/dbraw/zinc/73/42/63/1048734263.db2.gz QXEUBIXYERBIFJ-VMPITWQZSA-N 1 2 301.393 4.193 20 0 DIADLO CC(C)c1ccc(N2C[C@H]3[C@@H](C2)CCC[C@@H]3OCC2CC2)[nH+]c1 ZINC001166113971 1048735666 /nfs/dbraw/zinc/73/56/66/1048735666.db2.gz LSDGKAOTCJYXOD-QYZOEREBSA-N 1 2 314.473 4.237 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc(Cc2ccccc2)no1)c1ccccc1 ZINC000775389038 1048741944 /nfs/dbraw/zinc/74/19/44/1048741944.db2.gz COVTWYKNMQYGEM-FQEVSTJZSA-N 1 2 321.424 4.075 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(OC(F)(F)F)cc3)ccc21 ZINC001176643021 1048747649 /nfs/dbraw/zinc/74/76/49/1048747649.db2.gz PLXQNHTVLRAFSC-UHFFFAOYSA-N 1 2 307.275 4.216 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@@H]2c2ccsc2)o1 ZINC000483173663 1048750050 /nfs/dbraw/zinc/75/00/50/1048750050.db2.gz OKPKEZMNZSUJDD-GFCCVEGCSA-N 1 2 312.232 4.441 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@@H]2c2ccsc2)o1 ZINC000483173663 1048750061 /nfs/dbraw/zinc/75/00/61/1048750061.db2.gz OKPKEZMNZSUJDD-GFCCVEGCSA-N 1 2 312.232 4.441 20 0 DIADLO Cc1c(C)n(Cc2ccccc2)c2nc[nH+]c(N(C)C(C)(C)C)c12 ZINC001166527981 1048757104 /nfs/dbraw/zinc/75/71/04/1048757104.db2.gz FFWJJTVBFHDBJG-UHFFFAOYSA-N 1 2 322.456 4.331 20 0 DIADLO CC(C)c1ccc(N(Cc2cccnc2)Cc2ccccn2)[nH+]c1 ZINC001166556038 1048759913 /nfs/dbraw/zinc/75/99/13/1048759913.db2.gz GQNIMHYERTWKMH-UHFFFAOYSA-N 1 2 318.424 4.202 20 0 DIADLO CCCCc1nc(C[N@H+](C)C2CCC(C(C)(C)C)CC2)no1 ZINC001190589652 1048760466 /nfs/dbraw/zinc/76/04/66/1048760466.db2.gz RGUBCNHJXAVUDB-UHFFFAOYSA-N 1 2 307.482 4.449 20 0 DIADLO CCCCc1nc(C[N@@H+](C)C2CCC(C(C)(C)C)CC2)no1 ZINC001190589652 1048760477 /nfs/dbraw/zinc/76/04/77/1048760477.db2.gz RGUBCNHJXAVUDB-UHFFFAOYSA-N 1 2 307.482 4.449 20 0 DIADLO Clc1ccc2c(cc[nH+]c2N2CC[C@@H](c3ccncc3)C2)c1 ZINC001166568285 1048763918 /nfs/dbraw/zinc/76/39/18/1048763918.db2.gz GFZLDPNRCZQRCG-OAHLLOKOSA-N 1 2 309.800 4.277 20 0 DIADLO Clc1sccc1C[N@@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000483255781 1048764565 /nfs/dbraw/zinc/76/45/65/1048764565.db2.gz LFWBIJCVUFBRSL-QGZVFWFLSA-N 1 2 319.857 4.075 20 0 DIADLO Clc1sccc1C[N@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000483255781 1048764573 /nfs/dbraw/zinc/76/45/73/1048764573.db2.gz LFWBIJCVUFBRSL-QGZVFWFLSA-N 1 2 319.857 4.075 20 0 DIADLO COc1ccc2cc[nH+]c(N3CCCC[C@H]3c3cccnc3)c2c1 ZINC001166575890 1048764607 /nfs/dbraw/zinc/76/46/07/1048764607.db2.gz SDQNHQGLAVEFON-IBGZPJMESA-N 1 2 319.408 4.370 20 0 DIADLO CC[N@H+](Cc1nc2c(o1)CCCC2)Cc1ccc(Cl)cc1 ZINC001190627221 1048766773 /nfs/dbraw/zinc/76/67/73/1048766773.db2.gz FYIWAQSOKPOVFQ-UHFFFAOYSA-N 1 2 304.821 4.229 20 0 DIADLO CC[N@@H+](Cc1nc2c(o1)CCCC2)Cc1ccc(Cl)cc1 ZINC001190627221 1048766785 /nfs/dbraw/zinc/76/67/85/1048766785.db2.gz FYIWAQSOKPOVFQ-UHFFFAOYSA-N 1 2 304.821 4.229 20 0 DIADLO c1c(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)nnn1C1CCC1 ZINC000668229382 1048773427 /nfs/dbraw/zinc/77/34/27/1048773427.db2.gz GZMGZPLCLXZTSK-IBGZPJMESA-N 1 2 322.456 4.120 20 0 DIADLO c1c(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)nnn1C1CCC1 ZINC000668229382 1048773438 /nfs/dbraw/zinc/77/34/38/1048773438.db2.gz GZMGZPLCLXZTSK-IBGZPJMESA-N 1 2 322.456 4.120 20 0 DIADLO Cc1cc(N2CCC(c3ccccn3)CC2)[nH+]c2ccccc12 ZINC001166669016 1048776611 /nfs/dbraw/zinc/77/66/11/1048776611.db2.gz JWXLCVXIAJXDBQ-UHFFFAOYSA-N 1 2 303.409 4.322 20 0 DIADLO C[C@@H]1CCC(=O)C[N@@H+]1CCCCc1ccc(Cl)c(Cl)c1 ZINC001176735092 1048776982 /nfs/dbraw/zinc/77/69/82/1048776982.db2.gz MDDKOQVYNRFGQH-GFCCVEGCSA-N 1 2 314.256 4.370 20 0 DIADLO C[C@@H]1CCC(=O)C[N@H+]1CCCCc1ccc(Cl)c(Cl)c1 ZINC001176735092 1048776985 /nfs/dbraw/zinc/77/69/85/1048776985.db2.gz MDDKOQVYNRFGQH-GFCCVEGCSA-N 1 2 314.256 4.370 20 0 DIADLO c1ncc(-c2ccc(Nc3ccc[nH+]c3N3CCCC3)cc2)o1 ZINC001176751021 1048777331 /nfs/dbraw/zinc/77/73/31/1048777331.db2.gz SBNOAUMLHSMZEJ-UHFFFAOYSA-N 1 2 306.369 4.080 20 0 DIADLO Cc1cc(Cl)c(C)c(N2CCC(c3ccccn3)CC2)[nH+]1 ZINC001166669037 1048778791 /nfs/dbraw/zinc/77/87/91/1048778791.db2.gz LKJURDLEBBCJOC-UHFFFAOYSA-N 1 2 301.821 4.131 20 0 DIADLO Cc1ccc2c(c1)C[N@H+]([C@@H](C)C(=O)Nc1ccccc1C(C)C)C2 ZINC000483309259 1048779374 /nfs/dbraw/zinc/77/93/74/1048779374.db2.gz PNUZSZPRKDIXNI-INIZCTEOSA-N 1 2 322.452 4.461 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+]([C@@H](C)C(=O)Nc1ccccc1C(C)C)C2 ZINC000483309259 1048779380 /nfs/dbraw/zinc/77/93/80/1048779380.db2.gz PNUZSZPRKDIXNI-INIZCTEOSA-N 1 2 322.452 4.461 20 0 DIADLO Clc1ccc2c(cc[nH+]c2N2CCO[C@@H](c3ccccc3)C2)c1 ZINC001166680083 1048780198 /nfs/dbraw/zinc/78/01/98/1048780198.db2.gz AJECADVZCSRYCR-GOSISDBHSA-N 1 2 324.811 4.466 20 0 DIADLO Cc1nc(N2CCc3ccsc3C2)cc(C2CCCCC2)[nH+]1 ZINC001166685441 1048784218 /nfs/dbraw/zinc/78/42/18/1048784218.db2.gz YFDIPOQYECLNRG-UHFFFAOYSA-N 1 2 313.470 4.457 20 0 DIADLO OC1(C2CCC2)CC[NH+](Cc2cc(Cl)sc2Cl)CC1 ZINC001176718912 1048784986 /nfs/dbraw/zinc/78/49/86/1048784986.db2.gz OVJDLWIRBBEYOH-UHFFFAOYSA-N 1 2 320.285 4.182 20 0 DIADLO Cc1nc([C@H]2CCCCN2c2cc(C)c3cccc(C)c3[nH+]2)no1 ZINC001166714066 1048785282 /nfs/dbraw/zinc/78/52/82/1048785282.db2.gz LMBXDTRCVBETGJ-MRXNPFEDSA-N 1 2 322.412 4.275 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@@H+]2CCC(C)=C(C)C2)c(Cl)c1 ZINC000483381169 1048786390 /nfs/dbraw/zinc/78/63/90/1048786390.db2.gz VWFDCXKXNUXPTL-OAHLLOKOSA-N 1 2 320.864 4.326 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@H+]2CCC(C)=C(C)C2)c(Cl)c1 ZINC000483381169 1048786398 /nfs/dbraw/zinc/78/63/98/1048786398.db2.gz VWFDCXKXNUXPTL-OAHLLOKOSA-N 1 2 320.864 4.326 20 0 DIADLO COc1ccc2[nH+]c(N3CCC[C@@H](C(F)F)C3)cc(C)c2c1 ZINC001166773350 1048791091 /nfs/dbraw/zinc/79/10/91/1048791091.db2.gz QKSHXAHSUPVHMV-GFCCVEGCSA-N 1 2 306.356 4.033 20 0 DIADLO CCc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3Cl)C2)cc1 ZINC001190923840 1048798081 /nfs/dbraw/zinc/79/80/81/1048798081.db2.gz HLKCODGYIPJJBC-IBGZPJMESA-N 1 2 315.844 4.476 20 0 DIADLO CCc1ccc(C[N@H+]2CCO[C@H](c3ccccc3Cl)C2)cc1 ZINC001190923840 1048798089 /nfs/dbraw/zinc/79/80/89/1048798089.db2.gz HLKCODGYIPJJBC-IBGZPJMESA-N 1 2 315.844 4.476 20 0 DIADLO Fc1cccc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)n1 ZINC000851980861 1048816212 /nfs/dbraw/zinc/81/62/12/1048816212.db2.gz LTVQIKMZWOAREJ-UHFFFAOYSA-N 1 2 312.310 4.175 20 0 DIADLO Fc1cccc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)n1 ZINC000851980861 1048816223 /nfs/dbraw/zinc/81/62/23/1048816223.db2.gz LTVQIKMZWOAREJ-UHFFFAOYSA-N 1 2 312.310 4.175 20 0 DIADLO C[C@H]([NH2+]CC=C(Cl)Cl)c1nc(C(F)(F)F)cs1 ZINC000851993655 1048816856 /nfs/dbraw/zinc/81/68/56/1048816856.db2.gz KHAARUWJRGRRJV-YFKPBYRVSA-N 1 2 305.152 4.132 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@@H+](Cc1ccncc1Cl)C2 ZINC001177027349 1048817698 /nfs/dbraw/zinc/81/76/98/1048817698.db2.gz IRUPGBPMZXFXIF-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@H+](Cc1ccncc1Cl)C2 ZINC001177027349 1048817720 /nfs/dbraw/zinc/81/77/20/1048817720.db2.gz IRUPGBPMZXFXIF-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO COc1ccccc1Cc1cn(CCCc2ccccc2)c[nH+]1 ZINC001166963491 1048818588 /nfs/dbraw/zinc/81/85/88/1048818588.db2.gz HWHDCWXSPVCBJJ-UHFFFAOYSA-N 1 2 306.409 4.115 20 0 DIADLO Clc1cc(C[NH+]2CCC(c3ccco3)CC2)cc(Cl)n1 ZINC000852323361 1048834012 /nfs/dbraw/zinc/83/40/12/1048834012.db2.gz HMPNQIOSZDPKNA-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO CCc1ccc(-c2noc([C@H](C)[NH2+]Cc3ccc(C)cc3)n2)cc1 ZINC000483655896 1048837189 /nfs/dbraw/zinc/83/71/89/1048837189.db2.gz QPQHGMGVOSMAKY-HNNXBMFYSA-N 1 2 321.424 4.458 20 0 DIADLO C[C@@H]([NH2+]Cc1cnon1)c1ccc(O[C@@H](C)c2ccccc2)cc1 ZINC000852441184 1048839649 /nfs/dbraw/zinc/83/96/49/1048839649.db2.gz YBTZJIDDRVVVDG-CABCVRRESA-N 1 2 323.396 4.060 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@@H+]2C[C@@H]2CCCCC2(F)F)o1 ZINC001191122948 1048859187 /nfs/dbraw/zinc/85/91/87/1048859187.db2.gz UKHGNWJOMUNXFD-ZFWWWQNUSA-N 1 2 313.388 4.041 20 0 DIADLO CCc1ccc([C@@H]2COCC[N@H+]2C[C@@H]2CCCCC2(F)F)o1 ZINC001191122948 1048859210 /nfs/dbraw/zinc/85/92/10/1048859210.db2.gz UKHGNWJOMUNXFD-ZFWWWQNUSA-N 1 2 313.388 4.041 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@H](CC(C)C)c3ccccn3)[nH]c2c1 ZINC000483870060 1048873779 /nfs/dbraw/zinc/87/37/79/1048873779.db2.gz QJODRVWLUUEDFM-QGZVFWFLSA-N 1 2 308.429 4.143 20 0 DIADLO CSc1cc(Nc2cccc(C(=O)C(F)(F)F)c2)cc[nH+]1 ZINC001203340686 1048876017 /nfs/dbraw/zinc/87/60/17/1048876017.db2.gz HWTSJXVHHQKIDV-UHFFFAOYSA-N 1 2 312.316 4.292 20 0 DIADLO CNc1ccc(Nc2cc[nH+]c3cc(Cl)ccc23)c(F)n1 ZINC001203354196 1048879529 /nfs/dbraw/zinc/87/95/29/1048879529.db2.gz LJFHAJYFISEBSI-UHFFFAOYSA-N 1 2 302.740 4.208 20 0 DIADLO C[C@]1(c2ccc(Cl)cc2)C[N@H+](Cc2ccccc2F)CCO1 ZINC001203353477 1048880238 /nfs/dbraw/zinc/88/02/38/1048880238.db2.gz INCHHQJAUMSMJP-GOSISDBHSA-N 1 2 319.807 4.227 20 0 DIADLO C[C@]1(c2ccc(Cl)cc2)C[N@@H+](Cc2ccccc2F)CCO1 ZINC001203353477 1048880262 /nfs/dbraw/zinc/88/02/62/1048880262.db2.gz INCHHQJAUMSMJP-GOSISDBHSA-N 1 2 319.807 4.227 20 0 DIADLO Cc1cccc2[nH]c(CNc3ccc(-n4cc[nH+]c4)cc3)cc21 ZINC001177387705 1048881404 /nfs/dbraw/zinc/88/14/04/1048881404.db2.gz YJQCQBMDUUXYBF-UHFFFAOYSA-N 1 2 302.381 4.274 20 0 DIADLO Cc1ccc(Nc2cc(Cl)cc(Br)n2)c(C)[nH+]1 ZINC001203369249 1048883236 /nfs/dbraw/zinc/88/32/36/1048883236.db2.gz MSORPTMDSBPSBC-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO COc1ccc(Br)cc1Nc1ccc(C)[nH+]c1C ZINC001203373175 1048885408 /nfs/dbraw/zinc/88/54/08/1048885408.db2.gz INXJHTPEKLBGHD-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO CC[C@@H](C)C[N@H+](C)Cn1nc(-c2cccs2)n(CC)c1=S ZINC000111165613 1048887345 /nfs/dbraw/zinc/88/73/45/1048887345.db2.gz FAPKIOYKJYGHKV-GFCCVEGCSA-N 1 2 324.519 4.098 20 0 DIADLO CC[C@@H](C)C[N@@H+](C)Cn1nc(-c2cccs2)n(CC)c1=S ZINC000111165613 1048887365 /nfs/dbraw/zinc/88/73/65/1048887365.db2.gz FAPKIOYKJYGHKV-GFCCVEGCSA-N 1 2 324.519 4.098 20 0 DIADLO Cc1ccc(Nc2ccnc(Cl)c2OC(F)(F)F)c(C)[nH+]1 ZINC001203370476 1048888265 /nfs/dbraw/zinc/88/82/65/1048888265.db2.gz LZHHVYGNIFJZSW-UHFFFAOYSA-N 1 2 317.698 4.389 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1ncc(-c3ccccc3)o1)C2 ZINC000483986494 1048889440 /nfs/dbraw/zinc/88/94/40/1048889440.db2.gz MOUSDSRNIFXDHL-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1ncc(-c3ccccc3)o1)C2 ZINC000483986494 1048889460 /nfs/dbraw/zinc/88/94/60/1048889460.db2.gz MOUSDSRNIFXDHL-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO C[C@@H]1CSCC[N@@H+]1Cc1nc2c(s1)C(C)(C)CC(C)(C)C2 ZINC001191183550 1048892143 /nfs/dbraw/zinc/89/21/43/1048892143.db2.gz SBTSFEHYLGBXMS-GFCCVEGCSA-N 1 2 324.559 4.330 20 0 DIADLO C[C@@H]1CSCC[N@H+]1Cc1nc2c(s1)C(C)(C)CC(C)(C)C2 ZINC001191183550 1048892157 /nfs/dbraw/zinc/89/21/57/1048892157.db2.gz SBTSFEHYLGBXMS-GFCCVEGCSA-N 1 2 324.559 4.330 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccccn1 ZINC000775444377 1048904102 /nfs/dbraw/zinc/90/41/02/1048904102.db2.gz ANNRALVVPKIJCI-INIZCTEOSA-N 1 2 313.426 4.285 20 0 DIADLO CNc1ccc(Nc2cnc3cc(C(F)(F)F)ccc3c2)c[nH+]1 ZINC001203453175 1048906354 /nfs/dbraw/zinc/90/63/54/1048906354.db2.gz XORRLMMJWHPFDB-UHFFFAOYSA-N 1 2 318.302 4.434 20 0 DIADLO Clc1ccc(/C=C/C[N@@H+]2CCOC[C@H]2c2ccccc2)cc1 ZINC001191243065 1048908985 /nfs/dbraw/zinc/90/89/85/1048908985.db2.gz BKBHWCVLPZMZOT-PXPVJAHISA-N 1 2 313.828 4.427 20 0 DIADLO Clc1ccc(/C=C/C[N@H+]2CCOC[C@H]2c2ccccc2)cc1 ZINC001191243065 1048909005 /nfs/dbraw/zinc/90/90/05/1048909005.db2.gz BKBHWCVLPZMZOT-PXPVJAHISA-N 1 2 313.828 4.427 20 0 DIADLO COc1cc(C[N@@H+]2CCC23CCCC3)c(F)c(F)c1Cl ZINC001249788351 1048909757 /nfs/dbraw/zinc/90/97/57/1048909757.db2.gz PGXQBUPCZOVISM-UHFFFAOYSA-N 1 2 301.764 4.145 20 0 DIADLO COc1cc(C[N@H+]2CCC23CCCC3)c(F)c(F)c1Cl ZINC001249788351 1048909765 /nfs/dbraw/zinc/90/97/65/1048909765.db2.gz PGXQBUPCZOVISM-UHFFFAOYSA-N 1 2 301.764 4.145 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cc(C)ccc1OC ZINC001203464962 1048910467 /nfs/dbraw/zinc/91/04/67/1048910467.db2.gz SLDUWOCOJDBAEK-UHFFFAOYSA-N 1 2 302.443 4.264 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2cc3n(n2)CCCC3)o1 ZINC001191276916 1048913751 /nfs/dbraw/zinc/91/37/51/1048913751.db2.gz GTXCJHXMJOTPMI-KDOFPFPSSA-N 1 2 313.445 4.094 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2cc3n(n2)CCCC3)o1 ZINC001191276916 1048913765 /nfs/dbraw/zinc/91/37/65/1048913765.db2.gz GTXCJHXMJOTPMI-KDOFPFPSSA-N 1 2 313.445 4.094 20 0 DIADLO CC(C)n1cc(Nc2ccc(N(C)Cc3ccccc3)[nH+]c2)cn1 ZINC001203514139 1048917266 /nfs/dbraw/zinc/91/72/66/1048917266.db2.gz UEPRGCPFKXFXFG-UHFFFAOYSA-N 1 2 321.428 4.239 20 0 DIADLO COc1cc(C[N@@H+]2CCC3(CCC3)C2)c(F)c(F)c1Cl ZINC001249802699 1048926281 /nfs/dbraw/zinc/92/62/81/1048926281.db2.gz ZVWHSGPTLCDHFA-UHFFFAOYSA-N 1 2 301.764 4.003 20 0 DIADLO COc1cc(C[N@H+]2CCC3(CCC3)C2)c(F)c(F)c1Cl ZINC001249802699 1048926292 /nfs/dbraw/zinc/92/62/92/1048926292.db2.gz ZVWHSGPTLCDHFA-UHFFFAOYSA-N 1 2 301.764 4.003 20 0 DIADLO CC1(C)CCc2onc(C[NH2+]Cc3cc(F)cc(Cl)c3)c2C1 ZINC001203553676 1048926355 /nfs/dbraw/zinc/92/63/55/1048926355.db2.gz MGTDVVCVYDBVJF-UHFFFAOYSA-N 1 2 322.811 4.272 20 0 DIADLO CCC[C@@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)C(C)C ZINC000484339997 1048926954 /nfs/dbraw/zinc/92/69/54/1048926954.db2.gz YNVHJSQVZWVLQT-CQSZACIVSA-N 1 2 303.381 4.022 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@@H](C)c1cccc(O)c1)c1ccco1 ZINC000194876486 1048941585 /nfs/dbraw/zinc/94/15/85/1048941585.db2.gz BTQNBHNDQGLBIE-YOEHRIQHSA-N 1 2 303.402 4.050 20 0 DIADLO Cn1c2ccccc2[nH+]c1Nc1cccnc1-c1ccccc1 ZINC001203647315 1048947164 /nfs/dbraw/zinc/94/71/64/1048947164.db2.gz DAICIOJMYAXJNM-UHFFFAOYSA-N 1 2 300.365 4.379 20 0 DIADLO COc1ccc(Br)cc1Nc1cc(C)c[nH+]c1C ZINC001203660779 1048950964 /nfs/dbraw/zinc/95/09/64/1048950964.db2.gz LXBQNUZYIUANPJ-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cc(F)ccc2OC[C@H]2CCCO2)c1 ZINC001203663894 1048953659 /nfs/dbraw/zinc/95/36/59/1048953659.db2.gz YDRYCANUYBAYIP-OAHLLOKOSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2c(F)cccc2OC2CCOCC2)c1 ZINC001203667981 1048957707 /nfs/dbraw/zinc/95/77/07/1048957707.db2.gz SCEFNXIMFSTPDV-UHFFFAOYSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cc(Br)cc(F)c2O)c1 ZINC001203667551 1048957743 /nfs/dbraw/zinc/95/77/43/1048957743.db2.gz NSRRXMFNMBNHCA-UHFFFAOYSA-N 1 2 311.154 4.049 20 0 DIADLO CCOc1cncc(CNc2ccc3[nH+]c(C)cc(C)c3c2)c1 ZINC001203675823 1048958528 /nfs/dbraw/zinc/95/85/28/1048958528.db2.gz BTHNRRADLDWOEU-UHFFFAOYSA-N 1 2 307.397 4.257 20 0 DIADLO CCOC(=O)C1([N@H+](Cc2ccccc2)Cc2ccccc2C)CC1 ZINC001203712729 1048974034 /nfs/dbraw/zinc/97/40/34/1048974034.db2.gz LGNZTPVQCOZTCW-UHFFFAOYSA-N 1 2 323.436 4.093 20 0 DIADLO CCOC(=O)C1([N@@H+](Cc2ccccc2)Cc2ccccc2C)CC1 ZINC001203712729 1048974040 /nfs/dbraw/zinc/97/40/40/1048974040.db2.gz LGNZTPVQCOZTCW-UHFFFAOYSA-N 1 2 323.436 4.093 20 0 DIADLO CCC(CC)c1noc([C@H]([NH3+])c2ccccc2C(F)(F)F)n1 ZINC000904092501 1048974439 /nfs/dbraw/zinc/97/44/39/1048974439.db2.gz MIJUIUDJUZXGGF-GFCCVEGCSA-N 1 2 313.323 4.040 20 0 DIADLO FC(F)(F)c1cncc(Nc2ccc([NH+]3CCCCC3)cc2)n1 ZINC001203717713 1048975713 /nfs/dbraw/zinc/97/57/13/1048975713.db2.gz MIVJKGHDFJPHRB-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO COC(=O)c1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1 ZINC001203718657 1048975729 /nfs/dbraw/zinc/97/57/29/1048975729.db2.gz JMDPPMJDVDAPDH-UHFFFAOYSA-N 1 2 310.397 4.207 20 0 DIADLO OCc1cccc(Nc2ccc([NH+]3CCCCC3)cc2)c1F ZINC001203718873 1048976348 /nfs/dbraw/zinc/97/63/48/1048976348.db2.gz GFIWADNIPIXXNU-UHFFFAOYSA-N 1 2 300.377 4.052 20 0 DIADLO CCc1nc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cn2n1 ZINC001203718299 1048977387 /nfs/dbraw/zinc/97/73/87/1048977387.db2.gz ARVIBQQMEHYDRV-UHFFFAOYSA-N 1 2 321.428 4.026 20 0 DIADLO Oc1c(F)cc(Nc2ccc([NH+]3CCCCC3)cc2)cc1F ZINC001203719842 1048978495 /nfs/dbraw/zinc/97/84/95/1048978495.db2.gz VMDQAHVVHMGOTD-UHFFFAOYSA-N 1 2 304.340 4.404 20 0 DIADLO c1cc(Nc2ccc([NH+]3CCCCC3)cc2)n(CC2CCC2)n1 ZINC001203719679 1048978540 /nfs/dbraw/zinc/97/85/40/1048978540.db2.gz ZYXYAPPWLNJCFB-UHFFFAOYSA-N 1 2 310.445 4.417 20 0 DIADLO Cc1cn2c(cccc2NC(=O)Nc2cc(C)ccc2Cl)[nH+]1 ZINC001191665004 1048978842 /nfs/dbraw/zinc/97/88/42/1048978842.db2.gz HKYGCKUADAHCOE-UHFFFAOYSA-N 1 2 314.776 4.249 20 0 DIADLO c1cc(OC2COC2)ccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203719566 1048979343 /nfs/dbraw/zinc/97/93/43/1048979343.db2.gz PXNWPDGKFMAGIP-UHFFFAOYSA-N 1 2 324.424 4.198 20 0 DIADLO COCOc1cccc(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001203723824 1048979543 /nfs/dbraw/zinc/97/95/43/1048979543.db2.gz ADPBTLLQMYYIJP-UHFFFAOYSA-N 1 2 312.413 4.403 20 0 DIADLO CC[C@H]1C[C@@H](CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)CCO1 ZINC001178068667 1048979764 /nfs/dbraw/zinc/97/97/64/1048979764.db2.gz SZPOBEGYCIFBIJ-ZFWWWQNUSA-N 1 2 319.836 4.143 20 0 DIADLO O=c1[nH]oc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc21 ZINC001203724203 1048979832 /nfs/dbraw/zinc/97/98/32/1048979832.db2.gz IROKBZUJMLUPGJ-UHFFFAOYSA-N 1 2 309.369 4.267 20 0 DIADLO c1cc(Nc2ccc([NH+]3CCCCC3)cc2)cc2snnc12 ZINC001203724390 1048981851 /nfs/dbraw/zinc/98/18/51/1048981851.db2.gz LYRPVFUEJJRZGY-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO Oc1c(F)c(F)ccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203724388 1048982226 /nfs/dbraw/zinc/98/22/26/1048982226.db2.gz LSEQOFKNUYVVMI-UHFFFAOYSA-N 1 2 304.340 4.404 20 0 DIADLO CC(=O)c1cccc(O)c1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203724601 1048982577 /nfs/dbraw/zinc/98/25/77/1048982577.db2.gz RYWUWGXAZJPJIM-UHFFFAOYSA-N 1 2 310.397 4.329 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1cccc(Br)c1)C2 ZINC001203767496 1048994147 /nfs/dbraw/zinc/99/41/47/1048994147.db2.gz VWUWOYPGBKGLGI-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1cccc(Br)c1)C2 ZINC001203767496 1048994152 /nfs/dbraw/zinc/99/41/52/1048994152.db2.gz VWUWOYPGBKGLGI-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO CCn1ccnc1C[NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C ZINC001178180643 1048994304 /nfs/dbraw/zinc/99/43/04/1048994304.db2.gz BROFRRCYJRBSEL-MRXNPFEDSA-N 1 2 307.388 4.058 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1cccc(F)c1Br ZINC000158020554 1048996862 /nfs/dbraw/zinc/99/68/62/1048996862.db2.gz QVJNUELWCPFQRC-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1cccc(F)c1Br ZINC000158020554 1048996866 /nfs/dbraw/zinc/99/68/66/1048996866.db2.gz QVJNUELWCPFQRC-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO Fc1ccc(CNc2cccc(-n3cc[nH+]c3)c2)cc1Cl ZINC000163773013 1049002303 /nfs/dbraw/zinc/00/23/03/1049002303.db2.gz BZEOGKSDAMBYGG-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO Oc1ccc2c(c1)CC[N@@H+](Cc1cc(Cl)cc(Cl)c1)C2 ZINC001203808182 1049003702 /nfs/dbraw/zinc/00/37/02/1049003702.db2.gz IUPWIFQLAJNREN-UHFFFAOYSA-N 1 2 308.208 4.257 20 0 DIADLO Oc1ccc2c(c1)CC[N@H+](Cc1cc(Cl)cc(Cl)c1)C2 ZINC001203808182 1049003706 /nfs/dbraw/zinc/00/37/06/1049003706.db2.gz IUPWIFQLAJNREN-UHFFFAOYSA-N 1 2 308.208 4.257 20 0 DIADLO O=C(NC1CCC(c2ccccc2)CC1)c1cc2c[nH+]ccc2[nH]1 ZINC001151975539 1049005536 /nfs/dbraw/zinc/00/55/36/1049005536.db2.gz BRNHDOCONCVQCA-UHFFFAOYSA-N 1 2 319.408 4.019 20 0 DIADLO COc1cc(C)[nH+]c(CN2CC3(CCCC3)c3ccccc32)c1 ZINC001191822021 1049005985 /nfs/dbraw/zinc/00/59/85/1049005985.db2.gz RZDVAGWKXNSYMA-UHFFFAOYSA-N 1 2 308.425 4.231 20 0 DIADLO COc1nscc1C[N@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC001191821439 1049006497 /nfs/dbraw/zinc/00/64/97/1049006497.db2.gz NETFYPHYXBPGSP-UHFFFAOYSA-N 1 2 320.845 4.094 20 0 DIADLO COc1nscc1C[N@@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC001191821439 1049006504 /nfs/dbraw/zinc/00/65/04/1049006504.db2.gz NETFYPHYXBPGSP-UHFFFAOYSA-N 1 2 320.845 4.094 20 0 DIADLO C[C@@]1(F)CCCC[N@H+](Cc2ccc(Br)cc2)C1 ZINC001203908611 1049027210 /nfs/dbraw/zinc/02/72/10/1049027210.db2.gz FCOZVCUOXGQFLD-CQSZACIVSA-N 1 2 300.215 4.163 20 0 DIADLO C[C@@]1(F)CCCC[N@@H+](Cc2ccc(Br)cc2)C1 ZINC001203908611 1049027219 /nfs/dbraw/zinc/02/72/19/1049027219.db2.gz FCOZVCUOXGQFLD-CQSZACIVSA-N 1 2 300.215 4.163 20 0 DIADLO Cc1ccc(Br)c(NCc2cc(C)[nH+]c(C)c2)c1 ZINC001178417224 1049037731 /nfs/dbraw/zinc/03/77/31/1049037731.db2.gz MRMWKQBBIBOLFC-UHFFFAOYSA-N 1 2 305.219 4.381 20 0 DIADLO Fc1cc(Br)cc2c1CC[N@H+]([C@@H]1C=CCCC1)C2 ZINC001192183109 1049058208 /nfs/dbraw/zinc/05/82/08/1049058208.db2.gz FDAUGGWXCBPHMS-CYBMUJFWSA-N 1 2 310.210 4.055 20 0 DIADLO COC(=O)c1cccc2c1C[N@H+](Cc1cccc3ccccc31)C2 ZINC001203981629 1049047995 /nfs/dbraw/zinc/04/79/95/1049047995.db2.gz DNFYZJVHAGRLCD-UHFFFAOYSA-N 1 2 317.388 4.142 20 0 DIADLO COC(=O)c1cccc2c1C[N@@H+](Cc1cccc3ccccc31)C2 ZINC001203981629 1049048007 /nfs/dbraw/zinc/04/80/07/1049048007.db2.gz DNFYZJVHAGRLCD-UHFFFAOYSA-N 1 2 317.388 4.142 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@@H+]1CCC[C@@H](CC(C)C)C1 ZINC001192197926 1049051820 /nfs/dbraw/zinc/05/18/20/1049051820.db2.gz HRYANOUCKNXONK-YOEHRIQHSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[N@H+]1CCC[C@@H](CC(C)C)C1 ZINC001192197926 1049051834 /nfs/dbraw/zinc/05/18/34/1049051834.db2.gz HRYANOUCKNXONK-YOEHRIQHSA-N 1 2 323.864 4.312 20 0 DIADLO Fc1cc(Br)cc2c1CC[N@@H+]([C@@H]1C=CCCC1)C2 ZINC001192183109 1049058193 /nfs/dbraw/zinc/05/81/93/1049058193.db2.gz FDAUGGWXCBPHMS-CYBMUJFWSA-N 1 2 310.210 4.055 20 0 DIADLO Brc1ccc2c(c1)CC[N@@H+](Cc1cccs1)C2 ZINC001204013926 1049062279 /nfs/dbraw/zinc/06/22/79/1049062279.db2.gz AOXDVSAUNAGUKR-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1ccc2c(c1)CC[N@H+](Cc1cccs1)C2 ZINC001204013926 1049062295 /nfs/dbraw/zinc/06/22/95/1049062295.db2.gz AOXDVSAUNAGUKR-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO FC(F)(F)c1ccccc1OC1C[NH+](Cc2cccs2)C1 ZINC001204015099 1049064231 /nfs/dbraw/zinc/06/42/31/1049064231.db2.gz GRIKIDGKBPSVEH-UHFFFAOYSA-N 1 2 313.344 4.030 20 0 DIADLO Cc1ccc2[nH+]cc(CNC(=O)Nc3ccccc3C(C)C)n2c1 ZINC001192261273 1049069865 /nfs/dbraw/zinc/06/98/65/1049069865.db2.gz MKBXFQSQGDZBFE-UHFFFAOYSA-N 1 2 322.412 4.088 20 0 DIADLO CC(C)c1ccccc1NC(=O)NCc1c[nH+]cn1C1CCC1 ZINC001192279299 1049074087 /nfs/dbraw/zinc/07/40/87/1049074087.db2.gz YJKBVTBUQVEFMW-UHFFFAOYSA-N 1 2 312.417 4.053 20 0 DIADLO Cc1cc(C[NH+]2CCN(c3ccc(F)cc3Cl)CC2)cs1 ZINC001192314512 1049074819 /nfs/dbraw/zinc/07/48/19/1049074819.db2.gz IAZBKSIFXLBOBS-UHFFFAOYSA-N 1 2 324.852 4.171 20 0 DIADLO C[N@@H+]1CCCC[C@H]1C(=O)Nc1ccccc1SC(C)(C)C ZINC001178697817 1049076540 /nfs/dbraw/zinc/07/65/40/1049076540.db2.gz OOHNTXRMKMJFLW-AWEZNQCLSA-N 1 2 306.475 4.000 20 0 DIADLO C[N@H+]1CCCC[C@H]1C(=O)Nc1ccccc1SC(C)(C)C ZINC001178697817 1049076554 /nfs/dbraw/zinc/07/65/54/1049076554.db2.gz OOHNTXRMKMJFLW-AWEZNQCLSA-N 1 2 306.475 4.000 20 0 DIADLO CC(C)c1ncc(CNc2[nH+]c3cc(Cl)ccc3n2C)s1 ZINC001204078666 1049080197 /nfs/dbraw/zinc/08/01/97/1049080197.db2.gz CYLMCEGPTZOKDZ-UHFFFAOYSA-N 1 2 320.849 4.419 20 0 DIADLO O=C(Nc1ccc2sccc2c1)Nc1ccc2[nH+]ccn2c1 ZINC001192422818 1049093373 /nfs/dbraw/zinc/09/33/73/1049093373.db2.gz IGQIJFLXWZEREL-UHFFFAOYSA-N 1 2 308.366 4.193 20 0 DIADLO O=C(Nc1ccc2sccc2c1)Nc1cccc2[nH+]ccn21 ZINC001192417956 1049093716 /nfs/dbraw/zinc/09/37/16/1049093716.db2.gz JKLJVDSRUUTPAR-UHFFFAOYSA-N 1 2 308.366 4.193 20 0 DIADLO Clc1ccccc1-c1ccc(C[NH2+][C@@H]2CCn3ccnc32)o1 ZINC001178778622 1049095091 /nfs/dbraw/zinc/09/50/91/1049095091.db2.gz RMQRBIAIWXIORG-OAHLLOKOSA-N 1 2 313.788 4.031 20 0 DIADLO Cc1c[nH+]c2cc(-c3nc(-c4ccccc4Cl)no3)ccn12 ZINC000904568903 1049099429 /nfs/dbraw/zinc/09/94/29/1049099429.db2.gz HZFJMQYPIGKKSZ-UHFFFAOYSA-N 1 2 310.744 4.013 20 0 DIADLO FC(F)(F)c1ccc(C[NH+]2CC(OCc3ccccc3)C2)cc1 ZINC001204164750 1049102643 /nfs/dbraw/zinc/10/26/43/1049102643.db2.gz WCYLVQACWGUFQJ-UHFFFAOYSA-N 1 2 321.342 4.106 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC001192546110 1049118495 /nfs/dbraw/zinc/11/84/95/1049118495.db2.gz KMHYRGVBLVERIJ-GYSYKLTISA-N 1 2 300.215 4.190 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC001192546110 1049118498 /nfs/dbraw/zinc/11/84/98/1049118498.db2.gz KMHYRGVBLVERIJ-GYSYKLTISA-N 1 2 300.215 4.190 20 0 DIADLO Fc1ccc2ccc(CNc3cc4cc[nH]c4c[nH+]3)nc2c1F ZINC001179044904 1049124104 /nfs/dbraw/zinc/12/41/04/1049124104.db2.gz TZAUOTGGKXOAGE-UHFFFAOYSA-N 1 2 310.307 4.001 20 0 DIADLO COc1cccc(OC)c1C[N@H+](C)Cc1ccc(Cl)c(F)c1 ZINC001204325569 1049142480 /nfs/dbraw/zinc/14/24/80/1049142480.db2.gz ZGXQEBKMPTWSPL-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cccc(OC)c1C[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC001204325569 1049142486 /nfs/dbraw/zinc/14/24/86/1049142486.db2.gz ZGXQEBKMPTWSPL-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO CCCN(C)c1ccccc1NCc1ccc(-n2cc[nH+]c2)cc1 ZINC001179296090 1049151219 /nfs/dbraw/zinc/15/12/19/1049151219.db2.gz VUSYFWBZMHOEES-UHFFFAOYSA-N 1 2 320.440 4.331 20 0 DIADLO COc1ccc2c(c1)CC[N@@H+](Cc1ccc(F)cc1Cl)C2 ZINC001204435883 1049161716 /nfs/dbraw/zinc/16/17/16/1049161716.db2.gz ZNWAITYKWGZUSU-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc2c(c1)CC[N@H+](Cc1ccc(F)cc1Cl)C2 ZINC001204435883 1049161718 /nfs/dbraw/zinc/16/17/18/1049161718.db2.gz ZNWAITYKWGZUSU-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc(F)cc1Cl)CC2 ZINC001204435480 1049162259 /nfs/dbraw/zinc/16/22/59/1049162259.db2.gz ILFSABQPIDYDAN-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc(F)cc1Cl)CC2 ZINC001204435480 1049162265 /nfs/dbraw/zinc/16/22/65/1049162265.db2.gz ILFSABQPIDYDAN-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Fc1ccc(CC[N@@H+]2CCO[C@H](c3ccccc3Cl)C2)cc1 ZINC001204449720 1049163891 /nfs/dbraw/zinc/16/38/91/1049163891.db2.gz NIKPZIKTGWAJOM-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc(CC[N@H+]2CCO[C@H](c3ccccc3Cl)C2)cc1 ZINC001204449720 1049163898 /nfs/dbraw/zinc/16/38/98/1049163898.db2.gz NIKPZIKTGWAJOM-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Cc1ccc2[nH+]c(NCc3ccccc3N3CCCCC3)[nH]c2c1 ZINC001179442721 1049164426 /nfs/dbraw/zinc/16/44/26/1049164426.db2.gz GDBCZIYEXAGCEA-UHFFFAOYSA-N 1 2 320.440 4.474 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1ccc(OC(C)C)cc1)CC2 ZINC001204458251 1049166655 /nfs/dbraw/zinc/16/66/55/1049166655.db2.gz ZLSQFXCPYFUESK-UHFFFAOYSA-N 1 2 323.436 4.235 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccc(OC(C)C)cc1)CC2 ZINC001204458251 1049166660 /nfs/dbraw/zinc/16/66/60/1049166660.db2.gz ZLSQFXCPYFUESK-UHFFFAOYSA-N 1 2 323.436 4.235 20 0 DIADLO Cc1ncccc1C[N@@H+](C)Cc1c(F)cccc1C(F)(F)F ZINC001204464409 1049169015 /nfs/dbraw/zinc/16/90/15/1049169015.db2.gz GIOXUUQPHYENKK-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ncccc1C[N@H+](C)Cc1c(F)cccc1C(F)(F)F ZINC001204464409 1049169022 /nfs/dbraw/zinc/16/90/22/1049169022.db2.gz GIOXUUQPHYENKK-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO CC[C@@H]1C[C@H](CNc2[nH+]c3cc(Cl)ccc3n2CC)CCO1 ZINC001179484073 1049170134 /nfs/dbraw/zinc/17/01/34/1049170134.db2.gz AQAQCQKNZZPDAN-TZMCWYRMSA-N 1 2 321.852 4.327 20 0 DIADLO Cc1cc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)oc1C ZINC001204531704 1049183702 /nfs/dbraw/zinc/18/37/02/1049183702.db2.gz MAWVWPXBGOXCSX-FQEVSTJZSA-N 1 2 306.409 4.303 20 0 DIADLO Cc1cc(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)oc1C ZINC001204531704 1049183708 /nfs/dbraw/zinc/18/37/08/1049183708.db2.gz MAWVWPXBGOXCSX-FQEVSTJZSA-N 1 2 306.409 4.303 20 0 DIADLO Fc1ccc(Br)c2c1C[N@@H+]([C@H]1C=CCCC1)CC2 ZINC001193187719 1049190040 /nfs/dbraw/zinc/19/00/40/1049190040.db2.gz GCMFQVYAGMOKRX-NSHDSACASA-N 1 2 310.210 4.055 20 0 DIADLO Fc1ccc(Br)c2c1C[N@H+]([C@H]1C=CCCC1)CC2 ZINC001193187719 1049190045 /nfs/dbraw/zinc/19/00/45/1049190045.db2.gz GCMFQVYAGMOKRX-NSHDSACASA-N 1 2 310.210 4.055 20 0 DIADLO Fc1cc(Br)ccc1C[NH+]1CC(c2ccccc2)C1 ZINC001204553756 1049190090 /nfs/dbraw/zinc/19/00/90/1049190090.db2.gz DCDAMCXQMAULOG-UHFFFAOYSA-N 1 2 320.205 4.188 20 0 DIADLO FC(F)C[N@@H+](Cc1ccccc1)C[C@@H]1CCOc2ccccc21 ZINC001204581174 1049194334 /nfs/dbraw/zinc/19/43/34/1049194334.db2.gz SOMAUOHFQWUDSJ-INIZCTEOSA-N 1 2 317.379 4.320 20 0 DIADLO FC(F)C[N@H+](Cc1ccccc1)C[C@@H]1CCOc2ccccc21 ZINC001204581174 1049194341 /nfs/dbraw/zinc/19/43/41/1049194341.db2.gz SOMAUOHFQWUDSJ-INIZCTEOSA-N 1 2 317.379 4.320 20 0 DIADLO COCOc1cc(C)c(-c2ccc(-c3[nH]cc[nH+]3)cc2)c(C)c1 ZINC001204604584 1049198768 /nfs/dbraw/zinc/19/87/68/1049198768.db2.gz FALKBGYAJHGRGQ-UHFFFAOYSA-N 1 2 308.381 4.343 20 0 DIADLO CC[N@H+](Cc1ncsc1Br)[C@H]1CCCC[C@H]1C ZINC001193412825 1049210202 /nfs/dbraw/zinc/21/02/02/1049210202.db2.gz HWPWIOUEKHLGJV-PWSUYJOCSA-N 1 2 317.296 4.306 20 0 DIADLO CC[N@@H+](Cc1ncsc1Br)[C@H]1CCCC[C@H]1C ZINC001193412825 1049210208 /nfs/dbraw/zinc/21/02/08/1049210208.db2.gz HWPWIOUEKHLGJV-PWSUYJOCSA-N 1 2 317.296 4.306 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@@H]1CCc2ccc(Cl)nc21 ZINC000857912179 1049211268 /nfs/dbraw/zinc/21/12/68/1049211268.db2.gz ZHTRUPYWUSGYPH-CYBMUJFWSA-N 1 2 323.223 4.174 20 0 DIADLO CC(C)[C@@H]1CCC[C@@H](NC(=O)Nc2ccn3cc[nH+]c3c2)CC1 ZINC001204648834 1049212241 /nfs/dbraw/zinc/21/22/41/1049212241.db2.gz MSFBBEIJXBIUJW-HUUCEWRRSA-N 1 2 314.433 4.061 20 0 DIADLO CCC(C)(C)C1CCC(CC(=O)N[C@H]2CCn3c[nH+]cc32)CC1 ZINC000857979267 1049213030 /nfs/dbraw/zinc/21/30/30/1049213030.db2.gz VILVSGFGWLBBFZ-GPANFISMSA-N 1 2 317.477 4.077 20 0 DIADLO Cc1cn2c(cccc2-c2c(F)ccc(OC(C)C)c2F)[nH+]1 ZINC001204656171 1049213768 /nfs/dbraw/zinc/21/37/68/1049213768.db2.gz RAWPBWPVGWSYRY-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Cc1cc(-c2c(F)ccc(OC(C)C)c2F)cn2cc[nH+]c12 ZINC001204662376 1049216839 /nfs/dbraw/zinc/21/68/39/1049216839.db2.gz LGNVHPGHNMDKHC-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](CC[C@@H]3C[C@H]3C3CC3)CCO2)c(Cl)c1 ZINC001193546042 1049219046 /nfs/dbraw/zinc/21/90/46/1049219046.db2.gz MWEKPPNEHOPAIC-RPVQJOFSSA-N 1 2 323.839 4.289 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](CC[C@@H]3C[C@H]3C3CC3)CCO2)c(Cl)c1 ZINC001193546042 1049219053 /nfs/dbraw/zinc/21/90/53/1049219053.db2.gz MWEKPPNEHOPAIC-RPVQJOFSSA-N 1 2 323.839 4.289 20 0 DIADLO Fc1cc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)ccn1 ZINC000858150087 1049222224 /nfs/dbraw/zinc/22/22/24/1049222224.db2.gz HCUGANCTHBFXOH-UHFFFAOYSA-N 1 2 311.187 4.306 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2ccsc2C(F)(F)F)s1 ZINC000858149402 1049222513 /nfs/dbraw/zinc/22/25/13/1049222513.db2.gz JIYSJKPDKKNRKK-UHFFFAOYSA-N 1 2 321.393 4.032 20 0 DIADLO Cc1cc([C@H]2CCCN2c2cccc[nH+]2)ccc1Br ZINC000485402647 1049237165 /nfs/dbraw/zinc/23/71/65/1049237165.db2.gz HPZMHWFJKNCAKU-OAHLLOKOSA-N 1 2 317.230 4.494 20 0 DIADLO O=C1CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC001204724317 1049242228 /nfs/dbraw/zinc/24/22/28/1049242228.db2.gz HAQPCICZLWWQRH-UHFFFAOYSA-N 1 2 303.789 4.155 20 0 DIADLO O=C1CCC[N@H+](Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC001204724317 1049242234 /nfs/dbraw/zinc/24/22/34/1049242234.db2.gz HAQPCICZLWWQRH-UHFFFAOYSA-N 1 2 303.789 4.155 20 0 DIADLO Fc1cccc(F)c1C1([NH2+]Cc2cccnc2Cl)CCC1 ZINC000858341691 1049245411 /nfs/dbraw/zinc/24/54/11/1049245411.db2.gz HHJQIBFBDNZLKZ-UHFFFAOYSA-N 1 2 308.759 4.182 20 0 DIADLO CSCCCCCCC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000858385440 1049250463 /nfs/dbraw/zinc/25/04/63/1049250463.db2.gz SRWDABZMQBGIBM-UHFFFAOYSA-N 1 2 317.458 4.124 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1cc(-c2ccccc2)n(C)n1 ZINC000858397501 1049252614 /nfs/dbraw/zinc/25/26/14/1049252614.db2.gz LUIOUYJQJFNNAM-HNNXBMFYSA-N 1 2 320.440 4.326 20 0 DIADLO Oc1ccc(F)c(C[NH+]2CCC(c3ccccc3F)CC2)c1F ZINC001180018653 1049258398 /nfs/dbraw/zinc/25/83/98/1049258398.db2.gz PWXNNPUUAZLDPE-UHFFFAOYSA-N 1 2 321.342 4.189 20 0 DIADLO Cc1cc(Oc2ccc(NC(=O)OCC(C)C)cc2)cc[nH+]1 ZINC001193841536 1049262356 /nfs/dbraw/zinc/26/23/56/1049262356.db2.gz ZMPHGHZNHHAQMF-UHFFFAOYSA-N 1 2 300.358 4.387 20 0 DIADLO CCC[N@H+](Cc1nn(C)cc1Cl)[C@H](CC)c1ccccc1 ZINC001204803358 1049270202 /nfs/dbraw/zinc/27/02/02/1049270202.db2.gz MCWAZHKTIDYSQK-QGZVFWFLSA-N 1 2 305.853 4.437 20 0 DIADLO CCC[N@@H+](Cc1nn(C)cc1Cl)[C@H](CC)c1ccccc1 ZINC001204803358 1049270215 /nfs/dbraw/zinc/27/02/15/1049270215.db2.gz MCWAZHKTIDYSQK-QGZVFWFLSA-N 1 2 305.853 4.437 20 0 DIADLO Cc1cccn2c(CNc3ccc(C)c4ncccc34)c[nH+]c12 ZINC000158846939 1049274236 /nfs/dbraw/zinc/27/42/36/1049274236.db2.gz ZEIITBJCWYJNEI-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cc(Cl)c(OC)c(Cl)c1 ZINC001204836116 1049279636 /nfs/dbraw/zinc/27/96/36/1049279636.db2.gz GXTAYJCUUADCJF-UHFFFAOYSA-N 1 2 323.179 4.325 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2ccc(F)c(C(F)(F)F)c2)[C@@H]1C ZINC001180199058 1049316525 /nfs/dbraw/zinc/31/65/25/1049316525.db2.gz OSHFLXMWDRSJEB-NXEZZACHSA-N 1 2 307.356 4.170 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2ccc(CSC)cc2)cs1 ZINC001204852196 1049287267 /nfs/dbraw/zinc/28/72/67/1049287267.db2.gz XMIGHJFBDUQDPC-UHFFFAOYSA-N 1 2 306.500 4.201 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2ccc(CSC)cc2)cs1 ZINC001204852196 1049287276 /nfs/dbraw/zinc/28/72/76/1049287276.db2.gz XMIGHJFBDUQDPC-UHFFFAOYSA-N 1 2 306.500 4.201 20 0 DIADLO Cc1cc(C[NH+]2CCC(=Cc3ccccc3F)CC2)cnc1F ZINC001180108826 1049290283 /nfs/dbraw/zinc/29/02/83/1049290283.db2.gz XTLXFHUEMNBWGI-UHFFFAOYSA-N 1 2 314.379 4.348 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1CC=C(c2ccc(C)cc2)CC1 ZINC001180178169 1049294408 /nfs/dbraw/zinc/29/44/08/1049294408.db2.gz RRPXISGTSHSMIA-UHFFFAOYSA-N 1 2 315.848 4.154 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1CC=C(c2ccc(C)cc2)CC1 ZINC001180178169 1049294421 /nfs/dbraw/zinc/29/44/21/1049294421.db2.gz RRPXISGTSHSMIA-UHFFFAOYSA-N 1 2 315.848 4.154 20 0 DIADLO C[N@H+](Cc1nccs1)Cc1cccc(COc2ccccc2)c1 ZINC001180149497 1049299840 /nfs/dbraw/zinc/29/98/40/1049299840.db2.gz YKBXOMSPPKIEGN-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO C[N@@H+](Cc1nccs1)Cc1cccc(COc2ccccc2)c1 ZINC001180149497 1049299853 /nfs/dbraw/zinc/29/98/53/1049299853.db2.gz YKBXOMSPPKIEGN-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO CN(C)c1cccc([C@@H]2CCC[N@@H+]2Cc2nc(Cl)cs2)c1 ZINC001180203398 1049306589 /nfs/dbraw/zinc/30/65/89/1049306589.db2.gz QZHQCHHNUKLGDN-AWEZNQCLSA-N 1 2 321.877 4.200 20 0 DIADLO CN(C)c1cccc([C@@H]2CCC[N@H+]2Cc2nc(Cl)cs2)c1 ZINC001180203398 1049306592 /nfs/dbraw/zinc/30/65/92/1049306592.db2.gz QZHQCHHNUKLGDN-AWEZNQCLSA-N 1 2 321.877 4.200 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2ccc(F)c(C(F)(F)F)c2)[C@@H]1C ZINC001180199058 1049316510 /nfs/dbraw/zinc/31/65/10/1049316510.db2.gz OSHFLXMWDRSJEB-NXEZZACHSA-N 1 2 307.356 4.170 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c(F)c1 ZINC001204941188 1049317719 /nfs/dbraw/zinc/31/77/19/1049317719.db2.gz FMYRKIUZAPBUCN-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)c(F)c1 ZINC001204941188 1049317726 /nfs/dbraw/zinc/31/77/26/1049317726.db2.gz FMYRKIUZAPBUCN-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cc(Cl)ccc1C[NH2+]Cc1cc(COC(C)(C)C)on1 ZINC000485710935 1049319784 /nfs/dbraw/zinc/31/97/84/1049319784.db2.gz IBQLKHGZAGIWGE-UHFFFAOYSA-N 1 2 322.836 4.241 20 0 DIADLO COc1ccc(-c2ccc(Nc3ccn4cc[nH+]c4c3)cn2)cc1 ZINC001204951407 1049319851 /nfs/dbraw/zinc/31/98/51/1049319851.db2.gz RAMIVRGBFKCRGN-UHFFFAOYSA-N 1 2 316.364 4.149 20 0 DIADLO Fc1cc(Br)cc(F)c1Nc1ccn2cc[nH+]c2c1 ZINC001204977375 1049328023 /nfs/dbraw/zinc/32/80/23/1049328023.db2.gz FVSFJEUYJUZADS-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Nc1ccccc1N(c1ccccc1)c1ccn2cc[nH+]c2c1 ZINC001204977690 1049328334 /nfs/dbraw/zinc/32/83/34/1049328334.db2.gz JIGCAHPZJOMGTE-UHFFFAOYSA-N 1 2 300.365 4.386 20 0 DIADLO Oc1ccc(-c2ccc(Nc3ccn4cc[nH+]c4c3)cc2)cc1 ZINC001204983047 1049330568 /nfs/dbraw/zinc/33/05/68/1049330568.db2.gz NHHQUPOTXNFDND-UHFFFAOYSA-N 1 2 301.349 4.451 20 0 DIADLO Nc1cccc(Cc2cccc(Nc3ccn4cc[nH+]c4c3)c2)c1 ZINC001204991243 1049332793 /nfs/dbraw/zinc/33/27/93/1049332793.db2.gz MUKOJZJBRILAFJ-UHFFFAOYSA-N 1 2 314.392 4.251 20 0 DIADLO CCOC(=O)c1coc2cc(Nc3ccn4cc[nH+]c4c3)ccc12 ZINC001204997645 1049336199 /nfs/dbraw/zinc/33/61/99/1049336199.db2.gz LTGNJOWSKXUNPV-UHFFFAOYSA-N 1 2 321.336 4.001 20 0 DIADLO CC[C@]([NH2+]C[C@H]1CCCCC1(C)C)(C(=O)OC)c1ccccc1 ZINC001194260544 1049351255 /nfs/dbraw/zinc/35/12/55/1049351255.db2.gz DQUDSKIHJJMVNX-YLJYHZDGSA-N 1 2 317.473 4.271 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@@H+](Cc1cc(-c3ccco3)on1)CC2 ZINC000485891737 1049360952 /nfs/dbraw/zinc/36/09/52/1049360952.db2.gz XEJIKBRYSRVYKR-UHFFFAOYSA-N 1 2 308.381 4.110 20 0 DIADLO Cc1cc(C)c2c(c1)C[N@H+](Cc1cc(-c3ccco3)on1)CC2 ZINC000485891737 1049360964 /nfs/dbraw/zinc/36/09/64/1049360964.db2.gz XEJIKBRYSRVYKR-UHFFFAOYSA-N 1 2 308.381 4.110 20 0 DIADLO CN(C)c1[nH+]cc(CN(c2ccccc2)C2CC2)c2ccccc21 ZINC001194369805 1049363159 /nfs/dbraw/zinc/36/31/59/1049363159.db2.gz YOLSUIWCDULJON-UHFFFAOYSA-N 1 2 317.436 4.470 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3ccns3)cs2)o1 ZINC000860053295 1049365900 /nfs/dbraw/zinc/36/59/00/1049365900.db2.gz UXIPRBKMMOZDNC-JTQLQIEISA-N 1 2 305.428 4.019 20 0 DIADLO CC(C)CC(C)(C)C(=O)N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000084621965 1049367941 /nfs/dbraw/zinc/36/79/41/1049367941.db2.gz OWFQGZNLFVFZJS-HNNXBMFYSA-N 1 2 313.445 4.122 20 0 DIADLO Clc1ccsc1CNc1ccc(N2CCCCC2)c[nH+]1 ZINC000485954058 1049371939 /nfs/dbraw/zinc/37/19/39/1049371939.db2.gz MEEOGRALOCTMBH-UHFFFAOYSA-N 1 2 307.850 4.399 20 0 DIADLO CCOc1cccc(F)c1C[N@H+](Cc1cccs1)C1CC1 ZINC001180558860 1049381664 /nfs/dbraw/zinc/38/16/64/1049381664.db2.gz XSNJEZRCLPNSRZ-UHFFFAOYSA-N 1 2 305.418 4.451 20 0 DIADLO CCOc1cccc(F)c1C[N@@H+](Cc1cccs1)C1CC1 ZINC001180558860 1049381681 /nfs/dbraw/zinc/38/16/81/1049381681.db2.gz XSNJEZRCLPNSRZ-UHFFFAOYSA-N 1 2 305.418 4.451 20 0 DIADLO CCCC[C@H]([NH2+][C@H](C)Cc1ccccc1SCC)C(=O)OC ZINC001180663922 1049396384 /nfs/dbraw/zinc/39/63/84/1049396384.db2.gz BBWMGNOVKTUTMA-ZBFHGGJFSA-N 1 2 323.502 4.051 20 0 DIADLO CCCC[C@@H]([NH2+][C@@H](C)Cc1ccccc1SCC)C(=O)OC ZINC001180663920 1049397237 /nfs/dbraw/zinc/39/72/37/1049397237.db2.gz BBWMGNOVKTUTMA-GOEBONIOSA-N 1 2 323.502 4.051 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+]1CC(C)(C)O[C@](C)(C(F)(F)F)C1 ZINC001194648043 1049402807 /nfs/dbraw/zinc/40/28/07/1049402807.db2.gz DOJKROJCEHSDDQ-NHYWBVRUSA-N 1 2 319.342 4.319 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+]1CC(C)(C)O[C@](C)(C(F)(F)F)C1 ZINC001194648043 1049402810 /nfs/dbraw/zinc/40/28/10/1049402810.db2.gz DOJKROJCEHSDDQ-NHYWBVRUSA-N 1 2 319.342 4.319 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)Oc1ccc2ccccc2c1 ZINC001194623407 1049406134 /nfs/dbraw/zinc/40/61/34/1049406134.db2.gz GYVIRIMCXNEOSK-UHFFFAOYSA-N 1 2 303.321 4.098 20 0 DIADLO Cc1oc2ccccc2c1C[NH2+][C@@H]1COc2cc(F)cc(F)c21 ZINC001180820635 1049406991 /nfs/dbraw/zinc/40/69/91/1049406991.db2.gz PRWQIEHCMFSJIC-OAHLLOKOSA-N 1 2 315.319 4.243 20 0 DIADLO C[N@H+](CCc1cccc(Br)c1)C/C(Cl)=C\Cl ZINC001194693003 1049414661 /nfs/dbraw/zinc/41/46/61/1049414661.db2.gz XBJZRSTVBROAQL-XYOKQWHBSA-N 1 2 323.061 4.242 20 0 DIADLO C[N@@H+](CCc1cccc(Br)c1)C/C(Cl)=C\Cl ZINC001194693003 1049414664 /nfs/dbraw/zinc/41/46/64/1049414664.db2.gz XBJZRSTVBROAQL-XYOKQWHBSA-N 1 2 323.061 4.242 20 0 DIADLO CC1(C)CCC[N@H+](Cc2c(F)cccc2OC(F)(F)F)C1 ZINC001180896982 1049421425 /nfs/dbraw/zinc/42/14/25/1049421425.db2.gz NXHBHKJVAWJBKZ-UHFFFAOYSA-N 1 2 305.315 4.346 20 0 DIADLO CC1(C)CCC[N@@H+](Cc2c(F)cccc2OC(F)(F)F)C1 ZINC001180896982 1049421428 /nfs/dbraw/zinc/42/14/28/1049421428.db2.gz NXHBHKJVAWJBKZ-UHFFFAOYSA-N 1 2 305.315 4.346 20 0 DIADLO CCCCC[C@H]([NH2+][C@H](C)Cc1ccccc1SC)C(=O)OC ZINC001180954126 1049422355 /nfs/dbraw/zinc/42/23/55/1049422355.db2.gz VKDCHMDEHOMGSF-ZBFHGGJFSA-N 1 2 323.502 4.051 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001194764532 1049427592 /nfs/dbraw/zinc/42/75/92/1049427592.db2.gz MFEIVBGKMCHYJO-OLZOCXBDSA-N 1 2 303.352 4.309 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001194764532 1049427596 /nfs/dbraw/zinc/42/75/96/1049427596.db2.gz MFEIVBGKMCHYJO-OLZOCXBDSA-N 1 2 303.352 4.309 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)[NH+]1CCC(C)CC1 ZINC000003538713 1049433363 /nfs/dbraw/zinc/43/33/63/1049433363.db2.gz YHZHFIRWQLDXOV-NSHDSACASA-N 1 2 315.244 4.052 20 0 DIADLO Cc1ccc2c(c1)O[C@@H](C)CN2Cc1cc(C)[nH+]c2c1CCCC2 ZINC001181072622 1049441506 /nfs/dbraw/zinc/44/15/06/1049441506.db2.gz JJTCGODWHPJVRX-INIZCTEOSA-N 1 2 322.452 4.365 20 0 DIADLO Cc1ccc([C@@]2(C)C[N@H+](Cc3sccc3Cl)CCO2)cc1 ZINC001205347108 1049444333 /nfs/dbraw/zinc/44/43/33/1049444333.db2.gz GGOBEDHECHFXDV-QGZVFWFLSA-N 1 2 321.873 4.458 20 0 DIADLO Cc1ccc([C@@]2(C)C[N@@H+](Cc3sccc3Cl)CCO2)cc1 ZINC001205347108 1049444338 /nfs/dbraw/zinc/44/43/38/1049444338.db2.gz GGOBEDHECHFXDV-QGZVFWFLSA-N 1 2 321.873 4.458 20 0 DIADLO C[C@H](CC(=O)O[C@H]1CCCc2ccc(Cl)cc21)n1cc[nH+]c1 ZINC000861404904 1049447176 /nfs/dbraw/zinc/44/71/76/1049447176.db2.gz FSSXFJXSYBCGTM-WBMJQRKESA-N 1 2 318.804 4.108 20 0 DIADLO CC(C)CCC[C@H](C)NC(=O)c1cccc(-c2c[nH+]cn2C)c1 ZINC001194916647 1049448130 /nfs/dbraw/zinc/44/81/30/1049448130.db2.gz DLSIKXWSHMRQFW-HNNXBMFYSA-N 1 2 313.445 4.032 20 0 DIADLO COCc1ccc(C[NH2+][C@H](c2nccs2)c2ccccc2)cc1 ZINC000339029717 1049453234 /nfs/dbraw/zinc/45/32/34/1049453234.db2.gz OXHMWYQAHQASPY-SFHVURJKSA-N 1 2 324.449 4.169 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC001194974862 1049459400 /nfs/dbraw/zinc/45/94/00/1049459400.db2.gz QNARCWOLMMIHMV-SJLPKXTDSA-N 1 2 315.457 4.336 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC001194974862 1049459405 /nfs/dbraw/zinc/45/94/05/1049459405.db2.gz QNARCWOLMMIHMV-SJLPKXTDSA-N 1 2 315.457 4.336 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cn(C)nc2C2CCCC2)c1 ZINC001181285964 1049459628 /nfs/dbraw/zinc/45/96/28/1049459628.db2.gz RPCKSSRASQPAAU-UHFFFAOYSA-N 1 2 315.436 4.157 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cn(C)nc2C2CCCC2)c1 ZINC001181285964 1049459634 /nfs/dbraw/zinc/45/96/34/1049459634.db2.gz RPCKSSRASQPAAU-UHFFFAOYSA-N 1 2 315.436 4.157 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2ccc(F)c(F)c2N(C)C)c1 ZINC001181276564 1049459694 /nfs/dbraw/zinc/45/96/94/1049459694.db2.gz OANQRTRWPGBONL-UHFFFAOYSA-N 1 2 322.374 4.110 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2ccc(F)c(F)c2N(C)C)c1 ZINC001181276564 1049459702 /nfs/dbraw/zinc/45/97/02/1049459702.db2.gz OANQRTRWPGBONL-UHFFFAOYSA-N 1 2 322.374 4.110 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1CNc1[nH+]cccc1OC(C)C ZINC001205430629 1049469651 /nfs/dbraw/zinc/46/96/51/1049469651.db2.gz CGZNLCHNWOWUDI-UHFFFAOYSA-N 1 2 316.449 4.049 20 0 DIADLO CC(C)C1(C[N@@H+]2CCO[C@H](c3ccc(F)cc3Cl)C2)CC1 ZINC001205447005 1049473411 /nfs/dbraw/zinc/47/34/11/1049473411.db2.gz XJIDCGYAJWLEEP-INIZCTEOSA-N 1 2 311.828 4.289 20 0 DIADLO CC(C)C1(C[N@H+]2CCO[C@H](c3ccc(F)cc3Cl)C2)CC1 ZINC001205447005 1049473413 /nfs/dbraw/zinc/47/34/13/1049473413.db2.gz XJIDCGYAJWLEEP-INIZCTEOSA-N 1 2 311.828 4.289 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)Cc1ccsc1C(F)(F)F ZINC000862226512 1049479615 /nfs/dbraw/zinc/47/96/15/1049479615.db2.gz HQKMMUXDPLECRL-UHFFFAOYSA-N 1 2 304.337 4.004 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)Cc1ccsc1C(F)(F)F ZINC000862226512 1049479619 /nfs/dbraw/zinc/47/96/19/1049479619.db2.gz HQKMMUXDPLECRL-UHFFFAOYSA-N 1 2 304.337 4.004 20 0 DIADLO CCOc1cccc([C@@H](C)Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC000777246939 1049484334 /nfs/dbraw/zinc/48/43/34/1049484334.db2.gz AIQZGFHYLTWDKR-OAHLLOKOSA-N 1 2 311.429 4.254 20 0 DIADLO CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1c(Cl)ncn1CC ZINC001181514277 1049486220 /nfs/dbraw/zinc/48/62/20/1049486220.db2.gz DAXGCJRNICWNMB-OAHLLOKOSA-N 1 2 321.852 4.148 20 0 DIADLO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1c(Cl)ncn1CC ZINC001181514277 1049486232 /nfs/dbraw/zinc/48/62/32/1049486232.db2.gz DAXGCJRNICWNMB-OAHLLOKOSA-N 1 2 321.852 4.148 20 0 DIADLO CCn1c[nH+]cc1CN1C[C@@H](c2ccccc2)c2ccccc21 ZINC001205568205 1049499053 /nfs/dbraw/zinc/49/90/53/1049499053.db2.gz GOZSDPRPNGWMRY-IBGZPJMESA-N 1 2 303.409 4.055 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2nc(-c3ccccc3)cs2)C[C@H](CC)O1 ZINC001195299185 1049513154 /nfs/dbraw/zinc/51/31/54/1049513154.db2.gz LYLOFGZMUKRXKH-IYBDPMFKSA-N 1 2 316.470 4.200 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2nc(-c3ccccc3)cs2)C[C@H](CC)O1 ZINC001195299185 1049513169 /nfs/dbraw/zinc/51/31/69/1049513169.db2.gz LYLOFGZMUKRXKH-IYBDPMFKSA-N 1 2 316.470 4.200 20 0 DIADLO CCNc1cc(CNC(=O)Nc2cccc(C3CCC3)c2)cc[nH+]1 ZINC001205741675 1049549084 /nfs/dbraw/zinc/54/90/84/1049549084.db2.gz AWVIVEXWVURQMN-UHFFFAOYSA-N 1 2 324.428 4.103 20 0 DIADLO Cc1ccc(Nc2ccc(NC(=O)OC(C)(C)C)nc2)c(C)[nH+]1 ZINC001203368953 1049551592 /nfs/dbraw/zinc/55/15/92/1049551592.db2.gz HWOSZOAFUQJBGZ-UHFFFAOYSA-N 1 2 314.389 4.184 20 0 DIADLO CCc1cc(Br)ncc1Nc1ccc(C)[nH+]c1C ZINC001203368956 1049551896 /nfs/dbraw/zinc/55/18/96/1049551896.db2.gz HZGKUUNLFNTMAV-UHFFFAOYSA-N 1 2 306.207 4.162 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(F)ccc2Cl)CC2(CCCCC2)O1 ZINC001195650559 1049554865 /nfs/dbraw/zinc/55/48/65/1049554865.db2.gz QAYJGDBQXHBPKK-CYBMUJFWSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2Cl)CC2(CCCCC2)O1 ZINC001195650559 1049554876 /nfs/dbraw/zinc/55/48/76/1049554876.db2.gz QAYJGDBQXHBPKK-CYBMUJFWSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@@H]1CC1(C)C ZINC000487547671 1049557054 /nfs/dbraw/zinc/55/70/54/1049557054.db2.gz ALNNULQGHGVKHU-YOEHRIQHSA-N 1 2 307.441 4.448 20 0 DIADLO CCn1cc(C[N@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)nn1 ZINC001205772327 1049559362 /nfs/dbraw/zinc/55/93/62/1049559362.db2.gz AHWMRCLVKUKOBD-AWEZNQCLSA-N 1 2 320.868 4.171 20 0 DIADLO CCn1cc(C[N@@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)nn1 ZINC001205772327 1049559372 /nfs/dbraw/zinc/55/93/72/1049559372.db2.gz AHWMRCLVKUKOBD-AWEZNQCLSA-N 1 2 320.868 4.171 20 0 DIADLO Cc1cc(C)cc(-c2noc([C@H]([NH3+])c3cccc(Cl)c3)n2)c1 ZINC001205806604 1049569656 /nfs/dbraw/zinc/56/96/56/1049569656.db2.gz NVNGUBZABGQEIN-OAHLLOKOSA-N 1 2 313.788 4.055 20 0 DIADLO FC(F)(F)c1cscc1C[N@@H+]1CCOCC12CCCCC2 ZINC001205811308 1049570596 /nfs/dbraw/zinc/57/05/96/1049570596.db2.gz BBSUIGIUAXUOBS-UHFFFAOYSA-N 1 2 319.392 4.302 20 0 DIADLO FC(F)(F)c1cscc1C[N@H+]1CCOCC12CCCCC2 ZINC001205811308 1049570607 /nfs/dbraw/zinc/57/06/07/1049570607.db2.gz BBSUIGIUAXUOBS-UHFFFAOYSA-N 1 2 319.392 4.302 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1csc(-c2ccco2)n1 ZINC000488056884 1049597588 /nfs/dbraw/zinc/59/75/88/1049597588.db2.gz VMOCAXQFXHUXDF-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1csc(-c2ccco2)n1 ZINC000488056884 1049597599 /nfs/dbraw/zinc/59/75/99/1049597599.db2.gz VMOCAXQFXHUXDF-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2[C@@H](C#N)c2ccccc2)ccc1F ZINC000093872499 1049606798 /nfs/dbraw/zinc/60/67/98/1049606798.db2.gz RLINYNVOGDQTRS-HKUYNNGSSA-N 1 2 324.399 4.106 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2[C@@H](C#N)c2ccccc2)ccc1F ZINC000093872499 1049606802 /nfs/dbraw/zinc/60/68/02/1049606802.db2.gz RLINYNVOGDQTRS-HKUYNNGSSA-N 1 2 324.399 4.106 20 0 DIADLO CC[N@H+](C/C=C/c1ccc(Cl)cc1)[C@H](C)C(=O)OC(C)(C)C ZINC001196058181 1049607736 /nfs/dbraw/zinc/60/77/36/1049607736.db2.gz YDUZNUVLYFZDQE-HSBSLETESA-N 1 2 323.864 4.405 20 0 DIADLO CC[N@@H+](C/C=C/c1ccc(Cl)cc1)[C@H](C)C(=O)OC(C)(C)C ZINC001196058181 1049607739 /nfs/dbraw/zinc/60/77/39/1049607739.db2.gz YDUZNUVLYFZDQE-HSBSLETESA-N 1 2 323.864 4.405 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc(C(C)(C)O)cc2)ccc1[NH+](C)C ZINC000863986468 1049608705 /nfs/dbraw/zinc/60/87/05/1049608705.db2.gz AITAYRCFROUDTB-HNNXBMFYSA-N 1 2 312.457 4.462 20 0 DIADLO CC(C)(CC1CC1)c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001205968416 1049613779 /nfs/dbraw/zinc/61/37/79/1049613779.db2.gz MHFJNRUFVHLCOH-UHFFFAOYSA-N 1 2 308.385 4.000 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCOC[C@H]2c2cccc(F)c2)c(C)c1 ZINC001196142776 1049617608 /nfs/dbraw/zinc/61/76/08/1049617608.db2.gz RMTFVJZEKHGCCN-FQEVSTJZSA-N 1 2 313.416 4.324 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCOC[C@H]2c2cccc(F)c2)c(C)c1 ZINC001196142776 1049617614 /nfs/dbraw/zinc/61/76/14/1049617614.db2.gz RMTFVJZEKHGCCN-FQEVSTJZSA-N 1 2 313.416 4.324 20 0 DIADLO Fc1cccc([C@H]2COCC[N@@H+]2CC[C@@H]2CCCC2(F)F)c1 ZINC001196142347 1049617956 /nfs/dbraw/zinc/61/79/56/1049617956.db2.gz JQKNCQXZALLILO-GOEBONIOSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1cccc([C@H]2COCC[N@H+]2CC[C@@H]2CCCC2(F)F)c1 ZINC001196142347 1049617960 /nfs/dbraw/zinc/61/79/60/1049617960.db2.gz JQKNCQXZALLILO-GOEBONIOSA-N 1 2 313.363 4.025 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccccc2N2CCCCC2)cc1 ZINC000864021648 1049626232 /nfs/dbraw/zinc/62/62/32/1049626232.db2.gz CMNBIXXDQQRMMN-UHFFFAOYSA-N 1 2 309.457 4.355 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3ccc(F)cc3[nH]2)[C@H](c2ccccc2)CO1 ZINC000488339759 1049637571 /nfs/dbraw/zinc/63/75/71/1049637571.db2.gz XOJBKPHIVKNGOW-VLIAUNLRSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3ccc(F)cc3[nH]2)[C@H](c2ccccc2)CO1 ZINC000488339759 1049637577 /nfs/dbraw/zinc/63/75/77/1049637577.db2.gz XOJBKPHIVKNGOW-VLIAUNLRSA-N 1 2 324.399 4.269 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)cc1)[C@H](C)c1nc(C(C)C)no1 ZINC000488348474 1049638971 /nfs/dbraw/zinc/63/89/71/1049638971.db2.gz WESGUZXNICWSFX-GFCCVEGCSA-N 1 2 307.825 4.430 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)cc1)[C@H](C)c1nc(C(C)C)no1 ZINC000488348474 1049638975 /nfs/dbraw/zinc/63/89/75/1049638975.db2.gz WESGUZXNICWSFX-GFCCVEGCSA-N 1 2 307.825 4.430 20 0 DIADLO COc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1cc(Cl)cs1)C2 ZINC001206069752 1049647074 /nfs/dbraw/zinc/64/70/74/1049647074.db2.gz PRCUTPRLPRNYGM-UHFFFAOYSA-N 1 2 319.857 4.458 20 0 DIADLO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1cc(Cl)cs1)C2 ZINC001206069752 1049647079 /nfs/dbraw/zinc/64/70/79/1049647079.db2.gz PRCUTPRLPRNYGM-UHFFFAOYSA-N 1 2 319.857 4.458 20 0 DIADLO COc1cc(Cl)c(NCc2[nH+]cc(C)c(OC)c2C)cc1C ZINC001206069542 1049647860 /nfs/dbraw/zinc/64/78/60/1049647860.db2.gz KYKVGJVUCYQMCD-UHFFFAOYSA-N 1 2 320.820 4.290 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCCc3occc3C2)cs1 ZINC001206077416 1049649035 /nfs/dbraw/zinc/64/90/35/1049649035.db2.gz JUWRVFRYHLRPIU-UHFFFAOYSA-N 1 2 301.333 4.308 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCCc3occc3C2)cs1 ZINC001206077416 1049649040 /nfs/dbraw/zinc/64/90/40/1049649040.db2.gz JUWRVFRYHLRPIU-UHFFFAOYSA-N 1 2 301.333 4.308 20 0 DIADLO Cc1cn2cc(NC(=S)Nc3cccc(C)c3C)ccc2[nH+]1 ZINC001196392750 1049649844 /nfs/dbraw/zinc/64/98/44/1049649844.db2.gz SKBGDJGTUCMZMT-UHFFFAOYSA-N 1 2 310.426 4.068 20 0 DIADLO FC1(F)CC(CNc2[nH+]cccc2OCc2ccccc2)C1 ZINC000488442716 1049651151 /nfs/dbraw/zinc/65/11/51/1049651151.db2.gz FQAPUAMSQSAFHJ-UHFFFAOYSA-N 1 2 304.340 4.118 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@H](c2ccccc2)[C@@H](O)c2ccccc2)o1 ZINC000794683102 1049655247 /nfs/dbraw/zinc/65/52/47/1049655247.db2.gz GUSNATFHGLKOEB-IPELMVKDSA-N 1 2 322.408 4.109 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2cc3ccccc3o2)[nH]1 ZINC000488469721 1049661500 /nfs/dbraw/zinc/66/15/00/1049661500.db2.gz ZMNJVVGCRJXJFM-AVGNSLFASA-N 1 2 312.417 4.476 20 0 DIADLO Clc1cncc(C[N@@H+]2CCSC[C@@H]2C2CCC2)c1Cl ZINC001182464151 1049666824 /nfs/dbraw/zinc/66/68/24/1049666824.db2.gz XLYMLQUFTMKMQX-CYBMUJFWSA-N 1 2 317.285 4.106 20 0 DIADLO Clc1cncc(C[N@H+]2CCSC[C@@H]2C2CCC2)c1Cl ZINC001182464151 1049666829 /nfs/dbraw/zinc/66/68/29/1049666829.db2.gz XLYMLQUFTMKMQX-CYBMUJFWSA-N 1 2 317.285 4.106 20 0 DIADLO Fc1ccc2c(c1)OCC[N@H+]([C@H]1CCc3cc(Cl)ccc31)C2 ZINC001196606357 1049675151 /nfs/dbraw/zinc/67/51/51/1049675151.db2.gz VIGMVZZRXRHOKY-KRWDZBQOSA-N 1 2 317.791 4.361 20 0 DIADLO Fc1ccc2c(c1)OCC[N@@H+]([C@H]1CCc3cc(Cl)ccc31)C2 ZINC001196606357 1049675157 /nfs/dbraw/zinc/67/51/57/1049675157.db2.gz VIGMVZZRXRHOKY-KRWDZBQOSA-N 1 2 317.791 4.361 20 0 DIADLO CCC1(CC)C[NH+](Cc2sc(N3CCCC3)nc2Cl)C1 ZINC001206174085 1049675721 /nfs/dbraw/zinc/67/57/21/1049675721.db2.gz HDPKMPBXNYAEHV-UHFFFAOYSA-N 1 2 313.898 4.019 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)c(F)c(F)c(F)c1F)c1ccsc1 ZINC000774507541 1049677872 /nfs/dbraw/zinc/67/78/72/1049677872.db2.gz HRSJFBLWIHKRRB-ZCFIWIBFSA-N 1 2 307.287 4.294 20 0 DIADLO CC(C)Oc1cc(-c2cc[nH+]c(N3CCCC3)c2)ccc1F ZINC001206179200 1049677925 /nfs/dbraw/zinc/67/79/25/1049677925.db2.gz QWBUMBQTCABTLJ-UHFFFAOYSA-N 1 2 300.377 4.275 20 0 DIADLO c1ccc([C@@H]2CC[C@@H](Nc3ccc(N4CCCC4)c[nH+]3)C2)cc1 ZINC001182499282 1049679857 /nfs/dbraw/zinc/67/98/57/1049679857.db2.gz NRBIVJCAAUDFAH-QZTJIDSGSA-N 1 2 307.441 4.430 20 0 DIADLO Cn1cnc(C[N@H+]2CC=C(c3cc(Cl)cc(Cl)c3)CC2)c1 ZINC001206198368 1049680699 /nfs/dbraw/zinc/68/06/99/1049680699.db2.gz CSLZTQAHLOYMAQ-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1cnc(C[N@@H+]2CC=C(c3cc(Cl)cc(Cl)c3)CC2)c1 ZINC001206198368 1049680704 /nfs/dbraw/zinc/68/07/04/1049680704.db2.gz CSLZTQAHLOYMAQ-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Clc1nc(NCCCNc2cccc[nH+]2)cc2ccccc21 ZINC000774514934 1049682212 /nfs/dbraw/zinc/68/22/12/1049682212.db2.gz VFGNJDSBFQEMSX-UHFFFAOYSA-N 1 2 312.804 4.197 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000488614923 1049683899 /nfs/dbraw/zinc/68/38/99/1049683899.db2.gz SMAANTODRYAVFZ-NEPJUHHUSA-N 1 2 312.251 4.009 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000488614923 1049683909 /nfs/dbraw/zinc/68/39/09/1049683909.db2.gz SMAANTODRYAVFZ-NEPJUHHUSA-N 1 2 312.251 4.009 20 0 DIADLO O=C(C[C@@H]1C=CCCC1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000488716573 1049690775 /nfs/dbraw/zinc/69/07/75/1049690775.db2.gz JYOHZDMFIIKNSG-CYBMUJFWSA-N 1 2 315.804 4.211 20 0 DIADLO Cn1cnc(C[N@@H+]2CCCC[C@@H]2c2ccccc2C(F)(F)F)c1 ZINC001206257034 1049691227 /nfs/dbraw/zinc/69/12/27/1049691227.db2.gz MJOWBWYVYBZJBL-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1cnc(C[N@H+]2CCCC[C@@H]2c2ccccc2C(F)(F)F)c1 ZINC001206257034 1049691231 /nfs/dbraw/zinc/69/12/31/1049691231.db2.gz MJOWBWYVYBZJBL-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Cc1ccc(C[S@@](=O)[C@@H]2CCc3cc(Cl)ccc32)c(C)[nH+]1 ZINC000794782600 1049693263 /nfs/dbraw/zinc/69/32/63/1049693263.db2.gz YTDSYGCILOJDPO-DYESRHJHSA-N 1 2 319.857 4.288 20 0 DIADLO Cc1c(Cl)ccc(-c2ccc(Cn3cc[nH+]c3)cn2)c1F ZINC001206272769 1049696785 /nfs/dbraw/zinc/69/67/85/1049696785.db2.gz VJNLXCVRDHOCNO-UHFFFAOYSA-N 1 2 301.752 4.094 20 0 DIADLO Cc1nc([C@H](C)[NH+]2CCC(Cc3ccccc3Cl)CC2)no1 ZINC001197021602 1049716191 /nfs/dbraw/zinc/71/61/91/1049716191.db2.gz ZEVLQDOGKFRHFT-LBPRGKRZSA-N 1 2 319.836 4.047 20 0 DIADLO Cc1nc([C@@H](C)[NH+]2CCC(Cc3ccccc3Cl)CC2)no1 ZINC001197021601 1049716309 /nfs/dbraw/zinc/71/63/09/1049716309.db2.gz ZEVLQDOGKFRHFT-GFCCVEGCSA-N 1 2 319.836 4.047 20 0 DIADLO OCc1ccc(C[N@@H+]2CCc3c(Cl)c(Cl)ccc3C2)cc1 ZINC000489221610 1049734876 /nfs/dbraw/zinc/73/48/76/1049734876.db2.gz GIJCFPYCDSNLHA-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO OCc1ccc(C[N@H+]2CCc3c(Cl)c(Cl)ccc3C2)cc1 ZINC000489221610 1049734879 /nfs/dbraw/zinc/73/48/79/1049734879.db2.gz GIJCFPYCDSNLHA-UHFFFAOYSA-N 1 2 322.235 4.044 20 0 DIADLO CCCCOc1ccccc1C[N@@H+]1Cc2ccc(OC)cc2C1 ZINC001206456463 1049737446 /nfs/dbraw/zinc/73/74/46/1049737446.db2.gz MPNCCTOIUKUWND-UHFFFAOYSA-N 1 2 311.425 4.390 20 0 DIADLO CCCCOc1ccccc1C[N@H+]1Cc2ccc(OC)cc2C1 ZINC001206456463 1049737453 /nfs/dbraw/zinc/73/74/53/1049737453.db2.gz MPNCCTOIUKUWND-UHFFFAOYSA-N 1 2 311.425 4.390 20 0 DIADLO CC(C)(C)Oc1ncccc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001206501321 1049745336 /nfs/dbraw/zinc/74/53/36/1049745336.db2.gz QNTVOMUHJFNSLC-UHFFFAOYSA-N 1 2 308.385 4.188 20 0 DIADLO c1cn2cccc(-c3ccc4cnn([C@H]5CCCCO5)c4c3)c2[nH+]1 ZINC001206643768 1049775272 /nfs/dbraw/zinc/77/52/72/1049775272.db2.gz ZJVSGIYXGGEKQY-GOSISDBHSA-N 1 2 318.380 4.050 20 0 DIADLO c1cn2cc(-c3ccc4cnn([C@H]5CCCCO5)c4c3)ccc2[nH+]1 ZINC001206656843 1049776192 /nfs/dbraw/zinc/77/61/92/1049776192.db2.gz RKQZTBQDHGCSIH-LJQANCHMSA-N 1 2 318.380 4.050 20 0 DIADLO Cc1c[nH]c2cccc(-c3ccc(C[NH+]4CCOCC4)cc3F)c12 ZINC001206712037 1049781765 /nfs/dbraw/zinc/78/17/65/1049781765.db2.gz CHBBAIHQDFNCOW-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO Fc1cc(C[NH+]2CCOCC2)ccc1-c1ccc2ccoc2c1 ZINC001206712016 1049781780 /nfs/dbraw/zinc/78/17/80/1049781780.db2.gz BKACKBROLBRIJN-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO COc1cc(C[N@@H+]2Cc3ccc(O)cc3C2)cc2ccccc21 ZINC001206721227 1049784052 /nfs/dbraw/zinc/78/40/52/1049784052.db2.gz SVQCYCKAPIYGLR-UHFFFAOYSA-N 1 2 305.377 4.070 20 0 DIADLO COc1cc(C[N@H+]2Cc3ccc(O)cc3C2)cc2ccccc21 ZINC001206721227 1049784060 /nfs/dbraw/zinc/78/40/60/1049784060.db2.gz SVQCYCKAPIYGLR-UHFFFAOYSA-N 1 2 305.377 4.070 20 0 DIADLO Cc1cc2cc(-c3ccc(C[NH+]4CCOCC4)cc3F)ccc2[nH]1 ZINC001206720100 1049784169 /nfs/dbraw/zinc/78/41/69/1049784169.db2.gz XZVBVCDULOLQAY-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO C=Cc1cc(F)cc(-c2ccc(C[NH+]3CCOCC3)cc2F)c1 ZINC001206740307 1049787592 /nfs/dbraw/zinc/78/75/92/1049787592.db2.gz ZVAOSRKAZHOHOE-UHFFFAOYSA-N 1 2 315.363 4.107 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1Nc1c(Cl)ccc(O)c1Cl ZINC001206744362 1049790979 /nfs/dbraw/zinc/79/09/79/1049790979.db2.gz URUDHMFJQJTKES-UHFFFAOYSA-N 1 2 312.200 4.212 20 0 DIADLO Cc1nc(C[NH+]2CCC(c3ccc(F)cc3F)CC2)cs1 ZINC001206803310 1049804407 /nfs/dbraw/zinc/80/44/07/1049804407.db2.gz DAPVLMMRQQXESA-UHFFFAOYSA-N 1 2 308.397 4.109 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2csc(C3CC3)n2)CC2CC2)cn1 ZINC000646019930 1049810157 /nfs/dbraw/zinc/81/01/57/1049810157.db2.gz RPLXMWYPCUSSTN-UHFFFAOYSA-N 1 2 313.470 4.136 20 0 DIADLO Cc1ccc(C[N@H+](Cc2csc(C3CC3)n2)CC2CC2)cn1 ZINC000646019930 1049810170 /nfs/dbraw/zinc/81/01/70/1049810170.db2.gz RPLXMWYPCUSSTN-UHFFFAOYSA-N 1 2 313.470 4.136 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1cc(-c3ccccc3)on1)C2 ZINC001206843845 1049812262 /nfs/dbraw/zinc/81/22/62/1049812262.db2.gz DSPNTZSJLLNPGV-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1cc(-c3ccccc3)on1)C2 ZINC001206843845 1049812274 /nfs/dbraw/zinc/81/22/74/1049812274.db2.gz DSPNTZSJLLNPGV-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO COc1cccc([C@@H]2CCCC[N@@H+]2Cc2c(F)cncc2F)c1 ZINC001206860387 1049814901 /nfs/dbraw/zinc/81/49/01/1049814901.db2.gz CDYYCTVIAJQDQP-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cccc([C@@H]2CCCC[N@H+]2Cc2c(F)cncc2F)c1 ZINC001206860387 1049814909 /nfs/dbraw/zinc/81/49/09/1049814909.db2.gz CDYYCTVIAJQDQP-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1ncsc1C[N@@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001206987116 1049816570 /nfs/dbraw/zinc/81/65/70/1049816570.db2.gz ORIWVRDKIXGMCG-CQSZACIVSA-N 1 2 324.902 4.395 20 0 DIADLO Cc1ncsc1C[N@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001206987116 1049816580 /nfs/dbraw/zinc/81/65/80/1049816580.db2.gz ORIWVRDKIXGMCG-CQSZACIVSA-N 1 2 324.902 4.395 20 0 DIADLO CCc1nccc(C[N@@H+](CC)Cc2ccc(Cl)cc2Cl)n1 ZINC001207089650 1049835983 /nfs/dbraw/zinc/83/59/83/1049835983.db2.gz RJELRGSLKFAJLN-UHFFFAOYSA-N 1 2 324.255 4.368 20 0 DIADLO CCc1nccc(C[N@H+](CC)Cc2ccc(Cl)cc2Cl)n1 ZINC001207089650 1049836001 /nfs/dbraw/zinc/83/60/01/1049836001.db2.gz RJELRGSLKFAJLN-UHFFFAOYSA-N 1 2 324.255 4.368 20 0 DIADLO Fc1cnc(C[NH+]2CCC(c3ccccc3Cl)CC2)c(F)c1 ZINC001207100430 1049836067 /nfs/dbraw/zinc/83/60/67/1049836067.db2.gz ZOCGYUARGAJHMD-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO C[N@H+](Cc1ccc(F)cc1)Cc1c(F)cccc1OC(F)F ZINC001207112270 1049837409 /nfs/dbraw/zinc/83/74/09/1049837409.db2.gz YGYRRBUGRHMVCN-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO C[N@@H+](Cc1ccc(F)cc1)Cc1c(F)cccc1OC(F)F ZINC001207112270 1049837415 /nfs/dbraw/zinc/83/74/15/1049837415.db2.gz YGYRRBUGRHMVCN-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO FC[C@@H]1CC[N@H+](C[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1(F)F ZINC001207184108 1049854399 /nfs/dbraw/zinc/85/43/99/1049854399.db2.gz ZELMHVBJVLQGMQ-YDHLFZDLSA-N 1 2 317.782 4.370 20 0 DIADLO FC[C@@H]1CC[N@@H+](C[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1(F)F ZINC001207184108 1049854405 /nfs/dbraw/zinc/85/44/05/1049854405.db2.gz ZELMHVBJVLQGMQ-YDHLFZDLSA-N 1 2 317.782 4.370 20 0 DIADLO CCCc1nc(C[N@H+](C)Cc2ccc(OC)c(C)c2)cs1 ZINC000491047515 1049881915 /nfs/dbraw/zinc/88/19/15/1049881915.db2.gz GOWXZGINOFSGAG-UHFFFAOYSA-N 1 2 304.459 4.045 20 0 DIADLO CCCc1nc(C[N@@H+](C)Cc2ccc(OC)c(C)c2)cs1 ZINC000491047515 1049881921 /nfs/dbraw/zinc/88/19/21/1049881921.db2.gz GOWXZGINOFSGAG-UHFFFAOYSA-N 1 2 304.459 4.045 20 0 DIADLO COC(=O)c1cccc(CNc2ccc3[nH+]c(C)cc(C)c3c2)c1 ZINC001207552600 1049908113 /nfs/dbraw/zinc/90/81/13/1049908113.db2.gz BPTIRZWVRMORHC-UHFFFAOYSA-N 1 2 320.392 4.250 20 0 DIADLO CCCC[C@@H](C)[NH2+][C@@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001207678754 1049926591 /nfs/dbraw/zinc/92/65/91/1049926591.db2.gz BDBRMKQZKRRDAH-WBVHZDCISA-N 1 2 305.462 4.108 20 0 DIADLO Cc1cccnc1C[N@@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000571331666 1049930303 /nfs/dbraw/zinc/93/03/03/1049930303.db2.gz MBQQLIRUVLSFQS-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1cccnc1C[N@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000571331666 1049930306 /nfs/dbraw/zinc/93/03/06/1049930306.db2.gz MBQQLIRUVLSFQS-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1sccc1Br ZINC000588168991 1049971532 /nfs/dbraw/zinc/97/15/32/1049971532.db2.gz JWCYJULKVVPJER-UHFFFAOYSA-N 1 2 300.221 4.126 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1sccc1Br ZINC000588168991 1049971541 /nfs/dbraw/zinc/97/15/41/1049971541.db2.gz JWCYJULKVVPJER-UHFFFAOYSA-N 1 2 300.221 4.126 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC000588236526 1049976533 /nfs/dbraw/zinc/97/65/33/1049976533.db2.gz FIYSZYGQCRWOQJ-UHFFFAOYSA-N 1 2 324.211 4.256 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC000588236526 1049976538 /nfs/dbraw/zinc/97/65/38/1049976538.db2.gz FIYSZYGQCRWOQJ-UHFFFAOYSA-N 1 2 324.211 4.256 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccccc2OC(C)C)no1 ZINC000055901148 1049976640 /nfs/dbraw/zinc/97/66/40/1049976640.db2.gz GMITVBPOWGZZKM-QGZVFWFLSA-N 1 2 300.402 4.107 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccccc2OC(C)C)no1 ZINC000055901148 1049976643 /nfs/dbraw/zinc/97/66/43/1049976643.db2.gz GMITVBPOWGZZKM-QGZVFWFLSA-N 1 2 300.402 4.107 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccccc2OC(C)C)no1 ZINC000055901147 1049976696 /nfs/dbraw/zinc/97/66/96/1049976696.db2.gz GMITVBPOWGZZKM-KRWDZBQOSA-N 1 2 300.402 4.107 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccccc2OC(C)C)no1 ZINC000055901147 1049976699 /nfs/dbraw/zinc/97/66/99/1049976699.db2.gz GMITVBPOWGZZKM-KRWDZBQOSA-N 1 2 300.402 4.107 20 0 DIADLO Cc1ccc([C@@H](C)CC[N@@H+]2CCCC[C@H]2c2noc(C)n2)o1 ZINC001208154284 1049978708 /nfs/dbraw/zinc/97/87/08/1049978708.db2.gz FCNJOCBMQWCECX-WFASDCNBSA-N 1 2 303.406 4.000 20 0 DIADLO Cc1ccc([C@@H](C)CC[N@H+]2CCCC[C@H]2c2noc(C)n2)o1 ZINC001208154284 1049978711 /nfs/dbraw/zinc/97/87/11/1049978711.db2.gz FCNJOCBMQWCECX-WFASDCNBSA-N 1 2 303.406 4.000 20 0 DIADLO Cc1ccc([C@H](C)CC[N@@H+]2CCOC[C@H]2c2ccc(F)cc2)o1 ZINC001208166920 1049979835 /nfs/dbraw/zinc/97/98/35/1049979835.db2.gz YPVVOFFOXKVPNA-KDOFPFPSSA-N 1 2 317.404 4.294 20 0 DIADLO Cc1ccc([C@H](C)CC[N@H+]2CCOC[C@H]2c2ccc(F)cc2)o1 ZINC001208166920 1049979840 /nfs/dbraw/zinc/97/98/40/1049979840.db2.gz YPVVOFFOXKVPNA-KDOFPFPSSA-N 1 2 317.404 4.294 20 0 DIADLO CC(C)CCn1cccc1C[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000572251488 1049997736 /nfs/dbraw/zinc/99/77/36/1049997736.db2.gz BHJSLWJCGPZUFC-GOSISDBHSA-N 1 2 318.486 4.169 20 0 DIADLO CC(C)CCn1cccc1C[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000572251488 1049997739 /nfs/dbraw/zinc/99/77/39/1049997739.db2.gz BHJSLWJCGPZUFC-GOSISDBHSA-N 1 2 318.486 4.169 20 0 DIADLO FC(F)(F)c1ccc(CCC[NH+]2CC(F)(C3CC3)C2)cc1 ZINC001208685654 1050001992 /nfs/dbraw/zinc/00/19/92/1050001992.db2.gz HVHBFIOKGBXHCW-UHFFFAOYSA-N 1 2 301.327 4.072 20 0 DIADLO C[C@H](C[N@@H+]1CC(F)(F)C[C@]1(C)CO)c1cccc2ccccc21 ZINC001208704282 1050003816 /nfs/dbraw/zinc/00/38/16/1050003816.db2.gz JLMPTHJYAJFACU-RDTXWAMCSA-N 1 2 319.395 4.035 20 0 DIADLO C[C@H](C[N@H+]1CC(F)(F)C[C@]1(C)CO)c1cccc2ccccc21 ZINC001208704282 1050003821 /nfs/dbraw/zinc/00/38/21/1050003821.db2.gz JLMPTHJYAJFACU-RDTXWAMCSA-N 1 2 319.395 4.035 20 0 DIADLO Clc1ccc([C@H]2CCC[N@@H+]2Cc2cn3ccsc3n2)cc1 ZINC000588899880 1050007168 /nfs/dbraw/zinc/00/71/68/1050007168.db2.gz HLJHZDUEFOJVMT-OAHLLOKOSA-N 1 2 317.845 4.386 20 0 DIADLO Clc1ccc([C@H]2CCC[N@H+]2Cc2cn3ccsc3n2)cc1 ZINC000588899880 1050007176 /nfs/dbraw/zinc/00/71/76/1050007176.db2.gz HLJHZDUEFOJVMT-OAHLLOKOSA-N 1 2 317.845 4.386 20 0 DIADLO Clc1ccccc1[C@H]1CCC[N@@H+]1Cc1cn2ccsc2n1 ZINC000588900163 1050007654 /nfs/dbraw/zinc/00/76/54/1050007654.db2.gz XYXNDDLCRKBEEZ-OAHLLOKOSA-N 1 2 317.845 4.386 20 0 DIADLO Clc1ccccc1[C@H]1CCC[N@H+]1Cc1cn2ccsc2n1 ZINC000588900163 1050007658 /nfs/dbraw/zinc/00/76/58/1050007658.db2.gz XYXNDDLCRKBEEZ-OAHLLOKOSA-N 1 2 317.845 4.386 20 0 DIADLO c1cc2c(nc[nH+]c2Nc2ccc3c(c2)OC2(CCCCC2)O3)[nH]1 ZINC000588894759 1050011487 /nfs/dbraw/zinc/01/14/87/1050011487.db2.gz JKMITIFIODFQNP-UHFFFAOYSA-N 1 2 322.368 4.133 20 0 DIADLO C[C@H](C[N@@H+]1CCO[C@@](C)(c2ccc(Cl)cc2)C1)C(F)(F)F ZINC001208890322 1050020828 /nfs/dbraw/zinc/02/08/28/1050020828.db2.gz DEZBJGIHLQGYHO-BXUZGUMPSA-N 1 2 321.770 4.086 20 0 DIADLO C[C@H](C[N@H+]1CCO[C@@](C)(c2ccc(Cl)cc2)C1)C(F)(F)F ZINC001208890322 1050020833 /nfs/dbraw/zinc/02/08/33/1050020833.db2.gz DEZBJGIHLQGYHO-BXUZGUMPSA-N 1 2 321.770 4.086 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)C[C@H](C)C(F)(F)F ZINC001208899987 1050021273 /nfs/dbraw/zinc/02/12/73/1050021273.db2.gz INBZDSVDQKEPQD-JSGCOSHPSA-N 1 2 301.352 4.168 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)C[C@H](C)C(F)(F)F ZINC001208899987 1050021280 /nfs/dbraw/zinc/02/12/80/1050021280.db2.gz INBZDSVDQKEPQD-JSGCOSHPSA-N 1 2 301.352 4.168 20 0 DIADLO c1cn(-c2ccc(NC3=CCN(c4ccccc4)CC3)cc2)c[nH+]1 ZINC001209056926 1050032326 /nfs/dbraw/zinc/03/23/26/1050032326.db2.gz JZJRHTVXHGJXBP-UHFFFAOYSA-N 1 2 316.408 4.078 20 0 DIADLO Nc1cc2c(ccn2-c2cc[nH+]cc2Cl)cc1Br ZINC001212157499 1050034463 /nfs/dbraw/zinc/03/44/63/1050034463.db2.gz OCGWVATWGLWYHK-UHFFFAOYSA-N 1 2 322.593 4.024 20 0 DIADLO FC1(F)C[N@H+](CCCc2cccnc2)CC[C@@H]1c1ccccc1 ZINC001209180806 1050041758 /nfs/dbraw/zinc/04/17/58/1050041758.db2.gz KCISMZJGVKERFO-GOSISDBHSA-N 1 2 316.395 4.139 20 0 DIADLO FC1(F)C[N@@H+](CCCc2cccnc2)CC[C@@H]1c1ccccc1 ZINC001209180806 1050041762 /nfs/dbraw/zinc/04/17/62/1050041762.db2.gz KCISMZJGVKERFO-GOSISDBHSA-N 1 2 316.395 4.139 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000589600557 1050047623 /nfs/dbraw/zinc/04/76/23/1050047623.db2.gz FPWPLXSPASFJNT-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+]1CCO[C@@H](c2cccc(F)c2)C1 ZINC000589600557 1050047625 /nfs/dbraw/zinc/04/76/25/1050047625.db2.gz FPWPLXSPASFJNT-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1cccc(Cl)c1 ZINC000589605360 1050047986 /nfs/dbraw/zinc/04/79/86/1050047986.db2.gz XCGNDYNAKOFFQL-RDTXWAMCSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1cccc(Cl)c1 ZINC000589605360 1050047990 /nfs/dbraw/zinc/04/79/90/1050047990.db2.gz XCGNDYNAKOFFQL-RDTXWAMCSA-N 1 2 301.817 4.302 20 0 DIADLO CC[C@H]([NH2+]Cc1csc(C2CC2)n1)c1cccc([N+](=O)[O-])c1 ZINC000090224847 1050048076 /nfs/dbraw/zinc/04/80/76/1050048076.db2.gz KFGWBALXRBWVKJ-HNNXBMFYSA-N 1 2 317.414 4.170 20 0 DIADLO C[C@@]1(F)CC[N@H+](CCc2ccccc2C(F)(F)F)C[C@@H]1F ZINC001209278770 1050048914 /nfs/dbraw/zinc/04/89/14/1050048914.db2.gz XMCNHSDTEYOCGO-UONOGXRCSA-N 1 2 307.306 4.020 20 0 DIADLO C[C@@]1(F)CC[N@@H+](CCc2ccccc2C(F)(F)F)C[C@@H]1F ZINC001209278770 1050048920 /nfs/dbraw/zinc/04/89/20/1050048920.db2.gz XMCNHSDTEYOCGO-UONOGXRCSA-N 1 2 307.306 4.020 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@@H](c3ccccc3)CC2)no1 ZINC000589610217 1050049212 /nfs/dbraw/zinc/04/92/12/1050049212.db2.gz VHUPLCLTEHZXOV-MRXNPFEDSA-N 1 2 313.445 4.137 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@@H](c3ccccc3)CC2)no1 ZINC000589610217 1050049219 /nfs/dbraw/zinc/04/92/19/1050049219.db2.gz VHUPLCLTEHZXOV-MRXNPFEDSA-N 1 2 313.445 4.137 20 0 DIADLO CCc1ccc([C@H](C)C(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000589903708 1050066053 /nfs/dbraw/zinc/06/60/53/1050066053.db2.gz KORWLOVVNSYRMT-HNNXBMFYSA-N 1 2 319.408 4.177 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2cccnc2)c(F)cc1Cl ZINC001209660567 1050074935 /nfs/dbraw/zinc/07/49/35/1050074935.db2.gz BQRPKLFVKRHPGY-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2cccnc2)c(F)cc1Cl ZINC001209660567 1050074939 /nfs/dbraw/zinc/07/49/39/1050074939.db2.gz BQRPKLFVKRHPGY-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c(F)cc1Cl ZINC001209660568 1050075373 /nfs/dbraw/zinc/07/53/73/1050075373.db2.gz BQRPKLFVKRHPGY-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2cccnc2)c(F)cc1Cl ZINC001209660568 1050075377 /nfs/dbraw/zinc/07/53/77/1050075377.db2.gz BQRPKLFVKRHPGY-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1ccc(Cl)c(OC)c1F ZINC001209702139 1050078207 /nfs/dbraw/zinc/07/82/07/1050078207.db2.gz ROGDAZIRWSSVEU-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1ccc(Cl)c(OC)c1F ZINC001209702139 1050078213 /nfs/dbraw/zinc/07/82/13/1050078213.db2.gz ROGDAZIRWSSVEU-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO CC[N@H+](Cc1[nH]nc2ccc(Cl)cc21)Cc1ccccc1F ZINC001209760772 1050081840 /nfs/dbraw/zinc/08/18/40/1050081840.db2.gz ZFBVCIAYGBEUKZ-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO CC[N@@H+](Cc1[nH]nc2ccc(Cl)cc21)Cc1ccccc1F ZINC001209760772 1050081845 /nfs/dbraw/zinc/08/18/45/1050081845.db2.gz ZFBVCIAYGBEUKZ-UHFFFAOYSA-N 1 2 317.795 4.378 20 0 DIADLO c1[nH]c2ccc(Nc3cc(CCc4ccccc4)no3)cc2[nH+]1 ZINC001209841194 1050093771 /nfs/dbraw/zinc/09/37/71/1050093771.db2.gz FPZXCJRGDMNCJH-UHFFFAOYSA-N 1 2 304.353 4.080 20 0 DIADLO Clc1cc(Br)cnc1Nc1ccc2[nH]c[nH+]c2c1 ZINC001209841313 1050093788 /nfs/dbraw/zinc/09/37/88/1050093788.db2.gz IWBPTOCMZAMWFJ-UHFFFAOYSA-N 1 2 323.581 4.117 20 0 DIADLO CCOc1ccc(-c2cc(Nc3ccc4[nH]c[nH+]c4c3)on2)cc1 ZINC001209841249 1050093886 /nfs/dbraw/zinc/09/38/86/1050093886.db2.gz HPDYOFZGSPFQQM-UHFFFAOYSA-N 1 2 320.352 4.360 20 0 DIADLO Clc1cc(Br)nc(Nc2ccc3[nH]c[nH+]c3c2)c1 ZINC001209847161 1050094590 /nfs/dbraw/zinc/09/45/90/1050094590.db2.gz BHLBVVGTRXJXPM-UHFFFAOYSA-N 1 2 323.581 4.117 20 0 DIADLO COc1cc(C(F)(F)F)ccc1Nc1cccn2cc[nH+]c12 ZINC001209882544 1050099989 /nfs/dbraw/zinc/09/99/89/1050099989.db2.gz ZQHYIMFHNYOKRI-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO C[NH+](C)c1ccc(NCc2cc(Br)ccc2F)cc1 ZINC000057611142 1050102968 /nfs/dbraw/zinc/10/29/68/1050102968.db2.gz ZGYXXLWALPJJLR-UHFFFAOYSA-N 1 2 323.209 4.266 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(C(F)(F)F)c(F)c3)ccc21 ZINC001209912852 1050104657 /nfs/dbraw/zinc/10/46/57/1050104657.db2.gz CSDXWYWIMMDYEK-UHFFFAOYSA-N 1 2 309.266 4.475 20 0 DIADLO c1cc2cc(Nc3ccccc3C[NH+]3CCOCC3)ccc2s1 ZINC001209931790 1050108092 /nfs/dbraw/zinc/10/80/92/1050108092.db2.gz GBKCQOYWOKQGEK-UHFFFAOYSA-N 1 2 324.449 4.477 20 0 DIADLO CO[C@H](C)c1cccc(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001209951322 1050110359 /nfs/dbraw/zinc/11/03/59/1050110359.db2.gz OXCACOVZMXJUDW-OAHLLOKOSA-N 1 2 307.397 4.382 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2cccc(OCC)c2)n1 ZINC000068839570 1050111364 /nfs/dbraw/zinc/11/13/64/1050111364.db2.gz FPHWDMSWZWGGIY-KGLIPLIRSA-N 1 2 317.433 4.223 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cc(C(F)(F)F)ccc3O)ccc21 ZINC001209981991 1050115462 /nfs/dbraw/zinc/11/54/62/1050115462.db2.gz LRXGSJMLSGGZLC-UHFFFAOYSA-N 1 2 307.275 4.041 20 0 DIADLO CSc1cc(Nc2cc(C(F)(F)F)ccc2O)cc[nH+]1 ZINC001209982263 1050115791 /nfs/dbraw/zinc/11/57/91/1050115791.db2.gz PIEFODCQFBOAKK-UHFFFAOYSA-N 1 2 300.305 4.272 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(O)c(C(F)(F)F)c3)ccc21 ZINC001209985989 1050116891 /nfs/dbraw/zinc/11/68/91/1050116891.db2.gz PSZBIRXQZIOOLS-UHFFFAOYSA-N 1 2 307.275 4.041 20 0 DIADLO Cc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)ccc1N(C)C ZINC001210040695 1050127467 /nfs/dbraw/zinc/12/74/67/1050127467.db2.gz AFCYZNYVYMFKPR-UHFFFAOYSA-N 1 2 306.413 4.049 20 0 DIADLO Cc1cc(Br)cnc1Nc1ccc2c[nH+]ccc2c1 ZINC001210043500 1050127521 /nfs/dbraw/zinc/12/75/21/1050127521.db2.gz FNQZZVWAZWVSMH-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO CC(=O)c1c(F)cc(F)cc1Nc1ccc([NH+](C)C)c(C)c1 ZINC001210043517 1050127578 /nfs/dbraw/zinc/12/75/78/1050127578.db2.gz GQUAAVCRMIIJLE-UHFFFAOYSA-N 1 2 304.340 4.285 20 0 DIADLO Cc1cc(Nc2ccc(-c3cnn(C)c3)cc2)ccc1[NH+](C)C ZINC001210041351 1050127765 /nfs/dbraw/zinc/12/77/65/1050127765.db2.gz MPGBDQIVBIHRNJ-UHFFFAOYSA-N 1 2 306.413 4.205 20 0 DIADLO Cc1cc(Nc2[nH+]cccc2N2CCCCC2)ccc1N(C)C ZINC001210042463 1050127796 /nfs/dbraw/zinc/12/77/96/1050127796.db2.gz FQOZSZZBZSVHAO-UHFFFAOYSA-N 1 2 310.445 4.190 20 0 DIADLO Cc1noc(-c2ccc(Nc3ccc([NH+](C)C)c(C)c3)cc2)n1 ZINC001210043914 1050128583 /nfs/dbraw/zinc/12/85/83/1050128583.db2.gz UBLGGDHDQBFADK-UHFFFAOYSA-N 1 2 308.385 4.163 20 0 DIADLO Cc1cc(Nc2ccc(O)cc2Br)ccc1[NH+](C)C ZINC001210045793 1050128683 /nfs/dbraw/zinc/12/86/83/1050128683.db2.gz YATIOFBYCJPOCX-UHFFFAOYSA-N 1 2 321.218 4.273 20 0 DIADLO Cc1cc(Nc2ccc3c[nH+]ccc3c2)n(C(=O)OC(C)(C)C)n1 ZINC001210043933 1050128837 /nfs/dbraw/zinc/12/88/37/1050128837.db2.gz LQQKILPOKRRIHU-UHFFFAOYSA-N 1 2 324.384 4.267 20 0 DIADLO Cc1cc(Nc2ccc3c(c2)N(C)C(=O)C3(C)C)ccc1[NH+](C)C ZINC001210045900 1050128862 /nfs/dbraw/zinc/12/88/62/1050128862.db2.gz ZNTDRHLFLJQMLW-UHFFFAOYSA-N 1 2 323.440 4.059 20 0 DIADLO C[C@H]([NH2+]Cc1noc(-c2ccccc2)n1)c1ccc(C2CC2)cc1 ZINC000573191261 1050139627 /nfs/dbraw/zinc/13/96/27/1050139627.db2.gz SOVFFIKBRAXYQT-AWEZNQCLSA-N 1 2 319.408 4.465 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)no1 ZINC000573169173 1050140848 /nfs/dbraw/zinc/14/08/48/1050140848.db2.gz XIDFCGFBQUNLDL-INIZCTEOSA-N 1 2 302.393 4.448 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)no1 ZINC000573169173 1050140852 /nfs/dbraw/zinc/14/08/52/1050140852.db2.gz XIDFCGFBQUNLDL-INIZCTEOSA-N 1 2 302.393 4.448 20 0 DIADLO CCOc1ccccc1C[N@@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000591382671 1050143756 /nfs/dbraw/zinc/14/37/56/1050143756.db2.gz CIZITDLAOBJFBO-UHFFFAOYSA-N 1 2 320.436 4.433 20 0 DIADLO CCOc1ccccc1C[N@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000591382671 1050143759 /nfs/dbraw/zinc/14/37/59/1050143759.db2.gz CIZITDLAOBJFBO-UHFFFAOYSA-N 1 2 320.436 4.433 20 0 DIADLO COc1ccc2ccccc2c1Nc1ccc2c(c1)[nH+]cn2C ZINC001210169501 1050148550 /nfs/dbraw/zinc/14/85/50/1050148550.db2.gz WJZSQWPRWDPCGY-UHFFFAOYSA-N 1 2 303.365 4.479 20 0 DIADLO Fc1cnc(Br)cc1Nc1cccc2cc[nH+]cc21 ZINC001210224228 1050165494 /nfs/dbraw/zinc/16/54/94/1050165494.db2.gz HOOVDPVJOVTDJJ-UHFFFAOYSA-N 1 2 318.149 4.275 20 0 DIADLO Cc1cnc(C[NH2+][C@H](c2cccnc2)c2cc(C)cc(C)c2)s1 ZINC000823888028 1050165915 /nfs/dbraw/zinc/16/59/15/1050165915.db2.gz VCEVWVYDMIWDOL-LJQANCHMSA-N 1 2 323.465 4.343 20 0 DIADLO Fc1cnc(Br)c(Nc2cccc3cc[nH+]cc32)c1 ZINC001210224209 1050166205 /nfs/dbraw/zinc/16/62/05/1050166205.db2.gz TXMNANVBYROAJJ-UHFFFAOYSA-N 1 2 318.149 4.275 20 0 DIADLO Cc1nc(Cl)nc(Cl)c1Nc1cccc2cc[nH+]cc21 ZINC001210223652 1050166345 /nfs/dbraw/zinc/16/63/45/1050166345.db2.gz CBJAZFOOESRODY-UHFFFAOYSA-N 1 2 305.168 4.384 20 0 DIADLO Cc1ccc(-n2nccc2Nc2cccc3cc[nH+]cc32)cc1 ZINC001210224676 1050167206 /nfs/dbraw/zinc/16/72/06/1050167206.db2.gz VBYOOUPQQUEHTN-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO COC(=O)c1c(F)ccc(F)c1Nc1cccc2cc[nH+]cc21 ZINC001210230231 1050167351 /nfs/dbraw/zinc/16/73/51/1050167351.db2.gz AIUBCPQTFXLKGC-UHFFFAOYSA-N 1 2 314.291 4.043 20 0 DIADLO CCOC(=O)c1ccc(Nc2cccc3cc[nH+]cc32)c(OC)c1 ZINC001210230948 1050167538 /nfs/dbraw/zinc/16/75/38/1050167538.db2.gz KUJFWSDZZANCJE-UHFFFAOYSA-N 1 2 322.364 4.164 20 0 DIADLO COc1cccc2cc(CNc3ccc([NH+](C)C)c(C)c3)oc21 ZINC000770526975 1050167724 /nfs/dbraw/zinc/16/77/24/1050167724.db2.gz GDFUSBYDQPFYOF-UHFFFAOYSA-N 1 2 310.397 4.428 20 0 DIADLO CCSCc1cc[nH+]c(N[C@@H]2CCc3cccnc3CC2)c1 ZINC000591531653 1050168019 /nfs/dbraw/zinc/16/80/19/1050168019.db2.gz MAEFBDVMUWGFCR-MRXNPFEDSA-N 1 2 313.470 4.089 20 0 DIADLO CC(C)(C)c1cc2ncc(Nc3cccc4cc[nH+]cc43)cn2n1 ZINC001210225836 1050168509 /nfs/dbraw/zinc/16/85/09/1050168509.db2.gz LETNTDAFPGLKKF-UHFFFAOYSA-N 1 2 317.396 4.319 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3occc3Br)ccc21 ZINC000770540559 1050169489 /nfs/dbraw/zinc/16/94/89/1050169489.db2.gz ICXIRAWBPVWKGY-UHFFFAOYSA-N 1 2 321.218 4.037 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3occc3Br)ccc21 ZINC000770540559 1050169501 /nfs/dbraw/zinc/16/95/01/1050169501.db2.gz ICXIRAWBPVWKGY-UHFFFAOYSA-N 1 2 321.218 4.037 20 0 DIADLO CCOC(=O)c1ccc(F)c(Nc2cccc3cc[nH+]cc32)c1 ZINC001210231901 1050169760 /nfs/dbraw/zinc/16/97/60/1050169760.db2.gz VBSUQFFQDPWDDX-UHFFFAOYSA-N 1 2 310.328 4.294 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(C)on2)cc1OCC ZINC000282669630 1050171660 /nfs/dbraw/zinc/17/16/60/1050171660.db2.gz JAYHGSZYAAASRM-KGLIPLIRSA-N 1 2 318.417 4.192 20 0 DIADLO COC(=O)c1ccc(Nc2cccc3cc[nH+]cc32)c(F)c1F ZINC001210233303 1050172320 /nfs/dbraw/zinc/17/23/20/1050172320.db2.gz VBYPLJZBOLIMLY-UHFFFAOYSA-N 1 2 314.291 4.043 20 0 DIADLO CC(C)c1cc(NCCC(=O)c2ccccc2)nc(C(C)C)[nH+]1 ZINC001170015532 1050178114 /nfs/dbraw/zinc/17/81/14/1050178114.db2.gz SFODSHZARJNQNT-UHFFFAOYSA-N 1 2 311.429 4.408 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)o1 ZINC000770616681 1050180255 /nfs/dbraw/zinc/18/02/55/1050180255.db2.gz WTUKQOZPYFIXQN-MNOVXSKESA-N 1 2 314.307 4.293 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(Cl)c(OC(F)(F)F)c2)cc1N ZINC001210290818 1050191139 /nfs/dbraw/zinc/19/11/39/1050191139.db2.gz PREIHPWCYWWEAG-UHFFFAOYSA-N 1 2 317.698 4.268 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(Oc3ccccc3F)nc2)cc1N ZINC001210287319 1050191304 /nfs/dbraw/zinc/19/13/04/1050191304.db2.gz QVSIEIHUYCDVCS-UHFFFAOYSA-N 1 2 310.332 4.042 20 0 DIADLO COc1ccccc1-c1ccc(Nc2c[nH+]c(C)c(N)c2)cc1 ZINC001210287785 1050191542 /nfs/dbraw/zinc/19/15/42/1050191542.db2.gz FGZDJNXKQKTWJQ-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(OC3CCCC3)c(F)c2)cc1N ZINC001210291659 1050191656 /nfs/dbraw/zinc/19/16/56/1050191656.db2.gz PPPOMIAFKVPTOK-UHFFFAOYSA-N 1 2 301.365 4.176 20 0 DIADLO Cc1[nH+]cc(Nc2c(Cl)cc(Cl)nc2Cl)cc1N ZINC001210288766 1050191745 /nfs/dbraw/zinc/19/17/45/1050191745.db2.gz PHGUERFQVRFLSD-UHFFFAOYSA-N 1 2 303.580 4.071 20 0 DIADLO Cc1[nH+]cc(Nc2cccc(Br)c2Cl)cc1N ZINC001210292000 1050191770 /nfs/dbraw/zinc/19/17/70/1050191770.db2.gz XYWJWOZIFHHNMK-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO Cc1[nH+]cc(Nc2cc(F)ccc2OC2CCCC2)cc1N ZINC001210292034 1050192023 /nfs/dbraw/zinc/19/20/23/1050192023.db2.gz ZABXDZUAPWMDCN-UHFFFAOYSA-N 1 2 301.365 4.176 20 0 DIADLO Cc1[nH+]cc(Nc2ccn3cc(-c4ccccc4)nc3c2)cc1N ZINC001210288411 1050192474 /nfs/dbraw/zinc/19/24/74/1050192474.db2.gz HPNQCFSRHCTLIY-UHFFFAOYSA-N 1 2 315.380 4.031 20 0 DIADLO Cc1[nH+]cc(Nc2cc(F)c(OCC3CCC3)c(F)c2)cc1N ZINC001210293054 1050194695 /nfs/dbraw/zinc/19/46/95/1050194695.db2.gz DURVXYIVQQKYSJ-UHFFFAOYSA-N 1 2 319.355 4.173 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CCC[C@H](F)CC2)cc1Br ZINC001136849341 1050195032 /nfs/dbraw/zinc/19/50/32/1050195032.db2.gz HTDVMMOEJYENSV-JTQLQIEISA-N 1 2 322.168 4.051 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CCC[C@H](F)CC2)cc1Br ZINC001136849341 1050195041 /nfs/dbraw/zinc/19/50/41/1050195041.db2.gz HTDVMMOEJYENSV-JTQLQIEISA-N 1 2 322.168 4.051 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1cc(Br)c(F)cc1F ZINC001136849259 1050195263 /nfs/dbraw/zinc/19/52/63/1050195263.db2.gz DLUMUTGECROVFX-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1cc(Br)c(F)cc1F ZINC001136849259 1050195270 /nfs/dbraw/zinc/19/52/70/1050195270.db2.gz DLUMUTGECROVFX-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1cc(Br)c(F)cc1F ZINC001136849258 1050195751 /nfs/dbraw/zinc/19/57/51/1050195751.db2.gz DLUMUTGECROVFX-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1cc(Br)c(F)cc1F ZINC001136849258 1050195757 /nfs/dbraw/zinc/19/57/57/1050195757.db2.gz DLUMUTGECROVFX-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO Cc1ccc2c(Nc3ccc(OC(F)F)nc3)cccc2[nH+]1 ZINC001210303090 1050198692 /nfs/dbraw/zinc/19/86/92/1050198692.db2.gz GWFFVCQCQGVXKU-UHFFFAOYSA-N 1 2 301.296 4.283 20 0 DIADLO CC1(C)C[NH+](Cc2cc3c(cccc3Cl)[nH]2)CC(C)(C)O1 ZINC001136863440 1050201056 /nfs/dbraw/zinc/20/10/56/1050201056.db2.gz BQWSOFVUQREJRG-UHFFFAOYSA-N 1 2 306.837 4.211 20 0 DIADLO CC(=O)c1ccc([C@H](C)Nc2[nH+]cccc2-n2cccc2)cc1 ZINC001171053497 1050203623 /nfs/dbraw/zinc/20/36/23/1050203623.db2.gz LMJGPHFQKSBPAO-AWEZNQCLSA-N 1 2 305.381 4.248 20 0 DIADLO CCc1ccc[nH+]c1Nc1ccc2c(cnn2[C@@H]2CCCCO2)c1 ZINC001210335075 1050210534 /nfs/dbraw/zinc/21/05/34/1050210534.db2.gz XTSJJZUHFLUAJF-SFHVURJKSA-N 1 2 322.412 4.436 20 0 DIADLO FC(F)(F)COc1cccc(Nc2ccn3cc[nH+]c3c2)c1 ZINC001212169499 1050216637 /nfs/dbraw/zinc/21/66/37/1050216637.db2.gz IKNCAZALRAAGSM-UHFFFAOYSA-N 1 2 307.275 4.019 20 0 DIADLO CCN(CC)c1ccc(N[C@@H]2CCCNc3ccccc32)c[nH+]1 ZINC000573573907 1050217177 /nfs/dbraw/zinc/21/71/77/1050217177.db2.gz FNQOHPPTLGMLGT-GOSISDBHSA-N 1 2 310.445 4.287 20 0 DIADLO C[N@H+](Cc1nnc2ccccn21)Cc1cccc(C2CCCC2)c1 ZINC000824649131 1050231141 /nfs/dbraw/zinc/23/11/41/1050231141.db2.gz ADAUZLLVYCMGJX-UHFFFAOYSA-N 1 2 320.440 4.019 20 0 DIADLO C[N@@H+](Cc1nnc2ccccn21)Cc1cccc(C2CCCC2)c1 ZINC000824649131 1050231150 /nfs/dbraw/zinc/23/11/50/1050231150.db2.gz ADAUZLLVYCMGJX-UHFFFAOYSA-N 1 2 320.440 4.019 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@@H](C)c2csc3ccccc23)n1 ZINC000734160644 1050233552 /nfs/dbraw/zinc/23/35/52/1050233552.db2.gz YLYIHHQOPOHVFH-QWRGUYRKSA-N 1 2 301.415 4.259 20 0 DIADLO C[C@H]([NH2+]Cc1cccnc1Cl)c1nc2ccccc2s1 ZINC000734164437 1050234725 /nfs/dbraw/zinc/23/47/25/1050234725.db2.gz LWQHGPDSDHUIEO-JTQLQIEISA-N 1 2 303.818 4.196 20 0 DIADLO Cc1cc(C)c(NC(=O)CSCc2ccc(F)cc2)c(C)[nH+]1 ZINC000591888376 1050234878 /nfs/dbraw/zinc/23/48/78/1050234878.db2.gz WQZRTMOXOHYGJR-UHFFFAOYSA-N 1 2 318.417 4.018 20 0 DIADLO Cc1cccc(C2=CC[N@H+](Cc3cnc(Cl)s3)CC2)c1 ZINC000771465592 1050259265 /nfs/dbraw/zinc/25/92/65/1050259265.db2.gz VKTAFUMVPWRAAG-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO Cc1cccc(C2=CC[N@@H+](Cc3cnc(Cl)s3)CC2)c1 ZINC000771465592 1050259278 /nfs/dbraw/zinc/25/92/78/1050259278.db2.gz VKTAFUMVPWRAAG-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO CCc1nc(C[NH2+]Cc2cccc(OCc3ccccc3)c2)co1 ZINC000825051243 1050271826 /nfs/dbraw/zinc/27/18/26/1050271826.db2.gz ZQSUJYVZKBELNG-UHFFFAOYSA-N 1 2 322.408 4.106 20 0 DIADLO CC(C)CC1CC[NH+](Cc2noc(-c3ccsc3)n2)CC1 ZINC000760965404 1050295263 /nfs/dbraw/zinc/29/52/63/1050295263.db2.gz NEJAMJLIAGLRFK-UHFFFAOYSA-N 1 2 305.447 4.056 20 0 DIADLO Cc1oncc1Nc1cc[nH+]c2cc(Br)ccc12 ZINC001210577797 1050304601 /nfs/dbraw/zinc/30/46/01/1050304601.db2.gz COKKUEVEQXLROG-UHFFFAOYSA-N 1 2 304.147 4.037 20 0 DIADLO COc1cc2ccccc2c(-n2c(C)[nH+]c3ccc(N)cc32)c1 ZINC001210587646 1050307484 /nfs/dbraw/zinc/30/74/84/1050307484.db2.gz ITSUVKPTWROBDS-UHFFFAOYSA-N 1 2 303.365 4.078 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1Cl ZINC001143369512 1050319507 /nfs/dbraw/zinc/31/95/07/1050319507.db2.gz RTAUJBHBZFUERR-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2ccccn2)c1Cl ZINC001143369512 1050319518 /nfs/dbraw/zinc/31/95/18/1050319518.db2.gz RTAUJBHBZFUERR-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO CCSc1ccccc1OC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000734790508 1050320706 /nfs/dbraw/zinc/32/07/06/1050320706.db2.gz DUBALCIZKZTEQD-UHFFFAOYSA-N 1 2 324.405 4.204 20 0 DIADLO Cc1cc(N2CCC[C@@H]2c2ccc(F)c(F)c2)nc(C2CC2)[nH+]1 ZINC000734834051 1050323140 /nfs/dbraw/zinc/32/31/40/1050323140.db2.gz ZPKIWTBFBXMNDK-MRXNPFEDSA-N 1 2 315.367 4.282 20 0 DIADLO Fc1ccc(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c(F)c1Cl ZINC001143626449 1050327263 /nfs/dbraw/zinc/32/72/63/1050327263.db2.gz VMPOYMDLQZGNNX-CQSZACIVSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1ccc(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c(F)c1Cl ZINC001143626449 1050327277 /nfs/dbraw/zinc/32/72/77/1050327277.db2.gz VMPOYMDLQZGNNX-CQSZACIVSA-N 1 2 323.770 4.272 20 0 DIADLO FC(F)(F)c1ccc([C@@H]2OCCC[C@H]2Cn2cc[nH+]c2)cc1 ZINC000825716449 1050330740 /nfs/dbraw/zinc/33/07/40/1050330740.db2.gz OHZQVLLCNCVWHN-ZFWWWQNUSA-N 1 2 310.319 4.070 20 0 DIADLO FC(F)(F)c1ncc(Nc2cc[nH+]c3cc(Cl)ccc23)cn1 ZINC001210669687 1050332359 /nfs/dbraw/zinc/33/23/59/1050332359.db2.gz MLKWDZVEDZJIEZ-UHFFFAOYSA-N 1 2 324.693 4.441 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(C)c(C(F)(F)F)c1 ZINC001210685533 1050336105 /nfs/dbraw/zinc/33/61/05/1050336105.db2.gz DAFCJYHFYRIWFW-UHFFFAOYSA-N 1 2 305.303 4.243 20 0 DIADLO CCCCCC[C@H](CC)C(=O)NCc1[nH+]cc(C)c(OC)c1C ZINC000735005684 1050337150 /nfs/dbraw/zinc/33/71/50/1050337150.db2.gz XHXPXNVJXZWOQH-INIZCTEOSA-N 1 2 320.477 4.320 20 0 DIADLO CC(C)[C@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2Cl)CCO1 ZINC001143715324 1050338800 /nfs/dbraw/zinc/33/88/00/1050338800.db2.gz GTCJXMLTSQOBHR-CQSZACIVSA-N 1 2 321.770 4.216 20 0 DIADLO CC(C)[C@H]1C[N@@H+](Cc2ccc(C(F)(F)F)cc2Cl)CCO1 ZINC001143715324 1050338815 /nfs/dbraw/zinc/33/88/15/1050338815.db2.gz GTCJXMLTSQOBHR-CQSZACIVSA-N 1 2 321.770 4.216 20 0 DIADLO c1cc2cc(Nc3ccc(N4CCCCC4)[nH+]c3)cnc2s1 ZINC001210691548 1050340244 /nfs/dbraw/zinc/34/02/44/1050340244.db2.gz DNKNJCAAELJAMH-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO F[C@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2Cl)C[C@@H]2C[C@@H]21 ZINC001143710557 1050342036 /nfs/dbraw/zinc/34/20/36/1050342036.db2.gz VJMBSFPPRNDAJS-GAFUQQFSSA-N 1 2 307.718 4.149 20 0 DIADLO F[C@H]1C[N@@H+](Cc2ccc(C(F)(F)F)cc2Cl)C[C@@H]2C[C@@H]21 ZINC001143710557 1050342044 /nfs/dbraw/zinc/34/20/44/1050342044.db2.gz VJMBSFPPRNDAJS-GAFUQQFSSA-N 1 2 307.718 4.149 20 0 DIADLO C[N@H+](Cc1ccncc1)Cc1ccc(C(F)(F)F)cc1Cl ZINC001143709361 1050344005 /nfs/dbraw/zinc/34/40/05/1050344005.db2.gz DCJCIAIGUBRGGV-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccncc1)Cc1ccc(C(F)(F)F)cc1Cl ZINC001143709361 1050344011 /nfs/dbraw/zinc/34/40/11/1050344011.db2.gz DCJCIAIGUBRGGV-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO COc1ccnc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)c1 ZINC000592890225 1050347053 /nfs/dbraw/zinc/34/70/53/1050347053.db2.gz CQKZNRUAMQATCW-CYBMUJFWSA-N 1 2 316.832 4.469 20 0 DIADLO COc1ccnc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)c1 ZINC000592890225 1050347065 /nfs/dbraw/zinc/34/70/65/1050347065.db2.gz CQKZNRUAMQATCW-CYBMUJFWSA-N 1 2 316.832 4.469 20 0 DIADLO F[C@H]1C[N@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)C[C@@H]2C[C@@H]21 ZINC001143804430 1050366750 /nfs/dbraw/zinc/36/67/50/1050366750.db2.gz RPSDIYLPQURXMS-KWBADKCTSA-N 1 2 307.718 4.149 20 0 DIADLO F[C@H]1C[N@@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)C[C@@H]2C[C@@H]21 ZINC001143804430 1050366760 /nfs/dbraw/zinc/36/67/60/1050366760.db2.gz RPSDIYLPQURXMS-KWBADKCTSA-N 1 2 307.718 4.149 20 0 DIADLO COc1cc(Nc2cc(C(F)(F)F)cnc2Cl)cc(C)[nH+]1 ZINC001210773684 1050368236 /nfs/dbraw/zinc/36/82/36/1050368236.db2.gz CZMYNFPTWRSRIF-UHFFFAOYSA-N 1 2 317.698 4.209 20 0 DIADLO COc1cc(Nc2cc(Cl)nc(C(F)(F)F)c2)cc(C)[nH+]1 ZINC001210774624 1050368382 /nfs/dbraw/zinc/36/83/82/1050368382.db2.gz PBRPLTPHBJEWPI-UHFFFAOYSA-N 1 2 317.698 4.209 20 0 DIADLO CCC[C@H]([NH2+]Cc1occc1Br)c1ccccn1 ZINC000735322091 1050370815 /nfs/dbraw/zinc/37/08/15/1050370815.db2.gz CRBPRWVISWYUFA-LBPRGKRZSA-N 1 2 309.207 4.068 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1occc1Br ZINC000735323505 1050371269 /nfs/dbraw/zinc/37/12/69/1050371269.db2.gz YROMLZBKBPXJFA-UHFFFAOYSA-N 1 2 324.218 4.076 20 0 DIADLO Cc1nonc1C[N@@H+]1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000735311976 1050372294 /nfs/dbraw/zinc/37/22/94/1050372294.db2.gz ZVJSIFYQZYMAEW-INIZCTEOSA-N 1 2 305.809 4.149 20 0 DIADLO Cc1nonc1C[N@H+]1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000735311976 1050372310 /nfs/dbraw/zinc/37/23/10/1050372310.db2.gz ZVJSIFYQZYMAEW-INIZCTEOSA-N 1 2 305.809 4.149 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC001143860663 1050377675 /nfs/dbraw/zinc/37/76/75/1050377675.db2.gz RCAFRVXSZMLSMS-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC001143860663 1050377680 /nfs/dbraw/zinc/37/76/80/1050377680.db2.gz RCAFRVXSZMLSMS-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO Cc1cn2c(cccc2Nc2cc(O)cc(C(F)(F)F)c2)[nH+]1 ZINC001210822340 1050380156 /nfs/dbraw/zinc/38/01/56/1050380156.db2.gz GEDHVUBFYAZAQV-UHFFFAOYSA-N 1 2 307.275 4.111 20 0 DIADLO Oc1cc(Nc2ccc[nH+]c2N2CCCC2)cc(C(F)(F)F)c1 ZINC001210822393 1050380587 /nfs/dbraw/zinc/38/05/87/1050380587.db2.gz HBEOKNUUNXLHIP-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO Clc1cc([NH2+]C[C@H]2CCSC2)ccc1N1CCCCC1 ZINC000785491644 1050381825 /nfs/dbraw/zinc/38/18/25/1050381825.db2.gz RTLYLWLJJFUVRB-CYBMUJFWSA-N 1 2 310.894 4.495 20 0 DIADLO c1cn(Cc2ccc(Nc3ccccc3OC3CC3)cc2)c[nH+]1 ZINC001210838490 1050386880 /nfs/dbraw/zinc/38/68/80/1050386880.db2.gz CCJAXYMCDVGSKF-UHFFFAOYSA-N 1 2 305.381 4.216 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCC[C@H]2c2cccnc2)c1F ZINC001143886536 1050396551 /nfs/dbraw/zinc/39/65/51/1050396551.db2.gz VVQCMGZKGXHQOY-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCC[C@H]2c2cccnc2)c1F ZINC001143886536 1050396561 /nfs/dbraw/zinc/39/65/61/1050396561.db2.gz VVQCMGZKGXHQOY-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO c1cn(Cc2cccc(Nc3cccc(OC4CC4)c3)c2)c[nH+]1 ZINC001210862300 1050397655 /nfs/dbraw/zinc/39/76/55/1050397655.db2.gz FFWZOBDOYATLLJ-UHFFFAOYSA-N 1 2 305.381 4.216 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)c1F ZINC001143895681 1050401974 /nfs/dbraw/zinc/40/19/74/1050401974.db2.gz DEMMMTFPYHCONO-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCC[C@@H]2c2ccncc2)c1F ZINC001143895681 1050401981 /nfs/dbraw/zinc/40/19/81/1050401981.db2.gz DEMMMTFPYHCONO-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO CCN(C(=O)C[C@H](C)n1cc[nH+]c1)c1ccc2ccccc2c1 ZINC000844359075 1050406871 /nfs/dbraw/zinc/40/68/71/1050406871.db2.gz IXDUSIBTZZGMSV-HNNXBMFYSA-N 1 2 307.397 4.041 20 0 DIADLO Cc1nc2c(cc(Nc3cccn4cc[nH+]c34)cc2F)n1C(C)C ZINC001210920681 1050413645 /nfs/dbraw/zinc/41/36/45/1050413645.db2.gz LFNOHEGCJSLPJF-UHFFFAOYSA-N 1 2 323.375 4.456 20 0 DIADLO Cc1nc2c(cc(Nc3ccn4cc[nH+]c4c3)cc2F)n1C(C)C ZINC001210923156 1050414198 /nfs/dbraw/zinc/41/41/98/1050414198.db2.gz ZDIVQDBCWISMFA-UHFFFAOYSA-N 1 2 323.375 4.456 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCc3ccccc3[C@@H]2C)c1F ZINC001143969443 1050419460 /nfs/dbraw/zinc/41/94/60/1050419460.db2.gz CKLMHXVWUXMIQA-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCc3ccccc3[C@@H]2C)c1F ZINC001143969443 1050419469 /nfs/dbraw/zinc/41/94/69/1050419469.db2.gz CKLMHXVWUXMIQA-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO CC[C@H](OC(=O)C[C@@H](C)n1cc[nH+]c1)c1c(F)cccc1Cl ZINC000844428806 1050421424 /nfs/dbraw/zinc/42/14/24/1050421424.db2.gz LXZPPGVKWMTUKB-RISCZKNCSA-N 1 2 324.783 4.321 20 0 DIADLO FC1(F)C[C@]12CCC[N@H+](Cc1csc(C3CCCC3)n1)C2 ZINC000844440376 1050423325 /nfs/dbraw/zinc/42/33/25/1050423325.db2.gz SOJKSVNQDIFZDP-HNNXBMFYSA-N 1 2 312.429 4.422 20 0 DIADLO FC1(F)C[C@]12CCC[N@@H+](Cc1csc(C3CCCC3)n1)C2 ZINC000844440376 1050423331 /nfs/dbraw/zinc/42/33/31/1050423331.db2.gz SOJKSVNQDIFZDP-HNNXBMFYSA-N 1 2 312.429 4.422 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2cccnc2Cl)[C@H]1c1ccccc1 ZINC000735674597 1050423339 /nfs/dbraw/zinc/42/33/39/1050423339.db2.gz RROIGRWFRRUKDS-XJKSGUPXSA-N 1 2 318.873 4.414 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2cccnc2Cl)[C@H]1c1ccccc1 ZINC000735674597 1050423344 /nfs/dbraw/zinc/42/33/44/1050423344.db2.gz RROIGRWFRRUKDS-XJKSGUPXSA-N 1 2 318.873 4.414 20 0 DIADLO COc1ccc(F)c(C[N@H+](Cc2ccccc2)C2CC2)c1F ZINC001143980256 1050425827 /nfs/dbraw/zinc/42/58/27/1050425827.db2.gz HFNRPHLBKRMJLK-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO COc1ccc(F)c(C[N@@H+](Cc2ccccc2)C2CC2)c1F ZINC001143980256 1050425840 /nfs/dbraw/zinc/42/58/40/1050425840.db2.gz HFNRPHLBKRMJLK-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c1F ZINC001143979281 1050426373 /nfs/dbraw/zinc/42/63/73/1050426373.db2.gz XZPUXSPLPRQQAF-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c1F ZINC001143979281 1050426370 /nfs/dbraw/zinc/42/63/70/1050426370.db2.gz XZPUXSPLPRQQAF-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1nc(NCCC2CCOCC2)cc(C2CCCCC2)[nH+]1 ZINC001154850406 1050427246 /nfs/dbraw/zinc/42/72/46/1050427246.db2.gz HOVYAGWGARWDOY-UHFFFAOYSA-N 1 2 303.450 4.061 20 0 DIADLO CC(=O)[C@H]1CCC[N@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC001143990097 1050432291 /nfs/dbraw/zinc/43/22/91/1050432291.db2.gz FWCLGZDURRLGHH-LBPRGKRZSA-N 1 2 319.754 4.160 20 0 DIADLO CC(=O)[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC001143990097 1050432294 /nfs/dbraw/zinc/43/22/94/1050432294.db2.gz FWCLGZDURRLGHH-LBPRGKRZSA-N 1 2 319.754 4.160 20 0 DIADLO CC(C)c1ccc([C@H](C)OC(=O)C[C@@H](C)n2cc[nH+]c2)cc1 ZINC000844471758 1050435420 /nfs/dbraw/zinc/43/54/20/1050435420.db2.gz FSOGIHJLLGIMJB-CABCVRRESA-N 1 2 300.402 4.262 20 0 DIADLO COc1cc2ccn(-c3ccccc3[NH+]3CCCCC3)c2c(N)c1 ZINC001210964015 1050436036 /nfs/dbraw/zinc/43/60/36/1050436036.db2.gz VRAXOEQTPRZUSL-UHFFFAOYSA-N 1 2 321.424 4.212 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2CC[C@H]2c2ccccc2)cc1F ZINC001144030537 1050437916 /nfs/dbraw/zinc/43/79/16/1050437916.db2.gz CQHNFMVOJQZJTP-KRWDZBQOSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2CC[C@H]2c2ccccc2)cc1F ZINC001144030537 1050437927 /nfs/dbraw/zinc/43/79/27/1050437927.db2.gz CQHNFMVOJQZJTP-KRWDZBQOSA-N 1 2 303.352 4.311 20 0 DIADLO Cc1ccc(Nc2ccc(CNC(=O)OC(C)(C)C)cc2)[nH+]c1 ZINC001211005726 1050443338 /nfs/dbraw/zinc/44/33/38/1050443338.db2.gz ZCDMHGFVVITVKH-UHFFFAOYSA-N 1 2 313.401 4.158 20 0 DIADLO Cc1ccc(Nc2ccc(C)c(I)c2)[nH+]c1 ZINC001211012013 1050445349 /nfs/dbraw/zinc/44/53/49/1050445349.db2.gz PGFWEZQKQSETDK-UHFFFAOYSA-N 1 2 324.165 4.047 20 0 DIADLO Cc1ccc(Nc2cccc(NC(=O)c3ccccc3)c2)[nH+]c1 ZINC001211013710 1050447238 /nfs/dbraw/zinc/44/72/38/1050447238.db2.gz LBKOSCUYBXTLMM-UHFFFAOYSA-N 1 2 303.365 4.386 20 0 DIADLO Cc1ccc(Oc2cccc(C[N@@H+]3CCC(=O)[C@H](C)C3)c2)cc1 ZINC001144086201 1050457246 /nfs/dbraw/zinc/45/72/46/1050457246.db2.gz NWADIPZDQVCHIA-MRXNPFEDSA-N 1 2 309.409 4.198 20 0 DIADLO Cc1ccc(Oc2cccc(C[N@H+]3CCC(=O)[C@H](C)C3)c2)cc1 ZINC001144086201 1050457255 /nfs/dbraw/zinc/45/72/55/1050457255.db2.gz NWADIPZDQVCHIA-MRXNPFEDSA-N 1 2 309.409 4.198 20 0 DIADLO Cc1ccc(Oc2cccc(C[N@@H+]3CCOCC34CC4)c2)cc1 ZINC001144090087 1050459483 /nfs/dbraw/zinc/45/94/83/1050459483.db2.gz BALZVQKCZYFZSF-UHFFFAOYSA-N 1 2 309.409 4.152 20 0 DIADLO Cc1ccc(Oc2cccc(C[N@H+]3CCOCC34CC4)c2)cc1 ZINC001144090087 1050459484 /nfs/dbraw/zinc/45/94/84/1050459484.db2.gz BALZVQKCZYFZSF-UHFFFAOYSA-N 1 2 309.409 4.152 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CC[C@H](F)C(F)(F)CC2)cc1Cl ZINC001144120088 1050473015 /nfs/dbraw/zinc/47/30/15/1050473015.db2.gz CNMIADAGFSJYLS-LBPRGKRZSA-N 1 2 313.697 4.187 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)cc1Cl ZINC001144120088 1050473017 /nfs/dbraw/zinc/47/30/17/1050473017.db2.gz CNMIADAGFSJYLS-LBPRGKRZSA-N 1 2 313.697 4.187 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)cs1 ZINC000761047571 1050477416 /nfs/dbraw/zinc/47/74/16/1050477416.db2.gz VVCBTENAAKCJPO-NSHDSACASA-N 1 2 306.397 4.116 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CC[C@H](C(F)(F)F)C2)cs1 ZINC000761047571 1050477421 /nfs/dbraw/zinc/47/74/21/1050477421.db2.gz VVCBTENAAKCJPO-NSHDSACASA-N 1 2 306.397 4.116 20 0 DIADLO CCc1cc(C[N@@H+]2Cc3cccc(OC)c3C2)cc(CC)c1O ZINC001144151328 1050482809 /nfs/dbraw/zinc/48/28/09/1050482809.db2.gz RVCMVVHKAZCMRC-UHFFFAOYSA-N 1 2 311.425 4.041 20 0 DIADLO CCc1cc(C[N@H+]2Cc3cccc(OC)c3C2)cc(CC)c1O ZINC001144151328 1050482818 /nfs/dbraw/zinc/48/28/18/1050482818.db2.gz RVCMVVHKAZCMRC-UHFFFAOYSA-N 1 2 311.425 4.041 20 0 DIADLO C[N@H+](CCc1ccccc1Cl)Cc1n[nH]c2ccc(F)cc21 ZINC001144199254 1050493723 /nfs/dbraw/zinc/49/37/23/1050493723.db2.gz AAJYICNDLOOEBT-UHFFFAOYSA-N 1 2 317.795 4.030 20 0 DIADLO C[N@@H+](CCc1ccccc1Cl)Cc1n[nH]c2ccc(F)cc21 ZINC001144199254 1050493730 /nfs/dbraw/zinc/49/37/30/1050493730.db2.gz AAJYICNDLOOEBT-UHFFFAOYSA-N 1 2 317.795 4.030 20 0 DIADLO CC(C)CCCCC(=O)N[C@H]1CC[C@H](Nc2cccc[nH+]2)CC1 ZINC000574579440 1050495312 /nfs/dbraw/zinc/49/53/12/1050495312.db2.gz JANRFKCFQMNUAU-QAQDUYKDSA-N 1 2 317.477 4.137 20 0 DIADLO Clc1ccc2c(n1)CC[N@@H+](Cc1ccc(-n3cccc3)cc1)C2 ZINC001144246194 1050516212 /nfs/dbraw/zinc/51/62/12/1050516212.db2.gz XIKQQCDMJQUANR-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1ccc2c(n1)CC[N@H+](Cc1ccc(-n3cccc3)cc1)C2 ZINC001144246194 1050516227 /nfs/dbraw/zinc/51/62/27/1050516227.db2.gz XIKQQCDMJQUANR-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1cnccc1Br ZINC001211232074 1050525690 /nfs/dbraw/zinc/52/56/90/1050525690.db2.gz MIYWCNIHRPEWHZ-UHFFFAOYSA-N 1 2 306.207 4.415 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000787181951 1050565893 /nfs/dbraw/zinc/56/58/93/1050565893.db2.gz YOLYSBCZIMVXQA-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(F)ccc1C[N@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000787181951 1050565905 /nfs/dbraw/zinc/56/59/05/1050565905.db2.gz YOLYSBCZIMVXQA-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO CC(C)c1c(Cl)ncnc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213087848 1050582833 /nfs/dbraw/zinc/58/28/33/1050582833.db2.gz CUHJRFJGVPTYFY-UHFFFAOYSA-N 1 2 313.792 4.387 20 0 DIADLO Oc1cccc2sc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)nc21 ZINC001213085566 1050582883 /nfs/dbraw/zinc/58/28/83/1050582883.db2.gz LGYCRRLNYFXMCN-UHFFFAOYSA-N 1 2 308.366 4.136 20 0 DIADLO CN(c1ccc(Nc2cnc(F)c(F)c2)c[nH+]1)C1CCCCC1 ZINC001212614178 1050582758 /nfs/dbraw/zinc/58/27/58/1050582758.db2.gz HMWWUEBVPBXFES-UHFFFAOYSA-N 1 2 318.371 4.267 20 0 DIADLO FC(F)(F)c1cncc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001213086696 1050583279 /nfs/dbraw/zinc/58/32/79/1050583279.db2.gz VXRCFZOMNBVDRB-UHFFFAOYSA-N 1 2 304.275 4.234 20 0 DIADLO CCOC(=O)Nc1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001213090062 1050584976 /nfs/dbraw/zinc/58/49/76/1050584976.db2.gz RTXPGPLEZFUQFR-UHFFFAOYSA-N 1 2 322.368 4.389 20 0 DIADLO COC(=O)/C=C/c1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001213091770 1050585418 /nfs/dbraw/zinc/58/54/18/1050585418.db2.gz KNHBVBBENJUNLR-NYYWCZLTSA-N 1 2 319.364 4.007 20 0 DIADLO COc1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)ccc1C(C)=O ZINC001213089721 1050585553 /nfs/dbraw/zinc/58/55/53/1050585553.db2.gz ALJHGKPJKFZZPL-UHFFFAOYSA-N 1 2 307.353 4.032 20 0 DIADLO Cc1noc(-c2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2)n1 ZINC001213090025 1050586499 /nfs/dbraw/zinc/58/64/99/1050586499.db2.gz QHXMGNYSJPFUSV-UHFFFAOYSA-N 1 2 317.352 4.179 20 0 DIADLO Cc1nn(C)c2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc12 ZINC001213090127 1050586840 /nfs/dbraw/zinc/58/68/40/1050586840.db2.gz VLABIPYQKLLQCR-UHFFFAOYSA-N 1 2 303.369 4.015 20 0 DIADLO COc1c(F)cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1F ZINC001213090102 1050587043 /nfs/dbraw/zinc/58/70/43/1050587043.db2.gz UOMPQGYUXAJWSM-UHFFFAOYSA-N 1 2 301.296 4.107 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)cc1F ZINC001144466574 1050592845 /nfs/dbraw/zinc/59/28/45/1050592845.db2.gz PBMROSSXVFLKJY-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)cc1F ZINC001144466574 1050592847 /nfs/dbraw/zinc/59/28/47/1050592847.db2.gz PBMROSSXVFLKJY-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+]2CCc3cc(F)ccc3C2)c1 ZINC001144490197 1050598593 /nfs/dbraw/zinc/59/85/93/1050598593.db2.gz WASZUOCBGWDJBY-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(Cl)cc(C[N@H+]2CCc3cc(F)ccc3C2)c1 ZINC001144490197 1050598608 /nfs/dbraw/zinc/59/86/08/1050598608.db2.gz WASZUOCBGWDJBY-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CCC[C@@]2(CC2(F)F)C1 ZINC000845744242 1050611470 /nfs/dbraw/zinc/61/14/70/1050611470.db2.gz RRYBDEHYQNVMJC-QGZVFWFLSA-N 1 2 318.367 4.177 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c(F)c1 ZINC001144541630 1050611534 /nfs/dbraw/zinc/61/15/34/1050611534.db2.gz IEXLGTMVEUIJJG-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c(F)c1 ZINC001144541630 1050611546 /nfs/dbraw/zinc/61/15/46/1050611546.db2.gz IEXLGTMVEUIJJG-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c(F)c1 ZINC001144554633 1050612396 /nfs/dbraw/zinc/61/23/96/1050612396.db2.gz CUGFCMDJLPAPIS-KRWDZBQOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c(F)c1 ZINC001144554633 1050612399 /nfs/dbraw/zinc/61/23/99/1050612399.db2.gz CUGFCMDJLPAPIS-KRWDZBQOSA-N 1 2 307.315 4.147 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)cc(O)cc2F)cc1 ZINC001144555176 1050615687 /nfs/dbraw/zinc/61/56/87/1050615687.db2.gz YKFZGKCXRISPLS-SFHVURJKSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)cc(O)cc2F)cc1 ZINC001144555176 1050615694 /nfs/dbraw/zinc/61/56/94/1050615694.db2.gz YKFZGKCXRISPLS-SFHVURJKSA-N 1 2 319.351 4.016 20 0 DIADLO CSc1ccccc1[C@@H]1CCCN1Cc1[nH+]cn2ccccc12 ZINC001144625627 1050630242 /nfs/dbraw/zinc/63/02/42/1050630242.db2.gz QWDZCNOGPALEQW-KRWDZBQOSA-N 1 2 323.465 4.393 20 0 DIADLO CC[C@H](OC(=O)CCCn1cc[nH+]c1)c1cccc(Cl)c1F ZINC000787959919 1050633417 /nfs/dbraw/zinc/63/34/17/1050633417.db2.gz KKBFSAUUFIQBMD-AWEZNQCLSA-N 1 2 324.783 4.150 20 0 DIADLO CCOc1cc[nH+]cc1Nc1c(OC)cccc1C(F)(F)F ZINC001213341193 1050634244 /nfs/dbraw/zinc/63/42/44/1050634244.db2.gz OJWMXMVIYDUPDF-UHFFFAOYSA-N 1 2 312.291 4.251 20 0 DIADLO Oc1cc(F)c(C[NH+]2CCC(c3ccc(F)cc3)CC2)cc1F ZINC001144667095 1050645047 /nfs/dbraw/zinc/64/50/47/1050645047.db2.gz RSSVAUHHEAXVFG-UHFFFAOYSA-N 1 2 321.342 4.189 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(F)c(O)cc1F ZINC001144667073 1050645445 /nfs/dbraw/zinc/64/54/45/1050645445.db2.gz RDJIUHIHZLAKKB-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc(F)c(O)cc1F ZINC001144667073 1050645454 /nfs/dbraw/zinc/64/54/54/1050645454.db2.gz RDJIUHIHZLAKKB-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO C[N@H+](Cc1cc(F)c(O)cc1F)Cc1cccc2ccccc21 ZINC001144666751 1050645681 /nfs/dbraw/zinc/64/56/81/1050645681.db2.gz OUERACSTZVWBPT-UHFFFAOYSA-N 1 2 313.347 4.456 20 0 DIADLO C[N@@H+](Cc1cc(F)c(O)cc1F)Cc1cccc2ccccc21 ZINC001144666751 1050645690 /nfs/dbraw/zinc/64/56/90/1050645690.db2.gz OUERACSTZVWBPT-UHFFFAOYSA-N 1 2 313.347 4.456 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)OCc1ccc(Cl)s1)c1ccccc1 ZINC000741150195 1050662743 /nfs/dbraw/zinc/66/27/43/1050662743.db2.gz ABGDKVHYHPXGKX-HNNXBMFYSA-N 1 2 323.845 4.138 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)OCc1ccc(Cl)s1)c1ccccc1 ZINC000741150195 1050662753 /nfs/dbraw/zinc/66/27/53/1050662753.db2.gz ABGDKVHYHPXGKX-HNNXBMFYSA-N 1 2 323.845 4.138 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)OCc1cccc(Cl)c1)c1ccccc1 ZINC000741150913 1050663383 /nfs/dbraw/zinc/66/33/83/1050663383.db2.gz PPIHFFISPPJCCQ-QGZVFWFLSA-N 1 2 317.816 4.076 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)OCc1cccc(Cl)c1)c1ccccc1 ZINC000741150913 1050663389 /nfs/dbraw/zinc/66/33/89/1050663389.db2.gz PPIHFFISPPJCCQ-QGZVFWFLSA-N 1 2 317.816 4.076 20 0 DIADLO Cc1c(Nc2ccccc2C[NH+]2CCOCC2)cccc1C1CC1 ZINC001213472927 1050665995 /nfs/dbraw/zinc/66/59/95/1050665995.db2.gz FMJGJVDCXZUVIG-UHFFFAOYSA-N 1 2 322.452 4.448 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnn(Cc2ccccc2)c1 ZINC001213491301 1050669427 /nfs/dbraw/zinc/66/94/27/1050669427.db2.gz GONPEUGQMSJCER-UHFFFAOYSA-N 1 2 304.397 4.256 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1c(F)c(F)nc(F)c1Cl ZINC001213492197 1050670023 /nfs/dbraw/zinc/67/00/23/1050670023.db2.gz ZNEWADRPKOJXPZ-UHFFFAOYSA-N 1 2 313.710 4.477 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnc(F)c(Br)c1 ZINC001213488876 1050670112 /nfs/dbraw/zinc/67/01/12/1050670112.db2.gz FKDNJABFJPPLLC-UHFFFAOYSA-N 1 2 322.181 4.308 20 0 DIADLO Cc1cc(C)c(Nc2c(Cl)c(F)nc(F)c2Cl)c[nH+]1 ZINC001213505915 1050670688 /nfs/dbraw/zinc/67/06/88/1050670688.db2.gz SPWMZVSGCOBRLZ-UHFFFAOYSA-N 1 2 304.127 4.422 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnc2c(C(C)C)cnn2c1 ZINC001213497631 1050671474 /nfs/dbraw/zinc/67/14/74/1050671474.db2.gz ZCVAWODZYCAFPU-UHFFFAOYSA-N 1 2 307.401 4.177 20 0 DIADLO COC(Cc1ccccc1Nc1cc(C2CC2)c[nH+]c1C)OC ZINC001213499586 1050672598 /nfs/dbraw/zinc/67/25/98/1050672598.db2.gz QQGFHPIWQWKEPN-UHFFFAOYSA-N 1 2 312.413 4.172 20 0 DIADLO Cc1cc(C)c(Nc2ccnc(NC(=O)OC(C)(C)C)c2)c[nH+]1 ZINC001213503546 1050674330 /nfs/dbraw/zinc/67/43/30/1050674330.db2.gz LXBDDTIIOJLVHA-UHFFFAOYSA-N 1 2 314.389 4.184 20 0 DIADLO COC(=O)c1ccc(Nc2cc(C3CC3)c[nH+]c2C)c(C(C)=O)c1 ZINC001213501422 1050674696 /nfs/dbraw/zinc/67/46/96/1050674696.db2.gz XVCIBGHZJJPONE-UHFFFAOYSA-N 1 2 324.380 4.000 20 0 DIADLO Cc1c[nH+]cc(Nc2cc(Cl)cc(Br)n2)c1C ZINC001213527620 1050680534 /nfs/dbraw/zinc/68/05/34/1050680534.db2.gz WENBOKDYMXUXDA-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO COc1c(Br)cccc1Nc1c[nH+]c(C)cc1C ZINC001213518384 1050677309 /nfs/dbraw/zinc/67/73/09/1050677309.db2.gz LKBYXNDPIXFUBY-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO CCOC(=O)c1ccc(Nc2c[nH+]c(C)cc2C)cc1Cl ZINC001213515707 1050677732 /nfs/dbraw/zinc/67/77/32/1050677732.db2.gz GAAHIICWLDLCSF-UHFFFAOYSA-N 1 2 304.777 4.272 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(NC(=O)OC(C)(C)C)nc2)c1C ZINC001213527606 1050678827 /nfs/dbraw/zinc/67/88/27/1050678827.db2.gz VKPVVUILVCNGHG-UHFFFAOYSA-N 1 2 314.389 4.184 20 0 DIADLO Cc1cc(C)c(Nc2cccc([C@@H]3CN4C=CSC4=N3)c2)c[nH+]1 ZINC001213520460 1050679013 /nfs/dbraw/zinc/67/90/13/1050679013.db2.gz BNINIAOUGBLOQT-KRWDZBQOSA-N 1 2 322.437 4.373 20 0 DIADLO COc1cccc(Nc2c[nH+]c(C)cc2C)c1C(=O)C(F)(F)F ZINC001213520555 1050679205 /nfs/dbraw/zinc/67/92/05/1050679205.db2.gz DXBZFAYFVVHJGR-UHFFFAOYSA-N 1 2 324.302 4.196 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc3nc(-c4ccccc4)nn3c2)c1C ZINC001213528600 1050679257 /nfs/dbraw/zinc/67/92/57/1050679257.db2.gz HUXRVFFFIOJLSK-UHFFFAOYSA-N 1 2 315.380 4.152 20 0 DIADLO Cc1cc(Nc2c[nH+]cc(C)c2C)n(Cc2ccccc2F)n1 ZINC001213527167 1050679839 /nfs/dbraw/zinc/67/98/39/1050679839.db2.gz BGTWVDHMYJVFGT-UHFFFAOYSA-N 1 2 310.376 4.134 20 0 DIADLO Cc1c[nH+]cc(Nc2ncc(Br)cc2Cl)c1C ZINC001213523686 1050680294 /nfs/dbraw/zinc/68/02/94/1050680294.db2.gz ZHWOACBOAUUYIX-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1c[nH+]cc(Nc2cccc([C@H]3CN4C=CSC4=N3)c2)c1C ZINC001213534062 1050681514 /nfs/dbraw/zinc/68/15/14/1050681514.db2.gz KOFAYHYZJBFXTC-QGZVFWFLSA-N 1 2 322.437 4.373 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(N3CCSCC3)c(F)c2)c1C ZINC001213534000 1050681690 /nfs/dbraw/zinc/68/16/90/1050681690.db2.gz HHPXJYRLZMFEKA-UHFFFAOYSA-N 1 2 317.433 4.134 20 0 DIADLO CC(=O)c1ccc(Nc2c[nH+]cc(C)c2C)c(Br)c1 ZINC001213532562 1050682042 /nfs/dbraw/zinc/68/20/42/1050682042.db2.gz OGWXHOUKSXAFQX-UHFFFAOYSA-N 1 2 319.202 4.407 20 0 DIADLO COc1ccc(Nc2c[nH+]cc(C)c2C)cc1Br ZINC001213530516 1050682604 /nfs/dbraw/zinc/68/26/04/1050682604.db2.gz DLVDSMHWVCHBED-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc(Oc3cc[nH]c(=O)c3)cc2)c1C ZINC001213532427 1050682800 /nfs/dbraw/zinc/68/28/00/1050682800.db2.gz HMQUMVQVHZRJKO-UHFFFAOYSA-N 1 2 307.353 4.335 20 0 DIADLO CNc1cccc(Br)c1Nc1c[nH+]cc(C)c1C ZINC001213532332 1050682844 /nfs/dbraw/zinc/68/28/44/1050682844.db2.gz BZKZGLLAPPKXDG-UHFFFAOYSA-N 1 2 306.207 4.246 20 0 DIADLO Cc1ccc(C[S@](=O)Cc2cccc(C(C)C)c2)c(C)[nH+]1 ZINC000596037869 1050683981 /nfs/dbraw/zinc/68/39/81/1050683981.db2.gz OJELPAQDAVGPHF-OAQYLSRUSA-N 1 2 301.455 4.271 20 0 DIADLO Fc1cc(Cl)c(C[NH+]2CCC(OC3CCC3)CC2)cc1F ZINC001144722059 1050684124 /nfs/dbraw/zinc/68/41/24/1050684124.db2.gz MHJRRQWOMHKQCL-UHFFFAOYSA-N 1 2 315.791 4.152 20 0 DIADLO COC(=O)Cc1cc[nH+]c(N[C@H](C)c2oc3ccccc3c2C)c1 ZINC000596081054 1050686304 /nfs/dbraw/zinc/68/63/04/1050686304.db2.gz BUVPNDYPYAFPEG-CYBMUJFWSA-N 1 2 324.380 4.025 20 0 DIADLO COCc1ccc(C)c(Nc2[nH+]cccc2N2CCCCC2)c1 ZINC001213574064 1050687840 /nfs/dbraw/zinc/68/78/40/1050687840.db2.gz SUXLMWCZNRCSQF-UHFFFAOYSA-N 1 2 311.429 4.270 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2cnc(Cl)cn2)o1 ZINC000788480059 1050688226 /nfs/dbraw/zinc/68/82/26/1050688226.db2.gz GYBLEKVGVBNXOG-CQSZACIVSA-N 1 2 305.809 4.149 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2cnc(Cl)cn2)o1 ZINC000788480059 1050688230 /nfs/dbraw/zinc/68/82/30/1050688230.db2.gz GYBLEKVGVBNXOG-CQSZACIVSA-N 1 2 305.809 4.149 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)CC[C@]1(C)O ZINC001231599041 1050697442 /nfs/dbraw/zinc/69/74/42/1050697442.db2.gz ZLIDLPJOLVIPRA-XPTSAGLGSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)CC[C@]1(C)O ZINC001231599041 1050697444 /nfs/dbraw/zinc/69/74/44/1050697444.db2.gz ZLIDLPJOLVIPRA-XPTSAGLGSA-N 1 2 322.663 4.240 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@@H]2CCc3ccc(Cl)nc32)n1 ZINC000788595745 1050711756 /nfs/dbraw/zinc/71/17/56/1050711756.db2.gz VPVILLZOTZSDCK-LLVKDONJSA-N 1 2 321.877 4.266 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@@H]2CCc3ccc(Cl)nc32)on1 ZINC000788616121 1050715866 /nfs/dbraw/zinc/71/58/66/1050715866.db2.gz XDZHHITXIOODLT-CQSZACIVSA-N 1 2 319.836 4.404 20 0 DIADLO Cc1ccc[nH+]c1Nc1ccc2cnn(C(=O)OC(C)(C)C)c2c1 ZINC001213721985 1050725095 /nfs/dbraw/zinc/72/50/95/1050725095.db2.gz RCPBBIDGVXWQDE-UHFFFAOYSA-N 1 2 324.384 4.267 20 0 DIADLO CCN(CC)c1ccc(N[C@H]2CCc3ccc(Cl)nc32)c[nH+]1 ZINC000788710736 1050730751 /nfs/dbraw/zinc/73/07/51/1050730751.db2.gz IMVCJCMPKQPWQA-AWEZNQCLSA-N 1 2 316.836 4.076 20 0 DIADLO CCN(CC)c1ccc(N[C@@H]2CCc3ccc(Cl)nc32)c[nH+]1 ZINC000788710737 1050731250 /nfs/dbraw/zinc/73/12/50/1050731250.db2.gz IMVCJCMPKQPWQA-CQSZACIVSA-N 1 2 316.836 4.076 20 0 DIADLO Cc1cc(N[C@H]2CCc3ccc(Cl)nc32)ccc1[NH+](C)C ZINC000788729142 1050735244 /nfs/dbraw/zinc/73/52/44/1050735244.db2.gz QQSTVAPYILROGV-AWEZNQCLSA-N 1 2 301.821 4.209 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@@H]3CCCc4ccc(O)cc43)ccc21 ZINC000788730008 1050735977 /nfs/dbraw/zinc/73/59/77/1050735977.db2.gz WGUSALZZKLPLEP-LJQANCHMSA-N 1 2 308.425 4.264 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@@H]3CCCc4ccc(O)cc43)ccc21 ZINC000788730008 1050735994 /nfs/dbraw/zinc/73/59/94/1050735994.db2.gz WGUSALZZKLPLEP-LJQANCHMSA-N 1 2 308.425 4.264 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000741783898 1050740458 /nfs/dbraw/zinc/74/04/58/1050740458.db2.gz DHNWKQHIENWLQS-KSSFIOAISA-N 1 2 314.429 4.037 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000741783898 1050740474 /nfs/dbraw/zinc/74/04/74/1050740474.db2.gz DHNWKQHIENWLQS-KSSFIOAISA-N 1 2 314.429 4.037 20 0 DIADLO COc1cccc(Nc2ccc(N3CCCC3)[nH+]c2)c1C1CC1 ZINC001213803221 1050745807 /nfs/dbraw/zinc/74/58/07/1050745807.db2.gz XXHSPESODIQJGY-UHFFFAOYSA-N 1 2 309.413 4.311 20 0 DIADLO Cc1ncc(C(F)(F)F)cc1Nc1[nH+]c2ccccc2n1C ZINC001213825223 1050752727 /nfs/dbraw/zinc/75/27/27/1050752727.db2.gz UHHSYDOIDBDYIQ-UHFFFAOYSA-N 1 2 306.291 4.039 20 0 DIADLO CN(C)c1ccc(Nc2ccc(N3CCCCC3)cc2F)c[nH+]1 ZINC001213835073 1050759176 /nfs/dbraw/zinc/75/91/76/1050759176.db2.gz IQRALFYHOCIGJB-UHFFFAOYSA-N 1 2 314.408 4.021 20 0 DIADLO Fc1cc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)cnc1Cl ZINC000846809051 1050761070 /nfs/dbraw/zinc/76/10/70/1050761070.db2.gz PIIHHBGSXFUTPU-HNNXBMFYSA-N 1 2 322.836 4.164 20 0 DIADLO Fc1cc(C[N@H+]2CCS[C@H](c3ccccc3)C2)cnc1Cl ZINC000846809051 1050761084 /nfs/dbraw/zinc/76/10/84/1050761084.db2.gz PIIHHBGSXFUTPU-HNNXBMFYSA-N 1 2 322.836 4.164 20 0 DIADLO c1nsnc1C[NH2+][C@H](CCCc1ccccc1)c1ccccc1 ZINC000846816357 1050763136 /nfs/dbraw/zinc/76/31/36/1050763136.db2.gz FMZURBJBJFIDGY-LJQANCHMSA-N 1 2 323.465 4.392 20 0 DIADLO c1nsnc1C[NH2+][C@@H](CCCc1ccccc1)c1ccccc1 ZINC000846816355 1050763219 /nfs/dbraw/zinc/76/32/19/1050763219.db2.gz FMZURBJBJFIDGY-IBGZPJMESA-N 1 2 323.465 4.392 20 0 DIADLO CCC[C@@H]([NH2+]Cc1cnsn1)c1cccc(C(F)(F)F)c1 ZINC000846845584 1050769353 /nfs/dbraw/zinc/76/93/53/1050769353.db2.gz YTEXHGFISQGCQS-CYBMUJFWSA-N 1 2 315.364 4.188 20 0 DIADLO c1nsnc1C[NH2+][C@H](CC1CCCCC1)c1ccccc1 ZINC000846845607 1050769441 /nfs/dbraw/zinc/76/94/41/1050769441.db2.gz ZHZJQYHHZBKWQE-QGZVFWFLSA-N 1 2 301.459 4.339 20 0 DIADLO Clc1cccc([C@@H]([NH2+]Cc2cnsn2)C2CCCC2)c1 ZINC000846847446 1050771949 /nfs/dbraw/zinc/77/19/49/1050771949.db2.gz ZOJSSPAGZWVDBG-HNNXBMFYSA-N 1 2 307.850 4.213 20 0 DIADLO c1cc(N2CCCC2)ccc1[NH2+][C@@H]1CCCC[C@H]1[C@H]1CCOC1 ZINC000788986669 1050772930 /nfs/dbraw/zinc/77/29/30/1050772930.db2.gz YPTBAIIFKSVNES-FFZOFVMBSA-N 1 2 314.473 4.294 20 0 DIADLO c1cc([NH+]2CCCC2)ccc1N[C@@H]1CCCC[C@H]1[C@H]1CCOC1 ZINC000788986669 1050772939 /nfs/dbraw/zinc/77/29/39/1050772939.db2.gz YPTBAIIFKSVNES-FFZOFVMBSA-N 1 2 314.473 4.294 20 0 DIADLO C[C@H]([NH2+]c1ccc(N2CCOCC2)cc1)C1CCC(F)(F)CC1 ZINC000788986702 1050774459 /nfs/dbraw/zinc/77/44/59/1050774459.db2.gz YWBQOJIAVXUZBX-AWEZNQCLSA-N 1 2 324.415 4.149 20 0 DIADLO CC(C)c1cc(NCc2ccc([C@H](C)O)cc2)nc(C(C)C)[nH+]1 ZINC000761206625 1050780077 /nfs/dbraw/zinc/78/00/77/1050780077.db2.gz XJHHTIFPMJGTDI-AWEZNQCLSA-N 1 2 313.445 4.389 20 0 DIADLO COc1cc(F)c(Nc2[nH+]c3ccccc3n2C)cc1Cl ZINC001214058120 1050805629 /nfs/dbraw/zinc/80/56/29/1050805629.db2.gz GCVZSZKOEIYNTE-UHFFFAOYSA-N 1 2 305.740 4.118 20 0 DIADLO Cc1cc(N)ccc1Nc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001214105419 1050820670 /nfs/dbraw/zinc/82/06/70/1050820670.db2.gz FUEBYZCTMULJGE-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO CC/C(=C\C(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccc(OC)cc1 ZINC000746806660 1050830133 /nfs/dbraw/zinc/83/01/33/1050830133.db2.gz VKVMIDHKWWCESH-FOWTUZBSSA-N 1 2 324.424 4.448 20 0 DIADLO CC/C(=C/C(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccc(OC)cc1 ZINC000746806661 1050830666 /nfs/dbraw/zinc/83/06/66/1050830666.db2.gz VKVMIDHKWWCESH-VBKFSLOCSA-N 1 2 324.424 4.448 20 0 DIADLO CC(C)C[C@H](C(=O)N1CCC[C@H](C(C)(C)C)CC1)n1cc[nH+]c1 ZINC001146669292 1050834919 /nfs/dbraw/zinc/83/49/19/1050834919.db2.gz MOCSKWMOXKPDOW-DLBZAZTESA-N 1 2 319.493 4.145 20 0 DIADLO CC(C)C[C@H](C(=O)N1CCC[C@@H](C(C)(C)C)CC1)n1cc[nH+]c1 ZINC001146669293 1050835458 /nfs/dbraw/zinc/83/54/58/1050835458.db2.gz MOCSKWMOXKPDOW-IAGOWNOFSA-N 1 2 319.493 4.145 20 0 DIADLO CC(C)c1cc(N[C@@H]2COCc3ccccc32)nc(C(C)C)[nH+]1 ZINC001171292738 1050853213 /nfs/dbraw/zinc/85/32/13/1050853213.db2.gz XSEVMWFIUWNENG-QGZVFWFLSA-N 1 2 311.429 4.407 20 0 DIADLO Cc1cccc(N2CC[NH+](Cc3c(F)cccc3Cl)CC2)c1 ZINC000302910596 1050873789 /nfs/dbraw/zinc/87/37/89/1050873789.db2.gz LWPQDSDCEQSJIW-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1cc(OC(F)(F)F)ccc1O ZINC001214380177 1050887596 /nfs/dbraw/zinc/88/75/96/1050887596.db2.gz HIEZMZXNJBDEAV-UHFFFAOYSA-N 1 2 312.291 4.300 20 0 DIADLO Cc1ccc([C@H](C)C(=O)Nc2cccc(-c3[nH]c(C)c(C)[nH+]3)c2)o1 ZINC000742579456 1050890727 /nfs/dbraw/zinc/89/07/27/1050890727.db2.gz YYVFRMLOFLVVDR-LBPRGKRZSA-N 1 2 323.396 4.337 20 0 DIADLO CCCCC[C@@H](C)CC(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000742575617 1050892421 /nfs/dbraw/zinc/89/24/21/1050892421.db2.gz GJFIZIJRGHGIMD-HZPDHXFCSA-N 1 2 307.482 4.021 20 0 DIADLO CC[C@H](Cc1ccccc1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000602125277 1050905098 /nfs/dbraw/zinc/90/50/98/1050905098.db2.gz RJFZFGZRYXAYET-MRXNPFEDSA-N 1 2 319.408 4.284 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1c(F)ccc(Cl)c1Cl ZINC001214506930 1050927622 /nfs/dbraw/zinc/92/76/22/1050927622.db2.gz DGFQALIFDULVEW-UHFFFAOYSA-N 1 2 310.159 4.362 20 0 DIADLO C[C@@H](C(=O)Nc1ccc2ccccc2c1)[NH+]1Cc2ccccc2C1 ZINC000772750674 1050937042 /nfs/dbraw/zinc/93/70/42/1050937042.db2.gz LSDICBPFAOJQMJ-HNNXBMFYSA-N 1 2 316.404 4.183 20 0 DIADLO COC(=O)c1cccc(Nc2c(C)cc[nH+]c2C(C)C)c1F ZINC001214576882 1050948604 /nfs/dbraw/zinc/94/86/04/1050948604.db2.gz UMURWBVGBWPNIA-UHFFFAOYSA-N 1 2 302.349 4.183 20 0 DIADLO O[C@@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2F)C2(CCC2)C1 ZINC001171333352 1050953661 /nfs/dbraw/zinc/95/36/61/1050953661.db2.gz VQRVYGCTMYGLLF-GFCCVEGCSA-N 1 2 318.219 4.012 20 0 DIADLO O[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C2(CCC2)C1 ZINC001171333352 1050953668 /nfs/dbraw/zinc/95/36/68/1050953668.db2.gz VQRVYGCTMYGLLF-GFCCVEGCSA-N 1 2 318.219 4.012 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1ncc(C(C)(C)C)s1 ZINC000790467518 1050967272 /nfs/dbraw/zinc/96/72/72/1050967272.db2.gz FWXBKOIIZBCIFN-UHFFFAOYSA-N 1 2 303.475 4.427 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccsc2)oc1C)Cc1ccncc1 ZINC000348111668 1050988903 /nfs/dbraw/zinc/98/89/03/1050988903.db2.gz OYYQEQKIMUZCFD-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccsc2)oc1C)Cc1ccncc1 ZINC000348111668 1050988909 /nfs/dbraw/zinc/98/89/09/1050988909.db2.gz OYYQEQKIMUZCFD-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO Cc1nc(N[C@H](Cc2ccc(Cl)cc2)c2ccccn2)cc[nH+]1 ZINC000348125220 1050990383 /nfs/dbraw/zinc/99/03/83/1050990383.db2.gz NLFZKHCHDZIQGA-QGZVFWFLSA-N 1 2 324.815 4.229 20 0 DIADLO c1ccc(N2Cc3cccc(N[C@H]4CCC45CCC5)c3C2)[nH+]c1 ZINC000282735378 1050992152 /nfs/dbraw/zinc/99/21/52/1050992152.db2.gz MVLBMSZCUUWAIA-SFHVURJKSA-N 1 2 305.425 4.346 20 0 DIADLO CCCCOC1CC[NH+](Cc2ncc(Cl)cc2Cl)CC1 ZINC000348152135 1050993635 /nfs/dbraw/zinc/99/36/35/1050993635.db2.gz ORHYAKCASZAPTC-UHFFFAOYSA-N 1 2 317.260 4.170 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@H](Cc1ccccc1)c1cccs1 ZINC000180903859 1051016037 /nfs/dbraw/zinc/01/60/37/1051016037.db2.gz KGFBUHHPYVBECN-CXAGYDPISA-N 1 2 311.454 4.414 20 0 DIADLO CCC[C@@H]1CC(=O)N(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC000743348462 1051020673 /nfs/dbraw/zinc/02/06/73/1051020673.db2.gz MTELCSGXXWSWAV-RHSMWYFYSA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@@H]1CC(=O)N(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC000743348462 1051020684 /nfs/dbraw/zinc/02/06/84/1051020684.db2.gz MTELCSGXXWSWAV-RHSMWYFYSA-N 1 2 320.864 4.083 20 0 DIADLO CCNC(=O)c1ccc(Nc2ccc3c(C)cc[nH+]c3c2)c(F)c1 ZINC001214898076 1051021952 /nfs/dbraw/zinc/02/19/52/1051021952.db2.gz ABCVNKGHSIBFIQ-UHFFFAOYSA-N 1 2 323.371 4.176 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2c1cccc2Cl)c1cccnc1Cl ZINC000773038794 1051035218 /nfs/dbraw/zinc/03/52/18/1051035218.db2.gz CFOLCFUCAGLGDD-RNCFNFMXSA-N 1 2 309.196 4.173 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1cnn(-c2ccccc2)c1 ZINC000773051629 1051041747 /nfs/dbraw/zinc/04/17/47/1051041747.db2.gz LVEDNCIUURHPFB-ZDUSSCGKSA-N 1 2 324.453 4.057 20 0 DIADLO CCN(CC)C(=O)c1cccc(Nc2ccc(C)[nH+]c2C)c1F ZINC001215009127 1051050537 /nfs/dbraw/zinc/05/05/37/1051050537.db2.gz QPPBEEOODIXARM-UHFFFAOYSA-N 1 2 315.392 4.063 20 0 DIADLO Cc1[nH]ncc1[C@H](C)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000181075296 1051053392 /nfs/dbraw/zinc/05/33/92/1051053392.db2.gz SKFDTHSCAOSZHQ-GJZGRUSLSA-N 1 2 312.461 4.266 20 0 DIADLO Cc1[nH]ncc1[C@H](C)Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000181075296 1051053409 /nfs/dbraw/zinc/05/34/09/1051053409.db2.gz SKFDTHSCAOSZHQ-GJZGRUSLSA-N 1 2 312.461 4.266 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(F)n1)c1cc(Cl)sc1Cl ZINC000773083979 1051054610 /nfs/dbraw/zinc/05/46/10/1051054610.db2.gz ADTDTPZMIXDVJC-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)nc(Cl)c1 ZINC000791583142 1051061013 /nfs/dbraw/zinc/06/10/13/1051061013.db2.gz LKWZZRANETYELB-APPZFPTMSA-N 1 2 313.150 4.161 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(Cl)nc(Cl)c1 ZINC000791583142 1051061021 /nfs/dbraw/zinc/06/10/21/1051061021.db2.gz LKWZZRANETYELB-APPZFPTMSA-N 1 2 313.150 4.161 20 0 DIADLO CC(C)Oc1ccc(F)c(F)c1Nc1ccc2c(c1)[nH+]cn2C ZINC001215078966 1051072542 /nfs/dbraw/zinc/07/25/42/1051072542.db2.gz PFMBHCILEACGRQ-UHFFFAOYSA-N 1 2 317.339 4.382 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2cccc(Cl)n2)[C@H]1c1ccccc1 ZINC000743850211 1051073794 /nfs/dbraw/zinc/07/37/94/1051073794.db2.gz PSSURGIRZWKHGA-CXAGYDPISA-N 1 2 318.873 4.414 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2cccc(Cl)n2)[C@H]1c1ccccc1 ZINC000743850211 1051073801 /nfs/dbraw/zinc/07/38/01/1051073801.db2.gz PSSURGIRZWKHGA-CXAGYDPISA-N 1 2 318.873 4.414 20 0 DIADLO Cc1ccc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)c(C)c1 ZINC001215164585 1051095595 /nfs/dbraw/zinc/09/55/95/1051095595.db2.gz RXGJJWAQYYXXCD-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(Nc2ccccc2)n1)c1cccnc1 ZINC000181295195 1051106691 /nfs/dbraw/zinc/10/66/91/1051106691.db2.gz WGTGLCUTJAIJQH-CYBMUJFWSA-N 1 2 310.426 4.133 20 0 DIADLO Cc1[nH+]cccc1NCCc1ccc(OCc2ccccn2)cc1 ZINC001171426299 1051115119 /nfs/dbraw/zinc/11/51/19/1051115119.db2.gz QTZNBMMHSSRJFI-UHFFFAOYSA-N 1 2 319.408 4.019 20 0 DIADLO CCCCn1nc(C)c(C[N@H+](C)Cc2ccn(CC)c2)c1Cl ZINC000792184262 1051124743 /nfs/dbraw/zinc/12/47/43/1051124743.db2.gz UJGASNDAFSOSCB-UHFFFAOYSA-N 1 2 322.884 4.098 20 0 DIADLO CCCCn1nc(C)c(C[N@@H+](C)Cc2ccn(CC)c2)c1Cl ZINC000792184262 1051124754 /nfs/dbraw/zinc/12/47/54/1051124754.db2.gz UJGASNDAFSOSCB-UHFFFAOYSA-N 1 2 322.884 4.098 20 0 DIADLO CCn1ccc(C[N@H+](C)Cc2cc3ccccc3nc2Cl)c1 ZINC000792314602 1051132250 /nfs/dbraw/zinc/13/22/50/1051132250.db2.gz VUXUHAQQBRURJE-UHFFFAOYSA-N 1 2 313.832 4.342 20 0 DIADLO CCn1ccc(C[N@@H+](C)Cc2cc3ccccc3nc2Cl)c1 ZINC000792314602 1051132256 /nfs/dbraw/zinc/13/22/56/1051132256.db2.gz VUXUHAQQBRURJE-UHFFFAOYSA-N 1 2 313.832 4.342 20 0 DIADLO Cc1cccc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)c1F ZINC001215252766 1051134621 /nfs/dbraw/zinc/13/46/21/1051134621.db2.gz LFYBHOMCRHKGPI-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CC(C)c1cc(NCc2cccc3ncoc32)nc(C(C)C)[nH+]1 ZINC001171455872 1051138359 /nfs/dbraw/zinc/13/83/59/1051138359.db2.gz LWMMETOCYAWUAG-UHFFFAOYSA-N 1 2 310.401 4.477 20 0 DIADLO FC(F)(F)[C@H](Nc1cc2ccccc2c[nH+]1)c1ccccn1 ZINC001157685269 1051138510 /nfs/dbraw/zinc/13/85/10/1051138510.db2.gz XJZBWRJMFYLZON-OAHLLOKOSA-N 1 2 303.287 4.345 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(NCC2(c3ccccc3)CC2)c1 ZINC001171464778 1051141498 /nfs/dbraw/zinc/14/14/98/1051141498.db2.gz FARFTGVZLGWDIB-UHFFFAOYSA-N 1 2 303.409 4.231 20 0 DIADLO CC(C)(Nc1ccc(C2(C(F)(F)F)CC2)c[nH+]1)c1ccncc1 ZINC001171513280 1051158397 /nfs/dbraw/zinc/15/83/97/1051158397.db2.gz JFGKVYFPWVHMCZ-UHFFFAOYSA-N 1 2 321.346 4.418 20 0 DIADLO CCC(C)(C)c1ccc(C[N@H+](C)[C@H](C)c2nc(C)no2)cc1 ZINC001171591701 1051161080 /nfs/dbraw/zinc/16/10/80/1051161080.db2.gz NVNGUWDRQLKAEB-CYBMUJFWSA-N 1 2 301.434 4.259 20 0 DIADLO CCC(C)(C)c1ccc(C[N@@H+](C)[C@H](C)c2nc(C)no2)cc1 ZINC001171591701 1051161085 /nfs/dbraw/zinc/16/10/85/1051161085.db2.gz NVNGUWDRQLKAEB-CYBMUJFWSA-N 1 2 301.434 4.259 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2[C@H](C)Cc2ccccc2Cl)no1 ZINC001170286309 1051181905 /nfs/dbraw/zinc/18/19/05/1051181905.db2.gz XNPGFRLYTWXXSY-WBMJQRKESA-N 1 2 319.836 4.190 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2[C@H](C)Cc2ccccc2Cl)no1 ZINC001170286309 1051181909 /nfs/dbraw/zinc/18/19/09/1051181909.db2.gz XNPGFRLYTWXXSY-WBMJQRKESA-N 1 2 319.836 4.190 20 0 DIADLO CCOc1c(Nc2ccc[nH+]c2N2CCCC2)ccc(F)c1F ZINC001215410763 1051192852 /nfs/dbraw/zinc/19/28/52/1051192852.db2.gz DFCKNXGKALSWNR-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO Fc1ccc([C@@H]2COCC[N@@H+]2CC[C@H]2CCCC2(F)F)cc1 ZINC001170341605 1051192937 /nfs/dbraw/zinc/19/29/37/1051192937.db2.gz ARWJVPHBLNJSEY-ZBFHGGJFSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1ccc([C@@H]2COCC[N@H+]2CC[C@H]2CCCC2(F)F)cc1 ZINC001170341605 1051192938 /nfs/dbraw/zinc/19/29/38/1051192938.db2.gz ARWJVPHBLNJSEY-ZBFHGGJFSA-N 1 2 313.363 4.025 20 0 DIADLO CCOc1c(F)c(F)ccc1Nc1cccn2cc(C)[nH+]c12 ZINC001215411099 1051193073 /nfs/dbraw/zinc/19/30/73/1051193073.db2.gz KMUISWYVFYUMNC-UHFFFAOYSA-N 1 2 303.312 4.063 20 0 DIADLO Fc1ccc([C@H]2COCC[N@@H+]2CC[C@@H]2CCCC2(F)F)cc1 ZINC001170341601 1051193520 /nfs/dbraw/zinc/19/35/20/1051193520.db2.gz ARWJVPHBLNJSEY-GOEBONIOSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1ccc([C@H]2COCC[N@H+]2CC[C@@H]2CCCC2(F)F)cc1 ZINC001170341601 1051193527 /nfs/dbraw/zinc/19/35/27/1051193527.db2.gz ARWJVPHBLNJSEY-GOEBONIOSA-N 1 2 313.363 4.025 20 0 DIADLO Cc1nc2ccccc2nc1C[N@H+](Cc1ccccc1F)C1CC1 ZINC000181701807 1051196832 /nfs/dbraw/zinc/19/68/32/1051196832.db2.gz MZIVGLCXZQDDGG-UHFFFAOYSA-N 1 2 321.399 4.242 20 0 DIADLO Cc1nc2ccccc2nc1C[N@@H+](Cc1ccccc1F)C1CC1 ZINC000181701807 1051196841 /nfs/dbraw/zinc/19/68/41/1051196841.db2.gz MZIVGLCXZQDDGG-UHFFFAOYSA-N 1 2 321.399 4.242 20 0 DIADLO CC(C)Oc1c(F)c(F)ccc1Nc1cccn2cc[nH+]c12 ZINC001215420980 1051198958 /nfs/dbraw/zinc/19/89/58/1051198958.db2.gz NNKPURIVIMJQLR-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO Cc1cn2cccc(Nc3ccc(F)c(F)c3OC(C)C)c2[nH+]1 ZINC001215421392 1051199045 /nfs/dbraw/zinc/19/90/45/1051199045.db2.gz WHXJFLWDKSSOJJ-UHFFFAOYSA-N 1 2 317.339 4.452 20 0 DIADLO CCN(CC)c1ccc(N[C@H](C)c2nc(C)sc2C)c[nH+]1 ZINC000037003140 1051216613 /nfs/dbraw/zinc/21/66/13/1051216613.db2.gz GDXYRMCSBNMWHT-LLVKDONJSA-N 1 2 304.463 4.174 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)OC[C@@H](C)c1ccccc1)c1ccccc1 ZINC000745099651 1051221685 /nfs/dbraw/zinc/22/16/85/1051221685.db2.gz KDYYVGQEMDHDCM-APWZRJJASA-N 1 2 311.425 4.026 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)OC[C@@H](C)c1ccccc1)c1ccccc1 ZINC000745099651 1051221694 /nfs/dbraw/zinc/22/16/94/1051221694.db2.gz KDYYVGQEMDHDCM-APWZRJJASA-N 1 2 311.425 4.026 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)OC[C@H](C)c1ccccc1)c1ccccc1 ZINC000745099656 1051221955 /nfs/dbraw/zinc/22/19/55/1051221955.db2.gz KDYYVGQEMDHDCM-LPHOPBHVSA-N 1 2 311.425 4.026 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)OC[C@H](C)c1ccccc1)c1ccccc1 ZINC000745099656 1051221966 /nfs/dbraw/zinc/22/19/66/1051221966.db2.gz KDYYVGQEMDHDCM-LPHOPBHVSA-N 1 2 311.425 4.026 20 0 DIADLO CC(C)Oc1cc(Nc2[nH+]cccc2N2CCCC2)ccc1F ZINC001215498602 1051222194 /nfs/dbraw/zinc/22/21/94/1051222194.db2.gz PHBSYCDWRJVHKX-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO C[C@H](OC(=O)[C@@H]1CCCC[N@@H+]1C)c1ccc(Cl)cc1Cl ZINC000745079691 1051222951 /nfs/dbraw/zinc/22/29/51/1051222951.db2.gz MOETZSPCGQSHQK-HZMBPMFUSA-N 1 2 316.228 4.082 20 0 DIADLO C[C@H](OC(=O)[C@@H]1CCCC[N@H+]1C)c1ccc(Cl)cc1Cl ZINC000745079691 1051222964 /nfs/dbraw/zinc/22/29/64/1051222964.db2.gz MOETZSPCGQSHQK-HZMBPMFUSA-N 1 2 316.228 4.082 20 0 DIADLO COc1cc(C[N@@H+]2CC[C@@H]2c2ccc(F)cc2)ccc1Cl ZINC001171847515 1051233190 /nfs/dbraw/zinc/23/31/90/1051233190.db2.gz NQEWNLUKRKPFSS-MRXNPFEDSA-N 1 2 305.780 4.435 20 0 DIADLO COc1cc(C[N@H+]2CC[C@@H]2c2ccc(F)cc2)ccc1Cl ZINC001171847515 1051233203 /nfs/dbraw/zinc/23/32/03/1051233203.db2.gz NQEWNLUKRKPFSS-MRXNPFEDSA-N 1 2 305.780 4.435 20 0 DIADLO Cn1c2ccccc2[nH+]c1Nc1ccc(C(F)(F)F)cc1O ZINC001212628720 1051234209 /nfs/dbraw/zinc/23/42/09/1051234209.db2.gz DBUSZXBXUXWQNB-UHFFFAOYSA-N 1 2 307.275 4.041 20 0 DIADLO C[N@@H+](Cc1nc2ccc(C(F)(F)F)cc2[nH]1)CC1=CCCC1 ZINC001171893068 1051235471 /nfs/dbraw/zinc/23/54/71/1051235471.db2.gz IEQYIUGKDFLUNQ-UHFFFAOYSA-N 1 2 309.335 4.124 20 0 DIADLO C[N@H+](Cc1nc2ccc(C(F)(F)F)cc2[nH]1)CC1=CCCC1 ZINC001171893068 1051235481 /nfs/dbraw/zinc/23/54/81/1051235481.db2.gz IEQYIUGKDFLUNQ-UHFFFAOYSA-N 1 2 309.335 4.124 20 0 DIADLO Cc1cn2cccc(Nc3ccc(C(F)(F)F)cc3O)c2[nH+]1 ZINC001212630718 1051241891 /nfs/dbraw/zinc/24/18/91/1051241891.db2.gz JADBFWKYOVSMJX-UHFFFAOYSA-N 1 2 307.275 4.111 20 0 DIADLO C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH+]1CC(F)(C2CC2)C1 ZINC001171971530 1051262000 /nfs/dbraw/zinc/26/20/00/1051262000.db2.gz WCKADDJYOAJDPL-LLVKDONJSA-N 1 2 301.327 4.070 20 0 DIADLO Cc1cc(NC(=O)c2sc3ccccc3c2Cl)c(C)c[nH+]1 ZINC000747111188 1051282628 /nfs/dbraw/zinc/28/26/28/1051282628.db2.gz GGDGYQSEYOODGJ-UHFFFAOYSA-N 1 2 316.813 4.241 20 0 DIADLO CC(C)Oc1c(F)cc(F)c(Nc2cccn3cc[nH+]c23)c1F ZINC001212643379 1051312435 /nfs/dbraw/zinc/31/24/35/1051312435.db2.gz ZWSNBYXVXXXXEH-UHFFFAOYSA-N 1 2 321.302 4.282 20 0 DIADLO COc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)cc(C)c1F ZINC001215700103 1051312369 /nfs/dbraw/zinc/31/23/69/1051312369.db2.gz AQDXHFKETJNCTI-UHFFFAOYSA-N 1 2 315.392 4.272 20 0 DIADLO COC(C)(CNc1cc(C)c2cccc(C(C)C)c2[nH+]1)OC ZINC001170434218 1051321926 /nfs/dbraw/zinc/32/19/26/1051321926.db2.gz HSUCZNJMGNKOHY-UHFFFAOYSA-N 1 2 302.418 4.088 20 0 DIADLO C[C@]12CC[N@H+](Cc3cc(F)c(F)cc3F)C[C@H]1C2(Cl)Cl ZINC000793615431 1051329322 /nfs/dbraw/zinc/32/93/22/1051329322.db2.gz RVICLTSPPTVBEV-OLZOCXBDSA-N 1 2 324.173 4.120 20 0 DIADLO C[C@]12CC[N@@H+](Cc3cc(F)c(F)cc3F)C[C@H]1C2(Cl)Cl ZINC000793615431 1051329331 /nfs/dbraw/zinc/32/93/31/1051329331.db2.gz RVICLTSPPTVBEV-OLZOCXBDSA-N 1 2 324.173 4.120 20 0 DIADLO FC(F)C1([NH2+]Cc2ccc(Br)s2)CCCC1 ZINC000381485778 1051371997 /nfs/dbraw/zinc/37/19/97/1051371997.db2.gz ILAVLHMENZVJEP-UHFFFAOYSA-N 1 2 310.207 4.178 20 0 DIADLO Cc1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)c2c[nH]nc21 ZINC001215755515 1051345669 /nfs/dbraw/zinc/34/56/69/1051345669.db2.gz UNRBJYHWYBHOJX-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO CCOc1ccc(C)c(F)c1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001215762688 1051353007 /nfs/dbraw/zinc/35/30/07/1051353007.db2.gz IPUOBLQFIDBANE-UHFFFAOYSA-N 1 2 311.360 4.462 20 0 DIADLO c1cn2c(cccc2Nc2ccnc(Oc3ccccc3)c2)[nH+]1 ZINC001215773073 1051357765 /nfs/dbraw/zinc/35/77/65/1051357765.db2.gz LNTZDCZTOXEHQS-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H](F)c1ccccc1 ZINC000794213133 1051365142 /nfs/dbraw/zinc/36/51/42/1051365142.db2.gz KLIHKWVJQYQBCQ-INIZCTEOSA-N 1 2 309.344 4.034 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@H](C(C)(C)C)C[C@@H]2C)c(C)[nH+]1 ZINC001129395470 1051375154 /nfs/dbraw/zinc/37/51/54/1051375154.db2.gz PWBYEEPVDCVIDL-HOCLYGCPSA-N 1 2 302.462 4.294 20 0 DIADLO CCCOc1cccc2c(N3CCC(OCC)CC3)cc[nH+]c12 ZINC000194706506 1051379478 /nfs/dbraw/zinc/37/94/78/1051379478.db2.gz WRKOARQODROILR-UHFFFAOYSA-N 1 2 314.429 4.029 20 0 DIADLO Cc1ccc(F)c(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)c1 ZINC001215812129 1051385744 /nfs/dbraw/zinc/38/57/44/1051385744.db2.gz ZYOHTTYAWUKKBZ-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO S=c1sc(C2CC2)nn1C[N@@H+]1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000746377968 1051388434 /nfs/dbraw/zinc/38/84/34/1051388434.db2.gz SYIURBNXBIMJGY-KCXRBIIJSA-N 1 2 321.515 4.019 20 0 DIADLO S=c1sc(C2CC2)nn1C[N@H+]1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000746377968 1051388448 /nfs/dbraw/zinc/38/84/48/1051388448.db2.gz SYIURBNXBIMJGY-KCXRBIIJSA-N 1 2 321.515 4.019 20 0 DIADLO C/C(=C\C(=O)Nc1ccn2cc[nH+]c2c1)c1cccc(Cl)c1 ZINC001129479944 1051402168 /nfs/dbraw/zinc/40/21/68/1051402168.db2.gz DIQAPRLXMRDHIX-FMIVXFBMSA-N 1 2 311.772 4.030 20 0 DIADLO CC(C)(C)c1ccc(/C=C/C(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001129482675 1051402752 /nfs/dbraw/zinc/40/27/52/1051402752.db2.gz WFWZDSRWUZKTIF-RMKNXTFCSA-N 1 2 319.408 4.284 20 0 DIADLO CSc1ccc(F)c(Nc2ccc[nH+]c2N2CCCC2)c1F ZINC001215839637 1051404391 /nfs/dbraw/zinc/40/43/91/1051404391.db2.gz QSWBVIUWPQGIQZ-UHFFFAOYSA-N 1 2 321.396 4.426 20 0 DIADLO CCN(CC)c1ccc(NCc2ccc3cnccc3c2)c[nH+]1 ZINC000391834885 1051408107 /nfs/dbraw/zinc/40/81/07/1051408107.db2.gz RQGUAMIWVVDOJT-UHFFFAOYSA-N 1 2 306.413 4.088 20 0 DIADLO Cc1cc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)ccc1F ZINC001215846024 1051411019 /nfs/dbraw/zinc/41/10/19/1051411019.db2.gz MHTNHRXDWBAMTJ-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO O=C(C[NH2+][C@H]1CCC[C@@H](c2ccccc2)C1)OCc1ccccc1 ZINC001172536600 1051418511 /nfs/dbraw/zinc/41/85/11/1051418511.db2.gz FFWKRCZQJITNMH-UXHICEINSA-N 1 2 323.436 4.046 20 0 DIADLO C[NH+](C)Cc1ccccc1Nc1cc(Cl)cc2[nH]ncc21 ZINC001215861064 1051419202 /nfs/dbraw/zinc/41/92/02/1051419202.db2.gz SQXHCQKKBGZWMZ-UHFFFAOYSA-N 1 2 300.793 4.022 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nc(C(F)(F)F)cs2)c(C)o1 ZINC000183798718 1051421596 /nfs/dbraw/zinc/42/15/96/1051421596.db2.gz IDYFOXXUVHGERW-MRVPVSSYSA-N 1 2 304.337 4.223 20 0 DIADLO CSc1cccc(Nc2ccc[nH+]c2N2CCCC2)c1F ZINC001215867170 1051423606 /nfs/dbraw/zinc/42/36/06/1051423606.db2.gz UNNBXOZAPYSDPU-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO C[C@H]([NH2+][C@H]1CC[C@@H](c2ccccc2)C1)C(=O)OCc1ccccc1 ZINC001172551193 1051435298 /nfs/dbraw/zinc/43/52/98/1051435298.db2.gz NWYKRVDGUGUHCM-DBVUQKKJSA-N 1 2 323.436 4.044 20 0 DIADLO CCCc1cc(NCc2cc(C(C)C)no2)nc(CCC)[nH+]1 ZINC001168823412 1051445131 /nfs/dbraw/zinc/44/51/31/1051445131.db2.gz PVBNKZVCKNQWEJ-UHFFFAOYSA-N 1 2 302.422 4.105 20 0 DIADLO CSc1ccc(Nc2ccc[nH+]c2N2CCCCC2)c(C)n1 ZINC001215908102 1051446051 /nfs/dbraw/zinc/44/60/51/1051446051.db2.gz DRDSTEIDQQGDFF-UHFFFAOYSA-N 1 2 314.458 4.241 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C2CCC2)no1)c1ccc(C)c(F)c1 ZINC001168839115 1051449708 /nfs/dbraw/zinc/44/97/08/1051449708.db2.gz SWCRGUFANCKQRE-HNNXBMFYSA-N 1 2 303.381 4.026 20 0 DIADLO Cc1ccc([C@@H](C)Nc2cc[nH+]c3[nH]cc(C(F)(F)F)c32)nc1 ZINC001168857245 1051451893 /nfs/dbraw/zinc/45/18/93/1051451893.db2.gz GQHNIPKDCHWVPE-SNVBAGLBSA-N 1 2 320.318 4.458 20 0 DIADLO CC(C)c1ccc(/C=C\CC(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001129593709 1051454330 /nfs/dbraw/zinc/45/43/30/1051454330.db2.gz FPJNOWAOHWYBAX-ARJAWSKDSA-N 1 2 319.408 4.500 20 0 DIADLO CCCCOC(=O)[C@H](C)[NH2+][C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172543050 1051455120 /nfs/dbraw/zinc/45/51/20/1051455120.db2.gz MBKRYEOWDYLERW-JQHSSLGASA-N 1 2 303.446 4.034 20 0 DIADLO COc1ccc(Nc2ccccc2-n2cc[nH+]c2)cc1SC ZINC001215935299 1051468609 /nfs/dbraw/zinc/46/86/09/1051468609.db2.gz KJNRYYFZZMBLFS-UHFFFAOYSA-N 1 2 311.410 4.346 20 0 DIADLO Fc1ncc(C2CC2)cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001215955419 1051480148 /nfs/dbraw/zinc/48/01/48/1051480148.db2.gz PUMBWNCNAWTSIM-UHFFFAOYSA-N 1 2 312.392 4.227 20 0 DIADLO c1csc(-c2ccc(NCCc3cn4ccccc4[nH+]3)cn2)c1 ZINC001169008373 1051486771 /nfs/dbraw/zinc/48/67/71/1051486771.db2.gz ABDYCXBFGVPAGS-UHFFFAOYSA-N 1 2 320.421 4.112 20 0 DIADLO CSc1cc(F)c(Nc2[nH+]c3ccccc3n2C)cc1F ZINC001215964923 1051488228 /nfs/dbraw/zinc/48/82/28/1051488228.db2.gz IMCZYJOKJZYQME-UHFFFAOYSA-N 1 2 305.353 4.317 20 0 DIADLO CSc1cc(F)c(Nc2ccc3c(c2)[nH+]cn3C)cc1F ZINC001215967688 1051491729 /nfs/dbraw/zinc/49/17/29/1051491729.db2.gz QZKQDZJUVFZDLL-UHFFFAOYSA-N 1 2 305.353 4.317 20 0 DIADLO Oc1cccc(Cl)c1Nc1ccc[nH+]c1N1CCCCC1 ZINC001215983678 1051502420 /nfs/dbraw/zinc/50/24/20/1051502420.db2.gz MSWBGEWYESCODB-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO Nc1ccc(OC(F)(F)F)cc1Nc1[nH+]cccc1C1CC1 ZINC001216015433 1051525464 /nfs/dbraw/zinc/52/54/64/1051525464.db2.gz JMWZPVAMQZSLAS-UHFFFAOYSA-N 1 2 309.291 4.183 20 0 DIADLO CC(C)c1ccc(N)c(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001216020743 1051528607 /nfs/dbraw/zinc/52/86/07/1051528607.db2.gz MBFZZGHGJBFWSZ-UHFFFAOYSA-N 1 2 300.793 4.437 20 0 DIADLO CSc1ncc(Nc2ccc3c(c2)[nH+]cn3C)cc1Cl ZINC001216028318 1051533478 /nfs/dbraw/zinc/53/34/78/1051533478.db2.gz ASONYGQUJHPIJA-UHFFFAOYSA-N 1 2 304.806 4.087 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CCC(=O)[C@@H]2CCCC[C@@H]21 ZINC001172845980 1051535664 /nfs/dbraw/zinc/53/56/64/1051535664.db2.gz AEQNAEUKYPJLFW-XNJGSVPQSA-N 1 2 323.839 4.244 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CCC(=O)[C@@H]2CCCC[C@@H]21 ZINC001172845980 1051535673 /nfs/dbraw/zinc/53/56/73/1051535673.db2.gz AEQNAEUKYPJLFW-XNJGSVPQSA-N 1 2 323.839 4.244 20 0 DIADLO Cc1cc(C)c(CNC(=O)C[C@H]2C[C@@H](C)CC(C)(C)C2)c[nH+]1 ZINC001129842226 1051536223 /nfs/dbraw/zinc/53/62/23/1051536223.db2.gz VSCADMONJOZGOM-CZUORRHYSA-N 1 2 302.462 4.167 20 0 DIADLO CSc1cc(Nc2ccc(N)c(OC(F)(F)F)c2)cc[nH+]1 ZINC001216032044 1051536278 /nfs/dbraw/zinc/53/62/78/1051536278.db2.gz UPRPTQQDMLWUDD-UHFFFAOYSA-N 1 2 315.320 4.028 20 0 DIADLO Cc1cc(CNC(=O)[C@H](CCc2ccccc2)C(C)C)cc(C)[nH+]1 ZINC001129858995 1051541629 /nfs/dbraw/zinc/54/16/29/1051541629.db2.gz WDSNKJOGZIPXNT-HXUWFJFHSA-N 1 2 324.468 4.220 20 0 DIADLO C/C(=C\C(=O)NCc1cc(C)[nH+]c(C)c1)c1cccc(Cl)c1 ZINC001129858334 1051542289 /nfs/dbraw/zinc/54/22/89/1051542289.db2.gz KFFRIHKUPOGREO-KPKJPENVSA-N 1 2 314.816 4.072 20 0 DIADLO Cc1cc(NCc2c(Cl)cncc2Cl)[nH+]c2cc[nH]c21 ZINC001169186769 1051542998 /nfs/dbraw/zinc/54/29/98/1051542998.db2.gz UBSIMSCWUDOTLL-UHFFFAOYSA-N 1 2 307.184 4.185 20 0 DIADLO Cc1cc2cc(NCc3c(Cl)cncc3Cl)[nH+]cc2[nH]1 ZINC001169182862 1051547873 /nfs/dbraw/zinc/54/78/73/1051547873.db2.gz LJNKAIKFHVDHRU-UHFFFAOYSA-N 1 2 307.184 4.185 20 0 DIADLO Clc1cncc(Cl)c1CNc1[nH+]cccc1-n1cccc1 ZINC001169183204 1051548502 /nfs/dbraw/zinc/54/85/02/1051548502.db2.gz SAGAHRLUDOPKCM-UHFFFAOYSA-N 1 2 319.195 4.186 20 0 DIADLO Nc1ccc(Nc2[nH+]cccc2N2CCCC2)cc1C(F)(F)F ZINC001216051454 1051549566 /nfs/dbraw/zinc/54/95/66/1051549566.db2.gz MIKRUFGNZYBVHI-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO Clc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)c2n[nH]cc21 ZINC001216058582 1051554393 /nfs/dbraw/zinc/55/43/93/1051554393.db2.gz YMEUDKVTCZOWTL-UHFFFAOYSA-N 1 2 323.787 4.205 20 0 DIADLO Fc1cccc(F)c1C[N@H+](C[C@@H]1CCCC2(CCC2)O1)C1CC1 ZINC001169224355 1051555760 /nfs/dbraw/zinc/55/57/60/1051555760.db2.gz IAFOYCSRFNLQFJ-HNNXBMFYSA-N 1 2 321.411 4.421 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](C[C@@H]1CCCC2(CCC2)O1)C1CC1 ZINC001169224355 1051555775 /nfs/dbraw/zinc/55/57/75/1051555775.db2.gz IAFOYCSRFNLQFJ-HNNXBMFYSA-N 1 2 321.411 4.421 20 0 DIADLO COc1cc(CCNc2cc(-c3ccc(C)cc3)cc[nH+]2)ccn1 ZINC001169223113 1051556508 /nfs/dbraw/zinc/55/65/08/1051556508.db2.gz ZBTSINDFEGQPOJ-UHFFFAOYSA-N 1 2 319.408 4.115 20 0 DIADLO COc1cccc2[nH+]c(N[C@@H](C3CCC3)C(F)(F)F)ccc21 ZINC001169283062 1051568657 /nfs/dbraw/zinc/56/86/57/1051568657.db2.gz YTJFEGYJAFOXFM-HNNXBMFYSA-N 1 2 310.319 4.386 20 0 DIADLO Cc1cc(Nc2cc(OC(F)(F)F)cc[nH+]2)cc(Cl)c1O ZINC001216086738 1051571097 /nfs/dbraw/zinc/57/10/97/1051571097.db2.gz GFSAHTNDHYFFLW-UHFFFAOYSA-N 1 2 318.682 4.391 20 0 DIADLO Cc1cc(Nc2ccc[nH+]c2N2CCCCC2)cc(Cl)c1O ZINC001216084616 1051571214 /nfs/dbraw/zinc/57/12/14/1051571214.db2.gz YVBANIQTDLKRBX-UHFFFAOYSA-N 1 2 317.820 4.483 20 0 DIADLO FC(F)(F)[C@H](Nc1ccc(Cn2cc[nH+]c2)cc1)C1CCC1 ZINC001169286095 1051572488 /nfs/dbraw/zinc/57/24/88/1051572488.db2.gz RHCWTDIRCVSDNZ-OAHLLOKOSA-N 1 2 309.335 4.074 20 0 DIADLO Clc1ccnc(Cl)c1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212693503 1051573600 /nfs/dbraw/zinc/57/36/00/1051573600.db2.gz ZZDYZJYGAJVOOE-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO Cc1cc(Cl)c(N)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001216091262 1051574006 /nfs/dbraw/zinc/57/40/06/1051574006.db2.gz HDSFKYZGHRZCIB-UHFFFAOYSA-N 1 2 316.836 4.360 20 0 DIADLO FC(F)(F)c1cccnc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212693140 1051574647 /nfs/dbraw/zinc/57/46/47/1051574647.db2.gz FPBSWSAMQFLMDF-UHFFFAOYSA-N 1 2 318.302 4.089 20 0 DIADLO COC(=O)Nc1cccc(CNc2[nH+]c3ccccc3cc2C)c1 ZINC000804816095 1051578720 /nfs/dbraw/zinc/57/87/20/1051578720.db2.gz IUUQOLJBYNAKSW-UHFFFAOYSA-N 1 2 321.380 4.334 20 0 DIADLO Fc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(Cl)c(F)n1 ZINC001212694228 1051582077 /nfs/dbraw/zinc/58/20/77/1051582077.db2.gz PMLPQQGORHBLKA-UHFFFAOYSA-N 1 2 320.730 4.002 20 0 DIADLO Fc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)c(F)c(F)c1F ZINC001212696750 1051582180 /nfs/dbraw/zinc/58/21/80/1051582180.db2.gz JRCUFXVNEBSWSI-UHFFFAOYSA-N 1 2 321.277 4.231 20 0 DIADLO c1ccn(-c2ccc(Nc3ccc(Cn4cc[nH+]c4)cc3)cc2)c1 ZINC001212695340 1051583787 /nfs/dbraw/zinc/58/37/87/1051583787.db2.gz AIYQJHNLGNNJML-UHFFFAOYSA-N 1 2 314.392 4.466 20 0 DIADLO CCCCOc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)ccn1 ZINC001212694171 1051583950 /nfs/dbraw/zinc/58/39/50/1051583950.db2.gz NIARCDCNNVFEIN-UHFFFAOYSA-N 1 2 322.412 4.249 20 0 DIADLO CCc1ccc(OC)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001212699263 1051584556 /nfs/dbraw/zinc/58/45/56/1051584556.db2.gz WTDOGSREEQDHPG-UHFFFAOYSA-N 1 2 307.397 4.246 20 0 DIADLO Cc1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)cnc1OC(C)C ZINC001212695706 1051585332 /nfs/dbraw/zinc/58/53/32/1051585332.db2.gz PXUQQBKMIHFDSY-UHFFFAOYSA-N 1 2 322.412 4.166 20 0 DIADLO COc1cc(C)c(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1OC ZINC001212696997 1051587627 /nfs/dbraw/zinc/58/76/27/1051587627.db2.gz ZMYAQALPEIWAPH-UHFFFAOYSA-N 1 2 323.396 4.001 20 0 DIADLO c1cn(Cc2ccc(Nc3ccc4sncc4c3)cc2)c[nH+]1 ZINC001212697985 1051588867 /nfs/dbraw/zinc/58/88/67/1051588867.db2.gz FPHJNORFVFMDHX-UHFFFAOYSA-N 1 2 306.394 4.285 20 0 DIADLO CC1(C)C[C@@H](CNc2ccc3c(c2)[nH+]cn3-c2ccccc2)O1 ZINC001168454852 1051589837 /nfs/dbraw/zinc/58/98/37/1051589837.db2.gz BVWKLQWJJJXXSI-INIZCTEOSA-N 1 2 307.397 4.005 20 0 DIADLO COC(=O)c1cc2[nH+]c[nH]c2c(N[C@@H]2C[C@@H](C)c3ccccc32)c1 ZINC001169371133 1051593762 /nfs/dbraw/zinc/59/37/62/1051593762.db2.gz CGALCBQHNNYWRN-IAQYHMDHSA-N 1 2 321.380 4.010 20 0 DIADLO COc1c(C)[nH+]c(C2CC2)nc1N[C@H]1C[C@H](C)c2ccccc21 ZINC001169374305 1051595095 /nfs/dbraw/zinc/59/50/95/1051595095.db2.gz JGBXPMKLOFMJPZ-ZBEGNZNMSA-N 1 2 309.413 4.331 20 0 DIADLO Cc1ccc([N@H+]2C(=N)C=C(Cl)C=C2N)cc1-c1ccccc1 ZINC001216148461 1051603315 /nfs/dbraw/zinc/60/33/15/1051603315.db2.gz QUIQHGULWCYPPQ-UHFFFAOYSA-N 1 2 309.800 4.168 20 0 DIADLO Cc1ccc([N@@H+]2C(=N)C=C(Cl)C=C2N)cc1-c1ccccc1 ZINC001216148461 1051603322 /nfs/dbraw/zinc/60/33/22/1051603322.db2.gz QUIQHGULWCYPPQ-UHFFFAOYSA-N 1 2 309.800 4.168 20 0 DIADLO Cc1cc(NC[C@H](C)c2nc3ccccc3o2)nc(C2CC2)[nH+]1 ZINC000747226442 1051607314 /nfs/dbraw/zinc/60/73/14/1051607314.db2.gz IOLYEEXRJBFHKK-NSHDSACASA-N 1 2 308.385 4.019 20 0 DIADLO C[C@H]([NH2+]Cc1cn2cc(Cl)ccc2n1)c1ccccc1Cl ZINC000006996479 1051623635 /nfs/dbraw/zinc/62/36/35/1051623635.db2.gz RGXQKEKCXOHKIP-NSHDSACASA-N 1 2 320.223 4.492 20 0 DIADLO C[C@H](c1ccco1)[N@H+](CC(=O)c1c[nH]c2ccccc12)C1CC1 ZINC000088549398 1051626370 /nfs/dbraw/zinc/62/63/70/1051626370.db2.gz IUXGFTGRESFYJO-CYBMUJFWSA-N 1 2 308.381 4.169 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](CC(=O)c1c[nH]c2ccccc12)C1CC1 ZINC000088549398 1051626376 /nfs/dbraw/zinc/62/63/76/1051626376.db2.gz IUXGFTGRESFYJO-CYBMUJFWSA-N 1 2 308.381 4.169 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2nc(C)c(C)s2)s1 ZINC000088601587 1051627710 /nfs/dbraw/zinc/62/77/10/1051627710.db2.gz ZZMYXPZZADRZSG-LLVKDONJSA-N 1 2 309.504 4.280 20 0 DIADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2nc(C)c(C)s2)s1 ZINC000088601587 1051627715 /nfs/dbraw/zinc/62/77/15/1051627715.db2.gz ZZMYXPZZADRZSG-LLVKDONJSA-N 1 2 309.504 4.280 20 0 DIADLO COc1nscc1C[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC001169518610 1051641147 /nfs/dbraw/zinc/64/11/47/1051641147.db2.gz FNWWLGYRCAMMJF-QMMMGPOBSA-N 1 2 317.241 4.309 20 0 DIADLO COc1cc(Nc2cccn3cc(C)[nH+]c23)ccc1OC(C)C ZINC001216244611 1051651551 /nfs/dbraw/zinc/65/15/51/1051651551.db2.gz HTYFQRHDHXDHQR-UHFFFAOYSA-N 1 2 311.385 4.182 20 0 DIADLO CC[C@]1(CO)CCC[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001169592535 1051652238 /nfs/dbraw/zinc/65/22/38/1051652238.db2.gz BCHCIQCRCQPPKZ-HNNXBMFYSA-N 1 2 320.235 4.117 20 0 DIADLO CC[C@]1(CO)CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001169592535 1051652243 /nfs/dbraw/zinc/65/22/43/1051652243.db2.gz BCHCIQCRCQPPKZ-HNNXBMFYSA-N 1 2 320.235 4.117 20 0 DIADLO c1cn(Cc2ccc(NCCc3coc4ccccc34)cc2)c[nH+]1 ZINC001169600914 1051653958 /nfs/dbraw/zinc/65/39/58/1051653958.db2.gz XZRCGYPDNDQNQN-UHFFFAOYSA-N 1 2 317.392 4.332 20 0 DIADLO COc1cc(Nc2ccc(-n3cc[nH+]c3)cc2)ccc1OC(C)C ZINC001216249782 1051657066 /nfs/dbraw/zinc/65/70/66/1051657066.db2.gz VHXPIYJADUCLIE-UHFFFAOYSA-N 1 2 323.396 4.412 20 0 DIADLO Cc1ccc2cc(N[C@H]3CCc4ccccc4[C@@H]3O)[nH+]cc2c1 ZINC001169623525 1051657138 /nfs/dbraw/zinc/65/71/38/1051657138.db2.gz SLMKILCKTKYRAL-ICSRJNTNSA-N 1 2 304.393 4.004 20 0 DIADLO COCOc1ccc(Nc2c(C)cc[nH+]c2C(C)C)c(OC)c1 ZINC001216284142 1051673994 /nfs/dbraw/zinc/67/39/94/1051673994.db2.gz RVWAMLNMDWWTEE-UHFFFAOYSA-N 1 2 316.401 4.248 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@@H+]1CCOc2cccc(F)c2C1 ZINC001169715104 1051682467 /nfs/dbraw/zinc/68/24/67/1051682467.db2.gz GYRVNGFRFIKQGV-QGZVFWFLSA-N 1 2 303.352 4.311 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@H+]1CCOc2cccc(F)c2C1 ZINC001169715104 1051682475 /nfs/dbraw/zinc/68/24/75/1051682475.db2.gz GYRVNGFRFIKQGV-QGZVFWFLSA-N 1 2 303.352 4.311 20 0 DIADLO CCCc1csc(C[NH2+][C@@](C)(CC)c2nc(C)cs2)n1 ZINC000494098083 1051689188 /nfs/dbraw/zinc/68/91/88/1051689188.db2.gz KYGATODMNCEBBQ-HNNXBMFYSA-N 1 2 309.504 4.276 20 0 DIADLO c1c2ccccc2n2c1C[N@H+](Cc1ccc3c(c1)COC3)CCC2 ZINC000805841827 1051691286 /nfs/dbraw/zinc/69/12/86/1051691286.db2.gz VKSTVJPKPBINMO-UHFFFAOYSA-N 1 2 318.420 4.077 20 0 DIADLO c1c2ccccc2n2c1C[N@@H+](Cc1ccc3c(c1)COC3)CCC2 ZINC000805841827 1051691291 /nfs/dbraw/zinc/69/12/91/1051691291.db2.gz VKSTVJPKPBINMO-UHFFFAOYSA-N 1 2 318.420 4.077 20 0 DIADLO Oc1ccc([C@H]2CCC[N@@H+]2Cc2nc(Cl)ccc2Cl)cc1 ZINC000766810854 1051695686 /nfs/dbraw/zinc/69/56/86/1051695686.db2.gz RCFOTCOXSNNOKW-OAHLLOKOSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@H]2CCC[N@H+]2Cc2nc(Cl)ccc2Cl)cc1 ZINC000766810854 1051695691 /nfs/dbraw/zinc/69/56/91/1051695691.db2.gz RCFOTCOXSNNOKW-OAHLLOKOSA-N 1 2 323.223 4.431 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c(F)ccc(F)c1F ZINC001137930370 1051710336 /nfs/dbraw/zinc/71/03/36/1051710336.db2.gz MYYUOXBZAAMTTI-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1c(F)ccc(F)c1F ZINC001137930370 1051710344 /nfs/dbraw/zinc/71/03/44/1051710344.db2.gz MYYUOXBZAAMTTI-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCC[C@@H](Oc3ccccc3)C2)c1F ZINC001137930472 1051712348 /nfs/dbraw/zinc/71/23/48/1051712348.db2.gz PYFAAHPNCLYMBR-CQSZACIVSA-N 1 2 321.342 4.147 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCC[C@@H](Oc3ccccc3)C2)c1F ZINC001137930472 1051712361 /nfs/dbraw/zinc/71/23/61/1051712361.db2.gz PYFAAHPNCLYMBR-CQSZACIVSA-N 1 2 321.342 4.147 20 0 DIADLO COc1c(O)cccc1Nc1cc[nH+]c2cc(Cl)ccc12 ZINC001216349464 1051714057 /nfs/dbraw/zinc/71/40/57/1051714057.db2.gz RZLLHVRSHMYBDK-UHFFFAOYSA-N 1 2 300.745 4.346 20 0 DIADLO OC[C@@H](CNc1[nH+]cccc1-c1ccccc1)Cc1ccccc1 ZINC001169895469 1051724106 /nfs/dbraw/zinc/72/41/06/1051724106.db2.gz BEDFYBCKGPPXGH-GOSISDBHSA-N 1 2 318.420 4.012 20 0 DIADLO CC(C)(C)[C@H]1C[N@H+](CCc2cccc(Cl)c2Cl)CCO1 ZINC001169927889 1051730492 /nfs/dbraw/zinc/73/04/92/1051730492.db2.gz JLCQRUQHYRTUNE-CQSZACIVSA-N 1 2 316.272 4.283 20 0 DIADLO CC(C)(C)[C@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)CCO1 ZINC001169927889 1051730509 /nfs/dbraw/zinc/73/05/09/1051730509.db2.gz JLCQRUQHYRTUNE-CQSZACIVSA-N 1 2 316.272 4.283 20 0 DIADLO Cc1ccc(C(C)(C)[NH2+]Cc2nc(Cl)ccc2Cl)cn1 ZINC000766889053 1051736826 /nfs/dbraw/zinc/73/68/26/1051736826.db2.gz LVOBQHWEEIELDS-UHFFFAOYSA-N 1 2 310.228 4.117 20 0 DIADLO CCc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1nccn1-c1ccccc1 ZINC000806175854 1051747528 /nfs/dbraw/zinc/74/75/28/1051747528.db2.gz GOPZQHJMBYVNDE-ZIAGYGMSSA-N 1 2 324.428 4.143 20 0 DIADLO COc1cnc(F)c(Nc2ccc([NH+]3CCCCC3)cc2C)c1 ZINC001216411948 1051752894 /nfs/dbraw/zinc/75/28/94/1051752894.db2.gz MITVRKBWTWJWKK-UHFFFAOYSA-N 1 2 315.392 4.272 20 0 DIADLO Cc1cc([NH2+][C@H]2CC[C@H]2C2CC2)ccc1N1CCSCC1 ZINC000806156700 1051759620 /nfs/dbraw/zinc/75/96/20/1051759620.db2.gz ILTBCUKDQUEXTR-IRXDYDNUSA-N 1 2 302.487 4.149 20 0 DIADLO CC(C)=C(C)C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000767093531 1051760098 /nfs/dbraw/zinc/76/00/98/1051760098.db2.gz XRAJAYUDTFGTQF-UHFFFAOYSA-N 1 2 309.413 4.181 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1csc([C@@H](C)OC)n1 ZINC000185786412 1051782835 /nfs/dbraw/zinc/78/28/35/1051782835.db2.gz YCSSLADYUOKMBW-DYVFJYSZSA-N 1 2 316.470 4.187 20 0 DIADLO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1csc([C@@H](C)OC)n1 ZINC000185786412 1051782846 /nfs/dbraw/zinc/78/28/46/1051782846.db2.gz YCSSLADYUOKMBW-DYVFJYSZSA-N 1 2 316.470 4.187 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NCc1ccc(Cl)s1 ZINC000185844550 1051787093 /nfs/dbraw/zinc/78/70/93/1051787093.db2.gz NNVPWEOFJSQPLO-UHFFFAOYSA-N 1 2 321.833 4.010 20 0 DIADLO FC(F)(F)c1cccc(Nc2[nH+]cccc2N2CCCC2)c1 ZINC001173822043 1051801339 /nfs/dbraw/zinc/80/13/39/1051801339.db2.gz APWYYEQTACCSKQ-UHFFFAOYSA-N 1 2 307.319 4.444 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000186247298 1051801979 /nfs/dbraw/zinc/80/19/79/1051801979.db2.gz MRYMQFLOPYXDDD-BZNIZROVSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(F)c(F)c(F)c2)C1 ZINC000186247298 1051801991 /nfs/dbraw/zinc/80/19/91/1051801991.db2.gz MRYMQFLOPYXDDD-BZNIZROVSA-N 1 2 306.331 4.082 20 0 DIADLO Fc1c(Nc2cccn3cc[nH+]c23)cccc1OC(F)(F)F ZINC001216521491 1051801973 /nfs/dbraw/zinc/80/19/73/1051801973.db2.gz RSORIEDXCHFBFN-UHFFFAOYSA-N 1 2 311.238 4.116 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2ccc(F)cc2)cc[nH+]1 ZINC001173797050 1051804917 /nfs/dbraw/zinc/80/49/17/1051804917.db2.gz FEMCEXHWJXRCJW-UHFFFAOYSA-N 1 2 303.337 4.311 20 0 DIADLO Cc1ccc(Nc2ccc3[nH+]cc(Br)n3c2)cc1 ZINC001173801853 1051809178 /nfs/dbraw/zinc/80/91/78/1051809178.db2.gz GTMFVNSSSHBUMC-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO Cc1ccc2c(Nc3ccc(-c4ccn(C)n4)nc3)cccc2[nH+]1 ZINC001216560825 1051820575 /nfs/dbraw/zinc/82/05/75/1051820575.db2.gz UQSUVOYZBVYKEE-UHFFFAOYSA-N 1 2 315.380 4.082 20 0 DIADLO Brc1cc(NC=Cc2ccccc2)cn2cc[nH+]c12 ZINC001173871332 1051840455 /nfs/dbraw/zinc/84/04/55/1051840455.db2.gz AKZYJVHWQCPULQ-VOTSOKGWSA-N 1 2 314.186 4.180 20 0 DIADLO COc1cccc(Nc2cc[nH+]c(NC(=O)OC(C)(C)C)c2)c1 ZINC001173825101 1051844316 /nfs/dbraw/zinc/84/43/16/1051844316.db2.gz VUYNDCZRXOHWNT-UHFFFAOYSA-N 1 2 315.373 4.181 20 0 DIADLO C/C(=C/c1ccccc1)C[N@@H+](C)Cc1nc(C2CCCC2)no1 ZINC000494235770 1051857506 /nfs/dbraw/zinc/85/75/06/1051857506.db2.gz YUEXXBLPOXRIHX-QINSGFPZSA-N 1 2 311.429 4.263 20 0 DIADLO C/C(=C/c1ccccc1)C[N@H+](C)Cc1nc(C2CCCC2)no1 ZINC000494235770 1051857514 /nfs/dbraw/zinc/85/75/14/1051857514.db2.gz YUEXXBLPOXRIHX-QINSGFPZSA-N 1 2 311.429 4.263 20 0 DIADLO C[C@H](SCc1cc[nH+]c(N(C)C)c1)c1ccc(F)c(F)c1 ZINC000767871964 1051861037 /nfs/dbraw/zinc/86/10/37/1051861037.db2.gz QZKHJKPOIJTEDA-NSHDSACASA-N 1 2 308.397 4.420 20 0 DIADLO C/C(=C/c1ccccc1)C[N@@H+](C)Cc1nc(CCC(C)C)no1 ZINC000494267703 1051868326 /nfs/dbraw/zinc/86/83/26/1051868326.db2.gz IUAUFEJVBFDCMO-VBKFSLOCSA-N 1 2 313.445 4.194 20 0 DIADLO C/C(=C/c1ccccc1)C[N@H+](C)Cc1nc(CCC(C)C)no1 ZINC000494267703 1051868335 /nfs/dbraw/zinc/86/83/35/1051868335.db2.gz IUAUFEJVBFDCMO-VBKFSLOCSA-N 1 2 313.445 4.194 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3CC34CCCC4)c2)[nH+]c1C ZINC000747368464 1051870882 /nfs/dbraw/zinc/87/08/82/1051870882.db2.gz HZBXVWBSILLUCW-MRXNPFEDSA-N 1 2 309.413 4.212 20 0 DIADLO Cc1ccc(F)c(-c2noc(-c3ccccc3-n3cc[nH+]c3)n2)c1 ZINC001216755045 1051873528 /nfs/dbraw/zinc/87/35/28/1051873528.db2.gz AWXWCFFAHNUQCJ-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Cc1cccc(-c2noc(-c3ccccc3-n3cc[nH+]c3)n2)c1C ZINC001216757458 1051874046 /nfs/dbraw/zinc/87/40/46/1051874046.db2.gz YQOYWAALKHMYGK-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO Cc1ccc(F)cc1-c1noc(-c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000761621075 1051878248 /nfs/dbraw/zinc/87/82/48/1051878248.db2.gz IOCASQOIMRIWQA-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CCCc1csc(C[NH2+][C@H]2CCOc3c(Cl)cccc32)n1 ZINC000494360338 1051879134 /nfs/dbraw/zinc/87/91/34/1051879134.db2.gz WDIUEIDYWIRIJN-AWEZNQCLSA-N 1 2 322.861 4.362 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1cnc(-c2ccccc2)[nH]1 ZINC000189195811 1051889426 /nfs/dbraw/zinc/88/94/26/1051889426.db2.gz BOESKYQDDLILAT-UHFFFAOYSA-N 1 2 315.779 4.159 20 0 DIADLO CCCCn1nc(C)c(C[N@@H+]2CCn3cccc3[C@@H]2C)c1Cl ZINC000768161558 1051889466 /nfs/dbraw/zinc/88/94/66/1051889466.db2.gz GYYRMRVTTGGZRJ-AWEZNQCLSA-N 1 2 320.868 4.023 20 0 DIADLO CCCCn1nc(C)c(C[N@H+]2CCn3cccc3[C@@H]2C)c1Cl ZINC000768161558 1051889476 /nfs/dbraw/zinc/88/94/76/1051889476.db2.gz GYYRMRVTTGGZRJ-AWEZNQCLSA-N 1 2 320.868 4.023 20 0 DIADLO CCCCn1nc(C)c(C[N@@H+]2CCn3cccc3[C@H]2C)c1Cl ZINC000768161559 1051889965 /nfs/dbraw/zinc/88/99/65/1051889965.db2.gz GYYRMRVTTGGZRJ-CQSZACIVSA-N 1 2 320.868 4.023 20 0 DIADLO CCCCn1nc(C)c(C[N@H+]2CCn3cccc3[C@H]2C)c1Cl ZINC000768161559 1051889978 /nfs/dbraw/zinc/88/99/78/1051889978.db2.gz GYYRMRVTTGGZRJ-CQSZACIVSA-N 1 2 320.868 4.023 20 0 DIADLO CC[N@H+](Cc1c(Cl)nc(Cl)n1C)Cc1ccc(C)cc1 ZINC000768336557 1051919132 /nfs/dbraw/zinc/91/91/32/1051919132.db2.gz VTYNAFFINLYCPR-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO CC[N@@H+](Cc1c(Cl)nc(Cl)n1C)Cc1ccc(C)cc1 ZINC000768336557 1051919146 /nfs/dbraw/zinc/91/91/46/1051919146.db2.gz VTYNAFFINLYCPR-UHFFFAOYSA-N 1 2 312.244 4.057 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1c(Cl)nc(Cl)n1C ZINC000768319460 1051920784 /nfs/dbraw/zinc/92/07/84/1051920784.db2.gz ONKANLBMRFFVKD-ZDUSSCGKSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c(Cl)nc(Cl)n1C ZINC000768319460 1051920794 /nfs/dbraw/zinc/92/07/94/1051920794.db2.gz ONKANLBMRFFVKD-ZDUSSCGKSA-N 1 2 324.255 4.372 20 0 DIADLO c1ccc2ncc(Nc3ccc(N4CCCCC4)[nH+]c3)cc2c1 ZINC001174001079 1051926257 /nfs/dbraw/zinc/92/62/57/1051926257.db2.gz JOZIZMYPWYFVCH-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1occc1Br ZINC000768416229 1051932340 /nfs/dbraw/zinc/93/23/40/1051932340.db2.gz BPFMLQRYPKKTMR-SECBINFHSA-N 1 2 300.221 4.297 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1occc1Br ZINC000768416229 1051932349 /nfs/dbraw/zinc/93/23/49/1051932349.db2.gz BPFMLQRYPKKTMR-SECBINFHSA-N 1 2 300.221 4.297 20 0 DIADLO COc1cccc2cc(C[N@@H+]3CCC[C@@H]3c3cc(C)on3)oc21 ZINC000768431163 1051932882 /nfs/dbraw/zinc/93/28/82/1051932882.db2.gz WSODQCUXYRZAGV-MRXNPFEDSA-N 1 2 312.369 4.075 20 0 DIADLO COc1cccc2cc(C[N@H+]3CCC[C@@H]3c3cc(C)on3)oc21 ZINC000768431163 1051932891 /nfs/dbraw/zinc/93/28/91/1051932891.db2.gz WSODQCUXYRZAGV-MRXNPFEDSA-N 1 2 312.369 4.075 20 0 DIADLO CCC[C@]1(C)CCC[N@H+](Cn2nc(C3CC3)n(CC)c2=S)C1 ZINC000743404977 1051935843 /nfs/dbraw/zinc/93/58/43/1051935843.db2.gz ZSAWYUYFRGSBMP-QGZVFWFLSA-N 1 2 322.522 4.171 20 0 DIADLO CCC[C@]1(C)CCC[N@@H+](Cn2nc(C3CC3)n(CC)c2=S)C1 ZINC000743404977 1051935856 /nfs/dbraw/zinc/93/58/56/1051935856.db2.gz ZSAWYUYFRGSBMP-QGZVFWFLSA-N 1 2 322.522 4.171 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cnn(C(C)(C)C)c2C)cs1 ZINC000191280863 1051967604 /nfs/dbraw/zinc/96/76/04/1051967604.db2.gz FNFCTSSMUZGGTA-NWDGAFQWSA-N 1 2 320.506 4.377 20 0 DIADLO Cc1ccc(-c2cc[nH+]c(NCc3nccc(Cl)n3)c2)cc1 ZINC001170541391 1051969782 /nfs/dbraw/zinc/96/97/82/1051969782.db2.gz LFNZKDXBNBPQRY-UHFFFAOYSA-N 1 2 310.788 4.113 20 0 DIADLO CC(C)c1cn(C[N@@H+]2CC[C@H]2c2ccccc2)c(=S)n1C ZINC000747451532 1051973073 /nfs/dbraw/zinc/97/30/73/1051973073.db2.gz GHWDPXMBHYVXHT-HNNXBMFYSA-N 1 2 301.459 4.084 20 0 DIADLO CC(C)c1cn(C[N@H+]2CC[C@H]2c2ccccc2)c(=S)n1C ZINC000747451532 1051973087 /nfs/dbraw/zinc/97/30/87/1051973087.db2.gz GHWDPXMBHYVXHT-HNNXBMFYSA-N 1 2 301.459 4.084 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc(Cl)c(Cl)nc2C)c(C)[nH+]1 ZINC000808072784 1051973385 /nfs/dbraw/zinc/97/33/85/1051973385.db2.gz SAMFRCHKAUCAPD-UHFFFAOYSA-N 1 2 324.211 4.269 20 0 DIADLO CC(C)c1cc(N[C@H](C)[C@H](O)c2ccccc2)nc(C(C)C)[nH+]1 ZINC000808129926 1051976247 /nfs/dbraw/zinc/97/62/47/1051976247.db2.gz HQXHJFSPTVWDFF-KDOFPFPSSA-N 1 2 313.445 4.257 20 0 DIADLO CC(C)c1cc(N[C@H](C)[C@@H](O)c2ccccc2)nc(C(C)C)[nH+]1 ZINC000808129928 1051976402 /nfs/dbraw/zinc/97/64/02/1051976402.db2.gz HQXHJFSPTVWDFF-RDTXWAMCSA-N 1 2 313.445 4.257 20 0 DIADLO CCC/C=C\C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000769040658 1051991269 /nfs/dbraw/zinc/99/12/69/1051991269.db2.gz AQQZMABYJFUPQE-WCIBSUBMSA-N 1 2 309.413 4.181 20 0 DIADLO Cc1cccc(Nc2ccc(C(=O)NC3CCCCC3)cc2)[nH+]1 ZINC001174080732 1051996906 /nfs/dbraw/zinc/99/69/06/1051996906.db2.gz IATGPFLDABENQA-UHFFFAOYSA-N 1 2 309.413 4.196 20 0 DIADLO CCCCNC(=O)c1ccc(Nc2c(C)cc[nH+]c2CC)cc1 ZINC001174122460 1052001296 /nfs/dbraw/zinc/00/12/96/1052001296.db2.gz KQBYMFNUVXUIRI-UHFFFAOYSA-N 1 2 311.429 4.226 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(C(=O)NC(C)C)cc2)cc1 ZINC001174149717 1052019375 /nfs/dbraw/zinc/01/93/75/1052019375.db2.gz CGZJBVBOAIUFRH-UHFFFAOYSA-N 1 2 311.429 4.025 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(C(=O)NC(C)C)cc2)cc1 ZINC001174149717 1052019378 /nfs/dbraw/zinc/01/93/78/1052019378.db2.gz CGZJBVBOAIUFRH-UHFFFAOYSA-N 1 2 311.429 4.025 20 0 DIADLO Clc1ccsc1C[NH2+]Cc1coc(-c2cccs2)n1 ZINC000193048953 1052028463 /nfs/dbraw/zinc/02/84/63/1052028463.db2.gz VWPQMZORGIXACP-UHFFFAOYSA-N 1 2 310.831 4.408 20 0 DIADLO c1coc(-c2ncc(CNc3cccc(-n4cc[nH+]c4)c3)s2)c1 ZINC000193160608 1052032456 /nfs/dbraw/zinc/03/24/56/1052032456.db2.gz YJXWRVBRQGTRDC-UHFFFAOYSA-N 1 2 322.393 4.201 20 0 DIADLO CCc1cccc(Nc2cccc(C(=O)N3CCCCC3)c2)[nH+]1 ZINC001174174209 1052033446 /nfs/dbraw/zinc/03/34/46/1052033446.db2.gz IMWNVFJJGGHTAF-UHFFFAOYSA-N 1 2 309.413 4.014 20 0 DIADLO c1ccc2ncc(CNc3ccc(N4CCCCC4)c[nH+]3)cc2c1 ZINC000769375924 1052034313 /nfs/dbraw/zinc/03/43/13/1052034313.db2.gz BAJDTUJMVVJUII-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO Cc1ccccc1C(C)(C)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000195178687 1052039233 /nfs/dbraw/zinc/03/92/33/1052039233.db2.gz RIXMHPWHOIHFKR-UHFFFAOYSA-N 1 2 319.408 4.301 20 0 DIADLO CCCCNC(=O)c1cccc(Nc2cc[nH+]c(SC)c2)c1 ZINC001174190290 1052039800 /nfs/dbraw/zinc/03/98/00/1052039800.db2.gz IATQVUJOVCBGBV-UHFFFAOYSA-N 1 2 315.442 4.077 20 0 DIADLO Cc1ncc2c(n1)CCC[C@H]2[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000769412828 1052042572 /nfs/dbraw/zinc/04/25/72/1052042572.db2.gz HFNQTGWLFYBIPG-SMDDNHRTSA-N 1 2 316.474 4.093 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2occc2Br)n1 ZINC000769424942 1052043494 /nfs/dbraw/zinc/04/34/94/1052043494.db2.gz AQAIENSKQPPXHG-AWEZNQCLSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2occc2Br)n1 ZINC000769424942 1052043509 /nfs/dbraw/zinc/04/35/09/1052043509.db2.gz AQAIENSKQPPXHG-AWEZNQCLSA-N 1 2 321.218 4.083 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2[nH]nc3ccccc32)cc1F ZINC000769427017 1052045645 /nfs/dbraw/zinc/04/56/45/1052045645.db2.gz FKRHVGJIOWNLJC-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2[nH]nc3ccccc32)cc1F ZINC000769427017 1052045658 /nfs/dbraw/zinc/04/56/58/1052045658.db2.gz FKRHVGJIOWNLJC-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2n[nH]c3ccccc32)cc1F ZINC000769427017 1052045669 /nfs/dbraw/zinc/04/56/69/1052045669.db2.gz FKRHVGJIOWNLJC-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2n[nH]c3ccccc32)cc1F ZINC000769427017 1052045679 /nfs/dbraw/zinc/04/56/79/1052045679.db2.gz FKRHVGJIOWNLJC-GOSISDBHSA-N 1 2 313.351 4.178 20 0 DIADLO Cc1n[nH]c(C)c1Nc1cc[nH+]c2cc(C(F)(F)F)ccc12 ZINC001174213120 1052052954 /nfs/dbraw/zinc/05/29/54/1052052954.db2.gz KIPRVDOAOKTMKY-UHFFFAOYSA-N 1 2 306.291 4.337 20 0 DIADLO COc1ncccc1C[N@H+](CCC(F)(F)F)Cc1ccccc1 ZINC000193579624 1052054080 /nfs/dbraw/zinc/05/40/80/1052054080.db2.gz UYZJRBIMLSCSOG-UHFFFAOYSA-N 1 2 324.346 4.045 20 0 DIADLO COc1ncccc1C[N@@H+](CCC(F)(F)F)Cc1ccccc1 ZINC000193579624 1052054096 /nfs/dbraw/zinc/05/40/96/1052054096.db2.gz UYZJRBIMLSCSOG-UHFFFAOYSA-N 1 2 324.346 4.045 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458735 1052061028 /nfs/dbraw/zinc/06/10/28/1052061028.db2.gz ZMVSJOGCCSGFSN-SJCJKPOMSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458735 1052061039 /nfs/dbraw/zinc/06/10/39/1052061039.db2.gz ZMVSJOGCCSGFSN-SJCJKPOMSA-N 1 2 300.377 4.274 20 0 DIADLO Cc1cc(NC(=O)CCCOc2cccc3ccccc32)cc[nH+]1 ZINC000195592824 1052063640 /nfs/dbraw/zinc/06/36/40/1052063640.db2.gz QNKKAWIVGLAKLX-UHFFFAOYSA-N 1 2 320.392 4.341 20 0 DIADLO c1cnn(-c2cccc(Nc3[nH+]cccc3N3CCCCC3)c2)c1 ZINC001174298067 1052074500 /nfs/dbraw/zinc/07/45/00/1052074500.db2.gz DBLNPBAWVAQIOB-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO COc1cc(-c2ccccc2)sc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000195655922 1052074840 /nfs/dbraw/zinc/07/48/40/1052074840.db2.gz USQCBNZEUOBSJI-UHFFFAOYSA-N 1 2 324.405 4.379 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@H]3CCC[C@@H]3C)c2)[nH+]c1C ZINC000769560357 1052082770 /nfs/dbraw/zinc/08/27/70/1052082770.db2.gz PNAVBAPCUGCIRU-SWLSCSKDSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H](F)c3ccccc3)c2)[nH+]c1C ZINC000769558455 1052083927 /nfs/dbraw/zinc/08/39/27/1052083927.db2.gz COTKSBGUCJGLDA-QGZVFWFLSA-N 1 2 323.371 4.343 20 0 DIADLO COc1cc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)ccn1 ZINC001174303835 1052085496 /nfs/dbraw/zinc/08/54/96/1052085496.db2.gz ZXBAWDPRCLZQLB-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO FC(F)(F)c1ccc(Nc2cccc(-n3cc[nH+]c3)c2)cn1 ZINC001174310347 1052091505 /nfs/dbraw/zinc/09/15/05/1052091505.db2.gz XOWXCNMNICXPMR-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO Clc1cnc(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)s1 ZINC000769918679 1052122727 /nfs/dbraw/zinc/12/27/27/1052122727.db2.gz YNAFVOQKNYKVGV-GFCCVEGCSA-N 1 2 320.845 4.333 20 0 DIADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000769873374 1052124794 /nfs/dbraw/zinc/12/47/94/1052124794.db2.gz LJVJNLJIEMGOHJ-GFCCVEGCSA-N 1 2 311.385 4.051 20 0 DIADLO c1ccc([C@@H]2CCC[C@@H](c3nnc(CC4CCCC4)o3)[NH2+]2)cc1 ZINC001217750728 1052132186 /nfs/dbraw/zinc/13/21/86/1052132186.db2.gz WGUALULMVPBALD-IRXDYDNUSA-N 1 2 311.429 4.358 20 0 DIADLO CC(=O)NCc1cccc(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001174368944 1052132479 /nfs/dbraw/zinc/13/24/79/1052132479.db2.gz HEPSJUZIRANEHN-UHFFFAOYSA-N 1 2 323.440 4.057 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cnc4c(ccn4C)c3)ccc21 ZINC001174380878 1052138457 /nfs/dbraw/zinc/13/84/57/1052138457.db2.gz ODTLFHCGTXODBK-UHFFFAOYSA-N 1 2 305.385 4.248 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4cn(C)nc4c3)ccc21 ZINC001174381120 1052138473 /nfs/dbraw/zinc/13/84/73/1052138473.db2.gz GDTJPUYYRPVTQQ-UHFFFAOYSA-N 1 2 305.385 4.248 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(O)c(F)cc3F)ccc21 ZINC001174381151 1052138490 /nfs/dbraw/zinc/13/84/90/1052138490.db2.gz HWVCVFKBILTBSW-UHFFFAOYSA-N 1 2 303.312 4.345 20 0 DIADLO COC(=O)c1sccc1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174380686 1052139104 /nfs/dbraw/zinc/13/91/04/1052139104.db2.gz JLVRGBJWOKZARR-UHFFFAOYSA-N 1 2 315.398 4.209 20 0 DIADLO CC(=O)Nc1ccccc1Nc1ccc2c(c1)[nH+]cn2C(C)C ZINC001174381197 1052139387 /nfs/dbraw/zinc/13/93/87/1052139387.db2.gz JPSXHJFIRFEWRN-UHFFFAOYSA-N 1 2 308.385 4.319 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cnn4cccc(F)c34)ccc21 ZINC001174381720 1052140669 /nfs/dbraw/zinc/14/06/69/1052140669.db2.gz QBRGLGUHXDRKJZ-UHFFFAOYSA-N 1 2 309.348 4.148 20 0 DIADLO CC(C)n1c[nH+]c2cc(N(C)c3nc(Cl)ccc3N)ccc21 ZINC001174382295 1052140790 /nfs/dbraw/zinc/14/07/90/1052140790.db2.gz ITGHJULGSVZIOZ-UHFFFAOYSA-N 1 2 315.808 4.016 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4c3cnn4C)ccc21 ZINC001174381762 1052140813 /nfs/dbraw/zinc/14/08/13/1052140813.db2.gz RLCFCVREKWJOCA-UHFFFAOYSA-N 1 2 305.385 4.248 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cnc4ccccc4n3)ccc21 ZINC001174381667 1052140866 /nfs/dbraw/zinc/14/08/66/1052140866.db2.gz NNDZHXYQHYHWDK-UHFFFAOYSA-N 1 2 303.369 4.304 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(-c4ccncc4)no3)ccc21 ZINC001174381906 1052141249 /nfs/dbraw/zinc/14/12/49/1052141249.db2.gz SIAJHTVFKHLWMM-UHFFFAOYSA-N 1 2 319.368 4.411 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccccc3C3=NCCO3)ccc21 ZINC001174384052 1052142458 /nfs/dbraw/zinc/14/24/58/1052142458.db2.gz DQBPZWHRWJORHU-UHFFFAOYSA-N 1 2 320.396 4.138 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccnc(C(C)(C)C)n3)ccc21 ZINC001174382501 1052143020 /nfs/dbraw/zinc/14/30/20/1052143020.db2.gz SNFCNMCRWQLACH-UHFFFAOYSA-N 1 2 309.417 4.448 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4c3C(=O)OC4)ccc21 ZINC001174385972 1052145615 /nfs/dbraw/zinc/14/56/15/1052145615.db2.gz WZWKSEZFJMGVEI-UHFFFAOYSA-N 1 2 307.353 4.031 20 0 DIADLO CC(C)(C)OC(=O)c1ccc(Nc2cccc3[nH+]ccn32)cc1 ZINC001174426402 1052155812 /nfs/dbraw/zinc/15/58/12/1052155812.db2.gz SXNKSSOFKYZODA-UHFFFAOYSA-N 1 2 309.369 4.033 20 0 DIADLO O=C(c1ccc(Nc2cc[nH+]c3[nH]ccc32)cc1)C(F)(F)F ZINC001174411524 1052165596 /nfs/dbraw/zinc/16/55/96/1052165596.db2.gz ALNXDZUQGPOYAX-UHFFFAOYSA-N 1 2 305.259 4.003 20 0 DIADLO Cc1cc(C)n(-c2ccc(Nc3cc[nH+]c4[nH]ccc43)cc2)n1 ZINC001174414594 1052166738 /nfs/dbraw/zinc/16/67/38/1052166738.db2.gz XZLQCZVSPJHUFW-UHFFFAOYSA-N 1 2 303.369 4.061 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(-c2cccc(C)c2)n(C)c1=S ZINC000914567124 1052168189 /nfs/dbraw/zinc/16/81/89/1052168189.db2.gz CKYZMWVJIZLQBC-UHFFFAOYSA-N 1 2 318.490 4.006 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(-c2cccc(C)c2)n(C)c1=S ZINC000914567124 1052168193 /nfs/dbraw/zinc/16/81/93/1052168193.db2.gz CKYZMWVJIZLQBC-UHFFFAOYSA-N 1 2 318.490 4.006 20 0 DIADLO CCn1c(-c2ccco2)nn(C[N@H+](C)[C@@H](C)C(C)(C)C)c1=S ZINC000914568946 1052169779 /nfs/dbraw/zinc/16/97/79/1052169779.db2.gz PUNOFMOGMQWVKW-LBPRGKRZSA-N 1 2 322.478 4.018 20 0 DIADLO CCn1c(-c2ccco2)nn(C[N@@H+](C)[C@@H](C)C(C)(C)C)c1=S ZINC000914568946 1052169787 /nfs/dbraw/zinc/16/97/87/1052169787.db2.gz PUNOFMOGMQWVKW-LBPRGKRZSA-N 1 2 322.478 4.018 20 0 DIADLO C[C@@H]([N@H+](C)Cn1nc(-c2cccs2)oc1=S)C(C)(C)C ZINC000914568449 1052169864 /nfs/dbraw/zinc/16/98/64/1052169864.db2.gz JRNKWIKHPOABQZ-SNVBAGLBSA-N 1 2 311.476 4.258 20 0 DIADLO C[C@@H]([N@@H+](C)Cn1nc(-c2cccs2)oc1=S)C(C)(C)C ZINC000914568449 1052169869 /nfs/dbraw/zinc/16/98/69/1052169869.db2.gz JRNKWIKHPOABQZ-SNVBAGLBSA-N 1 2 311.476 4.258 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(-c2ccc(C)cc2)n(C)c1=S ZINC000914567430 1052170310 /nfs/dbraw/zinc/17/03/10/1052170310.db2.gz ZAJAEYUGOYUJIR-UHFFFAOYSA-N 1 2 318.490 4.006 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(-c2ccc(C)cc2)n(C)c1=S ZINC000914567430 1052170317 /nfs/dbraw/zinc/17/03/17/1052170317.db2.gz ZAJAEYUGOYUJIR-UHFFFAOYSA-N 1 2 318.490 4.006 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cc(F)ccc3C(F)(F)F)ccc21 ZINC001174486008 1052170957 /nfs/dbraw/zinc/17/09/57/1052170957.db2.gz BTEZPGUGEIDIBJ-UHFFFAOYSA-N 1 2 309.266 4.475 20 0 DIADLO c1cn(-c2ccc(Nc3cccc(N4CCCC4)c3)cc2)c[nH+]1 ZINC001174487974 1052173864 /nfs/dbraw/zinc/17/38/64/1052173864.db2.gz AQUJCYMVRUFCTR-UHFFFAOYSA-N 1 2 304.397 4.216 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+][C@H](Cc1ccccc1)c1ncco1)CC2 ZINC000653911687 1052192864 /nfs/dbraw/zinc/19/28/64/1052192864.db2.gz JHSPHLZJBZYJSP-RTBURBONSA-N 1 2 322.383 4.375 20 0 DIADLO Nc1cc[nH+]c(O[C@@H](c2ccccc2)c2cccc(Cl)c2)c1 ZINC001218191538 1052206010 /nfs/dbraw/zinc/20/60/10/1052206010.db2.gz BNCNQLUQFXPHHA-SFHVURJKSA-N 1 2 310.784 4.486 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C\c2nc3ccccc3s2)c(C)[nH+]1 ZINC000229856116 1052245128 /nfs/dbraw/zinc/24/51/28/1052245128.db2.gz LGCZDZKJYGJWHF-HJWRWDBZSA-N 1 2 323.421 4.268 20 0 DIADLO Nc1cc[nH+]c(O[C@@H]2CCN(c3ccccc3)c3ccccc32)c1 ZINC001218491329 1052249056 /nfs/dbraw/zinc/24/90/56/1052249056.db2.gz QDHZICJWLDALAT-LJQANCHMSA-N 1 2 317.392 4.326 20 0 DIADLO CCSc1nn(C[N@H+](C)[C@H]2CCC[C@H](C)C2)c(=S)s1 ZINC000914785168 1052249362 /nfs/dbraw/zinc/24/93/62/1052249362.db2.gz RBZBMMNUHZERJG-QWRGUYRKSA-N 1 2 317.549 4.254 20 0 DIADLO CCSc1nn(C[N@@H+](C)[C@H]2CCC[C@H](C)C2)c(=S)s1 ZINC000914785168 1052249372 /nfs/dbraw/zinc/24/93/72/1052249372.db2.gz RBZBMMNUHZERJG-QWRGUYRKSA-N 1 2 317.549 4.254 20 0 DIADLO CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001219556649 1052293115 /nfs/dbraw/zinc/29/31/15/1052293115.db2.gz AEWMLFLXXVFWMH-CABCVRRESA-N 1 2 314.433 4.061 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1nc2ccccc2s1 ZINC000315098161 1052331541 /nfs/dbraw/zinc/33/15/41/1052331541.db2.gz IQXPEWMDOXWWIZ-LLVKDONJSA-N 1 2 313.382 4.055 20 0 DIADLO C[C@@H](c1noc(-c2ccc(-n3cc[nH+]c3)cc2)n1)c1cccs1 ZINC000762195025 1052332703 /nfs/dbraw/zinc/33/27/03/1052332703.db2.gz PBZNVANILVOEJL-GFCCVEGCSA-N 1 2 322.393 4.136 20 0 DIADLO CCc1nc(C[N@@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)cs1 ZINC000303703980 1052338394 /nfs/dbraw/zinc/33/83/94/1052338394.db2.gz OOIKPNXSJPRDCR-CXAGYDPISA-N 1 2 318.511 4.384 20 0 DIADLO CCc1nc(C[N@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)cs1 ZINC000303703980 1052338403 /nfs/dbraw/zinc/33/84/03/1052338403.db2.gz OOIKPNXSJPRDCR-CXAGYDPISA-N 1 2 318.511 4.384 20 0 DIADLO Cc1cc(CNC(=O)NCCCCCCC(C)C)cc(C)[nH+]1 ZINC001220659597 1052350249 /nfs/dbraw/zinc/35/02/49/1052350249.db2.gz DCVNHMLOGORPLL-UHFFFAOYSA-N 1 2 305.466 4.104 20 0 DIADLO C[C@@H](SCc1cc[nH+]c(N(C)C)c1)c1c(F)cccc1F ZINC000762475990 1052388689 /nfs/dbraw/zinc/38/86/89/1052388689.db2.gz WUOPJVLIJOOJHV-LLVKDONJSA-N 1 2 308.397 4.420 20 0 DIADLO Cc1cccc([C@H]([NH2+]Cc2ccccc2F)c2ccccn2)c1 ZINC000153559471 1052394196 /nfs/dbraw/zinc/39/41/96/1052394196.db2.gz OOFTVHAUSMYTSO-FQEVSTJZSA-N 1 2 306.384 4.408 20 0 DIADLO CC1(C)Cc2cccc(CNc3ccc(N4CCCC4)[nH+]c3)c2O1 ZINC000236703705 1052430081 /nfs/dbraw/zinc/43/00/81/1052430081.db2.gz XUPPCTVVKSJZIQ-UHFFFAOYSA-N 1 2 323.440 4.007 20 0 DIADLO CCOc1ccc([C@@H]([NH2+]Cc2cscn2)c2ccccc2)cc1 ZINC000237114182 1052435875 /nfs/dbraw/zinc/43/58/75/1052435875.db2.gz LWPXRQARADNFEU-IBGZPJMESA-N 1 2 324.449 4.421 20 0 DIADLO COc1cccc(/C(C)=C/C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000176622590 1052441160 /nfs/dbraw/zinc/44/11/60/1052441160.db2.gz LAAAVUOQCRLEGQ-ZRDIBKRKSA-N 1 2 310.397 4.057 20 0 DIADLO Cc1ccc(NCc2ccc(-n3cc[nH+]c3)cc2)c2cccnc12 ZINC000237741649 1052444048 /nfs/dbraw/zinc/44/40/48/1052444048.db2.gz QYXVNKOZOFCRLD-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO ClC(Cl)(Cl)[C@H](OCCn1cc[nH+]c1)c1ccccc1 ZINC001222134326 1052448411 /nfs/dbraw/zinc/44/84/11/1052448411.db2.gz CQVCUDWQIMLIRN-GFCCVEGCSA-N 1 2 319.619 4.011 20 0 DIADLO O=C(/C=C\c1ccccc1Cl)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000915672307 1052467235 /nfs/dbraw/zinc/46/72/35/1052467235.db2.gz CCNUEZGXROKCLI-HJWRWDBZSA-N 1 2 323.783 4.178 20 0 DIADLO FC(F)(F)Oc1cccc(-c2ccccc2Cn2cc[nH+]c2)c1 ZINC001222327980 1052484054 /nfs/dbraw/zinc/48/40/54/1052484054.db2.gz UVQUKUUFJFZHRT-UHFFFAOYSA-N 1 2 318.298 4.497 20 0 DIADLO Clc1ccsc1CNC[C@H](c1ccccc1)[NH+]1CCCC1 ZINC000394062289 1052499925 /nfs/dbraw/zinc/49/99/25/1052499925.db2.gz BBBYKKNJVDICMA-MRXNPFEDSA-N 1 2 320.889 4.328 20 0 DIADLO Cn1c[nH+]cc1CO[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC001222595012 1052514837 /nfs/dbraw/zinc/51/48/37/1052514837.db2.gz LQCXBDGMTSSRQY-GOSISDBHSA-N 1 2 312.800 4.380 20 0 DIADLO C[C@@H](CNc1ccccc1OCCn1cc[nH+]c1)C(C)(C)C ZINC000670265921 1052539899 /nfs/dbraw/zinc/53/98/99/1052539899.db2.gz AQSXFDAKILNNKV-HNNXBMFYSA-N 1 2 301.434 4.056 20 0 DIADLO Oc1ccc2c(c1)[C@@H](Nc1ccc(N3CCCCC3)[nH+]c1)CCC2 ZINC000326414182 1052553861 /nfs/dbraw/zinc/55/38/61/1052553861.db2.gz SWLJPHPEKJDORD-IBGZPJMESA-N 1 2 323.440 4.267 20 0 DIADLO Cc1cc(CO[C@H]2CC[C@H](OCc3ccccc3)C2)cc(C)[nH+]1 ZINC001223425792 1052600260 /nfs/dbraw/zinc/60/02/60/1052600260.db2.gz VCUWFIONJKKNSJ-PMACEKPBSA-N 1 2 311.425 4.353 20 0 DIADLO CC[N@H+](Cc1cocn1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000191941163 1052619141 /nfs/dbraw/zinc/61/91/41/1052619141.db2.gz XZXRJWNJZCYNEJ-IBGZPJMESA-N 1 2 310.372 4.425 20 0 DIADLO CC[N@@H+](Cc1cocn1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000191941163 1052619145 /nfs/dbraw/zinc/61/91/45/1052619145.db2.gz XZXRJWNJZCYNEJ-IBGZPJMESA-N 1 2 310.372 4.425 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2cccc(Cl)c2)nc2ccccc12 ZINC000124001160 1052636106 /nfs/dbraw/zinc/63/61/06/1052636106.db2.gz QQGGWUPTRXFIJJ-GFCCVEGCSA-N 1 2 311.816 4.442 20 0 DIADLO CC[C@H](C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(F)cc1 ZINC000124231684 1052638632 /nfs/dbraw/zinc/63/86/32/1052638632.db2.gz BJUKPBYKQNHRSJ-KRWDZBQOSA-N 1 2 323.371 4.348 20 0 DIADLO Cc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1noc(-c2ccccc2)n1 ZINC000124281670 1052639225 /nfs/dbraw/zinc/63/92/25/1052639225.db2.gz YVSXEBXOXTTXCU-KSSFIOAISA-N 1 2 319.408 4.383 20 0 DIADLO CC[N@H+](Cc1nnc(C2CC2)o1)[C@@H](C)c1cc2ccccc2o1 ZINC000125762155 1052652897 /nfs/dbraw/zinc/65/28/97/1052652897.db2.gz CNCVCJIBMJBSEI-LBPRGKRZSA-N 1 2 311.385 4.276 20 0 DIADLO CC[N@@H+](Cc1nnc(C2CC2)o1)[C@@H](C)c1cc2ccccc2o1 ZINC000125762155 1052652904 /nfs/dbraw/zinc/65/29/04/1052652904.db2.gz CNCVCJIBMJBSEI-LBPRGKRZSA-N 1 2 311.385 4.276 20 0 DIADLO FC(F)(F)[C@H]1CCC[C@@H](Nc2ccc(N3CCCC3)[nH+]c2)C1 ZINC000125977321 1052662178 /nfs/dbraw/zinc/66/21/78/1052662178.db2.gz GUODZZYAFWUADY-QWHCGFSZSA-N 1 2 313.367 4.215 20 0 DIADLO CC(C)(C)c1ccc(-c2nnc([C@H]([NH3+])c3ccccc3)o2)cc1 ZINC000321291330 1052665539 /nfs/dbraw/zinc/66/55/39/1052665539.db2.gz HGRHSIUQUHYFQB-MRXNPFEDSA-N 1 2 307.397 4.082 20 0 DIADLO c1c[nH]c([C@@H]([NH2+]Cc2ccc3ccccc3c2)c2ccccc2)n1 ZINC000126201409 1052667304 /nfs/dbraw/zinc/66/73/04/1052667304.db2.gz SWNWRVQLNIYQPH-FQEVSTJZSA-N 1 2 313.404 4.442 20 0 DIADLO COc1ccc2oc(C[NH2+]Cc3nc(C4CC4)cs3)cc2c1 ZINC000126826321 1052681550 /nfs/dbraw/zinc/68/15/50/1052681550.db2.gz PTKFLXIWZFEIRT-UHFFFAOYSA-N 1 2 314.410 4.065 20 0 DIADLO COc1ccc(OC)c(C[NH2+][C@H](c2ccco2)c2ccccc2)c1 ZINC000066236386 1052686943 /nfs/dbraw/zinc/68/69/43/1052686943.db2.gz XGTOPGCCOPPDQS-FQEVSTJZSA-N 1 2 323.392 4.176 20 0 DIADLO CCCCCCNC(=O)C[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC000917066863 1052690127 /nfs/dbraw/zinc/69/01/27/1052690127.db2.gz VYZHOHFSCDNPKT-AWEZNQCLSA-N 1 2 310.869 4.029 20 0 DIADLO CCCCCCNC(=O)C[N@H+](C)[C@@H](C)c1ccccc1Cl ZINC000917066863 1052690125 /nfs/dbraw/zinc/69/01/25/1052690125.db2.gz VYZHOHFSCDNPKT-AWEZNQCLSA-N 1 2 310.869 4.029 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@H](c2cccc(O)c2)C1 ZINC000127399136 1052694298 /nfs/dbraw/zinc/69/42/98/1052694298.db2.gz YGGFZYSCISGQMD-ACJLOTCBSA-N 1 2 317.816 4.180 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@H](c2cccc(O)c2)C1 ZINC000127399136 1052694301 /nfs/dbraw/zinc/69/43/01/1052694301.db2.gz YGGFZYSCISGQMD-ACJLOTCBSA-N 1 2 317.816 4.180 20 0 DIADLO Cl/C=C/C[N@@H+]1CCC[C@H]1c1ccc(Br)cc1 ZINC000917086887 1052697361 /nfs/dbraw/zinc/69/73/61/1052697361.db2.gz LMACNDJWZALAOE-IADWALHJSA-N 1 2 300.627 4.339 20 0 DIADLO Cl/C=C/C[N@H+]1CCC[C@H]1c1ccc(Br)cc1 ZINC000917086887 1052697364 /nfs/dbraw/zinc/69/73/64/1052697364.db2.gz LMACNDJWZALAOE-IADWALHJSA-N 1 2 300.627 4.339 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2cc[nH]n2)c2cccs2)cc1 ZINC000066990356 1052698225 /nfs/dbraw/zinc/69/82/25/1052698225.db2.gz KIDSEXRKYYHCLT-HNNXBMFYSA-N 1 2 303.818 4.004 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1cc(F)ccc1Br ZINC000127550937 1052698598 /nfs/dbraw/zinc/69/85/98/1052698598.db2.gz UNXPMIFUTRJDEY-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1cc(F)ccc1Br ZINC000127550937 1052698602 /nfs/dbraw/zinc/69/86/02/1052698602.db2.gz UNXPMIFUTRJDEY-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO CSc1cc(C)ccc1C[NH2+][C@@H](c1ncc[nH]1)c1ccccc1 ZINC000127669816 1052701595 /nfs/dbraw/zinc/70/15/95/1052701595.db2.gz GTQAGZYWOOFTCB-GOSISDBHSA-N 1 2 323.465 4.319 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000127858117 1052703522 /nfs/dbraw/zinc/70/35/22/1052703522.db2.gz HGFYEYGUIICDSL-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000127858117 1052703526 /nfs/dbraw/zinc/70/35/26/1052703526.db2.gz HGFYEYGUIICDSL-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO CC(C)C[C@H](c1nc(-c2c[nH]c3ccccc32)no1)n1cc[nH+]c1 ZINC000924008068 1052703590 /nfs/dbraw/zinc/70/35/90/1052703590.db2.gz MFWRQOLICFUVDY-MRXNPFEDSA-N 1 2 321.384 4.050 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000128087193 1052709128 /nfs/dbraw/zinc/70/91/28/1052709128.db2.gz QNRJXOABTAHWQS-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1coc(-c2cccc(F)c2)n1 ZINC000128087193 1052709135 /nfs/dbraw/zinc/70/91/35/1052709135.db2.gz QNRJXOABTAHWQS-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO CC(C)Oc1cc(F)c(F)cc1Nc1ccc2c(c1)[nH+]cn2C ZINC001212227531 1052727812 /nfs/dbraw/zinc/72/78/12/1052727812.db2.gz OMHLCOAGFSWQIK-UHFFFAOYSA-N 1 2 317.339 4.382 20 0 DIADLO CCOC(=[NH2+])CCCCOCc1cc(C)ccc1OC(C)C ZINC001224964598 1052738810 /nfs/dbraw/zinc/73/88/10/1052738810.db2.gz AUNDJXZKBCJJQE-UHFFFAOYSA-N 1 2 307.434 4.483 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cn2sc3ccccc3c2=O)c1 ZINC000917617418 1052744437 /nfs/dbraw/zinc/74/44/37/1052744437.db2.gz DRBLUEMOYSDQBA-KRWDZBQOSA-N 1 2 324.449 4.166 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cn2sc3ccccc3c2=O)c1 ZINC000917617418 1052744441 /nfs/dbraw/zinc/74/44/41/1052744441.db2.gz DRBLUEMOYSDQBA-KRWDZBQOSA-N 1 2 324.449 4.166 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1cc(F)ccc1OC(F)F ZINC000660141054 1052798775 /nfs/dbraw/zinc/79/87/75/1052798775.db2.gz SMGFFAXHKUHAGB-LLVKDONJSA-N 1 2 310.319 4.015 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1cc(F)ccc1OC(F)F ZINC000660141054 1052798780 /nfs/dbraw/zinc/79/87/80/1052798780.db2.gz SMGFFAXHKUHAGB-LLVKDONJSA-N 1 2 310.319 4.015 20 0 DIADLO CC(C)CC1(C[NH2+][C@@H](c2cccs2)c2nnc[nH]2)CCCC1 ZINC000556104696 1052799979 /nfs/dbraw/zinc/79/99/79/1052799979.db2.gz IFITUOVFOYGAGH-HNNXBMFYSA-N 1 2 318.490 4.152 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1ncccc1C(F)(F)F ZINC000129712249 1052807321 /nfs/dbraw/zinc/80/73/21/1052807321.db2.gz KUIJELRVWCQBNC-NSHDSACASA-N 1 2 312.310 4.433 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ncccc1C(F)(F)F ZINC000129712249 1052807324 /nfs/dbraw/zinc/80/73/24/1052807324.db2.gz KUIJELRVWCQBNC-NSHDSACASA-N 1 2 312.310 4.433 20 0 DIADLO CCn1cc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000129883594 1052813751 /nfs/dbraw/zinc/81/37/51/1052813751.db2.gz AURLZQNUGFIFTI-ZDUSSCGKSA-N 1 2 303.837 4.282 20 0 DIADLO CCn1cc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000129883594 1052813756 /nfs/dbraw/zinc/81/37/56/1052813756.db2.gz AURLZQNUGFIFTI-ZDUSSCGKSA-N 1 2 303.837 4.282 20 0 DIADLO C[C@H](CC[NH2+][C@H](c1nnc[nH]1)c1ccc(F)cc1)CC(C)(C)C ZINC000556178686 1052817210 /nfs/dbraw/zinc/81/72/10/1052817210.db2.gz LKHOURISVKAQQQ-CJNGLKHVSA-N 1 2 318.440 4.085 20 0 DIADLO C/C(=C\C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccccc1 ZINC000918663265 1052821282 /nfs/dbraw/zinc/82/12/82/1052821282.db2.gz LBZLSZUALNSQAJ-SDNWHVSQSA-N 1 2 321.355 4.053 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1cn2ccccc2n1 ZINC000556235965 1052823713 /nfs/dbraw/zinc/82/37/13/1052823713.db2.gz LKFYWXQEOOEHQD-NSHDSACASA-N 1 2 320.223 4.492 20 0 DIADLO CCC(CC)n1ccc(Cn2c[nH+]c(Cc3ccccc3)c2)n1 ZINC000919145139 1052853530 /nfs/dbraw/zinc/85/35/30/1052853530.db2.gz XJTFKZJLDXOKNO-UHFFFAOYSA-N 1 2 308.429 4.080 20 0 DIADLO CCCCc1noc([C@@H](C)[NH+]2CCC(CC(F)(F)F)CC2)n1 ZINC000556505038 1052857684 /nfs/dbraw/zinc/85/76/84/1052857684.db2.gz CNXHFOAKEBQTRH-LLVKDONJSA-N 1 2 319.371 4.138 20 0 DIADLO Cc1noc(C[N@@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)n1 ZINC000556517183 1052860083 /nfs/dbraw/zinc/86/00/83/1052860083.db2.gz RLFKHCCYXJVYNY-LBPRGKRZSA-N 1 2 307.825 4.251 20 0 DIADLO Cc1noc(C[N@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)n1 ZINC000556517183 1052860085 /nfs/dbraw/zinc/86/00/85/1052860085.db2.gz RLFKHCCYXJVYNY-LBPRGKRZSA-N 1 2 307.825 4.251 20 0 DIADLO CC(C)(C)c1ccc(N2CCC(Nc3cccc[nH+]3)CC2)cc1 ZINC000919722515 1052885977 /nfs/dbraw/zinc/88/59/77/1052885977.db2.gz BAJSCHHQYOWREM-UHFFFAOYSA-N 1 2 309.457 4.460 20 0 DIADLO Clc1cc(C[N@@H+]2CC[C@H]2COCc2ccccc2)cs1 ZINC001142769738 1052905493 /nfs/dbraw/zinc/90/54/93/1052905493.db2.gz ZWLCCGTZTXLTPH-HNNXBMFYSA-N 1 2 307.846 4.193 20 0 DIADLO Clc1cc(C[N@H+]2CC[C@H]2COCc2ccccc2)cs1 ZINC001142769738 1052905495 /nfs/dbraw/zinc/90/54/95/1052905495.db2.gz ZWLCCGTZTXLTPH-HNNXBMFYSA-N 1 2 307.846 4.193 20 0 DIADLO CCC/C(C)=C\C(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1 ZINC000920217035 1052928569 /nfs/dbraw/zinc/92/85/69/1052928569.db2.gz IBQASVFPDZYJGO-UVTDQMKNSA-N 1 2 321.490 4.060 20 0 DIADLO CC(C)[C@@H]1CCC[N@@H+]1Cn1nc(-c2ccccc2F)oc1=S ZINC000920484504 1052942606 /nfs/dbraw/zinc/94/26/06/1052942606.db2.gz FTKSXGNWGVRFNX-AWEZNQCLSA-N 1 2 321.421 4.090 20 0 DIADLO CC(C)[C@@H]1CCC[N@H+]1Cn1nc(-c2ccccc2F)oc1=S ZINC000920484504 1052942610 /nfs/dbraw/zinc/94/26/10/1052942610.db2.gz FTKSXGNWGVRFNX-AWEZNQCLSA-N 1 2 321.421 4.090 20 0 DIADLO Cc1nc(N[C@@H]2CCCCC2(C)C)c(Br)c(C)[nH+]1 ZINC000322899829 1052971018 /nfs/dbraw/zinc/97/10/18/1052971018.db2.gz PHXJQPTXTISCEY-LLVKDONJSA-N 1 2 312.255 4.237 20 0 DIADLO CC[C@H]1CCC[C@H](Nc2nc(C)[nH+]c(C)c2Br)C1 ZINC000322905161 1052974439 /nfs/dbraw/zinc/97/44/39/1052974439.db2.gz QVNTZILCUINZIQ-RYUDHWBXSA-N 1 2 312.255 4.237 20 0 DIADLO Cc1cc[nH+]c(C)c1O[C@@H]1Cc2cccc(Br)c2C1 ZINC001227263056 1052977019 /nfs/dbraw/zinc/97/70/19/1052977019.db2.gz BSPVBXDYVOPMTB-CYBMUJFWSA-N 1 2 318.214 4.007 20 0 DIADLO Cc1nc(N[C@@H](C)c2ccccc2)c(Br)c(C)[nH+]1 ZINC000323005068 1052988369 /nfs/dbraw/zinc/98/83/69/1052988369.db2.gz DTRXJJFJYSKJRS-VIFPVBQESA-N 1 2 306.207 4.029 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1csc2ccccc12 ZINC000610000987 1053002004 /nfs/dbraw/zinc/00/20/04/1053002004.db2.gz KWBZWJYMULCOGS-GFCCVEGCSA-N 1 2 305.443 4.063 20 0 DIADLO C[C@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1csc2ccccc12 ZINC000610000987 1053002010 /nfs/dbraw/zinc/00/20/10/1053002010.db2.gz KWBZWJYMULCOGS-GFCCVEGCSA-N 1 2 305.443 4.063 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2nc(C(C)(C)C)no2)c(C)c1 ZINC000615463396 1053019521 /nfs/dbraw/zinc/01/95/21/1053019521.db2.gz GNFLJDMXGCFFMR-CQSZACIVSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nc(C(C)(C)C)no2)c(C)c1 ZINC000615463396 1053019524 /nfs/dbraw/zinc/01/95/24/1053019524.db2.gz GNFLJDMXGCFFMR-CQSZACIVSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1ccccc1C(N)=[NH+]OCc1cccc(C(F)(F)F)c1 ZINC000849213452 1053064364 /nfs/dbraw/zinc/06/43/64/1053064364.db2.gz IGYKJLCAYPLCQB-UHFFFAOYSA-N 1 2 308.303 4.061 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+][C@H](c2ccccc2)C(C)(C)C)o1 ZINC000068811991 1053072297 /nfs/dbraw/zinc/07/22/97/1053072297.db2.gz XWMICEQKWBNOGI-OAHLLOKOSA-N 1 2 301.434 4.244 20 0 DIADLO CC(C)c1cc(N[C@@H]2CCO[C@H](C(C)C)C2)nc(C(C)C)[nH+]1 ZINC000540038848 1053097082 /nfs/dbraw/zinc/09/70/82/1053097082.db2.gz PNXMKTNGZVGZRB-ZBFHGGJFSA-N 1 2 305.466 4.339 20 0 DIADLO CCCCC[C@H](C(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1)C(C)C ZINC001350826855 1053109891 /nfs/dbraw/zinc/10/98/91/1053109891.db2.gz LSEDCDVMXWPNLI-SFHVURJKSA-N 1 2 319.493 4.043 20 0 DIADLO C[C@H]([NH2+]Cc1cnn(C2CCC2)c1)c1nc(C(C)(C)C)cs1 ZINC001350887548 1053113822 /nfs/dbraw/zinc/11/38/22/1053113822.db2.gz DGSQKJVTFCOVRE-LBPRGKRZSA-N 1 2 318.490 4.213 20 0 DIADLO COc1ccc(CN(C)c2cc(C)c3ccccc3[nH+]2)cc1OC ZINC001317708154 1053128177 /nfs/dbraw/zinc/12/81/77/1053128177.db2.gz ZBFKZXSHYVUJFZ-UHFFFAOYSA-N 1 2 322.408 4.197 20 0 DIADLO CC(C)[C@@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc(Cl)cc1 ZINC000353440467 1053142231 /nfs/dbraw/zinc/14/22/31/1053142231.db2.gz KINFXRSPHKDQCV-NVXWUHKLSA-N 1 2 303.837 4.427 20 0 DIADLO CC(C)Oc1ccc(F)c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001212307997 1053147527 /nfs/dbraw/zinc/14/75/27/1053147527.db2.gz FEUSGWRGDVUWEQ-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO CC(C)Oc1cccc(Nc2ccc[nH+]c2N2CCCC2)c1F ZINC001212317977 1053154127 /nfs/dbraw/zinc/15/41/27/1053154127.db2.gz JXBJJSPUQUYNCN-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1CF)c1nc(C2CCCCC2)no1 ZINC001351294144 1053162495 /nfs/dbraw/zinc/16/24/95/1053162495.db2.gz JBBSAFDGFKMZKV-ZDUSSCGKSA-N 1 2 317.408 4.438 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+][C@H]2CCCc3[nH]ncc32)cc1 ZINC000353498641 1053176374 /nfs/dbraw/zinc/17/63/74/1053176374.db2.gz ASBUPHHHFNUHKV-WBMJQRKESA-N 1 2 301.459 4.250 20 0 DIADLO CC(C)Sc1c(Cl)cccc1NC(=O)[C@H](C)n1cc[nH+]c1 ZINC001318749576 1053188493 /nfs/dbraw/zinc/18/84/93/1053188493.db2.gz RYGFSQQGCDCEAH-NSHDSACASA-N 1 2 323.849 4.237 20 0 DIADLO CC(C)Sc1c(Cl)cccc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001318749573 1053188755 /nfs/dbraw/zinc/18/87/55/1053188755.db2.gz RYGFSQQGCDCEAH-LLVKDONJSA-N 1 2 323.849 4.237 20 0 DIADLO Cc1ccccc1C[N@@H+]1CCO[C@H](c2ccc(Cl)s2)C1 ZINC001318970889 1053207224 /nfs/dbraw/zinc/20/72/24/1053207224.db2.gz WWKXLVWNRLYIDC-AWEZNQCLSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccccc1C[N@H+]1CCO[C@H](c2ccc(Cl)s2)C1 ZINC001318970889 1053207230 /nfs/dbraw/zinc/20/72/30/1053207230.db2.gz WWKXLVWNRLYIDC-AWEZNQCLSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccn2cc(CNc3cc(C)c4ccccc4[nH+]3)nc2c1 ZINC001319301651 1053233555 /nfs/dbraw/zinc/23/35/55/1053233555.db2.gz MISWCROXQGOYGJ-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO Cc1cc(N2CC(c3nc4ccccc4[nH]3)C2)[nH+]c2ccccc12 ZINC001319298808 1053234405 /nfs/dbraw/zinc/23/44/05/1053234405.db2.gz MCRXNPMEOXJFOJ-UHFFFAOYSA-N 1 2 314.392 4.023 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001319334823 1053236004 /nfs/dbraw/zinc/23/60/04/1053236004.db2.gz NNBRKWCPNJFMAI-ZBFHGGJFSA-N 1 2 303.450 4.129 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001319334823 1053236008 /nfs/dbraw/zinc/23/60/08/1053236008.db2.gz NNBRKWCPNJFMAI-ZBFHGGJFSA-N 1 2 303.450 4.129 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC(C)(C)C2(C)C)c(Cl)c1 ZINC001319359752 1053237938 /nfs/dbraw/zinc/23/79/38/1053237938.db2.gz GQEBCEPZGRMXDJ-GFCCVEGCSA-N 1 2 308.853 4.096 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@H+]2CC(C)(C)C2(C)C)c(Cl)c1 ZINC001319359752 1053237948 /nfs/dbraw/zinc/23/79/48/1053237948.db2.gz GQEBCEPZGRMXDJ-GFCCVEGCSA-N 1 2 308.853 4.096 20 0 DIADLO C[C@H](C(=O)Nc1ccc2ccccc2c1)[N@H+](C)CCC(F)(F)F ZINC001319417535 1053241347 /nfs/dbraw/zinc/24/13/47/1053241347.db2.gz ZBLCZLKXJRZCSH-GFCCVEGCSA-N 1 2 324.346 4.051 20 0 DIADLO C[C@H](C(=O)Nc1ccc2ccccc2c1)[N@@H+](C)CCC(F)(F)F ZINC001319417535 1053241351 /nfs/dbraw/zinc/24/13/51/1053241351.db2.gz ZBLCZLKXJRZCSH-GFCCVEGCSA-N 1 2 324.346 4.051 20 0 DIADLO Cc1cc(N(C)[C@@H](CCO)c2ccccc2)[nH+]c2ccccc12 ZINC001319439804 1053242828 /nfs/dbraw/zinc/24/28/28/1053242828.db2.gz UKPVLYHFIYJEFB-IBGZPJMESA-N 1 2 306.409 4.103 20 0 DIADLO Cc1cc(NC[C@](C)(O)c2ccc(F)cc2)[nH+]c2ccccc12 ZINC001319517791 1053247749 /nfs/dbraw/zinc/24/77/49/1053247749.db2.gz NJYATDABDSILJB-IBGZPJMESA-N 1 2 310.372 4.002 20 0 DIADLO Cc1cc(N2CCC(c3cccnc3)CC2)[nH+]c2ccccc12 ZINC001319689710 1053264700 /nfs/dbraw/zinc/26/47/00/1053264700.db2.gz VPCQYZZPDYOFJV-UHFFFAOYSA-N 1 2 303.409 4.322 20 0 DIADLO Cc1cc(NC(=O)c2ccc(C(C)(C)C)c(Cl)c2)cc[nH+]1 ZINC001127644648 1053274876 /nfs/dbraw/zinc/27/48/76/1053274876.db2.gz GNZQEDUJXDXCBK-UHFFFAOYSA-N 1 2 302.805 4.015 20 0 DIADLO CCSc1cc(C[NH2+]Cc2csc(C(C)C)n2)ccn1 ZINC001320481561 1053338551 /nfs/dbraw/zinc/33/85/51/1053338551.db2.gz UNOOPTHWHOHOIW-UHFFFAOYSA-N 1 2 307.488 4.063 20 0 DIADLO Cc1cccc(C2=CC[N@H+]([C@H](C)c3nc(C(C)C)no3)CC2)c1 ZINC000092822195 1053350844 /nfs/dbraw/zinc/35/08/44/1053350844.db2.gz SPLNEUFLDUBKDX-OAHLLOKOSA-N 1 2 311.429 4.352 20 0 DIADLO Cc1cccc(C2=CC[N@@H+]([C@H](C)c3nc(C(C)C)no3)CC2)c1 ZINC000092822195 1053350855 /nfs/dbraw/zinc/35/08/55/1053350855.db2.gz SPLNEUFLDUBKDX-OAHLLOKOSA-N 1 2 311.429 4.352 20 0 DIADLO c1cn(-c2ccc(CNc3ccn(C4CCCCC4)n3)cc2)c[nH+]1 ZINC001320800996 1053362341 /nfs/dbraw/zinc/36/23/41/1053362341.db2.gz VUXDQWKPTGNGRF-UHFFFAOYSA-N 1 2 321.428 4.186 20 0 DIADLO Cc1cccnc1C[N@@H+](C)[C@H](C)c1ccccc1Br ZINC000093168591 1053365597 /nfs/dbraw/zinc/36/55/97/1053365597.db2.gz XEMRWXMFNDTSCJ-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cccnc1C[N@H+](C)[C@H](C)c1ccccc1Br ZINC000093168591 1053365607 /nfs/dbraw/zinc/36/56/07/1053365607.db2.gz XEMRWXMFNDTSCJ-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C)c3ccc(C(C)(C)C)cc3)ccn12 ZINC000847377503 1053367277 /nfs/dbraw/zinc/36/72/77/1053367277.db2.gz YZHLGDPNCNESFN-UHFFFAOYSA-N 1 2 321.424 4.217 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)s1 ZINC000450747670 1053368676 /nfs/dbraw/zinc/36/86/76/1053368676.db2.gz PXKQNTKIWWGJBV-OAHLLOKOSA-N 1 2 301.459 4.389 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CCCC[C@@H]2c2ccccc2)s1 ZINC000450747670 1053368688 /nfs/dbraw/zinc/36/86/88/1053368688.db2.gz PXKQNTKIWWGJBV-OAHLLOKOSA-N 1 2 301.459 4.389 20 0 DIADLO Clc1ncc(CSCc2ccc(-n3cc[nH+]c3)cc2)s1 ZINC001321024125 1053382482 /nfs/dbraw/zinc/38/24/82/1053382482.db2.gz OCHTXTANNVRKMD-UHFFFAOYSA-N 1 2 321.858 4.416 20 0 DIADLO CCOc1ccc2c(c1)C[N@@H+](Cc1cc(C)nc(Cl)c1)CC2 ZINC001321102784 1053391538 /nfs/dbraw/zinc/39/15/38/1053391538.db2.gz DVHOCSFTPOSCGA-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1ccc2c(c1)C[N@H+](Cc1cc(C)nc(Cl)c1)CC2 ZINC001321102784 1053391547 /nfs/dbraw/zinc/39/15/47/1053391547.db2.gz DVHOCSFTPOSCGA-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO COc1ccc2c(c1)CCC[C@H]2[N@H+](C)C/C(Cl)=C\Cl ZINC000763511980 1053408334 /nfs/dbraw/zinc/40/83/34/1053408334.db2.gz PZLYSVPXTQNSRY-SAAWKEMMSA-N 1 2 300.229 4.323 20 0 DIADLO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)C/C(Cl)=C\Cl ZINC000763511980 1053408341 /nfs/dbraw/zinc/40/83/41/1053408341.db2.gz PZLYSVPXTQNSRY-SAAWKEMMSA-N 1 2 300.229 4.323 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@@H]3CCCc4c(O)cccc43)ccc21 ZINC001321586622 1053422653 /nfs/dbraw/zinc/42/26/53/1053422653.db2.gz FYYNEBUFCYCIRQ-GOSISDBHSA-N 1 2 308.425 4.264 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@@H]3CCCc4c(O)cccc43)ccc21 ZINC001321586622 1053422656 /nfs/dbraw/zinc/42/26/56/1053422656.db2.gz FYYNEBUFCYCIRQ-GOSISDBHSA-N 1 2 308.425 4.264 20 0 DIADLO Cc1ccccc1OC[C@@H](C)Oc1ccc(-n2cc[nH+]c2)cc1 ZINC001229954265 1053438166 /nfs/dbraw/zinc/43/81/66/1053438166.db2.gz LSFIHRCYNXEHIF-MRXNPFEDSA-N 1 2 308.381 4.027 20 0 DIADLO FC(F)(F)[C@H]1CC[C@H](Oc2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001229953682 1053438266 /nfs/dbraw/zinc/43/82/66/1053438266.db2.gz CTTHIBCLPWMZAZ-MQMHXKEQSA-N 1 2 310.319 4.372 20 0 DIADLO c1cc(C[NH2+][C@H](c2nccs2)c2ccccc2)n(C2CC2)c1 ZINC001353003457 1053455227 /nfs/dbraw/zinc/45/52/27/1053455227.db2.gz NVOUEICKXYDXKO-KRWDZBQOSA-N 1 2 309.438 4.159 20 0 DIADLO CCc1nc2c(s1)[C@@H](Nc1ccc([NH+](C)C)cc1)CCC2 ZINC000182495113 1053456067 /nfs/dbraw/zinc/45/60/67/1053456067.db2.gz ODSFLSCXNHSKQD-AWEZNQCLSA-N 1 2 301.459 4.261 20 0 DIADLO C[NH+](C)c1ccc(N[C@@H]2CCCOc3ccc(F)cc32)cc1 ZINC000182491708 1053458245 /nfs/dbraw/zinc/45/82/45/1053458245.db2.gz JNPWEPHLISQTPZ-QGZVFWFLSA-N 1 2 300.377 4.218 20 0 DIADLO COc1ccc(CC[C@H](C)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000324512407 1053463058 /nfs/dbraw/zinc/46/30/58/1053463058.db2.gz UODLTPFACHYHBV-INIZCTEOSA-N 1 2 321.424 4.314 20 0 DIADLO C[C@H](CC(=O)Nc1ccc2c(c1)Cc1ccccc1-2)n1cc[nH+]c1 ZINC001353111947 1053482860 /nfs/dbraw/zinc/48/28/60/1053482860.db2.gz UXHCUWORRYTWJR-CQSZACIVSA-N 1 2 317.392 4.044 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+][C@H](C)CSC(C)(C)C ZINC000182609393 1053488477 /nfs/dbraw/zinc/48/84/77/1053488477.db2.gz ZZTZWKHAOQZDLR-OAHLLOKOSA-N 1 2 322.518 4.164 20 0 DIADLO CCc1ccc(CN(C(=O)c2c(C)cc(C)[nH+]c2C)C2CC2)cc1 ZINC001353251195 1053521310 /nfs/dbraw/zinc/52/13/10/1053521310.db2.gz MKGDAELBAXAREE-UHFFFAOYSA-N 1 2 322.452 4.374 20 0 DIADLO Cc1nc2c(s1)[C@@H](Nc1ccc([NH+](C)C)c(C)c1)CCC2 ZINC000182851538 1053532632 /nfs/dbraw/zinc/53/26/32/1053532632.db2.gz DESSNSFBMVPQIR-HNNXBMFYSA-N 1 2 301.459 4.315 20 0 DIADLO CC(C)c1cnc(C[NH+]2CCC(Oc3ccccc3)CC2)s1 ZINC000182998418 1053567678 /nfs/dbraw/zinc/56/76/78/1053567678.db2.gz MBALTZDMCAKUGJ-UHFFFAOYSA-N 1 2 316.470 4.310 20 0 DIADLO C[C@@H](Nc1nc(N)c2ccccc2[nH+]1)c1ccc(Cl)c(F)c1 ZINC001323205669 1053568495 /nfs/dbraw/zinc/56/84/95/1053568495.db2.gz GLJPNHBIVYMTCF-SECBINFHSA-N 1 2 316.767 4.178 20 0 DIADLO Cc1cc(C[NH+](Cc2cccs2)Cc2cccs2)[nH]n1 ZINC001323281390 1053571946 /nfs/dbraw/zinc/57/19/46/1053571946.db2.gz DVEMHTSXHUPDSL-UHFFFAOYSA-N 1 2 303.456 4.044 20 0 DIADLO CC(C)c1ocnc1C[N@@H+]1[C@H](C)Cc2cc(F)ccc2[C@H]1C ZINC001323368232 1053577134 /nfs/dbraw/zinc/57/71/34/1053577134.db2.gz SXILZKAUHWSDLM-CHWSQXEVSA-N 1 2 302.393 4.445 20 0 DIADLO CC(C)c1ocnc1C[N@H+]1[C@H](C)Cc2cc(F)ccc2[C@H]1C ZINC001323368232 1053577146 /nfs/dbraw/zinc/57/71/46/1053577146.db2.gz SXILZKAUHWSDLM-CHWSQXEVSA-N 1 2 302.393 4.445 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)C1CC2(C1)CCCCC2 ZINC001353492948 1053589430 /nfs/dbraw/zinc/58/94/30/1053589430.db2.gz MNXWTIQDRIXFQC-UHFFFAOYSA-N 1 2 309.413 4.171 20 0 DIADLO CC(C)=CCC[C@H](C)[NH2+]c1ccc(N2CCC(O)CC2)cc1 ZINC000183097363 1053589544 /nfs/dbraw/zinc/58/95/44/1053589544.db2.gz QAPPVQLFYVAKNP-INIZCTEOSA-N 1 2 302.462 4.195 20 0 DIADLO CC(C)=CCC[C@H](C)Nc1ccc([NH+]2CCC(O)CC2)cc1 ZINC000183097363 1053589549 /nfs/dbraw/zinc/58/95/49/1053589549.db2.gz QAPPVQLFYVAKNP-INIZCTEOSA-N 1 2 302.462 4.195 20 0 DIADLO C/C(=C/c1ccc(Cl)cc1)C(=O)Nc1cccc2[nH+]ccn21 ZINC001353494789 1053590328 /nfs/dbraw/zinc/59/03/28/1053590328.db2.gz OPHBETBUBLOVKV-QXMHVHEDSA-N 1 2 311.772 4.030 20 0 DIADLO N#Cc1ccccc1C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000070975558 1053591646 /nfs/dbraw/zinc/59/16/46/1053591646.db2.gz JDJOZGFOFQAZJM-UHFFFAOYSA-N 1 2 318.376 4.059 20 0 DIADLO N#Cc1ccccc1C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000070975558 1053591657 /nfs/dbraw/zinc/59/16/57/1053591657.db2.gz JDJOZGFOFQAZJM-UHFFFAOYSA-N 1 2 318.376 4.059 20 0 DIADLO CC[C@H]([NH2+]Cc1csc(N(C)C2CC2)n1)c1ccccc1F ZINC000649740138 1053593929 /nfs/dbraw/zinc/59/39/29/1053593929.db2.gz POJSGFAXXQGDOL-INIZCTEOSA-N 1 2 319.449 4.122 20 0 DIADLO CCN(CC)c1ccc(N[C@H](C)c2ccc(Cl)nc2)c[nH+]1 ZINC000183165648 1053599761 /nfs/dbraw/zinc/59/97/61/1053599761.db2.gz OZDCZEVDPQIWQO-GFCCVEGCSA-N 1 2 304.825 4.149 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000620127971 1053610264 /nfs/dbraw/zinc/61/02/64/1053610264.db2.gz GMQGULUZLWOGJZ-LPMFXHHGSA-N 1 2 317.379 4.488 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000620127971 1053610270 /nfs/dbraw/zinc/61/02/70/1053610270.db2.gz GMQGULUZLWOGJZ-LPMFXHHGSA-N 1 2 317.379 4.488 20 0 DIADLO CCCCc1ccc(NC(=S)Nc2cc[nH+]c(CC)c2)cc1 ZINC001200381640 1053613628 /nfs/dbraw/zinc/61/36/28/1053613628.db2.gz MLGGYDVXKVLXOT-UHFFFAOYSA-N 1 2 313.470 4.217 20 0 DIADLO Cc1ccc(Cl)cc1[C@@H](C)Oc1cc2c(cc1O)C=[NH+]CC2 ZINC001230919934 1053624867 /nfs/dbraw/zinc/62/48/67/1053624867.db2.gz GWAQKGCSXCJYFF-GFCCVEGCSA-N 1 2 315.800 4.469 20 0 DIADLO CCCCC1CCC(C(=O)Nc2ccc(C)[nH+]c2N(C)C)CC1 ZINC001435644300 1053628229 /nfs/dbraw/zinc/62/82/29/1053628229.db2.gz RVHWJEMPAPAAGS-UHFFFAOYSA-N 1 2 317.477 4.391 20 0 DIADLO FC(F)c1cccc(C[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC001324127317 1053628825 /nfs/dbraw/zinc/62/88/25/1053628825.db2.gz CFCCKLYZZZHTMM-OAHLLOKOSA-N 1 2 320.387 4.154 20 0 DIADLO Cl/C=C(/Cl)C[N@@H+]1CCC[C@H](c2nc3ccccc3[nH]2)C1 ZINC001324297181 1053642414 /nfs/dbraw/zinc/64/24/14/1053642414.db2.gz IBLSTUOCHNUBIC-SERMCNLOSA-N 1 2 310.228 4.061 20 0 DIADLO Cl/C=C(/Cl)C[N@H+]1CCC[C@H](c2nc3ccccc3[nH]2)C1 ZINC001324297181 1053642422 /nfs/dbraw/zinc/64/24/22/1053642422.db2.gz IBLSTUOCHNUBIC-SERMCNLOSA-N 1 2 310.228 4.061 20 0 DIADLO Oc1cccc(C[NH2+]Cc2cccc(Cl)c2F)c1Cl ZINC001324491119 1053656846 /nfs/dbraw/zinc/65/68/46/1053656846.db2.gz XLPKBNVJDKXUGE-UHFFFAOYSA-N 1 2 300.160 4.128 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Nc1ccccc1Oc1ccccc1 ZINC000620409239 1053659522 /nfs/dbraw/zinc/65/95/22/1053659522.db2.gz JLZOVCYTSFQDEQ-UHFFFAOYSA-N 1 2 321.380 4.094 20 0 DIADLO Cc1cc(NC(=O)C2(c3ccccc3)CCCCCC2)cc[nH+]1 ZINC001435759180 1053667438 /nfs/dbraw/zinc/66/74/38/1053667438.db2.gz YFHBEPORBJCTDX-UHFFFAOYSA-N 1 2 308.425 4.043 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(O[C@@H]2CCC(=O)c3ccccc32)cc1 ZINC001231079223 1053668700 /nfs/dbraw/zinc/66/87/00/1053668700.db2.gz JDAUWVRANJATDA-HXUWFJFHSA-N 1 2 318.376 4.184 20 0 DIADLO C[C@@H](Oc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(F)c(F)c1 ZINC001231081411 1053669298 /nfs/dbraw/zinc/66/92/98/1053669298.db2.gz KYNLLSFZUWBZML-LLVKDONJSA-N 1 2 300.308 4.495 20 0 DIADLO C[C@@H](Oc1ccc(-c2c[nH+]cn2C)cc1)c1cccc(N(C)C)c1 ZINC001231083678 1053671292 /nfs/dbraw/zinc/67/12/92/1053671292.db2.gz NEFNLOUZJWFQCC-OAHLLOKOSA-N 1 2 321.424 4.293 20 0 DIADLO C[C@H](COc1ccc(-c2c[nH+]cn2C)cc1)OCc1ccccc1 ZINC001231083671 1053671391 /nfs/dbraw/zinc/67/13/91/1053671391.db2.gz NBXVLMCJJCQKPE-MRXNPFEDSA-N 1 2 322.408 4.071 20 0 DIADLO Cc1ccc2c(c1)[C@H](Oc1ccc(-c3c[nH+]cn3C)cc1)CC2 ZINC001231082453 1053671657 /nfs/dbraw/zinc/67/16/57/1053671657.db2.gz PPKSLWLCAWDISV-HXUWFJFHSA-N 1 2 304.393 4.462 20 0 DIADLO C[C@@H](Oc1ccc(-c2[nH]cc[nH+]2)cc1)c1c(F)cccc1F ZINC001231084194 1053671820 /nfs/dbraw/zinc/67/18/20/1053671820.db2.gz ZMIMHUUYIUAXAC-LLVKDONJSA-N 1 2 300.308 4.495 20 0 DIADLO Cc1ccccc1OC[C@H](C)Oc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001231082775 1053672256 /nfs/dbraw/zinc/67/22/56/1053672256.db2.gz ZDBWCKQJZDLIKR-HNNXBMFYSA-N 1 2 308.381 4.231 20 0 DIADLO C[C@H]1CCc2nc(C[N@@H+]3CCC[C@H]3c3ccccn3)sc2C1 ZINC001324716175 1053673186 /nfs/dbraw/zinc/67/31/86/1053673186.db2.gz HMXCRJSVIOYQLB-BBRMVZONSA-N 1 2 313.470 4.000 20 0 DIADLO C[C@H]1CCc2nc(C[N@H+]3CCC[C@H]3c3ccccn3)sc2C1 ZINC001324716175 1053673190 /nfs/dbraw/zinc/67/31/90/1053673190.db2.gz HMXCRJSVIOYQLB-BBRMVZONSA-N 1 2 313.470 4.000 20 0 DIADLO COc1ccc2c(c1)CC[C@@H](Oc1ccc(-c3[nH]cc[nH+]3)cc1)C2 ZINC001231085827 1053673412 /nfs/dbraw/zinc/67/34/12/1053673412.db2.gz YQQYXFWWBXDUPW-LJQANCHMSA-N 1 2 320.392 4.022 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@@H]3C[C@@H]32)ccc1Br ZINC001231437522 1053752756 /nfs/dbraw/zinc/75/27/56/1053752756.db2.gz ZELWQYXQFKAWDR-MFKMUULPSA-N 1 2 300.627 4.087 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cnc(Cl)s2)cc1Cl ZINC001231417556 1053746132 /nfs/dbraw/zinc/74/61/32/1053746132.db2.gz KVXCKQYQRFLTDD-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cnc(Cl)s2)cc1Cl ZINC001231417556 1053746145 /nfs/dbraw/zinc/74/61/45/1053746145.db2.gz KVXCKQYQRFLTDD-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2noc(C3CCCCC3)n2)C1 ZINC000154153522 1053728655 /nfs/dbraw/zinc/72/86/55/1053728655.db2.gz CYDDYVGZTOHUJR-CABCVRRESA-N 1 2 323.506 4.223 20 0 DIADLO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2noc(C3CCCCC3)n2)C1 ZINC000154153522 1053728669 /nfs/dbraw/zinc/72/86/69/1053728669.db2.gz CYDDYVGZTOHUJR-CABCVRRESA-N 1 2 323.506 4.223 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2c(F)ccc(F)c2OC)cc1 ZINC001231413789 1053746965 /nfs/dbraw/zinc/74/69/65/1053746965.db2.gz BRHFDWWNTJHXRP-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2c(F)ccc(F)c2OC)cc1 ZINC001231413789 1053746970 /nfs/dbraw/zinc/74/69/70/1053746970.db2.gz BRHFDWWNTJHXRP-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO CC1(F)CC[NH+](Cc2ccc(Br)c(Cl)c2)CC1 ZINC001231434825 1053751739 /nfs/dbraw/zinc/75/17/39/1053751739.db2.gz DGULBOHNVCRVMG-UHFFFAOYSA-N 1 2 320.633 4.427 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@@H]3C[C@@H]32)ccc1Br ZINC001231437522 1053752747 /nfs/dbraw/zinc/75/27/47/1053752747.db2.gz ZELWQYXQFKAWDR-MFKMUULPSA-N 1 2 300.627 4.087 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@H+](C)Cc1nccn1C(F)F ZINC000154973721 1053754800 /nfs/dbraw/zinc/75/48/00/1053754800.db2.gz XLSJBTOBJIGUSS-UHFFFAOYSA-N 1 2 313.779 4.180 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@@H+](C)Cc1nccn1C(F)F ZINC000154973721 1053754814 /nfs/dbraw/zinc/75/48/14/1053754814.db2.gz XLSJBTOBJIGUSS-UHFFFAOYSA-N 1 2 313.779 4.180 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)C1[C@@H]2CCCCCC[C@@H]12 ZINC001354094986 1053763655 /nfs/dbraw/zinc/76/36/55/1053763655.db2.gz APSYFJCKWIOWRT-IAGOWNOFSA-N 1 2 309.413 4.027 20 0 DIADLO C[C@@H]1CO[C@@H]2C[N@H+](Cc3c(Cl)ccc(Cl)c3Cl)C[C@H]12 ZINC001231481755 1053763891 /nfs/dbraw/zinc/76/38/91/1053763891.db2.gz MPFYPOAVAHDGHX-JRKPZEMJSA-N 1 2 320.647 4.114 20 0 DIADLO C[C@@H]1CO[C@@H]2C[N@@H+](Cc3c(Cl)ccc(Cl)c3Cl)C[C@H]12 ZINC001231481755 1053763899 /nfs/dbraw/zinc/76/38/99/1053763899.db2.gz MPFYPOAVAHDGHX-JRKPZEMJSA-N 1 2 320.647 4.114 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1nnc(-c2ccccc2)s1 ZINC000155207943 1053768420 /nfs/dbraw/zinc/76/84/20/1053768420.db2.gz DAXWYWLTZNMRQW-CQSZACIVSA-N 1 2 321.449 4.324 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1nnc(-c2ccccc2)s1 ZINC000155207943 1053768427 /nfs/dbraw/zinc/76/84/27/1053768427.db2.gz DAXWYWLTZNMRQW-CQSZACIVSA-N 1 2 321.449 4.324 20 0 DIADLO Fc1cccc2c1CC[C@H]2[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC001326267485 1053769712 /nfs/dbraw/zinc/76/97/12/1053769712.db2.gz QJCQXJOAQABFTI-LJQANCHMSA-N 1 2 319.383 4.015 20 0 DIADLO Fc1cccc2c1CC[C@H]2[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC001326267485 1053769723 /nfs/dbraw/zinc/76/97/23/1053769723.db2.gz QJCQXJOAQABFTI-LJQANCHMSA-N 1 2 319.383 4.015 20 0 DIADLO Oc1ccc(C[N@H+]2CCc3ccsc3C2)cc1C(F)(F)F ZINC001231522878 1053778069 /nfs/dbraw/zinc/77/80/69/1053778069.db2.gz LOBCRKJNTAVQMS-UHFFFAOYSA-N 1 2 313.344 4.031 20 0 DIADLO C[C@H]([NH2+]Cc1ccnn1C1CCC1)c1nc(C(C)(C)C)cs1 ZINC001354159758 1053783670 /nfs/dbraw/zinc/78/36/70/1053783670.db2.gz DKCMGVGWVVISQN-LBPRGKRZSA-N 1 2 318.490 4.213 20 0 DIADLO Clc1ccc(C[N@@H+]2CCC[C@@H]3C[C@@H]32)cc1Br ZINC001231570015 1053785112 /nfs/dbraw/zinc/78/51/12/1053785112.db2.gz SSLWYKWZDUPQGD-MFKMUULPSA-N 1 2 300.627 4.087 20 0 DIADLO Clc1ccc(C[N@H+]2CCC[C@@H]3C[C@@H]32)cc1Br ZINC001231570015 1053785120 /nfs/dbraw/zinc/78/51/20/1053785120.db2.gz SSLWYKWZDUPQGD-MFKMUULPSA-N 1 2 300.627 4.087 20 0 DIADLO Brc1c[nH]c(C[N@H+]2CC=C(c3ccccc3)CC2)c1 ZINC001231576183 1053786489 /nfs/dbraw/zinc/78/64/89/1053786489.db2.gz ZVFJGUDSVFJLGK-UHFFFAOYSA-N 1 2 317.230 4.067 20 0 DIADLO Brc1c[nH]c(C[N@@H+]2CC=C(c3ccccc3)CC2)c1 ZINC001231576183 1053786500 /nfs/dbraw/zinc/78/65/00/1053786500.db2.gz ZVFJGUDSVFJLGK-UHFFFAOYSA-N 1 2 317.230 4.067 20 0 DIADLO c1cncc([C@@H]2CCCC[N@H+]2Cc2nc3c(s2)CCCC3)c1 ZINC001231581761 1053789206 /nfs/dbraw/zinc/78/92/06/1053789206.db2.gz CUEWVPVEFKKDSD-INIZCTEOSA-N 1 2 313.470 4.144 20 0 DIADLO c1cncc([C@@H]2CCCC[N@@H+]2Cc2nc3c(s2)CCCC3)c1 ZINC001231581761 1053789209 /nfs/dbraw/zinc/78/92/09/1053789209.db2.gz CUEWVPVEFKKDSD-INIZCTEOSA-N 1 2 313.470 4.144 20 0 DIADLO Cc1cc(NCc2ccc(OC(F)F)cn2)[nH+]c2ccccc12 ZINC001326560411 1053792099 /nfs/dbraw/zinc/79/20/99/1053792099.db2.gz GYJIFLLZXDFTIL-UHFFFAOYSA-N 1 2 315.323 4.152 20 0 DIADLO CO[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)C1 ZINC001231599139 1053798629 /nfs/dbraw/zinc/79/86/29/1053798629.db2.gz FJAKVATWKLHQEJ-LLVKDONJSA-N 1 2 308.636 4.258 20 0 DIADLO CO[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)C1 ZINC001231599139 1053798633 /nfs/dbraw/zinc/79/86/33/1053798633.db2.gz FJAKVATWKLHQEJ-LLVKDONJSA-N 1 2 308.636 4.258 20 0 DIADLO C[C@H]1CC[C@@H](CO)C[N@@H+]1Cc1cc(Cl)cc(Cl)c1Cl ZINC001231597613 1053794834 /nfs/dbraw/zinc/79/48/34/1053794834.db2.gz FEWAHDZLGUJJAW-VHSXEESVSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1CC[C@@H](CO)C[N@H+]1Cc1cc(Cl)cc(Cl)c1Cl ZINC001231597613 1053794843 /nfs/dbraw/zinc/79/48/43/1053794843.db2.gz FEWAHDZLGUJJAW-VHSXEESVSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)CC[C@@]1(C)O ZINC001231599039 1053798670 /nfs/dbraw/zinc/79/86/70/1053798670.db2.gz ZLIDLPJOLVIPRA-LKFCYVNXSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)CC[C@@]1(C)O ZINC001231599039 1053798676 /nfs/dbraw/zinc/79/86/76/1053798676.db2.gz ZLIDLPJOLVIPRA-LKFCYVNXSA-N 1 2 322.663 4.240 20 0 DIADLO FC[C@H]1[C@@H]2C[N@@H+](Cc3cc(Cl)cc(Cl)c3Cl)C[C@H]12 ZINC001231604157 1053800993 /nfs/dbraw/zinc/80/09/93/1053800993.db2.gz JXCGJYADZDCOIL-RTCCRHLQSA-N 1 2 308.611 4.294 20 0 DIADLO FC[C@H]1[C@@H]2C[N@H+](Cc3cc(Cl)cc(Cl)c3Cl)C[C@H]12 ZINC001231604157 1053800979 /nfs/dbraw/zinc/80/09/79/1053800979.db2.gz JXCGJYADZDCOIL-RTCCRHLQSA-N 1 2 308.611 4.294 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)ccn1 ZINC000671098170 1053802399 /nfs/dbraw/zinc/80/23/99/1053802399.db2.gz HXEGUBQOOWLDFW-LIRRHRJNSA-N 1 2 308.381 4.123 20 0 DIADLO Cn1c(Cl)ncc1C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001326891656 1053807511 /nfs/dbraw/zinc/80/75/11/1053807511.db2.gz SSMKGLSUXPMALS-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1c(Cl)ncc1C[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001326891656 1053807522 /nfs/dbraw/zinc/80/75/22/1053807522.db2.gz SSMKGLSUXPMALS-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO COc1cc(C)c(C[N@H+](C)Cc2nccs2)cc1C(C)C ZINC001231628680 1053810573 /nfs/dbraw/zinc/81/05/73/1053810573.db2.gz GQNMREDLTWPRTL-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO COc1cc(C)c(C[N@@H+](C)Cc2nccs2)cc1C(C)C ZINC001231628680 1053810583 /nfs/dbraw/zinc/81/05/83/1053810583.db2.gz GQNMREDLTWPRTL-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO CCc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)nc1 ZINC001231643079 1053812353 /nfs/dbraw/zinc/81/23/53/1053812353.db2.gz XZEWUYRACLENLJ-SFHVURJKSA-N 1 2 302.368 4.259 20 0 DIADLO CCc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)nc1 ZINC001231643079 1053812363 /nfs/dbraw/zinc/81/23/63/1053812363.db2.gz XZEWUYRACLENLJ-SFHVURJKSA-N 1 2 302.368 4.259 20 0 DIADLO C/C=C(/CC)C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001436226677 1053816817 /nfs/dbraw/zinc/81/68/17/1053816817.db2.gz ICTHKWAMODAPSE-BNNQUZSASA-N 1 2 310.397 4.148 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C)c3ccc4ccccc4c3)ccn12 ZINC001354285090 1053818990 /nfs/dbraw/zinc/81/89/90/1053818990.db2.gz YSZCAEWTFIHJAD-UHFFFAOYSA-N 1 2 315.376 4.073 20 0 DIADLO FC(F)(F)c1nn(CCCc2ccccc2)c2cc[nH+]cc21 ZINC000156704460 1053822051 /nfs/dbraw/zinc/82/20/51/1053822051.db2.gz JFZOPISAWJMVGP-UHFFFAOYSA-N 1 2 305.303 4.083 20 0 DIADLO CSc1ccccc1[C@H](C)[NH2+][C@H]1COc2cc(F)cc(F)c21 ZINC001327031251 1053828327 /nfs/dbraw/zinc/82/83/27/1053828327.db2.gz CNNDWDJRBULQFS-HZMBPMFUSA-N 1 2 321.392 4.471 20 0 DIADLO CCC(C)(C)C1CCC2(C[C@H]2c2nnc(C[NH+](C)C)o2)CC1 ZINC001327043333 1053830245 /nfs/dbraw/zinc/83/02/45/1053830245.db2.gz YXOKFBBASOKYMA-FVRSWCFKSA-N 1 2 305.466 4.231 20 0 DIADLO COc1cc(C)nc(C[NH2+]Cc2cc(Cl)sc2Cl)c1 ZINC000312753013 1053830611 /nfs/dbraw/zinc/83/06/11/1053830611.db2.gz YZXSEKICUGIDIT-UHFFFAOYSA-N 1 2 317.241 4.057 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)Cc2ccc(F)cc2)c(OC)c1 ZINC001231693665 1053833484 /nfs/dbraw/zinc/83/34/84/1053833484.db2.gz DGFGPKTZHPNKLT-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)Cc2ccc(F)cc2)c(OC)c1 ZINC001231693665 1053833506 /nfs/dbraw/zinc/83/35/06/1053833506.db2.gz DGFGPKTZHPNKLT-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COCc1ccc(C[N@H+](Cc2ccccc2)Cc2cccnc2)o1 ZINC001231692050 1053834950 /nfs/dbraw/zinc/83/49/50/1053834950.db2.gz WFTQKLYWLBGNQM-UHFFFAOYSA-N 1 2 322.408 4.023 20 0 DIADLO COCc1ccc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)o1 ZINC001231692050 1053834966 /nfs/dbraw/zinc/83/49/66/1053834966.db2.gz WFTQKLYWLBGNQM-UHFFFAOYSA-N 1 2 322.408 4.023 20 0 DIADLO Oc1cc(C[N@@H+]2CCCC[C@H]2c2cccnc2)ccc1Cl ZINC001231736496 1053843992 /nfs/dbraw/zinc/84/39/92/1053843992.db2.gz HVIPOWHEEJRHPY-INIZCTEOSA-N 1 2 302.805 4.168 20 0 DIADLO Oc1cc(C[N@H+]2CCCC[C@H]2c2cccnc2)ccc1Cl ZINC001231736496 1053844013 /nfs/dbraw/zinc/84/40/13/1053844013.db2.gz HVIPOWHEEJRHPY-INIZCTEOSA-N 1 2 302.805 4.168 20 0 DIADLO Oc1cc(C[N@@H+]2CCSc3ccccc3C2)ccc1Cl ZINC001231734575 1053846473 /nfs/dbraw/zinc/84/64/73/1053846473.db2.gz BYTAIDMEVYTUIU-UHFFFAOYSA-N 1 2 305.830 4.154 20 0 DIADLO Oc1cc(C[N@H+]2CCSc3ccccc3C2)ccc1Cl ZINC001231734575 1053846487 /nfs/dbraw/zinc/84/64/87/1053846487.db2.gz BYTAIDMEVYTUIU-UHFFFAOYSA-N 1 2 305.830 4.154 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000157396511 1053854718 /nfs/dbraw/zinc/85/47/18/1053854718.db2.gz FBLNVWOVMVFLCF-QGZVFWFLSA-N 1 2 317.454 4.109 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000157396511 1053854734 /nfs/dbraw/zinc/85/47/34/1053854734.db2.gz FBLNVWOVMVFLCF-QGZVFWFLSA-N 1 2 317.454 4.109 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H]2C[C@H](C)Sc3sccc32)s1 ZINC000274140702 1053859404 /nfs/dbraw/zinc/85/94/04/1053859404.db2.gz DCKVWYGELASDKH-RNSXUZJQSA-N 1 2 311.501 4.184 20 0 DIADLO C[C@H](c1ccccc1)N(C)c1nc2ccccc2n2c[nH+]cc12 ZINC001472642515 1053861047 /nfs/dbraw/zinc/86/10/47/1053861047.db2.gz SXVGFUJKPAGIRT-CQSZACIVSA-N 1 2 302.381 4.080 20 0 DIADLO Cc1nc(-c2ccccc2)ncc1C[N@H+](Cc1ccco1)C1CC1 ZINC001231800236 1053861349 /nfs/dbraw/zinc/86/13/49/1053861349.db2.gz KKOSZSOAVDDKCH-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1nc(-c2ccccc2)ncc1C[N@@H+](Cc1ccco1)C1CC1 ZINC001231800236 1053861361 /nfs/dbraw/zinc/86/13/61/1053861361.db2.gz KKOSZSOAVDDKCH-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO COc1cccc2cc([C@@H](C)[NH2+][C@@H](C)c3nnc(C)s3)oc21 ZINC000274288661 1053862658 /nfs/dbraw/zinc/86/26/58/1053862658.db2.gz ZYIZEWBGEHZFMD-ZJUUUORDSA-N 1 2 317.414 4.013 20 0 DIADLO CC[N@H+](CC(=O)OC(C)(C)C)Cc1ccc(OC(C)(C)C)cc1 ZINC001231804815 1053863525 /nfs/dbraw/zinc/86/35/25/1053863525.db2.gz IJNREYKRRNFSTF-UHFFFAOYSA-N 1 2 321.461 4.028 20 0 DIADLO CC[N@@H+](CC(=O)OC(C)(C)C)Cc1ccc(OC(C)(C)C)cc1 ZINC001231804815 1053863538 /nfs/dbraw/zinc/86/35/38/1053863538.db2.gz IJNREYKRRNFSTF-UHFFFAOYSA-N 1 2 321.461 4.028 20 0 DIADLO COc1cccc2cc(C[NH2+][C@@H](C)c3csc(C)n3)oc21 ZINC001327625286 1053869202 /nfs/dbraw/zinc/86/92/02/1053869202.db2.gz NTGHRCARVGMXOD-JTQLQIEISA-N 1 2 302.399 4.057 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc(-c3ccccc3)o1)C2 ZINC001231812624 1053871121 /nfs/dbraw/zinc/87/11/21/1053871121.db2.gz AGLNBPZNGCJRGE-UHFFFAOYSA-N 1 2 305.377 4.471 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc(-c3ccccc3)o1)C2 ZINC001231812624 1053871142 /nfs/dbraw/zinc/87/11/42/1053871142.db2.gz AGLNBPZNGCJRGE-UHFFFAOYSA-N 1 2 305.377 4.471 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1coc(C(C)(C)C)n1 ZINC001354498613 1053885218 /nfs/dbraw/zinc/88/52/18/1053885218.db2.gz HQPPIFHWVSVMDH-QWRGUYRKSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1coc(C(C)(C)C)n1 ZINC001354498613 1053885231 /nfs/dbraw/zinc/88/52/31/1053885231.db2.gz HQPPIFHWVSVMDH-QWRGUYRKSA-N 1 2 304.356 4.135 20 0 DIADLO COC(C)(C)[C@@H](C)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000671119602 1053888344 /nfs/dbraw/zinc/88/83/44/1053888344.db2.gz GGHSHDXEGAZLAA-CQSZACIVSA-N 1 2 313.445 4.112 20 0 DIADLO Cc1cccc2nc(NCc3ccc(-n4cc[nH+]c4)c(F)c3)oc21 ZINC001327952629 1053899387 /nfs/dbraw/zinc/89/93/87/1053899387.db2.gz CZRQSWVYIAAQHX-UHFFFAOYSA-N 1 2 322.343 4.073 20 0 DIADLO c1ccc2c(c1)C[NH+](Cc1ccc(OC3CCCCC3)nc1)C2 ZINC001231871427 1053900487 /nfs/dbraw/zinc/90/04/87/1053900487.db2.gz KPAYCGAASUDSNH-UHFFFAOYSA-N 1 2 308.425 4.309 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C)sc2C)c(OC)c1 ZINC000315435145 1053905841 /nfs/dbraw/zinc/90/58/41/1053905841.db2.gz KYFAEUDXHFEJQZ-QWRGUYRKSA-N 1 2 320.458 4.189 20 0 DIADLO FC(F)(F)c1cc(Cl)c(C[NH+]2CC3(C2)CCCC3)cn1 ZINC001231901667 1053912334 /nfs/dbraw/zinc/91/23/34/1053912334.db2.gz SYRJQYWMWHDXJS-UHFFFAOYSA-N 1 2 304.743 4.130 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)cnc1F ZINC001231926636 1053915343 /nfs/dbraw/zinc/91/53/43/1053915343.db2.gz COKJMTRXGOGNEL-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)cnc1F ZINC001231926636 1053915357 /nfs/dbraw/zinc/91/53/57/1053915357.db2.gz COKJMTRXGOGNEL-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)cnc1F ZINC001231925896 1053917237 /nfs/dbraw/zinc/91/72/37/1053917237.db2.gz BNJPMEDREROQGP-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1cc(C[N@H+]2CCc3cc(C(F)(F)F)ccc3C2)cnc1F ZINC001231925896 1053917242 /nfs/dbraw/zinc/91/72/42/1053917242.db2.gz BNJPMEDREROQGP-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)cnc1F ZINC001231926635 1053917261 /nfs/dbraw/zinc/91/72/61/1053917261.db2.gz COKJMTRXGOGNEL-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)cnc1F ZINC001231926635 1053917270 /nfs/dbraw/zinc/91/72/70/1053917270.db2.gz COKJMTRXGOGNEL-INIZCTEOSA-N 1 2 306.331 4.144 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1cncc(Cl)c1 ZINC000621242589 1053917804 /nfs/dbraw/zinc/91/78/04/1053917804.db2.gz QPPLBODSQJKAHL-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1cncc(Cl)c1 ZINC000621242589 1053917816 /nfs/dbraw/zinc/91/78/16/1053917816.db2.gz QPPLBODSQJKAHL-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1cc(NC[C@@]2(C)CCCc3ccccc32)nc(C2CC2)[nH+]1 ZINC001472747937 1053921036 /nfs/dbraw/zinc/92/10/36/1053921036.db2.gz IAGIJECAJKQKHV-HXUWFJFHSA-N 1 2 307.441 4.369 20 0 DIADLO CC1(C)C[N@H+](Cc2ncccc2C(F)(F)F)Cc2ccccc21 ZINC001231965068 1053921370 /nfs/dbraw/zinc/92/13/70/1053921370.db2.gz NONBEJJGAKZDAC-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO CC1(C)C[N@@H+](Cc2ncccc2C(F)(F)F)Cc2ccccc21 ZINC001231965068 1053921383 /nfs/dbraw/zinc/92/13/83/1053921383.db2.gz NONBEJJGAKZDAC-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO Cc1cc(F)ncc1C[N@H+](Cc1ccccc1)Cc1ccccn1 ZINC001231979485 1053930549 /nfs/dbraw/zinc/93/05/49/1053930549.db2.gz CGOBYQFGZRLGST-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+](Cc1ccccc1)Cc1ccccn1 ZINC001231979485 1053930558 /nfs/dbraw/zinc/93/05/58/1053930558.db2.gz CGOBYQFGZRLGST-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO O=C(C[C@H]1CCC[N@H+]1Cc1cncc(Cl)c1)c1cccs1 ZINC000621268623 1053936640 /nfs/dbraw/zinc/93/66/40/1053936640.db2.gz RYDLCTMUAQWPCK-CQSZACIVSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@H]1CCC[N@@H+]1Cc1cncc(Cl)c1)c1cccs1 ZINC000621268623 1053936647 /nfs/dbraw/zinc/93/66/47/1053936647.db2.gz RYDLCTMUAQWPCK-CQSZACIVSA-N 1 2 320.845 4.034 20 0 DIADLO C[C@H]([NH2+]Cc1cncc(Cl)c1)c1nc(C(F)(F)F)cs1 ZINC000621288337 1053942393 /nfs/dbraw/zinc/94/23/93/1053942393.db2.gz URCMGJMOKDUXLU-ZETCQYMHSA-N 1 2 321.755 4.061 20 0 DIADLO Cc1cnc(C[NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)o1 ZINC000621351865 1053948671 /nfs/dbraw/zinc/94/86/71/1053948671.db2.gz DLUCWHHEABXJRM-UHFFFAOYSA-N 1 2 310.319 4.171 20 0 DIADLO CCCc1ccc(C[NH2+]C2(c3noc(C)n3)CCCCC2)s1 ZINC000621333255 1053949771 /nfs/dbraw/zinc/94/97/71/1053949771.db2.gz ZQBYRZRHNBDDQN-UHFFFAOYSA-N 1 2 319.474 4.341 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1cccc(C(F)(F)F)n1 ZINC001232066884 1053952425 /nfs/dbraw/zinc/95/24/25/1053952425.db2.gz MDVHKBBKQPPIIE-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cccc(C(F)(F)F)n1 ZINC001232066884 1053952434 /nfs/dbraw/zinc/95/24/34/1053952434.db2.gz MDVHKBBKQPPIIE-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO CSc1ccc(F)cc1C[NH2+]Cc1ncc(C(C)C)s1 ZINC001200762618 1053953353 /nfs/dbraw/zinc/95/33/53/1053953353.db2.gz ZEJSOKURLHRVFH-UHFFFAOYSA-N 1 2 310.463 4.417 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc(C(F)(F)F)n2)cn1 ZINC001232073450 1053954503 /nfs/dbraw/zinc/95/45/03/1053954503.db2.gz DVDKLLLWHPYJCW-HNNXBMFYSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cccc(C(F)(F)F)n2)cn1 ZINC001232073450 1053954513 /nfs/dbraw/zinc/95/45/13/1053954513.db2.gz DVDKLLLWHPYJCW-HNNXBMFYSA-N 1 2 321.346 4.141 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(C(F)(F)F)n2)Cc2ccccc21 ZINC001232073941 1053955161 /nfs/dbraw/zinc/95/51/61/1053955161.db2.gz NYHKHAFBTPXPHV-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(C(F)(F)F)n2)Cc2ccccc21 ZINC001232073941 1053955178 /nfs/dbraw/zinc/95/51/78/1053955178.db2.gz NYHKHAFBTPXPHV-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cncc(Cl)c2)cc1F ZINC000621316185 1053955829 /nfs/dbraw/zinc/95/58/29/1053955829.db2.gz HNWKLXDGODKDNE-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cncc(Cl)c2)cc1F ZINC000621316185 1053955841 /nfs/dbraw/zinc/95/58/41/1053955841.db2.gz HNWKLXDGODKDNE-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CCCC[N@H+](Cc1nc(C(C)C)no1)[C@H](C)c1ccc(C)o1 ZINC000621317410 1053957945 /nfs/dbraw/zinc/95/79/45/1053957945.db2.gz AKMCRGFNNWITCZ-CQSZACIVSA-N 1 2 305.422 4.458 20 0 DIADLO CCCC[N@@H+](Cc1nc(C(C)C)no1)[C@H](C)c1ccc(C)o1 ZINC000621317410 1053957958 /nfs/dbraw/zinc/95/79/58/1053957958.db2.gz AKMCRGFNNWITCZ-CQSZACIVSA-N 1 2 305.422 4.458 20 0 DIADLO CCC[C@@H](CC1CCCC1)C(=O)NCc1c[nH+]c(C)cc1C ZINC001436736342 1053961680 /nfs/dbraw/zinc/96/16/80/1053961680.db2.gz IOKFQGWACKCRRW-KRWDZBQOSA-N 1 2 302.462 4.311 20 0 DIADLO C[C@@H](Nc1ccc([NH+]2CCCC2)cc1)c1cn2ccccc2n1 ZINC001329114048 1053967938 /nfs/dbraw/zinc/96/79/38/1053967938.db2.gz MWIFJAWYWRUOKB-OAHLLOKOSA-N 1 2 306.413 4.108 20 0 DIADLO Fc1ccc(OCc2ccccc2)c(C[NH+]2CC(C(F)F)C2)c1 ZINC001232117953 1053969286 /nfs/dbraw/zinc/96/92/86/1053969286.db2.gz AYPAREBKSDBSTB-UHFFFAOYSA-N 1 2 321.342 4.102 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2nc(Cl)ccc2F)cc1 ZINC001232162301 1053974972 /nfs/dbraw/zinc/97/49/72/1053974972.db2.gz CKMIEPDVUNEKCD-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2nc(Cl)ccc2F)cc1 ZINC001232162301 1053974979 /nfs/dbraw/zinc/97/49/79/1053974979.db2.gz CKMIEPDVUNEKCD-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ncc(C)cc2Br)c1 ZINC001232172304 1053979572 /nfs/dbraw/zinc/97/95/72/1053979572.db2.gz DOLFKLFBCPCFRX-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ncc(C)cc2Br)c1 ZINC001232172304 1053979578 /nfs/dbraw/zinc/97/95/78/1053979578.db2.gz DOLFKLFBCPCFRX-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO CC[C@H]1CO[C@@](C)(CCC(C)C)[N@@H+]1Cc1cn(C)nc1C1CC1 ZINC001232175017 1053980166 /nfs/dbraw/zinc/98/01/66/1053980166.db2.gz SBQNSJKUVHOHIH-HKUYNNGSSA-N 1 2 319.493 4.061 20 0 DIADLO CC[C@H]1CO[C@@](C)(CCC(C)C)[N@H+]1Cc1cn(C)nc1C1CC1 ZINC001232175017 1053980178 /nfs/dbraw/zinc/98/01/78/1053980178.db2.gz SBQNSJKUVHOHIH-HKUYNNGSSA-N 1 2 319.493 4.061 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2cnn(-c3ccccc3)c2)on1 ZINC001200802319 1053987865 /nfs/dbraw/zinc/98/78/65/1053987865.db2.gz FSFCELWGFYBTTQ-UHFFFAOYSA-N 1 2 324.428 4.054 20 0 DIADLO CC[C@]1(C)CC(=O)N(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)C1 ZINC001329441985 1053989978 /nfs/dbraw/zinc/98/99/78/1053989978.db2.gz CZZACRJQEYKXDC-SJLPKXTDSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@]1(C)CC(=O)N(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)C1 ZINC001329441985 1053989995 /nfs/dbraw/zinc/98/99/95/1053989995.db2.gz CZZACRJQEYKXDC-SJLPKXTDSA-N 1 2 320.864 4.083 20 0 DIADLO CCCC[N@H+](Cc1nnc(C2CC2)o1)[C@@H](C)c1ccc(C)o1 ZINC000621739190 1054006481 /nfs/dbraw/zinc/00/64/81/1054006481.db2.gz UEOJOZHXZNIOST-ZDUSSCGKSA-N 1 2 303.406 4.212 20 0 DIADLO CCCC[N@@H+](Cc1nnc(C2CC2)o1)[C@@H](C)c1ccc(C)o1 ZINC000621739190 1054006489 /nfs/dbraw/zinc/00/64/89/1054006489.db2.gz UEOJOZHXZNIOST-ZDUSSCGKSA-N 1 2 303.406 4.212 20 0 DIADLO COCc1ccc(C[N@@H+]2CCc3c4ccccc4oc3C2)cc1 ZINC001232302079 1054016736 /nfs/dbraw/zinc/01/67/36/1054016736.db2.gz HPYHHEDMCLZMHB-UHFFFAOYSA-N 1 2 307.393 4.138 20 0 DIADLO COCc1ccc(C[N@H+]2CCc3c4ccccc4oc3C2)cc1 ZINC001232302079 1054016747 /nfs/dbraw/zinc/01/67/47/1054016747.db2.gz HPYHHEDMCLZMHB-UHFFFAOYSA-N 1 2 307.393 4.138 20 0 DIADLO COc1cc(C)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)cn1 ZINC001232354058 1054027469 /nfs/dbraw/zinc/02/74/69/1054027469.db2.gz KJEAGYLLADMZBM-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C)c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)cn1 ZINC001232354058 1054027482 /nfs/dbraw/zinc/02/74/82/1054027482.db2.gz KJEAGYLLADMZBM-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@@](C)(F)C2)c(OC)cc1Cl ZINC001232370730 1054029392 /nfs/dbraw/zinc/02/93/92/1054029392.db2.gz ULPBNUFBXVZLRR-MRXNPFEDSA-N 1 2 315.816 4.071 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@@](C)(F)C2)c(OC)cc1Cl ZINC001232370730 1054029400 /nfs/dbraw/zinc/02/94/00/1054029400.db2.gz ULPBNUFBXVZLRR-MRXNPFEDSA-N 1 2 315.816 4.071 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1cc(C)ccc1OC(C)C)C2 ZINC001232398845 1054040946 /nfs/dbraw/zinc/04/09/46/1054040946.db2.gz MZHSQQGZWZJZCA-UHFFFAOYSA-N 1 2 311.425 4.307 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1cc(C)ccc1OC(C)C)C2 ZINC001232398845 1054040962 /nfs/dbraw/zinc/04/09/62/1054040962.db2.gz MZHSQQGZWZJZCA-UHFFFAOYSA-N 1 2 311.425 4.307 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(C(F)(F)F)o2)cn1 ZINC001232446248 1054045111 /nfs/dbraw/zinc/04/51/11/1054045111.db2.gz JQDHSRCVEBADLK-CQSZACIVSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccc(C(F)(F)F)o2)cn1 ZINC001232446248 1054045126 /nfs/dbraw/zinc/04/51/26/1054045126.db2.gz JQDHSRCVEBADLK-CQSZACIVSA-N 1 2 310.319 4.339 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+]1CCC(=O)[C@@H](C)C12CCCC2 ZINC001232500987 1054060566 /nfs/dbraw/zinc/06/05/66/1054060566.db2.gz UJSBICONGTYIBV-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+]1CCC(=O)[C@@H](C)C12CCCC2 ZINC001232500987 1054060578 /nfs/dbraw/zinc/06/05/78/1054060578.db2.gz UJSBICONGTYIBV-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO FCc1cccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)n1 ZINC001232537176 1054065337 /nfs/dbraw/zinc/06/53/37/1054065337.db2.gz BCMDAPQCQOPNEP-INIZCTEOSA-N 1 2 306.331 4.166 20 0 DIADLO FCc1cccc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)n1 ZINC001232537176 1054065352 /nfs/dbraw/zinc/06/53/52/1054065352.db2.gz BCMDAPQCQOPNEP-INIZCTEOSA-N 1 2 306.331 4.166 20 0 DIADLO Fc1ccc(F)c([C@@H]2CCC[N@@H+]2Cc2cc3ccoc3cn2)c1 ZINC001232553451 1054069090 /nfs/dbraw/zinc/06/90/90/1054069090.db2.gz UGHCDPIGAYJNRA-KRWDZBQOSA-N 1 2 314.335 4.443 20 0 DIADLO Fc1ccc(F)c([C@@H]2CCC[N@H+]2Cc2cc3ccoc3cn2)c1 ZINC001232553451 1054069097 /nfs/dbraw/zinc/06/90/97/1054069097.db2.gz UGHCDPIGAYJNRA-KRWDZBQOSA-N 1 2 314.335 4.443 20 0 DIADLO Cc1nnsc1C[NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl ZINC000293712213 1054069463 /nfs/dbraw/zinc/06/94/63/1054069463.db2.gz PATBJRMHUDGCQH-ZCFIWIBFSA-N 1 2 320.220 4.143 20 0 DIADLO Fc1cc(F)cc([C@H]2CCC[N@@H+]2Cc2cc3ccoc3cn2)c1 ZINC001232555264 1054070831 /nfs/dbraw/zinc/07/08/31/1054070831.db2.gz RSTBJRHEAJWLHE-QGZVFWFLSA-N 1 2 314.335 4.443 20 0 DIADLO Fc1cc(F)cc([C@H]2CCC[N@H+]2Cc2cc3ccoc3cn2)c1 ZINC001232555264 1054070842 /nfs/dbraw/zinc/07/08/42/1054070842.db2.gz RSTBJRHEAJWLHE-QGZVFWFLSA-N 1 2 314.335 4.443 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]C(c2ccccc2)c2ccccc2)c2nccn21 ZINC000293876304 1054072187 /nfs/dbraw/zinc/07/21/87/1054072187.db2.gz FHFQFUSSJZOTIA-CRAIPNDOSA-N 1 2 303.409 4.268 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+][C@H](COC)c1ccc(CC)o1 ZINC000165302707 1054074820 /nfs/dbraw/zinc/07/48/20/1054074820.db2.gz LNGSSVWQGSZZDT-RHSMWYFYSA-N 1 2 317.429 4.279 20 0 DIADLO CCC[N@@H+](Cc1cc(F)c(O)c(Br)c1)CC(C)C ZINC001232637627 1054091309 /nfs/dbraw/zinc/09/13/09/1054091309.db2.gz VHJNVCACIRLSMC-UHFFFAOYSA-N 1 2 318.230 4.162 20 0 DIADLO CCC[N@H+](Cc1cc(F)c(O)c(Br)c1)CC(C)C ZINC001232637627 1054091319 /nfs/dbraw/zinc/09/13/19/1054091319.db2.gz VHJNVCACIRLSMC-UHFFFAOYSA-N 1 2 318.230 4.162 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2c(Cl)ccnc2F)c1 ZINC001232620380 1054086705 /nfs/dbraw/zinc/08/67/05/1054086705.db2.gz QEKMDZZKZWEUDX-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2c(Cl)ccnc2F)c1 ZINC001232620380 1054086717 /nfs/dbraw/zinc/08/67/17/1054086717.db2.gz QEKMDZZKZWEUDX-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001331675841 1054086946 /nfs/dbraw/zinc/08/69/46/1054086946.db2.gz LEBWYUNFYFNWSV-OCCSQVGLSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001331675841 1054086956 /nfs/dbraw/zinc/08/69/56/1054086956.db2.gz LEBWYUNFYFNWSV-OCCSQVGLSA-N 1 2 323.362 4.240 20 0 DIADLO C[N@H+](Cc1cc(F)c(O)c(Br)c1)C1CCCCC1 ZINC001232630491 1054089647 /nfs/dbraw/zinc/08/96/47/1054089647.db2.gz SYCBNMZJHCCUGM-UHFFFAOYSA-N 1 2 316.214 4.058 20 0 DIADLO C[N@@H+](Cc1cc(F)c(O)c(Br)c1)C1CCCCC1 ZINC001232630491 1054089662 /nfs/dbraw/zinc/08/96/62/1054089662.db2.gz SYCBNMZJHCCUGM-UHFFFAOYSA-N 1 2 316.214 4.058 20 0 DIADLO C[C@H]1CCCCC[N@@H+]1Cc1cc(F)c(O)c(Br)c1 ZINC001232640886 1054092561 /nfs/dbraw/zinc/09/25/61/1054092561.db2.gz SWYUJLPLQGNKCO-JTQLQIEISA-N 1 2 316.214 4.058 20 0 DIADLO C[C@H]1CCCCC[N@H+]1Cc1cc(F)c(O)c(Br)c1 ZINC001232640886 1054092574 /nfs/dbraw/zinc/09/25/74/1054092574.db2.gz SWYUJLPLQGNKCO-JTQLQIEISA-N 1 2 316.214 4.058 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cnc(Cl)cc2Br)[C@@H](C)C1 ZINC001232682548 1054099645 /nfs/dbraw/zinc/09/96/45/1054099645.db2.gz DFEGQTWEEHHQOJ-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cnc(Cl)cc2Br)[C@@H](C)C1 ZINC001232682548 1054099660 /nfs/dbraw/zinc/09/96/60/1054099660.db2.gz DFEGQTWEEHHQOJ-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO CC[N@H+](Cc1c(F)ccc(Cl)c1Br)C1CC1 ZINC001232692558 1054101677 /nfs/dbraw/zinc/10/16/77/1054101677.db2.gz ZHSSGALSZHSTHL-UHFFFAOYSA-N 1 2 306.606 4.226 20 0 DIADLO CC[N@@H+](Cc1c(F)ccc(Cl)c1Br)C1CC1 ZINC001232692558 1054101684 /nfs/dbraw/zinc/10/16/84/1054101684.db2.gz ZHSSGALSZHSTHL-UHFFFAOYSA-N 1 2 306.606 4.226 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ncccc1C(F)(F)F ZINC001331933068 1054102470 /nfs/dbraw/zinc/10/24/70/1054102470.db2.gz LTLUZKFUIOGAJT-ZBFHGGJFSA-N 1 2 324.321 4.216 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2cccnc21)c1nc(C(C)(C)C)cs1 ZINC001331959778 1054103619 /nfs/dbraw/zinc/10/36/19/1054103619.db2.gz MCDVMYGUXYBKBB-AAEUAGOBSA-N 1 2 301.459 4.174 20 0 DIADLO CCOCC1CC[NH+](Cc2cc(F)c(Cl)cc2Cl)CC1 ZINC001232701382 1054104306 /nfs/dbraw/zinc/10/43/06/1054104306.db2.gz XEPNVROTKVCLAV-UHFFFAOYSA-N 1 2 320.235 4.381 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2cccnc21)c1nc(C(C)(C)C)cs1 ZINC001331959927 1054104639 /nfs/dbraw/zinc/10/46/39/1054104639.db2.gz MCDVMYGUXYBKBB-WCQYABFASA-N 1 2 301.459 4.174 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1ccc(C(F)(F)F)nc1Cl ZINC001232792423 1054122296 /nfs/dbraw/zinc/12/22/96/1054122296.db2.gz FUQIVESKXDYFKR-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1ccc(C(F)(F)F)nc1Cl ZINC001232792423 1054122307 /nfs/dbraw/zinc/12/23/07/1054122307.db2.gz FUQIVESKXDYFKR-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1)Cc1cccc(O)c1Cl ZINC001232789070 1054122697 /nfs/dbraw/zinc/12/26/97/1054122697.db2.gz VAULWOSIPABQQP-UHFFFAOYSA-N 1 2 305.805 4.076 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1)Cc1cccc(O)c1Cl ZINC001232789070 1054122702 /nfs/dbraw/zinc/12/27/02/1054122702.db2.gz VAULWOSIPABQQP-UHFFFAOYSA-N 1 2 305.805 4.076 20 0 DIADLO CCCn1cnc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1 ZINC001232799202 1054122863 /nfs/dbraw/zinc/12/28/63/1054122863.db2.gz ZMTFKCJTXAJQAS-KRWDZBQOSA-N 1 2 303.837 4.284 20 0 DIADLO CCCn1cnc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1 ZINC001232799202 1054122869 /nfs/dbraw/zinc/12/28/69/1054122869.db2.gz ZMTFKCJTXAJQAS-KRWDZBQOSA-N 1 2 303.837 4.284 20 0 DIADLO Cc1cc(N[C@@H](c2ccccc2)[C@@H]2CCCO2)nc(C(C)C)[nH+]1 ZINC000505778199 1054124769 /nfs/dbraw/zinc/12/47/69/1054124769.db2.gz RNGAWIKJQZYEHW-WMZOPIPTSA-N 1 2 311.429 4.241 20 0 DIADLO Cc1cc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)c(C)nn1 ZINC001332726901 1054125152 /nfs/dbraw/zinc/12/51/52/1054125152.db2.gz OCWYLJXEPKDMSC-UHFFFAOYSA-N 1 2 322.239 4.179 20 0 DIADLO COc1cc(C[N@H+](C)Cc2ccccc2Cl)c(OC)cc1C ZINC001232833273 1054128027 /nfs/dbraw/zinc/12/80/27/1054128027.db2.gz VKYQCMOGNCHDOC-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2ccccc2Cl)c(OC)cc1C ZINC001232833273 1054128029 /nfs/dbraw/zinc/12/80/29/1054128029.db2.gz VKYQCMOGNCHDOC-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO Oc1ccc2[nH]cc(C[N@@H+]3CCc4c5ccccc5oc4C3)c2c1 ZINC001232867541 1054135245 /nfs/dbraw/zinc/13/52/45/1054135245.db2.gz CYCHDIJDURERFE-UHFFFAOYSA-N 1 2 318.376 4.178 20 0 DIADLO Oc1ccc2[nH]cc(C[N@H+]3CCc4c5ccccc5oc4C3)c2c1 ZINC001232867541 1054135249 /nfs/dbraw/zinc/13/52/49/1054135249.db2.gz CYCHDIJDURERFE-UHFFFAOYSA-N 1 2 318.376 4.178 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ccc(F)c(F)c2Cl)c1 ZINC001232875058 1054136244 /nfs/dbraw/zinc/13/62/44/1054136244.db2.gz AIDFTQKZSNDCHB-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ccc(F)c(F)c2Cl)c1 ZINC001232875058 1054136255 /nfs/dbraw/zinc/13/62/55/1054136255.db2.gz AIDFTQKZSNDCHB-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cncc(-c3ccccc3)c1)C2 ZINC001232901695 1054146978 /nfs/dbraw/zinc/14/69/78/1054146978.db2.gz POXYMTGQLFAEFI-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cncc(-c3ccccc3)c1)C2 ZINC001232901695 1054146981 /nfs/dbraw/zinc/14/69/81/1054146981.db2.gz POXYMTGQLFAEFI-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO CC1(c2ccccc2)CC[NH+](Cc2ccc(F)c(O)c2F)CC1 ZINC001232941454 1054154196 /nfs/dbraw/zinc/15/41/96/1054154196.db2.gz YGLWAEUPYKJOPC-UHFFFAOYSA-N 1 2 317.379 4.224 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(F)(F)F)cs1)c1ccc(F)nc1 ZINC001333495800 1054156080 /nfs/dbraw/zinc/15/60/80/1054156080.db2.gz FHMWIUUMMKUPLD-SFYZADRCSA-N 1 2 319.327 4.108 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)nc1)c1nc(C(F)(F)F)cs1 ZINC001333495798 1054156590 /nfs/dbraw/zinc/15/65/90/1054156590.db2.gz FHMWIUUMMKUPLD-HTQZYQBOSA-N 1 2 319.327 4.108 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2c(Cl)cccc2N(C)C)n1 ZINC001333709948 1054168169 /nfs/dbraw/zinc/16/81/69/1054168169.db2.gz GQJRWWRURNFDKS-NSHDSACASA-N 1 2 309.866 4.022 20 0 DIADLO COc1cc(Cl)cc(F)c1C[N@@H+]1CCCC(F)(F)CC1 ZINC001233001263 1054168261 /nfs/dbraw/zinc/16/82/61/1054168261.db2.gz GJNNBAUAEFGDNY-UHFFFAOYSA-N 1 2 307.743 4.109 20 0 DIADLO COc1cc(Cl)cc(F)c1C[N@H+]1CCCC(F)(F)CC1 ZINC001233001263 1054168267 /nfs/dbraw/zinc/16/82/67/1054168267.db2.gz GJNNBAUAEFGDNY-UHFFFAOYSA-N 1 2 307.743 4.109 20 0 DIADLO COc1cc(Cl)cc(F)c1C[N@@H+]1CCC(F)(F)C(C)(C)C1 ZINC001233000795 1054168827 /nfs/dbraw/zinc/16/88/27/1054168827.db2.gz UPURVHGRZOVEMH-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO COc1cc(Cl)cc(F)c1C[N@H+]1CCC(F)(F)C(C)(C)C1 ZINC001233000795 1054168831 /nfs/dbraw/zinc/16/88/31/1054168831.db2.gz UPURVHGRZOVEMH-UHFFFAOYSA-N 1 2 321.770 4.355 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)cn1 ZINC001233007931 1054170988 /nfs/dbraw/zinc/17/09/88/1054170988.db2.gz WPOHMVDWMHXHFR-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)cn1 ZINC001233007931 1054170997 /nfs/dbraw/zinc/17/09/97/1054170997.db2.gz WPOHMVDWMHXHFR-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2cnc(C)cc2C)on1 ZINC001233013953 1054171441 /nfs/dbraw/zinc/17/14/41/1054171441.db2.gz ZAAJZUIVLZXWKT-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2cnc(C)cc2C)on1 ZINC001233013953 1054171444 /nfs/dbraw/zinc/17/14/44/1054171444.db2.gz ZAAJZUIVLZXWKT-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO CCOC(=O)c1ccsc1C[N@H+](C)C/C=C/c1ccccc1 ZINC001233021194 1054172835 /nfs/dbraw/zinc/17/28/35/1054172835.db2.gz BNGGSGMHOHSACA-JXMROGBWSA-N 1 2 315.438 4.070 20 0 DIADLO CCOC(=O)c1ccsc1C[N@@H+](C)C/C=C/c1ccccc1 ZINC001233021194 1054172841 /nfs/dbraw/zinc/17/28/41/1054172841.db2.gz BNGGSGMHOHSACA-JXMROGBWSA-N 1 2 315.438 4.070 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2ccc(Cl)c(Br)n2)[C@H]1C ZINC001233092530 1054185539 /nfs/dbraw/zinc/18/55/39/1054185539.db2.gz MXXYHPGVRJEDCS-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2ccc(Cl)c(Br)n2)[C@H]1C ZINC001233092530 1054185544 /nfs/dbraw/zinc/18/55/44/1054185544.db2.gz MXXYHPGVRJEDCS-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO Oc1cccc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1F ZINC001233055009 1054176502 /nfs/dbraw/zinc/17/65/02/1054176502.db2.gz JCWAIOQBCCQENJ-OAHLLOKOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cccc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1F ZINC001233055009 1054176509 /nfs/dbraw/zinc/17/65/09/1054176509.db2.gz JCWAIOQBCCQENJ-OAHLLOKOSA-N 1 2 307.315 4.147 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2nc3ccccn3n2)cc1C ZINC001233073026 1054180396 /nfs/dbraw/zinc/18/03/96/1054180396.db2.gz CUEWYYGCXCWDPJ-SFHVURJKSA-N 1 2 320.440 4.073 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2nc3ccccn3n2)cc1C ZINC001233073026 1054180403 /nfs/dbraw/zinc/18/04/03/1054180403.db2.gz CUEWYYGCXCWDPJ-SFHVURJKSA-N 1 2 320.440 4.073 20 0 DIADLO C[N@H+](Cc1ccsc1Cl)Cc1ccc(-n2ccnc2)cc1 ZINC001233058775 1054180988 /nfs/dbraw/zinc/18/09/88/1054180988.db2.gz AVNQGYCSJCNACE-UHFFFAOYSA-N 1 2 317.845 4.219 20 0 DIADLO C[N@@H+](Cc1ccsc1Cl)Cc1ccc(-n2ccnc2)cc1 ZINC001233058775 1054180993 /nfs/dbraw/zinc/18/09/93/1054180993.db2.gz AVNQGYCSJCNACE-UHFFFAOYSA-N 1 2 317.845 4.219 20 0 DIADLO CCc1ncc(C[NH2+][C@H](CC(F)(F)F)c2ccccc2C)o1 ZINC001334207196 1054183938 /nfs/dbraw/zinc/18/39/38/1054183938.db2.gz OKLRJBJFZKBMOD-CQSZACIVSA-N 1 2 312.335 4.329 20 0 DIADLO Fc1ccc2c(c1)[nH]nc2C[N@@H+]1CCC[C@H](c2ccccc2)CC1 ZINC001233127533 1054187838 /nfs/dbraw/zinc/18/78/38/1054187838.db2.gz YDNSUMHQFZSXCT-INIZCTEOSA-N 1 2 323.415 4.472 20 0 DIADLO Fc1ccc2c(c1)[nH]nc2C[N@H+]1CCC[C@H](c2ccccc2)CC1 ZINC001233127533 1054187843 /nfs/dbraw/zinc/18/78/43/1054187843.db2.gz YDNSUMHQFZSXCT-INIZCTEOSA-N 1 2 323.415 4.472 20 0 DIADLO CC(C)Oc1ncc(Cl)cc1C[N@H+](C)Cc1ccsc1 ZINC001233167219 1054194076 /nfs/dbraw/zinc/19/40/76/1054194076.db2.gz OHMZJZNNXBZFOE-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO CC(C)Oc1ncc(Cl)cc1C[N@@H+](C)Cc1ccsc1 ZINC001233167219 1054194082 /nfs/dbraw/zinc/19/40/82/1054194082.db2.gz OHMZJZNNXBZFOE-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO CC(C)Oc1ncc(Cl)cc1C[N@H+](C)Cc1cccc(F)c1 ZINC001233168749 1054196398 /nfs/dbraw/zinc/19/63/98/1054196398.db2.gz USCKEXXFHQVHLZ-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO CC(C)Oc1ncc(Cl)cc1C[N@@H+](C)Cc1cccc(F)c1 ZINC001233168749 1054196402 /nfs/dbraw/zinc/19/64/02/1054196402.db2.gz USCKEXXFHQVHLZ-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO Fc1c(Cl)ccc(C[NH+]2CCC(c3ccccn3)CC2)c1F ZINC001233210300 1054200593 /nfs/dbraw/zinc/20/05/93/1054200593.db2.gz FAORMVGEMCGGBX-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO C[C@@H]([NH2+]Cc1ccnc(Cl)c1)c1ncc(-c2ccccc2)o1 ZINC000184847498 1054207481 /nfs/dbraw/zinc/20/74/81/1054207481.db2.gz QWKJNPJXMSEJAW-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO C[C@H]([NH2+]Cc1ccnc(Cl)c1)c1ncc(-c2ccccc2)o1 ZINC000184847475 1054208194 /nfs/dbraw/zinc/20/81/94/1054208194.db2.gz QWKJNPJXMSEJAW-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)CC3CC(F)(F)C3)cc2)[nH+]c1C ZINC001335150515 1054208228 /nfs/dbraw/zinc/20/82/28/1054208228.db2.gz MBEHLNVEYPBLDP-UHFFFAOYSA-N 1 2 319.355 4.067 20 0 DIADLO COc1c2ccccc2oc1CNc1cc(C)[nH+]c(C(C)C)n1 ZINC000473716190 1054232328 /nfs/dbraw/zinc/23/23/28/1054232328.db2.gz UUBPGDSMYOZXSL-UHFFFAOYSA-N 1 2 311.385 4.275 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cc1F ZINC001233343391 1054239360 /nfs/dbraw/zinc/23/93/60/1054239360.db2.gz LIDUNFLSWKEFAG-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)cc1F ZINC001233343391 1054239375 /nfs/dbraw/zinc/23/93/75/1054239375.db2.gz LIDUNFLSWKEFAG-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1cc3cccnc3s1)C2 ZINC001233349320 1054246575 /nfs/dbraw/zinc/24/65/75/1054246575.db2.gz NHVNMMBVWNRSDI-UHFFFAOYSA-N 1 2 300.814 4.466 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1cc3cccnc3s1)C2 ZINC001233349320 1054246586 /nfs/dbraw/zinc/24/65/86/1054246586.db2.gz NHVNMMBVWNRSDI-UHFFFAOYSA-N 1 2 300.814 4.466 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+]1CCc2ncc(C)cc2C1 ZINC001233353315 1054247637 /nfs/dbraw/zinc/24/76/37/1054247637.db2.gz OOSLBCTZFMGPDT-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+]1CCc2ncc(C)cc2C1 ZINC001233353315 1054247645 /nfs/dbraw/zinc/24/76/45/1054247645.db2.gz OOSLBCTZFMGPDT-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO C[C@@]1(CO)CCC[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC001337033465 1054253570 /nfs/dbraw/zinc/25/35/70/1054253570.db2.gz UEHFBRYQYGEVKJ-CQSZACIVSA-N 1 2 322.663 4.241 20 0 DIADLO C[C@@]1(CO)CCC[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC001337033465 1054253585 /nfs/dbraw/zinc/25/35/85/1054253585.db2.gz UEHFBRYQYGEVKJ-CQSZACIVSA-N 1 2 322.663 4.241 20 0 DIADLO Nc1cc(F)c(F)cc1C[N@@H+]1CCCC[C@H]1c1ccccc1F ZINC001233380910 1054257600 /nfs/dbraw/zinc/25/76/00/1054257600.db2.gz IRSKULGFYMPUGQ-SFHVURJKSA-N 1 2 320.358 4.413 20 0 DIADLO Nc1cc(F)c(F)cc1C[N@H+]1CCCC[C@H]1c1ccccc1F ZINC001233380910 1054257610 /nfs/dbraw/zinc/25/76/10/1054257610.db2.gz IRSKULGFYMPUGQ-SFHVURJKSA-N 1 2 320.358 4.413 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1c(F)ccc(O)c1F ZINC001233396478 1054258776 /nfs/dbraw/zinc/25/87/76/1054258776.db2.gz FIOCQZHRIKSAKK-MRXNPFEDSA-N 1 2 303.352 4.180 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1c(Cl)ncnc1Cl ZINC001233408090 1054263868 /nfs/dbraw/zinc/26/38/68/1054263868.db2.gz BANKBYFIRSWEJQ-CQSZACIVSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1c(Cl)ncnc1Cl ZINC001233408090 1054263878 /nfs/dbraw/zinc/26/38/78/1054263878.db2.gz BANKBYFIRSWEJQ-CQSZACIVSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(c3ccccc3)[C@@H](C)C(C)C)ccn12 ZINC001439319293 1054264474 /nfs/dbraw/zinc/26/44/74/1054264474.db2.gz WGHKHTUSCJTIBX-INIZCTEOSA-N 1 2 321.424 4.334 20 0 DIADLO Clc1cccn2cc(C[N@@H+]3CCC[C@@H]3c3cccs3)nc12 ZINC001233422531 1054268055 /nfs/dbraw/zinc/26/80/55/1054268055.db2.gz LFUPBCWKAVZNIL-CQSZACIVSA-N 1 2 317.845 4.386 20 0 DIADLO Clc1cccn2cc(C[N@H+]3CCC[C@@H]3c3cccs3)nc12 ZINC001233422531 1054268065 /nfs/dbraw/zinc/26/80/65/1054268065.db2.gz LFUPBCWKAVZNIL-CQSZACIVSA-N 1 2 317.845 4.386 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cc(Br)ncc1Cl ZINC001233425148 1054271536 /nfs/dbraw/zinc/27/15/36/1054271536.db2.gz ORFQRTBJKGPQEJ-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO CC(=O)c1cc(Cl)c2ccccc2c1OC1C[NH+](C(C)C)C1 ZINC001233539742 1054291407 /nfs/dbraw/zinc/29/14/07/1054291407.db2.gz MLWAPCCLJRPREN-UHFFFAOYSA-N 1 2 317.816 4.167 20 0 DIADLO C[C@H]([C@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)C(C)(C)C ZINC001356297764 1054316581 /nfs/dbraw/zinc/31/65/81/1054316581.db2.gz YRWFIHLOCICQIW-QWHCGFSZSA-N 1 2 317.408 4.268 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)C1CCCC1 ZINC001356316358 1054318370 /nfs/dbraw/zinc/31/83/70/1054318370.db2.gz JCCGWYSHGAXHCI-GFCCVEGCSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1cc(C)c(CNC(=O)[C@@H](C)c2ccc(CC(C)C)cc2)c[nH+]1 ZINC000622667427 1054324064 /nfs/dbraw/zinc/32/40/64/1054324064.db2.gz FVSSMIMEHCZFBP-KRWDZBQOSA-N 1 2 324.468 4.317 20 0 DIADLO CC[C@@H](C(=O)NCc1c[nH+]c(C)cc1C)C1CCC(C)CC1 ZINC000622667792 1054332332 /nfs/dbraw/zinc/33/23/32/1054332332.db2.gz TXAROEDOBUUBCV-PVCYVWKFSA-N 1 2 302.462 4.167 20 0 DIADLO CCCCCCC(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001339301174 1054334897 /nfs/dbraw/zinc/33/48/97/1054334897.db2.gz SPORXCIYUYZLKA-INIZCTEOSA-N 1 2 319.493 4.315 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccnn1-c1ccccc1 ZINC001339826333 1054348296 /nfs/dbraw/zinc/34/82/96/1054348296.db2.gz KSWCTEKXGBAMOG-OAHLLOKOSA-N 1 2 306.413 4.111 20 0 DIADLO C[C@H]([NH2+]Cc1c[nH]cn1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000171129720 1054348608 /nfs/dbraw/zinc/34/86/08/1054348608.db2.gz KFPHAJFPAOJIEA-ZDUSSCGKSA-N 1 2 311.360 4.192 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)/C(F)=C\C1CCCCC1 ZINC001441151964 1054385323 /nfs/dbraw/zinc/38/53/23/1054385323.db2.gz YCZZRQSSJZTUBN-NTCAYCPXSA-N 1 2 313.376 4.245 20 0 DIADLO O=C(c1ccc(-n2cc[nH+]c2)cc1)N1CCCC2(CCCCC2)C1 ZINC000171889885 1054396453 /nfs/dbraw/zinc/39/64/53/1054396453.db2.gz IBKOMGZPEFVDOZ-UHFFFAOYSA-N 1 2 323.440 4.059 20 0 DIADLO C[C@@H]1CCN(C(=O)c2cccc(-n3cc[nH+]c3)c2)c2ccccc21 ZINC000172052774 1054405819 /nfs/dbraw/zinc/40/58/19/1054405819.db2.gz QRDJHKQLDLKMEC-OAHLLOKOSA-N 1 2 317.392 4.026 20 0 DIADLO Cc1cc(NC[C@H](c2ccccc2)C(F)(F)F)nc(C2CC2)[nH+]1 ZINC000486026215 1054409196 /nfs/dbraw/zinc/40/91/96/1054409196.db2.gz FQGWBBZEYCWBSY-CQSZACIVSA-N 1 2 321.346 4.420 20 0 DIADLO Cc1cc(NC[C@@H]2SCCc3ccccc32)nc(C2CC2)[nH+]1 ZINC000487664529 1054412550 /nfs/dbraw/zinc/41/25/50/1054412550.db2.gz GGRSYIBULQGFRK-INIZCTEOSA-N 1 2 311.454 4.105 20 0 DIADLO Cc1ccc(N2CC[N@H+](CC=C(Cl)Cl)[C@H](C)C2)cc1C ZINC001473204000 1054419875 /nfs/dbraw/zinc/41/98/75/1054419875.db2.gz KKXYPUMPNVBWCE-CQSZACIVSA-N 1 2 313.272 4.133 20 0 DIADLO Cc1ccc(N2CC[N@@H+](CC=C(Cl)Cl)[C@H](C)C2)cc1C ZINC001473204000 1054419882 /nfs/dbraw/zinc/41/98/82/1054419882.db2.gz KKXYPUMPNVBWCE-CQSZACIVSA-N 1 2 313.272 4.133 20 0 DIADLO Cc1cc(CNc2[nH+]c3ccccc3n2C2CCCCC2)[nH]n1 ZINC001343322394 1054440639 /nfs/dbraw/zinc/44/06/39/1054440639.db2.gz MHTYCDOJDBXHOE-UHFFFAOYSA-N 1 2 309.417 4.185 20 0 DIADLO Cc1cc(CNc2[nH+]c3ccccc3n2C2CCCCC2)n[nH]1 ZINC001343322394 1054440647 /nfs/dbraw/zinc/44/06/47/1054440647.db2.gz MHTYCDOJDBXHOE-UHFFFAOYSA-N 1 2 309.417 4.185 20 0 DIADLO CC[N@H+](Cc1ccc(C)cc1)Cc1c(Cl)nccc1N(C)C ZINC001234151892 1054440841 /nfs/dbraw/zinc/44/08/41/1054440841.db2.gz XVDTVDFAILLIRR-UHFFFAOYSA-N 1 2 317.864 4.132 20 0 DIADLO CC[N@@H+](Cc1ccc(C)cc1)Cc1c(Cl)nccc1N(C)C ZINC001234151892 1054440852 /nfs/dbraw/zinc/44/08/52/1054440852.db2.gz XVDTVDFAILLIRR-UHFFFAOYSA-N 1 2 317.864 4.132 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+]2C[C@H]3CCCC[C@]32c2ccccc2)[nH]1 ZINC001343871124 1054455107 /nfs/dbraw/zinc/45/51/07/1054455107.db2.gz IJMZOSIKZBOFGA-UZLBHIALSA-N 1 2 324.472 4.004 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+]2C[C@H]3CCCC[C@]32c2ccccc2)[nH]1 ZINC001343871124 1054455110 /nfs/dbraw/zinc/45/51/10/1054455110.db2.gz IJMZOSIKZBOFGA-UZLBHIALSA-N 1 2 324.472 4.004 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+](C)C(C)(C)c2ccccc2)cs1 ZINC000671245879 1054459530 /nfs/dbraw/zinc/45/95/30/1054459530.db2.gz KJLRLNLZJKKCAB-CYBMUJFWSA-N 1 2 304.459 4.218 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+](C)C(C)(C)c2ccccc2)cs1 ZINC000671245879 1054459534 /nfs/dbraw/zinc/45/95/34/1054459534.db2.gz KJLRLNLZJKKCAB-CYBMUJFWSA-N 1 2 304.459 4.218 20 0 DIADLO C[C@H](C(=O)Nc1ccc(SC(C)(C)C)c(F)c1)n1cc[nH+]c1 ZINC001344389352 1054467326 /nfs/dbraw/zinc/46/73/26/1054467326.db2.gz BBOUSJZWJWVNBH-LLVKDONJSA-N 1 2 321.421 4.113 20 0 DIADLO CC(C)CCC[C@H](C)N(CCC(C)C)C(=O)Cc1c[nH+]c[nH]1 ZINC001444960866 1054493329 /nfs/dbraw/zinc/49/33/29/1054493329.db2.gz VBVFAEBDITVVPH-INIZCTEOSA-N 1 2 307.482 4.042 20 0 DIADLO Cc1cccc(C)c1NC(=O)[C@H]1CC[C@@H](Nc2cccc[nH+]2)CC1 ZINC001444985087 1054493608 /nfs/dbraw/zinc/49/36/08/1054493608.db2.gz KGTQEAJCBCWLOQ-CALCHBBNSA-N 1 2 323.440 4.308 20 0 DIADLO CCc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1CC ZINC001357549913 1054498284 /nfs/dbraw/zinc/49/82/84/1054498284.db2.gz YERYIQDUEDUOMF-UHFFFAOYSA-N 1 2 319.408 4.249 20 0 DIADLO C[C@H]([NH2+]Cc1ccc2ccccc2c1)c1nc(C(C)(C)C)no1 ZINC000174662947 1054513192 /nfs/dbraw/zinc/51/31/92/1054513192.db2.gz ISXHYUIGJHTYDK-ZDUSSCGKSA-N 1 2 309.413 4.371 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nc(C(C)(C)C)no2)[C@@H]1c1cccc(F)c1 ZINC000175153166 1054522236 /nfs/dbraw/zinc/52/22/36/1054522236.db2.gz OGDVOHSNIFZWCN-LRDDRELGSA-N 1 2 317.408 4.089 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nc(C(C)(C)C)no2)[C@@H]1c1cccc(F)c1 ZINC000175153166 1054522244 /nfs/dbraw/zinc/52/22/44/1054522244.db2.gz OGDVOHSNIFZWCN-LRDDRELGSA-N 1 2 317.408 4.089 20 0 DIADLO Fc1ccc(-c2csc(SCCCn3cc[nH+]c3)n2)cc1 ZINC000185370078 1054531872 /nfs/dbraw/zinc/53/18/72/1054531872.db2.gz XNPHEOVUYUCLKC-UHFFFAOYSA-N 1 2 319.430 4.328 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@@H](C)COc2ccc(C)cc2)cc1 ZINC001234588686 1054550254 /nfs/dbraw/zinc/55/02/54/1054550254.db2.gz PVITWHGACSGHAY-HNNXBMFYSA-N 1 2 313.397 4.203 20 0 DIADLO O=C(CCCn1cc[nH+]c1)N(c1ccccc1)C1CCCCC1 ZINC000623275040 1054553423 /nfs/dbraw/zinc/55/34/23/1054553423.db2.gz LVGQWMPOQFVCSV-UHFFFAOYSA-N 1 2 311.429 4.029 20 0 DIADLO CCCN(C(=O)CCCn1cc[nH+]c1)c1cccc2ccccc21 ZINC000623292777 1054554937 /nfs/dbraw/zinc/55/49/37/1054554937.db2.gz YKPYIDPYEMIYRE-UHFFFAOYSA-N 1 2 321.424 4.260 20 0 DIADLO CCN(Cc1[nH]c(C)[nH+]c1C)Cc1cccc(C(F)(F)F)c1 ZINC001234656193 1054570145 /nfs/dbraw/zinc/57/01/45/1054570145.db2.gz WSSZROLBTNYGRK-UHFFFAOYSA-N 1 2 311.351 4.067 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H](C)c1ccc(-n2ccnc2)cc1 ZINC000325064343 1054573393 /nfs/dbraw/zinc/57/33/93/1054573393.db2.gz UZOMBPYHPAFENL-INIZCTEOSA-N 1 2 320.440 4.420 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1cccn1C1CC1)c1ccco1 ZINC001347782604 1054582936 /nfs/dbraw/zinc/58/29/36/1054582936.db2.gz RBZMYNLNYFJSIE-HXUWFJFHSA-N 1 2 322.408 4.304 20 0 DIADLO c1cc2cccc(C[N@@H+]3CCCC[C@H]3c3noc(C4CC4)n3)c2o1 ZINC001347782465 1054583030 /nfs/dbraw/zinc/58/30/30/1054583030.db2.gz OQACFDHYNXBLSI-INIZCTEOSA-N 1 2 323.396 4.420 20 0 DIADLO c1cc2cccc(C[N@H+]3CCCC[C@H]3c3noc(C4CC4)n3)c2o1 ZINC001347782465 1054583044 /nfs/dbraw/zinc/58/30/44/1054583044.db2.gz OQACFDHYNXBLSI-INIZCTEOSA-N 1 2 323.396 4.420 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2csc(C(F)(F)F)c2)cs1 ZINC000623409488 1054587425 /nfs/dbraw/zinc/58/74/25/1054587425.db2.gz DSGPIUHZKOESDX-SSDOTTSWSA-N 1 2 306.378 4.383 20 0 DIADLO CCc1nc(C[NH2+]Cc2csc(C(F)(F)F)c2)cs1 ZINC000623409731 1054588244 /nfs/dbraw/zinc/58/82/44/1054588244.db2.gz MUJIZIAOFOPKHV-UHFFFAOYSA-N 1 2 306.378 4.076 20 0 DIADLO Cc1cc(C)c(C(=O)N(C)[C@H]2CCCc3ccccc32)c(C)[nH+]1 ZINC001347832001 1054588496 /nfs/dbraw/zinc/58/84/96/1054588496.db2.gz TXWVZLOCIWAYTO-SFHVURJKSA-N 1 2 308.425 4.156 20 0 DIADLO O=C(C[C@H]1CC=CCC1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001358055501 1054588826 /nfs/dbraw/zinc/58/88/26/1054588826.db2.gz BBWQZVZHZRVGLI-ZDUSSCGKSA-N 1 2 315.804 4.211 20 0 DIADLO C[C@H]1CC(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)C[C@H](C)C1 ZINC001358067626 1054593614 /nfs/dbraw/zinc/59/36/14/1054593614.db2.gz VYVAFFHYQIRKIW-CHWSQXEVSA-N 1 2 315.392 4.022 20 0 DIADLO CC(C)c1nc(C[N@H+](CCC(F)(F)F)CC2CC2)cs1 ZINC000177166777 1054617214 /nfs/dbraw/zinc/61/72/14/1054617214.db2.gz PDZAODHMKJMBAV-UHFFFAOYSA-N 1 2 306.397 4.431 20 0 DIADLO CC(C)c1nc(C[N@@H+](CCC(F)(F)F)CC2CC2)cs1 ZINC000177166777 1054617227 /nfs/dbraw/zinc/61/72/27/1054617227.db2.gz PDZAODHMKJMBAV-UHFFFAOYSA-N 1 2 306.397 4.431 20 0 DIADLO Cc1cc(NC(=O)c2ccc(Oc3ccccc3)cc2C)cc[nH+]1 ZINC001358136230 1054606481 /nfs/dbraw/zinc/60/64/81/1054606481.db2.gz GEQLQIUDUORYIR-UHFFFAOYSA-N 1 2 318.376 4.165 20 0 DIADLO CC(C)c1ccc2cc(C(=O)Nc3ccn4cc[nH+]c4c3)[nH]c2c1 ZINC001448961054 1054610983 /nfs/dbraw/zinc/61/09/83/1054610983.db2.gz MXOHAINATXJJRM-UHFFFAOYSA-N 1 2 318.380 4.191 20 0 DIADLO C[C@@H](C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1)C(C)(C)C ZINC001348116605 1054613246 /nfs/dbraw/zinc/61/32/46/1054613246.db2.gz VRBFMHZVLZOVTA-LSDHHAIUSA-N 1 2 319.493 4.026 20 0 DIADLO CC(C)C[C@@H](C(=O)N(CC(C)C)c1ccccc1)n1cc[nH+]c1 ZINC001449219587 1054617037 /nfs/dbraw/zinc/61/70/37/1054617037.db2.gz KNCWBMVMMXPDHI-SFHVURJKSA-N 1 2 313.445 4.160 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)OCO2)c1ncc(C(C)(C)C)o1 ZINC000177418092 1054620028 /nfs/dbraw/zinc/62/00/28/1054620028.db2.gz JKNOBKPMYBXGFX-VXGBXAGGSA-N 1 2 316.401 4.113 20 0 DIADLO CCc1ccc(C[NH2+]Cc2ccc(F)cc2Br)o1 ZINC000177746574 1054633243 /nfs/dbraw/zinc/63/32/43/1054633243.db2.gz PKWODPCJAULJBU-UHFFFAOYSA-N 1 2 312.182 4.033 20 0 DIADLO C[C@H]1C[N@H+](Cc2cncc(Br)c2)[C@@H]1c1ccccc1 ZINC000177828165 1054636880 /nfs/dbraw/zinc/63/68/80/1054636880.db2.gz JEOARSYFUGSIOY-LRDDRELGSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cncc(Br)c2)[C@@H]1c1ccccc1 ZINC000177828165 1054636885 /nfs/dbraw/zinc/63/68/85/1054636885.db2.gz JEOARSYFUGSIOY-LRDDRELGSA-N 1 2 317.230 4.037 20 0 DIADLO O=C(CC1CCC(F)(F)CC1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000623735238 1054684957 /nfs/dbraw/zinc/68/49/57/1054684957.db2.gz OTLXGYSVFSELPG-UHFFFAOYSA-N 1 2 319.355 4.026 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2ccccc2o1)c1ccc(F)cc1F ZINC000179631455 1054691814 /nfs/dbraw/zinc/69/18/14/1054691814.db2.gz FWRVLAQEMCSOCA-CQSZACIVSA-N 1 2 302.324 4.347 20 0 DIADLO CC[C@@H]([NH2+]Cc1noc2c1CCCC2)c1ccc(F)cc1F ZINC000179629225 1054692107 /nfs/dbraw/zinc/69/21/07/1054692107.db2.gz FPMJGKWBTFTRLV-OAHLLOKOSA-N 1 2 306.356 4.073 20 0 DIADLO CCc1cccc(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)n1 ZINC001235264496 1054694308 /nfs/dbraw/zinc/69/43/08/1054694308.db2.gz LRTFHNZDBBCDQV-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO CCc1cccc(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)n1 ZINC001235264496 1054694314 /nfs/dbraw/zinc/69/43/14/1054694314.db2.gz LRTFHNZDBBCDQV-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO Cc1ccccc1-c1nc(C[NH2+][C@H](c2ccccc2)C2CC2)no1 ZINC000179690605 1054697165 /nfs/dbraw/zinc/69/71/65/1054697165.db2.gz KYDDRRAPYCFYRN-LJQANCHMSA-N 1 2 319.408 4.286 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)c(F)cn1 ZINC001235323544 1054701360 /nfs/dbraw/zinc/70/13/60/1054701360.db2.gz ORJPJOBQZWMNJO-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)c(F)cn1 ZINC001235323544 1054701370 /nfs/dbraw/zinc/70/13/70/1054701370.db2.gz ORJPJOBQZWMNJO-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1nc(N[C@H](C)CCCC(F)(F)F)c2c([nH+]1)CCCC2 ZINC000493573975 1054701684 /nfs/dbraw/zinc/70/16/84/1054701684.db2.gz RHHFZBLTIBATIG-SNVBAGLBSA-N 1 2 301.356 4.197 20 0 DIADLO CCC(CC)[C@H]([NH2+]Cc1noc(C(C)C)n1)c1ccccc1 ZINC000179789274 1054703102 /nfs/dbraw/zinc/70/31/02/1054703102.db2.gz BVGCFCNSOJWKDG-KRWDZBQOSA-N 1 2 301.434 4.460 20 0 DIADLO Fc1cc(C[NH+]2CCC3(CC[C@H](F)C3)CC2)c(F)c(F)c1F ZINC001235352145 1054706088 /nfs/dbraw/zinc/70/60/88/1054706088.db2.gz UENKSZOUEWUZJC-NSHDSACASA-N 1 2 319.317 4.347 20 0 DIADLO Fc1cc(C[NH+]2CCC(c3ccncc3)CC2)c(F)c(F)c1F ZINC001235350297 1054706710 /nfs/dbraw/zinc/70/67/10/1054706710.db2.gz TYPWKHOPZGIGBQ-UHFFFAOYSA-N 1 2 324.321 4.018 20 0 DIADLO C[N@H+](C/C=C/c1ccccc1)Cc1cc(F)c(F)c(F)c1F ZINC001235351320 1054707850 /nfs/dbraw/zinc/70/78/50/1054707850.db2.gz NPPDNZVAZOLTHI-VMPITWQZSA-N 1 2 309.306 4.388 20 0 DIADLO C[N@@H+](C/C=C/c1ccccc1)Cc1cc(F)c(F)c(F)c1F ZINC001235351320 1054707860 /nfs/dbraw/zinc/70/78/60/1054707860.db2.gz NPPDNZVAZOLTHI-VMPITWQZSA-N 1 2 309.306 4.388 20 0 DIADLO Cc1cc(NCCc2ccc(OC(C)C)cc2)nc(C2CC2)[nH+]1 ZINC000604757281 1054707828 /nfs/dbraw/zinc/70/78/28/1054707828.db2.gz WAHSYTWGCVQWAZ-UHFFFAOYSA-N 1 2 311.429 4.104 20 0 DIADLO Fc1cc(C[N@H+](Cc2ccccc2)C2CC2)c(F)c(F)c1F ZINC001235349264 1054708080 /nfs/dbraw/zinc/70/80/80/1054708080.db2.gz NEXZTPUHYZBLQH-UHFFFAOYSA-N 1 2 309.306 4.408 20 0 DIADLO Fc1cc(C[N@@H+](Cc2ccccc2)C2CC2)c(F)c(F)c1F ZINC001235349264 1054708091 /nfs/dbraw/zinc/70/80/91/1054708091.db2.gz NEXZTPUHYZBLQH-UHFFFAOYSA-N 1 2 309.306 4.408 20 0 DIADLO C[C@@H]1[C@H](C)SCC[N@@H+]1Cc1csc(Nc2ccccc2)n1 ZINC000605335699 1054710336 /nfs/dbraw/zinc/71/03/36/1054710336.db2.gz PUVOWCDJEXBKRD-OLZOCXBDSA-N 1 2 319.499 4.213 20 0 DIADLO C[C@@H]1[C@H](C)SCC[N@H+]1Cc1csc(Nc2ccccc2)n1 ZINC000605335699 1054710354 /nfs/dbraw/zinc/71/03/54/1054710354.db2.gz PUVOWCDJEXBKRD-OLZOCXBDSA-N 1 2 319.499 4.213 20 0 DIADLO Clc1ccc2c(c1)[C@@H]([NH2+]Cc1n[nH]c3ccccc31)CCC2 ZINC000623751110 1054723073 /nfs/dbraw/zinc/72/30/73/1054723073.db2.gz JAIGDTULTDNSAB-INIZCTEOSA-N 1 2 311.816 4.384 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cncc(F)c1Cl ZINC001235495003 1054735047 /nfs/dbraw/zinc/73/50/47/1054735047.db2.gz KWWKBGADHDTIJN-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1cncc(F)c1Cl ZINC001235495003 1054735066 /nfs/dbraw/zinc/73/50/66/1054735066.db2.gz KWWKBGADHDTIJN-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CC[C@]1(C)O ZINC001235592618 1054751323 /nfs/dbraw/zinc/75/13/23/1054751323.db2.gz SHPJMEUWIXAGLY-XPTSAGLGSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CC[C@]1(C)O ZINC001235592618 1054751341 /nfs/dbraw/zinc/75/13/41/1054751341.db2.gz SHPJMEUWIXAGLY-XPTSAGLGSA-N 1 2 322.663 4.240 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000180205373 1054742695 /nfs/dbraw/zinc/74/26/95/1054742695.db2.gz GATDCMHPKQJVJM-LJQANCHMSA-N 1 2 320.440 4.142 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000180205373 1054742709 /nfs/dbraw/zinc/74/27/09/1054742709.db2.gz GATDCMHPKQJVJM-LJQANCHMSA-N 1 2 320.440 4.142 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3ncc(Cl)cc3Cl)CC2)c1 ZINC000180257284 1054746743 /nfs/dbraw/zinc/74/67/43/1054746743.db2.gz RJAYSUDAYDLSPO-UHFFFAOYSA-N 1 2 311.187 4.306 20 0 DIADLO C[C@H]1CC[C@H](CO)C[N@@H+]1Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235587295 1054747305 /nfs/dbraw/zinc/74/73/05/1054747305.db2.gz AQKJUPYUGGAXCV-UWVGGRQHSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1CC[C@H](CO)C[N@H+]1Cc1cc(Cl)c(Cl)c(Cl)c1 ZINC001235587295 1054747315 /nfs/dbraw/zinc/74/73/15/1054747315.db2.gz AQKJUPYUGGAXCV-UWVGGRQHSA-N 1 2 322.663 4.240 20 0 DIADLO CC[C@@]1(C)C[N@@H+]([C@@H](C)c2ccc(Br)cc2)CCO1 ZINC001307688071 1054758631 /nfs/dbraw/zinc/75/86/31/1054758631.db2.gz KGFISPDOZZHQIT-WFASDCNBSA-N 1 2 312.251 4.011 20 0 DIADLO CC[C@@]1(C)C[N@H+]([C@@H](C)c2ccc(Br)cc2)CCO1 ZINC001307688071 1054758642 /nfs/dbraw/zinc/75/86/42/1054758642.db2.gz KGFISPDOZZHQIT-WFASDCNBSA-N 1 2 312.251 4.011 20 0 DIADLO CC(C)C[C@@H](C(=O)N(c1ccccc1)C1CCC1)n1cc[nH+]c1 ZINC001454266548 1054762297 /nfs/dbraw/zinc/76/22/97/1054762297.db2.gz KOFPEIWGRDPVKP-SFHVURJKSA-N 1 2 311.429 4.056 20 0 DIADLO Nc1ccnc(Cl)c1C[N@@H+]1CCCC[C@@H]1c1ccccc1F ZINC001235676581 1054770935 /nfs/dbraw/zinc/77/09/35/1054770935.db2.gz BKOOCDYRZMFSOZ-MRXNPFEDSA-N 1 2 319.811 4.184 20 0 DIADLO Nc1ccnc(Cl)c1C[N@H+]1CCCC[C@@H]1c1ccccc1F ZINC001235676581 1054770947 /nfs/dbraw/zinc/77/09/47/1054770947.db2.gz BKOOCDYRZMFSOZ-MRXNPFEDSA-N 1 2 319.811 4.184 20 0 DIADLO Nc1ccc(Cl)nc1C[N@@H+]1CCCC[C@H]1c1ccccc1F ZINC001235681234 1054774615 /nfs/dbraw/zinc/77/46/15/1054774615.db2.gz WTAQIEJUAWQPLM-INIZCTEOSA-N 1 2 319.811 4.184 20 0 DIADLO Nc1ccc(Cl)nc1C[N@H+]1CCCC[C@H]1c1ccccc1F ZINC001235681234 1054774632 /nfs/dbraw/zinc/77/46/32/1054774632.db2.gz WTAQIEJUAWQPLM-INIZCTEOSA-N 1 2 319.811 4.184 20 0 DIADLO COc1ccc([C@@H](Nc2cc(C)[nH+]c(C3CC3)n2)C(C)C)cc1 ZINC000522567327 1054776565 /nfs/dbraw/zinc/77/65/65/1054776565.db2.gz CYIZAQWGFCRRGE-SFHVURJKSA-N 1 2 311.429 4.480 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1nc2ccc(F)cc2[nH]1 ZINC001235686795 1054778964 /nfs/dbraw/zinc/77/89/64/1054778964.db2.gz BWQZXTGNPKUJSZ-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1nc2ccc(F)cc2[nH]1 ZINC001235686795 1054778979 /nfs/dbraw/zinc/77/89/79/1054778979.db2.gz BWQZXTGNPKUJSZ-GOSISDBHSA-N 1 2 309.388 4.348 20 0 DIADLO CC(C)(C)[N@@H+]1CC[C@H]1C(=O)Nc1nc(C2CCCCC2)cs1 ZINC001454719965 1054781328 /nfs/dbraw/zinc/78/13/28/1054781328.db2.gz DZIMINFNNMSULM-AWEZNQCLSA-N 1 2 321.490 4.002 20 0 DIADLO CC(C)(C)[N@H+]1CC[C@H]1C(=O)Nc1nc(C2CCCCC2)cs1 ZINC001454719965 1054781341 /nfs/dbraw/zinc/78/13/41/1054781341.db2.gz DZIMINFNNMSULM-AWEZNQCLSA-N 1 2 321.490 4.002 20 0 DIADLO Fc1ccc2[nH]c(C[N@@H+]3CCC[C@@H]3c3cccc(F)c3)nc2c1 ZINC001235697788 1054781324 /nfs/dbraw/zinc/78/13/24/1054781324.db2.gz UAPJQLYIEYGLEI-QGZVFWFLSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc2[nH]c(C[N@H+]3CCC[C@@H]3c3cccc(F)c3)nc2c1 ZINC001235697788 1054781338 /nfs/dbraw/zinc/78/13/38/1054781338.db2.gz UAPJQLYIEYGLEI-QGZVFWFLSA-N 1 2 313.351 4.178 20 0 DIADLO C[N@@H+]1CCCC[C@H]1C(=O)Nc1nc(C2CCCCCC2)cs1 ZINC001454704533 1054781434 /nfs/dbraw/zinc/78/14/34/1054781434.db2.gz IYLXXTBECAAXBB-HNNXBMFYSA-N 1 2 321.490 4.004 20 0 DIADLO C[N@H+]1CCCC[C@H]1C(=O)Nc1nc(C2CCCCCC2)cs1 ZINC001454704533 1054781447 /nfs/dbraw/zinc/78/14/47/1054781447.db2.gz IYLXXTBECAAXBB-HNNXBMFYSA-N 1 2 321.490 4.004 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@@H](c4ccccc4)CC3)[nH]c2c1 ZINC001235695835 1054782538 /nfs/dbraw/zinc/78/25/38/1054782538.db2.gz SMJLHQNJVJZQQW-MRXNPFEDSA-N 1 2 323.415 4.472 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@@H](c4ccccc4)CC3)[nH]c2c1 ZINC001235695835 1054782548 /nfs/dbraw/zinc/78/25/48/1054782548.db2.gz SMJLHQNJVJZQQW-MRXNPFEDSA-N 1 2 323.415 4.472 20 0 DIADLO CCn1cnc(Cl)c1C[NH2+][C@H](C)c1cc(Cl)ccc1F ZINC001474094249 1054783563 /nfs/dbraw/zinc/78/35/63/1054783563.db2.gz XFERIJLKFMDKAO-SECBINFHSA-N 1 2 316.207 4.200 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CC[C@H](C4CCCCC4)C3)[nH]c2c1 ZINC001235696043 1054783771 /nfs/dbraw/zinc/78/37/71/1054783771.db2.gz YWXXUCDPHZJLIH-AWEZNQCLSA-N 1 2 301.409 4.104 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CC[C@H](C4CCCCC4)C3)[nH]c2c1 ZINC001235696043 1054783786 /nfs/dbraw/zinc/78/37/86/1054783786.db2.gz YWXXUCDPHZJLIH-AWEZNQCLSA-N 1 2 301.409 4.104 20 0 DIADLO COc1cccc(C[NH2+]C2(c3c(F)cccc3F)CCC2)c1F ZINC000623844268 1054788704 /nfs/dbraw/zinc/78/87/04/1054788704.db2.gz OBFRABGGEQSNTO-UHFFFAOYSA-N 1 2 321.342 4.282 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+][C@@H]1CCCc2scnc21 ZINC000623866869 1054794910 /nfs/dbraw/zinc/79/49/10/1054794910.db2.gz IPWLFDAGSZVAOB-GXFFZTMASA-N 1 2 306.406 4.019 20 0 DIADLO COC1(C)CC[NH+](Cc2c(F)cc(Cl)cc2Cl)CC1 ZINC001235742732 1054795594 /nfs/dbraw/zinc/79/55/94/1054795594.db2.gz XRDJZZDCLZNMAH-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO C[C@H]([NH2+]Cc1cscn1)c1ccc(F)cc1C(F)(F)F ZINC000623881411 1054801982 /nfs/dbraw/zinc/80/19/82/1054801982.db2.gz NFNTXOLIAWYYLO-QMMMGPOBSA-N 1 2 304.312 4.152 20 0 DIADLO C[N@H+](Cc1cccc(F)c1N)Cc1cccc(Cl)c1Cl ZINC001235790716 1054807406 /nfs/dbraw/zinc/80/74/06/1054807406.db2.gz LGAHGLSCFVPOEM-UHFFFAOYSA-N 1 2 313.203 4.347 20 0 DIADLO C[N@@H+](Cc1cccc(F)c1N)Cc1cccc(Cl)c1Cl ZINC001235790716 1054807423 /nfs/dbraw/zinc/80/74/23/1054807423.db2.gz LGAHGLSCFVPOEM-UHFFFAOYSA-N 1 2 313.203 4.347 20 0 DIADLO Cc1cc(Br)cc(C)c1C[N@@H+]1CCc2occc2C1 ZINC001235787179 1054807621 /nfs/dbraw/zinc/80/76/21/1054807621.db2.gz BOHJTFCGMVPWPE-UHFFFAOYSA-N 1 2 320.230 4.217 20 0 DIADLO Cc1cc(Br)cc(C)c1C[N@H+]1CCc2occc2C1 ZINC001235787179 1054807629 /nfs/dbraw/zinc/80/76/29/1054807629.db2.gz BOHJTFCGMVPWPE-UHFFFAOYSA-N 1 2 320.230 4.217 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(F)nc1C ZINC001235820198 1054811262 /nfs/dbraw/zinc/81/12/62/1054811262.db2.gz LQBCSQLIKLNQAU-KRWDZBQOSA-N 1 2 314.404 4.013 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(F)nc1C ZINC001235820198 1054811277 /nfs/dbraw/zinc/81/12/77/1054811277.db2.gz LQBCSQLIKLNQAU-KRWDZBQOSA-N 1 2 314.404 4.013 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001235820876 1054814321 /nfs/dbraw/zinc/81/43/21/1054814321.db2.gz QEKQWJAEAQCBBK-HNNXBMFYSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(F)ccc1C[N@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001235820876 1054814334 /nfs/dbraw/zinc/81/43/34/1054814334.db2.gz QEKQWJAEAQCBBK-HNNXBMFYSA-N 1 2 306.331 4.144 20 0 DIADLO CC(C)c1cc(NCc2ccc3c(c2)COC3)nc(C(C)C)[nH+]1 ZINC000534877205 1054814570 /nfs/dbraw/zinc/81/45/70/1054814570.db2.gz RXEADQURNZHOJM-UHFFFAOYSA-N 1 2 311.429 4.366 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1cccc2cccnc21 ZINC000534147922 1054815181 /nfs/dbraw/zinc/81/51/81/1054815181.db2.gz MKXYQAQZBZPLAC-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO Cc1scc(CNc2ccc(-c3cnn(C)c3)c(C)[nH+]2)c1C ZINC000630955562 1054822281 /nfs/dbraw/zinc/82/22/81/1054822281.db2.gz VKEBWSVDADEGTQ-UHFFFAOYSA-N 1 2 312.442 4.081 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1ccc(C(F)F)nc1 ZINC000630951165 1054822550 /nfs/dbraw/zinc/82/25/50/1054822550.db2.gz IYQJJRFOJZCRNZ-UHFFFAOYSA-N 1 2 316.355 4.391 20 0 DIADLO Cc1nc2cc(C[N@@H+]3CCC[C@@H]3c3nccs3)ccc2s1 ZINC001235864489 1054826190 /nfs/dbraw/zinc/82/61/90/1054826190.db2.gz ZJYMFDLBVNVICB-CQSZACIVSA-N 1 2 315.467 4.398 20 0 DIADLO Cc1nc2cc(C[N@H+]3CCC[C@@H]3c3nccs3)ccc2s1 ZINC001235864489 1054826201 /nfs/dbraw/zinc/82/62/01/1054826201.db2.gz ZJYMFDLBVNVICB-CQSZACIVSA-N 1 2 315.467 4.398 20 0 DIADLO CC(C)[NH+](Cc1c(Br)ccnc1Cl)C(C)C ZINC001235872543 1054829544 /nfs/dbraw/zinc/82/95/44/1054829544.db2.gz XGFGDOJJZQNMHG-UHFFFAOYSA-N 1 2 305.647 4.116 20 0 DIADLO Cc1csc([C@H](C)[NH2+]C2(c3ccc(F)cc3F)CCC2)n1 ZINC000623944677 1054831081 /nfs/dbraw/zinc/83/10/81/1054831081.db2.gz NOKCXBKUVSJREI-NSHDSACASA-N 1 2 308.397 4.460 20 0 DIADLO C[C@H]([NH2+]Cc1csc(Nc2ccccc2)n1)c1cccnc1 ZINC000181295183 1054911210 /nfs/dbraw/zinc/91/12/10/1054911210.db2.gz WGTGLCUTJAIJQH-ZDUSSCGKSA-N 1 2 310.426 4.133 20 0 DIADLO Cc1cc(C)c(CNC(=O)N(C)C[C@@H](C)C2CCCCC2)c[nH+]1 ZINC000624178320 1054912530 /nfs/dbraw/zinc/91/25/30/1054912530.db2.gz BCLYYDWMJJTZDD-OAHLLOKOSA-N 1 2 317.477 4.056 20 0 DIADLO OCc1ccc(C(F)(F)F)cc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001236057659 1054918776 /nfs/dbraw/zinc/91/87/76/1054918776.db2.gz GTPQWAKQSKOZNH-UHFFFAOYSA-N 1 2 318.298 4.050 20 0 DIADLO CCC[N@H+](Cc1nc2ccccc2n1C)Cc1ccccc1F ZINC000624194087 1054924922 /nfs/dbraw/zinc/92/49/22/1054924922.db2.gz CLIFNXMFOJZMQD-UHFFFAOYSA-N 1 2 311.404 4.125 20 0 DIADLO CCC[N@@H+](Cc1nc2ccccc2n1C)Cc1ccccc1F ZINC000624194087 1054924935 /nfs/dbraw/zinc/92/49/35/1054924935.db2.gz CLIFNXMFOJZMQD-UHFFFAOYSA-N 1 2 311.404 4.125 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1ccc(C)cc1 ZINC000181684594 1054929863 /nfs/dbraw/zinc/92/98/63/1054929863.db2.gz DMLKHPZPCSRLGU-ZFWWWQNUSA-N 1 2 301.434 4.477 20 0 DIADLO COc1c(C)c[nH+]c(CN[C@H](C)c2c(F)cccc2Cl)c1C ZINC000181743202 1054935305 /nfs/dbraw/zinc/93/53/05/1054935305.db2.gz GWIVSMXTAZWLHE-GFCCVEGCSA-N 1 2 322.811 4.350 20 0 DIADLO COc1c(C)cnc(C[NH2+][C@H](C)c2c(F)cccc2Cl)c1C ZINC000181743202 1054935318 /nfs/dbraw/zinc/93/53/18/1054935318.db2.gz GWIVSMXTAZWLHE-GFCCVEGCSA-N 1 2 322.811 4.350 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3cc(N)ccc3C2)c(Cl)c1Cl ZINC001236106743 1054948555 /nfs/dbraw/zinc/94/85/55/1054948555.db2.gz XTOSNMKRLRSWBS-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3cc(N)ccc3C2)c(Cl)c1Cl ZINC001236106743 1054948567 /nfs/dbraw/zinc/94/85/67/1054948567.db2.gz XTOSNMKRLRSWBS-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO Nc1ccc2c(c1)CC[N@@H+](Cc1cc(Cl)ccc1Cl)C2 ZINC001236105864 1054949519 /nfs/dbraw/zinc/94/95/19/1054949519.db2.gz UQDUYSRGJMJHHC-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1ccc2c(c1)CC[N@H+](Cc1cc(Cl)ccc1Cl)C2 ZINC001236105864 1054949534 /nfs/dbraw/zinc/94/95/34/1054949534.db2.gz UQDUYSRGJMJHHC-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](C)c2ccc(OC)c(F)c2)cs1 ZINC000181995760 1054953356 /nfs/dbraw/zinc/95/33/56/1054953356.db2.gz OHFXAAXSCJKULG-NSHDSACASA-N 1 2 308.422 4.094 20 0 DIADLO C[N@H+](Cc1ccc2ccccc2c1)Cc1c(N)ccnc1Cl ZINC001236183009 1054981698 /nfs/dbraw/zinc/98/16/98/1054981698.db2.gz BILMVWHUACFYPB-UHFFFAOYSA-N 1 2 311.816 4.102 20 0 DIADLO C[N@@H+](Cc1ccc2ccccc2c1)Cc1c(N)ccnc1Cl ZINC001236183009 1054981712 /nfs/dbraw/zinc/98/17/12/1054981712.db2.gz BILMVWHUACFYPB-UHFFFAOYSA-N 1 2 311.816 4.102 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(-c2cccs2)on1)c1c(C)noc1C ZINC000182401169 1054986133 /nfs/dbraw/zinc/98/61/33/1054986133.db2.gz WAVAVYOTGRFGNI-CYBMUJFWSA-N 1 2 317.414 4.249 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(-c2ccoc2)no1)c1cccc(Cl)c1 ZINC000182590237 1054997479 /nfs/dbraw/zinc/99/74/79/1054997479.db2.gz OWFBBLYEIWVYOZ-CQSZACIVSA-N 1 2 317.776 4.224 20 0 DIADLO COc1cc(-c2ccc(-n3cc[nH+]c3)cc2OC)cc(C)c1F ZINC001236206634 1055000392 /nfs/dbraw/zinc/00/03/92/1055000392.db2.gz NGAFXXNMEJSOHK-UHFFFAOYSA-N 1 2 312.344 4.004 20 0 DIADLO Cc1nc([C@@H]([NH2+]C2CCCCCC2)c2ccc(Cl)cc2)no1 ZINC000182681520 1055004133 /nfs/dbraw/zinc/00/41/33/1055004133.db2.gz XRTJXPHQMFNXSM-INIZCTEOSA-N 1 2 319.836 4.433 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2ncc(C(C)C)s2)cc1 ZINC000182976395 1055022191 /nfs/dbraw/zinc/02/21/91/1055022191.db2.gz ICESRKXGBFRQAM-CYBMUJFWSA-N 1 2 304.459 4.468 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2ncc(C(C)C)s2)cc1 ZINC000182976395 1055022203 /nfs/dbraw/zinc/02/22/03/1055022203.db2.gz ICESRKXGBFRQAM-CYBMUJFWSA-N 1 2 304.459 4.468 20 0 DIADLO CC[N@H+](Cc1ncc(C(C)C)s1)Cc1ccc(OC)cc1 ZINC000182992417 1055022739 /nfs/dbraw/zinc/02/27/39/1055022739.db2.gz MYCCPQGGNSYQFL-UHFFFAOYSA-N 1 2 304.459 4.297 20 0 DIADLO CC[N@@H+](Cc1ncc(C(C)C)s1)Cc1ccc(OC)cc1 ZINC000182992417 1055022745 /nfs/dbraw/zinc/02/27/45/1055022745.db2.gz MYCCPQGGNSYQFL-UHFFFAOYSA-N 1 2 304.459 4.297 20 0 DIADLO Cc1cccc(C([NH2+][C@H](C)c2nccn2C)c2cccc(C)c2)c1 ZINC000183091089 1055030213 /nfs/dbraw/zinc/03/02/13/1055030213.db2.gz FVPARAIPEUGXQP-QGZVFWFLSA-N 1 2 319.452 4.477 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cc(F)c(F)c(F)c1 ZINC000183150170 1055032500 /nfs/dbraw/zinc/03/25/00/1055032500.db2.gz LRKQZHCAJNRJCX-NSHDSACASA-N 1 2 321.346 4.272 20 0 DIADLO O=C(/C=C\C1CCCCCC1)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC001535996813 1055037518 /nfs/dbraw/zinc/03/75/18/1055037518.db2.gz VCUUQKSYWLIDOY-XFXZXTDPSA-N 1 2 323.440 4.015 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2ccccc2F)c2ccccc2)nc1 ZINC000183292473 1055039704 /nfs/dbraw/zinc/03/97/04/1055039704.db2.gz NKVYJJRPKAOWAS-IBGZPJMESA-N 1 2 310.347 4.239 20 0 DIADLO CCO[C@H](C)Oc1ccc2cc(-c3ccc(N)[nH+]c3)ccc2c1 ZINC001236315916 1055053192 /nfs/dbraw/zinc/05/31/92/1055053192.db2.gz JABIRXHQWWCMDG-ZDUSSCGKSA-N 1 2 308.381 4.245 20 0 DIADLO CCO[C@@H](C)Oc1ccc2cc(-c3ccc(N)[nH+]c3)ccc2c1 ZINC001236315915 1055053643 /nfs/dbraw/zinc/05/36/43/1055053643.db2.gz JABIRXHQWWCMDG-CYBMUJFWSA-N 1 2 308.381 4.245 20 0 DIADLO COc1cc(C)ccc1C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000183713460 1055054936 /nfs/dbraw/zinc/05/49/36/1055054936.db2.gz UKJUKCKEBSMHMY-FQEVSTJZSA-N 1 2 307.393 4.476 20 0 DIADLO Cc1cccc([C@H](C)[NH2+]Cc2nc(Cc3ccccc3)no2)c1C ZINC000183727386 1055056643 /nfs/dbraw/zinc/05/66/43/1055056643.db2.gz JJGDPQHQWAFDBK-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO CCc1c2ccccc2oc1C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001536225743 1055063409 /nfs/dbraw/zinc/06/34/09/1055063409.db2.gz XBXSBSSAKCLNKV-UHFFFAOYSA-N 1 2 319.364 4.204 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2cc(-c3ccc(C)cc3)no2)n1 ZINC000184158252 1055070327 /nfs/dbraw/zinc/07/03/27/1055070327.db2.gz KVWFKCZXJVQOTQ-ZDUSSCGKSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c2ccccc2n1 ZINC000185159502 1055089042 /nfs/dbraw/zinc/08/90/42/1055089042.db2.gz QEBNWTGJMYAYMD-CYBMUJFWSA-N 1 2 324.428 4.075 20 0 DIADLO CCn1c2ccccc2nc1[C@H](C)Nc1cc(C)[nH+]c(C2CC2)n1 ZINC000185728064 1055097881 /nfs/dbraw/zinc/09/78/81/1055097881.db2.gz UEJUWTNKDXVCPK-ZDUSSCGKSA-N 1 2 321.428 4.205 20 0 DIADLO Cc1c(-c2ccc(F)c(-n3cc[nH+]c3)c2)cnn1-c1ccccc1 ZINC001236405268 1055097911 /nfs/dbraw/zinc/09/79/11/1055097911.db2.gz KHWHSLVTEGAWOO-UHFFFAOYSA-N 1 2 318.355 4.173 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nc(-c3ccsc3)no2)c(C)s1 ZINC000193131726 1055098696 /nfs/dbraw/zinc/09/86/96/1055098696.db2.gz VJXPFVBLIFBVTQ-SNVBAGLBSA-N 1 2 319.455 4.327 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2-c2ccccc2)c(C)c[nH+]1 ZINC001127733165 1055114890 /nfs/dbraw/zinc/11/48/90/1055114890.db2.gz DTIZESZNBRJAQE-UHFFFAOYSA-N 1 2 302.377 4.040 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2nc(-c3ccccc3)c[nH]2)C2CC2)s1 ZINC000194339743 1055122662 /nfs/dbraw/zinc/12/26/62/1055122662.db2.gz PCODTYOHKSKTLA-KRWDZBQOSA-N 1 2 324.453 4.083 20 0 DIADLO Cc1ccc(-c2c[nH+]c(N3CCCCC3)cc2C)c2c[nH]nc21 ZINC001236491508 1055143777 /nfs/dbraw/zinc/14/37/77/1055143777.db2.gz CFGMVZADUWZJQU-UHFFFAOYSA-N 1 2 306.413 4.232 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cncc(OC(C)C)c1 ZINC001236519064 1055158180 /nfs/dbraw/zinc/15/81/80/1055158180.db2.gz MMNNZDIWEQKTDE-UHFFFAOYSA-N 1 2 311.429 4.230 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cc(C)cc(C)c3Cl)nn2)c1C ZINC001236548503 1055176279 /nfs/dbraw/zinc/17/62/79/1055176279.db2.gz ONZYERKSJZVCDV-UHFFFAOYSA-N 1 2 312.804 4.216 20 0 DIADLO CC1(C)CC[NH+](Cc2c(Br)ccnc2Cl)CC1 ZINC001236593106 1055200176 /nfs/dbraw/zinc/20/01/76/1055200176.db2.gz BJJCVVOOHZACBV-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@H]1CCC[N@H+](Cc2c(Br)ccnc2Cl)C1 ZINC001236590906 1055202208 /nfs/dbraw/zinc/20/22/08/1055202208.db2.gz IZFLNCOJISGJBZ-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@H]1CCC[N@@H+](Cc2c(Br)ccnc2Cl)C1 ZINC001236590906 1055202212 /nfs/dbraw/zinc/20/22/12/1055202212.db2.gz IZFLNCOJISGJBZ-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CSc1ccccc1[C@@H]1CCC[N@@H+]1Cc1nccnc1Cl ZINC001236624915 1055206053 /nfs/dbraw/zinc/20/60/53/1055206053.db2.gz NXHMKVZKKATDRB-AWEZNQCLSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1ccccc1[C@@H]1CCC[N@H+]1Cc1nccnc1Cl ZINC001236624915 1055206061 /nfs/dbraw/zinc/20/60/61/1055206061.db2.gz NXHMKVZKKATDRB-AWEZNQCLSA-N 1 2 319.861 4.189 20 0 DIADLO Cc1c(Br)cccc1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC001236613479 1055206480 /nfs/dbraw/zinc/20/64/80/1055206480.db2.gz PZSFITIZYYHPTD-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1c(Br)cccc1C[N@H+]1CCC[C@@](C)(F)C1 ZINC001236613479 1055206486 /nfs/dbraw/zinc/20/64/86/1055206486.db2.gz PZSFITIZYYHPTD-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO C[C@]1(F)CCC[N@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)CC1 ZINC001236618617 1055206559 /nfs/dbraw/zinc/20/65/59/1055206559.db2.gz GULAENLCWDAIAZ-ZDUSSCGKSA-N 1 2 324.749 4.468 20 0 DIADLO C[C@]1(F)CCC[N@@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)CC1 ZINC001236618617 1055206564 /nfs/dbraw/zinc/20/65/64/1055206564.db2.gz GULAENLCWDAIAZ-ZDUSSCGKSA-N 1 2 324.749 4.468 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)[C@H]1C ZINC001236636871 1055209228 /nfs/dbraw/zinc/20/92/28/1055209228.db2.gz UZJVWWXNSLXKOS-UWVGGRQHSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)[C@H](C)C1 ZINC001236635420 1055208506 /nfs/dbraw/zinc/20/85/06/1055208506.db2.gz MHZVYAUIMBGGQZ-NXEZZACHSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)[C@H](C)C1 ZINC001236635420 1055208510 /nfs/dbraw/zinc/20/85/10/1055208510.db2.gz MHZVYAUIMBGGQZ-NXEZZACHSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)[C@H]1C ZINC001236636871 1055209221 /nfs/dbraw/zinc/20/92/21/1055209221.db2.gz UZJVWWXNSLXKOS-UWVGGRQHSA-N 1 2 306.759 4.374 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCSC[C@H]2c2ccccc2)n1 ZINC001236642865 1055210906 /nfs/dbraw/zinc/21/09/06/1055210906.db2.gz LTACQBNGDZPHHB-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCSC[C@H]2c2ccccc2)n1 ZINC001236642865 1055210913 /nfs/dbraw/zinc/21/09/13/1055210913.db2.gz LTACQBNGDZPHHB-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Fc1c(Cl)cc(C[N@@H+]2CC[C@@H]3CCCO[C@@H]3C2)cc1Cl ZINC001236651538 1055213095 /nfs/dbraw/zinc/21/30/95/1055213095.db2.gz LJRCEIHRXKGMJM-SMDDNHRTSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1c(Cl)cc(C[N@H+]2CC[C@@H]3CCCO[C@@H]3C2)cc1Cl ZINC001236651538 1055213102 /nfs/dbraw/zinc/21/31/02/1055213102.db2.gz LJRCEIHRXKGMJM-SMDDNHRTSA-N 1 2 318.219 4.133 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@@H](c2ccccc2)c2cccc(F)c2)o1 ZINC001620835391 1055224812 /nfs/dbraw/zinc/22/48/12/1055224812.db2.gz HGKUTFZOPWVWHS-IBGZPJMESA-N 1 2 310.372 4.310 20 0 DIADLO CCOc1ncc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)cc1F ZINC001236695147 1055232046 /nfs/dbraw/zinc/23/20/46/1055232046.db2.gz SVWVCAGWGWDBKK-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ncc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)cc1F ZINC001236695147 1055232057 /nfs/dbraw/zinc/23/20/57/1055232057.db2.gz SVWVCAGWGWDBKK-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ncc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cc1F ZINC001236695149 1055234394 /nfs/dbraw/zinc/23/43/94/1055234394.db2.gz SVWVCAGWGWDBKK-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ncc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)cc1F ZINC001236695149 1055234406 /nfs/dbraw/zinc/23/44/06/1055234406.db2.gz SVWVCAGWGWDBKK-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)ccc1F ZINC001236713052 1055236101 /nfs/dbraw/zinc/23/61/01/1055236101.db2.gz LUYACZGCOLWUOP-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)ccc1F ZINC001236713052 1055236112 /nfs/dbraw/zinc/23/61/12/1055236112.db2.gz LUYACZGCOLWUOP-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO C[N@H+](Cc1ccccc1F)Cc1ccc(OC(F)F)cc1F ZINC001236719843 1055239832 /nfs/dbraw/zinc/23/98/32/1055239832.db2.gz AQUIENMIMWHORA-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO C[N@@H+](Cc1ccccc1F)Cc1ccc(OC(F)F)cc1F ZINC001236719843 1055239849 /nfs/dbraw/zinc/23/98/49/1055239849.db2.gz AQUIENMIMWHORA-UHFFFAOYSA-N 1 2 313.294 4.198 20 0 DIADLO Cc1ccc(NC(=O)NCC[C@H](C)CC(C)(C)C)c(N(C)C)[nH+]1 ZINC001562530494 1055242944 /nfs/dbraw/zinc/24/29/44/1055242944.db2.gz HNRSXKOCUYQXGK-ZDUSSCGKSA-N 1 2 320.481 4.040 20 0 DIADLO Fc1ccc([C@@H]2COCC[N@@H+]2Cc2cccc3ccoc32)cc1 ZINC001236744107 1055248114 /nfs/dbraw/zinc/24/81/14/1055248114.db2.gz YLDPXVDWDALYGW-SFHVURJKSA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccc([C@@H]2COCC[N@H+]2Cc2cccc3ccoc32)cc1 ZINC001236744107 1055248122 /nfs/dbraw/zinc/24/81/22/1055248122.db2.gz YLDPXVDWDALYGW-SFHVURJKSA-N 1 2 311.356 4.145 20 0 DIADLO C[C@H](CC(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CC1 ZINC001587253333 1055252210 /nfs/dbraw/zinc/25/22/10/1055252210.db2.gz YRKNDPSIZWNYMO-CQSZACIVSA-N 1 2 324.424 4.228 20 0 DIADLO O=C(CCC1CCC1)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001587252076 1055252668 /nfs/dbraw/zinc/25/26/68/1055252668.db2.gz AMOGUTHOBRNHRE-UHFFFAOYSA-N 1 2 324.424 4.372 20 0 DIADLO Cc1ccoc1C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001587252111 1055252994 /nfs/dbraw/zinc/25/29/94/1055252994.db2.gz ASNDLRSZYXAAGI-UHFFFAOYSA-N 1 2 322.364 4.007 20 0 DIADLO CCCCCC(C)(C)CNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001562742341 1055280270 /nfs/dbraw/zinc/28/02/70/1055280270.db2.gz GULQTSGGTFUQDA-UHFFFAOYSA-N 1 2 302.422 4.062 20 0 DIADLO COc1cc(C[N@H+](C)[C@H](C)c2ccccc2OC)c(F)cc1F ZINC001236832025 1055282979 /nfs/dbraw/zinc/28/29/79/1055282979.db2.gz QAWJGKDUXUNEBV-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1cc(C[N@@H+](C)[C@H](C)c2ccccc2OC)c(F)cc1F ZINC001236832025 1055282991 /nfs/dbraw/zinc/28/29/91/1055282991.db2.gz QAWJGKDUXUNEBV-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1cc(C[N@H+](C)[C@@H](C)c2ccccc2OC)c(F)cc1F ZINC001236832031 1055284577 /nfs/dbraw/zinc/28/45/77/1055284577.db2.gz QAWJGKDUXUNEBV-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1cc(C[N@@H+](C)[C@@H](C)c2ccccc2OC)c(F)cc1F ZINC001236832031 1055284590 /nfs/dbraw/zinc/28/45/90/1055284590.db2.gz QAWJGKDUXUNEBV-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO Clc1cc2ccccc2nc1C[N@@H+]1CCC[C@H]1c1cnccn1 ZINC001236874274 1055299263 /nfs/dbraw/zinc/29/92/63/1055299263.db2.gz KELQGJIMDHNILC-SFHVURJKSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1cc2ccccc2nc1C[N@H+]1CCC[C@H]1c1cnccn1 ZINC001236874274 1055299273 /nfs/dbraw/zinc/29/92/73/1055299273.db2.gz KELQGJIMDHNILC-SFHVURJKSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1ccc(Cl)c(COc2ccccc2-n2cc[nH+]c2)n1 ZINC000764937741 1055299888 /nfs/dbraw/zinc/29/98/88/1055299888.db2.gz VPYDKUOSXPPXSW-UHFFFAOYSA-N 1 2 320.179 4.153 20 0 DIADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccc2oc3ccccc3c2c1 ZINC001587456384 1055300177 /nfs/dbraw/zinc/30/01/77/1055300177.db2.gz SIDNVXBJGIILIP-GFCCVEGCSA-N 1 2 319.364 4.126 20 0 DIADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccc2oc3ccccc3c2c1 ZINC001587456384 1055300196 /nfs/dbraw/zinc/30/01/96/1055300196.db2.gz SIDNVXBJGIILIP-GFCCVEGCSA-N 1 2 319.364 4.126 20 0 DIADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccc2oc3ccccc3c2c1 ZINC001587456385 1055301067 /nfs/dbraw/zinc/30/10/67/1055301067.db2.gz SIDNVXBJGIILIP-LBPRGKRZSA-N 1 2 319.364 4.126 20 0 DIADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccc2oc3ccccc3c2c1 ZINC001587456385 1055301085 /nfs/dbraw/zinc/30/10/85/1055301085.db2.gz SIDNVXBJGIILIP-LBPRGKRZSA-N 1 2 319.364 4.126 20 0 DIADLO Fc1ccc(C[N@@H+]2CCc3ncc(Cl)cc3C2)c2occc21 ZINC001236901035 1055307250 /nfs/dbraw/zinc/30/72/50/1055307250.db2.gz IYRWDZJCQWYOBG-UHFFFAOYSA-N 1 2 316.763 4.179 20 0 DIADLO Fc1ccc(C[N@H+]2CCc3ncc(Cl)cc3C2)c2occc21 ZINC001236901035 1055307264 /nfs/dbraw/zinc/30/72/64/1055307264.db2.gz IYRWDZJCQWYOBG-UHFFFAOYSA-N 1 2 316.763 4.179 20 0 DIADLO CC(C)(C)Oc1ccccc1C[N@@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001237024027 1055344387 /nfs/dbraw/zinc/34/43/87/1055344387.db2.gz WFZMOXSMZSJEDP-OAHLLOKOSA-N 1 2 315.379 4.433 20 0 DIADLO CC(C)(C)Oc1ccccc1C[N@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001237024027 1055344398 /nfs/dbraw/zinc/34/43/98/1055344398.db2.gz WFZMOXSMZSJEDP-OAHLLOKOSA-N 1 2 315.379 4.433 20 0 DIADLO COc1cccc2cc(C[NH2+]Cc3nc(C4CC4)cs3)oc21 ZINC000765261791 1055347763 /nfs/dbraw/zinc/34/77/63/1055347763.db2.gz OJBPSBYRTOJRQJ-UHFFFAOYSA-N 1 2 314.410 4.065 20 0 DIADLO COc1ccsc1C[NH2+]Cc1coc(-c2ccc(C)cc2)n1 ZINC000765256375 1055349020 /nfs/dbraw/zinc/34/90/20/1055349020.db2.gz VWUQUXFNBMKCNZ-UHFFFAOYSA-N 1 2 314.410 4.010 20 0 DIADLO Cc1cc(NC(=O)C2(Cc3cccs3)CCCCC2)cc[nH+]1 ZINC001537534605 1055351058 /nfs/dbraw/zinc/35/10/58/1055351058.db2.gz BPYJMQQHBIELSF-UHFFFAOYSA-N 1 2 314.454 4.005 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2nc(C(C)(C)C)co2)C2CC2)cc1 ZINC000921511980 1055373816 /nfs/dbraw/zinc/37/38/16/1055373816.db2.gz GKQFHHBVGVQCKU-SFHVURJKSA-N 1 2 314.429 4.222 20 0 DIADLO CCC(=CC(=O)Nc1c(C)c[nH+]cc1C)c1cccc(Cl)c1 ZINC001537603327 1055377130 /nfs/dbraw/zinc/37/71/30/1055377130.db2.gz DGMYFRXPLHPVKD-NTEUORMPSA-N 1 2 314.816 4.206 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@@H](C)c1cccc(CC(C)C)c1 ZINC001537609572 1055379281 /nfs/dbraw/zinc/37/92/81/1055379281.db2.gz KPPRWCORIKJMCS-INIZCTEOSA-N 1 2 310.441 4.061 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@H](Cc2ccccc2)C(C)C)c(C)[nH+]1 ZINC001537619991 1055381071 /nfs/dbraw/zinc/38/10/71/1055381071.db2.gz NWVPXFLSMXJCGS-IBGZPJMESA-N 1 2 324.468 4.252 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2Cc2ccc3cccccc2-3)no1 ZINC001237191185 1055399173 /nfs/dbraw/zinc/39/91/73/1055399173.db2.gz SLPGFCRUNWGWGJ-SFHVURJKSA-N 1 2 307.397 4.210 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2Cc2ccc3cccccc2-3)no1 ZINC001237191185 1055399187 /nfs/dbraw/zinc/39/91/87/1055399187.db2.gz SLPGFCRUNWGWGJ-SFHVURJKSA-N 1 2 307.397 4.210 20 0 DIADLO COc1cccc(C[N@@H+]2CCC(=O)[C@H](C)C23CCCC3)c1Cl ZINC001237194521 1055401683 /nfs/dbraw/zinc/40/16/83/1055401683.db2.gz FCIFTSZBIPKAON-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO COc1cccc(C[N@H+]2CCC(=O)[C@H](C)C23CCCC3)c1Cl ZINC001237194521 1055401692 /nfs/dbraw/zinc/40/16/92/1055401692.db2.gz FCIFTSZBIPKAON-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO COc1cccc(C[N@@H+]2CCC(=O)[C@@H](C)C23CCCC3)c1Cl ZINC001237194519 1055402465 /nfs/dbraw/zinc/40/24/65/1055402465.db2.gz FCIFTSZBIPKAON-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO COc1cccc(C[N@H+]2CCC(=O)[C@@H](C)C23CCCC3)c1Cl ZINC001237194519 1055402473 /nfs/dbraw/zinc/40/24/73/1055402473.db2.gz FCIFTSZBIPKAON-CYBMUJFWSA-N 1 2 321.848 4.072 20 0 DIADLO CC[N@H+](CC(=O)OC)Cc1ccc2sc3ccccc3c2c1 ZINC001237197719 1055402533 /nfs/dbraw/zinc/40/25/33/1055402533.db2.gz DLFRFDHPZYZAMV-UHFFFAOYSA-N 1 2 313.422 4.049 20 0 DIADLO CC[N@@H+](CC(=O)OC)Cc1ccc2sc3ccccc3c2c1 ZINC001237197719 1055402540 /nfs/dbraw/zinc/40/25/40/1055402540.db2.gz DLFRFDHPZYZAMV-UHFFFAOYSA-N 1 2 313.422 4.049 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@]2(c3ccccc3)CC2(C)C)c(C)[nH+]1 ZINC001587953455 1055404798 /nfs/dbraw/zinc/40/47/98/1055404798.db2.gz TUABXWJSTKHKQG-NRFANRHFSA-N 1 2 322.452 4.105 20 0 DIADLO COc1nc(Cl)ccc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001237241223 1055407539 /nfs/dbraw/zinc/40/75/39/1055407539.db2.gz JOAVAWLRKNOXDG-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nc(Cl)ccc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001237241223 1055407552 /nfs/dbraw/zinc/40/75/52/1055407552.db2.gz JOAVAWLRKNOXDG-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nc(Cl)ccc1C[N@@H+]1CCC[C@H]1c1cccs1 ZINC001237244031 1055407707 /nfs/dbraw/zinc/40/77/07/1055407707.db2.gz KIZOCMJPOQMAAC-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO COc1nc(Cl)ccc1C[N@H+]1CCC[C@H]1c1cccs1 ZINC001237244031 1055407715 /nfs/dbraw/zinc/40/77/15/1055407715.db2.gz KIZOCMJPOQMAAC-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CCc3cc(Cl)ccc32)c(C)[nH+]1 ZINC001588010190 1055414384 /nfs/dbraw/zinc/41/43/84/1055414384.db2.gz PPOMXZFHCUEJBX-MRXNPFEDSA-N 1 2 314.816 4.078 20 0 DIADLO COc1cc(C[N@@H+]2CCn3cccc3[C@H]2C)ccc1C(F)F ZINC001237279034 1055414469 /nfs/dbraw/zinc/41/44/69/1055414469.db2.gz FUYUTGCEXIOEDY-GFCCVEGCSA-N 1 2 306.356 4.011 20 0 DIADLO COc1cc(C[N@H+]2CCn3cccc3[C@H]2C)ccc1C(F)F ZINC001237279034 1055414473 /nfs/dbraw/zinc/41/44/73/1055414473.db2.gz FUYUTGCEXIOEDY-GFCCVEGCSA-N 1 2 306.356 4.011 20 0 DIADLO Cc1cc(NC(=O)CCC(=O)c2ccc3ccccc3c2)cc[nH+]1 ZINC000010165300 1055416092 /nfs/dbraw/zinc/41/60/92/1055416092.db2.gz NSOPEHWTWOFLBX-UHFFFAOYSA-N 1 2 318.376 4.145 20 0 DIADLO C[N@H+](Cc1ccon1)Cc1ccccc1CCc1ccccc1 ZINC001237295680 1055418384 /nfs/dbraw/zinc/41/83/84/1055418384.db2.gz XSQRLFWCGMWBTQ-UHFFFAOYSA-N 1 2 306.409 4.092 20 0 DIADLO C[N@@H+](Cc1ccon1)Cc1ccccc1CCc1ccccc1 ZINC001237295680 1055418392 /nfs/dbraw/zinc/41/83/92/1055418392.db2.gz XSQRLFWCGMWBTQ-UHFFFAOYSA-N 1 2 306.409 4.092 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cc(O)cc(F)c1 ZINC001237288439 1055418624 /nfs/dbraw/zinc/41/86/24/1055418624.db2.gz YPQKCUDQBYRZGD-GOSISDBHSA-N 1 2 315.388 4.015 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cc(O)cc(F)c1 ZINC001237288439 1055418630 /nfs/dbraw/zinc/41/86/30/1055418630.db2.gz YPQKCUDQBYRZGD-GOSISDBHSA-N 1 2 315.388 4.015 20 0 DIADLO c1cc2cccc(NC3CCN(c4cccc[nH+]4)CC3)c2s1 ZINC000386173421 1055426616 /nfs/dbraw/zinc/42/66/16/1055426616.db2.gz NHOCCSLOVDYWMR-UHFFFAOYSA-N 1 2 309.438 4.377 20 0 DIADLO CCCC[C@@H](C)N(CCCC)C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC001588108202 1055430889 /nfs/dbraw/zinc/43/08/89/1055430889.db2.gz MAKATDFOLKUWJI-OAHLLOKOSA-N 1 2 315.461 4.464 20 0 DIADLO COc1c(C)cccc1C[N@H+](CC(=O)c1ccccc1)C(C)C ZINC001237515666 1055464772 /nfs/dbraw/zinc/46/47/72/1055464772.db2.gz ZVMXDCVUNKZSLH-UHFFFAOYSA-N 1 2 311.425 4.097 20 0 DIADLO COc1c(C)cccc1C[N@@H+](CC(=O)c1ccccc1)C(C)C ZINC001237515666 1055464778 /nfs/dbraw/zinc/46/47/78/1055464778.db2.gz ZVMXDCVUNKZSLH-UHFFFAOYSA-N 1 2 311.425 4.097 20 0 DIADLO Oc1c(C[N@H+](Cc2ccccc2)C2CC2)cc(Cl)nc1Cl ZINC001237539746 1055469601 /nfs/dbraw/zinc/46/96/01/1055469601.db2.gz SUWDZDODEVFUKZ-UHFFFAOYSA-N 1 2 323.223 4.259 20 0 DIADLO Oc1c(C[N@@H+](Cc2ccccc2)C2CC2)cc(Cl)nc1Cl ZINC001237539746 1055469609 /nfs/dbraw/zinc/46/96/09/1055469609.db2.gz SUWDZDODEVFUKZ-UHFFFAOYSA-N 1 2 323.223 4.259 20 0 DIADLO F[C@@H]1C[N@H+](Cc2cccc(-c3ccccc3)n2)CCCC1(F)F ZINC001237542812 1055471454 /nfs/dbraw/zinc/47/14/54/1055471454.db2.gz PPCOGTXKJFEXRS-QGZVFWFLSA-N 1 2 320.358 4.318 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2cccc(-c3ccccc3)n2)CCCC1(F)F ZINC001237542812 1055471461 /nfs/dbraw/zinc/47/14/61/1055471461.db2.gz PPCOGTXKJFEXRS-QGZVFWFLSA-N 1 2 320.358 4.318 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cccc(-c2ccccc2)n1 ZINC001237547333 1055471647 /nfs/dbraw/zinc/47/16/47/1055471647.db2.gz SIZUCAWTJVBZCY-INIZCTEOSA-N 1 2 303.409 4.127 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cccc(-c2ccccc2)n1 ZINC001237547333 1055471650 /nfs/dbraw/zinc/47/16/50/1055471650.db2.gz SIZUCAWTJVBZCY-INIZCTEOSA-N 1 2 303.409 4.127 20 0 DIADLO CC(C)Oc1ccc(CNc2ccc3c(c2)CCC[N@H+]3C)cc1 ZINC001620851733 1055478935 /nfs/dbraw/zinc/47/89/35/1055478935.db2.gz HQLSGPYMZIZKTK-UHFFFAOYSA-N 1 2 310.441 4.468 20 0 DIADLO CC(C)Oc1ccc(CNc2ccc3c(c2)CCC[N@@H+]3C)cc1 ZINC001620851733 1055478942 /nfs/dbraw/zinc/47/89/42/1055478942.db2.gz HQLSGPYMZIZKTK-UHFFFAOYSA-N 1 2 310.441 4.468 20 0 DIADLO Cc1cccc(CNc2ccc([NH+](C)C)cc2)c1Br ZINC001620852878 1055481253 /nfs/dbraw/zinc/48/12/53/1055481253.db2.gz UAMHLVPSFPFPSC-UHFFFAOYSA-N 1 2 319.246 4.436 20 0 DIADLO CCO[C@@H]1CCC[N@H+](Cc2c(Cl)cc(F)cc2Cl)C1 ZINC001237596279 1055482216 /nfs/dbraw/zinc/48/22/16/1055482216.db2.gz JRCTUDKAELEQQX-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO CCO[C@@H]1CCC[N@@H+](Cc2c(Cl)cc(F)cc2Cl)C1 ZINC001237596279 1055482227 /nfs/dbraw/zinc/48/22/27/1055482227.db2.gz JRCTUDKAELEQQX-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccc(-c2cnc(C3CC3)o2)cc1 ZINC001620853724 1055483243 /nfs/dbraw/zinc/48/32/43/1055483243.db2.gz WALLNUUCSLKSIZ-UHFFFAOYSA-N 1 2 322.412 4.438 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3C[C@H]3C(C)(C)C)cc2)[nH+]c1C ZINC001589468177 1055484354 /nfs/dbraw/zinc/48/43/54/1055484354.db2.gz YKWCJJOXOSXDRV-HZPDHXFCSA-N 1 2 311.429 4.314 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1cccc(OC(F)F)c1 ZINC000921541176 1055490561 /nfs/dbraw/zinc/49/05/61/1055490561.db2.gz WNFGURWAXXDPEM-NSHDSACASA-N 1 2 324.371 4.424 20 0 DIADLO CCOc1cc(F)ccc1NCc1cc(C)[nH+]c2c1CCCC2 ZINC001620865850 1055491783 /nfs/dbraw/zinc/49/17/83/1055491783.db2.gz PGVPOTAQDRPJQO-UHFFFAOYSA-N 1 2 314.404 4.419 20 0 DIADLO Cc1c2ccccc2oc1C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000023889329 1055506272 /nfs/dbraw/zinc/50/62/72/1055506272.db2.gz DXZIWHKGAHEJJL-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO COc1ccc(C)c(C[N@@H+]2CCc3c4ccccc4oc3C2)c1 ZINC001237716355 1055513674 /nfs/dbraw/zinc/51/36/74/1055513674.db2.gz SZTRJOOEVWSZQG-UHFFFAOYSA-N 1 2 307.393 4.308 20 0 DIADLO COc1ccc(C)c(C[N@H+]2CCc3c4ccccc4oc3C2)c1 ZINC001237716355 1055513691 /nfs/dbraw/zinc/51/36/91/1055513691.db2.gz SZTRJOOEVWSZQG-UHFFFAOYSA-N 1 2 307.393 4.308 20 0 DIADLO Cc1ccc2c(ccc(C)c2C(=O)Nc2cccc3[nH+]ccn32)c1 ZINC001538058720 1055515990 /nfs/dbraw/zinc/51/59/90/1055515990.db2.gz UXOQEHZXOPDKQU-UHFFFAOYSA-N 1 2 315.376 4.357 20 0 DIADLO Clc1cnc(C[N@@H+]2CCC23CCCC3)c(Br)c1 ZINC001237755926 1055524591 /nfs/dbraw/zinc/52/45/91/1055524591.db2.gz GRZKWBYCATWCIX-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Clc1cnc(C[N@H+]2CCC23CCCC3)c(Br)c1 ZINC001237755926 1055524599 /nfs/dbraw/zinc/52/45/99/1055524599.db2.gz GRZKWBYCATWCIX-UHFFFAOYSA-N 1 2 315.642 4.016 20 0 DIADLO Clc1ccc(-c2nc(C[NH+]3CC4(CSC4)C3)cs2)cc1 ZINC001237765518 1055525476 /nfs/dbraw/zinc/52/54/76/1055525476.db2.gz VPXJCAQQIBUDCU-UHFFFAOYSA-N 1 2 322.886 4.012 20 0 DIADLO Cc1cc(C[NH2+][C@H]2COc3cc(F)cc(F)c32)ccc1Cl ZINC001620898792 1055525663 /nfs/dbraw/zinc/52/56/63/1055525663.db2.gz FPMQZAJWGOIWID-AWEZNQCLSA-N 1 2 309.743 4.150 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccc(OC(C)C)cc1Cl ZINC001620904794 1055528694 /nfs/dbraw/zinc/52/86/94/1055528694.db2.gz RFIJGYDMFGXOHW-UHFFFAOYSA-N 1 2 307.825 4.346 20 0 DIADLO CC(C)Oc1cccc(C[NH2+]Cc2nc(C(C)(C)C)co2)c1 ZINC000921548564 1055543426 /nfs/dbraw/zinc/54/34/26/1055543426.db2.gz ATUPSVANAVRWJK-UHFFFAOYSA-N 1 2 302.418 4.049 20 0 DIADLO COc1ccoc1C[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC001237874601 1055548775 /nfs/dbraw/zinc/54/87/75/1055548775.db2.gz XEDGBYWSFXHWQE-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO COc1ccoc1C[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC001237874601 1055548789 /nfs/dbraw/zinc/54/87/89/1055548789.db2.gz XEDGBYWSFXHWQE-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO C[N@H+](Cc1nccs1)Cc1ccc(COc2ccccc2)cc1 ZINC001237920850 1055557168 /nfs/dbraw/zinc/55/71/68/1055557168.db2.gz NJGRUHQBGJAIJB-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO C[N@@H+](Cc1nccs1)Cc1ccc(COc2ccccc2)cc1 ZINC001237920850 1055557179 /nfs/dbraw/zinc/55/71/79/1055557179.db2.gz NJGRUHQBGJAIJB-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO Fc1cccc(-c2nc(C[N@H+]3CCCC[C@H](F)C3)cs2)c1 ZINC001237968099 1055567924 /nfs/dbraw/zinc/56/79/24/1055567924.db2.gz JXZLTPLZKVWMKP-AWEZNQCLSA-N 1 2 308.397 4.273 20 0 DIADLO Fc1cccc(-c2nc(C[N@@H+]3CCCC[C@H](F)C3)cs2)c1 ZINC001237968099 1055567934 /nfs/dbraw/zinc/56/79/34/1055567934.db2.gz JXZLTPLZKVWMKP-AWEZNQCLSA-N 1 2 308.397 4.273 20 0 DIADLO Oc1ccc(-c2nc(C[N@@H+]3CC[C@H]3c3ccccc3)cs2)cc1 ZINC001237983178 1055572337 /nfs/dbraw/zinc/57/23/37/1055572337.db2.gz NLUGBKWQNMRCOI-SFHVURJKSA-N 1 2 322.433 4.463 20 0 DIADLO Oc1ccc(-c2nc(C[N@H+]3CC[C@H]3c3ccccc3)cs2)cc1 ZINC001237983178 1055572350 /nfs/dbraw/zinc/57/23/50/1055572350.db2.gz NLUGBKWQNMRCOI-SFHVURJKSA-N 1 2 322.433 4.463 20 0 DIADLO Oc1c(F)cc(C[NH+]2CCC3(CC(F)(F)C3)CC2)cc1Cl ZINC001237983176 1055574660 /nfs/dbraw/zinc/57/46/60/1055574660.db2.gz CYRZDSRWKADNPK-UHFFFAOYSA-N 1 2 319.754 4.196 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)cc1Cl ZINC001237990426 1055575502 /nfs/dbraw/zinc/57/55/02/1055575502.db2.gz SLIJWUXPUWWWMB-AWEZNQCLSA-N 1 2 319.807 4.249 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CCCC3(CC(F)C3)CC2)cc1Cl ZINC001237993499 1055576885 /nfs/dbraw/zinc/57/68/85/1055576885.db2.gz QZNPIFZGTSBBDE-UHFFFAOYSA-N 1 2 315.791 4.289 20 0 DIADLO Cc1c(Cl)ccc(C[NH2+]Cc2ncccc2N(C)C)c1Cl ZINC001620955713 1055577385 /nfs/dbraw/zinc/57/73/85/1055577385.db2.gz PXJCVWXIVDJRRZ-UHFFFAOYSA-N 1 2 324.255 4.053 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)cc1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237990874 1055577735 /nfs/dbraw/zinc/57/77/35/1055577735.db2.gz ZYXLAWXBIGVBPA-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO Oc1c(F)cc(C[N@@H+]2CC[C@H](c3ccc(F)cc3)C2)cc1Cl ZINC001237997962 1055578081 /nfs/dbraw/zinc/57/80/81/1055578081.db2.gz PLKCNWJNQAQQRQ-ZDUSSCGKSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)cc1Cl ZINC001237997962 1055578089 /nfs/dbraw/zinc/57/80/89/1055578089.db2.gz PLKCNWJNQAQQRQ-ZDUSSCGKSA-N 1 2 323.770 4.313 20 0 DIADLO CC[N@H+](Cc1ccc(OC)cc1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237987073 1055578808 /nfs/dbraw/zinc/57/88/08/1055578808.db2.gz AJXHGGHEDMYOES-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)cc1)Cc1cc(F)c(O)c(Cl)c1 ZINC001237987073 1055578816 /nfs/dbraw/zinc/57/88/16/1055578816.db2.gz AJXHGGHEDMYOES-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO FC1CC2(C1)CCC[N@@H+](Cc1n[nH]c3cc(Cl)ccc31)CC2 ZINC001238006014 1055580048 /nfs/dbraw/zinc/58/00/48/1055580048.db2.gz XAVSYVCQWXRLBO-UHFFFAOYSA-N 1 2 321.827 4.321 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cncc(Cl)c2Cl)CCC1(F)F ZINC001238006492 1055581172 /nfs/dbraw/zinc/58/11/72/1055581172.db2.gz RPAMNJRMZDNGRX-SECBINFHSA-N 1 2 309.187 4.256 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cncc(Cl)c2Cl)CCC1(F)F ZINC001238006492 1055581185 /nfs/dbraw/zinc/58/11/85/1055581185.db2.gz RPAMNJRMZDNGRX-SECBINFHSA-N 1 2 309.187 4.256 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2cnc(F)cc2Cl)c1 ZINC001238017107 1055584916 /nfs/dbraw/zinc/58/49/16/1055584916.db2.gz BAWNNIHVLGAORZ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2cnc(F)cc2Cl)c1 ZINC001238017107 1055584928 /nfs/dbraw/zinc/58/49/28/1055584928.db2.gz BAWNNIHVLGAORZ-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CCc3cc(C)cc(C)c3)cc2[nH+]1 ZINC001595320517 1055585868 /nfs/dbraw/zinc/58/58/68/1055585868.db2.gz DTVNYBPBDSGIAJ-UHFFFAOYSA-N 1 2 307.397 4.059 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cnc(F)cc1Cl ZINC001238023535 1055586451 /nfs/dbraw/zinc/58/64/51/1055586451.db2.gz KCDIBBUYLFHUSH-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1cnc(F)cc1Cl ZINC001238023535 1055586465 /nfs/dbraw/zinc/58/64/65/1055586465.db2.gz KCDIBBUYLFHUSH-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3C[C@@H](C)C[C@H]3CF)cs2)cc1 ZINC001238037234 1055590734 /nfs/dbraw/zinc/59/07/34/1055590734.db2.gz OBNSMAGQKUJLFB-BBRMVZONSA-N 1 2 304.434 4.298 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3C[C@@H](C)C[C@H]3CF)cs2)cc1 ZINC001238037234 1055590743 /nfs/dbraw/zinc/59/07/43/1055590743.db2.gz OBNSMAGQKUJLFB-BBRMVZONSA-N 1 2 304.434 4.298 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1C[N@H+](C)Cc1ncccn1 ZINC001238061541 1055596666 /nfs/dbraw/zinc/59/66/66/1055596666.db2.gz KFNYQUFIJXGRLM-UHFFFAOYSA-N 1 2 319.408 4.209 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1C[N@@H+](C)Cc1ncccn1 ZINC001238061541 1055596680 /nfs/dbraw/zinc/59/66/80/1055596680.db2.gz KFNYQUFIJXGRLM-UHFFFAOYSA-N 1 2 319.408 4.209 20 0 DIADLO Fc1ccc(C[NH+]2CCC3(CC3)CC2)c(F)c1Br ZINC001238078210 1055603448 /nfs/dbraw/zinc/60/34/48/1055603448.db2.gz ONOJEVHCZYCDTR-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO C[C@@H]1CC(C)(C)c2cccc(NC(=O)CCCn3cc[nH+]c3)c21 ZINC001538362965 1055611115 /nfs/dbraw/zinc/61/11/15/1055611115.db2.gz MTLUSHGNCXQQRV-CQSZACIVSA-N 1 2 311.429 4.087 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@@H](c3ccc(F)cc3)C2)cc1Cl ZINC001238149679 1055612019 /nfs/dbraw/zinc/61/20/19/1055612019.db2.gz MCTVMJWBWLOOJD-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)cc1Cl ZINC001238149679 1055612023 /nfs/dbraw/zinc/61/20/23/1055612023.db2.gz MCTVMJWBWLOOJD-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@@H](Cc3ccccc3)C2)cc1Cl ZINC001238153141 1055613901 /nfs/dbraw/zinc/61/39/01/1055613901.db2.gz XMFHZMMNFAHGRR-AWEZNQCLSA-N 1 2 319.807 4.249 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)cc1Cl ZINC001238153141 1055613909 /nfs/dbraw/zinc/61/39/09/1055613909.db2.gz XMFHZMMNFAHGRR-AWEZNQCLSA-N 1 2 319.807 4.249 20 0 DIADLO Oc1cc(F)c(C[NH+]2CCC3(CC[C@H](F)C3)CC2)cc1Cl ZINC001238150060 1055615443 /nfs/dbraw/zinc/61/54/43/1055615443.db2.gz QCKHUCIHFLILMM-LBPRGKRZSA-N 1 2 315.791 4.289 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2cccc(-c3cccs3)n2)C[C@H]1F ZINC001238211859 1055621104 /nfs/dbraw/zinc/62/11/04/1055621104.db2.gz SVJWYHHZZSQIEW-CVEARBPZSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2cccc(-c3cccs3)n2)C[C@H]1F ZINC001238211859 1055621109 /nfs/dbraw/zinc/62/11/09/1055621109.db2.gz SVJWYHHZZSQIEW-CVEARBPZSA-N 1 2 308.397 4.082 20 0 DIADLO Cc1c(C)c(C[N@H+](C)CC(=O)c2ccccc2)ccc1Cl ZINC001238221281 1055624913 /nfs/dbraw/zinc/62/49/13/1055624913.db2.gz DLGPBYJDRVSWTP-UHFFFAOYSA-N 1 2 301.817 4.272 20 0 DIADLO Cc1c(C)c(C[N@@H+](C)CC(=O)c2ccccc2)ccc1Cl ZINC001238221281 1055624921 /nfs/dbraw/zinc/62/49/21/1055624921.db2.gz DLGPBYJDRVSWTP-UHFFFAOYSA-N 1 2 301.817 4.272 20 0 DIADLO C[N@H+](CCc1cccc(Cl)c1)Cc1c(F)ccnc1Cl ZINC001238231372 1055627799 /nfs/dbraw/zinc/62/77/99/1055627799.db2.gz VJDHJKOTLJEMQG-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1cccc(Cl)c1)Cc1c(F)ccnc1Cl ZINC001238231372 1055627804 /nfs/dbraw/zinc/62/78/04/1055627804.db2.gz VJDHJKOTLJEMQG-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC001238338478 1055640459 /nfs/dbraw/zinc/64/04/59/1055640459.db2.gz JYMGDUTXHVNOHC-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(Cl)ccc(F)c1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC001238338478 1055640465 /nfs/dbraw/zinc/64/04/65/1055640465.db2.gz JYMGDUTXHVNOHC-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cccc(F)c1OCc1ccccc1 ZINC001238332460 1055640856 /nfs/dbraw/zinc/64/08/56/1055640856.db2.gz NIVBJTFABBLEBN-RHSMWYFYSA-N 1 2 317.379 4.337 20 0 DIADLO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1cccc(F)c1OCc1ccccc1 ZINC001238332460 1055640862 /nfs/dbraw/zinc/64/08/62/1055640862.db2.gz NIVBJTFABBLEBN-RHSMWYFYSA-N 1 2 317.379 4.337 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2c(F)ccc(Cl)c2OC)c1 ZINC001238339892 1055640874 /nfs/dbraw/zinc/64/08/74/1055640874.db2.gz QBLVFPUJSDFGNT-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2c(F)ccc(Cl)c2OC)c1 ZINC001238339892 1055640877 /nfs/dbraw/zinc/64/08/77/1055640877.db2.gz QBLVFPUJSDFGNT-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cc(C[N@H+](C)Cc2cccc(Cl)c2)c(Cl)cn1 ZINC001238359054 1055643107 /nfs/dbraw/zinc/64/31/07/1055643107.db2.gz WUMHAKMVXSFNEM-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2cccc(Cl)c2)c(Cl)cn1 ZINC001238359054 1055643116 /nfs/dbraw/zinc/64/31/16/1055643116.db2.gz WUMHAKMVXSFNEM-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccccc2F)c(Cl)cn1 ZINC001238359928 1055645678 /nfs/dbraw/zinc/64/56/78/1055645678.db2.gz MVDVJJVTCRWXSW-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccccc2F)c(Cl)cn1 ZINC001238359928 1055645684 /nfs/dbraw/zinc/64/56/84/1055645684.db2.gz MVDVJJVTCRWXSW-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC1(C)CC[NH+](Cc2ccnc(Br)c2Cl)CC1 ZINC001238377468 1055649738 /nfs/dbraw/zinc/64/97/38/1055649738.db2.gz ORHFDZQLXWWTIM-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(Cl)cncc2Br)[C@@H](C)C1 ZINC001238394684 1055651671 /nfs/dbraw/zinc/65/16/71/1055651671.db2.gz UJKRTKSZMOSCAD-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(Cl)cncc2Br)[C@@H](C)C1 ZINC001238394684 1055651677 /nfs/dbraw/zinc/65/16/77/1055651677.db2.gz UJKRTKSZMOSCAD-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO CCOc1ccc(C[N@H+](CC)Cc2cccnc2)c(Cl)c1 ZINC001238404531 1055652909 /nfs/dbraw/zinc/65/29/09/1055652909.db2.gz ZNFSFDDSDTVYFR-UHFFFAOYSA-N 1 2 304.821 4.156 20 0 DIADLO CCOc1ccc(C[N@@H+](CC)Cc2cccnc2)c(Cl)c1 ZINC001238404531 1055652914 /nfs/dbraw/zinc/65/29/14/1055652914.db2.gz ZNFSFDDSDTVYFR-UHFFFAOYSA-N 1 2 304.821 4.156 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2cccnc2C)c(Cl)c1 ZINC001238406047 1055652978 /nfs/dbraw/zinc/65/29/78/1055652978.db2.gz QJRAKVIXZZYJGB-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2cccnc2C)c(Cl)c1 ZINC001238406047 1055652984 /nfs/dbraw/zinc/65/29/84/1055652984.db2.gz QJRAKVIXZZYJGB-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO Cc1cc(C[N@@H+]2CCSc3ccccc3C2)ncc1Cl ZINC001238431561 1055657571 /nfs/dbraw/zinc/65/75/71/1055657571.db2.gz YLGUWGBQVBGOIG-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO Cc1cc(C[N@H+]2CCSc3ccccc3C2)ncc1Cl ZINC001238431561 1055657574 /nfs/dbraw/zinc/65/75/74/1055657574.db2.gz YLGUWGBQVBGOIG-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO COc1cc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)cnc1F ZINC001238461176 1055664971 /nfs/dbraw/zinc/66/49/71/1055664971.db2.gz CADAOUJXAUWMAI-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1cc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)cnc1F ZINC001238461176 1055664976 /nfs/dbraw/zinc/66/49/76/1055664976.db2.gz CADAOUJXAUWMAI-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1c(C[N@H+]2Cc3ccccc3[C@H](C)C2)ccc(F)c1F ZINC001238466833 1055665358 /nfs/dbraw/zinc/66/53/58/1055665358.db2.gz MWEVVIQLTRXNGX-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(C[N@@H+]2Cc3ccccc3[C@H](C)C2)ccc(F)c1F ZINC001238466833 1055665365 /nfs/dbraw/zinc/66/53/65/1055665365.db2.gz MWEVVIQLTRXNGX-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO CC(C)Oc1cncc(C[N@@H+]2CCc3c(Cl)cccc3C2)c1 ZINC001238471302 1055666077 /nfs/dbraw/zinc/66/60/77/1055666077.db2.gz NFEJQMJSPGZEJY-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO CC(C)Oc1cncc(C[N@H+]2CCc3c(Cl)cccc3C2)c1 ZINC001238471302 1055666086 /nfs/dbraw/zinc/66/60/86/1055666086.db2.gz NFEJQMJSPGZEJY-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO COc1c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)ccc(F)c1F ZINC001238466262 1055666551 /nfs/dbraw/zinc/66/65/51/1055666551.db2.gz GKLYYRIJDKTDMT-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)ccc(F)c1F ZINC001238466262 1055666563 /nfs/dbraw/zinc/66/65/63/1055666563.db2.gz GKLYYRIJDKTDMT-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1c(C[NH+]2CC3CC(C3)C2)cc(Cl)cc1C(F)(F)F ZINC001238497959 1055673999 /nfs/dbraw/zinc/67/39/99/1055673999.db2.gz HLIYTDIROGCTFC-UHFFFAOYSA-N 1 2 307.718 4.340 20 0 DIADLO Cc1c(Cl)ccc(C[N@H+](C)Cc2cnc3ccccn23)c1F ZINC001238511859 1055675953 /nfs/dbraw/zinc/67/59/53/1055675953.db2.gz IGUGZEHNJCIWGR-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Cc1c(Cl)ccc(C[N@@H+](C)Cc2cnc3ccccn23)c1F ZINC001238511859 1055675961 /nfs/dbraw/zinc/67/59/61/1055675961.db2.gz IGUGZEHNJCIWGR-UHFFFAOYSA-N 1 2 317.795 4.067 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@@H]2c2nccs2)cc1C1CC1 ZINC001238511341 1055676258 /nfs/dbraw/zinc/67/62/58/1055676258.db2.gz LBFIXAJRYMFZCD-MRXNPFEDSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@@H]2c2nccs2)cc1C1CC1 ZINC001238511341 1055676262 /nfs/dbraw/zinc/67/62/62/1055676262.db2.gz LBFIXAJRYMFZCD-MRXNPFEDSA-N 1 2 302.418 4.497 20 0 DIADLO CCC(C)(C)c1ccc(C[N@H+](C)Cc2nnc3ccccn32)cc1 ZINC000671683348 1055678163 /nfs/dbraw/zinc/67/81/63/1055678163.db2.gz ZCLFGRRUTGPXBB-UHFFFAOYSA-N 1 2 322.456 4.049 20 0 DIADLO CCC(C)(C)c1ccc(C[N@@H+](C)Cc2nnc3ccccn32)cc1 ZINC000671683348 1055678170 /nfs/dbraw/zinc/67/81/70/1055678170.db2.gz ZCLFGRRUTGPXBB-UHFFFAOYSA-N 1 2 322.456 4.049 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cc(C)ccc2Cl)c(OC)c1 ZINC001238568263 1055689426 /nfs/dbraw/zinc/68/94/26/1055689426.db2.gz DYTIJQSKPZHRMP-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cc(C)ccc2Cl)c(OC)c1 ZINC001238568263 1055689428 /nfs/dbraw/zinc/68/94/28/1055689428.db2.gz DYTIJQSKPZHRMP-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1c(F)cc(C)cc1OC ZINC001238593018 1055691401 /nfs/dbraw/zinc/69/14/01/1055691401.db2.gz FAPVRTAAZZWMKD-AWEZNQCLSA-N 1 2 317.404 4.344 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1c(F)cc(C)cc1OC ZINC001238593018 1055691406 /nfs/dbraw/zinc/69/14/06/1055691406.db2.gz FAPVRTAAZZWMKD-AWEZNQCLSA-N 1 2 317.404 4.344 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1c(F)cc(C)cc1OC ZINC001238593019 1055691487 /nfs/dbraw/zinc/69/14/87/1055691487.db2.gz FAPVRTAAZZWMKD-CQSZACIVSA-N 1 2 317.404 4.344 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1c(F)cc(C)cc1OC ZINC001238593019 1055691488 /nfs/dbraw/zinc/69/14/88/1055691488.db2.gz FAPVRTAAZZWMKD-CQSZACIVSA-N 1 2 317.404 4.344 20 0 DIADLO CC(C)Oc1cc(C[N@H+](C)Cc2ccccc2Cl)cnc1F ZINC001238591816 1055692469 /nfs/dbraw/zinc/69/24/69/1055692469.db2.gz GINFOSYJNDQFPD-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO CC(C)Oc1cc(C[N@@H+](C)Cc2ccccc2Cl)cnc1F ZINC001238591816 1055692473 /nfs/dbraw/zinc/69/24/73/1055692473.db2.gz GINFOSYJNDQFPD-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3ccc(Cl)cc3C2)cnc1C1CC1 ZINC001238615684 1055697835 /nfs/dbraw/zinc/69/78/35/1055697835.db2.gz HMUGULLUQVEPJH-UHFFFAOYSA-N 1 2 312.844 4.479 20 0 DIADLO Cc1cc(C[N@H+]2CCc3ccc(Cl)cc3C2)cnc1C1CC1 ZINC001238615684 1055697842 /nfs/dbraw/zinc/69/78/42/1055697842.db2.gz HMUGULLUQVEPJH-UHFFFAOYSA-N 1 2 312.844 4.479 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cncs2)cnc1-c1ccccc1 ZINC001238616952 1055698048 /nfs/dbraw/zinc/69/80/48/1055698048.db2.gz HXUPHTPTXXXSSB-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cncs2)cnc1-c1ccccc1 ZINC001238616952 1055698052 /nfs/dbraw/zinc/69/80/52/1055698052.db2.gz HXUPHTPTXXXSSB-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2coc(-c3ccc(C)cc3)n2)c1 ZINC000043567738 1055702250 /nfs/dbraw/zinc/70/22/50/1055702250.db2.gz RGZDBJWACRTRTK-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2coc(-c3ccc(C)cc3)n2)c1 ZINC000043567738 1055702261 /nfs/dbraw/zinc/70/22/61/1055702261.db2.gz RGZDBJWACRTRTK-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3cc(Cl)ccc3C2)cnc1C1CC1 ZINC001238627188 1055704961 /nfs/dbraw/zinc/70/49/61/1055704961.db2.gz HRBHCVIXCAHISX-UHFFFAOYSA-N 1 2 312.844 4.479 20 0 DIADLO Cc1cc(C[N@H+]2CCc3cc(Cl)ccc3C2)cnc1C1CC1 ZINC001238627188 1055704966 /nfs/dbraw/zinc/70/49/66/1055704966.db2.gz HRBHCVIXCAHISX-UHFFFAOYSA-N 1 2 312.844 4.479 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@@H+]1CCCC[C@@](C)(F)C1 ZINC001238651787 1055708952 /nfs/dbraw/zinc/70/89/52/1055708952.db2.gz JZYSWDOYNZPLDC-MRXNPFEDSA-N 1 2 301.352 4.078 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@H+]1CCCC[C@@](C)(F)C1 ZINC001238651787 1055708963 /nfs/dbraw/zinc/70/89/63/1055708963.db2.gz JZYSWDOYNZPLDC-MRXNPFEDSA-N 1 2 301.352 4.078 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC001238653632 1055709136 /nfs/dbraw/zinc/70/91/36/1055709136.db2.gz MRCWLXWTJLJGIH-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC001238653632 1055709146 /nfs/dbraw/zinc/70/91/46/1055709146.db2.gz MRCWLXWTJLJGIH-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC001238653635 1055709375 /nfs/dbraw/zinc/70/93/75/1055709375.db2.gz MRCWLXWTJLJGIH-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC001238653635 1055709385 /nfs/dbraw/zinc/70/93/85/1055709385.db2.gz MRCWLXWTJLJGIH-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO COC(=O)c1ccoc1C[N@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000044089979 1055709438 /nfs/dbraw/zinc/70/94/38/1055709438.db2.gz RLXXNMKEICPGNG-LBPRGKRZSA-N 1 2 313.353 4.005 20 0 DIADLO COC(=O)c1ccoc1C[N@@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000044089979 1055709452 /nfs/dbraw/zinc/70/94/52/1055709452.db2.gz RLXXNMKEICPGNG-LBPRGKRZSA-N 1 2 313.353 4.005 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1cc(-c2ccccc2)cnc1F ZINC001238663534 1055711454 /nfs/dbraw/zinc/71/14/54/1055711454.db2.gz HAUKHEJDLMTEPP-UHFFFAOYSA-N 1 2 321.399 4.305 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1cc(-c2ccccc2)cnc1F ZINC001238663534 1055711459 /nfs/dbraw/zinc/71/14/59/1055711459.db2.gz HAUKHEJDLMTEPP-UHFFFAOYSA-N 1 2 321.399 4.305 20 0 DIADLO CC(C)(C)C(=O)Nc1ccc(Cl)cc1C[NH+]1CC2(CCC2)C1 ZINC001238665842 1055714980 /nfs/dbraw/zinc/71/49/80/1055714980.db2.gz HDJOAPQPABQXCX-UHFFFAOYSA-N 1 2 320.864 4.311 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1ccc2ccccc2c1)n1cc[nH+]c1 ZINC001538817357 1055726379 /nfs/dbraw/zinc/72/63/79/1055726379.db2.gz TZWRCGKZQXXIPW-GOSISDBHSA-N 1 2 307.397 4.262 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1ccc2ccccc2c1)n1cc[nH+]c1 ZINC001538817358 1055726769 /nfs/dbraw/zinc/72/67/69/1055726769.db2.gz TZWRCGKZQXXIPW-SFHVURJKSA-N 1 2 307.397 4.262 20 0 DIADLO CCCCCCc1ccc(CN2CCn3c[nH+]cc3C2)s1 ZINC001238704239 1055728253 /nfs/dbraw/zinc/72/82/53/1055728253.db2.gz VJGUTJQYHXSIFI-UHFFFAOYSA-N 1 2 303.475 4.083 20 0 DIADLO CC(C)c1ccc(C[N@@H+]2CCc3ccsc3C2)c(Cl)n1 ZINC001238728351 1055734956 /nfs/dbraw/zinc/73/49/56/1055734956.db2.gz PKAFDBXNBOZZTN-UHFFFAOYSA-N 1 2 306.862 4.478 20 0 DIADLO CC(C)c1ccc(C[N@H+]2CCc3ccsc3C2)c(Cl)n1 ZINC001238728351 1055734968 /nfs/dbraw/zinc/73/49/68/1055734968.db2.gz PKAFDBXNBOZZTN-UHFFFAOYSA-N 1 2 306.862 4.478 20 0 DIADLO CC(C)Oc1c(C[N@@H+]2CCc3ccccc3C2)ccc(F)c1F ZINC001238740964 1055737893 /nfs/dbraw/zinc/73/78/93/1055737893.db2.gz HTTDQFVKSYBQOF-UHFFFAOYSA-N 1 2 317.379 4.310 20 0 DIADLO CC(C)Oc1c(C[N@H+]2CCc3ccccc3C2)ccc(F)c1F ZINC001238740964 1055737904 /nfs/dbraw/zinc/73/79/04/1055737904.db2.gz HTTDQFVKSYBQOF-UHFFFAOYSA-N 1 2 317.379 4.310 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1cccnc1OCc1ccccc1 ZINC001238772656 1055747829 /nfs/dbraw/zinc/74/78/29/1055747829.db2.gz GJKKFBNJYNKQIR-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1cccnc1OCc1ccccc1 ZINC001238772656 1055747839 /nfs/dbraw/zinc/74/78/39/1055747839.db2.gz GJKKFBNJYNKQIR-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@H]2c2cccnc2)cc1Cl ZINC001238788219 1055752087 /nfs/dbraw/zinc/75/20/87/1055752087.db2.gz LJXYWIYTUMUJBF-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@H]2c2cccnc2)cc1Cl ZINC001238788219 1055752098 /nfs/dbraw/zinc/75/20/98/1055752098.db2.gz LJXYWIYTUMUJBF-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1)Cc1cc(OC(C)C)ncc1F ZINC001238798748 1055754917 /nfs/dbraw/zinc/75/49/17/1055754917.db2.gz JEFUHGQGTBTIIM-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1)Cc1cc(OC(C)C)ncc1F ZINC001238798748 1055754928 /nfs/dbraw/zinc/75/49/28/1055754928.db2.gz JEFUHGQGTBTIIM-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)cc1-c1ccc(C2CC2)cc1 ZINC001238838420 1055760830 /nfs/dbraw/zinc/76/08/30/1055760830.db2.gz QUXUOCFJJTUMOQ-UHFFFAOYSA-N 1 2 311.400 4.202 20 0 DIADLO Cc1cn2c(cccc2-c2ccnc(Oc3ccccc3)c2)[nH+]1 ZINC001238843380 1055764914 /nfs/dbraw/zinc/76/49/14/1055764914.db2.gz VNGCHSFHDJQMPH-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2csc(-c3ccco3)n2)oc1C ZINC000282195325 1055786942 /nfs/dbraw/zinc/78/69/42/1055786942.db2.gz NPXSAOQAKLJKGF-NSHDSACASA-N 1 2 302.399 4.464 20 0 DIADLO c1nc2ccccc2n1Cc1ccc(CNc2cccc[nH+]2)cc1 ZINC000057830540 1055790826 /nfs/dbraw/zinc/79/08/26/1055790826.db2.gz NYXFTFSRJZBIJP-UHFFFAOYSA-N 1 2 314.392 4.092 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(F)c(SC)c1 ZINC001238964459 1055805838 /nfs/dbraw/zinc/80/58/38/1055805838.db2.gz BNBOACHMMZTZQM-UHFFFAOYSA-N 1 2 314.385 4.409 20 0 DIADLO Cc1ccc(-c2ccc(OC(C)C)c(C(F)(F)F)c2)[nH+]c1N ZINC001239000552 1055817850 /nfs/dbraw/zinc/81/78/50/1055817850.db2.gz QYJBLMFUBUZQFW-UHFFFAOYSA-N 1 2 310.319 4.445 20 0 DIADLO C[C@H]1CCCC[C@H]1OCC[NH+](Cc1ccco1)Cc1ccco1 ZINC000058932470 1055820794 /nfs/dbraw/zinc/82/07/94/1055820794.db2.gz AHOWQXWCBVWERP-QFBILLFUSA-N 1 2 317.429 4.470 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ccco2)C[C@H]2CCCO2)c(Cl)c1 ZINC000060039298 1055828295 /nfs/dbraw/zinc/82/82/95/1055828295.db2.gz PBTQSYNURCKKLB-MRXNPFEDSA-N 1 2 323.795 4.253 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ccco2)C[C@H]2CCCO2)c(Cl)c1 ZINC000060039298 1055828301 /nfs/dbraw/zinc/82/83/01/1055828301.db2.gz PBTQSYNURCKKLB-MRXNPFEDSA-N 1 2 323.795 4.253 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)C(=O)CCC2CCCCC2)c1C ZINC000060216179 1055831298 /nfs/dbraw/zinc/83/12/98/1055831298.db2.gz QSRWQHAKOAFPRA-UHFFFAOYSA-N 1 2 318.461 4.026 20 0 DIADLO Cc1cc2[nH]ccc2c(-c2cc(Cl)cnc2OC(C)C)[nH+]1 ZINC001239310962 1055864078 /nfs/dbraw/zinc/86/40/78/1055864078.db2.gz WOBHNRVQHQDOLF-UHFFFAOYSA-N 1 2 301.777 4.374 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C1(c2ccccc2)CCCCCC1 ZINC001597683532 1055863975 /nfs/dbraw/zinc/86/39/75/1055863975.db2.gz GUHWBCHXDJPWDD-UHFFFAOYSA-N 1 2 322.452 4.351 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1CCCC(F)(F)C1 ZINC000282246990 1055872629 /nfs/dbraw/zinc/87/26/29/1055872629.db2.gz OCSRRUJPUKHXEQ-CYBMUJFWSA-N 1 2 319.355 4.149 20 0 DIADLO O=C(c1cccc(-c2cc[nH+]c(N3CCCC3)c2)c1)C(F)(F)F ZINC001239380186 1055882315 /nfs/dbraw/zinc/88/23/15/1055882315.db2.gz IPPVZGCYLOQJHQ-UHFFFAOYSA-N 1 2 320.314 4.094 20 0 DIADLO Cc1cn2c(cccc2-c2cccc(C(=O)C(F)(F)F)c2)[nH+]1 ZINC001239380615 1055884245 /nfs/dbraw/zinc/88/42/45/1055884245.db2.gz PADWXONUZGTWBR-UHFFFAOYSA-N 1 2 304.271 4.055 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1cccc2ccccc21 ZINC001239472175 1055898023 /nfs/dbraw/zinc/89/80/23/1055898023.db2.gz XBUYWSNGFKHUDG-UHFFFAOYSA-N 1 2 304.393 4.047 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2ccc(-c3ccccc3)cc2)cc1 ZINC001239493396 1055907585 /nfs/dbraw/zinc/90/75/85/1055907585.db2.gz LKAIINHLJVDOCU-HXUWFJFHSA-N 1 2 317.388 4.193 20 0 DIADLO C[C@@H]([NH2+]C1(c2c(F)cccc2F)CCC1)c1ccc(F)cn1 ZINC000624345605 1055912968 /nfs/dbraw/zinc/91/29/68/1055912968.db2.gz OINNAHPQQGGMRZ-LLVKDONJSA-N 1 2 306.331 4.229 20 0 DIADLO CCC[C@@H]1CCC[C@H]1C(=O)Nc1nc(C[NH+](CC)CC)cs1 ZINC001570869778 1055919657 /nfs/dbraw/zinc/91/96/57/1055919657.db2.gz XXIIXJBTIPOLHP-UKRRQHHQSA-N 1 2 323.506 4.140 20 0 DIADLO C[N@H+](Cc1cccs1)Cc1nn(-c2ccccc2)c2c1CCC2 ZINC000064555053 1055920884 /nfs/dbraw/zinc/92/08/84/1055920884.db2.gz FWFCKSMDNRGDFW-UHFFFAOYSA-N 1 2 323.465 4.055 20 0 DIADLO C[N@@H+](Cc1cccs1)Cc1nn(-c2ccccc2)c2c1CCC2 ZINC000064555053 1055920894 /nfs/dbraw/zinc/92/08/94/1055920894.db2.gz FWFCKSMDNRGDFW-UHFFFAOYSA-N 1 2 323.465 4.055 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](c2ccc(CC)cc2)C(C)C)no1 ZINC000064931573 1055931729 /nfs/dbraw/zinc/93/17/29/1055931729.db2.gz CLDFYIXRQPXFFL-IBGZPJMESA-N 1 2 315.461 4.462 20 0 DIADLO CC(C)Cc1ccc([C@H](C)C(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001539935255 1055936165 /nfs/dbraw/zinc/93/61/65/1055936165.db2.gz JAQKOPSEANLXAX-HNNXBMFYSA-N 1 2 321.424 4.275 20 0 DIADLO CC(C)(C)CC(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001539989754 1055949032 /nfs/dbraw/zinc/94/90/32/1055949032.db2.gz KYHWKIHWBCKQAZ-UHFFFAOYSA-N 1 2 312.413 4.228 20 0 DIADLO Cl/C=C(/Cl)C[N@@H+]1CCCSC[C@@H]1c1ccccc1 ZINC001620543153 1055964746 /nfs/dbraw/zinc/96/47/46/1055964746.db2.gz UGWWNODONMHYPV-KADHNRKRSA-N 1 2 302.270 4.486 20 0 DIADLO Cl/C=C(/Cl)C[N@H+]1CCCSC[C@@H]1c1ccccc1 ZINC001620543153 1055964751 /nfs/dbraw/zinc/96/47/51/1055964751.db2.gz UGWWNODONMHYPV-KADHNRKRSA-N 1 2 302.270 4.486 20 0 DIADLO CC(C)Oc1c(Cl)cccc1NCc1cccc2[nH+]ccn21 ZINC001620789033 1055965866 /nfs/dbraw/zinc/96/58/66/1055965866.db2.gz HFKXUBSJJPZDRQ-UHFFFAOYSA-N 1 2 315.804 4.387 20 0 DIADLO Cc1ccc2ccccc2c1-c1ccc(C[NH+]2CCOCC2)nc1 ZINC001239589504 1055967486 /nfs/dbraw/zinc/96/74/86/1055967486.db2.gz QFURARKVMAKKQU-UHFFFAOYSA-N 1 2 318.420 4.042 20 0 DIADLO c1cc(-c2ccc(C3CCCC3)cc2)cnc1C[NH+]1CCOCC1 ZINC001239593861 1055969081 /nfs/dbraw/zinc/96/90/81/1055969081.db2.gz MVFIJVMKYBLPGF-UHFFFAOYSA-N 1 2 322.452 4.238 20 0 DIADLO Brc1cc(CNc2c[nH+]cc3c2CCCC3)cs1 ZINC001621004164 1055970398 /nfs/dbraw/zinc/97/03/98/1055970398.db2.gz LRHCWCIASRCSCL-UHFFFAOYSA-N 1 2 323.259 4.397 20 0 DIADLO CC(C)Sc1nnc([C@H](C)[NH+](C)C)n1-c1ccc(Cl)cc1 ZINC000066316942 1055977141 /nfs/dbraw/zinc/97/71/41/1055977141.db2.gz MCZOMUZRUNRWQZ-NSHDSACASA-N 1 2 324.881 4.044 20 0 DIADLO CC(C)(C)n1cc(CNc2ccc(Nc3ccccc3)c[nH+]2)cn1 ZINC001621012047 1055978001 /nfs/dbraw/zinc/97/80/01/1055978001.db2.gz DPIZDDSBHYKGLK-UHFFFAOYSA-N 1 2 321.428 4.389 20 0 DIADLO FC(F)c1ccc(C[NH2+][C@H](c2ccco2)c2ccccc2)cn1 ZINC001620704383 1055983537 /nfs/dbraw/zinc/98/35/37/1055983537.db2.gz KCQCRUNJYIZBMP-KRWDZBQOSA-N 1 2 314.335 4.491 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccc(OCCC(C)C)cc1 ZINC001620812487 1056005551 /nfs/dbraw/zinc/00/55/51/1056005551.db2.gz KDRLBKNUAAMKTL-UHFFFAOYSA-N 1 2 301.434 4.330 20 0 DIADLO Cc1ccc2[nH+]c(NCc3cc(F)cc4cccnc43)[nH]c2c1 ZINC001621045878 1056007400 /nfs/dbraw/zinc/00/74/00/1056007400.db2.gz LKFZTTSWCGRXOD-UHFFFAOYSA-N 1 2 306.344 4.171 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NC/C(C)=C\c1ccccc1 ZINC001621052023 1056010290 /nfs/dbraw/zinc/01/02/90/1056010290.db2.gz DCQTWEAODLIKMY-PEZBUJJGSA-N 1 2 321.424 4.198 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1ccc(-c2cc[nH]n2)o1 ZINC001621051611 1056010775 /nfs/dbraw/zinc/01/07/75/1056010775.db2.gz MCAFRGZWLJMKDF-UHFFFAOYSA-N 1 2 321.384 4.212 20 0 DIADLO CSc1ccc(C[NH2+]Cc2noc3c2CC(C)(C)CC3)s1 ZINC001621054226 1056013340 /nfs/dbraw/zinc/01/33/40/1056013340.db2.gz DXFQHLABMHEVGH-UHFFFAOYSA-N 1 2 322.499 4.263 20 0 DIADLO Fc1cc(CNc2[nH]c3ccc(Cl)cc3[nH+]2)cc(F)c1F ZINC001621056848 1056013766 /nfs/dbraw/zinc/01/37/66/1056013766.db2.gz GJHVGBIRWNCYIO-UHFFFAOYSA-N 1 2 311.694 4.246 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000072575194 1056029871 /nfs/dbraw/zinc/02/98/71/1056029871.db2.gz FOVVFMFPPPANPF-IAGOWNOFSA-N 1 2 317.477 4.112 20 0 DIADLO Cc1ccc(-c2cnc(C[NH2+]C3(c4ccccc4)CC3)o2)cc1 ZINC000072604882 1056030482 /nfs/dbraw/zinc/03/04/82/1056030482.db2.gz DEFYJXIYCXNBOO-UHFFFAOYSA-N 1 2 304.393 4.429 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000072558794 1056030519 /nfs/dbraw/zinc/03/05/19/1056030519.db2.gz XLRYRNOQPBHWOB-OAHLLOKOSA-N 1 2 305.809 4.087 20 0 DIADLO Cc1cccc([C@H](C)[N@H+](C)Cc2nccn2Cc2ccccc2)c1 ZINC000072774461 1056031946 /nfs/dbraw/zinc/03/19/46/1056031946.db2.gz RQQWNPADEODLKW-SFHVURJKSA-N 1 2 319.452 4.433 20 0 DIADLO Cc1cccc([C@H](C)[N@@H+](C)Cc2nccn2Cc2ccccc2)c1 ZINC000072774461 1056031958 /nfs/dbraw/zinc/03/19/58/1056031958.db2.gz RQQWNPADEODLKW-SFHVURJKSA-N 1 2 319.452 4.433 20 0 DIADLO Cc1cc(F)c(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)c(F)c1 ZINC001621331416 1056036323 /nfs/dbraw/zinc/03/63/23/1056036323.db2.gz KRBBBZCZKXDZHG-KGLIPLIRSA-N 1 2 320.210 4.289 20 0 DIADLO Cc1cc(F)c(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)c(F)c1 ZINC001621331416 1056036338 /nfs/dbraw/zinc/03/63/38/1056036338.db2.gz KRBBBZCZKXDZHG-KGLIPLIRSA-N 1 2 320.210 4.289 20 0 DIADLO CCCn1c[nH+]cc1CN1CC[C@@H](C)Sc2ccccc21 ZINC001621331172 1056036787 /nfs/dbraw/zinc/03/67/87/1056036787.db2.gz DAJDBKGJWUHFOZ-CQSZACIVSA-N 1 2 301.459 4.184 20 0 DIADLO CC[C@H](CC1CCCC1)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001583228324 1056042171 /nfs/dbraw/zinc/04/21/71/1056042171.db2.gz ATSNVNSJPKTJFL-OAHLLOKOSA-N 1 2 303.450 4.001 20 0 DIADLO CCC[C@@](C)(NC(=O)c1cc2c[nH+]ccc2[nH]1)c1ccccc1 ZINC001607230587 1056044873 /nfs/dbraw/zinc/04/48/73/1056044873.db2.gz OEQSPBCYSZCSRF-LJQANCHMSA-N 1 2 307.397 4.008 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000073778332 1056048483 /nfs/dbraw/zinc/04/84/83/1056048483.db2.gz FOHIJOWJLIOVFW-QGZVFWFLSA-N 1 2 321.852 4.408 20 0 DIADLO Cc1cc(F)ccc1-c1cc(F)cc(C)c1C[NH+]1CCOCC1 ZINC001239740504 1056049695 /nfs/dbraw/zinc/04/96/95/1056049695.db2.gz BIUFSQKAQIFYKL-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO Cc1cn2cc(-c3cncc(Oc4ccccc4)c3)ccc2[nH+]1 ZINC001239752199 1056059102 /nfs/dbraw/zinc/05/91/02/1056059102.db2.gz PVRXEFMGJYTSIB-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO CC(C)(C)c1ccc(C(=O)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC000039338920 1056060427 /nfs/dbraw/zinc/06/04/27/1056060427.db2.gz VJXIZERYRCBSDW-UHFFFAOYSA-N 1 2 319.408 4.422 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3CC[C@H](C)CC3)c2)[nH+]c1C ZINC001583354582 1056069919 /nfs/dbraw/zinc/06/99/19/1056069919.db2.gz GFMUYUZXRFCNPK-NNUKFRKNSA-N 1 2 311.429 4.458 20 0 DIADLO CCN(C(=O)[C@@H](CC(C)C)n1cc[nH+]c1)c1cc(C)cc(C)c1 ZINC001542201902 1056110454 /nfs/dbraw/zinc/11/04/54/1056110454.db2.gz FAWLHCJPHLDCDD-GOSISDBHSA-N 1 2 313.445 4.140 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@H]2COc3c2cccc3Cl)n1 ZINC000765802282 1056112975 /nfs/dbraw/zinc/11/29/75/1056112975.db2.gz KDKJIVMDTVXLCK-LBPRGKRZSA-N 1 2 322.861 4.317 20 0 DIADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cc(Cl)ccc1O ZINC000186353087 1056114904 /nfs/dbraw/zinc/11/49/04/1056114904.db2.gz FZJKPZCDGNOFNQ-LBPRGKRZSA-N 1 2 317.820 4.214 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cc(Cl)ccc1O ZINC000186353103 1056116959 /nfs/dbraw/zinc/11/69/59/1056116959.db2.gz FZJKPZCDGNOFNQ-GFCCVEGCSA-N 1 2 317.820 4.214 20 0 DIADLO Cc1cc(-c2ccc(C(=O)NCc3ccccc3)cc2)cc(C)[nH+]1 ZINC001239907750 1056149278 /nfs/dbraw/zinc/14/92/78/1056149278.db2.gz LPCYDAOPKDXRME-UHFFFAOYSA-N 1 2 316.404 4.295 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@H](C)c1cccnc1Cl)CCC2 ZINC000765812448 1056156986 /nfs/dbraw/zinc/15/69/86/1056156986.db2.gz AXYBMZCQHZBJRQ-DOMZBBRYSA-N 1 2 318.852 4.241 20 0 DIADLO Cc1cc(NC(=O)C[C@@H]2CCCC[C@@H]2C)ccc1-n1cc[nH+]c1 ZINC001542875781 1056161119 /nfs/dbraw/zinc/16/11/19/1056161119.db2.gz TYZGVQAVTGDVSL-HOCLYGCPSA-N 1 2 311.429 4.336 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3[nH]ccc3C3CC3)cc2)[nH+]c1C ZINC000921654447 1056166458 /nfs/dbraw/zinc/16/64/58/1056166458.db2.gz FJOAKMOXFKZWQU-UHFFFAOYSA-N 1 2 320.396 4.151 20 0 DIADLO CNc1ccc(Nc2cc(F)c(OC3CCC3)c(F)c2)c[nH+]1 ZINC001203462102 1056166920 /nfs/dbraw/zinc/16/69/20/1056166920.db2.gz JSWKALBGUFHBQM-UHFFFAOYSA-N 1 2 305.328 4.076 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@]3(C)C[C@H]4C[C@H]4C3)cc2)[nH+]c1C ZINC000921657671 1056169470 /nfs/dbraw/zinc/16/94/70/1056169470.db2.gz YDHGVYRYJIAFTR-CCWDJLKJSA-N 1 2 309.413 4.068 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3CCC(F)(F)C3)cc2)[nH+]c1C ZINC000921657783 1056169600 /nfs/dbraw/zinc/16/96/00/1056169600.db2.gz AUZISXWGIVYYBQ-CYBMUJFWSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C[C@H](C)n3cccc3)cc2)[nH+]c1C ZINC000921665178 1056174002 /nfs/dbraw/zinc/17/40/02/1056174002.db2.gz XJZJCCKXQMBZTQ-ZDUSSCGKSA-N 1 2 322.412 4.085 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3C[C@H]3c3ccco3)cc2)[nH+]c1C ZINC000921667885 1056178685 /nfs/dbraw/zinc/17/86/85/1056178685.db2.gz BFRJERKTFFXHDC-HZPDHXFCSA-N 1 2 321.380 4.029 20 0 DIADLO CCOc1ccc(Nc2ccccc2-n2cc[nH+]c2)c(OC)c1 ZINC001213118411 1056197082 /nfs/dbraw/zinc/19/70/82/1056197082.db2.gz YBOLXSFURQQRBK-UHFFFAOYSA-N 1 2 309.369 4.023 20 0 DIADLO CC(C)[N@H+](Cc1nc(C(C)(C)C)no1)Cc1cccc(Cl)c1 ZINC000061255054 1056205832 /nfs/dbraw/zinc/20/58/32/1056205832.db2.gz JCFBQXLKXLKXEV-UHFFFAOYSA-N 1 2 321.852 4.431 20 0 DIADLO CC(C)[N@@H+](Cc1nc(C(C)(C)C)no1)Cc1cccc(Cl)c1 ZINC000061255054 1056205847 /nfs/dbraw/zinc/20/58/47/1056205847.db2.gz JCFBQXLKXLKXEV-UHFFFAOYSA-N 1 2 321.852 4.431 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1ccc(C(F)F)cc1 ZINC000338675317 1056214474 /nfs/dbraw/zinc/21/44/74/1056214474.db2.gz DEKDJMHVPGPAHS-UHFFFAOYSA-N 1 2 313.307 4.062 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@H](C)c1cccc(F)c1F)CCC2 ZINC000765820012 1056215563 /nfs/dbraw/zinc/21/55/63/1056215563.db2.gz RWWXYVAYRIJFKC-MLGOLLRUSA-N 1 2 319.399 4.470 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)CCC2 ZINC000765820007 1056216192 /nfs/dbraw/zinc/21/61/92/1056216192.db2.gz RWWXYVAYRIJFKC-BLLLJJGKSA-N 1 2 319.399 4.470 20 0 DIADLO COc1c(C)cccc1C[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000655813355 1056230188 /nfs/dbraw/zinc/23/01/88/1056230188.db2.gz WHZYCZVLFAADQQ-ZDUSSCGKSA-N 1 2 304.459 4.434 20 0 DIADLO Cc1cc(NC[C@H](C)Cc2cccs2)nc(C2CCC2)[nH+]1 ZINC001612051051 1056230794 /nfs/dbraw/zinc/23/07/94/1056230794.db2.gz UIXYJHPNKSUZDU-GFCCVEGCSA-N 1 2 301.459 4.405 20 0 DIADLO Cc1cc(NC(=O)C=CCc2ccc(C(C)C)cc2)c(C)c[nH+]1 ZINC001584008921 1056234601 /nfs/dbraw/zinc/23/46/01/1056234601.db2.gz CIPYWRHIGKMNPV-AATRIKPKSA-N 1 2 308.425 4.286 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2CCC(C)(C)C[C@H]2c2ccccc2)cc[nH+]1 ZINC001584005458 1056234871 /nfs/dbraw/zinc/23/48/71/1056234871.db2.gz UHSXLGSDOLGBAL-MOPGFXCFSA-N 1 2 322.452 4.361 20 0 DIADLO Cc1ccc(C2CCN(c3cc(C)[nH+]c(C4CCC4)n3)CC2)cn1 ZINC001612177465 1056248828 /nfs/dbraw/zinc/24/88/28/1056248828.db2.gz FVWJCAXOEMVQOW-UHFFFAOYSA-N 1 2 322.456 4.140 20 0 DIADLO COc1cccc(C(C)(C)CNc2cc(C)[nH+]c(C3CC3)n2)c1 ZINC001612174275 1056249223 /nfs/dbraw/zinc/24/92/23/1056249223.db2.gz JSILVRFYBASLND-UHFFFAOYSA-N 1 2 311.429 4.061 20 0 DIADLO Cc1cc(Sc2ccccc2)ccc1NC(=O)Cc1c[nH]c[nH+]1 ZINC001543617575 1056267419 /nfs/dbraw/zinc/26/74/19/1056267419.db2.gz APANTGZQMRWWOQ-UHFFFAOYSA-N 1 2 323.421 4.051 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)N(c3cc(C)[nH+]c(C4CC4)n3)C2)cc1 ZINC001612322171 1056272351 /nfs/dbraw/zinc/27/23/51/1056272351.db2.gz WNMGNVTXYKSGES-YJBOKZPZSA-N 1 2 307.441 4.353 20 0 DIADLO COc1cc(C)ccc1Oc1ccccc1C[NH2+]Cc1ccon1 ZINC001620822517 1056273997 /nfs/dbraw/zinc/27/39/97/1056273997.db2.gz HZJLGYJCDWFKTQ-UHFFFAOYSA-N 1 2 324.380 4.074 20 0 DIADLO CNc1cc(-c2ccc(C(=O)Nc3ccccc3)cc2)cc[nH+]1 ZINC001240048727 1056284137 /nfs/dbraw/zinc/28/41/37/1056284137.db2.gz RBQWURAEWFJSMT-UHFFFAOYSA-N 1 2 303.365 4.043 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2NCC(C)(C)C1=CCCC1 ZINC001612457399 1056290541 /nfs/dbraw/zinc/29/05/41/1056290541.db2.gz XADQCIXKRFWNFJ-UHFFFAOYSA-N 1 2 313.449 4.130 20 0 DIADLO Cc1cc(C)c(CNc2cc(Cl)nc(C3CCC3)n2)c[nH+]1 ZINC001612488467 1056297669 /nfs/dbraw/zinc/29/76/69/1056297669.db2.gz TVNJPGDKSNVZTG-UHFFFAOYSA-N 1 2 302.809 4.021 20 0 DIADLO CC(C)c1cc(N[C@H](C2CC2)[C@H]2CCCCO2)nc(C(C)C)[nH+]1 ZINC001612549148 1056303847 /nfs/dbraw/zinc/30/38/47/1056303847.db2.gz WUAFJPORLMRTMZ-SJLPKXTDSA-N 1 2 317.477 4.483 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccc(Cl)c(Cl)c2)cs1 ZINC000107716048 1056307570 /nfs/dbraw/zinc/30/75/70/1056307570.db2.gz KFVIANMWKOPSJB-UHFFFAOYSA-N 1 2 301.242 4.302 20 0 DIADLO CCc1cc(N[C@H](CCc2ccccc2)C(F)F)nc(CC)[nH+]1 ZINC001612615822 1056310637 /nfs/dbraw/zinc/31/06/37/1056310637.db2.gz JILYEKQBCTVLDJ-OAHLLOKOSA-N 1 2 319.399 4.280 20 0 DIADLO Cc1[nH+]c(C(C)(C)C)nc(N[C@@H]2CCNc3ccccc32)c1C ZINC001168640121 1056311514 /nfs/dbraw/zinc/31/15/14/1056311514.db2.gz GJSSJIRGZYQLIJ-MRXNPFEDSA-N 1 2 310.445 4.360 20 0 DIADLO CC(C)c1cc(N[C@H](c2ccccc2)[C@@H](C)O)nc(C(C)C)[nH+]1 ZINC001612656530 1056316679 /nfs/dbraw/zinc/31/66/79/1056316679.db2.gz DHXLOLKMVDXGJR-KDOFPFPSSA-N 1 2 313.445 4.257 20 0 DIADLO CC(C)CCO[C@@H]1CCN(c2cc(C(C)C)[nH+]c(C(C)C)n2)C1 ZINC001612661716 1056317333 /nfs/dbraw/zinc/31/73/33/1056317333.db2.gz RISQAJHJJKVGHV-MRXNPFEDSA-N 1 2 319.493 4.365 20 0 DIADLO Cc1nc(N[C@H]2c3ccccc3CC[C@@H]2F)c2c([nH+]1)CCCC2 ZINC001612807344 1056329618 /nfs/dbraw/zinc/32/96/18/1056329618.db2.gz SOXYSEPBXMSMJJ-WMZOPIPTSA-N 1 2 311.404 4.101 20 0 DIADLO CC[C@@H](Nc1[nH+]cnc2c1cnn2C)c1cccc2ccccc21 ZINC001612924688 1056338899 /nfs/dbraw/zinc/33/88/99/1056338899.db2.gz CGNFVMXOAPADEQ-QGZVFWFLSA-N 1 2 317.396 4.080 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2NC[C@@H]1CCC=CCCC1 ZINC001613052525 1056346991 /nfs/dbraw/zinc/34/69/91/1056346991.db2.gz SLRKDDSYEHQQLQ-CQSZACIVSA-N 1 2 313.449 4.130 20 0 DIADLO CC(C)(C)c1cc2ncnc(-c3ccc4[nH+]ccn4c3)c2s1 ZINC001240213422 1056370960 /nfs/dbraw/zinc/37/09/60/1056370960.db2.gz AEYDDTVYCJWMMK-UHFFFAOYSA-N 1 2 308.410 4.304 20 0 DIADLO FC(F)(F)c1nc2ccsc2c(-c2ccc3[nH+]ccn3c2)n1 ZINC001240215506 1056372763 /nfs/dbraw/zinc/37/27/63/1056372763.db2.gz ZUXFATCSRZBBIV-UHFFFAOYSA-N 1 2 320.299 4.025 20 0 DIADLO Fc1ncc(-c2ccc3[nH+]ccn3c2)cc1OCc1ccccc1 ZINC001240218372 1056375058 /nfs/dbraw/zinc/37/50/58/1056375058.db2.gz LSBRFEBCFHOUNW-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO c1cn2cc(-c3nccc4ccn(Cc5ccccc5)c43)ccc2[nH+]1 ZINC001240217591 1056376470 /nfs/dbraw/zinc/37/64/70/1056376470.db2.gz RNCFQQWRSBUCFY-UHFFFAOYSA-N 1 2 324.387 4.399 20 0 DIADLO Fc1cc(O[C@@H]2CCCCO2)ccc1-c1ccc2[nH+]ccn2c1 ZINC001240220546 1056378543 /nfs/dbraw/zinc/37/85/43/1056378543.db2.gz HGKNHSOPNXKGMD-GOSISDBHSA-N 1 2 312.344 4.046 20 0 DIADLO CCOc1cc(-c2ccc3[nH+]ccn3c2)cc(C(F)(F)F)c1 ZINC001240222032 1056378902 /nfs/dbraw/zinc/37/89/02/1056378902.db2.gz UZXRTXZTDCNXTB-UHFFFAOYSA-N 1 2 306.287 4.419 20 0 DIADLO CN(C)c1[nH+]cc(CSc2ccc(O)cc2)c2ccccc21 ZINC001613488904 1056383833 /nfs/dbraw/zinc/38/38/33/1056383833.db2.gz ZBUMKHKILRVEGR-UHFFFAOYSA-N 1 2 310.422 4.299 20 0 DIADLO FC(F)(F)c1ccc(-c2ccccc2Cn2cc[nH+]c2)cn1 ZINC001240269199 1056403238 /nfs/dbraw/zinc/40/32/38/1056403238.db2.gz ZIJJLBBIGMVELX-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000303733261 1056408584 /nfs/dbraw/zinc/40/85/84/1056408584.db2.gz FLDPZGVHYLLFIY-RTBURBONSA-N 1 2 317.379 4.489 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000303733261 1056408591 /nfs/dbraw/zinc/40/85/91/1056408591.db2.gz FLDPZGVHYLLFIY-RTBURBONSA-N 1 2 317.379 4.489 20 0 DIADLO FC(F)(F)c1cc(-c2ccccc2Cn2cc[nH+]c2)ccn1 ZINC001240340243 1056434181 /nfs/dbraw/zinc/43/41/81/1056434181.db2.gz PDATUTUOKMYWQQ-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO CC(C)[N@@H+]1CCC[C@H]1C(=O)Oc1c(Cl)ccc2ccccc21 ZINC001544494359 1056442891 /nfs/dbraw/zinc/44/28/91/1056442891.db2.gz MLLJZYDLSXAWPX-INIZCTEOSA-N 1 2 317.816 4.271 20 0 DIADLO CC(C)[N@H+]1CCC[C@H]1C(=O)Oc1c(Cl)ccc2ccccc21 ZINC001544494359 1056442898 /nfs/dbraw/zinc/44/28/98/1056442898.db2.gz MLLJZYDLSXAWPX-INIZCTEOSA-N 1 2 317.816 4.271 20 0 DIADLO CCC1(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)CCCCC1 ZINC001584948860 1056449435 /nfs/dbraw/zinc/44/94/35/1056449435.db2.gz RYOFXUZIKZEZEM-UHFFFAOYSA-N 1 2 311.429 4.480 20 0 DIADLO CCCCS[C@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001614764095 1056449789 /nfs/dbraw/zinc/44/97/89/1056449789.db2.gz QMSLGPGASFKGHP-CQSZACIVSA-N 1 2 317.458 4.041 20 0 DIADLO Cc1cc(Cn2c[nH+]c(C(C)(C)C)c2)ccc1Br ZINC001614787103 1056452454 /nfs/dbraw/zinc/45/24/54/1056452454.db2.gz HPIUEVORWUXUAS-UHFFFAOYSA-N 1 2 307.235 4.300 20 0 DIADLO CC(C)(C)c1cn(Cc2csc(-c3ccccc3F)n2)c[nH+]1 ZINC001614787029 1056452968 /nfs/dbraw/zinc/45/29/68/1056452968.db2.gz DRBGFPOAQDNHCF-UHFFFAOYSA-N 1 2 315.417 4.492 20 0 DIADLO C/C(=C/c1ccccc1)CN(C)C(=O)c1c(C)cc(C)[nH+]c1C ZINC001584967532 1056453133 /nfs/dbraw/zinc/45/31/33/1056453133.db2.gz XUQXLLFCPLKSPW-KAMYIIQDSA-N 1 2 308.425 4.182 20 0 DIADLO COc1cccc2c(N[C@H]3CCCc4cccnc43)cc[nH+]c12 ZINC001168660666 1056456302 /nfs/dbraw/zinc/45/63/02/1056456302.db2.gz IXJUHPPVURFQSE-INIZCTEOSA-N 1 2 305.381 4.128 20 0 DIADLO Cc1cc(NC(=O)C(C)(C)C2CCCC2)ccc1-n1cc[nH+]c1 ZINC001614883756 1056456193 /nfs/dbraw/zinc/45/61/93/1056456193.db2.gz GGBUCKOSPQIKCX-UHFFFAOYSA-N 1 2 311.429 4.336 20 0 DIADLO Cc1c(F)cccc1NC(=O)C[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC001544583602 1056462199 /nfs/dbraw/zinc/46/21/99/1056462199.db2.gz MZZXSXICVGLQDD-OAHLLOKOSA-N 1 2 323.371 4.018 20 0 DIADLO C/C(=C\C(=O)NCc1c[nH+]c(C)cc1C)c1ccccc1Cl ZINC001585012255 1056463552 /nfs/dbraw/zinc/46/35/52/1056463552.db2.gz VXPURVGWUBHZID-UKTHLTGXSA-N 1 2 314.816 4.072 20 0 DIADLO Fc1cc(C(F)(F)F)ccc1-c1cc(-n2ccnc2)cc[nH+]1 ZINC001240395771 1056478033 /nfs/dbraw/zinc/47/80/33/1056478033.db2.gz JGPUDXWGEZRGHL-UHFFFAOYSA-N 1 2 307.250 4.092 20 0 DIADLO CCc1nc([C@H]2CCCC[N@@H+]2CC/C=C\c2ccccc2)no1 ZINC001615215636 1056478014 /nfs/dbraw/zinc/47/80/14/1056478014.db2.gz ZBLUAEKCFRQNQY-HMPQKADESA-N 1 2 311.429 4.263 20 0 DIADLO CCc1nc([C@H]2CCCC[N@H+]2CC/C=C\c2ccccc2)no1 ZINC001615215636 1056478023 /nfs/dbraw/zinc/47/80/23/1056478023.db2.gz ZBLUAEKCFRQNQY-HMPQKADESA-N 1 2 311.429 4.263 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[NH2+]Cc1cscn1 ZINC000172628610 1056478267 /nfs/dbraw/zinc/47/82/67/1056478267.db2.gz BJINBWDTKPTSSA-UHFFFAOYSA-N 1 2 312.438 4.373 20 0 DIADLO CN(Cc1ccoc1)c1cc[nH+]c2c(Br)cccc12 ZINC000338718918 1056481234 /nfs/dbraw/zinc/48/12/34/1056481234.db2.gz APNSFQHZLDKCFM-UHFFFAOYSA-N 1 2 317.186 4.227 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cc(Cl)ccc1OC)c1nccs1 ZINC000172672938 1056512866 /nfs/dbraw/zinc/51/28/66/1056512866.db2.gz KCDCFWQUNZSNBF-OAHLLOKOSA-N 1 2 310.850 4.220 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@H](CC)CC1 ZINC001615496973 1056520230 /nfs/dbraw/zinc/52/02/30/1056520230.db2.gz QBUJTFDCWDBSHV-YOEHRIQHSA-N 1 2 323.864 4.456 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H](CC)CC1 ZINC001615496973 1056520244 /nfs/dbraw/zinc/52/02/44/1056520244.db2.gz QBUJTFDCWDBSHV-YOEHRIQHSA-N 1 2 323.864 4.456 20 0 DIADLO CC(C)[C@H]1CCCC[N@@H+]1Cc1c(F)c(F)c(F)c(F)c1F ZINC001615519708 1056526606 /nfs/dbraw/zinc/52/66/06/1056526606.db2.gz MCIKIJYGUPWFOB-SNVBAGLBSA-N 1 2 307.306 4.393 20 0 DIADLO CC(C)[C@H]1CCCC[N@H+]1Cc1c(F)c(F)c(F)c(F)c1F ZINC001615519708 1056526621 /nfs/dbraw/zinc/52/66/21/1056526621.db2.gz MCIKIJYGUPWFOB-SNVBAGLBSA-N 1 2 307.306 4.393 20 0 DIADLO CC[C@H]1C[N@H+](CCc2c(Cl)cccc2Cl)C[C@@H](C)O1 ZINC001615535385 1056529766 /nfs/dbraw/zinc/52/97/66/1056529766.db2.gz DNSLHXRWLQZNPB-NEPJUHHUSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)C[C@@H](C)O1 ZINC001615535385 1056529779 /nfs/dbraw/zinc/52/97/79/1056529779.db2.gz DNSLHXRWLQZNPB-NEPJUHHUSA-N 1 2 302.245 4.035 20 0 DIADLO CC(C)CC(CC(C)C)NC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001585346416 1056533366 /nfs/dbraw/zinc/53/33/66/1056533366.db2.gz HRYPDSQRJKYWGZ-KRWDZBQOSA-N 1 2 307.482 4.047 20 0 DIADLO c1cn2ccc(-c3nccc(SCc4ccccc4)n3)cc2[nH+]1 ZINC001240504085 1056541905 /nfs/dbraw/zinc/54/19/05/1056541905.db2.gz XWRKUFNMFYHCPP-UHFFFAOYSA-N 1 2 318.405 4.084 20 0 DIADLO COC(=O)c1cc2ccc(-c3ccn4cc[nH+]c4c3)cc2s1 ZINC001240508750 1056544976 /nfs/dbraw/zinc/54/49/76/1056544976.db2.gz JUAFDFVYUBRGPK-UHFFFAOYSA-N 1 2 308.362 4.003 20 0 DIADLO Fc1ccccc1COc1ccc(-c2ccn3cc[nH+]c3c2)cn1 ZINC001240513434 1056546880 /nfs/dbraw/zinc/54/68/80/1056546880.db2.gz RWVJARHDKKLMMX-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO Fc1ccc(COc2ccc(-c3ccn4cc[nH+]c4c3)cn2)cc1 ZINC001240513653 1056547629 /nfs/dbraw/zinc/54/76/29/1056547629.db2.gz YAZHPHKKQANADX-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO c1cc2cc(NCc3csc(-c4ccccc4)n3)[nH+]cc2[nH]1 ZINC000672157676 1056552063 /nfs/dbraw/zinc/55/20/63/1056552063.db2.gz NDXKXPOUFIABOI-UHFFFAOYSA-N 1 2 306.394 4.299 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]CC(=O)c1ccccc1F ZINC001168685540 1056553150 /nfs/dbraw/zinc/55/31/50/1056553150.db2.gz LCBFNOZHEJLFID-CQSZACIVSA-N 1 2 315.388 4.146 20 0 DIADLO Cc1cc(N[C@H](Cc2ccccc2)c2ncco2)nc(C2CC2)[nH+]1 ZINC000656229807 1056555297 /nfs/dbraw/zinc/55/52/97/1056555297.db2.gz DLCCKFMPWKYZPT-MRXNPFEDSA-N 1 2 320.396 4.046 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@@H](C)c1nc(-c2ccccc2C)no1 ZINC000074990007 1056558715 /nfs/dbraw/zinc/55/87/15/1056558715.db2.gz GRSRAKFECLBUED-AWEZNQCLSA-N 1 2 311.385 4.221 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@@H](C)c1nc(-c2ccccc2C)no1 ZINC000074990007 1056558726 /nfs/dbraw/zinc/55/87/26/1056558726.db2.gz GRSRAKFECLBUED-AWEZNQCLSA-N 1 2 311.385 4.221 20 0 DIADLO CCCOc1cccc(C[N@H+]2CCOC[C@@H]2c2ccccc2)c1 ZINC001615665054 1056559917 /nfs/dbraw/zinc/55/99/17/1056559917.db2.gz IWJCORUGXLXAMD-HXUWFJFHSA-N 1 2 311.425 4.049 20 0 DIADLO CCCOc1cccc(C[N@@H+]2CCOC[C@@H]2c2ccccc2)c1 ZINC001615665054 1056559906 /nfs/dbraw/zinc/55/99/06/1056559906.db2.gz IWJCORUGXLXAMD-HXUWFJFHSA-N 1 2 311.425 4.049 20 0 DIADLO CC[C@H]1CN(Cc2ccc(-n3cc[nH+]c3)cc2)c2ccccc2O1 ZINC001615679227 1056565168 /nfs/dbraw/zinc/56/51/68/1056565168.db2.gz SRWZGJDZDQYTIM-SFHVURJKSA-N 1 2 319.408 4.050 20 0 DIADLO Clc1cccc2c(N3CCO[C@H](c4ccco4)C3)cc[nH+]c12 ZINC000672232754 1056578095 /nfs/dbraw/zinc/57/80/95/1056578095.db2.gz CPGNKRQNGQUQSB-INIZCTEOSA-N 1 2 314.772 4.059 20 0 DIADLO OCc1ccc(CCNc2cc[nH+]c3c(Cl)cccc23)cc1 ZINC000672246936 1056586888 /nfs/dbraw/zinc/58/68/88/1056586888.db2.gz PPQWPDHPMCVFEW-UHFFFAOYSA-N 1 2 312.800 4.035 20 0 DIADLO COC[C@@H]1CCCCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000672252732 1056593879 /nfs/dbraw/zinc/59/38/79/1056593879.db2.gz LXWWYLQRKXGFSD-CYBMUJFWSA-N 1 2 304.821 4.141 20 0 DIADLO C[N@H+](CCCOc1ccc(C(C)(C)C)cc1)Cc1cscn1 ZINC000063590832 1056597096 /nfs/dbraw/zinc/59/70/96/1056597096.db2.gz XEUWBDFZEQYDGO-UHFFFAOYSA-N 1 2 318.486 4.342 20 0 DIADLO C[N@@H+](CCCOc1ccc(C(C)(C)C)cc1)Cc1cscn1 ZINC000063590832 1056597113 /nfs/dbraw/zinc/59/71/13/1056597113.db2.gz XEUWBDFZEQYDGO-UHFFFAOYSA-N 1 2 318.486 4.342 20 0 DIADLO Cc1cc(OCC[N@H+](C)Cc2cscn2)ccc1C(C)C ZINC000063590411 1056597452 /nfs/dbraw/zinc/59/74/52/1056597452.db2.gz KYEQPTANRHGPOV-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO Cc1cc(OCC[N@@H+](C)Cc2cscn2)ccc1C(C)C ZINC000063590411 1056597464 /nfs/dbraw/zinc/59/74/64/1056597464.db2.gz KYEQPTANRHGPOV-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ncc(-c3ccc(F)cc3)o2)s1 ZINC000076342443 1056622662 /nfs/dbraw/zinc/62/26/62/1056622662.db2.gz XHFCBVCGVKSUDA-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ncc(-c3ccc(F)cc3)o2)s1 ZINC000076342443 1056622672 /nfs/dbraw/zinc/62/26/72/1056622672.db2.gz XHFCBVCGVKSUDA-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)C=C[C@]1(C)CC[C@H](C)C1(C)C ZINC001616247031 1056623948 /nfs/dbraw/zinc/62/39/48/1056623948.db2.gz PNOHUDRGONLKGG-WIPDZMNHSA-N 1 2 300.446 4.077 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2csc(C(C)C)n2)cc1 ZINC000076429584 1056625586 /nfs/dbraw/zinc/62/55/86/1056625586.db2.gz YIRRSCFBNHJKBP-CYBMUJFWSA-N 1 2 304.459 4.468 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2csc(C(C)C)n2)cc1 ZINC000076429584 1056625591 /nfs/dbraw/zinc/62/55/91/1056625591.db2.gz YIRRSCFBNHJKBP-CYBMUJFWSA-N 1 2 304.459 4.468 20 0 DIADLO C[C@@]1(c2ccccc2)C[N@H+](Cc2nsc3ccccc32)CCO1 ZINC001616308752 1056631552 /nfs/dbraw/zinc/63/15/52/1056631552.db2.gz KAPSPEZNZNSDSM-IBGZPJMESA-N 1 2 324.449 4.044 20 0 DIADLO C[C@@]1(c2ccccc2)C[N@@H+](Cc2nsc3ccccc32)CCO1 ZINC001616308752 1056631559 /nfs/dbraw/zinc/63/15/59/1056631559.db2.gz KAPSPEZNZNSDSM-IBGZPJMESA-N 1 2 324.449 4.044 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cnn([C@H]3CCCCO3)c2)c1 ZINC001240681822 1056638046 /nfs/dbraw/zinc/63/80/46/1056638046.db2.gz PZZMTXAHAJDLJX-LJQANCHMSA-N 1 2 313.445 4.404 20 0 DIADLO Fc1ccc2c(c1F)C[N@@H+](CCOC1CCCCCC1)CC2 ZINC001616346551 1056639172 /nfs/dbraw/zinc/63/91/72/1056639172.db2.gz KXCXDSRAEVVTSL-UHFFFAOYSA-N 1 2 309.400 4.062 20 0 DIADLO Fc1ccc2c(c1F)C[N@H+](CCOC1CCCCCC1)CC2 ZINC001616346551 1056639177 /nfs/dbraw/zinc/63/91/77/1056639177.db2.gz KXCXDSRAEVVTSL-UHFFFAOYSA-N 1 2 309.400 4.062 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc(C(F)F)c1 ZINC001240694115 1056645515 /nfs/dbraw/zinc/64/55/15/1056645515.db2.gz MVYAYNWAKAGXKH-UHFFFAOYSA-N 1 2 300.308 4.486 20 0 DIADLO CCCCOC(=O)[C@H](C)[NH2+][C@@H](CC)C(C)(C)c1ccccc1 ZINC001616645834 1056693901 /nfs/dbraw/zinc/69/39/01/1056693901.db2.gz NICRJEFUHRAVBY-RDJZCZTQSA-N 1 2 305.462 4.064 20 0 DIADLO COc1ccc(C(F)(F)F)cc1-c1cc(C)c2[nH+]ccn2c1 ZINC001240825672 1056719598 /nfs/dbraw/zinc/71/95/98/1056719598.db2.gz AVGRXMLTWCXZAD-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1c(Cl)n[nH]c1C1CC1 ZINC000922014186 1056734693 /nfs/dbraw/zinc/73/46/93/1056734693.db2.gz AOGYDLYCBYFASM-UHFFFAOYSA-N 1 2 314.191 4.023 20 0 DIADLO Cc1cc(NC(=O)[C@@H](CC(C)C)n2cc[nH+]c2)ccc1C1CC1 ZINC001616912525 1056736285 /nfs/dbraw/zinc/73/62/85/1056736285.db2.gz JRAQJRRMYHJRFT-GOSISDBHSA-N 1 2 311.429 4.295 20 0 DIADLO COc1ccc2c(c1)[C@H]([NH2+][C@H]1CCCC1(F)F)CCCS2 ZINC000672619992 1056738973 /nfs/dbraw/zinc/73/89/73/1056738973.db2.gz HHHWJYYGSGZYCR-HIFRSBDPSA-N 1 2 313.413 4.400 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H]2CCCC2(F)F)ccc1OC(F)F ZINC000672621699 1056741278 /nfs/dbraw/zinc/74/12/78/1056741278.db2.gz DZYSIINMFGHMOP-TVQRCGJNSA-N 1 2 321.314 4.135 20 0 DIADLO C[C@H]1CCCC[C@@H]1OCC[N@@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001616935967 1056743749 /nfs/dbraw/zinc/74/37/49/1056743749.db2.gz WDTXECOSDWYHAE-YWZLYKJASA-N 1 2 312.457 4.121 20 0 DIADLO C[C@H]1CCCC[C@@H]1OCC[N@H+]1CCc2c3ccccc3[nH]c2C1 ZINC001616935967 1056743757 /nfs/dbraw/zinc/74/37/57/1056743757.db2.gz WDTXECOSDWYHAE-YWZLYKJASA-N 1 2 312.457 4.121 20 0 DIADLO FC(F)[C@@H]1CCC[N@@H+]1CCCOc1ccc2ccccc2c1 ZINC001616950511 1056745682 /nfs/dbraw/zinc/74/56/82/1056745682.db2.gz FCKJOQWOBFXSME-KRWDZBQOSA-N 1 2 305.368 4.338 20 0 DIADLO FC(F)[C@@H]1CCC[N@H+]1CCCOc1ccc2ccccc2c1 ZINC001616950511 1056745692 /nfs/dbraw/zinc/74/56/92/1056745692.db2.gz FCKJOQWOBFXSME-KRWDZBQOSA-N 1 2 305.368 4.338 20 0 DIADLO Cc1coc2ccc(NC(=O)[C@H](CC(C)C)n3cc[nH+]c3)cc12 ZINC001616954112 1056745934 /nfs/dbraw/zinc/74/59/34/1056745934.db2.gz DLZMBLIHVDOCCO-INIZCTEOSA-N 1 2 311.385 4.164 20 0 DIADLO Cc1ccc(F)cc1-c1ccc(-c2nc3c(o2)CC[N@@H+](C)C3)cc1 ZINC001240921804 1056760331 /nfs/dbraw/zinc/76/03/31/1056760331.db2.gz LUQJXDGWSSHCNC-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO Cc1ccc(F)cc1-c1ccc(-c2nc3c(o2)CC[N@H+](C)C3)cc1 ZINC001240921804 1056760342 /nfs/dbraw/zinc/76/03/42/1056760342.db2.gz LUQJXDGWSSHCNC-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO CCCNc1ccc(C[NH2+]Cc2nc(C(C)(C)C)co2)cc1 ZINC000922061356 1056771402 /nfs/dbraw/zinc/77/14/02/1056771402.db2.gz OMLMBYSWTZKPSP-UHFFFAOYSA-N 1 2 301.434 4.084 20 0 DIADLO CCC[N@H+](CC(=O)OC(C)(C)C)[C@@H](C)c1ccc(F)c(F)c1 ZINC001617082261 1056773336 /nfs/dbraw/zinc/77/33/36/1056773336.db2.gz WUCJBHKEIYONDQ-LBPRGKRZSA-N 1 2 313.388 4.080 20 0 DIADLO CCC[N@@H+](CC(=O)OC(C)(C)C)[C@@H](C)c1ccc(F)c(F)c1 ZINC001617082261 1056773344 /nfs/dbraw/zinc/77/33/44/1056773344.db2.gz WUCJBHKEIYONDQ-LBPRGKRZSA-N 1 2 313.388 4.080 20 0 DIADLO Cc1c[nH]c2ncc(-c3c[nH+]c(N4CCCCC4)cc3C)cc12 ZINC001240957118 1056782859 /nfs/dbraw/zinc/78/28/59/1056782859.db2.gz GUDOZWWQJJCSBZ-UHFFFAOYSA-N 1 2 306.413 4.232 20 0 DIADLO CC(C)c1ccc2c(c1)[C@@H](NC(=O)c1cc3c[nH+]ccc3[nH]1)CC2 ZINC001617186947 1056789025 /nfs/dbraw/zinc/78/90/25/1056789025.db2.gz PRPUGQYLWKJPAB-SFHVURJKSA-N 1 2 319.408 4.104 20 0 DIADLO CO[C@@H](CC(C)C)C[N@@H+]1CCn2c(cc3cc(Cl)ccc32)C1 ZINC001617207218 1056793449 /nfs/dbraw/zinc/79/34/49/1056793449.db2.gz OJAWFYDMAXKXKP-KRWDZBQOSA-N 1 2 320.864 4.171 20 0 DIADLO CO[C@@H](CC(C)C)C[N@H+]1CCn2c(cc3cc(Cl)ccc32)C1 ZINC001617207218 1056793463 /nfs/dbraw/zinc/79/34/63/1056793463.db2.gz OJAWFYDMAXKXKP-KRWDZBQOSA-N 1 2 320.864 4.171 20 0 DIADLO CC(C)(C)c1ccc(/C=C/C(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001586808502 1056809543 /nfs/dbraw/zinc/80/95/43/1056809543.db2.gz MFTKIUISDWPUBX-IZZDOVSWSA-N 1 2 319.408 4.284 20 0 DIADLO CC(C)(C)c1ccc(/C=C\C(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001586808504 1056809827 /nfs/dbraw/zinc/80/98/27/1056809827.db2.gz MFTKIUISDWPUBX-WDZFZDKYSA-N 1 2 319.408 4.284 20 0 DIADLO CCOc1cc(F)cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1 ZINC001241026651 1056827587 /nfs/dbraw/zinc/82/75/87/1056827587.db2.gz MNYSQULLWMQKBL-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO Cc1cc(-c2ccc(OCc3ccccc3)c(F)c2)c[nH+]c1N ZINC001241039879 1056838156 /nfs/dbraw/zinc/83/81/56/1056838156.db2.gz GWSMVKSDRVKDEZ-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@H](C)c2ccccc2C(F)(F)F)n1 ZINC000114750104 1056872974 /nfs/dbraw/zinc/87/29/74/1056872974.db2.gz LLEMRHMETUKOCO-ZJUUUORDSA-N 1 2 313.323 4.063 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@H](C)c2ccccc2C(F)(F)F)n1 ZINC000114750102 1056873030 /nfs/dbraw/zinc/87/30/30/1056873030.db2.gz LLEMRHMETUKOCO-NXEZZACHSA-N 1 2 313.323 4.063 20 0 DIADLO COc1ccc(-c2ccc3[nH+]c(C)cn3c2)cc1C(F)(F)F ZINC001241090874 1056881740 /nfs/dbraw/zinc/88/17/40/1056881740.db2.gz IAYITUPAFMQZLB-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001241098103 1056890848 /nfs/dbraw/zinc/89/08/48/1056890848.db2.gz VXFHACSBZHIDPF-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO C[C@@H](C[N@@H+]1CCOC[C@@H]1c1ccco1)c1cccc(Cl)c1 ZINC000682155332 1056890791 /nfs/dbraw/zinc/89/07/91/1056890791.db2.gz ULWDIJUDQITHFC-XJKSGUPXSA-N 1 2 305.805 4.110 20 0 DIADLO C[C@@H](C[N@H+]1CCOC[C@@H]1c1ccco1)c1cccc(Cl)c1 ZINC000682155332 1056890797 /nfs/dbraw/zinc/89/07/97/1056890797.db2.gz ULWDIJUDQITHFC-XJKSGUPXSA-N 1 2 305.805 4.110 20 0 DIADLO Fc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)c(C(F)(F)F)c1 ZINC001241123987 1056908873 /nfs/dbraw/zinc/90/88/73/1056908873.db2.gz FPNOOGDHEMAUHQ-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO C[C@@H](C[NH2+][C@H](c1ccccc1)C(F)F)COCc1ccccc1 ZINC001618083847 1056922292 /nfs/dbraw/zinc/92/22/92/1056922292.db2.gz GHUKCMFQMZKBJO-MAUKXSAKSA-N 1 2 319.395 4.435 20 0 DIADLO C[C@H](C[NH2+][C@@H](c1ccccc1)C(F)F)COCc1ccccc1 ZINC001618083848 1056922544 /nfs/dbraw/zinc/92/25/44/1056922544.db2.gz GHUKCMFQMZKBJO-QAPCUYQASA-N 1 2 319.395 4.435 20 0 DIADLO COc1ccc(F)c(-c2c[nH+]c(N3CCCCC3)cc2C)c1F ZINC001241141884 1056922734 /nfs/dbraw/zinc/92/27/34/1056922734.db2.gz IKDVHLLMUCYHGO-UHFFFAOYSA-N 1 2 318.367 4.334 20 0 DIADLO Clc1sccc1C[NH2+][C@H]1COc2c1cccc2Cl ZINC000682943941 1056926369 /nfs/dbraw/zinc/92/63/69/1056926369.db2.gz YRGGKBUUHTZDER-NSHDSACASA-N 1 2 300.210 4.278 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cccnc2OC(C)(C)C)cc1F ZINC001241152172 1056929194 /nfs/dbraw/zinc/92/91/94/1056929194.db2.gz ORJMIGRLCOQHSP-UHFFFAOYSA-N 1 2 320.383 4.266 20 0 DIADLO COc1cc([C@H](C)[NH2+]Cc2csc(C3CCCC3)n2)ccn1 ZINC000347693792 1056932289 /nfs/dbraw/zinc/93/22/89/1056932289.db2.gz ZKERAGRSQWMILU-LBPRGKRZSA-N 1 2 317.458 4.055 20 0 DIADLO Cc1cc(-c2cc(F)cc(OCc3ccccc3)c2)c[nH+]c1N ZINC001241160536 1056935686 /nfs/dbraw/zinc/93/56/86/1056935686.db2.gz NQUUZUGEYZXTKH-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO Cc1ccccc1NC(=O)c1c(C)cccc1-c1cc[nH+]c(N)c1 ZINC001241163379 1056938408 /nfs/dbraw/zinc/93/84/08/1056938408.db2.gz NSGHAMBMGGNEGU-UHFFFAOYSA-N 1 2 317.392 4.200 20 0 DIADLO c1ccc([C@H]2CSCC[N@H+]2Cc2nc3ccccc3o2)cc1 ZINC000115561302 1056940842 /nfs/dbraw/zinc/94/08/42/1056940842.db2.gz HFYYHNGIBKEZIZ-MRXNPFEDSA-N 1 2 310.422 4.118 20 0 DIADLO c1ccc([C@H]2CSCC[N@@H+]2Cc2nc3ccccc3o2)cc1 ZINC000115561302 1056940854 /nfs/dbraw/zinc/94/08/54/1056940854.db2.gz HFYYHNGIBKEZIZ-MRXNPFEDSA-N 1 2 310.422 4.118 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)CC(=O)c1ccccc1F ZINC001618273044 1056942878 /nfs/dbraw/zinc/94/28/78/1056942878.db2.gz FEASHTUHVZZJDF-KRWDZBQOSA-N 1 2 315.388 4.100 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)CC(=O)c1ccccc1F ZINC001618273044 1056942887 /nfs/dbraw/zinc/94/28/87/1056942887.db2.gz FEASHTUHVZZJDF-KRWDZBQOSA-N 1 2 315.388 4.100 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1ccc(C(C)(C)C)cc1)n1cc[nH+]c1 ZINC001618299278 1056946601 /nfs/dbraw/zinc/94/66/01/1056946601.db2.gz NRJKYGUAJGYPGB-QGZVFWFLSA-N 1 2 313.445 4.407 20 0 DIADLO CCOc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)c(F)c1F ZINC001241178738 1056948383 /nfs/dbraw/zinc/94/83/83/1056948383.db2.gz FDTAJRIALAJJCH-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO C/C(=C\C=C\[NH3+])c1c(F)ccc(OCc2ccccc2)c1F ZINC001241195226 1056952852 /nfs/dbraw/zinc/95/28/52/1056952852.db2.gz QBFUSBSPUXVXCX-LRPJOWSMSA-N 1 2 301.336 4.420 20 0 DIADLO CCOc1cc(C)c(-c2ccc(Cn3cc[nH+]c3)cn2)c(C)c1 ZINC001241200665 1056956075 /nfs/dbraw/zinc/95/60/75/1056956075.db2.gz RDOXCQOBMKGMDW-UHFFFAOYSA-N 1 2 307.397 4.009 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(Cl)c(F)c1 ZINC001241232510 1056971195 /nfs/dbraw/zinc/97/11/95/1056971195.db2.gz JAMYHPSETASOAH-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cc2c(nn1)CC[C@H](C(C)(C)C)C2 ZINC001241240057 1056975083 /nfs/dbraw/zinc/97/50/83/1056975083.db2.gz HZWFOSVVTPHWBW-HNNXBMFYSA-N 1 2 324.472 4.064 20 0 DIADLO CCc1ccc(-c2ccc(-c3c[nH+]c(N(C)C)cc3C)nn2)cc1 ZINC001241240087 1056975250 /nfs/dbraw/zinc/97/52/50/1056975250.db2.gz JHBWDYDDZTXJMK-UHFFFAOYSA-N 1 2 318.424 4.142 20 0 DIADLO CCOc1ccc(OC)cc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001241239864 1056975671 /nfs/dbraw/zinc/97/56/71/1056975671.db2.gz JHEFGEVOPYHHKL-UHFFFAOYSA-N 1 2 308.381 4.161 20 0 DIADLO CCCCOc1cc(F)ccc1-c1c[nH+]c(N(C)C)cc1C ZINC001241242479 1056976705 /nfs/dbraw/zinc/97/67/05/1056976705.db2.gz DNTAMZCGUDUHMT-UHFFFAOYSA-N 1 2 302.393 4.441 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cc(C(F)(F)F)c2c(n1)CCC2 ZINC001241242840 1056977691 /nfs/dbraw/zinc/97/76/91/1056977691.db2.gz ARCYVWLUWATFGU-UHFFFAOYSA-N 1 2 321.346 4.026 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc2[nH]c(C(F)(F)F)nc2c1 ZINC001241243492 1056978069 /nfs/dbraw/zinc/97/80/69/1056978069.db2.gz IBJOBPJNQWMQHT-UHFFFAOYSA-N 1 2 320.318 4.018 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC001241243492 1056978073 /nfs/dbraw/zinc/97/80/73/1056978073.db2.gz IBJOBPJNQWMQHT-UHFFFAOYSA-N 1 2 320.318 4.018 20 0 DIADLO Nc1cn2ccc(-c3ccc(C(F)(F)F)c(Cl)c3)cc2[nH+]1 ZINC001241288632 1056999125 /nfs/dbraw/zinc/99/91/25/1056999125.db2.gz XJFQDDHTBVHMRQ-UHFFFAOYSA-N 1 2 311.694 4.256 20 0 DIADLO O=C(Nc1cccc(C(F)F)c1)c1cccc(-n2cc[nH+]c2)c1 ZINC000117642771 1057003945 /nfs/dbraw/zinc/00/39/45/1057003945.db2.gz DLQKTMIOHILBNY-UHFFFAOYSA-N 1 2 313.307 4.062 20 0 DIADLO CCOc1ccc(F)c(F)c1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001241308017 1057007548 /nfs/dbraw/zinc/00/75/48/1057007548.db2.gz FUGVPLFNMUKYFF-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1ccnn1C1CCC1 ZINC000922328663 1057009502 /nfs/dbraw/zinc/00/95/02/1057009502.db2.gz LAZXRZMJVNYBKO-UHFFFAOYSA-N 1 2 309.417 4.151 20 0 DIADLO C[C@H](CC(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1F ZINC000338845785 1057010348 /nfs/dbraw/zinc/01/03/48/1057010348.db2.gz BFNLJVICCQQTLJ-CQSZACIVSA-N 1 2 323.371 4.144 20 0 DIADLO CSc1cccc(-c2cc(C[NH+]3CCOCC3)ccc2F)c1 ZINC001241315959 1057010728 /nfs/dbraw/zinc/01/07/28/1057010728.db2.gz VBDLXSGCHODWHP-UHFFFAOYSA-N 1 2 317.429 4.047 20 0 DIADLO c1coc([C@@H]2CCCCC[N@H+]2Cc2nc(C3CCCC3)no2)c1 ZINC000153983746 1057023297 /nfs/dbraw/zinc/02/32/97/1057023297.db2.gz XVSKYPLKVIUOOA-HNNXBMFYSA-N 1 2 315.417 4.438 20 0 DIADLO c1coc([C@@H]2CCCCC[N@@H+]2Cc2nc(C3CCCC3)no2)c1 ZINC000153983746 1057023302 /nfs/dbraw/zinc/02/33/02/1057023302.db2.gz XVSKYPLKVIUOOA-HNNXBMFYSA-N 1 2 315.417 4.438 20 0 DIADLO Cc1cc2cc(C[NH2+][C@@H](c3ncccn3)C3CC3)oc2cc1C ZINC000922581240 1057034906 /nfs/dbraw/zinc/03/49/06/1057034906.db2.gz SKVHGZAZVUCJMJ-GOSISDBHSA-N 1 2 307.397 4.081 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](c3ccccn3)C3CC3)co2)cc1 ZINC000922586884 1057037190 /nfs/dbraw/zinc/03/71/90/1057037190.db2.gz SRTRWPNIDUMWNG-IBGZPJMESA-N 1 2 319.408 4.286 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(Cl)c1)[C@@H]1CCCC12CC2 ZINC000624937005 1057042266 /nfs/dbraw/zinc/04/22/66/1057042266.db2.gz AMTOCXDJAQBTAU-ZDUSSCGKSA-N 1 2 315.804 4.045 20 0 DIADLO Cc1ncoc1C[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F ZINC000922669443 1057047390 /nfs/dbraw/zinc/04/73/90/1057047390.db2.gz BVMBWZFBDOWJJH-ZETCQYMHSA-N 1 2 303.164 4.280 20 0 DIADLO Cc1cc(C[NH2+][C@@H]2CCCC2(F)F)ccc1Oc1cccnc1 ZINC000673618290 1057061343 /nfs/dbraw/zinc/06/13/43/1057061343.db2.gz ZLEQXSXIOHRHJS-QGZVFWFLSA-N 1 2 318.367 4.460 20 0 DIADLO C[C@H](Oc1ccccc1NCc1c[nH+]cn1C)c1ccccc1 ZINC000347749147 1057065181 /nfs/dbraw/zinc/06/51/81/1057065181.db2.gz ADBYZZCZWLFOLF-HNNXBMFYSA-N 1 2 307.397 4.172 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccc([S@@](C)=O)cc2)c1 ZINC001241490299 1057066696 /nfs/dbraw/zinc/06/66/96/1057066696.db2.gz MSXBHQJAURUERH-OAQYLSRUSA-N 1 2 301.455 4.246 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@@H]2CCCc3cccnc32)cs1 ZINC000922883138 1057074145 /nfs/dbraw/zinc/07/41/45/1057074145.db2.gz PXBXOPCTXSZPCL-CQSZACIVSA-N 1 2 301.459 4.003 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](C)Cc1ccncc1Br ZINC000625056628 1057082425 /nfs/dbraw/zinc/08/24/25/1057082425.db2.gz KRRSQIXJDBRSLH-LBPRGKRZSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccncc1Br ZINC000625056628 1057082432 /nfs/dbraw/zinc/08/24/32/1057082432.db2.gz KRRSQIXJDBRSLH-LBPRGKRZSA-N 1 2 305.219 4.037 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1ncccc1C(F)(F)F ZINC000158883607 1057084443 /nfs/dbraw/zinc/08/44/43/1057084443.db2.gz FDKNKNFMSGJAIZ-UHFFFAOYSA-N 1 2 320.318 4.082 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1ccncc1Br ZINC000625085552 1057085738 /nfs/dbraw/zinc/08/57/38/1057085738.db2.gz SZNAJNVPXARMJR-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1ccncc1Br ZINC000625085552 1057085744 /nfs/dbraw/zinc/08/57/44/1057085744.db2.gz SZNAJNVPXARMJR-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO Cc1cn2cc(-c3cccc(C(=O)OC(C)(C)C)c3)ccc2[nH+]1 ZINC001241537352 1057086966 /nfs/dbraw/zinc/08/69/66/1057086966.db2.gz RZROWQIFYVEYQM-UHFFFAOYSA-N 1 2 308.381 4.265 20 0 DIADLO Clc1cccnc1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC000625182628 1057097263 /nfs/dbraw/zinc/09/72/63/1057097263.db2.gz UINFARJYTLDTGK-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cccnc1C[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC000625182628 1057097269 /nfs/dbraw/zinc/09/72/69/1057097269.db2.gz UINFARJYTLDTGK-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccncc2Br)[C@H]1c1ccccc1 ZINC000625210049 1057099833 /nfs/dbraw/zinc/09/98/33/1057099833.db2.gz AVBVQPAQZLAPNS-BLLLJJGKSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccncc2Br)[C@H]1c1ccccc1 ZINC000625210049 1057099839 /nfs/dbraw/zinc/09/98/39/1057099839.db2.gz AVBVQPAQZLAPNS-BLLLJJGKSA-N 1 2 317.230 4.037 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)nn1C ZINC000282417304 1057100980 /nfs/dbraw/zinc/10/09/80/1057100980.db2.gz YMGCPOMBEVONTI-QRWLVFNGSA-N 1 2 323.415 4.308 20 0 DIADLO CCc1ccc([C@@H]([NH2+]Cc2noc(C3CCC3)n2)C(C)C)cc1 ZINC000625228860 1057104132 /nfs/dbraw/zinc/10/41/32/1057104132.db2.gz LSPJFNRGEYBQRZ-SFHVURJKSA-N 1 2 313.445 4.386 20 0 DIADLO CC(C)(C)OC1CC([N@@H+]2CCc3[nH]c4ccc(F)cc4c3C2)C1 ZINC000360861096 1057108818 /nfs/dbraw/zinc/10/88/18/1057108818.db2.gz ZVIWHYYEGLSLHK-UHFFFAOYSA-N 1 2 316.420 4.011 20 0 DIADLO CC(C)(C)OC1CC([N@H+]2CCc3[nH]c4ccc(F)cc4c3C2)C1 ZINC000360861096 1057108820 /nfs/dbraw/zinc/10/88/20/1057108820.db2.gz ZVIWHYYEGLSLHK-UHFFFAOYSA-N 1 2 316.420 4.011 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1ncc(-c2cccc(F)c2)o1 ZINC000673856896 1057143525 /nfs/dbraw/zinc/14/35/25/1057143525.db2.gz SMMCXVHBKJYFBH-UHFFFAOYSA-N 1 2 316.298 4.255 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1ncc(-c2cccc(F)c2)o1 ZINC000673856896 1057143531 /nfs/dbraw/zinc/14/35/31/1057143531.db2.gz SMMCXVHBKJYFBH-UHFFFAOYSA-N 1 2 316.298 4.255 20 0 DIADLO CCCC[N@H+](Cc1nc([C@H](C)OC)no1)[C@@H](C)c1ccc(C)o1 ZINC000673856969 1057144109 /nfs/dbraw/zinc/14/41/09/1057144109.db2.gz ZBIHXEAVTSENQL-KBPBESRZSA-N 1 2 321.421 4.042 20 0 DIADLO CCCC[N@@H+](Cc1nc([C@H](C)OC)no1)[C@@H](C)c1ccc(C)o1 ZINC000673856969 1057144112 /nfs/dbraw/zinc/14/41/12/1057144112.db2.gz ZBIHXEAVTSENQL-KBPBESRZSA-N 1 2 321.421 4.042 20 0 DIADLO Cc1cscc1-c1ccc(-c2ccc(-n3cc[nH+]c3)cc2)nn1 ZINC001241727912 1057148870 /nfs/dbraw/zinc/14/88/70/1057148870.db2.gz QHLVQDYAJKEDGN-UHFFFAOYSA-N 1 2 318.405 4.366 20 0 DIADLO C[C@@H]([NH2+]Cc1cnn(C(C)(C)C)c1)c1c(F)cccc1Cl ZINC000673929788 1057151824 /nfs/dbraw/zinc/15/18/24/1057151824.db2.gz MTYJQTTWGRKQRK-LLVKDONJSA-N 1 2 309.816 4.281 20 0 DIADLO Brc1cscc1C[N@@H+]1CCc2ccsc2C1 ZINC000347843848 1057155807 /nfs/dbraw/zinc/15/58/07/1057155807.db2.gz AARXCXNNMFDRNQ-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO Brc1cscc1C[N@H+]1CCc2ccsc2C1 ZINC000347843848 1057155810 /nfs/dbraw/zinc/15/58/10/1057155810.db2.gz AARXCXNNMFDRNQ-UHFFFAOYSA-N 1 2 314.273 4.130 20 0 DIADLO Cc1cccc(C)c1[C@H]1CCC[N@@H+]1Cc1noc(C2CCC2)n1 ZINC000625529405 1057156526 /nfs/dbraw/zinc/15/65/26/1057156526.db2.gz JLSQPGJCVNPPRO-MRXNPFEDSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1cccc(C)c1[C@H]1CCC[N@H+]1Cc1noc(C2CCC2)n1 ZINC000625529405 1057156529 /nfs/dbraw/zinc/15/65/29/1057156529.db2.gz JLSQPGJCVNPPRO-MRXNPFEDSA-N 1 2 311.429 4.291 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc(C(F)F)nc1 ZINC000657955082 1057157990 /nfs/dbraw/zinc/15/79/90/1057157990.db2.gz YQILOLCSTJLNFG-GFCCVEGCSA-N 1 2 318.371 4.188 20 0 DIADLO Nc1cn2ccc(-c3ccccc3Oc3ccccc3)cc2[nH+]1 ZINC001241795880 1057168267 /nfs/dbraw/zinc/16/82/67/1057168267.db2.gz LXUPKDFACBMPDF-UHFFFAOYSA-N 1 2 301.349 4.376 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)CC(=O)N[C@@H]1CCCC[C@H]1C ZINC000059389769 1057192988 /nfs/dbraw/zinc/19/29/88/1057192988.db2.gz FMGKGMZNHBEMIE-JKIFEVAISA-N 1 2 322.880 4.028 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)CC(=O)N[C@@H]1CCCC[C@H]1C ZINC000059389769 1057192993 /nfs/dbraw/zinc/19/29/93/1057192993.db2.gz FMGKGMZNHBEMIE-JKIFEVAISA-N 1 2 322.880 4.028 20 0 DIADLO COc1cc(C[NH2+]C2(C(F)F)CCCC2)cc(Cl)c1OC ZINC000674135258 1057212170 /nfs/dbraw/zinc/21/21/70/1057212170.db2.gz LAAGPFXCAYSNOS-UHFFFAOYSA-N 1 2 319.779 4.025 20 0 DIADLO Cc1nnc(-c2cccc(-c3ccc(F)c(-n4cc[nH+]c4)c3)c2)o1 ZINC001241938659 1057219313 /nfs/dbraw/zinc/21/93/13/1057219313.db2.gz TZGZTYRPLYDBJU-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2ccccc2OC(F)F)cc1F ZINC001241954104 1057223415 /nfs/dbraw/zinc/22/34/15/1057223415.db2.gz ZYVPPGYMGJSMKE-UHFFFAOYSA-N 1 2 313.294 4.295 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2cccc(N3CCOCC3)c2)c1 ZINC001241959828 1057224368 /nfs/dbraw/zinc/22/43/68/1057224368.db2.gz QNDJDKYTSMJQDV-UHFFFAOYSA-N 1 2 324.468 4.345 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccccc3C3CC3)CCCCC2)no1 ZINC000674334530 1057231824 /nfs/dbraw/zinc/23/18/24/1057231824.db2.gz SWSNNWJWUYGBTQ-UHFFFAOYSA-N 1 2 311.429 4.205 20 0 DIADLO Cc1cc(-c2ccc(-c3nc4cc[nH]cc-4n3)cc2)cc(C)[nH+]1 ZINC001241992736 1057232255 /nfs/dbraw/zinc/23/22/55/1057232255.db2.gz YJRPDCKRHHPIET-UHFFFAOYSA-N 1 2 300.365 4.304 20 0 DIADLO CSc1ccc(-c2ccccc2C[NH+]2CCOCC2)c(F)c1 ZINC001241993979 1057233746 /nfs/dbraw/zinc/23/37/46/1057233746.db2.gz DRWOLRXXFYTZHF-UHFFFAOYSA-N 1 2 317.429 4.047 20 0 DIADLO C=Cc1ccccc1-c1ncnc2c1C[N@H+](Cc1ccccc1)C2 ZINC001241999837 1057236402 /nfs/dbraw/zinc/23/64/02/1057236402.db2.gz DQHDHPWEXCRADX-UHFFFAOYSA-N 1 2 313.404 4.302 20 0 DIADLO C=Cc1ccccc1-c1ncnc2c1C[N@@H+](Cc1ccccc1)C2 ZINC001241999837 1057236408 /nfs/dbraw/zinc/23/64/08/1057236408.db2.gz DQHDHPWEXCRADX-UHFFFAOYSA-N 1 2 313.404 4.302 20 0 DIADLO Fc1ccc([C@@H]2CCCC[N@@H+]2Cc2noc3c2CCCC3)cc1 ZINC000674469273 1057244879 /nfs/dbraw/zinc/24/48/79/1057244879.db2.gz POXURXGYNHLFQS-SFHVURJKSA-N 1 2 314.404 4.420 20 0 DIADLO Fc1ccc([C@@H]2CCCC[N@H+]2Cc2noc3c2CCCC3)cc1 ZINC000674469273 1057244884 /nfs/dbraw/zinc/24/48/84/1057244884.db2.gz POXURXGYNHLFQS-SFHVURJKSA-N 1 2 314.404 4.420 20 0 DIADLO c1cn(Cc2ccc(-c3cccc(OC4CCCC4)c3)nc2)c[nH+]1 ZINC001242033691 1057245382 /nfs/dbraw/zinc/24/53/82/1057245382.db2.gz ZWDNSZLBBGEROL-UHFFFAOYSA-N 1 2 319.408 4.315 20 0 DIADLO CC(C)n1ccc(C[N@H+](C)Cc2ccccc2C(F)(F)F)n1 ZINC000172011430 1057245814 /nfs/dbraw/zinc/24/58/14/1057245814.db2.gz UOHUURPGGKZWOV-UHFFFAOYSA-N 1 2 311.351 4.115 20 0 DIADLO CC(C)n1ccc(C[N@@H+](C)Cc2ccccc2C(F)(F)F)n1 ZINC000172011430 1057245818 /nfs/dbraw/zinc/24/58/18/1057245818.db2.gz UOHUURPGGKZWOV-UHFFFAOYSA-N 1 2 311.351 4.115 20 0 DIADLO COc1cc(-c2c[nH+]c(N3CCCCC3)cc2C)c(F)cc1F ZINC001242045291 1057249088 /nfs/dbraw/zinc/24/90/88/1057249088.db2.gz RBRSSWDDWZEEBS-UHFFFAOYSA-N 1 2 318.367 4.334 20 0 DIADLO CC(C)Oc1ccc(-c2ccn3cc(N)[nH+]c3c2)c(Cl)c1 ZINC001242087225 1057258708 /nfs/dbraw/zinc/25/87/08/1057258708.db2.gz MRHXKNZAOFPSDT-UHFFFAOYSA-N 1 2 301.777 4.024 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2F)on1 ZINC000701406977 1057258956 /nfs/dbraw/zinc/25/89/56/1057258956.db2.gz RZGOKCCAXZRVMK-QMMMGPOBSA-N 1 2 303.164 4.280 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cc(C(F)(F)F)ccc2O)cc1 ZINC001242141327 1057276977 /nfs/dbraw/zinc/27/69/77/1057276977.db2.gz KTHSUVLEZSFMEG-UHFFFAOYSA-N 1 2 318.298 4.479 20 0 DIADLO Oc1ccc(-c2cc[nH+]c(N3CCCC3)c2)cc1C(F)(F)F ZINC001242157180 1057283069 /nfs/dbraw/zinc/28/30/69/1057283069.db2.gz DABCSJKLBDRRCM-UHFFFAOYSA-N 1 2 308.303 4.073 20 0 DIADLO Cc1c(-c2cccnc2OC2CCCCC2)ccc2[nH+]ccn21 ZINC001242231461 1057304656 /nfs/dbraw/zinc/30/46/56/1057304656.db2.gz MGLDSTYXGJRNKX-UHFFFAOYSA-N 1 2 307.397 4.416 20 0 DIADLO Cc1cccc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c1F ZINC001242238353 1057307003 /nfs/dbraw/zinc/30/70/03/1057307003.db2.gz DMHDRORITNGGOV-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO Cc1cccc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c1F ZINC001242238353 1057307007 /nfs/dbraw/zinc/30/70/07/1057307007.db2.gz DMHDRORITNGGOV-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO CCOc1cc(Nc2ccc[nH+]c2N2CCCC2)c(F)cc1F ZINC001212528808 1057314277 /nfs/dbraw/zinc/31/42/77/1057314277.db2.gz PHMUQAYGHUKLTB-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1cc(F)ccc1F ZINC000675089106 1057314529 /nfs/dbraw/zinc/31/45/29/1057314529.db2.gz NLBTVDKTRZTDKT-BJOHPYRUSA-N 1 2 309.743 4.403 20 0 DIADLO COc1ccc(C(C)=O)cc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001242269143 1057314953 /nfs/dbraw/zinc/31/49/53/1057314953.db2.gz YFRYKRJIUJHAHX-UHFFFAOYSA-N 1 2 324.424 4.259 20 0 DIADLO CCOc1cc(Nc2ccc(-n3cc[nH+]c3)cc2)c(F)cc1F ZINC001212530885 1057323387 /nfs/dbraw/zinc/32/33/87/1057323387.db2.gz XUDATSCKSCBYFB-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)c(Cl)c1 ZINC000675249774 1057333699 /nfs/dbraw/zinc/33/36/99/1057333699.db2.gz BRNHBXHJGTXYHG-INIZCTEOSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1ccc(Cl)c(Cl)c1 ZINC000675249774 1057333705 /nfs/dbraw/zinc/33/37/05/1057333705.db2.gz BRNHBXHJGTXYHG-INIZCTEOSA-N 1 2 324.255 4.372 20 0 DIADLO COc1ccc(OC(F)(F)F)cc1-c1cc(C)c2[nH+]ccn2c1 ZINC001242320836 1057334461 /nfs/dbraw/zinc/33/44/61/1057334461.db2.gz YXZJLNWHWQNJIR-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO C[NH+](C)c1ccc(NCc2csc(C(F)(F)F)c2)cc1 ZINC000703353344 1057338188 /nfs/dbraw/zinc/33/81/88/1057338188.db2.gz CGHBBBXWPZOADN-UHFFFAOYSA-N 1 2 300.349 4.445 20 0 DIADLO Cc1cccc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)c1O ZINC001242348273 1057341444 /nfs/dbraw/zinc/34/14/44/1057341444.db2.gz DHTWPLPVDPFPRJ-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO Cc1cccc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)c1O ZINC001242348273 1057341451 /nfs/dbraw/zinc/34/14/51/1057341451.db2.gz DHTWPLPVDPFPRJ-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2cccc(Cl)c2O)nc1 ZINC001242365504 1057347817 /nfs/dbraw/zinc/34/78/17/1057347817.db2.gz UVSPBQDIUYEGBK-CYBMUJFWSA-N 1 2 316.832 4.482 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1ccc(-c2cccc(Cl)c2O)nc1 ZINC001242365504 1057347820 /nfs/dbraw/zinc/34/78/20/1057347820.db2.gz UVSPBQDIUYEGBK-CYBMUJFWSA-N 1 2 316.832 4.482 20 0 DIADLO CCOc1cc(Nc2cc(Cl)c3[nH+]ccn3c2)ccc1OC ZINC001212540633 1057350660 /nfs/dbraw/zinc/35/06/60/1057350660.db2.gz MHSIQYYRDIABBP-UHFFFAOYSA-N 1 2 317.776 4.139 20 0 DIADLO CCOc1cc(Nc2cccc(Cn3cc[nH+]c3)c2)ccc1OC ZINC001212542518 1057351601 /nfs/dbraw/zinc/35/16/01/1057351601.db2.gz PZVLFNMYDNVQAD-UHFFFAOYSA-N 1 2 323.396 4.082 20 0 DIADLO Cc1ccc(-c2nc3[nH]ccc3c[nH+]2)cc1OCc1ccccc1 ZINC001242389364 1057357423 /nfs/dbraw/zinc/35/74/23/1057357423.db2.gz VCXSKZCBBPDXDZ-UHFFFAOYSA-N 1 2 315.376 4.464 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2ccc(Cl)c(Cl)c2C)cc1 ZINC001242516711 1057391951 /nfs/dbraw/zinc/39/19/51/1057391951.db2.gz MNDNUWOFMQFTOI-HNNXBMFYSA-N 1 2 324.207 4.142 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(-c4ccco4)s3)ccc2[nH+]1 ZINC000675774503 1057411291 /nfs/dbraw/zinc/41/12/91/1057411291.db2.gz BPZCPXFGEMWQLP-UHFFFAOYSA-N 1 2 323.377 4.217 20 0 DIADLO COc1cccc2c1OCC[C@@H]2[NH2+]Cc1c(F)cccc1Cl ZINC000675788746 1057415428 /nfs/dbraw/zinc/41/54/28/1057415428.db2.gz HQLMJCVRETYPNO-HNNXBMFYSA-N 1 2 321.779 4.101 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[NH+]1CC(c2nc3ccccc3[nH]2)C1 ZINC000675975503 1057439925 /nfs/dbraw/zinc/43/99/25/1057439925.db2.gz OLLUGZIGFULICJ-NSHDSACASA-N 1 2 313.351 4.002 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)CCOC(C)(C)C)cs2)cc1 ZINC000676042900 1057446076 /nfs/dbraw/zinc/44/60/76/1057446076.db2.gz GZJZBXODAUCWPX-UHFFFAOYSA-N 1 2 318.486 4.365 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)CCOC(C)(C)C)cs2)cc1 ZINC000676042900 1057446081 /nfs/dbraw/zinc/44/60/81/1057446081.db2.gz GZJZBXODAUCWPX-UHFFFAOYSA-N 1 2 318.486 4.365 20 0 DIADLO C[N@H+](CCOC(C)(C)C)Cc1csc(-c2ccccc2F)n1 ZINC000676043052 1057446398 /nfs/dbraw/zinc/44/63/98/1057446398.db2.gz JKKPJJOMWZFRHD-UHFFFAOYSA-N 1 2 322.449 4.196 20 0 DIADLO C[N@@H+](CCOC(C)(C)C)Cc1csc(-c2ccccc2F)n1 ZINC000676043052 1057446401 /nfs/dbraw/zinc/44/64/01/1057446401.db2.gz JKKPJJOMWZFRHD-UHFFFAOYSA-N 1 2 322.449 4.196 20 0 DIADLO CCc1cc(OC)ccc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001242700351 1057453006 /nfs/dbraw/zinc/45/30/06/1057453006.db2.gz OQADJAXCWBRRAG-UHFFFAOYSA-N 1 2 305.368 4.264 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccccc1-n1cccn1 ZINC001242711571 1057456124 /nfs/dbraw/zinc/45/61/24/1057456124.db2.gz UPLCAXREKJNMEI-UHFFFAOYSA-N 1 2 318.424 4.233 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1nc(C)sc1C)c1cccc(Cl)c1 ZINC000676196923 1057456344 /nfs/dbraw/zinc/45/63/44/1057456344.db2.gz FVFBXEMHCZYMEO-BMIGLBTASA-N 1 2 324.877 4.452 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1nc(C)sc1C)c1cccc(Cl)c1 ZINC000676196924 1057456568 /nfs/dbraw/zinc/45/65/68/1057456568.db2.gz FVFBXEMHCZYMEO-BONVTDFDSA-N 1 2 324.877 4.452 20 0 DIADLO FC(F)(F)COc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001242719053 1057458724 /nfs/dbraw/zinc/45/87/24/1057458724.db2.gz RAZVNXSEZCCUHE-UHFFFAOYSA-N 1 2 318.298 4.480 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1ccc(C)cc1Cl ZINC000676478544 1057477624 /nfs/dbraw/zinc/47/76/24/1057477624.db2.gz GPNTXVBLBFWZFZ-CYBMUJFWSA-N 1 2 320.820 4.091 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@H](C)C(=O)Nc1ccc(C)cc1Cl ZINC000676478544 1057477628 /nfs/dbraw/zinc/47/76/28/1057477628.db2.gz GPNTXVBLBFWZFZ-CYBMUJFWSA-N 1 2 320.820 4.091 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+][C@@H](C)c1nc(C)sc1C ZINC000676489533 1057478995 /nfs/dbraw/zinc/47/89/95/1057478995.db2.gz JYNDZBAWWHLACI-VIFPVBQESA-N 1 2 310.850 4.273 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(F)c(Cl)c(F)c1 ZINC001242797946 1057479713 /nfs/dbraw/zinc/47/97/13/1057479713.db2.gz GVVYYYAVUGXYDJ-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@H+](C1CC1)C1CCCCC1 ZINC000676556225 1057483140 /nfs/dbraw/zinc/48/31/40/1057483140.db2.gz OXFMLVPVDIKJJV-UHFFFAOYSA-N 1 2 303.450 4.414 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@@H+](C1CC1)C1CCCCC1 ZINC000676556225 1057483146 /nfs/dbraw/zinc/48/31/46/1057483146.db2.gz OXFMLVPVDIKJJV-UHFFFAOYSA-N 1 2 303.450 4.414 20 0 DIADLO Cc1cc(NC(=O)[C@@H](C)c2c(Cl)cccc2Cl)c(C)c[nH+]1 ZINC000676588327 1057486686 /nfs/dbraw/zinc/48/66/86/1057486686.db2.gz VXHRNHISTHUORS-NSHDSACASA-N 1 2 323.223 4.169 20 0 DIADLO CC(C)(C)SCC[N@@H+]1Cc2ccc(Br)cc2C1 ZINC000708028622 1057501613 /nfs/dbraw/zinc/50/16/13/1057501613.db2.gz VUEYTZCPVMJFBZ-UHFFFAOYSA-N 1 2 314.292 4.296 20 0 DIADLO CC(C)(C)SCC[N@H+]1Cc2ccc(Br)cc2C1 ZINC000708028622 1057501617 /nfs/dbraw/zinc/50/16/17/1057501617.db2.gz VUEYTZCPVMJFBZ-UHFFFAOYSA-N 1 2 314.292 4.296 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cn(C)cn1)c1cc(F)c(Cl)cc1Cl ZINC000710178932 1057502252 /nfs/dbraw/zinc/50/22/52/1057502252.db2.gz UNAINHIMBBNQOZ-BDAKNGLRSA-N 1 2 316.207 4.278 20 0 DIADLO Fc1ccc(OCCCSc2[nH+]cc3ccccn32)cc1 ZINC000072099290 1057502369 /nfs/dbraw/zinc/50/23/69/1057502369.db2.gz MBPDWRZYYHHUFP-UHFFFAOYSA-N 1 2 302.374 4.035 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2c(c1)C(=O)CCC2 ZINC001242858987 1057503049 /nfs/dbraw/zinc/50/30/49/1057503049.db2.gz LGROHWBNTHWUEC-UHFFFAOYSA-N 1 2 318.376 4.067 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2cc(Cl)cc3c2OCC3)cs1 ZINC000922987565 1057519441 /nfs/dbraw/zinc/51/94/41/1057519441.db2.gz UVVNYSJLSPGLMA-SNVBAGLBSA-N 1 2 322.861 4.145 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@]2(C)CCOc3ccccc32)cs1 ZINC000923023736 1057522420 /nfs/dbraw/zinc/52/24/20/1057522420.db2.gz AGGSNZHDCYAIJA-GOSISDBHSA-N 1 2 316.470 4.228 20 0 DIADLO Cc1noc([C@H](C)[NH+]2CCC([C@H](F)c3ccccc3F)CC2)n1 ZINC000671699523 1057543654 /nfs/dbraw/zinc/54/36/54/1057543654.db2.gz KMLSHTMMTACWRZ-ZBEGNZNMSA-N 1 2 321.371 4.001 20 0 DIADLO CSc1cccc(F)c1C[NH2+][C@H](C)c1nc(C)sc1C ZINC000671764869 1057559581 /nfs/dbraw/zinc/55/95/81/1057559581.db2.gz ZWJHRLUFHIIJFN-SECBINFHSA-N 1 2 310.463 4.472 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2noc(C3CCCCC3)n2)cc1 ZINC001243068433 1057562060 /nfs/dbraw/zinc/56/20/60/1057562060.db2.gz XAINLZKXUNUODO-UHFFFAOYSA-N 1 2 308.385 4.185 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)c(-c2ccc(C(F)F)cc2)c1 ZINC001243085876 1057566313 /nfs/dbraw/zinc/56/63/13/1057566313.db2.gz UCWVQGOCOPTRPE-UHFFFAOYSA-N 1 2 321.342 4.263 20 0 DIADLO Cc1cc2cc[nH]c2cc1-c1cc(F)ccc1C[NH+]1CCOCC1 ZINC001243087093 1057567643 /nfs/dbraw/zinc/56/76/43/1057567643.db2.gz BHWPAMMQTGVMMU-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO COC(=O)c1oc([C@H](C)[N@@H+]2CC[C@@H]2c2cccc(F)c2)cc1C ZINC000611372047 1057593653 /nfs/dbraw/zinc/59/36/53/1057593653.db2.gz OYJWFDSEYDYOHB-SWLSCSKDSA-N 1 2 317.360 4.022 20 0 DIADLO COC(=O)c1oc([C@H](C)[N@H+]2CC[C@@H]2c2cccc(F)c2)cc1C ZINC000611372047 1057593658 /nfs/dbraw/zinc/59/36/58/1057593658.db2.gz OYJWFDSEYDYOHB-SWLSCSKDSA-N 1 2 317.360 4.022 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2cccc3cccnc32)c1 ZINC000611470883 1057602353 /nfs/dbraw/zinc/60/23/53/1057602353.db2.gz OVDASGJTDURMRO-UHFFFAOYSA-N 1 2 310.422 4.380 20 0 DIADLO COc1c(F)cc(-c2cccc(-c3c[nH+]cn3C)c2)cc1F ZINC001243224459 1057611855 /nfs/dbraw/zinc/61/18/55/1057611855.db2.gz AIHVPEFCPXGTGS-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO c1nc(C2CC2)c(C[N@@H+]2CCc3[nH]c4ccccc4c3C2)s1 ZINC000495061049 1057620430 /nfs/dbraw/zinc/62/04/30/1057620430.db2.gz BIFIUPQNUQDEES-UHFFFAOYSA-N 1 2 309.438 4.060 20 0 DIADLO c1nc(C2CC2)c(C[N@H+]2CCc3[nH]c4ccccc4c3C2)s1 ZINC000495061049 1057620432 /nfs/dbraw/zinc/62/04/32/1057620432.db2.gz BIFIUPQNUQDEES-UHFFFAOYSA-N 1 2 309.438 4.060 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(O)c(C(C)C)c1 ZINC001243260264 1057623160 /nfs/dbraw/zinc/62/31/60/1057623160.db2.gz ODGGWPCLFBGNGZ-UHFFFAOYSA-N 1 2 308.381 4.377 20 0 DIADLO C[N@H+](Cc1cc(-c2cccs2)on1)Cc1cccc(F)c1 ZINC000052929929 1057632666 /nfs/dbraw/zinc/63/26/66/1057632666.db2.gz MLRAFHCZJOASAA-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1cc(-c2cccs2)on1)Cc1cccc(F)c1 ZINC000052929929 1057632671 /nfs/dbraw/zinc/63/26/71/1057632671.db2.gz MLRAFHCZJOASAA-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@H+](CC1CC1)Cn1nc(CCC2CCCCC2)oc1=S ZINC000727420434 1057654117 /nfs/dbraw/zinc/65/41/17/1057654117.db2.gz NTUVTFXBISCLNG-UHFFFAOYSA-N 1 2 309.479 4.018 20 0 DIADLO C[N@@H+](CC1CC1)Cn1nc(CCC2CCCCC2)oc1=S ZINC000727420434 1057654119 /nfs/dbraw/zinc/65/41/19/1057654119.db2.gz NTUVTFXBISCLNG-UHFFFAOYSA-N 1 2 309.479 4.018 20 0 DIADLO Cc1cc(-c2cccc(F)c2OCc2ccccc2)c[nH+]c1N ZINC001243345316 1057655054 /nfs/dbraw/zinc/65/50/54/1057655054.db2.gz JNJYMIDYYKOBRH-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO Cc1c2cccc(Cl)c2oc1C(=O)Nc1cc(C)[nH+]cc1C ZINC000536574719 1057674292 /nfs/dbraw/zinc/67/42/92/1057674292.db2.gz DSAORSDVMSMHDH-UHFFFAOYSA-N 1 2 314.772 4.081 20 0 DIADLO CC[C@@H]1CCC[N@@H+]1Cn1nc(-c2ccc(C)cc2)oc1=S ZINC000727825037 1057675552 /nfs/dbraw/zinc/67/55/52/1057675552.db2.gz UPCPPORAOBGFHF-CQSZACIVSA-N 1 2 303.431 4.013 20 0 DIADLO CC[C@@H]1CCC[N@H+]1Cn1nc(-c2ccc(C)cc2)oc1=S ZINC000727825037 1057675555 /nfs/dbraw/zinc/67/55/55/1057675555.db2.gz UPCPPORAOBGFHF-CQSZACIVSA-N 1 2 303.431 4.013 20 0 DIADLO CCOc1cc(C)ccc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001243413862 1057675804 /nfs/dbraw/zinc/67/58/04/1057675804.db2.gz CSNAWEOQHINQEH-UHFFFAOYSA-N 1 2 305.368 4.401 20 0 DIADLO Clc1nccc(-c2ccccc2Cn2cc[nH+]c2)c1Cl ZINC001243415020 1057675997 /nfs/dbraw/zinc/67/59/97/1057675997.db2.gz FQXQYFRFUKCTQJ-UHFFFAOYSA-N 1 2 304.180 4.300 20 0 DIADLO CCC[N@H+](CC)Cn1nc(-c2ccccc2Cl)oc1=S ZINC000727822382 1057677001 /nfs/dbraw/zinc/67/70/01/1057677001.db2.gz YLUKULXLVWJRBI-UHFFFAOYSA-N 1 2 311.838 4.215 20 0 DIADLO CCC[N@@H+](CC)Cn1nc(-c2ccccc2Cl)oc1=S ZINC000727822382 1057677007 /nfs/dbraw/zinc/67/70/07/1057677007.db2.gz YLUKULXLVWJRBI-UHFFFAOYSA-N 1 2 311.838 4.215 20 0 DIADLO CC(C)(C)n1cnn(C[N@H+](CC2CCCCC2)C2CC2)c1=S ZINC000727822294 1057677045 /nfs/dbraw/zinc/67/70/45/1057677045.db2.gz HCDJMLMMYXNXFU-UHFFFAOYSA-N 1 2 322.522 4.171 20 0 DIADLO CC(C)(C)n1cnn(C[N@@H+](CC2CCCCC2)C2CC2)c1=S ZINC000727822294 1057677049 /nfs/dbraw/zinc/67/70/49/1057677049.db2.gz HCDJMLMMYXNXFU-UHFFFAOYSA-N 1 2 322.522 4.171 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccnc(Cl)c2Cl)cc1 ZINC001243417322 1057677133 /nfs/dbraw/zinc/67/71/33/1057677133.db2.gz KAMYSBDIXVZVBY-UHFFFAOYSA-N 1 2 304.180 4.456 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccnc(Cl)c2Cl)c1 ZINC001243417639 1057677141 /nfs/dbraw/zinc/67/71/41/1057677141.db2.gz PMTBHQVGSUIMQU-UHFFFAOYSA-N 1 2 304.180 4.456 20 0 DIADLO CC[C@H]1CCC[N@@H+]1Cn1nc(-c2ccccc2C)oc1=S ZINC000727824781 1057677936 /nfs/dbraw/zinc/67/79/36/1057677936.db2.gz RNXWEWMKUUCOIY-ZDUSSCGKSA-N 1 2 303.431 4.013 20 0 DIADLO CC[C@H]1CCC[N@H+]1Cn1nc(-c2ccccc2C)oc1=S ZINC000727824781 1057677939 /nfs/dbraw/zinc/67/79/39/1057677939.db2.gz RNXWEWMKUUCOIY-ZDUSSCGKSA-N 1 2 303.431 4.013 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cn2c3ccccc3n(C)c2=S)s1 ZINC000728048653 1057685017 /nfs/dbraw/zinc/68/50/17/1057685017.db2.gz ZLAGYHJESXCEEW-UHFFFAOYSA-N 1 2 317.483 4.169 20 0 DIADLO Cc1ccc(C[N@H+](C)Cn2c3ccccc3n(C)c2=S)s1 ZINC000728048653 1057685020 /nfs/dbraw/zinc/68/50/20/1057685020.db2.gz ZLAGYHJESXCEEW-UHFFFAOYSA-N 1 2 317.483 4.169 20 0 DIADLO CCOc1ccc([C@@H]([NH2+][C@@H](C)c2ncc[nH]2)c2ccccc2)cc1 ZINC000286263241 1057687447 /nfs/dbraw/zinc/68/74/47/1057687447.db2.gz VAZFEOWMNIHPLA-KXBFYZLASA-N 1 2 321.424 4.249 20 0 DIADLO COc1cccc(OC)c1-c1ccccc1-c1ccc[nH+]c1N ZINC001243477921 1057691975 /nfs/dbraw/zinc/69/19/75/1057691975.db2.gz RTKFLLCPFUJURI-UHFFFAOYSA-N 1 2 306.365 4.015 20 0 DIADLO C[C@@H]1CCC[N@H+](Cn2nc(-c3ccccc3)sc2=S)CC1 ZINC000729981248 1057700262 /nfs/dbraw/zinc/70/02/62/1057700262.db2.gz KNGPKESXLQNXMU-CYBMUJFWSA-N 1 2 319.499 4.421 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cn2nc(-c3ccccc3)sc2=S)CC1 ZINC000729981248 1057700267 /nfs/dbraw/zinc/70/02/67/1057700267.db2.gz KNGPKESXLQNXMU-CYBMUJFWSA-N 1 2 319.499 4.421 20 0 DIADLO CCOc1cc(-c2cc[nH+]c(N3CCCCC3)c2)ccc1OC ZINC001243540411 1057707905 /nfs/dbraw/zinc/70/79/05/1057707905.db2.gz ZAZTVAVNNGEFGD-UHFFFAOYSA-N 1 2 312.413 4.146 20 0 DIADLO CSc1ccc(Cl)cc1-c1cc(-n2ccnc2)cc[nH+]1 ZINC001243598299 1057729072 /nfs/dbraw/zinc/72/90/72/1057729072.db2.gz LNHBCWVKHHHQJF-UHFFFAOYSA-N 1 2 301.802 4.310 20 0 DIADLO NC(Cc1cccs1)=[NH+]OCc1csc(C2CCCC2)n1 ZINC000731029526 1057733125 /nfs/dbraw/zinc/73/31/25/1057733125.db2.gz VSINYOXTARHQRW-UHFFFAOYSA-N 1 2 321.471 4.103 20 0 DIADLO CSc1ncc(Cl)cc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001243615658 1057734466 /nfs/dbraw/zinc/73/44/66/1057734466.db2.gz HPPJLVQHTHKQDX-UHFFFAOYSA-N 1 2 319.739 4.120 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(C4CCOCC4)cc3)cc2)c[nH+]1 ZINC001243630770 1057740031 /nfs/dbraw/zinc/74/00/31/1057740031.db2.gz XCVJFUMWRAWWJW-UHFFFAOYSA-N 1 2 318.420 4.492 20 0 DIADLO c1cn(Cc2ccc(-c3cnc(-c4ccccc4)cn3)cc2)c[nH+]1 ZINC001243655826 1057745443 /nfs/dbraw/zinc/74/54/43/1057745443.db2.gz BKPFSZIYYGSAHM-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(COC4CCC4)cn3)cc2)c[nH+]1 ZINC001243656008 1057745626 /nfs/dbraw/zinc/74/56/26/1057745626.db2.gz JXNYSUQWUYLGGA-UHFFFAOYSA-N 1 2 319.408 4.063 20 0 DIADLO c1cn(Cc2ccc(-c3cnc(-c4ccccc4)nc3)cc2)c[nH+]1 ZINC001243656835 1057745667 /nfs/dbraw/zinc/74/56/67/1057745667.db2.gz FSLXNBJBARPWCW-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO Cc1cc2ncnc(-c3ccc(Cn4cc[nH+]c4)cc3)c2cc1C ZINC001243656584 1057745753 /nfs/dbraw/zinc/74/57/53/1057745753.db2.gz NHGCUWWKDVQCPA-UHFFFAOYSA-N 1 2 314.392 4.158 20 0 DIADLO Fc1cc(F)c(F)c(-c2ccc(Cn3cc[nH+]c3)cc2)c1F ZINC001243658732 1057746057 /nfs/dbraw/zinc/74/60/57/1057746057.db2.gz JPTQSDLTYXXEBF-UHFFFAOYSA-N 1 2 306.262 4.155 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(-c4ccon4)cc3)cc2)c[nH+]1 ZINC001243657600 1057746284 /nfs/dbraw/zinc/74/62/84/1057746284.db2.gz NRYSMQKEYQSBME-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO Fc1cnc2c(cccc2-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243659322 1057746957 /nfs/dbraw/zinc/74/69/57/1057746957.db2.gz SBGWFJIGCBXADE-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO COC(=O)c1cc(C)c(-c2ccc(Cn3cc[nH+]c3)cc2)cc1C ZINC001243659858 1057747133 /nfs/dbraw/zinc/74/71/33/1057747133.db2.gz IHIAEARNOZRMKG-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO CCOc1c(F)c(F)ccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243660047 1057747275 /nfs/dbraw/zinc/74/72/75/1057747275.db2.gz MKVUGMLVEQVRCS-UHFFFAOYSA-N 1 2 314.335 4.275 20 0 DIADLO CCCOc1ncc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1C ZINC001243659537 1057747344 /nfs/dbraw/zinc/74/73/44/1057747344.db2.gz XXMRACNPYIEMDO-UHFFFAOYSA-N 1 2 307.397 4.091 20 0 DIADLO CCOC(=O)c1cc(C)ccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243659140 1057747407 /nfs/dbraw/zinc/74/74/07/1057747407.db2.gz MTXDTKGVYSIRGE-UHFFFAOYSA-N 1 2 320.392 4.084 20 0 DIADLO CC(C)(C)Oc1ccnc(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243659878 1057747465 /nfs/dbraw/zinc/74/74/65/1057747465.db2.gz JKTRRJWGTHFKEP-UHFFFAOYSA-N 1 2 307.397 4.171 20 0 DIADLO CC(C)COc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cn1 ZINC001243663112 1057748464 /nfs/dbraw/zinc/74/84/64/1057748464.db2.gz UQUAYWYIWBQCOL-UHFFFAOYSA-N 1 2 307.397 4.028 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cn1ccc(-c2cccs2)n1 ZINC000731657864 1057749758 /nfs/dbraw/zinc/74/97/58/1057749758.db2.gz QCDCWZCYUPLABJ-UHFFFAOYSA-N 1 2 323.874 4.416 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cn1ccc(-c2cccs2)n1 ZINC000731657864 1057749763 /nfs/dbraw/zinc/74/97/63/1057749763.db2.gz QCDCWZCYUPLABJ-UHFFFAOYSA-N 1 2 323.874 4.416 20 0 DIADLO C/C(=C/C(=O)Nc1ccccc1-n1cc[nH+]c1)c1cccc(F)c1 ZINC000732057595 1057767282 /nfs/dbraw/zinc/76/72/82/1057767282.db2.gz MLDRHTLUYUABCN-KAMYIIQDSA-N 1 2 321.355 4.053 20 0 DIADLO Cc1cc(-c2cccc(NC(=O)OC(C)(C)C)n2)cn2cc[nH+]c12 ZINC001243757365 1057772037 /nfs/dbraw/zinc/77/20/37/1057772037.db2.gz AXEFDLWAZUCDJN-UHFFFAOYSA-N 1 2 324.384 4.052 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cccc(NC(=O)OC(C)(C)C)n1 ZINC001243759241 1057772515 /nfs/dbraw/zinc/77/25/15/1057772515.db2.gz YINJCHDVQDMDFJ-UHFFFAOYSA-N 1 2 324.384 4.052 20 0 DIADLO CC(C)C[C@H](c1nc(-c2cccc(Cl)c2)no1)n1cc[nH+]c1 ZINC000821004185 1057772937 /nfs/dbraw/zinc/77/29/37/1057772937.db2.gz VAGHRLYPIRQTQQ-CQSZACIVSA-N 1 2 316.792 4.222 20 0 DIADLO CC[N@H+](CC1CC1)Cn1nc(-c2ccc(Cl)cc2)oc1=S ZINC000732662868 1057783054 /nfs/dbraw/zinc/78/30/54/1057783054.db2.gz AZQBNZWQEUOPQB-UHFFFAOYSA-N 1 2 323.849 4.215 20 0 DIADLO CC[N@@H+](CC1CC1)Cn1nc(-c2ccc(Cl)cc2)oc1=S ZINC000732662868 1057783057 /nfs/dbraw/zinc/78/30/57/1057783057.db2.gz AZQBNZWQEUOPQB-UHFFFAOYSA-N 1 2 323.849 4.215 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)c2ccc(SC)cc2)c1C ZINC000733030277 1057797679 /nfs/dbraw/zinc/79/76/79/1057797679.db2.gz RXEJDSXYZDAGCJ-UHFFFAOYSA-N 1 2 302.443 4.065 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1c2cc[nH]c2c(F)cc1C ZINC001243889135 1057800128 /nfs/dbraw/zinc/80/01/28/1057800128.db2.gz SDHCBZHIDBNLIL-UHFFFAOYSA-N 1 2 321.355 4.477 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cnc(F)c(-c2ccccc2)c1 ZINC001243902051 1057802499 /nfs/dbraw/zinc/80/24/99/1057802499.db2.gz ZBSOEBLZVROTHW-UHFFFAOYSA-N 1 2 319.339 4.211 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1ccc(OC(F)(F)F)c(F)c1 ZINC001243923025 1057808637 /nfs/dbraw/zinc/80/86/37/1057808637.db2.gz BKBIVPFWNXHTKU-UHFFFAOYSA-N 1 2 310.250 4.347 20 0 DIADLO Cc1cc(F)cc(C)c1-c1cc(C[NH+]2CCOCC2)ccc1F ZINC001243929757 1057810332 /nfs/dbraw/zinc/81/03/32/1057810332.db2.gz WWIUMNBMNNVMLY-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2sc(C)nc2c1 ZINC001243939321 1057814202 /nfs/dbraw/zinc/81/42/02/1057814202.db2.gz RHOQSDBYIPJOKU-UHFFFAOYSA-N 1 2 321.405 4.466 20 0 DIADLO Cc1ccc(-c2csc3ncnc(C4=C[NH2+]CCC4)c23)s1 ZINC001243949600 1057817749 /nfs/dbraw/zinc/81/77/49/1057817749.db2.gz VKKLYJWSNGRRBB-UHFFFAOYSA-N 1 2 313.451 4.453 20 0 DIADLO FC(F)(F)c1cccc(Cl)c1-c1c[nH+]c2c(c1)CCCN2 ZINC001243971409 1057824441 /nfs/dbraw/zinc/82/44/41/1057824441.db2.gz KMJCFKFNNVYDTB-UHFFFAOYSA-N 1 2 312.722 4.422 20 0 DIADLO COC(=O)c1c(C)cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1C ZINC001243975834 1057826551 /nfs/dbraw/zinc/82/65/51/1057826551.db2.gz CDLBUIBKCGORQF-UHFFFAOYSA-N 1 2 306.365 4.147 20 0 DIADLO COC(=O)c1c[nH]c2ccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)cc21 ZINC001243977441 1057827182 /nfs/dbraw/zinc/82/71/82/1057827182.db2.gz HDWFXQUGMRCYDA-UHFFFAOYSA-N 1 2 317.348 4.012 20 0 DIADLO COc1cnc2cc(-c3ccc(-c4[nH]cc[nH+]4)cc3)ccc2c1 ZINC001243978745 1057827375 /nfs/dbraw/zinc/82/73/75/1057827375.db2.gz LMQCJIXQBCHFHV-UHFFFAOYSA-N 1 2 301.349 4.301 20 0 DIADLO CCOC(=O)CCc1cccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001243980506 1057828304 /nfs/dbraw/zinc/82/83/04/1057828304.db2.gz YRNGYAXFQVVBOZ-UHFFFAOYSA-N 1 2 320.392 4.239 20 0 DIADLO CCOc1ccc(-c2ccccc2Cn2cc[nH+]c2)c(OC)c1 ZINC001244002394 1057835513 /nfs/dbraw/zinc/83/55/13/1057835513.db2.gz OFWCPDASRMEYCE-UHFFFAOYSA-N 1 2 308.381 4.006 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccc3c(c2)CCC(=O)N3C)c1 ZINC001244012114 1057838126 /nfs/dbraw/zinc/83/81/26/1057838126.db2.gz JXXOLCWDBYVZDO-UHFFFAOYSA-N 1 2 322.452 4.417 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(OCC(F)F)cc2)c1 ZINC001244065716 1057855071 /nfs/dbraw/zinc/85/50/71/1057855071.db2.gz AVCUGBROMYQGLC-UHFFFAOYSA-N 1 2 305.324 4.359 20 0 DIADLO COc1cccc(C(F)(F)F)c1-c1cn2cc[nH+]c2cc1C ZINC001244080877 1057861794 /nfs/dbraw/zinc/86/17/94/1057861794.db2.gz MBGWUVLRSRJILM-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO COc1cccc(C(F)(F)F)c1-c1cc(N2CCCC2)cc[nH+]1 ZINC001244084282 1057863278 /nfs/dbraw/zinc/86/32/78/1057863278.db2.gz INSSYXHPLMFQAL-UHFFFAOYSA-N 1 2 322.330 4.376 20 0 DIADLO COc1ccc(-c2ccc(-n3c[nH+]c(C)c3C)nn2)cc1C(C)C ZINC001244130121 1057880806 /nfs/dbraw/zinc/88/08/06/1057880806.db2.gz OWNREVUCNQDAQM-UHFFFAOYSA-N 1 2 322.412 4.078 20 0 DIADLO Cc1cn2c(cccc2-c2ccc(N3CCCCC3)cc2F)[nH+]1 ZINC001244263676 1057915590 /nfs/dbraw/zinc/91/55/90/1057915590.db2.gz AQLPJWUAVVRMBY-UHFFFAOYSA-N 1 2 309.388 4.439 20 0 DIADLO Fc1cc(-c2ccccc2C[NH+]2CCOCC2)c(F)cc1Cl ZINC001244302810 1057928289 /nfs/dbraw/zinc/92/82/89/1057928289.db2.gz RJINYXFTTSBUJZ-UHFFFAOYSA-N 1 2 323.770 4.117 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc3cc[nH]c(=O)c3c2)c1 ZINC001244311909 1057930924 /nfs/dbraw/zinc/93/09/24/1057930924.db2.gz FHIUIBKPOGRMNR-UHFFFAOYSA-N 1 2 301.349 4.008 20 0 DIADLO Cc1cc(F)cc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c1Cl ZINC001244355607 1057941546 /nfs/dbraw/zinc/94/15/46/1057941546.db2.gz KHXRVFTUHFZACQ-UHFFFAOYSA-N 1 2 304.674 4.451 20 0 DIADLO Cc1cccc(NC(=O)c2ccc(-c3ccc[nH+]c3N)cc2)c1C ZINC001244383501 1057947453 /nfs/dbraw/zinc/94/74/53/1057947453.db2.gz PIGJCKHIGISAAH-UHFFFAOYSA-N 1 2 317.392 4.200 20 0 DIADLO Cc1ccc(C)c(NC(=O)c2ccc(-c3ccc[nH+]c3N)cc2)c1 ZINC001244387855 1057948345 /nfs/dbraw/zinc/94/83/45/1057948345.db2.gz GUJQFLXDKMDQOL-UHFFFAOYSA-N 1 2 317.392 4.200 20 0 DIADLO C/C(=C\C=C\[NH3+])c1ccc(C(=O)Nc2cc(C)ccc2C)cc1 ZINC001244389559 1057948917 /nfs/dbraw/zinc/94/89/17/1057948917.db2.gz POYHFXPRRQINGB-CNTHDXSESA-N 1 2 306.409 4.431 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2ccc(Cl)c(C(C)C)c2)cc1 ZINC001244438625 1057958167 /nfs/dbraw/zinc/95/81/67/1057958167.db2.gz FNPGSAOMUAHDEP-QGZVFWFLSA-N 1 2 317.816 4.303 20 0 DIADLO Oc1c(F)cc(-c2cc(C[NH+]3CCCCC3)ccn2)cc1Cl ZINC001244500856 1057977606 /nfs/dbraw/zinc/97/76/06/1057977606.db2.gz OZNUNAMJAJZGAH-UHFFFAOYSA-N 1 2 320.795 4.233 20 0 DIADLO Oc1c(F)cc(-c2cncc(C[NH+]3CCCCC3)c2)cc1Cl ZINC001244502325 1057977977 /nfs/dbraw/zinc/97/79/77/1057977977.db2.gz MNLVTYDPTUAEFN-UHFFFAOYSA-N 1 2 320.795 4.233 20 0 DIADLO CSc1cc(-c2ccn3cc(N)[nH+]c3c2)cc(C(F)(F)F)c1 ZINC001244510062 1057981434 /nfs/dbraw/zinc/98/14/34/1057981434.db2.gz DCVVTOWLQFQEQQ-UHFFFAOYSA-N 1 2 323.343 4.324 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1c(F)c(C)ccc1OC ZINC001244566339 1057997395 /nfs/dbraw/zinc/99/73/95/1057997395.db2.gz AIJOOGJKLUJEKW-UHFFFAOYSA-N 1 2 312.344 4.004 20 0 DIADLO COc1c(F)cc(-c2ccc3[nH+]c(C)cn3c2)cc1C(F)(F)F ZINC001244571817 1057998766 /nfs/dbraw/zinc/99/87/66/1057998766.db2.gz DWRIWYOFAZHILH-UHFFFAOYSA-N 1 2 324.277 4.476 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cccc(Cl)c1CO ZINC001244574933 1057999671 /nfs/dbraw/zinc/99/96/71/1057999671.db2.gz WCPDHGWNSPPKFY-UHFFFAOYSA-N 1 2 316.832 4.193 20 0 DIADLO Cc1cc(Cl)c(N)c(-c2cc(F)c(C[NH+](C)C)c(F)c2)c1 ZINC001244590077 1058003772 /nfs/dbraw/zinc/00/37/72/1058003772.db2.gz PXRXVSQVULLSJO-UHFFFAOYSA-N 1 2 310.775 4.237 20 0 DIADLO CC(=O)c1ccc(F)c(-c2ccc(-c3c[nH+]cn3C)cc2)c1F ZINC001244621754 1058012109 /nfs/dbraw/zinc/01/21/09/1058012109.db2.gz HLGJFFGQKDIQEE-UHFFFAOYSA-N 1 2 312.319 4.235 20 0 DIADLO CNc1cc(-c2ccc(Cl)c(OC(F)(F)F)c2)cc[nH+]1 ZINC001244675102 1058024587 /nfs/dbraw/zinc/02/45/87/1058024587.db2.gz USZOFYKTGWSGTN-UHFFFAOYSA-N 1 2 302.683 4.342 20 0 DIADLO COc1c(F)cc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1Cl ZINC001244699654 1058029837 /nfs/dbraw/zinc/02/98/37/1058029837.db2.gz TWWJYTULRWNWAL-UHFFFAOYSA-N 1 2 316.763 4.400 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccc(CO)c(F)c2F)c1 ZINC001244721360 1058035110 /nfs/dbraw/zinc/03/51/10/1058035110.db2.gz MZCJYNNDKPKNKJ-UHFFFAOYSA-N 1 2 305.368 4.279 20 0 DIADLO Nc1ccc(-c2ccc(F)c(-n3cc[nH+]c3)c2)c(C(F)(F)F)c1 ZINC001244760250 1058042480 /nfs/dbraw/zinc/04/24/80/1058042480.db2.gz KFIQKYBPCRBTEE-UHFFFAOYSA-N 1 2 321.277 4.279 20 0 DIADLO Nc1ccc(-c2ccccc2Cn2cc[nH+]c2)c(C(F)(F)F)c1 ZINC001244757456 1058042496 /nfs/dbraw/zinc/04/24/96/1058042496.db2.gz UTRNDGJIFAVDTN-UHFFFAOYSA-N 1 2 317.314 4.199 20 0 DIADLO c1cn(Cc2ccc(-c3cccc(-c4ccncc4)c3)nc2)c[nH+]1 ZINC001244781650 1058047498 /nfs/dbraw/zinc/04/74/98/1058047498.db2.gz PLBZVVBULVXYGJ-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cc(F)cc(N2CCCCC2)c1 ZINC001244822325 1058053412 /nfs/dbraw/zinc/05/34/12/1058053412.db2.gz PUEGMNKYHZLZBU-UHFFFAOYSA-N 1 2 309.388 4.439 20 0 DIADLO CSc1cc(-c2nc3[nH]ccc3c[nH+]2)ccc1C(F)(F)F ZINC001244848276 1058057475 /nfs/dbraw/zinc/05/74/75/1058057475.db2.gz LRWURTMGWCCWFE-UHFFFAOYSA-N 1 2 309.316 4.317 20 0 DIADLO Cc1c[nH]c2c1cccc2-c1cccc(C[NH+]2CCOCC2)c1F ZINC001244855257 1058058593 /nfs/dbraw/zinc/05/85/93/1058058593.db2.gz UJTYCGKPYQROLG-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO CCOC(=O)c1c[nH]c2nc[nH+]c(-c3ccc(C4CCC4)cc3)c12 ZINC001244940643 1058076146 /nfs/dbraw/zinc/07/61/46/1058076146.db2.gz DYGYFGWSLFDAFJ-UHFFFAOYSA-N 1 2 321.380 4.069 20 0 DIADLO CNc1cc(-c2ccc3cc(C(F)(F)F)cnc3c2)cc[nH+]1 ZINC001244976055 1058084041 /nfs/dbraw/zinc/08/40/41/1058084041.db2.gz NOTCQOMBNMBSCN-UHFFFAOYSA-N 1 2 303.287 4.357 20 0 DIADLO Cc1c(Cl)c(-c2ccc(F)c(-n3cc[nH+]c3)c2)ccc1CO ZINC001244971325 1058084117 /nfs/dbraw/zinc/08/41/17/1058084117.db2.gz DRFKMOYCOCZDBU-UHFFFAOYSA-N 1 2 316.763 4.133 20 0 DIADLO CNc1cc(-c2ccnc3ccc(OC(F)(F)F)cc32)cc[nH+]1 ZINC001244977892 1058084621 /nfs/dbraw/zinc/08/46/21/1058084621.db2.gz LLESYADUPZRCHF-UHFFFAOYSA-N 1 2 319.286 4.237 20 0 DIADLO CNc1cc(-c2ccc3[nH]c(-c4ccccc4)nc3c2)cc[nH+]1 ZINC001244976682 1058084955 /nfs/dbraw/zinc/08/49/55/1058084955.db2.gz OCXCSHSRMVOMOI-UHFFFAOYSA-N 1 2 300.365 4.334 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2cccc(C3CCCC3)c2)cc1 ZINC001244989155 1058087334 /nfs/dbraw/zinc/08/73/34/1058087334.db2.gz RBRKBUGTOCQYDH-IBGZPJMESA-N 1 2 309.409 4.184 20 0 DIADLO c1cc(-c2cncc(C[NH+]3CCOCC3)c2)cc(C2CCCC2)c1 ZINC001244988781 1058087420 /nfs/dbraw/zinc/08/74/20/1058087420.db2.gz NJUOQIMXYWWYHO-UHFFFAOYSA-N 1 2 322.452 4.238 20 0 DIADLO OCc1cc(Cl)c(-c2cc(N3CCCC3)cc[nH+]2)c(Cl)c1 ZINC001245003972 1058090295 /nfs/dbraw/zinc/09/02/95/1058090295.db2.gz JCFHYXHHAOUSIE-UHFFFAOYSA-N 1 2 323.223 4.148 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(F)c(F)cc1Cl ZINC001245021153 1058095592 /nfs/dbraw/zinc/09/55/92/1058095592.db2.gz PPTXGJIXNMWPPE-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO Cc1cc(-c2cc[nH+]c(N3CCOCC3)c2)cc(Cl)c1Cl ZINC001245043112 1058100898 /nfs/dbraw/zinc/10/08/98/1058100898.db2.gz ZTPYQOYAGYGVOY-UHFFFAOYSA-N 1 2 323.223 4.200 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2cc(C)c(Cl)c(Cl)c2)cc1 ZINC001245044712 1058101444 /nfs/dbraw/zinc/10/14/44/1058101444.db2.gz PIXVSBFXWGMJCY-HNNXBMFYSA-N 1 2 324.207 4.142 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2ccc(C)c(Cl)c2Cl)cc1 ZINC001245095489 1058111505 /nfs/dbraw/zinc/11/15/05/1058111505.db2.gz IYVTYYYYZHGIDM-OAHLLOKOSA-N 1 2 324.207 4.142 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cccc(OC(F)(F)F)c1F ZINC001245175157 1058123653 /nfs/dbraw/zinc/12/36/53/1058123653.db2.gz LXRWKRIUZHPBCA-UHFFFAOYSA-N 1 2 310.250 4.347 20 0 DIADLO Cc1cn2c(cccc2-c2cccc(OC(F)(F)F)c2F)[nH+]1 ZINC001245175698 1058123805 /nfs/dbraw/zinc/12/38/05/1058123805.db2.gz QEVMZMIYSXOSEK-UHFFFAOYSA-N 1 2 310.250 4.347 20 0 DIADLO c1ncc(-c2cccc(-c3c[nH+]cn3Cc3ccccc3)c2)o1 ZINC001245196939 1058126205 /nfs/dbraw/zinc/12/62/05/1058126205.db2.gz OKKHLESEVTUUDE-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO CCc1cc(-c2c[nH+]cn2Cc2ccccc2)ccc1NC(C)=O ZINC001245197160 1058126221 /nfs/dbraw/zinc/12/62/21/1058126221.db2.gz OMTHRNVNTRWDQI-UHFFFAOYSA-N 1 2 319.408 4.119 20 0 DIADLO CC(C)[S@](=O)c1ccc(-c2c[nH+]cn2Cc2ccccc2)cc1 ZINC001245197172 1058126314 /nfs/dbraw/zinc/12/63/14/1058126314.db2.gz PWQPHRFZVDJCQV-QHCPKHFHSA-N 1 2 324.449 4.114 20 0 DIADLO Cc1cc(-c2c[nH+]cn2Cc2ccccc2)cc(C)c1N(C)C ZINC001245197486 1058126411 /nfs/dbraw/zinc/12/64/11/1058126411.db2.gz WGFBTFZSQYVUBA-UHFFFAOYSA-N 1 2 305.425 4.281 20 0 DIADLO CC1(C)Oc2ccc(-c3c[nH+]cn3Cc3ccccc3)cc2O1 ZINC001245198407 1058126786 /nfs/dbraw/zinc/12/67/86/1058126786.db2.gz DSISAQNRZHWDOL-UHFFFAOYSA-N 1 2 306.365 4.106 20 0 DIADLO COC(=O)c1cc(C)c(-c2c[nH+]cn2Cc2ccccc2)cc1C ZINC001245200778 1058126803 /nfs/dbraw/zinc/12/68/03/1058126803.db2.gz IETONCQNABGKEA-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO c1ncc(-c2ccc(-c3c[nH+]cn3Cc3ccccc3)cc2)o1 ZINC001245198206 1058126827 /nfs/dbraw/zinc/12/68/27/1058126827.db2.gz UVSQSWJUCIDUAA-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO Cc1ccc2ccc(-c3cncc(C[NH+]4CCOCC4)c3)cc2c1 ZINC001245252341 1058135458 /nfs/dbraw/zinc/13/54/58/1058135458.db2.gz ZEKUAFKWXJTJOQ-UHFFFAOYSA-N 1 2 318.420 4.042 20 0 DIADLO COc1c(-c2ccc3[nH+]ccn3c2C)cccc1C(F)(F)F ZINC001245276993 1058138892 /nfs/dbraw/zinc/13/88/92/1058138892.db2.gz AZDVKRPSGBSUFM-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Cc1cc(-c2cccc(Br)c2F)c2[nH+]ccn2c1 ZINC001245483710 1058177717 /nfs/dbraw/zinc/17/77/17/1058177717.db2.gz HNDZSAHZJBSXDX-UHFFFAOYSA-N 1 2 305.150 4.211 20 0 DIADLO Cc1cc(NC(=O)C=C[C@]2(C)CC[C@H](C)C2(C)C)c(C)c[nH+]1 ZINC001527662914 1058198768 /nfs/dbraw/zinc/19/87/68/1058198768.db2.gz XDPGDQNBFDGNOX-RSPMLXFXSA-N 1 2 300.446 4.077 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1c(F)cc(OC(C)C)cc1F ZINC001245526948 1058202639 /nfs/dbraw/zinc/20/26/39/1058202639.db2.gz MQKVYZNRJOXLRB-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(CC(C)(C)C)CC(C)(C)C)ccn12 ZINC001527718298 1058214522 /nfs/dbraw/zinc/21/45/22/1058214522.db2.gz BDPZBAZELUGXIB-UHFFFAOYSA-N 1 2 315.461 4.177 20 0 DIADLO Cc1cc(-c2nccc3ccc(C(F)(F)F)cc32)c[nH+]c1N ZINC001245535574 1058215087 /nfs/dbraw/zinc/21/50/87/1058215087.db2.gz DYUVHTPZZNJVRD-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1cc(-c2cnc3ccc(C(F)(F)F)cc3c2)c[nH+]c1N ZINC001245537863 1058216455 /nfs/dbraw/zinc/21/64/55/1058216455.db2.gz GFMNFXLLFDWYIQ-UHFFFAOYSA-N 1 2 303.287 4.206 20 0 DIADLO Cc1cc(-c2ccc(-c3nc4ccccc4[nH]3)cc2)c[nH+]c1N ZINC001245537283 1058217221 /nfs/dbraw/zinc/21/72/21/1058217221.db2.gz ANWBLQOHAJDXJF-UHFFFAOYSA-N 1 2 300.365 4.183 20 0 DIADLO Cc1cc(-c2ccc(OC(F)(F)C(F)(F)F)cc2)c[nH+]c1N ZINC001245538959 1058220383 /nfs/dbraw/zinc/22/03/83/1058220383.db2.gz KWOHALAOTNLOIM-UHFFFAOYSA-N 1 2 318.245 4.173 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2cc(C(=O)OC)c(C)cc2C)c1 ZINC001245554981 1058229689 /nfs/dbraw/zinc/22/96/89/1058229689.db2.gz LWHGVXDLGFLIIB-UHFFFAOYSA-N 1 2 311.381 4.119 20 0 DIADLO Clc1cccc2[nH]c(-c3ccc(Cn4cc[nH+]c4)cn3)cc21 ZINC001245581692 1058251198 /nfs/dbraw/zinc/25/11/98/1058251198.db2.gz VYNKXSSTHKFLIK-UHFFFAOYSA-N 1 2 308.772 4.128 20 0 DIADLO C[C@H](CC1CCCCC1)C(=O)N1CCCC[C@@H]1c1c[nH+]cn1C ZINC001548828317 1058262095 /nfs/dbraw/zinc/26/20/95/1058262095.db2.gz OOKFIEZJRXZGPN-NVXWUHKLSA-N 1 2 317.477 4.080 20 0 DIADLO COc1ccc2[nH]c(-c3cc[nH+]c(N4CCCCC4)c3)cc2c1 ZINC001245591346 1058264989 /nfs/dbraw/zinc/26/49/89/1058264989.db2.gz FHQZGBRKRGKAAJ-UHFFFAOYSA-N 1 2 307.397 4.229 20 0 DIADLO COc1ccc2[nH]c(-c3cc(F)c(C[NH+](C)C)c(F)c3)cc2c1 ZINC001245596812 1058271451 /nfs/dbraw/zinc/27/14/51/1058271451.db2.gz IUIXZFZLUNGJGL-UHFFFAOYSA-N 1 2 316.351 4.183 20 0 DIADLO c1nc(C[N@@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@H]32)oc1C1CC1 ZINC001549084558 1058281212 /nfs/dbraw/zinc/28/12/12/1058281212.db2.gz XLJVWVGZPPIONT-SQNIBIBYSA-N 1 2 324.424 4.047 20 0 DIADLO c1nc(C[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@H]32)oc1C1CC1 ZINC001549084558 1058281226 /nfs/dbraw/zinc/28/12/26/1058281226.db2.gz XLJVWVGZPPIONT-SQNIBIBYSA-N 1 2 324.424 4.047 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)cc1-c1cccc2ccoc21 ZINC001245616563 1058287011 /nfs/dbraw/zinc/28/70/11/1058287011.db2.gz CPHXOEZQJYVEEG-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1ccn2cc[nH+]c2c1)c1ccccc1 ZINC001527995428 1058292170 /nfs/dbraw/zinc/29/21/70/1058292170.db2.gz FPGYVPPOINDDJR-KRWDZBQOSA-N 1 2 307.397 4.103 20 0 DIADLO CC(C)C1=[NH+]CCc2ccc(-c3cc(O)c(F)c(F)c3F)cc21 ZINC001245638028 1058303135 /nfs/dbraw/zinc/30/31/35/1058303135.db2.gz BQRWWNKHVTZEAK-UHFFFAOYSA-N 1 2 319.326 4.478 20 0 DIADLO c1oc(C2CC2)nc1C[N@@H+]1CCC[C@H]2O[C@H](c3ccccc3)C[C@H]21 ZINC001550134206 1058319308 /nfs/dbraw/zinc/31/93/08/1058319308.db2.gz KUYSMWKWHUYBNP-QRVBRYPASA-N 1 2 324.424 4.047 20 0 DIADLO c1oc(C2CC2)nc1C[N@H+]1CCC[C@H]2O[C@H](c3ccccc3)C[C@H]21 ZINC001550134206 1058319323 /nfs/dbraw/zinc/31/93/23/1058319323.db2.gz KUYSMWKWHUYBNP-QRVBRYPASA-N 1 2 324.424 4.047 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3c(Cl)cccc3Cl)nn2)c1C ZINC001245672812 1058332123 /nfs/dbraw/zinc/33/21/23/1058332123.db2.gz GEDIURBMXXPMCX-UHFFFAOYSA-N 1 2 319.195 4.253 20 0 DIADLO CCc1ncc(C[N@@H+]2CCCC[C@@H]2c2nc(C)c(C)s2)o1 ZINC001550530493 1058345096 /nfs/dbraw/zinc/34/50/96/1058345096.db2.gz DCPHPGNAHJYKDQ-CQSZACIVSA-N 1 2 305.447 4.038 20 0 DIADLO CCc1ncc(C[N@H+]2CCCC[C@@H]2c2nc(C)c(C)s2)o1 ZINC001550530493 1058345117 /nfs/dbraw/zinc/34/51/17/1058345117.db2.gz DCPHPGNAHJYKDQ-CQSZACIVSA-N 1 2 305.447 4.038 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2Cc2cnc(F)c(C)c2)sc1C ZINC001550624383 1058351263 /nfs/dbraw/zinc/35/12/63/1058351263.db2.gz WNLMZKTZEQVSRR-OAHLLOKOSA-N 1 2 319.449 4.330 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2Cc2cnc(F)c(C)c2)sc1C ZINC001550624383 1058351282 /nfs/dbraw/zinc/35/12/82/1058351282.db2.gz WNLMZKTZEQVSRR-OAHLLOKOSA-N 1 2 319.449 4.330 20 0 DIADLO CCn1c[nH+]cc1[C@@H]1CCCCN1C(=O)CC1C(C)(C)C1(C)C ZINC001550783267 1058356438 /nfs/dbraw/zinc/35/64/38/1058356438.db2.gz FMJVCGVMFKWOQP-AWEZNQCLSA-N 1 2 317.477 4.029 20 0 DIADLO CCC(=CC(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1)CC ZINC001518865269 1058380070 /nfs/dbraw/zinc/38/00/70/1058380070.db2.gz DRBVQXHOTBNHSC-INIZCTEOSA-N 1 2 317.477 4.091 20 0 DIADLO Cc1cc(N2CC[C@@H](c3ccccc3)O[C@H](C)C2)nc(C2CC2)[nH+]1 ZINC001551229497 1058382819 /nfs/dbraw/zinc/38/28/19/1058382819.db2.gz UWAWYIDCBKOPAH-QAPCUYQASA-N 1 2 323.440 4.019 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(Cl)s2)CC[C@@H](c2ccccc2)O1 ZINC001551397122 1058394941 /nfs/dbraw/zinc/39/49/41/1058394941.db2.gz UKQOMTCADXCYSG-DOMZBBRYSA-N 1 2 322.861 4.149 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(Cl)s2)CC[C@@H](c2ccccc2)O1 ZINC001551397122 1058394956 /nfs/dbraw/zinc/39/49/56/1058394956.db2.gz UKQOMTCADXCYSG-DOMZBBRYSA-N 1 2 322.861 4.149 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1c(F)ccc(Cl)c1F ZINC001245722776 1058397209 /nfs/dbraw/zinc/39/72/09/1058397209.db2.gz BWGMMKHHTGUEEX-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@@H]2C(C)(C)C)[nH+]c1C ZINC001551738157 1058408299 /nfs/dbraw/zinc/40/82/99/1058408299.db2.gz HMANDAFEZVIEET-CABCVRRESA-N 1 2 311.429 4.314 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@@H]2C2CCCC2)[nH+]c1C ZINC001551741510 1058408390 /nfs/dbraw/zinc/40/83/90/1058408390.db2.gz PSMYDPDPDWIXSV-SJORKVTESA-N 1 2 323.440 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C[C@@H]2CCC[C@H]2C)[nH+]c1C ZINC001551740743 1058409071 /nfs/dbraw/zinc/40/90/71/1058409071.db2.gz OCPAHWZMNKDDDA-DOMZBBRYSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@H]2C(C)(C)C)[nH+]c1C ZINC001551738164 1058409528 /nfs/dbraw/zinc/40/95/28/1058409528.db2.gz HMANDAFEZVIEET-HUUCEWRRSA-N 1 2 311.429 4.314 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)CCC(C)(F)F)[nH+]c1C ZINC001551745300 1058411539 /nfs/dbraw/zinc/41/15/39/1058411539.db2.gz FURDXEJFLBEMGC-UHFFFAOYSA-N 1 2 307.344 4.067 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(Cl)c(F)c1F ZINC001245741612 1058422221 /nfs/dbraw/zinc/42/22/21/1058422221.db2.gz PYSBVQZVLUPFNP-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N[C@H]1CCO[C@H](c2ccccn2)C1 ZINC001553702325 1058499815 /nfs/dbraw/zinc/49/98/15/1058499815.db2.gz QWFWNIGVWHUXJC-LPHOPBHVSA-N 1 2 319.408 4.270 20 0 DIADLO COc1cc(-c2nc3[nH]ccc3c[nH+]2)ccc1Oc1ccccc1 ZINC001245816809 1058504454 /nfs/dbraw/zinc/50/44/54/1058504454.db2.gz FYSVRTIERSRBME-UHFFFAOYSA-N 1 2 317.348 4.377 20 0 DIADLO CCOc1cc(-c2ccccc2Cn2cc[nH+]c2)c(Cl)cn1 ZINC001245817752 1058506096 /nfs/dbraw/zinc/50/60/96/1058506096.db2.gz SQYXMPFTBSESRG-UHFFFAOYSA-N 1 2 313.788 4.046 20 0 DIADLO CCOc1c(F)cc(-c2cn3cc[nH+]c3cc2OC)cc1Cl ZINC001245823297 1058517054 /nfs/dbraw/zinc/51/70/54/1058517054.db2.gz UTCSCOOWWXOCGF-UHFFFAOYSA-N 1 2 320.751 4.201 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1noc([C@H]2CC[C@@H](c3ccccc3)C2)n1 ZINC001554099452 1058517400 /nfs/dbraw/zinc/51/74/00/1058517400.db2.gz RYFBKVRGIQGTPQ-CABCVRRESA-N 1 2 320.396 4.074 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1noc([C@H]2CC[C@@H](c3ccccc3)C2)n1 ZINC001554098281 1058518711 /nfs/dbraw/zinc/51/87/11/1058518711.db2.gz BHWVKQUGCYCHBW-CABCVRRESA-N 1 2 320.396 4.074 20 0 DIADLO Cc1ccc(-c2c[nH+]c(N3CCOCC3)c(C)c2)c(C)c1Cl ZINC001245827829 1058524486 /nfs/dbraw/zinc/52/44/86/1058524486.db2.gz ZITNAEFROAYAFY-UHFFFAOYSA-N 1 2 316.832 4.164 20 0 DIADLO Cc1cccc(NC(=O)[C@H](c2ccc(Cl)cc2)[NH+](C)C)c1F ZINC001520503435 1058624913 /nfs/dbraw/zinc/62/49/13/1058624913.db2.gz PKNRTUKXAVQOED-INIZCTEOSA-N 1 2 320.795 4.029 20 0 DIADLO CC(C)C[C@H](C)C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001529257332 1058656748 /nfs/dbraw/zinc/65/67/48/1058656748.db2.gz QDMNOEAOMOWCCN-HOTGVXAUSA-N 1 2 319.493 4.026 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3ccccc3C)cc2)[nH+]c1C ZINC001558132661 1058843399 /nfs/dbraw/zinc/84/33/99/1058843399.db2.gz GNTLLCYNLILXQE-UHFFFAOYSA-N 1 2 305.381 4.254 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)C=C2CCC(C)(C)CC2)[nH+]c1C ZINC001558351042 1058861019 /nfs/dbraw/zinc/86/10/19/1058861019.db2.gz FTMVHZDGYFUIEG-INIZCTEOSA-N 1 2 315.461 4.217 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)C1=C(c2ccccc2)CCCC1 ZINC001521674237 1058938776 /nfs/dbraw/zinc/93/87/76/1058938776.db2.gz VQBXNJLHNZGANE-UHFFFAOYSA-N 1 2 317.392 4.301 20 0 DIADLO CCn1c(CNc2cc(C)[nH+]c(C3CCC3)n2)nc2ccccc21 ZINC001559055247 1058953984 /nfs/dbraw/zinc/95/39/84/1058953984.db2.gz GEGXQKMVQIFTFE-UHFFFAOYSA-N 1 2 321.428 4.034 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2NCCCCc1ccccc1 ZINC001559059740 1058956591 /nfs/dbraw/zinc/95/65/91/1058956591.db2.gz CXCRLSQGBDHXJP-UHFFFAOYSA-N 1 2 323.444 4.016 20 0 DIADLO CCCC1CCC(Nc2[nH+]cnc3c2cnn3C(C)(C)C)CC1 ZINC001559081059 1058970541 /nfs/dbraw/zinc/97/05/41/1058970541.db2.gz FPPXOWYAWUUSFB-UHFFFAOYSA-N 1 2 315.465 4.352 20 0 DIADLO CC[C@H](CNc1[nH+]cnc2c1cnn2C(C)(C)C)c1ccccc1 ZINC001559089328 1058979110 /nfs/dbraw/zinc/97/91/10/1058979110.db2.gz JBVAEIJAKZPIOY-CQSZACIVSA-N 1 2 323.444 4.187 20 0 DIADLO CCc1cc(N2CCC[C@H](c3ccccc3)CC2)nc(CC)[nH+]1 ZINC001559094483 1058984411 /nfs/dbraw/zinc/98/44/11/1058984411.db2.gz RCLYAGPATAIDRZ-KRWDZBQOSA-N 1 2 309.457 4.376 20 0 DIADLO CCc1cc(NCC(C)(C)c2ccccc2F)nc(CC)[nH+]1 ZINC001559093760 1058985289 /nfs/dbraw/zinc/98/52/89/1058985289.db2.gz OKBRAHUEDVMMJD-UHFFFAOYSA-N 1 2 301.409 4.130 20 0 DIADLO CCO[C@H]1C[C@H](Nc2cc(C)[nH+]c(C3CC3)n2)C12CCCCC2 ZINC001559105640 1058990983 /nfs/dbraw/zinc/99/09/83/1058990983.db2.gz XEHRBWJAHZPPEQ-HOTGVXAUSA-N 1 2 315.461 4.202 20 0 DIADLO C[C@H](Nc1nc2ccccc2n2c[nH+]cc12)c1ccc(F)c(F)c1 ZINC001559109931 1058995346 /nfs/dbraw/zinc/99/53/46/1058995346.db2.gz KANNVVVQLUQEGJ-NSHDSACASA-N 1 2 324.334 4.334 20 0 DIADLO C[C@H](CC(=O)N1Cc2ccccc2-c2ccccc21)n1cc[nH+]c1 ZINC001530291325 1058995883 /nfs/dbraw/zinc/99/58/83/1058995883.db2.gz ZDSJHPPFACNKAJ-OAHLLOKOSA-N 1 2 317.392 4.048 20 0 DIADLO CCc1ncnc(Nc2ccc([NH+]3CCC(C)CC3)cc2)c1F ZINC001559112769 1059001250 /nfs/dbraw/zinc/00/12/50/1059001250.db2.gz KRRWUMWTYWVOFW-UHFFFAOYSA-N 1 2 314.408 4.158 20 0 DIADLO CCc1cc(N2C[C@@H](c3ccccc3C)C[C@H]2C)nc(CC)[nH+]1 ZINC001559114325 1059001671 /nfs/dbraw/zinc/00/16/71/1059001671.db2.gz PMUAODXQETZRHY-CVEARBPZSA-N 1 2 309.457 4.292 20 0 DIADLO CO[C@@]1(C)C[C@H](N(C)c2cc(C(C)C)[nH+]c(C(C)C)n2)C1(C)C ZINC001559125176 1059013230 /nfs/dbraw/zinc/01/32/30/1059013230.db2.gz FRHQXHKPJDHPOL-KXBFYZLASA-N 1 2 319.493 4.363 20 0 DIADLO C[C@@H](Nc1nc2ccccc2n2c[nH+]cc12)c1ccc(F)cc1F ZINC001559127933 1059015928 /nfs/dbraw/zinc/01/59/28/1059015928.db2.gz BMVYENPYRROMPI-LLVKDONJSA-N 1 2 324.334 4.334 20 0 DIADLO Cc1cc(N2CCc3cccc(F)c3[C@@H]2C)nc(C2CCC2)[nH+]1 ZINC001559161638 1059047246 /nfs/dbraw/zinc/04/72/46/1059047246.db2.gz HRINIWICIXPCSA-ZDUSSCGKSA-N 1 2 311.404 4.315 20 0 DIADLO Cc1cccc(COc2ccc(CNc3cc[nH+]c(C)n3)cc2)c1 ZINC001559164491 1059048235 /nfs/dbraw/zinc/04/82/35/1059048235.db2.gz HYYKBYORIMKFAX-UHFFFAOYSA-N 1 2 319.408 4.285 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)N(c3nc(C)[nH+]c4c3CCCC4)C2)cc1 ZINC001559179059 1059062155 /nfs/dbraw/zinc/06/21/55/1059062155.db2.gz KSUUBCBHIMDSCK-YJBOKZPZSA-N 1 2 321.468 4.355 20 0 DIADLO Cc1cccc(CCCNc2nc(C3CCCCC3)ns2)[nH+]1 ZINC001559185850 1059069978 /nfs/dbraw/zinc/06/99/78/1059069978.db2.gz IAWHRQHMXRETQZ-UHFFFAOYSA-N 1 2 316.474 4.334 20 0 DIADLO Cc1nc(N2CCC(c3c(Cl)cccc3Cl)CC2)cc[nH+]1 ZINC001559203667 1059084702 /nfs/dbraw/zinc/08/47/02/1059084702.db2.gz ZGWYQPALUZSHMW-UHFFFAOYSA-N 1 2 322.239 4.476 20 0 DIADLO Cc1nc(N2CC3(CCCCC3)[C@@H]2C(C)C)c2c([nH+]1)CCCC2 ZINC001559208632 1059088619 /nfs/dbraw/zinc/08/86/19/1059088619.db2.gz QNVTXAPDHTZQHW-SFHVURJKSA-N 1 2 313.489 4.459 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(Nc3ccc4c(c3)[C@H](O)CCCC4)c12 ZINC001559231663 1059109250 /nfs/dbraw/zinc/10/92/50/1059109250.db2.gz CLUZQHOZKCPGFN-MRXNPFEDSA-N 1 2 322.412 4.024 20 0 DIADLO Cc1cc(N(Cc2ccccc2F)CC2CC2)nc(C2CC2)[nH+]1 ZINC001559239599 1059114005 /nfs/dbraw/zinc/11/40/05/1059114005.db2.gz GMYWQVSHRZFPJW-UHFFFAOYSA-N 1 2 311.404 4.218 20 0 DIADLO Cc1nc(NCC2(C(F)(F)F)CCCC2)c2c([nH+]1)CCCC2 ZINC001559250005 1059123073 /nfs/dbraw/zinc/12/30/73/1059123073.db2.gz PMNOQHIZXPAWFX-UHFFFAOYSA-N 1 2 313.367 4.198 20 0 DIADLO O[C@@H](CSc1[nH+]cc2ccccn21)c1cccc2ccccc21 ZINC001559323984 1059162086 /nfs/dbraw/zinc/16/20/86/1059162086.db2.gz XGOLLXWJYMRCNP-SFHVURJKSA-N 1 2 320.417 4.313 20 0 DIADLO CCCN(Cc1ccc(C)cc1)C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC001523023110 1059176313 /nfs/dbraw/zinc/17/63/13/1059176313.db2.gz PFRKQILMYAFOPA-UHFFFAOYSA-N 1 2 321.424 4.004 20 0 DIADLO Cc1ccc(SCc2c[nH+]c(N(C)C)c3ccccc23)nc1 ZINC001559359367 1059182521 /nfs/dbraw/zinc/18/25/21/1059182521.db2.gz BKHKKLCXTHJIOS-UHFFFAOYSA-N 1 2 309.438 4.297 20 0 DIADLO Cc1ccc2[nH+]c(CS[C@@H]3CCOc4ccccc43)cn2c1 ZINC001559384710 1059198233 /nfs/dbraw/zinc/19/82/33/1059198233.db2.gz RBGKKRWVXXXVBG-QGZVFWFLSA-N 1 2 310.422 4.400 20 0 DIADLO Cc1cc(C)nc(SCc2ccc(-n3cc[nH+]c3)cc2C)c1 ZINC001559399055 1059206745 /nfs/dbraw/zinc/20/67/45/1059206745.db2.gz UXEBSLQUPVGAIW-UHFFFAOYSA-N 1 2 309.438 4.485 20 0 DIADLO CC(C)(C)c1c[nH]c(SCc2ccc(-n3cc[nH+]c3)cc2)n1 ZINC001559451994 1059239362 /nfs/dbraw/zinc/23/93/62/1059239362.db2.gz WCEAOSYNDTVWPI-UHFFFAOYSA-N 1 2 312.442 4.185 20 0 DIADLO CCC[C@H](C(=O)OCC)[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC001559486765 1059260831 /nfs/dbraw/zinc/26/08/31/1059260831.db2.gz FMWKKJRMZSBWQX-CQSZACIVSA-N 1 2 318.244 4.157 20 0 DIADLO CCC[C@H](C(=O)OCC)[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC001559486765 1059260848 /nfs/dbraw/zinc/26/08/48/1059260848.db2.gz FMWKKJRMZSBWQX-CQSZACIVSA-N 1 2 318.244 4.157 20 0 DIADLO CC(C)(C)OC(=O)C[N@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC001559506556 1059296048 /nfs/dbraw/zinc/29/60/48/1059296048.db2.gz FXGNKSLNSKNYHR-UHFFFAOYSA-N 1 2 323.436 4.271 20 0 DIADLO CC(C)(C)OC(=O)C[N@@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC001559506556 1059296067 /nfs/dbraw/zinc/29/60/67/1059296067.db2.gz FXGNKSLNSKNYHR-UHFFFAOYSA-N 1 2 323.436 4.271 20 0 DIADLO COC(=O)[C@H](c1ccccc1F)[N@@H+]1CCCC2(CCCCC2)C1 ZINC001559528861 1059331113 /nfs/dbraw/zinc/33/11/13/1059331113.db2.gz VKOUNWFRKWXWGX-KRWDZBQOSA-N 1 2 319.420 4.086 20 0 DIADLO COC(=O)[C@H](c1ccccc1F)[N@H+]1CCCC2(CCCCC2)C1 ZINC001559528861 1059331133 /nfs/dbraw/zinc/33/11/33/1059331133.db2.gz VKOUNWFRKWXWGX-KRWDZBQOSA-N 1 2 319.420 4.086 20 0 DIADLO CCc1ccc(NC(=S)Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC001247294716 1059371758 /nfs/dbraw/zinc/37/17/58/1059371758.db2.gz UUKTWSRBLWLQAI-UHFFFAOYSA-N 1 2 310.426 4.014 20 0 DIADLO CCc1ccc(NC(=S)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC001247333084 1059383190 /nfs/dbraw/zinc/38/31/90/1059383190.db2.gz KUYMHOOXINGGQB-UHFFFAOYSA-N 1 2 322.437 4.244 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@@H]3CC[C@@H]4CCCC[C@H]4C3)ccn12 ZINC001523968611 1059405055 /nfs/dbraw/zinc/40/50/55/1059405055.db2.gz XNNQSTSIXKVGCK-YQQAZPJKSA-N 1 2 312.413 4.158 20 0 DIADLO COc1ccc(C[N@@H+]2CCOC3(C2)CCCCCC3)cc1Cl ZINC001559596107 1059428178 /nfs/dbraw/zinc/42/81/78/1059428178.db2.gz OJFYZABBBMPWDF-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO COc1ccc(C[N@H+]2CCOC3(C2)CCCCCC3)cc1Cl ZINC001559596107 1059428183 /nfs/dbraw/zinc/42/81/83/1059428183.db2.gz OJFYZABBBMPWDF-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@H](CC(C)C)C1 ZINC001559649344 1059476131 /nfs/dbraw/zinc/47/61/31/1059476131.db2.gz DOLSWWDYLVHWNM-RHSMWYFYSA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@H](CC(C)C)C1 ZINC001559649344 1059476138 /nfs/dbraw/zinc/47/61/38/1059476138.db2.gz DOLSWWDYLVHWNM-RHSMWYFYSA-N 1 2 323.864 4.312 20 0 DIADLO Cc1cc(C)nc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@H]2C)c1 ZINC001559650861 1059478573 /nfs/dbraw/zinc/47/85/73/1059478573.db2.gz QNGPMIJYEXHPNB-CYBMUJFWSA-N 1 2 302.368 4.096 20 0 DIADLO Cc1cc(C)nc(C[N@H+]2CCc3c(F)cc(F)cc3[C@H]2C)c1 ZINC001559650861 1059478580 /nfs/dbraw/zinc/47/85/80/1059478580.db2.gz QNGPMIJYEXHPNB-CYBMUJFWSA-N 1 2 302.368 4.096 20 0 DIADLO CC[C@H](C)[C@@H](C(=O)OC)[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001559659800 1059488407 /nfs/dbraw/zinc/48/84/07/1059488407.db2.gz AINNTENNTMHETQ-GUYCJALGSA-N 1 2 321.848 4.017 20 0 DIADLO CC[C@H](C)[C@@H](C(=O)OC)[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001559659800 1059488424 /nfs/dbraw/zinc/48/84/24/1059488424.db2.gz AINNTENNTMHETQ-GUYCJALGSA-N 1 2 321.848 4.017 20 0 DIADLO Cc1nn(C)c(Cl)c1C[NH2+][C@H](C)c1cc(Cl)ccc1F ZINC001559681159 1059509735 /nfs/dbraw/zinc/50/97/35/1059509735.db2.gz YUFXFIKUELYMKT-MRVPVSSYSA-N 1 2 316.207 4.025 20 0 DIADLO CC[C@]1(C)COCC[N@@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001559713728 1059541014 /nfs/dbraw/zinc/54/10/14/1059541014.db2.gz XLYYWAAODDHJIA-OAHLLOKOSA-N 1 2 302.245 4.037 20 0 DIADLO CC[C@]1(C)COCC[N@H+]1CCc1cc(Cl)cc(Cl)c1 ZINC001559713728 1059541030 /nfs/dbraw/zinc/54/10/30/1059541030.db2.gz XLYYWAAODDHJIA-OAHLLOKOSA-N 1 2 302.245 4.037 20 0 DIADLO Cc1cc(C)c(C(=O)N(C)Cc2ccc(C(C)C)cc2)c(C)[nH+]1 ZINC001524617109 1059556531 /nfs/dbraw/zinc/55/65/31/1059556531.db2.gz LARQNXAPIQHCOT-UHFFFAOYSA-N 1 2 310.441 4.402 20 0 DIADLO C/C(=C/c1ccccc1Cl)C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001524618983 1059557864 /nfs/dbraw/zinc/55/78/64/1059557864.db2.gz GLOBTYTZJIXGQQ-BENRWUELSA-N 1 2 311.772 4.030 20 0 DIADLO CCCCc1ccc(-c2noc([C@@H]([NH3+])c3ccccc3)n2)cc1 ZINC001247651096 1059586828 /nfs/dbraw/zinc/58/68/28/1059586828.db2.gz KSNWXOGVNMYOFZ-KRWDZBQOSA-N 1 2 307.397 4.127 20 0 DIADLO Cc1ccc(-c2noc([C@H]([NH3+])c3ccccc3)n2)c2ccccc12 ZINC001247651935 1059590632 /nfs/dbraw/zinc/59/06/32/1059590632.db2.gz QANBSOBAXVZTET-GOSISDBHSA-N 1 2 315.376 4.246 20 0 DIADLO CC1=CC[C@@H](c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)CC1 ZINC001247762363 1059615955 /nfs/dbraw/zinc/61/59/55/1059615955.db2.gz GTQQLJJALBYZEY-OAHLLOKOSA-N 1 2 306.369 4.136 20 0 DIADLO Cn1nc(C[NH+]2CCC(c3cccc(Cl)c3)CC2)cc1Cl ZINC001559784026 1059617370 /nfs/dbraw/zinc/61/73/70/1059617370.db2.gz JASLAZCUTFUXBH-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@](F)(c3ccccc3C)C2)nc1Cl ZINC001559787050 1059621429 /nfs/dbraw/zinc/62/14/29/1059621429.db2.gz RORAHUQDCFTJEW-GOSISDBHSA-N 1 2 318.823 4.423 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@](F)(c3ccccc3C)C2)nc1Cl ZINC001559787050 1059621444 /nfs/dbraw/zinc/62/14/44/1059621444.db2.gz RORAHUQDCFTJEW-GOSISDBHSA-N 1 2 318.823 4.423 20 0 DIADLO C[C@@H](C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CCC1 ZINC001532440150 1059631846 /nfs/dbraw/zinc/63/18/46/1059631846.db2.gz PZPKAIQIAUXRLI-CQSZACIVSA-N 1 2 324.424 4.228 20 0 DIADLO C[C@@]1(C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)C=CCC1 ZINC001524815178 1059637970 /nfs/dbraw/zinc/63/79/70/1059637970.db2.gz ISXWNBJGCLKIPZ-HXUWFJFHSA-N 1 2 321.424 4.181 20 0 DIADLO CO[C@H](CC(C)C)C[N@@H+]1CCn2c(cc3ccc(Cl)cc32)C1 ZINC001559804734 1059638326 /nfs/dbraw/zinc/63/83/26/1059638326.db2.gz VDEGROVQZMPTHK-QGZVFWFLSA-N 1 2 320.864 4.171 20 0 DIADLO CO[C@H](CC(C)C)C[N@H+]1CCn2c(cc3ccc(Cl)cc32)C1 ZINC001559804734 1059638336 /nfs/dbraw/zinc/63/83/36/1059638336.db2.gz VDEGROVQZMPTHK-QGZVFWFLSA-N 1 2 320.864 4.171 20 0 DIADLO C[N@@H+](Cc1c(F)cccc1F)C[C@H]1CC2(CO1)CCCCC2 ZINC001559857719 1059680201 /nfs/dbraw/zinc/68/02/01/1059680201.db2.gz RZVSOPLLQCGEFR-CQSZACIVSA-N 1 2 309.400 4.136 20 0 DIADLO C[N@H+](Cc1c(F)cccc1F)C[C@H]1CC2(CO1)CCCCC2 ZINC001559857719 1059680209 /nfs/dbraw/zinc/68/02/09/1059680209.db2.gz RZVSOPLLQCGEFR-CQSZACIVSA-N 1 2 309.400 4.136 20 0 DIADLO FC(F)(F)c1cccc(N(CCCn2cc[nH+]c2)CC2CC2)c1 ZINC001559883825 1059704645 /nfs/dbraw/zinc/70/46/45/1059704645.db2.gz BUJSPOMGORLIGF-UHFFFAOYSA-N 1 2 323.362 4.209 20 0 DIADLO CN(C)c1ccccc1C[N@H+](C)Cc1cc(F)ccc1Cl ZINC001559887605 1059705993 /nfs/dbraw/zinc/70/59/93/1059705993.db2.gz QFCILDUHCODCTE-UHFFFAOYSA-N 1 2 306.812 4.177 20 0 DIADLO CN(C)c1ccccc1C[N@@H+](C)Cc1cc(F)ccc1Cl ZINC001559887605 1059706010 /nfs/dbraw/zinc/70/60/10/1059706010.db2.gz QFCILDUHCODCTE-UHFFFAOYSA-N 1 2 306.812 4.177 20 0 DIADLO Cc1ccc2c(c1C)N(Cc1ccc(-n3cc[nH+]c3)cc1)CCC2 ZINC001559914623 1059727099 /nfs/dbraw/zinc/72/70/99/1059727099.db2.gz DYNWIXPWBGFTOM-UHFFFAOYSA-N 1 2 317.436 4.442 20 0 DIADLO C[N@H+](Cc1nccc(Cl)c1Cl)C1CC(OC(C)(C)C)C1 ZINC001559920329 1059733301 /nfs/dbraw/zinc/73/33/01/1059733301.db2.gz HBTHTCBEJHPFHY-UHFFFAOYSA-N 1 2 317.260 4.166 20 0 DIADLO C[N@@H+](Cc1nccc(Cl)c1Cl)C1CC(OC(C)(C)C)C1 ZINC001559920329 1059733319 /nfs/dbraw/zinc/73/33/19/1059733319.db2.gz HBTHTCBEJHPFHY-UHFFFAOYSA-N 1 2 317.260 4.166 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2noc(C3CC3)n2)CC(C)C)c(C)c1 ZINC001559935450 1059747413 /nfs/dbraw/zinc/74/74/13/1059747413.db2.gz JQBKHHQOHMYEFD-UHFFFAOYSA-N 1 2 313.445 4.222 20 0 DIADLO Cc1ccc(C[N@H+](Cc2noc(C3CC3)n2)CC(C)C)c(C)c1 ZINC001559935450 1059747431 /nfs/dbraw/zinc/74/74/31/1059747431.db2.gz JQBKHHQOHMYEFD-UHFFFAOYSA-N 1 2 313.445 4.222 20 0 DIADLO CC[C@H]1C[N@@H+](CCc2cc(Cl)cc(Cl)c2)[C@H](C)CO1 ZINC001559963455 1059768546 /nfs/dbraw/zinc/76/85/46/1059768546.db2.gz STPQKYZWWTUPEE-ABAIWWIYSA-N 1 2 302.245 4.035 20 0 DIADLO Cc1ccc(F)cc1C[NH2+][C@H](Cc1ccccc1)c1ncco1 ZINC001559945193 1059757923 /nfs/dbraw/zinc/75/79/23/1059757923.db2.gz KYVBXKVXNHDLTR-GOSISDBHSA-N 1 2 310.372 4.196 20 0 DIADLO FCc1ccccc1C[NH2+][C@@H](Cc1ccccc1)c1ncco1 ZINC001559945511 1059760834 /nfs/dbraw/zinc/76/08/34/1059760834.db2.gz WGWGDTUTYOQXII-SFHVURJKSA-N 1 2 310.372 4.218 20 0 DIADLO CC[C@@H]1C[N@H+](CCc2cc(Cl)cc(Cl)c2)[C@H](C)CO1 ZINC001559963456 1059768280 /nfs/dbraw/zinc/76/82/80/1059768280.db2.gz STPQKYZWWTUPEE-IAQYHMDHSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1C[N@@H+](CCc2cc(Cl)cc(Cl)c2)[C@H](C)CO1 ZINC001559963456 1059768293 /nfs/dbraw/zinc/76/82/93/1059768293.db2.gz STPQKYZWWTUPEE-IAQYHMDHSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1C[N@H+](CCc2cc(Cl)cc(Cl)c2)[C@H](C)CO1 ZINC001559963455 1059768528 /nfs/dbraw/zinc/76/85/28/1059768528.db2.gz STPQKYZWWTUPEE-ABAIWWIYSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1C[N@H+](CCc2c(Cl)cccc2Cl)[C@@H](CC)CO1 ZINC001559973025 1059779831 /nfs/dbraw/zinc/77/98/31/1059779831.db2.gz CFEBKHAMPAVKKQ-STQMWFEESA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)[C@@H](CC)CO1 ZINC001559973025 1059779849 /nfs/dbraw/zinc/77/98/49/1059779849.db2.gz CFEBKHAMPAVKKQ-STQMWFEESA-N 1 2 316.272 4.425 20 0 DIADLO C[C@@H](CSc1ccccc1)[N@H+](C)Cc1scnc1Cl ZINC001559973109 1059780094 /nfs/dbraw/zinc/78/00/94/1059780094.db2.gz DXPDZDUPCRTDGL-NSHDSACASA-N 1 2 312.891 4.409 20 0 DIADLO C[C@@H](CSc1ccccc1)[N@@H+](C)Cc1scnc1Cl ZINC001559973109 1059780114 /nfs/dbraw/zinc/78/01/14/1059780114.db2.gz DXPDZDUPCRTDGL-NSHDSACASA-N 1 2 312.891 4.409 20 0 DIADLO Cc1ccc([N@@H+](CCc2ccc(C(N)=O)cc2)CC(C)C)c(C)c1 ZINC001559971012 1059781946 /nfs/dbraw/zinc/78/19/46/1059781946.db2.gz VLKXLWRBGDKRCU-UHFFFAOYSA-N 1 2 324.468 4.107 20 0 DIADLO Cc1ccc([N@H+](CCc2ccc(C(N)=O)cc2)CC(C)C)c(C)c1 ZINC001559971012 1059781963 /nfs/dbraw/zinc/78/19/63/1059781963.db2.gz VLKXLWRBGDKRCU-UHFFFAOYSA-N 1 2 324.468 4.107 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+]1CCO[C@@](C)(C2CC2)C1 ZINC001559992793 1059799302 /nfs/dbraw/zinc/79/93/02/1059799302.db2.gz ILEGDELGNKCFJD-BLLLJJGKSA-N 1 2 324.262 4.011 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+]1CCO[C@@](C)(C2CC2)C1 ZINC001559992793 1059799321 /nfs/dbraw/zinc/79/93/21/1059799321.db2.gz ILEGDELGNKCFJD-BLLLJJGKSA-N 1 2 324.262 4.011 20 0 DIADLO Fc1cc(F)cc([C@H]2COCC[N@@H+]2CC2CCCCCC2)c1 ZINC001560002846 1059805159 /nfs/dbraw/zinc/80/51/59/1059805159.db2.gz ZLBGCUFJTLUMEX-GOSISDBHSA-N 1 2 309.400 4.309 20 0 DIADLO Fc1cc(F)cc([C@H]2COCC[N@H+]2CC2CCCCCC2)c1 ZINC001560002846 1059805186 /nfs/dbraw/zinc/80/51/86/1059805186.db2.gz ZLBGCUFJTLUMEX-GOSISDBHSA-N 1 2 309.400 4.309 20 0 DIADLO Fc1cccc([C@@H]2COCC[N@@H+]2CCSC2CCCCC2)c1 ZINC001560002240 1059805427 /nfs/dbraw/zinc/80/54/27/1059805427.db2.gz JRRRBZMYEJWWRV-SFHVURJKSA-N 1 2 323.477 4.265 20 0 DIADLO Fc1cccc([C@@H]2COCC[N@H+]2CCSC2CCCCC2)c1 ZINC001560002240 1059805456 /nfs/dbraw/zinc/80/54/56/1059805456.db2.gz JRRRBZMYEJWWRV-SFHVURJKSA-N 1 2 323.477 4.265 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2F)C[C@H](C)O1 ZINC001560002083 1059806413 /nfs/dbraw/zinc/80/64/13/1059806413.db2.gz VKXBPNIHMAFYCC-ZJUUUORDSA-N 1 2 306.208 4.132 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C[C@H](C)O1 ZINC001560002083 1059806437 /nfs/dbraw/zinc/80/64/37/1059806437.db2.gz VKXBPNIHMAFYCC-ZJUUUORDSA-N 1 2 306.208 4.132 20 0 DIADLO Fc1cccc([C@@H]2COCC[N@@H+]2C[C@H]2CCCCC2(F)F)c1 ZINC001560001717 1059806943 /nfs/dbraw/zinc/80/69/43/1059806943.db2.gz GEGCZCJPFQYKEF-ZBFHGGJFSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1cccc([C@@H]2COCC[N@H+]2C[C@H]2CCCCC2(F)F)c1 ZINC001560001717 1059806969 /nfs/dbraw/zinc/80/69/69/1059806969.db2.gz GEGCZCJPFQYKEF-ZBFHGGJFSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1cccc([C@H]2COCC[N@@H+]2C[C@H]2CCCCC2(F)F)c1 ZINC001560001714 1059807923 /nfs/dbraw/zinc/80/79/23/1059807923.db2.gz GEGCZCJPFQYKEF-GDBMZVCRSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1cccc([C@H]2COCC[N@H+]2C[C@H]2CCCCC2(F)F)c1 ZINC001560001714 1059807948 /nfs/dbraw/zinc/80/79/48/1059807948.db2.gz GEGCZCJPFQYKEF-GDBMZVCRSA-N 1 2 313.363 4.025 20 0 DIADLO O=C(Nc1cccc(-c2ccccc2)c1)c1cccc2[nH+]ccn21 ZINC001525319653 1059828542 /nfs/dbraw/zinc/82/85/42/1059828542.db2.gz CXDVBFDOVBWFDA-UHFFFAOYSA-N 1 2 313.360 4.254 20 0 DIADLO C[C@@H](CC(=O)Nc1ccccc1Cc1ccccc1)n1cc[nH+]c1 ZINC001525312816 1059828772 /nfs/dbraw/zinc/82/87/72/1059828772.db2.gz SRSDYQMNSJWKLG-INIZCTEOSA-N 1 2 319.408 4.064 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+]1CCCC[C@H]1C(=O)OC(C)(C)C ZINC001560090569 1059898765 /nfs/dbraw/zinc/89/87/65/1059898765.db2.gz YIDLWANKADJAPM-INIZCTEOSA-N 1 2 323.864 4.345 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+]1CCCC[C@H]1C(=O)OC(C)(C)C ZINC001560090569 1059898792 /nfs/dbraw/zinc/89/87/92/1059898792.db2.gz YIDLWANKADJAPM-INIZCTEOSA-N 1 2 323.864 4.345 20 0 DIADLO CC(=O)OCc1cc(Nc2ccc([NH+]3CCCC3)cc2)ccc1C ZINC001248579037 1059902003 /nfs/dbraw/zinc/90/20/03/1059902003.db2.gz RVZCXONIFDVDCI-UHFFFAOYSA-N 1 2 324.424 4.402 20 0 DIADLO CCCOC(=O)[C@H](C)[NH2+][C@@H]1CCC(C)(C)C[C@@H]1c1ccccc1 ZINC001560092853 1059904396 /nfs/dbraw/zinc/90/43/96/1059904396.db2.gz QTQNRWPTXSMUIB-CGTJXYLNSA-N 1 2 317.473 4.280 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H]2CCCc3c(C)cccc32)c(C)[nH+]1 ZINC001533508353 1059916198 /nfs/dbraw/zinc/91/61/98/1059916198.db2.gz MQHBHTGOIQQJMW-SFHVURJKSA-N 1 2 308.425 4.123 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CCC[C@H](c3ccccc3)C2)c(C)[nH+]1 ZINC001525522464 1059921733 /nfs/dbraw/zinc/92/17/33/1059921733.db2.gz HHYRODPLNIOCTE-RBUKOAKNSA-N 1 2 322.452 4.463 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H]2CCC[C@H](c3ccccc3)C2)c(C)[nH+]1 ZINC001525522463 1059921778 /nfs/dbraw/zinc/92/17/78/1059921778.db2.gz HHYRODPLNIOCTE-OALUTQOASA-N 1 2 322.452 4.463 20 0 DIADLO C[C@@H]1c2sccc2CC[N@H+]1Cc1ccnc(Br)c1 ZINC001560112947 1059922742 /nfs/dbraw/zinc/92/27/42/1059922742.db2.gz SVUVPVIKKLSOLG-SNVBAGLBSA-N 1 2 323.259 4.025 20 0 DIADLO C[C@@H]1c2sccc2CC[N@@H+]1Cc1ccnc(Br)c1 ZINC001560112947 1059922761 /nfs/dbraw/zinc/92/27/61/1059922761.db2.gz SVUVPVIKKLSOLG-SNVBAGLBSA-N 1 2 323.259 4.025 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1cnn(CC(F)(F)F)c1 ZINC001248655180 1059926424 /nfs/dbraw/zinc/92/64/24/1059926424.db2.gz CAKSLADGHRRFDY-UHFFFAOYSA-N 1 2 312.339 4.091 20 0 DIADLO CC(C)(C)c1coc(C[N@@H+]2CC[C@H](c3c(F)cccc3F)C2)n1 ZINC001560131103 1059937022 /nfs/dbraw/zinc/93/70/22/1059937022.db2.gz UJLYGGRIQOHDET-LBPRGKRZSA-N 1 2 320.383 4.240 20 0 DIADLO CC(C)(C)c1coc(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)n1 ZINC001560131103 1059937043 /nfs/dbraw/zinc/93/70/43/1059937043.db2.gz UJLYGGRIQOHDET-LBPRGKRZSA-N 1 2 320.383 4.240 20 0 DIADLO Cc1ccc([N@H+](CCc2ccc3c(c2)CCO3)CC2CC2)cc1 ZINC001560141031 1059945876 /nfs/dbraw/zinc/94/58/76/1059945876.db2.gz FIZKXCMZQNWKDZ-UHFFFAOYSA-N 1 2 307.437 4.389 20 0 DIADLO Cc1ccc([N@@H+](CCc2ccc3c(c2)CCO3)CC2CC2)cc1 ZINC001560141031 1059945896 /nfs/dbraw/zinc/94/58/96/1059945896.db2.gz FIZKXCMZQNWKDZ-UHFFFAOYSA-N 1 2 307.437 4.389 20 0 DIADLO CC(C)C[N@H+](Cc1ccccn1)Cc1nc(Cl)ccc1Cl ZINC001560161694 1059953683 /nfs/dbraw/zinc/95/36/83/1059953683.db2.gz CXCHJLKJFVICLI-UHFFFAOYSA-N 1 2 324.255 4.442 20 0 DIADLO CC(C)C[N@@H+](Cc1ccccn1)Cc1nc(Cl)ccc1Cl ZINC001560161694 1059953694 /nfs/dbraw/zinc/95/36/94/1059953694.db2.gz CXCHJLKJFVICLI-UHFFFAOYSA-N 1 2 324.255 4.442 20 0 DIADLO Cc1cc([C@H]2CCCC[N@@H+]2CCSc2ccccc2)n[nH]1 ZINC001560174205 1059965597 /nfs/dbraw/zinc/96/55/97/1059965597.db2.gz WVONSFWKLNPHSJ-QGZVFWFLSA-N 1 2 301.459 4.037 20 0 DIADLO Cc1cc([C@H]2CCCC[N@H+]2CCSc2ccccc2)n[nH]1 ZINC001560174205 1059965615 /nfs/dbraw/zinc/96/56/15/1059965615.db2.gz WVONSFWKLNPHSJ-QGZVFWFLSA-N 1 2 301.459 4.037 20 0 DIADLO Cn1ccc(-c2ccc(C[N@@H+]3Cc4cccc(Cl)c4C3)cc2)n1 ZINC001248766831 1059973843 /nfs/dbraw/zinc/97/38/43/1059973843.db2.gz IQXUGKSEQLDDKS-UHFFFAOYSA-N 1 2 323.827 4.256 20 0 DIADLO Cn1ccc(-c2ccc(C[N@H+]3Cc4cccc(Cl)c4C3)cc2)n1 ZINC001248766831 1059973864 /nfs/dbraw/zinc/97/38/64/1059973864.db2.gz IQXUGKSEQLDDKS-UHFFFAOYSA-N 1 2 323.827 4.256 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2ncc(C(F)(F)F)cc2F)c1 ZINC001248787291 1059974596 /nfs/dbraw/zinc/97/45/96/1059974596.db2.gz WQMKAFBEIFTPPB-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2ncc(C(F)(F)F)cc2F)c1 ZINC001248787291 1059974616 /nfs/dbraw/zinc/97/46/16/1059974616.db2.gz WQMKAFBEIFTPPB-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@@](C)(F)C2)c(OC)c1Cl ZINC001248796763 1059978407 /nfs/dbraw/zinc/97/84/07/1059978407.db2.gz GTCHXOFBCKYMMA-MRXNPFEDSA-N 1 2 315.816 4.071 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@@](C)(F)C2)c(OC)c1Cl ZINC001248796763 1059978433 /nfs/dbraw/zinc/97/84/33/1059978433.db2.gz GTCHXOFBCKYMMA-MRXNPFEDSA-N 1 2 315.816 4.071 20 0 DIADLO FC1(C2CC2)CC[NH+](Cc2nccc(Cl)c2Cl)CC1 ZINC001560198242 1059980994 /nfs/dbraw/zinc/98/09/94/1059980994.db2.gz NRQHQCJGQSTIGX-UHFFFAOYSA-N 1 2 303.208 4.103 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCn3nc(C(C)(C)C)cc3C2)c(C)c1 ZINC001560196706 1059981221 /nfs/dbraw/zinc/98/12/21/1059981221.db2.gz SSVWNECETFYQCQ-UHFFFAOYSA-N 1 2 311.473 4.122 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCn3nc(C(C)(C)C)cc3C2)c(C)c1 ZINC001560196706 1059981247 /nfs/dbraw/zinc/98/12/47/1059981247.db2.gz SSVWNECETFYQCQ-UHFFFAOYSA-N 1 2 311.473 4.122 20 0 DIADLO Fc1cc(C(F)(F)F)cnc1C[N@H+](Cc1ccccc1)C1CC1 ZINC001248790490 1059983354 /nfs/dbraw/zinc/98/33/54/1059983354.db2.gz SKZUREOKBXEGAW-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO Fc1cc(C(F)(F)F)cnc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC001248790490 1059983370 /nfs/dbraw/zinc/98/33/70/1059983370.db2.gz SKZUREOKBXEGAW-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO Cc1cc(CN2CC[NH+]([C@H](C)c3ccc(F)cc3)CC2)cs1 ZINC001248804898 1059988813 /nfs/dbraw/zinc/98/88/13/1059988813.db2.gz ZUWABBBWZAREFF-OAHLLOKOSA-N 1 2 318.461 4.074 20 0 DIADLO Cc1cccnc1[C@H](C)[NH2+]Cc1csc(Cc2ccccc2)n1 ZINC001560220709 1059997185 /nfs/dbraw/zinc/99/71/85/1059997185.db2.gz DJYVMBZDDVPOES-HNNXBMFYSA-N 1 2 323.465 4.288 20 0 DIADLO FC(F)(F)c1ccc2c(c1)n[nH]c2C[NH+]1Cc2ccccc2C1 ZINC001248843802 1060013521 /nfs/dbraw/zinc/01/35/21/1060013521.db2.gz ATPGYNJIMTUTOC-UHFFFAOYSA-N 1 2 317.314 4.098 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+]3CC=C(c4ccccc4)CC3)nc2c1 ZINC001248842839 1060014753 /nfs/dbraw/zinc/01/47/53/1060014753.db2.gz MIMXIDYJAQQPJT-UHFFFAOYSA-N 1 2 303.409 4.161 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+]3CC=C(c4ccccc4)CC3)nc2c1 ZINC001248842839 1060014771 /nfs/dbraw/zinc/01/47/71/1060014771.db2.gz MIMXIDYJAQQPJT-UHFFFAOYSA-N 1 2 303.409 4.161 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CC=C(c4ccccc4)CC3)[nH]c2c1 ZINC001248842839 1060014792 /nfs/dbraw/zinc/01/47/92/1060014792.db2.gz MIMXIDYJAQQPJT-UHFFFAOYSA-N 1 2 303.409 4.161 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CC=C(c4ccccc4)CC3)[nH]c2c1 ZINC001248842839 1060014807 /nfs/dbraw/zinc/01/48/07/1060014807.db2.gz MIMXIDYJAQQPJT-UHFFFAOYSA-N 1 2 303.409 4.161 20 0 DIADLO FC(F)(F)c1ccc2c(c1)[nH]nc2C[NH+]1C2CCCC1CCC2 ZINC001248848235 1060020611 /nfs/dbraw/zinc/02/06/11/1060020611.db2.gz TUWWKUDNZUOXLO-UHFFFAOYSA-N 1 2 323.362 4.489 20 0 DIADLO Cc1nc(C[N@@H+]2CCSC[C@H]2c2ccccc2)ccc1Cl ZINC001248878682 1060032224 /nfs/dbraw/zinc/03/22/24/1060032224.db2.gz WEODWIQKWOMHDY-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1nc(C[N@H+]2CCSC[C@H]2c2ccccc2)ccc1Cl ZINC001248878682 1060032260 /nfs/dbraw/zinc/03/22/60/1060032260.db2.gz WEODWIQKWOMHDY-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1nc(C[N@@H+]2CCCC[C@H]2c2cccnc2)ccc1Cl ZINC001248874905 1060033620 /nfs/dbraw/zinc/03/36/20/1060033620.db2.gz VTLFZIAAJAHKSL-KRWDZBQOSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1nc(C[N@H+]2CCCC[C@H]2c2cccnc2)ccc1Cl ZINC001248874905 1060033638 /nfs/dbraw/zinc/03/36/38/1060033638.db2.gz VTLFZIAAJAHKSL-KRWDZBQOSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1nc(C[N@@H+]2CCSc3ccccc3C2)ccc1Cl ZINC001248872371 1060034398 /nfs/dbraw/zinc/03/43/98/1060034398.db2.gz PZYHVPYZLLMDRD-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO Cc1nc(C[N@H+]2CCSc3ccccc3C2)ccc1Cl ZINC001248872371 1060034419 /nfs/dbraw/zinc/03/44/19/1060034419.db2.gz PZYHVPYZLLMDRD-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO Cc1cc(C)nc(C[N@@H+](C)C(c2ccccc2)c2ccccc2)n1 ZINC001248933119 1060068541 /nfs/dbraw/zinc/06/85/41/1060068541.db2.gz OZWJEMXCXOTUOQ-UHFFFAOYSA-N 1 2 317.436 4.315 20 0 DIADLO Cc1cc(C)nc(C[N@H+](C)C(c2ccccc2)c2ccccc2)n1 ZINC001248933119 1060068562 /nfs/dbraw/zinc/06/85/62/1060068562.db2.gz OZWJEMXCXOTUOQ-UHFFFAOYSA-N 1 2 317.436 4.315 20 0 DIADLO Cc1cc(C)nc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC001248966981 1060094316 /nfs/dbraw/zinc/09/43/16/1060094316.db2.gz YAMKJCTVIHBJDD-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C)nc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC001248966981 1060094339 /nfs/dbraw/zinc/09/43/39/1060094339.db2.gz YAMKJCTVIHBJDD-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C)nc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)n1 ZINC001248966827 1060094623 /nfs/dbraw/zinc/09/46/23/1060094623.db2.gz WALRHMBGUDBXGG-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C)nc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)n1 ZINC001248966827 1060094644 /nfs/dbraw/zinc/09/46/44/1060094644.db2.gz WALRHMBGUDBXGG-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2cccnc2)c(Cl)nc1C ZINC001248988434 1060100124 /nfs/dbraw/zinc/10/01/24/1060100124.db2.gz KWCKPEBBNFKDKG-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2cccnc2)c(Cl)nc1C ZINC001248988434 1060100146 /nfs/dbraw/zinc/10/01/46/1060100146.db2.gz KWCKPEBBNFKDKG-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO CCn1ccnc1C[NH2+]Cc1ccccc1Oc1cccc(C)c1 ZINC001560319360 1060106262 /nfs/dbraw/zinc/10/62/62/1060106262.db2.gz BKLFJCOCWHJIOA-UHFFFAOYSA-N 1 2 321.424 4.294 20 0 DIADLO Cc1cc(C[N@@H+]2CCOC[C@H]2C2CCCCC2)c(Cl)nc1C ZINC001249036090 1060125061 /nfs/dbraw/zinc/12/50/61/1060125061.db2.gz GYTNEXDKIMLTOE-KRWDZBQOSA-N 1 2 322.880 4.133 20 0 DIADLO Cc1cc(C[N@H+]2CCOC[C@H]2C2CCCCC2)c(Cl)nc1C ZINC001249036090 1060125070 /nfs/dbraw/zinc/12/50/70/1060125070.db2.gz GYTNEXDKIMLTOE-KRWDZBQOSA-N 1 2 322.880 4.133 20 0 DIADLO Cc1cc(C[N@H+](C)CCC(=O)c2cccs2)c(Cl)nc1C ZINC001249035955 1060125694 /nfs/dbraw/zinc/12/56/94/1060125694.db2.gz FENCPDHPEGHPMU-UHFFFAOYSA-N 1 2 322.861 4.118 20 0 DIADLO Cc1cc(C[N@@H+](C)CCC(=O)c2cccs2)c(Cl)nc1C ZINC001249035955 1060125704 /nfs/dbraw/zinc/12/57/04/1060125704.db2.gz FENCPDHPEGHPMU-UHFFFAOYSA-N 1 2 322.861 4.118 20 0 DIADLO Cc1ccc(-c2noc([C@@H]([NH3+])c3cccc(Cl)c3)n2)c(C)c1 ZINC001249068349 1060142311 /nfs/dbraw/zinc/14/23/11/1060142311.db2.gz YGWJMHJQEUPEBX-HNNXBMFYSA-N 1 2 313.788 4.055 20 0 DIADLO [NH3+][C@H](c1nc(-c2ccccc2Cl)no1)c1cccc(Cl)c1 ZINC001249066891 1060142996 /nfs/dbraw/zinc/14/29/96/1060142996.db2.gz GCRWIXJFXSMBHU-ZDUSSCGKSA-N 1 2 320.179 4.092 20 0 DIADLO [NH3+][C@H](c1nc(-c2ccc(Cl)cc2)no1)c1cccc(Cl)c1 ZINC001249067576 1060143029 /nfs/dbraw/zinc/14/30/29/1060143029.db2.gz NXQYHRNHFHSKOK-ZDUSSCGKSA-N 1 2 320.179 4.092 20 0 DIADLO Clc1sc(C[N@@H+]2CCOCC23CCC3)c2ccccc12 ZINC001249067898 1060143118 /nfs/dbraw/zinc/14/31/18/1060143118.db2.gz ORAGSDZCHDVGQS-UHFFFAOYSA-N 1 2 307.846 4.310 20 0 DIADLO Clc1sc(C[N@H+]2CCOCC23CCC3)c2ccccc12 ZINC001249067898 1060143121 /nfs/dbraw/zinc/14/31/21/1060143121.db2.gz ORAGSDZCHDVGQS-UHFFFAOYSA-N 1 2 307.846 4.310 20 0 DIADLO COc1cc(C)ccc1C[NH2+]Cc1c(F)ccc(F)c1Cl ZINC001560376015 1060162684 /nfs/dbraw/zinc/16/26/84/1060162684.db2.gz LEHOEFYONCDVMY-UHFFFAOYSA-N 1 2 311.759 4.225 20 0 DIADLO Cc1c(Cl)ccc(CNc2ccc(N(C)C)c[nH+]2)c1Cl ZINC001560382194 1060169407 /nfs/dbraw/zinc/16/94/07/1060169407.db2.gz LOTVKIKAUBBZSW-UHFFFAOYSA-N 1 2 310.228 4.375 20 0 DIADLO Clc1cc(NCc2cccc3n[nH]cc32)ccc1-n1cc[nH+]c1 ZINC001560383741 1060170107 /nfs/dbraw/zinc/17/01/07/1060170107.db2.gz OCOFNCBMAONROH-UHFFFAOYSA-N 1 2 323.787 4.014 20 0 DIADLO CSc1ccc(CNc2ccc(-n3cc[nH+]c3)c(F)c2)cc1 ZINC001560386790 1060172023 /nfs/dbraw/zinc/17/20/23/1060172023.db2.gz DXSHGVMVXZYHTG-UHFFFAOYSA-N 1 2 313.401 4.345 20 0 DIADLO CCC[C@](C)(CC)c1nc(-c2ccccc2-n2cc[nH+]c2)no1 ZINC001249166532 1060177969 /nfs/dbraw/zinc/17/79/69/1060177969.db2.gz WIWXYKLXQCUJHL-SFHVURJKSA-N 1 2 310.401 4.390 20 0 DIADLO CCCCOc1ccc(CNc2ccc(C)[nH+]c2C)cc1OC ZINC001560408158 1060193442 /nfs/dbraw/zinc/19/34/42/1060193442.db2.gz WHSNXAJLCRMSOR-UHFFFAOYSA-N 1 2 314.429 4.498 20 0 DIADLO Cc1cc(-c2noc([C@H]3CC[N@@H+]3Cc3ccccc3)n2)ccc1F ZINC001249253007 1060203177 /nfs/dbraw/zinc/20/31/77/1060203177.db2.gz FOQNMOAKDHUREU-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cc(-c2noc([C@H]3CC[N@H+]3Cc3ccccc3)n2)ccc1F ZINC001249253007 1060203212 /nfs/dbraw/zinc/20/32/12/1060203212.db2.gz FOQNMOAKDHUREU-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1cc(O)cc(Cl)c1 ZINC001560425527 1060209061 /nfs/dbraw/zinc/20/90/61/1060209061.db2.gz NGMYISIRVQXZKF-UHFFFAOYSA-N 1 2 306.793 4.230 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1N[C@H]1CCc2cccnc2CC1 ZINC001560425696 1060210373 /nfs/dbraw/zinc/21/03/73/1060210373.db2.gz WJGQXLFCTGQSPZ-HNNXBMFYSA-N 1 2 311.429 4.013 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2cccc(F)c2)c2ccccn2)cc(C)n1 ZINC001560423410 1060210425 /nfs/dbraw/zinc/21/04/25/1060210425.db2.gz HTZQMJYYSFYAQS-FQEVSTJZSA-N 1 2 321.399 4.112 20 0 DIADLO CCc1ncc(C[NH2+][C@H](c2cccc(C)c2)c2ccccn2)s1 ZINC001560427849 1060214924 /nfs/dbraw/zinc/21/49/24/1060214924.db2.gz QHIGWNPTKCUXBS-LJQANCHMSA-N 1 2 323.465 4.288 20 0 DIADLO Cc1ccccc1-c1noc([C@H]([NH3+])c2ccc3ccccc3c2)n1 ZINC001249326041 1060218910 /nfs/dbraw/zinc/21/89/10/1060218910.db2.gz UJPSJCDHEUNKEI-GOSISDBHSA-N 1 2 315.376 4.246 20 0 DIADLO CC1(C)CC[N@H+](Cc2cc(Br)sc2Cl)C1 ZINC001249380981 1060232886 /nfs/dbraw/zinc/23/28/86/1060232886.db2.gz GULPTPAPHZINLQ-UHFFFAOYSA-N 1 2 308.672 4.396 20 0 DIADLO CC1(C)CC[N@@H+](Cc2cc(Br)sc2Cl)C1 ZINC001249380981 1060232890 /nfs/dbraw/zinc/23/28/90/1060232890.db2.gz GULPTPAPHZINLQ-UHFFFAOYSA-N 1 2 308.672 4.396 20 0 DIADLO CC[C@H](C)c1nn(C)cc1C[N@@H+]1CCc2ccc(Cl)cc2C1 ZINC001249402565 1060237713 /nfs/dbraw/zinc/23/77/13/1060237713.db2.gz NVBCRPFGOFGTMW-ZDUSSCGKSA-N 1 2 317.864 4.145 20 0 DIADLO CC[C@H](C)c1nn(C)cc1C[N@H+]1CCc2ccc(Cl)cc2C1 ZINC001249402565 1060237732 /nfs/dbraw/zinc/23/77/32/1060237732.db2.gz NVBCRPFGOFGTMW-ZDUSSCGKSA-N 1 2 317.864 4.145 20 0 DIADLO COc1ccc2nc(C[N@@H+]3CCC[C@@H]3c3cccc(C)c3)[nH]c2c1 ZINC001249411168 1060241504 /nfs/dbraw/zinc/24/15/04/1060241504.db2.gz QMVSGZHPMTWJMD-LJQANCHMSA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccc2nc(C[N@H+]3CCC[C@@H]3c3cccc(C)c3)[nH]c2c1 ZINC001249411168 1060241519 /nfs/dbraw/zinc/24/15/19/1060241519.db2.gz QMVSGZHPMTWJMD-LJQANCHMSA-N 1 2 321.424 4.217 20 0 DIADLO Cc1cc(C)c(C(=O)NCc2ccc(C(C)(F)F)cc2)c(C)[nH+]1 ZINC001534378152 1060243463 /nfs/dbraw/zinc/24/34/63/1060243463.db2.gz KVPGODNIXKNSSB-UHFFFAOYSA-N 1 2 318.367 4.049 20 0 DIADLO CC(C)c1cccc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)c1 ZINC001534449671 1060275023 /nfs/dbraw/zinc/27/50/23/1060275023.db2.gz HKTMNKCNEYPQJA-UHFFFAOYSA-N 1 2 323.371 4.387 20 0 DIADLO COc1cc[nH+]cc1Nc1cccc(SCC(F)(F)F)c1 ZINC001249549034 1060282676 /nfs/dbraw/zinc/28/26/76/1060282676.db2.gz HSPFDHMUAWOLAS-UHFFFAOYSA-N 1 2 314.332 4.488 20 0 DIADLO Cn1c(C[NH2+]CC(F)(F)c2ccccc2)cc2ccccc21 ZINC001560490679 1060284788 /nfs/dbraw/zinc/28/47/88/1060284788.db2.gz FGPJXGPKZKRSCM-UHFFFAOYSA-N 1 2 300.352 4.060 20 0 DIADLO F[C@]1(c2ccccc2)C[C@H]1[NH2+]Cc1ccccc1Br ZINC001560511975 1060310449 /nfs/dbraw/zinc/31/04/49/1060310449.db2.gz WVLHCEJDJKISMM-CVEARBPZSA-N 1 2 320.205 4.176 20 0 DIADLO Cc1cc(C[NH+]2CCC(c3ccccc3Cl)CC2)ns1 ZINC001249594039 1060311033 /nfs/dbraw/zinc/31/10/33/1060311033.db2.gz YEPFATPUTXJNHM-UHFFFAOYSA-N 1 2 306.862 4.485 20 0 DIADLO Cc1cc(C)c(NC(=O)C(F)(F)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC001526805938 1060343788 /nfs/dbraw/zinc/34/37/88/1060343788.db2.gz AGFNTZZTXYMAJZ-UHFFFAOYSA-N 1 2 324.758 4.391 20 0 DIADLO CCCOc1cncc(NCc2cc(C)[nH+]c3c2CCCC3)c1 ZINC001560537684 1060343799 /nfs/dbraw/zinc/34/37/99/1060343799.db2.gz KFVCUKICYDJNTK-UHFFFAOYSA-N 1 2 311.429 4.065 20 0 DIADLO CCOc1ccc(CNc2ccc(Nc3ccccc3)c[nH+]2)o1 ZINC001560539196 1060343835 /nfs/dbraw/zinc/34/38/35/1060343835.db2.gz SJIDOPMIIPORDS-UHFFFAOYSA-N 1 2 309.369 4.429 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)c2cccc(C3CC3)c2)c(C)[nH+]1 ZINC001526832950 1060352547 /nfs/dbraw/zinc/35/25/47/1060352547.db2.gz WGVXXYSWKONSQI-CQSZACIVSA-N 1 2 308.425 4.375 20 0 DIADLO Nc1ccc(Nc2[nH+]cccc2N2CCCCC2)c(Cl)c1 ZINC001249729983 1060375442 /nfs/dbraw/zinc/37/54/42/1060375442.db2.gz BHHRNTYEBSQUKM-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO Cc1nc(CNc2[nH+]c3ccccc3n2C(C)(C)C)sc1C ZINC001560574399 1060386207 /nfs/dbraw/zinc/38/62/07/1060386207.db2.gz AXGOJRMAZQTRMZ-UHFFFAOYSA-N 1 2 314.458 4.477 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1cnc(Cl)c(F)c1 ZINC001560574375 1060386625 /nfs/dbraw/zinc/38/66/25/1060386625.db2.gz RQFSJCVHUXEPPQ-UHFFFAOYSA-N 1 2 318.783 4.417 20 0 DIADLO COc1cccc2[nH]c(NCc3ccc(CC(C)C)cc3)[nH+]c21 ZINC001560577249 1060389803 /nfs/dbraw/zinc/38/98/03/1060389803.db2.gz VUXIDVUUUSLWCA-UHFFFAOYSA-N 1 2 309.413 4.382 20 0 DIADLO COc1ccc(CNc2[nH]c3ccc(Cl)cc3[nH+]2)cc1C ZINC001560579374 1060394219 /nfs/dbraw/zinc/39/42/19/1060394219.db2.gz JRRJWLZFSUTXBM-UHFFFAOYSA-N 1 2 301.777 4.145 20 0 DIADLO Fc1cccc(/C=C/CNc2[nH]c3ccc(Cl)cc3[nH+]2)c1 ZINC001560579257 1060394282 /nfs/dbraw/zinc/39/42/82/1060394282.db2.gz DMVLCSBZSKECTB-DUXPYHPUSA-N 1 2 301.752 4.481 20 0 DIADLO CNc1ccc(C)cc1CNc1[nH+]c2ccccc2n1CC1CC1 ZINC001560595534 1060408289 /nfs/dbraw/zinc/40/82/89/1060408289.db2.gz FIYSIBGELKDGDH-UHFFFAOYSA-N 1 2 320.440 4.409 20 0 DIADLO Fc1ccc2[nH]c(Nc3cc(Cl)c4[nH+]ccn4c3)cc2c1 ZINC001249850786 1060420999 /nfs/dbraw/zinc/42/09/99/1060420999.db2.gz LPXZRVKQRGZNPD-UHFFFAOYSA-N 1 2 300.724 4.352 20 0 DIADLO CCCc1cc[nH+]c(Nc2cc3cc(C(=O)OC)ccc3[nH]2)c1 ZINC001249868125 1060431533 /nfs/dbraw/zinc/43/15/33/1060431533.db2.gz XBAUAQJFUPVWDD-UHFFFAOYSA-N 1 2 309.369 4.046 20 0 DIADLO CC[N@H+](Cc1c(F)ccc(SC)c1Br)C1CC1 ZINC001249877605 1060439546 /nfs/dbraw/zinc/43/95/46/1060439546.db2.gz IHQHSYWJPLGSAM-UHFFFAOYSA-N 1 2 318.255 4.294 20 0 DIADLO CC[N@@H+](Cc1c(F)ccc(SC)c1Br)C1CC1 ZINC001249877605 1060439550 /nfs/dbraw/zinc/43/95/50/1060439550.db2.gz IHQHSYWJPLGSAM-UHFFFAOYSA-N 1 2 318.255 4.294 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1C[C@H](C)C[C@@H]1c1ccccc1F ZINC001560641881 1060460061 /nfs/dbraw/zinc/46/00/61/1060460061.db2.gz DJWHICPERLECMO-IUODEOHRSA-N 1 2 321.827 4.279 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1F ZINC001560641881 1060460070 /nfs/dbraw/zinc/46/00/70/1060460070.db2.gz DJWHICPERLECMO-IUODEOHRSA-N 1 2 321.827 4.279 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+](C)Cc1cccc2ccccc21 ZINC001560648016 1060470603 /nfs/dbraw/zinc/47/06/03/1060470603.db2.gz GZVQBENCDARVDQ-UHFFFAOYSA-N 1 2 313.832 4.342 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+](C)Cc1cccc2ccccc21 ZINC001560648016 1060470607 /nfs/dbraw/zinc/47/06/07/1060470607.db2.gz GZVQBENCDARVDQ-UHFFFAOYSA-N 1 2 313.832 4.342 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cnc1Cl ZINC001249916174 1060479448 /nfs/dbraw/zinc/47/94/48/1060479448.db2.gz BLJDXKGHTUPDMP-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cnc1Cl ZINC001249916174 1060479451 /nfs/dbraw/zinc/47/94/51/1060479451.db2.gz BLJDXKGHTUPDMP-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO CCCC[N@H+](Cc1cncn1CC)Cc1ccccc1Cl ZINC001560659625 1060484057 /nfs/dbraw/zinc/48/40/57/1060484057.db2.gz NZQTYJROROEWFR-UHFFFAOYSA-N 1 2 305.853 4.359 20 0 DIADLO CCCC[N@@H+](Cc1cncn1CC)Cc1ccccc1Cl ZINC001560659625 1060484065 /nfs/dbraw/zinc/48/40/65/1060484065.db2.gz NZQTYJROROEWFR-UHFFFAOYSA-N 1 2 305.853 4.359 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2c(Cl)ccnc2Cl)cc1 ZINC001560663228 1060489903 /nfs/dbraw/zinc/48/99/03/1060489903.db2.gz HLONWYMWFKSSKS-HNNXBMFYSA-N 1 2 323.223 4.431 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@H+]2Cc2c(Cl)ccnc2Cl)cc1 ZINC001560663228 1060489914 /nfs/dbraw/zinc/48/99/14/1060489914.db2.gz HLONWYMWFKSSKS-HNNXBMFYSA-N 1 2 323.223 4.431 20 0 DIADLO C[N@H+](Cc1cccc(O)c1)Cc1cc(Cl)cc(Cl)c1F ZINC001249934638 1060492832 /nfs/dbraw/zinc/49/28/32/1060492832.db2.gz WRCRTEBAHMTDOX-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO C[N@@H+](Cc1cccc(O)c1)Cc1cc(Cl)cc(Cl)c1F ZINC001249934638 1060492845 /nfs/dbraw/zinc/49/28/45/1060492845.db2.gz WRCRTEBAHMTDOX-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO Cc1ncccc1C[N@@H+](C)Cc1cc(Cl)cc(Cl)c1F ZINC001249940819 1060496169 /nfs/dbraw/zinc/49/61/69/1060496169.db2.gz CPPGWTWGYSMEIC-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1ncccc1C[N@H+](C)Cc1cc(Cl)cc(Cl)c1F ZINC001249940819 1060496174 /nfs/dbraw/zinc/49/61/74/1060496174.db2.gz CPPGWTWGYSMEIC-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO CC(C)O[C@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001249941786 1060496446 /nfs/dbraw/zinc/49/64/46/1060496446.db2.gz MXYPMHWBCIYQIO-LBPRGKRZSA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001249941786 1060496469 /nfs/dbraw/zinc/49/64/69/1060496469.db2.gz MXYPMHWBCIYQIO-LBPRGKRZSA-N 1 2 306.208 4.132 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(CC(C)C)s3)ccc2[nH+]1 ZINC001527355112 1060500042 /nfs/dbraw/zinc/50/00/42/1060500042.db2.gz HGQFGEKWAPXFNR-UHFFFAOYSA-N 1 2 313.426 4.155 20 0 DIADLO CCCn1c[nH+]cc1CN(C)Cc1cccc(Cl)c1Cl ZINC001560670328 1060501124 /nfs/dbraw/zinc/50/11/24/1060501124.db2.gz AWIPDGXARNGFRB-UHFFFAOYSA-N 1 2 312.244 4.232 20 0 DIADLO CC[NH+](CC)c1ccc(Nc2cc(O)c(F)c(F)c2F)cc1 ZINC001249963238 1060508302 /nfs/dbraw/zinc/50/83/02/1060508302.db2.gz TWBFAFBDUFYEOQ-UHFFFAOYSA-N 1 2 310.319 4.399 20 0 DIADLO COc1nccc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)c1F ZINC001560675880 1060514022 /nfs/dbraw/zinc/51/40/22/1060514022.db2.gz XRGPZZDDDVNHNN-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)c1F ZINC001560675880 1060514038 /nfs/dbraw/zinc/51/40/38/1060514038.db2.gz XRGPZZDDDVNHNN-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO CCOc1cc(F)cc(C[N@@H+]2CCc3cccc(F)c3[C@H]2C)c1 ZINC001560693037 1060543469 /nfs/dbraw/zinc/54/34/69/1060543469.db2.gz UTSQWYQSFDAMMS-CYBMUJFWSA-N 1 2 317.379 4.483 20 0 DIADLO CCOc1cc(F)cc(C[N@H+]2CCc3cccc(F)c3[C@H]2C)c1 ZINC001560693037 1060543490 /nfs/dbraw/zinc/54/34/90/1060543490.db2.gz UTSQWYQSFDAMMS-CYBMUJFWSA-N 1 2 317.379 4.483 20 0 DIADLO CC1=CC[C@@H]([NH2+][C@H](Cc2ccccc2)C(=O)OC(C)(C)C)CC1 ZINC001560707896 1060563637 /nfs/dbraw/zinc/56/36/37/1060563637.db2.gz XLKGGOFNSGPXMX-QZTJIDSGSA-N 1 2 315.457 4.028 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2cn(-c3ccccc3C)nn2)cc1 ZINC001560717444 1060578200 /nfs/dbraw/zinc/57/82/00/1060578200.db2.gz MMSVYWBOSZEYJB-QGZVFWFLSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2cn(-c3ccccc3C)nn2)cc1 ZINC001560717444 1060578218 /nfs/dbraw/zinc/57/82/18/1060578218.db2.gz MMSVYWBOSZEYJB-QGZVFWFLSA-N 1 2 320.440 4.077 20 0 DIADLO COc1cc[nH+]c(Nc2cc(Cl)c(OC(C)C)cc2F)c1 ZINC001250069707 1060583172 /nfs/dbraw/zinc/58/31/72/1060583172.db2.gz TXYVJDYZJWPIHW-UHFFFAOYSA-N 1 2 310.756 4.414 20 0 DIADLO COc1cc(OC)c(Nc2cccc3[nH+]c(C)cn32)cc1Cl ZINC001250092562 1060602262 /nfs/dbraw/zinc/60/22/62/1060602262.db2.gz HEKTWAXFZLDOJD-UHFFFAOYSA-N 1 2 317.776 4.057 20 0 DIADLO CCN(C)c1ccc(Nc2c(F)ccc(Cl)c2OC)c[nH+]1 ZINC001250102527 1060612107 /nfs/dbraw/zinc/61/21/07/1060612107.db2.gz NRFGOMDRTSKZJL-UHFFFAOYSA-N 1 2 309.772 4.082 20 0 DIADLO CCCCC[C@@H]([NH2+]CCc1ccc(C(C)(C)C)cc1)C(=O)OC ZINC001560764382 1060630244 /nfs/dbraw/zinc/63/02/44/1060630244.db2.gz WWFPPTVSFPJMSE-GOSISDBHSA-N 1 2 319.489 4.238 20 0 DIADLO Oc1cccc(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)c1Cl ZINC001560786219 1060646980 /nfs/dbraw/zinc/64/69/80/1060646980.db2.gz TVWAMVQMIDIQOF-QGZVFWFLSA-N 1 2 305.780 4.116 20 0 DIADLO Oc1cccc(C[N@H+]2CC[C@](F)(c3ccccc3)C2)c1Cl ZINC001560786219 1060646993 /nfs/dbraw/zinc/64/69/93/1060646993.db2.gz TVWAMVQMIDIQOF-QGZVFWFLSA-N 1 2 305.780 4.116 20 0 DIADLO CCCOc1ccc(C[N@@H+]2CCC=C(Br)C2)cc1C ZINC001560786546 1060647737 /nfs/dbraw/zinc/64/77/37/1060647737.db2.gz XLHSUYGBWBLMSA-UHFFFAOYSA-N 1 2 324.262 4.268 20 0 DIADLO CCCOc1ccc(C[N@H+]2CCC=C(Br)C2)cc1C ZINC001560786546 1060647741 /nfs/dbraw/zinc/64/77/41/1060647741.db2.gz XLHSUYGBWBLMSA-UHFFFAOYSA-N 1 2 324.262 4.268 20 0 DIADLO CSc1c(Cl)cccc1-n1c(C)[nH+]c2ccc(N)cc21 ZINC001250163426 1060655226 /nfs/dbraw/zinc/65/52/26/1060655226.db2.gz WHORPTNZMIKQBH-UHFFFAOYSA-N 1 2 303.818 4.291 20 0 DIADLO CCC[C@@H](Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1)C1CCC1 ZINC001560798843 1060659342 /nfs/dbraw/zinc/65/93/42/1060659342.db2.gz QKKSJMFZJNRPAK-RVKKMQEKSA-N 1 2 317.477 4.076 20 0 DIADLO CC(C)(C)[C@H]1C[N@H+](Cc2cc3ccnc(Cl)c3s2)CCO1 ZINC001560801165 1060660743 /nfs/dbraw/zinc/66/07/43/1060660743.db2.gz HELOFQCTIYTTMC-CYBMUJFWSA-N 1 2 324.877 4.197 20 0 DIADLO CC(C)(C)[C@H]1C[N@@H+](Cc2cc3ccnc(Cl)c3s2)CCO1 ZINC001560801165 1060660754 /nfs/dbraw/zinc/66/07/54/1060660754.db2.gz HELOFQCTIYTTMC-CYBMUJFWSA-N 1 2 324.877 4.197 20 0 DIADLO CCOc1cc(C)ccc1C[N@H+](C)Cc1nc2ccccc2o1 ZINC001250180337 1060662089 /nfs/dbraw/zinc/66/20/89/1060662089.db2.gz NUGPNTDTFTYFIC-UHFFFAOYSA-N 1 2 310.397 4.167 20 0 DIADLO CCOc1cc(C)ccc1C[N@@H+](C)Cc1nc2ccccc2o1 ZINC001250180337 1060662096 /nfs/dbraw/zinc/66/20/96/1060662096.db2.gz NUGPNTDTFTYFIC-UHFFFAOYSA-N 1 2 310.397 4.167 20 0 DIADLO COc1cc(Nc2cnc(Cl)c(Cl)c2Cl)[nH+]cc1C ZINC001250200299 1060680124 /nfs/dbraw/zinc/68/01/24/1060680124.db2.gz ORNIYNZXTITQSU-UHFFFAOYSA-N 1 2 318.591 4.497 20 0 DIADLO Oc1ccc(F)c(Nc2cc(Cl)c3[nH+]ccn3c2)c1Cl ZINC001250229726 1060707230 /nfs/dbraw/zinc/70/72/30/1060707230.db2.gz MKBRTHUFZNWDHC-UHFFFAOYSA-N 1 2 312.131 4.229 20 0 DIADLO Oc1ccc(F)c(Nc2ccc[nH+]c2N2CCCCC2)c1Cl ZINC001250229293 1060708769 /nfs/dbraw/zinc/70/87/69/1060708769.db2.gz ZGUDQEHJWYBHQM-UHFFFAOYSA-N 1 2 321.783 4.314 20 0 DIADLO CO[C@@H](CNc1ccc(-n2c[nH+]c(C)c2C)cc1)C1CCCC1 ZINC001560860032 1060717209 /nfs/dbraw/zinc/71/72/09/1060717209.db2.gz ZGMPWSBQLSCTHW-IBGZPJMESA-N 1 2 313.445 4.106 20 0 DIADLO COc1cc(OC)c(C[N@@H+]2CCc3sccc3[C@H]2C)cc1F ZINC001560870521 1060730268 /nfs/dbraw/zinc/73/02/68/1060730268.db2.gz IRFFUSRRWLXPJA-LLVKDONJSA-N 1 2 321.417 4.024 20 0 DIADLO COc1cc(OC)c(C[N@H+]2CCc3sccc3[C@H]2C)cc1F ZINC001560870521 1060730281 /nfs/dbraw/zinc/73/02/81/1060730281.db2.gz IRFFUSRRWLXPJA-LLVKDONJSA-N 1 2 321.417 4.024 20 0 DIADLO c1cn(Cc2ccc(CCCCOCc3ccccc3)cc2)c[nH+]1 ZINC001250252267 1060731456 /nfs/dbraw/zinc/73/14/56/1060731456.db2.gz BNEYKZPVNDXLOB-UHFFFAOYSA-N 1 2 320.436 4.471 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1c(F)ccc(C)c1OC ZINC001250251483 1060732909 /nfs/dbraw/zinc/73/29/09/1060732909.db2.gz RHUIISWGQMFPAI-AWEZNQCLSA-N 1 2 317.404 4.344 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1c(F)ccc(C)c1OC ZINC001250251483 1060732918 /nfs/dbraw/zinc/73/29/18/1060732918.db2.gz RHUIISWGQMFPAI-AWEZNQCLSA-N 1 2 317.404 4.344 20 0 DIADLO COc1ccc(F)c(Nc2cccc3[nH+]c(C)cn32)c1Cl ZINC001250301218 1060767456 /nfs/dbraw/zinc/76/74/56/1060767456.db2.gz HPNWITKKYCXVRK-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO CCOc1nccc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c1Cl ZINC001250361769 1060788618 /nfs/dbraw/zinc/78/86/18/1060788618.db2.gz YDELGHQRFWCJRE-ZDUSSCGKSA-N 1 2 316.832 4.253 20 0 DIADLO CCOc1nccc(C[N@H+]2CCc3ccccc3[C@@H]2C)c1Cl ZINC001250361769 1060788637 /nfs/dbraw/zinc/78/86/37/1060788637.db2.gz YDELGHQRFWCJRE-ZDUSSCGKSA-N 1 2 316.832 4.253 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1)C(=O)OC(C)(C)C ZINC001560926816 1060790693 /nfs/dbraw/zinc/79/06/93/1060790693.db2.gz ZAZOYCGNIBGQAB-XNRPHZJLSA-N 1 2 323.864 4.296 20 0 DIADLO c1ccc(COc2ccc3[nH]c(C4CCOCC4)[nH+]c3c2)cc1 ZINC001250432923 1060800526 /nfs/dbraw/zinc/80/05/26/1060800526.db2.gz DLAOTIGMNFSMJX-UHFFFAOYSA-N 1 2 308.381 4.036 20 0 DIADLO Fc1cc2[nH]c(-c3ccccc3Cl)nc2cc1-n1cc[nH+]c1 ZINC001250449059 1060807496 /nfs/dbraw/zinc/80/74/96/1060807496.db2.gz UBTINCNHLVNOGK-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO CCc1cccc2cc(C[N@@H+]3CCOc4ccc(O)cc4C3)oc21 ZINC001560942737 1060807556 /nfs/dbraw/zinc/80/75/56/1060807556.db2.gz FEDMSTOJTLEPJN-UHFFFAOYSA-N 1 2 323.392 4.095 20 0 DIADLO CCc1cccc2cc(C[N@H+]3CCOc4ccc(O)cc4C3)oc21 ZINC001560942737 1060807578 /nfs/dbraw/zinc/80/75/78/1060807578.db2.gz FEDMSTOJTLEPJN-UHFFFAOYSA-N 1 2 323.392 4.095 20 0 DIADLO Cc1cc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)ccc1F ZINC001250501134 1060856414 /nfs/dbraw/zinc/85/64/14/1060856414.db2.gz KBPCSHOPXDZGAP-UHFFFAOYSA-N 1 2 310.307 4.002 20 0 DIADLO COc1cc2ccccc2cc1C[NH2+]Cc1nc2ccccc2o1 ZINC001561014969 1060873541 /nfs/dbraw/zinc/87/35/41/1060873541.db2.gz HMNMLXBKGIQREO-UHFFFAOYSA-N 1 2 318.376 4.279 20 0 DIADLO CCn1c2ccc(C)cc2[nH+]c1C[C@@H](C)CCCC(C)(C)O ZINC001250557091 1060895644 /nfs/dbraw/zinc/89/56/44/1060895644.db2.gz ZDCGVRUAGPIDMU-AWEZNQCLSA-N 1 2 302.462 4.484 20 0 DIADLO CCCn1c(CCc2ccc(C)o2)[nH+]c2ccc(F)c(F)c21 ZINC001250559896 1060899206 /nfs/dbraw/zinc/89/92/06/1060899206.db2.gz BETCIMCVGWNGDX-UHFFFAOYSA-N 1 2 304.340 4.411 20 0 DIADLO Cc1cc(C)c2c(c1)CC[N@@H+](Cc1ncc(C(C)C)s1)C2 ZINC001561054765 1060901941 /nfs/dbraw/zinc/90/19/41/1060901941.db2.gz ABMGPGRPHYBOHL-UHFFFAOYSA-N 1 2 300.471 4.442 20 0 DIADLO Cc1cc(C)c2c(c1)CC[N@H+](Cc1ncc(C(C)C)s1)C2 ZINC001561054765 1060901955 /nfs/dbraw/zinc/90/19/55/1060901955.db2.gz ABMGPGRPHYBOHL-UHFFFAOYSA-N 1 2 300.471 4.442 20 0 DIADLO COc1ccc2[nH]c(C[C@H](C)CCCC(C)(C)OC)[nH+]c2c1 ZINC001250566717 1060903496 /nfs/dbraw/zinc/90/34/96/1060903496.db2.gz BJVHMDXWQDNPOR-CYBMUJFWSA-N 1 2 304.434 4.345 20 0 DIADLO COc1cc2[nH+]c(C[C@H](C)CCCC(C)(C)OC)[nH]c2cc1F ZINC001250567571 1060903993 /nfs/dbraw/zinc/90/39/93/1060903993.db2.gz LRRATPZNDUMMGJ-GFCCVEGCSA-N 1 2 322.424 4.485 20 0 DIADLO COc1cc2[nH]c(C[C@H](C)CCCC(C)(C)OC)[nH+]c2cc1F ZINC001250567571 1060904015 /nfs/dbraw/zinc/90/40/15/1060904015.db2.gz LRRATPZNDUMMGJ-GFCCVEGCSA-N 1 2 322.424 4.485 20 0 DIADLO COc1ccc2[nH+]c(CCc3ccccc3Cl)n(C)c2c1 ZINC001250585732 1060919418 /nfs/dbraw/zinc/91/94/18/1060919418.db2.gz KDWBYTYOZWRALP-UHFFFAOYSA-N 1 2 300.789 4.021 20 0 DIADLO COc1cc2[nH+]c(Cc3ccc(C(F)(F)F)cc3)[nH]c2cc1F ZINC001250594697 1060928921 /nfs/dbraw/zinc/92/89/21/1060928921.db2.gz QWHMQLQXUNNUKT-UHFFFAOYSA-N 1 2 324.277 4.320 20 0 DIADLO COC(=O)CCCCCCCCc1[nH]c2cc(F)c(F)cc2[nH+]1 ZINC001250597921 1060930875 /nfs/dbraw/zinc/93/08/75/1060930875.db2.gz WWLOTEMJWOQRAY-UHFFFAOYSA-N 1 2 324.371 4.287 20 0 DIADLO CCC[C@@]1(C)CCC[N@@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001473191241 1060943165 /nfs/dbraw/zinc/94/31/65/1060943165.db2.gz KFWLMVYGDAJZMM-AEFFLSMTSA-N 1 2 323.864 4.456 20 0 DIADLO CCC[C@@]1(C)CCC[N@H+]([C@@H](C(=O)OC)c2ccccc2Cl)C1 ZINC001473191241 1060943185 /nfs/dbraw/zinc/94/31/85/1060943185.db2.gz KFWLMVYGDAJZMM-AEFFLSMTSA-N 1 2 323.864 4.456 20 0 DIADLO Clc1ccc([C@@H]2C[N@H+](CC[C@@H]3C[C@H]3C3CC3)CCO2)s1 ZINC001473189626 1060943260 /nfs/dbraw/zinc/94/32/60/1060943260.db2.gz CCEHCZZJVVNVJY-RDBSUJKOSA-N 1 2 311.878 4.211 20 0 DIADLO Clc1ccc([C@@H]2C[N@@H+](CC[C@@H]3C[C@H]3C3CC3)CCO2)s1 ZINC001473189626 1060943279 /nfs/dbraw/zinc/94/32/79/1060943279.db2.gz CCEHCZZJVVNVJY-RDBSUJKOSA-N 1 2 311.878 4.211 20 0 DIADLO Clc1ccc([C@H]2C[N@H+](CC[C@@H]3C[C@H]3C3CC3)CCO2)s1 ZINC001473189625 1060945358 /nfs/dbraw/zinc/94/53/58/1060945358.db2.gz CCEHCZZJVVNVJY-HZSPNIEDSA-N 1 2 311.878 4.211 20 0 DIADLO Clc1ccc([C@H]2C[N@@H+](CC[C@@H]3C[C@H]3C3CC3)CCO2)s1 ZINC001473189625 1060945377 /nfs/dbraw/zinc/94/53/77/1060945377.db2.gz CCEHCZZJVVNVJY-HZSPNIEDSA-N 1 2 311.878 4.211 20 0 DIADLO Cc1cc(Cl)ncc1-c1[nH]c2ccc(N3CCCC3)cc2[nH+]1 ZINC001250625741 1060957474 /nfs/dbraw/zinc/95/74/74/1060957474.db2.gz LSXURJKBLNPHCX-UHFFFAOYSA-N 1 2 312.804 4.187 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@H+](Cc2c(Cl)n[nH]c2C2CC2)C1 ZINC001462142887 1060965067 /nfs/dbraw/zinc/96/50/67/1060965067.db2.gz AOTIHDSLKFIBFS-KRWDZBQOSA-N 1 2 319.811 4.011 20 0 DIADLO F[C@@]1(c2ccccc2)CC[N@@H+](Cc2c(Cl)n[nH]c2C2CC2)C1 ZINC001462142887 1060965087 /nfs/dbraw/zinc/96/50/87/1060965087.db2.gz AOTIHDSLKFIBFS-KRWDZBQOSA-N 1 2 319.811 4.011 20 0 DIADLO CC1(C)C[C@H](C[N@@H+](Cc2ccccc2)CC(F)F)C(C)(C)O1 ZINC001473209646 1060977130 /nfs/dbraw/zinc/97/71/30/1060977130.db2.gz ARGKDEGHJLVRDN-OAHLLOKOSA-N 1 2 311.416 4.347 20 0 DIADLO CC1(C)C[C@H](C[N@H+](Cc2ccccc2)CC(F)F)C(C)(C)O1 ZINC001473209646 1060977148 /nfs/dbraw/zinc/97/71/48/1060977148.db2.gz ARGKDEGHJLVRDN-OAHLLOKOSA-N 1 2 311.416 4.347 20 0 DIADLO CCCC[C@H](C)[C@@H](C)Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001462172480 1060990410 /nfs/dbraw/zinc/99/04/10/1060990410.db2.gz BOVHPGOULBRAHN-MWDXBVQZSA-N 1 2 319.493 4.322 20 0 DIADLO CCCC[C@H](C)[C@H](C)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)[nH+]c1 ZINC001462172477 1060991711 /nfs/dbraw/zinc/99/17/11/1060991711.db2.gz BOVHPGOULBRAHN-HZMVEIRTSA-N 1 2 319.493 4.322 20 0 DIADLO Clc1cccc(-c2csc(Cn3cc[nH+]c3)n2)c1Cl ZINC001473232693 1061011548 /nfs/dbraw/zinc/01/15/48/1061011548.db2.gz PAUDDQCBTPYLOS-UHFFFAOYSA-N 1 2 310.209 4.362 20 0 DIADLO CCC[C@@H]1C[N@@H+]([C@H](C)c2ccccc2Br)CCO1 ZINC001473281983 1061052132 /nfs/dbraw/zinc/05/21/32/1061052132.db2.gz IKYOHGICZKBGHE-CHWSQXEVSA-N 1 2 312.251 4.011 20 0 DIADLO CCC[C@@H]1C[N@H+]([C@H](C)c2ccccc2Br)CCO1 ZINC001473281983 1061052145 /nfs/dbraw/zinc/05/21/45/1061052145.db2.gz IKYOHGICZKBGHE-CHWSQXEVSA-N 1 2 312.251 4.011 20 0 DIADLO CC[C@H]1CCc2ccccc2N1Cc1[nH+]cc(C)c(OC)c1C ZINC001473264463 1061039347 /nfs/dbraw/zinc/03/93/47/1061039347.db2.gz RIYSQFVHYHKHOB-KRWDZBQOSA-N 1 2 310.441 4.438 20 0 DIADLO CN(C)c1[nH+]cc(CN(C)c2ccccc2F)c2ccccc21 ZINC001473271312 1061043638 /nfs/dbraw/zinc/04/36/38/1061043638.db2.gz XNONOVOLJUSDRQ-UHFFFAOYSA-N 1 2 309.388 4.076 20 0 DIADLO CC(C)CC[C@@H]1CCC[N@@H+]1Cc1ncsc1Br ZINC001473272872 1061044572 /nfs/dbraw/zinc/04/45/72/1061044572.db2.gz LJGRXIUSSORILR-NSHDSACASA-N 1 2 317.296 4.306 20 0 DIADLO CC(C)CC[C@@H]1CCC[N@H+]1Cc1ncsc1Br ZINC001473272872 1061044583 /nfs/dbraw/zinc/04/45/83/1061044583.db2.gz LJGRXIUSSORILR-NSHDSACASA-N 1 2 317.296 4.306 20 0 DIADLO COC(=O)[C@H](CC(C)C)[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001473287768 1061060121 /nfs/dbraw/zinc/06/01/21/1061060121.db2.gz JZOFPXCPFYBIHZ-KRWDZBQOSA-N 1 2 321.848 4.017 20 0 DIADLO COC(=O)[C@H](CC(C)C)[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001473287768 1061060131 /nfs/dbraw/zinc/06/01/31/1061060131.db2.gz JZOFPXCPFYBIHZ-KRWDZBQOSA-N 1 2 321.848 4.017 20 0 DIADLO Cc1c2nc(-c3ccc(-n4cc[nH+]c4)cc3)[nH]c2ccc1Cl ZINC001250771753 1061061312 /nfs/dbraw/zinc/06/13/12/1061061312.db2.gz CEARYPZYSNWQKP-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccc(-c4cccnc4)cc3)[nH+]c2c1 ZINC001250795646 1061071481 /nfs/dbraw/zinc/07/14/81/1061071481.db2.gz JUDRIOWIICVJHY-UHFFFAOYSA-N 1 2 314.392 4.358 20 0 DIADLO Cc1[nH]c(CN2CCc3cc(Cl)c(Cl)cc3[C@H]2C)[nH+]c1C ZINC001473306495 1061071539 /nfs/dbraw/zinc/07/15/39/1061071539.db2.gz ZFJZHSITVIQFCI-LLVKDONJSA-N 1 2 324.255 4.453 20 0 DIADLO CCOC(=O)[C@H](CC(C)C)[NH2+][C@H](c1ccccc1C)C1CC1 ZINC001473314728 1061078947 /nfs/dbraw/zinc/07/89/47/1061078947.db2.gz ZVMIMZWTBCJIQI-ROUUACIJSA-N 1 2 303.446 4.014 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2ncccc2Cl)C2CC2)c(F)c1 ZINC001473316354 1061082293 /nfs/dbraw/zinc/08/22/93/1061082293.db2.gz VZTYCCUSMIABRJ-MRXNPFEDSA-N 1 2 308.759 4.254 20 0 DIADLO Oc1ccc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c(Cl)c1 ZINC001250840370 1061090322 /nfs/dbraw/zinc/09/03/22/1061090322.db2.gz LNFFQSBMENEDDT-UHFFFAOYSA-N 1 2 313.788 4.189 20 0 DIADLO Cc1ccc2c(c1)SCCCN2Cc1c[nH+]c2ccc(C)cn12 ZINC001462309623 1061095520 /nfs/dbraw/zinc/09/55/20/1061095520.db2.gz WKULOWVPIMYMHG-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO CC1(C)C[N@H+](Cc2ccnn2CC2CCC2)[C@@H]1c1cccs1 ZINC001462308852 1061095953 /nfs/dbraw/zinc/09/59/53/1061095953.db2.gz UVDBTALYZDSRKK-QGZVFWFLSA-N 1 2 315.486 4.328 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccnn2CC2CCC2)[C@@H]1c1cccs1 ZINC001462308852 1061095969 /nfs/dbraw/zinc/09/59/69/1061095969.db2.gz UVDBTALYZDSRKK-QGZVFWFLSA-N 1 2 315.486 4.328 20 0 DIADLO c1ccc(CCCOC2C[NH+](Cc3ccc(C4CC4)cc3)C2)cc1 ZINC001462324198 1061104881 /nfs/dbraw/zinc/10/48/81/1061104881.db2.gz YGDKGUMXSCFFEN-UHFFFAOYSA-N 1 2 321.464 4.398 20 0 DIADLO CCn1c2ccc(C)cc2nc1-c1cccc(-n2cc[nH+]c2)c1 ZINC001250940344 1061135963 /nfs/dbraw/zinc/13/59/63/1061135963.db2.gz LGCXXPKORGADPW-UHFFFAOYSA-N 1 2 302.381 4.217 20 0 DIADLO CCn1c2ccc(F)cc2nc1-c1cccc(-n2cc[nH+]c2)c1 ZINC001250939988 1061136849 /nfs/dbraw/zinc/13/68/49/1061136849.db2.gz BTYKDHBGPVUDMM-UHFFFAOYSA-N 1 2 306.344 4.048 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3F)C2)cc1C ZINC001473402568 1061137352 /nfs/dbraw/zinc/13/73/52/1061137352.db2.gz LDAPXNRLLVQPSW-IBGZPJMESA-N 1 2 317.379 4.155 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@H](c3ccc(F)cc3F)C2)cc1C ZINC001473402568 1061137359 /nfs/dbraw/zinc/13/73/59/1061137359.db2.gz LDAPXNRLLVQPSW-IBGZPJMESA-N 1 2 317.379 4.155 20 0 DIADLO Fc1ccc2nc(-c3cccc(-n4cc[nH+]c4)c3)n(C3CC3)c2c1 ZINC001250940822 1061137807 /nfs/dbraw/zinc/13/78/07/1061137807.db2.gz ZSNMKKBQNJZFQG-UHFFFAOYSA-N 1 2 318.355 4.363 20 0 DIADLO Cc1c2nc(-c3cccc(-n4cc[nH+]c4)c3)[nH]c2ccc1Cl ZINC001250940719 1061138023 /nfs/dbraw/zinc/13/80/23/1061138023.db2.gz VAODZHJGJNCVEZ-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO CC(C)n1c2ccccc2nc1-c1cccc(-n2cc[nH+]c2)c1 ZINC001250940784 1061138867 /nfs/dbraw/zinc/13/88/67/1061138867.db2.gz XOQHCRCGYGKIEV-UHFFFAOYSA-N 1 2 302.381 4.470 20 0 DIADLO Fc1ccc(CCC[NH+]2Cc3cc(F)c(F)cc3C2)cc1F ZINC001462381940 1061139984 /nfs/dbraw/zinc/13/99/84/1061139984.db2.gz ZLLXAIRVWXCBKN-UHFFFAOYSA-N 1 2 309.306 4.191 20 0 DIADLO Cc1ccc2cc(-c3[nH]c4ccc(N(C)C)cc4[nH+]3)ccc2n1 ZINC001250944531 1061141118 /nfs/dbraw/zinc/14/11/18/1061141118.db2.gz JQQBJYGAGYACKC-UHFFFAOYSA-N 1 2 302.381 4.153 20 0 DIADLO CCCn1c[nH+]cc1CN1Cc2ccccc2-c2ccccc21 ZINC001462384089 1061141154 /nfs/dbraw/zinc/14/11/54/1061141154.db2.gz BXTAHJGIIWZPHE-UHFFFAOYSA-N 1 2 303.409 4.480 20 0 DIADLO Cc1[nH]nc(C[N@@H+]2CCC[C@]2(C)Cc2cccc(Cl)c2)c1C ZINC001462397848 1061148472 /nfs/dbraw/zinc/14/84/72/1061148472.db2.gz CFIDXIULCDRVEM-GOSISDBHSA-N 1 2 317.864 4.277 20 0 DIADLO Cc1[nH]nc(C[N@H+]2CCC[C@]2(C)Cc2cccc(Cl)c2)c1C ZINC001462397848 1061148484 /nfs/dbraw/zinc/14/84/84/1061148484.db2.gz CFIDXIULCDRVEM-GOSISDBHSA-N 1 2 317.864 4.277 20 0 DIADLO C[C@@H](CNc1c[nH+]cc2c1CCCC2)c1cc(F)cc(F)c1 ZINC001462422271 1061164816 /nfs/dbraw/zinc/16/48/16/1061164816.db2.gz UGNMMJPCHBEHNN-LBPRGKRZSA-N 1 2 302.368 4.454 20 0 DIADLO CCSc1ccccc1C[C@H](C)[NH2+][C@H](C)C(=O)OC(C)(C)C ZINC001462430574 1061170602 /nfs/dbraw/zinc/17/06/02/1061170602.db2.gz ZDJPOGYBEQLHPK-UONOGXRCSA-N 1 2 323.502 4.049 20 0 DIADLO CC1(C)CCC[C@H]1CC[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1 ZINC001462454669 1061183671 /nfs/dbraw/zinc/18/36/71/1061183671.db2.gz HQBMCGFSXCGNGS-JKSUJKDBSA-N 1 2 304.482 4.232 20 0 DIADLO CC(C)C[C@H](C)[NH2+]c1ccc(N2CCOC[C@@H]2C)c(Cl)c1 ZINC001462482999 1061203806 /nfs/dbraw/zinc/20/38/06/1061203806.db2.gz UBQFWYRWNRNKMQ-KBPBESRZSA-N 1 2 310.869 4.412 20 0 DIADLO COc1cc2c(cc1Cl)C[N@H+](Cc1ccc(C)c(F)c1)CC2 ZINC001473511696 1061203910 /nfs/dbraw/zinc/20/39/10/1061203910.db2.gz NEQNAPNCVNHXSY-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO COc1cc2c(cc1Cl)C[N@@H+](Cc1ccc(C)c(F)c1)CC2 ZINC001473511696 1061203931 /nfs/dbraw/zinc/20/39/31/1061203931.db2.gz NEQNAPNCVNHXSY-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO Cc1cc(Br)c(C[N@H+]2C[C@H](C)[C@@H]2C)cc1Cl ZINC001473511559 1061205593 /nfs/dbraw/zinc/20/55/93/1061205593.db2.gz YCWGEZKWPAHPRV-UWVGGRQHSA-N 1 2 302.643 4.251 20 0 DIADLO Cc1cc(Br)c(C[N@@H+]2C[C@H](C)[C@@H]2C)cc1Cl ZINC001473511559 1061205612 /nfs/dbraw/zinc/20/56/12/1061205612.db2.gz YCWGEZKWPAHPRV-UWVGGRQHSA-N 1 2 302.643 4.251 20 0 DIADLO COC(=O)[C@H](c1ccccc1Cl)[NH+]1CCC(C)(C2CC2)CC1 ZINC001473516742 1061212150 /nfs/dbraw/zinc/21/21/50/1061212150.db2.gz OZNPWUBQFWIWNQ-INIZCTEOSA-N 1 2 321.848 4.066 20 0 DIADLO CCc1cccc(Cl)c1C[N@@H+]1Cc2cccc(OC)c2C1 ZINC001462511618 1061220090 /nfs/dbraw/zinc/22/00/90/1061220090.db2.gz XWIFMVPVVWPMIT-UHFFFAOYSA-N 1 2 301.817 4.427 20 0 DIADLO CCc1cccc(Cl)c1C[N@H+]1Cc2cccc(OC)c2C1 ZINC001462511618 1061220111 /nfs/dbraw/zinc/22/01/11/1061220111.db2.gz XWIFMVPVVWPMIT-UHFFFAOYSA-N 1 2 301.817 4.427 20 0 DIADLO COc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1cc(F)ccc1F)C2 ZINC001473524744 1061221992 /nfs/dbraw/zinc/22/19/92/1061221992.db2.gz MJHUYKRHBUURPZ-UHFFFAOYSA-N 1 2 315.363 4.021 20 0 DIADLO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1cc(F)ccc1F)C2 ZINC001473524744 1061222013 /nfs/dbraw/zinc/22/20/13/1061222013.db2.gz MJHUYKRHBUURPZ-UHFFFAOYSA-N 1 2 315.363 4.021 20 0 DIADLO CCCC1(CCC)CCCN1C(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001455444813 1061223143 /nfs/dbraw/zinc/22/31/43/1061223143.db2.gz DODZLDJKAHRSRJ-KRWDZBQOSA-N 1 2 319.493 4.432 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC001473530087 1061225532 /nfs/dbraw/zinc/22/55/32/1061225532.db2.gz CJJDEMQCMDHZFK-AEFFLSMTSA-N 1 2 315.457 4.336 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC001473530087 1061225554 /nfs/dbraw/zinc/22/55/54/1061225554.db2.gz CJJDEMQCMDHZFK-AEFFLSMTSA-N 1 2 315.457 4.336 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1nc2cc(Cl)ccc2n1C(C)C ZINC001251091533 1061231072 /nfs/dbraw/zinc/23/10/72/1061231072.db2.gz GYMDCULFHXEIRX-UHFFFAOYSA-N 1 2 300.793 4.223 20 0 DIADLO CCCCn1c2ccc(Cl)cc2nc1-c1ccc(N)[nH+]c1C ZINC001251091564 1061232745 /nfs/dbraw/zinc/23/27/45/1061232745.db2.gz IRTVRLBIMDAXBI-UHFFFAOYSA-N 1 2 314.820 4.442 20 0 DIADLO CC[C@H](CC(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1)C(C)(C)C ZINC001455770645 1061235235 /nfs/dbraw/zinc/23/52/35/1061235235.db2.gz NAGANLJKLFTFIM-HUUCEWRRSA-N 1 2 305.466 4.152 20 0 DIADLO Cc1ccc(C[NH2+]Cc2cncc(Cl)c2Cl)c(Cl)n1 ZINC001462551875 1061256263 /nfs/dbraw/zinc/25/62/63/1061256263.db2.gz ZFKAYBCSLSMDPA-UHFFFAOYSA-N 1 2 316.619 4.035 20 0 DIADLO Cc1c2cccc(C)c2oc1C[N@H+](C)Cc1cc2n(n1)CCCC2 ZINC001473609774 1061283157 /nfs/dbraw/zinc/28/31/57/1061283157.db2.gz IPKJHQYRJUWLGF-UHFFFAOYSA-N 1 2 323.440 4.214 20 0 DIADLO Cc1c2cccc(C)c2oc1C[N@@H+](C)Cc1cc2n(n1)CCCC2 ZINC001473609774 1061283171 /nfs/dbraw/zinc/28/31/71/1061283171.db2.gz IPKJHQYRJUWLGF-UHFFFAOYSA-N 1 2 323.440 4.214 20 0 DIADLO Fc1cccc(Cl)c1[C@@H]1C[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)CCO1 ZINC001473616806 1061291445 /nfs/dbraw/zinc/29/14/45/1061291445.db2.gz JRVMXUSQCRBCSG-OEUWWYETSA-N 1 2 323.839 4.289 20 0 DIADLO Fc1cccc(Cl)c1[C@@H]1C[N@@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)CCO1 ZINC001473616806 1061291464 /nfs/dbraw/zinc/29/14/64/1061291464.db2.gz JRVMXUSQCRBCSG-OEUWWYETSA-N 1 2 323.839 4.289 20 0 DIADLO Clc1ccnc(C[NH+]2CCC(c3ccco3)CC2)c1Cl ZINC001473625712 1061300792 /nfs/dbraw/zinc/30/07/92/1061300792.db2.gz OPJSMNXAHSOFMS-UHFFFAOYSA-N 1 2 311.212 4.361 20 0 DIADLO CC(C)(C)n1c2cc(F)ccc2nc1-c1cccc2[nH+]ccn21 ZINC001251326198 1061315781 /nfs/dbraw/zinc/31/57/81/1061315781.db2.gz BWRIXZFTHCQOIJ-UHFFFAOYSA-N 1 2 308.360 4.245 20 0 DIADLO CCc1nnc(C[N@@H+](Cc2cccc(Cl)c2)CC(C)C)s1 ZINC001473671398 1061331816 /nfs/dbraw/zinc/33/18/16/1061331816.db2.gz WTQUHJCKADTHHQ-UHFFFAOYSA-N 1 2 323.893 4.412 20 0 DIADLO CCc1nnc(C[N@H+](Cc2cccc(Cl)c2)CC(C)C)s1 ZINC001473671398 1061331832 /nfs/dbraw/zinc/33/18/32/1061331832.db2.gz WTQUHJCKADTHHQ-UHFFFAOYSA-N 1 2 323.893 4.412 20 0 DIADLO CCc1cnc(C[N@@H+]2CCc3cc(C(C)C)ccc3C2)s1 ZINC001462674735 1061332317 /nfs/dbraw/zinc/33/23/17/1061332317.db2.gz PYPGMRVBOKGISH-UHFFFAOYSA-N 1 2 300.471 4.387 20 0 DIADLO CCc1cnc(C[N@H+]2CCc3cc(C(C)C)ccc3C2)s1 ZINC001462674735 1061332333 /nfs/dbraw/zinc/33/23/33/1061332333.db2.gz PYPGMRVBOKGISH-UHFFFAOYSA-N 1 2 300.471 4.387 20 0 DIADLO COC[C@H](C)[N@H+](C/C(Cl)=C\Cl)[C@@H]1CCc2ccccc21 ZINC001473691188 1061350193 /nfs/dbraw/zinc/35/01/93/1061350193.db2.gz DVWADQZOECBQGI-HZNNPKNDSA-N 1 2 314.256 4.330 20 0 DIADLO COC[C@H](C)[N@@H+](C/C(Cl)=C\Cl)[C@@H]1CCc2ccccc21 ZINC001473691188 1061350213 /nfs/dbraw/zinc/35/02/13/1061350213.db2.gz DVWADQZOECBQGI-HZNNPKNDSA-N 1 2 314.256 4.330 20 0 DIADLO CCC(CC)C[NH2+][C@@H](Cc1ccccc1)C(=O)OC1CCCC1 ZINC001473699254 1061354327 /nfs/dbraw/zinc/35/43/27/1061354327.db2.gz FQHAPIJSTNVOBK-IBGZPJMESA-N 1 2 317.473 4.109 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@@H](C(=O)OC(C)(C)C)C2CC2)C(C)C)c1 ZINC001473702967 1061357459 /nfs/dbraw/zinc/35/74/59/1061357459.db2.gz VCNPELCIBGAZED-QZTJIDSGSA-N 1 2 317.473 4.402 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@H+](Cc1ccc(F)c(F)c1)CC2 ZINC001473738523 1061384289 /nfs/dbraw/zinc/38/42/89/1061384289.db2.gz HCYQUSXOHHLXRG-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO Cc1c(Cl)ccc2c1C[N@@H+](Cc1ccc(F)c(F)c1)CC2 ZINC001473738523 1061384314 /nfs/dbraw/zinc/38/43/14/1061384314.db2.gz HCYQUSXOHHLXRG-UHFFFAOYSA-N 1 2 307.771 4.485 20 0 DIADLO CCc1cccc(C)c1-c1nc2cc(-n3cc[nH+]c3)c(F)cc2[nH]1 ZINC001251582799 1061409532 /nfs/dbraw/zinc/40/95/32/1061409532.db2.gz AXZSASXZHAYQTK-UHFFFAOYSA-N 1 2 320.371 4.426 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2nc3c(s2)C(C)(C)CC(C)(C)C3)CCO1 ZINC001473814996 1061420705 /nfs/dbraw/zinc/42/07/05/1061420705.db2.gz CFBRKRPVSUXXEM-CYBMUJFWSA-N 1 2 322.518 4.004 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2nc3c(s2)C(C)(C)CC(C)(C)C3)CCO1 ZINC001473814996 1061420713 /nfs/dbraw/zinc/42/07/13/1061420713.db2.gz CFBRKRPVSUXXEM-CYBMUJFWSA-N 1 2 322.518 4.004 20 0 DIADLO CCCOc1cc(F)ccc1-c1[nH]c2ccc(N(C)C)cc2[nH+]1 ZINC001251677369 1061440504 /nfs/dbraw/zinc/44/05/04/1061440504.db2.gz GDZRMCSVYYZXKI-UHFFFAOYSA-N 1 2 313.376 4.224 20 0 DIADLO Cc1cccnc1[C@@H](C)[NH2+]Cc1csc(CCC(C)C)n1 ZINC001473880052 1061448245 /nfs/dbraw/zinc/44/82/45/1061448245.db2.gz QLWWRHYOMCOBMF-CQSZACIVSA-N 1 2 303.475 4.286 20 0 DIADLO COC(=O)[C@]1([NH2+]C[C@H](C)C(C)(C)C)CC[C@H](C)c2ccccc21 ZINC001473887751 1061449579 /nfs/dbraw/zinc/44/95/79/1061449579.db2.gz IFHPAFINTNRKTK-AVYPCKFXSA-N 1 2 317.473 4.224 20 0 DIADLO CC(C)(C)[C@H]1CC[N@H+](Cc2nc(Cl)ccc2Cl)CCO1 ZINC001473896499 1061453908 /nfs/dbraw/zinc/45/39/08/1061453908.db2.gz CQTJQYKVMHKVCB-CYBMUJFWSA-N 1 2 317.260 4.025 20 0 DIADLO CC(C)(C)[C@H]1CC[N@@H+](Cc2nc(Cl)ccc2Cl)CCO1 ZINC001473896499 1061453915 /nfs/dbraw/zinc/45/39/15/1061453915.db2.gz CQTJQYKVMHKVCB-CYBMUJFWSA-N 1 2 317.260 4.025 20 0 DIADLO c1cc(N2CCCC2)cc2[nH+]c(-c3cncc(C4CC4)c3)[nH]c12 ZINC001251721914 1061455537 /nfs/dbraw/zinc/45/55/37/1061455537.db2.gz JLOZUPVPUTXPGA-UHFFFAOYSA-N 1 2 304.397 4.103 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@@H](Cc3ccccc3)[C@@H]2C)c(C)[nH+]1 ZINC001457434452 1061457227 /nfs/dbraw/zinc/45/72/27/1061457227.db2.gz JTMBWUCUIXXLJJ-HKUYNNGSSA-N 1 2 322.452 4.100 20 0 DIADLO COc1ccc(C[NH2+]Cc2c(F)ccc(F)c2Cl)cc1F ZINC001473919873 1061468034 /nfs/dbraw/zinc/46/80/34/1061468034.db2.gz SYQUTIRFZPESMN-UHFFFAOYSA-N 1 2 315.722 4.056 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2cnc[nH]2)c2cccs2)cc1 ZINC001473937938 1061482865 /nfs/dbraw/zinc/48/28/65/1061482865.db2.gz UITARFYKQRFMPK-HNNXBMFYSA-N 1 2 303.818 4.004 20 0 DIADLO Cc1cc(C)c(C(=O)NCC2(CC(C)C)CCCC2)c(C)[nH+]1 ZINC001457677461 1061483214 /nfs/dbraw/zinc/48/32/14/1061483214.db2.gz TYPXJDQKHIIJBD-UHFFFAOYSA-N 1 2 302.462 4.343 20 0 DIADLO Fc1ccc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c2[nH]ccc21 ZINC001251794806 1061489547 /nfs/dbraw/zinc/48/95/47/1061489547.db2.gz JKGGGMGPGVAKSU-UHFFFAOYSA-N 1 2 320.371 4.451 20 0 DIADLO Cc1cc(C)c(C(=O)N(C)Cc2ccc3ccccc3c2)c(C)[nH+]1 ZINC001463545914 1061497155 /nfs/dbraw/zinc/49/71/55/1061497155.db2.gz SWVBGKCVCGVTNV-UHFFFAOYSA-N 1 2 318.420 4.432 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N3CCCC[C@H]3CCC(C)C)ccn12 ZINC001457900524 1061520869 /nfs/dbraw/zinc/52/08/69/1061520869.db2.gz BGNNCWIJPOXEIY-KRWDZBQOSA-N 1 2 313.445 4.074 20 0 DIADLO CCn1ccc(C[NH2+][C@@H](Cc2ccccc2)c2ccccc2F)n1 ZINC001474012229 1061553480 /nfs/dbraw/zinc/55/34/80/1061553480.db2.gz GAUPOHMXWQEJLI-FQEVSTJZSA-N 1 2 323.415 4.116 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)C1[C@@H]2CCCCCC[C@@H]12 ZINC001464071578 1061553730 /nfs/dbraw/zinc/55/37/30/1061553730.db2.gz DUDXEGIMBQNPPN-HUUCEWRRSA-N 1 2 309.413 4.027 20 0 DIADLO CC/C=C(/F)C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001464222689 1061563905 /nfs/dbraw/zinc/56/39/05/1061563905.db2.gz TWLYTLPFOVSYJW-FZSIALSZSA-N 1 2 313.376 4.088 20 0 DIADLO CCc1cc(NC[C@@H](CC)Oc2cccc(C)c2)nc(CC)[nH+]1 ZINC001458106751 1061573087 /nfs/dbraw/zinc/57/30/87/1061573087.db2.gz SUUPJONWBMLLGV-MRXNPFEDSA-N 1 2 313.445 4.179 20 0 DIADLO Cc1ccc(OC[C@@H](C)Nc2cc(C)[nH+]c(C3CCC3)n2)cc1 ZINC001458135197 1061590527 /nfs/dbraw/zinc/59/05/27/1061590527.db2.gz IJJIVUJDEDCEPS-OAHLLOKOSA-N 1 2 311.429 4.240 20 0 DIADLO CN(C)c1ccc(NCc2ccc(-c3ccccc3)cc2)[nH+]c1 ZINC001474053274 1061599752 /nfs/dbraw/zinc/59/97/52/1061599752.db2.gz QJVSNOPSBOCGRW-UHFFFAOYSA-N 1 2 303.409 4.427 20 0 DIADLO CC[C@H](Nc1cc(C)[nH+]c(C2CCC2)n1)c1nc2ccccc2[nH]1 ZINC001458157560 1061604400 /nfs/dbraw/zinc/60/44/00/1061604400.db2.gz PSPSGPGENLJUGI-AWEZNQCLSA-N 1 2 321.428 4.492 20 0 DIADLO CCCn1c[nH+]cc1CNc1cccc(-c2nc(C)c(C)o2)c1 ZINC001474059237 1061604583 /nfs/dbraw/zinc/60/45/83/1061604583.db2.gz OTXLBHQLDKYYSF-UHFFFAOYSA-N 1 2 310.401 4.177 20 0 DIADLO C[C@H](CN(C)c1nc2ccccc2n2c[nH+]cc12)c1ccccc1 ZINC001458155686 1061604818 /nfs/dbraw/zinc/60/48/18/1061604818.db2.gz DJYPUZMQEYCBCT-OAHLLOKOSA-N 1 2 316.408 4.122 20 0 DIADLO Cc1cc(F)c(CNc2ccc([NH+]3CCCC3)cc2)c(F)c1 ZINC001474062824 1061608512 /nfs/dbraw/zinc/60/85/12/1061608512.db2.gz HCTNSINTFCWFBU-UHFFFAOYSA-N 1 2 302.368 4.486 20 0 DIADLO CCCCOc1cc(CNc2ccc(C)[nH+]c2C)ccc1OC ZINC001474079272 1061624611 /nfs/dbraw/zinc/62/46/11/1061624611.db2.gz DXCCUUYHAMQNCH-UHFFFAOYSA-N 1 2 314.429 4.498 20 0 DIADLO CCc1cc(NCc2ccccc2OCC2CC2)nc(CC)[nH+]1 ZINC001458200294 1061628090 /nfs/dbraw/zinc/62/80/90/1061628090.db2.gz IAWUMDZUYXWDBT-UHFFFAOYSA-N 1 2 311.429 4.002 20 0 DIADLO Cc1cccc(-c2nsc(Nc3ccc4c(c3)[nH+]cn4C)n2)c1 ZINC001458211481 1061634329 /nfs/dbraw/zinc/63/43/29/1061634329.db2.gz UTUUJUQTUXNPTB-UHFFFAOYSA-N 1 2 321.409 4.144 20 0 DIADLO COc1ccc(CNc2ccc([NH+](C)C)c(C)c2)cc1Cl ZINC001474094405 1061639229 /nfs/dbraw/zinc/63/92/29/1061639229.db2.gz MGGXYFAETKWEBQ-UHFFFAOYSA-N 1 2 304.821 4.335 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2cc(Cl)cc(Cl)c2)c[nH+]1 ZINC001464903798 1061647125 /nfs/dbraw/zinc/64/71/25/1061647125.db2.gz PZHOYYFFJPXJAE-UHFFFAOYSA-N 1 2 324.211 4.327 20 0 DIADLO Cc1cc(N(C)Cc2cc3ccccc3o2)nc(C2CCC2)[nH+]1 ZINC001458233200 1061651814 /nfs/dbraw/zinc/65/18/14/1061651814.db2.gz QJDALESWZUMAAL-UHFFFAOYSA-N 1 2 307.397 4.435 20 0 DIADLO CCCCO[C@@H]1C[C@H](Nc2cc(C)[nH+]c(C3CC3)n2)C1(C)C ZINC001458235861 1061652910 /nfs/dbraw/zinc/65/29/10/1061652910.db2.gz ZPPDDJWYUFLBKC-LSDHHAIUSA-N 1 2 303.450 4.058 20 0 DIADLO Cc1cc(NCC2(OC(C)C)CCCCC2)nc(C2CC2)[nH+]1 ZINC001458236948 1061653166 /nfs/dbraw/zinc/65/31/66/1061653166.db2.gz JWIJESQXRUTCBT-UHFFFAOYSA-N 1 2 303.450 4.202 20 0 DIADLO C[C@H](c1nnc(-c2ccc(-c3ccccc3)cc2)o1)n1cc[nH+]c1 ZINC001252537138 1061658448 /nfs/dbraw/zinc/65/84/48/1061658448.db2.gz VZPBGIDPYLHFIG-CQSZACIVSA-N 1 2 316.364 4.209 20 0 DIADLO CSCCCCCCNc1nc2ccccc2n2c[nH+]cc12 ZINC001458311297 1061690452 /nfs/dbraw/zinc/69/04/52/1061690452.db2.gz UZSUSOXLGVEYOB-UHFFFAOYSA-N 1 2 314.458 4.218 20 0 DIADLO CCCNc1ccc(CNc2cc(C)[nH+]c(C3CCC3)n2)cc1 ZINC001458366927 1061725991 /nfs/dbraw/zinc/72/59/91/1061725991.db2.gz WVVLXLMABHVRMB-UHFFFAOYSA-N 1 2 310.445 4.487 20 0 DIADLO Cc1cc(N(C)[C@H](C)Cc2cccc(F)c2)nc(C2CCC2)[nH+]1 ZINC001458427108 1061757241 /nfs/dbraw/zinc/75/72/41/1061757241.db2.gz GNOSFYFXFQNZGE-CQSZACIVSA-N 1 2 313.420 4.259 20 0 DIADLO Cc1cc(N2CCc3sc(Cl)cc3C2)nc(C2CCC2)[nH+]1 ZINC001458452345 1061771666 /nfs/dbraw/zinc/77/16/66/1061771666.db2.gz ASZWVHFSSJGYBM-UHFFFAOYSA-N 1 2 319.861 4.330 20 0 DIADLO Cc1cn2cc(NC(=O)NC(C)(C)c3ccccc3C)ccc2[nH+]1 ZINC001465532331 1061772472 /nfs/dbraw/zinc/77/24/72/1061772472.db2.gz ZWUOUZLUOKXVMF-UHFFFAOYSA-N 1 2 322.412 4.008 20 0 DIADLO Oc1cc(Cl)cc(C[NH2+]C2(c3c(F)cccc3F)CCC2)c1 ZINC001474227970 1061789662 /nfs/dbraw/zinc/78/96/62/1061789662.db2.gz XORWZYJJXMDXPQ-UHFFFAOYSA-N 1 2 323.770 4.493 20 0 DIADLO COc1ccc(CC[C@H](C)Nc2[nH]c3cc(C)ccc3[nH+]2)cc1 ZINC001474248105 1061815864 /nfs/dbraw/zinc/81/58/64/1061815864.db2.gz HENJIVXLOLFHLY-AWEZNQCLSA-N 1 2 309.413 4.313 20 0 DIADLO COc1ccc2oc(CNc3[nH]c4cc(C)ccc4[nH+]3)cc2c1 ZINC001474249306 1061816268 /nfs/dbraw/zinc/81/62/68/1061816268.db2.gz ZNDNFNSKWJNVPZ-UHFFFAOYSA-N 1 2 307.353 4.238 20 0 DIADLO COc1cncc(CNc2[nH+]c3ccccc3n2CCC(C)C)c1 ZINC001474253754 1061823548 /nfs/dbraw/zinc/82/35/48/1061823548.db2.gz OSOXENOGOSLCSF-UHFFFAOYSA-N 1 2 324.428 4.098 20 0 DIADLO Cc1cc(N[C@@H]2c3ccccc3CC[C@H]2F)nc(C2CCC2)[nH+]1 ZINC001458550066 1061831333 /nfs/dbraw/zinc/83/13/33/1061831333.db2.gz QZDQQFJRRLCJEI-SJLPKXTDSA-N 1 2 311.404 4.490 20 0 DIADLO F[C@H]1COc2ccccc2[C@@H]1[NH2+]Cc1csc2ccccc12 ZINC001474266837 1061833701 /nfs/dbraw/zinc/83/37/01/1061833701.db2.gz ZYVVLXIHVQKEPY-YJBOKZPZSA-N 1 2 313.397 4.463 20 0 DIADLO CC(C)([NH2+]Cc1cccc(O)c1Cl)c1ccc(F)cc1F ZINC001474269223 1061835209 /nfs/dbraw/zinc/83/52/09/1061835209.db2.gz WJUOAOPFTXVSKO-UHFFFAOYSA-N 1 2 311.759 4.349 20 0 DIADLO Clc1ccc(CNc2[nH+]c3ccccc3n2CC2CC2)cn1 ZINC001474273486 1061842245 /nfs/dbraw/zinc/84/22/45/1061842245.db2.gz CSRPBJYGFJMOHV-UHFFFAOYSA-N 1 2 312.804 4.107 20 0 DIADLO Cc1cc(NC(=O)N[C@H]2CCc3ccc(C(C)C)cc32)c(C)c[nH+]1 ZINC001465948515 1061846593 /nfs/dbraw/zinc/84/65/93/1061846593.db2.gz DITBSCOAUJHJPK-SFHVURJKSA-N 1 2 323.440 4.053 20 0 DIADLO Cc1cc(NC(=O)N[C@@H]2CCc3ccc(C(C)C)cc32)c(C)c[nH+]1 ZINC001465948514 1061846769 /nfs/dbraw/zinc/84/67/69/1061846769.db2.gz DITBSCOAUJHJPK-GOSISDBHSA-N 1 2 323.440 4.053 20 0 DIADLO CCSc1ccccc1CCNc1cc(C)[nH+]c(C2CC2)n1 ZINC001458598662 1061848315 /nfs/dbraw/zinc/84/83/15/1061848315.db2.gz VQIZFBKXZHDFQH-UHFFFAOYSA-N 1 2 313.470 4.429 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1NC[C@@H](O)c1ccc(F)c(F)c1 ZINC001253351342 1061875228 /nfs/dbraw/zinc/87/52/28/1061875228.db2.gz PDWQOZVQCDKFDR-GOSISDBHSA-N 1 2 320.383 4.012 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccc(O)c(F)c2F)[C@H](c2ccco2)C1 ZINC001474319927 1061897793 /nfs/dbraw/zinc/89/77/93/1061897793.db2.gz SYLFNOKOVDBUES-AAEUAGOBSA-N 1 2 307.340 4.237 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccc(O)c(F)c2F)[C@H](c2ccco2)C1 ZINC001474319927 1061897806 /nfs/dbraw/zinc/89/78/06/1061897806.db2.gz SYLFNOKOVDBUES-AAEUAGOBSA-N 1 2 307.340 4.237 20 0 DIADLO Cc1scc(C[N@H+](C)CC(=O)Nc2ccccc2Cl)c1C ZINC001474319878 1061898007 /nfs/dbraw/zinc/89/80/07/1061898007.db2.gz RABSOSOVGAEVIC-UHFFFAOYSA-N 1 2 322.861 4.089 20 0 DIADLO Cc1scc(C[N@@H+](C)CC(=O)Nc2ccccc2Cl)c1C ZINC001474319878 1061898024 /nfs/dbraw/zinc/89/80/24/1061898024.db2.gz RABSOSOVGAEVIC-UHFFFAOYSA-N 1 2 322.861 4.089 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2cnn(C)c2Cl)o1 ZINC001474326437 1061912901 /nfs/dbraw/zinc/91/29/01/1061912901.db2.gz DQQOPWXIVFBRLC-IUODEOHRSA-N 1 2 321.852 4.202 20 0 DIADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2cnn(C)c2Cl)o1 ZINC001474326437 1061912920 /nfs/dbraw/zinc/91/29/20/1061912920.db2.gz DQQOPWXIVFBRLC-IUODEOHRSA-N 1 2 321.852 4.202 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CC(C)(C)[C@@H]3c3ccccc3)cn2c1 ZINC001474340975 1061942194 /nfs/dbraw/zinc/94/21/94/1061942194.db2.gz FFWSSIMHYULXKM-IBGZPJMESA-N 1 2 305.425 4.226 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CC(C)(C)[C@@H]3c3ccccc3)cn2c1 ZINC001474340975 1061942213 /nfs/dbraw/zinc/94/22/13/1061942213.db2.gz FFWSSIMHYULXKM-IBGZPJMESA-N 1 2 305.425 4.226 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+](Cc1nc(CO)cs1)C1CC1 ZINC001474363277 1061990153 /nfs/dbraw/zinc/99/01/53/1061990153.db2.gz HTCMLUCOFMDVSS-LLVKDONJSA-N 1 2 322.861 4.014 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](Cc1nc(CO)cs1)C1CC1 ZINC001474363277 1061990167 /nfs/dbraw/zinc/99/01/67/1061990167.db2.gz HTCMLUCOFMDVSS-LLVKDONJSA-N 1 2 322.861 4.014 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)c2ccc3cc[nH]c3c2)c(C)[nH+]1 ZINC001466754397 1061999069 /nfs/dbraw/zinc/99/90/69/1061999069.db2.gz CNSHTJZHBWCHHE-UHFFFAOYSA-N 1 2 308.385 4.156 20 0 DIADLO CCSc1cccc(C[N@@H+]2CCC[C@H]2C(=O)OC(C)(C)C)c1 ZINC001474368223 1062000120 /nfs/dbraw/zinc/00/01/20/1062000120.db2.gz WFKAVFZSIJPTGW-INIZCTEOSA-N 1 2 321.486 4.105 20 0 DIADLO CCSc1cccc(C[N@H+]2CCC[C@H]2C(=O)OC(C)(C)C)c1 ZINC001474368223 1062000145 /nfs/dbraw/zinc/00/01/45/1062000145.db2.gz WFKAVFZSIJPTGW-INIZCTEOSA-N 1 2 321.486 4.105 20 0 DIADLO C[C@H]1CC[N@H+](Cc2ccc(Oc3ccc(F)cc3)nc2)C[C@@H]1F ZINC001474393288 1062046532 /nfs/dbraw/zinc/04/65/32/1062046532.db2.gz NCJWDRKTGPOTBS-GUYCJALGSA-N 1 2 318.367 4.193 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)nc2)C[C@@H]1F ZINC001474393288 1062046558 /nfs/dbraw/zinc/04/65/58/1062046558.db2.gz NCJWDRKTGPOTBS-GUYCJALGSA-N 1 2 318.367 4.193 20 0 DIADLO CCCCC[C@@H](NC(=O)Nc1ccc2[nH+]ccn2c1)C(C)(C)C ZINC001467065313 1062061749 /nfs/dbraw/zinc/06/17/49/1062061749.db2.gz KOQVUNMUTVICKS-OAHLLOKOSA-N 1 2 316.449 4.451 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](Cc1cccnc1N)C1CC1 ZINC001474415283 1062084045 /nfs/dbraw/zinc/08/40/45/1062084045.db2.gz WDTBRQQHGWLQDP-LBPRGKRZSA-N 1 2 301.821 4.043 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](Cc1cccnc1N)C1CC1 ZINC001474415283 1062084060 /nfs/dbraw/zinc/08/40/60/1062084060.db2.gz WDTBRQQHGWLQDP-LBPRGKRZSA-N 1 2 301.821 4.043 20 0 DIADLO Cc1[nH]nc(C[N@@H+]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1C ZINC001474419264 1062091666 /nfs/dbraw/zinc/09/16/66/1062091666.db2.gz YWYSKTVVTMEHEA-CQSZACIVSA-N 1 2 323.362 4.035 20 0 DIADLO Cc1[nH]nc(C[N@H+]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1C ZINC001474419264 1062091689 /nfs/dbraw/zinc/09/16/89/1062091689.db2.gz YWYSKTVVTMEHEA-CQSZACIVSA-N 1 2 323.362 4.035 20 0 DIADLO Cc1cccc(OCC[N@@H+](C)Cc2nc(C(C)(C)C)cs2)c1 ZINC001459343097 1062100689 /nfs/dbraw/zinc/10/06/89/1062100689.db2.gz VMWYGFIRJITDIW-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO Cc1cccc(OCC[N@H+](C)Cc2nc(C(C)(C)C)cs2)c1 ZINC001459343097 1062100695 /nfs/dbraw/zinc/10/06/95/1062100695.db2.gz VMWYGFIRJITDIW-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO C[N@H+](Cc1ccoc1)Cc1cc(Cl)ccc1OCC1CC1 ZINC001459355476 1062108869 /nfs/dbraw/zinc/10/88/69/1062108869.db2.gz WYCCPYYFQQISNX-UHFFFAOYSA-N 1 2 305.805 4.354 20 0 DIADLO C[N@@H+](Cc1ccoc1)Cc1cc(Cl)ccc1OCC1CC1 ZINC001459355476 1062108884 /nfs/dbraw/zinc/10/88/84/1062108884.db2.gz WYCCPYYFQQISNX-UHFFFAOYSA-N 1 2 305.805 4.354 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccc(F)c(F)c1F ZINC001474437547 1062114105 /nfs/dbraw/zinc/11/41/05/1062114105.db2.gz ZYIPJUBQKBQDRK-PSASIEDQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccc(F)c(F)c1F ZINC001474437547 1062114118 /nfs/dbraw/zinc/11/41/18/1062114118.db2.gz ZYIPJUBQKBQDRK-PSASIEDQSA-N 1 2 311.269 4.267 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC001459422457 1062138099 /nfs/dbraw/zinc/13/80/99/1062138099.db2.gz ASYLJMLJEODYHC-HNNXBMFYSA-N 1 2 314.429 4.318 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC001459422457 1062138108 /nfs/dbraw/zinc/13/81/08/1062138108.db2.gz ASYLJMLJEODYHC-HNNXBMFYSA-N 1 2 314.429 4.318 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC001459422463 1062139013 /nfs/dbraw/zinc/13/90/13/1062139013.db2.gz ASYLJMLJEODYHC-OAHLLOKOSA-N 1 2 314.429 4.318 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC001459422463 1062139024 /nfs/dbraw/zinc/13/90/24/1062139024.db2.gz ASYLJMLJEODYHC-OAHLLOKOSA-N 1 2 314.429 4.318 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1ncc(Br)cc1Cl ZINC001459450186 1062149118 /nfs/dbraw/zinc/14/91/18/1062149118.db2.gz SACUVLQRZNQTEJ-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cnc(CC(C)C)s2)c1 ZINC001474481229 1062161349 /nfs/dbraw/zinc/16/13/49/1062161349.db2.gz QUGBSMXZZIFPCP-UHFFFAOYSA-N 1 2 306.450 4.421 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cnc(CC(C)C)s2)c1 ZINC001474481229 1062161362 /nfs/dbraw/zinc/16/13/62/1062161362.db2.gz QUGBSMXZZIFPCP-UHFFFAOYSA-N 1 2 306.450 4.421 20 0 DIADLO Cc1cc(CN2C[C@@H](C)Oc3c(Cl)cccc32)cc(C)[nH+]1 ZINC001474486367 1062164827 /nfs/dbraw/zinc/16/48/27/1062164827.db2.gz KSBMLOKANOJVAC-CYBMUJFWSA-N 1 2 302.805 4.139 20 0 DIADLO CCc1ccc(C[NH+]2CCN(CCCC3CCCC3)CC2)s1 ZINC001459514722 1062179332 /nfs/dbraw/zinc/17/93/32/1062179332.db2.gz KMIBMYHNKKWGBQ-UHFFFAOYSA-N 1 2 320.546 4.399 20 0 DIADLO FC(F)(C[NH2+]C[C@H]1CC1(Cl)Cl)c1ccc(Cl)cc1 ZINC001474511685 1062193311 /nfs/dbraw/zinc/19/33/11/1062193311.db2.gz NUVPNEKTKSMNKG-SECBINFHSA-N 1 2 314.590 4.215 20 0 DIADLO CCc1ccc([C@H]2COCC[N@@H+]2Cc2ccccc2C2CC2)o1 ZINC001459536825 1062193547 /nfs/dbraw/zinc/19/35/47/1062193547.db2.gz SATFEQVWBCAIPF-LJQANCHMSA-N 1 2 311.425 4.293 20 0 DIADLO CCc1ccc([C@H]2COCC[N@H+]2Cc2ccccc2C2CC2)o1 ZINC001459536825 1062193558 /nfs/dbraw/zinc/19/35/58/1062193558.db2.gz SATFEQVWBCAIPF-LJQANCHMSA-N 1 2 311.425 4.293 20 0 DIADLO C[C@H]([NH2+]Cc1cc2c(ccnc2Cl)o1)c1c(F)cncc1F ZINC001474512630 1062193918 /nfs/dbraw/zinc/19/39/18/1062193918.db2.gz QCSQANYBCVDJGO-QMMMGPOBSA-N 1 2 323.730 4.005 20 0 DIADLO Fc1cccc(-c2ccc(C[NH+]3CC(C(F)(F)F)C3)o2)c1F ZINC001474532685 1062219145 /nfs/dbraw/zinc/21/91/45/1062219145.db2.gz MLBIHVFTILEMBR-UHFFFAOYSA-N 1 2 317.257 4.219 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(Cl)cc(F)cc3C2)cc(C)c1O ZINC001474552127 1062250374 /nfs/dbraw/zinc/25/03/74/1062250374.db2.gz ATTVBWFITKQKER-UHFFFAOYSA-N 1 2 319.807 4.360 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(Cl)cc(F)cc3C2)cc(C)c1O ZINC001474552127 1062250394 /nfs/dbraw/zinc/25/03/94/1062250394.db2.gz ATTVBWFITKQKER-UHFFFAOYSA-N 1 2 319.807 4.360 20 0 DIADLO CCC1C[NH+](Cc2cc(Cl)c(C)cc2Br)C1 ZINC001474564857 1062269234 /nfs/dbraw/zinc/26/92/34/1062269234.db2.gz CGTUDVWPEPLOJE-UHFFFAOYSA-N 1 2 302.643 4.253 20 0 DIADLO CCO[C@H]1C[C@H]([N@H+](C)Cc2c(Cl)cncc2Cl)C1(C)C ZINC001459633097 1062266090 /nfs/dbraw/zinc/26/60/90/1062266090.db2.gz ZMLSLPBVLWHEQT-KBPBESRZSA-N 1 2 317.260 4.024 20 0 DIADLO CCO[C@H]1C[C@H]([N@@H+](C)Cc2c(Cl)cncc2Cl)C1(C)C ZINC001459633097 1062266107 /nfs/dbraw/zinc/26/61/07/1062266107.db2.gz ZMLSLPBVLWHEQT-KBPBESRZSA-N 1 2 317.260 4.024 20 0 DIADLO Cn1ncc(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)c1Cl ZINC001474566597 1062270851 /nfs/dbraw/zinc/27/08/51/1062270851.db2.gz NNYNMJFXWAHSHM-MRXNPFEDSA-N 1 2 315.848 4.191 20 0 DIADLO Cn1ncc(C[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)c1Cl ZINC001474566597 1062270873 /nfs/dbraw/zinc/27/08/73/1062270873.db2.gz NNYNMJFXWAHSHM-MRXNPFEDSA-N 1 2 315.848 4.191 20 0 DIADLO C[N@H+](C[C@@H]1CCCC(C)(C)C1)[C@H](c1nnc[nH]1)c1ccccc1 ZINC001474571059 1062279853 /nfs/dbraw/zinc/27/98/53/1062279853.db2.gz JOPOTAOIMGCTPT-WBVHZDCISA-N 1 2 312.461 4.042 20 0 DIADLO C[N@@H+](C[C@@H]1CCCC(C)(C)C1)[C@H](c1nnc[nH]1)c1ccccc1 ZINC001474571059 1062279872 /nfs/dbraw/zinc/27/98/72/1062279872.db2.gz JOPOTAOIMGCTPT-WBVHZDCISA-N 1 2 312.461 4.042 20 0 DIADLO C[N@H+](C[C@@H]1CCCC(C)(C)C1)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC001474570857 1062280146 /nfs/dbraw/zinc/28/01/46/1062280146.db2.gz JOPOTAOIMGCTPT-NVXWUHKLSA-N 1 2 312.461 4.042 20 0 DIADLO C[N@@H+](C[C@@H]1CCCC(C)(C)C1)[C@@H](c1nnc[nH]1)c1ccccc1 ZINC001474570857 1062280167 /nfs/dbraw/zinc/28/01/67/1062280167.db2.gz JOPOTAOIMGCTPT-NVXWUHKLSA-N 1 2 312.461 4.042 20 0 DIADLO CN(C)c1cc(CSc2ncc(Cl)cc2Cl)cc[nH+]1 ZINC001254979721 1062292843 /nfs/dbraw/zinc/29/28/43/1062292843.db2.gz GWPBXIVOAMHHAH-UHFFFAOYSA-N 1 2 314.241 4.142 20 0 DIADLO Fc1cc(C[N@@H+]2CCOC3(C2)CCCCCC3)ccc1Cl ZINC001459670778 1062292564 /nfs/dbraw/zinc/29/25/64/1062292564.db2.gz NFRJZAUMRSSXEQ-UHFFFAOYSA-N 1 2 311.828 4.404 20 0 DIADLO Fc1cc(C[N@H+]2CCOC3(C2)CCCCCC3)ccc1Cl ZINC001459670778 1062292584 /nfs/dbraw/zinc/29/25/84/1062292584.db2.gz NFRJZAUMRSSXEQ-UHFFFAOYSA-N 1 2 311.828 4.404 20 0 DIADLO O=C(C[NH2+]C(c1ccccc1)c1ccccc1)c1ccccc1F ZINC001459672180 1062292631 /nfs/dbraw/zinc/29/26/31/1062292631.db2.gz TZPPVUKVNKRJRW-UHFFFAOYSA-N 1 2 319.379 4.388 20 0 DIADLO CC(C)(C)OC(=O)C[N@H+](C/C=C\c1cccc(F)c1)C1CCC1 ZINC001474604526 1062317032 /nfs/dbraw/zinc/31/70/32/1062317032.db2.gz HBEPDDYOWPCHQZ-VURMDHGXSA-N 1 2 319.420 4.035 20 0 DIADLO CC(C)(C)OC(=O)C[N@@H+](C/C=C\c1cccc(F)c1)C1CCC1 ZINC001474604526 1062317052 /nfs/dbraw/zinc/31/70/52/1062317052.db2.gz HBEPDDYOWPCHQZ-VURMDHGXSA-N 1 2 319.420 4.035 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)N(C(=O)c3c(C)cc(C)[nH+]c3C)C2)cc1 ZINC001459700697 1062317911 /nfs/dbraw/zinc/31/79/11/1062317911.db2.gz XTJSTPNZMSQUEW-APWZRJJASA-N 1 2 322.452 4.333 20 0 DIADLO Oc1ccc2c(c1)C[N@@H+](Cc1cc3nc(Cl)ccc3s1)C2 ZINC001474636602 1062359214 /nfs/dbraw/zinc/35/92/14/1062359214.db2.gz QVMRYASWRWGZHT-UHFFFAOYSA-N 1 2 316.813 4.171 20 0 DIADLO Oc1ccc2c(c1)C[N@H+](Cc1cc3nc(Cl)ccc3s1)C2 ZINC001474636602 1062359225 /nfs/dbraw/zinc/35/92/25/1062359225.db2.gz QVMRYASWRWGZHT-UHFFFAOYSA-N 1 2 316.813 4.171 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@H+]1C[C@H](C)O[C@@](C)(C(F)F)C1 ZINC001474635755 1062360792 /nfs/dbraw/zinc/36/07/92/1062360792.db2.gz DSUAJSTZEFDUFX-APPDUMDISA-N 1 2 315.404 4.130 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@@H+]1C[C@H](C)O[C@@](C)(C(F)F)C1 ZINC001474635755 1062360812 /nfs/dbraw/zinc/36/08/12/1062360812.db2.gz DSUAJSTZEFDUFX-APPDUMDISA-N 1 2 315.404 4.130 20 0 DIADLO Cc1ccccc1CC1C[NH+](Cc2c(Cl)ccnc2Cl)C1 ZINC001474638346 1062363975 /nfs/dbraw/zinc/36/39/75/1062363975.db2.gz WNDYOOFAQQHPHF-UHFFFAOYSA-N 1 2 321.251 4.371 20 0 DIADLO Cc1cc(Cl)ccc1-c1nnc(-c2cccc3[nH+]ccn32)o1 ZINC001255278192 1062374666 /nfs/dbraw/zinc/37/46/66/1062374666.db2.gz FSTLTBXLUFRCEO-UHFFFAOYSA-N 1 2 310.744 4.013 20 0 DIADLO COc1nc(C)cc(C)c1C[N@H+](C)Cc1ccc(SC)s1 ZINC001474647215 1062377296 /nfs/dbraw/zinc/37/72/96/1062377296.db2.gz LTTAHGVTPZJJAD-UHFFFAOYSA-N 1 2 322.499 4.122 20 0 DIADLO COc1nc(C)cc(C)c1C[N@@H+](C)Cc1ccc(SC)s1 ZINC001474647215 1062377317 /nfs/dbraw/zinc/37/73/17/1062377317.db2.gz LTTAHGVTPZJJAD-UHFFFAOYSA-N 1 2 322.499 4.122 20 0 DIADLO Fc1cccc2c1CC[N@H+](Cc1cccc(C(F)(F)F)c1)C2 ZINC001459776199 1062387405 /nfs/dbraw/zinc/38/74/05/1062387405.db2.gz NOROYCZDRPJISI-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Fc1cccc2c1CC[N@@H+](Cc1cccc(C(F)(F)F)c1)C2 ZINC001459776199 1062387424 /nfs/dbraw/zinc/38/74/24/1062387424.db2.gz NOROYCZDRPJISI-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Cc1nc(C[N@@H+]2[C@H](C)Cc3cc(F)ccc3[C@@H]2C)sc1C ZINC001459772985 1062389502 /nfs/dbraw/zinc/38/95/02/1062389502.db2.gz FEHOESZYZSDWME-PWSUYJOCSA-N 1 2 304.434 4.407 20 0 DIADLO Cc1nc(C[N@H+]2[C@H](C)Cc3cc(F)ccc3[C@@H]2C)sc1C ZINC001459772985 1062389522 /nfs/dbraw/zinc/38/95/22/1062389522.db2.gz FEHOESZYZSDWME-PWSUYJOCSA-N 1 2 304.434 4.407 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC001459786950 1062399699 /nfs/dbraw/zinc/39/96/99/1062399699.db2.gz HTWGGKJNDIEZRF-OXJNMPFZSA-N 1 2 323.436 4.128 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC001459786950 1062399726 /nfs/dbraw/zinc/39/97/26/1062399726.db2.gz HTWGGKJNDIEZRF-OXJNMPFZSA-N 1 2 323.436 4.128 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+]1CCc2ccc(Cl)c(C)c2C1 ZINC001474677772 1062408598 /nfs/dbraw/zinc/40/85/98/1062408598.db2.gz WABBIOJEYKNHBA-UHFFFAOYSA-N 1 2 304.796 4.049 20 0 DIADLO Cc1nc(F)ccc1C[N@H+]1CCc2ccc(Cl)c(C)c2C1 ZINC001474677772 1062408611 /nfs/dbraw/zinc/40/86/11/1062408611.db2.gz WABBIOJEYKNHBA-UHFFFAOYSA-N 1 2 304.796 4.049 20 0 DIADLO FC(F)[C@@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1cccc(Cl)c1 ZINC001474707000 1062431313 /nfs/dbraw/zinc/43/13/13/1062431313.db2.gz ODEVXCRDQHJBEZ-KBPBESRZSA-N 1 2 315.791 4.338 20 0 DIADLO COc1ccc(SCC[N@@H+]2Cc3cccc(Cl)c3C2)cc1 ZINC001474739507 1062454341 /nfs/dbraw/zinc/45/43/41/1062454341.db2.gz XGNRZQKSDKKZHC-UHFFFAOYSA-N 1 2 319.857 4.457 20 0 DIADLO COc1ccc(SCC[N@H+]2Cc3cccc(Cl)c3C2)cc1 ZINC001474739507 1062454347 /nfs/dbraw/zinc/45/43/47/1062454347.db2.gz XGNRZQKSDKKZHC-UHFFFAOYSA-N 1 2 319.857 4.457 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NCC[C@@H](C)c1ccccc1 ZINC001474748271 1062463511 /nfs/dbraw/zinc/46/35/11/1062463511.db2.gz XYBOETJYFZYUBF-MRXNPFEDSA-N 1 2 323.440 4.288 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)sc1C(C)(C)C ZINC001459885727 1062471050 /nfs/dbraw/zinc/47/10/50/1062471050.db2.gz BUPSXTRZPBZHCB-JTQLQIEISA-N 1 2 306.397 4.133 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@H](C(F)(F)F)C2)sc1C(C)(C)C ZINC001459885727 1062471066 /nfs/dbraw/zinc/47/10/66/1062471066.db2.gz BUPSXTRZPBZHCB-JTQLQIEISA-N 1 2 306.397 4.133 20 0 DIADLO Fc1ccccc1OC1C[NH+](C2CCC(C(F)(F)F)CC2)C1 ZINC001255521094 1062471993 /nfs/dbraw/zinc/47/19/93/1062471993.db2.gz UPYRGAHUTOGGLR-UHFFFAOYSA-N 1 2 317.326 4.010 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2C2CCC(C(F)(F)F)CC2)no1 ZINC001255520629 1062472758 /nfs/dbraw/zinc/47/27/58/1062472758.db2.gz SIBUVONXKWRIOV-WXRRBKDZSA-N 1 2 317.355 4.026 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2C2CCC(C(F)(F)F)CC2)no1 ZINC001255520629 1062472768 /nfs/dbraw/zinc/47/27/68/1062472768.db2.gz SIBUVONXKWRIOV-WXRRBKDZSA-N 1 2 317.355 4.026 20 0 DIADLO Cc1cccc(C[N@@H+](C)[C@@H](C)c2cccnc2)c1Br ZINC001459901614 1062484583 /nfs/dbraw/zinc/48/45/83/1062484583.db2.gz QEKDBWGLKMEPBJ-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1cccc(C[N@H+](C)[C@@H](C)c2cccnc2)c1Br ZINC001459901614 1062484590 /nfs/dbraw/zinc/48/45/90/1062484590.db2.gz QEKDBWGLKMEPBJ-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO CC(C)C[C@H](C(=O)N(C)[C@@H]1CCC[C@@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001469154395 1062488696 /nfs/dbraw/zinc/48/86/96/1062488696.db2.gz WKXRSJBERAPENR-GVDBMIGSSA-N 1 2 319.493 4.144 20 0 DIADLO CCNc1nc(C[NH2+][C@@H](C)c2oc3ccccc3c2C)cs1 ZINC001459908926 1062488825 /nfs/dbraw/zinc/48/88/25/1062488825.db2.gz XYQBXQOSULCNFS-LBPRGKRZSA-N 1 2 315.442 4.480 20 0 DIADLO CC(C)C[C@H](C(=O)N(C)[C@H]1CCC[C@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001469154397 1062489460 /nfs/dbraw/zinc/48/94/60/1062489460.db2.gz WKXRSJBERAPENR-IXDOHACOSA-N 1 2 319.493 4.144 20 0 DIADLO CC[C@@H](C)[C@H]([NH2+][C@H](C)c1sc2ccccc2c1C)C(=O)OC ZINC001459910872 1062491732 /nfs/dbraw/zinc/49/17/32/1062491732.db2.gz ZCERNFBHOQJVHJ-KFNAQCHYSA-N 1 2 319.470 4.448 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)[C@@H](C)CC(F)(F)F ZINC001255665476 1062508409 /nfs/dbraw/zinc/50/84/09/1062508409.db2.gz YJHUZSOJBGRTOK-GXTWGEPZSA-N 1 2 301.352 4.311 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)[C@@H](C)CC(F)(F)F ZINC001255665476 1062508437 /nfs/dbraw/zinc/50/84/37/1062508437.db2.gz YJHUZSOJBGRTOK-GXTWGEPZSA-N 1 2 301.352 4.311 20 0 DIADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1ccc(Cl)c(F)c1 ZINC001459933266 1062509519 /nfs/dbraw/zinc/50/95/19/1062509519.db2.gz KDHFYLCTUUABHZ-LBPRGKRZSA-N 1 2 305.780 4.262 20 0 DIADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1ccc(Cl)c(F)c1 ZINC001459933266 1062509543 /nfs/dbraw/zinc/50/95/43/1062509543.db2.gz KDHFYLCTUUABHZ-LBPRGKRZSA-N 1 2 305.780 4.262 20 0 DIADLO CCC[N@H+](Cc1ccccc1OC(C)C)[C@H](CC)C(=O)OCC ZINC001459941449 1062511891 /nfs/dbraw/zinc/51/18/91/1062511891.db2.gz HEALNIPTBURHKV-QGZVFWFLSA-N 1 2 321.461 4.028 20 0 DIADLO CCC[N@@H+](Cc1ccccc1OC(C)C)[C@H](CC)C(=O)OCC ZINC001459941449 1062511913 /nfs/dbraw/zinc/51/19/13/1062511913.db2.gz HEALNIPTBURHKV-QGZVFWFLSA-N 1 2 321.461 4.028 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+](C)Cc1ccn(CC)c1 ZINC001459954023 1062523808 /nfs/dbraw/zinc/52/38/08/1062523808.db2.gz UICXPHSZGSXXCV-UHFFFAOYSA-N 1 2 306.837 4.192 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+](C)Cc1ccn(CC)c1 ZINC001459954023 1062523825 /nfs/dbraw/zinc/52/38/25/1062523825.db2.gz UICXPHSZGSXXCV-UHFFFAOYSA-N 1 2 306.837 4.192 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2[C@H]2CCC[C@@H](C(F)(F)F)C2)no1 ZINC001255718924 1062536267 /nfs/dbraw/zinc/53/62/67/1062536267.db2.gz XGABDPPTCHPPSB-AGIUHOORSA-N 1 2 317.355 4.026 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2[C@H]2CCC[C@@H](C(F)(F)F)C2)no1 ZINC001255718924 1062536290 /nfs/dbraw/zinc/53/62/90/1062536290.db2.gz XGABDPPTCHPPSB-AGIUHOORSA-N 1 2 317.355 4.026 20 0 DIADLO CCC[C@@H](C)CCC[N@@H+]1CCOC[C@H]1CC(=O)c1cccs1 ZINC001459971587 1062536620 /nfs/dbraw/zinc/53/66/20/1062536620.db2.gz MMYNVNRCEBDELV-HZPDHXFCSA-N 1 2 323.502 4.238 20 0 DIADLO CCC[C@@H](C)CCC[N@H+]1CCOC[C@H]1CC(=O)c1cccs1 ZINC001459971587 1062536637 /nfs/dbraw/zinc/53/66/37/1062536637.db2.gz MMYNVNRCEBDELV-HZPDHXFCSA-N 1 2 323.502 4.238 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@@H+]2[C@H]2CCC[C@H](C(F)(F)F)C2)no1 ZINC001255718925 1062537207 /nfs/dbraw/zinc/53/72/07/1062537207.db2.gz XGABDPPTCHPPSB-AVGNSLFASA-N 1 2 317.355 4.026 20 0 DIADLO Cc1nc([C@@H]2CCCC[N@H+]2[C@H]2CCC[C@H](C(F)(F)F)C2)no1 ZINC001255718925 1062537230 /nfs/dbraw/zinc/53/72/30/1062537230.db2.gz XGABDPPTCHPPSB-AVGNSLFASA-N 1 2 317.355 4.026 20 0 DIADLO Fc1ccccc1OC1C[NH+]([C@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC001255717419 1062538532 /nfs/dbraw/zinc/53/85/32/1062538532.db2.gz MEYFFMARYCCMAH-RYUDHWBXSA-N 1 2 317.326 4.010 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2cccc(Cl)c2Cl)c[nH+]1 ZINC001475905003 1062542846 /nfs/dbraw/zinc/54/28/46/1062542846.db2.gz DAEAUFVRGVWKQG-UHFFFAOYSA-N 1 2 324.211 4.327 20 0 DIADLO COC(=O)[C@H](CC(C)C)[NH2+][C@@H]1CC(C)(C)CCc2ccccc21 ZINC001460003666 1062561003 /nfs/dbraw/zinc/56/10/03/1062561003.db2.gz FWHZARDVRNBCCX-ZWKOTPCHSA-N 1 2 317.473 4.268 20 0 DIADLO CCC1(CC)[C@H](OC)C[C@@H]1[NH2+]CC(F)(F)c1ccc(F)cc1 ZINC001460063762 1062609891 /nfs/dbraw/zinc/60/98/91/1062609891.db2.gz IPGDPYMSJPCWCR-LSDHHAIUSA-N 1 2 315.379 4.101 20 0 DIADLO Cc1cc(NC(=O)N[C@@H]2CCC[C@@H](C(C)(C)C)CC2)c(C)c[nH+]1 ZINC001476303926 1062627994 /nfs/dbraw/zinc/62/79/94/1062627994.db2.gz VMYXSXANXRRCET-HZPDHXFCSA-N 1 2 317.477 4.237 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)c(Cl)s1 ZINC001460096918 1062633501 /nfs/dbraw/zinc/63/35/01/1062633501.db2.gz ZWAORZXUPXRQHL-QWRGUYRKSA-N 1 2 306.258 4.198 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c(Cl)s1 ZINC001460096918 1062633508 /nfs/dbraw/zinc/63/35/08/1062633508.db2.gz ZWAORZXUPXRQHL-QWRGUYRKSA-N 1 2 306.258 4.198 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1ccc(F)c(Cl)c1)C2 ZINC001460139605 1062657974 /nfs/dbraw/zinc/65/79/74/1062657974.db2.gz ABONKFUCQQHAPQ-UHFFFAOYSA-N 1 2 317.791 4.232 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@H+](Cc1ccc(F)c(Cl)c1)C2 ZINC001460139605 1062657987 /nfs/dbraw/zinc/65/79/87/1062657987.db2.gz ABONKFUCQQHAPQ-UHFFFAOYSA-N 1 2 317.791 4.232 20 0 DIADLO Cc1cccc(CCC[N@@H+]2CCn3c(cc4ccccc43)C2)c1 ZINC001460185010 1062684596 /nfs/dbraw/zinc/68/45/96/1062684596.db2.gz ZLCRAVOZSWZSBY-UHFFFAOYSA-N 1 2 304.437 4.398 20 0 DIADLO Cc1cccc(CCC[N@H+]2CCn3c(cc4ccccc43)C2)c1 ZINC001460185010 1062684609 /nfs/dbraw/zinc/68/46/09/1062684609.db2.gz ZLCRAVOZSWZSBY-UHFFFAOYSA-N 1 2 304.437 4.398 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(Cl)cc2Cl)[C@H]1[C@H]1CCCO1 ZINC001460192706 1062690067 /nfs/dbraw/zinc/69/00/67/1062690067.db2.gz BDAXCZFKAPFOAQ-CABCVRRESA-N 1 2 314.256 4.383 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(Cl)cc2Cl)[C@H]1[C@H]1CCCO1 ZINC001460192706 1062690072 /nfs/dbraw/zinc/69/00/72/1062690072.db2.gz BDAXCZFKAPFOAQ-CABCVRRESA-N 1 2 314.256 4.383 20 0 DIADLO CC1(C)C[N@H+](Cc2cccc(Cl)c2Cl)[C@@H]1[C@@H]1CCCO1 ZINC001460193819 1062690743 /nfs/dbraw/zinc/69/07/43/1062690743.db2.gz FCHFJOPGRGBAIJ-DZGCQCFKSA-N 1 2 314.256 4.383 20 0 DIADLO CC1(C)C[N@@H+](Cc2cccc(Cl)c2Cl)[C@@H]1[C@@H]1CCCO1 ZINC001460193819 1062690757 /nfs/dbraw/zinc/69/07/57/1062690757.db2.gz FCHFJOPGRGBAIJ-DZGCQCFKSA-N 1 2 314.256 4.383 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CCC[C@@H](C(C)C)C2)c(C)[nH+]1 ZINC001476697593 1062703981 /nfs/dbraw/zinc/70/39/81/1062703981.db2.gz BNQJFZVICJFCPW-HZPDHXFCSA-N 1 2 303.450 4.343 20 0 DIADLO C[C@@H]1CCC(C)(C)[N@@H+]1Cc1ncc(Br)cc1Cl ZINC001460233112 1062715764 /nfs/dbraw/zinc/71/57/64/1062715764.db2.gz ZPBOLQZLKZEKSY-SECBINFHSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC(C)(C)[N@H+]1Cc1ncc(Br)cc1Cl ZINC001460233112 1062715785 /nfs/dbraw/zinc/71/57/85/1062715785.db2.gz ZPBOLQZLKZEKSY-SECBINFHSA-N 1 2 317.658 4.260 20 0 DIADLO CC[C@@H]1C[N@H+](CCc2c(Cl)cccc2Cl)[C@H](C)CO1 ZINC001460338816 1062793039 /nfs/dbraw/zinc/79/30/39/1062793039.db2.gz MRVDMYQGZWXZTJ-VXGBXAGGSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)[C@H](C)CO1 ZINC001460338816 1062793060 /nfs/dbraw/zinc/79/30/60/1062793060.db2.gz MRVDMYQGZWXZTJ-VXGBXAGGSA-N 1 2 302.245 4.035 20 0 DIADLO Cc1nsc(C)c1C[N@@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC001460357424 1062803032 /nfs/dbraw/zinc/80/30/32/1062803032.db2.gz CESKEURPEZHGGM-UHFFFAOYSA-N 1 2 311.454 4.108 20 0 DIADLO Cc1nsc(C)c1C[N@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC001460357424 1062803052 /nfs/dbraw/zinc/80/30/52/1062803052.db2.gz CESKEURPEZHGGM-UHFFFAOYSA-N 1 2 311.454 4.108 20 0 DIADLO CC[C@H](C)C[N@@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC001460368721 1062820173 /nfs/dbraw/zinc/82/01/73/1062820173.db2.gz YBXQIXZCVHEVDT-NSHDSACASA-N 1 2 321.262 4.335 20 0 DIADLO CC[C@H](C)C[N@H+]1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC001460368721 1062820200 /nfs/dbraw/zinc/82/02/00/1062820200.db2.gz YBXQIXZCVHEVDT-NSHDSACASA-N 1 2 321.262 4.335 20 0 DIADLO CN(C)c1cc(CN2CCCCc3cc(Cl)ccc32)cc[nH+]1 ZINC001460443914 1062860383 /nfs/dbraw/zinc/86/03/83/1062860383.db2.gz POFCLSUGKKJMNC-UHFFFAOYSA-N 1 2 315.848 4.144 20 0 DIADLO CC(C)(C)OC(=O)[C@@]1(C)CCC[N@@H+]1Cc1ccc(Cl)cc1 ZINC001460500213 1062884122 /nfs/dbraw/zinc/88/41/22/1062884122.db2.gz JBYCUNRUVJGRAV-QGZVFWFLSA-N 1 2 309.837 4.036 20 0 DIADLO CC(C)(C)OC(=O)[C@@]1(C)CCC[N@H+]1Cc1ccc(Cl)cc1 ZINC001460500213 1062884139 /nfs/dbraw/zinc/88/41/39/1062884139.db2.gz JBYCUNRUVJGRAV-QGZVFWFLSA-N 1 2 309.837 4.036 20 0 DIADLO Cc1ccc(-c2nnc([C@@H]3Cc4ccccc4C[N@H+]3C)o2)cc1C ZINC001256567061 1062888724 /nfs/dbraw/zinc/88/87/24/1062888724.db2.gz CQMFTUKNFXLJSF-SFHVURJKSA-N 1 2 319.408 4.083 20 0 DIADLO Cc1ccc(-c2nnc([C@@H]3Cc4ccccc4C[N@@H+]3C)o2)cc1C ZINC001256567061 1062888743 /nfs/dbraw/zinc/88/87/43/1062888743.db2.gz CQMFTUKNFXLJSF-SFHVURJKSA-N 1 2 319.408 4.083 20 0 DIADLO Cc1ccc(-c2nnc(-c3ccc(-n4cc[nH+]c4)cc3)o2)cc1C ZINC001256599117 1062908754 /nfs/dbraw/zinc/90/87/54/1062908754.db2.gz OCDNMQMQPRTZCW-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO COC(=O)[C@H](c1ccccc1F)[N@H+](C)C[C@H](C)C1CCCCC1 ZINC001460598283 1062927491 /nfs/dbraw/zinc/92/74/91/1062927491.db2.gz MNHAFPNFXZLFRB-KSSFIOAISA-N 1 2 321.436 4.188 20 0 DIADLO COC(=O)[C@H](c1ccccc1F)[N@@H+](C)C[C@H](C)C1CCCCC1 ZINC001460598283 1062927516 /nfs/dbraw/zinc/92/75/16/1062927516.db2.gz MNHAFPNFXZLFRB-KSSFIOAISA-N 1 2 321.436 4.188 20 0 DIADLO Cc1cc(CNC(=O)N[C@H]2CCC[C@@H]2CCC(C)C)cc(C)[nH+]1 ZINC001477774420 1062968877 /nfs/dbraw/zinc/96/88/77/1062968877.db2.gz YVBDYGMWYKTQRM-MSOLQXFVSA-N 1 2 317.477 4.103 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@H+](CCSC(C)(C)C)C3 ZINC001460698573 1062995199 /nfs/dbraw/zinc/99/51/99/1062995199.db2.gz DFGWIFWBCSPTFY-UHFFFAOYSA-N 1 2 318.486 4.066 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@@H+](CCSC(C)(C)C)C3 ZINC001460698573 1062995222 /nfs/dbraw/zinc/99/52/22/1062995222.db2.gz DFGWIFWBCSPTFY-UHFFFAOYSA-N 1 2 318.486 4.066 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3ccc(F)c(C)c3)cc2)[nH+]c1C ZINC001471593673 1063005801 /nfs/dbraw/zinc/00/58/01/1063005801.db2.gz QRQPMEQRWMHMPY-UHFFFAOYSA-N 1 2 323.371 4.393 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001460790586 1063060099 /nfs/dbraw/zinc/06/00/99/1063060099.db2.gz RZPZHAZRXYNFEK-GFCCVEGCSA-N 1 2 309.784 4.128 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001460790586 1063060118 /nfs/dbraw/zinc/06/01/18/1063060118.db2.gz RZPZHAZRXYNFEK-GFCCVEGCSA-N 1 2 309.784 4.128 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)c2cc(C(C)C)oc2C)[nH+]c1C ZINC001471860077 1063026107 /nfs/dbraw/zinc/02/61/07/1063026107.db2.gz JIISBRMJQGXNPI-OAHLLOKOSA-N 1 2 315.417 4.029 20 0 DIADLO CCCC(=CC(=O)N1CCC(Nc2cccc[nH+]2)CC1)CCC ZINC001471918906 1063032384 /nfs/dbraw/zinc/03/23/84/1063032384.db2.gz VVMBBGHDXYCROC-UHFFFAOYSA-N 1 2 315.461 4.011 20 0 DIADLO C[C@@H]1C[C@H](C)CC[N@H+](Cc2c(F)c(F)c(F)c(F)c2F)C1 ZINC001460802160 1063065453 /nfs/dbraw/zinc/06/54/53/1063065453.db2.gz OEFRQVSSSCIAQK-RKDXNWHRSA-N 1 2 307.306 4.250 20 0 DIADLO C[C@@H]1C[C@H](C)CC[N@@H+](Cc2c(F)c(F)c(F)c(F)c2F)C1 ZINC001460802160 1063065472 /nfs/dbraw/zinc/06/54/72/1063065472.db2.gz OEFRQVSSSCIAQK-RKDXNWHRSA-N 1 2 307.306 4.250 20 0 DIADLO COc1ccc(C[N@@H+]2CCCC[C@@H]2c2cc(C)n[nH]2)cc1Cl ZINC001460837438 1063089815 /nfs/dbraw/zinc/08/98/15/1063089815.db2.gz XOUJXBCYPMFIKW-MRXNPFEDSA-N 1 2 319.836 4.107 20 0 DIADLO COc1ccc(C[N@H+]2CCCC[C@@H]2c2cc(C)n[nH]2)cc1Cl ZINC001460837438 1063089821 /nfs/dbraw/zinc/08/98/21/1063089821.db2.gz XOUJXBCYPMFIKW-MRXNPFEDSA-N 1 2 319.836 4.107 20 0 DIADLO CC1=C(C)C[C@@H](C(=O)N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001472532044 1063096108 /nfs/dbraw/zinc/09/61/08/1063096108.db2.gz AWXRZPNAMFDTIZ-AEFFLSMTSA-N 1 2 323.440 4.186 20 0 DIADLO CC1=C(C)C[C@H](C(=O)N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001472532046 1063096247 /nfs/dbraw/zinc/09/62/47/1063096247.db2.gz AWXRZPNAMFDTIZ-SJLPKXTDSA-N 1 2 323.440 4.186 20 0 DIADLO CCc1cc(N[C@@H](C)COc2c(C)cccc2C)nc(CC)[nH+]1 ZINC001472672308 1063137805 /nfs/dbraw/zinc/13/78/05/1063137805.db2.gz HXUVLBZPDRETDC-HNNXBMFYSA-N 1 2 313.445 4.098 20 0 DIADLO Cc1ccc(C[C@@H]2CCCN(c3nc(C)[nH+]c(C)c3C)C2)cc1 ZINC001472677328 1063141835 /nfs/dbraw/zinc/14/18/35/1063141835.db2.gz OUDCCNNCWHKEIR-IBGZPJMESA-N 1 2 309.457 4.169 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)ccc(C)c2F)nc1 ZINC001460933999 1063142075 /nfs/dbraw/zinc/14/20/75/1063142075.db2.gz UQILUPWTIBAIAU-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)ccc(C)c2F)nc1 ZINC001460933999 1063142091 /nfs/dbraw/zinc/14/20/91/1063142091.db2.gz UQILUPWTIBAIAU-KRWDZBQOSA-N 1 2 318.367 4.014 20 0 DIADLO Cc1cc(NCCc2cccc3ccccc32)nc(C2CC2)[nH+]1 ZINC001472689388 1063153019 /nfs/dbraw/zinc/15/30/19/1063153019.db2.gz IXZSUHRPLCIIFE-UHFFFAOYSA-N 1 2 303.409 4.470 20 0 DIADLO CCc1cc(NCCc2ccc(F)cc2Cl)nc(CC)[nH+]1 ZINC001472688855 1063153629 /nfs/dbraw/zinc/15/36/29/1063153629.db2.gz NQCLCKXJSAZPQP-UHFFFAOYSA-N 1 2 307.800 4.049 20 0 DIADLO Cc1cccc2nc(C[N@@H+]3CCc4cc(C(C)C)ccc4C3)cn21 ZINC001460972014 1063161022 /nfs/dbraw/zinc/16/10/22/1063161022.db2.gz IICLGFNWPYPDAH-UHFFFAOYSA-N 1 2 319.452 4.324 20 0 DIADLO Cc1cccc2nc(C[N@H+]3CCc4cc(C(C)C)ccc4C3)cn21 ZINC001460972014 1063161033 /nfs/dbraw/zinc/16/10/33/1063161033.db2.gz IICLGFNWPYPDAH-UHFFFAOYSA-N 1 2 319.452 4.324 20 0 DIADLO COc1cc(C)[nH+]c(CN2c3ccc(Cl)cc3C[C@@H]2C)c1 ZINC001460975864 1063167152 /nfs/dbraw/zinc/16/71/52/1063167152.db2.gz LETZLVYBACBMSG-LBPRGKRZSA-N 1 2 302.805 4.003 20 0 DIADLO COc1ccc2cc(CC[C@H](C)[NH2+][C@H]3CC3(F)F)ccc2c1 ZINC001257267918 1063171369 /nfs/dbraw/zinc/17/13/69/1063171369.db2.gz CRPWQQWCEQPAKN-SJCJKPOMSA-N 1 2 305.368 4.167 20 0 DIADLO CC(C)c1cc(N[C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)nc(C(C)C)[nH+]1 ZINC001472713151 1063171702 /nfs/dbraw/zinc/17/17/02/1063171702.db2.gz QTYWVVHOYSGEQK-XYPHTWIQSA-N 1 2 317.477 4.339 20 0 DIADLO CCCCO[C@@H]1C[C@@H](Nc2nc(C)[nH+]c3c2CCCC3)C1(C)C ZINC001472718509 1063177353 /nfs/dbraw/zinc/17/73/53/1063177353.db2.gz DBGHKBHMVWNNOX-IAGOWNOFSA-N 1 2 317.477 4.060 20 0 DIADLO CCC(CC)[N@@H+]1CCOC[C@H]1c1csc(-c2ccccc2)n1 ZINC001257296730 1063186753 /nfs/dbraw/zinc/18/67/53/1063186753.db2.gz MLAPUTYSXREVGT-KRWDZBQOSA-N 1 2 316.470 4.372 20 0 DIADLO CCC(CC)[N@H+]1CCOC[C@H]1c1csc(-c2ccccc2)n1 ZINC001257296730 1063186771 /nfs/dbraw/zinc/18/67/71/1063186771.db2.gz MLAPUTYSXREVGT-KRWDZBQOSA-N 1 2 316.470 4.372 20 0 DIADLO Cc1cc(NCCOc2ccccc2Cl)nc(C2CCC2)[nH+]1 ZINC001472738366 1063194268 /nfs/dbraw/zinc/19/42/68/1063194268.db2.gz NEQKDVBXNPUQMS-UHFFFAOYSA-N 1 2 317.820 4.197 20 0 DIADLO Cc1cc(N(C)CCc2ccc(Cl)cc2)nc(C2CCC2)[nH+]1 ZINC001472744779 1063201483 /nfs/dbraw/zinc/20/14/83/1063201483.db2.gz DOPPUGJXEJWHMN-UHFFFAOYSA-N 1 2 315.848 4.385 20 0 DIADLO CCN(Cc1c[nH]c2ccccc12)c1nc(C)[nH+]c2c1CCCC2 ZINC001472758154 1063212680 /nfs/dbraw/zinc/21/26/80/1063212680.db2.gz DSWKQPGJBBLBPI-UHFFFAOYSA-N 1 2 320.440 4.172 20 0 DIADLO CC1(C)c2nc(-c3ccc(F)cc3)cn2CC[N@@H+]1C1CCCC1 ZINC001257354211 1063225753 /nfs/dbraw/zinc/22/57/53/1063225753.db2.gz AMLSNJZVHURVQN-UHFFFAOYSA-N 1 2 313.420 4.183 20 0 DIADLO CC1(C)c2nc(-c3ccc(F)cc3)cn2CC[N@H+]1C1CCCC1 ZINC001257354211 1063225773 /nfs/dbraw/zinc/22/57/73/1063225773.db2.gz AMLSNJZVHURVQN-UHFFFAOYSA-N 1 2 313.420 4.183 20 0 DIADLO COc1ccc([C@@H]2C[C@H]2Nc2cc(C)[nH+]c(C3CCC3)n2)cc1 ZINC001472775243 1063226592 /nfs/dbraw/zinc/22/65/92/1063226592.db2.gz PPGLRUVPQDYNSS-DLBZAZTESA-N 1 2 309.413 4.029 20 0 DIADLO CCOc1cccc(F)c1C[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC001461063649 1063228233 /nfs/dbraw/zinc/22/82/33/1063228233.db2.gz JWOICYSDKBMOGJ-TZMCWYRMSA-N 1 2 303.377 4.231 20 0 DIADLO CCCCCC[C@@H](C)N1CC[NH+](CCc2cccs2)CC1 ZINC001257367489 1063235234 /nfs/dbraw/zinc/23/52/34/1063235234.db2.gz CYKOTMPYTGFDSF-QGZVFWFLSA-N 1 2 308.535 4.267 20 0 DIADLO Cc1nc(N[C@@H](C)c2ccc3c(c2)CCCO3)c2c([nH+]1)CCCC2 ZINC001472836458 1063275385 /nfs/dbraw/zinc/27/53/85/1063275385.db2.gz MWBQQRDOXKERIZ-ZDUSSCGKSA-N 1 2 323.440 4.162 20 0 DIADLO CC[C@@H](Nc1nc(C)[nH+]c2c1CCCC2)c1ccccc1OC ZINC001472860014 1063287019 /nfs/dbraw/zinc/28/70/19/1063287019.db2.gz TXMSSQGERMRFAN-MRXNPFEDSA-N 1 2 311.429 4.236 20 0 DIADLO CCC[C@H](C)CC[C@@H](C)[N@@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001257480816 1063304377 /nfs/dbraw/zinc/30/43/77/1063304377.db2.gz ZADCUGFUDAPJJU-BBWFWOEESA-N 1 2 321.509 4.401 20 0 DIADLO CCC[C@H](C)CC[C@@H](C)[N@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001257480816 1063304399 /nfs/dbraw/zinc/30/43/99/1063304399.db2.gz ZADCUGFUDAPJJU-BBWFWOEESA-N 1 2 321.509 4.401 20 0 DIADLO FC1(F)C[N@@H+]([C@H]2CCCSC2)CC[C@H]1Cc1ccccc1 ZINC001257685957 1063369335 /nfs/dbraw/zinc/36/93/35/1063369335.db2.gz XJUBEXGANBJVAC-HOTGVXAUSA-N 1 2 311.441 4.082 20 0 DIADLO FC1(F)C[N@H+]([C@H]2CCCSC2)CC[C@H]1Cc1ccccc1 ZINC001257685957 1063369346 /nfs/dbraw/zinc/36/93/46/1063369346.db2.gz XJUBEXGANBJVAC-HOTGVXAUSA-N 1 2 311.441 4.082 20 0 DIADLO CC(C)[C@H]1CC[C@@H](C)C[C@H]1OC(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC001473070106 1063384785 /nfs/dbraw/zinc/38/47/85/1063384785.db2.gz QBCVECHFDCJBHP-BZUAXINKSA-N 1 2 320.477 4.185 20 0 DIADLO CC(C)(C)c1cn(Cc2cc(F)ccc2Br)c[nH+]1 ZINC001473070084 1063386495 /nfs/dbraw/zinc/38/64/95/1063386495.db2.gz ORYROMQZCXGUBA-UHFFFAOYSA-N 1 2 311.198 4.131 20 0 DIADLO COc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2Cl)c(F)c1 ZINC001461282624 1063388550 /nfs/dbraw/zinc/38/85/50/1063388550.db2.gz DMSUZSNHZAQAHN-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO COc1ccccc1Cc1cn(CC[C@@H]2CCCC2(F)F)c[nH+]1 ZINC001473101260 1063401026 /nfs/dbraw/zinc/40/10/26/1063401026.db2.gz QIEKICKSBQKRGZ-HNNXBMFYSA-N 1 2 320.383 4.308 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(OC(C)C)c(Cl)c1 ZINC001473105762 1063404487 /nfs/dbraw/zinc/40/44/87/1063404487.db2.gz NVPNXQRWDJWOGJ-UKRRQHHQSA-N 1 2 311.853 4.127 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ccc(OC(C)C)c(Cl)c1 ZINC001473105762 1063404497 /nfs/dbraw/zinc/40/44/97/1063404497.db2.gz NVPNXQRWDJWOGJ-UKRRQHHQSA-N 1 2 311.853 4.127 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1noc2c1CC(C)(C)CC2 ZINC001473107971 1063404695 /nfs/dbraw/zinc/40/46/95/1063404695.db2.gz FBUJVQSLTGXHRQ-GFCCVEGCSA-N 1 2 304.459 4.444 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1noc2c1CC(C)(C)CC2 ZINC001473107971 1063404703 /nfs/dbraw/zinc/40/47/03/1063404703.db2.gz FBUJVQSLTGXHRQ-GFCCVEGCSA-N 1 2 304.459 4.444 20 0 DIADLO CC(C)[N@H+](Cc1nc(CC2CC2)no1)Cc1cccc(Cl)c1 ZINC001473107642 1063406992 /nfs/dbraw/zinc/40/69/92/1063406992.db2.gz BIULOGWIFHPHBB-UHFFFAOYSA-N 1 2 319.836 4.086 20 0 DIADLO CC(C)[N@@H+](Cc1nc(CC2CC2)no1)Cc1cccc(Cl)c1 ZINC001473107642 1063406995 /nfs/dbraw/zinc/40/69/95/1063406995.db2.gz BIULOGWIFHPHBB-UHFFFAOYSA-N 1 2 319.836 4.086 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1CCc1c(Cl)cccc1Cl ZINC001473106412 1063407054 /nfs/dbraw/zinc/40/70/54/1063407054.db2.gz VEZDPTFBCQTPTQ-NWDGAFQWSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1CCc1c(Cl)cccc1Cl ZINC001473106412 1063407067 /nfs/dbraw/zinc/40/70/67/1063407067.db2.gz VEZDPTFBCQTPTQ-NWDGAFQWSA-N 1 2 302.245 4.035 20 0 DIADLO Fc1ccc(/C=C/CNc2ccc(-n3cc[nH+]c3)c(F)c2)cc1 ZINC001461320317 1063417249 /nfs/dbraw/zinc/41/72/49/1063417249.db2.gz ICQBPXKWNXIHPZ-OWOJBTEDSA-N 1 2 311.335 4.276 20 0 DIADLO CN(C)c1ccc(NCc2ccccc2OC2CCCC2)c[nH+]1 ZINC001461330008 1063422417 /nfs/dbraw/zinc/42/24/17/1063422417.db2.gz FXGSIGARXIPGPR-UHFFFAOYSA-N 1 2 311.429 4.081 20 0 DIADLO COc1ccccc1/C=C\CNc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001461333421 1063424022 /nfs/dbraw/zinc/42/40/22/1063424022.db2.gz VROPQAZRKFTZCH-ALCCZGGFSA-N 1 2 319.408 4.315 20 0 DIADLO COc1ccccc1/C=C/CNc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001461333423 1063425091 /nfs/dbraw/zinc/42/50/91/1063425091.db2.gz VROPQAZRKFTZCH-FNORWQNLSA-N 1 2 319.408 4.315 20 0 DIADLO CC(C)C[N@H+](Cc1nc(C(C)C)ns1)Cc1ccccc1 ZINC001473130567 1063437035 /nfs/dbraw/zinc/43/70/35/1063437035.db2.gz VRZDKOMDUMZNAK-UHFFFAOYSA-N 1 2 303.475 4.320 20 0 DIADLO CC(C)C[N@@H+](Cc1nc(C(C)C)ns1)Cc1ccccc1 ZINC001473130567 1063437045 /nfs/dbraw/zinc/43/70/45/1063437045.db2.gz VRZDKOMDUMZNAK-UHFFFAOYSA-N 1 2 303.475 4.320 20 0 DIADLO CCC[N@H+](CCc1cccc(OC(F)(F)F)c1)CC(F)F ZINC001473136284 1063443938 /nfs/dbraw/zinc/44/39/38/1063443938.db2.gz VCBOLOUUFKDPTF-UHFFFAOYSA-N 1 2 311.294 4.105 20 0 DIADLO CCC[N@@H+](CCc1cccc(OC(F)(F)F)c1)CC(F)F ZINC001473136284 1063443944 /nfs/dbraw/zinc/44/39/44/1063443944.db2.gz VCBOLOUUFKDPTF-UHFFFAOYSA-N 1 2 311.294 4.105 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@H+](C)CCC1CCCCC1 ZINC001473137147 1063444698 /nfs/dbraw/zinc/44/46/98/1063444698.db2.gz LNGOYQVYZPXGRK-KRWDZBQOSA-N 1 2 323.864 4.456 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@@H+](C)CCC1CCCCC1 ZINC001473137147 1063444702 /nfs/dbraw/zinc/44/47/02/1063444702.db2.gz LNGOYQVYZPXGRK-KRWDZBQOSA-N 1 2 323.864 4.456 20 0 DIADLO CCOc1c(Cl)cc(CNc2ccc(C)[nH+]c2C)cc1OC ZINC001461366053 1063447074 /nfs/dbraw/zinc/44/70/74/1063447074.db2.gz CDQGKRRAFHISRZ-UHFFFAOYSA-N 1 2 320.820 4.371 20 0 DIADLO CCN(CC)c1ccc(NCc2cccc3ncccc23)c[nH+]1 ZINC001461366043 1063447223 /nfs/dbraw/zinc/44/72/23/1063447223.db2.gz BRXCFOFXHXYFBI-UHFFFAOYSA-N 1 2 306.413 4.088 20 0 DIADLO c1cn(-c2csc(CNc3cncc4ccccc43)c2)c[nH+]1 ZINC001461406637 1063480040 /nfs/dbraw/zinc/48/00/40/1063480040.db2.gz XFMITNCKYCMHNI-UHFFFAOYSA-N 1 2 306.394 4.094 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NCc1ccc(OC(F)F)cc1 ZINC001461409998 1063482464 /nfs/dbraw/zinc/48/24/64/1063482464.db2.gz RIMGGBUUNYLDEZ-UHFFFAOYSA-N 1 2 322.355 4.472 20 0 DIADLO CCCCn1ncc(NCc2cc(C)[nH+]c(C)c2)c1C(C)C ZINC001461470901 1063526914 /nfs/dbraw/zinc/52/69/14/1063526914.db2.gz DYRZCHVYNAANKV-UHFFFAOYSA-N 1 2 300.450 4.431 20 0 DIADLO C[C@@H](CC(C)(C)SCc1ccco1)[N@@H+]1CCC(F)(F)C1 ZINC001258306900 1063602827 /nfs/dbraw/zinc/60/28/27/1063602827.db2.gz VWUQPTCXRRCLGY-LBPRGKRZSA-N 1 2 303.418 4.411 20 0 DIADLO C[C@@H](CC(C)(C)SCc1ccco1)[N@H+]1CCC(F)(F)C1 ZINC001258306900 1063602837 /nfs/dbraw/zinc/60/28/37/1063602837.db2.gz VWUQPTCXRRCLGY-LBPRGKRZSA-N 1 2 303.418 4.411 20 0 DIADLO COc1ccc(CC[C@@H](C)[N@@H+]2CCC[C@@H](F)C(F)(F)C2)cc1 ZINC001258398252 1063638142 /nfs/dbraw/zinc/63/81/42/1063638142.db2.gz QYCJFWUPVNFHTO-CZUORRHYSA-N 1 2 315.379 4.086 20 0 DIADLO COc1ccc(CC[C@@H](C)[N@H+]2CCC[C@@H](F)C(F)(F)C2)cc1 ZINC001258398252 1063638149 /nfs/dbraw/zinc/63/81/49/1063638149.db2.gz QYCJFWUPVNFHTO-CZUORRHYSA-N 1 2 315.379 4.086 20 0 DIADLO COc1ccc(CC[C@H](C)[N@@H+]2CCC[C@H](F)C(F)(F)C2)cc1 ZINC001258398250 1063638437 /nfs/dbraw/zinc/63/84/37/1063638437.db2.gz QYCJFWUPVNFHTO-BBRMVZONSA-N 1 2 315.379 4.086 20 0 DIADLO COc1ccc(CC[C@H](C)[N@H+]2CCC[C@H](F)C(F)(F)C2)cc1 ZINC001258398250 1063638445 /nfs/dbraw/zinc/63/84/45/1063638445.db2.gz QYCJFWUPVNFHTO-BBRMVZONSA-N 1 2 315.379 4.086 20 0 DIADLO COc1ccc(C[NH2+]C2(c3c(F)cccc3F)CCC2)c(F)c1 ZINC001461667085 1063647144 /nfs/dbraw/zinc/64/71/44/1063647144.db2.gz JJIUXEOKLUUSBQ-UHFFFAOYSA-N 1 2 321.342 4.282 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(-c2ccccc2)s1)c1ccns1 ZINC001461677748 1063652762 /nfs/dbraw/zinc/65/27/62/1063652762.db2.gz VSSDJMWMOFWNEQ-LLVKDONJSA-N 1 2 301.440 4.117 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(-c2ccccc2)s1)c1ccns1 ZINC001461677755 1063652996 /nfs/dbraw/zinc/65/29/96/1063652996.db2.gz VSSDJMWMOFWNEQ-NSHDSACASA-N 1 2 301.440 4.117 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NCc1ccc(C(C)C)cc1 ZINC001461726918 1063679572 /nfs/dbraw/zinc/67/95/72/1063679572.db2.gz BFDBUNHWFIBHGN-UHFFFAOYSA-N 1 2 323.440 4.418 20 0 DIADLO CC1(C)CC[C@H]([N@@H+]2CCCC[C@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258604391 1063704329 /nfs/dbraw/zinc/70/43/29/1063704329.db2.gz CAZWQAFJCYOBQY-QWRGUYRKSA-N 1 2 317.355 4.194 20 0 DIADLO CC1(C)CC[C@H]([N@H+]2CCCC[C@H]2c2noc(C(F)(F)F)n2)C1 ZINC001258604391 1063704337 /nfs/dbraw/zinc/70/43/37/1063704337.db2.gz CAZWQAFJCYOBQY-QWRGUYRKSA-N 1 2 317.355 4.194 20 0 DIADLO CC1(c2ccccc2C(=O)Nc2cccc(-n3cc[nH+]c3)c2)CC1 ZINC001515865205 1063704218 /nfs/dbraw/zinc/70/42/18/1063704218.db2.gz JPRLXIIKONFPOK-UHFFFAOYSA-N 1 2 317.392 4.176 20 0 DIADLO CCCCC[C@H](CCC)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258670534 1063738463 /nfs/dbraw/zinc/73/84/63/1063738463.db2.gz CJTJINSKNHKNNW-ZDUSSCGKSA-N 1 2 317.399 4.467 20 0 DIADLO CCCCC[C@H](CCC)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258670534 1063738472 /nfs/dbraw/zinc/73/84/72/1063738472.db2.gz CJTJINSKNHKNNW-ZDUSSCGKSA-N 1 2 317.399 4.467 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@@H]1C[C@H](C)CC(C)(C)C1)[C@@H]2C ZINC001258698609 1063758011 /nfs/dbraw/zinc/75/80/11/1063758011.db2.gz XGICDHKZCGTGTO-ARFHVFGLSA-N 1 2 319.493 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@@H]1C[C@H](C)CC(C)(C)C1)[C@@H]2C ZINC001258698609 1063758023 /nfs/dbraw/zinc/75/80/23/1063758023.db2.gz XGICDHKZCGTGTO-ARFHVFGLSA-N 1 2 319.493 4.011 20 0 DIADLO CCCC[N@H+](Cc1ccnn1CC)Cc1ccccc1Cl ZINC001461907802 1063792323 /nfs/dbraw/zinc/79/23/23/1063792323.db2.gz HJWJDQYLLXLWLM-UHFFFAOYSA-N 1 2 305.853 4.359 20 0 DIADLO CCCC[N@@H+](Cc1ccnn1CC)Cc1ccccc1Cl ZINC001461907802 1063792334 /nfs/dbraw/zinc/79/23/34/1063792334.db2.gz HJWJDQYLLXLWLM-UHFFFAOYSA-N 1 2 305.853 4.359 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)c(F)c1 ZINC001461922387 1063806484 /nfs/dbraw/zinc/80/64/84/1063806484.db2.gz XXYURXAWFSJUTK-SUMWQHHRSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)c(F)c1 ZINC001461922387 1063806492 /nfs/dbraw/zinc/80/64/92/1063806492.db2.gz XXYURXAWFSJUTK-SUMWQHHRSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(-c2nnc(-c3ccccc3-n3cc[nH+]c3)o2)cc1F ZINC001258785339 1063824335 /nfs/dbraw/zinc/82/43/35/1063824335.db2.gz MFYLMVJXJXMYIO-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO Nc1ncccc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC001461945364 1063830464 /nfs/dbraw/zinc/83/04/64/1063830464.db2.gz OTFBCWWZZRIJDQ-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ncccc1C[N@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC001461945364 1063830480 /nfs/dbraw/zinc/83/04/80/1063830480.db2.gz OTFBCWWZZRIJDQ-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO CC[C@H](C)C[C@H](CC)[N@@H+]1Cc2cc(Br)cnc2C1 ZINC001258798443 1063834354 /nfs/dbraw/zinc/83/43/54/1063834354.db2.gz UBSQEKSRHRSBEO-FZMZJTMJSA-N 1 2 311.267 4.375 20 0 DIADLO CC[C@H](C)C[C@H](CC)[N@H+]1Cc2cc(Br)cnc2C1 ZINC001258798443 1063834367 /nfs/dbraw/zinc/83/43/67/1063834367.db2.gz UBSQEKSRHRSBEO-FZMZJTMJSA-N 1 2 311.267 4.375 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@@H+]1CCC[C@H]1C(=O)OC(C)(C)C ZINC001461949553 1063833872 /nfs/dbraw/zinc/83/38/72/1063833872.db2.gz MYAPGDSNRTYHBL-HNNXBMFYSA-N 1 2 321.461 4.192 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@H+]1CCC[C@H]1C(=O)OC(C)(C)C ZINC001461949553 1063833884 /nfs/dbraw/zinc/83/38/84/1063833884.db2.gz MYAPGDSNRTYHBL-HNNXBMFYSA-N 1 2 321.461 4.192 20 0 DIADLO CCOCc1cnc2n1CC[N@H+](C(CC(C)C)CC(C)C)[C@H]2C ZINC001258834785 1063855613 /nfs/dbraw/zinc/85/56/13/1063855613.db2.gz NPSJLWHEICVQGW-INIZCTEOSA-N 1 2 321.509 4.257 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+](C(CC(C)C)CC(C)C)[C@H]2C ZINC001258834785 1063855621 /nfs/dbraw/zinc/85/56/21/1063855621.db2.gz NPSJLWHEICVQGW-INIZCTEOSA-N 1 2 321.509 4.257 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2nn(C)cc2Cl)cc1 ZINC001461987209 1063858384 /nfs/dbraw/zinc/85/83/84/1063858384.db2.gz IRJPDZAVMXQGHF-KRWDZBQOSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2nn(C)cc2Cl)cc1 ZINC001461987209 1063858399 /nfs/dbraw/zinc/85/83/99/1063858399.db2.gz IRJPDZAVMXQGHF-KRWDZBQOSA-N 1 2 303.837 4.109 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1N ZINC001462030397 1063889304 /nfs/dbraw/zinc/88/93/04/1063889304.db2.gz BLBOBNFMJMOQPC-OAHLLOKOSA-N 1 2 324.255 4.251 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1N ZINC001462030397 1063889312 /nfs/dbraw/zinc/88/93/12/1063889312.db2.gz BLBOBNFMJMOQPC-OAHLLOKOSA-N 1 2 324.255 4.251 20 0 DIADLO Cc1n[nH]c(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)c1C ZINC001462045314 1063900377 /nfs/dbraw/zinc/90/03/77/1063900377.db2.gz PTPUDXAPHRAEAJ-ZDUSSCGKSA-N 1 2 303.837 4.406 20 0 DIADLO Cc1n[nH]c(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)c1C ZINC001462045314 1063900389 /nfs/dbraw/zinc/90/03/89/1063900389.db2.gz PTPUDXAPHRAEAJ-ZDUSSCGKSA-N 1 2 303.837 4.406 20 0 DIADLO Cc1nc([C@H](C)Nc2[nH+]ccc3cc(C(F)(F)F)ccc32)no1 ZINC001261261539 1063915555 /nfs/dbraw/zinc/91/55/55/1063915555.db2.gz ZHOHRUDUJIJRTR-QMMMGPOBSA-N 1 2 322.290 4.118 20 0 DIADLO C[C@H](c1nc(C2CCC(c3ccccc3)CC2)no1)n1cc[nH+]c1 ZINC001261276373 1063918156 /nfs/dbraw/zinc/91/81/56/1063918156.db2.gz GMZWNBXUWQJEFY-ODIFPOPNSA-N 1 2 322.412 4.317 20 0 DIADLO COc1ccc([C@@H](C)[C@H](C)Nc2[nH+]cccc2OC(C)C)cc1 ZINC001462107550 1063932362 /nfs/dbraw/zinc/93/23/62/1063932362.db2.gz WCAUZCNMQXXOCI-GJZGRUSLSA-N 1 2 314.429 4.482 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2cc(Cl)cc3ccccc32)o1 ZINC001262258848 1063962280 /nfs/dbraw/zinc/96/22/80/1063962280.db2.gz UNWKCZNQHHHTRL-SNVBAGLBSA-N 1 2 301.777 4.035 20 0 DIADLO Cc1cc(Br)c(C[NH2+]Cc2ccco2)cc1Cl ZINC000379752899 1063986763 /nfs/dbraw/zinc/98/67/63/1063986763.db2.gz BFSKPGLHXLPMJW-UHFFFAOYSA-N 1 2 314.610 4.294 20 0 DIADLO COc1ccc2[nH]c(Cc3ccccc3C(F)(F)F)[nH+]c2c1 ZINC000587106657 1063994023 /nfs/dbraw/zinc/99/40/23/1063994023.db2.gz KHRLFCDNWKKWJP-UHFFFAOYSA-N 1 2 306.287 4.181 20 0 DIADLO CC(C)[N@H+](Cc1ccccc1)Cc1ncccc1Br ZINC000381899155 1063995591 /nfs/dbraw/zinc/99/55/91/1063995591.db2.gz VMDFHILJNDSARV-UHFFFAOYSA-N 1 2 319.246 4.255 20 0 DIADLO CC(C)[N@@H+](Cc1ccccc1)Cc1ncccc1Br ZINC000381899155 1063995593 /nfs/dbraw/zinc/99/55/93/1063995593.db2.gz VMDFHILJNDSARV-UHFFFAOYSA-N 1 2 319.246 4.255 20 0 DIADLO Cc1[nH+]cc(CNc2ccc3c(c2)CCCO3)n1-c1ccccc1 ZINC000383682511 1064002433 /nfs/dbraw/zinc/00/24/33/1064002433.db2.gz ZRIXWQPNTGQTKS-UHFFFAOYSA-N 1 2 319.408 4.118 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1c(F)ccc(N)c1F ZINC000386986805 1064062987 /nfs/dbraw/zinc/06/29/87/1064062987.db2.gz UFNACPOACJPMKQ-JTQLQIEISA-N 1 2 310.775 4.393 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1c(F)ccc(N)c1F ZINC000386986805 1064062992 /nfs/dbraw/zinc/06/29/92/1064062992.db2.gz UFNACPOACJPMKQ-JTQLQIEISA-N 1 2 310.775 4.393 20 0 DIADLO CCC[C@@H](CC(C)C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001264722018 1064124040 /nfs/dbraw/zinc/12/40/40/1064124040.db2.gz ZOINHJNMYTZYHZ-AWEZNQCLSA-N 1 2 317.408 4.412 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(C(F)F)c(F)c2)c(C)[nH+]1 ZINC001264804389 1064138304 /nfs/dbraw/zinc/13/83/04/1064138304.db2.gz DDXAHZGHXCKHSX-UHFFFAOYSA-N 1 2 308.303 4.336 20 0 DIADLO CC(C)C[C@@H]1C[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001264831063 1064145096 /nfs/dbraw/zinc/14/50/96/1064145096.db2.gz INCHLIAAJSAGEV-TZMCWYRMSA-N 1 2 317.820 4.146 20 0 DIADLO C[C@]([NH3+])(c1nc(-c2cccc3ccccc32)no1)c1ccccc1 ZINC000392102533 1064218002 /nfs/dbraw/zinc/21/80/02/1064218002.db2.gz MMMJEAHFEMBNID-HXUWFJFHSA-N 1 2 315.376 4.112 20 0 DIADLO Cc1cc(C)c(C(=O)NCC2CCC(C(C)C)CC2)c(C)[nH+]1 ZINC001265980199 1064303176 /nfs/dbraw/zinc/30/31/76/1064303176.db2.gz CENDAOMEEZRIDH-UHFFFAOYSA-N 1 2 302.462 4.199 20 0 DIADLO CC1(C)CCCC[C@H]1CC(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC001290763829 1064711029 /nfs/dbraw/zinc/71/10/29/1064711029.db2.gz QOJUDYBYYPHKRD-HNNXBMFYSA-N 1 2 311.429 4.417 20 0 DIADLO Fc1ccc(F)c(Sc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001306920835 1064718571 /nfs/dbraw/zinc/71/85/71/1064718571.db2.gz PYAGXXRWVAYSNS-UHFFFAOYSA-N 1 2 313.332 4.312 20 0 DIADLO CCc1cc(N2CCCC[C@@H]2c2ccc(F)cc2F)nc(C)[nH+]1 ZINC001306998821 1064735502 /nfs/dbraw/zinc/73/55/02/1064735502.db2.gz FOBATUVSHNUIMQ-QGZVFWFLSA-N 1 2 317.383 4.357 20 0 DIADLO Cc1cccc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)c1C ZINC001292862168 1064791118 /nfs/dbraw/zinc/79/11/18/1064791118.db2.gz ISJNMRIXXAGVHB-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO Cc1nc(N2CC[C@@H](C)[C@H]2c2ccccc2)c2c([nH+]1)CCCC2 ZINC001307208050 1064937305 /nfs/dbraw/zinc/93/73/05/1064937305.db2.gz SVGFQIPKTXYBAE-KUHUBIRLSA-N 1 2 307.441 4.251 20 0 DIADLO CCCCN(C(=O)c1cc2c[nH+]ccc2[nH]1)[C@H]1CCC[C@H](C)C1 ZINC001298620110 1065012623 /nfs/dbraw/zinc/01/26/23/1065012623.db2.gz VPRPNAFAONFROA-HOCLYGCPSA-N 1 2 313.445 4.384 20 0 DIADLO CC(C)C[C@@H](C(=O)N[C@H]1CCCCC12CCCC2)n1cc[nH+]c1 ZINC001298651863 1065014761 /nfs/dbraw/zinc/01/47/61/1065014761.db2.gz NLAOBTRTQLGBIK-IRXDYDNUSA-N 1 2 317.477 4.090 20 0 DIADLO CC(C)C[C@@H](C(=O)N1CC[C@]1(C)C1CCCCC1)n1cc[nH+]c1 ZINC001302914476 1065102073 /nfs/dbraw/zinc/10/20/73/1065102073.db2.gz DYBVBCGPEGHEQF-PKOBYXMFSA-N 1 2 317.477 4.042 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)/C=C\c3cccs3)cc2)[nH+]c1C ZINC001303122836 1065108102 /nfs/dbraw/zinc/10/81/02/1065108102.db2.gz QQTLTHBMENSKIK-KTKRTIGZSA-N 1 2 323.421 4.407 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C[C@H]3CCC[C@H]3C)cc2)[nH+]c1C ZINC001303121484 1065108516 /nfs/dbraw/zinc/10/85/16/1065108516.db2.gz ADXZPVRPUVRFET-MLGOLLRUSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)c2ccc3ccccc3c2)[nH+]c1C ZINC001303604690 1065119296 /nfs/dbraw/zinc/11/92/96/1065119296.db2.gz BZCSLEYLGRFLPD-SFHVURJKSA-N 1 2 319.408 4.157 20 0 DIADLO C/C(=C/c1ccc(C)cc1)C(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001303608610 1065119403 /nfs/dbraw/zinc/11/94/03/1065119403.db2.gz JGTOEPFJAVGUKK-RXXLQFRUSA-N 1 2 323.440 4.102 20 0 DIADLO Cc1cc(NCCc2cccc(Cl)c2)nc(C2CCC2)[nH+]1 ZINC001306914349 1065202604 /nfs/dbraw/zinc/20/26/04/1065202604.db2.gz UGQOKJPKTCWGDV-UHFFFAOYSA-N 1 2 301.821 4.361 20 0 DIADLO CCc1cc(NCc2ccccc2C(F)(F)F)nc(CC)[nH+]1 ZINC001306947702 1065216370 /nfs/dbraw/zinc/21/63/70/1065216370.db2.gz AEBHLIQCNYOOSG-UHFFFAOYSA-N 1 2 309.335 4.232 20 0 DIADLO Fc1ccc2nc(NCCCCNc3cccc[nH+]3)sc2c1 ZINC001306952372 1065218847 /nfs/dbraw/zinc/21/88/47/1065218847.db2.gz HMXADCXFBSXHPU-UHFFFAOYSA-N 1 2 316.405 4.135 20 0 DIADLO CCc1cc(NCC(C)(C)c2cccc(F)c2)nc(CC)[nH+]1 ZINC001306966200 1065224606 /nfs/dbraw/zinc/22/46/06/1065224606.db2.gz DRODNEBLIVOMEA-UHFFFAOYSA-N 1 2 301.409 4.130 20 0 DIADLO CC(C)c1cc(NCC2(O)CCCCCC2)nc(C(C)C)[nH+]1 ZINC001306972809 1065229908 /nfs/dbraw/zinc/22/99/08/1065229908.db2.gz LSBIGKPTCALTMJ-UHFFFAOYSA-N 1 2 305.466 4.221 20 0 DIADLO CCc1cc(N2CC[C@@](C)(CCc3ccccc3)C2)nc(CC)[nH+]1 ZINC001306989485 1065237830 /nfs/dbraw/zinc/23/78/30/1065237830.db2.gz MALUGMYUYAPDCL-OAQYLSRUSA-N 1 2 323.484 4.451 20 0 DIADLO Cc1nc(N[C@@H](C)c2ccc(F)cc2F)c2c([nH+]1)CCCC2 ZINC001306989522 1065238151 /nfs/dbraw/zinc/23/81/51/1065238151.db2.gz LBDACCRNSKXAGN-JTQLQIEISA-N 1 2 303.356 4.115 20 0 DIADLO CCO[C@H]1C[C@@H](N(C)c2cc(CC)[nH+]c(CC)n2)C1(CC)CC ZINC001306990048 1065238358 /nfs/dbraw/zinc/23/83/58/1065238358.db2.gz NGLVXBLLRSHENM-CVEARBPZSA-N 1 2 319.493 4.021 20 0 DIADLO CCc1cc(N(Cc2ccco2)Cc2ccccc2)nc(CC)[nH+]1 ZINC001306989392 1065238613 /nfs/dbraw/zinc/23/86/13/1065238613.db2.gz KHECCAHGXXNDQY-UHFFFAOYSA-N 1 2 321.424 4.401 20 0 DIADLO Cc1nc(N(C)[C@@H]2CCC[C@@H]2c2ccccc2)c2c([nH+]1)CCCC2 ZINC001307139909 1065281336 /nfs/dbraw/zinc/28/13/36/1065281336.db2.gz PTSKTFUZHWGPHX-YLJYHZDGSA-N 1 2 321.468 4.436 20 0 DIADLO CO[C@@](C)([C@H](C)Nc1cc(C(C)C)[nH+]c(C(C)C)n1)C1CC1 ZINC001307143036 1065282643 /nfs/dbraw/zinc/28/26/43/1065282643.db2.gz WJWFIYBXEZXSHP-UGSOOPFHSA-N 1 2 305.466 4.339 20 0 DIADLO CO[C@](C)([C@H](C)Nc1cc(C(C)C)[nH+]c(C(C)C)n1)C1CC1 ZINC001307143035 1065283204 /nfs/dbraw/zinc/28/32/04/1065283204.db2.gz WJWFIYBXEZXSHP-SCLBCKFNSA-N 1 2 305.466 4.339 20 0 DIADLO COc1nscc1C[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC001307421687 1065384391 /nfs/dbraw/zinc/38/43/91/1065384391.db2.gz WAQUOUVPBOOFPY-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1nscc1C[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC001307421687 1065384403 /nfs/dbraw/zinc/38/44/03/1065384403.db2.gz WAQUOUVPBOOFPY-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccccc1C[N@H+](Cc1ccc(F)cc1F)C1CC1 ZINC001307421496 1065384693 /nfs/dbraw/zinc/38/46/93/1065384693.db2.gz HGCLSAQVGKNQFZ-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1ccc(F)cc1F)C1CC1 ZINC001307421496 1065384701 /nfs/dbraw/zinc/38/47/01/1065384701.db2.gz HGCLSAQVGKNQFZ-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO CCC1(C)CC[NH+](Cc2nc(C)c(Br)s2)CC1 ZINC001307442638 1065401463 /nfs/dbraw/zinc/40/14/63/1065401463.db2.gz MVHRNOINRGAGFG-UHFFFAOYSA-N 1 2 317.296 4.226 20 0 DIADLO CC(C)[C@H]1CCC[N@H+](Cc2noc(C3CCCCC3)n2)CC1 ZINC001307476507 1065423350 /nfs/dbraw/zinc/42/33/50/1065423350.db2.gz ATYXUMJADSDQFP-HNNXBMFYSA-N 1 2 305.466 4.375 20 0 DIADLO CC(C)[C@H]1CCC[N@@H+](Cc2noc(C3CCCCC3)n2)CC1 ZINC001307476507 1065423353 /nfs/dbraw/zinc/42/33/53/1065423353.db2.gz ATYXUMJADSDQFP-HNNXBMFYSA-N 1 2 305.466 4.375 20 0 DIADLO Cc1nc(C[N@H+]2CCCC[C@@H]2C(C)C)sc1Br ZINC001307474804 1065423392 /nfs/dbraw/zinc/42/33/92/1065423392.db2.gz ZAWDARIHZNTAKR-LLVKDONJSA-N 1 2 317.296 4.225 20 0 DIADLO Cc1nc(C[N@@H+]2CCCC[C@@H]2C(C)C)sc1Br ZINC001307474804 1065423396 /nfs/dbraw/zinc/42/33/96/1065423396.db2.gz ZAWDARIHZNTAKR-LLVKDONJSA-N 1 2 317.296 4.225 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2CC(=O)c2ccccc2F)o1 ZINC001307498580 1065441584 /nfs/dbraw/zinc/44/15/84/1065441584.db2.gz YRSDYYJCGZWLCK-CXAGYDPISA-N 1 2 315.388 4.383 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2CC(=O)c2ccccc2F)o1 ZINC001307498580 1065441590 /nfs/dbraw/zinc/44/15/90/1065441590.db2.gz YRSDYYJCGZWLCK-CXAGYDPISA-N 1 2 315.388 4.383 20 0 DIADLO Fc1cccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1OC(F)F ZINC001307515298 1065454910 /nfs/dbraw/zinc/45/49/10/1065454910.db2.gz ZRINQTXQOXLIDO-OAHLLOKOSA-N 1 2 307.315 4.374 20 0 DIADLO Fc1cccc(C[N@H+]2CC[C@@H]2c2ccccc2)c1OC(F)F ZINC001307515298 1065454913 /nfs/dbraw/zinc/45/49/13/1065454913.db2.gz ZRINQTXQOXLIDO-OAHLLOKOSA-N 1 2 307.315 4.374 20 0 DIADLO CC(C)(C)Oc1cccc(C[N@@H+]2CCO[C@H](c3ccco3)C2)c1 ZINC001307523531 1065461291 /nfs/dbraw/zinc/46/12/91/1065461291.db2.gz NHPFEYYFUUHSQH-SFHVURJKSA-N 1 2 315.413 4.030 20 0 DIADLO CC(C)(C)Oc1cccc(C[N@H+]2CCO[C@H](c3ccco3)C2)c1 ZINC001307523531 1065461294 /nfs/dbraw/zinc/46/12/94/1065461294.db2.gz NHPFEYYFUUHSQH-SFHVURJKSA-N 1 2 315.413 4.030 20 0 DIADLO CC(C)CC1CC[NH+](Cc2sncc2Br)CC1 ZINC001307523082 1065462949 /nfs/dbraw/zinc/46/29/49/1065462949.db2.gz GNMSJQAYPACWNF-UHFFFAOYSA-N 1 2 317.296 4.164 20 0 DIADLO c1ccc2c(C[N@@H+]3CCOC4(C3)CCCCCC4)nsc2c1 ZINC001307530189 1065466451 /nfs/dbraw/zinc/46/64/51/1065466451.db2.gz NNWKCVFYKCOLFK-UHFFFAOYSA-N 1 2 316.470 4.222 20 0 DIADLO c1ccc2c(C[N@H+]3CCOC4(C3)CCCCCC4)nsc2c1 ZINC001307530189 1065466463 /nfs/dbraw/zinc/46/64/63/1065466463.db2.gz NNWKCVFYKCOLFK-UHFFFAOYSA-N 1 2 316.470 4.222 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CCCCC[C@H]2/C=C\c2ccccc2)[nH]1 ZINC001307582357 1065496111 /nfs/dbraw/zinc/49/61/11/1065496111.db2.gz GPUNNHNXUFDRQD-SQVRQVGWSA-N 1 2 324.472 4.386 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CCCCC[C@H]2/C=C\c2ccccc2)[nH]1 ZINC001307582357 1065496116 /nfs/dbraw/zinc/49/61/16/1065496116.db2.gz GPUNNHNXUFDRQD-SQVRQVGWSA-N 1 2 324.472 4.386 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2noc3c2CCCC3)C2CC2)c(F)c1 ZINC001307617095 1065520165 /nfs/dbraw/zinc/52/01/65/1065520165.db2.gz CACQSOFXDXBNGK-GOSISDBHSA-N 1 2 318.367 4.073 20 0 DIADLO CCNc1nc(C[NH2+][C@@H](CC)c2ccc(F)cc2F)cs1 ZINC001307624102 1065524835 /nfs/dbraw/zinc/52/48/35/1065524835.db2.gz BCZTZOZMXZYTHV-AWEZNQCLSA-N 1 2 311.401 4.094 20 0 DIADLO CCNc1nc(C[NH2+][C@@H](C)c2ccc(Cl)c(F)c2)cs1 ZINC001307636122 1065532387 /nfs/dbraw/zinc/53/23/87/1065532387.db2.gz CZDZYEHRUPDUKO-VIFPVBQESA-N 1 2 313.829 4.218 20 0 DIADLO C[N@@H+]1CCN(CCSC2CCCCC2)[C@@H](c2ccccc2)C1 ZINC001307654265 1065544131 /nfs/dbraw/zinc/54/41/31/1065544131.db2.gz GGWZWNIVHALFTG-LJQANCHMSA-N 1 2 318.530 4.041 20 0 DIADLO C[N@H+]1CCN(CCSC2CCCCC2)[C@@H](c2ccccc2)C1 ZINC001307654265 1065544139 /nfs/dbraw/zinc/54/41/39/1065544139.db2.gz GGWZWNIVHALFTG-LJQANCHMSA-N 1 2 318.530 4.041 20 0 DIADLO COc1cc(C)[nH+]c(CN2c3ccccc3CC[C@@H]2C(C)C)c1 ZINC001307654891 1065545756 /nfs/dbraw/zinc/54/57/56/1065545756.db2.gz HKMUOCUONLNJGT-LJQANCHMSA-N 1 2 310.441 4.376 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1ccc(F)cc1Cl ZINC001307672319 1065552973 /nfs/dbraw/zinc/55/29/73/1065552973.db2.gz LZCHUPNFKSMOBP-GFCCVEGCSA-N 1 2 305.780 4.262 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1ccc(F)cc1Cl ZINC001307672319 1065552984 /nfs/dbraw/zinc/55/29/84/1065552984.db2.gz LZCHUPNFKSMOBP-GFCCVEGCSA-N 1 2 305.780 4.262 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1CCc2cc(F)cc(C)c2C1 ZINC001307715585 1065582175 /nfs/dbraw/zinc/58/21/75/1065582175.db2.gz LSONUABZQVJWGB-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1CCc2cc(F)cc(C)c2C1 ZINC001307715585 1065582191 /nfs/dbraw/zinc/58/21/91/1065582191.db2.gz LSONUABZQVJWGB-UHFFFAOYSA-N 1 2 319.807 4.354 20 0 DIADLO Cc1cc(C)c(C[N@@H+]2CCc3c(Cl)cc(F)cc3C2)c(C)n1 ZINC001307805255 1065628902 /nfs/dbraw/zinc/62/89/02/1065628902.db2.gz FYTJAIAPSDMJBZ-UHFFFAOYSA-N 1 2 318.823 4.358 20 0 DIADLO Cc1cc(C)c(C[N@H+]2CCc3c(Cl)cc(F)cc3C2)c(C)n1 ZINC001307805255 1065628912 /nfs/dbraw/zinc/62/89/12/1065628912.db2.gz FYTJAIAPSDMJBZ-UHFFFAOYSA-N 1 2 318.823 4.358 20 0 DIADLO CO[C@H](C[N@@H+]1CCn2c(cc3ccccc32)C1)C1CCCCC1 ZINC001307803158 1065629014 /nfs/dbraw/zinc/62/90/14/1065629014.db2.gz ICQYMYIUWDYKRX-HXUWFJFHSA-N 1 2 312.457 4.052 20 0 DIADLO CO[C@H](C[N@H+]1CCn2c(cc3ccccc32)C1)C1CCCCC1 ZINC001307803158 1065629024 /nfs/dbraw/zinc/62/90/24/1065629024.db2.gz ICQYMYIUWDYKRX-HXUWFJFHSA-N 1 2 312.457 4.052 20 0 DIADLO COc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1sccc1Cl)C2 ZINC001307818322 1065638027 /nfs/dbraw/zinc/63/80/27/1065638027.db2.gz MSVPOXWDOLLACG-UHFFFAOYSA-N 1 2 319.857 4.458 20 0 DIADLO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1sccc1Cl)C2 ZINC001307818322 1065638030 /nfs/dbraw/zinc/63/80/30/1065638030.db2.gz MSVPOXWDOLLACG-UHFFFAOYSA-N 1 2 319.857 4.458 20 0 DIADLO CC[C@@H]1C[NH+]([C@@H](C)c2ncc(-c3ccccc3)o2)C[C@@H](CC)O1 ZINC001307856524 1065656812 /nfs/dbraw/zinc/65/68/12/1065656812.db2.gz LPGHJAHJYGYWDS-USXIJHARSA-N 1 2 314.429 4.292 20 0 DIADLO Clc1cncc(Cl)c1C[N@@H+]1CCSC[C@@H]1C1CCC1 ZINC001307860668 1065658760 /nfs/dbraw/zinc/65/87/60/1065658760.db2.gz VSBKVMOHJKRMSV-CQSZACIVSA-N 1 2 317.285 4.106 20 0 DIADLO Clc1cncc(Cl)c1C[N@H+]1CCSC[C@@H]1C1CCC1 ZINC001307860668 1065658763 /nfs/dbraw/zinc/65/87/63/1065658763.db2.gz VSBKVMOHJKRMSV-CQSZACIVSA-N 1 2 317.285 4.106 20 0 DIADLO C[C@@H]1C[N@H+](CCc2cc(Cl)cc(Cl)c2)C2(CCC2)CO1 ZINC001307902474 1065673275 /nfs/dbraw/zinc/67/32/75/1065673275.db2.gz VIQXFGOUFXXNCN-GFCCVEGCSA-N 1 2 314.256 4.179 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2cc(Cl)cc(Cl)c2)C2(CCC2)CO1 ZINC001307902474 1065673282 /nfs/dbraw/zinc/67/32/82/1065673282.db2.gz VIQXFGOUFXXNCN-GFCCVEGCSA-N 1 2 314.256 4.179 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+](C)Cc1oc2c(cccc2C)c1C ZINC001307901827 1065674141 /nfs/dbraw/zinc/67/41/41/1065674141.db2.gz OWRLJONOPRDTQV-HNNXBMFYSA-N 1 2 317.429 4.213 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+](C)Cc1oc2c(cccc2C)c1C ZINC001307901827 1065674147 /nfs/dbraw/zinc/67/41/47/1065674147.db2.gz OWRLJONOPRDTQV-HNNXBMFYSA-N 1 2 317.429 4.213 20 0 DIADLO Cc1ccc(C[N@@H+]2[C@H](C)CC[C@@H]2C(=O)OC(C)(C)C)c(Cl)c1 ZINC001307907519 1065679055 /nfs/dbraw/zinc/67/90/55/1065679055.db2.gz CZRGTFRFGJKNOT-CZUORRHYSA-N 1 2 323.864 4.343 20 0 DIADLO Cc1ccc(C[N@H+]2[C@H](C)CC[C@@H]2C(=O)OC(C)(C)C)c(Cl)c1 ZINC001307907519 1065679063 /nfs/dbraw/zinc/67/90/63/1065679063.db2.gz CZRGTFRFGJKNOT-CZUORRHYSA-N 1 2 323.864 4.343 20 0 DIADLO CCOC(=O)[C@@H](CCc1ccccc1)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC001307964938 1065702861 /nfs/dbraw/zinc/70/28/61/1065702861.db2.gz PMAGGDAWMBXSSR-OXJNMPFZSA-N 1 2 323.436 4.128 20 0 DIADLO CCOC(=O)[C@@H](CCc1ccccc1)[N@H+]1Cc2ccccc2[C@@H]1C ZINC001307964938 1065702873 /nfs/dbraw/zinc/70/28/73/1065702873.db2.gz PMAGGDAWMBXSSR-OXJNMPFZSA-N 1 2 323.436 4.128 20 0 DIADLO Cc1ccc(C[C@@]2(C)CCC[N@@H+]2CC(F)(F)C(F)F)cc1 ZINC001307972969 1065708130 /nfs/dbraw/zinc/70/81/30/1065708130.db2.gz UKIWXOBGGIVGMR-OAHLLOKOSA-N 1 2 303.343 4.292 20 0 DIADLO Cc1ccc(C[C@@]2(C)CCC[N@H+]2CC(F)(F)C(F)F)cc1 ZINC001307972969 1065708139 /nfs/dbraw/zinc/70/81/39/1065708139.db2.gz UKIWXOBGGIVGMR-OAHLLOKOSA-N 1 2 303.343 4.292 20 0 DIADLO COc1c(C)c[nH+]c(CN2C[C@@H](C)Cc3cccc(F)c32)c1C ZINC001308020731 1065727017 /nfs/dbraw/zinc/72/70/17/1065727017.db2.gz XQUPMHOCGXTRHM-LBPRGKRZSA-N 1 2 314.404 4.045 20 0 DIADLO CCOC(=O)[C@H](CCCC(C)C)[NH2+]C[C@H]1CCCCC1(F)F ZINC001308063157 1065748045 /nfs/dbraw/zinc/74/80/45/1065748045.db2.gz DRODJJYENMVVKD-CABCVRRESA-N 1 2 319.436 4.160 20 0 DIADLO C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1Cc2cn[nH]c2C[C@H](C)C1 ZINC001308075160 1065752746 /nfs/dbraw/zinc/75/27/46/1065752746.db2.gz RJORTGOBXGYMII-GJZGRUSLSA-N 1 2 311.473 4.463 20 0 DIADLO C[C@@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1Cc2cn[nH]c2C[C@H](C)C1 ZINC001308075160 1065752756 /nfs/dbraw/zinc/75/27/56/1065752756.db2.gz RJORTGOBXGYMII-GJZGRUSLSA-N 1 2 311.473 4.463 20 0 DIADLO COC(=O)[C@@H](CC(C)C)[NH2+][C@H]1CCc2cccc3cccc1c32 ZINC001308092795 1065760272 /nfs/dbraw/zinc/76/02/72/1065760272.db2.gz NAGLXYQVGUKWSI-ZWKOTPCHSA-N 1 2 311.425 4.004 20 0 DIADLO CC(C)(CNc1ccc([NH+]2CCC(O)CC2)cc1)c1ccccc1 ZINC001308209592 1065818537 /nfs/dbraw/zinc/81/85/37/1065818537.db2.gz PKPDVCTWSNQUNG-UHFFFAOYSA-N 1 2 324.468 4.037 20 0 DIADLO CC(C)(C[NH2+]c1ccc(N2CCC(O)CC2)cc1)c1ccccc1 ZINC001308209592 1065818558 /nfs/dbraw/zinc/81/85/58/1065818558.db2.gz PKPDVCTWSNQUNG-UHFFFAOYSA-N 1 2 324.468 4.037 20 0 DIADLO Clc1cncc(Cl)c1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC001308211849 1065819987 /nfs/dbraw/zinc/81/99/87/1065819987.db2.gz CJCHWGMIJIKGJL-UHFFFAOYSA-N 1 2 319.195 4.186 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2cnc(-c3ccccc3)[nH]2)C2CC2)s1 ZINC001308290703 1065886176 /nfs/dbraw/zinc/88/61/76/1065886176.db2.gz QILGDLMORSTHKB-INIZCTEOSA-N 1 2 324.453 4.083 20 0 DIADLO Fc1ccc(C[NH2+]Cc2cccc(Cl)c2F)c(F)c1F ZINC001308292182 1065889592 /nfs/dbraw/zinc/88/95/92/1065889592.db2.gz DWFOIUAXMCIDGV-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO CCCOc1cc(C)ccc1C[NH2+]Cc1ncc(CC)s1 ZINC001308304784 1065899761 /nfs/dbraw/zinc/89/97/61/1065899761.db2.gz KCTASBXJJSBUMV-UHFFFAOYSA-N 1 2 304.459 4.093 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3cc(F)c(F)c(F)c3)ccc21 ZINC001308321714 1065911304 /nfs/dbraw/zinc/91/13/04/1065911304.db2.gz OIKWBICOLFYLDZ-UHFFFAOYSA-N 1 2 306.331 4.098 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3cc(F)c(F)c(F)c3)ccc21 ZINC001308321714 1065911313 /nfs/dbraw/zinc/91/13/13/1065911313.db2.gz OIKWBICOLFYLDZ-UHFFFAOYSA-N 1 2 306.331 4.098 20 0 DIADLO Cc1nc(-c2ccc(NCc3cccc4[nH+]ccn43)cc2)oc1C ZINC001308322924 1065913747 /nfs/dbraw/zinc/91/37/47/1065913747.db2.gz RANOEMXKTKAFQJ-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO Cc1cccn2c(CNc3cccc(C(F)(F)F)c3)c[nH+]c12 ZINC001308325165 1065914437 /nfs/dbraw/zinc/91/44/37/1065914437.db2.gz VJEBFBONIMBOAB-UHFFFAOYSA-N 1 2 305.303 4.274 20 0 DIADLO Fc1ccc(Cl)cc1C[NH2+][C@H]1COc2ccc(Cl)cc21 ZINC001308326041 1065915045 /nfs/dbraw/zinc/91/50/45/1065915045.db2.gz YVVYRYWBJUCCTH-AWEZNQCLSA-N 1 2 312.171 4.356 20 0 DIADLO C[C@@H]([NH2+]C/C=C/c1cccc(F)c1)c1noc(-c2ccccc2)n1 ZINC001308329239 1065917342 /nfs/dbraw/zinc/91/73/42/1065917342.db2.gz UJKLRDWXMABHRL-IZPAUZPXSA-N 1 2 323.371 4.240 20 0 DIADLO CCN(CC)c1ccc(NC/C=C\c2ccc(F)c(F)c2)c[nH+]1 ZINC001308339643 1065924563 /nfs/dbraw/zinc/92/45/63/1065924563.db2.gz WINXPZNOMRMXRM-WAYWQWQTSA-N 1 2 317.383 4.331 20 0 DIADLO CCN(CC)c1ccc(NC/C=C/c2ccc(F)c(F)c2)c[nH+]1 ZINC001308339642 1065924870 /nfs/dbraw/zinc/92/48/70/1065924870.db2.gz WINXPZNOMRMXRM-AATRIKPKSA-N 1 2 317.383 4.331 20 0 DIADLO COc1cc[nH+]cc1NCc1cccc(OCc2ccccc2)c1 ZINC001308340006 1065925006 /nfs/dbraw/zinc/92/50/06/1065925006.db2.gz GINBHQSKHBZHJY-UHFFFAOYSA-N 1 2 320.392 4.281 20 0 DIADLO Cc1cc([NH2+]CC(C)(C)c2ccccc2)ccc1N1CCOCC1 ZINC001308345889 1065929810 /nfs/dbraw/zinc/92/98/10/1065929810.db2.gz PRUYZYNBKWBHTR-UHFFFAOYSA-N 1 2 324.468 4.221 20 0 DIADLO CCn1c[nH+]cc1CNc1cc(Cl)ccc1OCC1CCC1 ZINC001308374617 1065949262 /nfs/dbraw/zinc/94/92/62/1065949262.db2.gz RGAOOXBGVVMWQB-UHFFFAOYSA-N 1 2 319.836 4.347 20 0 DIADLO CCN(c1ccccc1)c1ccc(C[NH2+]C(CF)CF)cc1 ZINC001308418759 1065974360 /nfs/dbraw/zinc/97/43/60/1065974360.db2.gz YSYKXCNERADGNL-UHFFFAOYSA-N 1 2 304.384 4.242 20 0 DIADLO Cc1[nH+]cn(-c2ccc(NCc3cc(C)nc(C)c3)cc2)c1C ZINC001308421320 1065976041 /nfs/dbraw/zinc/97/60/41/1065976041.db2.gz TWGHARGUSYRCPT-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO Fc1ccc(C(F)(F)C[NH2+]Cc2ccc3[nH]ccc3c2)cc1 ZINC001308474363 1066014015 /nfs/dbraw/zinc/01/40/15/1066014015.db2.gz CUKIUJZYMPSFGQ-UHFFFAOYSA-N 1 2 304.315 4.189 20 0 DIADLO Oc1ccc(Cl)c(C[NH2+]Cc2cccc(OC3CC3)c2F)c1 ZINC001308503107 1066032251 /nfs/dbraw/zinc/03/22/51/1066032251.db2.gz MMINFFWXDNWSNM-UHFFFAOYSA-N 1 2 321.779 4.016 20 0 DIADLO CCOCCCn1c2ccccc2[nH+]c1NCc1ccc(C)cc1 ZINC001308505419 1066033736 /nfs/dbraw/zinc/03/37/36/1066033736.db2.gz FEOTULPNBAWSHL-UHFFFAOYSA-N 1 2 323.440 4.383 20 0 DIADLO Cc1ccc(C[NH2+]Cc2noc3c2CC(C)(C)CC3)cc1Cl ZINC001308508779 1066036167 /nfs/dbraw/zinc/03/61/67/1066036167.db2.gz MUYFRYCODOEHKB-UHFFFAOYSA-N 1 2 318.848 4.441 20 0 DIADLO Clc1ccc2[nH]c(NCc3ccc4c(c3)CCCO4)[nH+]c2c1 ZINC001308510954 1066037520 /nfs/dbraw/zinc/03/75/20/1066037520.db2.gz CEOBFYAXWGPMSA-UHFFFAOYSA-N 1 2 313.788 4.153 20 0 DIADLO F[C@@H]1COc2ccccc2[C@H]1[NH2+]Cc1cc2ccccc2s1 ZINC001308521469 1066042129 /nfs/dbraw/zinc/04/21/29/1066042129.db2.gz UOKOACSOPGYMGI-CRAIPNDOSA-N 1 2 313.397 4.463 20 0 DIADLO CCNc1ccccc1CNc1[nH+]c2ccccc2n1CC1CC1 ZINC001308527084 1066046517 /nfs/dbraw/zinc/04/65/17/1066046517.db2.gz BZKKYIQGOAHJKH-UHFFFAOYSA-N 1 2 320.440 4.490 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)c(F)c1F)c1c(F)cccc1F ZINC001308528693 1066047908 /nfs/dbraw/zinc/04/79/08/1066047908.db2.gz VKHYLGYJIGMFOB-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO COc1cccc(F)c1C[NH2+]Cc1ccc(Cl)cc1Cl ZINC001308536358 1066054510 /nfs/dbraw/zinc/05/45/10/1066054510.db2.gz XDRYBESUKPDEAR-UHFFFAOYSA-N 1 2 314.187 4.431 20 0 DIADLO Cn1ncc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)c1C1CC1 ZINC001308570512 1066080356 /nfs/dbraw/zinc/08/03/56/1066080356.db2.gz MULVLFPCNGRDFV-UHFFFAOYSA-N 1 2 324.255 4.236 20 0 DIADLO Cn1ncc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)c1C1CC1 ZINC001308570512 1066080366 /nfs/dbraw/zinc/08/03/66/1066080366.db2.gz MULVLFPCNGRDFV-UHFFFAOYSA-N 1 2 324.255 4.236 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2c(Cl)c(C)nn2C)o1 ZINC001308578250 1066093249 /nfs/dbraw/zinc/09/32/49/1066093249.db2.gz NYRUPUILNVWROB-BXUZGUMPSA-N 1 2 321.852 4.257 20 0 DIADLO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2c(Cl)c(C)nn2C)o1 ZINC001308578250 1066093262 /nfs/dbraw/zinc/09/32/62/1066093262.db2.gz NYRUPUILNVWROB-BXUZGUMPSA-N 1 2 321.852 4.257 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccnc2Br)[C@@H]1c1ccccc1 ZINC001308609760 1066116549 /nfs/dbraw/zinc/11/65/49/1066116549.db2.gz SWTRPSPRJNIVTC-WFASDCNBSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccnc2Br)[C@@H]1c1ccccc1 ZINC001308609760 1066116552 /nfs/dbraw/zinc/11/65/52/1066116552.db2.gz SWTRPSPRJNIVTC-WFASDCNBSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1cnc2ccccc2n1 ZINC001308614252 1066118769 /nfs/dbraw/zinc/11/87/69/1066118769.db2.gz QIHIYHLDQXQXBQ-LBPRGKRZSA-N 1 2 313.351 4.101 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cnc2ccccc2n1 ZINC001308614252 1066118771 /nfs/dbraw/zinc/11/87/71/1066118771.db2.gz QIHIYHLDQXQXBQ-LBPRGKRZSA-N 1 2 313.351 4.101 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cnc(CCc3ccccc3)s2)C[C@@H]1F ZINC001308642152 1066134027 /nfs/dbraw/zinc/13/40/27/1066134027.db2.gz OSAQFTUJWWULFR-YOEHRIQHSA-N 1 2 318.461 4.108 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cnc(CCc3ccccc3)s2)C[C@@H]1F ZINC001308642152 1066134032 /nfs/dbraw/zinc/13/40/32/1066134032.db2.gz OSAQFTUJWWULFR-YOEHRIQHSA-N 1 2 318.461 4.108 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cnc(CCc3ccccc3)s2)C[C@H]1F ZINC001308642148 1066134256 /nfs/dbraw/zinc/13/42/56/1066134256.db2.gz OSAQFTUJWWULFR-RHSMWYFYSA-N 1 2 318.461 4.108 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cnc(CCc3ccccc3)s2)C[C@H]1F ZINC001308642148 1066134258 /nfs/dbraw/zinc/13/42/58/1066134258.db2.gz OSAQFTUJWWULFR-RHSMWYFYSA-N 1 2 318.461 4.108 20 0 DIADLO CC[N@H+](Cc1ccccc1)Cc1nccc(C)c1Br ZINC001308652645 1066137681 /nfs/dbraw/zinc/13/76/81/1066137681.db2.gz TVQHDBWCFHSDHL-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccccc1)Cc1nccc(C)c1Br ZINC001308652645 1066137685 /nfs/dbraw/zinc/13/76/85/1066137685.db2.gz TVQHDBWCFHSDHL-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO Cc1cnc(C[N@@H+](C)[C@@H](c2ccccc2)c2ccc(F)cc2)o1 ZINC001308659509 1066142629 /nfs/dbraw/zinc/14/26/29/1066142629.db2.gz WMMYTNSUANJZOR-IBGZPJMESA-N 1 2 310.372 4.344 20 0 DIADLO Cc1cnc(C[N@H+](C)[C@@H](c2ccccc2)c2ccc(F)cc2)o1 ZINC001308659509 1066142635 /nfs/dbraw/zinc/14/26/35/1066142635.db2.gz WMMYTNSUANJZOR-IBGZPJMESA-N 1 2 310.372 4.344 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1nccc2c1CCCC2)C1CC1 ZINC001308663058 1066143733 /nfs/dbraw/zinc/14/37/33/1066143733.db2.gz PQKJEBVCLKEYLP-UHFFFAOYSA-N 1 2 310.416 4.264 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1nccc2c1CCCC2)C1CC1 ZINC001308663058 1066143737 /nfs/dbraw/zinc/14/37/37/1066143737.db2.gz PQKJEBVCLKEYLP-UHFFFAOYSA-N 1 2 310.416 4.264 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1c1ccccc1)C(=O)OC1CCCC1 ZINC001308706143 1066189769 /nfs/dbraw/zinc/18/97/69/1066189769.db2.gz YSPLIUSJGUZSJV-KFKAGJAMSA-N 1 2 315.457 4.177 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCC[C@H]1c1ccccc1)C(=O)OC1CCCC1 ZINC001308706147 1066191587 /nfs/dbraw/zinc/19/15/87/1066191587.db2.gz YSPLIUSJGUZSJV-ZYSHUDEJSA-N 1 2 315.457 4.177 20 0 DIADLO Fc1cccc(C=C2CC[NH+](Cc3ncccc3F)CC2)c1 ZINC001308739208 1066213124 /nfs/dbraw/zinc/21/31/24/1066213124.db2.gz ABAXWQSVLIWNOB-UHFFFAOYSA-N 1 2 300.352 4.039 20 0 DIADLO C/C=C/C[C@H]([NH2+][C@H](CC)Cc1ccc(Cl)cc1)C(=O)OCC ZINC001308740089 1066214572 /nfs/dbraw/zinc/21/45/72/1066214572.db2.gz MURXXQVPNSWMEX-YQIFSTGGSA-N 1 2 323.864 4.149 20 0 DIADLO Cc1cccc(C[N@H+](CCN(C)C)Cc2coc3ccccc23)c1 ZINC001308743330 1066219492 /nfs/dbraw/zinc/21/94/92/1066219492.db2.gz TUCYUYAVTKNOMA-UHFFFAOYSA-N 1 2 322.452 4.305 20 0 DIADLO Cc1cccc(C[N@@H+](CCN(C)C)Cc2coc3ccccc23)c1 ZINC001308743330 1066219502 /nfs/dbraw/zinc/21/95/02/1066219502.db2.gz TUCYUYAVTKNOMA-UHFFFAOYSA-N 1 2 322.452 4.305 20 0 DIADLO COc1cc(F)cc(OC)c1C[N@@H+]1CCc2sccc2[C@H]1C ZINC001308805176 1066282447 /nfs/dbraw/zinc/28/24/47/1066282447.db2.gz YYEIYBGKGRQRFP-LLVKDONJSA-N 1 2 321.417 4.024 20 0 DIADLO COc1cc(F)cc(OC)c1C[N@H+]1CCc2sccc2[C@H]1C ZINC001308805176 1066282459 /nfs/dbraw/zinc/28/24/59/1066282459.db2.gz YYEIYBGKGRQRFP-LLVKDONJSA-N 1 2 321.417 4.024 20 0 DIADLO CCOc1cccc(F)c1C[N@@H+]1C[C@@H](C)OC2(CCCCC2)C1 ZINC001308840114 1066314642 /nfs/dbraw/zinc/31/46/42/1066314642.db2.gz FJVUBCPAPJTIOO-OAHLLOKOSA-N 1 2 321.436 4.148 20 0 DIADLO CCOc1cccc(F)c1C[N@H+]1C[C@@H](C)OC2(CCCCC2)C1 ZINC001308840114 1066314661 /nfs/dbraw/zinc/31/46/61/1066314661.db2.gz FJVUBCPAPJTIOO-OAHLLOKOSA-N 1 2 321.436 4.148 20 0 DIADLO CCOc1cccc(F)c1C[N@@H+]1C[C@H](C)OC2(CCCCC2)C1 ZINC001308840113 1066314695 /nfs/dbraw/zinc/31/46/95/1066314695.db2.gz FJVUBCPAPJTIOO-HNNXBMFYSA-N 1 2 321.436 4.148 20 0 DIADLO CCOc1cccc(F)c1C[N@H+]1C[C@H](C)OC2(CCCCC2)C1 ZINC001308840113 1066314711 /nfs/dbraw/zinc/31/47/11/1066314711.db2.gz FJVUBCPAPJTIOO-HNNXBMFYSA-N 1 2 321.436 4.148 20 0 DIADLO CCC(C)(C)OC1C[NH+](C/C(C)=C\c2ccccc2COC)C1 ZINC001308864208 1066344329 /nfs/dbraw/zinc/34/43/29/1066344329.db2.gz MBFOQOZYAHIVJJ-WJDWOHSUSA-N 1 2 317.473 4.126 20 0 DIADLO CO[C@H](C[NH2+]CC(F)(F)c1ccccc1C)C1CCCCC1 ZINC001308883579 1066362828 /nfs/dbraw/zinc/36/28/28/1066362828.db2.gz YDOOOJANLKMIIF-QGZVFWFLSA-N 1 2 311.416 4.272 20 0 DIADLO C/C=C\C[C@H]1CCC[N@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC001308885572 1066365268 /nfs/dbraw/zinc/36/52/68/1066365268.db2.gz HXXWRIZPQDIPQZ-QUCGXOGASA-N 1 2 304.381 4.340 20 0 DIADLO C/C=C\C[C@H]1CCC[N@@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC001308885572 1066365281 /nfs/dbraw/zinc/36/52/81/1066365281.db2.gz HXXWRIZPQDIPQZ-QUCGXOGASA-N 1 2 304.381 4.340 20 0 DIADLO CCOC(=O)[C@H](CCCC(C)C)[NH2+]C[C@@H]1C[C@@H]1c1ccccc1 ZINC001308935248 1066406384 /nfs/dbraw/zinc/40/63/84/1066406384.db2.gz NZGVJXZKTZHNHH-OTWHNJEPSA-N 1 2 317.473 4.138 20 0 DIADLO FC(F)[C@@H]([NH2+]CC1CCSCC1)c1cccc(Cl)c1 ZINC001308938169 1066408249 /nfs/dbraw/zinc/40/82/49/1066408249.db2.gz ACLDNSGTYXZHLL-ZDUSSCGKSA-N 1 2 305.821 4.379 20 0 DIADLO FC(F)[C@H]([NH2+]CC1CCSCC1)c1cccc(Cl)c1 ZINC001308938168 1066409032 /nfs/dbraw/zinc/40/90/32/1066409032.db2.gz ACLDNSGTYXZHLL-CYBMUJFWSA-N 1 2 305.821 4.379 20 0 DIADLO CCCCC[C@H](NC(=O)NCc1cc(C)[nH+]c(C)c1)C(C)(C)C ZINC001311970550 1066721272 /nfs/dbraw/zinc/72/12/72/1066721272.db2.gz CCSZNLBCRUEMCG-KRWDZBQOSA-N 1 2 319.493 4.493 20 0 DIADLO COc1ccc([C@@H](Nc2cccc[nH+]2)c2ccccc2OC)cc1 ZINC000130648802 334929721 /nfs/dbraw/zinc/92/97/21/334929721.db2.gz YEXHEOGIJDTPDO-HXUWFJFHSA-N 1 2 320.392 4.300 20 0 DIADLO Cc1ccc(Br)c(NCc2[nH+]ccn2C(C)C)c1 ZINC000090084101 185281332 /nfs/dbraw/zinc/28/13/32/185281332.db2.gz MUTOTIKIRBLXDP-UHFFFAOYSA-N 1 2 308.223 4.147 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1nc2c(s1)CCCC2 ZINC000090458776 185297548 /nfs/dbraw/zinc/29/75/48/185297548.db2.gz FMCNGYKNXUUVQL-JTQLQIEISA-N 1 2 319.499 4.207 20 0 DIADLO CC[C@H](Nc1ncc(C(F)(F)F)cc1Cl)c1[nH]cc[nH+]1 ZINC000139820605 186023799 /nfs/dbraw/zinc/02/37/99/186023799.db2.gz ZUUBHWFVTSSLCJ-VIFPVBQESA-N 1 2 304.703 4.040 20 0 DIADLO C[C@H](CC(=O)N[C@H](C)c1cccc2ccccc21)C1CC[NH2+]CC1 ZINC000150723268 186060086 /nfs/dbraw/zinc/06/00/86/186060086.db2.gz GZCKUQBLZKLBCN-HZPDHXFCSA-N 1 2 324.468 4.043 20 0 DIADLO CC[C@@](C)([NH2+]Cc1csc(-c2ccoc2)n1)c1nccs1 ZINC000072683014 191214936 /nfs/dbraw/zinc/21/49/36/191214936.db2.gz AJNBQBMIWSZUIY-OAHLLOKOSA-N 1 2 319.455 4.275 20 0 DIADLO CC[N@H+](Cc1nnc(-c2ccccc2)o1)[C@@H](C)c1cccc(O)c1 ZINC000080931143 192202271 /nfs/dbraw/zinc/20/22/71/192202271.db2.gz FRUIFGPOMBYKAA-AWEZNQCLSA-N 1 2 323.396 4.025 20 0 DIADLO CC[N@@H+](Cc1nnc(-c2ccccc2)o1)[C@@H](C)c1cccc(O)c1 ZINC000080931143 192202273 /nfs/dbraw/zinc/20/22/73/192202273.db2.gz FRUIFGPOMBYKAA-AWEZNQCLSA-N 1 2 323.396 4.025 20 0 DIADLO Cc1nc(C[N@@H+](C)C2c3ccccc3-c3ccccc32)oc1C ZINC000081596938 192299332 /nfs/dbraw/zinc/29/93/32/192299332.db2.gz ZKTHDNAXAVJPGK-UHFFFAOYSA-N 1 2 304.393 4.493 20 0 DIADLO Cc1nc(C[N@H+](C)C2c3ccccc3-c3ccccc32)oc1C ZINC000081596938 192299334 /nfs/dbraw/zinc/29/93/34/192299334.db2.gz ZKTHDNAXAVJPGK-UHFFFAOYSA-N 1 2 304.393 4.493 20 0 DIADLO CCCOc1cccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000236882752 202052003 /nfs/dbraw/zinc/05/20/03/202052003.db2.gz KTCVTAHEPPIOGY-CYBMUJFWSA-N 1 2 317.433 4.007 20 0 DIADLO CCc1ccc(N[C@H](c2[nH]cc[nH+]2)c2cccnc2)cc1CC ZINC000195102042 201339504 /nfs/dbraw/zinc/33/95/04/201339504.db2.gz HUPDETLZJYQREM-SFHVURJKSA-N 1 2 306.413 4.131 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H](C)c2cccc(OC(C)C)c2)nn1C ZINC000421322757 541307142 /nfs/dbraw/zinc/30/71/42/541307142.db2.gz FHUGCLHJAYPQNO-GFCCVEGCSA-N 1 2 321.852 4.020 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2nc3ccccc3n2C)cs1 ZINC000091337252 193044067 /nfs/dbraw/zinc/04/40/67/193044067.db2.gz CXHJPIIYNONTAQ-VXGBXAGGSA-N 1 2 314.458 4.004 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000091701969 193093791 /nfs/dbraw/zinc/09/37/91/193093791.db2.gz OHDBIJVBHTVHLH-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)[C@@H](C)c1ccccn1 ZINC000091701969 193093793 /nfs/dbraw/zinc/09/37/93/193093793.db2.gz OHDBIJVBHTVHLH-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H](C)c1nccs1)c1nc2ccccc2[nH]1 ZINC000093401136 193244788 /nfs/dbraw/zinc/24/47/88/193244788.db2.gz SDLGIHOORJGQLM-FZMZJTMJSA-N 1 2 300.431 4.067 20 0 DIADLO COc1c(C)c[nH+]c(COc2ccccc2Br)c1C ZINC000019844442 182156456 /nfs/dbraw/zinc/15/64/56/182156456.db2.gz FZPSZNZPSLLOFC-UHFFFAOYSA-N 1 2 322.202 4.049 20 0 DIADLO c1ccc2oc(N3CCC(c4[nH]c5ccccc5[nH+]4)CC3)nc2c1 ZINC000022530667 182325703 /nfs/dbraw/zinc/32/57/03/182325703.db2.gz YZMODMIQJGVHHW-UHFFFAOYSA-N 1 2 318.380 4.088 20 0 DIADLO COc1ccc(OCCCn2c[nH+]c3cc(C)c(C)cc32)cc1 ZINC000040224104 183047042 /nfs/dbraw/zinc/04/70/42/183047042.db2.gz XLBAIPZVQRZFMP-UHFFFAOYSA-N 1 2 310.397 4.131 20 0 DIADLO Cc1cc2[nH+]cn(CCOc3ccccc3Cl)c2cc1C ZINC000040224046 183047087 /nfs/dbraw/zinc/04/70/87/183047087.db2.gz XVKKYWWPRHVQSY-UHFFFAOYSA-N 1 2 300.789 4.386 20 0 DIADLO Cc1cccc(COc2ccc([C@H](C)[NH2+]Cc3ccn[nH]3)cc2)c1 ZINC000105492012 194106867 /nfs/dbraw/zinc/10/68/67/194106867.db2.gz NLAMHPWFWDPQBU-INIZCTEOSA-N 1 2 321.424 4.148 20 0 DIADLO C[C@H]1CC[C@H](C)N1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000135816019 335047425 /nfs/dbraw/zinc/04/74/25/335047425.db2.gz VKMIKOUYWFERLK-KBPBESRZSA-N 1 2 311.385 4.279 20 0 DIADLO CC[C@@H](NC(=O)Nc1ccc(C)[nH+]c1C)c1cc(F)ccc1F ZINC000152392959 335047673 /nfs/dbraw/zinc/04/76/73/335047673.db2.gz PTZNIMWOWQLSMW-OAHLLOKOSA-N 1 2 319.355 4.249 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(-c2cccnc2)cc1 ZINC000271803081 129964122 /nfs/dbraw/zinc/96/41/22/129964122.db2.gz PVICTEZMRAJNJG-CQSZACIVSA-N 1 2 319.408 4.465 20 0 DIADLO Brc1cccc(C[N@@H+]2CCC[C@H]2c2cccs2)n1 ZINC000272426077 130029409 /nfs/dbraw/zinc/02/94/09/130029409.db2.gz PECYYVPTWUXTNZ-LBPRGKRZSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cccc(C[N@H+]2CCC[C@H]2c2cccs2)n1 ZINC000272426077 130029410 /nfs/dbraw/zinc/02/94/10/130029410.db2.gz PECYYVPTWUXTNZ-LBPRGKRZSA-N 1 2 323.259 4.243 20 0 DIADLO O=C(c1ccc(-c2ccccc2)o1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000273097721 130089584 /nfs/dbraw/zinc/08/95/84/130089584.db2.gz HJTYNVOQLVPWAO-OAHLLOKOSA-N 1 2 321.380 4.037 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)[C@H](C)c1nnc(C)s1 ZINC000273192497 130096597 /nfs/dbraw/zinc/09/65/97/130096597.db2.gz OAUZNQVFPUQVAC-MRVPVSSYSA-N 1 2 301.868 4.145 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)[C@H](C)c1nnc(C)s1 ZINC000273192497 130096598 /nfs/dbraw/zinc/09/65/98/130096598.db2.gz OAUZNQVFPUQVAC-MRVPVSSYSA-N 1 2 301.868 4.145 20 0 DIADLO COCC[C@H]([NH2+]Cc1csc(CCC(C)C)n1)c1ccco1 ZINC000273283229 130102972 /nfs/dbraw/zinc/10/29/72/130102972.db2.gz OHCZLEXADZUWEA-HNNXBMFYSA-N 1 2 322.474 4.192 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2cc(-c3ccccc3)no2)s1 ZINC000273289053 130103640 /nfs/dbraw/zinc/10/36/40/130103640.db2.gz KUHPEYKGNWPLEU-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO CCc1ccc(-c2noc([C@H](C)[NH2+][C@H](C)c3ccccn3)n2)cc1 ZINC000273319569 130106462 /nfs/dbraw/zinc/10/64/62/130106462.db2.gz PIRZOBZFKADWLH-KGLIPLIRSA-N 1 2 322.412 4.106 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2ccn(C(CC)CC)n2)cs1 ZINC000273389207 130115739 /nfs/dbraw/zinc/11/57/39/130115739.db2.gz OOMKKIKHVYJYBV-GFCCVEGCSA-N 1 2 306.479 4.114 20 0 DIADLO O=C(c1cccc(Oc2cc[nH+]cc2)c1)N1CC2(C1)CCCCC2 ZINC000273709877 130157061 /nfs/dbraw/zinc/15/70/61/130157061.db2.gz FYFUXQUTOFOGMP-UHFFFAOYSA-N 1 2 322.408 4.280 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nnc(C)s1)c1ccc(Cl)s1 ZINC000274182689 130214124 /nfs/dbraw/zinc/21/41/24/130214124.db2.gz JAFRDMGJPWSKAQ-APPZFPTMSA-N 1 2 301.868 4.363 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(OC(C)(C)C)cc2)s1 ZINC000274280274 130223496 /nfs/dbraw/zinc/22/34/96/130223496.db2.gz JPUPIDQTGHHZKN-NWDGAFQWSA-N 1 2 319.474 4.436 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1nc(Cl)ccc1Cl ZINC000274314934 130226002 /nfs/dbraw/zinc/22/60/02/130226002.db2.gz NIMMFDWKHHRIRC-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1nc(Cl)ccc1Cl ZINC000274314934 130226006 /nfs/dbraw/zinc/22/60/06/130226006.db2.gz NIMMFDWKHHRIRC-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H]2CCc3c2cccc3O)cs1 ZINC000274433852 130233552 /nfs/dbraw/zinc/23/35/52/130233552.db2.gz KLWYUFMAAUVPOV-BXUZGUMPSA-N 1 2 302.443 4.310 20 0 DIADLO CC[N@H+](Cc1cn(C)nc1C(F)F)Cc1ccccc1Cl ZINC000274446188 130235217 /nfs/dbraw/zinc/23/52/17/130235217.db2.gz DCGJRDMKYRERJV-UHFFFAOYSA-N 1 2 313.779 4.033 20 0 DIADLO CC[N@@H+](Cc1cn(C)nc1C(F)F)Cc1ccccc1Cl ZINC000274446188 130235219 /nfs/dbraw/zinc/23/52/19/130235219.db2.gz DCGJRDMKYRERJV-UHFFFAOYSA-N 1 2 313.779 4.033 20 0 DIADLO CC(C)([NH2+]Cc1ncc(C2CC2)o1)c1cccc(Cl)c1F ZINC000274519903 130242898 /nfs/dbraw/zinc/24/28/98/130242898.db2.gz NBNINXBBCQQZFB-UHFFFAOYSA-N 1 2 308.784 4.369 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)nc1)c1nc(C(F)(F)F)cs1 ZINC000274609862 130249247 /nfs/dbraw/zinc/24/92/47/130249247.db2.gz NBLYBTNSJFXKFI-SSDOTTSWSA-N 1 2 321.755 4.061 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1nc(C(F)(F)F)cs1 ZINC000274633464 130250180 /nfs/dbraw/zinc/25/01/80/130250180.db2.gz RYQIJQHUPDQBAK-PSASIEDQSA-N 1 2 316.348 4.483 20 0 DIADLO CCCc1cccc(C[NH2+]Cc2nnc(C(C)(C)C)s2)c1 ZINC000274838891 130267212 /nfs/dbraw/zinc/26/72/12/130267212.db2.gz VRZHAWHZZBRLEW-UHFFFAOYSA-N 1 2 303.475 4.078 20 0 DIADLO Fc1cncc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)c1 ZINC000275064869 130289655 /nfs/dbraw/zinc/28/96/55/130289655.db2.gz RQAWKIHWILBVSX-UHFFFAOYSA-N 1 2 311.187 4.306 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ncc(-c2ccc(Cl)cc2)o1)c1cn[nH]c1 ZINC000275198377 130297499 /nfs/dbraw/zinc/29/74/99/130297499.db2.gz QBPCAYGIKQJQLK-GHMZBOCLSA-N 1 2 316.792 4.130 20 0 DIADLO Fc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ncc(C(F)(F)F)s1 ZINC000278562734 130702471 /nfs/dbraw/zinc/70/24/71/130702471.db2.gz CQJVIXJJAZEQEB-NSHDSACASA-N 1 2 316.323 4.078 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2ncc(C(F)(F)F)s2)CC1 ZINC000278621695 130706783 /nfs/dbraw/zinc/70/67/83/130706783.db2.gz JTKGYLWNFRTTQW-UHFFFAOYSA-N 1 2 316.323 4.080 20 0 DIADLO CCn1cc([C@H](C)[NH2+][C@@H](c2ccc(C)cc2)c2ccccn2)cn1 ZINC000280292023 130795550 /nfs/dbraw/zinc/79/55/50/130795550.db2.gz ZHZJQTDFHREGRW-JXFKEZNVSA-N 1 2 320.440 4.047 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccc(C)cc2OC(C)(C)C)no1 ZINC000283835536 131028681 /nfs/dbraw/zinc/02/86/81/131028681.db2.gz AUISBJLIFNEKLJ-CQSZACIVSA-N 1 2 302.418 4.320 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CCC=C(c3ccccc3)C2)cs1 ZINC000284688369 131103709 /nfs/dbraw/zinc/10/37/09/131103709.db2.gz HJTYMRVFPZCJFQ-AWEZNQCLSA-N 1 2 314.454 4.140 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CCC=C(c3ccccc3)C2)cs1 ZINC000284688369 131103711 /nfs/dbraw/zinc/10/37/11/131103711.db2.gz HJTYMRVFPZCJFQ-AWEZNQCLSA-N 1 2 314.454 4.140 20 0 DIADLO FC(F)(F)C1=CC[N@H+](Cc2cc(-c3ccccc3)on2)CC1 ZINC000284867850 131117460 /nfs/dbraw/zinc/11/74/60/131117460.db2.gz DSLGXZMZANWQKF-UHFFFAOYSA-N 1 2 308.303 4.036 20 0 DIADLO FC(F)(F)C1=CC[N@@H+](Cc2cc(-c3ccccc3)on2)CC1 ZINC000284867850 131117461 /nfs/dbraw/zinc/11/74/61/131117461.db2.gz DSLGXZMZANWQKF-UHFFFAOYSA-N 1 2 308.303 4.036 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2cc(-c3ccccc3)on2)s1 ZINC000284870173 131118096 /nfs/dbraw/zinc/11/80/96/131118096.db2.gz DVNDTCKQNCPSBT-UHFFFAOYSA-N 1 2 313.426 4.131 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](CC(F)(F)F)c2ccc(F)cc2)no1 ZINC000284882063 131119214 /nfs/dbraw/zinc/11/92/14/131119214.db2.gz BJQQTCZVQPCHQS-QMTHXVAHSA-N 1 2 316.298 4.466 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H]2CCCOc3cc(Cl)ccc32)no1 ZINC000284952352 131125203 /nfs/dbraw/zinc/12/52/03/131125203.db2.gz FDVSMKVLEDYPCJ-RISCZKNCSA-N 1 2 306.793 4.201 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2nc(-c3ccccc3)c[nH]2)on1 ZINC000285150236 131142772 /nfs/dbraw/zinc/14/27/72/131142772.db2.gz UDEPBYDLKVKMQE-SFHVURJKSA-N 1 2 322.412 4.100 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2nc(-c3ccccc3)c[nH]2)on1 ZINC000285150236 131142774 /nfs/dbraw/zinc/14/27/74/131142774.db2.gz UDEPBYDLKVKMQE-SFHVURJKSA-N 1 2 322.412 4.100 20 0 DIADLO CC[C@](C)([NH2+]Cc1cc(-c2ccccc2)on1)c1nccs1 ZINC000285174792 131144950 /nfs/dbraw/zinc/14/49/50/131144950.db2.gz VGVVAYFIMBXFKA-KRWDZBQOSA-N 1 2 313.426 4.213 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cc(-c2ccccc2)on1)c1nccs1 ZINC000285174796 131145119 /nfs/dbraw/zinc/14/51/19/131145119.db2.gz VGVVAYFIMBXFKA-QGZVFWFLSA-N 1 2 313.426 4.213 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CCC=C(c3ccco3)C2)n1 ZINC000285226930 131149672 /nfs/dbraw/zinc/14/96/72/131149672.db2.gz FQQKIHYGGMNSMW-UHFFFAOYSA-N 1 2 314.332 4.044 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CCC=C(c3ccco3)C2)n1 ZINC000285226930 131149674 /nfs/dbraw/zinc/14/96/74/131149674.db2.gz FQQKIHYGGMNSMW-UHFFFAOYSA-N 1 2 314.332 4.044 20 0 DIADLO Cc1cc([C@@H](C)Nc2cccc3c2CN(c2cccc[nH+]2)C3)no1 ZINC000285407151 131165801 /nfs/dbraw/zinc/16/58/01/131165801.db2.gz XMEMMHBNOOKWPK-CQSZACIVSA-N 1 2 320.396 4.071 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1csc(-c2ccoc2)n1 ZINC000285524192 131177351 /nfs/dbraw/zinc/17/73/51/131177351.db2.gz FAZWTLPYJZTVAP-UHFFFAOYSA-N 1 2 317.414 4.033 20 0 DIADLO CCC(C)(C)c1ccc(C[NH2+]C(C)(C)c2noc(C)n2)cc1 ZINC000285691977 131193197 /nfs/dbraw/zinc/19/31/97/131193197.db2.gz RBUAOSSGICBAID-UHFFFAOYSA-N 1 2 301.434 4.091 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cc(F)c(F)c(F)c1 ZINC000285731134 131197663 /nfs/dbraw/zinc/19/76/63/131197663.db2.gz QSMMRIZNUXYWGQ-SFYZADRCSA-N 1 2 316.273 4.189 20 0 DIADLO CC(C)CC[C@@H]([NH2+]Cc1nncn1-c1ccccc1)c1ccoc1 ZINC000285827472 131204170 /nfs/dbraw/zinc/20/41/70/131204170.db2.gz WRZFZGQEVFWJLS-GOSISDBHSA-N 1 2 324.428 4.127 20 0 DIADLO CN(Cc1ccc(-n2cc[nH+]c2)cc1)c1cccc2cccnc21 ZINC000340217725 131210871 /nfs/dbraw/zinc/21/08/71/131210871.db2.gz RELBYOQXSVVGBS-UHFFFAOYSA-N 1 2 314.392 4.057 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1cc(C)ccn1)c1ccco1 ZINC000286223065 131224711 /nfs/dbraw/zinc/22/47/11/131224711.db2.gz SJVFAXMIIKMACE-FOIQADDNSA-N 1 2 322.408 4.432 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(Cc1ccc(F)cc1)C(C)C ZINC000286969108 131258138 /nfs/dbraw/zinc/25/81/38/131258138.db2.gz BDZBCCLWTIYYFU-UHFFFAOYSA-N 1 2 315.392 4.280 20 0 DIADLO Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)Nc2c(C)cc[nH+]c2C)C1 ZINC000286979860 131258881 /nfs/dbraw/zinc/25/88/81/131258881.db2.gz BTPQDVXIPUMPCS-DOTOQJQBSA-N 1 2 323.440 4.417 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@H](C)c2nccn2-c2ccccc2)o1 ZINC000287053923 131261896 /nfs/dbraw/zinc/26/18/96/131261896.db2.gz NBZXZBMXKMQPFG-HUUCEWRRSA-N 1 2 309.413 4.440 20 0 DIADLO C[C@H]([NH2+]Cc1ccncc1OCCC(C)(C)C)c1nccs1 ZINC000287139366 131266010 /nfs/dbraw/zinc/26/60/10/131266010.db2.gz APZIRRFXAHEQKO-ZDUSSCGKSA-N 1 2 319.474 4.204 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(CC1CCCCC1)C1CC1 ZINC000287381456 131277492 /nfs/dbraw/zinc/27/74/92/131277492.db2.gz CDMMYGPVQWLBHE-UHFFFAOYSA-N 1 2 301.434 4.275 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)N(C(=O)Nc3c(C)cc[nH+]c3C)C2)cc1 ZINC000287399021 131279351 /nfs/dbraw/zinc/27/93/51/131279351.db2.gz DKYSFZZBHIKIKT-QAPCUYQASA-N 1 2 323.440 4.417 20 0 DIADLO Fc1ccc2cc[nH+]c(NCc3cnn(-c4ccccc4)c3)c2c1 ZINC000340253460 131279624 /nfs/dbraw/zinc/27/96/24/131279624.db2.gz CMZNEVDQNQCXJU-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)Cc1ccc(Cl)c(F)c1 ZINC000287444982 131281073 /nfs/dbraw/zinc/28/10/73/131281073.db2.gz HPTKHGZNLCZPAL-UHFFFAOYSA-N 1 2 321.783 4.155 20 0 DIADLO CCc1nc(CCNc2[nH+]ccc3ccc(F)cc32)sc1C ZINC000340255799 131282163 /nfs/dbraw/zinc/28/21/63/131282163.db2.gz LIJOCYKTJUASLV-UHFFFAOYSA-N 1 2 315.417 4.356 20 0 DIADLO CCN(Cc1ccc(Cl)cc1)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287492837 131283255 /nfs/dbraw/zinc/28/32/55/131283255.db2.gz KZMXPPLNPAESSA-UHFFFAOYSA-N 1 2 317.820 4.406 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@@H](Cc2ccccc2)[C@H]1C ZINC000287490437 131283258 /nfs/dbraw/zinc/28/32/58/131283258.db2.gz KSUKFRCDYRPEPN-AEFFLSMTSA-N 1 2 323.440 4.183 20 0 DIADLO Cc1cccc(C2=CCN(C(=O)Nc3c(C)cc[nH+]c3C)CC2)c1 ZINC000287548204 131285713 /nfs/dbraw/zinc/28/57/13/131285713.db2.gz OQWSKLPMBSXNCZ-UHFFFAOYSA-N 1 2 321.424 4.328 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCCC2(CCCCC2)C1 ZINC000287617056 131290885 /nfs/dbraw/zinc/29/08/85/131290885.db2.gz TWVHKSPIVXSYTC-UHFFFAOYSA-N 1 2 301.434 4.277 20 0 DIADLO CSc1cc(C)ccc1CNC(=O)Nc1c(C)cc[nH+]c1C ZINC000287640139 131292116 /nfs/dbraw/zinc/29/21/16/131292116.db2.gz VQTRVILBTOADGN-UHFFFAOYSA-N 1 2 315.442 4.050 20 0 DIADLO CC[C@@H](NC(=O)Nc1c(C)cc[nH+]c1C)c1ccc(F)cc1F ZINC000287668101 131293031 /nfs/dbraw/zinc/29/30/31/131293031.db2.gz XMNHWNFNOPSHEA-OAHLLOKOSA-N 1 2 319.355 4.249 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000287675842 131294742 /nfs/dbraw/zinc/29/47/42/131294742.db2.gz VZJGHEQVMHXPSM-VHSXEESVSA-N 1 2 315.364 4.277 20 0 DIADLO Cc1nn(C)c2sc([C@H](C)Nc3ccc([NH+](C)C)cc3)cc12 ZINC000287731544 131298054 /nfs/dbraw/zinc/29/80/54/131298054.db2.gz PDKSCECKLKEBHG-LBPRGKRZSA-N 1 2 314.458 4.182 20 0 DIADLO C[C@@H]1CN(c2[nH+]ccc3ccc(F)cc32)C[C@@H](c2ccccc2)O1 ZINC000340261711 131300679 /nfs/dbraw/zinc/30/06/79/131300679.db2.gz VYAYHEPEPGUPBF-KUHUBIRLSA-N 1 2 322.383 4.340 20 0 DIADLO Clc1ccc(C[NH2+]Cc2noc3c2CCCC3)c(Cl)c1 ZINC000288332295 131320568 /nfs/dbraw/zinc/32/05/68/131320568.db2.gz AUQRCOBHTJBIMC-UHFFFAOYSA-N 1 2 311.212 4.150 20 0 DIADLO Clc1cc(Cl)cc(C[NH2+]Cc2noc3c2CCCC3)c1 ZINC000288369656 131322190 /nfs/dbraw/zinc/32/21/90/131322190.db2.gz DWBHZAQGJWTOGQ-UHFFFAOYSA-N 1 2 311.212 4.150 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2nccc(C(F)F)n2)cc1 ZINC000288503040 131327963 /nfs/dbraw/zinc/32/79/63/131327963.db2.gz SBYOUEFFZDKRGO-UHFFFAOYSA-N 1 2 305.372 4.002 20 0 DIADLO Cc1[nH+]cccc1Cc1nc(-c2ccccc2OCC(C)C)no1 ZINC000289164210 131363338 /nfs/dbraw/zinc/36/33/38/131363338.db2.gz QDZKDSSQWYHRLU-UHFFFAOYSA-N 1 2 323.396 4.066 20 0 DIADLO Cc1cc[nH+]cc1CCCNc1ccc(C)c(-c2ncco2)c1 ZINC000289195500 131364605 /nfs/dbraw/zinc/36/46/05/131364605.db2.gz HGNXBHYTVDOTHR-UHFFFAOYSA-N 1 2 307.397 4.398 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)no1 ZINC000289305309 131372423 /nfs/dbraw/zinc/37/24/23/131372423.db2.gz BYMJOJGQMVCEIF-KTJYFRGRSA-N 1 2 305.809 4.079 20 0 DIADLO CC1(CC(=O)N(Cc2[nH]cc[nH+]2)c2cccc(F)c2)CCCC1 ZINC000289314040 131373401 /nfs/dbraw/zinc/37/34/01/131373401.db2.gz WMHMOPOIKQAFOK-UHFFFAOYSA-N 1 2 315.392 4.052 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)no1 ZINC000289348488 131376733 /nfs/dbraw/zinc/37/67/33/131376733.db2.gz KOPKCZSUEIJJCQ-KBPBESRZSA-N 1 2 307.397 4.457 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2csc(Cl)n2)c1 ZINC000289449445 131386886 /nfs/dbraw/zinc/38/68/86/131386886.db2.gz XGTNEUVSIQBCGK-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2csc(Cl)n2)c1 ZINC000289449445 131386888 /nfs/dbraw/zinc/38/68/88/131386888.db2.gz XGTNEUVSIQBCGK-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2cc(Cl)sc2Cl)s1 ZINC000289597706 131399997 /nfs/dbraw/zinc/39/99/97/131399997.db2.gz BKFQTYYTZGLMCJ-ZCFIWIBFSA-N 1 2 322.286 4.320 20 0 DIADLO C[C@@H]([NH2+]Cc1ncccc1N(C)C)c1cccc(Cl)c1Cl ZINC000289877617 131428038 /nfs/dbraw/zinc/42/80/38/131428038.db2.gz RWGXZQFRVLAQOS-LLVKDONJSA-N 1 2 324.255 4.305 20 0 DIADLO CSCc1cnc(C[NH2+][C@H](C)c2cccc(F)c2F)s1 ZINC000293148249 131712344 /nfs/dbraw/zinc/71/23/44/131712344.db2.gz DMBUAMWGKKCZJJ-SECBINFHSA-N 1 2 314.426 4.135 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C1(C(F)(F)F)CCC1 ZINC000295118950 131884684 /nfs/dbraw/zinc/88/46/84/131884684.db2.gz ILXANKSRKPYFHW-UHFFFAOYSA-N 1 2 323.318 4.056 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1[C@H](C)C[C@@H](c2ccccc2)[C@H]1C ZINC000297197431 132003845 /nfs/dbraw/zinc/00/38/45/132003845.db2.gz XQIIWAGUPPAZID-QGPMSJSTSA-N 1 2 323.440 4.497 20 0 DIADLO CCC[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1ccc(F)cc1F ZINC000297557012 132022586 /nfs/dbraw/zinc/02/25/86/132022586.db2.gz FZKQFGOPZNOJIZ-RLCCDNCMSA-N 1 2 305.372 4.298 20 0 DIADLO CC[N@H+](Cc1cc(COC)on1)[C@H](C)c1cc2ccccc2o1 ZINC000297843895 132036851 /nfs/dbraw/zinc/03/68/51/132036851.db2.gz OCTMDJHYAZDEQI-CYBMUJFWSA-N 1 2 314.385 4.150 20 0 DIADLO CC[N@@H+](Cc1cc(COC)on1)[C@H](C)c1cc2ccccc2o1 ZINC000297843895 132036852 /nfs/dbraw/zinc/03/68/52/132036852.db2.gz OCTMDJHYAZDEQI-CYBMUJFWSA-N 1 2 314.385 4.150 20 0 DIADLO CC[N@H+](Cc1cc(COC)on1)[C@@H](C)c1cc2ccccc2o1 ZINC000297843901 132036936 /nfs/dbraw/zinc/03/69/36/132036936.db2.gz OCTMDJHYAZDEQI-ZDUSSCGKSA-N 1 2 314.385 4.150 20 0 DIADLO CC[N@@H+](Cc1cc(COC)on1)[C@@H](C)c1cc2ccccc2o1 ZINC000297843901 132036937 /nfs/dbraw/zinc/03/69/37/132036937.db2.gz OCTMDJHYAZDEQI-ZDUSSCGKSA-N 1 2 314.385 4.150 20 0 DIADLO COCc1cc(C[NH2+]Cc2ccc(-c3ccccc3)c(C)c2)no1 ZINC000298198520 132050278 /nfs/dbraw/zinc/05/02/78/132050278.db2.gz XPUYELXJWVZZFV-UHFFFAOYSA-N 1 2 322.408 4.086 20 0 DIADLO COCc1cc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)no1 ZINC000298427533 132061808 /nfs/dbraw/zinc/06/18/08/132061808.db2.gz MUJUGIQHBFKZPM-HNNXBMFYSA-N 1 2 322.408 4.339 20 0 DIADLO CCc1nnc(C[N@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000299350616 132100456 /nfs/dbraw/zinc/10/04/56/132100456.db2.gz CGYSNUBIQGEDEZ-SECBINFHSA-N 1 2 314.216 4.132 20 0 DIADLO CCc1nnc(C[N@@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000299350616 132100459 /nfs/dbraw/zinc/10/04/59/132100459.db2.gz CGYSNUBIQGEDEZ-SECBINFHSA-N 1 2 314.216 4.132 20 0 DIADLO CC(C)[N@H+](Cc1ccco1)Cc1nc2ccccc2n1C(F)F ZINC000299423043 132104456 /nfs/dbraw/zinc/10/44/56/132104456.db2.gz NYSOCITZIMFGDZ-UHFFFAOYSA-N 1 2 319.355 4.435 20 0 DIADLO CC(C)[N@@H+](Cc1ccco1)Cc1nc2ccccc2n1C(F)F ZINC000299423043 132104458 /nfs/dbraw/zinc/10/44/58/132104458.db2.gz NYSOCITZIMFGDZ-UHFFFAOYSA-N 1 2 319.355 4.435 20 0 DIADLO Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000164141472 132130232 /nfs/dbraw/zinc/13/02/32/132130232.db2.gz WQZLFQRVJZHWEY-GJZGRUSLSA-N 1 2 323.421 4.189 20 0 DIADLO FC(F)(F)c1ccc(CSc2[nH+]cc3ccccn32)nc1 ZINC000340666453 132135377 /nfs/dbraw/zinc/13/53/77/132135377.db2.gz TYZBKMHODOHUKY-UHFFFAOYSA-N 1 2 309.316 4.040 20 0 DIADLO Cc1cc(C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)ccc1F ZINC000340668218 132136338 /nfs/dbraw/zinc/13/63/38/132136338.db2.gz KASYUKGRYSQTRI-UHFFFAOYSA-N 1 2 323.371 4.151 20 0 DIADLO Cc1cnc(C[N@H+](Cc2ccccc2)Cc2ccc(F)cc2)nc1 ZINC000340678691 132145466 /nfs/dbraw/zinc/14/54/66/132145466.db2.gz XICIPXQEDVLGKU-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2ccccc2)Cc2ccc(F)cc2)nc1 ZINC000340678691 132145467 /nfs/dbraw/zinc/14/54/67/132145467.db2.gz XICIPXQEDVLGKU-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cnc(C[N@@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)nc1 ZINC000340692637 132157010 /nfs/dbraw/zinc/15/70/10/132157010.db2.gz MLIQYXMTOKFWFZ-HXUWFJFHSA-N 1 2 315.420 4.085 20 0 DIADLO Cc1cnc(C[N@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)nc1 ZINC000340692637 132157012 /nfs/dbraw/zinc/15/70/12/132157012.db2.gz MLIQYXMTOKFWFZ-HXUWFJFHSA-N 1 2 315.420 4.085 20 0 DIADLO Cc1cnc(C[N@H+](Cc2cc(F)ccc2F)C2CCCC2)nc1 ZINC000340693312 132157100 /nfs/dbraw/zinc/15/71/00/132157100.db2.gz FVJYPIIBUHHGQZ-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO Cc1cnc(C[N@@H+](Cc2cc(F)ccc2F)C2CCCC2)nc1 ZINC000340693312 132157101 /nfs/dbraw/zinc/15/71/01/132157101.db2.gz FVJYPIIBUHHGQZ-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO C[C@H]1CC=CC[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000340749480 132177398 /nfs/dbraw/zinc/17/73/98/132177398.db2.gz IAAZDFKQBAXPIA-GXTWGEPZSA-N 1 2 315.804 4.067 20 0 DIADLO Fc1ccc2[nH]c3c(c2c1)C[N@H+](C/C=C/c1ccccc1)CC3 ZINC000514099246 335067885 /nfs/dbraw/zinc/06/78/85/335067885.db2.gz KBZFUBNVYJLDFM-QPJJXVBHSA-N 1 2 306.384 4.379 20 0 DIADLO Fc1ccc2[nH]c3c(c2c1)C[N@@H+](C/C=C/c1ccccc1)CC3 ZINC000514099246 335067886 /nfs/dbraw/zinc/06/78/86/335067886.db2.gz KBZFUBNVYJLDFM-QPJJXVBHSA-N 1 2 306.384 4.379 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2c1cccc2Cl)c1nc(C(C)(C)C)no1 ZINC000194524596 335074615 /nfs/dbraw/zinc/07/46/15/335074615.db2.gz JQDUDHWNWOVLQQ-IINYFYTJSA-N 1 2 319.836 4.359 20 0 DIADLO C[C@H](CC1CCCCC1)NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000194625284 335081045 /nfs/dbraw/zinc/08/10/45/335081045.db2.gz LNYDIJPFIMCCPS-ZBFHGGJFSA-N 1 2 318.465 4.005 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccccc2-n2cccn2)nc(C2CC2)[nH+]1 ZINC000531589440 435102613 /nfs/dbraw/zinc/10/26/13/435102613.db2.gz IFKIPSPFOBFISD-AWEZNQCLSA-N 1 2 319.412 4.021 20 0 DIADLO CC(C)c1nc2[nH]ccc2c(N[C@H](CCCO)c2ccccc2)[nH+]1 ZINC000631127071 435400740 /nfs/dbraw/zinc/40/07/40/435400740.db2.gz ODIUWPFAJICJJB-MRXNPFEDSA-N 1 2 324.428 4.007 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCCn1cnc2ccccc21 ZINC000519041791 435666322 /nfs/dbraw/zinc/66/63/22/435666322.db2.gz DOHRQHCHMQNZIB-UHFFFAOYSA-N 1 2 302.381 4.005 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2ccccc2OC)c2ccco2)cc1 ZINC000575024438 332885366 /nfs/dbraw/zinc/88/53/66/332885366.db2.gz AXOPIBLMLVJPKW-HXUWFJFHSA-N 1 2 323.392 4.176 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)cc1O ZINC000180725632 331576558 /nfs/dbraw/zinc/57/65/58/331576558.db2.gz USBBOBMRVJGLCB-UHFFFAOYSA-N 1 2 320.348 4.140 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1csnn1 ZINC000398291740 331605111 /nfs/dbraw/zinc/60/51/11/331605111.db2.gz CMOIPCNVRIWUFW-JGVFFNPUSA-N 1 2 302.230 4.257 20 0 DIADLO O=C(C/C=C\c1ccccc1F)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000530924575 331636066 /nfs/dbraw/zinc/63/60/66/331636066.db2.gz KLZZWTTWPOOOGJ-HYXAFXHYSA-N 1 2 321.355 4.258 20 0 DIADLO CC[C@@H]1CCCC[C@H]1c1noc(-c2cc(-n3cc[nH+]c3)ccn2)n1 ZINC000556386093 331685924 /nfs/dbraw/zinc/68/59/24/331685924.db2.gz GTBZBFAOEJPJTG-UKRRQHHQSA-N 1 2 323.400 4.001 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2cc(C)ccc2s1)c1nccs1 ZINC000528439231 331688135 /nfs/dbraw/zinc/68/81/35/331688135.db2.gz GIOMPQTUNRMKDK-LLVKDONJSA-N 1 2 303.456 4.302 20 0 DIADLO CCOc1cc(NCc2c[nH+]c(C)n2-c2ccccc2)ccc1C ZINC000556408159 331701115 /nfs/dbraw/zinc/70/11/15/331701115.db2.gz XCFYUPMMNGIWGZ-UHFFFAOYSA-N 1 2 321.424 4.500 20 0 DIADLO Clc1cccc2c(N3CC[C@@H](C4CCOCC4)C3)cc[nH+]c12 ZINC000557643964 331805481 /nfs/dbraw/zinc/80/54/81/331805481.db2.gz MOVQNSBZPNZSMG-CQSZACIVSA-N 1 2 316.832 4.141 20 0 DIADLO Cc1cc(C)cc([C@H]2CCN(c3cc[nH+]c4ccncc43)C2)c1 ZINC000584136843 331841077 /nfs/dbraw/zinc/84/10/77/331841077.db2.gz SIINXXKCYSWHTJ-INIZCTEOSA-N 1 2 303.409 4.241 20 0 DIADLO C[C@@H](CC(=O)N1C[C@H](C(C)(C)C)c2ccccc21)n1cc[nH+]c1 ZINC000521051492 331971309 /nfs/dbraw/zinc/97/13/09/331971309.db2.gz DBUHXPVJDRQUGN-HOCLYGCPSA-N 1 2 311.429 4.011 20 0 DIADLO CSCc1cnc(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)s1 ZINC000559246220 332002179 /nfs/dbraw/zinc/00/21/79/332002179.db2.gz YFALPADLOBOTMZ-MFKMUULPSA-N 1 2 308.472 4.012 20 0 DIADLO CCc1cc(N(C)Cc2ccc(C)cc2)nc(-c2ccncc2)[nH+]1 ZINC000518298857 332008931 /nfs/dbraw/zinc/00/89/31/332008931.db2.gz ZZIZIYZMDOVXLA-UHFFFAOYSA-N 1 2 318.424 4.046 20 0 DIADLO CCCCOc1ccc(C[NH2+]CC(C)(F)F)cc1OCC ZINC000559323010 332025715 /nfs/dbraw/zinc/02/57/15/332025715.db2.gz PCZKZLDCDSQKGL-UHFFFAOYSA-N 1 2 301.377 4.009 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ncc(C(C)(C)C)o2)cc1 ZINC000409447061 332031125 /nfs/dbraw/zinc/03/11/25/332031125.db2.gz ODYFZWHJKOHKKN-UHFFFAOYSA-N 1 2 302.418 4.003 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ncc(C(C)(C)C)o2)cc1 ZINC000409447061 332031127 /nfs/dbraw/zinc/03/11/27/332031127.db2.gz ODYFZWHJKOHKKN-UHFFFAOYSA-N 1 2 302.418 4.003 20 0 DIADLO CC(C)(CC(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccccc1 ZINC000520046694 332044890 /nfs/dbraw/zinc/04/48/90/332044890.db2.gz FMKUBFVPCFVOTP-UHFFFAOYSA-N 1 2 319.408 4.179 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3cccc(OC)c3)cc2[nH+]1 ZINC000409718410 332049713 /nfs/dbraw/zinc/04/97/13/332049713.db2.gz FXTMHDRSJJUOFL-UHFFFAOYSA-N 1 2 323.396 4.166 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3ccccc3F)cc2[nH+]1 ZINC000409718186 332049760 /nfs/dbraw/zinc/04/97/60/332049760.db2.gz FVHGAKZLRCOIDH-UHFFFAOYSA-N 1 2 311.360 4.297 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3ccccc3C)cc2[nH+]1 ZINC000409721849 332051332 /nfs/dbraw/zinc/05/13/32/332051332.db2.gz RHUHUFXWKKCWAR-UHFFFAOYSA-N 1 2 307.397 4.466 20 0 DIADLO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000559351133 332060047 /nfs/dbraw/zinc/06/00/47/332060047.db2.gz ZBSBBIPQXYJOFO-NWDGAFQWSA-N 1 2 322.861 4.216 20 0 DIADLO C[C@@H]1[C@@H](C)C[N@H+]1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000559351133 332060048 /nfs/dbraw/zinc/06/00/48/332060048.db2.gz ZBSBBIPQXYJOFO-NWDGAFQWSA-N 1 2 322.861 4.216 20 0 DIADLO COc1cccc(C[N@@H+]2CCC[C@H]2c2nc3ccc(C)cc3[nH]2)c1 ZINC000569391412 332074350 /nfs/dbraw/zinc/07/43/50/332074350.db2.gz LMARVLXZQUVKRD-IBGZPJMESA-N 1 2 321.424 4.217 20 0 DIADLO COc1cccc(C[N@H+]2CCC[C@H]2c2nc3ccc(C)cc3[nH]2)c1 ZINC000569391412 332074351 /nfs/dbraw/zinc/07/43/51/332074351.db2.gz LMARVLXZQUVKRD-IBGZPJMESA-N 1 2 321.424 4.217 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(C(F)(F)F)s2)[C@H]1[C@H]1CCCO1 ZINC000569399045 332074724 /nfs/dbraw/zinc/07/47/24/332074724.db2.gz AWYAYABGSDAMGA-YPMHNXCESA-N 1 2 319.392 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(C(F)(F)F)s2)[C@H]1[C@H]1CCCO1 ZINC000569399045 332074725 /nfs/dbraw/zinc/07/47/25/332074725.db2.gz AWYAYABGSDAMGA-YPMHNXCESA-N 1 2 319.392 4.156 20 0 DIADLO C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)[N@H+]1Cc1ncc(Cl)s1 ZINC000449365321 332077302 /nfs/dbraw/zinc/07/73/02/332077302.db2.gz TTZCKLHDXHMCLK-DJLDLDEBSA-N 1 2 312.788 4.348 20 0 DIADLO C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)[N@@H+]1Cc1ncc(Cl)s1 ZINC000449365321 332077303 /nfs/dbraw/zinc/07/73/03/332077303.db2.gz TTZCKLHDXHMCLK-DJLDLDEBSA-N 1 2 312.788 4.348 20 0 DIADLO CCCc1ccc(C(=O)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC000518631366 332100892 /nfs/dbraw/zinc/10/08/92/332100892.db2.gz OSWHPDZXKFIWOR-UHFFFAOYSA-N 1 2 305.381 4.077 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1csc(Nc2ccccc2)n1 ZINC000091703640 332110735 /nfs/dbraw/zinc/11/07/35/332110735.db2.gz TVCCLCXMOYQFQT-AWEZNQCLSA-N 1 2 324.453 4.475 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1csc(Nc2ccccc2)n1 ZINC000091703640 332110736 /nfs/dbraw/zinc/11/07/36/332110736.db2.gz TVCCLCXMOYQFQT-AWEZNQCLSA-N 1 2 324.453 4.475 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(-c3ccc(F)cc3C)o2)no1 ZINC000092254340 332121675 /nfs/dbraw/zinc/12/16/75/332121675.db2.gz IGAHHKRDVOUYMK-UHFFFAOYSA-N 1 2 314.360 4.323 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(-c3ccc(F)cc3C)o2)no1 ZINC000092254340 332121676 /nfs/dbraw/zinc/12/16/76/332121676.db2.gz IGAHHKRDVOUYMK-UHFFFAOYSA-N 1 2 314.360 4.323 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(OCCC(C)C)cc2)no1 ZINC000092254590 332123169 /nfs/dbraw/zinc/12/31/69/332123169.db2.gz BWQNLZUPKKKEQO-UHFFFAOYSA-N 1 2 302.418 4.040 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(OCCC(C)C)cc2)no1 ZINC000092254590 332123170 /nfs/dbraw/zinc/12/31/70/332123170.db2.gz BWQNLZUPKKKEQO-UHFFFAOYSA-N 1 2 302.418 4.040 20 0 DIADLO CCn1ccnc1C[NH2+][C@@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000569533343 332127570 /nfs/dbraw/zinc/12/75/70/332127570.db2.gz FPFFPCZNHOIICI-MRXNPFEDSA-N 1 2 324.255 4.451 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+]2CCO[C@H](c3cccs3)C2)o1 ZINC000092594242 332134448 /nfs/dbraw/zinc/13/44/48/332134448.db2.gz PMHJZDMXGGZRNA-XPKDYRNWSA-N 1 2 303.427 4.038 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+]2CCO[C@H](c3cccs3)C2)o1 ZINC000092594242 332134450 /nfs/dbraw/zinc/13/44/50/332134450.db2.gz PMHJZDMXGGZRNA-XPKDYRNWSA-N 1 2 303.427 4.038 20 0 DIADLO CC(C)(C)Cc1nc2cc(N[C@@H]3CCn4cc[nH+]c43)ccc2o1 ZINC000569559571 332137844 /nfs/dbraw/zinc/13/78/44/332137844.db2.gz UWGWVBYROLLUNM-CYBMUJFWSA-N 1 2 310.401 4.170 20 0 DIADLO CCC[N@@H+](Cc1cccc(OCc2ccccn2)c1)CC(F)F ZINC000092737597 332140732 /nfs/dbraw/zinc/14/07/32/332140732.db2.gz NKNDDEDEJOHPFM-UHFFFAOYSA-N 1 2 320.383 4.138 20 0 DIADLO CCC[N@H+](Cc1cccc(OCc2ccccn2)c1)CC(F)F ZINC000092737597 332140734 /nfs/dbraw/zinc/14/07/34/332140734.db2.gz NKNDDEDEJOHPFM-UHFFFAOYSA-N 1 2 320.383 4.138 20 0 DIADLO CCOc1cc(C)ccc1[NH2+][C@@H]1CCC[C@@H](c2ccnn2C)C1 ZINC000448020626 332178993 /nfs/dbraw/zinc/17/89/93/332178993.db2.gz CZXLDUKAQIZLLK-HZPDHXFCSA-N 1 2 313.445 4.266 20 0 DIADLO CCc1nc(C)c(C[N@H+]2CC=C(c3c(F)cccc3F)CC2)o1 ZINC000428426409 332191277 /nfs/dbraw/zinc/19/12/77/332191277.db2.gz OKRVNGYAFUCQAX-UHFFFAOYSA-N 1 2 318.367 4.113 20 0 DIADLO CCc1nc(C)c(C[N@@H+]2CC=C(c3c(F)cccc3F)CC2)o1 ZINC000428426409 332191278 /nfs/dbraw/zinc/19/12/78/332191278.db2.gz OKRVNGYAFUCQAX-UHFFFAOYSA-N 1 2 318.367 4.113 20 0 DIADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1cccn1C1CCCC1 ZINC000181514695 332197520 /nfs/dbraw/zinc/19/75/20/332197520.db2.gz CLZCIQNEKCRHAY-UHFFFAOYSA-N 1 2 320.396 4.246 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2oc(C(C)C)nc2C)cs1 ZINC000428432175 332198419 /nfs/dbraw/zinc/19/84/19/332198419.db2.gz XRMXQKYIDXBDGY-CQSZACIVSA-N 1 2 305.447 4.208 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2oc(C(C)C)nc2C)cs1 ZINC000428432175 332198421 /nfs/dbraw/zinc/19/84/21/332198421.db2.gz XRMXQKYIDXBDGY-CQSZACIVSA-N 1 2 305.447 4.208 20 0 DIADLO C[N@@H+]1Cc2cccc(NC(=O)c3cccc(C(C)(C)C)c3)c2C1 ZINC000584301023 332228900 /nfs/dbraw/zinc/22/89/00/332228900.db2.gz HWLOFUZLMSISHA-UHFFFAOYSA-N 1 2 308.425 4.182 20 0 DIADLO C[N@H+]1Cc2cccc(NC(=O)c3cccc(C(C)(C)C)c3)c2C1 ZINC000584301023 332228902 /nfs/dbraw/zinc/22/89/02/332228902.db2.gz HWLOFUZLMSISHA-UHFFFAOYSA-N 1 2 308.425 4.182 20 0 DIADLO CCCCc1nc(COc2cc(CC)[nH+]c3ccccc32)no1 ZINC000536425147 332242575 /nfs/dbraw/zinc/24/25/75/332242575.db2.gz ASADZXKSHDJAPL-UHFFFAOYSA-N 1 2 311.385 4.102 20 0 DIADLO FC(F)Oc1ccccc1C[N@@H+]1CCC[C@@H]1c1nccs1 ZINC000370792552 332252703 /nfs/dbraw/zinc/25/27/03/332252703.db2.gz LVXNOPARAOHJSW-GFCCVEGCSA-N 1 2 310.369 4.082 20 0 DIADLO FC(F)Oc1ccccc1C[N@H+]1CCC[C@@H]1c1nccs1 ZINC000370792552 332252704 /nfs/dbraw/zinc/25/27/04/332252704.db2.gz LVXNOPARAOHJSW-GFCCVEGCSA-N 1 2 310.369 4.082 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@@H](Oc1cccc(Cl)c1)C(C)C ZINC000094124927 332265765 /nfs/dbraw/zinc/26/57/65/332265765.db2.gz NUZDQEBROIFVOZ-INIZCTEOSA-N 1 2 318.804 4.086 20 0 DIADLO CCCC[C@@H](CCC)C[NH2+][C@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000559774793 332279956 /nfs/dbraw/zinc/27/99/56/332279956.db2.gz YTCOVPCLJKFSHX-PBHICJAKSA-N 1 2 318.440 4.229 20 0 DIADLO Cc1ccc2[nH+]c(CNCc3c(Cl)cccc3Cl)cn2c1 ZINC000560048505 332305980 /nfs/dbraw/zinc/30/59/80/332305980.db2.gz LIXUKJOLMWNGFL-UHFFFAOYSA-N 1 2 320.223 4.239 20 0 DIADLO Cc1ccc2nc(C[NH2+]Cc3c(Cl)cccc3Cl)cn2c1 ZINC000560048505 332305981 /nfs/dbraw/zinc/30/59/81/332305981.db2.gz LIXUKJOLMWNGFL-UHFFFAOYSA-N 1 2 320.223 4.239 20 0 DIADLO Cc1cccc(OCCCC(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000097040078 332313483 /nfs/dbraw/zinc/31/34/83/332313483.db2.gz OEBGNOIVRSLKDL-UHFFFAOYSA-N 1 2 312.413 4.113 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(C3CC3)n2)CC[C@@H]1C(F)(F)F ZINC000191662679 332313906 /nfs/dbraw/zinc/31/39/06/332313906.db2.gz GTNOZVLTFDDKTB-LBPRGKRZSA-N 1 2 318.408 4.431 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(C3CC3)n2)CC[C@@H]1C(F)(F)F ZINC000191662679 332313907 /nfs/dbraw/zinc/31/39/07/332313907.db2.gz GTNOZVLTFDDKTB-LBPRGKRZSA-N 1 2 318.408 4.431 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@@H](C)Cc3ccc(O)cc3)cc2)c1C ZINC000560533267 332353717 /nfs/dbraw/zinc/35/37/17/332353717.db2.gz AGZCNSHFYBJAGR-AWEZNQCLSA-N 1 2 321.424 4.238 20 0 DIADLO CC(F)(F)c1ccc(C[NH2+]Cc2c(F)ccc(O)c2F)cc1 ZINC000560565628 332360269 /nfs/dbraw/zinc/36/02/69/332360269.db2.gz WKHFQOJDERMJSL-UHFFFAOYSA-N 1 2 313.294 4.072 20 0 DIADLO CCCCc1noc(C[N@H+](Cc2ccc(C)c(C)c2)C2CC2)n1 ZINC000097493585 332363200 /nfs/dbraw/zinc/36/32/00/332363200.db2.gz MHLJVYIXXJMQGP-UHFFFAOYSA-N 1 2 313.445 4.194 20 0 DIADLO CCCCc1noc(C[N@@H+](Cc2ccc(C)c(C)c2)C2CC2)n1 ZINC000097493585 332363202 /nfs/dbraw/zinc/36/32/02/332363202.db2.gz MHLJVYIXXJMQGP-UHFFFAOYSA-N 1 2 313.445 4.194 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)Sc1ccccc1Cl ZINC000425589479 335108065 /nfs/dbraw/zinc/10/80/65/335108065.db2.gz SRMKPZQXAUDWQC-GFCCVEGCSA-N 1 2 320.845 4.471 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2csc(Cl)c2Cl)c2nccn21 ZINC000449568591 332422664 /nfs/dbraw/zinc/42/26/64/332422664.db2.gz BRNPTZSRPIZOTP-VXNVDRBHSA-N 1 2 302.230 4.047 20 0 DIADLO CC(C)[C@H]1C[C@H]1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000425580842 335106395 /nfs/dbraw/zinc/10/63/95/335106395.db2.gz YRXHJTKTQOONRU-IAGOWNOFSA-N 1 2 323.440 4.117 20 0 DIADLO CC(C)=CCOc1cccc(C(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000425584820 335106905 /nfs/dbraw/zinc/10/69/05/335106905.db2.gz FTDIIBVKCPCQHY-UHFFFAOYSA-N 1 2 310.397 4.296 20 0 DIADLO CCS(=O)(=O)Nc1ccc([NH2+][C@H]2CCC[C@@H](C(C)C)C2)cc1 ZINC000317903182 332550137 /nfs/dbraw/zinc/55/01/37/332550137.db2.gz SJBHFHFMIGECKJ-PBHICJAKSA-N 1 2 324.490 4.075 20 0 DIADLO c1ccc([C@@H]([NH2+][C@@H]2COCc3ccccc32)c2ccccn2)cc1 ZINC000428216047 332557941 /nfs/dbraw/zinc/55/79/41/332557941.db2.gz BFDJEPFACLFTCD-NHCUHLMSSA-N 1 2 316.404 4.032 20 0 DIADLO CC[C@@H]([NH2+][C@@H](c1nccn1C)c1ccccc1)c1ccsc1 ZINC000562774803 332624687 /nfs/dbraw/zinc/62/46/87/332624687.db2.gz IAJZBWDRKMEREN-IAGOWNOFSA-N 1 2 311.454 4.312 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@H](c2ccccc2)C(C)C)n1 ZINC000136295012 332629202 /nfs/dbraw/zinc/62/92/02/332629202.db2.gz XLAUJLQAFVRMQM-CJNGLKHVSA-N 1 2 319.474 4.371 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1)c1noc(-c2ccccc2)n1 ZINC000569684738 332659654 /nfs/dbraw/zinc/65/96/54/332659654.db2.gz ILZDIXZVSYEQPS-CQSZACIVSA-N 1 2 319.408 4.465 20 0 DIADLO Cc1c(Cl)c(C[NH+]2CC(C(F)(F)F)C2)nc2ccccc12 ZINC000569766445 332677519 /nfs/dbraw/zinc/67/75/19/332677519.db2.gz FLQUURRGTCFDRJ-UHFFFAOYSA-N 1 2 314.738 4.191 20 0 DIADLO O=C(C[C@@H]1C=CCC1)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000569950959 332696141 /nfs/dbraw/zinc/69/61/41/332696141.db2.gz QUMSLHKFKBYTEC-OAHLLOKOSA-N 1 2 321.424 4.181 20 0 DIADLO CCC1(CNC(=O)c2ccc(C)c(Oc3cc[nH+]cc3)c2)CC1 ZINC000178177491 333003605 /nfs/dbraw/zinc/00/36/05/333003605.db2.gz IHZLFCFCHGKIOZ-UHFFFAOYSA-N 1 2 310.397 4.102 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C)[C@@H](C)c3ccc(C)cc3C)ccn12 ZINC000580213497 333013176 /nfs/dbraw/zinc/01/31/76/333013176.db2.gz RVIIVWJIBYKWRM-INIZCTEOSA-N 1 2 321.424 4.093 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@H](C)C(=O)Nc1ccc(C)cc1Cl ZINC000178725017 333018811 /nfs/dbraw/zinc/01/88/11/333018811.db2.gz YKDCCDXOYKQRDT-GFCCVEGCSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1occc1C[N@H+](C)[C@H](C)C(=O)Nc1ccc(C)cc1Cl ZINC000178725017 333018812 /nfs/dbraw/zinc/01/88/12/333018812.db2.gz YKDCCDXOYKQRDT-GFCCVEGCSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(Cl)cc1C ZINC000178724048 333018869 /nfs/dbraw/zinc/01/88/69/333018869.db2.gz PGLOCWSWUIOAEH-LBPRGKRZSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1occc1C[N@H+](C)[C@@H](C)C(=O)Nc1ccc(Cl)cc1C ZINC000178724048 333018870 /nfs/dbraw/zinc/01/88/70/333018870.db2.gz PGLOCWSWUIOAEH-LBPRGKRZSA-N 1 2 320.820 4.009 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@H](C)c2ccc(C)c(F)c2)n1 ZINC000181338425 333030100 /nfs/dbraw/zinc/03/01/00/333030100.db2.gz NKTJEACXDSDAHE-VXGBXAGGSA-N 1 2 323.437 4.182 20 0 DIADLO COC(=O)c1sccc1C[N@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000378665946 333042828 /nfs/dbraw/zinc/04/28/28/333042828.db2.gz JLUDTQGRUJNULJ-NSHDSACASA-N 1 2 323.845 4.381 20 0 DIADLO COC(=O)c1sccc1C[N@@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000378665946 333042829 /nfs/dbraw/zinc/04/28/29/333042829.db2.gz JLUDTQGRUJNULJ-NSHDSACASA-N 1 2 323.845 4.381 20 0 DIADLO CC(C)c1ccc(CN(C)C(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC000580262255 333044164 /nfs/dbraw/zinc/04/41/64/333044164.db2.gz QUTSIICGSWXZHK-UHFFFAOYSA-N 1 2 322.412 4.122 20 0 DIADLO Cc1[nH]c2ccc(CSc3nnc(-c4ccccc4)o3)cc2[nH+]1 ZINC000460418922 333082899 /nfs/dbraw/zinc/08/28/99/333082899.db2.gz BAOZHQKMQXJMQN-UHFFFAOYSA-N 1 2 322.393 4.214 20 0 DIADLO Cc1[nH]c2cc(CSc3nnc(-c4ccccc4)o3)ccc2[nH+]1 ZINC000460418922 333082900 /nfs/dbraw/zinc/08/29/00/333082900.db2.gz BAOZHQKMQXJMQN-UHFFFAOYSA-N 1 2 322.393 4.214 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(C[C@@H]2CC[C@@H](C)C2)n1 ZINC000460745349 333132637 /nfs/dbraw/zinc/13/26/37/333132637.db2.gz HNXNDICPQPILRD-ZIAGYGMSSA-N 1 2 324.428 4.009 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(C[C@H]2CC[C@@H](C)C2)n1 ZINC000460745347 333132683 /nfs/dbraw/zinc/13/26/83/333132683.db2.gz HNXNDICPQPILRD-KGLIPLIRSA-N 1 2 324.428 4.009 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(-c2ccccc2C)n1 ZINC000460746839 333133142 /nfs/dbraw/zinc/13/31/42/333133142.db2.gz JTXBVLTUTQTWTB-UHFFFAOYSA-N 1 2 318.380 4.005 20 0 DIADLO Cc1ncc(C[N@H+](Cc2ccccn2)Cc2ccccc2C)s1 ZINC000518777870 333162615 /nfs/dbraw/zinc/16/26/15/333162615.db2.gz AVLRYCYHRCYWBP-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2ccccn2)Cc2ccccc2C)s1 ZINC000518777870 333162616 /nfs/dbraw/zinc/16/26/16/333162616.db2.gz AVLRYCYHRCYWBP-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO CCn1c[nH+]cc1CN1Cc2ccccc2-c2ccccc2C1 ZINC000417763462 335126158 /nfs/dbraw/zinc/12/61/58/335126158.db2.gz KOSSWOCLGCAJBI-UHFFFAOYSA-N 1 2 303.409 4.086 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCCS[C@@H]1CCO[C@@H]1C ZINC000460868090 333178906 /nfs/dbraw/zinc/17/89/06/333178906.db2.gz AMWAYKKFKKAJTA-RDTXWAMCSA-N 1 2 318.486 4.426 20 0 DIADLO Fc1cccc2c1CC[C@@H]2[NH2+]Cc1ncc(-c2ccccc2)cn1 ZINC000461094543 333179523 /nfs/dbraw/zinc/17/95/23/333179523.db2.gz UVLMHPYTIUXQSR-IBGZPJMESA-N 1 2 319.383 4.060 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+](C)Cc1ccc(F)cc1 ZINC000216248772 333183365 /nfs/dbraw/zinc/18/33/65/333183365.db2.gz VCNBSLQKECZXOF-UHFFFAOYSA-N 1 2 315.388 4.059 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+](C)Cc1ccc(F)cc1 ZINC000216248772 333183366 /nfs/dbraw/zinc/18/33/66/333183366.db2.gz VCNBSLQKECZXOF-UHFFFAOYSA-N 1 2 315.388 4.059 20 0 DIADLO CC[C@@H](NC(=O)c1cc2c(s1)CCCCCC2)c1[nH]cc[nH+]1 ZINC000318589461 333191403 /nfs/dbraw/zinc/19/14/03/333191403.db2.gz LSEGRULDIDAOJZ-CYBMUJFWSA-N 1 2 317.458 4.011 20 0 DIADLO CCOc1cc(Cl)ccc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000182509536 335128059 /nfs/dbraw/zinc/12/80/59/335128059.db2.gz SZLISNBWBXBSIF-UHFFFAOYSA-N 1 2 318.804 4.311 20 0 DIADLO CC1(C)CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2Cl)C1 ZINC000497406610 333247228 /nfs/dbraw/zinc/24/72/28/333247228.db2.gz HKSDFADNYWKBPN-UHFFFAOYSA-N 1 2 315.244 4.054 20 0 DIADLO CC1(C)CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2Cl)C1 ZINC000497406610 333247229 /nfs/dbraw/zinc/24/72/29/333247229.db2.gz HKSDFADNYWKBPN-UHFFFAOYSA-N 1 2 315.244 4.054 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000497590687 333266150 /nfs/dbraw/zinc/26/61/50/333266150.db2.gz LZJVQJBVUADJEQ-XIKOKIGWSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000497590687 333266151 /nfs/dbraw/zinc/26/61/51/333266151.db2.gz LZJVQJBVUADJEQ-XIKOKIGWSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000497590512 333266161 /nfs/dbraw/zinc/26/61/61/333266161.db2.gz IRSLCDMLYNZWHI-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000497590512 333266162 /nfs/dbraw/zinc/26/61/62/333266162.db2.gz IRSLCDMLYNZWHI-SCLBCKFNSA-N 1 2 303.352 4.099 20 0 DIADLO Cc1cccc(N2CC[NH+]([C@@H](C)c3ccc(F)cc3F)CC2)c1 ZINC000497585019 333266386 /nfs/dbraw/zinc/26/63/86/333266386.db2.gz LHAYNIMLZPYVAC-HNNXBMFYSA-N 1 2 316.395 4.156 20 0 DIADLO COC1CCC([NH2+]c2ccc(N3C[C@H]4CC[C@@H]3C4)cc2)CC1 ZINC000190303428 333269759 /nfs/dbraw/zinc/26/97/59/333269759.db2.gz JYZZGWSPDGNLLH-ZUKISOHSSA-N 1 2 300.446 4.045 20 0 DIADLO COC1CCC(Nc2ccc([N@@H+]3C[C@H]4CC[C@@H]3C4)cc2)CC1 ZINC000190303428 333269760 /nfs/dbraw/zinc/26/97/60/333269760.db2.gz JYZZGWSPDGNLLH-ZUKISOHSSA-N 1 2 300.446 4.045 20 0 DIADLO COC1CCC(Nc2ccc([N@H+]3C[C@H]4CC[C@@H]3C4)cc2)CC1 ZINC000190303428 333269761 /nfs/dbraw/zinc/26/97/61/333269761.db2.gz JYZZGWSPDGNLLH-ZUKISOHSSA-N 1 2 300.446 4.045 20 0 DIADLO Cc1ccc([C@H]2CCCCCN2C(=O)Nc2cc[nH+]c(C)c2)o1 ZINC000120152248 333275581 /nfs/dbraw/zinc/27/55/81/333275581.db2.gz ZERBZKGQPPVKBV-MRXNPFEDSA-N 1 2 313.401 4.441 20 0 DIADLO COc1ccccc1[C@@H](C)Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000390410134 333278365 /nfs/dbraw/zinc/27/83/65/333278365.db2.gz KVSJESLGSBSYHP-OAHLLOKOSA-N 1 2 311.429 4.254 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC000525781678 333306547 /nfs/dbraw/zinc/30/65/47/333306547.db2.gz NJDLXPHMCYUVSB-LJQANCHMSA-N 1 2 311.425 4.047 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC000525781678 333306548 /nfs/dbraw/zinc/30/65/48/333306548.db2.gz NJDLXPHMCYUVSB-LJQANCHMSA-N 1 2 311.425 4.047 20 0 DIADLO CCc1cnc(C[N@H+](C)[C@@H](C)c2ccc(C(F)(F)F)cc2)o1 ZINC000525782252 333307058 /nfs/dbraw/zinc/30/70/58/333307058.db2.gz XGYOATBYRYKFBD-NSHDSACASA-N 1 2 312.335 4.449 20 0 DIADLO CCc1cnc(C[N@@H+](C)[C@@H](C)c2ccc(C(F)(F)F)cc2)o1 ZINC000525782252 333307060 /nfs/dbraw/zinc/30/70/60/333307060.db2.gz XGYOATBYRYKFBD-NSHDSACASA-N 1 2 312.335 4.449 20 0 DIADLO CSc1cc(C[NH2+][C@H](CCc2ccccc2)C(F)F)ccn1 ZINC000498918786 333318835 /nfs/dbraw/zinc/31/88/35/333318835.db2.gz RTUIUSQLFWYJIL-OAHLLOKOSA-N 1 2 322.424 4.160 20 0 DIADLO CCCCN(C(=O)CCc1[nH]cc[nH+]1)[C@@H](CC)c1ccccc1 ZINC000498012696 333320759 /nfs/dbraw/zinc/32/07/59/333320759.db2.gz MEEJNVZXNZTVFS-KRWDZBQOSA-N 1 2 313.445 4.122 20 0 DIADLO CC[C@H]1C[N@H+](Cc2nnsc2Cl)CC[C@H]1c1ccccc1 ZINC000531339895 333344674 /nfs/dbraw/zinc/34/46/74/333344674.db2.gz BZUNJYHBPLVRCD-GXTWGEPZSA-N 1 2 321.877 4.207 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2nnsc2Cl)CC[C@H]1c1ccccc1 ZINC000531339895 333344676 /nfs/dbraw/zinc/34/46/76/333344676.db2.gz BZUNJYHBPLVRCD-GXTWGEPZSA-N 1 2 321.877 4.207 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2nnsc2Cl)CC[C@H]1c1ccccc1 ZINC000531339910 333344742 /nfs/dbraw/zinc/34/47/42/333344742.db2.gz BZUNJYHBPLVRCD-TZMCWYRMSA-N 1 2 321.877 4.207 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2nnsc2Cl)CC[C@H]1c1ccccc1 ZINC000531339910 333344743 /nfs/dbraw/zinc/34/47/43/333344743.db2.gz BZUNJYHBPLVRCD-TZMCWYRMSA-N 1 2 321.877 4.207 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccn(-c3ccccc3)n2)[C@H]1c1ccccc1 ZINC000531378335 333347487 /nfs/dbraw/zinc/34/74/87/333347487.db2.gz FXMHRFURAHDNIH-OXJNMPFZSA-N 1 2 303.409 4.065 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccn(-c3ccccc3)n2)[C@H]1c1ccccc1 ZINC000531378335 333347488 /nfs/dbraw/zinc/34/74/88/333347488.db2.gz FXMHRFURAHDNIH-OXJNMPFZSA-N 1 2 303.409 4.065 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC[C@H]2c2ccccn2)cs1 ZINC000531440546 333353613 /nfs/dbraw/zinc/35/36/13/333353613.db2.gz MXTOYGNFRYUAND-KRWDZBQOSA-N 1 2 315.486 4.464 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC[C@H]2c2ccccn2)cs1 ZINC000531440546 333353615 /nfs/dbraw/zinc/35/36/15/333353615.db2.gz MXTOYGNFRYUAND-KRWDZBQOSA-N 1 2 315.486 4.464 20 0 DIADLO O[C@]1(CNc2ccc3ccccc3[nH+]2)CCC[C@H](C(F)(F)F)C1 ZINC000186727413 333377340 /nfs/dbraw/zinc/37/73/40/333377340.db2.gz MFKRDWCEVCMSIJ-XJKSGUPXSA-N 1 2 324.346 4.130 20 0 DIADLO COc1cc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)ccc1F ZINC000186745794 333377869 /nfs/dbraw/zinc/37/78/69/333377869.db2.gz MGPUIQCTYXXASV-CYBMUJFWSA-N 1 2 311.360 4.193 20 0 DIADLO c1cn(Cc2cccc(-c3noc(C4CC5(CCC5)C4)n3)c2)c[nH+]1 ZINC000563123074 333393938 /nfs/dbraw/zinc/39/39/38/333393938.db2.gz PIHYGNKITZDTRA-UHFFFAOYSA-N 1 2 320.396 4.029 20 0 DIADLO COc1ccc(C)cc1[C@H](C)Nc1ccc(N2CCCC2)[nH+]c1 ZINC000319662950 333394110 /nfs/dbraw/zinc/39/41/10/333394110.db2.gz GXIBFPWSFDBWJU-HNNXBMFYSA-N 1 2 311.429 4.172 20 0 DIADLO CO[C@@H](C)c1nc(CSCCc2cccc(C)[nH+]2)cs1 ZINC000563142958 333396466 /nfs/dbraw/zinc/39/64/66/333396466.db2.gz SMOYRHSGWWEZON-LBPRGKRZSA-N 1 2 308.472 4.030 20 0 DIADLO Cc1cc(NC(=O)Cc2ccc(-c3ccccc3)cc2)cc[nH+]1 ZINC000010163107 333443943 /nfs/dbraw/zinc/44/39/43/333443943.db2.gz MBFRKRSEJMWTAE-UHFFFAOYSA-N 1 2 302.377 4.238 20 0 DIADLO Fc1ccc(Cl)cc1C[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000430024489 333709059 /nfs/dbraw/zinc/70/90/59/333709059.db2.gz IMSLELRVMOPTBN-UHFFFAOYSA-N 1 2 321.676 4.325 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C(C)(C)CC(F)F ZINC000412301842 333745590 /nfs/dbraw/zinc/74/55/90/333745590.db2.gz CASNBEAVNWFTDC-UHFFFAOYSA-N 1 2 307.344 4.005 20 0 DIADLO CC(C)[C@@H](C)S[C@H](C)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000412999891 333824702 /nfs/dbraw/zinc/82/47/02/333824702.db2.gz NRAJENCQCPRAAF-CHWSQXEVSA-N 1 2 317.458 4.181 20 0 DIADLO Cc1ccc([C@@H]([NH2+][C@H](C)c2ccn(C)n2)c2ccccc2)cc1 ZINC000414060655 333889163 /nfs/dbraw/zinc/88/91/63/333889163.db2.gz YBMBNSNXUZDBFN-UZLBHIALSA-N 1 2 305.425 4.169 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1cc2n(n1)CCC2 ZINC000414089528 333894218 /nfs/dbraw/zinc/89/42/18/333894218.db2.gz JYUPCLMSBLSAEA-MRVPVSSYSA-N 1 2 316.257 4.048 20 0 DIADLO C[C@H]([NH2+]C1(c2c(Cl)cccc2Cl)CCC1)c1ccn(C)n1 ZINC000414122819 333898364 /nfs/dbraw/zinc/89/83/64/333898364.db2.gz BBMRXFJDWIDZCQ-NSHDSACASA-N 1 2 324.255 4.457 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCC[S@@](=O)CC(C)(C)C ZINC000414247522 333919876 /nfs/dbraw/zinc/91/98/76/333919876.db2.gz UEJWSQOCRSYAJY-JOCHJYFZSA-N 1 2 320.502 4.310 20 0 DIADLO CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1csnn1)CCC2 ZINC000414305247 333943978 /nfs/dbraw/zinc/94/39/78/333943978.db2.gz PUEAENVSDXVTHN-LRDDRELGSA-N 1 2 301.459 4.390 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(C(F)(F)F)c(C)c2)s1 ZINC000414425482 333970061 /nfs/dbraw/zinc/97/00/61/333970061.db2.gz AEHQKLQGXXFLPE-VIFPVBQESA-N 1 2 315.364 4.025 20 0 DIADLO Cc1ccc(C[NH2+]C2(c3c(Cl)cccc3Cl)CCC2)nn1 ZINC000414449341 333981465 /nfs/dbraw/zinc/98/14/65/333981465.db2.gz UKPIAVRUSREPPH-UHFFFAOYSA-N 1 2 322.239 4.261 20 0 DIADLO Cc1ccc(NC(=O)N(Cc2cccc(F)c2)C(C)C)c(C)[nH+]1 ZINC000267994985 333988388 /nfs/dbraw/zinc/98/83/88/333988388.db2.gz AMZVHVLTTJEKES-UHFFFAOYSA-N 1 2 315.392 4.280 20 0 DIADLO CCN(CC)c1ccc(N[C@@H](c2cncc(F)c2)C2CC2)c[nH+]1 ZINC000343491366 335169117 /nfs/dbraw/zinc/16/91/17/335169117.db2.gz POPHBBAGLQUSOD-GOSISDBHSA-N 1 2 314.408 4.025 20 0 DIADLO F[C@@H]1CCCC[C@H]1[NH2+]Cc1csc(COc2ccccc2)n1 ZINC000414510851 334002805 /nfs/dbraw/zinc/00/28/05/334002805.db2.gz JAXAXANZRFQZAH-HZPDHXFCSA-N 1 2 320.433 4.092 20 0 DIADLO Clc1ccc(C[NH2+]Cc2nnc(C3CC3)s2)cc1Cl ZINC000414559605 334017893 /nfs/dbraw/zinc/01/78/93/334017893.db2.gz VHSQQJBYGDNAAU-UHFFFAOYSA-N 1 2 314.241 4.012 20 0 DIADLO Cn1ncc(Cl)c1C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000437583387 334053357 /nfs/dbraw/zinc/05/33/57/334053357.db2.gz SKROGACYZIKKCW-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1ncc(Cl)c1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000437583387 334053359 /nfs/dbraw/zinc/05/33/59/334053359.db2.gz SKROGACYZIKKCW-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@H+]2CC(C)=C[C@H](C)C2)c(Cl)c1 ZINC000430284083 334069528 /nfs/dbraw/zinc/06/95/28/334069528.db2.gz KLISZWSMAIXNHO-SWLSCSKDSA-N 1 2 320.864 4.182 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)[N@@H+]2CC(C)=C[C@H](C)C2)c(Cl)c1 ZINC000430284083 334069531 /nfs/dbraw/zinc/06/95/31/334069531.db2.gz KLISZWSMAIXNHO-SWLSCSKDSA-N 1 2 320.864 4.182 20 0 DIADLO C[C@@H]([NH2+][C@@H](CO)c1c(F)cccc1F)c1csc(Cl)c1 ZINC000276462980 334079041 /nfs/dbraw/zinc/07/90/41/334079041.db2.gz CLZMEAZIFXTDEA-PELKAZGASA-N 1 2 317.788 4.064 20 0 DIADLO C[C@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1csc(Cl)c1 ZINC000276462990 334079198 /nfs/dbraw/zinc/07/91/98/334079198.db2.gz CLZMEAZIFXTDEA-QPUJVOFHSA-N 1 2 317.788 4.064 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2cccc(F)c2F)[nH]1 ZINC000277071340 334086531 /nfs/dbraw/zinc/08/65/31/334086531.db2.gz DZCPQWKXLWKGCC-AXFHLTTASA-N 1 2 308.376 4.008 20 0 DIADLO CS[C@@H](C(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccccc1 ZINC000414779188 334092803 /nfs/dbraw/zinc/09/28/03/334092803.db2.gz FMZFLJHWICJUHE-MRXNPFEDSA-N 1 2 300.427 4.050 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000279105791 334105704 /nfs/dbraw/zinc/10/57/04/334105704.db2.gz JTSIQMCNYCDQHI-UHFFFAOYSA-N 1 2 318.486 4.474 20 0 DIADLO Brc1cccc(CNc2ccc3c(c2)CCC[NH2+]3)c1 ZINC000414844216 334113418 /nfs/dbraw/zinc/11/34/18/334113418.db2.gz DKVOCUMQGJERET-UHFFFAOYSA-N 1 2 317.230 4.419 20 0 DIADLO CCCn1c(CNc2ccc3c(c2)CCC[NH2+]3)nc2ccccc21 ZINC000414845825 334116168 /nfs/dbraw/zinc/11/61/68/334116168.db2.gz GFJGWBGQBGMJIB-UHFFFAOYSA-N 1 2 320.440 4.417 20 0 DIADLO c1cn2c(CNc3ccc4c(c3)CCC[NH2+]4)c(C3CC3)nc2s1 ZINC000414850344 334123453 /nfs/dbraw/zinc/12/34/53/334123453.db2.gz MRURZHBMXGWXMW-UHFFFAOYSA-N 1 2 324.453 4.243 20 0 DIADLO Cc1oc2ccccc2c1CCNC(=O)Nc1ccc(C)[nH+]c1C ZINC000343613846 335177341 /nfs/dbraw/zinc/17/73/41/335177341.db2.gz SFOSQTBIRRWTEE-UHFFFAOYSA-N 1 2 323.396 4.117 20 0 DIADLO C[C@@H]1CCc2nc(CNc3ccc4c(c3)CCC[NH2+]4)sc2C1 ZINC000414852520 334126584 /nfs/dbraw/zinc/12/65/84/334126584.db2.gz QDGFQOWYDBYKSY-GFCCVEGCSA-N 1 2 313.470 4.238 20 0 DIADLO COc1cccc(Cl)c1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000414854850 334128047 /nfs/dbraw/zinc/12/80/47/334128047.db2.gz UWPWYTFBNINUFQ-UHFFFAOYSA-N 1 2 302.805 4.319 20 0 DIADLO Cn1cc(CNc2ccc3c(c2)CCC[NH2+]3)c(C2CCCCC2)n1 ZINC000414855527 334128467 /nfs/dbraw/zinc/12/84/67/334128467.db2.gz WYJQFLCONHIEGN-UHFFFAOYSA-N 1 2 324.472 4.438 20 0 DIADLO COCC[C@H](Cc1ccco1)Nc1[nH+]ccc2ccc(F)cc21 ZINC000343587640 335179743 /nfs/dbraw/zinc/17/97/43/335179743.db2.gz DKSFZCCEUZRIBQ-OAHLLOKOSA-N 1 2 314.360 4.027 20 0 DIADLO CCCc1nc(C)c(C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)o1 ZINC000293685849 334200890 /nfs/dbraw/zinc/20/08/90/334200890.db2.gz NLAWIGLAJLXVLI-QGZVFWFLSA-N 1 2 316.449 4.070 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccco2)no1)Cc1ccc(Cl)cc1 ZINC000340655014 334258330 /nfs/dbraw/zinc/25/83/30/334258330.db2.gz HHKYUEITVDZAGX-UHFFFAOYSA-N 1 2 317.776 4.005 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccco2)no1)Cc1ccc(Cl)cc1 ZINC000340655014 334258333 /nfs/dbraw/zinc/25/83/33/334258333.db2.gz HHKYUEITVDZAGX-UHFFFAOYSA-N 1 2 317.776 4.005 20 0 DIADLO C[C@H](C1CC1)n1cc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)cn1 ZINC000187623279 334267773 /nfs/dbraw/zinc/26/77/73/334267773.db2.gz LGFJREMGUTYVRG-LSDHHAIUSA-N 1 2 321.428 4.213 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2cccc(Cl)c2)c2ncc[nH]2)cc1 ZINC000187673776 334268736 /nfs/dbraw/zinc/26/87/36/334268736.db2.gz KFIZCKBBUIQLAE-INIZCTEOSA-N 1 2 315.779 4.081 20 0 DIADLO CCC(CC)CC(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000534556914 334283622 /nfs/dbraw/zinc/28/36/22/334283622.db2.gz GJUXXOKMMGOAGD-UHFFFAOYSA-N 1 2 323.440 4.367 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2ccc(Cl)s2)c2ncc[nH]2)cc1 ZINC000187862168 334298744 /nfs/dbraw/zinc/29/87/44/334298744.db2.gz MCFIHFAPSNIDGY-AWEZNQCLSA-N 1 2 321.808 4.143 20 0 DIADLO Fc1ccc([C@H](NCc2ccc(Cl)s2)c2[nH]cc[nH+]2)cc1 ZINC000187862168 334298745 /nfs/dbraw/zinc/29/87/45/334298745.db2.gz MCFIHFAPSNIDGY-AWEZNQCLSA-N 1 2 321.808 4.143 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1cc(-c2cccs2)on1 ZINC000111239656 334312375 /nfs/dbraw/zinc/31/23/75/334312375.db2.gz BQGIHTOKBJTMGO-GFCCVEGCSA-N 1 2 314.410 4.302 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1cc(-c2cccs2)on1 ZINC000111239656 334312376 /nfs/dbraw/zinc/31/23/76/334312376.db2.gz BQGIHTOKBJTMGO-GFCCVEGCSA-N 1 2 314.410 4.302 20 0 DIADLO CC(C)(C)OC(=O)C[N@@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000303372345 334315723 /nfs/dbraw/zinc/31/57/23/334315723.db2.gz KJHACHNBTZUISX-QGZVFWFLSA-N 1 2 314.429 4.037 20 0 DIADLO CC(C)(C)OC(=O)C[N@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000303372345 334315725 /nfs/dbraw/zinc/31/57/25/334315725.db2.gz KJHACHNBTZUISX-QGZVFWFLSA-N 1 2 314.429 4.037 20 0 DIADLO Cc1oc2ccccc2c1C[NH2+]Cc1nnc(C(C)C)s1 ZINC000534647394 334316066 /nfs/dbraw/zinc/31/60/66/334316066.db2.gz BMFBPMFHDOBEOR-UHFFFAOYSA-N 1 2 301.415 4.006 20 0 DIADLO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1nc(C)c2ccccc2n1 ZINC000531962353 334320285 /nfs/dbraw/zinc/32/02/85/334320285.db2.gz IKLZIEBMFABWSO-AWEZNQCLSA-N 1 2 321.424 4.106 20 0 DIADLO CCCCc1ccc([C@H]([NH2+]Cc2noc(CC)n2)C(C)C)cc1 ZINC000303467811 334321559 /nfs/dbraw/zinc/32/15/59/334321559.db2.gz MZELZGKFFQEOGR-LJQANCHMSA-N 1 2 315.461 4.462 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@H](C)c1ccc(Oc2ccccc2)cc1 ZINC000101599299 334336528 /nfs/dbraw/zinc/33/65/28/334336528.db2.gz FMQNONVATBCBRK-CQSZACIVSA-N 1 2 307.397 4.361 20 0 DIADLO Cc1nc(N2CCc3ccccc3[C@@H]2Cc2ccccc2)cc[nH+]1 ZINC000534881984 334343355 /nfs/dbraw/zinc/34/33/55/334343355.db2.gz ISMPJKHIWRNGKJ-FQEVSTJZSA-N 1 2 315.420 4.132 20 0 DIADLO Cn1c2ccccc2[nH+]c1N[C@@H](c1nccs1)c1ccccc1 ZINC000534979215 334351598 /nfs/dbraw/zinc/35/15/98/334351598.db2.gz FWZDEJHVEGHNJO-MRXNPFEDSA-N 1 2 320.421 4.231 20 0 DIADLO Cc1cc(NC(=O)CSc2ccc3ccccc3c2)c(C)c[nH+]1 ZINC000535036080 334359029 /nfs/dbraw/zinc/35/90/29/334359029.db2.gz JYDFWUYAZQKPSC-UHFFFAOYSA-N 1 2 322.433 4.004 20 0 DIADLO CC(C)C[C@@H](C)Oc1cc(C[NH2+][C@@H](C)c2cscn2)ccn1 ZINC000535064647 334362414 /nfs/dbraw/zinc/36/24/14/334362414.db2.gz TXCSXSOPQKLSEG-KGLIPLIRSA-N 1 2 319.474 4.202 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+](C)Cc1ccc(Cl)cc1 ZINC000535065998 334362658 /nfs/dbraw/zinc/36/26/58/334362658.db2.gz AEISCBJPJFCMNO-UHFFFAOYSA-N 1 2 313.832 4.342 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000535065998 334362659 /nfs/dbraw/zinc/36/26/59/334362659.db2.gz AEISCBJPJFCMNO-UHFFFAOYSA-N 1 2 313.832 4.342 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)CC(C)(C)O1 ZINC000535084626 334366942 /nfs/dbraw/zinc/36/69/42/334366942.db2.gz WNZUCDPRMKRLFL-CYBMUJFWSA-N 1 2 308.491 4.190 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)CC(C)(C)O1 ZINC000535084626 334366943 /nfs/dbraw/zinc/36/69/43/334366943.db2.gz WNZUCDPRMKRLFL-CYBMUJFWSA-N 1 2 308.491 4.190 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3cc(-c4ccccc4)oc3C2)cs1 ZINC000340697890 334367775 /nfs/dbraw/zinc/36/77/75/334367775.db2.gz UTMVBCBYLKJMDR-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1nc(C[N@H+]2CCc3cc(-c4ccccc4)oc3C2)cs1 ZINC000340697890 334367776 /nfs/dbraw/zinc/36/77/76/334367776.db2.gz UTMVBCBYLKJMDR-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO CCc1ccc(C[N@H+](Cc2cc[nH]n2)Cc2ccccc2)s1 ZINC000535086106 334368911 /nfs/dbraw/zinc/36/89/11/334368911.db2.gz COQALYRATURIOG-UHFFFAOYSA-N 1 2 311.454 4.236 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)s1 ZINC000535086106 334368912 /nfs/dbraw/zinc/36/89/12/334368912.db2.gz COQALYRATURIOG-UHFFFAOYSA-N 1 2 311.454 4.236 20 0 DIADLO C[C@H]1CCC[C@H]1NC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000112211351 334373781 /nfs/dbraw/zinc/37/37/81/334373781.db2.gz QYQIZCJCFDCBKT-SUMWQHHRSA-N 1 2 311.385 4.184 20 0 DIADLO CC[C@@H](NC(=O)C/C=C/c1ccc(C(C)C)cc1)c1[nH]cc[nH+]1 ZINC000443133128 338445395 /nfs/dbraw/zinc/44/53/95/338445395.db2.gz ULWFWBMTIVSJFB-FUTAKVPZSA-N 1 2 311.429 4.204 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[NH2+]Cc1nnc(C(C)(C)C)s1 ZINC000535247293 334382321 /nfs/dbraw/zinc/38/23/21/334382321.db2.gz LYJNMXPPUWGWMB-UHFFFAOYSA-N 1 2 323.893 4.396 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ncc(-c3ccccc3C)o2)c1 ZINC000535262262 334383213 /nfs/dbraw/zinc/38/32/13/334383213.db2.gz WSAUMPWUUNMTIO-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ncc(-c3ccccc3C)o2)c1 ZINC000535262262 334383214 /nfs/dbraw/zinc/38/32/14/334383214.db2.gz WSAUMPWUUNMTIO-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO Cc1ccc(C2CCN(c3nc4ccccc4nc3C)CC2)c[nH+]1 ZINC000340781071 334385346 /nfs/dbraw/zinc/38/53/46/334385346.db2.gz QOVRNGWRGCJCHN-UHFFFAOYSA-N 1 2 318.424 4.026 20 0 DIADLO Cc1ccc(C2CCN(c3nc4ccccc4s3)CC2)c[nH+]1 ZINC000340796310 334386235 /nfs/dbraw/zinc/38/62/35/334386235.db2.gz KTUXXRRMAJCWBF-UHFFFAOYSA-N 1 2 309.438 4.384 20 0 DIADLO Cc1ccc(C2CCN(c3ncnc4c(C)cccc43)CC2)c[nH+]1 ZINC000340839127 334388944 /nfs/dbraw/zinc/38/89/44/334388944.db2.gz MKBLHSZIABSXCR-UHFFFAOYSA-N 1 2 318.424 4.026 20 0 DIADLO O=C(C[C@H]1C[C@@H]1c1ccccc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000340898070 334389171 /nfs/dbraw/zinc/38/91/71/334389171.db2.gz NWOLCIMBYIJAHS-VQIMIIECSA-N 1 2 317.392 4.005 20 0 DIADLO CCOc1ccccc1[C@H](CC(C)C)NCc1[nH+]cc(C)n1C ZINC000341000654 334398885 /nfs/dbraw/zinc/39/88/85/334398885.db2.gz ANROACFIVWXWBS-KRWDZBQOSA-N 1 2 315.461 4.004 20 0 DIADLO Cc1c[nH+]c(CNc2cccc(CSC(C)C)c2C)n1C ZINC000341031566 334403502 /nfs/dbraw/zinc/40/35/02/334403502.db2.gz WGAXRNRNMKCCGX-UHFFFAOYSA-N 1 2 303.475 4.291 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1cccc(OC(F)F)c1 ZINC000341138718 334412576 /nfs/dbraw/zinc/41/25/76/334412576.db2.gz ACNWBLAKWSUDSS-SNVBAGLBSA-N 1 2 308.328 4.004 20 0 DIADLO CCc1nc(C[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)no1 ZINC000341452503 334441822 /nfs/dbraw/zinc/44/18/22/334441822.db2.gz ISLLNMJWKRDEOO-AWEZNQCLSA-N 1 2 305.397 4.038 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@H](CC(F)(F)F)c2ccccc2)n1 ZINC000341569043 334453346 /nfs/dbraw/zinc/45/33/46/334453346.db2.gz CGKZORVNMNLFKZ-OAHLLOKOSA-N 1 2 311.351 4.247 20 0 DIADLO FC(F)(F)C[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccccc1 ZINC000341586897 334459092 /nfs/dbraw/zinc/45/90/92/334459092.db2.gz ODKGTGORBVQMTC-ZDUSSCGKSA-N 1 2 310.319 4.335 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1[nH+]ccc3ccc(F)cc31)CCO2 ZINC000341603178 334461043 /nfs/dbraw/zinc/46/10/43/334461043.db2.gz FUBQGJVKSXGHPB-KRWDZBQOSA-N 1 2 324.355 4.318 20 0 DIADLO Cc1nnc(C[NH2+][C@H](C)c2ccc(SC(C)C)cc2)s1 ZINC000341803275 334483872 /nfs/dbraw/zinc/48/38/72/334483872.db2.gz ZFSCXXPMURNGMV-LLVKDONJSA-N 1 2 307.488 4.198 20 0 DIADLO COc1cc[nH+]cc1CSC[C@@H](OC)c1ccc(Cl)cc1 ZINC000342006172 334500607 /nfs/dbraw/zinc/50/06/07/334500607.db2.gz USMYYBSZVIFIBZ-MRXNPFEDSA-N 1 2 323.845 4.365 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC000342066704 334506557 /nfs/dbraw/zinc/50/65/57/334506557.db2.gz JICYZJXRUROWNP-CABCVRRESA-N 1 2 307.397 4.457 20 0 DIADLO COc1ccc2c(c1)[nH+]ccc2OCc1nc(C2CC2)cs1 ZINC000342481588 334546531 /nfs/dbraw/zinc/54/65/31/334546531.db2.gz BNTBTESABCXLQK-UHFFFAOYSA-N 1 2 312.394 4.156 20 0 DIADLO C[C@@H]1CCCN1c1cc[nH+]c2c(Br)ccc(F)c12 ZINC000443507418 338453027 /nfs/dbraw/zinc/45/30/27/338453027.db2.gz GOOXQRVMJFURDM-SECBINFHSA-N 1 2 309.182 4.125 20 0 DIADLO Cc1ccc(NC(=O)N[C@H]2c3ccccc3CC[C@@H]2C)c(C)[nH+]1 ZINC000342894899 334587280 /nfs/dbraw/zinc/58/72/80/334587280.db2.gz ARJRLZCCCFGRSQ-KPZWWZAWSA-N 1 2 309.413 4.144 20 0 DIADLO Cc1ccc(CC(C)(C)NC(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000417123047 334696664 /nfs/dbraw/zinc/69/66/64/334696664.db2.gz LGBBYBXOCHLIDB-UHFFFAOYSA-N 1 2 311.429 4.150 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cccc(-c3cscn3)c2)c(C)[nH+]1 ZINC000443832735 338461154 /nfs/dbraw/zinc/46/11/54/338461154.db2.gz BFCQMRXBPTXECU-UHFFFAOYSA-N 1 2 323.421 4.383 20 0 DIADLO CCC[C@]1(C(F)(F)F)CCCN1Cc1c[nH+]cn1C(C)C ZINC000425338837 334801431 /nfs/dbraw/zinc/80/14/31/334801431.db2.gz QESXEEFAWLEGRF-CQSZACIVSA-N 1 2 303.372 4.161 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+]Cc1cscn1 ZINC000444013062 338467068 /nfs/dbraw/zinc/46/70/68/338467068.db2.gz UMWKZJWHYQSNPK-ZDUSSCGKSA-N 1 2 300.349 4.235 20 0 DIADLO COc1ccccc1[C@H]1CC[C@@H](C)CN1c1cc[nH+]c(C2CC2)n1 ZINC000343281114 334917825 /nfs/dbraw/zinc/91/78/25/334917825.db2.gz GJXCPTJDPDJMFJ-RHSMWYFYSA-N 1 2 323.440 4.340 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccc(C)c(OC(F)F)c2)c(C)[nH+]1 ZINC000152318167 334918857 /nfs/dbraw/zinc/91/88/57/334918857.db2.gz QTLDOXQVRWILGX-UHFFFAOYSA-N 1 2 321.327 4.252 20 0 DIADLO Cc1ccc(CCCNc2cc(-c3ccnn3C)ccc2C)c[nH+]1 ZINC000343619689 335181872 /nfs/dbraw/zinc/18/18/72/335181872.db2.gz ZEOPFJWNIJFWSS-UHFFFAOYSA-N 1 2 320.440 4.144 20 0 DIADLO Cc1ccc2c(c1)CN(c1[nH+]ccc3ccc(F)cc31)CCO2 ZINC000343637708 335183669 /nfs/dbraw/zinc/18/36/69/335183669.db2.gz VBISHQOMYHBCTM-UHFFFAOYSA-N 1 2 308.356 4.081 20 0 DIADLO CC[N@H+](Cc1ccccc1Br)Cc1cnccc1C ZINC000343684689 335188055 /nfs/dbraw/zinc/18/80/55/335188055.db2.gz SYLUNASWNIIJJY-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1ccccc1Br)Cc1cnccc1C ZINC000343684689 335188057 /nfs/dbraw/zinc/18/80/57/335188057.db2.gz SYLUNASWNIIJJY-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CCc1nnc(C[NH2+][C@H](c2cc3ccccc3o2)C(C)C)s1 ZINC000343750965 335190425 /nfs/dbraw/zinc/19/04/25/335190425.db2.gz JPDPITHYXGELRB-KRWDZBQOSA-N 1 2 315.442 4.334 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3nc(C4CC4)cs3)CCC2)c(F)c1 ZINC000343758474 335190953 /nfs/dbraw/zinc/19/09/53/335190953.db2.gz PBYRBEVTVOHEMI-UHFFFAOYSA-N 1 2 320.408 4.468 20 0 DIADLO c1oc(-c2ccccc2)nc1C[NH2+]Cc1ccc2ccccc2n1 ZINC000343814950 335195238 /nfs/dbraw/zinc/19/52/38/335195238.db2.gz RFAMIFAPSCZDOY-UHFFFAOYSA-N 1 2 315.376 4.180 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)n1 ZINC000343845648 335196933 /nfs/dbraw/zinc/19/69/33/335196933.db2.gz YFCSFICQMXACHE-YUMQZZPRSA-N 1 2 321.393 4.339 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)cn1)c1nc(C(F)(F)F)cs1 ZINC000343830563 335200091 /nfs/dbraw/zinc/20/00/91/335200091.db2.gz BSZPKUDWGSCKID-SSDOTTSWSA-N 1 2 321.755 4.061 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)s1 ZINC000343835252 335200627 /nfs/dbraw/zinc/20/06/27/335200627.db2.gz AEMGDNMWKHWLGU-SSDOTTSWSA-N 1 2 321.393 4.032 20 0 DIADLO COc1cncc(C[NH+]2Cc3ccccc3-c3ccccc3C2)c1 ZINC000343972059 335208894 /nfs/dbraw/zinc/20/88/94/335208894.db2.gz OJBUNGDZPPGSGT-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO Cc1ccc([C@@H]2CCN(C(=O)Nc3ccc(C)[nH+]c3C)C2)c(C)c1 ZINC000344040872 335211521 /nfs/dbraw/zinc/21/15/21/335211521.db2.gz FAZWBZQACCIQIC-QGZVFWFLSA-N 1 2 323.440 4.337 20 0 DIADLO COc1cc[nH+]cc1CSc1ncc(C(C)C)n1C(C)C ZINC000344112667 335217972 /nfs/dbraw/zinc/21/79/72/335217972.db2.gz VMQSWTYBYJDAAV-UHFFFAOYSA-N 1 2 305.447 4.283 20 0 DIADLO CCc1cnc(C[NH2+]Cc2ccccc2OCC(C)C)s1 ZINC000344133487 335220359 /nfs/dbraw/zinc/22/03/59/335220359.db2.gz PZVFXMBUKYSZPH-UHFFFAOYSA-N 1 2 304.459 4.030 20 0 DIADLO Cc1nc(C2([NH2+]Cc3coc4ccccc34)CCCCC2)no1 ZINC000344198316 335224597 /nfs/dbraw/zinc/22/45/97/335224597.db2.gz YBFVFBRCUGENMD-UHFFFAOYSA-N 1 2 311.385 4.073 20 0 DIADLO Cc1ccccc1[C@@H](C)N(C)C(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000344217500 335229621 /nfs/dbraw/zinc/22/96/21/335229621.db2.gz VXMKNXPYHIOGKM-MRXNPFEDSA-N 1 2 319.408 4.014 20 0 DIADLO c1cc2c(o1)CCC[N@@H+](Cc1csc(-c3ccsc3)n1)C2 ZINC000344242766 335231464 /nfs/dbraw/zinc/23/14/64/335231464.db2.gz ZEDIRXXJGXWLHZ-UHFFFAOYSA-N 1 2 316.451 4.413 20 0 DIADLO c1cc2c(o1)CCC[N@H+](Cc1csc(-c3ccsc3)n1)C2 ZINC000344242766 335231465 /nfs/dbraw/zinc/23/14/65/335231465.db2.gz ZEDIRXXJGXWLHZ-UHFFFAOYSA-N 1 2 316.451 4.413 20 0 DIADLO C[C@H]([NH2+]Cc1cccc2cc[nH]c21)c1noc(-c2ccccc2)n1 ZINC000344637601 335261263 /nfs/dbraw/zinc/26/12/63/335261263.db2.gz HSLPDHMPUJFCHS-ZDUSSCGKSA-N 1 2 318.380 4.069 20 0 DIADLO CC(C)Cc1ccc(C[NH2+]Cc2nnc(C(C)C)s2)cc1 ZINC000344688666 335266936 /nfs/dbraw/zinc/26/69/36/335266936.db2.gz VNEPZJKAXQZQEL-UHFFFAOYSA-N 1 2 303.475 4.150 20 0 DIADLO CC[C@H]([NH2+]Cc1c(Cl)cccc1OC)c1nc(C)cs1 ZINC000118448997 335267784 /nfs/dbraw/zinc/26/77/84/335267784.db2.gz ZOLAYYYOGPRFBM-ZDUSSCGKSA-N 1 2 310.850 4.354 20 0 DIADLO Fc1cncc(C[N@H+](Cc2ccco2)Cc2cccs2)c1 ZINC000344671148 335270535 /nfs/dbraw/zinc/27/05/35/335270535.db2.gz NSEBWNUKNGABIF-UHFFFAOYSA-N 1 2 302.374 4.078 20 0 DIADLO Fc1cncc(C[N@@H+](Cc2ccco2)Cc2cccs2)c1 ZINC000344671148 335270536 /nfs/dbraw/zinc/27/05/36/335270536.db2.gz NSEBWNUKNGABIF-UHFFFAOYSA-N 1 2 302.374 4.078 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CCS[C@H](C)[C@@H]1c1ccccc1 ZINC000345158248 335302499 /nfs/dbraw/zinc/30/24/99/335302499.db2.gz PUZASUFEKKRSQR-CRAIPNDOSA-N 1 2 315.486 4.143 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CCS[C@H](C)[C@@H]1c1ccccc1 ZINC000345158248 335302500 /nfs/dbraw/zinc/30/25/00/335302500.db2.gz PUZASUFEKKRSQR-CRAIPNDOSA-N 1 2 315.486 4.143 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ccccc1Cl)c1nc(C2CC2)no1 ZINC000113357714 335325596 /nfs/dbraw/zinc/32/55/96/335325596.db2.gz AIKGVGXGVUWTGY-CQSZACIVSA-N 1 2 305.809 4.087 20 0 DIADLO Cc1cccc(Oc2ccccc2NC(=O)CCc2[nH]cc[nH+]2)c1 ZINC000345634570 335338478 /nfs/dbraw/zinc/33/84/78/335338478.db2.gz HJFTVCMYPUFMKI-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO Cc1cc(C(=O)Nc2ccccc2-n2cc[nH+]c2)ccc1Cl ZINC000345641037 335338869 /nfs/dbraw/zinc/33/88/69/335338869.db2.gz VHCNTVQZODAHPN-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO COc1cc[nH+]cc1NC(=O)C[C@@H]1C[C@@H](C(C)C)c2ccccc21 ZINC000345739848 335347033 /nfs/dbraw/zinc/34/70/33/335347033.db2.gz KJOFPNXFQFVJPA-YOEHRIQHSA-N 1 2 324.424 4.346 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ccco2)Cc2cccs2)nc1 ZINC000345835142 335354237 /nfs/dbraw/zinc/35/42/37/335354237.db2.gz BLQRVDMPXNQVDZ-UHFFFAOYSA-N 1 2 302.374 4.078 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ccco2)Cc2cccs2)nc1 ZINC000345835142 335354239 /nfs/dbraw/zinc/35/42/39/335354239.db2.gz BLQRVDMPXNQVDZ-UHFFFAOYSA-N 1 2 302.374 4.078 20 0 DIADLO CCC(C)(C)N(C)C(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000346091629 335374264 /nfs/dbraw/zinc/37/42/64/335374264.db2.gz YUFRKEAFLSYJRR-UHFFFAOYSA-N 1 2 312.413 4.443 20 0 DIADLO Cc1csc(-c2nc(Cc3ccc(C)[nH+]c3)no2)c1Cl ZINC000346176403 335378106 /nfs/dbraw/zinc/37/81/06/335378106.db2.gz NYGBSEASIBXLNG-UHFFFAOYSA-N 1 2 305.790 4.054 20 0 DIADLO CCOc1ccc2c(c1)CC[N@@H+](Cc1ncc(C(C)C)s1)C2 ZINC000346215303 335385090 /nfs/dbraw/zinc/38/50/90/335385090.db2.gz JRQUEBSFWLIEGY-UHFFFAOYSA-N 1 2 316.470 4.224 20 0 DIADLO CCOc1ccc2c(c1)CC[N@H+](Cc1ncc(C(C)C)s1)C2 ZINC000346215303 335385091 /nfs/dbraw/zinc/38/50/91/335385091.db2.gz JRQUEBSFWLIEGY-UHFFFAOYSA-N 1 2 316.470 4.224 20 0 DIADLO CC[N@H+](Cc1ncc(C(C)C)s1)Cc1ccc2c(c1)OCO2 ZINC000346219161 335385397 /nfs/dbraw/zinc/38/53/97/335385397.db2.gz RGZRKGGKVRPNMB-UHFFFAOYSA-N 1 2 318.442 4.017 20 0 DIADLO CC[N@@H+](Cc1ncc(C(C)C)s1)Cc1ccc2c(c1)OCO2 ZINC000346219161 335385398 /nfs/dbraw/zinc/38/53/98/335385398.db2.gz RGZRKGGKVRPNMB-UHFFFAOYSA-N 1 2 318.442 4.017 20 0 DIADLO CCc1cnc(C[N@H+](C)[C@@H]2CCCc3nc(CC)sc32)s1 ZINC000346225668 335386006 /nfs/dbraw/zinc/38/60/06/335386006.db2.gz SBGUPZZMONYFGV-CYBMUJFWSA-N 1 2 321.515 4.234 20 0 DIADLO CCc1cnc(C[N@@H+](C)[C@@H]2CCCc3nc(CC)sc32)s1 ZINC000346225668 335386007 /nfs/dbraw/zinc/38/60/07/335386007.db2.gz SBGUPZZMONYFGV-CYBMUJFWSA-N 1 2 321.515 4.234 20 0 DIADLO Cc1nc([C@@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)cs1 ZINC000346579583 335426126 /nfs/dbraw/zinc/42/61/26/335426126.db2.gz STUVKPJLDCKSSJ-GFCCVEGCSA-N 1 2 302.447 4.010 20 0 DIADLO Cc1nc([C@H]2CCCN(c3cc[nH+]c(C(C)C)n3)C2)sc1C ZINC000346654150 335426775 /nfs/dbraw/zinc/42/67/75/335426775.db2.gz VQNBBOXDOLODHY-AWEZNQCLSA-N 1 2 316.474 4.057 20 0 DIADLO CSc1ccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)nc1 ZINC000347257661 335483634 /nfs/dbraw/zinc/48/36/34/335483634.db2.gz MMDXKTXNMVUUCU-CYBMUJFWSA-N 1 2 310.426 4.162 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc(C2CCC(C)(C)CC2)no1 ZINC000347463025 335498513 /nfs/dbraw/zinc/49/85/13/335498513.db2.gz DURPNESSAVSWOA-UHFFFAOYSA-N 1 2 324.428 4.460 20 0 DIADLO Cc1csc([C@@H](C)CNc2[nH+]ccc3ccc(F)cc32)n1 ZINC000347891457 335532327 /nfs/dbraw/zinc/53/23/27/335532327.db2.gz YXHUAHDZRFNQHB-JTQLQIEISA-N 1 2 301.390 4.354 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2nc(C3CC3)cs2)C2CC2)s1 ZINC000347954478 335536869 /nfs/dbraw/zinc/53/68/69/335536869.db2.gz HEAUILJJBSXZKK-CQSZACIVSA-N 1 2 305.472 4.026 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]Cc1nccc(C)n1 ZINC000347994661 335544545 /nfs/dbraw/zinc/54/45/45/335544545.db2.gz DJRAFKMCLBEJCT-CYBMUJFWSA-N 1 2 324.453 4.068 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]Cc1ncc(C)cn1 ZINC000347995890 335544687 /nfs/dbraw/zinc/54/46/87/335544687.db2.gz DYPHDPHRPJQMFD-CYBMUJFWSA-N 1 2 324.453 4.068 20 0 DIADLO Cc1csc([C@H]2CCCCN2c2cc(C)[nH+]c(C(C)C)n2)n1 ZINC000348356119 335580211 /nfs/dbraw/zinc/58/02/11/335580211.db2.gz WNTAVBZLGXLLFR-CQSZACIVSA-N 1 2 316.474 4.405 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@H](C)c2csc(C(C)C)n2)ccn1 ZINC000348639131 335600785 /nfs/dbraw/zinc/60/07/85/335600785.db2.gz GNRISLCXKKSBDZ-NWDGAFQWSA-N 1 2 305.447 4.082 20 0 DIADLO CSc1ccccc1[C@H](C)[NH2+]Cc1nnc(C(C)(C)C)s1 ZINC000442858597 335641745 /nfs/dbraw/zinc/64/17/45/335641745.db2.gz PFBBFXHANPXIIF-NSHDSACASA-N 1 2 321.515 4.408 20 0 DIADLO CCOc1cccc(C[NH+](Cc2ccco2)Cc2ccco2)c1 ZINC000349612220 335685012 /nfs/dbraw/zinc/68/50/12/335685012.db2.gz AEVLMVDFTZHOPX-UHFFFAOYSA-N 1 2 311.381 4.474 20 0 DIADLO Cc1ccc(O[C@H](C)c2nc(CCc3[nH+]cccc3C)no2)cc1 ZINC000518908484 335699005 /nfs/dbraw/zinc/69/90/05/335699005.db2.gz ALJJNZXCBYTTNA-OAHLLOKOSA-N 1 2 323.396 4.007 20 0 DIADLO Cc1cc(C)c(NC(=O)c2csc3c2CC[C@H](C)C3)c(C)[nH+]1 ZINC000518977580 335760208 /nfs/dbraw/zinc/76/02/08/335760208.db2.gz DIMHMRFOFKHUNJ-JTQLQIEISA-N 1 2 314.454 4.445 20 0 DIADLO Cc1cc(NC(=O)N[C@H](C)c2cccc3ccccc32)c(C)c[nH+]1 ZINC000535774169 335764437 /nfs/dbraw/zinc/76/44/37/335764437.db2.gz QARIIDVXZOSMKU-OAHLLOKOSA-N 1 2 319.408 4.156 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(Cl)cc2F)nc2ccccc12 ZINC000527360696 335842481 /nfs/dbraw/zinc/84/24/81/335842481.db2.gz BJKHLUDKDHTBAF-UHFFFAOYSA-N 1 2 315.779 4.021 20 0 DIADLO Fc1ccc(Cl)c(NCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000527362521 335843896 /nfs/dbraw/zinc/84/38/96/335843896.db2.gz MAWOYGZWBLMKDO-UHFFFAOYSA-N 1 2 315.779 4.336 20 0 DIADLO Cc1cccc(C)c1Cn1nc(C(F)(F)F)c2c[nH+]ccc21 ZINC000536657312 335855189 /nfs/dbraw/zinc/85/51/89/335855189.db2.gz YBXXXRPTXYHOPA-UHFFFAOYSA-N 1 2 305.303 4.115 20 0 DIADLO COc1ccc(SCc2c[nH+]cn2Cc2ccccc2)cc1 ZINC000445609645 338502397 /nfs/dbraw/zinc/50/23/97/338502397.db2.gz XUQHSQAUTIRLCP-UHFFFAOYSA-N 1 2 310.422 4.232 20 0 DIADLO Cc1cc(O)c(C(C)C)cc1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC000519571546 335878498 /nfs/dbraw/zinc/87/84/98/335878498.db2.gz RDQBVOFBFMFWKW-UHFFFAOYSA-N 1 2 324.384 4.116 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(OC2CCCCC2)nc1)c1nccs1 ZINC000536772824 335887398 /nfs/dbraw/zinc/88/73/98/335887398.db2.gz PKJYWSAVIWEVFO-ZDUSSCGKSA-N 1 2 317.458 4.100 20 0 DIADLO CCOc1cccc(-c2cccc(NCc3c(C)noc3C)[nH+]2)c1 ZINC000519679265 335888867 /nfs/dbraw/zinc/88/88/67/335888867.db2.gz DDSUCSNZXHJTOD-UHFFFAOYSA-N 1 2 323.396 4.364 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC(C)(C)[C@@H]2c2cccnc2)c(C)[nH+]1 ZINC000519746765 335893971 /nfs/dbraw/zinc/89/39/71/335893971.db2.gz DRAATBUYUVQHHF-KRWDZBQOSA-N 1 2 324.428 4.017 20 0 DIADLO Fc1cc(F)c(F)c(NCc2cn3cc(Cl)ccc3[nH+]2)c1 ZINC000158674380 338506336 /nfs/dbraw/zinc/50/63/36/338506336.db2.gz WLRRHRQKAVKZCX-UHFFFAOYSA-N 1 2 311.694 4.017 20 0 DIADLO CCC1(c2nc(Cn3c4ccccc4[nH+]c3C(C)C)no2)CCC1 ZINC000445660239 338504910 /nfs/dbraw/zinc/50/49/10/338504910.db2.gz NOUBAYPVVOFRQE-UHFFFAOYSA-N 1 2 324.428 4.423 20 0 DIADLO Cc1cc(C(=O)Nc2ccc3c(c2)[nH+]c2n3CCCCC2)oc1C ZINC000532261584 335926983 /nfs/dbraw/zinc/92/69/83/335926983.db2.gz VFNBORRRILWHOR-UHFFFAOYSA-N 1 2 323.396 4.225 20 0 DIADLO C[C@@H]1CCCC[C@@H]1CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000520369646 335967899 /nfs/dbraw/zinc/96/78/99/335967899.db2.gz YYFHTDOVWDAHIV-ZIAGYGMSSA-N 1 2 315.392 4.166 20 0 DIADLO O=C(CCSc1ccccc1)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000520619401 335995636 /nfs/dbraw/zinc/99/56/36/335995636.db2.gz ALTOEFZTDWKULR-UHFFFAOYSA-N 1 2 323.421 4.198 20 0 DIADLO CCC[N@H+](Cc1cocn1)[C@H](C)c1ccccc1Br ZINC000191928637 336005186 /nfs/dbraw/zinc/00/51/86/336005186.db2.gz NLBTVIGFHOMKJY-GFCCVEGCSA-N 1 2 323.234 4.410 20 0 DIADLO CCC[N@@H+](Cc1cocn1)[C@H](C)c1ccccc1Br ZINC000191928637 336005188 /nfs/dbraw/zinc/00/51/88/336005188.db2.gz NLBTVIGFHOMKJY-GFCCVEGCSA-N 1 2 323.234 4.410 20 0 DIADLO CCC1(c2nc(CCn3c(C)[nH+]c4ccccc43)no2)CCCC1 ZINC000329613099 336010154 /nfs/dbraw/zinc/01/01/54/336010154.db2.gz OSWYZDRGANNGNH-UHFFFAOYSA-N 1 2 324.428 4.192 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2ccc(C(F)F)cc2)c(F)c1F ZINC000582217986 336010217 /nfs/dbraw/zinc/01/02/17/336010217.db2.gz PHDAVHQKWMAWOV-UHFFFAOYSA-N 1 2 319.248 4.470 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)c2ccc(F)cn2)c1C(C)C ZINC000191957986 336013355 /nfs/dbraw/zinc/01/33/55/336013355.db2.gz CMZCLFOKHDWEMA-UHFFFAOYSA-N 1 2 323.371 4.453 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc([C@H]2CCC[C@H](C)C2)n1 ZINC000329630791 336020111 /nfs/dbraw/zinc/02/01/11/336020111.db2.gz VPCCDXUIUNQORS-ZFWWWQNUSA-N 1 2 324.428 4.264 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)c1ccoc1Cl ZINC000192297460 336027672 /nfs/dbraw/zinc/02/76/72/336027672.db2.gz MQINSZCGGDBROH-UHFFFAOYSA-N 1 2 314.728 4.373 20 0 DIADLO Cc1ccc([C@H]2CCN(C(=O)Nc3c(C)cc(C)[nH+]c3C)C2)cc1 ZINC000582224643 336027949 /nfs/dbraw/zinc/02/79/49/336027949.db2.gz UIXFRGQKEMASIB-SFHVURJKSA-N 1 2 323.440 4.337 20 0 DIADLO Fc1ccc(Sc2ccc(C[NH2+]Cc3cocn3)cc2)cc1 ZINC000192341150 336031773 /nfs/dbraw/zinc/03/17/73/336031773.db2.gz HKMCZUDJCKPFBW-UHFFFAOYSA-N 1 2 314.385 4.255 20 0 DIADLO Cc1ccccc1-c1noc([C@H](C)[N@@H+]2CCCc3occc3C2)n1 ZINC000329662610 336033790 /nfs/dbraw/zinc/03/37/90/336033790.db2.gz PNOXXRFKNQBKLI-AWEZNQCLSA-N 1 2 323.396 4.147 20 0 DIADLO Cc1ccccc1-c1noc([C@H](C)[N@H+]2CCCc3occc3C2)n1 ZINC000329662610 336033791 /nfs/dbraw/zinc/03/37/91/336033791.db2.gz PNOXXRFKNQBKLI-AWEZNQCLSA-N 1 2 323.396 4.147 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc(C2CCCCC2)n1 ZINC000329683233 336043985 /nfs/dbraw/zinc/04/39/85/336043985.db2.gz XQQLWEQGPGVBTN-UHFFFAOYSA-N 1 2 310.401 4.018 20 0 DIADLO c1cn(Cc2ccc(NCc3cc4ccccc4s3)nc2)c[nH+]1 ZINC000351565638 336044541 /nfs/dbraw/zinc/04/45/41/336044541.db2.gz COBNKIRGSVYEKX-UHFFFAOYSA-N 1 2 320.421 4.153 20 0 DIADLO O=C(Cc1ccccc1F)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000351611842 336050402 /nfs/dbraw/zinc/05/04/02/336050402.db2.gz JSEILSBNECIXMS-UHFFFAOYSA-N 1 2 322.339 4.194 20 0 DIADLO CCN(Cc1c[nH+]cn1Cc1ccccc1)c1cccc(C)c1 ZINC000445819270 338511410 /nfs/dbraw/zinc/51/14/10/338511410.db2.gz AIJARGXNNDGXJO-UHFFFAOYSA-N 1 2 305.425 4.266 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)Cc2ccsc2C)cs1 ZINC000351671860 336057044 /nfs/dbraw/zinc/05/70/44/336057044.db2.gz AFVXVEOKUKRJBE-LLVKDONJSA-N 1 2 310.488 4.243 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)Cc2ccsc2C)cs1 ZINC000351671860 336057046 /nfs/dbraw/zinc/05/70/46/336057046.db2.gz AFVXVEOKUKRJBE-LLVKDONJSA-N 1 2 310.488 4.243 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(O)c2Cl)C[C@@H](c2ccsc2)O1 ZINC000351686359 336058205 /nfs/dbraw/zinc/05/82/05/336058205.db2.gz QSNSDIHPZXDNFL-NHYWBVRUSA-N 1 2 323.845 4.069 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(O)c2Cl)C[C@@H](c2ccsc2)O1 ZINC000351686359 336058206 /nfs/dbraw/zinc/05/82/06/336058206.db2.gz QSNSDIHPZXDNFL-NHYWBVRUSA-N 1 2 323.845 4.069 20 0 DIADLO CC(C)(CC(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000520735277 336072769 /nfs/dbraw/zinc/07/27/69/336072769.db2.gz SIBDGNYMNRCKES-UHFFFAOYSA-N 1 2 319.408 4.179 20 0 DIADLO Cc1cc([NH+]2CCCC2)ccc1N[C@@H]1CCCC12CCOCC2 ZINC000324140415 336094615 /nfs/dbraw/zinc/09/46/15/336094615.db2.gz MGRAMSXNQHNDLB-LJQANCHMSA-N 1 2 314.473 4.356 20 0 DIADLO Cc1cc(N2CCCC2)ccc1[NH2+][C@@H]1CCCC12CCOCC2 ZINC000324140415 336094617 /nfs/dbraw/zinc/09/46/17/336094617.db2.gz MGRAMSXNQHNDLB-LJQANCHMSA-N 1 2 314.473 4.356 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1nnc2n1CCCCC2)c1cc2ccccc2o1 ZINC000324181628 336103069 /nfs/dbraw/zinc/10/30/69/336103069.db2.gz HWKWTQIWOJMECS-ZIAGYGMSSA-N 1 2 324.428 4.163 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2[C@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331405989 336135175 /nfs/dbraw/zinc/13/51/75/336135175.db2.gz OCZQKWFWINJASN-OLZOCXBDSA-N 1 2 303.406 4.167 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2[C@H](C)c2nc(C(C)(C)C)no2)o1 ZINC000331405989 336135176 /nfs/dbraw/zinc/13/51/76/336135176.db2.gz OCZQKWFWINJASN-OLZOCXBDSA-N 1 2 303.406 4.167 20 0 DIADLO CC(C)c1nnc(C[N@@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)[nH]1 ZINC000330297541 336137253 /nfs/dbraw/zinc/13/72/53/336137253.db2.gz GYFBRUAHZDNQKK-KRWDZBQOSA-N 1 2 323.444 4.137 20 0 DIADLO CC(C)c1nnc(C[N@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)[nH]1 ZINC000330297541 336137255 /nfs/dbraw/zinc/13/72/55/336137255.db2.gz GYFBRUAHZDNQKK-KRWDZBQOSA-N 1 2 323.444 4.137 20 0 DIADLO C[C@H]([NH2+]Cc1nc(=O)c2sccc2[nH]1)[C@@H](C)C1CCCCC1 ZINC000332120623 336159386 /nfs/dbraw/zinc/15/93/86/336159386.db2.gz YVBIBWDWPHXNNA-NEPJUHHUSA-N 1 2 319.474 4.091 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCCCSc1ccccc1 ZINC000351923145 336178919 /nfs/dbraw/zinc/17/89/19/336178919.db2.gz QGWPYZGOGJFEPA-UHFFFAOYSA-N 1 2 315.442 4.002 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000351931335 336180474 /nfs/dbraw/zinc/18/04/74/336180474.db2.gz PWXITUCBDAQWIQ-HUUCEWRRSA-N 1 2 315.804 4.029 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)c1occ2c1CCC2 ZINC000351951926 336182351 /nfs/dbraw/zinc/18/23/51/336182351.db2.gz PIEBBCCEPFAZPW-UHFFFAOYSA-N 1 2 320.348 4.208 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](C)Cc2ncc(Cl)s2)c1 ZINC000351988353 336186053 /nfs/dbraw/zinc/18/60/53/336186053.db2.gz GEECAYCZJNSONB-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2ncc(Cl)s2)c1 ZINC000351988353 336186054 /nfs/dbraw/zinc/18/60/54/336186054.db2.gz GEECAYCZJNSONB-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO COc1c(C)cc(C[N@H+](C)Cc2ncc(Cl)s2)cc1C ZINC000352005949 336188083 /nfs/dbraw/zinc/18/80/83/336188083.db2.gz ZKHZRBRHVOCEHR-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO COc1c(C)cc(C[N@@H+](C)Cc2ncc(Cl)s2)cc1C ZINC000352005949 336188084 /nfs/dbraw/zinc/18/80/84/336188084.db2.gz ZKHZRBRHVOCEHR-UHFFFAOYSA-N 1 2 310.850 4.054 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+](C)Cc3nccn3C(F)F)cc2c1C ZINC000352020578 336189679 /nfs/dbraw/zinc/18/96/79/336189679.db2.gz IRDIISQZEJACLW-UHFFFAOYSA-N 1 2 318.371 4.008 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+](C)Cc3nccn3C(F)F)cc2c1C ZINC000352020578 336189680 /nfs/dbraw/zinc/18/96/80/336189680.db2.gz IRDIISQZEJACLW-UHFFFAOYSA-N 1 2 318.371 4.008 20 0 DIADLO Cc1ncc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)cn1 ZINC000352024406 336190001 /nfs/dbraw/zinc/19/00/01/336190001.db2.gz GMISSYURDAWEDG-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)cn1 ZINC000352024406 336190002 /nfs/dbraw/zinc/19/00/02/336190002.db2.gz GMISSYURDAWEDG-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO CC1(c2csc(Cc3[nH+]ccn3Cc3ccccc3)n2)CC1 ZINC000352274388 336209442 /nfs/dbraw/zinc/20/94/42/336209442.db2.gz LUJLMTISKYRYHB-UHFFFAOYSA-N 1 2 309.438 4.030 20 0 DIADLO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1nccn1-c1ccccc1 ZINC000352334898 336212927 /nfs/dbraw/zinc/21/29/27/336212927.db2.gz MWMUBSUDLOWMQY-MPGHIAIKSA-N 1 2 321.424 4.440 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)[C@H](C)[C@@H](C)O1 ZINC000526121302 336212983 /nfs/dbraw/zinc/21/29/83/336212983.db2.gz JFKWKJXMDHWSQI-MGPQQGTHSA-N 1 2 308.491 4.189 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)[C@H](C)[C@@H](C)O1 ZINC000526121302 336212984 /nfs/dbraw/zinc/21/29/84/336212984.db2.gz JFKWKJXMDHWSQI-MGPQQGTHSA-N 1 2 308.491 4.189 20 0 DIADLO CC(C)CCOC1CC[NH+](Cc2cc(F)c(F)cc2F)CC1 ZINC000352339099 336213218 /nfs/dbraw/zinc/21/32/18/336213218.db2.gz ZNOBCXKGLVFVPC-UHFFFAOYSA-N 1 2 315.379 4.131 20 0 DIADLO Fc1c(Cl)cccc1C[N@@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000352441201 336218949 /nfs/dbraw/zinc/21/89/49/336218949.db2.gz UBJNWSNFBDYTCH-GOEBONIOSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1c(Cl)cccc1C[N@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000352441201 336218950 /nfs/dbraw/zinc/21/89/50/336218950.db2.gz UBJNWSNFBDYTCH-GOEBONIOSA-N 1 2 309.812 4.013 20 0 DIADLO COC[C@@H](C)CNc1ccc(-c2cn3cccc(C)c3[nH+]2)cc1 ZINC000526123351 336219121 /nfs/dbraw/zinc/21/91/21/336219121.db2.gz PBIHROCULXFYRI-AWEZNQCLSA-N 1 2 309.413 4.004 20 0 DIADLO C[C@@H](CNc1cccc(-c2[nH+]ccn2C)c1)c1ccc(F)cc1 ZINC000526123718 336219147 /nfs/dbraw/zinc/21/91/47/336219147.db2.gz WHSTUWJEKAYFND-AWEZNQCLSA-N 1 2 309.388 4.442 20 0 DIADLO C[C@H](CNc1cccc(-c2[nH+]ccn2C)c1)c1ccc(F)cc1 ZINC000526123719 336219166 /nfs/dbraw/zinc/21/91/66/336219166.db2.gz WHSTUWJEKAYFND-CQSZACIVSA-N 1 2 309.388 4.442 20 0 DIADLO COc1ccccc1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000352773609 336235694 /nfs/dbraw/zinc/23/56/94/336235694.db2.gz STRSDPXDOYTVHJ-UHFFFAOYSA-N 1 2 320.348 4.135 20 0 DIADLO C[C@H]1CC[C@H](c2ccccc2)[N@H+](Cc2nccn2C(F)F)C1 ZINC000352799193 336238546 /nfs/dbraw/zinc/23/85/46/336238546.db2.gz FQPLJCZLHBVVPY-DZGCQCFKSA-N 1 2 305.372 4.251 20 0 DIADLO C[C@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2nccn2C(F)F)C1 ZINC000352799193 336238547 /nfs/dbraw/zinc/23/85/47/336238547.db2.gz FQPLJCZLHBVVPY-DZGCQCFKSA-N 1 2 305.372 4.251 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCc2c(F)ccc(F)c2C1 ZINC000532376668 336243990 /nfs/dbraw/zinc/24/39/90/336243990.db2.gz BIHNTSWBRIIJDF-UHFFFAOYSA-N 1 2 310.347 4.384 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)CC/C=C\c3ccccc3)cc2[nH+]1 ZINC000532440306 336247399 /nfs/dbraw/zinc/24/73/99/336247399.db2.gz VPGNGZXRXRCTSG-UITAMQMPSA-N 1 2 305.381 4.303 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1nccn1C)c1ccccc1)c1ccc(F)cc1 ZINC000532453201 336247871 /nfs/dbraw/zinc/24/78/71/336247871.db2.gz GTRZAOJOPZFKOO-RBUKOAKNSA-N 1 2 323.415 4.390 20 0 DIADLO CC[C@@H]([NH2+][C@@H](c1nccn1C)c1ccccc1)c1ccc(F)cc1 ZINC000532453202 336247940 /nfs/dbraw/zinc/24/79/40/336247940.db2.gz GTRZAOJOPZFKOO-RTBURBONSA-N 1 2 323.415 4.390 20 0 DIADLO Cc1nc(C[NH2+][C@H](CC(C)C)c2ccccn2)nc2ccccc12 ZINC000532490354 336250418 /nfs/dbraw/zinc/25/04/18/336250418.db2.gz UYMBBEGKLACASA-LJQANCHMSA-N 1 2 320.440 4.210 20 0 DIADLO C[N@H+](Cc1cc2ccccc2o1)Cc1nc2c(s1)CCCC2 ZINC000532623180 336257337 /nfs/dbraw/zinc/25/73/37/336257337.db2.gz ADXNXBTXLHLTOI-UHFFFAOYSA-N 1 2 312.438 4.400 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2o1)Cc1nc2c(s1)CCCC2 ZINC000532623180 336257338 /nfs/dbraw/zinc/25/73/38/336257338.db2.gz ADXNXBTXLHLTOI-UHFFFAOYSA-N 1 2 312.438 4.400 20 0 DIADLO COCc1cccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000192703950 336258973 /nfs/dbraw/zinc/25/89/73/336258973.db2.gz VHSZUMRSPODXGG-HNNXBMFYSA-N 1 2 307.397 4.192 20 0 DIADLO COc1cccc2c(N[C@H](C)c3ccc4n[nH]cc4c3)cc[nH+]c12 ZINC000580358783 336259337 /nfs/dbraw/zinc/25/93/37/336259337.db2.gz JMQWEKMSTXNEKM-GFCCVEGCSA-N 1 2 318.380 4.293 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2cnc(C3CCCC3)s2)s1 ZINC000532628426 336260937 /nfs/dbraw/zinc/26/09/37/336260937.db2.gz IHVRAFOTEFBLMN-UHFFFAOYSA-N 1 2 322.503 4.065 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)cc1C ZINC000580389128 336263346 /nfs/dbraw/zinc/26/33/46/336263346.db2.gz MBVOLDHFKFWOAQ-FXAWDEMLSA-N 1 2 319.452 4.477 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@H+](C)Cc1ccccn1 ZINC000104948886 336271909 /nfs/dbraw/zinc/27/19/09/336271909.db2.gz SFHWXDLMBZAIBW-LBPRGKRZSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@@H+](C)Cc1ccccn1 ZINC000104948886 336271910 /nfs/dbraw/zinc/27/19/10/336271910.db2.gz SFHWXDLMBZAIBW-LBPRGKRZSA-N 1 2 305.219 4.037 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2cc(O)cc(C(F)(F)F)c2)n1 ZINC000352837817 336273212 /nfs/dbraw/zinc/27/32/12/336273212.db2.gz CAVQJEUNBJGRCW-SECBINFHSA-N 1 2 316.348 4.027 20 0 DIADLO C[C@@H]1C[C@H](C)N1C(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000526933483 336275394 /nfs/dbraw/zinc/27/53/94/336275394.db2.gz KSASJZOGDWVJTI-TXEJJXNPSA-N 1 2 316.788 4.150 20 0 DIADLO COC(=O)c1sccc1C[NH2+][C@@H](C)c1cc2ccccc2o1 ZINC000182622374 336275858 /nfs/dbraw/zinc/27/58/58/336275858.db2.gz XIZLMZBLVXXZMO-NSHDSACASA-N 1 2 315.394 4.132 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CCCC2)no1)c1cc2ccccc2o1 ZINC000182627749 336276660 /nfs/dbraw/zinc/27/66/60/336276660.db2.gz VFSHXDTXSOKTCP-LBPRGKRZSA-N 1 2 311.385 4.324 20 0 DIADLO COc1cc(-c2ccccc2)ccc1C[NH2+]Cc1ncccc1F ZINC000526990760 336278025 /nfs/dbraw/zinc/27/80/25/336278025.db2.gz YRLGQFUXTRVUMO-UHFFFAOYSA-N 1 2 322.383 4.186 20 0 DIADLO C[C@H]([NH2+]Cc1noc(-c2ccccc2)n1)c1cc2ccccc2o1 ZINC000182644490 336278247 /nfs/dbraw/zinc/27/82/47/336278247.db2.gz FOUWODGOMAJLOI-ZDUSSCGKSA-N 1 2 319.364 4.334 20 0 DIADLO COc1ccc([C@H]2CCCN2c2cc(C)[nH+]c(C(C)C)n2)cc1 ZINC000301056919 336287556 /nfs/dbraw/zinc/28/75/56/336287556.db2.gz IDNLZXQINSRBRE-QGZVFWFLSA-N 1 2 311.429 4.259 20 0 DIADLO Cc1ccc(CNc2cc(C)[nH+]c(-c3cccnc3)n2)c(C)c1 ZINC000301130063 336291436 /nfs/dbraw/zinc/29/14/36/336291436.db2.gz ZQJXATLFRBHJIE-UHFFFAOYSA-N 1 2 304.397 4.076 20 0 DIADLO CCc1cc(N[C@@H]2C[C@H]2c2ccccc2)nc(-c2ccncc2)[nH+]1 ZINC000301186099 336293855 /nfs/dbraw/zinc/29/38/55/336293855.db2.gz UWATVKWRXXOUGT-ZWKOTPCHSA-N 1 2 316.408 4.069 20 0 DIADLO CCc1cc(N[C@@H]2C[C@@H]2c2ccccc2)nc(-c2ccncc2)[nH+]1 ZINC000301186096 336293864 /nfs/dbraw/zinc/29/38/64/336293864.db2.gz UWATVKWRXXOUGT-QZTJIDSGSA-N 1 2 316.408 4.069 20 0 DIADLO CCc1cc(N2CCC[C@H]2CC(C)C)nc(-c2ccncc2)[nH+]1 ZINC000301187809 336293928 /nfs/dbraw/zinc/29/39/28/336293928.db2.gz WMFFYFXBPXIPCD-KRWDZBQOSA-N 1 2 310.445 4.116 20 0 DIADLO Brc1cccc2c(NCc3ccco3)cc[nH+]c12 ZINC000301199037 336294483 /nfs/dbraw/zinc/29/44/83/336294483.db2.gz LNPPZAHKMQBDLF-UHFFFAOYSA-N 1 2 303.159 4.202 20 0 DIADLO CC(C)c1nc(N[C@H]2CCSc3ccc(F)cc32)cc[nH+]1 ZINC000301251064 336296823 /nfs/dbraw/zinc/29/68/23/336296823.db2.gz JDBLDKZYQOHCSU-ZDUSSCGKSA-N 1 2 303.406 4.388 20 0 DIADLO COc1cc([C@@H](C)Nc2cc(C)[nH+]cn2)ccc1OCC(C)C ZINC000301265497 336297605 /nfs/dbraw/zinc/29/76/05/336297605.db2.gz TZOATZMNNLWTNA-CQSZACIVSA-N 1 2 315.417 4.002 20 0 DIADLO Cc1cc(NCc2ccc(COCc3ccccc3)cc2)nc[nH+]1 ZINC000301286700 336298883 /nfs/dbraw/zinc/29/88/83/336298883.db2.gz ZJLNETYAGKIQIG-UHFFFAOYSA-N 1 2 319.408 4.114 20 0 DIADLO Cc1cc(NCc2ccccc2COCc2ccccc2)nc[nH+]1 ZINC000301288002 336298927 /nfs/dbraw/zinc/29/89/27/336298927.db2.gz ZXJPYOCHYVOJDK-UHFFFAOYSA-N 1 2 319.408 4.114 20 0 DIADLO Cc1[nH+]c(-c2ccncc2)nc(NCCSC(C)(C)C)c1C ZINC000301295680 336299402 /nfs/dbraw/zinc/29/94/02/336299402.db2.gz VOFFOCYPKDBIGQ-UHFFFAOYSA-N 1 2 316.474 4.099 20 0 DIADLO CCc1cc(N(C)[C@H](C)c2ccccc2)nc(-c2ccncc2)[nH+]1 ZINC000301304768 336299933 /nfs/dbraw/zinc/29/99/33/336299933.db2.gz ZLOAWWVHTJOBED-OAHLLOKOSA-N 1 2 318.424 4.298 20 0 DIADLO CC(C)Oc1cccc([C@@H](O)CNc2ccc3ccccc3[nH+]2)c1 ZINC000301323500 336300696 /nfs/dbraw/zinc/30/06/96/336300696.db2.gz WAPCPUOOXCQBQR-IBGZPJMESA-N 1 2 322.408 4.168 20 0 DIADLO Cc1cc(N[C@H](COCc2ccccc2)c2ccccc2)nc[nH+]1 ZINC000301379767 336303579 /nfs/dbraw/zinc/30/35/79/336303579.db2.gz XVRRGPKXBOOIMF-LJQANCHMSA-N 1 2 319.408 4.155 20 0 DIADLO Cc1cc(N[C@@H](C)c2cccc(-n3cccn3)c2)nc(C(C)C)[nH+]1 ZINC000301417645 336305318 /nfs/dbraw/zinc/30/53/18/336305318.db2.gz GLOYFNZFYCZOBZ-HNNXBMFYSA-N 1 2 321.428 4.267 20 0 DIADLO Cc1cc(N[C@H](C)c2cccc(-n3cccn3)c2)nc(C(C)C)[nH+]1 ZINC000301417646 336305358 /nfs/dbraw/zinc/30/53/58/336305358.db2.gz GLOYFNZFYCZOBZ-OAHLLOKOSA-N 1 2 321.428 4.267 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc(-n3cccn3)cc2)nc(C(C)C)[nH+]1 ZINC000301455418 336307860 /nfs/dbraw/zinc/30/78/60/336307860.db2.gz RUSHJKPUTUVWQC-OAHLLOKOSA-N 1 2 321.428 4.267 20 0 DIADLO C[C@@H]1CN(c2cc(C(F)(F)F)cc[nH+]2)C[C@@H](c2ccccc2)O1 ZINC000301456077 336307915 /nfs/dbraw/zinc/30/79/15/336307915.db2.gz WOCITLHCQPBJJK-DOMZBBRYSA-N 1 2 322.330 4.067 20 0 DIADLO c1ccc([C@@H](Nc2cc(N3CCCCC3)nc[nH+]2)C2CC2)cc1 ZINC000301494883 336310288 /nfs/dbraw/zinc/31/02/88/336310288.db2.gz AGSLKOQOJUEZBR-LJQANCHMSA-N 1 2 308.429 4.030 20 0 DIADLO c1ccc([C@@H](Nc2cc(N3CCCCC3)[nH+]cn2)C2CC2)cc1 ZINC000301494883 336310289 /nfs/dbraw/zinc/31/02/89/336310289.db2.gz AGSLKOQOJUEZBR-LJQANCHMSA-N 1 2 308.429 4.030 20 0 DIADLO CO[C@H](CNc1cc(C(F)(F)F)cc[nH+]1)c1ccc(F)cc1 ZINC000301529117 336312763 /nfs/dbraw/zinc/31/27/63/336312763.db2.gz HAXGGOMQPBFEOL-CYBMUJFWSA-N 1 2 314.282 4.039 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N[C@H]2CCCN(c3ccccc3)C2)c1 ZINC000301529887 336312791 /nfs/dbraw/zinc/31/27/91/336312791.db2.gz RIYULVCBHKSEEC-AWEZNQCLSA-N 1 2 321.346 4.181 20 0 DIADLO COc1ccc([C@H](C)N(C)c2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000301535880 336313065 /nfs/dbraw/zinc/31/30/65/336313065.db2.gz UBAIEYDJOUYXIY-NSHDSACASA-N 1 2 310.319 4.306 20 0 DIADLO Cc1ccc(-c2nc(CNc3cc[nH+]c(C(C)(C)C)n3)co2)cc1 ZINC000301564592 336315253 /nfs/dbraw/zinc/31/52/53/336315253.db2.gz JJJNOFWDDDBZAI-UHFFFAOYSA-N 1 2 322.412 4.350 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NCc2coc(-c3ccccc3)n2)c1 ZINC000301567124 336315374 /nfs/dbraw/zinc/31/53/74/336315374.db2.gz QEFNUXLMUOBBDH-UHFFFAOYSA-N 1 2 319.286 4.368 20 0 DIADLO COc1ccc([C@H]2CCCN2c2nc(C)[nH+]c3c2CCCC3)cc1 ZINC000301592473 336317008 /nfs/dbraw/zinc/31/70/08/336317008.db2.gz YOPQUANNIOIAJT-LJQANCHMSA-N 1 2 323.440 4.014 20 0 DIADLO Cc1cc(N2CCC(N(C)c3ccccc3)CC2)nc(C(C)C)[nH+]1 ZINC000301601026 336317569 /nfs/dbraw/zinc/31/75/69/336317569.db2.gz VEVLJVHJVDOQBK-UHFFFAOYSA-N 1 2 324.472 4.014 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccccc2-n2cccn2)nc(C(C)C)[nH+]1 ZINC000301614912 336318380 /nfs/dbraw/zinc/31/83/80/336318380.db2.gz BCCFXYWLCAIVMZ-HNNXBMFYSA-N 1 2 321.428 4.267 20 0 DIADLO Cc1cc(NCc2nc(C(C)(C)C)cs2)nc(C(C)C)[nH+]1 ZINC000301631774 336319534 /nfs/dbraw/zinc/31/95/34/336319534.db2.gz JKCSSUNCJBJNJX-UHFFFAOYSA-N 1 2 304.463 4.275 20 0 DIADLO Cc1cc(N[C@H](CCO)c2ccccc2)c2cccc(F)c2[nH+]1 ZINC000301646311 336320566 /nfs/dbraw/zinc/32/05/66/336320566.db2.gz CYZSBKDVOQFSRG-QGZVFWFLSA-N 1 2 310.372 4.218 20 0 DIADLO C[C@H]1CCN(c2ncc(-c3ccccc3)s2)C[C@H]1n1cc[nH+]c1 ZINC000301649692 336320728 /nfs/dbraw/zinc/32/07/28/336320728.db2.gz RKRXTNZDCDCCOA-GOEBONIOSA-N 1 2 324.453 4.094 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)c1cc(C)[nH+]cn1 ZINC000301652563 336320845 /nfs/dbraw/zinc/32/08/45/336320845.db2.gz TVVOOKCCJOXEJH-AWEZNQCLSA-N 1 2 324.453 4.414 20 0 DIADLO Cc1cc(N[C@@H]2CCC[C@@H]3OCC[C@H]32)c2cccc(F)c2[nH+]1 ZINC000301653746 336321056 /nfs/dbraw/zinc/32/10/56/336321056.db2.gz ABDDRIUSKYNAMX-MJEQTWJJSA-N 1 2 300.377 4.052 20 0 DIADLO FC(F)(F)c1cc[nH+]c(N2CCOC3(C2)CCCCCC3)c1 ZINC000301665634 336321964 /nfs/dbraw/zinc/32/19/64/336321964.db2.gz LYSQLVANFAQHGZ-UHFFFAOYSA-N 1 2 314.351 4.030 20 0 DIADLO Cc1cc(NC[C@@H](CCO)c2ccccc2)c2cccc(F)c2[nH+]1 ZINC000301668600 336322216 /nfs/dbraw/zinc/32/22/16/336322216.db2.gz MPWSZSUDKSPYCO-MRXNPFEDSA-N 1 2 324.399 4.260 20 0 DIADLO c1ccc(N(Cc2cccc(-c3cccnc3)c2)C2CC2)[nH+]c1 ZINC000301696574 336324067 /nfs/dbraw/zinc/32/40/67/336324067.db2.gz BLKXCZFBSDHKRC-UHFFFAOYSA-N 1 2 301.393 4.313 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCO[C@@H](c2cccs2)C1 ZINC000301704517 336324553 /nfs/dbraw/zinc/32/45/53/336324553.db2.gz FYWLNSWILUDACN-MRXNPFEDSA-N 1 2 310.422 4.183 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N[C@@H]1CCO[C@@]2(CCSC2)C1 ZINC000301718180 336325485 /nfs/dbraw/zinc/32/54/85/336325485.db2.gz LHYCQEILEUYSBI-QAPCUYQASA-N 1 2 314.454 4.010 20 0 DIADLO Cc1ncc(CNc2cc(C(C)(C)C)[nH+]c(C(C)(C)C)n2)s1 ZINC000301736335 336326488 /nfs/dbraw/zinc/32/64/88/336326488.db2.gz RJCLYYIQRXPKNP-UHFFFAOYSA-N 1 2 318.490 4.449 20 0 DIADLO CC(C)(C)c1cc(NCc2cscn2)nc(C(C)(C)C)[nH+]1 ZINC000301743428 336327115 /nfs/dbraw/zinc/32/71/15/336327115.db2.gz VWPZYQSRYRLRHJ-UHFFFAOYSA-N 1 2 304.463 4.140 20 0 DIADLO C[C@H](C[C@@H](O)c1ccccc1)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000301753512 336327802 /nfs/dbraw/zinc/32/78/02/336327802.db2.gz WCJGAVQCVCQQGT-BXUZGUMPSA-N 1 2 310.319 4.025 20 0 DIADLO CC(C)(C)c1nc(NCc2cccc(-c3ccccn3)c2)cc[nH+]1 ZINC000301767439 336328569 /nfs/dbraw/zinc/32/85/69/336328569.db2.gz DNAXPZTZMNIDRX-UHFFFAOYSA-N 1 2 318.424 4.448 20 0 DIADLO Cc1cc(NCc2cnc(CC(C)C)s2)nc(C(C)C)[nH+]1 ZINC000301799539 336330723 /nfs/dbraw/zinc/33/07/23/336330723.db2.gz SAWOEDBDKUKCDX-UHFFFAOYSA-N 1 2 304.463 4.176 20 0 DIADLO Cc1c[nH+]ccc1CCNc1ncc(C(F)(F)F)cc1Cl ZINC000301819522 336332245 /nfs/dbraw/zinc/33/22/45/336332245.db2.gz FXRDBTFMLXXEEG-UHFFFAOYSA-N 1 2 315.726 4.112 20 0 DIADLO CCc1ccc([C@H](C)Nc2[nH+]cnc3c2cnn3C(C)(C)C)cc1 ZINC000301840427 336333482 /nfs/dbraw/zinc/33/34/82/336333482.db2.gz OUKCWKMZYNMMPT-ZDUSSCGKSA-N 1 2 323.444 4.317 20 0 DIADLO Cc1ccc([C@@H](C)N(C)c2[nH+]cnc3c2cnn3C(C)(C)C)cc1 ZINC000301856287 336334558 /nfs/dbraw/zinc/33/45/58/336334558.db2.gz CECBKJMVDHGCJN-CQSZACIVSA-N 1 2 323.444 4.087 20 0 DIADLO Cc1ccc([C@@H](C)Nc2[nH+]cnc3c2cnn3C(C)(C)C)s1 ZINC000301878834 336335863 /nfs/dbraw/zinc/33/58/63/336335863.db2.gz JKYRUVOKUGORAE-LLVKDONJSA-N 1 2 315.446 4.124 20 0 DIADLO CC(C)c1cc(NCc2ccc(O)c(F)c2)nc(C(C)C)[nH+]1 ZINC000301882109 336336008 /nfs/dbraw/zinc/33/60/08/336336008.db2.gz WNITUGBBGQZCKH-UHFFFAOYSA-N 1 2 303.381 4.180 20 0 DIADLO CC[C@H](Nc1[nH+]cnc2c1cnn2C(C)(C)C)c1ccc(C)cc1 ZINC000301884465 336336051 /nfs/dbraw/zinc/33/60/51/336336051.db2.gz LNQDDZIQDNNIFN-INIZCTEOSA-N 1 2 323.444 4.453 20 0 DIADLO CC(C)Oc1cccc([C@H](C)Nc2nc(N)c3ccccc3[nH+]2)c1 ZINC000301884794 336336286 /nfs/dbraw/zinc/33/62/86/336336286.db2.gz OFAYDXKQLGPGPZ-ZDUSSCGKSA-N 1 2 322.412 4.172 20 0 DIADLO CC[C@@H](Nc1nc(N)c2ccccc2[nH+]1)c1cc(F)ccc1F ZINC000301889408 336336442 /nfs/dbraw/zinc/33/64/42/336336442.db2.gz LHYGNUSQAYHFTP-CQSZACIVSA-N 1 2 314.339 4.053 20 0 DIADLO C[C@H](c1ccccc1)[C@H](C)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC000301891148 336336478 /nfs/dbraw/zinc/33/64/78/336336478.db2.gz OBTSYFMNAWJFPQ-KBPBESRZSA-N 1 2 323.444 4.185 20 0 DIADLO Cc1cc(N[C@H](C)C[C@H](O)c2ccco2)c2cccc(F)c2[nH+]1 ZINC000301892290 336336492 /nfs/dbraw/zinc/33/64/92/336336492.db2.gz MGTDVFGFLQSTQH-WBMJQRKESA-N 1 2 314.360 4.199 20 0 DIADLO Cc1cccc([C@@H](C)Nc2[nH+]cnc3c2cnn3C(C)(C)C)c1C ZINC000301902256 336337367 /nfs/dbraw/zinc/33/73/67/336337367.db2.gz WHGZIVMTCMPGHH-CQSZACIVSA-N 1 2 323.444 4.371 20 0 DIADLO CCc1ncnc(Nc2cccc(Oc3cc[nH+]cc3)c2)c1F ZINC000301963390 336340213 /nfs/dbraw/zinc/34/02/13/336340213.db2.gz IYMJBINOYTUJNV-UHFFFAOYSA-N 1 2 310.332 4.109 20 0 DIADLO CCc1cc(N2CC[C@]3(CC[C@H](C)C3)C2)nc(-c2ccncc2)[nH+]1 ZINC000302033327 336344396 /nfs/dbraw/zinc/34/43/96/336344396.db2.gz DBBVLOLNIWWRKJ-YWZLYKJASA-N 1 2 322.456 4.118 20 0 DIADLO CCc1cc(N2C[C@H](C)[C@@H]3CCCC[C@@H]32)nc(-c2ccncc2)[nH+]1 ZINC000302066109 336346473 /nfs/dbraw/zinc/34/64/73/336346473.db2.gz AWEJQJAECIROMY-WBAXXEDZSA-N 1 2 322.456 4.116 20 0 DIADLO CNc1ccc(Nc2cnc3cc(Cl)c(Cl)cc3n2)c[nH+]1 ZINC000302076281 336347229 /nfs/dbraw/zinc/34/72/29/336347229.db2.gz HFLKRHHFQDKGNY-UHFFFAOYSA-N 1 2 320.183 4.117 20 0 DIADLO CC(C)c1nc(NCc2ccccc2N2CCCCC2)cc[nH+]1 ZINC000302083035 336347738 /nfs/dbraw/zinc/34/77/38/336347738.db2.gz YNDRECFYPLBGRW-UHFFFAOYSA-N 1 2 310.445 4.202 20 0 DIADLO Cc1csc([C@H](C)CNc2cc(C(F)(F)F)cc[nH+]2)n1 ZINC000302134959 336350131 /nfs/dbraw/zinc/35/01/31/336350131.db2.gz LYUGCFWTBLBUHV-MRVPVSSYSA-N 1 2 301.337 4.081 20 0 DIADLO Cc1cc(NC[C@H](C)c2nccs2)c2cccc(F)c2[nH+]1 ZINC000302136111 336350191 /nfs/dbraw/zinc/35/01/91/336350191.db2.gz MNNHXFUGPXYECM-JTQLQIEISA-N 1 2 301.390 4.354 20 0 DIADLO FC(F)c1ccc(CNc2cc(N3CCCCC3)nc[nH+]2)cc1 ZINC000302150968 336351040 /nfs/dbraw/zinc/35/10/40/336351040.db2.gz BLDSJCVEOVMWJA-UHFFFAOYSA-N 1 2 318.371 4.017 20 0 DIADLO FC(F)c1ccc(CNc2cc(N3CCCCC3)[nH+]cn2)cc1 ZINC000302150968 336351041 /nfs/dbraw/zinc/35/10/41/336351041.db2.gz BLDSJCVEOVMWJA-UHFFFAOYSA-N 1 2 318.371 4.017 20 0 DIADLO CC(C)c1cc(N(C)C[C@H](C)c2nccs2)nc(C(C)C)[nH+]1 ZINC000302197042 336353433 /nfs/dbraw/zinc/35/34/33/336353433.db2.gz XUHANJRQCKGVOL-ZDUSSCGKSA-N 1 2 318.490 4.420 20 0 DIADLO COc1ccc2[nH+]c(NCCC[C@H]3CCCCO3)ccc2c1 ZINC000302217884 336354519 /nfs/dbraw/zinc/35/45/19/336354519.db2.gz KMAPZYDBRKRULT-OAHLLOKOSA-N 1 2 300.402 4.005 20 0 DIADLO FC(F)(F)[C@H](CNc1cc[nH+]c(C2CC2)n1)c1ccccc1 ZINC000302351200 336357493 /nfs/dbraw/zinc/35/74/93/336357493.db2.gz BADFTSKLPMAORO-CYBMUJFWSA-N 1 2 307.319 4.112 20 0 DIADLO COc1cccc2c(N[C@H]3CCc4c3cccc4O)cc[nH+]c12 ZINC000302522758 336360890 /nfs/dbraw/zinc/36/08/90/336360890.db2.gz JGOPRTHNEDFIGT-HNNXBMFYSA-N 1 2 306.365 4.048 20 0 DIADLO Cc1cc(N2CCC([C@H]3CCCO3)CC2)c2cccc(F)c2[nH+]1 ZINC000302556943 336361561 /nfs/dbraw/zinc/36/15/61/336361561.db2.gz LSWIYWJEWNGHIO-GOSISDBHSA-N 1 2 314.404 4.078 20 0 DIADLO CCO[C@H](CNc1cc(C(F)(F)F)cc[nH+]1)c1ccccc1 ZINC000302837548 336371529 /nfs/dbraw/zinc/37/15/29/336371529.db2.gz XRODCWLJPNFXDC-CQSZACIVSA-N 1 2 310.319 4.290 20 0 DIADLO COC[C@@H](Nc1cc[nH+]c(C(C)C)n1)c1ccc(Cl)cc1 ZINC000302859000 336372130 /nfs/dbraw/zinc/37/21/30/336372130.db2.gz NSPRCOLSBVKXGA-CQSZACIVSA-N 1 2 305.809 4.053 20 0 DIADLO Cc1cccc([C@@H]2CCCCN2c2nc[nH+]c(N)c2Cl)c1C ZINC000302876255 336372814 /nfs/dbraw/zinc/37/28/14/336372814.db2.gz FLRMNFCFBMAELX-AWEZNQCLSA-N 1 2 316.836 4.061 20 0 DIADLO COC[C@@H](Nc1cc(C(C)(C)C)[nH+]c(C(C)C)n1)c1ccco1 ZINC000302881468 336373081 /nfs/dbraw/zinc/37/30/81/336373081.db2.gz HZHQIMYVPVLUJE-CYBMUJFWSA-N 1 2 317.433 4.290 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)s1 ZINC000352947187 336378833 /nfs/dbraw/zinc/37/88/33/336378833.db2.gz OXRKORWMDYQZBJ-ONGXEEELSA-N 1 2 324.437 4.169 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)s1 ZINC000352947187 336378834 /nfs/dbraw/zinc/37/88/34/336378834.db2.gz OXRKORWMDYQZBJ-ONGXEEELSA-N 1 2 324.437 4.169 20 0 DIADLO Cn1ccnc1[C@H]([NH2+]Cc1c(Cl)oc2ccccc21)C1CC1 ZINC000353039599 336387854 /nfs/dbraw/zinc/38/78/54/336387854.db2.gz QTHGCEHEPSLYBN-OAHLLOKOSA-N 1 2 315.804 4.061 20 0 DIADLO CCCOc1cccc2c(NCc3c(C)noc3C)cc[nH+]c12 ZINC000194707217 336393031 /nfs/dbraw/zinc/39/30/31/336393031.db2.gz RSHAILVIDSUVCQ-UHFFFAOYSA-N 1 2 311.385 4.241 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc2nc(C(F)F)sc2c1 ZINC000418056660 336398077 /nfs/dbraw/zinc/39/80/77/336398077.db2.gz KRBMDCICCBPCHZ-UHFFFAOYSA-N 1 2 308.357 4.062 20 0 DIADLO Cc1[nH+]c(-c2ccncc2)nc(N[C@H](C)c2cccc(O)c2)c1C ZINC000113247242 336400461 /nfs/dbraw/zinc/40/04/61/336400461.db2.gz PEOZFEBZKMTYFK-CQSZACIVSA-N 1 2 320.396 4.034 20 0 DIADLO Clc1cc(C[NH+]2Cc3ccccc3C2)cc2c1OCCCO2 ZINC000353394682 336415165 /nfs/dbraw/zinc/41/51/65/336415165.db2.gz NDGHORJGCDGACI-UHFFFAOYSA-N 1 2 315.800 4.017 20 0 DIADLO CCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(C)on2)cc1OC ZINC000353427020 336417292 /nfs/dbraw/zinc/41/72/92/336417292.db2.gz OBRYJTLNLWFXOR-KGLIPLIRSA-N 1 2 318.417 4.192 20 0 DIADLO COCc1nc(C[NH2+][C@H](c2ccc(C)o2)C2CCCC2)cs1 ZINC000353642430 336430944 /nfs/dbraw/zinc/43/09/44/336430944.db2.gz LPDOAGQBIKZSGP-KRWDZBQOSA-N 1 2 320.458 4.212 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(F)cn1 ZINC000354027786 336455185 /nfs/dbraw/zinc/45/51/85/336455185.db2.gz CJHOKNWTFSOPOE-MRXNPFEDSA-N 1 2 305.422 4.042 20 0 DIADLO CCc1c(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)ccn1C ZINC000354396105 336469357 /nfs/dbraw/zinc/46/93/57/336469357.db2.gz RJBBENRZYXNZFW-UHFFFAOYSA-N 1 2 321.380 4.027 20 0 DIADLO CC(C)n1cc2c(n1)C[C@@H](Nc1[nH+]ccc3ccc(F)cc31)CC2 ZINC000354874923 336485860 /nfs/dbraw/zinc/48/58/60/336485860.db2.gz IHBPQXOAIXJXGL-INIZCTEOSA-N 1 2 324.403 4.121 20 0 DIADLO CCSc1ccccc1[C@@H](C)[NH2+][C@H](C)c1nnc(C)s1 ZINC000354973028 336489657 /nfs/dbraw/zinc/48/96/57/336489657.db2.gz VXYHORJSLGEVMW-GHMZBOCLSA-N 1 2 307.488 4.370 20 0 DIADLO Cc1[nH+]cc(CN(CC(F)F)CC2CCC2)n1-c1ccccc1 ZINC000355141324 336496228 /nfs/dbraw/zinc/49/62/28/336496228.db2.gz XRLJGMJHQYGNBB-UHFFFAOYSA-N 1 2 319.399 4.048 20 0 DIADLO C[C@H](CC(C)(C)C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000355648774 336517749 /nfs/dbraw/zinc/51/77/49/336517749.db2.gz JQRQUCZWIOCHCT-GFCCVEGCSA-N 1 2 303.381 4.022 20 0 DIADLO COCc1cc(N2CCC[C@@H](C)CC2)c2cc(F)ccc2[nH+]1 ZINC000357232734 336577635 /nfs/dbraw/zinc/57/76/35/336577635.db2.gz XXACNAPOAWEOPI-CYBMUJFWSA-N 1 2 302.393 4.147 20 0 DIADLO CC1(CNC(=O)c2ccc(Oc3cc[nH+]cc3)c(Cl)c2)CC1 ZINC000357234935 336577801 /nfs/dbraw/zinc/57/78/01/336577801.db2.gz YNBDLHZYBSOOFJ-UHFFFAOYSA-N 1 2 316.788 4.057 20 0 DIADLO COCc1cc(N2CC3(CCC3)C[C@H]2C)c2cc(F)ccc2[nH+]1 ZINC000357669223 336593824 /nfs/dbraw/zinc/59/38/24/336593824.db2.gz XMRYQFIGTYJEDA-CYBMUJFWSA-N 1 2 314.404 4.289 20 0 DIADLO Cc1ccncc1[C@@H](C)[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000357786083 336598436 /nfs/dbraw/zinc/59/84/36/336598436.db2.gz VEACCKTUTFIRSY-RHSMWYFYSA-N 1 2 309.438 4.287 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1ccc(C2CCC2)cc1 ZINC000357952295 336604359 /nfs/dbraw/zinc/60/43/59/336604359.db2.gz AWSINOSIRSOAPT-UHFFFAOYSA-N 1 2 317.392 4.392 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2cc(-c3ccc(C)cc3)no2)cs1 ZINC000358080592 336610314 /nfs/dbraw/zinc/61/03/14/336610314.db2.gz JLJNLEUXQQMEGF-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1ccc(CNc2c(F)cccc2Br)c(C)[nH+]1 ZINC000358211889 336617125 /nfs/dbraw/zinc/61/71/25/336617125.db2.gz OTICBHYBYFPNSV-UHFFFAOYSA-N 1 2 309.182 4.212 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]Cc1nnc(C(C)C)s1 ZINC000358299428 336622490 /nfs/dbraw/zinc/62/24/90/336622490.db2.gz OIJHKVONVQURAX-SNVBAGLBSA-N 1 2 324.519 4.401 20 0 DIADLO Cc1cccc2[nH+]c(CSCc3ncc(Cl)s3)cn21 ZINC000358662216 336638651 /nfs/dbraw/zinc/63/86/51/336638651.db2.gz OUNZUXARACBAAJ-UHFFFAOYSA-N 1 2 309.847 4.186 20 0 DIADLO Cc1ccc(CSc2cc3c(cc2Cl)OCCO3)c(C)[nH+]1 ZINC000358860061 336645301 /nfs/dbraw/zinc/64/53/01/336645301.db2.gz QOLZHTXGJPFONN-UHFFFAOYSA-N 1 2 321.829 4.415 20 0 DIADLO Cc1ccc(N[C@H]2CCCc3nn(-c4ccccc4)cc32)c[nH+]1 ZINC000358984278 336651318 /nfs/dbraw/zinc/65/13/18/336651318.db2.gz IUZPFTFUQJSLOI-SFHVURJKSA-N 1 2 304.397 4.065 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCC[S@@](=O)[C@H](C)C(C)C ZINC000359916409 336692870 /nfs/dbraw/zinc/69/28/70/336692870.db2.gz GWXTXJFRZBSHJD-IVZQSRNASA-N 1 2 320.502 4.308 20 0 DIADLO CC(C)[C@]1(C)C[C@@H]1C(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000360699908 336719243 /nfs/dbraw/zinc/71/92/43/336719243.db2.gz ADVWQRYQKSQUIB-KUHUBIRLSA-N 1 2 311.429 4.071 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccc(OC3CCCC3)nc2)cs1 ZINC000361097301 336738372 /nfs/dbraw/zinc/73/83/72/336738372.db2.gz ORWIQDSOIRLASE-GFCCVEGCSA-N 1 2 317.458 4.019 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H](C)c3cc4ccccc4o3)ccc2[nH+]1 ZINC000361154893 336741632 /nfs/dbraw/zinc/74/16/32/336741632.db2.gz RKDXRVHVTIVYMR-ZDUSSCGKSA-N 1 2 319.364 4.131 20 0 DIADLO CC[C@H]([NH2+][C@@H]1CCOc2c(F)ccc(F)c21)c1ccc(F)cn1 ZINC000361181403 336742733 /nfs/dbraw/zinc/74/27/33/336742733.db2.gz MAHIWZXGINVSHR-DZGCQCFKSA-N 1 2 322.330 4.063 20 0 DIADLO C[C@@H]([NH2+]Cc1noc2c1CCCC2)c1ccccc1C(F)(F)F ZINC000367641158 336827214 /nfs/dbraw/zinc/82/72/14/336827214.db2.gz BZFSYSBMDJTPNO-LLVKDONJSA-N 1 2 324.346 4.423 20 0 DIADLO Cc1csc(C[NH2+][C@@H](c2ccc(C)cc2)c2ccccn2)n1 ZINC000369311308 336862254 /nfs/dbraw/zinc/86/22/54/336862254.db2.gz FVJFZHDSTQJCKA-SFHVURJKSA-N 1 2 309.438 4.034 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)/C=C/C1CCCCC1 ZINC000370716343 336891964 /nfs/dbraw/zinc/89/19/64/336891964.db2.gz LJMNYXBKTYUDDF-FMQWLBJXSA-N 1 2 315.461 4.093 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cc3ccccc3o2)[nH+]1 ZINC000371246877 336898379 /nfs/dbraw/zinc/89/83/79/336898379.db2.gz IAZBSXAFUMVANO-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)cs1 ZINC000371545545 336907641 /nfs/dbraw/zinc/90/76/41/336907641.db2.gz ISQLBIGJZJHART-AWEZNQCLSA-N 1 2 322.861 4.362 20 0 DIADLO C[C@H]([NH2+]Cc1ncoc1-c1ccccc1)c1cccc(F)c1F ZINC000373181345 336950653 /nfs/dbraw/zinc/95/06/53/336950653.db2.gz ZZCLKQDJJQQVRO-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cccc(Cl)c1 ZINC000373703704 336969720 /nfs/dbraw/zinc/96/97/20/336969720.db2.gz XEDBEOHVBVKVDC-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)CCC1CCCCC1 ZINC000373734812 336970460 /nfs/dbraw/zinc/97/04/60/336970460.db2.gz DTHKOIIEZOFIGC-QGZVFWFLSA-N 1 2 317.477 4.317 20 0 DIADLO CCCCC1CCC(C(=O)N2CCC[C@@H]2c2[nH]cc[nH+]2)CC1 ZINC000374472971 336990124 /nfs/dbraw/zinc/99/01/24/336990124.db2.gz SCKNBMVANCWVTI-UYSNPLJNSA-N 1 2 303.450 4.070 20 0 DIADLO Cc1ccc(CNc2ccc(-c3cn4c([nH+]3)CCCC4)cc2)o1 ZINC000122080687 336991856 /nfs/dbraw/zinc/99/18/56/336991856.db2.gz SMXNYQJFMVOVLZ-UHFFFAOYSA-N 1 2 307.397 4.400 20 0 DIADLO Cc1ccnc(C2CCN(c3[nH+]c4ccccc4cc3C)CC2)n1 ZINC000374925257 336999526 /nfs/dbraw/zinc/99/95/26/336999526.db2.gz IIPRMMLOUUJVFY-UHFFFAOYSA-N 1 2 318.424 4.026 20 0 DIADLO Fc1cc(Cl)cc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c1 ZINC000485689832 337000441 /nfs/dbraw/zinc/00/04/41/337000441.db2.gz AAVYSYFLYYMJOJ-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1cc(Cl)cc(C[N@H+]2CCO[C@H](c3ccccc3)C2)c1 ZINC000485689832 337000442 /nfs/dbraw/zinc/00/04/42/337000442.db2.gz AAVYSYFLYYMJOJ-KRWDZBQOSA-N 1 2 305.780 4.053 20 0 DIADLO C[C@@H](C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1)c1ccc2ccccc2c1 ZINC000375065424 337002355 /nfs/dbraw/zinc/00/23/55/337002355.db2.gz MJTWLKXEZMSOEU-KDOFPFPSSA-N 1 2 319.408 4.030 20 0 DIADLO CCc1nc([C@H](C)Nc2cc[nH+]c3c(OC)cccc23)cs1 ZINC000193482987 337007094 /nfs/dbraw/zinc/00/70/94/337007094.db2.gz BYVUSZPKSYNSCO-NSHDSACASA-N 1 2 313.426 4.435 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](CCCCC(F)(F)F)CCO2)c(F)c1 ZINC000375296528 337007389 /nfs/dbraw/zinc/00/73/89/337007389.db2.gz AHMPQDXGGUXRRZ-CQSZACIVSA-N 1 2 323.305 4.071 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](CCCCC(F)(F)F)CCO2)c(F)c1 ZINC000375296528 337007390 /nfs/dbraw/zinc/00/73/90/337007390.db2.gz AHMPQDXGGUXRRZ-CQSZACIVSA-N 1 2 323.305 4.071 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](CCCCC(F)(F)F)CCO2)c(F)c1 ZINC000375296527 337007413 /nfs/dbraw/zinc/00/74/13/337007413.db2.gz AHMPQDXGGUXRRZ-AWEZNQCLSA-N 1 2 323.305 4.071 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](CCCCC(F)(F)F)CCO2)c(F)c1 ZINC000375296527 337007414 /nfs/dbraw/zinc/00/74/14/337007414.db2.gz AHMPQDXGGUXRRZ-AWEZNQCLSA-N 1 2 323.305 4.071 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cc3[nH]ccc3s2)[nH+]1 ZINC000375659433 337015853 /nfs/dbraw/zinc/01/58/53/337015853.db2.gz WJXFKQUOSCBJOK-UHFFFAOYSA-N 1 2 322.393 4.180 20 0 DIADLO Cc1oncc1C[N@@H+]1CCCC[C@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000375695826 337016911 /nfs/dbraw/zinc/01/69/11/337016911.db2.gz CHVYNVCLVHCWOW-SFHVURJKSA-N 1 2 322.412 4.100 20 0 DIADLO Cc1oncc1C[N@H+]1CCCC[C@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000375695826 337016912 /nfs/dbraw/zinc/01/69/12/337016912.db2.gz CHVYNVCLVHCWOW-SFHVURJKSA-N 1 2 322.412 4.100 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1F)c1nccn1-c1ccccc1 ZINC000376506123 337035369 /nfs/dbraw/zinc/03/53/69/337035369.db2.gz JLWNIWILIVVYCA-GJZGRUSLSA-N 1 2 309.388 4.423 20 0 DIADLO O=c1[nH]c2ccccc2cc1C[N@@H+]1Cc2cccc(Cl)c2C1 ZINC000376536836 337036168 /nfs/dbraw/zinc/03/61/68/337036168.db2.gz YFEUXDAQZVTEHY-UHFFFAOYSA-N 1 2 310.784 4.110 20 0 DIADLO O=c1[nH]c2ccccc2cc1C[N@H+]1Cc2cccc(Cl)c2C1 ZINC000376536836 337036169 /nfs/dbraw/zinc/03/61/69/337036169.db2.gz YFEUXDAQZVTEHY-UHFFFAOYSA-N 1 2 310.784 4.110 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1nccn1-c1ccccc1 ZINC000376642105 337038777 /nfs/dbraw/zinc/03/87/77/337038777.db2.gz TWXMKJOTWLNZKV-CYBMUJFWSA-N 1 2 313.351 4.001 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1nccn1-c1ccccc1 ZINC000376642108 337038813 /nfs/dbraw/zinc/03/88/13/337038813.db2.gz TWXMKJOTWLNZKV-ZDUSSCGKSA-N 1 2 313.351 4.001 20 0 DIADLO Cc1nnc([C@H](C)[NH+]2CCC(F)(c3cccc(Cl)c3)CC2)o1 ZINC000377149926 337047659 /nfs/dbraw/zinc/04/76/59/337047659.db2.gz CHXVYEQQSJKLRC-NSHDSACASA-N 1 2 323.799 4.053 20 0 DIADLO C[C@H]1Oc2cc(F)ccc2[C@H]1[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000377383998 337051437 /nfs/dbraw/zinc/05/14/37/337051437.db2.gz UBJSYKBAXKBTBX-XIKOKIGWSA-N 1 2 324.355 4.093 20 0 DIADLO Cc1cccc([C@H](c2noc(Cc3ccc(C)[nH+]c3)n2)C(C)C)c1 ZINC000582453216 337054134 /nfs/dbraw/zinc/05/41/34/337054134.db2.gz ZFFKBQVOEZQTIM-LJQANCHMSA-N 1 2 321.424 4.460 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000377787077 337061058 /nfs/dbraw/zinc/06/10/58/337061058.db2.gz RZVHQRMGCNPISI-IJEWVQPXSA-N 1 2 318.461 4.067 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000377787077 337061059 /nfs/dbraw/zinc/06/10/59/337061059.db2.gz RZVHQRMGCNPISI-IJEWVQPXSA-N 1 2 318.461 4.067 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2c1ccc(Cl)c2Cl)c1nccs1 ZINC000378168840 337067682 /nfs/dbraw/zinc/06/76/82/337067682.db2.gz NITQWBWWTAKBSE-GMSGAONNSA-N 1 2 315.225 4.234 20 0 DIADLO Cc1c(C(=O)N2CCC[C@@H]2c2[nH]cc[nH+]2)oc2c1c(C)ccc2C ZINC000378412058 337072262 /nfs/dbraw/zinc/07/22/62/337072262.db2.gz YGRLCPALYUUAGR-CQSZACIVSA-N 1 2 323.396 4.058 20 0 DIADLO COc1cc(C)ccc1N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000193922249 337080712 /nfs/dbraw/zinc/08/07/12/337080712.db2.gz ZHQBSZKAEKSKQL-OAHLLOKOSA-N 1 2 307.397 4.362 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccn(C3CCCC3)n2)n1 ZINC000360080085 337085211 /nfs/dbraw/zinc/08/52/11/337085211.db2.gz UAXQJNRXLMDZMG-IBGZPJMESA-N 1 2 310.445 4.039 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccn(C3CCCC3)n2)n1 ZINC000360080085 337085212 /nfs/dbraw/zinc/08/52/12/337085212.db2.gz UAXQJNRXLMDZMG-IBGZPJMESA-N 1 2 310.445 4.039 20 0 DIADLO Cc1csc(C(=O)Nc2ccc3[nH]c(C(C)(C)C)[nH+]c3c2)c1 ZINC000393498470 337092825 /nfs/dbraw/zinc/09/28/25/337092825.db2.gz KJZCJKOHDGHMEQ-UHFFFAOYSA-N 1 2 313.426 4.483 20 0 DIADLO CC[N@H+](C)[C@H](c1nc(CC2CCCCC2)no1)c1ccccc1 ZINC000582691195 337123179 /nfs/dbraw/zinc/12/31/79/337123179.db2.gz REQNNXJLLDNTKB-SFHVURJKSA-N 1 2 313.445 4.234 20 0 DIADLO CC[N@@H+](C)[C@H](c1nc(CC2CCCCC2)no1)c1ccccc1 ZINC000582691195 337123180 /nfs/dbraw/zinc/12/31/80/337123180.db2.gz REQNNXJLLDNTKB-SFHVURJKSA-N 1 2 313.445 4.234 20 0 DIADLO Cc1ccc(C(=O)N2CCC[C@H](C)[C@@H]2C)cc1Oc1cc[nH+]cc1 ZINC000172650196 337129244 /nfs/dbraw/zinc/12/92/44/337129244.db2.gz IJZHIULGSZETOK-HOCLYGCPSA-N 1 2 324.424 4.443 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)o1 ZINC000174594257 337142654 /nfs/dbraw/zinc/14/26/54/337142654.db2.gz YQSPNZJNMWXKBX-ZDUSSCGKSA-N 1 2 322.412 4.018 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)o1 ZINC000174594257 337142655 /nfs/dbraw/zinc/14/26/55/337142655.db2.gz YQSPNZJNMWXKBX-ZDUSSCGKSA-N 1 2 322.412 4.018 20 0 DIADLO Cc1cccc(C[NH2+][C@H](C)c2nc(-c3cccc(F)c3)no2)c1 ZINC000174668888 337142960 /nfs/dbraw/zinc/14/29/60/337142960.db2.gz NWMWCDNMAKBPIS-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO COc1ccc(-c2csc(CNc3cc[nH+]c(C)n3)c2)cc1 ZINC000175171030 337145882 /nfs/dbraw/zinc/14/58/82/337145882.db2.gz PMEPNFVOMAGOAA-UHFFFAOYSA-N 1 2 311.410 4.134 20 0 DIADLO c1cn(-c2ccc(CSc3ccc4ccccc4n3)cn2)c[nH+]1 ZINC000175226435 337146274 /nfs/dbraw/zinc/14/62/74/337146274.db2.gz ALGKNNVJBOWZHT-UHFFFAOYSA-N 1 2 318.405 4.108 20 0 DIADLO Cc1cc([C@@H](C)NC(=O)Nc2ccc(C)[nH+]c2C)c(C)s1 ZINC000176723559 337151739 /nfs/dbraw/zinc/15/17/39/337151739.db2.gz VVGUFUSRWGBOFZ-LLVKDONJSA-N 1 2 303.431 4.259 20 0 DIADLO CCCC(CCC)[NH2+][C@H](c1noc(C)n1)c1ccccc1OC ZINC000177338337 337156994 /nfs/dbraw/zinc/15/69/94/337156994.db2.gz IBGJURXEAITERS-KRWDZBQOSA-N 1 2 317.433 4.034 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1c(F)cccc1Cl)CCO2 ZINC000178166985 337162875 /nfs/dbraw/zinc/16/28/75/337162875.db2.gz MDMIQXQJCNJHLX-HNNXBMFYSA-N 1 2 309.743 4.232 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1)c1noc(-c2ccccc2)n1 ZINC000178486665 337163116 /nfs/dbraw/zinc/16/31/16/337163116.db2.gz KQCIOQYSHYBUJF-CHWSQXEVSA-N 1 2 311.360 4.288 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1coc(-c2c(F)cccc2F)n1 ZINC000178607576 337165495 /nfs/dbraw/zinc/16/54/95/337165495.db2.gz JOCHBJGESBEFHP-UHFFFAOYSA-N 1 2 318.323 4.153 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1coc(-c2c(F)cccc2F)n1 ZINC000178607576 337165496 /nfs/dbraw/zinc/16/54/96/337165496.db2.gz JOCHBJGESBEFHP-UHFFFAOYSA-N 1 2 318.323 4.153 20 0 DIADLO CC[N@H+](Cc1csc(C2CC2)n1)Cc1ccc(OC)cc1 ZINC000179241108 337168408 /nfs/dbraw/zinc/16/84/08/337168408.db2.gz KQFJYAYZIAYHCQ-UHFFFAOYSA-N 1 2 302.443 4.051 20 0 DIADLO CC[N@@H+](Cc1csc(C2CC2)n1)Cc1ccc(OC)cc1 ZINC000179241108 337168409 /nfs/dbraw/zinc/16/84/09/337168409.db2.gz KQFJYAYZIAYHCQ-UHFFFAOYSA-N 1 2 302.443 4.051 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000179575637 337170233 /nfs/dbraw/zinc/17/02/33/337170233.db2.gz DSYGCBWKZOREEN-IBGZPJMESA-N 1 2 324.424 4.020 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000179575637 337170234 /nfs/dbraw/zinc/17/02/34/337170234.db2.gz DSYGCBWKZOREEN-IBGZPJMESA-N 1 2 324.424 4.020 20 0 DIADLO C[C@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1ccccn1 ZINC000179613278 337170709 /nfs/dbraw/zinc/17/07/09/337170709.db2.gz QQVKLHFTPAEIOU-HNNXBMFYSA-N 1 2 318.424 4.455 20 0 DIADLO Cc1ccc(F)cc1C[N@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000180229922 337175351 /nfs/dbraw/zinc/17/53/51/337175351.db2.gz POOJPKVNJYXVRS-UHFFFAOYSA-N 1 2 318.339 4.241 20 0 DIADLO Cc1ccc(F)cc1C[N@@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000180229922 337175352 /nfs/dbraw/zinc/17/53/52/337175352.db2.gz POOJPKVNJYXVRS-UHFFFAOYSA-N 1 2 318.339 4.241 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](C)c2ccc(-c3cccnc3)cc2)no1 ZINC000181309301 337181242 /nfs/dbraw/zinc/18/12/42/337181242.db2.gz SPQOEPDNEYYQOQ-AWEZNQCLSA-N 1 2 322.412 4.106 20 0 DIADLO CC[C@H]([NH2+]Cc1noc(-c2ccsc2)n1)c1ccc(C)cc1 ZINC000181707599 337183772 /nfs/dbraw/zinc/18/37/72/337183772.db2.gz HBVYMSVHTXJYSU-HNNXBMFYSA-N 1 2 313.426 4.347 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(-c2ccccc2F)n1)c1ccccn1 ZINC000181782649 337184553 /nfs/dbraw/zinc/18/45/53/337184553.db2.gz TZWFNSYVQNZUGQ-GFCCVEGCSA-N 1 2 313.401 4.195 20 0 DIADLO Cc1cc(Cl)c(C(=O)N2CCCC[C@H]2c2[nH]cc[nH+]2)cc1C ZINC000181882499 337185167 /nfs/dbraw/zinc/18/51/67/337185167.db2.gz KXQSJBTZCWZHOB-HNNXBMFYSA-N 1 2 317.820 4.047 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)Cc2cccnc2)cc1Cl ZINC000182032761 337185830 /nfs/dbraw/zinc/18/58/30/337185830.db2.gz DQXQTHJLICJSAA-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)Cc2cccnc2)cc1Cl ZINC000182032761 337185831 /nfs/dbraw/zinc/18/58/31/337185831.db2.gz DQXQTHJLICJSAA-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO C[N@H+](Cc1cccnc1)Cc1cc(C(F)(F)F)ccc1Cl ZINC000182027860 337185887 /nfs/dbraw/zinc/18/58/87/337185887.db2.gz PAONMTSAJJMYAV-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1cccnc1)Cc1cc(C(F)(F)F)ccc1Cl ZINC000182027860 337185888 /nfs/dbraw/zinc/18/58/88/337185888.db2.gz PAONMTSAJJMYAV-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nc(-c3cccc(C)c3)no2)cc1 ZINC000182347657 337187976 /nfs/dbraw/zinc/18/79/76/337187976.db2.gz DRRKAAYNGFZQJD-HNNXBMFYSA-N 1 2 307.397 4.204 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1ncc(Cl)cc1Cl ZINC000182498792 337188699 /nfs/dbraw/zinc/18/86/99/337188699.db2.gz OAWHWHODJFJAJK-OAHLLOKOSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1ncc(Cl)cc1Cl ZINC000182498792 337188700 /nfs/dbraw/zinc/18/87/00/337188700.db2.gz OAWHWHODJFJAJK-OAHLLOKOSA-N 1 2 310.228 4.064 20 0 DIADLO CC[C@H]([NH2+]Cc1sc(C)nc1C(F)(F)F)c1nccs1 ZINC000183669556 337194079 /nfs/dbraw/zinc/19/40/79/337194079.db2.gz YSERGTNMXVINEG-QMMMGPOBSA-N 1 2 321.393 4.168 20 0 DIADLO FC(F)(F)C[C@H]([NH2+]Cc1nc2ccccc2[nH]1)c1ccccc1 ZINC000321092645 337197245 /nfs/dbraw/zinc/19/72/45/337197245.db2.gz KKMKJMHFBQVUQM-HNNXBMFYSA-N 1 2 319.330 4.346 20 0 DIADLO Cc1ccc(CNc2cc(F)ccc2Br)c(C)[nH+]1 ZINC000184485796 337199037 /nfs/dbraw/zinc/19/90/37/337199037.db2.gz PYCRFJZQGLVTAZ-UHFFFAOYSA-N 1 2 309.182 4.212 20 0 DIADLO CC(C)Oc1cccc([C@@H]([NH2+][C@@H]2CCCSC2)C(F)F)c1 ZINC000582855986 337211170 /nfs/dbraw/zinc/21/11/70/337211170.db2.gz HUTNXMATEMTTNA-UKRRQHHQSA-N 1 2 315.429 4.265 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1nc(CC2CCCCC2)no1 ZINC000582930732 337215802 /nfs/dbraw/zinc/21/58/02/337215802.db2.gz ZPMXHVHYLHRNMZ-UHFFFAOYSA-N 1 2 324.428 4.093 20 0 DIADLO Clc1ccccc1C[C@H]([NH2+]Cc1ccn[nH]1)c1cccs1 ZINC000582957793 337218356 /nfs/dbraw/zinc/21/83/56/337218356.db2.gz PHGFEQQHXPHQRN-HNNXBMFYSA-N 1 2 317.845 4.198 20 0 DIADLO CCSc1cccc(C[N@@H+]2CCCC[C@H]2c2ncc[nH]2)c1 ZINC000186203139 337254713 /nfs/dbraw/zinc/25/47/13/337254713.db2.gz WSNKEYSXTUCLER-INIZCTEOSA-N 1 2 301.459 4.249 20 0 DIADLO CCSc1cccc(C[N@H+]2CCCC[C@H]2c2ncc[nH]2)c1 ZINC000186203139 337254714 /nfs/dbraw/zinc/25/47/14/337254714.db2.gz WSNKEYSXTUCLER-INIZCTEOSA-N 1 2 301.459 4.249 20 0 DIADLO Cc1cc(CNc2cc[nH+]cc2F)ccc1Oc1cccnc1 ZINC000186426184 337256091 /nfs/dbraw/zinc/25/60/91/337256091.db2.gz QTJRGHYHCKHPRV-UHFFFAOYSA-N 1 2 309.344 4.329 20 0 DIADLO Cc1ccsc1-c1nnc(SCc2ccc(C)[nH+]c2C)o1 ZINC000186614797 337257990 /nfs/dbraw/zinc/25/79/90/337257990.db2.gz XRTFATXYOXSCRZ-UHFFFAOYSA-N 1 2 317.439 4.411 20 0 DIADLO COCCOc1ccc(SCc2ccc(C)[nH+]c2C)cc1 ZINC000186702007 337258937 /nfs/dbraw/zinc/25/89/37/337258937.db2.gz POSQOEMPROHTPX-UHFFFAOYSA-N 1 2 303.427 4.016 20 0 DIADLO COc1ccc2nc(C[N@H+](C)[C@@H](C)c3ccco3)sc2c1 ZINC000186804197 337259913 /nfs/dbraw/zinc/25/99/13/337259913.db2.gz CLCKQXUZMSSULF-NSHDSACASA-N 1 2 302.399 4.091 20 0 DIADLO COc1ccc2nc(C[N@@H+](C)[C@@H](C)c3ccco3)sc2c1 ZINC000186804197 337259914 /nfs/dbraw/zinc/25/99/14/337259914.db2.gz CLCKQXUZMSSULF-NSHDSACASA-N 1 2 302.399 4.091 20 0 DIADLO Cc1ccc(C[S@@](=O)[C@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000187069731 337261739 /nfs/dbraw/zinc/26/17/39/337261739.db2.gz INRYRLQUDBBNTA-ZUOKHONESA-N 1 2 307.846 4.362 20 0 DIADLO CC[N@H+](Cc1nccn1-c1ccccc1)[C@H](C)c1cccc(O)c1 ZINC000191253799 337295205 /nfs/dbraw/zinc/29/52/05/337295205.db2.gz IZRBOGDROIYWMJ-MRXNPFEDSA-N 1 2 321.424 4.161 20 0 DIADLO CC[N@@H+](Cc1nccn1-c1ccccc1)[C@H](C)c1cccc(O)c1 ZINC000191253799 337295206 /nfs/dbraw/zinc/29/52/06/337295206.db2.gz IZRBOGDROIYWMJ-MRXNPFEDSA-N 1 2 321.424 4.161 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](Cc1nccn1-c1ccccc1)C1CC1 ZINC000191273183 337295347 /nfs/dbraw/zinc/29/53/47/337295347.db2.gz GMZSSEHLQVAAFD-HNNXBMFYSA-N 1 2 307.397 4.191 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](Cc1nccn1-c1ccccc1)C1CC1 ZINC000191273183 337295348 /nfs/dbraw/zinc/29/53/48/337295348.db2.gz GMZSSEHLQVAAFD-HNNXBMFYSA-N 1 2 307.397 4.191 20 0 DIADLO CO[C@H](C)c1cccc(NCc2ccc(N(C)C(C)C)[nH+]c2)c1 ZINC000191423934 337296894 /nfs/dbraw/zinc/29/68/94/337296894.db2.gz DKMVJPKUKARJSO-OAHLLOKOSA-N 1 2 313.445 4.246 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+][C@@H]2CSC[C@@H]2C)C(F)F)c1 ZINC000583273652 337299729 /nfs/dbraw/zinc/29/97/29/337299729.db2.gz XCQOIXCMZKPESI-GLQYFDAESA-N 1 2 315.429 4.121 20 0 DIADLO Cc1ncc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)s1 ZINC000191781563 337300146 /nfs/dbraw/zinc/30/01/46/337300146.db2.gz UEWMVCXOCTXNIE-UHFFFAOYSA-N 1 2 314.376 4.406 20 0 DIADLO Cc1ncc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)s1 ZINC000191781563 337300147 /nfs/dbraw/zinc/30/01/47/337300147.db2.gz UEWMVCXOCTXNIE-UHFFFAOYSA-N 1 2 314.376 4.406 20 0 DIADLO CC[N@H+](Cc1ncccn1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000191970502 337301574 /nfs/dbraw/zinc/30/15/74/337301574.db2.gz HKHRUNHSKNKGET-GFCCVEGCSA-N 1 2 309.335 4.079 20 0 DIADLO CC[N@@H+](Cc1ncccn1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000191970502 337301575 /nfs/dbraw/zinc/30/15/75/337301575.db2.gz HKHRUNHSKNKGET-GFCCVEGCSA-N 1 2 309.335 4.079 20 0 DIADLO CC[N@H+](Cc1ncccn1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000192101872 337303013 /nfs/dbraw/zinc/30/30/13/337303013.db2.gz BSZLTKLNVKOHKH-FQEVSTJZSA-N 1 2 321.399 4.227 20 0 DIADLO CC[N@@H+](Cc1ncccn1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000192101872 337303014 /nfs/dbraw/zinc/30/30/14/337303014.db2.gz BSZLTKLNVKOHKH-FQEVSTJZSA-N 1 2 321.399 4.227 20 0 DIADLO Cc1cc(N2CCCC2)ccc1[NH2+][C@H](C)Cc1ccc(O)cc1 ZINC000321915518 337304028 /nfs/dbraw/zinc/30/40/28/337304028.db2.gz APMDXOIQNSVFGL-MRXNPFEDSA-N 1 2 310.441 4.344 20 0 DIADLO Cc1cc(NC(=O)Nc2cccnc2)ccc1Oc1cc[nH+]cc1 ZINC000192580326 337306385 /nfs/dbraw/zinc/30/63/85/337306385.db2.gz RKJMGZDPGUTTBI-UHFFFAOYSA-N 1 2 320.352 4.221 20 0 DIADLO COC[C@H](Nc1cc(C)[nH+]c(C2CC2)n1)c1ccc(Cl)cc1 ZINC000192810644 337307750 /nfs/dbraw/zinc/30/77/50/337307750.db2.gz WEXPWDGMRFGFKI-HNNXBMFYSA-N 1 2 317.820 4.115 20 0 DIADLO Cc1cc(C[NH+](CCC2=CCCCC2)Cc2cc(C)no2)on1 ZINC000192971789 337308842 /nfs/dbraw/zinc/30/88/42/337308842.db2.gz WUEAJXDSIBMQER-UHFFFAOYSA-N 1 2 315.417 4.172 20 0 DIADLO Cc1noc([C@H](C)[N@@H+](C)Cc2ccc(SC(C)C)cc2)n1 ZINC000584418924 337322915 /nfs/dbraw/zinc/32/29/15/337322915.db2.gz PKGBCWUZCPXNOF-LBPRGKRZSA-N 1 2 305.447 4.072 20 0 DIADLO Cc1noc([C@H](C)[N@H+](C)Cc2ccc(SC(C)C)cc2)n1 ZINC000584418924 337322916 /nfs/dbraw/zinc/32/29/16/337322916.db2.gz PKGBCWUZCPXNOF-LBPRGKRZSA-N 1 2 305.447 4.072 20 0 DIADLO FC[C@@H]1CCC[N@@H+]1Cc1csc(Cc2ccc(Cl)cc2)n1 ZINC000583766707 337331800 /nfs/dbraw/zinc/33/18/00/337331800.db2.gz YGZMHUWHNWYQDO-HNNXBMFYSA-N 1 2 324.852 4.321 20 0 DIADLO FC[C@@H]1CCC[N@H+]1Cc1csc(Cc2ccc(Cl)cc2)n1 ZINC000583766707 337331801 /nfs/dbraw/zinc/33/18/01/337331801.db2.gz YGZMHUWHNWYQDO-HNNXBMFYSA-N 1 2 324.852 4.321 20 0 DIADLO FC[C@H]1CCC[N@@H+]1Cc1csc(Cc2ccc(Cl)cc2)n1 ZINC000583766708 337331870 /nfs/dbraw/zinc/33/18/70/337331870.db2.gz YGZMHUWHNWYQDO-OAHLLOKOSA-N 1 2 324.852 4.321 20 0 DIADLO FC[C@H]1CCC[N@H+]1Cc1csc(Cc2ccc(Cl)cc2)n1 ZINC000583766708 337331871 /nfs/dbraw/zinc/33/18/71/337331871.db2.gz YGZMHUWHNWYQDO-OAHLLOKOSA-N 1 2 324.852 4.321 20 0 DIADLO COc1ccc2c(c1)C[N@H+]([C@H](C)c1c(F)cccc1F)CC2 ZINC000520788511 337390778 /nfs/dbraw/zinc/39/07/78/337390778.db2.gz CCJXAEQOPLGZLQ-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc2c(c1)C[N@@H+]([C@H](C)c1c(F)cccc1F)CC2 ZINC000520788511 337390779 /nfs/dbraw/zinc/39/07/79/337390779.db2.gz CCJXAEQOPLGZLQ-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000116740941 337392818 /nfs/dbraw/zinc/39/28/18/337392818.db2.gz UCYHKERIVVTFKB-INIZCTEOSA-N 1 2 305.466 4.043 20 0 DIADLO COc1ccc(OCc2ccc(C(C)C)[nH+]c2C)c(C(C)=O)c1 ZINC000418780007 337396870 /nfs/dbraw/zinc/39/68/70/337396870.db2.gz KJIQMPNGSCLQDA-UHFFFAOYSA-N 1 2 313.397 4.304 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2cccc(Cl)c2)no1)c1ccccc1 ZINC000127892144 337422961 /nfs/dbraw/zinc/42/29/61/337422961.db2.gz RPCVWTVUEHMJJD-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2cccc(Cl)c2)no1)c1ccccc1 ZINC000127891918 337423031 /nfs/dbraw/zinc/42/30/31/337423031.db2.gz RPCVWTVUEHMJJD-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@@H](C)CCC(C)C)c2ccccc2F)no1 ZINC000130853769 337434729 /nfs/dbraw/zinc/43/47/29/337434729.db2.gz KLNQAHJQICXONT-LRDDRELGSA-N 1 2 305.397 4.021 20 0 DIADLO CC(C)c1nc(N[C@@H](C)c2ncc(-c3ccccc3)o2)cc[nH+]1 ZINC000131663872 337438458 /nfs/dbraw/zinc/43/84/58/337438458.db2.gz NNRZWAAZWQQDBN-ZDUSSCGKSA-N 1 2 308.385 4.428 20 0 DIADLO C[C@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1cccc(O)c1 ZINC000194874155 337464029 /nfs/dbraw/zinc/46/40/29/337464029.db2.gz UEHKGAWOPGOURR-SUMWQHHRSA-N 1 2 310.422 4.289 20 0 DIADLO CCc1[nH+]c(C(C)C)ccc1Cn1nc(C2CC2)nc1C1CC1 ZINC000418926455 337471776 /nfs/dbraw/zinc/47/17/76/337471776.db2.gz SUOXONUHWMKQNN-UHFFFAOYSA-N 1 2 310.445 4.162 20 0 DIADLO COCCCCN(C)c1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000419012831 337473700 /nfs/dbraw/zinc/47/37/00/337473700.db2.gz GKRXVJZVPJHPKT-UHFFFAOYSA-N 1 2 312.335 4.116 20 0 DIADLO Cc1cc(N2CCC[C@@H](CC(F)(F)F)C2)nc(C(C)C)[nH+]1 ZINC000420627466 337509195 /nfs/dbraw/zinc/50/91/95/337509195.db2.gz MXIGEIJMRUDTFO-LBPRGKRZSA-N 1 2 301.356 4.077 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@H](c3ccccc3)C2(C)C)c(C)[nH+]1 ZINC000421073688 337520449 /nfs/dbraw/zinc/52/04/49/337520449.db2.gz WESUDOIXIKVRDU-QGZVFWFLSA-N 1 2 323.440 4.498 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)nn1C ZINC000421337541 337527237 /nfs/dbraw/zinc/52/72/37/337527237.db2.gz ZJNXCJZCAMNTFP-MRXNPFEDSA-N 1 2 324.255 4.276 20 0 DIADLO Cc1cn2cc(NC(=O)N(C)[C@@H](C)C3CCCCC3)ccc2[nH+]1 ZINC000446125617 338521206 /nfs/dbraw/zinc/52/12/06/338521206.db2.gz IBFNDHQGFKCQAZ-AWEZNQCLSA-N 1 2 314.433 4.075 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2nnc(C(C)C)o2)c2ccccc2)cc1 ZINC000076292078 337568070 /nfs/dbraw/zinc/56/80/70/337568070.db2.gz YWVKMKPISNTMAP-LJQANCHMSA-N 1 2 321.424 4.381 20 0 DIADLO C[C@H]([NH2+][C@@H]1C=CCCCCC1)c1noc(Cc2ccccc2)n1 ZINC000571943390 337583712 /nfs/dbraw/zinc/58/37/12/337583712.db2.gz UVDVXMAONDJZGL-DOTOQJQBSA-N 1 2 311.429 4.200 20 0 DIADLO COc1c(C)[nH+]c(C2CC2)nc1N1CCC[C@@H]1c1cccs1 ZINC000572210061 337597139 /nfs/dbraw/zinc/59/71/39/337597139.db2.gz YOURUWBVNFVQLU-CYBMUJFWSA-N 1 2 315.442 4.074 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@H](C)c1ccncc1Cl)c1ccco1 ZINC000421823913 337646202 /nfs/dbraw/zinc/64/62/02/337646202.db2.gz FYVZWLPHHRNMAV-CZUORRHYSA-N 1 2 322.836 4.393 20 0 DIADLO CC[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(OC)c(OC)c1 ZINC000423205739 337703826 /nfs/dbraw/zinc/70/38/26/337703826.db2.gz BGQXDSABFUSPMB-MRXNPFEDSA-N 1 2 312.413 4.235 20 0 DIADLO Cc1cccnc1[C@H]1CCC[C@@H]([NH2+]c2ccc3c(c2)CCN3)C1 ZINC000423209866 337704250 /nfs/dbraw/zinc/70/42/50/337704250.db2.gz FNHQQIXYNWIJRX-DLBZAZTESA-N 1 2 307.441 4.496 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](CO)c2c(F)cccc2F)cc(C)c1F ZINC000536869709 337751886 /nfs/dbraw/zinc/75/18/86/337751886.db2.gz MCRGNVDZTGRMLY-LRDDRELGSA-N 1 2 323.358 4.105 20 0 DIADLO CC(C)c1nc(C[NH2+][C@@H](c2ccccn2)C2CCC2)cs1 ZINC000527773840 337762818 /nfs/dbraw/zinc/76/28/18/337762818.db2.gz RZXHCUQMOSNFAL-MRXNPFEDSA-N 1 2 301.459 4.293 20 0 DIADLO Cc1ncc(-c2ccccc2)cc1NCc1c[nH+]cn1C(C)C ZINC000424154254 337781806 /nfs/dbraw/zinc/78/18/06/337781806.db2.gz JIUTXUZFPPTKMD-UHFFFAOYSA-N 1 2 306.413 4.447 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2cncn2C(C)C)c2ccccn2)cc1 ZINC000424198233 337807866 /nfs/dbraw/zinc/80/78/66/337807866.db2.gz XLDQAFYBSVOLQA-FQEVSTJZSA-N 1 2 320.440 4.047 20 0 DIADLO Fc1c(Cl)cccc1NCc1cn2cc(Cl)ccc2[nH+]1 ZINC000105948131 337811858 /nfs/dbraw/zinc/81/18/58/337811858.db2.gz BYWUQAWJPOARSK-UHFFFAOYSA-N 1 2 310.159 4.392 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccccc1Oc1ccccc1 ZINC000107287395 337828318 /nfs/dbraw/zinc/82/83/18/337828318.db2.gz ANLWDVYRPJBZLB-UHFFFAOYSA-N 1 2 304.349 4.435 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000107293750 337828420 /nfs/dbraw/zinc/82/84/20/337828420.db2.gz KVKVUDDAWFIVQU-QWHCGFSZSA-N 1 2 321.207 4.439 20 0 DIADLO Cn1c2ccccc2[nH+]c1NCc1sccc1Br ZINC000148355951 337834070 /nfs/dbraw/zinc/83/40/70/337834070.db2.gz CVKOVYFPXFHGMR-UHFFFAOYSA-N 1 2 322.231 4.009 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)Nc1cccc(Cl)c1 ZINC000082358371 337836796 /nfs/dbraw/zinc/83/67/96/337836796.db2.gz IOBPUIYTUKFZJB-UHFFFAOYSA-N 1 2 312.760 4.170 20 0 DIADLO Cc1ccc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)c(C)[nH+]1 ZINC000119187633 337855056 /nfs/dbraw/zinc/85/50/56/337855056.db2.gz WYHWYUARAAGYGV-LJQANCHMSA-N 1 2 324.424 4.337 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1c(F)cccc1F ZINC000537022547 337870318 /nfs/dbraw/zinc/87/03/18/337870318.db2.gz PKEONAYXGPZLIN-SECBINFHSA-N 1 2 306.287 4.096 20 0 DIADLO Cc1ccc(Br)cc1NCc1c[nH+]cn1C(C)C ZINC000090208221 337879330 /nfs/dbraw/zinc/87/93/30/337879330.db2.gz WOMUONWWXXXSOT-UHFFFAOYSA-N 1 2 308.223 4.147 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)NC1CCC(c2ccccc2)CC1 ZINC000121327551 337891799 /nfs/dbraw/zinc/89/17/99/337891799.db2.gz JLDPSSCVSNXAOF-UHFFFAOYSA-N 1 2 309.413 4.238 20 0 DIADLO CCOc1ccc([C@H]([NH2+]Cc2cscn2)c2ccccc2)cc1 ZINC000060526873 337913888 /nfs/dbraw/zinc/91/38/88/337913888.db2.gz LWPXRQARADNFEU-LJQANCHMSA-N 1 2 324.449 4.421 20 0 DIADLO CC(C)c1cc(N2CCC[C@H]2C2CCOCC2)nc(C(C)C)[nH+]1 ZINC000537410298 337933984 /nfs/dbraw/zinc/93/39/84/337933984.db2.gz HFPRRXCXXNSYOV-KRWDZBQOSA-N 1 2 317.477 4.119 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)cc1 ZINC000537424856 337935870 /nfs/dbraw/zinc/93/58/70/337935870.db2.gz DKQRYYTVJVBPOB-OAHLLOKOSA-N 1 2 311.429 4.254 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@@H](C)c2nccn2C)c1 ZINC000537538189 337941563 /nfs/dbraw/zinc/94/15/63/337941563.db2.gz YKPIKHLAOMNYRO-HNNXBMFYSA-N 1 2 323.444 4.257 20 0 DIADLO COC[C@H]([NH2+]C(c1ccccc1)c1ccccc1)c1ccco1 ZINC000514244299 337967799 /nfs/dbraw/zinc/96/77/99/337967799.db2.gz GENXGAZDJMNZKT-SFHVURJKSA-N 1 2 307.393 4.346 20 0 DIADLO CC[C@H]1CCC[C@H]1c1nc(CCn2c(C)[nH+]c3ccccc32)no1 ZINC000514913055 337973954 /nfs/dbraw/zinc/97/39/54/337973954.db2.gz DEAFVTCZJQOURS-LSDHHAIUSA-N 1 2 324.428 4.264 20 0 DIADLO CC[C@H]1CCC[C@@H]1c1nc(CCn2c(C)[nH+]c3ccccc32)no1 ZINC000514913053 337974024 /nfs/dbraw/zinc/97/40/24/337974024.db2.gz DEAFVTCZJQOURS-GJZGRUSLSA-N 1 2 324.428 4.264 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCc3ccccc3OC)c2c1 ZINC000514912694 337974037 /nfs/dbraw/zinc/97/40/37/337974037.db2.gz ZANRNNGDIFSRRA-UHFFFAOYSA-N 1 2 309.365 4.139 20 0 DIADLO Cn1cc(C[N@H+](C)Cc2cc(Cl)ccc2F)c(C(C)(C)C)n1 ZINC000516145504 338005190 /nfs/dbraw/zinc/00/51/90/338005190.db2.gz WGDDPNHMKLHBGX-UHFFFAOYSA-N 1 2 323.843 4.142 20 0 DIADLO Cn1cc(C[N@@H+](C)Cc2cc(Cl)ccc2F)c(C(C)(C)C)n1 ZINC000516145504 338005191 /nfs/dbraw/zinc/00/51/91/338005191.db2.gz WGDDPNHMKLHBGX-UHFFFAOYSA-N 1 2 323.843 4.142 20 0 DIADLO COc1cc(C[N@H+](C)Cc2c(F)cccc2Cl)cc(OC)c1 ZINC000516308033 338010277 /nfs/dbraw/zinc/01/02/77/338010277.db2.gz BYCRTZIFIODGSS-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2c(F)cccc2Cl)cc(OC)c1 ZINC000516308033 338010278 /nfs/dbraw/zinc/01/02/78/338010278.db2.gz BYCRTZIFIODGSS-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)Cc1ccccc1Cl ZINC000425596082 338015778 /nfs/dbraw/zinc/01/57/78/338015778.db2.gz LKMVEGQOPXHTRR-GFCCVEGCSA-N 1 2 302.805 4.169 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)C1CCC(C(F)(F)F)CC1 ZINC000425597131 338015782 /nfs/dbraw/zinc/01/57/82/338015782.db2.gz RIASDGORUOSCIM-UHFFFAOYSA-N 1 2 300.324 4.006 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@H](C)c1c[nH]c2ccccc21 ZINC000425595953 338015830 /nfs/dbraw/zinc/01/58/30/338015830.db2.gz KTJIATMSVYQRRG-ZDUSSCGKSA-N 1 2 307.397 4.312 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000425598942 338015876 /nfs/dbraw/zinc/01/58/76/338015876.db2.gz YIRPDQAAAQGDSU-LLVKDONJSA-N 1 2 322.330 4.459 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000425598943 338015941 /nfs/dbraw/zinc/01/59/41/338015941.db2.gz YIRPDQAAAQGDSU-NSHDSACASA-N 1 2 322.330 4.459 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[NH+]1CCC(O)(C(F)F)CC1 ZINC000426229869 338023327 /nfs/dbraw/zinc/02/33/27/338023327.db2.gz AJPBSQWBFHHTFR-VIFPVBQESA-N 1 2 324.198 4.146 20 0 DIADLO Cc1ccoc1C[NH2+][C@@H](c1cccnc1)c1ccc(F)cc1F ZINC000426289962 338024809 /nfs/dbraw/zinc/02/48/09/338024809.db2.gz HSHSMRYFZODWQY-SFHVURJKSA-N 1 2 314.335 4.140 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cccc(-c3ccncc3)c2)CC1(F)F ZINC000426378736 338029644 /nfs/dbraw/zinc/02/96/44/338029644.db2.gz QQPPPBQRMKAAEL-AWEZNQCLSA-N 1 2 302.368 4.226 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cccc(-c3ccncc3)c2)CC1(F)F ZINC000426378736 338029645 /nfs/dbraw/zinc/02/96/45/338029645.db2.gz QQPPPBQRMKAAEL-AWEZNQCLSA-N 1 2 302.368 4.226 20 0 DIADLO CCCc1csc(C[N@H+](C)Cc2cc3ccccc3o2)n1 ZINC000426400409 338030645 /nfs/dbraw/zinc/03/06/45/338030645.db2.gz IDUXMIBHURAFGC-UHFFFAOYSA-N 1 2 300.427 4.474 20 0 DIADLO CCCc1csc(C[N@@H+](C)Cc2cc3ccccc3o2)n1 ZINC000426400409 338030646 /nfs/dbraw/zinc/03/06/46/338030646.db2.gz IDUXMIBHURAFGC-UHFFFAOYSA-N 1 2 300.427 4.474 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2ccc3nc(C)sc3c2)s1 ZINC000426416206 338031305 /nfs/dbraw/zinc/03/13/05/338031305.db2.gz HLWBASXCFDTZTJ-UHFFFAOYSA-N 1 2 317.483 4.256 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2ccc3nc(C)sc3c2)s1 ZINC000426416206 338031306 /nfs/dbraw/zinc/03/13/06/338031306.db2.gz HLWBASXCFDTZTJ-UHFFFAOYSA-N 1 2 317.483 4.256 20 0 DIADLO CCCc1csc(C[N@H+](CC)[C@H](C)c2cccc(O)c2)n1 ZINC000426419949 338031708 /nfs/dbraw/zinc/03/17/08/338031708.db2.gz NPCBHSPTIYEKMN-CYBMUJFWSA-N 1 2 304.459 4.384 20 0 DIADLO CCCc1csc(C[N@@H+](CC)[C@H](C)c2cccc(O)c2)n1 ZINC000426419949 338031709 /nfs/dbraw/zinc/03/17/09/338031709.db2.gz NPCBHSPTIYEKMN-CYBMUJFWSA-N 1 2 304.459 4.384 20 0 DIADLO Cc1ccc([C@H](C)c2noc(CCc3c[nH+]cc(C)c3)n2)cc1 ZINC000426427823 338031999 /nfs/dbraw/zinc/03/19/99/338031999.db2.gz GXAZEKOACXPBPI-HNNXBMFYSA-N 1 2 307.397 4.018 20 0 DIADLO CCSc1cccc(-c2noc(Cc3ccc[nH+]c3C)n2)c1 ZINC000426567598 338034854 /nfs/dbraw/zinc/03/48/54/338034854.db2.gz LDHKHVQTWGINGU-UHFFFAOYSA-N 1 2 311.410 4.143 20 0 DIADLO CCSc1cccc(-c2noc(Cc3ccc(C)[nH+]c3)n2)c1 ZINC000426616662 338035971 /nfs/dbraw/zinc/03/59/71/338035971.db2.gz AGSYISOVJANOTE-UHFFFAOYSA-N 1 2 311.410 4.143 20 0 DIADLO Cc1c[nH+]cc(CCc2nc(-c3ccc4ccccc4c3)no2)c1 ZINC000426618740 338036035 /nfs/dbraw/zinc/03/60/35/338036035.db2.gz HDXHEZNOSGEKCE-UHFFFAOYSA-N 1 2 315.376 4.378 20 0 DIADLO CCCc1nc(C)c(C[N@@H+]2CCc3c(Cl)cccc3C2)o1 ZINC000428230705 338043297 /nfs/dbraw/zinc/04/32/97/338043297.db2.gz HVPCHMIVNXJFDE-UHFFFAOYSA-N 1 2 304.821 4.147 20 0 DIADLO CCCc1nc(C)c(C[N@H+]2CCc3c(Cl)cccc3C2)o1 ZINC000428230705 338043298 /nfs/dbraw/zinc/04/32/98/338043298.db2.gz HVPCHMIVNXJFDE-UHFFFAOYSA-N 1 2 304.821 4.147 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@H](c2ccccc2)OC[C@@H]1C ZINC000428231176 338043471 /nfs/dbraw/zinc/04/34/71/338043471.db2.gz VDLXSLUTRNTYBO-KBXCAEBGSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@H](c2ccccc2)OC[C@@H]1C ZINC000428231176 338043472 /nfs/dbraw/zinc/04/34/72/338043472.db2.gz VDLXSLUTRNTYBO-KBXCAEBGSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1[C@H](C)COC[C@H]1c1ccccc1 ZINC000428294732 338045953 /nfs/dbraw/zinc/04/59/53/338045953.db2.gz NQWUXIYACGBJAK-PBHICJAKSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1[C@H](C)COC[C@H]1c1ccccc1 ZINC000428294732 338045954 /nfs/dbraw/zinc/04/59/54/338045954.db2.gz NQWUXIYACGBJAK-PBHICJAKSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1[C@H](c2ccccc2)COC[C@@H]1C ZINC000428294735 338046112 /nfs/dbraw/zinc/04/61/12/338046112.db2.gz NQWUXIYACGBJAK-YOEHRIQHSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1[C@H](c2ccccc2)COC[C@@H]1C ZINC000428294735 338046113 /nfs/dbraw/zinc/04/61/13/338046113.db2.gz NQWUXIYACGBJAK-YOEHRIQHSA-N 1 2 314.429 4.068 20 0 DIADLO CCCc1nc(C)c(C[NH2+]C2(c3ccc(F)cc3F)CCC2)o1 ZINC000428308661 338046632 /nfs/dbraw/zinc/04/66/32/338046632.db2.gz AIUFRSRADYZEPP-UHFFFAOYSA-N 1 2 320.383 4.383 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000428363817 338048884 /nfs/dbraw/zinc/04/88/84/338048884.db2.gz MDLMOWFYCNTYOD-WBMJQRKESA-N 1 2 320.458 4.130 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000428363817 338048885 /nfs/dbraw/zinc/04/88/85/338048885.db2.gz MDLMOWFYCNTYOD-WBMJQRKESA-N 1 2 320.458 4.130 20 0 DIADLO Cc1nc(C(C)C)oc1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000428369830 338049309 /nfs/dbraw/zinc/04/93/09/338049309.db2.gz LFMUERQYOIXKDS-LJQANCHMSA-N 1 2 321.424 4.381 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)ncn1 ZINC000428481058 338054645 /nfs/dbraw/zinc/05/46/45/338054645.db2.gz DCDCDDSJISPLKU-MRXNPFEDSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)ncn1 ZINC000428481058 338054646 /nfs/dbraw/zinc/05/46/46/338054646.db2.gz DCDCDDSJISPLKU-MRXNPFEDSA-N 1 2 322.239 4.429 20 0 DIADLO CCc1nc(C)c(C[N@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC000428484362 338054681 /nfs/dbraw/zinc/05/46/81/338054681.db2.gz LZNBFNGSYOXUEH-LRDDRELGSA-N 1 2 314.429 4.426 20 0 DIADLO CCc1nc(C)c(C[N@@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)o1 ZINC000428484362 338054682 /nfs/dbraw/zinc/05/46/82/338054682.db2.gz LZNBFNGSYOXUEH-LRDDRELGSA-N 1 2 314.429 4.426 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@@H]3CCC[C@H]32)cc1Oc1cc[nH+]cc1 ZINC000428538837 338055746 /nfs/dbraw/zinc/05/57/46/338055746.db2.gz YGWRILYFERKLSP-MAUKXSAKSA-N 1 2 322.408 4.197 20 0 DIADLO Cc1cccc(C[N@@H+](C)[C@H](C)c2nc(C(C)(C)C)no2)c1C ZINC000428713339 338059198 /nfs/dbraw/zinc/05/91/98/338059198.db2.gz VPZGTVFVACQEPP-CQSZACIVSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1cccc(C[N@H+](C)[C@H](C)c2nc(C(C)(C)C)no2)c1C ZINC000428713339 338059199 /nfs/dbraw/zinc/05/91/99/338059199.db2.gz VPZGTVFVACQEPP-CQSZACIVSA-N 1 2 301.434 4.177 20 0 DIADLO CC[C@H](F)C[N@H+]1C[C@@H](c2cccc(C(F)(F)F)c2)O[C@@H](C)C1 ZINC000428933380 338065520 /nfs/dbraw/zinc/06/55/20/338065520.db2.gz UMFPPVPJXVCPCO-CQDKDKBSSA-N 1 2 319.342 4.215 20 0 DIADLO CC[C@H](F)C[N@@H+]1C[C@@H](c2cccc(C(F)(F)F)c2)O[C@@H](C)C1 ZINC000428933380 338065521 /nfs/dbraw/zinc/06/55/21/338065521.db2.gz UMFPPVPJXVCPCO-CQDKDKBSSA-N 1 2 319.342 4.215 20 0 DIADLO Cc1ccc(OC(F)F)c(C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)c1 ZINC000428943592 338065962 /nfs/dbraw/zinc/06/59/62/338065962.db2.gz PSXKWJFKAGVDJU-HNNXBMFYSA-N 1 2 321.371 4.047 20 0 DIADLO Cc1ccc(OC(F)F)c(C[N@H+]2CCCC[C@H]2c2cc[nH]n2)c1 ZINC000428943592 338065963 /nfs/dbraw/zinc/06/59/63/338065963.db2.gz PSXKWJFKAGVDJU-HNNXBMFYSA-N 1 2 321.371 4.047 20 0 DIADLO CCC(C)(C)CNC(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000429052709 338069813 /nfs/dbraw/zinc/06/98/13/338069813.db2.gz HENCMNCPRMCDDH-UHFFFAOYSA-N 1 2 312.413 4.348 20 0 DIADLO C[C@H]1C[N@H+](Cc2nc3ccccc3s2)Cc2ccccc2O1 ZINC000429170434 338072455 /nfs/dbraw/zinc/07/24/55/338072455.db2.gz KMEGIVRKZFRMHE-ZDUSSCGKSA-N 1 2 310.422 4.079 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nc3ccccc3s2)Cc2ccccc2O1 ZINC000429170434 338072456 /nfs/dbraw/zinc/07/24/56/338072456.db2.gz KMEGIVRKZFRMHE-ZDUSSCGKSA-N 1 2 310.422 4.079 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2Cc3ccccc3O[C@H](C)C2)n1 ZINC000429183746 338072671 /nfs/dbraw/zinc/07/26/71/338072671.db2.gz RKTCBANTPQKCPT-OAHLLOKOSA-N 1 2 313.445 4.027 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2Cc3ccccc3O[C@H](C)C2)n1 ZINC000429183746 338072672 /nfs/dbraw/zinc/07/26/72/338072672.db2.gz RKTCBANTPQKCPT-OAHLLOKOSA-N 1 2 313.445 4.027 20 0 DIADLO C[C@H]1CC[C@@H](N(C)C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000429251954 338074784 /nfs/dbraw/zinc/07/47/84/338074784.db2.gz JPNCLLSAFONWOT-GOEBONIOSA-N 1 2 310.397 4.135 20 0 DIADLO CC[C@@H]1CC[N@@H+]1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000429275792 338075613 /nfs/dbraw/zinc/07/56/13/338075613.db2.gz RURIQMXUEIPCHG-CQSZACIVSA-N 1 2 322.861 4.360 20 0 DIADLO CC[C@@H]1CC[N@H+]1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000429275792 338075614 /nfs/dbraw/zinc/07/56/14/338075614.db2.gz RURIQMXUEIPCHG-CQSZACIVSA-N 1 2 322.861 4.360 20 0 DIADLO Cc1ccc(C)c(C[N@H+](C)Cc2noc(-c3ccccc3C)n2)c1 ZINC000429300653 338077155 /nfs/dbraw/zinc/07/71/55/338077155.db2.gz IZCUSGROLFGZKY-UHFFFAOYSA-N 1 2 321.424 4.294 20 0 DIADLO Cc1ccc(C)c(C[N@@H+](C)Cc2noc(-c3ccccc3C)n2)c1 ZINC000429300653 338077156 /nfs/dbraw/zinc/07/71/56/338077156.db2.gz IZCUSGROLFGZKY-UHFFFAOYSA-N 1 2 321.424 4.294 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC000429373088 338078947 /nfs/dbraw/zinc/07/89/47/338078947.db2.gz QFQTYQVNHAEUGZ-UHFFFAOYSA-N 1 2 324.211 4.175 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC000429373088 338078948 /nfs/dbraw/zinc/07/89/48/338078948.db2.gz QFQTYQVNHAEUGZ-UHFFFAOYSA-N 1 2 324.211 4.175 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1csc(-c2cccs2)n1 ZINC000429410119 338080044 /nfs/dbraw/zinc/08/00/44/338080044.db2.gz ZHXOEZKEUQLFSQ-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1csc(-c2cccs2)n1 ZINC000429410119 338080045 /nfs/dbraw/zinc/08/00/45/338080045.db2.gz ZHXOEZKEUQLFSQ-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO CN(Cc1cn2c([nH+]1)CCCC2)Cc1ccc(C(C)(C)C)cc1 ZINC000429534226 338083238 /nfs/dbraw/zinc/08/32/38/338083238.db2.gz DIRGCYCHBWMCIQ-UHFFFAOYSA-N 1 2 311.473 4.149 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(C(C)(C)C)on2)c1 ZINC000429718712 338088245 /nfs/dbraw/zinc/08/82/45/338088245.db2.gz SVLCRAFRBRRORH-KRWDZBQOSA-N 1 2 314.429 4.318 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2cc(C(C)(C)C)on2)c1 ZINC000429718712 338088246 /nfs/dbraw/zinc/08/82/46/338088246.db2.gz SVLCRAFRBRRORH-KRWDZBQOSA-N 1 2 314.429 4.318 20 0 DIADLO CC(C)(C)c1cc(C[N@H+](Cc2ccc(F)cc2)C2CC2)no1 ZINC000429717295 338088258 /nfs/dbraw/zinc/08/82/58/338088258.db2.gz LPLGBPSRIZGUNQ-UHFFFAOYSA-N 1 2 302.393 4.276 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+](Cc2ccc(F)cc2)C2CC2)no1 ZINC000429717295 338088259 /nfs/dbraw/zinc/08/82/59/338088259.db2.gz LPLGBPSRIZGUNQ-UHFFFAOYSA-N 1 2 302.393 4.276 20 0 DIADLO Cc1csc(C[NH2+]Cc2cc(Cl)ccc2OCC2CC2)n1 ZINC000430019401 338093492 /nfs/dbraw/zinc/09/34/92/338093492.db2.gz XKTZLXPNRKHMFL-UHFFFAOYSA-N 1 2 322.861 4.184 20 0 DIADLO Fc1cc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)ccc1Cl ZINC000430036452 338094249 /nfs/dbraw/zinc/09/42/49/338094249.db2.gz RSRDDNHXTBEDDF-UHFFFAOYSA-N 1 2 321.676 4.325 20 0 DIADLO CC1(C)C[N@H+](Cc2c[nH]nc2-c2cccs2)[C@@H]1c1cccnc1 ZINC000430106327 338097109 /nfs/dbraw/zinc/09/71/09/338097109.db2.gz PRUMYFGJYYWOOV-QGZVFWFLSA-N 1 2 324.453 4.116 20 0 DIADLO CC1(C)C[N@@H+](Cc2c[nH]nc2-c2cccs2)[C@@H]1c1cccnc1 ZINC000430106327 338097110 /nfs/dbraw/zinc/09/71/10/338097110.db2.gz PRUMYFGJYYWOOV-QGZVFWFLSA-N 1 2 324.453 4.116 20 0 DIADLO C[C@@H]1C[C@H](Nc2cccc(C[N@H+](C)Cc3cscn3)c2)[C@@H]1C ZINC000430228513 338102172 /nfs/dbraw/zinc/10/21/72/338102172.db2.gz QVOWFBHDQSNFIG-LBTNJELSSA-N 1 2 315.486 4.232 20 0 DIADLO C[C@@H]1C[C@H](Nc2cccc(C[N@@H+](C)Cc3cscn3)c2)[C@@H]1C ZINC000430228513 338102173 /nfs/dbraw/zinc/10/21/73/338102173.db2.gz QVOWFBHDQSNFIG-LBTNJELSSA-N 1 2 315.486 4.232 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000430866288 338117511 /nfs/dbraw/zinc/11/75/11/338117511.db2.gz GFTNQSCCPXMQCV-PVAVHDDUSA-N 1 2 313.445 4.347 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000430866288 338117512 /nfs/dbraw/zinc/11/75/12/338117512.db2.gz GFTNQSCCPXMQCV-PVAVHDDUSA-N 1 2 313.445 4.347 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1cccc(Cl)c1F ZINC000430876259 338117847 /nfs/dbraw/zinc/11/78/47/338117847.db2.gz DHSSRICVJWFXPT-HNNXBMFYSA-N 1 2 321.827 4.423 20 0 DIADLO Cn1c2cc(F)ccc2[nH+]c1N1CCC[C@H]1c1ccc(F)cc1 ZINC000431036359 338120912 /nfs/dbraw/zinc/12/09/12/338120912.db2.gz FLHDCNSSPXEGBJ-INIZCTEOSA-N 1 2 313.351 4.193 20 0 DIADLO C[C@@H]1CCN(c2[nH+]c3ccc(F)cc3n2C)[C@H](c2ccco2)C1 ZINC000431425015 338130483 /nfs/dbraw/zinc/13/04/83/338130483.db2.gz ARSUOXAHQQNGDI-WBMJQRKESA-N 1 2 313.376 4.283 20 0 DIADLO C[C@H]1CCN(c2[nH+]c3ccc(F)cc3n2C)[C@H](c2ccco2)C1 ZINC000431425013 338130487 /nfs/dbraw/zinc/13/04/87/338130487.db2.gz ARSUOXAHQQNGDI-LRDDRELGSA-N 1 2 313.376 4.283 20 0 DIADLO Cc1cc2[nH+]cn(Cc3ncccc3C(F)(F)F)c2cc1C ZINC000431954680 338142634 /nfs/dbraw/zinc/14/26/34/338142634.db2.gz REZITNXXZVNGIL-UHFFFAOYSA-N 1 2 305.303 4.115 20 0 DIADLO COCCCCN(Cc1ccccc1)c1cc[nH+]c(C(C)C)n1 ZINC000432070512 338144964 /nfs/dbraw/zinc/14/49/64/338144964.db2.gz ZFIFXJBQRZTPNK-UHFFFAOYSA-N 1 2 313.445 4.033 20 0 DIADLO Cc1cc(N2CC3(CCC3)[C@@H]2c2ccccc2)nc(C2CC2)[nH+]1 ZINC000432145693 338147068 /nfs/dbraw/zinc/14/70/68/338147068.db2.gz VNOJTQBUHHHKKN-SFHVURJKSA-N 1 2 305.425 4.394 20 0 DIADLO CCc1noc(CC)c1C[NH2+]Cc1csc(Cl)c1Cl ZINC000432250162 338150969 /nfs/dbraw/zinc/15/09/69/338150969.db2.gz IZAHRKTVHWHQHA-UHFFFAOYSA-N 1 2 319.257 4.458 20 0 DIADLO CCc1cnc(C[NH2+]Cc2csc(Cl)c2Cl)s1 ZINC000432253540 338151161 /nfs/dbraw/zinc/15/11/61/338151161.db2.gz NXUONVMAAJBEOK-UHFFFAOYSA-N 1 2 307.271 4.364 20 0 DIADLO FC(F)(F)c1cnc(CNc2c[nH+]c3c(c2)CCCC3)s1 ZINC000432732506 338164667 /nfs/dbraw/zinc/16/46/67/338164667.db2.gz VJDZHJWSGRNMRM-UHFFFAOYSA-N 1 2 313.348 4.048 20 0 DIADLO Cn1cc(Cl)cc1C[N@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432731403 338164698 /nfs/dbraw/zinc/16/46/98/338164698.db2.gz YDQNLFVPNXQPKP-UHFFFAOYSA-N 1 2 323.824 4.059 20 0 DIADLO Cn1cc(Cl)cc1C[N@@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432731403 338164699 /nfs/dbraw/zinc/16/46/99/338164699.db2.gz YDQNLFVPNXQPKP-UHFFFAOYSA-N 1 2 323.824 4.059 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)s1 ZINC000432753247 338166474 /nfs/dbraw/zinc/16/64/74/338166474.db2.gz TWJOGKBWPKJFAU-GFCCVEGCSA-N 1 2 300.349 4.432 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)s1 ZINC000432753247 338166475 /nfs/dbraw/zinc/16/64/75/338166475.db2.gz TWJOGKBWPKJFAU-GFCCVEGCSA-N 1 2 300.349 4.432 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CC=C(C(F)(F)F)CC2)s1 ZINC000432754608 338166640 /nfs/dbraw/zinc/16/66/40/338166640.db2.gz MAUATJPPUCRXLW-UHFFFAOYSA-N 1 2 315.282 4.461 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CC=C(C(F)(F)F)CC2)s1 ZINC000432754608 338166641 /nfs/dbraw/zinc/16/66/41/338166641.db2.gz MAUATJPPUCRXLW-UHFFFAOYSA-N 1 2 315.282 4.461 20 0 DIADLO Cc1cc2cc(C[N@@H+](C)Cc3cn4c(n3)CCCC4)oc2cc1C ZINC000432790259 338167814 /nfs/dbraw/zinc/16/78/14/338167814.db2.gz WCTJVZJNTVBACN-UHFFFAOYSA-N 1 2 323.440 4.214 20 0 DIADLO Cc1cc2cc(C[N@H+](C)Cc3cn4c(n3)CCCC4)oc2cc1C ZINC000432790259 338167815 /nfs/dbraw/zinc/16/78/15/338167815.db2.gz WCTJVZJNTVBACN-UHFFFAOYSA-N 1 2 323.440 4.214 20 0 DIADLO Cc1cc2cc(CN(C)Cc3cn4c([nH+]3)CCCC4)oc2cc1C ZINC000432790259 338167816 /nfs/dbraw/zinc/16/78/16/338167816.db2.gz WCTJVZJNTVBACN-UHFFFAOYSA-N 1 2 323.440 4.214 20 0 DIADLO CN(Cc1cn2c([nH+]1)CCCC2)Cc1cccc(Cl)c1Cl ZINC000432793835 338168023 /nfs/dbraw/zinc/16/80/23/338168023.db2.gz QTDTUCISDPZUGC-UHFFFAOYSA-N 1 2 324.255 4.158 20 0 DIADLO Cn1cc[nH+]c1-c1cccc(NC(=O)NC(C)(C)C(C)(C)C)c1 ZINC000432799717 338168279 /nfs/dbraw/zinc/16/82/79/338168279.db2.gz ZFVDNPVCFMFPGX-UHFFFAOYSA-N 1 2 314.433 4.033 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nnc(C(C)(C)C)[nH]1)c1ccccc1Cl ZINC000432841969 338170371 /nfs/dbraw/zinc/17/03/71/338170371.db2.gz SJQNVFMTYNZUEV-OAHLLOKOSA-N 1 2 320.868 4.243 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCC[N@@H+]2Cc2cocn2)c1 ZINC000432923387 338173281 /nfs/dbraw/zinc/17/32/81/338173281.db2.gz SFVQRXHIWIUENU-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCC[N@H+]2Cc2cocn2)c1 ZINC000432923387 338173282 /nfs/dbraw/zinc/17/32/82/338173282.db2.gz SFVQRXHIWIUENU-OAHLLOKOSA-N 1 2 310.319 4.421 20 0 DIADLO C[C@@H](c1cnn(C)c1)[N@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432922673 338173337 /nfs/dbraw/zinc/17/33/37/338173337.db2.gz OXLCJHJGEVEHBR-VIFPVBQESA-N 1 2 316.207 4.059 20 0 DIADLO C[C@@H](c1cnn(C)c1)[N@@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432922673 338173338 /nfs/dbraw/zinc/17/33/38/338173338.db2.gz OXLCJHJGEVEHBR-VIFPVBQESA-N 1 2 316.207 4.059 20 0 DIADLO Cc1ccc(NC(=O)NCc2ccc(C(C)(F)F)cc2)c(C)[nH+]1 ZINC000433024300 338176906 /nfs/dbraw/zinc/17/69/06/338176906.db2.gz CHYRFTGFJNGTJD-UHFFFAOYSA-N 1 2 319.355 4.132 20 0 DIADLO Cc1ccc(NC(=O)NCc2cc3ccccc3s2)c(C)[nH+]1 ZINC000433028684 338177211 /nfs/dbraw/zinc/17/72/11/338177211.db2.gz PFQBQJHLYIRESM-UHFFFAOYSA-N 1 2 311.410 4.235 20 0 DIADLO CSc1ccc(OCC[NH2+][C@@H](c2ccccc2)C(F)F)cc1 ZINC000433047299 338178414 /nfs/dbraw/zinc/17/84/14/338178414.db2.gz RUURIDRAOSLSMO-INIZCTEOSA-N 1 2 323.408 4.383 20 0 DIADLO FC(F)[C@@H]([NH2+]CCCOCCc1ccccc1)c1ccccc1 ZINC000433049445 338178611 /nfs/dbraw/zinc/17/86/11/338178611.db2.gz UVSQYFRVNDKTOQ-SFHVURJKSA-N 1 2 319.395 4.232 20 0 DIADLO COc1cccc(CCC[NH2+][C@H](c2ccccc2)C(F)F)c1 ZINC000433053155 338178745 /nfs/dbraw/zinc/17/87/45/338178745.db2.gz OJWREOWELODWIA-QGZVFWFLSA-N 1 2 305.368 4.224 20 0 DIADLO COc1cccc(CCC[NH2+][C@@H](c2ccccc2)C(F)F)c1 ZINC000433053154 338178844 /nfs/dbraw/zinc/17/88/44/338178844.db2.gz OJWREOWELODWIA-KRWDZBQOSA-N 1 2 305.368 4.224 20 0 DIADLO CC(C)[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1nnc(C(C)(C)C)[nH]1 ZINC000433199219 338185480 /nfs/dbraw/zinc/18/54/80/338185480.db2.gz KFRVWBGRBLPLMB-INIZCTEOSA-N 1 2 318.440 4.070 20 0 DIADLO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1nnc(C(C)(C)C)[nH]1 ZINC000433199219 338185481 /nfs/dbraw/zinc/18/54/81/338185481.db2.gz KFRVWBGRBLPLMB-INIZCTEOSA-N 1 2 318.440 4.070 20 0 DIADLO C[N@H+](Cc1ccn(C2CCCC2)n1)Cc1ccc(F)c(Cl)c1 ZINC000433239808 338187407 /nfs/dbraw/zinc/18/74/07/338187407.db2.gz IZPCLRYSTBQKEV-UHFFFAOYSA-N 1 2 321.827 4.423 20 0 DIADLO C[N@@H+](Cc1ccn(C2CCCC2)n1)Cc1ccc(F)c(Cl)c1 ZINC000433239808 338187408 /nfs/dbraw/zinc/18/74/08/338187408.db2.gz IZPCLRYSTBQKEV-UHFFFAOYSA-N 1 2 321.827 4.423 20 0 DIADLO C[N@H+](Cc1nc(C2CC2)cs1)Cc1ccc(F)c(Cl)c1 ZINC000433242886 338187760 /nfs/dbraw/zinc/18/77/60/338187760.db2.gz GWGXIINYSHPIBV-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO C[N@@H+](Cc1nc(C2CC2)cs1)Cc1ccc(F)c(Cl)c1 ZINC000433242886 338187761 /nfs/dbraw/zinc/18/77/61/338187761.db2.gz GWGXIINYSHPIBV-UHFFFAOYSA-N 1 2 310.825 4.445 20 0 DIADLO Cc1ccc(NC(=O)N(C)Cc2ccc(F)c(Cl)c2)c(C)[nH+]1 ZINC000433498676 338195883 /nfs/dbraw/zinc/19/58/83/338195883.db2.gz PFVASLLWRXJREB-UHFFFAOYSA-N 1 2 321.783 4.155 20 0 DIADLO Cc1ccc(NC(=O)N(C)C2CCC(C(C)C)CC2)c(C)[nH+]1 ZINC000433499758 338195891 /nfs/dbraw/zinc/19/58/91/338195891.db2.gz SYCXZLNFSPYDGY-UHFFFAOYSA-N 1 2 303.450 4.377 20 0 DIADLO CC(C)c1nc(N2CCC[C@]2(C)CCCO)cc(C(C)(C)C)[nH+]1 ZINC000433753072 338200626 /nfs/dbraw/zinc/20/06/26/338200626.db2.gz GAWLZGBWIUHJMR-LJQANCHMSA-N 1 2 319.493 4.029 20 0 DIADLO Cc1nc2[nH]ccc2c(N2CCC[C@@H](c3ccccc3)CC2)[nH+]1 ZINC000433778935 338201606 /nfs/dbraw/zinc/20/16/06/338201606.db2.gz DNNFNIUDGNZDJB-MRXNPFEDSA-N 1 2 306.413 4.040 20 0 DIADLO Cc1nc2[nH]ccc2c(N2CCC[C@H]2c2cccc(Cl)c2)[nH+]1 ZINC000433782154 338201794 /nfs/dbraw/zinc/20/17/94/338201794.db2.gz ZJDXNRMXYLNJLV-HNNXBMFYSA-N 1 2 312.804 4.261 20 0 DIADLO Cc1nc2[nH]ccc2c(N2CCCC[C@H]2c2ccc(F)cc2)[nH+]1 ZINC000433787862 338201891 /nfs/dbraw/zinc/20/18/91/338201891.db2.gz YXSAHGFUWVBHPH-INIZCTEOSA-N 1 2 310.376 4.137 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccccc3C(C)(C)C)ccc2[nH+]1 ZINC000433933929 338205181 /nfs/dbraw/zinc/20/51/81/338205181.db2.gz NCUXOKWGKJXHRW-UHFFFAOYSA-N 1 2 307.397 4.193 20 0 DIADLO Cc1ccc2oc(C(=O)Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2c1 ZINC000162843331 338212164 /nfs/dbraw/zinc/21/21/64/338212164.db2.gz DHBRJFIHKSXMCY-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2ncnn2C(C)C)c2ccccc2)cc1 ZINC000434473939 338216821 /nfs/dbraw/zinc/21/68/21/338216821.db2.gz JNKWZIYUHIQOFQ-HXUWFJFHSA-N 1 2 320.440 4.047 20 0 DIADLO Cc1ccccc1C1CC([N@H+](Cc2ncnn2C(C)C)C2CC2)C1 ZINC000434543751 338219881 /nfs/dbraw/zinc/21/98/81/338219881.db2.gz SKUZYDAUJBVELG-UHFFFAOYSA-N 1 2 324.472 4.078 20 0 DIADLO Cc1ccccc1C1CC([N@@H+](Cc2ncnn2C(C)C)C2CC2)C1 ZINC000434543751 338219882 /nfs/dbraw/zinc/21/98/82/338219882.db2.gz SKUZYDAUJBVELG-UHFFFAOYSA-N 1 2 324.472 4.078 20 0 DIADLO CC[C@H](c1ccccc1)[S@@](=O)Cc1[nH+]ccn1-c1ccccc1 ZINC000434623608 338221477 /nfs/dbraw/zinc/22/14/77/338221477.db2.gz DENSRGVAVRVMAZ-JPYJTQIMSA-N 1 2 324.449 4.272 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)[C@@H](c2ccc(F)cc2)C(C)C)no1 ZINC000434626491 338221705 /nfs/dbraw/zinc/22/17/05/338221705.db2.gz YTJPGFDWLULGRK-MRXNPFEDSA-N 1 2 305.397 4.161 20 0 DIADLO CC(C)c1nc(C[N@H+](C)[C@@H](c2ccc(F)cc2)C(C)C)no1 ZINC000434626491 338221706 /nfs/dbraw/zinc/22/17/06/338221706.db2.gz YTJPGFDWLULGRK-MRXNPFEDSA-N 1 2 305.397 4.161 20 0 DIADLO CC1(C)CCC([S@@](=O)Cc2[nH+]ccn2-c2ccccc2)CC1 ZINC000434635488 338222161 /nfs/dbraw/zinc/22/21/61/338222161.db2.gz GIAYNDSLTVLZCH-QFIPXVFZSA-N 1 2 316.470 4.090 20 0 DIADLO COc1cc(C)[nH+]c(COc2cnccc2-c2ccccc2)c1 ZINC000434751309 338224859 /nfs/dbraw/zinc/22/48/59/338224859.db2.gz DQBVZTMPSJFAOP-UHFFFAOYSA-N 1 2 306.365 4.040 20 0 DIADLO CCCn1c2ccccc2nc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000434989084 338229139 /nfs/dbraw/zinc/22/91/39/338229139.db2.gz ZOWKPXPZAZPCCA-SFHVURJKSA-N 1 2 305.425 4.393 20 0 DIADLO CCCn1c2ccccc2nc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000434989084 338229140 /nfs/dbraw/zinc/22/91/40/338229140.db2.gz ZOWKPXPZAZPCCA-SFHVURJKSA-N 1 2 305.425 4.393 20 0 DIADLO CCCn1c2ccccc2nc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000434989083 338229248 /nfs/dbraw/zinc/22/92/48/338229248.db2.gz ZOWKPXPZAZPCCA-GOSISDBHSA-N 1 2 305.425 4.393 20 0 DIADLO CCCn1c2ccccc2nc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000434989083 338229249 /nfs/dbraw/zinc/22/92/49/338229249.db2.gz ZOWKPXPZAZPCCA-GOSISDBHSA-N 1 2 305.425 4.393 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)s1 ZINC000435126991 338232706 /nfs/dbraw/zinc/23/27/06/338232706.db2.gz SZVGCOWEMYGHSL-GFCCVEGCSA-N 1 2 312.360 4.151 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CC[C@@H](c3ccccc3)C2)s1 ZINC000435126991 338232707 /nfs/dbraw/zinc/23/27/07/338232707.db2.gz SZVGCOWEMYGHSL-GFCCVEGCSA-N 1 2 312.360 4.151 20 0 DIADLO CCCc1cc(=O)[nH]c(C(=Cc2c[nH+]c3cc(C)ccn23)CC)n1 ZINC000435335652 338237233 /nfs/dbraw/zinc/23/72/33/338237233.db2.gz KCJQBHHOIBNHIE-UVTDQMKNSA-N 1 2 322.412 4.041 20 0 DIADLO Cc1nc(N[C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)cc[nH+]1 ZINC000435593499 338243129 /nfs/dbraw/zinc/24/31/29/338243129.db2.gz MVPGEPAFKNIBCZ-MQMHXKEQSA-N 1 2 307.319 4.162 20 0 DIADLO CCC[C@H](NC(=O)[C@H](C)[NH+]1Cc2ccccc2C1)c1ccccc1 ZINC000436133984 338259207 /nfs/dbraw/zinc/25/92/07/338259207.db2.gz UFSKZADLHWTNIF-JXFKEZNVSA-N 1 2 322.452 4.048 20 0 DIADLO CCC1(C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)CCC1 ZINC000436162227 338260100 /nfs/dbraw/zinc/26/01/00/338260100.db2.gz NPCBOOWJTVUVRN-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO C[C@H]1CC[C@@H](C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)C1 ZINC000436173080 338260564 /nfs/dbraw/zinc/26/05/64/338260564.db2.gz AJMGKRBMSZARMX-GOEBONIOSA-N 1 2 323.440 4.261 20 0 DIADLO CC(C)[C@H]1C[C@@H]1C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436185667 338261097 /nfs/dbraw/zinc/26/10/97/338261097.db2.gz FKPZPRGMPAAYGW-MSOLQXFVSA-N 1 2 323.440 4.117 20 0 DIADLO CC[C@@]1(C)C[C@@H]1C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436188716 338261170 /nfs/dbraw/zinc/26/11/70/338261170.db2.gz RZMNJRXHCBEAOR-XLIONFOSSA-N 1 2 323.440 4.261 20 0 DIADLO CC[C@H](C)CC(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436193107 338261411 /nfs/dbraw/zinc/26/14/11/338261411.db2.gz WKQSIXAGHGBLGY-AWEZNQCLSA-N 1 2 311.429 4.261 20 0 DIADLO COc1ccc(CNc2cccc([NH+]3CCCCCC3)c2)cn1 ZINC000436294206 338266914 /nfs/dbraw/zinc/26/69/14/338266914.db2.gz DZQZDRNMTJBCHW-UHFFFAOYSA-N 1 2 311.429 4.083 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1)c1ccon1 ZINC000436410972 338271495 /nfs/dbraw/zinc/27/14/95/338271495.db2.gz OKUHUPQCHAAWEQ-MRVPVSSYSA-N 1 2 304.699 4.198 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(-c2ccncc2)cc1)c1csnn1 ZINC000436470072 338273222 /nfs/dbraw/zinc/27/32/22/338273222.db2.gz IAYIYQPQMSZMSD-CHWSQXEVSA-N 1 2 310.426 4.012 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1csnn1)c1ccc(-c2ccncc2)cc1 ZINC000436470073 338273272 /nfs/dbraw/zinc/27/32/72/338273272.db2.gz IAYIYQPQMSZMSD-OLZOCXBDSA-N 1 2 310.426 4.012 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC3(C2)CCCCC3)c(C)[nH+]1 ZINC000436486020 338273932 /nfs/dbraw/zinc/27/39/32/338273932.db2.gz BDZRACIFJNTKQR-UHFFFAOYSA-N 1 2 301.434 4.195 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@H](c3ccccc3)C2)c(C)[nH+]1 ZINC000436489723 338274111 /nfs/dbraw/zinc/27/41/11/338274111.db2.gz GCTLTRLDNCPWDI-QGZVFWFLSA-N 1 2 309.413 4.028 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](C)c2ccc(F)cc2F)c(C)[nH+]1 ZINC000436500010 338274434 /nfs/dbraw/zinc/27/44/34/338274434.db2.gz YSBZHFSPSPVWGO-LLVKDONJSA-N 1 2 319.355 4.168 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@H](C)c1ccccc1OCc1ccccc1 ZINC000436934933 338294405 /nfs/dbraw/zinc/29/44/05/338294405.db2.gz UUCJACTUHNVQEQ-MRXNPFEDSA-N 1 2 321.424 4.148 20 0 DIADLO Cc1cccc(C)c1CSCc1[nH+]ccn1CC(F)(F)F ZINC000437283626 338306081 /nfs/dbraw/zinc/30/60/81/338306081.db2.gz AYRITAWLUOTVTK-UHFFFAOYSA-N 1 2 314.376 4.496 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000437604237 338315968 /nfs/dbraw/zinc/31/59/68/338315968.db2.gz NVHMXXFEADTJTP-VLIAUNLRSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000437604237 338315969 /nfs/dbraw/zinc/31/59/69/338315969.db2.gz NVHMXXFEADTJTP-VLIAUNLRSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000437604238 338315983 /nfs/dbraw/zinc/31/59/83/338315983.db2.gz NVHMXXFEADTJTP-XOBRGWDASA-N 1 2 324.399 4.269 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000437604238 338315984 /nfs/dbraw/zinc/31/59/84/338315984.db2.gz NVHMXXFEADTJTP-XOBRGWDASA-N 1 2 324.399 4.269 20 0 DIADLO CCCOc1ccccc1OCc1c[nH+]cn1Cc1ccccc1 ZINC000437627254 338316588 /nfs/dbraw/zinc/31/65/88/338316588.db2.gz SWYVETLCSQBQGY-UHFFFAOYSA-N 1 2 322.408 4.299 20 0 DIADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2cc3c(cccc3F)[nH]2)cs1 ZINC000437984298 338327332 /nfs/dbraw/zinc/32/73/32/338327332.db2.gz FBSLFKLQYAGVDP-KRWDZBQOSA-N 1 2 315.417 4.409 20 0 DIADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2cc3c(cccc3F)[nH]2)cs1 ZINC000437984298 338327333 /nfs/dbraw/zinc/32/73/33/338327333.db2.gz FBSLFKLQYAGVDP-KRWDZBQOSA-N 1 2 315.417 4.409 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NCC[C@@H]2CCOC2)c1 ZINC000438089684 338330891 /nfs/dbraw/zinc/33/08/91/338330891.db2.gz RGWNENJTFHAXNV-MRXNPFEDSA-N 1 2 313.445 4.189 20 0 DIADLO Fc1c(Cl)cccc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438300669 338339001 /nfs/dbraw/zinc/33/90/01/338339001.db2.gz DIVHNNUHHYILKZ-UHFFFAOYSA-N 1 2 315.779 4.336 20 0 DIADLO CCc1ccc(CCn2nc(C(F)(F)F)c3c[nH+]ccc32)cc1 ZINC000438300673 338339041 /nfs/dbraw/zinc/33/90/41/338339041.db2.gz DJCZCLWOWSVGPJ-UHFFFAOYSA-N 1 2 319.330 4.255 20 0 DIADLO Fc1ccc(NCc2c[nH+]cn2Cc2ccccc2)c(Cl)c1 ZINC000438319414 338339448 /nfs/dbraw/zinc/33/94/48/338339448.db2.gz NZTKAEDMDWNQNP-UHFFFAOYSA-N 1 2 315.779 4.336 20 0 DIADLO c1[nH+]cn(Cc2ccccc2)c1CNc1cccc2c1CCCC2 ZINC000438318943 338339497 /nfs/dbraw/zinc/33/94/97/338339497.db2.gz MDAVQEIYAKBRSQ-UHFFFAOYSA-N 1 2 317.436 4.422 20 0 DIADLO Cc1ccc(C(=O)N(C)CCC2CC2)cc1Oc1cc[nH+]cc1 ZINC000156213050 338346746 /nfs/dbraw/zinc/34/67/46/338346746.db2.gz SIKCVGWYLIAZJT-UHFFFAOYSA-N 1 2 310.397 4.054 20 0 DIADLO Cc1ccc(-n2cc[nH+]c2)c(C(=O)Nc2ccsc2Cl)c1 ZINC000438553049 338347919 /nfs/dbraw/zinc/34/79/19/338347919.db2.gz MTVKVMADCZHDBZ-UHFFFAOYSA-N 1 2 317.801 4.148 20 0 DIADLO Cc1ccc(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)cc1O ZINC000438751852 338351738 /nfs/dbraw/zinc/35/17/38/338351738.db2.gz JQTMXONWZDPLDB-UHFFFAOYSA-N 1 2 320.348 4.140 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@@H](c3ccccc3)C[C@@H]2C)c(C)[nH+]1 ZINC000439447772 338369764 /nfs/dbraw/zinc/36/97/64/338369764.db2.gz FXUFIJKLJJTJEB-MAUKXSAKSA-N 1 2 323.440 4.498 20 0 DIADLO Fc1cccc2c3c([nH]c21)C[N@@H+](CCC(F)(F)F)CCC3 ZINC000439481601 338371210 /nfs/dbraw/zinc/37/12/10/338371210.db2.gz JWWBMKXTVCTTRT-UHFFFAOYSA-N 1 2 300.299 4.008 20 0 DIADLO Fc1cccc2c3c([nH]c21)C[N@H+](CCC(F)(F)F)CCC3 ZINC000439481601 338371211 /nfs/dbraw/zinc/37/12/11/338371211.db2.gz JWWBMKXTVCTTRT-UHFFFAOYSA-N 1 2 300.299 4.008 20 0 DIADLO COC(=O)[C@H]([NH2+][C@@H]1CC[C@H]2CCC[C@@H]2C1)c1cccc(Cl)c1 ZINC000439616429 338374616 /nfs/dbraw/zinc/37/46/16/338374616.db2.gz JKSJMJWSIXIGEP-BQGCOEIASA-N 1 2 321.848 4.113 20 0 DIADLO Cn1c[nH+]cc1CNc1cc(Cl)ccc1Oc1ccccc1 ZINC000439622141 338374839 /nfs/dbraw/zinc/37/48/39/338374839.db2.gz ZRNDHYGIGJQQJH-UHFFFAOYSA-N 1 2 313.788 4.478 20 0 DIADLO Cc1sc2nc(C)nc(Nc3ccc4c(c3)[nH+]cn4C)c2c1C ZINC000439703185 338376146 /nfs/dbraw/zinc/37/61/46/338376146.db2.gz HEAAOPJJTOHXFZ-UHFFFAOYSA-N 1 2 323.425 4.247 20 0 DIADLO Cc1ccsc1CCCC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000439857411 338379741 /nfs/dbraw/zinc/37/97/41/338379741.db2.gz PUGILHHDZJFEAB-UHFFFAOYSA-N 1 2 302.443 4.338 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@H+](C)Cc1cnc(C(C)C)nc1 ZINC000440475124 338388071 /nfs/dbraw/zinc/38/80/71/338388071.db2.gz SBTLMBAGAPAKPM-KRWDZBQOSA-N 1 2 319.399 4.461 20 0 DIADLO CC[C@@H](c1ccc(F)cc1F)[N@@H+](C)Cc1cnc(C(C)C)nc1 ZINC000440475124 338388072 /nfs/dbraw/zinc/38/80/72/338388072.db2.gz SBTLMBAGAPAKPM-KRWDZBQOSA-N 1 2 319.399 4.461 20 0 DIADLO CC[C@H](F)C[N@@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000440488999 338388391 /nfs/dbraw/zinc/38/83/91/338388391.db2.gz CLZDXQHJBFAKAU-UWVGGRQHSA-N 1 2 306.244 4.396 20 0 DIADLO CC[C@H](F)C[N@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000440488999 338388392 /nfs/dbraw/zinc/38/83/92/338388392.db2.gz CLZDXQHJBFAKAU-UWVGGRQHSA-N 1 2 306.244 4.396 20 0 DIADLO CC[C@@H](F)C[N@@H+]1CCC[C@@H]1c1ccc(Br)s1 ZINC000440488995 338388427 /nfs/dbraw/zinc/38/84/27/338388427.db2.gz CLZDXQHJBFAKAU-NXEZZACHSA-N 1 2 306.244 4.396 20 0 DIADLO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1ccc(Br)s1 ZINC000440488995 338388428 /nfs/dbraw/zinc/38/84/28/338388428.db2.gz CLZDXQHJBFAKAU-NXEZZACHSA-N 1 2 306.244 4.396 20 0 DIADLO c1cn(Cc2ccccc2)c(Cc2nc(C3CCC3)cs2)[nH+]1 ZINC000440516826 338388957 /nfs/dbraw/zinc/38/89/57/338388957.db2.gz RPGULOZIOJLBGH-UHFFFAOYSA-N 1 2 309.438 4.246 20 0 DIADLO C[C@@H](SCC(C)(C)C)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000440582307 338391036 /nfs/dbraw/zinc/39/10/36/338391036.db2.gz GQDYQMRBEHHPGG-GFCCVEGCSA-N 1 2 317.458 4.183 20 0 DIADLO COC[C@@H](Nc1cc[nH+]c2c(OC)cccc12)c1ccccc1 ZINC000440652302 338394351 /nfs/dbraw/zinc/39/43/51/338394351.db2.gz ROQXVUDQBFQMRG-QGZVFWFLSA-N 1 2 308.381 4.043 20 0 DIADLO Cc1cn2cc(NC(=O)CC[C@@H](C)c3ccccc3)ccc2[nH+]1 ZINC000440784680 338397348 /nfs/dbraw/zinc/39/73/48/338397348.db2.gz NMLQFDZGUKCVET-CQSZACIVSA-N 1 2 307.397 4.165 20 0 DIADLO CC[C@@H](F)C[N@@H+]1CCC[C@@H]1c1nc(-c2ccc(F)cc2)c[nH]1 ZINC000440785576 338397451 /nfs/dbraw/zinc/39/74/51/338397451.db2.gz PRPYYNGSPBGWEF-CZUORRHYSA-N 1 2 305.372 4.101 20 0 DIADLO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1nc(-c2ccc(F)cc2)c[nH]1 ZINC000440785576 338397452 /nfs/dbraw/zinc/39/74/52/338397452.db2.gz PRPYYNGSPBGWEF-CZUORRHYSA-N 1 2 305.372 4.101 20 0 DIADLO Cc1ccc(Cl)c(N(Cc2[nH]cc[nH+]2)C(=O)[C@H](C)C(C)C)c1 ZINC000440908117 338399756 /nfs/dbraw/zinc/39/97/56/338399756.db2.gz YYAMCETWWSOACD-CYBMUJFWSA-N 1 2 319.836 4.197 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)[C@H]2C[C@H]2C2CC2)c1C(C)C ZINC000441579405 338417210 /nfs/dbraw/zinc/41/72/10/338417210.db2.gz HXIKDNJCFIASSD-HOTGVXAUSA-N 1 2 308.425 4.073 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@@H](Cc3ccccc3)[C@@H]2C)c(C)[nH+]1 ZINC000447168355 338546729 /nfs/dbraw/zinc/54/67/29/338546729.db2.gz MMZUKHIFFDUDTL-WMZOPIPTSA-N 1 2 323.440 4.183 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H]2CC[C@H]3CCCC[C@@H]3C2)c(C)[nH+]1 ZINC000447176308 338546847 /nfs/dbraw/zinc/54/68/47/338546847.db2.gz MVKFFSSFEGBALE-BZUAXINKSA-N 1 2 301.434 4.179 20 0 DIADLO Cc1c(Cl)cccc1C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000194563015 338565758 /nfs/dbraw/zinc/56/57/58/338565758.db2.gz APDITKMJKGHHKM-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO Fc1cc2c(c(F)c1F)[C@@H]([NH2+]Cc1ccc(Cl)o1)CC2 ZINC000449058779 338589033 /nfs/dbraw/zinc/58/90/33/338589033.db2.gz LWTVIIROHVYLSA-JTQLQIEISA-N 1 2 301.695 4.127 20 0 DIADLO Fc1cccc(F)c1C[NH2+][C@H]1CCc2cc(F)c(F)c(F)c21 ZINC000449191441 338601042 /nfs/dbraw/zinc/60/10/42/338601042.db2.gz SJDLVFLWSDADBP-ZDUSSCGKSA-N 1 2 313.269 4.159 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccc(C)cc2OCCC(C)C)s1 ZINC000449194502 338601243 /nfs/dbraw/zinc/60/12/43/338601243.db2.gz SSLMDABOJYABCS-UHFFFAOYSA-N 1 2 318.486 4.475 20 0 DIADLO Fc1ccc([C@@H](CC(F)(F)F)[NH2+]Cc2ccncc2F)cc1 ZINC000449207681 338602414 /nfs/dbraw/zinc/60/24/14/338602414.db2.gz CMFIBYGCTOQEJG-CQSZACIVSA-N 1 2 316.273 4.143 20 0 DIADLO CC(C)(C)OCc1cc(C[NH2+]Cc2cccc3ccoc32)no1 ZINC000449260948 338607812 /nfs/dbraw/zinc/60/78/12/338607812.db2.gz ZEBSYFMSKSNFEL-UHFFFAOYSA-N 1 2 314.385 4.026 20 0 DIADLO CC(C)[C@H]([NH2+]C1CCC(OC2CCCC2)CC1)C(F)(F)F ZINC000449272117 338608613 /nfs/dbraw/zinc/60/86/13/338608613.db2.gz KWHLXQPORSARTD-ZALBZXLWSA-N 1 2 307.400 4.433 20 0 DIADLO C[C@@H]1CSC[C@H]1Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000449281588 338609133 /nfs/dbraw/zinc/60/91/33/338609133.db2.gz DGLBGXKCRWLUSE-CXAGYDPISA-N 1 2 313.470 4.050 20 0 DIADLO CCSc1cccc(CN2CC(C)(C)[C@@H]2c2[nH+]ccn2C)c1 ZINC000449413724 338622209 /nfs/dbraw/zinc/62/22/09/338622209.db2.gz KAYDBMCNMRYVCR-INIZCTEOSA-N 1 2 315.486 4.115 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(-c2c(F)cccc2F)s1)C(C)(F)F ZINC000449413395 338622251 /nfs/dbraw/zinc/62/22/51/338622251.db2.gz IJXOZIIJMYTPHH-QMMMGPOBSA-N 1 2 318.339 4.222 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2coc(-c3ccccc3)n2)c2ccccc2O1 ZINC000449425002 338623235 /nfs/dbraw/zinc/62/32/35/338623235.db2.gz LQTJCUCBXNOARV-RDTXWAMCSA-N 1 2 320.392 4.344 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3)cc2F)c2nccn21 ZINC000449574281 338639270 /nfs/dbraw/zinc/63/92/70/338639270.db2.gz UILDVUFTTOYOHJ-IFXJQAMLSA-N 1 2 321.399 4.485 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]Cc2c(Cl)oc3ccccc32)c2nccn21 ZINC000449575928 338639388 /nfs/dbraw/zinc/63/93/88/338639388.db2.gz ZAOFMLUXZPCXIT-MFKMUULPSA-N 1 2 301.777 4.078 20 0 DIADLO CCCc1ncc(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)o1 ZINC000449615207 338641301 /nfs/dbraw/zinc/64/13/01/338641301.db2.gz YITHKQZBKSBHAV-UHFFFAOYSA-N 1 2 317.191 4.363 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H]2CCCCC2(F)F)[nH+]1 ZINC000450208475 338671130 /nfs/dbraw/zinc/67/11/30/338671130.db2.gz NGZBUMJKOXZQPY-ZDUSSCGKSA-N 1 2 319.355 4.149 20 0 DIADLO CCOC[C@H]1CCCN(c2cc[nH+]c3cc(F)c(Cl)cc32)C1 ZINC000450327936 338677649 /nfs/dbraw/zinc/67/76/49/338677649.db2.gz AHYVKTRKNAUMSO-LBPRGKRZSA-N 1 2 322.811 4.280 20 0 DIADLO CC(C)([NH2+]Cc1nnc(C2CC2)s1)c1cccc(Cl)c1 ZINC000450671089 338697630 /nfs/dbraw/zinc/69/76/30/338697630.db2.gz HJNZFGJHCQUVCL-UHFFFAOYSA-N 1 2 307.850 4.094 20 0 DIADLO C[C@@H]([NH2+]Cc1nnc(C2CC2)s1)c1ccc(F)c(Cl)c1 ZINC000450679612 338698522 /nfs/dbraw/zinc/69/85/22/338698522.db2.gz XAXMGLOOYPLMQH-MRVPVSSYSA-N 1 2 311.813 4.059 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C)c1csnn1 ZINC000450692574 338699460 /nfs/dbraw/zinc/69/94/60/338699460.db2.gz KWLDSRSHFYVHRJ-WIHQQPEOSA-N 1 2 307.850 4.239 20 0 DIADLO CO[C@H]1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C[C@@H]1C ZINC000450769575 338704705 /nfs/dbraw/zinc/70/47/05/338704705.db2.gz WLWKWTJHUFZHEI-NHYWBVRUSA-N 1 2 324.346 4.115 20 0 DIADLO CCn1cc([C@H](C)Nc2cc[nH+]c3c(Cl)cccc23)cn1 ZINC000450879757 338710249 /nfs/dbraw/zinc/71/02/49/338710249.db2.gz VEUGSBICQRMMPR-NSHDSACASA-N 1 2 300.793 4.278 20 0 DIADLO CC[C@H]1C[C@]1([NH2+]Cc1nnc(C2CC2)s1)c1cccc(C)c1 ZINC000450924319 338712555 /nfs/dbraw/zinc/71/25/55/338712555.db2.gz UFEWFNLDDCGJPG-KBXCAEBGSA-N 1 2 313.470 4.139 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@]2(c3ccc(Cl)cc3)C[C@H]2C)s1 ZINC000450931935 338713016 /nfs/dbraw/zinc/71/30/16/338713016.db2.gz YYLQAJIZAZNZJG-BDJLRTHQSA-N 1 2 321.877 4.340 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)c2ccccc21)c1csnn1 ZINC000451038285 338718895 /nfs/dbraw/zinc/71/88/95/338718895.db2.gz NBRICOIMMFELHJ-WDEREUQCSA-N 1 2 301.390 4.242 20 0 DIADLO CCC[C@@H]1CCC[C@@H]1C(=O)N1CCCC[C@H]1c1[nH+]ccn1CC ZINC000451388460 338732189 /nfs/dbraw/zinc/73/21/89/338732189.db2.gz CBXMBPCTXYJJLM-IKGGRYGDSA-N 1 2 317.477 4.173 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](CC(F)(F)F)c1ccccc1 ZINC000453059477 338788653 /nfs/dbraw/zinc/78/86/53/338788653.db2.gz KZKLSZPRQVMPOC-JSGCOSHPSA-N 1 2 311.351 4.247 20 0 DIADLO C[C@H]1C[C@H]([NH2+]C2c3ccccc3-c3ccccc32)c2nccn21 ZINC000453075335 338790813 /nfs/dbraw/zinc/79/08/13/338790813.db2.gz HLWYHBBXPVCUMB-UGSOOPFHSA-N 1 2 301.393 4.249 20 0 DIADLO CC(C)CCOc1ccccc1C[NH2+][C@H]1C[C@H](C)n2ccnc21 ZINC000453097090 338793328 /nfs/dbraw/zinc/79/33/28/338793328.db2.gz QHCLVVGKPOTYCT-RDJZCZTQSA-N 1 2 313.445 4.104 20 0 DIADLO Cc1ccc[nH+]c1CCc1noc(CC[C@@H](C)c2ccccc2)n1 ZINC000453216367 338809176 /nfs/dbraw/zinc/80/91/76/338809176.db2.gz DOYOKGWNUGTKPO-OAHLLOKOSA-N 1 2 321.424 4.295 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1cnn(-c2ccc(F)cc2)c1C)C(F)F ZINC000453242919 338813212 /nfs/dbraw/zinc/81/32/12/338813212.db2.gz IHAUGCSJTYSDQD-ZUZCIYMTSA-N 1 2 311.351 4.014 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+]Cc2nn(C)cc2Cl)cc1 ZINC000453310994 338822533 /nfs/dbraw/zinc/82/25/33/338822533.db2.gz BHUVDTBWXSMDLF-LLVKDONJSA-N 1 2 309.866 4.036 20 0 DIADLO CC(C)c1ccc2c(c1)[C@H]([NH2+]Cc1nn(C)cc1Cl)CCC2 ZINC000453312328 338822788 /nfs/dbraw/zinc/82/27/88/338822788.db2.gz CREFNNLGWJSRPI-QGZVFWFLSA-N 1 2 317.864 4.364 20 0 DIADLO CC[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(Cl)s1 ZINC000453325691 338825148 /nfs/dbraw/zinc/82/51/48/338825148.db2.gz RPDPIQYPHRVTCJ-SECBINFHSA-N 1 2 304.246 4.029 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+][C@H](C)c1nccn1CC ZINC000453379048 338834763 /nfs/dbraw/zinc/83/47/63/338834763.db2.gz ZYDAEGGFCKYSCN-QWHCGFSZSA-N 1 2 321.852 4.367 20 0 DIADLO CCc1ncc(C[NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c32)o1 ZINC000453381100 338835083 /nfs/dbraw/zinc/83/50/83/338835083.db2.gz LBVYMWITRVFTLL-CYBMUJFWSA-N 1 2 311.212 4.321 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@@H](c2ccccc2)C2CCC2)c[nH+]1 ZINC000454433122 338863434 /nfs/dbraw/zinc/86/34/34/338863434.db2.gz CBVPCVOACODTEX-IBGZPJMESA-N 1 2 323.440 4.039 20 0 DIADLO CSc1cccc(NC(=O)NCc2c[nH+]c(C)cc2C)c1C ZINC000455053334 338879916 /nfs/dbraw/zinc/87/99/16/338879916.db2.gz ABOSXMMGRCGYEI-UHFFFAOYSA-N 1 2 315.442 4.050 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455472981 338895667 /nfs/dbraw/zinc/89/56/67/338895667.db2.gz BWUWAWCUPBHEIF-CVEARBPZSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)NC2CC(c3ccccc3)C2)c(C)[nH+]1 ZINC000455492281 338896548 /nfs/dbraw/zinc/89/65/48/338896548.db2.gz ZLJFLJAEMXBBBB-UHFFFAOYSA-N 1 2 309.413 4.075 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](C)[C@@H](C)c2ccccc2)c(C)[nH+]1 ZINC000455500067 338896730 /nfs/dbraw/zinc/89/67/30/338896730.db2.gz SRSOHEQROYJMOI-HUUCEWRRSA-N 1 2 311.429 4.321 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@@H](C)C2CCCCC2)c(C)[nH+]1 ZINC000455518645 338897569 /nfs/dbraw/zinc/89/75/69/338897569.db2.gz LQCOJOCFOYXJMU-HNNXBMFYSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](CC(F)(F)F)C(C)C)c(C)[nH+]1 ZINC000455532227 338898089 /nfs/dbraw/zinc/89/80/89/338898089.db2.gz SWQYJWQDNKVVBN-LBPRGKRZSA-N 1 2 317.355 4.105 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](c2ccccc2)C(F)F)c(C)[nH+]1 ZINC000455531963 338898093 /nfs/dbraw/zinc/89/80/93/338898093.db2.gz SRBXEIDPYVNIRB-OAHLLOKOSA-N 1 2 319.355 4.135 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)C1=CCC(C)(C)CC1 ZINC000456041215 338917621 /nfs/dbraw/zinc/91/76/21/338917621.db2.gz RWPYREDZKUYPGM-MRXNPFEDSA-N 1 2 315.461 4.093 20 0 DIADLO CC(C)(NC(=O)c1cccc(Oc2cc[nH+]cc2)c1)C1CCC1 ZINC000456139284 338920230 /nfs/dbraw/zinc/92/02/30/338920230.db2.gz CKPCPYFSTHACIM-UHFFFAOYSA-N 1 2 310.397 4.182 20 0 DIADLO CCC[C@H](CC1CCCC1)C(=O)N[C@@H](C)c1[nH+]ccn1CC ZINC000456367659 338927798 /nfs/dbraw/zinc/92/77/98/338927798.db2.gz WYOZAPOFIDBSJV-GOEBONIOSA-N 1 2 305.466 4.077 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)NC(=O)c1ccc(C(C)C)c(Cl)c1 ZINC000456370734 338927918 /nfs/dbraw/zinc/92/79/18/338927918.db2.gz YGPJBWDGDNPYAH-GFCCVEGCSA-N 1 2 319.836 4.171 20 0 DIADLO CC(C)c1ccc(C(=O)N[C@H]2C[C@@H](C)n3cc[nH+]c32)cc1Cl ZINC000456440965 338930155 /nfs/dbraw/zinc/93/01/55/338930155.db2.gz YUGJOHZJCNOYES-ABAIWWIYSA-N 1 2 317.820 4.096 20 0 DIADLO CCC(CC)(C(=O)NCc1c[nH+]c(C)cc1C)c1ccccc1 ZINC000456835192 338943062 /nfs/dbraw/zinc/94/30/62/338943062.db2.gz ILXRSCHWEHSUMN-UHFFFAOYSA-N 1 2 310.441 4.073 20 0 DIADLO C[C@@H](CC(F)(F)F)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000457568557 338969728 /nfs/dbraw/zinc/96/97/28/338969728.db2.gz PPCYQVIWDNZEGU-NSHDSACASA-N 1 2 324.302 4.401 20 0 DIADLO C[C@]1(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC=CCC1 ZINC000458314507 338995724 /nfs/dbraw/zinc/99/57/24/338995724.db2.gz OCMQPYUEUSXTRC-IBGZPJMESA-N 1 2 308.381 4.103 20 0 DIADLO Cc1ccc(N[C@H](C)c2ccc(F)c(Br)c2)c[nH+]1 ZINC000164608456 339009017 /nfs/dbraw/zinc/00/90/17/339009017.db2.gz VUWBBTLKEKJJCD-SNVBAGLBSA-N 1 2 309.182 4.465 20 0 DIADLO CCCC[C@H](C)N(CCCC)C(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000459057537 339012273 /nfs/dbraw/zinc/01/22/73/339012273.db2.gz LAMIBCODSVGAFT-JKSUJKDBSA-N 1 2 322.497 4.354 20 0 DIADLO CCCC[C@@H](C)N(CCCC)C(=O)N[C@H](C)c1[nH+]ccn1CC ZINC000459057535 339012296 /nfs/dbraw/zinc/01/22/96/339012296.db2.gz LAMIBCODSVGAFT-HZPDHXFCSA-N 1 2 322.497 4.354 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1cnc(C2CC2)nc1 ZINC000459307210 339020692 /nfs/dbraw/zinc/02/06/92/339020692.db2.gz NTRZXTUADNQAEF-LBPRGKRZSA-N 1 2 324.453 4.157 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cnc(C2CC2)nc1 ZINC000459307210 339020693 /nfs/dbraw/zinc/02/06/93/339020693.db2.gz NTRZXTUADNQAEF-LBPRGKRZSA-N 1 2 324.453 4.157 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2cnc(C3CC3)nc2)C2CC2)o1 ZINC000459313156 339021050 /nfs/dbraw/zinc/02/10/50/339021050.db2.gz PCCXFDAJZPWDPP-FZKQIMNGSA-N 1 2 323.440 4.235 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cnc(C3CC3)nc2)C2CC2)o1 ZINC000459313156 339021051 /nfs/dbraw/zinc/02/10/51/339021051.db2.gz PCCXFDAJZPWDPP-FZKQIMNGSA-N 1 2 323.440 4.235 20 0 DIADLO Cc1nc2scc(C3CC3)n2c1C[NH+]1Cc2ccccc2C1 ZINC000459330764 339022249 /nfs/dbraw/zinc/02/22/49/339022249.db2.gz CHCVOCLMKABYPZ-UHFFFAOYSA-N 1 2 309.438 4.097 20 0 DIADLO c1cc(NCc2cnc(C3CC3)nc2)cc([NH+]2CCCCCC2)c1 ZINC000459363972 339024618 /nfs/dbraw/zinc/02/46/18/339024618.db2.gz RYSNDGNNTYWQBZ-UHFFFAOYSA-N 1 2 322.456 4.347 20 0 DIADLO CCCCCOc1cc(C)ccc1C[NH2+]Cc1cc(C)on1 ZINC000459437482 339029137 /nfs/dbraw/zinc/02/91/37/339029137.db2.gz KXXBOIWWQGEMQT-UHFFFAOYSA-N 1 2 302.418 4.150 20 0 DIADLO Cc1cc(C[NH2+]Cc2ccc(C)cc2OCCC(C)C)no1 ZINC000459439157 339029200 /nfs/dbraw/zinc/02/92/00/339029200.db2.gz VSYDWEZYAGJLKG-UHFFFAOYSA-N 1 2 302.418 4.006 20 0 DIADLO Cc1cc(C[NH2+]Cc2ccc(C)cc2OCCCC(C)C)no1 ZINC000459449565 339029888 /nfs/dbraw/zinc/02/98/88/339029888.db2.gz SOYRDEKAYMMYEE-UHFFFAOYSA-N 1 2 316.445 4.396 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ccc(C2CC2)cc1)c1nc(C2CC2)no1 ZINC000459466486 339030809 /nfs/dbraw/zinc/03/08/09/339030809.db2.gz OJNMTCKLSLCPKT-KRWDZBQOSA-N 1 2 311.429 4.311 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2Cc3sccc3CC2(C)C)cs1 ZINC000459572417 339036492 /nfs/dbraw/zinc/03/64/92/339036492.db2.gz AKHFKAWBIWTYFL-NSHDSACASA-N 1 2 322.499 4.249 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2Cc3sccc3CC2(C)C)cs1 ZINC000459572417 339036493 /nfs/dbraw/zinc/03/64/93/339036493.db2.gz AKHFKAWBIWTYFL-NSHDSACASA-N 1 2 322.499 4.249 20 0 DIADLO CCc1noc([C@H](C)[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)n1 ZINC000459573529 339036736 /nfs/dbraw/zinc/03/67/36/339036736.db2.gz RCHOVEAFOLOEIJ-WMLDXEAASA-N 1 2 311.429 4.310 20 0 DIADLO CCc1noc([C@H](C)[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)n1 ZINC000459573529 339036737 /nfs/dbraw/zinc/03/67/37/339036737.db2.gz RCHOVEAFOLOEIJ-WMLDXEAASA-N 1 2 311.429 4.310 20 0 DIADLO CC(C)Cn1ncnc1C[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459577114 339037020 /nfs/dbraw/zinc/03/70/20/339037020.db2.gz LXQNWKWYXHWORA-LJQANCHMSA-N 1 2 324.472 4.051 20 0 DIADLO CC(C)Cn1ncnc1C[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459577114 339037021 /nfs/dbraw/zinc/03/70/21/339037021.db2.gz LXQNWKWYXHWORA-LJQANCHMSA-N 1 2 324.472 4.051 20 0 DIADLO CSCC[N@@H+]1CCCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000459597278 339037931 /nfs/dbraw/zinc/03/79/31/339037931.db2.gz UPPCAOZFKHGLMT-CQSZACIVSA-N 1 2 309.866 4.106 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(F)c1Cl)c1nc2c(s1)CCC2 ZINC000459628914 339039218 /nfs/dbraw/zinc/03/92/18/339039218.db2.gz FZBMRVKGZWTONJ-VIFPVBQESA-N 1 2 310.825 4.275 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)ccc1F)c1nc2c(s1)CCC2 ZINC000459627455 339039222 /nfs/dbraw/zinc/03/92/22/339039222.db2.gz BXGXZFJVRVWCAH-SECBINFHSA-N 1 2 310.825 4.275 20 0 DIADLO CC1(CC(F)(F)F)C[NH+](Cc2conc2Cc2ccccc2)C1 ZINC000459636281 339039538 /nfs/dbraw/zinc/03/95/38/339039538.db2.gz KIWDQUOOHGDACX-UHFFFAOYSA-N 1 2 324.346 4.040 20 0 DIADLO Cc1ccc(C[NH2+]Cc2csc(-c3ccsc3)n2)nc1C ZINC000459666086 339041559 /nfs/dbraw/zinc/04/15/59/339041559.db2.gz LGVDCFFMSJMIGB-UHFFFAOYSA-N 1 2 315.467 4.173 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+]Cc3ccc(C)c(C)n3)cs2)cc1 ZINC000459670287 339042047 /nfs/dbraw/zinc/04/20/47/339042047.db2.gz OKTZBTKPEVCJJH-UHFFFAOYSA-N 1 2 323.465 4.420 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000459683446 339042990 /nfs/dbraw/zinc/04/29/90/339042990.db2.gz BZSADPPBGCCHIM-STQMWFEESA-N 1 2 317.433 4.096 20 0 DIADLO Cc1cnc(C[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)n1C ZINC000459716928 339044094 /nfs/dbraw/zinc/04/40/94/339044094.db2.gz QKAWVFVOWCSLSP-LJQANCHMSA-N 1 2 309.457 4.236 20 0 DIADLO Cc1cnc(C[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)n1C ZINC000459716928 339044095 /nfs/dbraw/zinc/04/40/95/339044095.db2.gz QKAWVFVOWCSLSP-LJQANCHMSA-N 1 2 309.457 4.236 20 0 DIADLO Cc1c[nH+]c(CN2CC3(CCCCC3)[C@H]2c2ccccc2)n1C ZINC000459716928 339044096 /nfs/dbraw/zinc/04/40/96/339044096.db2.gz QKAWVFVOWCSLSP-LJQANCHMSA-N 1 2 309.457 4.236 20 0 DIADLO CCc1nnc(C[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)o1 ZINC000459736723 339045249 /nfs/dbraw/zinc/04/52/49/339045249.db2.gz HGIFRXNIWDJHSR-GOSISDBHSA-N 1 2 311.429 4.139 20 0 DIADLO CCc1nnc(C[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)o1 ZINC000459736723 339045250 /nfs/dbraw/zinc/04/52/50/339045250.db2.gz HGIFRXNIWDJHSR-GOSISDBHSA-N 1 2 311.429 4.139 20 0 DIADLO COc1cc(NCCCc2ccc(C)[nH+]c2)cc(OC)c1Cl ZINC000459745805 339045836 /nfs/dbraw/zinc/04/58/36/339045836.db2.gz HKDJCCUVLCECRR-UHFFFAOYSA-N 1 2 320.820 4.105 20 0 DIADLO CCc1ccc([C@@H](C)CC(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC000460339740 339055614 /nfs/dbraw/zinc/05/56/14/339055614.db2.gz QLYIWYVBJCKOIW-AWEZNQCLSA-N 1 2 307.397 4.029 20 0 DIADLO CC(C)[C@@H](CC(=O)Nc1cccc2[nH+]ccn21)c1ccccc1 ZINC000460341685 339055799 /nfs/dbraw/zinc/05/57/99/339055799.db2.gz OTCGCLJFFBFUJI-MRXNPFEDSA-N 1 2 307.397 4.103 20 0 DIADLO Oc1cccc2c1CCC[C@@H]2Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000462814276 339091229 /nfs/dbraw/zinc/09/12/29/339091229.db2.gz DKMLZFKMQQNOHU-SFHVURJKSA-N 1 2 323.440 4.267 20 0 DIADLO CC[C@H](Nc1cc(C)[nH+]c(-c2ccncc2)n1)c1ccc(C)cc1 ZINC000462917210 339098017 /nfs/dbraw/zinc/09/80/17/339098017.db2.gz PLLJGBQWEUSMEU-SFHVURJKSA-N 1 2 318.424 4.141 20 0 DIADLO CCc1cc(N2CCC[C@@](C)(CC)C2)nc(-c2ccncc2)[nH+]1 ZINC000462959730 339099079 /nfs/dbraw/zinc/09/90/79/339099079.db2.gz WIAVKKODQSGXKZ-LJQANCHMSA-N 1 2 310.445 4.118 20 0 DIADLO CCCC[C@@H](COC)Nc1ccc(-n2c[nH+]c(C)c2C)cc1 ZINC000463009766 339100268 /nfs/dbraw/zinc/10/02/68/339100268.db2.gz JTNXPHFKFVZBKY-KRWDZBQOSA-N 1 2 301.434 4.106 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@@H]3CS[C@H](C(C)C)C3)cc2)c1C ZINC000463032667 339101915 /nfs/dbraw/zinc/10/19/15/339101915.db2.gz ISJBSIXOKFRGTO-WMZOPIPTSA-N 1 2 315.486 4.431 20 0 DIADLO CCCC[C@H](CC)C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000463033912 339101994 /nfs/dbraw/zinc/10/19/94/339101994.db2.gz CUJZQWGZUKHOSH-HOTGVXAUSA-N 1 2 322.518 4.170 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@@H]3CCO[C@@H](C(C)C)C3)cc2)c1C ZINC000463035387 339102216 /nfs/dbraw/zinc/10/22/16/339102216.db2.gz HIRMYIVFAFJVCI-IEBWSBKVSA-N 1 2 313.445 4.105 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@@H](C)CC3CCOCC3)cc2)c1C ZINC000463041811 339102622 /nfs/dbraw/zinc/10/26/22/339102622.db2.gz HOCXFDWXYPAXAH-AWEZNQCLSA-N 1 2 313.445 4.106 20 0 DIADLO CCC[C@@H](C(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1)C(C)C ZINC000463044816 339102801 /nfs/dbraw/zinc/10/28/01/339102801.db2.gz SYAGIOSOMIWSBK-NVXWUHKLSA-N 1 2 322.518 4.026 20 0 DIADLO Fc1cc(Nc2[nH+]cnc3[nH]ccc32)ccc1OC1CCCC1 ZINC000463076913 339104743 /nfs/dbraw/zinc/10/47/43/339104743.db2.gz HSEZVMXRIPHVCS-UHFFFAOYSA-N 1 2 312.348 4.162 20 0 DIADLO CCCOc1cccc(CNc2[nH+]cccc2OC(F)F)c1 ZINC000463250567 339112187 /nfs/dbraw/zinc/11/21/87/339112187.db2.gz OHAPSDVOHKACGE-UHFFFAOYSA-N 1 2 308.328 4.084 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cc4cc(C)c(C)cc4o3)cc2[nH+]1 ZINC000463301272 339114156 /nfs/dbraw/zinc/11/41/56/339114156.db2.gz FCMOHRNVRLBMQP-UHFFFAOYSA-N 1 2 319.364 4.487 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H](c3ccccc3)C(C)C)cc2[nH+]1 ZINC000463308236 339114436 /nfs/dbraw/zinc/11/44/36/339114436.db2.gz PZRZLQJKYKQZDS-GOSISDBHSA-N 1 2 307.397 4.250 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCCC3(C2)CCCCCC3)no1 ZINC000464773831 339152514 /nfs/dbraw/zinc/15/25/14/339152514.db2.gz QDBOWTQBXTZJIM-UHFFFAOYSA-N 1 2 305.466 4.304 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCCC3(C2)CCCCCC3)no1 ZINC000464773831 339152515 /nfs/dbraw/zinc/15/25/15/339152515.db2.gz QDBOWTQBXTZJIM-UHFFFAOYSA-N 1 2 305.466 4.304 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2csc(Cc3ccccc3)n2)CCS1 ZINC000464788647 339154004 /nfs/dbraw/zinc/15/40/04/339154004.db2.gz LFLFKOHTXNRNSI-MRXNPFEDSA-N 1 2 318.511 4.061 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2csc(Cc3ccccc3)n2)CCS1 ZINC000464788647 339154005 /nfs/dbraw/zinc/15/40/05/339154005.db2.gz LFLFKOHTXNRNSI-MRXNPFEDSA-N 1 2 318.511 4.061 20 0 DIADLO CCCc1noc(C[N@@H+]2CC[C@H](C)C[C@H]2c2ccc(CC)o2)n1 ZINC000464837307 339156546 /nfs/dbraw/zinc/15/65/46/339156546.db2.gz MHOHHWALUJSRGG-ZFWWWQNUSA-N 1 2 317.433 4.151 20 0 DIADLO CCCc1noc(C[N@H+]2CC[C@H](C)C[C@H]2c2ccc(CC)o2)n1 ZINC000464837307 339156547 /nfs/dbraw/zinc/15/65/47/339156547.db2.gz MHOHHWALUJSRGG-ZFWWWQNUSA-N 1 2 317.433 4.151 20 0 DIADLO C[C@H]1CC[N@H+](Cc2noc(-c3ccccc3)n2)[C@@H](c2ccco2)C1 ZINC000464850421 339157723 /nfs/dbraw/zinc/15/77/23/339157723.db2.gz KCSPZICDXZUJTQ-GOEBONIOSA-N 1 2 323.396 4.303 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2noc(-c3ccccc3)n2)[C@@H](c2ccco2)C1 ZINC000464850421 339157724 /nfs/dbraw/zinc/15/77/24/339157724.db2.gz KCSPZICDXZUJTQ-GOEBONIOSA-N 1 2 323.396 4.303 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cc(F)cc(Cl)c1 ZINC000464922168 339161851 /nfs/dbraw/zinc/16/18/51/339161851.db2.gz VRHZFGNBXGZNTO-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO CC[C@H]1CCC[C@H]1NC(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000465071402 339167556 /nfs/dbraw/zinc/16/75/56/339167556.db2.gz NNSOCZBOOJCDES-MAUKXSAKSA-N 1 2 324.424 4.491 20 0 DIADLO CCC(C)(C)CC(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1 ZINC000465080963 339167818 /nfs/dbraw/zinc/16/78/18/339167818.db2.gz RKBCHPULICMDBI-UHFFFAOYSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+][C@H](C)c3cc(F)ccc3F)nc2c1 ZINC000465396285 339175240 /nfs/dbraw/zinc/17/52/40/339175240.db2.gz ADOLATDXQYOBCS-LLVKDONJSA-N 1 2 301.340 4.000 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@H](C)c3cc(F)ccc3F)[nH]c2c1 ZINC000465396285 339175241 /nfs/dbraw/zinc/17/52/41/339175241.db2.gz ADOLATDXQYOBCS-LLVKDONJSA-N 1 2 301.340 4.000 20 0 DIADLO CC[C@@]1(C)C[C@H]1C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000466444597 339205291 /nfs/dbraw/zinc/20/52/91/339205291.db2.gz AXXDWEPWLYIBSF-PXNSSMCTSA-N 1 2 323.440 4.261 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1cc(Cl)ccc1Cl)CO2 ZINC000466475022 339206546 /nfs/dbraw/zinc/20/65/46/339206546.db2.gz RTRNLTONZKDGEJ-CQSZACIVSA-N 1 2 312.171 4.356 20 0 DIADLO CCS[C@H](C)c1noc(C[NH+]2CC(C)(C)CC(C)(C)C2)n1 ZINC000466936524 339222379 /nfs/dbraw/zinc/22/23/79/339222379.db2.gz SREYZBOYIQOKDA-GFCCVEGCSA-N 1 2 311.495 4.142 20 0 DIADLO COc1ccc(C2CCN(c3cc(C)[nH+]c(C4CC4)n3)CC2)cc1 ZINC000467005884 339224383 /nfs/dbraw/zinc/22/43/83/339224383.db2.gz PSHRZWKBNPHMFP-UHFFFAOYSA-N 1 2 323.440 4.055 20 0 DIADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@@H](Nc2cccc(CCCO)c2)C1 ZINC000467350880 339233243 /nfs/dbraw/zinc/23/32/43/339233243.db2.gz VSABGADATCILAO-UYAOXDASSA-N 1 2 324.468 4.453 20 0 DIADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@@H](Nc2cccc3c2CCO3)C1 ZINC000467374895 339235135 /nfs/dbraw/zinc/23/51/35/339235135.db2.gz BYKDTZRILXICEH-HZPDHXFCSA-N 1 2 308.425 4.463 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000467469957 339240030 /nfs/dbraw/zinc/24/00/30/339240030.db2.gz ZYDKJYWWTWVKEZ-ZBFHGGJFSA-N 1 2 314.433 4.075 20 0 DIADLO CC(C)=CC[N@@H+](Cc1ccnn1C)Cc1ccc(Cl)cc1 ZINC000467552686 339242041 /nfs/dbraw/zinc/24/20/41/339242041.db2.gz GUEMIEWDMYWNSZ-UHFFFAOYSA-N 1 2 303.837 4.042 20 0 DIADLO CC(C)=CC[N@H+](Cc1ccnn1C)Cc1ccc(Cl)cc1 ZINC000467552686 339242042 /nfs/dbraw/zinc/24/20/42/339242042.db2.gz GUEMIEWDMYWNSZ-UHFFFAOYSA-N 1 2 303.837 4.042 20 0 DIADLO CC[C@H]1C[N@H+](Cc2ccc(F)c(Cl)c2Cl)CCCO1 ZINC000467559197 339242622 /nfs/dbraw/zinc/24/26/22/339242622.db2.gz ZHOUWXIFUXJABR-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2ccc(F)c(Cl)c2Cl)CCCO1 ZINC000467559197 339242623 /nfs/dbraw/zinc/24/26/23/339242623.db2.gz ZHOUWXIFUXJABR-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO Cn1cc[nH+]c1CNc1ccc(F)cc1-c1ccc(Cl)cc1 ZINC000467765751 339246194 /nfs/dbraw/zinc/24/61/94/339246194.db2.gz CIZIIFHJKVWCLN-UHFFFAOYSA-N 1 2 315.779 4.492 20 0 DIADLO CCCCOc1ccccc1C[N@@H+]1CCO[C@@H](c2ccco2)C1 ZINC000468395284 339261672 /nfs/dbraw/zinc/26/16/72/339261672.db2.gz YSCXNMPLTWGASG-LJQANCHMSA-N 1 2 315.413 4.032 20 0 DIADLO CCCCOc1ccccc1C[N@H+]1CCO[C@@H](c2ccco2)C1 ZINC000468395284 339261673 /nfs/dbraw/zinc/26/16/73/339261673.db2.gz YSCXNMPLTWGASG-LJQANCHMSA-N 1 2 315.413 4.032 20 0 DIADLO Cc1cc(N2CCC[C@H](CC(C)C)C2)nc(-c2ccncc2)[nH+]1 ZINC000468844471 339272501 /nfs/dbraw/zinc/27/25/01/339272501.db2.gz GLGSYVHGMSXQTP-MRXNPFEDSA-N 1 2 310.445 4.110 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+][C@H](C)c3csc(Cl)c3)nc2c1 ZINC000468924932 339274947 /nfs/dbraw/zinc/27/49/47/339274947.db2.gz MIRUJNIZACRRJM-SNVBAGLBSA-N 1 2 305.834 4.437 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@H](C)c3csc(Cl)c3)[nH]c2c1 ZINC000468924932 339274948 /nfs/dbraw/zinc/27/49/48/339274948.db2.gz MIRUJNIZACRRJM-SNVBAGLBSA-N 1 2 305.834 4.437 20 0 DIADLO CCOc1cc(Cl)ccc1NCc1cn2cccc(C)c2[nH+]1 ZINC000469356939 339286902 /nfs/dbraw/zinc/28/69/02/339286902.db2.gz ZKKJHKYTQLFBEJ-UHFFFAOYSA-N 1 2 315.804 4.307 20 0 DIADLO Cc1csc(C[NH+]2CCC(=Cc3ccc(F)c(F)c3)CC2)n1 ZINC000469445912 339289573 /nfs/dbraw/zinc/28/95/73/339289573.db2.gz IIMNJCDQYCDBLK-UHFFFAOYSA-N 1 2 320.408 4.409 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CC[C@@H](c3c(F)cccc3F)C2)o1 ZINC000469465301 339290456 /nfs/dbraw/zinc/29/04/56/339290456.db2.gz SWEWTYKFOLVVCP-GFCCVEGCSA-N 1 2 320.383 4.240 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)o1 ZINC000469465301 339290457 /nfs/dbraw/zinc/29/04/57/339290457.db2.gz SWEWTYKFOLVVCP-GFCCVEGCSA-N 1 2 320.383 4.240 20 0 DIADLO CCc1cccc(C[N@H+](C)Cc2nccn2Cc2ccccc2)c1 ZINC000469607205 339294303 /nfs/dbraw/zinc/29/43/03/339294303.db2.gz OLYYPOLHVPMTQY-UHFFFAOYSA-N 1 2 319.452 4.126 20 0 DIADLO CCc1cccc(C[N@@H+](C)Cc2nccn2Cc2ccccc2)c1 ZINC000469607205 339294304 /nfs/dbraw/zinc/29/43/04/339294304.db2.gz OLYYPOLHVPMTQY-UHFFFAOYSA-N 1 2 319.452 4.126 20 0 DIADLO COc1ccc(C[NH2+][C@@H](C)c2csc(C(C)C)n2)c(F)c1 ZINC000469787860 339300001 /nfs/dbraw/zinc/30/00/01/339300001.db2.gz WLJVUTPVBPAJRP-NSHDSACASA-N 1 2 308.422 4.265 20 0 DIADLO Cc1[nH+]c2ccccc2n1CC(=O)Nc1ccc(C2CCC2)cc1 ZINC000470512363 339321299 /nfs/dbraw/zinc/32/12/99/339321299.db2.gz LGDCAMBZQRXDGS-UHFFFAOYSA-N 1 2 319.408 4.251 20 0 DIADLO C[C@H]1C[N@H+](Cc2nc(C3CCCCC3)cs2)C[C@@H](C2CC2)O1 ZINC000470907595 339330790 /nfs/dbraw/zinc/33/07/90/339330790.db2.gz TYDUANDNRPHDFE-GUYCJALGSA-N 1 2 320.502 4.190 20 0 DIADLO C[C@H]1C[N@@H+](Cc2nc(C3CCCCC3)cs2)C[C@@H](C2CC2)O1 ZINC000470907595 339330791 /nfs/dbraw/zinc/33/07/91/339330791.db2.gz TYDUANDNRPHDFE-GUYCJALGSA-N 1 2 320.502 4.190 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ncc(Cl)cc1Cl ZINC000470940847 339331627 /nfs/dbraw/zinc/33/16/27/339331627.db2.gz QNSJJSNBPCMJJJ-CBAPKCEASA-N 1 2 313.150 4.161 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ncc(Cl)cc1Cl ZINC000470940847 339331628 /nfs/dbraw/zinc/33/16/28/339331628.db2.gz QNSJJSNBPCMJJJ-CBAPKCEASA-N 1 2 313.150 4.161 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)n1 ZINC000470937938 339331739 /nfs/dbraw/zinc/33/17/39/339331739.db2.gz QSHQTMPPBUDVIC-FZMZJTMJSA-N 1 2 303.372 4.017 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)n1 ZINC000470937938 339331740 /nfs/dbraw/zinc/33/17/40/339331740.db2.gz QSHQTMPPBUDVIC-FZMZJTMJSA-N 1 2 303.372 4.017 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000470954733 339332571 /nfs/dbraw/zinc/33/25/71/339332571.db2.gz BSSCNKOBXXPTHT-UWVGGRQHSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000470954733 339332572 /nfs/dbraw/zinc/33/25/72/339332572.db2.gz BSSCNKOBXXPTHT-UWVGGRQHSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000470954734 339332616 /nfs/dbraw/zinc/33/26/16/339332616.db2.gz BSSCNKOBXXPTHT-VHSXEESVSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000470954734 339332617 /nfs/dbraw/zinc/33/26/17/339332617.db2.gz BSSCNKOBXXPTHT-VHSXEESVSA-N 1 2 306.397 4.213 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000471038765 339335220 /nfs/dbraw/zinc/33/52/20/339335220.db2.gz RJAMIJVHRPFXTR-VBKZILBWSA-N 1 2 323.415 4.388 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000471038765 339335221 /nfs/dbraw/zinc/33/52/21/339335221.db2.gz RJAMIJVHRPFXTR-VBKZILBWSA-N 1 2 323.415 4.388 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000471043797 339335435 /nfs/dbraw/zinc/33/54/35/339335435.db2.gz HXYYLOGIKMPVBB-VLIAUNLRSA-N 1 2 323.415 4.388 20 0 DIADLO CCn1c2cccc(F)c2nc1C[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000471043797 339335436 /nfs/dbraw/zinc/33/54/36/339335436.db2.gz HXYYLOGIKMPVBB-VLIAUNLRSA-N 1 2 323.415 4.388 20 0 DIADLO CCC(CC)N(C(=O)c1ccc2[nH+]ccn2c1)c1cccc(C)c1 ZINC000471438181 339344889 /nfs/dbraw/zinc/34/48/89/339344889.db2.gz VZCOXVYZHJCUFA-UHFFFAOYSA-N 1 2 321.424 4.478 20 0 DIADLO Clc1cnc(C[NH2+]Cc2ccc(Cl)cc2Cl)s1 ZINC000471978422 339358585 /nfs/dbraw/zinc/35/85/85/339358585.db2.gz OGPNTPSDUUBAJU-UHFFFAOYSA-N 1 2 307.633 4.393 20 0 DIADLO CCN(Cc1c(C)[nH+]c2ccccn21)c1ccc2[nH]ccc2c1 ZINC000472182760 339365506 /nfs/dbraw/zinc/36/55/06/339365506.db2.gz OHRHOSJOUIMHGR-UHFFFAOYSA-N 1 2 304.397 4.151 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2noc(C(C)C)n2)CC[C@@H]1c1ccccc1 ZINC000472247740 339367676 /nfs/dbraw/zinc/36/76/76/339367676.db2.gz SRIOKZDLPZZKAM-WBVHZDCISA-N 1 2 313.445 4.209 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2noc(C(C)C)n2)CC[C@@H]1c1ccccc1 ZINC000472247740 339367677 /nfs/dbraw/zinc/36/76/77/339367677.db2.gz SRIOKZDLPZZKAM-WBVHZDCISA-N 1 2 313.445 4.209 20 0 DIADLO CCCCc1noc(C[N@@H+]2CC[C@@H](C)[C@H]2c2cccc(F)c2)n1 ZINC000472312442 339369586 /nfs/dbraw/zinc/36/95/86/339369586.db2.gz DTXQMAQINVGADI-ACJLOTCBSA-N 1 2 317.408 4.134 20 0 DIADLO CCCCc1noc(C[N@H+]2CC[C@@H](C)[C@H]2c2cccc(F)c2)n1 ZINC000472312442 339369587 /nfs/dbraw/zinc/36/95/87/339369587.db2.gz DTXQMAQINVGADI-ACJLOTCBSA-N 1 2 317.408 4.134 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cn3ccsc3n2)[C@H]1c1cccc(F)c1 ZINC000472353382 339370647 /nfs/dbraw/zinc/37/06/47/339370647.db2.gz RNGLSWDFNWDFJI-BLLLJJGKSA-N 1 2 315.417 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cn3ccsc3n2)[C@H]1c1cccc(F)c1 ZINC000472353382 339370648 /nfs/dbraw/zinc/37/06/48/339370648.db2.gz RNGLSWDFNWDFJI-BLLLJJGKSA-N 1 2 315.417 4.118 20 0 DIADLO Cc1ccccc1-c1nc(C[N@@H+]2CCC[C@H]2c2ccccc2)no1 ZINC000472771426 339377370 /nfs/dbraw/zinc/37/73/70/339377370.db2.gz NLSZWXYGOZDTPA-SFHVURJKSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccccc1-c1nc(C[N@H+]2CCC[C@H]2c2ccccc2)no1 ZINC000472771426 339377371 /nfs/dbraw/zinc/37/73/71/339377371.db2.gz NLSZWXYGOZDTPA-SFHVURJKSA-N 1 2 319.408 4.382 20 0 DIADLO Fc1ccc(SCC[N@@H+]2CCO[C@@H](c3cccs3)C2)cc1 ZINC000472970447 339379634 /nfs/dbraw/zinc/37/96/34/339379634.db2.gz LCMJSQKREAKGKB-OAHLLOKOSA-N 1 2 323.458 4.053 20 0 DIADLO Fc1ccc(SCC[N@H+]2CCO[C@@H](c3cccs3)C2)cc1 ZINC000472970447 339379635 /nfs/dbraw/zinc/37/96/35/339379635.db2.gz LCMJSQKREAKGKB-OAHLLOKOSA-N 1 2 323.458 4.053 20 0 DIADLO Cc1cccc(C2=CC[N@H+](Cc3ncc(Cl)s3)CC2)c1 ZINC000473120846 339381288 /nfs/dbraw/zinc/38/12/88/339381288.db2.gz HJAHMRIGLCEOHG-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO Cc1cccc(C2=CC[N@@H+](Cc3ncc(Cl)s3)CC2)c1 ZINC000473120846 339381289 /nfs/dbraw/zinc/38/12/89/339381289.db2.gz HJAHMRIGLCEOHG-UHFFFAOYSA-N 1 2 304.846 4.394 20 0 DIADLO Fc1ccccc1CC1CC[NH+](Cc2ncc(Cl)s2)CC1 ZINC000473133798 339381709 /nfs/dbraw/zinc/38/17/09/339381709.db2.gz UAEXLMWYPAYYRN-UHFFFAOYSA-N 1 2 324.852 4.390 20 0 DIADLO CCn1nc(C[N@H+](C)Cc2ccccc2Cl)c2ccccc21 ZINC000473137944 339382143 /nfs/dbraw/zinc/38/21/43/339382143.db2.gz BQZVZDVHNNXKJB-UHFFFAOYSA-N 1 2 313.832 4.342 20 0 DIADLO CCn1nc(C[N@@H+](C)Cc2ccccc2Cl)c2ccccc21 ZINC000473137944 339382144 /nfs/dbraw/zinc/38/21/44/339382144.db2.gz BQZVZDVHNNXKJB-UHFFFAOYSA-N 1 2 313.832 4.342 20 0 DIADLO Clc1cnc(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)s1 ZINC000473143410 339382546 /nfs/dbraw/zinc/38/25/46/339382546.db2.gz XTFMBZSQBYYERR-LLVKDONJSA-N 1 2 313.253 4.439 20 0 DIADLO Clc1cnc(C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)s1 ZINC000473143410 339382547 /nfs/dbraw/zinc/38/25/47/339382547.db2.gz XTFMBZSQBYYERR-LLVKDONJSA-N 1 2 313.253 4.439 20 0 DIADLO COc1ccc2c(c1)CCC[C@@H]2[N@H+](C)Cc1ncc(Cl)s1 ZINC000473148252 339382748 /nfs/dbraw/zinc/38/27/48/339382748.db2.gz ZIHRSUPFVVJWJH-AWEZNQCLSA-N 1 2 322.861 4.315 20 0 DIADLO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)Cc1ncc(Cl)s1 ZINC000473148252 339382749 /nfs/dbraw/zinc/38/27/49/339382749.db2.gz ZIHRSUPFVVJWJH-AWEZNQCLSA-N 1 2 322.861 4.315 20 0 DIADLO COc1ccc2c(c1)[nH+]ccc2OCCCCOC(C)(C)C ZINC000473680493 339390281 /nfs/dbraw/zinc/39/02/81/339390281.db2.gz VKHUDHLDVSESFA-UHFFFAOYSA-N 1 2 303.402 4.218 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1cc(F)c(F)cc1F ZINC000474007504 339396962 /nfs/dbraw/zinc/39/69/62/339396962.db2.gz IZKIGMLODBHZRQ-UHFFFAOYSA-N 1 2 321.298 4.149 20 0 DIADLO COc1ccc([C@@H](C)[C@@H](C)Nc2ccc[nH+]c2C)cc1OC ZINC000474885575 339429933 /nfs/dbraw/zinc/42/99/33/339429933.db2.gz FSJATGUIONMGMA-QWHCGFSZSA-N 1 2 300.402 4.011 20 0 DIADLO CC(C)[C@H]1C[C@H]1C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000475617084 339457218 /nfs/dbraw/zinc/45/72/18/339457218.db2.gz JHAGIRPMUHOQGG-IAGOWNOFSA-N 1 2 323.440 4.117 20 0 DIADLO CCCCN(C(=O)CCn1c(C)[nH+]c2ccccc21)[C@@H](C)CC ZINC000476537113 339478163 /nfs/dbraw/zinc/47/81/63/339478163.db2.gz QGTZBWROXKGOHK-HNNXBMFYSA-N 1 2 315.461 4.162 20 0 DIADLO CCC[C@](C)(CC)C(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000476688898 339480709 /nfs/dbraw/zinc/48/07/09/339480709.db2.gz ACYOYGVAUQXZOJ-QAPCUYQASA-N 1 2 322.518 4.170 20 0 DIADLO c1sc(Cc2cn3ccccc3[nH+]2)nc1[C@@H]1Cc2ccccc21 ZINC000477260819 339490694 /nfs/dbraw/zinc/49/06/94/339490694.db2.gz OYRHPSHLXIQDCC-MRXNPFEDSA-N 1 2 317.417 4.070 20 0 DIADLO CCc1cc(Br)ccc1NCc1[nH+]ccn1C(C)C ZINC000477521570 339496647 /nfs/dbraw/zinc/49/66/47/339496647.db2.gz QTKHADSCBJVXIU-UHFFFAOYSA-N 1 2 322.250 4.401 20 0 DIADLO CCc1ccc(C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)cc1 ZINC000478001608 339506905 /nfs/dbraw/zinc/50/69/05/339506905.db2.gz MQGXTICVCATRAA-UHFFFAOYSA-N 1 2 305.381 4.200 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@@H](C)c2cncs2)c2ccccn2)cc1 ZINC000479508274 339538588 /nfs/dbraw/zinc/53/85/88/339538588.db2.gz YWIBGHLBBMIJPY-KSSFIOAISA-N 1 2 309.438 4.287 20 0 DIADLO CCN(C)c1ccc(CNc2ccccc2OCC(C)C)c[nH+]1 ZINC000480253657 339565481 /nfs/dbraw/zinc/56/54/81/339565481.db2.gz MGLTVIIVUDUODZ-UHFFFAOYSA-N 1 2 313.445 4.185 20 0 DIADLO CCN(C)c1ccc(CNc2cccc(C(F)(F)F)c2)c[nH+]1 ZINC000480305079 339568132 /nfs/dbraw/zinc/56/81/32/339568132.db2.gz BYTKEZVURRKPRO-UHFFFAOYSA-N 1 2 309.335 4.169 20 0 DIADLO COc1cccc2c(N3CC[C@@H](C(F)(F)F)[C@H]3C)cc[nH+]c12 ZINC000480547697 339576855 /nfs/dbraw/zinc/57/68/55/339576855.db2.gz CUHBLDOAVGNREF-ZYHUDNBSSA-N 1 2 310.319 4.021 20 0 DIADLO CO[C@]1(C)CCCN(c2cc(C(C)(C)C)[nH+]c(C(C)C)n2)CC1 ZINC000480825105 339588339 /nfs/dbraw/zinc/58/83/39/339588339.db2.gz QCQNBXHXQOTHAN-LJQANCHMSA-N 1 2 319.493 4.293 20 0 DIADLO Cc1cc(NCC2(CCO)CCCC2)c2cccc(F)c2[nH+]1 ZINC000481979408 339618524 /nfs/dbraw/zinc/61/85/24/339618524.db2.gz IJAJZDHHMFQVDL-UHFFFAOYSA-N 1 2 302.393 4.037 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1ccc(Cl)cc1OC ZINC000482638141 339638530 /nfs/dbraw/zinc/63/85/30/339638530.db2.gz DGQWROIXTMAPQY-LLVKDONJSA-N 1 2 323.795 4.347 20 0 DIADLO Fc1ccc([C@H]2C[C@H](Nc3cccc[nH+]3)C2)cc1Br ZINC000485420782 339703153 /nfs/dbraw/zinc/70/31/53/339703153.db2.gz JKPIACQSXCVGBO-HAQNSBGRSA-N 1 2 321.193 4.341 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1c2ccccc2CC[C@H]1C ZINC000485450930 339703520 /nfs/dbraw/zinc/70/35/20/339703520.db2.gz KPCUJIGJXGTOAL-XIKOKIGWSA-N 1 2 309.413 4.144 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCCc1cccc2ccccc21 ZINC000485449290 339703533 /nfs/dbraw/zinc/70/35/33/339703533.db2.gz BVRQNRQKYJZPQU-UHFFFAOYSA-N 1 2 319.408 4.216 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NC[C@]1(C)CCCc2ccccc21 ZINC000485449987 339703559 /nfs/dbraw/zinc/70/35/59/339703559.db2.gz GMEBIQXQPWQYBT-FQEVSTJZSA-N 1 2 323.440 4.114 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](C)C(C)(C)c1ccccc1 ZINC000485455364 339703613 /nfs/dbraw/zinc/70/36/13/339703613.db2.gz YDDOUEPQNFOIMY-HNNXBMFYSA-N 1 2 311.429 4.186 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCc1ccc2ccccc2c1 ZINC000485502380 339704550 /nfs/dbraw/zinc/70/45/50/339704550.db2.gz UORNOMLKXVYBLF-UHFFFAOYSA-N 1 2 305.381 4.173 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NC1(c2ccc(Cl)cc2)CC1 ZINC000485603750 339707061 /nfs/dbraw/zinc/70/70/61/339707061.db2.gz WMLVVIFLKKGMAP-UHFFFAOYSA-N 1 2 315.804 4.163 20 0 DIADLO Fc1cc(Cl)cc(C[NH2+]Cc2csc(-c3ccco3)n2)c1 ZINC000485728369 339711627 /nfs/dbraw/zinc/71/16/27/339711627.db2.gz NCOWHSXOYCKSLT-UHFFFAOYSA-N 1 2 322.792 4.485 20 0 DIADLO Cc1ccc(Cc2nc(-c3ccc(C(C)(C)C)cc3)no2)c[nH+]1 ZINC000485883913 339715486 /nfs/dbraw/zinc/71/54/86/339715486.db2.gz VGLPRKLCFKPKDV-UHFFFAOYSA-N 1 2 307.397 4.328 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1cccc2cc[nH]c21)C(=O)OC(C)(C)C ZINC000486450105 339727560 /nfs/dbraw/zinc/72/75/60/339727560.db2.gz UFHFVXRIMFIXBE-MRXNPFEDSA-N 1 2 316.445 4.014 20 0 DIADLO CCc1cc(C)c(C(=O)Nc2ccc3[nH+]c(N(C)C)ccc3c2)o1 ZINC000487210817 339746459 /nfs/dbraw/zinc/74/64/59/339746459.db2.gz OJSHAMBNJTUWPU-UHFFFAOYSA-N 1 2 323.396 4.017 20 0 DIADLO Clc1cc(NC/C=C\c2ccncc2)ccc1-n1cc[nH+]c1 ZINC000487263803 339747827 /nfs/dbraw/zinc/74/78/27/339747827.db2.gz FGEOUZQGDAPCBN-UPHRSURJSA-N 1 2 310.788 4.046 20 0 DIADLO Clc1cc(NC/C=C/c2ccncc2)ccc1-n1cc[nH+]c1 ZINC000487263800 339747878 /nfs/dbraw/zinc/74/78/78/339747878.db2.gz FGEOUZQGDAPCBN-OWOJBTEDSA-N 1 2 310.788 4.046 20 0 DIADLO Cc1cc(NC(=O)[C@H]2[C@@H](C)C2(F)F)ccc1Oc1cc[nH+]cc1 ZINC000487716338 339761716 /nfs/dbraw/zinc/76/17/16/339761716.db2.gz PLVIUSZGKWHQEN-IAQYHMDHSA-N 1 2 318.323 4.022 20 0 DIADLO CC(C)(C)[C@H]1C[C@H](Nc2ccc(N3CCCC3)c[nH+]2)CS1 ZINC000488440016 339782365 /nfs/dbraw/zinc/78/23/65/339782365.db2.gz IQHLVCBWPYJOJB-DZGCQCFKSA-N 1 2 305.491 4.014 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)N1CCC[C@H]1c1[nH]cc[nH+]1 ZINC000488789551 339793685 /nfs/dbraw/zinc/79/36/85/339793685.db2.gz VAVYTYLLGKRXCC-INMHGKMJSA-N 1 2 323.440 4.063 20 0 DIADLO Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)Nc3ccc(C)[nH+]c3C)C2)cc1 ZINC000488946571 339797746 /nfs/dbraw/zinc/79/77/46/339797746.db2.gz WUGBZCDNBZCXEW-CRAIPNDOSA-N 1 2 323.440 4.417 20 0 DIADLO CCN(Cc1[nH+]ccn1CC(F)(F)F)c1cccc(Cl)c1 ZINC000489576216 339813183 /nfs/dbraw/zinc/81/31/83/339813183.db2.gz CSKXKTCNKJZDJN-UHFFFAOYSA-N 1 2 317.742 4.125 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccc(F)cn1 ZINC000491060108 339847261 /nfs/dbraw/zinc/84/72/61/339847261.db2.gz MQQIXOOFIOYQIY-LBPRGKRZSA-N 1 2 307.438 4.216 20 0 DIADLO CCn1cc[nH+]c1/C=C\C(=O)Nc1ccccc1-c1cccs1 ZINC000492248668 339895342 /nfs/dbraw/zinc/89/53/42/339895342.db2.gz DTMMMVRDDQTTKX-KTKRTIGZSA-N 1 2 323.421 4.283 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+][C@@H](C)c1c(F)cccc1F ZINC000495456010 339985124 /nfs/dbraw/zinc/98/51/24/339985124.db2.gz VOKUZLYSPUVOTC-JTQLQIEISA-N 1 2 311.759 4.478 20 0 DIADLO FC(F)Oc1cccc(CSc2[nH+]cc3ccccn32)c1 ZINC000496410666 340004851 /nfs/dbraw/zinc/00/48/51/340004851.db2.gz IVSRPPYFRKJCIC-UHFFFAOYSA-N 1 2 306.337 4.228 20 0 DIADLO CC[C@H](C(=O)NCCC[N@H+](CC)c1ccccc1)c1ccccc1 ZINC000498698880 340021864 /nfs/dbraw/zinc/02/18/64/340021864.db2.gz DJCUQLYHIDGOOD-FQEVSTJZSA-N 1 2 324.468 4.213 20 0 DIADLO CC[C@H](C(=O)NCCC[N@@H+](CC)c1ccccc1)c1ccccc1 ZINC000498698880 340021865 /nfs/dbraw/zinc/02/18/65/340021865.db2.gz DJCUQLYHIDGOOD-FQEVSTJZSA-N 1 2 324.468 4.213 20 0 DIADLO Cc1ccc([C@H](C)N(C)c2cc(C)[nH+]c(-c3ccncc3)n2)cc1 ZINC000498837488 340024227 /nfs/dbraw/zinc/02/42/27/340024227.db2.gz LMVLZOMGZGLABY-INIZCTEOSA-N 1 2 318.424 4.353 20 0 DIADLO C[C@@H]1CC[C@@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)[C@H](C)C1 ZINC000499150931 340031295 /nfs/dbraw/zinc/03/12/95/340031295.db2.gz ZWZNKOVRVYEVDZ-SPYBWZPUSA-N 1 2 324.424 4.428 20 0 DIADLO C[C@@H]1CC[C@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)[C@H](C)C1 ZINC000499150928 340031301 /nfs/dbraw/zinc/03/13/01/340031301.db2.gz ZWZNKOVRVYEVDZ-CLCXKQKWSA-N 1 2 324.424 4.428 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@@H+]1CCOC2(CCC2)C1 ZINC000499240019 340033079 /nfs/dbraw/zinc/03/30/79/340033079.db2.gz AYUGVWITOWBVLU-NSHDSACASA-N 1 2 300.229 4.309 20 0 DIADLO C[C@@H](c1cc(Cl)ccc1Cl)[N@H+]1CCOC2(CCC2)C1 ZINC000499240019 340033080 /nfs/dbraw/zinc/03/30/80/340033080.db2.gz AYUGVWITOWBVLU-NSHDSACASA-N 1 2 300.229 4.309 20 0 DIADLO CC[C@@H](c1ccc(Br)cc1)[N@@H+]1CCOC2(CCC2)C1 ZINC000499256041 340033435 /nfs/dbraw/zinc/03/34/35/340033435.db2.gz ZMASVZSZEZRVAW-HNNXBMFYSA-N 1 2 324.262 4.155 20 0 DIADLO CC[C@@H](c1ccc(Br)cc1)[N@H+]1CCOC2(CCC2)C1 ZINC000499256041 340033436 /nfs/dbraw/zinc/03/34/36/340033436.db2.gz ZMASVZSZEZRVAW-HNNXBMFYSA-N 1 2 324.262 4.155 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3ncccc3CC)cc2[nH+]1 ZINC000499631882 340041741 /nfs/dbraw/zinc/04/17/41/340041741.db2.gz AIWMVXQKVJFPFV-UHFFFAOYSA-N 1 2 322.412 4.115 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)ccc1O ZINC000499766229 340044530 /nfs/dbraw/zinc/04/45/30/340044530.db2.gz JNLQTBAUUMTJAR-UHFFFAOYSA-N 1 2 320.348 4.140 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cc(C)c(C)cc2OC(F)F)o1 ZINC000500363116 340055692 /nfs/dbraw/zinc/05/56/92/340055692.db2.gz QJVXKEYJIGJKPO-GFCCVEGCSA-N 1 2 310.344 4.052 20 0 DIADLO C/C(=C\c1ccccc1)C[NH2+][C@@H](C)c1noc(-c2ccccc2)n1 ZINC000500375267 340055934 /nfs/dbraw/zinc/05/59/34/340055934.db2.gz IDPCSGTZBBRAER-MDJJKAFGSA-N 1 2 319.408 4.491 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1Cl ZINC000500398567 340056757 /nfs/dbraw/zinc/05/67/57/340056757.db2.gz RNGVKVYLJJONKQ-OAHLLOKOSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@H+]1Cc1cccc(Cl)c1Cl ZINC000500398567 340056758 /nfs/dbraw/zinc/05/67/58/340056758.db2.gz RNGVKVYLJJONKQ-OAHLLOKOSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@@H+]1Cc1cccc(C(F)(F)F)c1 ZINC000500415374 340057443 /nfs/dbraw/zinc/05/74/43/340057443.db2.gz KJEBLWSQIAGBPK-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@H+]1Cc1cccc(C(F)(F)F)c1 ZINC000500415374 340057444 /nfs/dbraw/zinc/05/74/44/340057444.db2.gz KJEBLWSQIAGBPK-INIZCTEOSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)ccc1Cl ZINC000500441321 340058755 /nfs/dbraw/zinc/05/87/55/340058755.db2.gz PTNKXBWFDVTNKM-INIZCTEOSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@@H]1CCCC[N@H+]1Cc1cc(Cl)ccc1Cl ZINC000500441321 340058756 /nfs/dbraw/zinc/05/87/56/340058756.db2.gz PTNKXBWFDVTNKM-INIZCTEOSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@@H+]1Cc1cc(Cl)ccc1Cl ZINC000500441323 340058847 /nfs/dbraw/zinc/05/88/47/340058847.db2.gz PTNKXBWFDVTNKM-MRXNPFEDSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1nccc1[C@H]1CCCC[N@H+]1Cc1cc(Cl)ccc1Cl ZINC000500441323 340058848 /nfs/dbraw/zinc/05/88/48/340058848.db2.gz PTNKXBWFDVTNKM-MRXNPFEDSA-N 1 2 324.255 4.454 20 0 DIADLO CCOc1cc(C[NH2+]C2(C(F)F)CC2)ccc1OCC(C)C ZINC000500518296 340061266 /nfs/dbraw/zinc/06/12/66/340061266.db2.gz XVUKKXPIKFABEH-UHFFFAOYSA-N 1 2 313.388 4.007 20 0 DIADLO FC(F)C1([NH2+]Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000500573053 340062639 /nfs/dbraw/zinc/06/26/39/340062639.db2.gz SEWPMZIHNDWGAY-UHFFFAOYSA-N 1 2 303.352 4.153 20 0 DIADLO C[N@H+](Cc1coc(-c2ccc(F)cc2)n1)Cc1ccc(F)cc1 ZINC000501351845 340078980 /nfs/dbraw/zinc/07/89/80/340078980.db2.gz PLPNBGYTPZIRQB-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1coc(-c2ccc(F)cc2)n1)Cc1ccc(F)cc1 ZINC000501351845 340078981 /nfs/dbraw/zinc/07/89/81/340078981.db2.gz PLPNBGYTPZIRQB-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+]1CC[C@](C)(F)C1 ZINC000501415852 340080440 /nfs/dbraw/zinc/08/04/40/340080440.db2.gz FYRZUGZPLQSYAJ-ZBEGNZNMSA-N 1 2 308.784 4.490 20 0 DIADLO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1CC[C@](C)(F)C1 ZINC000501415852 340080441 /nfs/dbraw/zinc/08/04/41/340080441.db2.gz FYRZUGZPLQSYAJ-ZBEGNZNMSA-N 1 2 308.784 4.490 20 0 DIADLO CCOc1ccc(-c2nc(C[N@@H+]3CC[C@@](C)(F)C3)cs2)cc1 ZINC000501428729 340080859 /nfs/dbraw/zinc/08/08/59/340080859.db2.gz UKRSNHQTUIHKDD-QGZVFWFLSA-N 1 2 320.433 4.143 20 0 DIADLO CCOc1ccc(-c2nc(C[N@H+]3CC[C@@](C)(F)C3)cs2)cc1 ZINC000501428729 340080860 /nfs/dbraw/zinc/08/08/60/340080860.db2.gz UKRSNHQTUIHKDD-QGZVFWFLSA-N 1 2 320.433 4.143 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+]Cc1nc(CCC(C)C)no1 ZINC000501519915 340082527 /nfs/dbraw/zinc/08/25/27/340082527.db2.gz VPJBXIHGIVGLBX-CYBMUJFWSA-N 1 2 319.474 4.231 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)c1nc2c(s1)CCC2 ZINC000502010814 340092870 /nfs/dbraw/zinc/09/28/70/340092870.db2.gz ACYAXVQPTNDQHI-NXEZZACHSA-N 1 2 308.397 4.322 20 0 DIADLO COCC[C@@H]1CCC[C@@H]1Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000502463961 340104745 /nfs/dbraw/zinc/10/47/45/340104745.db2.gz QZRUWSOSKFBKLN-BBRMVZONSA-N 1 2 319.836 4.143 20 0 DIADLO Cc1ccccc1CC(=O)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1 ZINC000502468314 340104948 /nfs/dbraw/zinc/10/49/48/340104948.db2.gz ZXBQFGXKSUZSQC-UHFFFAOYSA-N 1 2 319.408 4.320 20 0 DIADLO CC[C@H]1C[C@@]1([NH2+]Cc1nc(C(C)(C)C)no1)c1cccc(C)c1 ZINC000502544292 340107356 /nfs/dbraw/zinc/10/73/56/340107356.db2.gz SNHAUPRYVKPDTF-LIRRHRJNSA-N 1 2 313.445 4.091 20 0 DIADLO CC[C@@H]1C[C@@]1([NH2+]Cc1nc(-c2ccco2)no1)c1cccc(C)c1 ZINC000502590846 340108664 /nfs/dbraw/zinc/10/86/64/340108664.db2.gz HVSKHBSDVQQSKU-KUHUBIRLSA-N 1 2 323.396 4.053 20 0 DIADLO CC(C)(C)CC[N@@H+]1CCOC[C@@H]1c1nc2ccccc2s1 ZINC000502846490 340114480 /nfs/dbraw/zinc/11/44/80/340114480.db2.gz QLFCYCBKALQGRE-CQSZACIVSA-N 1 2 304.459 4.106 20 0 DIADLO CC(C)(C)CC[N@H+]1CCOC[C@@H]1c1nc2ccccc2s1 ZINC000502846490 340114481 /nfs/dbraw/zinc/11/44/81/340114481.db2.gz QLFCYCBKALQGRE-CQSZACIVSA-N 1 2 304.459 4.106 20 0 DIADLO Cc1cc(F)cc([C@]2(F)CC[N@H+](Cc3ccncc3Cl)C2)c1 ZINC000502891013 340115831 /nfs/dbraw/zinc/11/58/31/340115831.db2.gz DHYPKHONBJERSZ-KRWDZBQOSA-N 1 2 322.786 4.253 20 0 DIADLO Cc1cc(F)cc([C@]2(F)CC[N@@H+](Cc3ccncc3Cl)C2)c1 ZINC000502891013 340115832 /nfs/dbraw/zinc/11/58/32/340115832.db2.gz DHYPKHONBJERSZ-KRWDZBQOSA-N 1 2 322.786 4.253 20 0 DIADLO Cc1cc(F)cc2c1C[N@H+]([C@@H](C)c1nc3ccccc3o1)CC2 ZINC000502939318 340117035 /nfs/dbraw/zinc/11/70/35/340117035.db2.gz LPAFAOWKYFCKIS-ZDUSSCGKSA-N 1 2 310.372 4.395 20 0 DIADLO Cc1cc(F)cc2c1C[N@@H+]([C@@H](C)c1nc3ccccc3o1)CC2 ZINC000502939318 340117036 /nfs/dbraw/zinc/11/70/36/340117036.db2.gz LPAFAOWKYFCKIS-ZDUSSCGKSA-N 1 2 310.372 4.395 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2nc3ccccc3o2)C1 ZINC000502945498 340117320 /nfs/dbraw/zinc/11/73/20/340117320.db2.gz YHVRWRRWYGKITE-LJQANCHMSA-N 1 2 310.372 4.207 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2nc3ccccc3o2)C1 ZINC000502945498 340117321 /nfs/dbraw/zinc/11/73/21/340117321.db2.gz YHVRWRRWYGKITE-LJQANCHMSA-N 1 2 310.372 4.207 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2nc3ccccc3o2)C1 ZINC000502945497 340117341 /nfs/dbraw/zinc/11/73/41/340117341.db2.gz YHVRWRRWYGKITE-IBGZPJMESA-N 1 2 310.372 4.207 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2nc3ccccc3o2)C1 ZINC000502945497 340117342 /nfs/dbraw/zinc/11/73/42/340117342.db2.gz YHVRWRRWYGKITE-IBGZPJMESA-N 1 2 310.372 4.207 20 0 DIADLO Cc1cc(F)cc([C@@]2(F)CC[N@H+](C/C=C\c3ccncc3)C2)c1 ZINC000503030264 340119170 /nfs/dbraw/zinc/11/91/70/340119170.db2.gz GMKBPGWGWJSEEZ-FFPCURRISA-N 1 2 314.379 4.113 20 0 DIADLO Cc1cc(F)cc([C@@]2(F)CC[N@@H+](C/C=C\c3ccncc3)C2)c1 ZINC000503030264 340119171 /nfs/dbraw/zinc/11/91/71/340119171.db2.gz GMKBPGWGWJSEEZ-FFPCURRISA-N 1 2 314.379 4.113 20 0 DIADLO FC(F)[C@@H]1CCCC[N@@H+]1Cc1cccc(-c2cccnc2)c1 ZINC000503082522 340120645 /nfs/dbraw/zinc/12/06/45/340120645.db2.gz GHOYJXAILRAQJQ-KRWDZBQOSA-N 1 2 302.368 4.368 20 0 DIADLO FC(F)[C@@H]1CCCC[N@H+]1Cc1cccc(-c2cccnc2)c1 ZINC000503082522 340120646 /nfs/dbraw/zinc/12/06/46/340120646.db2.gz GHOYJXAILRAQJQ-KRWDZBQOSA-N 1 2 302.368 4.368 20 0 DIADLO CCCC[C@@H](C)C(=O)Nc1nc(C[N@@H+]2CCC[C@@H](C)C2)cs1 ZINC000503130630 340121634 /nfs/dbraw/zinc/12/16/34/340121634.db2.gz LAYONKMDGXOZHQ-ZIAGYGMSSA-N 1 2 323.506 4.140 20 0 DIADLO CCCC[C@@H](C)C(=O)Nc1nc(C[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000503130630 340121635 /nfs/dbraw/zinc/12/16/35/340121635.db2.gz LAYONKMDGXOZHQ-ZIAGYGMSSA-N 1 2 323.506 4.140 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1c(F)cccc1F ZINC000503170732 340122512 /nfs/dbraw/zinc/12/25/12/340122512.db2.gz QCLIWKRMAXQAMA-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3cc(-c4ccccc4)on3)CC2)cc1 ZINC000503178874 340122615 /nfs/dbraw/zinc/12/26/15/340122615.db2.gz BUSDSUBYVPKMLG-UHFFFAOYSA-N 1 2 308.356 4.260 20 0 DIADLO C[C@@H]1C[C@@]1([NH2+]Cc1ncc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000503395989 340127235 /nfs/dbraw/zinc/12/72/35/340127235.db2.gz WONDNJHADXTTTI-DIFFPNOSSA-N 1 2 302.805 4.230 20 0 DIADLO C[C@H]1C[C@]1([NH2+]Cc1ncc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000503395987 340127249 /nfs/dbraw/zinc/12/72/49/340127249.db2.gz WONDNJHADXTTTI-APPDUMDISA-N 1 2 302.805 4.230 20 0 DIADLO CCCOc1cccc2c(N[C@@H](C)[C@@H]3CCCOC3)cc[nH+]c12 ZINC000503577038 340131368 /nfs/dbraw/zinc/13/13/68/340131368.db2.gz UHYMJZFFOSKWQI-LSDHHAIUSA-N 1 2 314.429 4.251 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)no1 ZINC000503887280 340135772 /nfs/dbraw/zinc/13/57/72/340135772.db2.gz QTEBSAXUXZUSBW-MNOVXSKESA-N 1 2 314.307 4.293 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)no1 ZINC000503887281 340135806 /nfs/dbraw/zinc/13/58/06/340135806.db2.gz QTEBSAXUXZUSBW-QWRGUYRKSA-N 1 2 314.307 4.293 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)no1 ZINC000503887282 340135818 /nfs/dbraw/zinc/13/58/18/340135818.db2.gz QTEBSAXUXZUSBW-WDEREUQCSA-N 1 2 314.307 4.293 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]C2(C(F)F)CC2)c2cccc(Br)c21 ZINC000503950063 340138386 /nfs/dbraw/zinc/13/83/86/340138386.db2.gz SMRVRTRZFHYBTK-GZMMTYOYSA-N 1 2 316.189 4.385 20 0 DIADLO C[C@@H]1CC(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)C[C@@H](C)C1 ZINC000504072493 340140386 /nfs/dbraw/zinc/14/03/86/340140386.db2.gz FGKIVASJKJGCSD-KBPBESRZSA-N 1 2 311.429 4.098 20 0 DIADLO CC[C@@H](CC(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1 ZINC000504347406 340145477 /nfs/dbraw/zinc/14/54/77/340145477.db2.gz MCPRQYSFMUCXMM-INIZCTEOSA-N 1 2 319.408 4.395 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1c(F)cccc1F ZINC000504376309 340146392 /nfs/dbraw/zinc/14/63/92/340146392.db2.gz IVTNNOSCKXVFKB-GFCCVEGCSA-N 1 2 320.383 4.388 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)c1cc(F)cc(Cl)c1 ZINC000504701105 340151461 /nfs/dbraw/zinc/15/14/61/340151461.db2.gz RIJGJPYIIBWUQZ-UHFFFAOYSA-N 1 2 322.767 4.304 20 0 DIADLO CC[C@@H](CC(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccccc1 ZINC000504930665 340156693 /nfs/dbraw/zinc/15/66/93/340156693.db2.gz RRHRWMGINVAQNF-INIZCTEOSA-N 1 2 319.408 4.395 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1csc(-c2ccc(C)cc2)n1 ZINC000505596728 340172258 /nfs/dbraw/zinc/17/22/58/340172258.db2.gz NFQBNQRIXZVDGX-WMLDXEAASA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1csc(-c2ccc(C)cc2)n1 ZINC000505596728 340172259 /nfs/dbraw/zinc/17/22/59/340172259.db2.gz NFQBNQRIXZVDGX-WMLDXEAASA-N 1 2 316.470 4.118 20 0 DIADLO C[C@@H]1CCc2nc(C[N@H+](C)Cc3ccccc3F)sc2C1 ZINC000505606750 340172807 /nfs/dbraw/zinc/17/28/07/340172807.db2.gz IPMGOCPXVWZRNP-GFCCVEGCSA-N 1 2 304.434 4.039 20 0 DIADLO C[C@@H]1CCc2nc(C[N@@H+](C)Cc3ccccc3F)sc2C1 ZINC000505606750 340172808 /nfs/dbraw/zinc/17/28/08/340172808.db2.gz IPMGOCPXVWZRNP-GFCCVEGCSA-N 1 2 304.434 4.039 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cnc(-c2ccsc2)s1 ZINC000505689895 340175006 /nfs/dbraw/zinc/17/50/06/340175006.db2.gz KTFLCXHVIOSBJW-LBPRGKRZSA-N 1 2 315.467 4.250 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cnc(-c2ccsc2)s1 ZINC000505689895 340175007 /nfs/dbraw/zinc/17/50/07/340175007.db2.gz KTFLCXHVIOSBJW-LBPRGKRZSA-N 1 2 315.467 4.250 20 0 DIADLO CC(C)(C)c1noc(C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)n1 ZINC000505873798 340180376 /nfs/dbraw/zinc/18/03/76/340180376.db2.gz BBTDIIZEPLXYDP-PCUGXKRQSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1noc(C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)n1 ZINC000505873798 340180377 /nfs/dbraw/zinc/18/03/77/340180377.db2.gz BBTDIIZEPLXYDP-PCUGXKRQSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)no1 ZINC000505880908 340180562 /nfs/dbraw/zinc/18/05/62/340180562.db2.gz ZZDCXKSDGBVJIK-LPQFERQCSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)no1 ZINC000505880908 340180563 /nfs/dbraw/zinc/18/05/63/340180563.db2.gz ZZDCXKSDGBVJIK-LPQFERQCSA-N 1 2 311.429 4.045 20 0 DIADLO CC[N@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1cccc(F)c1 ZINC000506055008 340184455 /nfs/dbraw/zinc/18/44/55/340184455.db2.gz GSCPMFFFOFKLEM-UHFFFAOYSA-N 1 2 309.388 4.238 20 0 DIADLO CC[N@@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1cccc(F)c1 ZINC000506055008 340184456 /nfs/dbraw/zinc/18/44/56/340184456.db2.gz GSCPMFFFOFKLEM-UHFFFAOYSA-N 1 2 309.388 4.238 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1nc2ccccc2n1C ZINC000506085430 340185269 /nfs/dbraw/zinc/18/52/69/340185269.db2.gz KXYBQPUZKHMWKL-UHFFFAOYSA-N 1 2 319.861 4.310 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1nc2ccccc2n1C ZINC000506085430 340185270 /nfs/dbraw/zinc/18/52/70/340185270.db2.gz KXYBQPUZKHMWKL-UHFFFAOYSA-N 1 2 319.861 4.310 20 0 DIADLO C[N@H+](CCOc1ccc(F)cc1)Cc1csc(C(C)(C)C)n1 ZINC000506163685 340187311 /nfs/dbraw/zinc/18/73/11/340187311.db2.gz GBPQCSGYTCREMO-UHFFFAOYSA-N 1 2 322.449 4.091 20 0 DIADLO C[N@@H+](CCOc1ccc(F)cc1)Cc1csc(C(C)(C)C)n1 ZINC000506163685 340187312 /nfs/dbraw/zinc/18/73/12/340187312.db2.gz GBPQCSGYTCREMO-UHFFFAOYSA-N 1 2 322.449 4.091 20 0 DIADLO COC(=O)c1cc(C)c(NCc2ccc(C)[nH+]c2C)c(Cl)c1 ZINC000506232315 340189412 /nfs/dbraw/zinc/18/94/12/340189412.db2.gz JNBSAFXOERNODM-UHFFFAOYSA-N 1 2 318.804 4.059 20 0 DIADLO CCc1cc(NCc2[nH+]ccn2Cc2ccccc2)ccc1F ZINC000506310148 340191922 /nfs/dbraw/zinc/19/19/22/340191922.db2.gz PZAXUWKPIDZHJZ-UHFFFAOYSA-N 1 2 309.388 4.245 20 0 DIADLO FC(F)(F)c1cccc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c1 ZINC000506357581 340193272 /nfs/dbraw/zinc/19/32/72/340193272.db2.gz STAGGFSZCPABQB-QGZVFWFLSA-N 1 2 321.342 4.279 20 0 DIADLO FC(F)(F)c1cccc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)c1 ZINC000506357581 340193273 /nfs/dbraw/zinc/19/32/73/340193273.db2.gz STAGGFSZCPABQB-QGZVFWFLSA-N 1 2 321.342 4.279 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2nc3ccccc3[nH]2)C2CC2)o1 ZINC000506553722 340196564 /nfs/dbraw/zinc/19/65/64/340196564.db2.gz CSEFRCVBOYXXKF-XJKSGUPXSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2nc3ccccc3[nH]2)C2CC2)o1 ZINC000506553722 340196565 /nfs/dbraw/zinc/19/65/65/340196565.db2.gz CSEFRCVBOYXXKF-XJKSGUPXSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cc(-c2ccccc2)n[nH]1 ZINC000506583462 340197071 /nfs/dbraw/zinc/19/70/71/340197071.db2.gz CNEUSYHJPQNQOV-AWEZNQCLSA-N 1 2 309.388 4.409 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cc(-c2ccccc2)n[nH]1 ZINC000506583462 340197072 /nfs/dbraw/zinc/19/70/72/340197072.db2.gz CNEUSYHJPQNQOV-AWEZNQCLSA-N 1 2 309.388 4.409 20 0 DIADLO C[N@H+](Cc1cnc2ccc(Cl)cn12)Cc1ccccc1Cl ZINC000506804473 340202086 /nfs/dbraw/zinc/20/20/86/340202086.db2.gz GTMUMUYVRPESMV-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1cnc2ccc(Cl)cn12)Cc1ccccc1Cl ZINC000506804473 340202087 /nfs/dbraw/zinc/20/20/87/340202087.db2.gz GTMUMUYVRPESMV-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[C@H]1CCc2nc(C[N@@H+]3CCC[C@H](C(F)(F)F)C3)sc2C1 ZINC000506803354 340202178 /nfs/dbraw/zinc/20/21/78/340202178.db2.gz GJSISBIGQZBBGZ-QWRGUYRKSA-N 1 2 318.408 4.042 20 0 DIADLO C[C@H]1CCc2nc(C[N@H+]3CCC[C@H](C(F)(F)F)C3)sc2C1 ZINC000506803354 340202179 /nfs/dbraw/zinc/20/21/79/340202179.db2.gz GJSISBIGQZBBGZ-QWRGUYRKSA-N 1 2 318.408 4.042 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](CC(=O)c1cccn1C)C1CC1 ZINC000506955720 340204363 /nfs/dbraw/zinc/20/43/63/340204363.db2.gz UPPHCYRHFNZJKI-ZDUSSCGKSA-N 1 2 316.832 4.087 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](CC(=O)c1cccn1C)C1CC1 ZINC000506955720 340204364 /nfs/dbraw/zinc/20/43/64/340204364.db2.gz UPPHCYRHFNZJKI-ZDUSSCGKSA-N 1 2 316.832 4.087 20 0 DIADLO COc1ccc(OC(C)C)c(NCCCc2c[nH+]ccc2C)c1 ZINC000516603222 340205224 /nfs/dbraw/zinc/20/52/24/340205224.db2.gz RTRWHNXYXIJHHH-UHFFFAOYSA-N 1 2 314.429 4.231 20 0 DIADLO Oc1ccc(F)c(C[N@H+]2CC=C(c3ccc(F)cc3)CC2)c1F ZINC000507047432 340206102 /nfs/dbraw/zinc/20/61/02/340206102.db2.gz HKSOQFDTNMPFMB-UHFFFAOYSA-N 1 2 319.326 4.099 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c1F ZINC000507079118 340206714 /nfs/dbraw/zinc/20/67/14/340206714.db2.gz VAMKWKWZKMXBSE-OAHLLOKOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c1F ZINC000507079118 340206715 /nfs/dbraw/zinc/20/67/15/340206715.db2.gz VAMKWKWZKMXBSE-OAHLLOKOSA-N 1 2 307.315 4.147 20 0 DIADLO CC[N@@H+](Cc1ccccc1Br)Cc1cccnc1C ZINC000507118245 340208247 /nfs/dbraw/zinc/20/82/47/340208247.db2.gz SVUOUJDYHVZKMC-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@H+](Cc1ccccc1Br)Cc1cccnc1C ZINC000507118245 340208248 /nfs/dbraw/zinc/20/82/48/340208248.db2.gz SVUOUJDYHVZKMC-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO Oc1cccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1Cl ZINC000507133026 340208923 /nfs/dbraw/zinc/20/89/23/340208923.db2.gz RRUAOMBXDSAIJX-HNNXBMFYSA-N 1 2 319.857 4.336 20 0 DIADLO Oc1cccc(C[N@H+]2CCSC[C@H]2c2ccccc2)c1Cl ZINC000507133026 340208924 /nfs/dbraw/zinc/20/89/24/340208924.db2.gz RRUAOMBXDSAIJX-HNNXBMFYSA-N 1 2 319.857 4.336 20 0 DIADLO Clc1cccc(Cl)c1C[N@H+](CC1=CCCOC1)C1CC1 ZINC000507145993 340209410 /nfs/dbraw/zinc/20/94/10/340209410.db2.gz VBNUAGUIHMZGRZ-UHFFFAOYSA-N 1 2 312.240 4.305 20 0 DIADLO Clc1cccc(Cl)c1C[N@@H+](CC1=CCCOC1)C1CC1 ZINC000507145993 340209411 /nfs/dbraw/zinc/20/94/11/340209411.db2.gz VBNUAGUIHMZGRZ-UHFFFAOYSA-N 1 2 312.240 4.305 20 0 DIADLO CCc1nocc1C[N@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000507159618 340210120 /nfs/dbraw/zinc/21/01/20/340210120.db2.gz JBFGNZQKUKGDKE-BLLLJJGKSA-N 1 2 300.402 4.118 20 0 DIADLO CCc1nocc1C[N@@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000507159618 340210121 /nfs/dbraw/zinc/21/01/21/340210121.db2.gz JBFGNZQKUKGDKE-BLLLJJGKSA-N 1 2 300.402 4.118 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)nc1 ZINC000507205665 340213105 /nfs/dbraw/zinc/21/31/05/340213105.db2.gz XJXFJLCOAWCPDA-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)nc1 ZINC000507205665 340213106 /nfs/dbraw/zinc/21/31/06/340213106.db2.gz XJXFJLCOAWCPDA-UHFFFAOYSA-N 1 2 306.409 4.494 20 0 DIADLO Cc1nn2c(C[N@H+](C)[C@H](C)c3ccco3)c(C(C)C)nc2s1 ZINC000507220955 340214190 /nfs/dbraw/zinc/21/41/90/340214190.db2.gz CGLVWRSBGYKZKE-LLVKDONJSA-N 1 2 318.446 4.009 20 0 DIADLO Cc1nn2c(C[N@@H+](C)[C@H](C)c3ccco3)c(C(C)C)nc2s1 ZINC000507220955 340214191 /nfs/dbraw/zinc/21/41/91/340214191.db2.gz CGLVWRSBGYKZKE-LLVKDONJSA-N 1 2 318.446 4.009 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c1F ZINC000507227057 340214697 /nfs/dbraw/zinc/21/46/97/340214697.db2.gz HSEZLNXRVFZXAB-HNNXBMFYSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(F)c(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c1F ZINC000507227057 340214698 /nfs/dbraw/zinc/21/46/98/340214698.db2.gz HSEZLNXRVFZXAB-HNNXBMFYSA-N 1 2 307.315 4.147 20 0 DIADLO COCc1nc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2C)cs1 ZINC000507243113 340215155 /nfs/dbraw/zinc/21/51/55/340215155.db2.gz KCYDISFGHUKRIQ-AWEZNQCLSA-N 1 2 304.459 4.099 20 0 DIADLO COCc1nc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2C)cs1 ZINC000507243113 340215156 /nfs/dbraw/zinc/21/51/56/340215156.db2.gz KCYDISFGHUKRIQ-AWEZNQCLSA-N 1 2 304.459 4.099 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCCc3occc3C2)s1 ZINC000516604531 340218860 /nfs/dbraw/zinc/21/88/60/340218860.db2.gz WSEAELZLWAJRKA-UHFFFAOYSA-N 1 2 301.333 4.308 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCCc3occc3C2)s1 ZINC000516604531 340218861 /nfs/dbraw/zinc/21/88/61/340218861.db2.gz WSEAELZLWAJRKA-UHFFFAOYSA-N 1 2 301.333 4.308 20 0 DIADLO CCc1cccnc1[C@H](C)Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000507441833 340219652 /nfs/dbraw/zinc/21/96/52/340219652.db2.gz MKTVTVRBZXDNDC-HNNXBMFYSA-N 1 2 310.445 4.202 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+][C@H](COCC(C)C)c1ccco1 ZINC000507469175 340221169 /nfs/dbraw/zinc/22/11/69/340221169.db2.gz JSAHYTXQSADDEP-DOTOQJQBSA-N 1 2 316.445 4.302 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000507505508 340223147 /nfs/dbraw/zinc/22/31/47/340223147.db2.gz DWWYXEARUFKKFG-AWEZNQCLSA-N 1 2 307.397 4.150 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000507505537 340223176 /nfs/dbraw/zinc/22/31/76/340223176.db2.gz FARDRCIEXJWDPO-LBPRGKRZSA-N 1 2 303.475 4.249 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000507509071 340223347 /nfs/dbraw/zinc/22/33/47/340223347.db2.gz KEKRILDAINGCKQ-AWEZNQCLSA-N 1 2 307.397 4.150 20 0 DIADLO Cc1ccc(N[C@@H](c2[nH+]ccn2C)c2cccc(F)c2)cc1F ZINC000507804134 340232073 /nfs/dbraw/zinc/23/20/73/340232073.db2.gz MJGNWYZJVAMUFZ-QGZVFWFLSA-N 1 2 313.351 4.208 20 0 DIADLO C[C@H](c1cnn(C)c1)[N@H+](C)Cc1ccc(-c2ccccc2)cc1F ZINC000507856555 340234360 /nfs/dbraw/zinc/23/43/60/340234360.db2.gz WJYZGMRRWPRNRY-OAHLLOKOSA-N 1 2 323.415 4.419 20 0 DIADLO C[C@H](c1cnn(C)c1)[N@@H+](C)Cc1ccc(-c2ccccc2)cc1F ZINC000507856555 340234361 /nfs/dbraw/zinc/23/43/61/340234361.db2.gz WJYZGMRRWPRNRY-OAHLLOKOSA-N 1 2 323.415 4.419 20 0 DIADLO Fc1c(Cl)cc(NCc2cccc3[nH+]ccn32)cc1Cl ZINC000508516054 340245376 /nfs/dbraw/zinc/24/53/76/340245376.db2.gz IPEWFUPPBAVIOE-UHFFFAOYSA-N 1 2 310.159 4.392 20 0 DIADLO COc1ccc(-c2ccccc2)cc1C[N@H+](C)Cc1cc(C)on1 ZINC000508532265 340246052 /nfs/dbraw/zinc/24/60/52/340246052.db2.gz DAQKMGBBKAFIQK-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO COc1ccc(-c2ccccc2)cc1C[N@@H+](C)Cc1cc(C)on1 ZINC000508532265 340246053 /nfs/dbraw/zinc/24/60/53/340246053.db2.gz DAQKMGBBKAFIQK-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO Fc1ccc(C[N@H+](Cc2cscn2)C2CCCC2)c(F)c1 ZINC000508805615 340253388 /nfs/dbraw/zinc/25/33/88/340253388.db2.gz IUYSGZXZUPBKMT-UHFFFAOYSA-N 1 2 308.397 4.366 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2cscn2)C2CCCC2)c(F)c1 ZINC000508805615 340253389 /nfs/dbraw/zinc/25/33/89/340253389.db2.gz IUYSGZXZUPBKMT-UHFFFAOYSA-N 1 2 308.397 4.366 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCO[C@H](c3ccsc3)C2)c1 ZINC000508855905 340254443 /nfs/dbraw/zinc/25/44/43/340254443.db2.gz KMKNDTNWIACFNL-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCO[C@H](c3ccsc3)C2)c1 ZINC000508855905 340254444 /nfs/dbraw/zinc/25/44/44/340254444.db2.gz KMKNDTNWIACFNL-INIZCTEOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1[NH2+][C@@H]1CCCC12CCCC2 ZINC000509118902 340261755 /nfs/dbraw/zinc/26/17/55/340261755.db2.gz AEFNGQXEJFDSQB-LJQANCHMSA-N 1 2 314.473 4.356 20 0 DIADLO C[C@@H]1C[C@H](C)CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509189770 340263414 /nfs/dbraw/zinc/26/34/14/340263414.db2.gz IBLVDFPJBSIEBR-HZPDHXFCSA-N 1 2 324.424 4.382 20 0 DIADLO CN(C[C@@H]1CC=CCC1)C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509307288 340265806 /nfs/dbraw/zinc/26/58/06/340265806.db2.gz SJJFTLZBIGGMGA-MRXNPFEDSA-N 1 2 322.408 4.302 20 0 DIADLO C[C@@H]1CCCCCN1C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509334300 340266564 /nfs/dbraw/zinc/26/65/64/340266564.db2.gz ZMVTXQQHGFKXHO-OAHLLOKOSA-N 1 2 310.397 4.279 20 0 DIADLO CC[C@H]1c2ccsc2CC[N@H+]1Cc1nc2ccccc2n1C ZINC000509408730 340268520 /nfs/dbraw/zinc/26/85/20/340268520.db2.gz TXDYNBFYOKCBAP-HNNXBMFYSA-N 1 2 311.454 4.144 20 0 DIADLO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1nc2ccccc2n1C ZINC000509408730 340268521 /nfs/dbraw/zinc/26/85/21/340268521.db2.gz TXDYNBFYOKCBAP-HNNXBMFYSA-N 1 2 311.454 4.144 20 0 DIADLO FC(F)(F)c1cccc([C@@]2(F)CCN(c3cccc[nH+]3)C2)c1 ZINC000509542395 340272833 /nfs/dbraw/zinc/27/28/33/340272833.db2.gz QZGOKVUQMMASSH-OAHLLOKOSA-N 1 2 310.294 4.176 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H](C)Cc1ccccc1 ZINC000509646083 340275404 /nfs/dbraw/zinc/27/54/04/340275404.db2.gz HRVSULAQXOACQA-HNNXBMFYSA-N 1 2 319.408 4.202 20 0 DIADLO Fc1ccc(Cl)c(OCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000509747648 340278282 /nfs/dbraw/zinc/27/82/82/340278282.db2.gz WVAVCFRTPPLFSC-UHFFFAOYSA-N 1 2 316.763 4.303 20 0 DIADLO CN(C(=O)c1ccccc1Oc1cc[nH+]cc1)c1ccccc1F ZINC000509855085 340281656 /nfs/dbraw/zinc/28/16/56/340281656.db2.gz PVQUFWFPBGJVHX-UHFFFAOYSA-N 1 2 322.339 4.290 20 0 DIADLO COc1ccc(OC)c(C[N@H+](Cc2ccccc2F)C2CC2)c1 ZINC000302769574 340281744 /nfs/dbraw/zinc/28/17/44/340281744.db2.gz XJBANIAMKQRQHO-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO COc1ccc(OC)c(C[N@@H+](Cc2ccccc2F)C2CC2)c1 ZINC000302769574 340281745 /nfs/dbraw/zinc/28/17/45/340281745.db2.gz XJBANIAMKQRQHO-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO CCCOc1ccc(NC(=O)Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC000510032796 340285830 /nfs/dbraw/zinc/28/58/30/340285830.db2.gz CTLHMJFBJLSJEA-UHFFFAOYSA-N 1 2 324.384 4.076 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccccc2Cl)CC2CC2)oc1C ZINC000510265025 340294621 /nfs/dbraw/zinc/29/46/21/340294621.db2.gz BYVSVOFERVEXKG-UHFFFAOYSA-N 1 2 304.821 4.357 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccccc2Cl)CC2CC2)oc1C ZINC000510265025 340294622 /nfs/dbraw/zinc/29/46/22/340294622.db2.gz BYVSVOFERVEXKG-UHFFFAOYSA-N 1 2 304.821 4.357 20 0 DIADLO Cn1c2ccccc2nc1[C@@H]1CCC[N@@H+]1Cc1ccccc1F ZINC000510445242 340299641 /nfs/dbraw/zinc/29/96/41/340299641.db2.gz DUMHEIIQIBNTRZ-SFHVURJKSA-N 1 2 309.388 4.050 20 0 DIADLO Cn1c2ccccc2nc1[C@@H]1CCC[N@H+]1Cc1ccccc1F ZINC000510445242 340299642 /nfs/dbraw/zinc/29/96/42/340299642.db2.gz DUMHEIIQIBNTRZ-SFHVURJKSA-N 1 2 309.388 4.050 20 0 DIADLO Cc1ccc(CNC(=O)c2ccccc2Oc2cc[nH+]cc2)s1 ZINC000510474795 340300692 /nfs/dbraw/zinc/30/06/92/340300692.db2.gz GNKBHZYNBMIGGR-UHFFFAOYSA-N 1 2 324.405 4.174 20 0 DIADLO C[C@@H](CC(=O)Nc1ccccc1-n1cc[nH+]c1)C1CCCCC1 ZINC000510902379 340314295 /nfs/dbraw/zinc/31/42/95/340314295.db2.gz XVXARNFXLSIUIL-HNNXBMFYSA-N 1 2 311.429 4.417 20 0 DIADLO CSc1ccccc1C[N@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000511114834 340321349 /nfs/dbraw/zinc/32/13/49/340321349.db2.gz JXTNVOSYDHQHCH-UHFFFAOYSA-N 1 2 323.465 4.334 20 0 DIADLO CSc1ccccc1C[N@@H+](Cc1cc[nH]n1)Cc1ccccc1 ZINC000511114834 340321350 /nfs/dbraw/zinc/32/13/50/340321350.db2.gz JXTNVOSYDHQHCH-UHFFFAOYSA-N 1 2 323.465 4.334 20 0 DIADLO Cn1nccc1C1=CC[N@H+](Cc2c(Cl)cccc2Cl)CC1 ZINC000511122532 340321473 /nfs/dbraw/zinc/32/14/73/340321473.db2.gz ODMAXSNOCZBNQC-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1nccc1C1=CC[N@@H+](Cc2c(Cl)cccc2Cl)CC1 ZINC000511122532 340321474 /nfs/dbraw/zinc/32/14/74/340321474.db2.gz ODMAXSNOCZBNQC-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO CC(C)(C)c1ccc2c(c1)C[N@@H+](Cc1ncc(C3CC3)o1)CC2 ZINC000511189631 340323594 /nfs/dbraw/zinc/32/35/94/340323594.db2.gz XKYXVJLSAPETBR-UHFFFAOYSA-N 1 2 310.441 4.408 20 0 DIADLO CC(C)(C)c1ccc2c(c1)C[N@H+](Cc1ncc(C3CC3)o1)CC2 ZINC000511189631 340323595 /nfs/dbraw/zinc/32/35/95/340323595.db2.gz XKYXVJLSAPETBR-UHFFFAOYSA-N 1 2 310.441 4.408 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)C1CCCCC1 ZINC000511305623 340325102 /nfs/dbraw/zinc/32/51/02/340325102.db2.gz LPTSACUXYWXKGH-OAHLLOKOSA-N 1 2 311.429 4.417 20 0 DIADLO C[N@H+](Cc1ccoc1)Cc1cc(Br)ccc1Cl ZINC000511511463 340329042 /nfs/dbraw/zinc/32/90/42/340329042.db2.gz YWGTZSDGJDPHIF-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO C[N@@H+](Cc1ccoc1)Cc1cc(Br)ccc1Cl ZINC000511511463 340329043 /nfs/dbraw/zinc/32/90/43/340329043.db2.gz YWGTZSDGJDPHIF-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1)[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511603958 340332002 /nfs/dbraw/zinc/33/20/02/340332002.db2.gz DAQHLIVYHSWNAK-DYVFJYSZSA-N 1 2 314.816 4.114 20 0 DIADLO C[C@H](C(=O)Nc1ccccc1)[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511603958 340332003 /nfs/dbraw/zinc/33/20/03/340332003.db2.gz DAQHLIVYHSWNAK-DYVFJYSZSA-N 1 2 314.816 4.114 20 0 DIADLO Cc1nc(N2CC=C(c3ccc(Cl)c(Cl)c3)CC2)cc[nH+]1 ZINC000511857260 340340588 /nfs/dbraw/zinc/34/05/88/340340588.db2.gz FAPJUTAROWDHPY-UHFFFAOYSA-N 1 2 320.223 4.386 20 0 DIADLO C[C@H]([NH2+]C/C=C\c1ccc(F)c(F)c1)c1nc(C(C)(C)C)no1 ZINC000512013527 340345437 /nfs/dbraw/zinc/34/54/37/340345437.db2.gz BWULNGTWUZIKHO-GZTOBOFZSA-N 1 2 321.371 4.009 20 0 DIADLO C[C@@H]([NH2+]C/C=C/c1ccc(F)c(F)c1)c1nc(C(C)(C)C)no1 ZINC000512013529 340345439 /nfs/dbraw/zinc/34/54/39/340345439.db2.gz BWULNGTWUZIKHO-MVIFTORASA-N 1 2 321.371 4.009 20 0 DIADLO Cc1cc(C[NH2+]C2(c3ccc(F)cc3F)CCCCC2)no1 ZINC000512408480 340360840 /nfs/dbraw/zinc/36/08/40/340360840.db2.gz HPZXOLSYTHVAOF-UHFFFAOYSA-N 1 2 306.356 4.210 20 0 DIADLO Cc1cc2cc(C[N@@H+]3CCCC[C@H]3c3ncc[nH]3)oc2cc1C ZINC000512484597 340363563 /nfs/dbraw/zinc/36/35/63/340363563.db2.gz CPBUPHSLAUIWRH-KRWDZBQOSA-N 1 2 309.413 4.500 20 0 DIADLO Cc1cc2cc(C[N@H+]3CCCC[C@H]3c3ncc[nH]3)oc2cc1C ZINC000512484597 340363564 /nfs/dbraw/zinc/36/35/64/340363564.db2.gz CPBUPHSLAUIWRH-KRWDZBQOSA-N 1 2 309.413 4.500 20 0 DIADLO Clc1cccc(Cl)c1CN1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000512517621 340365085 /nfs/dbraw/zinc/36/50/85/340365085.db2.gz YUNDRTPQGWAYDM-AWEZNQCLSA-N 1 2 310.228 4.444 20 0 DIADLO CCC[N@@H+](Cc1c[nH]nc1-c1cccc(Cl)c1)CC(F)F ZINC000512599858 340368436 /nfs/dbraw/zinc/36/84/36/340368436.db2.gz KTLOGGDATXHGEW-UHFFFAOYSA-N 1 2 313.779 4.207 20 0 DIADLO CCC[N@H+](Cc1c[nH]nc1-c1cccc(Cl)c1)CC(F)F ZINC000512599858 340368437 /nfs/dbraw/zinc/36/84/37/340368437.db2.gz KTLOGGDATXHGEW-UHFFFAOYSA-N 1 2 313.779 4.207 20 0 DIADLO CCC[C@H](C)CC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000512624769 340369679 /nfs/dbraw/zinc/36/96/79/340369679.db2.gz LPOQEKNFQNXIGA-LBPRGKRZSA-N 1 2 305.809 4.291 20 0 DIADLO Oc1cccc(C[N@@H+](Cc2c(F)cccc2F)CC2CC2)c1 ZINC000512658536 340371459 /nfs/dbraw/zinc/37/14/59/340371459.db2.gz VMOHKWLBMVBXAP-UHFFFAOYSA-N 1 2 303.352 4.083 20 0 DIADLO Oc1cccc(C[N@H+](Cc2c(F)cccc2F)CC2CC2)c1 ZINC000512658536 340371460 /nfs/dbraw/zinc/37/14/60/340371460.db2.gz VMOHKWLBMVBXAP-UHFFFAOYSA-N 1 2 303.352 4.083 20 0 DIADLO Cc1nc(C[N@H+](CCc2ccc(C)cc2)Cc2ccco2)oc1C ZINC000174041453 340380710 /nfs/dbraw/zinc/38/07/10/340380710.db2.gz SDQIVHVJNXVWHJ-UHFFFAOYSA-N 1 2 324.424 4.438 20 0 DIADLO Cc1nc(C[N@@H+](CCc2ccc(C)cc2)Cc2ccco2)oc1C ZINC000174041453 340380711 /nfs/dbraw/zinc/38/07/11/340380711.db2.gz SDQIVHVJNXVWHJ-UHFFFAOYSA-N 1 2 324.424 4.438 20 0 DIADLO FC(F)C1([NH2+]Cc2cnc(-c3ccncc3)s2)CCCCC1 ZINC000512885596 340382459 /nfs/dbraw/zinc/38/24/59/340382459.db2.gz SKPZSAOHBNKION-UHFFFAOYSA-N 1 2 323.412 4.263 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1)c1cccnc1 ZINC000174404719 340387744 /nfs/dbraw/zinc/38/77/44/340387744.db2.gz PAJZECBMXBFGEY-CQSZACIVSA-N 1 2 319.364 4.011 20 0 DIADLO CC(C)[C@H](CNc1ccc(Cn2cc[nH+]c2)cn1)c1ccccc1 ZINC000513087477 340392760 /nfs/dbraw/zinc/39/27/60/340392760.db2.gz AQTQBAICFXABTC-IBGZPJMESA-N 1 2 320.440 4.178 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3c(Cl)c(Cl)ccc3C2)nc1 ZINC000513111935 340393837 /nfs/dbraw/zinc/39/38/37/340393837.db2.gz PMIPSPZXMPMOQD-UHFFFAOYSA-N 1 2 307.224 4.255 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3c(Cl)c(Cl)ccc3C2)nc1 ZINC000513111935 340393838 /nfs/dbraw/zinc/39/38/38/340393838.db2.gz PMIPSPZXMPMOQD-UHFFFAOYSA-N 1 2 307.224 4.255 20 0 DIADLO Cc1cccc2[nH+]c(CNc3ccc(CC(F)(F)F)cc3)cn21 ZINC000177251475 340438144 /nfs/dbraw/zinc/43/81/44/340438144.db2.gz CAHZPOVTCDXFCX-UHFFFAOYSA-N 1 2 319.330 4.360 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(Br)cc2)o1 ZINC000220886563 340519605 /nfs/dbraw/zinc/51/96/05/340519605.db2.gz CRAVCKUVHIJNNT-WDEREUQCSA-N 1 2 309.207 4.157 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000189305390 340533512 /nfs/dbraw/zinc/53/35/12/340533512.db2.gz WLMMMXUQHBJVJA-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO Cc1cccc(CC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)c1 ZINC000522110219 340571829 /nfs/dbraw/zinc/57/18/29/340571829.db2.gz MXCCYSRZHZGXPL-UHFFFAOYSA-N 1 2 318.376 4.364 20 0 DIADLO Cc1cc(C)c(NC(=O)CCSc2ccc(F)cc2)c(C)[nH+]1 ZINC000193182381 340573602 /nfs/dbraw/zinc/57/36/02/340573602.db2.gz VAOXXBCIIZAJHQ-UHFFFAOYSA-N 1 2 318.417 4.267 20 0 DIADLO CC[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1-n1cc[nH+]c1 ZINC000522129470 340575354 /nfs/dbraw/zinc/57/53/54/340575354.db2.gz KKERCODXIJVURE-KRWDZBQOSA-N 1 2 319.408 4.080 20 0 DIADLO COC[C@@H]([NH2+]Cc1ncc(C(C)C)s1)c1ccc(Cl)cc1 ZINC000193276187 340575424 /nfs/dbraw/zinc/57/54/24/340575424.db2.gz XZZYCULRCYKLRT-CQSZACIVSA-N 1 2 324.877 4.397 20 0 DIADLO Cc1cccn2cc(CC(=O)Nc3c(C)cccc3C(C)C)[nH+]c12 ZINC000522239103 340591481 /nfs/dbraw/zinc/59/14/81/340591481.db2.gz NLNMEWMETKQSPG-UHFFFAOYSA-N 1 2 321.424 4.256 20 0 DIADLO O=C(Nc1nc(C[NH+]2CCCCC2)cs1)C1CCCCCC1 ZINC000523154652 340617142 /nfs/dbraw/zinc/61/71/42/340617142.db2.gz WKOMIYLPDQNQEW-UHFFFAOYSA-N 1 2 321.490 4.038 20 0 DIADLO CS[C@H](C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1ccccc1 ZINC000523484221 340626091 /nfs/dbraw/zinc/62/60/91/340626091.db2.gz ZKWXITVPZUMOCX-KRWDZBQOSA-N 1 2 323.421 4.120 20 0 DIADLO CCOc1cc(C)ccc1NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000237048870 340667648 /nfs/dbraw/zinc/66/76/48/340667648.db2.gz YZIFJQZQKJMYHX-UHFFFAOYSA-N 1 2 307.397 4.192 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2cc[nH]n2)c2ccccc2Cl)cc1 ZINC000237916655 340675167 /nfs/dbraw/zinc/67/51/67/340675167.db2.gz QRXQZCPUDQTJFN-KRWDZBQOSA-N 1 2 315.779 4.081 20 0 DIADLO Clc1ccc(C[NH2+][C@@H]2COc3c2ccc(Cl)c3Cl)o1 ZINC000525182630 340693987 /nfs/dbraw/zinc/69/39/87/340693987.db2.gz DJJFACRDSZQKLP-SNVBAGLBSA-N 1 2 318.587 4.463 20 0 DIADLO CC(C)[C@H](C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1ccccc1 ZINC000525199467 340694763 /nfs/dbraw/zinc/69/47/63/340694763.db2.gz HXEMGRCQZSECFG-IBGZPJMESA-N 1 2 319.408 4.455 20 0 DIADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1cccc(F)c1Cl ZINC000525199473 340694789 /nfs/dbraw/zinc/69/47/89/340694789.db2.gz MHRQZFTZJHWAQC-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]CC(F)(F)c2ccccc2)cc1OC ZINC000322317255 340704071 /nfs/dbraw/zinc/70/40/71/340704071.db2.gz MPHUFWYHGHURAI-CYBMUJFWSA-N 1 2 321.367 4.146 20 0 DIADLO CC(C)C[C@H]([NH2+]Cc1ccc(C(F)F)cc1)C(=O)OC(C)C ZINC000526001467 340708236 /nfs/dbraw/zinc/70/82/36/340708236.db2.gz KYALBZDSZJJMTG-HNNXBMFYSA-N 1 2 313.388 4.080 20 0 DIADLO Cc1cn2cc(NC(=O)c3ccc(C(C)(C)C)cc3)ccc2[nH+]1 ZINC000041305357 340709664 /nfs/dbraw/zinc/70/96/64/340709664.db2.gz AXNFWZQKYPYBSQ-UHFFFAOYSA-N 1 2 307.397 4.193 20 0 DIADLO CCOc1cccc(Cl)c1C[NH2+][C@@H](C)c1ncccc1F ZINC000528822500 340735899 /nfs/dbraw/zinc/73/58/99/340735899.db2.gz HGOZHLWUSUTSNA-NSHDSACASA-N 1 2 308.784 4.124 20 0 DIADLO Cc1cocc1C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000529183235 340747804 /nfs/dbraw/zinc/74/78/04/340747804.db2.gz WHYWCZIISVXZEI-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO FC(F)(F)c1sccc1CN1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000529527089 340759333 /nfs/dbraw/zinc/75/93/33/340759333.db2.gz AMWVMZNALQFNFT-NSHDSACASA-N 1 2 315.364 4.217 20 0 DIADLO Fc1cc2c(cc1Cl)[C@H]([NH2+]Cc1noc3c1CCCC3)CC2 ZINC000529570536 340763803 /nfs/dbraw/zinc/76/38/03/340763803.db2.gz OKFONAHMPUEABG-OAHLLOKOSA-N 1 2 320.795 4.123 20 0 DIADLO Oc1ccc(F)c(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)c1F ZINC000529665876 340767033 /nfs/dbraw/zinc/76/70/33/340767033.db2.gz PFJIDKCXMFNTMG-CQSZACIVSA-N 1 2 309.743 4.101 20 0 DIADLO CC(C)n1c[nH+]cc1CN1CCc2cccc(C(F)(F)F)c2C1 ZINC000529679440 340767705 /nfs/dbraw/zinc/76/77/05/340767705.db2.gz NBWJFWPQTHUQMA-UHFFFAOYSA-N 1 2 323.362 4.041 20 0 DIADLO Cc1nn(C)cc1CNc1[nH+]c2ccccc2n1C1CCCCC1 ZINC000124024485 340796798 /nfs/dbraw/zinc/79/67/98/340796798.db2.gz WBCJJVFWKATUJH-UHFFFAOYSA-N 1 2 323.444 4.196 20 0 DIADLO C[C@@H]([NH2+][C@H](c1cccs1)c1ccc(F)cc1)c1nccn1C ZINC000538210966 340813489 /nfs/dbraw/zinc/81/34/89/340813489.db2.gz OVLNNYRDUSRIGW-WBMJQRKESA-N 1 2 315.417 4.061 20 0 DIADLO C[C@@H]1Cc2ccc(F)cc2[C@H]1Nc1ccc(N2CCCC2)[nH+]c1 ZINC000538558436 340833352 /nfs/dbraw/zinc/83/33/52/340833352.db2.gz AZLUIEGMKSNUML-YJYMSZOUSA-N 1 2 311.404 4.166 20 0 DIADLO CCCCc1noc(C[NH2+][C@H](C)c2cccc3ccccc32)n1 ZINC000128311536 340871114 /nfs/dbraw/zinc/87/11/14/340871114.db2.gz DWZRVLIILUZAMI-CQSZACIVSA-N 1 2 309.413 4.416 20 0 DIADLO CCc1nc2cc(N[C@@H](c3[nH]cc[nH+]3)c3ccccc3)ccc2o1 ZINC000128532639 340893882 /nfs/dbraw/zinc/89/38/82/340893882.db2.gz LBFPONBWGCJIKL-GOSISDBHSA-N 1 2 318.380 4.315 20 0 DIADLO Cc1cc(OCC(=O)Nc2cccc(F)c2)c2cccc(C)c2[nH+]1 ZINC000539744043 340898611 /nfs/dbraw/zinc/89/86/11/340898611.db2.gz DRUVUZRJOUTKFP-UHFFFAOYSA-N 1 2 324.355 4.008 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@H](C)c2cncs2)c2ccccn2)c1 ZINC000540155897 340918249 /nfs/dbraw/zinc/91/82/49/340918249.db2.gz KONCIEXWQZYALD-KDOFPFPSSA-N 1 2 309.438 4.287 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2c1ccc(Cl)c2Cl)c1cscn1 ZINC000540186133 340921814 /nfs/dbraw/zinc/92/18/14/340921814.db2.gz MRFATADVENTWOW-OIBJUYFYSA-N 1 2 315.225 4.234 20 0 DIADLO CC[C@@H](C)[C@@H]([NH2+]Cc1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000540386186 340928925 /nfs/dbraw/zinc/92/89/25/340928925.db2.gz PBXIVIXFGXADND-BDJLRTHQSA-N 1 2 319.836 4.477 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)C12CCC(CC1)C2 ZINC000541422400 340970338 /nfs/dbraw/zinc/97/03/38/340970338.db2.gz CBGAQGJZVCWXNF-UHFFFAOYSA-N 1 2 308.381 4.393 20 0 DIADLO c1csc([C@@H]([NH2+]Cc2nc(C3CCCC3)no2)C2CC2)c1 ZINC000541580458 340975684 /nfs/dbraw/zinc/97/56/84/340975684.db2.gz LONLUBKATBRCKR-HNNXBMFYSA-N 1 2 303.431 4.030 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@@H]2CCC(C)(C)C2)c2ccc(Cl)cc2)no1 ZINC000541587384 340976117 /nfs/dbraw/zinc/97/61/17/340976117.db2.gz GKVVGBSWZDNZGS-CABCVRRESA-N 1 2 319.836 4.289 20 0 DIADLO Cc1cccn2cc(CSc3ncc(C(C)(C)C)o3)[nH+]c12 ZINC000130181010 341005453 /nfs/dbraw/zinc/00/54/53/341005453.db2.gz OAMTXDSBKXGCGD-UHFFFAOYSA-N 1 2 301.415 4.221 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](c2ccc(C)o2)C2CCC2)cs1 ZINC000542664276 341016150 /nfs/dbraw/zinc/01/61/50/341016150.db2.gz UQTGOVDJHRZRSL-LRDDRELGSA-N 1 2 320.458 4.383 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CC=C(C(F)(F)F)CC2)c(F)c1 ZINC000542700617 341017953 /nfs/dbraw/zinc/01/79/53/341017953.db2.gz SYNGJHQPQMGHIZ-UPHRSURJSA-N 1 2 303.274 4.172 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CC=C(C(F)(F)F)CC2)c(F)c1 ZINC000542700617 341017954 /nfs/dbraw/zinc/01/79/54/341017954.db2.gz SYNGJHQPQMGHIZ-UPHRSURJSA-N 1 2 303.274 4.172 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2c(F)cccc2F)o1)c1ccon1 ZINC000542709733 341018580 /nfs/dbraw/zinc/01/85/80/341018580.db2.gz FTNMAGWPMUUVCI-SNVBAGLBSA-N 1 2 304.296 4.064 20 0 DIADLO CSc1ccccc1NCc1cn2cc(Cl)ccc2[nH+]1 ZINC000070945093 341020085 /nfs/dbraw/zinc/02/00/85/341020085.db2.gz RIGUIGYKUKPKOL-UHFFFAOYSA-N 1 2 303.818 4.322 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)s1 ZINC000542811519 341021562 /nfs/dbraw/zinc/02/15/62/341021562.db2.gz MQPOJMLEUDJRTP-INIZCTEOSA-N 1 2 315.442 4.470 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCc3c(cccc3OC)C2)cs1 ZINC000542944219 341026909 /nfs/dbraw/zinc/02/69/09/341026909.db2.gz FSQOSWCYYUPIFW-UHFFFAOYSA-N 1 2 316.470 4.053 20 0 DIADLO CCCCc1nc(C[N@H+]2CCc3c(cccc3OC)C2)cs1 ZINC000542944219 341026910 /nfs/dbraw/zinc/02/69/10/341026910.db2.gz FSQOSWCYYUPIFW-UHFFFAOYSA-N 1 2 316.470 4.053 20 0 DIADLO COc1cccc2c1CC[N@H+](Cc1nc(C(C)(C)C)cs1)C2 ZINC000542945013 341026964 /nfs/dbraw/zinc/02/69/64/341026964.db2.gz KMOXRFNQATYZHL-UHFFFAOYSA-N 1 2 316.470 4.008 20 0 DIADLO COc1cccc2c1CC[N@@H+](Cc1nc(C(C)(C)C)cs1)C2 ZINC000542945013 341026965 /nfs/dbraw/zinc/02/69/65/341026965.db2.gz KMOXRFNQATYZHL-UHFFFAOYSA-N 1 2 316.470 4.008 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@@H+]2Cc3ccccc3[C@@H]2C)cc1F ZINC000543060561 341029822 /nfs/dbraw/zinc/02/98/22/341029822.db2.gz KHDQPSZTBBBRIM-UONOGXRCSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@H+]2Cc3ccccc3[C@@H]2C)cc1F ZINC000543060561 341029823 /nfs/dbraw/zinc/02/98/23/341029823.db2.gz KHDQPSZTBBBRIM-UONOGXRCSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@@H+]2Cc3ccccc3[C@@H]2C)c(F)c1 ZINC000543063035 341030148 /nfs/dbraw/zinc/03/01/48/341030148.db2.gz WTCSLLFXKIINES-UONOGXRCSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@H+]2Cc3ccccc3[C@@H]2C)c(F)c1 ZINC000543063035 341030149 /nfs/dbraw/zinc/03/01/49/341030149.db2.gz WTCSLLFXKIINES-UONOGXRCSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1cccc(OCC[N@@H+](C)Cc2ncc(C(C)C)s2)c1 ZINC000543393797 341041685 /nfs/dbraw/zinc/04/16/85/341041685.db2.gz JAHWMMDDBKSVRJ-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO Cc1cccc(OCC[N@H+](C)Cc2ncc(C(C)C)s2)c1 ZINC000543393797 341041686 /nfs/dbraw/zinc/04/16/86/341041686.db2.gz JAHWMMDDBKSVRJ-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(N[C@H](C)[C@@H]2CCCO2)c1 ZINC000543426604 341043962 /nfs/dbraw/zinc/04/39/62/341043962.db2.gz WJADRIIBMPRKJW-QAPCUYQASA-N 1 2 313.445 4.330 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2sc3ccccc3c2Cl)o1 ZINC000543543071 341048680 /nfs/dbraw/zinc/04/86/80/341048680.db2.gz DLPVBCZQJMKMRW-MRVPVSSYSA-N 1 2 307.806 4.097 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)cccc2F)o1 ZINC000130855414 341049318 /nfs/dbraw/zinc/04/93/18/341049318.db2.gz OKTZCOFWOCDJAA-INIZCTEOSA-N 1 2 307.340 4.041 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)cccc2F)o1 ZINC000130855414 341049319 /nfs/dbraw/zinc/04/93/19/341049319.db2.gz OKTZCOFWOCDJAA-INIZCTEOSA-N 1 2 307.340 4.041 20 0 DIADLO CC[C@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)c1ccn(C)n1 ZINC000543595244 341050019 /nfs/dbraw/zinc/05/00/19/341050019.db2.gz LTQUDBQPITVZFH-DZGCQCFKSA-N 1 2 311.351 4.155 20 0 DIADLO CC[C@H]([NH2+][C@@H](CC(F)(F)F)c1ccccc1)c1ccn(C)n1 ZINC000543595251 341050050 /nfs/dbraw/zinc/05/00/50/341050050.db2.gz LTQUDBQPITVZFH-ZFWWWQNUSA-N 1 2 311.351 4.155 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCOC[C@@H]2c2ccccc2)c(F)c1 ZINC000543631348 341052317 /nfs/dbraw/zinc/05/23/17/341052317.db2.gz KAYRZSIWJFRYQT-BQHGXPCASA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCOC[C@@H]2c2ccccc2)c(F)c1 ZINC000543631348 341052318 /nfs/dbraw/zinc/05/23/18/341052318.db2.gz KAYRZSIWJFRYQT-BQHGXPCASA-N 1 2 315.363 4.052 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)s1 ZINC000543739619 341055206 /nfs/dbraw/zinc/05/52/06/341055206.db2.gz HDOMPPBPDWDHGO-ZETCQYMHSA-N 1 2 302.230 4.004 20 0 DIADLO CCc1ccccc1NC(=O)[C@H](C)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000543988032 341065114 /nfs/dbraw/zinc/06/51/14/341065114.db2.gz VOVJUIHGMBTUKV-GJZGRUSLSA-N 1 2 308.425 4.153 20 0 DIADLO CCc1ccccc1NC(=O)[C@H](C)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000543988032 341065115 /nfs/dbraw/zinc/06/51/15/341065115.db2.gz VOVJUIHGMBTUKV-GJZGRUSLSA-N 1 2 308.425 4.153 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2ncc(C3CC3)o2)C2CC2)cc1 ZINC000543991371 341065551 /nfs/dbraw/zinc/06/55/51/341065551.db2.gz TVPJHWLYFJDEDT-QGZVFWFLSA-N 1 2 302.805 4.446 20 0 DIADLO Brc1cccc(C2CCN(c3cccc[nH+]3)CC2)c1 ZINC000543994740 341065618 /nfs/dbraw/zinc/06/56/18/341065618.db2.gz DRCXURGTHDCJNV-UHFFFAOYSA-N 1 2 317.230 4.228 20 0 DIADLO Cc1nn(C)cc1C[N@@H+](C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000131211735 341065890 /nfs/dbraw/zinc/06/58/90/341065890.db2.gz LKDQEYQAUIXVEF-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO Cc1nn(C)cc1C[N@H+](C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000131211735 341065891 /nfs/dbraw/zinc/06/58/91/341065891.db2.gz LKDQEYQAUIXVEF-NSHDSACASA-N 1 2 312.244 4.228 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1ccc(CO)o1 ZINC000131215473 341066040 /nfs/dbraw/zinc/06/60/40/341066040.db2.gz ZVMLVJKQNUMFBY-JTQLQIEISA-N 1 2 314.212 4.272 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1ccc(CO)o1 ZINC000131215473 341066041 /nfs/dbraw/zinc/06/60/41/341066041.db2.gz ZVMLVJKQNUMFBY-JTQLQIEISA-N 1 2 314.212 4.272 20 0 DIADLO CCC(=Cc1nc(-c2ccc(C)[nH+]c2N2CCCC2)no1)CC ZINC000544441753 341082268 /nfs/dbraw/zinc/08/22/68/341082268.db2.gz QJVLJUFGXJDRQZ-UHFFFAOYSA-N 1 2 312.417 4.244 20 0 DIADLO Cc1ccccc1-c1cnc(C[NH2+][C@@H](C)c2cnn(C(C)C)c2)o1 ZINC000544469494 341083505 /nfs/dbraw/zinc/08/35/05/341083505.db2.gz OLHYCSADAVVUOF-HNNXBMFYSA-N 1 2 324.428 4.278 20 0 DIADLO Cc1ccc(-c2noc([C@@H](C)[NH2+]Cc3ccccc3)n2)cc1F ZINC000544515873 341084748 /nfs/dbraw/zinc/08/47/48/341084748.db2.gz QRJFBSKFIISIHX-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Oc2ccccc2)c(F)c1)c1ccon1 ZINC000544549590 341085489 /nfs/dbraw/zinc/08/54/89/341085489.db2.gz LXJLPJCWVXOUPO-ZDUSSCGKSA-N 1 2 312.344 4.457 20 0 DIADLO Fc1ccc(/C=C/C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c(F)c1 ZINC000544610630 341088789 /nfs/dbraw/zinc/08/87/89/341088789.db2.gz AARCEDJRRQFSKR-ZLHKHBAESA-N 1 2 315.363 4.052 20 0 DIADLO Fc1ccc(/C=C/C[N@H+]2CCO[C@@H](c3ccccc3)C2)c(F)c1 ZINC000544610630 341088790 /nfs/dbraw/zinc/08/87/90/341088790.db2.gz AARCEDJRRQFSKR-ZLHKHBAESA-N 1 2 315.363 4.052 20 0 DIADLO COCCC(C)(C)CNc1[nH+]cccc1OCc1ccccc1 ZINC000544847576 341096197 /nfs/dbraw/zinc/09/61/97/341096197.db2.gz JKTSZTKPIRYKNG-UHFFFAOYSA-N 1 2 314.429 4.135 20 0 DIADLO CC(C)c1ccc(-c2noc(Cc3cn4ccccc4[nH+]3)n2)cc1 ZINC000544898787 341098352 /nfs/dbraw/zinc/09/83/52/341098352.db2.gz UOHHHAFWBUHKGM-UHFFFAOYSA-N 1 2 318.380 4.099 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)[C@H]1C[C@@H]1c1ccccc1 ZINC000131711554 341109462 /nfs/dbraw/zinc/10/94/62/341109462.db2.gz BWOMTTAESVQSOX-CABCVRRESA-N 1 2 310.397 4.001 20 0 DIADLO CC(C)[C@H](CC1CCCCC1)c1nc(Cc2c[nH+]cn2C)no1 ZINC000545136143 341109912 /nfs/dbraw/zinc/10/99/12/341109912.db2.gz WKCFDYJNWDIZEA-INIZCTEOSA-N 1 2 316.449 4.104 20 0 DIADLO Cc1oc2ccccc2c1C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000545219048 341115070 /nfs/dbraw/zinc/11/50/70/341115070.db2.gz NNAIJKJYWTWAHP-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO CC[C@H]([NH2+][C@H]1COc2ccc(F)cc21)c1cc(F)ccc1F ZINC000545235835 341116316 /nfs/dbraw/zinc/11/63/16/341116316.db2.gz OSSQAFOIPOGLHK-HOTGVXAUSA-N 1 2 307.315 4.278 20 0 DIADLO Cc1ccc(OCc2nc(C[NH+]3CCCCC3)cs2)cc1 ZINC000073695675 341120080 /nfs/dbraw/zinc/12/00/80/341120080.db2.gz LAJGNBYDWUYPIZ-UHFFFAOYSA-N 1 2 302.443 4.016 20 0 DIADLO C[N@H+](Cc1nc2ccccc2s1)Cc1ccc(F)cc1F ZINC000073893937 341122961 /nfs/dbraw/zinc/12/29/61/341122961.db2.gz HXKKOEMBALHMAU-UHFFFAOYSA-N 1 2 304.365 4.207 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2s1)Cc1ccc(F)cc1F ZINC000073893937 341122962 /nfs/dbraw/zinc/12/29/62/341122962.db2.gz HXKKOEMBALHMAU-UHFFFAOYSA-N 1 2 304.365 4.207 20 0 DIADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)c1ccc(F)c(Cl)c1 ZINC000132445441 341123384 /nfs/dbraw/zinc/12/33/84/341123384.db2.gz XPAKUGFFZWRTKJ-UHFFFAOYSA-N 1 2 322.767 4.304 20 0 DIADLO CCCc1[nH+]c2ccccc2n1CCC(=O)Nc1ccccc1 ZINC000074020895 341125419 /nfs/dbraw/zinc/12/54/19/341125419.db2.gz OCFBEALFRARUQV-UHFFFAOYSA-N 1 2 307.397 4.018 20 0 DIADLO CC[C@H](CC(F)(F)F)Nc1nc(C)[nH+]c2ccc(OC)cc21 ZINC000545469261 341126654 /nfs/dbraw/zinc/12/66/54/341126654.db2.gz MCJFRCIZBXOYTH-SNVBAGLBSA-N 1 2 313.323 4.090 20 0 DIADLO CCC1(c2nc(-c3cccc(Cn4cc[nH+]c4)c3)no2)CCCC1 ZINC000545570736 341130943 /nfs/dbraw/zinc/13/09/43/341130943.db2.gz NGVIGVGBULPWMV-UHFFFAOYSA-N 1 2 322.412 4.203 20 0 DIADLO CCC(=Cc1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1)CC ZINC000545570799 341130989 /nfs/dbraw/zinc/13/09/89/341130989.db2.gz OXOYAEACHAMIGC-UHFFFAOYSA-N 1 2 308.385 4.185 20 0 DIADLO CC[C@H](C)c1noc(CCn2c3ccccc3[nH+]c2C2CC2)n1 ZINC000545580974 341131456 /nfs/dbraw/zinc/13/14/56/341131456.db2.gz ODBFTINTVRHRND-LBPRGKRZSA-N 1 2 310.401 4.053 20 0 DIADLO CC1(C)C[C@H]1c1noc(CCn2c3ccccc3[nH+]c2C2CC2)n1 ZINC000545613593 341133339 /nfs/dbraw/zinc/13/33/39/341133339.db2.gz CCNXAEGNQUNPOQ-ZDUSSCGKSA-N 1 2 322.412 4.053 20 0 DIADLO Cc1ccc(Cc2noc(-c3cccc(OCC(C)C)c3)n2)c[nH+]1 ZINC000545638390 341134422 /nfs/dbraw/zinc/13/44/22/341134422.db2.gz LIOJVPGQYMRWDV-UHFFFAOYSA-N 1 2 323.396 4.066 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+]1CCc2ccsc2C1 ZINC000132666788 341138090 /nfs/dbraw/zinc/13/80/90/341138090.db2.gz DEMXRBIBPMGRNS-UHFFFAOYSA-N 1 2 316.451 4.331 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+]1CCc2ccsc2C1 ZINC000132666788 341138091 /nfs/dbraw/zinc/13/80/91/341138091.db2.gz DEMXRBIBPMGRNS-UHFFFAOYSA-N 1 2 316.451 4.331 20 0 DIADLO CC(C)(C)Cc1noc(/C=C\c2ccc(-n3cc[nH+]c3)cc2)n1 ZINC000545747822 341139307 /nfs/dbraw/zinc/13/93/07/341139307.db2.gz NMBYPYRAPYPRRI-TWGQIWQCSA-N 1 2 308.385 4.014 20 0 DIADLO Cn1c[nH+]cc1Cc1noc(-c2ccc(C3CCCCC3)cc2)n1 ZINC000545843159 341143063 /nfs/dbraw/zinc/14/30/63/341143063.db2.gz CBAASSKQJQTSQN-UHFFFAOYSA-N 1 2 322.412 4.109 20 0 DIADLO CC[C@@H](C)c1ccc([C@@H]([NH2+]Cc2noc(C)n2)C(C)C)cc1 ZINC000132712321 341143215 /nfs/dbraw/zinc/14/32/15/341143215.db2.gz PXTSQPLYCWPIFJ-ACJLOTCBSA-N 1 2 301.434 4.378 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(Cl)cc1Cl)CO2 ZINC000545928490 341146719 /nfs/dbraw/zinc/14/67/19/341146719.db2.gz MIKIHPUVKVNIIE-AWEZNQCLSA-N 1 2 312.171 4.356 20 0 DIADLO CCn1ccnc1CNc1[nH+]cccc1O[C@H](C)c1ccccc1 ZINC000545927228 341146740 /nfs/dbraw/zinc/14/67/40/341146740.db2.gz RZLZRCQZLQFOJK-OAHLLOKOSA-N 1 2 322.412 4.050 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@@H]2COc3ccc(F)cc32)cs1 ZINC000545986117 341149789 /nfs/dbraw/zinc/14/97/89/341149789.db2.gz JQVMWDKNHMOUBN-GXFFZTMASA-N 1 2 306.406 4.190 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1nc2cc(F)ccc2o1 ZINC000133006582 341151713 /nfs/dbraw/zinc/15/17/13/341151713.db2.gz MADBPHBNSOGUES-NSHDSACASA-N 1 2 302.324 4.299 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1nc2cc(F)ccc2o1 ZINC000133006582 341151714 /nfs/dbraw/zinc/15/17/14/341151714.db2.gz MADBPHBNSOGUES-NSHDSACASA-N 1 2 302.324 4.299 20 0 DIADLO CCc1ccc([C@@H](C)Cc2nc(Cc3ccc(C)[nH+]c3)no2)cc1 ZINC000546340652 341164172 /nfs/dbraw/zinc/16/41/72/341164172.db2.gz HJNZUCGPWNTQFO-AWEZNQCLSA-N 1 2 321.424 4.272 20 0 DIADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2nc(C3CCCC3)no2)c1 ZINC000133220106 341164309 /nfs/dbraw/zinc/16/43/09/341164309.db2.gz HDKQTTDPIFHNQF-MRXNPFEDSA-N 1 2 315.392 4.203 20 0 DIADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2nc(C3CCCC3)no2)c1 ZINC000133220106 341164310 /nfs/dbraw/zinc/16/43/10/341164310.db2.gz HDKQTTDPIFHNQF-MRXNPFEDSA-N 1 2 315.392 4.203 20 0 DIADLO Cc1ccc(Cc2noc(-c3ccc(C(C)(C)C)s3)n2)c[nH+]1 ZINC000546346597 341164559 /nfs/dbraw/zinc/16/45/59/341164559.db2.gz MYHKFDUVURXCGL-UHFFFAOYSA-N 1 2 313.426 4.390 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc(CCC2CCCC2)n1 ZINC000546597122 341173956 /nfs/dbraw/zinc/17/39/56/341173956.db2.gz DRXVBRQEYSWKKA-UHFFFAOYSA-N 1 2 324.428 4.093 20 0 DIADLO CCCCOc1ccccc1CN[C@@H]1C[N@H+](C)Cc2ccccc21 ZINC000546626830 341175811 /nfs/dbraw/zinc/17/58/11/341175811.db2.gz YBUSIRZFALHIGT-HXUWFJFHSA-N 1 2 324.468 4.142 20 0 DIADLO CCCCOc1ccccc1CN[C@@H]1C[N@@H+](C)Cc2ccccc21 ZINC000546626830 341175812 /nfs/dbraw/zinc/17/58/12/341175812.db2.gz YBUSIRZFALHIGT-HXUWFJFHSA-N 1 2 324.468 4.142 20 0 DIADLO C[C@H](c1nc(-c2cccs2)no1)[N@H+](C)Cc1ccc(F)cc1 ZINC000075608466 341179520 /nfs/dbraw/zinc/17/95/20/341179520.db2.gz BTNPVYFELJLFEE-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO C[C@H](c1nc(-c2cccs2)no1)[N@@H+](C)Cc1ccc(F)cc1 ZINC000075608466 341179521 /nfs/dbraw/zinc/17/95/21/341179521.db2.gz BTNPVYFELJLFEE-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO CCn1nc(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)c2ccccc21 ZINC000546728430 341180607 /nfs/dbraw/zinc/18/06/07/341180607.db2.gz WYMQWEZHQMKODS-CJNGLKHVSA-N 1 2 309.413 4.062 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2nc3ccccc3o2)[C@H](C)CO1 ZINC000075784571 341182697 /nfs/dbraw/zinc/18/26/97/341182697.db2.gz LOHFTMOALMRVRZ-BEFAXECRSA-N 1 2 322.408 4.098 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2nc3ccccc3o2)[C@H](C)CO1 ZINC000075784571 341182698 /nfs/dbraw/zinc/18/26/98/341182698.db2.gz LOHFTMOALMRVRZ-BEFAXECRSA-N 1 2 322.408 4.098 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2nc(C(C)(C)C)no2)C1 ZINC000075842984 341185946 /nfs/dbraw/zinc/18/59/46/341185946.db2.gz JSKHVJAEMYBDLW-IUODEOHRSA-N 1 2 317.408 4.089 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2nc(C(C)(C)C)no2)C1 ZINC000075842984 341185947 /nfs/dbraw/zinc/18/59/47/341185947.db2.gz JSKHVJAEMYBDLW-IUODEOHRSA-N 1 2 317.408 4.089 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)Cc2cc(C)cc(C)c2)cs1 ZINC000075887848 341188274 /nfs/dbraw/zinc/18/82/74/341188274.db2.gz SNELYQRISFPYNI-OAHLLOKOSA-N 1 2 318.486 4.489 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)Cc2cc(C)cc(C)c2)cs1 ZINC000075887848 341188275 /nfs/dbraw/zinc/18/82/75/341188275.db2.gz SNELYQRISFPYNI-OAHLLOKOSA-N 1 2 318.486 4.489 20 0 DIADLO Cc1cc(C)cc(/C=C\c2nc(Cc3ccc(C)[nH+]c3)no2)c1 ZINC000547046969 341193502 /nfs/dbraw/zinc/19/35/02/341193502.db2.gz COVNIDOHZYWJQI-SREVYHEPSA-N 1 2 305.381 4.151 20 0 DIADLO Cc1[nH+]c2ccccc2n1Cc1nc([C@@H]2CCC[C@H](C)C2)no1 ZINC000547061004 341194119 /nfs/dbraw/zinc/19/41/19/341194119.db2.gz WBQHBGSQVSURDG-GXTWGEPZSA-N 1 2 310.401 4.070 20 0 DIADLO Cc1ccc(-c2noc([C@H](C)C(C)(C)C)n2)c(N2CCCC2)[nH+]1 ZINC000547076167 341194776 /nfs/dbraw/zinc/19/47/76/341194776.db2.gz BGPNGZJOSILLLX-ZDUSSCGKSA-N 1 2 314.433 4.190 20 0 DIADLO Cc1ccc(-c2nc(-c3ccc(C)[nH+]c3N3CCCC3)no2)cc1 ZINC000547082105 341194963 /nfs/dbraw/zinc/19/49/63/341194963.db2.gz XWQNWRLJHOHGSV-UHFFFAOYSA-N 1 2 320.396 4.016 20 0 DIADLO Cc1cccn2cc(Cc3noc([C@@H](C)CC4CCCC4)n3)[nH+]c12 ZINC000547089765 341195481 /nfs/dbraw/zinc/19/54/81/341195481.db2.gz CVNFMDYUAFWROC-AWEZNQCLSA-N 1 2 324.428 4.300 20 0 DIADLO Clc1cccc(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)c1 ZINC000547109689 341196267 /nfs/dbraw/zinc/19/62/67/341196267.db2.gz LDSRNHZIDZALLX-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc3ccccc3n2)[C@H](c2ccccc2)CO1 ZINC000076148349 341202972 /nfs/dbraw/zinc/20/29/72/341202972.db2.gz LXMIKARNWYLISI-KKSFZXQISA-N 1 2 318.420 4.197 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc3ccccc3n2)[C@H](c2ccccc2)CO1 ZINC000076148349 341202973 /nfs/dbraw/zinc/20/29/73/341202973.db2.gz LXMIKARNWYLISI-KKSFZXQISA-N 1 2 318.420 4.197 20 0 DIADLO COCCOc1cc(C)ccc1[NH2+][C@@H](C)CCc1ccco1 ZINC000237103232 341207341 /nfs/dbraw/zinc/20/73/41/341207341.db2.gz BOJJLWSBFUSYAP-HNNXBMFYSA-N 1 2 303.402 4.046 20 0 DIADLO COCCOc1cc(C)ccc1[NH2+][C@H](C)CCc1ccco1 ZINC000237103738 341207355 /nfs/dbraw/zinc/20/73/55/341207355.db2.gz BOJJLWSBFUSYAP-OAHLLOKOSA-N 1 2 303.402 4.046 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Br)cc2Cl)CCS1 ZINC000134342225 341213639 /nfs/dbraw/zinc/21/36/39/341213639.db2.gz DCVOHLBQURJDDL-SECBINFHSA-N 1 2 320.683 4.040 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Br)cc2Cl)CCS1 ZINC000134342225 341213640 /nfs/dbraw/zinc/21/36/40/341213640.db2.gz DCVOHLBQURJDDL-SECBINFHSA-N 1 2 320.683 4.040 20 0 DIADLO FC(F)(F)c1ccc([C@@H]2CCCC[N@@H+]2Cc2ccon2)cc1 ZINC000077277214 341222151 /nfs/dbraw/zinc/22/21/51/341222151.db2.gz BACFNUBCXDBFAA-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1ccc([C@@H]2CCCC[N@H+]2Cc2ccon2)cc1 ZINC000077277214 341222152 /nfs/dbraw/zinc/22/21/52/341222152.db2.gz BACFNUBCXDBFAA-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2csc(C3CC3)n2)cc1 ZINC000134874719 341225743 /nfs/dbraw/zinc/22/57/43/341225743.db2.gz CCIXMXGUCVXYAD-INIZCTEOSA-N 1 2 302.418 4.497 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2csc(C3CC3)n2)cc1 ZINC000134874719 341225744 /nfs/dbraw/zinc/22/57/44/341225744.db2.gz CCIXMXGUCVXYAD-INIZCTEOSA-N 1 2 302.418 4.497 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2nc(-c3ccccc3)cs2)s1 ZINC000134910372 341226518 /nfs/dbraw/zinc/22/65/18/341226518.db2.gz LADZAGBIWXBZJU-GFCCVEGCSA-N 1 2 315.467 4.426 20 0 DIADLO c1cc(-c2n[nH]cc2CNc2c[nH+]c3c(c2)CCCC3)cs1 ZINC000547703514 341227674 /nfs/dbraw/zinc/22/76/74/341227674.db2.gz BSQJLPBMXWMIJO-UHFFFAOYSA-N 1 2 310.426 4.024 20 0 DIADLO CC[C@@H](C[N@H+](CC)Cc1nnsc1Cl)c1ccccc1 ZINC000547841831 341236857 /nfs/dbraw/zinc/23/68/57/341236857.db2.gz AMSLVIHNPLQMFC-LBPRGKRZSA-N 1 2 309.866 4.207 20 0 DIADLO CC[C@@H](C[N@@H+](CC)Cc1nnsc1Cl)c1ccccc1 ZINC000547841831 341236858 /nfs/dbraw/zinc/23/68/58/341236858.db2.gz AMSLVIHNPLQMFC-LBPRGKRZSA-N 1 2 309.866 4.207 20 0 DIADLO Cc1cc(NC(=O)c2cncc(-c3ccc(Cl)cc3)c2)cc[nH+]1 ZINC000135508576 341241038 /nfs/dbraw/zinc/24/10/38/341241038.db2.gz WUELCIDDUALMEA-UHFFFAOYSA-N 1 2 323.783 4.358 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2COc2ccccc2)cc[nH+]1 ZINC000078579233 341244327 /nfs/dbraw/zinc/24/43/27/341244327.db2.gz OZWTZSOHEHYORF-UHFFFAOYSA-N 1 2 318.376 4.221 20 0 DIADLO O=C(C[C@H]1CCC[N@H+]1Cc1c(F)cccc1F)c1cccs1 ZINC000548065582 341245463 /nfs/dbraw/zinc/24/54/63/341245463.db2.gz UVZFNHKXAOYRMI-GFCCVEGCSA-N 1 2 321.392 4.264 20 0 DIADLO O=C(C[C@H]1CCC[N@@H+]1Cc1c(F)cccc1F)c1cccs1 ZINC000548065582 341245464 /nfs/dbraw/zinc/24/54/64/341245464.db2.gz UVZFNHKXAOYRMI-GFCCVEGCSA-N 1 2 321.392 4.264 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3csc(C4CC4)n3)CCC2)c(F)c1 ZINC000136130050 341253381 /nfs/dbraw/zinc/25/33/81/341253381.db2.gz VWLUMSDGGAOSPN-UHFFFAOYSA-N 1 2 320.408 4.468 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000548300359 341255080 /nfs/dbraw/zinc/25/50/80/341255080.db2.gz DLYNHDXWDITAGY-SGTLLEGYSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@@H](c1cccc(F)c1)[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000548300359 341255081 /nfs/dbraw/zinc/25/50/81/341255081.db2.gz DLYNHDXWDITAGY-SGTLLEGYSA-N 1 2 321.342 4.238 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1csc2ccccc12 ZINC000079217640 341255525 /nfs/dbraw/zinc/25/55/25/341255525.db2.gz VVUWLOPBMCNSSZ-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C3CC3)no2)cc1 ZINC000079304742 341256383 /nfs/dbraw/zinc/25/63/83/341256383.db2.gz XHEXETYJZUEVNA-STQMWFEESA-N 1 2 315.417 4.146 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C3CC3)no2)cc1 ZINC000079304747 341256404 /nfs/dbraw/zinc/25/64/04/341256404.db2.gz XHEXETYJZUEVNA-QWHCGFSZSA-N 1 2 315.417 4.146 20 0 DIADLO CC(C)(C)c1[nH]c2ccc(NC(=O)CCC(F)(F)F)cc2[nH+]1 ZINC000079379863 341257511 /nfs/dbraw/zinc/25/75/11/341257511.db2.gz IHWMFUYIGOKFKN-UHFFFAOYSA-N 1 2 313.323 4.141 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)C[NH+]2[C@H](C)C[C@H]2C)cc1 ZINC000548425506 341260104 /nfs/dbraw/zinc/26/01/04/341260104.db2.gz NMPSKVFJOFSAEU-HZPDHXFCSA-N 1 2 324.424 4.209 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(F)c(Cl)c1 ZINC000136552037 341261769 /nfs/dbraw/zinc/26/17/69/341261769.db2.gz WKTSQCVRNSYEQH-UHFFFAOYSA-N 1 2 315.735 4.122 20 0 DIADLO CCc1ccccc1NC(=O)C[N@H+](C)Cc1cc2ccccc2o1 ZINC000080069194 341269206 /nfs/dbraw/zinc/26/92/06/341269206.db2.gz PMVKLKSACLCKKL-UHFFFAOYSA-N 1 2 322.408 4.066 20 0 DIADLO CCc1ccccc1NC(=O)C[N@@H+](C)Cc1cc2ccccc2o1 ZINC000080069194 341269207 /nfs/dbraw/zinc/26/92/07/341269207.db2.gz PMVKLKSACLCKKL-UHFFFAOYSA-N 1 2 322.408 4.066 20 0 DIADLO Cc1cc[nH+]cc1NCc1ccc(Cl)c(Br)c1 ZINC000137125268 341272915 /nfs/dbraw/zinc/27/29/15/341272915.db2.gz XYILHQWHLJEHOA-UHFFFAOYSA-N 1 2 311.610 4.418 20 0 DIADLO c1cc(N[C@@H]2CCC23CCOCC3)cc([NH+]2CCCCCC2)c1 ZINC000548793593 341275945 /nfs/dbraw/zinc/27/59/45/341275945.db2.gz LARBLDZMCDLGRP-LJQANCHMSA-N 1 2 314.473 4.438 20 0 DIADLO CCc1nc(C[N@H+](C)C[C@H](OC)c2ccc(Cl)cc2)cs1 ZINC000548910743 341280675 /nfs/dbraw/zinc/28/06/75/341280675.db2.gz LBFFXXPPBZOABS-HNNXBMFYSA-N 1 2 324.877 4.178 20 0 DIADLO CCc1nc(C[N@@H+](C)C[C@H](OC)c2ccc(Cl)cc2)cs1 ZINC000548910743 341280676 /nfs/dbraw/zinc/28/06/76/341280676.db2.gz LBFFXXPPBZOABS-HNNXBMFYSA-N 1 2 324.877 4.178 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccccc2OC(C)C)s1 ZINC000548916921 341280887 /nfs/dbraw/zinc/28/08/87/341280887.db2.gz ODDBMTCEOPOGDD-NEPJUHHUSA-N 1 2 305.447 4.046 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@@H+](C[C@@H]2CCC3(CCCC3)O2)C1 ZINC000548921382 341281162 /nfs/dbraw/zinc/28/11/62/341281162.db2.gz CLWDXIXKYUTYFB-HNNXBMFYSA-N 1 2 310.441 4.018 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@H+](C[C@@H]2CCC3(CCCC3)O2)C1 ZINC000548921382 341281163 /nfs/dbraw/zinc/28/11/63/341281163.db2.gz CLWDXIXKYUTYFB-HNNXBMFYSA-N 1 2 310.441 4.018 20 0 DIADLO CCc1noc(C)c1C[N@@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000548938696 341281917 /nfs/dbraw/zinc/28/19/17/341281917.db2.gz CAGKKAUOHMWCMR-KRWDZBQOSA-N 1 2 322.811 4.270 20 0 DIADLO CCc1noc(C)c1C[N@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000548938696 341281918 /nfs/dbraw/zinc/28/19/18/341281918.db2.gz CAGKKAUOHMWCMR-KRWDZBQOSA-N 1 2 322.811 4.270 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000548941551 341281925 /nfs/dbraw/zinc/28/19/25/341281925.db2.gz XUTRGTWLQCIBKA-CXAGYDPISA-N 1 2 304.796 4.367 20 0 DIADLO C[C@H](c1cccnc1)[N@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000548941551 341281926 /nfs/dbraw/zinc/28/19/26/341281926.db2.gz XUTRGTWLQCIBKA-CXAGYDPISA-N 1 2 304.796 4.367 20 0 DIADLO Cc1ccncc1C[N@@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000548944520 341282003 /nfs/dbraw/zinc/28/20/03/341282003.db2.gz XWCDIGGKMNSUCU-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccncc1C[N@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000548944520 341282004 /nfs/dbraw/zinc/28/20/04/341282004.db2.gz XWCDIGGKMNSUCU-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO CCc1cc(N2CC(C3CCCCC3)C2)nc(-c2ccncc2)[nH+]1 ZINC000549265852 341289930 /nfs/dbraw/zinc/28/99/30/341289930.db2.gz AFBDMMNVZBPCHI-UHFFFAOYSA-N 1 2 322.456 4.118 20 0 DIADLO Cc1csc(C[N@@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)n1 ZINC000245410473 341291851 /nfs/dbraw/zinc/29/18/51/341291851.db2.gz REFLUKVBVAZVCS-IAQYHMDHSA-N 1 2 302.443 4.333 20 0 DIADLO Cc1csc(C[N@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)n1 ZINC000245410473 341291852 /nfs/dbraw/zinc/29/18/52/341291852.db2.gz REFLUKVBVAZVCS-IAQYHMDHSA-N 1 2 302.443 4.333 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+](C)Cc1ccc(F)cc1F ZINC000549367010 341292532 /nfs/dbraw/zinc/29/25/32/341292532.db2.gz UKSWUNQHZVSKEU-UHFFFAOYSA-N 1 2 304.384 4.424 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+](C)Cc1ccc(F)cc1F ZINC000549367010 341292533 /nfs/dbraw/zinc/29/25/33/341292533.db2.gz UKSWUNQHZVSKEU-UHFFFAOYSA-N 1 2 304.384 4.424 20 0 DIADLO CCc1nc(C(C)C)ccc1C[N@@H+]1CCOC[C@H]1c1ccccc1 ZINC000549464277 341295251 /nfs/dbraw/zinc/29/52/51/341295251.db2.gz SISVQIIQNXXBON-NRFANRHFSA-N 1 2 324.468 4.341 20 0 DIADLO CCc1nc(C(C)C)ccc1C[N@H+]1CCOC[C@H]1c1ccccc1 ZINC000549464277 341295252 /nfs/dbraw/zinc/29/52/52/341295252.db2.gz SISVQIIQNXXBON-NRFANRHFSA-N 1 2 324.468 4.341 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000245465595 341295515 /nfs/dbraw/zinc/29/55/15/341295515.db2.gz ITAOGFYQBHZTPA-GHMZBOCLSA-N 1 2 304.356 4.307 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000245465595 341295516 /nfs/dbraw/zinc/29/55/16/341295516.db2.gz ITAOGFYQBHZTPA-GHMZBOCLSA-N 1 2 304.356 4.307 20 0 DIADLO Cc1cc(Cl)cc(C[NH2+][C@@H](c2nc(C3CC3)no2)C(C)C)c1 ZINC000549754596 341302276 /nfs/dbraw/zinc/30/22/76/341302276.db2.gz FDNWVEKZLUZDQT-OAHLLOKOSA-N 1 2 319.836 4.396 20 0 DIADLO Cc1sccc1C[NH2+][C@@H](CO)c1c(Cl)cccc1Cl ZINC000549817320 341304119 /nfs/dbraw/zinc/30/41/19/341304119.db2.gz KHHXKMVHWDCLLI-ZDUSSCGKSA-N 1 2 316.253 4.187 20 0 DIADLO COCc1ccc(C[N@@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)o1 ZINC000549821563 341304197 /nfs/dbraw/zinc/30/41/97/341304197.db2.gz BTJMMKJSWJDWSL-QGZVFWFLSA-N 1 2 323.795 4.150 20 0 DIADLO COCc1ccc(C[N@H+]2CC[C@](F)(c3cccc(Cl)c3)C2)o1 ZINC000549821563 341304198 /nfs/dbraw/zinc/30/41/98/341304198.db2.gz BTJMMKJSWJDWSL-QGZVFWFLSA-N 1 2 323.795 4.150 20 0 DIADLO COCc1ccc(C[N@@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)o1 ZINC000549821561 341304238 /nfs/dbraw/zinc/30/42/38/341304238.db2.gz BTJMMKJSWJDWSL-KRWDZBQOSA-N 1 2 323.795 4.150 20 0 DIADLO COCc1ccc(C[N@H+]2CC[C@@](F)(c3cccc(Cl)c3)C2)o1 ZINC000549821561 341304239 /nfs/dbraw/zinc/30/42/39/341304239.db2.gz BTJMMKJSWJDWSL-KRWDZBQOSA-N 1 2 323.795 4.150 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)[C@H]1C ZINC000549924331 341306912 /nfs/dbraw/zinc/30/69/12/341306912.db2.gz WQRUNRBIUGCJBF-NEPJUHHUSA-N 1 2 306.862 4.228 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)[C@H]1C ZINC000549924331 341306913 /nfs/dbraw/zinc/30/69/13/341306913.db2.gz WQRUNRBIUGCJBF-NEPJUHHUSA-N 1 2 306.862 4.228 20 0 DIADLO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+]1CCC[C@@H]1CF ZINC000550008283 341308750 /nfs/dbraw/zinc/30/87/50/341308750.db2.gz MRVKGDOWLXCQEX-SMDDNHRTSA-N 1 2 308.784 4.490 20 0 DIADLO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1CCC[C@@H]1CF ZINC000550008283 341308751 /nfs/dbraw/zinc/30/87/51/341308751.db2.gz MRVKGDOWLXCQEX-SMDDNHRTSA-N 1 2 308.784 4.490 20 0 DIADLO Cc1cccn2cc(COc3cccc(C(F)(F)F)c3)[nH+]c12 ZINC000550149420 341311117 /nfs/dbraw/zinc/31/11/17/341311117.db2.gz OKJJFCMXBJZUEB-UHFFFAOYSA-N 1 2 306.287 4.241 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)n1 ZINC000245831791 341315638 /nfs/dbraw/zinc/31/56/38/341315638.db2.gz BURCSPMMVGTCNM-JDSLSITLSA-N 1 2 319.836 4.162 20 0 DIADLO Cc1ccc(Nc2nc(C[N@@H+]3CCC[C@@H]3CF)cs2)cc1 ZINC000550410376 341316546 /nfs/dbraw/zinc/31/65/46/341316546.db2.gz SQFSBBZDSHARNB-OAHLLOKOSA-N 1 2 305.422 4.129 20 0 DIADLO Cc1ccc(Nc2nc(C[N@H+]3CCC[C@@H]3CF)cs2)cc1 ZINC000550410376 341316547 /nfs/dbraw/zinc/31/65/47/341316547.db2.gz SQFSBBZDSHARNB-OAHLLOKOSA-N 1 2 305.422 4.129 20 0 DIADLO Clc1ccccc1CC[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000550525501 341318220 /nfs/dbraw/zinc/31/82/20/341318220.db2.gz KXQFJUQYRVJLDQ-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1ccccc1CC[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000550525501 341318221 /nfs/dbraw/zinc/31/82/21/341318221.db2.gz KXQFJUQYRVJLDQ-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO CC(F)(F)C[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000551255295 341335631 /nfs/dbraw/zinc/33/56/31/341335631.db2.gz PARLHVIEIPPVQX-OAHLLOKOSA-N 1 2 310.775 4.264 20 0 DIADLO CCCc1cc(=O)[nH]c(C(=Cc2cn3cc(C)ccc3[nH+]2)CC)n1 ZINC000551348439 341339192 /nfs/dbraw/zinc/33/91/92/341339192.db2.gz KAPZZDCQYOZMPE-NTEUORMPSA-N 1 2 322.412 4.041 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc2ncsc2c1 ZINC000564382007 341349544 /nfs/dbraw/zinc/34/95/44/341349544.db2.gz VXNYWNXGAHMPGN-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc2ncsc2c1 ZINC000564382006 341349658 /nfs/dbraw/zinc/34/96/58/341349658.db2.gz VXNYWNXGAHMPGN-LLVKDONJSA-N 1 2 315.442 4.433 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@@H](C)CCC(C)(C)C)c2ccccc2F)no1 ZINC000551788231 341351420 /nfs/dbraw/zinc/35/14/20/341351420.db2.gz ACPZATPJXCURMM-LRDDRELGSA-N 1 2 319.424 4.411 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@H](C)CCC(C)(C)C)c2ccccc2F)no1 ZINC000551788233 341351466 /nfs/dbraw/zinc/35/14/66/341351466.db2.gz ACPZATPJXCURMM-WBMJQRKESA-N 1 2 319.424 4.411 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cc1cnc(C(C)(C)C)nc1 ZINC000551807667 341352451 /nfs/dbraw/zinc/35/24/51/341352451.db2.gz LOEIWTKZZRAXCV-UHFFFAOYSA-N 1 2 309.866 4.121 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1cnc(C(C)(C)C)nc1 ZINC000551807667 341352452 /nfs/dbraw/zinc/35/24/52/341352452.db2.gz LOEIWTKZZRAXCV-UHFFFAOYSA-N 1 2 309.866 4.121 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2ccccc2F)o1)c1cscn1 ZINC000551917681 341354908 /nfs/dbraw/zinc/35/49/08/341354908.db2.gz UJWZBRJYVOBWSV-NSHDSACASA-N 1 2 302.374 4.393 20 0 DIADLO Cc1ccc(-c2cc(C[N@@H+]3CCCC[C@H]3c3cc[nH]n3)on2)cc1 ZINC000551980716 341356710 /nfs/dbraw/zinc/35/67/10/341356710.db2.gz LVMRQEMFYUCUBW-IBGZPJMESA-N 1 2 322.412 4.100 20 0 DIADLO Cc1ccc(-c2cc(C[N@H+]3CCCC[C@H]3c3cc[nH]n3)on2)cc1 ZINC000551980716 341356711 /nfs/dbraw/zinc/35/67/11/341356711.db2.gz LVMRQEMFYUCUBW-IBGZPJMESA-N 1 2 322.412 4.100 20 0 DIADLO C[C@@H]([NH2+][C@H]1CC2(CCC2)Oc2ccccc21)c1cscn1 ZINC000552002267 341359038 /nfs/dbraw/zinc/35/90/38/341359038.db2.gz XVQDQQXWLAILOK-OCCSQVGLSA-N 1 2 300.427 4.240 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+]1CCO[C@@H](c2cccc(O)c2)C1 ZINC000247197067 341362109 /nfs/dbraw/zinc/36/21/09/341362109.db2.gz UTUNFFZFUNXTDJ-SCLBCKFNSA-N 1 2 317.816 4.180 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+]1CCO[C@@H](c2cccc(O)c2)C1 ZINC000247197067 341362110 /nfs/dbraw/zinc/36/21/10/341362110.db2.gz UTUNFFZFUNXTDJ-SCLBCKFNSA-N 1 2 317.816 4.180 20 0 DIADLO CC[N@H+](Cc1ncc(CSC)s1)Cc1ccc(C)cc1 ZINC000552022966 341362358 /nfs/dbraw/zinc/36/23/58/341362358.db2.gz FLNAQKBRIKEBSP-UHFFFAOYSA-N 1 2 306.500 4.337 20 0 DIADLO CC[N@@H+](Cc1ncc(CSC)s1)Cc1ccc(C)cc1 ZINC000552022966 341362359 /nfs/dbraw/zinc/36/23/59/341362359.db2.gz FLNAQKBRIKEBSP-UHFFFAOYSA-N 1 2 306.500 4.337 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](Cc2nc3ccccc3o2)[C@@H](C)CO1 ZINC000247499256 341365918 /nfs/dbraw/zinc/36/59/18/341365918.db2.gz LOHFTMOALMRVRZ-HNAYVOBHSA-N 1 2 322.408 4.098 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2nc3ccccc3o2)[C@@H](C)CO1 ZINC000247499256 341365919 /nfs/dbraw/zinc/36/59/19/341365919.db2.gz LOHFTMOALMRVRZ-HNAYVOBHSA-N 1 2 322.408 4.098 20 0 DIADLO Cc1nc([C@H]([NH2+][C@H]2CC[C@H]2C(C)C)c2ccc(Cl)cc2)no1 ZINC000552070896 341367370 /nfs/dbraw/zinc/36/73/70/341367370.db2.gz IHKFZKHVEWWKIX-HRCADAONSA-N 1 2 319.836 4.145 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247659737 341368296 /nfs/dbraw/zinc/36/82/96/341368296.db2.gz XJZAYPOVBWDYQU-IAQYHMDHSA-N 1 2 309.381 4.161 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247659737 341368297 /nfs/dbraw/zinc/36/82/97/341368297.db2.gz XJZAYPOVBWDYQU-IAQYHMDHSA-N 1 2 309.381 4.161 20 0 DIADLO CC[N@H+](CCCNC(=O)C[C@H](C)c1ccccc1)c1ccccc1 ZINC000248151992 341374007 /nfs/dbraw/zinc/37/40/07/341374007.db2.gz AAURBBDRHBSWAT-SFHVURJKSA-N 1 2 324.468 4.213 20 0 DIADLO CC[N@@H+](CCCNC(=O)C[C@H](C)c1ccccc1)c1ccccc1 ZINC000248151992 341374008 /nfs/dbraw/zinc/37/40/08/341374008.db2.gz AAURBBDRHBSWAT-SFHVURJKSA-N 1 2 324.468 4.213 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1csc([C@H](C)OC)n1 ZINC000248640677 341382573 /nfs/dbraw/zinc/38/25/73/341382573.db2.gz YCSSLADYUOKMBW-SUMWQHHRSA-N 1 2 316.470 4.187 20 0 DIADLO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1csc([C@H](C)OC)n1 ZINC000248640677 341382574 /nfs/dbraw/zinc/38/25/74/341382574.db2.gz YCSSLADYUOKMBW-SUMWQHHRSA-N 1 2 316.470 4.187 20 0 DIADLO c1cc([C@@H]2C[N@H+](C[C@H]3CCC4(CCCCC4)O3)CCO2)cs1 ZINC000248811071 341387397 /nfs/dbraw/zinc/38/73/97/341387397.db2.gz HSKYVQLICORLCB-SJORKVTESA-N 1 2 321.486 4.003 20 0 DIADLO c1cc([C@@H]2C[N@@H+](C[C@H]3CCC4(CCCCC4)O3)CCO2)cs1 ZINC000248811071 341387398 /nfs/dbraw/zinc/38/73/98/341387398.db2.gz HSKYVQLICORLCB-SJORKVTESA-N 1 2 321.486 4.003 20 0 DIADLO Cc1cncc([C@@H](C)[NH2+]CC(F)(F)c2ccc(Cl)cc2)c1 ZINC000552337417 341387565 /nfs/dbraw/zinc/38/75/65/341387565.db2.gz TVIQLJVRUSMKOA-GFCCVEGCSA-N 1 2 310.775 4.486 20 0 DIADLO c1cn2c(cccc2CNc2ccccc2OC2CCCC2)[nH+]1 ZINC000552368063 341389538 /nfs/dbraw/zinc/38/95/38/341389538.db2.gz FSXJVGODWFMBKH-UHFFFAOYSA-N 1 2 307.397 4.268 20 0 DIADLO Cc1ccc(-c2ccc(C(=O)N[C@H](C)c3[nH]cc[nH+]3)c(F)c2)cc1 ZINC000552558457 341398729 /nfs/dbraw/zinc/39/87/29/341398729.db2.gz DBZRRBLQQRNMQW-CYBMUJFWSA-N 1 2 323.371 4.015 20 0 DIADLO Cc1cscc1C(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000089869020 341410197 /nfs/dbraw/zinc/41/01/97/341410197.db2.gz AQLCMTGGRCHWAU-UHFFFAOYSA-N 1 2 311.410 4.073 20 0 DIADLO CCOC[C@@H]1CCCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000553096244 341415747 /nfs/dbraw/zinc/41/57/47/341415747.db2.gz FLWIKNJQPNBLTN-CYBMUJFWSA-N 1 2 304.821 4.141 20 0 DIADLO Clc1cccc2c(N3CCC[C@]4(CCCOC4)C3)cc[nH+]c12 ZINC000553155108 341418066 /nfs/dbraw/zinc/41/80/66/341418066.db2.gz YFVJHOCXNQIYBH-SFHVURJKSA-N 1 2 316.832 4.285 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](c1ccccc1)C(F)(F)F ZINC000554387796 341452896 /nfs/dbraw/zinc/45/28/96/341452896.db2.gz JBSTYHNFDIAAPM-AWEZNQCLSA-N 1 2 323.318 4.124 20 0 DIADLO CCc1ccc(C2=CCN(C(=O)Nc3cc[nH+]cc3C)CC2)cc1 ZINC000093401884 341471671 /nfs/dbraw/zinc/47/16/71/341471671.db2.gz ZGRNBIPSLMSMTQ-UHFFFAOYSA-N 1 2 321.424 4.274 20 0 DIADLO Cn1c2ccc(NC(=O)C3=CCCCCC3)cc2[nH+]c1C1CC1 ZINC000555622588 341487480 /nfs/dbraw/zinc/48/74/80/341487480.db2.gz LOTJCZMVIXWCFL-UHFFFAOYSA-N 1 2 309.413 4.280 20 0 DIADLO CCCC(=O)Nc1cccc(C[NH2+][C@H](C)c2csc(C)n2)c1 ZINC000564658052 341506298 /nfs/dbraw/zinc/50/62/98/341506298.db2.gz ODBZKYDNENSSKV-GFCCVEGCSA-N 1 2 317.458 4.041 20 0 DIADLO Cc1ccccc1NC(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000152988538 341515740 /nfs/dbraw/zinc/51/57/40/341515740.db2.gz NOBITVLZVYVENK-UHFFFAOYSA-N 1 2 320.396 4.403 20 0 DIADLO CC(C)n1ccnc1SCCCc1[nH]c2ccccc2[nH+]1 ZINC000565070739 341516383 /nfs/dbraw/zinc/51/63/83/341516383.db2.gz PNLBXMAPRQQSFI-UHFFFAOYSA-N 1 2 300.431 4.065 20 0 DIADLO Cc1ccc(C)c([C@@H](C)N(C)C(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC000565278017 341522166 /nfs/dbraw/zinc/52/21/66/341522166.db2.gz WVLKHJFDRDYBAX-OAHLLOKOSA-N 1 2 322.412 4.176 20 0 DIADLO CC[C@@H]1CCCN(c2cc(COC)[nH+]c3ccc(F)cc32)C1 ZINC000565394556 341526114 /nfs/dbraw/zinc/52/61/14/341526114.db2.gz JSSAARIHIKNDKO-CYBMUJFWSA-N 1 2 302.393 4.147 20 0 DIADLO Cc1cccc(CCSCc2ccn(C3CCCC3)n2)[nH+]1 ZINC000565658542 341534371 /nfs/dbraw/zinc/53/43/71/341534371.db2.gz PZXGWMVKMANLMA-UHFFFAOYSA-N 1 2 301.459 4.178 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)N(C)CCC)c1 ZINC000153389570 341537686 /nfs/dbraw/zinc/53/76/86/341537686.db2.gz PCGQBQQSYVFJAN-UHFFFAOYSA-N 1 2 314.433 4.224 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)N(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000566149082 341549053 /nfs/dbraw/zinc/54/90/53/341549053.db2.gz HKCMPDRWGCSXBD-UGSOOPFHSA-N 1 2 307.372 4.356 20 0 DIADLO Cc1ccc(-c2ccc(C)c(NC(=O)C[C@@H](C)n3cc[nH+]c3)c2)o1 ZINC000566304609 341553332 /nfs/dbraw/zinc/55/33/32/341553332.db2.gz PMFOOFVZQBKQTK-CQSZACIVSA-N 1 2 323.396 4.350 20 0 DIADLO C[C@H](CC(=O)Nc1cccc(C(F)F)c1Cl)n1cc[nH+]c1 ZINC000566303709 341553394 /nfs/dbraw/zinc/55/33/94/341553394.db2.gz FZFDJSRBPUEPOO-SECBINFHSA-N 1 2 313.735 4.064 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccn(-c2ccccc2)n1 ZINC000163182722 341553880 /nfs/dbraw/zinc/55/38/80/341553880.db2.gz HGUITCVDEJTBQC-MRXNPFEDSA-N 1 2 321.424 4.040 20 0 DIADLO Cc1[nH]c(CNc2cc(F)ccc2SCC(F)F)[nH+]c1C ZINC000566497233 341560114 /nfs/dbraw/zinc/56/01/14/341560114.db2.gz VCBBBZYPOORWMM-UHFFFAOYSA-N 1 2 315.364 4.135 20 0 DIADLO CC(C)c1nc(N[C@@H](C)c2cccc(N3CCCC3)c2)cc[nH+]1 ZINC000154051891 341583851 /nfs/dbraw/zinc/58/38/51/341583851.db2.gz MXPXARPTRNZNKX-HNNXBMFYSA-N 1 2 310.445 4.373 20 0 DIADLO CC[C@@H](C)n1ncc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1C ZINC000567245557 341591041 /nfs/dbraw/zinc/59/10/41/341591041.db2.gz MUFLDIBBYOYNMS-CXAGYDPISA-N 1 2 309.417 4.087 20 0 DIADLO CCCCN(C(=O)C[C@H](C)n1cc[nH+]c1)[C@@H]1CCC[C@@H](C)C1 ZINC000567593211 341618967 /nfs/dbraw/zinc/61/89/67/341618967.db2.gz UKLIUZPGNWHFQM-IXDOHACOSA-N 1 2 305.466 4.042 20 0 DIADLO CCCCN(C(=O)C[C@H](C)n1cc[nH+]c1)[C@H]1CCC[C@H](C)C1 ZINC000567593212 341618994 /nfs/dbraw/zinc/61/89/94/341618994.db2.gz UKLIUZPGNWHFQM-ULQDDVLXSA-N 1 2 305.466 4.042 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2c(Cl)cccc2Cl)s1 ZINC000273618934 341636693 /nfs/dbraw/zinc/63/66/93/341636693.db2.gz QCIFITOSHUNKAD-ZETCQYMHSA-N 1 2 302.230 4.004 20 0 DIADLO Cc1ccc(-c2noc(C3CC4(CCC4)C3)n2)c(N2CCCC2)[nH+]1 ZINC000567854632 341637040 /nfs/dbraw/zinc/63/70/40/341637040.db2.gz RGLIRGZMXZZEGC-UHFFFAOYSA-N 1 2 324.428 4.088 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2sc(C(C)(C)C)nc2C)s1 ZINC000274263699 341642149 /nfs/dbraw/zinc/64/21/49/341642149.db2.gz VIFVHOMLIGYRMU-WCBMZHEXSA-N 1 2 324.519 4.321 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)c3ccc(Cl)cc3C)ccc2n1C ZINC000165396821 341711691 /nfs/dbraw/zinc/71/16/91/341711691.db2.gz JCXYSTGNPNDKOW-UHFFFAOYSA-N 1 2 313.788 4.096 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2ccc(Cl)o2)c2ccco2)cc1 ZINC000574604221 341763515 /nfs/dbraw/zinc/76/35/15/341763515.db2.gz JDTJCZWQHHBRDU-KRWDZBQOSA-N 1 2 317.772 4.414 20 0 DIADLO Clc1ccc(-c2ccc(C[NH2+]Cc3cc[nH]n3)o2)cc1Cl ZINC000174366174 341826225 /nfs/dbraw/zinc/82/62/25/341826225.db2.gz FKNWDDZNWSZRQK-UHFFFAOYSA-N 1 2 322.195 4.266 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)s1 ZINC000343624143 341849606 /nfs/dbraw/zinc/84/96/06/341849606.db2.gz YIKFHIQHHVEGNW-MRVPVSSYSA-N 1 2 316.257 4.258 20 0 DIADLO CC[C@H](C)Oc1cccc(NCc2ccc(N(C)CC)[nH+]c2)c1 ZINC000576593400 341854230 /nfs/dbraw/zinc/85/42/30/341854230.db2.gz KBVIOABWEJAZFO-HNNXBMFYSA-N 1 2 313.445 4.327 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)c1cccc(C2CC2)c1 ZINC000577123830 341887957 /nfs/dbraw/zinc/88/79/57/341887957.db2.gz XTJIFEWXKSZGMG-GOSISDBHSA-N 1 2 323.440 4.148 20 0 DIADLO COC[C@@H]([NH2+]Cc1ccc(-c2ccccc2)o1)c1ccc(C)o1 ZINC000177565334 341921249 /nfs/dbraw/zinc/92/12/49/341921249.db2.gz HFULAXRFCOKMQE-QGZVFWFLSA-N 1 2 311.381 4.325 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(Oc2ccccc2)cc1)n1cc[nH+]c1 ZINC000577778950 341936389 /nfs/dbraw/zinc/93/63/89/341936389.db2.gz KPKRGWROCJYNBU-OAHLLOKOSA-N 1 2 321.380 4.265 20 0 DIADLO CCCc1csc(C[NH2+][C@H](COC)c2cccc(Cl)c2)n1 ZINC000568808213 517620022 /nfs/dbraw/zinc/62/00/22/517620022.db2.gz NVESBIKNIDRXCT-OAHLLOKOSA-N 1 2 324.877 4.226 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2c1cc(Cl)cc2Cl)c1csnn1 ZINC000412036500 518178579 /nfs/dbraw/zinc/17/85/79/518178579.db2.gz IHCJSEBEVPGDJH-KRTXAFLBSA-N 1 2 314.241 4.183 20 0 DIADLO CC(C)[N@@H+](Cc1csc(-c2ccccn2)n1)Cc1ccco1 ZINC000264927064 519662793 /nfs/dbraw/zinc/66/27/93/519662793.db2.gz MEYPLLNQHQRJTQ-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)[N@H+](Cc1csc(-c2ccccn2)n1)Cc1ccco1 ZINC000264927064 519662796 /nfs/dbraw/zinc/66/27/96/519662796.db2.gz MEYPLLNQHQRJTQ-UHFFFAOYSA-N 1 2 313.426 4.209 20 0 DIADLO CC(C)CN(C)C(=O)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000265115910 519708665 /nfs/dbraw/zinc/70/86/65/519708665.db2.gz YZBTUGBWWVSFSU-UHFFFAOYSA-N 1 2 318.804 4.255 20 0 DIADLO CC(=O)Nc1cccc(C[NH+](Cc2ccco2)Cc2ccco2)c1 ZINC000101543575 519738456 /nfs/dbraw/zinc/73/84/56/519738456.db2.gz PMULXWJXXWSLEA-UHFFFAOYSA-N 1 2 324.380 4.033 20 0 DIADLO CC(C)c1nc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)no1 ZINC000182579324 519864345 /nfs/dbraw/zinc/86/43/45/519864345.db2.gz XSURBTHIDZFEMG-INIZCTEOSA-N 1 2 319.836 4.477 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)o1 ZINC000182448244 519887771 /nfs/dbraw/zinc/88/77/71/519887771.db2.gz JGOQDMDBXKDWES-JTQLQIEISA-N 1 2 313.323 4.063 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)o1 ZINC000180017970 519887850 /nfs/dbraw/zinc/88/78/50/519887850.db2.gz DWTCTGBCWQADRY-SGIREYDYSA-N 1 2 319.836 4.333 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)o1 ZINC000181619120 519888086 /nfs/dbraw/zinc/88/80/86/519888086.db2.gz INJLYQGPCKRKAE-HNNXBMFYSA-N 1 2 323.387 4.348 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)o1 ZINC000180297310 519888104 /nfs/dbraw/zinc/88/81/04/519888104.db2.gz YZLHPVPHOWRXOJ-QGZVFWFLSA-N 1 2 317.408 4.353 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@H+](C)Cc2ccc(Cl)c(F)c2)n1 ZINC000127694875 519907317 /nfs/dbraw/zinc/90/73/17/519907317.db2.gz IVARPVWHWYFYRY-SNVBAGLBSA-N 1 2 311.788 4.179 20 0 DIADLO CC(C)c1noc([C@@H](C)[N@@H+](C)Cc2ccc(Cl)c(F)c2)n1 ZINC000127694875 519907320 /nfs/dbraw/zinc/90/73/20/519907320.db2.gz IVARPVWHWYFYRY-SNVBAGLBSA-N 1 2 311.788 4.179 20 0 DIADLO CC(C)n1cc[nH+]c1CN1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000338368499 520031054 /nfs/dbraw/zinc/03/10/54/520031054.db2.gz DIIDUZOXEJZIJB-QGZVFWFLSA-N 1 2 321.827 4.188 20 0 DIADLO CC(C)n1cc[nH+]c1CNc1ccc(F)c(C(F)(F)F)c1 ZINC000124261974 520033825 /nfs/dbraw/zinc/03/38/25/520033825.db2.gz QGESDZPFDQCOSP-UHFFFAOYSA-N 1 2 301.287 4.234 20 0 DIADLO CCCCCC[C@H](C)NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000106515782 520129259 /nfs/dbraw/zinc/12/92/59/520129259.db2.gz URPVSTDBRCUWHP-LSDHHAIUSA-N 1 2 306.454 4.005 20 0 DIADLO CCCOc1ccc(C[NH2+][C@@H](C)c2csc(C(C)C)n2)cn1 ZINC000186329325 520372807 /nfs/dbraw/zinc/37/28/07/520372807.db2.gz OQZKKEGQWXJDAM-ZDUSSCGKSA-N 1 2 319.474 4.301 20 0 DIADLO CC1=C(c2ccco2)C[N@H+](Cc2noc(-c3ccccc3)n2)CC1 ZINC000338345098 520847478 /nfs/dbraw/zinc/84/74/78/520847478.db2.gz RHHCFCRKVDXXHP-UHFFFAOYSA-N 1 2 321.380 4.009 20 0 DIADLO CC1=C(c2ccco2)C[N@@H+](Cc2noc(-c3ccccc3)n2)CC1 ZINC000338345098 520847490 /nfs/dbraw/zinc/84/74/90/520847490.db2.gz RHHCFCRKVDXXHP-UHFFFAOYSA-N 1 2 321.380 4.009 20 0 DIADLO CCC[C@H](C)[NH2+]c1ccc(OCc2noc(C3CC3)n2)cc1 ZINC000179853725 521062525 /nfs/dbraw/zinc/06/25/25/521062525.db2.gz JKWCCJDZANWHQY-LBPRGKRZSA-N 1 2 301.390 4.127 20 0 DIADLO CCCC[C@@H]([NH2+]Cc1nc(C(C)C)no1)c1ccc(OC)cc1 ZINC000182143433 521101846 /nfs/dbraw/zinc/10/18/46/521101846.db2.gz UWDCZRCPPSCFOE-MRXNPFEDSA-N 1 2 317.433 4.223 20 0 DIADLO CCC[C@H]([NH2+]Cc1ccn(C(C)C)n1)c1ccc(F)cc1F ZINC000181677480 521165431 /nfs/dbraw/zinc/16/54/31/521165431.db2.gz QUATZCUVXRUGLV-KRWDZBQOSA-N 1 2 307.388 4.373 20 0 DIADLO CCC[C@H]([NH2+]Cc1nc(C(C)C)no1)c1ccc(F)cc1F ZINC000181664239 521165651 /nfs/dbraw/zinc/16/56/51/521165651.db2.gz VWUKAEWKAAIACH-AWEZNQCLSA-N 1 2 309.360 4.102 20 0 DIADLO CCCC[C@H]([NH2+]Cc1nc(CCC)no1)c1ccc(OC)cc1 ZINC000182138011 521241014 /nfs/dbraw/zinc/24/10/14/521241014.db2.gz MCVMYZGLDAYFPN-INIZCTEOSA-N 1 2 317.433 4.052 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)[C@H](C)c1nc(C2CC2)no1 ZINC000132116232 521312060 /nfs/dbraw/zinc/31/20/60/521312060.db2.gz NRSAORPDVYQERR-SECBINFHSA-N 1 2 311.838 4.245 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)[C@H](C)c1nc(C2CC2)no1 ZINC000132116232 521312073 /nfs/dbraw/zinc/31/20/73/521312073.db2.gz NRSAORPDVYQERR-SECBINFHSA-N 1 2 311.838 4.245 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@@H](CC)c2ccc(OC)cc2)n1 ZINC000181823253 521346609 /nfs/dbraw/zinc/34/66/09/521346609.db2.gz WMQIZNQPEPNGGF-CJNGLKHVSA-N 1 2 317.433 4.223 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NCc2conc2C)c1 ZINC000339311497 521392424 /nfs/dbraw/zinc/39/24/24/521392424.db2.gz AKGPRZWASWVIIB-UHFFFAOYSA-N 1 2 310.401 4.259 20 0 DIADLO CCCc1nc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)cs1 ZINC000180856360 521514583 /nfs/dbraw/zinc/51/45/83/521514583.db2.gz VEPOEZYBPTUOJR-UHFFFAOYSA-N 1 2 310.413 4.399 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+][C@@H](COC)c1ccc(C)o1 ZINC000156501772 521573750 /nfs/dbraw/zinc/57/37/50/521573750.db2.gz MDTHOOXCZGHPHY-ZBFHGGJFSA-N 1 2 303.402 4.025 20 0 DIADLO CCCn1c(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)nc2ccccc21 ZINC000127364231 521629115 /nfs/dbraw/zinc/62/91/15/521629115.db2.gz UOPKYPFHNOPYBX-KRWDZBQOSA-N 1 2 308.429 4.112 20 0 DIADLO CCCn1c(C[N@H+]2CCC[C@H]2c2ccc[nH]2)nc2ccccc21 ZINC000127364231 521629121 /nfs/dbraw/zinc/62/91/21/521629121.db2.gz UOPKYPFHNOPYBX-KRWDZBQOSA-N 1 2 308.429 4.112 20 0 DIADLO CCCN(CCc1cccc(F)c1)C(=O)Nc1cc[nH+]cc1C ZINC000121547462 521671082 /nfs/dbraw/zinc/67/10/82/521671082.db2.gz QCQSQQHUCLNPBW-UHFFFAOYSA-N 1 2 315.392 4.016 20 0 DIADLO CCC[N@H+](Cc1csc([C@@H](C)OC)n1)Cc1ccc(F)cc1 ZINC000267017870 521693245 /nfs/dbraw/zinc/69/32/45/521693245.db2.gz JSFUKSQKEGCTAC-CYBMUJFWSA-N 1 2 322.449 4.402 20 0 DIADLO CCC[N@@H+](Cc1csc([C@@H](C)OC)n1)Cc1ccc(F)cc1 ZINC000267017870 521693249 /nfs/dbraw/zinc/69/32/49/521693249.db2.gz JSFUKSQKEGCTAC-CYBMUJFWSA-N 1 2 322.449 4.402 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cccc(O)c2Cl)c1 ZINC000339333348 521719668 /nfs/dbraw/zinc/71/96/68/521719668.db2.gz XBDMOJOOVIZCHP-UHFFFAOYSA-N 1 2 308.834 4.306 20 0 DIADLO CCSc1cc(C[NH2+]Cc2csc(C(C)(C)C)n2)ccn1 ZINC000189593954 521734077 /nfs/dbraw/zinc/73/40/77/521734077.db2.gz CEAYPYJUIFCNED-UHFFFAOYSA-N 1 2 321.515 4.237 20 0 DIADLO COCC[C@H](C)[NH2+]c1ccc(N2CCc3sccc3C2)cc1 ZINC000183051781 521921696 /nfs/dbraw/zinc/92/16/96/521921696.db2.gz SLLMLMYPPKUAPU-AWEZNQCLSA-N 1 2 316.470 4.148 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2nc(C)sc2C)s1 ZINC000336821010 522231269 /nfs/dbraw/zinc/23/12/69/522231269.db2.gz GEMOBQSEJKWHLI-JTQLQIEISA-N 1 2 309.504 4.280 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2nc(C)sc2C)s1 ZINC000336821010 522231274 /nfs/dbraw/zinc/23/12/74/522231274.db2.gz GEMOBQSEJKWHLI-JTQLQIEISA-N 1 2 309.504 4.280 20 0 DIADLO COC[C@@H]([NH2+][C@H](CC(C)C)c1ccccn1)c1ccc(C)o1 ZINC000182229222 522380780 /nfs/dbraw/zinc/38/07/80/522380780.db2.gz TZOKPFJOVXVZHE-IAGOWNOFSA-N 1 2 302.418 4.048 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cccc(NC(C)=O)c2)cs1 ZINC000162267170 522424150 /nfs/dbraw/zinc/42/41/50/522424150.db2.gz MBYJDSVSYPTJEI-NWDGAFQWSA-N 1 2 317.458 4.076 20 0 DIADLO CCc1[nH+]c2cc(CNC(=O)C3=C(C)CCC3)ccc2n1C1CC1 ZINC000338500792 522482742 /nfs/dbraw/zinc/48/27/42/522482742.db2.gz TWIOGQXKVDQYFC-UHFFFAOYSA-N 1 2 323.440 4.050 20 0 DIADLO CCc1[nH+]c2cc(CNc3ncc(C)s3)ccc2n1C1CC1 ZINC000338486402 522488195 /nfs/dbraw/zinc/48/81/95/522488195.db2.gz ZRGUVJOTZGWAQJ-UHFFFAOYSA-N 1 2 312.442 4.311 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1nccn1C)c1cccc(F)c1)c1ccccc1 ZINC000128366222 522708991 /nfs/dbraw/zinc/70/89/91/522708991.db2.gz IWMVZTFSBIRIRC-RBUKOAKNSA-N 1 2 323.415 4.390 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nc2ccccc2o1)c1nc(C)cs1 ZINC000182442747 522745349 /nfs/dbraw/zinc/74/53/49/522745349.db2.gz PXSXVNPNZDBAAH-NEPJUHHUSA-N 1 2 301.415 4.395 20 0 DIADLO CCc1nnc(C[NH2+][C@H](CCc2ccccc2)c2ccccc2)o1 ZINC000180374452 522746719 /nfs/dbraw/zinc/74/67/19/522746719.db2.gz USJBGXQYZSZIOM-GOSISDBHSA-N 1 2 321.424 4.096 20 0 DIADLO CC[C@H](Nc1cc(C)ccc1Br)c1[nH+]ccn1C ZINC000180093092 522765200 /nfs/dbraw/zinc/76/52/00/522765200.db2.gz BVFZAOIYMGMBKR-LBPRGKRZSA-N 1 2 308.223 4.054 20 0 DIADLO CC[C@H](Nc1ccc2c(c1)OC1(CCCC1)O2)c1[nH+]ccn1C ZINC000182578302 522769997 /nfs/dbraw/zinc/76/99/97/522769997.db2.gz XKVCXPOOVQTZOQ-AWEZNQCLSA-N 1 2 313.401 4.025 20 0 DIADLO CCc1noc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)n1 ZINC000180018522 522914676 /nfs/dbraw/zinc/91/46/76/522914676.db2.gz QRUHQRMCBXRDMU-FNNPODNZSA-N 1 2 319.836 4.333 20 0 DIADLO CC[C@@H](Nc1cccc(N2CCC(C)CC2)c1)c1[nH+]ccn1C ZINC000179961249 522960770 /nfs/dbraw/zinc/96/07/70/522960770.db2.gz HTIRFRJZYHHYJA-GOSISDBHSA-N 1 2 312.461 4.220 20 0 DIADLO C[N@H+](Cc1cc(F)cc2cccnc21)Cc1c(F)cccc1F ZINC000339599318 523179986 /nfs/dbraw/zinc/17/99/86/523179986.db2.gz GPGXPNXPWUDGAV-UHFFFAOYSA-N 1 2 316.326 4.284 20 0 DIADLO C[N@@H+](Cc1cc(F)cc2cccnc21)Cc1c(F)cccc1F ZINC000339599318 523179989 /nfs/dbraw/zinc/17/99/89/523179989.db2.gz GPGXPNXPWUDGAV-UHFFFAOYSA-N 1 2 316.326 4.284 20 0 DIADLO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@H](C)c1ccncc1F ZINC000338012414 523295217 /nfs/dbraw/zinc/29/52/17/523295217.db2.gz MKLJINFXNCCJEA-OLZOCXBDSA-N 1 2 312.392 4.002 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](Cc2ccc(F)cc2)C(C)C)cs1 ZINC000267019236 523468223 /nfs/dbraw/zinc/46/82/23/523468223.db2.gz JUBQGWFSFGLCMD-ZDUSSCGKSA-N 1 2 322.449 4.400 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](Cc2ccc(F)cc2)C(C)C)cs1 ZINC000267019236 523468228 /nfs/dbraw/zinc/46/82/28/523468228.db2.gz JUBQGWFSFGLCMD-ZDUSSCGKSA-N 1 2 322.449 4.400 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+](Cc2cccc(F)c2)C(C)C)cs1 ZINC000267003325 523469589 /nfs/dbraw/zinc/46/95/89/523469589.db2.gz DWSOHJZXZKWKBF-ZDUSSCGKSA-N 1 2 322.449 4.400 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+](Cc2cccc(F)c2)C(C)C)cs1 ZINC000267003325 523469600 /nfs/dbraw/zinc/46/96/00/523469600.db2.gz DWSOHJZXZKWKBF-ZDUSSCGKSA-N 1 2 322.449 4.400 20 0 DIADLO COCCC[C@H](C)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000182883820 523491987 /nfs/dbraw/zinc/49/19/87/523491987.db2.gz JQAGGTBCJPOLCY-HNNXBMFYSA-N 1 2 313.445 4.113 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1ccc(SC)cc1 ZINC000339153232 523554798 /nfs/dbraw/zinc/55/47/98/523554798.db2.gz PCINAWMHLMIOPL-KRWDZBQOSA-N 1 2 315.486 4.352 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1ccc(SC)cc1 ZINC000339153232 523554808 /nfs/dbraw/zinc/55/48/08/523554808.db2.gz PCINAWMHLMIOPL-KRWDZBQOSA-N 1 2 315.486 4.352 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1Cc1sccc1Cl ZINC000339148217 523557334 /nfs/dbraw/zinc/55/73/34/523557334.db2.gz GOGKCCLXRKYJOB-ZDUSSCGKSA-N 1 2 309.866 4.345 20 0 DIADLO COCC[N@H+](Cc1ccc(C)o1)Cc1cc(Cl)ccc1F ZINC000354128539 523748297 /nfs/dbraw/zinc/74/82/97/523748297.db2.gz VASPOUPTXMXMPN-UHFFFAOYSA-N 1 2 311.784 4.029 20 0 DIADLO COCC[N@@H+](Cc1ccc(C)o1)Cc1cc(Cl)ccc1F ZINC000354128539 523748305 /nfs/dbraw/zinc/74/83/05/523748305.db2.gz VASPOUPTXMXMPN-UHFFFAOYSA-N 1 2 311.784 4.029 20 0 DIADLO COCC[N@H+](Cc1ccsc1)Cc1ccc(F)cc1Cl ZINC000339232361 523770855 /nfs/dbraw/zinc/77/08/55/523770855.db2.gz IWXLALMFSWPAIF-UHFFFAOYSA-N 1 2 313.825 4.189 20 0 DIADLO COCC[N@@H+](Cc1ccsc1)Cc1ccc(F)cc1Cl ZINC000339232361 523770864 /nfs/dbraw/zinc/77/08/64/523770864.db2.gz IWXLALMFSWPAIF-UHFFFAOYSA-N 1 2 313.825 4.189 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cs1 ZINC000267050999 523913050 /nfs/dbraw/zinc/91/30/50/523913050.db2.gz QRRNSVQNHLYGJA-WBMJQRKESA-N 1 2 320.433 4.327 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cs1 ZINC000267050999 523913054 /nfs/dbraw/zinc/91/30/54/523913054.db2.gz QRRNSVQNHLYGJA-WBMJQRKESA-N 1 2 320.433 4.327 20 0 DIADLO CCc1ccc(C[NH2+][C@@H](C)c2nc(Cc3ccccc3)no2)cc1 ZINC000237153238 523944075 /nfs/dbraw/zinc/94/40/75/523944075.db2.gz CJMRVRJEZASRCC-HNNXBMFYSA-N 1 2 321.424 4.074 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@@H+]2[C@H](C)c2nc(C(C)C)no2)o1 ZINC000265383654 524038146 /nfs/dbraw/zinc/03/81/46/524038146.db2.gz DFDRGMIFFSYENS-OCCSQVGLSA-N 1 2 303.406 4.247 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@H+]2[C@H](C)c2nc(C(C)C)no2)o1 ZINC000265383654 524038148 /nfs/dbraw/zinc/03/81/48/524038148.db2.gz DFDRGMIFFSYENS-OCCSQVGLSA-N 1 2 303.406 4.247 20 0 DIADLO CCc1ccc([C@H](C)[NH2+]Cc2csc(-c3ccco3)n2)o1 ZINC000128461899 524046206 /nfs/dbraw/zinc/04/62/06/524046206.db2.gz JISGVLUTPMNZTP-NSHDSACASA-N 1 2 302.399 4.409 20 0 DIADLO C[C@H]1CC[C@@H](N(C)C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000338204084 524360484 /nfs/dbraw/zinc/36/04/84/524360484.db2.gz HMMOGYXOKCNJCF-LSDHHAIUSA-N 1 2 310.397 4.135 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nnc(-c3ccc(C)cc3)o2)s1 ZINC000102773335 524393930 /nfs/dbraw/zinc/39/39/30/524393930.db2.gz YUCMDPTWXMKEJH-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nnc(-c3ccc(C)cc3)o2)s1 ZINC000102773335 524393936 /nfs/dbraw/zinc/39/39/36/524393936.db2.gz YUCMDPTWXMKEJH-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2csc(-c3ccco3)n2)s1 ZINC000102794326 524395282 /nfs/dbraw/zinc/39/52/82/524395282.db2.gz LBCJYJSVYCOILI-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2csc(-c3ccco3)n2)s1 ZINC000102794326 524395285 /nfs/dbraw/zinc/39/52/85/524395285.db2.gz LBCJYJSVYCOILI-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2coc(-c3cccs3)n2)s1 ZINC000102774316 524396157 /nfs/dbraw/zinc/39/61/57/524396157.db2.gz WACDYWVHWICFDO-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2coc(-c3cccs3)n2)s1 ZINC000102774316 524396161 /nfs/dbraw/zinc/39/61/61/524396161.db2.gz WACDYWVHWICFDO-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1cccc(C[NH2+][C@@H](C)c2nc(Cc3ccccc3)no2)c1C ZINC000191603828 524435887 /nfs/dbraw/zinc/43/58/87/524435887.db2.gz BXTWZAXEIBNGDH-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1cccc(COc2ccc([C@@H](C)[NH2+]Cc3cocn3)cc2)c1 ZINC000182066949 524447622 /nfs/dbraw/zinc/44/76/22/524447622.db2.gz WXAFLLRIDZBXHU-MRXNPFEDSA-N 1 2 322.408 4.413 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2nc3ccccc3n2C(C)C)on1 ZINC000267373902 524689827 /nfs/dbraw/zinc/68/98/27/524689827.db2.gz SJCDOOWLNLBRCX-SFHVURJKSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2nc3ccccc3n2C(C)C)on1 ZINC000267373902 524689838 /nfs/dbraw/zinc/68/98/38/524689838.db2.gz SJCDOOWLNLBRCX-SFHVURJKSA-N 1 2 324.428 4.251 20 0 DIADLO COc1ccc([NH2+][C@H](C)CSC(C)(C)C)c(OC)c1OC ZINC000182869681 524707259 /nfs/dbraw/zinc/70/72/59/524707259.db2.gz IUEZLABAJRLAQQ-LLVKDONJSA-N 1 2 313.463 4.045 20 0 DIADLO COc1ccccc1[C@H](C)CC(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000102982822 524769588 /nfs/dbraw/zinc/76/95/88/524769588.db2.gz QFWSHDAAIOLBDM-GFCCVEGCSA-N 1 2 312.413 4.148 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000124499394 524874414 /nfs/dbraw/zinc/87/44/14/524874414.db2.gz FDDNHVLAKTWBMR-GJZGRUSLSA-N 1 2 307.397 4.457 20 0 DIADLO Cc1ccc(NC(=O)CC2CCC(C(F)(F)F)CC2)c(C)[nH+]1 ZINC000182096320 525031546 /nfs/dbraw/zinc/03/15/46/525031546.db2.gz UYSBSHIANZPUHD-UHFFFAOYSA-N 1 2 314.351 4.396 20 0 DIADLO Cc1ccc(NC(=O)N2CC[C@H](C)C[C@@H]2c2ccco2)c(C)[nH+]1 ZINC000162259292 525141664 /nfs/dbraw/zinc/14/16/64/525141664.db2.gz ONNPJIGAZWGUCE-BLLLJJGKSA-N 1 2 313.401 4.297 20 0 DIADLO Cc1ccccc1Cc1noc(C[NH2+][C@H](C)c2ccccc2C)n1 ZINC000181536938 525206917 /nfs/dbraw/zinc/20/69/17/525206917.db2.gz MTQCCACIBUWEST-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(Cl)c3ncccc23)c(C)[nH+]1 ZINC000337968745 525238310 /nfs/dbraw/zinc/23/83/10/525238310.db2.gz LTJNRZVDYJHKQH-UHFFFAOYSA-N 1 2 311.772 4.152 20 0 DIADLO Cc1cc(NC(=O)c2ccc(CCC(F)(F)F)cc2)cc[nH+]1 ZINC000131734608 525245745 /nfs/dbraw/zinc/24/57/45/525245745.db2.gz HMBXPNNQKNOBMO-UHFFFAOYSA-N 1 2 308.303 4.137 20 0 DIADLO Cc1ccc(NC(=O)c2cnccc2Oc2ccccc2)c(C)[nH+]1 ZINC000337177908 525252933 /nfs/dbraw/zinc/25/29/33/525252933.db2.gz PGVZOPCHKIWMTF-UHFFFAOYSA-N 1 2 319.364 4.138 20 0 DIADLO C[C@H]([NH2+]C1(c2cccc(Br)c2)CC1)c1nccs1 ZINC000182271841 525285256 /nfs/dbraw/zinc/28/52/56/525285256.db2.gz WNRWCMSLKOGHEG-JTQLQIEISA-N 1 2 323.259 4.246 20 0 DIADLO Cc1ccccc1[C@@H]([NH2+]Cc1noc(C(C)C)n1)C(C)(C)C ZINC000180088466 525374208 /nfs/dbraw/zinc/37/42/08/525374208.db2.gz VITFNWJYACQDHZ-MRXNPFEDSA-N 1 2 301.434 4.378 20 0 DIADLO C[C@@H]([NH2+]C1(c2cccc(Br)c2)CC1)c1nccs1 ZINC000182271858 525391719 /nfs/dbraw/zinc/39/17/19/525391719.db2.gz WNRWCMSLKOGHEG-SNVBAGLBSA-N 1 2 323.259 4.246 20 0 DIADLO C[C@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1ccc(Cl)cc1 ZINC000186061098 525431934 /nfs/dbraw/zinc/43/19/34/525431934.db2.gz VSDOYBPEJZNGCN-LBPRGKRZSA-N 1 2 322.836 4.494 20 0 DIADLO C[C@H]([NH2+]Cc1csc(C2CCCC2)n1)c1ccncc1F ZINC000338341740 525482536 /nfs/dbraw/zinc/48/25/36/525482536.db2.gz IAWZKAIHNVQYQA-NSHDSACASA-N 1 2 305.422 4.186 20 0 DIADLO C[C@H]([NH2+]Cc1nc2cc(Cl)ccc2s1)c1ccncc1F ZINC000338369121 525487110 /nfs/dbraw/zinc/48/71/10/525487110.db2.gz MRNMRKSNNNEUID-VIFPVBQESA-N 1 2 321.808 4.335 20 0 DIADLO C[C@H]([NH2+]Cc1nccn1CC(F)(F)F)c1cc2ccccc2o1 ZINC000189097527 525491576 /nfs/dbraw/zinc/49/15/76/525491576.db2.gz AZGNRQMRJXCMDQ-NSHDSACASA-N 1 2 323.318 4.042 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(C2CC2)n1C1CC1)c1cc2ccccc2o1 ZINC000182634273 525493567 /nfs/dbraw/zinc/49/35/67/525493567.db2.gz KWIZWSWVVAJHTN-LBPRGKRZSA-N 1 2 322.412 4.087 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2coc(-c3ccccc3)n2)o1 ZINC000237469268 525510517 /nfs/dbraw/zinc/51/05/17/525510517.db2.gz WINAHJBSNKUYLY-CXAGYDPISA-N 1 2 308.381 4.348 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2cc(C(F)(F)F)ccc2o1)c1ccccn1 ZINC000181790264 525558900 /nfs/dbraw/zinc/55/89/00/525558900.db2.gz BYHIVDBWIBOXFM-SNVBAGLBSA-N 1 2 321.302 4.092 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccncc1F)c1ncc(-c2ccccc2)o1 ZINC000338348892 525619817 /nfs/dbraw/zinc/61/98/17/525619817.db2.gz XBBPYUBIYONCLE-QWHCGFSZSA-N 1 2 311.360 4.288 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccccc1Br ZINC000162295286 525622098 /nfs/dbraw/zinc/62/20/98/525622098.db2.gz CDNLQSAWOMDDHE-ZJUUUORDSA-N 1 2 311.248 4.317 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(Cc3ccccc3)no2)cc1 ZINC000173971855 525747711 /nfs/dbraw/zinc/74/77/11/525747711.db2.gz QYTCPKQHBXYBSO-HZPDHXFCSA-N 1 2 321.424 4.381 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+](C)[C@H](C)c3ccccn3)o2)cc1 ZINC000129193139 525770945 /nfs/dbraw/zinc/77/09/45/525770945.db2.gz BBFOOEZVZQIVTR-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+](C)[C@H](C)c3ccccn3)o2)cc1 ZINC000129193139 525770953 /nfs/dbraw/zinc/77/09/53/525770953.db2.gz BBFOOEZVZQIVTR-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2ncnn2C(C)(C)C)o1 ZINC000338307058 525796916 /nfs/dbraw/zinc/79/69/16/525796916.db2.gz PWWZJFHFUAGZHA-HNNXBMFYSA-N 1 2 316.449 4.052 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2ncnn2C(C)(C)C)o1 ZINC000338307058 525796920 /nfs/dbraw/zinc/79/69/20/525796920.db2.gz PWWZJFHFUAGZHA-HNNXBMFYSA-N 1 2 316.449 4.052 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000158659066 525796982 /nfs/dbraw/zinc/79/69/82/525796982.db2.gz IHXIZDARQSOYHF-AWEZNQCLSA-N 1 2 303.406 4.212 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000158659066 525796987 /nfs/dbraw/zinc/79/69/87/525796987.db2.gz IHXIZDARQSOYHF-AWEZNQCLSA-N 1 2 303.406 4.212 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2nc(Cc3ccccc3C)no2)cc1 ZINC000182318817 525930017 /nfs/dbraw/zinc/93/00/17/525930017.db2.gz JURBPRBAOIGYAP-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1cn2cc(NC(=O)C[C@@H]3CCCc4ccccc43)ccc2[nH+]1 ZINC000336966442 525948385 /nfs/dbraw/zinc/94/83/85/525948385.db2.gz HFTAPSXMEDVOMC-INIZCTEOSA-N 1 2 319.408 4.091 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000158659224 525989241 /nfs/dbraw/zinc/98/92/41/525989241.db2.gz IHXIZDARQSOYHF-CQSZACIVSA-N 1 2 303.406 4.212 20 0 DIADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2nnc(C(C)C)o2)o1 ZINC000158659224 525989253 /nfs/dbraw/zinc/98/92/53/525989253.db2.gz IHXIZDARQSOYHF-CQSZACIVSA-N 1 2 303.406 4.212 20 0 DIADLO Cc1cc(-c2nnc(C[N@H+]3C[C@@H](C)[C@H]3c3ccccc3)o2)c(C)o1 ZINC000336878260 526058318 /nfs/dbraw/zinc/05/83/18/526058318.db2.gz CRKOWEQIWMCALE-XIKOKIGWSA-N 1 2 323.396 4.139 20 0 DIADLO Cc1cc(-c2nnc(C[N@@H+]3C[C@@H](C)[C@H]3c3ccccc3)o2)c(C)o1 ZINC000336878260 526058323 /nfs/dbraw/zinc/05/83/23/526058323.db2.gz CRKOWEQIWMCALE-XIKOKIGWSA-N 1 2 323.396 4.139 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1csc(-c2cccs2)n1 ZINC000127953487 526113355 /nfs/dbraw/zinc/11/33/55/526113355.db2.gz DZBCNXOXNFDJIT-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1csc(-c2cccs2)n1 ZINC000127953487 526113359 /nfs/dbraw/zinc/11/33/59/526113359.db2.gz DZBCNXOXNFDJIT-LBPRGKRZSA-N 1 2 315.467 4.460 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1nnc(-c2cccc(Cl)c2)o1 ZINC000106860188 526133498 /nfs/dbraw/zinc/13/34/98/526133498.db2.gz KCUCECKCFKAUQG-NSHDSACASA-N 1 2 317.776 4.176 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1nnc(-c2cccc(Cl)c2)o1 ZINC000106860188 526133508 /nfs/dbraw/zinc/13/35/08/526133508.db2.gz KCUCECKCFKAUQG-NSHDSACASA-N 1 2 317.776 4.176 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1nc(-c2ccccc2F)no1 ZINC000188967406 526147307 /nfs/dbraw/zinc/14/73/07/526147307.db2.gz LCASZKLFRMFSHL-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1nc(-c2ccccc2F)no1 ZINC000188967406 526147316 /nfs/dbraw/zinc/14/73/16/526147316.db2.gz LCASZKLFRMFSHL-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)C1c2ccccc2Oc2ccccc21 ZINC000107357124 526236588 /nfs/dbraw/zinc/23/65/88/526236588.db2.gz URMRHQRBMRFCFU-UHFFFAOYSA-N 1 2 316.360 4.266 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@@H](C)Sc1ccc(Cl)cc1 ZINC000107286117 526239750 /nfs/dbraw/zinc/23/97/50/526239750.db2.gz ABHNKTHJJSWTRW-LLVKDONJSA-N 1 2 306.818 4.163 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000107290717 526240041 /nfs/dbraw/zinc/24/00/41/526240041.db2.gz VLACHBBZZNIWBN-KGLIPLIRSA-N 1 2 320.314 4.151 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@H](C)Sc1ccccc1Cl ZINC000107293996 526240859 /nfs/dbraw/zinc/24/08/59/526240859.db2.gz DXDWMFFIUBPNQX-NSHDSACASA-N 1 2 306.818 4.163 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccc(Sc2ccccn2)cc1 ZINC000107292569 526241779 /nfs/dbraw/zinc/24/17/79/526241779.db2.gz FNIVINKCZWHODW-UHFFFAOYSA-N 1 2 321.405 4.189 20 0 DIADLO Oc1cccc(C[NH2+]Cc2coc(-c3cccs3)n2)c1Cl ZINC000339200501 526360702 /nfs/dbraw/zinc/36/07/02/526360702.db2.gz INHZLZSVJDRCIY-UHFFFAOYSA-N 1 2 320.801 4.052 20 0 DIADLO Fc1ccc2cc[nH+]c(N[C@H]3CCCC34CCOCC4)c2c1 ZINC000336932070 526376471 /nfs/dbraw/zinc/37/64/71/526376471.db2.gz QOUFMOCUIUDFJZ-INIZCTEOSA-N 1 2 300.377 4.135 20 0 DIADLO Fc1cccc(C[N@@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c1Cl ZINC000339202750 526385202 /nfs/dbraw/zinc/38/52/02/526385202.db2.gz QFHRARSGUNIXAY-ZBFHGGJFSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cccc(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c1Cl ZINC000339202750 526385208 /nfs/dbraw/zinc/38/52/08/526385208.db2.gz QFHRARSGUNIXAY-ZBFHGGJFSA-N 1 2 309.812 4.013 20 0 DIADLO Cc1noc(C)c1C[N@@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000338369708 526507128 /nfs/dbraw/zinc/50/71/28/526507128.db2.gz KCTDMHNABFLCCS-MRXNPFEDSA-N 1 2 308.784 4.016 20 0 DIADLO Cc1noc(C)c1C[N@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000338369708 526507139 /nfs/dbraw/zinc/50/71/39/526507139.db2.gz KCTDMHNABFLCCS-MRXNPFEDSA-N 1 2 308.784 4.016 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+](Cc1cccnc1)C1CC1 ZINC000124761966 526739472 /nfs/dbraw/zinc/73/94/72/526739472.db2.gz OYEWWYUZSYNTMB-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+](Cc1cccnc1)C1CC1 ZINC000124761966 526739475 /nfs/dbraw/zinc/73/94/75/526739475.db2.gz OYEWWYUZSYNTMB-UHFFFAOYSA-N 1 2 319.408 4.210 20 0 DIADLO O=C(c1cccc(Oc2cc[nH+]cc2)c1)N1CCC[C@H]1C1CCC1 ZINC000264929796 526776587 /nfs/dbraw/zinc/77/65/87/526776587.db2.gz XDQGORKOUNKTKB-IBGZPJMESA-N 1 2 322.408 4.279 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1nc(-c2ccsc2)oc1C ZINC000102655651 526824813 /nfs/dbraw/zinc/82/48/13/526824813.db2.gz NTHKDNWAXIROAV-UHFFFAOYSA-N 1 2 302.399 4.245 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1nc(-c2ccsc2)oc1C ZINC000102655651 526824821 /nfs/dbraw/zinc/82/48/21/526824821.db2.gz NTHKDNWAXIROAV-UHFFFAOYSA-N 1 2 302.399 4.245 20 0 DIADLO Cc1nc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c(C)s1 ZINC000336824135 526869824 /nfs/dbraw/zinc/86/98/24/526869824.db2.gz SWTFYSOJNCALSE-MRXNPFEDSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1nc(C[N@H+]2CCSC[C@@H]2c2ccccc2)c(C)s1 ZINC000336824135 526869826 /nfs/dbraw/zinc/86/98/26/526869826.db2.gz SWTFYSOJNCALSE-MRXNPFEDSA-N 1 2 304.484 4.050 20 0 DIADLO Cc1nc(C[NH2+]Cc2nc(-c3ccccc3F)cs2)cs1 ZINC000368212144 526889485 /nfs/dbraw/zinc/88/94/85/526889485.db2.gz HRTFRJKFCNWVHY-UHFFFAOYSA-N 1 2 319.430 4.004 20 0 DIADLO Cc1nc(C[NH2+][C@@H](CCC(C)C)c2ccc(Cl)cc2)no1 ZINC000180027428 526890647 /nfs/dbraw/zinc/89/06/47/526890647.db2.gz KFHZNEBWBZCUQP-HNNXBMFYSA-N 1 2 307.825 4.299 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCC(=O)Nc1ccc(Cl)cc1 ZINC000163591773 527167076 /nfs/dbraw/zinc/16/70/76/527167076.db2.gz NGHOUXZRHZXOFW-UHFFFAOYSA-N 1 2 313.788 4.027 20 0 DIADLO Cc1[nH+]c2ccccn2c1CSc1ccc(N)cc1Cl ZINC000338152854 527179761 /nfs/dbraw/zinc/17/97/61/527179761.db2.gz BUHIAMYPBQBVFW-UHFFFAOYSA-N 1 2 303.818 4.171 20 0 DIADLO Cc1[nH]c(C(=O)N[C@H](C)c2ccccc2Oc2ccccc2)c[nH+]1 ZINC000339225310 527241270 /nfs/dbraw/zinc/24/12/70/527241270.db2.gz GYHNVAZYEYIAQT-CYBMUJFWSA-N 1 2 321.380 4.001 20 0 DIADLO O=C(Nc1cccc2c1CCCC2)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000267296323 527378172 /nfs/dbraw/zinc/37/81/72/527378172.db2.gz DLCOTPBLKVNKHY-QGZVFWFLSA-N 1 2 324.428 4.048 20 0 DIADLO Cc1nccnc1[C@@H](C)[NH2+][C@H](C)c1nc(-c2ccccc2)cs1 ZINC000188185762 527454403 /nfs/dbraw/zinc/45/44/03/527454403.db2.gz PSRBQPQCRLOTLY-ZIAGYGMSSA-N 1 2 324.453 4.320 20 0 DIADLO Cc1nccnc1[C@H](C)Nc1cccc([NH+]2CCCCCC2)c1 ZINC000188423670 527459509 /nfs/dbraw/zinc/45/95/09/527459509.db2.gz KYALQVYARCQRPR-INIZCTEOSA-N 1 2 310.445 4.339 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NCc2ccn(C3CCCC3)n2)c1 ZINC000154741677 527688140 /nfs/dbraw/zinc/68/81/40/527688140.db2.gz XCQJLBXTLAYKOU-UHFFFAOYSA-N 1 2 310.323 4.024 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)c1ccco1 ZINC000274957166 535181550 /nfs/dbraw/zinc/18/15/50/535181550.db2.gz WCIGNAYXLGQVDD-XJKSGUPXSA-N 1 2 322.836 4.393 20 0 DIADLO CCCC[C@@H](CC)C(=O)N1CCCC[C@H]1c1[nH+]ccn1CC ZINC000366642719 535346002 /nfs/dbraw/zinc/34/60/02/535346002.db2.gz FKJZZULDNBGQTA-CVEARBPZSA-N 1 2 305.466 4.173 20 0 DIADLO CC[C@@H](Cc1nc(Cc2ccc(C)[nH+]c2)no1)c1ccccc1 ZINC000273919421 535777388 /nfs/dbraw/zinc/77/73/88/535777388.db2.gz KZUMANUDUGAXEE-INIZCTEOSA-N 1 2 307.397 4.100 20 0 DIADLO CCn1cc[nH+]c1[C@@H](C)Nc1ccc(OCC(F)(F)F)cc1 ZINC000296777965 536117023 /nfs/dbraw/zinc/11/70/23/536117023.db2.gz KQQAPQYADJRBFY-LLVKDONJSA-N 1 2 313.323 4.017 20 0 DIADLO COC[C@@H]([NH2+]Cc1csc(C2CC2)n1)c1cccc(Cl)c1 ZINC000288521692 536720649 /nfs/dbraw/zinc/72/06/49/536720649.db2.gz JLXJKYLFIUOYJS-OAHLLOKOSA-N 1 2 322.861 4.151 20 0 DIADLO COCC[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCCC2)c1ccco1 ZINC000272540119 536808845 /nfs/dbraw/zinc/80/88/45/536808845.db2.gz KNBZVKREFMMWPX-QWHCGFSZSA-N 1 2 320.458 4.043 20 0 DIADLO COc1ccccc1C[NH2+][C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000274671165 537049138 /nfs/dbraw/zinc/04/91/38/537049138.db2.gz YFBLMKMIMRAMNW-VIFPVBQESA-N 1 2 316.348 4.021 20 0 DIADLO CC/C=C\CC[N@@H+]1CCc2cc(Br)cc(F)c2C1 ZINC001192635836 1049126199 /nfs/dbraw/zinc/12/61/99/1049126199.db2.gz RPIFPTXFGCPEOQ-ARJAWSKDSA-N 1 2 312.226 4.303 20 0 DIADLO CC/C=C\CC[N@H+]1CCc2cc(Br)cc(F)c2C1 ZINC001192635836 1049126205 /nfs/dbraw/zinc/12/62/05/1049126205.db2.gz RPIFPTXFGCPEOQ-ARJAWSKDSA-N 1 2 312.226 4.303 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cnc(Cl)cc1Br ZINC001232682553 1054097027 /nfs/dbraw/zinc/09/70/27/1054097027.db2.gz DFEGQTWEEHHQOJ-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cnc(Cl)cc1Br ZINC001232682553 1054097036 /nfs/dbraw/zinc/09/70/36/1054097036.db2.gz DFEGQTWEEHHQOJ-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO CC1CC([N@H+](C)Cc2c(F)ccc(Cl)c2Br)C1 ZINC001232690543 1054102517 /nfs/dbraw/zinc/10/25/17/1054102517.db2.gz IFKAUJDYIAHMEB-UHFFFAOYSA-N 1 2 320.633 4.472 20 0 DIADLO CC1CC([N@@H+](C)Cc2c(F)ccc(Cl)c2Br)C1 ZINC001232690543 1054102519 /nfs/dbraw/zinc/10/25/19/1054102519.db2.gz IFKAUJDYIAHMEB-UHFFFAOYSA-N 1 2 320.633 4.472 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2c(Cl)cc(F)cc2Cl)[C@H](C)C1 ZINC001237603595 1055484181 /nfs/dbraw/zinc/48/41/81/1055484181.db2.gz UCRFCRYSAQZBFX-KOLCDFICSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2c(Cl)cc(F)cc2Cl)[C@H](C)C1 ZINC001237603595 1055484187 /nfs/dbraw/zinc/48/41/87/1055484187.db2.gz UCRFCRYSAQZBFX-KOLCDFICSA-N 1 2 306.208 4.132 20 0 DIADLO CC[N@H+](Cc1cccc(Cl)c1)[C@@H](C)c1nc(C2CC2)no1 ZINC000153988703 1035665673 /nfs/dbraw/zinc/66/56/73/1035665673.db2.gz KMUQTUMGOQBIRL-NSHDSACASA-N 1 2 305.809 4.184 20 0 DIADLO CC[N@@H+](Cc1cccc(Cl)c1)[C@@H](C)c1nc(C2CC2)no1 ZINC000153988703 1035665684 /nfs/dbraw/zinc/66/56/84/1035665684.db2.gz KMUQTUMGOQBIRL-NSHDSACASA-N 1 2 305.809 4.184 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC001167063070 1035688284 /nfs/dbraw/zinc/68/82/84/1035688284.db2.gz QOLNIIXKYDWVSG-CYBMUJFWSA-N 1 2 309.837 4.036 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC001167063070 1035688293 /nfs/dbraw/zinc/68/82/93/1035688293.db2.gz QOLNIIXKYDWVSG-CYBMUJFWSA-N 1 2 309.837 4.036 20 0 DIADLO COc1ccc2[nH+]c(N3CC(c4ccccc4)C3)cc(C)c2c1 ZINC001167063218 1035689718 /nfs/dbraw/zinc/68/97/18/1035689718.db2.gz NTNYCBMWJLTAPA-UHFFFAOYSA-N 1 2 304.393 4.156 20 0 DIADLO Cc1cnc(F)c(Nc2cc[nH+]c(NC(=O)OC(C)(C)C)c2)c1 ZINC001211493721 1035691596 /nfs/dbraw/zinc/69/15/96/1035691596.db2.gz KYFMWVDBEZVULZ-UHFFFAOYSA-N 1 2 318.352 4.015 20 0 DIADLO CC(C)CC[C@@H]1CCCCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000579821361 1035734645 /nfs/dbraw/zinc/73/46/45/1035734645.db2.gz RGKBTOWXGLMJSC-INIZCTEOSA-N 1 2 314.433 4.157 20 0 DIADLO Cc1ncccc1C[N@@H+](C)[C@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660706895 1035761323 /nfs/dbraw/zinc/76/13/23/1035761323.db2.gz ABMNKAXGPGDQBC-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1ncccc1C[N@H+](C)[C@H](C)c1nc2cc(Cl)ccc2[nH]1 ZINC000660706895 1035761335 /nfs/dbraw/zinc/76/13/35/1035761335.db2.gz ABMNKAXGPGDQBC-GFCCVEGCSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1cc(NC(=O)[C@@H](C)Sc2ccc(Cl)cc2)cc[nH+]1 ZINC000010165244 1035833128 /nfs/dbraw/zinc/83/31/28/1035833128.db2.gz XZRMXKNVBDWBPX-LLVKDONJSA-N 1 2 306.818 4.163 20 0 DIADLO CCC[C@H]1CCC[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001125300829 1035836508 /nfs/dbraw/zinc/83/65/08/1035836508.db2.gz FAOPAVUSUWMZLM-DZGCQCFKSA-N 1 2 315.392 4.166 20 0 DIADLO CCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1cscn1 ZINC000072756796 1035874706 /nfs/dbraw/zinc/87/47/06/1035874706.db2.gz XMNHDPOUPBIQQI-MRXNPFEDSA-N 1 2 304.459 4.419 20 0 DIADLO Cc1ccnc(C[N@@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)n1 ZINC000339661907 1035903142 /nfs/dbraw/zinc/90/31/42/1035903142.db2.gz RYWGJHAOECQQSH-CYBMUJFWSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1ccnc(C[N@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)n1 ZINC000339661907 1035903154 /nfs/dbraw/zinc/90/31/54/1035903154.db2.gz RYWGJHAOECQQSH-CYBMUJFWSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccccc2OC(F)F)cs1 ZINC000037084625 1035938834 /nfs/dbraw/zinc/93/88/34/1035938834.db2.gz OTMOITDZBAOVHM-VHSXEESVSA-N 1 2 312.385 4.465 20 0 DIADLO Cc1cc(C)c(NC(=O)CCC[N@H+](CC(F)F)C2CC2)c(C)c1 ZINC000137240666 1035940099 /nfs/dbraw/zinc/94/00/99/1035940099.db2.gz AOPZRWROBDMPJQ-UHFFFAOYSA-N 1 2 324.415 4.060 20 0 DIADLO Cc1cc(C)c(NC(=O)CCC[N@@H+](CC(F)F)C2CC2)c(C)c1 ZINC000137240666 1035940111 /nfs/dbraw/zinc/94/01/11/1035940111.db2.gz AOPZRWROBDMPJQ-UHFFFAOYSA-N 1 2 324.415 4.060 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2ccccc2OC(F)F)cs1 ZINC000037084628 1035943516 /nfs/dbraw/zinc/94/35/16/1035943516.db2.gz OTMOITDZBAOVHM-ZJUUUORDSA-N 1 2 312.385 4.465 20 0 DIADLO c1c[nH]c(C[NH2+][C@H](c2ccccc2)c2ccc3ccccc3c2)n1 ZINC000109350076 1035961132 /nfs/dbraw/zinc/96/11/32/1035961132.db2.gz OMMHWCASYTUITP-OAQYLSRUSA-N 1 2 313.404 4.442 20 0 DIADLO Cc1cc(C[N@H+](CC(F)F)CC2CCC2)c2ccccc2n1 ZINC000535618547 1035963282 /nfs/dbraw/zinc/96/32/82/1035963282.db2.gz VGNPBFQLPGWTGO-UHFFFAOYSA-N 1 2 304.384 4.410 20 0 DIADLO Cc1cc(C[N@@H+](CC(F)F)CC2CCC2)c2ccccc2n1 ZINC000535618547 1035963291 /nfs/dbraw/zinc/96/32/91/1035963291.db2.gz VGNPBFQLPGWTGO-UHFFFAOYSA-N 1 2 304.384 4.410 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2nnc(C(C)(C)C)o2)C1 ZINC000075843128 1036021896 /nfs/dbraw/zinc/02/18/96/1036021896.db2.gz PHDRYHWKXAJCKR-IUODEOHRSA-N 1 2 317.408 4.089 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2nnc(C(C)(C)C)o2)C1 ZINC000075843128 1036021908 /nfs/dbraw/zinc/02/19/08/1036021908.db2.gz PHDRYHWKXAJCKR-IUODEOHRSA-N 1 2 317.408 4.089 20 0 DIADLO Cc1noc([C@@H](C)[NH2+][C@@H](Cc2ccccc2)c2ccccc2)n1 ZINC000078541087 1036059190 /nfs/dbraw/zinc/05/91/90/1036059190.db2.gz VAHXWDRXCHYMQO-KDOFPFPSSA-N 1 2 307.397 4.013 20 0 DIADLO C/C(=C\C(=O)Nc1nc(C[NH+]2CCCCC2)cs1)C(C)(C)C ZINC000079701135 1036070039 /nfs/dbraw/zinc/07/00/39/1036070039.db2.gz IEYIOEGEGXBHMK-JLHYYAGUSA-N 1 2 321.490 4.060 20 0 DIADLO CSc1nccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC001140037886 1036111533 /nfs/dbraw/zinc/11/15/33/1036111533.db2.gz GXVMSQBJZVCHRB-OAHLLOKOSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1nccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC001140037886 1036111539 /nfs/dbraw/zinc/11/15/39/1036111539.db2.gz GXVMSQBJZVCHRB-OAHLLOKOSA-N 1 2 319.861 4.189 20 0 DIADLO CCc1ccc(C[N@@H+]2CCc3c4cc(OC)ccc4[nH]c3C2)cc1 ZINC000039231311 1036119488 /nfs/dbraw/zinc/11/94/88/1036119488.db2.gz OIODATLCLJOHEH-UHFFFAOYSA-N 1 2 320.436 4.297 20 0 DIADLO CCc1ccc(C[N@H+]2CCc3c4cc(OC)ccc4[nH]c3C2)cc1 ZINC000039231311 1036119494 /nfs/dbraw/zinc/11/94/94/1036119494.db2.gz OIODATLCLJOHEH-UHFFFAOYSA-N 1 2 320.436 4.297 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1cccc2ccccc21 ZINC000047514657 1036122125 /nfs/dbraw/zinc/12/21/25/1036122125.db2.gz JMYJMEHJMNEBKO-UHFFFAOYSA-N 1 2 313.360 4.278 20 0 DIADLO Cc1noc(C)c1C[N@@H+](C)Cc1cc(F)cc(C(F)(F)F)c1 ZINC000091812741 1036163022 /nfs/dbraw/zinc/16/30/22/1036163022.db2.gz SAYQPKGRIQSXHB-UHFFFAOYSA-N 1 2 316.298 4.081 20 0 DIADLO Cc1noc(C)c1C[N@H+](C)Cc1cc(F)cc(C(F)(F)F)c1 ZINC000091812741 1036163029 /nfs/dbraw/zinc/16/30/29/1036163029.db2.gz SAYQPKGRIQSXHB-UHFFFAOYSA-N 1 2 316.298 4.081 20 0 DIADLO C[C@]1(c2ccc(F)cc2)CN(c2[nH+]ccc3ccccc32)CCO1 ZINC001167137220 1036169231 /nfs/dbraw/zinc/16/92/31/1036169231.db2.gz JJAXEWDUGMVUFM-HXUWFJFHSA-N 1 2 322.383 4.126 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1ccnc(Cl)c1 ZINC000090228879 1036187958 /nfs/dbraw/zinc/18/79/58/1036187958.db2.gz PYGDHOVGKDAJTR-SSDOTTSWSA-N 1 2 318.701 4.142 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](c2ccccc2)C2CCCC2)no1 ZINC000109801167 1036261562 /nfs/dbraw/zinc/26/15/62/1036261562.db2.gz HIMIDMBQAYQRGE-LJQANCHMSA-N 1 2 313.445 4.433 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1cc(F)ccc1F ZINC000120901270 1036372562 /nfs/dbraw/zinc/37/25/62/1036372562.db2.gz GHIJJOUCWQZXID-LBPRGKRZSA-N 1 2 305.372 4.127 20 0 DIADLO Fc1cccc([C@H]2CC[N@@H+]2Cc2ccc(C(F)(F)F)cn2)c1 ZINC000683522982 1036438046 /nfs/dbraw/zinc/43/80/46/1036438046.db2.gz ZLXJPZKYNRJQNO-OAHLLOKOSA-N 1 2 310.294 4.187 20 0 DIADLO Fc1cccc([C@H]2CC[N@H+]2Cc2ccc(C(F)(F)F)cn2)c1 ZINC000683522982 1036438054 /nfs/dbraw/zinc/43/80/54/1036438054.db2.gz ZLXJPZKYNRJQNO-OAHLLOKOSA-N 1 2 310.294 4.187 20 0 DIADLO c1nc(C2CCCC2)sc1C[N@H+](Cc1cccnc1)C1CC1 ZINC000349236572 1036493571 /nfs/dbraw/zinc/49/35/71/1036493571.db2.gz DHAWJXGBZQBNDH-UHFFFAOYSA-N 1 2 313.470 4.360 20 0 DIADLO c1nc(C2CCCC2)sc1C[N@@H+](Cc1cccnc1)C1CC1 ZINC000349236572 1036493583 /nfs/dbraw/zinc/49/35/83/1036493583.db2.gz DHAWJXGBZQBNDH-UHFFFAOYSA-N 1 2 313.470 4.360 20 0 DIADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cc(O)ccc2Cl)o1 ZINC000625328046 1036505057 /nfs/dbraw/zinc/50/50/57/1036505057.db2.gz QKFKTLPSIJYDIO-MRXNPFEDSA-N 1 2 321.804 4.122 20 0 DIADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2cc(O)ccc2Cl)o1 ZINC000625328046 1036505066 /nfs/dbraw/zinc/50/50/66/1036505066.db2.gz QKFKTLPSIJYDIO-MRXNPFEDSA-N 1 2 321.804 4.122 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@@H]1CCCn2ccnc21 ZINC000655760897 1036526700 /nfs/dbraw/zinc/52/67/00/1036526700.db2.gz AHJNUPXWNLPXOH-CABCVRRESA-N 1 2 323.362 4.310 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(C3=CCCC3)cc2)c(N(C)C)[nH+]1 ZINC001266516069 1036587948 /nfs/dbraw/zinc/58/79/48/1036587948.db2.gz PXMNDLAHPWYVNU-UHFFFAOYSA-N 1 2 321.424 4.276 20 0 DIADLO CCOc1ccc(NCc2c[nH+]c3c(C)cccn23)cc1Cl ZINC001648841284 1036622930 /nfs/dbraw/zinc/62/29/30/1036622930.db2.gz GUGIJKPXEWLJCY-UHFFFAOYSA-N 1 2 315.804 4.307 20 0 DIADLO FC(F)Oc1ccc2ccccc2c1CNc1cccc[nH+]1 ZINC001648855836 1036644961 /nfs/dbraw/zinc/64/49/61/1036644961.db2.gz JRYYIRKYCZZELG-UHFFFAOYSA-N 1 2 300.308 4.448 20 0 DIADLO COc1ccccc1/C=C\CNc1ccc(N2CCCCC2)c[nH+]1 ZINC001648874001 1036664595 /nfs/dbraw/zinc/66/45/95/1036664595.db2.gz HCPXTRKBCTZADU-CLFYSBASSA-N 1 2 323.440 4.206 20 0 DIADLO Cc1ccc(-c2noc([C@H](C)[NH2+]Cc3cccs3)n2)cc1F ZINC000579987713 1036691620 /nfs/dbraw/zinc/69/16/20/1036691620.db2.gz AWRGFFLMIUIAQO-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000447928106 1036724933 /nfs/dbraw/zinc/72/49/33/1036724933.db2.gz CVXUUCBWZQEIKI-UHFFFAOYSA-N 1 2 324.877 4.392 20 0 DIADLO Cc1nc(C[NH2+][C@H]2CCCOc3c(C)cc(Cl)cc32)cs1 ZINC000121982228 1036731478 /nfs/dbraw/zinc/73/14/78/1036731478.db2.gz BSWRQTDUJKBWNG-HNNXBMFYSA-N 1 2 322.861 4.417 20 0 DIADLO C[C@@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)c1nccs1 ZINC000080266782 1036772221 /nfs/dbraw/zinc/77/22/21/1036772221.db2.gz GTDPLLXSUMUYJI-ZYHUDNBSSA-N 1 2 300.349 4.487 20 0 DIADLO C[C@@H]([NH2+][C@@H](CC(F)(F)F)c1ccccc1)c1nccs1 ZINC000080266776 1036773862 /nfs/dbraw/zinc/77/38/62/1036773862.db2.gz GTDPLLXSUMUYJI-PWSUYJOCSA-N 1 2 300.349 4.487 20 0 DIADLO Cc1ccc2nc(C(=O)Nc3c(C)cc(C)[nH+]c3C)ccc2c1 ZINC001125403764 1036810810 /nfs/dbraw/zinc/81/08/10/1036810810.db2.gz GZUQGBZXBNVZMJ-UHFFFAOYSA-N 1 2 305.381 4.116 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2cc(Cl)cc(Cl)c2)c(C)[nH+]1 ZINC001125405039 1036817316 /nfs/dbraw/zinc/81/73/16/1036817316.db2.gz YJOOFYAGRPCFNX-UHFFFAOYSA-N 1 2 323.223 4.495 20 0 DIADLO c1cc2cc(CNc3ccc(N4CCCCC4)c[nH+]3)ccc2cn1 ZINC000683751362 1036822944 /nfs/dbraw/zinc/82/29/44/1036822944.db2.gz LOBSVTPLOSPZFQ-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@H](C)c2ccc(F)cn2)c2ccccn2)c1 ZINC000090946513 1036823255 /nfs/dbraw/zinc/82/32/55/1036823255.db2.gz NWWYEJUAGKXCSC-FOIQADDNSA-N 1 2 321.399 4.364 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1ccc2cnccc2c1 ZINC000683752240 1036827329 /nfs/dbraw/zinc/82/73/29/1036827329.db2.gz UMLYFKKIMYSTBA-UHFFFAOYSA-N 1 2 322.799 4.387 20 0 DIADLO Nc1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000315183035 1036830604 /nfs/dbraw/zinc/83/06/04/1036830604.db2.gz UMEIPXRCMTWDNZ-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000315183035 1036830621 /nfs/dbraw/zinc/83/06/21/1036830621.db2.gz UMEIPXRCMTWDNZ-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc([C@@H]2CCC[C@@H]3C[C@@H]32)no1)c1ccccc1 ZINC000656050843 1036848910 /nfs/dbraw/zinc/84/89/10/1036848910.db2.gz HXRXNWJRZKTTDA-WCXIOVBPSA-N 1 2 311.429 4.014 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc([C@@H]2CCC[C@@H]3C[C@@H]32)no1)c1ccccc1 ZINC000656050843 1036848918 /nfs/dbraw/zinc/84/89/18/1036848918.db2.gz HXRXNWJRZKTTDA-WCXIOVBPSA-N 1 2 311.429 4.014 20 0 DIADLO Cc1cc(NC(=O)c2cccnc2Sc2ccccc2)cc[nH+]1 ZINC000066351261 1036943848 /nfs/dbraw/zinc/94/38/48/1036943848.db2.gz TXNNSPBJDQHNAE-UHFFFAOYSA-N 1 2 321.405 4.189 20 0 DIADLO Cc1noc([C@H](C)[N@H+](C)Cc2ccc(-c3ccccc3)s2)n1 ZINC000580095262 1036946385 /nfs/dbraw/zinc/94/63/85/1036946385.db2.gz NRPYMEBLJZJFNT-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1noc([C@H](C)[N@@H+](C)Cc2ccc(-c3ccccc3)s2)n1 ZINC000580095262 1036946403 /nfs/dbraw/zinc/94/64/03/1036946403.db2.gz NRPYMEBLJZJFNT-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO COc1cc(Nc2cnc(Cl)c(C(F)(F)F)c2)cc(C)[nH+]1 ZINC001210773711 1036951720 /nfs/dbraw/zinc/95/17/20/1036951720.db2.gz DLMULITZSPAGNP-UHFFFAOYSA-N 1 2 317.698 4.209 20 0 DIADLO COc1cc(Nc2c(Cl)c(F)nc(F)c2Cl)cc(C)[nH+]1 ZINC001210775445 1036953691 /nfs/dbraw/zinc/95/36/91/1036953691.db2.gz FMJKLVMXOYJVNI-UHFFFAOYSA-N 1 2 320.126 4.122 20 0 DIADLO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)s1 ZINC000683822082 1036970069 /nfs/dbraw/zinc/97/00/69/1036970069.db2.gz KRIRYJNFASSVAJ-BQBZGAKWSA-N 1 2 321.393 4.339 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@@H+](Cc2ccc3cnccc3c2)C1 ZINC000683832869 1036992961 /nfs/dbraw/zinc/99/29/61/1036992961.db2.gz NANNXGOULHSABR-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@H+](Cc2ccc3cnccc3c2)C1 ZINC000683832869 1036992972 /nfs/dbraw/zinc/99/29/72/1036992972.db2.gz NANNXGOULHSABR-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO Cc1nsc(C)c1C[NH2+][C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000568163379 1036995878 /nfs/dbraw/zinc/99/58/78/1036995878.db2.gz VYHQDPLBIRPPKX-ZETCQYMHSA-N 1 2 321.393 4.086 20 0 DIADLO Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]Cc1cn[nH]c1C ZINC000124718629 1037023211 /nfs/dbraw/zinc/02/32/11/1037023211.db2.gz PLPOMRFNYWLSAX-QGZVFWFLSA-N 1 2 311.454 4.162 20 0 DIADLO FC(F)(F)c1nn(C/C=C\c2ccccc2)c2cc[nH+]cc21 ZINC000255392450 1037050514 /nfs/dbraw/zinc/05/05/14/1037050514.db2.gz SAFTZKLOQMVKQY-DAXSKMNVSA-N 1 2 303.287 4.164 20 0 DIADLO COc1ccc(C[NH+]2Cc3ccccc3-c3ccccc3C2)o1 ZINC001204534017 1037064543 /nfs/dbraw/zinc/06/45/43/1037064543.db2.gz NYKBGXSHAYNGHU-UHFFFAOYSA-N 1 2 305.377 4.471 20 0 DIADLO CC[C@H]1CCC[N@@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1 ZINC001167382123 1037066735 /nfs/dbraw/zinc/06/67/35/1037066735.db2.gz VJBIDPQDKCHITD-XJKSGUPXSA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@H]1CCC[N@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1 ZINC001167382123 1037066750 /nfs/dbraw/zinc/06/67/50/1037066750.db2.gz VJBIDPQDKCHITD-XJKSGUPXSA-N 1 2 309.837 4.066 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3ccccn3)cs2)cc1 ZINC000071081369 1037071416 /nfs/dbraw/zinc/07/14/16/1037071416.db2.gz RFHWUUXVRPVGNL-AWEZNQCLSA-N 1 2 309.438 4.364 20 0 DIADLO Cc1ccc(Nc2ccccc2CNC(=O)OC(C)(C)C)[nH+]c1 ZINC001211012221 1037093163 /nfs/dbraw/zinc/09/31/63/1037093163.db2.gz BRHIYGPRGIORGY-UHFFFAOYSA-N 1 2 313.401 4.158 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cc2ccccc2[nH]1 ZINC000683923967 1037103837 /nfs/dbraw/zinc/10/38/37/1037103837.db2.gz MJKWCZBWSDAAKG-UHFFFAOYSA-N 1 2 308.360 4.289 20 0 DIADLO CC[C@@H]1C[N@H+](CCc2cccc(Cl)c2Cl)C[C@@H](C)O1 ZINC001167421659 1037218765 /nfs/dbraw/zinc/21/87/65/1037218765.db2.gz ZPBKGZGCGGJVOQ-DGCLKSJQSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)C[C@@H](C)O1 ZINC001167421659 1037218782 /nfs/dbraw/zinc/21/87/82/1037218782.db2.gz ZPBKGZGCGGJVOQ-DGCLKSJQSA-N 1 2 302.245 4.035 20 0 DIADLO CC(C)[C@@H]1CCC[N@H+](Cc2ncsc2Br)CC1 ZINC001167426119 1037231072 /nfs/dbraw/zinc/23/10/72/1037231072.db2.gz USQKZLUWZWCFFY-LLVKDONJSA-N 1 2 317.296 4.164 20 0 DIADLO CC(C)[C@@H]1CCC[N@@H+](Cc2ncsc2Br)CC1 ZINC001167426119 1037231083 /nfs/dbraw/zinc/23/10/83/1037231083.db2.gz USQKZLUWZWCFFY-LLVKDONJSA-N 1 2 317.296 4.164 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)CCc2ccc(F)cc2)c(C)[nH+]1 ZINC001125473792 1037302924 /nfs/dbraw/zinc/30/29/24/1037302924.db2.gz MRSPFEWBFDHCTK-GFCCVEGCSA-N 1 2 314.404 4.353 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1ccc2ccccc2n1 ZINC000317452902 1037321396 /nfs/dbraw/zinc/32/13/96/1037321396.db2.gz NPYSEDSIVKFUJU-UHFFFAOYSA-N 1 2 312.800 4.187 20 0 DIADLO O=C(CCc1ccc2ccccc2c1)Nc1ccn2cc[nH+]c2c1 ZINC000580849722 1037332076 /nfs/dbraw/zinc/33/20/76/1037332076.db2.gz RZQIBBKKCVDOBA-UHFFFAOYSA-N 1 2 315.376 4.059 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]C2(c3c(F)cccc3F)CCC2)c(C)n1 ZINC000624345155 1037349532 /nfs/dbraw/zinc/34/95/32/1037349532.db2.gz YWITXKDEYUUIRA-GFCCVEGCSA-N 1 2 317.383 4.102 20 0 DIADLO CC(C)(C)c1cc(C[NH+]2CCC(OC3CCCCC3)CC2)no1 ZINC000581040419 1037414606 /nfs/dbraw/zinc/41/46/06/1037414606.db2.gz SYQXXPGZQCZNLU-UHFFFAOYSA-N 1 2 320.477 4.286 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCCc3sccc3C2)s1 ZINC000684143395 1037431669 /nfs/dbraw/zinc/43/16/69/1037431669.db2.gz WOJDPMJVEYLKPV-UHFFFAOYSA-N 1 2 306.500 4.451 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCCc3sccc3C2)s1 ZINC000684143395 1037431680 /nfs/dbraw/zinc/43/16/80/1037431680.db2.gz WOJDPMJVEYLKPV-UHFFFAOYSA-N 1 2 306.500 4.451 20 0 DIADLO Cc1nccnc1C[N@@H+](C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000621711203 1037435783 /nfs/dbraw/zinc/43/57/83/1037435783.db2.gz JGKAFNHBQJLVFV-NSHDSACASA-N 1 2 310.228 4.285 20 0 DIADLO Cc1nccnc1C[N@H+](C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000621711203 1037435791 /nfs/dbraw/zinc/43/57/91/1037435791.db2.gz JGKAFNHBQJLVFV-NSHDSACASA-N 1 2 310.228 4.285 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(-c2ccco2)no1)c1ccc(Cl)cc1 ZINC000029979309 1037437593 /nfs/dbraw/zinc/43/75/93/1037437593.db2.gz FQAMBPBPBXBAHO-ZDUSSCGKSA-N 1 2 317.776 4.224 20 0 DIADLO CCc1ncc(Br)cc1Nc1c[nH+]cc(C)c1C ZINC001213528595 1037443357 /nfs/dbraw/zinc/44/33/57/1037443357.db2.gz HSAQDXRUVOLOPY-UHFFFAOYSA-N 1 2 306.207 4.162 20 0 DIADLO Cc1c[nH+]cc(Nc2cc(Br)cc(C)c2N)c1C ZINC001213531000 1037470201 /nfs/dbraw/zinc/47/02/01/1037470201.db2.gz RQPWTUHQWYHUFY-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO Cc1ncccc1C[N@@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001207155165 1037470115 /nfs/dbraw/zinc/47/01/15/1037470115.db2.gz NWZOWUCVMKKAPZ-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ncccc1C[N@H+]1CCSC[C@@H]1c1cccc(Cl)c1 ZINC001207155165 1037470119 /nfs/dbraw/zinc/47/01/19/1037470119.db2.gz NWZOWUCVMKKAPZ-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1c(Cl)nc2ccccn21 ZINC000157803682 1037498355 /nfs/dbraw/zinc/49/83/55/1037498355.db2.gz YLBUYVLTJYSQAO-LLVKDONJSA-N 1 2 305.834 4.242 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1c(Cl)nc2ccccn21 ZINC000157803682 1037498361 /nfs/dbraw/zinc/49/83/61/1037498361.db2.gz YLBUYVLTJYSQAO-LLVKDONJSA-N 1 2 305.834 4.242 20 0 DIADLO CCc1cnc(C[N@@H+]2CCc3ccccc3[C@H]2c2ccccc2)o1 ZINC000581358518 1037552530 /nfs/dbraw/zinc/55/25/30/1037552530.db2.gz UEOZCGYKJOXKJJ-OAQYLSRUSA-N 1 2 318.420 4.385 20 0 DIADLO CCc1cnc(C[N@H+]2CCc3ccccc3[C@H]2c2ccccc2)o1 ZINC000581358518 1037552544 /nfs/dbraw/zinc/55/25/44/1037552544.db2.gz UEOZCGYKJOXKJJ-OAQYLSRUSA-N 1 2 318.420 4.385 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+][C@@H](c2ccccc2)C(C)(C)C)o1 ZINC000068811987 1037555341 /nfs/dbraw/zinc/55/53/41/1037555341.db2.gz XWMICEQKWBNOGI-HNNXBMFYSA-N 1 2 301.434 4.244 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+]Cc1cc(F)cnc1Cl ZINC000834840880 1037602031 /nfs/dbraw/zinc/60/20/31/1037602031.db2.gz NKNDIJFPKYMAMY-LLVKDONJSA-N 1 2 308.784 4.124 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2cc(Cl)cc3c2OCC3)sc1C ZINC000933273216 1037615479 /nfs/dbraw/zinc/61/54/79/1037615479.db2.gz QVUWLIYPYJFDDV-JTQLQIEISA-N 1 2 322.861 4.199 20 0 DIADLO CCC(CC)N(C(=O)CCCn1cc[nH+]c1)c1cccc(C)c1 ZINC000684247328 1037621880 /nfs/dbraw/zinc/62/18/80/1037621880.db2.gz JTGOTTADVFXJGP-UHFFFAOYSA-N 1 2 313.445 4.194 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2csc(Cl)c2)cs1 ZINC000276304547 1037692935 /nfs/dbraw/zinc/69/29/35/1037692935.db2.gz DKMZSZIWQUMVST-BDAKNGLRSA-N 1 2 316.879 4.416 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)ccc1F ZINC001204561803 1037700281 /nfs/dbraw/zinc/70/02/81/1037700281.db2.gz VANARWVXSIQXBJ-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)ccc1F ZINC001204561803 1037700299 /nfs/dbraw/zinc/70/02/99/1037700299.db2.gz VANARWVXSIQXBJ-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO c1c(C[NH2+]C(c2ccccc2)c2ccccc2)onc1C1CC1 ZINC000656637661 1037722847 /nfs/dbraw/zinc/72/28/47/1037722847.db2.gz OOEUKAVGTTUBPC-UHFFFAOYSA-N 1 2 304.393 4.431 20 0 DIADLO Cc1cn2cc(NC(=O)C[C@H](C)c3ccccc3C)ccc2[nH+]1 ZINC000341201231 1037737168 /nfs/dbraw/zinc/73/71/68/1037737168.db2.gz FUDQJBLUCWCKMC-AWEZNQCLSA-N 1 2 307.397 4.083 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)n1 ZINC000581571363 1037741770 /nfs/dbraw/zinc/74/17/70/1037741770.db2.gz JSHLZPOUNKGBAL-LBPRGKRZSA-N 1 2 313.376 4.165 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(Cc2ccccc2C)o1)c1ccccc1 ZINC000341208861 1037746230 /nfs/dbraw/zinc/74/62/30/1037746230.db2.gz FOESJPNEFLSKHZ-SFHVURJKSA-N 1 2 321.424 4.210 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1ccc(F)c(F)c1 ZINC000090228341 1037764715 /nfs/dbraw/zinc/76/47/15/1037764715.db2.gz IFQSDPSBUXFUJH-ZETCQYMHSA-N 1 2 319.248 4.372 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1nc2c(s1)CCC2 ZINC000656781284 1037861004 /nfs/dbraw/zinc/86/10/04/1037861004.db2.gz MKMSUFVURJSVDW-UHFFFAOYSA-N 1 2 312.442 4.175 20 0 DIADLO c1ccc(-c2ncc(CNc3c[nH+]cc4c3CCCC4)cn2)cc1 ZINC000656776451 1037862669 /nfs/dbraw/zinc/86/26/69/1037862669.db2.gz NYAFVKWMGHIXIA-UHFFFAOYSA-N 1 2 316.408 4.030 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2csc(C(C)C)n2)cc1[N+](=O)[O-] ZINC000076900200 1037864213 /nfs/dbraw/zinc/86/42/13/1037864213.db2.gz DRZNXDPTNNDIEK-GFCCVEGCSA-N 1 2 319.430 4.334 20 0 DIADLO c1onc(Cc2ccccc2)c1CNc1c[nH+]cc2c1CCCC2 ZINC000656776190 1037865375 /nfs/dbraw/zinc/86/53/75/1037865375.db2.gz KOSZOQJACDSBOB-UHFFFAOYSA-N 1 2 319.408 4.151 20 0 DIADLO C[C@@]1([NH2+]Cc2cc(-c3ccccc3)on2)CCOc2ccccc21 ZINC000933367713 1037897848 /nfs/dbraw/zinc/89/78/48/1037897848.db2.gz XHGDHMGYRBCMBI-HXUWFJFHSA-N 1 2 320.392 4.129 20 0 DIADLO CC(C)([NH2+]Cc1cccc(OCc2ccccc2)c1)C(F)F ZINC000684414734 1037962849 /nfs/dbraw/zinc/96/28/49/1037962849.db2.gz RHEGKDGIQMYIHW-UHFFFAOYSA-N 1 2 305.368 4.399 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)[C@@H](C)[N@H+](C)Cc1ccsc1 ZINC000127283892 1037978544 /nfs/dbraw/zinc/97/85/44/1037978544.db2.gz AWWVQAARBQRNPL-GFCCVEGCSA-N 1 2 322.861 4.169 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccsc1 ZINC000127283892 1037978552 /nfs/dbraw/zinc/97/85/52/1037978552.db2.gz AWWVQAARBQRNPL-GFCCVEGCSA-N 1 2 322.861 4.169 20 0 DIADLO CCn1cc(C[N@H+](Cc2ccco2)Cc2cccs2)c(C)n1 ZINC000891474811 1037980904 /nfs/dbraw/zinc/98/09/04/1037980904.db2.gz WPUGYZWCQOGPQR-UHFFFAOYSA-N 1 2 315.442 4.068 20 0 DIADLO CCn1cc(C[N@@H+](Cc2ccco2)Cc2cccs2)c(C)n1 ZINC000891474811 1037980922 /nfs/dbraw/zinc/98/09/22/1037980922.db2.gz WPUGYZWCQOGPQR-UHFFFAOYSA-N 1 2 315.442 4.068 20 0 DIADLO C[C@@H](CC(=O)N1C[C@@H](C(C)(C)C)c2ccccc21)n1cc[nH+]c1 ZINC000521051489 1037981114 /nfs/dbraw/zinc/98/11/14/1037981114.db2.gz DBUHXPVJDRQUGN-GOEBONIOSA-N 1 2 311.429 4.011 20 0 DIADLO C[C@H](Nc1cc[nH+]c2[nH]cc(C(F)(F)F)c21)c1ccc(F)cn1 ZINC001167482900 1037994803 /nfs/dbraw/zinc/99/48/03/1037994803.db2.gz FVLREKAVTYLZFN-QMMMGPOBSA-N 1 2 324.281 4.289 20 0 DIADLO COc1ccc(C2([NH2+]Cc3csc(C(C)(C)C)n3)CC2)cc1 ZINC000598038077 1038002555 /nfs/dbraw/zinc/00/25/55/1038002555.db2.gz YIAQOXIYYDTWEE-UHFFFAOYSA-N 1 2 316.470 4.228 20 0 DIADLO CCCOc1ccc(C(C)(C)[NH2+]Cc2n[nH]c3ccccc32)cc1 ZINC000684428511 1038016193 /nfs/dbraw/zinc/01/61/93/1038016193.db2.gz AYUIQWREMHTWKX-UHFFFAOYSA-N 1 2 323.440 4.377 20 0 DIADLO Cc1nc(CCNc2cc[nH+]c3c(Cl)cccc23)cs1 ZINC000341429171 1038018298 /nfs/dbraw/zinc/01/82/98/1038018298.db2.gz JGNXGZBDIWZJHP-UHFFFAOYSA-N 1 2 303.818 4.308 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+][C@H](COCC(C)C)c2ccco2)s1 ZINC000090406794 1038036797 /nfs/dbraw/zinc/03/67/97/1038036797.db2.gz JJLOYXAWJMMDHB-TZMCWYRMSA-N 1 2 308.447 4.109 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)n1 ZINC000341460137 1038041533 /nfs/dbraw/zinc/04/15/33/1038041533.db2.gz QTUDIAULZGTTBF-HNNXBMFYSA-N 1 2 319.424 4.428 20 0 DIADLO COc1cc(F)c(F)cc1C[N@@H+](C)[C@@H](C)c1ccccc1OC ZINC001143399934 1038050126 /nfs/dbraw/zinc/05/01/26/1038050126.db2.gz FVHCTQJILXJFIC-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1cc(F)c(F)cc1C[N@H+](C)[C@@H](C)c1ccccc1OC ZINC001143399934 1038050151 /nfs/dbraw/zinc/05/01/51/1038050151.db2.gz FVHCTQJILXJFIC-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO Cc1cc(N(Cc2ccc(F)cc2F)C2CC2)nc(C2CC2)[nH+]1 ZINC000341473019 1038055877 /nfs/dbraw/zinc/05/58/77/1038055877.db2.gz CTQGPPMOSQOYTR-UHFFFAOYSA-N 1 2 315.367 4.110 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1cnc(C2CCC2)s1 ZINC000341490721 1038058713 /nfs/dbraw/zinc/05/87/13/1038058713.db2.gz UKEKLQPMPOYDRY-CYBMUJFWSA-N 1 2 314.454 4.194 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1cnc(C2CCC2)s1 ZINC000341490721 1038058731 /nfs/dbraw/zinc/05/87/31/1038058731.db2.gz UKEKLQPMPOYDRY-CYBMUJFWSA-N 1 2 314.454 4.194 20 0 DIADLO c1cn(-c2cccc(OCc3coc(-c4ccccc4)n3)c2)c[nH+]1 ZINC000156925692 1038061434 /nfs/dbraw/zinc/06/14/34/1038061434.db2.gz VCSTZYURFPEVNH-UHFFFAOYSA-N 1 2 317.348 4.106 20 0 DIADLO Cc1cc(N2CC=C(c3ccc(F)cc3)CC2)nc(C2CC2)[nH+]1 ZINC000341494900 1038062584 /nfs/dbraw/zinc/06/25/84/1038062584.db2.gz YNYFWCAIFIFFLO-UHFFFAOYSA-N 1 2 309.388 4.095 20 0 DIADLO Cc1cnc(C[NH2+][C@H](C)c2ccc(-c3csc(C)n3)cc2)o1 ZINC000341589741 1038156110 /nfs/dbraw/zinc/15/61/10/1038156110.db2.gz GMNDOZNSAJVQEO-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1nc2cccnc2s1 ZINC000341607937 1038174371 /nfs/dbraw/zinc/17/43/71/1038174371.db2.gz RDCPTDSFDVOGRM-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1nc2cccnc2s1 ZINC000341607937 1038174375 /nfs/dbraw/zinc/17/43/75/1038174375.db2.gz RDCPTDSFDVOGRM-LLVKDONJSA-N 1 2 301.390 4.023 20 0 DIADLO Cc1cc(N(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)nc(C2CC2)[nH+]1 ZINC000581965653 1038180224 /nfs/dbraw/zinc/18/02/24/1038180224.db2.gz RHMCMUVIQLUGDI-BETUJISGSA-N 1 2 313.367 4.220 20 0 DIADLO Cc1cc(NC(=O)C=Cc2ccc(F)c3ccccc23)c(C)c[nH+]1 ZINC001266899543 1038205057 /nfs/dbraw/zinc/20/50/57/1038205057.db2.gz HAWMOIHORBGCFC-NTMALXAHSA-N 1 2 320.367 4.065 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1ncc(C)o1)c1ccccc1OC(F)F ZINC000341659277 1038210885 /nfs/dbraw/zinc/21/08/85/1038210885.db2.gz NHXVXQSFFWCOMM-AAEUAGOBSA-N 1 2 310.344 4.386 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1ccc(C)s1)c1ccccn1 ZINC000089797077 1038227122 /nfs/dbraw/zinc/22/71/22/1038227122.db2.gz BSBRZKGWOJBMMG-LJQANCHMSA-N 1 2 324.449 4.339 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1cc(Cl)cs1 ZINC001232280326 1038234337 /nfs/dbraw/zinc/23/43/37/1038234337.db2.gz MJNXRGLMYSGXKI-UHFFFAOYSA-N 1 2 307.846 4.495 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1cc(Cl)cs1 ZINC001232280326 1038234346 /nfs/dbraw/zinc/23/43/46/1038234346.db2.gz MJNXRGLMYSGXKI-UHFFFAOYSA-N 1 2 307.846 4.495 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1ccn(C(C)C)n1)c1cc(F)ccc1F ZINC000684552607 1038257272 /nfs/dbraw/zinc/25/72/72/1038257272.db2.gz FZLLNNJGYPJNCX-KRWDZBQOSA-N 1 2 307.388 4.229 20 0 DIADLO CC(C)(C)OCCCSCc1ccc(-n2cc[nH+]c2)cc1 ZINC000610703760 1038262942 /nfs/dbraw/zinc/26/29/42/1038262942.db2.gz FIZGLHLAMSEBQG-UHFFFAOYSA-N 1 2 304.459 4.311 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001143413389 1038266310 /nfs/dbraw/zinc/26/63/10/1038266310.db2.gz PJWOLVFLFPJZLR-UHFFFAOYSA-N 1 2 315.363 4.263 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+]1CC=C(c2ccccc2)CC1 ZINC001143413389 1038266322 /nfs/dbraw/zinc/26/63/22/1038266322.db2.gz PJWOLVFLFPJZLR-UHFFFAOYSA-N 1 2 315.363 4.263 20 0 DIADLO CC(C)c1ccc(C[S@@](=O)Cc2c[nH+]cn2C)c(C(C)C)c1 ZINC000610715286 1038269684 /nfs/dbraw/zinc/26/96/84/1038269684.db2.gz LPHGWZSZQXOHCY-JOCHJYFZSA-N 1 2 318.486 4.116 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1)Cc1c(F)c(F)ccc1OC ZINC001143413972 1038270298 /nfs/dbraw/zinc/27/02/98/1038270298.db2.gz XFXJCBWYQBWGQV-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1)Cc1c(F)c(F)ccc1OC ZINC001143413972 1038270305 /nfs/dbraw/zinc/27/03/05/1038270305.db2.gz XFXJCBWYQBWGQV-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO Cc1cn2cc(NC(=O)N(C)[C@H](C)c3ccc(C)cc3)ccc2[nH+]1 ZINC000599405767 1038279180 /nfs/dbraw/zinc/27/91/80/1038279180.db2.gz OMBLVQPKWAARPK-OAHLLOKOSA-N 1 2 322.412 4.176 20 0 DIADLO CC[C@@H](C)[C@H](C(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC000603785518 1038281074 /nfs/dbraw/zinc/28/10/74/1038281074.db2.gz SQDBPXKBEAIDMU-KDOFPFPSSA-N 1 2 307.397 4.103 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cnc3ccccc3c2)c1 ZINC000761342388 1038284011 /nfs/dbraw/zinc/28/40/11/1038284011.db2.gz KRDPFBHACPZETG-UHFFFAOYSA-N 1 2 309.438 4.495 20 0 DIADLO COc1cccc(Cl)c1C[NH2+][C@H](C)c1ccc(Cl)cn1 ZINC000276935597 1038286523 /nfs/dbraw/zinc/28/65/23/1038286523.db2.gz SWXQVKSASCHBJB-SNVBAGLBSA-N 1 2 311.212 4.248 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1ccc(F)cc1F ZINC000341849212 1038296199 /nfs/dbraw/zinc/29/61/99/1038296199.db2.gz XWCMXTKUKXXXGN-AWEZNQCLSA-N 1 2 320.314 4.486 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](c2ccc(Cl)cc2)[C@H](C)CC)o1 ZINC000341857941 1038298278 /nfs/dbraw/zinc/29/82/78/1038298278.db2.gz FRYHAHRTELQTGR-BDJLRTHQSA-N 1 2 307.825 4.162 20 0 DIADLO CCn1c2ccccc2nc1C[N@H+](Cc1cccc(F)c1)C1CC1 ZINC000535782670 1038337911 /nfs/dbraw/zinc/33/79/11/1038337911.db2.gz JVRBMEZOLXHLEA-UHFFFAOYSA-N 1 2 323.415 4.360 20 0 DIADLO CCn1c2ccccc2nc1C[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000535782670 1038337921 /nfs/dbraw/zinc/33/79/21/1038337921.db2.gz JVRBMEZOLXHLEA-UHFFFAOYSA-N 1 2 323.415 4.360 20 0 DIADLO COc1ccccc1C[N@H+](Cc1cccc(OC)c1F)C1CC1 ZINC000669707281 1038341459 /nfs/dbraw/zinc/34/14/59/1038341459.db2.gz JYPBQWLHLADXNJ-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1cccc(OC)c1F)C1CC1 ZINC000669707281 1038341476 /nfs/dbraw/zinc/34/14/76/1038341476.db2.gz JYPBQWLHLADXNJ-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO COc1cccc(Cl)c1C[N@H+](Cc1ccccn1)C(C)C ZINC000535813680 1038344665 /nfs/dbraw/zinc/34/46/65/1038344665.db2.gz OBAGHXBOFCOAMI-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+](Cc1ccccn1)C(C)C ZINC000535813680 1038344681 /nfs/dbraw/zinc/34/46/81/1038344681.db2.gz OBAGHXBOFCOAMI-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO C[N@H+](Cc1csc(-c2ccoc2)n1)Cc1cccc(F)c1 ZINC000341935311 1038354048 /nfs/dbraw/zinc/35/40/48/1038354048.db2.gz NERKYVYWCCFDLA-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1csc(-c2ccoc2)n1)Cc1cccc(F)c1 ZINC000341935311 1038354062 /nfs/dbraw/zinc/35/40/62/1038354062.db2.gz NERKYVYWCCFDLA-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO c1nc(N2CCC3(CCCCC3)CC2)cc(N2CCCCC2)[nH+]1 ZINC000599838152 1038359274 /nfs/dbraw/zinc/35/92/74/1038359274.db2.gz GFQIBHMISDSFCA-UHFFFAOYSA-N 1 2 314.477 4.018 20 0 DIADLO c1nc(N2CCCCC2)cc(N2CCC3(CCCCC3)CC2)[nH+]1 ZINC000599838152 1038359290 /nfs/dbraw/zinc/35/92/90/1038359290.db2.gz GFQIBHMISDSFCA-UHFFFAOYSA-N 1 2 314.477 4.018 20 0 DIADLO c1cc(-c2nc(C[N@@H+]3CCC=C(c4ccccc4)C3)no2)cs1 ZINC000341995781 1038363172 /nfs/dbraw/zinc/36/31/72/1038363172.db2.gz SAAYXZXCVRBCHH-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO c1cc(-c2nc(C[N@H+]3CCC=C(c4ccccc4)C3)no2)cs1 ZINC000341995781 1038363181 /nfs/dbraw/zinc/36/31/81/1038363181.db2.gz SAAYXZXCVRBCHH-UHFFFAOYSA-N 1 2 323.421 4.087 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC000342066706 1038384491 /nfs/dbraw/zinc/38/44/91/1038384491.db2.gz JICYZJXRUROWNP-HUUCEWRRSA-N 1 2 307.397 4.457 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)n1 ZINC000097120363 1038411743 /nfs/dbraw/zinc/41/17/43/1038411743.db2.gz JNTCGABUXKSFTC-RYUDHWBXSA-N 1 2 307.825 4.477 20 0 DIADLO CC[C@]1(C)CC[N@H+](Cc2c(F)ccc(Br)c2F)C1 ZINC000399494378 1038435117 /nfs/dbraw/zinc/43/51/17/1038435117.db2.gz VYFZYKWPZJLGDO-CQSZACIVSA-N 1 2 318.205 4.349 20 0 DIADLO CC[C@]1(C)CC[N@@H+](Cc2c(F)ccc(Br)c2F)C1 ZINC000399494378 1038435124 /nfs/dbraw/zinc/43/51/24/1038435124.db2.gz VYFZYKWPZJLGDO-CQSZACIVSA-N 1 2 318.205 4.349 20 0 DIADLO CC(C)C[N@H+](Cc1ccn(C(C)C)n1)Cc1ccccc1F ZINC000604884894 1038460889 /nfs/dbraw/zinc/46/08/89/1038460889.db2.gz OTWINPDYAMPVHS-UHFFFAOYSA-N 1 2 303.425 4.261 20 0 DIADLO CC(C)C[N@@H+](Cc1ccn(C(C)C)n1)Cc1ccccc1F ZINC000604884894 1038460897 /nfs/dbraw/zinc/46/08/97/1038460897.db2.gz OTWINPDYAMPVHS-UHFFFAOYSA-N 1 2 303.425 4.261 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H]2CC(C)(C)Cc3occc32)[nH]1 ZINC000277296339 1038490714 /nfs/dbraw/zinc/49/07/14/1038490714.db2.gz RPQANIJXUVIPMB-SGMGOOAPSA-N 1 2 316.449 4.276 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)c2csc(Cl)c2)[nH]1 ZINC000277298854 1038491438 /nfs/dbraw/zinc/49/14/38/1038491438.db2.gz RVBULWMAXNZXEP-AEJSXWLSSA-N 1 2 312.870 4.445 20 0 DIADLO CCc1ccc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)nc1 ZINC000582015664 1038493070 /nfs/dbraw/zinc/49/30/70/1038493070.db2.gz KEVJBSASGGZTPV-UHFFFAOYSA-N 1 2 302.368 4.087 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)nc1 ZINC000582015664 1038493074 /nfs/dbraw/zinc/49/30/74/1038493074.db2.gz KEVJBSASGGZTPV-UHFFFAOYSA-N 1 2 302.368 4.087 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3cncs3)cs2)o1 ZINC000934193181 1038506046 /nfs/dbraw/zinc/50/60/46/1038506046.db2.gz DVRIUCIHJOTDSF-JTQLQIEISA-N 1 2 305.428 4.019 20 0 DIADLO Clc1ccc(/C=C\C[N@@H+]2CCO[C@H](c3ccco3)C2)cc1 ZINC000255161441 1038570705 /nfs/dbraw/zinc/57/07/05/1038570705.db2.gz PEYFCJAKEXIYLH-MPXGXIRNSA-N 1 2 303.789 4.020 20 0 DIADLO Clc1ccc(/C=C\C[N@H+]2CCO[C@H](c3ccco3)C2)cc1 ZINC000255161441 1038570713 /nfs/dbraw/zinc/57/07/13/1038570713.db2.gz PEYFCJAKEXIYLH-MPXGXIRNSA-N 1 2 303.789 4.020 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1nnc(C(C)C)s1)C(C)(C)C ZINC000934288560 1038579553 /nfs/dbraw/zinc/57/95/53/1038579553.db2.gz WGHGYPHHACRHMN-OAHLLOKOSA-N 1 2 318.490 4.242 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ccc(F)c(F)c3F)CCC2)n1 ZINC000657340615 1038582946 /nfs/dbraw/zinc/58/29/46/1038582946.db2.gz RMBQHBFQDUKICH-UHFFFAOYSA-N 1 2 312.360 4.038 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1nc2ccccc2o1)C(C)(C)C ZINC000934295310 1038583882 /nfs/dbraw/zinc/58/38/82/1038583882.db2.gz WCITXUWREYNMOA-SFHVURJKSA-N 1 2 309.413 4.408 20 0 DIADLO O=C(CC/C=C\c1ccccc1)Nc1ccccc1-n1cc[nH+]c1 ZINC000606350437 1038593389 /nfs/dbraw/zinc/59/33/89/1038593389.db2.gz BHUDBMPTFOWLFH-WMZJFQQLSA-N 1 2 317.392 4.304 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2csc(NC(=O)CCC(C)(C)C)n2)C1 ZINC000606355909 1038593731 /nfs/dbraw/zinc/59/37/31/1038593731.db2.gz ATVTXHBCYBKFEI-ZDUSSCGKSA-N 1 2 323.506 4.140 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2csc(NC(=O)CCC(C)(C)C)n2)C1 ZINC000606355909 1038593742 /nfs/dbraw/zinc/59/37/42/1038593742.db2.gz ATVTXHBCYBKFEI-ZDUSSCGKSA-N 1 2 323.506 4.140 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2csc(NC(=O)CCC(C)(C)C)n2)C1 ZINC000606355908 1038594343 /nfs/dbraw/zinc/59/43/43/1038594343.db2.gz ATVTXHBCYBKFEI-CYBMUJFWSA-N 1 2 323.506 4.140 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2csc(NC(=O)CCC(C)(C)C)n2)C1 ZINC000606355908 1038594347 /nfs/dbraw/zinc/59/43/47/1038594347.db2.gz ATVTXHBCYBKFEI-CYBMUJFWSA-N 1 2 323.506 4.140 20 0 DIADLO CCc1ccc(-c2nc(C[N@@H+]3CCSC[C@@H]3C)cs2)cc1 ZINC000606451896 1038604681 /nfs/dbraw/zinc/60/46/81/1038604681.db2.gz OAQSZQJPLZDOEH-ZDUSSCGKSA-N 1 2 318.511 4.310 20 0 DIADLO CCc1ccc(-c2nc(C[N@H+]3CCSC[C@@H]3C)cs2)cc1 ZINC000606451896 1038604685 /nfs/dbraw/zinc/60/46/85/1038604685.db2.gz OAQSZQJPLZDOEH-ZDUSSCGKSA-N 1 2 318.511 4.310 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000342443921 1038608176 /nfs/dbraw/zinc/60/81/76/1038608176.db2.gz HKCZKWVZWYVZHS-HNNXBMFYSA-N 1 2 318.442 4.097 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000342443921 1038608182 /nfs/dbraw/zinc/60/81/82/1038608182.db2.gz HKCZKWVZWYVZHS-HNNXBMFYSA-N 1 2 318.442 4.097 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2ccc(F)c(F)c2F)sc1C ZINC000657367064 1038611193 /nfs/dbraw/zinc/61/11/93/1038611193.db2.gz FPAOLYMWEVTUOS-UHFFFAOYSA-N 1 2 314.376 4.202 20 0 DIADLO C=C(Br)C[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000062640519 1038611961 /nfs/dbraw/zinc/61/19/61/1038611961.db2.gz JISTVIIRUQIDPE-CYBMUJFWSA-N 1 2 300.627 4.386 20 0 DIADLO C=C(Br)C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000062640519 1038611969 /nfs/dbraw/zinc/61/19/69/1038611969.db2.gz JISTVIIRUQIDPE-CYBMUJFWSA-N 1 2 300.627 4.386 20 0 DIADLO Cc1cccc2[nH]c(C[NH2+][C@H](c3nc(C4CC4)no3)C(C)C)cc21 ZINC000657367801 1038613503 /nfs/dbraw/zinc/61/35/03/1038613503.db2.gz RFGQFAJVXNXPPO-KRWDZBQOSA-N 1 2 324.428 4.224 20 0 DIADLO Cc1cn2cc(NC(=O)N[C@H](C)c3cccc(C)c3C)ccc2[nH+]1 ZINC000606569443 1038614038 /nfs/dbraw/zinc/61/40/38/1038614038.db2.gz WSGKFGMUEKBRJC-OAHLLOKOSA-N 1 2 322.412 4.142 20 0 DIADLO Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC000606582939 1038616290 /nfs/dbraw/zinc/61/62/90/1038616290.db2.gz JQPGQFJTIPFXJE-QGZVFWFLSA-N 1 2 320.396 4.012 20 0 DIADLO CC(C)(C)[C@H]1CCCN(C(=O)Nc2ccc3[nH+]ccn3c2)CC1 ZINC000606581749 1038616311 /nfs/dbraw/zinc/61/63/11/1038616311.db2.gz OYUZAECREOFHBG-AWEZNQCLSA-N 1 2 314.433 4.014 20 0 DIADLO CC(C)c1nnc(CNc2cc[nH+]c3c(Cl)cccc23)s1 ZINC000342483521 1038630176 /nfs/dbraw/zinc/63/01/76/1038630176.db2.gz RLFUFINDMCLXCK-UHFFFAOYSA-N 1 2 318.833 4.475 20 0 DIADLO Cc1ccccc1-c1nc(C[NH2+]C(C)(C)c2ccccc2C)no1 ZINC000582348589 1038636463 /nfs/dbraw/zinc/63/64/63/1038636463.db2.gz CRKVOQJKAXUMSD-UHFFFAOYSA-N 1 2 321.424 4.378 20 0 DIADLO CC(C)n1ccnc1C[NH2+][C@H]1CCCOc2c(Cl)cccc21 ZINC000657427295 1038663366 /nfs/dbraw/zinc/66/33/66/1038663366.db2.gz CCLAHHNOYDZGDW-HNNXBMFYSA-N 1 2 319.836 4.121 20 0 DIADLO CC(C)n1ccnc1C[NH2+][C@H]1CCCOc2cc(Cl)ccc21 ZINC000657429001 1038666376 /nfs/dbraw/zinc/66/63/76/1038666376.db2.gz PSOOPKHRESIDGQ-HNNXBMFYSA-N 1 2 319.836 4.121 20 0 DIADLO CC(=O)[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2C(F)(F)F)C1 ZINC001140568526 1038683178 /nfs/dbraw/zinc/68/31/78/1038683178.db2.gz JDJOGQRFVIPWHH-NSHDSACASA-N 1 2 319.754 4.160 20 0 DIADLO CC(=O)[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2C(F)(F)F)C1 ZINC001140568526 1038683180 /nfs/dbraw/zinc/68/31/80/1038683180.db2.gz JDJOGQRFVIPWHH-NSHDSACASA-N 1 2 319.754 4.160 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2ccc(Cl)cc2Cl)c(C)[nH+]1 ZINC000097039957 1038684327 /nfs/dbraw/zinc/68/43/27/1038684327.db2.gz NMDXLYGFVAEHIE-UHFFFAOYSA-N 1 2 323.223 4.495 20 0 DIADLO C[N@H+](Cc1ccoc1)Cc1c(Cl)cccc1N1CCCC1 ZINC000342632219 1038694057 /nfs/dbraw/zinc/69/40/57/1038694057.db2.gz HCIWDHWUROUVTE-UHFFFAOYSA-N 1 2 304.821 4.165 20 0 DIADLO C[N@@H+](Cc1ccoc1)Cc1c(Cl)cccc1N1CCCC1 ZINC000342632219 1038694065 /nfs/dbraw/zinc/69/40/65/1038694065.db2.gz HCIWDHWUROUVTE-UHFFFAOYSA-N 1 2 304.821 4.165 20 0 DIADLO Cc1csc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)n1 ZINC000277688821 1038699028 /nfs/dbraw/zinc/69/90/28/1038699028.db2.gz KGCRPBVZMRISQL-UHFFFAOYSA-N 1 2 324.453 4.263 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1ncc(-c2ccccc2F)o1 ZINC000158559805 1038707646 /nfs/dbraw/zinc/70/76/46/1038707646.db2.gz PQBOTWXSOWTKKC-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1ncc(-c2ccccc2F)o1 ZINC000158559805 1038707656 /nfs/dbraw/zinc/70/76/56/1038707656.db2.gz PQBOTWXSOWTKKC-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO Cc1ccc(C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)o1 ZINC000277702601 1038708394 /nfs/dbraw/zinc/70/83/94/1038708394.db2.gz MVGBRJXSGOWVDE-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ncc(-c2cccs2)o1 ZINC000607748063 1038721863 /nfs/dbraw/zinc/72/18/63/1038721863.db2.gz KSTAJZIJQVHHOT-CYBMUJFWSA-N 1 2 310.422 4.350 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ncc(-c2cccs2)o1 ZINC000607748063 1038721871 /nfs/dbraw/zinc/72/18/71/1038721871.db2.gz KSTAJZIJQVHHOT-CYBMUJFWSA-N 1 2 310.422 4.350 20 0 DIADLO COCc1cnc(C[N@H+](C)Cc2cccc3ccccc32)s1 ZINC000342709788 1038731627 /nfs/dbraw/zinc/73/16/27/1038731627.db2.gz ZXDDPIWFEYOBNN-UHFFFAOYSA-N 1 2 312.438 4.075 20 0 DIADLO COCc1cnc(C[N@@H+](C)Cc2cccc3ccccc32)s1 ZINC000342709788 1038731634 /nfs/dbraw/zinc/73/16/34/1038731634.db2.gz ZXDDPIWFEYOBNN-UHFFFAOYSA-N 1 2 312.438 4.075 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2ccc(CC(C)C)cc2)c(C)[nH+]1 ZINC000097213914 1038737606 /nfs/dbraw/zinc/73/76/06/1038737606.db2.gz GKRGUIAYXWBTMC-UHFFFAOYSA-N 1 2 310.441 4.387 20 0 DIADLO c1sc(-c2ccccc2)nc1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000684954323 1038740673 /nfs/dbraw/zinc/74/06/73/1038740673.db2.gz BPSARRPCORWWPS-QGZVFWFLSA-N 1 2 321.449 4.372 20 0 DIADLO C/C(=C\C1CCC(C)CC1)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC001125613837 1038750018 /nfs/dbraw/zinc/75/00/18/1038750018.db2.gz OAQWSJTXQQDFAR-GXDHUFHOSA-N 1 2 311.429 4.354 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc(C2CC2)cs1)c1nc(C)cs1 ZINC000342754647 1038760768 /nfs/dbraw/zinc/76/07/68/1038760768.db2.gz SNWDSFSROKFGPF-HNNXBMFYSA-N 1 2 307.488 4.200 20 0 DIADLO C[N@H+](Cc1nccn1C(F)F)[C@@H]1CCc2ccc(Cl)cc21 ZINC000342764254 1038764166 /nfs/dbraw/zinc/76/41/66/1038764166.db2.gz GVGUZIOSBRSFIC-CYBMUJFWSA-N 1 2 311.763 4.051 20 0 DIADLO C[N@@H+](Cc1nccn1C(F)F)[C@@H]1CCc2ccc(Cl)cc21 ZINC000342764254 1038764172 /nfs/dbraw/zinc/76/41/72/1038764172.db2.gz GVGUZIOSBRSFIC-CYBMUJFWSA-N 1 2 311.763 4.051 20 0 DIADLO Cc1ccc(C(=O)Nc2cccc(CNc3cccc[nH+]3)c2)cc1 ZINC000048786408 1038782055 /nfs/dbraw/zinc/78/20/55/1038782055.db2.gz UKQZEKBFJUSKBQ-UHFFFAOYSA-N 1 2 317.392 4.254 20 0 DIADLO Cc1c[nH+]c(CN2CCc3cc(Cl)cc(Cl)c3[C@@H]2C)n1C ZINC000342797182 1038793880 /nfs/dbraw/zinc/79/38/80/1038793880.db2.gz FCNAWTGOTVNKBK-NSHDSACASA-N 1 2 324.255 4.155 20 0 DIADLO Cc1ccc(-c2cnc(C[N@H+](Cc3ccccn3)C(C)C)o2)cc1 ZINC000075642844 1038813183 /nfs/dbraw/zinc/81/31/83/1038813183.db2.gz YPGSGKNMKNDTNC-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO Cc1ccc(-c2cnc(C[N@@H+](Cc3ccccn3)C(C)C)o2)cc1 ZINC000075642844 1038813215 /nfs/dbraw/zinc/81/32/15/1038813215.db2.gz YPGSGKNMKNDTNC-UHFFFAOYSA-N 1 2 321.424 4.456 20 0 DIADLO COCc1nc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccc(F)c2)cs1 ZINC000075842844 1038826742 /nfs/dbraw/zinc/82/67/42/1038826742.db2.gz GZSZPTDPMOBKMY-MLGOLLRUSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1nc(C[N@H+]2C[C@H](C)C[C@@H]2c2cccc(F)c2)cs1 ZINC000075842844 1038826767 /nfs/dbraw/zinc/82/67/67/1038826767.db2.gz GZSZPTDPMOBKMY-MLGOLLRUSA-N 1 2 320.433 4.012 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2csc(-c3ccc(C)o3)n2)CCS1 ZINC000076072047 1038829083 /nfs/dbraw/zinc/82/90/83/1038829083.db2.gz VQWXOUWGLFOLDM-CYBMUJFWSA-N 1 2 308.472 4.039 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2csc(-c3ccc(C)o3)n2)CCS1 ZINC000076072047 1038829109 /nfs/dbraw/zinc/82/91/09/1038829109.db2.gz VQWXOUWGLFOLDM-CYBMUJFWSA-N 1 2 308.472 4.039 20 0 DIADLO c1ccc(COCc2ccccc2CNc2cccc[nH+]2)cc1 ZINC000076745811 1038854867 /nfs/dbraw/zinc/85/48/67/1038854867.db2.gz AXDPTBGZRKFSJJ-UHFFFAOYSA-N 1 2 304.393 4.411 20 0 DIADLO CCO[C@@H](C)c1nc(C[NH2+]C2(c3ccccc3)CC2)cs1 ZINC000076726716 1038854920 /nfs/dbraw/zinc/85/49/20/1038854920.db2.gz DMYKZBQTARWPAG-ZDUSSCGKSA-N 1 2 302.443 4.020 20 0 DIADLO CCc1noc(C[N@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC000608506612 1038873332 /nfs/dbraw/zinc/87/33/32/1038873332.db2.gz RMKQFPGSZXYGDB-OAHLLOKOSA-N 1 2 321.424 4.492 20 0 DIADLO CCc1noc(C[N@@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC000608506612 1038873351 /nfs/dbraw/zinc/87/33/51/1038873351.db2.gz RMKQFPGSZXYGDB-OAHLLOKOSA-N 1 2 321.424 4.492 20 0 DIADLO CCCCN(C(=O)c1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000078264190 1038903428 /nfs/dbraw/zinc/90/34/28/1038903428.db2.gz ZMVMMCUXHRQQNK-UHFFFAOYSA-N 1 2 319.408 4.319 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc3ccccc23)C[C@H](C(F)(F)F)O1 ZINC000608750525 1038911921 /nfs/dbraw/zinc/91/19/21/1038911921.db2.gz RUPUXMNHMNXZNW-IINYFYTJSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc3ccccc23)C[C@H](C(F)(F)F)O1 ZINC000608750525 1038911932 /nfs/dbraw/zinc/91/19/32/1038911932.db2.gz RUPUXMNHMNXZNW-IINYFYTJSA-N 1 2 315.360 4.053 20 0 DIADLO C[C@H]([NH2+]Cc1csc2ccccc12)c1nc(C(C)(C)C)no1 ZINC000237523837 1038922358 /nfs/dbraw/zinc/92/23/58/1038922358.db2.gz KHLYDBBYQFIRAI-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO COC(=O)c1occc1C[N@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000030005692 1038937682 /nfs/dbraw/zinc/93/76/82/1038937682.db2.gz TXHGFXBVURFOOA-GFCCVEGCSA-N 1 2 313.353 4.005 20 0 DIADLO COC(=O)c1occc1C[N@@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000030005692 1038937702 /nfs/dbraw/zinc/93/77/02/1038937702.db2.gz TXHGFXBVURFOOA-GFCCVEGCSA-N 1 2 313.353 4.005 20 0 DIADLO Cc1[nH]c(CN(Cc2c(F)cccc2F)C2CCCC2)[nH+]c1C ZINC000628163404 1038950625 /nfs/dbraw/zinc/95/06/25/1038950625.db2.gz ASUKAUQBVKHVFP-UHFFFAOYSA-N 1 2 319.399 4.250 20 0 DIADLO Fc1cc(C(F)(F)F)cnc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213085844 1038973497 /nfs/dbraw/zinc/97/34/97/1038973497.db2.gz ZRJKISGBAHROMI-UHFFFAOYSA-N 1 2 322.265 4.373 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CCCC[C@H]2CCc2ccccc2)no1 ZINC000534126755 1038990156 /nfs/dbraw/zinc/99/01/56/1038990156.db2.gz YKXYRGATIWWAIN-KRWDZBQOSA-N 1 2 313.445 4.180 20 0 DIADLO CC(C)c1nc(C[N@H+]2CCCC[C@H]2CCc2ccccc2)no1 ZINC000534126755 1038990180 /nfs/dbraw/zinc/99/01/80/1038990180.db2.gz YKXYRGATIWWAIN-KRWDZBQOSA-N 1 2 313.445 4.180 20 0 DIADLO CC(C)c1cccc(NC(=O)c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC000078649628 1038997544 /nfs/dbraw/zinc/99/75/44/1038997544.db2.gz UKJRMSPIYQCHAN-UHFFFAOYSA-N 1 2 319.408 4.307 20 0 DIADLO CCC(CC)[C@@H](C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000534173181 1038999105 /nfs/dbraw/zinc/99/91/05/1038999105.db2.gz UHWGQLGXPFKQLY-GFCCVEGCSA-N 1 2 303.381 4.022 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)Cc2c(C)cccc2C)n1 ZINC000342908799 1038999387 /nfs/dbraw/zinc/99/93/87/1038999387.db2.gz JGUBXZQYLBSXFY-CQSZACIVSA-N 1 2 319.474 4.133 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)Cc2c(C)cccc2C)n1 ZINC000342908799 1038999401 /nfs/dbraw/zinc/99/94/01/1038999401.db2.gz JGUBXZQYLBSXFY-CQSZACIVSA-N 1 2 319.474 4.133 20 0 DIADLO COCc1cnc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccc(F)c2)s1 ZINC000342935219 1039027050 /nfs/dbraw/zinc/02/70/50/1039027050.db2.gz RZALUXHAWODDAW-MLGOLLRUSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1cnc(C[N@H+]2C[C@H](C)C[C@@H]2c2cccc(F)c2)s1 ZINC000342935219 1039027070 /nfs/dbraw/zinc/02/70/70/1039027070.db2.gz RZALUXHAWODDAW-MLGOLLRUSA-N 1 2 320.433 4.012 20 0 DIADLO COCc1cnc(C[N@@H+]2CCCCC[C@H]2c2ccc(C)o2)s1 ZINC000342936596 1039032408 /nfs/dbraw/zinc/03/24/08/1039032408.db2.gz DBMOMXPXTPIMMG-HNNXBMFYSA-N 1 2 320.458 4.308 20 0 DIADLO COCc1cnc(C[N@H+]2CCCCC[C@H]2c2ccc(C)o2)s1 ZINC000342936596 1039032428 /nfs/dbraw/zinc/03/24/28/1039032428.db2.gz DBMOMXPXTPIMMG-HNNXBMFYSA-N 1 2 320.458 4.308 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2cccc(-c3cccnc3)c2)cs1 ZINC000534349651 1039035426 /nfs/dbraw/zinc/03/54/26/1039035426.db2.gz OTLXNMPTTBEHEL-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2cccc(-c3cccnc3)c2)cs1 ZINC000534349651 1039035445 /nfs/dbraw/zinc/03/54/45/1039035445.db2.gz OTLXNMPTTBEHEL-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@@H](C)c1nc(C)cs1 ZINC000091318668 1039042073 /nfs/dbraw/zinc/04/20/73/1039042073.db2.gz GAXNBJGSCRTXIG-STQMWFEESA-N 1 2 314.458 4.233 20 0 DIADLO c1sc(C2CC2)nc1C[NH+]1CCC(Oc2ccccc2)CC1 ZINC000161473155 1039059865 /nfs/dbraw/zinc/05/98/65/1039059865.db2.gz XGYFLAHILNUYJR-UHFFFAOYSA-N 1 2 314.454 4.064 20 0 DIADLO Cc1cc(C)c(CNC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)c[nH+]1 ZINC000456845754 1039083140 /nfs/dbraw/zinc/08/31/40/1039083140.db2.gz SUPNDWWZJGEYJB-WOJBJXKFSA-N 1 2 322.452 4.289 20 0 DIADLO CCc1sc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1C ZINC000042649440 1039105595 /nfs/dbraw/zinc/10/55/95/1039105595.db2.gz WHBXPPGPMHDABG-UHFFFAOYSA-N 1 2 311.410 4.057 20 0 DIADLO COc1cccc2ncc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc21 ZINC001213086796 1039108785 /nfs/dbraw/zinc/10/87/85/1039108785.db2.gz ANLZCAJHYLEYCD-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CCC1 ZINC000457434295 1039144988 /nfs/dbraw/zinc/14/49/88/1039144988.db2.gz GYWSJFUZWJMKQU-CQSZACIVSA-N 1 2 323.440 4.261 20 0 DIADLO CC(C)[N@H+](Cc1ccco1)Cc1nc2c(s1)C[C@H](C)CC2 ZINC000349834444 1039152002 /nfs/dbraw/zinc/15/20/02/1039152002.db2.gz XPUBHJZJWHDTMR-CYBMUJFWSA-N 1 2 304.459 4.272 20 0 DIADLO CC(C)[N@@H+](Cc1ccco1)Cc1nc2c(s1)C[C@H](C)CC2 ZINC000349834444 1039152011 /nfs/dbraw/zinc/15/20/11/1039152011.db2.gz XPUBHJZJWHDTMR-CYBMUJFWSA-N 1 2 304.459 4.272 20 0 DIADLO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)c(C)n1 ZINC000153971909 1039154503 /nfs/dbraw/zinc/15/45/03/1039154503.db2.gz GRUHTQVGPDRHKH-JQWIXIFHSA-N 1 2 318.490 4.259 20 0 DIADLO Cc1cccc([C@@H](C)C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)c1 ZINC000150780012 1039158833 /nfs/dbraw/zinc/15/88/33/1039158833.db2.gz XPXKIBLABLGAJE-CQSZACIVSA-N 1 2 323.371 4.062 20 0 DIADLO Cc1[nH]c(CN2CCc3c(Cl)cc(Cl)cc3[C@H]2C)[nH+]c1C ZINC001167658272 1039198518 /nfs/dbraw/zinc/19/85/18/1039198518.db2.gz DQZSAUWSJGCRFL-LLVKDONJSA-N 1 2 324.255 4.453 20 0 DIADLO c1cn(Cc2ccccc2)c(C[N@@H+]2CCC[C@H]2c2ccsc2)n1 ZINC000079989371 1039239702 /nfs/dbraw/zinc/23/97/02/1039239702.db2.gz OYFYKCLGQQEIDC-SFHVURJKSA-N 1 2 323.465 4.330 20 0 DIADLO c1cn(Cc2ccccc2)c(C[N@H+]2CCC[C@H]2c2ccsc2)n1 ZINC000079989371 1039239712 /nfs/dbraw/zinc/23/97/12/1039239712.db2.gz OYFYKCLGQQEIDC-SFHVURJKSA-N 1 2 323.465 4.330 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccccc2)oc1C)Cc1ccccn1 ZINC000125326503 1039244934 /nfs/dbraw/zinc/24/49/34/1039244934.db2.gz ZVOFFUQEMHLXLJ-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccccc2)oc1C)Cc1ccccn1 ZINC000125326503 1039244945 /nfs/dbraw/zinc/24/49/45/1039244945.db2.gz ZVOFFUQEMHLXLJ-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)cs1 ZINC000278180547 1039253922 /nfs/dbraw/zinc/25/39/22/1039253922.db2.gz BMUBXIHDMZDZET-CYBMUJFWSA-N 1 2 315.486 4.391 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)cs1 ZINC000278180550 1039254219 /nfs/dbraw/zinc/25/42/19/1039254219.db2.gz BMUBXIHDMZDZET-ZDUSSCGKSA-N 1 2 315.486 4.391 20 0 DIADLO C[C@@H](Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)c1ccncc1 ZINC000278183086 1039256758 /nfs/dbraw/zinc/25/67/58/1039256758.db2.gz BQBVRBRKNHVSSM-OAHLLOKOSA-N 1 2 318.424 4.455 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2cc(C)ccc2OC(F)F)cs1 ZINC000126560932 1039279046 /nfs/dbraw/zinc/27/90/46/1039279046.db2.gz VTIVQNNLNIHCEK-JTQLQIEISA-N 1 2 312.385 4.212 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3ccc(OCC4CC4)nc3)cc2)[nH]1 ZINC001213087781 1039283714 /nfs/dbraw/zinc/28/37/14/1039283714.db2.gz ADIUVCLXQGZJRL-UHFFFAOYSA-N 1 2 306.369 4.004 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccsc1)c1nc(-c2cccs2)no1 ZINC000669828930 1039284386 /nfs/dbraw/zinc/28/43/86/1039284386.db2.gz UYIXAFSIXGIMKU-VHSXEESVSA-N 1 2 305.428 4.271 20 0 DIADLO Clc1cscc1C[N@@H+]1CC2(CCOCC2)[C@@H]1c1ccco1 ZINC000668673053 1039286796 /nfs/dbraw/zinc/28/67/96/1039286796.db2.gz GTLUDCNZRARJMF-HNNXBMFYSA-N 1 2 323.845 4.348 20 0 DIADLO Clc1cscc1C[N@H+]1CC2(CCOCC2)[C@@H]1c1ccco1 ZINC000668673053 1039286801 /nfs/dbraw/zinc/28/68/01/1039286801.db2.gz GTLUDCNZRARJMF-HNNXBMFYSA-N 1 2 323.845 4.348 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3ccc(N4CCCC4)cc3)cc2)[nH]1 ZINC001213087983 1039288788 /nfs/dbraw/zinc/28/87/88/1039288788.db2.gz JSTAKHFAUDNAGN-UHFFFAOYSA-N 1 2 304.397 4.421 20 0 DIADLO CC[N@H+](Cc1cc(C(C)=O)no1)Cc1ccc2ccccc2c1 ZINC000583448864 1039331146 /nfs/dbraw/zinc/33/11/46/1039331146.db2.gz RWXAYWUFKZSGLO-UHFFFAOYSA-N 1 2 308.381 4.053 20 0 DIADLO CC[N@@H+](Cc1cc(C(C)=O)no1)Cc1ccc2ccccc2c1 ZINC000583448864 1039331163 /nfs/dbraw/zinc/33/11/63/1039331163.db2.gz RWXAYWUFKZSGLO-UHFFFAOYSA-N 1 2 308.381 4.053 20 0 DIADLO CC[N@H+](CC(=O)c1cc(C)[nH]c1C)Cc1ccc(Cl)s1 ZINC000343263187 1039355952 /nfs/dbraw/zinc/35/59/52/1039355952.db2.gz JUARPWMIHGFDDZ-UHFFFAOYSA-N 1 2 310.850 4.051 20 0 DIADLO CC[N@@H+](CC(=O)c1cc(C)[nH]c1C)Cc1ccc(Cl)s1 ZINC000343263187 1039355967 /nfs/dbraw/zinc/35/59/67/1039355967.db2.gz JUARPWMIHGFDDZ-UHFFFAOYSA-N 1 2 310.850 4.051 20 0 DIADLO Cc1c2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2nn1C ZINC001213088768 1039360400 /nfs/dbraw/zinc/36/04/00/1039360400.db2.gz CIBPCEUMQQNLBQ-UHFFFAOYSA-N 1 2 303.369 4.015 20 0 DIADLO Cc1ncccc1C[N@@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000539837816 1039364860 /nfs/dbraw/zinc/36/48/60/1039364860.db2.gz FTVBKWHGXFQIHC-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ncccc1C[N@H+]1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000539837816 1039364870 /nfs/dbraw/zinc/36/48/70/1039364870.db2.gz FTVBKWHGXFQIHC-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(Cl)ccc1NC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC000635146415 1039428475 /nfs/dbraw/zinc/42/84/75/1039428475.db2.gz CSEZFVJWKDVLFE-HNNXBMFYSA-N 1 2 305.809 4.071 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1nc(-c2ccccc2)cs1 ZINC000540163045 1039430449 /nfs/dbraw/zinc/43/04/49/1039430449.db2.gz JDVYSRPCICTBKB-IUODEOHRSA-N 1 2 324.453 4.261 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)c1nc(-c2ccccc2)cs1 ZINC000540163045 1039430462 /nfs/dbraw/zinc/43/04/62/1039430462.db2.gz JDVYSRPCICTBKB-IUODEOHRSA-N 1 2 324.453 4.261 20 0 DIADLO Cn1ncc(C2CC2)c1CNc1ccc(Nc2ccccc2)c[nH+]1 ZINC000657786395 1039433478 /nfs/dbraw/zinc/43/34/78/1039433478.db2.gz PNHDVJGVKXNTCH-UHFFFAOYSA-N 1 2 319.412 4.048 20 0 DIADLO Cl/C=C(\Cl)C[NH2+]C1(c2ccc(Br)cc2)CC1 ZINC000309516892 1039435900 /nfs/dbraw/zinc/43/59/00/1039435900.db2.gz RZJCRCJFRGTPQD-XFFZJAGNSA-N 1 2 321.045 4.347 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1cc(C)oc1C)c1nnc2n1CCCCC2 ZINC000278399245 1039441472 /nfs/dbraw/zinc/44/14/72/1039441472.db2.gz FLKGJXMUWRWQDL-CZUORRHYSA-N 1 2 316.449 4.016 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1cc(C)oc1C)c1nnc2n1CCCCC2 ZINC000278399238 1039443015 /nfs/dbraw/zinc/44/30/15/1039443015.db2.gz FLKGJXMUWRWQDL-CJNGLKHVSA-N 1 2 316.449 4.016 20 0 DIADLO Cc1[nH]c(CN([C@H](C)c2ccccc2Cl)C2CC2)[nH+]c1C ZINC000628130578 1039469354 /nfs/dbraw/zinc/46/93/54/1039469354.db2.gz DUKPEDYTNUHSIE-CYBMUJFWSA-N 1 2 303.837 4.406 20 0 DIADLO Cc1[nH]c(CN(Cc2ccccc2C(F)(F)F)C2CC2)[nH+]c1C ZINC000628130537 1039470976 /nfs/dbraw/zinc/47/09/76/1039470976.db2.gz CNYSETJAZGFAOB-UHFFFAOYSA-N 1 2 323.362 4.210 20 0 DIADLO CCCc1nc(C[N@@H+]2CCC[C@H]2c2ccc(COC)o2)cs1 ZINC000131045952 1039482553 /nfs/dbraw/zinc/48/25/53/1039482553.db2.gz DTFITIDRLOUEDE-HNNXBMFYSA-N 1 2 320.458 4.172 20 0 DIADLO CCCc1nc(C[N@H+]2CCC[C@H]2c2ccc(COC)o2)cs1 ZINC000131045952 1039482558 /nfs/dbraw/zinc/48/25/58/1039482558.db2.gz DTFITIDRLOUEDE-HNNXBMFYSA-N 1 2 320.458 4.172 20 0 DIADLO O=C1CCCc2cccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)c21 ZINC001213091032 1039483585 /nfs/dbraw/zinc/48/35/85/1039483585.db2.gz SEXDKYXVICQPSO-UHFFFAOYSA-N 1 2 303.365 4.339 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccccc1-n1cccn1 ZINC000540362187 1039483998 /nfs/dbraw/zinc/48/39/98/1039483998.db2.gz IRIZLWFAIAPDMH-AWEZNQCLSA-N 1 2 324.428 4.009 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000540393505 1039486930 /nfs/dbraw/zinc/48/69/30/1039486930.db2.gz MDCNLSNCOLUFOO-OAHLLOKOSA-N 1 2 319.836 4.477 20 0 DIADLO COc1ccccc1-c1ccc([C@@H](C)[NH2+]Cc2ccon2)cc1 ZINC000540458595 1039496892 /nfs/dbraw/zinc/49/68/92/1039496892.db2.gz RBXOIOGZBDFRAS-CQSZACIVSA-N 1 2 308.381 4.201 20 0 DIADLO COC[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccc(F)cc1 ZINC000540478661 1039500578 /nfs/dbraw/zinc/50/05/78/1039500578.db2.gz SYMXDKCQPOPGOX-CQSZACIVSA-N 1 2 322.449 4.057 20 0 DIADLO Cn1cc(C[N@H+](Cc2ccccc2F)C2CC2)c(C(C)(C)C)n1 ZINC000540507005 1039507277 /nfs/dbraw/zinc/50/72/77/1039507277.db2.gz IKNVPNOSUKMLAA-UHFFFAOYSA-N 1 2 315.436 4.021 20 0 DIADLO Cn1cc(C[N@@H+](Cc2ccccc2F)C2CC2)c(C(C)(C)C)n1 ZINC000540507005 1039507289 /nfs/dbraw/zinc/50/72/89/1039507289.db2.gz IKNVPNOSUKMLAA-UHFFFAOYSA-N 1 2 315.436 4.021 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(C)n1)c1cc2c(ccc3ccccc23)o1 ZINC000540605744 1039526264 /nfs/dbraw/zinc/52/62/64/1039526264.db2.gz JCTNJXDFDFNSMM-ZDUSSCGKSA-N 1 2 305.381 4.170 20 0 DIADLO CC(C)[C@@]1(C)C[C@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000685242865 1039531411 /nfs/dbraw/zinc/53/14/11/1039531411.db2.gz GCPVEMAZDFBQDD-QFBILLFUSA-N 1 2 322.412 4.131 20 0 DIADLO C[C@H]([NH2+]Cc1csnn1)c1ccc(-c2ccc(F)cc2)cc1 ZINC000540627664 1039533696 /nfs/dbraw/zinc/53/36/96/1039533696.db2.gz FUETUYCYDCIPRP-LBPRGKRZSA-N 1 2 313.401 4.195 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc(Cl)nc2Cl)s1 ZINC000693853697 1039551888 /nfs/dbraw/zinc/55/18/88/1039551888.db2.gz BWYLXQVNNUFQCT-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc(Cl)nc2Cl)s1 ZINC000693853697 1039551905 /nfs/dbraw/zinc/55/19/05/1039551905.db2.gz BWYLXQVNNUFQCT-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO CC(C)(C)c1ccc(Cl)cc1NC(=O)CCCn1cc[nH+]c1 ZINC000669878868 1039552663 /nfs/dbraw/zinc/55/26/63/1039552663.db2.gz KTMRYIUUMBPYKA-UHFFFAOYSA-N 1 2 319.836 4.253 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccc2c(c1)CCO2 ZINC000540726845 1039555759 /nfs/dbraw/zinc/55/57/59/1039555759.db2.gz INIXDUVWWPAEQI-OAHLLOKOSA-N 1 2 323.440 4.180 20 0 DIADLO Cc1cccc(OCC[N@@H+](C)Cc2csc(C(C)(C)C)n2)c1 ZINC000642253457 1039562938 /nfs/dbraw/zinc/56/29/38/1039562938.db2.gz VCRACADYVRTLOS-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO Cc1cccc(OCC[N@H+](C)Cc2csc(C(C)(C)C)n2)c1 ZINC000642253457 1039562956 /nfs/dbraw/zinc/56/29/56/1039562956.db2.gz VCRACADYVRTLOS-UHFFFAOYSA-N 1 2 318.486 4.260 20 0 DIADLO CC[N@H+](C)[C@@H](c1nc(C2CCC(C)CC2)no1)c1ccccc1 ZINC000685263476 1039590043 /nfs/dbraw/zinc/59/00/43/1039590043.db2.gz JPPWQOCEINBKAP-BDVYOWHSSA-N 1 2 313.445 4.404 20 0 DIADLO CC[N@@H+](C)[C@@H](c1nc(C2CCC(C)CC2)no1)c1ccccc1 ZINC000685263476 1039590058 /nfs/dbraw/zinc/59/00/58/1039590058.db2.gz JPPWQOCEINBKAP-BDVYOWHSSA-N 1 2 313.445 4.404 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1ncc(C(C)C)s1 ZINC000158883750 1039602355 /nfs/dbraw/zinc/60/23/55/1039602355.db2.gz MFQTWQAVAYZIRR-UHFFFAOYSA-N 1 2 300.431 4.248 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(Cl)nc1Cl ZINC000278638645 1039608730 /nfs/dbraw/zinc/60/87/30/1039608730.db2.gz OSHGBGTZHYSMLV-ZDUSSCGKSA-N 1 2 310.228 4.367 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(Cl)nc1Cl ZINC000278638645 1039608741 /nfs/dbraw/zinc/60/87/41/1039608741.db2.gz OSHGBGTZHYSMLV-ZDUSSCGKSA-N 1 2 310.228 4.367 20 0 DIADLO C[C@H]1COc2ccccc2C[N@@H+]1Cc1ncc(-c2ccccc2)o1 ZINC000541086505 1039619507 /nfs/dbraw/zinc/61/95/07/1039619507.db2.gz PQIDQBMFLUDLDV-HNNXBMFYSA-N 1 2 320.392 4.125 20 0 DIADLO C[C@H]1COc2ccccc2C[N@H+]1Cc1ncc(-c2ccccc2)o1 ZINC000541086505 1039619517 /nfs/dbraw/zinc/61/95/17/1039619517.db2.gz PQIDQBMFLUDLDV-HNNXBMFYSA-N 1 2 320.392 4.125 20 0 DIADLO Cc1[nH]c(CN[C@@H](C)c2cc(F)c(Cl)cc2Cl)[nH+]c1C ZINC000584183366 1039630865 /nfs/dbraw/zinc/63/08/65/1039630865.db2.gz GJUJNPICQTVIGB-VIFPVBQESA-N 1 2 316.207 4.323 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCSC(C)(C)C3)cs2)o1 ZINC000083415098 1039735865 /nfs/dbraw/zinc/73/58/65/1039735865.db2.gz HURZIONDIGYNQV-UHFFFAOYSA-N 1 2 308.472 4.039 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCSC(C)(C)C3)cs2)o1 ZINC000083415098 1039735884 /nfs/dbraw/zinc/73/58/84/1039735884.db2.gz HURZIONDIGYNQV-UHFFFAOYSA-N 1 2 308.472 4.039 20 0 DIADLO CCc1ncc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)s1 ZINC000278767041 1039765196 /nfs/dbraw/zinc/76/51/96/1039765196.db2.gz OLNOMUOHXWUENZ-SSDOTTSWSA-N 1 2 321.393 4.032 20 0 DIADLO CCc1ncc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)s1 ZINC000278767043 1039765162 /nfs/dbraw/zinc/76/51/62/1039765162.db2.gz OLNOMUOHXWUENZ-ZETCQYMHSA-N 1 2 321.393 4.032 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H](C)c2cnn(C(C)C)c2)cs1 ZINC000090049911 1039787340 /nfs/dbraw/zinc/78/73/40/1039787340.db2.gz TZXFBQCZDWVPTH-QWHCGFSZSA-N 1 2 306.479 4.456 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccccn1)c1nc(-c2ccncc2)cs1 ZINC000090045764 1039788584 /nfs/dbraw/zinc/78/85/84/1039788584.db2.gz FSHJEKYXQLANJL-CHWSQXEVSA-N 1 2 310.426 4.012 20 0 DIADLO COc1ccc(CNc2cc(C(C)C)[nH+]c(C(C)C)n2)cc1O ZINC000090071218 1039790539 /nfs/dbraw/zinc/79/05/39/1039790539.db2.gz LMPJGXXDYRNOOU-UHFFFAOYSA-N 1 2 315.417 4.050 20 0 DIADLO CCc1cnccc1[C@@H](C)[NH2+][C@H](C)c1ncc(C(C)(C)C)o1 ZINC000542123146 1039792003 /nfs/dbraw/zinc/79/20/03/1039792003.db2.gz JNOFLEQLHFZIAW-CHWSQXEVSA-N 1 2 301.434 4.341 20 0 DIADLO CCC[NH+](CCC)Cn1nc(C=Cc2ccccc2)[nH]c1=S ZINC000029886070 1039834074 /nfs/dbraw/zinc/83/40/74/1039834074.db2.gz FEJCCUHMBFXAKT-ZHACJKMWSA-N 1 2 316.474 4.191 20 0 DIADLO CCn1c(C[N@H+]([C@@H](C)c2ccco2)C2CC2)nc2ccccc21 ZINC000092484133 1039871629 /nfs/dbraw/zinc/87/16/29/1039871629.db2.gz ONJQTNAVNXBHDB-AWEZNQCLSA-N 1 2 309.413 4.375 20 0 DIADLO CCn1c(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)nc2ccccc21 ZINC000092484133 1039871654 /nfs/dbraw/zinc/87/16/54/1039871654.db2.gz ONJQTNAVNXBHDB-AWEZNQCLSA-N 1 2 309.413 4.375 20 0 DIADLO COc1ccc(-c2cnc(C[NH2+][C@@H](C)c3ccsc3)o2)cc1 ZINC000669939717 1039877482 /nfs/dbraw/zinc/87/74/82/1039877482.db2.gz IPGHLSFUPXHVNF-LBPRGKRZSA-N 1 2 314.410 4.263 20 0 DIADLO CCC(CC)(CNC(=O)c1c(C)cc(C)[nH+]c1C)C(F)(F)F ZINC000913734780 1039879127 /nfs/dbraw/zinc/87/91/27/1039879127.db2.gz AUNCPSPBSUVBHT-UHFFFAOYSA-N 1 2 316.367 4.105 20 0 DIADLO C[N@H+](Cc1nc2ccccc2o1)Cc1ccc(F)c(Cl)c1 ZINC000093339074 1039891757 /nfs/dbraw/zinc/89/17/57/1039891757.db2.gz HYNGYXGXWCDMBR-UHFFFAOYSA-N 1 2 304.752 4.252 20 0 DIADLO C[N@@H+](Cc1nc2ccccc2o1)Cc1ccc(F)c(Cl)c1 ZINC000093339074 1039891780 /nfs/dbraw/zinc/89/17/80/1039891780.db2.gz HYNGYXGXWCDMBR-UHFFFAOYSA-N 1 2 304.752 4.252 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000093234619 1039899899 /nfs/dbraw/zinc/89/98/99/1039899899.db2.gz CMYWUNXOUYPIBU-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)[C@@H](C)c1cccnc1 ZINC000093234619 1039899913 /nfs/dbraw/zinc/89/99/13/1039899913.db2.gz CMYWUNXOUYPIBU-LBPRGKRZSA-N 1 2 313.426 4.300 20 0 DIADLO CCCOc1cccc2c(NCc3ncccc3C)cc[nH+]c12 ZINC000492210821 1039937772 /nfs/dbraw/zinc/93/77/72/1039937772.db2.gz OGVKLEFSPVOFPJ-UHFFFAOYSA-N 1 2 307.397 4.339 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2ccc(CSC(F)F)o2)n1 ZINC000069168384 1039992921 /nfs/dbraw/zinc/99/29/21/1039992921.db2.gz USYZAAYAJBUABN-VIFPVBQESA-N 1 2 318.414 4.351 20 0 DIADLO Brc1cscc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000685410445 1040032575 /nfs/dbraw/zinc/03/25/75/1040032575.db2.gz HITVXUCXPINDNJ-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cscc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000685410445 1040032591 /nfs/dbraw/zinc/03/25/91/1040032591.db2.gz HITVXUCXPINDNJ-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO CCCC[N@H+](Cc1cn(C(C)C)nn1)[C@@H](C)c1ccc(C)o1 ZINC000685410599 1040033786 /nfs/dbraw/zinc/03/37/86/1040033786.db2.gz ISYFUXOOPRTENO-HNNXBMFYSA-N 1 2 304.438 4.124 20 0 DIADLO CCCC[N@@H+](Cc1cn(C(C)C)nn1)[C@@H](C)c1ccc(C)o1 ZINC000685410599 1040033804 /nfs/dbraw/zinc/03/38/04/1040033804.db2.gz ISYFUXOOPRTENO-HNNXBMFYSA-N 1 2 304.438 4.124 20 0 DIADLO CC[N@H+](Cc1coc(C(C)(C)C)n1)[C@H](C)c1cccc(O)c1 ZINC000929792978 1040075788 /nfs/dbraw/zinc/07/57/88/1040075788.db2.gz SANYNDZOSUUPCO-CYBMUJFWSA-N 1 2 302.418 4.261 20 0 DIADLO CC[N@@H+](Cc1coc(C(C)(C)C)n1)[C@H](C)c1cccc(O)c1 ZINC000929792978 1040075822 /nfs/dbraw/zinc/07/58/22/1040075822.db2.gz SANYNDZOSUUPCO-CYBMUJFWSA-N 1 2 302.418 4.261 20 0 DIADLO Cc1ccc([C@H](c2noc([C@@H]3C[C@H]3c3c[nH]c[nH+]3)n2)C(C)C)cc1 ZINC000924070847 1040081418 /nfs/dbraw/zinc/08/14/18/1040081418.db2.gz ZUBDERJOIIYALD-BFYDXBDKSA-N 1 2 322.412 4.160 20 0 DIADLO Cc1cc(C[NH2+]C(c2ccc(F)cc2)c2ccc(F)cc2)on1 ZINC000092820724 1040088164 /nfs/dbraw/zinc/08/81/64/1040088164.db2.gz SBNYWGWKWVEJPB-UHFFFAOYSA-N 1 2 314.335 4.140 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc(Br)o2)o1 ZINC000189498123 1040090009 /nfs/dbraw/zinc/09/00/09/1040090009.db2.gz LDKLWZGWJMNZAX-CABZTGNLSA-N 1 2 310.191 4.048 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(F)c(Cl)cc2F)CCC1(F)F ZINC001140699341 1040103154 /nfs/dbraw/zinc/10/31/54/1040103154.db2.gz MISJDHFWHNTPSM-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(F)c(Cl)cc2F)CCC1(F)F ZINC001140699341 1040103164 /nfs/dbraw/zinc/10/31/64/1040103164.db2.gz MISJDHFWHNTPSM-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO C[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1ccccc1Br ZINC000294267356 1040116946 /nfs/dbraw/zinc/11/69/46/1040116946.db2.gz XTDFTPCYHOMLGA-MJVIPROJSA-N 1 2 320.234 4.002 20 0 DIADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1ccccc1Br ZINC000294267350 1040118638 /nfs/dbraw/zinc/11/86/38/1040118638.db2.gz XTDFTPCYHOMLGA-COPLHBTASA-N 1 2 320.234 4.002 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+](C)CCOc1ccccc1F ZINC000177642328 1040131359 /nfs/dbraw/zinc/13/13/59/1040131359.db2.gz YFOGKEFFJGLVCT-ZDUSSCGKSA-N 1 2 320.408 4.183 20 0 DIADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)CCOc1ccccc1F ZINC000177642328 1040131369 /nfs/dbraw/zinc/13/13/69/1040131369.db2.gz YFOGKEFFJGLVCT-ZDUSSCGKSA-N 1 2 320.408 4.183 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)no1 ZINC000685564762 1040132428 /nfs/dbraw/zinc/13/24/28/1040132428.db2.gz JGOSKIVRNZADPX-MRXNPFEDSA-N 1 2 316.470 4.262 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)no1 ZINC000685564762 1040132438 /nfs/dbraw/zinc/13/24/38/1040132438.db2.gz JGOSKIVRNZADPX-MRXNPFEDSA-N 1 2 316.470 4.262 20 0 DIADLO Cc1nc(C)c(C[NH2+]C(C)(C)c2ccccc2Br)o1 ZINC000685571573 1040135758 /nfs/dbraw/zinc/13/57/58/1040135758.db2.gz VGYCHOAUJISTLA-UHFFFAOYSA-N 1 2 323.234 4.079 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cc(C(C)(C)C)on1 ZINC000685571944 1040136215 /nfs/dbraw/zinc/13/62/15/1040136215.db2.gz BZZOQMWBDCZSOZ-QWRGUYRKSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1cc(C(C)(C)C)on1 ZINC000685571944 1040136225 /nfs/dbraw/zinc/13/62/25/1040136225.db2.gz BZZOQMWBDCZSOZ-QWRGUYRKSA-N 1 2 304.356 4.135 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000685614128 1040156007 /nfs/dbraw/zinc/15/60/07/1040156007.db2.gz NSGBIHDHEAWEAS-GOSISDBHSA-N 1 2 311.816 4.251 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000685614128 1040156015 /nfs/dbraw/zinc/15/60/15/1040156015.db2.gz NSGBIHDHEAWEAS-GOSISDBHSA-N 1 2 311.816 4.251 20 0 DIADLO CSc1ccc(C[NH2+]Cc2nc(C)c3ccccc3n2)s1 ZINC000685614883 1040158801 /nfs/dbraw/zinc/15/88/01/1040158801.db2.gz PIGOAQCQCCNLJC-UHFFFAOYSA-N 1 2 315.467 4.011 20 0 DIADLO COc1ccc2oc([C@@H](C)[NH2+]Cc3nc(C)c(C)o3)c(C)c2c1 ZINC000184333576 1040211098 /nfs/dbraw/zinc/21/10/98/1040211098.db2.gz DFZINWHHVDDOHY-GFCCVEGCSA-N 1 2 314.385 4.205 20 0 DIADLO Cc1cnc2c(c1)C[N@@H+](Cc1cc(C)cc(C(F)(F)F)c1)CC2 ZINC001143459520 1040248964 /nfs/dbraw/zinc/24/89/64/1040248964.db2.gz WMPONXIZXWGKKN-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1cnc2c(c1)C[N@H+](Cc1cc(C)cc(C(F)(F)F)c1)CC2 ZINC001143459520 1040248981 /nfs/dbraw/zinc/24/89/81/1040248981.db2.gz WMPONXIZXWGKKN-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO COc1ccnc(C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)c1F ZINC000658223628 1040366465 /nfs/dbraw/zinc/36/64/65/1040366465.db2.gz KYFGXQXQOOUMFZ-LBPRGKRZSA-N 1 2 314.360 4.135 20 0 DIADLO COc1ccnc(C[NH2+][C@@H](c2ccc(C)o2)C2CCCC2)c1F ZINC000658228262 1040369885 /nfs/dbraw/zinc/36/98/85/1040369885.db2.gz QDVOWSRGUZTGNR-GOSISDBHSA-N 1 2 318.392 4.152 20 0 DIADLO CC(C)c1ccc([C@@H]2CCCN2C(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)cc1 ZINC000635741435 1040472201 /nfs/dbraw/zinc/47/22/01/1040472201.db2.gz DWZFBOULBWIAMJ-LMMKCTJWSA-N 1 2 323.440 4.000 20 0 DIADLO CC(C)c1ccc([C@@H]2CCCN2C(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)cc1 ZINC000635741435 1040472212 /nfs/dbraw/zinc/47/22/12/1040472212.db2.gz DWZFBOULBWIAMJ-LMMKCTJWSA-N 1 2 323.440 4.000 20 0 DIADLO O=C(Nc1ccc2[nH+]ccn2c1)c1ccc(C2=CCCC2)cc1 ZINC000685733910 1040490943 /nfs/dbraw/zinc/49/09/43/1040490943.db2.gz GNFBCYJQXFBYFQ-UHFFFAOYSA-N 1 2 303.365 4.154 20 0 DIADLO CC(C)C[N@H+](C)Cn1nc(-c2cccs2)n(C2CC2)c1=S ZINC000065943579 1040609915 /nfs/dbraw/zinc/60/99/15/1040609915.db2.gz VPZQWXAFIUANFD-UHFFFAOYSA-N 1 2 322.503 4.023 20 0 DIADLO CC(C)C[N@@H+](C)Cn1nc(-c2cccs2)n(C2CC2)c1=S ZINC000065943579 1040609930 /nfs/dbraw/zinc/60/99/30/1040609930.db2.gz VPZQWXAFIUANFD-UHFFFAOYSA-N 1 2 322.503 4.023 20 0 DIADLO C#CC[N@H+](Cc1cc(-c2ccccc2)no1)Cc1ccc(F)cc1 ZINC000065958295 1040632059 /nfs/dbraw/zinc/63/20/59/1040632059.db2.gz QAFQCEQPNNRIAS-UHFFFAOYSA-N 1 2 320.367 4.116 20 0 DIADLO C#CC[N@@H+](Cc1cc(-c2ccccc2)no1)Cc1ccc(F)cc1 ZINC000065958295 1040632065 /nfs/dbraw/zinc/63/20/65/1040632065.db2.gz QAFQCEQPNNRIAS-UHFFFAOYSA-N 1 2 320.367 4.116 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCC1(F)F)c1ccc(Br)s1 ZINC000309551237 1040713427 /nfs/dbraw/zinc/71/34/27/1040713427.db2.gz IGYBDWRWZBKRBB-CBAPKCEASA-N 1 2 310.207 4.349 20 0 DIADLO FC(F)(F)c1cscc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000685833891 1040765282 /nfs/dbraw/zinc/76/52/82/1040765282.db2.gz VVVYWIODDJPLEC-AWEZNQCLSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cscc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000685833891 1040765296 /nfs/dbraw/zinc/76/52/96/1040765296.db2.gz VVVYWIODDJPLEC-AWEZNQCLSA-N 1 2 312.360 4.499 20 0 DIADLO Cc1cn[nH]c1C[N@H+](Cc1ccc(Cl)c(Cl)c1)C(C)C ZINC000685834650 1040769875 /nfs/dbraw/zinc/76/98/75/1040769875.db2.gz VEVMZMQDQNRZDI-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO Cc1cn[nH]c1C[N@@H+](Cc1ccc(Cl)c(Cl)c1)C(C)C ZINC000685834650 1040769884 /nfs/dbraw/zinc/76/98/84/1040769884.db2.gz VEVMZMQDQNRZDI-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO Cc1cn[nH]c1C[N@@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000685837976 1040775667 /nfs/dbraw/zinc/77/56/67/1040775667.db2.gz RVPWLEWXHTWMLK-FQEVSTJZSA-N 1 2 303.409 4.018 20 0 DIADLO Cc1cn[nH]c1C[N@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000685837976 1040775683 /nfs/dbraw/zinc/77/56/83/1040775683.db2.gz RVPWLEWXHTWMLK-FQEVSTJZSA-N 1 2 303.409 4.018 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@H](C)OC[C@H]2c2ccccc2)s1 ZINC000685838037 1040776461 /nfs/dbraw/zinc/77/64/61/1040776461.db2.gz WTUDDURZUXIEFJ-BBRMVZONSA-N 1 2 319.495 4.432 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@H](C)OC[C@H]2c2ccccc2)s1 ZINC000685838037 1040776472 /nfs/dbraw/zinc/77/64/72/1040776472.db2.gz WTUDDURZUXIEFJ-BBRMVZONSA-N 1 2 319.495 4.432 20 0 DIADLO COc1c(C)cnc(C[N@H+](C)Cc2ccc(SC)s2)c1C ZINC000685843440 1040783326 /nfs/dbraw/zinc/78/33/26/1040783326.db2.gz BXLGDDZQVWBQIT-UHFFFAOYSA-N 1 2 322.499 4.122 20 0 DIADLO COc1c(C)cnc(C[N@@H+](C)Cc2ccc(SC)s2)c1C ZINC000685843440 1040783341 /nfs/dbraw/zinc/78/33/41/1040783341.db2.gz BXLGDDZQVWBQIT-UHFFFAOYSA-N 1 2 322.499 4.122 20 0 DIADLO Clc1ccc([C@H]2CCC[N@@H+]2Cc2cn3ccccc3n2)cc1 ZINC000613374035 1040904192 /nfs/dbraw/zinc/90/41/92/1040904192.db2.gz LVZAITZOJKSOCW-QGZVFWFLSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1ccc([C@H]2CCC[N@H+]2Cc2cn3ccccc3n2)cc1 ZINC000613374035 1040904210 /nfs/dbraw/zinc/90/42/10/1040904210.db2.gz LVZAITZOJKSOCW-QGZVFWFLSA-N 1 2 311.816 4.325 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@@H](C)c2nc3c(s2)CCC3)c(F)c1 ZINC000414142008 1040915853 /nfs/dbraw/zinc/91/58/53/1040915853.db2.gz IRQVMZPITDFPJP-QWRGUYRKSA-N 1 2 320.433 4.191 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2ccsc2Br)o1 ZINC000282389332 1040922051 /nfs/dbraw/zinc/92/20/51/1040922051.db2.gz JSUNFXPCOSBTBW-SECBINFHSA-N 1 2 300.221 4.263 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cn1)c1nc2c(s1)CCC2 ZINC000414155344 1040931752 /nfs/dbraw/zinc/93/17/52/1040931752.db2.gz NDLUXCAPUCUNPF-NXEZZACHSA-N 1 2 307.850 4.092 20 0 DIADLO Cc1cc(C[N@@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)no1 ZINC000174040515 1040940211 /nfs/dbraw/zinc/94/02/11/1040940211.db2.gz YGRHIWAKOPYARS-HXUWFJFHSA-N 1 2 304.393 4.283 20 0 DIADLO Cc1cc(C[N@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)no1 ZINC000174040515 1040940232 /nfs/dbraw/zinc/94/02/32/1040940232.db2.gz YGRHIWAKOPYARS-HXUWFJFHSA-N 1 2 304.393 4.283 20 0 DIADLO Cc1ncc(C[NH2+][C@@H](C)c2cc(Cl)ccc2OC(F)F)o1 ZINC000414180536 1040964338 /nfs/dbraw/zinc/96/43/38/1040964338.db2.gz LLNDMKYQFLDFMN-QMMMGPOBSA-N 1 2 316.735 4.089 20 0 DIADLO CCn1ccc(C[NH2+][C@@H](c2ccccc2)c2cc(C)ccc2C)n1 ZINC000414203867 1040999368 /nfs/dbraw/zinc/99/93/68/1040999368.db2.gz FNLSCUYXEUUOKW-NRFANRHFSA-N 1 2 319.452 4.399 20 0 DIADLO CC(C)c1noc(C[N@H+](C)Cc2ccccc2-c2ccccc2)n1 ZINC000170648560 1041000939 /nfs/dbraw/zinc/00/09/39/1041000939.db2.gz PDUZPLYMXWVENC-UHFFFAOYSA-N 1 2 321.424 4.492 20 0 DIADLO CC(C)c1noc(C[N@@H+](C)Cc2ccccc2-c2ccccc2)n1 ZINC000170648560 1041000951 /nfs/dbraw/zinc/00/09/51/1041000951.db2.gz PDUZPLYMXWVENC-UHFFFAOYSA-N 1 2 321.424 4.492 20 0 DIADLO CCc1ccc(-c2noc(C[N@H+](C)Cc3cccc(C)c3)n2)cc1 ZINC000613506184 1041024387 /nfs/dbraw/zinc/02/43/87/1041024387.db2.gz ZQEDHLYABHFGBF-UHFFFAOYSA-N 1 2 321.424 4.239 20 0 DIADLO CCc1ccc(-c2noc(C[N@@H+](C)Cc3cccc(C)c3)n2)cc1 ZINC000613506184 1041024403 /nfs/dbraw/zinc/02/44/03/1041024403.db2.gz ZQEDHLYABHFGBF-UHFFFAOYSA-N 1 2 321.424 4.239 20 0 DIADLO Clc1ccc(SCC[N@@H+]2CCC[C@@H](c3ccn[nH]3)C2)cc1 ZINC000613509100 1041028225 /nfs/dbraw/zinc/02/82/25/1041028225.db2.gz GAOHXTYWGHWMMH-CYBMUJFWSA-N 1 2 321.877 4.035 20 0 DIADLO Clc1ccc(SCC[N@H+]2CCC[C@@H](c3ccn[nH]3)C2)cc1 ZINC000613509100 1041028240 /nfs/dbraw/zinc/02/82/40/1041028240.db2.gz GAOHXTYWGHWMMH-CYBMUJFWSA-N 1 2 321.877 4.035 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001131515773 1041053351 /nfs/dbraw/zinc/05/33/51/1041053351.db2.gz BFJTUYIPIMAZFN-CABCVRRESA-N 1 2 319.408 4.262 20 0 DIADLO Cc1cccc2c1[C@@H](C)C[C@@H]2CC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001131515776 1041054296 /nfs/dbraw/zinc/05/42/96/1041054296.db2.gz BFJTUYIPIMAZFN-LSDHHAIUSA-N 1 2 319.408 4.262 20 0 DIADLO Cc1nc(-c2ccccc2)oc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000175557934 1041075741 /nfs/dbraw/zinc/07/57/41/1041075741.db2.gz BMMHHLCRKHZZIM-UHFFFAOYSA-N 1 2 321.380 4.223 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1csnn1)c1ccc(OC(C)(C)C)cc1 ZINC000414292233 1041090850 /nfs/dbraw/zinc/09/08/50/1041090850.db2.gz BVWJDUCAWNVRJS-NEPJUHHUSA-N 1 2 305.447 4.127 20 0 DIADLO C[N@H+](CC(=O)Nc1ccc2ccccc2c1)Cc1ccc(F)cc1 ZINC000003588354 1041096961 /nfs/dbraw/zinc/09/69/61/1041096961.db2.gz BBWFZNSTFZUWSA-UHFFFAOYSA-N 1 2 322.383 4.049 20 0 DIADLO C[N@@H+](CC(=O)Nc1ccc2ccccc2c1)Cc1ccc(F)cc1 ZINC000003588354 1041096984 /nfs/dbraw/zinc/09/69/84/1041096984.db2.gz BBWFZNSTFZUWSA-UHFFFAOYSA-N 1 2 322.383 4.049 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2csnn2)c2ccccc12 ZINC000414308346 1041104680 /nfs/dbraw/zinc/10/46/80/1041104680.db2.gz SSRQUIXDTUOLMS-NEPJUHHUSA-N 1 2 313.426 4.112 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]Cc2nnc(C3CC3)s2)c2ccsc2S1 ZINC000414329512 1041138866 /nfs/dbraw/zinc/13/88/66/1041138866.db2.gz QRBFHCPMDOQYQW-GZMMTYOYSA-N 1 2 323.512 4.192 20 0 DIADLO Cc1cc(NC(=O)C2(c3cccc(C(F)(F)F)c3)CC2)cc[nH+]1 ZINC000103268864 1041158236 /nfs/dbraw/zinc/15/82/36/1041158236.db2.gz AZBMDMLTZRJISP-UHFFFAOYSA-N 1 2 320.314 4.079 20 0 DIADLO CCCOc1cccc2c(N3CC[C@@H](C(F)F)C3)cc[nH+]c12 ZINC000685919739 1041171300 /nfs/dbraw/zinc/17/13/00/1041171300.db2.gz VGGGDFRNZMOKQC-GFCCVEGCSA-N 1 2 306.356 4.115 20 0 DIADLO CC(C)(C)OC(=O)Nc1ccsc1CNc1cccc[nH+]1 ZINC000892638216 1041178964 /nfs/dbraw/zinc/17/89/64/1041178964.db2.gz YNXUKQDMOHIUTJ-UHFFFAOYSA-N 1 2 305.403 4.102 20 0 DIADLO CC(C)[C@@H](c1noc([C@H](C)[NH+](C)C)n1)c1ccc(Cl)cc1 ZINC000809500982 1041179202 /nfs/dbraw/zinc/17/92/02/1041179202.db2.gz ZCGWIZOIWQUYPC-SMDDNHRTSA-N 1 2 307.825 4.134 20 0 DIADLO CC1(Cc2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)CCCC1 ZINC000809534841 1041184908 /nfs/dbraw/zinc/18/49/08/1041184908.db2.gz SAUZKKDVXAQVST-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO Clc1nc(C[N@@H+]2CC[C@@H](CSc3ccccc3)C2)cs1 ZINC000809574228 1041186960 /nfs/dbraw/zinc/18/69/60/1041186960.db2.gz HGCMPKKMUDKYHH-GFCCVEGCSA-N 1 2 324.902 4.411 20 0 DIADLO Clc1nc(C[N@H+]2CC[C@@H](CSc3ccccc3)C2)cs1 ZINC000809574228 1041186967 /nfs/dbraw/zinc/18/69/67/1041186967.db2.gz HGCMPKKMUDKYHH-GFCCVEGCSA-N 1 2 324.902 4.411 20 0 DIADLO CCc1ncc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000414375450 1041197720 /nfs/dbraw/zinc/19/77/20/1041197720.db2.gz YWCXUKVYTGILSY-CYBMUJFWSA-N 1 2 315.848 4.418 20 0 DIADLO CCc1ncc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000414375450 1041197726 /nfs/dbraw/zinc/19/77/26/1041197726.db2.gz YWCXUKVYTGILSY-CYBMUJFWSA-N 1 2 315.848 4.418 20 0 DIADLO OC1CCN(c2ccc([NH2+]CCC3CCCCCC3)cc2)CC1 ZINC000809597104 1041199836 /nfs/dbraw/zinc/19/98/36/1041199836.db2.gz ZMSKHQNPDIRYCR-UHFFFAOYSA-N 1 2 316.489 4.420 20 0 DIADLO C[NH+](C)c1ccc(NC2CC(c3cc(F)cc(F)c3)C2)cc1 ZINC000809598611 1041200941 /nfs/dbraw/zinc/20/09/41/1041200941.db2.gz QDTUVBFKZJZWJN-UHFFFAOYSA-N 1 2 302.368 4.389 20 0 DIADLO CN(C)c1ccc([NH2+]C2CC(c3cc(F)cc(F)c3)C2)cc1 ZINC000809598611 1041200947 /nfs/dbraw/zinc/20/09/47/1041200947.db2.gz QDTUVBFKZJZWJN-UHFFFAOYSA-N 1 2 302.368 4.389 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2c(Cl)nc(Cl)n2C)C1 ZINC000809716843 1041232802 /nfs/dbraw/zinc/23/28/02/1041232802.db2.gz ZRQHSVLJGWBMDM-DGCLKSJQSA-N 1 2 324.255 4.310 20 0 DIADLO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](Cc2c(Cl)nc(Cl)n2C)C1 ZINC000809716843 1041232811 /nfs/dbraw/zinc/23/28/11/1041232811.db2.gz ZRQHSVLJGWBMDM-DGCLKSJQSA-N 1 2 324.255 4.310 20 0 DIADLO COc1ccc([C@H](C)Nc2cc(C)[nH+]c(C(C)C)n2)cc1OC ZINC000301075220 1041235579 /nfs/dbraw/zinc/23/55/79/1041235579.db2.gz FRFRXLXZXIFZBG-ZDUSSCGKSA-N 1 2 315.417 4.099 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1coc(C2CC2)n1 ZINC000809780734 1041252585 /nfs/dbraw/zinc/25/25/85/1041252585.db2.gz IFJAOUCRWOAEQQ-INIZCTEOSA-N 1 2 300.402 4.144 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1coc(C2CC2)n1 ZINC000809780734 1041252604 /nfs/dbraw/zinc/25/26/04/1041252604.db2.gz IFJAOUCRWOAEQQ-INIZCTEOSA-N 1 2 300.402 4.144 20 0 DIADLO CCCCn1nc(C)c(C[N@@H+]2CCCc3occc3C2)c1Cl ZINC000809791952 1041258237 /nfs/dbraw/zinc/25/82/37/1041258237.db2.gz CNLHPBDQZDZGAM-UHFFFAOYSA-N 1 2 321.852 4.186 20 0 DIADLO CCCCn1nc(C)c(C[N@H+]2CCCc3occc3C2)c1Cl ZINC000809791952 1041258251 /nfs/dbraw/zinc/25/82/51/1041258251.db2.gz CNLHPBDQZDZGAM-UHFFFAOYSA-N 1 2 321.852 4.186 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccc(F)cc2)c(C)c1 ZINC000187794961 1041264466 /nfs/dbraw/zinc/26/44/66/1041264466.db2.gz SJRKXZIVXDQQCM-GOSISDBHSA-N 1 2 309.388 4.045 20 0 DIADLO Cc1cnc(C[NH2+][C@H](c2c(Cl)cccc2Cl)C2CC2)cn1 ZINC000810023338 1041292805 /nfs/dbraw/zinc/29/28/05/1041292805.db2.gz JXYJPJFPMOIAIE-INIZCTEOSA-N 1 2 322.239 4.333 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@@H+]2CCC(F)(F)[C@@H](C)C2)cc1 ZINC000810044517 1041300993 /nfs/dbraw/zinc/30/09/93/1041300993.db2.gz CALOQXISVZTISG-KGLIPLIRSA-N 1 2 324.415 4.116 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@H+]2CCC(F)(F)[C@@H](C)C2)cc1 ZINC000810044517 1041301001 /nfs/dbraw/zinc/30/10/01/1041301001.db2.gz CALOQXISVZTISG-KGLIPLIRSA-N 1 2 324.415 4.116 20 0 DIADLO C[C@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1cnn(C2CCC2)c1 ZINC000926810641 1041311898 /nfs/dbraw/zinc/31/18/98/1041311898.db2.gz UNEJWOKCCNSMEV-SJCJKPOMSA-N 1 2 305.372 4.109 20 0 DIADLO CCCn1c(C[NH2+]Cc2cc(F)ccc2F)nc2ccccc21 ZINC000107929286 1041314596 /nfs/dbraw/zinc/31/45/96/1041314596.db2.gz ZIUCLKAFRPLCOC-UHFFFAOYSA-N 1 2 315.367 4.014 20 0 DIADLO Fc1cccc2c1CC[C@H]2[NH2+]Cc1csc(C(F)(F)F)n1 ZINC000892681237 1041318149 /nfs/dbraw/zinc/31/81/49/1041318149.db2.gz XSRDDPDSRKRVLB-GFCCVEGCSA-N 1 2 316.323 4.078 20 0 DIADLO C[C@H]([NH2+]Cc1ccon1)c1ccc(-c2c(F)cccc2F)cc1 ZINC000810221312 1041339877 /nfs/dbraw/zinc/33/98/77/1041339877.db2.gz NPRFSZKSSRTETJ-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO CCN(C)c1ccc(Nc2cc(C(F)(F)F)cnc2C)c[nH+]1 ZINC001213828780 1041354510 /nfs/dbraw/zinc/35/45/10/1041354510.db2.gz VTGCDSOVMVPWHP-UHFFFAOYSA-N 1 2 310.323 4.004 20 0 DIADLO COc1ccc2cc(C[N@H+](C)Cc3nc(C)oc3C)ccc2c1 ZINC000659820369 1041377584 /nfs/dbraw/zinc/37/75/84/1041377584.db2.gz FWOYKKLXXFVEDZ-UHFFFAOYSA-N 1 2 310.397 4.085 20 0 DIADLO COc1ccc2cc(C[N@@H+](C)Cc3nc(C)oc3C)ccc2c1 ZINC000659820369 1041377598 /nfs/dbraw/zinc/37/75/98/1041377598.db2.gz FWOYKKLXXFVEDZ-UHFFFAOYSA-N 1 2 310.397 4.085 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)c(C)o1 ZINC000659821299 1041379056 /nfs/dbraw/zinc/37/90/56/1041379056.db2.gz LWBQRZUMSNLYMD-UHFFFAOYSA-N 1 2 324.346 4.475 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)c(C)o1 ZINC000659821299 1041379067 /nfs/dbraw/zinc/37/90/67/1041379067.db2.gz LWBQRZUMSNLYMD-UHFFFAOYSA-N 1 2 324.346 4.475 20 0 DIADLO COc1cccc(C[NH2+][C@H](C)c2nc(C)cs2)c1OC(C)C ZINC000892856095 1041410520 /nfs/dbraw/zinc/41/05/20/1041410520.db2.gz MPOHLNWYZJLLSI-CYBMUJFWSA-N 1 2 320.458 4.098 20 0 DIADLO CC[C@H](CC(F)F)C[N@@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000659849750 1041445608 /nfs/dbraw/zinc/44/56/08/1041445608.db2.gz JOGARSIFZUFUIM-YPMHNXCESA-N 1 2 313.392 4.155 20 0 DIADLO CC[C@H](CC(F)F)C[N@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000659849750 1041445615 /nfs/dbraw/zinc/44/56/15/1041445615.db2.gz JOGARSIFZUFUIM-YPMHNXCESA-N 1 2 313.392 4.155 20 0 DIADLO CC(C)(C)[C@@H]([NH2+]Cc1nccn1C1CC1)c1ccc(F)cc1F ZINC000893111730 1041491507 /nfs/dbraw/zinc/49/15/07/1041491507.db2.gz BPYCOBRHCLRJCE-KRWDZBQOSA-N 1 2 319.399 4.373 20 0 DIADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1cscn1 ZINC000271024125 1041491649 /nfs/dbraw/zinc/49/16/49/1041491649.db2.gz AVKCPPADSKRZTL-KGLIPLIRSA-N 1 2 304.459 4.480 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccnc(Cl)c2Cl)s1 ZINC000811461474 1041519946 /nfs/dbraw/zinc/51/99/46/1041519946.db2.gz LRUQONMBOJBAAL-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccnc(Cl)c2Cl)s1 ZINC000811461474 1041519951 /nfs/dbraw/zinc/51/99/51/1041519951.db2.gz LRUQONMBOJBAAL-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3ccnc(Cl)c3Cl)ccc21 ZINC000811487704 1041523102 /nfs/dbraw/zinc/52/31/02/1041523102.db2.gz SABKYANNKJFITN-UHFFFAOYSA-N 1 2 322.239 4.383 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3ccnc(Cl)c3Cl)ccc21 ZINC000811487704 1041523110 /nfs/dbraw/zinc/52/31/10/1041523110.db2.gz SABKYANNKJFITN-UHFFFAOYSA-N 1 2 322.239 4.383 20 0 DIADLO CC(C)[N@H+](Cc1ncsc1Br)C1CCCC1 ZINC000660061114 1041595727 /nfs/dbraw/zinc/59/57/27/1041595727.db2.gz FUJCMONAWMGMIL-UHFFFAOYSA-N 1 2 303.269 4.059 20 0 DIADLO CC(C)[N@@H+](Cc1ncsc1Br)C1CCCC1 ZINC000660061114 1041595733 /nfs/dbraw/zinc/59/57/33/1041595733.db2.gz FUJCMONAWMGMIL-UHFFFAOYSA-N 1 2 303.269 4.059 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1cccc(F)c1OC(F)F ZINC000660021136 1041585834 /nfs/dbraw/zinc/58/58/34/1041585834.db2.gz IRZOTGZZHRDXJG-HNNXBMFYSA-N 1 2 324.346 4.103 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1cccc(F)c1OC(F)F ZINC000660021136 1041585838 /nfs/dbraw/zinc/58/58/38/1041585838.db2.gz IRZOTGZZHRDXJG-HNNXBMFYSA-N 1 2 324.346 4.103 20 0 DIADLO c1csc([C@H](Cc2ccccc2)Nc2cc3cc[nH]c3c[nH+]2)n1 ZINC001170657382 1041587697 /nfs/dbraw/zinc/58/76/97/1041587697.db2.gz LMWXPGFKBZUSOR-HNNXBMFYSA-N 1 2 320.421 4.415 20 0 DIADLO Cc1ccc(CCCC(=O)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC000613714261 1041587989 /nfs/dbraw/zinc/58/79/89/1041587989.db2.gz FYJSTHAJGQGZIO-UHFFFAOYSA-N 1 2 319.408 4.142 20 0 DIADLO COc1cccc(C[N@@H+]2CC=C(C(F)(F)F)CC2)c1Cl ZINC000660131319 1041625962 /nfs/dbraw/zinc/62/59/62/1041625962.db2.gz ZGZGMLANVDDQRI-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO Cc1ccc([N@H+](C)CC2CCN(C(=O)C(C)(C)C)CC2)c(C)c1 ZINC000185195028 1041607849 /nfs/dbraw/zinc/60/78/49/1041607849.db2.gz RAUBQLMZEPPALT-UHFFFAOYSA-N 1 2 316.489 4.024 20 0 DIADLO Cc1ccc([N@@H+](C)CC2CCN(C(=O)C(C)(C)C)CC2)c(C)c1 ZINC000185195028 1041607857 /nfs/dbraw/zinc/60/78/57/1041607857.db2.gz RAUBQLMZEPPALT-UHFFFAOYSA-N 1 2 316.489 4.024 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)nc(C)n1 ZINC000660103233 1041615696 /nfs/dbraw/zinc/61/56/96/1041615696.db2.gz BCMJKEBZKCVCRL-GOSISDBHSA-N 1 2 317.383 4.099 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)nc(C)n1 ZINC000660103233 1041615697 /nfs/dbraw/zinc/61/56/97/1041615697.db2.gz BCMJKEBZKCVCRL-GOSISDBHSA-N 1 2 317.383 4.099 20 0 DIADLO Cc1nc(C[NH+]2CCC(=Cc3cccc(F)c3)CC2)c(C)o1 ZINC000660106933 1041616668 /nfs/dbraw/zinc/61/66/68/1041616668.db2.gz DKVPDNDQKCAAAU-UHFFFAOYSA-N 1 2 300.377 4.110 20 0 DIADLO COc1cccc(C[N@H+]2CC=C(C(F)(F)F)CC2)c1Cl ZINC000660131319 1041625952 /nfs/dbraw/zinc/62/59/52/1041625952.db2.gz ZGZGMLANVDDQRI-UHFFFAOYSA-N 1 2 305.727 4.043 20 0 DIADLO Cc1ccc(C[S@](=O)[C@@H](C)c2ccc3c(c2)CCC3)c(C)[nH+]1 ZINC000417160642 1041639123 /nfs/dbraw/zinc/63/91/23/1041639123.db2.gz HZWJKPRVQALMJR-NYHFZMIOSA-N 1 2 313.466 4.197 20 0 DIADLO CCC[C@H]([NH2+]Cc1nnc(C(F)(F)F)s1)c1ccccc1 ZINC000660175939 1041649280 /nfs/dbraw/zinc/64/92/80/1041649280.db2.gz VRNHROMWRODMOT-NSHDSACASA-N 1 2 315.364 4.188 20 0 DIADLO C[C@H]1C[N@H+](Cc2cncc(C(F)(F)F)c2)Cc2ccccc21 ZINC000812822961 1041649999 /nfs/dbraw/zinc/64/99/99/1041649999.db2.gz NHJZFFGKHQAUJK-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cncc(C(F)(F)F)c2)Cc2ccccc21 ZINC000812822961 1041650003 /nfs/dbraw/zinc/65/00/03/1041650003.db2.gz NHJZFFGKHQAUJK-LBPRGKRZSA-N 1 2 306.331 4.220 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cncc(C(F)(F)F)c2)n1 ZINC000812829339 1041653374 /nfs/dbraw/zinc/65/33/74/1041653374.db2.gz RXWJDLUXYXFHHR-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2cncc(C(F)(F)F)c2)n1 ZINC000812829339 1041653379 /nfs/dbraw/zinc/65/33/79/1041653379.db2.gz RXWJDLUXYXFHHR-MRXNPFEDSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc(C[NH2+]Cc2c(Cl)cc(Cl)cc2N(C)C)nc1 ZINC000641766697 1041656942 /nfs/dbraw/zinc/65/69/42/1041656942.db2.gz QXEQFLDSVFIZSY-UHFFFAOYSA-N 1 2 324.255 4.053 20 0 DIADLO C[C@H]([NH2+]Cc1ncccc1F)c1csc(C(F)(F)F)c1 ZINC000925595806 1041659929 /nfs/dbraw/zinc/65/99/29/1041659929.db2.gz CAQZLIVYWDRUBY-QMMMGPOBSA-N 1 2 304.312 4.152 20 0 DIADLO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H](C)C(F)(F)c1ccccc1 ZINC000925603680 1041670556 /nfs/dbraw/zinc/67/05/56/1041670556.db2.gz CRCCKKDRJVSTSX-SMDDNHRTSA-N 1 2 308.372 4.165 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)[nH]1 ZINC000660238189 1041683673 /nfs/dbraw/zinc/68/36/73/1041683673.db2.gz HYJMDWYLHBBDAW-BMIGLBTASA-N 1 2 324.831 4.208 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2sc(-c3ccccc3)nc2C)co1 ZINC000660264756 1041696251 /nfs/dbraw/zinc/69/62/51/1041696251.db2.gz ZMIFGGARUWXQTN-LLVKDONJSA-N 1 2 313.426 4.266 20 0 DIADLO CCc1nocc1C[NH2+][C@H](C)c1nc(-c2ccccc2)cs1 ZINC000660267670 1041697287 /nfs/dbraw/zinc/69/72/87/1041697287.db2.gz UECDXYNGPCCOLS-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO CCn1c[nH+]cc1CNc1cccc(COC2CCCCC2)c1 ZINC000417802857 1041702828 /nfs/dbraw/zinc/70/28/28/1041702828.db2.gz FJJUKWSRVUTKEI-UHFFFAOYSA-N 1 2 313.445 4.364 20 0 DIADLO CCn1c[nH+]cc1CNc1cccc(OCc2cccc(C)c2)c1 ZINC000417827324 1041704262 /nfs/dbraw/zinc/70/42/62/1041704262.db2.gz FMOGWRRKJIELHG-UHFFFAOYSA-N 1 2 321.424 4.403 20 0 DIADLO Cc1nc(C)c(C[N@@H+]2CCc3c(Cl)cc(F)cc3C2)s1 ZINC001170709363 1041722921 /nfs/dbraw/zinc/72/29/21/1041722921.db2.gz CDRZZZCKRQXTPI-UHFFFAOYSA-N 1 2 310.825 4.111 20 0 DIADLO Cc1nc(C)c(C[N@H+]2CCc3c(Cl)cc(F)cc3C2)s1 ZINC001170709363 1041722931 /nfs/dbraw/zinc/72/29/31/1041722931.db2.gz CDRZZZCKRQXTPI-UHFFFAOYSA-N 1 2 310.825 4.111 20 0 DIADLO Clc1scc(C[NH2+][C@H]2COCc3ccccc32)c1Cl ZINC000418099593 1041725893 /nfs/dbraw/zinc/72/58/93/1041725893.db2.gz CCTOHCFYXGMDOW-LBPRGKRZSA-N 1 2 314.237 4.416 20 0 DIADLO CC(C)CCCCCC(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000747877118 1041733239 /nfs/dbraw/zinc/73/32/39/1041733239.db2.gz NOFJSYNYDDRTGB-UHFFFAOYSA-N 1 2 313.445 4.095 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](c2ccccc2)[C@@H](O)c2ccccc2)no1 ZINC000813876735 1041741729 /nfs/dbraw/zinc/74/17/29/1041741729.db2.gz ZHYAZEQHAGJXLR-BEVDRBHNSA-N 1 2 322.408 4.109 20 0 DIADLO Cc1nc2cc(CNc3cc(C)c(C(F)(F)F)c[nH+]3)ccc2o1 ZINC001167756750 1041759753 /nfs/dbraw/zinc/75/97/53/1041759753.db2.gz MVXNNPKRAVFMSF-UHFFFAOYSA-N 1 2 321.302 4.471 20 0 DIADLO C[C@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ncco1 ZINC000925680776 1041767633 /nfs/dbraw/zinc/76/76/33/1041767633.db2.gz UHTOOFDTQNAVDO-HZMBPMFUSA-N 1 2 310.319 4.495 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cscc2Cl)C[C@@H](c2ccccc2)O1 ZINC000678213752 1041772541 /nfs/dbraw/zinc/77/25/41/1041772541.db2.gz CZXXPPMHLXOBKQ-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cscc2Cl)C[C@@H](c2ccccc2)O1 ZINC000678213752 1041772546 /nfs/dbraw/zinc/77/25/46/1041772546.db2.gz CZXXPPMHLXOBKQ-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2CCc3ccc(F)c(Cl)c32)c1 ZINC000652067713 1041772861 /nfs/dbraw/zinc/77/28/61/1041772861.db2.gz DKYVVZOCHKYWMW-CYBMUJFWSA-N 1 2 306.768 4.120 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1ccc(Cl)nc1)[C@@H]2C ZINC000781928225 1041773017 /nfs/dbraw/zinc/77/30/17/1041773017.db2.gz VFXWFFDSHUEHAJ-CHWSQXEVSA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1ccc(Cl)nc1)[C@@H]2C ZINC000781928225 1041773020 /nfs/dbraw/zinc/77/30/20/1041773020.db2.gz VFXWFFDSHUEHAJ-CHWSQXEVSA-N 1 2 316.832 4.251 20 0 DIADLO CSc1cc(NC2CCN(c3cccc[nH+]3)CC2)ccc1C ZINC000652072549 1041774263 /nfs/dbraw/zinc/77/42/63/1041774263.db2.gz BMWNSPILUCIMTP-UHFFFAOYSA-N 1 2 313.470 4.193 20 0 DIADLO COC(=O)c1cc2[nH+]c[nH]c2c(N[C@@H](C)c2ccc(C)cc2C)c1 ZINC001170726859 1041775694 /nfs/dbraw/zinc/77/56/94/1041775694.db2.gz WPLWTFGHWTVHLV-ZDUSSCGKSA-N 1 2 323.396 4.139 20 0 DIADLO Cc1nn(C(C)C)c(C)c1CNc1ccc2c(c1)CCC[N@H+]2C ZINC000893367452 1041792085 /nfs/dbraw/zinc/79/20/85/1041792085.db2.gz HQMITZCQYMLIRI-UHFFFAOYSA-N 1 2 312.461 4.075 20 0 DIADLO Cc1nn(C(C)C)c(C)c1CNc1ccc2c(c1)CCC[N@@H+]2C ZINC000893367452 1041792091 /nfs/dbraw/zinc/79/20/91/1041792091.db2.gz HQMITZCQYMLIRI-UHFFFAOYSA-N 1 2 312.461 4.075 20 0 DIADLO CC(C)CCCCCC(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000747934162 1041809611 /nfs/dbraw/zinc/80/96/11/1041809611.db2.gz IKBKCXBAZGPYLE-UHFFFAOYSA-N 1 2 313.445 4.095 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2ccc(F)c(-c3cccs3)c2)n1 ZINC000557178841 1041839071 /nfs/dbraw/zinc/83/90/71/1041839071.db2.gz LDHPJEULAUXVMS-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO c1coc([C@H]([NH2+][C@H]2CCCc3cccnc32)c2ccccc2)c1 ZINC000320734694 1041839172 /nfs/dbraw/zinc/83/91/72/1041839172.db2.gz AIAQROPRIFLUCE-FXAWDEMLSA-N 1 2 304.393 4.431 20 0 DIADLO c1coc([C@H]([NH2+][C@@H]2CCCc3cccnc32)c2ccccc2)c1 ZINC000320734697 1041839900 /nfs/dbraw/zinc/83/99/00/1041839900.db2.gz AIAQROPRIFLUCE-YLJYHZDGSA-N 1 2 304.393 4.431 20 0 DIADLO c1coc([C@@H]([NH2+][C@H]2CCCc3cccnc32)c2ccccc2)c1 ZINC000320734695 1041840365 /nfs/dbraw/zinc/84/03/65/1041840365.db2.gz AIAQROPRIFLUCE-PXNSSMCTSA-N 1 2 304.393 4.431 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(F)c2Br)CCC1(F)F ZINC001137717262 1041848141 /nfs/dbraw/zinc/84/81/41/1041848141.db2.gz RLUOMCZCUMSVDZ-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(F)c2Br)CCC1(F)F ZINC001137717262 1041848150 /nfs/dbraw/zinc/84/81/50/1041848150.db2.gz RLUOMCZCUMSVDZ-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO CCc1ccc([C@H](C)[NH2+]Cc2nccn2CCc2ccccc2)o1 ZINC000164316457 1041896998 /nfs/dbraw/zinc/89/69/98/1041896998.db2.gz IUNCCBXJSHLWFO-INIZCTEOSA-N 1 2 323.440 4.132 20 0 DIADLO CC(C)(C)C(=O)Nc1ccc(Cl)cc1Nc1ccc(N)[nH+]c1 ZINC001159282109 1041913343 /nfs/dbraw/zinc/91/33/43/1041913343.db2.gz NMEZSFIAWJUCQA-UHFFFAOYSA-N 1 2 318.808 4.045 20 0 DIADLO CCN(C)c1cc(NC2c3ccccc3-c3ccccc32)[nH+]cn1 ZINC001167777204 1041919300 /nfs/dbraw/zinc/91/93/00/1041919300.db2.gz QTINOCKQHABVIO-UHFFFAOYSA-N 1 2 316.408 4.115 20 0 DIADLO CCN(C)c1cc(NC2c3ccccc3-c3ccccc32)nc[nH+]1 ZINC001167777204 1041919310 /nfs/dbraw/zinc/91/93/10/1041919310.db2.gz QTINOCKQHABVIO-UHFFFAOYSA-N 1 2 316.408 4.115 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2ccc(Cl)cc2F)c(F)c1 ZINC000815151766 1041919525 /nfs/dbraw/zinc/91/95/25/1041919525.db2.gz CLZARKQDFJUXNB-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1ccc(-c2ccccc2)cn1 ZINC000651822514 1041924048 /nfs/dbraw/zinc/92/40/48/1041924048.db2.gz AAOYZPMNMALXIH-HZPDHXFCSA-N 1 2 320.440 4.377 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1)[N@@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661445575 1041939173 /nfs/dbraw/zinc/93/91/73/1041939173.db2.gz INJIOCOGKHRHAX-YJBOKZPZSA-N 1 2 324.424 4.224 20 0 DIADLO C[C@@H](C(=O)Nc1ccccc1)[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661445575 1041939182 /nfs/dbraw/zinc/93/91/82/1041939182.db2.gz INJIOCOGKHRHAX-YJBOKZPZSA-N 1 2 324.424 4.224 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+][C@H](c2ccccc2F)C(C)C)cs1 ZINC000661489152 1041943613 /nfs/dbraw/zinc/94/36/13/1041943613.db2.gz ZXPFYWGJZCYKHH-WBMJQRKESA-N 1 2 322.449 4.477 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893479382 1041964036 /nfs/dbraw/zinc/96/40/36/1041964036.db2.gz VFKJZPSHBUVTCA-WDEREUQCSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893479382 1041964039 /nfs/dbraw/zinc/96/40/39/1041964039.db2.gz VFKJZPSHBUVTCA-WDEREUQCSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893479380 1041964194 /nfs/dbraw/zinc/96/41/94/1041964194.db2.gz VFKJZPSHBUVTCA-QWRGUYRKSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000893479380 1041964199 /nfs/dbraw/zinc/96/41/99/1041964199.db2.gz VFKJZPSHBUVTCA-QWRGUYRKSA-N 1 2 304.356 4.135 20 0 DIADLO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1cc(COC(C)(C)C)on1 ZINC000815618041 1041975439 /nfs/dbraw/zinc/97/54/39/1041975439.db2.gz CDGYYXWONWHYPC-CYBMUJFWSA-N 1 2 320.408 4.288 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccnc(Cl)c1 ZINC000815649791 1041985604 /nfs/dbraw/zinc/98/56/04/1041985604.db2.gz ZELNCUJIQIHNFM-QMMMGPOBSA-N 1 2 300.711 4.003 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(Cl)n1C)c1cccc(Cl)c1Cl ZINC000178448107 1041992976 /nfs/dbraw/zinc/99/29/76/1041992976.db2.gz CTNFOBYHPLZNTE-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO Brc1nc(C[N@@H+]2CCC[C@@H]3CCCC[C@@H]32)cs1 ZINC001137583565 1041993374 /nfs/dbraw/zinc/99/33/74/1041993374.db2.gz ZHPCONMEMHRYSG-JQWIXIFHSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1nc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)cs1 ZINC001137583565 1041993379 /nfs/dbraw/zinc/99/33/79/1041993379.db2.gz ZHPCONMEMHRYSG-JQWIXIFHSA-N 1 2 315.280 4.060 20 0 DIADLO COCc1cc[nH+]c(N[C@@H]2C[C@H](C)Sc3sccc32)c1 ZINC000652330613 1042009725 /nfs/dbraw/zinc/00/97/25/1042009725.db2.gz KYMLWUJFROVNIV-GXFFZTMASA-N 1 2 306.456 4.327 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2ccc(OC(C)C)cc2)c1 ZINC000652330968 1042010617 /nfs/dbraw/zinc/01/06/17/1042010617.db2.gz UIAQPAWQJOLDFI-AWEZNQCLSA-N 1 2 300.402 4.188 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2ccc(OC(C)C)cc2)c1 ZINC000652330969 1042011352 /nfs/dbraw/zinc/01/13/52/1042011352.db2.gz UIAQPAWQJOLDFI-CQSZACIVSA-N 1 2 300.402 4.188 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2cc3c(s2)CCCC3)c1 ZINC000652331103 1042011461 /nfs/dbraw/zinc/01/14/61/1042011461.db2.gz YEARZWPVDRKFCK-LBPRGKRZSA-N 1 2 302.443 4.341 20 0 DIADLO COCc1nc(C[N@@H+]2CCCC[C@@H]2c2ccc(C)cc2)cs1 ZINC000075767201 1042046921 /nfs/dbraw/zinc/04/69/21/1042046921.db2.gz WPUDPKIGCYCNDR-QGZVFWFLSA-N 1 2 316.470 4.325 20 0 DIADLO COCc1nc(C[N@H+]2CCCC[C@@H]2c2ccc(C)cc2)cs1 ZINC000075767201 1042046928 /nfs/dbraw/zinc/04/69/28/1042046928.db2.gz WPUDPKIGCYCNDR-QGZVFWFLSA-N 1 2 316.470 4.325 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1cnn(C)c1Cl ZINC000816483940 1042056003 /nfs/dbraw/zinc/05/60/03/1042056003.db2.gz KZSFBKJDJCRERG-LLVKDONJSA-N 1 2 303.793 4.013 20 0 DIADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1cnn(C)c1Cl ZINC000816483940 1042056009 /nfs/dbraw/zinc/05/60/09/1042056009.db2.gz KZSFBKJDJCRERG-LLVKDONJSA-N 1 2 303.793 4.013 20 0 DIADLO Cn1ncc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1Cl ZINC000816486421 1042056232 /nfs/dbraw/zinc/05/62/32/1042056232.db2.gz CWHUOBULJRYQSW-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1ncc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1Cl ZINC000816486421 1042056237 /nfs/dbraw/zinc/05/62/37/1042056237.db2.gz CWHUOBULJRYQSW-CQSZACIVSA-N 1 2 310.228 4.064 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+]1CC[C@H]1c1ccc(Br)cc1 ZINC000662098059 1042064292 /nfs/dbraw/zinc/06/42/92/1042064292.db2.gz DTUHADYBHCPOPE-WBMJQRKESA-N 1 2 317.230 4.352 20 0 DIADLO C[C@H](c1ccncc1)[N@H+]1CC[C@H]1c1ccc(Br)cc1 ZINC000662098059 1042064295 /nfs/dbraw/zinc/06/42/95/1042064295.db2.gz DTUHADYBHCPOPE-WBMJQRKESA-N 1 2 317.230 4.352 20 0 DIADLO C[C@H](Cc1ccccc1)[N@H+](Cc1csnn1)Cc1ccccc1 ZINC000662155701 1042074382 /nfs/dbraw/zinc/07/43/82/1042074382.db2.gz MYILLBDQWJUNCX-MRXNPFEDSA-N 1 2 323.465 4.172 20 0 DIADLO C[C@H](Cc1ccccc1)[N@@H+](Cc1csnn1)Cc1ccccc1 ZINC000662155701 1042074389 /nfs/dbraw/zinc/07/43/89/1042074389.db2.gz MYILLBDQWJUNCX-MRXNPFEDSA-N 1 2 323.465 4.172 20 0 DIADLO FC(F)Oc1ccc(Br)cc1C[NH+]1CCCCC1 ZINC000060208156 1042087110 /nfs/dbraw/zinc/08/71/10/1042087110.db2.gz GMNAUIGVOQCNMT-UHFFFAOYSA-N 1 2 320.177 4.036 20 0 DIADLO C[N@@H+](Cc1csc(C2CCCCC2)n1)CC1=CCSC1 ZINC000662271604 1042104117 /nfs/dbraw/zinc/10/41/17/1042104117.db2.gz WDPRCHGFNVFPOF-UHFFFAOYSA-N 1 2 308.516 4.296 20 0 DIADLO C[N@H+](Cc1csc(C2CCCCC2)n1)CC1=CCSC1 ZINC000662271604 1042104121 /nfs/dbraw/zinc/10/41/21/1042104121.db2.gz WDPRCHGFNVFPOF-UHFFFAOYSA-N 1 2 308.516 4.296 20 0 DIADLO CC(C)n1ccn(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)c1=S ZINC000817366406 1042106441 /nfs/dbraw/zinc/10/64/41/1042106441.db2.gz WLYGTEZPTXMJGE-GFCCVEGCSA-N 1 2 321.412 4.222 20 0 DIADLO CC(C)n1ccn(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c1=S ZINC000817366406 1042106444 /nfs/dbraw/zinc/10/64/44/1042106444.db2.gz WLYGTEZPTXMJGE-GFCCVEGCSA-N 1 2 321.412 4.222 20 0 DIADLO Cc1cc(C)n(-c2ccc(CNc3c[nH+]c(C)c(C)c3)cc2)n1 ZINC001167796531 1042106632 /nfs/dbraw/zinc/10/66/32/1042106632.db2.gz SDXKUIISMHRCRL-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@H](C)c1ccncc1Cl)CCC2 ZINC000817584801 1042118583 /nfs/dbraw/zinc/11/85/83/1042118583.db2.gz FXONCPZPYBANHG-WBMJQRKESA-N 1 2 318.852 4.241 20 0 DIADLO COc1ccc([C@@H]2CCCN2c2[nH+]ccc3c(N)cccc32)cc1 ZINC000663331075 1042120561 /nfs/dbraw/zinc/12/05/61/1042120561.db2.gz GVBIDWLUMXGYCA-IBGZPJMESA-N 1 2 319.408 4.167 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1csc([C@H](C)OC)n1 ZINC000165241134 1042120826 /nfs/dbraw/zinc/12/08/26/1042120826.db2.gz AWBFPXORMSDEPV-OLZOCXBDSA-N 1 2 320.458 4.018 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1csc([C@H](C)OC)n1 ZINC000165241263 1042121211 /nfs/dbraw/zinc/12/12/11/1042121211.db2.gz AWBFPXORMSDEPV-STQMWFEESA-N 1 2 320.458 4.018 20 0 DIADLO CC[N@H+](Cc1noc(-c2ccccc2)n1)Cc1ccccc1C ZINC000051536633 1042140591 /nfs/dbraw/zinc/14/05/91/1042140591.db2.gz FDRAPQXYSABCGY-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO CC[N@@H+](Cc1noc(-c2ccccc2)n1)Cc1ccccc1C ZINC000051536633 1042140596 /nfs/dbraw/zinc/14/05/96/1042140596.db2.gz FDRAPQXYSABCGY-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2cc(C(C)C)no2)c(Cl)c1 ZINC000818331337 1042148156 /nfs/dbraw/zinc/14/81/56/1042148156.db2.gz FVMXFUURXIJUEE-LLVKDONJSA-N 1 2 308.809 4.311 20 0 DIADLO FC[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccc(Cl)cc2F)C1 ZINC001137656579 1042157497 /nfs/dbraw/zinc/15/74/97/1042157497.db2.gz MRDSWUIQJYCVKC-LBPRGKRZSA-N 1 2 313.697 4.203 20 0 DIADLO FC[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccc(Cl)cc2F)C1 ZINC001137656579 1042157503 /nfs/dbraw/zinc/15/75/03/1042157503.db2.gz MRDSWUIQJYCVKC-LBPRGKRZSA-N 1 2 313.697 4.203 20 0 DIADLO Cc1cc(C(F)(F)F)cc(N2CCC[C@H]2c2ccccn2)[nH+]1 ZINC000663417060 1042158665 /nfs/dbraw/zinc/15/86/65/1042158665.db2.gz GLIDRSGCCLVDSA-AWEZNQCLSA-N 1 2 307.319 4.145 20 0 DIADLO CCn1c(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)nc2ccccc21 ZINC000071006110 1042174539 /nfs/dbraw/zinc/17/45/39/1042174539.db2.gz XOEBKIFSUWJYII-DZGCQCFKSA-N 1 2 309.413 4.062 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1cc2ccccc2nc1Cl ZINC000314972590 1042182273 /nfs/dbraw/zinc/18/22/73/1042182273.db2.gz NZYNETOZZMBKCS-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1cc2ccccc2nc1Cl ZINC000314972590 1042182279 /nfs/dbraw/zinc/18/22/79/1042182279.db2.gz NZYNETOZZMBKCS-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2cnccc2C(F)(F)F)c(C)s1 ZINC000663471577 1042183238 /nfs/dbraw/zinc/18/32/38/1042183238.db2.gz SNFXCTRXNZHASK-MRVPVSSYSA-N 1 2 315.364 4.025 20 0 DIADLO C[Si](C)(C)CCCC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001136329149 1042211500 /nfs/dbraw/zinc/21/15/00/1042211500.db2.gz PSRZMYBTFNYGKO-UHFFFAOYSA-N 1 2 319.456 4.068 20 0 DIADLO COc1cc([C@H](C)Nc2ccc([NH+](C)C)cc2C)ccc1F ZINC000317285793 1042223084 /nfs/dbraw/zinc/22/30/84/1042223084.db2.gz PQRISMQXHUPFSZ-ZDUSSCGKSA-N 1 2 302.393 4.382 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](Cc2ccccc2C)c2ccco2)s1 ZINC000820812259 1042229261 /nfs/dbraw/zinc/22/92/61/1042229261.db2.gz GYRMTRTXIVFSBT-INIZCTEOSA-N 1 2 312.438 4.427 20 0 DIADLO CCN(C(=O)[C@@H](CC(C)C)n1cc[nH+]c1)c1cccc(C)c1C ZINC001136389220 1042234057 /nfs/dbraw/zinc/23/40/57/1042234057.db2.gz QXFQJMZJIWXZOU-GOSISDBHSA-N 1 2 313.445 4.140 20 0 DIADLO Cc1cc(C[NH2+]C2(c3noc(C)n3)CCCCCC2)c(C)s1 ZINC000585749209 1042243205 /nfs/dbraw/zinc/24/32/05/1042243205.db2.gz YBHAWRYLAUPOAV-UHFFFAOYSA-N 1 2 319.474 4.396 20 0 DIADLO Cc1nc(C2([NH2+]Cc3cc(C)ccc3C)CCCCCC2)no1 ZINC000585749379 1042243368 /nfs/dbraw/zinc/24/33/68/1042243368.db2.gz LGXNOWNBSPBGSX-UHFFFAOYSA-N 1 2 313.445 4.334 20 0 DIADLO Cc1csc(C2([NH2+][C@H](C)c3cc(O)cc(F)c3)CCC2)n1 ZINC000925804461 1042251852 /nfs/dbraw/zinc/25/18/52/1042251852.db2.gz IBDDEXWLRXOFHH-LLVKDONJSA-N 1 2 306.406 4.026 20 0 DIADLO COc1ccc(CNc2ccc([NH+]3CCCC3)cc2)c(F)c1 ZINC000317858204 1042255761 /nfs/dbraw/zinc/25/57/61/1042255761.db2.gz BKXBOILUORDMKB-UHFFFAOYSA-N 1 2 300.377 4.047 20 0 DIADLO CC[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccccc1OC ZINC000319782328 1042258793 /nfs/dbraw/zinc/25/87/93/1042258793.db2.gz MFTACHSKNIKNFI-QGZVFWFLSA-N 1 2 311.429 4.254 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)cc1 ZINC000319783518 1042259826 /nfs/dbraw/zinc/25/98/26/1042259826.db2.gz HCSGEGFFMXFWTK-HNNXBMFYSA-N 1 2 311.429 4.254 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+]Cc2ccc3c(n2)CCCC3)s1 ZINC000279020510 1042260671 /nfs/dbraw/zinc/26/06/71/1042260671.db2.gz AGGCBHUCRWGGFU-UHFFFAOYSA-N 1 2 315.486 4.004 20 0 DIADLO C[C@@H]([NH2+]Cc1ccnc(Cl)c1)c1nc(C(F)(F)F)cs1 ZINC000279048240 1042265148 /nfs/dbraw/zinc/26/51/48/1042265148.db2.gz YGBRYVFKLWZMTO-SSDOTTSWSA-N 1 2 321.755 4.061 20 0 DIADLO CC(C)(C)[C@@H]1CCCC[C@H]1CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001136512696 1042267831 /nfs/dbraw/zinc/26/78/31/1042267831.db2.gz HEJQIHVOLJTFSL-DZGCQCFKSA-N 1 2 313.445 4.145 20 0 DIADLO COCC[C@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1ccc(C)o1 ZINC000279235328 1042284443 /nfs/dbraw/zinc/28/44/43/1042284443.db2.gz ZFVVRTPWFQAQQY-ZDUSSCGKSA-N 1 2 322.474 4.209 20 0 DIADLO C[C@@H]1C[N@H+](CC[C@H]2CC2(Cl)Cl)C[C@@H](c2ccsc2)O1 ZINC000822686094 1042298197 /nfs/dbraw/zinc/29/81/97/1042298197.db2.gz OCNCMXAOYLRVHS-WXHSDQCUSA-N 1 2 320.285 4.094 20 0 DIADLO C[C@@H]1C[N@@H+](CC[C@H]2CC2(Cl)Cl)C[C@@H](c2ccsc2)O1 ZINC000822686094 1042298199 /nfs/dbraw/zinc/29/81/99/1042298199.db2.gz OCNCMXAOYLRVHS-WXHSDQCUSA-N 1 2 320.285 4.094 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C(C)(C)C(C)(F)F)c2)[nH+]c1C ZINC000822729969 1042298648 /nfs/dbraw/zinc/29/86/48/1042298648.db2.gz DHFIGXFPYYVOTI-UHFFFAOYSA-N 1 2 321.371 4.313 20 0 DIADLO Cc1cc(NC(=O)C(C2CCC2)C2CCC2)ccc1-n1cc[nH+]c1 ZINC001136625086 1042300171 /nfs/dbraw/zinc/30/01/71/1042300171.db2.gz WPBUPGUKWLEZCP-UHFFFAOYSA-N 1 2 323.440 4.336 20 0 DIADLO CCCC[C@](C)(F)C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001136625769 1042300974 /nfs/dbraw/zinc/30/09/74/1042300974.db2.gz XYPDULWRNGEGKB-KRWDZBQOSA-N 1 2 303.381 4.038 20 0 DIADLO Fc1ccc([C@@H](Nc2ccc(N3CCCC3)[nH+]c2)C2CC2)cc1 ZINC000320046554 1042303122 /nfs/dbraw/zinc/30/31/22/1042303122.db2.gz PMKUNSLAHVGHRL-IBGZPJMESA-N 1 2 311.404 4.384 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)cn1 ZINC000163214841 1042308341 /nfs/dbraw/zinc/30/83/41/1042308341.db2.gz GBMOMXWAYFTIOE-DNVCBOLYSA-N 1 2 309.413 4.497 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)cn1 ZINC000163214752 1042308682 /nfs/dbraw/zinc/30/86/82/1042308682.db2.gz GBMOMXWAYFTIOE-KXBFYZLASA-N 1 2 309.413 4.497 20 0 DIADLO Cc1[nH+]cc(CNc2cnc(Cl)c(C)c2)n1-c1ccccc1 ZINC000318903087 1042317265 /nfs/dbraw/zinc/31/72/65/1042317265.db2.gz SEWVEVADRTVMSZ-UHFFFAOYSA-N 1 2 312.804 4.150 20 0 DIADLO COc1cc2ccccc2cc1C[N@H+](C)Cc1c(C)noc1C ZINC000823408588 1042324848 /nfs/dbraw/zinc/32/48/48/1042324848.db2.gz NDZVXIWROKFKCY-UHFFFAOYSA-N 1 2 310.397 4.085 20 0 DIADLO COc1cc2ccccc2cc1C[N@@H+](C)Cc1c(C)noc1C ZINC000823408588 1042324856 /nfs/dbraw/zinc/32/48/56/1042324856.db2.gz NDZVXIWROKFKCY-UHFFFAOYSA-N 1 2 310.397 4.085 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(F)ncc2F)[C@@H]1c1cccc(F)c1 ZINC000823470958 1042328031 /nfs/dbraw/zinc/32/80/31/1042328031.db2.gz PHUMCYQXSOJTOI-DIFFPNOSSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(F)ncc2F)[C@@H]1c1cccc(F)c1 ZINC000823470958 1042328036 /nfs/dbraw/zinc/32/80/36/1042328036.db2.gz PHUMCYQXSOJTOI-DIFFPNOSSA-N 1 2 306.331 4.082 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(SC(C)C)cc2)o1 ZINC000112543392 1042341550 /nfs/dbraw/zinc/34/15/50/1042341550.db2.gz MQKYMJOSHQYGRD-VXGBXAGGSA-N 1 2 305.447 4.290 20 0 DIADLO Clc1cccc2c1CCN2Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001167898068 1042343214 /nfs/dbraw/zinc/34/32/14/1042343214.db2.gz LNHZZSFRTUMBIN-UHFFFAOYSA-N 1 2 309.800 4.088 20 0 DIADLO CCCCS[C@H](C)C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000279820497 1042346006 /nfs/dbraw/zinc/34/60/06/1042346006.db2.gz AEAABXQEQZDBGM-CYBMUJFWSA-N 1 2 317.458 4.245 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(OC(C)C)cc2)s1 ZINC000274275194 1042351793 /nfs/dbraw/zinc/35/17/93/1042351793.db2.gz XLPSDFAAGXZTJG-RYUDHWBXSA-N 1 2 305.447 4.046 20 0 DIADLO CCCC[C@H](CC)CC[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000437986076 1042360121 /nfs/dbraw/zinc/36/01/21/1042360121.db2.gz KHZBZHSQXDDWKD-DOTOQJQBSA-N 1 2 300.450 4.090 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cc(F)cnc1Br ZINC001213491617 1042365599 /nfs/dbraw/zinc/36/55/99/1042365599.db2.gz OKESGKQELIPXTQ-UHFFFAOYSA-N 1 2 322.181 4.308 20 0 DIADLO Cc1cc(OCc2nnc(C3CC3)s2)c2cccc(C)c2[nH+]1 ZINC000418949052 1042366573 /nfs/dbraw/zinc/36/65/73/1042366573.db2.gz URVNKBIMKMKIRL-UHFFFAOYSA-N 1 2 311.410 4.160 20 0 DIADLO COc1ccc(COCCSCc2ccc(C)[nH+]c2C)cc1 ZINC000614063536 1042374726 /nfs/dbraw/zinc/37/47/26/1042374726.db2.gz GSGIKDNROYNACI-UHFFFAOYSA-N 1 2 317.454 4.157 20 0 DIADLO Brc1cncc([C@@H]2CCC[N@@H+]2Cc2ccsc2)c1 ZINC000932252604 1042384886 /nfs/dbraw/zinc/38/48/86/1042384886.db2.gz MTNVWTCAVZBPSY-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cncc([C@@H]2CCC[N@H+]2Cc2ccsc2)c1 ZINC000932252604 1042384892 /nfs/dbraw/zinc/38/48/92/1042384892.db2.gz MTNVWTCAVZBPSY-AWEZNQCLSA-N 1 2 323.259 4.243 20 0 DIADLO COc1c(F)cccc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001143536922 1042391989 /nfs/dbraw/zinc/39/19/89/1042391989.db2.gz KLVNRNIJDVYRLI-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cccc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001143536922 1042391993 /nfs/dbraw/zinc/39/19/93/1042391993.db2.gz KLVNRNIJDVYRLI-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cc(N2CC(C)(C)[C@H]2c2cccnc2)nc(C2CCC2)[nH+]1 ZINC000893947627 1042397947 /nfs/dbraw/zinc/39/79/47/1042397947.db2.gz JVGMZJWYWALBQV-QGZVFWFLSA-N 1 2 308.429 4.035 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)CSc2ccccc2)c(C)[nH+]1 ZINC000110191611 1042400789 /nfs/dbraw/zinc/40/07/89/1042400789.db2.gz XMGCIOBIQLAGRG-CYBMUJFWSA-N 1 2 314.454 4.374 20 0 DIADLO COc1ccnc([C@@H](C)[NH2+]Cc2c(Cl)cccc2Cl)c1 ZINC000924860377 1042409072 /nfs/dbraw/zinc/40/90/72/1042409072.db2.gz IQWVQKSFZSEZNV-SNVBAGLBSA-N 1 2 311.212 4.248 20 0 DIADLO CCCCc1noc(C[N@H+](C)Cc2cccc3ccccc32)n1 ZINC000051992785 1042446085 /nfs/dbraw/zinc/44/60/85/1042446085.db2.gz HKKZBBCCILAYKE-UHFFFAOYSA-N 1 2 309.413 4.197 20 0 DIADLO CCCCc1noc(C[N@@H+](C)Cc2cccc3ccccc32)n1 ZINC000051992785 1042446086 /nfs/dbraw/zinc/44/60/86/1042446086.db2.gz HKKZBBCCILAYKE-UHFFFAOYSA-N 1 2 309.413 4.197 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cn2cc(Cl)ccc2n1 ZINC000052073711 1042465850 /nfs/dbraw/zinc/46/58/50/1042465850.db2.gz SOBKESLSYOJURQ-GFCCVEGCSA-N 1 2 317.795 4.320 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cn2cc(Cl)ccc2n1 ZINC000052073711 1042465856 /nfs/dbraw/zinc/46/58/56/1042465856.db2.gz SOBKESLSYOJURQ-GFCCVEGCSA-N 1 2 317.795 4.320 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2ccc(C3CC3)cc2)s1 ZINC000419325255 1042470207 /nfs/dbraw/zinc/47/02/07/1042470207.db2.gz AYMODACBLHGHSP-GFCCVEGCSA-N 1 2 301.459 4.390 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2ccc(Br)cc2)on1 ZINC000052453343 1042481133 /nfs/dbraw/zinc/48/11/33/1042481133.db2.gz MMCJGBJMPDUPFT-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2ccc(Br)cc2)on1 ZINC000052453343 1042481139 /nfs/dbraw/zinc/48/11/39/1042481139.db2.gz MMCJGBJMPDUPFT-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO CCOc1ccc(NCc2c[nH+]c(C)n2-c2ccccc2)c(C)c1 ZINC000237060332 1042487494 /nfs/dbraw/zinc/48/74/94/1042487494.db2.gz BKWOUKKBKXGWLK-UHFFFAOYSA-N 1 2 321.424 4.500 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+][C@H](C)c1cn(C(C)C)nn1 ZINC000924894869 1042508592 /nfs/dbraw/zinc/50/85/92/1042508592.db2.gz BIAWECYQIZQYOW-GDBMZVCRSA-N 1 2 316.449 4.060 20 0 DIADLO Cn1ccnc1[C@@H]([NH2+]Cc1cccs1)c1ccc(Cl)cc1 ZINC000052774881 1042516669 /nfs/dbraw/zinc/51/66/69/1042516669.db2.gz CVYYHNSQJVXOLK-HNNXBMFYSA-N 1 2 317.845 4.014 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@@H]2CCc3c2c(F)ccc3F)o1 ZINC000513344274 1042535482 /nfs/dbraw/zinc/53/54/82/1042535482.db2.gz YZKSIDRJBOFVEX-HZPDHXFCSA-N 1 2 321.367 4.085 20 0 DIADLO Oc1cccc(C[NH+]2CCC(CC(F)(F)F)CC2)c1Cl ZINC000513633366 1042555050 /nfs/dbraw/zinc/55/50/50/1042555050.db2.gz LUOLGLHFCOSIAS-UHFFFAOYSA-N 1 2 307.743 4.210 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1ncccc1C(F)(F)F ZINC000513668128 1042557758 /nfs/dbraw/zinc/55/77/58/1042557758.db2.gz WARVXTTWKHHYOG-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1ncccc1C(F)(F)F ZINC000513668128 1042557760 /nfs/dbraw/zinc/55/77/60/1042557760.db2.gz WARVXTTWKHHYOG-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2ccnn2C(C)C)c2ccccn2)c1 ZINC000280377714 1042571976 /nfs/dbraw/zinc/57/19/76/1042571976.db2.gz TZSVPGHDISRFMO-HXUWFJFHSA-N 1 2 320.440 4.047 20 0 DIADLO c1sc(-c2ccccn2)nc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000348528062 1042572433 /nfs/dbraw/zinc/57/24/33/1042572433.db2.gz WTBNFCSPDCBQRS-KRWDZBQOSA-N 1 2 307.422 4.152 20 0 DIADLO c1sc(-c2ccccn2)nc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000348528062 1042572436 /nfs/dbraw/zinc/57/24/36/1042572436.db2.gz WTBNFCSPDCBQRS-KRWDZBQOSA-N 1 2 307.422 4.152 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)cs1 ZINC000420951144 1042616596 /nfs/dbraw/zinc/61/65/96/1042616596.db2.gz QOHYWJSOLGVVTD-QWRGUYRKSA-N 1 2 322.396 4.015 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cs1 ZINC000420951144 1042616597 /nfs/dbraw/zinc/61/65/97/1042616597.db2.gz QOHYWJSOLGVVTD-QWRGUYRKSA-N 1 2 322.396 4.015 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)cs1 ZINC000420951137 1042616722 /nfs/dbraw/zinc/61/67/22/1042616722.db2.gz QOHYWJSOLGVVTD-GHMZBOCLSA-N 1 2 322.396 4.015 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)cs1 ZINC000420951137 1042616724 /nfs/dbraw/zinc/61/67/24/1042616724.db2.gz QOHYWJSOLGVVTD-GHMZBOCLSA-N 1 2 322.396 4.015 20 0 DIADLO FC(F)C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1 ZINC000420990461 1042619036 /nfs/dbraw/zinc/61/90/36/1042619036.db2.gz FTLZWPPAZAKIOP-SNVBAGLBSA-N 1 2 302.777 4.283 20 0 DIADLO Cc1cc(CNC(=O)Nc2cccc(C(F)(F)F)c2)cc(C)[nH+]1 ZINC000421035419 1042621701 /nfs/dbraw/zinc/62/17/01/1042621701.db2.gz LTJAGMWUYSUPBO-UHFFFAOYSA-N 1 2 323.318 4.039 20 0 DIADLO CCc1ccc(CC)c(NC(=O)NCc2cc(C)[nH+]c(C)c2)c1 ZINC000421066724 1042624387 /nfs/dbraw/zinc/62/43/87/1042624387.db2.gz LPGVQHPOMQJHIX-UHFFFAOYSA-N 1 2 311.429 4.145 20 0 DIADLO Cc1ccsc1C[N@@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000513745610 1042628282 /nfs/dbraw/zinc/62/82/82/1042628282.db2.gz CGHJNAZJECOFJN-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccsc1C[N@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000513745610 1042628284 /nfs/dbraw/zinc/62/82/84/1042628284.db2.gz CGHJNAZJECOFJN-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cccc(C2CC2)c1)c1nc(C2CC2)no1 ZINC000421341116 1042630938 /nfs/dbraw/zinc/63/09/38/1042630938.db2.gz KYAKGASHNBECJJ-KRWDZBQOSA-N 1 2 311.429 4.311 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)s1 ZINC000421360713 1042632112 /nfs/dbraw/zinc/63/21/12/1042632112.db2.gz JKWDXTINVJLKEA-JTQLQIEISA-N 1 2 324.437 4.171 20 0 DIADLO CSCc1cnc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)s1 ZINC000421360713 1042632116 /nfs/dbraw/zinc/63/21/16/1042632116.db2.gz JKWDXTINVJLKEA-JTQLQIEISA-N 1 2 324.437 4.171 20 0 DIADLO CC[C@H]1C[C@@]1([NH2+]Cc1nn(C)c(C)c1Cl)c1cccc(C)c1 ZINC000421359465 1042632197 /nfs/dbraw/zinc/63/21/97/1042632197.db2.gz WVBXHOZQRSNQCV-KSSFIOAISA-N 1 2 317.864 4.105 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H](C)c2ccc(C3CC3)cc2)nn1C ZINC000421378979 1042634460 /nfs/dbraw/zinc/63/44/60/1042634460.db2.gz HXPINVZANCQPBG-NSHDSACASA-N 1 2 303.837 4.110 20 0 DIADLO CC[C@@H]1C[C@H](C)C[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000072698380 1042641946 /nfs/dbraw/zinc/64/19/46/1042641946.db2.gz YJLFWDZFTREGAK-WDEREUQCSA-N 1 2 315.244 4.052 20 0 DIADLO CC[C@@H]1C[C@H](C)C[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000072698380 1042641950 /nfs/dbraw/zinc/64/19/50/1042641950.db2.gz YJLFWDZFTREGAK-WDEREUQCSA-N 1 2 315.244 4.052 20 0 DIADLO Cc1cc(CNC(=O)c2ccccc2SC(C)C)cc(C)[nH+]1 ZINC000421558720 1042644475 /nfs/dbraw/zinc/64/44/75/1042644475.db2.gz NFONEDIEOJBAMC-UHFFFAOYSA-N 1 2 314.454 4.129 20 0 DIADLO COc1cccc(F)c1[C@@H](C)[NH2+][C@H](C)c1ccncc1Cl ZINC000421828138 1042654477 /nfs/dbraw/zinc/65/44/77/1042654477.db2.gz BHBXLLXSZQXWJI-GHMZBOCLSA-N 1 2 308.784 4.295 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1ccncc1Cl ZINC000421828139 1042654495 /nfs/dbraw/zinc/65/44/95/1042654495.db2.gz BHBXLLXSZQXWJI-MNOVXSKESA-N 1 2 308.784 4.295 20 0 DIADLO Cc1csc(C2([NH2+][C@@H](C)c3ccncc3Cl)CCC2)n1 ZINC000421837519 1042655880 /nfs/dbraw/zinc/65/58/80/1042655880.db2.gz RGACEWPCMCFLMQ-NSHDSACASA-N 1 2 307.850 4.230 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)cc(C)n1 ZINC000421853148 1042656760 /nfs/dbraw/zinc/65/67/60/1042656760.db2.gz IPHZOXBRJSMUSZ-JTQLQIEISA-N 1 2 315.364 4.025 20 0 DIADLO COc1cc(Cl)ccc1[C@@H](C)[NH2+]Cc1cnc(C2CC2)o1 ZINC000421850550 1042656778 /nfs/dbraw/zinc/65/67/78/1042656778.db2.gz DIHWIORQWBZGOV-SNVBAGLBSA-N 1 2 306.793 4.065 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@@H](CC)c2ccccc2)n1 ZINC000271715759 1042666390 /nfs/dbraw/zinc/66/63/90/1042666390.db2.gz VUZAFBIWAYALOJ-JSGCOSHPSA-N 1 2 305.447 4.125 20 0 DIADLO C[C@@H]([NH2+]C1(c2ccccc2)CC1)c1ncc(Br)s1 ZINC000272029635 1042675378 /nfs/dbraw/zinc/67/53/78/1042675378.db2.gz TZNLEMZIHOFTOE-SNVBAGLBSA-N 1 2 323.259 4.246 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H]2CCCOc3cc(F)ccc32)cs1 ZINC000272104379 1042677319 /nfs/dbraw/zinc/67/73/19/1042677319.db2.gz ZMHIULDGGIGFNX-QMTHXVAHSA-N 1 2 306.406 4.155 20 0 DIADLO CCC[C@@H]([NH2+][C@H]1COCc2cccc(Cl)c21)c1ccccn1 ZINC000924946116 1042677700 /nfs/dbraw/zinc/67/77/00/1042677700.db2.gz LKPVLZYIBUTFIN-SJORKVTESA-N 1 2 316.832 4.437 20 0 DIADLO C(=C\c1ccc(-n2cc[nH+]c2)cc1)\c1nc(-c2cccs2)no1 ZINC000504368679 1042720902 /nfs/dbraw/zinc/72/09/02/1042720902.db2.gz UPGJCGILEVEJQP-YVMONPNESA-N 1 2 320.377 4.154 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@H]2CCOc3ccc(F)cc32)c(F)c1 ZINC000424181197 1042727361 /nfs/dbraw/zinc/72/73/61/1042727361.db2.gz XETSBSNRMXHCPV-INIZCTEOSA-N 1 2 307.315 4.026 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccnn1C1CCC1 ZINC000924969750 1042739228 /nfs/dbraw/zinc/73/92/28/1042739228.db2.gz KWYGPSMWLVPOBQ-LBPRGKRZSA-N 1 2 318.490 4.213 20 0 DIADLO CC(C)c1ccccc1-n1ccnc1SCc1cc[nH+]c(N)c1 ZINC000430135866 1042788151 /nfs/dbraw/zinc/78/81/51/1042788151.db2.gz RQNGCBZCUAFTPX-UHFFFAOYSA-N 1 2 324.453 4.265 20 0 DIADLO FC(F)CC1C[NH+](Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000425368651 1042799324 /nfs/dbraw/zinc/79/93/24/1042799324.db2.gz XJPNMCVQQZFSHD-UHFFFAOYSA-N 1 2 313.697 4.446 20 0 DIADLO Cc1cccc([C@H]2CCCCC[N@@H+]2Cc2nc(C(F)F)no2)c1 ZINC000425407547 1042813966 /nfs/dbraw/zinc/81/39/66/1042813966.db2.gz RGICNLWAWNSQQQ-CQSZACIVSA-N 1 2 321.371 4.433 20 0 DIADLO Cc1cccc([C@H]2CCCCC[N@H+]2Cc2nc(C(F)F)no2)c1 ZINC000425407547 1042813973 /nfs/dbraw/zinc/81/39/73/1042813973.db2.gz RGICNLWAWNSQQQ-CQSZACIVSA-N 1 2 321.371 4.433 20 0 DIADLO CC[N@H+](Cc1nc(C(F)F)no1)[C@H](C)c1cc2ccccc2o1 ZINC000425411537 1042816121 /nfs/dbraw/zinc/81/61/21/1042816121.db2.gz YIUYUZSOOOSXAX-SNVBAGLBSA-N 1 2 321.327 4.337 20 0 DIADLO CC[N@@H+](Cc1nc(C(F)F)no1)[C@H](C)c1cc2ccccc2o1 ZINC000425411537 1042816124 /nfs/dbraw/zinc/81/61/24/1042816124.db2.gz YIUYUZSOOOSXAX-SNVBAGLBSA-N 1 2 321.327 4.337 20 0 DIADLO Cc1cc(C)c(C(=O)N2C[C@H](c3ccccc3C)C[C@H]2C)c(C)[nH+]1 ZINC001126443536 1042828447 /nfs/dbraw/zinc/82/84/47/1042828447.db2.gz IKIMNLOETRTUCJ-SJLPKXTDSA-N 1 2 322.452 4.333 20 0 DIADLO C[C@@H](COCC(F)(F)F)Nc1cc[nH+]c2c(Cl)cccc12 ZINC000516874151 1042857944 /nfs/dbraw/zinc/85/79/44/1042857944.db2.gz NIATZFKCDCZQFR-VIFPVBQESA-N 1 2 318.726 4.268 20 0 DIADLO Cc1ccc(Br)c(Nc2cccc3cc[nH+]cc32)n1 ZINC000712510109 1042862558 /nfs/dbraw/zinc/86/25/58/1042862558.db2.gz VINREEZKUGRLNG-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@H](c2cnn(C)c2)c2ccccc2)o1 ZINC000366673050 1042863174 /nfs/dbraw/zinc/86/31/74/1042863174.db2.gz CXBYLLQBRHYHDK-KUHUBIRLSA-N 1 2 309.413 4.016 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2ccc(C)nc2Cl)C2CC2)n1 ZINC000838924035 1042864776 /nfs/dbraw/zinc/86/47/76/1042864776.db2.gz XNMQGUJSLJNTSW-ZDUSSCGKSA-N 1 2 307.850 4.049 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2ccc(C)nc2Cl)C2CC2)n1 ZINC000838924034 1042864950 /nfs/dbraw/zinc/86/49/50/1042864950.db2.gz XNMQGUJSLJNTSW-CYBMUJFWSA-N 1 2 307.850 4.049 20 0 DIADLO CC(C)c1cccc(C[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000517066774 1042866704 /nfs/dbraw/zinc/86/67/04/1042866704.db2.gz VUILFYNULYICAA-SFHVURJKSA-N 1 2 312.461 4.339 20 0 DIADLO Cc1nnc(C[N@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)o1 ZINC000291271286 1042875636 /nfs/dbraw/zinc/87/56/36/1042875636.db2.gz XYZLDMZRLVTVTM-HNNXBMFYSA-N 1 2 307.397 4.141 20 0 DIADLO Cc1nnc(C[N@@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)o1 ZINC000291271286 1042875641 /nfs/dbraw/zinc/87/56/41/1042875641.db2.gz XYZLDMZRLVTVTM-HNNXBMFYSA-N 1 2 307.397 4.141 20 0 DIADLO C[N@H+](Cc1cnc(-c2ccco2)s1)Cc1cc(F)cc(F)c1 ZINC000425992361 1042894915 /nfs/dbraw/zinc/89/49/15/1042894915.db2.gz CSMCGKBUKSSRPQ-UHFFFAOYSA-N 1 2 320.364 4.313 20 0 DIADLO C[N@@H+](Cc1cnc(-c2ccco2)s1)Cc1cc(F)cc(F)c1 ZINC000425992361 1042894919 /nfs/dbraw/zinc/89/49/19/1042894919.db2.gz CSMCGKBUKSSRPQ-UHFFFAOYSA-N 1 2 320.364 4.313 20 0 DIADLO CCCc1noc(C[N@@H+]2CCCCC[C@@H]2c2ccc(C)o2)n1 ZINC000151198143 1042899161 /nfs/dbraw/zinc/89/91/61/1042899161.db2.gz VISBPXUVLWBTBS-CQSZACIVSA-N 1 2 303.406 4.041 20 0 DIADLO CCCc1noc(C[N@H+]2CCCCC[C@@H]2c2ccc(C)o2)n1 ZINC000151198143 1042899171 /nfs/dbraw/zinc/89/91/71/1042899171.db2.gz VISBPXUVLWBTBS-CQSZACIVSA-N 1 2 303.406 4.041 20 0 DIADLO C[C@@H]([NH2+]Cc1ccon1)c1cc2cc(Br)ccc2o1 ZINC000148759173 1042914850 /nfs/dbraw/zinc/91/48/50/1042914850.db2.gz OTBTUIKTQHVAES-SECBINFHSA-N 1 2 321.174 4.034 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](c2cccc(Cl)c2)[NH+](C)C)c(F)c1 ZINC000518891131 1042923859 /nfs/dbraw/zinc/92/38/59/1042923859.db2.gz LHYOAENSHGFAKN-MRXNPFEDSA-N 1 2 320.795 4.029 20 0 DIADLO Fc1cc(C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)ccc1C(F)F ZINC000894395679 1042941123 /nfs/dbraw/zinc/94/11/23/1042941123.db2.gz AMSZAXNBNHIRFC-HNNXBMFYSA-N 1 2 309.335 4.214 20 0 DIADLO Fc1cc(C[N@H+]2CCCC[C@H]2c2cc[nH]n2)ccc1C(F)F ZINC000894395679 1042941125 /nfs/dbraw/zinc/94/11/25/1042941125.db2.gz AMSZAXNBNHIRFC-HNNXBMFYSA-N 1 2 309.335 4.214 20 0 DIADLO COc1ccnc([C@@H](C)[NH2+][C@H](C)c2nc3ccccc3s2)c1 ZINC000925068599 1042945638 /nfs/dbraw/zinc/94/56/38/1042945638.db2.gz DWOWGWDUZRWBSO-VXGBXAGGSA-N 1 2 313.426 4.112 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2ccc3sccc3c2)s1 ZINC000894532671 1042966394 /nfs/dbraw/zinc/96/63/94/1042966394.db2.gz VFLRCDMDWDROOT-UHFFFAOYSA-N 1 2 303.456 4.166 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(C(F)(F)F)cn2)[C@H]1c1ccncc1 ZINC000664829389 1042967322 /nfs/dbraw/zinc/96/73/22/1042967322.db2.gz MSCFHTDMRUSGIV-HNNXBMFYSA-N 1 2 321.346 4.079 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(C(F)(F)F)cn2)[C@H]1c1ccncc1 ZINC000664829389 1042967328 /nfs/dbraw/zinc/96/73/28/1042967328.db2.gz MSCFHTDMRUSGIV-HNNXBMFYSA-N 1 2 321.346 4.079 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H]2CCCc3c(F)cc(F)cc32)s1 ZINC000894656414 1042971659 /nfs/dbraw/zinc/97/16/59/1042971659.db2.gz AQOIDGVFOLVYBG-AWEZNQCLSA-N 1 2 323.412 4.107 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nc(C(C)(C)C)co1 ZINC000894705679 1042974525 /nfs/dbraw/zinc/97/45/25/1042974525.db2.gz BAVAKUMXAYRQPS-QWRGUYRKSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1nc(C(C)(C)C)co1 ZINC000894705679 1042974528 /nfs/dbraw/zinc/97/45/28/1042974528.db2.gz BAVAKUMXAYRQPS-QWRGUYRKSA-N 1 2 304.356 4.135 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc([NH+](C)C)cc2C)cc1OC ZINC000319997164 1042980052 /nfs/dbraw/zinc/98/00/52/1042980052.db2.gz GWHVTFQIEQLJNO-CQSZACIVSA-N 1 2 314.429 4.251 20 0 DIADLO C[C@H](c1ccccc1Br)[N@H+]1C[C@H](C)OC(C)(C)C1 ZINC000519957986 1043011338 /nfs/dbraw/zinc/01/13/38/1043011338.db2.gz OQXVDGLFKKRHBK-NWDGAFQWSA-N 1 2 312.251 4.009 20 0 DIADLO C[C@H](c1ccccc1Br)[N@@H+]1C[C@H](C)OC(C)(C)C1 ZINC000519957986 1043011334 /nfs/dbraw/zinc/01/13/34/1043011334.db2.gz OQXVDGLFKKRHBK-NWDGAFQWSA-N 1 2 312.251 4.009 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cn2c(n1)CCCC2)c1ccc(F)cc1Cl ZINC000925095253 1043014567 /nfs/dbraw/zinc/01/45/67/1043014567.db2.gz SRFWQZVEMGMSQS-NEPJUHHUSA-N 1 2 321.827 4.424 20 0 DIADLO CCCCc1nc(C[N@@H+](Cc2ccccc2)CC(C)C)no1 ZINC000520172547 1043020682 /nfs/dbraw/zinc/02/06/82/1043020682.db2.gz NMIWGUMOQMSJKI-UHFFFAOYSA-N 1 2 301.434 4.070 20 0 DIADLO CCCCc1nc(C[N@H+](Cc2ccccc2)CC(C)C)no1 ZINC000520172547 1043020688 /nfs/dbraw/zinc/02/06/88/1043020688.db2.gz NMIWGUMOQMSJKI-UHFFFAOYSA-N 1 2 301.434 4.070 20 0 DIADLO CCCc1nc(C[N@@H+](CCC)[C@H](CC)c2ccccc2)no1 ZINC000520171512 1043020952 /nfs/dbraw/zinc/02/09/52/1043020952.db2.gz OWPYHFOSXXPIQY-MRXNPFEDSA-N 1 2 301.434 4.385 20 0 DIADLO CCCc1nc(C[N@H+](CCC)[C@H](CC)c2ccccc2)no1 ZINC000520171512 1043020955 /nfs/dbraw/zinc/02/09/55/1043020955.db2.gz OWPYHFOSXXPIQY-MRXNPFEDSA-N 1 2 301.434 4.385 20 0 DIADLO Cc1csc(C[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)n1 ZINC000118403714 1043037082 /nfs/dbraw/zinc/03/70/82/1043037082.db2.gz GHMNHGQDSBTWFE-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1csc(C[N@H+](C)Cc2ccc(Cl)c(Cl)c2)n1 ZINC000118403714 1043037085 /nfs/dbraw/zinc/03/70/85/1043037085.db2.gz GHMNHGQDSBTWFE-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3Cl)C2)cc1 ZINC000112542606 1043048467 /nfs/dbraw/zinc/04/84/67/1043048467.db2.gz OPFVEMWBWOSWBU-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3Cl)C2)cc1 ZINC000112542606 1043048477 /nfs/dbraw/zinc/04/84/77/1043048477.db2.gz OPFVEMWBWOSWBU-GOSISDBHSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3Cl)C2)cc1 ZINC000112542604 1043049068 /nfs/dbraw/zinc/04/90/68/1043049068.db2.gz OPFVEMWBWOSWBU-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@H](c3ccccc3Cl)C2)cc1 ZINC000112542604 1043049077 /nfs/dbraw/zinc/04/90/77/1043049077.db2.gz OPFVEMWBWOSWBU-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1coc(C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)c1 ZINC000890357673 1043049468 /nfs/dbraw/zinc/04/94/68/1043049468.db2.gz WBIMSKBIHIWNTH-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000173806668 1043054200 /nfs/dbraw/zinc/05/42/00/1043054200.db2.gz INHLRZJCIWJFRU-CVEARBPZSA-N 1 2 321.424 4.381 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nc(Cc2ccccc2)no1)c1ccccc1 ZINC000174014085 1043058734 /nfs/dbraw/zinc/05/87/34/1043058734.db2.gz LBMDEVPEWXOCRI-MAUKXSAKSA-N 1 2 321.424 4.462 20 0 DIADLO CCc1ccccc1C[NH2+][C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000174122577 1043059907 /nfs/dbraw/zinc/05/99/07/1043059907.db2.gz JSTGJIGWUHGBOF-HNNXBMFYSA-N 1 2 321.424 4.074 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nc(Cc2ccccc2)no1)c1ccccc1 ZINC000174014072 1043059942 /nfs/dbraw/zinc/05/99/42/1043059942.db2.gz LBMDEVPEWXOCRI-YJBOKZPZSA-N 1 2 321.424 4.462 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc3[nH]c(=O)oc3c2)nc(C2CCC2)[nH+]1 ZINC000894981852 1043060403 /nfs/dbraw/zinc/06/04/03/1043060403.db2.gz UWADIBUJCYZJGP-NSHDSACASA-N 1 2 324.384 4.072 20 0 DIADLO Cc1noc([C@H]2CCCC[N@@H+]2C/C=C\c2ccc(Cl)cc2)n1 ZINC000579268569 1043061293 /nfs/dbraw/zinc/06/12/93/1043061293.db2.gz HWVPFJGOGONYHD-YIEVGGLXSA-N 1 2 317.820 4.272 20 0 DIADLO Cc1noc([C@H]2CCCC[N@H+]2C/C=C\c2ccc(Cl)cc2)n1 ZINC000579268569 1043061306 /nfs/dbraw/zinc/06/13/06/1043061306.db2.gz HWVPFJGOGONYHD-YIEVGGLXSA-N 1 2 317.820 4.272 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc(F)c(C(=O)N(C)C)c3)ccc12 ZINC001211859407 1043068141 /nfs/dbraw/zinc/06/81/41/1043068141.db2.gz AEPHLPVEJSOOLY-UHFFFAOYSA-N 1 2 323.371 4.128 20 0 DIADLO CC[N@H+](Cc1csc([C@H](C)OC)n1)Cc1ccccc1C ZINC000175058177 1043074962 /nfs/dbraw/zinc/07/49/62/1043074962.db2.gz CLUQQMWROSQDOZ-AWEZNQCLSA-N 1 2 304.459 4.181 20 0 DIADLO CC[N@@H+](Cc1csc([C@H](C)OC)n1)Cc1ccccc1C ZINC000175058177 1043074974 /nfs/dbraw/zinc/07/49/74/1043074974.db2.gz CLUQQMWROSQDOZ-AWEZNQCLSA-N 1 2 304.459 4.181 20 0 DIADLO FC(F)c1ccc(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000188472274 1043087594 /nfs/dbraw/zinc/08/75/94/1043087594.db2.gz IUGDEACIXRDOKD-INIZCTEOSA-N 1 2 313.351 4.227 20 0 DIADLO CCC[C@@H](O)CCCSCc1c[nH+]cn1Cc1ccccc1 ZINC000865379161 1043088341 /nfs/dbraw/zinc/08/83/41/1043088341.db2.gz LZJGIXPFWDACNU-GOSISDBHSA-N 1 2 318.486 4.106 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2c(Cl)cncc2Cl)o1 ZINC000865419844 1043095190 /nfs/dbraw/zinc/09/51/90/1043095190.db2.gz ZNQUVRHBMJQCBK-ONGXEEELSA-N 1 2 311.212 4.395 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2c(Cl)cncc2Cl)o1 ZINC000865419842 1043096562 /nfs/dbraw/zinc/09/65/62/1043096562.db2.gz ZNQUVRHBMJQCBK-KOLCDFICSA-N 1 2 311.212 4.395 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2ccc(OC(F)F)cc2F)cs1 ZINC000865456416 1043101035 /nfs/dbraw/zinc/10/10/35/1043101035.db2.gz KKIPPOQIOGOZLH-MRVPVSSYSA-N 1 2 316.348 4.043 20 0 DIADLO Cc1c(Cl)cccc1C[NH2+][C@H](c1nc(C2CC2)no1)C(C)C ZINC000865462565 1043101608 /nfs/dbraw/zinc/10/16/08/1043101608.db2.gz PGRUNJGXYOEZDJ-HNNXBMFYSA-N 1 2 319.836 4.396 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](Cc2ccc(F)c(F)c2)[C@H](C)CO1 ZINC000441437878 1043103163 /nfs/dbraw/zinc/10/31/63/1043103163.db2.gz IHQMYSLOLALBCJ-AUUYWEPGSA-N 1 2 317.379 4.235 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2ccc(F)c(F)c2)[C@H](C)CO1 ZINC000441437878 1043103168 /nfs/dbraw/zinc/10/31/68/1043103168.db2.gz IHQMYSLOLALBCJ-AUUYWEPGSA-N 1 2 317.379 4.235 20 0 DIADLO Cc1c(Cl)cccc1C[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000865481550 1043103486 /nfs/dbraw/zinc/10/34/86/1043103486.db2.gz HQORLQBFGACCCK-LLVKDONJSA-N 1 2 307.825 4.180 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2cnc(Cl)c(F)c2)on1 ZINC000865476850 1043103560 /nfs/dbraw/zinc/10/35/60/1043103560.db2.gz SDNKBSDKPNCRFR-UHFFFAOYSA-N 1 2 311.788 4.056 20 0 DIADLO COc1ccc(C[NH2+][C@H](C)c2nnc(C)s2)cc1C(C)(C)C ZINC000865527400 1043110008 /nfs/dbraw/zinc/11/00/08/1043110008.db2.gz DDDZNHREHQMGJN-LLVKDONJSA-N 1 2 319.474 4.003 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+]Cc1cn(C2CC2)cn1 ZINC000865545193 1043112357 /nfs/dbraw/zinc/11/23/57/1043112357.db2.gz TWEZSQSTXGQEQW-INIZCTEOSA-N 1 2 323.362 4.310 20 0 DIADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000865572261 1043115400 /nfs/dbraw/zinc/11/54/00/1043115400.db2.gz MEJBIHGTXPEURD-BDJLRTHQSA-N 1 2 302.443 4.052 20 0 DIADLO COC[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2n1)c1ccc(C)o1 ZINC000178229073 1043123591 /nfs/dbraw/zinc/12/35/91/1043123591.db2.gz GFDBRCIYTDTEQF-KBXCAEBGSA-N 1 2 310.397 4.175 20 0 DIADLO CCc1cccc(NC(=O)C[N@@H+]2CCCC[C@@H]2c2ccco2)c1 ZINC000520452167 1043125111 /nfs/dbraw/zinc/12/51/11/1043125111.db2.gz OCZUQMQDMSLTKR-QGZVFWFLSA-N 1 2 312.413 4.008 20 0 DIADLO CCc1cccc(NC(=O)C[N@H+]2CCCC[C@@H]2c2ccco2)c1 ZINC000520452167 1043125120 /nfs/dbraw/zinc/12/51/20/1043125120.db2.gz OCZUQMQDMSLTKR-QGZVFWFLSA-N 1 2 312.413 4.008 20 0 DIADLO CC[N@H+](Cc1nc(-c2ccccc2)no1)[C@@H](C)c1cccc(O)c1 ZINC000178375111 1043126994 /nfs/dbraw/zinc/12/69/94/1043126994.db2.gz INVCKUZPNYWEFY-AWEZNQCLSA-N 1 2 323.396 4.025 20 0 DIADLO CC[N@@H+](Cc1nc(-c2ccccc2)no1)[C@@H](C)c1cccc(O)c1 ZINC000178375111 1043127001 /nfs/dbraw/zinc/12/70/01/1043127001.db2.gz INVCKUZPNYWEFY-AWEZNQCLSA-N 1 2 323.396 4.025 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@@H](c1nc2ccccc2[nH]1)C1CCCCC1 ZINC000865842950 1043139438 /nfs/dbraw/zinc/13/94/38/1043139438.db2.gz YNODBUYHSDBGSZ-GOSISDBHSA-N 1 2 323.444 4.006 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@@H](c1nc2ccccc2[nH]1)C1CCCCC1 ZINC000865842950 1043139445 /nfs/dbraw/zinc/13/94/45/1043139445.db2.gz YNODBUYHSDBGSZ-GOSISDBHSA-N 1 2 323.444 4.006 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2ccc(Cl)cc2F)C2CC2)s1 ZINC000189186546 1043143354 /nfs/dbraw/zinc/14/33/54/1043143354.db2.gz DBRQHCYJGLNXDD-AWEZNQCLSA-N 1 2 310.825 4.485 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]C(C)(C)c2cccc(F)c2)cs1 ZINC000179571780 1043147196 /nfs/dbraw/zinc/14/71/96/1043147196.db2.gz IFTQTZJTODCKLO-NSHDSACASA-N 1 2 308.422 4.015 20 0 DIADLO CC(C)([NH2+]Cc1nnc(-c2ccco2)o1)c1cccc(Cl)c1 ZINC000179607404 1043149046 /nfs/dbraw/zinc/14/90/46/1043149046.db2.gz RFDRBOCPQPYJSJ-UHFFFAOYSA-N 1 2 317.776 4.008 20 0 DIADLO CC(C)n1cc(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)cn1 ZINC000179733814 1043151204 /nfs/dbraw/zinc/15/12/04/1043151204.db2.gz HRGMLXKKEXBMAX-ZDUSSCGKSA-N 1 2 314.458 4.267 20 0 DIADLO CC(C)n1cc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)cn1 ZINC000179733814 1043151209 /nfs/dbraw/zinc/15/12/09/1043151209.db2.gz HRGMLXKKEXBMAX-ZDUSSCGKSA-N 1 2 314.458 4.267 20 0 DIADLO Cc1ccccc1[C@@H]([NH2+]Cc1ncn(-c2ccccc2)n1)C(C)C ZINC000183223897 1043158697 /nfs/dbraw/zinc/15/86/97/1043158697.db2.gz IRVJEYUMJNVCHI-FQEVSTJZSA-N 1 2 320.440 4.063 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2cccc(F)c2F)o1 ZINC000183271558 1043159242 /nfs/dbraw/zinc/15/92/42/1043159242.db2.gz FUTDDSBBJZSITL-IAQYHMDHSA-N 1 2 309.356 4.159 20 0 DIADLO Cc1cccnc1[C@H]([NH2+][C@@H]1c2ccccc2OC[C@@H]1F)C(C)C ZINC000866267447 1043168998 /nfs/dbraw/zinc/16/89/98/1043168998.db2.gz IWJSQAZWQZYPOJ-KVSKMBFKSA-N 1 2 314.404 4.149 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2nc3ccccc3s2)s1 ZINC000183926786 1043174958 /nfs/dbraw/zinc/17/49/58/1043174958.db2.gz QZSOXSLYBMCCCE-UHFFFAOYSA-N 1 2 303.456 4.086 20 0 DIADLO FC(F)c1ccc(C[NH2+][C@H]2c3ccccc3OC[C@@H]2F)cc1 ZINC000866341849 1043184870 /nfs/dbraw/zinc/18/48/70/1043184870.db2.gz SEBLNRKXEWHEMF-HOCLYGCPSA-N 1 2 307.315 4.186 20 0 DIADLO CC[C@H]1[C@H](C)CC[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000185599769 1043204245 /nfs/dbraw/zinc/20/42/45/1043204245.db2.gz YVZCKXRJOYTZJY-MFKMUULPSA-N 1 2 315.244 4.052 20 0 DIADLO CC[C@H]1[C@H](C)CC[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000185599769 1043204252 /nfs/dbraw/zinc/20/42/52/1043204252.db2.gz YVZCKXRJOYTZJY-MFKMUULPSA-N 1 2 315.244 4.052 20 0 DIADLO CC(C)Oc1ccc(C[NH2+][C@H](C)c2csc(C(C)C)n2)cn1 ZINC000186250569 1043218447 /nfs/dbraw/zinc/21/84/47/1043218447.db2.gz XISBCWQAHMGEIT-CYBMUJFWSA-N 1 2 319.474 4.300 20 0 DIADLO Cc1ccc2cc([C@H](C)[NH2+]Cc3nn(C)cc3C(F)F)oc2c1 ZINC000866565613 1043224091 /nfs/dbraw/zinc/22/40/91/1043224091.db2.gz OCMATQZMNXREGZ-NSHDSACASA-N 1 2 319.355 4.263 20 0 DIADLO C[C@H]([NH2+][C@H](CCO)c1ccco1)c1cccc(Cl)c1Cl ZINC000186541834 1043226524 /nfs/dbraw/zinc/22/65/24/1043226524.db2.gz HNCOBQAGOPAXTR-GXFFZTMASA-N 1 2 314.212 4.361 20 0 DIADLO FC[C@H]([NH2+][C@@H]1CCc2nc(Cl)ccc21)c1ccc(F)cc1 ZINC000866597467 1043231272 /nfs/dbraw/zinc/23/12/72/1043231272.db2.gz TWRDVXMZGGKKMX-HIFRSBDPSA-N 1 2 308.759 4.162 20 0 DIADLO CCn1c2ccccc2[nH+]c1NCc1cc(-c2ccccc2)n[nH]1 ZINC000004741733 1043232545 /nfs/dbraw/zinc/23/25/45/1043232545.db2.gz VNMVSXLPNXAJRJ-UHFFFAOYSA-N 1 2 317.396 4.058 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1ccccc1F ZINC000186827319 1043234645 /nfs/dbraw/zinc/23/46/45/1043234645.db2.gz DCNRRRHCNYIHDD-KRWDZBQOSA-N 1 2 320.408 4.370 20 0 DIADLO C[C@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1cc(F)cc(F)c1 ZINC000186819918 1043234664 /nfs/dbraw/zinc/23/46/64/1043234664.db2.gz MLDVZECGBRHUEG-NSHDSACASA-N 1 2 324.371 4.119 20 0 DIADLO Cc1[nH]c(CNc2cc(C(C)C)nn2Cc2ccccc2)[nH+]c1C ZINC000520612065 1043237561 /nfs/dbraw/zinc/23/75/61/1043237561.db2.gz ZYBZMAGBIJXDQC-UHFFFAOYSA-N 1 2 323.444 4.007 20 0 DIADLO Cc1cc(F)cc(C[NH+](Cc2cccnc2)Cc2cccnc2)c1 ZINC001143587018 1043239243 /nfs/dbraw/zinc/23/92/43/1043239243.db2.gz ZCUPVXNMYRDSRA-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C3CC4(CCC4)C3)c2)[nH+]c1C ZINC000843775562 1043239928 /nfs/dbraw/zinc/23/99/28/1043239928.db2.gz RJTZYTVHARERGJ-UHFFFAOYSA-N 1 2 309.413 4.212 20 0 DIADLO CCc1ccc([C@H]([NH2+]Cc2nc(C(C)(C)C)no2)C(C)C)cc1 ZINC000074044271 1043254210 /nfs/dbraw/zinc/25/42/10/1043254210.db2.gz BGBBCXLZECTHCH-QGZVFWFLSA-N 1 2 315.461 4.416 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2cnc(-c3ccco3)s2)cs1 ZINC000193099528 1043280771 /nfs/dbraw/zinc/28/07/71/1043280771.db2.gz IONSMDPUZGZSRF-SNVBAGLBSA-N 1 2 319.455 4.273 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C[C@@H](C)n3cccc3)c2)[nH+]c1C ZINC000729525519 1043281873 /nfs/dbraw/zinc/28/18/73/1043281873.db2.gz FDRAGKOCGSGVGB-CYBMUJFWSA-N 1 2 322.412 4.085 20 0 DIADLO COC[C@@H]([NH2+]Cc1csc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000193279422 1043282867 /nfs/dbraw/zinc/28/28/67/1043282867.db2.gz KWPSRGJMIHWAJF-OAHLLOKOSA-N 1 2 322.861 4.151 20 0 DIADLO Cc1cccc(C)c1NC(=O)C[N@@H+](C)Cc1cc(Cl)cs1 ZINC000194307713 1043290223 /nfs/dbraw/zinc/29/02/23/1043290223.db2.gz OYAAXLHNCFEOJA-UHFFFAOYSA-N 1 2 322.861 4.089 20 0 DIADLO Cc1cccc(C)c1NC(=O)C[N@H+](C)Cc1cc(Cl)cs1 ZINC000194307713 1043290234 /nfs/dbraw/zinc/29/02/34/1043290234.db2.gz OYAAXLHNCFEOJA-UHFFFAOYSA-N 1 2 322.861 4.089 20 0 DIADLO COc1cc(F)c([C@@H](C)[NH2+][C@H](C)c2csc(C)n2)cc1OC ZINC000268840261 1043335221 /nfs/dbraw/zinc/33/52/21/1043335221.db2.gz AONJWTOFARHNMD-NXEZZACHSA-N 1 2 324.421 4.020 20 0 DIADLO Cc1cc(C[N@@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)nn1C ZINC000487413671 1043338904 /nfs/dbraw/zinc/33/89/04/1043338904.db2.gz LUGBHMSIXMXLQE-OAQYLSRUSA-N 1 2 317.436 4.028 20 0 DIADLO Cc1cc(C[N@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)nn1C ZINC000487413671 1043338916 /nfs/dbraw/zinc/33/89/16/1043338916.db2.gz LUGBHMSIXMXLQE-OAQYLSRUSA-N 1 2 317.436 4.028 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H]2CCOc3c(Cl)cccc32)cs1 ZINC000268870933 1043338956 /nfs/dbraw/zinc/33/89/56/1043338956.db2.gz GDBIUOXAIHGYNI-RNCFNFMXSA-N 1 2 308.834 4.279 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(-c3ccccc3)no2)cc1 ZINC000269043469 1043352643 /nfs/dbraw/zinc/35/26/43/1043352643.db2.gz DOEXFDRTHJHRRI-ZIAGYGMSSA-N 1 2 323.396 4.157 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H](c2nc3ccccc3[nH]2)C(C)C)cs1 ZINC000269399084 1043365188 /nfs/dbraw/zinc/36/51/88/1043365188.db2.gz FUIRITJTGFDMNP-BDJLRTHQSA-N 1 2 314.458 4.376 20 0 DIADLO C[N@H+](Cc1nc(C(F)(F)F)cs1)[C@@H]1C[C@H]1c1ccccc1 ZINC000269755772 1043372791 /nfs/dbraw/zinc/37/27/91/1043372791.db2.gz GSISLYPSLVMWIA-NWDGAFQWSA-N 1 2 312.360 4.150 20 0 DIADLO C[N@@H+](Cc1nc(C(F)(F)F)cs1)[C@@H]1C[C@H]1c1ccccc1 ZINC000269755772 1043372799 /nfs/dbraw/zinc/37/27/99/1043372799.db2.gz GSISLYPSLVMWIA-NWDGAFQWSA-N 1 2 312.360 4.150 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H]2CCc3c2c(F)ccc3F)cs1 ZINC000269812268 1043373321 /nfs/dbraw/zinc/37/33/21/1043373321.db2.gz HFCLAGRSWKRBIB-TVQRCGJNSA-N 1 2 308.397 4.322 20 0 DIADLO CCCCc1nc(C[N@@H+](Cc2cccc(C)c2)CC(C)C)no1 ZINC000521195570 1043374603 /nfs/dbraw/zinc/37/46/03/1043374603.db2.gz IEJMNPHMYDYQMQ-UHFFFAOYSA-N 1 2 315.461 4.379 20 0 DIADLO CCCCc1nc(C[N@H+](Cc2cccc(C)c2)CC(C)C)no1 ZINC000521195570 1043374609 /nfs/dbraw/zinc/37/46/09/1043374609.db2.gz IEJMNPHMYDYQMQ-UHFFFAOYSA-N 1 2 315.461 4.379 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)c(C)[nH+]1 ZINC000521344173 1043388949 /nfs/dbraw/zinc/38/89/49/1043388949.db2.gz LCUDWNYGXINAPO-CHWSQXEVSA-N 1 2 314.351 4.314 20 0 DIADLO CC[N@H+](Cc1nc(-c2cccs2)oc1C)Cc1ccncc1 ZINC000271020691 1043399546 /nfs/dbraw/zinc/39/95/46/1043399546.db2.gz NSUMSUQKVQDWHI-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO CC[N@@H+](Cc1nc(-c2cccs2)oc1C)Cc1ccncc1 ZINC000271020691 1043399552 /nfs/dbraw/zinc/39/95/52/1043399552.db2.gz NSUMSUQKVQDWHI-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1cnc([C@H]2CCCO2)s1 ZINC000271023532 1043399733 /nfs/dbraw/zinc/39/97/33/1043399733.db2.gz DIOAPFILGIOMHN-BXUZGUMPSA-N 1 2 320.483 4.175 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1cnc([C@H]2CCCO2)s1 ZINC000271023532 1043399741 /nfs/dbraw/zinc/39/97/41/1043399741.db2.gz DIOAPFILGIOMHN-BXUZGUMPSA-N 1 2 320.483 4.175 20 0 DIADLO Cc1ccc(C[C@@H]([NH2+][C@H](C)c2cscn2)c2ccccn2)cc1 ZINC000271067915 1043402177 /nfs/dbraw/zinc/40/21/77/1043402177.db2.gz DKENBZFSVZAWPW-CRAIPNDOSA-N 1 2 323.465 4.481 20 0 DIADLO Cc1cncc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)c1 ZINC000442679903 1043404448 /nfs/dbraw/zinc/40/44/48/1043404448.db2.gz MMHHCSKTKOJCKO-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1cncc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)c1 ZINC000442679903 1043404459 /nfs/dbraw/zinc/40/44/59/1043404459.db2.gz MMHHCSKTKOJCKO-SFHVURJKSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@H]1CC2(CCC2)Oc2ccccc21 ZINC000925270114 1043405613 /nfs/dbraw/zinc/40/56/13/1043405613.db2.gz RRFBQEZDVCFLCF-CVEARBPZSA-N 1 2 324.424 4.397 20 0 DIADLO CCc1cccc2c1OCC[C@H]2[NH2+][C@H]1CCCc2oc(C)nc21 ZINC000925359699 1043411891 /nfs/dbraw/zinc/41/18/91/1043411891.db2.gz CVBFCNWJJKUOIF-CVEARBPZSA-N 1 2 312.413 4.036 20 0 DIADLO COc1ccc(Cl)cc1[C@@H](C)[NH2+][C@@H](C)c1nnc(C(C)C)[nH]1 ZINC000271431698 1043415852 /nfs/dbraw/zinc/41/58/52/1043415852.db2.gz DGRSQNJPAIDYLN-MNOVXSKESA-N 1 2 322.840 4.002 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+][C@@H](C)c1cccc(O)c1F ZINC000872027892 1043423831 /nfs/dbraw/zinc/42/38/31/1043423831.db2.gz GRYBSYDSRBUEHV-JTQLQIEISA-N 1 2 309.768 4.044 20 0 DIADLO C[C@@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1ccc(Cl)cc1 ZINC000271485396 1043424901 /nfs/dbraw/zinc/42/49/01/1043424901.db2.gz OERUKIQJFDTMFR-MEBBXXQBSA-N 1 2 311.759 4.002 20 0 DIADLO CSc1ccc([C@H](C)[NH2+][C@@H](C)c2nnc(C(C)C)[nH]2)cc1F ZINC000271473471 1043424976 /nfs/dbraw/zinc/42/49/76/1043424976.db2.gz ISEVVNVPLGMNNL-QWRGUYRKSA-N 1 2 322.453 4.201 20 0 DIADLO Clc1ccc2c(c1)[C@H]([NH2+][C@H]1CCc3c1nccc3Cl)CO2 ZINC000925532080 1043425947 /nfs/dbraw/zinc/42/59/47/1043425947.db2.gz QDRVDTFRBQULQE-UONOGXRCSA-N 1 2 321.207 4.099 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2nc3ccccc3[nH]2)c1C ZINC000558057348 1043429001 /nfs/dbraw/zinc/42/90/01/1043429001.db2.gz NPQYXFYFFRWAGA-UHFFFAOYSA-N 1 2 313.426 4.017 20 0 DIADLO Cc1csc(C2([NH2+][C@@H](C)c3cccc(O)c3F)CCC2)n1 ZINC000872054851 1043437825 /nfs/dbraw/zinc/43/78/25/1043437825.db2.gz CJMYOMUHLMISTM-NSHDSACASA-N 1 2 306.406 4.026 20 0 DIADLO CCOc1cc(Cl)ccc1C[NH2+][C@H]1CCCc2oc(C)nc21 ZINC000925605724 1043438701 /nfs/dbraw/zinc/43/87/01/1043438701.db2.gz HZWYFYXNADHLRD-AWEZNQCLSA-N 1 2 320.820 4.202 20 0 DIADLO CC[C@H]1CC[C@@H](C)[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000271588591 1043440610 /nfs/dbraw/zinc/44/06/10/1043440610.db2.gz SSIIROMBZGSARW-MNOVXSKESA-N 1 2 315.244 4.195 20 0 DIADLO CC[C@H]1CC[C@@H](C)[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000271588591 1043440621 /nfs/dbraw/zinc/44/06/21/1043440621.db2.gz SSIIROMBZGSARW-MNOVXSKESA-N 1 2 315.244 4.195 20 0 DIADLO CC[C@H]1CC[C@H](C)[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000271588596 1043441474 /nfs/dbraw/zinc/44/14/74/1043441474.db2.gz SSIIROMBZGSARW-QWRGUYRKSA-N 1 2 315.244 4.195 20 0 DIADLO CC[C@H]1CC[C@H](C)[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000271588596 1043441479 /nfs/dbraw/zinc/44/14/79/1043441479.db2.gz SSIIROMBZGSARW-QWRGUYRKSA-N 1 2 315.244 4.195 20 0 DIADLO CC[C@@H]1CC[C@@H](C)[N@@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000271588586 1043442430 /nfs/dbraw/zinc/44/24/30/1043442430.db2.gz SSIIROMBZGSARW-GHMZBOCLSA-N 1 2 315.244 4.195 20 0 DIADLO CC[C@@H]1CC[C@@H](C)[N@H+]1CC(=O)Nc1c(Cl)cccc1Cl ZINC000271588586 1043442433 /nfs/dbraw/zinc/44/24/33/1043442433.db2.gz SSIIROMBZGSARW-GHMZBOCLSA-N 1 2 315.244 4.195 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(OC)cc1 ZINC000271625613 1043444337 /nfs/dbraw/zinc/44/43/37/1043444337.db2.gz DVWWBPMGBPDCNB-OAHLLOKOSA-N 1 2 302.418 4.222 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2ncc(C3CC3)o2)c1 ZINC000271621922 1043444946 /nfs/dbraw/zinc/44/49/46/1043444946.db2.gz AATKXRHEXWZNSZ-CYBMUJFWSA-N 1 2 300.402 4.190 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1cccc(O)c1F)c1ccc(Cl)cc1 ZINC000872066105 1043445709 /nfs/dbraw/zinc/44/57/09/1043445709.db2.gz DYOXBELFESGAFN-NHYWBVRUSA-N 1 2 323.795 4.223 20 0 DIADLO Cc1nnc(C[NH2+][C@H](c2ccccc2F)C2CCCC2)s1 ZINC000271681869 1043447595 /nfs/dbraw/zinc/44/75/95/1043447595.db2.gz BTTLPHMSRRCWOP-INIZCTEOSA-N 1 2 305.422 4.007 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@H](C)c2ccc(F)cc2F)n1 ZINC000271689840 1043450098 /nfs/dbraw/zinc/45/00/98/1043450098.db2.gz QQTQCTJBOJQLHT-GFCCVEGCSA-N 1 2 307.388 4.373 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(C(F)(F)F)n[nH]2)s1 ZINC000442891389 1043450555 /nfs/dbraw/zinc/45/05/55/1043450555.db2.gz RIUOBWOJCNNSKU-NSHDSACASA-N 1 2 315.364 4.136 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc(C(F)(F)F)n[nH]2)s1 ZINC000442891389 1043450572 /nfs/dbraw/zinc/45/05/72/1043450572.db2.gz RIUOBWOJCNNSKU-NSHDSACASA-N 1 2 315.364 4.136 20 0 DIADLO C[C@@H]([NH2+][C@H]1CC(C)(C)Sc2ccccc21)c1csnn1 ZINC000872080863 1043451464 /nfs/dbraw/zinc/45/14/64/1043451464.db2.gz TZAHBNMDGUXBKV-PWSUYJOCSA-N 1 2 305.472 4.204 20 0 DIADLO C[C@H]([NH2+][C@H]1CC(C)(C)Sc2ccccc21)c1csnn1 ZINC000872080862 1043452072 /nfs/dbraw/zinc/45/20/72/1043452072.db2.gz TZAHBNMDGUXBKV-JQWIXIFHSA-N 1 2 305.472 4.204 20 0 DIADLO COc1cccc(Nc2ccn3cc[nH+]c3c2)c1C(F)(F)F ZINC001204982790 1043454445 /nfs/dbraw/zinc/45/44/45/1043454445.db2.gz IWVBEZFBTHVIGH-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cccc(OC(C)C)c2)s1 ZINC000283050453 1043456590 /nfs/dbraw/zinc/45/65/90/1043456590.db2.gz IYDJPOMOEPBWCC-VXGBXAGGSA-N 1 2 305.447 4.046 20 0 DIADLO C[C@H](Nc1ccc([NH+]2CCCC2)cc1)c1ccnn1C1CCC1 ZINC000925728794 1043457632 /nfs/dbraw/zinc/45/76/32/1043457632.db2.gz WDCJKCJTHNMEHZ-HNNXBMFYSA-N 1 2 310.445 4.381 20 0 DIADLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2ccc(-c3ccc(C)cc3)o2)n1 ZINC000348814848 1043469558 /nfs/dbraw/zinc/46/95/58/1043469558.db2.gz IKWSUTLCWKDVIP-KRWDZBQOSA-N 1 2 323.396 4.284 20 0 DIADLO Cc1noc([C@@H]2CCC[N@H+]2Cc2ccc(-c3ccc(C)cc3)o2)n1 ZINC000348814848 1043469566 /nfs/dbraw/zinc/46/95/66/1043469566.db2.gz IKWSUTLCWKDVIP-KRWDZBQOSA-N 1 2 323.396 4.284 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+][C@H](C)c1nccn1-c1ccccc1 ZINC000558260341 1043475827 /nfs/dbraw/zinc/47/58/27/1043475827.db2.gz XRSICHPUIQKVNC-HZPDHXFCSA-N 1 2 320.440 4.242 20 0 DIADLO Cc1nonc1C[NH2+][C@H](C)c1ccccc1SC(C)(C)C ZINC000872136579 1043478082 /nfs/dbraw/zinc/47/80/82/1043478082.db2.gz NHWKGCHJJGSSAH-LLVKDONJSA-N 1 2 305.447 4.119 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)s1 ZINC000348924214 1043479555 /nfs/dbraw/zinc/47/95/55/1043479555.db2.gz VSKGTLZVEAZXEW-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCC[C@@H]2c2ccncc2)s1 ZINC000348924214 1043479563 /nfs/dbraw/zinc/47/95/63/1043479563.db2.gz VSKGTLZVEAZXEW-CYBMUJFWSA-N 1 2 312.360 4.499 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@@H]2c2cccnc2)s1 ZINC000348921900 1043480167 /nfs/dbraw/zinc/48/01/67/1043480167.db2.gz PHYYVHLVFGDERL-CQSZACIVSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@@H]2c2cccnc2)s1 ZINC000348921900 1043480177 /nfs/dbraw/zinc/48/01/77/1043480177.db2.gz PHYYVHLVFGDERL-CQSZACIVSA-N 1 2 301.459 4.173 20 0 DIADLO CCCn1c2ccccc2nc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000348920154 1043480555 /nfs/dbraw/zinc/48/05/55/1043480555.db2.gz IOILGYWKRRPPGV-SFHVURJKSA-N 1 2 320.440 4.178 20 0 DIADLO CCCn1c2ccccc2nc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000348920154 1043480558 /nfs/dbraw/zinc/48/05/58/1043480558.db2.gz IOILGYWKRRPPGV-SFHVURJKSA-N 1 2 320.440 4.178 20 0 DIADLO CCC[C@H](C)c1noc([C@H]([NH3+])c2ccc(C(F)(F)F)cc2)n1 ZINC000872174909 1043484825 /nfs/dbraw/zinc/48/48/25/1043484825.db2.gz FYXAJTIBTHRXJN-JOYOIKCWSA-N 1 2 313.323 4.040 20 0 DIADLO c1ccc(-c2nnc(C[NH2+][C@H]3CCCCc4ccccc43)[nH]2)cc1 ZINC000777579135 1043487211 /nfs/dbraw/zinc/48/72/11/1043487211.db2.gz QNHAKJJZMJUVGM-SFHVURJKSA-N 1 2 318.424 4.029 20 0 DIADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1ncc(Cl)s1 ZINC000349570098 1043512677 /nfs/dbraw/zinc/51/26/77/1043512677.db2.gz QWDNVFGXRPFJAW-GFCCVEGCSA-N 1 2 310.850 4.436 20 0 DIADLO CC[N@H+](Cc1ccc(OC)c(OC)c1)Cc1c(F)cccc1F ZINC000349578055 1043513206 /nfs/dbraw/zinc/51/32/06/1043513206.db2.gz NNLHCPHZHKPZHH-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)c(OC)c1)Cc1c(F)cccc1F ZINC000349578055 1043513220 /nfs/dbraw/zinc/51/32/20/1043513220.db2.gz NNLHCPHZHKPZHH-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CCOc1cccc(C[N@H+](Cc2ccco2)Cc2ccccc2)n1 ZINC000349584481 1043514125 /nfs/dbraw/zinc/51/41/25/1043514125.db2.gz CIJIGLUUUFREJT-UHFFFAOYSA-N 1 2 322.408 4.276 20 0 DIADLO CCOc1cccc(C[N@@H+](Cc2ccco2)Cc2ccccc2)n1 ZINC000349584481 1043514135 /nfs/dbraw/zinc/51/41/35/1043514135.db2.gz CIJIGLUUUFREJT-UHFFFAOYSA-N 1 2 322.408 4.276 20 0 DIADLO c1nnc([C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C2CCCCC2)[nH]1 ZINC000521955781 1043515141 /nfs/dbraw/zinc/51/51/41/1043515141.db2.gz OCVUUQBZNRCLGN-SFHVURJKSA-N 1 2 310.445 4.093 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CC(C)(C)[C@@H]2[C@@H]2CCCO2)cs1 ZINC000558469960 1043515380 /nfs/dbraw/zinc/51/53/80/1043515380.db2.gz KNPKCXKYGZJUNW-RDJZCZTQSA-N 1 2 322.518 4.121 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CC(C)(C)[C@@H]2[C@@H]2CCCO2)cs1 ZINC000558469960 1043515389 /nfs/dbraw/zinc/51/53/89/1043515389.db2.gz KNPKCXKYGZJUNW-RDJZCZTQSA-N 1 2 322.518 4.121 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Br)c(F)c2)CCC1(F)F ZINC000558467452 1043515847 /nfs/dbraw/zinc/51/58/47/1043515847.db2.gz REMTVYXLUMWDHS-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Br)c(F)c2)CCC1(F)F ZINC000558467452 1043515857 /nfs/dbraw/zinc/51/58/57/1043515857.db2.gz REMTVYXLUMWDHS-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO C[C@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1ncco1 ZINC000926054944 1043516042 /nfs/dbraw/zinc/51/60/42/1043516042.db2.gz KITLXNVRKXVRMJ-ZDUSSCGKSA-N 1 2 308.385 4.048 20 0 DIADLO CC1(C)CCc2onc(C[NH2+]Cc3ccc(C(F)F)cc3)c2C1 ZINC000873174815 1043521953 /nfs/dbraw/zinc/52/19/53/1043521953.db2.gz PMHAWZWHHSOPHO-UHFFFAOYSA-N 1 2 320.383 4.417 20 0 DIADLO CC(F)(F)C[NH2+][C@@H]1CCCc2cc(Br)ccc21 ZINC000522019022 1043523763 /nfs/dbraw/zinc/52/37/63/1043523763.db2.gz OLWTVTJUQQVNMW-GFCCVEGCSA-N 1 2 304.178 4.071 20 0 DIADLO CC(C)n1ncc2cc(N[C@H](C)c3cn4c([nH+]3)CCCC4)ccc21 ZINC000926090169 1043523976 /nfs/dbraw/zinc/52/39/76/1043523976.db2.gz DPGOOQBDUYCVDA-CQSZACIVSA-N 1 2 323.444 4.323 20 0 DIADLO C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC000558505606 1043525614 /nfs/dbraw/zinc/52/56/14/1043525614.db2.gz LCJOMIHEYGGWJO-ZIAGYGMSSA-N 1 2 314.433 4.013 20 0 DIADLO CC(C)[N@H+](Cc1ccco1)Cc1cc(O)ccc1Br ZINC000349840162 1043528631 /nfs/dbraw/zinc/52/86/31/1043528631.db2.gz OWOUHEIVCLXMKN-UHFFFAOYSA-N 1 2 324.218 4.158 20 0 DIADLO CC(C)[N@@H+](Cc1ccco1)Cc1cc(O)ccc1Br ZINC000349840162 1043528639 /nfs/dbraw/zinc/52/86/39/1043528639.db2.gz OWOUHEIVCLXMKN-UHFFFAOYSA-N 1 2 324.218 4.158 20 0 DIADLO Cc1nc2sccn2c1C[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000349916404 1043532149 /nfs/dbraw/zinc/53/21/49/1043532149.db2.gz REZDEQXCMFRMSY-LBPRGKRZSA-N 1 2 303.406 4.036 20 0 DIADLO Cc1nc2sccn2c1C[N@H+](C)[C@@H](C)c1ccccc1F ZINC000349916404 1043532160 /nfs/dbraw/zinc/53/21/60/1043532160.db2.gz REZDEQXCMFRMSY-LBPRGKRZSA-N 1 2 303.406 4.036 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@H](c1ccc(Cl)cc1F)C(C)C ZINC000926126975 1043532895 /nfs/dbraw/zinc/53/28/95/1043532895.db2.gz GCMYSUSLPDBDPA-OTYXRUKQSA-N 1 2 311.788 4.218 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@@H](c1ccc(Cl)cc1F)C(C)C ZINC000926126974 1043533099 /nfs/dbraw/zinc/53/30/99/1043533099.db2.gz GCMYSUSLPDBDPA-LKFCYVNXSA-N 1 2 311.788 4.218 20 0 DIADLO Cc1ccc(O)c(C[N@H+](C)Cc2cccc(Cl)c2Cl)n1 ZINC000350050036 1043536082 /nfs/dbraw/zinc/53/60/82/1043536082.db2.gz CBYXEDVIRMJUQG-UHFFFAOYSA-N 1 2 311.212 4.034 20 0 DIADLO Cc1ccc(O)c(C[N@@H+](C)Cc2cccc(Cl)c2Cl)n1 ZINC000350050036 1043536090 /nfs/dbraw/zinc/53/60/90/1043536090.db2.gz CBYXEDVIRMJUQG-UHFFFAOYSA-N 1 2 311.212 4.034 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc(Sc3ccccn3)o2)o1 ZINC000350238379 1043542210 /nfs/dbraw/zinc/54/22/10/1043542210.db2.gz BYHLSLHPTKSGIW-UHFFFAOYSA-N 1 2 314.410 4.359 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc(Sc3ccccn3)o2)o1 ZINC000350238379 1043542221 /nfs/dbraw/zinc/54/22/21/1043542221.db2.gz BYHLSLHPTKSGIW-UHFFFAOYSA-N 1 2 314.410 4.359 20 0 DIADLO CCCCOc1ccc(C[NH2+][C@H](C)c2ncco2)cc1Cl ZINC000926251097 1043553139 /nfs/dbraw/zinc/55/31/39/1043553139.db2.gz OYELKEIFSMSOLV-GFCCVEGCSA-N 1 2 308.809 4.358 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2c2nc3ccc(F)cc3s2)[nH+]c1C ZINC000895198141 1043559702 /nfs/dbraw/zinc/55/97/02/1043559702.db2.gz YRJYJNNNYILXBT-CYBMUJFWSA-N 1 2 316.405 4.117 20 0 DIADLO Cc1c(N[C@@H](C)c2cn3c([nH+]2)CCCC3)cnn1C1CCCC1 ZINC000926292501 1043560643 /nfs/dbraw/zinc/56/06/43/1043560643.db2.gz KMYLJPBRHKGNRC-ZDUSSCGKSA-N 1 2 313.449 4.013 20 0 DIADLO COc1ccc2cc([C@H](C)[NH2+][C@@H](C)c3csnn3)ccc2c1 ZINC000398429342 1043560684 /nfs/dbraw/zinc/56/06/84/1043560684.db2.gz UEYQSTILHKKPDF-RYUDHWBXSA-N 1 2 313.426 4.112 20 0 DIADLO Cc1ccc2c(ccc(C)c2C(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC001274969716 1043564075 /nfs/dbraw/zinc/56/40/75/1043564075.db2.gz NDAJMOYXAIHASW-UHFFFAOYSA-N 1 2 315.376 4.357 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2csc(C(F)(F)F)c2)no1 ZINC000926364744 1043569941 /nfs/dbraw/zinc/56/99/41/1043569941.db2.gz NQBSWTMMQHYDEP-RKDXNWHRSA-N 1 2 304.337 4.475 20 0 DIADLO Cc1cccc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3n2C)n1 ZINC000558679260 1043572360 /nfs/dbraw/zinc/57/23/60/1043572360.db2.gz OQPPEQWKWYERPW-LJQANCHMSA-N 1 2 320.440 4.004 20 0 DIADLO Cc1cccc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3n2C)n1 ZINC000558679260 1043572368 /nfs/dbraw/zinc/57/23/68/1043572368.db2.gz OQPPEQWKWYERPW-LJQANCHMSA-N 1 2 320.440 4.004 20 0 DIADLO Clc1ccc(-n2cc(C[NH+]3Cc4ccccc4C3)cn2)cc1 ZINC000353399869 1043604984 /nfs/dbraw/zinc/60/49/84/1043604984.db2.gz DZDIMQSESSJTHO-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO Clc1ccnc2c1CCC[C@H]2[NH2+]Cc1noc2ccccc12 ZINC000926679909 1043616560 /nfs/dbraw/zinc/61/65/60/1043616560.db2.gz WYJJATQWFLDQPL-CQSZACIVSA-N 1 2 313.788 4.043 20 0 DIADLO COCc1nc(C[NH2+][C@@H](c2ccc(C)o2)C2CCCC2)cs1 ZINC000353642431 1043627126 /nfs/dbraw/zinc/62/71/26/1043627126.db2.gz LPDOAGQBIKZSGP-QGZVFWFLSA-N 1 2 320.458 4.212 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1csc(C(F)(F)F)c1 ZINC000926773400 1043630821 /nfs/dbraw/zinc/63/08/21/1043630821.db2.gz WVYYOAMNLWCFKQ-SNVBAGLBSA-N 1 2 316.348 4.231 20 0 DIADLO O=C(Nc1csc2ccccc12)Nc1ccn2cc[nH+]c2c1 ZINC000353676013 1043632505 /nfs/dbraw/zinc/63/25/05/1043632505.db2.gz KYCCIHULSSNLMI-UHFFFAOYSA-N 1 2 308.366 4.193 20 0 DIADLO Cc1ccc([C@H]2COCC[N@@H+]2Cc2c(C)oc3ccccc32)o1 ZINC000353684814 1043633994 /nfs/dbraw/zinc/63/39/94/1043633994.db2.gz TUJWJRPVRRCWNE-QGZVFWFLSA-N 1 2 311.381 4.216 20 0 DIADLO Cc1ccc([C@H]2COCC[N@H+]2Cc2c(C)oc3ccccc32)o1 ZINC000353684814 1043633999 /nfs/dbraw/zinc/63/39/99/1043633999.db2.gz TUJWJRPVRRCWNE-QGZVFWFLSA-N 1 2 311.381 4.216 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+][C@@H]2COCc3cccc(Cl)c32)s1 ZINC000926785990 1043634091 /nfs/dbraw/zinc/63/40/91/1043634091.db2.gz KSHLQNMVTCYSFB-NOZJJQNGSA-N 1 2 308.834 4.027 20 0 DIADLO CC1(C)C[N@H+](Cc2c[nH]nc2-c2ccsc2)[C@@H]1c1ccncc1 ZINC000353713568 1043636580 /nfs/dbraw/zinc/63/65/80/1043636580.db2.gz KAJYWWQMGWLNCN-QGZVFWFLSA-N 1 2 324.453 4.116 20 0 DIADLO CC1(C)C[N@@H+](Cc2c[nH]nc2-c2ccsc2)[C@@H]1c1ccncc1 ZINC000353713568 1043636587 /nfs/dbraw/zinc/63/65/87/1043636587.db2.gz KAJYWWQMGWLNCN-QGZVFWFLSA-N 1 2 324.453 4.116 20 0 DIADLO CCc1nc(C[N@@H+]2CCCC[C@@H]2CCCc2ccccc2)no1 ZINC000443647137 1043641725 /nfs/dbraw/zinc/64/17/25/1043641725.db2.gz KYKWVYJMRJVHSS-QGZVFWFLSA-N 1 2 313.445 4.009 20 0 DIADLO CCc1nc(C[N@H+]2CCCC[C@@H]2CCCc2ccccc2)no1 ZINC000443647137 1043641732 /nfs/dbraw/zinc/64/17/32/1043641732.db2.gz KYKWVYJMRJVHSS-QGZVFWFLSA-N 1 2 313.445 4.009 20 0 DIADLO COCc1nc(C[N@H+](Cc2ccc(C)c(C)c2)C2CC2)cs1 ZINC000353775814 1043643525 /nfs/dbraw/zinc/64/35/25/1043643525.db2.gz PDLLMXOEJFLCQQ-UHFFFAOYSA-N 1 2 316.470 4.071 20 0 DIADLO COCc1nc(C[N@@H+](Cc2ccc(C)c(C)c2)C2CC2)cs1 ZINC000353775814 1043643532 /nfs/dbraw/zinc/64/35/32/1043643532.db2.gz PDLLMXOEJFLCQQ-UHFFFAOYSA-N 1 2 316.470 4.071 20 0 DIADLO CC[C@@H]([NH2+][C@H]1CCCc2oc(C)nc21)c1cc(F)ccc1OC ZINC000926901407 1043652822 /nfs/dbraw/zinc/65/28/22/1043652822.db2.gz RIYHXUSEVFYNRL-CABCVRRESA-N 1 2 318.392 4.249 20 0 DIADLO Fc1ccc(F)c2c1CC[C@@H]2[NH2+]Cc1nc2c(s1)CCCC2 ZINC000926917454 1043655628 /nfs/dbraw/zinc/65/56/28/1043655628.db2.gz AXZKVNFGAWHXQT-AWEZNQCLSA-N 1 2 320.408 4.077 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c(F)c1 ZINC000631123673 1043658678 /nfs/dbraw/zinc/65/86/78/1043658678.db2.gz YNICETXPOKYAOW-VIFPVBQESA-N 1 2 318.339 4.460 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1cnn(C2CCCC2)c1 ZINC000353927904 1043660034 /nfs/dbraw/zinc/66/00/34/1043660034.db2.gz WYFKWAZMBYNEHG-VXGBXAGGSA-N 1 2 320.387 4.083 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1ccccc1-n1cccn1)C2 ZINC001137100680 1043660598 /nfs/dbraw/zinc/66/05/98/1043660598.db2.gz IBQAZLDBJOKWIM-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1ccccc1-n1cccn1)C2 ZINC001137100680 1043660600 /nfs/dbraw/zinc/66/06/00/1043660600.db2.gz IBQAZLDBJOKWIM-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO CCc1cccc(F)c1C[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000474156374 1043671362 /nfs/dbraw/zinc/67/13/62/1043671362.db2.gz UTALBYGZACDJOE-INIZCTEOSA-N 1 2 305.418 4.023 20 0 DIADLO CCc1cccc(F)c1C[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000474156374 1043671370 /nfs/dbraw/zinc/67/13/70/1043671370.db2.gz UTALBYGZACDJOE-INIZCTEOSA-N 1 2 305.418 4.023 20 0 DIADLO Clc1cnc(C[NH+]2CCC3(CCc4ccccc43)CC2)s1 ZINC001137105439 1043677177 /nfs/dbraw/zinc/67/71/77/1043677177.db2.gz SLUHYEHSJDNJFM-UHFFFAOYSA-N 1 2 318.873 4.277 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1sccc1Cl ZINC000927110986 1043688297 /nfs/dbraw/zinc/68/82/97/1043688297.db2.gz XPFKCSNIHVDBFN-CYBMUJFWSA-N 1 2 309.866 4.253 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1sccc1Cl ZINC000927110987 1043688820 /nfs/dbraw/zinc/68/88/20/1043688820.db2.gz XPFKCSNIHVDBFN-ZDUSSCGKSA-N 1 2 309.866 4.253 20 0 DIADLO Cc1ccc2cc([C@@H](C)[NH2+]Cc3cc(C4CC4)n(C)n3)oc2c1 ZINC000927109707 1043689381 /nfs/dbraw/zinc/68/93/81/1043689381.db2.gz VZCXHTXMYUXCBM-CYBMUJFWSA-N 1 2 309.413 4.203 20 0 DIADLO CCc1onc(C)c1C[NH2+][C@H](c1ccc(C)cc1)c1cccnc1 ZINC000927132278 1043695351 /nfs/dbraw/zinc/69/53/51/1043695351.db2.gz NZKWIJLEFZNTPM-HXUWFJFHSA-N 1 2 321.424 4.128 20 0 DIADLO Fc1cccc(-c2noc([C@@H]3CCC[C@@H](c4ccccc4)[NH2+]3)n2)c1 ZINC001211883600 1043695413 /nfs/dbraw/zinc/69/54/13/1043695413.db2.gz BAGUDYVVGRFMTC-IRXDYDNUSA-N 1 2 323.371 4.432 20 0 DIADLO Fc1ccccc1-c1noc([C@H]2CCC[C@@H](c3ccccc3)[NH2+]2)n1 ZINC001211883778 1043695905 /nfs/dbraw/zinc/69/59/05/1043695905.db2.gz BXDKFIVKIWZDOA-DLBZAZTESA-N 1 2 323.371 4.432 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc3c(ccnc3Cl)o2)on1 ZINC000876617047 1043701486 /nfs/dbraw/zinc/70/14/86/1043701486.db2.gz FAROYOAVPRZJJX-ZDUSSCGKSA-N 1 2 317.776 4.115 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc3c(ccnc3Cl)o2)on1 ZINC000876617047 1043701493 /nfs/dbraw/zinc/70/14/93/1043701493.db2.gz FAROYOAVPRZJJX-ZDUSSCGKSA-N 1 2 317.776 4.115 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)[C@@H]2C=CCCCCC2)n1 ZINC000559113659 1043701571 /nfs/dbraw/zinc/70/15/71/1043701571.db2.gz XBYZSPUUOHRQDS-UONOGXRCSA-N 1 2 309.479 4.204 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)[C@@H]2C=CCCCCC2)n1 ZINC000559113659 1043701575 /nfs/dbraw/zinc/70/15/75/1043701575.db2.gz XBYZSPUUOHRQDS-UONOGXRCSA-N 1 2 309.479 4.204 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2cc3c(ccnc3Cl)o2)s1 ZINC000876780875 1043710796 /nfs/dbraw/zinc/71/07/96/1043710796.db2.gz ZREIJUUKCUQQMB-UHFFFAOYSA-N 1 2 321.833 4.132 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2cc3c(ccnc3Cl)o2)s1 ZINC000876780875 1043710807 /nfs/dbraw/zinc/71/08/07/1043710807.db2.gz ZREIJUUKCUQQMB-UHFFFAOYSA-N 1 2 321.833 4.132 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@@H](c2ccccc2)c2ccccn2)c1 ZINC000559233950 1043714762 /nfs/dbraw/zinc/71/47/62/1043714762.db2.gz IMXKHWYBICQTJY-FQEVSTJZSA-N 1 2 322.383 4.109 20 0 DIADLO C[C@H]1CCC[N@@H+]1Cc1c(F)cc(Cl)cc1Br ZINC001141837558 1043742134 /nfs/dbraw/zinc/74/21/34/1043742134.db2.gz IGDOCUUPXOJVKM-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@H]1CCC[N@H+]1Cc1c(F)cc(Cl)cc1Br ZINC001141837558 1043742145 /nfs/dbraw/zinc/74/21/45/1043742145.db2.gz IGDOCUUPXOJVKM-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO COc1c(C)c[nH+]c(CNc2cccc([C@H](C)OC)c2)c1C ZINC000876857219 1043718852 /nfs/dbraw/zinc/71/88/52/1043718852.db2.gz OCHLFPYEAUMHSZ-AWEZNQCLSA-N 1 2 300.402 4.027 20 0 DIADLO CCC[N@H+](Cc1nnc(CC)[nH]1)[C@H](C)c1cc2ccccc2o1 ZINC000354808463 1043721477 /nfs/dbraw/zinc/72/14/77/1043721477.db2.gz QQVPXBPCOQURBK-CYBMUJFWSA-N 1 2 312.417 4.087 20 0 DIADLO CCC[N@@H+](Cc1nnc(CC)[nH]1)[C@H](C)c1cc2ccccc2o1 ZINC000354808463 1043721493 /nfs/dbraw/zinc/72/14/93/1043721493.db2.gz QQVPXBPCOQURBK-CYBMUJFWSA-N 1 2 312.417 4.087 20 0 DIADLO C[N@H+](Cc1cc(-c2cccs2)on1)Cc1ccc(F)cc1 ZINC000052929943 1043736768 /nfs/dbraw/zinc/73/67/68/1043736768.db2.gz IJMIOXXYYRGIKS-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO C[N@@H+](Cc1cc(-c2cccs2)on1)Cc1ccc(F)cc1 ZINC000052929943 1043736777 /nfs/dbraw/zinc/73/67/77/1043736777.db2.gz IJMIOXXYYRGIKS-UHFFFAOYSA-N 1 2 302.374 4.174 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2ccc(C(C)C)cc2C(C)C)n1 ZINC000680415904 1043740781 /nfs/dbraw/zinc/74/07/81/1043740781.db2.gz QNQZYFKNVCHKQH-CYBMUJFWSA-N 1 2 301.434 4.476 20 0 DIADLO C[C@H]1CC[N@H+](Cc2c(F)cc(Cl)cc2Br)C1 ZINC001141837676 1043741303 /nfs/dbraw/zinc/74/13/03/1043741303.db2.gz LWGAPGBEFXRLEW-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2c(F)cc(Cl)cc2Br)C1 ZINC001141837676 1043741316 /nfs/dbraw/zinc/74/13/16/1043741316.db2.gz LWGAPGBEFXRLEW-QMMMGPOBSA-N 1 2 306.606 4.083 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccccc2s1)c1nc2c(s1)CCC2 ZINC000355121587 1043745778 /nfs/dbraw/zinc/74/57/78/1043745778.db2.gz NTXCHSLKELBIOK-SNVBAGLBSA-N 1 2 315.467 4.092 20 0 DIADLO C[C@H](C[N@H+](C)Cc1c(Cl)cncc1Cl)c1nccs1 ZINC000877315792 1043755672 /nfs/dbraw/zinc/75/56/72/1043755672.db2.gz BCSHWUIFLBIIIO-SECBINFHSA-N 1 2 316.257 4.080 20 0 DIADLO C[C@H](C[N@@H+](C)Cc1c(Cl)cncc1Cl)c1nccs1 ZINC000877315792 1043755686 /nfs/dbraw/zinc/75/56/86/1043755686.db2.gz BCSHWUIFLBIIIO-SECBINFHSA-N 1 2 316.257 4.080 20 0 DIADLO C[C@H](Cc1ccsc1)[NH2+]c1ccc(N2CCOC[C@H]2C)cc1 ZINC000777691604 1043755860 /nfs/dbraw/zinc/75/58/60/1043755860.db2.gz DBROEANEQOCOBU-HUUCEWRRSA-N 1 2 316.470 4.016 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1cccnc1Cl ZINC000777705300 1043766526 /nfs/dbraw/zinc/76/65/26/1043766526.db2.gz PWZWQABXIGJSHW-ZDUSSCGKSA-N 1 2 316.836 4.293 20 0 DIADLO Clc1cncc(Cl)c1C[NH+]1CCC(c2cccnc2)CC1 ZINC000877525330 1043769279 /nfs/dbraw/zinc/76/92/79/1043769279.db2.gz ZNNHFYPQHUJGDU-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1coc2cc(F)ccc12 ZINC000355467305 1043769566 /nfs/dbraw/zinc/76/95/66/1043769566.db2.gz QUQNSKJPKPMCJF-UHFFFAOYSA-N 1 2 321.311 4.214 20 0 DIADLO CCc1noc(C)c1[C@H](C)Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000777704898 1043770351 /nfs/dbraw/zinc/77/03/51/1043770351.db2.gz MQLTVSHTKYNUQA-ZDUSSCGKSA-N 1 2 314.433 4.104 20 0 DIADLO CC1(C)C[N@H+](Cc2cnc3c(F)cccc3c2)[C@@H]1c1cccnc1 ZINC000877545204 1043772809 /nfs/dbraw/zinc/77/28/09/1043772809.db2.gz GRZDAACWGHTYBZ-LJQANCHMSA-N 1 2 321.399 4.352 20 0 DIADLO CC1(C)C[N@@H+](Cc2cnc3c(F)cccc3c2)[C@@H]1c1cccnc1 ZINC000877545204 1043772819 /nfs/dbraw/zinc/77/28/19/1043772819.db2.gz GRZDAACWGHTYBZ-LJQANCHMSA-N 1 2 321.399 4.352 20 0 DIADLO Fc1ccc2occ(C[N@@H+]3CCO[C@@H](c4ccccc4)C3)c2c1 ZINC001141852689 1043778219 /nfs/dbraw/zinc/77/82/19/1043778219.db2.gz NXVPYNRKXARTLO-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccc2occ(C[N@H+]3CCO[C@@H](c4ccccc4)C3)c2c1 ZINC001141852689 1043778229 /nfs/dbraw/zinc/77/82/29/1043778229.db2.gz NXVPYNRKXARTLO-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CCC[C@H]2c2ccc(C)cc2)cs1 ZINC000355667455 1043784146 /nfs/dbraw/zinc/78/41/46/1043784146.db2.gz XOYGJGVJDCAUJW-YOEHRIQHSA-N 1 2 316.470 4.496 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CCC[C@H]2c2ccc(C)cc2)cs1 ZINC000355667455 1043784155 /nfs/dbraw/zinc/78/41/55/1043784155.db2.gz XOYGJGVJDCAUJW-YOEHRIQHSA-N 1 2 316.470 4.496 20 0 DIADLO Fc1cc(C[NH2+]Cc2ncc(Cl)s2)ccc1C(F)F ZINC000895932021 1043785233 /nfs/dbraw/zinc/78/52/33/1043785233.db2.gz WAHFFYGJHFNWFZ-UHFFFAOYSA-N 1 2 306.740 4.163 20 0 DIADLO C[C@H]1CCC[C@@H](CC(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)C1 ZINC000355808863 1043787237 /nfs/dbraw/zinc/78/72/37/1043787237.db2.gz CQWUVUABWPLCFQ-UONOGXRCSA-N 1 2 315.392 4.166 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccnc(Cl)c2Cl)C1 ZINC000877812166 1043798999 /nfs/dbraw/zinc/79/89/99/1043798999.db2.gz IMGZCSDKKDPSPA-LLVKDONJSA-N 1 2 313.150 4.163 20 0 DIADLO CC(C)([NH2+]Cc1ccnc(F)c1)c1nc2cc(Cl)ccc2o1 ZINC000877668512 1043788695 /nfs/dbraw/zinc/78/86/95/1043788695.db2.gz JLFLLWFRQIPSTR-UHFFFAOYSA-N 1 2 319.767 4.040 20 0 DIADLO CC(C)([NH2+]Cc1ccc(F)cn1)c1nc2cc(Cl)ccc2o1 ZINC000877669126 1043789205 /nfs/dbraw/zinc/78/92/05/1043789205.db2.gz VGOIUXKXLUGRTN-UHFFFAOYSA-N 1 2 319.767 4.040 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3c(ncn3-c3ccccc3)C2)cc1C ZINC000929065010 1043789483 /nfs/dbraw/zinc/78/94/83/1043789483.db2.gz JJLAYIBDROHUQJ-UHFFFAOYSA-N 1 2 317.436 4.047 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3c(ncn3-c3ccccc3)C2)cc1C ZINC000929065010 1043789489 /nfs/dbraw/zinc/78/94/89/1043789489.db2.gz JJLAYIBDROHUQJ-UHFFFAOYSA-N 1 2 317.436 4.047 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3c(ncn3-c3ccccc3)C2)c(C)s1 ZINC000929066462 1043789528 /nfs/dbraw/zinc/78/95/28/1043789528.db2.gz WCIGNAALGCFMRQ-UHFFFAOYSA-N 1 2 323.465 4.109 20 0 DIADLO Cc1cc(C[N@H+]2CCc3c(ncn3-c3ccccc3)C2)c(C)s1 ZINC000929066462 1043789536 /nfs/dbraw/zinc/78/95/36/1043789536.db2.gz WCIGNAALGCFMRQ-UHFFFAOYSA-N 1 2 323.465 4.109 20 0 DIADLO CSCc1cnc(C[N@H+](C)Cc2ccc3cc[nH]c3c2)s1 ZINC000877770522 1043796784 /nfs/dbraw/zinc/79/67/84/1043796784.db2.gz WPNCKDLNOSZHCK-UHFFFAOYSA-N 1 2 317.483 4.119 20 0 DIADLO CSCc1cnc(C[N@@H+](C)Cc2ccc3cc[nH]c3c2)s1 ZINC000877770522 1043796795 /nfs/dbraw/zinc/79/67/95/1043796795.db2.gz WPNCKDLNOSZHCK-UHFFFAOYSA-N 1 2 317.483 4.119 20 0 DIADLO Cc1ncc(C[NH2+][C@H](c2nc3ccccc3[nH]2)C2CCCCC2)o1 ZINC000877763794 1043797297 /nfs/dbraw/zinc/79/72/97/1043797297.db2.gz JTTRCVGRSSBYFN-SFHVURJKSA-N 1 2 324.428 4.271 20 0 DIADLO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccnc(Cl)c2Cl)C1 ZINC000877812166 1043798988 /nfs/dbraw/zinc/79/89/88/1043798988.db2.gz IMGZCSDKKDPSPA-LLVKDONJSA-N 1 2 313.150 4.163 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1cc(O)cc(C(F)(F)F)c1 ZINC000356059975 1043804249 /nfs/dbraw/zinc/80/42/49/1043804249.db2.gz IJCOGXFWHADOJS-INIZCTEOSA-N 1 2 324.346 4.087 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1cc(O)cc(C(F)(F)F)c1 ZINC000356059975 1043804271 /nfs/dbraw/zinc/80/42/71/1043804271.db2.gz IJCOGXFWHADOJS-INIZCTEOSA-N 1 2 324.346 4.087 20 0 DIADLO Cc1nnsc1[C@@H](C)[N@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC000929286933 1043807247 /nfs/dbraw/zinc/80/72/47/1043807247.db2.gz KMJZUKWPZTYSPT-SNVBAGLBSA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nnsc1[C@@H](C)[N@@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC000929286933 1043807268 /nfs/dbraw/zinc/80/72/68/1043807268.db2.gz KMJZUKWPZTYSPT-SNVBAGLBSA-N 1 2 315.364 4.058 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)c(Cl)c1)[C@H](C)c1ncccn1 ZINC000929318963 1043807814 /nfs/dbraw/zinc/80/78/14/1043807814.db2.gz GTSCFVOHHSKSBI-LLVKDONJSA-N 1 2 310.228 4.367 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@H](C)c1ncccn1 ZINC000929318963 1043807835 /nfs/dbraw/zinc/80/78/35/1043807835.db2.gz GTSCFVOHHSKSBI-LLVKDONJSA-N 1 2 310.228 4.367 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cscc2C(F)(F)F)on1 ZINC000356081144 1043808589 /nfs/dbraw/zinc/80/85/89/1043808589.db2.gz FPGPNSBAQUOMGM-LBPRGKRZSA-N 1 2 316.348 4.400 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cscc2C(F)(F)F)on1 ZINC000356081144 1043808613 /nfs/dbraw/zinc/80/86/13/1043808613.db2.gz FPGPNSBAQUOMGM-LBPRGKRZSA-N 1 2 316.348 4.400 20 0 DIADLO CCc1nc(C[N@H+](C)C[C@@H]2[C@@H](c3ccccc3)C2(F)F)cs1 ZINC000929344842 1043810282 /nfs/dbraw/zinc/81/02/82/1043810282.db2.gz SPPJOCGESBUDGX-GDBMZVCRSA-N 1 2 322.424 4.186 20 0 DIADLO CCc1nc(C[N@@H+](C)C[C@@H]2[C@@H](c3ccccc3)C2(F)F)cs1 ZINC000929344842 1043810308 /nfs/dbraw/zinc/81/03/08/1043810308.db2.gz SPPJOCGESBUDGX-GDBMZVCRSA-N 1 2 322.424 4.186 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1nc2c(o1)CCCC2 ZINC000877891829 1043817043 /nfs/dbraw/zinc/81/70/43/1043817043.db2.gz HCWVUBUMUCSMSQ-ZDUSSCGKSA-N 1 2 310.397 4.493 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nc2c(o1)CCCC2 ZINC000877891829 1043817055 /nfs/dbraw/zinc/81/70/55/1043817055.db2.gz HCWVUBUMUCSMSQ-ZDUSSCGKSA-N 1 2 310.397 4.493 20 0 DIADLO COC[C@@H]([NH2+]Cc1cscc1C(F)(F)F)c1ccc(C)o1 ZINC000356197890 1043821591 /nfs/dbraw/zinc/82/15/91/1043821591.db2.gz WUGPUPXSBOHLAT-GFCCVEGCSA-N 1 2 319.348 4.146 20 0 DIADLO Oc1cc(C[N@@H+]2CCC[C@H]2c2cccnc2)cc(C(F)(F)F)c1 ZINC000356294768 1043830177 /nfs/dbraw/zinc/83/01/77/1043830177.db2.gz ANOOOGUKXYQFMD-INIZCTEOSA-N 1 2 322.330 4.143 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@H]2c2cccnc2)cc(C(F)(F)F)c1 ZINC000356294768 1043830200 /nfs/dbraw/zinc/83/02/00/1043830200.db2.gz ANOOOGUKXYQFMD-INIZCTEOSA-N 1 2 322.330 4.143 20 0 DIADLO Cc1conc1C[N@@H+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000878047809 1043841004 /nfs/dbraw/zinc/84/10/04/1043841004.db2.gz UWJIZKDXILYXJF-OAHLLOKOSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1conc1C[N@H+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000878047809 1043841025 /nfs/dbraw/zinc/84/10/25/1043841025.db2.gz UWJIZKDXILYXJF-OAHLLOKOSA-N 1 2 310.319 4.339 20 0 DIADLO CCc1cc(C[NH2+][C@H](c2cccnc2)c2cc(C)cc(C)c2)on1 ZINC000925130806 1043849766 /nfs/dbraw/zinc/84/97/66/1043849766.db2.gz XTVVONPANUTOAA-HXUWFJFHSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ccco2)Cc2cc(C)nnc2C)c1 ZINC000929890467 1043851960 /nfs/dbraw/zinc/85/19/60/1043851960.db2.gz WTKLYHNAYUNVBF-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ccco2)Cc2cc(C)nnc2C)c1 ZINC000929890467 1043851971 /nfs/dbraw/zinc/85/19/71/1043851971.db2.gz WTKLYHNAYUNVBF-UHFFFAOYSA-N 1 2 321.424 4.197 20 0 DIADLO C[C@H]1CCCC[C@@H]1c1noc(-c2cccc(-n3cc[nH+]c3)c2)n1 ZINC000356586481 1043852898 /nfs/dbraw/zinc/85/28/98/1043852898.db2.gz XZNGLRBHHISHBT-BBRMVZONSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@H]1CCC[C@H](c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)C1 ZINC000356602656 1043853772 /nfs/dbraw/zinc/85/37/72/1043853772.db2.gz QEWNAABVOPNTPH-ZFWWWQNUSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@@H]1CCC[C@H](c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)C1 ZINC000356602654 1043854286 /nfs/dbraw/zinc/85/42/86/1043854286.db2.gz QEWNAABVOPNTPH-HIFRSBDPSA-N 1 2 308.385 4.216 20 0 DIADLO CCc1cccc(F)c1C[NH2+]Cc1coc(-c2cccs2)n1 ZINC000474618389 1043862608 /nfs/dbraw/zinc/86/26/08/1043862608.db2.gz YWQZBGRQTJWTFO-UHFFFAOYSA-N 1 2 316.401 4.394 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2ccc(C)c(Cl)n2)sc1C ZINC000878260809 1043864719 /nfs/dbraw/zinc/86/47/19/1043864719.db2.gz CNCOUDNOMDUHJH-UHFFFAOYSA-N 1 2 309.866 4.142 20 0 DIADLO CC[C@@](C)([NH2+]Cc1ccc(C)c(Cl)n1)c1nc(C)cs1 ZINC000878262841 1043867118 /nfs/dbraw/zinc/86/71/18/1043867118.db2.gz WTMDENUKYOGWJG-OAHLLOKOSA-N 1 2 309.866 4.223 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1noc2c1CC(C)(C)CC2 ZINC000878345572 1043872147 /nfs/dbraw/zinc/87/21/47/1043872147.db2.gz TWBYARFGNSUVBR-CYBMUJFWSA-N 1 2 314.429 4.049 20 0 DIADLO Cc1conc1C[NH2+][C@H](C)c1ccc(-c2csc(C)n2)cc1 ZINC000878354488 1043875648 /nfs/dbraw/zinc/87/56/48/1043875648.db2.gz NGOQERIWWIAQOO-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO C[C@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccccc1C(F)(F)F ZINC000878366790 1043878780 /nfs/dbraw/zinc/87/87/80/1043878780.db2.gz BDRYLNLGQUTAEV-NSHDSACASA-N 1 2 324.346 4.423 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2cc(C(F)(F)F)co2)s1 ZINC000878418066 1043889814 /nfs/dbraw/zinc/88/98/14/1043889814.db2.gz UZZQZSJSYBIRQR-UHFFFAOYSA-N 1 2 304.337 4.088 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(CC2CC2)no1)c1csc2ccccc12 ZINC000878419391 1043890382 /nfs/dbraw/zinc/89/03/82/1043890382.db2.gz DKQGXXPVRLPNSA-LLVKDONJSA-N 1 2 313.426 4.088 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2nc(C(C)C)ns2)c1 ZINC000930198015 1043891621 /nfs/dbraw/zinc/89/16/21/1043891621.db2.gz IDMFWIKPHRTXMV-CYBMUJFWSA-N 1 2 319.474 4.300 20 0 DIADLO CCc1cccc(F)c1C[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000474720298 1043899251 /nfs/dbraw/zinc/89/92/51/1043899251.db2.gz QOVBCAYICNZTBN-UHFFFAOYSA-N 1 2 306.450 4.432 20 0 DIADLO Cc1c2ccccc2oc1[C@@H]([NH2+]Cc1nncs1)C(C)C ZINC000930222809 1043900172 /nfs/dbraw/zinc/90/01/72/1043900172.db2.gz ROEMMXGLBLRMCA-HNNXBMFYSA-N 1 2 301.415 4.080 20 0 DIADLO CC(C)([NH2+]Cc1csc(Cl)n1)c1cccc(Cl)c1 ZINC000289963815 1043902530 /nfs/dbraw/zinc/90/25/30/1043902530.db2.gz ITRHTAFQYRHHCT-UHFFFAOYSA-N 1 2 301.242 4.475 20 0 DIADLO Cc1cnc([C@H](C)[NH+]2CCC(Oc3ccccc3Cl)CC2)o1 ZINC000356998057 1043904912 /nfs/dbraw/zinc/90/49/12/1043904912.db2.gz ABZFPTIYLNJNSA-ZDUSSCGKSA-N 1 2 320.820 4.241 20 0 DIADLO c1cn(-c2ccc(CSCc3nc4ccccc4[nH]3)cc2)c[nH+]1 ZINC000357019358 1043907380 /nfs/dbraw/zinc/90/73/80/1043907380.db2.gz ZLMIOXLGBYVHIF-UHFFFAOYSA-N 1 2 320.421 4.182 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nc(C(F)(F)F)cs2)CC12CCC2 ZINC000357051120 1043911962 /nfs/dbraw/zinc/91/19/62/1043911962.db2.gz ZUVHJGVNFXAGDV-JTQLQIEISA-N 1 2 304.381 4.174 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nc(C(F)(F)F)cs2)CC12CCC2 ZINC000357051120 1043911969 /nfs/dbraw/zinc/91/19/69/1043911969.db2.gz ZUVHJGVNFXAGDV-JTQLQIEISA-N 1 2 304.381 4.174 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2ccccc2OC2CC2)cs1 ZINC000290147048 1043923069 /nfs/dbraw/zinc/92/30/69/1043923069.db2.gz WIKLPRJWLQTJHD-GFCCVEGCSA-N 1 2 302.443 4.098 20 0 DIADLO Cc1ccccc1-c1cccc(C[N@@H+](C)Cc2nccn2C)c1 ZINC000357209234 1043928758 /nfs/dbraw/zinc/92/87/58/1043928758.db2.gz AVNORVDDQVISRI-UHFFFAOYSA-N 1 2 305.425 4.028 20 0 DIADLO Cc1ccccc1-c1cccc(C[N@H+](C)Cc2nccn2C)c1 ZINC000357209234 1043928768 /nfs/dbraw/zinc/92/87/68/1043928768.db2.gz AVNORVDDQVISRI-UHFFFAOYSA-N 1 2 305.425 4.028 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1nc(C)c(C(C)(C)C)s1 ZINC000930477613 1043929908 /nfs/dbraw/zinc/92/99/08/1043929908.db2.gz SEFYRQITAARGOB-UHFFFAOYSA-N 1 2 321.490 4.379 20 0 DIADLO CCc1onc(C)c1C[N@@H+]1CCC[C@@H]1c1nc2cc(C)ccc2[nH]1 ZINC000930486499 1043932527 /nfs/dbraw/zinc/93/25/27/1043932527.db2.gz MWEOLSUOSYMQJA-QGZVFWFLSA-N 1 2 324.428 4.067 20 0 DIADLO CCc1onc(C)c1C[N@H+]1CCC[C@@H]1c1nc2cc(C)ccc2[nH]1 ZINC000930486499 1043932535 /nfs/dbraw/zinc/93/25/35/1043932535.db2.gz MWEOLSUOSYMQJA-QGZVFWFLSA-N 1 2 324.428 4.067 20 0 DIADLO CCc1onc(C)c1C[N@@H+]1CCC[C@@H]1c1nc2ccc(C)cc2[nH]1 ZINC000930486499 1043932548 /nfs/dbraw/zinc/93/25/48/1043932548.db2.gz MWEOLSUOSYMQJA-QGZVFWFLSA-N 1 2 324.428 4.067 20 0 DIADLO CCc1onc(C)c1C[N@H+]1CCC[C@@H]1c1nc2ccc(C)cc2[nH]1 ZINC000930486499 1043932556 /nfs/dbraw/zinc/93/25/56/1043932556.db2.gz MWEOLSUOSYMQJA-QGZVFWFLSA-N 1 2 324.428 4.067 20 0 DIADLO COc1cccc(C=C2CC[NH+](Cc3ncc(C)s3)CC2)c1 ZINC000357308493 1043938082 /nfs/dbraw/zinc/93/80/82/1043938082.db2.gz UGAOMSLQZGBQKJ-UHFFFAOYSA-N 1 2 314.454 4.140 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCc3ccc4c(c3)COC4)c2c1 ZINC000777917892 1043940798 /nfs/dbraw/zinc/94/07/98/1043940798.db2.gz UTPOFQXIQCMXLU-UHFFFAOYSA-N 1 2 321.376 4.161 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000290414531 1043949951 /nfs/dbraw/zinc/94/99/51/1043949951.db2.gz KHVBLBQBSLAUOC-AWEZNQCLSA-N 1 2 303.475 4.419 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000290414531 1043949960 /nfs/dbraw/zinc/94/99/60/1043949960.db2.gz KHVBLBQBSLAUOC-AWEZNQCLSA-N 1 2 303.475 4.419 20 0 DIADLO Cc1cccc2c(C[N@H+](C)Cc3nc4ccccc4s3)[nH]nc21 ZINC001137141941 1043952779 /nfs/dbraw/zinc/95/27/79/1043952779.db2.gz OGHFNAAIPASBON-UHFFFAOYSA-N 1 2 322.437 4.113 20 0 DIADLO Cc1cccc2c(C[N@@H+](C)Cc3nc4ccccc4s3)[nH]nc21 ZINC001137141941 1043952786 /nfs/dbraw/zinc/95/27/86/1043952786.db2.gz OGHFNAAIPASBON-UHFFFAOYSA-N 1 2 322.437 4.113 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1cc(C)on1 ZINC000290578341 1043964453 /nfs/dbraw/zinc/96/44/53/1043964453.db2.gz FSKIGPWMBAQYML-DZGCQCFKSA-N 1 2 302.418 4.320 20 0 DIADLO Cc1ccccc1C1([NH2+]Cc2nc(C(C)C)ns2)CCC1 ZINC000930842541 1043967462 /nfs/dbraw/zinc/96/74/62/1043967462.db2.gz FGXUWBWIPLPIOE-UHFFFAOYSA-N 1 2 301.459 4.139 20 0 DIADLO COC[C@@H]([NH2+]Cc1nc(C(C)C)cs1)c1cccc(Cl)c1 ZINC000290610482 1043968367 /nfs/dbraw/zinc/96/83/67/1043968367.db2.gz HYFQETWNRJQIJN-CQSZACIVSA-N 1 2 324.877 4.397 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc([C@H]3CCCOC3)cc2)c(C)[nH+]1 ZINC000329396432 1043975275 /nfs/dbraw/zinc/97/52/75/1043975275.db2.gz WCFFLFAFHFXWCQ-SFHVURJKSA-N 1 2 324.424 4.153 20 0 DIADLO FC(F)C(F)(F)COc1cc(NCc2ccsc2)cc[nH+]1 ZINC000357703937 1043976706 /nfs/dbraw/zinc/97/67/06/1043976706.db2.gz DUNLALSWXBECQE-UHFFFAOYSA-N 1 2 320.311 4.034 20 0 DIADLO C[C@@H](c1ccc(F)nc1)[N@@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000930967489 1043978565 /nfs/dbraw/zinc/97/85/65/1043978565.db2.gz XVANUUNNVGJHIC-GUYCJALGSA-N 1 2 300.377 4.492 20 0 DIADLO C[C@@H](c1ccc(F)nc1)[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000930967489 1043978576 /nfs/dbraw/zinc/97/85/76/1043978576.db2.gz XVANUUNNVGJHIC-GUYCJALGSA-N 1 2 300.377 4.492 20 0 DIADLO CC(C)c1nsc(C[NH2+][C@H](c2ccccc2F)C(C)C)n1 ZINC000930970114 1043979100 /nfs/dbraw/zinc/97/91/00/1043979100.db2.gz YDKOBMHLXGJZLE-HNNXBMFYSA-N 1 2 307.438 4.288 20 0 DIADLO c1cn2c(cccc2CNc2ccnc(Oc3ccccc3)c2)[nH+]1 ZINC000357713816 1043979227 /nfs/dbraw/zinc/97/92/27/1043979227.db2.gz GDDXWBRLFFDXRI-UHFFFAOYSA-N 1 2 316.364 4.134 20 0 DIADLO C[C@H]([NH2+]Cc1csc(Cl)n1)c1ccc(C(F)(F)F)nc1 ZINC000880103498 1044010822 /nfs/dbraw/zinc/01/08/22/1044010822.db2.gz YBYIRJLZBYORIZ-ZETCQYMHSA-N 1 2 321.755 4.061 20 0 DIADLO Cc1cc(C)nc(C[NH2+]C2(c3c(F)cccc3F)CCC2)c1 ZINC000931338185 1044013470 /nfs/dbraw/zinc/01/34/70/1044013470.db2.gz OHMAOHYXSSOFIE-UHFFFAOYSA-N 1 2 302.368 4.146 20 0 DIADLO Cc1nccnc1[C@H](C)[NH2+]Cc1nc(C2CCCCC2)cs1 ZINC000880109302 1044013660 /nfs/dbraw/zinc/01/36/60/1044013660.db2.gz VXFGCBNYCUNYMZ-ZDUSSCGKSA-N 1 2 316.474 4.140 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc(C(C)C)ns1)c1ccc(F)cc1 ZINC000931379998 1044018457 /nfs/dbraw/zinc/01/84/57/1044018457.db2.gz FXDUCMHOKNLHAR-MRXNPFEDSA-N 1 2 307.438 4.216 20 0 DIADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2cc(F)c(F)c(F)c2)cs1 ZINC000358092212 1044018673 /nfs/dbraw/zinc/01/86/73/1044018673.db2.gz YBQPFBDZNRGOFG-YUMQZZPRSA-N 1 2 300.349 4.281 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)c(C(F)(F)F)cc1F)c1ccco1 ZINC000561886913 1044021299 /nfs/dbraw/zinc/02/12/99/1044021299.db2.gz CEMHYNGJMNDLLE-QMMMGPOBSA-N 1 2 305.246 4.427 20 0 DIADLO CC[N@H+](Cc1cn(C(C)C)nn1)Cc1ccc2ccccc2c1 ZINC000561943195 1044034079 /nfs/dbraw/zinc/03/40/79/1044034079.db2.gz KJKKKYJVJJXFPR-UHFFFAOYSA-N 1 2 308.429 4.034 20 0 DIADLO CC[N@@H+](Cc1cn(C(C)C)nn1)Cc1ccc2ccccc2c1 ZINC000561943195 1044034092 /nfs/dbraw/zinc/03/40/92/1044034092.db2.gz KJKKKYJVJJXFPR-UHFFFAOYSA-N 1 2 308.429 4.034 20 0 DIADLO CCSc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1nnc(C(C)C)[nH]1 ZINC000358231688 1044037764 /nfs/dbraw/zinc/03/77/64/1044037764.db2.gz ADSFLPLKLORZSG-OLZOCXBDSA-N 1 2 318.490 4.452 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccnc(Cl)c1 ZINC000128435755 1044041656 /nfs/dbraw/zinc/04/16/56/1044041656.db2.gz YOQMHEWPSLHLAP-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H]2CCSc3ccc(F)cc32)s1 ZINC000358295178 1044049356 /nfs/dbraw/zinc/04/93/56/1044049356.db2.gz ZCBJQEHOIVOIOK-LBPRGKRZSA-N 1 2 323.462 4.127 20 0 DIADLO Cc1csc(C[N@H+](Cc2cccnc2)Cc2ccccn2)c1 ZINC001137157354 1044052824 /nfs/dbraw/zinc/05/28/24/1044052824.db2.gz UXXWUOSXXLJCJF-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1csc(C[N@@H+](Cc2cccnc2)Cc2ccccn2)c1 ZINC001137157354 1044052835 /nfs/dbraw/zinc/05/28/35/1044052835.db2.gz UXXWUOSXXLJCJF-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2CCSc3ccccc32)c(C)[nH+]1 ZINC000358362700 1044059460 /nfs/dbraw/zinc/05/94/60/1044059460.db2.gz XDIKFZONDDRMJZ-HNNXBMFYSA-N 1 2 312.438 4.225 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H]2CCc3cccc4cccc2c43)n1 ZINC000931807945 1044075657 /nfs/dbraw/zinc/07/56/57/1044075657.db2.gz XPKOBZOIYQRNNY-QGZVFWFLSA-N 1 2 321.424 4.343 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(F)cc(C(F)(F)F)c2)CCC1(F)F ZINC000562206535 1044085415 /nfs/dbraw/zinc/08/54/15/1044085415.db2.gz FLQVGYOLHKEMJK-SECBINFHSA-N 1 2 311.269 4.322 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(F)cc(C(F)(F)F)c2)CCC1(F)F ZINC000562206535 1044085432 /nfs/dbraw/zinc/08/54/32/1044085432.db2.gz FLQVGYOLHKEMJK-SECBINFHSA-N 1 2 311.269 4.322 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2c(Cl)ccc3cccnc32)n1 ZINC000358592257 1044086826 /nfs/dbraw/zinc/08/68/26/1044086826.db2.gz YXKOCUKXEVFCHM-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2c(Cl)ccc3cccnc32)n1 ZINC000358592257 1044086839 /nfs/dbraw/zinc/08/68/39/1044086839.db2.gz YXKOCUKXEVFCHM-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@@H]2CCc3sc(Cl)cc32)[nH+]1 ZINC000562237495 1044089287 /nfs/dbraw/zinc/08/92/87/1044089287.db2.gz ZWRQIPWWPJTXHP-SNVBAGLBSA-N 1 2 304.806 4.081 20 0 DIADLO CN(C)c1cc[nH+]cc1CN[C@H]1CCCc2sc(Cl)cc21 ZINC000291712335 1044097138 /nfs/dbraw/zinc/09/71/38/1044097138.db2.gz LMURSWIJYXJNOC-ZDUSSCGKSA-N 1 2 321.877 4.030 20 0 DIADLO CC(C)[C@@]1(C)C[C@H]1c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000346378451 1044098859 /nfs/dbraw/zinc/09/88/59/1044098859.db2.gz BMMDVRMSCREOBQ-MAUKXSAKSA-N 1 2 308.385 4.072 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+]1CCC(F)(F)[C@@H](CO)C1 ZINC000291768584 1044101896 /nfs/dbraw/zinc/10/18/96/1044101896.db2.gz LPBUSXRQLMATHJ-NXEZZACHSA-N 1 2 324.198 4.004 20 0 DIADLO C[C@H](c1ccc(Cl)cc1Cl)[N@H+]1CCC(F)(F)[C@@H](CO)C1 ZINC000291768584 1044101900 /nfs/dbraw/zinc/10/19/00/1044101900.db2.gz LPBUSXRQLMATHJ-NXEZZACHSA-N 1 2 324.198 4.004 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3c[nH]cn3)CC2)cc1Cl ZINC000358795548 1044101975 /nfs/dbraw/zinc/10/19/75/1044101975.db2.gz GOXBXOIDUSAKOQ-UHFFFAOYSA-N 1 2 308.212 4.006 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3c[nH]cn3)CC2)cc1Cl ZINC000358795548 1044101981 /nfs/dbraw/zinc/10/19/81/1044101981.db2.gz GOXBXOIDUSAKOQ-UHFFFAOYSA-N 1 2 308.212 4.006 20 0 DIADLO Cc1ccc(Oc2ccccc2)c(NC(=O)CCc2[nH]cc[nH+]2)c1 ZINC000346428619 1044103366 /nfs/dbraw/zinc/10/33/66/1044103366.db2.gz HJTFOTHXRTUBIS-UHFFFAOYSA-N 1 2 321.380 4.082 20 0 DIADLO CCCCc1nc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccnc2)cs1 ZINC000358835536 1044103404 /nfs/dbraw/zinc/10/34/04/1044103404.db2.gz YNMPTSRLUFMBDM-RHSMWYFYSA-N 1 2 315.486 4.464 20 0 DIADLO CCCCc1nc(C[N@H+]2C[C@H](C)C[C@@H]2c2cccnc2)cs1 ZINC000358835536 1044103409 /nfs/dbraw/zinc/10/34/09/1044103409.db2.gz YNMPTSRLUFMBDM-RHSMWYFYSA-N 1 2 315.486 4.464 20 0 DIADLO O=C(/C=C\Sc1ccccc1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000881075102 1044103612 /nfs/dbraw/zinc/10/36/12/1044103612.db2.gz MWXUVAPIMOJYRX-RAXLEYEMSA-N 1 2 321.405 4.117 20 0 DIADLO Cc1ccsc1[C@H](CO)[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000346517206 1044110780 /nfs/dbraw/zinc/11/07/80/1044110780.db2.gz DDNPGKACOXLJSW-RYUDHWBXSA-N 1 2 310.488 4.021 20 0 DIADLO CC(C)CCc1nc(C[NH2+][C@H](c2ccccn2)C2CC2)cs1 ZINC000932381286 1044121379 /nfs/dbraw/zinc/12/13/79/1044121379.db2.gz MGOGYKZGUNZIFE-SFHVURJKSA-N 1 2 315.486 4.368 20 0 DIADLO Fc1cccc(C[N@H+](Cc2ncc(C3CC3)o2)C2CCC2)c1 ZINC000932403128 1044125556 /nfs/dbraw/zinc/12/55/56/1044125556.db2.gz MMCRNKMANYETQY-UHFFFAOYSA-N 1 2 300.377 4.246 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2ncc(C3CC3)o2)C2CCC2)c1 ZINC000932403128 1044125561 /nfs/dbraw/zinc/12/55/61/1044125561.db2.gz MMCRNKMANYETQY-UHFFFAOYSA-N 1 2 300.377 4.246 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@@H](C)c2ccc(F)cc2C)n1 ZINC000932565697 1044143974 /nfs/dbraw/zinc/14/39/74/1044143974.db2.gz VKCCYILSMYIGGG-RYUDHWBXSA-N 1 2 323.437 4.182 20 0 DIADLO Cc1ccoc1CNc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000444007466 1044152900 /nfs/dbraw/zinc/15/29/00/1044152900.db2.gz BDNOYWICWBRHLG-UHFFFAOYSA-N 1 2 307.397 4.400 20 0 DIADLO CC(C)c1ccc([C@H](C)[N@@H+](C)Cc2nncn2C(C)C)cc1 ZINC000292288058 1044158364 /nfs/dbraw/zinc/15/83/64/1044158364.db2.gz CDVZTIJCKUTUDB-HNNXBMFYSA-N 1 2 300.450 4.175 20 0 DIADLO CC(C)c1ccc([C@H](C)[N@H+](C)Cc2nncn2C(C)C)cc1 ZINC000292288058 1044158370 /nfs/dbraw/zinc/15/83/70/1044158370.db2.gz CDVZTIJCKUTUDB-HNNXBMFYSA-N 1 2 300.450 4.175 20 0 DIADLO COc1ccncc1C[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000346863113 1044163218 /nfs/dbraw/zinc/16/32/18/1044163218.db2.gz HFSAJTVOAQYVNA-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccncc1C[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000346863113 1044163223 /nfs/dbraw/zinc/16/32/23/1044163223.db2.gz HFSAJTVOAQYVNA-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO CCS[C@@H](C)c1noc(-c2cc(C)ccc2-n2cc[nH+]c2)n1 ZINC000346870020 1044167492 /nfs/dbraw/zinc/16/74/92/1044167492.db2.gz DKHRAQHFPOAFND-LBPRGKRZSA-N 1 2 314.414 4.045 20 0 DIADLO Cc1ccoc1C[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1C(C)C ZINC000292409701 1044170186 /nfs/dbraw/zinc/17/01/86/1044170186.db2.gz UMUJBNQXCBSCHH-OAHLLOKOSA-N 1 2 314.429 4.170 20 0 DIADLO Cc1ccoc1C[N@H+](C)[C@H](C)C(=O)Nc1ccccc1C(C)C ZINC000292409701 1044170198 /nfs/dbraw/zinc/17/01/98/1044170198.db2.gz UMUJBNQXCBSCHH-OAHLLOKOSA-N 1 2 314.429 4.170 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nncn1C(C)C ZINC000292551001 1044183446 /nfs/dbraw/zinc/18/34/46/1044183446.db2.gz YONQQOJEYDWSSY-OAHLLOKOSA-N 1 2 306.841 4.096 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nncn1C(C)C ZINC000292551001 1044183448 /nfs/dbraw/zinc/18/34/48/1044183448.db2.gz YONQQOJEYDWSSY-OAHLLOKOSA-N 1 2 306.841 4.096 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccc(Cl)cn1 ZINC000359647196 1044185239 /nfs/dbraw/zinc/18/52/39/1044185239.db2.gz UTWMLLFYADECOG-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1ncc(C3CC3)o1)[C@@H]2C ZINC000359637501 1044185836 /nfs/dbraw/zinc/18/58/36/1044185836.db2.gz QEGVRUWXPFQAGC-QWHCGFSZSA-N 1 2 312.413 4.068 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1ncc(C3CC3)o1)[C@@H]2C ZINC000359637501 1044185841 /nfs/dbraw/zinc/18/58/41/1044185841.db2.gz QEGVRUWXPFQAGC-QWHCGFSZSA-N 1 2 312.413 4.068 20 0 DIADLO Fc1cc(NCc2ccsc2Cl)ccc1-n1cc[nH+]c1 ZINC000359671368 1044188518 /nfs/dbraw/zinc/18/85/18/1044188518.db2.gz AYWOQOVNCZNRJI-UHFFFAOYSA-N 1 2 307.781 4.338 20 0 DIADLO Fc1cncc(C[N@H+](CCC(F)(F)F)Cc2ccccc2)c1 ZINC000347202394 1044206376 /nfs/dbraw/zinc/20/63/76/1044206376.db2.gz PFYCPPSMVGWVBC-UHFFFAOYSA-N 1 2 312.310 4.175 20 0 DIADLO Fc1cncc(C[N@@H+](CCC(F)(F)F)Cc2ccccc2)c1 ZINC000347202394 1044206383 /nfs/dbraw/zinc/20/63/83/1044206383.db2.gz PFYCPPSMVGWVBC-UHFFFAOYSA-N 1 2 312.310 4.175 20 0 DIADLO Cc1ccc(C[NH2+]Cc2nc(C(C)C)c[nH]2)c(OC(C)(C)C)c1 ZINC000883034321 1044216427 /nfs/dbraw/zinc/21/64/27/1044216427.db2.gz QYSMCRVLSJOZTD-UHFFFAOYSA-N 1 2 315.461 4.309 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)s1 ZINC000347263907 1044221085 /nfs/dbraw/zinc/22/10/85/1044221085.db2.gz HVYNAELKHORJFV-ZBEGNZNMSA-N 1 2 302.443 4.333 20 0 DIADLO Cc1ncc(C[N@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)s1 ZINC000347263907 1044221090 /nfs/dbraw/zinc/22/10/90/1044221090.db2.gz HVYNAELKHORJFV-ZBEGNZNMSA-N 1 2 302.443 4.333 20 0 DIADLO c1cn(-c2ccc(NCc3ccc(OCC4CC4)cc3)cc2)c[nH+]1 ZINC000359962829 1044222090 /nfs/dbraw/zinc/22/20/90/1044222090.db2.gz HDOJACGXUVKLNB-UHFFFAOYSA-N 1 2 319.408 4.273 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1cncs1 ZINC000934202276 1044230329 /nfs/dbraw/zinc/23/03/29/1044230329.db2.gz QNSHVSBSLPNESC-LLVKDONJSA-N 1 2 307.488 4.498 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[NH2+][C@H](C)c1cncs1 ZINC000934199009 1044231012 /nfs/dbraw/zinc/23/10/12/1044231012.db2.gz RRHHSIVBXSGQHG-SECBINFHSA-N 1 2 305.428 4.019 20 0 DIADLO CCC[C@@](C)([NH2+]Cc1ncn(-c2ccccc2)n1)c1ccccc1 ZINC000934181850 1044231066 /nfs/dbraw/zinc/23/10/66/1044231066.db2.gz GQVOHJYMTNTFQC-HXUWFJFHSA-N 1 2 320.440 4.072 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1noc2c1CCCC2)C(C)(C)C ZINC000934293451 1044234433 /nfs/dbraw/zinc/23/44/33/1044234433.db2.gz WBRABAWLNWEHAI-SFHVURJKSA-N 1 2 313.445 4.134 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nnc(C)s1)c1sccc1Cl ZINC000883215629 1044236478 /nfs/dbraw/zinc/23/64/78/1044236478.db2.gz CETUIBIWRYJFFW-OIBJUYFYSA-N 1 2 301.868 4.363 20 0 DIADLO COc1ccc(C2CC2)cc1C[NH2+]Cc1csc(C2CC2)n1 ZINC000883257410 1044248759 /nfs/dbraw/zinc/24/87/59/1044248759.db2.gz AOIFVJNUPYNFNB-UHFFFAOYSA-N 1 2 314.454 4.196 20 0 DIADLO Cc1csc(C[NH2+]Cc2ccc(Cl)cc2OC(C)C)n1 ZINC000883259140 1044250081 /nfs/dbraw/zinc/25/00/81/1044250081.db2.gz CPCOMMAVSUAMIL-UHFFFAOYSA-N 1 2 310.850 4.182 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C)[C@H](c3ccccc3)C(C)C)ccn12 ZINC000563382922 1044254572 /nfs/dbraw/zinc/25/45/72/1044254572.db2.gz LQVGFGFQQCCLED-IBGZPJMESA-N 1 2 321.424 4.112 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+][C@H]1C[C@@H](C)n2ccnc21 ZINC000883267617 1044255735 /nfs/dbraw/zinc/25/57/35/1044255735.db2.gz LFFPNKDCRBEUJS-DOMZBBRYSA-N 1 2 319.836 4.119 20 0 DIADLO Cc1[nH]c(CNc2ccc3nc(C(F)F)sc3c2)[nH+]c1C ZINC000563437873 1044261578 /nfs/dbraw/zinc/26/15/78/1044261578.db2.gz AXCMOCDOVDQXAP-UHFFFAOYSA-N 1 2 308.357 4.186 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cc(C)ccc2OC(F)F)s1 ZINC000293228159 1044262803 /nfs/dbraw/zinc/26/28/03/1044262803.db2.gz QGWHREOLURKVPD-NSHDSACASA-N 1 2 312.385 4.212 20 0 DIADLO c1cnc(C2([NH2+]Cc3cccc(C4CCCC4)c3)CCC2)nc1 ZINC000883304808 1044263139 /nfs/dbraw/zinc/26/31/39/1044263139.db2.gz GBUVSHBEPSKDQF-UHFFFAOYSA-N 1 2 307.441 4.303 20 0 DIADLO C[C@@H]([NH2+]C1(c2ncccn2)CCC1)c1cccc(C(F)(F)F)c1 ZINC000883314230 1044267786 /nfs/dbraw/zinc/26/77/86/1044267786.db2.gz YSHYNSIAFTYBDY-GFCCVEGCSA-N 1 2 321.346 4.225 20 0 DIADLO Cc1ccc(OC(F)F)c(C[NH2+]C(C)(C)c2nccs2)c1 ZINC000293347715 1044274432 /nfs/dbraw/zinc/27/44/32/1044274432.db2.gz XSJZTQWREQCQJO-UHFFFAOYSA-N 1 2 312.385 4.078 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc(Br)cn2)c[nH+]c1C ZINC000883342851 1044278656 /nfs/dbraw/zinc/27/86/56/1044278656.db2.gz OHYPKUYJRAPWGZ-LLVKDONJSA-N 1 2 306.207 4.029 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)c[nH+]c1C ZINC000883341913 1044280010 /nfs/dbraw/zinc/28/00/10/1044280010.db2.gz DSAOQHFPYFNWJT-AWEZNQCLSA-N 1 2 324.428 4.155 20 0 DIADLO Cc1ccc(C)c(C2CC[NH+](Cc3nc(C(F)F)no3)CC2)c1 ZINC000934798094 1044284427 /nfs/dbraw/zinc/28/44/27/1044284427.db2.gz ZNLAVKBRMPAACH-UHFFFAOYSA-N 1 2 321.371 4.004 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cn(C(C)C)nc1C ZINC000883377380 1044290411 /nfs/dbraw/zinc/29/04/11/1044290411.db2.gz GOLGUGZPACFXGD-UHFFFAOYSA-N 1 2 304.463 4.033 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1cnc(C(C)(C)C)s1)CCO2 ZINC000563655307 1044295954 /nfs/dbraw/zinc/29/59/54/1044295954.db2.gz JJUSXSKPXCHDTE-UHFFFAOYSA-N 1 2 316.470 4.144 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1cnc(C(C)(C)C)s1)CCO2 ZINC000563655307 1044295969 /nfs/dbraw/zinc/29/59/69/1044295969.db2.gz JJUSXSKPXCHDTE-UHFFFAOYSA-N 1 2 316.470 4.144 20 0 DIADLO CCCCc1noc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)n1 ZINC000121255444 1044300390 /nfs/dbraw/zinc/30/03/90/1044300390.db2.gz XPOYVBLZIMLCDS-CQSZACIVSA-N 1 2 303.406 4.123 20 0 DIADLO CCCCc1noc(C[N@H+]2CCCCC[C@@H]2c2ccco2)n1 ZINC000121255444 1044300401 /nfs/dbraw/zinc/30/04/01/1044300401.db2.gz XPOYVBLZIMLCDS-CQSZACIVSA-N 1 2 303.406 4.123 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000360725704 1044305177 /nfs/dbraw/zinc/30/51/77/1044305177.db2.gz MQLXHNXCGJXGGK-BXKDBHETSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1csc(C2CC2)n1 ZINC000360725704 1044305190 /nfs/dbraw/zinc/30/51/90/1044305190.db2.gz MQLXHNXCGJXGGK-BXKDBHETSA-N 1 2 304.381 4.183 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cccc(O)c3Cl)CCCC2)n1 ZINC000293633936 1044306606 /nfs/dbraw/zinc/30/66/06/1044306606.db2.gz RHLLXGYASYNXSE-UHFFFAOYSA-N 1 2 322.861 4.370 20 0 DIADLO Cc1ccc2c(Nc3cccc(Br)n3)cccc2[nH+]1 ZINC001212794075 1044310121 /nfs/dbraw/zinc/31/01/21/1044310121.db2.gz ICLROPUITWHQNH-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO CC1(C)Nc2ccccc2[C@H]1[NH2+]Cc1c(Cl)cncc1Cl ZINC000883464739 1044310809 /nfs/dbraw/zinc/31/08/09/1044310809.db2.gz VIKABRXGVSZTRI-OAHLLOKOSA-N 1 2 322.239 4.423 20 0 DIADLO CCCCc1nc(C[N@H+](C)[C@@H](C)Cc2ccc(Cl)cc2)no1 ZINC000523010208 1044315808 /nfs/dbraw/zinc/31/58/08/1044315808.db2.gz ZAGVZMILQLWRND-ZDUSSCGKSA-N 1 2 321.852 4.129 20 0 DIADLO CCCCc1nc(C[N@@H+](C)[C@@H](C)Cc2ccc(Cl)cc2)no1 ZINC000523010208 1044315818 /nfs/dbraw/zinc/31/58/18/1044315818.db2.gz ZAGVZMILQLWRND-ZDUSSCGKSA-N 1 2 321.852 4.129 20 0 DIADLO Cc1ccc2c(Nc3ccc(Br)nc3)cccc2[nH+]1 ZINC001212795167 1044320467 /nfs/dbraw/zinc/32/04/67/1044320467.db2.gz RVVSXEFOKBHABB-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO CC(=O)Nc1ccc([C@@H](C)[NH2+]CC(F)(F)c2ccccc2)cc1 ZINC000564009088 1044330470 /nfs/dbraw/zinc/33/04/70/1044330470.db2.gz VVMZXYDPZIUXCI-CYBMUJFWSA-N 1 2 318.367 4.088 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1c[nH]c(-c2ccccc2)n1 ZINC000475293476 1044343712 /nfs/dbraw/zinc/34/37/12/1044343712.db2.gz KPJRRLLUIYTPCA-UHFFFAOYSA-N 1 2 323.465 4.431 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1c[nH]c(-c2ccccc2)n1 ZINC000475293476 1044343728 /nfs/dbraw/zinc/34/37/28/1044343728.db2.gz KPJRRLLUIYTPCA-UHFFFAOYSA-N 1 2 323.465 4.431 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC000475293476 1044343743 /nfs/dbraw/zinc/34/37/43/1044343743.db2.gz KPJRRLLUIYTPCA-UHFFFAOYSA-N 1 2 323.465 4.431 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1cnc(-c2ccccc2)[nH]1 ZINC000475293476 1044343757 /nfs/dbraw/zinc/34/37/57/1044343757.db2.gz KPJRRLLUIYTPCA-UHFFFAOYSA-N 1 2 323.465 4.431 20 0 DIADLO CCc1ccc(-c2noc(C[NH2+][C@@H](C)c3ccccc3)n2)cc1 ZINC000102676838 1044344580 /nfs/dbraw/zinc/34/45/80/1044344580.db2.gz IXYXMNMAXBVQRG-AWEZNQCLSA-N 1 2 307.397 4.150 20 0 DIADLO Cc1ccc2c(Nc3cnc4cc(C(C)C)nn4c3)cccc2[nH+]1 ZINC001212796905 1044348462 /nfs/dbraw/zinc/34/84/62/1044348462.db2.gz LVQGJPHVRLNDEL-UHFFFAOYSA-N 1 2 317.396 4.453 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1c(C3CC3)nc3sccn13)C2 ZINC000361107483 1044360155 /nfs/dbraw/zinc/36/01/55/1044360155.db2.gz AQQBYZMCIJQFHV-UHFFFAOYSA-N 1 2 309.438 4.097 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1c(C3CC3)nc3sccn13)C2 ZINC000361107483 1044360174 /nfs/dbraw/zinc/36/01/74/1044360174.db2.gz AQQBYZMCIJQFHV-UHFFFAOYSA-N 1 2 309.438 4.097 20 0 DIADLO CCO[C@H](C)c1nc(C[NH2+][C@@H](C)c2ccncc2CC)cs1 ZINC000361119753 1044363342 /nfs/dbraw/zinc/36/33/42/1044363342.db2.gz MFZVNQOWYJPQSM-QWHCGFSZSA-N 1 2 319.474 4.049 20 0 DIADLO C[C@H](c1noc(-c2cccc(Cn3cc[nH+]c3)c2)n1)C(C)(C)C ZINC000564250533 1044364990 /nfs/dbraw/zinc/36/49/90/1044364990.db2.gz GMLATGAQSVWKLM-CYBMUJFWSA-N 1 2 310.401 4.131 20 0 DIADLO Cc1ccc2c(Nc3ccc4c(c3)NC(=O)CC4)cccc2[nH+]1 ZINC001212797641 1044366244 /nfs/dbraw/zinc/36/62/44/1044366244.db2.gz BDVMEXMLDXIUKX-UHFFFAOYSA-N 1 2 303.365 4.172 20 0 DIADLO COc1ccsc1C[NH2+][C@H](c1ccc(C)cc1)c1ccccn1 ZINC000475338817 1044369260 /nfs/dbraw/zinc/36/92/60/1044369260.db2.gz STUYGCHTGFCJOT-LJQANCHMSA-N 1 2 324.449 4.339 20 0 DIADLO O=C(N[C@H]1CCCCC12CCCC2)c1ccc(-n2cc[nH+]c2)cc1 ZINC000361191041 1044372126 /nfs/dbraw/zinc/37/21/26/1044372126.db2.gz QNYSODLMGATRFP-SFHVURJKSA-N 1 2 323.440 4.105 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2cc(C)cc(C)c2)n1 ZINC000107071886 1044374190 /nfs/dbraw/zinc/37/41/90/1044374190.db2.gz RUDBCCYUNZPOBC-HUUCEWRRSA-N 1 2 301.434 4.441 20 0 DIADLO Fc1ccc(F)c2c1OCC[C@H]2[NH2+]Cc1sccc1Cl ZINC000361254601 1044379302 /nfs/dbraw/zinc/37/93/02/1044379302.db2.gz ZQTKQOGKHNOSNO-LLVKDONJSA-N 1 2 315.772 4.293 20 0 DIADLO CSC1(CNc2ccc(-n3c[nH+]c(C)c3C)cc2)CCC1 ZINC000361249033 1044381633 /nfs/dbraw/zinc/38/16/33/1044381633.db2.gz FLFBLMYHQVLTAL-UHFFFAOYSA-N 1 2 301.459 4.187 20 0 DIADLO Cc1[nH]ncc1C[NH2+]Cc1sc2c(cccc2Cl)c1C ZINC000294171857 1044388251 /nfs/dbraw/zinc/38/82/51/1044388251.db2.gz PYYBIQQWBXAHQH-UHFFFAOYSA-N 1 2 305.834 4.184 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@@H](CC)c2c(C)noc2C)n1 ZINC000348282310 1044396529 /nfs/dbraw/zinc/39/65/29/1044396529.db2.gz PWQSVRHOEQMEEQ-INIZCTEOSA-N 1 2 304.438 4.090 20 0 DIADLO CCCC(=O)Nc1cccc(C[NH2+][C@@H](C)c2csc(C)n2)c1 ZINC000564658053 1044397508 /nfs/dbraw/zinc/39/75/08/1044397508.db2.gz ODBZKYDNENSSKV-LBPRGKRZSA-N 1 2 317.458 4.041 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1cc(C)on1)c1ccccc1OC(F)F ZINC000282878791 1044397683 /nfs/dbraw/zinc/39/76/83/1044397683.db2.gz VOFWBCKLDNCCJC-DGCLKSJQSA-N 1 2 310.344 4.386 20 0 DIADLO Cn1ncc(Cl)c1C[N@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC000475431738 1044397802 /nfs/dbraw/zinc/39/78/02/1044397802.db2.gz APTVEZXZMNPHAQ-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1ncc(Cl)c1C[N@@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC000475431738 1044397810 /nfs/dbraw/zinc/39/78/10/1044397810.db2.gz APTVEZXZMNPHAQ-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO CC(=O)Nc1cccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000192903427 1044398567 /nfs/dbraw/zinc/39/85/67/1044398567.db2.gz SEEFYSDOLAHJRJ-CQSZACIVSA-N 1 2 320.396 4.004 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2ncc(CSC)s2)cc1 ZINC000294336706 1044408387 /nfs/dbraw/zinc/40/83/87/1044408387.db2.gz AJCMZTLGWDQPEY-LBPRGKRZSA-N 1 2 322.499 4.208 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2ncc(CSC)s2)cc1 ZINC000294336706 1044408391 /nfs/dbraw/zinc/40/83/91/1044408391.db2.gz AJCMZTLGWDQPEY-LBPRGKRZSA-N 1 2 322.499 4.208 20 0 DIADLO Cc1ccc([C@@H](c2noc(C[C@H](C)n3cc[nH+]c3)n2)C(C)C)cc1 ZINC000565063111 1044413234 /nfs/dbraw/zinc/41/32/34/1044413234.db2.gz RKIGLIZPLUPFQH-YJBOKZPZSA-N 1 2 324.428 4.166 20 0 DIADLO Cc1ccc([C@@H](C)C[NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)cc1 ZINC000565131386 1044416784 /nfs/dbraw/zinc/41/67/84/1044416784.db2.gz CFHIUXWWDKGOFB-MAUKXSAKSA-N 1 2 312.461 4.128 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1nccn1-c1ccccc1 ZINC000361607663 1044425735 /nfs/dbraw/zinc/42/57/35/1044425735.db2.gz DAOAEFGRWMXEFK-ZFWWWQNUSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1nccn1-c1ccccc1 ZINC000361607663 1044425739 /nfs/dbraw/zinc/42/57/39/1044425739.db2.gz DAOAEFGRWMXEFK-ZFWWWQNUSA-N 1 2 323.362 4.035 20 0 DIADLO CC(C)n1ccnc1C[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000111241978 1044431904 /nfs/dbraw/zinc/43/19/04/1044431904.db2.gz LESWRYZZBQVDHA-FQEVSTJZSA-N 1 2 323.415 4.482 20 0 DIADLO CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000565392984 1044431942 /nfs/dbraw/zinc/43/19/42/1044431942.db2.gz QCUXZUVWXZSUIH-RHSMWYFYSA-N 1 2 305.368 4.144 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1ncc(C(C)(C)C)o1)CCC2 ZINC000111311770 1044433491 /nfs/dbraw/zinc/43/34/91/1044433491.db2.gz PDBXDTRMIPJVCT-ZDUSSCGKSA-N 1 2 319.474 4.246 20 0 DIADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ncc(C(C)(C)C)o1)CCC2 ZINC000111311770 1044433495 /nfs/dbraw/zinc/43/34/95/1044433495.db2.gz PDBXDTRMIPJVCT-ZDUSSCGKSA-N 1 2 319.474 4.246 20 0 DIADLO Cc1ccc(-c2nc(CO[NH+]=C(N)c3ccccc3C)co2)cc1 ZINC000884084233 1044433829 /nfs/dbraw/zinc/43/38/29/1044433829.db2.gz KTVFWGOVAFVBAN-UHFFFAOYSA-N 1 2 321.380 4.005 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)s1 ZINC000565619388 1044446302 /nfs/dbraw/zinc/44/63/02/1044446302.db2.gz GXYJAFBTZJRFHJ-CYBMUJFWSA-N 1 2 324.453 4.013 20 0 DIADLO Cc1ccc2c(Nc3ccc4c(c3)C(=O)NC4(C)C)cccc2[nH+]1 ZINC001212798718 1044454046 /nfs/dbraw/zinc/45/40/46/1044454046.db2.gz OTTHYZXFXCXAMX-UHFFFAOYSA-N 1 2 317.392 4.265 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc(O)c2Cl)o1 ZINC000294828702 1044463832 /nfs/dbraw/zinc/46/38/32/1044463832.db2.gz YHJNBOHLMNJQHA-AWEZNQCLSA-N 1 2 321.804 4.122 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cccc(O)c2Cl)o1 ZINC000294828702 1044463837 /nfs/dbraw/zinc/46/38/37/1044463837.db2.gz YHJNBOHLMNJQHA-AWEZNQCLSA-N 1 2 321.804 4.122 20 0 DIADLO Cc1cc(N[C@H](c2nccs2)c2ccccc2)nc(C2CC2)[nH+]1 ZINC000116260929 1044469135 /nfs/dbraw/zinc/46/91/35/1044469135.db2.gz YRYSCKDMTBUCAP-INIZCTEOSA-N 1 2 322.437 4.320 20 0 DIADLO C[C@H](c1ccc(C[N@H+](C)Cc2nccs2)cc1)C(F)(F)F ZINC000294945514 1044475361 /nfs/dbraw/zinc/47/53/61/1044475361.db2.gz KAFSOWABKGDGCV-LLVKDONJSA-N 1 2 314.376 4.441 20 0 DIADLO C[C@H](c1ccc(C[N@@H+](C)Cc2nccs2)cc1)C(F)(F)F ZINC000294945514 1044475372 /nfs/dbraw/zinc/47/53/72/1044475372.db2.gz KAFSOWABKGDGCV-LLVKDONJSA-N 1 2 314.376 4.441 20 0 DIADLO C[C@@H]1C[C@@H](c2cccnc2)N(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000566149073 1044475870 /nfs/dbraw/zinc/47/58/70/1044475870.db2.gz HKCMPDRWGCSXBD-ACJLOTCBSA-N 1 2 307.372 4.356 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)N(c2[nH+]ccc3cc(F)ccc32)C1 ZINC000566149077 1044477291 /nfs/dbraw/zinc/47/72/91/1044477291.db2.gz HKCMPDRWGCSXBD-FZKQIMNGSA-N 1 2 307.372 4.356 20 0 DIADLO c1n[nH]c([C@@H]([NH2+]C[C@@H](c2ccccc2)C2CC2)C2CCCCC2)n1 ZINC000566350737 1044484801 /nfs/dbraw/zinc/48/48/01/1044484801.db2.gz ODUIEDHOOIWFSB-OALUTQOASA-N 1 2 324.472 4.210 20 0 DIADLO Cc1cccnc1[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)C(C)C ZINC000118839646 1044488148 /nfs/dbraw/zinc/48/81/48/1044488148.db2.gz MCBHONIPCMOSBU-MRXNPFEDSA-N 1 2 301.434 4.162 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nccn1-c1ccccc1)c1ccc(F)cn1 ZINC000348313229 1044489441 /nfs/dbraw/zinc/48/94/41/1044489441.db2.gz GNNMUMHZZWMPEO-WMLDXEAASA-N 1 2 324.403 4.208 20 0 DIADLO CCc1ccccc1NC(=O)C[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000119233351 1044491796 /nfs/dbraw/zinc/49/17/96/1044491796.db2.gz ILYIGWWOOHTHSI-AWEZNQCLSA-N 1 2 312.413 4.006 20 0 DIADLO CCc1ccccc1NC(=O)C[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000119233351 1044491800 /nfs/dbraw/zinc/49/18/00/1044491800.db2.gz ILYIGWWOOHTHSI-AWEZNQCLSA-N 1 2 312.413 4.006 20 0 DIADLO CC[C@H](Cc1ccc(C)cc1)Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000566528887 1044495794 /nfs/dbraw/zinc/49/57/94/1044495794.db2.gz BIGVWBREGSKVNC-LJQANCHMSA-N 1 2 320.440 4.068 20 0 DIADLO CC(C)CCCO[C@H]1CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC001205977126 1044498430 /nfs/dbraw/zinc/49/84/30/1044498430.db2.gz SKTIQVCTPRGIIM-ZDUSSCGKSA-N 1 2 316.898 4.214 20 0 DIADLO CC(C)CCCO[C@H]1CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC001205977126 1044498435 /nfs/dbraw/zinc/49/84/35/1044498435.db2.gz SKTIQVCTPRGIIM-ZDUSSCGKSA-N 1 2 316.898 4.214 20 0 DIADLO COc1cc(C[N@H+](C)Cc2nc(-c3ccccc3)c[nH]2)ccc1C ZINC000362322176 1044501590 /nfs/dbraw/zinc/50/15/90/1044501590.db2.gz LVWTUVNFNKOOMF-UHFFFAOYSA-N 1 2 321.424 4.026 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2nc(-c3ccccc3)c[nH]2)ccc1C ZINC000362322176 1044501604 /nfs/dbraw/zinc/50/16/04/1044501604.db2.gz LVWTUVNFNKOOMF-UHFFFAOYSA-N 1 2 321.424 4.026 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1CCCCC1(F)F ZINC000295221974 1044502413 /nfs/dbraw/zinc/50/24/13/1044502413.db2.gz VUJKVYCRZKLZEC-ZDUSSCGKSA-N 1 2 319.355 4.149 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)C)no2)c1 ZINC000120238449 1044502312 /nfs/dbraw/zinc/50/23/12/1044502312.db2.gz HVRSXEZENBZZAX-KBPBESRZSA-N 1 2 317.433 4.392 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2cn3ccsc3n2)o1 ZINC000362436305 1044511148 /nfs/dbraw/zinc/51/11/48/1044511148.db2.gz ZWXPYRHYPLLPGT-SWLSCSKDSA-N 1 2 315.442 4.270 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2cn3ccsc3n2)o1 ZINC000362436305 1044511163 /nfs/dbraw/zinc/51/11/63/1044511163.db2.gz ZWXPYRHYPLLPGT-SWLSCSKDSA-N 1 2 315.442 4.270 20 0 DIADLO COc1ccc2nc(C[N@@H+]3CC[C@H]3c3ccccc3)sc2c1 ZINC000475573670 1044511933 /nfs/dbraw/zinc/51/19/33/1044511933.db2.gz MLQKQUJLPKGMIQ-INIZCTEOSA-N 1 2 310.422 4.252 20 0 DIADLO COc1ccc2nc(C[N@H+]3CC[C@H]3c3ccccc3)sc2c1 ZINC000475573670 1044511949 /nfs/dbraw/zinc/51/19/49/1044511949.db2.gz MLQKQUJLPKGMIQ-INIZCTEOSA-N 1 2 310.422 4.252 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000566776742 1044515743 /nfs/dbraw/zinc/51/57/43/1044515743.db2.gz DTSMKXWVDOQTAA-NSHDSACASA-N 1 2 307.388 4.178 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000566776742 1044515759 /nfs/dbraw/zinc/51/57/59/1044515759.db2.gz DTSMKXWVDOQTAA-NSHDSACASA-N 1 2 307.388 4.178 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1ccc(Cl)cn1)[C@@H]2C ZINC000566934327 1044528973 /nfs/dbraw/zinc/52/89/73/1044528973.db2.gz GDVZABWIVYNXNQ-QWHCGFSZSA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1ccc(Cl)cn1)[C@@H]2C ZINC000566934327 1044528991 /nfs/dbraw/zinc/52/89/91/1044528991.db2.gz GDVZABWIVYNXNQ-QWHCGFSZSA-N 1 2 316.832 4.251 20 0 DIADLO CCCC[C@@H](CCC)C[NH2+][C@H](c1nnc[nH]1)c1ccccc1 ZINC000567142187 1044546256 /nfs/dbraw/zinc/54/62/56/1044546256.db2.gz HVHUUNWULCFCSQ-WBVHZDCISA-N 1 2 300.450 4.090 20 0 DIADLO Cc1ccc(-c2noc([C@@H](C)[NH2+]Cc3ccsc3)n2)cc1F ZINC000567176122 1044549498 /nfs/dbraw/zinc/54/94/98/1044549498.db2.gz JZBQXTRJXPEUKH-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ccc(-c2noc([C@H](C)[NH2+]Cc3ccsc3)n2)cc1F ZINC000567176123 1044549695 /nfs/dbraw/zinc/54/96/95/1044549695.db2.gz JZBQXTRJXPEUKH-NSHDSACASA-N 1 2 317.389 4.096 20 0 DIADLO CCC1(CC)CCN(C(=O)Nc2ccc3[nH+]c(C)cn3c2)CC1 ZINC000362856948 1044556409 /nfs/dbraw/zinc/55/64/09/1044556409.db2.gz UNKMDFADKIDZTP-UHFFFAOYSA-N 1 2 314.433 4.077 20 0 DIADLO CC(C)c1nnc(C[NH+]2CCC(c3ccsc3)CC2)s1 ZINC000295759441 1044556527 /nfs/dbraw/zinc/55/65/27/1044556527.db2.gz OTEVNMQTRBRPMY-UHFFFAOYSA-N 1 2 307.488 4.103 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+]CC2CC(F)(F)C2)C(F)F)c1 ZINC000567290882 1044556905 /nfs/dbraw/zinc/55/69/05/1044556905.db2.gz OKQFCVIEHFSUIY-AWEZNQCLSA-N 1 2 319.342 4.415 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c1C ZINC000115602712 1044559417 /nfs/dbraw/zinc/55/94/17/1044559417.db2.gz AJEJJGGYKCFJKN-KBPBESRZSA-N 1 2 301.434 4.396 20 0 DIADLO CC[C@@H](C)c1nnc([C@@H](C)[NH2+]Cc2cc3cc(F)ccc3o2)[nH]1 ZINC000362932866 1044567635 /nfs/dbraw/zinc/56/76/35/1044567635.db2.gz ZGFDKDJCJWZUBQ-GHMZBOCLSA-N 1 2 316.380 4.054 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1ccccc1Br ZINC000295977028 1044578239 /nfs/dbraw/zinc/57/82/39/1044578239.db2.gz MZTJVOUWMXHJTM-RYUDHWBXSA-N 1 2 322.250 4.077 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CCc4cc(F)c(F)cc4C3)ccc2c1 ZINC001137219556 1044586260 /nfs/dbraw/zinc/58/62/60/1044586260.db2.gz JIEPYOZOPMOEIE-UHFFFAOYSA-N 1 2 324.374 4.380 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CCc4cc(F)c(F)cc4C3)ccc2c1 ZINC001137219556 1044586272 /nfs/dbraw/zinc/58/62/72/1044586272.db2.gz JIEPYOZOPMOEIE-UHFFFAOYSA-N 1 2 324.374 4.380 20 0 DIADLO c1cn(Cc2cccc(-c3nc(C4CCCCCC4)no3)c2)c[nH+]1 ZINC000567882870 1044587858 /nfs/dbraw/zinc/58/78/58/1044587858.db2.gz DZZZMXVCLAROFI-UHFFFAOYSA-N 1 2 322.412 4.419 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H]2CC[C@H]3CCC[C@H]3C2)c(C)[nH+]1 ZINC000567849579 1044588352 /nfs/dbraw/zinc/58/83/52/1044588352.db2.gz JQDWICVOOQNEMQ-OWCLPIDISA-N 1 2 301.434 4.097 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000363210187 1044595014 /nfs/dbraw/zinc/59/50/14/1044595014.db2.gz CXZJTWIJNLCWOX-ZDUSSCGKSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1occc1C[N@H+](C)[C@@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000363210187 1044595023 /nfs/dbraw/zinc/59/50/23/1044595023.db2.gz CXZJTWIJNLCWOX-ZDUSSCGKSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1[nH]nc(CNc2cccc(Cn3cc[nH+]c3C(C)C)c2)c1C ZINC000885933568 1044595389 /nfs/dbraw/zinc/59/53/89/1044595389.db2.gz XSWXGWDUGDXSTQ-UHFFFAOYSA-N 1 2 323.444 4.007 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ncc(C(F)(F)F)cn1)c1ccsc1 ZINC000296304622 1044604928 /nfs/dbraw/zinc/60/49/28/1044604928.db2.gz GBMJSONMCPUZTR-GFCCVEGCSA-N 1 2 315.364 4.188 20 0 DIADLO C[N@H+](CCOc1ccccc1Cl)Cc1cc(C(C)(C)C)on1 ZINC000568141485 1044605693 /nfs/dbraw/zinc/60/56/93/1044605693.db2.gz KRNRMUQDFYOZFG-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO C[N@@H+](CCOc1ccccc1Cl)Cc1cc(C(C)(C)C)on1 ZINC000568141485 1044605704 /nfs/dbraw/zinc/60/57/04/1044605704.db2.gz KRNRMUQDFYOZFG-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)Cc2nc(-c3ccsc3)no2)c1 ZINC000444704360 1044609125 /nfs/dbraw/zinc/60/91/25/1044609125.db2.gz KXKXTWOIKVWNQA-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)Cc2nc(-c3ccsc3)no2)c1 ZINC000444704360 1044609136 /nfs/dbraw/zinc/60/91/36/1044609136.db2.gz KXKXTWOIKVWNQA-UHFFFAOYSA-N 1 2 313.426 4.047 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)[nH]1 ZINC000296386450 1044614733 /nfs/dbraw/zinc/61/47/33/1044614733.db2.gz JWMHPIMIGNTLRV-OAHLLOKOSA-N 1 2 324.831 4.208 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1ccn(-c2ccccc2)n1 ZINC000523347819 1044616392 /nfs/dbraw/zinc/61/63/92/1044616392.db2.gz LKOOQLUANFHFGE-HNNXBMFYSA-N 1 2 309.388 4.204 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccn(-c2ccccc2)n1 ZINC000523347819 1044616399 /nfs/dbraw/zinc/61/63/99/1044616399.db2.gz LKOOQLUANFHFGE-HNNXBMFYSA-N 1 2 309.388 4.204 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[N@H+](C)Cc1ccco1 ZINC000053065824 1044616572 /nfs/dbraw/zinc/61/65/72/1044616572.db2.gz CEVJEXVJYABIPA-OAHLLOKOSA-N 1 2 314.429 4.170 20 0 DIADLO Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccco1 ZINC000053065824 1044616582 /nfs/dbraw/zinc/61/65/82/1044616582.db2.gz CEVJEXVJYABIPA-OAHLLOKOSA-N 1 2 314.429 4.170 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)nn1C ZINC000444788815 1044631088 /nfs/dbraw/zinc/63/10/88/1044631088.db2.gz AYRCUOAMDYAUNZ-KRWDZBQOSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)nn1C ZINC000444788815 1044631091 /nfs/dbraw/zinc/63/10/91/1044631091.db2.gz AYRCUOAMDYAUNZ-KRWDZBQOSA-N 1 2 303.837 4.109 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2nnc(C(C)C)s2)c1 ZINC000296652856 1044640473 /nfs/dbraw/zinc/64/04/73/1044640473.db2.gz XNOKUFKZVODOTG-OAHLLOKOSA-N 1 2 317.458 4.007 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2nnc(C(C)C)s2)c1 ZINC000296652856 1044640484 /nfs/dbraw/zinc/64/04/84/1044640484.db2.gz XNOKUFKZVODOTG-OAHLLOKOSA-N 1 2 317.458 4.007 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1ccccc1Br ZINC000067960925 1044646915 /nfs/dbraw/zinc/64/69/15/1044646915.db2.gz NHXIEIVGYNDMKI-GFCCVEGCSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccccc1Br ZINC000067960925 1044646923 /nfs/dbraw/zinc/64/69/23/1044646923.db2.gz NHXIEIVGYNDMKI-GFCCVEGCSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1sccc1Br)c1cscn1 ZINC000568783143 1044648579 /nfs/dbraw/zinc/64/85/79/1044648579.db2.gz NWEAILQBIZWHFW-YUMQZZPRSA-N 1 2 317.277 4.379 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@H]1CCCc2c3cccc(Cl)c3[nH]c21 ZINC000886550412 1044659118 /nfs/dbraw/zinc/65/91/18/1044659118.db2.gz ZKMUXWKVAOJGMJ-HNNXBMFYSA-N 1 2 314.820 4.020 20 0 DIADLO C[C@H]([NH2+]Cc1ncoc1-c1ccccc1)c1ccc(F)cc1F ZINC000364492003 1044667278 /nfs/dbraw/zinc/66/72/78/1044667278.db2.gz DJRQSLZUANWBOP-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)CSC(C)(C)C)c2)[nH+]c1C ZINC000364550703 1044668614 /nfs/dbraw/zinc/66/86/14/1044668614.db2.gz OYMMXMBJZOUDPZ-UHFFFAOYSA-N 1 2 317.458 4.164 20 0 DIADLO CCCCN(CCCC)C(=O)[C@@H]1CCc2[nH+]c(C(C)C)[nH]c2C1 ZINC000364539672 1044668720 /nfs/dbraw/zinc/66/87/20/1044668720.db2.gz SCHWCDRZCIGODY-OAHLLOKOSA-N 1 2 319.493 4.067 20 0 DIADLO CCCCN(CCCC)C(=O)[C@@H]1CCc2[nH]c(C(C)C)[nH+]c2C1 ZINC000364539672 1044668722 /nfs/dbraw/zinc/66/87/22/1044668722.db2.gz SCHWCDRZCIGODY-OAHLLOKOSA-N 1 2 319.493 4.067 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000364642410 1044671894 /nfs/dbraw/zinc/67/18/94/1044671894.db2.gz RCVDWXOXUSQKQU-MAUKXSAKSA-N 1 2 305.466 4.112 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000364642409 1044672422 /nfs/dbraw/zinc/67/24/22/1044672422.db2.gz RCVDWXOXUSQKQU-CRAIPNDOSA-N 1 2 305.466 4.112 20 0 DIADLO COc1ccc([C@H](C)[NH2+]Cc2cc(C3CC3)no2)c(Cl)c1 ZINC000886683910 1044678797 /nfs/dbraw/zinc/67/87/97/1044678797.db2.gz AJTYBJZHXVLYOX-JTQLQIEISA-N 1 2 306.793 4.065 20 0 DIADLO Fc1ccc2c(c1Cl)[C@H]([NH2+]Cc1cc(C3CC3)no1)CC2 ZINC000886684736 1044679092 /nfs/dbraw/zinc/67/90/92/1044679092.db2.gz RDAURXIDVODMLW-CYBMUJFWSA-N 1 2 306.768 4.122 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1ccc(-c2ccccc2)cn1 ZINC000886684376 1044679146 /nfs/dbraw/zinc/67/91/46/1044679146.db2.gz KFFRWSJKMDOWSI-CQSZACIVSA-N 1 2 319.408 4.465 20 0 DIADLO Fc1cccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1F ZINC000523760275 1044683160 /nfs/dbraw/zinc/68/31/60/1044683160.db2.gz MGHKJIWQTPHJHQ-MRXNPFEDSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1cccc(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1F ZINC000523760275 1044683165 /nfs/dbraw/zinc/68/31/65/1044683165.db2.gz MGHKJIWQTPHJHQ-MRXNPFEDSA-N 1 2 305.393 4.255 20 0 DIADLO C[NH+](C)[C@@H](c1nc([C@@H]2CCCC(C)(C)C2)no1)c1ccccc1 ZINC000569272881 1044689384 /nfs/dbraw/zinc/68/93/84/1044689384.db2.gz ILQLGVKMKAONRP-HZPDHXFCSA-N 1 2 313.445 4.404 20 0 DIADLO FC(F)(F)C1CC[NH+](Cc2coc(-c3ccccc3)n2)CC1 ZINC000075969302 1044690491 /nfs/dbraw/zinc/69/04/91/1044690491.db2.gz LWVCSMZHLNWQJV-UHFFFAOYSA-N 1 2 310.319 4.116 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000365457869 1044691808 /nfs/dbraw/zinc/69/18/08/1044691808.db2.gz IIFKMWLWKZYNKO-SJORKVTESA-N 1 2 319.493 4.123 20 0 DIADLO Cc1cc(N(C)Cc2cccc3ccccc32)nc(C2CC2)[nH+]1 ZINC000523874414 1044699569 /nfs/dbraw/zinc/69/95/69/1044699569.db2.gz IXBPHXPTSPGLGP-UHFFFAOYSA-N 1 2 303.409 4.452 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCc2c1cccc2F)c1ncc(C(C)(C)C)o1 ZINC000886926559 1044719246 /nfs/dbraw/zinc/71/92/46/1044719246.db2.gz STSKGKSPLOJBJN-XHDPSFHLSA-N 1 2 302.393 4.449 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2c1cccc2F)c1nc(-c2ccccc2)no1 ZINC000886920628 1044719891 /nfs/dbraw/zinc/71/98/91/1044719891.db2.gz DZDAKVSTCNWRRZ-PXAZEXFGSA-N 1 2 323.371 4.214 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(C)cc2OC(C)(C)C)cs1 ZINC000084958655 1044726176 /nfs/dbraw/zinc/72/61/76/1044726176.db2.gz CAADGZVCGSSELO-UHFFFAOYSA-N 1 2 304.459 4.227 20 0 DIADLO Cc1ccc(C)c(NC(=O)C[N@@H+]([C@@H](C)c2ccco2)C2CC2)c1 ZINC000086233018 1044730229 /nfs/dbraw/zinc/73/02/29/1044730229.db2.gz UQOOASUEPYSYSF-HNNXBMFYSA-N 1 2 312.413 4.061 20 0 DIADLO Cc1ccc(C)c(NC(=O)C[N@H+]([C@@H](C)c2ccco2)C2CC2)c1 ZINC000086233018 1044730242 /nfs/dbraw/zinc/73/02/42/1044730242.db2.gz UQOOASUEPYSYSF-HNNXBMFYSA-N 1 2 312.413 4.061 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CCC(C)=C(c3ccco3)C2)cs1 ZINC000367220376 1044735885 /nfs/dbraw/zinc/73/58/85/1044735885.db2.gz UISNUXFNOQTBNG-ZDUSSCGKSA-N 1 2 318.442 4.123 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CCC(C)=C(c3ccco3)C2)cs1 ZINC000367220376 1044735903 /nfs/dbraw/zinc/73/59/03/1044735903.db2.gz UISNUXFNOQTBNG-ZDUSSCGKSA-N 1 2 318.442 4.123 20 0 DIADLO Oc1cccc2ccc(/C=C/c3c[nH+]c4ccc(Cl)cn34)nc12 ZINC000524104057 1044737688 /nfs/dbraw/zinc/73/76/88/1044737688.db2.gz VIHAOWPAIVCZRA-BQYQJAHWSA-N 1 2 321.767 4.412 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)s1 ZINC000367299280 1044737549 /nfs/dbraw/zinc/73/75/49/1044737549.db2.gz OTDXMWJSADRQNR-NSHDSACASA-N 1 2 319.861 4.350 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)s1 ZINC000367299280 1044737559 /nfs/dbraw/zinc/73/75/59/1044737559.db2.gz OTDXMWJSADRQNR-NSHDSACASA-N 1 2 319.861 4.350 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CC[C@H](OC(F)F)C1 ZINC000570227849 1044742187 /nfs/dbraw/zinc/74/21/87/1044742187.db2.gz RJMMJUGLPSQTPJ-SCZZXKLOSA-N 1 2 310.171 4.368 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CC[C@H](OC(F)F)C1 ZINC000570227849 1044742196 /nfs/dbraw/zinc/74/21/96/1044742196.db2.gz RJMMJUGLPSQTPJ-SCZZXKLOSA-N 1 2 310.171 4.368 20 0 DIADLO CC(C)n1cc(C[N@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)nn1 ZINC000570246268 1044744637 /nfs/dbraw/zinc/74/46/37/1044744637.db2.gz DPODLXSLQFTTGB-ZDUSSCGKSA-N 1 2 318.852 4.238 20 0 DIADLO CC(C)n1cc(C[N@@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)nn1 ZINC000570246268 1044744651 /nfs/dbraw/zinc/74/46/51/1044744651.db2.gz DPODLXSLQFTTGB-ZDUSSCGKSA-N 1 2 318.852 4.238 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1nccn1Cc1ccccc1 ZINC000524164967 1044756979 /nfs/dbraw/zinc/75/69/79/1044756979.db2.gz FZHDPVSTJUPOKZ-MRXNPFEDSA-N 1 2 323.415 4.264 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1nccn1Cc1ccccc1 ZINC000524164967 1044756997 /nfs/dbraw/zinc/75/69/97/1044756997.db2.gz FZHDPVSTJUPOKZ-MRXNPFEDSA-N 1 2 323.415 4.264 20 0 DIADLO CC(C)(C)c1cc(C[N@H+](CCC(F)(F)F)CC2CC2)no1 ZINC000570438014 1044757282 /nfs/dbraw/zinc/75/72/82/1044757282.db2.gz LUIZXJAGYYGPSY-UHFFFAOYSA-N 1 2 304.356 4.137 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+](CCC(F)(F)F)CC2CC2)no1 ZINC000570438014 1044757294 /nfs/dbraw/zinc/75/72/94/1044757294.db2.gz LUIZXJAGYYGPSY-UHFFFAOYSA-N 1 2 304.356 4.137 20 0 DIADLO Cc1cn[nH]c1C[NH2+][C@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000368082743 1044766284 /nfs/dbraw/zinc/76/62/84/1044766284.db2.gz ZCEDHTUMHMXADE-INIZCTEOSA-N 1 2 317.845 4.312 20 0 DIADLO Cc1c[nH]nc1C[NH2+][C@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000368082743 1044766297 /nfs/dbraw/zinc/76/62/97/1044766297.db2.gz ZCEDHTUMHMXADE-INIZCTEOSA-N 1 2 317.845 4.312 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccccc2F)cs1)c1ccccn1 ZINC000368219426 1044769904 /nfs/dbraw/zinc/76/99/04/1044769904.db2.gz AVTVXDUOHHATKY-GFCCVEGCSA-N 1 2 313.401 4.195 20 0 DIADLO CC(C)(C)c1n[nH]cc1C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000570706464 1044776604 /nfs/dbraw/zinc/77/66/04/1044776604.db2.gz XBDXIHYQJQQFPC-OAHLLOKOSA-N 1 2 303.837 4.308 20 0 DIADLO CC(C)(C)c1n[nH]cc1C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000570706464 1044776617 /nfs/dbraw/zinc/77/66/17/1044776617.db2.gz XBDXIHYQJQQFPC-OAHLLOKOSA-N 1 2 303.837 4.308 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](Cc1ccon1)C1CC1 ZINC000122877995 1044777005 /nfs/dbraw/zinc/77/70/05/1044777005.db2.gz FTZJXLNJXNEXIC-LLVKDONJSA-N 1 2 310.319 4.419 20 0 DIADLO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](Cc1ccon1)C1CC1 ZINC000122877995 1044777027 /nfs/dbraw/zinc/77/70/27/1044777027.db2.gz FTZJXLNJXNEXIC-LLVKDONJSA-N 1 2 310.319 4.419 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@H](c2ccccc2)C(C)(C)C)n1 ZINC000097079239 1044786561 /nfs/dbraw/zinc/78/65/61/1044786561.db2.gz QJXQXOSXCCATCG-QGZVFWFLSA-N 1 2 301.434 4.145 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H](C)c2c[nH+]c3c(C)cccn23)c(C)c1 ZINC001202754440 1044793992 /nfs/dbraw/zinc/79/39/92/1044793992.db2.gz KYRITBFJSWLPQY-HNNXBMFYSA-N 1 2 322.412 4.142 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2ccccc2F)c2ccccn2)cc1 ZINC000369289625 1044799974 /nfs/dbraw/zinc/79/99/74/1044799974.db2.gz BXAFAFMHEZIAMU-FQEVSTJZSA-N 1 2 306.384 4.408 20 0 DIADLO CC[N@H+](Cc1nc(-c2cccs2)oc1C)Cc1ccccn1 ZINC000125401632 1044802187 /nfs/dbraw/zinc/80/21/87/1044802187.db2.gz LXZJXIBXXZZGNO-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO CC[N@@H+](Cc1nc(-c2cccs2)oc1C)Cc1ccccn1 ZINC000125401632 1044802208 /nfs/dbraw/zinc/80/22/08/1044802208.db2.gz LXZJXIBXXZZGNO-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2cc3cc(OC)ccc3o2)cs1 ZINC000125383599 1044803225 /nfs/dbraw/zinc/80/32/25/1044803225.db2.gz AWDPXXAHORIONF-NSHDSACASA-N 1 2 316.426 4.311 20 0 DIADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1nc(C)cs1 ZINC000126224458 1044810965 /nfs/dbraw/zinc/81/09/65/1044810965.db2.gz NAQALXVDKRQIQC-LLVKDONJSA-N 1 2 310.850 4.354 20 0 DIADLO CCC1(c2noc(CCc3[nH]c4c(cccc4C)[nH+]3)n2)CCCC1 ZINC000445788189 1044815388 /nfs/dbraw/zinc/81/53/88/1044815388.db2.gz YKVQRIFRNHQRCE-UHFFFAOYSA-N 1 2 324.428 4.261 20 0 DIADLO CCC[N@H+](Cc1nnc(C(C)C)o1)[C@@H](C)c1ccccc1OC ZINC000263725371 1044823313 /nfs/dbraw/zinc/82/33/13/1044823313.db2.gz GASQGPBELYCFTA-AWEZNQCLSA-N 1 2 317.433 4.175 20 0 DIADLO CCC[N@@H+](Cc1nnc(C(C)C)o1)[C@@H](C)c1ccccc1OC ZINC000263725371 1044823332 /nfs/dbraw/zinc/82/33/32/1044823332.db2.gz GASQGPBELYCFTA-AWEZNQCLSA-N 1 2 317.433 4.175 20 0 DIADLO Clc1ncc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)s1 ZINC000370169127 1044826289 /nfs/dbraw/zinc/82/62/89/1044826289.db2.gz LZGSGEUSXFRPJH-CYBMUJFWSA-N 1 2 310.875 4.087 20 0 DIADLO Clc1ncc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)s1 ZINC000370169127 1044826317 /nfs/dbraw/zinc/82/63/17/1044826317.db2.gz LZGSGEUSXFRPJH-CYBMUJFWSA-N 1 2 310.875 4.087 20 0 DIADLO CC[N@@H+](Cc1ccn(-c2ccccc2F)n1)Cc1cccs1 ZINC000445798331 1044830540 /nfs/dbraw/zinc/83/05/40/1044830540.db2.gz OPNDZALUIRZCQQ-UHFFFAOYSA-N 1 2 315.417 4.095 20 0 DIADLO CC[N@H+](Cc1ccn(-c2ccccc2F)n1)Cc1cccs1 ZINC000445798331 1044830570 /nfs/dbraw/zinc/83/05/70/1044830570.db2.gz OPNDZALUIRZCQQ-UHFFFAOYSA-N 1 2 315.417 4.095 20 0 DIADLO COc1c(C)cc(C[N@H+](C)Cc2cc(C(C)(C)C)on2)cc1C ZINC000571928010 1044832802 /nfs/dbraw/zinc/83/28/02/1044832802.db2.gz XBCPTQMXFJWNLD-UHFFFAOYSA-N 1 2 316.445 4.230 20 0 DIADLO COc1c(C)cc(C[N@@H+](C)Cc2cc(C(C)(C)C)on2)cc1C ZINC000571928010 1044832821 /nfs/dbraw/zinc/83/28/21/1044832821.db2.gz XBCPTQMXFJWNLD-UHFFFAOYSA-N 1 2 316.445 4.230 20 0 DIADLO C[C@@H]([NH2+][C@@H]1C=CCCCCC1)c1noc(Cc2ccccc2)n1 ZINC000571943392 1044832994 /nfs/dbraw/zinc/83/29/94/1044832994.db2.gz UVDVXMAONDJZGL-NVXWUHKLSA-N 1 2 311.429 4.200 20 0 DIADLO Cc1nc([C@H](C)[NH+]2CCC(c3c(C)[nH]c4ccccc43)CC2)no1 ZINC000370597624 1044844344 /nfs/dbraw/zinc/84/43/44/1044844344.db2.gz OGVUMQOODRUNJT-ZDUSSCGKSA-N 1 2 324.428 4.108 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2cccc(-c3cccnc3)c2)s1 ZINC000370720614 1044853031 /nfs/dbraw/zinc/85/30/31/1044853031.db2.gz PBJPJLZGCABURW-UHFFFAOYSA-N 1 2 324.453 4.013 20 0 DIADLO Cc1cnn(CC[N@@H+]2CCc3cc(Cl)c(Cl)cc3[C@@H]2C)c1 ZINC000572504212 1044861282 /nfs/dbraw/zinc/86/12/82/1044861282.db2.gz FUKJDHWIJOGUMT-LBPRGKRZSA-N 1 2 324.255 4.118 20 0 DIADLO Cc1cnn(CC[N@H+]2CCc3cc(Cl)c(Cl)cc3[C@@H]2C)c1 ZINC000572504212 1044861309 /nfs/dbraw/zinc/86/13/09/1044861309.db2.gz FUKJDHWIJOGUMT-LBPRGKRZSA-N 1 2 324.255 4.118 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2ccccc2SC)cs1 ZINC000337386269 1044889834 /nfs/dbraw/zinc/88/98/34/1044889834.db2.gz XKQMBZVEWXUVKU-NEPJUHHUSA-N 1 2 322.499 4.423 20 0 DIADLO CC(C)(C[NH2+][C@H](c1cccs1)c1nnc[nH]1)C1=CCCCC1 ZINC000573310204 1044902814 /nfs/dbraw/zinc/90/28/14/1044902814.db2.gz KLDXOUXOCDMPDB-OAHLLOKOSA-N 1 2 316.474 4.072 20 0 DIADLO Cc1cc(NC(=O)c2ccc([C@H](C)C(F)(F)F)cc2)c(C)c[nH+]1 ZINC000573419911 1044906780 /nfs/dbraw/zinc/90/67/80/1044906780.db2.gz LUPJCJIQHCLLGM-LBPRGKRZSA-N 1 2 322.330 4.038 20 0 DIADLO Cc1ccc(CNc2cccc3c2CN(c2cccc[nH+]2)C3)o1 ZINC000372296252 1044911150 /nfs/dbraw/zinc/91/11/50/1044911150.db2.gz DBOKVPUISVUZEB-UHFFFAOYSA-N 1 2 305.381 4.115 20 0 DIADLO CC(C)[C@@H]1CN(c2cc[nH+]c3c(Cl)cccc23)CCCO1 ZINC000573546210 1044913146 /nfs/dbraw/zinc/91/31/46/1044913146.db2.gz URISZONGADKMQK-INIZCTEOSA-N 1 2 304.821 4.140 20 0 DIADLO c1cn(Cc2cccc(-c3nc(C4CCCCC4)no3)c2)c[nH+]1 ZINC000264668945 1044915324 /nfs/dbraw/zinc/91/53/24/1044915324.db2.gz WJBNONXPYPXVMC-UHFFFAOYSA-N 1 2 308.385 4.029 20 0 DIADLO CC(C)CC[C@H]1CCC[C@H]1Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000573764181 1044921564 /nfs/dbraw/zinc/92/15/64/1044921564.db2.gz UYUXNYJYXOQOQC-QZTJIDSGSA-N 1 2 312.461 4.343 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c(F)c1 ZINC000133469992 1044937776 /nfs/dbraw/zinc/93/77/76/1044937776.db2.gz WLMDECLHCBVYPH-LLVKDONJSA-N 1 2 322.449 4.439 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2nc(-c3ccccc3)c[nH]2)o1 ZINC000574361629 1044950435 /nfs/dbraw/zinc/95/04/35/1044950435.db2.gz QGOIJKRRUGMQGN-CJNGLKHVSA-N 1 2 307.397 4.083 20 0 DIADLO c1ccc(-c2nc(C[N@@H+]3CCCC[C@H]3c3ccccc3)no2)cc1 ZINC000575172613 1044991752 /nfs/dbraw/zinc/99/17/52/1044991752.db2.gz SQIAOQYEIBKXBK-SFHVURJKSA-N 1 2 319.408 4.464 20 0 DIADLO c1ccc(-c2nc(C[N@H+]3CCCC[C@H]3c3ccccc3)no2)cc1 ZINC000575172613 1044991767 /nfs/dbraw/zinc/99/17/67/1044991767.db2.gz SQIAOQYEIBKXBK-SFHVURJKSA-N 1 2 319.408 4.464 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@@H+]2[C@@H](C)c2nc(C3CC3)no2)o1 ZINC000265375521 1044992923 /nfs/dbraw/zinc/99/29/23/1044992923.db2.gz BJQKUIFVYJJLBU-FZMZJTMJSA-N 1 2 301.390 4.001 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@H+]2[C@@H](C)c2nc(C3CC3)no2)o1 ZINC000265375521 1044992940 /nfs/dbraw/zinc/99/29/40/1044992940.db2.gz BJQKUIFVYJJLBU-FZMZJTMJSA-N 1 2 301.390 4.001 20 0 DIADLO Cc1ccc2ncc(C[N@@H+]3CCO[C@H](c4ccsc4)C3)cc2c1 ZINC000411314606 1044996082 /nfs/dbraw/zinc/99/60/82/1044996082.db2.gz FBFLETSVZSXROA-IBGZPJMESA-N 1 2 324.449 4.178 20 0 DIADLO Cc1ccc2ncc(C[N@H+]3CCO[C@H](c4ccsc4)C3)cc2c1 ZINC000411314606 1044996092 /nfs/dbraw/zinc/99/60/92/1044996092.db2.gz FBFLETSVZSXROA-IBGZPJMESA-N 1 2 324.449 4.178 20 0 DIADLO FC1(F)CC[C@@H](C[N@@H+]2CCO[C@H](c3ccccc3Cl)C2)C1 ZINC000575436165 1045000246 /nfs/dbraw/zinc/00/02/46/1045000246.db2.gz LFWPMYPDLLRUFQ-DOMZBBRYSA-N 1 2 315.791 4.149 20 0 DIADLO FC1(F)CC[C@@H](C[N@H+]2CCO[C@H](c3ccccc3Cl)C2)C1 ZINC000575436165 1045000256 /nfs/dbraw/zinc/00/02/56/1045000256.db2.gz LFWPMYPDLLRUFQ-DOMZBBRYSA-N 1 2 315.791 4.149 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1cc2ccccc2[nH]1 ZINC000373694599 1045002100 /nfs/dbraw/zinc/00/21/00/1045002100.db2.gz HKGGYRSOJBVOEI-UHFFFAOYSA-N 1 2 316.364 4.119 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)CCc1ccsc1 ZINC000373706091 1045002694 /nfs/dbraw/zinc/00/26/94/1045002694.db2.gz OFFLJCNJVIVRCU-UHFFFAOYSA-N 1 2 311.410 4.018 20 0 DIADLO COc1cccc(C2([NH2+]Cc3coc(-c4ccccc4)n3)CC2)c1 ZINC000150891170 1045009586 /nfs/dbraw/zinc/00/95/86/1045009586.db2.gz MEQSXYFBHJBUCY-UHFFFAOYSA-N 1 2 320.392 4.129 20 0 DIADLO FC(F)OC[C@@H]1CC[N@H+](Cc2csc(Cl)c2Cl)C1 ZINC000575956581 1045020698 /nfs/dbraw/zinc/02/06/98/1045020698.db2.gz YYTLYNBIKQFOBQ-SSDOTTSWSA-N 1 2 316.200 4.116 20 0 DIADLO FC(F)OC[C@@H]1CC[N@@H+](Cc2csc(Cl)c2Cl)C1 ZINC000575956581 1045020710 /nfs/dbraw/zinc/02/07/10/1045020710.db2.gz YYTLYNBIKQFOBQ-SSDOTTSWSA-N 1 2 316.200 4.116 20 0 DIADLO C[N@H+](Cc1noc(Cc2ccccc2)n1)C1CCC(C)(C)CC1 ZINC000446737016 1045030603 /nfs/dbraw/zinc/03/06/03/1045030603.db2.gz SSAIIHPDXMKCET-UHFFFAOYSA-N 1 2 313.445 4.061 20 0 DIADLO C[N@@H+](Cc1noc(Cc2ccccc2)n1)C1CCC(C)(C)CC1 ZINC000446737016 1045030616 /nfs/dbraw/zinc/03/06/16/1045030616.db2.gz SSAIIHPDXMKCET-UHFFFAOYSA-N 1 2 313.445 4.061 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@H](Oc3ccccc3)C2)o1 ZINC000411982303 1045042529 /nfs/dbraw/zinc/04/25/29/1045042529.db2.gz JSUCNIKRPYFLLW-INIZCTEOSA-N 1 2 314.429 4.016 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CCC[C@H](Oc3ccccc3)C2)o1 ZINC000411982303 1045042542 /nfs/dbraw/zinc/04/25/42/1045042542.db2.gz JSUCNIKRPYFLLW-INIZCTEOSA-N 1 2 314.429 4.016 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@H](C)c1cnn(C(C)C)c1)c1ccco1 ZINC000152630824 1045044642 /nfs/dbraw/zinc/04/46/42/1045044642.db2.gz IMLPCORZOZSPKF-WBVHZDCISA-N 1 2 319.449 4.122 20 0 DIADLO CC[N@H+](CC(=O)Nc1c(C)cccc1Cl)Cc1occc1C ZINC000412027427 1045049984 /nfs/dbraw/zinc/04/99/84/1045049984.db2.gz PMQPOWBYRUCJOE-UHFFFAOYSA-N 1 2 320.820 4.010 20 0 DIADLO CC[N@@H+](CC(=O)Nc1c(C)cccc1Cl)Cc1occc1C ZINC000412027427 1045049992 /nfs/dbraw/zinc/04/99/92/1045049992.db2.gz PMQPOWBYRUCJOE-UHFFFAOYSA-N 1 2 320.820 4.010 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(C2CC2)s1)c1nccn1-c1ccccc1 ZINC000576425679 1045058069 /nfs/dbraw/zinc/05/80/69/1045058069.db2.gz DZUHOMWOFVWBMD-ZDUSSCGKSA-N 1 2 324.453 4.057 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2)N(c2cc(N3CCCCC3)[nH+]cn2)C1 ZINC000576538498 1045064704 /nfs/dbraw/zinc/06/47/04/1045064704.db2.gz JRTNLJVXQHOBJZ-AEFFLSMTSA-N 1 2 322.456 4.054 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2)N(c2cc(N3CCCCC3)nc[nH+]2)C1 ZINC000576538498 1045064718 /nfs/dbraw/zinc/06/47/18/1045064718.db2.gz JRTNLJVXQHOBJZ-AEFFLSMTSA-N 1 2 322.456 4.054 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)cs1 ZINC000374529748 1045066812 /nfs/dbraw/zinc/06/68/12/1045066812.db2.gz KAFOPVYDMGGLBB-LBPRGKRZSA-N 1 2 304.381 4.006 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)cs1 ZINC000374529748 1045066823 /nfs/dbraw/zinc/06/68/23/1045066823.db2.gz KAFOPVYDMGGLBB-LBPRGKRZSA-N 1 2 304.381 4.006 20 0 DIADLO CCc1cc(C[NH2+]Cc2ccc(-c3ccc(F)cc3C)o2)on1 ZINC000525460709 1045073093 /nfs/dbraw/zinc/07/30/93/1045073093.db2.gz MMVRLXOXDVAEIK-UHFFFAOYSA-N 1 2 314.360 4.234 20 0 DIADLO Cc1cc2[nH]c(C[N@H+](C)Cc3cc(C(C)(C)C)n[nH]3)cc2c(C)c1 ZINC000447070632 1045094804 /nfs/dbraw/zinc/09/48/04/1045094804.db2.gz UCJXGROBMLSCLV-UHFFFAOYSA-N 1 2 324.472 4.437 20 0 DIADLO Cc1cc2[nH]c(C[N@@H+](C)Cc3cc(C(C)(C)C)n[nH]3)cc2c(C)c1 ZINC000447070632 1045094812 /nfs/dbraw/zinc/09/48/12/1045094812.db2.gz UCJXGROBMLSCLV-UHFFFAOYSA-N 1 2 324.472 4.437 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@H](C)O[C@@H](c2ccccc2)C1 ZINC000428469341 1045099243 /nfs/dbraw/zinc/09/92/43/1045099243.db2.gz JKMGVDFNSTWNEY-KBXCAEBGSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@H](C)O[C@@H](c2ccccc2)C1 ZINC000428469341 1045099256 /nfs/dbraw/zinc/09/92/56/1045099256.db2.gz JKMGVDFNSTWNEY-KBXCAEBGSA-N 1 2 314.429 4.068 20 0 DIADLO CC(C)(C)C(C)(C)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000577129658 1045102629 /nfs/dbraw/zinc/10/26/29/1045102629.db2.gz FLZSUUZPSLGBEU-UHFFFAOYSA-N 1 2 324.428 4.305 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cc(-c2cccs2)on1 ZINC000525637048 1045103471 /nfs/dbraw/zinc/10/34/71/1045103471.db2.gz WWGSEWOPBLVVOE-ZDUSSCGKSA-N 1 2 310.422 4.350 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cc(-c2cccs2)on1 ZINC000525637048 1045103474 /nfs/dbraw/zinc/10/34/74/1045103474.db2.gz WWGSEWOPBLVVOE-ZDUSSCGKSA-N 1 2 310.422 4.350 20 0 DIADLO CCCCc1nc(C[N@@H+]2Cc3ccccc3C[C@H]2C)cs1 ZINC000525637906 1045104286 /nfs/dbraw/zinc/10/42/86/1045104286.db2.gz KCPGVCAODYNLDI-CQSZACIVSA-N 1 2 300.471 4.433 20 0 DIADLO CCCCc1nc(C[N@H+]2Cc3ccccc3C[C@H]2C)cs1 ZINC000525637906 1045104297 /nfs/dbraw/zinc/10/42/97/1045104297.db2.gz KCPGVCAODYNLDI-CQSZACIVSA-N 1 2 300.471 4.433 20 0 DIADLO Cc1cnc([C@H](C)[N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)cn1 ZINC000428472118 1045111045 /nfs/dbraw/zinc/11/10/45/1045111045.db2.gz FNAJJOPQWCQLQO-XJKSGUPXSA-N 1 2 324.453 4.293 20 0 DIADLO Cc1cnc([C@H](C)[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)cn1 ZINC000428472118 1045111049 /nfs/dbraw/zinc/11/10/49/1045111049.db2.gz FNAJJOPQWCQLQO-XJKSGUPXSA-N 1 2 324.453 4.293 20 0 DIADLO Cc1cccc(C)c1NC(=O)[C@H](C)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000361057998 1045112847 /nfs/dbraw/zinc/11/28/47/1045112847.db2.gz AWNOJVOTIGPALW-HOTGVXAUSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1cccc(C)c1NC(=O)[C@H](C)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000361057998 1045112852 /nfs/dbraw/zinc/11/28/52/1045112852.db2.gz AWNOJVOTIGPALW-HOTGVXAUSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc([S@](C)=O)cc2)c(Cl)c1 ZINC000447314258 1045118918 /nfs/dbraw/zinc/11/89/18/1045118918.db2.gz MGQYRPHNIKYCAX-NRFANRHFSA-N 1 2 321.873 4.018 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc([S@](C)=O)cc2)c(Cl)c1 ZINC000447314258 1045118924 /nfs/dbraw/zinc/11/89/24/1045118924.db2.gz MGQYRPHNIKYCAX-NRFANRHFSA-N 1 2 321.873 4.018 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nccn2CCc2ccccc2)oc1C ZINC000282021404 1045119772 /nfs/dbraw/zinc/11/97/72/1045119772.db2.gz DYNYGKKDHODDRN-INIZCTEOSA-N 1 2 323.440 4.186 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cncn1Cc1ccccc1 ZINC000525833054 1045127101 /nfs/dbraw/zinc/12/71/01/1045127101.db2.gz IFTDJVWJQAQSHC-INIZCTEOSA-N 1 2 323.415 4.264 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cncn1Cc1ccccc1 ZINC000525833054 1045127107 /nfs/dbraw/zinc/12/71/07/1045127107.db2.gz IFTDJVWJQAQSHC-INIZCTEOSA-N 1 2 323.415 4.264 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@H](C)c2ccccc2Br)C[C@H](C)O1 ZINC000600702765 1045130804 /nfs/dbraw/zinc/13/08/04/1045130804.db2.gz ZURCNFHFAFFJNE-YNEHKIRRSA-N 1 2 312.251 4.009 20 0 DIADLO CC[C@@H]1C[N@H+]([C@H](C)c2ccccc2Br)C[C@H](C)O1 ZINC000600702765 1045130814 /nfs/dbraw/zinc/13/08/14/1045130814.db2.gz ZURCNFHFAFFJNE-YNEHKIRRSA-N 1 2 312.251 4.009 20 0 DIADLO COc1cc(C)cc(NCc2c[nH+]cn2Cc2ccccc2)c1C ZINC000447415315 1045131697 /nfs/dbraw/zinc/13/16/97/1045131697.db2.gz WPPVEBSDLSCULE-UHFFFAOYSA-N 1 2 321.424 4.169 20 0 DIADLO c1cn(-c2ccccc2)c(C[N@H+](Cc2ccccc2)C2CC2)n1 ZINC000361491814 1045132189 /nfs/dbraw/zinc/13/21/89/1045132189.db2.gz AORGSEPNSODAFQ-UHFFFAOYSA-N 1 2 303.409 4.037 20 0 DIADLO c1cn(-c2ccccc2)c(C[N@@H+](Cc2ccccc2)C2CC2)n1 ZINC000361491814 1045132192 /nfs/dbraw/zinc/13/21/92/1045132192.db2.gz AORGSEPNSODAFQ-UHFFFAOYSA-N 1 2 303.409 4.037 20 0 DIADLO C[C@@H]1CC(C)(C)C[C@@H]1Nc1ccccc1OCCn1cc[nH+]c1 ZINC000447595408 1045157539 /nfs/dbraw/zinc/15/75/39/1045157539.db2.gz NISQJJDXGGZGEE-WBVHZDCISA-N 1 2 313.445 4.199 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1cnc(C(F)(F)F)s1 ZINC000447739297 1045172264 /nfs/dbraw/zinc/17/22/64/1045172264.db2.gz GWLSKFIUWGRSLQ-VIFPVBQESA-N 1 2 316.348 4.061 20 0 DIADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1cnc(C(F)(F)F)s1 ZINC000447739297 1045172269 /nfs/dbraw/zinc/17/22/69/1045172269.db2.gz GWLSKFIUWGRSLQ-VIFPVBQESA-N 1 2 316.348 4.061 20 0 DIADLO Cc1nonc1[C@@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000924527462 1045174607 /nfs/dbraw/zinc/17/46/07/1045174607.db2.gz ZNGYRUZMDZQEQT-UONOGXRCSA-N 1 2 307.397 4.457 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1cnc(C(F)(F)F)s1 ZINC000447793322 1045177867 /nfs/dbraw/zinc/17/78/67/1045177867.db2.gz BHTXELWSAFEAGI-VIFPVBQESA-N 1 2 318.339 4.494 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1cnc(C(F)(F)F)s1 ZINC000447793322 1045177875 /nfs/dbraw/zinc/17/78/75/1045177875.db2.gz BHTXELWSAFEAGI-VIFPVBQESA-N 1 2 318.339 4.494 20 0 DIADLO Oc1ccc(Cl)c(F)c1C[NH2+]C1(c2ccccc2F)CC1 ZINC000191125967 1045182531 /nfs/dbraw/zinc/18/25/31/1045182531.db2.gz MUZIHRMIPIJICL-UHFFFAOYSA-N 1 2 309.743 4.103 20 0 DIADLO CC(C)Oc1ccccc1C[NH2+]Cc1nc(-c2ccccc2)c[nH]1 ZINC000447854481 1045184607 /nfs/dbraw/zinc/18/46/07/1045184607.db2.gz LOEVTKUMAPSDLY-UHFFFAOYSA-N 1 2 321.424 4.154 20 0 DIADLO CC[C@H]([NH2+][C@@H]1CCCc2oc(C)nc21)c1ccccc1OC ZINC000924646066 1045188320 /nfs/dbraw/zinc/18/83/20/1045188320.db2.gz JRPAKZYJEPGPMS-LSDHHAIUSA-N 1 2 300.402 4.110 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1COCc1ccccc1)c1ncco1 ZINC000924659993 1045189768 /nfs/dbraw/zinc/18/97/68/1045189768.db2.gz NYKORWBWFLHNHZ-MRXNPFEDSA-N 1 2 322.408 4.242 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000447936629 1045192086 /nfs/dbraw/zinc/19/20/86/1045192086.db2.gz QODPBDBXIIIRNO-LBPRGKRZSA-N 1 2 304.459 4.300 20 0 DIADLO COc1ccc(C[N@@H+]2CCCn3c(cc4ccccc43)C2)cc1 ZINC000577973516 1045195738 /nfs/dbraw/zinc/19/57/38/1045195738.db2.gz QLSNTHFMGVYURC-UHFFFAOYSA-N 1 2 306.409 4.056 20 0 DIADLO COc1ccc(C[N@H+]2CCCn3c(cc4ccccc43)C2)cc1 ZINC000577973516 1045195742 /nfs/dbraw/zinc/19/57/42/1045195742.db2.gz QLSNTHFMGVYURC-UHFFFAOYSA-N 1 2 306.409 4.056 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@@H]1CCOc2c(Cl)cccc21 ZINC000924823820 1045201135 /nfs/dbraw/zinc/20/11/35/1045201135.db2.gz CWEJLBXWLCDPEI-ZIAGYGMSSA-N 1 2 318.804 4.127 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(Cl)c1Cl)c1cn2c(n1)CCCC2 ZINC000924858407 1045205379 /nfs/dbraw/zinc/20/53/79/1045205379.db2.gz MVWYPEVMPDMCPA-NSHDSACASA-N 1 2 324.255 4.377 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1Cl)c1ccnn1C1CCC1 ZINC000924859041 1045206084 /nfs/dbraw/zinc/20/60/84/1045206084.db2.gz RXPGRUJLMBIZGS-NSHDSACASA-N 1 2 307.800 4.251 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)on1 ZINC000924859533 1045206410 /nfs/dbraw/zinc/20/64/10/1045206410.db2.gz UEKGDNDYVFXLAL-DTWKUNHWSA-N 1 2 315.200 4.402 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)C[C@@H](C2CC2)O1 ZINC000527239216 1045206508 /nfs/dbraw/zinc/20/65/08/1045206508.db2.gz VGZJINVDUTVURM-DYVFJYSZSA-N 1 2 320.502 4.190 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)C[C@@H](C2CC2)O1 ZINC000527239216 1045206517 /nfs/dbraw/zinc/20/65/17/1045206517.db2.gz VGZJINVDUTVURM-DYVFJYSZSA-N 1 2 320.502 4.190 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(Cl)n1C)c1csc(C(F)(F)F)c1 ZINC000924906609 1045209401 /nfs/dbraw/zinc/20/94/01/1045209401.db2.gz JUQHWHUOKBKJFO-SSDOTTSWSA-N 1 2 323.771 4.005 20 0 DIADLO Cc1oncc1C[N@H+]1CCC[C@@H]1c1nc2ccccc2n1C(C)C ZINC000527324629 1045214345 /nfs/dbraw/zinc/21/43/45/1045214345.db2.gz ZGAOVPBIJFWPSZ-GOSISDBHSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1oncc1C[N@@H+]1CCC[C@@H]1c1nc2ccccc2n1C(C)C ZINC000527324629 1045214354 /nfs/dbraw/zinc/21/43/54/1045214354.db2.gz ZGAOVPBIJFWPSZ-GOSISDBHSA-N 1 2 324.428 4.251 20 0 DIADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1csc(-c2ccccc2)n1 ZINC000578169020 1045217134 /nfs/dbraw/zinc/21/71/34/1045217134.db2.gz JYXTYHTZQROERD-ACJLOTCBSA-N 1 2 322.433 4.422 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccnn2CC2CCC2)cs1 ZINC000925034043 1045220150 /nfs/dbraw/zinc/22/01/50/1045220150.db2.gz POOHUINCOGEVIT-QWHCGFSZSA-N 1 2 318.490 4.114 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2ccc3nc(C)ccc3c2)cs1 ZINC000527357460 1045221141 /nfs/dbraw/zinc/22/11/41/1045221141.db2.gz JEEBKWUHRKBHOR-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2ccc3nc(C)ccc3c2)cs1 ZINC000527357460 1045221152 /nfs/dbraw/zinc/22/11/52/1045221152.db2.gz JEEBKWUHRKBHOR-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2Cl)on1 ZINC000925093862 1045226494 /nfs/dbraw/zinc/22/64/94/1045226494.db2.gz TWDYICRPBIJTLF-IUCAKERBSA-N 1 2 315.200 4.402 20 0 DIADLO Cc1nnsc1C[N@@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000578326661 1045231406 /nfs/dbraw/zinc/23/14/06/1045231406.db2.gz AKWYGWWIEZDIIB-GOSISDBHSA-N 1 2 321.449 4.146 20 0 DIADLO Cc1nnsc1C[N@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000578326661 1045231414 /nfs/dbraw/zinc/23/14/14/1045231414.db2.gz AKWYGWWIEZDIIB-GOSISDBHSA-N 1 2 321.449 4.146 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccnn1C1CCC1 ZINC000925154952 1045231467 /nfs/dbraw/zinc/23/14/67/1045231467.db2.gz SQDKCZPMEIHTQP-CQSZACIVSA-N 1 2 322.412 4.114 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@H](C)c2cc(O)cc(F)c2)on1 ZINC000925159035 1045231778 /nfs/dbraw/zinc/23/17/78/1045231778.db2.gz WKEPWFZNRBEOFJ-LLVKDONJSA-N 1 2 306.381 4.274 20 0 DIADLO CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@H](C)c1nonc1C ZINC000925207938 1045235684 /nfs/dbraw/zinc/23/56/84/1045235684.db2.gz NZOYZBFDERVEKG-CJNGLKHVSA-N 1 2 317.433 4.215 20 0 DIADLO Clc1cccc2c(N3CCO[C@H](c4ccccc4)C3)cc[nH+]c12 ZINC000578388164 1045237428 /nfs/dbraw/zinc/23/74/28/1045237428.db2.gz QHALLYGJUDIUGI-SFHVURJKSA-N 1 2 324.811 4.466 20 0 DIADLO CCCCN(C(=O)[C@@H]1CCCc2[nH+]c[nH]c21)[C@H]1CCC[C@@H](C)C1 ZINC000578392408 1045239577 /nfs/dbraw/zinc/23/95/77/1045239577.db2.gz VRFUKZVZWHCOQE-OWCLPIDISA-N 1 2 317.477 4.037 20 0 DIADLO CCC[C@@H](Cc1ccccc1)Nc1ccc(Cn2cc[nH+]c2)cn1 ZINC000578470825 1045245905 /nfs/dbraw/zinc/24/59/05/1045245905.db2.gz UXJUFLWKDFTDJY-IBGZPJMESA-N 1 2 320.440 4.150 20 0 DIADLO Cc1cccc(F)c1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000779070700 1045246007 /nfs/dbraw/zinc/24/60/07/1045246007.db2.gz HUCVKGNZSPOWDR-HXUWFJFHSA-N 1 2 306.384 4.408 20 0 DIADLO Cc1ncc(C[N@@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)s1 ZINC000116327025 1045247016 /nfs/dbraw/zinc/24/70/16/1045247016.db2.gz SMZXREMIQUMDMD-OAHLLOKOSA-N 1 2 324.902 4.395 20 0 DIADLO Cc1ncc(C[N@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)s1 ZINC000116327025 1045247028 /nfs/dbraw/zinc/24/70/28/1045247028.db2.gz SMZXREMIQUMDMD-OAHLLOKOSA-N 1 2 324.902 4.395 20 0 DIADLO CCc1cnc(C[NH2+]C(C)(C)c2nc3ccccc3s2)s1 ZINC000527745593 1045258271 /nfs/dbraw/zinc/25/82/71/1045258271.db2.gz SWJKIIDWFIURCE-UHFFFAOYSA-N 1 2 317.483 4.340 20 0 DIADLO Clc1cccc2c(N3CCC[C@@H]3[C@@H]3CCCOC3)cc[nH+]c12 ZINC000578763858 1045270789 /nfs/dbraw/zinc/27/07/89/1045270789.db2.gz OMJMNUSYIGBLRF-CZUORRHYSA-N 1 2 316.832 4.284 20 0 DIADLO CCCCCC[C@](C)(CCC)C(=O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000779096507 1045272599 /nfs/dbraw/zinc/27/25/99/1045272599.db2.gz QUMXJMCRTGEJGT-APWZRJJASA-N 1 2 319.493 4.091 20 0 DIADLO C[C@H]1CCCC[C@@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000578858557 1045276606 /nfs/dbraw/zinc/27/66/06/1045276606.db2.gz SINAMZMWIYHGNG-YOEHRIQHSA-N 1 2 322.412 4.275 20 0 DIADLO CC(C)c1cccc([C@@H](C)[NH2+]Cc2nnc(C3CC3)s2)c1 ZINC000527909660 1045281109 /nfs/dbraw/zinc/28/11/09/1045281109.db2.gz RMFVLVYGIWDKJB-GFCCVEGCSA-N 1 2 301.459 4.390 20 0 DIADLO c1ccc2c(c1)cc[nH+]c2N1CCC(Cc2cccnc2)CC1 ZINC000527945869 1045285135 /nfs/dbraw/zinc/28/51/35/1045285135.db2.gz GDISRXUTKHIPCR-UHFFFAOYSA-N 1 2 303.409 4.089 20 0 DIADLO C[C@@H]1CN(c2[nH+]ccc3ccccc32)C[C@H](c2ccsc2)O1 ZINC000527931554 1045286061 /nfs/dbraw/zinc/28/60/61/1045286061.db2.gz SYQMFHLVMXVJQO-CXAGYDPISA-N 1 2 310.422 4.263 20 0 DIADLO C[C@@H](CC(=O)N[C@H](CC(C)(C)C)c1ccccc1)n1cc[nH+]c1 ZINC000579115494 1045294553 /nfs/dbraw/zinc/29/45/53/1045294553.db2.gz OERLPSLSILIAJN-DOTOQJQBSA-N 1 2 313.445 4.128 20 0 DIADLO CC1(C2CC2)CC[NH+](Cc2noc(C3CCCCC3)n2)CC1 ZINC000579289745 1045305260 /nfs/dbraw/zinc/30/52/60/1045305260.db2.gz HKKDSKYWPVKBRU-UHFFFAOYSA-N 1 2 303.450 4.129 20 0 DIADLO C[C@H]1COC(C)(C)C[N@@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000579305666 1045306924 /nfs/dbraw/zinc/30/69/24/1045306924.db2.gz SCFCOQKNRWVANY-ZDUSSCGKSA-N 1 2 308.491 4.190 20 0 DIADLO C[C@H]1COC(C)(C)C[N@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000579305666 1045306929 /nfs/dbraw/zinc/30/69/29/1045306929.db2.gz SCFCOQKNRWVANY-ZDUSSCGKSA-N 1 2 308.491 4.190 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cccc(-n3cc[nH+]c3)c2)c(C)c1 ZINC000117561077 1045306965 /nfs/dbraw/zinc/30/69/65/1045306965.db2.gz CUEIEEUBTMQTML-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO Fc1ccc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)cn1 ZINC000779157670 1045330305 /nfs/dbraw/zinc/33/03/05/1045330305.db2.gz HVYRMKGVUZMTLR-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)cn1 ZINC000779157670 1045330311 /nfs/dbraw/zinc/33/03/11/1045330311.db2.gz HVYRMKGVUZMTLR-UHFFFAOYSA-N 1 2 320.358 4.444 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1cccnc1C(F)(F)F ZINC000528345093 1045339278 /nfs/dbraw/zinc/33/92/78/1045339278.db2.gz MNANALHECHLLBC-SNVBAGLBSA-N 1 2 312.360 4.281 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1cccnc1C(F)(F)F ZINC000528345093 1045339287 /nfs/dbraw/zinc/33/92/87/1045339287.db2.gz MNANALHECHLLBC-SNVBAGLBSA-N 1 2 312.360 4.281 20 0 DIADLO Clc1cccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)n1 ZINC000075746233 1045339648 /nfs/dbraw/zinc/33/96/48/1045339648.db2.gz BVTZZESLUNCMES-OAHLLOKOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cccc(C[N@H+]2CCSC[C@@H]2c2ccccc2)n1 ZINC000075746233 1045339652 /nfs/dbraw/zinc/33/96/52/1045339652.db2.gz BVTZZESLUNCMES-OAHLLOKOSA-N 1 2 304.846 4.025 20 0 DIADLO C[N@H+](Cc1ccccc1Cl)Cc1cccnc1C(F)(F)F ZINC000528337678 1045341289 /nfs/dbraw/zinc/34/12/89/1045341289.db2.gz JVDISURLTZPTGI-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccccc1Cl)Cc1cccnc1C(F)(F)F ZINC000528337678 1045341295 /nfs/dbraw/zinc/34/12/95/1045341295.db2.gz JVDISURLTZPTGI-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2nc3cc(C)ccc3s2)on1 ZINC000528357386 1045345130 /nfs/dbraw/zinc/34/51/30/1045345130.db2.gz NXVXTRYSLCYRJX-AWEZNQCLSA-N 1 2 313.426 4.238 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2nc3cc(C)ccc3s2)on1 ZINC000528357386 1045345133 /nfs/dbraw/zinc/34/51/33/1045345133.db2.gz NXVXTRYSLCYRJX-AWEZNQCLSA-N 1 2 313.426 4.238 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2ccc(F)nc2)s1 ZINC000189308664 1045346126 /nfs/dbraw/zinc/34/61/26/1045346126.db2.gz UJVZGXSEGVMTJH-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2ccc(F)nc2)s1 ZINC000189308664 1045346131 /nfs/dbraw/zinc/34/61/31/1045346131.db2.gz UJVZGXSEGVMTJH-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO Fc1ccc(C[N@@H+]2CCc3cc(-c4ccccc4)oc3C2)cn1 ZINC000779165158 1045348768 /nfs/dbraw/zinc/34/87/68/1045348768.db2.gz ZDHIZWVQEDWRSO-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1ccc(C[N@H+]2CCc3cc(-c4ccccc4)oc3C2)cn1 ZINC000779165158 1045348770 /nfs/dbraw/zinc/34/87/70/1045348770.db2.gz ZDHIZWVQEDWRSO-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cccnc2C(F)(F)F)n1 ZINC000528408218 1045352545 /nfs/dbraw/zinc/35/25/45/1045352545.db2.gz SGNXTXPWXUEENK-HNNXBMFYSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cccnc2C(F)(F)F)n1 ZINC000528408218 1045352547 /nfs/dbraw/zinc/35/25/47/1045352547.db2.gz SGNXTXPWXUEENK-HNNXBMFYSA-N 1 2 321.346 4.141 20 0 DIADLO Clc1ccccc1O[C@@H]1CC[N@@H+](Cc2ncccc2Cl)C1 ZINC000528420080 1045353615 /nfs/dbraw/zinc/35/36/15/1045353615.db2.gz JIXGSIZXJZRQRI-GFCCVEGCSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccccc1O[C@@H]1CC[N@H+](Cc2ncccc2Cl)C1 ZINC000528420080 1045353616 /nfs/dbraw/zinc/35/36/16/1045353616.db2.gz JIXGSIZXJZRQRI-GFCCVEGCSA-N 1 2 323.223 4.042 20 0 DIADLO Fc1cc2c(c(F)c1F)[C@H]([NH2+]Cc1nc(C3CC3)cs1)CC2 ZINC000449185382 1045360453 /nfs/dbraw/zinc/36/04/53/1045360453.db2.gz HQSVUEDOYQPYNM-LLVKDONJSA-N 1 2 324.371 4.215 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ncccc2Cl)cc1F ZINC000528554530 1045376404 /nfs/dbraw/zinc/37/64/04/1045376404.db2.gz LROYSKZJTSSJNR-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ncccc2Cl)cc1F ZINC000528554530 1045376415 /nfs/dbraw/zinc/37/64/15/1045376415.db2.gz LROYSKZJTSSJNR-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccccn1 ZINC000076902668 1045377087 /nfs/dbraw/zinc/37/70/87/1045377087.db2.gz UHGCKPKUTMCOQF-INIZCTEOSA-N 1 2 313.426 4.285 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1cc2ccccc2cc1OC ZINC000449342793 1045378230 /nfs/dbraw/zinc/37/82/30/1045378230.db2.gz FKAKXGAMLUMTIX-UHFFFAOYSA-N 1 2 310.397 4.031 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1cc2ccccc2cc1OC ZINC000449342793 1045378235 /nfs/dbraw/zinc/37/82/35/1045378235.db2.gz FKAKXGAMLUMTIX-UHFFFAOYSA-N 1 2 310.397 4.031 20 0 DIADLO Cc1cccc(C[NH2+][C@@H]2CCOc3c(F)ccc(F)c32)c1F ZINC000449333933 1045381452 /nfs/dbraw/zinc/38/14/52/1045381452.db2.gz CNFJNXQOWIILOL-CQSZACIVSA-N 1 2 307.315 4.026 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+]1CCc2nc(C(C)(C)C)ncc2C1 ZINC000528591936 1045386933 /nfs/dbraw/zinc/38/69/33/1045386933.db2.gz KHGAWSUHRCQJNB-ZDUSSCGKSA-N 1 2 313.420 4.033 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+]1CCc2nc(C(C)(C)C)ncc2C1 ZINC000528591936 1045386942 /nfs/dbraw/zinc/38/69/42/1045386942.db2.gz KHGAWSUHRCQJNB-ZDUSSCGKSA-N 1 2 313.420 4.033 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000449458858 1045395464 /nfs/dbraw/zinc/39/54/64/1045395464.db2.gz JHJWUVWJROBNMW-KGLIPLIRSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000449458858 1045395469 /nfs/dbraw/zinc/39/54/69/1045395469.db2.gz JHJWUVWJROBNMW-KGLIPLIRSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1nccn1-c1ccccc1 ZINC000449462416 1045399410 /nfs/dbraw/zinc/39/94/10/1045399410.db2.gz SXRRBRNJJBQPNE-ZIAGYGMSSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1nccn1-c1ccccc1 ZINC000449462416 1045399411 /nfs/dbraw/zinc/39/94/11/1045399411.db2.gz SXRRBRNJJBQPNE-ZIAGYGMSSA-N 1 2 323.362 4.035 20 0 DIADLO Cc1cc(C[N@H+]2CC=C(c3ccc(Cl)cc3C)CC2)no1 ZINC000528740467 1045406831 /nfs/dbraw/zinc/40/68/31/1045406831.db2.gz HMOXUEBXFBRVIE-UHFFFAOYSA-N 1 2 302.805 4.234 20 0 DIADLO Cc1cc(C[N@@H+]2CC=C(c3ccc(Cl)cc3C)CC2)no1 ZINC000528740467 1045406834 /nfs/dbraw/zinc/40/68/34/1045406834.db2.gz HMOXUEBXFBRVIE-UHFFFAOYSA-N 1 2 302.805 4.234 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CC=C(c3ccc(Cl)cc3C)CC2)o1 ZINC000528742121 1045408036 /nfs/dbraw/zinc/40/80/36/1045408036.db2.gz SAXRUHIQFRCDIX-GFCCVEGCSA-N 1 2 317.820 4.190 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CC=C(c3ccc(Cl)cc3C)CC2)o1 ZINC000528742121 1045408040 /nfs/dbraw/zinc/40/80/40/1045408040.db2.gz SAXRUHIQFRCDIX-GFCCVEGCSA-N 1 2 317.820 4.190 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1csc(-c2cccs2)n1 ZINC000528762401 1045408596 /nfs/dbraw/zinc/40/85/96/1045408596.db2.gz LWGRXHKXYGKVBR-JTQLQIEISA-N 1 2 314.426 4.491 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1csc(-c2cccs2)n1 ZINC000528762401 1045408600 /nfs/dbraw/zinc/40/86/00/1045408600.db2.gz LWGRXHKXYGKVBR-JTQLQIEISA-N 1 2 314.426 4.491 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1ncc(-c2ccccc2F)o1 ZINC000528763715 1045408674 /nfs/dbraw/zinc/40/86/74/1045408674.db2.gz BBZOYPGQEIOAQM-NSHDSACASA-N 1 2 310.319 4.100 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1ncc(-c2ccccc2F)o1 ZINC000528763715 1045408677 /nfs/dbraw/zinc/40/86/77/1045408677.db2.gz BBZOYPGQEIOAQM-NSHDSACASA-N 1 2 310.319 4.100 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1csc(C2CCCC2)n1 ZINC000528766057 1045411229 /nfs/dbraw/zinc/41/12/29/1045411229.db2.gz JHFFPPASSLOUFT-LLVKDONJSA-N 1 2 300.418 4.420 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1csc(C2CCCC2)n1 ZINC000528766057 1045411233 /nfs/dbraw/zinc/41/12/33/1045411233.db2.gz JHFFPPASSLOUFT-LLVKDONJSA-N 1 2 300.418 4.420 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1csc(-c2ccsc2)n1 ZINC000528763794 1045411440 /nfs/dbraw/zinc/41/14/40/1045411440.db2.gz CDPFIKUKEMHFMG-JTQLQIEISA-N 1 2 314.426 4.491 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1csc(-c2ccsc2)n1 ZINC000528763794 1045411444 /nfs/dbraw/zinc/41/14/44/1045411444.db2.gz CDPFIKUKEMHFMG-JTQLQIEISA-N 1 2 314.426 4.491 20 0 DIADLO C[C@@H](C[N@H+](C)Cc1nnc(C(F)(F)F)s1)C1CCCCC1 ZINC000528774071 1045412614 /nfs/dbraw/zinc/41/26/14/1045412614.db2.gz PNLMMHFULCGEJL-JTQLQIEISA-N 1 2 321.412 4.205 20 0 DIADLO C[C@@H](C[N@@H+](C)Cc1nnc(C(F)(F)F)s1)C1CCCCC1 ZINC000528774071 1045412617 /nfs/dbraw/zinc/41/26/17/1045412617.db2.gz PNLMMHFULCGEJL-JTQLQIEISA-N 1 2 321.412 4.205 20 0 DIADLO Clc1cccc(C2C[NH+](Cc3ccnn3C3CCCC3)C2)c1 ZINC000449554858 1045412808 /nfs/dbraw/zinc/41/28/08/1045412808.db2.gz FDNRYEZUOSDULV-UHFFFAOYSA-N 1 2 315.848 4.251 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@@H+]1Cc1coc(-c2ccc(F)cc2)n1 ZINC000528772113 1045413191 /nfs/dbraw/zinc/41/31/91/1045413191.db2.gz ZKDXQRNFDXSPRH-NSHDSACASA-N 1 2 310.319 4.100 20 0 DIADLO C[C@H]1CC(F)(F)CC[N@H+]1Cc1coc(-c2ccc(F)cc2)n1 ZINC000528772113 1045413193 /nfs/dbraw/zinc/41/31/93/1045413193.db2.gz ZKDXQRNFDXSPRH-NSHDSACASA-N 1 2 310.319 4.100 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3F)o2)c2nccn21 ZINC000449575039 1045415923 /nfs/dbraw/zinc/41/59/23/1045415923.db2.gz WSXVUNDWQOHKRG-BLLLJJGKSA-N 1 2 311.360 4.078 20 0 DIADLO Cc1c[nH+]c(CN2CCCC[C@H]2c2ccc(Cl)cc2)n1C ZINC000449570750 1045416063 /nfs/dbraw/zinc/41/60/63/1045416063.db2.gz KGYMIQYBCJRAJP-INIZCTEOSA-N 1 2 303.837 4.109 20 0 DIADLO CCc1ncc(C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)o1 ZINC000449609491 1045418595 /nfs/dbraw/zinc/41/85/95/1045418595.db2.gz NKOISPWWKOFGHJ-UHFFFAOYSA-N 1 2 314.360 4.234 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@@H+]1Cc1ccn(C(F)F)n1 ZINC000449730694 1045430725 /nfs/dbraw/zinc/43/07/25/1045430725.db2.gz GEIQOXGZWDGSPN-OAHLLOKOSA-N 1 2 309.335 4.063 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@H+]1Cc1ccn(C(F)F)n1 ZINC000449730694 1045430727 /nfs/dbraw/zinc/43/07/27/1045430727.db2.gz GEIQOXGZWDGSPN-OAHLLOKOSA-N 1 2 309.335 4.063 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](CC)Cc2ccccc2C)n1 ZINC000119586221 1045432496 /nfs/dbraw/zinc/43/24/96/1045432496.db2.gz GSIHINYPVATAKM-AWEZNQCLSA-N 1 2 319.474 4.214 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](CC)Cc2ccccc2C)n1 ZINC000119586221 1045432499 /nfs/dbraw/zinc/43/24/99/1045432499.db2.gz GSIHINYPVATAKM-AWEZNQCLSA-N 1 2 319.474 4.214 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC000449736708 1045432987 /nfs/dbraw/zinc/43/29/87/1045432987.db2.gz XJHJDJXQOMAAJA-GOSISDBHSA-N 1 2 319.399 4.388 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC000449736708 1045432993 /nfs/dbraw/zinc/43/29/93/1045432993.db2.gz XJHJDJXQOMAAJA-GOSISDBHSA-N 1 2 319.399 4.388 20 0 DIADLO CCO[C@H](C)c1noc(C[NH2+][C@@H](CC)c2ccc(Cl)cc2)n1 ZINC000120416388 1045472687 /nfs/dbraw/zinc/47/26/87/1045472687.db2.gz IDFZWHYLCODXQA-RISCZKNCSA-N 1 2 323.824 4.061 20 0 DIADLO Cc1c([C@@H](C)Nc2cc[nH+]c3cc(F)c(Cl)cc23)cnn1C ZINC000450242635 1045477942 /nfs/dbraw/zinc/47/79/42/1045477942.db2.gz PDWGXVFOOHMOIO-SECBINFHSA-N 1 2 318.783 4.242 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2nnc(C3CC3)s2)c1 ZINC000450297644 1045485454 /nfs/dbraw/zinc/48/54/54/1045485454.db2.gz KEZBFBCCBWOURK-CYBMUJFWSA-N 1 2 301.459 4.225 20 0 DIADLO Cc1ccc(C)c([C@@H](C)[N@@H+](C)Cc2nnc(C3CC3)s2)c1 ZINC000450297644 1045485460 /nfs/dbraw/zinc/48/54/60/1045485460.db2.gz KEZBFBCCBWOURK-CYBMUJFWSA-N 1 2 301.459 4.225 20 0 DIADLO CCOC[C@@H]1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C1 ZINC000450367952 1045497553 /nfs/dbraw/zinc/49/75/53/1045497553.db2.gz YHMWILVURNLVFO-GFCCVEGCSA-N 1 2 324.346 4.116 20 0 DIADLO CCC[C@]1(C)CCC[N@@H+]([C@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001307500717 1045512106 /nfs/dbraw/zinc/51/21/06/1045512106.db2.gz VVJGKFUOVXZQRO-FUHWJXTLSA-N 1 2 323.864 4.456 20 0 DIADLO CCC[C@]1(C)CCC[N@H+]([C@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001307500717 1045512110 /nfs/dbraw/zinc/51/21/10/1045512110.db2.gz VVJGKFUOVXZQRO-FUHWJXTLSA-N 1 2 323.864 4.456 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2cc(Cl)cc3ccccc32)n1 ZINC001119732522 1045523419 /nfs/dbraw/zinc/52/34/19/1045523419.db2.gz LSXVQVYQTIMBCV-SNVBAGLBSA-N 1 2 301.777 4.035 20 0 DIADLO COC[C@@]1(C)CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)C1 ZINC000450620735 1045527078 /nfs/dbraw/zinc/52/70/78/1045527078.db2.gz VYJJCPKHGUXHTF-INIZCTEOSA-N 1 2 324.346 4.116 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2cnc(C3CC3)o2)C2CC2)o1 ZINC000628131296 1045527502 /nfs/dbraw/zinc/52/75/02/1045527502.db2.gz VXPAEULGFSDPKC-YVEFUNNKSA-N 1 2 312.413 4.433 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cnc(C3CC3)o2)C2CC2)o1 ZINC000628131296 1045527515 /nfs/dbraw/zinc/52/75/15/1045527515.db2.gz VXPAEULGFSDPKC-YVEFUNNKSA-N 1 2 312.413 4.433 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2cnc(-c3ccccc3)s2)C[C@@H]1F ZINC001138527682 1045527582 /nfs/dbraw/zinc/52/75/82/1045527582.db2.gz RZBQRLGJUGEMME-GOEBONIOSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2cnc(-c3ccccc3)s2)C[C@@H]1F ZINC001138527682 1045527591 /nfs/dbraw/zinc/52/75/91/1045527591.db2.gz RZBQRLGJUGEMME-GOEBONIOSA-N 1 2 308.397 4.082 20 0 DIADLO CC(C)c1cc(Cl)ccc1NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000529848404 1045538514 /nfs/dbraw/zinc/53/85/14/1045538514.db2.gz KSEYOVGGOJVLLM-NSHDSACASA-N 1 2 305.809 4.004 20 0 DIADLO CC(C)c1cc(Cl)ccc1NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000529848404 1045538523 /nfs/dbraw/zinc/53/85/23/1045538523.db2.gz KSEYOVGGOJVLLM-NSHDSACASA-N 1 2 305.809 4.004 20 0 DIADLO CC(C)CN(C(=O)CCCn1cc[nH+]c1)c1cccc(Cl)c1 ZINC000654316944 1045540103 /nfs/dbraw/zinc/54/01/03/1045540103.db2.gz JWTUGLWYYKLLMZ-UHFFFAOYSA-N 1 2 319.836 4.006 20 0 DIADLO CC(C)CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2csnn2)cc1 ZINC000450667711 1045540581 /nfs/dbraw/zinc/54/05/81/1045540581.db2.gz MCXPAKBRZQZILI-ZIAGYGMSSA-N 1 2 319.474 4.375 20 0 DIADLO CC(C)Sc1ccc([C@H](C)[NH2+][C@@H](C)c2csnn2)cc1 ZINC000450666301 1045540683 /nfs/dbraw/zinc/54/06/83/1045540683.db2.gz HJRXQVUENREECU-RYUDHWBXSA-N 1 2 307.488 4.450 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc1 ZINC000450666461 1045541704 /nfs/dbraw/zinc/54/17/04/1045541704.db2.gz IHGOCEPKACICQF-NSHDSACASA-N 1 2 319.499 4.378 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2cnc(C)o2)c2ccc(C)cc2)cc1 ZINC000628209502 1045543903 /nfs/dbraw/zinc/54/39/03/1045543903.db2.gz HXCGVGUKLVRMBQ-HXUWFJFHSA-N 1 2 322.408 4.179 20 0 DIADLO Cc1nc2ccccc2n1C1CCN(c2cc(F)cc(C)[nH+]2)CC1 ZINC001120927700 1045548878 /nfs/dbraw/zinc/54/88/78/1045548878.db2.gz ATEDGJHBCSIMGK-UHFFFAOYSA-N 1 2 324.403 4.029 20 0 DIADLO COc1cccc2c(NC[C@H]3CCOC4(CCC4)C3)cc[nH+]c12 ZINC000450711688 1045552382 /nfs/dbraw/zinc/55/23/82/1045552382.db2.gz DEEBKXBNNNKFPA-AWEZNQCLSA-N 1 2 312.413 4.005 20 0 DIADLO CCO[C@@H]1CCN(c2cc[nH+]c3cc(F)c(Cl)cc32)C[C@H]1C ZINC000450749158 1045557985 /nfs/dbraw/zinc/55/79/85/1045557985.db2.gz WZAQTELFEYUKIK-PIGZYNQJSA-N 1 2 322.811 4.279 20 0 DIADLO Cc1cc(OC(=O)c2ccc(-n3cc[nH+]c3)cc2)ccc1Cl ZINC001122007883 1045560290 /nfs/dbraw/zinc/56/02/90/1045560290.db2.gz ROANXZZPHYQHKY-UHFFFAOYSA-N 1 2 312.756 4.053 20 0 DIADLO COCC[C@H](Nc1cccc[nH+]1)c1cccc(C(F)(F)F)c1 ZINC000450799345 1045569906 /nfs/dbraw/zinc/56/99/06/1045569906.db2.gz AUPCGGRBOMOFNI-AWEZNQCLSA-N 1 2 310.319 4.290 20 0 DIADLO COCC1(C2CCC2)C[NH+](Cc2csc(C(F)(F)F)c2)C1 ZINC000628338607 1045570585 /nfs/dbraw/zinc/57/05/85/1045570585.db2.gz PNSMHQQJQDNQGN-UHFFFAOYSA-N 1 2 319.392 4.015 20 0 DIADLO CCc1ccc([C@H]2C[N@H+](Cc3ccc(C(C)=O)cc3)CCO2)cc1 ZINC000450848886 1045576819 /nfs/dbraw/zinc/57/68/19/1045576819.db2.gz XUFCHGVIRQBNAN-OAQYLSRUSA-N 1 2 323.436 4.025 20 0 DIADLO CCc1ccc([C@H]2C[N@@H+](Cc3ccc(C(C)=O)cc3)CCO2)cc1 ZINC000450848886 1045576826 /nfs/dbraw/zinc/57/68/26/1045576826.db2.gz XUFCHGVIRQBNAN-OAQYLSRUSA-N 1 2 323.436 4.025 20 0 DIADLO CCCc1ncc(CNc2cc[nH+]c3c(Cl)cccc23)o1 ZINC000450867866 1045580573 /nfs/dbraw/zinc/58/05/73/1045580573.db2.gz VLIZQSOSOVFSJR-UHFFFAOYSA-N 1 2 301.777 4.441 20 0 DIADLO CC(C)(C)c1cnc(C[NH+]2CC(Cc3cccs3)C2)s1 ZINC000628478812 1045587730 /nfs/dbraw/zinc/58/77/30/1045587730.db2.gz QGYOGSVFOBPXPK-UHFFFAOYSA-N 1 2 306.500 4.177 20 0 DIADLO CC(C)(C)c1nc(C[NH+]2CC(Cc3cccs3)C2)cs1 ZINC000628478734 1045588114 /nfs/dbraw/zinc/58/81/14/1045588114.db2.gz NNPSOSQWBIIOQM-UHFFFAOYSA-N 1 2 306.500 4.177 20 0 DIADLO CC(C)c1nc(C[NH+]2CCC(F)(c3ccccn3)CC2)cs1 ZINC000450928498 1045595180 /nfs/dbraw/zinc/59/51/80/1045595180.db2.gz GRQVGQPQWCUQGL-UHFFFAOYSA-N 1 2 319.449 4.122 20 0 DIADLO CC[C@H](C)CCCCC(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000751427589 1045605463 /nfs/dbraw/zinc/60/54/63/1045605463.db2.gz JDJQOMXHAWWZDI-HOTGVXAUSA-N 1 2 307.482 4.021 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H](C)c3ccccc3)c2)[nH+]c1C ZINC000751443504 1045605695 /nfs/dbraw/zinc/60/56/95/1045605695.db2.gz VSLLWPDRKYZRKI-ZDUSSCGKSA-N 1 2 319.408 4.436 20 0 DIADLO CC[C@@H](C)CCCCC(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000751427588 1045605891 /nfs/dbraw/zinc/60/58/91/1045605891.db2.gz JDJQOMXHAWWZDI-CVEARBPZSA-N 1 2 307.482 4.021 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)c2ccccc21)c1csnn1 ZINC000451038284 1045612756 /nfs/dbraw/zinc/61/27/56/1045612756.db2.gz NBRICOIMMFELHJ-QWRGUYRKSA-N 1 2 301.390 4.242 20 0 DIADLO COc1ccc2c(c1)[C@H](Nc1ccc([NH+]3CCCC3)cc1)CC2 ZINC000320864780 1045621922 /nfs/dbraw/zinc/62/19/22/1045621922.db2.gz YOSIUWKKXYIELH-HXUWFJFHSA-N 1 2 308.425 4.395 20 0 DIADLO FC1(F)CCCC[C@H]1C[N@@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000451082175 1045623667 /nfs/dbraw/zinc/62/36/67/1045623667.db2.gz UFYZIBVJYCYDEE-HNNXBMFYSA-N 1 2 317.383 4.013 20 0 DIADLO FC1(F)CCCC[C@H]1C[N@H+]1Cc2cnn(-c3ccccc3)c2C1 ZINC000451082175 1045623670 /nfs/dbraw/zinc/62/36/70/1045623670.db2.gz UFYZIBVJYCYDEE-HNNXBMFYSA-N 1 2 317.383 4.013 20 0 DIADLO C[C@]12C[C@H]1CCC[C@@H]2[NH2+]c1ccc(N2CCSCC2)cc1 ZINC000800489322 1045628769 /nfs/dbraw/zinc/62/87/69/1045628769.db2.gz RXZKQEYKNRTHIK-JLSDUUJJSA-N 1 2 302.487 4.230 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(CSC(F)F)o1)c1nccs1 ZINC000078004335 1045630765 /nfs/dbraw/zinc/63/07/65/1045630765.db2.gz DMMNZCLXWUETPS-LLVKDONJSA-N 1 2 318.414 4.433 20 0 DIADLO C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+]1CCC[C@](C)(F)C1 ZINC000451123199 1045631306 /nfs/dbraw/zinc/63/13/06/1045631306.db2.gz UXKIGVYJZXROHA-ZBEGNZNMSA-N 1 2 323.799 4.275 20 0 DIADLO C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)[N@H+]1CCC[C@](C)(F)C1 ZINC000451123199 1045631312 /nfs/dbraw/zinc/63/13/12/1045631312.db2.gz UXKIGVYJZXROHA-ZBEGNZNMSA-N 1 2 323.799 4.275 20 0 DIADLO Cc1cc(F)cc([C@]2(F)CC[N@H+](Cc3ccc(F)nc3C)C2)c1 ZINC000800536836 1045639478 /nfs/dbraw/zinc/63/94/78/1045639478.db2.gz XOSVMCLFZVNJNJ-SFHVURJKSA-N 1 2 320.358 4.047 20 0 DIADLO Cc1cc(F)cc([C@]2(F)CC[N@@H+](Cc3ccc(F)nc3C)C2)c1 ZINC000800536836 1045639481 /nfs/dbraw/zinc/63/94/81/1045639481.db2.gz XOSVMCLFZVNJNJ-SFHVURJKSA-N 1 2 320.358 4.047 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)[C@@H](C)c2cccc(C)c2)n1 ZINC000121669817 1045639883 /nfs/dbraw/zinc/63/98/83/1045639883.db2.gz WDGDXVRROHPDGS-UONOGXRCSA-N 1 2 319.474 4.385 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)[C@@H](C)c2cccc(C)c2)n1 ZINC000121669817 1045639887 /nfs/dbraw/zinc/63/98/87/1045639887.db2.gz WDGDXVRROHPDGS-UONOGXRCSA-N 1 2 319.474 4.385 20 0 DIADLO Cc1cc(N2CCC(c3cccc(F)c3)CC2)nc(C2CC2)[nH+]1 ZINC000751968217 1045645539 /nfs/dbraw/zinc/64/55/39/1045645539.db2.gz WYTRMQNXZRZCIN-UHFFFAOYSA-N 1 2 311.404 4.186 20 0 DIADLO C[NH2+]c1ccc(NCc2ccc(OC(C)C)c(OC)c2)cc1 ZINC000629388982 1045665745 /nfs/dbraw/zinc/66/57/45/1045665745.db2.gz HHUDTTMTJQFFGC-UHFFFAOYSA-N 1 2 300.402 4.136 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)ccn1 ZINC000671098168 1045672495 /nfs/dbraw/zinc/67/24/95/1045672495.db2.gz HXEGUBQOOWLDFW-IFXJQAMLSA-N 1 2 308.381 4.123 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCn2ccnc21)c1cccc(Cl)c1Cl ZINC000655726735 1045675218 /nfs/dbraw/zinc/67/52/18/1045675218.db2.gz PCUJDQXEUSTKDT-MFKMUULPSA-N 1 2 310.228 4.376 20 0 DIADLO CC[C@H](C)c1ccccc1OC(=O)c1ccn2c(C)c[nH+]c2c1 ZINC001124417749 1045686570 /nfs/dbraw/zinc/68/65/70/1045686570.db2.gz TXQKXUNNCRTPFL-ZDUSSCGKSA-N 1 2 308.381 4.375 20 0 DIADLO C[C@@H](CC(=O)NC(C)(C)c1ccc2ccccc2c1)n1cc[nH+]c1 ZINC000629649438 1045689826 /nfs/dbraw/zinc/68/98/26/1045689826.db2.gz AIBIVQNKWPLWAM-HNNXBMFYSA-N 1 2 321.424 4.039 20 0 DIADLO C[N@@H+]1CCC(=O)C[C@H]1c1ccc(-c2cc(F)c(F)c(F)c2)cc1 ZINC000629710782 1045700975 /nfs/dbraw/zinc/70/09/75/1045700975.db2.gz KZBIKNGNCCXRKF-KRWDZBQOSA-N 1 2 319.326 4.107 20 0 DIADLO C[N@H+]1CCC(=O)C[C@H]1c1ccc(-c2cc(F)c(F)c(F)c2)cc1 ZINC000629710782 1045700984 /nfs/dbraw/zinc/70/09/84/1045700984.db2.gz KZBIKNGNCCXRKF-KRWDZBQOSA-N 1 2 319.326 4.107 20 0 DIADLO c1sc(C2CCCC2)nc1C[N@@H+]1CCSC[C@H]1C1CC1 ZINC000451649723 1045707118 /nfs/dbraw/zinc/70/71/18/1045707118.db2.gz SJIKHOCTXDONHU-HNNXBMFYSA-N 1 2 308.516 4.128 20 0 DIADLO c1sc(C2CCCC2)nc1C[N@H+]1CCSC[C@H]1C1CC1 ZINC000451649723 1045707128 /nfs/dbraw/zinc/70/71/28/1045707128.db2.gz SJIKHOCTXDONHU-HNNXBMFYSA-N 1 2 308.516 4.128 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@H+](C)Cc2ccsc2)c(Cl)c1 ZINC000629942767 1045726484 /nfs/dbraw/zinc/72/64/84/1045726484.db2.gz XFLKALFCAOJZTJ-LBPRGKRZSA-N 1 2 322.861 4.169 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)[N@@H+](C)Cc2ccsc2)c(Cl)c1 ZINC000629942767 1045726499 /nfs/dbraw/zinc/72/64/99/1045726499.db2.gz XFLKALFCAOJZTJ-LBPRGKRZSA-N 1 2 322.861 4.169 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(Br)n2)[C@H]1c1ccccc1 ZINC000779436142 1045727216 /nfs/dbraw/zinc/72/72/16/1045727216.db2.gz BXYQDDLVAXZQAU-MLGOLLRUSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(Br)n2)[C@H]1c1ccccc1 ZINC000779436142 1045727229 /nfs/dbraw/zinc/72/72/29/1045727229.db2.gz BXYQDDLVAXZQAU-MLGOLLRUSA-N 1 2 317.230 4.037 20 0 DIADLO CC(C)c1cc(N2CCN(c3ccccc3)CC2)nc(C(C)C)[nH+]1 ZINC000630343791 1045751107 /nfs/dbraw/zinc/75/11/07/1045751107.db2.gz WIFJMSSLAINYSC-UHFFFAOYSA-N 1 2 324.472 4.050 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1cnc(Cl)s1 ZINC000078670439 1045752473 /nfs/dbraw/zinc/75/24/73/1045752473.db2.gz UPZWLPJKYAADNU-QMMMGPOBSA-N 1 2 302.777 4.268 20 0 DIADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1cnc(Cl)s1 ZINC000078670439 1045752486 /nfs/dbraw/zinc/75/24/86/1045752486.db2.gz UPZWLPJKYAADNU-QMMMGPOBSA-N 1 2 302.777 4.268 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)CC2(C)CCCCC2)n1 ZINC000753478569 1045754299 /nfs/dbraw/zinc/75/42/99/1045754299.db2.gz RPAZEDNAGIUUHW-UHFFFAOYSA-N 1 2 323.506 4.284 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@@H+]1Cc1ncc(C2CC2)o1 ZINC000451984855 1045755681 /nfs/dbraw/zinc/75/56/81/1045755681.db2.gz HWGMPBUTEMUMHL-INIZCTEOSA-N 1 2 300.377 4.337 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@H+]1Cc1ncc(C2CC2)o1 ZINC000451984855 1045755695 /nfs/dbraw/zinc/75/56/95/1045755695.db2.gz HWGMPBUTEMUMHL-INIZCTEOSA-N 1 2 300.377 4.337 20 0 DIADLO Cc1nc(/C=C/c2c[nH+]cn2C(C)C)sc1Br ZINC000901518807 1045757468 /nfs/dbraw/zinc/75/74/68/1045757468.db2.gz ZCJDWGZUIMZNHP-SNAWJCMRSA-N 1 2 312.236 4.162 20 0 DIADLO Fc1cccc(-c2cnc(C[N@@H+]3CCC[C@@H]3c3ccccn3)o2)c1 ZINC000530962332 1045759444 /nfs/dbraw/zinc/75/94/44/1045759444.db2.gz NQOBQMVLELJUPN-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1cccc(-c2cnc(C[N@H+]3CCC[C@@H]3c3ccccn3)o2)c1 ZINC000530962332 1045759455 /nfs/dbraw/zinc/75/94/55/1045759455.db2.gz NQOBQMVLELJUPN-QGZVFWFLSA-N 1 2 323.371 4.213 20 0 DIADLO CCC(CC)[N@H+](Cc1noc(Cc2ccccc2C)n1)C1CC1 ZINC000530960962 1045762032 /nfs/dbraw/zinc/76/20/32/1045762032.db2.gz AXGQBBLIOYAJJW-UHFFFAOYSA-N 1 2 313.445 4.122 20 0 DIADLO CCC(CC)[N@@H+](Cc1noc(Cc2ccccc2C)n1)C1CC1 ZINC000530960962 1045762043 /nfs/dbraw/zinc/76/20/43/1045762043.db2.gz AXGQBBLIOYAJJW-UHFFFAOYSA-N 1 2 313.445 4.122 20 0 DIADLO C#CC[N@@H+](C)[C@@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 ZINC000192223916 1045793327 /nfs/dbraw/zinc/79/33/27/1045793327.db2.gz CWAMFOAKXGFWKF-JTQLQIEISA-N 1 2 309.196 4.274 20 0 DIADLO C#CC[N@H+](C)[C@@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 ZINC000192223916 1045793332 /nfs/dbraw/zinc/79/33/32/1045793332.db2.gz CWAMFOAKXGFWKF-JTQLQIEISA-N 1 2 309.196 4.274 20 0 DIADLO Cc1ccc(C)c(C[N@H+](C)Cc2nc(C(F)(F)F)cs2)c1 ZINC000531343978 1045828062 /nfs/dbraw/zinc/82/80/62/1045828062.db2.gz SLIJTYNSYURJCT-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1ccc(C)c(C[N@@H+](C)Cc2nc(C(F)(F)F)cs2)c1 ZINC000531343978 1045828077 /nfs/dbraw/zinc/82/80/77/1045828077.db2.gz SLIJTYNSYURJCT-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO C[C@H](CC(=O)Nc1ccc2c(c1)oc1ccccc12)n1cc[nH+]c1 ZINC001125004725 1045831323 /nfs/dbraw/zinc/83/13/23/1045831323.db2.gz BXRAZILTDMZWJA-CYBMUJFWSA-N 1 2 319.364 4.372 20 0 DIADLO O[C@@]1(CNc2cc3ccccc3c[nH+]2)CCC[C@H](C(F)(F)F)C1 ZINC000631232813 1045838957 /nfs/dbraw/zinc/83/89/57/1045838957.db2.gz IBCXYVOHSOJQJK-HOCLYGCPSA-N 1 2 324.346 4.130 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2csc(-c3ccsc3)n2)s1 ZINC000631223746 1045839410 /nfs/dbraw/zinc/83/94/10/1045839410.db2.gz GDODWRQGXLBNMO-SECBINFHSA-N 1 2 321.496 4.487 20 0 DIADLO CC[N@H+](Cc1ccncc1)[C@@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000754052915 1045841357 /nfs/dbraw/zinc/84/13/57/1045841357.db2.gz DFBPPXYDUBVGLL-HNNXBMFYSA-N 1 2 322.412 4.023 20 0 DIADLO CC[N@@H+](Cc1ccncc1)[C@@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000754052915 1045841385 /nfs/dbraw/zinc/84/13/85/1045841385.db2.gz DFBPPXYDUBVGLL-HNNXBMFYSA-N 1 2 322.412 4.023 20 0 DIADLO CC1(C)CC[C@H]1C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001125053128 1045842333 /nfs/dbraw/zinc/84/23/33/1045842333.db2.gz WYPIYVUZFAELBC-KRWDZBQOSA-N 1 2 323.440 4.261 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)CCSC(C)(C)C)cs1 ZINC000801923511 1045844757 /nfs/dbraw/zinc/84/47/57/1045844757.db2.gz JHSNRGYSOPSWAS-GFCCVEGCSA-N 1 2 316.536 4.204 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)CCSC(C)(C)C)cs1 ZINC000801923511 1045844763 /nfs/dbraw/zinc/84/47/63/1045844763.db2.gz JHSNRGYSOPSWAS-GFCCVEGCSA-N 1 2 316.536 4.204 20 0 DIADLO CC(C)(C)c1ncc(C[NH2+][C@H](CF)c2ccc(F)cc2)s1 ZINC000631283098 1045844991 /nfs/dbraw/zinc/84/49/91/1045844991.db2.gz HVEZMCWBAXZQDU-CQSZACIVSA-N 1 2 310.413 4.380 20 0 DIADLO COc1cc(C[NH2+][C@@H](CF)c2ccc(F)cc2)ccc1SC ZINC000631285123 1045846788 /nfs/dbraw/zinc/84/67/88/1045846788.db2.gz XRTHLHNXGQAQAN-HNNXBMFYSA-N 1 2 323.408 4.357 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1ccccc1C1CCC1 ZINC001125083251 1045847130 /nfs/dbraw/zinc/84/71/30/1045847130.db2.gz AKUJQIVJZMXCNK-UHFFFAOYSA-N 1 2 317.392 4.392 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC001125083273 1045848030 /nfs/dbraw/zinc/84/80/30/1045848030.db2.gz BCHDORDBPDEBGC-IXDOHACOSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1nc2cc(Cl)ccc2s1 ZINC000754157241 1045857831 /nfs/dbraw/zinc/85/78/31/1045857831.db2.gz UARXBSIGOHRXQL-MRVPVSSYSA-N 1 2 321.833 4.405 20 0 DIADLO CC(C)[N@H+](Cc1nc(C(C)(C)C)cs1)Cc1ccccn1 ZINC000531524864 1045862915 /nfs/dbraw/zinc/86/29/15/1045862915.db2.gz JGAJZNSKVKZTHI-UHFFFAOYSA-N 1 2 303.475 4.246 20 0 DIADLO CC(C)[N@@H+](Cc1nc(C(C)(C)C)cs1)Cc1ccccn1 ZINC000531524864 1045862930 /nfs/dbraw/zinc/86/29/30/1045862930.db2.gz JGAJZNSKVKZTHI-UHFFFAOYSA-N 1 2 303.475 4.246 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@@H](c2nccn2C)c2ccccc2)c1 ZINC000531688396 1045891327 /nfs/dbraw/zinc/89/13/27/1045891327.db2.gz SDFNEMVRJITFPK-VQIMIIECSA-N 1 2 305.425 4.169 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccc(C)cc2OC)cs1 ZINC000531715790 1045905884 /nfs/dbraw/zinc/90/58/84/1045905884.db2.gz FRQJWHCDSAKZOF-OLZOCXBDSA-N 1 2 304.459 4.434 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2noc(-c3ccccc3C)n2)s1 ZINC000754664948 1045906621 /nfs/dbraw/zinc/90/66/21/1045906621.db2.gz UMCLYVOZVRMDEH-CYBMUJFWSA-N 1 2 313.426 4.266 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2ccc3oc4ccccc4c3c2)n1 ZINC000754682660 1045912400 /nfs/dbraw/zinc/91/24/00/1045912400.db2.gz AMHFRXZNDNSFAW-NSHDSACASA-N 1 2 307.353 4.128 20 0 DIADLO C[C@H]([NH2+]Cc1c(Cl)cccc1OC(F)F)c1ccco1 ZINC000631772366 1045918274 /nfs/dbraw/zinc/91/82/74/1045918274.db2.gz DLSPSXADCPHSFS-VIFPVBQESA-N 1 2 301.720 4.385 20 0 DIADLO C[C@@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1ccccc1N(C)C ZINC000631797462 1045919952 /nfs/dbraw/zinc/91/99/52/1045919952.db2.gz BAABWIZPPNAUPR-CXAGYDPISA-N 1 2 304.384 4.253 20 0 DIADLO C[C@@H]1C[C@H]([NH2+][C@@H](CC(F)(F)F)c2ccccc2)c2nccn21 ZINC000453057131 1045920138 /nfs/dbraw/zinc/92/01/38/1045920138.db2.gz GZCMMKLEXUMNSU-XBFCOCLRSA-N 1 2 309.335 4.172 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)cc1OC ZINC000631795315 1045920626 /nfs/dbraw/zinc/92/06/26/1045920626.db2.gz HZTZHNTZZNYLTO-MLGOLLRUSA-N 1 2 321.367 4.204 20 0 DIADLO CCCc1noc(C[NH2+][C@@H](C)c2csc3ccccc23)n1 ZINC000754744177 1045923547 /nfs/dbraw/zinc/92/35/47/1045923547.db2.gz QFBOJQFFTUPJTJ-NSHDSACASA-N 1 2 301.415 4.088 20 0 DIADLO Fc1cc(Cl)ccc1C[N@@H+]1CC[C@H]1COCc1ccccc1 ZINC001137660655 1045925335 /nfs/dbraw/zinc/92/53/35/1045925335.db2.gz YRAYBBHCOVANGR-KRWDZBQOSA-N 1 2 319.807 4.270 20 0 DIADLO Fc1cc(Cl)ccc1C[N@H+]1CC[C@H]1COCc1ccccc1 ZINC001137660655 1045925345 /nfs/dbraw/zinc/92/53/45/1045925345.db2.gz YRAYBBHCOVANGR-KRWDZBQOSA-N 1 2 319.807 4.270 20 0 DIADLO CC(C)c1ccc([C@H](C)OC(=O)CCc2ccc(N)[nH+]c2)cc1 ZINC000754856045 1045933943 /nfs/dbraw/zinc/93/39/43/1045933943.db2.gz AKMNWOUPTOHMLO-AWEZNQCLSA-N 1 2 312.413 4.024 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001137751984 1045956745 /nfs/dbraw/zinc/95/67/45/1045956745.db2.gz VXTBTFUXSYRKIH-HNNXBMFYSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001137751984 1045956752 /nfs/dbraw/zinc/95/67/52/1045956752.db2.gz VXTBTFUXSYRKIH-HNNXBMFYSA-N 1 2 324.255 4.372 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1ccc(C)cc1Br ZINC001137807205 1045970079 /nfs/dbraw/zinc/97/00/79/1045970079.db2.gz NBEMAUYVFRACQO-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1ccc(C)cc1Br ZINC001137807205 1045970084 /nfs/dbraw/zinc/97/00/84/1045970084.db2.gz NBEMAUYVFRACQO-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO Cc1ccccc1OC1CC[NH+](Cc2scnc2Cl)CC1 ZINC001137817378 1045973338 /nfs/dbraw/zinc/97/33/38/1045973338.db2.gz QRHUOQJTZFUVNT-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+][C@@H](CC)C(F)F)cc1OCC ZINC000453246112 1046000423 /nfs/dbraw/zinc/00/04/23/1046000423.db2.gz MEMYVXYLEAACTN-AAEUAGOBSA-N 1 2 301.377 4.178 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(F)c(F)c2F)c1 ZINC001137940316 1046025613 /nfs/dbraw/zinc/02/56/13/1046025613.db2.gz SANDUXLTLZFGPL-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2ccc(F)c(F)c2F)c1 ZINC001137940316 1046025628 /nfs/dbraw/zinc/02/56/28/1046025628.db2.gz SANDUXLTLZFGPL-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1ccc(F)c(F)c1F ZINC001137940253 1046026509 /nfs/dbraw/zinc/02/65/09/1046026509.db2.gz PQKVLZNIMLBSHT-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1ccc(F)c(F)c1F ZINC001137940253 1046026521 /nfs/dbraw/zinc/02/65/21/1046026521.db2.gz PQKVLZNIMLBSHT-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(SC(F)(F)F)cc2)CCC1=O ZINC001137955019 1046030729 /nfs/dbraw/zinc/03/07/29/1046030729.db2.gz BVRCSDXMAZRFDR-UHFFFAOYSA-N 1 2 317.376 4.100 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(SC(F)(F)F)cc2)CCC1=O ZINC001137955019 1046030743 /nfs/dbraw/zinc/03/07/43/1046030743.db2.gz BVRCSDXMAZRFDR-UHFFFAOYSA-N 1 2 317.376 4.100 20 0 DIADLO FC[C@@]1(C(F)(F)F)CC[N@H+](Cc2cccc(Cl)c2F)C1 ZINC001137957870 1046034279 /nfs/dbraw/zinc/03/42/79/1046034279.db2.gz RXMNVFNYYNOBFD-LBPRGKRZSA-N 1 2 313.697 4.203 20 0 DIADLO FC[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cccc(Cl)c2F)C1 ZINC001137957870 1046034291 /nfs/dbraw/zinc/03/42/91/1046034291.db2.gz RXMNVFNYYNOBFD-LBPRGKRZSA-N 1 2 313.697 4.203 20 0 DIADLO Cc1ccc(C[N@H+](C)CCC(=O)c2cccs2)c(F)c1F ZINC001137971548 1046038682 /nfs/dbraw/zinc/03/86/82/1046038682.db2.gz YNGURODBJHLLDS-UHFFFAOYSA-N 1 2 309.381 4.040 20 0 DIADLO Cc1ccc(C[N@@H+](C)CCC(=O)c2cccs2)c(F)c1F ZINC001137971548 1046038692 /nfs/dbraw/zinc/03/86/92/1046038692.db2.gz YNGURODBJHLLDS-UHFFFAOYSA-N 1 2 309.381 4.040 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccccc1C(C)(C)C ZINC000453325807 1046040693 /nfs/dbraw/zinc/04/06/93/1046040693.db2.gz SEYJOSGDKHIWPQ-GFCCVEGCSA-N 1 2 305.853 4.222 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](c1cc(F)ccc1F)C(C)C ZINC000453335904 1046042065 /nfs/dbraw/zinc/04/20/65/1046042065.db2.gz FBUUUDJYLQDKFS-WBMJQRKESA-N 1 2 307.388 4.229 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nccn1CC)c1cccc(Cl)c1F ZINC000453353051 1046052065 /nfs/dbraw/zinc/05/20/65/1046052065.db2.gz NGCAANWWMHUEKA-SMDDNHRTSA-N 1 2 309.816 4.497 20 0 DIADLO Fc1ccc(F)c(C[NH+]2CCC(c3cccnc3)CC2)c1Cl ZINC001138005225 1046052327 /nfs/dbraw/zinc/05/23/27/1046052327.db2.gz RKKKDJOZTAUUMH-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001137998002 1046052884 /nfs/dbraw/zinc/05/28/84/1046052884.db2.gz OCCBJRXXXMXLOW-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001137998002 1046052900 /nfs/dbraw/zinc/05/29/00/1046052900.db2.gz OCCBJRXXXMXLOW-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nccn1CC)c1cc(Cl)ccc1OC ZINC000453355998 1046056159 /nfs/dbraw/zinc/05/61/59/1046056159.db2.gz OVMWTNRMBXXEKB-DOMZBBRYSA-N 1 2 321.852 4.367 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)cn1 ZINC000453382870 1046060455 /nfs/dbraw/zinc/06/04/55/1046060455.db2.gz YORAFNDEZQNNEH-SNVBAGLBSA-N 1 2 315.364 4.025 20 0 DIADLO CC[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1cc(Cl)ccc1OC ZINC000453361285 1046063429 /nfs/dbraw/zinc/06/34/29/1046063429.db2.gz QUAJKQKHVQNLCO-CQDKDKBSSA-N 1 2 319.836 4.292 20 0 DIADLO CC[NH+](CC)[C@H](C(=O)Oc1ccc2cc[nH]c2c1)c1ccccc1 ZINC000802963096 1046092121 /nfs/dbraw/zinc/09/21/21/1046092121.db2.gz PZWVJNLSJGIDAX-IBGZPJMESA-N 1 2 322.408 4.156 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Cl)cc2)C[C@@H](c2ccsc2)O1 ZINC000532098068 1046098809 /nfs/dbraw/zinc/09/88/09/1046098809.db2.gz FIXZMCXYJJVQKK-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Cl)cc2)C[C@@H](c2ccsc2)O1 ZINC000532098068 1046098822 /nfs/dbraw/zinc/09/88/22/1046098822.db2.gz FIXZMCXYJJVQKK-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2CC[C@H]2COCc2ccccc2)c1F ZINC001138118542 1046099554 /nfs/dbraw/zinc/09/95/54/1046099554.db2.gz NQASTQIOQVHFRR-INIZCTEOSA-N 1 2 317.379 4.064 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2CC[C@H]2COCc2ccccc2)c1F ZINC001138118542 1046099568 /nfs/dbraw/zinc/09/95/68/1046099568.db2.gz NQASTQIOQVHFRR-INIZCTEOSA-N 1 2 317.379 4.064 20 0 DIADLO Fc1cc(F)c(F)c(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)c1F ZINC001138236689 1046124858 /nfs/dbraw/zinc/12/48/58/1046124858.db2.gz LYVADCCNFHUILB-SNVBAGLBSA-N 1 2 319.317 4.347 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@H+](C)Cc2ccoc2C)cc1 ZINC000195616860 1046127064 /nfs/dbraw/zinc/12/70/64/1046127064.db2.gz USPANJJOJOGLLM-CQSZACIVSA-N 1 2 314.429 4.172 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)C[N@@H+](C)Cc2ccoc2C)cc1 ZINC000195616860 1046127073 /nfs/dbraw/zinc/12/70/73/1046127073.db2.gz USPANJJOJOGLLM-CQSZACIVSA-N 1 2 314.429 4.172 20 0 DIADLO C[C@@H](Nc1cnn([C@@H](C)C2CC2)c1)c1cccc(-n2cc[nH+]c2)c1 ZINC000902962579 1046129090 /nfs/dbraw/zinc/12/90/90/1046129090.db2.gz HJRODWGMVPLESE-CABCVRRESA-N 1 2 321.428 4.213 20 0 DIADLO CC(C)(C)c1[nH]c2ccccc2c1C[N@@H+]1C[C@@H](F)C[C@H]1CF ZINC001138310065 1046144421 /nfs/dbraw/zinc/14/44/21/1046144421.db2.gz ABJXGZDTYFXINO-STQMWFEESA-N 1 2 306.400 4.347 20 0 DIADLO CC(C)(C)c1[nH]c2ccccc2c1C[N@H+]1C[C@@H](F)C[C@H]1CF ZINC001138310065 1046144425 /nfs/dbraw/zinc/14/44/25/1046144425.db2.gz ABJXGZDTYFXINO-STQMWFEESA-N 1 2 306.400 4.347 20 0 DIADLO CCCO[C@@H]1CC[N@H+](Cc2c(Cl)cc(OC)cc2Cl)C1 ZINC001142292558 1046146719 /nfs/dbraw/zinc/14/67/19/1046146719.db2.gz GJVLHLCCUGDGPV-LLVKDONJSA-N 1 2 318.244 4.003 20 0 DIADLO CCCO[C@@H]1CC[N@@H+](Cc2c(Cl)cc(OC)cc2Cl)C1 ZINC001142292558 1046146730 /nfs/dbraw/zinc/14/67/30/1046146730.db2.gz GJVLHLCCUGDGPV-LLVKDONJSA-N 1 2 318.244 4.003 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2ccc(C(F)(F)F)s2)c1 ZINC000903042786 1046147240 /nfs/dbraw/zinc/14/72/40/1046147240.db2.gz ICIGGQKPZRXZOE-SECBINFHSA-N 1 2 316.348 4.481 20 0 DIADLO COc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001138376964 1046158811 /nfs/dbraw/zinc/15/88/11/1046158811.db2.gz ZDTMWUQBTOCYBQ-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)cc1C[N@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001138376964 1046158817 /nfs/dbraw/zinc/15/88/17/1046158817.db2.gz ZDTMWUQBTOCYBQ-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1c2ccccc2[nH]c1C[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC001138397651 1046164170 /nfs/dbraw/zinc/16/41/70/1046164170.db2.gz YYGIJQQUDVSBCX-HXUWFJFHSA-N 1 2 306.409 4.050 20 0 DIADLO Cc1c2ccccc2[nH]c1C[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC001138397651 1046164175 /nfs/dbraw/zinc/16/41/75/1046164175.db2.gz YYGIJQQUDVSBCX-HXUWFJFHSA-N 1 2 306.409 4.050 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2nc(Cl)cs2)CC2CC2)cc1 ZINC001461924384 1046164846 /nfs/dbraw/zinc/16/48/46/1046164846.db2.gz COHJBBIFCRMKCY-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO Fc1ccc(C[N@H+](Cc2nc(Cl)cs2)CC2CC2)cc1 ZINC001461924384 1046164856 /nfs/dbraw/zinc/16/48/56/1046164856.db2.gz COHJBBIFCRMKCY-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO COc1ccc2c(c1Cl)[C@H]([NH2+]Cc1ncccc1F)CCC2 ZINC000903127821 1046169725 /nfs/dbraw/zinc/16/97/25/1046169725.db2.gz MDIYBSKRYMBKMJ-CYBMUJFWSA-N 1 2 320.795 4.050 20 0 DIADLO Cc1c(C[N@@H+]2CCOC[C@@H]2c2ccccc2)[nH]c2ccc(F)cc12 ZINC001138409775 1046170248 /nfs/dbraw/zinc/17/02/48/1046170248.db2.gz GSNLQFLOGBYFHB-HXUWFJFHSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1c(C[N@H+]2CCOC[C@@H]2c2ccccc2)[nH]c2ccc(F)cc12 ZINC001138409775 1046170254 /nfs/dbraw/zinc/17/02/54/1046170254.db2.gz GSNLQFLOGBYFHB-HXUWFJFHSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC000635065985 1046173660 /nfs/dbraw/zinc/17/36/60/1046173660.db2.gz VXFZYUZWYNCSFW-OAHLLOKOSA-N 1 2 305.809 4.071 20 0 DIADLO Cc1ccc2[nH]c(C[N@@H+](C)Cc3ccc(F)cc3F)cc2c1 ZINC001138418060 1046175420 /nfs/dbraw/zinc/17/54/20/1046175420.db2.gz PMAAHLQUKBPXPE-UHFFFAOYSA-N 1 2 300.352 4.387 20 0 DIADLO Cc1ccc2[nH]c(C[N@H+](C)Cc3ccc(F)cc3F)cc2c1 ZINC001138418060 1046175426 /nfs/dbraw/zinc/17/54/26/1046175426.db2.gz PMAAHLQUKBPXPE-UHFFFAOYSA-N 1 2 300.352 4.387 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3nc(Cl)ccc3C2)c(C)c1 ZINC001138434389 1046180495 /nfs/dbraw/zinc/18/04/95/1046180495.db2.gz RLDWWRPSSZAUBV-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3nc(Cl)ccc3C2)c(C)c1 ZINC001138434389 1046180507 /nfs/dbraw/zinc/18/05/07/1046180507.db2.gz RLDWWRPSSZAUBV-UHFFFAOYSA-N 1 2 316.832 4.000 20 0 DIADLO COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1nc2c(s1)CCC2 ZINC000903193068 1046189685 /nfs/dbraw/zinc/18/96/85/1046189685.db2.gz QDHWTTMUMTUCKX-SNVBAGLBSA-N 1 2 322.861 4.145 20 0 DIADLO Cc1c2ccccc2sc1C[N@@H+]1CCOC[C@@H]1c1cccnc1 ZINC001138464022 1046192458 /nfs/dbraw/zinc/19/24/58/1046192458.db2.gz PHIYEYXGIOTELM-QGZVFWFLSA-N 1 2 324.449 4.178 20 0 DIADLO Cc1c2ccccc2sc1C[N@H+]1CCOC[C@@H]1c1cccnc1 ZINC001138464022 1046192470 /nfs/dbraw/zinc/19/24/70/1046192470.db2.gz PHIYEYXGIOTELM-QGZVFWFLSA-N 1 2 324.449 4.178 20 0 DIADLO C[C@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1cnn(CC2CCC2)c1 ZINC000903214762 1046196514 /nfs/dbraw/zinc/19/65/14/1046196514.db2.gz XFMAUPNQPNUJRF-UGSOOPFHSA-N 1 2 319.399 4.184 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1F)Cc1cc(C)ccc1OC ZINC001138489124 1046199112 /nfs/dbraw/zinc/19/91/12/1046199112.db2.gz OAKKBVMLBFSDOA-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1F)Cc1cc(C)ccc1OC ZINC001138489124 1046199118 /nfs/dbraw/zinc/19/91/18/1046199118.db2.gz OAKKBVMLBFSDOA-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO Cc1ccc(Cl)c(NC(=O)[C@H](CC(C)C)n2cc[nH+]c2)c1 ZINC000635690032 1046202532 /nfs/dbraw/zinc/20/25/32/1046202532.db2.gz OPQOWBWKSSLWLJ-HNNXBMFYSA-N 1 2 305.809 4.071 20 0 DIADLO CC(C)C[C@@H](C(=O)Nc1cccc(C(C)(F)F)c1)n1cc[nH+]c1 ZINC000635832093 1046206812 /nfs/dbraw/zinc/20/68/12/1046206812.db2.gz SFFHYQWROVZKRY-HNNXBMFYSA-N 1 2 321.371 4.221 20 0 DIADLO CC(=O)Nc1ccc(SCc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000012806953 1046228216 /nfs/dbraw/zinc/22/82/16/1046228216.db2.gz DZEBHPKXOSUERS-UHFFFAOYSA-N 1 2 323.421 4.123 20 0 DIADLO Clc1ccc2c(c1)CN(Cc1c[nH+]cn1Cc1ccccc1)C2 ZINC001138564226 1046228555 /nfs/dbraw/zinc/22/85/55/1046228555.db2.gz JLBZXUVPIKPKEL-UHFFFAOYSA-N 1 2 323.827 4.101 20 0 DIADLO Cc1cc(C[NH+](Cc2cccnc2)Cc2cccnc2)c(C)s1 ZINC001138567857 1046229682 /nfs/dbraw/zinc/22/96/82/1046229682.db2.gz LNDUIHWBPSDWGN-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO CC[C@@H]([NH2+][C@H](c1ncccn1)C1CC1)c1sccc1Cl ZINC000903321991 1046236146 /nfs/dbraw/zinc/23/61/46/1046236146.db2.gz FITFRKHDVXBECC-OLZOCXBDSA-N 1 2 307.850 4.384 20 0 DIADLO COc1cccc2cc([C@H](C)[NH2+][C@H](c3ncccn3)C3CC3)oc21 ZINC000903327155 1046238622 /nfs/dbraw/zinc/23/86/22/1046238622.db2.gz PZZITOSPGDHKKI-SJCJKPOMSA-N 1 2 323.396 4.033 20 0 DIADLO COc1cccc2cc([C@H](C)[NH2+][C@@H](c3ncccn3)C3CC3)oc21 ZINC000903327157 1046239650 /nfs/dbraw/zinc/23/96/50/1046239650.db2.gz PZZITOSPGDHKKI-YVEFUNNKSA-N 1 2 323.396 4.033 20 0 DIADLO COc1cccc2cc([C@@H](C)[NH2+][C@@H](c3ncccn3)C3CC3)oc21 ZINC000903327156 1046239786 /nfs/dbraw/zinc/23/97/86/1046239786.db2.gz PZZITOSPGDHKKI-SJKOYZFVSA-N 1 2 323.396 4.033 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@H](c1ncccc1C)C(C)(C)C ZINC000903328043 1046241975 /nfs/dbraw/zinc/24/19/75/1046241975.db2.gz DDKLFZAGDBDUPV-KBXCAEBGSA-N 1 2 313.445 4.441 20 0 DIADLO COc1ccc(-c2cccc(C[N@H+](C)Cc3cscn3)c2)cc1 ZINC001138617471 1046243881 /nfs/dbraw/zinc/24/38/81/1046243881.db2.gz HGOLWSPEEKKBBG-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1ccc(-c2cccc(C[N@@H+](C)Cc3cscn3)c2)cc1 ZINC001138617471 1046243895 /nfs/dbraw/zinc/24/38/95/1046243895.db2.gz HGOLWSPEEKKBBG-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO CCC[C@H]([NH2+][C@H](C)c1cc(OC)no1)c1ccc(F)cc1F ZINC000925266082 1046245233 /nfs/dbraw/zinc/24/52/33/1046245233.db2.gz WYMRJAWTNVWBNY-YGRLFVJLSA-N 1 2 310.344 4.153 20 0 DIADLO CCC[C@H]([NH2+][C@@H](C)c1cc(OC)no1)c1ccc(F)cc1F ZINC000925266078 1046245337 /nfs/dbraw/zinc/24/53/37/1046245337.db2.gz WYMRJAWTNVWBNY-HZMBPMFUSA-N 1 2 310.344 4.153 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)Cc1cccc(F)c1 ZINC000102654903 1046251913 /nfs/dbraw/zinc/25/19/13/1046251913.db2.gz GABIAJWHDLNGGK-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)Cc1cccc(F)c1 ZINC000102654903 1046251930 /nfs/dbraw/zinc/25/19/30/1046251930.db2.gz GABIAJWHDLNGGK-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO CCc1noc(C[NH2+]C2(c3ccc(Cl)cc3)CCCCC2)n1 ZINC000102655955 1046252172 /nfs/dbraw/zinc/25/21/72/1046252172.db2.gz YJBDPDXSUIUALU-UHFFFAOYSA-N 1 2 319.836 4.235 20 0 DIADLO COc1cccc2c1CC[N@H+](Cc1cc(F)ccc1Cl)C2 ZINC001138674903 1046263744 /nfs/dbraw/zinc/26/37/44/1046263744.db2.gz GQIVLRXNCUURGL-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc2c1CC[N@@H+](Cc1cc(F)ccc1Cl)C2 ZINC001138674903 1046263753 /nfs/dbraw/zinc/26/37/53/1046263753.db2.gz GQIVLRXNCUURGL-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CSc1ncc(C[N@H+](C)[C@H](C)c2ccccc2Cl)cn1 ZINC001138707594 1046273696 /nfs/dbraw/zinc/27/36/96/1046273696.db2.gz NYNNPPFKDGCNBP-LLVKDONJSA-N 1 2 307.850 4.045 20 0 DIADLO CSc1ncc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)cn1 ZINC001138707594 1046273704 /nfs/dbraw/zinc/27/37/04/1046273704.db2.gz NYNNPPFKDGCNBP-LLVKDONJSA-N 1 2 307.850 4.045 20 0 DIADLO CSc1ncc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)cn1 ZINC001138705692 1046275031 /nfs/dbraw/zinc/27/50/31/1046275031.db2.gz YYTZLDLTYNAAOS-HNNXBMFYSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1ncc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)cn1 ZINC001138705692 1046275042 /nfs/dbraw/zinc/27/50/42/1046275042.db2.gz YYTZLDLTYNAAOS-HNNXBMFYSA-N 1 2 319.861 4.189 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)s1)[C@H](c1nccn1C)C1CC1 ZINC000637866054 1046280459 /nfs/dbraw/zinc/28/04/59/1046280459.db2.gz KTMJUNKEDPWHBB-AWEZNQCLSA-N 1 2 309.866 4.108 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)s1)[C@H](c1nccn1C)C1CC1 ZINC000637866054 1046280467 /nfs/dbraw/zinc/28/04/67/1046280467.db2.gz KTMJUNKEDPWHBB-AWEZNQCLSA-N 1 2 309.866 4.108 20 0 DIADLO Cc1ncc([C@H](C)[N@H+](Cc2ccco2)Cc2ccccc2)c(C)n1 ZINC000637859627 1046280736 /nfs/dbraw/zinc/28/07/36/1046280736.db2.gz GAVAPQOVGPPCFB-INIZCTEOSA-N 1 2 321.424 4.450 20 0 DIADLO Cc1ncc([C@H](C)[N@@H+](Cc2ccco2)Cc2ccccc2)c(C)n1 ZINC000637859627 1046280749 /nfs/dbraw/zinc/28/07/49/1046280749.db2.gz GAVAPQOVGPPCFB-INIZCTEOSA-N 1 2 321.424 4.450 20 0 DIADLO c1cc([C@@H]2CCC[N@@H+]2[C@H](c2nnc[nH]2)C2CCCCC2)cs1 ZINC000637909993 1046287163 /nfs/dbraw/zinc/28/71/63/1046287163.db2.gz MUCYUWQHMBWPGA-HOTGVXAUSA-N 1 2 316.474 4.325 20 0 DIADLO c1cc([C@@H]2CCC[N@H+]2[C@H](c2nnc[nH]2)C2CCCCC2)cs1 ZINC000637909993 1046287166 /nfs/dbraw/zinc/28/71/66/1046287166.db2.gz MUCYUWQHMBWPGA-HOTGVXAUSA-N 1 2 316.474 4.325 20 0 DIADLO COc1cc(Cl)cc(C[N@H+](C)Cc2ccccc2F)c1OC ZINC001138747021 1046287323 /nfs/dbraw/zinc/28/73/23/1046287323.db2.gz RSSVCPKBDYOHGG-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+](C)Cc2ccccc2F)c1OC ZINC001138747021 1046287338 /nfs/dbraw/zinc/28/73/38/1046287338.db2.gz RSSVCPKBDYOHGG-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO c1cc([C@@H]2CCC[N@@H+]2[C@@H](c2nnc[nH]2)C2CCCCC2)cs1 ZINC000637909997 1046288036 /nfs/dbraw/zinc/28/80/36/1046288036.db2.gz MUCYUWQHMBWPGA-JKSUJKDBSA-N 1 2 316.474 4.325 20 0 DIADLO c1cc([C@@H]2CCC[N@H+]2[C@@H](c2nnc[nH]2)C2CCCCC2)cs1 ZINC000637909997 1046288046 /nfs/dbraw/zinc/28/80/46/1046288046.db2.gz MUCYUWQHMBWPGA-JKSUJKDBSA-N 1 2 316.474 4.325 20 0 DIADLO Cc1csc([C@@H]2CCCC[N@H+]2[C@H](C)c2cnc(C)nc2C)n1 ZINC000638000008 1046291173 /nfs/dbraw/zinc/29/11/73/1046291173.db2.gz MHCLHRNYUQJUNR-CJNGLKHVSA-N 1 2 316.474 4.147 20 0 DIADLO Cc1csc([C@@H]2CCCC[N@@H+]2[C@H](C)c2cnc(C)nc2C)n1 ZINC000638000008 1046291182 /nfs/dbraw/zinc/29/11/82/1046291182.db2.gz MHCLHRNYUQJUNR-CJNGLKHVSA-N 1 2 316.474 4.147 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2c[nH]c3c2cccc3Cl)no1 ZINC001138830402 1046304174 /nfs/dbraw/zinc/30/41/74/1046304174.db2.gz KZKCJIVRIJDGFT-MRXNPFEDSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2c[nH]c3c2cccc3Cl)no1 ZINC001138830402 1046304187 /nfs/dbraw/zinc/30/41/87/1046304187.db2.gz KZKCJIVRIJDGFT-MRXNPFEDSA-N 1 2 315.804 4.455 20 0 DIADLO O=C1CC[N@@H+](Cc2c[nH]c3c2cccc3Cl)[C@@H]2CCCC[C@@H]12 ZINC001138830413 1046304816 /nfs/dbraw/zinc/30/48/16/1046304816.db2.gz LQUFSLYYXKQNGV-GDBMZVCRSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c[nH]c3c2cccc3Cl)[C@@H]2CCCC[C@@H]12 ZINC001138830413 1046304832 /nfs/dbraw/zinc/30/48/32/1046304832.db2.gz LQUFSLYYXKQNGV-GDBMZVCRSA-N 1 2 316.832 4.155 20 0 DIADLO Cc1ccc2cc(C[NH+]3CC4(C3)CC(F)(F)C4)c(Cl)nc2c1 ZINC001138858476 1046309051 /nfs/dbraw/zinc/30/90/51/1046309051.db2.gz IIMIZGXEAGGGOT-UHFFFAOYSA-N 1 2 322.786 4.428 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nnc[nH]1)C1CCCCC1)c1ccc(Cl)s1 ZINC000638337084 1046314372 /nfs/dbraw/zinc/31/43/72/1046314372.db2.gz MBXAKLOYLYDSHI-YGRLFVJLSA-N 1 2 324.881 4.492 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@H+](C)Cc1csc(C(C)(C)O)n1 ZINC000832379406 1046315809 /nfs/dbraw/zinc/31/58/09/1046315809.db2.gz JKHQKWCPEYJAFM-OAHLLOKOSA-N 1 2 322.449 4.093 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1csc(C(C)(C)O)n1 ZINC000832379406 1046315821 /nfs/dbraw/zinc/31/58/21/1046315821.db2.gz JKHQKWCPEYJAFM-OAHLLOKOSA-N 1 2 322.449 4.093 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)cnc2Cl)cc1 ZINC001138892759 1046321569 /nfs/dbraw/zinc/32/15/69/1046321569.db2.gz XVCFRJIAMUGVHR-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)cnc2Cl)cc1 ZINC001138892759 1046321577 /nfs/dbraw/zinc/32/15/77/1046321577.db2.gz XVCFRJIAMUGVHR-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO C[N@@H+](Cc1cccc2cccnc21)Cc1cc(F)cnc1Cl ZINC001138893431 1046322063 /nfs/dbraw/zinc/32/20/63/1046322063.db2.gz FJHFCHWXQMHNIQ-UHFFFAOYSA-N 1 2 315.779 4.054 20 0 DIADLO C[N@H+](Cc1cccc2cccnc21)Cc1cc(F)cnc1Cl ZINC001138893431 1046322077 /nfs/dbraw/zinc/32/20/77/1046322077.db2.gz FJHFCHWXQMHNIQ-UHFFFAOYSA-N 1 2 315.779 4.054 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(Br)cnc2Cl)[C@@H](C)C1 ZINC001138945260 1046331407 /nfs/dbraw/zinc/33/14/07/1046331407.db2.gz XQDBVDPLFINOTI-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(Br)cnc2Cl)[C@@H](C)C1 ZINC001138945260 1046331421 /nfs/dbraw/zinc/33/14/21/1046331421.db2.gz XQDBVDPLFINOTI-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1cccc(C(C)(C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000638667157 1046334167 /nfs/dbraw/zinc/33/41/67/1046334167.db2.gz LBVIBDYIRXYVNV-QGZVFWFLSA-N 1 2 312.461 4.259 20 0 DIADLO CC[C@@H]1CCC[N@H+](Cc2cc(Br)cnc2Cl)C1 ZINC001138945635 1046334344 /nfs/dbraw/zinc/33/43/44/1046334344.db2.gz LRSNHGWROGGQNF-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@@H]1CCC[N@@H+](Cc2cc(Br)cnc2Cl)C1 ZINC001138945635 1046334354 /nfs/dbraw/zinc/33/43/54/1046334354.db2.gz LRSNHGWROGGQNF-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO Cc1nsc(C)c1C[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC000653615656 1046335282 /nfs/dbraw/zinc/33/52/82/1046335282.db2.gz SLBROMSONGFTBS-SNVBAGLBSA-N 1 2 309.504 4.365 20 0 DIADLO CCCCOc1cccc(C[N@@H+]2Cc3cccc(OC)c3C2)c1 ZINC001138956671 1046337134 /nfs/dbraw/zinc/33/71/34/1046337134.db2.gz PDLCRNNYRVERBB-UHFFFAOYSA-N 1 2 311.425 4.390 20 0 DIADLO CCCCOc1cccc(C[N@H+]2Cc3cccc(OC)c3C2)c1 ZINC001138956671 1046337149 /nfs/dbraw/zinc/33/71/49/1046337149.db2.gz PDLCRNNYRVERBB-UHFFFAOYSA-N 1 2 311.425 4.390 20 0 DIADLO C[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@H]1CC1(F)F ZINC000638803652 1046343421 /nfs/dbraw/zinc/34/34/21/1046343421.db2.gz GSMLJPICLVPFKF-SWLSCSKDSA-N 1 2 315.367 4.057 20 0 DIADLO CCCOc1ccccc1C[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC001138995088 1046351986 /nfs/dbraw/zinc/35/19/86/1046351986.db2.gz FIEGKQGKSGMRCM-LJQANCHMSA-N 1 2 311.425 4.049 20 0 DIADLO CCCOc1ccccc1C[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC001138995088 1046351997 /nfs/dbraw/zinc/35/19/97/1046351997.db2.gz FIEGKQGKSGMRCM-LJQANCHMSA-N 1 2 311.425 4.049 20 0 DIADLO CC1=C(C)C[C@H]([C@H](C)[NH2+][C@@H](c2nnc[nH]2)c2ccccc2)CC1 ZINC000639062621 1046356109 /nfs/dbraw/zinc/35/61/09/1046356109.db2.gz RNFAQEQCDDBULP-CGTJXYLNSA-N 1 2 310.445 4.009 20 0 DIADLO COc1ccc(-c2ccccc2)cc1C[N@@H+]1CCC(=O)C(C)(C)C1 ZINC001139070133 1046379491 /nfs/dbraw/zinc/37/94/91/1046379491.db2.gz FWZIRVDCODLWRS-UHFFFAOYSA-N 1 2 323.436 4.163 20 0 DIADLO COc1ccc(-c2ccccc2)cc1C[N@H+]1CCC(=O)C(C)(C)C1 ZINC001139070133 1046379503 /nfs/dbraw/zinc/37/95/03/1046379503.db2.gz FWZIRVDCODLWRS-UHFFFAOYSA-N 1 2 323.436 4.163 20 0 DIADLO COc1ccc(-c2ccccc2)cc1C[N@H+](C)Cc1cncs1 ZINC001139072136 1046382954 /nfs/dbraw/zinc/38/29/54/1046382954.db2.gz WGCGFJXYZUCTAS-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO COc1ccc(-c2ccccc2)cc1C[N@@H+](C)Cc1cncs1 ZINC001139072136 1046382967 /nfs/dbraw/zinc/38/29/67/1046382967.db2.gz WGCGFJXYZUCTAS-UHFFFAOYSA-N 1 2 324.449 4.451 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1ccc(Br)nc1Cl ZINC001139112199 1046386102 /nfs/dbraw/zinc/38/61/02/1046386102.db2.gz KGKAEMNLEWURFT-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1ccc(Br)nc1Cl ZINC001139112199 1046386114 /nfs/dbraw/zinc/38/61/14/1046386114.db2.gz KGKAEMNLEWURFT-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2nc(C(C)C)n3ccccc23)s1 ZINC000639383325 1046387298 /nfs/dbraw/zinc/38/72/98/1046387298.db2.gz ZNXNEGNBTNLDOA-LBPRGKRZSA-N 1 2 314.458 4.073 20 0 DIADLO CCn1ccc2c1cccc2C[N@@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001139152198 1046394557 /nfs/dbraw/zinc/39/45/57/1046394557.db2.gz SKKKKLIQCDNODB-INIZCTEOSA-N 1 2 310.363 4.230 20 0 DIADLO CCn1ccc2c1cccc2C[N@H+]1CCC[C@H](F)C(F)(F)C1 ZINC001139152198 1046394573 /nfs/dbraw/zinc/39/45/73/1046394573.db2.gz SKKKKLIQCDNODB-INIZCTEOSA-N 1 2 310.363 4.230 20 0 DIADLO CC(C)Oc1ccc(NCc2cccc3[nH+]ccn32)c(Cl)c1 ZINC000780582779 1046394873 /nfs/dbraw/zinc/39/48/73/1046394873.db2.gz KYFJVGKHTYWFIM-UHFFFAOYSA-N 1 2 315.804 4.387 20 0 DIADLO CCn1ccc2c1cccc2C[N@@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001139152199 1046395132 /nfs/dbraw/zinc/39/51/32/1046395132.db2.gz SKKKKLIQCDNODB-MRXNPFEDSA-N 1 2 310.363 4.230 20 0 DIADLO CCn1ccc2c1cccc2C[N@H+]1CCC[C@@H](F)C(F)(F)C1 ZINC001139152199 1046395146 /nfs/dbraw/zinc/39/51/46/1046395146.db2.gz SKKKKLIQCDNODB-MRXNPFEDSA-N 1 2 310.363 4.230 20 0 DIADLO CCCCC[C@@](C)(CC)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000780593722 1046395125 /nfs/dbraw/zinc/39/51/25/1046395125.db2.gz WVEILHVZPMCVAY-FUHWJXTLSA-N 1 2 305.466 4.043 20 0 DIADLO CC(C)c1cc(NCc2cccc3cn(C)nc32)nc(C(C)C)[nH+]1 ZINC001168197954 1046395778 /nfs/dbraw/zinc/39/57/78/1046395778.db2.gz RODVZSKGYUJUTC-UHFFFAOYSA-N 1 2 323.444 4.222 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+][C@H](C)c1c(F)cccc1F ZINC000037997673 1046402860 /nfs/dbraw/zinc/40/28/60/1046402860.db2.gz OYIOGMXTSNOWEB-SNVBAGLBSA-N 1 2 311.759 4.478 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C2CCC2)no1)c1ccc(Cl)s1 ZINC000639578192 1046412812 /nfs/dbraw/zinc/41/28/12/1046412812.db2.gz OXGOGMODPQEIGQ-JTQLQIEISA-N 1 2 311.838 4.293 20 0 DIADLO c1ccc([C@@H](CC2CCC2)[NH2+]Cc2nc(CC3CC3)no2)cc1 ZINC000639572428 1046413613 /nfs/dbraw/zinc/41/36/13/1046413613.db2.gz QTAVNRSLLBENFH-QGZVFWFLSA-N 1 2 311.429 4.043 20 0 DIADLO CC[N@H+](Cc1ccc2nonc2c1)Cc1c(F)cccc1Cl ZINC001139221876 1046416754 /nfs/dbraw/zinc/41/67/54/1046416754.db2.gz CAMZQWMPHNQVOI-UHFFFAOYSA-N 1 2 319.767 4.037 20 0 DIADLO CC[N@@H+](Cc1ccc2nonc2c1)Cc1c(F)cccc1Cl ZINC001139221876 1046416760 /nfs/dbraw/zinc/41/67/60/1046416760.db2.gz CAMZQWMPHNQVOI-UHFFFAOYSA-N 1 2 319.767 4.037 20 0 DIADLO Cc1nc(-c2ccccc2)oc1C[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000639639232 1046418836 /nfs/dbraw/zinc/41/88/36/1046418836.db2.gz TWQQJDRROJUHKE-QGZVFWFLSA-N 1 2 322.412 4.100 20 0 DIADLO Cc1nc(-c2ccccc2)oc1C[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000639639232 1046418847 /nfs/dbraw/zinc/41/88/47/1046418847.db2.gz TWQQJDRROJUHKE-QGZVFWFLSA-N 1 2 322.412 4.100 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc(Oc2ccccc2)nc1 ZINC001139247472 1046419025 /nfs/dbraw/zinc/41/90/25/1046419025.db2.gz GBDXXKPCCFRAFW-MRXNPFEDSA-N 1 2 319.408 4.252 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccc(Oc2ccccc2)nc1 ZINC001139247472 1046419028 /nfs/dbraw/zinc/41/90/28/1046419028.db2.gz GBDXXKPCCFRAFW-MRXNPFEDSA-N 1 2 319.408 4.252 20 0 DIADLO Clc1nc(-c2ccccc2)[nH]c1C[NH+]1CC(c2ccccc2)C1 ZINC001139281403 1046424248 /nfs/dbraw/zinc/42/42/48/1046424248.db2.gz JEXWWLHXOZIPCX-UHFFFAOYSA-N 1 2 323.827 4.330 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+]3CCC[C@H]3c3cn[nH]c3)n2)cc1 ZINC000639778900 1046427435 /nfs/dbraw/zinc/42/74/35/1046427435.db2.gz VTFQHEHRVGGWTQ-KRWDZBQOSA-N 1 2 324.453 4.179 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+]3CCC[C@H]3c3cn[nH]c3)n2)cc1 ZINC000639778900 1046427441 /nfs/dbraw/zinc/42/74/41/1046427441.db2.gz VTFQHEHRVGGWTQ-KRWDZBQOSA-N 1 2 324.453 4.179 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(Cl)c(F)c1 ZINC000719414669 1046427508 /nfs/dbraw/zinc/42/75/08/1046427508.db2.gz XYZMFMAEICZQFT-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO C[C@]1(F)CCCC[N@H+](Cc2sccc2Br)C1 ZINC001139309409 1046429056 /nfs/dbraw/zinc/42/90/56/1046429056.db2.gz WUZDRRAMUPHSMT-LBPRGKRZSA-N 1 2 306.244 4.225 20 0 DIADLO C[C@]1(F)CCCC[N@@H+](Cc2sccc2Br)C1 ZINC001139309409 1046429059 /nfs/dbraw/zinc/42/90/59/1046429059.db2.gz WUZDRRAMUPHSMT-LBPRGKRZSA-N 1 2 306.244 4.225 20 0 DIADLO Clc1cc2cccnc2c(C[N@@H+]2CCC[C@@H]2c2ncccn2)c1 ZINC000639843357 1046432029 /nfs/dbraw/zinc/43/20/29/1046432029.db2.gz QAVWGDUHSSBXGP-MRXNPFEDSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1cc2cccnc2c(C[N@H+]2CCC[C@@H]2c2ncccn2)c1 ZINC000639843357 1046432037 /nfs/dbraw/zinc/43/20/37/1046432037.db2.gz QAVWGDUHSSBXGP-MRXNPFEDSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1cccc(Cl)c1CC[N@@H+]1CCC[C@@H]1c1ncccn1 ZINC000639870025 1046432065 /nfs/dbraw/zinc/43/20/65/1046432065.db2.gz NYUKORDQGJNVIA-OAHLLOKOSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1cccc(Cl)c1CC[N@H+]1CCC[C@@H]1c1ncccn1 ZINC000639870025 1046432070 /nfs/dbraw/zinc/43/20/70/1046432070.db2.gz NYUKORDQGJNVIA-OAHLLOKOSA-N 1 2 322.239 4.163 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1ccncc1Cl ZINC001168234634 1046435645 /nfs/dbraw/zinc/43/56/45/1046435645.db2.gz NGSLAGCLMROULC-NEPJUHHUSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1ccncc1Cl ZINC001168234634 1046435647 /nfs/dbraw/zinc/43/56/47/1046435647.db2.gz NGSLAGCLMROULC-NEPJUHHUSA-N 1 2 304.796 4.382 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2coc(-c3ccccc3F)n2)s1 ZINC000639996481 1046441124 /nfs/dbraw/zinc/44/11/24/1046441124.db2.gz KZGUDCGTKCSJSV-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H]2CCCOc3ccc(F)cc32)c(C)s1 ZINC000676838968 1046441260 /nfs/dbraw/zinc/44/12/60/1046441260.db2.gz INNSCHJXDXYAPZ-MEBBXXQBSA-N 1 2 320.433 4.464 20 0 DIADLO Cc1noc([C@@H](C)[NH2+][C@H](c2ccc(CC(C)C)cc2)C2CC2)n1 ZINC000676842790 1046441313 /nfs/dbraw/zinc/44/13/13/1046441313.db2.gz DGRMICLXDBRUGZ-FZKQIMNGSA-N 1 2 313.445 4.378 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2ncc(-c3ccc(F)cc3)o2)s1 ZINC000639995096 1046442037 /nfs/dbraw/zinc/44/20/37/1046442037.db2.gz QRUJWJQMOHRPQM-SNVBAGLBSA-N 1 2 317.389 4.096 20 0 DIADLO CCc1noc(C[NH2+][C@H](c2ccc(F)cc2)C2CCCCC2)n1 ZINC000640013774 1046442883 /nfs/dbraw/zinc/44/28/83/1046442883.db2.gz RQWDOLKFFGEDCT-SFHVURJKSA-N 1 2 317.408 4.182 20 0 DIADLO CC(C)c1ccc(NC(=O)NCc2c[nH+]cn2C2CCC2)cc1 ZINC001202931036 1046444031 /nfs/dbraw/zinc/44/40/31/1046444031.db2.gz IBDCCXYALSCRHS-UHFFFAOYSA-N 1 2 312.417 4.053 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2ccc(C(F)(F)F)cc2)c[nH+]1 ZINC000454189355 1046445105 /nfs/dbraw/zinc/44/51/05/1046445105.db2.gz HBJGCXLZGLNPDQ-UHFFFAOYSA-N 1 2 323.318 4.039 20 0 DIADLO c1cc(-c2ccccc2)sc1C[NH+]1CC(Oc2cccnc2)C1 ZINC001139414777 1046446690 /nfs/dbraw/zinc/44/66/90/1046446690.db2.gz YSSKQXUJBRGJMH-UHFFFAOYSA-N 1 2 322.433 4.073 20 0 DIADLO c1cc2n(n1)CCC[C@H]2[NH2+]Cc1csc(C2CCCCC2)n1 ZINC000640218872 1046453691 /nfs/dbraw/zinc/45/36/91/1046453691.db2.gz XIBCIGVUUAUMFN-OAHLLOKOSA-N 1 2 316.474 4.012 20 0 DIADLO Cn1c(C2CCC2)nn(C[N@H+](C)CCC2CCCCC2)c1=S ZINC000781562535 1046456740 /nfs/dbraw/zinc/45/67/40/1046456740.db2.gz UMZJJADROVEZNM-UHFFFAOYSA-N 1 2 322.522 4.078 20 0 DIADLO Cn1c(C2CCC2)nn(C[N@@H+](C)CCC2CCCCC2)c1=S ZINC000781562535 1046456746 /nfs/dbraw/zinc/45/67/46/1046456746.db2.gz UMZJJADROVEZNM-UHFFFAOYSA-N 1 2 322.522 4.078 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2cccc(OC3CCCC3)c2)cs1 ZINC000125008320 1046462136 /nfs/dbraw/zinc/46/21/36/1046462136.db2.gz BTQURGMYRHRASG-UHFFFAOYSA-N 1 2 316.470 4.405 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2cccc(OC3CCCC3)c2)cs1 ZINC000125008320 1046462140 /nfs/dbraw/zinc/46/21/40/1046462140.db2.gz BTQURGMYRHRASG-UHFFFAOYSA-N 1 2 316.470 4.405 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(CC(C)C)no1)c1cccc(Cl)c1 ZINC000125285800 1046465801 /nfs/dbraw/zinc/46/58/01/1046465801.db2.gz YRBVYBRITAADLZ-AWEZNQCLSA-N 1 2 307.825 4.162 20 0 DIADLO C[C@H]1COCC[N@@H+]1Cc1ccccc1-c1ccccc1Cl ZINC001139572329 1046474783 /nfs/dbraw/zinc/47/47/83/1046474783.db2.gz NOJDKHQXQFZCGE-AWEZNQCLSA-N 1 2 301.817 4.228 20 0 DIADLO C[C@H]1COCC[N@H+]1Cc1ccccc1-c1ccccc1Cl ZINC001139572329 1046474789 /nfs/dbraw/zinc/47/47/89/1046474789.db2.gz NOJDKHQXQFZCGE-AWEZNQCLSA-N 1 2 301.817 4.228 20 0 DIADLO Cc1cnc(Cl)c(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC001139590925 1046478874 /nfs/dbraw/zinc/47/88/74/1046478874.db2.gz FSPRTKKXCYMDFE-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cnc(Cl)c(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC001139590925 1046478878 /nfs/dbraw/zinc/47/88/78/1046478878.db2.gz FSPRTKKXCYMDFE-MRXNPFEDSA-N 1 2 318.873 4.334 20 0 DIADLO COc1ccccc1[C@H](C)[N@H+](C)Cc1cc(C)cnc1Cl ZINC001139595845 1046480901 /nfs/dbraw/zinc/48/09/01/1046480901.db2.gz PKHYSSMDUDGUCY-ZDUSSCGKSA-N 1 2 304.821 4.245 20 0 DIADLO COc1ccccc1[C@H](C)[N@@H+](C)Cc1cc(C)cnc1Cl ZINC001139595845 1046480904 /nfs/dbraw/zinc/48/09/04/1046480904.db2.gz PKHYSSMDUDGUCY-ZDUSSCGKSA-N 1 2 304.821 4.245 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3c(C)cc(C)cc3C)ccc2[nH+]1 ZINC001202952247 1046482141 /nfs/dbraw/zinc/48/21/41/1046482141.db2.gz YXBRADRNXLYJRE-UHFFFAOYSA-N 1 2 308.385 4.212 20 0 DIADLO C[C@H]1C[C@H](CCNC(=O)c2cc3c[nH+]ccc3[nH]2)CC(C)(C)C1 ZINC001139604738 1046482683 /nfs/dbraw/zinc/48/26/83/1046482683.db2.gz AWVHBHOBNBENGY-KBPBESRZSA-N 1 2 313.445 4.145 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCOC3(CCCCC3)C2)cc1Cl ZINC001139597292 1046483287 /nfs/dbraw/zinc/48/32/87/1046483287.db2.gz UCBFPPZLIMPGEC-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO CCOc1ccc(C[N@H+]2CCOC3(CCCCC3)C2)cc1Cl ZINC001139597292 1046483294 /nfs/dbraw/zinc/48/32/94/1046483294.db2.gz UCBFPPZLIMPGEC-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO CC(=O)Nc1ccc([C@@H](C)Nc2ccc([NH+]3CCCC3)cc2)cc1 ZINC000781908866 1046486325 /nfs/dbraw/zinc/48/63/25/1046486325.db2.gz AVYCTMZZILYCJU-OAHLLOKOSA-N 1 2 323.440 4.418 20 0 DIADLO Cc1cc(C(=O)Nc2ccccc2-n2cc[nH+]c2)c(C)n1C(C)C ZINC000045955602 1046488274 /nfs/dbraw/zinc/48/82/74/1046488274.db2.gz CVSNDFDPWZMKBN-UHFFFAOYSA-N 1 2 322.412 4.124 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H](F)C2)cc1Br ZINC001139728619 1046507483 /nfs/dbraw/zinc/50/74/83/1046507483.db2.gz AQWBLYIRZKTLDC-ZDUSSCGKSA-N 1 2 300.215 4.082 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1cccc(Cl)n1)[C@H]2C ZINC000782097335 1046493705 /nfs/dbraw/zinc/49/37/05/1046493705.db2.gz JCLJGUOYXCWUIC-OLZOCXBDSA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1cccc(Cl)n1)[C@H]2C ZINC000782097335 1046493707 /nfs/dbraw/zinc/49/37/07/1046493707.db2.gz JCLJGUOYXCWUIC-OLZOCXBDSA-N 1 2 316.832 4.251 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H](F)C2)cc1Br ZINC001139728619 1046507494 /nfs/dbraw/zinc/50/74/94/1046507494.db2.gz AQWBLYIRZKTLDC-ZDUSSCGKSA-N 1 2 300.215 4.082 20 0 DIADLO COc1ncc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001139744748 1046509013 /nfs/dbraw/zinc/50/90/13/1046509013.db2.gz QYDGWNKCJXMDNT-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(Cl)cc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001139744748 1046509017 /nfs/dbraw/zinc/50/90/17/1046509017.db2.gz QYDGWNKCJXMDNT-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(Cl)cc1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001139749962 1046512278 /nfs/dbraw/zinc/51/22/78/1046512278.db2.gz PGBLIESDNUJGEJ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(Cl)cc1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001139749962 1046512284 /nfs/dbraw/zinc/51/22/84/1046512284.db2.gz PGBLIESDNUJGEJ-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC001139749995 1046512315 /nfs/dbraw/zinc/51/23/15/1046512315.db2.gz QJWJSRCDSAISMN-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ncc(Cl)cc1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC001139749995 1046512326 /nfs/dbraw/zinc/51/23/26/1046512326.db2.gz QJWJSRCDSAISMN-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO FC(F)(F)[C@H]1CC[N@H+](Cc2csc(-c3ccsc3)n2)C1 ZINC000677713835 1046513107 /nfs/dbraw/zinc/51/31/07/1046513107.db2.gz LDPYGBMSUWGOOQ-JTQLQIEISA-N 1 2 318.389 4.256 20 0 DIADLO FC(F)(F)[C@H]1CC[N@@H+](Cc2csc(-c3ccsc3)n2)C1 ZINC000677713835 1046513118 /nfs/dbraw/zinc/51/31/18/1046513118.db2.gz LDPYGBMSUWGOOQ-JTQLQIEISA-N 1 2 318.389 4.256 20 0 DIADLO FC(F)[C@H]1CC[N@H+](Cc2csc(C3CCCCC3)n2)C1 ZINC000677733367 1046517388 /nfs/dbraw/zinc/51/73/88/1046517388.db2.gz QNJZQUMWMPIQFQ-LBPRGKRZSA-N 1 2 300.418 4.278 20 0 DIADLO FC(F)[C@H]1CC[N@@H+](Cc2csc(C3CCCCC3)n2)C1 ZINC000677733367 1046517397 /nfs/dbraw/zinc/51/73/97/1046517397.db2.gz QNJZQUMWMPIQFQ-LBPRGKRZSA-N 1 2 300.418 4.278 20 0 DIADLO c1ccc(-c2nc(C[NH+]3CCC(c4ccccc4)CC3)no2)cc1 ZINC000641863767 1046519393 /nfs/dbraw/zinc/51/93/93/1046519393.db2.gz DXNNHVGLAGIBGA-UHFFFAOYSA-N 1 2 319.408 4.116 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccccc1C(F)F)CC2 ZINC001139800802 1046519541 /nfs/dbraw/zinc/51/95/41/1046519541.db2.gz ZWXFJXUNDSFIFQ-UHFFFAOYSA-N 1 2 315.363 4.385 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1ccccc1C(F)F)CC2 ZINC001139800802 1046519556 /nfs/dbraw/zinc/51/95/56/1046519556.db2.gz ZWXFJXUNDSFIFQ-UHFFFAOYSA-N 1 2 315.363 4.385 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1cc(Cl)ncc1Br ZINC001139806178 1046521585 /nfs/dbraw/zinc/52/15/85/1046521585.db2.gz PHDUCGISNYWYSO-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO CC[N@H+](Cc1ncc(-c2ccccc2C)o1)Cc1ccncc1 ZINC000536605699 1046523169 /nfs/dbraw/zinc/52/31/69/1046523169.db2.gz MRBIHTKYGDMUNP-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO CC[N@@H+](Cc1ncc(-c2ccccc2C)o1)Cc1ccncc1 ZINC000536605699 1046523183 /nfs/dbraw/zinc/52/31/83/1046523183.db2.gz MRBIHTKYGDMUNP-UHFFFAOYSA-N 1 2 307.397 4.067 20 0 DIADLO CN(C)c1ccc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)cn1 ZINC000677802050 1046527990 /nfs/dbraw/zinc/52/79/90/1046527990.db2.gz LJJOTXCVLAWQJU-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)cn1 ZINC000677802050 1046528002 /nfs/dbraw/zinc/52/80/02/1046528002.db2.gz LJJOTXCVLAWQJU-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CC[C@@H](NC(=O)Nc1cc(C)[nH+]cc1C)c1ccc(Cl)s1 ZINC000536619433 1046528933 /nfs/dbraw/zinc/52/89/33/1046528933.db2.gz ZHBBACKZBQFAKM-LLVKDONJSA-N 1 2 323.849 4.108 20 0 DIADLO COc1c(Cl)cccc1C[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000897479775 1046532060 /nfs/dbraw/zinc/53/20/60/1046532060.db2.gz HZTSUPIMYZOAKU-UHFFFAOYSA-N 1 2 324.877 4.392 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000641959517 1046532657 /nfs/dbraw/zinc/53/26/57/1046532657.db2.gz MXDFXYXBZITVCX-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000641959517 1046532665 /nfs/dbraw/zinc/53/26/65/1046532665.db2.gz MXDFXYXBZITVCX-FZKQIMNGSA-N 1 2 303.352 4.099 20 0 DIADLO Cc1cc(NC(=O)N2CCCC3(C2)CCCCCC3)c(C)c[nH+]1 ZINC000536618251 1046533150 /nfs/dbraw/zinc/53/31/50/1046533150.db2.gz IGLQERNHEMBYSD-UHFFFAOYSA-N 1 2 315.461 4.089 20 0 DIADLO CCc1nc(C[NH2+][C@@H]2CC(C)(C)Oc3cc(F)ccc32)cs1 ZINC000133288842 1046538207 /nfs/dbraw/zinc/53/82/07/1046538207.db2.gz WTXCVQDIXYDSNI-CQSZACIVSA-N 1 2 320.433 4.237 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ncccc2C(F)(F)F)o1 ZINC000677964769 1046538466 /nfs/dbraw/zinc/53/84/66/1046538466.db2.gz PAEJQBYOFVUEJK-CMPLNLGQSA-N 1 2 310.319 4.107 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccc(Cl)nc1 ZINC000179132757 1046543726 /nfs/dbraw/zinc/54/37/26/1046543726.db2.gz XPXAVFVGZIKKBH-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO Cc1nn(C[N@H+]2C[C@@H](c3ccc(C)cc3)C[C@@H]2C)c(=S)s1 ZINC000782951566 1046547986 /nfs/dbraw/zinc/54/79/86/1046547986.db2.gz CULSFTPVNXDFHL-WFASDCNBSA-N 1 2 319.499 4.126 20 0 DIADLO Cc1nn(C[N@@H+]2C[C@@H](c3ccc(C)cc3)C[C@@H]2C)c(=S)s1 ZINC000782951566 1046547995 /nfs/dbraw/zinc/54/79/95/1046547995.db2.gz CULSFTPVNXDFHL-WFASDCNBSA-N 1 2 319.499 4.126 20 0 DIADLO Cc1nn(C[N@H+]2C[C@H](c3ccc(C)cc3)C[C@H]2C)c(=S)s1 ZINC000782951564 1046548123 /nfs/dbraw/zinc/54/81/23/1046548123.db2.gz CULSFTPVNXDFHL-IUODEOHRSA-N 1 2 319.499 4.126 20 0 DIADLO Cc1nn(C[N@@H+]2C[C@H](c3ccc(C)cc3)C[C@H]2C)c(=S)s1 ZINC000782951564 1046548135 /nfs/dbraw/zinc/54/81/35/1046548135.db2.gz CULSFTPVNXDFHL-IUODEOHRSA-N 1 2 319.499 4.126 20 0 DIADLO Brc1ncc(C[N@@H+]2CCC[C@@H]2c2ccccc2)s1 ZINC001139914146 1046551836 /nfs/dbraw/zinc/55/18/36/1046551836.db2.gz QPKDLCQMZGJMIH-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ncc(C[N@H+]2CCC[C@@H]2c2ccccc2)s1 ZINC001139914146 1046551848 /nfs/dbraw/zinc/55/18/48/1046551848.db2.gz QPKDLCQMZGJMIH-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO FC1CC2(C1)CC[NH+](Cc1sc(Cl)nc1Cl)CC2 ZINC001139953305 1046557172 /nfs/dbraw/zinc/55/71/72/1046557172.db2.gz IRGGZPRNDCETSZ-UHFFFAOYSA-N 1 2 309.237 4.164 20 0 DIADLO C[N@H+](CCc1cccc(F)c1)Cc1sc(Cl)nc1Cl ZINC001139959915 1046559596 /nfs/dbraw/zinc/55/95/96/1046559596.db2.gz MTFKOJAZMXWLCW-UHFFFAOYSA-N 1 2 319.232 4.264 20 0 DIADLO C[N@@H+](CCc1cccc(F)c1)Cc1sc(Cl)nc1Cl ZINC001139959915 1046559608 /nfs/dbraw/zinc/55/96/08/1046559608.db2.gz MTFKOJAZMXWLCW-UHFFFAOYSA-N 1 2 319.232 4.264 20 0 DIADLO C[C@H](c1ccc2ccccc2c1)[N@H+](C)Cc1ncc(Cl)n1C ZINC000053642673 1046560897 /nfs/dbraw/zinc/56/08/97/1046560897.db2.gz RDTKXEICWPULQG-CYBMUJFWSA-N 1 2 313.832 4.420 20 0 DIADLO C[C@H](c1ccc2ccccc2c1)[N@@H+](C)Cc1ncc(Cl)n1C ZINC000053642673 1046560908 /nfs/dbraw/zinc/56/09/08/1046560908.db2.gz RDTKXEICWPULQG-CYBMUJFWSA-N 1 2 313.832 4.420 20 0 DIADLO O=C(c1ccccc1)C1CC[NH+](Cc2cscc2Cl)CC1 ZINC000678130090 1046562275 /nfs/dbraw/zinc/56/22/75/1046562275.db2.gz NJPOWTCSLJYUTD-UHFFFAOYSA-N 1 2 319.857 4.496 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2[nH]nc3ccccc32)C2CC2)o1 ZINC000678135462 1046564335 /nfs/dbraw/zinc/56/43/35/1046564335.db2.gz NNGQUYUSOMXMKV-DYVFJYSZSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2[nH]nc3ccccc32)C2CC2)o1 ZINC000678135462 1046564348 /nfs/dbraw/zinc/56/43/48/1046564348.db2.gz NNGQUYUSOMXMKV-DYVFJYSZSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2n[nH]c3ccccc32)C2CC2)o1 ZINC000678135462 1046564363 /nfs/dbraw/zinc/56/43/63/1046564363.db2.gz NNGQUYUSOMXMKV-DYVFJYSZSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2n[nH]c3ccccc32)C2CC2)o1 ZINC000678135462 1046564376 /nfs/dbraw/zinc/56/43/76/1046564376.db2.gz NNGQUYUSOMXMKV-DYVFJYSZSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2[nH]nc3ccccc32)C2CC2)o1 ZINC000678135465 1046565291 /nfs/dbraw/zinc/56/52/91/1046565291.db2.gz NNGQUYUSOMXMKV-SUMWQHHRSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2[nH]nc3ccccc32)C2CC2)o1 ZINC000678135465 1046565305 /nfs/dbraw/zinc/56/53/05/1046565305.db2.gz NNGQUYUSOMXMKV-SUMWQHHRSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2n[nH]c3ccccc32)C2CC2)o1 ZINC000678135465 1046565319 /nfs/dbraw/zinc/56/53/19/1046565319.db2.gz NNGQUYUSOMXMKV-SUMWQHHRSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2n[nH]c3ccccc32)C2CC2)o1 ZINC000678135465 1046565334 /nfs/dbraw/zinc/56/53/34/1046565334.db2.gz NNGQUYUSOMXMKV-SUMWQHHRSA-N 1 2 321.424 4.444 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc3ccccc3cn2)[C@@H](c2ccccc2)CO1 ZINC001140000969 1046566482 /nfs/dbraw/zinc/56/64/82/1046566482.db2.gz QBOOMEQREIKTKP-HRAATJIYSA-N 1 2 318.420 4.197 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc3ccccc3cn2)[C@@H](c2ccccc2)CO1 ZINC001140000969 1046566497 /nfs/dbraw/zinc/56/64/97/1046566497.db2.gz QBOOMEQREIKTKP-HRAATJIYSA-N 1 2 318.420 4.197 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cnc(CC(C)C)s2)C2CC2)o1 ZINC000678136219 1046567601 /nfs/dbraw/zinc/56/76/01/1046567601.db2.gz YVSQNZTUWOGMBF-UHFFFAOYSA-N 1 2 304.459 4.408 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cnc(CC(C)C)s2)C2CC2)o1 ZINC000678136219 1046567614 /nfs/dbraw/zinc/56/76/14/1046567614.db2.gz YVSQNZTUWOGMBF-UHFFFAOYSA-N 1 2 304.459 4.408 20 0 DIADLO c1c[nH]c([C@@H](Nc2ccc([NH+]3CCCC3)cc2)c2ccccc2)n1 ZINC000783267819 1046571609 /nfs/dbraw/zinc/57/16/09/1046571609.db2.gz LHDYPLCTBSCUPP-IBGZPJMESA-N 1 2 318.424 4.211 20 0 DIADLO C[N@H+](Cc1ccc(Cl)c(Cl)c1)Cc1cc(O)ccc1F ZINC001140045262 1046574438 /nfs/dbraw/zinc/57/44/38/1046574438.db2.gz FRKZSKMNVGYDTL-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)c(Cl)c1)Cc1cc(O)ccc1F ZINC001140045262 1046574452 /nfs/dbraw/zinc/57/44/52/1046574452.db2.gz FRKZSKMNVGYDTL-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO CSc1nccc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)n1 ZINC001140038673 1046575884 /nfs/dbraw/zinc/57/58/84/1046575884.db2.gz DFYZJQPUAVNQCC-NSHDSACASA-N 1 2 307.850 4.045 20 0 DIADLO CSc1nccc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)n1 ZINC001140038673 1046575894 /nfs/dbraw/zinc/57/58/94/1046575894.db2.gz DFYZJQPUAVNQCC-NSHDSACASA-N 1 2 307.850 4.045 20 0 DIADLO C[N@H+](Cc1cc(Cl)cc(Cl)c1)Cc1cc(O)ccc1F ZINC001140053004 1046576900 /nfs/dbraw/zinc/57/69/00/1046576900.db2.gz KVMNKWZQZLSMKE-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO C[N@@H+](Cc1cc(Cl)cc(Cl)c1)Cc1cc(O)ccc1F ZINC001140053004 1046576914 /nfs/dbraw/zinc/57/69/14/1046576914.db2.gz KVMNKWZQZLSMKE-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001140053297 1046579112 /nfs/dbraw/zinc/57/91/12/1046579112.db2.gz ZOQMRJAHFLTUJV-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)c1 ZINC001140053297 1046579124 /nfs/dbraw/zinc/57/91/24/1046579124.db2.gz ZOQMRJAHFLTUJV-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO COc1c(Cl)cccc1C[N@@H+]1CCc2cc(F)ccc2C1 ZINC001140062438 1046580062 /nfs/dbraw/zinc/58/00/62/1046580062.db2.gz XLOKTQWNKUXWQY-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1c(Cl)cccc1C[N@H+]1CCc2cc(F)ccc2C1 ZINC001140062438 1046580069 /nfs/dbraw/zinc/58/00/69/1046580069.db2.gz XLOKTQWNKUXWQY-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2cnc(Br)cc2Cl)CC1 ZINC001140076474 1046580219 /nfs/dbraw/zinc/58/02/19/1046580219.db2.gz UOHGSCXDSQBHJQ-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2cnc(Br)cc2Cl)CC1 ZINC001140076474 1046580226 /nfs/dbraw/zinc/58/02/26/1046580226.db2.gz UOHGSCXDSQBHJQ-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO COc1c(Cl)cccc1C[N@@H+]1CCC(=O)[C@H](C)C12CCCC2 ZINC001140065767 1046581018 /nfs/dbraw/zinc/58/10/18/1046581018.db2.gz KWOMKLRGWDNVLC-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO COc1c(Cl)cccc1C[N@H+]1CCC(=O)[C@H](C)C12CCCC2 ZINC001140065767 1046581030 /nfs/dbraw/zinc/58/10/30/1046581030.db2.gz KWOMKLRGWDNVLC-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cnc(Br)cc1Cl ZINC001140073557 1046581048 /nfs/dbraw/zinc/58/10/48/1046581048.db2.gz BIBIAXYJYFDCFY-NXEZZACHSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1cnc(C2CCC2)s1 ZINC000678197069 1046584712 /nfs/dbraw/zinc/58/47/12/1046584712.db2.gz PYGBMVHRAYPARV-CYBMUJFWSA-N 1 2 314.454 4.366 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1cnc(C2CCC2)s1 ZINC000678197069 1046584726 /nfs/dbraw/zinc/58/47/26/1046584726.db2.gz PYGBMVHRAYPARV-CYBMUJFWSA-N 1 2 314.454 4.366 20 0 DIADLO CC[C@@H]1CCC[N@H+](Cc2cnc(Br)cc2Cl)C1 ZINC001140079775 1046584787 /nfs/dbraw/zinc/58/47/87/1046584787.db2.gz HAYQJYCJILVOSA-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@@H]1CCC[N@@H+](Cc2cnc(Br)cc2Cl)C1 ZINC001140079775 1046584801 /nfs/dbraw/zinc/58/48/01/1046584801.db2.gz HAYQJYCJILVOSA-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO Oc1ccc(C[N@H+](Cc2ccccc2)Cc2ccncc2)c(F)c1 ZINC001140124133 1046595287 /nfs/dbraw/zinc/59/52/87/1046595287.db2.gz BSGFMGWZAUDWKU-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO Oc1ccc(C[N@@H+](Cc2ccccc2)Cc2ccncc2)c(F)c1 ZINC001140124133 1046595298 /nfs/dbraw/zinc/59/52/98/1046595298.db2.gz BSGFMGWZAUDWKU-UHFFFAOYSA-N 1 2 322.383 4.129 20 0 DIADLO COc1ccc(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)c(OC)c1 ZINC000536637832 1046602213 /nfs/dbraw/zinc/60/22/13/1046602213.db2.gz RGYVLXCHCWMKGO-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)c(OC)c1 ZINC000536637832 1046602217 /nfs/dbraw/zinc/60/22/17/1046602217.db2.gz RGYVLXCHCWMKGO-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1ccc(-c2ccncc2)cc1 ZINC001140175373 1046607525 /nfs/dbraw/zinc/60/75/25/1046607525.db2.gz ZXLFAVYILZKQCK-UHFFFAOYSA-N 1 2 316.404 4.063 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1ccc(-c2ccncc2)cc1 ZINC001140175373 1046607529 /nfs/dbraw/zinc/60/75/29/1046607529.db2.gz ZXLFAVYILZKQCK-UHFFFAOYSA-N 1 2 316.404 4.063 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2c(s1)CCC2)c1ccc(F)cc1F ZINC000093076158 1046607556 /nfs/dbraw/zinc/60/75/56/1046607556.db2.gz MDDLFVMPNRCYEH-ZDUSSCGKSA-N 1 2 308.397 4.151 20 0 DIADLO Clc1cscc1C[N@@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000678278051 1046608462 /nfs/dbraw/zinc/60/84/62/1046608462.db2.gz SLTPBFVFEGPTRV-KRWDZBQOSA-N 1 2 319.857 4.075 20 0 DIADLO Clc1cscc1C[N@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000678278051 1046608469 /nfs/dbraw/zinc/60/84/69/1046608469.db2.gz SLTPBFVFEGPTRV-KRWDZBQOSA-N 1 2 319.857 4.075 20 0 DIADLO CC[N@H+](Cc1cnc[nH]1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000093133727 1046612494 /nfs/dbraw/zinc/61/24/94/1046612494.db2.gz DCRWIBMEZQSJRI-IBGZPJMESA-N 1 2 309.388 4.160 20 0 DIADLO CC[N@@H+](Cc1cnc[nH]1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000093133727 1046612497 /nfs/dbraw/zinc/61/24/97/1046612497.db2.gz DCRWIBMEZQSJRI-IBGZPJMESA-N 1 2 309.388 4.160 20 0 DIADLO C[N@H+](Cc1ccc2oc3ccccc3c2c1)[C@@H]1CC(C)(C)OC1=O ZINC000795663216 1046614925 /nfs/dbraw/zinc/61/49/25/1046614925.db2.gz YWYHHCAZZOSSJU-MRXNPFEDSA-N 1 2 323.392 4.112 20 0 DIADLO C[N@@H+](Cc1ccc2oc3ccccc3c2c1)[C@@H]1CC(C)(C)OC1=O ZINC000795663216 1046614929 /nfs/dbraw/zinc/61/49/29/1046614929.db2.gz YWYHHCAZZOSSJU-MRXNPFEDSA-N 1 2 323.392 4.112 20 0 DIADLO CCCCOc1ccc(C[N@@H+]2CCO[C@@H](c3ccco3)C2)cc1 ZINC000678294942 1046615883 /nfs/dbraw/zinc/61/58/83/1046615883.db2.gz SHXWAIMIJSTMOJ-LJQANCHMSA-N 1 2 315.413 4.032 20 0 DIADLO CCCCOc1ccc(C[N@H+]2CCO[C@@H](c3ccco3)C2)cc1 ZINC000678294942 1046615893 /nfs/dbraw/zinc/61/58/93/1046615893.db2.gz SHXWAIMIJSTMOJ-LJQANCHMSA-N 1 2 315.413 4.032 20 0 DIADLO COc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1OC(C)C ZINC001203017601 1046624567 /nfs/dbraw/zinc/62/45/67/1046624567.db2.gz JHLPCZJXSSBUEE-UHFFFAOYSA-N 1 2 323.396 4.412 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1ccc(OC)c(OC(C)C)c1 ZINC001203018213 1046630984 /nfs/dbraw/zinc/63/09/84/1046630984.db2.gz XXZIKZDLSVQWRR-UHFFFAOYSA-N 1 2 300.402 4.492 20 0 DIADLO CC(C)c1ccc(NC(=S)Nc2cc(N(C)C)cc[nH+]2)cc1 ZINC000783760730 1046631668 /nfs/dbraw/zinc/63/16/68/1046631668.db2.gz CHLAQOQEGGTXGN-UHFFFAOYSA-N 1 2 314.458 4.080 20 0 DIADLO COc1ccc(Nc2ccc3c(c2)[nH+]cn3C)cc1OC(C)C ZINC001203020219 1046639473 /nfs/dbraw/zinc/63/94/73/1046639473.db2.gz GGFHTBXBLHOLRM-UHFFFAOYSA-N 1 2 311.385 4.113 20 0 DIADLO CC(C)c1ccc(OC2CC[NH+](Cc3nccs3)CC2)cc1 ZINC000533079925 1046650565 /nfs/dbraw/zinc/65/05/65/1046650565.db2.gz SVXOBVOQTFJTME-UHFFFAOYSA-N 1 2 316.470 4.310 20 0 DIADLO Cc1ccc(NC2=CCCN(C(=O)OC(C)(C)C)CC2)c(C)[nH+]1 ZINC001203023027 1046651523 /nfs/dbraw/zinc/65/15/23/1046651523.db2.gz WEWZGKDAGBIQPS-UHFFFAOYSA-N 1 2 317.433 4.025 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H]2CCOc3ccc(F)cc32)c(C)s1 ZINC000678584013 1046662332 /nfs/dbraw/zinc/66/23/32/1046662332.db2.gz KWUOJCCDPUZPCY-OTYXRUKQSA-N 1 2 306.406 4.073 20 0 DIADLO Fc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1c(F)c(F)cc(F)c1F ZINC000678595481 1046669044 /nfs/dbraw/zinc/66/90/44/1046669044.db2.gz PLBOEJLGYHWKHR-AWEZNQCLSA-N 1 2 313.269 4.159 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)c(C)s1 ZINC000678597944 1046671006 /nfs/dbraw/zinc/67/10/06/1046671006.db2.gz NFKNNVYKRRBOIF-AMIZOPFISA-N 1 2 308.834 4.198 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3sccc3[C@H]2C)nc2ccccc12 ZINC000533223491 1046672429 /nfs/dbraw/zinc/67/24/29/1046672429.db2.gz UIZBISNAGGHVQD-CYBMUJFWSA-N 1 2 309.438 4.119 20 0 DIADLO Cc1nc(C[N@H+]2CCc3sccc3[C@H]2C)nc2ccccc12 ZINC000533223491 1046672434 /nfs/dbraw/zinc/67/24/34/1046672434.db2.gz UIZBISNAGGHVQD-CYBMUJFWSA-N 1 2 309.438 4.119 20 0 DIADLO C[N@H+](Cc1sc(N2CCCC2)nc1Cl)Cc1ccccc1 ZINC001140361944 1046674554 /nfs/dbraw/zinc/67/45/54/1046674554.db2.gz IMRLSZHPQBALDV-UHFFFAOYSA-N 1 2 321.877 4.029 20 0 DIADLO C[N@@H+](Cc1sc(N2CCCC2)nc1Cl)Cc1ccccc1 ZINC001140361944 1046674559 /nfs/dbraw/zinc/67/45/59/1046674559.db2.gz IMRLSZHPQBALDV-UHFFFAOYSA-N 1 2 321.877 4.029 20 0 DIADLO Cc1nn(C[N@@H+]2C[C@H](C)C[C@@H]2c2ccccc2)c(=S)s1 ZINC000795744215 1046674954 /nfs/dbraw/zinc/67/49/54/1046674954.db2.gz LOHVZGRMNGSMOX-BXUZGUMPSA-N 1 2 305.472 4.023 20 0 DIADLO Cc1nn(C[N@H+]2C[C@H](C)C[C@@H]2c2ccccc2)c(=S)s1 ZINC000795744215 1046674962 /nfs/dbraw/zinc/67/49/62/1046674962.db2.gz LOHVZGRMNGSMOX-BXUZGUMPSA-N 1 2 305.472 4.023 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2cccc(OC(C)(C)C)n2)c(C)s1 ZINC000678610660 1046679216 /nfs/dbraw/zinc/67/92/16/1046679216.db2.gz RDSOFISMQMAWMP-NSHDSACASA-N 1 2 319.474 4.183 20 0 DIADLO CC[C@@H]([NH2+][C@H]1CCn2ccnc21)c1ccc(Cl)cc1Cl ZINC000834835705 1046680409 /nfs/dbraw/zinc/68/04/09/1046680409.db2.gz IPQSSTALYOKRJF-KGLIPLIRSA-N 1 2 310.228 4.376 20 0 DIADLO FC(F)(F)c1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)nc1 ZINC000643860671 1046687704 /nfs/dbraw/zinc/68/77/04/1046687704.db2.gz WRYHFIQBGSSWBC-UHFFFAOYSA-N 1 2 322.334 4.229 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc2c(s1)CCCC2 ZINC000533308272 1046693184 /nfs/dbraw/zinc/69/31/84/1046693184.db2.gz FWNYQTGJOGOZMY-LLVKDONJSA-N 1 2 322.424 4.493 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc2c(s1)CCCC2 ZINC000533308272 1046693189 /nfs/dbraw/zinc/69/31/89/1046693189.db2.gz FWNYQTGJOGOZMY-LLVKDONJSA-N 1 2 322.424 4.493 20 0 DIADLO CCc1noc(C[NH2+][C@H](CCc2ccccc2)c2ccccc2)n1 ZINC000678755062 1046695250 /nfs/dbraw/zinc/69/52/50/1046695250.db2.gz QBFYXJNBLGRNEC-GOSISDBHSA-N 1 2 321.424 4.096 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccccc2C)C2CCC(C)CC2)no1 ZINC000678773760 1046698858 /nfs/dbraw/zinc/69/88/58/1046698858.db2.gz PLGSXOUUOIUUAZ-ZVYVSMAVSA-N 1 2 313.445 4.344 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccccc2C)C2CCC(C)CC2)no1 ZINC000678773758 1046698899 /nfs/dbraw/zinc/69/88/99/1046698899.db2.gz PLGSXOUUOIUUAZ-NSRCDFIJSA-N 1 2 313.445 4.344 20 0 DIADLO CC(C)Oc1c(F)cc(NCc2cccc3[nH+]ccn32)cc1F ZINC000784615670 1046699793 /nfs/dbraw/zinc/69/97/93/1046699793.db2.gz INCAPPLNPHCCFV-UHFFFAOYSA-N 1 2 317.339 4.012 20 0 DIADLO Fc1cccc(-c2ncc(C[NH+]3Cc4ccccc4C3)s2)c1 ZINC001140416738 1046705437 /nfs/dbraw/zinc/70/54/37/1046705437.db2.gz PLNUAHFWUXOUEF-UHFFFAOYSA-N 1 2 310.397 4.465 20 0 DIADLO CCc1nc(C[NH2+][C@@H](CC)c2cc(Cl)ccc2OC)co1 ZINC000834899470 1046709969 /nfs/dbraw/zinc/70/99/69/1046709969.db2.gz HLHKVFWSSSJKBR-AWEZNQCLSA-N 1 2 308.809 4.140 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3csc(-c4ccoc4)n3)CC2)cc1 ZINC000533391162 1046712592 /nfs/dbraw/zinc/71/25/92/1046712592.db2.gz LJIRGDJUCYXVCH-UHFFFAOYSA-N 1 2 314.385 4.321 20 0 DIADLO C[N@H+](Cc1nc2c(s1)CCC2)Cc1ccc(Cl)c(F)c1 ZINC000678837179 1046716395 /nfs/dbraw/zinc/71/63/95/1046716395.db2.gz PRFUNYFGEMESKQ-UHFFFAOYSA-N 1 2 310.825 4.056 20 0 DIADLO C[N@@H+](Cc1nc2c(s1)CCC2)Cc1ccc(Cl)c(F)c1 ZINC000678837179 1046716408 /nfs/dbraw/zinc/71/64/08/1046716408.db2.gz PRFUNYFGEMESKQ-UHFFFAOYSA-N 1 2 310.825 4.056 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2c[nH]c3cccc(Cl)c23)no1 ZINC001140433050 1046721022 /nfs/dbraw/zinc/72/10/22/1046721022.db2.gz OASKRVAKAVXHIE-MRXNPFEDSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2c[nH]c3cccc(Cl)c23)no1 ZINC001140433050 1046721038 /nfs/dbraw/zinc/72/10/38/1046721038.db2.gz OASKRVAKAVXHIE-MRXNPFEDSA-N 1 2 315.804 4.455 20 0 DIADLO CC[N@H+](Cc1cnc2ccc(Cl)cn12)Cc1ccccc1F ZINC001140431859 1046721586 /nfs/dbraw/zinc/72/15/86/1046721586.db2.gz MGYWPHXEBYESOD-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO CC[N@@H+](Cc1cnc2ccc(Cl)cn12)Cc1ccccc1F ZINC001140431859 1046721597 /nfs/dbraw/zinc/72/15/97/1046721597.db2.gz MGYWPHXEBYESOD-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO Fc1ccc([C@H](C[C@H]2CCOC2)[NH2+][C@H]2CCCC2(F)F)cc1 ZINC000644547203 1046721768 /nfs/dbraw/zinc/72/17/68/1046721768.db2.gz GUUFBECBTHXIOT-KCXAZCMYSA-N 1 2 313.363 4.071 20 0 DIADLO CC(C)n1ccn(C[N@H+](C)Cc2ccc(Cl)cc2)c1=S ZINC000834932005 1046722556 /nfs/dbraw/zinc/72/25/56/1046722556.db2.gz CLQRPOMRGAVXTO-UHFFFAOYSA-N 1 2 309.866 4.343 20 0 DIADLO CC(C)n1ccn(C[N@@H+](C)Cc2ccc(Cl)cc2)c1=S ZINC000834932005 1046722571 /nfs/dbraw/zinc/72/25/71/1046722571.db2.gz CLQRPOMRGAVXTO-UHFFFAOYSA-N 1 2 309.866 4.343 20 0 DIADLO O=C1CC[N@@H+](Cc2c[nH]c3cccc(Cl)c23)[C@H]2CCCC[C@@H]12 ZINC001140433201 1046723679 /nfs/dbraw/zinc/72/36/79/1046723679.db2.gz SIEPFCZVUDXGRZ-CJNGLKHVSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c[nH]c3cccc(Cl)c23)[C@H]2CCCC[C@@H]12 ZINC001140433201 1046723694 /nfs/dbraw/zinc/72/36/94/1046723694.db2.gz SIEPFCZVUDXGRZ-CJNGLKHVSA-N 1 2 316.832 4.155 20 0 DIADLO F[C@@H]1C[N@H+](Cc2c[nH]c3cccc(Cl)c23)CCCC1(F)F ZINC001140433256 1046723747 /nfs/dbraw/zinc/72/37/47/1046723747.db2.gz UDQFHUOHNNNFPV-CYBMUJFWSA-N 1 2 316.754 4.391 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2c[nH]c3cccc(Cl)c23)CCCC1(F)F ZINC001140433256 1046723761 /nfs/dbraw/zinc/72/37/61/1046723761.db2.gz UDQFHUOHNNNFPV-CYBMUJFWSA-N 1 2 316.754 4.391 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2cccc(C(C)(F)F)c2)c[nH+]1 ZINC000455237484 1046724684 /nfs/dbraw/zinc/72/46/84/1046724684.db2.gz YNUQVEYEGOZSLS-UHFFFAOYSA-N 1 2 319.355 4.132 20 0 DIADLO Cc1ccc(Cl)nc1C[N@@H+]1CCSc2ccccc2C1 ZINC001140446955 1046729551 /nfs/dbraw/zinc/72/95/51/1046729551.db2.gz PKKGTNONHVJSND-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO Cc1ccc(Cl)nc1C[N@H+]1CCSc2ccccc2C1 ZINC001140446955 1046729569 /nfs/dbraw/zinc/72/95/69/1046729569.db2.gz PKKGTNONHVJSND-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(C)n2)n1 ZINC000533483441 1046734938 /nfs/dbraw/zinc/73/49/38/1046734938.db2.gz LIVVZYPDUUXNAD-LJQANCHMSA-N 1 2 312.461 4.285 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCC[C@@H]2c2cccc(C)n2)n1 ZINC000533483441 1046734948 /nfs/dbraw/zinc/73/49/48/1046734948.db2.gz LIVVZYPDUUXNAD-LJQANCHMSA-N 1 2 312.461 4.285 20 0 DIADLO Fc1ccc(C[N@H+](Cc2nc3c(s2)CCCC3)C2CC2)cc1 ZINC000678940637 1046740281 /nfs/dbraw/zinc/74/02/81/1046740281.db2.gz HKQHUPBXOXACIM-UHFFFAOYSA-N 1 2 316.445 4.326 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2nc3c(s2)CCCC3)C2CC2)cc1 ZINC000678940637 1046740299 /nfs/dbraw/zinc/74/02/99/1046740299.db2.gz HKQHUPBXOXACIM-UHFFFAOYSA-N 1 2 316.445 4.326 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2nc3c(s2)CCCC3)o1 ZINC000678945149 1046740621 /nfs/dbraw/zinc/74/06/21/1046740621.db2.gz CMQSTIASXKTBAI-YPMHNXCESA-N 1 2 302.443 4.028 20 0 DIADLO COc1cc(F)cc(C[N@H+](C)Cc2nc3ccccc3s2)c1 ZINC001140477623 1046741299 /nfs/dbraw/zinc/74/12/99/1046741299.db2.gz HZHRUPPNEDOBEN-UHFFFAOYSA-N 1 2 316.401 4.076 20 0 DIADLO COc1cc(F)cc(C[N@@H+](C)Cc2nc3ccccc3s2)c1 ZINC001140477623 1046741313 /nfs/dbraw/zinc/74/13/13/1046741313.db2.gz HZHRUPPNEDOBEN-UHFFFAOYSA-N 1 2 316.401 4.076 20 0 DIADLO COc1cc(F)cc(C[N@@H+]2CCc3c(Cl)cccc3C2)c1 ZINC001140483711 1046742731 /nfs/dbraw/zinc/74/27/31/1046742731.db2.gz ZGPOHIHBLKJDTN-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(F)cc(C[N@H+]2CCc3c(Cl)cccc3C2)c1 ZINC001140483711 1046742740 /nfs/dbraw/zinc/74/27/40/1046742740.db2.gz ZGPOHIHBLKJDTN-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Clc1ccc(C[NH2+]Cc2ccc(Sc3ccccn3)o2)o1 ZINC000644883547 1046746274 /nfs/dbraw/zinc/74/62/74/1046746274.db2.gz BLUHYCDHYGRWPY-UHFFFAOYSA-N 1 2 320.801 4.362 20 0 DIADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)[C@@H]1CC12CCC2 ZINC000644965548 1046752149 /nfs/dbraw/zinc/75/21/49/1046752149.db2.gz OJMHHFRXFQIZGT-INIZCTEOSA-N 1 2 321.424 4.015 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)cc1Cl ZINC000533558903 1046753571 /nfs/dbraw/zinc/75/35/71/1046753571.db2.gz ZFIKEDBBALGCBN-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)cc1Cl ZINC000533558903 1046753582 /nfs/dbraw/zinc/75/35/82/1046753582.db2.gz ZFIKEDBBALGCBN-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)[C@H]1CC[C@H]1[NH2+]c1ccc(N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000796916817 1046759224 /nfs/dbraw/zinc/75/92/24/1046759224.db2.gz IGDSNQHDZRHJEN-WTLGNFPFSA-N 1 2 302.462 4.147 20 0 DIADLO Cc1ccc(OCCCC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000645092357 1046764779 /nfs/dbraw/zinc/76/47/79/1046764779.db2.gz COCCLYDAHMHQOH-UHFFFAOYSA-N 1 2 312.413 4.113 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1ccnn1-c1ccccc1)CC2 ZINC001140530928 1046768541 /nfs/dbraw/zinc/76/85/41/1046768541.db2.gz HFFDWMDWGQLJBV-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1ccnn1-c1ccccc1)CC2 ZINC001140530928 1046768548 /nfs/dbraw/zinc/76/85/48/1046768548.db2.gz HFFDWMDWGQLJBV-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCCc3ccccc3CC2)c(C)[nH+]1 ZINC000455466506 1046769153 /nfs/dbraw/zinc/76/91/53/1046769153.db2.gz AFZRTWKDCFEYJS-UHFFFAOYSA-N 1 2 323.440 4.030 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H]2CCC[C@H]2c2ccccc2)c(C)[nH+]1 ZINC000455476117 1046769606 /nfs/dbraw/zinc/76/96/06/1046769606.db2.gz LNWPBXSFAUSUGJ-ROUUACIJSA-N 1 2 323.440 4.465 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](C)c2c(F)cccc2F)c(C)[nH+]1 ZINC000455468123 1046769634 /nfs/dbraw/zinc/76/96/34/1046769634.db2.gz GYUJPNKGWBJEHS-LLVKDONJSA-N 1 2 319.355 4.168 20 0 DIADLO Cc1cc(C)c(NC(=O)Nc2ccccc2OC(C)C)c(C)[nH+]1 ZINC000455492193 1046771542 /nfs/dbraw/zinc/77/15/42/1046771542.db2.gz ZGZBKTOASBVCAB-UHFFFAOYSA-N 1 2 313.401 4.438 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)[C@H]2CCc3ccccc3C2)c(C)[nH+]1 ZINC000455485342 1046773617 /nfs/dbraw/zinc/77/36/17/1046773617.db2.gz RDEZQVWTXGOBMD-SFHVURJKSA-N 1 2 323.440 4.028 20 0 DIADLO COc1cccc2c1CC[N@H+](Cc1cc(F)cc(Cl)c1)C2 ZINC001140542252 1046774383 /nfs/dbraw/zinc/77/43/83/1046774383.db2.gz JAFOLWZJUZTKCV-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc2c1CC[N@@H+](Cc1cc(F)cc(Cl)c1)C2 ZINC001140542252 1046774395 /nfs/dbraw/zinc/77/43/95/1046774395.db2.gz JAFOLWZJUZTKCV-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Cc1nc([C@H]([NH2+][C@H](C)CC2CCC2)c2ccc(Cl)cc2)no1 ZINC000679092398 1046774495 /nfs/dbraw/zinc/77/44/95/1046774495.db2.gz SIBCLNYFGRKWKV-BDJLRTHQSA-N 1 2 319.836 4.289 20 0 DIADLO Cc1nc([C@@H]([NH2+][C@@H](C)CC2CCC2)c2ccc(Cl)cc2)no1 ZINC000679092404 1046775262 /nfs/dbraw/zinc/77/52/62/1046775262.db2.gz SIBCLNYFGRKWKV-ZBEGNZNMSA-N 1 2 319.836 4.289 20 0 DIADLO Cc1cc(C)c(NC(=O)N(Cc2ccco2)C(C)C)c(C)[nH+]1 ZINC000455492469 1046775546 /nfs/dbraw/zinc/77/55/46/1046775546.db2.gz ZZCMBBLEBMJZSA-UHFFFAOYSA-N 1 2 301.390 4.042 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1c[nH]nc1C(C)(C)C ZINC000679118045 1046776246 /nfs/dbraw/zinc/77/62/46/1046776246.db2.gz YHNDQOBLNZVPGD-UHFFFAOYSA-N 1 2 311.433 4.079 20 0 DIADLO Cc1cc(C)c(NC(=O)NC(C)(C)c2cccs2)c(C)[nH+]1 ZINC000455502149 1046776855 /nfs/dbraw/zinc/77/68/55/1046776855.db2.gz UTLQHPBWITVLTN-UHFFFAOYSA-N 1 2 303.431 4.125 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC(C)(C)[C@H]3CCC[C@@H]32)c(C)[nH+]1 ZINC000455513579 1046779844 /nfs/dbraw/zinc/77/98/44/1046779844.db2.gz JCHFVQHHYCVOPR-GJZGRUSLSA-N 1 2 301.434 4.049 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC3(CCCC3)[C@@H]2C(C)C)c(C)[nH+]1 ZINC000455514438 1046780387 /nfs/dbraw/zinc/78/03/87/1046780387.db2.gz JTNWAZWPLBIJRW-KRWDZBQOSA-N 1 2 315.461 4.439 20 0 DIADLO Cc1ccc(F)c(CN(C)C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000455537376 1046783642 /nfs/dbraw/zinc/78/36/42/1046783642.db2.gz WMVGVDYHCMJGQM-UHFFFAOYSA-N 1 2 315.392 4.118 20 0 DIADLO COc1cc(C[N@H+](C)Cc2cccc(F)c2Cl)cc(OC)c1 ZINC001140563419 1046783687 /nfs/dbraw/zinc/78/36/87/1046783687.db2.gz VZLAWYRGJSJETH-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2cccc(F)c2Cl)cc(OC)c1 ZINC001140563419 1046783700 /nfs/dbraw/zinc/78/37/00/1046783700.db2.gz VZLAWYRGJSJETH-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO Cc1ccc(C)c(CN(C)C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000455540763 1046784161 /nfs/dbraw/zinc/78/41/61/1046784161.db2.gz YWEAZIOBGKFGPC-UHFFFAOYSA-N 1 2 311.429 4.288 20 0 DIADLO Clc1cnc(C[NH+]2CCC(c3cccnc3)CC2)c(Cl)c1 ZINC000679151064 1046788665 /nfs/dbraw/zinc/78/86/65/1046788665.db2.gz MCYODFKATJYDFL-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO C[N@H+](Cc1nnc(-c2ccccc2)o1)Cc1cccc(Cl)c1 ZINC000069219517 1046792140 /nfs/dbraw/zinc/79/21/40/1046792140.db2.gz ACCLWKQWZUMCDU-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1nnc(-c2ccccc2)o1)Cc1cccc(Cl)c1 ZINC000069219517 1046792148 /nfs/dbraw/zinc/79/21/48/1046792148.db2.gz ACCLWKQWZUMCDU-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)[C@H](C)c2cccc(C)c2)n1 ZINC000247320275 1046827065 /nfs/dbraw/zinc/82/70/65/1046827065.db2.gz WDGDXVRROHPDGS-KGLIPLIRSA-N 1 2 319.474 4.385 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)[C@H](C)c2cccc(C)c2)n1 ZINC000247320275 1046827088 /nfs/dbraw/zinc/82/70/88/1046827088.db2.gz WDGDXVRROHPDGS-KGLIPLIRSA-N 1 2 319.474 4.385 20 0 DIADLO COCC[C@H]([NH2+][C@H](C)c1nc(C)sc1C)c1ccc(C)o1 ZINC000679359918 1046827842 /nfs/dbraw/zinc/82/78/42/1046827842.db2.gz GDJKAIFGPSUWLX-RISCZKNCSA-N 1 2 308.447 4.090 20 0 DIADLO CCO[C@@H](C)c1nc(C[NH2+]C2(c3ccccc3C)CC2)cs1 ZINC000645980010 1046835645 /nfs/dbraw/zinc/83/56/45/1046835645.db2.gz ZCQHNNOVCRUSTN-AWEZNQCLSA-N 1 2 316.470 4.328 20 0 DIADLO Cc1ccc(-c2nnc(C[NH2+]C3(c4ccccc4C)CC3)o2)cc1 ZINC000645979462 1046836213 /nfs/dbraw/zinc/83/62/13/1046836213.db2.gz JOSNMRFQSXZFAO-UHFFFAOYSA-N 1 2 319.408 4.132 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2nc(C)c(C)o2)o1 ZINC000076145156 1046845788 /nfs/dbraw/zinc/84/57/88/1046845788.db2.gz QEZHNPOKZBFHJI-LRDDRELGSA-N 1 2 302.418 4.420 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2nc(C)c(C)o2)o1 ZINC000076145156 1046845812 /nfs/dbraw/zinc/84/58/12/1046845812.db2.gz QEZHNPOKZBFHJI-LRDDRELGSA-N 1 2 302.418 4.420 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cccc(O)c2Cl)n1 ZINC000646087816 1046853162 /nfs/dbraw/zinc/85/31/62/1046853162.db2.gz GGMBRNRZZJQQCB-HNNXBMFYSA-N 1 2 302.805 4.086 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cccc(O)c2Cl)n1 ZINC000646087816 1046853185 /nfs/dbraw/zinc/85/31/85/1046853185.db2.gz GGMBRNRZZJQQCB-HNNXBMFYSA-N 1 2 302.805 4.086 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccc(Cl)nc1 ZINC000797585613 1046856661 /nfs/dbraw/zinc/85/66/61/1046856661.db2.gz IUZJVHMGQMLQCH-ZETCQYMHSA-N 1 2 318.701 4.142 20 0 DIADLO CCc1nnc([C@H](C)[N@@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)o1 ZINC000646117172 1046858995 /nfs/dbraw/zinc/85/89/95/1046858995.db2.gz RMZOGDNGGIBLME-YOEHRIQHSA-N 1 2 309.413 4.086 20 0 DIADLO CCc1nnc([C@H](C)[N@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)o1 ZINC000646117172 1046859016 /nfs/dbraw/zinc/85/90/16/1046859016.db2.gz RMZOGDNGGIBLME-YOEHRIQHSA-N 1 2 309.413 4.086 20 0 DIADLO Fc1cc(C[NH+]2CCC(c3ccccn3)CC2)c(F)cc1Cl ZINC001140701558 1046863898 /nfs/dbraw/zinc/86/38/98/1046863898.db2.gz RBWHNBBVZSJFMP-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Cc1ccc(C2([NH2+]Cc3nc(C4CCCC4)no3)CCC2)cc1 ZINC000646131010 1046865068 /nfs/dbraw/zinc/86/50/68/1046865068.db2.gz YTTHITKFULMEEJ-UHFFFAOYSA-N 1 2 311.429 4.205 20 0 DIADLO Cc1nc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)nc2ccccc12 ZINC000679549709 1046867878 /nfs/dbraw/zinc/86/78/78/1046867878.db2.gz YPHVJQJZHZZQEO-YPMHNXCESA-N 1 2 323.362 4.101 20 0 DIADLO Cc1nc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)nc2ccccc12 ZINC000679549709 1046867892 /nfs/dbraw/zinc/86/78/92/1046867892.db2.gz YPHVJQJZHZZQEO-YPMHNXCESA-N 1 2 323.362 4.101 20 0 DIADLO Cc1cc(CNc2ccc(N3CCCCC3)[nH+]c2)cc(Cl)n1 ZINC000797601696 1046870228 /nfs/dbraw/zinc/87/02/28/1046870228.db2.gz WQVXPILQBRRTKK-UHFFFAOYSA-N 1 2 316.836 4.041 20 0 DIADLO Nc1ccc(Cl)cc1C[N@@H+]1CCc2cccc(Cl)c2C1 ZINC001140718205 1046871012 /nfs/dbraw/zinc/87/10/12/1046871012.db2.gz UOTHQUOGTKSRPC-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1ccc(Cl)cc1C[N@H+]1CCc2cccc(Cl)c2C1 ZINC001140718205 1046871029 /nfs/dbraw/zinc/87/10/29/1046871029.db2.gz UOTHQUOGTKSRPC-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cc(F)c(F)c(F)c2)cc(Cl)n1 ZINC000797601834 1046871166 /nfs/dbraw/zinc/87/11/66/1046871166.db2.gz ZJCDILHUTLTEDJ-UHFFFAOYSA-N 1 2 314.738 4.093 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cc(F)c(F)c(F)c2)cc(Cl)n1 ZINC000797601834 1046871182 /nfs/dbraw/zinc/87/11/82/1046871182.db2.gz ZJCDILHUTLTEDJ-UHFFFAOYSA-N 1 2 314.738 4.093 20 0 DIADLO Clc1ncc2ccccc2c1C[N@@H+]1CCOc2ccccc2C1 ZINC001140722308 1046875143 /nfs/dbraw/zinc/87/51/43/1046875143.db2.gz SFNXYOMAUOBWOP-UHFFFAOYSA-N 1 2 324.811 4.283 20 0 DIADLO Clc1ncc2ccccc2c1C[N@H+]1CCOc2ccccc2C1 ZINC001140722308 1046875159 /nfs/dbraw/zinc/87/51/59/1046875159.db2.gz SFNXYOMAUOBWOP-UHFFFAOYSA-N 1 2 324.811 4.283 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000077171029 1046875097 /nfs/dbraw/zinc/87/50/97/1046875097.db2.gz KBULLIZMFYFZNG-OAHLLOKOSA-N 1 2 313.426 4.377 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000077171029 1046875108 /nfs/dbraw/zinc/87/51/08/1046875108.db2.gz KBULLIZMFYFZNG-OAHLLOKOSA-N 1 2 313.426 4.377 20 0 DIADLO Oc1cccc2c1CC[N@H+](Cc1c(Cl)ncc3ccccc31)C2 ZINC001140721181 1046875388 /nfs/dbraw/zinc/87/53/88/1046875388.db2.gz JHGXQWGOZGBBFO-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1cccc2c1CC[N@@H+](Cc1c(Cl)ncc3ccccc31)C2 ZINC001140721181 1046875394 /nfs/dbraw/zinc/87/53/94/1046875394.db2.gz JHGXQWGOZGBBFO-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000679583745 1046876497 /nfs/dbraw/zinc/87/64/97/1046876497.db2.gz HCUXNCLUWJMUKM-TZMCWYRMSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000679583745 1046876516 /nfs/dbraw/zinc/87/65/16/1046876516.db2.gz HCUXNCLUWJMUKM-TZMCWYRMSA-N 1 2 323.362 4.240 20 0 DIADLO Cc1ccc(Br)c(C[N@H+](C)Cc2cccc(O)c2)c1 ZINC001137380688 1046884612 /nfs/dbraw/zinc/88/46/12/1046884612.db2.gz ULFCAFFMSNBKAU-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1ccc(Br)c(C[N@@H+](C)Cc2cccc(O)c2)c1 ZINC001137380688 1046884621 /nfs/dbraw/zinc/88/46/21/1046884621.db2.gz ULFCAFFMSNBKAU-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)c(C)c1 ZINC000078264165 1046908024 /nfs/dbraw/zinc/90/80/24/1046908024.db2.gz VSJLWGLRHHGBEI-UHFFFAOYSA-N 1 2 305.381 4.050 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H]3CC[C@@H]4CCCC[C@H]4C3)cc2[nH+]1 ZINC001137392757 1046911365 /nfs/dbraw/zinc/91/13/65/1046911365.db2.gz IRPNEXMZIZNKQJ-SOUVJXGZSA-N 1 2 311.429 4.416 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1cccc(-c3ccncc3)c1)C2 ZINC001137393221 1046911633 /nfs/dbraw/zinc/91/16/33/1046911633.db2.gz IINKVSSYUUWGLN-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1cccc(-c3ccncc3)c1)C2 ZINC001137393221 1046911635 /nfs/dbraw/zinc/91/16/35/1046911635.db2.gz IINKVSSYUUWGLN-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO CC[N@H+](Cc1ccc(OC)cc1)Cc1c(F)cc(OC)cc1F ZINC001140830218 1046920054 /nfs/dbraw/zinc/92/00/54/1046920054.db2.gz QXSFKNYDKPVYLA-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)cc1)Cc1c(F)cc(OC)cc1F ZINC001140830218 1046920062 /nfs/dbraw/zinc/92/00/62/1046920062.db2.gz QXSFKNYDKPVYLA-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CCSc1nn(C[NH+]2CCCCCCC2)c(=S)s1 ZINC000798150067 1046931867 /nfs/dbraw/zinc/93/18/67/1046931867.db2.gz ONLQPRARKWHLTK-UHFFFAOYSA-N 1 2 303.522 4.010 20 0 DIADLO CC1CCC(=CC(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)CC1 ZINC000303581236 1046933964 /nfs/dbraw/zinc/93/39/64/1046933964.db2.gz OYHBMIUQEKDNAP-UHFFFAOYSA-N 1 2 313.376 4.086 20 0 DIADLO CC[C@H]([NH2+][C@H]1COCc2cccc(Cl)c21)c1c(C)noc1C ZINC000798181498 1046934547 /nfs/dbraw/zinc/93/45/47/1046934547.db2.gz KRBJBQFYANNKCX-GJZGRUSLSA-N 1 2 320.820 4.257 20 0 DIADLO Nc1cccc(F)c1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001140877780 1046938725 /nfs/dbraw/zinc/93/87/25/1046938725.db2.gz UICFPMVBNMERHC-KRWDZBQOSA-N 1 2 306.331 4.023 20 0 DIADLO Nc1cccc(F)c1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001140877780 1046938733 /nfs/dbraw/zinc/93/87/33/1046938733.db2.gz UICFPMVBNMERHC-KRWDZBQOSA-N 1 2 306.331 4.023 20 0 DIADLO C[N@H+](Cc1cc(Cl)cc(Cl)c1)Cc1c(N)cccc1F ZINC001140877883 1046939275 /nfs/dbraw/zinc/93/92/75/1046939275.db2.gz KENRMDMOHFVEJQ-UHFFFAOYSA-N 1 2 313.203 4.347 20 0 DIADLO C[N@@H+](Cc1cc(Cl)cc(Cl)c1)Cc1c(N)cccc1F ZINC001140877883 1046939282 /nfs/dbraw/zinc/93/92/82/1046939282.db2.gz KENRMDMOHFVEJQ-UHFFFAOYSA-N 1 2 313.203 4.347 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)C(C)(C)C ZINC000261434128 1046940478 /nfs/dbraw/zinc/94/04/78/1046940478.db2.gz JUVQEYFYPNONKT-LBPRGKRZSA-N 1 2 303.381 4.022 20 0 DIADLO C[N@H+](Cc1cncs1)Cc1cc(F)c(C(F)(F)F)c(F)c1 ZINC001140881952 1046941275 /nfs/dbraw/zinc/94/12/75/1046941275.db2.gz MTEUJDCLPHGYMS-UHFFFAOYSA-N 1 2 322.302 4.072 20 0 DIADLO C[N@@H+](Cc1cncs1)Cc1cc(F)c(C(F)(F)F)c(F)c1 ZINC001140881952 1046941282 /nfs/dbraw/zinc/94/12/82/1046941282.db2.gz MTEUJDCLPHGYMS-UHFFFAOYSA-N 1 2 322.302 4.072 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc(O)c(F)c1F ZINC001140894448 1046945862 /nfs/dbraw/zinc/94/58/62/1046945862.db2.gz YTTMNWOREMABOM-AWEZNQCLSA-N 1 2 319.351 4.016 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nnc(CC)s1)c1ccc(F)cc1F ZINC000680076122 1046946983 /nfs/dbraw/zinc/94/69/83/1046946983.db2.gz TYQOVNVOSIAJJB-CYBMUJFWSA-N 1 2 311.401 4.010 20 0 DIADLO CCn1nc(C)c(C[N@H+](Cc2ccco2)Cc2ccccc2)c1C ZINC000162207864 1046949425 /nfs/dbraw/zinc/94/94/25/1046949425.db2.gz NUJAWAJLVDRNLC-UHFFFAOYSA-N 1 2 323.440 4.315 20 0 DIADLO CCn1nc(C)c(C[N@@H+](Cc2ccco2)Cc2ccccc2)c1C ZINC000162207864 1046949433 /nfs/dbraw/zinc/94/94/33/1046949433.db2.gz NUJAWAJLVDRNLC-UHFFFAOYSA-N 1 2 323.440 4.315 20 0 DIADLO C[N@H+](Cc1ccccc1Cl)Cc1cnccc1C(F)(F)F ZINC001140918525 1046949454 /nfs/dbraw/zinc/94/94/54/1046949454.db2.gz SCGZTMKFCJMNGI-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccccc1Cl)Cc1cnccc1C(F)(F)F ZINC001140918525 1046949464 /nfs/dbraw/zinc/94/94/64/1046949464.db2.gz SCGZTMKFCJMNGI-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2ncc(C(C)(C)C)s2)CC1 ZINC000647233123 1046958714 /nfs/dbraw/zinc/95/87/14/1046958714.db2.gz UMYCCLQCJOUTHU-UHFFFAOYSA-N 1 2 316.470 4.228 20 0 DIADLO CCc1cnc(C[N@@H+]2CCCC[C@@H]2c2ccccc2OC)s1 ZINC000680331375 1046963141 /nfs/dbraw/zinc/96/31/41/1046963141.db2.gz ZDIPTGGHHCRSBJ-MRXNPFEDSA-N 1 2 316.470 4.441 20 0 DIADLO CCc1cnc(C[N@H+]2CCCC[C@@H]2c2ccccc2OC)s1 ZINC000680331375 1046963156 /nfs/dbraw/zinc/96/31/56/1046963156.db2.gz ZDIPTGGHHCRSBJ-MRXNPFEDSA-N 1 2 316.470 4.441 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2N(C)C)cs1 ZINC000162391021 1046965888 /nfs/dbraw/zinc/96/58/88/1046965888.db2.gz AQHVEEWQJJWZOI-NWDGAFQWSA-N 1 2 321.465 4.322 20 0 DIADLO CC[C@@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1ccccc1F ZINC000680355314 1046974078 /nfs/dbraw/zinc/97/40/78/1046974078.db2.gz WMXGKLDZBVIXMB-HUUCEWRRSA-N 1 2 307.315 4.278 20 0 DIADLO O=C(CC1CCC1)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000079580082 1046982833 /nfs/dbraw/zinc/98/28/33/1046982833.db2.gz AODBKKHPDWNRFW-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO CCCCc1[nH]c(CN2CCC[C@@H]2c2c(F)cccc2F)c[nH+]1 ZINC001141071421 1046999274 /nfs/dbraw/zinc/99/92/74/1046999274.db2.gz OEKZPHNZWMAFKN-MRXNPFEDSA-N 1 2 319.399 4.368 20 0 DIADLO CCCCc1[nH]cc(CN2CCC[C@@H]2c2c(F)cccc2F)[nH+]1 ZINC001141071421 1046999279 /nfs/dbraw/zinc/99/92/79/1046999279.db2.gz OEKZPHNZWMAFKN-MRXNPFEDSA-N 1 2 319.399 4.368 20 0 DIADLO CC(C)=CCC[C@@H](C)NC(=O)c1c[nH+]ccc1Nc1ccccc1 ZINC001141085621 1047002793 /nfs/dbraw/zinc/00/27/93/1047002793.db2.gz CPCOTBDOVCOFAX-MRXNPFEDSA-N 1 2 323.440 4.112 20 0 DIADLO Clc1cccc(C2=CC[N@H+](Cc3cnc(Cl)cn3)CC2)c1 ZINC000799170263 1047005652 /nfs/dbraw/zinc/00/56/52/1047005652.db2.gz VSOWPOUTRDINNL-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1cccc(C2=CC[N@@H+](Cc3cnc(Cl)cn3)CC2)c1 ZINC000799170263 1047005667 /nfs/dbraw/zinc/00/56/67/1047005667.db2.gz VSOWPOUTRDINNL-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Nc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000647513902 1047005834 /nfs/dbraw/zinc/00/58/34/1047005834.db2.gz QEPKQRDUWWBCPA-HNNXBMFYSA-N 1 2 322.239 4.138 20 0 DIADLO Nc1ccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000647513902 1047005852 /nfs/dbraw/zinc/00/58/52/1047005852.db2.gz QEPKQRDUWWBCPA-HNNXBMFYSA-N 1 2 322.239 4.138 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cccc(C)c2Br)cn1 ZINC001141092862 1047007556 /nfs/dbraw/zinc/00/75/56/1047007556.db2.gz HHEPMEUVUYKEIM-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cccc(C)c2Br)cn1 ZINC001141092862 1047007568 /nfs/dbraw/zinc/00/75/68/1047007568.db2.gz HHEPMEUVUYKEIM-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2cccnc2C)c1Br ZINC001141093132 1047008231 /nfs/dbraw/zinc/00/82/31/1047008231.db2.gz QYAYSFCSKDCAEZ-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2cccnc2C)c1Br ZINC001141093132 1047008245 /nfs/dbraw/zinc/00/82/45/1047008245.db2.gz QYAYSFCSKDCAEZ-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccnc(-c2ccc(F)cc2)c1 ZINC001141119937 1047020040 /nfs/dbraw/zinc/02/00/40/1047020040.db2.gz CUCHLTDJGJKEBD-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccnc(-c2ccc(F)cc2)c1 ZINC001141119937 1047020049 /nfs/dbraw/zinc/02/00/49/1047020049.db2.gz CUCHLTDJGJKEBD-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO CCCCC1CC[NH+](Cc2ncc(Cl)nc2Cl)CC1 ZINC001141134007 1047023348 /nfs/dbraw/zinc/02/33/48/1047023348.db2.gz MDIZQSJVWIUAEW-UHFFFAOYSA-N 1 2 302.249 4.186 20 0 DIADLO Clc1cnc(C[N@H+](Cc2ccccc2)C2CCC2)c(Cl)n1 ZINC001141136840 1047024868 /nfs/dbraw/zinc/02/48/68/1047024868.db2.gz AQFYLKGCDRUHSK-UHFFFAOYSA-N 1 2 322.239 4.338 20 0 DIADLO Clc1cnc(C[N@@H+](Cc2ccccc2)C2CCC2)c(Cl)n1 ZINC001141136840 1047024883 /nfs/dbraw/zinc/02/48/83/1047024883.db2.gz AQFYLKGCDRUHSK-UHFFFAOYSA-N 1 2 322.239 4.338 20 0 DIADLO C[C@H](Sc1ccccc1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000162719955 1047027498 /nfs/dbraw/zinc/02/74/98/1047027498.db2.gz ABBNDBGOOLVHDR-ZDUSSCGKSA-N 1 2 323.421 4.196 20 0 DIADLO Cc1[nH+]cn(-c2ccc(NC3CCC(F)(F)CC3)cc2)c1C ZINC000648037698 1047031955 /nfs/dbraw/zinc/03/19/55/1047031955.db2.gz ZEQBBHTUYCSVCC-UHFFFAOYSA-N 1 2 305.372 4.479 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2ccccc2C(C)(F)F)c[nH+]1 ZINC000455789453 1047039722 /nfs/dbraw/zinc/03/97/22/1047039722.db2.gz MBRFKYKDDZHFCR-UHFFFAOYSA-N 1 2 319.355 4.132 20 0 DIADLO COc1ccc(C(F)(F)F)cc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC001141203667 1047044045 /nfs/dbraw/zinc/04/40/45/1047044045.db2.gz SOMYEYVMSFSPJX-LBPRGKRZSA-N 1 2 324.346 4.092 20 0 DIADLO COc1ccc(C(F)(F)F)cc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC001141203667 1047044056 /nfs/dbraw/zinc/04/40/56/1047044056.db2.gz SOMYEYVMSFSPJX-LBPRGKRZSA-N 1 2 324.346 4.092 20 0 DIADLO CCc1nc(C[N@H+](C)Cc2c(C)oc3ccccc32)cs1 ZINC000536654887 1047046016 /nfs/dbraw/zinc/04/60/16/1047046016.db2.gz WQVKBUHENZSYFW-UHFFFAOYSA-N 1 2 300.427 4.392 20 0 DIADLO CCc1nc(C[N@@H+](C)Cc2c(C)oc3ccccc32)cs1 ZINC000536654887 1047046030 /nfs/dbraw/zinc/04/60/30/1047046030.db2.gz WQVKBUHENZSYFW-UHFFFAOYSA-N 1 2 300.427 4.392 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)c(Cl)s1 ZINC000648361122 1047048184 /nfs/dbraw/zinc/04/81/84/1047048184.db2.gz TWGNCCRYRDAYPX-SECBINFHSA-N 1 2 316.257 4.158 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)c(Cl)s1 ZINC000648361122 1047048199 /nfs/dbraw/zinc/04/81/99/1047048199.db2.gz TWGNCCRYRDAYPX-SECBINFHSA-N 1 2 316.257 4.158 20 0 DIADLO COc1cccc(C[N@@H+]2CCc3c(Cl)cccc3C2)c1F ZINC001141222802 1047050363 /nfs/dbraw/zinc/05/03/63/1047050363.db2.gz SDGSJPULBPHXBD-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc(C[N@H+]2CCc3c(Cl)cccc3C2)c1F ZINC001141222802 1047050369 /nfs/dbraw/zinc/05/03/69/1047050369.db2.gz SDGSJPULBPHXBD-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO O=C(c1ccc(F)cc1)[C@@H]1CCC[N@H+](Cc2ccc(Cl)o2)C1 ZINC000536661208 1047053473 /nfs/dbraw/zinc/05/34/73/1047053473.db2.gz NIASTJVCDIRPBK-CYBMUJFWSA-N 1 2 321.779 4.167 20 0 DIADLO O=C(c1ccc(F)cc1)[C@@H]1CCC[N@@H+](Cc2ccc(Cl)o2)C1 ZINC000536661208 1047053489 /nfs/dbraw/zinc/05/34/89/1047053489.db2.gz NIASTJVCDIRPBK-CYBMUJFWSA-N 1 2 321.779 4.167 20 0 DIADLO c1ccc2c(c1)[nH+]c(NCc1nc3c(s1)CCCC3)n2C1CC1 ZINC000680852646 1047054761 /nfs/dbraw/zinc/05/47/61/1047054761.db2.gz MGWGPRSZTQLKMU-UHFFFAOYSA-N 1 2 324.453 4.319 20 0 DIADLO COCc1cccc(CNc2[nH+]c3ccccc3n2C2CC2)c1 ZINC000680852502 1047055189 /nfs/dbraw/zinc/05/51/89/1047055189.db2.gz CDZJEXIPHGBKEN-UHFFFAOYSA-N 1 2 307.397 4.130 20 0 DIADLO COc1ccc(CNc2[nH+]c3ccccc3n2C2CC2)c(OC)c1 ZINC000680852477 1047055433 /nfs/dbraw/zinc/05/54/33/1047055433.db2.gz BFNLXONCKDRDFV-UHFFFAOYSA-N 1 2 323.396 4.001 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC001141231408 1047056342 /nfs/dbraw/zinc/05/63/42/1047056342.db2.gz NPRCJESUZHCHSB-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC001141231408 1047056351 /nfs/dbraw/zinc/05/63/51/1047056351.db2.gz NPRCJESUZHCHSB-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1cc(N[C@@H]2Cc3[nH]c4ccccc4c3C2)ccc1[NH+](C)C ZINC000799724848 1047057549 /nfs/dbraw/zinc/05/75/49/1047057549.db2.gz SNFZZQCHFMTNOG-HNNXBMFYSA-N 1 2 305.425 4.122 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccc(Cl)c(C)c1)CC2 ZINC001141236602 1047057729 /nfs/dbraw/zinc/05/77/29/1047057729.db2.gz WKXOORUCUPQSCF-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1ccc(Cl)c(C)c1)CC2 ZINC001141236602 1047057743 /nfs/dbraw/zinc/05/77/43/1047057743.db2.gz WKXOORUCUPQSCF-UHFFFAOYSA-N 1 2 313.828 4.409 20 0 DIADLO Cc1[nH]ncc1C[N@@H+]1C[C@@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000536663636 1047058309 /nfs/dbraw/zinc/05/83/09/1047058309.db2.gz RHTJSLOLSBKDIQ-ZBEGNZNMSA-N 1 2 323.362 4.320 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1C[C@@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000536663636 1047058313 /nfs/dbraw/zinc/05/83/13/1047058313.db2.gz RHTJSLOLSBKDIQ-ZBEGNZNMSA-N 1 2 323.362 4.320 20 0 DIADLO Clc1cnc(NCc2cc[nH+]c(N3CCCCCC3)c2)s1 ZINC000680893421 1047063312 /nfs/dbraw/zinc/06/33/12/1047063312.db2.gz GMJJPUFBAHHCTN-UHFFFAOYSA-N 1 2 322.865 4.184 20 0 DIADLO Cc1cnccc1C[N@H+]1C[C@H](c2cccc(Cl)c2)OC[C@H]1C ZINC000648535263 1047064124 /nfs/dbraw/zinc/06/41/24/1047064124.db2.gz YRMYOEFZQNHZGQ-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1cnccc1C[N@@H+]1C[C@H](c2cccc(Cl)c2)OC[C@H]1C ZINC000648535263 1047064139 /nfs/dbraw/zinc/06/41/39/1047064139.db2.gz YRMYOEFZQNHZGQ-RDTXWAMCSA-N 1 2 316.832 4.005 20 0 DIADLO Clc1ccc(Br)c(C[N@@H+]2CCC23CCC3)c1 ZINC000536677862 1047069976 /nfs/dbraw/zinc/06/99/76/1047069976.db2.gz OTPVTKZMAXIZEK-UHFFFAOYSA-N 1 2 300.627 4.231 20 0 DIADLO Clc1ccc(Br)c(C[N@H+]2CCC23CCC3)c1 ZINC000536677862 1047069989 /nfs/dbraw/zinc/06/99/89/1047069989.db2.gz OTPVTKZMAXIZEK-UHFFFAOYSA-N 1 2 300.627 4.231 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)c1 ZINC000536695588 1047071771 /nfs/dbraw/zinc/07/17/71/1047071771.db2.gz IGAVXBVBQJXMPS-DYVFJYSZSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)c1 ZINC000536695588 1047071781 /nfs/dbraw/zinc/07/17/81/1047071781.db2.gz IGAVXBVBQJXMPS-DYVFJYSZSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1nc([C@@H](C)[NH2+]Cc2cccc(C(F)(F)F)n2)c(C)s1 ZINC000648656381 1047078337 /nfs/dbraw/zinc/07/83/37/1047078337.db2.gz NMYQQUSPFTULBX-MRVPVSSYSA-N 1 2 315.364 4.025 20 0 DIADLO COc1ccc(OCCNc2cc(C)c3ccccc3[nH+]2)cc1 ZINC001115818749 1047082332 /nfs/dbraw/zinc/08/23/32/1047082332.db2.gz VFPWPZONFPNORY-UHFFFAOYSA-N 1 2 308.381 4.043 20 0 DIADLO CC(C)=CCC[C@H](C)CC(=O)N1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000648823867 1047094087 /nfs/dbraw/zinc/09/40/87/1047094087.db2.gz VZDAZRVDCXFYQM-BZSNNMDCSA-N 1 2 317.477 4.065 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cn1ccc(-c2ccccc2)n1 ZINC001116017855 1047100273 /nfs/dbraw/zinc/10/02/73/1047100273.db2.gz MAJLRGZMOJCUCR-UHFFFAOYSA-N 1 2 309.388 4.169 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cn1ccc(-c2ccccc2)n1 ZINC001116017855 1047100276 /nfs/dbraw/zinc/10/02/76/1047100276.db2.gz MAJLRGZMOJCUCR-UHFFFAOYSA-N 1 2 309.388 4.169 20 0 DIADLO CCSc1cccc(C[NH2+][C@@H]2COc3cc(F)cc(F)c32)c1 ZINC000681133941 1047101286 /nfs/dbraw/zinc/10/12/86/1047101286.db2.gz IFBLWZXJUWPOHJ-OAHLLOKOSA-N 1 2 321.392 4.300 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cn1ccc(-c2ccsc2)n1 ZINC001116021454 1047102224 /nfs/dbraw/zinc/10/22/24/1047102224.db2.gz NJKLMOLZTOCLFC-UHFFFAOYSA-N 1 2 315.417 4.230 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cn1ccc(-c2ccsc2)n1 ZINC001116021454 1047102229 /nfs/dbraw/zinc/10/22/29/1047102229.db2.gz NJKLMOLZTOCLFC-UHFFFAOYSA-N 1 2 315.417 4.230 20 0 DIADLO CCn1nc(C[N@@H+]2CC[C@H]2c2cccc(F)c2)c2ccccc21 ZINC000681166262 1047104041 /nfs/dbraw/zinc/10/40/41/1047104041.db2.gz LUXVYUAGFLHXTB-SFHVURJKSA-N 1 2 309.388 4.142 20 0 DIADLO CCn1nc(C[N@H+]2CC[C@H]2c2cccc(F)c2)c2ccccc21 ZINC000681166262 1047104047 /nfs/dbraw/zinc/10/40/47/1047104047.db2.gz LUXVYUAGFLHXTB-SFHVURJKSA-N 1 2 309.388 4.142 20 0 DIADLO CCC[N@H+](Cc1cnc(Cl)s1)Cc1ccc(F)cc1F ZINC001459371427 1047105900 /nfs/dbraw/zinc/10/59/00/1047105900.db2.gz ATYNMXHKRVHBNW-UHFFFAOYSA-N 1 2 316.804 4.487 20 0 DIADLO CCC[N@@H+](Cc1cnc(Cl)s1)Cc1ccc(F)cc1F ZINC001459371427 1047105906 /nfs/dbraw/zinc/10/59/06/1047105906.db2.gz ATYNMXHKRVHBNW-UHFFFAOYSA-N 1 2 316.804 4.487 20 0 DIADLO Cc1c(CSC(C)C)cccc1NC(=O)[C@@H](C)n1cc[nH+]c1 ZINC001116134674 1047111166 /nfs/dbraw/zinc/11/11/66/1047111166.db2.gz FSODQIFLIPZKTB-CQSZACIVSA-N 1 2 317.458 4.033 20 0 DIADLO CC[NH+](CC)c1ccc(Nc2ncc(C(F)(F)F)cn2)cc1 ZINC001212967961 1047114982 /nfs/dbraw/zinc/11/49/82/1047114982.db2.gz ARXCPKMANZUZAO-UHFFFAOYSA-N 1 2 310.323 4.085 20 0 DIADLO FC(F)[C@H](Cc1ccccc1)[NH2+]Cc1cnc2ccccc2c1 ZINC000536861187 1047115312 /nfs/dbraw/zinc/11/53/12/1047115312.db2.gz BNBSCJAZHUWFDB-SFHVURJKSA-N 1 2 312.363 4.201 20 0 DIADLO CCOC1CCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)CC1 ZINC000649250854 1047118137 /nfs/dbraw/zinc/11/81/37/1047118137.db2.gz WXLPNQOXWBBKDB-UHFFFAOYSA-N 1 2 324.346 4.259 20 0 DIADLO CCOC1CCN(c2cc[nH+]c3cc(F)c(Cl)cc32)CC1 ZINC000649250856 1047119859 /nfs/dbraw/zinc/11/98/59/1047119859.db2.gz ZPQNPBQBFOOCEM-UHFFFAOYSA-N 1 2 308.784 4.033 20 0 DIADLO CO[C@H]1CCCN(c2cc[nH+]c3cc(F)c(Cl)cc32)CC1 ZINC000649323507 1047121559 /nfs/dbraw/zinc/12/15/59/1047121559.db2.gz ZCQUUUKLYYHCJY-NSHDSACASA-N 1 2 308.784 4.033 20 0 DIADLO CC(C)[C@H]1c2ccccc2CC[N@H+]1Cc1nnc(C2CC2)s1 ZINC000649353350 1047121738 /nfs/dbraw/zinc/12/17/38/1047121738.db2.gz JNLZBHSYOJWLKS-KRWDZBQOSA-N 1 2 313.470 4.171 20 0 DIADLO CC(C)[C@H]1c2ccccc2CC[N@@H+]1Cc1nnc(C2CC2)s1 ZINC000649353350 1047121743 /nfs/dbraw/zinc/12/17/43/1047121743.db2.gz JNLZBHSYOJWLKS-KRWDZBQOSA-N 1 2 313.470 4.171 20 0 DIADLO C[C@@H](c1cccc(Cl)c1F)[N@@H+]1CCC[C@H](OC(F)F)C1 ZINC000681410738 1047123386 /nfs/dbraw/zinc/12/33/86/1047123386.db2.gz XTEAEBOBOLODKT-UWVGGRQHSA-N 1 2 307.743 4.244 20 0 DIADLO C[C@@H](c1cccc(Cl)c1F)[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000681410738 1047123391 /nfs/dbraw/zinc/12/33/91/1047123391.db2.gz XTEAEBOBOLODKT-UWVGGRQHSA-N 1 2 307.743 4.244 20 0 DIADLO CC[NH+](CC)c1ccc(N(c2ccc(N)cn2)C2CCC2)cc1 ZINC001212969855 1047123432 /nfs/dbraw/zinc/12/34/32/1047123432.db2.gz FDDWZZCIPBNTSD-UHFFFAOYSA-N 1 2 310.445 4.201 20 0 DIADLO Cc1cc(N[C@@H]2CCO[C@@]3(CCSC3)C2)[nH+]c2ccccc12 ZINC001116309151 1047129543 /nfs/dbraw/zinc/12/95/43/1047129543.db2.gz RKVJGGYKCDDKTD-KDOFPFPSSA-N 1 2 314.454 4.010 20 0 DIADLO COc1cccc([C@H](C)[NH2+]Cc2ncc(-c3ccccc3)o2)c1 ZINC000537028993 1047133121 /nfs/dbraw/zinc/13/31/21/1047133121.db2.gz ZYKYULDLOYHQKT-AWEZNQCLSA-N 1 2 308.381 4.201 20 0 DIADLO C[C@@H]([NH2+]Cc1n[nH]c2ccccc21)c1ccc2ncsc2c1 ZINC000681595033 1047133714 /nfs/dbraw/zinc/13/37/14/1047133714.db2.gz JZPQQPAJVNWGHY-LLVKDONJSA-N 1 2 308.410 4.023 20 0 DIADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2)no1)c1c(F)cccc1F ZINC000537022236 1047133725 /nfs/dbraw/zinc/13/37/25/1047133725.db2.gz DJIRDKIIKDLHPU-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO Cc1cc(F)c2[nH]ccc2c1Nc1ccc[nH+]c1N1CCCC1 ZINC001212973431 1047134542 /nfs/dbraw/zinc/13/45/42/1047134542.db2.gz XADGCZADAJGDGI-UHFFFAOYSA-N 1 2 310.376 4.354 20 0 DIADLO CC(C)c1ocnc1C[NH2+][C@H](C)c1ccc(OC(F)F)cc1 ZINC001116477070 1047146497 /nfs/dbraw/zinc/14/64/97/1047146497.db2.gz MCQRWEFSLFTEJI-LLVKDONJSA-N 1 2 310.344 4.250 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CCc4ncc(Cl)cc4C3)ccc2n1 ZINC001141482958 1047147695 /nfs/dbraw/zinc/14/76/95/1047147695.db2.gz YBJPECNQULMBGV-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CCc4ncc(Cl)cc4C3)ccc2n1 ZINC001141482958 1047147698 /nfs/dbraw/zinc/14/76/98/1047147698.db2.gz YBJPECNQULMBGV-UHFFFAOYSA-N 1 2 323.827 4.150 20 0 DIADLO CCCCN(C(=O)C[C@@H](C)n1cc[nH+]c1)[C@@H](C)c1ccccc1 ZINC000649590202 1047150049 /nfs/dbraw/zinc/15/00/49/1047150049.db2.gz PEGCNLLNQIRODC-SJORKVTESA-N 1 2 313.445 4.224 20 0 DIADLO C[C@H](CSc1ccccc1)[N@H+](C)Cc1nnc(C2CC2)s1 ZINC000649666287 1047160747 /nfs/dbraw/zinc/16/07/47/1047160747.db2.gz MFTHIMBPWAANFA-GFCCVEGCSA-N 1 2 319.499 4.028 20 0 DIADLO C[C@H](CSc1ccccc1)[N@@H+](C)Cc1nnc(C2CC2)s1 ZINC000649666287 1047160752 /nfs/dbraw/zinc/16/07/52/1047160752.db2.gz MFTHIMBPWAANFA-GFCCVEGCSA-N 1 2 319.499 4.028 20 0 DIADLO C[C@H]1COCCN1c1ccc([NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1 ZINC000838879217 1047168811 /nfs/dbraw/zinc/16/88/11/1047168811.db2.gz GEFAZZINFMYZGE-MDKPJZGXSA-N 1 2 322.452 4.127 20 0 DIADLO CC(=O)c1cccc(C[N@@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@H]2C)c1 ZINC000827799520 1047171741 /nfs/dbraw/zinc/17/17/41/1047171741.db2.gz ZNLQHEYVLCAGLM-ZOCZFRKYSA-N 1 2 323.436 4.240 20 0 DIADLO CC(=O)c1cccc(C[N@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@H]2C)c1 ZINC000827799520 1047171753 /nfs/dbraw/zinc/17/17/53/1047171753.db2.gz ZNLQHEYVLCAGLM-ZOCZFRKYSA-N 1 2 323.436 4.240 20 0 DIADLO CC(=O)c1cccc(C[N@@H+]2[C@H](C)CO[C@@H](c3ccccc3)[C@H]2C)c1 ZINC000827799515 1047172779 /nfs/dbraw/zinc/17/27/79/1047172779.db2.gz ZNLQHEYVLCAGLM-WHSLLNHNSA-N 1 2 323.436 4.240 20 0 DIADLO CC(=O)c1cccc(C[N@H+]2[C@H](C)CO[C@@H](c3ccccc3)[C@H]2C)c1 ZINC000827799515 1047172787 /nfs/dbraw/zinc/17/27/87/1047172787.db2.gz ZNLQHEYVLCAGLM-WHSLLNHNSA-N 1 2 323.436 4.240 20 0 DIADLO Cc1nc([C@H]2CCCC[N@H+]2C[C@H](C)c2cccc(Cl)c2)no1 ZINC000682150895 1047177121 /nfs/dbraw/zinc/17/71/21/1047177121.db2.gz BQKNFWHXHBAVFH-BLLLJJGKSA-N 1 2 319.836 4.362 20 0 DIADLO Cc1nc([C@H]2CCCC[N@@H+]2C[C@H](C)c2cccc(Cl)c2)no1 ZINC000682150895 1047177126 /nfs/dbraw/zinc/17/71/26/1047177126.db2.gz BQKNFWHXHBAVFH-BLLLJJGKSA-N 1 2 319.836 4.362 20 0 DIADLO Cc1ccccc1[C@@H](O)C1CC[NH+](C/C(Cl)=C\Cl)CC1 ZINC000796406217 1047198816 /nfs/dbraw/zinc/19/88/16/1047198816.db2.gz JWTGOTJWWOWXHB-DKGMDFAASA-N 1 2 314.256 4.059 20 0 DIADLO Fc1c(Cl)cc(Br)cc1C[N@@H+]1CCC2(CC2)C1 ZINC001141596490 1047211680 /nfs/dbraw/zinc/21/16/80/1047211680.db2.gz MCIMMWQWLWZEKM-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO Fc1c(Cl)cc(Br)cc1C[N@H+]1CCC2(CC2)C1 ZINC001141596490 1047211692 /nfs/dbraw/zinc/21/16/92/1047211692.db2.gz MCIMMWQWLWZEKM-UHFFFAOYSA-N 1 2 318.617 4.228 20 0 DIADLO Nc1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)cc1Cl ZINC001212105365 1047218836 /nfs/dbraw/zinc/21/88/36/1047218836.db2.gz CZYNBUKBAWCCFE-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO CC(C)(C)OCCCC[N@@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000682754607 1047219583 /nfs/dbraw/zinc/21/95/83/1047219583.db2.gz FDBBUFKTVJOEPV-OAHLLOKOSA-N 1 2 321.465 4.069 20 0 DIADLO CC(C)(C)OCCCC[N@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000682754607 1047219593 /nfs/dbraw/zinc/21/95/93/1047219593.db2.gz FDBBUFKTVJOEPV-OAHLLOKOSA-N 1 2 321.465 4.069 20 0 DIADLO COc1cc(C(F)(F)F)ccc1C[N@@H+]1CCn2cccc2[C@@H]1C ZINC001141611148 1047224508 /nfs/dbraw/zinc/22/45/08/1047224508.db2.gz OQILLXPSXWBQOA-LBPRGKRZSA-N 1 2 324.346 4.092 20 0 DIADLO COc1cc(C(F)(F)F)ccc1C[N@H+]1CCn2cccc2[C@@H]1C ZINC001141611148 1047224515 /nfs/dbraw/zinc/22/45/15/1047224515.db2.gz OQILLXPSXWBQOA-LBPRGKRZSA-N 1 2 324.346 4.092 20 0 DIADLO Cc1ccc(-c2cnc(CO[NH+]=C(N)c3ccccc3C)o2)cc1 ZINC000760421003 1047228539 /nfs/dbraw/zinc/22/85/39/1047228539.db2.gz NWUQHSITLYHTTN-UHFFFAOYSA-N 1 2 321.380 4.005 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001117595979 1047233646 /nfs/dbraw/zinc/23/36/46/1047233646.db2.gz UCGIYCUDJNIBCZ-CJNGLKHVSA-N 1 2 315.486 4.246 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001117595979 1047233656 /nfs/dbraw/zinc/23/36/56/1047233656.db2.gz UCGIYCUDJNIBCZ-CJNGLKHVSA-N 1 2 315.486 4.246 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1nccn1-c1ccccc1 ZINC000682997731 1047248116 /nfs/dbraw/zinc/24/81/16/1047248116.db2.gz XQKPAKSJMRVXIL-UONOGXRCSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1nccn1-c1ccccc1 ZINC000682997731 1047248125 /nfs/dbraw/zinc/24/81/25/1047248125.db2.gz XQKPAKSJMRVXIL-UONOGXRCSA-N 1 2 323.362 4.035 20 0 DIADLO CSc1cc(NC(=O)NCc2c[nH+]c(C)cc2C)ccc1C ZINC000650532486 1047248103 /nfs/dbraw/zinc/24/81/03/1047248103.db2.gz XOAPOOJLTYQCHN-UHFFFAOYSA-N 1 2 315.442 4.050 20 0 DIADLO Cc1ccnc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3n2C)c1 ZINC000683015797 1047255560 /nfs/dbraw/zinc/25/55/60/1047255560.db2.gz NEGMSFUBVMFZDY-LJQANCHMSA-N 1 2 320.440 4.004 20 0 DIADLO Cc1ccnc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3n2C)c1 ZINC000683015797 1047255597 /nfs/dbraw/zinc/25/55/97/1047255597.db2.gz NEGMSFUBVMFZDY-LJQANCHMSA-N 1 2 320.440 4.004 20 0 DIADLO Cc1oc(C)c(C(=O)Nc2ccc3c(cc[nH+]c3N(C)C)c2)c1C ZINC000650588460 1047259415 /nfs/dbraw/zinc/25/94/15/1047259415.db2.gz HJQDTPAJXKCWLJ-UHFFFAOYSA-N 1 2 323.396 4.071 20 0 DIADLO C[C@@H]1CCC[N@@H+]1Cc1c(F)c(Cl)ccc1Br ZINC001141689883 1047266330 /nfs/dbraw/zinc/26/63/30/1047266330.db2.gz RCCRZHBRNOOEDN-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@@H]1CCC[N@H+]1Cc1c(F)c(Cl)ccc1Br ZINC001141689883 1047266343 /nfs/dbraw/zinc/26/63/43/1047266343.db2.gz RCCRZHBRNOOEDN-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CC1 ZINC000147121707 1047274384 /nfs/dbraw/zinc/27/43/84/1047274384.db2.gz ZIWBCWRPOAOHCZ-AWEZNQCLSA-N 1 2 323.440 4.261 20 0 DIADLO F[C@@H]1C[N@H+](Cc2ccc3c(c2)Cc2ccccc2-3)CCC1(F)F ZINC001141735223 1047282334 /nfs/dbraw/zinc/28/23/34/1047282334.db2.gz ZJQHVSCKRRHYMR-GOSISDBHSA-N 1 2 317.354 4.437 20 0 DIADLO F[C@@H]1C[N@@H+](Cc2ccc3c(c2)Cc2ccccc2-3)CCC1(F)F ZINC001141735223 1047282352 /nfs/dbraw/zinc/28/23/52/1047282352.db2.gz ZJQHVSCKRRHYMR-GOSISDBHSA-N 1 2 317.354 4.437 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CC[C@H]3CCCC[C@@H]3C2)n1 ZINC001141766900 1047289187 /nfs/dbraw/zinc/28/91/87/1047289187.db2.gz MNFCDERJFJECTL-GHMZBOCLSA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CC[C@H]3CCCC[C@@H]3C2)n1 ZINC001141766900 1047289202 /nfs/dbraw/zinc/28/92/02/1047289202.db2.gz MNFCDERJFJECTL-GHMZBOCLSA-N 1 2 304.381 4.174 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H](C)c1ccc2c(c1)OCCO2 ZINC000390349687 1047297048 /nfs/dbraw/zinc/29/70/48/1047297048.db2.gz YIVVMFZPEAPHNW-AWEZNQCLSA-N 1 2 312.413 4.005 20 0 DIADLO Fc1ccc2occ(C[N@@H+]3CCCC(F)(F)[C@H](F)C3)c2c1 ZINC001141847059 1047297312 /nfs/dbraw/zinc/29/73/12/1047297312.db2.gz VMQMTMFAVFCQCS-CQSZACIVSA-N 1 2 301.283 4.141 20 0 DIADLO Fc1ccc2occ(C[N@H+]3CCCC(F)(F)[C@H](F)C3)c2c1 ZINC001141847059 1047297322 /nfs/dbraw/zinc/29/73/22/1047297322.db2.gz VMQMTMFAVFCQCS-CQSZACIVSA-N 1 2 301.283 4.141 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cccc1OC(F)(F)F)c1cncs1 ZINC000897933543 1047299402 /nfs/dbraw/zinc/29/94/02/1047299402.db2.gz ZLWLZLNMVMFRNF-MRVPVSSYSA-N 1 2 320.311 4.032 20 0 DIADLO CC(C)(C)c1coc(C[NH2+]Cc2ccc(OCC3CC3)cc2)n1 ZINC000897944493 1047303664 /nfs/dbraw/zinc/30/36/64/1047303664.db2.gz OKOWRYNOUUWFOZ-UHFFFAOYSA-N 1 2 314.429 4.051 20 0 DIADLO Fc1cc(C[N@@H+]2C[C@H]3CC[C@@H]2C3)c(Cl)cc1Br ZINC001141927751 1047310082 /nfs/dbraw/zinc/31/00/82/1047310082.db2.gz JXHAHTVZGUFBKN-WCBMZHEXSA-N 1 2 318.617 4.226 20 0 DIADLO Fc1cc(C[N@H+]2C[C@H]3CC[C@@H]2C3)c(Cl)cc1Br ZINC001141927751 1047310098 /nfs/dbraw/zinc/31/00/98/1047310098.db2.gz JXHAHTVZGUFBKN-WCBMZHEXSA-N 1 2 318.617 4.226 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)[NH+]1CCC(Cc2cccc(F)c2F)CC1 ZINC000651472551 1047316373 /nfs/dbraw/zinc/31/63/73/1047316373.db2.gz XWTQELDTTSXSGW-CYBMUJFWSA-N 1 2 319.399 4.012 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(SC(F)(F)F)cc1)c1csnn1 ZINC000398316777 1047327167 /nfs/dbraw/zinc/32/71/67/1047327167.db2.gz UFXUFAPDFWFODU-QMMMGPOBSA-N 1 2 319.377 4.001 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1nc3ccccc3[nH]1)[C@@H]2C ZINC001119293376 1047327043 /nfs/dbraw/zinc/32/70/43/1047327043.db2.gz CGCGLRKJEIMAEY-UONOGXRCSA-N 1 2 321.424 4.079 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1nc3ccccc3[nH]1)[C@@H]2C ZINC001119293376 1047327061 /nfs/dbraw/zinc/32/70/61/1047327061.db2.gz CGCGLRKJEIMAEY-UONOGXRCSA-N 1 2 321.424 4.079 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1ccc(Cl)nc1 ZINC001119282696 1047327177 /nfs/dbraw/zinc/32/71/77/1047327177.db2.gz IAXIVFMOMBIUNG-UHFFFAOYSA-N 1 2 314.820 4.452 20 0 DIADLO C[C@H]1C[N@H+](Cc2sccc2Oc2ccccc2)CCCC1=O ZINC001141994529 1047335559 /nfs/dbraw/zinc/33/55/59/1047335559.db2.gz OOGGWRFYTFNYHJ-AWEZNQCLSA-N 1 2 315.438 4.341 20 0 DIADLO C[C@H]1C[N@@H+](Cc2sccc2Oc2ccccc2)CCCC1=O ZINC001141994529 1047335571 /nfs/dbraw/zinc/33/55/71/1047335571.db2.gz OOGGWRFYTFNYHJ-AWEZNQCLSA-N 1 2 315.438 4.341 20 0 DIADLO c1cc(Oc2ccccc2)c(C[N@@H+]2CCc3ncccc3C2)s1 ZINC001142001193 1047338823 /nfs/dbraw/zinc/33/88/23/1047338823.db2.gz JKUYJBHZLSLLBK-UHFFFAOYSA-N 1 2 322.433 4.494 20 0 DIADLO c1cc(Oc2ccccc2)c(C[N@H+]2CCc3ncccc3C2)s1 ZINC001142001193 1047338830 /nfs/dbraw/zinc/33/88/30/1047338830.db2.gz JKUYJBHZLSLLBK-UHFFFAOYSA-N 1 2 322.433 4.494 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[N@H+](C)Cc1conc1C ZINC000652039053 1047339145 /nfs/dbraw/zinc/33/91/45/1047339145.db2.gz JKVJELUWYOIJQR-OAHLLOKOSA-N 1 2 320.820 4.154 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[N@@H+](C)Cc1conc1C ZINC000652039053 1047339156 /nfs/dbraw/zinc/33/91/56/1047339156.db2.gz JKVJELUWYOIJQR-OAHLLOKOSA-N 1 2 320.820 4.154 20 0 DIADLO Fc1cc(Br)c(C[N@@H+]2CCC23CCCC3)cc1F ZINC001142006178 1047341801 /nfs/dbraw/zinc/34/18/01/1047341801.db2.gz RCTOCAGWDRJTLM-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1cc(Br)c(C[N@H+]2CCC23CCCC3)cc1F ZINC001142006178 1047341810 /nfs/dbraw/zinc/34/18/10/1047341810.db2.gz RCTOCAGWDRJTLM-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1cc(Br)c(C[N@@H+]2CCCCC23CC3)cc1F ZINC001142013194 1047342809 /nfs/dbraw/zinc/34/28/09/1047342809.db2.gz ARMFHYIBGWALDB-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO Fc1cc(Br)c(C[N@H+]2CCCCC23CC3)cc1F ZINC001142013194 1047342820 /nfs/dbraw/zinc/34/28/20/1047342820.db2.gz ARMFHYIBGWALDB-UHFFFAOYSA-N 1 2 316.189 4.246 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+]C1(c2ccccc2Cl)CCC1 ZINC000652216730 1047347487 /nfs/dbraw/zinc/34/74/87/1047347487.db2.gz DWXGECNMSZDLCM-CYBMUJFWSA-N 1 2 303.837 4.286 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H]2CC(C)(C)Oc3ccc(F)cc32)no1 ZINC000652267588 1047351160 /nfs/dbraw/zinc/35/11/60/1047351160.db2.gz XERZMXVETCNXMS-IAQYHMDHSA-N 1 2 304.365 4.075 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2cc(Cl)ccc2OC)c1 ZINC000652330401 1047355926 /nfs/dbraw/zinc/35/59/26/1047355926.db2.gz FFXCPCSOBUVPKS-LLVKDONJSA-N 1 2 306.793 4.063 20 0 DIADLO C[C@@H](Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1cccc(F)c1F ZINC000537534627 1047359170 /nfs/dbraw/zinc/35/91/70/1047359170.db2.gz ZKKXTAVTBFWEBH-LLVKDONJSA-N 1 2 317.314 4.463 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1nc(-c2cccs2)no1 ZINC000045606675 1047372651 /nfs/dbraw/zinc/37/26/51/1047372651.db2.gz VLPMPJYRSOVONQ-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc(-c2cccs2)no1 ZINC000045606675 1047372660 /nfs/dbraw/zinc/37/26/60/1047372660.db2.gz VLPMPJYRSOVONQ-LLVKDONJSA-N 1 2 317.389 4.130 20 0 DIADLO CC[N@H+](CC(=O)OC)Cc1ccc(-c2ccccc2Cl)cc1 ZINC001142102524 1047380262 /nfs/dbraw/zinc/38/02/62/1047380262.db2.gz WBXDYTHICAAKDZ-UHFFFAOYSA-N 1 2 317.816 4.002 20 0 DIADLO CC[N@@H+](CC(=O)OC)Cc1ccc(-c2ccccc2Cl)cc1 ZINC001142102524 1047380272 /nfs/dbraw/zinc/38/02/72/1047380272.db2.gz WBXDYTHICAAKDZ-UHFFFAOYSA-N 1 2 317.816 4.002 20 0 DIADLO COc1ccccc1-c1nc(C[NH+]2CCC(F)(F)CC2)cs1 ZINC000796543633 1047385490 /nfs/dbraw/zinc/38/54/90/1047385490.db2.gz ZOTNJLRKFCKGAK-UHFFFAOYSA-N 1 2 324.396 4.050 20 0 DIADLO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2cccnc2)c(Cl)n1 ZINC001142137008 1047387830 /nfs/dbraw/zinc/38/78/30/1047387830.db2.gz YFNVHBOHOOZJOZ-INIZCTEOSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1ccc(C[N@H+]2CCCC[C@H]2c2cccnc2)c(Cl)n1 ZINC001142137008 1047387836 /nfs/dbraw/zinc/38/78/36/1047387836.db2.gz YFNVHBOHOOZJOZ-INIZCTEOSA-N 1 2 301.821 4.166 20 0 DIADLO Fc1cc(Cn2cc[nH+]c2)cc(-c2cccc(N3CCCC3)c2)c1 ZINC000653511703 1047394489 /nfs/dbraw/zinc/39/44/89/1047394489.db2.gz ORRHGKWIYNCNMJ-UHFFFAOYSA-N 1 2 321.399 4.338 20 0 DIADLO c1cc2c(nc[nH+]c2Nc2cccc(COc3ccccc3)c2)[nH]1 ZINC000726967611 1047397000 /nfs/dbraw/zinc/39/70/00/1047397000.db2.gz QXHDANMNBLOEDI-UHFFFAOYSA-N 1 2 316.364 4.281 20 0 DIADLO CCOc1cccc(Cl)c1C[NH2+][C@H](C)c1c(C)noc1C ZINC000653605040 1047406902 /nfs/dbraw/zinc/40/69/02/1047406902.db2.gz DMJYWWZINGXOCP-SNVBAGLBSA-N 1 2 308.809 4.194 20 0 DIADLO COc1cc(Cl)c(C[NH+]2CCC(C)(F)CC2)c(Cl)c1 ZINC001142277343 1047421262 /nfs/dbraw/zinc/42/12/62/1047421262.db2.gz RLODPKNVHUZBAD-UHFFFAOYSA-N 1 2 306.208 4.326 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)/C=C\c3ccsc3)c2)[nH+]c1C ZINC000749582847 1047427761 /nfs/dbraw/zinc/42/77/61/1047427761.db2.gz NSGYWIYBHHMVEX-SREVYHEPSA-N 1 2 323.421 4.407 20 0 DIADLO F[C@@H]1CCC[N@@H+]([C@H]2CCC[C@@H](C(F)(F)F)C2)CC1(F)F ZINC001255706049 1047429997 /nfs/dbraw/zinc/42/99/97/1047429997.db2.gz OLURRWWABCNWHP-OUAUKWLOSA-N 1 2 303.290 4.177 20 0 DIADLO F[C@@H]1CCC[N@H+]([C@H]2CCC[C@@H](C(F)(F)F)C2)CC1(F)F ZINC001255706049 1047430000 /nfs/dbraw/zinc/43/00/00/1047430000.db2.gz OLURRWWABCNWHP-OUAUKWLOSA-N 1 2 303.290 4.177 20 0 DIADLO COc1cc(C[NH2+][C@H](Cc2ccccc2)c2ncco2)ccc1C ZINC000653913198 1047433900 /nfs/dbraw/zinc/43/39/00/1047433900.db2.gz QIWABHDWOACTFJ-GOSISDBHSA-N 1 2 322.408 4.065 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)CC2CCCCCC2)n1 ZINC000749921550 1047449152 /nfs/dbraw/zinc/44/91/52/1047449152.db2.gz XCGUXBWADYDOQP-UHFFFAOYSA-N 1 2 323.506 4.284 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(N(C)Cc2ccccc2)cc1 ZINC000841851637 1047459490 /nfs/dbraw/zinc/45/94/90/1047459490.db2.gz RLFCVMCVLUKSGO-UHFFFAOYSA-N 1 2 320.440 4.152 20 0 DIADLO CCOc1ccccc1C1=CC[N@H+](Cc2nc(C)cs2)CC1 ZINC000088587012 1047465673 /nfs/dbraw/zinc/46/56/73/1047465673.db2.gz USQKSZXDWUNUKR-UHFFFAOYSA-N 1 2 314.454 4.140 20 0 DIADLO CCOc1ccccc1C1=CC[N@@H+](Cc2nc(C)cs2)CC1 ZINC000088587012 1047465698 /nfs/dbraw/zinc/46/56/98/1047465698.db2.gz USQKSZXDWUNUKR-UHFFFAOYSA-N 1 2 314.454 4.140 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cnc(-c3ccccc3)[nH]2)[C@@H]1c1ccccc1 ZINC000537622507 1047467358 /nfs/dbraw/zinc/46/73/58/1047467358.db2.gz ZXSBJEPXRKRQMI-BEFAXECRSA-N 1 2 303.409 4.270 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cnccn1)c1nc(-c2ccccc2)cs1 ZINC000089553649 1047483917 /nfs/dbraw/zinc/48/39/17/1047483917.db2.gz MQJGVRKMCMBMQL-STQMWFEESA-N 1 2 310.426 4.012 20 0 DIADLO Clc1cccc(Cl)c1OCCSCCn1cc[nH+]c1 ZINC000090199450 1047500184 /nfs/dbraw/zinc/50/01/84/1047500184.db2.gz ZOGRTNIXRXGFLS-UHFFFAOYSA-N 1 2 317.241 4.002 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1cccc(-c3ccccn3)c1)C2 ZINC001142844451 1047502770 /nfs/dbraw/zinc/50/27/70/1047502770.db2.gz TVOLORUCPUBQIS-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1cccc(-c3ccccn3)c1)C2 ZINC001142844451 1047502774 /nfs/dbraw/zinc/50/27/74/1047502774.db2.gz TVOLORUCPUBQIS-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1cccc(-c3ccccn3)c1)C2 ZINC001142844263 1047503399 /nfs/dbraw/zinc/50/33/99/1047503399.db2.gz NQXNQECIHLKRNH-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1cccc(-c3ccccn3)c1)C2 ZINC001142844263 1047503401 /nfs/dbraw/zinc/50/34/01/1047503401.db2.gz NQXNQECIHLKRNH-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Cc1cccc([C@@H]([NH2+][C@@H](C)c2cncc(F)c2)c2ccccn2)c1 ZINC000090945791 1047513427 /nfs/dbraw/zinc/51/34/27/1047513427.db2.gz PISMLWXJDPBLEY-MGPUTAFESA-N 1 2 321.399 4.364 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@H](C)c2cncc(F)c2)c2ccccn2)c1 ZINC000090945793 1047513774 /nfs/dbraw/zinc/51/37/74/1047513774.db2.gz PISMLWXJDPBLEY-QRWLVFNGSA-N 1 2 321.399 4.364 20 0 DIADLO CC[C@@](C)([NH2+]Cc1ccc(OC)cc1Cl)c1nccs1 ZINC000152608151 1047530808 /nfs/dbraw/zinc/53/08/08/1047530808.db2.gz MWQGMOQOLSMRSA-OAHLLOKOSA-N 1 2 310.850 4.220 20 0 DIADLO C[C@@H]1C[N@H+](Cc2occc2Br)Cc2ccccc21 ZINC001143116785 1047533671 /nfs/dbraw/zinc/53/36/71/1047533671.db2.gz UFYMFTSWQVAPNK-LLVKDONJSA-N 1 2 306.203 4.161 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2occc2Br)Cc2ccccc21 ZINC001143116785 1047533676 /nfs/dbraw/zinc/53/36/76/1047533676.db2.gz UFYMFTSWQVAPNK-LLVKDONJSA-N 1 2 306.203 4.161 20 0 DIADLO Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]Cc1nccs1 ZINC000121991008 1047534968 /nfs/dbraw/zinc/53/49/68/1047534968.db2.gz QGWAVCWHQOXFSZ-ZDUSSCGKSA-N 1 2 308.834 4.108 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2cccn2C)s1 ZINC000092536853 1047536172 /nfs/dbraw/zinc/53/61/72/1047536172.db2.gz LCSISXSYYNVJAN-UHFFFAOYSA-N 1 2 300.427 4.190 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2cccn2C)s1 ZINC000092536853 1047536183 /nfs/dbraw/zinc/53/61/83/1047536183.db2.gz LCSISXSYYNVJAN-UHFFFAOYSA-N 1 2 300.427 4.190 20 0 DIADLO COc1c(F)ccc(C[N@@H+]2CCC[C@H]2c2ccccc2F)c1F ZINC001143317967 1047552454 /nfs/dbraw/zinc/55/24/54/1047552454.db2.gz FSTRHZOJGRVGSF-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)ccc(C[N@H+]2CCC[C@H]2c2ccccc2F)c1F ZINC001143317967 1047552458 /nfs/dbraw/zinc/55/24/58/1047552458.db2.gz FSTRHZOJGRVGSF-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO C[N@H+](Cc1ccco1)Cc1ccc(Br)cc1Cl ZINC000060876165 1047553630 /nfs/dbraw/zinc/55/36/30/1047553630.db2.gz RMAZDXITHRPXEI-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO C[N@@H+](Cc1ccco1)Cc1ccc(Br)cc1Cl ZINC000060876165 1047553636 /nfs/dbraw/zinc/55/36/36/1047553636.db2.gz RMAZDXITHRPXEI-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)[C@@H](CC)c2ccccc2)n1 ZINC000123265481 1047579700 /nfs/dbraw/zinc/57/97/00/1047579700.db2.gz GWIXINJFGDTDKU-HIFRSBDPSA-N 1 2 319.474 4.467 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)[C@@H](CC)c2ccccc2)n1 ZINC000123265481 1047579704 /nfs/dbraw/zinc/57/97/04/1047579704.db2.gz GWIXINJFGDTDKU-HIFRSBDPSA-N 1 2 319.474 4.467 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000477142110 1047598507 /nfs/dbraw/zinc/59/85/07/1047598507.db2.gz MTDGMPALAKRHPG-CQSZACIVSA-N 1 2 301.409 4.330 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000477142110 1047598512 /nfs/dbraw/zinc/59/85/12/1047598512.db2.gz MTDGMPALAKRHPG-CQSZACIVSA-N 1 2 301.409 4.330 20 0 DIADLO C[N@H+](Cc1ccn(C2CCCC2)n1)Cc1cccc(Cl)c1 ZINC000477154360 1047598978 /nfs/dbraw/zinc/59/89/78/1047598978.db2.gz SKJSNNZOTHFTHW-UHFFFAOYSA-N 1 2 303.837 4.284 20 0 DIADLO C[N@@H+](Cc1ccn(C2CCCC2)n1)Cc1cccc(Cl)c1 ZINC000477154360 1047598982 /nfs/dbraw/zinc/59/89/82/1047598982.db2.gz SKJSNNZOTHFTHW-UHFFFAOYSA-N 1 2 303.837 4.284 20 0 DIADLO Cc1cc([C@H](C)NC(=O)c2cc3c[nH+]ccc3[nH]2)ccc1Cl ZINC001151975828 1047605131 /nfs/dbraw/zinc/60/51/31/1047605131.db2.gz GWOMOWUWKUIPDP-NSHDSACASA-N 1 2 313.788 4.016 20 0 DIADLO Cc1ccc(Nc2ccc3cnn([C@@H]4CCCCO4)c3c2)c(C)[nH+]1 ZINC001203375425 1047605795 /nfs/dbraw/zinc/60/57/95/1047605795.db2.gz ZKWLPQCDAMHHFE-IBGZPJMESA-N 1 2 322.412 4.491 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2cccc(F)c2)nn1C ZINC000282082640 1047622471 /nfs/dbraw/zinc/62/24/71/1047622471.db2.gz HQQONMYJXVSFQJ-QRWLVFNGSA-N 1 2 323.415 4.308 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H](F)c3ccccc3)cc2)[nH+]c1C ZINC001153557529 1047627608 /nfs/dbraw/zinc/62/76/08/1047627608.db2.gz ZCZOCYRNPKJFIX-QGZVFWFLSA-N 1 2 323.371 4.343 20 0 DIADLO CCCCSCC(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1 ZINC001153548849 1047627699 /nfs/dbraw/zinc/62/76/99/1047627699.db2.gz YNOFFWAMYWUBJS-UHFFFAOYSA-N 1 2 317.458 4.165 20 0 DIADLO CN(Cc1ccc(Cl)cc1Cl)Cc1cccc2[nH+]ccn21 ZINC000678810529 1047641115 /nfs/dbraw/zinc/64/11/15/1047641115.db2.gz LZEIAXCCFWDLFY-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)cc1Cl)Cc1cccc2nccn21 ZINC000678810529 1047641118 /nfs/dbraw/zinc/64/11/18/1047641118.db2.gz LZEIAXCCFWDLFY-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@H+](Cc1ccc(Cl)cc1Cl)Cc1cccc2nccn21 ZINC000678810529 1047641119 /nfs/dbraw/zinc/64/11/19/1047641119.db2.gz LZEIAXCCFWDLFY-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2c(F)ccc(C(C)=O)c2F)cc1 ZINC001214771295 1047643415 /nfs/dbraw/zinc/64/34/15/1047643415.db2.gz HNHMVUFGQJQJQX-UHFFFAOYSA-N 1 2 304.340 4.367 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2c(F)ccc(C(C)=O)c2F)cc1 ZINC001214771295 1047643416 /nfs/dbraw/zinc/64/34/16/1047643416.db2.gz HNHMVUFGQJQJQX-UHFFFAOYSA-N 1 2 304.340 4.367 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccc(F)cc1F ZINC000537961156 1047648049 /nfs/dbraw/zinc/64/80/49/1047648049.db2.gz ZEQQNLFQXRQRIB-RFAUZJTJSA-N 1 2 309.743 4.403 20 0 DIADLO C[C@@H]([NH2+][C@@H](C(=O)Nc1ccccc1)c1ccccc1)c1ccoc1 ZINC000537985606 1047651049 /nfs/dbraw/zinc/65/10/49/1047651049.db2.gz CRKMMUMZQVYQKS-DNVCBOLYSA-N 1 2 320.392 4.310 20 0 DIADLO COC(=O)/C=C/c1cc(C)c[nH+]c1N[C@H](c1ccccc1)C1CC1 ZINC001154644189 1047652654 /nfs/dbraw/zinc/65/26/54/1047652654.db2.gz CZMWODAVIVJWBX-GNISGLHKSA-N 1 2 322.408 4.139 20 0 DIADLO COC(OC)c1cc(C)c[nH+]c1N[C@@H](c1ccccc1)C1CC1 ZINC001154645986 1047653646 /nfs/dbraw/zinc/65/36/46/1047653646.db2.gz VFOUDZVUYBDJBW-KRWDZBQOSA-N 1 2 312.413 4.245 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@H]1CCSc2c(F)cccc21 ZINC000924650599 1047655563 /nfs/dbraw/zinc/65/55/63/1047655563.db2.gz ZYNNCNDKXBLWJH-UONOGXRCSA-N 1 2 318.417 4.326 20 0 DIADLO COc1cccc([C@H](C)[NH2+]Cc2ncc(-c3cccs3)o2)c1 ZINC000538129327 1047660136 /nfs/dbraw/zinc/66/01/36/1047660136.db2.gz SWDRWYDKUQWDAD-LBPRGKRZSA-N 1 2 314.410 4.263 20 0 DIADLO Cc1cccc2c(C)cc(NCc3cnc4cccc(C)n34)[nH+]c12 ZINC001154941858 1047662155 /nfs/dbraw/zinc/66/21/55/1047662155.db2.gz JBNDYNYDKZSZPF-UHFFFAOYSA-N 1 2 316.408 4.420 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000538225118 1047663689 /nfs/dbraw/zinc/66/36/89/1047663689.db2.gz BIDMVWWPTWFTHD-AWEZNQCLSA-N 1 2 307.397 4.150 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1cnc(Cl)nc1Oc1cccc(F)c1 ZINC001155181713 1047670942 /nfs/dbraw/zinc/67/09/42/1047670942.db2.gz OWHGXEJXCBVRMU-UHFFFAOYSA-N 1 2 322.771 4.497 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)/C(F)=C\C2CCCCC2)[nH+]c1C ZINC001155183206 1047670995 /nfs/dbraw/zinc/67/09/95/1047670995.db2.gz CHMVHRQBSPAGAZ-SFKKXYGYSA-N 1 2 319.424 4.124 20 0 DIADLO Cc1ccn2c(CNc3cc(C)c4ccccc4[nH+]3)cnc2c1 ZINC001155278768 1047674271 /nfs/dbraw/zinc/67/42/71/1047674271.db2.gz RRDVSAWZYMMCIC-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO Cc1cc(CN(Cc2ccccc2)c2cccc(C3CC3)[nH+]2)on1 ZINC001155289662 1047675854 /nfs/dbraw/zinc/67/58/54/1047675854.db2.gz GUYWPFOYBIRPLX-UHFFFAOYSA-N 1 2 319.408 4.462 20 0 DIADLO Cc1cc(N2CCc3c4ccccc4oc3C2)nc(C(C)C)[nH+]1 ZINC001155517809 1047683314 /nfs/dbraw/zinc/68/33/14/1047683314.db2.gz SKYALPKKNIULLO-UHFFFAOYSA-N 1 2 307.397 4.217 20 0 DIADLO COC(=O)c1ccc2cc[nH+]c(NCc3cc(C)cc(C)c3)c2c1 ZINC001155898701 1047691567 /nfs/dbraw/zinc/69/15/67/1047691567.db2.gz UAYWQTTVQPLEIB-UHFFFAOYSA-N 1 2 320.392 4.250 20 0 DIADLO [NH2+]=C(Nc1ncnc2cc(F)ccc21)C12CC3CC(CC(C3)C1)C2 ZINC001155955687 1047693044 /nfs/dbraw/zinc/69/30/44/1047693044.db2.gz BZTJMVNETLNXRO-UHFFFAOYSA-N 1 2 324.403 4.374 20 0 DIADLO C[C@H]1Cc2ccccc2[C@@H]1Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000538635978 1047693223 /nfs/dbraw/zinc/69/32/23/1047693223.db2.gz VRHSXCUOEGJCBR-ORAYPTAESA-N 1 2 307.372 4.357 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@H](C3CCCCC3)C2)c(C)[nH+]1 ZINC000667118910 1047694743 /nfs/dbraw/zinc/69/47/43/1047694743.db2.gz BGQJPLJDDTVHCN-KRWDZBQOSA-N 1 2 315.461 4.441 20 0 DIADLO Cc1ccc(CC2CN(C(=O)Nc3c(C)cc(C)[nH+]c3C)C2)cc1 ZINC000667119146 1047695796 /nfs/dbraw/zinc/69/57/96/1047695796.db2.gz KIVBYDIZAUYQRL-UHFFFAOYSA-N 1 2 323.440 4.022 20 0 DIADLO Cc1cccn2cc(CC(=O)Nc3csc4ccccc34)[nH+]c12 ZINC000538716177 1047697854 /nfs/dbraw/zinc/69/78/54/1047697854.db2.gz VHXQYGIHIAYJKR-UHFFFAOYSA-N 1 2 321.405 4.039 20 0 DIADLO Cc1ccoc1C[N@H+]1C[C@@H](c2ccccc2Cl)OC[C@H]1C ZINC000538729393 1047702554 /nfs/dbraw/zinc/70/25/54/1047702554.db2.gz MBKQMXPFOAUJDS-DYVFJYSZSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccoc1C[N@@H+]1C[C@@H](c2ccccc2Cl)OC[C@H]1C ZINC000538729393 1047702558 /nfs/dbraw/zinc/70/25/58/1047702558.db2.gz MBKQMXPFOAUJDS-DYVFJYSZSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccoc1C[N@H+]1C[C@H](c2ccccc2Cl)OC[C@@H]1C ZINC000538729395 1047702651 /nfs/dbraw/zinc/70/26/51/1047702651.db2.gz MBKQMXPFOAUJDS-SUMWQHHRSA-N 1 2 305.805 4.203 20 0 DIADLO Cc1ccoc1C[N@@H+]1C[C@H](c2ccccc2Cl)OC[C@@H]1C ZINC000538729395 1047702654 /nfs/dbraw/zinc/70/26/54/1047702654.db2.gz MBKQMXPFOAUJDS-SUMWQHHRSA-N 1 2 305.805 4.203 20 0 DIADLO CC(C)c1ccc(CN2CC[NH+]([C@H](C)c3cccnc3)CC2)cc1 ZINC000538739720 1047704449 /nfs/dbraw/zinc/70/44/49/1047704449.db2.gz ULMATDSWPLPSAF-GOSISDBHSA-N 1 2 323.484 4.084 20 0 DIADLO CC(C)(C)c1ccc(N2Cc3cnn(-c4ccccc4)c3C2)[nH+]c1 ZINC001156207303 1047705997 /nfs/dbraw/zinc/70/59/97/1047705997.db2.gz RMBJTPAVTKVJCM-UHFFFAOYSA-N 1 2 318.424 4.085 20 0 DIADLO Cc1ccc(Nc2ccc(Oc3cc[nH]c(=O)c3)cc2)c(C)[nH+]1 ZINC001203376772 1047708789 /nfs/dbraw/zinc/70/87/89/1047708789.db2.gz SBQZYUKGNRCEBP-UHFFFAOYSA-N 1 2 307.353 4.335 20 0 DIADLO CCOC(=O)c1cc(Nc2ccc(C)[nH+]c2C)ccc1Cl ZINC001203376933 1047708848 /nfs/dbraw/zinc/70/88/48/1047708848.db2.gz XERUADFPAIZLQG-UHFFFAOYSA-N 1 2 304.777 4.272 20 0 DIADLO CC1(C)CCC[C@H]1[N@H+](Cc1csnn1)Cc1ccccc1 ZINC000538791058 1047712709 /nfs/dbraw/zinc/71/27/09/1047712709.db2.gz FDDQBOVAXQINJN-MRXNPFEDSA-N 1 2 301.459 4.119 20 0 DIADLO CC1(C)CCC[C@H]1[N@@H+](Cc1csnn1)Cc1ccccc1 ZINC000538791058 1047712713 /nfs/dbraw/zinc/71/27/13/1047712713.db2.gz FDDQBOVAXQINJN-MRXNPFEDSA-N 1 2 301.459 4.119 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCc1ccc(-c2ncon2)cc1 ZINC001156546582 1047717609 /nfs/dbraw/zinc/71/76/09/1047717609.db2.gz OSDGEOPSDDVMSU-UHFFFAOYSA-N 1 2 316.364 4.205 20 0 DIADLO CC(C)(C)OC(=O)C[C@@H]1CCCN1c1ccc(C(C)(C)C)c[nH+]1 ZINC001156679968 1047720033 /nfs/dbraw/zinc/72/00/33/1047720033.db2.gz DVKDQOLYHJFUFC-HNNXBMFYSA-N 1 2 318.461 4.080 20 0 DIADLO Clc1ccc([C@@H]2COCCN2c2cc3ccccc3c[nH+]2)cc1 ZINC001156713261 1047720396 /nfs/dbraw/zinc/72/03/96/1047720396.db2.gz DYDIYUBWCMZYRT-SFHVURJKSA-N 1 2 324.811 4.466 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@@H](C)c2ccccc2Br)n1 ZINC000149052682 1047727346 /nfs/dbraw/zinc/72/73/46/1047727346.db2.gz OJKGARQBNFLUMH-LBPRGKRZSA-N 1 2 322.250 4.077 20 0 DIADLO COc1ccc(C)[nH+]c1N1CCC[C@H]1c1c(F)cccc1F ZINC001156939142 1047729252 /nfs/dbraw/zinc/72/92/52/1047729252.db2.gz IJTVMBYHQWUXMZ-AWEZNQCLSA-N 1 2 304.340 4.018 20 0 DIADLO Cc1nc(N[C@@H]2C[C@H]2c2ccc(F)c(F)c2)cc(C(C)C)[nH+]1 ZINC001157297581 1047738593 /nfs/dbraw/zinc/73/85/93/1047738593.db2.gz QJWINPRZADIVGA-BLLLJJGKSA-N 1 2 303.356 4.155 20 0 DIADLO CCCC[C@@H](CC)COCCCNc1cc(COC)cc[nH+]1 ZINC001157340838 1047739110 /nfs/dbraw/zinc/73/91/10/1047739110.db2.gz JCIIRCHFDCDEGN-MRXNPFEDSA-N 1 2 308.466 4.263 20 0 DIADLO CCCC[C@H](CC)COCCCNc1cc(COC)cc[nH+]1 ZINC001157340837 1047739262 /nfs/dbraw/zinc/73/92/62/1047739262.db2.gz JCIIRCHFDCDEGN-INIZCTEOSA-N 1 2 308.466 4.263 20 0 DIADLO CSCC[C@@H](Nc1[nH+]ccc2cc(Cl)ccc21)C(C)(C)O ZINC001157430103 1047742731 /nfs/dbraw/zinc/74/27/31/1047742731.db2.gz DJYBTDNGWOKQGN-CQSZACIVSA-N 1 2 324.877 4.193 20 0 DIADLO Cc1cccc2c(C)cc(NCc3cccc4cn(C)nc43)[nH+]c12 ZINC001157415178 1047742804 /nfs/dbraw/zinc/74/28/04/1047742804.db2.gz BEIGIIRSLVJDST-UHFFFAOYSA-N 1 2 316.408 4.350 20 0 DIADLO CC(C)(C)c1ccc(N2CCC(c3cccc(O)c3)CC2)[nH+]c1 ZINC001157572724 1047745779 /nfs/dbraw/zinc/74/57/79/1047745779.db2.gz CKPILOQJFMFPAY-UHFFFAOYSA-N 1 2 310.441 4.469 20 0 DIADLO Cc1c(F)cc[nH+]c1N(CCCCCCO)Cc1ccccc1 ZINC001157591212 1047746764 /nfs/dbraw/zinc/74/67/64/1047746764.db2.gz JIILRPLXEVYRNS-UHFFFAOYSA-N 1 2 316.420 4.088 20 0 DIADLO CSc1cc[nH+]c(NCc2ccc(F)c(Cl)c2F)c1 ZINC001157710764 1047750859 /nfs/dbraw/zinc/75/08/59/1047750859.db2.gz KORPCCNWISKGBB-UHFFFAOYSA-N 1 2 300.761 4.347 20 0 DIADLO Cc1cc(NCc2ccc(F)c(Cl)c2F)nc(C(C)C)[nH+]1 ZINC001157711981 1047751066 /nfs/dbraw/zinc/75/10/66/1047751066.db2.gz ZXVZIXPXQAMIMW-UHFFFAOYSA-N 1 2 311.763 4.452 20 0 DIADLO COc1cc(C)c[nH+]c1NCc1cccc(C(F)(F)F)c1C ZINC001157737454 1047751637 /nfs/dbraw/zinc/75/16/37/1047751637.db2.gz YTSSTOLLPIZZAN-UHFFFAOYSA-N 1 2 310.319 4.338 20 0 DIADLO CCCc1ccc(CNc2[nH+]cccc2/C=C/C(=O)OCC)cc1 ZINC001157826751 1047756413 /nfs/dbraw/zinc/75/64/13/1047756413.db2.gz ZHRHBJBSBVROLY-OUKQBFOZSA-N 1 2 324.424 4.223 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@H]3CC[C@@H](C)SC3)cc2)c1C ZINC000655776821 1047761886 /nfs/dbraw/zinc/76/18/86/1047761886.db2.gz PICLZIUGNZFTQW-WBMJQRKESA-N 1 2 301.459 4.185 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cc(F)nc(C(F)(F)F)c2)cc1 ZINC001213011551 1047764066 /nfs/dbraw/zinc/76/40/66/1047764066.db2.gz AWDAPXOUZYPHMX-UHFFFAOYSA-N 1 2 313.298 4.439 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cc(F)nc(C(F)(F)F)c2)cc1 ZINC001213011551 1047764067 /nfs/dbraw/zinc/76/40/67/1047764067.db2.gz AWDAPXOUZYPHMX-UHFFFAOYSA-N 1 2 313.298 4.439 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)CCCC(F)(F)F ZINC000478005214 1047764422 /nfs/dbraw/zinc/76/44/22/1047764422.db2.gz VBXTWSAHOAETEQ-UHFFFAOYSA-N 1 2 311.307 4.056 20 0 DIADLO Cc1ccc(C(C)(C)Nc2nc(N3CCCC3)c(C)c[nH+]2)cc1 ZINC001157974288 1047765325 /nfs/dbraw/zinc/76/53/25/1047765325.db2.gz IJACWDPJNJMPAY-UHFFFAOYSA-N 1 2 310.445 4.041 20 0 DIADLO Cc1ccc(C(C)(C)Nc2cc(N3CCCCC3)nc[nH+]2)cc1 ZINC001157979567 1047765642 /nfs/dbraw/zinc/76/56/42/1047765642.db2.gz KQTCQPJHGWKISC-UHFFFAOYSA-N 1 2 310.445 4.123 20 0 DIADLO Cc1ccc(C(C)(C)Nc2cc(N3CCCCC3)[nH+]cn2)cc1 ZINC001157979567 1047765646 /nfs/dbraw/zinc/76/56/46/1047765646.db2.gz KQTCQPJHGWKISC-UHFFFAOYSA-N 1 2 310.445 4.123 20 0 DIADLO C[N@H+](Cc1ncc(-c2ccc(F)cc2)o1)Cc1ccc(F)cc1 ZINC000061779037 1047768741 /nfs/dbraw/zinc/76/87/41/1047768741.db2.gz LNHUXNZZNIHBBO-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1ncc(-c2ccc(F)cc2)o1)Cc1ccc(F)cc1 ZINC000061779037 1047768749 /nfs/dbraw/zinc/76/87/49/1047768749.db2.gz LNHUXNZZNIHBBO-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO Cc1cccn2cc(CNc3cc(C)c4cccc(C)c4[nH+]3)nc12 ZINC001158154305 1047770941 /nfs/dbraw/zinc/77/09/41/1047770941.db2.gz KYVHYQWVODHWMM-UHFFFAOYSA-N 1 2 316.408 4.420 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccc(Br)s2)cc1 ZINC000057611206 1047773144 /nfs/dbraw/zinc/77/31/44/1047773144.db2.gz PADUZGPPTRSWBE-UHFFFAOYSA-N 1 2 311.248 4.189 20 0 DIADLO CCCN(CCC)c1cc(N[C@@H]2CCCC(F)(F)C2)[nH+]cn1 ZINC001158335054 1047774971 /nfs/dbraw/zinc/77/49/71/1047774971.db2.gz FVQPABYWXJNAQK-CYBMUJFWSA-N 1 2 312.408 4.093 20 0 DIADLO CCCN(CCC)c1cc(N[C@@H]2CCCC(F)(F)C2)nc[nH+]1 ZINC001158335054 1047774974 /nfs/dbraw/zinc/77/49/74/1047774974.db2.gz FVQPABYWXJNAQK-CYBMUJFWSA-N 1 2 312.408 4.093 20 0 DIADLO CCOC(=O)/C=C/c1ccc[nH+]c1N[C@@H]1C[C@@H](C)c2ccccc21 ZINC001158469220 1047781789 /nfs/dbraw/zinc/78/17/89/1047781789.db2.gz RTBHKMFVLFVHIE-UVBGIDOTSA-N 1 2 322.408 4.318 20 0 DIADLO CCOC(=O)C1(CNc2[nH+]ccc3cc(Cl)ccc32)CCC1 ZINC001158621265 1047792989 /nfs/dbraw/zinc/79/29/89/1047792989.db2.gz TUSBGCNSJKCZGE-UHFFFAOYSA-N 1 2 318.804 4.034 20 0 DIADLO Cc1cccc2c(C)cc(N[C@@H]3CCc4ccccc4[C@@H]3O)[nH+]c12 ZINC001158674310 1047793425 /nfs/dbraw/zinc/79/34/25/1047793425.db2.gz FKKSHKJTADYRII-NQIIRXRSSA-N 1 2 318.420 4.312 20 0 DIADLO COc1cc(C)c[nH+]c1NCc1ccc(-c2ccccn2)cc1 ZINC001158912818 1047803708 /nfs/dbraw/zinc/80/37/08/1047803708.db2.gz WZVSCZMEDDNUBN-UHFFFAOYSA-N 1 2 305.381 4.073 20 0 DIADLO OC[C@H](CNc1cc(-c2ccccc2)cc[nH+]1)Cc1ccccc1 ZINC001158915901 1047804114 /nfs/dbraw/zinc/80/41/14/1047804114.db2.gz JLAOZFIVGXPLGK-SFHVURJKSA-N 1 2 318.420 4.012 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@@H](Cc1ccc(C)cc1)c1ccc(C)cc1 ZINC000552911555 1047805024 /nfs/dbraw/zinc/80/50/24/1047805024.db2.gz GOODATPFKIYSSH-NRFANRHFSA-N 1 2 319.452 4.409 20 0 DIADLO Nc1ccc(Nc2cc(OCc3ccccc3)ccc2F)c[nH+]1 ZINC001159281765 1047825492 /nfs/dbraw/zinc/82/54/92/1047825492.db2.gz ACXPRYINEKDZEH-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO Nc1ccc(Nc2cccc(F)c2OCc2ccccc2)c[nH+]1 ZINC001159282389 1047826528 /nfs/dbraw/zinc/82/65/28/1047826528.db2.gz WEOHWCCABYFSAF-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO COc1ccc2ccc(NC3CC(C)(C)OC(C)(C)C3)[nH+]c2c1 ZINC001159318898 1047834256 /nfs/dbraw/zinc/83/42/56/1047834256.db2.gz ATCDOGSJZYRNMH-UHFFFAOYSA-N 1 2 314.429 4.392 20 0 DIADLO c1c[nH+]c(Nc2ccc3c(c2)CCCN3)c(N2CCCCC2)c1 ZINC001159364800 1047835406 /nfs/dbraw/zinc/83/54/06/1047835406.db2.gz YFOTWZOFXSHYCW-UHFFFAOYSA-N 1 2 308.429 4.174 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cccc(OCc2ccccn2)c1)c1ncco1 ZINC000924715781 1047838443 /nfs/dbraw/zinc/83/84/43/1047838443.db2.gz POWRUCVMOKGTNB-HUUCEWRRSA-N 1 2 323.396 4.060 20 0 DIADLO Cc1ccc([C@H]2CCCN2c2cc(N3CCCC3)[nH+]cn2)cc1C ZINC000553330861 1047838491 /nfs/dbraw/zinc/83/84/91/1047838491.db2.gz LNCFFZMDUDUEJO-GOSISDBHSA-N 1 2 322.456 4.035 20 0 DIADLO Cc1ccc([C@H]2CCCN2c2cc(N3CCCC3)nc[nH+]2)cc1C ZINC000553330861 1047838496 /nfs/dbraw/zinc/83/84/96/1047838496.db2.gz LNCFFZMDUDUEJO-GOSISDBHSA-N 1 2 322.456 4.035 20 0 DIADLO C[C@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1ccc(F)cc1F ZINC000553338136 1047839503 /nfs/dbraw/zinc/83/95/03/1047839503.db2.gz VZTUMPIUKCMIJB-VIFPVBQESA-N 1 2 306.287 4.096 20 0 DIADLO CN(c1ccc(Nc2ccc(F)cc2N)c[nH+]1)C1CCCCC1 ZINC001159442274 1047845268 /nfs/dbraw/zinc/84/52/68/1047845268.db2.gz GRMLTHJOAOMFFG-UHFFFAOYSA-N 1 2 314.408 4.315 20 0 DIADLO Cc1ccc(CSc2n[nH]c(C=Cc3ccccc3)n2)c(C)[nH+]1 ZINC000479202163 1047845496 /nfs/dbraw/zinc/84/54/96/1047845496.db2.gz OXHVDOBXXVVHOV-PKNBQFBNSA-N 1 2 322.437 4.279 20 0 DIADLO Cc1cccnc1C[N@@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001205807737 1047849926 /nfs/dbraw/zinc/84/99/26/1047849926.db2.gz VWLDZYFBFPCFPT-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cccnc1C[N@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001205807737 1047849939 /nfs/dbraw/zinc/84/99/39/1047849939.db2.gz VWLDZYFBFPCFPT-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO O=c1[nH]cc(Nc2ccc([NH+]3CCCC3)cc2)cc1C(F)(F)F ZINC001174526297 1047854398 /nfs/dbraw/zinc/85/43/98/1047854398.db2.gz LDKOXRZMQXSWIJ-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO c1cn(-c2ccccc2Nc2ccc(N3CCCC3)cc2)c[nH+]1 ZINC001174526013 1047854908 /nfs/dbraw/zinc/85/49/08/1047854908.db2.gz CDEVEMQEQCBASD-UHFFFAOYSA-N 1 2 304.397 4.216 20 0 DIADLO FC(F)(F)Oc1cc[nH+]c(Nc2ccc(N3CCCC3)cc2)c1 ZINC001174526994 1047857515 /nfs/dbraw/zinc/85/75/15/1047857515.db2.gz JPHAOVZOCUKBHX-UHFFFAOYSA-N 1 2 323.318 4.324 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1c(Cl)cccc1OC ZINC000479289865 1047860772 /nfs/dbraw/zinc/86/07/72/1047860772.db2.gz WTDZOQKIERYNPZ-GFCCVEGCSA-N 1 2 304.821 4.157 20 0 DIADLO COc1cccc(Nc2ccc(NCC3(SC)CC3)[nH+]c2)c1 ZINC001182911203 1047862699 /nfs/dbraw/zinc/86/26/99/1047862699.db2.gz WDEWEZAUJZNNIM-UHFFFAOYSA-N 1 2 315.442 4.141 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2cccs2)c2ccc(F)cc2)on1 ZINC000553485504 1047863956 /nfs/dbraw/zinc/86/39/56/1047863956.db2.gz SOSCMNBPFNKZIG-MRXNPFEDSA-N 1 2 302.374 4.063 20 0 DIADLO Cc1c(Br)cncc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000667463955 1047866118 /nfs/dbraw/zinc/86/61/18/1047866118.db2.gz DFMSJTVYUQHDRP-MRXNPFEDSA-N 1 2 317.230 4.100 20 0 DIADLO Cc1c(Br)cncc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000667463955 1047866133 /nfs/dbraw/zinc/86/61/33/1047866133.db2.gz DFMSJTVYUQHDRP-MRXNPFEDSA-N 1 2 317.230 4.100 20 0 DIADLO CCOc1cc(Nc2ccc(NC(=O)C(C)C)cc2)cc(C)[nH+]1 ZINC001197678326 1047868308 /nfs/dbraw/zinc/86/83/08/1047868308.db2.gz CPXGFPADVVPYMF-UHFFFAOYSA-N 1 2 313.401 4.127 20 0 DIADLO CCSc1cccc(C[N@@H+]2C[C@H](C)O[C@](C)(C(F)F)C2)c1 ZINC001182969343 1047870988 /nfs/dbraw/zinc/87/09/88/1047870988.db2.gz HKKIEIIRKKRKHY-LRDDRELGSA-N 1 2 315.429 4.043 20 0 DIADLO CCSc1cccc(C[N@H+]2C[C@H](C)O[C@](C)(C(F)F)C2)c1 ZINC001182969343 1047871000 /nfs/dbraw/zinc/87/10/00/1047871000.db2.gz HKKIEIIRKKRKHY-LRDDRELGSA-N 1 2 315.429 4.043 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2Cc2c(F)cccc2Cl)[nH+]c1C ZINC001197710642 1047874525 /nfs/dbraw/zinc/87/45/25/1047874525.db2.gz LEZYPHXSYMUMNO-HNNXBMFYSA-N 1 2 307.800 4.156 20 0 DIADLO Cn1ccc2ccc(Nc3ccc(Cn4cc[nH+]c4)cc3)cc21 ZINC001174516445 1047878222 /nfs/dbraw/zinc/87/82/22/1047878222.db2.gz DXYSTWDCRGKUEA-UHFFFAOYSA-N 1 2 302.381 4.167 20 0 DIADLO C/C(=C\C(=O)N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1)C(C)(C)C ZINC001183019108 1047879374 /nfs/dbraw/zinc/87/93/74/1047879374.db2.gz VCVHECHIFULADR-OKFGHLOFSA-N 1 2 311.429 4.042 20 0 DIADLO Cn1c(C[NH2+]Cc2ccccc2Cl)nc2cccc(Cl)c21 ZINC000479395071 1047880000 /nfs/dbraw/zinc/88/00/00/1047880000.db2.gz SLLAETWYFJCRAA-UHFFFAOYSA-N 1 2 320.223 4.170 20 0 DIADLO CCNC(=O)Nc1ccc(Nc2ccc([NH+]3CCCC3)cc2)cc1 ZINC001174519775 1047880296 /nfs/dbraw/zinc/88/02/96/1047880296.db2.gz SRVWTUJMRKFGFQ-UHFFFAOYSA-N 1 2 324.428 4.172 20 0 DIADLO C/C(=C\C(=O)N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1)C(C)(C)C ZINC001183019109 1047881711 /nfs/dbraw/zinc/88/17/11/1047881711.db2.gz VCVHECHIFULADR-ZQHYZAEZSA-N 1 2 311.429 4.042 20 0 DIADLO COc1ccc(F)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1F ZINC001174523775 1047884399 /nfs/dbraw/zinc/88/43/99/1047884399.db2.gz QVHLAJDDPLWPEE-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO Cc1cnc(Cl)c(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174523217 1047884443 /nfs/dbraw/zinc/88/44/43/1047884443.db2.gz JOHOYLLYKCBARA-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO c1cnc2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc2c1 ZINC001174522006 1047884541 /nfs/dbraw/zinc/88/45/41/1047884541.db2.gz GMFCUEJQADMPGV-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO Cc1nc(Cl)ccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523690 1047884620 /nfs/dbraw/zinc/88/46/20/1047884620.db2.gz VZGPUDWYIAMCJC-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO Oc1cc(Cl)cc(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001174522943 1047884870 /nfs/dbraw/zinc/88/48/70/1047884870.db2.gz FEXAMEXTEUPELT-UHFFFAOYSA-N 1 2 303.793 4.175 20 0 DIADLO Cc1ncc(Cl)cc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523092 1047885085 /nfs/dbraw/zinc/88/50/85/1047885085.db2.gz GDVMZKQILCGPLJ-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO c1sc2ncccc2c1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523622 1047885630 /nfs/dbraw/zinc/88/56/30/1047885630.db2.gz RUWCZVNNUNZODR-UHFFFAOYSA-N 1 2 310.426 4.425 20 0 DIADLO c1cnc2cccc(Nc3ccc(N4CCCCC4)[nH+]c3)c2c1 ZINC001174522232 1047885878 /nfs/dbraw/zinc/88/58/78/1047885878.db2.gz LOMZKXCGJAQFTN-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO Cc1c(Cl)nccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174521878 1047885932 /nfs/dbraw/zinc/88/59/32/1047885932.db2.gz BAMTUYZEYQFUDG-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO CC(=O)Nc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)ccc1C ZINC001174524862 1047887442 /nfs/dbraw/zinc/88/74/42/1047887442.db2.gz SNGBPEJTARLEJP-UHFFFAOYSA-N 1 2 324.428 4.082 20 0 DIADLO c1c[nH+]c(N2CCCC2)c(Nc2ccc(N3CCCC3)cc2)c1 ZINC001174524803 1047889152 /nfs/dbraw/zinc/88/91/52/1047889152.db2.gz FAMJWOMZXLVAMX-UHFFFAOYSA-N 1 2 308.429 4.026 20 0 DIADLO C[C@@H]1COCC[C@@H]1Nc1cc(SCc2ccccc2)cc[nH+]1 ZINC001159719049 1047908075 /nfs/dbraw/zinc/90/80/75/1047908075.db2.gz OOKBXBHSJOIFDV-PBHICJAKSA-N 1 2 314.454 4.211 20 0 DIADLO Cc1[nH+]c2c(NC(=S)Nc3ccc(C)cc3C)cccn2c1C ZINC001197972088 1047912817 /nfs/dbraw/zinc/91/28/17/1047912817.db2.gz XPWDURMSLLRACN-UHFFFAOYSA-N 1 2 324.453 4.377 20 0 DIADLO CCCOc1ccc(C[N@H+](C)Cc2nccn2C(F)F)c(C)c1 ZINC000667507960 1047917607 /nfs/dbraw/zinc/91/76/07/1047917607.db2.gz OSWVCBFSCWUJGQ-UHFFFAOYSA-N 1 2 323.387 4.007 20 0 DIADLO CCCOc1ccc(C[N@@H+](C)Cc2nccn2C(F)F)c(C)c1 ZINC000667507960 1047917621 /nfs/dbraw/zinc/91/76/21/1047917621.db2.gz OSWVCBFSCWUJGQ-UHFFFAOYSA-N 1 2 323.387 4.007 20 0 DIADLO FC(F)(CNc1cc(-c2ccccc2)cc[nH+]1)c1ccccn1 ZINC001159792669 1047925271 /nfs/dbraw/zinc/92/52/71/1047925271.db2.gz BLPBEPNEXOFUGB-UHFFFAOYSA-N 1 2 311.335 4.348 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3C[C@@]3(C)C(C)C)c2)[nH+]c1C ZINC000775817796 1047926195 /nfs/dbraw/zinc/92/61/95/1047926195.db2.gz HNBSAJIENRVEFA-APWZRJJASA-N 1 2 311.429 4.314 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[NH+]1CCN(CC(C)(F)F)CC1 ZINC001198130412 1047927207 /nfs/dbraw/zinc/92/72/07/1047927207.db2.gz ICLZGSGBLHFKQK-HNNXBMFYSA-N 1 2 316.823 4.064 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@@H]2c2cc(C)n[nH]2)ccc1Cl ZINC001198130375 1047927285 /nfs/dbraw/zinc/92/72/85/1047927285.db2.gz HROILITVYWYQRS-MRXNPFEDSA-N 1 2 319.836 4.107 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@@H]2c2cc(C)n[nH]2)ccc1Cl ZINC001198130375 1047927294 /nfs/dbraw/zinc/92/72/94/1047927294.db2.gz HROILITVYWYQRS-MRXNPFEDSA-N 1 2 319.836 4.107 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@H]2c2cc(C)n[nH]2)ccc1Cl ZINC001198130373 1047928080 /nfs/dbraw/zinc/92/80/80/1047928080.db2.gz HROILITVYWYQRS-INIZCTEOSA-N 1 2 319.836 4.107 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@H]2c2cc(C)n[nH]2)ccc1Cl ZINC001198130373 1047928083 /nfs/dbraw/zinc/92/80/83/1047928083.db2.gz HROILITVYWYQRS-INIZCTEOSA-N 1 2 319.836 4.107 20 0 DIADLO COc1cc(OC)cc([C@H](C)Nc2cc(CSC)cc[nH+]2)c1 ZINC001159815237 1047929904 /nfs/dbraw/zinc/92/99/04/1047929904.db2.gz SYCBGVXKEHUKCF-LBPRGKRZSA-N 1 2 318.442 4.135 20 0 DIADLO COC(=O)[C@@]1([NH2+]Cc2c(C)cc(C)cc2C)CCCC(C)(C)C1 ZINC001174679994 1047932291 /nfs/dbraw/zinc/93/22/91/1047932291.db2.gz AJSSCSZNTGXXLA-HXUWFJFHSA-N 1 2 317.473 4.213 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cccc(Br)c1N ZINC001159866420 1047939311 /nfs/dbraw/zinc/93/93/11/1047939311.db2.gz PHEIQQGXWAEZBH-UHFFFAOYSA-N 1 2 318.218 4.356 20 0 DIADLO FC(F)(F)Oc1cc[nH+]c(Nc2ccc3c(c2)CCCO3)c1 ZINC001174721015 1047955392 /nfs/dbraw/zinc/95/53/92/1047955392.db2.gz YUSQWSGZAYRGDU-UHFFFAOYSA-N 1 2 310.275 4.049 20 0 DIADLO FC(F)(F)c1cncc(Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001174740496 1047959933 /nfs/dbraw/zinc/95/99/33/1047959933.db2.gz VTANKSZJYBGMCS-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO CCO[C@@H](C)n1cc(Nc2c[nH+]c(CC(C)C)cc2C)cn1 ZINC001174697440 1047962973 /nfs/dbraw/zinc/96/29/73/1047962973.db2.gz UEUIVGBGHLIKAB-AWEZNQCLSA-N 1 2 302.422 4.084 20 0 DIADLO COc1ccc(C(F)(F)F)cc1Nc1ccc2c(c1)[nH+]cn2C ZINC001174778797 1047970662 /nfs/dbraw/zinc/97/06/62/1047970662.db2.gz KOYBLIVYWSHLOM-UHFFFAOYSA-N 1 2 321.302 4.344 20 0 DIADLO Cc1ccc(C)c(Cc2noc([C@H](CC(C)C)n3cc[nH+]c3)n2)c1 ZINC000923810471 1047970666 /nfs/dbraw/zinc/97/06/66/1047970666.db2.gz MGRVLUMYBXNTPU-KRWDZBQOSA-N 1 2 324.428 4.109 20 0 DIADLO Cc1cc(C)c2cc(NCc3cnc4ccccc4n3)ccc2[nH+]1 ZINC001183823542 1047972226 /nfs/dbraw/zinc/97/22/26/1047972226.db2.gz UGQVVPBCEUATMB-UHFFFAOYSA-N 1 2 314.392 4.407 20 0 DIADLO COc1cc(C)nc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)c1 ZINC000553987730 1047983603 /nfs/dbraw/zinc/98/36/03/1047983603.db2.gz SGEUZOOGDMHWPZ-INIZCTEOSA-N 1 2 302.443 4.043 20 0 DIADLO COc1cc(C)nc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)c1 ZINC000553987730 1047983606 /nfs/dbraw/zinc/98/36/06/1047983606.db2.gz SGEUZOOGDMHWPZ-INIZCTEOSA-N 1 2 302.443 4.043 20 0 DIADLO C[C@H]1C[C@H](C(C)(C)C)CC[N@@H+]1CC(=O)Nc1c(F)cccc1F ZINC000553987974 1047983968 /nfs/dbraw/zinc/98/39/68/1047983968.db2.gz UUPXNRRITUCWLM-QWHCGFSZSA-N 1 2 324.415 4.050 20 0 DIADLO C[C@H]1C[C@H](C(C)(C)C)CC[N@H+]1CC(=O)Nc1c(F)cccc1F ZINC000553987974 1047983979 /nfs/dbraw/zinc/98/39/79/1047983979.db2.gz UUPXNRRITUCWLM-QWHCGFSZSA-N 1 2 324.415 4.050 20 0 DIADLO CCN(CC)c1cc(NCc2cccc3sccc32)[nH+]cn1 ZINC001160186999 1047992433 /nfs/dbraw/zinc/99/24/33/1047992433.db2.gz MTXYQRBYAMLFKL-UHFFFAOYSA-N 1 2 312.442 4.150 20 0 DIADLO CCN(CC)c1cc(NCc2cccc3sccc32)nc[nH+]1 ZINC001160186999 1047992439 /nfs/dbraw/zinc/99/24/39/1047992439.db2.gz MTXYQRBYAMLFKL-UHFFFAOYSA-N 1 2 312.442 4.150 20 0 DIADLO CC(C)C[N@H+](Cc1nnc(C(C)C)[nH]1)Cc1cccc(Cl)c1 ZINC001174863308 1048005554 /nfs/dbraw/zinc/00/55/54/1048005554.db2.gz LKNGYMYXTGPHJV-UHFFFAOYSA-N 1 2 320.868 4.240 20 0 DIADLO CC(C)C[N@@H+](Cc1nnc(C(C)C)[nH]1)Cc1cccc(Cl)c1 ZINC001174863308 1048005569 /nfs/dbraw/zinc/00/55/69/1048005569.db2.gz LKNGYMYXTGPHJV-UHFFFAOYSA-N 1 2 320.868 4.240 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@@H+](CCOC1CCCCCC1)C2 ZINC001198845310 1048011610 /nfs/dbraw/zinc/01/16/10/1048011610.db2.gz YEZCNUVZMJRSJT-UHFFFAOYSA-N 1 2 309.400 4.062 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@H+](CCOC1CCCCCC1)C2 ZINC001198845310 1048011624 /nfs/dbraw/zinc/01/16/24/1048011624.db2.gz YEZCNUVZMJRSJT-UHFFFAOYSA-N 1 2 309.400 4.062 20 0 DIADLO Fc1ccc(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)c(F)c1F ZINC000667591285 1048029017 /nfs/dbraw/zinc/02/90/17/1048029017.db2.gz ONBZBUCBSCHTIV-MRXNPFEDSA-N 1 2 321.342 4.068 20 0 DIADLO Fc1ccc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)c(F)c1F ZINC000667591285 1048029031 /nfs/dbraw/zinc/02/90/31/1048029031.db2.gz ONBZBUCBSCHTIV-MRXNPFEDSA-N 1 2 321.342 4.068 20 0 DIADLO COc1ccc2[nH+]c(NC(C)(C)c3ccncc3)cc(C)c2c1 ZINC001160311035 1048030262 /nfs/dbraw/zinc/03/02/62/1048030262.db2.gz IBWZHLBCSOKAMV-UHFFFAOYSA-N 1 2 307.397 4.294 20 0 DIADLO Nc1ccc(-c2cccs2)cc1Nc1ccn2cc[nH+]c2c1 ZINC001160320351 1048032800 /nfs/dbraw/zinc/03/28/00/1048032800.db2.gz QZBVHDCXNGNOLM-UHFFFAOYSA-N 1 2 306.394 4.389 20 0 DIADLO C[C@@H](Nc1cccc2c1OCCC2)c1ccc(-n2cc[nH+]c2)cc1 ZINC000554224414 1048035378 /nfs/dbraw/zinc/03/53/78/1048035378.db2.gz GFCDYFORTISYTB-OAHLLOKOSA-N 1 2 319.408 4.370 20 0 DIADLO Cc1ccccc1Nc1ccc(O[C@@H]2CC[NH2+]CC2(F)F)cc1 ZINC001160341664 1048037638 /nfs/dbraw/zinc/03/76/38/1048037638.db2.gz VVRRFMOPMXPBCO-QGZVFWFLSA-N 1 2 318.367 4.115 20 0 DIADLO CCCOc1ccc(C[NH+]2CC(Oc3ccccc3)C2)c(C)c1 ZINC001184427924 1048039718 /nfs/dbraw/zinc/03/97/18/1048039718.db2.gz CWYKATDHTHPAEH-UHFFFAOYSA-N 1 2 311.425 4.047 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1cccn1C(F)F ZINC001184462265 1048042958 /nfs/dbraw/zinc/04/29/58/1048042958.db2.gz JJNNCPRPFAAPGR-UHFFFAOYSA-N 1 2 304.344 4.426 20 0 DIADLO COc1cc(C)c[nH+]c1N[C@@H](c1ccccc1)c1ccc(O)cc1 ZINC001160494546 1048058725 /nfs/dbraw/zinc/05/87/25/1048058725.db2.gz BVZMWMLVKWFQCC-IBGZPJMESA-N 1 2 320.392 4.306 20 0 DIADLO C[C@@H]1C[C@H](C(C)(C)C)CC[N@@H+]1Cc1nccn1CC(F)(F)F ZINC000554308850 1048062901 /nfs/dbraw/zinc/06/29/01/1048062901.db2.gz HBCXGUZEDYAKBV-CHWSQXEVSA-N 1 2 317.399 4.092 20 0 DIADLO C[C@@H]1C[C@H](C(C)(C)C)CC[N@H+]1Cc1nccn1CC(F)(F)F ZINC000554308850 1048062910 /nfs/dbraw/zinc/06/29/10/1048062910.db2.gz HBCXGUZEDYAKBV-CHWSQXEVSA-N 1 2 317.399 4.092 20 0 DIADLO CSCc1cc[nH+]c(N[C@@H](c2ccccc2)C2(O)CCC2)c1 ZINC001160544183 1048065119 /nfs/dbraw/zinc/06/51/19/1048065119.db2.gz RPTNPSRHDIUHEC-KRWDZBQOSA-N 1 2 314.454 4.013 20 0 DIADLO COC(=O)C[C@@H](Nc1cc2ccccc2c[nH+]1)C1CCCCC1 ZINC001160557735 1048065615 /nfs/dbraw/zinc/06/56/15/1048065615.db2.gz KPDASTOPAUIUDC-QGZVFWFLSA-N 1 2 312.413 4.159 20 0 DIADLO CCOc1cc(F)cc(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001175003360 1048066584 /nfs/dbraw/zinc/06/65/84/1048066584.db2.gz ZYHWDYGQKFFBRH-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1nc(C(C)(C)C)cs1 ZINC001199472148 1048069170 /nfs/dbraw/zinc/06/91/70/1048069170.db2.gz HOQFYAJLLRAJFD-UHFFFAOYSA-N 1 2 303.475 4.427 20 0 DIADLO CCCN(CCC)c1cc(NC2CC3(C2)CC(F)(F)C3)[nH+]cn1 ZINC001160590901 1048069293 /nfs/dbraw/zinc/06/92/93/1048069293.db2.gz PFJGOGHZVKQFMP-UHFFFAOYSA-N 1 2 324.419 4.093 20 0 DIADLO CCCN(CCC)c1cc(NC2CC3(C2)CC(F)(F)C3)nc[nH+]1 ZINC001160590901 1048069309 /nfs/dbraw/zinc/06/93/09/1048069309.db2.gz PFJGOGHZVKQFMP-UHFFFAOYSA-N 1 2 324.419 4.093 20 0 DIADLO COc1ccc(NCc2cc(C)[nH+]c3c2CCCC3)cc1F ZINC001199531579 1048073862 /nfs/dbraw/zinc/07/38/62/1048073862.db2.gz XAMMXJURJQHQLC-UHFFFAOYSA-N 1 2 300.377 4.029 20 0 DIADLO CSCc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001199530855 1048075139 /nfs/dbraw/zinc/07/51/39/1048075139.db2.gz KUXWDHRULKIKAL-UHFFFAOYSA-N 1 2 309.438 4.347 20 0 DIADLO CCc1cccc(F)c1CNc1ccc(N2CCCCC2)c[nH+]1 ZINC001199554300 1048076782 /nfs/dbraw/zinc/07/67/82/1048076782.db2.gz LKBRNQUWRRTSPO-UHFFFAOYSA-N 1 2 313.420 4.386 20 0 DIADLO Cc1cccn2c([C@H](C)N[C@@H](F)c3ccnc(Cl)c3)c[nH+]c12 ZINC001160682274 1048077882 /nfs/dbraw/zinc/07/78/82/1048077882.db2.gz AJGBBGBHIXCLER-XHDPSFHLSA-N 1 2 318.783 4.010 20 0 DIADLO Cc1cccn2c([C@H](C)Nc3nc(C)c4ccccc4n3)c[nH+]c12 ZINC001160682523 1048078152 /nfs/dbraw/zinc/07/81/52/1048078152.db2.gz FNGBGPDDKYLDDE-AWEZNQCLSA-N 1 2 317.396 4.067 20 0 DIADLO CCc1cc(N[C@@H](C)c2ccccc2OC(F)F)nc(CC)[nH+]1 ZINC001184720320 1048081737 /nfs/dbraw/zinc/08/17/37/1048081737.db2.gz PWWLXMOZGDMVBC-NSHDSACASA-N 1 2 321.371 4.376 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](c2ccccc2)C2CCCCC2)no1 ZINC000776005119 1048081623 /nfs/dbraw/zinc/08/16/23/1048081623.db2.gz BQFISCZGGHTABA-IBGZPJMESA-N 1 2 313.445 4.433 20 0 DIADLO Cc1cc(NCCc2c[nH]c3ccccc23)nc(C(C)(C)C)[nH+]1 ZINC001160782020 1048084025 /nfs/dbraw/zinc/08/40/25/1048084025.db2.gz XBQLUAIWEOBHAW-UHFFFAOYSA-N 1 2 308.429 4.218 20 0 DIADLO c1[nH+]c(-c2ccc(N[C@@H]3CC[C@@H]3C3CC3)cc2)n2c1CCCC2 ZINC000554372543 1048084530 /nfs/dbraw/zinc/08/45/30/1048084530.db2.gz NQORHOCNAMGUPK-RTBURBONSA-N 1 2 307.441 4.487 20 0 DIADLO c1ccc([C@H]([NH2+]Cc2noc(C3CC3)n2)C2CCCCC2)cc1 ZINC000776007151 1048087685 /nfs/dbraw/zinc/08/76/85/1048087685.db2.gz QGKZYGIPIJOUHD-SFHVURJKSA-N 1 2 311.429 4.358 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCc1ccc(C2OCCO2)cc1 ZINC001160818264 1048087711 /nfs/dbraw/zinc/08/77/11/1048087711.db2.gz OSSOPOCCHALXIM-UHFFFAOYSA-N 1 2 320.392 4.201 20 0 DIADLO Cc1nc(N(C)[C@H](C)c2ccc(F)c(F)c2)c2c([nH+]1)CCCC2 ZINC001184774832 1048091535 /nfs/dbraw/zinc/09/15/35/1048091535.db2.gz BEYMYQBTJIRGGT-LLVKDONJSA-N 1 2 317.383 4.139 20 0 DIADLO Fc1nc(F)c(Cl)c(Nc2cccc3[nH+]c[nH]c32)c1Cl ZINC001213027143 1048094747 /nfs/dbraw/zinc/09/47/47/1048094747.db2.gz LIIQSXSSQYZMLU-UHFFFAOYSA-N 1 2 315.110 4.287 20 0 DIADLO Cc1cn2cc(NC(=O)N[C@H](C)CC3CCCCC3)ccc2[nH+]1 ZINC001199768054 1048099949 /nfs/dbraw/zinc/09/99/49/1048099949.db2.gz RRFMOROKUKQXCG-CYBMUJFWSA-N 1 2 314.433 4.123 20 0 DIADLO Cc1cn2cc(NC(=O)N3CCC[C@]3(C)CC(C)C)ccc2[nH+]1 ZINC001199767557 1048100608 /nfs/dbraw/zinc/10/06/08/1048100608.db2.gz HONZBMAAYSLYHV-GOSISDBHSA-N 1 2 314.433 4.075 20 0 DIADLO c1sc(C2CC2)nc1C[NH2+][C@H](c1ccccc1)[C@@H]1CCCO1 ZINC001199783845 1048102164 /nfs/dbraw/zinc/10/21/64/1048102164.db2.gz LSOMWJDPSKQYLV-DLBZAZTESA-N 1 2 314.454 4.030 20 0 DIADLO CCOc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1Cl ZINC001184967473 1048108003 /nfs/dbraw/zinc/10/80/03/1048108003.db2.gz DBZOCBHMXIMLQO-UHFFFAOYSA-N 1 2 317.820 4.478 20 0 DIADLO Cc1cnn(-c2ccc(Cl)cc2)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213030740 1048112957 /nfs/dbraw/zinc/11/29/57/1048112957.db2.gz OTJFFABZMIZDLI-UHFFFAOYSA-N 1 2 323.787 4.454 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(F)cc3C(F)(F)F)ccc21 ZINC001175102882 1048117940 /nfs/dbraw/zinc/11/79/40/1048117940.db2.gz HRIOEVQIVGYZMV-UHFFFAOYSA-N 1 2 309.266 4.475 20 0 DIADLO c1[nH]c2c(cccc2Nc2ccc(Cc3ccncc3)cc2)[nH+]1 ZINC001213031603 1048118700 /nfs/dbraw/zinc/11/87/00/1048118700.db2.gz IPIBKCICIWNTHP-UHFFFAOYSA-N 1 2 300.365 4.292 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1ccc(C(F)F)o1 ZINC001161261677 1048119367 /nfs/dbraw/zinc/11/93/67/1048119367.db2.gz WWJKQRCRTYTXGB-UHFFFAOYSA-N 1 2 317.295 4.168 20 0 DIADLO CSc1ccc(Nc2ccc[nH+]c2N2CCCC2)c(F)c1 ZINC001185042740 1048122371 /nfs/dbraw/zinc/12/23/71/1048122371.db2.gz HSEFLRNKMCZIIS-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO Cc1ncsc1-c1ccc(C[N@H+](C)Cc2nccs2)cc1 ZINC000667659881 1048123676 /nfs/dbraw/zinc/12/36/76/1048123676.db2.gz UFAKVXTVNNGNBJ-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO Cc1ncsc1-c1ccc(C[N@@H+](C)Cc2nccs2)cc1 ZINC000667659881 1048123682 /nfs/dbraw/zinc/12/36/82/1048123682.db2.gz UFAKVXTVNNGNBJ-UHFFFAOYSA-N 1 2 315.467 4.207 20 0 DIADLO COc1ccc(Nc2ccn3cc[nH+]c3c2)cc1C(F)(F)F ZINC001175071829 1048127427 /nfs/dbraw/zinc/12/74/27/1048127427.db2.gz UDLSZPYWXOXSRH-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO CNc1ccc(C(F)(F)F)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213032766 1048131176 /nfs/dbraw/zinc/13/11/76/1048131176.db2.gz XAEBNPGOJFQNHG-UHFFFAOYSA-N 1 2 306.291 4.367 20 0 DIADLO CCOc1ccc(F)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001175081527 1048135544 /nfs/dbraw/zinc/13/55/44/1048135544.db2.gz HXPNBNHPJQJCII-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@H](C)c2ccc3c(c2)OCO3)[nH+]1 ZINC001161516498 1048136473 /nfs/dbraw/zinc/13/64/73/1048136473.db2.gz VEMGGZOIDVRUJX-LLVKDONJSA-N 1 2 304.777 4.254 20 0 DIADLO Cc1sc2nc(C)nc(NCc3c[nH+]cn3C(C)C)c2c1C ZINC001161564927 1048138638 /nfs/dbraw/zinc/13/86/38/1048138638.db2.gz GVSWHDCNRYDBHO-UHFFFAOYSA-N 1 2 315.446 4.006 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cccc(OCc2ccccc2)n1 ZINC001161568851 1048140415 /nfs/dbraw/zinc/14/04/15/1048140415.db2.gz GGIICCWNKYOFIE-UHFFFAOYSA-N 1 2 322.412 4.050 20 0 DIADLO Cn1ncc(C2CCC2)c1C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000667671833 1048141691 /nfs/dbraw/zinc/14/16/91/1048141691.db2.gz AYZCLAZDNMEQJB-KRWDZBQOSA-N 1 2 315.848 4.288 20 0 DIADLO Cn1ncc(C2CCC2)c1C[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000667671833 1048141697 /nfs/dbraw/zinc/14/16/97/1048141697.db2.gz AYZCLAZDNMEQJB-KRWDZBQOSA-N 1 2 315.848 4.288 20 0 DIADLO CCOc1ccc(Nc2ccc[nH+]c2N2CCCC2)c(F)c1F ZINC001175151000 1048143124 /nfs/dbraw/zinc/14/31/24/1048143124.db2.gz UHNAMQIMBYMYCY-UHFFFAOYSA-N 1 2 319.355 4.102 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@H+]1Cc1ccc2ncccc2c1 ZINC000794435562 1048143635 /nfs/dbraw/zinc/14/36/35/1048143635.db2.gz PRBQYFJTYYYVRF-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@H]1c2ccc(Cl)n2CC[N@@H+]1Cc1ccc2ncccc2c1 ZINC000794435562 1048143641 /nfs/dbraw/zinc/14/36/41/1048143641.db2.gz PRBQYFJTYYYVRF-ZDUSSCGKSA-N 1 2 311.816 4.267 20 0 DIADLO CC(C)Sc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncccn2)cc1 ZINC000930214316 1048146279 /nfs/dbraw/zinc/14/62/79/1048146279.db2.gz AZCXGEHSUJGQHT-KGLIPLIRSA-N 1 2 301.459 4.389 20 0 DIADLO Nc1cc(F)cc(C(F)(F)F)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213034271 1048151518 /nfs/dbraw/zinc/15/15/18/1048151518.db2.gz ALQOZYKQEGADTF-UHFFFAOYSA-N 1 2 310.254 4.047 20 0 DIADLO Cc1c(Cl)c2ccc(F)cc2nc1NCCCn1cc[nH+]c1 ZINC001161682698 1048152500 /nfs/dbraw/zinc/15/25/00/1048152500.db2.gz WKOYVCWTWVJXDD-UHFFFAOYSA-N 1 2 318.783 4.034 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3CCO[C@@H](c4ccsc4)C3)cc21 ZINC000667681030 1048155313 /nfs/dbraw/zinc/15/53/13/1048155313.db2.gz ZIDPQGDYADOJIM-GOSISDBHSA-N 1 2 312.438 4.111 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3CCO[C@@H](c4ccsc4)C3)cc21 ZINC000667681030 1048155317 /nfs/dbraw/zinc/15/53/17/1048155317.db2.gz ZIDPQGDYADOJIM-GOSISDBHSA-N 1 2 312.438 4.111 20 0 DIADLO CNc1ccc(Br)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213034734 1048155333 /nfs/dbraw/zinc/15/53/33/1048155333.db2.gz ZIHDNJFGHXRIKG-UHFFFAOYSA-N 1 2 317.190 4.111 20 0 DIADLO C[C@H]1C[C@H](Nc2cc(SCc3ccccc3)cc[nH+]2)CCO1 ZINC001161695690 1048155466 /nfs/dbraw/zinc/15/54/66/1048155466.db2.gz GBRHUYAOAHDVLS-GOEBONIOSA-N 1 2 314.454 4.353 20 0 DIADLO CCSc1ccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000480518659 1048166299 /nfs/dbraw/zinc/16/62/99/1048166299.db2.gz MXIFVUUVXVDPIB-UHFFFAOYSA-N 1 2 323.421 4.441 20 0 DIADLO Nc1cc(Cl)[nH+]c(N[C@H](CC2CC2)c2ccccc2F)c1 ZINC001161772627 1048169318 /nfs/dbraw/zinc/16/93/18/1048169318.db2.gz RRPDLCSQOXIKRN-CQSZACIVSA-N 1 2 305.784 4.410 20 0 DIADLO Cc1nc(N[C@H](CC2CC2)c2ccccc2F)c2c([nH+]1)CCC2 ZINC001161776572 1048169475 /nfs/dbraw/zinc/16/94/75/1048169475.db2.gz ILBOVDSUNGCFJY-GOSISDBHSA-N 1 2 311.404 4.366 20 0 DIADLO Cc1nc(N[C@H](c2cncc(F)c2)C2CC2)cc(C(C)C)[nH+]1 ZINC001161812024 1048175177 /nfs/dbraw/zinc/17/51/77/1048175177.db2.gz MLCKINOZBIVGIN-KRWDZBQOSA-N 1 2 300.381 4.006 20 0 DIADLO CCc1ccc([C@H](COC)Nc2cc(C)[nH+]c(C3CCC3)n2)o1 ZINC001185420915 1048176332 /nfs/dbraw/zinc/17/63/32/1048176332.db2.gz NMTJEBMWHVZGHZ-HNNXBMFYSA-N 1 2 315.417 4.008 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1cccc(Cl)c1 ZINC000774875372 1048177796 /nfs/dbraw/zinc/17/77/96/1048177796.db2.gz PYHWDZUWWVFYPS-ZDUSSCGKSA-N 1 2 307.825 4.261 20 0 DIADLO Cc1ccc(C)c(Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)[nH+]c2)c1 ZINC001175162832 1048178093 /nfs/dbraw/zinc/17/80/93/1048178093.db2.gz YQGDMIGXSHYFLF-IYBDPMFKSA-N 1 2 311.429 4.056 20 0 DIADLO CCOc1cc[nH+]cc1Nc1cccc(O[C@H]2CCCCO2)c1 ZINC001175184401 1048187433 /nfs/dbraw/zinc/18/74/33/1048187433.db2.gz UNNANGXYBCWJLB-SFHVURJKSA-N 1 2 314.385 4.129 20 0 DIADLO COCCC1(Nc2cc(SC)cc[nH+]2)CCC(F)(F)CC1 ZINC001161912920 1048192485 /nfs/dbraw/zinc/19/24/85/1048192485.db2.gz JYTJYEAHAIYQRN-UHFFFAOYSA-N 1 2 316.417 4.200 20 0 DIADLO CSCc1cc[nH+]c(NC2(CC3CCC3)CCOCC2)c1 ZINC001161922831 1048192589 /nfs/dbraw/zinc/19/25/89/1048192589.db2.gz JDMPPGNJPHRCDX-UHFFFAOYSA-N 1 2 306.475 4.096 20 0 DIADLO CC(C)c1cc(N2CCS[C@@H](C(C)C)C2)nc(C(C)C)[nH+]1 ZINC001185555525 1048195343 /nfs/dbraw/zinc/19/53/43/1048195343.db2.gz UFIYIBNKIJQOOM-OAHLLOKOSA-N 1 2 307.507 4.301 20 0 DIADLO CCOc1ccc(OC)cc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001175212636 1048197242 /nfs/dbraw/zinc/19/72/42/1048197242.db2.gz BLJUTYYDPMRXQI-UHFFFAOYSA-N 1 2 309.369 4.023 20 0 DIADLO CC(C)c1cc(N(C)Cc2cccc(F)c2)nc(C(C)C)[nH+]1 ZINC001161951731 1048198280 /nfs/dbraw/zinc/19/82/80/1048198280.db2.gz DSFZNQKGWUIEDP-UHFFFAOYSA-N 1 2 301.409 4.499 20 0 DIADLO CCOc1ccc(OC)cc1Nc1ccc([N@H+](C)CC)cc1 ZINC001175215686 1048198367 /nfs/dbraw/zinc/19/83/67/1048198367.db2.gz QHAPAHQMVWZELB-UHFFFAOYSA-N 1 2 300.402 4.294 20 0 DIADLO CCOc1ccc(OC)cc1Nc1ccc([N@@H+](C)CC)cc1 ZINC001175215686 1048198372 /nfs/dbraw/zinc/19/83/72/1048198372.db2.gz QHAPAHQMVWZELB-UHFFFAOYSA-N 1 2 300.402 4.294 20 0 DIADLO CCO[C@H]1C[C@@H](Nc2nc(C)[nH+]c3c2CCCC3)C1(CC)CC ZINC001185545144 1048199972 /nfs/dbraw/zinc/19/99/72/1048199972.db2.gz XIQMGAVNFYOXDE-SJORKVTESA-N 1 2 317.477 4.060 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ncc(C(C)C)o2)cc1 ZINC000774899147 1048201940 /nfs/dbraw/zinc/20/19/40/1048201940.db2.gz FUBBPOZDOWTEBR-AWEZNQCLSA-N 1 2 302.418 4.436 20 0 DIADLO CCOc1ccc([C@@H](C)Nc2cc(C)[nH+]c(SC)n2)cc1 ZINC001161974249 1048204128 /nfs/dbraw/zinc/20/41/28/1048204128.db2.gz DOUWXQZHKAASKR-GFCCVEGCSA-N 1 2 303.431 4.079 20 0 DIADLO CC(=O)c1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)cc1F ZINC001175227793 1048205471 /nfs/dbraw/zinc/20/54/71/1048205471.db2.gz QPTIRDWDTSKIHV-UHFFFAOYSA-N 1 2 313.376 4.157 20 0 DIADLO Cc1cnn(C)c1C[N@@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000554847827 1048207562 /nfs/dbraw/zinc/20/75/62/1048207562.db2.gz AOXLZXNDMIBODF-HNNXBMFYSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1cnn(C)c1C[N@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000554847827 1048207580 /nfs/dbraw/zinc/20/75/80/1048207580.db2.gz AOXLZXNDMIBODF-HNNXBMFYSA-N 1 2 324.255 4.372 20 0 DIADLO CC(C)CC1CCN(c2nc3ccccc3n3c[nH+]cc23)CC1 ZINC001185659172 1048209528 /nfs/dbraw/zinc/20/95/28/1048209528.db2.gz UZXBPQKVMONWQG-UHFFFAOYSA-N 1 2 308.429 4.145 20 0 DIADLO CCO[C@@H]1C[C@H](N(C)c2cc(C)[nH+]c(C3CC3)n2)C1(CC)CC ZINC001185620126 1048210227 /nfs/dbraw/zinc/21/02/27/1048210227.db2.gz DDUDJHZSTHQHKR-JKSUJKDBSA-N 1 2 317.477 4.082 20 0 DIADLO Cc1cccn2c(CNc3ccccc3OCC(C)C)c[nH+]c12 ZINC001201248772 1048221603 /nfs/dbraw/zinc/22/16/03/1048221603.db2.gz JKRNHNAEEOTSJI-UHFFFAOYSA-N 1 2 309.413 4.290 20 0 DIADLO c1[nH+]c(-c2ccc(NCc3ccccc3)cc2)n2c1CCCC2 ZINC001201234597 1048222027 /nfs/dbraw/zinc/22/20/27/1048222027.db2.gz JYKZWJKAULYDDH-UHFFFAOYSA-N 1 2 303.409 4.499 20 0 DIADLO O=C(Nc1ccc2c(c1)CCC2)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001185758066 1048222172 /nfs/dbraw/zinc/22/21/72/1048222172.db2.gz KXYFIQUJBNUCCO-UHFFFAOYSA-N 1 2 318.380 4.005 20 0 DIADLO CCc1ccc([C@H](C)[NH2+]Cc2nc3cccc(Cl)c3n2C)o1 ZINC000480693135 1048224482 /nfs/dbraw/zinc/22/44/82/1048224482.db2.gz BTSKNORSIZGWDH-NSHDSACASA-N 1 2 317.820 4.233 20 0 DIADLO COc1ccc2cc(CN(C)c3nc(C)[nH+]c(C)c3C)ccc2c1 ZINC001162095595 1048224918 /nfs/dbraw/zinc/22/49/18/1048224918.db2.gz UWPXSCHXEWQYQD-UHFFFAOYSA-N 1 2 321.424 4.200 20 0 DIADLO CC(=O)c1c(C)cc(C)c(C[N@H+](C)Cc2c(C)noc2C)c1C ZINC000042132847 1048226372 /nfs/dbraw/zinc/22/63/72/1048226372.db2.gz SFVAVHGEAKMICX-UHFFFAOYSA-N 1 2 314.429 4.051 20 0 DIADLO CC(=O)c1c(C)cc(C)c(C[N@@H+](C)Cc2c(C)noc2C)c1C ZINC000042132847 1048226388 /nfs/dbraw/zinc/22/63/88/1048226388.db2.gz SFVAVHGEAKMICX-UHFFFAOYSA-N 1 2 314.429 4.051 20 0 DIADLO Nc1ccc(Nc2c(F)cccc2OC2CCCCC2)c[nH+]1 ZINC001201294495 1048230666 /nfs/dbraw/zinc/23/06/66/1048230666.db2.gz BHIJEXORCZFVDT-UHFFFAOYSA-N 1 2 301.365 4.258 20 0 DIADLO Cc1cc(NC(=O)OC(C)(C)C)ccc1Nc1ccc(N)[nH+]c1 ZINC001201295882 1048232192 /nfs/dbraw/zinc/23/21/92/1048232192.db2.gz VZCJDHOMFCOVKX-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO Cc1c(Nc2ccc(N)[nH+]c2)c(Cl)ccc1C(F)(F)F ZINC001201295926 1048232800 /nfs/dbraw/zinc/23/28/00/1048232800.db2.gz YDAKNPHRVXFACY-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO C[C@H](C[NH2+]c1ccc(N2CCO[C@@H](C)C2)cc1)c1ccccc1 ZINC000774939412 1048233644 /nfs/dbraw/zinc/23/36/44/1048233644.db2.gz UUEWOWBEVFIUJP-SJORKVTESA-N 1 2 310.441 4.127 20 0 DIADLO C[C@@H](C[NH2+]c1ccc(N2CCSCC2)cc1)c1ccccc1 ZINC000774936414 1048234239 /nfs/dbraw/zinc/23/42/39/1048234239.db2.gz LBIPROFMOQISEL-INIZCTEOSA-N 1 2 312.482 4.455 20 0 DIADLO CC(C)Cc1ccc(CNc2ccc3c(c2)CCC[N@H+]3C)cn1 ZINC001201308638 1048234362 /nfs/dbraw/zinc/23/43/62/1048234362.db2.gz MFLHTNZBJMIEIY-UHFFFAOYSA-N 1 2 309.457 4.275 20 0 DIADLO CC(C)Cc1ccc(CNc2ccc3c(c2)CCC[N@@H+]3C)cn1 ZINC001201308638 1048234368 /nfs/dbraw/zinc/23/43/68/1048234368.db2.gz MFLHTNZBJMIEIY-UHFFFAOYSA-N 1 2 309.457 4.275 20 0 DIADLO C[C@H](C[NH2+]c1ccc(N2CCOC[C@@H]2C)cc1)c1ccccc1 ZINC000774936600 1048234376 /nfs/dbraw/zinc/23/43/76/1048234376.db2.gz AEOMBJVQFBHABJ-SJORKVTESA-N 1 2 310.441 4.127 20 0 DIADLO Cn1ccc2cc(CNc3ccc(Cn4cc[nH+]c4)cc3)ccc21 ZINC001162168754 1048235348 /nfs/dbraw/zinc/23/53/48/1048235348.db2.gz DAXKSCNANJDAKI-UHFFFAOYSA-N 1 2 316.408 4.035 20 0 DIADLO Cc1cc(NCc2nccc3c2CCCC3)ccc1-n1cc[nH+]c1 ZINC001201357819 1048239172 /nfs/dbraw/zinc/23/91/72/1048239172.db2.gz UZVVHBBGEUPJPX-UHFFFAOYSA-N 1 2 318.424 4.067 20 0 DIADLO CCc1nc(N(Cc2ccc(Cl)cc2)C2CC2)cc(C)[nH+]1 ZINC001162195657 1048240653 /nfs/dbraw/zinc/24/06/53/1048240653.db2.gz LLJWZBMOEGSAAC-UHFFFAOYSA-N 1 2 301.821 4.170 20 0 DIADLO CN(C)c1ccc(Nc2ccc3nc(Cl)sc3c2)c[nH+]1 ZINC001175343796 1048249906 /nfs/dbraw/zinc/24/99/06/1048249906.db2.gz PCCPPHPDWFGXDS-UHFFFAOYSA-N 1 2 304.806 4.154 20 0 DIADLO c1coc(-c2ccc(Nc3ccc(N4CCCC4)[nH+]c3)cc2)n1 ZINC001175348582 1048251393 /nfs/dbraw/zinc/25/13/93/1048251393.db2.gz GVGNWOUWXQSUCI-UHFFFAOYSA-N 1 2 306.369 4.080 20 0 DIADLO Clc1cc(Cl)nc(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175346591 1048252884 /nfs/dbraw/zinc/25/28/84/1048252884.db2.gz YFCHHHMZKAJEGU-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO CC(=O)c1ccc(Nc2ccc(N(C)C)[nH+]c2)c(C(F)(F)F)c1 ZINC001175345798 1048252929 /nfs/dbraw/zinc/25/29/29/1048252929.db2.gz INQXGLSAEDZAED-UHFFFAOYSA-N 1 2 323.318 4.113 20 0 DIADLO Cc1cc(N[C@@H](C)COc2cccc(F)c2)nc(C2CCC2)[nH+]1 ZINC001162291164 1048257481 /nfs/dbraw/zinc/25/74/81/1048257481.db2.gz DJYXCOSGJHYRRX-ZDUSSCGKSA-N 1 2 315.392 4.071 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2ncc(C(C)C)o2)c1 ZINC000774987640 1048270040 /nfs/dbraw/zinc/27/00/40/1048270040.db2.gz AUTDLSOVZRXECW-CQSZACIVSA-N 1 2 302.418 4.436 20 0 DIADLO c1cc(OCC2CC2)ccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175349744 1048270699 /nfs/dbraw/zinc/27/06/99/1048270699.db2.gz FBXNITSFHDPTAS-UHFFFAOYSA-N 1 2 309.413 4.214 20 0 DIADLO FC(F)(F)Oc1cccc(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175351081 1048272446 /nfs/dbraw/zinc/27/24/46/1048272446.db2.gz LCMJPBGVBCSCGD-UHFFFAOYSA-N 1 2 323.318 4.324 20 0 DIADLO CC(C)OCc1cccc(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175349714 1048272878 /nfs/dbraw/zinc/27/28/78/1048272878.db2.gz DIOBRRRKBQIHAD-UHFFFAOYSA-N 1 2 311.429 4.350 20 0 DIADLO c1ccc(-c2cccc(Nc3ccc(N4CCCC4)[nH+]c3)c2)nc1 ZINC001175352886 1048274215 /nfs/dbraw/zinc/27/42/15/1048274215.db2.gz WBQPXWVESMVOGA-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Cc1ccnc2c(Nc3ccc(N4CCCC4)[nH+]c3)cccc12 ZINC001175352126 1048274254 /nfs/dbraw/zinc/27/42/54/1048274254.db2.gz RMQWDTFDRNWPPN-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO Cc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c(Cl)c1O ZINC001175352038 1048274341 /nfs/dbraw/zinc/27/43/41/1048274341.db2.gz PXUWRPVMXIHNMB-UHFFFAOYSA-N 1 2 303.793 4.093 20 0 DIADLO CSc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c(F)c1 ZINC001175352622 1048274436 /nfs/dbraw/zinc/27/44/36/1048274436.db2.gz LKMYDDDIOSQTCN-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO Cc1cc(N[C@H]2CCOc3c(F)cc(F)cc32)nc(C(C)C)[nH+]1 ZINC001162404739 1048275291 /nfs/dbraw/zinc/27/52/91/1048275291.db2.gz AYKDJZZALPXRKE-AWEZNQCLSA-N 1 2 319.355 4.122 20 0 DIADLO COC(=O)c1cc(Cl)ncc1Nc1ccc([NH2+]C(C)C)cc1 ZINC001201488193 1048279869 /nfs/dbraw/zinc/27/98/69/1048279869.db2.gz ACARDHMLSGDBTI-UHFFFAOYSA-N 1 2 319.792 4.086 20 0 DIADLO Cc1cn2cccc(Nc3c(F)c(F)c(F)c(F)c3F)c2[nH+]1 ZINC001175382912 1048290263 /nfs/dbraw/zinc/29/02/63/1048290263.db2.gz HIEFCSLEMJFKHL-UHFFFAOYSA-N 1 2 313.229 4.082 20 0 DIADLO CC(C)CC[C@@](C)(O)CNc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC001162568191 1048306489 /nfs/dbraw/zinc/30/64/89/1048306489.db2.gz PKMFIYHBWIURAG-GOSISDBHSA-N 1 2 307.482 4.323 20 0 DIADLO Cc1cc(NCc2cccc3c2cnn3C)[nH+]c2ccccc12 ZINC001162586805 1048307593 /nfs/dbraw/zinc/30/75/93/1048307593.db2.gz JXBWBRYXHRFSOV-UHFFFAOYSA-N 1 2 302.381 4.042 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCc1cccc2c1cnn2C ZINC001162586326 1048308447 /nfs/dbraw/zinc/30/84/47/1048308447.db2.gz ARBCYWNJDAQEAA-UHFFFAOYSA-N 1 2 302.381 4.042 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1cc(F)cc(C(=O)N(C)C)c1 ZINC001201520114 1048309013 /nfs/dbraw/zinc/30/90/13/1048309013.db2.gz OIGNNWOALITIBL-UHFFFAOYSA-N 1 2 315.392 4.098 20 0 DIADLO CCc1cc(N2C[C@H](C)C[C@H]2c2cccc(F)c2)nc(CC)[nH+]1 ZINC001162625830 1048315666 /nfs/dbraw/zinc/31/56/66/1048315666.db2.gz JNUBEIFALMDKKF-DYVFJYSZSA-N 1 2 313.420 4.328 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1ccc([S@](C)=O)cc1 ZINC001175473967 1048316105 /nfs/dbraw/zinc/31/61/05/1048316105.db2.gz JMUXGNYYLCVZDD-NRFANRHFSA-N 1 2 302.443 4.070 20 0 DIADLO CCc1cc(N2[C@H](C)C[C@@H](c3ccccc3)[C@H]2C)nc(CC)[nH+]1 ZINC001186572201 1048318427 /nfs/dbraw/zinc/31/84/27/1048318427.db2.gz SMQANSRSRBWTKF-IIDMSEBBSA-N 1 2 309.457 4.372 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H](C)c2cccc(N(C)C)c2)c1 ZINC001162634835 1048319902 /nfs/dbraw/zinc/31/99/02/1048319902.db2.gz HOKRYZJYPCDWFH-ZDUSSCGKSA-N 1 2 301.459 4.433 20 0 DIADLO CC(C)(Nc1ccc(F)c(-n2cc[nH+]c2)c1)C(=O)c1ccccc1 ZINC001162639827 1048322935 /nfs/dbraw/zinc/32/29/35/1048322935.db2.gz MLIPRJANHVJSPX-UHFFFAOYSA-N 1 2 323.371 4.085 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1ncc(Br)cc1C(F)(F)F ZINC001162664819 1048332180 /nfs/dbraw/zinc/33/21/80/1048332180.db2.gz QEFCNYUVAXEFDI-UHFFFAOYSA-N 1 2 324.144 4.298 20 0 DIADLO c1cn2c(cccc2Nc2cncc(OCc3ccccc3)c2)[nH+]1 ZINC001201620503 1048334556 /nfs/dbraw/zinc/33/45/56/1048334556.db2.gz KFTWJIBVIAOGMX-UHFFFAOYSA-N 1 2 316.364 4.052 20 0 DIADLO Cc1cc(N2CCC[C@H](CC(F)(F)F)C2)nc(C2CCC2)[nH+]1 ZINC001186763341 1048338102 /nfs/dbraw/zinc/33/81/02/1048338102.db2.gz BNCDTGIFJKUCOY-GFCCVEGCSA-N 1 2 313.367 4.221 20 0 DIADLO Cc1cc(CNc2ccnc(-c3cccc(Cl)c3)n2)cc(C)[nH+]1 ZINC001186748424 1048338806 /nfs/dbraw/zinc/33/88/06/1048338806.db2.gz PFRKITQHGRXCHH-UHFFFAOYSA-N 1 2 324.815 4.421 20 0 DIADLO C[C@@H]1CN(c2ccc(Nc3ccc(C4CC4)cc3)c[nH+]2)C[C@H](C)O1 ZINC001201676013 1048340793 /nfs/dbraw/zinc/34/07/93/1048340793.db2.gz UAXLETLGUYHIID-GASCZTMLSA-N 1 2 323.440 4.316 20 0 DIADLO CC(C)c1cc(NCC(C)(C)OCC2CC2)nc(C(C)C)[nH+]1 ZINC001186721174 1048342243 /nfs/dbraw/zinc/34/22/43/1048342243.db2.gz SKMKDYSITPRHTH-UHFFFAOYSA-N 1 2 305.466 4.341 20 0 DIADLO CCc1cc(NCC2(Cc3ccccc3)CCC2)nc(CC)[nH+]1 ZINC001162773348 1048356028 /nfs/dbraw/zinc/35/60/28/1048356028.db2.gz DCSOERWWCUCOIS-UHFFFAOYSA-N 1 2 309.457 4.426 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+]Cc1ncc(C(C)C)o1 ZINC000775084388 1048371900 /nfs/dbraw/zinc/37/19/00/1048371900.db2.gz DZRJABBWLSMVGD-HNNXBMFYSA-N 1 2 302.418 4.438 20 0 DIADLO C[N@H+](Cc1noc2c1CC(C)(C)CC2)Cc1ccc2cc[nH]c2c1 ZINC001175623338 1048377561 /nfs/dbraw/zinc/37/75/61/1048377561.db2.gz YFPSUWYMQJKVEF-UHFFFAOYSA-N 1 2 323.440 4.303 20 0 DIADLO C[N@@H+](Cc1noc2c1CC(C)(C)CC2)Cc1ccc2cc[nH]c2c1 ZINC001175623338 1048377572 /nfs/dbraw/zinc/37/75/72/1048377572.db2.gz YFPSUWYMQJKVEF-UHFFFAOYSA-N 1 2 323.440 4.303 20 0 DIADLO Cn1cc2cc(Nc3ccc([NH+]4CCCCC4)cc3)ccc2n1 ZINC001175624840 1048379612 /nfs/dbraw/zinc/37/96/12/1048379612.db2.gz LRNIZPZHYLCFSA-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO CO[C@H](CNc1cc(C(C)C)[nH+]c(C(C)C)n1)C1CCCC1 ZINC001187139909 1048380171 /nfs/dbraw/zinc/38/01/71/1048380171.db2.gz FLNHNWASFQNIRC-MRXNPFEDSA-N 1 2 305.466 4.341 20 0 DIADLO CCc1nc(N2CCC[C@@]2(C)Cc2cccc(C)c2)cc(C)[nH+]1 ZINC001187198606 1048380663 /nfs/dbraw/zinc/38/06/63/1048380663.db2.gz HCPBMAGFZLAQTH-FQEVSTJZSA-N 1 2 309.457 4.257 20 0 DIADLO Cc1cc(NCC2([C@@H]3CCCCO3)CCC2)nc(C2CCC2)[nH+]1 ZINC001187183133 1048380690 /nfs/dbraw/zinc/38/06/90/1048380690.db2.gz WNTZTSJQKSQJNQ-INIZCTEOSA-N 1 2 315.461 4.204 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(Nc3cccc(C4CCOCC4)c3)c12 ZINC001187242917 1048384534 /nfs/dbraw/zinc/38/45/34/1048384534.db2.gz QFZNZYGGUYUGOX-UHFFFAOYSA-N 1 2 322.412 4.158 20 0 DIADLO COc1ccsc1C[NH2+][C@H](c1cccc(C)c1)c1ccccn1 ZINC001201842111 1048387155 /nfs/dbraw/zinc/38/71/55/1048387155.db2.gz HCLGBWZOGCQYKP-LJQANCHMSA-N 1 2 324.449 4.339 20 0 DIADLO Cc1nc(N[C@H]2CCc3c2c(F)ccc3F)cc(C(C)C)[nH+]1 ZINC001162930444 1048390960 /nfs/dbraw/zinc/39/09/60/1048390960.db2.gz BMVRURSKZNVQFR-AWEZNQCLSA-N 1 2 303.356 4.286 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1ccc(C(=O)NC2CC2)cc1 ZINC001175606854 1048392027 /nfs/dbraw/zinc/39/20/27/1048392027.db2.gz ZMNSWYMOFOVUCS-UHFFFAOYSA-N 1 2 323.440 4.224 20 0 DIADLO Cc1cc(N[C@@H]2CCc3c2c(F)ccc3F)nc(C(C)C)[nH+]1 ZINC001162937994 1048392685 /nfs/dbraw/zinc/39/26/85/1048392685.db2.gz HFSSQFRURNCOGR-CQSZACIVSA-N 1 2 303.356 4.286 20 0 DIADLO Cc1cc(N[C@H]2CCc3c2c(F)ccc3F)nc(C2CC2)[nH+]1 ZINC001162938699 1048393862 /nfs/dbraw/zinc/39/38/62/1048393862.db2.gz RPYFPUJWJVLMGE-AWEZNQCLSA-N 1 2 301.340 4.040 20 0 DIADLO CC(=O)N1CC(C)(C)c2ccc(Nc3cc(C)c[nH+]c3C)cc21 ZINC001203662957 1048395669 /nfs/dbraw/zinc/39/56/69/1048395669.db2.gz ADENAYPYHZILDP-UHFFFAOYSA-N 1 2 309.413 4.086 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(C(=O)c3ccncc3)cc2)c1 ZINC001203663808 1048405109 /nfs/dbraw/zinc/40/51/09/1048405109.db2.gz SFBWAINGEMCQMR-UHFFFAOYSA-N 1 2 303.365 4.068 20 0 DIADLO CC[C@H](NC(=O)[C@@H](C)Cc1c[nH]c[nH+]1)c1cccc2ccccc21 ZINC000899654075 1048409514 /nfs/dbraw/zinc/40/95/14/1048409514.db2.gz FTGOQUVIZFUXDG-LIRRHRJNSA-N 1 2 321.424 4.009 20 0 DIADLO CC[C@H](NC(=O)[C@@H](C)Cc1c[nH+]c[nH]1)c1cccc2ccccc21 ZINC000899654075 1048409530 /nfs/dbraw/zinc/40/95/30/1048409530.db2.gz FTGOQUVIZFUXDG-LIRRHRJNSA-N 1 2 321.424 4.009 20 0 DIADLO CCc1cc(N2CC[C@H](C)C3(CCCCC3)C2)nc(CC)[nH+]1 ZINC001163112648 1048417392 /nfs/dbraw/zinc/41/73/92/1048417392.db2.gz KFSRTJOHTAHNBW-HNNXBMFYSA-N 1 2 301.478 4.398 20 0 DIADLO CCc1ccccc1NC(=O)Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001187636470 1048417539 /nfs/dbraw/zinc/41/75/39/1048417539.db2.gz QHKIAMQLIWBHNX-UHFFFAOYSA-N 1 2 320.396 4.138 20 0 DIADLO COCCC1(CNc2cc(C)[nH+]c(C3CCC3)n2)CCCCC1 ZINC001163120404 1048418981 /nfs/dbraw/zinc/41/89/81/1048418981.db2.gz RXYZALPBKGBDPF-UHFFFAOYSA-N 1 2 317.477 4.451 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc3ncsc3c2)c[nH+]1 ZINC001175712481 1048419604 /nfs/dbraw/zinc/41/96/04/1048419604.db2.gz MWNSJMAQHLTRCP-UHFFFAOYSA-N 1 2 310.304 4.036 20 0 DIADLO Cc1nc(NCc2ccc3nccn3c2)cc(C2CCCCC2)[nH+]1 ZINC001163141083 1048420532 /nfs/dbraw/zinc/42/05/32/1048420532.db2.gz SESINNRJQVQKSM-UHFFFAOYSA-N 1 2 321.428 4.093 20 0 DIADLO COc1cc(C)c(Nc2c[nH+]c(N)cc2C(F)(F)F)cc1C ZINC001175713369 1048420688 /nfs/dbraw/zinc/42/06/88/1048420688.db2.gz FLNUAUUCXUINFX-UHFFFAOYSA-N 1 2 311.307 4.052 20 0 DIADLO CC(C)c1cc(NCc2ccc3[nH+]ccn3c2)nc(C(C)(C)C)n1 ZINC001163140423 1048420942 /nfs/dbraw/zinc/42/09/42/1048420942.db2.gz DSVPCGURKRZHSP-UHFFFAOYSA-N 1 2 323.444 4.157 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cc(F)cc3cccnc32)c[nH+]1 ZINC001175713523 1048420996 /nfs/dbraw/zinc/42/09/96/1048420996.db2.gz CCBIRIHRJKCCSF-UHFFFAOYSA-N 1 2 322.265 4.114 20 0 DIADLO CC(C)c1ccc2ncnc(NCc3ccc4[nH+]ccn4c3)c2c1 ZINC001163140583 1048421150 /nfs/dbraw/zinc/42/11/50/1048421150.db2.gz GDMZRKBRNWCMTK-UHFFFAOYSA-N 1 2 317.396 4.013 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cccc3cncc(F)c32)c[nH+]1 ZINC001175713693 1048421939 /nfs/dbraw/zinc/42/19/39/1048421939.db2.gz KOKCEGIODDUBBD-UHFFFAOYSA-N 1 2 322.265 4.114 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3ccc(F)c(Cl)c3)ccc2[nH+]1 ZINC001187672281 1048422202 /nfs/dbraw/zinc/42/22/02/1048422202.db2.gz QUHDMWYYKNMUQM-UHFFFAOYSA-N 1 2 318.739 4.079 20 0 DIADLO Cc1ccc(Cl)c(Nc2c[nH+]c(N)cc2C(F)(F)F)c1 ZINC001175717226 1048423385 /nfs/dbraw/zinc/42/33/85/1048423385.db2.gz GCIQSAOVKJCBBY-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(F)c(C3CC3)c2)c[nH+]1 ZINC001175717617 1048423527 /nfs/dbraw/zinc/42/35/27/1048423527.db2.gz WTGKLPYBJCGKLT-UHFFFAOYSA-N 1 2 311.282 4.443 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2nc3ccccc3o2)cc(F)c1F ZINC001143610083 1048424705 /nfs/dbraw/zinc/42/47/05/1048424705.db2.gz QGZIOUHWJVCYKF-UHFFFAOYSA-N 1 2 302.324 4.046 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2nc3ccccc3o2)cc(F)c1F ZINC001143610083 1048424714 /nfs/dbraw/zinc/42/47/14/1048424714.db2.gz QGZIOUHWJVCYKF-UHFFFAOYSA-N 1 2 302.324 4.046 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)Nc1ccccc1Cl ZINC001202063876 1048436047 /nfs/dbraw/zinc/43/60/47/1048436047.db2.gz YORWQQNXZIETJH-UHFFFAOYSA-N 1 2 312.760 4.170 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2cnc(Cl)cc2Cl)c[nH+]1 ZINC001175705761 1048436037 /nfs/dbraw/zinc/43/60/37/1048436037.db2.gz FRXZUOCQINIECF-UHFFFAOYSA-N 1 2 323.105 4.128 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(C3CCC3)nc2)c[nH+]1 ZINC001175711268 1048437624 /nfs/dbraw/zinc/43/76/24/1048437624.db2.gz UEJJKTOYMCWCBK-UHFFFAOYSA-N 1 2 308.307 4.089 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccnc(Cl)c2Cl)c[nH+]1 ZINC001175709900 1048437812 /nfs/dbraw/zinc/43/78/12/1048437812.db2.gz OVZNHSZVEWBIEL-UHFFFAOYSA-N 1 2 323.105 4.128 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2nc(Cl)ccc2Cl)c[nH+]1 ZINC001175710952 1048438057 /nfs/dbraw/zinc/43/80/57/1048438057.db2.gz PIYHWZGASMQGDU-UHFFFAOYSA-N 1 2 323.105 4.128 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2csc3ncccc23)c[nH+]1 ZINC001175709648 1048438114 /nfs/dbraw/zinc/43/81/14/1048438114.db2.gz IKCAABMVCJBCEL-UHFFFAOYSA-N 1 2 310.304 4.036 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(Cl)nc2Cl)c[nH+]1 ZINC001175710165 1048438136 /nfs/dbraw/zinc/43/81/36/1048438136.db2.gz WTBPAMPSVGABTN-UHFFFAOYSA-N 1 2 323.105 4.128 20 0 DIADLO COc1cccc2c1OC[C@@H]2Nc1cc(C)c2ccccc2[nH+]1 ZINC001163224843 1048438976 /nfs/dbraw/zinc/43/89/76/1048438976.db2.gz FXKWZKHRWHYNFD-INIZCTEOSA-N 1 2 306.365 4.097 20 0 DIADLO COc1cccc2c1OC[C@H]2Nc1cc(C)c2cccc(C)c2[nH+]1 ZINC001163222811 1048439557 /nfs/dbraw/zinc/43/95/57/1048439557.db2.gz HRFQIAUCTLPGTA-MRXNPFEDSA-N 1 2 320.392 4.406 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NCc1cnc2c(F)cccc2c1 ZINC001202032018 1048440459 /nfs/dbraw/zinc/44/04/59/1048440459.db2.gz VNTPBGZBRZZDMD-UHFFFAOYSA-N 1 2 311.360 4.168 20 0 DIADLO Cc1nc(N2CCC[C@@H]2/C=C\c2ccccc2)c2c([nH+]1)CCCC2 ZINC001187765749 1048441609 /nfs/dbraw/zinc/44/16/09/1048441609.db2.gz PUZZMQLUFIARCF-SWNWVQGVSA-N 1 2 319.452 4.346 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)Nc1ccc(Cl)cc1Cl ZINC001202074155 1048454509 /nfs/dbraw/zinc/45/45/09/1048454509.db2.gz VRPCEGUPFGRDGI-UHFFFAOYSA-N 1 2 321.167 4.285 20 0 DIADLO CSc1cccc(NC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001188016024 1048467765 /nfs/dbraw/zinc/46/77/65/1048467765.db2.gz QHXBNRGDERYEKM-UHFFFAOYSA-N 1 2 324.409 4.238 20 0 DIADLO CSc1ccc(NC(=O)Nc2cccc3[nH+]c(C)cn32)cc1 ZINC001188073955 1048472070 /nfs/dbraw/zinc/47/20/70/1048472070.db2.gz WUCZFNJQPQOKEM-UHFFFAOYSA-N 1 2 312.398 4.009 20 0 DIADLO c1nc(C[N@@H+]2Cc3ccccc3C3(CC3)C2)oc1-c1ccccc1 ZINC000481767849 1048479659 /nfs/dbraw/zinc/47/96/59/1048479659.db2.gz LJAMERXWTKQFGE-UHFFFAOYSA-N 1 2 316.404 4.389 20 0 DIADLO c1nc(C[N@H+]2Cc3ccccc3C3(CC3)C2)oc1-c1ccccc1 ZINC000481767849 1048479662 /nfs/dbraw/zinc/47/96/62/1048479662.db2.gz LJAMERXWTKQFGE-UHFFFAOYSA-N 1 2 316.404 4.389 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CC=C(c3cccc(Cl)c3)CC2)n1 ZINC000481765608 1048480678 /nfs/dbraw/zinc/48/06/78/1048480678.db2.gz GVRPSUXTYBVRPB-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)n1 ZINC000481765608 1048480684 /nfs/dbraw/zinc/48/06/84/1048480684.db2.gz GVRPSUXTYBVRPB-UHFFFAOYSA-N 1 2 315.848 4.407 20 0 DIADLO COC[C@@H]([NH2+]Cc1cscc1Cl)c1ccc(F)c(F)c1 ZINC000776255746 1048481822 /nfs/dbraw/zinc/48/18/22/1048481822.db2.gz HSYRQMWMNLLDOI-CQSZACIVSA-N 1 2 317.788 4.157 20 0 DIADLO Cn1ccc2c1cccc2Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001175865122 1048482167 /nfs/dbraw/zinc/48/21/67/1048482167.db2.gz FSANUZUQAPZAHQ-UHFFFAOYSA-N 1 2 302.381 4.167 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000481770595 1048483156 /nfs/dbraw/zinc/48/31/56/1048483156.db2.gz YEWWGZIDNMZZNQ-CJNGLKHVSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000481770595 1048483161 /nfs/dbraw/zinc/48/31/61/1048483161.db2.gz YEWWGZIDNMZZNQ-CJNGLKHVSA-N 1 2 323.362 4.035 20 0 DIADLO Cc1nc(N2CC(c3ccccc3)(C(C)C)C2)c2c([nH+]1)CCCC2 ZINC001163523557 1048483950 /nfs/dbraw/zinc/48/39/50/1048483950.db2.gz KZIBEZLQOQJTFC-UHFFFAOYSA-N 1 2 321.468 4.078 20 0 DIADLO Cc1cccn2c([C@H](C)NC(=O)Nc3c(C)cccc3C)c[nH+]c12 ZINC001202215289 1048485509 /nfs/dbraw/zinc/48/55/09/1048485509.db2.gz VXLUZVMDEJECAI-HNNXBMFYSA-N 1 2 322.412 4.142 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(OC(C)C)c(Cl)c1 ZINC001175868163 1048485799 /nfs/dbraw/zinc/48/57/99/1048485799.db2.gz WIIUIMKNUPXOQN-UHFFFAOYSA-N 1 2 315.804 4.357 20 0 DIADLO c1cn2cccc(Nc3cccnc3OCc3ccccc3)c2[nH+]1 ZINC001175873350 1048488989 /nfs/dbraw/zinc/48/89/89/1048488989.db2.gz ZWGMJRZVOICKKH-UHFFFAOYSA-N 1 2 316.364 4.052 20 0 DIADLO COc1ccc(Nc2cccc3[nH+]ccn32)c(C(F)(F)F)c1 ZINC001213046450 1048495113 /nfs/dbraw/zinc/49/51/13/1048495113.db2.gz IHPXOQHXRXTNQL-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO Clc1cc(Nc2ccc3scnc3c2)cn2cc[nH+]c12 ZINC001175915068 1048498555 /nfs/dbraw/zinc/49/85/55/1048498555.db2.gz LJBDRWGARDXXQR-UHFFFAOYSA-N 1 2 300.774 4.341 20 0 DIADLO c1cn(Cc2cccc(Nc3ccc4scnc4c3)c2)c[nH+]1 ZINC001175915331 1048499068 /nfs/dbraw/zinc/49/90/68/1048499068.db2.gz WHUDKHMIBWKALU-UHFFFAOYSA-N 1 2 306.394 4.285 20 0 DIADLO Cc1cccc2c(C)cc(N3CCC(=O)[C@@H]4CCCC[C@H]43)[nH+]c12 ZINC001163786866 1048524913 /nfs/dbraw/zinc/52/49/13/1048524913.db2.gz VJWIGESPNKCLEQ-IAGOWNOFSA-N 1 2 308.425 4.190 20 0 DIADLO Cc1cc2[nH]c(C[N@@H+]3CCO[C@@H](c4ccccc4)C3)cc2c(C)c1 ZINC000481923157 1048527779 /nfs/dbraw/zinc/52/77/79/1048527779.db2.gz NJKAJTLLIGDPRB-OAQYLSRUSA-N 1 2 320.436 4.358 20 0 DIADLO Cc1cc2[nH]c(C[N@H+]3CCO[C@@H](c4ccccc4)C3)cc2c(C)c1 ZINC000481923157 1048527796 /nfs/dbraw/zinc/52/77/96/1048527796.db2.gz NJKAJTLLIGDPRB-OAQYLSRUSA-N 1 2 320.436 4.358 20 0 DIADLO CCSc1cc[nH+]c(N2CC[C@@H](c3ccccc3OC)C2)c1 ZINC001163810505 1048528046 /nfs/dbraw/zinc/52/80/46/1048528046.db2.gz ZHVQYBYGIDNMKA-CQSZACIVSA-N 1 2 314.454 4.196 20 0 DIADLO COc1ccccc1[C@@H]1CCN(c2[nH+]c(C)cc(Cl)c2C)C1 ZINC001163807246 1048528571 /nfs/dbraw/zinc/52/85/71/1048528571.db2.gz QHBAXSYZDCTXGX-CQSZACIVSA-N 1 2 316.832 4.354 20 0 DIADLO CC[NH+](CC)[C@H](CN[C@@H](C)c1ccc(F)cc1F)c1ccco1 ZINC000481944133 1048530095 /nfs/dbraw/zinc/53/00/95/1048530095.db2.gz GVFZYJZEESTKFY-SUMWQHHRSA-N 1 2 322.399 4.292 20 0 DIADLO CCc1nc(N2CCC[C@@]2(C)Cc2ccc(C)cc2)cc(C)[nH+]1 ZINC001163837700 1048533592 /nfs/dbraw/zinc/53/35/92/1048533592.db2.gz LENBULMZPFOHIT-FQEVSTJZSA-N 1 2 309.457 4.257 20 0 DIADLO CCc1cc(NCC2(C(F)(F)F)CCCC2)nc(CC)[nH+]1 ZINC001163837337 1048533907 /nfs/dbraw/zinc/53/39/07/1048533907.db2.gz AHYOKWHCSLTYHA-UHFFFAOYSA-N 1 2 301.356 4.136 20 0 DIADLO O=C(Nc1ccc(Cl)cc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001202374601 1048535058 /nfs/dbraw/zinc/53/50/58/1048535058.db2.gz KEWRQIZLOLDMCZ-UHFFFAOYSA-N 1 2 312.760 4.170 20 0 DIADLO Cc1scc(CNc2nc3ccccc3n3c[nH+]cc23)c1C ZINC001163882228 1048543831 /nfs/dbraw/zinc/54/38/31/1048543831.db2.gz QUPVFBAQGMRZTR-UHFFFAOYSA-N 1 2 308.410 4.173 20 0 DIADLO Cc1ccc(NC(=O)N(C)C2CCCCCCC2)c(N(C)C)[nH+]1 ZINC001202395423 1048549547 /nfs/dbraw/zinc/54/95/47/1048549547.db2.gz JHVSESSJWDTTIQ-UHFFFAOYSA-N 1 2 318.465 4.033 20 0 DIADLO CCc1ccc(NCc2c[nH+]c(C)n2-c2ccccc2)cc1OC ZINC001202435952 1048553152 /nfs/dbraw/zinc/55/31/52/1048553152.db2.gz MOTXYWIQXWIUCU-UHFFFAOYSA-N 1 2 321.424 4.364 20 0 DIADLO COc1ccc2cc[nH+]c(N3CCc4ccccc4[C@@H]3C)c2c1 ZINC001163956831 1048559606 /nfs/dbraw/zinc/55/96/06/1048559606.db2.gz VOLPQWNOJMLAHL-AWEZNQCLSA-N 1 2 304.393 4.367 20 0 DIADLO COc1cc[nH+]cc1Nc1cccc(Cl)c1Br ZINC001176123494 1048576400 /nfs/dbraw/zinc/57/64/00/1048576400.db2.gz WHZFSOLAXWOFNN-UHFFFAOYSA-N 1 2 313.582 4.250 20 0 DIADLO Cc1cn2c(cccc2NC(=O)Nc2cccc3ccccc32)[nH+]1 ZINC001188906823 1048566395 /nfs/dbraw/zinc/56/63/95/1048566395.db2.gz ZJCUDWKJLSKWKP-UHFFFAOYSA-N 1 2 316.364 4.440 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001176178038 1048581131 /nfs/dbraw/zinc/58/11/31/1048581131.db2.gz WSKDPXQKDGOXOG-LBPRGKRZSA-N 1 2 309.784 4.128 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001176178038 1048581143 /nfs/dbraw/zinc/58/11/43/1048581143.db2.gz WSKDPXQKDGOXOG-LBPRGKRZSA-N 1 2 309.784 4.128 20 0 DIADLO CC(C)(C)c1cccc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001188969999 1048574205 /nfs/dbraw/zinc/57/42/05/1048574205.db2.gz KBEDXHYSOQYFTG-UHFFFAOYSA-N 1 2 319.408 4.422 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(Oc2ccccc2)ccc1N ZINC001176123119 1048575765 /nfs/dbraw/zinc/57/57/65/1048575765.db2.gz NJVWHKOQCJGRRD-UHFFFAOYSA-N 1 2 307.353 4.208 20 0 DIADLO COCCOc1cc(N[C@@H](C)c2ccc3ccccc3c2)cc[nH+]1 ZINC001164143396 1048588743 /nfs/dbraw/zinc/58/87/43/1048588743.db2.gz NWULRAQLLHXFPJ-HNNXBMFYSA-N 1 2 322.408 4.433 20 0 DIADLO CNc1ccc(CNc2cc3c4c(c2)CCC[NH+]4CCC3)cc1 ZINC001164153950 1048595477 /nfs/dbraw/zinc/59/54/77/1048595477.db2.gz GWNLCZYVVZSAQJ-UHFFFAOYSA-N 1 2 307.441 4.039 20 0 DIADLO Fc1ccc2c[nH+]c(N[C@@H](c3cccnc3)C(F)(F)F)cc2c1 ZINC001164175176 1048596924 /nfs/dbraw/zinc/59/69/24/1048596924.db2.gz CRVTVXRKKWGTBH-HNNXBMFYSA-N 1 2 321.277 4.484 20 0 DIADLO CCOc1cc(C[N@H+](CC)Cc2cccs2)c(Cl)cn1 ZINC001250319199 1048597251 /nfs/dbraw/zinc/59/72/51/1048597251.db2.gz PTDAOJKCFZRERG-UHFFFAOYSA-N 1 2 310.850 4.217 20 0 DIADLO CCOc1cc(C[N@@H+](CC)Cc2cccs2)c(Cl)cn1 ZINC001250319199 1048597266 /nfs/dbraw/zinc/59/72/66/1048597266.db2.gz PTDAOJKCFZRERG-UHFFFAOYSA-N 1 2 310.850 4.217 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)CCc3ccccc3)cc2)[nH+]c1C ZINC001176210326 1048606369 /nfs/dbraw/zinc/60/63/69/1048606369.db2.gz GNBIPXHZKBZTSK-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO COc1ccc2cc(NCCSCc3ccco3)[nH+]cc2c1 ZINC001164219908 1048608267 /nfs/dbraw/zinc/60/82/67/1048608267.db2.gz BLAIOLQBSFALSR-UHFFFAOYSA-N 1 2 314.410 4.182 20 0 DIADLO c1coc(CSCCNc2cc(-c3ccncc3)cc[nH+]2)c1 ZINC001164216033 1048608670 /nfs/dbraw/zinc/60/86/70/1048608670.db2.gz QOIUWNRJECBATL-UHFFFAOYSA-N 1 2 311.410 4.082 20 0 DIADLO CC(C)c1cc(NCC2(Br)CC2)nc(C(C)C)[nH+]1 ZINC001164234284 1048610389 /nfs/dbraw/zinc/61/03/89/1048610389.db2.gz MLCHCFUOCDYNGY-UHFFFAOYSA-N 1 2 312.255 4.063 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000482495055 1048617460 /nfs/dbraw/zinc/61/74/60/1048617460.db2.gz HADDIWDCTZDCCG-DOMZBBRYSA-N 1 2 323.362 4.240 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cnc(-c2ccccc2)[nH]1 ZINC000482495055 1048617467 /nfs/dbraw/zinc/61/74/67/1048617467.db2.gz HADDIWDCTZDCCG-DOMZBBRYSA-N 1 2 323.362 4.240 20 0 DIADLO CCOc1c(Cl)cc(NCc2[nH]c(C)c(C)[nH+]2)cc1Cl ZINC000850249084 1048627143 /nfs/dbraw/zinc/62/71/43/1048627143.db2.gz OTSXYNIMFZEUOF-UHFFFAOYSA-N 1 2 314.216 4.344 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@H+](C)CCC(F)(F)F ZINC000066437923 1048643646 /nfs/dbraw/zinc/64/36/46/1048643646.db2.gz XCSIWDWMKKRCBJ-UHFFFAOYSA-N 1 2 304.337 4.096 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[N@@H+](C)CCC(F)(F)F ZINC000066437923 1048643648 /nfs/dbraw/zinc/64/36/48/1048643648.db2.gz XCSIWDWMKKRCBJ-UHFFFAOYSA-N 1 2 304.337 4.096 20 0 DIADLO Cc1ccc(Nc2cccc3c2cnn3[C@H]2CCCCO2)c(C)[nH+]1 ZINC001176314901 1048647944 /nfs/dbraw/zinc/64/79/44/1048647944.db2.gz FPZCCPSHFPQPJQ-LJQANCHMSA-N 1 2 322.412 4.491 20 0 DIADLO Cc1cc(C[NH2+][C@H](CO)c2cccc(Cl)c2Cl)c(C)o1 ZINC000850402803 1048648271 /nfs/dbraw/zinc/64/82/71/1048648271.db2.gz XNTXVBUPIVZPTQ-CQSZACIVSA-N 1 2 314.212 4.026 20 0 DIADLO Cc1[nH+]cc(NC(=O)Nc2ccccc2-c2ccccc2)n1C ZINC001189699920 1048652959 /nfs/dbraw/zinc/65/29/59/1048652959.db2.gz WZICYOIGZXAPTA-UHFFFAOYSA-N 1 2 306.369 4.040 20 0 DIADLO CCc1ccc(C[N@@H+]2CCSC[C@@H]2c2ccc(F)cc2)o1 ZINC001204392658 1048655462 /nfs/dbraw/zinc/65/54/62/1048655462.db2.gz IRHVETRNJAGHQD-QGZVFWFLSA-N 1 2 305.418 4.271 20 0 DIADLO CCc1ccc(C[N@H+]2CCSC[C@@H]2c2ccc(F)cc2)o1 ZINC001204392658 1048655469 /nfs/dbraw/zinc/65/54/69/1048655469.db2.gz IRHVETRNJAGHQD-QGZVFWFLSA-N 1 2 305.418 4.271 20 0 DIADLO CCCC[N@H+](Cc1csnc1OC)Cc1c(C)oc(C)c1C ZINC001176365286 1048661566 /nfs/dbraw/zinc/66/15/66/1048661566.db2.gz OAQZQQYWXJWUBI-UHFFFAOYSA-N 1 2 322.474 4.472 20 0 DIADLO CCCC[N@@H+](Cc1csnc1OC)Cc1c(C)oc(C)c1C ZINC001176365286 1048661586 /nfs/dbraw/zinc/66/15/86/1048661586.db2.gz OAQZQQYWXJWUBI-UHFFFAOYSA-N 1 2 322.474 4.472 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@H]3CCCC34CC4)cc2)C[C@@H](C)O1 ZINC000850458795 1048663190 /nfs/dbraw/zinc/66/31/90/1048663190.db2.gz PWVDKLGEDZVEJW-RKVPGOIHSA-N 1 2 300.446 4.045 20 0 DIADLO CC(C)c1nnc2n1CC[N@@H+](CC[C@H]1C[C@H](C)C[C@H](C)C1)[C@@H]2C ZINC001176373001 1048665097 /nfs/dbraw/zinc/66/50/97/1048665097.db2.gz LPEZGRLRFFLNHT-TWMKSMIVSA-N 1 2 318.509 4.241 20 0 DIADLO CC(C)c1nnc2n1CC[N@H+](CC[C@H]1C[C@H](C)C[C@H](C)C1)[C@@H]2C ZINC001176373001 1048665105 /nfs/dbraw/zinc/66/51/05/1048665105.db2.gz LPEZGRLRFFLNHT-TWMKSMIVSA-N 1 2 318.509 4.241 20 0 DIADLO CCOc1cc[nH+]cc1Nc1ccc(Oc2ccccc2)nc1 ZINC001176374290 1048665640 /nfs/dbraw/zinc/66/56/40/1048665640.db2.gz RGZQVLIAOKURFI-UHFFFAOYSA-N 1 2 307.353 4.411 20 0 DIADLO Fc1ccc(C[NH+]2CCC(CC(F)(F)F)CC2)c(F)c1F ZINC000668115038 1048671407 /nfs/dbraw/zinc/67/14/07/1048671407.db2.gz NPFUNRCWCPEKAL-UHFFFAOYSA-N 1 2 311.269 4.268 20 0 DIADLO Clc1ccsc1C[NH2+]Cc1nc2ccccc2n1C1CC1 ZINC000194485110 1048674012 /nfs/dbraw/zinc/67/40/12/1048674012.db2.gz ILMOBPATCPGFAI-UHFFFAOYSA-N 1 2 317.845 4.376 20 0 DIADLO Cc1cc(N)nc(SC[C@H](C)CSc2ccccc2C)[nH+]1 ZINC001165289262 1048674268 /nfs/dbraw/zinc/67/42/68/1048674268.db2.gz VDQRERFHIGMRRA-LLVKDONJSA-N 1 2 319.499 4.196 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2C[C@@H](O)c3ccccc32)cs1 ZINC000850527609 1048681357 /nfs/dbraw/zinc/68/13/57/1048681357.db2.gz HBQWKXAQOIHCQZ-HZUKXOBISA-N 1 2 302.443 4.096 20 0 DIADLO CC(C)(C)c1cccc(NC(=O)c2ccccc2-n2cc[nH+]c2)c1 ZINC001190097718 1048694830 /nfs/dbraw/zinc/69/48/30/1048694830.db2.gz QIJHBXWSUJTSOO-UHFFFAOYSA-N 1 2 319.408 4.422 20 0 DIADLO Cc1ccc2[nH+]c(CSC[C@H]3CC3(Cl)Cl)cn2c1 ZINC001165544600 1048696714 /nfs/dbraw/zinc/69/67/14/1048696714.db2.gz BUBCJUOBOFMJRG-SNVBAGLBSA-N 1 2 301.242 4.070 20 0 DIADLO COc1cc(Cl)ccc1NCc1cc(-n2cc[nH+]c2)cs1 ZINC000775352246 1048699037 /nfs/dbraw/zinc/69/90/37/1048699037.db2.gz QOXSPWMFWBPPIB-UHFFFAOYSA-N 1 2 319.817 4.208 20 0 DIADLO COCc1cc([C@@H](C)[NH2+]CC(F)(F)C(C)(C)C)ccc1OC ZINC000850573225 1048699489 /nfs/dbraw/zinc/69/94/89/1048699489.db2.gz XEGJVLVTQUBNPT-GFCCVEGCSA-N 1 2 315.404 4.174 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NC1CCC(C(F)(F)F)CC1 ZINC001165648364 1048705195 /nfs/dbraw/zinc/70/51/95/1048705195.db2.gz ZCKKIVIIEHWDJV-UHFFFAOYSA-N 1 2 302.340 4.402 20 0 DIADLO Fc1cccc(-c2nc(C[N@@H+]3CC[C@@H]3c3ccccc3)co2)c1 ZINC000482951348 1048706639 /nfs/dbraw/zinc/70/66/39/1048706639.db2.gz WPNXASIECBILPD-GOSISDBHSA-N 1 2 308.356 4.428 20 0 DIADLO Fc1cccc(-c2nc(C[N@H+]3CC[C@@H]3c3ccccc3)co2)c1 ZINC000482951348 1048706647 /nfs/dbraw/zinc/70/66/47/1048706647.db2.gz WPNXASIECBILPD-GOSISDBHSA-N 1 2 308.356 4.428 20 0 DIADLO c1ccc2c(c1)cc[nH+]c2N1C[C@H]2[C@@H](C1)CCC[C@H]2OCC1CC1 ZINC001166112814 1048736885 /nfs/dbraw/zinc/73/68/85/1048736885.db2.gz COPGVDZPHLTKPJ-YZGWKJHDSA-N 1 2 322.452 4.266 20 0 DIADLO CC(C)C[C@H](C(=O)Nc1ccc(C(F)F)cc1)n1cc[nH+]c1 ZINC000885584976 1048742126 /nfs/dbraw/zinc/74/21/26/1048742126.db2.gz WRAAPESODOFLCD-CQSZACIVSA-N 1 2 307.344 4.047 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@@H]2c2cccs2)o1 ZINC000483142352 1048745894 /nfs/dbraw/zinc/74/58/94/1048745894.db2.gz JAIGFIVRYRNLLI-LLVKDONJSA-N 1 2 312.232 4.441 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@@H]2c2cccs2)o1 ZINC000483142352 1048745916 /nfs/dbraw/zinc/74/59/16/1048745916.db2.gz JAIGFIVRYRNLLI-LLVKDONJSA-N 1 2 312.232 4.441 20 0 DIADLO CC[C@](C)([NH2+]Cc1noc(-c2ccccc2C)n1)c1ccccc1 ZINC000775392791 1048747998 /nfs/dbraw/zinc/74/79/98/1048747998.db2.gz CVPAAVGLSIHPIO-FQEVSTJZSA-N 1 2 321.424 4.460 20 0 DIADLO CCN(C)c1ccc(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)cn1 ZINC000483172975 1048748797 /nfs/dbraw/zinc/74/87/97/1048748797.db2.gz MFRYDRIRCYVNSS-ZDUSSCGKSA-N 1 2 319.399 4.009 20 0 DIADLO CCN(C)c1ccc(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)cn1 ZINC000483172975 1048748805 /nfs/dbraw/zinc/74/88/05/1048748805.db2.gz MFRYDRIRCYVNSS-ZDUSSCGKSA-N 1 2 319.399 4.009 20 0 DIADLO C[C@@H]([NH2+]CC=C(Cl)Cl)c1nc(C(F)(F)F)cs1 ZINC000851993652 1048815382 /nfs/dbraw/zinc/81/53/82/1048815382.db2.gz KHAARUWJRGRRJV-RXMQYKEDSA-N 1 2 305.152 4.132 20 0 DIADLO COC(=O)c1ccc(-c2ccc(N(C)C(C)(C)C)[nH+]c2C)cc1 ZINC001166527723 1048756782 /nfs/dbraw/zinc/75/67/82/1048756782.db2.gz XPQSWLKYPNKXSO-UHFFFAOYSA-N 1 2 312.413 4.078 20 0 DIADLO c1c[nH+]c(Nc2ccc(-c3ccncc3)cc2)c(N2CCCC2)c1 ZINC001176695622 1048760710 /nfs/dbraw/zinc/76/07/10/1048760710.db2.gz IJOLLBVMISRHKG-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+](CCCC)[C@H](C)c1ccc(C)o1 ZINC001190588818 1048761003 /nfs/dbraw/zinc/76/10/03/1048761003.db2.gz FYIYQVNSJBUQDT-CVEARBPZSA-N 1 2 309.450 4.483 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+](CCCC)[C@H](C)c1ccc(C)o1 ZINC001190588818 1048761012 /nfs/dbraw/zinc/76/10/12/1048761012.db2.gz FYIYQVNSJBUQDT-CVEARBPZSA-N 1 2 309.450 4.483 20 0 DIADLO C[C@H]1CCC(=O)C[N@@H+]1CCCCc1ccc(Cl)c(Cl)c1 ZINC001176735094 1048775548 /nfs/dbraw/zinc/77/55/48/1048775548.db2.gz MDDKOQVYNRFGQH-LBPRGKRZSA-N 1 2 314.256 4.370 20 0 DIADLO C[C@H]1CCC(=O)C[N@H+]1CCCCc1ccc(Cl)c(Cl)c1 ZINC001176735094 1048775562 /nfs/dbraw/zinc/77/55/62/1048775562.db2.gz MDDKOQVYNRFGQH-LBPRGKRZSA-N 1 2 314.256 4.370 20 0 DIADLO Clc1cc(Nc2ccc[nH+]c2N2CCCC2)cc(Cl)n1 ZINC001176742911 1048776163 /nfs/dbraw/zinc/77/61/63/1048776163.db2.gz CBLWDILGSVREEW-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO Cc1ccc2cc(Nc3ccc[nH+]c3N3CCCC3)ccc2n1 ZINC001176751071 1048777301 /nfs/dbraw/zinc/77/73/01/1048777301.db2.gz VWHIFDRYSJHZQD-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO Clc1ccc(Cl)c(Nc2ccc[nH+]c2N2CCCC2)n1 ZINC001176749951 1048777986 /nfs/dbraw/zinc/77/79/86/1048777986.db2.gz OZIAENLTYGXXQX-UHFFFAOYSA-N 1 2 309.200 4.127 20 0 DIADLO c1ccc(N2CCCCC2)c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001176751219 1048778759 /nfs/dbraw/zinc/77/87/59/1048778759.db2.gz ZFTSKORYRYMXHF-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO Fc1cccc2ncc(Nc3ccc[nH+]c3N3CCCC3)cc12 ZINC001176749880 1048778898 /nfs/dbraw/zinc/77/88/98/1048778898.db2.gz MOZSWSGUMGGSGH-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO Cc1cc(N(C)Cc2cccc3cccnc32)nc(C(C)(C)C)[nH+]1 ZINC001166687834 1048783761 /nfs/dbraw/zinc/78/37/61/1048783761.db2.gz CFLQVQMDMYTNNK-UHFFFAOYSA-N 1 2 320.440 4.267 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](CCc3ccccc3)CCO2)cc1Cl ZINC001190781792 1048786327 /nfs/dbraw/zinc/78/63/27/1048786327.db2.gz YTYJUGSQPOJXMY-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](CCc3ccccc3)CCO2)cc1Cl ZINC001190781792 1048786339 /nfs/dbraw/zinc/78/63/39/1048786339.db2.gz YTYJUGSQPOJXMY-GOSISDBHSA-N 1 2 319.807 4.095 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@H+](C)Cc2ccsc2)cc1 ZINC000007926841 1048788777 /nfs/dbraw/zinc/78/87/77/1048788777.db2.gz ZXIMDPNPCRQWGF-AWEZNQCLSA-N 1 2 316.470 4.332 20 0 DIADLO CC[C@H](C)c1ccc(NC(=O)C[N@@H+](C)Cc2ccsc2)cc1 ZINC000007926841 1048788789 /nfs/dbraw/zinc/78/87/89/1048788789.db2.gz ZXIMDPNPCRQWGF-AWEZNQCLSA-N 1 2 316.470 4.332 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2cccc(F)n2)C2CC2)o1 ZINC000851711800 1048794785 /nfs/dbraw/zinc/79/47/85/1048794785.db2.gz GIGFZIUAEAXHMD-MLGOLLRUSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cccc(F)n2)C2CC2)o1 ZINC000851711800 1048794796 /nfs/dbraw/zinc/79/47/96/1048794796.db2.gz GIGFZIUAEAXHMD-MLGOLLRUSA-N 1 2 300.377 4.102 20 0 DIADLO CCC1CC[NH+](Cc2noc(-c3c(F)cccc3Cl)n2)CC1 ZINC001190864158 1048796047 /nfs/dbraw/zinc/79/60/47/1048796047.db2.gz DKBLLZLDIYAECI-UHFFFAOYSA-N 1 2 323.799 4.151 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ccc(Cl)nc2)c1Cl ZINC000851800284 1048800703 /nfs/dbraw/zinc/80/07/03/1048800703.db2.gz XMWOOSIAOGPVRK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ccc(Cl)nc2)c1Cl ZINC000851800284 1048800730 /nfs/dbraw/zinc/80/07/30/1048800730.db2.gz XMWOOSIAOGPVRK-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2ncsc2Br)s1 ZINC000851928802 1048812722 /nfs/dbraw/zinc/81/27/22/1048812722.db2.gz QMGGZCPNYNPNHS-QMMMGPOBSA-N 1 2 317.277 4.126 20 0 DIADLO C[C@@H](c1nc2cc(Cl)ccc2[nH]1)[N@H+](C)Cc1ccsc1 ZINC000852126785 1048827663 /nfs/dbraw/zinc/82/76/63/1048827663.db2.gz HLGXDNYAENKMTD-JTQLQIEISA-N 1 2 305.834 4.471 20 0 DIADLO C[C@@H](c1nc2cc(Cl)ccc2[nH]1)[N@@H+](C)Cc1ccsc1 ZINC000852126785 1048827673 /nfs/dbraw/zinc/82/76/73/1048827673.db2.gz HLGXDNYAENKMTD-JTQLQIEISA-N 1 2 305.834 4.471 20 0 DIADLO CCOC(=O)CCc1ccc[nH+]c1NCc1ccccc1C1CC1 ZINC001167013019 1048830137 /nfs/dbraw/zinc/83/01/37/1048830137.db2.gz RZSSPKADDLSPCS-UHFFFAOYSA-N 1 2 324.424 4.067 20 0 DIADLO CC(C)c1cnc(C[NH2+]Cc2ccccc2OC(F)F)s1 ZINC001177166250 1048834209 /nfs/dbraw/zinc/83/42/09/1048834209.db2.gz MCJCPWZTHZGVMH-UHFFFAOYSA-N 1 2 312.385 4.158 20 0 DIADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1nc3ccccc3o1)CCS2 ZINC001177158059 1048841385 /nfs/dbraw/zinc/84/13/85/1048841385.db2.gz QXABBVXHTNURHQ-CYBMUJFWSA-N 1 2 314.385 4.294 20 0 DIADLO CC(C)c1cnc(C[NH+]2CCC3(C=Cc4ccccc4O3)CC2)o1 ZINC000852729500 1048856398 /nfs/dbraw/zinc/85/63/98/1048856398.db2.gz HKHACJZQOZCHSS-UHFFFAOYSA-N 1 2 324.424 4.238 20 0 DIADLO Cc1nc(C[NH2+][C@]2(c3ccccc3)CC2(C)C)nc2ccccc12 ZINC000852771278 1048858712 /nfs/dbraw/zinc/85/87/12/1048858712.db2.gz CXCDBBXTZVZNEN-NRFANRHFSA-N 1 2 317.436 4.353 20 0 DIADLO Cc1ccc(C[N@H+](CC(=O)c2ccccc2F)C2CC2)cc1C ZINC001191165442 1048873318 /nfs/dbraw/zinc/87/33/18/1048873318.db2.gz VYSISZMWIMOZQN-UHFFFAOYSA-N 1 2 311.400 4.290 20 0 DIADLO Cc1ccc(C[N@@H+](CC(=O)c2ccccc2F)C2CC2)cc1C ZINC001191165442 1048873330 /nfs/dbraw/zinc/87/33/30/1048873330.db2.gz VYSISZMWIMOZQN-UHFFFAOYSA-N 1 2 311.400 4.290 20 0 DIADLO Fc1c(F)c(F)c(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)c(F)c1F ZINC001203360661 1048880670 /nfs/dbraw/zinc/88/06/70/1048880670.db2.gz GNRZMIDIOGOADT-DTORHVGOSA-N 1 2 305.290 4.004 20 0 DIADLO Fc1c(F)c(F)c(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)c(F)c1F ZINC001203360661 1048880687 /nfs/dbraw/zinc/88/06/87/1048880687.db2.gz GNRZMIDIOGOADT-DTORHVGOSA-N 1 2 305.290 4.004 20 0 DIADLO CC(C)c1cccc(CNc2ccc([NH+]3CCC(O)CC3)cc2)c1 ZINC000853085033 1048880822 /nfs/dbraw/zinc/88/08/22/1048880822.db2.gz RVWMBXZMRUDQLH-UHFFFAOYSA-N 1 2 324.468 4.383 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(OC(F)(F)F)cc1Cl ZINC000853094747 1048882426 /nfs/dbraw/zinc/88/24/26/1048882426.db2.gz MKCVHIHYUNTFON-UHFFFAOYSA-N 1 2 319.714 4.067 20 0 DIADLO COc1ccc(Cn2nc(C)cc2Nc2ccc(C)[nH+]c2C)cc1 ZINC001203369847 1048883766 /nfs/dbraw/zinc/88/37/66/1048883766.db2.gz UCVOULUBERYOPL-UHFFFAOYSA-N 1 2 322.412 4.004 20 0 DIADLO Cc1ccc(Nc2nc(C)c(C)cc2Br)c(C)[nH+]1 ZINC001203369830 1048884061 /nfs/dbraw/zinc/88/40/61/1048884061.db2.gz CQBOLIIGMHOYLY-UHFFFAOYSA-N 1 2 306.207 4.216 20 0 DIADLO Cc1ccc(Nc2c(Cl)c(F)nc(F)c2Cl)c(C)[nH+]1 ZINC001203367583 1048884352 /nfs/dbraw/zinc/88/43/52/1048884352.db2.gz MSAKBLGFAKUQQX-UHFFFAOYSA-N 1 2 304.127 4.422 20 0 DIADLO Cc1cc(C[NH2+]Cc2cccc(Oc3ccc(F)cc3)c2)no1 ZINC001177454643 1048886912 /nfs/dbraw/zinc/88/69/12/1048886912.db2.gz UXHQAOSHSPQRAA-UHFFFAOYSA-N 1 2 312.344 4.204 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1csc(-c3ccoc3)n1)C2 ZINC000483971303 1048887321 /nfs/dbraw/zinc/88/73/21/1048887321.db2.gz FDCMFJVLXLXVMJ-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1csc(-c3ccoc3)n1)C2 ZINC000483971303 1048887341 /nfs/dbraw/zinc/88/73/41/1048887341.db2.gz FDCMFJVLXLXVMJ-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(Cl)c2)C[N@@H+]1Cc1cccs1 ZINC000483975576 1048890405 /nfs/dbraw/zinc/89/04/05/1048890405.db2.gz GZDPKILUUSRVMO-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@H](c2cccc(Cl)c2)C[N@H+]1Cc1cccs1 ZINC000483975576 1048890421 /nfs/dbraw/zinc/89/04/21/1048890421.db2.gz GZDPKILUUSRVMO-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1ncc(-c3cccc(F)c3)o1)C2 ZINC000483988238 1048890951 /nfs/dbraw/zinc/89/09/51/1048890951.db2.gz QVUWCIMWPHDTAY-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1ncc(-c3cccc(F)c3)o1)C2 ZINC000483988238 1048890960 /nfs/dbraw/zinc/89/09/60/1048890960.db2.gz QVUWCIMWPHDTAY-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1coc(-c3cccs3)n1)C2 ZINC000483995572 1048892201 /nfs/dbraw/zinc/89/22/01/1048892201.db2.gz UCRGTIXLRIDZKR-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1coc(-c3cccs3)n1)C2 ZINC000483995572 1048892212 /nfs/dbraw/zinc/89/22/12/1048892212.db2.gz UCRGTIXLRIDZKR-UHFFFAOYSA-N 1 2 310.422 4.270 20 0 DIADLO CCC[C@]1(C)CCC[N@@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191254726 1048896680 /nfs/dbraw/zinc/89/66/80/1048896680.db2.gz BMVMSINBWHDFIX-SJLPKXTDSA-N 1 2 323.864 4.456 20 0 DIADLO CCC[C@]1(C)CCC[N@H+]([C@@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191254726 1048896708 /nfs/dbraw/zinc/89/67/08/1048896708.db2.gz BMVMSINBWHDFIX-SJLPKXTDSA-N 1 2 323.864 4.456 20 0 DIADLO COc1ccccc1C[N@H+](Cc1cc(C)no1)Cc1ccccc1 ZINC001203437471 1048901260 /nfs/dbraw/zinc/90/12/60/1048901260.db2.gz BZOABFYAJJOVJC-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1cc(C)no1)Cc1ccccc1 ZINC001203437471 1048901274 /nfs/dbraw/zinc/90/12/74/1048901274.db2.gz BZOABFYAJJOVJC-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO CNc1ccc(Nc2ccccc2C(=O)Nc2ccccc2)c[nH+]1 ZINC001203455589 1048905622 /nfs/dbraw/zinc/90/56/22/1048905622.db2.gz VEXJSJQMAYUMBD-UHFFFAOYSA-N 1 2 318.380 4.119 20 0 DIADLO CNc1ccc(N(Cc2ccccc2)c2ccccc2N)c[nH+]1 ZINC001203458371 1048906225 /nfs/dbraw/zinc/90/62/25/1048906225.db2.gz MASVTDCFEDARQR-UHFFFAOYSA-N 1 2 304.397 4.044 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1ccc(C(C)(C)O)cc1 ZINC001203464807 1048908154 /nfs/dbraw/zinc/90/81/54/1048908154.db2.gz RQBTYDAZGYSWGO-UHFFFAOYSA-N 1 2 316.470 4.174 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3ccnc(Cl)c3)CC2)cn1 ZINC000773671683 1048909872 /nfs/dbraw/zinc/90/98/72/1048909872.db2.gz YRYPQEXFZSXDCZ-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3ccnc(Cl)c3)CC2)cn1 ZINC000773671683 1048909888 /nfs/dbraw/zinc/90/98/88/1048909888.db2.gz YRYPQEXFZSXDCZ-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1nc2ccccc2s1 ZINC000111405402 1048910935 /nfs/dbraw/zinc/91/09/35/1048910935.db2.gz AINRBOVLEBAQPY-SNVBAGLBSA-N 1 2 304.365 4.425 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2cccc(O)c2)c[nH+]1 ZINC001203515372 1048917199 /nfs/dbraw/zinc/91/71/99/1048917199.db2.gz JQSWKGLHNYZWFI-UHFFFAOYSA-N 1 2 305.381 4.167 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2ccccc2O)c[nH+]1 ZINC001203518888 1048918024 /nfs/dbraw/zinc/91/80/24/1048918024.db2.gz SQTYJSDGNKDFJB-UHFFFAOYSA-N 1 2 305.381 4.167 20 0 DIADLO COc1cccc2[nH]c(NCc3cc(C(C)(C)C)oc3C)[nH+]c21 ZINC001203547074 1048923238 /nfs/dbraw/zinc/92/32/38/1048923238.db2.gz DAUDYMHYORTUKG-UHFFFAOYSA-N 1 2 313.401 4.383 20 0 DIADLO COc1ccc(OC)c([C@H](C)[NH2+]Cc2c(F)cccc2Cl)c1 ZINC000194809217 1048926087 /nfs/dbraw/zinc/92/60/87/1048926087.db2.gz SGSYMEBHYAYYSS-NSHDSACASA-N 1 2 323.795 4.347 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cc(Br)cnc2Cl)c1 ZINC001203656225 1048950770 /nfs/dbraw/zinc/95/07/70/1048950770.db2.gz MXNMKZJOALZSMI-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO CC(C)(C)c1cnc(C[N@@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)o1 ZINC000484360401 1048927569 /nfs/dbraw/zinc/92/75/69/1048927569.db2.gz YVAPEQGKHXZZMP-NSHDSACASA-N 1 2 318.383 4.383 20 0 DIADLO CC(C)(C)c1cnc(C[N@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)o1 ZINC000484360401 1048927579 /nfs/dbraw/zinc/92/75/79/1048927579.db2.gz YVAPEQGKHXZZMP-NSHDSACASA-N 1 2 318.383 4.383 20 0 DIADLO CN(C)c1ccc(Nc2cncc(Oc3ccccc3)c2)c[nH+]1 ZINC001203557428 1048929152 /nfs/dbraw/zinc/92/91/52/1048929152.db2.gz XVPFGFNYSRSSOB-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO CCc1ccc([C@H]2C[N@H+](CCCCC(F)(F)F)CCO2)cc1 ZINC000484351920 1048930077 /nfs/dbraw/zinc/93/00/77/1048930077.db2.gz AVNLUJGIHMKVLL-MRXNPFEDSA-N 1 2 315.379 4.355 20 0 DIADLO CCc1ccc([C@H]2C[N@@H+](CCCCC(F)(F)F)CCO2)cc1 ZINC000484351920 1048930087 /nfs/dbraw/zinc/93/00/87/1048930087.db2.gz AVNLUJGIHMKVLL-MRXNPFEDSA-N 1 2 315.379 4.355 20 0 DIADLO CCOc1c(Cl)cccc1C[NH2+]Cc1noc2ccccc12 ZINC001203650849 1048948531 /nfs/dbraw/zinc/94/85/31/1048948531.db2.gz ADHPMYQINXEHLJ-UHFFFAOYSA-N 1 2 316.788 4.170 20 0 DIADLO O[C@@H](c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1)C1CCC1 ZINC000854203021 1048950419 /nfs/dbraw/zinc/95/04/19/1048950419.db2.gz NBZDKGDJUZDWKJ-OAQYLSRUSA-N 1 2 318.420 4.432 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cc(F)ccc2OC[C@@H]2CCCO2)c1 ZINC001203663893 1048954491 /nfs/dbraw/zinc/95/44/91/1048954491.db2.gz YDRYCANUYBAYIP-HNNXBMFYSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(OC[C@@H]3CCCO3)c(F)c2)c1 ZINC001203663643 1048954738 /nfs/dbraw/zinc/95/47/38/1048954738.db2.gz VFQUBAZUSKXSTO-HNNXBMFYSA-N 1 2 316.376 4.139 20 0 DIADLO CCc1ncc(Br)cc1Nc1cc(C)c[nH+]c1C ZINC001203661224 1048955074 /nfs/dbraw/zinc/95/50/74/1048955074.db2.gz SOIBSWUQIMNFNJ-UHFFFAOYSA-N 1 2 306.207 4.162 20 0 DIADLO CCOC(=O)c1cnc2cc(Nc3cc(C)c[nH+]c3C)ccc2c1 ZINC001203667158 1048955478 /nfs/dbraw/zinc/95/54/78/1048955478.db2.gz JQFUJLGBFCQHJG-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccc(OC3CCOCC3)c(F)c2)c1 ZINC001203663514 1048955725 /nfs/dbraw/zinc/95/57/25/1048955725.db2.gz NOUFMQFTFFCEON-UHFFFAOYSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ccccc2-c2nc(CO)cs2)c1 ZINC001203667468 1048957403 /nfs/dbraw/zinc/95/74/03/1048957403.db2.gz MFNZJVAQIYZCSA-UHFFFAOYSA-N 1 2 311.410 4.058 20 0 DIADLO COc1cncc(CNc2ccc3[nH+]c(C)cc(C)c3c2)c1C ZINC001203675800 1048958944 /nfs/dbraw/zinc/95/89/44/1048958944.db2.gz AOHCEAQFTZXKQR-UHFFFAOYSA-N 1 2 307.397 4.176 20 0 DIADLO Cc1ccccc1-c1cccc(NC(=O)[C@@H](C)n2cc[nH+]c2)c1 ZINC001177926092 1048961831 /nfs/dbraw/zinc/96/18/31/1048961831.db2.gz DAWMTAGDVJAKGQ-OAHLLOKOSA-N 1 2 305.381 4.058 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1CCOC2(C1)CCCCCC2 ZINC001191549631 1048963063 /nfs/dbraw/zinc/96/30/63/1048963063.db2.gz FUJMORCKKPIPKW-CQSZACIVSA-N 1 2 309.400 4.451 20 0 DIADLO C[C@H](c1ccc(F)cc1F)[N@H+]1CCOC2(C1)CCCCCC2 ZINC001191549631 1048963074 /nfs/dbraw/zinc/96/30/74/1048963074.db2.gz FUJMORCKKPIPKW-CQSZACIVSA-N 1 2 309.400 4.451 20 0 DIADLO O=C1CC[N@@H+](Cc2ccccc2C(F)(F)F)[C@H]2CCCC[C@@H]12 ZINC001203684411 1048963262 /nfs/dbraw/zinc/96/32/62/1048963262.db2.gz VDQPPUADTSRELD-HIFRSBDPSA-N 1 2 311.347 4.039 20 0 DIADLO O=C1CC[N@H+](Cc2ccccc2C(F)(F)F)[C@H]2CCCC[C@@H]12 ZINC001203684411 1048963266 /nfs/dbraw/zinc/96/32/66/1048963266.db2.gz VDQPPUADTSRELD-HIFRSBDPSA-N 1 2 311.347 4.039 20 0 DIADLO Cc1nc2c(s1)C[N@H+](Cc1ccccc1C(F)(F)F)CC2 ZINC001203693469 1048965173 /nfs/dbraw/zinc/96/51/73/1048965173.db2.gz ZFRUPPAZABVKGA-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1nc2c(s1)C[N@@H+](Cc1ccccc1C(F)(F)F)CC2 ZINC001203693469 1048965188 /nfs/dbraw/zinc/96/51/88/1048965188.db2.gz ZFRUPPAZABVKGA-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1ncc(Br)s1 ZINC001191790130 1049000342 /nfs/dbraw/zinc/00/03/42/1049000342.db2.gz UKXONLFOACDQAT-GHMZBOCLSA-N 1 2 317.296 4.306 20 0 DIADLO Cc1cccc(C[NH2+]Cc2csc(-c3ccco3)n2)c1F ZINC001177999708 1048969647 /nfs/dbraw/zinc/96/96/47/1048969647.db2.gz MIGSCKUMNOWOML-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO Fc1cc(F)c(F)c(C[NH2+]Cc2ccc(Cl)s2)c1F ZINC001177954634 1048969875 /nfs/dbraw/zinc/96/98/75/1048969875.db2.gz IMFTVSMRVRZXJQ-UHFFFAOYSA-N 1 2 309.715 4.248 20 0 DIADLO Cc1ccccc1C[N@@H+]1Cc2cnc(-c3ccc(F)cc3)nc2C1 ZINC001203708413 1048970936 /nfs/dbraw/zinc/97/09/36/1048970936.db2.gz HJHRNIIDDQVJCC-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO Cc1ccccc1C[N@H+]1Cc2cnc(-c3ccc(F)cc3)nc2C1 ZINC001203708413 1048970937 /nfs/dbraw/zinc/97/09/37/1048970937.db2.gz HJHRNIIDDQVJCC-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO CC(C)(C)c1nnc(Nc2ccc([NH+]3CCCCC3)cc2)o1 ZINC001203712715 1048972536 /nfs/dbraw/zinc/97/25/36/1048972536.db2.gz NBGHHTZSKXLBKA-UHFFFAOYSA-N 1 2 300.406 4.101 20 0 DIADLO Cc1ccc(C[NH2+]Cc2nc3ccccc3o2)c(OC(C)C)c1 ZINC001178000129 1048972931 /nfs/dbraw/zinc/97/29/31/1048972931.db2.gz YCQJPAYZOCSHFQ-UHFFFAOYSA-N 1 2 310.397 4.213 20 0 DIADLO FC(F)Oc1cncc(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001203718656 1048975453 /nfs/dbraw/zinc/97/54/53/1048975453.db2.gz JLSZECMIUDPXMS-UHFFFAOYSA-N 1 2 319.355 4.417 20 0 DIADLO c1ccc([N@H+](CC2CCC3(CC2)OCCO3)C2CCCC2)cc1 ZINC001191682131 1048975338 /nfs/dbraw/zinc/97/53/38/1048975338.db2.gz MQRQSGAPCRMVBF-UHFFFAOYSA-N 1 2 315.457 4.369 20 0 DIADLO c1ccc([N@@H+](CC2CCC3(CC2)OCCO3)C2CCCC2)cc1 ZINC001191682131 1048975352 /nfs/dbraw/zinc/97/53/52/1048975352.db2.gz MQRQSGAPCRMVBF-UHFFFAOYSA-N 1 2 315.457 4.369 20 0 DIADLO Cn1c2ccccc2nc1[C@H]1CCCC[N@@H+]1Cc1ccc(F)cc1 ZINC001191682317 1048975794 /nfs/dbraw/zinc/97/57/94/1048975794.db2.gz PLQGULLPEHVOLG-LJQANCHMSA-N 1 2 323.415 4.440 20 0 DIADLO Cn1c2ccccc2nc1[C@H]1CCCC[N@H+]1Cc1ccc(F)cc1 ZINC001191682317 1048975804 /nfs/dbraw/zinc/97/58/04/1048975804.db2.gz PLQGULLPEHVOLG-LJQANCHMSA-N 1 2 323.415 4.440 20 0 DIADLO COC(=O)Cc1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1 ZINC001203719254 1048976312 /nfs/dbraw/zinc/97/63/12/1048976312.db2.gz LVFFUSIWAGQCTI-UHFFFAOYSA-N 1 2 324.424 4.136 20 0 DIADLO Cn1nc(C2CCC2)cc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718697 1048976677 /nfs/dbraw/zinc/97/66/77/1048976677.db2.gz LBUKTBFPHBCLQV-UHFFFAOYSA-N 1 2 310.445 4.422 20 0 DIADLO c1cc2cnncc2c(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001203719591 1048977836 /nfs/dbraw/zinc/97/78/36/1048977836.db2.gz QSQFSAZSOMVCER-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO CN1Cc2cccc(Nc3ccc([NH+]4CCCCC4)cc3)c2C1=O ZINC001203723895 1048979291 /nfs/dbraw/zinc/97/92/91/1048979291.db2.gz CBBVRUJJAWISDY-UHFFFAOYSA-N 1 2 321.424 4.006 20 0 DIADLO Nc1cccc2c1CCCN2c1ccc([NH+]2CCCCC2)cc1 ZINC001203723897 1048980163 /nfs/dbraw/zinc/98/01/63/1048980163.db2.gz CBHUSSXRQDWKJI-UHFFFAOYSA-N 1 2 307.441 4.343 20 0 DIADLO Cc1cc(CNc2cccc(NC(=O)c3ccoc3)c2)cc(C)[nH+]1 ZINC001178068035 1048981154 /nfs/dbraw/zinc/98/11/54/1048981154.db2.gz HKBBAGAMGYDLHO-UHFFFAOYSA-N 1 2 321.380 4.156 20 0 DIADLO Cn1cnc2c1cccc2Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203724225 1048982800 /nfs/dbraw/zinc/98/28/00/1048982800.db2.gz JGZYKSOSWHQHBU-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO CC(C)Oc1cccc(CNc2ccc3c(c2)CCC[N@H+]3C)c1 ZINC001178114537 1048987180 /nfs/dbraw/zinc/98/71/80/1048987180.db2.gz IWBJGUMZQSCKLS-UHFFFAOYSA-N 1 2 310.441 4.468 20 0 DIADLO CC(C)Oc1cccc(CNc2ccc3c(c2)CCC[N@@H+]3C)c1 ZINC001178114537 1048987189 /nfs/dbraw/zinc/98/71/89/1048987189.db2.gz IWBJGUMZQSCKLS-UHFFFAOYSA-N 1 2 310.441 4.468 20 0 DIADLO Cc1cc(NCC2=Cc3ccccc3OC2)ccc1-n1cc[nH+]c1 ZINC001178138680 1048990041 /nfs/dbraw/zinc/99/00/41/1048990041.db2.gz GNPCBQWYSCISRP-UHFFFAOYSA-N 1 2 317.392 4.069 20 0 DIADLO Fc1ccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c(F)c1 ZINC001204210934 1048993731 /nfs/dbraw/zinc/99/37/31/1048993731.db2.gz JYATTYIXBLGXOS-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1ccc(C[N@H+]2CCSC[C@@H]2c2ccccc2)c(F)c1 ZINC001204210934 1048993746 /nfs/dbraw/zinc/99/37/46/1048993746.db2.gz JYATTYIXBLGXOS-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO C[C@H]([NH2+]C/C=C\c1ccc(F)cc1)c1noc(-c2ccccc2)n1 ZINC001178176324 1048994360 /nfs/dbraw/zinc/99/43/60/1048994360.db2.gz KVORYSRQFJDAER-GXMNPTEKSA-N 1 2 323.371 4.240 20 0 DIADLO C[C@@H]([NH2+]C/C=C\c1ccc(F)cc1)c1noc(-c2ccccc2)n1 ZINC001178176323 1048994648 /nfs/dbraw/zinc/99/46/48/1048994648.db2.gz KVORYSRQFJDAER-GEXIGZQTSA-N 1 2 323.371 4.240 20 0 DIADLO CCSCc1cc[nH+]c(NC[C@@H]2CCOc3ccccc32)c1 ZINC001178192030 1048997705 /nfs/dbraw/zinc/99/77/05/1048997705.db2.gz PRYRATGCXAMAHA-HNNXBMFYSA-N 1 2 314.454 4.313 20 0 DIADLO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cc1ncc(Br)s1 ZINC001191790130 1049000330 /nfs/dbraw/zinc/00/03/30/1049000330.db2.gz UKXONLFOACDQAT-GHMZBOCLSA-N 1 2 317.296 4.306 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@@H](C)c1ccc(-n2cccn2)cc1 ZINC000776767264 1049003368 /nfs/dbraw/zinc/00/33/68/1049003368.db2.gz UYBZKYQXADLQFS-INIZCTEOSA-N 1 2 320.440 4.420 20 0 DIADLO CCn1c(=S)n(C[NH+]2CCC(CC)(CC)CC2)nc1C1CC1 ZINC000776771703 1049005199 /nfs/dbraw/zinc/00/51/99/1049005199.db2.gz MQGHAYRXRINHHM-UHFFFAOYSA-N 1 2 322.522 4.171 20 0 DIADLO C[C@]12CC3CC(NC(=O)c4cc5c[nH+]ccc5[nH]4)(C1)C[C@@](C)(C3)C2 ZINC001151976383 1049005669 /nfs/dbraw/zinc/00/56/69/1049005669.db2.gz MLAWLSVUHFJSSU-GOSFSIBNSA-N 1 2 323.440 4.042 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1noc([C@@H]2CCC[C@@H]2c2ccccc2)n1 ZINC000904268627 1049010048 /nfs/dbraw/zinc/01/00/48/1049010048.db2.gz XJSMHQRLGSEYHO-HUUCEWRRSA-N 1 2 320.396 4.074 20 0 DIADLO COc1cccc2c1CC[C@H]2Nc1ccc([NH+]2CCCC2)cc1 ZINC000776802454 1049023950 /nfs/dbraw/zinc/02/39/50/1049023950.db2.gz JDJVKHSPHKESPO-LJQANCHMSA-N 1 2 308.425 4.395 20 0 DIADLO CCCN(C(=O)c1cccc2[nH+]ccn21)[C@@H](CC)c1ccccc1 ZINC000776805126 1049026455 /nfs/dbraw/zinc/02/64/55/1049026455.db2.gz KWYDXKQCRXQUHS-KRWDZBQOSA-N 1 2 321.424 4.338 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2cnn(C(C)C)c2)c2ccccn2)c1 ZINC001178404600 1049035296 /nfs/dbraw/zinc/03/52/96/1049035296.db2.gz QRICQJPBOKGVHO-HXUWFJFHSA-N 1 2 320.440 4.047 20 0 DIADLO CCCOc1ccc(CNc2[nH+]cccc2OC(C)C)cc1 ZINC001178505417 1049046440 /nfs/dbraw/zinc/04/64/40/1049046440.db2.gz RXLXHGMTQMREMK-UHFFFAOYSA-N 1 2 300.402 4.270 20 0 DIADLO c1cc2n(c1)CC[N@@H+](Cc1ccc(OCc3ccccc3)cc1)C2 ZINC001203962325 1049046598 /nfs/dbraw/zinc/04/65/98/1049046598.db2.gz KYEYGEVVZSQCEJ-UHFFFAOYSA-N 1 2 318.420 4.083 20 0 DIADLO c1cc2n(c1)CC[N@H+](Cc1ccc(OCc3ccccc3)cc1)C2 ZINC001203962325 1049046609 /nfs/dbraw/zinc/04/66/09/1049046609.db2.gz KYEYGEVVZSQCEJ-UHFFFAOYSA-N 1 2 318.420 4.083 20 0 DIADLO CC(C)[N@H+](CCc1ccc(OC(F)(F)F)cc1)CC(F)F ZINC001192183752 1049057422 /nfs/dbraw/zinc/05/74/22/1049057422.db2.gz MFGZNUKQUOPVSF-UHFFFAOYSA-N 1 2 311.294 4.103 20 0 DIADLO CC(C)[N@@H+](CCc1ccc(OC(F)(F)F)cc1)CC(F)F ZINC001192183752 1049057435 /nfs/dbraw/zinc/05/74/35/1049057435.db2.gz MFGZNUKQUOPVSF-UHFFFAOYSA-N 1 2 311.294 4.103 20 0 DIADLO Clc1cnc2c(c1)C[N@@H+](Cc1ccc3ccccc3c1)CC2 ZINC001203999853 1049059113 /nfs/dbraw/zinc/05/91/13/1049059113.db2.gz POSXOLJBFYTXIX-UHFFFAOYSA-N 1 2 308.812 4.447 20 0 DIADLO Clc1cnc2c(c1)C[N@H+](Cc1ccc3ccccc3c1)CC2 ZINC001203999853 1049059122 /nfs/dbraw/zinc/05/91/22/1049059122.db2.gz POSXOLJBFYTXIX-UHFFFAOYSA-N 1 2 308.812 4.447 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccnc(Cl)c1 ZINC000776846732 1049068029 /nfs/dbraw/zinc/06/80/29/1049068029.db2.gz FYOSZJWQTHDTEP-ZDUSSCGKSA-N 1 2 316.836 4.293 20 0 DIADLO CCOc1ccc(C[NH2+]Cc2ccc(-c3ccco3)cc2F)o1 ZINC001178629690 1049069297 /nfs/dbraw/zinc/06/92/97/1049069297.db2.gz SIOICAGVRADLAJ-UHFFFAOYSA-N 1 2 315.344 4.367 20 0 DIADLO C[C@@H]([NH2+]Cc1cn(C)nc1Cl)c1cc(Cl)ccc1Cl ZINC000856768467 1049104178 /nfs/dbraw/zinc/10/41/78/1049104178.db2.gz VQMARRHDCKQCOY-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CCC[N@@H+]1Cc1ccc2c(c1)OCO2 ZINC001204053764 1049074421 /nfs/dbraw/zinc/07/44/21/1049074421.db2.gz HGIALUYHPPWWJN-HNNXBMFYSA-N 1 2 317.335 4.031 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CCC[N@H+]1Cc1ccc2c(c1)OCO2 ZINC001204053764 1049074427 /nfs/dbraw/zinc/07/44/27/1049074427.db2.gz HGIALUYHPPWWJN-HNNXBMFYSA-N 1 2 317.335 4.031 20 0 DIADLO Cc1noc(C)c1[C@H](C)[NH2+]Cc1csc(-c2ccccc2)n1 ZINC000113957416 1049078332 /nfs/dbraw/zinc/07/83/32/1049078332.db2.gz PGADETIYOJHISR-NSHDSACASA-N 1 2 313.426 4.266 20 0 DIADLO Clc1cccc([C@H]2CSCC[N@@H+]2Cc2ccncc2)c1 ZINC001204080843 1049078786 /nfs/dbraw/zinc/07/87/86/1049078786.db2.gz ZAZJXNIPZZRUOT-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cccc([C@H]2CSCC[N@H+]2Cc2ccncc2)c1 ZINC001204080843 1049078797 /nfs/dbraw/zinc/07/87/97/1049078797.db2.gz ZAZJXNIPZZRUOT-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NC/C=C/c1cccc(F)c1 ZINC001204079960 1049079918 /nfs/dbraw/zinc/07/99/18/1049079918.db2.gz VYMRJQOUUNIYGC-HWKANZROSA-N 1 2 315.779 4.491 20 0 DIADLO COc1nc2ccccc2cc1C[N@@H+]1CC[C@H]1c1cccc(F)c1 ZINC001204163899 1049100810 /nfs/dbraw/zinc/10/08/10/1049100810.db2.gz VFSBWXKSPNGOGV-IBGZPJMESA-N 1 2 322.383 4.330 20 0 DIADLO COc1nc2ccccc2cc1C[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC001204163899 1049100814 /nfs/dbraw/zinc/10/08/14/1049100814.db2.gz VFSBWXKSPNGOGV-IBGZPJMESA-N 1 2 322.383 4.330 20 0 DIADLO Cc1ccc(N2CC[NH+](Cc3cccc(Cl)c3F)CC2)cc1 ZINC001192452407 1049107771 /nfs/dbraw/zinc/10/77/71/1049107771.db2.gz KYPVQULKSHPBMG-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO Cc1ccc([C@]2(C)C[N@H+](Cc3ccc(F)c(F)c3)CCO2)cc1 ZINC001204226537 1049113888 /nfs/dbraw/zinc/11/38/88/1049113888.db2.gz BUGQRBPHWQEYGN-IBGZPJMESA-N 1 2 317.379 4.021 20 0 DIADLO Cc1ccc([C@]2(C)C[N@@H+](Cc3ccc(F)c(F)c3)CCO2)cc1 ZINC001204226537 1049113894 /nfs/dbraw/zinc/11/38/94/1049113894.db2.gz BUGQRBPHWQEYGN-IBGZPJMESA-N 1 2 317.379 4.021 20 0 DIADLO CCn1ccc(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)o2)n1 ZINC001178958464 1049114450 /nfs/dbraw/zinc/11/44/50/1049114450.db2.gz MCPIVKGIDVDYGJ-UHFFFAOYSA-N 1 2 315.804 4.106 20 0 DIADLO Cc1cc(C)cc(-c2ccc(CNc3cc(CO)cc[nH+]3)cc2)c1 ZINC001178992452 1049118891 /nfs/dbraw/zinc/11/88/91/1049118891.db2.gz QLLQMTGSYRVYJF-UHFFFAOYSA-N 1 2 318.420 4.470 20 0 DIADLO COc1c(Cl)cc(Cl)cc1CNc1cc2cc[nH]c2c[nH+]1 ZINC001179044753 1049122705 /nfs/dbraw/zinc/12/27/05/1049122705.db2.gz PLPKDMGWUPWDNA-UHFFFAOYSA-N 1 2 322.195 4.490 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1CCCCC[C@@H]1c1ccco1 ZINC001204299135 1049134544 /nfs/dbraw/zinc/13/45/44/1049134544.db2.gz QBQYWLCQCHXREM-CYBMUJFWSA-N 1 2 307.825 4.267 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC001204299135 1049134549 /nfs/dbraw/zinc/13/45/49/1049134549.db2.gz QBQYWLCQCHXREM-CYBMUJFWSA-N 1 2 307.825 4.267 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H](C)c2cccc(N3CCCC3)c2)o1 ZINC000775550219 1049139577 /nfs/dbraw/zinc/13/95/77/1049139577.db2.gz VTYRNXYRLYHMLQ-HNNXBMFYSA-N 1 2 313.445 4.249 20 0 DIADLO C[N@H+](Cc1ccc(Cl)c(F)c1)Cc1ccc(O)c(F)c1F ZINC001204325037 1049142391 /nfs/dbraw/zinc/14/23/91/1049142391.db2.gz VZWQXLUWBNMXPC-UHFFFAOYSA-N 1 2 315.722 4.095 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)c(F)c1)Cc1ccc(O)c(F)c1F ZINC001204325037 1049142395 /nfs/dbraw/zinc/14/23/95/1049142395.db2.gz VZWQXLUWBNMXPC-UHFFFAOYSA-N 1 2 315.722 4.095 20 0 DIADLO Fc1ccc(OC(F)F)c(C[NH2+]Cc2ccsc2Cl)c1 ZINC001179252910 1049149666 /nfs/dbraw/zinc/14/96/66/1049149666.db2.gz LIFQPNHTODBOJW-UHFFFAOYSA-N 1 2 321.751 4.432 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@H+]1Cc1cccc2ncccc12 ZINC001192948101 1049151023 /nfs/dbraw/zinc/15/10/23/1049151023.db2.gz VCDGBWWHUVGWFD-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@@H+]1Cc1cccc2ncccc12 ZINC001192948101 1049151027 /nfs/dbraw/zinc/15/10/27/1049151027.db2.gz VCDGBWWHUVGWFD-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO CCCCCCOc1ccc(C[N@H+]2CCC(=O)[C@@H](F)CC2)cc1 ZINC001204365309 1049151799 /nfs/dbraw/zinc/15/17/99/1049151799.db2.gz QIKYLMFDJTUDKS-SFHVURJKSA-N 1 2 321.436 4.149 20 0 DIADLO CCCCCCOc1ccc(C[N@@H+]2CCC(=O)[C@@H](F)CC2)cc1 ZINC001204365309 1049151803 /nfs/dbraw/zinc/15/18/03/1049151803.db2.gz QIKYLMFDJTUDKS-SFHVURJKSA-N 1 2 321.436 4.149 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+][C@H](C)c1ccc(Cl)cn1)CCC2 ZINC000775555418 1049157495 /nfs/dbraw/zinc/15/74/95/1049157495.db2.gz MOQAXJHUXFTYEX-MLGOLLRUSA-N 1 2 318.852 4.241 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1ccc(OC(F)(F)F)cc1)C2 ZINC001204415515 1049160580 /nfs/dbraw/zinc/16/05/80/1049160580.db2.gz ROWVLBNUPBXBHC-UHFFFAOYSA-N 1 2 311.278 4.240 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1ccc(OC(F)(F)F)cc1)C2 ZINC001204415515 1049160590 /nfs/dbraw/zinc/16/05/90/1049160590.db2.gz ROWVLBNUPBXBHC-UHFFFAOYSA-N 1 2 311.278 4.240 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1ccc2c(c1)CCCO2 ZINC001179434335 1049164202 /nfs/dbraw/zinc/16/42/02/1049164202.db2.gz YOJDZKXWFNLKNJ-UHFFFAOYSA-N 1 2 314.454 4.272 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1ccc(F)c(F)c1F ZINC001179432704 1049164487 /nfs/dbraw/zinc/16/44/87/1049164487.db2.gz HJTVXSBXSWRHEB-UHFFFAOYSA-N 1 2 312.360 4.364 20 0 DIADLO COC(=O)c1ccoc1C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000339005217 1049165503 /nfs/dbraw/zinc/16/55/03/1049165503.db2.gz JERMUHVFRLXMGK-OAHLLOKOSA-N 1 2 319.788 4.057 20 0 DIADLO COC(=O)c1ccoc1C[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000339005217 1049165506 /nfs/dbraw/zinc/16/55/06/1049165506.db2.gz JERMUHVFRLXMGK-OAHLLOKOSA-N 1 2 319.788 4.057 20 0 DIADLO Fc1ccc(C(F)(F)F)cc1C[NH+]1CC(c2ccccc2)C1 ZINC001204474716 1049170599 /nfs/dbraw/zinc/17/05/99/1049170599.db2.gz VNBIMFBBLZRWKX-UHFFFAOYSA-N 1 2 309.306 4.444 20 0 DIADLO Clc1ccc2[nH]c(NCC3=Cc4ccccc4OC3)[nH+]c2c1 ZINC001179516431 1049173149 /nfs/dbraw/zinc/17/31/49/1049173149.db2.gz YVAIWHPHPPSHCY-UHFFFAOYSA-N 1 2 311.772 4.104 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cccc2ccccc21)C(=O)OC(C)(C)C ZINC001193080497 1049174236 /nfs/dbraw/zinc/17/42/36/1049174236.db2.gz FNZPOEGSWLZYQK-SFHVURJKSA-N 1 2 313.441 4.296 20 0 DIADLO Fc1ccc(C[N@@H+]2CCc3ccsc3C2)cc1C(F)(F)F ZINC001204485314 1049174859 /nfs/dbraw/zinc/17/48/59/1049174859.db2.gz RAMPONZCBSIPTM-UHFFFAOYSA-N 1 2 315.335 4.464 20 0 DIADLO Fc1ccc(C[N@H+]2CCc3ccsc3C2)cc1C(F)(F)F ZINC001204485314 1049174862 /nfs/dbraw/zinc/17/48/62/1049174862.db2.gz RAMPONZCBSIPTM-UHFFFAOYSA-N 1 2 315.335 4.464 20 0 DIADLO C[C@@H]1C[NH+](Cc2cccc(F)c2OC(F)(F)F)C[C@@H](C)S1 ZINC001204489724 1049175213 /nfs/dbraw/zinc/17/52/13/1049175213.db2.gz WWWCKBPZDCSPNP-NXEZZACHSA-N 1 2 323.355 4.050 20 0 DIADLO C[N@H+](CCc1ccccc1)Cc1c(F)c(F)c(F)c(F)c1F ZINC001203359806 1049179689 /nfs/dbraw/zinc/17/96/89/1049179689.db2.gz HRXMBFMTBGRRHW-UHFFFAOYSA-N 1 2 315.285 4.057 20 0 DIADLO C[N@@H+](CCc1ccccc1)Cc1c(F)c(F)c(F)c(F)c1F ZINC001203359806 1049179696 /nfs/dbraw/zinc/17/96/96/1049179696.db2.gz HRXMBFMTBGRRHW-UHFFFAOYSA-N 1 2 315.285 4.057 20 0 DIADLO COc1ccc2cc(C[N@@H+]3Cc4cnc(C)cc4C3)ccc2c1 ZINC001204517472 1049180699 /nfs/dbraw/zinc/18/06/99/1049180699.db2.gz LHDCNJRHGFJIHH-UHFFFAOYSA-N 1 2 304.393 4.068 20 0 DIADLO COc1ccc2cc(C[N@H+]3Cc4cnc(C)cc4C3)ccc2c1 ZINC001204517472 1049180704 /nfs/dbraw/zinc/18/07/04/1049180704.db2.gz LHDCNJRHGFJIHH-UHFFFAOYSA-N 1 2 304.393 4.068 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cc(F)c(F)c(F)c1)CCC2 ZINC001204531358 1049182838 /nfs/dbraw/zinc/18/28/38/1049182838.db2.gz UTLYRKGPAUZIIX-UHFFFAOYSA-N 1 2 321.342 4.061 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cc(F)c(F)c(F)c1)CCC2 ZINC001204531358 1049182845 /nfs/dbraw/zinc/18/28/45/1049182845.db2.gz UTLYRKGPAUZIIX-UHFFFAOYSA-N 1 2 321.342 4.061 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccccc2Br)oc1C ZINC001204530638 1049183265 /nfs/dbraw/zinc/18/32/65/1049183265.db2.gz FYVGGHICEZAMST-UHFFFAOYSA-N 1 2 308.219 4.291 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccccc2Br)oc1C ZINC001204530638 1049183273 /nfs/dbraw/zinc/18/32/73/1049183273.db2.gz FYVGGHICEZAMST-UHFFFAOYSA-N 1 2 308.219 4.291 20 0 DIADLO CCCn1c(C[NH2+]Cc2cscc2Cl)nc2ccccc21 ZINC001179603071 1049183945 /nfs/dbraw/zinc/18/39/45/1049183945.db2.gz SSIAXBFEYXFQOQ-UHFFFAOYSA-N 1 2 319.861 4.451 20 0 DIADLO COc1cc(C[N@H+](C)Cc2nc3ccccc3s2)ccc1F ZINC001204556343 1049189184 /nfs/dbraw/zinc/18/91/84/1049189184.db2.gz DNJYDAGBBNCACX-UHFFFAOYSA-N 1 2 316.401 4.076 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2nc3ccccc3s2)ccc1F ZINC001204556343 1049189190 /nfs/dbraw/zinc/18/91/90/1049189190.db2.gz DNJYDAGBBNCACX-UHFFFAOYSA-N 1 2 316.401 4.076 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cc(C(F)(F)F)co1 ZINC001193293649 1049196124 /nfs/dbraw/zinc/19/61/24/1049196124.db2.gz OVOPALBDBAUKNK-RKDXNWHRSA-N 1 2 315.257 4.461 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1cc(C(F)(F)F)co1 ZINC001193293649 1049196127 /nfs/dbraw/zinc/19/61/27/1049196127.db2.gz OVOPALBDBAUKNK-RKDXNWHRSA-N 1 2 315.257 4.461 20 0 DIADLO CCNc1nc(C[N@H+](C)C/C(C)=C/c2ccccc2)cs1 ZINC001193372406 1049204118 /nfs/dbraw/zinc/20/41/18/1049204118.db2.gz CEDDVVNQKODRPI-GXDHUFHOSA-N 1 2 301.459 4.110 20 0 DIADLO CCNc1nc(C[N@@H+](C)C/C(C)=C/c2ccccc2)cs1 ZINC001193372406 1049204127 /nfs/dbraw/zinc/20/41/27/1049204127.db2.gz CEDDVVNQKODRPI-GXDHUFHOSA-N 1 2 301.459 4.110 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cccc(Oc2ccccc2)n1 ZINC001179784836 1049207436 /nfs/dbraw/zinc/20/74/36/1049207436.db2.gz SAFLLABDXRZEJR-UHFFFAOYSA-N 1 2 308.385 4.263 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cc(F)ccc1F ZINC001179810446 1049208899 /nfs/dbraw/zinc/20/88/99/1049208899.db2.gz NKYVEDLTXAXVNO-UHFFFAOYSA-N 1 2 305.303 4.086 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1c(F)cccc1F ZINC001179809869 1049209521 /nfs/dbraw/zinc/20/95/21/1049209521.db2.gz GNJCMWABUGRZDF-UHFFFAOYSA-N 1 2 307.731 4.117 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cccc2ncccc12 ZINC001179815079 1049210875 /nfs/dbraw/zinc/21/08/75/1049210875.db2.gz CWOUWARATBSXJM-UHFFFAOYSA-N 1 2 320.371 4.356 20 0 DIADLO CCC[C@H]1CCCC[C@H]1CNC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001204649150 1049211390 /nfs/dbraw/zinc/21/13/90/1049211390.db2.gz RSIGTXGJAHPYNJ-GJZGRUSLSA-N 1 2 314.433 4.062 20 0 DIADLO CCCCc1ccc(N(C)C(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001204649322 1049211600 /nfs/dbraw/zinc/21/16/00/1049211600.db2.gz ZEMMFDCBJKVEBM-UHFFFAOYSA-N 1 2 322.412 4.345 20 0 DIADLO CC(C)Cc1ccc(NC(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001204648779 1049212536 /nfs/dbraw/zinc/21/25/36/1049212536.db2.gz LPXMLLFTTVZITN-UHFFFAOYSA-N 1 2 308.385 4.177 20 0 DIADLO Cc1noc([C@@H]([NH2+]Cc2cccc(CC3CCC3)c2)C(C)C)n1 ZINC001179838204 1049213039 /nfs/dbraw/zinc/21/30/39/1049213039.db2.gz PBSPJDJYHDZKLL-SFHVURJKSA-N 1 2 313.445 4.208 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2c(Cl)ccnc2F)cc1 ZINC001179844777 1049213165 /nfs/dbraw/zinc/21/31/65/1049213165.db2.gz BWOIAQUBOYBLMH-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2c(Cl)ccnc2F)cc1 ZINC001179844777 1049213176 /nfs/dbraw/zinc/21/31/76/1049213176.db2.gz BWOIAQUBOYBLMH-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC[C@]1(C)C[N@@H+]([C@H](C)c2cccc(Br)c2)CCO1 ZINC001193474337 1049213946 /nfs/dbraw/zinc/21/39/46/1049213946.db2.gz WMFJKOAIWJSNCM-IUODEOHRSA-N 1 2 312.251 4.011 20 0 DIADLO CC[C@]1(C)C[N@H+]([C@H](C)c2cccc(Br)c2)CCO1 ZINC001193474337 1049213954 /nfs/dbraw/zinc/21/39/54/1049213954.db2.gz WMFJKOAIWJSNCM-IUODEOHRSA-N 1 2 312.251 4.011 20 0 DIADLO CCCCCC[C@@](C)(CCC)C(=O)N[C@H]1CCn2c[nH+]cc2C1 ZINC000857948924 1049213886 /nfs/dbraw/zinc/21/38/86/1049213886.db2.gz UATBZEJSBOTYGL-QFBILLFUSA-N 1 2 319.493 4.091 20 0 DIADLO C[C@@H]1CC[C@@H](C)[N@H+](Cc2cc(Br)cnc2Cl)C1 ZINC001179855439 1049214957 /nfs/dbraw/zinc/21/49/57/1049214957.db2.gz SFWCPWRDVCCJCB-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2cc(Br)cnc2Cl)C1 ZINC001179855439 1049214963 /nfs/dbraw/zinc/21/49/63/1049214963.db2.gz SFWCPWRDVCCJCB-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[C@H](C)[N@H+](Cc2cc(Br)cnc2Cl)C1 ZINC001179855442 1049218173 /nfs/dbraw/zinc/21/81/73/1049218173.db2.gz SFWCPWRDVCCJCB-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[C@H](C)[N@@H+](Cc2cc(Br)cnc2Cl)C1 ZINC001179855442 1049218186 /nfs/dbraw/zinc/21/81/86/1049218186.db2.gz SFWCPWRDVCCJCB-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](CC[C@@H]3C[C@H]3C3CC3)CCO2)c(Cl)c1 ZINC001193546043 1049219520 /nfs/dbraw/zinc/21/95/20/1049219520.db2.gz MWEKPPNEHOPAIC-SKDZVZGDSA-N 1 2 323.839 4.289 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](CC[C@@H]3C[C@H]3C3CC3)CCO2)c(Cl)c1 ZINC001193546043 1049219532 /nfs/dbraw/zinc/21/95/32/1049219532.db2.gz MWEKPPNEHOPAIC-SKDZVZGDSA-N 1 2 323.839 4.289 20 0 DIADLO Cc1nc(C2([NH2+]Cc3ccc4cc[nH]c4c3)CCCCCC2)no1 ZINC000858120846 1049220503 /nfs/dbraw/zinc/22/05/03/1049220503.db2.gz OFVDDGSMMMPHEZ-UHFFFAOYSA-N 1 2 324.428 4.199 20 0 DIADLO Clc1cccc(-c2ccc(C[NH+]3CC4(C3)CCCCO4)o2)c1 ZINC001204695323 1049231072 /nfs/dbraw/zinc/23/10/72/1049231072.db2.gz ORAABNOEQBCCBW-UHFFFAOYSA-N 1 2 317.816 4.355 20 0 DIADLO CC[C@H]([NH2+]Cc1ncc(CN(C)C)s1)c1cc(C)ccc1C ZINC000858295633 1049236888 /nfs/dbraw/zinc/23/68/88/1049236888.db2.gz HAOMSHFKIOVKCR-KRWDZBQOSA-N 1 2 317.502 4.062 20 0 DIADLO Cc1ccc(C2=CC[N@H+](Cc3ccc(O)c(F)c3F)CC2)cc1 ZINC001204743728 1049248267 /nfs/dbraw/zinc/24/82/67/1049248267.db2.gz KDBSINZYXRHLHM-UHFFFAOYSA-N 1 2 315.363 4.268 20 0 DIADLO Cc1ccc(C2=CC[N@@H+](Cc3ccc(O)c(F)c3F)CC2)cc1 ZINC001204743728 1049248275 /nfs/dbraw/zinc/24/82/75/1049248275.db2.gz KDBSINZYXRHLHM-UHFFFAOYSA-N 1 2 315.363 4.268 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2scnc21)c1nc2ccccc2s1 ZINC000858365586 1049249174 /nfs/dbraw/zinc/24/91/74/1049249174.db2.gz PEMIFJSMMORGQA-ZYHUDNBSSA-N 1 2 315.467 4.481 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2ccn(CC)n2)o1 ZINC001179961133 1049251037 /nfs/dbraw/zinc/25/10/37/1049251037.db2.gz AOAYCNSFHUCNPZ-PBHICJAKSA-N 1 2 301.434 4.032 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2ccn(CC)n2)o1 ZINC001179961133 1049251046 /nfs/dbraw/zinc/25/10/46/1049251046.db2.gz AOAYCNSFHUCNPZ-PBHICJAKSA-N 1 2 301.434 4.032 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2ccn(CC)n2)o1 ZINC001179961135 1049252405 /nfs/dbraw/zinc/25/24/05/1049252405.db2.gz AOAYCNSFHUCNPZ-WMLDXEAASA-N 1 2 301.434 4.032 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2ccn(CC)n2)o1 ZINC001179961135 1049252420 /nfs/dbraw/zinc/25/24/20/1049252420.db2.gz AOAYCNSFHUCNPZ-WMLDXEAASA-N 1 2 301.434 4.032 20 0 DIADLO Clc1csc(NCc2cc[nH+]c(N3CCCCCC3)c2)n1 ZINC000858402008 1049252685 /nfs/dbraw/zinc/25/26/85/1049252685.db2.gz UWYHFHFHHYDHFY-UHFFFAOYSA-N 1 2 322.865 4.184 20 0 DIADLO CO[C@]1(C)C[C@@H]([N@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001179962129 1049253334 /nfs/dbraw/zinc/25/33/34/1049253334.db2.gz LHQVTOBRLAFDBI-IUODEOHRSA-N 1 2 317.260 4.024 20 0 DIADLO CO[C@]1(C)C[C@@H]([N@@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001179962129 1049253345 /nfs/dbraw/zinc/25/33/45/1049253345.db2.gz LHQVTOBRLAFDBI-IUODEOHRSA-N 1 2 317.260 4.024 20 0 DIADLO Cc1cn2cc(-c3ccc(OCc4ccccc4)nc3)ccc2[nH+]1 ZINC001204750355 1049253412 /nfs/dbraw/zinc/25/34/12/1049253412.db2.gz IJUNDOMSWRMWLU-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO CC1=CC[N@H+](Cc2cc3c(cc(F)cc3Br)[nH]2)CC1 ZINC001204767368 1049256491 /nfs/dbraw/zinc/25/64/91/1049256491.db2.gz BEADVOBVLFDRRJ-UHFFFAOYSA-N 1 2 323.209 4.222 20 0 DIADLO CC1=CC[N@@H+](Cc2cc3c(cc(F)cc3Br)[nH]2)CC1 ZINC001204767368 1049256504 /nfs/dbraw/zinc/25/65/04/1049256504.db2.gz BEADVOBVLFDRRJ-UHFFFAOYSA-N 1 2 323.209 4.222 20 0 DIADLO CCc1cccc2cc(C[N@@H+]3CCO[C@@H](c4ccco4)C3)oc21 ZINC001204804035 1049270157 /nfs/dbraw/zinc/27/01/57/1049270157.db2.gz VPXQYVRLOQGOQC-GOSISDBHSA-N 1 2 311.381 4.162 20 0 DIADLO CCc1cccc2cc(C[N@H+]3CCO[C@@H](c4ccco4)C3)oc21 ZINC001204804035 1049270171 /nfs/dbraw/zinc/27/01/71/1049270171.db2.gz VPXQYVRLOQGOQC-GOSISDBHSA-N 1 2 311.381 4.162 20 0 DIADLO Oc1ccc(Cl)c(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)c1 ZINC001193830040 1049270527 /nfs/dbraw/zinc/27/05/27/1049270527.db2.gz ZQBIWWCDOHNMSZ-QGZVFWFLSA-N 1 2 305.780 4.116 20 0 DIADLO Oc1ccc(Cl)c(C[N@H+]2CC[C@](F)(c3ccccc3)C2)c1 ZINC001193830040 1049270537 /nfs/dbraw/zinc/27/05/37/1049270537.db2.gz ZQBIWWCDOHNMSZ-QGZVFWFLSA-N 1 2 305.780 4.116 20 0 DIADLO COc1cnc(F)c(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)c1 ZINC001180129362 1049276456 /nfs/dbraw/zinc/27/64/56/1049276456.db2.gz PIYQDZYBUGPAGI-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cnc(F)c(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)c1 ZINC001180129362 1049276471 /nfs/dbraw/zinc/27/64/71/1049276471.db2.gz PIYQDZYBUGPAGI-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2n1C(F)F)c1ccns1 ZINC000858575570 1049278553 /nfs/dbraw/zinc/27/85/53/1049278553.db2.gz BDZCRTSEZSAPNO-ZJUUUORDSA-N 1 2 322.384 4.300 20 0 DIADLO CCn1ccc(C[N@H+](Cc2cc(F)ccc2F)C2CCCC2)n1 ZINC001180136513 1049279542 /nfs/dbraw/zinc/27/95/42/1049279542.db2.gz DRMHXAVSAOJMEL-UHFFFAOYSA-N 1 2 319.399 4.126 20 0 DIADLO CCn1ccc(C[N@@H+](Cc2cc(F)ccc2F)C2CCCC2)n1 ZINC001180136513 1049279553 /nfs/dbraw/zinc/27/95/53/1049279553.db2.gz DRMHXAVSAOJMEL-UHFFFAOYSA-N 1 2 319.399 4.126 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1nc(C(F)(F)F)cs1)c1ccns1 ZINC000858578706 1049279531 /nfs/dbraw/zinc/27/95/31/1049279531.db2.gz XQDARBMYPRXJFV-RNFRBKRXSA-N 1 2 307.366 4.030 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1nc(C(F)(F)F)cs1 ZINC000858578705 1049281010 /nfs/dbraw/zinc/28/10/10/1049281010.db2.gz XQDARBMYPRXJFV-NKWVEPMBSA-N 1 2 307.366 4.030 20 0 DIADLO Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCCc3[nH]ncc31)CCC2 ZINC000858601549 1049282454 /nfs/dbraw/zinc/28/24/54/1049282454.db2.gz WRAKQLVROLPOMX-HZPDHXFCSA-N 1 2 301.821 4.108 20 0 DIADLO C[C@H]1C[N@H+](CCc2cc(Cl)cc(Cl)c2)C[C@@H](C2CC2)O1 ZINC001193974870 1049289043 /nfs/dbraw/zinc/28/90/43/1049289043.db2.gz DMTLLVAAVFKGMP-ZBEGNZNMSA-N 1 2 314.256 4.035 20 0 DIADLO C[C@H]1C[N@@H+](CCc2cc(Cl)cc(Cl)c2)C[C@@H](C2CC2)O1 ZINC001193974870 1049289058 /nfs/dbraw/zinc/28/90/58/1049289058.db2.gz DMTLLVAAVFKGMP-ZBEGNZNMSA-N 1 2 314.256 4.035 20 0 DIADLO C[C@@H]1C[N@H+](CCc2cc(Cl)cc(Cl)c2)C[C@@H](C2CC2)O1 ZINC001193974867 1049289266 /nfs/dbraw/zinc/28/92/66/1049289266.db2.gz DMTLLVAAVFKGMP-BZNIZROVSA-N 1 2 314.256 4.035 20 0 DIADLO C[C@@H]1C[N@@H+](CCc2cc(Cl)cc(Cl)c2)C[C@@H](C2CC2)O1 ZINC001193974867 1049289282 /nfs/dbraw/zinc/28/92/82/1049289282.db2.gz DMTLLVAAVFKGMP-BZNIZROVSA-N 1 2 314.256 4.035 20 0 DIADLO CCCC[C@H](CC)COC(=O)NCc1c[nH+]cn1C1CCC1 ZINC001193979946 1049291062 /nfs/dbraw/zinc/29/10/62/1049291062.db2.gz BADFFOSLUBHRKJ-AWEZNQCLSA-N 1 2 307.438 4.051 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CCCC34CC4)c2)[nH+]c1C ZINC000858739225 1049291333 /nfs/dbraw/zinc/29/13/33/1049291333.db2.gz CVBBIFDYOMCTAC-INIZCTEOSA-N 1 2 309.413 4.212 20 0 DIADLO CNc1ccc(C)cc1C[N@H+](C)Cc1nc2c(s1)CCCC2 ZINC001204873417 1049294094 /nfs/dbraw/zinc/29/40/94/1049294094.db2.gz APYWBIJEUMWTGQ-UHFFFAOYSA-N 1 2 315.486 4.004 20 0 DIADLO CNc1ccc(C)cc1C[N@@H+](C)Cc1nc2c(s1)CCCC2 ZINC001204873417 1049294103 /nfs/dbraw/zinc/29/41/03/1049294103.db2.gz APYWBIJEUMWTGQ-UHFFFAOYSA-N 1 2 315.486 4.004 20 0 DIADLO C[N@H+](Cc1ccccc1F)Cc1cccc(OC2CC2)c1F ZINC001180161349 1049302220 /nfs/dbraw/zinc/30/22/20/1049302220.db2.gz CHFYYPJINGTPNJ-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO C[N@@H+](Cc1ccccc1F)Cc1cccc(OC2CC2)c1F ZINC001180161349 1049302229 /nfs/dbraw/zinc/30/22/29/1049302229.db2.gz CHFYYPJINGTPNJ-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)n1 ZINC001180203058 1049306720 /nfs/dbraw/zinc/30/67/20/1049306720.db2.gz IPDPZUCXNLONQX-INIZCTEOSA-N 1 2 303.837 4.489 20 0 DIADLO Cc1c[nH]c(C[N@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)n1 ZINC001180203058 1049306729 /nfs/dbraw/zinc/30/67/29/1049306729.db2.gz IPDPZUCXNLONQX-INIZCTEOSA-N 1 2 303.837 4.489 20 0 DIADLO c1cc(Oc2ccccc2)oc1C[N@@H+]1CCOCC12CCCC2 ZINC001180219700 1049310115 /nfs/dbraw/zinc/31/01/15/1049310115.db2.gz TUVFIACXUDURBD-UHFFFAOYSA-N 1 2 313.397 4.217 20 0 DIADLO c1cc(Oc2ccccc2)oc1C[N@H+]1CCOCC12CCCC2 ZINC001180219700 1049310125 /nfs/dbraw/zinc/31/01/25/1049310125.db2.gz TUVFIACXUDURBD-UHFFFAOYSA-N 1 2 313.397 4.217 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@@H+](C/C=C\c1ccc(F)c(F)c1)CC2 ZINC001180220050 1049310199 /nfs/dbraw/zinc/31/01/99/1049310199.db2.gz YMJKGTPJJZLZDL-UPHRSURJSA-N 1 2 321.317 4.315 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@H+](C/C=C\c1ccc(F)c(F)c1)CC2 ZINC001180220050 1049310206 /nfs/dbraw/zinc/31/02/06/1049310206.db2.gz YMJKGTPJJZLZDL-UPHRSURJSA-N 1 2 321.317 4.315 20 0 DIADLO CCc1ccc(N(Cc2cc[nH+]c(N(C)C)c2)CC(C)C)cc1 ZINC001194065893 1049311526 /nfs/dbraw/zinc/31/15/26/1049311526.db2.gz AZVFDOWVPCUXEB-UHFFFAOYSA-N 1 2 311.473 4.373 20 0 DIADLO C[C@H](c1ccccc1Br)[N@H+](C)Cc1ccnc(F)c1 ZINC000859097334 1049312781 /nfs/dbraw/zinc/31/27/81/1049312781.db2.gz YQDKDTBWUJBOFS-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1ccccc1Br)[N@@H+](C)Cc1ccnc(F)c1 ZINC000859097334 1049312792 /nfs/dbraw/zinc/31/27/92/1049312792.db2.gz YQDKDTBWUJBOFS-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO Cc1c(Cl)cccc1C[N@@H+](C)Cc1nc2ccccc2n1C ZINC001204924464 1049312924 /nfs/dbraw/zinc/31/29/24/1049312924.db2.gz VMBIHSZZCYFNSA-UHFFFAOYSA-N 1 2 313.832 4.167 20 0 DIADLO Cc1c(Cl)cccc1C[N@H+](C)Cc1nc2ccccc2n1C ZINC001204924464 1049312942 /nfs/dbraw/zinc/31/29/42/1049312942.db2.gz VMBIHSZZCYFNSA-UHFFFAOYSA-N 1 2 313.832 4.167 20 0 DIADLO Oc1ccc(F)c(C[N@H+](CCc2ccc(F)cc2)C2CC2)c1F ZINC001204929714 1049313368 /nfs/dbraw/zinc/31/33/68/1049313368.db2.gz AGYXGHROUDXMRH-UHFFFAOYSA-N 1 2 321.342 4.017 20 0 DIADLO Oc1ccc(F)c(C[N@@H+](CCc2ccc(F)cc2)C2CC2)c1F ZINC001204929714 1049313377 /nfs/dbraw/zinc/31/33/77/1049313377.db2.gz AGYXGHROUDXMRH-UHFFFAOYSA-N 1 2 321.342 4.017 20 0 DIADLO CCc1ccc([N@H+](CC[C@H]2COC(C)(C)O2)CC(C)C)cc1 ZINC001194066752 1049313810 /nfs/dbraw/zinc/31/38/10/1049313810.db2.gz PVGXBGCHBGVXLP-SFHVURJKSA-N 1 2 305.462 4.253 20 0 DIADLO CCc1ccc([N@@H+](CC[C@H]2COC(C)(C)O2)CC(C)C)cc1 ZINC001194066752 1049313823 /nfs/dbraw/zinc/31/38/23/1049313823.db2.gz PVGXBGCHBGVXLP-SFHVURJKSA-N 1 2 305.462 4.253 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)c1 ZINC001180234870 1049320218 /nfs/dbraw/zinc/32/02/18/1049320218.db2.gz SSALJTINKXXPIM-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)c1 ZINC001180234870 1049320232 /nfs/dbraw/zinc/32/02/32/1049320232.db2.gz SSALJTINKXXPIM-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@H]([NH2+]Cc1cccnc1C(F)(F)F)c1c(F)cccc1F ZINC000859227524 1049321368 /nfs/dbraw/zinc/32/13/68/1049321368.db2.gz IAWYIGUXTKKSTI-VIFPVBQESA-N 1 2 316.273 4.229 20 0 DIADLO C[C@H](CC(C)(C)C)[NH2+][C@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001204969544 1049325913 /nfs/dbraw/zinc/32/59/13/1049325913.db2.gz ZNRCNEKHWRYPPG-NVXWUHKLSA-N 1 2 319.489 4.354 20 0 DIADLO FC(F)(F)c1cc(Cl)cnc1Nc1ccn2cc[nH+]c2c1 ZINC001204966483 1049326478 /nfs/dbraw/zinc/32/64/78/1049326478.db2.gz VBKMIPVACZJTJI-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO Cc1cccc(Br)c1Nc1ccn2cc[nH+]c2c1 ZINC001204977604 1049328092 /nfs/dbraw/zinc/32/80/92/1049328092.db2.gz HODAYEUSZYUQDJ-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO Fc1cc(Nc2ccn3cc[nH+]c3c2)ccc1OC(F)(F)F ZINC001204978254 1049328372 /nfs/dbraw/zinc/32/83/72/1049328372.db2.gz RLQXJZJNJWEVBN-UHFFFAOYSA-N 1 2 311.238 4.116 20 0 DIADLO Cc1cc(CNc2cccc(N(C)C)c2C)c2c([nH+]1)CCCC2 ZINC001204977642 1049328634 /nfs/dbraw/zinc/32/86/34/1049328634.db2.gz YHJUASNBHPZKCW-UHFFFAOYSA-N 1 2 309.457 4.255 20 0 DIADLO COc1c(Nc2ccn3cc[nH+]c3c2)cccc1C(F)(F)F ZINC001204982707 1049330604 /nfs/dbraw/zinc/33/06/04/1049330604.db2.gz GEFDPRZVMOSTGU-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO c1csc(Oc2ccc(Nc3ccn4cc[nH+]c4c3)cc2)n1 ZINC001204982627 1049330963 /nfs/dbraw/zinc/33/09/63/1049330963.db2.gz AVHIQXPCRRJMLO-UHFFFAOYSA-N 1 2 308.366 4.327 20 0 DIADLO Cc1ccc(Br)cc1Nc1ccn2cc[nH+]c2c1 ZINC001204982778 1049331572 /nfs/dbraw/zinc/33/15/72/1049331572.db2.gz IPXLKXMKPNOBBG-UHFFFAOYSA-N 1 2 302.175 4.149 20 0 DIADLO Nc1ccccc1-c1ccccc1Nc1ccn2cc[nH+]c2c1 ZINC001204983319 1049331970 /nfs/dbraw/zinc/33/19/70/1049331970.db2.gz ROLQKOOIBUWSMO-UHFFFAOYSA-N 1 2 300.365 4.327 20 0 DIADLO CCCCCCOC(=O)Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001194185973 1049333215 /nfs/dbraw/zinc/33/32/15/1049333215.db2.gz YWSOKTUKHVJRPM-UHFFFAOYSA-N 1 2 301.390 4.060 20 0 DIADLO Nc1ccc(Oc2ccccc2)cc1Nc1ccn2cc[nH+]c2c1 ZINC001204990885 1049333817 /nfs/dbraw/zinc/33/38/17/1049333817.db2.gz IEAUJPMDDREKTQ-UHFFFAOYSA-N 1 2 316.364 4.452 20 0 DIADLO Fc1cnc(Cl)c2cccc(Nc3ccn4cc[nH+]c4c3)c12 ZINC001204997290 1049334671 /nfs/dbraw/zinc/33/46/71/1049334671.db2.gz HTYMFQIINQDVNA-UHFFFAOYSA-N 1 2 312.735 4.419 20 0 DIADLO CC(C)Oc1c(F)cc(Nc2ccn3cc[nH+]c3c2)cc1F ZINC001204996916 1049335716 /nfs/dbraw/zinc/33/57/16/1049335716.db2.gz AKAJVIQJCFXPTF-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO CCc1ccc(C)[nH+]c1Nc1cnc(Cl)n1[C@H]1CCCCO1 ZINC001205005304 1049336830 /nfs/dbraw/zinc/33/68/30/1049336830.db2.gz DCEFDVQISUINLY-CQSZACIVSA-N 1 2 320.824 4.245 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)Cc3cccc(C)c3Cl)cc2[nH+]1 ZINC000485795238 1049338662 /nfs/dbraw/zinc/33/86/62/1049338662.db2.gz QLEPOLKFIHWFBR-UHFFFAOYSA-N 1 2 313.788 4.014 20 0 DIADLO CSc1ccc(C[N@H+](C)Cc2cc(F)c(F)c(F)c2)o1 ZINC001180326694 1049345332 /nfs/dbraw/zinc/34/53/32/1049345332.db2.gz OZGTZROZLHIIDE-UHFFFAOYSA-N 1 2 301.333 4.051 20 0 DIADLO CSc1ccc(C[N@@H+](C)Cc2cc(F)c(F)c(F)c2)o1 ZINC001180326694 1049345343 /nfs/dbraw/zinc/34/53/43/1049345343.db2.gz OZGTZROZLHIIDE-UHFFFAOYSA-N 1 2 301.333 4.051 20 0 DIADLO CCCn1cc(C[N@H+](Cc2ccco2)Cc2ccccc2)c(C)n1 ZINC001205024006 1049345356 /nfs/dbraw/zinc/34/53/56/1049345356.db2.gz MRJUOVQPGMWKPV-UHFFFAOYSA-N 1 2 323.440 4.397 20 0 DIADLO CCCn1cc(C[N@@H+](Cc2ccco2)Cc2ccccc2)c(C)n1 ZINC001205024006 1049345364 /nfs/dbraw/zinc/34/53/64/1049345364.db2.gz MRJUOVQPGMWKPV-UHFFFAOYSA-N 1 2 323.440 4.397 20 0 DIADLO CC(C)c1noc([C@@H](C)[NH2+][C@H](C)c2ccc3ncsc3c2)n1 ZINC000485843521 1049349749 /nfs/dbraw/zinc/34/97/49/1049349749.db2.gz JHDJIFDVQVMKSN-GHMZBOCLSA-N 1 2 316.430 4.215 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)[C@H](C)c2ccco2)cc1OC ZINC001180393727 1049351426 /nfs/dbraw/zinc/35/14/26/1049351426.db2.gz PROYWSRHXMBVKQ-LLVKDONJSA-N 1 2 309.793 4.143 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)[C@H](C)c2ccco2)cc1OC ZINC001180393727 1049351437 /nfs/dbraw/zinc/35/14/37/1049351437.db2.gz PROYWSRHXMBVKQ-LLVKDONJSA-N 1 2 309.793 4.143 20 0 DIADLO Cc1cc(-c2c[nH+]c(N3CCOCC3)c(C)c2)cc(C)c1Cl ZINC001205052069 1049354323 /nfs/dbraw/zinc/35/43/23/1049354323.db2.gz IJMHYTBMEVDKQK-UHFFFAOYSA-N 1 2 316.832 4.164 20 0 DIADLO Cc1cc(-c2c[nH+]c(N3CCOCC3)cc2C)cc(C)c1Cl ZINC001205052535 1049356614 /nfs/dbraw/zinc/35/66/14/1049356614.db2.gz YCDBGDNDCVAIIT-UHFFFAOYSA-N 1 2 316.832 4.164 20 0 DIADLO c1coc(C[NH+](Cc2ccco2)Cc2ccc3nccnc3c2)c1 ZINC001180412614 1049361154 /nfs/dbraw/zinc/36/11/54/1049361154.db2.gz BGWFAZNAKMUKAS-UHFFFAOYSA-N 1 2 319.364 4.018 20 0 DIADLO Cc1ccc2sc(C[N@@H+]3CCOCC34CCCCC4)nc2c1 ZINC001194377288 1049362599 /nfs/dbraw/zinc/36/25/99/1049362599.db2.gz VXBPZGGXTLTHQB-UHFFFAOYSA-N 1 2 316.470 4.140 20 0 DIADLO Cc1ccc2sc(C[N@H+]3CCOCC34CCCCC4)nc2c1 ZINC001194377288 1049362612 /nfs/dbraw/zinc/36/26/12/1049362612.db2.gz VXBPZGGXTLTHQB-UHFFFAOYSA-N 1 2 316.470 4.140 20 0 DIADLO CC[C@H]([NH2+]Cc1nnc(C(C)(C)C)o1)c1cc(C)ccc1C ZINC000859935832 1049362787 /nfs/dbraw/zinc/36/27/87/1049362787.db2.gz ZNCVSBBIICWLOX-HNNXBMFYSA-N 1 2 301.434 4.225 20 0 DIADLO C[C@@H]1CCC[C@H](c2nc(-c3ccccc3-n3cc[nH+]c3)no2)C1 ZINC001205075381 1049364284 /nfs/dbraw/zinc/36/42/84/1049364284.db2.gz OCMWBMIHSLYZTH-KGLIPLIRSA-N 1 2 308.385 4.216 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CCCCC2)cs1)c1ccns1 ZINC000860061078 1049365515 /nfs/dbraw/zinc/36/55/15/1049365515.db2.gz GBYZHZJGQZABPF-NSHDSACASA-N 1 2 307.488 4.498 20 0 DIADLO COc1cc(OC)c(C[N@H+](C)Cc2ccccc2Cl)cc1F ZINC001180531841 1049373056 /nfs/dbraw/zinc/37/30/56/1049373056.db2.gz LESQNJGJNOVFFS-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cc(OC)c(C[N@@H+](C)Cc2ccccc2Cl)cc1F ZINC001180531841 1049373068 /nfs/dbraw/zinc/37/30/68/1049373068.db2.gz LESQNJGJNOVFFS-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO C[N@H+](Cc1c(Cl)ccnc1F)[C@H]1CCCc2ccccc21 ZINC001205094129 1049373851 /nfs/dbraw/zinc/37/38/51/1049373851.db2.gz QSWAPJINFCRUCZ-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO C[N@@H+](Cc1c(Cl)ccnc1F)[C@H]1CCCc2ccccc21 ZINC001205094129 1049373861 /nfs/dbraw/zinc/37/38/61/1049373861.db2.gz QSWAPJINFCRUCZ-INIZCTEOSA-N 1 2 304.796 4.384 20 0 DIADLO CCCC[C@@H]([NH2+][C@H](C)Cc1ccccc1SCC)C(=O)OC ZINC001180663919 1049396470 /nfs/dbraw/zinc/39/64/70/1049396470.db2.gz BBWMGNOVKTUTMA-GDBMZVCRSA-N 1 2 323.502 4.051 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CC(C)(C)O[C@@](C)(C(F)(F)F)C1 ZINC001194648042 1049403801 /nfs/dbraw/zinc/40/38/01/1049403801.db2.gz DOJKROJCEHSDDQ-IAQYHMDHSA-N 1 2 319.342 4.319 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+]1CC(C)(C)O[C@@](C)(C(F)(F)F)C1 ZINC001194648042 1049403806 /nfs/dbraw/zinc/40/38/06/1049403806.db2.gz DOJKROJCEHSDDQ-IAQYHMDHSA-N 1 2 319.342 4.319 20 0 DIADLO Cc1c(F)nccc1C[N@H+](Cc1ccco1)Cc1cccs1 ZINC001205178853 1049404095 /nfs/dbraw/zinc/40/40/95/1049404095.db2.gz ZXMDIDLCSUBTMN-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO Cc1c(F)nccc1C[N@@H+](Cc1ccco1)Cc1cccs1 ZINC001205178853 1049404100 /nfs/dbraw/zinc/40/41/00/1049404100.db2.gz ZXMDIDLCSUBTMN-UHFFFAOYSA-N 1 2 316.401 4.386 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1c(F)cc(F)c(F)c1F ZINC001205191892 1049406829 /nfs/dbraw/zinc/40/68/29/1049406829.db2.gz UDXNYRRHZSUNNQ-UHFFFAOYSA-N 1 2 322.261 4.104 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c1 ZINC001205193765 1049408735 /nfs/dbraw/zinc/40/87/35/1049408735.db2.gz YBGSBGGRTYMALO-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCO[C@H](c3ccccc3)C2)c1 ZINC001205193765 1049408739 /nfs/dbraw/zinc/40/87/39/1049408739.db2.gz YBGSBGGRTYMALO-SFHVURJKSA-N 1 2 301.817 4.222 20 0 DIADLO Nc1[nH+]cccc1CNc1cc(Cl)ccc1OCC1CCC1 ZINC001180934660 1049420197 /nfs/dbraw/zinc/42/01/97/1049420197.db2.gz IIPJAEGCFRSEHP-UHFFFAOYSA-N 1 2 317.820 4.108 20 0 DIADLO CCCCC[C@@H]([NH2+][C@H](C)Cc1ccccc1SC)C(=O)OC ZINC001180954123 1049422536 /nfs/dbraw/zinc/42/25/36/1049422536.db2.gz VKDCHMDEHOMGSF-GDBMZVCRSA-N 1 2 323.502 4.051 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000339021755 1049424087 /nfs/dbraw/zinc/42/40/87/1049424087.db2.gz LUNFMHNJXZEJIB-QGZVFWFLSA-N 1 2 316.470 4.148 20 0 DIADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000339021755 1049424091 /nfs/dbraw/zinc/42/40/91/1049424091.db2.gz LUNFMHNJXZEJIB-QGZVFWFLSA-N 1 2 316.470 4.148 20 0 DIADLO CCc1ccc2c(c1)[C@@H]([NH2+]Cc1c(Cl)ccnc1F)CCO2 ZINC001205276314 1049425795 /nfs/dbraw/zinc/42/57/95/1049425795.db2.gz GWTQXUFVWJKSAJ-HNNXBMFYSA-N 1 2 320.795 4.050 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001194764534 1049427958 /nfs/dbraw/zinc/42/79/58/1049427958.db2.gz MFEIVBGKMCHYJO-STQMWFEESA-N 1 2 303.352 4.309 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001194764534 1049427961 /nfs/dbraw/zinc/42/79/61/1049427961.db2.gz MFEIVBGKMCHYJO-STQMWFEESA-N 1 2 303.352 4.309 20 0 DIADLO COc1ccccc1N(Cc1ccc(-n2cc[nH+]c2)cc1)C(C)C ZINC001194836333 1049437972 /nfs/dbraw/zinc/43/79/72/1049437972.db2.gz YLHJFZUJNWQAIW-UHFFFAOYSA-N 1 2 321.424 4.296 20 0 DIADLO Cc1cn2c(cccc2-c2ccc(Oc3ccccc3)nc2)[nH+]1 ZINC001205349109 1049445919 /nfs/dbraw/zinc/44/59/19/1049445919.db2.gz DDNGLISTZYZONB-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC001194890877 1049451093 /nfs/dbraw/zinc/45/10/93/1049451093.db2.gz NEDYZDOPCNZVJG-JSGCOSHPSA-N 1 2 309.475 4.251 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC001194890877 1049451096 /nfs/dbraw/zinc/45/10/96/1049451096.db2.gz NEDYZDOPCNZVJG-JSGCOSHPSA-N 1 2 309.475 4.251 20 0 DIADLO COc1cc([NH2+]C[C@@H]2CCCC[C@@H]2C)c(OC)c(C)c1OC ZINC001181206225 1049453857 /nfs/dbraw/zinc/45/38/57/1049453857.db2.gz QXPZUIBQFJNXCD-JSGCOSHPSA-N 1 2 307.434 4.259 20 0 DIADLO Fc1ccc2c(c1)CC[N@@H+](Cc1cc3c(ccnc3Cl)o1)C2 ZINC001205380351 1049454425 /nfs/dbraw/zinc/45/44/25/1049454425.db2.gz RESKTSRXVITYMI-UHFFFAOYSA-N 1 2 316.763 4.179 20 0 DIADLO Fc1ccc2c(c1)CC[N@H+](Cc1cc3c(ccnc3Cl)o1)C2 ZINC001205380351 1049454427 /nfs/dbraw/zinc/45/44/27/1049454427.db2.gz RESKTSRXVITYMI-UHFFFAOYSA-N 1 2 316.763 4.179 20 0 DIADLO CC[C@@]1(C)C[N@H+](Cc2ccc(Oc3ccccc3)o2)CCO1 ZINC001205426834 1049467407 /nfs/dbraw/zinc/46/74/07/1049467407.db2.gz OJTQCFWSGOUCGV-SFHVURJKSA-N 1 2 301.386 4.073 20 0 DIADLO CC[C@@]1(C)C[N@@H+](Cc2ccc(Oc3ccccc3)o2)CCO1 ZINC001205426834 1049467415 /nfs/dbraw/zinc/46/74/15/1049467415.db2.gz OJTQCFWSGOUCGV-SFHVURJKSA-N 1 2 301.386 4.073 20 0 DIADLO C[N@H+](Cc1ccc(C(F)(F)F)nc1)Cc1ccccc1Cl ZINC001205431136 1049469390 /nfs/dbraw/zinc/46/93/90/1049469390.db2.gz VGXUBRWHBLRBQG-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1ccc(C(F)(F)F)nc1)Cc1ccccc1Cl ZINC001205431136 1049469395 /nfs/dbraw/zinc/46/93/95/1049469395.db2.gz VGXUBRWHBLRBQG-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CCCC[C@@H]3C)cc2)C[C@H](C)O1 ZINC001181383407 1049469702 /nfs/dbraw/zinc/46/97/02/1049469702.db2.gz TVOULYXLVYFXMX-YIOZNXECSA-N 1 2 302.462 4.291 20 0 DIADLO COc1ncccc1C[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000486810303 1049477013 /nfs/dbraw/zinc/47/70/13/1049477013.db2.gz IEZYOEGOBQEVPF-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ncccc1C[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000486810303 1049477018 /nfs/dbraw/zinc/47/70/18/1049477018.db2.gz IEZYOEGOBQEVPF-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1ccc(Nc2cnc(Cl)c(Br)c2)c(C)[nH+]1 ZINC001203367284 1049477143 /nfs/dbraw/zinc/47/71/43/1049477143.db2.gz JWLSIRFJGZOVKS-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO C[N@H+](Cc1csc(C(F)(F)F)c1)Cc1ccc(Cl)nc1 ZINC000862215733 1049478738 /nfs/dbraw/zinc/47/87/38/1049478738.db2.gz MVAJIVSKUOBWMU-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1csc(C(F)(F)F)c1)Cc1ccc(Cl)nc1 ZINC000862215733 1049478747 /nfs/dbraw/zinc/47/87/47/1049478747.db2.gz MVAJIVSKUOBWMU-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO Oc1ccc2c(c1)CC[N@@H+](Cc1ccc(Cl)c(Cl)c1)C2 ZINC001203804316 1049486227 /nfs/dbraw/zinc/48/62/27/1049486227.db2.gz PQKSXDUGSCJVQQ-UHFFFAOYSA-N 1 2 308.208 4.257 20 0 DIADLO Oc1ccc2c(c1)CC[N@H+](Cc1ccc(Cl)c(Cl)c1)C2 ZINC001203804316 1049486237 /nfs/dbraw/zinc/48/62/37/1049486237.db2.gz PQKSXDUGSCJVQQ-UHFFFAOYSA-N 1 2 308.208 4.257 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3)o2)[nH]1 ZINC000486876299 1049486526 /nfs/dbraw/zinc/48/65/26/1049486526.db2.gz CANGGLYZBMZFGV-KBPBESRZSA-N 1 2 324.428 4.429 20 0 DIADLO Fc1cccc(OC(F)(F)F)c1C[N@@H+]1CCCC2(CC2)C1 ZINC001205493488 1049486677 /nfs/dbraw/zinc/48/66/77/1049486677.db2.gz XJWBFDLEJUCPMR-UHFFFAOYSA-N 1 2 303.299 4.100 20 0 DIADLO Fc1cccc(OC(F)(F)F)c1C[N@H+]1CCCC2(CC2)C1 ZINC001205493488 1049486678 /nfs/dbraw/zinc/48/66/78/1049486678.db2.gz XJWBFDLEJUCPMR-UHFFFAOYSA-N 1 2 303.299 4.100 20 0 DIADLO c1coc(-c2ncc(CNc3ccc(-n4cc[nH+]c4)cc3)s2)c1 ZINC000486937582 1049496854 /nfs/dbraw/zinc/49/68/54/1049496854.db2.gz PBQLOWFSHMGYGG-UHFFFAOYSA-N 1 2 322.393 4.201 20 0 DIADLO CO[C@@H](C[NH2+]CC(F)(F)c1ccc(Cl)cc1)C1CCCC1 ZINC001181621780 1049497487 /nfs/dbraw/zinc/49/74/87/1049497487.db2.gz ICTBEWDIXDQGCC-HNNXBMFYSA-N 1 2 317.807 4.227 20 0 DIADLO Cc1cc(C)c(Nc2ccc(C)[nH+]c2C)c(Br)n1 ZINC001203368092 1049512937 /nfs/dbraw/zinc/51/29/37/1049512937.db2.gz UMLLEVRGHHRLCI-UHFFFAOYSA-N 1 2 306.207 4.216 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@H+]1C[C@H]1CCC2(CCCC2)O1 ZINC000794446381 1049515609 /nfs/dbraw/zinc/51/56/09/1049515609.db2.gz RYLRKFFMFYXNQR-ZIAGYGMSSA-N 1 2 308.853 4.010 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@@H+]1C[C@H]1CCC2(CCCC2)O1 ZINC000794446381 1049515619 /nfs/dbraw/zinc/51/56/19/1049515619.db2.gz RYLRKFFMFYXNQR-ZIAGYGMSSA-N 1 2 308.853 4.010 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@H+](C)Cc1ccc(C)cn1 ZINC001205634144 1049515956 /nfs/dbraw/zinc/51/59/56/1049515956.db2.gz OLIZYZPCECQSTK-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@@H+](C)Cc1ccc(C)cn1 ZINC001205634144 1049515967 /nfs/dbraw/zinc/51/59/67/1049515967.db2.gz OLIZYZPCECQSTK-UHFFFAOYSA-N 1 2 304.821 4.074 20 0 DIADLO Cc1cc2ncn(C[N@@H+]3CCC[C@H]3c3ccccc3)c2cc1C ZINC000014308399 1049517745 /nfs/dbraw/zinc/51/77/45/1049517745.db2.gz LBZFJDRYGWMAIV-IBGZPJMESA-N 1 2 305.425 4.448 20 0 DIADLO Cc1cc2ncn(C[N@H+]3CCC[C@H]3c3ccccc3)c2cc1C ZINC000014308399 1049517759 /nfs/dbraw/zinc/51/77/59/1049517759.db2.gz LBZFJDRYGWMAIV-IBGZPJMESA-N 1 2 305.425 4.448 20 0 DIADLO Fc1ccc(C[NH+](Cc2cnoc2)Cc2ccc(F)cc2)cc1 ZINC001205724162 1049543750 /nfs/dbraw/zinc/54/37/50/1049543750.db2.gz HQFUZJAOGUPGHI-UHFFFAOYSA-N 1 2 314.335 4.155 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(F)c2Cl)CC2(CCCCC2)O1 ZINC001195649378 1049554414 /nfs/dbraw/zinc/55/44/14/1049554414.db2.gz ILTSMXNJASTNBG-CYBMUJFWSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(F)c2Cl)CC2(CCCCC2)O1 ZINC001195649378 1049554427 /nfs/dbraw/zinc/55/44/27/1049554427.db2.gz ILTSMXNJASTNBG-CYBMUJFWSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(F)ccc2Cl)CC2(CCCCC2)O1 ZINC001195650560 1049554529 /nfs/dbraw/zinc/55/45/29/1049554529.db2.gz QAYJGDBQXHBPKK-ZDUSSCGKSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(F)ccc2Cl)CC2(CCCCC2)O1 ZINC001195650560 1049554541 /nfs/dbraw/zinc/55/45/41/1049554541.db2.gz QAYJGDBQXHBPKK-ZDUSSCGKSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc(C(C)(C)C)cs2)CC2(CCCCC2)O1 ZINC001195650966 1049554783 /nfs/dbraw/zinc/55/47/83/1049554783.db2.gz TVKVBZUNLRKLCC-CQSZACIVSA-N 1 2 322.518 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc(C(C)(C)C)cs2)CC2(CCCCC2)O1 ZINC001195650966 1049554795 /nfs/dbraw/zinc/55/47/95/1049554795.db2.gz TVKVBZUNLRKLCC-CQSZACIVSA-N 1 2 322.518 4.364 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[N@H+](C)Cc1ccns1 ZINC001195730440 1049556291 /nfs/dbraw/zinc/55/62/91/1049556291.db2.gz ZAIQLCIXHDHDGU-CQSZACIVSA-N 1 2 322.861 4.315 20 0 DIADLO COc1ccc(Cl)c2c1CCC[C@H]2[N@@H+](C)Cc1ccns1 ZINC001195730440 1049556302 /nfs/dbraw/zinc/55/63/02/1049556302.db2.gz ZAIQLCIXHDHDGU-CQSZACIVSA-N 1 2 322.861 4.315 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1ccc(C(=O)OC(C)(C)C)s1 ZINC001182043911 1049562863 /nfs/dbraw/zinc/56/28/63/1049562863.db2.gz QOJZKFXLTBDLOY-UHFFFAOYSA-N 1 2 321.442 4.237 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1ccc(C(=O)OC(C)(C)C)s1 ZINC001182043911 1049562876 /nfs/dbraw/zinc/56/28/76/1049562876.db2.gz QOJZKFXLTBDLOY-UHFFFAOYSA-N 1 2 321.442 4.237 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2cc(O)ccc2c1 ZINC001205786060 1049562966 /nfs/dbraw/zinc/56/29/66/1049562966.db2.gz FWTOOQYNLGXMAF-UHFFFAOYSA-N 1 2 316.360 4.407 20 0 DIADLO C[C@H]1C[N@H+](CCc2c(Cl)cccc2Cl)CC2(CCC2)O1 ZINC001195756704 1049563075 /nfs/dbraw/zinc/56/30/75/1049563075.db2.gz JAUPBOWJISZJJZ-LBPRGKRZSA-N 1 2 314.256 4.179 20 0 DIADLO C[C@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)CC2(CCC2)O1 ZINC001195756704 1049563088 /nfs/dbraw/zinc/56/30/88/1049563088.db2.gz JAUPBOWJISZJJZ-LBPRGKRZSA-N 1 2 314.256 4.179 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(Br)cc(C(F)(F)F)c2)[C@@H]1C ZINC001182061282 1049566403 /nfs/dbraw/zinc/56/64/03/1049566403.db2.gz CYWVEYJAWSENAG-RKDXNWHRSA-N 1 2 322.168 4.308 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(Br)cc(C(F)(F)F)c2)[C@@H]1C ZINC001182061282 1049566408 /nfs/dbraw/zinc/56/64/08/1049566408.db2.gz CYWVEYJAWSENAG-RKDXNWHRSA-N 1 2 322.168 4.308 20 0 DIADLO CCOc1c(F)c(F)ccc1-c1ccc(-c2c[nH+]cn2C)cc1 ZINC001205818078 1049572183 /nfs/dbraw/zinc/57/21/83/1049572183.db2.gz SUKLLALTIJYRTB-UHFFFAOYSA-N 1 2 314.335 4.431 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@H]1CCCOc2ccc(F)cc21 ZINC000924827842 1049576368 /nfs/dbraw/zinc/57/63/68/1049576368.db2.gz WKSCKTHLEOHUDK-LSDHHAIUSA-N 1 2 316.376 4.003 20 0 DIADLO Cc1ccc(Nc2cc(Br)cnc2Cl)c(C)[nH+]1 ZINC001203370062 1049585655 /nfs/dbraw/zinc/58/56/55/1049585655.db2.gz GAPVLCIGMUTLIH-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1c(-c2ccc(F)c(F)c2OC(C)C)ccc2[nH+]ccn21 ZINC001205874091 1049589451 /nfs/dbraw/zinc/58/94/51/1049589451.db2.gz ORJJTJPYERQZQE-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Cc1nc(C[N@H+]2CCc3ccc(C(C)C)cc3C2)c(C)s1 ZINC001195911825 1049589947 /nfs/dbraw/zinc/58/99/47/1049589947.db2.gz RQTRUDULRFZJAN-UHFFFAOYSA-N 1 2 300.471 4.442 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3ccc(C(C)C)cc3C2)c(C)s1 ZINC001195911825 1049589960 /nfs/dbraw/zinc/58/99/60/1049589960.db2.gz RQTRUDULRFZJAN-UHFFFAOYSA-N 1 2 300.471 4.442 20 0 DIADLO FC(F)(F)CC1C[NH+](Cc2ccc(Oc3ccccc3)o2)C1 ZINC001182215915 1049592094 /nfs/dbraw/zinc/59/20/94/1049592094.db2.gz JPCVQWRJYNCJKU-UHFFFAOYSA-N 1 2 311.303 4.456 20 0 DIADLO COCc1ccc(C[N@H+](Cc2ccco2)Cc2cccnc2)cc1 ZINC000339061969 1049592378 /nfs/dbraw/zinc/59/23/78/1049592378.db2.gz RIWFGAWFLHRPSB-UHFFFAOYSA-N 1 2 322.408 4.023 20 0 DIADLO COCc1ccc(C[N@@H+](Cc2ccco2)Cc2cccnc2)cc1 ZINC000339061969 1049592386 /nfs/dbraw/zinc/59/23/86/1049592386.db2.gz RIWFGAWFLHRPSB-UHFFFAOYSA-N 1 2 322.408 4.023 20 0 DIADLO CC[NH+](CC)[C@H](C(=O)Nc1ccsc1)c1ccccc1Cl ZINC001182218834 1049593420 /nfs/dbraw/zinc/59/34/20/1049593420.db2.gz MCWKTNOHLZHVDY-HNNXBMFYSA-N 1 2 322.861 4.423 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccccn1 ZINC000794563791 1049594977 /nfs/dbraw/zinc/59/49/77/1049594977.db2.gz XILGGJMXGSESRP-IBGZPJMESA-N 1 2 307.397 4.224 20 0 DIADLO CCCCC[C@@H](CC)C(=O)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC000775676611 1049601221 /nfs/dbraw/zinc/60/12/21/1049601221.db2.gz VGBWIBSUWOKCKK-QGZVFWFLSA-N 1 2 313.445 4.095 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2cnn(C3CCC3)c2)c(F)c1 ZINC001182344356 1049630619 /nfs/dbraw/zinc/63/06/19/1049630619.db2.gz INIHFUDOMBADRM-SFHVURJKSA-N 1 2 317.383 4.223 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2cnn(C3CCC3)c2)c(F)c1 ZINC001182344356 1049630625 /nfs/dbraw/zinc/63/06/25/1049630625.db2.gz INIHFUDOMBADRM-SFHVURJKSA-N 1 2 317.383 4.223 20 0 DIADLO Cc1cccc(C[N@@H+]2CCCn3c(cc4ccccc43)C2)c1F ZINC001206056446 1049642992 /nfs/dbraw/zinc/64/29/92/1049642992.db2.gz RITOYSGHYGXYRV-UHFFFAOYSA-N 1 2 308.400 4.495 20 0 DIADLO Cc1cccc(C[N@H+]2CCCn3c(cc4ccccc43)C2)c1F ZINC001206056446 1049642996 /nfs/dbraw/zinc/64/29/96/1049642996.db2.gz RITOYSGHYGXYRV-UHFFFAOYSA-N 1 2 308.400 4.495 20 0 DIADLO Cc1cccc(NC(=S)Nc2ccc(-n3cc[nH+]c3)cc2)c1C ZINC001196385934 1049649052 /nfs/dbraw/zinc/64/90/52/1049649052.db2.gz UJTQFNHCYZZJTK-UHFFFAOYSA-N 1 2 322.437 4.298 20 0 DIADLO Cc1nn(C[N@@H+]2CC[C@H](c3ccc(C)cc3C)C2)c(=S)s1 ZINC000794655273 1049651868 /nfs/dbraw/zinc/65/18/68/1049651868.db2.gz MSXLOKCDNGNYDI-AWEZNQCLSA-N 1 2 319.499 4.046 20 0 DIADLO Cc1nn(C[N@H+]2CC[C@H](c3ccc(C)cc3C)C2)c(=S)s1 ZINC000794655273 1049651874 /nfs/dbraw/zinc/65/18/74/1049651874.db2.gz MSXLOKCDNGNYDI-AWEZNQCLSA-N 1 2 319.499 4.046 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@@H](C3CCCCC3)C2)no1 ZINC001196410930 1049654148 /nfs/dbraw/zinc/65/41/48/1049654148.db2.gz WCCKMRANBKWAGZ-MRXNPFEDSA-N 1 2 305.466 4.205 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@@H](C3CCCCC3)C2)no1 ZINC001196410930 1049654150 /nfs/dbraw/zinc/65/41/50/1049654150.db2.gz WCCKMRANBKWAGZ-MRXNPFEDSA-N 1 2 305.466 4.205 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@H](c2ccccc2)[C@@H](O)c2ccccc2)o1 ZINC000794683103 1049654951 /nfs/dbraw/zinc/65/49/51/1049654951.db2.gz GUSNATFHGLKOEB-LZQZEXGQSA-N 1 2 322.408 4.109 20 0 DIADLO Clc1cnn(C[NH+]2CCC(c3cccc(Cl)c3)CC2)c1 ZINC000794684749 1049655272 /nfs/dbraw/zinc/65/52/72/1049655272.db2.gz YZTDVMKQNUORKX-UHFFFAOYSA-N 1 2 310.228 4.027 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001206127382 1049660681 /nfs/dbraw/zinc/66/06/81/1049660681.db2.gz GNXIDCKTAYUARO-CYBMUJFWSA-N 1 2 309.438 4.258 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1nc(-c2ccccc2)c[nH]1 ZINC001206127382 1049660687 /nfs/dbraw/zinc/66/06/87/1049660687.db2.gz GNXIDCKTAYUARO-CYBMUJFWSA-N 1 2 309.438 4.258 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nnc([C@@H](C)CC)[nH]1)c1ccccc1OC ZINC000488481785 1049661300 /nfs/dbraw/zinc/66/13/00/1049661300.db2.gz UAJUCVUNRLMHBP-KCQAQPDRSA-N 1 2 316.449 4.129 20 0 DIADLO CC(C)[C@@H]1C[C@@H](Nc2ccc(N3CCCCC3)[nH+]c2)CS1 ZINC000488518623 1049671989 /nfs/dbraw/zinc/67/19/89/1049671989.db2.gz SVESUDRJXFAKED-CVEARBPZSA-N 1 2 305.491 4.014 20 0 DIADLO COc1cc(C[NH+]2CCOCC2)ccc1/C=C/c1ccc(C)cc1 ZINC001206177132 1049675137 /nfs/dbraw/zinc/67/51/37/1049675137.db2.gz RLIPVELVSIQYCD-VQHVLOKHSA-N 1 2 323.436 4.006 20 0 DIADLO Fc1ccc(F)c(CNc2ccc(N3CCCC3)c[nH+]2)c1Cl ZINC001182501093 1049678785 /nfs/dbraw/zinc/67/87/85/1049678785.db2.gz YMRPMYVTDLYETO-UHFFFAOYSA-N 1 2 323.774 4.226 20 0 DIADLO F[C@@]1(c2ccccc2)C[C@H]1[NH2+]Cc1cncc(Cl)c1Cl ZINC001182499936 1049678821 /nfs/dbraw/zinc/67/88/21/1049678821.db2.gz REQAHDDEBLJTSK-UKRRQHHQSA-N 1 2 311.187 4.115 20 0 DIADLO Cc1ccccc1-c1ccccc1C[NH+]1CC(OC(F)F)C1 ZINC001206194761 1049680755 /nfs/dbraw/zinc/68/07/55/1049680755.db2.gz MHZAGKDETBJUDO-UHFFFAOYSA-N 1 2 303.352 4.085 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@@H+]1C[C@H](C)OC(C)(C)C1 ZINC000488614924 1049684448 /nfs/dbraw/zinc/68/44/48/1049684448.db2.gz SMAANTODRYAVFZ-NWDGAFQWSA-N 1 2 312.251 4.009 20 0 DIADLO C[C@H](c1ccc(Br)cc1)[N@H+]1C[C@H](C)OC(C)(C)C1 ZINC000488614924 1049684452 /nfs/dbraw/zinc/68/44/52/1049684452.db2.gz SMAANTODRYAVFZ-NWDGAFQWSA-N 1 2 312.251 4.009 20 0 DIADLO CC(C)C[C@@H](C)C[NH2+][C@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001196736845 1049685915 /nfs/dbraw/zinc/68/59/15/1049685915.db2.gz PQDXSCDRMNIPRO-SJLPKXTDSA-N 1 2 319.489 4.211 20 0 DIADLO C[C@H]1CN(c2cccc[nH+]2)C[C@H](c2cccc(C(F)(F)F)c2)O1 ZINC000488686733 1049687302 /nfs/dbraw/zinc/68/73/02/1049687302.db2.gz PHKQPGDYCMKBJJ-SWLSCSKDSA-N 1 2 322.330 4.067 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1cc2ccc(C)cc2[nH]1 ZINC001182666353 1049695660 /nfs/dbraw/zinc/69/56/60/1049695660.db2.gz NAFFIARJVOBEPM-KRWDZBQOSA-N 1 2 316.445 4.028 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1cc2ccc(C)cc2[nH]1 ZINC001182666353 1049695673 /nfs/dbraw/zinc/69/56/73/1049695673.db2.gz NAFFIARJVOBEPM-KRWDZBQOSA-N 1 2 316.445 4.028 20 0 DIADLO Fc1cc(F)c(F)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001206405306 1049726693 /nfs/dbraw/zinc/72/66/93/1049726693.db2.gz BIBUINAAGFUEIK-UHFFFAOYSA-N 1 2 303.287 4.092 20 0 DIADLO COc1ccc(C[NH+]2CCOCC2)cc1-c1ccccc1C1CC1 ZINC001206533197 1049751602 /nfs/dbraw/zinc/75/16/02/1049751602.db2.gz WUENRJMUGMNOLI-UHFFFAOYSA-N 1 2 323.436 4.072 20 0 DIADLO C[C@H]1c2sccc2CC[N@H+]1Cc1noc2c1CC(C)(C)CC2 ZINC001197431650 1049752600 /nfs/dbraw/zinc/75/26/00/1049752600.db2.gz HRHAWFHGYVHRCC-LBPRGKRZSA-N 1 2 316.470 4.370 20 0 DIADLO C[C@H]1c2sccc2CC[N@@H+]1Cc1noc2c1CC(C)(C)CC2 ZINC001197431650 1049752610 /nfs/dbraw/zinc/75/26/10/1049752610.db2.gz HRHAWFHGYVHRCC-LBPRGKRZSA-N 1 2 316.470 4.370 20 0 DIADLO C[C@H]1c2sccc2CC[N@H+]1Cc1cncc(C(F)(F)F)c1 ZINC001197432454 1049752965 /nfs/dbraw/zinc/75/29/65/1049752965.db2.gz WKOPPNQCUYJVKU-JTQLQIEISA-N 1 2 312.360 4.281 20 0 DIADLO C[C@H]1c2sccc2CC[N@@H+]1Cc1cncc(C(F)(F)F)c1 ZINC001197432454 1049752971 /nfs/dbraw/zinc/75/29/71/1049752971.db2.gz WKOPPNQCUYJVKU-JTQLQIEISA-N 1 2 312.360 4.281 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Oc3ccccc3)o2)C2(CCC2)CO1 ZINC001206545205 1049753169 /nfs/dbraw/zinc/75/31/69/1049753169.db2.gz UGAVQBAYJQRODV-OAHLLOKOSA-N 1 2 313.397 4.215 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)o2)C2(CCC2)CO1 ZINC001206545205 1049753176 /nfs/dbraw/zinc/75/31/76/1049753176.db2.gz UGAVQBAYJQRODV-OAHLLOKOSA-N 1 2 313.397 4.215 20 0 DIADLO COCC[N@@H+](Cc1scnc1C)Cc1ccc(C)cc1Cl ZINC000489469714 1049760515 /nfs/dbraw/zinc/76/05/15/1049760515.db2.gz BTODQZFWKXNGAV-UHFFFAOYSA-N 1 2 324.877 4.062 20 0 DIADLO COCC[N@H+](Cc1scnc1C)Cc1ccc(C)cc1Cl ZINC000489469714 1049760505 /nfs/dbraw/zinc/76/05/05/1049760505.db2.gz BTODQZFWKXNGAV-UHFFFAOYSA-N 1 2 324.877 4.062 20 0 DIADLO CCCOc1ccc(F)c(-c2ccc3[nH+]ccn3c2C)c1F ZINC001206748795 1049790585 /nfs/dbraw/zinc/79/05/85/1049790585.db2.gz PAKZJWNTYSNTPQ-UHFFFAOYSA-N 1 2 302.324 4.377 20 0 DIADLO Cc1nc(C[NH+]2CCC(Oc3cccc(Cl)c3)CC2)cs1 ZINC001206801858 1049802360 /nfs/dbraw/zinc/80/23/60/1049802360.db2.gz QBTJBSFSTRFRAA-UHFFFAOYSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3Cl)C2)no1 ZINC001206819987 1049806382 /nfs/dbraw/zinc/80/63/82/1049806382.db2.gz WPUHGBVTFXICMR-LLVKDONJSA-N 1 2 311.212 4.279 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3Cl)C2)no1 ZINC001206819987 1049806384 /nfs/dbraw/zinc/80/63/84/1049806384.db2.gz WPUHGBVTFXICMR-LLVKDONJSA-N 1 2 311.212 4.279 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1cc(-c3ccc(F)cc3)on1)C2 ZINC001206840346 1049810600 /nfs/dbraw/zinc/81/06/00/1049810600.db2.gz ZQAMCAHNTHMFTA-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1cc(-c3ccc(F)cc3)on1)C2 ZINC001206840346 1049810613 /nfs/dbraw/zinc/81/06/13/1049810613.db2.gz ZQAMCAHNTHMFTA-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO CCCCOc1ccc(C(=O)Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC000490222048 1049811476 /nfs/dbraw/zinc/81/14/76/1049811476.db2.gz CBVQJMPGQRLGKP-UHFFFAOYSA-N 1 2 323.396 4.074 20 0 DIADLO Fc1cncc(F)c1C[N@@H+]1CC[C@@H](c2ccccc2Cl)C1 ZINC001206860656 1049815729 /nfs/dbraw/zinc/81/57/29/1049815729.db2.gz JADTUIUCCBYTSN-LLVKDONJSA-N 1 2 308.759 4.003 20 0 DIADLO Fc1cncc(F)c1C[N@H+]1CC[C@@H](c2ccccc2Cl)C1 ZINC001206860656 1049815736 /nfs/dbraw/zinc/81/57/36/1049815736.db2.gz JADTUIUCCBYTSN-LLVKDONJSA-N 1 2 308.759 4.003 20 0 DIADLO CC[N@H+](Cc1cccc(C(F)(F)F)c1)Cc1ncccc1F ZINC001207036662 1049822799 /nfs/dbraw/zinc/82/27/99/1049822799.db2.gz UVTYYLNAGHWOAW-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1cccc(C(F)(F)F)c1)Cc1ncccc1F ZINC001207036662 1049822804 /nfs/dbraw/zinc/82/28/04/1049822804.db2.gz UVTYYLNAGHWOAW-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@H+](Cc1ccc(Br)cc1)Cc1ncccc1F ZINC001207034846 1049823463 /nfs/dbraw/zinc/82/34/63/1049823463.db2.gz ZJLNBDPFGXGWOZ-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1ccc(Br)cc1)Cc1ncccc1F ZINC001207034846 1049823471 /nfs/dbraw/zinc/82/34/71/1049823471.db2.gz ZJLNBDPFGXGWOZ-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CCc1nccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)s2)n1 ZINC001207087552 1049832331 /nfs/dbraw/zinc/83/23/31/1049832331.db2.gz BIARZAZVRRFVOF-GFCCVEGCSA-N 1 2 307.850 4.091 20 0 DIADLO CCc1nccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)n1 ZINC001207087552 1049832341 /nfs/dbraw/zinc/83/23/41/1049832341.db2.gz BIARZAZVRRFVOF-GFCCVEGCSA-N 1 2 307.850 4.091 20 0 DIADLO Cc1nccc(C[N@H+](C)Cc2sc3ccccc3c2Cl)n1 ZINC001207166737 1049847964 /nfs/dbraw/zinc/84/79/64/1049847964.db2.gz XJUFYODRAKAYTP-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO Cc1nccc(C[N@@H+](C)Cc2sc3ccccc3c2Cl)n1 ZINC001207166737 1049847980 /nfs/dbraw/zinc/84/79/80/1049847980.db2.gz XJUFYODRAKAYTP-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO Cc1nccc(C[N@@H+](C)Cc2ccccc2Oc2ccccc2)n1 ZINC001207168571 1049849776 /nfs/dbraw/zinc/84/97/76/1049849776.db2.gz KUNPCSUMIFCQJR-UHFFFAOYSA-N 1 2 319.408 4.209 20 0 DIADLO Cc1nccc(C[N@H+](C)Cc2ccccc2Oc2ccccc2)n1 ZINC001207168571 1049849783 /nfs/dbraw/zinc/84/97/83/1049849783.db2.gz KUNPCSUMIFCQJR-UHFFFAOYSA-N 1 2 319.408 4.209 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1cnn(C2CCC2)c1 ZINC000924856210 1049862058 /nfs/dbraw/zinc/86/20/58/1049862058.db2.gz AAJVQMCINYBRRN-LLVKDONJSA-N 1 2 307.800 4.251 20 0 DIADLO CC(C)(C[NH+]1C[C@@H](F)[C@H](F)C1)Sc1ccc(Cl)cc1 ZINC001207295170 1049877536 /nfs/dbraw/zinc/87/75/36/1049877536.db2.gz KCZXEUCUFDJRRD-CHWSQXEVSA-N 1 2 305.821 4.203 20 0 DIADLO CCOc1cc(CNc2c[nH+]c(C)c(C)c2)cc(Cl)c1O ZINC001207327024 1049880915 /nfs/dbraw/zinc/88/09/15/1049880915.db2.gz WGJCDEIEKJQESU-UHFFFAOYSA-N 1 2 306.793 4.068 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCS[C@H](C(F)(F)F)C2)c1 ZINC001207566506 1049910588 /nfs/dbraw/zinc/91/05/88/1049910588.db2.gz XONYBAZWVPBCTO-LBPRGKRZSA-N 1 2 309.784 4.128 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCS[C@H](C(F)(F)F)C2)c1 ZINC001207566506 1049910609 /nfs/dbraw/zinc/91/06/09/1049910609.db2.gz XONYBAZWVPBCTO-LBPRGKRZSA-N 1 2 309.784 4.128 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2cncs2)CC2CC2)c(Cl)c1 ZINC000571006459 1049918808 /nfs/dbraw/zinc/91/88/08/1049918808.db2.gz SWKQDEXQZBSILS-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO Fc1ccc(C[N@H+](Cc2cncs2)CC2CC2)c(Cl)c1 ZINC000571006459 1049918815 /nfs/dbraw/zinc/91/88/15/1049918815.db2.gz SWKQDEXQZBSILS-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO FC(F)(F)c1n[nH]c2c1CC[N@H+](CC1(c3ccccc3)CC1)C2 ZINC001207840896 1049943062 /nfs/dbraw/zinc/94/30/62/1049943062.db2.gz OJVJLKZUYZPDQJ-HNNXBMFYSA-N 1 2 321.346 4.075 20 0 DIADLO FC(F)(F)c1n[nH]c2c1CC[N@@H+](CC1(c3ccccc3)CC1)C2 ZINC001207840896 1049943073 /nfs/dbraw/zinc/94/30/73/1049943073.db2.gz OJVJLKZUYZPDQJ-HNNXBMFYSA-N 1 2 321.346 4.075 20 0 DIADLO CC/C=C\CCC[N@@H+]1CCc2nc(Br)sc2C1 ZINC001208135517 1049977136 /nfs/dbraw/zinc/97/71/36/1049977136.db2.gz FSPXSXDHNJTNDC-ARJAWSKDSA-N 1 2 315.280 4.010 20 0 DIADLO CC/C=C\CCC[N@H+]1CCc2nc(Br)sc2C1 ZINC001208135517 1049977140 /nfs/dbraw/zinc/97/71/40/1049977140.db2.gz FSPXSXDHNJTNDC-ARJAWSKDSA-N 1 2 315.280 4.010 20 0 DIADLO Cc1ccc([C@H](C)CC[N@@H+]2CCCC[C@H]2c2noc(C)n2)o1 ZINC001208154266 1049978452 /nfs/dbraw/zinc/97/84/52/1049978452.db2.gz FCNJOCBMQWCECX-DOMZBBRYSA-N 1 2 303.406 4.000 20 0 DIADLO Cc1ccc([C@H](C)CC[N@H+]2CCCC[C@H]2c2noc(C)n2)o1 ZINC001208154266 1049978456 /nfs/dbraw/zinc/97/84/56/1049978456.db2.gz FCNJOCBMQWCECX-DOMZBBRYSA-N 1 2 303.406 4.000 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2cscn2)c(OC(F)F)cc1C ZINC000572379314 1050001614 /nfs/dbraw/zinc/00/16/14/1050001614.db2.gz BTEGUDRHJDYPLC-LLVKDONJSA-N 1 2 312.385 4.212 20 0 DIADLO Cc1cn2cc(NC(=O)C3(c4ccccc4)CCCC3)ccc2[nH+]1 ZINC000588859199 1050006697 /nfs/dbraw/zinc/00/66/97/1050006697.db2.gz DZUNBOAMQUTNLG-UHFFFAOYSA-N 1 2 319.408 4.093 20 0 DIADLO FC1(F)CCC[N@H+](CCCc2cccc(Br)c2)C1 ZINC001208820603 1050013122 /nfs/dbraw/zinc/01/31/22/1050013122.db2.gz PCPSCWDUVPLXGS-UHFFFAOYSA-N 1 2 318.205 4.113 20 0 DIADLO FC1(F)CCC[N@@H+](CCCc2cccc(Br)c2)C1 ZINC001208820603 1050013125 /nfs/dbraw/zinc/01/31/25/1050013125.db2.gz PCPSCWDUVPLXGS-UHFFFAOYSA-N 1 2 318.205 4.113 20 0 DIADLO C[C@H](C[N@@H+]1CCO[C@](C)(c2ccc(Cl)cc2)C1)C(F)(F)F ZINC001208890326 1050020462 /nfs/dbraw/zinc/02/04/62/1050020462.db2.gz DEZBJGIHLQGYHO-RISCZKNCSA-N 1 2 321.770 4.086 20 0 DIADLO C[C@H](C[N@H+]1CCO[C@](C)(c2ccc(Cl)cc2)C1)C(F)(F)F ZINC001208890326 1050020465 /nfs/dbraw/zinc/02/04/65/1050020465.db2.gz DEZBJGIHLQGYHO-RISCZKNCSA-N 1 2 321.770 4.086 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)C[C@@H](C)C(F)(F)F ZINC001208899992 1050021924 /nfs/dbraw/zinc/02/19/24/1050021924.db2.gz INBZDSVDQKEPQD-TZMCWYRMSA-N 1 2 301.352 4.168 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)C[C@@H](C)C(F)(F)F ZINC001208899992 1050021927 /nfs/dbraw/zinc/02/19/27/1050021927.db2.gz INBZDSVDQKEPQD-TZMCWYRMSA-N 1 2 301.352 4.168 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)C[C@H](C)C(F)(F)F ZINC001208899983 1050022382 /nfs/dbraw/zinc/02/23/82/1050022382.db2.gz INBZDSVDQKEPQD-GXTWGEPZSA-N 1 2 301.352 4.168 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)C[C@H](C)C(F)(F)F ZINC001208899983 1050022388 /nfs/dbraw/zinc/02/23/88/1050022388.db2.gz INBZDSVDQKEPQD-GXTWGEPZSA-N 1 2 301.352 4.168 20 0 DIADLO C1=CSC(=C2SC=C(C[NH+]3CCSCC3)S2)S1 ZINC001209087882 1050034402 /nfs/dbraw/zinc/03/44/02/1050034402.db2.gz IIVOLTMITXFNRU-UHFFFAOYSA-N 1 2 319.567 4.434 20 0 DIADLO Fc1ccc2oc(C[N@@H+]3CC[C@](F)(c4ccccc4)C3)nc2c1 ZINC000572783624 1050043323 /nfs/dbraw/zinc/04/33/23/1050043323.db2.gz ZCUBPRZRSBBTEL-GOSISDBHSA-N 1 2 314.335 4.038 20 0 DIADLO Fc1ccc2oc(C[N@H+]3CC[C@](F)(c4ccccc4)C3)nc2c1 ZINC000572783624 1050043326 /nfs/dbraw/zinc/04/33/26/1050043326.db2.gz ZCUBPRZRSBBTEL-GOSISDBHSA-N 1 2 314.335 4.038 20 0 DIADLO C[C@]1(F)CC[N@H+](CCc2ccccc2C(F)(F)F)C[C@@H]1F ZINC001209278768 1050048992 /nfs/dbraw/zinc/04/89/92/1050048992.db2.gz XMCNHSDTEYOCGO-KBPBESRZSA-N 1 2 307.306 4.020 20 0 DIADLO C[C@]1(F)CC[N@@H+](CCc2ccccc2C(F)(F)F)C[C@@H]1F ZINC001209278768 1050048997 /nfs/dbraw/zinc/04/89/97/1050048997.db2.gz XMCNHSDTEYOCGO-KBPBESRZSA-N 1 2 307.306 4.020 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000589598648 1050050042 /nfs/dbraw/zinc/05/00/42/1050050042.db2.gz UWIQUAOKWOXXOS-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000589598648 1050050045 /nfs/dbraw/zinc/05/00/45/1050050045.db2.gz UWIQUAOKWOXXOS-ACJLOTCBSA-N 1 2 303.352 4.099 20 0 DIADLO C[C@@H]([NH2+]Cc1n[nH]c2ccccc21)c1ccc(OC(F)F)cc1 ZINC000589638930 1050051406 /nfs/dbraw/zinc/05/14/06/1050051406.db2.gz HFCQMXKPRJCNET-LLVKDONJSA-N 1 2 317.339 4.015 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)cs1 ZINC000589642459 1050052857 /nfs/dbraw/zinc/05/28/57/1050052857.db2.gz GICSRLJGHIONDG-UHFFFAOYSA-N 1 2 320.767 4.414 20 0 DIADLO Cc1cc(C)cc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1 ZINC000589707357 1050055368 /nfs/dbraw/zinc/05/53/68/1050055368.db2.gz IZBUCJUIWMATAR-LJQANCHMSA-N 1 2 317.379 4.155 20 0 DIADLO Cc1cc(C)cc(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1 ZINC000589707357 1050055371 /nfs/dbraw/zinc/05/53/71/1050055371.db2.gz IZBUCJUIWMATAR-LJQANCHMSA-N 1 2 317.379 4.155 20 0 DIADLO CCc1ccc([C@@H](C)C(=O)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000589903709 1050066297 /nfs/dbraw/zinc/06/62/97/1050066297.db2.gz KORWLOVVNSYRMT-OAHLLOKOSA-N 1 2 319.408 4.177 20 0 DIADLO CCc1ccc([C@@H](C)C(=O)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC000589942801 1050069073 /nfs/dbraw/zinc/06/90/73/1050069073.db2.gz PIRQPDAJQRFNII-OAHLLOKOSA-N 1 2 319.408 4.177 20 0 DIADLO c1cc(C[N@@H+]2CCSC[C@H]2c2cccc3ccccc32)no1 ZINC001209569673 1050069875 /nfs/dbraw/zinc/06/98/75/1050069875.db2.gz JSENIDAWTBTXAZ-SFHVURJKSA-N 1 2 310.422 4.118 20 0 DIADLO c1cc(C[N@H+]2CCSC[C@H]2c2cccc3ccccc32)no1 ZINC001209569673 1050069882 /nfs/dbraw/zinc/06/98/82/1050069882.db2.gz JSENIDAWTBTXAZ-SFHVURJKSA-N 1 2 310.422 4.118 20 0 DIADLO Cc1cc(Cl)ncc1C[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001209635492 1050072382 /nfs/dbraw/zinc/07/23/82/1050072382.db2.gz GCWCKKQJOPBLOY-INIZCTEOSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1cc(Cl)ncc1C[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001209635492 1050072386 /nfs/dbraw/zinc/07/23/86/1050072386.db2.gz GCWCKKQJOPBLOY-INIZCTEOSA-N 1 2 301.821 4.166 20 0 DIADLO Fc1ccccc1C[NH2+][C@H](CN1CCCCC1)c1ccccc1 ZINC000590075078 1050074009 /nfs/dbraw/zinc/07/40/09/1050074009.db2.gz OOFMKJWQSQXRBF-HXUWFJFHSA-N 1 2 312.432 4.143 20 0 DIADLO COc1c(Cl)ccc(C[N@@H+]2CCC[C@H]2c2cccnc2)c1F ZINC001209699012 1050076953 /nfs/dbraw/zinc/07/69/53/1050076953.db2.gz MOMYCGAZVQYWDS-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(Cl)ccc(C[N@H+]2CCC[C@H]2c2cccnc2)c1F ZINC001209699012 1050076955 /nfs/dbraw/zinc/07/69/55/1050076955.db2.gz MOMYCGAZVQYWDS-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H]1C[N@H+](Cc2[nH]nc3ccc(Cl)cc32)Cc2ccccc21 ZINC001209751227 1050080356 /nfs/dbraw/zinc/08/03/56/1050080356.db2.gz OGWQUWGVRDOALA-GFCCVEGCSA-N 1 2 311.816 4.336 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2[nH]nc3ccc(Cl)cc32)Cc2ccccc21 ZINC001209751227 1050080361 /nfs/dbraw/zinc/08/03/61/1050080361.db2.gz OGWQUWGVRDOALA-GFCCVEGCSA-N 1 2 311.816 4.336 20 0 DIADLO C[C@@H]1C[N@H+](Cc2n[nH]c3ccc(Cl)cc32)Cc2ccccc21 ZINC001209751227 1050080366 /nfs/dbraw/zinc/08/03/66/1050080366.db2.gz OGWQUWGVRDOALA-GFCCVEGCSA-N 1 2 311.816 4.336 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2n[nH]c3ccc(Cl)cc32)Cc2ccccc21 ZINC001209751227 1050080371 /nfs/dbraw/zinc/08/03/71/1050080371.db2.gz OGWQUWGVRDOALA-GFCCVEGCSA-N 1 2 311.816 4.336 20 0 DIADLO CCC[C@@H]([NH2+]Cc1ncc(CSC)s1)c1ccccn1 ZINC000590185659 1050080449 /nfs/dbraw/zinc/08/04/49/1050080449.db2.gz TVYKPYMOAXRZDA-CYBMUJFWSA-N 1 2 307.488 4.032 20 0 DIADLO Clc1ccc2[nH]nc(C[N@@H+]3CCCc4ccccc4C3)c2c1 ZINC001209754430 1050080620 /nfs/dbraw/zinc/08/06/20/1050080620.db2.gz CDJDHBRNBAABLP-UHFFFAOYSA-N 1 2 311.816 4.165 20 0 DIADLO Clc1ccc2[nH]nc(C[N@H+]3CCCc4ccccc4C3)c2c1 ZINC001209754430 1050080624 /nfs/dbraw/zinc/08/06/24/1050080624.db2.gz CDJDHBRNBAABLP-UHFFFAOYSA-N 1 2 311.816 4.165 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](C)c2nc3ccccc3s2)s1 ZINC000224319488 1050091197 /nfs/dbraw/zinc/09/11/97/1050091197.db2.gz RQFSSCRDQVIVFN-JTQLQIEISA-N 1 2 303.456 4.166 20 0 DIADLO Fc1ccc(-c2cc(Nc3ccc4[nH]c[nH+]c4c3)on2)cc1F ZINC001209841342 1050093893 /nfs/dbraw/zinc/09/38/93/1050093893.db2.gz JKFHFFUELVNLHD-UHFFFAOYSA-N 1 2 312.279 4.240 20 0 DIADLO CC(C)c1ccc(C[N@H+](Cc2ncc(Cl)n2C)C2CC2)cc1 ZINC000057621690 1050103533 /nfs/dbraw/zinc/10/35/33/1050103533.db2.gz DKKXFUIGERHVQE-UHFFFAOYSA-N 1 2 317.864 4.362 20 0 DIADLO CC(C)c1ccc(C[N@@H+](Cc2ncc(Cl)n2C)C2CC2)cc1 ZINC000057621690 1050103534 /nfs/dbraw/zinc/10/35/34/1050103534.db2.gz DKKXFUIGERHVQE-UHFFFAOYSA-N 1 2 317.864 4.362 20 0 DIADLO CCCCC[N@H+](Cc1ncc(Cl)n1C)Cc1ccc(F)cc1 ZINC000057622466 1050103781 /nfs/dbraw/zinc/10/37/81/1050103781.db2.gz BDGNXZDEVMXTEC-UHFFFAOYSA-N 1 2 323.843 4.405 20 0 DIADLO CCCCC[N@@H+](Cc1ncc(Cl)n1C)Cc1ccc(F)cc1 ZINC000057622466 1050103783 /nfs/dbraw/zinc/10/37/83/1050103783.db2.gz BDGNXZDEVMXTEC-UHFFFAOYSA-N 1 2 323.843 4.405 20 0 DIADLO Cc1cc(Nc2ccccc2C[NH+]2CCOCC2)ccc1Cl ZINC001209928641 1050107888 /nfs/dbraw/zinc/10/78/88/1050107888.db2.gz GMXYVCZBCNKYMK-UHFFFAOYSA-N 1 2 316.832 4.224 20 0 DIADLO Cc1cccc(Nc2ccccc2C[NH+]2CCOCC2)c1Cl ZINC001209933595 1050108049 /nfs/dbraw/zinc/10/80/49/1050108049.db2.gz UEPVIAINDCLDIL-UHFFFAOYSA-N 1 2 316.832 4.224 20 0 DIADLO CCc1cccc(C)c1Nc1ccccc1C[NH+]1CCOCC1 ZINC001209930946 1050108128 /nfs/dbraw/zinc/10/81/28/1050108128.db2.gz XEHBXJVBUFIZDX-UHFFFAOYSA-N 1 2 310.441 4.133 20 0 DIADLO CCOc1cccc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)C)no2)c1 ZINC000068839572 1050111445 /nfs/dbraw/zinc/11/14/45/1050111445.db2.gz CYVZTWLCSDPVRG-STQMWFEESA-N 1 2 303.406 4.004 20 0 DIADLO Cc1noc([C@@H](C)[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)n1 ZINC000590948850 1050115104 /nfs/dbraw/zinc/11/51/04/1050115104.db2.gz AZAQMILPLMZWGU-NWDGAFQWSA-N 1 2 305.447 4.290 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)n1 ZINC000590948851 1050115133 /nfs/dbraw/zinc/11/51/33/1050115133.db2.gz AZAQMILPLMZWGU-RYUDHWBXSA-N 1 2 305.447 4.290 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@H](C)c2ccc(SC(C)C)cc2)n1 ZINC000590948849 1050115214 /nfs/dbraw/zinc/11/52/14/1050115214.db2.gz AZAQMILPLMZWGU-NEPJUHHUSA-N 1 2 305.447 4.290 20 0 DIADLO Cc1cc(Nc2cc(O)ccc2Br)ccc1[NH+](C)C ZINC001210040713 1050127504 /nfs/dbraw/zinc/12/75/04/1050127504.db2.gz AIKHYQPMXYYCOI-UHFFFAOYSA-N 1 2 321.218 4.273 20 0 DIADLO FC(F)(F)c1ccncc1Nc1ccccc1-n1cc[nH+]c1 ZINC001210094819 1050135359 /nfs/dbraw/zinc/13/53/59/1050135359.db2.gz ZTOATDMVKRGKGN-UHFFFAOYSA-N 1 2 304.275 4.030 20 0 DIADLO Cc1cc2n[nH]cc2cc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001210100209 1050136125 /nfs/dbraw/zinc/13/61/25/1050136125.db2.gz IIHMSGAWOSYPLU-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO COc1ccc2ccccc2c1-n1c(C)[nH+]c2ccc(N)cc21 ZINC001210169787 1050148497 /nfs/dbraw/zinc/14/84/97/1050148497.db2.gz KDIVUTQXCPWVKZ-UHFFFAOYSA-N 1 2 303.365 4.078 20 0 DIADLO Cc1cc(N[C@@H]2CCc3ccc(O)cc3C2)[nH+]cc1C(F)(F)F ZINC001171027965 1050151748 /nfs/dbraw/zinc/15/17/48/1050151748.db2.gz IWABLYXETCHDEP-CYBMUJFWSA-N 1 2 322.330 4.084 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCC[N@@H+]1Cc1ccco1 ZINC000770337070 1050152299 /nfs/dbraw/zinc/15/22/99/1050152299.db2.gz QDWPYVUVXIUXBH-HNNXBMFYSA-N 1 2 321.852 4.431 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCC[N@H+]1Cc1ccco1 ZINC000770337070 1050152303 /nfs/dbraw/zinc/15/23/03/1050152303.db2.gz QDWPYVUVXIUXBH-HNNXBMFYSA-N 1 2 321.852 4.431 20 0 DIADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ncc(-c2ccccc2)s1 ZINC000573283233 1050153651 /nfs/dbraw/zinc/15/36/51/1050153651.db2.gz DMZWQEFKLCHORP-YJYMSZOUSA-N 1 2 322.433 4.422 20 0 DIADLO CCCCC[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C(C)(C)C ZINC001136774151 1050153552 /nfs/dbraw/zinc/15/35/52/1050153552.db2.gz SZHKHCODGDASMM-MRXNPFEDSA-N 1 2 301.434 4.288 20 0 DIADLO C[N@H+](CC1CCCC1)Cn1nc(-c2ccccc2F)oc1=S ZINC000746504647 1050157756 /nfs/dbraw/zinc/15/77/56/1050157756.db2.gz KBHQJGRJJLMWNB-UHFFFAOYSA-N 1 2 321.421 4.091 20 0 DIADLO C[N@@H+](CC1CCCC1)Cn1nc(-c2ccccc2F)oc1=S ZINC000746504647 1050157763 /nfs/dbraw/zinc/15/77/63/1050157763.db2.gz KBHQJGRJJLMWNB-UHFFFAOYSA-N 1 2 321.421 4.091 20 0 DIADLO CC(C)(C)c1ccc(CCC(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC000733881466 1050161753 /nfs/dbraw/zinc/16/17/53/1050161753.db2.gz OULFWTBCRVSBQB-UHFFFAOYSA-N 1 2 321.424 4.203 20 0 DIADLO Cc1cnc([C@@H]([NH2+]Cc2nc(C3CC3)cs2)C2CC2)s1 ZINC000347954475 1050164156 /nfs/dbraw/zinc/16/41/56/1050164156.db2.gz HEAUILJJBSXZKK-AWEZNQCLSA-N 1 2 305.472 4.026 20 0 DIADLO Cc1cnc([C@@H](C)[NH+]2CCC(=Cc3cccc(F)c3)CC2)o1 ZINC000573335139 1050164932 /nfs/dbraw/zinc/16/49/32/1050164932.db2.gz HTPYCAFSDASFAJ-CQSZACIVSA-N 1 2 300.377 4.363 20 0 DIADLO NC(=O)c1c2c(sc1Nc1cccc3cc[nH+]cc31)CCCC2 ZINC001210223685 1050166009 /nfs/dbraw/zinc/16/60/09/1050166009.db2.gz DCNTZQCBIHWYTD-UHFFFAOYSA-N 1 2 323.421 4.018 20 0 DIADLO CC(=O)c1oc2cccnc2c1Nc1cccc2cc[nH+]cc21 ZINC001210225065 1050167809 /nfs/dbraw/zinc/16/78/09/1050167809.db2.gz CGIJUJLZSPWBOI-UHFFFAOYSA-N 1 2 303.321 4.322 20 0 DIADLO Fc1nc(Nc2cccc3cc[nH+]cc32)c(F)c(Cl)c1F ZINC001210225852 1050168145 /nfs/dbraw/zinc/16/81/45/1050168145.db2.gz LZPYGHUNGXAZJH-UHFFFAOYSA-N 1 2 309.678 4.444 20 0 DIADLO COC(=O)c1cc(Nc2cccc3cc[nH+]cc32)c(F)cc1F ZINC001210229908 1050168482 /nfs/dbraw/zinc/16/84/82/1050168482.db2.gz BGYCSFXXDNMWLM-UHFFFAOYSA-N 1 2 314.291 4.043 20 0 DIADLO Cc1cc(NCc2occc2Br)ccc1[NH+](C)C ZINC000770528467 1050169743 /nfs/dbraw/zinc/16/97/43/1050169743.db2.gz XDAADFWRHCCAHX-UHFFFAOYSA-N 1 2 309.207 4.029 20 0 DIADLO c1cn(-c2cccc(NCc3cnc4ccccc4c3)c2)c[nH+]1 ZINC000770528514 1050169790 /nfs/dbraw/zinc/16/97/90/1050169790.db2.gz YJYWNESMHIDOCG-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO Fc1cc(NCc2cnc3ccccc3c2)ccc1-n1cc[nH+]c1 ZINC000770529733 1050170196 /nfs/dbraw/zinc/17/01/96/1050170196.db2.gz RSINVNWYWILUGB-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(C)on2)cc1OCC ZINC000282669640 1050172053 /nfs/dbraw/zinc/17/20/53/1050172053.db2.gz JAYHGSZYAAASRM-ZIAGYGMSSA-N 1 2 318.417 4.192 20 0 DIADLO FC(F)(F)c1ccccc1CCNc1cc2cc[nH]c2c[nH+]1 ZINC001171038977 1050172656 /nfs/dbraw/zinc/17/26/56/1050172656.db2.gz DOBOJMGCEUQGIX-UHFFFAOYSA-N 1 2 305.303 4.236 20 0 DIADLO Cn1c[nH+]c2ccc(NCCc3ccccc3C(F)(F)F)cc21 ZINC001171040845 1050176099 /nfs/dbraw/zinc/17/60/99/1050176099.db2.gz GYZSSHXZDCDIBX-UHFFFAOYSA-N 1 2 319.330 4.247 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+](C)Cc2csc3ccccc23)o1 ZINC000348063283 1050178702 /nfs/dbraw/zinc/17/87/02/1050178702.db2.gz LYECHTFEJXBVCL-LLVKDONJSA-N 1 2 301.415 4.040 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+](C)Cc2csc3ccccc23)o1 ZINC000348063283 1050178708 /nfs/dbraw/zinc/17/87/08/1050178708.db2.gz LYECHTFEJXBVCL-LLVKDONJSA-N 1 2 301.415 4.040 20 0 DIADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)o1 ZINC000770616682 1050180167 /nfs/dbraw/zinc/18/01/67/1050180167.db2.gz WTUKQOZPYFIXQN-QWRGUYRKSA-N 1 2 314.307 4.293 20 0 DIADLO Fc1cc(C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)c(F)cn1 ZINC000824136041 1050183854 /nfs/dbraw/zinc/18/38/54/1050183854.db2.gz SUVWAOAVZFIYHC-HLRDLLSLSA-N 1 2 300.352 4.038 20 0 DIADLO Fc1cc(C[N@H+]2CCC[C@@H]2/C=C\c2ccccc2)c(F)cn1 ZINC000824136041 1050183862 /nfs/dbraw/zinc/18/38/62/1050183862.db2.gz SUVWAOAVZFIYHC-HLRDLLSLSA-N 1 2 300.352 4.038 20 0 DIADLO FC(F)C(F)(F)C[N@H+](CCc1ccccc1)C1CCCC1 ZINC000733898467 1050188637 /nfs/dbraw/zinc/18/86/37/1050188637.db2.gz ITRJYULOZWTFRL-UHFFFAOYSA-N 1 2 303.343 4.374 20 0 DIADLO FC(F)C(F)(F)C[N@@H+](CCc1ccccc1)C1CCCC1 ZINC000733898467 1050188644 /nfs/dbraw/zinc/18/86/44/1050188644.db2.gz ITRJYULOZWTFRL-UHFFFAOYSA-N 1 2 303.343 4.374 20 0 DIADLO Cc1[nH+]cc(-n2c(-c3ccccc3)cc3cc(N)ccc32)cc1N ZINC001210289412 1050191203 /nfs/dbraw/zinc/19/12/03/1050191203.db2.gz KLNUCWBXRBOHJB-UHFFFAOYSA-N 1 2 314.392 4.165 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(OC(F)(F)F)cc2Cl)cc1N ZINC001210288153 1050191442 /nfs/dbraw/zinc/19/14/42/1050191442.db2.gz LVMKLZLBMMTCJL-UHFFFAOYSA-N 1 2 317.698 4.268 20 0 DIADLO Cc1[nH+]cc(Nc2cc(C(F)(F)F)c(F)cc2F)cc1N ZINC001210290453 1050191489 /nfs/dbraw/zinc/19/14/89/1050191489.db2.gz LQVYYMVJJCGWJW-UHFFFAOYSA-N 1 2 303.234 4.013 20 0 DIADLO Cc1cc(Oc2ccccc2)ncc1Nc1c[nH+]c(C)c(N)c1 ZINC001210288155 1050191622 /nfs/dbraw/zinc/19/16/22/1050191622.db2.gz CBBXUBSKVMJQFU-UHFFFAOYSA-N 1 2 306.369 4.212 20 0 DIADLO Cc1[nH+]cc(Nc2cc(F)c(C(F)(F)F)c(F)c2)cc1N ZINC001210291606 1050191893 /nfs/dbraw/zinc/19/18/93/1050191893.db2.gz OMWOYOULHLSGRB-UHFFFAOYSA-N 1 2 303.234 4.013 20 0 DIADLO Cc1[nH+]cc(-n2c(-c3ccccc3N)cc3ccccc32)cc1N ZINC001210289548 1050192425 /nfs/dbraw/zinc/19/24/25/1050192425.db2.gz QPSVJWHULQNCFJ-UHFFFAOYSA-N 1 2 314.392 4.165 20 0 DIADLO Cc1[nH+]cc(Nc2ccccc2-c2ccc(Cl)cn2)cc1N ZINC001210294476 1050194014 /nfs/dbraw/zinc/19/40/14/1050194014.db2.gz YXMJEIDCTHUDLL-UHFFFAOYSA-N 1 2 310.788 4.431 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CCC[C@@H](F)CC2)cc1Br ZINC001136849342 1050195562 /nfs/dbraw/zinc/19/55/62/1050195562.db2.gz HTDVMMOEJYENSV-SNVBAGLBSA-N 1 2 322.168 4.051 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CCC[C@@H](F)CC2)cc1Br ZINC001136849342 1050195565 /nfs/dbraw/zinc/19/55/65/1050195565.db2.gz HTDVMMOEJYENSV-SNVBAGLBSA-N 1 2 322.168 4.051 20 0 DIADLO CSc1ccccc1C[N@H+](C)Cc1ccnc(Cl)c1F ZINC000824314677 1050197268 /nfs/dbraw/zinc/19/72/68/1050197268.db2.gz NIPDNPSWUIJHDD-UHFFFAOYSA-N 1 2 310.825 4.228 20 0 DIADLO CSc1ccccc1C[N@@H+](C)Cc1ccnc(Cl)c1F ZINC000824314677 1050197275 /nfs/dbraw/zinc/19/72/75/1050197275.db2.gz NIPDNPSWUIJHDD-UHFFFAOYSA-N 1 2 310.825 4.228 20 0 DIADLO Clc1cccc2[nH]c(C[N@@H+]3CCOC4(CCCCC4)C3)cc21 ZINC001136863826 1050201755 /nfs/dbraw/zinc/20/17/55/1050201755.db2.gz SOGSOKMSRQRILC-UHFFFAOYSA-N 1 2 318.848 4.356 20 0 DIADLO Clc1cccc2[nH]c(C[N@H+]3CCOC4(CCCCC4)C3)cc21 ZINC001136863826 1050201767 /nfs/dbraw/zinc/20/17/67/1050201767.db2.gz SOGSOKMSRQRILC-UHFFFAOYSA-N 1 2 318.848 4.356 20 0 DIADLO Cc1[nH]c2c(cc(C)cc2C[NH2+]Cc2n[nH]c3ccccc32)c1C ZINC000591711656 1050202129 /nfs/dbraw/zinc/20/21/29/1050202129.db2.gz FBWBQULCDHJWSL-UHFFFAOYSA-N 1 2 318.424 4.259 20 0 DIADLO CC(C)(C)/C=C/C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000733919885 1050204169 /nfs/dbraw/zinc/20/41/69/1050204169.db2.gz KMEKSOODGXXCOB-VAWYXSNFSA-N 1 2 323.440 4.427 20 0 DIADLO Cc1cc[nH+]c(Nc2ccc3c(cnn3[C@H]3CCCCO3)c2)c1 ZINC001210330840 1050207281 /nfs/dbraw/zinc/20/72/81/1050207281.db2.gz ABOXSCDAZQQBQF-GOSISDBHSA-N 1 2 308.385 4.182 20 0 DIADLO CCc1ccc[nH+]c1Nc1ccc2c(cnn2[C@H]2CCCCO2)c1 ZINC001210335073 1050209700 /nfs/dbraw/zinc/20/97/00/1050209700.db2.gz XTSJJZUHFLUAJF-GOSISDBHSA-N 1 2 322.412 4.436 20 0 DIADLO FC(F)(F)n1cc(Nc2cc[nH+]c3cc(Cl)ccc23)cn1 ZINC001210360297 1050215090 /nfs/dbraw/zinc/21/50/90/1050215090.db2.gz SPVGQIVHODANPK-UHFFFAOYSA-N 1 2 312.682 4.305 20 0 DIADLO C[N@H+](Cc1ccc(Cl)nc1)Cc1cccc(OC2CC2)c1F ZINC000824549115 1050224051 /nfs/dbraw/zinc/22/40/51/1050224051.db2.gz WWJDOJCEMFUSRT-UHFFFAOYSA-N 1 2 320.795 4.047 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)nc1)Cc1cccc(OC2CC2)c1F ZINC000824549115 1050224058 /nfs/dbraw/zinc/22/40/58/1050224058.db2.gz WWJDOJCEMFUSRT-UHFFFAOYSA-N 1 2 320.795 4.047 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2occc2Br)c2ccccc2O1 ZINC000824651359 1050229190 /nfs/dbraw/zinc/22/91/90/1050229190.db2.gz YKCJOMTWLBMHSW-ZWNOBZJWSA-N 1 2 322.202 4.044 20 0 DIADLO Cc1nonc1C[N@H+](Cc1ccccc1)[C@@H](C)c1ccccc1 ZINC000734146813 1050233643 /nfs/dbraw/zinc/23/36/43/1050233643.db2.gz JETDIYNCMXOBHR-INIZCTEOSA-N 1 2 307.397 4.141 20 0 DIADLO Cc1nonc1C[N@@H+](Cc1ccccc1)[C@@H](C)c1ccccc1 ZINC000734146813 1050233651 /nfs/dbraw/zinc/23/36/51/1050233651.db2.gz JETDIYNCMXOBHR-INIZCTEOSA-N 1 2 307.397 4.141 20 0 DIADLO Cn1c[nH+]cc1CNc1cc(F)c(SC(C)(C)C)c(F)c1 ZINC000824702802 1050234210 /nfs/dbraw/zinc/23/42/10/1050234210.db2.gz QHUWPBDBRKWTCZ-UHFFFAOYSA-N 1 2 311.401 4.201 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ccc(F)cc3C)c2)[nH+]c1C ZINC000771297553 1050236719 /nfs/dbraw/zinc/23/67/19/1050236719.db2.gz ZGYQIFNFVUKSKT-UHFFFAOYSA-N 1 2 323.371 4.393 20 0 DIADLO FC(F)(F)c1ccccc1C=CNc1cccn2cc[nH+]c12 ZINC001210429776 1050242388 /nfs/dbraw/zinc/24/23/88/1050242388.db2.gz YHIHCZVGPYTJBK-BQYQJAHWSA-N 1 2 303.287 4.436 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cn1)c1nc2ccccc2s1 ZINC000771392411 1050249956 /nfs/dbraw/zinc/24/99/56/1050249956.db2.gz WHHLSDWAUNHRMY-QWRGUYRKSA-N 1 2 301.390 4.242 20 0 DIADLO c1ccc2sc(C[N@@H+]3CCOC[C@H]3C3CCCCC3)nc2c1 ZINC001136957748 1050255026 /nfs/dbraw/zinc/25/50/26/1050255026.db2.gz NJLDAHLYNPQNEM-INIZCTEOSA-N 1 2 316.470 4.077 20 0 DIADLO c1ccc2sc(C[N@H+]3CCOC[C@H]3C3CCCCC3)nc2c1 ZINC001136957748 1050255028 /nfs/dbraw/zinc/25/50/28/1050255028.db2.gz NJLDAHLYNPQNEM-INIZCTEOSA-N 1 2 316.470 4.077 20 0 DIADLO Cc1ccsc1C[N@@H+](C)Cc1ncc(Cl)cc1Cl ZINC000573872572 1050261526 /nfs/dbraw/zinc/26/15/26/1050261526.db2.gz YKZNKFAOSSWOAN-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1ccsc1C[N@H+](C)Cc1ncc(Cl)cc1Cl ZINC000573872572 1050261536 /nfs/dbraw/zinc/26/15/36/1050261536.db2.gz YKZNKFAOSSWOAN-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO CC(C)CC1CC[NH+](CC(=O)Nc2ccccc2Cl)CC1 ZINC000760931580 1050272455 /nfs/dbraw/zinc/27/24/55/1050272455.db2.gz CSIKPSXXRIRFAD-UHFFFAOYSA-N 1 2 308.853 4.037 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1c[nH]c3cccc(F)c13)CC2 ZINC001136987226 1050273727 /nfs/dbraw/zinc/27/37/27/1050273727.db2.gz OSCPSQHEPOQRJY-UHFFFAOYSA-N 1 2 322.383 4.068 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1c[nH]c3cccc(F)c13)CC2 ZINC001136987226 1050273742 /nfs/dbraw/zinc/27/37/42/1050273742.db2.gz OSCPSQHEPOQRJY-UHFFFAOYSA-N 1 2 322.383 4.068 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000069085141 1050275541 /nfs/dbraw/zinc/27/55/41/1050275541.db2.gz HIMLNDHHEGVLNQ-HNNXBMFYSA-N 1 2 314.429 4.318 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000069085141 1050275557 /nfs/dbraw/zinc/27/55/57/1050275557.db2.gz HIMLNDHHEGVLNQ-HNNXBMFYSA-N 1 2 314.429 4.318 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cncc(Cl)c1 ZINC001136997773 1050282914 /nfs/dbraw/zinc/28/29/14/1050282914.db2.gz OACVUCMKXJTWNU-KRWDZBQOSA-N 1 2 316.832 4.218 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cncc(Cl)c1 ZINC001136997773 1050282932 /nfs/dbraw/zinc/28/29/32/1050282932.db2.gz OACVUCMKXJTWNU-KRWDZBQOSA-N 1 2 316.832 4.218 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@@H+]1Cc1cc(F)ncc1F ZINC000825215311 1050286132 /nfs/dbraw/zinc/28/61/32/1050286132.db2.gz LWTSJGQABCPXLX-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@H+]1Cc1cc(F)ncc1F ZINC000825215311 1050286140 /nfs/dbraw/zinc/28/61/40/1050286140.db2.gz LWTSJGQABCPXLX-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1ccc2c(Nc3cncc(N4CCCC4)c3)cccc2[nH+]1 ZINC001210610193 1050313177 /nfs/dbraw/zinc/31/31/77/1050313177.db2.gz RQEKMTOZRQGZQO-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO F[C@H]1C[N@H+](Cc2ccc(Cl)c(OC(F)(F)F)c2)C[C@@H]2C[C@@H]21 ZINC001143356944 1050315583 /nfs/dbraw/zinc/31/55/83/1050315583.db2.gz MCPPLXHBLUCQBL-NHCYSSNCSA-N 1 2 323.717 4.028 20 0 DIADLO F[C@H]1C[N@@H+](Cc2ccc(Cl)c(OC(F)(F)F)c2)C[C@@H]2C[C@@H]21 ZINC001143356944 1050315593 /nfs/dbraw/zinc/31/55/93/1050315593.db2.gz MCPPLXHBLUCQBL-NHCYSSNCSA-N 1 2 323.717 4.028 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2ccncc2)c1Cl ZINC001143369323 1050319758 /nfs/dbraw/zinc/31/97/58/1050319758.db2.gz PDKAYUKLMQYYFM-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@H]2c2ccncc2)c1Cl ZINC001143369323 1050319768 /nfs/dbraw/zinc/31/97/68/1050319768.db2.gz PDKAYUKLMQYYFM-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO CN(C)C(=O)Nc1ccc(Nc2cccc(C3CCC3)[nH+]2)cc1 ZINC001210633311 1050320531 /nfs/dbraw/zinc/32/05/31/1050320531.db2.gz XSZKVQJVMSDGJC-UHFFFAOYSA-N 1 2 310.401 4.186 20 0 DIADLO COc1ccc(F)c(C[NH+]2CC(c3ccccc3)C2)c1Cl ZINC001143371009 1050321365 /nfs/dbraw/zinc/32/13/65/1050321365.db2.gz BBJHFHCZUWJDLR-UHFFFAOYSA-N 1 2 305.780 4.087 20 0 DIADLO Cc1ccc2c(Nc3ccc(NC(=O)N(C)C)cc3)cccc2[nH+]1 ZINC001210635951 1050322257 /nfs/dbraw/zinc/32/22/57/1050322257.db2.gz KHZJOMZSKZRONS-UHFFFAOYSA-N 1 2 320.396 4.380 20 0 DIADLO O=C(CC1=CCCCC1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000592616837 1050327740 /nfs/dbraw/zinc/32/77/40/1050327740.db2.gz OUUPQWVJZKPAHO-UHFFFAOYSA-N 1 2 315.804 4.355 20 0 DIADLO CCCCCC[C@H](CC)C(=O)NCC[NH+]1Cc2ccccc2C1 ZINC000735039437 1050340304 /nfs/dbraw/zinc/34/03/04/1050340304.db2.gz VIAMKEZPGKSKNB-KRWDZBQOSA-N 1 2 316.489 4.115 20 0 DIADLO Clc1cc(Nc2cnc3sccc3c2)cn2cc[nH+]c12 ZINC001210692139 1050340643 /nfs/dbraw/zinc/34/06/43/1050340643.db2.gz IWGCODDKIBNFIY-UHFFFAOYSA-N 1 2 300.774 4.341 20 0 DIADLO CCCCCC[C@H](CC)C(=O)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000735040489 1050342295 /nfs/dbraw/zinc/34/22/95/1050342295.db2.gz VZQCRUIQUATFSF-HNNXBMFYSA-N 1 2 305.466 4.112 20 0 DIADLO c1c[nH]c([C@H]2CCC[N@H+]2Cc2csc(C3CCCC3)n2)c1 ZINC000069193808 1050347743 /nfs/dbraw/zinc/34/77/43/1050347743.db2.gz ALQDMCIHUDZRFN-MRXNPFEDSA-N 1 2 301.459 4.466 20 0 DIADLO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2csc(C3CCCC3)n2)c1 ZINC000069193808 1050347757 /nfs/dbraw/zinc/34/77/57/1050347757.db2.gz ALQDMCIHUDZRFN-MRXNPFEDSA-N 1 2 301.459 4.466 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)CCCC1=O ZINC001143803813 1050366106 /nfs/dbraw/zinc/36/61/06/1050366106.db2.gz BNUPYCHDDXJUSS-JTQLQIEISA-N 1 2 319.754 4.160 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)CCCC1=O ZINC001143803813 1050366118 /nfs/dbraw/zinc/36/61/18/1050366118.db2.gz BNUPYCHDDXJUSS-JTQLQIEISA-N 1 2 319.754 4.160 20 0 DIADLO Brc1ccoc1C[NH2+][C@@H]1CCCOc2ccccc21 ZINC000735322827 1050369855 /nfs/dbraw/zinc/36/98/55/1050369855.db2.gz NDPURFGVMLQNCC-CYBMUJFWSA-N 1 2 322.202 4.046 20 0 DIADLO Fc1cccc(Cl)c1C[NH2+][C@H]1CCc2c1nccc2Cl ZINC000924859323 1050370261 /nfs/dbraw/zinc/37/02/61/1050370261.db2.gz UPZQSENAFRYKRE-AWEZNQCLSA-N 1 2 311.187 4.305 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCc3ccsc3C2)cc1Cl ZINC001143847147 1050372070 /nfs/dbraw/zinc/37/20/70/1050372070.db2.gz BDMJJXUFRRDLRQ-UHFFFAOYSA-N 1 2 311.809 4.108 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCc3ccsc3C2)cc1Cl ZINC001143847147 1050372079 /nfs/dbraw/zinc/37/20/79/1050372079.db2.gz BDMJJXUFRRDLRQ-UHFFFAOYSA-N 1 2 311.809 4.108 20 0 DIADLO c1ccc2nc(Nc3ccc[nH+]c3N3CCCCC3)ccc2c1 ZINC001210813897 1050377447 /nfs/dbraw/zinc/37/74/47/1050377447.db2.gz QKFYUGSWNKXDIP-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO CCOc1ccc(CNc2ccc3c(c2)CCC[N@H+]3C)cc1F ZINC000785491225 1050380674 /nfs/dbraw/zinc/38/06/74/1050380674.db2.gz FQAMDCSSHPAWES-UHFFFAOYSA-N 1 2 314.404 4.219 20 0 DIADLO CCOc1ccc(CNc2ccc3c(c2)CCC[N@@H+]3C)cc1F ZINC000785491225 1050380681 /nfs/dbraw/zinc/38/06/81/1050380681.db2.gz FQAMDCSSHPAWES-UHFFFAOYSA-N 1 2 314.404 4.219 20 0 DIADLO Oc1cc(Nc2ccccc2-n2cc[nH+]c2)cc(C(F)(F)F)c1 ZINC001210825256 1050382492 /nfs/dbraw/zinc/38/24/92/1050382492.db2.gz FMDJUXVDICVSFS-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO COC[C@@H]1CCCC[N@@H+]1Cc1c(F)ccc(Cl)c1Cl ZINC001143854639 1050385628 /nfs/dbraw/zinc/38/56/28/1050385628.db2.gz BNIDUQPVACLFDY-JTQLQIEISA-N 1 2 306.208 4.133 20 0 DIADLO COC[C@@H]1CCCC[N@H+]1Cc1c(F)ccc(Cl)c1Cl ZINC001143854639 1050385634 /nfs/dbraw/zinc/38/56/34/1050385634.db2.gz BNIDUQPVACLFDY-JTQLQIEISA-N 1 2 306.208 4.133 20 0 DIADLO c1cn(Cc2cccc(Nc3ccccc3OC3CC3)c2)c[nH+]1 ZINC001210838771 1050387218 /nfs/dbraw/zinc/38/72/18/1050387218.db2.gz GKUWDCPOMQGJDS-UHFFFAOYSA-N 1 2 305.381 4.216 20 0 DIADLO CN(c1ccc(Nc2cncc(F)c2)c[nH+]1)C1CCCCC1 ZINC001212613111 1050388142 /nfs/dbraw/zinc/38/81/42/1050388142.db2.gz DIJSQFNIHKIMBB-UHFFFAOYSA-N 1 2 300.381 4.128 20 0 DIADLO C[C@@H](CC(=O)Oc1ccc2oc3c(c2c1)CCCC3)n1cc[nH+]c1 ZINC000844290714 1050394967 /nfs/dbraw/zinc/39/49/67/1050394967.db2.gz PULATJMENTZYOF-ZDUSSCGKSA-N 1 2 324.380 4.065 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)/C=C/C2CCCCC2)n1 ZINC000735463224 1050399844 /nfs/dbraw/zinc/39/98/44/1050399844.db2.gz GBUWSUVILOMOGQ-ZHACJKMWSA-N 1 2 321.490 4.060 20 0 DIADLO C[N@H+](CCSc1ccccc1)Cc1ccn(-c2ccccc2)n1 ZINC000735491995 1050402865 /nfs/dbraw/zinc/40/28/65/1050402865.db2.gz SIGIHBDKGIATNC-UHFFFAOYSA-N 1 2 323.465 4.096 20 0 DIADLO C[N@@H+](CCSc1ccccc1)Cc1ccn(-c2ccccc2)n1 ZINC000735491995 1050402871 /nfs/dbraw/zinc/40/28/71/1050402871.db2.gz SIGIHBDKGIATNC-UHFFFAOYSA-N 1 2 323.465 4.096 20 0 DIADLO CCN(C(=O)C[C@@H](C)n1cc[nH+]c1)c1ccc2ccccc2c1 ZINC000844359391 1050405642 /nfs/dbraw/zinc/40/56/42/1050405642.db2.gz IXDUSIBTZZGMSV-OAHLLOKOSA-N 1 2 307.397 4.041 20 0 DIADLO FC(F)(F)c1nc(Cl)ccc1C[N@@H+]1CCC12CCCC2 ZINC000844355846 1050406425 /nfs/dbraw/zinc/40/64/25/1050406425.db2.gz CHHQSLGHLLFVQA-UHFFFAOYSA-N 1 2 304.743 4.272 20 0 DIADLO FC(F)(F)c1nc(Cl)ccc1C[N@H+]1CCC12CCCC2 ZINC000844355846 1050406437 /nfs/dbraw/zinc/40/64/37/1050406437.db2.gz CHHQSLGHLLFVQA-UHFFFAOYSA-N 1 2 304.743 4.272 20 0 DIADLO Cc1c(C[N@@H+]2CC[C@@](C)(F)[C@H](F)C2)cccc1C(F)(F)F ZINC001143923277 1050409560 /nfs/dbraw/zinc/40/95/60/1050409560.db2.gz UJWSJAWTKSOJMV-ZIAGYGMSSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1c(C[N@H+]2CC[C@@](C)(F)[C@H](F)C2)cccc1C(F)(F)F ZINC001143923277 1050409563 /nfs/dbraw/zinc/40/95/63/1050409563.db2.gz UJWSJAWTKSOJMV-ZIAGYGMSSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1c(C[N@H+](C)Cc2nccs2)cccc1C(F)(F)F ZINC001143931085 1050414100 /nfs/dbraw/zinc/41/41/00/1050414100.db2.gz XSEDVZPHRBSQEA-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1c(C[N@@H+](C)Cc2nccs2)cccc1C(F)(F)F ZINC001143931085 1050414107 /nfs/dbraw/zinc/41/41/07/1050414107.db2.gz XSEDVZPHRBSQEA-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO CCCOC1CC[NH+](Cc2c(Cl)ccc(F)c2F)CC1 ZINC001143957981 1050417506 /nfs/dbraw/zinc/41/75/06/1050417506.db2.gz UFDCSIUHWMCUDR-UHFFFAOYSA-N 1 2 303.780 4.009 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCc3ccccc3[C@H]2C)c1F ZINC001143969440 1050419522 /nfs/dbraw/zinc/41/95/22/1050419522.db2.gz CKLMHXVWUXMIQA-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCc3ccccc3[C@H]2C)c1F ZINC001143969440 1050419526 /nfs/dbraw/zinc/41/95/26/1050419526.db2.gz CKLMHXVWUXMIQA-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO CC[C@H](OC(=O)C[C@H](C)n1cc[nH+]c1)c1c(F)cccc1Cl ZINC000844428805 1050421723 /nfs/dbraw/zinc/42/17/23/1050421723.db2.gz LXZPPGVKWMTUKB-FZMZJTMJSA-N 1 2 324.783 4.321 20 0 DIADLO COc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c1F ZINC001143979280 1050427221 /nfs/dbraw/zinc/42/72/21/1050427221.db2.gz XZPUXSPLPRQQAF-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c1F ZINC001143979280 1050427223 /nfs/dbraw/zinc/42/72/23/1050427223.db2.gz XZPUXSPLPRQQAF-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO CCCSc1ccc(COC(=O)C[C@H](C)n2cc[nH+]c2)cc1 ZINC000844479948 1050429000 /nfs/dbraw/zinc/42/90/00/1050429000.db2.gz VLULBAVTACRTBF-AWEZNQCLSA-N 1 2 318.442 4.080 20 0 DIADLO Cc1cn2c(cccc2Nc2ccccc2N2CCCCC2)[nH+]1 ZINC001210958502 1050433079 /nfs/dbraw/zinc/43/30/79/1050433079.db2.gz XBBDUMZOHMAKSK-UHFFFAOYSA-N 1 2 306.413 4.377 20 0 DIADLO CC[C@@H](OC(=O)C[C@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1F ZINC000844463906 1050434795 /nfs/dbraw/zinc/43/47/95/1050434795.db2.gz ZENJKSZSEYSLHL-XHDPSFHLSA-N 1 2 324.783 4.321 20 0 DIADLO CC[C@H](OC(=O)C[C@@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1F ZINC000844463903 1050435473 /nfs/dbraw/zinc/43/54/73/1050435473.db2.gz ZENJKSZSEYSLHL-ABAIWWIYSA-N 1 2 324.783 4.321 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)OC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000844488880 1050439641 /nfs/dbraw/zinc/43/96/41/1050439641.db2.gz DGMVECCJDYKBLF-GXTWGEPZSA-N 1 2 312.369 4.193 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2CCC[C@H]2c2ccncc2)cc1F ZINC001144028306 1050445007 /nfs/dbraw/zinc/44/50/07/1050445007.db2.gz ZNXCNAGKIOYRJS-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2CCC[C@H]2c2ccncc2)cc1F ZINC001144028306 1050445014 /nfs/dbraw/zinc/44/50/14/1050445014.db2.gz ZNXCNAGKIOYRJS-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1ccc(Nc2cc(C(F)(F)F)c(Cl)cc2N)[nH+]c1 ZINC001211013666 1050446511 /nfs/dbraw/zinc/44/65/11/1050446511.db2.gz KHLHEHBUWXGYDZ-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Cc1cn2cccc(Nc3cncc(-c4ccccc4)c3)c2[nH+]1 ZINC001211022377 1050449804 /nfs/dbraw/zinc/44/98/04/1050449804.db2.gz VVFZFPSPRYWEDP-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO CCn1ncc(Nc2ccc(N(C)C3CCCCC3)[nH+]c2)c1C ZINC001212613270 1050450845 /nfs/dbraw/zinc/45/08/45/1050450845.db2.gz LPVXUVWDWVJHSO-UHFFFAOYSA-N 1 2 313.449 4.119 20 0 DIADLO COc1cc[nH+]cc1NC/C(=C/F)CCc1ccc(F)cc1 ZINC001170055496 1050457879 /nfs/dbraw/zinc/45/78/79/1050457879.db2.gz DMPDBQAJMRSBRC-GXDHUFHOSA-N 1 2 304.340 4.127 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccc(Br)cc2F)cc1 ZINC000058946919 1050465341 /nfs/dbraw/zinc/46/53/41/1050465341.db2.gz JNCRBZCSLOQPSO-UHFFFAOYSA-N 1 2 323.209 4.266 20 0 DIADLO Cc1c(O)cccc1C[N@@H+](C)Cc1ccccc1Br ZINC001144107643 1050475137 /nfs/dbraw/zinc/47/51/37/1050475137.db2.gz NNJRSTMCXMYAAG-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO Cc1c(O)cccc1C[N@H+](C)Cc1ccccc1Br ZINC001144107643 1050475145 /nfs/dbraw/zinc/47/51/45/1050475145.db2.gz NNJRSTMCXMYAAG-UHFFFAOYSA-N 1 2 320.230 4.095 20 0 DIADLO CC(C)c1nnc(C[NH2+]C(C)(C)c2ccc3ccccc3c2)o1 ZINC000626115907 1050479358 /nfs/dbraw/zinc/47/93/58/1050479358.db2.gz JMTGJBULOVNQFC-UHFFFAOYSA-N 1 2 309.413 4.371 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1cc(Cl)c(F)cc1F ZINC001144129615 1050479486 /nfs/dbraw/zinc/47/94/86/1050479486.db2.gz NOGSFSNLGBAHMM-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1cc(Cl)c(F)cc1F ZINC001144129615 1050479491 /nfs/dbraw/zinc/47/94/91/1050479491.db2.gz NOGSFSNLGBAHMM-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO FC(F)C[C@H]1COCC[N@@H+]1Cc1ccc(C2CCCC2)cc1 ZINC000574507898 1050492955 /nfs/dbraw/zinc/49/29/55/1050492955.db2.gz DDBXEXNGSPOTFK-KRWDZBQOSA-N 1 2 309.400 4.200 20 0 DIADLO FC(F)C[C@H]1COCC[N@H+]1Cc1ccc(C2CCCC2)cc1 ZINC000574507898 1050492963 /nfs/dbraw/zinc/49/29/63/1050492963.db2.gz DDBXEXNGSPOTFK-KRWDZBQOSA-N 1 2 309.400 4.200 20 0 DIADLO Nc1ccc(C(F)(F)F)cc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001211149861 1050498849 /nfs/dbraw/zinc/49/88/49/1050498849.db2.gz XAGGRHYVIJOIAA-UHFFFAOYSA-N 1 2 318.302 4.217 20 0 DIADLO c1c(Cc2nc(C3CCCCCCC3)no2)[nH+]c2n1CCCC2 ZINC000844863152 1050511226 /nfs/dbraw/zinc/51/12/26/1050511226.db2.gz PNMJATJHEORBIS-UHFFFAOYSA-N 1 2 314.433 4.021 20 0 DIADLO CCC1(CC)Oc2ccc(NCc3cccc4[nH+]ccn43)cc2O1 ZINC000786831674 1050519170 /nfs/dbraw/zinc/51/91/70/1050519170.db2.gz OUBZMSWIZOPGPZ-UHFFFAOYSA-N 1 2 323.396 4.234 20 0 DIADLO Brc1cnc2ccc(CNc3cccc[nH+]3)cc2c1 ZINC001171154579 1050519472 /nfs/dbraw/zinc/51/94/72/1050519472.db2.gz NKBPDZRXSFFABC-UHFFFAOYSA-N 1 2 314.186 4.004 20 0 DIADLO CO[C@H](c1ccccc1)[C@@H](C)Nc1ccc([NH+]2CCCC2)cc1 ZINC000786870840 1050525056 /nfs/dbraw/zinc/52/50/56/1050525056.db2.gz GNPRNMFNYVSWAQ-UZLBHIALSA-N 1 2 310.441 4.475 20 0 DIADLO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cn1nnc2ccccc2c1=S ZINC000738060039 1050525235 /nfs/dbraw/zinc/52/52/35/1050525235.db2.gz ZUHDBUWKBAAYFE-BBRMVZONSA-N 1 2 316.474 4.019 20 0 DIADLO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cn1nnc2ccccc2c1=S ZINC000738060039 1050525244 /nfs/dbraw/zinc/52/52/44/1050525244.db2.gz ZUHDBUWKBAAYFE-BBRMVZONSA-N 1 2 316.474 4.019 20 0 DIADLO COC[C@H](Nc1ccc([NH+](C)C)cc1)c1ccc(Cl)cc1 ZINC000786893693 1050527161 /nfs/dbraw/zinc/52/71/61/1050527161.db2.gz YOOOMYXGBNDJSQ-KRWDZBQOSA-N 1 2 304.821 4.206 20 0 DIADLO CCn1c(=S)n(C[N@@H+]2CCC[C@@H](C(C)C)CC2)nc1C1CC1 ZINC000738241943 1050528066 /nfs/dbraw/zinc/52/80/66/1050528066.db2.gz VEHHOQSXGWFPAL-CQSZACIVSA-N 1 2 322.522 4.027 20 0 DIADLO CCn1c(=S)n(C[N@H+]2CCC[C@@H](C(C)C)CC2)nc1C1CC1 ZINC000738241943 1050528080 /nfs/dbraw/zinc/52/80/80/1050528080.db2.gz VEHHOQSXGWFPAL-CQSZACIVSA-N 1 2 322.522 4.027 20 0 DIADLO Cc1ccc([C@H]2[C@@H](C)CCC[N@@H+]2Cn2ncsc2=S)cc1 ZINC000738284970 1050528410 /nfs/dbraw/zinc/52/84/10/1050528410.db2.gz NSEXNUKFCAHLDR-DZGCQCFKSA-N 1 2 319.499 4.413 20 0 DIADLO Cc1ccc([C@H]2[C@@H](C)CCC[N@H+]2Cn2ncsc2=S)cc1 ZINC000738284970 1050528425 /nfs/dbraw/zinc/52/84/25/1050528425.db2.gz NSEXNUKFCAHLDR-DZGCQCFKSA-N 1 2 319.499 4.413 20 0 DIADLO Cc1ccc[nH+]c1Nc1ccc2c(cnn2C(=O)OC(C)(C)C)c1 ZINC001211253220 1050529800 /nfs/dbraw/zinc/52/98/00/1050529800.db2.gz AXRIPTOWMSUFAK-UHFFFAOYSA-N 1 2 324.384 4.267 20 0 DIADLO COc1cc(Nc2ccc3c(c2)[nH+]cn3C)cc(C(F)(F)F)c1 ZINC001211335660 1050550476 /nfs/dbraw/zinc/55/04/76/1050550476.db2.gz VOPJSFGVTQEUHG-UHFFFAOYSA-N 1 2 321.302 4.344 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3C[C@H]3C3CCC3)c2)[nH+]c1C ZINC000845272188 1050557180 /nfs/dbraw/zinc/55/71/80/1050557180.db2.gz MWDUYBGYKLHLAC-DLBZAZTESA-N 1 2 309.413 4.068 20 0 DIADLO CCCOc1ccccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001211382870 1050558933 /nfs/dbraw/zinc/55/89/33/1050558933.db2.gz JPGCVLNUWTUQFF-UHFFFAOYSA-N 1 2 307.397 4.464 20 0 DIADLO Cc1cc(C)c([C@@H](C)OC(=O)C[C@H](C)n2cc[nH+]c2)c(C)c1 ZINC000845283359 1050559938 /nfs/dbraw/zinc/55/99/38/1050559938.db2.gz VULZVKFBXGIQLX-JKSUJKDBSA-N 1 2 300.402 4.064 20 0 DIADLO CCCCc1ccc(-c2noc([C@](C)([NH3+])c3ccccc3)n2)cc1 ZINC001211442516 1050568512 /nfs/dbraw/zinc/56/85/12/1050568512.db2.gz BBQMRTMRRNHXNJ-HXUWFJFHSA-N 1 2 321.424 4.301 20 0 DIADLO CC1(C)Oc2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2O1 ZINC001213088733 1050582232 /nfs/dbraw/zinc/58/22/32/1050582232.db2.gz APSAJEBYSRKNRL-UHFFFAOYSA-N 1 2 307.353 4.328 20 0 DIADLO COc1ccc2cc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cnc2c1 ZINC001213086917 1050582480 /nfs/dbraw/zinc/58/24/80/1050582480.db2.gz FQFKSCJLTOXKEF-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO FC(F)(F)Oc1ncccc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213088114 1050583412 /nfs/dbraw/zinc/58/34/12/1050583412.db2.gz PUZAAIBZXQXFOC-UHFFFAOYSA-N 1 2 320.274 4.114 20 0 DIADLO O=c1[nH]c2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2s1 ZINC001213088844 1050584097 /nfs/dbraw/zinc/58/40/97/1050584097.db2.gz HBAUVYMAVOEWMF-UHFFFAOYSA-N 1 2 308.366 4.136 20 0 DIADLO Clc1cc(Nc2ccc(-c3ncc[nH]3)cc2)cn2cc[nH+]c12 ZINC001213087497 1050584397 /nfs/dbraw/zinc/58/43/97/1050584397.db2.gz QALWRXDWSRQCFX-UHFFFAOYSA-N 1 2 309.760 4.121 20 0 DIADLO FC(F)(F)Oc1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cn1 ZINC001213086818 1050584506 /nfs/dbraw/zinc/58/45/06/1050584506.db2.gz BNPJHZOIYNPNGJ-UHFFFAOYSA-N 1 2 320.274 4.114 20 0 DIADLO COc1ccc2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc2n1 ZINC001213091977 1050585449 /nfs/dbraw/zinc/58/54/49/1050585449.db2.gz VFMKVDUSHGJTNM-UHFFFAOYSA-N 1 2 316.364 4.377 20 0 DIADLO CO[C@H]1CCOc2c(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cccc21 ZINC001213090880 1050585706 /nfs/dbraw/zinc/58/57/06/1050585706.db2.gz KXTDAGJCBLZLGX-KRWDZBQOSA-N 1 2 321.380 4.290 20 0 DIADLO Nc1cc(F)c(Cl)cc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213089049 1050586275 /nfs/dbraw/zinc/58/62/75/1050586275.db2.gz QZXRRLVDXBSDKR-UHFFFAOYSA-N 1 2 302.740 4.195 20 0 DIADLO Fc1cc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)c(F)c(F)c1F ZINC001213088988 1050586543 /nfs/dbraw/zinc/58/65/43/1050586543.db2.gz NURYFSOUBXMMCX-UHFFFAOYSA-N 1 2 307.250 4.377 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)cc1F ZINC001144462838 1050589256 /nfs/dbraw/zinc/58/92/56/1050589256.db2.gz IUNQPSKERAXYQP-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)cc1F ZINC001144462838 1050589269 /nfs/dbraw/zinc/58/92/69/1050589269.db2.gz IUNQPSKERAXYQP-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)cc1F ZINC001144463444 1050589897 /nfs/dbraw/zinc/58/98/97/1050589897.db2.gz QKTOBWIPMJXYJY-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO COc1ncc(C[N@H+]2CCCC[C@@H]2c2ccccc2F)cc1F ZINC001144463444 1050589912 /nfs/dbraw/zinc/58/99/12/1050589912.db2.gz QKTOBWIPMJXYJY-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO Cc1cc(NCc2ccccc2OCC2CC2)nc(C(C)C)[nH+]1 ZINC000739897670 1050591862 /nfs/dbraw/zinc/59/18/62/1050591862.db2.gz KYOJQHARFYFBAF-UHFFFAOYSA-N 1 2 311.429 4.309 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+]2CCc3c(F)cccc3C2)c1 ZINC001144490365 1050599880 /nfs/dbraw/zinc/59/98/80/1050599880.db2.gz ZFQKZFPQAADWMF-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(Cl)cc(C[N@H+]2CCc3c(F)cccc3C2)c1 ZINC001144490365 1050599895 /nfs/dbraw/zinc/59/98/95/1050599895.db2.gz ZFQKZFPQAADWMF-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CN(c1ccc(N(C)C2CCCCC2)[nH+]c1)c1ccccc1N ZINC001212614871 1050600444 /nfs/dbraw/zinc/60/04/44/1050600444.db2.gz ZJSNBBCEUOSODM-UHFFFAOYSA-N 1 2 310.445 4.201 20 0 DIADLO FC(F)(F)c1ncccc1C[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001144531791 1050608479 /nfs/dbraw/zinc/60/84/79/1050608479.db2.gz ZDSNYLDSJPSCOF-HNNXBMFYSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1ncccc1C[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001144531791 1050608481 /nfs/dbraw/zinc/60/84/81/1050608481.db2.gz ZDSNYLDSJPSCOF-HNNXBMFYSA-N 1 2 321.346 4.223 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cccnc1C(F)(F)F ZINC001144538575 1050610134 /nfs/dbraw/zinc/61/01/34/1050610134.db2.gz OHTMHEDGYSWWLO-LBPRGKRZSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cccnc1C(F)(F)F ZINC001144538575 1050610142 /nfs/dbraw/zinc/61/01/42/1050610142.db2.gz OHTMHEDGYSWWLO-LBPRGKRZSA-N 1 2 306.331 4.047 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2c(F)cc(O)cc2F)c1 ZINC001144542400 1050610514 /nfs/dbraw/zinc/61/05/14/1050610514.db2.gz WIZNSMJINDPNNG-GOSISDBHSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2c(F)cc(O)cc2F)c1 ZINC001144542400 1050610518 /nfs/dbraw/zinc/61/05/18/1050610518.db2.gz WIZNSMJINDPNNG-GOSISDBHSA-N 1 2 303.352 4.316 20 0 DIADLO C[N@H+](Cc1cccc2ccccc21)Cc1c(F)cc(O)cc1F ZINC001144553688 1050612527 /nfs/dbraw/zinc/61/25/27/1050612527.db2.gz MTNZXDPYGRLFNH-UHFFFAOYSA-N 1 2 313.347 4.456 20 0 DIADLO C[N@@H+](Cc1cccc2ccccc21)Cc1c(F)cc(O)cc1F ZINC001144553688 1050612538 /nfs/dbraw/zinc/61/25/38/1050612538.db2.gz MTNZXDPYGRLFNH-UHFFFAOYSA-N 1 2 313.347 4.456 20 0 DIADLO Oc1cc(F)c(C[NH+]2CCC(c3ccccc3F)CC2)c(F)c1 ZINC001144554811 1050613882 /nfs/dbraw/zinc/61/38/82/1050613882.db2.gz IMNZSXXWTIYEJT-UHFFFAOYSA-N 1 2 321.342 4.189 20 0 DIADLO FC(F)COc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC001213305269 1050625589 /nfs/dbraw/zinc/62/55/89/1050625589.db2.gz ULRLFNMNCOXNSM-UHFFFAOYSA-N 1 2 315.323 4.260 20 0 DIADLO C[C@@H]1C[C@H](C)C[N@H+]1Cn1nc(-c2ccccc2)sc1=S ZINC000740859023 1050632070 /nfs/dbraw/zinc/63/20/70/1050632070.db2.gz IHFRJNVGMIGQAH-NWDGAFQWSA-N 1 2 305.472 4.029 20 0 DIADLO C[C@@H]1C[C@H](C)C[N@@H+]1Cn1nc(-c2ccccc2)sc1=S ZINC000740859023 1050632077 /nfs/dbraw/zinc/63/20/77/1050632077.db2.gz IHFRJNVGMIGQAH-NWDGAFQWSA-N 1 2 305.472 4.029 20 0 DIADLO COc1cccc([C@@H]2CCCCN2Cc2[nH+]cn3ccccc23)c1 ZINC001144623117 1050632378 /nfs/dbraw/zinc/63/23/78/1050632378.db2.gz QFUXRAJFHFYRLK-IBGZPJMESA-N 1 2 321.424 4.070 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCCC[C@@H]2c2ccccc2)cc1F ZINC001144646856 1050638458 /nfs/dbraw/zinc/63/84/58/1050638458.db2.gz NMYZKFTZGQQIQW-QGZVFWFLSA-N 1 2 303.352 4.398 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCCC[C@@H]2c2ccccc2)cc1F ZINC001144646856 1050638467 /nfs/dbraw/zinc/63/84/67/1050638467.db2.gz NMYZKFTZGQQIQW-QGZVFWFLSA-N 1 2 303.352 4.398 20 0 DIADLO Oc1cc(F)c(C[NH+]2CCC(c3ccccc3)CC2)cc1F ZINC001144647884 1050638698 /nfs/dbraw/zinc/63/86/98/1050638698.db2.gz NWYRQXNFUDGVIS-UHFFFAOYSA-N 1 2 303.352 4.050 20 0 DIADLO Oc1cc(F)c(C[N@H+](Cc2ccccc2)C2CCC2)cc1F ZINC001144663905 1050645786 /nfs/dbraw/zinc/64/57/86/1050645786.db2.gz NNCBQROVVOGNKE-UHFFFAOYSA-N 1 2 303.352 4.225 20 0 DIADLO Oc1cc(F)c(C[N@@H+](Cc2ccccc2)C2CCC2)cc1F ZINC001144663905 1050645787 /nfs/dbraw/zinc/64/57/87/1050645787.db2.gz NNCBQROVVOGNKE-UHFFFAOYSA-N 1 2 303.352 4.225 20 0 DIADLO CC(C)(c1ccc(Nc2[nH+]cccc2CCO)cc1)C(F)(F)F ZINC001213392729 1050646296 /nfs/dbraw/zinc/64/62/96/1050646296.db2.gz TYMXBVJOAJZBGQ-UHFFFAOYSA-N 1 2 324.346 4.200 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cc1F ZINC001144659518 1050648470 /nfs/dbraw/zinc/64/84/70/1050648470.db2.gz LNMFKMFKQLYVPE-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)cc1F ZINC001144659518 1050648473 /nfs/dbraw/zinc/64/84/73/1050648473.db2.gz LNMFKMFKQLYVPE-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1ccc2ccccc2c1 ZINC000772714835 1050656918 /nfs/dbraw/zinc/65/69/18/1050656918.db2.gz AVXFJCIOFJZTEP-HNNXBMFYSA-N 1 2 322.408 4.282 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1ccc2ccccc2c1 ZINC000772714835 1050656926 /nfs/dbraw/zinc/65/69/26/1050656926.db2.gz AVXFJCIOFJZTEP-HNNXBMFYSA-N 1 2 322.408 4.282 20 0 DIADLO CC[C@@H]([NH2+]Cc1occc1Br)c1ccccc1OC ZINC000227366259 1050663137 /nfs/dbraw/zinc/66/31/37/1050663137.db2.gz MIKZXCLLDXKKMK-CYBMUJFWSA-N 1 2 324.218 4.292 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)OCc1ccc(Cl)s1)c1ccccc1 ZINC000741150196 1050663292 /nfs/dbraw/zinc/66/32/92/1050663292.db2.gz ABGDKVHYHPXGKX-OAHLLOKOSA-N 1 2 323.845 4.138 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)OCc1ccc(Cl)s1)c1ccccc1 ZINC000741150196 1050663297 /nfs/dbraw/zinc/66/32/97/1050663297.db2.gz ABGDKVHYHPXGKX-OAHLLOKOSA-N 1 2 323.845 4.138 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2noc3c2CCCC3)c1 ZINC000179674100 1050664930 /nfs/dbraw/zinc/66/49/30/1050664930.db2.gz WCEIUZLRJJBHPH-CQSZACIVSA-N 1 2 314.429 4.191 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2noc3c2CCCC3)c1 ZINC000179674112 1050665088 /nfs/dbraw/zinc/66/50/88/1050665088.db2.gz WCEIUZLRJJBHPH-AWEZNQCLSA-N 1 2 314.429 4.191 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)CC[C@@]1(C)O ZINC001231480740 1050665435 /nfs/dbraw/zinc/66/54/35/1050665435.db2.gz XEKJQTIXNQEXTP-LKFCYVNXSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)CC[C@@]1(C)O ZINC001231480740 1050665442 /nfs/dbraw/zinc/66/54/42/1050665442.db2.gz XEKJQTIXNQEXTP-LKFCYVNXSA-N 1 2 322.663 4.240 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccnn1Cc1ccccc1 ZINC001213492153 1050669899 /nfs/dbraw/zinc/66/98/99/1050669899.db2.gz XMCNCJKLMFGJHR-UHFFFAOYSA-N 1 2 304.397 4.256 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccnn1Cc1ccccc1F ZINC001213491527 1050670010 /nfs/dbraw/zinc/67/00/10/1050670010.db2.gz MREUQYCVDZWKGR-UHFFFAOYSA-N 1 2 322.387 4.395 20 0 DIADLO COC(=O)c1ccc(Nc2cc(C3CC3)c[nH+]c2C)cc1Cl ZINC001213497437 1050671538 /nfs/dbraw/zinc/67/15/38/1050671538.db2.gz OVGISSRKRNWNID-UHFFFAOYSA-N 1 2 316.788 4.451 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cnc(Br)c(F)c1 ZINC001213497088 1050671718 /nfs/dbraw/zinc/67/17/18/1050671718.db2.gz IDRSNPHQOFNXDQ-UHFFFAOYSA-N 1 2 322.181 4.308 20 0 DIADLO c1cc([NH2+]CCC2=CCCCC2)cc2c1NCC21CCOCC1 ZINC001168772483 1050671979 /nfs/dbraw/zinc/67/19/79/1050671979.db2.gz WZHZMAHEIRJWHG-UHFFFAOYSA-N 1 2 312.457 4.463 20 0 DIADLO COc1cc(Nc2cc(C3CC3)c[nH+]c2C)cc(OC)c1OC ZINC001213501263 1050673788 /nfs/dbraw/zinc/67/37/88/1050673788.db2.gz POFACIVAXOWQNT-UHFFFAOYSA-N 1 2 314.385 4.037 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2c(c1)CC(C)(C)NC2=O ZINC001213503770 1050673983 /nfs/dbraw/zinc/67/39/83/1050673983.db2.gz XCQBLGNGQPNIPQ-UHFFFAOYSA-N 1 2 321.424 4.076 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cc(N)ccc1OC(F)(F)F ZINC001213501367 1050674464 /nfs/dbraw/zinc/67/44/64/1050674464.db2.gz VJLZNVAAKGRDBW-UHFFFAOYSA-N 1 2 323.318 4.492 20 0 DIADLO COC(=O)c1c(C)ccc(Nc2cc(C3CC3)c[nH+]c2C)c1F ZINC001213503598 1050674935 /nfs/dbraw/zinc/67/49/35/1050674935.db2.gz OFJMIRJHAFAOAF-UHFFFAOYSA-N 1 2 314.360 4.245 20 0 DIADLO Cc1nc(-c2ccc(Nc3cc(C4CC4)c[nH+]c3C)cc2)no1 ZINC001213500856 1050675172 /nfs/dbraw/zinc/67/51/72/1050675172.db2.gz AGDIOFKFFFPNHO-UHFFFAOYSA-N 1 2 306.369 4.369 20 0 DIADLO COC(=O)c1c(F)cc(Nc2cc(C3CC3)c[nH+]c2C)cc1F ZINC001213501210 1050675231 /nfs/dbraw/zinc/67/52/31/1050675231.db2.gz MUPVMOFYVIGHLU-UHFFFAOYSA-N 1 2 318.323 4.076 20 0 DIADLO COC(=O)/C=C/c1ccc(Nc2cc(C3CC3)c[nH+]c2C)cc1 ZINC001213503391 1050675303 /nfs/dbraw/zinc/67/53/03/1050675303.db2.gz COLJPUBLLUBJBF-BJMVGYQFSA-N 1 2 308.381 4.197 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2c(c1)CN(C)C(=O)N2C ZINC001213503820 1050675345 /nfs/dbraw/zinc/67/53/45/1050675345.db2.gz ZTFNDXZXRJJSSI-UHFFFAOYSA-N 1 2 322.412 4.013 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc2c(c1)CCCC(=O)N2 ZINC001213500929 1050675361 /nfs/dbraw/zinc/67/53/61/1050675361.db2.gz CZCPVYYTNPUZAU-UHFFFAOYSA-N 1 2 307.397 4.286 20 0 DIADLO Cc1cc(C)c(Nc2cc(Br)c(C)cc2O)c[nH+]1 ZINC001213518269 1050676702 /nfs/dbraw/zinc/67/67/02/1050676702.db2.gz FDAORORZAYQNFY-UHFFFAOYSA-N 1 2 307.191 4.219 20 0 DIADLO Cc1cc(C)c(Nc2ccc3cnn([C@H]4CCCCO4)c3c2)c[nH+]1 ZINC001213515975 1050676746 /nfs/dbraw/zinc/67/67/46/1050676746.db2.gz WDBBZZZMCOMKPO-LJQANCHMSA-N 1 2 322.412 4.491 20 0 DIADLO COc1cccc(Nc2c[nH+]c(C)cc2C)c1Br ZINC001213513392 1050677009 /nfs/dbraw/zinc/67/70/09/1050677009.db2.gz IEMIAYVDUOHKPA-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1cc(C)c(Nc2c(Cl)nccc2Br)c[nH+]1 ZINC001213511012 1050677180 /nfs/dbraw/zinc/67/71/80/1050677180.db2.gz RDMNZODPHLKJDN-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1cc(C)c(Nc2ccccc2C(=O)Nc2cccnc2)c[nH+]1 ZINC001213515907 1050677746 /nfs/dbraw/zinc/67/77/46/1050677746.db2.gz RWASQRRXRJRTOP-UHFFFAOYSA-N 1 2 318.380 4.089 20 0 DIADLO CCOC(=O)CCc1ccc(Nc2c[nH+]c(C)cc2C)cc1F ZINC001213521111 1050678910 /nfs/dbraw/zinc/67/89/10/1050678910.db2.gz ULQKGBCFPGKFJS-UHFFFAOYSA-N 1 2 316.376 4.077 20 0 DIADLO Cc1c[nH+]cc(Nc2cccnc2OCc2ccccc2)c1C ZINC001213527456 1050679165 /nfs/dbraw/zinc/67/91/65/1050679165.db2.gz LUXGAVFCWINKPR-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO Cc1c[nH+]cc(Nc2nc(F)cc(C(F)(F)F)c2F)c1C ZINC001213522878 1050679628 /nfs/dbraw/zinc/67/96/28/1050679628.db2.gz IKBZGYAHOVKXBF-UHFFFAOYSA-N 1 2 303.234 4.134 20 0 DIADLO Cc1c[nH+]cc(Nc2cncc(Br)c2Cl)c1C ZINC001213524647 1050679891 /nfs/dbraw/zinc/67/98/91/1050679891.db2.gz BCGBUMGGQPXZBJ-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc3c(cnn3[C@H]3CCCCO3)c2)c1C ZINC001213531233 1050681626 /nfs/dbraw/zinc/68/16/26/1050681626.db2.gz XGNLEPPLNPAVSD-LJQANCHMSA-N 1 2 322.412 4.491 20 0 DIADLO Cc1c[nH+]cc(Nc2cc(F)ccc2OC[C@@H]2CCCO2)c1C ZINC001213531284 1050681918 /nfs/dbraw/zinc/68/19/18/1050681918.db2.gz ZKXGMCSUGZPSMM-HNNXBMFYSA-N 1 2 316.376 4.139 20 0 DIADLO COc1cccc(Nc2c[nH+]cc(C)c2C)c1C(=O)C(F)(F)F ZINC001213536223 1050682211 /nfs/dbraw/zinc/68/22/11/1050682211.db2.gz CKCXZEGQHBHAND-UHFFFAOYSA-N 1 2 324.302 4.196 20 0 DIADLO CCOC(=O)c1cnc2c(cccc2Nc2c[nH+]cc(C)c2C)c1 ZINC001213534238 1050682436 /nfs/dbraw/zinc/68/24/36/1050682436.db2.gz SQHHKYAYSLVIFU-UHFFFAOYSA-N 1 2 321.380 4.167 20 0 DIADLO Cc1c[nH+]cc(Nc2cccc(C(=O)N3CCCCC3)c2)c1C ZINC001213530661 1050682465 /nfs/dbraw/zinc/68/24/65/1050682465.db2.gz JVPQCQHFWDQXFL-UHFFFAOYSA-N 1 2 309.413 4.068 20 0 DIADLO Cc1cc(N2CCOCC2)ccc1Nc1cccc(C(C)C)[nH+]1 ZINC001213556684 1050684315 /nfs/dbraw/zinc/68/43/15/1050684315.db2.gz WXLPGCJGOSGUCF-UHFFFAOYSA-N 1 2 311.429 4.094 20 0 DIADLO COCc1ccc(C)c(Nc2ccc[nH+]c2N2CCCCC2)c1 ZINC001213570942 1050686047 /nfs/dbraw/zinc/68/60/47/1050686047.db2.gz IFMROYUPUXJKIB-UHFFFAOYSA-N 1 2 311.429 4.270 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(Cl)cn1)c1ccc(Cl)cc1Cl ZINC000788487492 1050690199 /nfs/dbraw/zinc/69/01/99/1050690199.db2.gz HVSAROQIYNLFAP-QMMMGPOBSA-N 1 2 316.619 4.288 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(Cl)cn1)c1cccc(Cl)c1Cl ZINC000788489896 1050690380 /nfs/dbraw/zinc/69/03/80/1050690380.db2.gz TYWWKTDASCFWHJ-MRVPVSSYSA-N 1 2 316.619 4.288 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(Cl)cn1)c1cccc(Cl)c1Cl ZINC000788489897 1050691120 /nfs/dbraw/zinc/69/11/20/1050691120.db2.gz TYWWKTDASCFWHJ-QMMMGPOBSA-N 1 2 316.619 4.288 20 0 DIADLO Fc1cc2c(cc1F)C[N@H+](Cc1ccc3scnc3c1)CC2 ZINC001144745343 1050696809 /nfs/dbraw/zinc/69/68/09/1050696809.db2.gz XNQVITZOYSKNPS-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO Fc1cc2c(cc1F)C[N@@H+](Cc1ccc3scnc3c1)CC2 ZINC001144745343 1050696816 /nfs/dbraw/zinc/69/68/16/1050696816.db2.gz XNQVITZOYSKNPS-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1SC(C)(C)C)c1nncn1C ZINC000788589421 1050710437 /nfs/dbraw/zinc/71/04/37/1050710437.db2.gz RFMJZXPGEVJVLQ-STQMWFEESA-N 1 2 318.490 4.118 20 0 DIADLO C[C@H]1CCc2c(sc3ncnc(NC(=[NH2+])C(C)(C)C)c23)C1 ZINC001155181089 1050715834 /nfs/dbraw/zinc/71/58/34/1050715834.db2.gz GZUFOJZQTNBDSM-VIFPVBQESA-N 1 2 302.447 4.251 20 0 DIADLO Clc1cccc2c1[C@@H]([NH2+]Cc1cc3ccccc3o1)COC2 ZINC000788646852 1050716917 /nfs/dbraw/zinc/71/69/17/1050716917.db2.gz DRSBRPVNRROBLY-INIZCTEOSA-N 1 2 313.784 4.447 20 0 DIADLO C[C@@H]1CCc2c(sc3ncnc(NC(=[NH2+])C(C)(C)C)c23)C1 ZINC001155181088 1050717139 /nfs/dbraw/zinc/71/71/39/1050717139.db2.gz GZUFOJZQTNBDSM-SECBINFHSA-N 1 2 302.447 4.251 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1cc(F)c(Cl)cc1F ZINC000788618724 1050718500 /nfs/dbraw/zinc/71/85/00/1050718500.db2.gz AMBUCVFFNRINGC-QMMMGPOBSA-N 1 2 314.763 4.328 20 0 DIADLO Cc1cc(CSCc2ccc(-n3cc[nH+]c3)cc2C)nc(C)n1 ZINC000596357186 1050723302 /nfs/dbraw/zinc/72/33/02/1050723302.db2.gz NBYOMRJOJZYCAU-UHFFFAOYSA-N 1 2 324.453 4.021 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3CCC[C@H](C)C3)c2)[nH+]c1C ZINC000741673428 1050725853 /nfs/dbraw/zinc/72/58/53/1050725853.db2.gz TWCSTXMKWADYHO-BLLLJJGKSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3CCC[C@@H](C)C3)c2)[nH+]c1C ZINC000741673439 1050726625 /nfs/dbraw/zinc/72/66/25/1050726625.db2.gz TWCSTXMKWADYHO-WBMJQRKESA-N 1 2 311.429 4.458 20 0 DIADLO Cc1cc2cc(Nc3ccccc3C[NH+]3CCOCC3)ccc2[nH]1 ZINC001213791908 1050742347 /nfs/dbraw/zinc/74/23/47/1050742347.db2.gz SDSLDCLGGOGVHW-UHFFFAOYSA-N 1 2 321.424 4.052 20 0 DIADLO CC(C)[C@@H](O)Cc1ccccc1-c1cccc(Cn2cc[nH+]c2)c1 ZINC000846778562 1050748527 /nfs/dbraw/zinc/74/85/27/1050748527.db2.gz DUJSQMMXOQNPMJ-NRFANRHFSA-N 1 2 320.436 4.158 20 0 DIADLO O[C@H](c1ccc(-c2cccc(Cn3cc[nH+]c3)c2)cc1)C1CC1 ZINC000846780375 1050748716 /nfs/dbraw/zinc/74/87/16/1050748716.db2.gz VFPWIHJGECWUGV-HXUWFJFHSA-N 1 2 304.393 4.042 20 0 DIADLO COc1ccccc1C[N@H+](Cc1cnc(Cl)c(F)c1)C1CC1 ZINC000846776808 1050749080 /nfs/dbraw/zinc/74/90/80/1050749080.db2.gz YNDFAANQMKSHSZ-UHFFFAOYSA-N 1 2 320.795 4.047 20 0 DIADLO COc1ccccc1C[N@@H+](Cc1cnc(Cl)c(F)c1)C1CC1 ZINC000846776808 1050749093 /nfs/dbraw/zinc/74/90/93/1050749093.db2.gz YNDFAANQMKSHSZ-UHFFFAOYSA-N 1 2 320.795 4.047 20 0 DIADLO O[C@@H](c1ccc(-c2cccc(Cn3cc[nH+]c3)c2)cc1)C1CC1 ZINC000846780373 1050749565 /nfs/dbraw/zinc/74/95/65/1050749565.db2.gz VFPWIHJGECWUGV-FQEVSTJZSA-N 1 2 304.393 4.042 20 0 DIADLO Clc1ccc(C2([NH2+]Cc3cnsn3)CCCCC2)cc1 ZINC000846821217 1050766057 /nfs/dbraw/zinc/76/60/57/1050766057.db2.gz CYDFHIQITBDWDM-UHFFFAOYSA-N 1 2 307.850 4.141 20 0 DIADLO Clc1ccc([C@H]([NH2+]Cc2cnsn2)C2CCCC2)cc1 ZINC000846845613 1050770309 /nfs/dbraw/zinc/77/03/09/1050770309.db2.gz ZPPQCDXIEQEJLQ-OAHLLOKOSA-N 1 2 307.850 4.213 20 0 DIADLO c1cc(N2CCSCC2)ccc1[NH2+][C@H]1CCC12CCCC2 ZINC000788984023 1050771963 /nfs/dbraw/zinc/77/19/63/1050771963.db2.gz MGPXLZRXVOWTMS-KRWDZBQOSA-N 1 2 302.487 4.375 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cc(F)c(CO)c(F)c3)ccc12 ZINC001214036832 1050801913 /nfs/dbraw/zinc/80/19/13/1050801913.db2.gz CPGMFOLDQPTTMY-UHFFFAOYSA-N 1 2 300.308 4.057 20 0 DIADLO COc1cc(F)c(Nc2ccc(N3CCCC3)[nH+]c2)cc1Cl ZINC001214062842 1050807894 /nfs/dbraw/zinc/80/78/94/1050807894.db2.gz OGPYEDLLOWEJLT-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H]1CCCc2cc(OC(F)F)ccc21 ZINC000180331717 1050809730 /nfs/dbraw/zinc/80/97/30/1050809730.db2.gz IVVRLLFPCUIGTP-QFYYESIMSA-N 1 2 321.371 4.048 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000180322568 1050809902 /nfs/dbraw/zinc/80/99/02/1050809902.db2.gz WASJJEVKXUFYPW-KZULUSFZSA-N 1 2 301.409 4.439 20 0 DIADLO CN(c1ccc(N2CCc3c2cccc3N)c[nH+]1)C1CCCCC1 ZINC001212615294 1050811440 /nfs/dbraw/zinc/81/14/40/1050811440.db2.gz SIZOWXXGPLKAKJ-UHFFFAOYSA-N 1 2 322.456 4.127 20 0 DIADLO C[C@@H]([NH2+]C1(c2ccccc2Cl)CC1)c1cn2ccccc2n1 ZINC000655779878 1050818843 /nfs/dbraw/zinc/81/88/43/1050818843.db2.gz SZPFPXPWGXLJBA-CYBMUJFWSA-N 1 2 311.816 4.328 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2cc(O)ccc2Br)c(C)o1 ZINC000126860517 1050825769 /nfs/dbraw/zinc/82/57/69/1050825769.db2.gz RKBJAXPZCAUDCM-JTQLQIEISA-N 1 2 324.218 4.215 20 0 DIADLO Cc1nc(NC2CCN(c3ccc(C(C)(C)C)cc3)CC2)cc[nH+]1 ZINC000742395657 1050829979 /nfs/dbraw/zinc/82/99/79/1050829979.db2.gz CXSKJTRHWXSWNL-UHFFFAOYSA-N 1 2 324.472 4.163 20 0 DIADLO CCCC[C@H]([NH2+][C@H](C)c1cn[nH]c1C)c1ccc(OC)cc1 ZINC000180424660 1050834239 /nfs/dbraw/zinc/83/42/39/1050834239.db2.gz HJEGYCKPCVICIT-ACJLOTCBSA-N 1 2 301.434 4.309 20 0 DIADLO Cc1cc(N[C@@H]2COCc3ccccc32)[nH+]cc1C(F)(F)F ZINC001171291477 1050848594 /nfs/dbraw/zinc/84/85/94/1050848594.db2.gz ZWHNEEIHGGKBIT-CQSZACIVSA-N 1 2 308.303 4.092 20 0 DIADLO CCCCC[C@@H](C)CC(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000742575614 1050891290 /nfs/dbraw/zinc/89/12/90/1050891290.db2.gz GJFIZIJRGHGIMD-CVEARBPZSA-N 1 2 307.482 4.021 20 0 DIADLO CCCc1ccc(-c2ccc(NC(=O)[C@H]3CC[N@@H+]3CC)cc2)cc1 ZINC001147593401 1050894539 /nfs/dbraw/zinc/89/45/39/1050894539.db2.gz GIPRZHNXACPYMN-HXUWFJFHSA-N 1 2 322.452 4.339 20 0 DIADLO CCCc1ccc(-c2ccc(NC(=O)[C@H]3CC[N@H+]3CC)cc2)cc1 ZINC001147593401 1050894547 /nfs/dbraw/zinc/89/45/47/1050894547.db2.gz GIPRZHNXACPYMN-HXUWFJFHSA-N 1 2 322.452 4.339 20 0 DIADLO COCOc1ccc(Cl)cc1Nc1cccn2cc(C)[nH+]c12 ZINC001214418752 1050898055 /nfs/dbraw/zinc/89/80/55/1050898055.db2.gz KKSAGBIGICPEBF-UHFFFAOYSA-N 1 2 317.776 4.022 20 0 DIADLO CC[C@@H](Cc1ccccc1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000602125276 1050905005 /nfs/dbraw/zinc/90/50/05/1050905005.db2.gz RJFZFGZRYXAYET-INIZCTEOSA-N 1 2 319.408 4.284 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000790154855 1050918810 /nfs/dbraw/zinc/91/88/10/1050918810.db2.gz MCFWAVRVYKQFFJ-FUHWJXTLSA-N 1 2 318.461 4.058 20 0 DIADLO COc1c(C)ccc(F)c1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001214534798 1050933298 /nfs/dbraw/zinc/93/32/98/1050933298.db2.gz SVORFTLSVUEJNQ-UHFFFAOYSA-N 1 2 311.360 4.131 20 0 DIADLO CC(C)(C)[C@@H]1C[N@H+](Cc2cc3ccccc3nc2Cl)CCO1 ZINC000790425591 1050958137 /nfs/dbraw/zinc/95/81/37/1050958137.db2.gz CKPDTRVVMKQZMT-INIZCTEOSA-N 1 2 318.848 4.135 20 0 DIADLO CC(C)(C)[C@@H]1C[N@@H+](Cc2cc3ccccc3nc2Cl)CCO1 ZINC000790425591 1050958149 /nfs/dbraw/zinc/95/81/49/1050958149.db2.gz CKPDTRVVMKQZMT-INIZCTEOSA-N 1 2 318.848 4.135 20 0 DIADLO COc1c(F)cc(Nc2cccc(C)[nH+]2)cc1C(F)(F)F ZINC001214633136 1050967460 /nfs/dbraw/zinc/96/74/60/1050967460.db2.gz GDPVMWJHYQEVAO-UHFFFAOYSA-N 1 2 300.255 4.300 20 0 DIADLO Cc1cc(-c2nnc(C[NH2+][C@H](C)c3cc(C)oc3C)o2)c(C)o1 ZINC000348112238 1050988341 /nfs/dbraw/zinc/98/83/41/1050988341.db2.gz PABJOBKEUYIYPR-LLVKDONJSA-N 1 2 315.373 4.007 20 0 DIADLO CC[N@H+](Cc1ncc(-c2ccccc2)s1)Cc1ccncc1 ZINC000348130746 1050991451 /nfs/dbraw/zinc/99/14/51/1050991451.db2.gz XWFAGYYBVJMEAM-UHFFFAOYSA-N 1 2 309.438 4.227 20 0 DIADLO CC[N@@H+](Cc1ncc(-c2ccccc2)s1)Cc1ccncc1 ZINC000348130746 1050991459 /nfs/dbraw/zinc/99/14/59/1050991459.db2.gz XWFAGYYBVJMEAM-UHFFFAOYSA-N 1 2 309.438 4.227 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2cc3ccccc3s2)o1 ZINC000348190049 1051002671 /nfs/dbraw/zinc/00/26/71/1051002671.db2.gz ZUVWRZUISODPCB-GHMZBOCLSA-N 1 2 301.415 4.259 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@@H](Cc1ccccc1)c1cccs1 ZINC000180903824 1051016423 /nfs/dbraw/zinc/01/64/23/1051016423.db2.gz KGFBUHHPYVBECN-DYVFJYSZSA-N 1 2 311.454 4.414 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cccc(C)c2OCOC)cc1 ZINC001214860128 1051016714 /nfs/dbraw/zinc/01/67/14/1051016714.db2.gz QBVWYEQILCQHDN-UHFFFAOYSA-N 1 2 300.402 4.177 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cccc(C)c2OCOC)cc1 ZINC001214860128 1051016722 /nfs/dbraw/zinc/01/67/22/1051016722.db2.gz QBVWYEQILCQHDN-UHFFFAOYSA-N 1 2 300.402 4.177 20 0 DIADLO CCCC[N@@H+](Cc1ccccc1Cl)CN1C(=O)CC12CCC2 ZINC000743361100 1051017959 /nfs/dbraw/zinc/01/79/59/1051017959.db2.gz SZEIVEMQUPNYNZ-UHFFFAOYSA-N 1 2 320.864 4.055 20 0 DIADLO CCCC[N@H+](Cc1ccccc1Cl)CN1C(=O)CC12CCC2 ZINC000743361100 1051017971 /nfs/dbraw/zinc/01/79/71/1051017971.db2.gz SZEIVEMQUPNYNZ-UHFFFAOYSA-N 1 2 320.864 4.055 20 0 DIADLO CCC[C@H]1CC(=O)N(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)C1 ZINC000743349205 1051021456 /nfs/dbraw/zinc/02/14/56/1051021456.db2.gz BZJVPHYOHIMROZ-YOEHRIQHSA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@H]1CC(=O)N(C[N@H+]2CCC[C@H]2c2ccccc2Cl)C1 ZINC000743349205 1051021464 /nfs/dbraw/zinc/02/14/64/1051021464.db2.gz BZJVPHYOHIMROZ-YOEHRIQHSA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@H]1[C@H](C)CCC[N@@H+]1Cn1nnc2ccccc2c1=S ZINC000743379455 1051024319 /nfs/dbraw/zinc/02/43/19/1051024319.db2.gz PAGQMAHIHWPOMY-CJNGLKHVSA-N 1 2 316.474 4.019 20 0 DIADLO CCC[C@H]1[C@H](C)CCC[N@H+]1Cn1nnc2ccccc2c1=S ZINC000743379455 1051024328 /nfs/dbraw/zinc/02/43/28/1051024328.db2.gz PAGQMAHIHWPOMY-CJNGLKHVSA-N 1 2 316.474 4.019 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2c1cccc2Cl)c1cccnc1Cl ZINC000773038796 1051035596 /nfs/dbraw/zinc/03/55/96/1051035596.db2.gz CFOLCFUCAGLGDD-ZANVPECISA-N 1 2 309.196 4.173 20 0 DIADLO CCN(C)c1ccc(Nc2cc(F)c(OC)c(Cl)c2)c[nH+]1 ZINC001214969629 1051037980 /nfs/dbraw/zinc/03/79/80/1051037980.db2.gz ZDHCEQLZDOLGLP-UHFFFAOYSA-N 1 2 309.772 4.082 20 0 DIADLO CC(=O)c1ccc(Nc2ccccc2-n2cc[nH+]c2)c(F)c1F ZINC001214983346 1051043211 /nfs/dbraw/zinc/04/32/11/1051043211.db2.gz BJUIFOQFIMXNDY-UHFFFAOYSA-N 1 2 313.307 4.097 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2cccc(F)c2)C(C)(C)C)o1 ZINC000181061116 1051049197 /nfs/dbraw/zinc/04/91/97/1051049197.db2.gz PZBZPLAFPXCDLO-HNNXBMFYSA-N 1 2 305.397 4.209 20 0 DIADLO Cc1cc(CC(C)C)[nH+]cc1Nc1ccc(CO)c(F)c1F ZINC001215032615 1051056294 /nfs/dbraw/zinc/05/62/94/1051056294.db2.gz DUZZNXZASWCARU-UHFFFAOYSA-N 1 2 306.356 4.103 20 0 DIADLO Cc1ccc2c(Nc3cccc(C(=O)N(C)C)c3F)cccc2[nH+]1 ZINC001215151872 1051090969 /nfs/dbraw/zinc/09/09/69/1051090969.db2.gz DSBNQVLMIANHJM-UHFFFAOYSA-N 1 2 323.371 4.128 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ncc(Br)s2)cs1 ZINC000714936001 1051097146 /nfs/dbraw/zinc/09/71/46/1051097146.db2.gz DKKPRJGPPNGDSE-MRVPVSSYSA-N 1 2 317.277 4.126 20 0 DIADLO Cc1cn2c(cccc2Nc2c(F)ccc(OC(C)C)c2F)[nH+]1 ZINC001215169937 1051098668 /nfs/dbraw/zinc/09/86/68/1051098668.db2.gz ABGRPZLDSUIADV-UHFFFAOYSA-N 1 2 317.339 4.452 20 0 DIADLO Nc1cc(COC(=O)CC2CCC(c3ccccc3)CC2)cc[nH+]1 ZINC000791874875 1051105725 /nfs/dbraw/zinc/10/57/25/1051105725.db2.gz HAJRXFGQMMJTBI-UHFFFAOYSA-N 1 2 324.424 4.071 20 0 DIADLO COc1cc(CO)ccc1Nc1cc[nH+]c2cc(Cl)ccc12 ZINC001215202562 1051114252 /nfs/dbraw/zinc/11/42/52/1051114252.db2.gz NAMFNAYYALTGJO-UHFFFAOYSA-N 1 2 314.772 4.133 20 0 DIADLO Cc1ccc(F)cc1-c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001215250726 1051134385 /nfs/dbraw/zinc/13/43/85/1051134385.db2.gz ZCSGZTQFCGIINY-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1ccc(OCOC)c(Cl)c1 ZINC001215257575 1051137815 /nfs/dbraw/zinc/13/78/15/1051137815.db2.gz JBMCKMUGQONJFS-UHFFFAOYSA-N 1 2 306.793 4.332 20 0 DIADLO COc1cccc2[nH+]c(NCCOC3CCCCC3)ccc21 ZINC001171473160 1051149361 /nfs/dbraw/zinc/14/93/61/1051149361.db2.gz AUWYAZQQZJCCKT-UHFFFAOYSA-N 1 2 300.402 4.005 20 0 DIADLO COc1cccc(C2([NH2+]Cc3nccc(Cl)c3Cl)CC2)c1 ZINC001170172039 1051149730 /nfs/dbraw/zinc/14/97/30/1051149730.db2.gz FGTYYMKNYBLMBU-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO C[C@]12CC[N@H+](Cc3cc(Cl)ccc3F)C[C@H]1C2(Cl)Cl ZINC001170231061 1051156158 /nfs/dbraw/zinc/15/61/58/1051156158.db2.gz ISOIMYWJIZFLSF-OLZOCXBDSA-N 1 2 322.638 4.495 20 0 DIADLO C[C@]12CC[N@@H+](Cc3cc(Cl)ccc3F)C[C@H]1C2(Cl)Cl ZINC001170231061 1051156163 /nfs/dbraw/zinc/15/61/63/1051156163.db2.gz ISOIMYWJIZFLSF-OLZOCXBDSA-N 1 2 322.638 4.495 20 0 DIADLO CC(C)(Nc1cc[nH+]c2[nH]cc(C(F)(F)F)c21)c1ccncc1 ZINC001171517106 1051159980 /nfs/dbraw/zinc/15/99/80/1051159980.db2.gz PBQMTOGDAACADP-UHFFFAOYSA-N 1 2 320.318 4.324 20 0 DIADLO Cn1c[nH+]c2ccc(NCc3nc(-c4ccccc4)cs3)cc21 ZINC001170246273 1051162255 /nfs/dbraw/zinc/16/22/55/1051162255.db2.gz UDSAUZQANSFEMB-UHFFFAOYSA-N 1 2 320.421 4.309 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3ccc(Br)cc3C2)cs1 ZINC001170253366 1051174178 /nfs/dbraw/zinc/17/41/78/1051174178.db2.gz KEOIUEROSFNPTB-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1cc(C[N@H+]2CCc3ccc(Br)cc3C2)cs1 ZINC001170253366 1051174185 /nfs/dbraw/zinc/17/41/85/1051174185.db2.gz KEOIUEROSFNPTB-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cn1nc(-c2cccs2)oc1=S ZINC000744443764 1051177388 /nfs/dbraw/zinc/17/73/88/1051177388.db2.gz OHNYGRZZAHGDRN-GHMZBOCLSA-N 1 2 309.460 4.012 20 0 DIADLO CC[C@@H]1C[C@@H](C)C[N@H+]1Cn1nc(-c2cccs2)oc1=S ZINC000744443764 1051177397 /nfs/dbraw/zinc/17/73/97/1051177397.db2.gz OHNYGRZZAHGDRN-GHMZBOCLSA-N 1 2 309.460 4.012 20 0 DIADLO CC[C@H]([NH2+]Cc1cnc(C)s1)c1nc(C(F)(F)F)cs1 ZINC000744448988 1051178457 /nfs/dbraw/zinc/17/84/57/1051178457.db2.gz PYSNJGJPVKLELQ-VIFPVBQESA-N 1 2 321.393 4.168 20 0 DIADLO CCc1ccc(C2=CCN(Cc3cc(OC)cc(C)[nH+]3)CC2)cc1 ZINC001168774134 1051184388 /nfs/dbraw/zinc/18/43/88/1051184388.db2.gz IZYHFHNWJPXMPN-UHFFFAOYSA-N 1 2 322.452 4.250 20 0 DIADLO CCOc1c(F)c(F)ccc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001215415479 1051194616 /nfs/dbraw/zinc/19/46/16/1051194616.db2.gz VYVFTMYENNSORH-UHFFFAOYSA-N 1 2 315.323 4.293 20 0 DIADLO COc1cc(C)[nH+]c(CN2CC3(CC=CC3)[C@H]2c2ccccc2)c1 ZINC001171719855 1051200549 /nfs/dbraw/zinc/20/05/49/1051200549.db2.gz XLEUWJNOHGHPAZ-HXUWFJFHSA-N 1 2 320.436 4.292 20 0 DIADLO COc1ccc2c(c1)C[C@@H](Nc1ccc([NH+](C)C)c(C)c1)CC2 ZINC001170411652 1051203385 /nfs/dbraw/zinc/20/33/85/1051203385.db2.gz ANOXFWBDRUUTAB-SFHVURJKSA-N 1 2 310.441 4.039 20 0 DIADLO COc1c(C)c[nH+]c(CN2CC(C)(C)c3ccc(F)cc32)c1C ZINC001171692371 1051206176 /nfs/dbraw/zinc/20/61/76/1051206176.db2.gz CPJRYDYCNWXQLR-UHFFFAOYSA-N 1 2 314.404 4.144 20 0 DIADLO COCc1cc[nH+]c(NCc2cccc(C(F)(F)F)c2C)c1 ZINC001157732164 1051206530 /nfs/dbraw/zinc/20/65/30/1051206530.db2.gz DXNSRFZSPXRFMB-UHFFFAOYSA-N 1 2 310.319 4.167 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)OC[C@H](C)c1ccccc1)c1ccccc1 ZINC000745099661 1051221169 /nfs/dbraw/zinc/22/11/69/1051221169.db2.gz KDYYVGQEMDHDCM-QFBILLFUSA-N 1 2 311.425 4.026 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)OC[C@H](C)c1ccccc1)c1ccccc1 ZINC000745099661 1051221183 /nfs/dbraw/zinc/22/11/83/1051221183.db2.gz KDYYVGQEMDHDCM-QFBILLFUSA-N 1 2 311.425 4.026 20 0 DIADLO CC[C@@H](OC(=O)[C@@H](c1ccccc1)[N@H+](C)CC)c1ccccc1 ZINC000745098702 1051222137 /nfs/dbraw/zinc/22/21/37/1051222137.db2.gz UZCBRLUQKPLCDF-RTBURBONSA-N 1 2 311.425 4.374 20 0 DIADLO CC[C@@H](OC(=O)[C@@H](c1ccccc1)[N@@H+](C)CC)c1ccccc1 ZINC000745098702 1051222150 /nfs/dbraw/zinc/22/21/50/1051222150.db2.gz UZCBRLUQKPLCDF-RTBURBONSA-N 1 2 311.425 4.374 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)O[C@H](C)c1ccccc1F)c1ccccc1 ZINC000745097591 1051222713 /nfs/dbraw/zinc/22/27/13/1051222713.db2.gz GVTVEQCKVWUOIS-KDOFPFPSSA-N 1 2 315.388 4.123 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)O[C@H](C)c1ccccc1F)c1ccccc1 ZINC000745097591 1051222719 /nfs/dbraw/zinc/22/27/19/1051222719.db2.gz GVTVEQCKVWUOIS-KDOFPFPSSA-N 1 2 315.388 4.123 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1cc(O)cc(C(F)(F)F)c1)CC2 ZINC001171815371 1051227831 /nfs/dbraw/zinc/22/78/31/1051227831.db2.gz NBJMMQFLFDERNJ-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1cc(O)cc(C(F)(F)F)c1)CC2 ZINC001171815371 1051227842 /nfs/dbraw/zinc/22/78/42/1051227842.db2.gz NBJMMQFLFDERNJ-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO Fc1ccc([C@@H]2CC[N@@H+]2Cc2cnn(Cc3ccccc3)c2)cc1 ZINC001171846814 1051231113 /nfs/dbraw/zinc/23/11/13/1051231113.db2.gz FMYFUBWWYMYPEZ-FQEVSTJZSA-N 1 2 321.399 4.018 20 0 DIADLO Fc1ccc([C@@H]2CC[N@H+]2Cc2cnn(Cc3ccccc3)c2)cc1 ZINC001171846814 1051231123 /nfs/dbraw/zinc/23/11/23/1051231123.db2.gz FMYFUBWWYMYPEZ-FQEVSTJZSA-N 1 2 321.399 4.018 20 0 DIADLO COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1coc(C2CC2)n1 ZINC000747100324 1051244778 /nfs/dbraw/zinc/24/47/78/1051244778.db2.gz WWCQXRFKKWPEEY-KRWDZBQOSA-N 1 2 314.429 4.438 20 0 DIADLO CCCOc1ccc(F)c(Nc2cccn3cc[nH+]c23)c1F ZINC001215567231 1051248241 /nfs/dbraw/zinc/24/82/41/1051248241.db2.gz UPNQNFOGUZTMSD-UHFFFAOYSA-N 1 2 303.312 4.145 20 0 DIADLO Cc1ccccc1Nc1nc(C[NH2+][C@@H](C)c2ccccn2)cs1 ZINC000182399653 1051249784 /nfs/dbraw/zinc/24/97/84/1051249784.db2.gz HJNJYBMEHVZZCX-AWEZNQCLSA-N 1 2 324.453 4.441 20 0 DIADLO CC1(C)C[C@@H]([N@H+](CC=C(Cl)Cl)Cc2ccccc2)CO1 ZINC001171936513 1051253607 /nfs/dbraw/zinc/25/36/07/1051253607.db2.gz BIMSFFNVDQTYSI-CQSZACIVSA-N 1 2 314.256 4.375 20 0 DIADLO CC1(C)C[C@@H]([N@@H+](CC=C(Cl)Cl)Cc2ccccc2)CO1 ZINC001171936513 1051253618 /nfs/dbraw/zinc/25/36/18/1051253618.db2.gz BIMSFFNVDQTYSI-CQSZACIVSA-N 1 2 314.256 4.375 20 0 DIADLO COCCOc1ccccc1Nc1ccc2c(C)cc[nH+]c2c1 ZINC001212640452 1051291483 /nfs/dbraw/zinc/29/14/83/1051291483.db2.gz ROVPQYYJZDHSEG-UHFFFAOYSA-N 1 2 308.381 4.312 20 0 DIADLO COc1ccc(CC/[NH+]=C/c2c(O)ccc3ccccc32)cc1 ZINC000005287394 1051294299 /nfs/dbraw/zinc/29/42/99/1051294299.db2.gz WPOMATPJSSBRGD-KGENOOAVSA-N 1 2 305.377 4.216 20 0 DIADLO COc1ccccc1CC/[NH+]=C/c1c(O)ccc2ccccc21 ZINC000005293697 1051296023 /nfs/dbraw/zinc/29/60/23/1051296023.db2.gz BRHQOIOSWYXGCE-KGENOOAVSA-N 1 2 305.377 4.216 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1cc(C(F)(F)F)ccc1CO ZINC001215683491 1051299287 /nfs/dbraw/zinc/29/92/87/1051299287.db2.gz JBMRQBYYRUQMRW-UHFFFAOYSA-N 1 2 310.319 4.207 20 0 DIADLO CC(C)c1ccc(NC(=O)C[N@H+](Cc2ccco2)C(C)C)cc1 ZINC000746115165 1051323078 /nfs/dbraw/zinc/32/30/78/1051323078.db2.gz NEJDBSZEWHPFRA-UHFFFAOYSA-N 1 2 314.429 4.252 20 0 DIADLO CC(C)c1ccc(NC(=O)C[N@@H+](Cc2ccco2)C(C)C)cc1 ZINC000746115165 1051323084 /nfs/dbraw/zinc/32/30/84/1051323084.db2.gz NEJDBSZEWHPFRA-UHFFFAOYSA-N 1 2 314.429 4.252 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)CC(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000746124772 1051326230 /nfs/dbraw/zinc/32/62/30/1051326230.db2.gz WGVFCQZPBAARSK-AWEZNQCLSA-N 1 2 314.429 4.209 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)CC(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000746124772 1051326238 /nfs/dbraw/zinc/32/62/38/1051326238.db2.gz WGVFCQZPBAARSK-AWEZNQCLSA-N 1 2 314.429 4.209 20 0 DIADLO C[C@]12CC[N@@H+](Cc3cc(F)c(F)c(F)c3)C[C@H]1C2(Cl)Cl ZINC000793613217 1051326867 /nfs/dbraw/zinc/32/68/67/1051326867.db2.gz LOQRCVDBIZOIJI-YPMHNXCESA-N 1 2 324.173 4.120 20 0 DIADLO C[C@]12CC[N@H+](Cc3cc(F)c(F)c(F)c3)C[C@H]1C2(Cl)Cl ZINC000793613217 1051326857 /nfs/dbraw/zinc/32/68/57/1051326857.db2.gz LOQRCVDBIZOIJI-YPMHNXCESA-N 1 2 324.173 4.120 20 0 DIADLO CC(C)Oc1c(F)ccc(Nc2ccc3c(c2)[nH+]cn3C)c1F ZINC001215729283 1051330077 /nfs/dbraw/zinc/33/00/77/1051330077.db2.gz ZMWYNFSJEDNNQF-UHFFFAOYSA-N 1 2 317.339 4.382 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@H]3[C@@H]4CCCC[C@@H]43)c2)[nH+]c1C ZINC000746157373 1051332871 /nfs/dbraw/zinc/33/28/71/1051332871.db2.gz KYNBJGYGKQRKBU-FVQHAEBGSA-N 1 2 309.413 4.068 20 0 DIADLO Cc1cc(OC(C)C)ncc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001215771995 1051357997 /nfs/dbraw/zinc/35/79/97/1051357997.db2.gz BXHWSHQSZODWCB-UHFFFAOYSA-N 1 2 322.412 4.166 20 0 DIADLO CCOc1cc[nH+]cc1Nc1ccnc(Oc2ccccc2)c1 ZINC001215775459 1051360734 /nfs/dbraw/zinc/36/07/34/1051360734.db2.gz SOUCOXNRPZTWIB-UHFFFAOYSA-N 1 2 307.353 4.411 20 0 DIADLO Cc1ccc([C@H](C)C(=O)Nc2cc(-c3[nH]cc[nH+]3)ccc2C)o1 ZINC000794207533 1051362298 /nfs/dbraw/zinc/36/22/98/1051362298.db2.gz QIYPCVBYTKTVHI-ZDUSSCGKSA-N 1 2 309.369 4.029 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2cccc(OC)c2F)on1 ZINC000192689267 1051369525 /nfs/dbraw/zinc/36/95/25/1051369525.db2.gz NGQVYHLQYRALGJ-UHFFFAOYSA-N 1 2 306.381 4.016 20 0 DIADLO O=C(CCc1c[nH]c[nH+]1)Nc1ccc(SC2CCCC2)cc1 ZINC000192618807 1051370825 /nfs/dbraw/zinc/37/08/25/1051370825.db2.gz RJPRMLYXRAWPJL-UHFFFAOYSA-N 1 2 315.442 4.016 20 0 DIADLO O=C(CCc1c[nH+]c[nH]1)Nc1ccc(SC2CCCC2)cc1 ZINC000192618807 1051370834 /nfs/dbraw/zinc/37/08/34/1051370834.db2.gz RJPRMLYXRAWPJL-UHFFFAOYSA-N 1 2 315.442 4.016 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@@H](C(C)(C)C)C[C@@H]2C)c(C)[nH+]1 ZINC001129395469 1051375622 /nfs/dbraw/zinc/37/56/22/1051375622.db2.gz PWBYEEPVDCVIDL-GOEBONIOSA-N 1 2 302.462 4.294 20 0 DIADLO Cc1ccc(F)c(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)c1 ZINC001215811962 1051385446 /nfs/dbraw/zinc/38/54/46/1051385446.db2.gz TVYOGQLVQXHDPY-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CC(C)[C@@H]1CCC[N@H+](Cn2nc(C3CC3)sc2=S)CC1 ZINC000746380165 1051387430 /nfs/dbraw/zinc/38/74/30/1051387430.db2.gz LPRADKWPROHGON-GFCCVEGCSA-N 1 2 311.520 4.267 20 0 DIADLO CC(C)[C@@H]1CCC[N@@H+](Cn2nc(C3CC3)sc2=S)CC1 ZINC000746380165 1051387439 /nfs/dbraw/zinc/38/74/39/1051387439.db2.gz LPRADKWPROHGON-GFCCVEGCSA-N 1 2 311.520 4.267 20 0 DIADLO CCSc1cccc(CNC(=O)c2c(C)cc(C)[nH+]c2C)c1 ZINC001129448632 1051388287 /nfs/dbraw/zinc/38/82/87/1051388287.db2.gz DRAOMURYNIMQNM-UHFFFAOYSA-N 1 2 314.454 4.049 20 0 DIADLO COc1cc(Nc2ccccc2NC(=O)C(C)(C)C)cc(C)[nH+]1 ZINC001215834069 1051397447 /nfs/dbraw/zinc/39/74/47/1051397447.db2.gz QSHDPDPDXYZWPJ-UHFFFAOYSA-N 1 2 313.401 4.127 20 0 DIADLO CSc1ccc(F)c(Nc2ccc(N3CCCC3)[nH+]c2)c1F ZINC001215837608 1051400898 /nfs/dbraw/zinc/40/08/98/1051400898.db2.gz UDSIGSVRRIFBQJ-UHFFFAOYSA-N 1 2 321.396 4.426 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H](c2cccnc2)C(F)(F)F)c1 ZINC001156162995 1051400983 /nfs/dbraw/zinc/40/09/83/1051400983.db2.gz IGXIDAOBSJPXOS-ZDUSSCGKSA-N 1 2 313.348 4.304 20 0 DIADLO CC(C)OCC[C@H](C)[N@@H+]1CC[C@H](c2ccccc2)C(F)(F)C1 ZINC001172461851 1051412706 /nfs/dbraw/zinc/41/27/06/1051412706.db2.gz VOALPZZOVFEMHQ-DOTOQJQBSA-N 1 2 311.416 4.315 20 0 DIADLO CC(C)OCC[C@H](C)[N@H+]1CC[C@H](c2ccccc2)C(F)(F)C1 ZINC001172461851 1051412716 /nfs/dbraw/zinc/41/27/16/1051412716.db2.gz VOALPZZOVFEMHQ-DOTOQJQBSA-N 1 2 311.416 4.315 20 0 DIADLO CC(C)OCC[C@@H](C)[N@@H+]1CC[C@H](c2ccccc2)C(F)(F)C1 ZINC001172461853 1051413753 /nfs/dbraw/zinc/41/37/53/1051413753.db2.gz VOALPZZOVFEMHQ-NVXWUHKLSA-N 1 2 311.416 4.315 20 0 DIADLO CC(C)OCC[C@@H](C)[N@H+]1CC[C@H](c2ccccc2)C(F)(F)C1 ZINC001172461853 1051413756 /nfs/dbraw/zinc/41/37/56/1051413756.db2.gz VOALPZZOVFEMHQ-NVXWUHKLSA-N 1 2 311.416 4.315 20 0 DIADLO CCCCC[C@H]1CCCN1c1[nH+]cnc2c1cnn2C(C)(C)C ZINC000766424813 1051419154 /nfs/dbraw/zinc/41/91/54/1051419154.db2.gz NTSFOIVZYFLVMK-AWEZNQCLSA-N 1 2 315.465 4.130 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)OCc3csc4ccccc34)ccn12 ZINC001129514933 1051421505 /nfs/dbraw/zinc/42/15/05/1051421505.db2.gz OPLVKBUCCMRPGR-UHFFFAOYSA-N 1 2 322.389 4.214 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1ccc(C)c(F)c1 ZINC001168792333 1051422846 /nfs/dbraw/zinc/42/28/46/1051422846.db2.gz BGVYSQOPWQZMID-NHYWBVRUSA-N 1 2 303.381 4.196 20 0 DIADLO OCC[C@H](Nc1cc[nH+]c2c(Cl)cccc12)c1cccs1 ZINC000804498978 1051431333 /nfs/dbraw/zinc/43/13/33/1051431333.db2.gz WTDKZJKXMZGGBN-AWEZNQCLSA-N 1 2 318.829 4.485 20 0 DIADLO CC(C)c1cc(CNc2cc[nH+]c(OCc3ccccc3)c2)on1 ZINC001168827605 1051448129 /nfs/dbraw/zinc/44/81/29/1051448129.db2.gz PAZQGIJIMODOIP-UHFFFAOYSA-N 1 2 323.396 4.384 20 0 DIADLO CCCc1sc(C(=O)Nc2ccn3cc[nH+]c3c2)cc1CC ZINC001129593829 1051453540 /nfs/dbraw/zinc/45/35/40/1051453540.db2.gz IKOKTQCPWWSOJR-UHFFFAOYSA-N 1 2 313.426 4.163 20 0 DIADLO CC(C)c1ccc(/C=C/CC(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001129593711 1051454293 /nfs/dbraw/zinc/45/42/93/1051454293.db2.gz FPJNOWAOHWYBAX-ONEGZZNKSA-N 1 2 319.408 4.500 20 0 DIADLO Cc1cccc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)c1C ZINC001215916934 1051454417 /nfs/dbraw/zinc/45/44/17/1051454417.db2.gz SMJRFLWHBOATRH-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO CSc1c(F)cc(Nc2ccc(N3CCCC3)[nH+]c2)cc1F ZINC001215924377 1051460121 /nfs/dbraw/zinc/46/01/21/1051460121.db2.gz ILVIFIFYNUDOPG-UHFFFAOYSA-N 1 2 321.396 4.426 20 0 DIADLO C[C@H]([NH2+]Cc1scnc1Cl)c1nc2ccccc2s1 ZINC001168981555 1051477368 /nfs/dbraw/zinc/47/73/68/1051477368.db2.gz NQADLLABZXMHGO-QMMMGPOBSA-N 1 2 309.847 4.257 20 0 DIADLO Fc1ncc(Nc2cccn3cc[nH+]c23)cc1-c1ccccc1 ZINC001215958637 1051483753 /nfs/dbraw/zinc/48/37/53/1051483753.db2.gz HSIBWBCUCLHSSM-UHFFFAOYSA-N 1 2 304.328 4.279 20 0 DIADLO Cc1cc(NCCc2cn3ccccc3[nH+]2)ccc1OC(C)C ZINC001169008467 1051487237 /nfs/dbraw/zinc/48/72/37/1051487237.db2.gz GGPDPMUSHRTNNZ-UHFFFAOYSA-N 1 2 309.413 4.085 20 0 DIADLO Fc1cc(NCCc2cn3ccccc3[nH+]2)cc2ccccc12 ZINC001169008867 1051487898 /nfs/dbraw/zinc/48/78/98/1051487898.db2.gz JCEOVYJVLOOKLN-UHFFFAOYSA-N 1 2 305.356 4.281 20 0 DIADLO Cn1c[nH+]c2ccc(NCCOc3cccc4ccccc43)cc21 ZINC001169013175 1051488137 /nfs/dbraw/zinc/48/81/37/1051488137.db2.gz GIUACLCWJSHGJE-UHFFFAOYSA-N 1 2 317.392 4.217 20 0 DIADLO CSc1cc(F)c(Nc2cccn3cc(C)[nH+]c23)cc1F ZINC001215966843 1051490245 /nfs/dbraw/zinc/49/02/45/1051490245.db2.gz ZTZOVHXNYYPKHQ-UHFFFAOYSA-N 1 2 305.353 4.386 20 0 DIADLO COc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)c(C)c1C ZINC001215975133 1051497335 /nfs/dbraw/zinc/49/73/35/1051497335.db2.gz YSRWNYBBUMCYMQ-UHFFFAOYSA-N 1 2 307.397 4.300 20 0 DIADLO CCCCN(C(=O)Nc1cc(C)[nH+]cc1C)[C@H]1CCC[C@H](C)C1 ZINC001216003159 1051518970 /nfs/dbraw/zinc/51/89/70/1051518970.db2.gz CLKXBTXUXSBWRB-YOEHRIQHSA-N 1 2 317.477 4.333 20 0 DIADLO CCCCN(C(=O)Nc1cc(C)[nH+]cc1C)[C@@H]1CCC[C@H](C)C1 ZINC001216003158 1051520051 /nfs/dbraw/zinc/52/00/51/1051520051.db2.gz CLKXBTXUXSBWRB-WMLDXEAASA-N 1 2 317.477 4.333 20 0 DIADLO Cc1ccc2c(Nc3cc(F)c(F)c(F)c3N)cccc2[nH+]1 ZINC001216009567 1051521833 /nfs/dbraw/zinc/52/18/33/1051521833.db2.gz INJZKGSPPMDPOM-UHFFFAOYSA-N 1 2 303.287 4.286 20 0 DIADLO Cc1cc(C)c(C(=O)NCC2(C)CCC(C)(C)CC2)c(C)[nH+]1 ZINC001129771635 1051523178 /nfs/dbraw/zinc/52/31/78/1051523178.db2.gz KJMAFGYAVBJHNC-UHFFFAOYSA-N 1 2 302.462 4.343 20 0 DIADLO CCCc1cc[nH+]c(Nc2cc(OC(F)(F)F)ccc2N)c1 ZINC001216015702 1051524772 /nfs/dbraw/zinc/52/47/72/1051524772.db2.gz ZUYOLYGKSOVQBF-UHFFFAOYSA-N 1 2 311.307 4.259 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001172847474 1051534280 /nfs/dbraw/zinc/53/42/80/1051534280.db2.gz MRFXZBAIWFNYEN-QMTHXVAHSA-N 1 2 323.761 4.479 20 0 DIADLO C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CCCC(F)(F)[C@H](F)C1 ZINC001172847474 1051534287 /nfs/dbraw/zinc/53/42/87/1051534287.db2.gz MRFXZBAIWFNYEN-QMTHXVAHSA-N 1 2 323.761 4.479 20 0 DIADLO Cc1cc(CNC(=O)C[C@H]2C[C@@H](C)c3c2cccc3C)cc(C)[nH+]1 ZINC001129858172 1051542407 /nfs/dbraw/zinc/54/24/07/1051542407.db2.gz IUIBFTONXYTDHK-RDTXWAMCSA-N 1 2 322.452 4.304 20 0 DIADLO Clc1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)c2n[nH]cc21 ZINC001216055934 1051552891 /nfs/dbraw/zinc/55/28/91/1051552891.db2.gz SZZSHAZUIDJBDX-UHFFFAOYSA-N 1 2 318.167 4.261 20 0 DIADLO Cc1ccc(CCCNc2cc(C)c(C(F)(F)F)c[nH+]2)cn1 ZINC001169253980 1051564649 /nfs/dbraw/zinc/56/46/49/1051564649.db2.gz CUTVCEDEDKDPDO-UHFFFAOYSA-N 1 2 309.335 4.157 20 0 DIADLO Cc1nc2c(o1)CC[N@@H+]([C@H](C)CSc1ccc(Cl)cc1)C2 ZINC001172884372 1051565764 /nfs/dbraw/zinc/56/57/64/1051565764.db2.gz CAGURSWMCDIRKP-LLVKDONJSA-N 1 2 322.861 4.175 20 0 DIADLO Cc1nc2c(o1)CC[N@H+]([C@H](C)CSc1ccc(Cl)cc1)C2 ZINC001172884372 1051565776 /nfs/dbraw/zinc/56/57/76/1051565776.db2.gz CAGURSWMCDIRKP-LLVKDONJSA-N 1 2 322.861 4.175 20 0 DIADLO COc1cccc2[nH+]c(N[C@H](C3CCC3)C(F)(F)F)ccc21 ZINC001169283063 1051569275 /nfs/dbraw/zinc/56/92/75/1051569275.db2.gz YTJFEGYJAFOXFM-OAHLLOKOSA-N 1 2 310.319 4.386 20 0 DIADLO Cc1cc(Nc2[nH+]cccc2N2CCCCC2)cc(Cl)c1O ZINC001216087413 1051572451 /nfs/dbraw/zinc/57/24/51/1051572451.db2.gz ORPBSDZKSWBSMI-UHFFFAOYSA-N 1 2 317.820 4.483 20 0 DIADLO COc1cccc([C@H]2C[N@H+](Cc3cc4ccccc4o3)CCO2)c1 ZINC000178547546 1051576417 /nfs/dbraw/zinc/57/64/17/1051576417.db2.gz HVZCHGMVSZNEIF-HXUWFJFHSA-N 1 2 323.392 4.015 20 0 DIADLO COc1cccc([C@H]2C[N@@H+](Cc3cc4ccccc4o3)CCO2)c1 ZINC000178547546 1051576431 /nfs/dbraw/zinc/57/64/31/1051576431.db2.gz HVZCHGMVSZNEIF-HXUWFJFHSA-N 1 2 323.392 4.015 20 0 DIADLO CC(C)(C)c1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)sn1 ZINC001212695067 1051581977 /nfs/dbraw/zinc/58/19/77/1051581977.db2.gz MCCJPTGFNCGUPG-UHFFFAOYSA-N 1 2 312.442 4.429 20 0 DIADLO c1cn(Cc2ccc(Nc3ccc(C4CCC4)nc3)cc2)c[nH+]1 ZINC001212695233 1051583248 /nfs/dbraw/zinc/58/32/48/1051583248.db2.gz UYORETWWTOJCRQ-UHFFFAOYSA-N 1 2 304.397 4.338 20 0 DIADLO S=c1[nH]ccn1C[N@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000766662631 1051583748 /nfs/dbraw/zinc/58/37/48/1051583748.db2.gz DPXWDIGINUEPOR-CQSZACIVSA-N 1 2 307.850 4.010 20 0 DIADLO S=c1[nH]ccn1C[N@@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000766662631 1051583756 /nfs/dbraw/zinc/58/37/56/1051583756.db2.gz DPXWDIGINUEPOR-CQSZACIVSA-N 1 2 307.850 4.010 20 0 DIADLO CCOc1c(Cl)cccc1CNc1ccc([NH+](C)C)cc1 ZINC000785486747 1051585231 /nfs/dbraw/zinc/58/52/31/1051585231.db2.gz JDYGACBVLOENPZ-UHFFFAOYSA-N 1 2 304.821 4.417 20 0 DIADLO c1cn(Cc2ccc(Nc3ccccc3OCC3CC3)cc2)c[nH+]1 ZINC001212699939 1051587797 /nfs/dbraw/zinc/58/77/97/1051587797.db2.gz LDEBPEMYOJFRTM-UHFFFAOYSA-N 1 2 319.408 4.464 20 0 DIADLO Nc1cc(F)c(Cl)cc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212696983 1051588630 /nfs/dbraw/zinc/58/86/30/1051588630.db2.gz YPZDNYKDIJOJHL-UHFFFAOYSA-N 1 2 316.767 4.050 20 0 DIADLO c1cn(Cc2ccc(Nc3ccccc3-c3cnco3)cc2)c[nH+]1 ZINC001212697561 1051589095 /nfs/dbraw/zinc/58/90/95/1051589095.db2.gz GBKQSHAHPYBIRX-UHFFFAOYSA-N 1 2 316.364 4.330 20 0 DIADLO COC[C@@H]([NH2+]Cc1cc(Cl)ccc1Cl)c1ccc(C)o1 ZINC000179012124 1051598832 /nfs/dbraw/zinc/59/88/32/1051598832.db2.gz ZMIJLEUBNQVGJG-CQSZACIVSA-N 1 2 314.212 4.372 20 0 DIADLO C[C@@H]1C[C@H](Nc2cc[nH+]c(OC3CCOCC3)c2)c2ccccc21 ZINC001169381441 1051599753 /nfs/dbraw/zinc/59/97/53/1051599753.db2.gz SIECRQGWDQLKAB-KUHUBIRLSA-N 1 2 324.424 4.300 20 0 DIADLO Cc1cc(CNC(=O)c2ccc(C3=CCCC3)cc2)cc(C)[nH+]1 ZINC001130044639 1051600842 /nfs/dbraw/zinc/60/08/42/1051600842.db2.gz DZGZHXACWALQJT-UHFFFAOYSA-N 1 2 306.409 4.196 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001130043539 1051601178 /nfs/dbraw/zinc/60/11/78/1051601178.db2.gz SKHWCKFJNCKOGA-GOSISDBHSA-N 1 2 302.462 4.311 20 0 DIADLO Cc1ccc(Nc2[nH+]cccc2CCO)cc1-c1ccccc1 ZINC001216147963 1051603168 /nfs/dbraw/zinc/60/31/68/1051603168.db2.gz MCUXRNJUGHYYHC-UHFFFAOYSA-N 1 2 304.393 4.335 20 0 DIADLO CC[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccc(F)cn1 ZINC000493247940 1051605074 /nfs/dbraw/zinc/60/50/74/1051605074.db2.gz MGFTVUUEXIRJRR-INIZCTEOSA-N 1 2 311.360 4.117 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cc(F)cc(N4CCCCC4)c3)ccc21 ZINC001216180419 1051616198 /nfs/dbraw/zinc/61/61/98/1051616198.db2.gz MKGSJZAWYJXRAC-UHFFFAOYSA-N 1 2 324.403 4.446 20 0 DIADLO COc1cccc2[nH+]c(NC[C@H](C)c3ccc(O)cc3)ccc21 ZINC001169534489 1051637520 /nfs/dbraw/zinc/63/75/20/1051637520.db2.gz HEMVFPSBNCRSQK-ZDUSSCGKSA-N 1 2 308.381 4.165 20 0 DIADLO Fc1ccc(NCCc2coc3ccccc23)cc1-n1cc[nH+]c1 ZINC001169597900 1051651324 /nfs/dbraw/zinc/65/13/24/1051651324.db2.gz IVPMDDYQVNJGRJ-UHFFFAOYSA-N 1 2 321.355 4.412 20 0 DIADLO CCCc1csc(C[NH2+]Cc2ccc(Cl)cc2OC)n1 ZINC000494020021 1051679920 /nfs/dbraw/zinc/67/99/20/1051679920.db2.gz WVLBZIYAGXFXHT-UHFFFAOYSA-N 1 2 310.850 4.047 20 0 DIADLO CCCc1csc(C[NH2+]Cc2ccccc2OC2CCC2)n1 ZINC000494019820 1051680979 /nfs/dbraw/zinc/68/09/79/1051680979.db2.gz WEAYVHOCYJAJHR-UHFFFAOYSA-N 1 2 316.470 4.317 20 0 DIADLO c1ccn(-c2ccc(N[C@@H]3CCO[C@@H](c4ccccc4)C3)[nH+]c2)c1 ZINC001169755491 1051691842 /nfs/dbraw/zinc/69/18/42/1051691842.db2.gz NLNMVNCZHNDEKK-IEBWSBKVSA-N 1 2 319.408 4.205 20 0 DIADLO CCCc1csc(C[NH2+]C(C)(C)c2nc(C)c(C)s2)n1 ZINC000494144834 1051692816 /nfs/dbraw/zinc/69/28/16/1051692816.db2.gz JXMUMRLYDYOYIV-UHFFFAOYSA-N 1 2 309.504 4.194 20 0 DIADLO CN(C)c1cccc(C[N@H+](C)Cc2nc(Cl)ccc2Cl)c1 ZINC000766826835 1051697677 /nfs/dbraw/zinc/69/76/77/1051697677.db2.gz FSEICFNKROSHKE-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1cccc(C[N@@H+](C)Cc2nc(Cl)ccc2Cl)c1 ZINC000766826835 1051697685 /nfs/dbraw/zinc/69/76/85/1051697685.db2.gz FSEICFNKROSHKE-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO Cc1nc2ccc(CNc3cccc(-n4cc[nH+]c4)c3)cc2s1 ZINC000494199198 1051703190 /nfs/dbraw/zinc/70/31/90/1051703190.db2.gz TXEBWXGFOWMHSV-UHFFFAOYSA-N 1 2 320.421 4.403 20 0 DIADLO c1ccc([C@@H]2C[C@H]2Nc2cccc(Cc3ccncc3)[nH+]2)cc1 ZINC001169812433 1051704817 /nfs/dbraw/zinc/70/48/17/1051704817.db2.gz OJRLGNSTGLXLQZ-RBUKOAKNSA-N 1 2 301.393 4.035 20 0 DIADLO Cc1cn2c(cccc2Nc2c(Cl)cc(CO)cc2Cl)[nH+]1 ZINC001216360936 1051720162 /nfs/dbraw/zinc/72/01/62/1051720162.db2.gz BQYKXCKFKHEMIP-UHFFFAOYSA-N 1 2 322.195 4.185 20 0 DIADLO Cn1c[nH+]c2cc(Nc3c(Cl)cc(CO)cc3Cl)ccc21 ZINC001216363737 1051722635 /nfs/dbraw/zinc/72/26/35/1051722635.db2.gz JBLDDOYWYFLJKJ-UHFFFAOYSA-N 1 2 322.195 4.116 20 0 DIADLO CCOc1cc(C)cc(F)c1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001216369246 1051726968 /nfs/dbraw/zinc/72/69/68/1051726968.db2.gz YRDZIPBONHJJIK-UHFFFAOYSA-N 1 2 311.360 4.462 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(Cl)ccc1Cl)c1c(C)noc1C ZINC000766892500 1051738638 /nfs/dbraw/zinc/73/86/38/1051738638.db2.gz IGNHBNMQVCBORN-LLVKDONJSA-N 1 2 314.216 4.234 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H]2CCc3nc(Cl)ccc32)cs1 ZINC000806139019 1051739867 /nfs/dbraw/zinc/73/98/67/1051739867.db2.gz HDGOCQDBMXTDAV-KOLCDFICSA-N 1 2 307.850 4.092 20 0 DIADLO C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1Cc2cncnc2C1 ZINC001173548288 1051748161 /nfs/dbraw/zinc/74/81/61/1051748161.db2.gz ZYRFBSIDSQAZOI-LLVKDONJSA-N 1 2 322.239 4.120 20 0 DIADLO C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1Cc2cncnc2C1 ZINC001173548288 1051748172 /nfs/dbraw/zinc/74/81/72/1051748172.db2.gz ZYRFBSIDSQAZOI-LLVKDONJSA-N 1 2 322.239 4.120 20 0 DIADLO CCN(CC)c1ccc(N[C@@H]2CCc3nc(Cl)ccc32)c[nH+]1 ZINC000806154141 1051756696 /nfs/dbraw/zinc/75/66/96/1051756696.db2.gz BJMXKGQHNMNVHU-CQSZACIVSA-N 1 2 316.836 4.076 20 0 DIADLO C[N@@H+]1CCCc2cc(N[C@@H]3CCc4nc(Cl)ccc43)ccc21 ZINC000806157120 1051759532 /nfs/dbraw/zinc/75/95/32/1051759532.db2.gz OQZUVDDAPOZHFL-OAHLLOKOSA-N 1 2 313.832 4.217 20 0 DIADLO C[N@H+]1CCCc2cc(N[C@@H]3CCc4nc(Cl)ccc43)ccc21 ZINC000806157120 1051759543 /nfs/dbraw/zinc/75/95/43/1051759543.db2.gz OQZUVDDAPOZHFL-OAHLLOKOSA-N 1 2 313.832 4.217 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+][C@@H]3CC[C@@H]3C(C)(C)C)cc2)CCO1 ZINC000806156820 1051759769 /nfs/dbraw/zinc/75/97/69/1051759769.db2.gz KNRCEAPPVLAXEZ-FHLIZLRMSA-N 1 2 302.462 4.148 20 0 DIADLO O=C(C=C1CCCC1)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000767093187 1051760171 /nfs/dbraw/zinc/76/01/71/1051760171.db2.gz UFIQJCBNESHNDZ-UHFFFAOYSA-N 1 2 321.424 4.325 20 0 DIADLO C/C(=C\C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)C1CC1 ZINC000767091968 1051760272 /nfs/dbraw/zinc/76/02/72/1051760272.db2.gz MTJKYJUHIHFUSU-SDNWHVSQSA-N 1 2 321.424 4.181 20 0 DIADLO Cc1cc[nH+]c(Nc2ccc(C(=O)N(C)c3ccccc3)cc2)c1 ZINC001216466997 1051778858 /nfs/dbraw/zinc/77/88/58/1051778858.db2.gz FEAIRAFNTDVHNJ-UHFFFAOYSA-N 1 2 317.392 4.410 20 0 DIADLO CC[C@@H](C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccc(F)cc1 ZINC000185745813 1051784466 /nfs/dbraw/zinc/78/44/66/1051784466.db2.gz OSTOADYFBBKTCO-GOSISDBHSA-N 1 2 323.371 4.144 20 0 DIADLO CC(=O)c1cccc(Nc2cc(Cl)c3[nH+]ccn3c2)c1F ZINC001216498808 1051793571 /nfs/dbraw/zinc/79/35/71/1051793571.db2.gz OETZPIFBQWFWIW-UHFFFAOYSA-N 1 2 303.724 4.073 20 0 DIADLO CC(=O)c1cccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1F ZINC001216499750 1051794172 /nfs/dbraw/zinc/79/41/72/1051794172.db2.gz ASEDGGCFVALPIC-UHFFFAOYSA-N 1 2 309.344 4.017 20 0 DIADLO CC(=O)c1cccc(Nc2cccc(Cn3cc[nH+]c3)c2)c1F ZINC001216500586 1051795568 /nfs/dbraw/zinc/79/55/68/1051795568.db2.gz DRUOKZBSLMADNE-UHFFFAOYSA-N 1 2 309.344 4.017 20 0 DIADLO Fc1c(Nc2cccc3[nH+]ccn32)cccc1OC(F)(F)F ZINC001216521185 1051800985 /nfs/dbraw/zinc/80/09/85/1051800985.db2.gz BGJUYCGHVJSCRY-UHFFFAOYSA-N 1 2 311.238 4.116 20 0 DIADLO COc1ccc(CNc2cc[nH+]c3c(Cl)cccc23)cc1O ZINC000804354570 1051811265 /nfs/dbraw/zinc/81/12/65/1051811265.db2.gz NNGHLIQMRULMQH-UHFFFAOYSA-N 1 2 314.772 4.215 20 0 DIADLO COc1c(F)cc(SC)cc1Nc1cccc2[nH+]c(C)cn21 ZINC001216580230 1051822565 /nfs/dbraw/zinc/82/25/65/1051822565.db2.gz NDQXFZJIXGIIKF-UHFFFAOYSA-N 1 2 317.389 4.256 20 0 DIADLO Fc1cccc(F)c1Nc1cc(Br)c2[nH+]ccn2c1 ZINC001173859733 1051832400 /nfs/dbraw/zinc/83/24/00/1051832400.db2.gz YZSTYQGGTILRCY-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO Cc1cc(C)cc(Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)[nH+]c2)c1 ZINC001173827464 1051847242 /nfs/dbraw/zinc/84/72/42/1051847242.db2.gz YKPKIDFVCQBWOV-IYBDPMFKSA-N 1 2 311.429 4.056 20 0 DIADLO CCCCC[C@H]1CCC[N@@H+]1Cn1nc(OCC)sc1=S ZINC000767766072 1051847470 /nfs/dbraw/zinc/84/74/70/1051847470.db2.gz VRQCWROLWXKHGD-LBPRGKRZSA-N 1 2 315.508 4.075 20 0 DIADLO CCCCC[C@H]1CCC[N@H+]1Cn1nc(OCC)sc1=S ZINC000767766072 1051847474 /nfs/dbraw/zinc/84/74/74/1051847474.db2.gz VRQCWROLWXKHGD-LBPRGKRZSA-N 1 2 315.508 4.075 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1F)c1ccc(C)o1 ZINC000187487241 1051847843 /nfs/dbraw/zinc/84/78/43/1051847843.db2.gz QTHSYYWDHKFRTG-FZMZJTMJSA-N 1 2 311.784 4.419 20 0 DIADLO CN(c1ccc(OCc2ccccc2F)cc1)c1[nH+]cccc1N ZINC001216654951 1051854115 /nfs/dbraw/zinc/85/41/15/1051854115.db2.gz MIRUNBOYKJCDPI-UHFFFAOYSA-N 1 2 323.371 4.150 20 0 DIADLO C/C(=C/c1ccccc1)C[N@@H+](C)[C@H](C)c1nc(C(C)(C)C)no1 ZINC000494232949 1051858112 /nfs/dbraw/zinc/85/81/12/1051858112.db2.gz FALHBXNPOFRAMZ-IKESIWSLSA-N 1 2 313.445 4.463 20 0 DIADLO C/C(=C/c1ccccc1)C[N@H+](C)[C@H](C)c1nc(C(C)(C)C)no1 ZINC000494232949 1051858118 /nfs/dbraw/zinc/85/81/18/1051858118.db2.gz FALHBXNPOFRAMZ-IKESIWSLSA-N 1 2 313.445 4.463 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@H]2c2ccccc2C(F)(F)F)nn1C ZINC000767893434 1051860139 /nfs/dbraw/zinc/86/01/39/1051860139.db2.gz NRWMZFSRVATQRX-INIZCTEOSA-N 1 2 323.362 4.084 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@H]2c2ccccc2C(F)(F)F)nn1C ZINC000767893434 1051860146 /nfs/dbraw/zinc/86/01/46/1051860146.db2.gz NRWMZFSRVATQRX-INIZCTEOSA-N 1 2 323.362 4.084 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@@H](C)c1ccccc1F)c1ccco1 ZINC000152562518 1051880663 /nfs/dbraw/zinc/88/06/63/1051880663.db2.gz YYXIQDCFHMEWCE-WMLDXEAASA-N 1 2 305.393 4.483 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2ccc(Cl)cc2F)cc1F ZINC000189191519 1051888317 /nfs/dbraw/zinc/88/83/17/1051888317.db2.gz YOSRYNOXZVPLLV-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO CCCCn1nc(C)c(C[N@H+](C)Cc2cccs2)c1Cl ZINC000768160054 1051890170 /nfs/dbraw/zinc/89/01/70/1051890170.db2.gz LWXGHZURDCCOTI-UHFFFAOYSA-N 1 2 311.882 4.339 20 0 DIADLO CCCCn1nc(C)c(C[N@@H+](C)Cc2cccs2)c1Cl ZINC000768160054 1051890181 /nfs/dbraw/zinc/89/01/81/1051890181.db2.gz LWXGHZURDCCOTI-UHFFFAOYSA-N 1 2 311.882 4.339 20 0 DIADLO CCC[N@H+](Cc1c(Cl)nc(Cl)n1C)Cc1ccccc1 ZINC000768160022 1051890430 /nfs/dbraw/zinc/89/04/30/1051890430.db2.gz KYGYPYKYWPEADK-UHFFFAOYSA-N 1 2 312.244 4.139 20 0 DIADLO CCC[N@@H+](Cc1c(Cl)nc(Cl)n1C)Cc1ccccc1 ZINC000768160022 1051890438 /nfs/dbraw/zinc/89/04/38/1051890438.db2.gz KYGYPYKYWPEADK-UHFFFAOYSA-N 1 2 312.244 4.139 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1occc1Br ZINC000768215480 1051904851 /nfs/dbraw/zinc/90/48/51/1051904851.db2.gz IFQQYAWHSPITSL-SNVBAGLBSA-N 1 2 312.182 4.374 20 0 DIADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1occc1Br ZINC000768215480 1051904855 /nfs/dbraw/zinc/90/48/55/1051904855.db2.gz IFQQYAWHSPITSL-SNVBAGLBSA-N 1 2 312.182 4.374 20 0 DIADLO C[N@H+](Cn1nc(-c2ccccc2Cl)oc1=S)C1CCCC1 ZINC000798192245 1051908089 /nfs/dbraw/zinc/90/80/89/1051908089.db2.gz QOOAUXLOOIKENW-UHFFFAOYSA-N 1 2 323.849 4.358 20 0 DIADLO C[N@@H+](Cn1nc(-c2ccccc2Cl)oc1=S)C1CCCC1 ZINC000798192245 1051908101 /nfs/dbraw/zinc/90/81/01/1051908101.db2.gz QOOAUXLOOIKENW-UHFFFAOYSA-N 1 2 323.849 4.358 20 0 DIADLO Cc1nn(-c2cccc(Cl)c2)c(Cl)c1C[N@@H+](C)C1CC1 ZINC000768334179 1051919744 /nfs/dbraw/zinc/91/97/44/1051919744.db2.gz APKWFRZSSLMKBF-UHFFFAOYSA-N 1 2 310.228 4.082 20 0 DIADLO Cc1nn(-c2cccc(Cl)c2)c(Cl)c1C[N@H+](C)C1CC1 ZINC000768334179 1051919756 /nfs/dbraw/zinc/91/97/56/1051919756.db2.gz APKWFRZSSLMKBF-UHFFFAOYSA-N 1 2 310.228 4.082 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)c(C)o1 ZINC000768374755 1051924190 /nfs/dbraw/zinc/92/41/90/1051924190.db2.gz KJXGCGFFQOYZTL-QGZVFWFLSA-N 1 2 305.805 4.123 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)c(C)o1 ZINC000768374755 1051924202 /nfs/dbraw/zinc/92/42/02/1051924202.db2.gz KJXGCGFFQOYZTL-QGZVFWFLSA-N 1 2 305.805 4.123 20 0 DIADLO COc1cccc2cc(C[N@@H+]3CCC[C@H]3c3cc(C)on3)oc21 ZINC000768431160 1051931981 /nfs/dbraw/zinc/93/19/81/1051931981.db2.gz WSODQCUXYRZAGV-INIZCTEOSA-N 1 2 312.369 4.075 20 0 DIADLO COc1cccc2cc(C[N@H+]3CCC[C@H]3c3cc(C)on3)oc21 ZINC000768431160 1051931987 /nfs/dbraw/zinc/93/19/87/1051931987.db2.gz WSODQCUXYRZAGV-INIZCTEOSA-N 1 2 312.369 4.075 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1ccc(C(=O)N(CC)CC)cc1 ZINC001174061726 1051945136 /nfs/dbraw/zinc/94/51/36/1051945136.db2.gz FYUWJOVBUCANTD-UHFFFAOYSA-N 1 2 311.429 4.178 20 0 DIADLO OCc1cccc(Nc2cc[nH+]c3ccc(Cl)cc23)c1Cl ZINC001212760806 1051949674 /nfs/dbraw/zinc/94/96/74/1051949674.db2.gz PEVQAJDNMUWJSH-UHFFFAOYSA-N 1 2 319.191 4.199 20 0 DIADLO FC(F)C1CC(Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C1 ZINC000768668594 1051952301 /nfs/dbraw/zinc/95/23/01/1051952301.db2.gz HREDZVDEBAPYDQ-UHFFFAOYSA-N 1 2 317.383 4.342 20 0 DIADLO COc1ccc2cc(Nc3ccc4c(c3)[nH+]cn4C)ccc2c1 ZINC001174033027 1051959568 /nfs/dbraw/zinc/95/95/68/1051959568.db2.gz YMDRUXDOXQKREX-UHFFFAOYSA-N 1 2 303.365 4.479 20 0 DIADLO COc1ncccc1Nc1cc[nH+]c2cc(C(F)(F)F)ccc12 ZINC001174040581 1051961976 /nfs/dbraw/zinc/96/19/76/1051961976.db2.gz QGKMAHKOVVTYIB-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO Cc1ccc(Nc2ccccc2C[NH+]2CCOCC2)c(Cl)c1 ZINC001174045767 1051966334 /nfs/dbraw/zinc/96/63/34/1051966334.db2.gz MCGXZGDSTXGNOW-UHFFFAOYSA-N 1 2 316.832 4.224 20 0 DIADLO c1ccc2c(c1)cncc2Nc1ccc[nH+]c1N1CCCCC1 ZINC001174098955 1051974436 /nfs/dbraw/zinc/97/44/36/1051974436.db2.gz ZZGGTCMLFOLHKX-UHFFFAOYSA-N 1 2 304.397 4.364 20 0 DIADLO CC1(C)CC(=O)N(C[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)C1 ZINC000808182862 1051982487 /nfs/dbraw/zinc/98/24/87/1051982487.db2.gz NPFUBQFFRSRXKN-MRXNPFEDSA-N 1 2 320.864 4.083 20 0 DIADLO CC1(C)CC(=O)N(C[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)C1 ZINC000808182862 1051982498 /nfs/dbraw/zinc/98/24/98/1051982498.db2.gz NPFUBQFFRSRXKN-MRXNPFEDSA-N 1 2 320.864 4.083 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1ccc(C(=O)N2CCCC2)cc1 ZINC001174068127 1051991672 /nfs/dbraw/zinc/99/16/72/1051991672.db2.gz HZKLHNCYJNUCFB-UHFFFAOYSA-N 1 2 323.440 4.493 20 0 DIADLO CCCc1cc[nH+]c(Nc2ccc(C(=O)NCC(C)C)cc2)c1 ZINC001174077683 1051994623 /nfs/dbraw/zinc/99/46/23/1051994623.db2.gz OUIWZFJEEIQYHX-UHFFFAOYSA-N 1 2 311.429 4.164 20 0 DIADLO Cc1cc(OCc2nnc(-c3ccccc3)o2)c2ccccc2[nH+]1 ZINC000192193601 1052005534 /nfs/dbraw/zinc/00/55/34/1052005534.db2.gz AYOPLBOMJQRQHM-UHFFFAOYSA-N 1 2 317.348 4.172 20 0 DIADLO Cc1cc(OCc2nc(C3CCCC3)no2)c2ccccc2[nH+]1 ZINC000192192769 1052006046 /nfs/dbraw/zinc/00/60/46/1052006046.db2.gz PORTVBSXKXTMSJ-UHFFFAOYSA-N 1 2 309.369 4.163 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1cccc(OC(F)F)c1 ZINC000225314022 1052010686 /nfs/dbraw/zinc/01/06/86/1052010686.db2.gz XRVSCWZKDLODQH-MRVPVSSYSA-N 1 2 318.776 4.249 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1OC(F)F ZINC000225306318 1052010714 /nfs/dbraw/zinc/01/07/14/1052010714.db2.gz BAYXHIKQCFALKU-QMMMGPOBSA-N 1 2 318.776 4.249 20 0 DIADLO c1nc([C@H]2CCC[N@H+]2Cc2ccccc2-c2ccccc2)no1 ZINC000769233582 1052011378 /nfs/dbraw/zinc/01/13/78/1052011378.db2.gz SGNAPOCXSPHPTO-GOSISDBHSA-N 1 2 305.381 4.074 20 0 DIADLO c1nc([C@H]2CCC[N@@H+]2Cc2ccccc2-c2ccccc2)no1 ZINC000769233582 1052011385 /nfs/dbraw/zinc/01/13/85/1052011385.db2.gz SGNAPOCXSPHPTO-GOSISDBHSA-N 1 2 305.381 4.074 20 0 DIADLO c1cn(Cc2ccc(Nc3cccc4cnccc43)cc2)c[nH+]1 ZINC001174136851 1052013296 /nfs/dbraw/zinc/01/32/96/1052013296.db2.gz BGXABVIZFZXQFA-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO Cc1cc(C)c(NC(=O)CSc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000192679598 1052016659 /nfs/dbraw/zinc/01/66/59/1052016659.db2.gz BNUSDTNFQTTZKF-UHFFFAOYSA-N 1 2 320.845 4.391 20 0 DIADLO Cc1cc(O)c[nH+]c1Nc1ccc(C(=O)Nc2ccccc2)cc1 ZINC001174159406 1052024138 /nfs/dbraw/zinc/02/41/38/1052024138.db2.gz JKMZQHKXJSNATL-UHFFFAOYSA-N 1 2 319.364 4.092 20 0 DIADLO Cc1cc(C)c(Nc2ccc(C(=O)N3CCC(C)CC3)cc2)c[nH+]1 ZINC001174157656 1052024358 /nfs/dbraw/zinc/02/43/58/1052024358.db2.gz JRNQTQGWFUXPFP-UHFFFAOYSA-N 1 2 323.440 4.314 20 0 DIADLO COc1cc(Cl)c(NCc2c[nH+]c3c(C)cccn23)cc1C ZINC000808448752 1052024705 /nfs/dbraw/zinc/02/47/05/1052024705.db2.gz IMCKLJBYKVNOAN-UHFFFAOYSA-N 1 2 315.804 4.225 20 0 DIADLO COc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)cc1Cl ZINC001174155761 1052024750 /nfs/dbraw/zinc/02/47/50/1052024750.db2.gz ZNEMUBOFAHQQCF-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1nc2ccccc2[nH]1 ZINC000769332420 1052026885 /nfs/dbraw/zinc/02/68/85/1052026885.db2.gz DEIBEVIRRBTICV-SFHVURJKSA-N 1 2 321.424 4.299 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1nc2ccccc2[nH]1 ZINC000769332420 1052026894 /nfs/dbraw/zinc/02/68/94/1052026894.db2.gz DEIBEVIRRBTICV-SFHVURJKSA-N 1 2 321.424 4.299 20 0 DIADLO C[C@@H]1CC[C@@](C)(/C=C\C(=O)Nc2ccc3[nH+]ccn3c2)C1(C)C ZINC001131309659 1052028299 /nfs/dbraw/zinc/02/82/99/1052028299.db2.gz UFCPPEATNKTKIB-OYKHKUDJSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1ccc(-c2cc(C[N@@H+]3CCn4cccc4[C@H]3C)on2)cc1 ZINC000193068447 1052028712 /nfs/dbraw/zinc/02/87/12/1052028712.db2.gz APVJMVLMVJMTAL-OAHLLOKOSA-N 1 2 307.397 4.028 20 0 DIADLO Cc1ccc(-c2cc(C[N@H+]3CCn4cccc4[C@H]3C)on2)cc1 ZINC000193068447 1052028725 /nfs/dbraw/zinc/02/87/25/1052028725.db2.gz APVJMVLMVJMTAL-OAHLLOKOSA-N 1 2 307.397 4.028 20 0 DIADLO CC1CCC(OC2CC[NH+](Cc3coc(C4CC4)n3)CC2)CC1 ZINC000769384598 1052036782 /nfs/dbraw/zinc/03/67/82/1052036782.db2.gz ROBWYBLUMFLTIU-UHFFFAOYSA-N 1 2 318.461 4.112 20 0 DIADLO CCCCNC(=O)c1cccc(Nc2c(C)cc[nH+]c2CC)c1 ZINC001174190165 1052039536 /nfs/dbraw/zinc/03/95/36/1052039536.db2.gz WJPUWLPGARVITB-UHFFFAOYSA-N 1 2 311.429 4.226 20 0 DIADLO Cc1ncc2c(n1)CCC[C@H]2[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000769412808 1052042046 /nfs/dbraw/zinc/04/20/46/1052042046.db2.gz HFNQTGWLFYBIPG-BXUZGUMPSA-N 1 2 316.474 4.093 20 0 DIADLO CCn1ncnc1C[N@@H+]1CCCC[C@@H]1c1ccc(C(C)C)cc1 ZINC000193458432 1052044222 /nfs/dbraw/zinc/04/42/22/1052044222.db2.gz ONPLBMZQVRVMBS-GOSISDBHSA-N 1 2 312.461 4.149 20 0 DIADLO CCn1ncnc1C[N@H+]1CCCC[C@@H]1c1ccc(C(C)C)cc1 ZINC000193458432 1052044240 /nfs/dbraw/zinc/04/42/40/1052044240.db2.gz ONPLBMZQVRVMBS-GOSISDBHSA-N 1 2 312.461 4.149 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[N@@H+]1CCC(=O)[C@@H](C)C1 ZINC000670088177 1052044291 /nfs/dbraw/zinc/04/42/91/1052044291.db2.gz PUQQCAUHNFGMLF-HNNXBMFYSA-N 1 2 311.425 4.038 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[N@H+]1CCC(=O)[C@@H](C)C1 ZINC000670088177 1052044305 /nfs/dbraw/zinc/04/43/05/1052044305.db2.gz PUQQCAUHNFGMLF-HNNXBMFYSA-N 1 2 311.425 4.038 20 0 DIADLO C[C@H](CCC1CC1)[NH2+]c1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000769417071 1052045994 /nfs/dbraw/zinc/04/59/94/1052045994.db2.gz PKGOEUHMVWDELM-BZUAXINKSA-N 1 2 302.462 4.291 20 0 DIADLO Cc1ccc(Nc2cccc(C(=O)N3CCC(C)CC3)c2)c(C)[nH+]1 ZINC001174202370 1052046746 /nfs/dbraw/zinc/04/67/46/1052046746.db2.gz GLYBSKKVAZXZHQ-UHFFFAOYSA-N 1 2 323.440 4.314 20 0 DIADLO C[N@H+](Cc1nc2c(s1)CCCC2)Cc1cncc2ccccc21 ZINC000769393533 1052050528 /nfs/dbraw/zinc/05/05/28/1052050528.db2.gz DPUQTODMCJCAFZ-UHFFFAOYSA-N 1 2 323.465 4.202 20 0 DIADLO C[N@@H+](Cc1nc2c(s1)CCCC2)Cc1cncc2ccccc21 ZINC000769393533 1052050535 /nfs/dbraw/zinc/05/05/35/1052050535.db2.gz DPUQTODMCJCAFZ-UHFFFAOYSA-N 1 2 323.465 4.202 20 0 DIADLO FC(F)(F)Sc1ccc(C[N@@H+]2CCOCC23CCC3)cc1 ZINC000769452605 1052058092 /nfs/dbraw/zinc/05/80/92/1052058092.db2.gz ZIWJJLGPBKHPCA-UHFFFAOYSA-N 1 2 317.376 4.053 20 0 DIADLO FC(F)(F)Sc1ccc(C[N@H+]2CCOCC23CCC3)cc1 ZINC000769452605 1052058101 /nfs/dbraw/zinc/05/81/01/1052058101.db2.gz ZIWJJLGPBKHPCA-UHFFFAOYSA-N 1 2 317.376 4.053 20 0 DIADLO Cc1cc(O)c[nH+]c1Nc1ccc(C(=O)c2ccccc2)cc1 ZINC001174222767 1052059325 /nfs/dbraw/zinc/05/93/25/1052059325.db2.gz HTVHEJQVXONAJM-UHFFFAOYSA-N 1 2 304.349 4.070 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2coc(C3CC3)n2)[C@@H]1c1ccccc1 ZINC000769463524 1052060478 /nfs/dbraw/zinc/06/04/78/1052060478.db2.gz PPNFLSWFRXIJLP-GUYCJALGSA-N 1 2 314.454 4.231 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2coc(C3CC3)n2)[C@@H]1c1ccccc1 ZINC000769463524 1052060488 /nfs/dbraw/zinc/06/04/88/1052060488.db2.gz PPNFLSWFRXIJLP-GUYCJALGSA-N 1 2 314.454 4.231 20 0 DIADLO Cn1c(Cl)nc(Cl)c1C[NH+]1CCC(C2CCCC2)CC1 ZINC000769503297 1052067739 /nfs/dbraw/zinc/06/77/39/1052067739.db2.gz WXFHPBWBOLRUKY-UHFFFAOYSA-N 1 2 316.276 4.129 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@@H+](Cc2cncc3ccccc32)C1 ZINC000769512662 1052070917 /nfs/dbraw/zinc/07/09/17/1052070917.db2.gz MVWUXVJYOWPAOW-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@H+](Cc2cncc3ccccc32)C1 ZINC000769512662 1052070920 /nfs/dbraw/zinc/07/09/20/1052070920.db2.gz MVWUXVJYOWPAOW-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO CC(C)c1ccc(-c2noc(-c3cccc4[nH+]ccn43)n2)cc1 ZINC001217500816 1052074602 /nfs/dbraw/zinc/07/46/02/1052074602.db2.gz MJRIFKWDVIEXPC-UHFFFAOYSA-N 1 2 304.353 4.175 20 0 DIADLO Cc1cn2cccc(Nc3cccc(N4CCCCC4)c3)c2[nH+]1 ZINC001174301763 1052078405 /nfs/dbraw/zinc/07/84/05/1052078405.db2.gz JGBDBGOTHPZJBY-UHFFFAOYSA-N 1 2 306.413 4.377 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1ccccc1)[C@H](O)c1ccccc1)c1cscn1 ZINC000808722923 1052082434 /nfs/dbraw/zinc/08/24/34/1052082434.db2.gz HLXVHUVKZKIMTC-MDASCCDHSA-N 1 2 324.449 4.269 20 0 DIADLO COc1cc(Nc2ccc(Oc3cc[nH+]c(C)c3)cc2)ccn1 ZINC001174307340 1052090389 /nfs/dbraw/zinc/09/03/89/1052090389.db2.gz HLRAYZLHIXYGRO-UHFFFAOYSA-N 1 2 307.353 4.330 20 0 DIADLO Cn1cnc2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc21 ZINC001174347996 1052112130 /nfs/dbraw/zinc/11/21/30/1052112130.db2.gz WYMDTRWURSRAGH-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO c1c(N=C2CCC[N@@H+](Cc3ccccc3)C2)onc1C1CCC1 ZINC001174392472 1052115756 /nfs/dbraw/zinc/11/57/56/1052115756.db2.gz AOTNVSTVNHVHKW-UHFFFAOYSA-N 1 2 309.413 4.144 20 0 DIADLO c1c(N=C2CCC[N@H+](Cc3ccccc3)C2)onc1C1CCC1 ZINC001174392472 1052115760 /nfs/dbraw/zinc/11/57/60/1052115760.db2.gz AOTNVSTVNHVHKW-UHFFFAOYSA-N 1 2 309.413 4.144 20 0 DIADLO Clc1cnc(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)s1 ZINC000769918682 1052122406 /nfs/dbraw/zinc/12/24/06/1052122406.db2.gz YNAFVOQKNYKVGV-LBPRGKRZSA-N 1 2 320.845 4.333 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2cc(Cl)ccc2Cl)c(C)[nH+]1 ZINC000194674098 1052123476 /nfs/dbraw/zinc/12/34/76/1052123476.db2.gz PZRFCHMUTRVLHA-UHFFFAOYSA-N 1 2 323.223 4.495 20 0 DIADLO CCCOc1cccc2c(N[C@H](C)c3cnn(C)c3C)cc[nH+]c12 ZINC000194702028 1052124448 /nfs/dbraw/zinc/12/44/48/1052124448.db2.gz TXUQYVLXGQKLKG-CYBMUJFWSA-N 1 2 324.428 4.239 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000769873258 1052124458 /nfs/dbraw/zinc/12/44/58/1052124458.db2.gz KQDAJZHQMVLCRO-JTQLQIEISA-N 1 2 307.463 4.150 20 0 DIADLO FC(F)(F)c1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)ccn1 ZINC001174361639 1052127428 /nfs/dbraw/zinc/12/74/28/1052127428.db2.gz NEHPKIWISXTRRX-UHFFFAOYSA-N 1 2 318.302 4.089 20 0 DIADLO c1cn(Cc2ccc(Nc3ccc4ncsc4c3)cc2)c[nH+]1 ZINC001174367367 1052131967 /nfs/dbraw/zinc/13/19/67/1052131967.db2.gz FGLQUTUQFXYIQB-UHFFFAOYSA-N 1 2 306.394 4.285 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc(OC(F)F)nc3)ccc21 ZINC001174381245 1052138768 /nfs/dbraw/zinc/13/87/68/1052138768.db2.gz BYBPXICUTDWMDE-UHFFFAOYSA-N 1 2 318.327 4.357 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(C(C)(C)C)nn3C)ccc21 ZINC001174381881 1052140491 /nfs/dbraw/zinc/14/04/91/1052140491.db2.gz RTVYCVCTARPDGN-UHFFFAOYSA-N 1 2 311.433 4.392 20 0 DIADLO COc1cc(Cl)nc(Nc2ccc3c(c2)[nH+]cn3C(C)C)c1 ZINC001174382235 1052140753 /nfs/dbraw/zinc/14/07/53/1052140753.db2.gz FQEJPXNHHKBELZ-UHFFFAOYSA-N 1 2 316.792 4.418 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cnc(C(F)(F)F)nc3)ccc21 ZINC001174381302 1052140763 /nfs/dbraw/zinc/14/07/63/1052140763.db2.gz FVSFNHWCQTWYSR-UHFFFAOYSA-N 1 2 321.306 4.170 20 0 DIADLO Cc1cc2ncc(C)c(Nc3ccc4c(c3)[nH+]cn4C(C)C)n2n1 ZINC001174381339 1052140983 /nfs/dbraw/zinc/14/09/83/1052140983.db2.gz WWZKSWRTSQQLQH-UHFFFAOYSA-N 1 2 320.400 4.020 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4nc[nH]c(=O)c4c3)ccc21 ZINC001174381590 1052141122 /nfs/dbraw/zinc/14/11/22/1052141122.db2.gz ODGZQAURANCPNE-UHFFFAOYSA-N 1 2 319.368 4.010 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4nn(C)cc43)ccc21 ZINC001174381899 1052141375 /nfs/dbraw/zinc/14/13/75/1052141375.db2.gz WCHOKHXZDXTOIW-UHFFFAOYSA-N 1 2 305.385 4.248 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3c(N)ccc(F)c3F)ccc21 ZINC001174381727 1052141415 /nfs/dbraw/zinc/14/14/15/1052141415.db2.gz QIJPYFHAXWIGCH-UHFFFAOYSA-N 1 2 302.328 4.221 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(F)c(F)cc3N)ccc21 ZINC001174382000 1052141476 /nfs/dbraw/zinc/14/14/76/1052141476.db2.gz ZEDOLRRWHGCRGU-UHFFFAOYSA-N 1 2 302.328 4.221 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3c(Cl)[nH]ccc3=O)ccc21 ZINC001174382239 1052141579 /nfs/dbraw/zinc/14/15/79/1052141579.db2.gz FULZRWXWAXKPRI-UHFFFAOYSA-N 1 2 302.765 4.115 20 0 DIADLO CC(=O)Oc1ccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cc1 ZINC001174383792 1052142349 /nfs/dbraw/zinc/14/23/49/1052142349.db2.gz ULGWZQBZKBTILI-UHFFFAOYSA-N 1 2 309.369 4.286 20 0 DIADLO CC(=O)c1cccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)c1O ZINC001174382720 1052143233 /nfs/dbraw/zinc/14/32/33/1052143233.db2.gz CQQROWCMVKGJEG-UHFFFAOYSA-N 1 2 309.369 4.269 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(c3)CCC(=O)N4)ccc21 ZINC001174384430 1052145065 /nfs/dbraw/zinc/14/50/65/1052145065.db2.gz WMRLJKRIRVGWMS-UHFFFAOYSA-N 1 2 320.396 4.246 20 0 DIADLO c1n[nH]c([C@@H]([NH2+]C[C@H]2CCCc3ccccc32)C2CCCCC2)n1 ZINC000494877848 1052155797 /nfs/dbraw/zinc/15/57/97/1052155797.db2.gz LMESHHWXYIOLMN-MJGOQNOKSA-N 1 2 324.472 4.136 20 0 DIADLO Cc1ccccc1[C@@H](O[C@@H]1C[NH2+]CC(F)(F)C1)c1ccccc1 ZINC001217855176 1052156107 /nfs/dbraw/zinc/15/61/07/1052156107.db2.gz KRLZNRPEUNTHJW-WMZOPIPTSA-N 1 2 317.379 4.098 20 0 DIADLO c1n[nH]c([C@@H]([NH2+]C[C@@H]2CCCc3ccccc32)C2CCCCC2)n1 ZINC000494877846 1052156321 /nfs/dbraw/zinc/15/63/21/1052156321.db2.gz LMESHHWXYIOLMN-HKUYNNGSSA-N 1 2 324.472 4.136 20 0 DIADLO c1n[nH]c([C@H]([NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)C2CCCCC2)n1 ZINC000494885562 1052160740 /nfs/dbraw/zinc/16/07/40/1052160740.db2.gz HYDYNZMDDNAEQJ-DZOHQFGASA-N 1 2 316.493 4.375 20 0 DIADLO COc1ccc(Nc2cc[nH+]c3[nH]ccc32)cc1Br ZINC001174411308 1052164004 /nfs/dbraw/zinc/16/40/04/1052164004.db2.gz UPNISNYTSNQUQO-UHFFFAOYSA-N 1 2 318.174 4.029 20 0 DIADLO Cc1cc(Nc2cc[nH+]c3[nH]ccc32)ccc1Br ZINC001174411581 1052165383 /nfs/dbraw/zinc/16/53/83/1052165383.db2.gz CZEHPHHAIVPXEU-UHFFFAOYSA-N 1 2 302.175 4.329 20 0 DIADLO COC(=O)c1cc(Cl)cc(Nc2cc[nH+]c3[nH]ccc32)c1C ZINC001174415891 1052168365 /nfs/dbraw/zinc/16/83/65/1052168365.db2.gz UQEYVBQQDLYEEI-UHFFFAOYSA-N 1 2 315.760 4.007 20 0 DIADLO CC(C)CCn1cc(Nc2ccc(N3CCCCC3)[nH+]c2)cn1 ZINC001174415828 1052168531 /nfs/dbraw/zinc/16/85/31/1052168531.db2.gz YZZQASDBNVHORJ-UHFFFAOYSA-N 1 2 313.449 4.058 20 0 DIADLO CC(C)Oc1c(F)cc(Nc2cc[nH+]c3[nH]ccc32)cc1F ZINC001174415369 1052168625 /nfs/dbraw/zinc/16/86/25/1052168625.db2.gz KOEXGDUKAYKDSP-UHFFFAOYSA-N 1 2 303.312 4.324 20 0 DIADLO c1cc2c([nH]1)[nH+]ccc2Nc1cccc(Oc2cccnc2)c1 ZINC001174415665 1052168646 /nfs/dbraw/zinc/16/86/46/1052168646.db2.gz PJPMTQDUAUISEM-UHFFFAOYSA-N 1 2 302.337 4.445 20 0 DIADLO CCCC[N@H+](CC)Cn1nc(-c2ccccc2)n(CC)c1=S ZINC000914567187 1052169010 /nfs/dbraw/zinc/16/90/10/1052169010.db2.gz HWJRIGKLLPDJMU-UHFFFAOYSA-N 1 2 318.490 4.180 20 0 DIADLO CCCC[N@@H+](CC)Cn1nc(-c2ccccc2)n(CC)c1=S ZINC000914567187 1052169021 /nfs/dbraw/zinc/16/90/21/1052169021.db2.gz HWJRIGKLLPDJMU-UHFFFAOYSA-N 1 2 318.490 4.180 20 0 DIADLO CCCC[N@H+](CC)Cn1ncn(-c2cccc(Cl)c2)c1=S ZINC000914567437 1052170207 /nfs/dbraw/zinc/17/02/07/1052170207.db2.gz ZISHFRSQZAVPKK-UHFFFAOYSA-N 1 2 324.881 4.136 20 0 DIADLO CCCC[N@@H+](CC)Cn1ncn(-c2cccc(Cl)c2)c1=S ZINC000914567437 1052170216 /nfs/dbraw/zinc/17/02/16/1052170216.db2.gz ZISHFRSQZAVPKK-UHFFFAOYSA-N 1 2 324.881 4.136 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1sccc1Cl ZINC000494935100 1052172117 /nfs/dbraw/zinc/17/21/17/1052172117.db2.gz IPNOPVWAHKLBPK-IUODEOHRSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1sccc1Cl ZINC000494935100 1052172118 /nfs/dbraw/zinc/17/21/18/1052172118.db2.gz IPNOPVWAHKLBPK-IUODEOHRSA-N 1 2 307.846 4.364 20 0 DIADLO FC1(F)C[NH2+]CC[C@H]1Oc1c(Cl)cc(Cl)cc1Cl ZINC001218006592 1052183851 /nfs/dbraw/zinc/18/38/51/1052183851.db2.gz MFSFAAZMFPIRKP-SECBINFHSA-N 1 2 316.562 4.023 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1cc(Cl)cs1 ZINC000494941856 1052181039 /nfs/dbraw/zinc/18/10/39/1052181039.db2.gz YQNFPODYXMGZEZ-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1cc(Cl)cs1 ZINC000494941856 1052181045 /nfs/dbraw/zinc/18/10/45/1052181045.db2.gz YQNFPODYXMGZEZ-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1ccc(C)c([C@@H]2C[N@H+](C/C=C\c3ccncc3)[C@@H](C)CO2)c1 ZINC000494960613 1052183680 /nfs/dbraw/zinc/18/36/80/1052183680.db2.gz YARQDVYVLOPGCG-WLMOVXJDSA-N 1 2 322.452 4.174 20 0 DIADLO Cc1ccc(C)c([C@@H]2C[N@@H+](C/C=C\c3ccncc3)[C@@H](C)CO2)c1 ZINC000494960613 1052183689 /nfs/dbraw/zinc/18/36/89/1052183689.db2.gz YARQDVYVLOPGCG-WLMOVXJDSA-N 1 2 322.452 4.174 20 0 DIADLO FC1(F)C[NH2+]CC[C@H]1Oc1cc(Cl)c(Cl)cc1Cl ZINC001218007885 1052185744 /nfs/dbraw/zinc/18/57/44/1052185744.db2.gz RXONWSHRGRDLHV-SNVBAGLBSA-N 1 2 316.562 4.023 20 0 DIADLO COc1cccc([C@@H](C)[NH2+][C@@H](Cc2ccccc2)c2ncco2)c1 ZINC000653911594 1052190941 /nfs/dbraw/zinc/19/09/41/1052190941.db2.gz HJCYRWJGHLSVEQ-BEFAXECRSA-N 1 2 322.408 4.318 20 0 DIADLO CC(C)[C@@H]1CCC[C@H]([NH2+][C@@H](c2ncn[nH]2)C2CCCCC2)C1 ZINC000495045370 1052201271 /nfs/dbraw/zinc/20/12/71/1052201271.db2.gz LVDXCBMMMKWKCH-IXDOHACOSA-N 1 2 304.482 4.231 20 0 DIADLO CC(C)C1CCC([NH2+][C@H](c2ncn[nH]2)C2CCCCC2)CC1 ZINC000495049649 1052201668 /nfs/dbraw/zinc/20/16/68/1052201668.db2.gz RWFISESEPZKJOR-PREGVCBESA-N 1 2 304.482 4.231 20 0 DIADLO C[C@H]1CCC[C@H](c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)C1 ZINC000761797963 1052201697 /nfs/dbraw/zinc/20/16/97/1052201697.db2.gz XQQQISZLDPMAFD-ZFWWWQNUSA-N 1 2 308.385 4.216 20 0 DIADLO Nc1cc[nH+]c(OC2c3ccccc3C=Cc3ccccc32)c1 ZINC001218293610 1052219362 /nfs/dbraw/zinc/21/93/62/1052219362.db2.gz KIEZMTNTFRTJAF-UHFFFAOYSA-N 1 2 300.361 4.316 20 0 DIADLO Nc1cc[nH+]c(O[C@@H](c2ccccc2)C(Cl)(Cl)Cl)c1 ZINC001218318705 1052223829 /nfs/dbraw/zinc/22/38/29/1052223829.db2.gz BXSPBUDFYTVYCM-LBPRGKRZSA-N 1 2 317.603 4.154 20 0 DIADLO Nc1[nH+]cccc1O[C@@H](c1ccccc1)C(Cl)(Cl)Cl ZINC001218320910 1052225254 /nfs/dbraw/zinc/22/52/54/1052225254.db2.gz ZJCNNNKIDFXDMJ-NSHDSACASA-N 1 2 317.603 4.154 20 0 DIADLO Nc1cc[nH+]c(O[C@H](/C=C/c2ccccc2)c2ccccc2)c1 ZINC001218354776 1052231149 /nfs/dbraw/zinc/23/11/49/1052231149.db2.gz XIBZUTPFCMTBDJ-TZZQJPOUSA-N 1 2 302.377 4.497 20 0 DIADLO Nc1[nH+]cccc1O[C@H]1CCN(c2ccccc2)c2ccccc21 ZINC001218490613 1052249546 /nfs/dbraw/zinc/24/95/46/1052249546.db2.gz MWLDABFNHMRSLD-SFHVURJKSA-N 1 2 317.392 4.326 20 0 DIADLO CCSc1nn(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)c(=S)s1 ZINC000914785169 1052250146 /nfs/dbraw/zinc/25/01/46/1052250146.db2.gz RBZBMMNUHZERJG-WDEREUQCSA-N 1 2 317.549 4.254 20 0 DIADLO CCSc1nn(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)c(=S)s1 ZINC000914785169 1052250154 /nfs/dbraw/zinc/25/01/54/1052250154.db2.gz RBZBMMNUHZERJG-WDEREUQCSA-N 1 2 317.549 4.254 20 0 DIADLO Fc1ccc2c[nH+]c(N[C@H](c3ccccn3)C(F)(F)F)cc2c1 ZINC001168480783 1052259388 /nfs/dbraw/zinc/25/93/88/1052259388.db2.gz ZSYTYMJJXYNMRG-OAHLLOKOSA-N 1 2 321.277 4.484 20 0 DIADLO C[C@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(C(C)(C)C)cc1 ZINC000393362159 1052264968 /nfs/dbraw/zinc/26/49/68/1052264968.db2.gz HAENLJLJIVZUNR-LBPRGKRZSA-N 1 2 305.853 4.222 20 0 DIADLO CC[C@H](NC(=O)Nc1c(C)cc(C)[nH+]c1C)C1CCCCC1 ZINC001219009820 1052267657 /nfs/dbraw/zinc/26/76/57/1052267657.db2.gz PFJRCTDTQPCLKJ-INIZCTEOSA-N 1 2 303.450 4.487 20 0 DIADLO CCON(CC1CCCCC1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001219009767 1052267878 /nfs/dbraw/zinc/26/78/78/1052267878.db2.gz MRAQGJBAMUOUEE-UHFFFAOYSA-N 1 2 319.449 4.373 20 0 DIADLO COc1cc(CNc2ccc([NH+](C)C)cc2)ccc1OC(C)C ZINC000032233025 1052287810 /nfs/dbraw/zinc/28/78/10/1052287810.db2.gz RMOVFQHSZOLLOC-UHFFFAOYSA-N 1 2 314.429 4.161 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc([NH+](C)C)cc2C)cc1F ZINC000315639685 1052346632 /nfs/dbraw/zinc/34/66/32/1052346632.db2.gz YZSNJWUTLFXZOS-ZDUSSCGKSA-N 1 2 302.393 4.382 20 0 DIADLO Cn1c2ccccc2[nH+]c1N[C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000762543018 1052397518 /nfs/dbraw/zinc/39/75/18/1052397518.db2.gz RSCBEPBIOPDXAJ-MRXNPFEDSA-N 1 2 319.408 4.432 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1ccc(F)cc1Cl ZINC000234918896 1052403454 /nfs/dbraw/zinc/40/34/54/1052403454.db2.gz GGKLIKPGHOLJPM-UHFFFAOYSA-N 1 2 314.187 4.431 20 0 DIADLO Cc1[nH+]cc(CNc2cnc3ccccc3c2)n1-c1ccccc1 ZINC000237871680 1052445703 /nfs/dbraw/zinc/44/57/03/1052445703.db2.gz BDKCZGKCJWKOBK-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO CC[C@H](Nc1ccc(N(CC)CC)[nH+]c1)c1ccc(F)cn1 ZINC000317011348 1052476662 /nfs/dbraw/zinc/47/66/62/1052476662.db2.gz ADGMAYZWMRYCDE-HNNXBMFYSA-N 1 2 302.397 4.025 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(C)c(F)c1OC ZINC001222322182 1052481911 /nfs/dbraw/zinc/48/19/11/1052481911.db2.gz KAFVTAQEPLBIGU-UHFFFAOYSA-N 1 2 312.344 4.004 20 0 DIADLO Cc1ccc(-c2ccccc2Cl)c(C[NH+]2CCOCC2)c1 ZINC001222445728 1052501910 /nfs/dbraw/zinc/50/19/10/1052501910.db2.gz VALWXXYGHNEJPK-UHFFFAOYSA-N 1 2 301.817 4.148 20 0 DIADLO COc1ccc2c(c1)[C@@H](Nc1ccc(N3CCCC3)[nH+]c1)CCC2 ZINC000325895748 1052502038 /nfs/dbraw/zinc/50/20/38/1052502038.db2.gz SPOAWXURSRZTNL-IBGZPJMESA-N 1 2 323.440 4.180 20 0 DIADLO Cn1cc(-c2cccc(-c3c[nH+]cn3C)c2)c(-c2ccccc2)n1 ZINC001222544331 1052510322 /nfs/dbraw/zinc/51/03/22/1052510322.db2.gz MOJSRISOYFHMKQ-UHFFFAOYSA-N 1 2 314.392 4.155 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2nc(-c3ccccc3)no2)cc1 ZINC000025360136 1052515520 /nfs/dbraw/zinc/51/55/20/1052515520.db2.gz NHALZUQALPNVRZ-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2nc(-c3ccccc3)no2)cc1 ZINC000025360136 1052515527 /nfs/dbraw/zinc/51/55/27/1052515527.db2.gz NHALZUQALPNVRZ-KRWDZBQOSA-N 1 2 323.371 4.213 20 0 DIADLO Cn1c[nH+]cc1CO[C@@H](/C=C/c1ccccc1)c1ccccc1 ZINC001222600096 1052516522 /nfs/dbraw/zinc/51/65/22/1052516522.db2.gz ISVMNTGVZGHGSN-SJFMBGHLSA-N 1 2 304.393 4.391 20 0 DIADLO Cc1nc([C@H]([NH2+]C[C@H](C)C(C)(C)C)c2ccc(Cl)cc2)no1 ZINC000670268000 1052544196 /nfs/dbraw/zinc/54/41/96/1052544196.db2.gz BBJJYZKNOHFFBC-XHDPSFHLSA-N 1 2 321.852 4.393 20 0 DIADLO Cc1cc(CO[C@@H](C)c2ccc(Br)nc2)cc(C)[nH+]1 ZINC001223421813 1052598808 /nfs/dbraw/zinc/59/88/08/1052598808.db2.gz QZWSQMJBMGPLCH-LBPRGKRZSA-N 1 2 321.218 4.134 20 0 DIADLO Cc1cc(CO[C@H](C)c2ccc(Br)nc2)cc(C)[nH+]1 ZINC001223421810 1052598905 /nfs/dbraw/zinc/59/89/05/1052598905.db2.gz QZWSQMJBMGPLCH-GFCCVEGCSA-N 1 2 321.218 4.134 20 0 DIADLO Cc1cc(CO[C@H]2CC=C[C@@H]2COCc2ccccc2)cc(C)[nH+]1 ZINC001223418808 1052599505 /nfs/dbraw/zinc/59/95/05/1052599505.db2.gz AYELDMURHVXZDI-RTWAWAEBSA-N 1 2 323.436 4.377 20 0 DIADLO Cc1cc(CO[C@@H]2CCCc3c(Cl)ccnc32)cc(C)[nH+]1 ZINC001223424355 1052600145 /nfs/dbraw/zinc/60/01/45/1052600145.db2.gz LCVFSDVOCKWHKD-MRXNPFEDSA-N 1 2 302.805 4.341 20 0 DIADLO CC[C@@H]1CCCC[C@@H]1OC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000916293973 1052601511 /nfs/dbraw/zinc/60/15/11/1052601511.db2.gz QIGTVFJTTKZDOY-AEFFLSMTSA-N 1 2 312.413 4.057 20 0 DIADLO CC(C)(C)c1ncc2c(n1)CC[N@@H+](Cc1ccc3occc3c1)C2 ZINC000529644604 1052607100 /nfs/dbraw/zinc/60/71/00/1052607100.db2.gz ZWZPMMPLEBGWLR-UHFFFAOYSA-N 1 2 321.424 4.079 20 0 DIADLO CC(C)(C)c1ncc2c(n1)CC[N@H+](Cc1ccc3occc3c1)C2 ZINC000529644604 1052607106 /nfs/dbraw/zinc/60/71/06/1052607106.db2.gz ZWZPMMPLEBGWLR-UHFFFAOYSA-N 1 2 321.424 4.079 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2csc(-c3ccccn3)n2)cc1 ZINC000124177726 1052637822 /nfs/dbraw/zinc/63/78/22/1052637822.db2.gz XRWRCEFGIJXNKW-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2csc(-c3ccccn3)n2)cc1 ZINC000124177726 1052637826 /nfs/dbraw/zinc/63/78/26/1052637826.db2.gz XRWRCEFGIJXNKW-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO CCCn1c2cccc(F)c2nc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC000916854493 1052660377 /nfs/dbraw/zinc/66/03/77/1052660377.db2.gz LDQSVYCOJFIQON-UHFFFAOYSA-N 1 2 320.371 4.438 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2ccc(CC)cc2)C(C)C)no1 ZINC000065588129 1052670126 /nfs/dbraw/zinc/67/01/26/1052670126.db2.gz NVQAZCKMAZJKTM-SFHVURJKSA-N 1 2 301.434 4.071 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000127545192 1052698615 /nfs/dbraw/zinc/69/86/15/1052698615.db2.gz DWGGORLWWCYIPN-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000127545192 1052698621 /nfs/dbraw/zinc/69/86/21/1052698621.db2.gz DWGGORLWWCYIPN-ZDUSSCGKSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(F)cc1Br ZINC000127655595 1052701527 /nfs/dbraw/zinc/70/15/27/1052701527.db2.gz BCMPMXCOPLRUMV-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(F)cc1Br ZINC000127655595 1052701533 /nfs/dbraw/zinc/70/15/33/1052701533.db2.gz BCMPMXCOPLRUMV-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1ncc(-c2cccs2)o1 ZINC000067375075 1052703673 /nfs/dbraw/zinc/70/36/73/1052703673.db2.gz MSZMPPVEDDHBKA-AWEZNQCLSA-N 1 2 313.426 4.079 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1ncc(-c2cccs2)o1 ZINC000067375075 1052703676 /nfs/dbraw/zinc/70/36/76/1052703676.db2.gz MSZMPPVEDDHBKA-AWEZNQCLSA-N 1 2 313.426 4.079 20 0 DIADLO CC(C)Oc1cc(F)c(F)cc1Nc1ccn2cc[nH+]c2c1 ZINC001212225509 1052708455 /nfs/dbraw/zinc/70/84/55/1052708455.db2.gz UFNBBBASWLDZIC-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1ccc(Br)cc1F ZINC000128089978 1052708854 /nfs/dbraw/zinc/70/88/54/1052708854.db2.gz GQWKZFUEFUCRHB-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccc(Br)cc1F ZINC000128089978 1052708858 /nfs/dbraw/zinc/70/88/58/1052708858.db2.gz GQWKZFUEFUCRHB-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-c2ccccc2)cc1)n1cc[nH+]c1 ZINC000917360171 1052723572 /nfs/dbraw/zinc/72/35/72/1052723572.db2.gz CKYAYUJOMNSPRX-HNNXBMFYSA-N 1 2 305.381 4.140 20 0 DIADLO Cc1ccc(-c2cc(CO[NH+]=C(N)c3ccccc3C)on2)cc1 ZINC000917392864 1052723878 /nfs/dbraw/zinc/72/38/78/1052723878.db2.gz QVGBKFRQYRYFFN-UHFFFAOYSA-N 1 2 321.380 4.005 20 0 DIADLO Fc1ccc(-c2cn(C[N@@H+]3CCCSCC3)c(=S)o2)cc1 ZINC000917462379 1052728602 /nfs/dbraw/zinc/72/86/02/1052728602.db2.gz PAKBGBUSKVCMGZ-UHFFFAOYSA-N 1 2 324.446 4.013 20 0 DIADLO Fc1ccc(-c2cn(C[N@H+]3CCCSCC3)c(=S)o2)cc1 ZINC000917462379 1052728608 /nfs/dbraw/zinc/72/86/08/1052728608.db2.gz PAKBGBUSKVCMGZ-UHFFFAOYSA-N 1 2 324.446 4.013 20 0 DIADLO Cc1nn(C[N@@H+]2CCC[C@H]2CCc2ccccc2)c(=S)s1 ZINC000917478172 1052729886 /nfs/dbraw/zinc/72/98/86/1052729886.db2.gz KQCMFKLYNXKGKK-HNNXBMFYSA-N 1 2 319.499 4.037 20 0 DIADLO Cc1nn(C[N@H+]2CCC[C@H]2CCc2ccccc2)c(=S)s1 ZINC000917478172 1052729893 /nfs/dbraw/zinc/72/98/93/1052729893.db2.gz KQCMFKLYNXKGKK-HNNXBMFYSA-N 1 2 319.499 4.037 20 0 DIADLO CC[N@H+](CC(C)C)Cn1[nH]c(/C=C/c2ccccc2)nc1=S ZINC000917454741 1052729985 /nfs/dbraw/zinc/72/99/85/1052729985.db2.gz ZRHANMIBRIURGW-ZHACJKMWSA-N 1 2 316.474 4.046 20 0 DIADLO CC[N@@H+](CC(C)C)Cn1[nH]c(/C=C/c2ccccc2)nc1=S ZINC000917454741 1052729987 /nfs/dbraw/zinc/72/99/87/1052729987.db2.gz ZRHANMIBRIURGW-ZHACJKMWSA-N 1 2 316.474 4.046 20 0 DIADLO COc1ccc(C(Oc2cc[nH+]cc2)c2ccc(OC)cc2)cc1 ZINC001225290733 1052769766 /nfs/dbraw/zinc/76/97/66/1052769766.db2.gz HMLZIADZLZHHPD-UHFFFAOYSA-N 1 2 321.376 4.267 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2nnc(C(C)(C)C)o2)c(C)c1 ZINC000918023571 1052773910 /nfs/dbraw/zinc/77/39/10/1052773910.db2.gz DKPZBAZIQNBRJH-AWEZNQCLSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2nnc(C(C)(C)C)o2)c(C)c1 ZINC000918023571 1052773913 /nfs/dbraw/zinc/77/39/13/1052773913.db2.gz DKPZBAZIQNBRJH-AWEZNQCLSA-N 1 2 301.434 4.177 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]CC(C)(F)F)c2cccc(Br)c21 ZINC000556230829 1052825371 /nfs/dbraw/zinc/82/53/71/1052825371.db2.gz ATIPAKFTUKGNNS-KCJUWKMLSA-N 1 2 304.178 4.242 20 0 DIADLO FC(c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1)=C1CCCC1 ZINC000556277028 1052833698 /nfs/dbraw/zinc/83/36/98/1052833698.db2.gz IVTGTJOQXRGHNT-UHFFFAOYSA-N 1 2 324.359 4.236 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cnc(C(C)(C)C)nc1 ZINC000556598708 1052870413 /nfs/dbraw/zinc/87/04/13/1052870413.db2.gz SPTYGTHLIGWVQQ-CYBMUJFWSA-N 1 2 301.409 4.106 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cnc(C(C)(C)C)nc1 ZINC000556598708 1052870420 /nfs/dbraw/zinc/87/04/20/1052870420.db2.gz SPTYGTHLIGWVQQ-CYBMUJFWSA-N 1 2 301.409 4.106 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCC[N@@H+]2Cc2cnccn2)c1 ZINC000556785123 1052883560 /nfs/dbraw/zinc/88/35/60/1052883560.db2.gz IVLJCGNVEIDDGO-MRXNPFEDSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1cccc([C@H]2CCCC[N@H+]2Cc2cnccn2)c1 ZINC000556785123 1052883565 /nfs/dbraw/zinc/88/35/65/1052883565.db2.gz IVLJCGNVEIDDGO-MRXNPFEDSA-N 1 2 321.346 4.223 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(Oc2ccccc2)cn1)c1ccn(C)n1 ZINC000556890037 1052894533 /nfs/dbraw/zinc/89/45/33/1052894533.db2.gz BRUKXUZZBOYWHP-GJZGRUSLSA-N 1 2 322.412 4.019 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+][C@H](C)c1c(F)cncc1F ZINC000556915629 1052899255 /nfs/dbraw/zinc/89/92/55/1052899255.db2.gz NRBGEYSBUYCLRR-NWDGAFQWSA-N 1 2 306.356 4.170 20 0 DIADLO Cc1cccc2ncc(C[N@@H+]3CC[C@@H]3c3ccc(Cl)cc3)n21 ZINC000556927737 1052901352 /nfs/dbraw/zinc/90/13/52/1052901352.db2.gz UVMQDKBYBTYUEK-QGZVFWFLSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1cccc2ncc(C[N@H+]3CC[C@@H]3c3ccc(Cl)cc3)n21 ZINC000556927737 1052901358 /nfs/dbraw/zinc/90/13/58/1052901358.db2.gz UVMQDKBYBTYUEK-QGZVFWFLSA-N 1 2 311.816 4.243 20 0 DIADLO O=C(CC1CCCC1)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000557036280 1052915226 /nfs/dbraw/zinc/91/52/26/1052915226.db2.gz YDIQZANOPSNDMC-UHFFFAOYSA-N 1 2 323.440 4.405 20 0 DIADLO CC[N@H+](Cc1ncc(Cl)n1C)Cc1ccc2ccccc2c1 ZINC000920089949 1052918048 /nfs/dbraw/zinc/91/80/48/1052918048.db2.gz YJZWFFVYFKKNKC-UHFFFAOYSA-N 1 2 313.832 4.249 20 0 DIADLO CC[N@@H+](Cc1ncc(Cl)n1C)Cc1ccc2ccccc2c1 ZINC000920089949 1052918051 /nfs/dbraw/zinc/91/80/51/1052918051.db2.gz YJZWFFVYFKKNKC-UHFFFAOYSA-N 1 2 313.832 4.249 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](Cc1ncc(Cl)n1C)C1CC1 ZINC000920086881 1052918943 /nfs/dbraw/zinc/91/89/43/1052918943.db2.gz PTGYAGLSVBLTAU-NSHDSACASA-N 1 2 324.255 4.453 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](Cc1ncc(Cl)n1C)C1CC1 ZINC000920086881 1052918944 /nfs/dbraw/zinc/91/89/44/1052918944.db2.gz PTGYAGLSVBLTAU-NSHDSACASA-N 1 2 324.255 4.453 20 0 DIADLO CCC/C(C)=C/C(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC000920220406 1052929166 /nfs/dbraw/zinc/92/91/66/1052929166.db2.gz PRROEFBKRMENDL-SSUFTNFISA-N 1 2 321.490 4.060 20 0 DIADLO CCC/C(C)=C/C(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC000920220406 1052929171 /nfs/dbraw/zinc/92/91/71/1052929171.db2.gz PRROEFBKRMENDL-SSUFTNFISA-N 1 2 321.490 4.060 20 0 DIADLO CC[N@@H+](Cc1ccc(Cl)c(Cl)c1)Cn1cc(Cl)cn1 ZINC000921186861 1052964683 /nfs/dbraw/zinc/96/46/83/1052964683.db2.gz RAPBKBRSFFFXCM-UHFFFAOYSA-N 1 2 318.635 4.323 20 0 DIADLO CC[N@H+](Cc1ccc(Cl)c(Cl)c1)Cn1cc(Cl)cn1 ZINC000921186861 1052964686 /nfs/dbraw/zinc/96/46/86/1052964686.db2.gz RAPBKBRSFFFXCM-UHFFFAOYSA-N 1 2 318.635 4.323 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](Cc1cccc(Cl)c1)C1CC1 ZINC000610012928 1053004089 /nfs/dbraw/zinc/00/40/89/1053004089.db2.gz LKGKCTUJUBSWKR-LBPRGKRZSA-N 1 2 309.837 4.035 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](Cc1cccc(Cl)c1)C1CC1 ZINC000610012928 1053004092 /nfs/dbraw/zinc/00/40/92/1053004092.db2.gz LKGKCTUJUBSWKR-LBPRGKRZSA-N 1 2 309.837 4.035 20 0 DIADLO C[C@@H]([NH2+]CC1(c2cccs2)CCCCC1)C(=O)OC(C)(C)C ZINC000610087615 1053006993 /nfs/dbraw/zinc/00/69/93/1053006993.db2.gz GTBIEQPFBCERCO-CQSZACIVSA-N 1 2 323.502 4.270 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1cccc(Cl)c1O ZINC000180022148 1053042559 /nfs/dbraw/zinc/04/25/59/1053042559.db2.gz WHOULPDSPZYMDS-SUMWQHHRSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1cccc(Cl)c1O ZINC000180022148 1053042565 /nfs/dbraw/zinc/04/25/65/1053042565.db2.gz WHOULPDSPZYMDS-SUMWQHHRSA-N 1 2 317.816 4.008 20 0 DIADLO COc1cc2c(cc1O[C@@H](C)CCc1ccccc1)C=[NH+]CC2 ZINC001228086808 1053042749 /nfs/dbraw/zinc/04/27/49/1053042749.db2.gz BPAPNKCTAHIDBW-HNNXBMFYSA-N 1 2 309.409 4.070 20 0 DIADLO COc1cc2c(cc1O[C@H]1CCc3cc(C)ccc31)C=[NH+]CC2 ZINC001228088139 1053042883 /nfs/dbraw/zinc/04/28/83/1053042883.db2.gz SHFALZWUQZAJEU-SFHVURJKSA-N 1 2 307.393 4.045 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+](C2CC2)[C@H]2CCc3ccccc32)o1 ZINC000068812920 1053072497 /nfs/dbraw/zinc/07/24/97/1053072497.db2.gz LJHHLIIKFRGDHX-INIZCTEOSA-N 1 2 311.429 4.019 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+](C2CC2)[C@H]2CCc3ccccc32)o1 ZINC000068812920 1053072507 /nfs/dbraw/zinc/07/25/07/1053072507.db2.gz LJHHLIIKFRGDHX-INIZCTEOSA-N 1 2 311.429 4.019 20 0 DIADLO C[C@H](c1nc(C2CC(C)(C)CC(C)(C)C2)no1)n1cc[nH+]c1 ZINC001350513908 1053072727 /nfs/dbraw/zinc/07/27/27/1053072727.db2.gz FZAFDEOTSUILCP-GFCCVEGCSA-N 1 2 302.422 4.195 20 0 DIADLO Cc1[nH]c2ccc(O[C@H](C(=O)c3ccco3)c3ccco3)cc2[nH+]1 ZINC001228327639 1053073401 /nfs/dbraw/zinc/07/34/01/1053073401.db2.gz SNKUMHSXJBECGL-SFHVURJKSA-N 1 2 322.320 4.060 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCC2)o1 ZINC000068828386 1053073469 /nfs/dbraw/zinc/07/34/69/1053073469.db2.gz WOFVBHZWUMXDRL-MRXNPFEDSA-N 1 2 317.408 4.137 20 0 DIADLO COc1ccc([C@H](C)Oc2ccc3[nH]c(C)[nH+]c3c2)c(F)c1 ZINC001228329559 1053075882 /nfs/dbraw/zinc/07/58/82/1053075882.db2.gz NLDVEUBJYDDBJV-JTQLQIEISA-N 1 2 300.333 4.159 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)Cc2ccccc2Cl)c(C)[nH+]1 ZINC001350574657 1053083305 /nfs/dbraw/zinc/08/33/05/1053083305.db2.gz JBCFLIPQUNPQIN-CYBMUJFWSA-N 1 2 316.832 4.021 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C)Cc2ccccc2Cl)c(C)[nH+]1 ZINC001350574658 1053084312 /nfs/dbraw/zinc/08/43/12/1053084312.db2.gz JBCFLIPQUNPQIN-ZDUSSCGKSA-N 1 2 316.832 4.021 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)C1(C2CCCCC2)CC1 ZINC001350614847 1053089264 /nfs/dbraw/zinc/08/92/64/1053089264.db2.gz AEPRKSCQGQLWQZ-UHFFFAOYSA-N 1 2 309.413 4.171 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2ncc(C(C)C)o2)c1 ZINC001351065810 1053132465 /nfs/dbraw/zinc/13/24/65/1053132465.db2.gz QBNNLMHINOSJCA-MRXNPFEDSA-N 1 2 300.402 4.144 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2ncc(C(C)C)o2)c1 ZINC001351065810 1053132470 /nfs/dbraw/zinc/13/24/70/1053132470.db2.gz QBNNLMHINOSJCA-MRXNPFEDSA-N 1 2 300.402 4.144 20 0 DIADLO C[C@H](C(=O)Nc1cccc(Sc2ccccc2)c1)n1cc[nH+]c1 ZINC001351086996 1053135887 /nfs/dbraw/zinc/13/58/87/1053135887.db2.gz LUVJJKNUCJTXNF-CQSZACIVSA-N 1 2 323.421 4.234 20 0 DIADLO CC[NH+]1CC(Oc2ccc(-c3nc4ccccc4s3)cc2)C1 ZINC001228695201 1053161009 /nfs/dbraw/zinc/16/10/09/1053161009.db2.gz RTXANKQLGGUMGX-UHFFFAOYSA-N 1 2 310.422 4.046 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)co1 ZINC001351389929 1053174336 /nfs/dbraw/zinc/17/43/36/1053174336.db2.gz VEOGKMSIYACCOW-NSHDSACASA-N 1 2 304.356 4.135 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)co1 ZINC001351389929 1053174340 /nfs/dbraw/zinc/17/43/40/1053174340.db2.gz VEOGKMSIYACCOW-NSHDSACASA-N 1 2 304.356 4.135 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+][C@@H]2CCCc3[nH]ncc32)cc1 ZINC000353498635 1053176256 /nfs/dbraw/zinc/17/62/56/1053176256.db2.gz ASBUPHHHFNUHKV-BLLLJJGKSA-N 1 2 301.459 4.250 20 0 DIADLO CC(C)C[C@@H](NC(=O)[C@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC001318682318 1053183253 /nfs/dbraw/zinc/18/32/53/1053183253.db2.gz SHQZKLJUWPBWDS-XJKSGUPXSA-N 1 2 319.836 4.001 20 0 DIADLO COc1ccccc1O[C@H](C)CNc1cc(C)c2ccccc2[nH+]1 ZINC001318779607 1053191072 /nfs/dbraw/zinc/19/10/72/1053191072.db2.gz PHXOQLFTSPEJLK-OAHLLOKOSA-N 1 2 322.408 4.431 20 0 DIADLO COc1ccc2c(c1)OCC[C@@H]2Nc1cc(C)c2ccccc2[nH+]1 ZINC001318849048 1053198071 /nfs/dbraw/zinc/19/80/71/1053198071.db2.gz XMWRVPQNCOGCAK-SFHVURJKSA-N 1 2 320.392 4.488 20 0 DIADLO Cc1ccccc1C[N@@H+]1CCO[C@@H](c2ccc(Cl)s2)C1 ZINC001318970890 1053208087 /nfs/dbraw/zinc/20/80/87/1053208087.db2.gz WWKXLVWNRLYIDC-CQSZACIVSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccccc1C[N@H+]1CCO[C@@H](c2ccc(Cl)s2)C1 ZINC001318970890 1053208099 /nfs/dbraw/zinc/20/80/99/1053208099.db2.gz WWKXLVWNRLYIDC-CQSZACIVSA-N 1 2 307.846 4.283 20 0 DIADLO CCCCC1(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CC1 ZINC001351766437 1053220382 /nfs/dbraw/zinc/22/03/82/1053220382.db2.gz MCKAWIAXQTZBSE-UHFFFAOYSA-N 1 2 317.820 4.435 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001319334821 1053235606 /nfs/dbraw/zinc/23/56/06/1053235606.db2.gz NNBRKWCPNJFMAI-GOEBONIOSA-N 1 2 303.450 4.129 20 0 DIADLO C(c1noc(C2CCCCC2)n1)[N@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001319334821 1053235614 /nfs/dbraw/zinc/23/56/14/1053235614.db2.gz NNBRKWCPNJFMAI-GOEBONIOSA-N 1 2 303.450 4.129 20 0 DIADLO Cc1sc2[nH]c([C@H](C)[N@@H+]3CC(C)(C)C3(C)C)nc(=O)c2c1C ZINC001319368218 1053237491 /nfs/dbraw/zinc/23/74/91/1053237491.db2.gz CMFNHSLNXTXMMH-JTQLQIEISA-N 1 2 319.474 4.195 20 0 DIADLO Cc1sc2[nH]c([C@H](C)[N@H+]3CC(C)(C)C3(C)C)nc(=O)c2c1C ZINC001319368218 1053237503 /nfs/dbraw/zinc/23/75/03/1053237503.db2.gz CMFNHSLNXTXMMH-JTQLQIEISA-N 1 2 319.474 4.195 20 0 DIADLO CCCCCn1cc(C[NH2+]Cc2csc(C(C)C)n2)c(C)n1 ZINC001319772220 1053273202 /nfs/dbraw/zinc/27/32/02/1053273202.db2.gz PNWKQKWKFHDUSN-UHFFFAOYSA-N 1 2 320.506 4.251 20 0 DIADLO Cc1cc(N2CCC[C@@H](C[C@@H]3CCOC3)C2)[nH+]c2ccccc12 ZINC001319782685 1053273315 /nfs/dbraw/zinc/27/33/15/1053273315.db2.gz CXXJOOAQUHWZDG-IRXDYDNUSA-N 1 2 310.441 4.186 20 0 DIADLO Clc1cccc(Cl)c1C1([NH2+][C@@H]2CCCc3n[nH]cc32)CC1 ZINC000353644376 1053281703 /nfs/dbraw/zinc/28/17/03/1053281703.db2.gz DVIDVHNWBFVGAC-CYBMUJFWSA-N 1 2 322.239 4.373 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3ccccc3[C@H]2Cc2ccccc2)n[nH]1 ZINC001319972025 1053290194 /nfs/dbraw/zinc/29/01/94/1053290194.db2.gz DVJAXCRFFKFMNR-OAQYLSRUSA-N 1 2 317.436 4.060 20 0 DIADLO Cc1cc(C[N@H+]2CCc3ccccc3[C@H]2Cc2ccccc2)n[nH]1 ZINC001319972025 1053290201 /nfs/dbraw/zinc/29/02/01/1053290201.db2.gz DVJAXCRFFKFMNR-OAQYLSRUSA-N 1 2 317.436 4.060 20 0 DIADLO Cc1ccc(N[C@@H](C)c2ncc(Br)s2)c(C)[nH+]1 ZINC001319984099 1053290246 /nfs/dbraw/zinc/29/02/46/1053290246.db2.gz OTUPFJMXKNHJCG-VIFPVBQESA-N 1 2 312.236 4.091 20 0 DIADLO Cc1cc(C[N@@H+]2CCc3ccccc3[C@@H]2Cc2ccccc2)n[nH]1 ZINC001319972024 1053291008 /nfs/dbraw/zinc/29/10/08/1053291008.db2.gz DVJAXCRFFKFMNR-NRFANRHFSA-N 1 2 317.436 4.060 20 0 DIADLO Cc1cc(C[N@H+]2CCc3ccccc3[C@@H]2Cc2ccccc2)n[nH]1 ZINC001319972024 1053291020 /nfs/dbraw/zinc/29/10/20/1053291020.db2.gz DVJAXCRFFKFMNR-NRFANRHFSA-N 1 2 317.436 4.060 20 0 DIADLO COCC[C@H](Cc1ccco1)Nc1cc(C)c2ccccc2[nH+]1 ZINC001320029319 1053296464 /nfs/dbraw/zinc/29/64/64/1053296464.db2.gz BGZZSKBUNFCWDA-OAHLLOKOSA-N 1 2 310.397 4.196 20 0 DIADLO CN(C)c1cc(CSc2ncc(-c3ccccc3)o2)cc[nH+]1 ZINC001320219059 1053315515 /nfs/dbraw/zinc/31/55/15/1053315515.db2.gz QVPIUZYTCVUZNW-UHFFFAOYSA-N 1 2 311.410 4.095 20 0 DIADLO Cc1cc(N[C@@H](COCC(C)C)c2ccco2)nc(C(C)C)[nH+]1 ZINC000471055075 1053319855 /nfs/dbraw/zinc/31/98/55/1053319855.db2.gz FPSLAFYJLNHYBB-HNNXBMFYSA-N 1 2 317.433 4.327 20 0 DIADLO Cc1cc(CSCc2cc[nH+]c(N(C)C)c2)c2ccccc2n1 ZINC001320277818 1053322010 /nfs/dbraw/zinc/32/20/10/1053322010.db2.gz GWCUDDJEMQEFEJ-UHFFFAOYSA-N 1 2 323.465 4.438 20 0 DIADLO CC(C)n1cc2c(n1)[C@H]([NH2+]Cc1ccc([C@H]3C[C@H]3C)o1)CCC2 ZINC001320370984 1053329810 /nfs/dbraw/zinc/32/98/10/1053329810.db2.gz FRIZDKZFVKEPDA-XOKHGSTOSA-N 1 2 313.445 4.348 20 0 DIADLO CN(C)c1cc(CS[C@@H]2CCc3c2cccc3F)cc[nH+]1 ZINC001320400520 1053330418 /nfs/dbraw/zinc/33/04/18/1053330418.db2.gz GRACPPFEHAERKN-MRXNPFEDSA-N 1 2 302.418 4.207 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2ncoc2C(C)C)c1 ZINC001320610306 1053347880 /nfs/dbraw/zinc/34/78/80/1053347880.db2.gz VEUYWUFELXEPJJ-AWEZNQCLSA-N 1 2 302.418 4.436 20 0 DIADLO CCc1noc([C@@H](C)[N@H+]2CC=C(c3ccc(CC)cc3)CC2)n1 ZINC000093263637 1053375995 /nfs/dbraw/zinc/37/59/95/1053375995.db2.gz FAHMBHXFYNLWLT-CQSZACIVSA-N 1 2 311.429 4.045 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+]2CC=C(c3ccc(CC)cc3)CC2)n1 ZINC000093263637 1053376007 /nfs/dbraw/zinc/37/60/07/1053376007.db2.gz FAHMBHXFYNLWLT-CQSZACIVSA-N 1 2 311.429 4.045 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2cccc(Cl)c2O)sc1C ZINC000182223558 1053383354 /nfs/dbraw/zinc/38/33/54/1053383354.db2.gz LPWBRAOCMGACSX-UHFFFAOYSA-N 1 2 310.850 4.144 20 0 DIADLO CC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001434922259 1053387545 /nfs/dbraw/zinc/38/75/45/1053387545.db2.gz VUUSWYUBIGDGKX-TZMCWYRMSA-N 1 2 317.820 4.291 20 0 DIADLO CCc1ccc(C(=O)Nc2ccc3[nH+]c(C)cn3c2)cc1CC ZINC001434944230 1053394774 /nfs/dbraw/zinc/39/47/74/1053394774.db2.gz LIFDYHDIANAWKT-UHFFFAOYSA-N 1 2 307.397 4.020 20 0 DIADLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccc(SC(C)(C)C)cc1 ZINC000847425992 1053395695 /nfs/dbraw/zinc/39/56/95/1053395695.db2.gz BHQHTPLJBAOPIT-GFCCVEGCSA-N 1 2 317.458 4.118 20 0 DIADLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccc(SC(C)(C)C)cc1 ZINC000847425992 1053395707 /nfs/dbraw/zinc/39/57/07/1053395707.db2.gz BHQHTPLJBAOPIT-GFCCVEGCSA-N 1 2 317.458 4.118 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2noc3c2CC(C)(C)CC3)c(C)o1 ZINC001352889668 1053426737 /nfs/dbraw/zinc/42/67/37/1053426737.db2.gz LFDGRINTRKCDGY-LBPRGKRZSA-N 1 2 302.418 4.250 20 0 DIADLO COc1cccc2c1CC[C@H]([NH2+][C@@H](c1ccccc1)C(F)F)C2 ZINC001474761841 1053430820 /nfs/dbraw/zinc/43/08/20/1053430820.db2.gz CYAPKQRZKIHBMU-YJBOKZPZSA-N 1 2 317.379 4.149 20 0 DIADLO COc1ccc(OC)c([C@H](C)Oc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001229953903 1053438469 /nfs/dbraw/zinc/43/84/69/1053438469.db2.gz FMWJFMBBMNAXQP-AWEZNQCLSA-N 1 2 324.380 4.030 20 0 DIADLO C[C@@H](Oc1ccc(-n2cc[nH+]c2)cc1)c1ccc(F)c(F)c1 ZINC001229954162 1053438748 /nfs/dbraw/zinc/43/87/48/1053438748.db2.gz KDOXKZNVJOJYAK-GFCCVEGCSA-N 1 2 300.308 4.291 20 0 DIADLO C[C@@H](Oc1ccc(-n2cc[nH+]c2)cc1)c1cccc(N(C)C)c1 ZINC001229954969 1053438795 /nfs/dbraw/zinc/43/87/95/1053438795.db2.gz WMDJRLVAMSLYOA-OAHLLOKOSA-N 1 2 307.397 4.078 20 0 DIADLO O=C(OCCCn1cc[nH+]c1)c1ccc2c(c1)oc1ccccc12 ZINC001322001908 1053446314 /nfs/dbraw/zinc/44/63/14/1053446314.db2.gz RQGXCXMAAICAQE-UHFFFAOYSA-N 1 2 320.348 4.030 20 0 DIADLO CCSc1cccc(CNc2ccc(N3CCCC3)c[nH+]2)c1 ZINC000471476974 1053455155 /nfs/dbraw/zinc/45/51/55/1053455155.db2.gz RFKOUSOYMRUGGW-UHFFFAOYSA-N 1 2 313.470 4.406 20 0 DIADLO COc1ccc(CC[C@@H](C)Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000324512408 1053461913 /nfs/dbraw/zinc/46/19/13/1053461913.db2.gz UODLTPFACHYHBV-MRXNPFEDSA-N 1 2 321.424 4.314 20 0 DIADLO COc1ccc(C2CC2)cc1C[NH2+]Cc1csc(C(C)C)n1 ZINC001353031300 1053461966 /nfs/dbraw/zinc/46/19/66/1053461966.db2.gz XPTOPERJYFQHPT-UHFFFAOYSA-N 1 2 316.470 4.442 20 0 DIADLO Cl/C=C(/Cl)C[N@@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000763566336 1053479323 /nfs/dbraw/zinc/47/93/23/1053479323.db2.gz NCTTXVYLULPCKD-SFKKXYGYSA-N 1 2 314.256 4.029 20 0 DIADLO Cl/C=C(/Cl)C[N@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000763566336 1053479330 /nfs/dbraw/zinc/47/93/30/1053479330.db2.gz NCTTXVYLULPCKD-SFKKXYGYSA-N 1 2 314.256 4.029 20 0 DIADLO C[C@@H]1CCc2nc(C[NH2+]C3(c4ccccc4F)CC3)sc2C1 ZINC000152736994 1053517905 /nfs/dbraw/zinc/51/79/05/1053517905.db2.gz HVPCLLIUAQATRC-GFCCVEGCSA-N 1 2 316.445 4.186 20 0 DIADLO C[C@@H]([NH2+]c1ccc(N(C)Cc2ccccc2)cc1)[C@H]1CCOC1 ZINC000182901182 1053544824 /nfs/dbraw/zinc/54/48/24/1053544824.db2.gz SXCOGZYLBVRNNW-AEFFLSMTSA-N 1 2 310.441 4.160 20 0 DIADLO C[C@H](CC1CCCCC1)C(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC001322859644 1053547231 /nfs/dbraw/zinc/54/72/31/1053547231.db2.gz MUPKODADVURTLL-NVXWUHKLSA-N 1 2 319.493 4.021 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@H+]2C)c1ccc(Cl)nc1 ZINC000182956071 1053562466 /nfs/dbraw/zinc/56/24/66/1053562466.db2.gz FZSMPCVDCHMQAT-LBPRGKRZSA-N 1 2 301.821 4.291 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CCC[N@@H+]2C)c1ccc(Cl)nc1 ZINC000182956071 1053562482 /nfs/dbraw/zinc/56/24/82/1053562482.db2.gz FZSMPCVDCHMQAT-LBPRGKRZSA-N 1 2 301.821 4.291 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1ncoc1C(C)C ZINC001323390041 1053580900 /nfs/dbraw/zinc/58/09/00/1053580900.db2.gz YVUXTSWSHPAUES-MRXNPFEDSA-N 1 2 302.418 4.390 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1ncoc1C(C)C ZINC001323390041 1053580909 /nfs/dbraw/zinc/58/09/09/1053580909.db2.gz YVUXTSWSHPAUES-MRXNPFEDSA-N 1 2 302.418 4.390 20 0 DIADLO CCN(CC)c1ccc(N[C@@H](C)c2ccc(Cl)nc2)c[nH+]1 ZINC000183165626 1053600153 /nfs/dbraw/zinc/60/01/53/1053600153.db2.gz OZDCZEVDPQIWQO-LBPRGKRZSA-N 1 2 304.825 4.149 20 0 DIADLO FC(F)n1ccnc1C[N@@H+]1C[C@@H]2CCCC[C@]21c1ccccc1 ZINC001324058646 1053621609 /nfs/dbraw/zinc/62/16/09/1053621609.db2.gz AUIAISKEURHHQJ-YJBOKZPZSA-N 1 2 317.383 4.180 20 0 DIADLO FC(F)n1ccnc1C[N@H+]1C[C@@H]2CCCC[C@]21c1ccccc1 ZINC001324058646 1053621616 /nfs/dbraw/zinc/62/16/16/1053621616.db2.gz AUIAISKEURHHQJ-YJBOKZPZSA-N 1 2 317.383 4.180 20 0 DIADLO CCS[C@@H]1CCCC[N@H+](Cc2nc(C(F)(F)F)cs2)C1 ZINC000153505907 1053623506 /nfs/dbraw/zinc/62/35/06/1053623506.db2.gz HLXSSNZEYKJNAI-SNVBAGLBSA-N 1 2 324.437 4.270 20 0 DIADLO CCS[C@@H]1CCCC[N@@H+](Cc2nc(C(F)(F)F)cs2)C1 ZINC000153505907 1053623517 /nfs/dbraw/zinc/62/35/17/1053623517.db2.gz HLXSSNZEYKJNAI-SNVBAGLBSA-N 1 2 324.437 4.270 20 0 DIADLO CCCCC(=O)[C@@H](CCCC)Oc1cc2c(cc1O)C=[NH+]CC2 ZINC001230921295 1053624925 /nfs/dbraw/zinc/62/49/25/1053624925.db2.gz KLJBWBJAWLSMLG-GOSISDBHSA-N 1 2 317.429 4.064 20 0 DIADLO FC(F)c1cccc(C[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC001324127305 1053628344 /nfs/dbraw/zinc/62/83/44/1053628344.db2.gz CFCCKLYZZZHTMM-HNNXBMFYSA-N 1 2 320.387 4.154 20 0 DIADLO Cc1cc(NC[C@@]2(CO)C[C@@H]2c2ccccc2)[nH+]c2ccccc12 ZINC001324235308 1053635764 /nfs/dbraw/zinc/63/57/64/1053635764.db2.gz HTPLJYRZHNKQCX-WIYYLYMNSA-N 1 2 318.420 4.121 20 0 DIADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2nc(CCC(C)C)no2)c(C)c1 ZINC000620278342 1053640063 /nfs/dbraw/zinc/64/00/63/1053640063.db2.gz NEVIFEKGOXASFO-INIZCTEOSA-N 1 2 315.461 4.468 20 0 DIADLO Cc1ccc([C@H](C)[N@H+](C)Cc2nc(CCC(C)C)no2)c(C)c1 ZINC000620278342 1053640077 /nfs/dbraw/zinc/64/00/77/1053640077.db2.gz NEVIFEKGOXASFO-INIZCTEOSA-N 1 2 315.461 4.468 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2c(F)cccc2F)CCC1 ZINC001324294341 1053641870 /nfs/dbraw/zinc/64/18/70/1053641870.db2.gz USNYPJKWIVNWPV-UHFFFAOYSA-N 1 2 303.352 4.142 20 0 DIADLO FC(F)c1cccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)c1 ZINC001324333391 1053643459 /nfs/dbraw/zinc/64/34/59/1053643459.db2.gz ABYRPTJVNFIDST-MRXNPFEDSA-N 1 2 313.351 4.227 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@@H+]2Cc2c(C)cc(C)cc2C)no1 ZINC000620342411 1053647727 /nfs/dbraw/zinc/64/77/27/1053647727.db2.gz JTTBIPBADKOKDH-KRWDZBQOSA-N 1 2 313.445 4.284 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@H+]2Cc2c(C)cc(C)cc2C)no1 ZINC000620342411 1053647732 /nfs/dbraw/zinc/64/77/32/1053647732.db2.gz JTTBIPBADKOKDH-KRWDZBQOSA-N 1 2 313.445 4.284 20 0 DIADLO Cc1cc(NCc2ccc(C[S@@](C)=O)cc2)[nH+]c2ccccc12 ZINC001324391801 1053649706 /nfs/dbraw/zinc/64/97/06/1053649706.db2.gz RHRHFASMTBOCCN-HSZRJFAPSA-N 1 2 324.449 4.034 20 0 DIADLO ClC1(Cl)C[C@@H]1CSCc1ccc(-n2cc[nH+]c2)cc1 ZINC001324496649 1053659167 /nfs/dbraw/zinc/65/91/67/1053659167.db2.gz XRMGTAQKKQFEDU-GFCCVEGCSA-N 1 2 313.253 4.299 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2nnc(-c3ccccc3)[nH]2)cc1 ZINC001200438976 1053662827 /nfs/dbraw/zinc/66/28/27/1053662827.db2.gz KJPBZWGBTRGJBU-UHFFFAOYSA-N 1 2 320.440 4.059 20 0 DIADLO Cc1cc(NC(=O)[C@@H](C)c2ccc(CC(C)C)cc2)c(C)c[nH+]1 ZINC001435757807 1053665083 /nfs/dbraw/zinc/66/50/83/1053665083.db2.gz NPHCEQRDWJYQNM-INIZCTEOSA-N 1 2 310.441 4.061 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2nc3c(s2)C[C@H](C)CC3)o1 ZINC001324643160 1053667343 /nfs/dbraw/zinc/66/73/43/1053667343.db2.gz UPXLXFKCMIKXSU-DYEKYZERSA-N 1 2 316.470 4.274 20 0 DIADLO Cc1ccc2c(ccc(C)c2C(=O)Nc2cc(C)[nH+]cc2C)c1 ZINC001435758903 1053667425 /nfs/dbraw/zinc/66/74/25/1053667425.db2.gz VIIYPVUJPMXLRV-UHFFFAOYSA-N 1 2 304.393 4.143 20 0 DIADLO c1c[nH+]c(-c2ccc(OC3CCN(c4ccccc4)CC3)cc2)[nH]1 ZINC001231080349 1053669608 /nfs/dbraw/zinc/66/96/08/1053669608.db2.gz CCXNFNHDOSOYLG-UHFFFAOYSA-N 1 2 319.408 4.125 20 0 DIADLO Cc1cccc(OC[C@H](C)Oc2ccc(-c3c[nH+]cn3C)cc2)c1 ZINC001231083439 1053671525 /nfs/dbraw/zinc/67/15/25/1053671525.db2.gz KJULDUWBTBOMJA-INIZCTEOSA-N 1 2 322.408 4.242 20 0 DIADLO C[C@H](Oc1ccc(-c2c[nH+]cn2C)cc1)c1cccnc1Cl ZINC001231082167 1053671537 /nfs/dbraw/zinc/67/15/37/1053671537.db2.gz NTDWSBAHOTUPDV-LBPRGKRZSA-N 1 2 313.788 4.276 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(OC2CC(C)(C)OC(C)(C)C2)cc1 ZINC001231084160 1053672020 /nfs/dbraw/zinc/67/20/20/1053672020.db2.gz YSVJJHXIBPOUGN-UHFFFAOYSA-N 1 2 314.429 4.202 20 0 DIADLO c1[nH]c(CNc2ccc([NH+]3CCCC3)cc2)nc1-c1ccccc1 ZINC001324759224 1053678120 /nfs/dbraw/zinc/67/81/20/1053678120.db2.gz OKOWVLAOIWWODL-UHFFFAOYSA-N 1 2 318.424 4.289 20 0 DIADLO Cc1ccc(N[C@H](C)c2cnn(Cc3ccccc3)c2)c(C)[nH+]1 ZINC001324964612 1053691597 /nfs/dbraw/zinc/69/15/97/1053691597.db2.gz DMHPSULKVQAIPW-OAHLLOKOSA-N 1 2 306.413 4.116 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)c(C)[nH+]1 ZINC001353885119 1053697106 /nfs/dbraw/zinc/69/71/06/1053697106.db2.gz HGOFREMJRWVCTP-GVDBMIGSSA-N 1 2 300.446 4.096 20 0 DIADLO CCn1ccnc1C[NH2+][C@@H](c1ccccc1)c1ccc(C)cc1C ZINC000263886803 1053701701 /nfs/dbraw/zinc/70/17/01/1053701701.db2.gz JEYTZBXMPWQDBJ-NRFANRHFSA-N 1 2 319.452 4.399 20 0 DIADLO CCn1ccnc1C[NH2+][C@H](c1ccccc1)c1cc(C)ccc1C ZINC000263883165 1053702476 /nfs/dbraw/zinc/70/24/76/1053702476.db2.gz FTYWPEWMTFLCSX-OAQYLSRUSA-N 1 2 319.452 4.399 20 0 DIADLO Fc1cc2[nH+]ccc(N3CC[C@H]4OCCC[C@@H]4C3)c2cc1Cl ZINC001325182749 1053704905 /nfs/dbraw/zinc/70/49/05/1053704905.db2.gz VWJGGGJSVONXMC-PIGZYNQJSA-N 1 2 320.795 4.033 20 0 DIADLO Cc1cc(NCc2nn(C)c3ccccc23)[nH+]c2ccccc12 ZINC001325381595 1053716834 /nfs/dbraw/zinc/71/68/34/1053716834.db2.gz AFIQBYXVTKSNGO-UHFFFAOYSA-N 1 2 302.381 4.042 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cncc(F)c1)c1nc(C(C)(C)C)cs1 ZINC000154013827 1053722151 /nfs/dbraw/zinc/72/21/51/1053722151.db2.gz HXLURHDAEAOTIP-WDEREUQCSA-N 1 2 307.438 4.387 20 0 DIADLO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2noc(C3CCCCC3)n2)C1 ZINC000154153241 1053729854 /nfs/dbraw/zinc/72/98/54/1053729854.db2.gz CYDDYVGZTOHUJR-LSDHHAIUSA-N 1 2 323.506 4.223 20 0 DIADLO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2noc(C3CCCCC3)n2)C1 ZINC000154153241 1053729858 /nfs/dbraw/zinc/72/98/58/1053729858.db2.gz CYDDYVGZTOHUJR-LSDHHAIUSA-N 1 2 323.506 4.223 20 0 DIADLO C[C@H]([NH2+]Cc1nc(-c2ccoc2)no1)c1ccc2c(c1)CCCC2 ZINC000154347436 1053736690 /nfs/dbraw/zinc/73/66/90/1053736690.db2.gz KGKJCTFLKPHKFY-ZDUSSCGKSA-N 1 2 323.396 4.059 20 0 DIADLO Cc1ccc2c(c1)nc(CNc1cc(C)c3ccccc3[nH+]1)n2C ZINC001325952903 1053743623 /nfs/dbraw/zinc/74/36/23/1053743623.db2.gz YAVQWWXCXUWULH-UHFFFAOYSA-N 1 2 316.408 4.350 20 0 DIADLO Cc1cc(N2CCC(C3CCOCC3)CC2)[nH+]c2ccccc12 ZINC001325961491 1053743651 /nfs/dbraw/zinc/74/36/51/1053743651.db2.gz OEGZXBYJRLMCNI-UHFFFAOYSA-N 1 2 310.441 4.186 20 0 DIADLO CN(C)c1ccc2cc(C[N@@H+]3CCC(F)(F)[C@H](F)C3)ccc2c1 ZINC001231440042 1053753739 /nfs/dbraw/zinc/75/37/39/1053753739.db2.gz VASXJEIUJLSKQF-QGZVFWFLSA-N 1 2 322.374 4.085 20 0 DIADLO CN(C)c1ccc2cc(C[N@H+]3CCC(F)(F)[C@H](F)C3)ccc2c1 ZINC001231440042 1053753743 /nfs/dbraw/zinc/75/37/43/1053753743.db2.gz VASXJEIUJLSKQF-QGZVFWFLSA-N 1 2 322.374 4.085 20 0 DIADLO Cc1cc(F)cc(N2CCC[C@@H](c3nc4ccccc4o3)C2)[nH+]1 ZINC001354070117 1053756064 /nfs/dbraw/zinc/75/60/64/1053756064.db2.gz LINQUNBKJPVSOZ-CYBMUJFWSA-N 1 2 311.360 4.054 20 0 DIADLO COC[C@H]1CCC[N@@H+]1Cc1c(Cl)ccc(Cl)c1Cl ZINC001231480752 1053760491 /nfs/dbraw/zinc/76/04/91/1053760491.db2.gz XFSQNCONGVJQNY-SECBINFHSA-N 1 2 308.636 4.258 20 0 DIADLO COC[C@H]1CCC[N@H+]1Cc1c(Cl)ccc(Cl)c1Cl ZINC001231480752 1053760500 /nfs/dbraw/zinc/76/05/00/1053760500.db2.gz XFSQNCONGVJQNY-SECBINFHSA-N 1 2 308.636 4.258 20 0 DIADLO C[N@H+](Cc1nnc(-c2ccccc2)s1)[C@@H]1CCc2ccccc21 ZINC000155103888 1053761439 /nfs/dbraw/zinc/76/14/39/1053761439.db2.gz JBPQJXGEAZZESO-QGZVFWFLSA-N 1 2 321.449 4.324 20 0 DIADLO C[N@@H+](Cc1nnc(-c2ccccc2)s1)[C@@H]1CCc2ccccc21 ZINC000155103888 1053761456 /nfs/dbraw/zinc/76/14/56/1053761456.db2.gz JBPQJXGEAZZESO-QGZVFWFLSA-N 1 2 321.449 4.324 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CCC[C@]23CCOC3)c1Cl ZINC001231482030 1053764297 /nfs/dbraw/zinc/76/42/97/1053764297.db2.gz ZZWRJVWZLAHROW-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CCC[C@]23CCOC3)c1Cl ZINC001231482030 1053764304 /nfs/dbraw/zinc/76/43/04/1053764304.db2.gz ZZWRJVWZLAHROW-CQSZACIVSA-N 1 2 320.647 4.402 20 0 DIADLO C(=C/c1ccc(C[NH+]2CC3(C2)CCCO3)cc1)\c1ccccc1 ZINC001231486872 1053767335 /nfs/dbraw/zinc/76/73/35/1053767335.db2.gz OTXGCBUTPWLWLG-BQYQJAHWSA-N 1 2 305.421 4.222 20 0 DIADLO C(=C/c1ccc(CN2CCn3c[nH+]cc3C2)cc1)\c1ccccc1 ZINC001231489962 1053769788 /nfs/dbraw/zinc/76/97/88/1053769788.db2.gz WMBWEFGFKXBWMV-VOTSOKGWSA-N 1 2 315.420 4.069 20 0 DIADLO CCc1ccc(C[N@H+](Cc2cccnc2)Cc2ccccn2)s1 ZINC001231501507 1053771660 /nfs/dbraw/zinc/77/16/60/1053771660.db2.gz KHFCBYPATZIAHH-UHFFFAOYSA-N 1 2 323.465 4.303 20 0 DIADLO CCc1ccc(C[N@@H+](Cc2cccnc2)Cc2ccccn2)s1 ZINC001231501507 1053771665 /nfs/dbraw/zinc/77/16/65/1053771665.db2.gz KHFCBYPATZIAHH-UHFFFAOYSA-N 1 2 323.465 4.303 20 0 DIADLO c1ccc(-c2cccc(C[NH+]3CC(Oc4cccnc4)C3)c2)cc1 ZINC001231509881 1053775759 /nfs/dbraw/zinc/77/57/59/1053775759.db2.gz HGLCOVCYVYZTNF-UHFFFAOYSA-N 1 2 316.404 4.012 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2cc3cc(F)ccc3o2)cs1 ZINC001200572844 1053776645 /nfs/dbraw/zinc/77/66/45/1053776645.db2.gz SJXVNFWIXRRDNS-SNVBAGLBSA-N 1 2 304.390 4.442 20 0 DIADLO COc1c(Cl)cc(Cl)cc1C[NH2+]Cc1ncc(C)s1 ZINC001200581958 1053786288 /nfs/dbraw/zinc/78/62/88/1053786288.db2.gz WBFUWXLTMSJFOI-UHFFFAOYSA-N 1 2 317.241 4.057 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)C[C@]1(C)O ZINC001231598623 1053799837 /nfs/dbraw/zinc/79/98/37/1053799837.db2.gz RBIHSMWDYUEBGG-OTYXRUKQSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2Cl)C[C@]1(C)O ZINC001231598623 1053799851 /nfs/dbraw/zinc/79/98/51/1053799851.db2.gz RBIHSMWDYUEBGG-OTYXRUKQSA-N 1 2 322.663 4.240 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3coc(-c4ccccc4)n3)CC2)c1 ZINC000156293526 1053805249 /nfs/dbraw/zinc/80/52/49/1053805249.db2.gz YZBJWQBTPUBQKN-UHFFFAOYSA-N 1 2 308.356 4.260 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2ccc(SC)c(F)c2)cs1 ZINC000156426146 1053807421 /nfs/dbraw/zinc/80/74/21/1053807421.db2.gz DIRFNOJUEBHMKQ-SNVBAGLBSA-N 1 2 310.463 4.417 20 0 DIADLO CCc1ccc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)nc1 ZINC001231640358 1053812060 /nfs/dbraw/zinc/81/20/60/1053812060.db2.gz CPGFVEDBEPKSTE-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO CCc1ccc(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)nc1 ZINC001231640358 1053812083 /nfs/dbraw/zinc/81/20/83/1053812083.db2.gz CPGFVEDBEPKSTE-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO CCc1ccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)nc1 ZINC001231642748 1053812169 /nfs/dbraw/zinc/81/21/69/1053812169.db2.gz PHZNOGRXVWMEKJ-KRWDZBQOSA-N 1 2 302.368 4.259 20 0 DIADLO CCc1ccc(C[N@H+]2CCC[C@H]2c2c(F)cccc2F)nc1 ZINC001231642748 1053812182 /nfs/dbraw/zinc/81/21/82/1053812182.db2.gz PHZNOGRXVWMEKJ-KRWDZBQOSA-N 1 2 302.368 4.259 20 0 DIADLO CCc1ccc(C[N@@H+]2CCSC[C@H]2c2ccc(F)cc2)nc1 ZINC001231641955 1053813382 /nfs/dbraw/zinc/81/33/82/1053813382.db2.gz LIUHVYNUFSIOSB-SFHVURJKSA-N 1 2 316.445 4.073 20 0 DIADLO CCc1ccc(C[N@H+]2CCSC[C@H]2c2ccc(F)cc2)nc1 ZINC001231641955 1053813391 /nfs/dbraw/zinc/81/33/91/1053813391.db2.gz LIUHVYNUFSIOSB-SFHVURJKSA-N 1 2 316.445 4.073 20 0 DIADLO Cc1cccc2cc(C[N@H+]3CC[C@@H](C)[C@H](F)C3)c(Cl)nc12 ZINC001231648332 1053816458 /nfs/dbraw/zinc/81/64/58/1053816458.db2.gz CSHFGZUAIORSKE-IAQYHMDHSA-N 1 2 306.812 4.377 20 0 DIADLO Cc1cccc2cc(C[N@@H+]3CC[C@@H](C)[C@H](F)C3)c(Cl)nc12 ZINC001231648332 1053816476 /nfs/dbraw/zinc/81/64/76/1053816476.db2.gz CSHFGZUAIORSKE-IAQYHMDHSA-N 1 2 306.812 4.377 20 0 DIADLO Cc1cccc2cc(C[N@@H+](C)C3CC(F)(F)C3)c(Cl)nc12 ZINC001231647677 1053816963 /nfs/dbraw/zinc/81/69/63/1053816963.db2.gz OSBFAPCCJXUYAT-UHFFFAOYSA-N 1 2 310.775 4.426 20 0 DIADLO Cc1cccc2cc(C[N@H+](C)C3CC(F)(F)C3)c(Cl)nc12 ZINC001231647677 1053816981 /nfs/dbraw/zinc/81/69/81/1053816981.db2.gz OSBFAPCCJXUYAT-UHFFFAOYSA-N 1 2 310.775 4.426 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1ccnn1CC1CC1 ZINC001327074583 1053834529 /nfs/dbraw/zinc/83/45/29/1053834529.db2.gz PUFUVNWCKLKNDA-UHFFFAOYSA-N 1 2 323.444 4.010 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)Cc2ccccc2C)c(OC)c1 ZINC001231697034 1053835998 /nfs/dbraw/zinc/83/59/98/1053835998.db2.gz NKSHVCVKHQKJOZ-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)Cc2ccccc2C)c(OC)c1 ZINC001231697034 1053836019 /nfs/dbraw/zinc/83/60/19/1053836019.db2.gz NKSHVCVKHQKJOZ-UHFFFAOYSA-N 1 2 319.832 4.298 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)c(O)c2)cn1 ZINC001231734496 1053840693 /nfs/dbraw/zinc/84/06/93/1053840693.db2.gz AGFXFKROKXYLAM-MRXNPFEDSA-N 1 2 302.805 4.086 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)c(O)c2)cn1 ZINC001231734496 1053840705 /nfs/dbraw/zinc/84/07/05/1053840705.db2.gz AGFXFKROKXYLAM-MRXNPFEDSA-N 1 2 302.805 4.086 20 0 DIADLO Oc1cc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)ccc1Cl ZINC001231733885 1053841872 /nfs/dbraw/zinc/84/18/72/1053841872.db2.gz KSCSZUGYMOCUHO-MRXNPFEDSA-N 1 2 319.857 4.336 20 0 DIADLO Oc1cc(C[N@H+]2CCSC[C@@H]2c2ccccc2)ccc1Cl ZINC001231733885 1053841884 /nfs/dbraw/zinc/84/18/84/1053841884.db2.gz KSCSZUGYMOCUHO-MRXNPFEDSA-N 1 2 319.857 4.336 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[N@@H+]1CCC(=O)C[C@@H]1C ZINC001231735007 1053846732 /nfs/dbraw/zinc/84/67/32/1053846732.db2.gz IEIKFTLIPHDCAE-HNNXBMFYSA-N 1 2 311.425 4.180 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[N@H+]1CCC(=O)C[C@@H]1C ZINC001231735007 1053846749 /nfs/dbraw/zinc/84/67/49/1053846749.db2.gz IEIKFTLIPHDCAE-HNNXBMFYSA-N 1 2 311.425 4.180 20 0 DIADLO CCOc1ncccc1C[N@H+](C)[C@@H](C)c1ccccc1Cl ZINC001231765952 1053852847 /nfs/dbraw/zinc/85/28/47/1053852847.db2.gz PAEKVDUGTNQXRJ-ZDUSSCGKSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1ncccc1C[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC001231765952 1053852862 /nfs/dbraw/zinc/85/28/62/1053852862.db2.gz PAEKVDUGTNQXRJ-ZDUSSCGKSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1ncccc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001231766154 1053854105 /nfs/dbraw/zinc/85/41/05/1053854105.db2.gz VWCXSQQBXWLSSC-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ncccc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001231766154 1053854113 /nfs/dbraw/zinc/85/41/13/1053854113.db2.gz VWCXSQQBXWLSSC-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO c1nnc(C[NH2+][C@@H](CCCCc2ccccc2)c2ccccc2)[nH]1 ZINC001327520346 1053860604 /nfs/dbraw/zinc/86/06/04/1053860604.db2.gz RXMMDQIOTLOIEJ-IBGZPJMESA-N 1 2 320.440 4.049 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCCc1cscn1 ZINC001327521570 1053861648 /nfs/dbraw/zinc/86/16/48/1053861648.db2.gz USHZZSAENFGYCL-UHFFFAOYSA-N 1 2 315.467 4.113 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ncoc2C(C)C)cc1F ZINC001327584142 1053865601 /nfs/dbraw/zinc/86/56/01/1053865601.db2.gz UUVSVXKPTICVJE-INIZCTEOSA-N 1 2 318.392 4.283 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ncoc2C(C)C)cc1F ZINC001327584142 1053865619 /nfs/dbraw/zinc/86/56/19/1053865619.db2.gz UUVSVXKPTICVJE-INIZCTEOSA-N 1 2 318.392 4.283 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc(-c3ccccc3)o1)C2 ZINC001231813768 1053871893 /nfs/dbraw/zinc/87/18/93/1053871893.db2.gz RZORLRMDRYQBNA-UHFFFAOYSA-N 1 2 305.377 4.471 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc(-c3ccccc3)o1)C2 ZINC001231813768 1053871906 /nfs/dbraw/zinc/87/19/06/1053871906.db2.gz RZORLRMDRYQBNA-UHFFFAOYSA-N 1 2 305.377 4.471 20 0 DIADLO Cc1nc2c(o1)CC[N@H+](Cc1ccccc1-c1ccc(F)cc1)C2 ZINC001231825509 1053881023 /nfs/dbraw/zinc/88/10/23/1053881023.db2.gz AIHVOFDIUUHPKO-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1nc2c(o1)CC[N@@H+](Cc1ccccc1-c1ccc(F)cc1)C2 ZINC001231825509 1053881031 /nfs/dbraw/zinc/88/10/31/1053881031.db2.gz AIHVOFDIUUHPKO-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1csc2sc(C[N@@H+]3Cc4ccncc4C3)c(C)c12 ZINC001231834610 1053886161 /nfs/dbraw/zinc/88/61/61/1053886161.db2.gz REQNGKREBVFVEP-UHFFFAOYSA-N 1 2 300.452 4.490 20 0 DIADLO Cc1csc2sc(C[N@H+]3Cc4ccncc4C3)c(C)c12 ZINC001231834610 1053886171 /nfs/dbraw/zinc/88/61/71/1053886171.db2.gz REQNGKREBVFVEP-UHFFFAOYSA-N 1 2 300.452 4.490 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+](C)Cc3cc(C(C)(C)C)n[nH]3)cc21 ZINC001327880717 1053889837 /nfs/dbraw/zinc/88/98/37/1053889837.db2.gz JKKFIYOBJXBIEF-UHFFFAOYSA-N 1 2 310.445 4.129 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+](C)Cc3cc(C(C)(C)C)n[nH]3)cc21 ZINC001327880717 1053889851 /nfs/dbraw/zinc/88/98/51/1053889851.db2.gz JKKFIYOBJXBIEF-UHFFFAOYSA-N 1 2 310.445 4.129 20 0 DIADLO Cc1cc(OCc2ccccc2)ccc1C[N@H+]1CCC(=O)C[C@H]1C ZINC001231848187 1053892152 /nfs/dbraw/zinc/89/21/52/1053892152.db2.gz YNBFDZMEUSNHGS-QGZVFWFLSA-N 1 2 323.436 4.127 20 0 DIADLO Cc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCC(=O)C[C@H]1C ZINC001231848187 1053892159 /nfs/dbraw/zinc/89/21/59/1053892159.db2.gz YNBFDZMEUSNHGS-QGZVFWFLSA-N 1 2 323.436 4.127 20 0 DIADLO Fc1c(C[NH+]2CC3(C2)CCCC3)ccc(C(F)(F)F)c1F ZINC001231859467 1053893193 /nfs/dbraw/zinc/89/31/93/1053893193.db2.gz ULEXHQZARLZJOD-UHFFFAOYSA-N 1 2 305.290 4.360 20 0 DIADLO FC1(F)CC2(C[NH+](Cc3ccc(OC4CCCCC4)nc3)C2)C1 ZINC001231871241 1053900361 /nfs/dbraw/zinc/90/03/61/1053900361.db2.gz HBBCEZIRCHXRLT-UHFFFAOYSA-N 1 2 322.399 4.024 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)/C(F)=C\C1CCCCC1 ZINC001354542965 1053902706 /nfs/dbraw/zinc/90/27/06/1053902706.db2.gz VVDYQWFLXZUZFP-GZTJUZNOSA-N 1 2 313.376 4.245 20 0 DIADLO COC(=O)c1cccc2c1C[N@H+](Cc1ccccc1C(C)C)C2 ZINC001231877127 1053903258 /nfs/dbraw/zinc/90/32/58/1053903258.db2.gz WGGVEOCSBDPNMO-UHFFFAOYSA-N 1 2 309.409 4.112 20 0 DIADLO COC(=O)c1cccc2c1C[N@@H+](Cc1ccccc1C(C)C)C2 ZINC001231877127 1053903263 /nfs/dbraw/zinc/90/32/63/1053903263.db2.gz WGGVEOCSBDPNMO-UHFFFAOYSA-N 1 2 309.409 4.112 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2cccnc2)cnc1F ZINC001231926586 1053915277 /nfs/dbraw/zinc/91/52/77/1053915277.db2.gz ALZPNDZHXAUIQA-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)cnc1F ZINC001231926586 1053915289 /nfs/dbraw/zinc/91/52/89/1053915289.db2.gz ALZPNDZHXAUIQA-UHFFFAOYSA-N 1 2 321.399 4.127 20 0 DIADLO Cc1ccc2c(C(=O)Nc3ccn4cc[nH+]c4c3)csc2c1 ZINC001436600198 1053918406 /nfs/dbraw/zinc/91/84/06/1053918406.db2.gz VBXDIPRYKPYPGC-UHFFFAOYSA-N 1 2 307.378 4.110 20 0 DIADLO FC(F)(F)c1cnc(Cl)cc1C[N@@H+]1CCC12CCCC2 ZINC001231930408 1053919264 /nfs/dbraw/zinc/91/92/64/1053919264.db2.gz NWJLZEVCRUGTBM-UHFFFAOYSA-N 1 2 304.743 4.272 20 0 DIADLO FC(F)(F)c1cnc(Cl)cc1C[N@H+]1CCC12CCCC2 ZINC001231930408 1053919273 /nfs/dbraw/zinc/91/92/73/1053919273.db2.gz NWJLZEVCRUGTBM-UHFFFAOYSA-N 1 2 304.743 4.272 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cnc(F)c(C)c1 ZINC001231931243 1053920724 /nfs/dbraw/zinc/92/07/24/1053920724.db2.gz UCQHHOYVFBVRBO-KRWDZBQOSA-N 1 2 314.404 4.013 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cnc(F)c(C)c1 ZINC001231931243 1053920734 /nfs/dbraw/zinc/92/07/34/1053920734.db2.gz UCQHHOYVFBVRBO-KRWDZBQOSA-N 1 2 314.404 4.013 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001231983812 1053928471 /nfs/dbraw/zinc/92/84/71/1053928471.db2.gz DWMWSDQQWXPYHV-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(F)ncc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC001231983812 1053928480 /nfs/dbraw/zinc/92/84/80/1053928480.db2.gz DWMWSDQQWXPYHV-MRXNPFEDSA-N 1 2 306.331 4.144 20 0 DIADLO Clc1cncc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC000621257582 1053928713 /nfs/dbraw/zinc/92/87/13/1053928713.db2.gz CTDGIEZWJBKCOQ-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1cncc(C[N@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC000621257582 1053928727 /nfs/dbraw/zinc/92/87/27/1053928727.db2.gz CTDGIEZWJBKCOQ-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO CCC1CC[NH+](Cc2cc(C(F)(F)F)cnc2Cl)CC1 ZINC001232005598 1053935058 /nfs/dbraw/zinc/93/50/58/1053935058.db2.gz KNCQUALZJVOXNL-UHFFFAOYSA-N 1 2 306.759 4.376 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccccn1 ZINC000159028533 1053931352 /nfs/dbraw/zinc/93/13/52/1053931352.db2.gz MIJOTEAJVAVDAT-CYBMUJFWSA-N 1 2 303.475 4.467 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)cnc2F)cc1 ZINC001231992703 1053933218 /nfs/dbraw/zinc/93/32/18/1053933218.db2.gz MXLBVIUHIXTAKD-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(Cl)cnc2F)cc1 ZINC001231992703 1053933227 /nfs/dbraw/zinc/93/32/27/1053933227.db2.gz MXLBVIUHIXTAKD-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1cn(C)nc1Cl ZINC001328506273 1053938135 /nfs/dbraw/zinc/93/81/35/1053938135.db2.gz RYSSSPZUQNWPQA-NSHDSACASA-N 1 2 303.793 4.013 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1cn(C)nc1Cl ZINC001328506273 1053938144 /nfs/dbraw/zinc/93/81/44/1053938144.db2.gz RYSSSPZUQNWPQA-NSHDSACASA-N 1 2 303.793 4.013 20 0 DIADLO CC[N@H+](CC(=O)OC(C)C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC001328603326 1053941280 /nfs/dbraw/zinc/94/12/80/1053941280.db2.gz WTUAFWGALNYTLS-GFCCVEGCSA-N 1 2 317.351 4.040 20 0 DIADLO CC[N@@H+](CC(=O)OC(C)C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC001328603326 1053941291 /nfs/dbraw/zinc/94/12/91/1053941291.db2.gz WTUAFWGALNYTLS-GFCCVEGCSA-N 1 2 317.351 4.040 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CCc2cc(C(C)(C)C)ccc2C1 ZINC001328654988 1053946537 /nfs/dbraw/zinc/94/65/37/1053946537.db2.gz HOOIGIDFHGUEAV-UHFFFAOYSA-N 1 2 311.473 4.320 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CCc2cc(C(C)(C)C)ccc2C1 ZINC001328654988 1053946548 /nfs/dbraw/zinc/94/65/48/1053946548.db2.gz HOOIGIDFHGUEAV-UHFFFAOYSA-N 1 2 311.473 4.320 20 0 DIADLO COC(=O)Nc1cccc(CNc2cc(C)c3ccccc3[nH+]2)c1 ZINC001328645323 1053946575 /nfs/dbraw/zinc/94/65/75/1053946575.db2.gz SFLPZSCCMXEXCG-UHFFFAOYSA-N 1 2 321.380 4.334 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)c(C)n1 ZINC001232083620 1053958791 /nfs/dbraw/zinc/95/87/91/1053958791.db2.gz BTWVVWAQHHQWSK-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)c(C)n1 ZINC001232083620 1053958799 /nfs/dbraw/zinc/95/87/99/1053958799.db2.gz BTWVVWAQHHQWSK-UHFFFAOYSA-N 1 2 320.358 4.276 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CC[C@H](F)C(F)(F)CC2)c(Cl)c1 ZINC001232096799 1053963399 /nfs/dbraw/zinc/96/33/99/1053963399.db2.gz HRBJKULZGUTXLS-LBPRGKRZSA-N 1 2 313.697 4.187 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c(Cl)c1 ZINC001232096799 1053963413 /nfs/dbraw/zinc/96/34/13/1053963413.db2.gz HRBJKULZGUTXLS-LBPRGKRZSA-N 1 2 313.697 4.187 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1cccc(Cl)n1 ZINC000075586764 1053963754 /nfs/dbraw/zinc/96/37/54/1053963754.db2.gz YCOMOPRFKNEXKU-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1cccc(Cl)n1 ZINC000075586764 1053963766 /nfs/dbraw/zinc/96/37/66/1053963766.db2.gz YCOMOPRFKNEXKU-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Brc1ccccc1[C@H]1CCC[N@@H+]1Cc1cnsc1 ZINC001232223061 1053996897 /nfs/dbraw/zinc/99/68/97/1053996897.db2.gz CMYPSJGGQNVXJS-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccccc1[C@H]1CCC[N@H+]1Cc1cnsc1 ZINC001232223061 1053996903 /nfs/dbraw/zinc/99/69/03/1053996903.db2.gz CMYPSJGGQNVXJS-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO CC[C@H](c1ccccc1)[N@H+](C)Cc1ncccc1Br ZINC001232164621 1053974491 /nfs/dbraw/zinc/97/44/91/1053974491.db2.gz AUVGXMIEXMKRJM-MRXNPFEDSA-N 1 2 319.246 4.427 20 0 DIADLO CC[C@H](c1ccccc1)[N@@H+](C)Cc1ncccc1Br ZINC001232164621 1053974505 /nfs/dbraw/zinc/97/45/05/1053974505.db2.gz AUVGXMIEXMKRJM-MRXNPFEDSA-N 1 2 319.246 4.427 20 0 DIADLO Cc1cc(N[C@@H]2CCO[C@@H](c3cccnc3)C2)[nH+]c2ccccc12 ZINC001329254454 1053975855 /nfs/dbraw/zinc/97/58/55/1053975855.db2.gz RRSPIFUNXOAMGX-VQIMIIECSA-N 1 2 319.408 4.270 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1cn(C)nc1C1CC1 ZINC001232172695 1053980477 /nfs/dbraw/zinc/98/04/77/1053980477.db2.gz ZGDBRWMCUXCJMB-LBPRGKRZSA-N 1 2 303.837 4.144 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1cn(C)nc1C1CC1 ZINC001232172695 1053980489 /nfs/dbraw/zinc/98/04/89/1053980489.db2.gz ZGDBRWMCUXCJMB-LBPRGKRZSA-N 1 2 303.837 4.144 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccnc3c(F)cccc23)no1 ZINC001232207374 1053988818 /nfs/dbraw/zinc/98/88/18/1053988818.db2.gz IDJMEGXGRBCHIE-KRWDZBQOSA-N 1 2 311.360 4.007 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccnc3c(F)cccc23)no1 ZINC001232207374 1053988825 /nfs/dbraw/zinc/98/88/25/1053988825.db2.gz IDJMEGXGRBCHIE-KRWDZBQOSA-N 1 2 311.360 4.007 20 0 DIADLO CC[C@]1(C)CC(=O)N(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)C1 ZINC001329441980 1053990187 /nfs/dbraw/zinc/99/01/87/1053990187.db2.gz CZZACRJQEYKXDC-FUHWJXTLSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@]1(C)CC(=O)N(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)C1 ZINC001329441980 1053990202 /nfs/dbraw/zinc/99/02/02/1053990202.db2.gz CZZACRJQEYKXDC-FUHWJXTLSA-N 1 2 320.864 4.083 20 0 DIADLO C[N@H+](Cc1ccnc(C(C)(C)C)c1)Cc1ccc(F)cc1F ZINC001232221315 1053995482 /nfs/dbraw/zinc/99/54/82/1053995482.db2.gz WWKQYUVHBGMOBE-UHFFFAOYSA-N 1 2 304.384 4.289 20 0 DIADLO C[N@@H+](Cc1ccnc(C(C)(C)C)c1)Cc1ccc(F)cc1F ZINC001232221315 1053995495 /nfs/dbraw/zinc/99/54/95/1053995495.db2.gz WWKQYUVHBGMOBE-UHFFFAOYSA-N 1 2 304.384 4.289 20 0 DIADLO Cc1ccc(Cl)c(O[C@@H]2CCC[N@H+](Cc3cnsc3)C2)c1 ZINC001232227368 1053995967 /nfs/dbraw/zinc/99/59/67/1053995967.db2.gz MTQFDAJHJSWSIY-CQSZACIVSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1ccc(Cl)c(O[C@@H]2CCC[N@@H+](Cc3cnsc3)C2)c1 ZINC001232227368 1053995980 /nfs/dbraw/zinc/99/59/80/1053995980.db2.gz MTQFDAJHJSWSIY-CQSZACIVSA-N 1 2 322.861 4.148 20 0 DIADLO CCOc1cncc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)c1 ZINC000621728271 1054001811 /nfs/dbraw/zinc/00/18/11/1054001811.db2.gz IYAKEMVJRFBHTM-MRXNPFEDSA-N 1 2 302.443 4.125 20 0 DIADLO CCOc1cncc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)c1 ZINC000621728271 1054001824 /nfs/dbraw/zinc/00/18/24/1054001824.db2.gz IYAKEMVJRFBHTM-MRXNPFEDSA-N 1 2 302.443 4.125 20 0 DIADLO CC[C@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)C(C)(C)C ZINC001354918621 1054004334 /nfs/dbraw/zinc/00/43/34/1054004334.db2.gz NPJZIRUWOBKEBT-CYBMUJFWSA-N 1 2 317.408 4.412 20 0 DIADLO COCc1cccc(C[N@H+](C)[C@H](C)c2ccccc2Cl)n1 ZINC001232259680 1054005100 /nfs/dbraw/zinc/00/51/00/1054005100.db2.gz HOJQUNMTKSVADR-CYBMUJFWSA-N 1 2 304.821 4.074 20 0 DIADLO COCc1cccc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)n1 ZINC001232259680 1054005109 /nfs/dbraw/zinc/00/51/09/1054005109.db2.gz HOJQUNMTKSVADR-CYBMUJFWSA-N 1 2 304.821 4.074 20 0 DIADLO CCCC[N@H+](Cc1nc(CCC)no1)[C@@H](C)c1ccc(C)o1 ZINC000621739053 1054007073 /nfs/dbraw/zinc/00/70/73/1054007073.db2.gz CEWPOHASPTYIFC-AWEZNQCLSA-N 1 2 305.422 4.287 20 0 DIADLO CCCC[N@@H+](Cc1nc(CCC)no1)[C@@H](C)c1ccc(C)o1 ZINC000621739053 1054007086 /nfs/dbraw/zinc/00/70/86/1054007086.db2.gz CEWPOHASPTYIFC-AWEZNQCLSA-N 1 2 305.422 4.287 20 0 DIADLO Cc1cc(C)c(NC(=O)Cn2c[nH+]c(C(C)(C)C)c2)c(Cl)c1 ZINC001329722320 1054007147 /nfs/dbraw/zinc/00/71/47/1054007147.db2.gz FAYYYFBJVCTEHU-UHFFFAOYSA-N 1 2 319.836 4.090 20 0 DIADLO Cc1nc(NC[C@@H]2C[C@@H]2C2CCCC2)c(Br)c(C)[nH+]1 ZINC001472904128 1054016533 /nfs/dbraw/zinc/01/65/33/1054016533.db2.gz IZJOYGFILQGOGN-QWHCGFSZSA-N 1 2 324.266 4.094 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3cc(C(C)(C)C)ccc3C2)cs1 ZINC001330068403 1054018621 /nfs/dbraw/zinc/01/86/21/1054018621.db2.gz DPOWYCYQKXULJN-UHFFFAOYSA-N 1 2 300.471 4.307 20 0 DIADLO Cc1nc(C[N@H+]2CCc3cc(C(C)(C)C)ccc3C2)cs1 ZINC001330068403 1054018633 /nfs/dbraw/zinc/01/86/33/1054018633.db2.gz DPOWYCYQKXULJN-UHFFFAOYSA-N 1 2 300.471 4.307 20 0 DIADLO CSc1ccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)cn1 ZINC001232328692 1054019231 /nfs/dbraw/zinc/01/92/31/1054019231.db2.gz LMGQLEXNMZCVMH-INIZCTEOSA-N 1 2 320.408 4.419 20 0 DIADLO CSc1ccc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)cn1 ZINC001232328692 1054019242 /nfs/dbraw/zinc/01/92/42/1054019242.db2.gz LMGQLEXNMZCVMH-INIZCTEOSA-N 1 2 320.408 4.419 20 0 DIADLO CC(C)C[C@H](C(=O)N[C@@H]1CCCC12CCCCC2)n1cc[nH+]c1 ZINC001300770101 1054020980 /nfs/dbraw/zinc/02/09/80/1054020980.db2.gz NQZVGDLZIIESHZ-IAGOWNOFSA-N 1 2 317.477 4.090 20 0 DIADLO C[C@@H](c1ccco1)c1noc([C@H]2CCC[N@@H+]2Cc2ccccc2)n1 ZINC000621795448 1054022206 /nfs/dbraw/zinc/02/22/06/1054022206.db2.gz ISNPQLILRIPLTN-GOEBONIOSA-N 1 2 323.396 4.152 20 0 DIADLO C[C@@H](c1ccco1)c1noc([C@H]2CCC[N@H+]2Cc2ccccc2)n1 ZINC000621795448 1054022217 /nfs/dbraw/zinc/02/22/17/1054022217.db2.gz ISNPQLILRIPLTN-GOEBONIOSA-N 1 2 323.396 4.152 20 0 DIADLO CSc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)cn1 ZINC001232329956 1054022812 /nfs/dbraw/zinc/02/28/12/1054022812.db2.gz JJXLGOPHLGRFKH-INIZCTEOSA-N 1 2 320.408 4.419 20 0 DIADLO CSc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)cn1 ZINC001232329956 1054022827 /nfs/dbraw/zinc/02/28/27/1054022827.db2.gz JJXLGOPHLGRFKH-INIZCTEOSA-N 1 2 320.408 4.419 20 0 DIADLO CCC(=O)c1c(Cl)cccc1N1CCC(c2c[nH]c[nH+]2)CC1 ZINC001330109731 1054026043 /nfs/dbraw/zinc/02/60/43/1054026043.db2.gz QHYILMYJTTYYJN-UHFFFAOYSA-N 1 2 317.820 4.040 20 0 DIADLO COc1cc(C)c(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)cn1 ZINC001232352372 1054028712 /nfs/dbraw/zinc/02/87/12/1054028712.db2.gz LLDXOYACISJJMC-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1cc(C)c(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)cn1 ZINC001232352372 1054028726 /nfs/dbraw/zinc/02/87/26/1054028726.db2.gz LLDXOYACISJJMC-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO CC(C)[N@H+](Cc1ccc(N)nc1)Cc1c(Cl)cccc1Cl ZINC001232369445 1054032008 /nfs/dbraw/zinc/03/20/08/1054032008.db2.gz FBBLHGIDEDBYCO-UHFFFAOYSA-N 1 2 324.255 4.381 20 0 DIADLO CC(C)[N@@H+](Cc1ccc(N)nc1)Cc1c(Cl)cccc1Cl ZINC001232369445 1054032020 /nfs/dbraw/zinc/03/20/20/1054032020.db2.gz FBBLHGIDEDBYCO-UHFFFAOYSA-N 1 2 324.255 4.381 20 0 DIADLO Cc1cccc(C[N@@H+]2CCCC(F)(F)[C@@H](F)C2)c1OC(C)C ZINC001232389702 1054035762 /nfs/dbraw/zinc/03/57/62/1054035762.db2.gz HPKAFEASSRFDJC-HNNXBMFYSA-N 1 2 315.379 4.351 20 0 DIADLO Cc1cccc(C[N@H+]2CCCC(F)(F)[C@@H](F)C2)c1OC(C)C ZINC001232389702 1054035771 /nfs/dbraw/zinc/03/57/71/1054035771.db2.gz HPKAFEASSRFDJC-HNNXBMFYSA-N 1 2 315.379 4.351 20 0 DIADLO Cc1ncc(C[NH+]2CCC(Sc3ccc(Cl)cc3)CC2)[nH]1 ZINC001232465183 1054050024 /nfs/dbraw/zinc/05/00/24/1054050024.db2.gz XSFFPIPRIKROCL-UHFFFAOYSA-N 1 2 321.877 4.128 20 0 DIADLO c1c(C[N@@H+]2CC[C@H]2c2ccccc2)onc1OCc1ccccc1 ZINC001232452317 1054051497 /nfs/dbraw/zinc/05/14/97/1054051497.db2.gz KGPCLTAUXXJMAQ-IBGZPJMESA-N 1 2 320.392 4.201 20 0 DIADLO c1c(C[N@H+]2CC[C@H]2c2ccccc2)onc1OCc1ccccc1 ZINC001232452317 1054051504 /nfs/dbraw/zinc/05/15/04/1054051504.db2.gz KGPCLTAUXXJMAQ-IBGZPJMESA-N 1 2 320.392 4.201 20 0 DIADLO Cc1nc(C[N@@H+]2CCSC[C@@H]2c2cccc3ccccc32)c[nH]1 ZINC001232467157 1054053592 /nfs/dbraw/zinc/05/35/92/1054053592.db2.gz CQMBHANTMSTJGO-LJQANCHMSA-N 1 2 323.465 4.161 20 0 DIADLO Cc1nc(C[N@H+]2CCSC[C@@H]2c2cccc3ccccc32)c[nH]1 ZINC001232467157 1054053604 /nfs/dbraw/zinc/05/36/04/1054053604.db2.gz CQMBHANTMSTJGO-LJQANCHMSA-N 1 2 323.465 4.161 20 0 DIADLO Cc1ncc(C[N@@H+]2CCSC[C@@H]2c2cccc3ccccc32)[nH]1 ZINC001232467157 1054053617 /nfs/dbraw/zinc/05/36/17/1054053617.db2.gz CQMBHANTMSTJGO-LJQANCHMSA-N 1 2 323.465 4.161 20 0 DIADLO Cc1ncc(C[N@H+]2CCSC[C@@H]2c2cccc3ccccc32)[nH]1 ZINC001232467157 1054053633 /nfs/dbraw/zinc/05/36/33/1054053633.db2.gz CQMBHANTMSTJGO-LJQANCHMSA-N 1 2 323.465 4.161 20 0 DIADLO FCc1cccc(C[N@H+](Cc2ccccc2)Cc2ccccn2)n1 ZINC001232536015 1054065937 /nfs/dbraw/zinc/06/59/37/1054065937.db2.gz UJAINLGHNPLYMS-UHFFFAOYSA-N 1 2 321.399 4.149 20 0 DIADLO FCc1cccc(C[N@@H+](Cc2ccccc2)Cc2ccccn2)n1 ZINC001232536015 1054065943 /nfs/dbraw/zinc/06/59/43/1054065943.db2.gz UJAINLGHNPLYMS-UHFFFAOYSA-N 1 2 321.399 4.149 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]C(c2ccccc2)c2ccccc2)c2nccn21 ZINC000293876308 1054072052 /nfs/dbraw/zinc/07/20/52/1054072052.db2.gz FHFQFUSSJZOTIA-MAUKXSAKSA-N 1 2 303.409 4.268 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+][C@@H](COC)c1ccc(CC)o1 ZINC000165302828 1054073614 /nfs/dbraw/zinc/07/36/14/1054073614.db2.gz LNGSSVWQGSZZDT-PBHICJAKSA-N 1 2 317.429 4.279 20 0 DIADLO CCOc1ccnc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1 ZINC001232587891 1054077519 /nfs/dbraw/zinc/07/75/19/1054077519.db2.gz NBDOCBLNYRCPES-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccnc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1 ZINC001232587891 1054077526 /nfs/dbraw/zinc/07/75/26/1054077526.db2.gz NBDOCBLNYRCPES-GOSISDBHSA-N 1 2 318.367 4.096 20 0 DIADLO CO[C@@H](C)c1nc(CNc2cc(C)c3ccccc3[nH+]2)cs1 ZINC001331662240 1054083857 /nfs/dbraw/zinc/08/38/57/1054083857.db2.gz WADPROYZINNLNY-LBPRGKRZSA-N 1 2 313.426 4.319 20 0 DIADLO C[NH2+]c1ccc(NCc2sc(N3CCCCC3)nc2C)cc1 ZINC001331841227 1054091726 /nfs/dbraw/zinc/09/17/26/1054091726.db2.gz TVUAOMGVCSCRSX-UHFFFAOYSA-N 1 2 316.474 4.096 20 0 DIADLO COC[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(Cl)cc1Cl ZINC001232698220 1054101463 /nfs/dbraw/zinc/10/14/63/1054101463.db2.gz KAPRMRABFUGAHY-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO COC[C@@H]1CCCC[N@H+]1Cc1cc(F)c(Cl)cc1Cl ZINC001232698220 1054101474 /nfs/dbraw/zinc/10/14/74/1054101474.db2.gz KAPRMRABFUGAHY-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO C[C@H]1CCC[N@@H+]1Cc1c(F)ccc(Cl)c1Br ZINC001232690742 1054101612 /nfs/dbraw/zinc/10/16/12/1054101612.db2.gz DIQQABRFSTXCBW-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@H]1CCC[N@H+]1Cc1c(F)ccc(Cl)c1Br ZINC001232690742 1054101616 /nfs/dbraw/zinc/10/16/16/1054101616.db2.gz DIQQABRFSTXCBW-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO Cc1c(Cl)nccc1C[N@@H+](CC(=O)c1ccccc1)C(C)C ZINC001232754515 1054115153 /nfs/dbraw/zinc/11/51/53/1054115153.db2.gz DNBHJSGVEDSTQO-UHFFFAOYSA-N 1 2 316.832 4.137 20 0 DIADLO Cc1c(Cl)nccc1C[N@H+](CC(=O)c1ccccc1)C(C)C ZINC001232754515 1054115159 /nfs/dbraw/zinc/11/51/59/1054115159.db2.gz DNBHJSGVEDSTQO-UHFFFAOYSA-N 1 2 316.832 4.137 20 0 DIADLO CC[N@H+](Cc1ccc(CCO)cc1)Cc1c(F)cccc1Cl ZINC001232779339 1054119724 /nfs/dbraw/zinc/11/97/24/1054119724.db2.gz MCNXXRUSNHPMFH-UHFFFAOYSA-N 1 2 321.823 4.036 20 0 DIADLO CC[N@@H+](Cc1ccc(CCO)cc1)Cc1c(F)cccc1Cl ZINC001232779339 1054119727 /nfs/dbraw/zinc/11/97/27/1054119727.db2.gz MCNXXRUSNHPMFH-UHFFFAOYSA-N 1 2 321.823 4.036 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@H]2COCc2ccccc2)c(F)cc1F ZINC001232783152 1054119823 /nfs/dbraw/zinc/11/98/23/1054119823.db2.gz SCGNMSFLLKEATE-KRWDZBQOSA-N 1 2 317.379 4.064 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@H]2COCc2ccccc2)c(F)cc1F ZINC001232783152 1054119831 /nfs/dbraw/zinc/11/98/31/1054119831.db2.gz SCGNMSFLLKEATE-KRWDZBQOSA-N 1 2 317.379 4.064 20 0 DIADLO C[N@H+](Cc1ccc(CCO)cc1)Cc1c(Cl)cccc1Cl ZINC001232777018 1054119905 /nfs/dbraw/zinc/11/99/05/1054119905.db2.gz JOQIMQYJYCYMDN-UHFFFAOYSA-N 1 2 324.251 4.160 20 0 DIADLO C[N@@H+](Cc1ccc(CCO)cc1)Cc1c(Cl)cccc1Cl ZINC001232777018 1054119908 /nfs/dbraw/zinc/11/99/08/1054119908.db2.gz JOQIMQYJYCYMDN-UHFFFAOYSA-N 1 2 324.251 4.160 20 0 DIADLO COc1cc(O)cc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c1 ZINC001232803756 1054125827 /nfs/dbraw/zinc/12/58/27/1054125827.db2.gz PQOHZJDKTWFESB-SFHVURJKSA-N 1 2 319.351 4.016 20 0 DIADLO COc1cc(O)cc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)c1 ZINC001232803756 1054125833 /nfs/dbraw/zinc/12/58/33/1054125833.db2.gz PQOHZJDKTWFESB-SFHVURJKSA-N 1 2 319.351 4.016 20 0 DIADLO CCc1onc(C)c1C[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC001332885024 1054129822 /nfs/dbraw/zinc/12/98/22/1054129822.db2.gz NSIIDJCZFBLTLH-LLVKDONJSA-N 1 2 307.463 4.150 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(Br)co2)Cc2ccccc21 ZINC001232850589 1054130608 /nfs/dbraw/zinc/13/06/08/1054130608.db2.gz SKEFUVBFWKYEHP-NSHDSACASA-N 1 2 306.203 4.161 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(Br)co2)Cc2ccccc21 ZINC001232850589 1054130611 /nfs/dbraw/zinc/13/06/11/1054130611.db2.gz SKEFUVBFWKYEHP-NSHDSACASA-N 1 2 306.203 4.161 20 0 DIADLO CC[N@H+](Cc1cc(Br)co1)Cc1ccccc1F ZINC001232856914 1054131943 /nfs/dbraw/zinc/13/19/43/1054131943.db2.gz IMWYJQDPNQVMPR-UHFFFAOYSA-N 1 2 312.182 4.203 20 0 DIADLO CC[N@@H+](Cc1cc(Br)co1)Cc1ccccc1F ZINC001232856914 1054131952 /nfs/dbraw/zinc/13/19/52/1054131952.db2.gz IMWYJQDPNQVMPR-UHFFFAOYSA-N 1 2 312.182 4.203 20 0 DIADLO CC(C)OC1CC[NH+](Cc2ccc(F)c(F)c2Cl)CC1 ZINC001232875657 1054135918 /nfs/dbraw/zinc/13/59/18/1054135918.db2.gz GXRWAXRYDLKQHN-UHFFFAOYSA-N 1 2 303.780 4.008 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cncc(-c3ccccc3)c2)no1 ZINC001232897814 1054144738 /nfs/dbraw/zinc/14/47/38/1054144738.db2.gz UXVMBMBIYAKHLX-FQEVSTJZSA-N 1 2 319.408 4.382 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cncc(-c3ccccc3)c2)no1 ZINC001232897814 1054144744 /nfs/dbraw/zinc/14/47/44/1054144744.db2.gz UXVMBMBIYAKHLX-FQEVSTJZSA-N 1 2 319.408 4.382 20 0 DIADLO CC1=C(C)C[C@@](C)(C(=O)Nc2cccc(-n3cc[nH+]c3)c2)CC1 ZINC001355482086 1054149322 /nfs/dbraw/zinc/14/93/22/1054149322.db2.gz JAXDDTQTWNGKDZ-IBGZPJMESA-N 1 2 309.413 4.337 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc(F)c(O)c1F ZINC001232935571 1054150335 /nfs/dbraw/zinc/15/03/35/1054150335.db2.gz UCZLVKOFNBWLSQ-OAHLLOKOSA-N 1 2 319.351 4.016 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(OCCC(C)C)c(F)c1 ZINC000848573153 1054156100 /nfs/dbraw/zinc/15/61/00/1054156100.db2.gz RKEKBFNJCSWKES-UHFFFAOYSA-N 1 2 305.397 4.079 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(OCCC(C)C)cc1F ZINC000848575783 1054158421 /nfs/dbraw/zinc/15/84/21/1054158421.db2.gz BANZUARWFCIOCT-UHFFFAOYSA-N 1 2 305.397 4.079 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1nsc3ccccc31)C2 ZINC001333593016 1054161976 /nfs/dbraw/zinc/16/19/76/1054161976.db2.gz RHJSVHMNOSSVSF-UHFFFAOYSA-N 1 2 322.433 4.049 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@H+](Cc1nsc3ccccc31)C2 ZINC001333593016 1054161985 /nfs/dbraw/zinc/16/19/85/1054161985.db2.gz RHJSVHMNOSSVSF-UHFFFAOYSA-N 1 2 322.433 4.049 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232972334 1054163338 /nfs/dbraw/zinc/16/33/38/1054163338.db2.gz NAUHMYVXSPANFU-MRXNPFEDSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1cc(O)c(F)c(F)c1 ZINC001232972334 1054163350 /nfs/dbraw/zinc/16/33/50/1054163350.db2.gz NAUHMYVXSPANFU-MRXNPFEDSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ncc(F)cc1C[N@@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001232990413 1054165791 /nfs/dbraw/zinc/16/57/91/1054165791.db2.gz YMJRITYEONDOQP-QGZVFWFLSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1ncc(F)cc1C[N@H+]1CCC[C@@H]1c1cc(F)ccc1F ZINC001232990413 1054165797 /nfs/dbraw/zinc/16/57/97/1054165797.db2.gz YMJRITYEONDOQP-QGZVFWFLSA-N 1 2 306.331 4.144 20 0 DIADLO Fc1cccc(OC(F)(F)F)c1C[NH2+]Cc1ccc(Cl)o1 ZINC000671189820 1054167745 /nfs/dbraw/zinc/16/77/45/1054167745.db2.gz BRVBBBDXONXAPP-UHFFFAOYSA-N 1 2 323.673 4.261 20 0 DIADLO F[C@H]1C[N@H+](Cc2ccc(OC(F)(F)F)cc2Cl)C[C@@H]2C[C@@H]21 ZINC001232992478 1054168606 /nfs/dbraw/zinc/16/86/06/1054168606.db2.gz USMIGJKZCLWCSU-GAFUQQFSSA-N 1 2 323.717 4.028 20 0 DIADLO F[C@H]1C[N@@H+](Cc2ccc(OC(F)(F)F)cc2Cl)C[C@@H]2C[C@@H]21 ZINC001232992478 1054168608 /nfs/dbraw/zinc/16/86/08/1054168608.db2.gz USMIGJKZCLWCSU-GAFUQQFSSA-N 1 2 323.717 4.028 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1C[C@@H](CC(F)(F)F)O[C@@H](C)C1 ZINC001333741716 1054170470 /nfs/dbraw/zinc/17/04/70/1054170470.db2.gz TVSQGMSPEPWGQB-QWHCGFSZSA-N 1 2 324.346 4.089 20 0 DIADLO CC(C)(C)c1coc(C[NH+]2CCC(OC3CCCCC3)CC2)n1 ZINC001333749670 1054170971 /nfs/dbraw/zinc/17/09/71/1054170971.db2.gz XFEMGPGCNNJSPC-UHFFFAOYSA-N 1 2 320.477 4.286 20 0 DIADLO CCOC(=O)c1ccsc1C[N@H+](Cc1ccccc1)C1CC1 ZINC001233021321 1054173794 /nfs/dbraw/zinc/17/37/94/1054173794.db2.gz HKESIECANBYDCC-UHFFFAOYSA-N 1 2 315.438 4.089 20 0 DIADLO CCOC(=O)c1ccsc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC001233021321 1054173802 /nfs/dbraw/zinc/17/38/02/1054173802.db2.gz HKESIECANBYDCC-UHFFFAOYSA-N 1 2 315.438 4.089 20 0 DIADLO CCOC(=O)c1ccsc1C[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC001233017925 1054174950 /nfs/dbraw/zinc/17/49/50/1054174950.db2.gz LWYGTYLMOLTIAA-ZDUSSCGKSA-N 1 2 315.438 4.044 20 0 DIADLO CCOC(=O)c1ccsc1C[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC001233017925 1054174955 /nfs/dbraw/zinc/17/49/55/1054174955.db2.gz LWYGTYLMOLTIAA-ZDUSSCGKSA-N 1 2 315.438 4.044 20 0 DIADLO CCOC(=O)c1ccsc1C[N@H+](C)Cc1ccc(CC)cc1 ZINC001233022392 1054175637 /nfs/dbraw/zinc/17/56/37/1054175637.db2.gz ZMTAYNFKSMRFQQ-UHFFFAOYSA-N 1 2 317.454 4.119 20 0 DIADLO CCOC(=O)c1ccsc1C[N@@H+](C)Cc1ccc(CC)cc1 ZINC001233022392 1054175641 /nfs/dbraw/zinc/17/56/41/1054175641.db2.gz ZMTAYNFKSMRFQQ-UHFFFAOYSA-N 1 2 317.454 4.119 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)c1ccon1 ZINC000671191449 1054180661 /nfs/dbraw/zinc/18/06/61/1054180661.db2.gz RQJNHKARDPZGRR-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO CCOc1c(Cl)cc(C[N@@H+]2CCC[C@@H](OC)C2)cc1Cl ZINC001233106327 1054186021 /nfs/dbraw/zinc/18/60/21/1054186021.db2.gz XSGGWEZUCIACQB-GFCCVEGCSA-N 1 2 318.244 4.003 20 0 DIADLO CCOc1c(Cl)cc(C[N@H+]2CCC[C@@H](OC)C2)cc1Cl ZINC001233106327 1054186030 /nfs/dbraw/zinc/18/60/30/1054186030.db2.gz XSGGWEZUCIACQB-GFCCVEGCSA-N 1 2 318.244 4.003 20 0 DIADLO Cc1ccc(C)c2nc(Cl)c(C[NH+]3CC(C(F)F)C3)cc12 ZINC001233139091 1054191391 /nfs/dbraw/zinc/19/13/91/1054191391.db2.gz MMTWDQPVWRXOPA-UHFFFAOYSA-N 1 2 310.775 4.202 20 0 DIADLO Cc1ccc(C)c2nc(Cl)c(C[N@@H+]3CCC[C@@H]3CF)cc12 ZINC001233140099 1054191410 /nfs/dbraw/zinc/19/14/10/1054191410.db2.gz XRWIVTOVDJRFLK-CQSZACIVSA-N 1 2 306.812 4.439 20 0 DIADLO Cc1ccc(C)c2nc(Cl)c(C[N@H+]3CCC[C@@H]3CF)cc12 ZINC001233140099 1054191411 /nfs/dbraw/zinc/19/14/11/1054191411.db2.gz XRWIVTOVDJRFLK-CQSZACIVSA-N 1 2 306.812 4.439 20 0 DIADLO CC(C)Oc1ncc(Cl)cc1C[N@H+](C)Cc1cccs1 ZINC001233171968 1054196197 /nfs/dbraw/zinc/19/61/97/1054196197.db2.gz YDKCUESGYZWYNZ-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO CC(C)Oc1ncc(Cl)cc1C[N@@H+](C)Cc1cccs1 ZINC001233171968 1054196206 /nfs/dbraw/zinc/19/62/06/1054196206.db2.gz YDKCUESGYZWYNZ-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1ccnc(Cl)c1Br ZINC001233178406 1054198069 /nfs/dbraw/zinc/19/80/69/1054198069.db2.gz SHJOLJLTDGWWTF-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccc(Oc3ccc(F)cc3)c2)CCC1=O ZINC001233207952 1054200375 /nfs/dbraw/zinc/20/03/75/1054200375.db2.gz TVRDHSLPLDUHAI-CQSZACIVSA-N 1 2 313.372 4.029 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccc(Oc3ccc(F)cc3)c2)CCC1=O ZINC001233207952 1054200384 /nfs/dbraw/zinc/20/03/84/1054200384.db2.gz TVRDHSLPLDUHAI-CQSZACIVSA-N 1 2 313.372 4.029 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N[C@H](CC(C)C)c3ccccc3)ccn12 ZINC001355721290 1054205981 /nfs/dbraw/zinc/20/59/81/1054205981.db2.gz RUKQBDYWTSFOKU-GOSISDBHSA-N 1 2 321.424 4.160 20 0 DIADLO CC(C)C[N@H+](Cc1csc(C(C)C)n1)Cc1ccccn1 ZINC001335036816 1054206267 /nfs/dbraw/zinc/20/62/67/1054206267.db2.gz WTOYAKNYYZOXEK-UHFFFAOYSA-N 1 2 303.475 4.320 20 0 DIADLO CC(C)C[N@@H+](Cc1csc(C(C)C)n1)Cc1ccccn1 ZINC001335036816 1054206279 /nfs/dbraw/zinc/20/62/79/1054206279.db2.gz WTOYAKNYYZOXEK-UHFFFAOYSA-N 1 2 303.475 4.320 20 0 DIADLO Cc1ccc(C[N@@H+]2CCn3cccc3[C@H]2c2ccccc2)cc1O ZINC001233230741 1054210933 /nfs/dbraw/zinc/21/09/33/1054210933.db2.gz LPMNDPXWLQLMQA-OAQYLSRUSA-N 1 2 318.420 4.107 20 0 DIADLO Cc1ccc(C[N@H+]2CCn3cccc3[C@H]2c2ccccc2)cc1O ZINC001233230741 1054210942 /nfs/dbraw/zinc/21/09/42/1054210942.db2.gz LPMNDPXWLQLMQA-OAQYLSRUSA-N 1 2 318.420 4.107 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3c(cccc3C(F)(F)F)C2)cc1O ZINC001233235608 1054213033 /nfs/dbraw/zinc/21/30/33/1054213033.db2.gz ZWBCMPCUHYNXLW-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3c(cccc3C(F)(F)F)C2)cc1O ZINC001233235608 1054213038 /nfs/dbraw/zinc/21/30/38/1054213038.db2.gz ZWBCMPCUHYNXLW-UHFFFAOYSA-N 1 2 321.342 4.278 20 0 DIADLO Cc1nc(Cl)c(C[N@H+]2CCC[C@@H](C)C2)cc1Br ZINC001233464839 1054279300 /nfs/dbraw/zinc/27/93/00/1054279300.db2.gz IPOBPIKQLDAEEA-SECBINFHSA-N 1 2 317.658 4.038 20 0 DIADLO Cc1nc(Cl)c(C[N@@H+]2CCC[C@@H](C)C2)cc1Br ZINC001233464839 1054279314 /nfs/dbraw/zinc/27/93/14/1054279314.db2.gz IPOBPIKQLDAEEA-SECBINFHSA-N 1 2 317.658 4.038 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2cccnc2)sn1 ZINC001233311671 1054225969 /nfs/dbraw/zinc/22/59/69/1054225969.db2.gz CNSSLUNXVONBPE-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)sn1 ZINC001233311671 1054225980 /nfs/dbraw/zinc/22/59/80/1054225980.db2.gz CNSSLUNXVONBPE-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Clc1ccc(C[NH+]2CC3(CC(OCc4ccccc4)C3)C2)o1 ZINC001233316756 1054228183 /nfs/dbraw/zinc/22/81/83/1054228183.db2.gz AORDTXFKNVXMDU-UHFFFAOYSA-N 1 2 317.816 4.114 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1c(Cl)cccc1SC ZINC001233352905 1054248754 /nfs/dbraw/zinc/24/87/54/1054248754.db2.gz YXLUIJGLRKMMOK-UHFFFAOYSA-N 1 2 306.862 4.479 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1c(Cl)cccc1SC ZINC001233352905 1054248768 /nfs/dbraw/zinc/24/87/68/1054248768.db2.gz YXLUIJGLRKMMOK-UHFFFAOYSA-N 1 2 306.862 4.479 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2sc3ccccc3c2Cl)o1 ZINC001233367413 1054253179 /nfs/dbraw/zinc/25/31/79/1054253179.db2.gz GXWQUKACNUWFNN-UHFFFAOYSA-N 1 2 306.818 4.483 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2sc3ccccc3c2Cl)o1 ZINC001233367413 1054253197 /nfs/dbraw/zinc/25/31/97/1054253197.db2.gz GXWQUKACNUWFNN-UHFFFAOYSA-N 1 2 306.818 4.483 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(COc3ccccc3)n2)C1(C)C ZINC001337033104 1054253510 /nfs/dbraw/zinc/25/35/10/1054253510.db2.gz OBAHCAZGHXIAJQ-UHFFFAOYSA-N 1 2 316.470 4.343 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(COc3ccccc3)n2)C1(C)C ZINC001337033104 1054253523 /nfs/dbraw/zinc/25/35/23/1054253523.db2.gz OBAHCAZGHXIAJQ-UHFFFAOYSA-N 1 2 316.470 4.343 20 0 DIADLO C[C@]1(CO)CCC[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC001337033264 1054253819 /nfs/dbraw/zinc/25/38/19/1054253819.db2.gz UEHFBRYQYGEVKJ-AWEZNQCLSA-N 1 2 322.663 4.241 20 0 DIADLO C[C@]1(CO)CCC[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)C1 ZINC001337033264 1054253828 /nfs/dbraw/zinc/25/38/28/1054253828.db2.gz UEHFBRYQYGEVKJ-AWEZNQCLSA-N 1 2 322.663 4.241 20 0 DIADLO Nc1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001233383081 1054255732 /nfs/dbraw/zinc/25/57/32/1054255732.db2.gz UVXSIVNNHURWLS-QGZVFWFLSA-N 1 2 324.321 4.162 20 0 DIADLO Nc1cc(F)c(F)cc1C[N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001233383081 1054255745 /nfs/dbraw/zinc/25/57/45/1054255745.db2.gz UVXSIVNNHURWLS-QGZVFWFLSA-N 1 2 324.321 4.162 20 0 DIADLO COc1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)c(Cl)c1O ZINC001233400897 1054260930 /nfs/dbraw/zinc/26/09/30/1054260930.db2.gz CWLIQZHJBQRGMC-AWEZNQCLSA-N 1 2 303.789 4.001 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1ccc(OC)c(O)c1Cl ZINC001233401061 1054263110 /nfs/dbraw/zinc/26/31/10/1054263110.db2.gz KJAVICYYJYEZAI-UHFFFAOYSA-N 1 2 311.834 4.138 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1ccc(OC)c(O)c1Cl ZINC001233401061 1054263123 /nfs/dbraw/zinc/26/31/23/1054263123.db2.gz KJAVICYYJYEZAI-UHFFFAOYSA-N 1 2 311.834 4.138 20 0 DIADLO Clc1ncnc(Cl)c1C[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC001233409798 1054263264 /nfs/dbraw/zinc/26/32/64/1054263264.db2.gz NCFYPKAZMVBVID-CYBMUJFWSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1ncnc(Cl)c1C[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC001233409798 1054263274 /nfs/dbraw/zinc/26/32/74/1054263274.db2.gz NCFYPKAZMVBVID-CYBMUJFWSA-N 1 2 322.239 4.163 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cc(Br)ncc2Cl)[C@H]1C ZINC001233427153 1054268983 /nfs/dbraw/zinc/26/89/83/1054268983.db2.gz LGYDZSPKJAAWIY-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cc(Br)ncc2Cl)[C@H]1C ZINC001233427153 1054268998 /nfs/dbraw/zinc/26/89/98/1054268998.db2.gz LGYDZSPKJAAWIY-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO Fc1ccccc1[C@H]1CCC[N@@H+]1Cc1c[nH]c(Br)c1 ZINC001233437328 1054273936 /nfs/dbraw/zinc/27/39/36/1054273936.db2.gz VOVDCTRSFACLSW-CQSZACIVSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1ccccc1[C@H]1CCC[N@H+]1Cc1c[nH]c(Br)c1 ZINC001233437328 1054273947 /nfs/dbraw/zinc/27/39/47/1054273947.db2.gz VOVDCTRSFACLSW-CQSZACIVSA-N 1 2 323.209 4.253 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@H](C)c3ccc(F)cc3C)ccn12 ZINC001439465942 1054274143 /nfs/dbraw/zinc/27/41/43/1054274143.db2.gz NHUCKJZTENZURB-CYBMUJFWSA-N 1 2 312.344 4.008 20 0 DIADLO Fc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c[nH]c(Br)c1 ZINC001233437327 1054274187 /nfs/dbraw/zinc/27/41/87/1054274187.db2.gz VOVDCTRSFACLSW-AWEZNQCLSA-N 1 2 323.209 4.253 20 0 DIADLO Fc1ccccc1[C@@H]1CCC[N@H+]1Cc1c[nH]c(Br)c1 ZINC001233437327 1054274195 /nfs/dbraw/zinc/27/41/95/1054274195.db2.gz VOVDCTRSFACLSW-AWEZNQCLSA-N 1 2 323.209 4.253 20 0 DIADLO CC[C@H]1c2ccsc2CCN1C(=O)c1c(C)cc(C)[nH+]c1C ZINC001356110825 1054283325 /nfs/dbraw/zinc/28/33/25/1054283325.db2.gz FFWPTERSTXSPBZ-HNNXBMFYSA-N 1 2 314.454 4.218 20 0 DIADLO CC[N@H+](Cc1cn2c(cccc2Cl)n1)Cc1ccccc1F ZINC001233600150 1054307572 /nfs/dbraw/zinc/30/75/72/1054307572.db2.gz VKCLZKWZBYZKNG-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO CC[N@@H+](Cc1cn2c(cccc2Cl)n1)Cc1ccccc1F ZINC001233600150 1054307586 /nfs/dbraw/zinc/30/75/86/1054307586.db2.gz VKCLZKWZBYZKNG-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO CC[C@@H](C)CCC(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001339299769 1054334525 /nfs/dbraw/zinc/33/45/25/1054334525.db2.gz FVPUZHIQCDYNHW-HZPDHXFCSA-N 1 2 319.493 4.170 20 0 DIADLO Cc1cc(C[N@@H+]2Cc3cnc(-c4ccccc4)nc3C2)sc1C ZINC001233700624 1054336075 /nfs/dbraw/zinc/33/60/75/1054336075.db2.gz PTHGGIPAVDUYKZ-UHFFFAOYSA-N 1 2 321.449 4.338 20 0 DIADLO Cc1cc(C[N@H+]2Cc3cnc(-c4ccccc4)nc3C2)sc1C ZINC001233700624 1054336087 /nfs/dbraw/zinc/33/60/87/1054336087.db2.gz PTHGGIPAVDUYKZ-UHFFFAOYSA-N 1 2 321.449 4.338 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)C3(C(C)(F)F)CC3)cc2)[nH+]c1C ZINC001339870748 1054350819 /nfs/dbraw/zinc/35/08/19/1054350819.db2.gz LWJKOJQDWXJSJY-UHFFFAOYSA-N 1 2 319.355 4.067 20 0 DIADLO C[C@H]([NH2+]Cc1coc(C(C)(C)C)n1)c1ccc2ncsc2c1 ZINC001341157255 1054378764 /nfs/dbraw/zinc/37/87/64/1054378764.db2.gz XEEDNLIYVWJWFM-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO Cc1cc(N[C@H](C)c2ccc([S@](C)=O)cc2)[nH+]c2ccccc12 ZINC001341155263 1054378825 /nfs/dbraw/zinc/37/88/25/1054378825.db2.gz NFSVEDGBUGDJQW-FATZIPQQSA-N 1 2 324.449 4.454 20 0 DIADLO CC(C)(C)c1noc(C[NH2+]C2(c3ccc(F)cc3)CCCC2)n1 ZINC000171693931 1054382338 /nfs/dbraw/zinc/38/23/38/1054382338.db2.gz BPMDWSXRQSDERR-UHFFFAOYSA-N 1 2 317.408 4.065 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1cscc1C(F)F ZINC001441174485 1054384885 /nfs/dbraw/zinc/38/48/85/1054384885.db2.gz FFTDLQWZSDZVOO-UHFFFAOYSA-N 1 2 319.336 4.124 20 0 DIADLO Clc1ccc2ccc(NCCc3cn4ccccc4[nH+]3)nc2c1 ZINC000479829444 1054388677 /nfs/dbraw/zinc/38/86/77/1054388677.db2.gz MXNUGUSLRHISGA-UHFFFAOYSA-N 1 2 322.799 4.191 20 0 DIADLO CC(C)[C@H](C)C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000171923323 1054396989 /nfs/dbraw/zinc/39/69/89/1054396989.db2.gz JHCJAOJTCGWVLI-AWEZNQCLSA-N 1 2 311.429 4.117 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccc(F)c(F)c2)nc2ccccc12 ZINC000171982057 1054400628 /nfs/dbraw/zinc/40/06/28/1054400628.db2.gz VPUXBZYQWLHZBR-LLVKDONJSA-N 1 2 313.351 4.067 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C/c2ccnc3ccccc23)c(C)[nH+]1 ZINC000172044192 1054406977 /nfs/dbraw/zinc/40/69/77/1054406977.db2.gz SVLLEDVSXQIJDK-CMDGGOBGSA-N 1 2 317.392 4.207 20 0 DIADLO Cc1cc(NC[C@H]2SCCc3ccccc32)nc(C2CC2)[nH+]1 ZINC000487664530 1054412659 /nfs/dbraw/zinc/41/26/59/1054412659.db2.gz GGRSYIBULQGFRK-MRXNPFEDSA-N 1 2 311.454 4.105 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(-c2ccccc2)no1)c1ccc(F)cc1 ZINC001342229785 1054419335 /nfs/dbraw/zinc/41/93/35/1054419335.db2.gz ZWMGWCNHPJOSHP-INIZCTEOSA-N 1 2 311.360 4.117 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCc3ncoc3C(C)C)c2c1 ZINC001342482321 1054422472 /nfs/dbraw/zinc/42/24/72/1054422472.db2.gz FSJKIMJUMNKVRC-UHFFFAOYSA-N 1 2 312.369 4.242 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@H+](C)Cc2ccc(C)cc2C)cs1 ZINC000172317453 1054422699 /nfs/dbraw/zinc/42/26/99/1054422699.db2.gz SJBAHFUFQDMAEX-HNNXBMFYSA-N 1 2 318.486 4.489 20 0 DIADLO CCO[C@@H](C)c1nc(C[N@@H+](C)Cc2ccc(C)cc2C)cs1 ZINC000172317453 1054422708 /nfs/dbraw/zinc/42/27/08/1054422708.db2.gz SJBAHFUFQDMAEX-HNNXBMFYSA-N 1 2 318.486 4.489 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CCS[C@H](C)[C@H]2c2ccccc2)n1 ZINC000172409323 1054428837 /nfs/dbraw/zinc/42/88/37/1054428837.db2.gz ISTBXQBZRGWLTQ-QAPCUYQASA-N 1 2 315.486 4.143 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CCS[C@H](C)[C@H]2c2ccccc2)n1 ZINC000172409323 1054428842 /nfs/dbraw/zinc/42/88/42/1054428842.db2.gz ISTBXQBZRGWLTQ-QAPCUYQASA-N 1 2 315.486 4.143 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]Cc2cc(C(C)(C)C)oc2C)cs1 ZINC001342977125 1054434806 /nfs/dbraw/zinc/43/48/06/1054434806.db2.gz CAHKSYPIWYPKCT-GFCCVEGCSA-N 1 2 322.474 4.339 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@@H]1CCC[C@H]2CCCC[C@H]21 ZINC001357288496 1054451800 /nfs/dbraw/zinc/45/18/00/1054451800.db2.gz AWUIVCRVPHBQPT-ATZDWAIDSA-N 1 2 323.440 4.417 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)c(N(C)C)[nH+]1 ZINC001357396886 1054470640 /nfs/dbraw/zinc/47/06/40/1054470640.db2.gz PPKGTYBIUXQQJS-UHFFFAOYSA-N 1 2 324.211 4.015 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)Nc1ccc(C)[nH+]c1N(C)C ZINC001357393602 1054470931 /nfs/dbraw/zinc/47/09/31/1054470931.db2.gz CEKHUKOHQMPHKA-INIZCTEOSA-N 1 2 317.477 4.391 20 0 DIADLO CCCC[C@@H](C(=O)OC)[NH+]1CCC(=Cc2ccccc2F)CC1 ZINC001473276718 1054476924 /nfs/dbraw/zinc/47/69/24/1054476924.db2.gz LAHIEEHPIKBFEH-SFHVURJKSA-N 1 2 319.420 4.037 20 0 DIADLO Fc1cncc(CNc2[nH+]c3ccccc3n2C2CCCC2)c1 ZINC000489788125 1054502539 /nfs/dbraw/zinc/50/25/39/1054502539.db2.gz HATXDITYKYDZET-UHFFFAOYSA-N 1 2 310.376 4.298 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CC[N@H+](Cc2cnc(Cl)s2)C1 ZINC000185331770 1054523058 /nfs/dbraw/zinc/52/30/58/1054523058.db2.gz IWBBFRATLJRGPT-SECBINFHSA-N 1 2 314.788 4.064 20 0 DIADLO Fc1cccc(F)c1[C@@H]1CC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC000185331770 1054523072 /nfs/dbraw/zinc/52/30/72/1054523072.db2.gz IWBBFRATLJRGPT-SECBINFHSA-N 1 2 314.788 4.064 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1ccc(F)c(Cl)c1 ZINC000763826615 1054529522 /nfs/dbraw/zinc/52/95/22/1054529522.db2.gz UEEZLUSSZGELSA-UHFFFAOYSA-N 1 2 305.205 4.221 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1ccc(F)c(Cl)c1 ZINC000763826615 1054529534 /nfs/dbraw/zinc/52/95/34/1054529534.db2.gz UEEZLUSSZGELSA-UHFFFAOYSA-N 1 2 305.205 4.221 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3cc(C(C)C)no3)c2)[nH+]c1C ZINC000072782889 1054533816 /nfs/dbraw/zinc/53/38/16/1054533816.db2.gz TVUKMJQZFYSARU-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1csc(-c2ccc(C)o2)n1 ZINC000623121455 1054535404 /nfs/dbraw/zinc/53/54/04/1054535404.db2.gz XMPQZRFTZMMHFI-UHFFFAOYSA-N 1 2 318.364 4.486 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1csc(-c2ccc(C)o2)n1 ZINC000623121455 1054535418 /nfs/dbraw/zinc/53/54/18/1054535418.db2.gz XMPQZRFTZMMHFI-UHFFFAOYSA-N 1 2 318.364 4.486 20 0 DIADLO O=C(CCCn1cc[nH+]c1)Nc1ccc2oc3ccccc3c2c1 ZINC000623238981 1054548975 /nfs/dbraw/zinc/54/89/75/1054548975.db2.gz NJVYKVMURFDYOU-UHFFFAOYSA-N 1 2 319.364 4.201 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)n1 ZINC000192825132 1054580372 /nfs/dbraw/zinc/58/03/72/1054580372.db2.gz BMBULHIHYNZTAD-KRWDZBQOSA-N 1 2 319.836 4.162 20 0 DIADLO CC1(F)CC[NH+](Cc2c(F)cc(F)cc2Br)CC1 ZINC001234734607 1054584285 /nfs/dbraw/zinc/58/42/85/1054584285.db2.gz OWEVHRCERRJPFR-UHFFFAOYSA-N 1 2 322.168 4.051 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3cc(Cl)cc(Cl)c3)ccn12 ZINC001347800874 1054584322 /nfs/dbraw/zinc/58/43/22/1054584322.db2.gz UDDZZQWLNPWZMR-UHFFFAOYSA-N 1 2 321.163 4.169 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2csc(C(F)(F)F)c2)cs1 ZINC000623409489 1054588089 /nfs/dbraw/zinc/58/80/89/1054588089.db2.gz DSGPIUHZKOESDX-ZETCQYMHSA-N 1 2 306.378 4.383 20 0 DIADLO CC(C)[C@]1(C)C[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001358056037 1054590003 /nfs/dbraw/zinc/59/00/03/1054590003.db2.gz KLJLCFPQZTYXGY-GUYCJALGSA-N 1 2 317.820 4.146 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3cccc4ccccc43)ccn12 ZINC001347996089 1054603318 /nfs/dbraw/zinc/60/33/18/1054603318.db2.gz UINANDLSXRZOCN-UHFFFAOYSA-N 1 2 301.349 4.048 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2-c2ccccc2C)cc[nH+]1 ZINC001358136373 1054606887 /nfs/dbraw/zinc/60/68/87/1054606887.db2.gz HJEYPEQVGRGMCI-UHFFFAOYSA-N 1 2 302.377 4.040 20 0 DIADLO Cc1cc(Cl)c(NC(=O)[C@@H](CC(C)C)n2cc[nH+]c2)cc1C ZINC001450026605 1054635905 /nfs/dbraw/zinc/63/59/05/1054635905.db2.gz YXJZOCAVQVVNGB-MRXNPFEDSA-N 1 2 319.836 4.379 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](Cc1ccccc1)Cc1ncc(F)cn1 ZINC001235008693 1054640090 /nfs/dbraw/zinc/64/00/90/1054640090.db2.gz YTOWJNRNEWEEGZ-INIZCTEOSA-N 1 2 321.399 4.379 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1)Cc1ncc(F)cn1 ZINC001235008693 1054640100 /nfs/dbraw/zinc/64/01/00/1054640100.db2.gz YTOWJNRNEWEEGZ-INIZCTEOSA-N 1 2 321.399 4.379 20 0 DIADLO Cn1c(Cl)cnc1C[NH+]1CCC(c2ccc(Cl)cc2)CC1 ZINC000185786969 1054654726 /nfs/dbraw/zinc/65/47/26/1054654726.db2.gz DXJPTHWKALUJJE-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO Cc1cn2cc(NC(=O)CCC(C)(C)c3ccccc3)ccc2[nH+]1 ZINC001358363267 1054665505 /nfs/dbraw/zinc/66/55/05/1054665505.db2.gz MLVBNMGLMDXKKG-UHFFFAOYSA-N 1 2 321.424 4.339 20 0 DIADLO CC(=O)C1CC[NH+](Cc2c(Cl)cc(C)cc2Cl)CC1 ZINC001235169466 1054669517 /nfs/dbraw/zinc/66/95/17/1054669517.db2.gz SAGXIBNHYYKOJL-UHFFFAOYSA-N 1 2 300.229 4.103 20 0 DIADLO CCC[C@@H]1CCCC[C@H]1CNC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001451457010 1054679428 /nfs/dbraw/zinc/67/94/28/1054679428.db2.gz JOJCJGZFEHMUJG-FGTMMUONSA-N 1 2 319.493 4.193 20 0 DIADLO Cc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccc(C)nc2)c(F)c1 ZINC001235199741 1054684573 /nfs/dbraw/zinc/68/45/73/1054684573.db2.gz VXXPIMWOIFQMNK-GOSISDBHSA-N 1 2 302.368 4.314 20 0 DIADLO Cc1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccc(C)nc2)c(F)c1 ZINC001235199741 1054684577 /nfs/dbraw/zinc/68/45/77/1054684577.db2.gz VXXPIMWOIFQMNK-GOSISDBHSA-N 1 2 302.368 4.314 20 0 DIADLO FC(F)(F)c1ccc(Cl)nc1C[N@@H+]1CCCCC12CC2 ZINC001235234114 1054687733 /nfs/dbraw/zinc/68/77/33/1054687733.db2.gz SXMVJEDVPPHMSD-UHFFFAOYSA-N 1 2 304.743 4.272 20 0 DIADLO FC(F)(F)c1ccc(Cl)nc1C[N@H+]1CCCCC12CC2 ZINC001235234114 1054687735 /nfs/dbraw/zinc/68/77/35/1054687735.db2.gz SXMVJEDVPPHMSD-UHFFFAOYSA-N 1 2 304.743 4.272 20 0 DIADLO C[N@H+](Cc1cc2cccc(F)c2[nH]1)Cc1nc2ccccc2o1 ZINC001235248533 1054691649 /nfs/dbraw/zinc/69/16/49/1054691649.db2.gz HZADBXGGUOSSPI-UHFFFAOYSA-N 1 2 309.344 4.080 20 0 DIADLO C[N@@H+](Cc1cc2cccc(F)c2[nH]1)Cc1nc2ccccc2o1 ZINC001235248533 1054691655 /nfs/dbraw/zinc/69/16/55/1054691655.db2.gz HZADBXGGUOSSPI-UHFFFAOYSA-N 1 2 309.344 4.080 20 0 DIADLO C[C@H]1C(=O)CC[N@H+](Cc2cc3cccc(F)c3[nH]2)C12CCCC2 ZINC001235252085 1054692619 /nfs/dbraw/zinc/69/26/19/1054692619.db2.gz YIWONTKIVNZHOU-ZDUSSCGKSA-N 1 2 314.404 4.031 20 0 DIADLO C[C@H]1C(=O)CC[N@@H+](Cc2cc3cccc(F)c3[nH]2)C12CCCC2 ZINC001235252085 1054692623 /nfs/dbraw/zinc/69/26/23/1054692623.db2.gz YIWONTKIVNZHOU-ZDUSSCGKSA-N 1 2 314.404 4.031 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3ncc(-c4cccs4)o3)CC2)c1 ZINC000179700315 1054696399 /nfs/dbraw/zinc/69/63/99/1054696399.db2.gz WYHMZPBZTAMBPA-UHFFFAOYSA-N 1 2 314.385 4.321 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3coc(-c4cccs4)n3)CC2)c1 ZINC000179686864 1054697145 /nfs/dbraw/zinc/69/71/45/1054697145.db2.gz JEYJWDUTZBGIJG-UHFFFAOYSA-N 1 2 314.385 4.321 20 0 DIADLO Cc1cnc(F)c(C[N@@H+]2CCCC[C@H]2c2ccccc2F)c1 ZINC001235336452 1054703819 /nfs/dbraw/zinc/70/38/19/1054703819.db2.gz ZSFQICIFDDOZNB-KRWDZBQOSA-N 1 2 302.368 4.395 20 0 DIADLO Cc1cnc(F)c(C[N@H+]2CCCC[C@H]2c2ccccc2F)c1 ZINC001235336452 1054703836 /nfs/dbraw/zinc/70/38/36/1054703836.db2.gz ZSFQICIFDDOZNB-KRWDZBQOSA-N 1 2 302.368 4.395 20 0 DIADLO Fc1cc(C[NH+]2CCC3(CCCC3)CC2)c(F)c(F)c1F ZINC001235346721 1054704660 /nfs/dbraw/zinc/70/46/60/1054704660.db2.gz TXAOSDKYHPYYDO-UHFFFAOYSA-N 1 2 301.327 4.399 20 0 DIADLO Cc1cc(NCCNc2cccc3ccccc32)nc(C2CC2)[nH+]1 ZINC000604756671 1054708934 /nfs/dbraw/zinc/70/89/34/1054708934.db2.gz QVAOBAIATGIQBE-UHFFFAOYSA-N 1 2 318.424 4.340 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2csc(Nc3ccccc3)n2)[C@H]1C ZINC000605335700 1054709601 /nfs/dbraw/zinc/70/96/01/1054709601.db2.gz PUVOWCDJEXBKRD-QWHCGFSZSA-N 1 2 319.499 4.213 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2csc(Nc3ccccc3)n2)[C@H]1C ZINC000605335700 1054709611 /nfs/dbraw/zinc/70/96/11/1054709611.db2.gz PUVOWCDJEXBKRD-QWHCGFSZSA-N 1 2 319.499 4.213 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](C)c2cc(F)ccc2OC)cs1 ZINC000179915527 1054715287 /nfs/dbraw/zinc/71/52/87/1054715287.db2.gz FMBHREZZPJHGOD-NSHDSACASA-N 1 2 308.422 4.094 20 0 DIADLO COc1cc(C[N@@H+]2CCSc3ccccc3C2)cc(F)c1F ZINC001235441688 1054720596 /nfs/dbraw/zinc/72/05/96/1054720596.db2.gz QEQIKVIJVUEOKK-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO COc1cc(C[N@H+]2CCSc3ccccc3C2)cc(F)c1F ZINC001235441688 1054720608 /nfs/dbraw/zinc/72/06/08/1054720608.db2.gz QEQIKVIJVUEOKK-UHFFFAOYSA-N 1 2 321.392 4.081 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccc(OC(F)F)cc1 ZINC000921505850 1054726530 /nfs/dbraw/zinc/72/65/30/1054726530.db2.gz CUSFUTALJVGAIK-NSHDSACASA-N 1 2 324.371 4.424 20 0 DIADLO CN(Cc1cccc2[nH+]ccn21)[C@H](c1ccccc1)C(F)(F)F ZINC000180038112 1054728746 /nfs/dbraw/zinc/72/87/46/1054728746.db2.gz FYFJVOOCLMQFPP-MRXNPFEDSA-N 1 2 319.330 4.070 20 0 DIADLO C[C@@H]1C[NH+](Cc2csc(Nc3ccccc3)n2)C[C@@H](C)S1 ZINC000608502137 1054732842 /nfs/dbraw/zinc/73/28/42/1054732842.db2.gz ACHGZPHSWMWCSX-CHWSQXEVSA-N 1 2 319.499 4.213 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2cncc(F)c2Cl)cc1 ZINC001235501231 1054735220 /nfs/dbraw/zinc/73/52/20/1054735220.db2.gz WTKSLGZVAIKPTI-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2cncc(F)c2Cl)cc1 ZINC001235501231 1054735232 /nfs/dbraw/zinc/73/52/32/1054735232.db2.gz WTKSLGZVAIKPTI-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nccn2-c2ccccc2)cc1C ZINC001473549429 1054741662 /nfs/dbraw/zinc/74/16/62/1054741662.db2.gz DUFZTEFCXLLHAQ-UHFFFAOYSA-N 1 2 305.425 4.121 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nccn2-c2ccccc2)cc1C ZINC001473549429 1054741676 /nfs/dbraw/zinc/74/16/76/1054741676.db2.gz DUFZTEFCXLLHAQ-UHFFFAOYSA-N 1 2 305.425 4.121 20 0 DIADLO COC1CC[NH+](Cc2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC001235589932 1054746582 /nfs/dbraw/zinc/74/65/82/1054746582.db2.gz GAMDZWYGIFTJKW-UHFFFAOYSA-N 1 2 308.636 4.258 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@@]23CCOC3)cc(Cl)c1Cl ZINC001235599098 1054749794 /nfs/dbraw/zinc/74/97/94/1054749794.db2.gz VDWFSAONFPWKDT-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@@]23CCOC3)cc(Cl)c1Cl ZINC001235599098 1054749806 /nfs/dbraw/zinc/74/98/06/1054749806.db2.gz VDWFSAONFPWKDT-AWEZNQCLSA-N 1 2 320.647 4.402 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)[C@@H]1CO ZINC001235594210 1054750456 /nfs/dbraw/zinc/75/04/56/1054750456.db2.gz XRDUTXABBPRWSA-TVQRCGJNSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)[C@@H]1CO ZINC001235594210 1054750471 /nfs/dbraw/zinc/75/04/71/1054750471.db2.gz XRDUTXABBPRWSA-TVQRCGJNSA-N 1 2 322.663 4.240 20 0 DIADLO CC[C@@H](CC(F)F)c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000351204860 1054754489 /nfs/dbraw/zinc/75/44/89/1054754489.db2.gz GCWCOKWCKCKHLR-NSHDSACASA-N 1 2 318.327 4.071 20 0 DIADLO C[N@H+](Cc1cccn1C(=O)OC(C)(C)C)Cc1ccc(F)cc1 ZINC001235626826 1054756718 /nfs/dbraw/zinc/75/67/18/1054756718.db2.gz VCPHDXJEELDQRT-UHFFFAOYSA-N 1 2 318.392 4.042 20 0 DIADLO C[N@@H+](Cc1cccn1C(=O)OC(C)(C)C)Cc1ccc(F)cc1 ZINC001235626826 1054756737 /nfs/dbraw/zinc/75/67/37/1054756737.db2.gz VCPHDXJEELDQRT-UHFFFAOYSA-N 1 2 318.392 4.042 20 0 DIADLO CC(=O)c1ccc(N(C)Cc2ccc(-n3cc[nH+]c3)cc2C)cc1 ZINC001473750308 1054758577 /nfs/dbraw/zinc/75/85/77/1054758577.db2.gz MIZDSVAFWONCMB-UHFFFAOYSA-N 1 2 319.408 4.020 20 0 DIADLO Nc1ccc(Cl)nc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC001235672916 1054767510 /nfs/dbraw/zinc/76/75/10/1054767510.db2.gz AYXPUAAJCPCCFQ-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccc(Cl)nc1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC001235672916 1054767524 /nfs/dbraw/zinc/76/75/24/1054767524.db2.gz AYXPUAAJCPCCFQ-HNNXBMFYSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccc(F)c(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)c1F ZINC001235677821 1054769077 /nfs/dbraw/zinc/76/90/77/1054769077.db2.gz IYIGMCLYCUNWKD-QGZVFWFLSA-N 1 2 320.358 4.413 20 0 DIADLO Nc1ccc(F)c(C[N@H+]2CCCC[C@@H]2c2ccccc2F)c1F ZINC001235677821 1054769092 /nfs/dbraw/zinc/76/90/92/1054769092.db2.gz IYIGMCLYCUNWKD-QGZVFWFLSA-N 1 2 320.358 4.413 20 0 DIADLO C[C@]1(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)C[C@@H]1c1ccccc1 ZINC001349613749 1054775011 /nfs/dbraw/zinc/77/50/11/1054775011.db2.gz BFZKDOFXMNDDED-QUCCMNQESA-N 1 2 317.392 4.005 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@H](c4ccccc4)C3)[nH]c2c1 ZINC001235691679 1054778302 /nfs/dbraw/zinc/77/83/02/1054778302.db2.gz IWVBDVJHKNKQOR-HNNXBMFYSA-N 1 2 309.388 4.082 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@H](c4ccccc4)C3)[nH]c2c1 ZINC001235691679 1054778320 /nfs/dbraw/zinc/77/83/20/1054778320.db2.gz IWVBDVJHKNKQOR-HNNXBMFYSA-N 1 2 309.388 4.082 20 0 DIADLO COc1ccc(CC[C@H](C)Nc2cc(C)[nH+]c(C3CC3)n2)cc1 ZINC000523876045 1054779773 /nfs/dbraw/zinc/77/97/73/1054779773.db2.gz LQVHOKAPIBBOJB-ZDUSSCGKSA-N 1 2 311.429 4.104 20 0 DIADLO Fc1ccc2nc(C[N@@H+]3CCC[C@H](c4ccccc4)CC3)[nH]c2c1 ZINC001235695834 1054781430 /nfs/dbraw/zinc/78/14/30/1054781430.db2.gz SMJLHQNJVJZQQW-INIZCTEOSA-N 1 2 323.415 4.472 20 0 DIADLO Fc1ccc2nc(C[N@H+]3CCC[C@H](c4ccccc4)CC3)[nH]c2c1 ZINC001235695834 1054781444 /nfs/dbraw/zinc/78/14/44/1054781444.db2.gz SMJLHQNJVJZQQW-INIZCTEOSA-N 1 2 323.415 4.472 20 0 DIADLO Nc1nc(Cl)ccc1C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC001235693753 1054781682 /nfs/dbraw/zinc/78/16/82/1054781682.db2.gz FPDBSQCTAWQAML-CQSZACIVSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nc(Cl)ccc1C[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC001235693753 1054781696 /nfs/dbraw/zinc/78/16/96/1054781696.db2.gz FPDBSQCTAWQAML-CQSZACIVSA-N 1 2 322.239 4.308 20 0 DIADLO Fc1ccc2nc(C[N@H+](Cc3ccccc3)C3CCC3)[nH]c2c1 ZINC001235700239 1054781876 /nfs/dbraw/zinc/78/18/76/1054781876.db2.gz IWJQWUMGHOUILI-UHFFFAOYSA-N 1 2 309.388 4.257 20 0 DIADLO Fc1ccc2nc(C[N@@H+](Cc3ccccc3)C3CCC3)[nH]c2c1 ZINC001235700239 1054781890 /nfs/dbraw/zinc/78/18/90/1054781890.db2.gz IWJQWUMGHOUILI-UHFFFAOYSA-N 1 2 309.388 4.257 20 0 DIADLO Nc1nccc(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC001235693859 1054782163 /nfs/dbraw/zinc/78/21/63/1054782163.db2.gz HYQCWQGXCQSIRB-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1nccc(Cl)c1C[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC001235693859 1054782179 /nfs/dbraw/zinc/78/21/79/1054782179.db2.gz HYQCWQGXCQSIRB-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Cc1cc(CNc2cnn([C@H](C)C3CC3)c2)c2c([nH+]1)CCCC2 ZINC001474121864 1054785148 /nfs/dbraw/zinc/78/51/48/1054785148.db2.gz LSMNQJMENSTVLC-CQSZACIVSA-N 1 2 310.445 4.048 20 0 DIADLO CCC/C(C)=C\C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001349682077 1054785306 /nfs/dbraw/zinc/78/53/06/1054785306.db2.gz LAILHFFWPQVASS-QZFKAFNDSA-N 1 2 317.477 4.091 20 0 DIADLO c1nc2c(s1)CCC[C@H]2[NH2+][C@@H](c1ccccc1)c1ccncc1 ZINC000623874993 1054796277 /nfs/dbraw/zinc/79/62/77/1054796277.db2.gz VJOSJCMSMPEOGF-AEFFLSMTSA-N 1 2 321.449 4.295 20 0 DIADLO CCOc1cc(C[N@H+](C)Cc2cccc(F)c2F)ccc1F ZINC001235806093 1054809754 /nfs/dbraw/zinc/80/97/54/1054809754.db2.gz LIQYDAQWCBMYIM-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CCOc1cc(C[N@@H+](C)Cc2cccc(F)c2F)ccc1F ZINC001235806093 1054809765 /nfs/dbraw/zinc/80/97/65/1054809765.db2.gz LIQYDAQWCBMYIM-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO Fc1cccnc1C[NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1 ZINC001474471918 1054813602 /nfs/dbraw/zinc/81/36/02/1054813602.db2.gz BBTFPRYRYJHXMT-UHFFFAOYSA-N 1 2 311.187 4.306 20 0 DIADLO CC(C)c1cc(N[C@H]2CCOC3(CCC3)C2)nc(C(C)C)[nH+]1 ZINC000534142258 1054816033 /nfs/dbraw/zinc/81/60/33/1054816033.db2.gz DTIROSYDJHEZIJ-AWEZNQCLSA-N 1 2 303.450 4.237 20 0 DIADLO CC[C@H](Nc1cc(C(C)C)[nH+]c(C(C)C)n1)C1CCOCC1 ZINC000534881039 1054816338 /nfs/dbraw/zinc/81/63/38/1054816338.db2.gz XHORCYKUFRYBFM-HNNXBMFYSA-N 1 2 305.466 4.341 20 0 DIADLO CC(C)c1cc(N[C@@H](C)COCC(F)(F)F)nc(C(C)C)[nH+]1 ZINC000535592677 1054820383 /nfs/dbraw/zinc/82/03/83/1054820383.db2.gz FCIMKWSAXTZTQK-NSHDSACASA-N 1 2 319.371 4.103 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc3sc(C)nc3c1)C2 ZINC001235866926 1054826774 /nfs/dbraw/zinc/82/67/74/1054826774.db2.gz SMILWMVFVVHQDU-UHFFFAOYSA-N 1 2 310.422 4.129 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc3sc(C)nc3c1)C2 ZINC001235866926 1054826778 /nfs/dbraw/zinc/82/67/78/1054826778.db2.gz SMILWMVFVVHQDU-UHFFFAOYSA-N 1 2 310.422 4.129 20 0 DIADLO Cc1csc([C@@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)n1 ZINC000623954522 1054834913 /nfs/dbraw/zinc/83/49/13/1054834913.db2.gz QWUBDGCFPOQGOP-CYBMUJFWSA-N 1 2 302.447 4.010 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccc(F)c(CO)c2F)c1 ZINC001235896738 1054835595 /nfs/dbraw/zinc/83/55/95/1054835595.db2.gz MUBUZLTUYJDFED-UHFFFAOYSA-N 1 2 305.368 4.279 20 0 DIADLO COc1c(C[NH2+][C@H](C)c2nc(C)cs2)oc2ccccc21 ZINC000623968716 1054839821 /nfs/dbraw/zinc/83/98/21/1054839821.db2.gz LIUFKFHJDBKHQK-LLVKDONJSA-N 1 2 302.399 4.057 20 0 DIADLO Fc1cc(C2CC2)ccc1C[NH2+][C@H]1CCCc2scnc21 ZINC000623987611 1054841857 /nfs/dbraw/zinc/84/18/57/1054841857.db2.gz HWTCTULZFJNOOU-HNNXBMFYSA-N 1 2 302.418 4.327 20 0 DIADLO Clc1ccc(-c2ccccc2C[NH+]2CCOCC2)c(Cl)c1 ZINC001235962306 1054871943 /nfs/dbraw/zinc/87/19/43/1054871943.db2.gz IFPMNYPSDAXOEI-UHFFFAOYSA-N 1 2 322.235 4.493 20 0 DIADLO Cc1nccnc1[C@H](C)[NH2+]Cc1c(Cl)oc2ccccc21 ZINC000624109146 1054879976 /nfs/dbraw/zinc/87/99/76/1054879976.db2.gz OAWAGWPSVRMUAH-NSHDSACASA-N 1 2 301.777 4.035 20 0 DIADLO CCc1nnc(C[NH2+]Cc2ccc(-c3ccccc3)cc2)s1 ZINC000353153477 1054901276 /nfs/dbraw/zinc/90/12/76/1054901276.db2.gz NPUWZBVWBXSGKD-UHFFFAOYSA-N 1 2 309.438 4.057 20 0 DIADLO CC(C)c1ccc(-c2noc(C[NH2+][C@@H](C)c3cccnc3)n2)cc1 ZINC000181373117 1054911827 /nfs/dbraw/zinc/91/18/27/1054911827.db2.gz IKXFCVPUZPRFHJ-AWEZNQCLSA-N 1 2 322.412 4.106 20 0 DIADLO CC[C@@H](NC(=O)c1ccn2c(C)c[nH+]c2c1)c1cc(C)ccc1C ZINC001535395311 1054921878 /nfs/dbraw/zinc/92/18/78/1054921878.db2.gz CHFKLVJOLAMPDI-GOSISDBHSA-N 1 2 321.424 4.141 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1ccn(C(C)C)n1)c1ccc(F)cc1F ZINC000181652833 1054927103 /nfs/dbraw/zinc/92/71/03/1054927103.db2.gz HBWZNQMYXRDSNQ-QGZVFWFLSA-N 1 2 307.388 4.229 20 0 DIADLO CCC[C@H]([NH2+]Cc1cn2ccsc2n1)c1ccc(F)cc1F ZINC000181681947 1054928882 /nfs/dbraw/zinc/92/88/82/1054928882.db2.gz LHISAPINKHNRKJ-HNNXBMFYSA-N 1 2 321.396 4.305 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)o1 ZINC000181814816 1054939193 /nfs/dbraw/zinc/93/91/93/1054939193.db2.gz JRYCSIWCLDCOBI-ZDUSSCGKSA-N 1 2 309.369 4.021 20 0 DIADLO Cc1cc(Cl)c(C[N@@H+]2CCc3cc(N)ccc3C2)c(Cl)c1 ZINC001236105017 1054950438 /nfs/dbraw/zinc/95/04/38/1054950438.db2.gz FJWIULPXGYWNNQ-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO Cc1cc(Cl)c(C[N@H+]2CCc3cc(N)ccc3C2)c(Cl)c1 ZINC001236105017 1054950447 /nfs/dbraw/zinc/95/04/47/1054950447.db2.gz FJWIULPXGYWNNQ-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](C)c2ccc(OC)c(F)c2)cs1 ZINC000182006756 1054953779 /nfs/dbraw/zinc/95/37/79/1054953779.db2.gz JQLKDQAYEFQUAG-GFCCVEGCSA-N 1 2 322.449 4.484 20 0 DIADLO CC(C)[N@H+](Cc1ccnc(N)c1)Cc1c(Cl)cccc1Cl ZINC001236111335 1054954538 /nfs/dbraw/zinc/95/45/38/1054954538.db2.gz KHSHTGLSDNFDSH-UHFFFAOYSA-N 1 2 324.255 4.381 20 0 DIADLO CC(C)[N@@H+](Cc1ccnc(N)c1)Cc1c(Cl)cccc1Cl ZINC001236111335 1054954554 /nfs/dbraw/zinc/95/45/54/1054954554.db2.gz KHSHTGLSDNFDSH-UHFFFAOYSA-N 1 2 324.255 4.381 20 0 DIADLO CCSc1ccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)no2)cc1 ZINC000182131429 1054963864 /nfs/dbraw/zinc/96/38/64/1054963864.db2.gz JDHCTXSHIHXUCY-LBPRGKRZSA-N 1 2 319.474 4.330 20 0 DIADLO CC[C@H]([NH2+]Cc1coc(-c2cccs2)n1)c1c(C)noc1C ZINC000182403336 1054984484 /nfs/dbraw/zinc/98/44/84/1054984484.db2.gz YBGLLQOTTBNGOE-ZDUSSCGKSA-N 1 2 317.414 4.249 20 0 DIADLO CC[C@@H](C)c1ccc(C(=O)NC[C@@H]2c3ccccc3C[N@H+]2C)cc1 ZINC001535620601 1054991882 /nfs/dbraw/zinc/99/18/82/1054991882.db2.gz TVWGKSMAPVHLKB-FOIQADDNSA-N 1 2 322.452 4.117 20 0 DIADLO CC[C@@H](C)c1ccc(C(=O)NC[C@@H]2c3ccccc3C[N@@H+]2C)cc1 ZINC001535620601 1054991894 /nfs/dbraw/zinc/99/18/94/1054991894.db2.gz TVWGKSMAPVHLKB-FOIQADDNSA-N 1 2 322.452 4.117 20 0 DIADLO CC[N@H+](Cc1cccc(Cl)c1)Cc1c(F)ccc(N)c1F ZINC001236193467 1054993844 /nfs/dbraw/zinc/99/38/44/1054993844.db2.gz KZQAEWVWKREGTC-UHFFFAOYSA-N 1 2 310.775 4.223 20 0 DIADLO CC[N@@H+](Cc1cccc(Cl)c1)Cc1c(F)ccc(N)c1F ZINC001236193467 1054993852 /nfs/dbraw/zinc/99/38/52/1054993852.db2.gz KZQAEWVWKREGTC-UHFFFAOYSA-N 1 2 310.775 4.223 20 0 DIADLO COc1cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc(C)c1F ZINC001236208155 1054999470 /nfs/dbraw/zinc/99/94/70/1054999470.db2.gz WSIQJYWXGJLUNN-UHFFFAOYSA-N 1 2 300.308 4.135 20 0 DIADLO CCC[C@H](C)C[NH2+][C@@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000182681365 1055004525 /nfs/dbraw/zinc/00/45/25/1055004525.db2.gz FYAIFMOFFNVYTB-XHDPSFHLSA-N 1 2 307.825 4.147 20 0 DIADLO FC(F)(F)c1cc(C[NH2+][C@H]2CCCc3scnc32)cs1 ZINC000624261072 1055010095 /nfs/dbraw/zinc/01/00/95/1055010095.db2.gz HGQIYLHTZURXTL-VIFPVBQESA-N 1 2 318.389 4.391 20 0 DIADLO CC(C)Cn1cc(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)cn1 ZINC000183050068 1055026218 /nfs/dbraw/zinc/02/62/18/1055026218.db2.gz RFSUQTHPSMMJFG-CYBMUJFWSA-N 1 2 307.388 4.010 20 0 DIADLO CC(C)Cn1cc(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)cn1 ZINC000183050068 1055026232 /nfs/dbraw/zinc/02/62/32/1055026232.db2.gz RFSUQTHPSMMJFG-CYBMUJFWSA-N 1 2 307.388 4.010 20 0 DIADLO c1ccc2c(c1)OCCC[C@@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000183147977 1055032397 /nfs/dbraw/zinc/03/23/97/1055032397.db2.gz OWRWOBNBLZONMU-KRWDZBQOSA-N 1 2 309.413 4.008 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](c2ccccc2C)C(C)C)no1 ZINC000183219442 1055035697 /nfs/dbraw/zinc/03/56/97/1055035697.db2.gz WJSNFLARDUTHTC-SFHVURJKSA-N 1 2 301.434 4.208 20 0 DIADLO CC(C)C(=O)Nc1ccc(-c2ccccc2Cn2cc[nH+]c2)cc1 ZINC001236267508 1055045873 /nfs/dbraw/zinc/04/58/73/1055045873.db2.gz WNUHWADLXXLSDO-UHFFFAOYSA-N 1 2 319.408 4.193 20 0 DIADLO Cc1cc(C)c(CNC(=O)C=C2CCC(C(C)(C)C)CC2)c[nH+]1 ZINC001536110547 1055048769 /nfs/dbraw/zinc/04/87/69/1055048769.db2.gz XUVRMJIUMJFNKZ-UHFFFAOYSA-N 1 2 314.473 4.477 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2ccncc2)c(Br)c1 ZINC000183716620 1055055289 /nfs/dbraw/zinc/05/52/89/1055055289.db2.gz WKEWYQSMPDLQAE-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)c2ccncc2)c(Br)c1 ZINC000183716620 1055055301 /nfs/dbraw/zinc/05/53/01/1055055301.db2.gz WKEWYQSMPDLQAE-CYBMUJFWSA-N 1 2 319.246 4.346 20 0 DIADLO CCc1noc(CC)c1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000183707553 1055055339 /nfs/dbraw/zinc/05/53/39/1055055339.db2.gz GXRZRLSUBFNJHL-LJQANCHMSA-N 1 2 310.397 4.272 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H]3CCC[C@@H]3c3ccccc3)ccc2[nH+]1 ZINC001536223069 1055061535 /nfs/dbraw/zinc/06/15/35/1055061535.db2.gz IWHMZWDQHPMZFC-QZTJIDSGSA-N 1 2 319.408 4.165 20 0 DIADLO CN(C)c1cc(-c2ccc(NC(=O)c3ccccc3)cc2)cc[nH+]1 ZINC001236335040 1055062867 /nfs/dbraw/zinc/06/28/67/1055062867.db2.gz XBWZARLHAPCUEG-UHFFFAOYSA-N 1 2 317.392 4.067 20 0 DIADLO Cc1ccc(C[N@@H+]2CCc3c(N)cccc3C2)c(Cl)c1Cl ZINC001236365671 1055074031 /nfs/dbraw/zinc/07/40/31/1055074031.db2.gz QLKTYUZYKZVMCX-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO Cc1ccc(C[N@H+]2CCc3c(N)cccc3C2)c(Cl)c1Cl ZINC001236365671 1055074040 /nfs/dbraw/zinc/07/40/40/1055074040.db2.gz QLKTYUZYKZVMCX-UHFFFAOYSA-N 1 2 321.251 4.442 20 0 DIADLO C[C@@H]([NH2+]Cc1ccncc1Cl)c1nc(C(C)(C)C)cs1 ZINC000184459893 1055075976 /nfs/dbraw/zinc/07/59/76/1055075976.db2.gz JMVWNIXTDVZUGH-SNVBAGLBSA-N 1 2 309.866 4.340 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c2ccccc2n1 ZINC000185159485 1055089264 /nfs/dbraw/zinc/08/92/64/1055089264.db2.gz QEBNWTGJMYAYMD-ZDUSSCGKSA-N 1 2 324.428 4.075 20 0 DIADLO CCCCn1c(SC(CC)CC)nnc1[C@@H](CC)[NH+](C)C ZINC000185380626 1055091476 /nfs/dbraw/zinc/09/14/76/1055091476.db2.gz OIFMUAHSDARIBO-CQSZACIVSA-N 1 2 312.527 4.372 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c(C)s1 ZINC000193133547 1055098788 /nfs/dbraw/zinc/09/87/88/1055098788.db2.gz GDGXFLGKJJEKRR-MNOVXSKESA-N 1 2 307.463 4.457 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(Cl)c(OC(C)C)c1 ZINC001236412402 1055102314 /nfs/dbraw/zinc/10/23/14/1055102314.db2.gz TXIYWLNTPQABNI-UHFFFAOYSA-N 1 2 316.788 4.451 20 0 DIADLO COc1nc(C(C)C)ccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001236443242 1055114916 /nfs/dbraw/zinc/11/49/16/1055114916.db2.gz BNTXQVHPUMWKRM-UHFFFAOYSA-N 1 2 307.397 4.125 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1ccc(Cl)cc1 ZINC000194371228 1055122160 /nfs/dbraw/zinc/12/21/60/1055122160.db2.gz BSDHICRHYHJIOL-CYBMUJFWSA-N 1 2 307.825 4.261 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C(C)(C)C)no1)c1ccc(Cl)cc1 ZINC000194371214 1055122298 /nfs/dbraw/zinc/12/22/98/1055122298.db2.gz BSDHICRHYHJIOL-ZDUSSCGKSA-N 1 2 307.825 4.261 20 0 DIADLO CCCOc1ccc(Cl)cc1-c1ccn2cc(N)[nH+]c2c1 ZINC001236453796 1055122485 /nfs/dbraw/zinc/12/24/85/1055122485.db2.gz VHTLNWXJULIQDY-UHFFFAOYSA-N 1 2 301.777 4.026 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1nc(-c2ccccc2)c[nH]1 ZINC000194424943 1055123937 /nfs/dbraw/zinc/12/39/37/1055123937.db2.gz LIRQCKAIHFPQMA-UHFFFAOYSA-N 1 2 315.779 4.159 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)c(C)[nH+]1 ZINC001536587107 1055133943 /nfs/dbraw/zinc/13/39/43/1055133943.db2.gz DXPRAHCYLSFBDK-HNNXBMFYSA-N 1 2 322.452 4.377 20 0 DIADLO CCOc1ncc(Cl)cc1-c1ccccc1Cn1cc[nH+]c1 ZINC001236495579 1055147114 /nfs/dbraw/zinc/14/71/14/1055147114.db2.gz QFQKIHRHUVBABO-UHFFFAOYSA-N 1 2 313.788 4.046 20 0 DIADLO CCSc1ccc(CNC(=O)c2c(C)cc(C)[nH+]c2C)cc1 ZINC001536852971 1055185924 /nfs/dbraw/zinc/18/59/24/1055185924.db2.gz LWRXPKVGJZCPBP-UHFFFAOYSA-N 1 2 314.454 4.049 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2c(Br)ccnc2Cl)[C@@H]1C ZINC001236598867 1055201482 /nfs/dbraw/zinc/20/14/82/1055201482.db2.gz RTQLYTBDHVOICO-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2c(Br)ccnc2Cl)[C@@H]1C ZINC001236598867 1055201491 /nfs/dbraw/zinc/20/14/91/1055201491.db2.gz RTQLYTBDHVOICO-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1nc(C)c(C[N@@H+]2CCSC[C@@H]2c2cccc(Cl)c2)o1 ZINC001236594274 1055202704 /nfs/dbraw/zinc/20/27/04/1055202704.db2.gz IXAAVWBICIQDBJ-OAHLLOKOSA-N 1 2 322.861 4.235 20 0 DIADLO Cc1nc(C)c(C[N@H+]2CCSC[C@@H]2c2cccc(Cl)c2)o1 ZINC001236594274 1055202714 /nfs/dbraw/zinc/20/27/14/1055202714.db2.gz IXAAVWBICIQDBJ-OAHLLOKOSA-N 1 2 322.861 4.235 20 0 DIADLO Cc1c(Br)cccc1C[NH+]1Cc2ccccc2C1 ZINC001236611521 1055204417 /nfs/dbraw/zinc/20/44/17/1055204417.db2.gz YCKPPLIXCIJYDW-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO F[C@H]1CCC[N@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)CC1 ZINC001236618983 1055205890 /nfs/dbraw/zinc/20/58/90/1055205890.db2.gz JYCKBAMCAAEUJB-JTQLQIEISA-N 1 2 310.722 4.078 20 0 DIADLO F[C@H]1CCC[N@@H+](Cc2cnc(Cl)c(C(F)(F)F)c2)CC1 ZINC001236618983 1055205897 /nfs/dbraw/zinc/20/58/97/1055205897.db2.gz JYCKBAMCAAEUJB-JTQLQIEISA-N 1 2 310.722 4.078 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC23CCCC3)cnc1Cl ZINC001236629949 1055206199 /nfs/dbraw/zinc/20/61/99/1055206199.db2.gz UJYGBSGXCUPPOR-UHFFFAOYSA-N 1 2 304.743 4.272 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC23CCCC3)cnc1Cl ZINC001236629949 1055206204 /nfs/dbraw/zinc/20/62/04/1055206204.db2.gz UJYGBSGXCUPPOR-UHFFFAOYSA-N 1 2 304.743 4.272 20 0 DIADLO COC[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)c(F)c(Cl)c1 ZINC001236651838 1055212056 /nfs/dbraw/zinc/21/20/56/1055212056.db2.gz CJKRZOHPXMUQSH-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO COC[C@@H]1CCCC[N@H+]1Cc1cc(Cl)c(F)c(Cl)c1 ZINC001236651838 1055212063 /nfs/dbraw/zinc/21/20/63/1055212063.db2.gz CJKRZOHPXMUQSH-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)cc(C)n2)cn1 ZINC001236648653 1055212976 /nfs/dbraw/zinc/21/29/76/1055212976.db2.gz VVACLBJKFDSDKK-QGZVFWFLSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc(Cl)cc(C)n2)cn1 ZINC001236648653 1055212979 /nfs/dbraw/zinc/21/29/79/1055212979.db2.gz VVACLBJKFDSDKK-QGZVFWFLSA-N 1 2 301.821 4.084 20 0 DIADLO CC(C)O[C@H]1CC[N@H+](Cc2cc(Cl)c(F)c(Cl)c2)C1 ZINC001236659742 1055213919 /nfs/dbraw/zinc/21/39/19/1055213919.db2.gz QZOSFOZQOCFJLH-NSHDSACASA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@H]1CC[N@@H+](Cc2cc(Cl)c(F)c(Cl)c2)C1 ZINC001236659742 1055213935 /nfs/dbraw/zinc/21/39/35/1055213935.db2.gz QZOSFOZQOCFJLH-NSHDSACASA-N 1 2 306.208 4.132 20 0 DIADLO Fc1c(Cl)cc(C[N@@H+]2CC[C@]3(C2)CCCCO3)cc1Cl ZINC001236654082 1055214686 /nfs/dbraw/zinc/21/46/86/1055214686.db2.gz UGFZZZFOPUCSRE-HNNXBMFYSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1c(Cl)cc(C[N@H+]2CC[C@]3(C2)CCCCO3)cc1Cl ZINC001236654082 1055214694 /nfs/dbraw/zinc/21/46/94/1055214694.db2.gz UGFZZZFOPUCSRE-HNNXBMFYSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1c(Cl)cc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)cc1Cl ZINC001236661475 1055217837 /nfs/dbraw/zinc/21/78/37/1055217837.db2.gz JYJLPHTUVHOBDK-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1c(Cl)cc(C[N@H+]2CC[C@]3(CC3(F)F)C2)cc1Cl ZINC001236661475 1055217847 /nfs/dbraw/zinc/21/78/47/1055217847.db2.gz JYJLPHTUVHOBDK-LBPRGKRZSA-N 1 2 310.146 4.364 20 0 DIADLO COc1cc2ccccc2cc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC001236679532 1055226154 /nfs/dbraw/zinc/22/61/54/1055226154.db2.gz KEHYOWYPXFPFMM-OAHLLOKOSA-N 1 2 306.409 4.227 20 0 DIADLO COc1cc2ccccc2cc1C[N@H+]1CCn2cccc2[C@H]1C ZINC001236679532 1055226166 /nfs/dbraw/zinc/22/61/66/1055226166.db2.gz KEHYOWYPXFPFMM-OAHLLOKOSA-N 1 2 306.409 4.227 20 0 DIADLO COC(=O)c1cccc2c1C[N@H+](Cc1cccc3sccc31)C2 ZINC001236691110 1055231671 /nfs/dbraw/zinc/23/16/71/1055231671.db2.gz YHUZWLSSWRRIRK-UHFFFAOYSA-N 1 2 323.417 4.204 20 0 DIADLO COC(=O)c1cccc2c1C[N@@H+](Cc1cccc3sccc31)C2 ZINC001236691110 1055231685 /nfs/dbraw/zinc/23/16/85/1055231685.db2.gz YHUZWLSSWRRIRK-UHFFFAOYSA-N 1 2 323.417 4.204 20 0 DIADLO Cc1c(F)ccc(C[N@@H+]2CCc3c(O)cccc3C2)c1Cl ZINC001236708071 1055237076 /nfs/dbraw/zinc/23/70/76/1055237076.db2.gz MHIUICWWPNWQDX-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Cc1c(F)ccc(C[N@H+]2CCc3c(O)cccc3C2)c1Cl ZINC001236708071 1055237088 /nfs/dbraw/zinc/23/70/88/1055237088.db2.gz MHIUICWWPNWQDX-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Cc1c(F)ccc(C[N@@H+]2CCc3cc(O)ccc3C2)c1Cl ZINC001236708927 1055237621 /nfs/dbraw/zinc/23/76/21/1055237621.db2.gz TVRBHDZBQKJMJP-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Cc1c(F)ccc(C[N@H+]2CCc3cc(O)ccc3C2)c1Cl ZINC001236708927 1055237640 /nfs/dbraw/zinc/23/76/40/1055237640.db2.gz TVRBHDZBQKJMJP-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Cc1ccc(NC(=O)NCC[C@@H](C)CC(C)(C)C)c(N(C)C)[nH+]1 ZINC001562530493 1055243528 /nfs/dbraw/zinc/24/35/28/1055243528.db2.gz HNRSXKOCUYQXGK-CYBMUJFWSA-N 1 2 320.481 4.040 20 0 DIADLO CC1(C)CCN(C(=O)Nc2ccn3cc[nH+]c3c2)CC(C)(C)C1 ZINC001562742409 1055278789 /nfs/dbraw/zinc/27/87/89/1055278789.db2.gz JGLOPEDCWIHFBP-UHFFFAOYSA-N 1 2 314.433 4.014 20 0 DIADLO CCCCC[C@@H](NC(=O)Nc1ccn2cc[nH+]c2c1)C(C)(C)C ZINC001562742857 1055279486 /nfs/dbraw/zinc/27/94/86/1055279486.db2.gz YBGSOUMAAIETFR-OAHLLOKOSA-N 1 2 316.449 4.451 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1cc(OC)c(F)cc1F ZINC001236832142 1055285851 /nfs/dbraw/zinc/28/58/51/1055285851.db2.gz SRRCWLLACKVYDL-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1cc(OC)c(F)cc1F ZINC001236832142 1055285860 /nfs/dbraw/zinc/28/58/60/1055285860.db2.gz SRRCWLLACKVYDL-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CCOc1cncc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)c1 ZINC001236840287 1055288869 /nfs/dbraw/zinc/28/88/69/1055288869.db2.gz LBPRMYDDFGAVLA-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cncc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)c1 ZINC001236840287 1055288880 /nfs/dbraw/zinc/28/88/80/1055288880.db2.gz LBPRMYDDFGAVLA-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1nc2ccccc2cc1Cl ZINC001236869592 1055300262 /nfs/dbraw/zinc/30/02/62/1055300262.db2.gz FUXSGAVAQIMMHI-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1nc2ccccc2cc1Cl ZINC001236869592 1055300280 /nfs/dbraw/zinc/30/02/80/1055300280.db2.gz FUXSGAVAQIMMHI-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1nc2ccccc2cc1Cl ZINC001236876048 1055303572 /nfs/dbraw/zinc/30/35/72/1055303572.db2.gz UWPBETMXDQUCOF-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1nc2ccccc2cc1Cl ZINC001236876048 1055303586 /nfs/dbraw/zinc/30/35/86/1055303586.db2.gz UWPBETMXDQUCOF-UHFFFAOYSA-N 1 2 311.816 4.305 20 0 DIADLO Clc1cc(C[NH+]2Cc3ccccc3C2)ccc1-n1ccnc1 ZINC001236904763 1055309680 /nfs/dbraw/zinc/30/96/80/1055309680.db2.gz VFJFMSYGKNQHEM-UHFFFAOYSA-N 1 2 309.800 4.042 20 0 DIADLO Cc1cc(NC(=O)Cc2cc(Cl)cc3ccccc32)c(C)c[nH+]1 ZINC001537540384 1055354296 /nfs/dbraw/zinc/35/42/96/1055354296.db2.gz QTFBSPSMYQCKMR-UHFFFAOYSA-N 1 2 324.811 4.108 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N[C@@H](c3cccc(C)c3)C(C)C)ccn12 ZINC001587756429 1055358534 /nfs/dbraw/zinc/35/85/34/1055358534.db2.gz DVVFFGMIXIXZAR-LJQANCHMSA-N 1 2 321.424 4.078 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2nc(C(C)(C)C)co2)C2CC2)cc1 ZINC000921511976 1055373393 /nfs/dbraw/zinc/37/33/93/1055373393.db2.gz GKQFHHBVGVQCKU-GOSISDBHSA-N 1 2 314.429 4.222 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)c1ccc(Oc2ccccc2)cc1 ZINC001537603875 1055377741 /nfs/dbraw/zinc/37/77/41/1055377741.db2.gz MZUKVSGUTQTGHR-UHFFFAOYSA-N 1 2 318.376 4.165 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2ccnc3c(Cl)cccc23)C[C@H]1F ZINC001237151725 1055387725 /nfs/dbraw/zinc/38/77/25/1055387725.db2.gz ZTSCOVLQKBUZCG-GDBMZVCRSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2ccnc3c(Cl)cccc23)C[C@H]1F ZINC001237151725 1055387737 /nfs/dbraw/zinc/38/77/37/1055387737.db2.gz ZTSCOVLQKBUZCG-GDBMZVCRSA-N 1 2 310.775 4.160 20 0 DIADLO Cc1cc(NC(=O)c2cccc(Oc3ccccc3)c2)cc[nH+]1 ZINC000010163102 1055414827 /nfs/dbraw/zinc/41/48/27/1055414827.db2.gz SKCXIGNFRXSNNF-UHFFFAOYSA-N 1 2 304.349 4.435 20 0 DIADLO COc1cc(C[N@@H+]2CCCC(F)(F)[C@H](F)C2)ccc1C(F)F ZINC001237277575 1055416004 /nfs/dbraw/zinc/41/60/04/1055416004.db2.gz QAXFZXXNHMRDMU-CYBMUJFWSA-N 1 2 323.305 4.202 20 0 DIADLO COc1cc(C[N@H+]2CCCC(F)(F)[C@H](F)C2)ccc1C(F)F ZINC001237277575 1055416005 /nfs/dbraw/zinc/41/60/05/1055416005.db2.gz QAXFZXXNHMRDMU-CYBMUJFWSA-N 1 2 323.305 4.202 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cccc(C(F)(F)F)c3)cc2[nH+]1 ZINC000010895990 1055420240 /nfs/dbraw/zinc/42/02/40/1055420240.db2.gz OQJYITBVAHAECG-UHFFFAOYSA-N 1 2 319.286 4.142 20 0 DIADLO Fc1ccccc1C1CC[NH+](Cc2cnc(Cl)c(F)c2)CC1 ZINC001237409053 1055449964 /nfs/dbraw/zinc/44/99/64/1055449964.db2.gz BRIXBSJJUURNRA-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C=Cc3ccc4[nH]ccc4c3)cc2[nH+]1 ZINC000765564074 1055463742 /nfs/dbraw/zinc/46/37/42/1055463742.db2.gz MLHZCFASPSZMOY-XVNBXDOJSA-N 1 2 316.364 4.005 20 0 DIADLO CCCCC[C@@H](C)NC(=O)C[N@H+](CC)Cc1ccccc1Cl ZINC001588283176 1055464195 /nfs/dbraw/zinc/46/41/95/1055464195.db2.gz PSHYCSHSQFXTFQ-OAHLLOKOSA-N 1 2 324.896 4.247 20 0 DIADLO CCCCC[C@@H](C)NC(=O)C[N@@H+](CC)Cc1ccccc1Cl ZINC001588283176 1055464202 /nfs/dbraw/zinc/46/42/02/1055464202.db2.gz PSHYCSHSQFXTFQ-OAHLLOKOSA-N 1 2 324.896 4.247 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2cccc(-c3ccccc3)n2)C[C@@H]1F ZINC001237543739 1055472910 /nfs/dbraw/zinc/47/29/10/1055472910.db2.gz ZLCXKOJGVVRKGY-ZWKOTPCHSA-N 1 2 302.368 4.021 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2cccc(-c3ccccc3)n2)C[C@@H]1F ZINC001237543739 1055472917 /nfs/dbraw/zinc/47/29/17/1055472917.db2.gz ZLCXKOJGVVRKGY-ZWKOTPCHSA-N 1 2 302.368 4.021 20 0 DIADLO Clc1ccc(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)nc1 ZINC001620846130 1055474777 /nfs/dbraw/zinc/47/47/77/1055474777.db2.gz ZWAKFNHILGMHNH-UHFFFAOYSA-N 1 2 319.195 4.186 20 0 DIADLO CN(CCO)c1ccc([NH2+]CC2CCC(C(C)(C)C)CC2)cc1 ZINC001620851934 1055479758 /nfs/dbraw/zinc/47/97/58/1055479758.db2.gz SAKNSYQLNINHIT-UHFFFAOYSA-N 1 2 318.505 4.380 20 0 DIADLO c1cc2c(cc1CNc1ccc([NH+]3CCCC3)cc1)CCCO2 ZINC001620853163 1055480597 /nfs/dbraw/zinc/48/05/97/1055480597.db2.gz NCYAGGFVOBJACJ-UHFFFAOYSA-N 1 2 308.425 4.224 20 0 DIADLO Cc1cc(NCc2cc3ccncc3s2)ccc1-n1cc[nH+]c1 ZINC001620853866 1055482637 /nfs/dbraw/zinc/48/26/37/1055482637.db2.gz FJGWUWPBFXUHRT-UHFFFAOYSA-N 1 2 320.421 4.403 20 0 DIADLO Cc1cc(NCc2ccc3[nH]ccc3c2)ccc1-n1cc[nH+]c1 ZINC001620853810 1055482710 /nfs/dbraw/zinc/48/27/10/1055482710.db2.gz BTSHAQCSQUJIMW-UHFFFAOYSA-N 1 2 302.381 4.274 20 0 DIADLO CC(C)O[C@H]1CC[N@H+](Cc2c(Cl)cc(F)cc2Cl)C1 ZINC001237599806 1055482757 /nfs/dbraw/zinc/48/27/57/1055482757.db2.gz RJNRGHFCNISMEA-NSHDSACASA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@H]1CC[N@@H+](Cc2c(Cl)cc(F)cc2Cl)C1 ZINC001237599806 1055482762 /nfs/dbraw/zinc/48/27/62/1055482762.db2.gz RJNRGHFCNISMEA-NSHDSACASA-N 1 2 306.208 4.132 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3cccc(C)c3F)cc2)[nH+]c1C ZINC001589437238 1055484394 /nfs/dbraw/zinc/48/43/94/1055484394.db2.gz MNYJJPKDWIVZEJ-UHFFFAOYSA-N 1 2 323.371 4.393 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cc(F)ccc2N(C)C)c1 ZINC001620860917 1055487691 /nfs/dbraw/zinc/48/76/91/1055487691.db2.gz BABVBDXGSTUKIH-UHFFFAOYSA-N 1 2 319.449 4.152 20 0 DIADLO CCc1n[nH]cc1C[N@@H+](CC)Cc1ccc(Cl)cc1Cl ZINC001237651912 1055493251 /nfs/dbraw/zinc/49/32/51/1055493251.db2.gz BCISFQZUHPYICO-UHFFFAOYSA-N 1 2 312.244 4.301 20 0 DIADLO CCc1[nH]ncc1C[N@@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC001237650911 1055493164 /nfs/dbraw/zinc/49/31/64/1055493164.db2.gz KRWZRCPKVVIFFW-NRFANRHFSA-N 1 2 317.436 4.120 20 0 DIADLO CCc1[nH]ncc1C[N@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC001237650911 1055493171 /nfs/dbraw/zinc/49/31/71/1055493171.db2.gz KRWZRCPKVVIFFW-NRFANRHFSA-N 1 2 317.436 4.120 20 0 DIADLO CCc1n[nH]cc1C[N@H+](CC)Cc1ccc(Cl)cc1Cl ZINC001237651912 1055493257 /nfs/dbraw/zinc/49/32/57/1055493257.db2.gz BCISFQZUHPYICO-UHFFFAOYSA-N 1 2 312.244 4.301 20 0 DIADLO CC(C)c1nc(CNc2ccc(N3CCCCC3)[nH+]c2)cs1 ZINC001620869407 1055495922 /nfs/dbraw/zinc/49/59/22/1055495922.db2.gz YBWLVENLDJQXCX-UHFFFAOYSA-N 1 2 316.474 4.264 20 0 DIADLO Cc1cc(C)c(Cl)c(C[N@@H+]2CCC(=O)[C@@H]3CCCC[C@@H]32)c1 ZINC001237698954 1055507599 /nfs/dbraw/zinc/50/75/99/1055507599.db2.gz SEFSICWEBNKILU-CVEARBPZSA-N 1 2 305.849 4.290 20 0 DIADLO Cc1cc(C)c(Cl)c(C[N@H+]2CCC(=O)[C@@H]3CCCC[C@@H]32)c1 ZINC001237698954 1055507603 /nfs/dbraw/zinc/50/76/03/1055507603.db2.gz SEFSICWEBNKILU-CVEARBPZSA-N 1 2 305.849 4.290 20 0 DIADLO Cc1ccc(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC000024050780 1055508420 /nfs/dbraw/zinc/50/84/20/1055508420.db2.gz IYXKPYOGSZCNLD-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO CC[C@H](NC(=O)c1ccc(-n2cc[nH+]c2)cc1)c1ccc(C)cc1 ZINC000024049417 1055508548 /nfs/dbraw/zinc/50/85/48/1055508548.db2.gz KMEIBQFNCPKTGT-IBGZPJMESA-N 1 2 319.408 4.062 20 0 DIADLO Cc1cc(NCc2ccc(F)c(F)c2N(C)C)ccc1[NH+](C)C ZINC001620884485 1055509160 /nfs/dbraw/zinc/50/91/60/1055509160.db2.gz HXBLBOUHTPTRPT-UHFFFAOYSA-N 1 2 319.399 4.017 20 0 DIADLO O=C(Nc1cccc2[nH+]ccn21)c1cc(Cl)cc(Cl)c1F ZINC001538058596 1055515754 /nfs/dbraw/zinc/51/57/54/1055515754.db2.gz RGVGAAYLCAJCBQ-UHFFFAOYSA-N 1 2 324.142 4.033 20 0 DIADLO Cc1cccc2c1[C@@H](C)C[C@@H]2CC(=O)Nc1cccc2[nH+]ccn21 ZINC001538058687 1055516077 /nfs/dbraw/zinc/51/60/77/1055516077.db2.gz SWAQOHVWBFPIEJ-LSDHHAIUSA-N 1 2 319.408 4.262 20 0 DIADLO CCc1cc(C[N@@H+]2CCC(=O)[C@H]3CCCC[C@H]32)ccc1Cl ZINC001237739430 1055517608 /nfs/dbraw/zinc/51/76/08/1055517608.db2.gz YGSPELGQUQLDAI-DOTOQJQBSA-N 1 2 305.849 4.236 20 0 DIADLO CCc1cc(C[N@H+]2CCC(=O)[C@H]3CCCC[C@H]32)ccc1Cl ZINC001237739430 1055517621 /nfs/dbraw/zinc/51/76/21/1055517621.db2.gz YGSPELGQUQLDAI-DOTOQJQBSA-N 1 2 305.849 4.236 20 0 DIADLO C[C@H]1CCC[C@H](C)[NH+]1Cc1ncc(Cl)cc1Br ZINC001237752572 1055523546 /nfs/dbraw/zinc/52/35/46/1055523546.db2.gz HTSQUNFTSQKDGL-UWVGGRQHSA-N 1 2 317.658 4.260 20 0 DIADLO Fc1cccc2c1CC[N@H+](Cc1cc3c(ccnc3Cl)o1)C2 ZINC001621115181 1055525556 /nfs/dbraw/zinc/52/55/56/1055525556.db2.gz HDNOHENJJGDUGF-UHFFFAOYSA-N 1 2 316.763 4.179 20 0 DIADLO Fc1cccc2c1CC[N@@H+](Cc1cc3c(ccnc3Cl)o1)C2 ZINC001621115181 1055525567 /nfs/dbraw/zinc/52/55/67/1055525567.db2.gz HDNOHENJJGDUGF-UHFFFAOYSA-N 1 2 316.763 4.179 20 0 DIADLO CC[N@H+](Cc1cnc(C2CC2)s1)Cc1cccc(F)c1F ZINC001237794283 1055529611 /nfs/dbraw/zinc/52/96/11/1055529611.db2.gz ZWEZIKXZIUYJLC-UHFFFAOYSA-N 1 2 308.397 4.321 20 0 DIADLO CC[N@@H+](Cc1cnc(C2CC2)s1)Cc1cccc(F)c1F ZINC001237794283 1055529616 /nfs/dbraw/zinc/52/96/16/1055529616.db2.gz ZWEZIKXZIUYJLC-UHFFFAOYSA-N 1 2 308.397 4.321 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)ccc1F ZINC001237819115 1055537156 /nfs/dbraw/zinc/53/71/56/1055537156.db2.gz AYVAMJMUVSNFBN-QGZVFWFLSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)ccc1F ZINC001237819115 1055537164 /nfs/dbraw/zinc/53/71/64/1055537164.db2.gz AYVAMJMUVSNFBN-QGZVFWFLSA-N 1 2 306.331 4.144 20 0 DIADLO CCc1ncc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)s1 ZINC001237827795 1055540350 /nfs/dbraw/zinc/54/03/50/1055540350.db2.gz WGZMXELSDHNPOP-OAHLLOKOSA-N 1 2 308.397 4.321 20 0 DIADLO CCc1ncc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)s1 ZINC001237827795 1055540342 /nfs/dbraw/zinc/54/03/42/1055540342.db2.gz WGZMXELSDHNPOP-OAHLLOKOSA-N 1 2 308.397 4.321 20 0 DIADLO COc1ccoc1C[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC001237868622 1055543809 /nfs/dbraw/zinc/54/38/09/1055543809.db2.gz MECFEJQPJHUSHN-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO COc1ccoc1C[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC001237868622 1055543820 /nfs/dbraw/zinc/54/38/20/1055543820.db2.gz MECFEJQPJHUSHN-UHFFFAOYSA-N 1 2 300.185 4.227 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCc3cc(C(C)C)ccc3C2)c(C)[nH+]1 ZINC001538143080 1055546901 /nfs/dbraw/zinc/54/69/01/1055546901.db2.gz ZLGWLLXYYJHDTJ-UHFFFAOYSA-N 1 2 322.452 4.329 20 0 DIADLO c1ccc(OCc2ccc(C[NH+]3CC4(C3)CCCCO4)cc2)cc1 ZINC001237927961 1055560632 /nfs/dbraw/zinc/56/06/32/1055560632.db2.gz SUUPXVXSXSMDDT-UHFFFAOYSA-N 1 2 323.436 4.021 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2cccc(F)c2F)cc1F ZINC001237960489 1055563260 /nfs/dbraw/zinc/56/32/60/1055563260.db2.gz LXHYLADOCJHVOG-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2cccc(F)c2F)cc1F ZINC001237960489 1055563274 /nfs/dbraw/zinc/56/32/74/1055563274.db2.gz LXHYLADOCJHVOG-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ccc(F)cc2F)cc1F ZINC001237957518 1055563697 /nfs/dbraw/zinc/56/36/97/1055563697.db2.gz ASBGAFKIMZPBAC-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ccc(F)cc2F)cc1F ZINC001237957518 1055563708 /nfs/dbraw/zinc/56/37/08/1055563708.db2.gz ASBGAFKIMZPBAC-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO Cc1sccc1C[NH+](Cc1cccnc1)Cc1cccnc1 ZINC001237966318 1055567774 /nfs/dbraw/zinc/56/77/74/1055567774.db2.gz JNWZGYLWQBBTIW-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Clc1cccc(-c2nc(C[NH+]3CCSCC3)cs2)c1 ZINC001237985189 1055573826 /nfs/dbraw/zinc/57/38/26/1055573826.db2.gz VIZGWMRFQLIRKB-UHFFFAOYSA-N 1 2 310.875 4.012 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[NH+]1CCC2(CCCC2)CC1 ZINC001237997970 1055576932 /nfs/dbraw/zinc/57/69/32/1055576932.db2.gz UOAWQQHOAFENKI-UHFFFAOYSA-N 1 2 303.837 4.373 20 0 DIADLO Oc1c(F)cc(C[N@@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)cc1Cl ZINC001237987252 1055577329 /nfs/dbraw/zinc/57/73/29/1055577329.db2.gz BAWFAVBKFDPEQJ-BETUJISGSA-N 1 2 317.791 4.271 20 0 DIADLO Oc1c(F)cc(C[N@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)cc1Cl ZINC001237987252 1055577333 /nfs/dbraw/zinc/57/73/33/1055577333.db2.gz BAWFAVBKFDPEQJ-BETUJISGSA-N 1 2 317.791 4.271 20 0 DIADLO Cc1ccoc1C[NH2+]Cc1csc(-c2ccc(F)cc2)n1 ZINC000387399419 1055579904 /nfs/dbraw/zinc/57/99/04/1055579904.db2.gz DQFBVYNEHTYCQP-UHFFFAOYSA-N 1 2 302.374 4.140 20 0 DIADLO C[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccc(F)cc1F ZINC000102689659 1055586908 /nfs/dbraw/zinc/58/69/08/1055586908.db2.gz KCCYTDLVBBMKEG-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO Cc1ccc(-c2nnc(C[N@@H+](C)[C@H](C)c3cccs3)o2)cc1 ZINC000025931417 1055588104 /nfs/dbraw/zinc/58/81/04/1055588104.db2.gz ZVIRVYUFOOSNTG-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(-c2nnc(C[N@H+](C)[C@H](C)c3cccs3)o2)cc1 ZINC000025931417 1055588113 /nfs/dbraw/zinc/58/81/13/1055588113.db2.gz ZVIRVYUFOOSNTG-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Brc1ncsc1C[N@@H+]1CCC[C@H]1c1ccccc1 ZINC001238038633 1055590431 /nfs/dbraw/zinc/59/04/31/1055590431.db2.gz XLUPMQLSSYJCHE-LBPRGKRZSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ncsc1C[N@H+]1CCC[C@H]1c1ccccc1 ZINC001238038633 1055590441 /nfs/dbraw/zinc/59/04/41/1055590441.db2.gz XLUPMQLSSYJCHE-LBPRGKRZSA-N 1 2 323.259 4.243 20 0 DIADLO Fc1cc(C[NH2+]Cc2cc(-c3ccccc3)on2)cc(F)c1F ZINC000102781177 1055591463 /nfs/dbraw/zinc/59/14/63/1055591463.db2.gz MWRZPVHRELXAKO-UHFFFAOYSA-N 1 2 318.298 4.049 20 0 DIADLO CC(C)(C)c1cccc(C(=O)Nc2ccccc2-n2cc[nH+]c2)c1 ZINC001595395919 1055593995 /nfs/dbraw/zinc/59/39/95/1055593995.db2.gz RHQJZVKRZNXLGI-UHFFFAOYSA-N 1 2 319.408 4.422 20 0 DIADLO C[C@H]1CC(=O)CC[N@@H+]1Cc1cccc(OCC2CCCCC2)c1 ZINC001238066044 1055596276 /nfs/dbraw/zinc/59/62/76/1055596276.db2.gz HFMWQVQXCWUGBH-INIZCTEOSA-N 1 2 315.457 4.199 20 0 DIADLO C[C@H]1CC(=O)CC[N@H+]1Cc1cccc(OCC2CCCCC2)c1 ZINC001238066044 1055596291 /nfs/dbraw/zinc/59/62/91/1055596291.db2.gz HFMWQVQXCWUGBH-INIZCTEOSA-N 1 2 315.457 4.199 20 0 DIADLO CC1(C)CCC[N@@H+]1Cc1cc(F)cc(Br)c1F ZINC001238076415 1055600651 /nfs/dbraw/zinc/60/06/51/1055600651.db2.gz UAQWBIDTWKJIIA-UHFFFAOYSA-N 1 2 304.178 4.102 20 0 DIADLO CC1(C)CCC[N@H+]1Cc1cc(F)cc(Br)c1F ZINC001238076415 1055600661 /nfs/dbraw/zinc/60/06/61/1055600661.db2.gz UAQWBIDTWKJIIA-UHFFFAOYSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1ccc(F)c(Br)c1F ZINC001238082759 1055603543 /nfs/dbraw/zinc/60/35/43/1055603543.db2.gz WWTJAIFSSIICMA-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1ccc(F)c(Br)c1F ZINC001238082759 1055603547 /nfs/dbraw/zinc/60/35/47/1055603547.db2.gz WWTJAIFSSIICMA-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@H](c3ccc(F)cc3)C2)cc1Cl ZINC001238149680 1055611734 /nfs/dbraw/zinc/61/17/34/1055611734.db2.gz MCTVMJWBWLOOJD-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)cc1Cl ZINC001238149680 1055611737 /nfs/dbraw/zinc/61/17/37/1055611737.db2.gz MCTVMJWBWLOOJD-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO COc1ccc([C@@H](C)[N@H+](C)Cc2cc(Cl)c(O)cc2F)cc1 ZINC001238150076 1055613634 /nfs/dbraw/zinc/61/36/34/1055613634.db2.gz RFATUIHYAZOKSB-LLVKDONJSA-N 1 2 323.795 4.386 20 0 DIADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2cc(Cl)c(O)cc2F)cc1 ZINC001238150076 1055613646 /nfs/dbraw/zinc/61/36/46/1055613646.db2.gz RFATUIHYAZOKSB-LLVKDONJSA-N 1 2 323.795 4.386 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@H](c3ccccc3F)C2)cc1Cl ZINC001238153098 1055613717 /nfs/dbraw/zinc/61/37/17/1055613717.db2.gz VLOGCOLTEYYEJU-NSHDSACASA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@H](c3ccccc3F)C2)cc1Cl ZINC001238153098 1055613728 /nfs/dbraw/zinc/61/37/28/1055613728.db2.gz VLOGCOLTEYYEJU-NSHDSACASA-N 1 2 323.770 4.313 20 0 DIADLO CC[N@H+](Cc1cncc(C2CC2)c1)Cc1cccc(F)c1F ZINC001238196308 1055618057 /nfs/dbraw/zinc/61/80/57/1055618057.db2.gz YFHMGOFYCXRZMY-UHFFFAOYSA-N 1 2 302.368 4.259 20 0 DIADLO CC[N@@H+](Cc1cncc(C2CC2)c1)Cc1cccc(F)c1F ZINC001238196308 1055618066 /nfs/dbraw/zinc/61/80/66/1055618066.db2.gz YFHMGOFYCXRZMY-UHFFFAOYSA-N 1 2 302.368 4.259 20 0 DIADLO Cc1c(Cl)c(Br)ccc1C[NH+]1CC(C)(C)C1 ZINC001238225312 1055622824 /nfs/dbraw/zinc/62/28/24/1055622824.db2.gz XGWSPQHAXNORKD-UHFFFAOYSA-N 1 2 302.643 4.253 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000029951261 1055624261 /nfs/dbraw/zinc/62/42/61/1055624261.db2.gz UEDFTDJOMVPFOF-HNNXBMFYSA-N 1 2 305.381 4.005 20 0 DIADLO CSc1ccc(C)c(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000029910074 1055625019 /nfs/dbraw/zinc/62/50/19/1055625019.db2.gz UUAJOQNVBIPLHM-UHFFFAOYSA-N 1 2 323.421 4.155 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1c(F)ccnc1Cl ZINC001238235514 1055627741 /nfs/dbraw/zinc/62/77/41/1055627741.db2.gz UFKMWFJJSDYTQS-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1c(F)ccnc1Cl ZINC001238235514 1055627748 /nfs/dbraw/zinc/62/77/48/1055627748.db2.gz UFKMWFJJSDYTQS-MRXNPFEDSA-N 1 2 304.796 4.384 20 0 DIADLO Fc1ccc(C2CC[NH+](Cc3c(F)ccnc3Cl)CC2)cc1 ZINC001238229211 1055627856 /nfs/dbraw/zinc/62/78/56/1055627856.db2.gz GDGIAHNUHQTFAI-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO CN(Cc1csc2ccccc12)C(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001595828502 1055638941 /nfs/dbraw/zinc/63/89/41/1055638941.db2.gz QCVRQGGHWVMRTO-UHFFFAOYSA-N 1 2 321.405 4.050 20 0 DIADLO CCCCC[C@@H]1CCCN1C(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001595874050 1055643038 /nfs/dbraw/zinc/64/30/38/1055643038.db2.gz IZKSQFQEHOBNDO-IAGOWNOFSA-N 1 2 305.466 4.042 20 0 DIADLO CC1(C)C[NH+](Cc2ccc(F)c(OCc3ccccc3)c2F)C1 ZINC001238348794 1055643573 /nfs/dbraw/zinc/64/35/73/1055643573.db2.gz JKPCSONZRYRJGG-UHFFFAOYSA-N 1 2 317.379 4.386 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2cccc(F)c2F)cnc1OC(C)C ZINC001238378966 1055648549 /nfs/dbraw/zinc/64/85/49/1055648549.db2.gz UPTOZFJELQMZAX-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2cccc(F)c2F)cnc1OC(C)C ZINC001238378966 1055648554 /nfs/dbraw/zinc/64/85/54/1055648554.db2.gz UPTOZFJELQMZAX-UHFFFAOYSA-N 1 2 320.383 4.087 20 0 DIADLO CC[C@@H]1CCC[N@H+](Cc2ccnc(Br)c2Cl)C1 ZINC001238386317 1055648603 /nfs/dbraw/zinc/64/86/03/1055648603.db2.gz YURXWVHWHXWAKL-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@@H]1CCC[N@@H+](Cc2ccnc(Br)c2Cl)C1 ZINC001238386317 1055648607 /nfs/dbraw/zinc/64/86/07/1055648607.db2.gz YURXWVHWHXWAKL-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1ccnc(Br)c1Cl ZINC001238384587 1055649135 /nfs/dbraw/zinc/64/91/35/1055649135.db2.gz OOVPMNIMHHVNHD-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1ccnc(Br)c1Cl ZINC001238384587 1055649147 /nfs/dbraw/zinc/64/91/47/1055649147.db2.gz OOVPMNIMHHVNHD-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO CCCC[N@H+](CC)Cc1c(Cl)cncc1Br ZINC001238389592 1055650932 /nfs/dbraw/zinc/65/09/32/1055650932.db2.gz HJRYAAZFVBLHIW-UHFFFAOYSA-N 1 2 305.647 4.120 20 0 DIADLO CCCC[N@@H+](CC)Cc1c(Cl)cncc1Br ZINC001238389592 1055650937 /nfs/dbraw/zinc/65/09/37/1055650937.db2.gz HJRYAAZFVBLHIW-UHFFFAOYSA-N 1 2 305.647 4.120 20 0 DIADLO CCOc1ccc(C[N@H+](Cc2ccco2)C2CC2)c(Cl)c1 ZINC001238401619 1055651577 /nfs/dbraw/zinc/65/15/77/1055651577.db2.gz BTADLSBOXZHRJW-UHFFFAOYSA-N 1 2 305.805 4.496 20 0 DIADLO CCOc1ccc(C[N@@H+](Cc2ccco2)C2CC2)c(Cl)c1 ZINC001238401619 1055651579 /nfs/dbraw/zinc/65/15/79/1055651579.db2.gz BTADLSBOXZHRJW-UHFFFAOYSA-N 1 2 305.805 4.496 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(Cl)cncc2Br)[C@H](C)C1 ZINC001238394677 1055651592 /nfs/dbraw/zinc/65/15/92/1055651592.db2.gz UJKRTKSZMOSCAD-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(Cl)cncc2Br)[C@H](C)C1 ZINC001238394677 1055651593 /nfs/dbraw/zinc/65/15/93/1055651593.db2.gz UJKRTKSZMOSCAD-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1c(Cl)cncc1Br ZINC001238394680 1055651641 /nfs/dbraw/zinc/65/16/41/1055651641.db2.gz UJKRTKSZMOSCAD-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1c(Cl)cncc1Br ZINC001238394680 1055651644 /nfs/dbraw/zinc/65/16/44/1055651644.db2.gz UJKRTKSZMOSCAD-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO CC(C)[N@H+](C)Cc1c(F)c(Cl)c(F)cc1Br ZINC001238403934 1055653183 /nfs/dbraw/zinc/65/31/83/1055653183.db2.gz QAPFNEGRHJSPJM-UHFFFAOYSA-N 1 2 312.585 4.221 20 0 DIADLO CC(C)[N@@H+](C)Cc1c(F)c(Cl)c(F)cc1Br ZINC001238403934 1055653188 /nfs/dbraw/zinc/65/31/88/1055653188.db2.gz QAPFNEGRHJSPJM-UHFFFAOYSA-N 1 2 312.585 4.221 20 0 DIADLO CNc1ccc(Nc2cc(Oc3ccccc3)ccc2N)c[nH+]1 ZINC001203458883 1055662778 /nfs/dbraw/zinc/66/27/78/1055662778.db2.gz SUTXEOZYVWEQQB-UHFFFAOYSA-N 1 2 306.369 4.241 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@H]2c2ccccc2F)cnc1F ZINC001238453165 1055663139 /nfs/dbraw/zinc/66/31/39/1055663139.db2.gz FQPRVGBBFUIXAW-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@H]2c2ccccc2F)cnc1F ZINC001238453165 1055663143 /nfs/dbraw/zinc/66/31/43/1055663143.db2.gz FQPRVGBBFUIXAW-INIZCTEOSA-N 1 2 318.367 4.096 20 0 DIADLO COc1c(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)ccc(F)c1F ZINC001238470302 1055666304 /nfs/dbraw/zinc/66/63/04/1055666304.db2.gz QZKJLQPFVYPDRH-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)ccc(F)c1F ZINC001238470302 1055666313 /nfs/dbraw/zinc/66/63/13/1055666313.db2.gz QZKJLQPFVYPDRH-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO Clc1cccc(Cl)c1C[NH2+]Cc1cnn(C2CCC2)c1 ZINC000921622236 1055668869 /nfs/dbraw/zinc/66/88/69/1055668869.db2.gz UQASKUWPWRBMAJ-UHFFFAOYSA-N 1 2 310.228 4.205 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@@H]2CF)cc(C(F)(F)F)c1 ZINC001238498641 1055673871 /nfs/dbraw/zinc/67/38/71/1055673871.db2.gz KBELTJNLPPZJLH-CYBMUJFWSA-N 1 2 305.315 4.038 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@@H]2CF)cc(C(F)(F)F)c1 ZINC001238498641 1055673880 /nfs/dbraw/zinc/67/38/80/1055673880.db2.gz KBELTJNLPPZJLH-CYBMUJFWSA-N 1 2 305.315 4.038 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc(F)c(C3CC3)c2)no1 ZINC001238504372 1055673938 /nfs/dbraw/zinc/67/39/38/1055673938.db2.gz UYGKJLZPGODZOU-GOSISDBHSA-N 1 2 300.377 4.337 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc(F)c(C3CC3)c2)no1 ZINC001238504372 1055673948 /nfs/dbraw/zinc/67/39/48/1055673948.db2.gz UYGKJLZPGODZOU-GOSISDBHSA-N 1 2 300.377 4.337 20 0 DIADLO C[N@H+](CCF)Cc1ccc(-c2cccc(C(F)(F)F)c2)nc1 ZINC001238511402 1055676279 /nfs/dbraw/zinc/67/62/79/1055676279.db2.gz OYYHCOATXMVQJL-UHFFFAOYSA-N 1 2 312.310 4.169 20 0 DIADLO C[N@@H+](CCF)Cc1ccc(-c2cccc(C(F)(F)F)c2)nc1 ZINC001238511402 1055676286 /nfs/dbraw/zinc/67/62/86/1055676286.db2.gz OYYHCOATXMVQJL-UHFFFAOYSA-N 1 2 312.310 4.169 20 0 DIADLO CC(C)Cc1noc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCC2)n1 ZINC000104704103 1055678057 /nfs/dbraw/zinc/67/80/57/1055678057.db2.gz XWGMZHMGLPBNTI-GOSISDBHSA-N 1 2 317.408 4.038 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)c1F ZINC001238526300 1055681029 /nfs/dbraw/zinc/68/10/29/1055681029.db2.gz BOQDJYINYUEPPJ-NSHDSACASA-N 1 2 319.342 4.229 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)c1F ZINC001238526300 1055681034 /nfs/dbraw/zinc/68/10/34/1055681034.db2.gz BOQDJYINYUEPPJ-NSHDSACASA-N 1 2 319.342 4.229 20 0 DIADLO Cc1cc(Br)c(Cl)cc1C[NH+]1CCC(F)CC1 ZINC001238572364 1055690240 /nfs/dbraw/zinc/69/02/40/1055690240.db2.gz JWLFJCCMQWSJTD-UHFFFAOYSA-N 1 2 320.633 4.345 20 0 DIADLO CC(C)Oc1cc(C[N@@H+]2CCc3ccccc3[C@@H]2C)cnc1F ZINC001238593270 1055691585 /nfs/dbraw/zinc/69/15/85/1055691585.db2.gz BBZDDOOGUIFLFO-AWEZNQCLSA-N 1 2 314.404 4.127 20 0 DIADLO CC(C)Oc1cc(C[N@H+]2CCc3ccccc3[C@@H]2C)cnc1F ZINC001238593270 1055691589 /nfs/dbraw/zinc/69/15/89/1055691589.db2.gz BBZDDOOGUIFLFO-AWEZNQCLSA-N 1 2 314.404 4.127 20 0 DIADLO CC(C)OC1C[NH+](Cc2ccccc2-c2ccc(F)cc2F)C1 ZINC001238585235 1055692254 /nfs/dbraw/zinc/69/22/54/1055692254.db2.gz ALEMJLAPVLVLOQ-UHFFFAOYSA-N 1 2 317.379 4.241 20 0 DIADLO Fc1ccc(-c2noc(C[N@H+](Cc3ccccc3)C3CC3)n2)cc1 ZINC000043643211 1055701915 /nfs/dbraw/zinc/70/19/15/1055701915.db2.gz VLVGHDFSIXWGKO-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1ccc(-c2noc(C[N@@H+](Cc3ccccc3)C3CC3)n2)cc1 ZINC000043643211 1055701925 /nfs/dbraw/zinc/70/19/25/1055701925.db2.gz VLVGHDFSIXWGKO-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(-c3ccccc3)ncc2Cl)C[C@@H]1F ZINC001238624066 1055702229 /nfs/dbraw/zinc/70/22/29/1055702229.db2.gz JCVKCDCWEVUHBT-WBMJQRKESA-N 1 2 304.796 4.192 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(-c3ccccc3)ncc2Cl)C[C@@H]1F ZINC001238624066 1055702240 /nfs/dbraw/zinc/70/22/40/1055702240.db2.gz JCVKCDCWEVUHBT-WBMJQRKESA-N 1 2 304.796 4.192 20 0 DIADLO Cc1cc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)cc(C)c1F ZINC001565582493 1055710981 /nfs/dbraw/zinc/71/09/81/1055710981.db2.gz ZAUGGAAKVQILJX-UHFFFAOYSA-N 1 2 323.371 4.189 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC001238661136 1055713324 /nfs/dbraw/zinc/71/33/24/1055713324.db2.gz PEOCEKCUHFAPOG-KRWDZBQOSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1cc(F)c(F)cc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC001238661136 1055713335 /nfs/dbraw/zinc/71/33/35/1055713335.db2.gz PEOCEKCUHFAPOG-KRWDZBQOSA-N 1 2 303.352 4.311 20 0 DIADLO Cc1cc(OC(C)C)cc(C)c1C[N@@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001238670923 1055714635 /nfs/dbraw/zinc/71/46/35/1055714635.db2.gz ZKSGFPROWNDEPT-INIZCTEOSA-N 1 2 315.379 4.270 20 0 DIADLO Cc1cc(OC(C)C)cc(C)c1C[N@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001238670923 1055714642 /nfs/dbraw/zinc/71/46/42/1055714642.db2.gz ZKSGFPROWNDEPT-INIZCTEOSA-N 1 2 315.379 4.270 20 0 DIADLO CSc1ccc(Cl)cc1C[N@@H+]1CCc2c(O)cccc2C1 ZINC001238671948 1055715989 /nfs/dbraw/zinc/71/59/89/1055715989.db2.gz OEOQZRXWDYTWJN-UHFFFAOYSA-N 1 2 319.857 4.326 20 0 DIADLO CSc1ccc(Cl)cc1C[N@H+]1CCc2c(O)cccc2C1 ZINC001238671948 1055715999 /nfs/dbraw/zinc/71/59/99/1055715999.db2.gz OEOQZRXWDYTWJN-UHFFFAOYSA-N 1 2 319.857 4.326 20 0 DIADLO CC(C)Sc1ccc(Cl)cc1NC(=O)CCc1[nH]cc[nH+]1 ZINC001565678018 1055717364 /nfs/dbraw/zinc/71/73/64/1055717364.db2.gz ONFUZCJKKQHGDP-UHFFFAOYSA-N 1 2 323.849 4.135 20 0 DIADLO Clc1ccc(-c2ccc(C[N@@H+]3Cc4ccncc4C3)cc2)nc1 ZINC001238682969 1055721041 /nfs/dbraw/zinc/72/10/41/1055721041.db2.gz MCJODSCOWCQYSW-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO Clc1ccc(-c2ccc(C[N@H+]3Cc4ccncc4C3)cc2)nc1 ZINC001238682969 1055721049 /nfs/dbraw/zinc/72/10/49/1055721049.db2.gz MCJODSCOWCQYSW-UHFFFAOYSA-N 1 2 321.811 4.313 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ccc(C(C)C)nc2Cl)c1 ZINC001238723708 1055733916 /nfs/dbraw/zinc/73/39/16/1055733916.db2.gz DOHWOPAFFJLAEU-UHFFFAOYSA-N 1 2 318.848 4.499 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ccc(C(C)C)nc2Cl)c1 ZINC001238723708 1055733926 /nfs/dbraw/zinc/73/39/26/1055733926.db2.gz DOHWOPAFFJLAEU-UHFFFAOYSA-N 1 2 318.848 4.499 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c(F)cn1 ZINC001238729379 1055734055 /nfs/dbraw/zinc/73/40/55/1055734055.db2.gz WXSKMOUILGTCGR-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c(F)cn1 ZINC001238729379 1055734065 /nfs/dbraw/zinc/73/40/65/1055734065.db2.gz WXSKMOUILGTCGR-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CC(C)c1ccc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)c(Cl)n1 ZINC001238722192 1055734200 /nfs/dbraw/zinc/73/42/00/1055734200.db2.gz LYAKXZCTRGWIPZ-NSHDSACASA-N 1 2 302.796 4.336 20 0 DIADLO CC(C)c1ccc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)c(Cl)n1 ZINC001238722192 1055734213 /nfs/dbraw/zinc/73/42/13/1055734213.db2.gz LYAKXZCTRGWIPZ-NSHDSACASA-N 1 2 302.796 4.336 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c(F)cn1 ZINC001238729380 1055735311 /nfs/dbraw/zinc/73/53/11/1055735311.db2.gz WXSKMOUILGTCGR-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c(F)cn1 ZINC001238729380 1055735317 /nfs/dbraw/zinc/73/53/17/1055735317.db2.gz WXSKMOUILGTCGR-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2)c(F)cn1 ZINC001238731907 1055737524 /nfs/dbraw/zinc/73/75/24/1055737524.db2.gz LUIKBUOCKBNLLU-GFCCVEGCSA-N 1 2 322.811 4.466 20 0 DIADLO CCOc1cc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2)c(F)cn1 ZINC001238731907 1055737536 /nfs/dbraw/zinc/73/75/36/1055737536.db2.gz LUIKBUOCKBNLLU-GFCCVEGCSA-N 1 2 322.811 4.466 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1ccc(F)c(F)c1OC(C)C ZINC001238740848 1055737786 /nfs/dbraw/zinc/73/77/86/1055737786.db2.gz CJFNXZGURVSOLM-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1ccc(F)c(F)c1OC(C)C ZINC001238740848 1055737795 /nfs/dbraw/zinc/73/77/95/1055737795.db2.gz CJFNXZGURVSOLM-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1ccc(F)c(F)c1OC(C)C ZINC001238749721 1055740284 /nfs/dbraw/zinc/74/02/84/1055740284.db2.gz GUSYLXBZNCITNP-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1ccc(F)c(F)c1OC(C)C ZINC001238749721 1055740291 /nfs/dbraw/zinc/74/02/91/1055740291.db2.gz GUSYLXBZNCITNP-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO Cc1ccccc1[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C(C)(C)C ZINC001566233311 1055753528 /nfs/dbraw/zinc/75/35/28/1055753528.db2.gz ZYFHRFNCPCYQAD-GOSISDBHSA-N 1 2 321.424 4.389 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccccn2)cc1Cl ZINC001238790962 1055753554 /nfs/dbraw/zinc/75/35/54/1055753554.db2.gz SQIURUHMGSXHSM-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccccn2)cc1Cl ZINC001238790962 1055753564 /nfs/dbraw/zinc/75/35/64/1055753564.db2.gz SQIURUHMGSXHSM-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CC(C)Oc1cc(C[N@H+](Cc2ccccc2)C2CC2)c(F)cn1 ZINC001238799189 1055755386 /nfs/dbraw/zinc/75/53/86/1055755386.db2.gz KDHSJCCOVYDISY-UHFFFAOYSA-N 1 2 314.404 4.173 20 0 DIADLO CC(C)Oc1cc(C[N@@H+](Cc2ccccc2)C2CC2)c(F)cn1 ZINC001238799189 1055755396 /nfs/dbraw/zinc/75/53/96/1055755396.db2.gz KDHSJCCOVYDISY-UHFFFAOYSA-N 1 2 314.404 4.173 20 0 DIADLO CC1(C)CC=C(C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)CC1 ZINC001596894114 1055757651 /nfs/dbraw/zinc/75/76/51/1055757651.db2.gz FLYOYHDHILAKGC-UHFFFAOYSA-N 1 2 313.376 4.086 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1ccc(C(F)F)cc1 ZINC000338661843 1055758297 /nfs/dbraw/zinc/75/82/97/1055758297.db2.gz JKFNGJDAUUHWDQ-UHFFFAOYSA-N 1 2 313.307 4.062 20 0 DIADLO Cc1cc(-c2ccnc(Oc3ccccc3)c2)c2[nH+]ccn2c1 ZINC001238840910 1055761801 /nfs/dbraw/zinc/76/18/01/1055761801.db2.gz BASPFYJGULFLNF-UHFFFAOYSA-N 1 2 301.349 4.497 20 0 DIADLO COc1ccc(C[NH2+][C@H](c2ccccc2)c2ccccc2OC)o1 ZINC001649245148 1055774900 /nfs/dbraw/zinc/77/49/00/1055774900.db2.gz ROUBQEVXWJOSOW-HXUWFJFHSA-N 1 2 323.392 4.176 20 0 DIADLO CC(C)Oc1cnc(F)c(-c2cccc(-c3c[nH+]cn3C)c2)c1 ZINC001238905399 1055786978 /nfs/dbraw/zinc/78/69/78/1055786978.db2.gz WEUWOTUEUYYGBL-UHFFFAOYSA-N 1 2 311.360 4.075 20 0 DIADLO Cc1cc(-c2cc(Cl)cnc2OC(C)C)c2[nH+]ccn2c1 ZINC001239323023 1055870291 /nfs/dbraw/zinc/87/02/91/1055870291.db2.gz RQIBAWICLKKMLF-UHFFFAOYSA-N 1 2 301.777 4.145 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2cscn2)c2ccc(C)cc2)cc1 ZINC000062258810 1055878291 /nfs/dbraw/zinc/87/82/91/1055878291.db2.gz GHWZDWKWYZOKMO-IBGZPJMESA-N 1 2 324.449 4.339 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC(C3CCCC3)CC2)c(C)[nH+]1 ZINC001539662395 1055878790 /nfs/dbraw/zinc/87/87/90/1055878790.db2.gz HDYAQYUBRLHYFC-UHFFFAOYSA-N 1 2 300.446 4.049 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC3(CCCCC3)[C@@H]2C(C)C)c(C)[nH+]1 ZINC001570190964 1055888885 /nfs/dbraw/zinc/88/88/85/1055888885.db2.gz BNSUDXMIPVZXQT-SFHVURJKSA-N 1 2 314.473 4.438 20 0 DIADLO Cc1cc(-c2cccc3ccccc32)c[nH+]c1N1CCOCC1 ZINC001239471805 1055897187 /nfs/dbraw/zinc/89/71/87/1055897187.db2.gz QTVKLGOYKDKPPI-UHFFFAOYSA-N 1 2 304.393 4.047 20 0 DIADLO CS[C@@H]1CC[C@@H]1[NH2+][C@@H](CCC(C)(C)C)C(=O)OC(C)(C)C ZINC001621343529 1055928745 /nfs/dbraw/zinc/92/87/45/1055928745.db2.gz RKRJREDZMCTVKO-MELADBBJSA-N 1 2 315.523 4.007 20 0 DIADLO Fc1ccc(C[NH2+]Cc2c(Cl)cncc2Cl)cc1Cl ZINC001620761362 1055933726 /nfs/dbraw/zinc/93/37/26/1055933726.db2.gz XIKQFQIEPDZPTR-UHFFFAOYSA-N 1 2 319.594 4.471 20 0 DIADLO FC(F)(F)c1ccccc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001239544042 1055942165 /nfs/dbraw/zinc/94/21/65/1055942165.db2.gz RHJLKYDIAYHCRE-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@@H+]([C@@H](C)c1ccccc1)C3 ZINC001620539596 1055964946 /nfs/dbraw/zinc/96/49/46/1055964946.db2.gz OEGVSHWDCMNKIC-AWEZNQCLSA-N 1 2 306.409 4.296 20 0 DIADLO COc1ccc2[nH]c3c(c2c1)CC[N@H+]([C@@H](C)c1ccccc1)C3 ZINC001620539596 1055964955 /nfs/dbraw/zinc/96/49/55/1055964955.db2.gz OEGVSHWDCMNKIC-AWEZNQCLSA-N 1 2 306.409 4.296 20 0 DIADLO CC[C@H](C)c1ccc(-c2ccc(C[NH+]3CCOCC3)nc2)cc1 ZINC001239590199 1055967619 /nfs/dbraw/zinc/96/76/19/1055967619.db2.gz IFEHCIRGRFDINV-INIZCTEOSA-N 1 2 310.441 4.094 20 0 DIADLO CC[C@@H](C)c1ccc(-c2ccc(C[NH+]3CCOCC3)nc2)cc1 ZINC001239590200 1055968034 /nfs/dbraw/zinc/96/80/34/1055968034.db2.gz IFEHCIRGRFDINV-MRXNPFEDSA-N 1 2 310.441 4.094 20 0 DIADLO COc1cccc(CN2CCC[C@H]2c2[nH]c(C)c(C)[nH+]2)c1Cl ZINC001620574203 1055969039 /nfs/dbraw/zinc/96/90/39/1055969039.db2.gz KCBQBVPWXDYODR-AWEZNQCLSA-N 1 2 319.836 4.026 20 0 DIADLO COc1cccc(Nc2ccc(NCc3cnccc3C)[nH+]c2)c1 ZINC001621006666 1055974414 /nfs/dbraw/zinc/97/44/14/1055974414.db2.gz QBVKYZLZIQTAGR-UHFFFAOYSA-N 1 2 320.396 4.149 20 0 DIADLO Cc1cccnc1[C@@H](C)[NH2+]Cc1coc(-c2ccccc2F)n1 ZINC001620665039 1055977977 /nfs/dbraw/zinc/97/79/77/1055977977.db2.gz UYKVHYARANCQHM-CYBMUJFWSA-N 1 2 311.360 4.035 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2coc(-c3ccccc3)n2)cc1 ZINC000066864080 1055984198 /nfs/dbraw/zinc/98/41/98/1055984198.db2.gz YTIZYGRJTOWXTC-UHFFFAOYSA-N 1 2 322.408 4.372 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2coc(-c3ccccc3)n2)cc1 ZINC000066864080 1055984210 /nfs/dbraw/zinc/98/42/10/1055984210.db2.gz YTIZYGRJTOWXTC-UHFFFAOYSA-N 1 2 322.408 4.372 20 0 DIADLO Cc1cc(C[NH2+]Cc2c(OC(F)F)ccc3ccccc32)no1 ZINC000066875479 1055984270 /nfs/dbraw/zinc/98/42/70/1055984270.db2.gz ZVCJUIBEAUWBKG-UHFFFAOYSA-N 1 2 318.323 4.027 20 0 DIADLO Brc1ccc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)s1 ZINC000067387359 1055992103 /nfs/dbraw/zinc/99/21/03/1055992103.db2.gz GKQBLCKHIZMUIT-LBPRGKRZSA-N 1 2 311.248 4.176 20 0 DIADLO Brc1ccc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)s1 ZINC000067387359 1055992116 /nfs/dbraw/zinc/99/21/16/1055992116.db2.gz GKQBLCKHIZMUIT-LBPRGKRZSA-N 1 2 311.248 4.176 20 0 DIADLO COc1cccc2cc(C[NH2+][C@H](CF)c3ccc(F)cc3)oc21 ZINC001621039911 1056000711 /nfs/dbraw/zinc/00/07/11/1056000711.db2.gz CJJIZKQFGVYMMA-MRXNPFEDSA-N 1 2 317.335 4.381 20 0 DIADLO Brc1ccsc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000067966789 1056001496 /nfs/dbraw/zinc/00/14/96/1056001496.db2.gz HGIPJXDAZGDXGA-LBPRGKRZSA-N 1 2 311.248 4.176 20 0 DIADLO Brc1ccsc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000067966789 1056001505 /nfs/dbraw/zinc/00/15/05/1056001505.db2.gz HGIPJXDAZGDXGA-LBPRGKRZSA-N 1 2 311.248 4.176 20 0 DIADLO COc1ccc(C[NH2+][C@H]2c3ccccc3CC[C@H]2F)c(Cl)c1 ZINC001621043365 1056003743 /nfs/dbraw/zinc/00/37/43/1056003743.db2.gz DENNTHWHBQCJAZ-MSOLQXFVSA-N 1 2 319.807 4.464 20 0 DIADLO Cc1ccc(-c2n[nH]cc2CNc2[nH]c3cc(C)ccc3[nH+]2)cc1 ZINC001621045821 1056006368 /nfs/dbraw/zinc/00/63/68/1056006368.db2.gz JCZDDBCENUWCSG-UHFFFAOYSA-N 1 2 317.396 4.182 20 0 DIADLO COc1cc(CNc2c[nH+]c(C)c(C)c2)ccc1OC(C)C ZINC001621047543 1056006672 /nfs/dbraw/zinc/00/66/72/1056006672.db2.gz WBFNDVWUSRFLND-UHFFFAOYSA-N 1 2 300.402 4.106 20 0 DIADLO COCCn1c2ccccc2[nH+]c1NC/C(C)=C/c1ccccc1 ZINC001621052022 1056009852 /nfs/dbraw/zinc/00/98/52/1056009852.db2.gz DCQTWEAODLIKMY-JQIJEIRASA-N 1 2 321.424 4.198 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCC1(CC)CCOCC1 ZINC001621052352 1056009961 /nfs/dbraw/zinc/00/99/61/1056009961.db2.gz SPHAVLVXKBPKEW-UHFFFAOYSA-N 1 2 321.852 4.328 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1cccc2c1CCOC2 ZINC001621051640 1056011134 /nfs/dbraw/zinc/01/11/34/1056011134.db2.gz MWVSLNAJHWTRKR-UHFFFAOYSA-N 1 2 321.424 4.302 20 0 DIADLO COc1ccc2c(c1)nccc2-c1ccc(-n2cc[nH+]c2)cc1 ZINC001239678754 1056021637 /nfs/dbraw/zinc/02/16/37/1056021637.db2.gz VXUKFJJLGPXVDS-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO c1ccc(C[C@H]([NH2+]Cc2nnc(C3CC3)o2)c2ccccc2)cc1 ZINC000072557395 1056031208 /nfs/dbraw/zinc/03/12/08/1056031208.db2.gz BOYJYKQQJVTCNK-SFHVURJKSA-N 1 2 319.408 4.021 20 0 DIADLO CCC[C@@H](NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1)c1ccccc1 ZINC001540587324 1056048482 /nfs/dbraw/zinc/04/84/82/1056048482.db2.gz GABPVTNGFFKGMQ-QZTJIDSGSA-N 1 2 313.445 4.128 20 0 DIADLO COc1ccc2cc(-c3cn4cc[nH+]c4cc3OC)ccc2c1 ZINC001239840602 1056101777 /nfs/dbraw/zinc/10/17/77/1056101777.db2.gz IVWWQDVBRGVXIZ-UHFFFAOYSA-N 1 2 304.349 4.172 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@@H]2COc3c2cccc3Cl)n1 ZINC000765802280 1056112719 /nfs/dbraw/zinc/11/27/19/1056112719.db2.gz KDKJIVMDTVXLCK-GFCCVEGCSA-N 1 2 322.861 4.317 20 0 DIADLO c1cn(Cc2ccc(-c3cccnc3-c3ccccc3)nc2)c[nH+]1 ZINC001239873003 1056123340 /nfs/dbraw/zinc/12/33/40/1056123340.db2.gz WSZIHZVCGKWPRU-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO Cc1cc(NC(=O)CC2(C)CCCCC2)ccc1-n1cc[nH+]c1 ZINC001542875526 1056161066 /nfs/dbraw/zinc/16/10/66/1056161066.db2.gz KTFVDIOYBOYVBX-UHFFFAOYSA-N 1 2 311.429 4.480 20 0 DIADLO Cc1ccc(NCc2ccc(Br)c(C)c2)c(C)[nH+]1 ZINC000094664723 1056161982 /nfs/dbraw/zinc/16/19/82/1056161982.db2.gz ACKLMSRSNYXJAC-UHFFFAOYSA-N 1 2 305.219 4.381 20 0 DIADLO Cc1ccc([C@@H](C)C(=O)Nc2ccc(-c3[nH]c(C)c(C)[nH+]3)cc2)o1 ZINC000921660016 1056168407 /nfs/dbraw/zinc/16/84/07/1056168407.db2.gz IFVNXHGOWAFXHR-GFCCVEGCSA-N 1 2 323.396 4.337 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3cc(C(C)C)no3)cc2)[nH+]c1C ZINC000921663331 1056171077 /nfs/dbraw/zinc/17/10/77/1056171077.db2.gz VMMBTXWNPOSXJN-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO COc1cccc(Sc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001611772622 1056187472 /nfs/dbraw/zinc/18/74/72/1056187472.db2.gz BGGFSBCIPMXZIF-UHFFFAOYSA-N 1 2 307.378 4.042 20 0 DIADLO Cc1nc(NC[C@H](Nc2ccccc2)C(C)C)c2c([nH+]1)CCCC2 ZINC001611770508 1056187799 /nfs/dbraw/zinc/18/77/99/1056187799.db2.gz XLSSSGOCEWYLQW-IBGZPJMESA-N 1 2 324.472 4.212 20 0 DIADLO CCOc1ccc2cc(-c3nc4c(ccn4C)c[nH+]3)ccc2c1 ZINC001239954091 1056190487 /nfs/dbraw/zinc/19/04/87/1056190487.db2.gz ALIBBTHQZMUWLN-UHFFFAOYSA-N 1 2 303.365 4.187 20 0 DIADLO CC(C)Oc1ccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)cc1 ZINC001239961049 1056200772 /nfs/dbraw/zinc/20/07/72/1056200772.db2.gz JTDJVFABEOKQPR-UHFFFAOYSA-N 1 2 305.368 4.481 20 0 DIADLO CCc1cc(NCCCc2ccc(Cl)cc2)nc(CC)[nH+]1 ZINC001611914928 1056209696 /nfs/dbraw/zinc/20/96/96/1056209696.db2.gz OJZKXAIWBRJSIC-UHFFFAOYSA-N 1 2 303.837 4.300 20 0 DIADLO CCc1cc(NCC2(Sc3ccccc3)CC2)nc(CC)[nH+]1 ZINC001611942849 1056213501 /nfs/dbraw/zinc/21/35/01/1056213501.db2.gz MKUHRJMVPMYLJC-UHFFFAOYSA-N 1 2 313.470 4.338 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)CCC2 ZINC000765820009 1056216536 /nfs/dbraw/zinc/21/65/36/1056216536.db2.gz RWWXYVAYRIJFKC-LRDDRELGSA-N 1 2 319.399 4.470 20 0 DIADLO Cc1nc(NCc2ccccc2OCC2CC2)c2c([nH+]1)CCCC2 ZINC001612015050 1056222508 /nfs/dbraw/zinc/22/25/08/1056222508.db2.gz YMTKNAOSCSYXPT-UHFFFAOYSA-N 1 2 323.440 4.065 20 0 DIADLO CC1CC[NH+](c2ccc(Nc3nc(C4CC4)ns3)cc2)CC1 ZINC001612014021 1056222776 /nfs/dbraw/zinc/22/27/76/1056222776.db2.gz FJLHPJSXHWGOGQ-UHFFFAOYSA-N 1 2 314.458 4.395 20 0 DIADLO COc1c(C)cccc1C[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000655833518 1056233734 /nfs/dbraw/zinc/23/37/34/1056233734.db2.gz QJHHFOQKMSCOTI-UHFFFAOYSA-N 1 2 304.459 4.047 20 0 DIADLO CC(C)CC(C)(C)CNc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001612077155 1056235210 /nfs/dbraw/zinc/23/52/10/1056235210.db2.gz RXXRRDLCWFIXPK-UHFFFAOYSA-N 1 2 303.454 4.066 20 0 DIADLO Cc1cc(N2CCCC2)nc(-c2ccc(N3CCCCC3)cc2)[nH+]1 ZINC001239999962 1056238497 /nfs/dbraw/zinc/23/84/97/1056238497.db2.gz MSLDWZSEAGUXNM-UHFFFAOYSA-N 1 2 322.456 4.043 20 0 DIADLO Cc1cc(NC[C@@H](C)c2nc3ccccc3s2)nc(C2CC2)[nH+]1 ZINC001612114394 1056241739 /nfs/dbraw/zinc/24/17/39/1056241739.db2.gz GPDZCTWYDAHWRY-LLVKDONJSA-N 1 2 324.453 4.488 20 0 DIADLO CCCC[C@@H](Nc1[nH+]cnc2c1cnn2C(C)(C)C)C1CCC1 ZINC001612139140 1056244839 /nfs/dbraw/zinc/24/48/39/1056244839.db2.gz MQIBKJMGVCHJEJ-OAHLLOKOSA-N 1 2 315.465 4.352 20 0 DIADLO CC1(C)CCC(CC(=O)Nc2ccccc2-n2cc[nH+]c2)CC1 ZINC001543547381 1056247926 /nfs/dbraw/zinc/24/79/26/1056247926.db2.gz FPZHUKRMURMLGT-UHFFFAOYSA-N 1 2 311.429 4.417 20 0 DIADLO CCc1noc(C)c1[C@@H](C)[NH2+][C@@H]1CCCc2cn(C(C)C)nc21 ZINC000765822348 1056253878 /nfs/dbraw/zinc/25/38/78/1056253878.db2.gz ZRVPFCDAIYQTNF-MLGOLLRUSA-N 1 2 316.449 4.051 20 0 DIADLO CCc1cc(N(C)Cc2cccc(OC(C)C)c2)nc(CC)[nH+]1 ZINC001612212065 1056254319 /nfs/dbraw/zinc/25/43/19/1056254319.db2.gz ZDNZCSQIISBFNX-UHFFFAOYSA-N 1 2 313.445 4.025 20 0 DIADLO Cc1nc(N2CCC(Cc3ccc(C(C)C)cc3)CC2)cc[nH+]1 ZINC001612221277 1056257453 /nfs/dbraw/zinc/25/74/53/1056257453.db2.gz OFQUKGPSGTWHDR-UHFFFAOYSA-N 1 2 309.457 4.368 20 0 DIADLO CC[C@@H]([NH2+]CC(=O)c1ccccc1F)c1cc(F)ccc1F ZINC001168633049 1056258278 /nfs/dbraw/zinc/25/82/78/1056258278.db2.gz KZNNSBXCLBODNA-MRXNPFEDSA-N 1 2 307.315 4.028 20 0 DIADLO CCCc1ccc(CNc2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC001168635964 1056279833 /nfs/dbraw/zinc/27/98/33/1056279833.db2.gz SYULMQZNBFUJRL-UHFFFAOYSA-N 1 2 305.425 4.496 20 0 DIADLO c1ccc2c(c1)NCC[C@H]2Nc1cc(-c2ccncc2)cc[nH+]1 ZINC001168640230 1056309311 /nfs/dbraw/zinc/30/93/11/1056309311.db2.gz XQNYNIMFCMQINH-GOSISDBHSA-N 1 2 302.381 4.112 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3C[C@@H]4C[C@@H]4C[C@@H]3C)c2)[nH+]c1C ZINC001543835532 1056309323 /nfs/dbraw/zinc/30/93/23/1056309323.db2.gz ULWLMXRMWABVNC-TWUUUVDRSA-N 1 2 323.440 4.314 20 0 DIADLO CCCCNC(=O)c1cccc(-c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001240086978 1056314010 /nfs/dbraw/zinc/31/40/10/1056314010.db2.gz CVNHKHXZJBQXQN-UHFFFAOYSA-N 1 2 319.408 4.069 20 0 DIADLO CCCCOc1ccc(C(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)cc1 ZINC000010896244 1056316442 /nfs/dbraw/zinc/31/64/42/1056316442.db2.gz IVBSVCDDXMCDHD-UHFFFAOYSA-N 1 2 323.396 4.303 20 0 DIADLO Cc1nc(N[C@@H]2c3ccccc3CC[C@@H]2F)c2c([nH+]1)CCCC2 ZINC001612807342 1056329159 /nfs/dbraw/zinc/32/91/59/1056329159.db2.gz SOXYSEPBXMSMJJ-FUHWJXTLSA-N 1 2 311.404 4.101 20 0 DIADLO COc1ccc(-c2ccc(-c3ccn4cc(N)[nH+]c4c3)cc2)cc1 ZINC001240104794 1056329994 /nfs/dbraw/zinc/32/99/94/1056329994.db2.gz SVQXQPCHIHYSKN-UHFFFAOYSA-N 1 2 315.376 4.259 20 0 DIADLO Cc1cc(NCc2ccc(C(F)(F)F)s2)nc(C2CC2)[nH+]1 ZINC001612850860 1056333394 /nfs/dbraw/zinc/33/33/94/1056333394.db2.gz YNWILIHFWUQBHR-UHFFFAOYSA-N 1 2 313.348 4.355 20 0 DIADLO CN(C)c1cc(-c2cccc(C(=O)Nc3ccccc3)c2)cc[nH+]1 ZINC001240114178 1056337756 /nfs/dbraw/zinc/33/77/56/1056337756.db2.gz UMWNWTMKCXWJAN-UHFFFAOYSA-N 1 2 317.392 4.067 20 0 DIADLO CC(C)c1cc(NC[C@H]2CCC3(CCC3)CO2)nc(C(C)C)[nH+]1 ZINC001612907957 1056338530 /nfs/dbraw/zinc/33/85/30/1056338530.db2.gz FPXLKUIHCIUXPR-OAHLLOKOSA-N 1 2 317.477 4.485 20 0 DIADLO CSC1CCC(CNc2cc(C)[nH+]c(C3CCC3)n2)CC1 ZINC001612917145 1056339331 /nfs/dbraw/zinc/33/93/31/1056339331.db2.gz PGHLILJFROFNCT-UHFFFAOYSA-N 1 2 305.491 4.386 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(N[C@@H]2CCNc3ccccc32)c1 ZINC001168645285 1056339582 /nfs/dbraw/zinc/33/95/82/1056339582.db2.gz ONVBJZFBSBOFRL-GOSISDBHSA-N 1 2 304.397 4.056 20 0 DIADLO c1cc2c[nH+]c(-c3cccc(OCc4ccccc4)c3)nc2[nH]1 ZINC001240120812 1056340620 /nfs/dbraw/zinc/34/06/20/1056340620.db2.gz NYFLQSOEJIWNAQ-UHFFFAOYSA-N 1 2 301.349 4.156 20 0 DIADLO Nc1cn2ccc(-c3cccc(OCc4ccccc4)c3)cc2[nH+]1 ZINC001240121784 1056342305 /nfs/dbraw/zinc/34/23/05/1056342305.db2.gz DTTGFIJKBFBMNN-UHFFFAOYSA-N 1 2 315.376 4.163 20 0 DIADLO CC(C)c1cc(N[C@@H]2CCOC23CCCC3)nc(C(C)C)[nH+]1 ZINC001613042411 1056346134 /nfs/dbraw/zinc/34/61/34/1056346134.db2.gz OCORUBBLEITNIJ-OAHLLOKOSA-N 1 2 303.450 4.237 20 0 DIADLO CC(C)c1cc(N2CCO[C@H](C(C)(C)C)CC2)nc(C(C)C)[nH+]1 ZINC001613073180 1056350723 /nfs/dbraw/zinc/35/07/23/1056350723.db2.gz UGPDVIGJXJZSET-INIZCTEOSA-N 1 2 319.493 4.365 20 0 DIADLO C[C@@H](CCSc1[nH+]cc2ccccn21)OCc1ccccc1 ZINC001613234907 1056361735 /nfs/dbraw/zinc/36/17/35/1056361735.db2.gz UWIRGBXTGDSVQN-HNNXBMFYSA-N 1 2 312.438 4.422 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@H](c2ccc(F)cc2)C2CC2)n1 ZINC000921713626 1056370909 /nfs/dbraw/zinc/37/09/09/1056370909.db2.gz BODIBFVWAWFXQO-KRWDZBQOSA-N 1 2 302.393 4.352 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@@H](c2ccc(F)cc2)C2CC2)n1 ZINC000921713627 1056371657 /nfs/dbraw/zinc/37/16/57/1056371657.db2.gz BODIBFVWAWFXQO-QGZVFWFLSA-N 1 2 302.393 4.352 20 0 DIADLO Cc1ccnc(-c2cc(C)cc(-c3ccc4[nH+]ccn4c3)n2)c1 ZINC001240218846 1056376604 /nfs/dbraw/zinc/37/66/04/1056376604.db2.gz MBRJLMSUEOIDMJ-UHFFFAOYSA-N 1 2 300.365 4.075 20 0 DIADLO Cc1cc(-c2ccccc2OCc2ccc(F)cc2)c[nH+]c1N ZINC001240262926 1056396833 /nfs/dbraw/zinc/39/68/33/1056396833.db2.gz PRHOQMSJJRICLD-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000303733258 1056407890 /nfs/dbraw/zinc/40/78/90/1056407890.db2.gz FLDPZGVHYLLFIY-MOPGFXCFSA-N 1 2 317.379 4.489 20 0 DIADLO CC[C@H](c1ccc(F)cc1)[N@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000303733258 1056407897 /nfs/dbraw/zinc/40/78/97/1056407897.db2.gz FLDPZGVHYLLFIY-MOPGFXCFSA-N 1 2 317.379 4.489 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N3CC[C@@H](C)c4cccc(C)c43)ccn12 ZINC001544328931 1056408553 /nfs/dbraw/zinc/40/85/53/1056408553.db2.gz BZMLGROYMNBOPS-CYBMUJFWSA-N 1 2 319.408 4.105 20 0 DIADLO CCc1ccc(F)cc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001544350504 1056413228 /nfs/dbraw/zinc/41/32/28/1056413228.db2.gz XENZXTARLJYLLW-UHFFFAOYSA-N 1 2 309.344 4.031 20 0 DIADLO C[C@]1(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)C[C@@H]1c1ccccc1 ZINC001544350246 1056413442 /nfs/dbraw/zinc/41/34/42/1056413442.db2.gz SGXPQSBDYJCMQN-XLIONFOSSA-N 1 2 317.392 4.209 20 0 DIADLO CC(C)(C)C[C@@H]1CCN(C(=O)c2cccc3[nH+]ccn32)C1(C)C ZINC001584834597 1056430147 /nfs/dbraw/zinc/43/01/47/1056430147.db2.gz RMVIQXKLWWUFNT-AWEZNQCLSA-N 1 2 313.445 4.011 20 0 DIADLO FC(F)(F)c1cc(-c2ccc(Cn3cc[nH+]c3)cc2)ccn1 ZINC001240339624 1056433647 /nfs/dbraw/zinc/43/36/47/1056433647.db2.gz AFOMLWYGJHYHDY-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO Cc1ccccc1N1CC[NH+](Cc2c(F)cccc2Cl)CC1 ZINC000014218223 1056436854 /nfs/dbraw/zinc/43/68/54/1056436854.db2.gz XSGSJIWUSCEODM-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO CCCCc1noc(C[N@H+](Cc2ccoc2)C2CCCCC2)n1 ZINC000303954595 1056442547 /nfs/dbraw/zinc/44/25/47/1056442547.db2.gz WRIUKRODOSOHLC-UHFFFAOYSA-N 1 2 317.433 4.340 20 0 DIADLO CCCCc1noc(C[N@@H+](Cc2ccoc2)C2CCCCC2)n1 ZINC000303954595 1056442551 /nfs/dbraw/zinc/44/25/51/1056442551.db2.gz WRIUKRODOSOHLC-UHFFFAOYSA-N 1 2 317.433 4.340 20 0 DIADLO COc1ccc(Cl)cc1COc1cccc(-n2cc[nH+]c2)c1 ZINC000303960344 1056444571 /nfs/dbraw/zinc/44/45/71/1056444571.db2.gz ZFNHKCMOOIEDEZ-UHFFFAOYSA-N 1 2 314.772 4.113 20 0 DIADLO Cc1ccc(C[NH2+][C@H](c2cccc(Cl)c2)c2ccccn2)cn1 ZINC000156238204 1056447097 /nfs/dbraw/zinc/44/70/97/1056447097.db2.gz JSBULQNCQCUXES-LJQANCHMSA-N 1 2 323.827 4.318 20 0 DIADLO C/C(=C\c1ccccc1)CN(C)C(=O)c1c(C)cc(C)[nH+]c1C ZINC001584967533 1056453296 /nfs/dbraw/zinc/45/32/96/1056453296.db2.gz XUQXLLFCPLKSPW-SDNWHVSQSA-N 1 2 308.425 4.182 20 0 DIADLO Cc1cc(NC(=O)C2(C3CCCCC3)CC2)ccc1-n1cc[nH+]c1 ZINC001614884286 1056455851 /nfs/dbraw/zinc/45/58/51/1056455851.db2.gz RDRREKZJNRQJJM-UHFFFAOYSA-N 1 2 323.440 4.480 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)nc1Cl ZINC001615187478 1056472240 /nfs/dbraw/zinc/47/22/40/1056472240.db2.gz IHTNNAWGFOWZPE-UHFFFAOYSA-N 1 2 322.786 4.486 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)nc1Cl ZINC001615187478 1056472246 /nfs/dbraw/zinc/47/22/46/1056472246.db2.gz IHTNNAWGFOWZPE-UHFFFAOYSA-N 1 2 322.786 4.486 20 0 DIADLO COc1nscc1C[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001615188324 1056472637 /nfs/dbraw/zinc/47/26/37/1056472637.db2.gz VZTHGCJCKVJEOG-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1nscc1C[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001615188324 1056472643 /nfs/dbraw/zinc/47/26/43/1056472643.db2.gz VZTHGCJCKVJEOG-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@@H+]2CCCSC(C)(C)C)no1 ZINC001615214380 1056478285 /nfs/dbraw/zinc/47/82/85/1056478285.db2.gz BGOIMPUKNMZKDB-ZDUSSCGKSA-N 1 2 311.495 4.081 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@H+]2CCCSC(C)(C)C)no1 ZINC001615214380 1056478289 /nfs/dbraw/zinc/47/82/89/1056478289.db2.gz BGOIMPUKNMZKDB-ZDUSSCGKSA-N 1 2 311.495 4.081 20 0 DIADLO CCOC(=O)C[N@H+](CC)Cc1ccc(C(C)C)cc1C(C)C ZINC001615280362 1056486421 /nfs/dbraw/zinc/48/64/21/1056486421.db2.gz RILGSHXMZRVOKL-UHFFFAOYSA-N 1 2 305.462 4.318 20 0 DIADLO CCOC(=O)C[N@@H+](CC)Cc1ccc(C(C)C)cc1C(C)C ZINC001615280362 1056486424 /nfs/dbraw/zinc/48/64/24/1056486424.db2.gz RILGSHXMZRVOKL-UHFFFAOYSA-N 1 2 305.462 4.318 20 0 DIADLO CC1(C[N@@H+]2CCO[C@@H](c3ccccc3Br)C2)CCC1 ZINC001615354497 1056499033 /nfs/dbraw/zinc/49/90/33/1056499033.db2.gz QNAWQSFHNQSGMC-OAHLLOKOSA-N 1 2 324.262 4.013 20 0 DIADLO CC1(C[N@H+]2CCO[C@@H](c3ccccc3Br)C2)CCC1 ZINC001615354497 1056499038 /nfs/dbraw/zinc/49/90/38/1056499038.db2.gz QNAWQSFHNQSGMC-OAHLLOKOSA-N 1 2 324.262 4.013 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1C)Cc1c(F)cccc1F ZINC001615378974 1056500658 /nfs/dbraw/zinc/50/06/58/1056500658.db2.gz KXEHLCHGAYUHDE-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1C)Cc1c(F)cccc1F ZINC001615378974 1056500667 /nfs/dbraw/zinc/50/06/67/1056500667.db2.gz KXEHLCHGAYUHDE-UHFFFAOYSA-N 1 2 305.368 4.304 20 0 DIADLO Cc1cn2c(cccc2-c2ccc(C(=O)OC(C)(C)C)cc2)[nH+]1 ZINC001240438447 1056509694 /nfs/dbraw/zinc/50/96/94/1056509694.db2.gz DPNAVLBYQHWUPD-UHFFFAOYSA-N 1 2 308.381 4.265 20 0 DIADLO CC[C@](C)([NH2+]Cc1cc(Cl)ccc1OC)c1nccs1 ZINC000172672936 1056511778 /nfs/dbraw/zinc/51/17/78/1056511778.db2.gz KCDCFWQUNZSNBF-HNNXBMFYSA-N 1 2 310.850 4.220 20 0 DIADLO CSc1cc(C)ccc1C[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000921835520 1056532193 /nfs/dbraw/zinc/53/21/93/1056532193.db2.gz XAWVXJMOWXXQDB-UHFFFAOYSA-N 1 2 304.459 4.292 20 0 DIADLO CC(C)COC(=O)Nc1ccc(-c2ccn3cc[nH+]c3c2)cc1 ZINC001240503670 1056541147 /nfs/dbraw/zinc/54/11/47/1056541147.db2.gz RLOQEIOOKZBSMH-UHFFFAOYSA-N 1 2 309.369 4.206 20 0 DIADLO c1cn2ccc(-c3cc(SCc4ccccc4)ncn3)cc2[nH+]1 ZINC001240504853 1056543178 /nfs/dbraw/zinc/54/31/78/1056543178.db2.gz ZXPLHVKWORDDJH-UHFFFAOYSA-N 1 2 318.405 4.084 20 0 DIADLO CN(C)c1ccc(-c2ccn3cc[nH+]c3c2)c(C(F)(F)F)c1 ZINC001240508536 1056543642 /nfs/dbraw/zinc/54/36/42/1056543642.db2.gz BLTHWALOYOTWNW-UHFFFAOYSA-N 1 2 305.303 4.086 20 0 DIADLO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cc1ncsc1Br ZINC001615600714 1056544236 /nfs/dbraw/zinc/54/42/36/1056544236.db2.gz NFLKYFVLFSFMKN-CMPLNLGQSA-N 1 2 317.296 4.306 20 0 DIADLO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1ncsc1Br ZINC001615600714 1056544251 /nfs/dbraw/zinc/54/42/51/1056544251.db2.gz NFLKYFVLFSFMKN-CMPLNLGQSA-N 1 2 317.296 4.306 20 0 DIADLO CCOC(=O)c1ccc(-c2ccn3cc[nH+]c3c2)c2ccccc12 ZINC001240511171 1056544448 /nfs/dbraw/zinc/54/44/48/1056544448.db2.gz AQUDSNPBGLXDJU-UHFFFAOYSA-N 1 2 316.360 4.331 20 0 DIADLO CC(C)(C)OC(=O)c1ccc(-c2ccn3cc[nH+]c3c2)c(F)c1 ZINC001240511592 1056544470 /nfs/dbraw/zinc/54/44/70/1056544470.db2.gz IPPUCFZLTBTRNY-UHFFFAOYSA-N 1 2 312.344 4.096 20 0 DIADLO CCOc1ccc(-c2ccn3cc[nH+]c3c2)c(C(F)(F)F)c1 ZINC001240511985 1056545208 /nfs/dbraw/zinc/54/52/08/1056545208.db2.gz NXIJUORYULKMGS-UHFFFAOYSA-N 1 2 306.287 4.419 20 0 DIADLO Fc1ccc(COc2cc(-c3ccn4cc[nH+]c4c3)ccn2)cc1 ZINC001240513396 1056546054 /nfs/dbraw/zinc/54/60/54/1056546054.db2.gz PSCPQKOWKUASGJ-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO CCC(CC)(CNC(=O)c1cc2c[nH+]ccc2[nH]1)c1ccccc1 ZINC001545021083 1056547658 /nfs/dbraw/zinc/54/76/58/1056547658.db2.gz HEUJMUFYHBXACU-UHFFFAOYSA-N 1 2 321.424 4.051 20 0 DIADLO CC[C@@]1(C)CCC[N@H+](Cc2nc(C)c(Br)s2)C1 ZINC001615649794 1056553074 /nfs/dbraw/zinc/55/30/74/1056553074.db2.gz NUWDBNUOCICINI-ZDUSSCGKSA-N 1 2 317.296 4.226 20 0 DIADLO CC[C@@]1(C)CCC[N@@H+](Cc2nc(C)c(Br)s2)C1 ZINC001615649794 1056553088 /nfs/dbraw/zinc/55/30/88/1056553088.db2.gz NUWDBNUOCICINI-ZDUSSCGKSA-N 1 2 317.296 4.226 20 0 DIADLO Fc1ccc(Br)cc1CNc1cc2cc[nH]c2c[nH+]1 ZINC000672162540 1056553065 /nfs/dbraw/zinc/55/30/65/1056553065.db2.gz XPZKRBODGTWBGT-UHFFFAOYSA-N 1 2 320.165 4.077 20 0 DIADLO COc1ccc2ccccc2c1CNc1cc2cc[nH]c2c[nH+]1 ZINC000672160326 1056554751 /nfs/dbraw/zinc/55/47/51/1056554751.db2.gz CBKFOMFROPWIBD-UHFFFAOYSA-N 1 2 303.365 4.337 20 0 DIADLO CC[C@H](C)C[C@H](C)Nc1[nH+]cccc1CC(=O)OC(C)(C)C ZINC001168688766 1056563082 /nfs/dbraw/zinc/56/30/82/1056563082.db2.gz DMLNPDOAZNZZLE-KBPBESRZSA-N 1 2 306.450 4.202 20 0 DIADLO C[N@H+](Cc1cc2ccccc2[nH]1)Cc1cc(O)ccc1Cl ZINC001615782997 1056576791 /nfs/dbraw/zinc/57/67/91/1056576791.db2.gz POBNCHPJPDPJCA-UHFFFAOYSA-N 1 2 300.789 4.159 20 0 DIADLO C[N@@H+](Cc1cc2ccccc2[nH]1)Cc1cc(O)ccc1Cl ZINC001615782997 1056576800 /nfs/dbraw/zinc/57/68/00/1056576800.db2.gz POBNCHPJPDPJCA-UHFFFAOYSA-N 1 2 300.789 4.159 20 0 DIADLO COc1cc(C[N@@H+]2CCOC3(C2)CCCCCC3)ccc1Cl ZINC001615868382 1056586814 /nfs/dbraw/zinc/58/68/14/1056586814.db2.gz QOGPNUXNOGQKET-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO COc1cc(C[N@H+]2CCOC3(C2)CCCCCC3)ccc1Cl ZINC001615868382 1056586822 /nfs/dbraw/zinc/58/68/22/1056586822.db2.gz QOGPNUXNOGQKET-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2ccn(-c3ccccc3)n2)c1 ZINC000063518202 1056590964 /nfs/dbraw/zinc/59/09/64/1056590964.db2.gz QNBVONAWADIDCA-FQEVSTJZSA-N 1 2 321.399 4.349 20 0 DIADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2ccn(-c3ccccc3)n2)c1 ZINC000063518202 1056590972 /nfs/dbraw/zinc/59/09/72/1056590972.db2.gz QNBVONAWADIDCA-FQEVSTJZSA-N 1 2 321.399 4.349 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000063517644 1056591896 /nfs/dbraw/zinc/59/18/96/1056591896.db2.gz DBRRGKMJDZBBQD-CQSZACIVSA-N 1 2 309.438 4.053 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000063517644 1056591905 /nfs/dbraw/zinc/59/19/05/1056591905.db2.gz DBRRGKMJDZBBQD-CQSZACIVSA-N 1 2 309.438 4.053 20 0 DIADLO CCOC(=O)CC(C)(C)CC[N@H+](CC)c1cccc(C)c1C ZINC001615923382 1056598726 /nfs/dbraw/zinc/59/87/26/1056598726.db2.gz HIELUQIAFWFTHY-UHFFFAOYSA-N 1 2 305.462 4.499 20 0 DIADLO CCOC(=O)CC(C)(C)CC[N@@H+](CC)c1cccc(C)c1C ZINC001615923382 1056598740 /nfs/dbraw/zinc/59/87/40/1056598740.db2.gz HIELUQIAFWFTHY-UHFFFAOYSA-N 1 2 305.462 4.499 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(N2CCCC2)cc1 ZINC001240592107 1056599018 /nfs/dbraw/zinc/59/90/18/1056599018.db2.gz VJGLNLOFHDRZNX-UHFFFAOYSA-N 1 2 319.408 4.148 20 0 DIADLO Cn1ccc2c[nH+]c(-c3ccc(-c4ccc(O)cc4)cc3)nc21 ZINC001240595346 1056601358 /nfs/dbraw/zinc/60/13/58/1056601358.db2.gz NRPGRMFBQLXKMF-UHFFFAOYSA-N 1 2 301.349 4.008 20 0 DIADLO C[C@H]1CSc2ccccc2N1Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001615995723 1056603972 /nfs/dbraw/zinc/60/39/72/1056603972.db2.gz XCEIXBLGFWSMEV-HNNXBMFYSA-N 1 2 321.449 4.373 20 0 DIADLO CCc1ncc(C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)o1 ZINC001616013938 1056605043 /nfs/dbraw/zinc/60/50/43/1056605043.db2.gz OSDFYIZYKQRHMV-LJQANCHMSA-N 1 2 310.372 4.255 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCOc3ccccc3[C@H]2C)c1 ZINC001616041738 1056607319 /nfs/dbraw/zinc/60/73/19/1056607319.db2.gz ATOAEHNIECJOOY-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCOc3ccccc3[C@H]2C)c1 ZINC001616041738 1056607324 /nfs/dbraw/zinc/60/73/24/1056607324.db2.gz ATOAEHNIECJOOY-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO CC[C@@H](C)C[C@H](C)Nc1ccc(C)cc1C[NH+]1CCOCC1 ZINC001168694395 1056609218 /nfs/dbraw/zinc/60/92/18/1056609218.db2.gz PTFHDAXMLXUEJR-WBVHZDCISA-N 1 2 304.478 4.064 20 0 DIADLO CCOc1c(Cl)cc(-c2ccn3cc(N)[nH+]c3c2)cc1Cl ZINC001240604173 1056609928 /nfs/dbraw/zinc/60/99/28/1056609928.db2.gz ARJDTIWLTZHQIU-UHFFFAOYSA-N 1 2 322.195 4.289 20 0 DIADLO Clc1cccc2c(N3CCC4(CCOCC4)CC3)cc[nH+]c12 ZINC000672297187 1056616305 /nfs/dbraw/zinc/61/63/05/1056616305.db2.gz CKMMBTDPCJFCHE-UHFFFAOYSA-N 1 2 316.832 4.285 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cc(-c3cccs3)on2)s1 ZINC000076342454 1056623314 /nfs/dbraw/zinc/62/33/14/1056623314.db2.gz OITBRUOVNUNASP-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cc(-c3cccs3)on2)s1 ZINC000076342454 1056623319 /nfs/dbraw/zinc/62/33/19/1056623319.db2.gz OITBRUOVNUNASP-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO CC(C)C[C@H]1CCC[N@H+](Cc2noc(C3CCCCC3)n2)C1 ZINC001616323273 1056634813 /nfs/dbraw/zinc/63/48/13/1056634813.db2.gz UAPBIKNZFDWVFL-OAHLLOKOSA-N 1 2 305.466 4.375 20 0 DIADLO CC(C)C[C@H]1CCC[N@@H+](Cc2noc(C3CCCCC3)n2)C1 ZINC001616323273 1056634821 /nfs/dbraw/zinc/63/48/21/1056634821.db2.gz UAPBIKNZFDWVFL-OAHLLOKOSA-N 1 2 305.466 4.375 20 0 DIADLO Cc1[nH+]c(C(C)(C)C)nc(N[C@@H](C)CCCC(C)(C)O)c1C ZINC001168697257 1056653548 /nfs/dbraw/zinc/65/35/48/1056653548.db2.gz AIRYKLSEEBIKSH-LBPRGKRZSA-N 1 2 307.482 4.133 20 0 DIADLO COc1c(F)ccc(F)c1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001240724335 1056662674 /nfs/dbraw/zinc/66/26/74/1056662674.db2.gz AHMPCXYLPQAAMI-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO Cc1c(F)cccc1-c1ncnc2c1C[N@H+](Cc1ccccc1)C2 ZINC001240727674 1056664850 /nfs/dbraw/zinc/66/48/50/1056664850.db2.gz SKYOTQFHUKEXTC-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO Cc1c(F)cccc1-c1ncnc2c1C[N@@H+](Cc1ccccc1)C2 ZINC001240727674 1056664859 /nfs/dbraw/zinc/66/48/59/1056664859.db2.gz SKYOTQFHUKEXTC-UHFFFAOYSA-N 1 2 319.383 4.107 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2nc(-c3ccccc3)c[nH]2)c1C ZINC001616488638 1056665015 /nfs/dbraw/zinc/66/50/15/1056665015.db2.gz GLFHSACCQKOEQV-UHFFFAOYSA-N 1 2 321.424 4.026 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2nc(-c3ccccc3)c[nH]2)c1C ZINC001616488638 1056665024 /nfs/dbraw/zinc/66/50/24/1056665024.db2.gz GLFHSACCQKOEQV-UHFFFAOYSA-N 1 2 321.424 4.026 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccccc2OCCC(C)C)nn1C ZINC000282320162 1056665264 /nfs/dbraw/zinc/66/52/64/1056665264.db2.gz UGLJXHLWAVFHBS-INIZCTEOSA-N 1 2 315.461 4.004 20 0 DIADLO Cc1c(F)cccc1-c1ccc(-c2nc3c(o2)CC[N@@H+](C)C3)cc1 ZINC001240733884 1056668558 /nfs/dbraw/zinc/66/85/58/1056668558.db2.gz YRCJJYWLRXIVGU-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO Cc1c(F)cccc1-c1ccc(-c2nc3c(o2)CC[N@H+](C)C3)cc1 ZINC001240733884 1056668564 /nfs/dbraw/zinc/66/85/64/1056668564.db2.gz YRCJJYWLRXIVGU-UHFFFAOYSA-N 1 2 322.383 4.444 20 0 DIADLO CC(C)c1ccc(C(C)(C)NC(=O)c2cccc3[nH+]ccn32)cc1 ZINC001586154331 1056684361 /nfs/dbraw/zinc/68/43/61/1056684361.db2.gz VPTXDBOKDNYITB-UHFFFAOYSA-N 1 2 321.424 4.123 20 0 DIADLO CC[NH+](CC)[C@@H](C(=O)Oc1ccc(C)c(F)c1)c1ccccc1 ZINC001586189655 1056687874 /nfs/dbraw/zinc/68/78/74/1056687874.db2.gz ITXQLVQMUSRMKZ-GOSISDBHSA-N 1 2 315.388 4.123 20 0 DIADLO CC(C)N1CCCC[C@@H]1C[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC001616662913 1056696928 /nfs/dbraw/zinc/69/69/28/1056696928.db2.gz VDLNNAINUNUPJG-UONOGXRCSA-N 1 2 312.860 4.393 20 0 DIADLO CC(C)N1CCCC[C@H]1C[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC001616662910 1056697288 /nfs/dbraw/zinc/69/72/88/1056697288.db2.gz VDLNNAINUNUPJG-KBPBESRZSA-N 1 2 312.860 4.393 20 0 DIADLO FC(F)(F)c1cncc(-c2ccccc2Cn2cc[nH+]c2)c1 ZINC001240792258 1056703385 /nfs/dbraw/zinc/70/33/85/1056703385.db2.gz WIZMOHBXDNDZQO-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO CCC[C@@](C)(NC(=O)c1ccn2c(C)c[nH+]c2c1)c1ccccc1 ZINC001586348810 1056719038 /nfs/dbraw/zinc/71/90/38/1056719038.db2.gz VXWDHZFICVIWBF-HXUWFJFHSA-N 1 2 321.424 4.088 20 0 DIADLO Cc1cc(NC(=O)[C@H](CC(C)C)n2cc[nH+]c2)ccc1C1CC1 ZINC001616912527 1056737283 /nfs/dbraw/zinc/73/72/83/1056737283.db2.gz JRAQJRRMYHJRFT-SFHVURJKSA-N 1 2 311.429 4.295 20 0 DIADLO CCOc1ccc([C@H](C)[NH2+][C@H]2CCCC2(F)F)cc1OCC ZINC000672621748 1056740267 /nfs/dbraw/zinc/74/02/67/1056740267.db2.gz HYAHFVOPYISMAE-LRDDRELGSA-N 1 2 313.388 4.322 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCC1(F)F)c1ccc(OCC(F)(F)F)cc1 ZINC000672621856 1056740812 /nfs/dbraw/zinc/74/08/12/1056740812.db2.gz MCVLSIOZQICEJF-GWCFXTLKSA-N 1 2 323.305 4.466 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccc2ncsc2c1 ZINC000922017965 1056744453 /nfs/dbraw/zinc/74/44/53/1056744453.db2.gz DIRQIBKGHOQJOW-NSHDSACASA-N 1 2 315.442 4.433 20 0 DIADLO Cc1ccc(F)cc1-c1cc(F)cc(C)c1C[NH+]1CCOCC1 ZINC001240921837 1056759175 /nfs/dbraw/zinc/75/91/75/1056759175.db2.gz MVNSNCXKBVJJJQ-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO CCCc1ccc(C[NH2+]Cc2nc(-c3ccccc3)no2)s1 ZINC000621723264 1056772365 /nfs/dbraw/zinc/77/23/65/1056772365.db2.gz ZVUDZJKCFJVZJI-UHFFFAOYSA-N 1 2 313.426 4.040 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1ccc(Br)s1)CC2 ZINC001617169153 1056786131 /nfs/dbraw/zinc/78/61/31/1056786131.db2.gz LBDLHIHFYFVFJU-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1ccc(Br)s1)CC2 ZINC001617169153 1056786140 /nfs/dbraw/zinc/78/61/40/1056786140.db2.gz LBDLHIHFYFVFJU-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO CO[C@H](CC(C)C)C[N@@H+]1CCn2c(cc3cc(Cl)ccc32)C1 ZINC001617207219 1056793244 /nfs/dbraw/zinc/79/32/44/1056793244.db2.gz OJAWFYDMAXKXKP-QGZVFWFLSA-N 1 2 320.864 4.171 20 0 DIADLO CO[C@H](CC(C)C)C[N@H+]1CCn2c(cc3cc(Cl)ccc32)C1 ZINC001617207219 1056793252 /nfs/dbraw/zinc/79/32/52/1056793252.db2.gz OJAWFYDMAXKXKP-QGZVFWFLSA-N 1 2 320.864 4.171 20 0 DIADLO CC(C)CCCCC(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC001128330313 1056795521 /nfs/dbraw/zinc/79/55/21/1056795521.db2.gz ZRJJIYCIUXQUJR-INIZCTEOSA-N 1 2 322.518 4.170 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2cccnc2Cl)s1 ZINC000172836293 1056809029 /nfs/dbraw/zinc/80/90/29/1056809029.db2.gz JFWFWDGBFULEGH-NSHDSACASA-N 1 2 309.866 4.255 20 0 DIADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2cccnc2Cl)s1 ZINC000172836293 1056809032 /nfs/dbraw/zinc/80/90/32/1056809032.db2.gz JFWFWDGBFULEGH-NSHDSACASA-N 1 2 309.866 4.255 20 0 DIADLO CCCCOc1ccccc1-c1ccc(-n2c[nH+]c(C)c2C)nn1 ZINC001241018984 1056820384 /nfs/dbraw/zinc/82/03/84/1056820384.db2.gz IORXRSDPAAKEKG-UHFFFAOYSA-N 1 2 322.412 4.125 20 0 DIADLO CCCCOc1ccccc1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001241019517 1056822774 /nfs/dbraw/zinc/82/27/74/1056822774.db2.gz VPQXTFUFJPPQIR-UHFFFAOYSA-N 1 2 307.397 4.172 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)c(Cl)s1 ZINC001617413261 1056829235 /nfs/dbraw/zinc/82/92/35/1056829235.db2.gz OBBVXFZYCBFFGK-GFCCVEGCSA-N 1 2 320.285 4.446 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@@H](OCC3CC3)C2)c(Cl)s1 ZINC001617413261 1056829246 /nfs/dbraw/zinc/82/92/46/1056829246.db2.gz OBBVXFZYCBFFGK-GFCCVEGCSA-N 1 2 320.285 4.446 20 0 DIADLO CCOc1ccc(-c2ccn3cc[nH+]c3c2)cc1C(F)(F)F ZINC001241055510 1056853283 /nfs/dbraw/zinc/85/32/83/1056853283.db2.gz WQHGFTMQJDVESL-UHFFFAOYSA-N 1 2 306.287 4.419 20 0 DIADLO CC(C)(C)c1coc(C[NH2+][C@@H]2CCCc3c(F)cccc32)n1 ZINC000922150978 1056853896 /nfs/dbraw/zinc/85/38/96/1056853896.db2.gz WQSWPKDURWLLBR-OAHLLOKOSA-N 1 2 302.393 4.278 20 0 DIADLO CCOc1cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)ccc1F ZINC001241070342 1056863421 /nfs/dbraw/zinc/86/34/21/1056863421.db2.gz FGUWBQZAMCUZQE-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO CCOc1cc(F)c(-c2ccc(-c3c[nH+]cn3C)cc2)cc1F ZINC001241073353 1056865029 /nfs/dbraw/zinc/86/50/29/1056865029.db2.gz CBAWJUJSBQIWFX-UHFFFAOYSA-N 1 2 314.335 4.431 20 0 DIADLO COc1ccc(-c2cc3[nH]c[nH+]c3cc2OC)cc1C(F)(F)F ZINC001241091261 1056883361 /nfs/dbraw/zinc/88/33/61/1056883361.db2.gz POJRTZPEOFRCGS-UHFFFAOYSA-N 1 2 322.286 4.266 20 0 DIADLO CCOc1ccc(F)cc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001241105271 1056897140 /nfs/dbraw/zinc/89/71/40/1056897140.db2.gz OJIACHMOOPGOLL-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc(F)c(F)cc1F ZINC001241110183 1056898744 /nfs/dbraw/zinc/89/87/44/1056898744.db2.gz RHTJGKLLIWJBCW-UHFFFAOYSA-N 1 2 306.331 4.465 20 0 DIADLO CC1(C(=O)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)CC=CC1 ZINC001128426143 1056905047 /nfs/dbraw/zinc/90/50/47/1056905047.db2.gz JYWCIBNJZCVJJV-UHFFFAOYSA-N 1 2 321.424 4.181 20 0 DIADLO CCOc1ccc(C)cc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001241147619 1056926584 /nfs/dbraw/zinc/92/65/84/1056926584.db2.gz BMSLIQHJOZOGPT-UHFFFAOYSA-N 1 2 305.368 4.401 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cccnc2OC(C)(C)C)c1 ZINC001241149964 1056929055 /nfs/dbraw/zinc/92/90/55/1056929055.db2.gz WLFGLMBUVDTHEH-UHFFFAOYSA-N 1 2 307.397 4.326 20 0 DIADLO CCCC[C@H](CC)CCCN(C)C(=O)c1cccc2[nH+]ccn21 ZINC001618243779 1056940590 /nfs/dbraw/zinc/94/05/90/1056940590.db2.gz KMGVZVLLGQDNTD-INIZCTEOSA-N 1 2 315.461 4.403 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Cl)c(F)c2)Cc2ccccc2O1 ZINC001618249439 1056940821 /nfs/dbraw/zinc/94/08/21/1056940821.db2.gz FYHJDYTVVYBAEJ-LBPRGKRZSA-N 1 2 305.780 4.262 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Cl)c(F)c2)Cc2ccccc2O1 ZINC001618249439 1056940832 /nfs/dbraw/zinc/94/08/32/1056940832.db2.gz FYHJDYTVVYBAEJ-LBPRGKRZSA-N 1 2 305.780 4.262 20 0 DIADLO Nc1cc(-c2cc(F)c(OCc3ccccc3)c(F)c2)cc[nH+]1 ZINC001241170117 1056942996 /nfs/dbraw/zinc/94/29/96/1056942996.db2.gz DXAIWLRYQDLFQW-UHFFFAOYSA-N 1 2 312.319 4.188 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2c(F)cc(F)cc2F)cc1F ZINC001241172022 1056944640 /nfs/dbraw/zinc/94/46/40/1056944640.db2.gz FDQHKWMVCMUALH-UHFFFAOYSA-N 1 2 301.258 4.111 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@@H]2c2c(F)cccc2F)c(C)[nH+]1 ZINC000115984622 1056959845 /nfs/dbraw/zinc/95/98/45/1056959845.db2.gz DSRKKVCFVMKBFU-STQMWFEESA-N 1 2 316.351 4.027 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ncnc2sc(C(C)C)cc21 ZINC001241229102 1056969705 /nfs/dbraw/zinc/96/97/05/1056969705.db2.gz XCWMSKGXHGFUFF-UHFFFAOYSA-N 1 2 312.442 4.251 20 0 DIADLO Cc1nc2c3ccccc3oc2c(-c2c[nH+]c(N(C)C)cc2C)n1 ZINC001241232976 1056971787 /nfs/dbraw/zinc/97/17/87/1056971787.db2.gz CASGOMVBBFEKKR-UHFFFAOYSA-N 1 2 318.380 4.121 20 0 DIADLO COc1cc(C(F)(F)F)ccc1-c1c[nH+]c(N(C)C)cc1C ZINC001241242470 1056976255 /nfs/dbraw/zinc/97/62/55/1056976255.db2.gz CYSADAZLOMLVBS-UHFFFAOYSA-N 1 2 310.319 4.150 20 0 DIADLO CCCCOc1ccc(-c2ccc(-n3c[nH+]c(C)c3C)nn2)cc1 ZINC001241267220 1056987711 /nfs/dbraw/zinc/98/77/11/1056987711.db2.gz GZUNIGYOOBIANI-UHFFFAOYSA-N 1 2 322.412 4.125 20 0 DIADLO CCc1oc2ccccc2c1C[N@H+](C)Cc1ccn(C(F)F)n1 ZINC000347705708 1056995842 /nfs/dbraw/zinc/99/58/42/1056995842.db2.gz PKIXBZJPKOXVAL-UHFFFAOYSA-N 1 2 319.355 4.219 20 0 DIADLO CCc1oc2ccccc2c1C[N@@H+](C)Cc1ccn(C(F)F)n1 ZINC000347705708 1056995845 /nfs/dbraw/zinc/99/58/45/1056995845.db2.gz PKIXBZJPKOXVAL-UHFFFAOYSA-N 1 2 319.355 4.219 20 0 DIADLO CC(C)OC(=O)c1ccc(-c2cccc(-c3c[nH+]cn3C)c2)cc1 ZINC001241285072 1056996486 /nfs/dbraw/zinc/99/64/86/1056996486.db2.gz BWNGXYMUOAUAFR-UHFFFAOYSA-N 1 2 320.392 4.319 20 0 DIADLO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2ccn(C(F)F)n2)cc1 ZINC000347708064 1057006500 /nfs/dbraw/zinc/00/65/00/1057006500.db2.gz RVFAEQFNMOATKJ-INIZCTEOSA-N 1 2 321.371 4.014 20 0 DIADLO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2ccn(C(F)F)n2)cc1 ZINC000347708064 1057006505 /nfs/dbraw/zinc/00/65/05/1057006505.db2.gz RVFAEQFNMOATKJ-INIZCTEOSA-N 1 2 321.371 4.014 20 0 DIADLO Cc1cccc2[nH]c(C[NH2+][C@H]3c4ccccc4OC[C@H]3F)cc21 ZINC000922522899 1057030109 /nfs/dbraw/zinc/03/01/09/1057030109.db2.gz XBEVCIAUKVLGER-APWZRJJASA-N 1 2 310.372 4.038 20 0 DIADLO Cc1nc2c(ccn2C)c(NCCc2ccc3ccccc3c2)[nH+]1 ZINC001168728238 1057033280 /nfs/dbraw/zinc/03/32/80/1057033280.db2.gz QBTROYUUGGCLPK-UHFFFAOYSA-N 1 2 316.408 4.085 20 0 DIADLO CCc1cccc2cc(C[NH2+][C@H](c3ncccn3)C3CC3)oc21 ZINC000922578273 1057033786 /nfs/dbraw/zinc/03/37/86/1057033786.db2.gz ZOQLPHGKQRIGLS-KRWDZBQOSA-N 1 2 307.397 4.026 20 0 DIADLO CC[C@H]([NH2+]Cc1ncc(Cl)s1)c1cc(F)ccc1OC ZINC000922621696 1057040035 /nfs/dbraw/zinc/04/00/35/1057040035.db2.gz MWRPHYGQGLPXFA-NSHDSACASA-N 1 2 314.813 4.185 20 0 DIADLO Fc1c(F)c(F)c(-c2ccc(Cn3cc[nH+]c3)cc2)c(F)c1F ZINC001241406709 1057043775 /nfs/dbraw/zinc/04/37/75/1057043775.db2.gz AIGZNTYIYLZTDQ-UHFFFAOYSA-N 1 2 324.252 4.294 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc([C@@H]2CCCO2)s1)c1c(F)cccc1F ZINC000922652004 1057045342 /nfs/dbraw/zinc/04/53/42/1057045342.db2.gz JJZJZPGQHJQYSI-YGRLFVJLSA-N 1 2 324.396 4.124 20 0 DIADLO COc1ccc(C[NH2+]C(C)(C)c2nc(C)c(C)s2)c(Cl)c1 ZINC000124726270 1057049201 /nfs/dbraw/zinc/04/92/01/1057049201.db2.gz IVHSLFAMLGSYBZ-UHFFFAOYSA-N 1 2 324.877 4.447 20 0 DIADLO Cc1cc([C@H](C)[NH2+]C(c2cccs2)c2cccs2)nn1C ZINC000282369482 1057055534 /nfs/dbraw/zinc/05/55/34/1057055534.db2.gz WLOHESKHRNFTLW-LBPRGKRZSA-N 1 2 317.483 4.292 20 0 DIADLO Cc1cn2c(cccc2-c2cccc(C(=O)OC(C)(C)C)c2)[nH+]1 ZINC001241537109 1057086550 /nfs/dbraw/zinc/08/65/50/1057086550.db2.gz MDMANCUODLKHDZ-UHFFFAOYSA-N 1 2 308.381 4.265 20 0 DIADLO Cc1cc2[nH+]ccn2cc1-c1cccc(C(=O)OC(C)(C)C)c1 ZINC001241537752 1057088405 /nfs/dbraw/zinc/08/84/05/1057088405.db2.gz BEFRALIHZXOUJN-UHFFFAOYSA-N 1 2 308.381 4.265 20 0 DIADLO CCc1cccc(-c2ncnc3c2C[N@H+](Cc2ccccc2)C3)c1 ZINC001241544890 1057090842 /nfs/dbraw/zinc/09/08/42/1057090842.db2.gz OGOIEFDHVXLOMT-UHFFFAOYSA-N 1 2 315.420 4.222 20 0 DIADLO CCc1cccc(-c2ncnc3c2C[N@@H+](Cc2ccccc2)C3)c1 ZINC001241544890 1057090853 /nfs/dbraw/zinc/09/08/53/1057090853.db2.gz OGOIEFDHVXLOMT-UHFFFAOYSA-N 1 2 315.420 4.222 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)nn1C ZINC000282417298 1057100992 /nfs/dbraw/zinc/10/09/92/1057100992.db2.gz YMGCPOMBEVONTI-MGPUTAFESA-N 1 2 323.415 4.308 20 0 DIADLO Fc1ccccc1-c1nc(C[N@@H+]2CCC[C@H]2c2cccnc2)co1 ZINC000625271313 1057112442 /nfs/dbraw/zinc/11/24/42/1057112442.db2.gz LZXTWVNGSPUPLF-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccccc1-c1nc(C[N@H+]2CCC[C@H]2c2cccnc2)co1 ZINC000625271313 1057112450 /nfs/dbraw/zinc/11/24/50/1057112450.db2.gz LZXTWVNGSPUPLF-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO Cc1ccccc1-c1noc(C[N@H+]2C[C@@H](C)[C@H]2c2ccccc2)n1 ZINC000673714292 1057120149 /nfs/dbraw/zinc/12/01/49/1057120149.db2.gz VVGRHJRMIXMUDE-BEFAXECRSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccccc1-c1noc(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)n1 ZINC000673714292 1057120153 /nfs/dbraw/zinc/12/01/53/1057120153.db2.gz VVGRHJRMIXMUDE-BEFAXECRSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1[nH]nc2ccc(-c3ccc(F)c(C[NH+]4CCCC4)c3)cc12 ZINC001241671754 1057131037 /nfs/dbraw/zinc/13/10/37/1057131037.db2.gz NRAXAIRCZRSOCY-UHFFFAOYSA-N 1 2 309.388 4.273 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cccnc2C(F)(F)F)c1 ZINC000625374257 1057131487 /nfs/dbraw/zinc/13/14/87/1057131487.db2.gz NAYDPFQCSJWRGH-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cccnc2C(F)(F)F)c1 ZINC000625374257 1057131489 /nfs/dbraw/zinc/13/14/89/1057131489.db2.gz NAYDPFQCSJWRGH-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1csc([C@@H](C)OC)n1 ZINC000673856150 1057142625 /nfs/dbraw/zinc/14/26/25/1057142625.db2.gz KMPRSGSGEYIGBX-CXAGYDPISA-N 1 2 316.470 4.360 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1csc([C@@H](C)OC)n1 ZINC000673856150 1057142634 /nfs/dbraw/zinc/14/26/34/1057142634.db2.gz KMPRSGSGEYIGBX-CXAGYDPISA-N 1 2 316.470 4.360 20 0 DIADLO CC[N@H+](Cc1ccoc1)Cc1ncc(-c2cccc(F)c2)o1 ZINC000673856772 1057142899 /nfs/dbraw/zinc/14/28/99/1057142899.db2.gz OJXVKRFLENQJQD-UHFFFAOYSA-N 1 2 300.333 4.096 20 0 DIADLO CC[N@@H+](Cc1ccoc1)Cc1ncc(-c2cccc(F)c2)o1 ZINC000673856772 1057142902 /nfs/dbraw/zinc/14/29/02/1057142902.db2.gz OJXVKRFLENQJQD-UHFFFAOYSA-N 1 2 300.333 4.096 20 0 DIADLO C[N@H+](Cc1nc2c(s1)CCCC2)Cc1ccc2occc2c1 ZINC000347827501 1057144766 /nfs/dbraw/zinc/14/47/66/1057144766.db2.gz YPOIPQSOVDNMCR-UHFFFAOYSA-N 1 2 312.438 4.400 20 0 DIADLO C[N@@H+](Cc1nc2c(s1)CCCC2)Cc1ccc2occc2c1 ZINC000347827501 1057144769 /nfs/dbraw/zinc/14/47/69/1057144769.db2.gz YPOIPQSOVDNMCR-UHFFFAOYSA-N 1 2 312.438 4.400 20 0 DIADLO Cc1nnc([C@H](C)[N@H+]2CC=C(c3cccc(Cl)c3)CC2)s1 ZINC000282478610 1057160634 /nfs/dbraw/zinc/16/06/34/1057160634.db2.gz LJMGZFFIDFXHRF-NSHDSACASA-N 1 2 319.861 4.350 20 0 DIADLO Cc1nnc([C@H](C)[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)s1 ZINC000282478610 1057160636 /nfs/dbraw/zinc/16/06/36/1057160636.db2.gz LJMGZFFIDFXHRF-NSHDSACASA-N 1 2 319.861 4.350 20 0 DIADLO COc1cc(F)c(C(C)C)cc1-c1c[nH+]c(N(C)C)cc1C ZINC001241786149 1057163100 /nfs/dbraw/zinc/16/31/00/1057163100.db2.gz IPHYLNHGPBGWFN-UHFFFAOYSA-N 1 2 302.393 4.394 20 0 DIADLO COc1cc(F)c(C(C)C)cc1-c1cc(-n2ccnc2)cc[nH+]1 ZINC001241786934 1057163473 /nfs/dbraw/zinc/16/34/73/1057163473.db2.gz ZYNKLGKCOUZBKU-UHFFFAOYSA-N 1 2 311.360 4.205 20 0 DIADLO Fc1cccc([C@@H]2CC[N@@H+]2Cc2cc(-c3ccccc3)no2)c1 ZINC000674009778 1057176696 /nfs/dbraw/zinc/17/66/96/1057176696.db2.gz LOEPUFUAUHRAEV-IBGZPJMESA-N 1 2 308.356 4.428 20 0 DIADLO Fc1cccc([C@@H]2CC[N@H+]2Cc2cc(-c3ccccc3)no2)c1 ZINC000674009778 1057176697 /nfs/dbraw/zinc/17/66/97/1057176697.db2.gz LOEPUFUAUHRAEV-IBGZPJMESA-N 1 2 308.356 4.428 20 0 DIADLO CNc1ccc(Nc2cc(C)nn2-c2cccc(Cl)c2)c[nH+]1 ZINC001203448799 1057178315 /nfs/dbraw/zinc/17/83/15/1057178315.db2.gz KKOLATBMZPJMSA-UHFFFAOYSA-N 1 2 313.792 4.014 20 0 DIADLO Cc1cc(-c2cccnc2OCc2ccccc2)c2[nH+]ccn2c1 ZINC001241830397 1057180322 /nfs/dbraw/zinc/18/03/22/1057180322.db2.gz UJLZCCRTUSIRSG-UHFFFAOYSA-N 1 2 315.376 4.284 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[N@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000625653781 1057184629 /nfs/dbraw/zinc/18/46/29/1057184629.db2.gz NJKNIOASKVGWTE-FRRDWIJNSA-N 1 2 321.371 4.021 20 0 DIADLO C[C@H](c1noc(-c2ccccc2)n1)[N@@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000625653781 1057184631 /nfs/dbraw/zinc/18/46/31/1057184631.db2.gz NJKNIOASKVGWTE-FRRDWIJNSA-N 1 2 321.371 4.021 20 0 DIADLO C[N@H+](CC1CCCCC1)Cn1nc(C2CC2)n(C2CC2)c1=S ZINC000074068000 1057187122 /nfs/dbraw/zinc/18/71/22/1057187122.db2.gz VFHMEOLDLNKKSU-UHFFFAOYSA-N 1 2 320.506 4.096 20 0 DIADLO C[N@@H+](CC1CCCCC1)Cn1nc(C2CC2)n(C2CC2)c1=S ZINC000074068000 1057187126 /nfs/dbraw/zinc/18/71/26/1057187126.db2.gz VFHMEOLDLNKKSU-UHFFFAOYSA-N 1 2 320.506 4.096 20 0 DIADLO CC(C)[N@H+](Cc1nccn1C)Cc1ccc(Cl)c(Cl)c1 ZINC000171109393 1057210432 /nfs/dbraw/zinc/21/04/32/1057210432.db2.gz RYWMEWDZUOPTQZ-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO CC(C)[N@@H+](Cc1nccn1C)Cc1ccc(Cl)c(Cl)c1 ZINC000171109393 1057210436 /nfs/dbraw/zinc/21/04/36/1057210436.db2.gz RYWMEWDZUOPTQZ-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@H+](C)Cc1cccnc1 ZINC000171146446 1057213480 /nfs/dbraw/zinc/21/34/80/1057213480.db2.gz RJQJJGTZGINENC-LBPRGKRZSA-N 1 2 305.219 4.037 20 0 DIADLO C[C@@H](c1ccccc1Br)[N@@H+](C)Cc1cccnc1 ZINC000171146446 1057213487 /nfs/dbraw/zinc/21/34/87/1057213487.db2.gz RJQJJGTZGINENC-LBPRGKRZSA-N 1 2 305.219 4.037 20 0 DIADLO CCOc1ccc2ccccc2c1-c1ccn2cc(N)[nH+]c2c1 ZINC001241925441 1057214066 /nfs/dbraw/zinc/21/40/66/1057214066.db2.gz SQVLLCCTAZDRQH-UHFFFAOYSA-N 1 2 303.365 4.135 20 0 DIADLO CCC(C)(C)C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000171156329 1057215457 /nfs/dbraw/zinc/21/54/57/1057215457.db2.gz HFPQBZCDGXZFRH-UHFFFAOYSA-N 1 2 311.429 4.261 20 0 DIADLO COc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)c2ccccc12 ZINC001241971542 1057225394 /nfs/dbraw/zinc/22/53/94/1057225394.db2.gz IDTDFYOTDOOIHK-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO CC(C)c1cccc(N(C)C(=O)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000140568219 1057235258 /nfs/dbraw/zinc/23/52/58/1057235258.db2.gz MGWVAJMAORYNBN-UHFFFAOYSA-N 1 2 319.408 4.272 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cccc([C@H](C)OC)c1 ZINC001242040357 1057247365 /nfs/dbraw/zinc/24/73/65/1057247365.db2.gz LFITYZOSNDPBIV-AWEZNQCLSA-N 1 2 308.381 4.255 20 0 DIADLO CC(C)n1ccc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)n1 ZINC000172333368 1057254712 /nfs/dbraw/zinc/25/47/12/1057254712.db2.gz DLIFSGQYMAPLFV-UHFFFAOYSA-N 1 2 311.351 4.115 20 0 DIADLO CC(C)n1ccc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2)n1 ZINC000172333368 1057254719 /nfs/dbraw/zinc/25/47/19/1057254719.db2.gz DLIFSGQYMAPLFV-UHFFFAOYSA-N 1 2 311.351 4.115 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1nc2ccccc2c(-c2ccccc2)n1 ZINC001242072579 1057254808 /nfs/dbraw/zinc/25/48/08/1057254808.db2.gz MPIGISYYFUNQHO-UHFFFAOYSA-N 1 2 312.376 4.249 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cnn(Cc3cccs3)c2)cc1 ZINC001242094882 1057262790 /nfs/dbraw/zinc/26/27/90/1057262790.db2.gz VKOZSBUSNFYIQN-UHFFFAOYSA-N 1 2 320.421 4.060 20 0 DIADLO Oc1ccc(C(F)(F)F)cc1-c1cc(N2CCCCC2)cc[nH+]1 ZINC001242131168 1057273578 /nfs/dbraw/zinc/27/35/78/1057273578.db2.gz AMYLSCAVUPTTPL-UHFFFAOYSA-N 1 2 322.330 4.463 20 0 DIADLO CC(C)CCN(C(=O)Nc1ccc2[nH+]ccn2c1)C1CCCC1 ZINC000674757498 1057279350 /nfs/dbraw/zinc/27/93/50/1057279350.db2.gz LHILVNGTWBQPII-UHFFFAOYSA-N 1 2 314.433 4.157 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cc(Cl)cc(C)c3F)nn2)c1C ZINC001242225793 1057300164 /nfs/dbraw/zinc/30/01/64/1057300164.db2.gz AAVVXKZCCZIXML-UHFFFAOYSA-N 1 2 316.767 4.047 20 0 DIADLO Cc1cn2c(cccc2-c2cccnc2OC2CCCCC2)[nH+]1 ZINC001242227735 1057302296 /nfs/dbraw/zinc/30/22/96/1057302296.db2.gz HYLRRHIOKISOLL-UHFFFAOYSA-N 1 2 307.397 4.416 20 0 DIADLO FC(F)(F)c1ccncc1-c1ccccc1Cn1cc[nH+]c1 ZINC001242278860 1057317326 /nfs/dbraw/zinc/31/73/26/1057317326.db2.gz AARGQNMKHYYUBQ-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cnccc2C(F)(F)F)c1 ZINC001242279103 1057318267 /nfs/dbraw/zinc/31/82/67/1057318267.db2.gz IKQPVUNYSZMCCP-UHFFFAOYSA-N 1 2 303.287 4.168 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cnccc2C(F)(F)F)cc1 ZINC001242280104 1057318390 /nfs/dbraw/zinc/31/83/90/1057318390.db2.gz WEQOTNHUNPKNRX-UHFFFAOYSA-N 1 2 303.287 4.168 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(Cl)c(F)cc1F ZINC001242292359 1057324553 /nfs/dbraw/zinc/32/45/53/1057324553.db2.gz NLIAWPCKGNGZBF-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(F)c(F)c1C ZINC001242308007 1057330398 /nfs/dbraw/zinc/33/03/98/1057330398.db2.gz QXOXLFXKUOSCCH-UHFFFAOYSA-N 1 2 300.308 4.135 20 0 DIADLO Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1Cl ZINC000675250041 1057332989 /nfs/dbraw/zinc/33/29/89/1057332989.db2.gz FBUNUGJCRVMZCE-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1ccc(Cl)cc1Cl ZINC000675250041 1057332994 /nfs/dbraw/zinc/33/29/94/1057332994.db2.gz FBUNUGJCRVMZCE-MRXNPFEDSA-N 1 2 324.255 4.372 20 0 DIADLO COc1ccc2ccccc2c1-c1cc(-n2ccnc2)cc[nH+]1 ZINC001242331092 1057337257 /nfs/dbraw/zinc/33/72/57/1057337257.db2.gz YLBPCXAEZGZTFP-UHFFFAOYSA-N 1 2 301.349 4.096 20 0 DIADLO CCOc1c(F)cccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212535996 1057344425 /nfs/dbraw/zinc/34/44/25/1057344425.db2.gz AJMYKYICKYBBEP-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO Cc1cc(CNc2[nH+]c3cc(Cl)ccc3n2C)cnc1Cl ZINC000766109981 1057346529 /nfs/dbraw/zinc/34/65/29/1057346529.db2.gz OKKWRUITPGVIKJ-UHFFFAOYSA-N 1 2 321.211 4.196 20 0 DIADLO Oc1c(Cl)cccc1-c1cc(C[NH+]2CCCCC2)ccn1 ZINC001242364193 1057346648 /nfs/dbraw/zinc/34/66/48/1057346648.db2.gz VNDKLXZWBQXVEK-UHFFFAOYSA-N 1 2 302.805 4.094 20 0 DIADLO C[C@H]1CCCC[N@@H+]1Cc1ccc(-c2cccc(Cl)c2O)nc1 ZINC001242365505 1057347161 /nfs/dbraw/zinc/34/71/61/1057347161.db2.gz UVSPBQDIUYEGBK-ZDUSSCGKSA-N 1 2 316.832 4.482 20 0 DIADLO C[C@H]1CCCC[N@H+]1Cc1ccc(-c2cccc(Cl)c2O)nc1 ZINC001242365505 1057347164 /nfs/dbraw/zinc/34/71/64/1057347164.db2.gz UVSPBQDIUYEGBK-ZDUSSCGKSA-N 1 2 316.832 4.482 20 0 DIADLO COc1ccc(-c2cnc(C[N@H+](C)Cc3cccs3)o2)cc1 ZINC000041392568 1057349818 /nfs/dbraw/zinc/34/98/18/1057349818.db2.gz HGIZJSRZNJWYIY-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1ccc(-c2cnc(C[N@@H+](C)Cc3cccs3)o2)cc1 ZINC000041392568 1057349829 /nfs/dbraw/zinc/34/98/29/1057349829.db2.gz HGIZJSRZNJWYIY-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO Cc1ccnc(F)c1Nc1cc[nH+]c(NC(=O)OC(C)(C)C)c1 ZINC001212554528 1057369236 /nfs/dbraw/zinc/36/92/36/1057369236.db2.gz YTAGAGBCHGJXRY-UHFFFAOYSA-N 1 2 318.352 4.015 20 0 DIADLO Nc1cn2ccc(/C=C/c3ccccc3C(F)(F)F)cc2[nH+]1 ZINC001242492304 1057382813 /nfs/dbraw/zinc/38/28/13/1057382813.db2.gz BSXLOLVSGDENGR-AATRIKPKSA-N 1 2 303.287 4.106 20 0 DIADLO CC(C)CC[C@H]1CCCCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000675531960 1057385094 /nfs/dbraw/zinc/38/50/94/1057385094.db2.gz HSXGBJDMYZJOHR-MRXNPFEDSA-N 1 2 314.433 4.157 20 0 DIADLO COc1ncc(Cl)cc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001242507085 1057387560 /nfs/dbraw/zinc/38/75/60/1057387560.db2.gz IIEYULWAVKPTLR-UHFFFAOYSA-N 1 2 317.820 4.104 20 0 DIADLO COCOc1ccc(-c2cccc(-c3c[nH+]cn3C)c2)c(C)c1 ZINC001242538105 1057397044 /nfs/dbraw/zinc/39/70/44/1057397044.db2.gz JCAGPQRQXXNXBH-UHFFFAOYSA-N 1 2 308.381 4.045 20 0 DIADLO CCC[C@H](C)C[N@@H+]1CCOC[C@@H]1c1nc2ccccc2s1 ZINC000503064743 1057399047 /nfs/dbraw/zinc/39/90/47/1057399047.db2.gz UVITYEYDBVILHO-DZGCQCFKSA-N 1 2 304.459 4.106 20 0 DIADLO CCC[C@H](C)C[N@H+]1CCOC[C@@H]1c1nc2ccccc2s1 ZINC000503064743 1057399051 /nfs/dbraw/zinc/39/90/51/1057399051.db2.gz UVITYEYDBVILHO-DZGCQCFKSA-N 1 2 304.459 4.106 20 0 DIADLO C[C@H]([NH2+]Cc1ccncc1Cl)c1nc2ccccc2s1 ZINC000704401900 1057400481 /nfs/dbraw/zinc/40/04/81/1057400481.db2.gz RGXMDYNGDFNITJ-JTQLQIEISA-N 1 2 303.818 4.196 20 0 DIADLO COc1cc(F)c(F)cc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001242577740 1057412517 /nfs/dbraw/zinc/41/25/17/1057412517.db2.gz XRXGHUGRMKNJOX-UHFFFAOYSA-N 1 2 318.367 4.334 20 0 DIADLO CCOc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1nc(C)cs1)CCO2 ZINC000675810280 1057417655 /nfs/dbraw/zinc/41/76/55/1057417655.db2.gz QKEXVFQFODXBIZ-IUODEOHRSA-N 1 2 318.442 4.025 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cccnc1OC(F)F ZINC001242630367 1057428599 /nfs/dbraw/zinc/42/85/99/1057428599.db2.gz NKZKKUOAEIRCLH-UHFFFAOYSA-N 1 2 319.355 4.044 20 0 DIADLO Fc1ccc(C[NH2+][C@H]2COc3c2cccc3Cl)c(Cl)c1 ZINC000676044565 1057446117 /nfs/dbraw/zinc/44/61/17/1057446117.db2.gz CAACZXBSWRTDOZ-AWEZNQCLSA-N 1 2 312.171 4.356 20 0 DIADLO C[C@]1(F)CCC[N@H+](Cc2cc(F)cc(OC(F)(F)F)c2)C1 ZINC001143256108 1057453308 /nfs/dbraw/zinc/45/33/08/1057453308.db2.gz DHMYEILFYZZTJK-ZDUSSCGKSA-N 1 2 309.278 4.048 20 0 DIADLO C[C@]1(F)CCC[N@@H+](Cc2cc(F)cc(OC(F)(F)F)c2)C1 ZINC001143256108 1057453311 /nfs/dbraw/zinc/45/33/11/1057453311.db2.gz DHMYEILFYZZTJK-ZDUSSCGKSA-N 1 2 309.278 4.048 20 0 DIADLO Clc1cc(NCc2n[nH]c3ccccc23)ccc1-n1cc[nH+]c1 ZINC000676321885 1057464677 /nfs/dbraw/zinc/46/46/77/1057464677.db2.gz POTWZOIVNJNUSZ-UHFFFAOYSA-N 1 2 323.787 4.014 20 0 DIADLO C[N@H+](Cc1nc(-c2ccccc2)cs1)Cc1cccc(O)c1 ZINC000676414086 1057470952 /nfs/dbraw/zinc/47/09/52/1057470952.db2.gz LGMFTWLHFMMRDQ-UHFFFAOYSA-N 1 2 310.422 4.148 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccccc2)cs1)Cc1cccc(O)c1 ZINC000676414086 1057470957 /nfs/dbraw/zinc/47/09/57/1057470957.db2.gz LGMFTWLHFMMRDQ-UHFFFAOYSA-N 1 2 310.422 4.148 20 0 DIADLO CC[N@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1ccc(C)cc1Cl ZINC000676478734 1057477587 /nfs/dbraw/zinc/47/75/87/1057477587.db2.gz GPNTXVBLBFWZFZ-ZDUSSCGKSA-N 1 2 320.820 4.091 20 0 DIADLO CC[N@@H+](Cc1ccoc1)[C@@H](C)C(=O)Nc1ccc(C)cc1Cl ZINC000676478734 1057477589 /nfs/dbraw/zinc/47/75/89/1057477589.db2.gz GPNTXVBLBFWZFZ-ZDUSSCGKSA-N 1 2 320.820 4.091 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cc(Cl)ccc2Cl)cn1 ZINC000676721794 1057497450 /nfs/dbraw/zinc/49/74/50/1057497450.db2.gz ZGGNOGMOKZHIKW-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2Cl)cn1 ZINC000676721794 1057497454 /nfs/dbraw/zinc/49/74/54/1057497454.db2.gz ZGGNOGMOKZHIKW-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Oc1c(Cl)cc(-c2ccc(O[C@H]3CC[NH2+]C3)cc2)cc1Cl ZINC001242853041 1057499147 /nfs/dbraw/zinc/49/91/47/1057499147.db2.gz JKNLASZVNKPGMG-ZDUSSCGKSA-N 1 2 324.207 4.107 20 0 DIADLO C[C@@H]([NH2+]Cc1ccsc1Cl)c1nc2ccccc2n1C ZINC000312884353 1057501254 /nfs/dbraw/zinc/50/12/54/1057501254.db2.gz XWUHHCJJWIWNFF-SNVBAGLBSA-N 1 2 305.834 4.139 20 0 DIADLO O=C1CCCc2ccc(-c3ccc(F)c(-n4cc[nH+]c4)c3)cc21 ZINC001242858974 1057502974 /nfs/dbraw/zinc/50/29/74/1057502974.db2.gz KUPGXCOOYWIBSH-UHFFFAOYSA-N 1 2 306.340 4.197 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@@H](C)c2ccc(OCC)cc2)n1 ZINC000073637374 1057508734 /nfs/dbraw/zinc/50/87/34/1057508734.db2.gz DGWLPDBAPBPUFB-UONOGXRCSA-N 1 2 317.433 4.223 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cccc(COC(C)(C)C)c1 ZINC000922914132 1057510719 /nfs/dbraw/zinc/51/07/19/1057510719.db2.gz IHPFRRCXTPJBBM-UHFFFAOYSA-N 1 2 301.434 4.391 20 0 DIADLO Oc1cc(OC(F)(F)F)cc(-c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001242987897 1057537245 /nfs/dbraw/zinc/53/72/45/1057537245.db2.gz YNOMKESJJVKRLN-UHFFFAOYSA-N 1 2 320.270 4.144 20 0 DIADLO Cc1noc([C@@H](C)[NH+]2CCC([C@@H](F)c3ccccc3F)CC2)n1 ZINC000671699520 1057543805 /nfs/dbraw/zinc/54/38/05/1057543805.db2.gz KMLSHTMMTACWRZ-BDJLRTHQSA-N 1 2 321.371 4.001 20 0 DIADLO Nc1ccc(C(F)(F)F)cc1-c1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001243005540 1057544942 /nfs/dbraw/zinc/54/49/42/1057544942.db2.gz RQGLGOXHSPSORP-UHFFFAOYSA-N 1 2 303.287 4.345 20 0 DIADLO Cc1csc(C[N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)n1 ZINC000626007416 1057548110 /nfs/dbraw/zinc/54/81/10/1057548110.db2.gz FSYUWCIKDUPBII-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1csc(C[N@H+]2CCc3cc(C(F)(F)F)ccc3C2)n1 ZINC000626007416 1057548112 /nfs/dbraw/zinc/54/81/12/1057548112.db2.gz FSYUWCIKDUPBII-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1cn2cc(-c3ccc(C(F)(F)F)nc3Cl)ccc2[nH+]1 ZINC001243037068 1057553418 /nfs/dbraw/zinc/55/34/18/1057553418.db2.gz XTBBXISTLOVHNY-UHFFFAOYSA-N 1 2 311.694 4.377 20 0 DIADLO CCc1ccc(-c2cc(F)ccc2C[NH+]2CCOCC2)c(C)c1 ZINC001243083498 1057565786 /nfs/dbraw/zinc/56/57/86/1057565786.db2.gz DVERSWZJCACITP-UHFFFAOYSA-N 1 2 313.416 4.196 20 0 DIADLO CSc1ccc(-c2cc(F)ccc2C[NH+]2CCOCC2)cc1 ZINC001243083278 1057565878 /nfs/dbraw/zinc/56/58/78/1057565878.db2.gz DZCRRRNRPCXKMK-UHFFFAOYSA-N 1 2 317.429 4.047 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)c(-c2ccccc2C(F)F)c1 ZINC001243083264 1057565914 /nfs/dbraw/zinc/56/59/14/1057565914.db2.gz DWGZMFYLXXBCIU-UHFFFAOYSA-N 1 2 321.342 4.263 20 0 DIADLO Cc1cc(C)c(-c2cc(F)ccc2C[NH+]2CCOCC2)c(C)c1 ZINC001243086339 1057566476 /nfs/dbraw/zinc/56/64/76/1057566476.db2.gz QKGYOHWPBURTPY-UHFFFAOYSA-N 1 2 313.416 4.250 20 0 DIADLO Fc1ccc(C[NH+]2CCOCC2)c(-c2ccc3occc3c2)c1 ZINC001243084847 1057566668 /nfs/dbraw/zinc/56/66/68/1057566668.db2.gz LXQLNDACBBNENY-UHFFFAOYSA-N 1 2 311.356 4.071 20 0 DIADLO Cc1c[nH]c2c1cccc2-c1cc(F)ccc1C[NH+]1CCOCC1 ZINC001243087458 1057567169 /nfs/dbraw/zinc/56/71/69/1057567169.db2.gz MJTCRXGCWJOQKY-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO CCCCOC(=O)c1cccc(-c2cc[nH+]c(N3CCCC3)c2)c1 ZINC001243093252 1057570487 /nfs/dbraw/zinc/57/04/87/1057570487.db2.gz GZAHEMSKFYEFJK-UHFFFAOYSA-N 1 2 324.424 4.306 20 0 DIADLO CCc1cc(-c2cc(F)ccc2C[NH+]2CCOCC2)ccc1F ZINC001243101898 1057573041 /nfs/dbraw/zinc/57/30/41/1057573041.db2.gz PQFGJNWXXDMRRT-UHFFFAOYSA-N 1 2 317.379 4.026 20 0 DIADLO Cc1c(F)ccc(-c2cc(F)ccc2C[NH+]2CCOCC2)c1C ZINC001243102102 1057573361 /nfs/dbraw/zinc/57/33/61/1057573361.db2.gz VEVWMRKLCCZZGD-UHFFFAOYSA-N 1 2 317.379 4.081 20 0 DIADLO COc1cc(-c2ccc3[nH+]c(C)cn3c2)cc(C(F)(F)F)c1 ZINC001243117936 1057576909 /nfs/dbraw/zinc/57/69/09/1057576909.db2.gz BIHAHNORTKGIRY-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1c(F)cccc1SC ZINC001243129902 1057582051 /nfs/dbraw/zinc/58/20/51/1057582051.db2.gz ILKYKRSGQPSKBL-UHFFFAOYSA-N 1 2 314.385 4.409 20 0 DIADLO COC(=O)c1oc([C@@H](C)[N@@H+]2CC[C@H]2c2cccc(F)c2)cc1C ZINC000611372045 1057593061 /nfs/dbraw/zinc/59/30/61/1057593061.db2.gz OYJWFDSEYDYOHB-DOMZBBRYSA-N 1 2 317.360 4.022 20 0 DIADLO COC(=O)c1oc([C@@H](C)[N@H+]2CC[C@H]2c2cccc(F)c2)cc1C ZINC000611372045 1057593064 /nfs/dbraw/zinc/59/30/64/1057593064.db2.gz OYJWFDSEYDYOHB-DOMZBBRYSA-N 1 2 317.360 4.022 20 0 DIADLO Cc1cc(-c2ccccc2NC(=O)C(C)(C)C)cn2cc[nH+]c12 ZINC001243185304 1057596995 /nfs/dbraw/zinc/59/69/95/1057596995.db2.gz UNJILHUBXNJWRC-UHFFFAOYSA-N 1 2 307.397 4.294 20 0 DIADLO Cc1c(-c2ccccc2NC(=O)C(C)(C)C)ccc2[nH+]ccn21 ZINC001243190605 1057598843 /nfs/dbraw/zinc/59/88/43/1057598843.db2.gz RHZCXIROBTZHLF-UHFFFAOYSA-N 1 2 307.397 4.294 20 0 DIADLO Cc1cc(NC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)cc[nH+]1 ZINC000017820663 1057601251 /nfs/dbraw/zinc/60/12/51/1057601251.db2.gz LIEDRODHOWONKI-GFCCVEGCSA-N 1 2 319.408 4.248 20 0 DIADLO CCCCCOc1cc(C)ccc1C[NH2+][C@H](C)c1ncc[nH]1 ZINC000513673697 1057623130 /nfs/dbraw/zinc/62/31/30/1057623130.db2.gz WCYOTKXKFNTPLF-OAHLLOKOSA-N 1 2 301.434 4.138 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCc3cccnc3Cl)c2c1 ZINC000727055475 1057631116 /nfs/dbraw/zinc/63/11/16/1057631116.db2.gz XGCXBAGUJXNICK-UHFFFAOYSA-N 1 2 314.772 4.179 20 0 DIADLO CCOc1cc(F)c(F)cc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001243277455 1057633047 /nfs/dbraw/zinc/63/30/47/1057633047.db2.gz YMIHSWLFOREXCK-UHFFFAOYSA-N 1 2 318.245 4.027 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3cc(C)ccc3F)c2)[nH+]c1C ZINC000727103598 1057634402 /nfs/dbraw/zinc/63/44/02/1057634402.db2.gz HFJMOJHLDFVODP-UHFFFAOYSA-N 1 2 323.371 4.393 20 0 DIADLO Nc1ccc(F)c(-c2[nH+]ccc3c2ccn3Cc2ccccc2)c1 ZINC001243281554 1057634905 /nfs/dbraw/zinc/63/49/05/1057634905.db2.gz SBHDXXZFGQQUGB-UHFFFAOYSA-N 1 2 317.367 4.473 20 0 DIADLO c1ccc(-c2nc(C[N@@H+]3CCC[C@H]3c3ccccc3)no2)cc1 ZINC000054993510 1057640731 /nfs/dbraw/zinc/64/07/31/1057640731.db2.gz CFOFIGPJMWFPGO-KRWDZBQOSA-N 1 2 305.381 4.074 20 0 DIADLO c1ccc(-c2nc(C[N@H+]3CCC[C@H]3c3ccccc3)no2)cc1 ZINC000054993510 1057640735 /nfs/dbraw/zinc/64/07/35/1057640735.db2.gz CFOFIGPJMWFPGO-KRWDZBQOSA-N 1 2 305.381 4.074 20 0 DIADLO CC[C@H]([NH2+]Cc1coc(C2CC2)n1)c1ccccc1OC(F)F ZINC000727466181 1057654535 /nfs/dbraw/zinc/65/45/35/1057654535.db2.gz YRVOSHMGCUESPD-AWEZNQCLSA-N 1 2 322.355 4.394 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(C2CC2)n1)c1ccc(Br)cc1 ZINC000727463192 1057655080 /nfs/dbraw/zinc/65/50/80/1057655080.db2.gz GEPWUBOQOKCQNC-SNVBAGLBSA-N 1 2 321.218 4.165 20 0 DIADLO C[C@H]([NH2+]Cc1coc(C2CC2)n1)c1cccc(OC(F)F)c1 ZINC000727465537 1057655102 /nfs/dbraw/zinc/65/51/02/1057655102.db2.gz AOURBTZFPRZASS-JTQLQIEISA-N 1 2 308.328 4.004 20 0 DIADLO CC(C)Sc1ccc(Cl)cc1NC(=O)CCc1c[nH]c[nH+]1 ZINC000280527790 1057656369 /nfs/dbraw/zinc/65/63/69/1057656369.db2.gz NJCRYIDFQYXWNY-UHFFFAOYSA-N 1 2 323.849 4.135 20 0 DIADLO CC(C)Sc1ccc(Cl)cc1NC(=O)CCc1c[nH+]c[nH]1 ZINC000280527790 1057656371 /nfs/dbraw/zinc/65/63/71/1057656371.db2.gz NJCRYIDFQYXWNY-UHFFFAOYSA-N 1 2 323.849 4.135 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2cc(Cl)nc(Cl)c2)cc1 ZINC001243368090 1057660985 /nfs/dbraw/zinc/66/09/85/1057660985.db2.gz DSFMIDLEBVIGGO-UHFFFAOYSA-N 1 2 304.180 4.456 20 0 DIADLO CCC[N@H+](CC)Cn1nc(-c2ccco2)n(CC(C)C)c1=S ZINC000727820947 1057676644 /nfs/dbraw/zinc/67/66/44/1057676644.db2.gz UBBIFVXNIITQCG-UHFFFAOYSA-N 1 2 322.478 4.019 20 0 DIADLO CCC[N@@H+](CC)Cn1nc(-c2ccco2)n(CC(C)C)c1=S ZINC000727820947 1057676650 /nfs/dbraw/zinc/67/66/50/1057676650.db2.gz UBBIFVXNIITQCG-UHFFFAOYSA-N 1 2 322.478 4.019 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2nccn2CC(F)(F)F)C1 ZINC000285535355 1057686085 /nfs/dbraw/zinc/68/60/85/1057686085.db2.gz FPXPXCZRFQIEEI-ZFWWWQNUSA-N 1 2 323.362 4.029 20 0 DIADLO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2nccn2CC(F)(F)F)C1 ZINC000285535355 1057686087 /nfs/dbraw/zinc/68/60/87/1057686087.db2.gz FPXPXCZRFQIEEI-ZFWWWQNUSA-N 1 2 323.362 4.029 20 0 DIADLO COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1cc(C(C)C)no1 ZINC000169278445 1057690839 /nfs/dbraw/zinc/69/08/39/1057690839.db2.gz HAXVUHITWMTORD-LLVKDONJSA-N 1 2 308.809 4.311 20 0 DIADLO Cc1ccccc1NC(=O)c1c(C)cccc1-c1ccc[nH+]c1N ZINC001243472242 1057691304 /nfs/dbraw/zinc/69/13/04/1057691304.db2.gz GHFRSCCIHDWYCX-UHFFFAOYSA-N 1 2 317.392 4.200 20 0 DIADLO CCOc1ccc(Cc2cccc(-c3ccc[nH+]c3N)c2)cc1 ZINC001243474528 1057691450 /nfs/dbraw/zinc/69/14/50/1057691450.db2.gz NFIWZRYHVZCLJQ-UHFFFAOYSA-N 1 2 304.393 4.320 20 0 DIADLO CCCCN(C(=O)CCc1c[nH]c[nH+]1)[C@H](CC)c1ccccc1 ZINC000498010776 1057692064 /nfs/dbraw/zinc/69/20/64/1057692064.db2.gz DNUAZYMRHCFUKW-GOSISDBHSA-N 1 2 313.445 4.122 20 0 DIADLO CCCCN(C(=O)CCc1c[nH+]c[nH]1)[C@H](CC)c1ccccc1 ZINC000498010776 1057692068 /nfs/dbraw/zinc/69/20/68/1057692068.db2.gz DNUAZYMRHCFUKW-GOSISDBHSA-N 1 2 313.445 4.122 20 0 DIADLO CCCCN(C(=O)CCc1c[nH]c[nH+]1)[C@@H](CC)c1ccccc1 ZINC000498010777 1057692078 /nfs/dbraw/zinc/69/20/78/1057692078.db2.gz DNUAZYMRHCFUKW-SFHVURJKSA-N 1 2 313.445 4.122 20 0 DIADLO CCCCN(C(=O)CCc1c[nH+]c[nH]1)[C@@H](CC)c1ccccc1 ZINC000498010777 1057692081 /nfs/dbraw/zinc/69/20/81/1057692081.db2.gz DNUAZYMRHCFUKW-SFHVURJKSA-N 1 2 313.445 4.122 20 0 DIADLO Cc1cn2cc(-c3cc(F)c(OC(F)F)c(F)c3)ccc2[nH+]1 ZINC001243492117 1057695173 /nfs/dbraw/zinc/69/51/73/1057695173.db2.gz NWRBQBQTCQBVJK-UHFFFAOYSA-N 1 2 310.250 4.189 20 0 DIADLO COC(=O)c1c[nH]c2nc(-c3ccc(C4CCCC4)cc3)[nH+]cc12 ZINC001243494361 1057696014 /nfs/dbraw/zinc/69/60/14/1057696014.db2.gz YOYXHSRHZVQBLE-UHFFFAOYSA-N 1 2 321.380 4.021 20 0 DIADLO S=c1sc(-c2ccccc2)nn1C[N@@H+]1CCC[C@H]1C1CC1 ZINC000729983974 1057699979 /nfs/dbraw/zinc/69/99/79/1057699979.db2.gz RIRMSDCBHZIWAN-AWEZNQCLSA-N 1 2 317.483 4.173 20 0 DIADLO S=c1sc(-c2ccccc2)nn1C[N@H+]1CCC[C@H]1C1CC1 ZINC000729983974 1057699980 /nfs/dbraw/zinc/69/99/80/1057699980.db2.gz RIRMSDCBHZIWAN-AWEZNQCLSA-N 1 2 317.483 4.173 20 0 DIADLO CC[N@H+](CC(C)C)Cn1nc(-c2ccccc2)sc1=S ZINC000729981712 1057700292 /nfs/dbraw/zinc/70/02/92/1057700292.db2.gz PSSUDMZZGFMNFD-UHFFFAOYSA-N 1 2 307.488 4.276 20 0 DIADLO CC[N@@H+](CC(C)C)Cn1nc(-c2ccccc2)sc1=S ZINC000729981712 1057700295 /nfs/dbraw/zinc/70/02/95/1057700295.db2.gz PSSUDMZZGFMNFD-UHFFFAOYSA-N 1 2 307.488 4.276 20 0 DIADLO CCOc1c(F)cccc1-c1ccc(-n2cc[nH+]c2)cc1OC ZINC001243536722 1057706607 /nfs/dbraw/zinc/70/66/07/1057706607.db2.gz MSUQZCPYNXMUJT-UHFFFAOYSA-N 1 2 312.344 4.086 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(Cl)c(O)c1 ZINC001243578412 1057721419 /nfs/dbraw/zinc/72/14/19/1057721419.db2.gz PGFKYXVBPYVPRK-UHFFFAOYSA-N 1 2 302.805 4.406 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(C(F)(F)F)cc2O)cc1 ZINC001243610976 1057732957 /nfs/dbraw/zinc/73/29/57/1057732957.db2.gz DAEKEHOUZHLROA-UHFFFAOYSA-N 1 2 318.298 4.479 20 0 DIADLO CC(C)Oc1c(F)cc(F)c(-c2ccc3[nH+]ccn3c2)c1F ZINC001243616058 1057734298 /nfs/dbraw/zinc/73/42/98/1057734298.db2.gz LMINXJDGJYHJCR-UHFFFAOYSA-N 1 2 306.287 4.206 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1c(F)cc(F)c(OC(C)C)c1F ZINC001243616062 1057734352 /nfs/dbraw/zinc/73/43/52/1057734352.db2.gz LMOUDQXNEIKOHO-UHFFFAOYSA-N 1 2 324.346 4.328 20 0 DIADLO CNc1ccc(Nc2ccc(Oc3ccccc3F)nc2)c[nH+]1 ZINC001203449136 1057741407 /nfs/dbraw/zinc/74/14/07/1057741407.db2.gz AZSPPPCSURYARP-UHFFFAOYSA-N 1 2 310.332 4.193 20 0 DIADLO CCc1nc2sccc2c(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC001243657223 1057745402 /nfs/dbraw/zinc/74/54/02/1057745402.db2.gz SHXOZQSXORMYCB-UHFFFAOYSA-N 1 2 320.421 4.166 20 0 DIADLO Cc1ccc(C(F)(F)F)nc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243655772 1057745617 /nfs/dbraw/zinc/74/56/17/1057745617.db2.gz CXHBQUSMDLADBW-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO COc1cnc(-c2ccc(Cn3cc[nH+]c3)cc2)c2ccccc12 ZINC001243656253 1057745630 /nfs/dbraw/zinc/74/56/30/1057745630.db2.gz GOOFVZVMJNGFSG-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO c1cn(Cc2ccc(-c3ccnc(-c4ccccc4)n3)cc2)c[nH+]1 ZINC001243656708 1057745687 /nfs/dbraw/zinc/74/56/87/1057745687.db2.gz JFBPXLCZGAOHEZ-UHFFFAOYSA-N 1 2 312.376 4.055 20 0 DIADLO FC(F)(F)c1cccc(-c2ccc(Cn3cc[nH+]c3)cc2)n1 ZINC001243657618 1057746067 /nfs/dbraw/zinc/74/60/67/1057746067.db2.gz SIZZUGIZHJTOFK-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO Fc1ccc2nc(-c3ccc(Cn4cc[nH+]c4)cc3)ccc2c1 ZINC001243657766 1057746116 /nfs/dbraw/zinc/74/61/16/1057746116.db2.gz TWTDJKXJZPEQML-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO CCc1cc(NC(C)=O)cc(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243658738 1057746468 /nfs/dbraw/zinc/74/64/68/1057746468.db2.gz GGZFMTQUJGEEOX-UHFFFAOYSA-N 1 2 319.408 4.119 20 0 DIADLO c1cn(Cc2ccc(-c3cc(C4CC4)nc(C4CC4)n3)cc2)c[nH+]1 ZINC001243657901 1057746525 /nfs/dbraw/zinc/74/65/25/1057746525.db2.gz ZNWPJVPYNLUDLD-UHFFFAOYSA-N 1 2 316.408 4.143 20 0 DIADLO Fc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c2cccnc12 ZINC001243659010 1057746558 /nfs/dbraw/zinc/74/65/58/1057746558.db2.gz XWXRJWUHLAMFFK-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO Fc1cccc(OC(F)F)c1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243657584 1057746668 /nfs/dbraw/zinc/74/66/68/1057746668.db2.gz NLBGAFQVLPBNND-UHFFFAOYSA-N 1 2 318.298 4.339 20 0 DIADLO CCc1cc2c(ccnc2-c2ccc(Cn3cc[nH+]c3)cc2)o1 ZINC001243659219 1057746970 /nfs/dbraw/zinc/74/69/70/1057746970.db2.gz OLBYFBAGGHCYMQ-UHFFFAOYSA-N 1 2 303.365 4.302 20 0 DIADLO COc1ccc2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)cc2n1 ZINC001243659100 1057747199 /nfs/dbraw/zinc/74/71/99/1057747199.db2.gz LINNPLBOMIYSHT-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Cc1ncc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1C(F)(F)F ZINC001243660262 1057747338 /nfs/dbraw/zinc/74/73/38/1057747338.db2.gz SKNOIYUKEFAZPL-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO CCOc1cc(OC)cc(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243660879 1057747745 /nfs/dbraw/zinc/74/77/45/1057747745.db2.gz ZHVIOAODLDVTFH-UHFFFAOYSA-N 1 2 308.381 4.006 20 0 DIADLO Fc1cccc2c(-c3ccc(Cn4cc[nH+]c4)cc3)ccnc12 ZINC001243663559 1057748567 /nfs/dbraw/zinc/74/85/67/1057748567.db2.gz XBDRINPSLFVQFQ-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO CC[N@H+](C)[C@@H](C(=O)Oc1ccc(SC)cc1)c1ccccc1 ZINC000731598551 1057749216 /nfs/dbraw/zinc/74/92/16/1057749216.db2.gz MIIRYNOTZBVOQM-QGZVFWFLSA-N 1 2 315.438 4.007 20 0 DIADLO CC[N@@H+](C)[C@@H](C(=O)Oc1ccc(SC)cc1)c1ccccc1 ZINC000731598551 1057749220 /nfs/dbraw/zinc/74/92/20/1057749220.db2.gz MIIRYNOTZBVOQM-QGZVFWFLSA-N 1 2 315.438 4.007 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)s1)Cn1ccc(-c2ccsc2)n1 ZINC000731657146 1057749776 /nfs/dbraw/zinc/74/97/76/1057749776.db2.gz CNCPWSJRHARCKT-UHFFFAOYSA-N 1 2 323.874 4.416 20 0 DIADLO C[N@H+](Cc1ccc(Cl)s1)Cn1ccc(-c2ccsc2)n1 ZINC000731657146 1057749779 /nfs/dbraw/zinc/74/97/79/1057749779.db2.gz CNCPWSJRHARCKT-UHFFFAOYSA-N 1 2 323.874 4.416 20 0 DIADLO Clc1cccc(-c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)c1 ZINC000731788006 1057753117 /nfs/dbraw/zinc/75/31/17/1057753117.db2.gz AYUDYLQYGVVNKH-UHFFFAOYSA-N 1 2 322.755 4.243 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1cccc(F)c1F ZINC000731893973 1057757875 /nfs/dbraw/zinc/75/78/75/1057757875.db2.gz WMBMXRGOYJBSPI-TYILLQQXSA-N 1 2 317.379 4.315 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@H+]1Cc1cccc(F)c1F ZINC000731893973 1057757877 /nfs/dbraw/zinc/75/78/77/1057757877.db2.gz WMBMXRGOYJBSPI-TYILLQQXSA-N 1 2 317.379 4.315 20 0 DIADLO CC[N@@H+](c1ccc(Nc2nc3ccccc3c(=O)[nH]2)cc1)C(C)C ZINC000731905841 1057758753 /nfs/dbraw/zinc/75/87/53/1057758753.db2.gz YCTWAPWZCGQVRP-UHFFFAOYSA-N 1 2 322.412 4.314 20 0 DIADLO CC[N@H+](c1ccc(Nc2nc3ccccc3c(=O)[nH]2)cc1)C(C)C ZINC000731905841 1057758755 /nfs/dbraw/zinc/75/87/55/1057758755.db2.gz YCTWAPWZCGQVRP-UHFFFAOYSA-N 1 2 322.412 4.314 20 0 DIADLO C/C(=C/C(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1cccc(F)c1 ZINC000731973779 1057762855 /nfs/dbraw/zinc/76/28/55/1057762855.db2.gz HXCPDEREDNXHOG-UVTDQMKNSA-N 1 2 321.355 4.053 20 0 DIADLO Cc1ccc([C@@H](C)Nc2cc(N3CCCCC3)nc[nH+]2)s1 ZINC000731984229 1057763985 /nfs/dbraw/zinc/76/39/85/1057763985.db2.gz YMNAJKXWBTWJIA-CYBMUJFWSA-N 1 2 302.447 4.010 20 0 DIADLO Cc1ccc([C@@H](C)Nc2cc(N3CCCCC3)[nH+]cn2)s1 ZINC000731984229 1057763989 /nfs/dbraw/zinc/76/39/89/1057763989.db2.gz YMNAJKXWBTWJIA-CYBMUJFWSA-N 1 2 302.447 4.010 20 0 DIADLO Cc1nn(C[N@@H+]2CCCC3(CCCCC3)C2)c(=S)n1C1CC1 ZINC000732191062 1057769565 /nfs/dbraw/zinc/76/95/65/1057769565.db2.gz OOLOIAIJNSBWJK-UHFFFAOYSA-N 1 2 320.506 4.061 20 0 DIADLO Cc1nn(C[N@H+]2CCCC3(CCCCC3)C2)c(=S)n1C1CC1 ZINC000732191062 1057769568 /nfs/dbraw/zinc/76/95/68/1057769568.db2.gz OOLOIAIJNSBWJK-UHFFFAOYSA-N 1 2 320.506 4.061 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1ccc(F)c(F)c1 ZINC000732209998 1057769637 /nfs/dbraw/zinc/76/96/37/1057769637.db2.gz YTCWYCDIVVBFCA-TYILLQQXSA-N 1 2 317.379 4.315 20 0 DIADLO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@H+]1Cc1ccc(F)c(F)c1 ZINC000732209998 1057769639 /nfs/dbraw/zinc/76/96/39/1057769639.db2.gz YTCWYCDIVVBFCA-TYILLQQXSA-N 1 2 317.379 4.315 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2cc3cccc(OC)c3o2)cs1 ZINC000732232696 1057771217 /nfs/dbraw/zinc/77/12/17/1057771217.db2.gz SALKYMUHWJBSFO-NSHDSACASA-N 1 2 316.426 4.311 20 0 DIADLO Cc1cc(C)c(-c2cccc(NC(=O)OC(C)(C)C)n2)c(C)[nH+]1 ZINC001243761168 1057772626 /nfs/dbraw/zinc/77/26/26/1057772626.db2.gz RJDKSTLTVPOVDV-UHFFFAOYSA-N 1 2 313.401 4.416 20 0 DIADLO Cc1c(-c2cccc(NC(=O)OC(C)(C)C)n2)ccc2[nH+]ccn21 ZINC001243760689 1057772947 /nfs/dbraw/zinc/77/29/47/1057772947.db2.gz OMBODZMGNUKILI-UHFFFAOYSA-N 1 2 324.384 4.052 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(Cl)c3n[nH]cc32)c1 ZINC001243782420 1057777629 /nfs/dbraw/zinc/77/76/29/1057777629.db2.gz DADIIGBUFAQDJP-UHFFFAOYSA-N 1 2 308.772 4.284 20 0 DIADLO Cc1nc(OCC(C)C)ccc1-c1ccccc1Cn1cc[nH+]c1 ZINC001243795872 1057781417 /nfs/dbraw/zinc/78/14/17/1057781417.db2.gz BZDFNSILCNKBFY-UHFFFAOYSA-N 1 2 321.424 4.337 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2ccc(OCC(C)C)nc2C)cc1 ZINC001243801717 1057782612 /nfs/dbraw/zinc/78/26/12/1057782612.db2.gz ZHORGIUMQRGKQV-UHFFFAOYSA-N 1 2 312.413 4.454 20 0 DIADLO c1csc(-c2ccc(-c3cc[nH+]c(N4CCOCC4)c3)cc2)c1 ZINC001243900085 1057801773 /nfs/dbraw/zinc/80/17/73/1057801773.db2.gz QKYHVNFVXKRWCE-UHFFFAOYSA-N 1 2 322.433 4.314 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cc(F)nc(C(F)(F)F)c2)c1 ZINC001243912935 1057804641 /nfs/dbraw/zinc/80/46/41/1057804641.db2.gz CAVDFJGWWXMUTL-UHFFFAOYSA-N 1 2 321.277 4.307 20 0 DIADLO Cc1cn2c(cccc2-c2ccc(OC(F)(F)F)c(F)c2)[nH+]1 ZINC001243923601 1057809031 /nfs/dbraw/zinc/80/90/31/1057809031.db2.gz OEKNIIJPUMBGGJ-UHFFFAOYSA-N 1 2 310.250 4.347 20 0 DIADLO CC[N@H+](Cc1ncc(C(C)C)o1)[C@@H](C)c1cccc(OC)c1 ZINC000733306499 1057811023 /nfs/dbraw/zinc/81/10/23/1057811023.db2.gz BXAMVUYAQLPHBQ-AWEZNQCLSA-N 1 2 302.418 4.390 20 0 DIADLO CC[N@@H+](Cc1ncc(C(C)C)o1)[C@@H](C)c1cccc(OC)c1 ZINC000733306499 1057811027 /nfs/dbraw/zinc/81/10/27/1057811027.db2.gz BXAMVUYAQLPHBQ-AWEZNQCLSA-N 1 2 302.418 4.390 20 0 DIADLO COc1ccc(-c2ccc3[nH+]c(C)cn3c2)c(C(F)(F)F)c1 ZINC001243944186 1057815743 /nfs/dbraw/zinc/81/57/43/1057815743.db2.gz BKAIIXKMCPGYKB-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO CC[NH+](CC)c1ccc(C)c(-c2ccccc2CC(=O)OC)c1 ZINC001243956765 1057818475 /nfs/dbraw/zinc/81/84/75/1057818475.db2.gz HQWPEUFWAOKXJO-UHFFFAOYSA-N 1 2 311.425 4.224 20 0 DIADLO CCOC(=O)c1cc(F)cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001243978036 1057827098 /nfs/dbraw/zinc/82/70/98/1057827098.db2.gz FVCGUOXWXCZISK-UHFFFAOYSA-N 1 2 310.328 4.060 20 0 DIADLO CC(=O)Nc1c(C)cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1C ZINC001243978647 1057827135 /nfs/dbraw/zinc/82/71/35/1057827135.db2.gz KSUWHTXVZPXFPJ-UHFFFAOYSA-N 1 2 305.381 4.319 20 0 DIADLO COC(=O)c1cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc2[nH]ccc21 ZINC001243977382 1057827240 /nfs/dbraw/zinc/82/72/40/1057827240.db2.gz DISPGIJPIIPPRV-UHFFFAOYSA-N 1 2 317.348 4.012 20 0 DIADLO COC(=O)c1cc(C)c(-c2ccc(-c3[nH]cc[nH+]3)cc2)c(C)c1 ZINC001243977939 1057827596 /nfs/dbraw/zinc/82/75/96/1057827596.db2.gz BQGVSEOHBJUCOX-UHFFFAOYSA-N 1 2 306.365 4.147 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1c(O)cccc1Cl ZINC001244051131 1057849833 /nfs/dbraw/zinc/84/98/33/1057849833.db2.gz OZMQDGZDHVQUBW-UHFFFAOYSA-N 1 2 302.805 4.406 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(OCC(F)F)cc2)cc1 ZINC001244067777 1057855701 /nfs/dbraw/zinc/85/57/01/1057855701.db2.gz MSYDYYPYMGUKBQ-UHFFFAOYSA-N 1 2 314.335 4.398 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(OCC(F)F)cc2)c1 ZINC001244069174 1057856375 /nfs/dbraw/zinc/85/63/75/1057856375.db2.gz WRCHHRFHJYTGLH-UHFFFAOYSA-N 1 2 314.335 4.398 20 0 DIADLO COc1cccc(C(F)(F)F)c1-c1[nH+]ccc2c1ccn2C ZINC001244081525 1057862268 /nfs/dbraw/zinc/86/22/68/1057862268.db2.gz HDDGCGOMGBASBT-UHFFFAOYSA-N 1 2 306.287 4.268 20 0 DIADLO COc1c(C)cc(C)cc1-c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001244119187 1057875081 /nfs/dbraw/zinc/87/50/81/1057875081.db2.gz UJOXSYHGAGQSBB-UHFFFAOYSA-N 1 2 305.368 4.319 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cccc(C4CC4)c3C)nn2)c1C ZINC001244133341 1057882146 /nfs/dbraw/zinc/88/21/46/1057882146.db2.gz STVAMISDZIDWLE-UHFFFAOYSA-N 1 2 304.397 4.132 20 0 DIADLO COc1cc(-c2nc3[nH]ccc3c[nH+]2)ccc1-c1ccccc1 ZINC001244140068 1057883682 /nfs/dbraw/zinc/88/36/82/1057883682.db2.gz HEQCSIIIIWQYJL-UHFFFAOYSA-N 1 2 301.349 4.252 20 0 DIADLO COCc1ccc(C)c(-c2ccc(-n3cc[nH+]c3)cc2OC)c1 ZINC001244172579 1057891812 /nfs/dbraw/zinc/89/18/12/1057891812.db2.gz NEUFFVWANKSFOO-UHFFFAOYSA-N 1 2 308.381 4.003 20 0 DIADLO Fc1ccc(-c2ccccc2N2CCCC2)cc1-n1cc[nH+]c1 ZINC001244185971 1057894834 /nfs/dbraw/zinc/89/48/34/1057894834.db2.gz OQZVTSMTALKXTA-UHFFFAOYSA-N 1 2 307.372 4.279 20 0 DIADLO COc1cccc(C2CC2)c1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001244254142 1057912520 /nfs/dbraw/zinc/91/25/20/1057912520.db2.gz UJYAYUFLPONKKL-UHFFFAOYSA-N 1 2 308.303 4.236 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(N2CCCCC2)cc1F ZINC001244263791 1057915739 /nfs/dbraw/zinc/91/57/39/1057915739.db2.gz CJSIGQOBUAMOKJ-UHFFFAOYSA-N 1 2 313.420 4.252 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2ccc(N3CCCC3)cc2F)cc1 ZINC001244271940 1057919574 /nfs/dbraw/zinc/91/95/74/1057919574.db2.gz FDIXLNWQCNZUCW-UHFFFAOYSA-N 1 2 312.388 4.455 20 0 DIADLO CC[NH+](CC)Cc1ccncc1-c1cc(F)c(O)c(Cl)c1 ZINC001244504147 1057978943 /nfs/dbraw/zinc/97/89/43/1057978943.db2.gz LAXSAHVNOVXJPE-UHFFFAOYSA-N 1 2 308.784 4.089 20 0 DIADLO Oc1c(F)cc(-c2ccc(C[NH+]3CCCCC3)cn2)cc1Cl ZINC001244504267 1057979223 /nfs/dbraw/zinc/97/92/23/1057979223.db2.gz NNCQASPFUIVMBU-UHFFFAOYSA-N 1 2 320.795 4.233 20 0 DIADLO COc1c(C)ccc(F)c1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001244529059 1057986677 /nfs/dbraw/zinc/98/66/77/1057986677.db2.gz YBWGJQQDSBLXRI-UHFFFAOYSA-N 1 2 300.308 4.135 20 0 DIADLO Oc1ccc(Cl)c(-c2ccc(Cn3cc[nH+]c3)cc2)c1F ZINC001244542806 1057992178 /nfs/dbraw/zinc/99/21/78/1057992178.db2.gz OCGZJRQJWUVCSF-UHFFFAOYSA-N 1 2 302.736 4.097 20 0 DIADLO Cc1cc(N(C)C)nc(-c2ccc(NCc3ccccc3)cc2)[nH+]1 ZINC001244642498 1058018060 /nfs/dbraw/zinc/01/80/60/1058018060.db2.gz DVIQCTHHFRGUCI-UHFFFAOYSA-N 1 2 318.424 4.130 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cnc(OC(C)C)c(C)c1 ZINC001244688157 1058026663 /nfs/dbraw/zinc/02/66/63/1058026663.db2.gz LMJQMPDWXVTNDT-UHFFFAOYSA-N 1 2 323.396 4.039 20 0 DIADLO COc1c(F)cc(-c2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC001244698481 1058029403 /nfs/dbraw/zinc/02/94/03/1058029403.db2.gz HHUBAHUYWLDZEJ-UHFFFAOYSA-N 1 2 302.736 4.340 20 0 DIADLO Cc1cn2c(cccc2-c2c(F)c(F)ccc2OC(C)C)[nH+]1 ZINC001244739940 1058039183 /nfs/dbraw/zinc/03/91/83/1058039183.db2.gz ADJFFPOLNHSGQO-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1c(F)c(F)ccc1OC(C)C ZINC001244741348 1058039506 /nfs/dbraw/zinc/03/95/06/1058039506.db2.gz SABCRANWAUNIDR-UHFFFAOYSA-N 1 2 306.356 4.188 20 0 DIADLO Nc1cn2ccc(-c3ccc(Cl)cc3C(F)(F)F)cc2[nH+]1 ZINC001244772602 1058045436 /nfs/dbraw/zinc/04/54/36/1058045436.db2.gz DXLKOIKCLNMHEV-UHFFFAOYSA-N 1 2 311.694 4.256 20 0 DIADLO Cc1cc[nH+]c(C)c1C1=CC[C@@H](OC(=O)c2ccccc2)CC1 ZINC001244808314 1058051154 /nfs/dbraw/zinc/05/11/54/1058051154.db2.gz YSJCMVZCLDCBKY-GOSISDBHSA-N 1 2 307.393 4.491 20 0 DIADLO Cc1cc[nH+]c(C)c1C1=CC[C@H](OC(=O)c2ccccc2)CC1 ZINC001244808316 1058051298 /nfs/dbraw/zinc/05/12/98/1058051298.db2.gz YSJCMVZCLDCBKY-SFHVURJKSA-N 1 2 307.393 4.491 20 0 DIADLO Cc1c[nH]c2cccc(-c3cccc(C[NH+]4CCOCC4)c3F)c12 ZINC001244852760 1058058914 /nfs/dbraw/zinc/05/89/14/1058058914.db2.gz COHWCEWVYSBTHF-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO COc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)ccc1C1CC1 ZINC001244890819 1058067208 /nfs/dbraw/zinc/06/72/08/1058067208.db2.gz OBXBUKNIMZVMHW-UHFFFAOYSA-N 1 2 304.393 4.484 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1ccc(C2CCC2)cc1 ZINC001244944584 1058077531 /nfs/dbraw/zinc/07/75/31/1058077531.db2.gz VCASRASOWREHJC-UHFFFAOYSA-N 1 2 308.425 4.161 20 0 DIADLO CNc1cc(-c2ccnc3ccc(C(F)(F)F)cc32)cc[nH+]1 ZINC001244970682 1058083584 /nfs/dbraw/zinc/08/35/84/1058083584.db2.gz AGAHYVDFZCIMPL-UHFFFAOYSA-N 1 2 303.287 4.357 20 0 DIADLO CNc1cc(-c2ccc(C3(C(=O)OC)CCCCC3)cc2)cc[nH+]1 ZINC001244977046 1058084946 /nfs/dbraw/zinc/08/49/46/1058084946.db2.gz PIRMEASYBNCIJN-UHFFFAOYSA-N 1 2 324.424 4.165 20 0 DIADLO CCOc1cc(C)c(C)cc1-c1cc(N)c(C(F)(F)F)c[nH+]1 ZINC001245023111 1058096237 /nfs/dbraw/zinc/09/62/37/1058096237.db2.gz CRMOOGZSJFOQTP-UHFFFAOYSA-N 1 2 310.319 4.365 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cc(F)cc(C(C)(C)O)c2)c1 ZINC001245141987 1058120310 /nfs/dbraw/zinc/12/03/10/1058120310.db2.gz GGVKLFIUBRRBMF-UHFFFAOYSA-N 1 2 310.372 4.121 20 0 DIADLO CCOC(=O)c1ccc(C)c(-c2c[nH+]cn2Cc2ccccc2)c1 ZINC001245198529 1058126932 /nfs/dbraw/zinc/12/69/32/1058126932.db2.gz JQQRLJIPYYSRBY-UHFFFAOYSA-N 1 2 320.392 4.084 20 0 DIADLO COc1ccc(-c2c[nH+]cn2Cc2ccccc2)c2ccncc12 ZINC001245200912 1058127026 /nfs/dbraw/zinc/12/70/26/1058127026.db2.gz JGACENNUUAULEC-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO CCOC(=O)c1cccc(-c2c[nH+]cn2Cc2ccccc2)c1C ZINC001245199129 1058127088 /nfs/dbraw/zinc/12/70/88/1058127088.db2.gz QRVJNRJAHKOREN-UHFFFAOYSA-N 1 2 320.392 4.084 20 0 DIADLO Fc1cnc2ccc(-c3c[nH+]cn3Cc3ccccc3)cc2c1 ZINC001245198636 1058127162 /nfs/dbraw/zinc/12/71/62/1058127162.db2.gz KXRRFYIHYPETIO-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO COc1c(F)cc(SC)cc1-c1ccc(-n2cc[nH+]c2)cc1 ZINC001245226270 1058129855 /nfs/dbraw/zinc/12/98/55/1058129855.db2.gz SOEBMUKGPIIJHK-UHFFFAOYSA-N 1 2 314.385 4.409 20 0 DIADLO CCCOc1ccc(-c2c[nH+]c(N3CCCCC3)cc2C)cn1 ZINC001245232410 1058131100 /nfs/dbraw/zinc/13/11/00/1058131100.db2.gz YDQVEOWXMWRYEP-UHFFFAOYSA-N 1 2 311.429 4.231 20 0 DIADLO Cc1cc(Oc2ccc(NC(=S)NCC(C)C)cc2)cc[nH+]1 ZINC001245253122 1058135432 /nfs/dbraw/zinc/13/54/32/1058135432.db2.gz ADZWTZKACKDAGJ-UHFFFAOYSA-N 1 2 315.442 4.125 20 0 DIADLO COc1c(-c2cn3cc[nH+]c3cc2C)cccc1C(F)(F)F ZINC001245275615 1058138415 /nfs/dbraw/zinc/13/84/15/1058138415.db2.gz RAZSUMBQEADSNE-UHFFFAOYSA-N 1 2 306.287 4.337 20 0 DIADLO Cc1ccc(-c2ccc(OCc3ccccc3F)cc2)[nH+]c1N ZINC001245295311 1058142244 /nfs/dbraw/zinc/14/22/44/1058142244.db2.gz YMJQFPXKMRKPAT-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO Cc1cccc2[nH]c(-c3cc(C[NH+]4CCOCC4)ccc3F)cc21 ZINC001245346801 1058149046 /nfs/dbraw/zinc/14/90/46/1058149046.db2.gz KUGHXDZZWYTDDB-UHFFFAOYSA-N 1 2 324.399 4.115 20 0 DIADLO CC(=O)OCc1cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)ccc1C ZINC001245382752 1058157721 /nfs/dbraw/zinc/15/77/21/1058157721.db2.gz XJQBOGBOKIUZJZ-UHFFFAOYSA-N 1 2 324.355 4.050 20 0 DIADLO CC(C)COc1ncc(-c2[nH+]ccc3[nH]ccc32)cc1Cl ZINC001245531509 1058210897 /nfs/dbraw/zinc/21/08/97/1058210897.db2.gz ZZPIFMGIKYBOBL-UHFFFAOYSA-N 1 2 301.777 4.313 20 0 DIADLO CC(C)COc1ncc(-c2ccn3cc[nH+]c3c2)cc1Cl ZINC001245533330 1058213052 /nfs/dbraw/zinc/21/30/52/1058213052.db2.gz PUUWNISEBLYCLD-UHFFFAOYSA-N 1 2 301.777 4.085 20 0 DIADLO Cc1cn2cc(-c3cnc(OCC(C)C)c(Cl)c3)ccc2[nH+]1 ZINC001245533826 1058215861 /nfs/dbraw/zinc/21/58/61/1058215861.db2.gz WCVPKCYBKNLILI-UHFFFAOYSA-N 1 2 315.804 4.393 20 0 DIADLO Cc1cc(-c2cc(C(F)(F)F)c3cc(F)ccc3n2)c[nH+]c1N ZINC001245540423 1058220129 /nfs/dbraw/zinc/22/01/29/1058220129.db2.gz DHGNFOQAMZAKIA-UHFFFAOYSA-N 1 2 321.277 4.345 20 0 DIADLO COc1cccc(OC)c1-c1ccc(-c2c[nH+]c(N)c(C)c2)cc1 ZINC001245541158 1058220242 /nfs/dbraw/zinc/22/02/42/1058220242.db2.gz MGCRYONLNKAKMP-UHFFFAOYSA-N 1 2 320.392 4.323 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2cc(C(=O)OC)c(C)cc2C)cc1 ZINC001245552777 1058227646 /nfs/dbraw/zinc/22/76/46/1058227646.db2.gz BIEFXKFGJYWRAL-UHFFFAOYSA-N 1 2 311.381 4.119 20 0 DIADLO Cc1ccc2[nH]c(-c3cc(F)c(C[NH+](C)C)c(F)c3)cc2c1 ZINC001245573053 1058241370 /nfs/dbraw/zinc/24/13/70/1058241370.db2.gz UJICTYGYSBZJKP-UHFFFAOYSA-N 1 2 300.352 4.483 20 0 DIADLO COc1ccc2[nH]c(-c3ccc(F)c(-n4cc[nH+]c4)c3)cc2c1 ZINC001245597456 1058270868 /nfs/dbraw/zinc/27/08/68/1058270868.db2.gz PDYXHSJQCZEFSV-UHFFFAOYSA-N 1 2 307.328 4.168 20 0 DIADLO CC(C)Cc1cccc([C@H](C)C(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC001527999859 1058295048 /nfs/dbraw/zinc/29/50/48/1058295048.db2.gz MDJYBDZOARURFS-HNNXBMFYSA-N 1 2 321.424 4.275 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(-c3ncco3)cc2)cc1 ZINC001245623208 1058295283 /nfs/dbraw/zinc/29/52/83/1058295283.db2.gz KZJOBUHXSLPPRP-UHFFFAOYSA-N 1 2 301.349 4.409 20 0 DIADLO CC(C)(C)Oc1cccc(NC(=O)Nc2ccc3[nH+]ccn3c2)c1 ZINC001563092204 1058299404 /nfs/dbraw/zinc/29/94/04/1058299404.db2.gz ZJPBIOAPMAEQCN-UHFFFAOYSA-N 1 2 324.384 4.156 20 0 DIADLO C[N@@H+]1CCCC[C@@H]1c1ccc(-c2cc(Cl)c(O)cc2F)nc1 ZINC001245670679 1058327145 /nfs/dbraw/zinc/32/71/45/1058327145.db2.gz VKMREFLYWZUPTJ-MRXNPFEDSA-N 1 2 320.795 4.404 20 0 DIADLO C[N@H+]1CCCC[C@@H]1c1ccc(-c2cc(Cl)c(O)cc2F)nc1 ZINC001245670679 1058327154 /nfs/dbraw/zinc/32/71/54/1058327154.db2.gz VKMREFLYWZUPTJ-MRXNPFEDSA-N 1 2 320.795 4.404 20 0 DIADLO COc1cc(C)c(-c2cc(F)c(C[NH+](C)C)c(F)c2)c(C)c1 ZINC001245683312 1058345568 /nfs/dbraw/zinc/34/55/68/1058345568.db2.gz RPCJVJTVPAMALI-UHFFFAOYSA-N 1 2 305.368 4.319 20 0 DIADLO C[C@H]([NH2+][C@@H]1CC(C)(C)Oc2ccc(F)cc21)c1ncccc1F ZINC001550704096 1058355328 /nfs/dbraw/zinc/35/53/28/1058355328.db2.gz OKIYUODMBNYDPN-XHDPSFHLSA-N 1 2 318.367 4.313 20 0 DIADLO Cc1ccc([C@H](C)NC(=O)Nc2c(C)cc(C)[nH+]c2C)s1 ZINC001562900615 1058356353 /nfs/dbraw/zinc/35/63/53/1058356353.db2.gz LLWDRKANCGUZPX-LBPRGKRZSA-N 1 2 303.431 4.259 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(Cn3cccc3)cc2)c(C)[nH+]1 ZINC001518701323 1058370005 /nfs/dbraw/zinc/37/00/05/1058370005.db2.gz YBRRQOUGHVELGB-UHFFFAOYSA-N 1 2 319.408 4.109 20 0 DIADLO CCOc1cc(F)c(-c2c[nH+]c(N(C)C)cc2C)cc1Cl ZINC001245705242 1058375146 /nfs/dbraw/zinc/37/51/46/1058375146.db2.gz WYMDSZAIKQIRQZ-UHFFFAOYSA-N 1 2 308.784 4.314 20 0 DIADLO COc1cc(-c2ccc3[nH+]c(C)cn3c2)ccc1OC(F)(F)F ZINC001245713962 1058387879 /nfs/dbraw/zinc/38/78/79/1058387879.db2.gz DEIALBJRJFMUEN-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@H]3CCCC[C@H]32)[nH+]c1C ZINC001551740609 1058408254 /nfs/dbraw/zinc/40/82/54/1058408254.db2.gz NRSJKHJJTSRRNF-BFYDXBDKSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@H]2C2CCCC2)[nH+]c1C ZINC001551741508 1058408740 /nfs/dbraw/zinc/40/87/40/1058408740.db2.gz PSMYDPDPDWIXSV-IRXDYDNUSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2CCCC[C@@H]2C)[nH+]c1C ZINC001551737385 1058408887 /nfs/dbraw/zinc/40/88/87/1058408887.db2.gz DEUQRMAOEUOBGS-SWLSCSKDSA-N 1 2 311.429 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@@H]2C2CCCC2)[nH+]c1C ZINC001551741507 1058408907 /nfs/dbraw/zinc/40/89/07/1058408907.db2.gz PSMYDPDPDWIXSV-IAGOWNOFSA-N 1 2 323.440 4.458 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2CCC(F)(F)C2)[nH+]c1C ZINC001551737366 1058409482 /nfs/dbraw/zinc/40/94/82/1058409482.db2.gz CWRBFYZCFHLWTN-GFCCVEGCSA-N 1 2 319.355 4.067 20 0 DIADLO CCCCC1CCC(C(=O)NCc2c[nH+]c(C)cc2C)CC1 ZINC001528514510 1058442473 /nfs/dbraw/zinc/44/24/73/1058442473.db2.gz TXZJGMYUJZJQGE-UHFFFAOYSA-N 1 2 302.462 4.311 20 0 DIADLO CSc1cnc(F)c(-c2c[nH+]c(N3CCCCC3)cc2C)c1 ZINC001245760868 1058446092 /nfs/dbraw/zinc/44/60/92/1058446092.db2.gz PDOCGSJGOUZOBF-UHFFFAOYSA-N 1 2 317.433 4.303 20 0 DIADLO Cc1cc(C)c(C(=O)NC[C@@H]2C[C@@H](C)CC[C@H]2C(C)C)c(C)[nH+]1 ZINC001519675465 1058457731 /nfs/dbraw/zinc/45/77/31/1058457731.db2.gz UKPQHESUXKBGGM-KKXDTOCCSA-N 1 2 316.489 4.445 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccccc3CCC(C)C)ccn12 ZINC001528579797 1058458658 /nfs/dbraw/zinc/45/86/58/1058458658.db2.gz SZZYFBRXCOBHFH-UHFFFAOYSA-N 1 2 321.424 4.484 20 0 DIADLO CCc1cc(C(=O)Nc2ccccc2-c2[nH]c(C)c(C)[nH+]2)c(C)o1 ZINC001553986923 1058510540 /nfs/dbraw/zinc/51/05/40/1058510540.db2.gz HJQUJKYEDGDGBB-UHFFFAOYSA-N 1 2 323.396 4.410 20 0 DIADLO Cc1ccc2sc(C(=O)NCc3c[nH+]c(C)cc3C)cc2c1 ZINC001528920227 1058553151 /nfs/dbraw/zinc/55/31/51/1058553151.db2.gz NZDGZVUXINEGAV-UHFFFAOYSA-N 1 2 310.422 4.152 20 0 DIADLO COc1cc(-c2cccc3[nH+]c(C)cn32)c(F)c(F)c1Cl ZINC001245856096 1058563232 /nfs/dbraw/zinc/56/32/32/1058563232.db2.gz ARYAPHMYMPRWMP-UHFFFAOYSA-N 1 2 308.715 4.250 20 0 DIADLO COc1cc(-c2ccc3[nH+]ccn3c2C)c(F)c(F)c1Cl ZINC001245858743 1058566452 /nfs/dbraw/zinc/56/64/52/1058566452.db2.gz YVOYCJVQHAPADC-UHFFFAOYSA-N 1 2 308.715 4.250 20 0 DIADLO COc1cc(-c2cn3cc[nH+]c3cc2C)c(F)c(F)c1Cl ZINC001245860179 1058567439 /nfs/dbraw/zinc/56/74/39/1058567439.db2.gz BCHFAYQNODDBOP-UHFFFAOYSA-N 1 2 308.715 4.250 20 0 DIADLO Cc1cc(CNC(=O)c2ccc(C3CCCC3)cc2)cc(C)[nH+]1 ZINC001529060479 1058590957 /nfs/dbraw/zinc/59/09/57/1058590957.db2.gz NPEVVYJOLVTQEH-UHFFFAOYSA-N 1 2 308.425 4.286 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(CO)c(F)c2Cl)cc1 ZINC001245883514 1058594449 /nfs/dbraw/zinc/59/44/49/1058594449.db2.gz IZWOKWAQKXEXCJ-UHFFFAOYSA-N 1 2 316.763 4.039 20 0 DIADLO C/C(=C/c1ccccc1Cl)C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001529383991 1058692725 /nfs/dbraw/zinc/69/27/25/1058692725.db2.gz CKVIQXQYLHZNPD-WQLSENKSSA-N 1 2 314.816 4.072 20 0 DIADLO CCC[C@H](CC)C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001520868337 1058703178 /nfs/dbraw/zinc/70/31/78/1058703178.db2.gz SKHIGGYUNMKPQQ-HOTGVXAUSA-N 1 2 319.493 4.170 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N[C@H](c3ccccc3C)C(C)C)ccn12 ZINC001521311120 1058819163 /nfs/dbraw/zinc/81/91/63/1058819163.db2.gz DDQQNZZWYHOKSE-IBGZPJMESA-N 1 2 321.424 4.078 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)c3ccsc3C)cc2)[nH+]c1C ZINC001558134590 1058843042 /nfs/dbraw/zinc/84/30/42/1058843042.db2.gz CPMFXCNHJCLHHG-UHFFFAOYSA-N 1 2 311.410 4.316 20 0 DIADLO CCCCCC[C@H](C)C(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001558351055 1058859400 /nfs/dbraw/zinc/85/94/00/1058859400.db2.gz FYDFLNLHIOKFNU-XJKSGUPXSA-N 1 2 305.466 4.297 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)C=C2CCC(C)(C)CC2)[nH+]c1C ZINC001558351043 1058860295 /nfs/dbraw/zinc/86/02/95/1058860295.db2.gz FTMVHZDGYFUIEG-MRXNPFEDSA-N 1 2 315.461 4.217 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C2CCC2)C2CCCC2)c(C)[nH+]1 ZINC001530079540 1058928647 /nfs/dbraw/zinc/92/86/47/1058928647.db2.gz IJMMPRWHZVDMGF-SFHVURJKSA-N 1 2 300.446 4.096 20 0 DIADLO CCc1ncnc(Nc2ccc([N@H+](CC)C(C)C)cc2)c1F ZINC001559063153 1058958622 /nfs/dbraw/zinc/95/86/22/1058958622.db2.gz DXJVGBMTMMASAZ-UHFFFAOYSA-N 1 2 302.397 4.156 20 0 DIADLO CCc1ncnc(Nc2ccc([N@@H+](CC)C(C)C)cc2)c1F ZINC001559063153 1058958641 /nfs/dbraw/zinc/95/86/41/1058958641.db2.gz DXJVGBMTMMASAZ-UHFFFAOYSA-N 1 2 302.397 4.156 20 0 DIADLO Cc1nc(Sc2nc3ccccc3n3c[nH+]cc23)sc1C ZINC001559119093 1059007158 /nfs/dbraw/zinc/00/71/58/1059007158.db2.gz RRAUUBDWSYORAL-UHFFFAOYSA-N 1 2 312.423 4.107 20 0 DIADLO Cc1nc(N2CCC[C@@H](Cc3csc4ccccc34)C2)cc[nH+]1 ZINC001559159821 1059043287 /nfs/dbraw/zinc/04/32/87/1059043287.db2.gz SPRNXTSZRMCIEZ-HNNXBMFYSA-N 1 2 323.465 4.459 20 0 DIADLO CCc1cc(N[C@@H]2C[C@H]2c2ccc(Cl)cc2)nc(CC)[nH+]1 ZINC001559178350 1059061021 /nfs/dbraw/zinc/06/10/21/1059061021.db2.gz IYVGQBWUTYEAGM-LSDHHAIUSA-N 1 2 301.821 4.223 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)N(c3nc(C)[nH+]c4c3CCCC4)C2)cc1 ZINC001559179058 1059061180 /nfs/dbraw/zinc/06/11/80/1059061180.db2.gz KSUUBCBHIMDSCK-QAPCUYQASA-N 1 2 321.468 4.355 20 0 DIADLO CSc1ccc(CCNc2nc(C)[nH+]c3c2CCCC3)cc1 ZINC001559178982 1059062031 /nfs/dbraw/zinc/06/20/31/1059062031.db2.gz IBPACZFPITTWGG-UHFFFAOYSA-N 1 2 313.470 4.040 20 0 DIADLO Cc1ccc([C@H]2CCN(c3nc(C)[nH+]c4c3CCCC4)C2)c(C)c1 ZINC001559184035 1059069786 /nfs/dbraw/zinc/06/97/86/1059069786.db2.gz RUAJDYFRDUNJNL-KRWDZBQOSA-N 1 2 321.468 4.275 20 0 DIADLO Cc1cc(NC2(Cc3ccc(F)cc3)CC2)nc(C2CCC2)[nH+]1 ZINC001559189880 1059074775 /nfs/dbraw/zinc/07/47/75/1059074775.db2.gz DWPDDMMDNSXFOR-UHFFFAOYSA-N 1 2 311.404 4.379 20 0 DIADLO CC(C)c1cc(NCCCC2CCOCC2)nc(C(C)C)[nH+]1 ZINC001559199487 1059080510 /nfs/dbraw/zinc/08/05/10/1059080510.db2.gz ALKYFESGJJXRNY-UHFFFAOYSA-N 1 2 305.466 4.342 20 0 DIADLO CCc1csc([C@@H](C)Nc2cc(C)[nH+]c(C3CCC3)n2)n1 ZINC001559221039 1059099284 /nfs/dbraw/zinc/09/92/84/1059099284.db2.gz ZBCDPHLHCQEOJX-LLVKDONJSA-N 1 2 302.447 4.245 20 0 DIADLO Cc1ccc2oc(NCCn3c[nH+]cc3-c3ccccc3)nc2c1 ZINC001559248376 1059120793 /nfs/dbraw/zinc/12/07/93/1059120793.db2.gz RDDGQDSMLYTGNE-UHFFFAOYSA-N 1 2 318.380 4.112 20 0 DIADLO Cc1cc(NCc2ccccc2CC(F)(F)F)nc(C2CC2)[nH+]1 ZINC001559251378 1059123118 /nfs/dbraw/zinc/12/31/18/1059123118.db2.gz PGBOUPLGNPVKRJ-UHFFFAOYSA-N 1 2 321.346 4.379 20 0 DIADLO CC(C)(C)c1c[nH]c(Sc2nc3ccccc3n3c[nH+]cc23)n1 ZINC001559252899 1059123166 /nfs/dbraw/zinc/12/31/66/1059123166.db2.gz ZJCQQEZWXQTZSH-UHFFFAOYSA-N 1 2 323.425 4.054 20 0 DIADLO CCC1CCC([N@H+](Cc2noc(C3CCC3)n2)C2CC2)CC1 ZINC001559488416 1059261987 /nfs/dbraw/zinc/26/19/87/1059261987.db2.gz HLJUWXKYUOLJIB-UHFFFAOYSA-N 1 2 303.450 4.270 20 0 DIADLO CCC1CCC([N@@H+](Cc2noc(C3CCC3)n2)C2CC2)CC1 ZINC001559488416 1059262005 /nfs/dbraw/zinc/26/20/05/1059262005.db2.gz HLJUWXKYUOLJIB-UHFFFAOYSA-N 1 2 303.450 4.270 20 0 DIADLO COC(=O)c1csc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)c1 ZINC001559490406 1059265857 /nfs/dbraw/zinc/26/58/57/1059265857.db2.gz ZXCQFYZNFOKZQR-NSHDSACASA-N 1 2 323.845 4.381 20 0 DIADLO COC(=O)c1csc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)c1 ZINC001559490406 1059265885 /nfs/dbraw/zinc/26/58/85/1059265885.db2.gz ZXCQFYZNFOKZQR-NSHDSACASA-N 1 2 323.845 4.381 20 0 DIADLO CC(C)(C)C[N@H+](Cc1nnc(C(C)(C)C)[nH]1)Cc1ccccc1 ZINC001559531449 1059329723 /nfs/dbraw/zinc/32/97/23/1059329723.db2.gz RSKRWIQSHZPMSA-UHFFFAOYSA-N 1 2 314.477 4.151 20 0 DIADLO CC(C)(C)C[N@@H+](Cc1nnc(C(C)(C)C)[nH]1)Cc1ccccc1 ZINC001559531449 1059329747 /nfs/dbraw/zinc/32/97/47/1059329747.db2.gz RSKRWIQSHZPMSA-UHFFFAOYSA-N 1 2 314.477 4.151 20 0 DIADLO CC(C)c1nsc(C[N@@H+](C)[C@H](c2ccccc2)C(C)C)n1 ZINC001559535390 1059336914 /nfs/dbraw/zinc/33/69/14/1059336914.db2.gz OMSDUEQBDXQQTR-INIZCTEOSA-N 1 2 303.475 4.491 20 0 DIADLO CC(C)c1nsc(C[N@H+](C)[C@H](c2ccccc2)C(C)C)n1 ZINC001559535390 1059336933 /nfs/dbraw/zinc/33/69/33/1059336933.db2.gz OMSDUEQBDXQQTR-INIZCTEOSA-N 1 2 303.475 4.491 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Oc3cc(Cl)ccc3Cl)ccn12 ZINC001523704679 1059341256 /nfs/dbraw/zinc/34/12/56/1059341256.db2.gz WRFHHTGWZXYTSM-UHFFFAOYSA-N 1 2 321.163 4.169 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2ncccc2Cl)[C@H]1c1ccccc1 ZINC001559543528 1059342373 /nfs/dbraw/zinc/34/23/73/1059342373.db2.gz XJVAMUROZJEPIC-CXAGYDPISA-N 1 2 318.873 4.414 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2ncccc2Cl)[C@H]1c1ccccc1 ZINC001559543528 1059342392 /nfs/dbraw/zinc/34/23/92/1059342392.db2.gz XJVAMUROZJEPIC-CXAGYDPISA-N 1 2 318.873 4.414 20 0 DIADLO CCc1cccc(-c2noc([C@H]3CCC[N@@H+]3Cc3ccco3)n2)c1 ZINC001247224110 1059350692 /nfs/dbraw/zinc/35/06/92/1059350692.db2.gz FHOWZCCQGAPRSH-QGZVFWFLSA-N 1 2 323.396 4.229 20 0 DIADLO CCc1cccc(-c2noc([C@H]3CCC[N@H+]3Cc3ccco3)n2)c1 ZINC001247224110 1059350710 /nfs/dbraw/zinc/35/07/10/1059350710.db2.gz FHOWZCCQGAPRSH-QGZVFWFLSA-N 1 2 323.396 4.229 20 0 DIADLO O=C(C[N@@H+]1CCCCC[C@H]1c1ccco1)c1ccccc1F ZINC001559549526 1059357838 /nfs/dbraw/zinc/35/78/38/1059357838.db2.gz PLADRRXNAAGNSL-INIZCTEOSA-N 1 2 301.361 4.219 20 0 DIADLO O=C(C[N@H+]1CCCCC[C@H]1c1ccco1)c1ccccc1F ZINC001559549526 1059357848 /nfs/dbraw/zinc/35/78/48/1059357848.db2.gz PLADRRXNAAGNSL-INIZCTEOSA-N 1 2 301.361 4.219 20 0 DIADLO CCc1ccc(NC(=S)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC001247281688 1059366466 /nfs/dbraw/zinc/36/64/66/1059366466.db2.gz KKKMLCXDSPUULE-UHFFFAOYSA-N 1 2 322.437 4.244 20 0 DIADLO COc1cc(C)[nH+]c(CN2CC[C@H](C)C[C@@H]2c2ccc(C)o2)c1 ZINC001559569551 1059402272 /nfs/dbraw/zinc/40/22/72/1059402272.db2.gz BFIPYMHWNJVSAV-SCLBCKFNSA-N 1 2 314.429 4.273 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@@H]3CC[C@H]4CCCC[C@@H]4C3)ccn12 ZINC001523968606 1059405011 /nfs/dbraw/zinc/40/50/11/1059405011.db2.gz XNNQSTSIXKVGCK-BFYDXBDKSA-N 1 2 312.413 4.158 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@@H]3CC[C@H]4CCCC[C@H]4C3)ccn12 ZINC001523968608 1059405753 /nfs/dbraw/zinc/40/57/53/1059405753.db2.gz XNNQSTSIXKVGCK-HLLBOEOZSA-N 1 2 312.413 4.158 20 0 DIADLO c1cn(-c2ccccc2-c2noc(CCC3CCCC3)n2)c[nH+]1 ZINC001247380547 1059427192 /nfs/dbraw/zinc/42/71/92/1059427192.db2.gz XBKVPUIMUOVROZ-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+]1CCOC2(C1)CCCCCC2 ZINC001559595428 1059427364 /nfs/dbraw/zinc/42/73/64/1059427364.db2.gz DRCAWRPJLYAQOF-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+]1CCOC2(C1)CCCCCC2 ZINC001559595428 1059427372 /nfs/dbraw/zinc/42/73/72/1059427372.db2.gz DRCAWRPJLYAQOF-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO c1cn(-c2ccccc2-c2noc(CCC3CCCCC3)n2)c[nH+]1 ZINC001247383307 1059429381 /nfs/dbraw/zinc/42/93/81/1059429381.db2.gz WYJKBTKIUSCEMP-UHFFFAOYSA-N 1 2 322.412 4.435 20 0 DIADLO CC1(C)CCC(=CC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001524208877 1059469849 /nfs/dbraw/zinc/46/98/49/1059469849.db2.gz WAUMAIDNCCJURH-UHFFFAOYSA-N 1 2 309.413 4.337 20 0 DIADLO CC(C)[N@H+](CCn1ccc2cc(Cl)ccc21)CC(F)F ZINC001559648726 1059474541 /nfs/dbraw/zinc/47/45/41/1059474541.db2.gz OIXPOQLTBVVCPD-UHFFFAOYSA-N 1 2 300.780 4.270 20 0 DIADLO CC(C)[N@@H+](CCn1ccc2cc(Cl)ccc21)CC(F)F ZINC001559648726 1059474550 /nfs/dbraw/zinc/47/45/50/1059474550.db2.gz OIXPOQLTBVVCPD-UHFFFAOYSA-N 1 2 300.780 4.270 20 0 DIADLO Fc1ccc(OCC[N@@H+]2CCc3cc(F)ccc3C2)c(Cl)c1 ZINC001559659815 1059488875 /nfs/dbraw/zinc/48/88/75/1059488875.db2.gz AVKFSKUSLXVFOT-UHFFFAOYSA-N 1 2 323.770 4.055 20 0 DIADLO Fc1ccc(OCC[N@H+]2CCc3cc(F)ccc3C2)c(Cl)c1 ZINC001559659815 1059488883 /nfs/dbraw/zinc/48/88/83/1059488883.db2.gz AVKFSKUSLXVFOT-UHFFFAOYSA-N 1 2 323.770 4.055 20 0 DIADLO Cc1conc1C[N@@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC001559662290 1059494059 /nfs/dbraw/zinc/49/40/59/1059494059.db2.gz VWPODJORYVXYPU-HXUWFJFHSA-N 1 2 304.393 4.283 20 0 DIADLO Cc1conc1C[N@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC001559662290 1059494065 /nfs/dbraw/zinc/49/40/65/1059494065.db2.gz VWPODJORYVXYPU-HXUWFJFHSA-N 1 2 304.393 4.283 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@@H+](Cc1cc(F)cc(F)c1)C2 ZINC001559664756 1059494128 /nfs/dbraw/zinc/49/41/28/1059494128.db2.gz RVMXGVYABHPYPE-UHFFFAOYSA-N 1 2 317.379 4.312 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@H+](Cc1cc(F)cc(F)c1)C2 ZINC001559664756 1059494138 /nfs/dbraw/zinc/49/41/38/1059494138.db2.gz RVMXGVYABHPYPE-UHFFFAOYSA-N 1 2 317.379 4.312 20 0 DIADLO Fc1cccc(F)c1C[N@@H+]1CC[C@H](Oc2ccccc2Cl)C1 ZINC001559670805 1059496014 /nfs/dbraw/zinc/49/60/14/1059496014.db2.gz UMHHYMFFFLJHIW-LBPRGKRZSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1cccc(F)c1C[N@H+]1CC[C@H](Oc2ccccc2Cl)C1 ZINC001559670805 1059496023 /nfs/dbraw/zinc/49/60/23/1059496023.db2.gz UMHHYMFFFLJHIW-LBPRGKRZSA-N 1 2 323.770 4.272 20 0 DIADLO C[N@H+](Cc1cc(C(F)(F)F)co1)Cc1cc(F)c(F)c(F)c1 ZINC001559677844 1059500982 /nfs/dbraw/zinc/50/09/82/1059500982.db2.gz LFHWXARGZARLJX-UHFFFAOYSA-N 1 2 323.236 4.348 20 0 DIADLO C[N@@H+](Cc1cc(C(F)(F)F)co1)Cc1cc(F)c(F)c(F)c1 ZINC001559677844 1059501011 /nfs/dbraw/zinc/50/10/11/1059501011.db2.gz LFHWXARGZARLJX-UHFFFAOYSA-N 1 2 323.236 4.348 20 0 DIADLO c1ccc(SCC[N@@H+]2CCc3c4ccccc4[nH]c3C2)cc1 ZINC001559718152 1059547511 /nfs/dbraw/zinc/54/75/11/1059547511.db2.gz BHULXVBXBVXBIJ-UHFFFAOYSA-N 1 2 308.450 4.318 20 0 DIADLO c1ccc(SCC[N@H+]2CCc3c4ccccc4[nH]c3C2)cc1 ZINC001559718152 1059547526 /nfs/dbraw/zinc/54/75/26/1059547526.db2.gz BHULXVBXBVXBIJ-UHFFFAOYSA-N 1 2 308.450 4.318 20 0 DIADLO CCN(Cc1cc(OC)cc(C)[nH+]1)c1ccc(Cl)cc1F ZINC001559789034 1059626065 /nfs/dbraw/zinc/62/60/65/1059626065.db2.gz AFAZDYSJHNAHOX-UHFFFAOYSA-N 1 2 308.784 4.218 20 0 DIADLO CC(C)CCC(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001532430346 1059628299 /nfs/dbraw/zinc/62/82/99/1059628299.db2.gz JKSPFKUOJRSFKY-UHFFFAOYSA-N 1 2 312.413 4.228 20 0 DIADLO CC1=C(Br)C[N@H+](Cc2ccccc2OC(C)C)CC1 ZINC001559793467 1059629235 /nfs/dbraw/zinc/62/92/35/1059629235.db2.gz PXQHLYWTTUFJIU-UHFFFAOYSA-N 1 2 324.262 4.348 20 0 DIADLO CC1=C(Br)C[N@@H+](Cc2ccccc2OC(C)C)CC1 ZINC001559793467 1059629241 /nfs/dbraw/zinc/62/92/41/1059629241.db2.gz PXQHLYWTTUFJIU-UHFFFAOYSA-N 1 2 324.262 4.348 20 0 DIADLO Clc1cccc(Cl)c1C[N@H+](CCOC1CC1)C1CC1 ZINC001559815318 1059652713 /nfs/dbraw/zinc/65/27/13/1059652713.db2.gz CBBFMAAYUANENK-UHFFFAOYSA-N 1 2 300.229 4.137 20 0 DIADLO Clc1cccc(Cl)c1C[N@@H+](CCOC1CC1)C1CC1 ZINC001559815318 1059652719 /nfs/dbraw/zinc/65/27/19/1059652719.db2.gz CBBFMAAYUANENK-UHFFFAOYSA-N 1 2 300.229 4.137 20 0 DIADLO Cc1cc(C[N@@H+]([C@H](C)C(=O)OC(C)(C)C)C2CC2)c(C)s1 ZINC001559900871 1059716051 /nfs/dbraw/zinc/71/60/51/1059716051.db2.gz AWIANNNJCVDFEG-GFCCVEGCSA-N 1 2 309.475 4.060 20 0 DIADLO Cc1cc(C[N@H+]([C@H](C)C(=O)OC(C)(C)C)C2CC2)c(C)s1 ZINC001559900871 1059716066 /nfs/dbraw/zinc/71/60/66/1059716066.db2.gz AWIANNNJCVDFEG-GFCCVEGCSA-N 1 2 309.475 4.060 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC=C(c3ccc(F)cc3)CC2)c(C)[nH+]1 ZINC001525035333 1059727756 /nfs/dbraw/zinc/72/77/56/1059727756.db2.gz REJMTWNNOPMACN-UHFFFAOYSA-N 1 2 324.399 4.075 20 0 DIADLO CCc1ccc(-c2noc([C@@H]3Cc4ccccc4C[N@@H+]3C)n2)cc1 ZINC001248119644 1059731174 /nfs/dbraw/zinc/73/11/74/1059731174.db2.gz LLSVIAJHFBVONT-SFHVURJKSA-N 1 2 319.408 4.028 20 0 DIADLO CCc1ccc(-c2noc([C@@H]3Cc4ccccc4C[N@H+]3C)n2)cc1 ZINC001248119644 1059731191 /nfs/dbraw/zinc/73/11/91/1059731191.db2.gz LLSVIAJHFBVONT-SFHVURJKSA-N 1 2 319.408 4.028 20 0 DIADLO Cc1ccc(-c2noc([C@H]3Cc4ccccc4C[N@H+]3C)n2)c(C)c1 ZINC001248119651 1059732598 /nfs/dbraw/zinc/73/25/98/1059732598.db2.gz LPEUXAYYYDJEKV-GOSISDBHSA-N 1 2 319.408 4.083 20 0 DIADLO Cc1ccc(-c2noc([C@H]3Cc4ccccc4C[N@@H+]3C)n2)c(C)c1 ZINC001248119651 1059732616 /nfs/dbraw/zinc/73/26/16/1059732616.db2.gz LPEUXAYYYDJEKV-GOSISDBHSA-N 1 2 319.408 4.083 20 0 DIADLO Cc1ccc([N@@H+](CCCNC(=O)OC(C)(C)C)CC(C)C)cc1 ZINC001559921413 1059734939 /nfs/dbraw/zinc/73/49/39/1059734939.db2.gz KRPKMKWTSNZGQU-UHFFFAOYSA-N 1 2 320.477 4.372 20 0 DIADLO Cc1ccc([N@H+](CCCNC(=O)OC(C)(C)C)CC(C)C)cc1 ZINC001559921413 1059734960 /nfs/dbraw/zinc/73/49/60/1059734960.db2.gz KRPKMKWTSNZGQU-UHFFFAOYSA-N 1 2 320.477 4.372 20 0 DIADLO Cl/C=C(/Cl)C[NH+]1CCC(Cc2nc3ccccc3[nH]2)CC1 ZINC001559932234 1059743007 /nfs/dbraw/zinc/74/30/07/1059743007.db2.gz CKETXZMTCXSDNQ-JLHYYAGUSA-N 1 2 324.255 4.136 20 0 DIADLO C[C@H](c1ccc2ccccc2c1)[N@@H+]1Cc2ccccc2NC(=O)C1 ZINC001559945102 1059755712 /nfs/dbraw/zinc/75/57/12/1059755712.db2.gz HDINIAIHSNVMOC-OAHLLOKOSA-N 1 2 316.404 4.355 20 0 DIADLO C[C@H](c1ccc2ccccc2c1)[N@H+]1Cc2ccccc2NC(=O)C1 ZINC001559945102 1059755725 /nfs/dbraw/zinc/75/57/25/1059755725.db2.gz HDINIAIHSNVMOC-OAHLLOKOSA-N 1 2 316.404 4.355 20 0 DIADLO Clc1ccc(-c2cc(C[N@H+]3CCC=C(Cl)C3)on2)cc1 ZINC001559957818 1059763532 /nfs/dbraw/zinc/76/35/32/1059763532.db2.gz HSLAIIIKTJMZGJ-UHFFFAOYSA-N 1 2 309.196 4.323 20 0 DIADLO Clc1ccc(-c2cc(C[N@@H+]3CCC=C(Cl)C3)on2)cc1 ZINC001559957818 1059763546 /nfs/dbraw/zinc/76/35/46/1059763546.db2.gz HSLAIIIKTJMZGJ-UHFFFAOYSA-N 1 2 309.196 4.323 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(F)cccc2Cl)CC2(CCCCC2)O1 ZINC001559954263 1059764772 /nfs/dbraw/zinc/76/47/72/1059764772.db2.gz PRPSLLSCJMDHSS-ZDUSSCGKSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c(F)cccc2Cl)CC2(CCCCC2)O1 ZINC001559954263 1059764784 /nfs/dbraw/zinc/76/47/84/1059764784.db2.gz PRPSLLSCJMDHSS-ZDUSSCGKSA-N 1 2 311.828 4.403 20 0 DIADLO CC[C@H]1C[N@H+](CCc2cc(Cl)cc(Cl)c2)[C@@H](C)CO1 ZINC001559963457 1059770087 /nfs/dbraw/zinc/77/00/87/1059770087.db2.gz STPQKYZWWTUPEE-NHYWBVRUSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@H]1C[N@@H+](CCc2cc(Cl)cc(Cl)c2)[C@@H](C)CO1 ZINC001559963457 1059770107 /nfs/dbraw/zinc/77/01/07/1059770107.db2.gz STPQKYZWWTUPEE-NHYWBVRUSA-N 1 2 302.245 4.035 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC001560012571 1059818142 /nfs/dbraw/zinc/81/81/42/1059818142.db2.gz YQKRJXQLSNJSQT-WMLDXEAASA-N 1 2 321.848 4.066 20 0 DIADLO COC(=O)[C@@H](c1ccccc1Cl)[N@H+]1CCC[C@H](C2CCC2)C1 ZINC001560012571 1059818171 /nfs/dbraw/zinc/81/81/71/1059818171.db2.gz YQKRJXQLSNJSQT-WMLDXEAASA-N 1 2 321.848 4.066 20 0 DIADLO CC(C)(C)CCC[NH2+][C@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001560052026 1059869071 /nfs/dbraw/zinc/86/90/71/1059869071.db2.gz UMAGYSAAOHQFAZ-QGZVFWFLSA-N 1 2 319.489 4.355 20 0 DIADLO Fc1ccc2occc2c1C[N@@H+]1CCC[C@H]1c1nccs1 ZINC001248542121 1059874308 /nfs/dbraw/zinc/87/43/08/1059874308.db2.gz YLQXMTLCFLOVGL-AWEZNQCLSA-N 1 2 302.374 4.366 20 0 DIADLO Fc1ccc2occc2c1C[N@H+]1CCC[C@H]1c1nccs1 ZINC001248542121 1059874334 /nfs/dbraw/zinc/87/43/34/1059874334.db2.gz YLQXMTLCFLOVGL-AWEZNQCLSA-N 1 2 302.374 4.366 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@H+](Cc2noc3c2CCCC3)C1 ZINC001560081765 1059893594 /nfs/dbraw/zinc/89/35/94/1059893594.db2.gz MMNKWHVTEIUWTE-LJQANCHMSA-N 1 2 314.404 4.014 20 0 DIADLO F[C@]1(c2ccccc2)CCC[N@@H+](Cc2noc3c2CCCC3)C1 ZINC001560081765 1059893618 /nfs/dbraw/zinc/89/36/18/1059893618.db2.gz MMNKWHVTEIUWTE-LJQANCHMSA-N 1 2 314.404 4.014 20 0 DIADLO Cc1cccc(Br)c1C[NH+]1Cc2ccccc2C1 ZINC001248599003 1059910217 /nfs/dbraw/zinc/91/02/17/1059910217.db2.gz JEGTWXMSJSOLEH-UHFFFAOYSA-N 1 2 302.215 4.273 20 0 DIADLO COc1c(C[N@H+](C)Cc2cccnc2)ccc(Cl)c1Cl ZINC001248624109 1059917056 /nfs/dbraw/zinc/91/70/56/1059917056.db2.gz JBSKCWNGGYDPBU-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1c(C[N@@H+](C)Cc2cccnc2)ccc(Cl)c1Cl ZINC001248624109 1059917075 /nfs/dbraw/zinc/91/70/75/1059917075.db2.gz JBSKCWNGGYDPBU-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+]1CCCC[C@H]1c1ncccn1 ZINC001560115290 1059918963 /nfs/dbraw/zinc/91/89/63/1059918963.db2.gz UEGXUDFREISRFV-INIZCTEOSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+]1CCCC[C@H]1c1ncccn1 ZINC001560115290 1059918982 /nfs/dbraw/zinc/91/89/82/1059918982.db2.gz UEGXUDFREISRFV-INIZCTEOSA-N 1 2 301.821 4.166 20 0 DIADLO C[C@H]1c2sccc2CC[N@H+]1Cc1ccnc(Br)c1 ZINC001560112946 1059921014 /nfs/dbraw/zinc/92/10/14/1059921014.db2.gz SVUVPVIKKLSOLG-JTQLQIEISA-N 1 2 323.259 4.025 20 0 DIADLO C[C@H]1c2sccc2CC[N@@H+]1Cc1ccnc(Br)c1 ZINC001560112946 1059921025 /nfs/dbraw/zinc/92/10/25/1059921025.db2.gz SVUVPVIKKLSOLG-JTQLQIEISA-N 1 2 323.259 4.025 20 0 DIADLO COc1c(C[N@@H+]2CCC[C@H](C(F)F)C2)ccc(Cl)c1Cl ZINC001248642165 1059921071 /nfs/dbraw/zinc/92/10/71/1059921071.db2.gz ZBODEQHNQNJHNX-JTQLQIEISA-N 1 2 324.198 4.479 20 0 DIADLO COc1c(C[N@H+]2CCC[C@H](C(F)F)C2)ccc(Cl)c1Cl ZINC001248642165 1059921086 /nfs/dbraw/zinc/92/10/86/1059921086.db2.gz ZBODEQHNQNJHNX-JTQLQIEISA-N 1 2 324.198 4.479 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+]1CCCC[C@@H]1c1ncccn1 ZINC001560115291 1059921265 /nfs/dbraw/zinc/92/12/65/1059921265.db2.gz UEGXUDFREISRFV-MRXNPFEDSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+]1CCCC[C@@H]1c1ncccn1 ZINC001560115291 1059921279 /nfs/dbraw/zinc/92/12/79/1059921279.db2.gz UEGXUDFREISRFV-MRXNPFEDSA-N 1 2 301.821 4.166 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2Cc2ccc(C)cc2Cl)[nH+]c1C ZINC001560138198 1059940045 /nfs/dbraw/zinc/94/00/45/1059940045.db2.gz OVWZJQNEHDTYJI-MRXNPFEDSA-N 1 2 303.837 4.325 20 0 DIADLO Cc1ccc(C[N@@H+](CCCC(C)C)Cc2cc(Cl)n(C)n2)o1 ZINC001560143242 1059942562 /nfs/dbraw/zinc/94/25/62/1059942562.db2.gz VBMZPYQSAKTPGR-UHFFFAOYSA-N 1 2 323.868 4.413 20 0 DIADLO Cc1ccc(C[N@H+](CCCC(C)C)Cc2cc(Cl)n(C)n2)o1 ZINC001560143242 1059942585 /nfs/dbraw/zinc/94/25/85/1059942585.db2.gz VBMZPYQSAKTPGR-UHFFFAOYSA-N 1 2 323.868 4.413 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)c1sccc1C(F)F ZINC001525579522 1059943297 /nfs/dbraw/zinc/94/32/97/1059943297.db2.gz BFAZPAAWFOJZIF-UHFFFAOYSA-N 1 2 319.336 4.124 20 0 DIADLO Cc1noc2ccc(C[N@H+]3C[C@H](C)OC[C@@H]3c3ccccc3)cc12 ZINC001248713088 1059949843 /nfs/dbraw/zinc/94/98/43/1059949843.db2.gz YKPSKPHBPKGIQU-IFXJQAMLSA-N 1 2 322.408 4.098 20 0 DIADLO Cc1noc2ccc(C[N@@H+]3C[C@H](C)OC[C@@H]3c3ccccc3)cc12 ZINC001248713088 1059949859 /nfs/dbraw/zinc/94/98/59/1059949859.db2.gz YKPSKPHBPKGIQU-IFXJQAMLSA-N 1 2 322.408 4.098 20 0 DIADLO Cn1nc(C[NH+]2CCC(CC3CCCCC3)CC2)cc1Cl ZINC001560180827 1059973300 /nfs/dbraw/zinc/97/33/00/1059973300.db2.gz LHFDJDRXPPHBCS-UHFFFAOYSA-N 1 2 309.885 4.256 20 0 DIADLO CCC[N@H+](Cc1ccccc1)Cc1c(Cl)ccnc1OC ZINC001248794722 1059979736 /nfs/dbraw/zinc/97/97/36/1059979736.db2.gz ZVKOSCKVVCSNTA-UHFFFAOYSA-N 1 2 304.821 4.156 20 0 DIADLO CCC[N@@H+](Cc1ccccc1)Cc1c(Cl)ccnc1OC ZINC001248794722 1059979757 /nfs/dbraw/zinc/97/97/57/1059979757.db2.gz ZVKOSCKVVCSNTA-UHFFFAOYSA-N 1 2 304.821 4.156 20 0 DIADLO CC[C@H](c1ccccc1)[N@H+](C)Cc1c(Cl)ccnc1OC ZINC001248795256 1059983064 /nfs/dbraw/zinc/98/30/64/1059983064.db2.gz WULWBNVDGAOWEH-MRXNPFEDSA-N 1 2 304.821 4.327 20 0 DIADLO CC[C@H](c1ccccc1)[N@@H+](C)Cc1c(Cl)ccnc1OC ZINC001248795256 1059983089 /nfs/dbraw/zinc/98/30/89/1059983089.db2.gz WULWBNVDGAOWEH-MRXNPFEDSA-N 1 2 304.821 4.327 20 0 DIADLO O=C(Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1)[C@@H]1CC=CCC1 ZINC001525682736 1059989267 /nfs/dbraw/zinc/98/92/67/1059989267.db2.gz XHHPCGIGHJMIGC-MRXNPFEDSA-N 1 2 322.408 4.148 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@@H+](Cc1ccc3ccccc3n1)C2 ZINC001560240595 1060005656 /nfs/dbraw/zinc/00/56/56/1060005656.db2.gz WSKINVJFKNTFEE-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@H+](Cc1ccc3ccccc3n1)C2 ZINC001560240595 1060005677 /nfs/dbraw/zinc/00/56/77/1060005677.db2.gz WSKINVJFKNTFEE-UHFFFAOYSA-N 1 2 310.347 4.071 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2nc3ccc(C)cc3[nH]2)cc1 ZINC001248842023 1060013010 /nfs/dbraw/zinc/01/30/10/1060013010.db2.gz COLGVWQOIJNIOK-IBGZPJMESA-N 1 2 321.424 4.217 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2nc3ccc(C)cc3[nH]2)cc1 ZINC001248842023 1060013036 /nfs/dbraw/zinc/01/30/36/1060013036.db2.gz COLGVWQOIJNIOK-IBGZPJMESA-N 1 2 321.424 4.217 20 0 DIADLO Brc1cccc2nc(C[N@@H+]3CCC34CCCC4)oc21 ZINC001248849486 1060020817 /nfs/dbraw/zinc/02/08/17/1060020817.db2.gz OQFXWFHFBOBEGI-UHFFFAOYSA-N 1 2 321.218 4.109 20 0 DIADLO Brc1cccc2nc(C[N@H+]3CCC34CCCC4)oc21 ZINC001248849486 1060020835 /nfs/dbraw/zinc/02/08/35/1060020835.db2.gz OQFXWFHFBOBEGI-UHFFFAOYSA-N 1 2 321.218 4.109 20 0 DIADLO Cc1cc(C)c(CNc2ccc([NH+]3CCC(O)CC3)cc2)c(C)c1 ZINC001560276624 1060053667 /nfs/dbraw/zinc/05/36/67/1060053667.db2.gz JOBXBPVFKXZFFY-UHFFFAOYSA-N 1 2 324.468 4.185 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1cccc(OC2CC2)c1F ZINC001560278049 1060053952 /nfs/dbraw/zinc/05/39/52/1060053952.db2.gz UIDVJYXMSUVXLP-UHFFFAOYSA-N 1 2 314.404 4.353 20 0 DIADLO Cc1cc(C)nc(C[NH+]2CCC(c3ccccc3Cl)CC2)n1 ZINC001248977499 1060097345 /nfs/dbraw/zinc/09/73/45/1060097345.db2.gz LPLYWTYOKILSLM-UHFFFAOYSA-N 1 2 315.848 4.126 20 0 DIADLO CC1(C)CCCC[C@H]1CC(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001533989005 1060099107 /nfs/dbraw/zinc/09/91/07/1060099107.db2.gz XTAFSLQXEPOAAA-HNNXBMFYSA-N 1 2 311.429 4.417 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c(Cl)nc1C ZINC001248988435 1060099208 /nfs/dbraw/zinc/09/92/08/1060099208.db2.gz KWCKPEBBNFKDKG-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2cccnc2)c(Cl)nc1C ZINC001248988435 1060099229 /nfs/dbraw/zinc/09/92/29/1060099229.db2.gz KWCKPEBBNFKDKG-MRXNPFEDSA-N 1 2 301.821 4.084 20 0 DIADLO CCc1ccc(-c2noc([C@@H]([NH3+])c3ccc(Cl)cc3)n2)cc1 ZINC001248998628 1060105805 /nfs/dbraw/zinc/10/58/05/1060105805.db2.gz NXOLYOPSVHISLL-HNNXBMFYSA-N 1 2 313.788 4.001 20 0 DIADLO CC[C@H]([NH2+]Cc1cnc(-c2ccccc2)[nH]1)c1nc(C)cs1 ZINC001560323186 1060110766 /nfs/dbraw/zinc/11/07/66/1060110766.db2.gz JUTSLYHZCVVXFS-HNNXBMFYSA-N 1 2 312.442 4.083 20 0 DIADLO c1cn(-c2ccc(CNc3ccc(OCC4CC4)cc3)cc2)c[nH+]1 ZINC001560331542 1060118204 /nfs/dbraw/zinc/11/82/04/1060118204.db2.gz AZKVFWJTRMIFBF-UHFFFAOYSA-N 1 2 319.408 4.273 20 0 DIADLO CC(C)c1ncc(C[NH2+]Cc2coc(-c3ccccc3)n2)s1 ZINC001560341528 1060128473 /nfs/dbraw/zinc/12/84/73/1060128473.db2.gz KKJMQGWSOPQKQR-UHFFFAOYSA-N 1 2 313.426 4.211 20 0 DIADLO Cc1cc(CNc2ccc(F)cc2OCC2CC2)cc(C)[nH+]1 ZINC001560345763 1060133084 /nfs/dbraw/zinc/13/30/84/1060133084.db2.gz WKUIALYXEHMRDP-UHFFFAOYSA-N 1 2 300.377 4.238 20 0 DIADLO CCc1cccc(-c2noc([C@@H]([NH3+])c3cccc(Cl)c3)n2)c1 ZINC001249067284 1060141806 /nfs/dbraw/zinc/14/18/06/1060141806.db2.gz LHUMKIGLCJWITB-HNNXBMFYSA-N 1 2 313.788 4.001 20 0 DIADLO C[C@@H]1Cc2cc(CNc3ccc4c(c3)CCC[N@H+]4C)ccc2O1 ZINC001560389733 1060175893 /nfs/dbraw/zinc/17/58/93/1060175893.db2.gz LFPLKRBUGYGPFQ-CQSZACIVSA-N 1 2 308.425 4.005 20 0 DIADLO C[C@@H]1Cc2cc(CNc3ccc4c(c3)CCC[N@@H+]4C)ccc2O1 ZINC001560389733 1060175903 /nfs/dbraw/zinc/17/59/03/1060175903.db2.gz LFPLKRBUGYGPFQ-CQSZACIVSA-N 1 2 308.425 4.005 20 0 DIADLO C/C(=C\c1ccc(Cl)cc1)CNc1ccc(N(C)C)[nH+]c1 ZINC001560392437 1060178452 /nfs/dbraw/zinc/17/84/52/1060178452.db2.gz GRPFNVNFJBPMQD-JLHYYAGUSA-N 1 2 301.821 4.316 20 0 DIADLO CCOc1cc(C)ccc1C[NH2+]Cc1c[nH]c(-c2ccccc2)n1 ZINC001560394502 1060181837 /nfs/dbraw/zinc/18/18/37/1060181837.db2.gz BGAIVHMFDGQCMO-UHFFFAOYSA-N 1 2 321.424 4.074 20 0 DIADLO CCSCc1cc[nH+]c(NCc2ccc(OC)cc2F)c1 ZINC001560398383 1060182741 /nfs/dbraw/zinc/18/27/41/1060182741.db2.gz PPOOLYAEHCFQTI-UHFFFAOYSA-N 1 2 306.406 4.095 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC[C@H](c3ccccc3)C2)c(C)[nH+]1 ZINC001526337739 1060192277 /nfs/dbraw/zinc/19/22/77/1060192277.db2.gz FGODJWPINUPWII-SFHVURJKSA-N 1 2 308.425 4.027 20 0 DIADLO CC(C)c1cnc(CNc2ccc(N3CCCCC3)[nH+]c2)s1 ZINC001560407357 1060193368 /nfs/dbraw/zinc/19/33/68/1060193368.db2.gz VPLMSAADPKYCCB-UHFFFAOYSA-N 1 2 316.474 4.264 20 0 DIADLO CCN(CC)c1ccc(NCc2csc(C(C)C)n2)c[nH+]1 ZINC001560407027 1060193579 /nfs/dbraw/zinc/19/35/79/1060193579.db2.gz BAGZPUOALNUJLG-UHFFFAOYSA-N 1 2 304.463 4.120 20 0 DIADLO Cc1ccc(F)c(-c2noc([C@@H]3CC[N@@H+]3Cc3ccccc3)n2)c1 ZINC001249253258 1060203258 /nfs/dbraw/zinc/20/32/58/1060203258.db2.gz ROMVXEXYEIFGEP-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc(F)c(-c2noc([C@@H]3CC[N@H+]3Cc3ccccc3)n2)c1 ZINC001249253258 1060203282 /nfs/dbraw/zinc/20/32/82/1060203282.db2.gz ROMVXEXYEIFGEP-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc(-c2noc([C@H]3CC[N@@H+]3Cc3ccccc3)n2)c(F)c1 ZINC001249253450 1060203963 /nfs/dbraw/zinc/20/39/63/1060203963.db2.gz ZXHYMHDCUBIIGO-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc(-c2noc([C@H]3CC[N@H+]3Cc3ccccc3)n2)c(F)c1 ZINC001249253450 1060203969 /nfs/dbraw/zinc/20/39/69/1060203969.db2.gz ZXHYMHDCUBIIGO-QGZVFWFLSA-N 1 2 323.371 4.131 20 0 DIADLO CCc1ccc(-c2noc([C@H]3CC[N@@H+]3Cc3ccccc3)n2)cc1 ZINC001249256567 1060204058 /nfs/dbraw/zinc/20/40/58/1060204058.db2.gz UAACRRLNPXGPIK-GOSISDBHSA-N 1 2 319.408 4.246 20 0 DIADLO CCc1ccc(-c2noc([C@H]3CC[N@H+]3Cc3ccccc3)n2)cc1 ZINC001249256567 1060204066 /nfs/dbraw/zinc/20/40/66/1060204066.db2.gz UAACRRLNPXGPIK-GOSISDBHSA-N 1 2 319.408 4.246 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3CC[N@@H+]3Cc3ccccc3)n2)c(F)c1 ZINC001249253449 1060204708 /nfs/dbraw/zinc/20/47/08/1060204708.db2.gz ZXHYMHDCUBIIGO-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3CC[N@H+]3Cc3ccccc3)n2)c(F)c1 ZINC001249253449 1060204730 /nfs/dbraw/zinc/20/47/30/1060204730.db2.gz ZXHYMHDCUBIIGO-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cccc(-c2noc([C@@H]3CC[N@@H+]3Cc3ccccc3)n2)c1C ZINC001249254499 1060206343 /nfs/dbraw/zinc/20/63/43/1060206343.db2.gz AKQWOESTTIKXLN-SFHVURJKSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1cccc(-c2noc([C@@H]3CC[N@H+]3Cc3ccccc3)n2)c1C ZINC001249254499 1060206362 /nfs/dbraw/zinc/20/63/62/1060206362.db2.gz AKQWOESTTIKXLN-SFHVURJKSA-N 1 2 319.408 4.300 20 0 DIADLO CCc1ncc(C[NH2+][C@@H](c2cccc(C)c2)c2ccccn2)s1 ZINC001560427848 1060216634 /nfs/dbraw/zinc/21/66/34/1060216634.db2.gz QHIGWNPTKCUXBS-IBGZPJMESA-N 1 2 323.465 4.288 20 0 DIADLO CCCC[C@](C)(F)C(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC001526422843 1060218509 /nfs/dbraw/zinc/21/85/09/1060218509.db2.gz DXYPMGKBBYREOJ-SFHVURJKSA-N 1 2 317.408 4.158 20 0 DIADLO [NH3+][C@@H](c1nc(-c2ccc(F)cc2)no1)c1ccc2ccccc2c1 ZINC001249324777 1060220983 /nfs/dbraw/zinc/22/09/83/1060220983.db2.gz GPVWKDRUNGTZSM-QGZVFWFLSA-N 1 2 319.339 4.077 20 0 DIADLO CC[C@H](C)c1nn(C)cc1C[N@@H+]1CCc2cc(Cl)ccc2C1 ZINC001249409033 1060242717 /nfs/dbraw/zinc/24/27/17/1060242717.db2.gz QWGIBHAEEPQASL-ZDUSSCGKSA-N 1 2 317.864 4.145 20 0 DIADLO CC[C@H](C)c1nn(C)cc1C[N@H+]1CCc2cc(Cl)ccc2C1 ZINC001249409033 1060242727 /nfs/dbraw/zinc/24/27/27/1060242727.db2.gz QWGIBHAEEPQASL-ZDUSSCGKSA-N 1 2 317.864 4.145 20 0 DIADLO CCSc1ccccc1C[N@@H+]1CCc2ncc(Cl)cc2C1 ZINC001249440250 1060251110 /nfs/dbraw/zinc/25/11/10/1060251110.db2.gz DQWQEZQXRSSJBB-UHFFFAOYSA-N 1 2 318.873 4.405 20 0 DIADLO CCSc1ccccc1C[N@H+]1CCc2ncc(Cl)cc2C1 ZINC001249440250 1060251134 /nfs/dbraw/zinc/25/11/34/1060251134.db2.gz DQWQEZQXRSSJBB-UHFFFAOYSA-N 1 2 318.873 4.405 20 0 DIADLO Brc1coc2ccc(C[NH+]3CC4(CCC4)C3)cc12 ZINC001249495088 1060264091 /nfs/dbraw/zinc/26/40/91/1060264091.db2.gz FMIDBGAOWZTOIL-UHFFFAOYSA-N 1 2 306.203 4.181 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+]2CC[C@@H]2c2ccccc2)cn1 ZINC001249515000 1060271828 /nfs/dbraw/zinc/27/18/28/1060271828.db2.gz IHDWOPLJELZBQX-MRXNPFEDSA-N 1 2 306.331 4.356 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+]2CC[C@@H]2c2ccccc2)cn1 ZINC001249515000 1060271846 /nfs/dbraw/zinc/27/18/46/1060271846.db2.gz IHDWOPLJELZBQX-MRXNPFEDSA-N 1 2 306.331 4.356 20 0 DIADLO Nc1cc(F)cc(Nc2cc[nH+]c3ccc(Cl)cc23)c1Cl ZINC001249646903 1060330516 /nfs/dbraw/zinc/33/05/16/1060330516.db2.gz DWAXSMFQFKEHPS-UHFFFAOYSA-N 1 2 322.170 4.428 20 0 DIADLO Fc1ccc(/C=C\CNc2c[nH+]cc3c2CCCC3)cc1F ZINC001560531784 1060333810 /nfs/dbraw/zinc/33/38/10/1060333810.db2.gz NHZUPYMBKODEQR-ARJAWSKDSA-N 1 2 300.352 4.364 20 0 DIADLO Nc1cc(F)cc(Nc2cccc(Cn3cc[nH+]c3)c2)c1Cl ZINC001249652208 1060335847 /nfs/dbraw/zinc/33/58/47/1060335847.db2.gz PTSSSOOSEOAKPT-UHFFFAOYSA-N 1 2 316.767 4.050 20 0 DIADLO CCC(F)(F)C[NH2+]Cc1ccc(-c2ccccc2OC)cc1 ZINC001560534253 1060337574 /nfs/dbraw/zinc/33/75/74/1060337574.db2.gz UYSNILNPTIRZCJ-UHFFFAOYSA-N 1 2 305.368 4.497 20 0 DIADLO CC[C@H](Oc1cccc(C)c1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001526806589 1060342979 /nfs/dbraw/zinc/34/29/79/1060342979.db2.gz ZJGMFAWIXCXZBP-KRWDZBQOSA-N 1 2 312.413 4.111 20 0 DIADLO CC[C@@H]1C[C@H](CNc2ccc(Nc3ccccc3)c[nH+]2)CCO1 ZINC001560538782 1060345061 /nfs/dbraw/zinc/34/50/61/1060345061.db2.gz DSNVVPLWIQUFQR-CRAIPNDOSA-N 1 2 311.429 4.442 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC001534712549 1060346033 /nfs/dbraw/zinc/34/60/33/1060346033.db2.gz MIBRMXXVTIVTRM-OALUTQOASA-N 1 2 316.404 4.016 20 0 DIADLO Cc1cc(CNC[C@H]2CCCC[N@@H+]2Cc2ccccc2)c(C)o1 ZINC001560561226 1060368705 /nfs/dbraw/zinc/36/87/05/1060368705.db2.gz HDVNKSBCNFQKSK-HXUWFJFHSA-N 1 2 312.457 4.041 20 0 DIADLO Cc1cc(CNC[C@H]2CCCC[N@H+]2Cc2ccccc2)c(C)o1 ZINC001560561226 1060368727 /nfs/dbraw/zinc/36/87/27/1060368727.db2.gz HDVNKSBCNFQKSK-HXUWFJFHSA-N 1 2 312.457 4.041 20 0 DIADLO Cc1cc(C)c(NC(=S)Nc2ccc3[nH+]ccn3c2)c(C)c1 ZINC001249720817 1060370205 /nfs/dbraw/zinc/37/02/05/1060370205.db2.gz OSIJGWALGBUKAB-UHFFFAOYSA-N 1 2 310.426 4.068 20 0 DIADLO CCSCc1ccc[nH+]c1NC/C=C\c1ccccc1OC ZINC001560568718 1060377789 /nfs/dbraw/zinc/37/77/89/1060377789.db2.gz XUPIDPQKPBNMCH-TWGQIWQCSA-N 1 2 314.454 4.469 20 0 DIADLO Cc1cc(C)c(C(=O)NCCC(C)(C)c2ccccc2)c(C)[nH+]1 ZINC001534837715 1060380322 /nfs/dbraw/zinc/38/03/22/1060380322.db2.gz GIWGHCJSOKXTCD-UHFFFAOYSA-N 1 2 310.441 4.105 20 0 DIADLO Cc1ccc2[nH+]c(NCc3c[nH]nc3-c3ccc(F)cc3)[nH]c2c1 ZINC001560569877 1060381018 /nfs/dbraw/zinc/38/10/18/1060381018.db2.gz MCUKCGVICUPDEM-UHFFFAOYSA-N 1 2 321.359 4.013 20 0 DIADLO Cc1cc(NCc2cnn(-c3ccc(Cl)cc3)c2)c[nH+]c1C ZINC001560571043 1060382165 /nfs/dbraw/zinc/38/21/65/1060382165.db2.gz FGMGGTHPAKHPSO-UHFFFAOYSA-N 1 2 312.804 4.150 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1ccc(OC)cc1 ZINC001560574156 1060387047 /nfs/dbraw/zinc/38/70/47/1060387047.db2.gz JGEDPTFNTJUJJZ-UHFFFAOYSA-N 1 2 315.804 4.330 20 0 DIADLO Clc1ccc2[nH]c(NCc3ccc4cnccc4c3)[nH+]c2c1 ZINC001560579068 1060393792 /nfs/dbraw/zinc/39/37/92/1060393792.db2.gz VNCZKUPZZATSCX-UHFFFAOYSA-N 1 2 308.772 4.377 20 0 DIADLO COc1cc(C[N@@H+]2C[C@H](C)CC23CC3)c(F)c(F)c1Cl ZINC001249803727 1060406413 /nfs/dbraw/zinc/40/64/13/1060406413.db2.gz HQTHBJSJZMKQQO-SECBINFHSA-N 1 2 301.764 4.001 20 0 DIADLO COc1cc(C[N@H+]2C[C@H](C)CC23CC3)c(F)c(F)c1Cl ZINC001249803727 1060406422 /nfs/dbraw/zinc/40/64/22/1060406422.db2.gz HQTHBJSJZMKQQO-SECBINFHSA-N 1 2 301.764 4.001 20 0 DIADLO CNc1ccccc1CNc1[nH+]c2ccccc2n1CC1CC1 ZINC001560595745 1060406836 /nfs/dbraw/zinc/40/68/36/1060406836.db2.gz LSTDMVJAYDCNRL-UHFFFAOYSA-N 1 2 306.413 4.100 20 0 DIADLO CCCCc1ccc(NC(=S)Nc2cc[nH+]cc2C)c(C)c1 ZINC001249806131 1060410505 /nfs/dbraw/zinc/41/05/05/1060410505.db2.gz OLOIJJWSIKCLPR-UHFFFAOYSA-N 1 2 313.470 4.272 20 0 DIADLO COC(=O)c1cc(Nc2ccccc2-n2cc[nH+]c2)c(C)cc1C ZINC001249812728 1060414012 /nfs/dbraw/zinc/41/40/12/1060414012.db2.gz GZNDIDWZWSOCMB-UHFFFAOYSA-N 1 2 321.380 4.019 20 0 DIADLO COc1c(Cl)cccc1C[NH2+]Cc1c(F)cccc1Cl ZINC001560605787 1060419289 /nfs/dbraw/zinc/41/92/89/1060419289.db2.gz YASMKQOMCIQYIK-UHFFFAOYSA-N 1 2 314.187 4.431 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cc3cc(C(=O)OC)ccc3[nH]2)cc1 ZINC001249874360 1060436933 /nfs/dbraw/zinc/43/69/33/1060436933.db2.gz LCMXYMRRCVEWQE-UHFFFAOYSA-N 1 2 323.396 4.154 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cc3cc(C(=O)OC)ccc3[nH]2)cc1 ZINC001249874360 1060436947 /nfs/dbraw/zinc/43/69/47/1060436947.db2.gz LCMXYMRRCVEWQE-UHFFFAOYSA-N 1 2 323.396 4.154 20 0 DIADLO COc1nsc(C[N@H+](Cc2ccccc2)C(C)C)c1Cl ZINC001560628394 1060439113 /nfs/dbraw/zinc/43/91/13/1060439113.db2.gz INWXNIZPCUBHIM-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO COc1nsc(C[N@@H+](Cc2ccccc2)C(C)C)c1Cl ZINC001560628394 1060439122 /nfs/dbraw/zinc/43/91/22/1060439122.db2.gz INWXNIZPCUBHIM-UHFFFAOYSA-N 1 2 310.850 4.216 20 0 DIADLO COc1ccc2[nH]c(Nc3cc(Cl)c4[nH+]ccn4c3)cc2c1 ZINC001249883533 1060445260 /nfs/dbraw/zinc/44/52/60/1060445260.db2.gz MCHBEJMHFLMYBN-UHFFFAOYSA-N 1 2 312.760 4.221 20 0 DIADLO Cc1cn2c(cccc2Nc2ccc3c(c2)C(=O)CCCC3)[nH+]1 ZINC001249889370 1060451207 /nfs/dbraw/zinc/45/12/07/1060451207.db2.gz MZMZHXZUNNOFNI-UHFFFAOYSA-N 1 2 305.381 4.295 20 0 DIADLO O=C1CCCCc2ccc(Nc3[nH+]cccc3N3CCCC3)cc21 ZINC001249894626 1060458370 /nfs/dbraw/zinc/45/83/70/1060458370.db2.gz NJKYOVHIZKRRJW-UHFFFAOYSA-N 1 2 321.424 4.335 20 0 DIADLO CCN(C)c1ccc(Nc2ccc3c(c2)C(=O)CCCC3)c[nH+]1 ZINC001249894079 1060458428 /nfs/dbraw/zinc/45/84/28/1060458428.db2.gz BTTPOHYSWCYGBA-UHFFFAOYSA-N 1 2 309.413 4.190 20 0 DIADLO COCC[N@H+](Cc1c(F)cc(C)cc1F)[C@@H](C)c1ccccc1 ZINC001560641624 1060461054 /nfs/dbraw/zinc/46/10/54/1060461054.db2.gz JZAQUJBFGALYMW-HNNXBMFYSA-N 1 2 319.395 4.483 20 0 DIADLO COCC[N@@H+](Cc1c(F)cc(C)cc1F)[C@@H](C)c1ccccc1 ZINC001560641624 1060461063 /nfs/dbraw/zinc/46/10/63/1060461063.db2.gz JZAQUJBFGALYMW-HNNXBMFYSA-N 1 2 319.395 4.483 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@H+]2CCC[C@H]2C(=O)OC(C)C)c(C)c1 ZINC001560645990 1060468397 /nfs/dbraw/zinc/46/83/97/1060468397.db2.gz LNJKARMLMMTJBM-QJSCKGPTSA-N 1 2 315.457 4.041 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@@H+]2CCC[C@H]2C(=O)OC(C)C)c(C)c1 ZINC001560645990 1060468406 /nfs/dbraw/zinc/46/84/06/1060468406.db2.gz LNJKARMLMMTJBM-QJSCKGPTSA-N 1 2 315.457 4.041 20 0 DIADLO CC/C(=C/C(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccc(C)cc1 ZINC001527354374 1060499780 /nfs/dbraw/zinc/49/97/80/1060499780.db2.gz BUUCHXYJPGZIAX-WJDWOHSUSA-N 1 2 319.408 4.383 20 0 DIADLO COc1nccc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1F ZINC001560673926 1060508223 /nfs/dbraw/zinc/50/82/23/1060508223.db2.gz GRCQZQQUHCFXBW-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1F ZINC001560673926 1060508245 /nfs/dbraw/zinc/50/82/45/1060508245.db2.gz GRCQZQQUHCFXBW-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1[nH+]ccn1-c1ccc(Nc2cc(O)c(F)c(F)c2F)cc1 ZINC001249962300 1060509051 /nfs/dbraw/zinc/50/90/51/1060509051.db2.gz JRFJFKGTLBRSBH-UHFFFAOYSA-N 1 2 319.286 4.047 20 0 DIADLO Cc1cc(Br)c(C[N@@H+](C)Cc2ccoc2C)s1 ZINC001560682949 1060527098 /nfs/dbraw/zinc/52/70/98/1060527098.db2.gz UJHNXRKOWKWXHV-UHFFFAOYSA-N 1 2 314.248 4.352 20 0 DIADLO Cc1cc(Br)c(C[N@H+](C)Cc2ccoc2C)s1 ZINC001560682949 1060527117 /nfs/dbraw/zinc/52/71/17/1060527117.db2.gz UJHNXRKOWKWXHV-UHFFFAOYSA-N 1 2 314.248 4.352 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1cccc(Br)c1F ZINC001560682184 1060527755 /nfs/dbraw/zinc/52/77/55/1060527755.db2.gz FVANDZKHPJBTBF-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1cccc(Br)c1F ZINC001560682184 1060527771 /nfs/dbraw/zinc/52/77/71/1060527771.db2.gz FVANDZKHPJBTBF-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)ccn1 ZINC001250013632 1060539758 /nfs/dbraw/zinc/53/97/58/1060539758.db2.gz GUOADWGPQXBSQE-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)ccn1 ZINC001250013632 1060539777 /nfs/dbraw/zinc/53/97/77/1060539777.db2.gz GUOADWGPQXBSQE-KRWDZBQOSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)ccn1 ZINC001250013635 1060541425 /nfs/dbraw/zinc/54/14/25/1060541425.db2.gz GUOADWGPQXBSQE-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)ccn1 ZINC001250013635 1060541440 /nfs/dbraw/zinc/54/14/40/1060541440.db2.gz GUOADWGPQXBSQE-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO Oc1cc(F)c(Nc2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC001250021975 1060547438 /nfs/dbraw/zinc/54/74/38/1060547438.db2.gz ASFRWGAIFUEKHI-UHFFFAOYSA-N 1 2 303.724 4.114 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2nc(C(C)(C)C)co2)c1 ZINC001560726637 1060587267 /nfs/dbraw/zinc/58/72/67/1060587267.db2.gz YQPVNSJMRIZIOW-MRXNPFEDSA-N 1 2 314.429 4.318 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2nc(C(C)(C)C)co2)c1 ZINC001560726637 1060587277 /nfs/dbraw/zinc/58/72/77/1060587277.db2.gz YQPVNSJMRIZIOW-MRXNPFEDSA-N 1 2 314.429 4.318 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2c(Cl)n[nH]c2C2CC2)cc1 ZINC001560725467 1060588558 /nfs/dbraw/zinc/58/85/58/1060588558.db2.gz XOYGGGDBUOHMFD-UHFFFAOYSA-N 1 2 303.837 4.135 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2c(Cl)n[nH]c2C2CC2)cc1 ZINC001560725467 1060588574 /nfs/dbraw/zinc/58/85/74/1060588574.db2.gz XOYGGGDBUOHMFD-UHFFFAOYSA-N 1 2 303.837 4.135 20 0 DIADLO CCc1ccc[nH+]c1Nc1ccc(OC(F)(F)F)c(OC)c1 ZINC001250079443 1060593296 /nfs/dbraw/zinc/59/32/96/1060593296.db2.gz HKDKZJCNQVHNBH-UHFFFAOYSA-N 1 2 312.291 4.295 20 0 DIADLO COC(=O)[C@@H](CC1CCCCC1)[NH2+]CC[C@@H](C)c1ccccc1 ZINC001560756083 1060622874 /nfs/dbraw/zinc/62/28/74/1060622874.db2.gz AADNOONHCWXVFO-VQIMIIECSA-N 1 2 317.473 4.282 20 0 DIADLO c1ccc2nc(Cc3ccc(N4CCCCC4)[nH+]c3)ccc2c1 ZINC001250117527 1060623132 /nfs/dbraw/zinc/62/31/32/1060623132.db2.gz FMKZIOJULIMXHQ-UHFFFAOYSA-N 1 2 303.409 4.211 20 0 DIADLO CCCCC[C@H]([NH2+]CCc1ccc(C(C)(C)C)cc1)C(=O)OC ZINC001560764383 1060630047 /nfs/dbraw/zinc/63/00/47/1060630047.db2.gz WWFPPTVSFPJMSE-SFHVURJKSA-N 1 2 319.489 4.238 20 0 DIADLO CCCc1ccc(C[N@H+]([C@H](CC)C(=O)OCC)C2CC2)s1 ZINC001560768071 1060632747 /nfs/dbraw/zinc/63/27/47/1060632747.db2.gz PUPSZHAVSHEZJQ-MRXNPFEDSA-N 1 2 309.475 4.007 20 0 DIADLO CCCc1ccc(C[N@@H+]([C@H](CC)C(=O)OCC)C2CC2)s1 ZINC001560768071 1060632754 /nfs/dbraw/zinc/63/27/54/1060632754.db2.gz PUPSZHAVSHEZJQ-MRXNPFEDSA-N 1 2 309.475 4.007 20 0 DIADLO Cc1c2cccc(Cl)c2sc1C[N@H+](C)Cc1ncc[nH]1 ZINC001560793300 1060653971 /nfs/dbraw/zinc/65/39/71/1060653971.db2.gz LCOCFOWLXXCVCW-UHFFFAOYSA-N 1 2 305.834 4.218 20 0 DIADLO Cc1c2cccc(Cl)c2sc1C[N@@H+](C)Cc1ncc[nH]1 ZINC001560793300 1060653978 /nfs/dbraw/zinc/65/39/78/1060653978.db2.gz LCOCFOWLXXCVCW-UHFFFAOYSA-N 1 2 305.834 4.218 20 0 DIADLO CCCC(CCC)Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001560799257 1060660930 /nfs/dbraw/zinc/66/09/30/1060660930.db2.gz ZOTLLZATLCKWNA-GASCZTMLSA-N 1 2 305.466 4.076 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC001560825227 1060684782 /nfs/dbraw/zinc/68/47/82/1060684782.db2.gz GEKRXGUOWFLMDO-MRXNPFEDSA-N 1 2 301.434 4.336 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC001560825227 1060684789 /nfs/dbraw/zinc/68/47/89/1060684789.db2.gz GEKRXGUOWFLMDO-MRXNPFEDSA-N 1 2 301.434 4.336 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@H]2c2ncccn2)c(C)c1Cl ZINC001250207266 1060687285 /nfs/dbraw/zinc/68/72/85/1060687285.db2.gz SKDQCCCFJBFONG-HNNXBMFYSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@H]2c2ncccn2)c(C)c1Cl ZINC001250207266 1060687291 /nfs/dbraw/zinc/68/72/91/1060687291.db2.gz SKDQCCCFJBFONG-HNNXBMFYSA-N 1 2 301.821 4.084 20 0 DIADLO Fc1ccc(Cc2ccc[nH+]c2N2CCCC2)c(C(F)(F)F)c1 ZINC001250214691 1060693158 /nfs/dbraw/zinc/69/31/58/1060693158.db2.gz MYXXIJCQYKTQSE-UHFFFAOYSA-N 1 2 324.321 4.431 20 0 DIADLO CC(C)Cc1ccc([C@@H](C)[C@H](C)[NH2+][C@@H](C)C(=O)OC(C)C)cc1 ZINC001560837748 1060695562 /nfs/dbraw/zinc/69/55/62/1060695562.db2.gz ANUBFEQAKNYEDC-ULQDDVLXSA-N 1 2 319.489 4.307 20 0 DIADLO CC(C)Cc1ccc([C@@H](C)[C@@H](C)[NH2+][C@@H](C)C(=O)OC(C)C)cc1 ZINC001560837746 1060695764 /nfs/dbraw/zinc/69/57/64/1060695764.db2.gz ANUBFEQAKNYEDC-BBWFWOEESA-N 1 2 319.489 4.307 20 0 DIADLO Cc1ccc(C[N@@H+]2CCC[C@](C)(F)C2)c(C)c1Br ZINC001560848881 1060706337 /nfs/dbraw/zinc/70/63/37/1060706337.db2.gz LWHOBAWTXQJSMP-HNNXBMFYSA-N 1 2 314.242 4.390 20 0 DIADLO Cc1ccc(C[N@H+]2CCC[C@](C)(F)C2)c(C)c1Br ZINC001560848881 1060706348 /nfs/dbraw/zinc/70/63/48/1060706348.db2.gz LWHOBAWTXQJSMP-HNNXBMFYSA-N 1 2 314.242 4.390 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@@H+](Cc1cc3cccnc3o1)CC2 ZINC001560860283 1060716837 /nfs/dbraw/zinc/71/68/37/1060716837.db2.gz IBLJFCRHYFBEEW-UHFFFAOYSA-N 1 2 316.763 4.179 20 0 DIADLO Fc1cc(Cl)c2c(c1)C[N@H+](Cc1cc3cccnc3o1)CC2 ZINC001560860283 1060716849 /nfs/dbraw/zinc/71/68/49/1060716849.db2.gz IBLJFCRHYFBEEW-UHFFFAOYSA-N 1 2 316.763 4.179 20 0 DIADLO CCOc1cccc(F)c1C[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001560860957 1060720841 /nfs/dbraw/zinc/72/08/41/1060720841.db2.gz AEQCUUAJXKLYOH-AWEZNQCLSA-N 1 2 315.388 4.008 20 0 DIADLO CCOc1cccc(F)c1C[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001560860957 1060720855 /nfs/dbraw/zinc/72/08/55/1060720855.db2.gz AEQCUUAJXKLYOH-AWEZNQCLSA-N 1 2 315.388 4.008 20 0 DIADLO CCOc1nccc(Nc2cccc(-n3cc[nH+]c3)c2)c1Cl ZINC001250248325 1060727011 /nfs/dbraw/zinc/72/70/11/1060727011.db2.gz YOEGZRVBLKEVNA-UHFFFAOYSA-N 1 2 314.776 4.063 20 0 DIADLO Fc1cc(C[N@@H+]2C[C@H]3CC[C@@H]2C3)c(Cl)c(C(F)(F)F)c1 ZINC001250276621 1060748866 /nfs/dbraw/zinc/74/88/66/1060748866.db2.gz JECOHEPTPXGNQG-GZMMTYOYSA-N 1 2 307.718 4.482 20 0 DIADLO Fc1cc(C[N@H+]2C[C@H]3CC[C@@H]2C3)c(Cl)c(C(F)(F)F)c1 ZINC001250276621 1060748879 /nfs/dbraw/zinc/74/88/79/1060748879.db2.gz JECOHEPTPXGNQG-GZMMTYOYSA-N 1 2 307.718 4.482 20 0 DIADLO CC(C)O[C@@H]1CC[N@H+](Cc2ccc(F)c(Cl)c2Cl)C1 ZINC001560902567 1060765575 /nfs/dbraw/zinc/76/55/75/1060765575.db2.gz WZCFJGQBRDJQCV-LLVKDONJSA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)O[C@@H]1CC[N@@H+](Cc2ccc(F)c(Cl)c2Cl)C1 ZINC001560902567 1060765588 /nfs/dbraw/zinc/76/55/88/1060765588.db2.gz WZCFJGQBRDJQCV-LLVKDONJSA-N 1 2 306.208 4.132 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(CO)c(F)c2Cl)cc1 ZINC001250301384 1060766890 /nfs/dbraw/zinc/76/68/90/1060766890.db2.gz NVEWCZLNPITXQS-UHFFFAOYSA-N 1 2 308.784 4.171 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(CO)c(F)c2Cl)cc1 ZINC001250301384 1060766903 /nfs/dbraw/zinc/76/69/03/1060766903.db2.gz NVEWCZLNPITXQS-UHFFFAOYSA-N 1 2 308.784 4.171 20 0 DIADLO Cc1ccc(OCc2ccccc2)c(CCn2cc[nH+]c2)c1F ZINC001250320838 1060777360 /nfs/dbraw/zinc/77/73/60/1060777360.db2.gz QQVZHUZLYBADAE-UHFFFAOYSA-N 1 2 310.372 4.152 20 0 DIADLO FC(F)(F)c1ccc(C(F)(F)F)c(CCn2cc[nH+]c2)c1 ZINC001250318379 1060778144 /nfs/dbraw/zinc/77/81/44/1060778144.db2.gz FSGUDPLFUVJNGH-UHFFFAOYSA-N 1 2 308.225 4.163 20 0 DIADLO Clc1cc(OCc2ccccc2)ccc1CCn1cc[nH+]c1 ZINC001250321228 1060778575 /nfs/dbraw/zinc/77/85/75/1060778575.db2.gz YGYNYGQSSUMQEP-UHFFFAOYSA-N 1 2 312.800 4.358 20 0 DIADLO CCOc1cc(C[N@@H+]2CC[C@@H]2c2ccccc2)c(Cl)cn1 ZINC001250319188 1060779057 /nfs/dbraw/zinc/77/90/57/1060779057.db2.gz PBFDMEDSAKYCEQ-MRXNPFEDSA-N 1 2 302.805 4.081 20 0 DIADLO CCOc1cc(C[N@H+]2CC[C@@H]2c2ccccc2)c(Cl)cn1 ZINC001250319188 1060779072 /nfs/dbraw/zinc/77/90/72/1060779072.db2.gz PBFDMEDSAKYCEQ-MRXNPFEDSA-N 1 2 302.805 4.081 20 0 DIADLO CC(C)(C[NH2+]CC(F)(F)c1cccc(F)c1)Oc1ccccc1 ZINC001560922291 1060787402 /nfs/dbraw/zinc/78/74/02/1060787402.db2.gz PVKYTDFFNLKDQR-UHFFFAOYSA-N 1 2 323.358 4.365 20 0 DIADLO CCOc1nccc(C[N@H+](Cc2ccccc2)C2CC2)c1Cl ZINC001250385714 1060791740 /nfs/dbraw/zinc/79/17/40/1060791740.db2.gz STFBSDGDAQQNCL-UHFFFAOYSA-N 1 2 316.832 4.298 20 0 DIADLO CCOc1nccc(C[N@@H+](Cc2ccccc2)C2CC2)c1Cl ZINC001250385714 1060791751 /nfs/dbraw/zinc/79/17/51/1060791751.db2.gz STFBSDGDAQQNCL-UHFFFAOYSA-N 1 2 316.832 4.298 20 0 DIADLO CC[N@H+](Cc1cc(O)c(Cl)c(F)c1F)C1CCCCC1 ZINC001250386942 1060792128 /nfs/dbraw/zinc/79/21/28/1060792128.db2.gz DIWGVRXWZQJJFO-UHFFFAOYSA-N 1 2 303.780 4.478 20 0 DIADLO CC[N@@H+](Cc1cc(O)c(Cl)c(F)c1F)C1CCCCC1 ZINC001250386942 1060792142 /nfs/dbraw/zinc/79/21/42/1060792142.db2.gz DIWGVRXWZQJJFO-UHFFFAOYSA-N 1 2 303.780 4.478 20 0 DIADLO COc1c(C)c[nH+]c(CNc2cccc(F)c2SC)c1C ZINC001560927968 1060792990 /nfs/dbraw/zinc/79/29/90/1060792990.db2.gz GXITWCKSRNDKNZ-UHFFFAOYSA-N 1 2 306.406 4.180 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccccc3Br)[nH+]c2c1 ZINC001250447550 1060807742 /nfs/dbraw/zinc/80/77/42/1060807742.db2.gz PLDZSYIASHWEQK-UHFFFAOYSA-N 1 2 316.202 4.058 20 0 DIADLO CCO[C@@H]1C[C@@H]([NH2+]CC(F)(F)c2ccccc2C)C12CCC2 ZINC001560948787 1060815578 /nfs/dbraw/zinc/81/55/78/1060815578.db2.gz HWLHOPNWMNQOAZ-HZPDHXFCSA-N 1 2 309.400 4.024 20 0 DIADLO Oc1ccc(C[NH2+]Cc2ccc(C(F)(F)F)s2)c(F)c1F ZINC001560993850 1060854169 /nfs/dbraw/zinc/85/41/69/1060854169.db2.gz QASZBUOYEIVZJP-UHFFFAOYSA-N 1 2 323.286 4.041 20 0 DIADLO Cc1ccc(F)c(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)c1 ZINC001250508207 1060860930 /nfs/dbraw/zinc/86/09/30/1060860930.db2.gz IJGZQUHWDBLRGZ-UHFFFAOYSA-N 1 2 310.307 4.002 20 0 DIADLO CC[C@@H]1C[C@@H]([NH2+][C@@H](c2cccc(Cl)c2)C(F)F)CCO1 ZINC001561006870 1060864873 /nfs/dbraw/zinc/86/48/73/1060864873.db2.gz DKVQKBAPGLUGLP-MJBXVCDLSA-N 1 2 303.780 4.193 20 0 DIADLO COc1cc(C[C@H](C)Nc2ccc3[nH+]c(C)cc(C)c3c2)ccn1 ZINC001561007794 1060865702 /nfs/dbraw/zinc/86/57/02/1060865702.db2.gz FYFCVZJFIDDEKG-HNNXBMFYSA-N 1 2 321.424 4.298 20 0 DIADLO COc1ccc2[nH+]c(CCc3ccc(Cl)cc3)n(C)c2c1 ZINC001250553445 1060889806 /nfs/dbraw/zinc/88/98/06/1060889806.db2.gz BDTLGPJRJDFGJS-UHFFFAOYSA-N 1 2 300.789 4.021 20 0 DIADLO COc1cc2[nH+]c(CCc3cccc(Cl)c3)[nH]c2cc1F ZINC001250553485 1060890023 /nfs/dbraw/zinc/89/00/23/1060890023.db2.gz DSDDHEHGIFGYCN-UHFFFAOYSA-N 1 2 304.752 4.149 20 0 DIADLO COc1cc2[nH]c(CCc3cccc(Cl)c3)[nH+]c2cc1F ZINC001250553485 1060890030 /nfs/dbraw/zinc/89/00/30/1060890030.db2.gz DSDDHEHGIFGYCN-UHFFFAOYSA-N 1 2 304.752 4.149 20 0 DIADLO Cc1cc(F)cc2[nH+]c(Cc3cccc(Br)c3)[nH]c21 ZINC001250552637 1060890886 /nfs/dbraw/zinc/89/08/86/1060890886.db2.gz JECIUUWTKQUSNG-UHFFFAOYSA-N 1 2 319.177 4.364 20 0 DIADLO COc1ccc(CCc2[nH+]c3cccc(C)c3n2C2CC2)cc1 ZINC001250553492 1060891381 /nfs/dbraw/zinc/89/13/81/1060891381.db2.gz FINYMNGUECIDNE-UHFFFAOYSA-N 1 2 306.409 4.473 20 0 DIADLO CCOc1ccc2[nH]c(C[C@H](C)CCCC(C)(C)O)[nH+]c2c1 ZINC001250557059 1060896559 /nfs/dbraw/zinc/89/65/59/1060896559.db2.gz YCEMVCVOJPFTNM-CYBMUJFWSA-N 1 2 304.434 4.081 20 0 DIADLO CC1(c2[nH]c3ccc(OCc4ccccc4)cc3[nH+]2)CCOCC1 ZINC001250562753 1060900642 /nfs/dbraw/zinc/90/06/42/1060900642.db2.gz NIMINLNGUNPGQM-UHFFFAOYSA-N 1 2 322.408 4.210 20 0 DIADLO COc1ccc2[nH+]c(C[C@@H](C)CCCC(C)(C)OC)n(C)c2c1 ZINC001250567437 1060905325 /nfs/dbraw/zinc/90/53/25/1060905325.db2.gz JNQURCVSGIBYRB-AWEZNQCLSA-N 1 2 318.461 4.356 20 0 DIADLO FC(F)[C@@H]([NH2+][C@H]1Cc2[nH]c3ccccc3c2C1)c1ccccc1 ZINC001561059096 1060906773 /nfs/dbraw/zinc/90/67/73/1060906773.db2.gz OOKNXZWITMLLIJ-ACJLOTCBSA-N 1 2 312.363 4.231 20 0 DIADLO FC(F)[C@@H]([NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1)c1ccccc1 ZINC001561059099 1060907667 /nfs/dbraw/zinc/90/76/67/1060907667.db2.gz OOKNXZWITMLLIJ-UGSOOPFHSA-N 1 2 312.363 4.231 20 0 DIADLO COC(=O)[C@H]1CC[C@H](c2[nH+]c3cccc(C)c3n2C2CC2)CC1 ZINC001250574708 1060912951 /nfs/dbraw/zinc/91/29/51/1060912951.db2.gz HIAWYBJJRNFGJH-HDJSIYSDSA-N 1 2 312.413 4.126 20 0 DIADLO CCOC(=O)CCCCCc1[nH+]c2cc(C)ccc2n1CC ZINC001250611476 1060937595 /nfs/dbraw/zinc/93/75/95/1060937595.db2.gz LYDLZEHBZQSEGX-UHFFFAOYSA-N 1 2 302.418 4.031 20 0 DIADLO CCOC(=O)CCCCCc1[nH]c2ccc(Cl)c(C)c2[nH+]1 ZINC001250611655 1060940770 /nfs/dbraw/zinc/94/07/70/1060940770.db2.gz XFGZTKRGUSFFBX-UHFFFAOYSA-N 1 2 308.809 4.191 20 0 DIADLO CCOC(=O)CCCCCc1[nH]c2ccc(C(C)C)cc2[nH+]1 ZINC001250611559 1060942324 /nfs/dbraw/zinc/94/23/24/1060942324.db2.gz PGIDKFZHKMUCNA-UHFFFAOYSA-N 1 2 302.418 4.352 20 0 DIADLO CCOc1cc2[nH]c([C@@H]3C[C@@H](C)O[C@@H](C)C3)[nH+]c2cc1OCC ZINC001250612470 1060942365 /nfs/dbraw/zinc/94/23/65/1060942365.db2.gz PPIQEJNDKYMHEF-CLLJXQQHSA-N 1 2 318.417 4.031 20 0 DIADLO C[C@H]1C[N@H+](Cc2ncccc2Br)[C@H]1c1ccccc1 ZINC001473208066 1060975190 /nfs/dbraw/zinc/97/51/90/1060975190.db2.gz HPPKRZVEPWGBOU-BLLLJJGKSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ncccc2Br)[C@H]1c1ccccc1 ZINC001473208066 1060975215 /nfs/dbraw/zinc/97/52/15/1060975215.db2.gz HPPKRZVEPWGBOU-BLLLJJGKSA-N 1 2 317.230 4.037 20 0 DIADLO CC(=O)C[N@@H+](C)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC001473212286 1060978371 /nfs/dbraw/zinc/97/83/71/1060978371.db2.gz HPIZJCARRQNWBU-QGZVFWFLSA-N 1 2 305.780 4.089 20 0 DIADLO CC(=O)C[N@H+](C)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC001473212286 1060978396 /nfs/dbraw/zinc/97/83/96/1060978396.db2.gz HPIZJCARRQNWBU-QGZVFWFLSA-N 1 2 305.780 4.089 20 0 DIADLO c1ccc2ncc(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)cc2c1 ZINC001250647124 1060984423 /nfs/dbraw/zinc/98/44/23/1060984423.db2.gz DZSRXZFPFIUJDM-UHFFFAOYSA-N 1 2 314.392 4.378 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CCC(CC)(CC)C1 ZINC001473222491 1061002621 /nfs/dbraw/zinc/00/26/21/1061002621.db2.gz JMDJSERCWHBQGV-INIZCTEOSA-N 1 2 323.864 4.456 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CCC(CC)(CC)C1 ZINC001473222491 1061002639 /nfs/dbraw/zinc/00/26/39/1061002639.db2.gz JMDJSERCWHBQGV-INIZCTEOSA-N 1 2 323.864 4.456 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccc(O)c4ccccc34)[nH+]c2c1 ZINC001250681004 1061013222 /nfs/dbraw/zinc/01/32/22/1061013222.db2.gz LGOHLATXHXPRDC-UHFFFAOYSA-N 1 2 303.365 4.155 20 0 DIADLO COC(C)(C)CC[N@H+](CCc1ccccc1)c1ccc(O)cc1 ZINC001473251930 1061028364 /nfs/dbraw/zinc/02/83/64/1061028364.db2.gz ZLVJJKAXFUPDBO-UHFFFAOYSA-N 1 2 313.441 4.256 20 0 DIADLO COC(C)(C)CC[N@@H+](CCc1ccccc1)c1ccc(O)cc1 ZINC001473251930 1061028383 /nfs/dbraw/zinc/02/83/83/1061028383.db2.gz ZLVJJKAXFUPDBO-UHFFFAOYSA-N 1 2 313.441 4.256 20 0 DIADLO CC(C)CC[C@H]1CCC[N@@H+]1Cc1ncsc1Br ZINC001473272871 1061045223 /nfs/dbraw/zinc/04/52/23/1061045223.db2.gz LJGRXIUSSORILR-LLVKDONJSA-N 1 2 317.296 4.306 20 0 DIADLO CC(C)CC[C@H]1CCC[N@H+]1Cc1ncsc1Br ZINC001473272871 1061045234 /nfs/dbraw/zinc/04/52/34/1061045234.db2.gz LJGRXIUSSORILR-LLVKDONJSA-N 1 2 317.296 4.306 20 0 DIADLO CC(C)CO[C@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001473274885 1061048512 /nfs/dbraw/zinc/04/85/12/1061048512.db2.gz LUCJKEWKIDOLSM-ZDUSSCGKSA-N 1 2 320.235 4.379 20 0 DIADLO CC(C)CO[C@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001473274885 1061048528 /nfs/dbraw/zinc/04/85/28/1061048528.db2.gz LUCJKEWKIDOLSM-ZDUSSCGKSA-N 1 2 320.235 4.379 20 0 DIADLO CC(C)COC(=O)C[N@H+](Cc1ccccc1F)C1CCCCC1 ZINC001473286352 1061055083 /nfs/dbraw/zinc/05/50/83/1061055083.db2.gz IBPXGMNGJZXOJH-UHFFFAOYSA-N 1 2 321.436 4.160 20 0 DIADLO CC(C)COC(=O)C[N@@H+](Cc1ccccc1F)C1CCCCC1 ZINC001473286352 1061055098 /nfs/dbraw/zinc/05/50/98/1061055098.db2.gz IBPXGMNGJZXOJH-UHFFFAOYSA-N 1 2 321.436 4.160 20 0 DIADLO COC(=O)[C@@H](CC(C)C)[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001473287769 1061058905 /nfs/dbraw/zinc/05/89/05/1061058905.db2.gz JZOFPXCPFYBIHZ-QGZVFWFLSA-N 1 2 321.848 4.017 20 0 DIADLO COC(=O)[C@@H](CC(C)C)[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC001473287769 1061058920 /nfs/dbraw/zinc/05/89/20/1061058920.db2.gz JZOFPXCPFYBIHZ-QGZVFWFLSA-N 1 2 321.848 4.017 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccc(-c4ccsc4)nc3)[nH+]c2c1 ZINC001250786488 1061066760 /nfs/dbraw/zinc/06/67/60/1061066760.db2.gz UMUDSAIGIUITFT-UHFFFAOYSA-N 1 2 320.421 4.419 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@@H+]1CCCc2occc2C1 ZINC001462291201 1061082613 /nfs/dbraw/zinc/08/26/13/1061082613.db2.gz CUIHQSJXUNTLMU-UHFFFAOYSA-N 1 2 305.805 4.280 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@H+]1CCCc2occc2C1 ZINC001462291201 1061082629 /nfs/dbraw/zinc/08/26/29/1061082629.db2.gz CUIHQSJXUNTLMU-UHFFFAOYSA-N 1 2 305.805 4.280 20 0 DIADLO CCC1(CC)C[NH+](Cc2cccc(F)c2OC(F)(F)F)C1 ZINC001462314460 1061100856 /nfs/dbraw/zinc/10/08/56/1061100856.db2.gz JDHLXBXZZKXTAH-UHFFFAOYSA-N 1 2 305.315 4.346 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@H](C)C(C)(C)C1 ZINC001473364692 1061113798 /nfs/dbraw/zinc/11/37/98/1061113798.db2.gz CIXLARLHBXWWNU-CJNGLKHVSA-N 1 2 323.864 4.312 20 0 DIADLO CCOC(=O)[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@@H](C)C(C)(C)C1 ZINC001473364692 1061113803 /nfs/dbraw/zinc/11/38/03/1061113803.db2.gz CIXLARLHBXWWNU-CJNGLKHVSA-N 1 2 323.864 4.312 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1c(F)cccc1F)[C@@H]2C ZINC001473370740 1061118208 /nfs/dbraw/zinc/11/82/08/1061118208.db2.gz ANOOJXBFBFUJPT-CHWSQXEVSA-N 1 2 317.379 4.481 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1c(F)cccc1F)[C@@H]2C ZINC001473370740 1061118212 /nfs/dbraw/zinc/11/82/12/1061118212.db2.gz ANOOJXBFBFUJPT-CHWSQXEVSA-N 1 2 317.379 4.481 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1nsc2ccccc21 ZINC001473372912 1061118365 /nfs/dbraw/zinc/11/83/65/1061118365.db2.gz JOXUKPAGEJJIQJ-CYBMUJFWSA-N 1 2 310.422 4.079 20 0 DIADLO C[C@@H]1COc2ccccc2C[N@H+]1Cc1nsc2ccccc21 ZINC001473372912 1061118371 /nfs/dbraw/zinc/11/83/71/1061118371.db2.gz JOXUKPAGEJJIQJ-CYBMUJFWSA-N 1 2 310.422 4.079 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1c(F)cccc1F)[C@H]2C ZINC001473370741 1061120043 /nfs/dbraw/zinc/12/00/43/1061120043.db2.gz ANOOJXBFBFUJPT-OLZOCXBDSA-N 1 2 317.379 4.481 20 0 DIADLO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1c(F)cccc1F)[C@H]2C ZINC001473370741 1061120053 /nfs/dbraw/zinc/12/00/53/1061120053.db2.gz ANOOJXBFBFUJPT-OLZOCXBDSA-N 1 2 317.379 4.481 20 0 DIADLO Cc1cc2[nH]c(-c3ccn4cc[nH+]c4c3)nc2cc1C(F)(F)F ZINC001250927828 1061128997 /nfs/dbraw/zinc/12/89/97/1061128997.db2.gz KZGGHAVUPZODEV-UHFFFAOYSA-N 1 2 316.286 4.205 20 0 DIADLO Cc1ccc2c(c1)nc(-c1ccn3cc[nH+]c3c1)n2CC(C)C ZINC001250928092 1061129020 /nfs/dbraw/zinc/12/90/20/1061129020.db2.gz VNKUQJQOTBALHS-UHFFFAOYSA-N 1 2 304.397 4.315 20 0 DIADLO Fc1cccc(Cl)c1[C@H]1C[N@H+](C[C@H]2CC=CCC2)CCO1 ZINC001462407007 1061154023 /nfs/dbraw/zinc/15/40/23/1061154023.db2.gz GKXCBJVZJMNHIW-XJKSGUPXSA-N 1 2 309.812 4.209 20 0 DIADLO Fc1cccc(Cl)c1[C@H]1C[N@@H+](C[C@H]2CC=CCC2)CCO1 ZINC001462407007 1061154027 /nfs/dbraw/zinc/15/40/27/1061154027.db2.gz GKXCBJVZJMNHIW-XJKSGUPXSA-N 1 2 309.812 4.209 20 0 DIADLO Fc1cccc(Cl)c1[C@H]1C[N@H+](C[C@@H]2CC=CCC2)CCO1 ZINC001462407006 1061154093 /nfs/dbraw/zinc/15/40/93/1061154093.db2.gz GKXCBJVZJMNHIW-CZUORRHYSA-N 1 2 309.812 4.209 20 0 DIADLO Fc1cccc(Cl)c1[C@H]1C[N@@H+](C[C@@H]2CC=CCC2)CCO1 ZINC001462407006 1061154097 /nfs/dbraw/zinc/15/40/97/1061154097.db2.gz GKXCBJVZJMNHIW-CZUORRHYSA-N 1 2 309.812 4.209 20 0 DIADLO C[C@@H]1[C@@H](C)[S@@](=O)CC[N@@H+]1Cc1ccc(C2CCCCC2)cc1 ZINC001473429618 1061156644 /nfs/dbraw/zinc/15/66/44/1061156644.db2.gz XTVOGGBOWNWLQK-MCFFVMPBSA-N 1 2 319.514 4.076 20 0 DIADLO C[C@@H]1[C@@H](C)[S@@](=O)CC[N@H+]1Cc1ccc(C2CCCCC2)cc1 ZINC001473429618 1061156654 /nfs/dbraw/zinc/15/66/54/1061156654.db2.gz XTVOGGBOWNWLQK-MCFFVMPBSA-N 1 2 319.514 4.076 20 0 DIADLO COc1nsc(C[N@H+](C)C(C)(C)c2ccccc2)c1Cl ZINC001462413538 1061158091 /nfs/dbraw/zinc/15/80/91/1061158091.db2.gz JEOIQXAYVHRXMN-UHFFFAOYSA-N 1 2 310.850 4.172 20 0 DIADLO COc1nsc(C[N@@H+](C)C(C)(C)c2ccccc2)c1Cl ZINC001462413538 1061158101 /nfs/dbraw/zinc/15/81/01/1061158101.db2.gz JEOIQXAYVHRXMN-UHFFFAOYSA-N 1 2 310.850 4.172 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)[C@@H](C)c2cn(-c3ccccc3)nn2)c1 ZINC001473446049 1061162269 /nfs/dbraw/zinc/16/22/69/1061162269.db2.gz HRFSCHYTTQGNDX-KRWDZBQOSA-N 1 2 320.440 4.077 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)[C@@H](C)c2cn(-c3ccccc3)nn2)c1 ZINC001473446049 1061162278 /nfs/dbraw/zinc/16/22/78/1061162278.db2.gz HRFSCHYTTQGNDX-KRWDZBQOSA-N 1 2 320.440 4.077 20 0 DIADLO CCc1cccc(Cl)c1C[N@@H+]1C[C@H](C)O[C@](C)(C(F)F)C1 ZINC001462451458 1061182085 /nfs/dbraw/zinc/18/20/85/1061182085.db2.gz LMBFZFBJCZZCFZ-ZBEGNZNMSA-N 1 2 317.807 4.147 20 0 DIADLO CCc1cccc(Cl)c1C[N@H+]1C[C@H](C)O[C@](C)(C(F)F)C1 ZINC001462451458 1061182093 /nfs/dbraw/zinc/18/20/93/1061182093.db2.gz LMBFZFBJCZZCFZ-ZBEGNZNMSA-N 1 2 317.807 4.147 20 0 DIADLO CCc1cccc(Cl)c1C[N@@H+]1C[C@H](C)O[C@@](C)(C(F)F)C1 ZINC001462451455 1061182409 /nfs/dbraw/zinc/18/24/09/1061182409.db2.gz LMBFZFBJCZZCFZ-MEDUHNTESA-N 1 2 317.807 4.147 20 0 DIADLO CCc1cccc(Cl)c1C[N@H+]1C[C@H](C)O[C@@](C)(C(F)F)C1 ZINC001462451455 1061182415 /nfs/dbraw/zinc/18/24/15/1061182415.db2.gz LMBFZFBJCZZCFZ-MEDUHNTESA-N 1 2 317.807 4.147 20 0 DIADLO C[C@H](c1nc2ccc(Cl)cc2[nH]1)[N@H+](C)C[C@@H]1CCC(C)(C)O1 ZINC001473483480 1061184537 /nfs/dbraw/zinc/18/45/37/1061184537.db2.gz JKNOOGZHXPHBJB-YPMHNXCESA-N 1 2 321.852 4.167 20 0 DIADLO C[C@H](c1nc2ccc(Cl)cc2[nH]1)[N@@H+](C)C[C@@H]1CCC(C)(C)O1 ZINC001473483480 1061184545 /nfs/dbraw/zinc/18/45/45/1061184545.db2.gz JKNOOGZHXPHBJB-YPMHNXCESA-N 1 2 321.852 4.167 20 0 DIADLO CC(C)Oc1ccc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)cn1 ZINC001251019835 1061185285 /nfs/dbraw/zinc/18/52/85/1061185285.db2.gz DGDBEIFCYGSIPP-UHFFFAOYSA-N 1 2 322.412 4.012 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(Cl)ccc2Cl)[C@@H]1[C@H]1CCCO1 ZINC001473523367 1061222858 /nfs/dbraw/zinc/22/28/58/1061222858.db2.gz QIRJMCRTNUVMHJ-HUUCEWRRSA-N 1 2 314.256 4.383 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(Cl)ccc2Cl)[C@@H]1[C@H]1CCCO1 ZINC001473523367 1061222879 /nfs/dbraw/zinc/22/28/79/1061222879.db2.gz QIRJMCRTNUVMHJ-HUUCEWRRSA-N 1 2 314.256 4.383 20 0 DIADLO CCOC(=O)[C@H](CCCC(C)C)[NH2+]C[C@@H](C)c1ccccc1 ZINC001462573004 1061269555 /nfs/dbraw/zinc/26/95/55/1061269555.db2.gz MDROCZXWOQJJFT-AEFFLSMTSA-N 1 2 305.462 4.138 20 0 DIADLO CCOC(=O)[C@H](CCCC(C)C)[NH2+]C[C@H](C)c1ccccc1 ZINC001462573007 1061271030 /nfs/dbraw/zinc/27/10/30/1061271030.db2.gz MDROCZXWOQJJFT-WMZOPIPTSA-N 1 2 305.462 4.138 20 0 DIADLO COC(=O)[C@H]([NH2+][C@H]1CCC[C@@H](C)C1)c1cccc2ccccc21 ZINC001462588290 1061280902 /nfs/dbraw/zinc/28/09/02/1061280902.db2.gz STNHXKVWWKQYJW-SIXWZSSISA-N 1 2 311.425 4.222 20 0 DIADLO C[C@@H]1C[N@H+](Cc2nc3ccccc3s2)CC2(CCCCC2)O1 ZINC001473596451 1061281295 /nfs/dbraw/zinc/28/12/95/1061281295.db2.gz AZTTXYVKJZAUCY-CQSZACIVSA-N 1 2 316.470 4.220 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2nc3ccccc3s2)CC2(CCCCC2)O1 ZINC001473596451 1061281314 /nfs/dbraw/zinc/28/13/14/1061281314.db2.gz AZTTXYVKJZAUCY-CQSZACIVSA-N 1 2 316.470 4.220 20 0 DIADLO CCc1cccc(Cl)c1C[NH2+]Cc1nc2ccccc2o1 ZINC001462600688 1061286515 /nfs/dbraw/zinc/28/65/15/1061286515.db2.gz AHPLXDZRKZEHEL-UHFFFAOYSA-N 1 2 300.789 4.333 20 0 DIADLO Cc1ccccc1-c1nc(C[NH+]2CCC(C3CCC3)CC2)no1 ZINC001473626597 1061298179 /nfs/dbraw/zinc/29/81/79/1061298179.db2.gz LMBSQXJUPJIQGH-UHFFFAOYSA-N 1 2 311.429 4.057 20 0 DIADLO C[C@@]1(C2CC2)C[N@H+](CCc2cccc(Cl)c2Cl)CCO1 ZINC001473638363 1061310758 /nfs/dbraw/zinc/31/07/58/1061310758.db2.gz TUUVSFMYULFMIQ-INIZCTEOSA-N 1 2 314.256 4.037 20 0 DIADLO C[C@@]1(C2CC2)C[N@@H+](CCc2cccc(Cl)c2Cl)CCO1 ZINC001473638363 1061310774 /nfs/dbraw/zinc/31/07/74/1061310774.db2.gz TUUVSFMYULFMIQ-INIZCTEOSA-N 1 2 314.256 4.037 20 0 DIADLO Fc1cc2[nH]c(-c3cccc4[nH+]ccn43)nc2c(C(F)(F)F)c1 ZINC001251326413 1061315158 /nfs/dbraw/zinc/31/51/58/1061315158.db2.gz IMQGGHCIWKFSAC-UHFFFAOYSA-N 1 2 320.249 4.036 20 0 DIADLO CCCn1c(-c2cccc3[nH+]ccn32)nc2ccc(F)c(F)c21 ZINC001251326404 1061315566 /nfs/dbraw/zinc/31/55/66/1061315566.db2.gz HXOGUQKABWVDED-UHFFFAOYSA-N 1 2 312.323 4.039 20 0 DIADLO Clc1cc2nc(-c3cccc4[nH+]ccn43)[nH]c2cc1Cl ZINC001251326179 1061315704 /nfs/dbraw/zinc/31/57/04/1061315704.db2.gz AYNQYBIHTUBFKL-UHFFFAOYSA-N 1 2 303.152 4.184 20 0 DIADLO Fc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3)CC2)c(F)c1F ZINC001462681713 1061337324 /nfs/dbraw/zinc/33/73/24/1061337324.db2.gz YRRIULLRDWFUIZ-MRXNPFEDSA-N 1 2 321.342 4.068 20 0 DIADLO Fc1ccc(C[N@H+]2CCO[C@@H](c3ccccc3)CC2)c(F)c1F ZINC001462681713 1061337344 /nfs/dbraw/zinc/33/73/44/1061337344.db2.gz YRRIULLRDWFUIZ-MRXNPFEDSA-N 1 2 321.342 4.068 20 0 DIADLO C[C@H](c1cccc(Cl)c1F)[N@@H+]1Cc2c[nH]nc2CC(C)(C)C1 ZINC001473680815 1061342057 /nfs/dbraw/zinc/34/20/57/1061342057.db2.gz AHWOKOYXPXBDAG-LLVKDONJSA-N 1 2 321.827 4.348 20 0 DIADLO C[C@H](c1cccc(Cl)c1F)[N@H+]1Cc2c[nH]nc2CC(C)(C)C1 ZINC001473680815 1061342078 /nfs/dbraw/zinc/34/20/78/1061342078.db2.gz AHWOKOYXPXBDAG-LLVKDONJSA-N 1 2 321.827 4.348 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(CC3CC3)c3ccc(C)cc3)ccn12 ZINC001462772640 1061355318 /nfs/dbraw/zinc/35/53/18/1061355318.db2.gz BYASFHDQEJQNGP-UHFFFAOYSA-N 1 2 319.408 4.008 20 0 DIADLO Cc1[nH]c(CN2CC=C(c3ccc(Cl)cc3C)CC2)[nH+]c1C ZINC001473696961 1061356061 /nfs/dbraw/zinc/35/60/61/1061356061.db2.gz TWGUSIWFAZRIEH-UHFFFAOYSA-N 1 2 315.848 4.278 20 0 DIADLO Cc1nc(C[N@H+]2CC=C(c3ccc(Cl)cc3C)CC2)[nH]c1C ZINC001473696961 1061356082 /nfs/dbraw/zinc/35/60/82/1061356082.db2.gz TWGUSIWFAZRIEH-UHFFFAOYSA-N 1 2 315.848 4.278 20 0 DIADLO Cc1nc(C[N@@H+]2CC=C(c3ccc(Cl)cc3C)CC2)[nH]c1C ZINC001473696961 1061356105 /nfs/dbraw/zinc/35/61/05/1061356105.db2.gz TWGUSIWFAZRIEH-UHFFFAOYSA-N 1 2 315.848 4.278 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@H](C(=O)OC(C)(C)C)C2CC2)C(C)C)c1 ZINC001473702966 1061358614 /nfs/dbraw/zinc/35/86/14/1061358614.db2.gz VCNPELCIBGAZED-MSOLQXFVSA-N 1 2 317.473 4.402 20 0 DIADLO Cc1nc2cc(-c3[nH]c4ccc(N(C)C)cc4[nH+]3)ccc2s1 ZINC001251452254 1061364364 /nfs/dbraw/zinc/36/43/64/1061364364.db2.gz HVMHVFMJJXSFQK-UHFFFAOYSA-N 1 2 308.410 4.214 20 0 DIADLO CO[C@H]1CC[C@H](C)[N@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001473713741 1061365193 /nfs/dbraw/zinc/36/51/93/1061365193.db2.gz XDPASIVAQGBTRP-CABZTGNLSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[C@H](C)[N@@H+](Cc2cc(Cl)cc(Cl)c2F)C1 ZINC001473713741 1061365209 /nfs/dbraw/zinc/36/52/09/1061365209.db2.gz XDPASIVAQGBTRP-CABZTGNLSA-N 1 2 306.208 4.132 20 0 DIADLO CC(C)(C)OC(=O)C[NH2+][C@@H]1CCC(C)(C)C[C@@H]1c1ccccc1 ZINC001473743371 1061382563 /nfs/dbraw/zinc/38/25/63/1061382563.db2.gz RPUBRQITPBWJKH-IAGOWNOFSA-N 1 2 317.473 4.280 20 0 DIADLO C[C@H](C[N@H+](C)Cc1ncsc1Br)C(C)(C)C ZINC001473779535 1061405737 /nfs/dbraw/zinc/40/57/37/1061405737.db2.gz PNTOATDQCXAORC-SECBINFHSA-N 1 2 305.285 4.020 20 0 DIADLO C[C@H](C[N@@H+](C)Cc1ncsc1Br)C(C)(C)C ZINC001473779535 1061405743 /nfs/dbraw/zinc/40/57/43/1061405743.db2.gz PNTOATDQCXAORC-SECBINFHSA-N 1 2 305.285 4.020 20 0 DIADLO CC(C)C1=[NH+]CCc2ccc(-c3nc4ccc(F)cc4[nH]3)cc21 ZINC001251674180 1061437932 /nfs/dbraw/zinc/43/79/32/1061437932.db2.gz NEEVDSGKFJCINL-UHFFFAOYSA-N 1 2 307.372 4.370 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccccc3C3CCOCC3)[nH+]c2c1 ZINC001251677322 1061440801 /nfs/dbraw/zinc/44/08/01/1061440801.db2.gz COHGYTXVZMGHEG-UHFFFAOYSA-N 1 2 321.424 4.190 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@@H+](Cc1nc3ccccc3n1C)C2 ZINC001473905587 1061456926 /nfs/dbraw/zinc/45/69/26/1061456926.db2.gz SLBNKSVSIZOGHP-UHFFFAOYSA-N 1 2 319.452 4.255 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@H+](Cc1nc3ccccc3n1C)C2 ZINC001473905587 1061456931 /nfs/dbraw/zinc/45/69/31/1061456931.db2.gz SLBNKSVSIZOGHP-UHFFFAOYSA-N 1 2 319.452 4.255 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc(OC(C)C)cc3C)n2c1 ZINC001473943945 1061487329 /nfs/dbraw/zinc/48/73/29/1061487329.db2.gz ZSIYTSZNJBIXNM-UHFFFAOYSA-N 1 2 309.413 4.350 20 0 DIADLO Fc1cc2[nH]c(-c3cccc4c3CCC4)nc2cc1-n1cc[nH+]c1 ZINC001251822288 1061501208 /nfs/dbraw/zinc/50/12/08/1061501208.db2.gz FGYRRBBZBBPKTQ-UHFFFAOYSA-N 1 2 318.355 4.043 20 0 DIADLO CCC[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccccn1 ZINC001473982568 1061526386 /nfs/dbraw/zinc/52/63/86/1061526386.db2.gz UPRKMXIYDBUHGR-KRWDZBQOSA-N 1 2 307.397 4.368 20 0 DIADLO CCN(CCCNc1cc(C)[nH+]c(C2CCC2)n1)c1ccccc1 ZINC001458067502 1061555740 /nfs/dbraw/zinc/55/57/40/1061555740.db2.gz HNCWIEJIWBPJEV-UHFFFAOYSA-N 1 2 324.472 4.381 20 0 DIADLO Cc1cc(CNC(=O)N[C@H]2CCCC[C@H]2C(C)(C)C)cc(C)[nH+]1 ZINC001252017687 1061555975 /nfs/dbraw/zinc/55/59/75/1061555975.db2.gz KENVJOCYAYWPSA-SJORKVTESA-N 1 2 317.477 4.103 20 0 DIADLO Cc1cc(CNC(=O)N[C@@H]2CCCC[C@H]2C(C)(C)C)cc(C)[nH+]1 ZINC001252017685 1061557211 /nfs/dbraw/zinc/55/72/11/1061557211.db2.gz KENVJOCYAYWPSA-IAGOWNOFSA-N 1 2 317.477 4.103 20 0 DIADLO Cc1cccc(OC[C@H](C)Nc2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC001458132904 1061587998 /nfs/dbraw/zinc/58/79/98/1061587998.db2.gz BDCMRCRJYCNYRA-HNNXBMFYSA-N 1 2 311.429 4.240 20 0 DIADLO C/C(=C/c1ccco1)C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC001464460795 1061598168 /nfs/dbraw/zinc/59/81/68/1061598168.db2.gz VKIOZDVPSSCOCE-BENRWUELSA-N 1 2 321.380 4.329 20 0 DIADLO CCc1c[nH]c2ncnc(Nc3ccc(NC4CCCC4)[nH+]c3)c12 ZINC001458146133 1061599052 /nfs/dbraw/zinc/59/90/52/1061599052.db2.gz KMVPONFSYIGFJW-UHFFFAOYSA-N 1 2 322.416 4.013 20 0 DIADLO C/C(=C\c1ccc(Cl)cc1)CNc1ccc(N(C)C)c[nH+]1 ZINC001474052973 1061601069 /nfs/dbraw/zinc/60/10/69/1061601069.db2.gz AUZVKFPFLUSJCV-JLHYYAGUSA-N 1 2 301.821 4.316 20 0 DIADLO Cc1ccc(-c2ccc(CNc3ccc(N(C)C)c[nH+]3)o2)cc1 ZINC001474053192 1061601163 /nfs/dbraw/zinc/60/11/63/1061601163.db2.gz MOZINKXGOMHUOZ-UHFFFAOYSA-N 1 2 307.397 4.328 20 0 DIADLO Clc1cncnc1Nc1ccc([NH2+]CC2CCCC2)cc1 ZINC001458152698 1061601759 /nfs/dbraw/zinc/60/17/59/1061601759.db2.gz AIOULSXIPJKDTI-UHFFFAOYSA-N 1 2 302.809 4.476 20 0 DIADLO CC[C@@H](Nc1cc(C)[nH+]c(C2CCC2)n1)c1nc2ccccc2[nH]1 ZINC001458157573 1061605044 /nfs/dbraw/zinc/60/50/44/1061605044.db2.gz PSPSGPGENLJUGI-CQSZACIVSA-N 1 2 321.428 4.492 20 0 DIADLO Fc1cc(NCc2cccc3ncccc23)ccc1-n1cc[nH+]c1 ZINC001474058929 1061606121 /nfs/dbraw/zinc/60/61/21/1061606121.db2.gz ZBMACTBRKMRGLL-UHFFFAOYSA-N 1 2 318.355 4.172 20 0 DIADLO CCOc1cc(C)ccc1C[NH2+]Cc1c(F)cc(C)cc1F ZINC001474066827 1061613155 /nfs/dbraw/zinc/61/31/55/1061613155.db2.gz PFWNZLIUDTYCRY-UHFFFAOYSA-N 1 2 305.368 4.270 20 0 DIADLO Cc1cc(N(C)[C@H](C)Cc2ccc(Cl)cc2)nc(C2CC2)[nH+]1 ZINC001458177777 1061613179 /nfs/dbraw/zinc/61/31/79/1061613179.db2.gz GPCXTKNWAIANCW-CYBMUJFWSA-N 1 2 315.848 4.383 20 0 DIADLO COc1cc[nH+]cc1NCc1cc(Cl)cc(Cl)c1OC ZINC001474079738 1061626320 /nfs/dbraw/zinc/62/63/20/1061626320.db2.gz DCWVZJPSEVJVRI-UHFFFAOYSA-N 1 2 313.184 4.018 20 0 DIADLO CCS[C@@H]1CC[C@H](N(C)c2cc(C)[nH+]c(C3CCC3)n2)C1 ZINC001458202227 1061628409 /nfs/dbraw/zinc/62/84/09/1061628409.db2.gz ANZLLBXPVORADK-LSDHHAIUSA-N 1 2 305.491 4.163 20 0 DIADLO CCCc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)cc1 ZINC001464825258 1061636483 /nfs/dbraw/zinc/63/64/83/1061636483.db2.gz JUNYSURXNWZCGW-UHFFFAOYSA-N 1 2 319.408 4.386 20 0 DIADLO CCc1cc(NC[C@H](OC)c2ccc(Cl)cc2)nc(CC)[nH+]1 ZINC001458214317 1061636953 /nfs/dbraw/zinc/63/69/53/1061636953.db2.gz YWMTTYCXMPCJFS-HNNXBMFYSA-N 1 2 319.836 4.054 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]23)c(N(C)C)[nH+]1 ZINC001458216877 1061639072 /nfs/dbraw/zinc/63/90/72/1061639072.db2.gz PXOINUNEZGKAIQ-ARFHVFGLSA-N 1 2 315.461 4.001 20 0 DIADLO COc1ccc(NCc2cc(C)[nH+]c(C)c2)cc1OC(C)C ZINC001474102236 1061647736 /nfs/dbraw/zinc/64/77/36/1061647736.db2.gz GFMKWZKACQEGSN-UHFFFAOYSA-N 1 2 300.402 4.106 20 0 DIADLO CCc1cc(NCCc2c(F)cccc2Cl)nc(CC)[nH+]1 ZINC001458236648 1061653724 /nfs/dbraw/zinc/65/37/24/1061653724.db2.gz HYJZYNQLOUJXNN-UHFFFAOYSA-N 1 2 307.800 4.049 20 0 DIADLO CCc1cc(NC[C@@H](OC)c2ccccc2Cl)nc(CC)[nH+]1 ZINC001458237370 1061654145 /nfs/dbraw/zinc/65/41/45/1061654145.db2.gz LOCSPZJLXNSERM-OAHLLOKOSA-N 1 2 319.836 4.054 20 0 DIADLO Cc1nsc(Nc2ccc([N@H+]3CCCC[C@H]3C)cc2C)n1 ZINC001458258267 1061662766 /nfs/dbraw/zinc/66/27/66/1061662766.db2.gz DVIMBEPMPLBNER-GFCCVEGCSA-N 1 2 302.447 4.277 20 0 DIADLO Cc1nsc(Nc2ccc([N@@H+]3CCCC[C@H]3C)cc2C)n1 ZINC001458258267 1061662777 /nfs/dbraw/zinc/66/27/77/1061662777.db2.gz DVIMBEPMPLBNER-GFCCVEGCSA-N 1 2 302.447 4.277 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NC/C=C/c1ccc(F)cc1F ZINC001474115521 1061663532 /nfs/dbraw/zinc/66/35/32/1061663532.db2.gz MGTCAWUJBZVNQP-HWKANZROSA-N 1 2 304.340 4.272 20 0 DIADLO Cc1cccc([C@@H](O)CNc2cc(C(C)C)[nH+]c(C(C)C)n2)c1 ZINC001458259738 1061664837 /nfs/dbraw/zinc/66/48/37/1061664837.db2.gz IXRWFNDZLDOLBX-KRWDZBQOSA-N 1 2 313.445 4.177 20 0 DIADLO COC1(CNc2cc(C)[nH+]c(C3CCC3)n2)CCC(C)CC1 ZINC001458352459 1061715775 /nfs/dbraw/zinc/71/57/75/1061715775.db2.gz DAXVDJJGKFSNFC-UHFFFAOYSA-N 1 2 303.450 4.060 20 0 DIADLO CCC[C@H](Nc1[nH+]cnc2c1cnn2C(C)(C)C)C(C)(C)C ZINC001458378831 1061731273 /nfs/dbraw/zinc/73/12/73/1061731273.db2.gz BLEKGZKVKOZKTM-ZDUSSCGKSA-N 1 2 303.454 4.208 20 0 DIADLO Cc1cc(NC[C@@H]2CSc3ccccc32)nc(C2CCC2)[nH+]1 ZINC001458400346 1061739762 /nfs/dbraw/zinc/73/97/62/1061739762.db2.gz PMNZXYNJYYAQIE-CQSZACIVSA-N 1 2 311.454 4.354 20 0 DIADLO F[C@H]1CCCC[C@H]1[NH2+]Cc1csc(COc2ccccc2)n1 ZINC001474228573 1061790283 /nfs/dbraw/zinc/79/02/83/1061790283.db2.gz JAXAXANZRFQZAH-JKSUJKDBSA-N 1 2 320.433 4.092 20 0 DIADLO CC[C@H](C)Oc1cccc(NCc2ccc(-n3cc[nH+]c3)cc2)n1 ZINC001474243051 1061804469 /nfs/dbraw/zinc/80/44/69/1061804469.db2.gz WSKBWZOWCNQNDR-HNNXBMFYSA-N 1 2 322.412 4.057 20 0 DIADLO CCOc1ccc(CNc2[nH+]cccc2CSCC)cc1 ZINC001474245221 1061812171 /nfs/dbraw/zinc/81/21/71/1061812171.db2.gz MJVPYRLFXNRCKA-UHFFFAOYSA-N 1 2 302.443 4.346 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1cc(F)cc(OC)c1 ZINC001474245996 1061813220 /nfs/dbraw/zinc/81/32/20/1061813220.db2.gz WUTOQICKPWEOGG-UHFFFAOYSA-N 1 2 306.406 4.095 20 0 DIADLO Cc1cccc(CNc2c[nH+]c(C)c(C)c2)c1Br ZINC001474249920 1061815319 /nfs/dbraw/zinc/81/53/19/1061815319.db2.gz XZUPHVDCBYWSFU-UHFFFAOYSA-N 1 2 305.219 4.381 20 0 DIADLO COc1ccc(CC[C@@H](C)Nc2[nH]c3cc(C)ccc3[nH+]2)cc1 ZINC001474248107 1061816144 /nfs/dbraw/zinc/81/61/44/1061816144.db2.gz HENJIVXLOLFHLY-CQSZACIVSA-N 1 2 309.413 4.313 20 0 DIADLO Cc1cc(N[C@H]2c3ccccc3CC[C@H]2F)nc(C2CCC2)[nH+]1 ZINC001458550052 1061832175 /nfs/dbraw/zinc/83/21/75/1061832175.db2.gz QZDQQFJRRLCJEI-AEFFLSMTSA-N 1 2 311.404 4.490 20 0 DIADLO F[C@@H]1COc2ccccc2[C@@H]1[NH2+]Cc1csc2ccccc12 ZINC001474266836 1061833877 /nfs/dbraw/zinc/83/38/77/1061833877.db2.gz ZYVVLXIHVQKEPY-QAPCUYQASA-N 1 2 313.397 4.463 20 0 DIADLO Cc1cc(NCC2C[C@H]3CC[C@@H](C2)S3)nc(C2CCC2)[nH+]1 ZINC001458594806 1061850192 /nfs/dbraw/zinc/85/01/92/1061850192.db2.gz UCIPAQGLHBYHKM-LQDVMPOASA-N 1 2 303.475 4.139 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc(-c3ccc[nH]3)cc2)cc(C)[nH+]1 ZINC001466032247 1061863416 /nfs/dbraw/zinc/86/34/16/1061863416.db2.gz SLHCVOJDBJNUES-UHFFFAOYSA-N 1 2 320.396 4.015 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cccc(Cl)c1N ZINC001474301769 1061870370 /nfs/dbraw/zinc/87/03/70/1061870370.db2.gz OZWNTXCALUGQAC-UHFFFAOYSA-N 1 2 318.783 4.043 20 0 DIADLO CCc1cccc2cc(C[NH2+][C@@H](c3nc(C)no3)C(C)C)oc21 ZINC001474306524 1061872833 /nfs/dbraw/zinc/87/28/33/1061872833.db2.gz DUVYHADEHMTPMS-MRXNPFEDSA-N 1 2 313.401 4.174 20 0 DIADLO CC(C)c1cc(N[C@H]2CCOCC23CCCC3)nc(C(C)C)[nH+]1 ZINC001458712432 1061879425 /nfs/dbraw/zinc/87/94/25/1061879425.db2.gz VFBNCRNBFWCMDG-INIZCTEOSA-N 1 2 317.477 4.485 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC001474323968 1061909190 /nfs/dbraw/zinc/90/91/90/1061909190.db2.gz JTZNUITWIOCJSX-DOMZBBRYSA-N 1 2 321.827 4.279 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC001474323968 1061909216 /nfs/dbraw/zinc/90/92/16/1061909216.db2.gz JTZNUITWIOCJSX-DOMZBBRYSA-N 1 2 321.827 4.279 20 0 DIADLO CCCCC[C@H](O)CNc1cc(-c2cccc(F)c2)cc[nH+]1 ZINC001253521091 1061912895 /nfs/dbraw/zinc/91/28/95/1061912895.db2.gz OWDHUPOPKRRECX-KRWDZBQOSA-N 1 2 302.393 4.241 20 0 DIADLO Cc1scc(C[N@@H+]2CCO[C@H](c3ccccc3F)C2)c1C ZINC001474343662 1061946494 /nfs/dbraw/zinc/94/64/94/1061946494.db2.gz RAIJRCBPILCFAI-KRWDZBQOSA-N 1 2 305.418 4.078 20 0 DIADLO Cc1scc(C[N@H+]2CCO[C@H](c3ccccc3F)C2)c1C ZINC001474343662 1061946503 /nfs/dbraw/zinc/94/65/03/1061946503.db2.gz RAIJRCBPILCFAI-KRWDZBQOSA-N 1 2 305.418 4.078 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2ccc3occc3c2)c(C)[nH+]1 ZINC001466756842 1061998988 /nfs/dbraw/zinc/99/89/88/1061998988.db2.gz YDLDSQLQXGWGFX-UHFFFAOYSA-N 1 2 309.369 4.075 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H]2CC[C@H](Cc3ccccc3)C2)c(C)[nH+]1 ZINC001459168838 1062033144 /nfs/dbraw/zinc/03/31/44/1062033144.db2.gz ZBLRYDZWXLTGKJ-MOPGFXCFSA-N 1 2 322.452 4.148 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@H](C)[C@@H](F)C2)c(C)c1Br ZINC001474393427 1062050157 /nfs/dbraw/zinc/05/01/57/1062050157.db2.gz QIZFEZBKWAKAMR-HZMBPMFUSA-N 1 2 314.242 4.246 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)c(C)c1Br ZINC001474393427 1062050177 /nfs/dbraw/zinc/05/01/77/1062050177.db2.gz QIZFEZBKWAKAMR-HZMBPMFUSA-N 1 2 314.242 4.246 20 0 DIADLO Cc1ccc(Br)c(F)c1C[N@H+](C)Cc1ccco1 ZINC001474398436 1062054541 /nfs/dbraw/zinc/05/45/41/1062054541.db2.gz SNBOWTYDSZVHIQ-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccc(Br)c(F)c1C[N@@H+](C)Cc1ccco1 ZINC001474398436 1062054551 /nfs/dbraw/zinc/05/45/51/1062054551.db2.gz SNBOWTYDSZVHIQ-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO COc1cc(C)[nH+]c(CSc2nc3ccc(F)cc3s2)c1 ZINC001459251936 1062058845 /nfs/dbraw/zinc/05/88/45/1062058845.db2.gz ORZPCMDWAOQNEK-UHFFFAOYSA-N 1 2 320.414 4.440 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](C)Cc1nc(Br)cs1 ZINC001474410246 1062071522 /nfs/dbraw/zinc/07/15/22/1062071522.db2.gz OMUCIOGVPNVLHN-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1nc(Br)cs1 ZINC001474410246 1062071542 /nfs/dbraw/zinc/07/15/42/1062071542.db2.gz OMUCIOGVPNVLHN-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO COc1ccccc1Cc1cn(CCSC(C)(C)C)c[nH+]1 ZINC001459298935 1062073841 /nfs/dbraw/zinc/07/38/41/1062073841.db2.gz AVNCKVYBVVEDMH-UHFFFAOYSA-N 1 2 304.459 4.014 20 0 DIADLO CC(C)COC(=O)C[N@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC001459356486 1062110322 /nfs/dbraw/zinc/11/03/22/1062110322.db2.gz JKJIIWUVINMMTO-UHFFFAOYSA-N 1 2 311.425 4.003 20 0 DIADLO CC(C)COC(=O)C[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC001459356486 1062110331 /nfs/dbraw/zinc/11/03/31/1062110331.db2.gz JKJIIWUVINMMTO-UHFFFAOYSA-N 1 2 311.425 4.003 20 0 DIADLO COCC[N@H+](Cc1nc(C(C)(C)C)co1)[C@@H](C)c1ccccc1 ZINC001459379988 1062121689 /nfs/dbraw/zinc/12/16/89/1062121689.db2.gz RMXKIDQISNPVLU-HNNXBMFYSA-N 1 2 316.445 4.182 20 0 DIADLO COCC[N@@H+](Cc1nc(C(C)(C)C)co1)[C@@H](C)c1ccccc1 ZINC001459379988 1062121703 /nfs/dbraw/zinc/12/17/03/1062121703.db2.gz RMXKIDQISNPVLU-HNNXBMFYSA-N 1 2 316.445 4.182 20 0 DIADLO CC[N@H+](Cc1cc(C)co1)Cc1ccccc1Br ZINC001474470184 1062148808 /nfs/dbraw/zinc/14/88/08/1062148808.db2.gz BFXQEVHJKRHSFJ-UHFFFAOYSA-N 1 2 308.219 4.373 20 0 DIADLO CC[N@@H+](Cc1cc(C)co1)Cc1ccccc1Br ZINC001474470184 1062148823 /nfs/dbraw/zinc/14/88/23/1062148823.db2.gz BFXQEVHJKRHSFJ-UHFFFAOYSA-N 1 2 308.219 4.373 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2cccc(O)c2Cl)C1 ZINC001474473009 1062150351 /nfs/dbraw/zinc/15/03/51/1062150351.db2.gz JBCKKUZPRGSERE-GOSISDBHSA-N 1 2 319.807 4.425 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2cccc(O)c2Cl)C1 ZINC001474473009 1062150365 /nfs/dbraw/zinc/15/03/65/1062150365.db2.gz JBCKKUZPRGSERE-GOSISDBHSA-N 1 2 319.807 4.425 20 0 DIADLO Cc1ccc2c(ccc(C)c2C[N@@H+]2CCO[C@H](C(F)(F)F)C2)c1 ZINC001459524161 1062182364 /nfs/dbraw/zinc/18/23/64/1062182364.db2.gz BZFGSYCEPRWECK-KRWDZBQOSA-N 1 2 323.358 4.220 20 0 DIADLO Cc1ccc2c(ccc(C)c2C[N@H+]2CCO[C@H](C(F)(F)F)C2)c1 ZINC001459524161 1062182375 /nfs/dbraw/zinc/18/23/75/1062182375.db2.gz BZFGSYCEPRWECK-KRWDZBQOSA-N 1 2 323.358 4.220 20 0 DIADLO Clc1ccnc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c1Cl ZINC001459602342 1062239520 /nfs/dbraw/zinc/23/95/20/1062239520.db2.gz LRXLDJJBYVDXMI-STQMWFEESA-N 1 2 317.285 4.248 20 0 DIADLO Clc1ccc([C@@H]2CC[N@@H+]2Cc2cnn(CC3CCC3)c2)cc1 ZINC001474516233 1062202496 /nfs/dbraw/zinc/20/24/96/1062202496.db2.gz BOQCIPLBXDYNAF-SFHVURJKSA-N 1 2 315.848 4.284 20 0 DIADLO Clc1ccc([C@@H]2CC[N@H+]2Cc2cnn(CC3CCC3)c2)cc1 ZINC001474516233 1062202519 /nfs/dbraw/zinc/20/25/19/1062202519.db2.gz BOQCIPLBXDYNAF-SFHVURJKSA-N 1 2 315.848 4.284 20 0 DIADLO CC(C)[C@H]1C[N@H+](Cc2ncc(Br)s2)[C@H]1C(C)C ZINC001474521654 1062204078 /nfs/dbraw/zinc/20/40/78/1062204078.db2.gz OHYVVCQZQPNVQW-MFKMUULPSA-N 1 2 317.296 4.018 20 0 DIADLO CC(C)[C@H]1C[N@@H+](Cc2ncc(Br)s2)[C@H]1C(C)C ZINC001474521654 1062204096 /nfs/dbraw/zinc/20/40/96/1062204096.db2.gz OHYVVCQZQPNVQW-MFKMUULPSA-N 1 2 317.296 4.018 20 0 DIADLO Cc1cc(Cl)c(NC2CCN(c3cccc[nH+]3)CC2)cc1C ZINC001474537063 1062227220 /nfs/dbraw/zinc/22/72/20/1062227220.db2.gz GYGKZCHAMCKEFQ-UHFFFAOYSA-N 1 2 315.848 4.433 20 0 DIADLO Clc1ccnc(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)c1Cl ZINC001459602342 1062239505 /nfs/dbraw/zinc/23/95/05/1062239505.db2.gz LRXLDJJBYVDXMI-STQMWFEESA-N 1 2 317.285 4.248 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Br)cc2C(F)(F)F)[C@H]1C ZINC001474549842 1062245705 /nfs/dbraw/zinc/24/57/05/1062245705.db2.gz LBOJIVOCTWUVMH-BDAKNGLRSA-N 1 2 322.168 4.308 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Br)cc2C(F)(F)F)[C@H]1C ZINC001474549842 1062245731 /nfs/dbraw/zinc/24/57/31/1062245731.db2.gz LBOJIVOCTWUVMH-BDAKNGLRSA-N 1 2 322.168 4.308 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@@H+]1CCc3c(F)ccc(F)c3C1)CC2 ZINC001459613109 1062248182 /nfs/dbraw/zinc/24/81/82/1062248182.db2.gz KGCJPBLRYLAGCJ-SFHVURJKSA-N 1 2 303.327 4.150 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([N@H+]1CCc3c(F)ccc(F)c3C1)CC2 ZINC001459613109 1062248203 /nfs/dbraw/zinc/24/82/03/1062248203.db2.gz KGCJPBLRYLAGCJ-SFHVURJKSA-N 1 2 303.327 4.150 20 0 DIADLO Cc1[nH+]cn(-c2ccc(NCC3CCSCC3)cc2)c1C ZINC001474553046 1062251624 /nfs/dbraw/zinc/25/16/24/1062251624.db2.gz VEUREMIXLFQMFL-UHFFFAOYSA-N 1 2 301.459 4.044 20 0 DIADLO CC(C)c1ccc(-c2nnc([C@@H]3CCCc4[nH]c[nH+]c43)o2)cc1 ZINC001254842304 1062262145 /nfs/dbraw/zinc/26/21/45/1062262145.db2.gz CMFSBVQWTZVEIN-CQSZACIVSA-N 1 2 308.385 4.051 20 0 DIADLO CC(C)c1ccc(-c2nnc(Cc3c[nH+]c4ccccn34)o2)cc1 ZINC001254858424 1062266407 /nfs/dbraw/zinc/26/64/07/1062266407.db2.gz SOFRRCSJNLPTGQ-UHFFFAOYSA-N 1 2 318.380 4.099 20 0 DIADLO Clc1cc(CN2CCn3c[nH+]cc3C2)ccc1-c1ccccc1 ZINC001474563101 1062268987 /nfs/dbraw/zinc/26/89/87/1062268987.db2.gz ZESSOPCTFWOWLJ-UHFFFAOYSA-N 1 2 323.827 4.219 20 0 DIADLO CCC1(CC)CC[N@@H+]([C@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001459650120 1062274712 /nfs/dbraw/zinc/27/47/12/1062274712.db2.gz NXWCYYGDXZNPCA-HNNXBMFYSA-N 1 2 309.837 4.066 20 0 DIADLO CCC1(CC)CC[N@H+]([C@H](C(=O)OC)c2ccc(Cl)cc2)C1 ZINC001459650120 1062274720 /nfs/dbraw/zinc/27/47/20/1062274720.db2.gz NXWCYYGDXZNPCA-HNNXBMFYSA-N 1 2 309.837 4.066 20 0 DIADLO CC(C)Cc1ccc([C@H]([NH2+]Cc2cnsn2)C(C)C)cc1 ZINC001459687819 1062306844 /nfs/dbraw/zinc/30/68/44/1062306844.db2.gz UHHZFAZUBIIACV-QGZVFWFLSA-N 1 2 303.475 4.224 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@@H+]2CCc3nc[nH]c3C23CCC3)cc1C ZINC001474599568 1062311687 /nfs/dbraw/zinc/31/16/87/1062311687.db2.gz XGLALGFYHXWSMU-GQCTYLIASA-N 1 2 321.468 4.286 20 0 DIADLO Cc1cc(C)c(/C=C/C[N@H+]2CCc3nc[nH]c3C23CCC3)cc1C ZINC001474599568 1062311716 /nfs/dbraw/zinc/31/17/16/1062311716.db2.gz XGLALGFYHXWSMU-GQCTYLIASA-N 1 2 321.468 4.286 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3sc(Cl)cc3C2)c(C)c1 ZINC001474598431 1062313600 /nfs/dbraw/zinc/31/36/00/1062313600.db2.gz CMVFKISASQVFRY-UHFFFAOYSA-N 1 2 307.846 4.277 20 0 DIADLO COc1ccc(C[N@H+]2CCc3sc(Cl)cc3C2)c(C)c1 ZINC001474598431 1062313619 /nfs/dbraw/zinc/31/36/19/1062313619.db2.gz CMVFKISASQVFRY-UHFFFAOYSA-N 1 2 307.846 4.277 20 0 DIADLO CC(C)(C)OC(=O)C[N@H+](C/C=C/c1cccc(F)c1)C1CCC1 ZINC001474604525 1062319332 /nfs/dbraw/zinc/31/93/32/1062319332.db2.gz HBEPDDYOWPCHQZ-SOFGYWHQSA-N 1 2 319.420 4.035 20 0 DIADLO CC(C)(C)OC(=O)C[N@@H+](C/C=C/c1cccc(F)c1)C1CCC1 ZINC001474604525 1062319354 /nfs/dbraw/zinc/31/93/54/1062319354.db2.gz HBEPDDYOWPCHQZ-SOFGYWHQSA-N 1 2 319.420 4.035 20 0 DIADLO CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]CC(F)(F)c1cccc(F)c1 ZINC001474618354 1062337913 /nfs/dbraw/zinc/33/79/13/1062337913.db2.gz SLOGJEXETUXLDU-CXAGYDPISA-N 1 2 323.358 4.283 20 0 DIADLO COc1nscc1C[N@H+](C)C1c2ccccc2-c2ccccc21 ZINC001459733863 1062348904 /nfs/dbraw/zinc/34/89/04/1062348904.db2.gz YZXZFNKAKRKWIV-UHFFFAOYSA-N 1 2 322.433 4.354 20 0 DIADLO COc1nscc1C[N@@H+](C)C1c2ccccc2-c2ccccc21 ZINC001459733863 1062348921 /nfs/dbraw/zinc/34/89/21/1062348921.db2.gz YZXZFNKAKRKWIV-UHFFFAOYSA-N 1 2 322.433 4.354 20 0 DIADLO CCC[C@@H]1CCC[N@@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001459738492 1062350436 /nfs/dbraw/zinc/35/04/36/1062350436.db2.gz DOJGNVWLAYRVMC-CJNGLKHVSA-N 1 2 309.837 4.066 20 0 DIADLO CCC[C@@H]1CCC[N@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001459738492 1062350460 /nfs/dbraw/zinc/35/04/60/1062350460.db2.gz DOJGNVWLAYRVMC-CJNGLKHVSA-N 1 2 309.837 4.066 20 0 DIADLO c1n[nH]c([C@H]([NH2+]C2CCC(C3CCC3)CC2)C2CCCCC2)n1 ZINC001474635590 1062360331 /nfs/dbraw/zinc/36/03/31/1062360331.db2.gz BXSSWGNDVYAPMG-VMWRSERWSA-N 1 2 316.493 4.375 20 0 DIADLO CC1(c2ccccc2)C[NH+](Cc2cc(F)ccc2OC(F)F)C1 ZINC001474638593 1062364557 /nfs/dbraw/zinc/36/45/57/1062364557.db2.gz IZGXFNJQKSWMBA-UHFFFAOYSA-N 1 2 321.342 4.201 20 0 DIADLO CCC[C@@H]1C[N@H+](Cc2cccc(SC(F)(F)F)c2)CCO1 ZINC001459764783 1062375676 /nfs/dbraw/zinc/37/56/76/1062375676.db2.gz TYVZTQFBWNHKEL-CYBMUJFWSA-N 1 2 319.392 4.299 20 0 DIADLO CCC[C@@H]1C[N@@H+](Cc2cccc(SC(F)(F)F)c2)CCO1 ZINC001459764783 1062375690 /nfs/dbraw/zinc/37/56/90/1062375690.db2.gz TYVZTQFBWNHKEL-CYBMUJFWSA-N 1 2 319.392 4.299 20 0 DIADLO CCCC[C@H](C)[NH2+][C@H](C(=O)OC(C)(C)C)[C@@H](C)OC(C)(C)C ZINC001255309748 1062387306 /nfs/dbraw/zinc/38/73/06/1062387306.db2.gz KOJSOIZQKGCTLP-ZNMIVQPWSA-N 1 2 315.498 4.069 20 0 DIADLO Oc1cccc2c1CC[N@H+](Cc1ccc(Oc3ccccc3)o1)C2 ZINC001474658168 1062390754 /nfs/dbraw/zinc/39/07/54/1062390754.db2.gz KQMIOQADRHOHCF-UHFFFAOYSA-N 1 2 321.376 4.336 20 0 DIADLO Oc1cccc2c1CC[N@@H+](Cc1ccc(Oc3ccccc3)o1)C2 ZINC001474658168 1062390757 /nfs/dbraw/zinc/39/07/57/1062390757.db2.gz KQMIOQADRHOHCF-UHFFFAOYSA-N 1 2 321.376 4.336 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+](Cc1ccccc1F)C1CCCCC1 ZINC001459786123 1062401142 /nfs/dbraw/zinc/40/11/42/1062401142.db2.gz JZIXPPIGGACJHL-HNNXBMFYSA-N 1 2 321.436 4.302 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+](Cc1ccccc1F)C1CCCCC1 ZINC001459786123 1062401144 /nfs/dbraw/zinc/40/11/44/1062401144.db2.gz JZIXPPIGGACJHL-HNNXBMFYSA-N 1 2 321.436 4.302 20 0 DIADLO CC1(C)CN(Cc2ccc(-n3cc[nH+]c3)cc2)c2ccccc2O1 ZINC001459799286 1062408290 /nfs/dbraw/zinc/40/82/90/1062408290.db2.gz GIYRSYKMTZZSLU-UHFFFAOYSA-N 1 2 319.408 4.050 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2c(F)ccc(O)c2F)s1 ZINC001474698526 1062426216 /nfs/dbraw/zinc/42/62/16/1062426216.db2.gz XMQWSPZLWHWSQB-UHFFFAOYSA-N 1 2 311.397 4.319 20 0 DIADLO FC(F)[C@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1cccc(Cl)c1 ZINC001474707006 1062431828 /nfs/dbraw/zinc/43/18/28/1062431828.db2.gz ODEVXCRDQHJBEZ-ZIAGYGMSSA-N 1 2 315.791 4.338 20 0 DIADLO Cc1nn(C)c(Cl)c1C[NH2+][C@H](C)c1c(F)cccc1Cl ZINC001459834025 1062435854 /nfs/dbraw/zinc/43/58/54/1062435854.db2.gz HKTGGVCTUKWHLD-SECBINFHSA-N 1 2 316.207 4.025 20 0 DIADLO FC(F)c1cccc(C[NH2+]Cc2occc2Br)c1 ZINC001255461666 1062454318 /nfs/dbraw/zinc/45/43/18/1062454318.db2.gz SIQOZWWQJXXKKS-UHFFFAOYSA-N 1 2 316.145 4.270 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@H](Cc3ccccc3)C2)c(Cl)c1 ZINC001459866288 1062457926 /nfs/dbraw/zinc/45/79/26/1062457926.db2.gz DEKYMFXDCIFDJA-SFHVURJKSA-N 1 2 315.844 4.092 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@H](Cc3ccccc3)C2)c(Cl)c1 ZINC001459866288 1062457934 /nfs/dbraw/zinc/45/79/34/1062457934.db2.gz DEKYMFXDCIFDJA-SFHVURJKSA-N 1 2 315.844 4.092 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)nn1)c1cccc(Cl)c1Cl ZINC001459868513 1062459496 /nfs/dbraw/zinc/45/94/96/1062459496.db2.gz JOORNISLNUDJID-MRVPVSSYSA-N 1 2 316.619 4.288 20 0 DIADLO CC1(C)CCc2onc(C[N@@H+]3Cc4ccccc4C(C)(C)C3)c2C1 ZINC001459873463 1062464185 /nfs/dbraw/zinc/46/41/85/1062464185.db2.gz BROQBZJNRBDAGG-UHFFFAOYSA-N 1 2 324.468 4.483 20 0 DIADLO CC1(C)CCc2onc(C[N@H+]3Cc4ccccc4C(C)(C)C3)c2C1 ZINC001459873463 1062464204 /nfs/dbraw/zinc/46/42/04/1062464204.db2.gz BROQBZJNRBDAGG-UHFFFAOYSA-N 1 2 324.468 4.483 20 0 DIADLO Cn1c(C[N@@H+]2CCc3cc(F)cc(F)c3C2)cc2ccccc21 ZINC001474759510 1062465546 /nfs/dbraw/zinc/46/55/46/1062465546.db2.gz OCYNKSPMCYYCAN-UHFFFAOYSA-N 1 2 312.363 4.015 20 0 DIADLO Cn1c(C[N@H+]2CCc3cc(F)cc(F)c3C2)cc2ccccc21 ZINC001474759510 1062465558 /nfs/dbraw/zinc/46/55/58/1062465558.db2.gz OCYNKSPMCYYCAN-UHFFFAOYSA-N 1 2 312.363 4.015 20 0 DIADLO C[C@H](CC(F)(F)F)[N@@H+]1CCc2c(Br)cccc2C1 ZINC001255655308 1062498351 /nfs/dbraw/zinc/49/83/51/1062498351.db2.gz JRLJHOMSSFGKKT-SECBINFHSA-N 1 2 322.168 4.148 20 0 DIADLO C[C@H](CC(F)(F)F)[N@H+]1CCc2c(Br)cccc2C1 ZINC001255655308 1062498358 /nfs/dbraw/zinc/49/83/58/1062498358.db2.gz JRLJHOMSSFGKKT-SECBINFHSA-N 1 2 322.168 4.148 20 0 DIADLO CC(C)C[C@H](C(=O)N(C)[C@H]1CCC[C@@H]1C(C)(C)C)n1cc[nH+]c1 ZINC001469154399 1062489094 /nfs/dbraw/zinc/48/90/94/1062489094.db2.gz WKXRSJBERAPENR-YESZJQIVSA-N 1 2 319.493 4.144 20 0 DIADLO CCNc1nc(C[NH2+][C@H](C)c2oc3ccccc3c2C)cs1 ZINC001459908924 1062489676 /nfs/dbraw/zinc/48/96/76/1062489676.db2.gz XYQBXQOSULCNFS-GFCCVEGCSA-N 1 2 315.442 4.480 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)[C@@H](C)CC(F)(F)F)on1 ZINC001255660536 1062500763 /nfs/dbraw/zinc/50/07/63/1062500763.db2.gz IQYAGOANWQDLGG-ZDUSSCGKSA-N 1 2 312.335 4.326 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)[C@@H](C)CC(F)(F)F)on1 ZINC001255660536 1062500786 /nfs/dbraw/zinc/50/07/86/1062500786.db2.gz IQYAGOANWQDLGG-ZDUSSCGKSA-N 1 2 312.335 4.326 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)[C@H](C)CC(F)(F)F)on1 ZINC001255660533 1062502468 /nfs/dbraw/zinc/50/24/68/1062502468.db2.gz IQYAGOANWQDLGG-CYBMUJFWSA-N 1 2 312.335 4.326 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)[C@H](C)CC(F)(F)F)on1 ZINC001255660533 1062502478 /nfs/dbraw/zinc/50/24/78/1062502478.db2.gz IQYAGOANWQDLGG-CYBMUJFWSA-N 1 2 312.335 4.326 20 0 DIADLO Cn1cc([C@@H]([NH2+]Cc2ccsc2Cl)c2ccccc2)cn1 ZINC001255690418 1062518869 /nfs/dbraw/zinc/51/88/69/1062518869.db2.gz SVBHEGXDKONKIA-HNNXBMFYSA-N 1 2 317.845 4.014 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2c(F)cccc2F)C1 ZINC001460015015 1062570025 /nfs/dbraw/zinc/57/00/25/1062570025.db2.gz SJWDYRNOJJLYFP-GOSISDBHSA-N 1 2 305.343 4.344 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2c(F)cccc2F)C1 ZINC001460015015 1062570042 /nfs/dbraw/zinc/57/00/42/1062570042.db2.gz SJWDYRNOJJLYFP-GOSISDBHSA-N 1 2 305.343 4.344 20 0 DIADLO C[C@H]1CC[C@H](C(=O)Oc2ccc(-c3[nH+]cc4n3CCCC4)cc2)C1 ZINC001460019272 1062574907 /nfs/dbraw/zinc/57/49/07/1062574907.db2.gz ZFHFKSLBXIXSSG-HOCLYGCPSA-N 1 2 324.424 4.228 20 0 DIADLO CCCOc1cccc(C[N@@H+]2CCC(C)=C(Br)C2)c1 ZINC001460029692 1062585332 /nfs/dbraw/zinc/58/53/32/1062585332.db2.gz QOLWJEHSRSBWCQ-UHFFFAOYSA-N 1 2 324.262 4.350 20 0 DIADLO CCCOc1cccc(C[N@H+]2CCC(C)=C(Br)C2)c1 ZINC001460029692 1062585355 /nfs/dbraw/zinc/58/53/55/1062585355.db2.gz QOLWJEHSRSBWCQ-UHFFFAOYSA-N 1 2 324.262 4.350 20 0 DIADLO Cc1ccc2sc(C[N@@H+]3CCOc4ccc(C)cc4C3)nc2c1 ZINC001460083926 1062624549 /nfs/dbraw/zinc/62/45/49/1062624549.db2.gz KQAPBHFIWYYCOS-UHFFFAOYSA-N 1 2 324.449 4.308 20 0 DIADLO Cc1ccc2sc(C[N@H+]3CCOc4ccc(C)cc4C3)nc2c1 ZINC001460083926 1062624564 /nfs/dbraw/zinc/62/45/64/1062624564.db2.gz KQAPBHFIWYYCOS-UHFFFAOYSA-N 1 2 324.449 4.308 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC001460201474 1062695861 /nfs/dbraw/zinc/69/58/61/1062695861.db2.gz HUMKBFNKDZHXJI-RDJZCZTQSA-N 1 2 315.457 4.334 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC001460201474 1062695869 /nfs/dbraw/zinc/69/58/69/1062695869.db2.gz HUMKBFNKDZHXJI-RDJZCZTQSA-N 1 2 315.457 4.334 20 0 DIADLO O=C(C[NH2+][C@H]1CCC[C@H](c2ccccc2)C1)OCc1ccccc1 ZINC001256106178 1062704426 /nfs/dbraw/zinc/70/44/26/1062704426.db2.gz FFWKRCZQJITNMH-PMACEKPBSA-N 1 2 323.436 4.046 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@H](C2CCC2)C2CCCC2)c(C)[nH+]1 ZINC001476697689 1062704941 /nfs/dbraw/zinc/70/49/41/1062704941.db2.gz GLNHHZMYIVEXDY-SFHVURJKSA-N 1 2 315.461 4.487 20 0 DIADLO C[N@@H+](Cc1noc(C2CC2)n1)CC1CCC(C(C)(C)C)CC1 ZINC001460226340 1062711987 /nfs/dbraw/zinc/71/19/87/1062711987.db2.gz WWOWBVPTTAYQQZ-UHFFFAOYSA-N 1 2 305.466 4.231 20 0 DIADLO C[N@H+](Cc1noc(C2CC2)n1)CC1CCC(C(C)(C)C)CC1 ZINC001460226340 1062712007 /nfs/dbraw/zinc/71/20/07/1062712007.db2.gz WWOWBVPTTAYQQZ-UHFFFAOYSA-N 1 2 305.466 4.231 20 0 DIADLO CC[N@H+](Cc1occc1C)Cc1cc(C(=O)OC)ccc1Cl ZINC001460260104 1062739639 /nfs/dbraw/zinc/73/96/39/1062739639.db2.gz UNPZGBRJUAQAAH-UHFFFAOYSA-N 1 2 321.804 4.050 20 0 DIADLO CC[N@@H+](Cc1occc1C)Cc1cc(C(=O)OC)ccc1Cl ZINC001460260104 1062739657 /nfs/dbraw/zinc/73/96/57/1062739657.db2.gz UNPZGBRJUAQAAH-UHFFFAOYSA-N 1 2 321.804 4.050 20 0 DIADLO CC(C)CCCCCCNC(=O)Nc1ccc2[nH+]ccn2c1 ZINC001476898088 1062743298 /nfs/dbraw/zinc/74/32/98/1062743298.db2.gz WERAQQWVGIKPOQ-UHFFFAOYSA-N 1 2 302.422 4.062 20 0 DIADLO CCC[C@@](C)(NC(=O)Nc1ccc2[nH+]ccn2c1)c1ccccc1 ZINC001476898461 1062743728 /nfs/dbraw/zinc/74/37/28/1062743728.db2.gz JTBXZZGZQAFSIA-LJQANCHMSA-N 1 2 322.412 4.171 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ncc(Cl)s2)CCc2ccc(F)cc21 ZINC001460335472 1062789627 /nfs/dbraw/zinc/78/96/27/1062789627.db2.gz QJKYLRGQPGBFDA-SNVBAGLBSA-N 1 2 310.825 4.097 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ncc(Cl)s2)CCc2ccc(F)cc21 ZINC001460335472 1062789645 /nfs/dbraw/zinc/78/96/45/1062789645.db2.gz QJKYLRGQPGBFDA-SNVBAGLBSA-N 1 2 310.825 4.097 20 0 DIADLO CCCC(CCC)C(=O)N1CC[NH2+][C@@H](c2ccc(Cl)cc2)C1 ZINC001470636226 1062828265 /nfs/dbraw/zinc/82/82/65/1062828265.db2.gz MDXQIDHCHSPPPN-QGZVFWFLSA-N 1 2 322.880 4.029 20 0 DIADLO Cc1ccc(-c2nnc(-c3cccc(-n4cc[nH+]c4)c3)o2)cc1C ZINC001256595345 1062905165 /nfs/dbraw/zinc/90/51/65/1062905165.db2.gz BAAQCNBPJBRIPC-UHFFFAOYSA-N 1 2 316.364 4.206 20 0 DIADLO CC(C)C[C@@H](C(=O)N(C)C[C@@H](C)C1CCCCC1)n1cc[nH+]c1 ZINC001471014030 1062908851 /nfs/dbraw/zinc/90/88/51/1062908851.db2.gz PEIMKEPZNZNNGO-AEFFLSMTSA-N 1 2 319.493 4.145 20 0 DIADLO C[C@@H]1C[C@H]1c1nnc([C@H](c2ccc(Cl)cc2)[NH+]2CCCC2)o1 ZINC001256681771 1062945852 /nfs/dbraw/zinc/94/58/52/1062945852.db2.gz DJVGLJRZRIKWIX-DFBGVHRSSA-N 1 2 317.820 4.032 20 0 DIADLO Cc1cc(CNC(=O)N[C@@H]2CCC[C@H]2CCC(C)C)cc(C)[nH+]1 ZINC001477774430 1062968984 /nfs/dbraw/zinc/96/89/84/1062968984.db2.gz YVBDYGMWYKTQRM-ZWKOTPCHSA-N 1 2 317.477 4.103 20 0 DIADLO Cc1ccc2[nH+]c(Cc3nnc(CCC4CCCCC4)o3)cn2c1 ZINC001256821611 1063001649 /nfs/dbraw/zinc/00/16/49/1063001649.db2.gz APPZHMQGEYHXTJ-UHFFFAOYSA-N 1 2 324.428 4.129 20 0 DIADLO CCCCC[C@@H](NC(=O)NCc1c[nH+]c(C)cc1C)C(C)(C)C ZINC001477884560 1063007539 /nfs/dbraw/zinc/00/75/39/1063007539.db2.gz YRFZIUWMQQVGOF-QGZVFWFLSA-N 1 2 319.493 4.493 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)CC/C=C/c2ccccc2)[nH+]c1C ZINC001471859694 1063025751 /nfs/dbraw/zinc/02/57/51/1063025751.db2.gz RPQXLXIYCKENLR-PMQIGOLDSA-N 1 2 323.440 4.184 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2C(=O)CCCCCC(C)C)[nH+]c1C ZINC001471859303 1063027754 /nfs/dbraw/zinc/02/77/54/1063027754.db2.gz MEMNQLKDPMWUGD-INIZCTEOSA-N 1 2 305.466 4.297 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)C2CC3(C2)CCCCC3)[nH+]c1C ZINC001471860969 1063027876 /nfs/dbraw/zinc/02/78/76/1063027876.db2.gz UYQHDAQPRVSFMT-MRXNPFEDSA-N 1 2 315.461 4.051 20 0 DIADLO CCc1[nH]c(CNC(=O)c2csc(C3CCCCC3)c2)c[nH+]1 ZINC001472020131 1063043477 /nfs/dbraw/zinc/04/34/77/1063043477.db2.gz CXCUBXMZNRAJDM-UHFFFAOYSA-N 1 2 317.458 4.011 20 0 DIADLO CCc1[nH]cc(CNC(=O)c2csc(C3CCCCC3)c2)[nH+]1 ZINC001472020131 1063043500 /nfs/dbraw/zinc/04/35/00/1063043500.db2.gz CXCUBXMZNRAJDM-UHFFFAOYSA-N 1 2 317.458 4.011 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2c(C)cccc2Cl)[nH]c1C ZINC001460761567 1063044698 /nfs/dbraw/zinc/04/46/98/1063044698.db2.gz INGGEKJGBWAIOY-MRXNPFEDSA-N 1 2 303.837 4.325 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2c(C)cccc2Cl)[nH]c1C ZINC001460761567 1063044716 /nfs/dbraw/zinc/04/47/16/1063044716.db2.gz INGGEKJGBWAIOY-MRXNPFEDSA-N 1 2 303.837 4.325 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2Cc2c(C)cccc2Cl)[nH+]c1C ZINC001460761567 1063044737 /nfs/dbraw/zinc/04/47/37/1063044737.db2.gz INGGEKJGBWAIOY-MRXNPFEDSA-N 1 2 303.837 4.325 20 0 DIADLO CCC[C@H](C)CCC[N@@H+]1CCOC[C@@H]1c1ccc(COC)o1 ZINC001460819967 1063080858 /nfs/dbraw/zinc/08/08/58/1063080858.db2.gz RTRRMODKVWMLTD-DOTOQJQBSA-N 1 2 309.450 4.016 20 0 DIADLO CCC[C@H](C)CCC[N@H+]1CCOC[C@@H]1c1ccc(COC)o1 ZINC001460819967 1063080874 /nfs/dbraw/zinc/08/08/74/1063080874.db2.gz RTRRMODKVWMLTD-DOTOQJQBSA-N 1 2 309.450 4.016 20 0 DIADLO CCC[C@@H](C)CCC[N@@H+]1CCOC[C@@H]1c1ccc(COC)o1 ZINC001460819973 1063081808 /nfs/dbraw/zinc/08/18/08/1063081808.db2.gz RTRRMODKVWMLTD-NVXWUHKLSA-N 1 2 309.450 4.016 20 0 DIADLO CCC[C@@H](C)CCC[N@H+]1CCOC[C@@H]1c1ccc(COC)o1 ZINC001460819973 1063081830 /nfs/dbraw/zinc/08/18/30/1063081830.db2.gz RTRRMODKVWMLTD-NVXWUHKLSA-N 1 2 309.450 4.016 20 0 DIADLO CC1=C(C)C[C@@H](C(=O)N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)CC1 ZINC001472532047 1063097304 /nfs/dbraw/zinc/09/73/04/1063097304.db2.gz AWXRZPNAMFDTIZ-WMZOPIPTSA-N 1 2 323.440 4.186 20 0 DIADLO C[C@@H](c1ccc2c(c1)CCC2)[N@@H+]1CCn2nc(C(C)(C)C)cc2C1 ZINC001460884286 1063114497 /nfs/dbraw/zinc/11/44/97/1063114497.db2.gz RQEGPZCLPMPYEB-HNNXBMFYSA-N 1 2 323.484 4.246 20 0 DIADLO C[C@@H](c1ccc2c(c1)CCC2)[N@H+]1CCn2nc(C(C)(C)C)cc2C1 ZINC001460884286 1063114511 /nfs/dbraw/zinc/11/45/11/1063114511.db2.gz RQEGPZCLPMPYEB-HNNXBMFYSA-N 1 2 323.484 4.246 20 0 DIADLO c1[nH+]cn2c1c(NCCCCc1ccccc1)nc1ccccc12 ZINC001472647703 1063118788 /nfs/dbraw/zinc/11/87/88/1063118788.db2.gz DTQYJGQJQWHULU-UHFFFAOYSA-N 1 2 316.408 4.317 20 0 DIADLO Cc1cc(NCc2cccc(OC(C)C)c2)nc(C2CCC2)[nH+]1 ZINC001472662243 1063129689 /nfs/dbraw/zinc/12/96/89/1063129689.db2.gz IUUBEWHHCMFAEG-UHFFFAOYSA-N 1 2 311.429 4.452 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(F)c(Cl)c2)nc1 ZINC001460935413 1063146132 /nfs/dbraw/zinc/14/61/32/1063146132.db2.gz XNJMBTBTMSSLLW-QGZVFWFLSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(F)c(Cl)c2)nc1 ZINC001460935413 1063146150 /nfs/dbraw/zinc/14/61/50/1063146150.db2.gz XNJMBTBTMSSLLW-QGZVFWFLSA-N 1 2 320.795 4.220 20 0 DIADLO CN(CCC1CCCCC1)c1nc2ccccc2n2c[nH+]cc12 ZINC001472683898 1063147752 /nfs/dbraw/zinc/14/77/52/1063147752.db2.gz DDUNNAWFIZXEFW-UHFFFAOYSA-N 1 2 308.429 4.289 20 0 DIADLO CC(C)c1cc(NC[C@H](O)C2CCCCC2)nc(C(C)C)[nH+]1 ZINC001472682935 1063147981 /nfs/dbraw/zinc/14/79/81/1063147981.db2.gz LDRTZNKUFBGNSW-INIZCTEOSA-N 1 2 305.466 4.077 20 0 DIADLO Cc1nc(NCCCCC(C)(C)C)c(Br)c(C)[nH+]1 ZINC001472689579 1063153486 /nfs/dbraw/zinc/15/34/86/1063153486.db2.gz QKRSRFFLGRJBDC-UHFFFAOYSA-N 1 2 314.271 4.484 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@@H+](Cc1ccnc(Cl)c1)C2 ZINC001460970900 1063163150 /nfs/dbraw/zinc/16/31/50/1063163150.db2.gz FMCLIUNVSXECAX-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc2c(c1)CC[N@H+](Cc1ccnc(Cl)c1)C2 ZINC001460970900 1063163159 /nfs/dbraw/zinc/16/31/59/1063163159.db2.gz FMCLIUNVSXECAX-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@@H+]1CCc3cc(F)cc(F)c3C1)CC2 ZINC001460974253 1063165261 /nfs/dbraw/zinc/16/52/61/1063165261.db2.gz POVYDDMEFWLIKA-GOSISDBHSA-N 1 2 303.327 4.150 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@H+]1CCc3cc(F)cc(F)c3C1)CC2 ZINC001460974253 1063165268 /nfs/dbraw/zinc/16/52/68/1063165268.db2.gz POVYDDMEFWLIKA-GOSISDBHSA-N 1 2 303.327 4.150 20 0 DIADLO c1c2cccnc2oc1C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC001460987415 1063169005 /nfs/dbraw/zinc/16/90/05/1063169005.db2.gz ATWMVCJTDVZTRA-IBGZPJMESA-N 1 2 315.376 4.102 20 0 DIADLO COc1ccc2cc(CC[C@@H](C)[NH2+][C@H]3CC3(F)F)ccc2c1 ZINC001257267915 1063169335 /nfs/dbraw/zinc/16/93/35/1063169335.db2.gz CRPWQQWCEQPAKN-PXAZEXFGSA-N 1 2 305.368 4.167 20 0 DIADLO Cc1cc(CNC(=O)[C@@H](C)c2ccc3ccccc3c2)cc(C)[nH+]1 ZINC001461006257 1063182889 /nfs/dbraw/zinc/18/28/89/1063182889.db2.gz FYUQCZCQZIGCHK-INIZCTEOSA-N 1 2 318.420 4.272 20 0 DIADLO CCCOc1cccc(CCNc2cc(CC)[nH+]c(CC)n2)c1 ZINC001472735854 1063195146 /nfs/dbraw/zinc/19/51/46/1063195146.db2.gz PQIICUIKRVNDIS-UHFFFAOYSA-N 1 2 313.445 4.045 20 0 DIADLO Cc1nc(N2CCC[C@@H](c3ccc(F)cc3)CC2)c(C)c(C)[nH+]1 ZINC001472741272 1063196361 /nfs/dbraw/zinc/19/63/61/1063196361.db2.gz YWXJVNWTBPEAQK-MRXNPFEDSA-N 1 2 313.420 4.315 20 0 DIADLO CC(C)c1cc(NCC[C@H]2CCO[C@@H](C)C2)nc(C(C)C)[nH+]1 ZINC001472755727 1063209877 /nfs/dbraw/zinc/20/98/77/1063209877.db2.gz IZBCGDUPJHBHQL-GJZGRUSLSA-N 1 2 305.466 4.341 20 0 DIADLO CC(C)c1cc(NCC[C@@H]2CCO[C@H](C)C2)nc(C(C)C)[nH+]1 ZINC001472755728 1063210446 /nfs/dbraw/zinc/21/04/46/1063210446.db2.gz IZBCGDUPJHBHQL-HUUCEWRRSA-N 1 2 305.466 4.341 20 0 DIADLO CSc1ccc(CNc2nc3ccccc3n3c[nH+]cc23)cc1 ZINC001472760986 1063212744 /nfs/dbraw/zinc/21/27/44/1063212744.db2.gz OTTUKYOOGSBIRT-UHFFFAOYSA-N 1 2 320.421 4.217 20 0 DIADLO Cc1cc(NC[C@H]2CCC3(CCCCC3)O2)nc(C2CCC2)[nH+]1 ZINC001472757805 1063213777 /nfs/dbraw/zinc/21/37/77/1063213777.db2.gz XDKBRUWNEZJPFR-MRXNPFEDSA-N 1 2 315.461 4.346 20 0 DIADLO CC[C@H](Nc1nc(C)[nH+]c(C)c1Br)[C@@H]1CC1(C)C ZINC001472809171 1063254550 /nfs/dbraw/zinc/25/45/50/1063254550.db2.gz LFIKLQQYAVJTKJ-QWRGUYRKSA-N 1 2 312.255 4.093 20 0 DIADLO CCc1cc(N2CCC[C@]2(C)Cc2ccc(F)cc2)nc(C)[nH+]1 ZINC001472811041 1063257900 /nfs/dbraw/zinc/25/79/00/1063257900.db2.gz HFEZKNQCSOBNBG-LJQANCHMSA-N 1 2 313.420 4.088 20 0 DIADLO CCCC[C@@H](CC)[NH2+][C@H](c1nnc(C)o1)c1ccccc1OC ZINC001257416632 1063266285 /nfs/dbraw/zinc/26/62/85/1063266285.db2.gz NSDFCCNGDBHDCD-PBHICJAKSA-N 1 2 317.433 4.034 20 0 DIADLO CC[C@@H](OCCNc1cc(C)[nH+]c(C2CC2)n1)c1ccccc1 ZINC001472823757 1063267914 /nfs/dbraw/zinc/26/79/14/1063267914.db2.gz MWSNNQDZVTWMGX-QGZVFWFLSA-N 1 2 311.429 4.242 20 0 DIADLO Cc1nc(N[C@@H]2CCC[C@@H]2c2ccccc2)c2c([nH+]1)CCCC2 ZINC001472853237 1063286016 /nfs/dbraw/zinc/28/60/16/1063286016.db2.gz UFNMMRGIDKDLIH-SJLPKXTDSA-N 1 2 307.441 4.412 20 0 DIADLO Cc1cc(N[C@@H]2Cc3ccc(Cl)cc3C2)nc(C2CCC2)[nH+]1 ZINC001472897981 1063305984 /nfs/dbraw/zinc/30/59/84/1063305984.db2.gz WVGDWYMOPZCORV-MRXNPFEDSA-N 1 2 313.832 4.285 20 0 DIADLO Cc1nc(NC[C@H]2C[C@H]2C2CCCC2)c(Br)c(C)[nH+]1 ZINC001472904127 1063308115 /nfs/dbraw/zinc/30/81/15/1063308115.db2.gz IZJOYGFILQGOGN-OLZOCXBDSA-N 1 2 324.266 4.094 20 0 DIADLO c1ccc(C[N@@H+]2CCCC[C@H]2c2nnc(C3CCCC3)o2)cc1 ZINC001257537052 1063328161 /nfs/dbraw/zinc/32/81/61/1063328161.db2.gz CUYWQHSMKCOYLI-KRWDZBQOSA-N 1 2 311.429 4.454 20 0 DIADLO c1ccc(C[N@H+]2CCCC[C@H]2c2nnc(C3CCCC3)o2)cc1 ZINC001257537052 1063328180 /nfs/dbraw/zinc/32/81/80/1063328180.db2.gz CUYWQHSMKCOYLI-KRWDZBQOSA-N 1 2 311.429 4.454 20 0 DIADLO CC(C)(C)OC(=O)NCCCCCCn1c[nH+]c(C(C)(C)C)c1 ZINC001473070415 1063384486 /nfs/dbraw/zinc/38/44/86/1063384486.db2.gz XMZPVLLGGPBLOY-UHFFFAOYSA-N 1 2 323.481 4.266 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@@H+]1CCc1cccc(Cl)c1Cl ZINC001473105505 1063401481 /nfs/dbraw/zinc/40/14/81/1063401481.db2.gz MCBBGYKTQYCWGQ-DGCLKSJQSA-N 1 2 302.245 4.035 20 0 DIADLO CC[C@@H]1CO[C@H](C)C[N@H+]1CCc1cccc(Cl)c1Cl ZINC001473105505 1063401487 /nfs/dbraw/zinc/40/14/87/1063401487.db2.gz MCBBGYKTQYCWGQ-DGCLKSJQSA-N 1 2 302.245 4.035 20 0 DIADLO COCCC1(C[NH2+]c2ccc3c(c2)CCCO3)CCCCC1 ZINC001461324875 1063419936 /nfs/dbraw/zinc/41/99/36/1063419936.db2.gz XJEPIGQLHXCMDH-UHFFFAOYSA-N 1 2 303.446 4.411 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3cccc(OC(F)F)c3)ccc21 ZINC001461329459 1063422751 /nfs/dbraw/zinc/42/27/51/1063422751.db2.gz HSFDMCDCPCIETR-UHFFFAOYSA-N 1 2 318.367 4.283 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3cccc(OC(F)F)c3)ccc21 ZINC001461329459 1063422762 /nfs/dbraw/zinc/42/27/62/1063422762.db2.gz HSFDMCDCPCIETR-UHFFFAOYSA-N 1 2 318.367 4.283 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC001473119063 1063423643 /nfs/dbraw/zinc/42/36/43/1063423643.db2.gz CNMUCRQGJUYNOQ-OAHLLOKOSA-N 1 2 311.425 4.146 20 0 DIADLO CCCOC(=O)[C@@H](C)[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC001473119063 1063423654 /nfs/dbraw/zinc/42/36/54/1063423654.db2.gz CNMUCRQGJUYNOQ-OAHLLOKOSA-N 1 2 311.425 4.146 20 0 DIADLO CCc1ccc(C[NH2+][C@H](C)c2noc(-c3ccccc3)n2)s1 ZINC001461339192 1063427238 /nfs/dbraw/zinc/42/72/38/1063427238.db2.gz CZJONPFKZMODSG-GFCCVEGCSA-N 1 2 313.426 4.211 20 0 DIADLO CC(C)C[N@H+](CC(=O)c1ccccc1F)Cc1ccccc1F ZINC001473130678 1063438406 /nfs/dbraw/zinc/43/84/06/1063438406.db2.gz ZSNZPFFHBADGOH-UHFFFAOYSA-N 1 2 317.379 4.306 20 0 DIADLO CC(C)C[N@@H+](CC(=O)c1ccccc1F)Cc1ccccc1F ZINC001473130678 1063438415 /nfs/dbraw/zinc/43/84/15/1063438415.db2.gz ZSNZPFFHBADGOH-UHFFFAOYSA-N 1 2 317.379 4.306 20 0 DIADLO CCN(CC)c1ccc(NC/C=C/c2ccc(F)cc2F)c[nH+]1 ZINC001461366080 1063447781 /nfs/dbraw/zinc/44/77/81/1063447781.db2.gz FBMHZUJIOMNONO-AATRIKPKSA-N 1 2 317.383 4.331 20 0 DIADLO CC(C)(CNc1ccc(N2CCCCC2)[nH+]c1)c1ccccc1 ZINC001461372253 1063455416 /nfs/dbraw/zinc/45/54/16/1063455416.db2.gz ASBYOLHDWURLMR-UHFFFAOYSA-N 1 2 309.457 4.462 20 0 DIADLO Cc1cc(NCc2cc(C)[nH+]c(C)c2)nn1-c1ccc(C)cc1 ZINC001461380486 1063459823 /nfs/dbraw/zinc/45/98/23/1063459823.db2.gz UOEORIYWZWALPL-UHFFFAOYSA-N 1 2 306.413 4.113 20 0 DIADLO Cc1cc(NCc2cnc(-c3ccccc3)nc2)ccc1[NH+](C)C ZINC001461391840 1063469133 /nfs/dbraw/zinc/46/91/33/1063469133.db2.gz MZKZOCLSCKBNDK-UHFFFAOYSA-N 1 2 318.424 4.130 20 0 DIADLO Cc1cc(Br)cc(NCc2cc(C)[nH+]c(C)c2)c1 ZINC001461437769 1063506059 /nfs/dbraw/zinc/50/60/59/1063506059.db2.gz VNKJICXPEBBQJX-UHFFFAOYSA-N 1 2 305.219 4.381 20 0 DIADLO OCc1cc[nH+]c(NCc2ccc(Sc3ccccc3)cc2)c1 ZINC001461593006 1063601394 /nfs/dbraw/zinc/60/13/94/1063601394.db2.gz HIHRUVDJWOELSS-UHFFFAOYSA-N 1 2 322.433 4.337 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N[C@@H](c3ccccc3)C(C)(C)C)ccn12 ZINC001514727136 1063607874 /nfs/dbraw/zinc/60/78/74/1063607874.db2.gz WXTDFQFIYAQYAE-SFHVURJKSA-N 1 2 321.424 4.160 20 0 DIADLO CSc1c(F)cccc1NCc1c[nH+]c2ccc(C)cn12 ZINC001461634197 1063626867 /nfs/dbraw/zinc/62/68/67/1063626867.db2.gz ZCJZVZMJJHRPFK-UHFFFAOYSA-N 1 2 301.390 4.116 20 0 DIADLO CCC(CC)[C@@H](NC(=O)c1cccc2[nH+]ccn21)c1ccccc1 ZINC001514975364 1063634007 /nfs/dbraw/zinc/63/40/07/1063634007.db2.gz PMMSWATYCSPXHO-LJQANCHMSA-N 1 2 321.424 4.242 20 0 DIADLO CCCSc1cccc(NCc2ccc(-n3cc[nH+]c3)cc2)n1 ZINC001461678567 1063653149 /nfs/dbraw/zinc/65/31/49/1063653149.db2.gz RYSLLXXEHOACRI-UHFFFAOYSA-N 1 2 324.453 4.382 20 0 DIADLO CCCCC[C@@H](CC)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258446670 1063658259 /nfs/dbraw/zinc/65/82/59/1063658259.db2.gz TXRBPUPJFBZGJD-GFCCVEGCSA-N 1 2 303.372 4.076 20 0 DIADLO CCCCC[C@@H](CC)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258446670 1063658264 /nfs/dbraw/zinc/65/82/64/1063658264.db2.gz TXRBPUPJFBZGJD-GFCCVEGCSA-N 1 2 303.372 4.076 20 0 DIADLO COc1cc(F)cc(OC)c1C[NH2+]Cc1ccc(C(C)(C)C)o1 ZINC001461697478 1063663933 /nfs/dbraw/zinc/66/39/33/1063663933.db2.gz JPXRLPFTUGFDIN-UHFFFAOYSA-N 1 2 321.392 4.023 20 0 DIADLO COc1ccc(CNc2[nH]c3cc(C)ccc3[nH+]2)c(Cl)c1 ZINC001461708206 1063672475 /nfs/dbraw/zinc/67/24/75/1063672475.db2.gz GFSVHKXRMPFCTF-UHFFFAOYSA-N 1 2 301.777 4.145 20 0 DIADLO CCc1cccc2cc(CNc3[nH]c4cccc(OC)c4[nH+]3)oc21 ZINC001461731132 1063684010 /nfs/dbraw/zinc/68/40/10/1063684010.db2.gz ZZSPDOVCLHNKIC-UHFFFAOYSA-N 1 2 321.380 4.492 20 0 DIADLO CC1(C)CC[NH+](Cc2c(F)cc(Br)cc2F)CC1 ZINC001461914215 1063798708 /nfs/dbraw/zinc/79/87/08/1063798708.db2.gz XWKGYWVQYDTNGW-UHFFFAOYSA-N 1 2 318.205 4.349 20 0 DIADLO CCCC[C@H](CCC)[N@@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001258761475 1063806882 /nfs/dbraw/zinc/80/68/82/1063806882.db2.gz MDDWOWLMALMGFU-HOTGVXAUSA-N 1 2 307.482 4.155 20 0 DIADLO CCCC[C@H](CCC)[N@H+]1CCn2c(COCC)cnc2[C@@H]1C ZINC001258761475 1063806892 /nfs/dbraw/zinc/80/68/92/1063806892.db2.gz MDDWOWLMALMGFU-HOTGVXAUSA-N 1 2 307.482 4.155 20 0 DIADLO Cc1ccc(-c2nnc([C@@H]3CC[N@@H+]3Cc3ccccc3)o2)cc1F ZINC001258765979 1063813543 /nfs/dbraw/zinc/81/35/43/1063813543.db2.gz QLRMXQMRLHZJMM-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1ccc(-c2nnc([C@@H]3CC[N@H+]3Cc3ccccc3)o2)cc1F ZINC001258765979 1063813557 /nfs/dbraw/zinc/81/35/57/1063813557.db2.gz QLRMXQMRLHZJMM-KRWDZBQOSA-N 1 2 323.371 4.131 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1nc3ccc(F)cc3s1)C2 ZINC001461949301 1063831972 /nfs/dbraw/zinc/83/19/72/1063831972.db2.gz MQABJLFUNTZLLE-UHFFFAOYSA-N 1 2 312.413 4.302 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1nc3ccc(F)cc3s1)C2 ZINC001461949301 1063831985 /nfs/dbraw/zinc/83/19/85/1063831985.db2.gz MQABJLFUNTZLLE-UHFFFAOYSA-N 1 2 312.413 4.302 20 0 DIADLO CC[C@@H](C)C[C@H](CC)[N@@H+]1Cc2cc(Br)cnc2C1 ZINC001258798444 1063834597 /nfs/dbraw/zinc/83/45/97/1063834597.db2.gz UBSQEKSRHRSBEO-RISCZKNCSA-N 1 2 311.267 4.375 20 0 DIADLO CC[C@@H](C)C[C@H](CC)[N@H+]1Cc2cc(Br)cnc2C1 ZINC001258798444 1063834612 /nfs/dbraw/zinc/83/46/12/1063834612.db2.gz UBSQEKSRHRSBEO-RISCZKNCSA-N 1 2 311.267 4.375 20 0 DIADLO CC[C@H]1C[N@H+](Cc2cc(F)cc(C(F)(F)F)c2)CCS1 ZINC001461964995 1063845296 /nfs/dbraw/zinc/84/52/96/1063845296.db2.gz YRGGRIVZYJJBDK-ZDUSSCGKSA-N 1 2 307.356 4.172 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2cc(F)cc(C(F)(F)F)c2)CCS1 ZINC001461964995 1063845307 /nfs/dbraw/zinc/84/53/07/1063845307.db2.gz YRGGRIVZYJJBDK-ZDUSSCGKSA-N 1 2 307.356 4.172 20 0 DIADLO CC[C@H]1C[N@H+](Cc2ccc(F)c(Cl)c2Cl)CCS1 ZINC001461958379 1063839954 /nfs/dbraw/zinc/83/99/54/1063839954.db2.gz JPQOZMUYAMSFQR-JTQLQIEISA-N 1 2 308.249 4.460 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2ccc(F)c(Cl)c2Cl)CCS1 ZINC001461958379 1063839965 /nfs/dbraw/zinc/83/99/65/1063839965.db2.gz JPQOZMUYAMSFQR-JTQLQIEISA-N 1 2 308.249 4.460 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@@H+]2CCO[C@H](c3ccco3)C2)c(C)c1 ZINC001461966940 1063845545 /nfs/dbraw/zinc/84/55/45/1063845545.db2.gz JJIYECVTJMSLHF-MNBNYPOFSA-N 1 2 311.425 4.292 20 0 DIADLO Cc1cc(C)c(/C=C\C[N@H+]2CCO[C@H](c3ccco3)C2)c(C)c1 ZINC001461966940 1063845549 /nfs/dbraw/zinc/84/55/49/1063845549.db2.gz JJIYECVTJMSLHF-MNBNYPOFSA-N 1 2 311.425 4.292 20 0 DIADLO CCC[N@H+](Cc1ccnn1C(C)C)Cc1ccc(F)cc1F ZINC001461972802 1063850794 /nfs/dbraw/zinc/85/07/94/1063850794.db2.gz ZQLKLEMTVOSXFV-UHFFFAOYSA-N 1 2 307.388 4.154 20 0 DIADLO CCC[N@@H+](Cc1ccnn1C(C)C)Cc1ccc(F)cc1F ZINC001461972802 1063850811 /nfs/dbraw/zinc/85/08/11/1063850811.db2.gz ZQLKLEMTVOSXFV-UHFFFAOYSA-N 1 2 307.388 4.154 20 0 DIADLO CC[C@H]1C[N@H+](CCCc2c(Cl)cccc2Cl)C[C@@H](C)O1 ZINC001461985162 1063859766 /nfs/dbraw/zinc/85/97/66/1063859766.db2.gz DRLLGBRHTFPPHG-OLZOCXBDSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@H]1C[N@@H+](CCCc2c(Cl)cccc2Cl)C[C@@H](C)O1 ZINC001461985162 1063859771 /nfs/dbraw/zinc/85/97/71/1063859771.db2.gz DRLLGBRHTFPPHG-OLZOCXBDSA-N 1 2 316.272 4.425 20 0 DIADLO Cc1ccc(C[NH+]2CCN(c3ccccc3F)CC2)c(Cl)c1 ZINC001462005743 1063873201 /nfs/dbraw/zinc/87/32/01/1063873201.db2.gz AWJARZYRKQCQMY-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO C[C@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2ncc[nH]2)c2ccsc2S1 ZINC001462061665 1063907943 /nfs/dbraw/zinc/90/79/43/1063907943.db2.gz QTFCFCBAPKCASM-UHTWSYAYSA-N 1 2 305.472 4.234 20 0 DIADLO C[C@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ncc[nH]2)c2ccsc2S1 ZINC001462061665 1063907958 /nfs/dbraw/zinc/90/79/58/1063907958.db2.gz QTFCFCBAPKCASM-UHTWSYAYSA-N 1 2 305.472 4.234 20 0 DIADLO Cc1nc([C@@H](C)Nc2[nH+]ccc3cc(C(F)(F)F)ccc32)no1 ZINC001261261538 1063915941 /nfs/dbraw/zinc/91/59/41/1063915941.db2.gz ZHOHRUDUJIJRTR-MRVPVSSYSA-N 1 2 322.290 4.118 20 0 DIADLO Cc1ccc(N[C@@H](C)c2ncc(-c3ccccc3)n2C)c(C)[nH+]1 ZINC001261276396 1063917349 /nfs/dbraw/zinc/91/73/49/1063917349.db2.gz HPOPQEINQLNPND-HNNXBMFYSA-N 1 2 306.413 4.272 20 0 DIADLO C[C@@H](c1nc(C2CCC(c3ccccc3)CC2)no1)n1cc[nH+]c1 ZINC001261276374 1063917854 /nfs/dbraw/zinc/91/78/54/1063917854.db2.gz GMZWNBXUWQJEFY-OOHWJJMZSA-N 1 2 322.412 4.317 20 0 DIADLO CCC[N@H+](Cc1cc(C(C)(C)C)oc1C)[C@H](CC)C(=O)OCC ZINC001462083691 1063920030 /nfs/dbraw/zinc/92/00/30/1063920030.db2.gz AWGBCQLHHOBKPH-MRXNPFEDSA-N 1 2 323.477 4.439 20 0 DIADLO CCC[N@@H+](Cc1cc(C(C)(C)C)oc1C)[C@H](CC)C(=O)OCC ZINC001462083691 1063920038 /nfs/dbraw/zinc/92/00/38/1063920038.db2.gz AWGBCQLHHOBKPH-MRXNPFEDSA-N 1 2 323.477 4.439 20 0 DIADLO CC1(C)C[NH+](Cc2ccsc2C(F)(F)F)CC(C)(C)O1 ZINC001462096304 1063927372 /nfs/dbraw/zinc/92/73/72/1063927372.db2.gz QSZMBHPPGVDKML-UHFFFAOYSA-N 1 2 307.381 4.156 20 0 DIADLO COc1ccc([C@H](C)[C@H](C)Nc2[nH+]cccc2OC(C)C)cc1 ZINC001462107548 1063932196 /nfs/dbraw/zinc/93/21/96/1063932196.db2.gz WCAUZCNMQXXOCI-CABCVRRESA-N 1 2 314.429 4.482 20 0 DIADLO COc1ccc([C@@H](C)[C@@H](C)Nc2[nH+]cccc2OC(C)C)cc1 ZINC001462107555 1063932835 /nfs/dbraw/zinc/93/28/35/1063932835.db2.gz WCAUZCNMQXXOCI-LSDHHAIUSA-N 1 2 314.429 4.482 20 0 DIADLO CCCCC[C@H]([NH2+]C1CC(c2ccc(Cl)cc2)C1)C(=O)OC ZINC001462116585 1063936072 /nfs/dbraw/zinc/93/60/72/1063936072.db2.gz XABYIBKCNVCARJ-PREGVCBESA-N 1 2 323.864 4.298 20 0 DIADLO Cc1nc(C[NH2+]C(C)(C)c2nc3ccccc3s2)c(C)s1 ZINC001261806628 1063945765 /nfs/dbraw/zinc/94/57/65/1063945765.db2.gz SUZPXJVUTNIRGR-UHFFFAOYSA-N 1 2 317.483 4.395 20 0 DIADLO C[C@]1(C[N@@H+]2CCO[C@H](c3ccc(Cl)s3)C2)CCCS1 ZINC001261828178 1063947920 /nfs/dbraw/zinc/94/79/20/1063947920.db2.gz BBNCCTCZRXZRTJ-SMDDNHRTSA-N 1 2 317.907 4.061 20 0 DIADLO C[C@]1(C[N@H+]2CCO[C@H](c3ccc(Cl)s3)C2)CCCS1 ZINC001261828178 1063947928 /nfs/dbraw/zinc/94/79/28/1063947928.db2.gz BBNCCTCZRXZRTJ-SMDDNHRTSA-N 1 2 317.907 4.061 20 0 DIADLO C[C@]1(C[N@@H+]2CCO[C@@H](c3ccc(Cl)s3)C2)CCCS1 ZINC001261828175 1063948288 /nfs/dbraw/zinc/94/82/88/1063948288.db2.gz BBNCCTCZRXZRTJ-BXUZGUMPSA-N 1 2 317.907 4.061 20 0 DIADLO C[C@]1(C[N@H+]2CCO[C@@H](c3ccc(Cl)s3)C2)CCCS1 ZINC001261828175 1063948299 /nfs/dbraw/zinc/94/82/99/1063948299.db2.gz BBNCCTCZRXZRTJ-BXUZGUMPSA-N 1 2 317.907 4.061 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C)sc1C)c1cccc(OC)c1OC ZINC001262015347 1063952078 /nfs/dbraw/zinc/95/20/78/1063952078.db2.gz JQHYIQPQTWJKDT-AWEZNQCLSA-N 1 2 320.458 4.018 20 0 DIADLO C[C@@H](CC(=O)Nc1ccccc1-c1cccs1)n1cc[nH+]c1 ZINC001264319199 1064074226 /nfs/dbraw/zinc/07/42/26/1064074226.db2.gz CBZBNYKVYBIWOA-ZDUSSCGKSA-N 1 2 311.410 4.201 20 0 DIADLO Brc1sccc1C[N@@H+]1CCc2ccccc2C1 ZINC000389001040 1064118457 /nfs/dbraw/zinc/11/84/57/1064118457.db2.gz QQQPPMWBNKYIMQ-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1sccc1C[N@H+]1CCc2ccccc2C1 ZINC000389001040 1064118460 /nfs/dbraw/zinc/11/84/60/1064118460.db2.gz QQQPPMWBNKYIMQ-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO C[C@H]1CC[C@H](CC(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)C1 ZINC001264831237 1064144538 /nfs/dbraw/zinc/14/45/38/1064144538.db2.gz PEUPWZCSTDOYPD-STQMWFEESA-N 1 2 317.820 4.291 20 0 DIADLO CC1(CC(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CCCC1 ZINC001264831361 1064144681 /nfs/dbraw/zinc/14/46/81/1064144681.db2.gz VQTCZOYBDXJQMB-UHFFFAOYSA-N 1 2 317.820 4.435 20 0 DIADLO CCCC[C@](C)(F)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001264831624 1064145154 /nfs/dbraw/zinc/14/51/54/1064145154.db2.gz GLGLAUJZAUIDAF-INIZCTEOSA-N 1 2 323.799 4.383 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc4cc(C)ccc4s3)ccc2[nH+]1 ZINC001264857793 1064151614 /nfs/dbraw/zinc/15/16/14/1064151614.db2.gz IUVVFTWKKMFJEE-UHFFFAOYSA-N 1 2 321.405 4.418 20 0 DIADLO Fc1c(Br)ccc(C[N@@H+]2CCC3(CCC3)C2)c1F ZINC000701293791 1064246929 /nfs/dbraw/zinc/24/69/29/1064246929.db2.gz KFHLHGMKRFKPKM-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Fc1c(Br)ccc(C[N@H+]2CCC3(CCC3)C2)c1F ZINC000701293791 1064246939 /nfs/dbraw/zinc/24/69/39/1064246939.db2.gz KFHLHGMKRFKPKM-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO CCCCCc1ccc(NC(=O)C(C)(C)n2c[nH+]c(C)c2)cc1 ZINC001290042903 1064676631 /nfs/dbraw/zinc/67/66/31/1064676631.db2.gz PQOHYYMJPDIWBI-UHFFFAOYSA-N 1 2 313.445 4.298 20 0 DIADLO CCc1ccc([C@H](NC(=O)c2cc3c[nH+]ccc3[nH]2)C(C)C)cc1 ZINC001290485077 1064696011 /nfs/dbraw/zinc/69/60/11/1064696011.db2.gz XEGYJZXUMQUHJI-LJQANCHMSA-N 1 2 321.424 4.252 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)C1CCC(C2CC2)CC1 ZINC001290762121 1064710329 /nfs/dbraw/zinc/71/03/29/1064710329.db2.gz BCMFAAZXIURULV-UHFFFAOYSA-N 1 2 309.413 4.027 20 0 DIADLO Cc1ccc(C[C@H](C)Nc2nc(C)[nH+]c3c2CCCC3)s1 ZINC001306974058 1064729081 /nfs/dbraw/zinc/72/90/81/1064729081.db2.gz FJUMLEXBBBCCBK-NSHDSACASA-N 1 2 301.459 4.077 20 0 DIADLO CCc1cc(N2CCCC[C@H]2c2ccc(F)cc2F)nc(C)[nH+]1 ZINC001306998820 1064735645 /nfs/dbraw/zinc/73/56/45/1064735645.db2.gz FOBATUVSHNUIMQ-KRWDZBQOSA-N 1 2 317.383 4.357 20 0 DIADLO CCCN(CC1CCCCC1)C(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001291973521 1064753407 /nfs/dbraw/zinc/75/34/07/1064753407.db2.gz MJXWJCTUWQTGRU-GOSISDBHSA-N 1 2 319.493 4.289 20 0 DIADLO CC(C)=CCC[C@H](C)CC(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC001292058545 1064757062 /nfs/dbraw/zinc/75/70/62/1064757062.db2.gz JGJHBXQTDDYCCH-IRXDYDNUSA-N 1 2 319.493 4.187 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@]3(C)CCC[C@@H]3C)c2)[nH+]c1C ZINC001292072771 1064759072 /nfs/dbraw/zinc/75/90/72/1064759072.db2.gz KSOLDLYUZLWNGV-HXPMCKFVSA-N 1 2 311.429 4.458 20 0 DIADLO CC[N@H+](CC(=O)N(CC(C)C)C(C)C)Cc1ccccc1Cl ZINC001292362951 1064770855 /nfs/dbraw/zinc/77/08/55/1064770855.db2.gz YIWOCCKSUAXRAZ-UHFFFAOYSA-N 1 2 324.896 4.055 20 0 DIADLO CC[N@@H+](CC(=O)N(CC(C)C)C(C)C)Cc1ccccc1Cl ZINC001292362951 1064770868 /nfs/dbraw/zinc/77/08/68/1064770868.db2.gz YIWOCCKSUAXRAZ-UHFFFAOYSA-N 1 2 324.896 4.055 20 0 DIADLO Cc1cc(C)c(C(=O)N2CCC[C@H](Cc3ccccc3)C2)c(C)[nH+]1 ZINC001292882137 1064790803 /nfs/dbraw/zinc/79/08/03/1064790803.db2.gz LVXGZBXBTVLBSN-LJQANCHMSA-N 1 2 322.452 4.102 20 0 DIADLO CC[C@@H](C)C[C@H](C)NC(=O)C[N@H+](CC)Cc1ccccc1Cl ZINC001293941378 1064839312 /nfs/dbraw/zinc/83/93/12/1064839312.db2.gz FPIXKWDQTNBOGW-CABCVRRESA-N 1 2 324.896 4.103 20 0 DIADLO CC[C@@H](C)C[C@H](C)NC(=O)C[N@@H+](CC)Cc1ccccc1Cl ZINC001293941378 1064839324 /nfs/dbraw/zinc/83/93/24/1064839324.db2.gz FPIXKWDQTNBOGW-CABCVRRESA-N 1 2 324.896 4.103 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@H]3[C@@H](c4ccccc4)C3(C)C)cc2[nH+]1 ZINC001294768080 1064884997 /nfs/dbraw/zinc/88/49/97/1064884997.db2.gz WYWHEVSDTUOOFE-MSOLQXFVSA-N 1 2 319.408 4.250 20 0 DIADLO CC[C@H]([NH2+][C@@H](c1noc(C)n1)c1ccc(Cl)cc1)[C@@H]1C[C@H]1C ZINC000666122457 1065080422 /nfs/dbraw/zinc/08/04/22/1065080422.db2.gz NYEJJDRVNFLXDA-HGGPSHQYSA-N 1 2 319.836 4.145 20 0 DIADLO CC(C)C[C@H](C(=O)N1CC[C@]1(C)C1CCCCC1)n1cc[nH+]c1 ZINC001302914474 1065101296 /nfs/dbraw/zinc/10/12/96/1065101296.db2.gz DYBVBCGPEGHEQF-IEBWSBKVSA-N 1 2 317.477 4.042 20 0 DIADLO CC(C)=CCC[C@@H](C)CC(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001303609340 1065119003 /nfs/dbraw/zinc/11/90/03/1065119003.db2.gz SIELJEWVQHWBJQ-PBHICJAKSA-N 1 2 317.477 4.463 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)c2cccc3ccccc32)[nH+]c1C ZINC001303605994 1065119158 /nfs/dbraw/zinc/11/91/58/1065119158.db2.gz OEVYYUUTSZXGIG-GOSISDBHSA-N 1 2 319.408 4.157 20 0 DIADLO Cc1nc(NCc2ccc(C(F)(F)F)cc2)c2c([nH+]1)CCCC2 ZINC001306921146 1065205428 /nfs/dbraw/zinc/20/54/28/1065205428.db2.gz SLXTWWHRNHZBIR-UHFFFAOYSA-N 1 2 321.346 4.295 20 0 DIADLO CCc1cc(N2CCC[C@H]2Cc2ccccc2C)nc(CC)[nH+]1 ZINC001306971572 1065227724 /nfs/dbraw/zinc/22/77/24/1065227724.db2.gz KMQDJZWAPDILMS-SFHVURJKSA-N 1 2 309.457 4.121 20 0 DIADLO CCc1cc(Nc2ccc([NH+]3CCC(C)CC3)cc2)nc(C)n1 ZINC001306975746 1065230863 /nfs/dbraw/zinc/23/08/63/1065230863.db2.gz WDLYYVSNCCMBJA-UHFFFAOYSA-N 1 2 310.445 4.327 20 0 DIADLO Cc1nc(N2CC[C@H](Cc3ccccc3)[C@@H]2C)c2c([nH+]1)CCCC2 ZINC001306988364 1065236360 /nfs/dbraw/zinc/23/63/60/1065236360.db2.gz BOAGEGPBIQDXDV-MAUKXSAKSA-N 1 2 321.468 4.121 20 0 DIADLO CCO[C@@H]1C[C@@H](N(C)c2cc(CC)[nH+]c(CC)n2)C1(CC)CC ZINC001306990050 1065239015 /nfs/dbraw/zinc/23/90/15/1065239015.db2.gz NGLVXBLLRSHENM-HZPDHXFCSA-N 1 2 319.493 4.021 20 0 DIADLO CCn1c[nH+]cc1/C=C(/Cl)c1nc2c(cccc2F)n1CC ZINC000901472624 1065256200 /nfs/dbraw/zinc/25/62/00/1065256200.db2.gz OYRKLHHYNCVOAZ-XYOKQWHBSA-N 1 2 318.783 4.149 20 0 DIADLO C[C@@H](Nc1[nH+]cnc2c1cnn2C(C)(C)C)C1CCCCCC1 ZINC001307095724 1065259173 /nfs/dbraw/zinc/25/91/73/1065259173.db2.gz QPOQYVUMUYSTTF-CYBMUJFWSA-N 1 2 315.465 4.352 20 0 DIADLO CC[C@@H]1CCC[C@H]1CNc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC001307123650 1065273109 /nfs/dbraw/zinc/27/31/09/1065273109.db2.gz ODSGVUFEFFXREC-CABCVRRESA-N 1 2 321.428 4.054 20 0 DIADLO Cc1nc(N[C@@H]2CCCc3c4cc(Cl)ccc4[nH]c32)cc[nH+]1 ZINC001307183608 1065297136 /nfs/dbraw/zinc/29/71/36/1065297136.db2.gz SAHJSVUVWZZVQE-OAHLLOKOSA-N 1 2 312.804 4.409 20 0 DIADLO CCc1cc(NCc2cccc(OC(C)(C)C)c2)nc(CC)[nH+]1 ZINC001307202783 1065301437 /nfs/dbraw/zinc/30/14/37/1065301437.db2.gz JHIFIGQABQSINQ-UHFFFAOYSA-N 1 2 313.445 4.391 20 0 DIADLO Cc1cccc2nc(N3CCC(Nc4cccc[nH+]4)CC3)sc21 ZINC001307212540 1065303183 /nfs/dbraw/zinc/30/31/83/1065303183.db2.gz MJDBPXWNRXVIRR-UHFFFAOYSA-N 1 2 324.453 4.081 20 0 DIADLO CC(C)(C)c1cn(Cc2ccc(F)cc2Br)c[nH+]1 ZINC001307382196 1065362743 /nfs/dbraw/zinc/36/27/43/1065362743.db2.gz WPLLJCCLIHCDOF-UHFFFAOYSA-N 1 2 311.198 4.131 20 0 DIADLO COc1ccccc1Cc1cn(Cc2ccc3c(c2)CCC3)c[nH+]1 ZINC001307408344 1065372640 /nfs/dbraw/zinc/37/26/40/1065372640.db2.gz YPWHTSJLFXMTIH-UHFFFAOYSA-N 1 2 318.420 4.020 20 0 DIADLO CCc1nc(C[N@@H+](C)CCO[C@H](CC)c2ccccc2)cs1 ZINC001307428874 1065387680 /nfs/dbraw/zinc/38/76/80/1065387680.db2.gz MMZDYHMRZQKIPS-QGZVFWFLSA-N 1 2 318.486 4.305 20 0 DIADLO CCc1nc(C[N@H+](C)CCO[C@H](CC)c2ccccc2)cs1 ZINC001307428874 1065387686 /nfs/dbraw/zinc/38/76/86/1065387686.db2.gz MMZDYHMRZQKIPS-QGZVFWFLSA-N 1 2 318.486 4.305 20 0 DIADLO CC[N@H+](Cc1csnc1OC)[C@H](C)c1cc2ccccc2o1 ZINC001307428347 1065389103 /nfs/dbraw/zinc/38/91/03/1065389103.db2.gz BRHCONWDGDJPMO-GFCCVEGCSA-N 1 2 316.426 4.481 20 0 DIADLO CC[N@@H+](Cc1csnc1OC)[C@H](C)c1cc2ccccc2o1 ZINC001307428347 1065389115 /nfs/dbraw/zinc/38/91/15/1065389115.db2.gz BRHCONWDGDJPMO-GFCCVEGCSA-N 1 2 316.426 4.481 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2nc(CC3CC3)no2)o1 ZINC001307489712 1065435365 /nfs/dbraw/zinc/43/53/65/1065435365.db2.gz MIIUPOPXJWVNDE-HNNXBMFYSA-N 1 2 315.417 4.041 20 0 DIADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2nc(CC3CC3)no2)o1 ZINC001307489712 1065435372 /nfs/dbraw/zinc/43/53/72/1065435372.db2.gz MIIUPOPXJWVNDE-HNNXBMFYSA-N 1 2 315.417 4.041 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2CC(=O)c2ccccc2F)o1 ZINC001307498583 1065441800 /nfs/dbraw/zinc/44/18/00/1065441800.db2.gz YRSDYYJCGZWLCK-SUMWQHHRSA-N 1 2 315.388 4.383 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2CC(=O)c2ccccc2F)o1 ZINC001307498583 1065441806 /nfs/dbraw/zinc/44/18/06/1065441806.db2.gz YRSDYYJCGZWLCK-SUMWQHHRSA-N 1 2 315.388 4.383 20 0 DIADLO Clc1ccc(-n2ccc(C[N@@H+]3CC[C@@H]3c3ccccc3)n2)cc1 ZINC001307513248 1065452581 /nfs/dbraw/zinc/45/25/81/1065452581.db2.gz JGSYQGSHZJGJQV-LJQANCHMSA-N 1 2 323.827 4.473 20 0 DIADLO Clc1ccc(-n2ccc(C[N@H+]3CC[C@@H]3c3ccccc3)n2)cc1 ZINC001307513248 1065452587 /nfs/dbraw/zinc/45/25/87/1065452587.db2.gz JGSYQGSHZJGJQV-LJQANCHMSA-N 1 2 323.827 4.473 20 0 DIADLO C[C@@H]1c2cc(Cl)cc(Cl)c2CC[N@H+]1CCOCC1CC1 ZINC001307529342 1065467438 /nfs/dbraw/zinc/46/74/38/1065467438.db2.gz JKZAMEQLDDEITJ-LLVKDONJSA-N 1 2 314.256 4.339 20 0 DIADLO C[C@@H]1c2cc(Cl)cc(Cl)c2CC[N@@H+]1CCOCC1CC1 ZINC001307529342 1065467440 /nfs/dbraw/zinc/46/74/40/1065467440.db2.gz JKZAMEQLDDEITJ-LLVKDONJSA-N 1 2 314.256 4.339 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1noc2c1CC(C)(C)CC2 ZINC001307551607 1065479062 /nfs/dbraw/zinc/47/90/62/1065479062.db2.gz JXHOICGNCGVNNG-CYBMUJFWSA-N 1 2 314.429 4.088 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1noc2c1CC(C)(C)CC2 ZINC001307551607 1065479066 /nfs/dbraw/zinc/47/90/66/1065479066.db2.gz JXHOICGNCGVNNG-CYBMUJFWSA-N 1 2 314.429 4.088 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1cc(F)ccc1OC(F)F ZINC001307562585 1065483857 /nfs/dbraw/zinc/48/38/57/1065483857.db2.gz MFPUDPXVPQLBLJ-OAHLLOKOSA-N 1 2 324.346 4.103 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1cc(F)ccc1OC(F)F ZINC001307562585 1065483860 /nfs/dbraw/zinc/48/38/60/1065483860.db2.gz MFPUDPXVPQLBLJ-OAHLLOKOSA-N 1 2 324.346 4.103 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1Cc1cccc(Cl)n1 ZINC001307589260 1065500128 /nfs/dbraw/zinc/50/01/28/1065500128.db2.gz UUQKJEDTUCJPDO-VXGBXAGGSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1Cc1cccc(Cl)n1 ZINC001307589260 1065500136 /nfs/dbraw/zinc/50/01/36/1065500136.db2.gz UUQKJEDTUCJPDO-VXGBXAGGSA-N 1 2 304.796 4.382 20 0 DIADLO Cc1cc(C[NH2+][C@@H](c2cccc(Cl)c2)c2ccccn2)ccn1 ZINC001307599179 1065506165 /nfs/dbraw/zinc/50/61/65/1065506165.db2.gz GVTGXCIPLNUXEF-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2noc3c2CCCC3)C2CC2)c(F)c1 ZINC001307617096 1065520367 /nfs/dbraw/zinc/52/03/67/1065520367.db2.gz CACQSOFXDXBNGK-SFHVURJKSA-N 1 2 318.367 4.073 20 0 DIADLO Fc1cccc(F)c1C[N@H+](CCSC(F)(F)F)C1CC1 ZINC001307676947 1065557024 /nfs/dbraw/zinc/55/70/24/1065557024.db2.gz HBZWEZVCTZJFHW-UHFFFAOYSA-N 1 2 311.319 4.182 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](CCSC(F)(F)F)C1CC1 ZINC001307676947 1065557038 /nfs/dbraw/zinc/55/70/38/1065557038.db2.gz HBZWEZVCTZJFHW-UHFFFAOYSA-N 1 2 311.319 4.182 20 0 DIADLO CC[C@@]1(C)C[N@@H+]([C@H](C)c2ccc(Br)cc2)CCO1 ZINC001307688068 1065563725 /nfs/dbraw/zinc/56/37/25/1065563725.db2.gz KGFISPDOZZHQIT-DOMZBBRYSA-N 1 2 312.251 4.011 20 0 DIADLO CC[C@@]1(C)C[N@H+]([C@H](C)c2ccc(Br)cc2)CCO1 ZINC001307688068 1065563733 /nfs/dbraw/zinc/56/37/33/1065563733.db2.gz KGFISPDOZZHQIT-DOMZBBRYSA-N 1 2 312.251 4.011 20 0 DIADLO CN(C)c1cc(CN2CCc3cc(C(C)(C)C)ccc32)cc[nH+]1 ZINC001307704250 1065572703 /nfs/dbraw/zinc/57/27/03/1065572703.db2.gz BRJCMONRWOKULF-UHFFFAOYSA-N 1 2 309.457 4.008 20 0 DIADLO CC1=CCC[N@H+](Cc2ccc(Br)c(Cl)c2)C1 ZINC001307723417 1065587241 /nfs/dbraw/zinc/58/72/41/1065587241.db2.gz FFUFRTASTUYRKO-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO CC1=CCC[N@@H+](Cc2ccc(Br)c(Cl)c2)C1 ZINC001307723417 1065587250 /nfs/dbraw/zinc/58/72/50/1065587250.db2.gz FFUFRTASTUYRKO-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO C[C@H]1COC(C)(C)C[N@@H+]1CCc1cccc(Cl)c1Cl ZINC001307740218 1065596177 /nfs/dbraw/zinc/59/61/77/1065596177.db2.gz MXVGVYJIGUMZIK-NSHDSACASA-N 1 2 302.245 4.035 20 0 DIADLO C[C@H]1COC(C)(C)C[N@H+]1CCc1cccc(Cl)c1Cl ZINC001307740218 1065596189 /nfs/dbraw/zinc/59/61/89/1065596189.db2.gz MXVGVYJIGUMZIK-NSHDSACASA-N 1 2 302.245 4.035 20 0 DIADLO C[C@H]1CC[C@H](c2ccccc2)[N@H+](Cc2cc(Cl)n(C)n2)C1 ZINC001307756459 1065607333 /nfs/dbraw/zinc/60/73/33/1065607333.db2.gz NWNZYEITTDOLKL-XJKSGUPXSA-N 1 2 303.837 4.047 20 0 DIADLO C[C@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2cc(Cl)n(C)n2)C1 ZINC001307756459 1065607338 /nfs/dbraw/zinc/60/73/38/1065607338.db2.gz NWNZYEITTDOLKL-XJKSGUPXSA-N 1 2 303.837 4.047 20 0 DIADLO CCCC[C@H](CC)C[NH2+][C@](CC)(C(=O)OC)c1ccccc1 ZINC001307759589 1065608909 /nfs/dbraw/zinc/60/89/09/1065608909.db2.gz AGDKVLPHUFIZGK-LPHOPBHVSA-N 1 2 305.462 4.271 20 0 DIADLO C[C@H]1CC(C)(C)C[N@@H+]1Cc1ccc(Br)c(F)c1F ZINC001307845622 1065649920 /nfs/dbraw/zinc/64/99/20/1065649920.db2.gz OGENHCPCAHGFJL-VIFPVBQESA-N 1 2 318.205 4.348 20 0 DIADLO C[C@H]1CC(C)(C)C[N@H+]1Cc1ccc(Br)c(F)c1F ZINC001307845622 1065649930 /nfs/dbraw/zinc/64/99/30/1065649930.db2.gz OGENHCPCAHGFJL-VIFPVBQESA-N 1 2 318.205 4.348 20 0 DIADLO CC[C@@H]1C[NH+]([C@H](C)c2ncc(-c3ccccc3)o2)C[C@@H](CC)O1 ZINC001307856522 1065656275 /nfs/dbraw/zinc/65/62/75/1065656275.db2.gz LPGHJAHJYGYWDS-DJIMGWMZSA-N 1 2 314.429 4.292 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(Cl)c2F)CC2(CCCCC2)O1 ZINC001307884830 1065666579 /nfs/dbraw/zinc/66/65/79/1065666579.db2.gz FCYXVXHXHNMVDW-ZDUSSCGKSA-N 1 2 311.828 4.403 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(Cl)c2F)CC2(CCCCC2)O1 ZINC001307884830 1065666585 /nfs/dbraw/zinc/66/65/85/1065666585.db2.gz FCYXVXHXHNMVDW-ZDUSSCGKSA-N 1 2 311.828 4.403 20 0 DIADLO COc1c(C)c[nH+]c(CN[C@H](C(F)F)C2CCCCC2)c1C ZINC001307945544 1065693160 /nfs/dbraw/zinc/69/31/60/1065693160.db2.gz QYRLETYOCDUGLB-HNNXBMFYSA-N 1 2 312.404 4.011 20 0 DIADLO CCC(CC)CCC[N@H+](C)[C@@H](C(=O)OC)c1cccc(OC)c1 ZINC001307970397 1065703817 /nfs/dbraw/zinc/70/38/17/1065703817.db2.gz ZNHXNDFHLJSAFP-GOSISDBHSA-N 1 2 321.461 4.058 20 0 DIADLO CCC(CC)CCC[N@@H+](C)[C@@H](C(=O)OC)c1cccc(OC)c1 ZINC001307970397 1065703822 /nfs/dbraw/zinc/70/38/22/1065703822.db2.gz ZNHXNDFHLJSAFP-GOSISDBHSA-N 1 2 321.461 4.058 20 0 DIADLO CC1(C)[C@H]2[C@H](CCC[N@@H+]2Cc2cc(Cl)sc2Cl)[C@@H]1O ZINC001307998315 1065717933 /nfs/dbraw/zinc/71/79/33/1065717933.db2.gz LNBATDAOCNBKIZ-WCQGTBRESA-N 1 2 320.285 4.036 20 0 DIADLO CC1(C)[C@H]2[C@H](CCC[N@H+]2Cc2cc(Cl)sc2Cl)[C@@H]1O ZINC001307998315 1065717945 /nfs/dbraw/zinc/71/79/45/1065717945.db2.gz LNBATDAOCNBKIZ-WCQGTBRESA-N 1 2 320.285 4.036 20 0 DIADLO COc1c(C)c[nH+]c(CN2C[C@H](C)Cc3cccc(F)c32)c1C ZINC001308020727 1065726639 /nfs/dbraw/zinc/72/66/39/1065726639.db2.gz XQUPMHOCGXTRHM-GFCCVEGCSA-N 1 2 314.404 4.045 20 0 DIADLO CC(C)COC(=O)C[N@@H+]1CC[C@@H](c2ccccc2Cl)C1(C)C ZINC001308033407 1065733775 /nfs/dbraw/zinc/73/37/75/1065733775.db2.gz BINSNKRFAZPGOK-HNNXBMFYSA-N 1 2 323.864 4.107 20 0 DIADLO CC(C)COC(=O)C[N@H+]1CC[C@@H](c2ccccc2Cl)C1(C)C ZINC001308033407 1065733785 /nfs/dbraw/zinc/73/37/85/1065733785.db2.gz BINSNKRFAZPGOK-HNNXBMFYSA-N 1 2 323.864 4.107 20 0 DIADLO Cc1ccc(C[N@@H+](CCCC(C)C)Cc2snnc2C)o1 ZINC001308074885 1065752935 /nfs/dbraw/zinc/75/29/35/1065752935.db2.gz IATBKOYGCPNBJA-UHFFFAOYSA-N 1 2 307.463 4.186 20 0 DIADLO Cc1ccc(C[N@H+](CCCC(C)C)Cc2snnc2C)o1 ZINC001308074885 1065752949 /nfs/dbraw/zinc/75/29/49/1065752949.db2.gz IATBKOYGCPNBJA-UHFFFAOYSA-N 1 2 307.463 4.186 20 0 DIADLO Fc1cncc(F)c1C[N@@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC001308123126 1065772218 /nfs/dbraw/zinc/77/22/18/1065772218.db2.gz ULHGEZLPTCMFOL-WHLNPGIBSA-N 1 2 300.352 4.038 20 0 DIADLO Fc1cncc(F)c1C[N@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC001308123126 1065772226 /nfs/dbraw/zinc/77/22/26/1065772226.db2.gz ULHGEZLPTCMFOL-WHLNPGIBSA-N 1 2 300.352 4.038 20 0 DIADLO FC1(C2CC2)CC[NH+](Cc2c(Cl)cncc2Cl)CC1 ZINC001308130853 1065772415 /nfs/dbraw/zinc/77/24/15/1065772415.db2.gz CJVIYGDVEKKKJI-UHFFFAOYSA-N 1 2 303.208 4.103 20 0 DIADLO Cc1cccc(C2=CC[N@H+]([C@H](C)C(=O)OC(C)(C)C)CC2)c1C ZINC001308146964 1065780035 /nfs/dbraw/zinc/78/00/35/1065780035.db2.gz RKNBAWXAYVPOKP-MRXNPFEDSA-N 1 2 315.457 4.123 20 0 DIADLO Cc1cccc(C2=CC[N@@H+]([C@H](C)C(=O)OC(C)(C)C)CC2)c1C ZINC001308146964 1065780045 /nfs/dbraw/zinc/78/00/45/1065780045.db2.gz RKNBAWXAYVPOKP-MRXNPFEDSA-N 1 2 315.457 4.123 20 0 DIADLO CCc1nc(C[NH2+][C@@H](c2nc3ccccc3[nH]2)C(C)C)cs1 ZINC001308201535 1065809323 /nfs/dbraw/zinc/80/93/23/1065809323.db2.gz LBHBVCWOPVTCIA-MRXNPFEDSA-N 1 2 314.458 4.069 20 0 DIADLO Fc1ccc(C[NH2+]Cc2c(F)cccc2Cl)c(F)c1F ZINC001308231679 1065839504 /nfs/dbraw/zinc/83/95/04/1065839504.db2.gz MBZILEIMMBBUIP-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO CCNc1ccccc1C[NH2+][C@H](c1nccs1)c1ccccc1 ZINC001308235582 1065843144 /nfs/dbraw/zinc/84/31/44/1065843144.db2.gz DIXZDOIAOJLVGH-SFHVURJKSA-N 1 2 323.465 4.454 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+]Cc3cccc(O)c3)cs2)cc1 ZINC001308243172 1065848575 /nfs/dbraw/zinc/84/85/75/1065848575.db2.gz KFGVIGVCVZEMNC-UHFFFAOYSA-N 1 2 310.422 4.114 20 0 DIADLO Fc1ccc(F)c(C[NH2+][C@H](c2ccccc2)c2cccnc2)c1 ZINC001308244231 1065850076 /nfs/dbraw/zinc/85/00/76/1065850076.db2.gz KIFXGRLHBZUAFQ-LJQANCHMSA-N 1 2 310.347 4.239 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+]Cc1c(F)cc(C)cc1F ZINC001308272791 1065873101 /nfs/dbraw/zinc/87/31/01/1065873101.db2.gz QIZVTEZLDVHFEW-UHFFFAOYSA-N 1 2 311.759 4.225 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+]Cc1c(C)cccc1F ZINC001308285886 1065883382 /nfs/dbraw/zinc/88/33/82/1065883382.db2.gz RHIHNCJANNBKDE-UHFFFAOYSA-N 1 2 316.401 4.449 20 0 DIADLO CCC(CC)c1cc(C[NH2+]Cc2ccccc2OC(F)F)on1 ZINC001308290169 1065886390 /nfs/dbraw/zinc/88/63/90/1065886390.db2.gz GPOZKXVBYYJEAU-UHFFFAOYSA-N 1 2 324.371 4.469 20 0 DIADLO Cc1coc(-c2ccc(C)c(NCc3cccc4[nH+]ccn43)c2)n1 ZINC001308317790 1065909528 /nfs/dbraw/zinc/90/95/28/1065909528.db2.gz FIGZFDIYHKBQGJ-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO CCCCCOc1cc(C)ccc1C[NH2+]Cc1nccs1 ZINC001308330322 1065918336 /nfs/dbraw/zinc/91/83/36/1065918336.db2.gz LJKLJUNFIYUFDE-UHFFFAOYSA-N 1 2 304.459 4.310 20 0 DIADLO COc1cc[nH+]cc1NCc1ccc(-c2cccc(F)c2F)o1 ZINC001308340137 1065925417 /nfs/dbraw/zinc/92/54/17/1065925417.db2.gz IDSZXSIHNCAJTR-UHFFFAOYSA-N 1 2 316.307 4.241 20 0 DIADLO Cc1ccc(NCc2cccc3[nH+]ccn32)c(Br)c1 ZINC001308357119 1065937254 /nfs/dbraw/zinc/93/72/54/1065937254.db2.gz QRQOXQYDBIVEEZ-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO Fc1ccc(C[NH2+]Cc2ccc(Cl)cc2F)c(F)c1F ZINC001308377782 1065951531 /nfs/dbraw/zinc/95/15/31/1065951531.db2.gz FGXQTCSYQXIBBU-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO CC(C)(C)c1ncc(CNc2c[nH+]cc3c2CCCC3)s1 ZINC001308464820 1066005702 /nfs/dbraw/zinc/00/57/02/1066005702.db2.gz YABPLJMYCUAIPY-UHFFFAOYSA-N 1 2 301.459 4.327 20 0 DIADLO CCC(F)(F)C[NH2+]Cc1ccc(-n2cnc3ccccc32)cc1 ZINC001308466114 1066007460 /nfs/dbraw/zinc/00/74/60/1066007460.db2.gz SVGSJQBERYYOMB-UHFFFAOYSA-N 1 2 315.367 4.160 20 0 DIADLO CC(C)(C)C(F)(F)C[NH2+]Cc1cccc(Br)c1 ZINC001308470438 1066009824 /nfs/dbraw/zinc/00/98/24/1066009824.db2.gz INVNBQQYRCNRKU-UHFFFAOYSA-N 1 2 306.194 4.220 20 0 DIADLO CCn1nc(C[NH2+][C@@H]2c3ccccc3CC[C@@H]2F)c2ccccc21 ZINC001308498988 1066028925 /nfs/dbraw/zinc/02/89/25/1066028925.db2.gz CEAOBGIYNQQAMH-FXAWDEMLSA-N 1 2 323.415 4.171 20 0 DIADLO Cc1ccc(COc2ccc(C[NH2+][C@@H](C)C(F)F)cc2)cc1 ZINC001308501620 1066030811 /nfs/dbraw/zinc/03/08/11/1066030811.db2.gz TYWXAJKGCZECOP-AWEZNQCLSA-N 1 2 305.368 4.317 20 0 DIADLO O=c1ccc(CNc2[nH+]c3ccccc3n2C2CCCCC2)c[nH]1 ZINC001308506368 1066034001 /nfs/dbraw/zinc/03/40/01/1066034001.db2.gz UWGTYAWAZQRRIV-UHFFFAOYSA-N 1 2 322.412 4.254 20 0 DIADLO Clc1ccc(Cl)c(C[NH2+]Cc2noc3ccccc23)c1 ZINC001308518536 1066040086 /nfs/dbraw/zinc/04/00/86/1066040086.db2.gz GFHVYVXSKDQXSQ-UHFFFAOYSA-N 1 2 307.180 4.424 20 0 DIADLO CCCOc1cccc(C[NH2+][C@H]2c3ccccc3OC[C@H]2F)c1 ZINC001308521648 1066044373 /nfs/dbraw/zinc/04/43/73/1066044373.db2.gz WPXIVKCDGLDIFF-MJGOQNOKSA-N 1 2 315.388 4.037 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Cl)cc2c1OCC2)c1c(F)cccc1F ZINC001308528121 1066047074 /nfs/dbraw/zinc/04/70/74/1066047074.db2.gz GDLUJQNZEXOWFY-JTQLQIEISA-N 1 2 323.770 4.404 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308574429 1066086969 /nfs/dbraw/zinc/08/69/69/1066086969.db2.gz VSZLETLKCNGSAN-XHDPSFHLSA-N 1 2 321.342 4.393 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308574429 1066086981 /nfs/dbraw/zinc/08/69/81/1066086981.db2.gz VSZLETLKCNGSAN-XHDPSFHLSA-N 1 2 321.342 4.393 20 0 DIADLO CCc1cc(OC)ccc1C[N@@H+]1CCc2c(F)ccc(F)c2C1 ZINC001308573216 1066087072 /nfs/dbraw/zinc/08/70/72/1066087072.db2.gz IYGZJNXGDNUAGT-UHFFFAOYSA-N 1 2 317.379 4.094 20 0 DIADLO CCc1cc(OC)ccc1C[N@H+]1CCc2c(F)ccc(F)c2C1 ZINC001308573216 1066087083 /nfs/dbraw/zinc/08/70/83/1066087083.db2.gz IYGZJNXGDNUAGT-UHFFFAOYSA-N 1 2 317.379 4.094 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2nccn2C2CC2)o1 ZINC001308578831 1066092875 /nfs/dbraw/zinc/09/28/75/1066092875.db2.gz QTQPRHZSGSPXNI-YOEHRIQHSA-N 1 2 313.445 4.347 20 0 DIADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2nccn2C2CC2)o1 ZINC001308578831 1066092885 /nfs/dbraw/zinc/09/28/85/1066092885.db2.gz QTQPRHZSGSPXNI-YOEHRIQHSA-N 1 2 313.445 4.347 20 0 DIADLO CCCn1cc(C[N@H+](CC)[C@@H](C)c2cc3ccccc3o2)nn1 ZINC001308592219 1066105070 /nfs/dbraw/zinc/10/50/70/1066105070.db2.gz ZOHFYDVROFHNMY-AWEZNQCLSA-N 1 2 312.417 4.017 20 0 DIADLO CCCn1cc(C[N@@H+](CC)[C@@H](C)c2cc3ccccc3o2)nn1 ZINC001308592219 1066105075 /nfs/dbraw/zinc/10/50/75/1066105075.db2.gz ZOHFYDVROFHNMY-AWEZNQCLSA-N 1 2 312.417 4.017 20 0 DIADLO CCOC(=O)[C@H]1CCCC[N@@H+]1C/C=C/c1cc(C)c(C)cc1C ZINC001308598557 1066108853 /nfs/dbraw/zinc/10/88/53/1066108853.db2.gz RNRZYVWAOQRNBW-CSHXORCISA-N 1 2 315.457 4.043 20 0 DIADLO CCOC(=O)[C@H]1CCCC[N@H+]1C/C=C/c1cc(C)c(C)cc1C ZINC001308598557 1066108857 /nfs/dbraw/zinc/10/88/57/1066108857.db2.gz RNRZYVWAOQRNBW-CSHXORCISA-N 1 2 315.457 4.043 20 0 DIADLO CCOC(=O)[C@H]1CCCC[N@@H+]1C/C=C\c1cc(C)c(C)cc1C ZINC001308598566 1066109142 /nfs/dbraw/zinc/10/91/42/1066109142.db2.gz RNRZYVWAOQRNBW-OLHLWXQYSA-N 1 2 315.457 4.043 20 0 DIADLO CCOC(=O)[C@H]1CCCC[N@H+]1C/C=C\c1cc(C)c(C)cc1C ZINC001308598566 1066109145 /nfs/dbraw/zinc/10/91/45/1066109145.db2.gz RNRZYVWAOQRNBW-OLHLWXQYSA-N 1 2 315.457 4.043 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ncc(C(C)(C)C)s1 ZINC001308600617 1066110033 /nfs/dbraw/zinc/11/00/33/1066110033.db2.gz LXMKGEDJVDBFOT-CYBMUJFWSA-N 1 2 300.471 4.387 20 0 DIADLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ncc(C(C)(C)C)s1 ZINC001308600617 1066110038 /nfs/dbraw/zinc/11/00/38/1066110038.db2.gz LXMKGEDJVDBFOT-CYBMUJFWSA-N 1 2 300.471 4.387 20 0 DIADLO CC(C)CO[C@H]1CC[N@H+](Cc2ccc(F)c(Cl)c2Cl)C1 ZINC001308602616 1066111524 /nfs/dbraw/zinc/11/15/24/1066111524.db2.gz DZGHBVDBRKJXHG-LBPRGKRZSA-N 1 2 320.235 4.379 20 0 DIADLO CC(C)CO[C@H]1CC[N@@H+](Cc2ccc(F)c(Cl)c2Cl)C1 ZINC001308602616 1066111529 /nfs/dbraw/zinc/11/15/29/1066111529.db2.gz DZGHBVDBRKJXHG-LBPRGKRZSA-N 1 2 320.235 4.379 20 0 DIADLO Cc1nn(-c2ccccc2Cl)cc1C[N@H+](C)Cc1ccoc1 ZINC001308610083 1066115789 /nfs/dbraw/zinc/11/57/89/1066115789.db2.gz CGDCAZCBAJQOTD-UHFFFAOYSA-N 1 2 315.804 4.059 20 0 DIADLO Cc1nn(-c2ccccc2Cl)cc1C[N@@H+](C)Cc1ccoc1 ZINC001308610083 1066115793 /nfs/dbraw/zinc/11/57/93/1066115793.db2.gz CGDCAZCBAJQOTD-UHFFFAOYSA-N 1 2 315.804 4.059 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1nccc2c1CCCC2 ZINC001308613600 1066119684 /nfs/dbraw/zinc/11/96/84/1066119684.db2.gz GNPKGZBVVADHME-ZDUSSCGKSA-N 1 2 316.395 4.432 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1nccc2c1CCCC2 ZINC001308613600 1066119688 /nfs/dbraw/zinc/11/96/88/1066119688.db2.gz GNPKGZBVVADHME-ZDUSSCGKSA-N 1 2 316.395 4.432 20 0 DIADLO CCCn1c[nH+]cc1CN(C)[C@H](C)c1nc2ccccc2s1 ZINC001308626757 1066124622 /nfs/dbraw/zinc/12/46/22/1066124622.db2.gz VNNKYABDJVQGPI-CYBMUJFWSA-N 1 2 314.458 4.096 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cnc(CCc3ccccc3)s2)C[C@H]1F ZINC001308642150 1066134099 /nfs/dbraw/zinc/13/40/99/1066134099.db2.gz OSAQFTUJWWULFR-WMLDXEAASA-N 1 2 318.461 4.108 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cnc(CCc3ccccc3)s2)C[C@H]1F ZINC001308642150 1066134103 /nfs/dbraw/zinc/13/41/03/1066134103.db2.gz OSAQFTUJWWULFR-WMLDXEAASA-N 1 2 318.461 4.108 20 0 DIADLO COc1nc(C[N@H+](C)[C@H](C)c2ccccc2Cl)ccc1C ZINC001308649041 1066136920 /nfs/dbraw/zinc/13/69/20/1066136920.db2.gz GYSRZHBHYNGAEQ-CYBMUJFWSA-N 1 2 304.821 4.245 20 0 DIADLO COc1nc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)ccc1C ZINC001308649041 1066136923 /nfs/dbraw/zinc/13/69/23/1066136923.db2.gz GYSRZHBHYNGAEQ-CYBMUJFWSA-N 1 2 304.821 4.245 20 0 DIADLO Fc1cccnc1C[N@H+](Cc1ccccc1C(F)(F)F)C1CC1 ZINC001308663669 1066143451 /nfs/dbraw/zinc/14/34/51/1066143451.db2.gz RXNJNGWEYLJKBM-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO Fc1cccnc1C[N@@H+](Cc1ccccc1C(F)(F)F)C1CC1 ZINC001308663669 1066143456 /nfs/dbraw/zinc/14/34/56/1066143456.db2.gz RXNJNGWEYLJKBM-UHFFFAOYSA-N 1 2 324.321 4.404 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NC1CC(c2cccc(F)c2)C1 ZINC001308693262 1066183863 /nfs/dbraw/zinc/18/38/63/1066183863.db2.gz AGGVDFADMDNBSU-UHFFFAOYSA-N 1 2 300.377 4.366 20 0 DIADLO CCOC(=O)[C@H](C)[N@H+](Cc1cccc(C2CCCC2)c1)C1CC1 ZINC001308694927 1066185242 /nfs/dbraw/zinc/18/52/42/1066185242.db2.gz JPCPGCAREIGIHV-HNNXBMFYSA-N 1 2 315.457 4.260 20 0 DIADLO CCOC(=O)[C@H](C)[N@@H+](Cc1cccc(C2CCCC2)c1)C1CC1 ZINC001308694927 1066185246 /nfs/dbraw/zinc/18/52/46/1066185246.db2.gz JPCPGCAREIGIHV-HNNXBMFYSA-N 1 2 315.457 4.260 20 0 DIADLO CC[C@]1(C)CCC[C@@H]1Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001308732617 1066206196 /nfs/dbraw/zinc/20/61/96/1066206196.db2.gz SIDHKMNGZKJHPM-RIVXBTQJSA-N 1 2 317.477 4.076 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@H+](Cc1ccccn1)C1CC1 ZINC001308745780 1066220006 /nfs/dbraw/zinc/22/00/06/1066220006.db2.gz FIIODEAYDDMTNG-UHFFFAOYSA-N 1 2 316.832 4.298 20 0 DIADLO CCOc1ccc(Cl)cc1C[N@@H+](Cc1ccccn1)C1CC1 ZINC001308745780 1066220019 /nfs/dbraw/zinc/22/00/19/1066220019.db2.gz FIIODEAYDDMTNG-UHFFFAOYSA-N 1 2 316.832 4.298 20 0 DIADLO CSc1cccc(F)c1C[NH2+]Cc1c(Cl)ccnc1F ZINC001308759344 1066230442 /nfs/dbraw/zinc/23/04/42/1066230442.db2.gz YCPRTMJDYDWLLV-UHFFFAOYSA-N 1 2 314.788 4.025 20 0 DIADLO COc1cc(F)cc(OC)c1C[N@@H+]1CCc2sccc2[C@@H]1C ZINC001308805179 1066282955 /nfs/dbraw/zinc/28/29/55/1066282955.db2.gz YYEIYBGKGRQRFP-NSHDSACASA-N 1 2 321.417 4.024 20 0 DIADLO COc1cc(F)cc(OC)c1C[N@H+]1CCc2sccc2[C@@H]1C ZINC001308805179 1066282969 /nfs/dbraw/zinc/28/29/69/1066282969.db2.gz YYEIYBGKGRQRFP-NSHDSACASA-N 1 2 321.417 4.024 20 0 DIADLO Cc1c(Cl)cccc1C[N@@H+]([C@@H](C)C(=O)OC(C)(C)C)C1CC1 ZINC001308814078 1066288502 /nfs/dbraw/zinc/28/85/02/1066288502.db2.gz XREYCMYPMJDLJX-ZDUSSCGKSA-N 1 2 323.864 4.343 20 0 DIADLO Cc1c(Cl)cccc1C[N@H+]([C@@H](C)C(=O)OC(C)(C)C)C1CC1 ZINC001308814078 1066288509 /nfs/dbraw/zinc/28/85/09/1066288509.db2.gz XREYCMYPMJDLJX-ZDUSSCGKSA-N 1 2 323.864 4.343 20 0 DIADLO CC[N@H+](Cc1nc2c(s1)C[C@@H](C)CC2)Cc1occc1C ZINC001308822250 1066295205 /nfs/dbraw/zinc/29/52/05/1066295205.db2.gz BFGCSACHQTXIDL-LBPRGKRZSA-N 1 2 304.459 4.191 20 0 DIADLO CC[N@@H+](Cc1nc2c(s1)C[C@@H](C)CC2)Cc1occc1C ZINC001308822250 1066295224 /nfs/dbraw/zinc/29/52/24/1066295224.db2.gz BFGCSACHQTXIDL-LBPRGKRZSA-N 1 2 304.459 4.191 20 0 DIADLO Cc1scc(C[N@H+](CC(=O)OC(C)(C)C)C2CCC2)c1C ZINC001308842866 1066318627 /nfs/dbraw/zinc/31/86/27/1066318627.db2.gz XYMMIAZCWQXJJD-UHFFFAOYSA-N 1 2 309.475 4.061 20 0 DIADLO Cc1scc(C[N@@H+](CC(=O)OC(C)(C)C)C2CCC2)c1C ZINC001308842866 1066318645 /nfs/dbraw/zinc/31/86/45/1066318645.db2.gz XYMMIAZCWQXJJD-UHFFFAOYSA-N 1 2 309.475 4.061 20 0 DIADLO FC(F)[C@@H](CCc1ccccc1)[NH2+]C[C@@H]1CC1(Cl)Cl ZINC001308862790 1066341259 /nfs/dbraw/zinc/34/12/59/1066341259.db2.gz IGKANIIHUZLZEU-NWDGAFQWSA-N 1 2 308.199 4.036 20 0 DIADLO CO[C@H](c1ccccc1)[C@@H](C)[NH2+]CC(F)(F)c1ccc(F)cc1 ZINC001308880378 1066360587 /nfs/dbraw/zinc/36/05/87/1066360587.db2.gz LQJVZBIBXVKLRH-DYVFJYSZSA-N 1 2 323.358 4.283 20 0 DIADLO CCOC(=O)[C@H](CCCC(C)C)[NH2+]C[C@H]1C[C@H]1c1ccccc1 ZINC001308935250 1066406486 /nfs/dbraw/zinc/40/64/86/1066406486.db2.gz NZGVJXZKTZHNHH-QYZOEREBSA-N 1 2 317.473 4.138 20 0 DIADLO CCOC(=O)[C@H](CCCC(C)C)[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC001308935249 1066407150 /nfs/dbraw/zinc/40/71/50/1066407150.db2.gz NZGVJXZKTZHNHH-QRVBRYPASA-N 1 2 317.473 4.138 20 0 DIADLO Cc1cn2cc(NC(=O)NCCCCC3CCCC3)ccc2[nH+]1 ZINC001310255264 1066504884 /nfs/dbraw/zinc/50/48/84/1066504884.db2.gz KUYJRYLNYYYQHD-UHFFFAOYSA-N 1 2 314.433 4.125 20 0 DIADLO CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001310674627 1066550000 /nfs/dbraw/zinc/55/00/00/1066550000.db2.gz HRWWSUPVZLKMPR-HUUCEWRRSA-N 1 2 314.433 4.061 20 0 DIADLO Cc1cc(CNC(=O)N2CCCCC[C@@H]2CC(C)C)cc(C)[nH+]1 ZINC001312891024 1066878178 /nfs/dbraw/zinc/87/81/78/1066878178.db2.gz NSWIBLUWGCKJQR-GOSISDBHSA-N 1 2 317.477 4.199 20 0 DIADLO CC(C)c1noc([C@@H](C)[NH2+][C@@H](C)c2ccc3c(c2)CCCC3)n1 ZINC000079291087 185163468 /nfs/dbraw/zinc/16/34/68/185163468.db2.gz CNABWMNDTNFPQN-UONOGXRCSA-N 1 2 313.445 4.484 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2sccc2Br)cs1 ZINC000087574951 185228620 /nfs/dbraw/zinc/22/86/20/185228620.db2.gz XJPRKKGELFWUDI-ZETCQYMHSA-N 1 2 317.277 4.126 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1nc2c(s1)CCCC2 ZINC000090458777 185297512 /nfs/dbraw/zinc/29/75/12/185297512.db2.gz FMCNGYKNXUUVQL-SNVBAGLBSA-N 1 2 319.499 4.207 20 0 DIADLO Cn1cc[nH+]c1CNc1ccccc1Oc1ccccc1Cl ZINC000096982697 185395119 /nfs/dbraw/zinc/39/51/19/185395119.db2.gz LXLOFMMICQFECG-UHFFFAOYSA-N 1 2 313.788 4.478 20 0 DIADLO Fc1cc(F)c(C[NH+]2CCC(OC3CCCC3)CC2)cc1F ZINC000092759045 185338705 /nfs/dbraw/zinc/33/87/05/185338705.db2.gz IRTLPYQEBALWOI-UHFFFAOYSA-N 1 2 313.363 4.028 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cc3ccc(F)cc3nc2C)c(C)[nH+]1 ZINC000097040371 185401880 /nfs/dbraw/zinc/40/18/80/185401880.db2.gz BTWZZHZBHCXBTL-UHFFFAOYSA-N 1 2 323.371 4.255 20 0 DIADLO CC(C)(C)OC1CC[NH+](Cc2ccc(Cl)nc2Cl)CC1 ZINC000283215691 534969901 /nfs/dbraw/zinc/96/99/01/534969901.db2.gz SIRIPIGJPJYACU-UHFFFAOYSA-N 1 2 317.260 4.168 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc2ccccc2s1)c1nccs1 ZINC000072684379 191214597 /nfs/dbraw/zinc/21/45/97/191214597.db2.gz XIZSBFXKBHPLCI-HNNXBMFYSA-N 1 2 303.456 4.168 20 0 DIADLO C[C@@H]1CCC[C@H](C)N1C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000073321035 191304818 /nfs/dbraw/zinc/30/48/18/191304818.db2.gz NXNQMVYSUOVTIS-GASCZTMLSA-N 1 2 310.397 4.277 20 0 DIADLO CC[N@H+](Cc1nnc(-c2ccccc2)o1)[C@H](C)c1cccc(O)c1 ZINC000080931146 192203170 /nfs/dbraw/zinc/20/31/70/192203170.db2.gz FRUIFGPOMBYKAA-CQSZACIVSA-N 1 2 323.396 4.025 20 0 DIADLO CC[N@@H+](Cc1nnc(-c2ccccc2)o1)[C@H](C)c1cccc(O)c1 ZINC000080931146 192203173 /nfs/dbraw/zinc/20/31/73/192203173.db2.gz FRUIFGPOMBYKAA-CQSZACIVSA-N 1 2 323.396 4.025 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)c1nc2ccccc2n1C ZINC000091409485 193051709 /nfs/dbraw/zinc/05/17/09/193051709.db2.gz GXMIHXPIYABVET-VXGBXAGGSA-N 1 2 315.367 4.263 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nccs2)c(OC(C)(C)C)c1 ZINC000091734859 193099059 /nfs/dbraw/zinc/09/90/59/193099059.db2.gz HUQGQKAZEWYFKW-CYBMUJFWSA-N 1 2 304.459 4.480 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000092224246 193176569 /nfs/dbraw/zinc/17/65/69/193176569.db2.gz UKAUDRQVISPKPN-OAHLLOKOSA-N 1 2 303.475 4.419 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000092224246 193176570 /nfs/dbraw/zinc/17/65/70/193176570.db2.gz UKAUDRQVISPKPN-OAHLLOKOSA-N 1 2 303.475 4.419 20 0 DIADLO CC(C)CCc1nc(C[N@H+](C)[C@@H](C)c2cccnc2)cs1 ZINC000093234257 193220132 /nfs/dbraw/zinc/22/01/32/193220132.db2.gz QJTHYKPRYBUKHA-AWEZNQCLSA-N 1 2 303.475 4.320 20 0 DIADLO CC(C)CCc1nc(C[N@@H+](C)[C@@H](C)c2cccnc2)cs1 ZINC000093234257 193220134 /nfs/dbraw/zinc/22/01/34/193220134.db2.gz QJTHYKPRYBUKHA-AWEZNQCLSA-N 1 2 303.475 4.320 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)Cc1c[nH]cn1 ZINC000093612719 193273555 /nfs/dbraw/zinc/27/35/55/193273555.db2.gz MLARWXKXQFZKHJ-ZDUSSCGKSA-N 1 2 312.442 4.035 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)Cc1c[nH]cn1 ZINC000093612719 193273557 /nfs/dbraw/zinc/27/35/57/193273557.db2.gz MLARWXKXQFZKHJ-ZDUSSCGKSA-N 1 2 312.442 4.035 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)Cc1cnc[nH]1 ZINC000093612719 193273558 /nfs/dbraw/zinc/27/35/58/193273558.db2.gz MLARWXKXQFZKHJ-ZDUSSCGKSA-N 1 2 312.442 4.035 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)Cc1cnc[nH]1 ZINC000093612719 193273560 /nfs/dbraw/zinc/27/35/60/193273560.db2.gz MLARWXKXQFZKHJ-ZDUSSCGKSA-N 1 2 312.442 4.035 20 0 DIADLO C[C@H]([NH2+]Cc1nc2ccccc2s1)c1ccc(F)cc1F ZINC000015484033 182004944 /nfs/dbraw/zinc/00/49/44/182004944.db2.gz OTBAPLUZBGMDQW-JTQLQIEISA-N 1 2 304.365 4.425 20 0 DIADLO Cc1ccc(C(C)C)cc1OCC(=O)Nc1c(C)cc[nH+]c1C ZINC000563806670 335018504 /nfs/dbraw/zinc/01/85/04/335018504.db2.gz DIMDCIVWQPAAQD-UHFFFAOYSA-N 1 2 312.413 4.148 20 0 DIADLO Cc1cc(C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)c(C)n1C(C)C ZINC000103967287 193968909 /nfs/dbraw/zinc/96/89/09/193968909.db2.gz VQOKADNGIUKHLK-UHFFFAOYSA-N 1 2 322.412 4.328 20 0 DIADLO Brc1cncc(C[N@H+]2CCC[C@@H]2c2ccsc2)c1 ZINC000298773407 532977434 /nfs/dbraw/zinc/97/74/34/532977434.db2.gz SNVSVZQEMNNRJT-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cncc(C[N@@H+]2CCC[C@@H]2c2ccsc2)c1 ZINC000298773407 532977429 /nfs/dbraw/zinc/97/74/29/532977429.db2.gz SNVSVZQEMNNRJT-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO c1cn(-c2ccc(CNc3ccc(-c4cnco4)cc3)cc2)c[nH+]1 ZINC000119693430 195018298 /nfs/dbraw/zinc/01/82/98/195018298.db2.gz DLHGOYZWVYSNDJ-UHFFFAOYSA-N 1 2 316.364 4.139 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(Br)cc1 ZINC000271838904 129970749 /nfs/dbraw/zinc/97/07/49/129970749.db2.gz UEVDJINGKDIUQD-SNVBAGLBSA-N 1 2 321.218 4.165 20 0 DIADLO Cc1ccc(N[C@H](C)c2ccc(NC(=O)NC(C)C)cc2)c[nH+]1 ZINC000272164383 130004161 /nfs/dbraw/zinc/00/41/61/130004161.db2.gz CAOZIULSWHEURF-CQSZACIVSA-N 1 2 312.417 4.093 20 0 DIADLO CCc1nnc(C[NH2+][C@H](c2ccccc2)c2ccc(C)cc2)s1 ZINC000272981281 130078568 /nfs/dbraw/zinc/07/85/68/130078568.db2.gz AWPHFSANDZXCKN-LJQANCHMSA-N 1 2 323.465 4.288 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)s1 ZINC000273011635 130081223 /nfs/dbraw/zinc/08/12/23/130081223.db2.gz AXVNLDSNOLVJKJ-LBPRGKRZSA-N 1 2 321.515 4.452 20 0 DIADLO O=C(c1ccc(-c2ccccc2)o1)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000273097718 130089316 /nfs/dbraw/zinc/08/93/16/130089316.db2.gz HJTYNVOQLVPWAO-HNNXBMFYSA-N 1 2 321.380 4.037 20 0 DIADLO COCC[C@H]([NH2+]Cc1csc(C2CCCC2)n1)c1ccco1 ZINC000273212671 130097999 /nfs/dbraw/zinc/09/79/99/130097999.db2.gz BXNYJFDLHGWYMF-HNNXBMFYSA-N 1 2 320.458 4.261 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2cc(-c3ccccc3)no2)cs1 ZINC000273243885 130100181 /nfs/dbraw/zinc/10/01/81/130100181.db2.gz AQGJOUZRQBQZJE-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO Fc1ccc([C@H]2C[C@@H](Nc3cc[nH+]c4ccncc34)CCO2)cc1 ZINC000273274543 130102177 /nfs/dbraw/zinc/10/21/77/130102177.db2.gz IBNOKSNBFAQWDL-HNAYVOBHSA-N 1 2 323.371 4.101 20 0 DIADLO CCOc1nnc(C[NH2+][C@H](C)c2cc3ccccc3s2)s1 ZINC000273308911 130104722 /nfs/dbraw/zinc/10/47/22/130104722.db2.gz OPVNVZBKPHYCFB-SNVBAGLBSA-N 1 2 319.455 4.002 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2ccccc2OC(C)C)cs1 ZINC000273424153 130120649 /nfs/dbraw/zinc/12/06/49/130120649.db2.gz VZUPMGGKAAATBR-CYBMUJFWSA-N 1 2 304.459 4.344 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(Oc3ccccc3)o2)s1 ZINC000273609406 130142884 /nfs/dbraw/zinc/14/28/84/130142884.db2.gz NZSDUPRJPUAYPN-NSHDSACASA-N 1 2 315.398 4.083 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1nc(Cl)ccc1Cl ZINC000274314931 130226284 /nfs/dbraw/zinc/22/62/84/130226284.db2.gz NIMMFDWKHHRIRC-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1nc(Cl)ccc1Cl ZINC000274314931 130226286 /nfs/dbraw/zinc/22/62/86/130226286.db2.gz NIMMFDWKHHRIRC-AWEZNQCLSA-N 1 2 310.228 4.064 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)n1 ZINC000274356565 130228750 /nfs/dbraw/zinc/22/87/50/130228750.db2.gz YKKHZUZESYAYTR-CQSZACIVSA-N 1 2 308.212 4.121 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CCC[C@@H]2c2ccncc2)n1 ZINC000274356565 130228752 /nfs/dbraw/zinc/22/87/52/130228752.db2.gz YKKHZUZESYAYTR-CQSZACIVSA-N 1 2 308.212 4.121 20 0 DIADLO CCn1nc(C[NH2+][C@@H](C)c2c(F)cccc2F)c2ccccc21 ZINC000274465544 130238247 /nfs/dbraw/zinc/23/82/47/130238247.db2.gz UIRBQJGCBFYLDZ-LBPRGKRZSA-N 1 2 315.367 4.185 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)cc(F)c1)c1nc(C(F)(F)F)cs1 ZINC000274666980 130254019 /nfs/dbraw/zinc/25/40/19/130254019.db2.gz XFGBJGSQHVSVRN-ZETCQYMHSA-N 1 2 322.302 4.291 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@H](C)c2ccc(Cl)cn2)on1 ZINC000274822211 130265466 /nfs/dbraw/zinc/26/54/66/130265466.db2.gz BSUHLQIMUUPXSR-LLVKDONJSA-N 1 2 307.825 4.477 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncn(C)n1)c1ccc(C2CCCCC2)cc1 ZINC000275802861 130389153 /nfs/dbraw/zinc/38/91/53/130389153.db2.gz YSTSHZGNNCTABF-CABCVRRESA-N 1 2 312.461 4.275 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@H](c3ccccc3F)C2)c(C)s1 ZINC000340187132 131033441 /nfs/dbraw/zinc/03/34/41/131033441.db2.gz YMPAXGQCHYUFGP-KRWDZBQOSA-N 1 2 305.418 4.078 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@H](c3ccccc3F)C2)c(C)s1 ZINC000340187132 131033442 /nfs/dbraw/zinc/03/34/42/131033442.db2.gz YMPAXGQCHYUFGP-KRWDZBQOSA-N 1 2 305.418 4.078 20 0 DIADLO Cc1c(CSC(C)C)cccc1NC(=O)C=Cc1c[nH]c[nH+]1 ZINC000283922024 131034176 /nfs/dbraw/zinc/03/41/76/131034176.db2.gz KAJRKWLGSVPMAJ-BQYQJAHWSA-N 1 2 315.442 4.012 20 0 DIADLO Cc1noc(C(C)(C)[NH2+]Cc2ccc(-c3ccccc3)cc2)n1 ZINC000283959933 131036204 /nfs/dbraw/zinc/03/62/04/131036204.db2.gz KNDNAKBQWRBUHK-UHFFFAOYSA-N 1 2 307.397 4.070 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)[C@@H](C)CC1CCCC1 ZINC000366641385 131165466 /nfs/dbraw/zinc/16/54/66/131165466.db2.gz BQZBTEJPHSCXDI-RDJZCZTQSA-N 1 2 317.477 4.173 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)[C@H](C)CC1CCCC1 ZINC000366641383 131166623 /nfs/dbraw/zinc/16/66/23/131166623.db2.gz BQZBTEJPHSCXDI-NVXWUHKLSA-N 1 2 317.477 4.173 20 0 DIADLO COc1ccc(CNc2[nH+]ccc3ccc(F)cc32)cc1OC ZINC000340207495 131177168 /nfs/dbraw/zinc/17/71/68/131177168.db2.gz WLNOHYGBLXUTAX-UHFFFAOYSA-N 1 2 312.344 4.003 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+]Cc2ccc(F)cc2Br)c1 ZINC000285535286 131178472 /nfs/dbraw/zinc/17/84/72/131178472.db2.gz BWKVQJXSAOEVQC-NSHDSACASA-N 1 2 323.209 4.142 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+]Cc2ccc(F)cc2Br)c1 ZINC000285535283 131178916 /nfs/dbraw/zinc/17/89/16/131178916.db2.gz BWKVQJXSAOEVQC-LLVKDONJSA-N 1 2 323.209 4.142 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1c(F)cncc1F)c1cc(C)ccc1OC ZINC000285643917 131189281 /nfs/dbraw/zinc/18/92/81/131189281.db2.gz LBSHKADQHQGMHT-WBMJQRKESA-N 1 2 320.383 4.479 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(F)cc1F ZINC000285786256 131202418 /nfs/dbraw/zinc/20/24/18/131202418.db2.gz SUEAYXCCTHZZHH-BJOHPYRUSA-N 1 2 312.310 4.440 20 0 DIADLO c1c[nH]c([C@@H]([NH2+]Cc2nc(C3CC3)cs2)C2CCCCC2)n1 ZINC000286011213 131215603 /nfs/dbraw/zinc/21/56/03/131215603.db2.gz IDTKSACSMKKXIO-INIZCTEOSA-N 1 2 316.474 4.155 20 0 DIADLO c1cc(C[N@@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cs1 ZINC000286167608 131223366 /nfs/dbraw/zinc/22/33/66/131223366.db2.gz IORQCMBZTQAQNE-AWEZNQCLSA-N 1 2 303.431 4.126 20 0 DIADLO c1cc(C[N@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)cs1 ZINC000286167608 131223367 /nfs/dbraw/zinc/22/33/67/131223367.db2.gz IORQCMBZTQAQNE-AWEZNQCLSA-N 1 2 303.431 4.126 20 0 DIADLO COc1cc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)cc(OC)c1 ZINC000286215893 131224513 /nfs/dbraw/zinc/22/45/13/131224513.db2.gz SBXNAFIUUZRZCW-QGZVFWFLSA-N 1 2 315.417 4.160 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@@H](C)c1cc(C)ccn1)c1ccco1 ZINC000286223067 131225130 /nfs/dbraw/zinc/22/51/30/131225130.db2.gz SJVFAXMIIKMACE-MGPUTAFESA-N 1 2 322.408 4.432 20 0 DIADLO CSc1ccc(C)c(NC(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000286974617 131258878 /nfs/dbraw/zinc/25/88/78/131258878.db2.gz BMKIMEZFBFFZAQ-UHFFFAOYSA-N 1 2 301.415 4.373 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2nccn2-c2ccccc2)oc1C ZINC000287188726 131267967 /nfs/dbraw/zinc/26/79/67/131267967.db2.gz VPUUWZIHWNSEJS-CABCVRRESA-N 1 2 309.413 4.494 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+]Cc2ccsc2Br)c1 ZINC000287314181 131274142 /nfs/dbraw/zinc/27/41/42/131274142.db2.gz FELQYKXSCAABSQ-JTQLQIEISA-N 1 2 311.248 4.065 20 0 DIADLO CSc1cccc(F)c1C[NH2+][C@@H](C)c1cccnc1Cl ZINC000287303639 131274842 /nfs/dbraw/zinc/27/48/42/131274842.db2.gz DRMDLXHULXTEQI-JTQLQIEISA-N 1 2 310.825 4.447 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](C)c1ccc(F)c(C)c1 ZINC000287390197 131278321 /nfs/dbraw/zinc/27/83/21/131278321.db2.gz CTKQPUYIHWTNQF-GFCCVEGCSA-N 1 2 301.365 4.029 20 0 DIADLO CSc1cccc(NC(=O)Nc2c(C)cc[nH+]c2C)c1C ZINC000287418962 131279832 /nfs/dbraw/zinc/27/98/32/131279832.db2.gz FTEVEHSRPMCMGK-UHFFFAOYSA-N 1 2 301.415 4.373 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](C)c1c(F)cccc1Cl ZINC000287455793 131281265 /nfs/dbraw/zinc/28/12/65/131281265.db2.gz IJSMZNCWYXWFCN-JTQLQIEISA-N 1 2 321.783 4.374 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](C)c1c(F)cccc1Cl ZINC000287455796 131281384 /nfs/dbraw/zinc/28/13/84/131281384.db2.gz IJSMZNCWYXWFCN-SNVBAGLBSA-N 1 2 321.783 4.374 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1C[C@@H](c2ccccc2)C[C@H]1C ZINC000287462167 131281477 /nfs/dbraw/zinc/28/14/77/131281477.db2.gz ITNWLQIJJUBRFA-PBHICJAKSA-N 1 2 309.413 4.108 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@@H]1c1cccc(F)c1 ZINC000287458032 131281687 /nfs/dbraw/zinc/28/16/87/131281687.db2.gz IPAIFXJWKUNIEW-MRXNPFEDSA-N 1 2 313.376 4.207 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1 ZINC000287459994 131281941 /nfs/dbraw/zinc/28/19/41/131281941.db2.gz IQDVRYAHVKJEPK-GFCCVEGCSA-N 1 2 319.355 4.202 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@]1(C)Cc1ccccc1 ZINC000287478005 131282343 /nfs/dbraw/zinc/28/23/43/131282343.db2.gz JYRQUDPCRQTCMK-HXUWFJFHSA-N 1 2 323.440 4.328 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@H](Cc2ccccc2)[C@@H]1C ZINC000287490444 131283038 /nfs/dbraw/zinc/28/30/38/131283038.db2.gz KSUKFRCDYRPEPN-FUHWJXTLSA-N 1 2 323.440 4.183 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CCSc2ccccc21 ZINC000287490632 131283122 /nfs/dbraw/zinc/28/31/22/131283122.db2.gz KVDPRZSQYFKXML-AWEZNQCLSA-N 1 2 313.426 4.057 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(CC1CC1)C1CCCCC1 ZINC000287532131 131284728 /nfs/dbraw/zinc/28/47/28/131284728.db2.gz NQBMHQKFJPPYLC-UHFFFAOYSA-N 1 2 301.434 4.275 20 0 DIADLO CCN(Cc1ccccc1Cl)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287563142 131286963 /nfs/dbraw/zinc/28/69/63/131286963.db2.gz PRVPTHMGRSOEAZ-UHFFFAOYSA-N 1 2 317.820 4.406 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](C)c1ccccc1Cl ZINC000287588930 131289058 /nfs/dbraw/zinc/28/90/58/131289058.db2.gz RIPYVUYAYUBFBW-LLVKDONJSA-N 1 2 303.793 4.235 20 0 DIADLO Cc1ccc(C[C@H]2CCCN2C(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000287647509 131292110 /nfs/dbraw/zinc/29/21/10/131292110.db2.gz WBINJWJAPNQXNI-GOSISDBHSA-N 1 2 323.440 4.246 20 0 DIADLO Cc1ccc(C[C@@H]2CCCN2C(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000287647515 131292514 /nfs/dbraw/zinc/29/25/14/131292514.db2.gz WBINJWJAPNQXNI-SFHVURJKSA-N 1 2 323.440 4.246 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCCC[C@H]1Cc1ccccc1 ZINC000287687438 131294100 /nfs/dbraw/zinc/29/41/00/131294100.db2.gz YSUVNDSOXYQCCY-SFHVURJKSA-N 1 2 323.440 4.328 20 0 DIADLO CCN(C(=O)Nc1c(C)cc[nH+]c1C)[C@H](C)Cc1ccsc1 ZINC000287702115 131295457 /nfs/dbraw/zinc/29/54/57/131295457.db2.gz ZPDGYQCJTBHRTQ-CYBMUJFWSA-N 1 2 317.458 4.245 20 0 DIADLO C[C@@H]1CN(c2[nH+]ccc3ccc(F)cc32)C[C@H](c2ccccc2)O1 ZINC000340261697 131300442 /nfs/dbraw/zinc/30/04/42/131300442.db2.gz VYAYHEPEPGUPBF-AUUYWEPGSA-N 1 2 322.383 4.340 20 0 DIADLO CCCCOc1ccc(C[NH2+]Cc2noc3c2CCCC3)cc1 ZINC000288404487 131323349 /nfs/dbraw/zinc/32/33/49/131323349.db2.gz IDXXLUOKVFKNDL-UHFFFAOYSA-N 1 2 314.429 4.022 20 0 DIADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000288572901 131330625 /nfs/dbraw/zinc/33/06/25/131330625.db2.gz NENXGTNZZLHSTC-BDJLRTHQSA-N 1 2 302.443 4.052 20 0 DIADLO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1csc(C(C)(C)C)n1 ZINC000288710738 131336296 /nfs/dbraw/zinc/33/62/96/131336296.db2.gz ZGHWKGMOTVFJCB-IAQYHMDHSA-N 1 2 302.443 4.052 20 0 DIADLO COC[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1cccc(Cl)c1 ZINC000288825936 131340428 /nfs/dbraw/zinc/34/04/28/131340428.db2.gz NNYUVUWEBBCHLT-AWEZNQCLSA-N 1 2 322.836 4.103 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccncc1F ZINC000340306212 131363803 /nfs/dbraw/zinc/36/38/03/131363803.db2.gz PJQPZVXDPPWNNR-IFXJQAMLSA-N 1 2 307.372 4.056 20 0 DIADLO COC[C@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(Cl)cc1 ZINC000289328455 131374134 /nfs/dbraw/zinc/37/41/34/131374134.db2.gz DGTSEEUUIAMTOS-HNNXBMFYSA-N 1 2 322.836 4.103 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2cc(C(C)(C)C)on2)s1 ZINC000289550997 131395477 /nfs/dbraw/zinc/39/54/77/131395477.db2.gz DGBAUMVTWYDQML-LLVKDONJSA-N 1 2 307.463 4.238 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cc(C(C)(C)C)on2)s1 ZINC000289550997 131395478 /nfs/dbraw/zinc/39/54/78/131395478.db2.gz DGBAUMVTWYDQML-LLVKDONJSA-N 1 2 307.463 4.238 20 0 DIADLO CC(C)OCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)no1 ZINC000289912788 131432711 /nfs/dbraw/zinc/43/27/11/131432711.db2.gz OBVORTJJNSCNBO-VXGBXAGGSA-N 1 2 323.824 4.060 20 0 DIADLO Cc1cccc([C@H]2CCCN2C(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC000290575082 131499715 /nfs/dbraw/zinc/49/97/15/131499715.db2.gz FNCKQJIMWWKKEX-QGZVFWFLSA-N 1 2 320.396 4.012 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](c2ccc(C)o2)C2CCCC2)s1 ZINC000353563648 131857141 /nfs/dbraw/zinc/85/71/41/131857141.db2.gz UMNGQXVUJLKQOU-MRXNPFEDSA-N 1 2 305.447 4.023 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCn2ccnc21)c1cc(F)c(Cl)cc1Cl ZINC000295979340 131933203 /nfs/dbraw/zinc/93/32/03/131933203.db2.gz NBHXBFICBPYRRJ-AMIZOPFISA-N 1 2 314.191 4.125 20 0 DIADLO Fc1ccc(C2CC2)cc1CN[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000297250603 132005645 /nfs/dbraw/zinc/00/56/45/132005645.db2.gz JGMCKYUVHAHFAN-LJQANCHMSA-N 1 2 321.399 4.305 20 0 DIADLO Fc1ccc(C2CC2)cc1C[NH2+][C@@H](c1ncc[nH]1)c1ccccc1 ZINC000297250603 132005646 /nfs/dbraw/zinc/00/56/46/132005646.db2.gz JGMCKYUVHAHFAN-LJQANCHMSA-N 1 2 321.399 4.305 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000297611610 132025701 /nfs/dbraw/zinc/02/57/01/132025701.db2.gz KQIAQMYMXNNTEH-AEFFLSMTSA-N 1 2 309.413 4.190 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000297611616 132025896 /nfs/dbraw/zinc/02/58/96/132025896.db2.gz KQIAQMYMXNNTEH-SJLPKXTDSA-N 1 2 309.413 4.190 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@H]1C[C@H](C)n2ccnc21 ZINC000297646138 132026829 /nfs/dbraw/zinc/02/68/29/132026829.db2.gz JZHGSLQIHXPTRS-ZOBUZTSGSA-N 1 2 313.445 4.164 20 0 DIADLO C[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2)c2cccc(F)c2)c2nccn21 ZINC000297794752 132034511 /nfs/dbraw/zinc/03/45/11/132034511.db2.gz QBUWZRZDFNRDPX-CCKFTAQKSA-N 1 2 321.399 4.407 20 0 DIADLO Fc1ccccc1[C@@H](Cc1ccccc1)[NH2+][C@H]1CCn2ccnc21 ZINC000297967965 132042757 /nfs/dbraw/zinc/04/27/57/132042757.db2.gz ZRBVNDFKUCIRSL-RBUKOAKNSA-N 1 2 321.399 4.041 20 0 DIADLO Fc1ccccc1[C@H](Cc1ccccc1)[NH2+][C@@H]1CCn2ccnc21 ZINC000297967952 132042941 /nfs/dbraw/zinc/04/29/41/132042941.db2.gz ZRBVNDFKUCIRSL-MOPGFXCFSA-N 1 2 321.399 4.041 20 0 DIADLO C[N@H+](Cc1ncc(C(C)(C)C)o1)Cc1ccc(OC(F)F)cc1 ZINC000298264341 132053258 /nfs/dbraw/zinc/05/32/58/132053258.db2.gz AEQKXJPWDLKGRY-UHFFFAOYSA-N 1 2 324.371 4.206 20 0 DIADLO C[N@@H+](Cc1ncc(C(C)(C)C)o1)Cc1ccc(OC(F)F)cc1 ZINC000298264341 132053259 /nfs/dbraw/zinc/05/32/59/132053259.db2.gz AEQKXJPWDLKGRY-UHFFFAOYSA-N 1 2 324.371 4.206 20 0 DIADLO Cc1[nH+]c2cc(CNC(=O)C[C@@H]3C=CCCC3)ccc2n1C1CC1 ZINC000298554959 132067664 /nfs/dbraw/zinc/06/76/64/132067664.db2.gz YKTUPZNTSMVBCU-OAHLLOKOSA-N 1 2 323.440 4.042 20 0 DIADLO CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1nc(=O)c2sccc2[nH]1 ZINC000298616591 132070201 /nfs/dbraw/zinc/07/02/01/132070201.db2.gz MWADSRSWVPTEOA-RYUDHWBXSA-N 1 2 319.474 4.091 20 0 DIADLO CCc1nnc(C[N@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000299350619 132100882 /nfs/dbraw/zinc/10/08/82/132100882.db2.gz CGYSNUBIQGEDEZ-VIFPVBQESA-N 1 2 314.216 4.132 20 0 DIADLO CCc1nnc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000299350619 132100885 /nfs/dbraw/zinc/10/08/85/132100885.db2.gz CGYSNUBIQGEDEZ-VIFPVBQESA-N 1 2 314.216 4.132 20 0 DIADLO C[N@H+](Cc1ncc(C2CC2)o1)Cc1cccc(C(F)(F)F)c1 ZINC000340660648 132121764 /nfs/dbraw/zinc/12/17/64/132121764.db2.gz MTZQDJPUYDZYLG-UHFFFAOYSA-N 1 2 310.319 4.203 20 0 DIADLO C[N@@H+](Cc1ncc(C2CC2)o1)Cc1cccc(C(F)(F)F)c1 ZINC000340660648 132121765 /nfs/dbraw/zinc/12/17/65/132121765.db2.gz MTZQDJPUYDZYLG-UHFFFAOYSA-N 1 2 310.319 4.203 20 0 DIADLO Cc1ccc(C(=O)Nc2ccc3c(c2)[nH+]c(C2CC2)n3C)cc1F ZINC000340665741 132135287 /nfs/dbraw/zinc/13/52/87/132135287.db2.gz AYHWYAMPHOTJMA-UHFFFAOYSA-N 1 2 323.371 4.151 20 0 DIADLO Cc1cc(NC(=O)N[C@H](C)c2nc(C(C)(C)C)cs2)cc[nH+]1 ZINC000119793132 132137622 /nfs/dbraw/zinc/13/76/22/132137622.db2.gz YQUNJUYBKJWQLD-LLVKDONJSA-N 1 2 318.446 4.027 20 0 DIADLO O=C(CCn1c2ccccc2[nH+]c1C1CC1)Nc1cccc(F)c1 ZINC000340688295 132154368 /nfs/dbraw/zinc/15/43/68/132154368.db2.gz DIOYGIYYZQKCDC-UHFFFAOYSA-N 1 2 323.371 4.082 20 0 DIADLO Cc1cnc(C[N@@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)nc1 ZINC000340690573 132157856 /nfs/dbraw/zinc/15/78/56/132157856.db2.gz VSWRAVBLPASPNR-ZDUSSCGKSA-N 1 2 301.821 4.164 20 0 DIADLO Cc1cnc(C[N@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)nc1 ZINC000340690573 132157858 /nfs/dbraw/zinc/15/78/58/132157858.db2.gz VSWRAVBLPASPNR-ZDUSSCGKSA-N 1 2 301.821 4.164 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2c1cccc2Cl)c1nc(C(C)(C)C)no1 ZINC000194524619 335074538 /nfs/dbraw/zinc/07/45/38/335074538.db2.gz JQDUDHWNWOVLQQ-HZMBPMFUSA-N 1 2 319.836 4.359 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ccccc2F)n(C)n1 ZINC000417734951 335078326 /nfs/dbraw/zinc/07/83/26/335078326.db2.gz SCGLVAYIBKYNJI-UHFFFAOYSA-N 1 2 323.415 4.070 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2ccccc2F)n(C)n1 ZINC000417734951 335078327 /nfs/dbraw/zinc/07/83/27/335078327.db2.gz SCGLVAYIBKYNJI-UHFFFAOYSA-N 1 2 323.415 4.070 20 0 DIADLO C[C@H](CC1CCCCC1)NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000194625267 335080963 /nfs/dbraw/zinc/08/09/63/335080963.db2.gz LNYDIJPFIMCCPS-GDBMZVCRSA-N 1 2 318.465 4.005 20 0 DIADLO CCn1cncc1C[N@H+](Cc1ccccc1)Cc1ccc(F)cc1 ZINC000417736680 335081204 /nfs/dbraw/zinc/08/12/04/335081204.db2.gz UGEBPWQSWDFGQM-UHFFFAOYSA-N 1 2 323.415 4.245 20 0 DIADLO CCn1cncc1C[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1 ZINC000417736680 335081205 /nfs/dbraw/zinc/08/12/05/335081205.db2.gz UGEBPWQSWDFGQM-UHFFFAOYSA-N 1 2 323.415 4.245 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC[C@H](C)COC)c1 ZINC000525875262 335089174 /nfs/dbraw/zinc/08/91/74/335089174.db2.gz VNZUMGZZLVNAIK-HNNXBMFYSA-N 1 2 301.434 4.045 20 0 DIADLO CC(C)c1nc2[nH]ccc2c(N[C@H](C)c2cnn(C(C)C)c2)[nH+]1 ZINC000631116493 435401182 /nfs/dbraw/zinc/40/11/82/435401182.db2.gz BLHPFNKZXIIWHK-GFCCVEGCSA-N 1 2 312.421 4.032 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cc(C4(C)CCCC4)on3)cn2c1 ZINC000519847898 435712792 /nfs/dbraw/zinc/71/27/92/435712792.db2.gz ZIWWVRMGEXTWNZ-UHFFFAOYSA-N 1 2 310.401 4.075 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H](C)CCc2cccc(F)c2)c(C)[nH+]1 ZINC000175102405 332874474 /nfs/dbraw/zinc/87/44/74/332874474.db2.gz JTEITBYDKWVNNI-GFCCVEGCSA-N 1 2 314.404 4.353 20 0 DIADLO Cc1nc(-c2ccccc2)c(C(=O)Nc2cc[nH+]cc2C)s1 ZINC000170956827 332909525 /nfs/dbraw/zinc/90/95/25/332909525.db2.gz XHGPIDKYZMYGKH-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)C1CC2(CCC2)C1 ZINC000583936040 331475652 /nfs/dbraw/zinc/47/56/52/331475652.db2.gz PSRSJOGBDGKOJJ-UHFFFAOYSA-N 1 2 308.381 4.393 20 0 DIADLO Cn1cc[nH+]c1CN(Cc1ccc(Cl)cc1)c1ccccc1 ZINC000533387171 331513397 /nfs/dbraw/zinc/51/33/97/331513397.db2.gz YGGBNPKYFYRQKE-UHFFFAOYSA-N 1 2 311.816 4.280 20 0 DIADLO Cc1cc(NC(=O)N(C)Cc2cccc3ccccc32)cc[nH+]1 ZINC000179802161 331543086 /nfs/dbraw/zinc/54/30/86/331543086.db2.gz PVBHKIIOAHDICF-UHFFFAOYSA-N 1 2 305.381 4.207 20 0 DIADLO Cc1cccn2cc(CC(=O)Nc3cccc4ccsc43)[nH+]c12 ZINC000533570104 331586528 /nfs/dbraw/zinc/58/65/28/331586528.db2.gz KSDIZZGDRCUOFR-UHFFFAOYSA-N 1 2 321.405 4.039 20 0 DIADLO Cc1c[nH+]cc(NCc2c(F)cccc2OC(F)(F)F)c1 ZINC000556328893 331668559 /nfs/dbraw/zinc/66/85/59/331668559.db2.gz SQXJHUUHMCRNQZ-UHFFFAOYSA-N 1 2 300.255 4.040 20 0 DIADLO FC(F)(F)c1cccc(C2([NH2+]Cc3ncc(C4CC4)o3)CC2)c1 ZINC000556330556 331668967 /nfs/dbraw/zinc/66/89/67/331668967.db2.gz CZGYXXYTWAMPIL-UHFFFAOYSA-N 1 2 322.330 4.350 20 0 DIADLO CC(C)c1nc(C[NH+]2CCC(CC(F)(F)F)CC2)cs1 ZINC000556507621 331709889 /nfs/dbraw/zinc/70/98/89/331709889.db2.gz DEJMOWASDCJFAQ-UHFFFAOYSA-N 1 2 306.397 4.431 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3nc4ccccc4[nH]3)CCC2)c(F)c1 ZINC000556619235 331721079 /nfs/dbraw/zinc/72/10/79/331721079.db2.gz XLIHZKMOVYIMPO-UHFFFAOYSA-N 1 2 313.351 4.010 20 0 DIADLO C[C@H]1C[C@H]([NH2+]Cc2cc(Cl)sc2Cl)c2nccn21 ZINC000312745132 331725231 /nfs/dbraw/zinc/72/52/31/331725231.db2.gz MSSHRZNMQJEWBR-CBAPKCEASA-N 1 2 302.230 4.047 20 0 DIADLO Cc1c2ccccc2oc1C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000519993171 331739902 /nfs/dbraw/zinc/73/99/02/331739902.db2.gz SPPZSGFHPNTNBD-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO C[C@H]([NH2+]C/C=C\c1ccc(Cl)cc1)c1nc(C(C)(C)C)no1 ZINC000255657950 331784611 /nfs/dbraw/zinc/78/46/11/331784611.db2.gz ATBYBKRTXCZPPJ-FJOGCWAESA-N 1 2 319.836 4.385 20 0 DIADLO CCc1cccc(NC(=O)C[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000557433012 331789930 /nfs/dbraw/zinc/78/99/30/331789930.db2.gz LZEXTAVITSQOGW-GOSISDBHSA-N 1 2 319.408 4.133 20 0 DIADLO O=C(C/C=C\c1ccccc1F)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000255898874 331815573 /nfs/dbraw/zinc/81/55/73/331815573.db2.gz TXSLQIJZDZASCJ-XQRVVYSFSA-N 1 2 321.355 4.258 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc2cccnc12 ZINC000584137019 331841158 /nfs/dbraw/zinc/84/11/58/331841158.db2.gz ZGONZPJOUZDGGE-CYBMUJFWSA-N 1 2 324.428 4.075 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]Cc2cnc(C3CCCCC3)s2)c2nccn21 ZINC000584212724 331869064 /nfs/dbraw/zinc/86/90/64/331869064.db2.gz PBZPPHXLZLNEPB-DOMZBBRYSA-N 1 2 316.474 4.183 20 0 DIADLO Cc1cc[nH+]c(NC[C@@]2(C)OCCc3sccc32)c1Cl ZINC000558599758 331927056 /nfs/dbraw/zinc/92/70/56/331927056.db2.gz YNJSUZDNJCZOSY-OAHLLOKOSA-N 1 2 308.834 4.005 20 0 DIADLO Cc1cccn2cc(CC(=O)Nc3cccc(C4CCC4)c3)[nH+]c12 ZINC000558654261 331932397 /nfs/dbraw/zinc/93/23/97/331932397.db2.gz WDZXAUDUYUMDAO-UHFFFAOYSA-N 1 2 319.408 4.091 20 0 DIADLO CC(C)c1cc(N2CCC[C@@H]2[C@@H]2CCCOC2)nc(C(C)C)[nH+]1 ZINC000564903165 331946832 /nfs/dbraw/zinc/94/68/32/331946832.db2.gz INSPUGMJSIHMEX-NVXWUHKLSA-N 1 2 317.477 4.119 20 0 DIADLO CC(C)c1cc(N2CCC[C@H]2[C@@H]2CCCOC2)nc(C(C)C)[nH+]1 ZINC000564903167 331947649 /nfs/dbraw/zinc/94/76/49/331947649.db2.gz INSPUGMJSIHMEX-WBVHZDCISA-N 1 2 317.477 4.119 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+]Cc2cccc(F)c2Cl)o1 ZINC000559148968 331982396 /nfs/dbraw/zinc/98/23/96/331982396.db2.gz ACILGBHCDMVDTN-CQSZACIVSA-N 1 2 311.784 4.112 20 0 DIADLO c1oc(-c2ccccc2)nc1CSCc1cn2ccccc2[nH+]1 ZINC000084495389 332003217 /nfs/dbraw/zinc/00/32/17/332003217.db2.gz VRMLYWZREVIDQU-UHFFFAOYSA-N 1 2 321.405 4.423 20 0 DIADLO Cc1cccc(-c2noc(C[N@@H+]([C@@H](C)c3ccco3)C3CC3)n2)c1 ZINC000086234032 332019426 /nfs/dbraw/zinc/01/94/26/332019426.db2.gz OGWUZDDCUUPUBE-AWEZNQCLSA-N 1 2 323.396 4.364 20 0 DIADLO Cc1cccc(-c2noc(C[N@H+]([C@@H](C)c3ccco3)C3CC3)n2)c1 ZINC000086234032 332019427 /nfs/dbraw/zinc/01/94/27/332019427.db2.gz OGWUZDDCUUPUBE-AWEZNQCLSA-N 1 2 323.396 4.364 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ncc(C(C)(C)C)o2)cc1 ZINC000409447574 332033064 /nfs/dbraw/zinc/03/30/64/332033064.db2.gz RFDZKBYIHJNPSP-INIZCTEOSA-N 1 2 314.429 4.318 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ncc(C(C)(C)C)o2)cc1 ZINC000409447574 332033065 /nfs/dbraw/zinc/03/30/65/332033065.db2.gz RFDZKBYIHJNPSP-INIZCTEOSA-N 1 2 314.429 4.318 20 0 DIADLO Brc1ccc(C2CCN(c3cccc[nH+]3)CC2)cc1 ZINC000409642837 332041751 /nfs/dbraw/zinc/04/17/51/332041751.db2.gz DZBKNYYIJQLUPR-UHFFFAOYSA-N 1 2 317.230 4.228 20 0 DIADLO CCCCc1[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc2[nH+]1 ZINC000409719501 332049627 /nfs/dbraw/zinc/04/96/27/332049627.db2.gz JVHTZNLGZABKAZ-UHFFFAOYSA-N 1 2 311.360 4.297 20 0 DIADLO Cc1cnn([C@@H]2CC[N@H+](Cc3cc(Cl)sc3Cl)C2)c1 ZINC000449339714 332052500 /nfs/dbraw/zinc/05/25/00/332052500.db2.gz UWQXDIIGJWKGLK-LLVKDONJSA-N 1 2 316.257 4.007 20 0 DIADLO Cc1cnn([C@@H]2CC[N@@H+](Cc3cc(Cl)sc3Cl)C2)c1 ZINC000449339714 332052501 /nfs/dbraw/zinc/05/25/01/332052501.db2.gz UWQXDIIGJWKGLK-LLVKDONJSA-N 1 2 316.257 4.007 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(COc3ccc(Cl)cc3)n2)[C@H]1C ZINC000559351134 332059845 /nfs/dbraw/zinc/05/98/45/332059845.db2.gz ZBSBBIPQXYJOFO-RYUDHWBXSA-N 1 2 322.861 4.216 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(COc3ccc(Cl)cc3)n2)[C@H]1C ZINC000559351134 332059847 /nfs/dbraw/zinc/05/98/47/332059847.db2.gz ZBSBBIPQXYJOFO-RYUDHWBXSA-N 1 2 322.861 4.216 20 0 DIADLO CCc1cccc(CNc2ccccc2OCCn2cc[nH+]c2)c1 ZINC000569368653 332065419 /nfs/dbraw/zinc/06/54/19/332065419.db2.gz BTHRQYCALJVJIF-UHFFFAOYSA-N 1 2 321.424 4.137 20 0 DIADLO CCCC[C@@H](C)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000409983664 332071186 /nfs/dbraw/zinc/07/11/86/332071186.db2.gz IMMNCTFSGJHSJA-OAHLLOKOSA-N 1 2 323.440 4.367 20 0 DIADLO CCCc1csc(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)n1 ZINC000426359746 332082230 /nfs/dbraw/zinc/08/22/30/332082230.db2.gz JBZLJQQAILDMAC-PWSUYJOCSA-N 1 2 306.397 4.258 20 0 DIADLO CCCc1csc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)n1 ZINC000426359746 332082231 /nfs/dbraw/zinc/08/22/31/332082231.db2.gz JBZLJQQAILDMAC-PWSUYJOCSA-N 1 2 306.397 4.258 20 0 DIADLO Cc1cccc2[nH+]c(CNC(=O)CCCC3CCCCC3)cn21 ZINC000410073340 332086324 /nfs/dbraw/zinc/08/63/24/332086324.db2.gz DZHJECLTQKPIGG-UHFFFAOYSA-N 1 2 313.445 4.010 20 0 DIADLO CC(C)n1nccc1C[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000410313167 332110057 /nfs/dbraw/zinc/11/00/57/332110057.db2.gz KXQKUABOEJGMQK-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO CC(C)n1nccc1C[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000410313167 332110059 /nfs/dbraw/zinc/11/00/59/332110059.db2.gz KXQKUABOEJGMQK-UHFFFAOYSA-N 1 2 312.244 4.403 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)CC1CCC(c2ccccc2)CC1 ZINC000518658366 332118157 /nfs/dbraw/zinc/11/81/57/332118157.db2.gz QRTAVZVMYWMGKX-UHFFFAOYSA-N 1 2 308.425 4.115 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cccc2ccoc21)c1nc(C2CC2)no1 ZINC000569543925 332132789 /nfs/dbraw/zinc/13/27/89/332132789.db2.gz NHNOAPDTFHXSAK-HNNXBMFYSA-N 1 2 311.385 4.180 20 0 DIADLO c1ccc2cc(OCCC[N@@H+]3Cc4cccnc4C3)ccc2c1 ZINC000569570575 332141329 /nfs/dbraw/zinc/14/13/29/332141329.db2.gz RBDAZWHDJSSDFN-UHFFFAOYSA-N 1 2 304.393 4.020 20 0 DIADLO c1ccc2cc(OCCC[N@H+]3Cc4cccnc4C3)ccc2c1 ZINC000569570575 332141330 /nfs/dbraw/zinc/14/13/30/332141330.db2.gz RBDAZWHDJSSDFN-UHFFFAOYSA-N 1 2 304.393 4.020 20 0 DIADLO Cc1nc(N[C@@H](COc2ccccc2F)c2ccccc2)cc[nH+]1 ZINC000426893077 332160459 /nfs/dbraw/zinc/16/04/59/332160459.db2.gz DBRDJTRXDDABSS-KRWDZBQOSA-N 1 2 323.371 4.156 20 0 DIADLO CCOc1cc(C[N@H+](C)Cc2c(F)cccc2F)ccc1OC ZINC000354356880 332172853 /nfs/dbraw/zinc/17/28/53/332172853.db2.gz VSUVPZPYWAWKBX-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CCOc1cc(C[N@@H+](C)Cc2c(F)cccc2F)ccc1OC ZINC000354356880 332172854 /nfs/dbraw/zinc/17/28/54/332172854.db2.gz VSUVPZPYWAWKBX-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000181017938 332172863 /nfs/dbraw/zinc/17/28/63/332172863.db2.gz HZSKNZUJLNISNM-ZRGWGRIASA-N 1 2 322.408 4.351 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000181017938 332172864 /nfs/dbraw/zinc/17/28/64/332172864.db2.gz HZSKNZUJLNISNM-ZRGWGRIASA-N 1 2 322.408 4.351 20 0 DIADLO Cc1ccc(C(=O)N[C@H]2CCCC2(C)C)cc1Oc1cc[nH+]cc1 ZINC000427168654 332174956 /nfs/dbraw/zinc/17/49/56/332174956.db2.gz FQVYAOHCXJPFLR-SFHVURJKSA-N 1 2 324.424 4.491 20 0 DIADLO CCOc1cc(C)ccc1[NH2+][C@H]1CCC[C@H](c2ccnn2C)C1 ZINC000448020625 332178953 /nfs/dbraw/zinc/17/89/53/332178953.db2.gz CZXLDUKAQIZLLK-HOTGVXAUSA-N 1 2 313.445 4.266 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)CCc2ccccc2C)[nH+]1 ZINC000427191509 332182890 /nfs/dbraw/zinc/18/28/90/332182890.db2.gz HRCODSBICQYOKB-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO Cc1[nH]ncc1C[NH+]1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000181505171 332197342 /nfs/dbraw/zinc/19/73/42/332197342.db2.gz IVDUOBNQFBJBNI-UHFFFAOYSA-N 1 2 323.362 4.117 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1Cl)c1csnn1 ZINC000398318696 332231042 /nfs/dbraw/zinc/23/10/42/332231042.db2.gz GYHRQTWXKXNULG-YUMQZZPRSA-N 1 2 302.230 4.257 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)[C@H](Oc1cccc(Cl)c1)C(C)C ZINC000094124926 332265853 /nfs/dbraw/zinc/26/58/53/332265853.db2.gz NUZDQEBROIFVOZ-MRXNPFEDSA-N 1 2 318.804 4.086 20 0 DIADLO CCCC[C@H](CCC)C[NH2+][C@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000559774796 332279929 /nfs/dbraw/zinc/27/99/29/332279929.db2.gz YTCOVPCLJKFSHX-YOEHRIQHSA-N 1 2 318.440 4.229 20 0 DIADLO CC(F)(F)C[NH2+][C@@H]1CCSc2ccc(Br)cc21 ZINC000559876715 332288182 /nfs/dbraw/zinc/28/81/82/332288182.db2.gz BJQNNUIEPBGOAI-SNVBAGLBSA-N 1 2 322.218 4.231 20 0 DIADLO CC(F)(F)C[NH2+][C@H]1CCCc2ccc(Br)cc21 ZINC000559886005 332289245 /nfs/dbraw/zinc/28/92/45/332289245.db2.gz JNKHOQBSXPRRMZ-LBPRGKRZSA-N 1 2 304.178 4.071 20 0 DIADLO CC(F)(F)C[NH2+][C@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000559890896 332290002 /nfs/dbraw/zinc/29/00/02/332290002.db2.gz KLJXYPGEZPTREJ-OAHLLOKOSA-N 1 2 310.775 4.264 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3cc4c(cc(C)cc4C)[nH]3)cc2[nH+]1 ZINC000560070914 332308587 /nfs/dbraw/zinc/30/85/87/332308587.db2.gz CQQOCZQFQGOLPV-UHFFFAOYSA-N 1 2 318.380 4.222 20 0 DIADLO Cc1[nH]c2cc(NC(=O)c3cc4c(cc(C)cc4C)[nH]3)ccc2[nH+]1 ZINC000560070914 332308589 /nfs/dbraw/zinc/30/85/89/332308589.db2.gz CQQOCZQFQGOLPV-UHFFFAOYSA-N 1 2 318.380 4.222 20 0 DIADLO c1ccc(C2=CCC[N@@H+](Cc3noc(C4CCCCC4)n3)C2)cc1 ZINC000560170771 332316817 /nfs/dbraw/zinc/31/68/17/332316817.db2.gz ADPNWFCLTDJYLY-UHFFFAOYSA-N 1 2 323.440 4.407 20 0 DIADLO c1ccc(C2=CCC[N@H+](Cc3noc(C4CCCCC4)n3)C2)cc1 ZINC000560170771 332316820 /nfs/dbraw/zinc/31/68/20/332316820.db2.gz ADPNWFCLTDJYLY-UHFFFAOYSA-N 1 2 323.440 4.407 20 0 DIADLO C[C@H]1OCC[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)[C@@H]1C ZINC000560261053 332325098 /nfs/dbraw/zinc/32/50/98/332325098.db2.gz FNSBSDKFLIQEIL-VXGBXAGGSA-N 1 2 322.861 4.073 20 0 DIADLO C[C@H]1OCC[N@@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)[C@@H]1C ZINC000560261053 332325099 /nfs/dbraw/zinc/32/50/99/332325099.db2.gz FNSBSDKFLIQEIL-VXGBXAGGSA-N 1 2 322.861 4.073 20 0 DIADLO CCc1noc([C@@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)n1 ZINC000114747047 332329017 /nfs/dbraw/zinc/32/90/17/332329017.db2.gz XMTCVRHSNMNXMO-VHSXEESVSA-N 1 2 313.323 4.063 20 0 DIADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2oc(C(C)C)nc2C)[nH+]1 ZINC000560320416 332330376 /nfs/dbraw/zinc/33/03/76/332330376.db2.gz XEBMWGZSOGEBHI-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3CCc4ccc(F)cc4C3)co2)cc1 ZINC000560523682 332350902 /nfs/dbraw/zinc/35/09/02/332350902.db2.gz BFJVABOGCQJTGH-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3CCc4ccc(F)cc4C3)co2)cc1 ZINC000560523682 332350903 /nfs/dbraw/zinc/35/09/03/332350903.db2.gz BFJVABOGCQJTGH-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1ccc(C[NH2+]Cc2nc(C)c3ccccc3n2)cc1Cl ZINC000583360840 332353000 /nfs/dbraw/zinc/35/30/00/332353000.db2.gz RQHKWQWTEWJZNL-UHFFFAOYSA-N 1 2 311.816 4.190 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc([C@@H]2CC=CCC2)n1 ZINC000583361164 332353428 /nfs/dbraw/zinc/35/34/28/332353428.db2.gz GSBXTCFBOQKFCB-CQSZACIVSA-N 1 2 322.412 4.415 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)Cc3cccc(C)n3)cs2)cc1 ZINC000560553632 332359000 /nfs/dbraw/zinc/35/90/00/332359000.db2.gz JKSAPCPMESBFCZ-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)Cc3cccc(C)n3)cs2)cc1 ZINC000560553632 332359002 /nfs/dbraw/zinc/35/90/02/332359002.db2.gz JKSAPCPMESBFCZ-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000425566758 335103253 /nfs/dbraw/zinc/10/32/53/335103253.db2.gz IFLOLWNYEGQTIU-UZLBHIALSA-N 1 2 323.440 4.261 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@H](C)Cc1cccc(F)c1 ZINC000425586342 335107285 /nfs/dbraw/zinc/10/72/85/335107285.db2.gz KHSFBMRBFXWBFY-GFCCVEGCSA-N 1 2 300.377 4.045 20 0 DIADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)C1CCCC1 ZINC000560684078 332377419 /nfs/dbraw/zinc/37/74/19/332377419.db2.gz RIMBWKRYTJRCGZ-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO O=C(Nc1ccccc1-c1[nH+]cc2n1CCCC2)[C@H]1CC=CCC1 ZINC000560684753 332377554 /nfs/dbraw/zinc/37/75/54/332377554.db2.gz YPMFYPZFVLVERC-HNNXBMFYSA-N 1 2 321.424 4.181 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)CSCc1ccccc1 ZINC000425586847 335107421 /nfs/dbraw/zinc/10/74/21/335107421.db2.gz LPIOWLDSMNBLLD-AWEZNQCLSA-N 1 2 314.454 4.206 20 0 DIADLO C[C@H]1CC[C@H](C(=O)Nc2ccccc2-c2[nH+]cc3n2CCCC3)C1 ZINC000425571299 335104582 /nfs/dbraw/zinc/10/45/82/335104582.db2.gz MYUIGGYHNQQGNC-GJZGRUSLSA-N 1 2 323.440 4.261 20 0 DIADLO Clc1cccc2c(N[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)cc[nH+]c12 ZINC000561267243 332431205 /nfs/dbraw/zinc/43/12/05/332431205.db2.gz ABQLMMBFRXRSAW-VUCTXSBTSA-N 1 2 314.816 4.258 20 0 DIADLO Clc1cccc2c(N[C@@H]3[C@H]4CCO[C@H]4C34CCC4)cc[nH+]c12 ZINC000561267237 332431211 /nfs/dbraw/zinc/43/12/11/332431211.db2.gz ABQLMMBFRXRSAW-CSMYWGQOSA-N 1 2 314.816 4.258 20 0 DIADLO CC[C@@H](CC(F)(F)F)Nc1[nH+]ccc(C)c1Br ZINC000561266646 332431910 /nfs/dbraw/zinc/43/19/10/332431910.db2.gz VMAGSJXNDGZWCJ-QMMMGPOBSA-N 1 2 311.145 4.295 20 0 DIADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc([C@H](C)C2CCC2)n1 ZINC000561295886 332434519 /nfs/dbraw/zinc/43/45/19/332434519.db2.gz UXYAVPVSWFMPQZ-CYBMUJFWSA-N 1 2 324.428 4.495 20 0 DIADLO CCc1ccc([C@@H](COC)[NH2+]Cc2cnc(C3CCC3)s2)o1 ZINC000150834489 332438736 /nfs/dbraw/zinc/43/87/36/332438736.db2.gz FTRXNHSSFJDPQE-OAHLLOKOSA-N 1 2 320.458 4.043 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl ZINC000425583453 335106663 /nfs/dbraw/zinc/10/66/63/335106663.db2.gz ABBVYROISFXOHU-NEPJUHHUSA-N 1 2 318.779 4.233 20 0 DIADLO CC[C@@H](CC(=O)Nc1c(C)cc[nH+]c1C)c1ccc(OC)cc1 ZINC000425583497 335106722 /nfs/dbraw/zinc/10/67/22/335106722.db2.gz ARAREUGVSYCRLZ-HNNXBMFYSA-N 1 2 312.413 4.229 20 0 DIADLO COc1cccc(C2([NH2+]Cc3csc(C(C)C)n3)CC2)c1 ZINC000150900823 332453376 /nfs/dbraw/zinc/45/33/76/332453376.db2.gz RKOOLLIVEAILPF-UHFFFAOYSA-N 1 2 302.443 4.054 20 0 DIADLO CCc1nc(SCc2ccc(C(C)C)[nH+]c2C)[nH]c(=O)c1C ZINC000566498308 332458258 /nfs/dbraw/zinc/45/82/58/332458258.db2.gz DRARCUWNBIRNES-UHFFFAOYSA-N 1 2 317.458 4.172 20 0 DIADLO C/C=C/c1ccc(NC(=O)c2cccc(Cn3cc[nH+]c3)c2)cc1 ZINC000561648424 332474948 /nfs/dbraw/zinc/47/49/48/332474948.db2.gz UAHVPQANKNLQIZ-DUXPYHPUSA-N 1 2 317.392 4.217 20 0 DIADLO CC(C)c1csc(C[NH2+][C@@H]2CCCOc3ccc(F)cc32)n1 ZINC000128561955 332500115 /nfs/dbraw/zinc/50/01/15/332500115.db2.gz MKQKPCLZTHGEHE-CQSZACIVSA-N 1 2 320.433 4.409 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H](C)c2ccc(F)c(F)c2)c(C)[nH+]1 ZINC000525657757 332532682 /nfs/dbraw/zinc/53/26/82/332532682.db2.gz PLZPZMGCILKFAT-NSHDSACASA-N 1 2 304.340 4.027 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(C)c(Cl)c2F)c(C)[nH+]1 ZINC000448127662 332534798 /nfs/dbraw/zinc/53/47/98/332534798.db2.gz YWNBGJBBYPCJEK-UHFFFAOYSA-N 1 2 306.768 4.360 20 0 DIADLO CCCN(Cc1ccc(C)cc1)C(=O)Nc1c(C)cc[nH+]c1C ZINC000562284902 332568197 /nfs/dbraw/zinc/56/81/97/332568197.db2.gz TUWLLPIKWHWBMA-UHFFFAOYSA-N 1 2 311.429 4.451 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1noc([C@@H]2CCC(C)(C)C2)n1 ZINC000562473823 332596342 /nfs/dbraw/zinc/59/63/42/332596342.db2.gz YZXYLVSKKLMTOD-CQSZACIVSA-N 1 2 324.428 4.264 20 0 DIADLO FC(F)(F)c1cc(C[NH2+]Cc2c(Cl)cccc2Cl)[nH]n1 ZINC000562511207 332599312 /nfs/dbraw/zinc/59/93/12/332599312.db2.gz PDMSVJOGFYIMOZ-UHFFFAOYSA-N 1 2 324.133 4.025 20 0 DIADLO C[C@H](Nc1cc(Cl)cc(C(F)(F)F)c1)c1[nH+]ccn1C ZINC000168984980 332607523 /nfs/dbraw/zinc/60/75/23/332607523.db2.gz YZIVBWLRSCKBLR-QMMMGPOBSA-N 1 2 303.715 4.265 20 0 DIADLO CC(C)OC(C)(C)C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000448839009 332666854 /nfs/dbraw/zinc/66/68/54/332666854.db2.gz YFEFTJQZODUTRP-UHFFFAOYSA-N 1 2 314.385 4.016 20 0 DIADLO FC(F)(F)c1ccc(C[NH2+]Cc2ncc(Cl)s2)cc1 ZINC000225305011 332670784 /nfs/dbraw/zinc/67/07/84/332670784.db2.gz NBMTXOHFSOBAQG-UHFFFAOYSA-N 1 2 306.740 4.105 20 0 DIADLO CC(C)(C)OC1CCN(c2[nH+]ccc3cc(F)ccc32)CC1 ZINC000569807044 332681635 /nfs/dbraw/zinc/68/16/35/332681635.db2.gz ZXCHMGNUJWVTRE-UHFFFAOYSA-N 1 2 302.393 4.158 20 0 DIADLO CC(C)(C)C[C@H]([NH2+]C1CCC2(CCCO2)CC1)C(F)(F)F ZINC000570220483 332726849 /nfs/dbraw/zinc/72/68/49/332726849.db2.gz UGNCPOHBQVEFNN-OWYJLGKBSA-N 1 2 307.400 4.435 20 0 DIADLO Cc1cccn2cc(C[S@](=O)c3ccc4ccccc4c3)[nH+]c12 ZINC000176637953 332950254 /nfs/dbraw/zinc/95/02/54/332950254.db2.gz BAAOAHTXJLLGRB-QHCPKHFHSA-N 1 2 320.417 4.104 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2ncc(-c3ccc(Cl)cc3)o2)CCO1 ZINC000178590819 333016618 /nfs/dbraw/zinc/01/66/18/333016618.db2.gz XJIXXPPBVUELEZ-SWLSCSKDSA-N 1 2 320.820 4.167 20 0 DIADLO CC[C@@H]1C[N@H+]([C@@H](C)c2ncc(-c3ccc(Cl)cc3)o2)CCO1 ZINC000178590819 333016621 /nfs/dbraw/zinc/01/66/21/333016621.db2.gz XJIXXPPBVUELEZ-SWLSCSKDSA-N 1 2 320.820 4.167 20 0 DIADLO CC[C@H]1C[N@@H+]([C@@H](C)c2ncc(-c3ccc(Cl)cc3)o2)CCO1 ZINC000178590834 333016698 /nfs/dbraw/zinc/01/66/98/333016698.db2.gz XJIXXPPBVUELEZ-WFASDCNBSA-N 1 2 320.820 4.167 20 0 DIADLO CC[C@H]1C[N@H+]([C@@H](C)c2ncc(-c3ccc(Cl)cc3)o2)CCO1 ZINC000178590834 333016700 /nfs/dbraw/zinc/01/67/00/333016700.db2.gz XJIXXPPBVUELEZ-WFASDCNBSA-N 1 2 320.820 4.167 20 0 DIADLO Cc1occc1C[N@@H+](C)[C@H](C)C(=O)Nc1ccc(Cl)cc1C ZINC000178724034 333018863 /nfs/dbraw/zinc/01/88/63/333018863.db2.gz PGLOCWSWUIOAEH-GFCCVEGCSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1occc1C[N@H+](C)[C@H](C)C(=O)Nc1ccc(Cl)cc1C ZINC000178724034 333018864 /nfs/dbraw/zinc/01/88/64/333018864.db2.gz PGLOCWSWUIOAEH-GFCCVEGCSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1nc(C[N@@H+]2CC[C@H](Oc3ccccc3Cl)C2)sc1C ZINC000178973603 333023112 /nfs/dbraw/zinc/02/31/12/333023112.db2.gz FZQRJXHBIVOBAZ-ZDUSSCGKSA-N 1 2 322.861 4.067 20 0 DIADLO Cc1nc(C[N@H+]2CC[C@H](Oc3ccccc3Cl)C2)sc1C ZINC000178973603 333023113 /nfs/dbraw/zinc/02/31/13/333023113.db2.gz FZQRJXHBIVOBAZ-ZDUSSCGKSA-N 1 2 322.861 4.067 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@H](C)c2ccc(C)c(F)c2)n1 ZINC000181338404 333030213 /nfs/dbraw/zinc/03/02/13/333030213.db2.gz NKTJEACXDSDAHE-NEPJUHHUSA-N 1 2 323.437 4.182 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2ccc(F)cc2)n1)c1cccc(O)c1 ZINC000181512817 333030805 /nfs/dbraw/zinc/03/08/05/333030805.db2.gz QUSWFGQDSOFTJU-GFCCVEGCSA-N 1 2 312.344 4.037 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccc(OC(F)(F)F)cc2)oc1C ZINC000182518666 333042096 /nfs/dbraw/zinc/04/20/96/333042096.db2.gz AZSGKAZUTJGPIV-SNVBAGLBSA-N 1 2 314.307 4.041 20 0 DIADLO Cc1cc[nH+]cc1CCCNc1cccc(OCC(F)(F)F)c1 ZINC000580259034 333044016 /nfs/dbraw/zinc/04/40/16/333044016.db2.gz UJVHDRXGIGVNPG-UHFFFAOYSA-N 1 2 324.346 4.376 20 0 DIADLO COc1c(C)c[nH+]c(CN[C@@H](C)c2ccc(F)cc2Cl)c1C ZINC000183785134 333063072 /nfs/dbraw/zinc/06/30/72/333063072.db2.gz BVWNALRDFJYZPV-LBPRGKRZSA-N 1 2 322.811 4.350 20 0 DIADLO Cc1[nH]c2ccc(CSc3nc4ccccc4nc3C)cc2[nH+]1 ZINC000460419394 333082887 /nfs/dbraw/zinc/08/28/87/333082887.db2.gz DBJFFSTTXDVNBD-UHFFFAOYSA-N 1 2 320.421 4.415 20 0 DIADLO Cc1[nH]c2cc(CSc3nc4ccccc4nc3C)ccc2[nH+]1 ZINC000460419394 333082888 /nfs/dbraw/zinc/08/28/88/333082888.db2.gz DBJFFSTTXDVNBD-UHFFFAOYSA-N 1 2 320.421 4.415 20 0 DIADLO Cc1[nH]c2ccc(CSc3ncc(C(C)(C)C)o3)cc2[nH+]1 ZINC000460435242 333086144 /nfs/dbraw/zinc/08/61/44/333086144.db2.gz FVYWCYIHOPHRJY-UHFFFAOYSA-N 1 2 301.415 4.449 20 0 DIADLO Cc1[nH]c2cc(CSc3ncc(C(C)(C)C)o3)ccc2[nH+]1 ZINC000460435242 333086145 /nfs/dbraw/zinc/08/61/45/333086145.db2.gz FVYWCYIHOPHRJY-UHFFFAOYSA-N 1 2 301.415 4.449 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@H](C)c3cccc(Cl)c3)cc2[nH+]1 ZINC000460683037 333124581 /nfs/dbraw/zinc/12/45/81/333124581.db2.gz GKTMBHWOBOSNLJ-SNVBAGLBSA-N 1 2 313.788 4.267 20 0 DIADLO CCC[C@H](C)Cc1nc(Cn2c3ccccc3[nH+]c2CC)no1 ZINC000460728564 333129492 /nfs/dbraw/zinc/12/94/92/333129492.db2.gz KNESXTLAHBYEEQ-ZDUSSCGKSA-N 1 2 312.417 4.009 20 0 DIADLO Cc1ccc(SCCC(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000425591294 335123723 /nfs/dbraw/zinc/12/37/23/335123723.db2.gz YNHQSEPQJRVDHO-UHFFFAOYSA-N 1 2 300.427 4.128 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1noc(-c2sccc2C)n1 ZINC000460749163 333133433 /nfs/dbraw/zinc/13/34/33/333133433.db2.gz UVQKTVOCRHRBRH-UHFFFAOYSA-N 1 2 324.409 4.067 20 0 DIADLO CCCCc1nc(C[NH2+][C@@H](C)c2ccc(OC(C)C)cc2)no1 ZINC000179528281 333152082 /nfs/dbraw/zinc/15/20/82/333152082.db2.gz XYIUJOXSWZQJDT-AWEZNQCLSA-N 1 2 317.433 4.050 20 0 DIADLO Fc1cccc(CCCn2nc(C(F)(F)F)c3c[nH+]ccc32)c1 ZINC000180407134 333161643 /nfs/dbraw/zinc/16/16/43/333161643.db2.gz RYPFSODPIOREQO-UHFFFAOYSA-N 1 2 323.293 4.222 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2ccsc2Br)n1 ZINC000388726926 333171148 /nfs/dbraw/zinc/17/11/48/333171148.db2.gz BTOKJMDNMOEORF-QMMMGPOBSA-N 1 2 317.277 4.126 20 0 DIADLO CC(C)(Cc1ccccc1)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000522743159 333184619 /nfs/dbraw/zinc/18/46/19/333184619.db2.gz DXHZCKJIVOSYMA-UHFFFAOYSA-N 1 2 319.408 4.284 20 0 DIADLO COC(=O)c1occc1C[NH2+][C@@H](c1ccccc1Cl)C(C)C ZINC000183701791 333186994 /nfs/dbraw/zinc/18/69/94/333186994.db2.gz NJJWTFGKJWWDRR-OAHLLOKOSA-N 1 2 321.804 4.207 20 0 DIADLO Fc1ccc(-c2csc(Cc3cn4ccccc4[nH+]3)n2)cc1 ZINC000040040184 333200638 /nfs/dbraw/zinc/20/06/38/333200638.db2.gz DDJIQKLJNNWQFX-UHFFFAOYSA-N 1 2 309.369 4.188 20 0 DIADLO Cc1nnc(C[NH2+][C@@H](C)c2ccc(Cl)c3ccccc32)o1 ZINC000185393011 333207978 /nfs/dbraw/zinc/20/79/78/333207978.db2.gz KNCAKBQIEIZVTO-JTQLQIEISA-N 1 2 301.777 4.035 20 0 DIADLO CC1(C)CCC[N@H+](CC(=O)Nc2cccc(Cl)c2Cl)C1 ZINC000497372411 333241561 /nfs/dbraw/zinc/24/15/61/333241561.db2.gz SWZFDBYXHDQARG-UHFFFAOYSA-N 1 2 315.244 4.054 20 0 DIADLO CC1(C)CCC[N@@H+](CC(=O)Nc2cccc(Cl)c2Cl)C1 ZINC000497372411 333241562 /nfs/dbraw/zinc/24/15/62/333241562.db2.gz SWZFDBYXHDQARG-UHFFFAOYSA-N 1 2 315.244 4.054 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000497590680 333266191 /nfs/dbraw/zinc/26/61/91/333266191.db2.gz LZCGSXAZPKATDI-KDOFPFPSSA-N 1 2 301.817 4.475 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000497590680 333266193 /nfs/dbraw/zinc/26/61/93/333266193.db2.gz LZCGSXAZPKATDI-KDOFPFPSSA-N 1 2 301.817 4.475 20 0 DIADLO COc1ccccc1[C@H](C)Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000390410133 333278358 /nfs/dbraw/zinc/27/83/58/333278358.db2.gz KVSJESLGSBSYHP-HNNXBMFYSA-N 1 2 311.429 4.254 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1nc2c(s1)CCC2 ZINC000497710503 333280948 /nfs/dbraw/zinc/28/09/48/333280948.db2.gz JYPHUNGKZHFIOH-NXEZZACHSA-N 1 2 308.397 4.322 20 0 DIADLO Clc1ccc(C[N@@H+]2CCc3c(cnn3-c3ccccc3)C2)cc1 ZINC000502019591 333282834 /nfs/dbraw/zinc/28/28/34/333282834.db2.gz AAFGAFUUQRTEHN-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO Clc1ccc(C[N@H+]2CCc3c(cnn3-c3ccccc3)C2)cc1 ZINC000502019591 333282835 /nfs/dbraw/zinc/28/28/35/333282835.db2.gz AAFGAFUUQRTEHN-UHFFFAOYSA-N 1 2 323.827 4.084 20 0 DIADLO CC(C)Oc1ccccc1C[N@@H+]1CCOC[C@H]1c1ccccc1 ZINC000525781677 333306361 /nfs/dbraw/zinc/30/63/61/333306361.db2.gz NJDLXPHMCYUVSB-IBGZPJMESA-N 1 2 311.425 4.047 20 0 DIADLO CC(C)Oc1ccccc1C[N@H+]1CCOC[C@H]1c1ccccc1 ZINC000525781677 333306362 /nfs/dbraw/zinc/30/63/62/333306362.db2.gz NJDLXPHMCYUVSB-IBGZPJMESA-N 1 2 311.425 4.047 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1c(Cl)cccc1OC ZINC000388522323 333320184 /nfs/dbraw/zinc/32/01/84/333320184.db2.gz JEGIQZWKOIPAON-NSHDSACASA-N 1 2 323.795 4.347 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1c(Cl)cccc1OC ZINC000388522322 333320218 /nfs/dbraw/zinc/32/02/18/333320218.db2.gz JEGIQZWKOIPAON-LLVKDONJSA-N 1 2 323.795 4.347 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2Cl)o1 ZINC000111193402 333328831 /nfs/dbraw/zinc/32/88/31/333328831.db2.gz NSYULEJJHPMTKO-BDAKNGLRSA-N 1 2 314.216 4.351 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cccc(Br)c3)cn2c1 ZINC000531231543 333336458 /nfs/dbraw/zinc/33/64/58/333336458.db2.gz CHXGVMCWQWGEIK-UHFFFAOYSA-N 1 2 316.202 4.017 20 0 DIADLO c1oc(-c2ccccc2)nc1C[NH2+][C@H]1CSc2ccccc21 ZINC000531251091 333337812 /nfs/dbraw/zinc/33/78/12/333337812.db2.gz JMTHYEBRXRSDJQ-INIZCTEOSA-N 1 2 308.406 4.278 20 0 DIADLO COC[C@H]([NH2+]Cc1ccc(-c2ccccc2F)o1)c1ccco1 ZINC000531333221 333344140 /nfs/dbraw/zinc/34/41/40/333344140.db2.gz XBXHVWBJNTZKOG-INIZCTEOSA-N 1 2 315.344 4.156 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2nnsc2Cl)CC[C@@H]1c1ccccc1 ZINC000531339908 333344724 /nfs/dbraw/zinc/34/47/24/333344724.db2.gz BZUNJYHBPLVRCD-OCCSQVGLSA-N 1 2 321.877 4.207 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2nnsc2Cl)CC[C@@H]1c1ccccc1 ZINC000531339908 333344725 /nfs/dbraw/zinc/34/47/25/333344725.db2.gz BZUNJYHBPLVRCD-OCCSQVGLSA-N 1 2 321.877 4.207 20 0 DIADLO C[N@H+](Cc1csc(Cc2ccccc2)n1)Cc1cccc(O)c1 ZINC000531382250 333347785 /nfs/dbraw/zinc/34/77/85/333347785.db2.gz JUTOBJMLNOHCRN-UHFFFAOYSA-N 1 2 324.449 4.072 20 0 DIADLO C[N@@H+](Cc1csc(Cc2ccccc2)n1)Cc1cccc(O)c1 ZINC000531382250 333347787 /nfs/dbraw/zinc/34/77/87/333347787.db2.gz JUTOBJMLNOHCRN-UHFFFAOYSA-N 1 2 324.449 4.072 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC[C@@H]2c2ccccn2)cs1 ZINC000531440552 333353546 /nfs/dbraw/zinc/35/35/46/333353546.db2.gz MXTOYGNFRYUAND-QGZVFWFLSA-N 1 2 315.486 4.464 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC[C@@H]2c2ccccn2)cs1 ZINC000531440552 333353547 /nfs/dbraw/zinc/35/35/47/333353547.db2.gz MXTOYGNFRYUAND-QGZVFWFLSA-N 1 2 315.486 4.464 20 0 DIADLO Clc1ccc([C@H]2CCC[N@@H+]2Cc2cnccn2)cc1Cl ZINC000563090482 333386327 /nfs/dbraw/zinc/38/63/27/333386327.db2.gz TXPKZHNBTCGQOY-OAHLLOKOSA-N 1 2 308.212 4.121 20 0 DIADLO Clc1ccc([C@H]2CCC[N@H+]2Cc2cnccn2)cc1Cl ZINC000563090482 333386329 /nfs/dbraw/zinc/38/63/29/333386329.db2.gz TXPKZHNBTCGQOY-OAHLLOKOSA-N 1 2 308.212 4.121 20 0 DIADLO CC(C)CCc1noc(C[N@H+](Cc2cccc(F)c2)C(C)C)n1 ZINC000518830445 335139016 /nfs/dbraw/zinc/13/90/16/335139016.db2.gz IXPIJLYSPXTIJK-UHFFFAOYSA-N 1 2 319.424 4.208 20 0 DIADLO CC(C)CCc1noc(C[N@@H+](Cc2cccc(F)c2)C(C)C)n1 ZINC000518830445 335139018 /nfs/dbraw/zinc/13/90/18/335139018.db2.gz IXPIJLYSPXTIJK-UHFFFAOYSA-N 1 2 319.424 4.208 20 0 DIADLO Cc1[nH+]c2cc(NC(=O)C/C=C/c3ccc(C)cc3)ccc2n1C ZINC000531477503 333414303 /nfs/dbraw/zinc/41/43/03/333414303.db2.gz PJQFVLMYNGFCDG-SNAWJCMRSA-N 1 2 319.408 4.232 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+]Cc1csc(C(C)(C)C)n1 ZINC000067184002 333447653 /nfs/dbraw/zinc/44/76/53/333447653.db2.gz KSBRFWLDLLQWQX-GFCCVEGCSA-N 1 2 304.459 4.300 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](c2cccs2)c2ccc(F)cc2)o1 ZINC000531654341 333541982 /nfs/dbraw/zinc/54/19/82/333541982.db2.gz OSVJJPHOVKDOIH-MRXNPFEDSA-N 1 2 302.374 4.063 20 0 DIADLO CCc1ccc([C@@H](C)[NH2+][C@H](c2nccn2C)c2ccccc2)cc1 ZINC000531687488 333543775 /nfs/dbraw/zinc/54/37/75/333543775.db2.gz AWHAWVIFDBQSHV-UZLBHIALSA-N 1 2 319.452 4.423 20 0 DIADLO Cc1ccc2[nH+]c(CNc3ccc(CC(F)(F)F)cc3)cn2c1 ZINC000531859371 333583935 /nfs/dbraw/zinc/58/39/35/333583935.db2.gz JATHMLCGOSUKCH-UHFFFAOYSA-N 1 2 319.330 4.360 20 0 DIADLO Cc1[nH]c(CNc2cc(Br)c(C)cc2C)[nH+]c1C ZINC000571418879 333788108 /nfs/dbraw/zinc/78/81/08/333788108.db2.gz PXHVEQVOBYRLQN-UHFFFAOYSA-N 1 2 308.223 4.018 20 0 DIADLO COc1ccc(-c2ccccc2)cc1C[NH2+]Cc1nccs1 ZINC000343364041 335159640 /nfs/dbraw/zinc/15/96/40/335159640.db2.gz CPKNUKRHRMIPOR-UHFFFAOYSA-N 1 2 310.422 4.109 20 0 DIADLO CCS[C@H](C)c1noc(CSCCc2cccc(C)[nH+]2)n1 ZINC000571562413 333816267 /nfs/dbraw/zinc/81/62/67/333816267.db2.gz ILRVGLUPRZJOPY-GFCCVEGCSA-N 1 2 323.487 4.063 20 0 DIADLO CCC(CC)[C@H](C)C(=O)N1CCCC[C@@H]1c1[nH+]ccn1CC ZINC000435981205 333831513 /nfs/dbraw/zinc/83/15/13/333831513.db2.gz IOGYISZPHSQPSK-GOEBONIOSA-N 1 2 305.466 4.029 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000413278049 333839231 /nfs/dbraw/zinc/83/92/31/333839231.db2.gz HJMIWJNYOBPFAP-DLBZAZTESA-N 1 2 317.477 4.460 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1cc2n(n1)CCC2 ZINC000414130534 333899783 /nfs/dbraw/zinc/89/97/83/333899783.db2.gz WQAXRGAFQNSOFA-QWRGUYRKSA-N 1 2 307.800 4.034 20 0 DIADLO CCn1ccc(C[NH2+][C@H](C)c2cc(F)c(Cl)cc2Cl)n1 ZINC000414211238 333922156 /nfs/dbraw/zinc/92/21/56/333922156.db2.gz PQASRCHHOPIJRH-SECBINFHSA-N 1 2 316.207 4.200 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccsc2Br)s1 ZINC000388742510 333927484 /nfs/dbraw/zinc/92/74/84/333927484.db2.gz KNOCSEOCFCFNIZ-MRVPVSSYSA-N 1 2 317.277 4.126 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1csnn1)c1cc(Cl)cc(Cl)c1 ZINC000414309353 333937059 /nfs/dbraw/zinc/93/70/59/333937059.db2.gz UVWAYJBZRSAUKA-SFYZADRCSA-N 1 2 302.230 4.257 20 0 DIADLO c1sc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)nc1C1CC1 ZINC000343546224 335171437 /nfs/dbraw/zinc/17/14/37/335171437.db2.gz FTGDREINOLNVBP-MRXNPFEDSA-N 1 2 316.495 4.311 20 0 DIADLO c1sc(C[N@H+]2CCSC[C@@H]2c2ccccc2)nc1C1CC1 ZINC000343546224 335171438 /nfs/dbraw/zinc/17/14/38/335171438.db2.gz FTGDREINOLNVBP-MRXNPFEDSA-N 1 2 316.495 4.311 20 0 DIADLO Cc1ccc2sc(C[NH2+][C@H](C)c3c(F)cncc3F)nc2c1 ZINC000528506539 333992410 /nfs/dbraw/zinc/99/24/10/333992410.db2.gz QRJDEXZMYINRIW-SNVBAGLBSA-N 1 2 319.380 4.129 20 0 DIADLO FC(F)(F)C1=CC[N@H+](Cc2csc(-c3ccco3)n2)CC1 ZINC000270340667 334011728 /nfs/dbraw/zinc/01/17/28/334011728.db2.gz UMRFYNHLEOEMTN-UHFFFAOYSA-N 1 2 314.332 4.098 20 0 DIADLO FC(F)(F)C1=CC[N@@H+](Cc2csc(-c3ccco3)n2)CC1 ZINC000270340667 334011730 /nfs/dbraw/zinc/01/17/30/334011730.db2.gz UMRFYNHLEOEMTN-UHFFFAOYSA-N 1 2 314.332 4.098 20 0 DIADLO Cc1cc(F)ccc1-c1ccc(C[NH2+][C@H](C)c2csnn2)o1 ZINC000414550279 334015444 /nfs/dbraw/zinc/01/54/44/334015444.db2.gz NJOSXWWLUHPNFA-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO Clc1ccc(Cl)c(C[NH2+]Cc2nnc(C3CC3)s2)c1 ZINC000414560143 334018785 /nfs/dbraw/zinc/01/87/85/334018785.db2.gz WFVPUPYILWKBQB-UHFFFAOYSA-N 1 2 314.241 4.012 20 0 DIADLO Brc1ccsc1C[N@H+](Cc1cccnc1)C1CC1 ZINC000271375103 334021944 /nfs/dbraw/zinc/02/19/44/334021944.db2.gz NSLSGYCSOFGFEQ-UHFFFAOYSA-N 1 2 323.259 4.070 20 0 DIADLO Brc1ccsc1C[N@@H+](Cc1cccnc1)C1CC1 ZINC000271375103 334021946 /nfs/dbraw/zinc/02/19/46/334021946.db2.gz NSLSGYCSOFGFEQ-UHFFFAOYSA-N 1 2 323.259 4.070 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(C(F)(F)F)cc1 ZINC000276471850 334079510 /nfs/dbraw/zinc/07/95/10/334079510.db2.gz YYFFWQZZKQTUBU-SNVBAGLBSA-N 1 2 310.319 4.422 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc2c(ccc3ccccc23)o1)c1ncnn1C ZINC000276523340 334080791 /nfs/dbraw/zinc/08/07/91/334080791.db2.gz CAOYFVRFORZNGT-QWHCGFSZSA-N 1 2 320.396 4.126 20 0 DIADLO CC(C)[C@@H](NC(=O)CCc1ccc2ccccc2c1)c1[nH]cc[nH+]1 ZINC000276577950 334082491 /nfs/dbraw/zinc/08/24/91/334082491.db2.gz JFTOOEWWAPEGCQ-LJQANCHMSA-N 1 2 321.424 4.009 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2CC(C)(C)Oc3ccccc32)c(C)[nH+]1 ZINC000414789528 334097407 /nfs/dbraw/zinc/09/74/07/334097407.db2.gz OUQKTONDWXQHSS-INIZCTEOSA-N 1 2 324.424 4.290 20 0 DIADLO C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)CC(=O)OC(C)(C)C ZINC000195732513 334107765 /nfs/dbraw/zinc/10/77/65/334107765.db2.gz IGGHQNFOXGVBID-LLVKDONJSA-N 1 2 317.351 4.040 20 0 DIADLO C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CC(=O)OC(C)(C)C ZINC000195732513 334107767 /nfs/dbraw/zinc/10/77/67/334107767.db2.gz IGGHQNFOXGVBID-LLVKDONJSA-N 1 2 317.351 4.040 20 0 DIADLO Cn1cc(CNc2ccc3c(c2)CCC[NH2+]3)c(-c2cccs2)n1 ZINC000414848694 334121313 /nfs/dbraw/zinc/12/13/13/334121313.db2.gz KSTYARUPTMIXOQ-UHFFFAOYSA-N 1 2 324.453 4.119 20 0 DIADLO COc1ccc(CNc2ccc3c(c2)CCC[NH2+]3)c(Cl)c1 ZINC000414851654 334125765 /nfs/dbraw/zinc/12/57/65/334125765.db2.gz OQBZGIQBJAZAFV-UHFFFAOYSA-N 1 2 302.805 4.319 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)Cc1ccc(Cl)cc1 ZINC000287506205 334157919 /nfs/dbraw/zinc/15/79/19/334157919.db2.gz LWUPYJIAGUBJPX-UHFFFAOYSA-N 1 2 303.793 4.016 20 0 DIADLO FC1(c2cccc(Cl)c2)CC[NH+](Cc2nccs2)CC1 ZINC000343659653 335180512 /nfs/dbraw/zinc/18/05/12/335180512.db2.gz NPFBCFVVEKTODW-UHFFFAOYSA-N 1 2 310.825 4.257 20 0 DIADLO Fc1cc(F)c(NCc2cn3cc(Cl)ccc3[nH+]2)cc1F ZINC000156584311 334184578 /nfs/dbraw/zinc/18/45/78/334184578.db2.gz SPYIJFZDNJHIQV-UHFFFAOYSA-N 1 2 311.694 4.017 20 0 DIADLO CC(C)c1nnc(C[NH2+]C2(c3cccc(Cl)c3)CC2)s1 ZINC000295051933 334215989 /nfs/dbraw/zinc/21/59/89/334215989.db2.gz UOXSGPSOIUHDAB-UHFFFAOYSA-N 1 2 307.850 4.094 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc([C@H](C)C(F)(F)F)cc2)no1 ZINC000295628046 334225999 /nfs/dbraw/zinc/22/59/99/334225999.db2.gz XBZRFTYXOMOZIS-LBPRGKRZSA-N 1 2 312.335 4.281 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc([C@H](C)C(F)(F)F)cc2)no1 ZINC000295628046 334226001 /nfs/dbraw/zinc/22/60/01/334226001.db2.gz XBZRFTYXOMOZIS-LBPRGKRZSA-N 1 2 312.335 4.281 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2cc(COC(C)(C)C)on2)cs1 ZINC000296272940 334231105 /nfs/dbraw/zinc/23/11/05/334231105.db2.gz CGKOTHHATBZYFY-LBPRGKRZSA-N 1 2 308.447 4.210 20 0 DIADLO Cc1c(N[C@H]2C[C@@H](C)n3cc[nH+]c32)cnn1-c1cc(C)ccc1C ZINC000296349113 334232705 /nfs/dbraw/zinc/23/27/05/334232705.db2.gz HISRJNTVNCSKDW-ZBFHGGJFSA-N 1 2 321.428 4.112 20 0 DIADLO Cc1cnc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)s1 ZINC000296826207 334236809 /nfs/dbraw/zinc/23/68/09/334236809.db2.gz NOSCGJUVTARXMS-UHFFFAOYSA-N 1 2 324.453 4.263 20 0 DIADLO CCCOc1ccc(N[C@@H]2CCn3cc[nH+]c32)cc1OCCC ZINC000296923317 334237892 /nfs/dbraw/zinc/23/78/92/334237892.db2.gz PTOXAVYXRYFSDU-OAHLLOKOSA-N 1 2 315.417 4.018 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)oc1C ZINC000299651923 334256910 /nfs/dbraw/zinc/25/69/10/334256910.db2.gz SQLXZFYIBJZWDL-UHFFFAOYSA-N 1 2 311.212 4.377 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)c1nc2ccccc2n1C ZINC000187581497 334265716 /nfs/dbraw/zinc/26/57/16/334265716.db2.gz GQBKXFHWPIDUFT-LLVKDONJSA-N 1 2 317.795 4.217 20 0 DIADLO C[C@@H](Nc1cnn([C@H](C)C2CC2)c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000187623291 334267601 /nfs/dbraw/zinc/26/76/01/334267601.db2.gz LGFJREMGUTYVRG-HUUCEWRRSA-N 1 2 321.428 4.213 20 0 DIADLO C[C@H](Nc1cnn([C@@H](C)C2CC2)c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000187623251 334267748 /nfs/dbraw/zinc/26/77/48/334267748.db2.gz LGFJREMGUTYVRG-GJZGRUSLSA-N 1 2 321.428 4.213 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2ccc(Cl)cc2)c2ncc[nH]2)cc1 ZINC000187684267 334267846 /nfs/dbraw/zinc/26/78/46/334267846.db2.gz AYOMHLVDYFXWRE-MRXNPFEDSA-N 1 2 315.779 4.081 20 0 DIADLO COc1cc(C)[nH+]c(CN(C)Cc2csc3ccccc23)c1 ZINC000534553952 334284434 /nfs/dbraw/zinc/28/44/34/334284434.db2.gz GVCFMYVKKMLKMM-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](CC(=O)OC(C)(C)C)C1CC1 ZINC000110985099 334298848 /nfs/dbraw/zinc/29/88/48/334298848.db2.gz KOJKHFBQXNVWHZ-LBPRGKRZSA-N 1 2 309.837 4.207 20 0 DIADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](CC(=O)OC(C)(C)C)C1CC1 ZINC000110985099 334298849 /nfs/dbraw/zinc/29/88/49/334298849.db2.gz KOJKHFBQXNVWHZ-LBPRGKRZSA-N 1 2 309.837 4.207 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(C(F)(F)F)cc2C)s1 ZINC000443002920 338441597 /nfs/dbraw/zinc/44/15/97/338441597.db2.gz UENNYHXGZUVCGI-VIFPVBQESA-N 1 2 315.364 4.025 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1noc(Cc2ccccc2)n1)c1ccccc1 ZINC000111195510 334310715 /nfs/dbraw/zinc/31/07/15/334310715.db2.gz OPSCRQXYARTZHB-FQEVSTJZSA-N 1 2 321.424 4.147 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(F)c(F)c2)C[C@@H](c2ccc(F)cc2)O1 ZINC000303841685 334334679 /nfs/dbraw/zinc/33/46/79/334334679.db2.gz BRQAKIRGZLHUFC-SGTLLEGYSA-N 1 2 321.342 4.066 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(F)c(F)c2)C[C@@H](c2ccc(F)cc2)O1 ZINC000303841685 334334680 /nfs/dbraw/zinc/33/46/80/334334680.db2.gz BRQAKIRGZLHUFC-SGTLLEGYSA-N 1 2 321.342 4.066 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccccc2Cl)C[C@H](c2ccc(F)cc2)O1 ZINC000303840370 334336343 /nfs/dbraw/zinc/33/63/43/334336343.db2.gz BNZHRFRDJRFSJB-FZKQIMNGSA-N 1 2 319.807 4.441 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccccc2Cl)C[C@H](c2ccc(F)cc2)O1 ZINC000303840370 334336344 /nfs/dbraw/zinc/33/63/44/334336344.db2.gz BNZHRFRDJRFSJB-FZKQIMNGSA-N 1 2 319.807 4.441 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1ccccc1Cl)c1ccco1 ZINC000101597039 334336369 /nfs/dbraw/zinc/33/63/69/334336369.db2.gz RSOVOJDCXZDWQZ-INIZCTEOSA-N 1 2 307.821 4.437 20 0 DIADLO CC1(C)CCCN(C(=O)c2ccc3[nH+]ccn3c2)c2ccccc21 ZINC000534842487 334339548 /nfs/dbraw/zinc/33/95/48/334339548.db2.gz AYCWWBPILPWZHY-UHFFFAOYSA-N 1 2 319.408 4.053 20 0 DIADLO Cc1nc(N2CCc3ccccc3[C@H]2Cc2ccccc2)cc[nH+]1 ZINC000534881987 334343467 /nfs/dbraw/zinc/34/34/67/334343467.db2.gz ISMPJKHIWRNGKJ-HXUWFJFHSA-N 1 2 315.420 4.132 20 0 DIADLO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1csc([C@@H](C)OC)n1 ZINC000531979649 334350832 /nfs/dbraw/zinc/35/08/32/334350832.db2.gz XWFLIQCCAXLKRS-CHWSQXEVSA-N 1 2 320.458 4.018 20 0 DIADLO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1csc([C@@H](C)OC)n1 ZINC000531979651 334350846 /nfs/dbraw/zinc/35/08/46/334350846.db2.gz XWFLIQCCAXLKRS-QWHCGFSZSA-N 1 2 320.458 4.018 20 0 DIADLO CC(C)C[C@H](C)Oc1cc(C[NH2+][C@H](C)c2cscn2)ccn1 ZINC000535064648 334362449 /nfs/dbraw/zinc/36/24/49/334362449.db2.gz TXCSXSOPQKLSEG-UONOGXRCSA-N 1 2 319.474 4.202 20 0 DIADLO Cc1nc(C[N@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)oc1C ZINC000049983160 334365386 /nfs/dbraw/zinc/36/53/86/334365386.db2.gz JPPDJUVEFUYCCX-UHFFFAOYSA-N 1 2 324.346 4.475 20 0 DIADLO Cc1nc(C[N@@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)oc1C ZINC000049983160 334365387 /nfs/dbraw/zinc/36/53/87/334365387.db2.gz JPPDJUVEFUYCCX-UHFFFAOYSA-N 1 2 324.346 4.475 20 0 DIADLO Cc1cc(NC(=O)c2ccccc2OCc2cccs2)cc[nH+]1 ZINC000112298266 334381454 /nfs/dbraw/zinc/38/14/54/334381454.db2.gz HDACWBLWJQJKRC-UHFFFAOYSA-N 1 2 324.405 4.283 20 0 DIADLO Cc1cccc2[nH+]c(CNc3c(F)cc(Cl)cc3F)cn21 ZINC000340934903 334394732 /nfs/dbraw/zinc/39/47/32/334394732.db2.gz CYHRROILUWSDNK-UHFFFAOYSA-N 1 2 307.731 4.186 20 0 DIADLO Brc1cnc(C[N@H+](Cc2ccccc2)C2CC2)s1 ZINC000340909493 334397154 /nfs/dbraw/zinc/39/71/54/334397154.db2.gz IHRRJDMKZXCYPI-UHFFFAOYSA-N 1 2 323.259 4.070 20 0 DIADLO Brc1cnc(C[N@@H+](Cc2ccccc2)C2CC2)s1 ZINC000340909493 334397155 /nfs/dbraw/zinc/39/71/55/334397155.db2.gz IHRRJDMKZXCYPI-UHFFFAOYSA-N 1 2 323.259 4.070 20 0 DIADLO CN(c1cc[nH+]c2ccncc21)C1CCC(C(F)(F)F)CC1 ZINC000341058880 334406055 /nfs/dbraw/zinc/40/60/55/334406055.db2.gz FLTSPBZDDYLFON-UHFFFAOYSA-N 1 2 309.335 4.187 20 0 DIADLO Cc1ccccc1[C@H](C)CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000341183006 334416389 /nfs/dbraw/zinc/41/63/89/334416389.db2.gz UZSNFTBVNOGDNR-MRXNPFEDSA-N 1 2 319.408 4.313 20 0 DIADLO Cc1c[nH+]c(CNc2ccc3oc(CC(C)(C)C)nc3c2)n1C ZINC000341301139 334433221 /nfs/dbraw/zinc/43/32/21/334433221.db2.gz MAQPKEJPUFEMNI-UHFFFAOYSA-N 1 2 312.417 4.070 20 0 DIADLO CCCN(Cc1[nH+]ccn1CC)Cc1c(F)cccc1Cl ZINC000341832751 334483190 /nfs/dbraw/zinc/48/31/90/334483190.db2.gz XTHGHPFSRLZZMD-UHFFFAOYSA-N 1 2 309.816 4.108 20 0 DIADLO COc1cc[nH+]cc1CSCc1cc(F)cc2cccnc21 ZINC000341951641 334495356 /nfs/dbraw/zinc/49/53/56/334495356.db2.gz JIDKMFKNZOPRMQ-UHFFFAOYSA-N 1 2 314.385 4.211 20 0 DIADLO Cn1c(N2CCC[C@@H]2c2ccsc2)[nH+]c2cccc(F)c21 ZINC000443525611 338453570 /nfs/dbraw/zinc/45/35/70/338453570.db2.gz ZNBOGSRWDSQAGD-CQSZACIVSA-N 1 2 301.390 4.115 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2nc(C3CC3)cs2)sc1C ZINC000342751424 334566512 /nfs/dbraw/zinc/56/65/12/334566512.db2.gz MTXJBEQFJOJYHA-UHFFFAOYSA-N 1 2 307.488 4.119 20 0 DIADLO OC[C@@H](Nc1cc[nH+]c2c(Cl)cccc12)c1ccsc1 ZINC000342880263 334586045 /nfs/dbraw/zinc/58/60/45/334586045.db2.gz FKDREVWIEUQFCP-CQSZACIVSA-N 1 2 304.802 4.095 20 0 DIADLO Cc1nccnc1[C@@H](C)[NH2+][C@H](c1ccccc1)c1cccc(F)c1 ZINC000188136594 334656001 /nfs/dbraw/zinc/65/60/01/334656001.db2.gz NRKYNQGXQKETCM-FOIQADDNSA-N 1 2 321.399 4.364 20 0 DIADLO Cc1ccccc1[C@H]1C[C@H](C)N(c2cc[nH+]c3ccncc32)C1 ZINC000444069504 338467960 /nfs/dbraw/zinc/46/79/60/338467960.db2.gz HXUPORVANASHLJ-HOTGVXAUSA-N 1 2 303.409 4.321 20 0 DIADLO CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)Nc1ccc(C)[nH+]c1C ZINC000331336735 334854544 /nfs/dbraw/zinc/85/45/44/334854544.db2.gz YRTGVECEZVVLLF-VMGRFDJRSA-N 1 2 304.434 4.011 20 0 DIADLO C[C@@H]1CN(c2cc[nH+]c3ccncc32)CC[C@@H]1c1ccccc1 ZINC000444090955 338468117 /nfs/dbraw/zinc/46/81/17/338468117.db2.gz UAQGXSLMKSMQJF-WBVHZDCISA-N 1 2 303.409 4.260 20 0 DIADLO C[C@H](C1CC1)n1cc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)cn1 ZINC000563693990 334860400 /nfs/dbraw/zinc/86/04/00/334860400.db2.gz UTYYMYZXWPCPPQ-CXAGYDPISA-N 1 2 313.449 4.311 20 0 DIADLO C[C@@H](Nc1cc[nH+]c2ccncc12)c1cccc(C(F)(F)F)c1 ZINC000444116442 338468718 /nfs/dbraw/zinc/46/87/18/338468718.db2.gz VZOXUWJVOBKEIA-LLVKDONJSA-N 1 2 317.314 4.244 20 0 DIADLO CSCc1cccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)c1 ZINC000188714346 334872790 /nfs/dbraw/zinc/87/27/90/334872790.db2.gz IMGALGSUPHTZGG-GOSISDBHSA-N 1 2 323.465 4.152 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2cc(F)ccc2Cl)C2CC2)n1 ZINC000189353042 334892615 /nfs/dbraw/zinc/89/26/15/334892615.db2.gz CAZJWRQURYVMHC-AWEZNQCLSA-N 1 2 310.825 4.485 20 0 DIADLO Cc1nc(C)c(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)s1 ZINC000343818718 335195456 /nfs/dbraw/zinc/19/54/56/335195456.db2.gz OWLGUMZMDBMSBK-SSDOTTSWSA-N 1 2 321.393 4.086 20 0 DIADLO COc1cc[nH+]cc1CSc1ncnc2sc(C)c(C)c21 ZINC000343840714 335196445 /nfs/dbraw/zinc/19/64/45/335196445.db2.gz NZFDKAUXIRYEEN-UHFFFAOYSA-N 1 2 317.439 4.004 20 0 DIADLO Fc1ccc2cc[nH+]c(NCC3(c4ccccn4)CCC3)c2c1 ZINC000343954564 335207634 /nfs/dbraw/zinc/20/76/34/335207634.db2.gz OZIZYWIDVWIGJD-UHFFFAOYSA-N 1 2 307.372 4.303 20 0 DIADLO FC(F)c1nc2ccc(Nc3[nH+]cnc4[nH]ccc43)cc2s1 ZINC000343960648 335207931 /nfs/dbraw/zinc/20/79/31/335207931.db2.gz MMEIMONMSFKJGM-UHFFFAOYSA-N 1 2 317.324 4.249 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](C)c2ccc(Oc3cccnc3)cc2)o1 ZINC000344054266 335213414 /nfs/dbraw/zinc/21/34/14/335213414.db2.gz BGSYWWDZLDEGIW-AWEZNQCLSA-N 1 2 309.369 4.021 20 0 DIADLO COc1cc[nH+]cc1CSc1nc(-c2ccccc2)c(C)[nH]1 ZINC000344068577 335214769 /nfs/dbraw/zinc/21/47/69/335214769.db2.gz GYROLFFRVKECME-UHFFFAOYSA-N 1 2 311.410 4.081 20 0 DIADLO C[C@@H]([NH2+]Cc1nccn1C)c1cc2c(ccc3ccccc23)o1 ZINC000344079610 335215938 /nfs/dbraw/zinc/21/59/38/335215938.db2.gz TZQKINIYPJFELR-CYBMUJFWSA-N 1 2 305.381 4.170 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2ccc(Oc3cccnc3)cc2)no1 ZINC000344089392 335217033 /nfs/dbraw/zinc/21/70/33/335217033.db2.gz IXIDTBFZKIZYDV-CQSZACIVSA-N 1 2 309.369 4.021 20 0 DIADLO Brc1csc(C[N@@H+]2CCCc3occc3C2)c1 ZINC000344252526 335232408 /nfs/dbraw/zinc/23/24/08/335232408.db2.gz HMSBZOPOROAVIO-UHFFFAOYSA-N 1 2 312.232 4.052 20 0 DIADLO Brc1csc(C[N@H+]2CCCc3occc3C2)c1 ZINC000344252526 335232409 /nfs/dbraw/zinc/23/24/09/335232409.db2.gz HMSBZOPOROAVIO-UHFFFAOYSA-N 1 2 312.232 4.052 20 0 DIADLO CCCCCn1cc(C[NH2+]Cc2ncc(C(C)C)s2)c(C)n1 ZINC000344319431 335240452 /nfs/dbraw/zinc/24/04/52/335240452.db2.gz BQQAEHHBEHYJFO-UHFFFAOYSA-N 1 2 320.506 4.251 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2ccccc2[nH]1)c1cc(F)ccc1F ZINC000344483989 335253078 /nfs/dbraw/zinc/25/30/78/335253078.db2.gz WDNRYFLSQBRIPU-AWEZNQCLSA-N 1 2 301.340 4.082 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]Cc2cc3cc(F)ccc3o2)cs1 ZINC000344710257 335274745 /nfs/dbraw/zinc/27/47/45/335274745.db2.gz MSCVXFJTAUJNQF-JTQLQIEISA-N 1 2 320.389 4.026 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CCS[C@@H](C)[C@@H]1c1ccccc1 ZINC000345158258 335302369 /nfs/dbraw/zinc/30/23/69/335302369.db2.gz PUZASUFEKKRSQR-MAUKXSAKSA-N 1 2 315.486 4.143 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CCS[C@@H](C)[C@@H]1c1ccccc1 ZINC000345158258 335302370 /nfs/dbraw/zinc/30/23/70/335302370.db2.gz PUZASUFEKKRSQR-MAUKXSAKSA-N 1 2 315.486 4.143 20 0 DIADLO CC(C)[C@@H](N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1)C(F)(F)F ZINC000345162102 335302525 /nfs/dbraw/zinc/30/25/25/335302525.db2.gz KBOYSHWBCDRSPP-IUODEOHRSA-N 1 2 311.351 4.110 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2csc(Cl)c2)s1 ZINC000345329555 335317683 /nfs/dbraw/zinc/31/76/83/335317683.db2.gz ZBCXOZBTPVSSSC-MRVPVSSYSA-N 1 2 301.868 4.227 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2ccc(F)cn2)C2CC2)o1 ZINC000345775987 335350642 /nfs/dbraw/zinc/35/06/42/335350642.db2.gz RSTUJTZVGFVNIU-SJCJKPOMSA-N 1 2 300.377 4.102 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2ccc(F)cn2)C2CC2)o1 ZINC000345775987 335350643 /nfs/dbraw/zinc/35/06/43/335350643.db2.gz RSTUJTZVGFVNIU-SJCJKPOMSA-N 1 2 300.377 4.102 20 0 DIADLO Fc1ccc(C=C2CC[NH+](Cc3nccs3)CC2)cc1F ZINC000346099346 335374750 /nfs/dbraw/zinc/37/47/50/335374750.db2.gz RJWGLYYRMZKHTJ-UHFFFAOYSA-N 1 2 306.381 4.101 20 0 DIADLO c1cc([C@@H]2C[N@H+](C[C@@H]3CCC4(CCCCC4)O3)CCO2)cs1 ZINC000190982405 335376848 /nfs/dbraw/zinc/37/68/48/335376848.db2.gz HSKYVQLICORLCB-IRXDYDNUSA-N 1 2 321.486 4.003 20 0 DIADLO c1cc([C@@H]2C[N@@H+](C[C@@H]3CCC4(CCCCC4)O3)CCO2)cs1 ZINC000190982405 335376850 /nfs/dbraw/zinc/37/68/50/335376850.db2.gz HSKYVQLICORLCB-IRXDYDNUSA-N 1 2 321.486 4.003 20 0 DIADLO CC(C)c1cnc(C[N@H+](C)C[C@@H]2OCCc3ccccc32)s1 ZINC000346148319 335381895 /nfs/dbraw/zinc/38/18/95/335381895.db2.gz KJMYGKFVGKKJJP-INIZCTEOSA-N 1 2 316.470 4.012 20 0 DIADLO CC(C)c1cnc(C[N@@H+](C)C[C@@H]2OCCc3ccccc32)s1 ZINC000346148319 335381896 /nfs/dbraw/zinc/38/18/96/335381896.db2.gz KJMYGKFVGKKJJP-INIZCTEOSA-N 1 2 316.470 4.012 20 0 DIADLO Cn1cncc1C[N@@H+]1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000346155487 335382789 /nfs/dbraw/zinc/38/27/89/335382789.db2.gz UWFBOKOILBIQBE-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO Cn1cncc1C[N@H+]1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000346155487 335382790 /nfs/dbraw/zinc/38/27/90/335382790.db2.gz UWFBOKOILBIQBE-MRXNPFEDSA-N 1 2 323.362 4.166 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1noc(C2CC2)n1 ZINC000346307650 335398398 /nfs/dbraw/zinc/39/83/98/335398398.db2.gz YGCADHPKLOMZJN-AWEZNQCLSA-N 1 2 305.809 4.184 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1noc(C2CC2)n1 ZINC000346307650 335398399 /nfs/dbraw/zinc/39/83/99/335398399.db2.gz YGCADHPKLOMZJN-AWEZNQCLSA-N 1 2 305.809 4.184 20 0 DIADLO CCCCOc1ccc([C@H](C)Nc2cc(C)[nH+]cn2)cc1OC ZINC000346730440 335432434 /nfs/dbraw/zinc/43/24/34/335432434.db2.gz DPJDEJFPFHISSY-AWEZNQCLSA-N 1 2 315.417 4.146 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1Oc1ccccc1)c1nncn1C ZINC000346932385 335455688 /nfs/dbraw/zinc/45/56/88/335455688.db2.gz AXQZTPKLSRUBKM-LSDHHAIUSA-N 1 2 322.412 4.019 20 0 DIADLO CC1(Cc2noc(-c3cccc(-n4cc[nH+]c4)c3)n2)CCCC1 ZINC000347463235 335498780 /nfs/dbraw/zinc/49/87/80/335498780.db2.gz FTELANCXVMZREV-UHFFFAOYSA-N 1 2 308.385 4.045 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[NH2+][C@@H](C)c1cccc(O)c1 ZINC000444750322 338486922 /nfs/dbraw/zinc/48/69/22/338486922.db2.gz BAANIDYWZDAFDL-ZDUSSCGKSA-N 1 2 308.381 4.206 20 0 DIADLO CCn1cc[nH+]c1CN1C[C@@H](c2ccccc2)c2ccccc21 ZINC000444771408 338487467 /nfs/dbraw/zinc/48/74/67/338487467.db2.gz JAXFJHKBQJHATC-SFHVURJKSA-N 1 2 303.409 4.055 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(-c2ccc(F)cc2)no1)c1nccs1 ZINC000347904506 335533164 /nfs/dbraw/zinc/53/31/64/335533164.db2.gz BDYWABCQNATQMS-CQSZACIVSA-N 1 2 317.389 4.178 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cccc(C(F)F)c1)c1nc(C2CC2)no1 ZINC000348061299 335545299 /nfs/dbraw/zinc/54/52/99/335545299.db2.gz YHEZGQOXOPZSQR-CQSZACIVSA-N 1 2 321.371 4.372 20 0 DIADLO Cc1noc([C@@H](C)[NH2+][C@@H]2CCc3c2cc(Cl)cc3Cl)n1 ZINC000348094811 335552823 /nfs/dbraw/zinc/55/28/23/335552823.db2.gz ZNXCALMJTAOXMV-FUXBKTLASA-N 1 2 312.200 4.023 20 0 DIADLO Cc1csc([C@H](C)[NH2+]Cc2csc(CCC(C)C)n2)n1 ZINC000348113322 335554769 /nfs/dbraw/zinc/55/47/69/335554769.db2.gz QTTBKAFWHOXFLI-LBPRGKRZSA-N 1 2 309.504 4.347 20 0 DIADLO CCc1ccc([C@H](C)[NH2+]Cc2c(F)cc(F)c(F)c2F)o1 ZINC000430749756 335645766 /nfs/dbraw/zinc/64/57/66/335645766.db2.gz LJNNPAYNDQTDCG-QMMMGPOBSA-N 1 2 301.283 4.249 20 0 DIADLO Cc1[nH+]c2ccccc2c(NC(=O)c2cscn2)c1C(C)C ZINC000191322943 335678762 /nfs/dbraw/zinc/67/87/62/335678762.db2.gz ZAUCRHSEMLHFJE-UHFFFAOYSA-N 1 2 311.410 4.375 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+]Cc3nnc(C(C)C)s3)cc2c1C ZINC000349562428 335680774 /nfs/dbraw/zinc/68/07/74/335680774.db2.gz DTRGWYMIGWLBLH-UHFFFAOYSA-N 1 2 314.458 4.049 20 0 DIADLO Cc1oc(-c2ccccc2)c(C(=O)Nc2cc(C)[nH+]cc2C)c1C ZINC000527328407 335812304 /nfs/dbraw/zinc/81/23/04/335812304.db2.gz HWBRPMKSENZGPE-UHFFFAOYSA-N 1 2 320.392 4.249 20 0 DIADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1sccc1Cl ZINC000519555401 335876743 /nfs/dbraw/zinc/87/67/43/335876743.db2.gz PHZLCSALHCYRDP-UHFFFAOYSA-N 1 2 303.774 4.044 20 0 DIADLO Cc1cc2ccccc2[nH+]c1N1CCC[C@@H](OCC(F)(F)F)C1 ZINC000532269540 335925001 /nfs/dbraw/zinc/92/50/01/335925001.db2.gz NGHVVVJBRGERGK-CQSZACIVSA-N 1 2 324.346 4.091 20 0 DIADLO C[C@H]1CCCC[C@H]1CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000520369643 335967903 /nfs/dbraw/zinc/96/79/03/335967903.db2.gz YYFHTDOVWDAHIV-KBPBESRZSA-N 1 2 315.392 4.166 20 0 DIADLO Cc1ccccc1-c1noc([C@@H](C)[N@@H+]2CCCc3occc3C2)n1 ZINC000329662611 336033821 /nfs/dbraw/zinc/03/38/21/336033821.db2.gz PNOXXRFKNQBKLI-CQSZACIVSA-N 1 2 323.396 4.147 20 0 DIADLO Cc1ccccc1-c1noc([C@@H](C)[N@H+]2CCCc3occc3C2)n1 ZINC000329662611 336033822 /nfs/dbraw/zinc/03/38/22/336033822.db2.gz PNOXXRFKNQBKLI-CQSZACIVSA-N 1 2 323.396 4.147 20 0 DIADLO CSCc1cnc(C[N@@H+]2CCc3ccccc3[C@H]2C)s1 ZINC000351475979 336036555 /nfs/dbraw/zinc/03/65/55/336036555.db2.gz HJKYEQSBXVZFGT-GFCCVEGCSA-N 1 2 304.484 4.125 20 0 DIADLO CSCc1cnc(C[N@H+]2CCc3ccccc3[C@H]2C)s1 ZINC000351475979 336036557 /nfs/dbraw/zinc/03/65/57/336036557.db2.gz HJKYEQSBXVZFGT-GFCCVEGCSA-N 1 2 304.484 4.125 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(-c3ccccc3F)o2)no1 ZINC000351567019 336044982 /nfs/dbraw/zinc/04/49/82/336044982.db2.gz FYQOREHUMNYSPD-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(-c3ccccc3F)o2)no1 ZINC000351567019 336044983 /nfs/dbraw/zinc/04/49/83/336044983.db2.gz FYQOREHUMNYSPD-UHFFFAOYSA-N 1 2 300.333 4.014 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2ccon2)ccc1Oc1cccnc1 ZINC000351577336 336046614 /nfs/dbraw/zinc/04/66/14/336046614.db2.gz FKLQUJTXMIEKGD-AWEZNQCLSA-N 1 2 309.369 4.021 20 0 DIADLO Cc1cc([NH+]2CCCC2)ccc1N[C@H]1CCCC12CCOCC2 ZINC000324140413 336094513 /nfs/dbraw/zinc/09/45/13/336094513.db2.gz MGRAMSXNQHNDLB-IBGZPJMESA-N 1 2 314.473 4.356 20 0 DIADLO Cc1cc(N2CCCC2)ccc1[NH2+][C@H]1CCCC12CCOCC2 ZINC000324140413 336094514 /nfs/dbraw/zinc/09/45/14/336094514.db2.gz MGRAMSXNQHNDLB-IBGZPJMESA-N 1 2 314.473 4.356 20 0 DIADLO COC(=O)c1cccc(Cl)c1C[N@H+](Cc1ccco1)C(C)C ZINC000351892599 336105358 /nfs/dbraw/zinc/10/53/58/336105358.db2.gz DBVJNDYHCWQHQZ-UHFFFAOYSA-N 1 2 321.804 4.130 20 0 DIADLO COC(=O)c1cccc(Cl)c1C[N@@H+](Cc1ccco1)C(C)C ZINC000351892599 336105360 /nfs/dbraw/zinc/10/53/60/336105360.db2.gz DBVJNDYHCWQHQZ-UHFFFAOYSA-N 1 2 321.804 4.130 20 0 DIADLO CC1(C)C[N@H+](Cc2csc(C3CCCC3)n2)[C@H]1[C@@H]1CCCO1 ZINC000351960156 336183423 /nfs/dbraw/zinc/18/34/23/336183423.db2.gz UTAYSXOWEHTPRF-HOTGVXAUSA-N 1 2 320.502 4.190 20 0 DIADLO CC1(C)C[N@@H+](Cc2csc(C3CCCC3)n2)[C@H]1[C@@H]1CCCO1 ZINC000351960156 336183425 /nfs/dbraw/zinc/18/34/25/336183425.db2.gz UTAYSXOWEHTPRF-HOTGVXAUSA-N 1 2 320.502 4.190 20 0 DIADLO Cc1csc(C[N@H+]2CC=C(c3c(F)cccc3F)CC2)n1 ZINC000351981207 336185646 /nfs/dbraw/zinc/18/56/46/336185646.db2.gz JSYACPRHLGSFRK-UHFFFAOYSA-N 1 2 306.381 4.019 20 0 DIADLO Cc1csc(C[N@@H+]2CC=C(c3c(F)cccc3F)CC2)n1 ZINC000351981207 336185648 /nfs/dbraw/zinc/18/56/48/336185648.db2.gz JSYACPRHLGSFRK-UHFFFAOYSA-N 1 2 306.381 4.019 20 0 DIADLO Clc1cnc(C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)s1 ZINC000351989988 336186405 /nfs/dbraw/zinc/18/64/05/336186405.db2.gz XIYWOBXSEHEZJV-CQSZACIVSA-N 1 2 304.846 4.448 20 0 DIADLO Clc1cnc(C[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)s1 ZINC000351989988 336186406 /nfs/dbraw/zinc/18/64/06/336186406.db2.gz XIYWOBXSEHEZJV-CQSZACIVSA-N 1 2 304.846 4.448 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)c1 ZINC000352011969 336188902 /nfs/dbraw/zinc/18/89/02/336188902.db2.gz WWNALKHBIXKZGO-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2ncc(Cl)s2)c1 ZINC000352011969 336188903 /nfs/dbraw/zinc/18/89/03/336188903.db2.gz WWNALKHBIXKZGO-ZDUSSCGKSA-N 1 2 308.834 4.142 20 0 DIADLO CC[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc2c(c1)CCO2 ZINC000324386448 336204920 /nfs/dbraw/zinc/20/49/20/336204920.db2.gz OTFICNZLHRMENU-GOSISDBHSA-N 1 2 323.440 4.180 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2c(Cl)oc3ccccc32)s1 ZINC000352284785 336209978 /nfs/dbraw/zinc/20/99/78/336209978.db2.gz BZKHXSTWXUEWKI-UHFFFAOYSA-N 1 2 306.818 4.483 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2c(Cl)oc3ccccc32)s1 ZINC000352284785 336209979 /nfs/dbraw/zinc/20/99/79/336209979.db2.gz BZKHXSTWXUEWKI-UHFFFAOYSA-N 1 2 306.818 4.483 20 0 DIADLO Cc1ccc(-c2csc(C[N@H+]3C[C@H](C)O[C@@H](C)[C@@H]3C)n2)cc1 ZINC000352413886 336217004 /nfs/dbraw/zinc/21/70/04/336217004.db2.gz RERRPNQHJCCCSA-KKUMJFAQSA-N 1 2 316.470 4.116 20 0 DIADLO Cc1ccc(-c2csc(C[N@@H+]3C[C@H](C)O[C@@H](C)[C@@H]3C)n2)cc1 ZINC000352413886 336217005 /nfs/dbraw/zinc/21/70/05/336217005.db2.gz RERRPNQHJCCCSA-KKUMJFAQSA-N 1 2 316.470 4.116 20 0 DIADLO Fc1cccc(Cl)c1C[N@@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000352439168 336218759 /nfs/dbraw/zinc/21/87/59/336218759.db2.gz KHJMZRDTIVOYQB-HZPDHXFCSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cccc(Cl)c1C[N@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000352439168 336218760 /nfs/dbraw/zinc/21/87/60/336218760.db2.gz KHJMZRDTIVOYQB-HZPDHXFCSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)cc1C[N@@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000352440301 336218920 /nfs/dbraw/zinc/21/89/20/336218920.db2.gz NECIVLUGUBJEGM-HOTGVXAUSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)cc1C[N@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000352440301 336218921 /nfs/dbraw/zinc/21/89/21/336218921.db2.gz NECIVLUGUBJEGM-HOTGVXAUSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cc(Cl)ccc1C[N@@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000352447959 336219482 /nfs/dbraw/zinc/21/94/82/336219482.db2.gz PLAAIQNYBVDDOL-HOTGVXAUSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cc(Cl)ccc1C[N@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000352447959 336219483 /nfs/dbraw/zinc/21/94/83/336219483.db2.gz PLAAIQNYBVDDOL-HOTGVXAUSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cc(Cl)ccc1C[N@@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000352447961 336219565 /nfs/dbraw/zinc/21/95/65/336219565.db2.gz PLAAIQNYBVDDOL-HZPDHXFCSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1cc(Cl)ccc1C[N@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000352447961 336219566 /nfs/dbraw/zinc/21/95/66/336219566.db2.gz PLAAIQNYBVDDOL-HZPDHXFCSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c1 ZINC000352449277 336219686 /nfs/dbraw/zinc/21/96/86/336219686.db2.gz YLGGXZLBOSFIEX-CVEARBPZSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c1 ZINC000352449277 336219687 /nfs/dbraw/zinc/21/96/87/336219687.db2.gz YLGGXZLBOSFIEX-CVEARBPZSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)c(C[N@@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)c1 ZINC000352449278 336219703 /nfs/dbraw/zinc/21/97/03/336219703.db2.gz YLGGXZLBOSFIEX-HOTGVXAUSA-N 1 2 309.812 4.013 20 0 DIADLO Fc1ccc(Cl)c(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)c1 ZINC000352449278 336219704 /nfs/dbraw/zinc/21/97/04/336219704.db2.gz YLGGXZLBOSFIEX-HOTGVXAUSA-N 1 2 309.812 4.013 20 0 DIADLO CC[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccc(F)cn1 ZINC000352556178 336224408 /nfs/dbraw/zinc/22/44/08/336224408.db2.gz WLSBSRAUMNIJBD-CYBMUJFWSA-N 1 2 317.389 4.178 20 0 DIADLO C[C@H]1CCC[C@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000352764192 336233638 /nfs/dbraw/zinc/23/36/38/336233638.db2.gz VFVWFDNDBIZHKJ-HOCLYGCPSA-N 1 2 310.397 4.182 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc(C(C)C)c(C)s1)c1ccc(F)cn1 ZINC000352754583 336235024 /nfs/dbraw/zinc/23/50/24/336235024.db2.gz VHNOWNIORVRGSN-CYBMUJFWSA-N 1 2 307.438 4.350 20 0 DIADLO C[N@H+](Cc1ccccc1F)Cc1ccccc1Br ZINC000042206034 336237302 /nfs/dbraw/zinc/23/73/02/336237302.db2.gz BTQZKGCFWPVZAK-UHFFFAOYSA-N 1 2 308.194 4.220 20 0 DIADLO C[N@@H+](Cc1ccccc1F)Cc1ccccc1Br ZINC000042206034 336237303 /nfs/dbraw/zinc/23/73/03/336237303.db2.gz BTQZKGCFWPVZAK-UHFFFAOYSA-N 1 2 308.194 4.220 20 0 DIADLO CC(C)(C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(F)cc1 ZINC000103078097 336237656 /nfs/dbraw/zinc/23/76/56/336237656.db2.gz YRACQIQKOREPOL-UHFFFAOYSA-N 1 2 323.371 4.132 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc(F)cc2Br)o1 ZINC000042229579 336239308 /nfs/dbraw/zinc/23/93/08/336239308.db2.gz FFVXLRDNMGIRSZ-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc(F)cc2Br)o1 ZINC000042229579 336239309 /nfs/dbraw/zinc/23/93/09/336239309.db2.gz FFVXLRDNMGIRSZ-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Brc1ccc(C[N@@H+]2CCc3sccc3C2)cc1 ZINC000042229707 336239392 /nfs/dbraw/zinc/23/93/92/336239392.db2.gz VUMNBPWYEUKMHH-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1ccc(C[N@H+]2CCc3sccc3C2)cc1 ZINC000042229707 336239393 /nfs/dbraw/zinc/23/93/93/336239393.db2.gz VUMNBPWYEUKMHH-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(Cl)c2)C[C@H](c2ccsc2)O1 ZINC000532352197 336243782 /nfs/dbraw/zinc/24/37/82/336243782.db2.gz SGMHVIYEXXZLCG-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(Cl)c2)C[C@H](c2ccsc2)O1 ZINC000532352197 336243783 /nfs/dbraw/zinc/24/37/83/336243783.db2.gz SGMHVIYEXXZLCG-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO CC[C@@H]([NH2+][C@H](c1nccn1C)c1ccccc1)c1ccc(F)cc1 ZINC000532453199 336247937 /nfs/dbraw/zinc/24/79/37/336247937.db2.gz GTRZAOJOPZFKOO-MOPGFXCFSA-N 1 2 323.415 4.390 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+](C)[C@@H](C)c2ccccc2F)cc1C ZINC000532473755 336249793 /nfs/dbraw/zinc/24/97/93/336249793.db2.gz QVCQXCRNIAORTD-HNNXBMFYSA-N 1 2 314.404 4.074 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+](C)[C@@H](C)c2ccccc2F)cc1C ZINC000532473755 336249794 /nfs/dbraw/zinc/24/97/94/336249794.db2.gz QVCQXCRNIAORTD-HNNXBMFYSA-N 1 2 314.404 4.074 20 0 DIADLO Fc1cc(CNc2ccc(N3CCCC3)[nH+]c2)ccc1Cl ZINC000043389302 336255148 /nfs/dbraw/zinc/25/51/48/336255148.db2.gz RVVPYKYOSAAOLJ-UHFFFAOYSA-N 1 2 305.784 4.086 20 0 DIADLO CSc1ccc(CNc2cccc(-n3cc[nH+]c3)c2)s1 ZINC000352826398 336263306 /nfs/dbraw/zinc/26/33/06/336263306.db2.gz DVFWHZKHWSXKHN-UHFFFAOYSA-N 1 2 301.440 4.268 20 0 DIADLO Fc1ccccc1[C@@H](F)C1CC[NH+](Cc2cscn2)CC1 ZINC000367136878 336269684 /nfs/dbraw/zinc/26/96/84/336269684.db2.gz CUROVKQFRHKMCR-INIZCTEOSA-N 1 2 308.397 4.205 20 0 DIADLO CSc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)s1 ZINC000352836200 336272595 /nfs/dbraw/zinc/27/25/95/336272595.db2.gz SFUCZNFATAJDLU-UHFFFAOYSA-N 1 2 301.440 4.268 20 0 DIADLO Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)c1cc[nH+]c(C)n1 ZINC000468884279 336275385 /nfs/dbraw/zinc/27/53/85/336275385.db2.gz IKEKCNAKDUMIDX-ZDUSSCGKSA-N 1 2 324.453 4.414 20 0 DIADLO Cc1ccccc1-c1cnc(C[NH+]2CC(C)(C)OC(C)(C)C2)o1 ZINC000526949798 336275870 /nfs/dbraw/zinc/27/58/70/336275870.db2.gz LIEIROBJWLKJOQ-UHFFFAOYSA-N 1 2 314.429 4.039 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(C(F)F)cc2)nc2ccccc12 ZINC000526979873 336277787 /nfs/dbraw/zinc/27/77/87/336277787.db2.gz AIFMXGSOHAPEIM-UHFFFAOYSA-N 1 2 313.351 4.166 20 0 DIADLO COc1cccc([C@H]2CCCN2c2cc(C)[nH+]c(C(C)C)n2)c1 ZINC000301097407 336289899 /nfs/dbraw/zinc/28/98/99/336289899.db2.gz WTYOVGUESXFQCB-QGZVFWFLSA-N 1 2 311.429 4.259 20 0 DIADLO c1cn(-c2ccc(CNc3nc4ccccc4s3)cc2)c[nH+]1 ZINC000301132904 336291595 /nfs/dbraw/zinc/29/15/95/336291595.db2.gz XOCZSJRZQHDTQY-UHFFFAOYSA-N 1 2 306.394 4.094 20 0 DIADLO COc1ccc2[nH+]c(N[C@@H]3CCOc4ccc(F)cc43)ccc2c1 ZINC000301192871 336294317 /nfs/dbraw/zinc/29/43/17/336294317.db2.gz ITKHFTXILRJNPA-QGZVFWFLSA-N 1 2 324.355 4.318 20 0 DIADLO CCc1cc(NCCSC(C)(C)C)nc(-c2ccncc2)[nH+]1 ZINC000301209116 336295028 /nfs/dbraw/zinc/29/50/28/336295028.db2.gz SLSWLGHJXNWKFL-UHFFFAOYSA-N 1 2 316.474 4.045 20 0 DIADLO c1cc(Nc2ccnc(C3CC3)n2)cc(Oc2cc[nH+]cc2)c1 ZINC000301237135 336296223 /nfs/dbraw/zinc/29/62/23/336296223.db2.gz MDRWNIOZBFNWKX-UHFFFAOYSA-N 1 2 304.353 4.285 20 0 DIADLO CCc1cc(N(C)[C@H](C)c2cccs2)nc(-c2ccncc2)[nH+]1 ZINC000301254925 336297131 /nfs/dbraw/zinc/29/71/31/336297131.db2.gz KBJDLXDYKHOXDF-CYBMUJFWSA-N 1 2 324.453 4.360 20 0 DIADLO CO[C@@H](c1ccc(Cl)cc1)[C@H](C)Nc1cc[nH+]c(C2CC2)n1 ZINC000301295147 336299343 /nfs/dbraw/zinc/29/93/43/336299343.db2.gz WYEWPBACQWBXQP-MEDUHNTESA-N 1 2 317.820 4.196 20 0 DIADLO CCc1ccccc1CNc1cc(C)[nH+]c(-c2cccnc2)n1 ZINC000301340009 336301521 /nfs/dbraw/zinc/30/15/21/336301521.db2.gz HSLVDXSZZLSAER-UHFFFAOYSA-N 1 2 304.397 4.022 20 0 DIADLO CCc1cc(N2[C@H](C)C[C@H]3CCCC[C@@H]32)nc(-c2ccncc2)[nH+]1 ZINC000301349998 336301960 /nfs/dbraw/zinc/30/19/60/336301960.db2.gz JMXOMOGNTYPROB-KYJSFNMBSA-N 1 2 322.456 4.258 20 0 DIADLO COc1ccc([C@H]2CCN(c3cc(C(F)(F)F)cc[nH+]3)C2)cc1 ZINC000301440828 336306911 /nfs/dbraw/zinc/30/69/11/336306911.db2.gz MPBDLVACSNDRBA-ZDUSSCGKSA-N 1 2 322.330 4.103 20 0 DIADLO COc1ccccc1O[C@H](C)CNc1ccc2ccccc2[nH+]1 ZINC000301485762 336309769 /nfs/dbraw/zinc/30/97/69/336309769.db2.gz ZKNIHTZYMUVBIM-CQSZACIVSA-N 1 2 308.381 4.123 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NC[C@H]2CCOc3ccccc32)c1 ZINC000301495438 336310355 /nfs/dbraw/zinc/31/03/55/336310355.db2.gz BMHPFJFBNCPQFM-LLVKDONJSA-N 1 2 308.303 4.079 20 0 DIADLO CC(C)(C)c1nc(NC[C@@H](O)c2ccc3ccccc3c2)cc[nH+]1 ZINC000301523223 336312227 /nfs/dbraw/zinc/31/22/27/336312227.db2.gz MFMASGBRFAVAKM-QGZVFWFLSA-N 1 2 321.424 4.073 20 0 DIADLO FC(F)(F)c1cc[nH+]c(NC2CCN(c3ccccc3)CC2)c1 ZINC000301533431 336312939 /nfs/dbraw/zinc/31/29/39/336312939.db2.gz SPFKGJSCWSTDCI-UHFFFAOYSA-N 1 2 321.346 4.181 20 0 DIADLO CC(C)[C@H](CNc1cc(C(F)(F)F)cc[nH+]1)c1cccnc1 ZINC000301553963 336314471 /nfs/dbraw/zinc/31/44/71/336314471.db2.gz GTJJVOVBXDUCKU-AWEZNQCLSA-N 1 2 309.335 4.347 20 0 DIADLO Cc1cc(N[C@H](C)c2ccccc2-n2cccn2)nc(C(C)C)[nH+]1 ZINC000301614913 336318472 /nfs/dbraw/zinc/31/84/72/336318472.db2.gz BCCFXYWLCAIVMZ-OAHLLOKOSA-N 1 2 321.428 4.267 20 0 DIADLO Cc1cc(NCCc2nc3ccccc3s2)nc(C(C)C)[nH+]1 ZINC000301657744 336321159 /nfs/dbraw/zinc/32/11/59/336321159.db2.gz SMNADWLLNMNTDE-UHFFFAOYSA-N 1 2 312.442 4.173 20 0 DIADLO COC[C@H](Nc1cc(C)[nH+]c2c(F)cccc12)c1ccc(C)o1 ZINC000301685014 336323378 /nfs/dbraw/zinc/32/33/78/336323378.db2.gz UECIQWSOXROKFS-INIZCTEOSA-N 1 2 314.360 4.383 20 0 DIADLO Cc1ccn(-c2ccccc2CNc2ccc3ccccc3[nH+]2)n1 ZINC000301702762 336324370 /nfs/dbraw/zinc/32/43/70/336324370.db2.gz QRWZTSGJARVMPX-UHFFFAOYSA-N 1 2 314.392 4.341 20 0 DIADLO C[C@H](C[C@H](O)c1ccc(F)cc1)Nc1ccc2ccccc2[nH+]1 ZINC000301750752 336327690 /nfs/dbraw/zinc/32/76/90/336327690.db2.gz ULCWUSQSGRAYKL-ACJLOTCBSA-N 1 2 310.372 4.298 20 0 DIADLO CC(C)Cn1cc[nH+]c1CNc1cc2ccccc2c(Cl)n1 ZINC000301785889 336329721 /nfs/dbraw/zinc/32/97/21/336329721.db2.gz VDKXXQNRYADPMY-UHFFFAOYSA-N 1 2 314.820 4.353 20 0 DIADLO CC(C)c1cc(N[C@H](CCO)c2ccccc2)nc(C(C)C)[nH+]1 ZINC000301799974 336330923 /nfs/dbraw/zinc/33/09/23/336330923.db2.gz BVAQZOJAMWTRMF-MRXNPFEDSA-N 1 2 313.445 4.259 20 0 DIADLO Cc1ccc([C@H]2CCCN2c2cc(NCC3CC3)[nH+]cn2)s1 ZINC000301820151 336332270 /nfs/dbraw/zinc/33/22/70/336332270.db2.gz JFAUXSYRLJLBEQ-CQSZACIVSA-N 1 2 314.458 4.010 20 0 DIADLO Cc1ccc([C@H]2CCCN2c2cc(NCC3CC3)nc[nH+]2)s1 ZINC000301820151 336332271 /nfs/dbraw/zinc/33/22/71/336332271.db2.gz JFAUXSYRLJLBEQ-CQSZACIVSA-N 1 2 314.458 4.010 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NC[C@@](C)(O)c1ccc(F)cc1 ZINC000301837432 336333271 /nfs/dbraw/zinc/33/32/71/336333271.db2.gz MOPXBAGMUKBUIP-LJQANCHMSA-N 1 2 310.372 4.002 20 0 DIADLO CC(C)[C@@H](Nc1[nH+]cnc2c1cnn2C(C)(C)C)c1ccccc1 ZINC000301844794 336333790 /nfs/dbraw/zinc/33/37/90/336333790.db2.gz SONCBHQTTVYYAH-MRXNPFEDSA-N 1 2 323.444 4.391 20 0 DIADLO CC(C)c1cc(NC[C@@](C)(O)c2cccs2)nc(C(C)C)[nH+]1 ZINC000301854685 336334390 /nfs/dbraw/zinc/33/43/90/336334390.db2.gz HOTWYRQYHFCOJE-QGZVFWFLSA-N 1 2 319.474 4.105 20 0 DIADLO COc1ccc([C@@H](Nc2nc(N)c3ccccc3[nH+]2)C(C)C)cc1 ZINC000301858025 336334573 /nfs/dbraw/zinc/33/45/73/336334573.db2.gz DPACFOJVMPHBJG-KRWDZBQOSA-N 1 2 322.412 4.030 20 0 DIADLO c1ccc2oc([C@H]3CCCN(c4[nH]c5ccccc5[nH+]4)C3)nc2c1 ZINC000301877852 336335807 /nfs/dbraw/zinc/33/58/07/336335807.db2.gz KXCOMRBEKBWFCE-ZDUSSCGKSA-N 1 2 318.380 4.088 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)Nc2nc(N)c3ccccc3[nH+]2)c1 ZINC000301884793 336336212 /nfs/dbraw/zinc/33/62/12/336336212.db2.gz OFAYDXKQLGPGPZ-CYBMUJFWSA-N 1 2 322.412 4.172 20 0 DIADLO Cc1cc(C)cc([C@@H](C)Nc2[nH+]cnc3c2cnn3C(C)(C)C)c1 ZINC000301895765 336336843 /nfs/dbraw/zinc/33/68/43/336336843.db2.gz PZEIZUWDKCWXKJ-CQSZACIVSA-N 1 2 323.444 4.371 20 0 DIADLO Cc1cc(C)cc([C@H](C)Nc2[nH+]cnc3c2cnn3C(C)(C)C)c1 ZINC000301895763 336336889 /nfs/dbraw/zinc/33/68/89/336336889.db2.gz PZEIZUWDKCWXKJ-AWEZNQCLSA-N 1 2 323.444 4.371 20 0 DIADLO Cc1cc(NCc2cn3cccc(C)c3[nH+]2)c2cccc(F)c2n1 ZINC000301999393 336342288 /nfs/dbraw/zinc/34/22/88/336342288.db2.gz QYRLTLJOLWSROV-UHFFFAOYSA-N 1 2 320.371 4.251 20 0 DIADLO Clc1cccc2c1OCCC[C@@H]2Nc1cc[nH+]c(C2CC2)n1 ZINC000302038635 336344857 /nfs/dbraw/zinc/34/48/57/336344857.db2.gz VRHOGOBZKIHBJV-AWEZNQCLSA-N 1 2 315.804 4.333 20 0 DIADLO Clc1ccccc1-c1csc(NCCCn2cc[nH+]c2)n1 ZINC000302099526 336348460 /nfs/dbraw/zinc/34/84/60/336348460.db2.gz UNGMJZZOSXRBIR-UHFFFAOYSA-N 1 2 318.833 4.162 20 0 DIADLO COc1ccc2[nH+]c(NC[C@@H](C)c3nc(C)cs3)ccc2c1 ZINC000302125146 336349738 /nfs/dbraw/zinc/34/97/38/336349738.db2.gz HZWGSYGGVUQRIV-LLVKDONJSA-N 1 2 313.426 4.224 20 0 DIADLO C[N@H+](Cc1noc(C(C)(C)C)n1)C1CCC(C(C)(C)C)CC1 ZINC000514104445 336352113 /nfs/dbraw/zinc/35/21/13/336352113.db2.gz JUTPYFUEJNKKTG-UHFFFAOYSA-N 1 2 307.482 4.404 20 0 DIADLO C[N@@H+](Cc1noc(C(C)(C)C)n1)C1CCC(C(C)(C)C)CC1 ZINC000514104445 336352114 /nfs/dbraw/zinc/35/21/14/336352114.db2.gz JUTPYFUEJNKKTG-UHFFFAOYSA-N 1 2 307.482 4.404 20 0 DIADLO c1cc2c(s1)CCC[C@@H]2Nc1cc(N2CCCCC2)nc[nH+]1 ZINC000302190597 336353192 /nfs/dbraw/zinc/35/31/92/336353192.db2.gz BGOURGUBCNARQY-AWEZNQCLSA-N 1 2 314.458 4.018 20 0 DIADLO c1cc2c(s1)CCC[C@@H]2Nc1cc(N2CCCCC2)[nH+]cn1 ZINC000302190597 336353193 /nfs/dbraw/zinc/35/31/93/336353193.db2.gz BGOURGUBCNARQY-AWEZNQCLSA-N 1 2 314.458 4.018 20 0 DIADLO COc1ccc2[nH+]c(NCCC[C@@H]3CCCCO3)ccc2c1 ZINC000302217883 336354489 /nfs/dbraw/zinc/35/44/89/336354489.db2.gz KMAPZYDBRKRULT-HNNXBMFYSA-N 1 2 300.402 4.005 20 0 DIADLO CCSc1cc(CNc2cc(C(F)(F)F)cc[nH+]2)ccn1 ZINC000302420796 336358506 /nfs/dbraw/zinc/35/85/06/336358506.db2.gz MZIAHJVMWPXPFC-UHFFFAOYSA-N 1 2 313.348 4.220 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCc1ccc(C(C)(C)O)cc1 ZINC000302458796 336359153 /nfs/dbraw/zinc/35/91/53/336359153.db2.gz UVFHSWIVQRAOMV-UHFFFAOYSA-N 1 2 306.409 4.383 20 0 DIADLO COc1cc(F)cc(CNc2cc[nH+]c3c(OC)cccc23)c1 ZINC000302516146 336360645 /nfs/dbraw/zinc/36/06/45/336360645.db2.gz HJMBTXGHARAQBB-UHFFFAOYSA-N 1 2 312.344 4.003 20 0 DIADLO Fc1ccccc1[C@H]1C[N@H+](Cc2cc3ccccc3o2)CCO1 ZINC000514106179 336360894 /nfs/dbraw/zinc/36/08/94/336360894.db2.gz WSDSLXHMUCFTHH-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO Fc1ccccc1[C@H]1C[N@@H+](Cc2cc3ccccc3o2)CCO1 ZINC000514106179 336360895 /nfs/dbraw/zinc/36/08/95/336360895.db2.gz WSDSLXHMUCFTHH-LJQANCHMSA-N 1 2 311.356 4.145 20 0 DIADLO COc1cccc2c(NC3CCC(OC(C)C)CC3)cc[nH+]c12 ZINC000302539039 336361202 /nfs/dbraw/zinc/36/12/02/336361202.db2.gz NGISWSFKKMMUGC-UHFFFAOYSA-N 1 2 314.429 4.392 20 0 DIADLO Fc1cccc2c(NCCCc3[nH]c4ccccc4[nH+]3)ccnc12 ZINC000302636685 336363194 /nfs/dbraw/zinc/36/31/94/336363194.db2.gz DBYXSAKAAQAETE-UHFFFAOYSA-N 1 2 320.371 4.295 20 0 DIADLO CCc1nc(CNc2c(C)c[nH+]c3c(OC)cccc23)cs1 ZINC000302677986 336364566 /nfs/dbraw/zinc/36/45/66/336364566.db2.gz VJPNMLACIFDAFQ-UHFFFAOYSA-N 1 2 313.426 4.183 20 0 DIADLO COc1ccc2[nH+]c(NCc3ccnc(OC(C)C)c3)ccc2c1 ZINC000302712745 336366058 /nfs/dbraw/zinc/36/60/58/336366058.db2.gz ZUNYZLIGGZCLGD-UHFFFAOYSA-N 1 2 323.396 4.038 20 0 DIADLO CC(C)c1nc(N[C@@H](CO)c2ccccc2)cc(C(C)(C)C)[nH+]1 ZINC000302783089 336368890 /nfs/dbraw/zinc/36/88/90/336368890.db2.gz KTVHXYJIKLQRNY-HNNXBMFYSA-N 1 2 313.445 4.043 20 0 DIADLO COC[C@@H](Nc1cc(C)[nH+]c(C(C)C)n1)c1ccc(Cl)cc1 ZINC000302842213 336371714 /nfs/dbraw/zinc/37/17/14/336371714.db2.gz DMTLOEXAZXHKAV-OAHLLOKOSA-N 1 2 319.836 4.361 20 0 DIADLO CC(C)c1ccc([C@@H]2CCCN2c2nc[nH+]c(N)c2Cl)cc1 ZINC000302850632 336371872 /nfs/dbraw/zinc/37/18/72/336371872.db2.gz PQTSWCXXHKUUIG-AWEZNQCLSA-N 1 2 316.836 4.177 20 0 DIADLO C[C@H](Nc1nc[nH+]c(N)c1Cl)c1cc2ccccc2s1 ZINC000302879790 336372924 /nfs/dbraw/zinc/37/29/24/336372924.db2.gz HCGDXCBNUWYCKS-QMMMGPOBSA-N 1 2 304.806 4.100 20 0 DIADLO C[C@H](Nc1[nH+]cnc(N)c1Cl)c1cc2ccccc2s1 ZINC000302879790 336372925 /nfs/dbraw/zinc/37/29/25/336372925.db2.gz HCGDXCBNUWYCKS-QMMMGPOBSA-N 1 2 304.806 4.100 20 0 DIADLO FC(F)(F)CCCC[N@@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000152442837 336384487 /nfs/dbraw/zinc/38/44/87/336384487.db2.gz KJDUMCYKPPEPJY-CQSZACIVSA-N 1 2 321.770 4.446 20 0 DIADLO FC(F)(F)CCCC[N@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000152442837 336384488 /nfs/dbraw/zinc/38/44/88/336384488.db2.gz KJDUMCYKPPEPJY-CQSZACIVSA-N 1 2 321.770 4.446 20 0 DIADLO Cc1cc(N[C@H]2CCc3ccc(F)cc32)nc(-c2cccnc2)[nH+]1 ZINC000106477403 336390147 /nfs/dbraw/zinc/39/01/47/336390147.db2.gz CFMUMLXKEQXZOI-KRWDZBQOSA-N 1 2 320.371 4.086 20 0 DIADLO Cn1ccnc1[C@H]([NH2+]Cc1csc(Cl)c1Cl)C1CC1 ZINC000353049331 336391621 /nfs/dbraw/zinc/39/16/21/336391621.db2.gz RWTGVINNDXUCRD-LLVKDONJSA-N 1 2 316.257 4.029 20 0 DIADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1cccc(OC(F)F)c1 ZINC000110209722 336395908 /nfs/dbraw/zinc/39/59/08/336395908.db2.gz RSXGAGWZQNUEKP-JTQLQIEISA-N 1 2 305.328 4.129 20 0 DIADLO C[C@@H]1CCCN(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000112211782 336399405 /nfs/dbraw/zinc/39/94/05/336399405.db2.gz QUOFAORYYXGYIA-CQSZACIVSA-N 1 2 311.385 4.138 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c1C ZINC000115602715 336402024 /nfs/dbraw/zinc/40/20/24/336402024.db2.gz AJEJJGGYKCFJKN-ZIAGYGMSSA-N 1 2 301.434 4.396 20 0 DIADLO c1c2ccccc2oc1[C@@H]([NH2+]Cc1cccnc1)c1cccnc1 ZINC000353338847 336412558 /nfs/dbraw/zinc/41/25/58/336412558.db2.gz VEILCIOVKYMMFL-FQEVSTJZSA-N 1 2 315.376 4.102 20 0 DIADLO CC[C@H](NC(=O)c1ccc2[nH+]c(C)n(C)c2c1)c1ccc(C)cc1 ZINC000353514302 336421885 /nfs/dbraw/zinc/42/18/85/336421885.db2.gz JSORKHZLNGXNSJ-KRWDZBQOSA-N 1 2 321.424 4.071 20 0 DIADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ncc(-c2cccs2)o1 ZINC000353569829 336425904 /nfs/dbraw/zinc/42/59/04/336425904.db2.gz GMSYXEMRPOAHPN-UHFFFAOYSA-N 1 2 317.414 4.033 20 0 DIADLO O=C(c1ccc(C2=CCCC2)cc1)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000353774018 336439942 /nfs/dbraw/zinc/43/99/42/336439942.db2.gz PHLMAUACNGACTK-GOSISDBHSA-N 1 2 321.424 4.344 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccc2ccccc2n1 ZINC000353934934 336450048 /nfs/dbraw/zinc/45/00/48/336450048.db2.gz RWGUPACSCYNOPL-VXGBXAGGSA-N 1 2 313.351 4.320 20 0 DIADLO Cc1[nH+]c2ccc(C(=O)N(C)[C@@H](C)c3ccc(C)cc3)cc2n1C ZINC000354318621 336466640 /nfs/dbraw/zinc/46/66/40/336466640.db2.gz MJVQPCVIIKMQCY-AWEZNQCLSA-N 1 2 321.424 4.023 20 0 DIADLO COc1cc(F)cc(CNc2[nH+]ccc3ccc(F)cc32)c1 ZINC000354884080 336486417 /nfs/dbraw/zinc/48/64/17/336486417.db2.gz LOXCTYVBZPYVTI-UHFFFAOYSA-N 1 2 300.308 4.134 20 0 DIADLO Cc1[nH]c(C(=O)N[C@H](C)c2ccc(-c3ccc(F)cc3)cc2)c[nH+]1 ZINC000354971501 336489532 /nfs/dbraw/zinc/48/95/32/336489532.db2.gz ANNSNLHYFSRFIP-GFCCVEGCSA-N 1 2 323.371 4.015 20 0 DIADLO CSc1ccc(N(C)Cc2cc(-n3cc[nH+]c3)cs2)cc1 ZINC000355374320 336506360 /nfs/dbraw/zinc/50/63/60/336506360.db2.gz YMKQQLQDYMYXGK-UHFFFAOYSA-N 1 2 315.467 4.292 20 0 DIADLO Cc1ccc(-n2cc[nH+]c2)c(C(=O)Nc2ccccc2Cl)c1 ZINC000114111668 336517739 /nfs/dbraw/zinc/51/77/39/336517739.db2.gz ZXFFOJZAHUIDIS-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO CCCOc1ccc([C@H](C)[NH2+][C@H](C)c2ncc(C)o2)cc1OC ZINC000356265964 336543353 /nfs/dbraw/zinc/54/33/53/336543353.db2.gz BLDZDQUXQPOVEQ-UONOGXRCSA-N 1 2 318.417 4.192 20 0 DIADLO C[C@H](c1cccs1)c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000356651103 336557193 /nfs/dbraw/zinc/55/71/93/336557193.db2.gz SJNOXIKBMMFHOI-GFCCVEGCSA-N 1 2 322.393 4.136 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1cccnc1)c1ccc(F)cn1 ZINC000356682449 336558109 /nfs/dbraw/zinc/55/81/09/336558109.db2.gz SERFTGIEUMUUSH-AUUYWEPGSA-N 1 2 307.372 4.056 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2sc3ccccc3c2Cl)n1 ZINC000356862686 336563748 /nfs/dbraw/zinc/56/37/48/336563748.db2.gz JNHWVCNXOCKISW-QMMMGPOBSA-N 1 2 307.806 4.097 20 0 DIADLO Cc1nc(C)c(CSCc2ccc(-n3cc[nH+]c3)cc2)s1 ZINC000357047001 336571808 /nfs/dbraw/zinc/57/18/08/336571808.db2.gz YKIIQURLBKDVFJ-UHFFFAOYSA-N 1 2 315.467 4.379 20 0 DIADLO COCc1cc(N2Cc3ccccc3C2)c2cc(F)ccc2[nH+]1 ZINC000357233966 336577745 /nfs/dbraw/zinc/57/77/45/336577745.db2.gz FNAJYMQZTBTPEP-UHFFFAOYSA-N 1 2 308.356 4.041 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2cc(Cl)ccc2s1)c1nccs1 ZINC000357780118 336597970 /nfs/dbraw/zinc/59/79/70/336597970.db2.gz UIDGCATUZAQVLM-MRVPVSSYSA-N 1 2 309.847 4.257 20 0 DIADLO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2nnc(C(C)C)s2)cc1 ZINC000358289611 336621704 /nfs/dbraw/zinc/62/17/04/336621704.db2.gz PKDWEPWVBSNZAY-CYBMUJFWSA-N 1 2 319.474 4.300 20 0 DIADLO c1sc(C[NH2+]Cc2ccccn2)nc1-c1cc2ccccc2o1 ZINC000358984218 336651195 /nfs/dbraw/zinc/65/11/95/336651195.db2.gz IJMQKSSWPNCDRU-UHFFFAOYSA-N 1 2 321.405 4.241 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(CC)no2)cc1 ZINC000114751794 336671239 /nfs/dbraw/zinc/67/12/39/336671239.db2.gz FFHKGVHMILTNNA-NEPJUHHUSA-N 1 2 305.447 4.156 20 0 DIADLO Cc1cc2cccnc2c(NCc2ccc(N(C)C(C)C)[nH+]c2)c1 ZINC000359680251 336683169 /nfs/dbraw/zinc/68/31/69/336683169.db2.gz ZIYQTYWAHQEJJG-UHFFFAOYSA-N 1 2 320.440 4.395 20 0 DIADLO CCOCc1ccc(NCc2ccc(N(C)C(C)C)[nH+]c2)cc1 ZINC000359737535 336685727 /nfs/dbraw/zinc/68/57/27/336685727.db2.gz DUNRUONYHBDCLN-UHFFFAOYSA-N 1 2 313.445 4.075 20 0 DIADLO CC[C@@H](C)n1ncc(NCc2cn3cc(Cl)ccc3[nH+]2)c1C ZINC000359822096 336688796 /nfs/dbraw/zinc/68/87/96/336688796.db2.gz ZIGDUEMUTODQSX-LLVKDONJSA-N 1 2 317.824 4.076 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCCCC[S@](=O)CCC(C)C ZINC000359917130 336693019 /nfs/dbraw/zinc/69/30/19/336693019.db2.gz LNPBDOFLFJODDT-QFIPXVFZSA-N 1 2 320.502 4.310 20 0 DIADLO C/C=C\c1ccc(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000360320857 336708155 /nfs/dbraw/zinc/70/81/55/336708155.db2.gz WTHXULPHFDDAMB-IHWYPQMZSA-N 1 2 303.365 4.158 20 0 DIADLO O=C(NCCCCF)c1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000360504116 336713325 /nfs/dbraw/zinc/71/33/25/336713325.db2.gz BWULTXWSWWDWKJ-UHFFFAOYSA-N 1 2 322.767 4.007 20 0 DIADLO CC(C)[C@@]1(C)C[C@@H]1C(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000360699897 336719240 /nfs/dbraw/zinc/71/92/40/336719240.db2.gz ADVWQRYQKSQUIB-AUUYWEPGSA-N 1 2 311.429 4.071 20 0 DIADLO Cc1cc(NCc2nnc(C(C)C)s2)c2cccc(F)c2[nH+]1 ZINC000360873121 336725201 /nfs/dbraw/zinc/72/52/01/336725201.db2.gz QIXYIMJPQRFLBP-UHFFFAOYSA-N 1 2 316.405 4.269 20 0 DIADLO CCN(CC)c1ccc(N[C@H](c2cccnc2)C2CCC2)c[nH+]1 ZINC000360884669 336725734 /nfs/dbraw/zinc/72/57/34/336725734.db2.gz PZSMKHAWSXEBFT-IBGZPJMESA-N 1 2 310.445 4.276 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+][C@H]1CCOc2c(F)ccc(F)c21 ZINC000361175040 336742264 /nfs/dbraw/zinc/74/22/64/336742264.db2.gz CBLKAOUHUAYSJC-NHYWBVRUSA-N 1 2 318.367 4.097 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@H]2CCOc3c(F)ccc(F)c32)oc1C ZINC000361186785 336743341 /nfs/dbraw/zinc/74/33/41/336743341.db2.gz MSTACOWUSNSFMT-YGRLFVJLSA-N 1 2 307.340 4.349 20 0 DIADLO Fc1ccc(F)c2c1OCC[C@@H]2[NH2+]Cc1ccsc1Cl ZINC000361252146 336747009 /nfs/dbraw/zinc/74/70/09/336747009.db2.gz PSSVOLFCBKZEJQ-NSHDSACASA-N 1 2 315.772 4.293 20 0 DIADLO CSc1ccc(Cl)c(C(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000362394574 336795480 /nfs/dbraw/zinc/79/54/80/336795480.db2.gz FFUPKYNEKICYSD-UHFFFAOYSA-N 1 2 306.818 4.326 20 0 DIADLO Cc1nc(-c2cccc(C(=O)Nc3c(C)cc[nH+]c3C)c2)cs1 ZINC000362395482 336795485 /nfs/dbraw/zinc/79/54/85/336795485.db2.gz JHEIUIKFWIEURM-UHFFFAOYSA-N 1 2 323.421 4.383 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)CSc1ccccc1Cl ZINC000362397926 336795630 /nfs/dbraw/zinc/79/56/30/336795630.db2.gz UBSPMOBPQHWPCP-UHFFFAOYSA-N 1 2 306.818 4.083 20 0 DIADLO Cc1nc(N2CCC(c3c(F)cccc3F)CC2)c(C)c(C)[nH+]1 ZINC000362697420 336809342 /nfs/dbraw/zinc/80/93/42/336809342.db2.gz KMAAMIMNXAYWEB-UHFFFAOYSA-N 1 2 317.383 4.064 20 0 DIADLO Cc1ccc(NC(=O)c2cc3cc(Cl)sc3[nH]2)c(C)[nH+]1 ZINC000362929068 336815122 /nfs/dbraw/zinc/81/51/22/336815122.db2.gz ZKNIHAFSIIKEMZ-UHFFFAOYSA-N 1 2 305.790 4.147 20 0 DIADLO CCOCc1csc([C@H](C)n2c[nH+]c3cc(C)c(C)cc32)n1 ZINC000362928176 336815208 /nfs/dbraw/zinc/81/52/08/336815208.db2.gz PLVCYTSNQDWBLL-ZDUSSCGKSA-N 1 2 315.442 4.255 20 0 DIADLO Cc1ccnc([C@@H](C)[NH2+][C@@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000367533674 336824503 /nfs/dbraw/zinc/82/45/03/336824503.db2.gz NKSMZIWSUWQHAM-QRWLVFNGSA-N 1 2 321.399 4.364 20 0 DIADLO C[C@H]([NH2+]Cc1noc2c1CCCC2)c1ccccc1C(F)(F)F ZINC000367641160 336827191 /nfs/dbraw/zinc/82/71/91/336827191.db2.gz BZFSYSBMDJTPNO-NSHDSACASA-N 1 2 324.346 4.423 20 0 DIADLO Cc1nc([C@@H](C)[NH+]2CCC(F)(c3cccc(Cl)c3)CC2)no1 ZINC000367658059 336827583 /nfs/dbraw/zinc/82/75/83/336827583.db2.gz MNHWCZQWKURBRV-LLVKDONJSA-N 1 2 323.799 4.053 20 0 DIADLO Cc1cc(Cl)ccc1NC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117562415 336856370 /nfs/dbraw/zinc/85/63/70/336856370.db2.gz MRNQVYFFQHEGGI-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO CCCc1cc(C(=O)N2CCCC[C@H]2c2[nH]cc[nH+]2)sc1C ZINC000120284648 336905370 /nfs/dbraw/zinc/90/53/70/336905370.db2.gz MOSXCFTUTUMPQJ-AWEZNQCLSA-N 1 2 317.458 4.100 20 0 DIADLO Cc1cc(C)c(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)[nH]1 ZINC000120731084 336920365 /nfs/dbraw/zinc/92/03/65/336920365.db2.gz OGFAMFGMROEVDY-UHFFFAOYSA-N 1 2 307.353 4.071 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N(C)[C@H](C)c1cc2ccccc2o1 ZINC000121114635 336931391 /nfs/dbraw/zinc/93/13/91/336931391.db2.gz KYKLZOOLPHBODY-CYBMUJFWSA-N 1 2 309.369 4.361 20 0 DIADLO Fc1cc(NCc2cccc3[nH]ccc32)ccc1-n1cc[nH+]c1 ZINC000121383668 336946998 /nfs/dbraw/zinc/94/69/98/336946998.db2.gz NYFNCZIXUKNBBD-UHFFFAOYSA-N 1 2 306.344 4.105 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1coc2ccccc12 ZINC000373620360 336966788 /nfs/dbraw/zinc/96/67/88/336966788.db2.gz ZGEPLSYMAKILPL-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1C[C@@H]2CCCC[C@]21c1ccccc1 ZINC000122143502 336995996 /nfs/dbraw/zinc/99/59/96/336995996.db2.gz YEFAYTAIJLSOFC-PXNSSMCTSA-N 1 2 321.424 4.323 20 0 DIADLO C[C@@H](C(=O)N1CCC[C@@H]1c1[nH]cc[nH+]1)c1ccc2ccccc2c1 ZINC000375065426 337002321 /nfs/dbraw/zinc/00/23/21/337002321.db2.gz MJTWLKXEZMSOEU-RDTXWAMCSA-N 1 2 319.408 4.030 20 0 DIADLO C[C@H](C(=O)N1CCC[C@H]1c1[nH]cc[nH+]1)c1ccc2ccccc2c1 ZINC000375065425 337002323 /nfs/dbraw/zinc/00/23/23/337002323.db2.gz MJTWLKXEZMSOEU-KSSFIOAISA-N 1 2 319.408 4.030 20 0 DIADLO CC(C)c1cnc(C[NH+]2CCC(F)(c3cccnc3)CC2)s1 ZINC000375302715 337007677 /nfs/dbraw/zinc/00/76/77/337007677.db2.gz LLTYBYWDCREGOC-UHFFFAOYSA-N 1 2 319.449 4.122 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1ccoc1C(C)C ZINC000375645397 337015529 /nfs/dbraw/zinc/01/55/29/337015529.db2.gz RYJNKUYAPWSATH-UHFFFAOYSA-N 1 2 309.369 4.354 20 0 DIADLO C[C@@H]1C[C@@H]1[C@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc(Cl)cc1 ZINC000375782964 337019457 /nfs/dbraw/zinc/01/94/57/337019457.db2.gz PIKNWWXNVWQXBK-FRYJOBKFSA-N 1 2 315.848 4.427 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](c1ccco1)c1ccccc1 ZINC000376596124 337037527 /nfs/dbraw/zinc/03/75/27/337037527.db2.gz BIIMKBFJSMWPAX-SFHVURJKSA-N 1 2 321.380 4.203 20 0 DIADLO Cc1ccccc1[C@H]1CCCN1C(=O)Nc1c(C)cc[nH+]c1C ZINC000376598909 337037705 /nfs/dbraw/zinc/03/77/05/337037705.db2.gz VOPNJYLZODIRGO-QGZVFWFLSA-N 1 2 309.413 4.376 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1Cc2ccccc2C2(CCC2)C1 ZINC000376617782 337038216 /nfs/dbraw/zinc/03/82/16/337038216.db2.gz IXJOXKVBYFDGJH-UHFFFAOYSA-N 1 2 321.424 4.168 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC[C@@H](c2ccccc2)C[C@H]1C ZINC000376638850 337038686 /nfs/dbraw/zinc/03/86/86/337038686.db2.gz CUVNBQYPVJVJFZ-CRAIPNDOSA-N 1 2 323.440 4.498 20 0 DIADLO CCn1cc[nH+]c1[C@@H]1CCCCN1C(=O)C1C[C@H](C)C[C@@H](C)C1 ZINC000377212880 337048835 /nfs/dbraw/zinc/04/88/35/337048835.db2.gz DJUPONXCEPFMPV-INMHGKMJSA-N 1 2 317.477 4.029 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1ncc(C(C)C)s1 ZINC000377222444 337048905 /nfs/dbraw/zinc/04/89/05/337048905.db2.gz HHRAIURNWJKWSL-CQSZACIVSA-N 1 2 318.490 4.210 20 0 DIADLO Cc1cc([C@H](C)Nc2cccc(-c3cn4c([nH+]3)CCCC4)c2)no1 ZINC000377816726 337061857 /nfs/dbraw/zinc/06/18/57/337061857.db2.gz KXKHHGXHTGGEDR-AWEZNQCLSA-N 1 2 322.412 4.356 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000378082628 337066104 /nfs/dbraw/zinc/06/61/04/337066104.db2.gz IFZWEJCOYDBWSS-HNNXBMFYSA-N 1 2 305.466 4.112 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000378082628 337066105 /nfs/dbraw/zinc/06/61/05/337066105.db2.gz IFZWEJCOYDBWSS-HNNXBMFYSA-N 1 2 305.466 4.112 20 0 DIADLO CCCCCC[C@@H](C)CC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000170781929 337083103 /nfs/dbraw/zinc/08/31/03/337083103.db2.gz UXJYBUJSHPPCMI-HZPDHXFCSA-N 1 2 305.466 4.460 20 0 DIADLO Cc1ccc(C(=O)N(C)C2CCCC2)cc1Oc1cc[nH+]cc1 ZINC000172053957 337089407 /nfs/dbraw/zinc/08/94/07/337089407.db2.gz XDBQPOIUNPACLP-UHFFFAOYSA-N 1 2 310.397 4.197 20 0 DIADLO C[C@H](Nc1nc2cc(F)ccc2o1)c1cccc(-n2cc[nH+]c2)c1 ZINC000172788878 337130999 /nfs/dbraw/zinc/13/09/99/337130999.db2.gz LAPJJJOVFPTICH-LBPRGKRZSA-N 1 2 322.343 4.326 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2nc(C(F)(F)F)cs2)c1 ZINC000174960367 337143766 /nfs/dbraw/zinc/14/37/66/337143766.db2.gz VOWLIDVESCJFDM-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2nc(C(F)(F)F)cs2)c1 ZINC000174960367 337143767 /nfs/dbraw/zinc/14/37/67/337143767.db2.gz VOWLIDVESCJFDM-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc(C(F)(F)F)cs2)cc1 ZINC000174965933 337143856 /nfs/dbraw/zinc/14/38/56/337143856.db2.gz FZCPCOFOTRDNIZ-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc(C(F)(F)F)cs2)cc1 ZINC000174965933 337143857 /nfs/dbraw/zinc/14/38/57/337143857.db2.gz FZCPCOFOTRDNIZ-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000175305213 337145245 /nfs/dbraw/zinc/14/52/45/337145245.db2.gz GKTRJLLDJKODRU-AWEZNQCLSA-N 1 2 318.808 4.131 20 0 DIADLO c1cn(-c2ccc(CSc3ccnc4ccccc43)cn2)c[nH+]1 ZINC000175260394 337146469 /nfs/dbraw/zinc/14/64/69/337146469.db2.gz AGFFRJFDTJILTO-UHFFFAOYSA-N 1 2 318.405 4.108 20 0 DIADLO C[C@@H](C(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1)c1cc2ccccc2o1 ZINC000176218954 337149797 /nfs/dbraw/zinc/14/97/97/337149797.db2.gz CYZVQLRIORGBIG-UKRRQHHQSA-N 1 2 323.396 4.013 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+]2C[C@H](C)[C@@H]2c2ccccc2)cs1 ZINC000177829059 337160646 /nfs/dbraw/zinc/16/06/46/337160646.db2.gz BNBMLLZHJURICO-JJRVBVJISA-N 1 2 316.470 4.434 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)cs1 ZINC000177829059 337160647 /nfs/dbraw/zinc/16/06/47/337160647.db2.gz BNBMLLZHJURICO-JJRVBVJISA-N 1 2 316.470 4.434 20 0 DIADLO CSc1ccc(CCCC(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000514673808 337163288 /nfs/dbraw/zinc/16/32/88/337163288.db2.gz LQKUKBUDQDZVJJ-UHFFFAOYSA-N 1 2 314.454 4.382 20 0 DIADLO Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000178666889 337166024 /nfs/dbraw/zinc/16/60/24/337166024.db2.gz PRZBDKADLFJCSA-KBPBESRZSA-N 1 2 300.427 4.119 20 0 DIADLO Cc1cnc(C[N@H+](C)Cc2ccc(Cl)c(Cl)c2)s1 ZINC000180424346 337174303 /nfs/dbraw/zinc/17/43/03/337174303.db2.gz ZSBGQXJICUHKBZ-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000179575620 337170363 /nfs/dbraw/zinc/17/03/63/337170363.db2.gz DSYGCBWKZOREEN-LJQANCHMSA-N 1 2 324.424 4.020 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000179575620 337170364 /nfs/dbraw/zinc/17/03/64/337170364.db2.gz DSYGCBWKZOREEN-LJQANCHMSA-N 1 2 324.424 4.020 20 0 DIADLO Cc1cnc(C[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)s1 ZINC000180424346 337174302 /nfs/dbraw/zinc/17/43/02/337174302.db2.gz ZSBGQXJICUHKBZ-UHFFFAOYSA-N 1 2 301.242 4.390 20 0 DIADLO Cc1cnc(C[N@H+]2C[C@H](c3cc(C)ccc3C)OC[C@H]2C)s1 ZINC000180514302 337176034 /nfs/dbraw/zinc/17/60/34/337176034.db2.gz GGWHBVASLPPOEA-RHSMWYFYSA-N 1 2 316.470 4.030 20 0 DIADLO Cc1cnc(C[N@@H+]2C[C@H](c3cc(C)ccc3C)OC[C@H]2C)s1 ZINC000180514302 337176035 /nfs/dbraw/zinc/17/60/35/337176035.db2.gz GGWHBVASLPPOEA-RHSMWYFYSA-N 1 2 316.470 4.030 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)cs1 ZINC000180914934 337178529 /nfs/dbraw/zinc/17/85/29/337178529.db2.gz ZJRJGTRIXBXZML-UHFFFAOYSA-N 1 2 314.410 4.381 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1cn(-c2ccccc2)nn1)c1ccccc1F ZINC000180945905 337178831 /nfs/dbraw/zinc/17/88/31/337178831.db2.gz PAVFYXXQILFLJY-RDTXWAMCSA-N 1 2 324.403 4.208 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)sc1C ZINC000180987835 337179126 /nfs/dbraw/zinc/17/91/26/337179126.db2.gz PGUBDGHETJGBFZ-UHFFFAOYSA-N 1 2 314.410 4.435 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[NH2+][C@H](C)c3cccnc3)o2)cc1C ZINC000181652859 337183551 /nfs/dbraw/zinc/18/35/51/337183551.db2.gz LZDPNPYARVVFKG-CABCVRRESA-N 1 2 322.412 4.160 20 0 DIADLO CCc1cc(NC(=O)N2CCCC[C@@H]2c2[nH]cc[nH+]2)ccc1C ZINC000181976648 337185633 /nfs/dbraw/zinc/18/56/33/337185633.db2.gz JCUANUBLWKYEEG-MRXNPFEDSA-N 1 2 312.417 4.040 20 0 DIADLO Cc1cccc(O)c1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000183016054 337190979 /nfs/dbraw/zinc/19/09/79/337190979.db2.gz AWJNBZTUWUPTGL-UHFFFAOYSA-N 1 2 320.348 4.140 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+](C)[C@H](C)c2ccco2)s1 ZINC000183574459 337192256 /nfs/dbraw/zinc/19/22/56/337192256.db2.gz ZKXMGBHHLNPOTM-MRVPVSSYSA-N 1 2 304.337 4.256 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+](C)[C@H](C)c2ccco2)s1 ZINC000183574459 337192257 /nfs/dbraw/zinc/19/22/57/337192257.db2.gz ZKXMGBHHLNPOTM-MRVPVSSYSA-N 1 2 304.337 4.256 20 0 DIADLO Cc1cncc([C@@H](C)[NH2+][C@@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000184426014 337197154 /nfs/dbraw/zinc/19/71/54/337197154.db2.gz GLSAAWROSIUMHL-QRWLVFNGSA-N 1 2 321.399 4.364 20 0 DIADLO Cc1ccnc(-c2ccc(NCc3ccc(C)[nH+]c3C)cc2)n1 ZINC000184455409 337197407 /nfs/dbraw/zinc/19/74/07/337197407.db2.gz QXTVDOYBDCRIKF-UHFFFAOYSA-N 1 2 304.397 4.076 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1cnn(C(C)C)c1 ZINC000184252049 337197583 /nfs/dbraw/zinc/19/75/83/337197583.db2.gz VMPMGYDPUUVAIO-UHFFFAOYSA-N 1 2 317.824 4.099 20 0 DIADLO Cc1ccc(CNc2ccc(F)cc2OCC(F)F)c(C)[nH+]1 ZINC000184501991 337199251 /nfs/dbraw/zinc/19/92/51/337199251.db2.gz YPKYOCRLQXJUJS-UHFFFAOYSA-N 1 2 310.319 4.094 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(F)c1F)c1ncc(-c2ccccc2)o1 ZINC000184891753 337200628 /nfs/dbraw/zinc/20/06/28/337200628.db2.gz NQYRCVKCTSGTQQ-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000185230971 337203555 /nfs/dbraw/zinc/20/35/55/337203555.db2.gz UTTAVKSFTMIKAU-GTNSWQLSSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(F)c(F)cc2F)C1 ZINC000185230971 337203556 /nfs/dbraw/zinc/20/35/56/337203556.db2.gz UTTAVKSFTMIKAU-GTNSWQLSSA-N 1 2 306.331 4.082 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc3c(c2)CCCCC3=O)c(C)[nH+]1 ZINC000582938318 337219717 /nfs/dbraw/zinc/21/97/17/337219717.db2.gz ZNVDQYFLYVQXCM-UHFFFAOYSA-N 1 2 322.408 4.168 20 0 DIADLO CCOc1cccc(Cl)c1C[N@@H+]1CCC[C@H]1c1cc(C)no1 ZINC000583092276 337239507 /nfs/dbraw/zinc/23/95/07/337239507.db2.gz KPMVRKSMOCQGLM-HNNXBMFYSA-N 1 2 320.820 4.372 20 0 DIADLO CCOc1cccc(Cl)c1C[N@H+]1CCC[C@H]1c1cc(C)no1 ZINC000583092276 337239508 /nfs/dbraw/zinc/23/95/08/337239508.db2.gz KPMVRKSMOCQGLM-HNNXBMFYSA-N 1 2 320.820 4.372 20 0 DIADLO CC(C)Oc1cccc([C@@H]([NH2+]CCc2ccncc2)C(F)F)c1 ZINC000583093137 337239875 /nfs/dbraw/zinc/23/98/75/337239875.db2.gz FTWPIRDPBQBLTC-QGZVFWFLSA-N 1 2 320.383 4.007 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+](C)Cc2ccc(C(C)(C)C)cc2)o1 ZINC000532904201 337254991 /nfs/dbraw/zinc/25/49/91/337254991.db2.gz UZCKVMWSGPPYEN-CYBMUJFWSA-N 1 2 301.434 4.123 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+](C)Cc2ccc(C(C)(C)C)cc2)o1 ZINC000532904201 337254992 /nfs/dbraw/zinc/25/49/92/337254992.db2.gz UZCKVMWSGPPYEN-CYBMUJFWSA-N 1 2 301.434 4.123 20 0 DIADLO Cc1ccc(C[S@](=O)Cc2ccc(C(C)C)cc2)c(C)[nH+]1 ZINC000187072304 337261637 /nfs/dbraw/zinc/26/16/37/337261637.db2.gz NUXQFFYTNOGQME-OAQYLSRUSA-N 1 2 301.455 4.271 20 0 DIADLO Cc1ccc(C[S@](=O)[C@@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000187069712 337261645 /nfs/dbraw/zinc/26/16/45/337261645.db2.gz INRYRLQUDBBNTA-RBZFPXEDSA-N 1 2 307.846 4.362 20 0 DIADLO Cc1ccc(C[S@](=O)Cc2cccc3ccccc32)c(C)[nH+]1 ZINC000187070220 337261694 /nfs/dbraw/zinc/26/16/94/337261694.db2.gz JAMSBKCYJWLKAH-QFIPXVFZSA-N 1 2 309.434 4.301 20 0 DIADLO Cc1ccc(C[S@](=O)Cc2ccc(C(C)(C)C)cc2)c(C)[nH+]1 ZINC000187134451 337262858 /nfs/dbraw/zinc/26/28/58/337262858.db2.gz BDRHFYMBGDGJAL-JOCHJYFZSA-N 1 2 315.482 4.445 20 0 DIADLO Cc1ccc(C[S@](=O)CCCc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000187232694 337264377 /nfs/dbraw/zinc/26/43/77/337264377.db2.gz CTDSMPRLGFAPJC-OAQYLSRUSA-N 1 2 321.873 4.233 20 0 DIADLO CC[C@@H]([NH2+]Cc1nc2ccc(OC)cc2s1)c1nccs1 ZINC000187488199 337266255 /nfs/dbraw/zinc/26/62/55/337266255.db2.gz FYSLZXDCIDZYRS-LLVKDONJSA-N 1 2 319.455 4.002 20 0 DIADLO Cc1ccc(CNc2ccc(Br)cc2F)c(C)[nH+]1 ZINC000187707457 337269583 /nfs/dbraw/zinc/26/95/83/337269583.db2.gz IODOPKXVWYKXNZ-UHFFFAOYSA-N 1 2 309.182 4.212 20 0 DIADLO Cc1ccc(CNc2cccc(-c3ccnc(C)n3)c2)c(C)[nH+]1 ZINC000187715158 337269498 /nfs/dbraw/zinc/26/94/98/337269498.db2.gz WOEZVBGGPVQLLI-UHFFFAOYSA-N 1 2 304.397 4.076 20 0 DIADLO Cc1c(Cl)cc(NC(=O)C[C@@H](C)n2cc[nH+]c2)cc1Cl ZINC000583206610 337270930 /nfs/dbraw/zinc/27/09/30/337270930.db2.gz LACJSWPYTCXGDC-SECBINFHSA-N 1 2 312.200 4.088 20 0 DIADLO Cc1ncccc1C[N@H+]1C[C@@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000188752031 337275486 /nfs/dbraw/zinc/27/54/86/337275486.db2.gz UVFBVRMQGGLOEY-UGSOOPFHSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1ncccc1C[N@@H+]1C[C@@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000188752031 337275487 /nfs/dbraw/zinc/27/54/87/337275487.db2.gz UVFBVRMQGGLOEY-UGSOOPFHSA-N 1 2 316.832 4.005 20 0 DIADLO Cc1c(Br)cccc1NCc1c[nH+]cn1C(C)C ZINC000232227416 337281299 /nfs/dbraw/zinc/28/12/99/337281299.db2.gz YMDAXXINHXQUND-UHFFFAOYSA-N 1 2 308.223 4.147 20 0 DIADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2ccccc2OC(F)F)cs1 ZINC000189786334 337282066 /nfs/dbraw/zinc/28/20/66/337282066.db2.gz JVLRRSDOSWXLAY-AWEZNQCLSA-N 1 2 324.396 4.390 20 0 DIADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2ccccc2OC(F)F)cs1 ZINC000189786334 337282067 /nfs/dbraw/zinc/28/20/67/337282067.db2.gz JVLRRSDOSWXLAY-AWEZNQCLSA-N 1 2 324.396 4.390 20 0 DIADLO C[C@@H]([NH2+]Cc1nccn1-c1ccccc1)c1ccc(F)cc1F ZINC000190679054 337289750 /nfs/dbraw/zinc/28/97/50/337289750.db2.gz YGCZVPRLEBFLDI-CYBMUJFWSA-N 1 2 313.351 4.001 20 0 DIADLO CCO[C@@H](C)c1nc(COc2ccc(C)[nH+]c2CC)cs1 ZINC000190768198 337290677 /nfs/dbraw/zinc/29/06/77/337290677.db2.gz DPGBZSHAQAGJPG-LBPRGKRZSA-N 1 2 306.431 4.085 20 0 DIADLO Cc1csc(CSCc2ccc(-n3cc[nH+]c3)cc2C)n1 ZINC000190972341 337291894 /nfs/dbraw/zinc/29/18/94/337291894.db2.gz MQSYBNUBTCWSGP-UHFFFAOYSA-N 1 2 315.467 4.379 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCc1nccs1 ZINC000190983273 337292118 /nfs/dbraw/zinc/29/21/18/337292118.db2.gz FYPRLVPAJFZOFK-UHFFFAOYSA-N 1 2 301.440 4.071 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(Br)o2)n1 ZINC000191078568 337293531 /nfs/dbraw/zinc/29/35/31/337293531.db2.gz XFYPOAPVMLLTEI-AWEZNQCLSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(Br)o2)n1 ZINC000191078568 337293532 /nfs/dbraw/zinc/29/35/32/337293532.db2.gz XFYPOAPVMLLTEI-AWEZNQCLSA-N 1 2 321.218 4.083 20 0 DIADLO CC(C)c1nc2n(n1)CCC[C@@H]2[NH2+][C@@H](C)c1csc(Cl)c1 ZINC000191337207 337296039 /nfs/dbraw/zinc/29/60/39/337296039.db2.gz KKLLJNJVMGVRIG-JQWIXIFHSA-N 1 2 324.881 4.302 20 0 DIADLO Cc1cccc([C@H](NC(=O)C[C@H](C)n2cc[nH+]c2)C(C)(C)C)c1 ZINC000583266851 337296506 /nfs/dbraw/zinc/29/65/06/337296506.db2.gz YMNDJFYYYYWNPV-YJBOKZPZSA-N 1 2 313.445 4.046 20 0 DIADLO CC(C)N(C)c1ccc(CNc2ccc3ncsc3c2)c[nH+]1 ZINC000191403372 337296787 /nfs/dbraw/zinc/29/67/87/337296787.db2.gz ZTTVRMXXENQAHS-UHFFFAOYSA-N 1 2 312.442 4.148 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccc(Br)o2)C1 ZINC000191493399 337297301 /nfs/dbraw/zinc/29/73/01/337297301.db2.gz IYEPPJUNKOFUME-SMDDNHRTSA-N 1 2 321.218 4.020 20 0 DIADLO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc(Br)o2)C1 ZINC000191493399 337297302 /nfs/dbraw/zinc/29/73/02/337297302.db2.gz IYEPPJUNKOFUME-SMDDNHRTSA-N 1 2 321.218 4.020 20 0 DIADLO Cc1ccc(-c2ncc(C[NH2+][C@@H](C)c3cscn3)s2)cc1 ZINC000583274932 337300209 /nfs/dbraw/zinc/30/02/09/337300209.db2.gz VAZCAUQOYGQYNW-LBPRGKRZSA-N 1 2 315.467 4.426 20 0 DIADLO CC(C)c1cccc2c1CC[N@@H+]([C@@H](C)c1nc(C3CC3)no1)C2 ZINC000191890764 337300883 /nfs/dbraw/zinc/30/08/83/337300883.db2.gz UUGBQGWKWWUPNE-ZDUSSCGKSA-N 1 2 311.429 4.190 20 0 DIADLO CC(C)c1cccc2c1CC[N@H+]([C@@H](C)c1nc(C3CC3)no1)C2 ZINC000191890764 337300884 /nfs/dbraw/zinc/30/08/84/337300884.db2.gz UUGBQGWKWWUPNE-ZDUSSCGKSA-N 1 2 311.429 4.190 20 0 DIADLO Cc1ocnc1C(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000191956535 337301357 /nfs/dbraw/zinc/30/13/57/337301357.db2.gz VHCFYBQAWYGDCU-UHFFFAOYSA-N 1 2 309.369 4.215 20 0 DIADLO Clc1ccccc1C[C@H]([NH2+]Cc1ncccn1)c1ccccc1 ZINC000192154973 337303408 /nfs/dbraw/zinc/30/34/08/337303408.db2.gz ISPICLXBENPXCY-SFHVURJKSA-N 1 2 323.827 4.204 20 0 DIADLO COc1ccc(Cl)c(C[NH2+][C@@H](c2ncc(C)s2)C2CC2)c1 ZINC000192178063 337303834 /nfs/dbraw/zinc/30/38/34/337303834.db2.gz AXGBVWAFPNHCBK-OAHLLOKOSA-N 1 2 322.861 4.354 20 0 DIADLO Cc1cc(C)c(NC(=O)CSc2ccc(F)c(F)c2)c(C)[nH+]1 ZINC000192680114 337306868 /nfs/dbraw/zinc/30/68/68/337306868.db2.gz RKTBYWCSQJLKCS-UHFFFAOYSA-N 1 2 322.380 4.016 20 0 DIADLO Cc1cc(NCc2noc3c2CCCC3)c2cccc(F)c2[nH+]1 ZINC000583714196 337312720 /nfs/dbraw/zinc/31/27/20/337312720.db2.gz GGHSHPZLHKQAQL-UHFFFAOYSA-N 1 2 311.360 4.161 20 0 DIADLO CC[C@H](CC(=O)N(Cc1[nH]cc[nH+]1)c1cccc(F)c1)C(C)C ZINC000446103435 338520742 /nfs/dbraw/zinc/52/07/42/338520742.db2.gz OCNZUIKUNPEFOI-CQSZACIVSA-N 1 2 317.408 4.154 20 0 DIADLO C[N@H+](Cc1nnc(-c2cccc(Cl)c2)o1)Cc1ccccc1 ZINC000030824791 337390595 /nfs/dbraw/zinc/39/05/95/337390595.db2.gz WIRXXGWRVNZUCX-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1nnc(-c2cccc(Cl)c2)o1)Cc1ccccc1 ZINC000030824791 337390596 /nfs/dbraw/zinc/39/05/96/337390596.db2.gz WIRXXGWRVNZUCX-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO CCc1cc(Br)ccc1NCc1c[nH+]cn1C(C)C ZINC000148105775 337419210 /nfs/dbraw/zinc/41/92/10/337419210.db2.gz HSBRWJDLZLRZES-UHFFFAOYSA-N 1 2 322.250 4.401 20 0 DIADLO Cc1cc(Cl)c2c(c1)[C@H]([NH2+]Cc1cscn1)CCCO2 ZINC000126621971 337417270 /nfs/dbraw/zinc/41/72/70/337417270.db2.gz JYMJQBOSNVBNFM-CQSZACIVSA-N 1 2 308.834 4.108 20 0 DIADLO c1nc(C[NH2+][C@H]2CCCOc3cc4c(cc32)CCCC4)cs1 ZINC000126621504 337417272 /nfs/dbraw/zinc/41/72/72/337417272.db2.gz KTLQVDRAGSOHCH-KRWDZBQOSA-N 1 2 314.454 4.025 20 0 DIADLO Cc1ccc([C@@H](C)N(C)C(=O)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000045248243 337419683 /nfs/dbraw/zinc/41/96/83/337419683.db2.gz LQFFNUNWDXAQFW-MRXNPFEDSA-N 1 2 319.408 4.014 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(Br)o1)c1cccc(F)c1F ZINC000188728237 337426394 /nfs/dbraw/zinc/42/63/94/337426394.db2.gz SSPLRBHMDGVBCQ-QMMMGPOBSA-N 1 2 316.145 4.171 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1ccncc1)c1ccco1 ZINC000130729649 337434109 /nfs/dbraw/zinc/43/41/09/337434109.db2.gz UFEGSDBKVAJUCM-AUUYWEPGSA-N 1 2 308.381 4.123 20 0 DIADLO COc1ccccc1[C@@H]([NH2+][C@@H](C)c1cccnc1)c1ccco1 ZINC000130787113 337434281 /nfs/dbraw/zinc/43/42/81/337434281.db2.gz HBUXKPLBQXTECJ-IFXJQAMLSA-N 1 2 308.381 4.123 20 0 DIADLO CCc1cccc(C)c1NC(=O)CCn1c(C)[nH+]c2ccccc21 ZINC000132523249 337442420 /nfs/dbraw/zinc/44/24/20/337442420.db2.gz IFBCWSYIZHLBHG-UHFFFAOYSA-N 1 2 321.424 4.244 20 0 DIADLO CCc1cc(OCc2nnc(C3CC3)s2)c2ccccc2[nH+]1 ZINC000418921128 337471651 /nfs/dbraw/zinc/47/16/51/337471651.db2.gz IMQOIRRIQJPRCK-UHFFFAOYSA-N 1 2 311.410 4.105 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@H](C)c2ccc(C3CC3)cc2)n1 ZINC000419354598 337480734 /nfs/dbraw/zinc/48/07/34/337480734.db2.gz MFLUOGUGERNXKJ-CQSZACIVSA-N 1 2 313.445 4.386 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CSCc1ccc(C(N)=O)cc1 ZINC000419361327 337480950 /nfs/dbraw/zinc/48/09/50/337480950.db2.gz OFMKCDRMMIUDNN-UHFFFAOYSA-N 1 2 314.454 4.046 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2cc(C(C)(C)C)on2)c1 ZINC000419455684 337485222 /nfs/dbraw/zinc/48/52/22/337485222.db2.gz PYVJUYBJHBVLNI-UHFFFAOYSA-N 1 2 306.431 4.118 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)o1 ZINC000245836705 337495087 /nfs/dbraw/zinc/49/50/87/337495087.db2.gz CSXABLUCWCKPEQ-ANGCBRKESA-N 1 2 305.809 4.079 20 0 DIADLO CCCC[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(OC)cc1 ZINC000420913227 337513413 /nfs/dbraw/zinc/51/34/13/337513413.db2.gz ARWMKNZBWBCGLE-MRXNPFEDSA-N 1 2 321.852 4.103 20 0 DIADLO Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]Cc1nn(C)c(C)c1Cl ZINC000421331318 337526843 /nfs/dbraw/zinc/52/68/43/337526843.db2.gz JMZZJZVZSUGUJQ-ZDUSSCGKSA-N 1 2 321.852 4.087 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H](C)c2cccc(C3CC3)c2)nn1C ZINC000421386090 337529898 /nfs/dbraw/zinc/52/98/98/337529898.db2.gz RFWRZSIIKIGZEB-NSHDSACASA-N 1 2 303.837 4.110 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000161816607 337597623 /nfs/dbraw/zinc/59/76/23/337597623.db2.gz YJKZVBCMCGNVBM-CQSZACIVSA-N 1 2 305.381 4.209 20 0 DIADLO C[C@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1cccc(F)c1 ZINC000261466622 337604687 /nfs/dbraw/zinc/60/46/87/337604687.db2.gz VTYAOHOKZWNPSQ-CQSZACIVSA-N 1 2 323.371 4.144 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2ccc(Cl)cc2OC)s1 ZINC000421832359 337651546 /nfs/dbraw/zinc/65/15/46/337651546.db2.gz MKOWCZLYFKLXDG-SNVBAGLBSA-N 1 2 310.850 4.218 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccncc1Cl ZINC000421836451 337652376 /nfs/dbraw/zinc/65/23/76/337652376.db2.gz QZAVJXFVAIQGAT-SNVBAGLBSA-N 1 2 309.866 4.340 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccncc1Cl ZINC000421846417 337654475 /nfs/dbraw/zinc/65/44/75/337654475.db2.gz SIUVCJKOFLAKNZ-OTYXRUKQSA-N 1 2 309.196 4.173 20 0 DIADLO Cc1nc(-c2cccc(C(=O)Nc3cc[nH+]cc3C)c2)cs1 ZINC000080111615 337660427 /nfs/dbraw/zinc/66/04/27/337660427.db2.gz WJXBGQKNGBMTBU-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ncc(Br)s1 ZINC000423211856 337704378 /nfs/dbraw/zinc/70/43/78/337704378.db2.gz HLFXQEFGVWNNII-QMMMGPOBSA-N 1 2 324.247 4.047 20 0 DIADLO CC(C)[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc2[nH]c(=O)oc2c1 ZINC000423218325 337705154 /nfs/dbraw/zinc/70/51/54/337705154.db2.gz ROWDADGSPWNNBG-GOSISDBHSA-N 1 2 323.396 4.311 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](CO)c2c(F)cccc2F)cc(C)c1F ZINC000536869702 337751875 /nfs/dbraw/zinc/75/18/75/337751875.db2.gz MCRGNVDZTGRMLY-BLLLJJGKSA-N 1 2 323.358 4.105 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc2cc[nH]c2c1)c1nc(C2CCCCC2)no1 ZINC000527669097 337754403 /nfs/dbraw/zinc/75/44/03/337754403.db2.gz ICZUPNCUJLISHG-CYBMUJFWSA-N 1 2 324.428 4.449 20 0 DIADLO CCc1nc(C[NH2+]C(C)(C)c2nc3ccccc3s2)cs1 ZINC000527744595 337760739 /nfs/dbraw/zinc/76/07/39/337760739.db2.gz MBAPXYPHRUNKHV-UHFFFAOYSA-N 1 2 317.483 4.340 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(C2CCCC2)s1)c1ncccc1F ZINC000527826660 337767169 /nfs/dbraw/zinc/76/71/69/337767169.db2.gz QNKHEPZHQUVBQX-NSHDSACASA-N 1 2 305.422 4.186 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2ncn(-c3ccccc3)n2)C(C)C)c1 ZINC000527903829 337769858 /nfs/dbraw/zinc/76/98/58/337769858.db2.gz TUSJCBJQIKRKGY-FQEVSTJZSA-N 1 2 320.440 4.063 20 0 DIADLO CC(C)n1cncc1C[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000424145998 337771863 /nfs/dbraw/zinc/77/18/63/337771863.db2.gz OPSFYJGOSBHZCX-LBPRGKRZSA-N 1 2 306.479 4.069 20 0 DIADLO CCOCc1nc([C@H](C)[NH2+][C@@H](C)c2cccc(C(C)C)c2)no1 ZINC000527900382 337772724 /nfs/dbraw/zinc/77/27/24/337772724.db2.gz LOXRAQXIWRXPFM-KBPBESRZSA-N 1 2 317.433 4.141 20 0 DIADLO COc1ccc[nH+]c1N[C@@H](C)c1ccc(-n2nc(C)cc2C)cc1 ZINC000527926190 337775816 /nfs/dbraw/zinc/77/58/16/337775816.db2.gz YQNYVUXMIVDRJL-HNNXBMFYSA-N 1 2 322.412 4.066 20 0 DIADLO c1ccc2c(c1)CO[C@]21CCCN(c2[nH+]ccc3ccccc32)C1 ZINC000527967730 337781134 /nfs/dbraw/zinc/78/11/34/337781134.db2.gz RFTBIYCORXNLHA-NRFANRHFSA-N 1 2 316.404 4.261 20 0 DIADLO Cc1[nH+]cccc1Cc1noc([C@H]2CC[C@H]2c2ccc(F)cc2)n1 ZINC000528214732 337795943 /nfs/dbraw/zinc/79/59/43/337795943.db2.gz WYHOODGTLUNVCM-IRXDYDNUSA-N 1 2 323.371 4.164 20 0 DIADLO FC(F)(F)c1nn(Cc2ccc(Cl)cc2)c2cc[nH+]cc21 ZINC000533050696 337808240 /nfs/dbraw/zinc/80/82/40/337808240.db2.gz IFMUYFOGILYWJL-UHFFFAOYSA-N 1 2 311.694 4.152 20 0 DIADLO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1ncc(C)s1 ZINC000424208776 337809700 /nfs/dbraw/zinc/80/97/00/337809700.db2.gz ZVTDVJWNVHLMDA-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO Cc1nc(C[NH+]2CCC(=Cc3cccc(F)c3)CC2)oc1C ZINC000533081085 337811004 /nfs/dbraw/zinc/81/10/04/337811004.db2.gz CDPCUNMBLOADJY-UHFFFAOYSA-N 1 2 300.377 4.110 20 0 DIADLO Cc1ccc(Cl)cc1C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000533120556 337827751 /nfs/dbraw/zinc/82/77/51/337827751.db2.gz ZTNWOUNUDVKQJK-UHFFFAOYSA-N 1 2 311.772 4.291 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)c1ccccc1CCc1ccccc1 ZINC000107288309 337828516 /nfs/dbraw/zinc/82/85/16/337828516.db2.gz AYJXAFNKXPZGGB-UHFFFAOYSA-N 1 2 316.404 4.428 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1csc(C)n1)c1ccccc1 ZINC000108421268 337836949 /nfs/dbraw/zinc/83/69/49/337836949.db2.gz WSGXMIMBNNKNDS-IBGZPJMESA-N 1 2 324.449 4.339 20 0 DIADLO CCCc1ccccc1NC(=O)c1cccc(-n2cc[nH+]c2)c1 ZINC000117603719 337848311 /nfs/dbraw/zinc/84/83/11/337848311.db2.gz XKQGHJXIETVUCC-UHFFFAOYSA-N 1 2 305.381 4.077 20 0 DIADLO Cc1ccc(NC(=O)[C@H](C)CSc2ccccc2)c(C)[nH+]1 ZINC000119087676 337854198 /nfs/dbraw/zinc/85/41/98/337854198.db2.gz MGLFOZCHZXRDHZ-GFCCVEGCSA-N 1 2 300.427 4.065 20 0 DIADLO Cc1ccc(NC(=O)C2(c3cccc(F)c3)CCCC2)c(C)[nH+]1 ZINC000119155270 337854725 /nfs/dbraw/zinc/85/47/25/337854725.db2.gz BETZDWQMJBDAME-UHFFFAOYSA-N 1 2 312.388 4.288 20 0 DIADLO Cc1ccc(NC(=O)c2ccc3ccc(Cl)cc3n2)c(C)[nH+]1 ZINC000119256031 337855667 /nfs/dbraw/zinc/85/56/67/337855667.db2.gz IGCRTBYMMQDZFB-UHFFFAOYSA-N 1 2 311.772 4.152 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)CCc2cccc(F)c2)c(C)[nH+]1 ZINC000119263822 337855777 /nfs/dbraw/zinc/85/57/77/337855777.db2.gz SKNJDNPJQVSPRQ-LBPRGKRZSA-N 1 2 300.377 4.045 20 0 DIADLO Cc1ccc(C)c([C@@H]2CCCN2C(=O)Nc2cc[nH+]c(C)c2)c1 ZINC000119317234 337857579 /nfs/dbraw/zinc/85/75/79/337857579.db2.gz DQIPNBWSNXIHII-SFHVURJKSA-N 1 2 309.413 4.376 20 0 DIADLO CC[C@@H](C)c1ccccc1OCC(=O)Nc1ccc(C)[nH+]c1C ZINC000119331901 337857704 /nfs/dbraw/zinc/85/77/04/337857704.db2.gz UPRIVXDFTWHTBN-CYBMUJFWSA-N 1 2 312.413 4.229 20 0 DIADLO Cc1cc(NC(=O)N2C[C@@H](c3ccccc3)C(C)(C)C2)cc[nH+]1 ZINC000119847328 337866717 /nfs/dbraw/zinc/86/67/17/337866717.db2.gz BQWQROWGVDMMLF-KRWDZBQOSA-N 1 2 309.413 4.048 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000537123382 337893456 /nfs/dbraw/zinc/89/34/56/337893456.db2.gz QLKPNXPFSJZHLN-KBPBESRZSA-N 1 2 322.412 4.106 20 0 DIADLO CC(C)C[C@@H](C)Oc1cc(C[NH2+][C@@H](C)c2nccs2)ccn1 ZINC000091723131 337894775 /nfs/dbraw/zinc/89/47/75/337894775.db2.gz KAHPEEAPFOXLGD-KGLIPLIRSA-N 1 2 319.474 4.202 20 0 DIADLO Cc1nc([C@H]([NH2+]C[C@@H]2CC=CCC2)c2ccc(Cl)cc2)no1 ZINC000092441404 337904152 /nfs/dbraw/zinc/90/41/52/337904152.db2.gz IJFODXIQWWKVEH-CZUORRHYSA-N 1 2 317.820 4.067 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCC(=O)Nc1ccccc1C(C)C ZINC000122778671 337925215 /nfs/dbraw/zinc/92/52/15/337925215.db2.gz KVYUCEHXKHFDHN-UHFFFAOYSA-N 1 2 321.424 4.497 20 0 DIADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)[C@@H]1CCC[C@@H](F)C1 ZINC000424625992 337926530 /nfs/dbraw/zinc/92/65/30/337926530.db2.gz IMCJKDZETZFLSS-ZIAGYGMSSA-N 1 2 314.360 4.341 20 0 DIADLO C[C@H](Nc1ccc2oc(CC(C)(C)C)nc2c1)c1[nH+]ccn1C ZINC000537529083 337940764 /nfs/dbraw/zinc/94/07/64/337940764.db2.gz GVAJCOAPOHYMRQ-LBPRGKRZSA-N 1 2 312.417 4.323 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccc(F)cc1F ZINC000537961154 337964809 /nfs/dbraw/zinc/96/48/09/337964809.db2.gz ZEQQNLFQXRQRIB-BJOHPYRUSA-N 1 2 309.743 4.403 20 0 DIADLO CC(C)c1cc(N2CC(C)(C)[C@@H]2[C@H]2CCCO2)nc(C(C)C)[nH+]1 ZINC000514832870 337972560 /nfs/dbraw/zinc/97/25/60/337972560.db2.gz SHEQTSGYJDPSGM-WBVHZDCISA-N 1 2 317.477 4.117 20 0 DIADLO Cc1ccc(C(=O)N[C@@H]2CCC[C@@H]3C[C@@H]32)cc1Oc1cc[nH+]cc1 ZINC000515041912 337978459 /nfs/dbraw/zinc/97/84/59/337978459.db2.gz MAJVEMIAOIMPOG-FHLIZLRMSA-N 1 2 322.408 4.101 20 0 DIADLO Cc1cc(C)c([C@@H](C)Sc2[nH+]cnc3c2cnn3C)c(C)c1 ZINC000516147760 338005454 /nfs/dbraw/zinc/00/54/54/338005454.db2.gz WLGXURMAHHXRQI-CYBMUJFWSA-N 1 2 312.442 4.142 20 0 DIADLO Cc1ccccc1[C@@H](c1noc(Cc2ccc[nH+]c2C)n1)C(C)C ZINC000516347481 338010387 /nfs/dbraw/zinc/01/03/87/338010387.db2.gz YJVWDAGSDLREMF-IBGZPJMESA-N 1 2 321.424 4.460 20 0 DIADLO CCCc1csc(C[N@@H+]2CCC[C@H]2c2ccc(COC)o2)n1 ZINC000426366948 338029011 /nfs/dbraw/zinc/02/90/11/338029011.db2.gz RVMDIYLKINUSER-HNNXBMFYSA-N 1 2 320.458 4.172 20 0 DIADLO CCCc1csc(C[N@H+]2CCC[C@H]2c2ccc(COC)o2)n1 ZINC000426366948 338029012 /nfs/dbraw/zinc/02/90/12/338029012.db2.gz RVMDIYLKINUSER-HNNXBMFYSA-N 1 2 320.458 4.172 20 0 DIADLO CCCc1csc(C[N@@H+]2C[C@H](C)O[C@@H](c3ccccc3)C2)n1 ZINC000426417586 338031395 /nfs/dbraw/zinc/03/13/95/338031395.db2.gz BORZCBLAPHOMBK-WMLDXEAASA-N 1 2 316.470 4.058 20 0 DIADLO CCCc1csc(C[N@H+]2C[C@H](C)O[C@@H](c3ccccc3)C2)n1 ZINC000426417586 338031396 /nfs/dbraw/zinc/03/13/96/338031396.db2.gz BORZCBLAPHOMBK-WMLDXEAASA-N 1 2 316.470 4.058 20 0 DIADLO CCCc1csc(C[N@H+](CC)[C@@H](C)c2cccc(O)c2)n1 ZINC000426420295 338031764 /nfs/dbraw/zinc/03/17/64/338031764.db2.gz NPCBHSPTIYEKMN-ZDUSSCGKSA-N 1 2 304.459 4.384 20 0 DIADLO CCCc1csc(C[N@@H+](CC)[C@@H](C)c2cccc(O)c2)n1 ZINC000426420295 338031765 /nfs/dbraw/zinc/03/17/65/338031765.db2.gz NPCBHSPTIYEKMN-ZDUSSCGKSA-N 1 2 304.459 4.384 20 0 DIADLO Cc1c[nH+]cc(CCc2nc(-c3ccc(OC(C)C)cc3)no2)c1 ZINC000426443626 338032281 /nfs/dbraw/zinc/03/22/81/338032281.db2.gz DVOUIOCDTYCPSC-UHFFFAOYSA-N 1 2 323.396 4.012 20 0 DIADLO CCCc1nc(C)c(C[N@H+](CC)Cc2c(F)cccc2F)o1 ZINC000428208350 338042340 /nfs/dbraw/zinc/04/23/40/338042340.db2.gz QIECQOMRNKOSBD-UHFFFAOYSA-N 1 2 308.372 4.236 20 0 DIADLO CCCc1nc(C)c(C[N@@H+](CC)Cc2c(F)cccc2F)o1 ZINC000428208350 338042341 /nfs/dbraw/zinc/04/23/41/338042341.db2.gz QIECQOMRNKOSBD-UHFFFAOYSA-N 1 2 308.372 4.236 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@@H](c2ccccc2)OC[C@H]1C ZINC000428231177 338043408 /nfs/dbraw/zinc/04/34/08/338043408.db2.gz VDLXSLUTRNTYBO-KDOFPFPSSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@@H](c2ccccc2)OC[C@H]1C ZINC000428231177 338043409 /nfs/dbraw/zinc/04/34/09/338043409.db2.gz VDLXSLUTRNTYBO-KDOFPFPSSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@H](c2ccccc2)OC[C@H]1C ZINC000428231179 338043421 /nfs/dbraw/zinc/04/34/21/338043421.db2.gz VDLXSLUTRNTYBO-RDTXWAMCSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@H](c2ccccc2)OC[C@H]1C ZINC000428231179 338043422 /nfs/dbraw/zinc/04/34/22/338043422.db2.gz VDLXSLUTRNTYBO-RDTXWAMCSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@@H](C)OC[C@@H]1c1ccccc1 ZINC000428245150 338044183 /nfs/dbraw/zinc/04/41/83/338044183.db2.gz LUGYJEFAVYLWQO-RHSMWYFYSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@@H](C)OC[C@@H]1c1ccccc1 ZINC000428245150 338044184 /nfs/dbraw/zinc/04/41/84/338044184.db2.gz LUGYJEFAVYLWQO-RHSMWYFYSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1[C@H](C)COC[C@@H]1c1ccccc1 ZINC000428294733 338046092 /nfs/dbraw/zinc/04/60/92/338046092.db2.gz NQWUXIYACGBJAK-RHSMWYFYSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1[C@H](C)COC[C@@H]1c1ccccc1 ZINC000428294733 338046093 /nfs/dbraw/zinc/04/60/93/338046093.db2.gz NQWUXIYACGBJAK-RHSMWYFYSA-N 1 2 314.429 4.068 20 0 DIADLO CC[C@H](C)[N@H+](CC(=O)OC(C)(C)C)Cc1oc(C(C)C)nc1C ZINC000428371201 338049211 /nfs/dbraw/zinc/04/92/11/338049211.db2.gz VNHCCYNEUHZHFH-ZDUSSCGKSA-N 1 2 324.465 4.049 20 0 DIADLO CC[C@H](C)[N@@H+](CC(=O)OC(C)(C)C)Cc1oc(C(C)C)nc1C ZINC000428371201 338049212 /nfs/dbraw/zinc/04/92/12/338049212.db2.gz VNHCCYNEUHZHFH-ZDUSSCGKSA-N 1 2 324.465 4.049 20 0 DIADLO CC(C)c1nnc(C[N@H+](C)C2c3ccccc3-c3ccccc32)[nH]1 ZINC000428384149 338049584 /nfs/dbraw/zinc/04/95/84/338049584.db2.gz WMGDFNHAVMSAPP-UHFFFAOYSA-N 1 2 318.424 4.130 20 0 DIADLO CC(C)c1nnc(C[N@@H+](C)C2c3ccccc3-c3ccccc32)[nH]1 ZINC000428384149 338049585 /nfs/dbraw/zinc/04/95/85/338049585.db2.gz WMGDFNHAVMSAPP-UHFFFAOYSA-N 1 2 318.424 4.130 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)ncn1 ZINC000428441351 338051759 /nfs/dbraw/zinc/05/17/59/338051759.db2.gz HISMBEKYJUBLDV-NSHDSACASA-N 1 2 310.228 4.285 20 0 DIADLO Cc1cc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)ncn1 ZINC000428441351 338051760 /nfs/dbraw/zinc/05/17/60/338051760.db2.gz HISMBEKYJUBLDV-NSHDSACASA-N 1 2 310.228 4.285 20 0 DIADLO CCCc1nc(C)c(C[NH+](Cc2ccco2)Cc2ccco2)o1 ZINC000428467163 338053827 /nfs/dbraw/zinc/05/38/27/338053827.db2.gz YYSUSERPWOBCHR-UHFFFAOYSA-N 1 2 314.385 4.324 20 0 DIADLO CCCc1nc(C)c(C[N@H+](C)[C@H](C)c2c(F)cccc2F)o1 ZINC000428486899 338054756 /nfs/dbraw/zinc/05/47/56/338054756.db2.gz PIMLBAANAUUEJO-GFCCVEGCSA-N 1 2 308.372 4.407 20 0 DIADLO CCCc1nc(C)c(C[N@@H+](C)[C@H](C)c2c(F)cccc2F)o1 ZINC000428486899 338054757 /nfs/dbraw/zinc/05/47/57/338054757.db2.gz PIMLBAANAUUEJO-GFCCVEGCSA-N 1 2 308.372 4.407 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2nc3ccc(F)cc3s2)cs1 ZINC000428841407 338061790 /nfs/dbraw/zinc/06/17/90/338061790.db2.gz CHCRGOGFAQFOCY-VIFPVBQESA-N 1 2 321.446 4.305 20 0 DIADLO Fc1ccc2nc(CNc3c[nH+]c4c(c3)CCCC4)sc2c1 ZINC000428871262 338063791 /nfs/dbraw/zinc/06/37/91/338063791.db2.gz HWGOIPUGZUXVAB-UHFFFAOYSA-N 1 2 313.401 4.321 20 0 DIADLO Fc1cc(-c2ccc(Cl)cc2)ccc1C[NH2+]Cc1cocn1 ZINC000428876012 338064250 /nfs/dbraw/zinc/06/42/50/338064250.db2.gz IPSKWLOLURNNAJ-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc2ccc(F)cc2s1)c1nccs1 ZINC000428888433 338064707 /nfs/dbraw/zinc/06/47/07/338064707.db2.gz NMVKEKBLBZMOOD-OAHLLOKOSA-N 1 2 321.446 4.307 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(C(F)F)cc2)C[C@H](C(F)(F)F)O1 ZINC000428937792 338065587 /nfs/dbraw/zinc/06/55/87/338065587.db2.gz GWCCFULPMIEWDH-GFCCVEGCSA-N 1 2 323.305 4.166 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(C(F)F)cc2)C[C@H](C(F)(F)F)O1 ZINC000428937792 338065588 /nfs/dbraw/zinc/06/55/88/338065588.db2.gz GWCCFULPMIEWDH-GFCCVEGCSA-N 1 2 323.305 4.166 20 0 DIADLO CCc1nc(C)c(C[N@@H+]2CC[C@@](F)(c3cc(C)cc(F)c3)C2)o1 ZINC000428941523 338065849 /nfs/dbraw/zinc/06/58/49/338065849.db2.gz VUFRGSVKLDFIKE-SFHVURJKSA-N 1 2 320.383 4.064 20 0 DIADLO CCc1nc(C)c(C[N@H+]2CC[C@@](F)(c3cc(C)cc(F)c3)C2)o1 ZINC000428941523 338065850 /nfs/dbraw/zinc/06/58/50/338065850.db2.gz VUFRGSVKLDFIKE-SFHVURJKSA-N 1 2 320.383 4.064 20 0 DIADLO CCc1nc(C)c(C[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)o1 ZINC000428974455 338067377 /nfs/dbraw/zinc/06/73/77/338067377.db2.gz FMRQMMPUOQKBKY-HXUWFJFHSA-N 1 2 321.424 4.128 20 0 DIADLO C[C@@H]1C[N@H+](Cc2csc(C(C)(C)C)n2)Cc2ccccc2O1 ZINC000429119707 338071019 /nfs/dbraw/zinc/07/10/19/338071019.db2.gz YYYZNKKQLMTQRN-CYBMUJFWSA-N 1 2 316.470 4.224 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2csc(C(C)(C)C)n2)Cc2ccccc2O1 ZINC000429119707 338071020 /nfs/dbraw/zinc/07/10/20/338071020.db2.gz YYYZNKKQLMTQRN-CYBMUJFWSA-N 1 2 316.470 4.224 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC000429164449 338072427 /nfs/dbraw/zinc/07/24/27/338072427.db2.gz CQIWHYUBMSYCID-UONOGXRCSA-N 1 2 314.429 4.316 20 0 DIADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC000429164449 338072428 /nfs/dbraw/zinc/07/24/28/338072428.db2.gz CQIWHYUBMSYCID-UONOGXRCSA-N 1 2 314.429 4.316 20 0 DIADLO Cc1cc[nH+]c(NCc2cc(F)cc(F)c2)c1Br ZINC000429210851 338073292 /nfs/dbraw/zinc/07/32/92/338073292.db2.gz JBZYCWHLUAOZRJ-UHFFFAOYSA-N 1 2 313.145 4.043 20 0 DIADLO C[C@@H]1CC[C@H](N(C)C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000429251956 338074850 /nfs/dbraw/zinc/07/48/50/338074850.db2.gz JPNCLLSAFONWOT-ZBFHGGJFSA-N 1 2 310.397 4.135 20 0 DIADLO CC[C@H]1CC[N@@H+]1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000429275789 338075625 /nfs/dbraw/zinc/07/56/25/338075625.db2.gz RURIQMXUEIPCHG-AWEZNQCLSA-N 1 2 322.861 4.360 20 0 DIADLO CC[C@H]1CC[N@H+]1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000429275789 338075626 /nfs/dbraw/zinc/07/56/26/338075626.db2.gz RURIQMXUEIPCHG-AWEZNQCLSA-N 1 2 322.861 4.360 20 0 DIADLO Cc1ccoc1C[N@H+](C)Cc1csc(-c2ccccc2F)n1 ZINC000429376959 338079065 /nfs/dbraw/zinc/07/90/65/338079065.db2.gz HYDOCVJYVASRJS-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO Cc1ccoc1C[N@@H+](C)Cc1csc(-c2ccccc2F)n1 ZINC000429376959 338079066 /nfs/dbraw/zinc/07/90/66/338079066.db2.gz HYDOCVJYVASRJS-UHFFFAOYSA-N 1 2 316.401 4.483 20 0 DIADLO C[C@H](c1cccc(Cl)c1F)N(C)Cc1cn2c([nH+]1)CCCC2 ZINC000429542487 338083517 /nfs/dbraw/zinc/08/35/17/338083517.db2.gz QTPUJLGHEPGDHL-GFCCVEGCSA-N 1 2 321.827 4.205 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]C(C)(C)c1nc(C)cs1 ZINC000429687920 338087484 /nfs/dbraw/zinc/08/74/84/338087484.db2.gz VPZNTRGZHFKGSR-UHFFFAOYSA-N 1 2 310.850 4.138 20 0 DIADLO C[N@H+](CCOc1ccc(Cl)cc1)Cc1cc(C(C)(C)C)on1 ZINC000429705468 338087891 /nfs/dbraw/zinc/08/78/91/338087891.db2.gz BAMROFZWMXWPEC-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO C[N@@H+](CCOc1ccc(Cl)cc1)Cc1cc(C(C)(C)C)on1 ZINC000429705468 338087892 /nfs/dbraw/zinc/08/78/92/338087892.db2.gz BAMROFZWMXWPEC-UHFFFAOYSA-N 1 2 322.836 4.136 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2cc(C(C)(C)C)on2)c1 ZINC000429718713 338088221 /nfs/dbraw/zinc/08/82/21/338088221.db2.gz SVLCRAFRBRRORH-QGZVFWFLSA-N 1 2 314.429 4.318 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2cc(C(C)(C)C)on2)c1 ZINC000429718713 338088222 /nfs/dbraw/zinc/08/82/22/338088222.db2.gz SVLCRAFRBRRORH-QGZVFWFLSA-N 1 2 314.429 4.318 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1cc(F)ccc1F ZINC000429791082 338089999 /nfs/dbraw/zinc/08/99/99/338089999.db2.gz WZBLGVBPEVIOKW-ZETCQYMHSA-N 1 2 319.248 4.372 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2ccc(Cl)cc2)c(F)c1F ZINC000430035581 338093973 /nfs/dbraw/zinc/09/39/73/338093973.db2.gz NETGZONSDAEAMV-UHFFFAOYSA-N 1 2 303.686 4.186 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(F)cc2Cl)[C@H]1c1cccnc1 ZINC000430104138 338096877 /nfs/dbraw/zinc/09/68/77/338096877.db2.gz QYYSKGAONLFXJU-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(F)cc2Cl)[C@H]1c1cccnc1 ZINC000430104138 338096878 /nfs/dbraw/zinc/09/68/78/338096878.db2.gz QYYSKGAONLFXJU-INIZCTEOSA-N 1 2 304.796 4.457 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000430110507 338097348 /nfs/dbraw/zinc/09/73/48/338097348.db2.gz ZDHYSYDIEDNAEG-KRWDZBQOSA-N 1 2 316.832 4.327 20 0 DIADLO COc1cccc(Cl)c1C[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000430110507 338097349 /nfs/dbraw/zinc/09/73/49/338097349.db2.gz ZDHYSYDIEDNAEG-KRWDZBQOSA-N 1 2 316.832 4.327 20 0 DIADLO CC(C)n1cnnc1C[N@H+](C)Cc1cccc(-c2ccccc2)c1 ZINC000430200938 338101154 /nfs/dbraw/zinc/10/11/54/338101154.db2.gz YGKHKDYIPRTTRE-UHFFFAOYSA-N 1 2 320.440 4.158 20 0 DIADLO CC(C)n1cnnc1C[N@@H+](C)Cc1cccc(-c2ccccc2)c1 ZINC000430200938 338101155 /nfs/dbraw/zinc/10/11/55/338101155.db2.gz YGKHKDYIPRTTRE-UHFFFAOYSA-N 1 2 320.440 4.158 20 0 DIADLO CC[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccc(F)cn1 ZINC000430749278 338113565 /nfs/dbraw/zinc/11/35/65/338113565.db2.gz ULULQCKZESWHJA-LBPRGKRZSA-N 1 2 316.273 4.018 20 0 DIADLO C[C@@H]1[C@H](C(=O)Nc2c[nH+]ccc2OC(C)(C)C)[C@H]1c1ccccc1 ZINC000430800039 338115405 /nfs/dbraw/zinc/11/54/05/338115405.db2.gz OBFWKUXOIORSRY-VHSSKADRSA-N 1 2 324.424 4.247 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1cc(F)cc(Cl)c1 ZINC000430871474 338117677 /nfs/dbraw/zinc/11/76/77/338117677.db2.gz XSJQBQUVKLDNPZ-MRXNPFEDSA-N 1 2 321.827 4.423 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1cccc(Cl)c1F ZINC000430876260 338117809 /nfs/dbraw/zinc/11/78/09/338117809.db2.gz DHSSRICVJWFXPT-OAHLLOKOSA-N 1 2 321.827 4.423 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1cc(F)ccc1C ZINC000430875930 338117849 /nfs/dbraw/zinc/11/78/49/338117849.db2.gz BSIXPJIJYFZOBD-KRWDZBQOSA-N 1 2 301.409 4.078 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1Cc1cc(F)ccc1C ZINC000430875930 338117850 /nfs/dbraw/zinc/11/78/50/338117850.db2.gz BSIXPJIJYFZOBD-KRWDZBQOSA-N 1 2 301.409 4.078 20 0 DIADLO Cc1cc(C)c(COc2cc[nH+]cc2)c(OCc2ccccc2)n1 ZINC000431476790 338131725 /nfs/dbraw/zinc/13/17/25/338131725.db2.gz IWFCUYYHOBQIKP-UHFFFAOYSA-N 1 2 320.392 4.251 20 0 DIADLO Cc1ccc(NC(=O)N[C@@H]2CC(C)(C)c3ccccc32)c(C)[nH+]1 ZINC000431801795 338139050 /nfs/dbraw/zinc/13/90/50/338139050.db2.gz QBYOZWKBYODTJT-QGZVFWFLSA-N 1 2 309.413 4.243 20 0 DIADLO COc1cc(C)[nH+]c(COc2ccc(Oc3ccccc3)nc2)c1 ZINC000431860066 338140496 /nfs/dbraw/zinc/14/04/96/338140496.db2.gz IFRBSDABOYWOMA-UHFFFAOYSA-N 1 2 322.364 4.165 20 0 DIADLO Fc1ccc([C@@H]2CCCC[N@@H+]2CCOCC(F)(F)F)c(F)c1 ZINC000432010942 338143582 /nfs/dbraw/zinc/14/35/82/338143582.db2.gz DGHBTWHUVPMWNZ-AWEZNQCLSA-N 1 2 323.305 4.071 20 0 DIADLO Fc1ccc([C@@H]2CCCC[N@H+]2CCOCC(F)(F)F)c(F)c1 ZINC000432010942 338143583 /nfs/dbraw/zinc/14/35/83/338143583.db2.gz DGHBTWHUVPMWNZ-AWEZNQCLSA-N 1 2 323.305 4.071 20 0 DIADLO Fc1ccc([C@H]2CCCCN2c2cc[nH+]c(C3CC3)n2)c(F)c1 ZINC000432054670 338144532 /nfs/dbraw/zinc/14/45/32/338144532.db2.gz MIRAXRWBHSABAB-MRXNPFEDSA-N 1 2 315.367 4.364 20 0 DIADLO Cc1cc(N(Cc2ccccn2)C2CC2)c2cccc(F)c2[nH+]1 ZINC000432139007 338146884 /nfs/dbraw/zinc/14/68/84/338146884.db2.gz NSULYMIPBNJRSB-UHFFFAOYSA-N 1 2 307.372 4.246 20 0 DIADLO Cc1ccc(-c2ccc(C)c(NC(=O)Nc3cc[nH+]cc3C)c2)o1 ZINC000432272222 338151918 /nfs/dbraw/zinc/15/19/18/338151918.db2.gz VEOORKYZJRFYDU-UHFFFAOYSA-N 1 2 321.380 4.333 20 0 DIADLO CC(C)CCn1cccc1CNc1cccc(-n2cc[nH+]c2)c1 ZINC000432610791 338160624 /nfs/dbraw/zinc/16/06/24/338160624.db2.gz BAVKRPBAPVPBCL-UHFFFAOYSA-N 1 2 308.429 4.332 20 0 DIADLO Cc1n[nH]cc1CNc1ccc(-c2ccc(Cl)s2)c[nH+]1 ZINC000432736738 338165096 /nfs/dbraw/zinc/16/50/96/338165096.db2.gz XZLBTVYSSRFUGI-UHFFFAOYSA-N 1 2 304.806 4.107 20 0 DIADLO c1cc(-c2ccc(CNc3ccc(-c4ccccc4)c[nH+]3)o2)n[nH]1 ZINC000432745414 338165891 /nfs/dbraw/zinc/16/58/91/338165891.db2.gz BVFYLXMYLVRAGM-UHFFFAOYSA-N 1 2 316.364 4.344 20 0 DIADLO FC(F)(F)c1ccc(CN2CCCC[C@@H]2c2[nH]cc[nH+]2)s1 ZINC000432746813 338166019 /nfs/dbraw/zinc/16/60/19/338166019.db2.gz FVWHCZDQKJSZTK-LLVKDONJSA-N 1 2 315.364 4.217 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+](Cc2ccoc2)C2CCCCC2)[nH]1 ZINC000432819051 338169083 /nfs/dbraw/zinc/16/90/83/338169083.db2.gz NBNPTYXIFMKRJW-UHFFFAOYSA-N 1 2 316.449 4.030 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+](Cc2ccoc2)C2CCCCC2)[nH]1 ZINC000432819051 338169084 /nfs/dbraw/zinc/16/90/84/338169084.db2.gz NBNPTYXIFMKRJW-UHFFFAOYSA-N 1 2 316.449 4.030 20 0 DIADLO FC1(c2ccccc2)CCN(c2cc[nH+]c3ccncc32)CC1 ZINC000432832623 338169971 /nfs/dbraw/zinc/16/99/71/338169971.db2.gz PLBNJSZNXBPEQR-UHFFFAOYSA-N 1 2 307.372 4.095 20 0 DIADLO COC(=O)c1cc([C@H](C)[N@H+](C)Cc2ccccc2Cl)oc1C ZINC000432927834 338173674 /nfs/dbraw/zinc/17/36/74/338173674.db2.gz OPUBLZOAXLSTLB-NSHDSACASA-N 1 2 321.804 4.221 20 0 DIADLO COC(=O)c1cc([C@H](C)[N@@H+](C)Cc2ccccc2Cl)oc1C ZINC000432927834 338173675 /nfs/dbraw/zinc/17/36/75/338173675.db2.gz OPUBLZOAXLSTLB-NSHDSACASA-N 1 2 321.804 4.221 20 0 DIADLO CCSc1cccc(CNC(=O)Nc2ccc(C)[nH+]c2C)c1 ZINC000433018819 338176456 /nfs/dbraw/zinc/17/64/56/338176456.db2.gz GTUWIXJNPTWGMP-UHFFFAOYSA-N 1 2 315.442 4.132 20 0 DIADLO CC(C)(C)OC(=O)CCCC[NH2+][C@H](c1ccccc1)C(F)F ZINC000433048827 338178366 /nfs/dbraw/zinc/17/83/66/338178366.db2.gz YSPHTRJVTANNFU-OAHLLOKOSA-N 1 2 313.388 4.094 20 0 DIADLO CCCCc1noc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)n1 ZINC000433307995 338190959 /nfs/dbraw/zinc/19/09/59/338190959.db2.gz WOCFGSZPRNCCQL-CQSZACIVSA-N 1 2 319.836 4.055 20 0 DIADLO CCCCc1noc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)n1 ZINC000433307995 338190960 /nfs/dbraw/zinc/19/09/60/338190960.db2.gz WOCFGSZPRNCCQL-CQSZACIVSA-N 1 2 319.836 4.055 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ncc(C(F)(F)F)s2)c(C)o1 ZINC000433312876 338191696 /nfs/dbraw/zinc/19/16/96/338191696.db2.gz NPVLWQNJKYGPRO-QMMMGPOBSA-N 1 2 304.337 4.223 20 0 DIADLO FC(F)(F)c1cnc(C[NH2+]Cc2ccc(C3CC3)cc2)s1 ZINC000433334390 338192910 /nfs/dbraw/zinc/19/29/10/338192910.db2.gz HKKOKNCACLWQCW-UHFFFAOYSA-N 1 2 312.360 4.329 20 0 DIADLO Cc1nc2[nH]ccc2c(N(C)[C@H](C)c2cc3ccccc3o2)[nH+]1 ZINC000433782931 338201744 /nfs/dbraw/zinc/20/17/44/338201744.db2.gz LNTMHZQVXGEPFY-LLVKDONJSA-N 1 2 306.369 4.210 20 0 DIADLO Cc1nc2[nH]ccc2c(N2CCCC[C@@H]2c2ccc(F)cc2)[nH+]1 ZINC000433787863 338201927 /nfs/dbraw/zinc/20/19/27/338201927.db2.gz YXSAHGFUWVBHPH-MRXNPFEDSA-N 1 2 310.376 4.137 20 0 DIADLO Cc1ccc(NC(=O)N2C[C@@H](c3ccccc3)C(C)(C)C2)c(C)[nH+]1 ZINC000434117370 338209797 /nfs/dbraw/zinc/20/97/97/338209797.db2.gz WQSBBRLWYODXBK-KRWDZBQOSA-N 1 2 323.440 4.356 20 0 DIADLO Cc1ccc(NC(=O)N2C[C@H](c3ccccc3)C(C)(C)C2)c(C)[nH+]1 ZINC000434117371 338209865 /nfs/dbraw/zinc/20/98/65/338209865.db2.gz WQSBBRLWYODXBK-QGZVFWFLSA-N 1 2 323.440 4.356 20 0 DIADLO CC(C)n1ncnc1C[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000434489378 338218183 /nfs/dbraw/zinc/21/81/83/338218183.db2.gz QHQCSWPLOCUYEB-SNVBAGLBSA-N 1 2 313.232 4.017 20 0 DIADLO CC(C)Cc1noc(C[N@H+](C)[C@H](c2ccc(F)cc2)C(C)C)n1 ZINC000434617852 338221333 /nfs/dbraw/zinc/22/13/33/338221333.db2.gz MWZKJSQPSQPHRA-SFHVURJKSA-N 1 2 319.424 4.236 20 0 DIADLO CC(C)Cc1noc(C[N@@H+](C)[C@H](c2ccc(F)cc2)C(C)C)n1 ZINC000434617852 338221334 /nfs/dbraw/zinc/22/13/34/338221334.db2.gz MWZKJSQPSQPHRA-SFHVURJKSA-N 1 2 319.424 4.236 20 0 DIADLO Cc1cccc([C@@H](C)[S@](=O)Cc2[nH+]ccn2-c2ccccc2)c1 ZINC000434629881 338221846 /nfs/dbraw/zinc/22/18/46/338221846.db2.gz ROXPTVAJUMIHIU-WAIKUNEKSA-N 1 2 324.449 4.191 20 0 DIADLO CC(C)c1ccc([S@@](=O)Cc2[nH+]ccn2-c2ccccc2)cc1 ZINC000434640016 338222254 /nfs/dbraw/zinc/22/22/54/338222254.db2.gz XQAGYIFAUUHPHN-QHCPKHFHSA-N 1 2 324.449 4.304 20 0 DIADLO Cc1ccccc1C[N@H+](C)Cc1ncc(C(F)(F)F)s1 ZINC000434834544 338226039 /nfs/dbraw/zinc/22/60/39/338226039.db2.gz RTNUMAOKSNOWKH-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1ccccc1C[N@@H+](C)Cc1ncc(C(F)(F)F)s1 ZINC000434834544 338226040 /nfs/dbraw/zinc/22/60/40/338226040.db2.gz RTNUMAOKSNOWKH-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO C[N@H+](Cc1ccc(-c2cc[nH]n2)o1)Cc1c(F)cccc1Cl ZINC000434834225 338226199 /nfs/dbraw/zinc/22/61/99/338226199.db2.gz OPQOENWNBFUDQP-UHFFFAOYSA-N 1 2 319.767 4.094 20 0 DIADLO C[N@@H+](Cc1ccc(-c2cc[nH]n2)o1)Cc1c(F)cccc1Cl ZINC000434834225 338226200 /nfs/dbraw/zinc/22/62/00/338226200.db2.gz OPQOENWNBFUDQP-UHFFFAOYSA-N 1 2 319.767 4.094 20 0 DIADLO COc1ccc(OC(F)F)c(C[N@@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000434976597 338228278 /nfs/dbraw/zinc/22/82/78/338228278.db2.gz CXBZAKZKCNCHAS-MRXNPFEDSA-N 1 2 319.351 4.244 20 0 DIADLO COc1ccc(OC(F)F)c(C[N@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000434976597 338228279 /nfs/dbraw/zinc/22/82/79/338228279.db2.gz CXBZAKZKCNCHAS-MRXNPFEDSA-N 1 2 319.351 4.244 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCCC3(CCCC3)C2)s1 ZINC000434982421 338228457 /nfs/dbraw/zinc/22/84/57/338228457.db2.gz LIJXEPMWMIFBOU-UHFFFAOYSA-N 1 2 304.381 4.318 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCCC3(CCCC3)C2)s1 ZINC000434982421 338228458 /nfs/dbraw/zinc/22/84/58/338228458.db2.gz LIJXEPMWMIFBOU-UHFFFAOYSA-N 1 2 304.381 4.318 20 0 DIADLO C[C@@H]1CC[C@@]2(CC[N@H+](Cc3ncc(C(F)(F)F)s3)C2)C1 ZINC000434980872 338228510 /nfs/dbraw/zinc/22/85/10/338228510.db2.gz HHHDIKJRCWEIHJ-ZWNOBZJWSA-N 1 2 304.381 4.174 20 0 DIADLO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3ncc(C(F)(F)F)s3)C2)C1 ZINC000434980872 338228511 /nfs/dbraw/zinc/22/85/11/338228511.db2.gz HHHDIKJRCWEIHJ-ZWNOBZJWSA-N 1 2 304.381 4.174 20 0 DIADLO CCC1(CC)C[N@H+](Cc2ncc(C(F)(F)F)s2)CCS1 ZINC000434990704 338229259 /nfs/dbraw/zinc/22/92/59/338229259.db2.gz ISJUKSBUJVSZMR-UHFFFAOYSA-N 1 2 324.437 4.270 20 0 DIADLO CCC1(CC)C[N@@H+](Cc2ncc(C(F)(F)F)s2)CCS1 ZINC000434990704 338229260 /nfs/dbraw/zinc/22/92/60/338229260.db2.gz ISJUKSBUJVSZMR-UHFFFAOYSA-N 1 2 324.437 4.270 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CC[C@H](c3ccccc3)C2)s1 ZINC000435126992 338232583 /nfs/dbraw/zinc/23/25/83/338232583.db2.gz SZVGCOWEMYGHSL-LBPRGKRZSA-N 1 2 312.360 4.151 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CC[C@H](c3ccccc3)C2)s1 ZINC000435126992 338232584 /nfs/dbraw/zinc/23/25/84/338232584.db2.gz SZVGCOWEMYGHSL-LBPRGKRZSA-N 1 2 312.360 4.151 20 0 DIADLO CC(C)C[C@H]1CCC[N@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC000435128208 338232729 /nfs/dbraw/zinc/23/27/29/338232729.db2.gz GCRAOZOHWDWBOF-LLVKDONJSA-N 1 2 306.397 4.420 20 0 DIADLO CC(C)C[C@H]1CCC[N@@H+](Cc2ncc(C(F)(F)F)s2)C1 ZINC000435128208 338232730 /nfs/dbraw/zinc/23/27/30/338232730.db2.gz GCRAOZOHWDWBOF-LLVKDONJSA-N 1 2 306.397 4.420 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCC[C@H]2c2ccccc2)s1 ZINC000435135174 338233015 /nfs/dbraw/zinc/23/30/15/338233015.db2.gz MUNLPMFMXMGVNS-LBPRGKRZSA-N 1 2 312.360 4.499 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCC[C@H]2c2ccccc2)s1 ZINC000435135174 338233016 /nfs/dbraw/zinc/23/30/16/338233016.db2.gz MUNLPMFMXMGVNS-LBPRGKRZSA-N 1 2 312.360 4.499 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1C(=O)C[C@H](C)C(C)(C)C ZINC000435991972 338255270 /nfs/dbraw/zinc/25/52/70/338255270.db2.gz JNGFNLRVNQARJR-LSDHHAIUSA-N 1 2 305.466 4.029 20 0 DIADLO Cc1ccc(C(=O)N2CC(C)=C[C@H](C)C2)cc1Oc1cc[nH+]cc1 ZINC000436014824 338255828 /nfs/dbraw/zinc/25/58/28/338255828.db2.gz SWDATXBKDMGGSC-AWEZNQCLSA-N 1 2 322.408 4.221 20 0 DIADLO Fc1cccc2[nH]c(CNc3ccc(N4CCCCC4)[nH+]c3)cc21 ZINC000436021544 338256047 /nfs/dbraw/zinc/25/60/47/338256047.db2.gz VPBFASCXVQNDQD-UHFFFAOYSA-N 1 2 324.403 4.304 20 0 DIADLO CCC(C)(C)C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436165847 338260246 /nfs/dbraw/zinc/26/02/46/338260246.db2.gz AHYOZRRVRLMMDY-UHFFFAOYSA-N 1 2 311.429 4.261 20 0 DIADLO CC(C)[C@@H](C)C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436174440 338260610 /nfs/dbraw/zinc/26/06/10/338260610.db2.gz VEHAKLKCXCLCTP-CQSZACIVSA-N 1 2 311.429 4.117 20 0 DIADLO Cc1occc1C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000436179727 338260794 /nfs/dbraw/zinc/26/07/94/338260794.db2.gz XNBUEGRMUABORJ-UHFFFAOYSA-N 1 2 321.380 4.040 20 0 DIADLO O=C(Nc1cccc(-c2[nH+]cc3n2CCCC3)c1)c1ccccc1 ZINC000436179758 338260848 /nfs/dbraw/zinc/26/08/48/338260848.db2.gz WAGIUMARQJOCCW-UHFFFAOYSA-N 1 2 317.392 4.139 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)c2[nH]ccc2C)c1 ZINC000436185794 338261149 /nfs/dbraw/zinc/26/11/49/338261149.db2.gz MXAZIFYCLPQCLU-UHFFFAOYSA-N 1 2 322.412 4.239 20 0 DIADLO CC1=CCC[N@@H+]([C@H](C)c2nc(Cc3ccc(Cl)cc3)no2)C1 ZINC000436260554 338264119 /nfs/dbraw/zinc/26/41/19/338264119.db2.gz OESHUNKGPWVLAO-CYBMUJFWSA-N 1 2 317.820 4.027 20 0 DIADLO CC1=CCC[N@H+]([C@H](C)c2nc(Cc3ccc(Cl)cc3)no2)C1 ZINC000436260554 338264120 /nfs/dbraw/zinc/26/41/20/338264120.db2.gz OESHUNKGPWVLAO-CYBMUJFWSA-N 1 2 317.820 4.027 20 0 DIADLO COc1cccc2c(N[C@H]3CCO[C@H](C(C)(C)C)C3)cc[nH+]c12 ZINC000436460125 338272817 /nfs/dbraw/zinc/27/28/17/338272817.db2.gz MXMCMIUSQXZIDM-GUYCJALGSA-N 1 2 314.429 4.249 20 0 DIADLO COc1cccc2c(N[C@@H]3CCO[C@@H](C(C)(C)C)C3)cc[nH+]c12 ZINC000436460118 338272838 /nfs/dbraw/zinc/27/28/38/338272838.db2.gz MXMCMIUSQXZIDM-CXAGYDPISA-N 1 2 314.429 4.249 20 0 DIADLO Cc1cc(C)c(NC(=O)N2[C@H](C)C[C@H]3CCCC[C@H]32)c(C)[nH+]1 ZINC000436486982 338273789 /nfs/dbraw/zinc/27/37/89/338273789.db2.gz CKJPQQKHDBEWGP-FVQBIDKESA-N 1 2 301.434 4.192 20 0 DIADLO Cc1cc(C)c(NC(=O)N2[C@H](C)C[C@@H]3CCCC[C@H]32)c(C)[nH+]1 ZINC000436486991 338273924 /nfs/dbraw/zinc/27/39/24/338273924.db2.gz CKJPQQKHDBEWGP-VNQPRFMTSA-N 1 2 301.434 4.192 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@H]2C2CCCC2)c(C)[nH+]1 ZINC000436491306 338274143 /nfs/dbraw/zinc/27/41/43/338274143.db2.gz IEFPRVSYUNKPEH-INIZCTEOSA-N 1 2 301.434 4.193 20 0 DIADLO CCC(C)(C)CC[S@](=O)Cc1cn2cc(Cl)ccc2[nH+]1 ZINC000437167606 338303089 /nfs/dbraw/zinc/30/30/89/338303089.db2.gz OHBKDZUOKJRANH-FQEVSTJZSA-N 1 2 312.866 4.063 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)n1 ZINC000437577698 338314162 /nfs/dbraw/zinc/31/41/62/338314162.db2.gz KKQKXIQPBCJZAE-LJQANCHMSA-N 1 2 314.477 4.310 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCCC[C@@H]2c2cccn2C)n1 ZINC000437577698 338314163 /nfs/dbraw/zinc/31/41/63/338314163.db2.gz KKQKXIQPBCJZAE-LJQANCHMSA-N 1 2 314.477 4.310 20 0 DIADLO COc1ccc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)cn1 ZINC000437582271 338314775 /nfs/dbraw/zinc/31/47/75/338314775.db2.gz NETIFDGJVHLLHH-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1ccc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)cn1 ZINC000437582271 338314776 /nfs/dbraw/zinc/31/47/76/338314776.db2.gz NETIFDGJVHLLHH-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO C[C@@H](Cc1ccccc1F)Nc1cccc(-c2[nH+]ccn2C)c1 ZINC000438083202 338330465 /nfs/dbraw/zinc/33/04/65/338330465.db2.gz WWZVXPNMMKYCEX-AWEZNQCLSA-N 1 2 309.388 4.269 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3c(cccc3F)[nH]2)[C@@H](c2ccccc2)CO1 ZINC000438091156 338330965 /nfs/dbraw/zinc/33/09/65/338330965.db2.gz AGOPDLMDHXSDJS-JLTOFOAXSA-N 1 2 324.399 4.269 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3c(cccc3F)[nH]2)[C@@H](c2ccccc2)CO1 ZINC000438091156 338330966 /nfs/dbraw/zinc/33/09/66/338330966.db2.gz AGOPDLMDHXSDJS-JLTOFOAXSA-N 1 2 324.399 4.269 20 0 DIADLO Cc1ccc2cc(C[N@H+](CC(F)F)CC3CCC3)ccc2n1 ZINC000438091713 338330968 /nfs/dbraw/zinc/33/09/68/338330968.db2.gz CQYKZLOCJZOYEO-UHFFFAOYSA-N 1 2 304.384 4.410 20 0 DIADLO Cc1ccc2cc(C[N@@H+](CC(F)F)CC3CCC3)ccc2n1 ZINC000438091713 338330969 /nfs/dbraw/zinc/33/09/69/338330969.db2.gz CQYKZLOCJZOYEO-UHFFFAOYSA-N 1 2 304.384 4.410 20 0 DIADLO COC(=O)c1ccc(CNc2[nH+]cccc2-c2ccccc2)cc1 ZINC000438242662 338337720 /nfs/dbraw/zinc/33/77/20/338337720.db2.gz DNHGTSOSSVLIRG-UHFFFAOYSA-N 1 2 318.376 4.147 20 0 DIADLO CC(C)CCc1noc([C@H]2CCC[N@@H+]2Cc2ccc(F)cc2)n1 ZINC000438246242 338337866 /nfs/dbraw/zinc/33/78/66/338337866.db2.gz ZEGJVLMEIJWRKC-MRXNPFEDSA-N 1 2 317.408 4.134 20 0 DIADLO CC(C)CCc1noc([C@H]2CCC[N@H+]2Cc2ccc(F)cc2)n1 ZINC000438246242 338337867 /nfs/dbraw/zinc/33/78/67/338337867.db2.gz ZEGJVLMEIJWRKC-MRXNPFEDSA-N 1 2 317.408 4.134 20 0 DIADLO Clc1ccc2[nH]c([C@@H]3CCC[N@@H+]3Cc3cncs3)nc2c1 ZINC000438259574 338337963 /nfs/dbraw/zinc/33/79/63/338337963.db2.gz MYKFCWHPFGMOBC-AWEZNQCLSA-N 1 2 318.833 4.010 20 0 DIADLO Clc1ccc2[nH]c([C@@H]3CCC[N@H+]3Cc3cncs3)nc2c1 ZINC000438259574 338337964 /nfs/dbraw/zinc/33/79/64/338337964.db2.gz MYKFCWHPFGMOBC-AWEZNQCLSA-N 1 2 318.833 4.010 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(Cl)c2)C[N@@H+]1Cc1cccc(O)c1 ZINC000438538402 338347312 /nfs/dbraw/zinc/34/73/12/338347312.db2.gz CPCKXRZZVFQBOH-FZKQIMNGSA-N 1 2 317.816 4.008 20 0 DIADLO C[C@@H]1CO[C@@H](c2cccc(Cl)c2)C[N@H+]1Cc1cccc(O)c1 ZINC000438538402 338347313 /nfs/dbraw/zinc/34/73/13/338347313.db2.gz CPCKXRZZVFQBOH-FZKQIMNGSA-N 1 2 317.816 4.008 20 0 DIADLO CCCc1noc(C[N@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)n1 ZINC000438723871 338351249 /nfs/dbraw/zinc/35/12/49/338351249.db2.gz NYKCEONDSZUCCE-LBPRGKRZSA-N 1 2 319.836 4.401 20 0 DIADLO CCCc1noc(C[N@@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)n1 ZINC000438723871 338351250 /nfs/dbraw/zinc/35/12/50/338351250.db2.gz NYKCEONDSZUCCE-LBPRGKRZSA-N 1 2 319.836 4.401 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cs1 ZINC000438758758 338351792 /nfs/dbraw/zinc/35/17/92/338351792.db2.gz WAVNESAIZXRKFZ-MRXNPFEDSA-N 1 2 303.475 4.397 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)cs1 ZINC000438758758 338351793 /nfs/dbraw/zinc/35/17/93/338351793.db2.gz WAVNESAIZXRKFZ-MRXNPFEDSA-N 1 2 303.475 4.397 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)ccc(O)c2F)cc1 ZINC000438849321 338353814 /nfs/dbraw/zinc/35/38/14/338353814.db2.gz DRCJKADFGFGOQJ-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)ccc(O)c2F)cc1 ZINC000438849321 338353815 /nfs/dbraw/zinc/35/38/15/338353815.db2.gz DRCJKADFGFGOQJ-INIZCTEOSA-N 1 2 319.351 4.016 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)C(C)(C)c1ccc(C(C)(C)C)cc1 ZINC000439007020 338358144 /nfs/dbraw/zinc/35/81/44/338358144.db2.gz UQADXOZHIAXGTJ-UHFFFAOYSA-N 1 2 310.441 4.026 20 0 DIADLO CCc1nc(C[NH2+][C@H]2C[C@H](C)Sc3sccc32)cs1 ZINC000156425893 338359494 /nfs/dbraw/zinc/35/94/94/338359494.db2.gz PWSDSGBHUQIRKN-CABZTGNLSA-N 1 2 310.513 4.482 20 0 DIADLO Cn1c[nH+]cc1CSc1ccc(Cl)c(C(F)(F)F)c1 ZINC000439521925 338372125 /nfs/dbraw/zinc/37/21/25/338372125.db2.gz MZYIZVURPLFPDV-UHFFFAOYSA-N 1 2 306.740 4.385 20 0 DIADLO FC(F)Oc1ccc(CSCc2cn3ccccc3[nH+]2)cc1 ZINC000439538737 338372646 /nfs/dbraw/zinc/37/26/46/338372646.db2.gz CMRHCPHPFZHTBU-UHFFFAOYSA-N 1 2 320.364 4.369 20 0 DIADLO CCC[C@@H]([NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)OCC ZINC000439545595 338372870 /nfs/dbraw/zinc/37/28/70/338372870.db2.gz HQLOANJXVFPRBP-SMDDNHRTSA-N 1 2 317.351 4.088 20 0 DIADLO c1c(CNc2ccc(Oc3ccccn3)cc2)[nH+]c2ccccn12 ZINC000439555302 338372982 /nfs/dbraw/zinc/37/29/82/338372982.db2.gz AIPDARRBZNKCTM-UHFFFAOYSA-N 1 2 316.364 4.134 20 0 DIADLO CCC[C@@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1)C(=O)OCC ZINC000439558002 338373019 /nfs/dbraw/zinc/37/30/19/338373019.db2.gz QIKKJMXXBVPJCH-SMDDNHRTSA-N 1 2 317.351 4.088 20 0 DIADLO FC(F)(F)c1nn(Cc2cccc(Cl)c2)c2cc[nH+]cc21 ZINC000439893008 338380378 /nfs/dbraw/zinc/38/03/78/338380378.db2.gz VAYGUNNZCMPABU-UHFFFAOYSA-N 1 2 311.694 4.152 20 0 DIADLO CC(C)c1ncc(C[N@H+](C)Cc2ccc(F)cc2Cl)cn1 ZINC000440456616 338387607 /nfs/dbraw/zinc/38/76/07/338387607.db2.gz CEUBSZRZHCEAIG-UHFFFAOYSA-N 1 2 307.800 4.025 20 0 DIADLO CC(C)c1ncc(C[N@@H+](C)Cc2ccc(F)cc2Cl)cn1 ZINC000440456616 338387608 /nfs/dbraw/zinc/38/76/08/338387608.db2.gz CEUBSZRZHCEAIG-UHFFFAOYSA-N 1 2 307.800 4.025 20 0 DIADLO CC(C)c1ncc(C[N@H+](C)Cc2ccc(Cl)cc2F)cn1 ZINC000440471523 338388004 /nfs/dbraw/zinc/38/80/04/338388004.db2.gz HWBAPRBRUNVPBE-UHFFFAOYSA-N 1 2 307.800 4.025 20 0 DIADLO CC(C)c1ncc(C[N@@H+](C)Cc2ccc(Cl)cc2F)cn1 ZINC000440471523 338388005 /nfs/dbraw/zinc/38/80/05/338388005.db2.gz HWBAPRBRUNVPBE-UHFFFAOYSA-N 1 2 307.800 4.025 20 0 DIADLO CC(C)c1ncc(C[N@H+](C)Cc2cc(Cl)ccc2F)cn1 ZINC000440477123 338388034 /nfs/dbraw/zinc/38/80/34/338388034.db2.gz KINLCGFCEBHJTN-UHFFFAOYSA-N 1 2 307.800 4.025 20 0 DIADLO CC(C)c1ncc(C[N@@H+](C)Cc2cc(Cl)ccc2F)cn1 ZINC000440477123 338388035 /nfs/dbraw/zinc/38/80/35/338388035.db2.gz KINLCGFCEBHJTN-UHFFFAOYSA-N 1 2 307.800 4.025 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(F)(F)F)n[nH]1)c1c(F)cccc1Cl ZINC000440624908 338392893 /nfs/dbraw/zinc/39/28/93/338392893.db2.gz BLVLCDGNHSDZRN-ZETCQYMHSA-N 1 2 321.705 4.072 20 0 DIADLO COCC[C@H](Nc1cc[nH+]c2c(OC)cccc12)c1ccco1 ZINC000440634413 338393495 /nfs/dbraw/zinc/39/34/95/338393495.db2.gz GKPNWOFWNSJABK-HNNXBMFYSA-N 1 2 312.369 4.026 20 0 DIADLO COc1cccc2c(N[C@H]3CCCC[C@H]3n3cccn3)cc[nH+]c12 ZINC000440661883 338394684 /nfs/dbraw/zinc/39/46/84/338394684.db2.gz RBUADLSPTFTLCR-DLBZAZTESA-N 1 2 322.412 4.036 20 0 DIADLO COc1cccc([C@@H](C)Nc2cc[nH+]c3c(OC)cccc23)c1 ZINC000440664096 338394757 /nfs/dbraw/zinc/39/47/57/338394757.db2.gz OWTQIZYIRNULNZ-CYBMUJFWSA-N 1 2 308.381 4.425 20 0 DIADLO CCc1nc(C(C)(C)[NH2+]Cc2c(C)ccc3ccccc32)no1 ZINC000441281210 338407570 /nfs/dbraw/zinc/40/75/70/338407570.db2.gz SZDYHNWRFXBYAJ-UHFFFAOYSA-N 1 2 309.413 4.119 20 0 DIADLO Cc1ccc2[nH+]c(CNc3cc(Cl)cc(F)c3F)cn2c1 ZINC000442093401 338421288 /nfs/dbraw/zinc/42/12/88/338421288.db2.gz YNBJGVUPMHFWEW-UHFFFAOYSA-N 1 2 307.731 4.186 20 0 DIADLO Fc1cc(NC2CCC(C(F)F)CC2)ccc1-n1cc[nH+]c1 ZINC000442871178 338436634 /nfs/dbraw/zinc/43/66/34/338436634.db2.gz HKEXALGXKDATGA-UHFFFAOYSA-N 1 2 309.335 4.247 20 0 DIADLO c1cn(Cc2ccccc2)c(CNc2ccc3ccoc3c2)[nH+]1 ZINC000442877588 338437580 /nfs/dbraw/zinc/43/75/80/338437580.db2.gz WXUXJGVUUSCQEH-UHFFFAOYSA-N 1 2 303.365 4.290 20 0 DIADLO COc1cc(C2(C(=O)Nc3ccc(C)[nH+]c3C)CCC2)ccc1C ZINC000446427406 338527836 /nfs/dbraw/zinc/52/78/36/338527836.db2.gz DYPSFOQMPDRWAF-UHFFFAOYSA-N 1 2 324.424 4.076 20 0 DIADLO Cc1ccc(NC(=O)N[C@H]2CCC[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC000447168456 338546717 /nfs/dbraw/zinc/54/67/17/338546717.db2.gz SKYVAWOOANIKLW-AEFFLSMTSA-N 1 2 309.413 4.156 20 0 DIADLO Cc1ccc(NC(=O)NC2(c3ccccc3)CCCC2)c(C)[nH+]1 ZINC000447170323 338546725 /nfs/dbraw/zinc/54/67/25/338546725.db2.gz ZMXHYLGFJSQRNX-UHFFFAOYSA-N 1 2 309.413 4.289 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+][C@H]2COc3ccc(Cl)cc32)s1 ZINC000447898810 338570978 /nfs/dbraw/zinc/57/09/78/338570978.db2.gz YZBKZKCFLUIOHS-LBPRGKRZSA-N 1 2 322.861 4.317 20 0 DIADLO Cc1ccc2[nH]c(CN3CC(C)(C)[C@@H]3c3[nH+]ccn3C)cc2c1C ZINC000449415873 338622548 /nfs/dbraw/zinc/62/25/48/338622548.db2.gz QWYBPJDQSGPJKX-SFHVURJKSA-N 1 2 322.456 4.101 20 0 DIADLO CCc1ncc(C[NH2+]Cc2ccc(-c3ccccc3)cc2OC)o1 ZINC000449611651 338640931 /nfs/dbraw/zinc/64/09/31/338640931.db2.gz XEXJTDAXFVSIJM-UHFFFAOYSA-N 1 2 322.408 4.202 20 0 DIADLO Cc1nc(C[NH+]2CC(c3cccc(C(F)(F)F)c3)C2)cs1 ZINC000449670765 338645274 /nfs/dbraw/zinc/64/52/74/338645274.db2.gz YISUMUCQZXYAJN-UHFFFAOYSA-N 1 2 312.360 4.070 20 0 DIADLO Fc1cc2[nH+]ccc(N3CCC4(C3)CCOCC4)c2cc1Cl ZINC000450360956 338679916 /nfs/dbraw/zinc/67/99/16/338679916.db2.gz CSHQCJHXAMWUQZ-UHFFFAOYSA-N 1 2 320.795 4.034 20 0 DIADLO COc1cccc2c1cc[nH+]c2N[C@H]1CCOC2(CCCC2)C1 ZINC000450386160 338681218 /nfs/dbraw/zinc/68/12/18/338681218.db2.gz DFMZEDZOMCUEKJ-AWEZNQCLSA-N 1 2 312.413 4.147 20 0 DIADLO FC(F)(F)c1ccc2c(cc[nH+]c2NCC[C@@H]2CCOC2)c1 ZINC000450442234 338684482 /nfs/dbraw/zinc/68/44/82/338684482.db2.gz SCYSIOXOZDLMTK-LLVKDONJSA-N 1 2 310.319 4.092 20 0 DIADLO CC(C)c1nc(N2[C@H](C)[C@@H](CC(F)(F)F)C[C@@H]2C)cc[nH+]1 ZINC000450565958 338691226 /nfs/dbraw/zinc/69/12/26/338691226.db2.gz KVEVJRXETVBTNH-QJPTWQEYSA-N 1 2 301.356 4.156 20 0 DIADLO CC[C@H]([NH2+]Cc1cccc(C)n1)c1nc(C(F)(F)F)cs1 ZINC000450723360 338701280 /nfs/dbraw/zinc/70/12/80/338701280.db2.gz COTODFDMYZCVGA-NSHDSACASA-N 1 2 315.364 4.106 20 0 DIADLO COc1ccc2oc([C@@H](C)[NH2+][C@H](C)c3csnn3)c(C)c2c1 ZINC000450729062 338701937 /nfs/dbraw/zinc/70/19/37/338701937.db2.gz NQAONRVFQZSEKW-GHMZBOCLSA-N 1 2 317.414 4.013 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2ccn(CCc3ccccc3)n2)c(C)o1 ZINC000450731564 338702217 /nfs/dbraw/zinc/70/22/17/338702217.db2.gz ZDJRPHIKMIFAEM-MRXNPFEDSA-N 1 2 323.440 4.186 20 0 DIADLO Fc1ccc2cc[nH+]c(N[C@@H]3CCO[C@@H](c4ccncc4)C3)c2c1 ZINC000450794015 338705940 /nfs/dbraw/zinc/70/59/40/338705940.db2.gz LWXYGBQSTSISJX-SJLPKXTDSA-N 1 2 323.371 4.101 20 0 DIADLO C[C@@H]1C[C@H](Nc2ncc(C(F)(F)F)cc2Cl)c2[nH+]ccn21 ZINC000450832154 338707616 /nfs/dbraw/zinc/70/76/16/338707616.db2.gz QRUQHWUULHGSHF-XCBNKYQSSA-N 1 2 316.714 4.068 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)oc1C ZINC000451354038 338730881 /nfs/dbraw/zinc/73/08/81/338730881.db2.gz MCOBLVLJCIZASW-INIZCTEOSA-N 1 2 308.784 4.325 20 0 DIADLO CCc1nnc([C@H](C)[NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)o1 ZINC000451360479 338731283 /nfs/dbraw/zinc/73/12/83/338731283.db2.gz YKKMPISIZLVOLH-VFZGTOFNSA-N 1 2 323.799 4.226 20 0 DIADLO CN(C)c1[nH+]ccc2cc(NC(=O)c3ccoc3C3CC3)ccc21 ZINC000452351434 338764334 /nfs/dbraw/zinc/76/43/34/338764334.db2.gz FPDXJCKBROSKDP-UHFFFAOYSA-N 1 2 321.380 4.024 20 0 DIADLO Cc1ccc([C@H]([NH2+][C@@H]2CCn3ccnc32)c2ccccc2)cc1 ZINC000453054612 338788112 /nfs/dbraw/zinc/78/81/12/338788112.db2.gz HTISBGQFVHAMAP-RTBURBONSA-N 1 2 303.409 4.016 20 0 DIADLO C[C@@H]1C[C@H]([NH2+]C2c3ccccc3-c3ccccc32)c2nccn21 ZINC000453075330 338790760 /nfs/dbraw/zinc/79/07/60/338790760.db2.gz HLWYHBBXPVCUMB-ACJLOTCBSA-N 1 2 301.393 4.249 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1CNc1cnn(-c2ccccc2)c1 ZINC000453111104 338795075 /nfs/dbraw/zinc/79/50/75/338795075.db2.gz DTKYMRWCSCRONP-UHFFFAOYSA-N 1 2 306.413 4.311 20 0 DIADLO CC(C)[C@@H]1C[C@H]([NH2+]Cc2nn(C)cc2Cl)c2ccccc21 ZINC000453309901 338822297 /nfs/dbraw/zinc/82/22/97/338822297.db2.gz FARCKCWSCTZDPB-HOCLYGCPSA-N 1 2 303.837 4.048 20 0 DIADLO Cn1cc(Cl)c(C[NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)n1 ZINC000453315619 338823279 /nfs/dbraw/zinc/82/32/79/338823279.db2.gz JLLJNBKKAOVDOP-HNNXBMFYSA-N 1 2 324.255 4.358 20 0 DIADLO C[C@@H]([NH2+]Cc1cnc(C2CC2)o1)c1ccccc1Br ZINC000453352006 338829597 /nfs/dbraw/zinc/82/95/97/338829597.db2.gz KMRMCMTUZIVFKR-SNVBAGLBSA-N 1 2 321.218 4.165 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1cnc(CC)o1 ZINC000453378576 338834607 /nfs/dbraw/zinc/83/46/07/338834607.db2.gz KHKIYKNCWMFWMB-NSHDSACASA-N 1 2 308.809 4.140 20 0 DIADLO CCc1ccc(CC)c(NC(=O)NCc2c[nH+]c(C)cc2C)c1 ZINC000454890786 338874855 /nfs/dbraw/zinc/87/48/55/338874855.db2.gz NIJZAASGUXVRHK-UHFFFAOYSA-N 1 2 311.429 4.145 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2c(Cl)ccc(C)c2C)c[nH+]1 ZINC000455262960 338887866 /nfs/dbraw/zinc/88/78/66/338887866.db2.gz AFCHXGGOXYXAPY-UHFFFAOYSA-N 1 2 317.820 4.290 20 0 DIADLO CCS[C@H]1CCCCN(C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000455460027 338895179 /nfs/dbraw/zinc/89/51/79/338895179.db2.gz AGLGSLQTMILOHN-HNNXBMFYSA-N 1 2 321.490 4.146 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@]3(CC=CCC3)C2)c(C)[nH+]1 ZINC000455479697 338895838 /nfs/dbraw/zinc/89/58/38/338895838.db2.gz NOVIGRZCIJNPIV-LJQANCHMSA-N 1 2 313.445 4.361 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@H]2CC(C)(C)C)c(C)[nH+]1 ZINC000455491235 338896470 /nfs/dbraw/zinc/89/64/70/338896470.db2.gz YGCYOLJAAHVKNW-HNNXBMFYSA-N 1 2 303.450 4.439 20 0 DIADLO CCS[C@@H]1CC[C@H](N(C)C(=O)Nc2c(C)cc(C)[nH+]c2C)C1 ZINC000455508415 338897123 /nfs/dbraw/zinc/89/71/23/338897123.db2.gz ZTSRTLATPQRLKW-LSDHHAIUSA-N 1 2 321.490 4.145 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H](c3ccccc3)C2)c(C)[nH+]1 ZINC000455509462 338897149 /nfs/dbraw/zinc/89/71/49/338897149.db2.gz GMHHRLDHECUZKO-GOSISDBHSA-N 1 2 323.440 4.418 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C1(C2CCC2)CCC1 ZINC000456008902 338916439 /nfs/dbraw/zinc/91/64/39/338916439.db2.gz ABWCHZWQYHRIIN-UHFFFAOYSA-N 1 2 309.413 4.294 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C1=CCC(C)(C)CC1 ZINC000456044624 338917689 /nfs/dbraw/zinc/91/76/89/338917689.db2.gz VXYMJOKXXCXDRT-UHFFFAOYSA-N 1 2 309.413 4.460 20 0 DIADLO CN(C(=O)C1=CCC(C)(C)CC1)[C@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000456055426 338918232 /nfs/dbraw/zinc/91/82/32/338918232.db2.gz DKOPKHIPMCRFKZ-KRWDZBQOSA-N 1 2 323.440 4.094 20 0 DIADLO CC(C)c1nc(NCc2cccc(-c3ccccn3)c2)cc[nH+]1 ZINC000164252606 338920946 /nfs/dbraw/zinc/92/09/46/338920946.db2.gz HFABZBHDBBGXSF-UHFFFAOYSA-N 1 2 304.397 4.274 20 0 DIADLO CCn1cc[nH+]c1[C@H](C)NC(=O)c1ccc(C(C)C)c(Cl)c1 ZINC000456370739 338927941 /nfs/dbraw/zinc/92/79/41/338927941.db2.gz YGPJBWDGDNPYAH-LBPRGKRZSA-N 1 2 319.836 4.171 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1)C1CCC1 ZINC000457461720 338964679 /nfs/dbraw/zinc/96/46/79/338964679.db2.gz SABPLQTYYDPWCD-CQSZACIVSA-N 1 2 323.440 4.261 20 0 DIADLO CCCCCN(C(=O)N[C@@H]1C[C@@H](C)n2cc[nH+]c21)[C@@H](C)CCC ZINC000459106222 339013794 /nfs/dbraw/zinc/01/37/94/339013794.db2.gz IVDXNBZQIWYTRM-ARFHVFGLSA-N 1 2 320.481 4.279 20 0 DIADLO CCC[C@H](NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1)C1CCCC1 ZINC000459280688 339018951 /nfs/dbraw/zinc/01/89/51/339018951.db2.gz KVTJYOYCUFHTPX-JKSUJKDBSA-N 1 2 318.465 4.005 20 0 DIADLO COCc1cc(C[N@H+](C)[C@@H](c2ccccc2Cl)C(C)C)no1 ZINC000459345060 339023087 /nfs/dbraw/zinc/02/30/87/339023087.db2.gz JDOSSNZCLMPJFM-QGZVFWFLSA-N 1 2 322.836 4.304 20 0 DIADLO COCc1cc(C[N@@H+](C)[C@@H](c2ccccc2Cl)C(C)C)no1 ZINC000459345060 339023088 /nfs/dbraw/zinc/02/30/88/339023088.db2.gz JDOSSNZCLMPJFM-QGZVFWFLSA-N 1 2 322.836 4.304 20 0 DIADLO COCc1cc(C[NH2+][C@@H](c2ccccc2)c2ccc(C)cc2)no1 ZINC000459376572 339025603 /nfs/dbraw/zinc/02/56/03/339025603.db2.gz WORZLASJPXBTPQ-FQEVSTJZSA-N 1 2 322.408 4.009 20 0 DIADLO Cc1cc(C[NH2+][C@@H]2CCOc3c(-c4ccccc4)cccc32)no1 ZINC000459406956 339027338 /nfs/dbraw/zinc/02/73/38/339027338.db2.gz DEQSFSVCJGBEJK-LJQANCHMSA-N 1 2 320.392 4.263 20 0 DIADLO Cc1ccc(NC(=O)N(C)[C@@H]2CCC[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC000459433251 339028997 /nfs/dbraw/zinc/02/89/97/339028997.db2.gz LLYONBATGUXKJX-IEBWSBKVSA-N 1 2 323.440 4.498 20 0 DIADLO Cc1cc(C)c(NC(=O)N2Cc3ccc(Cl)cc3C2)c(C)[nH+]1 ZINC000459577558 339036913 /nfs/dbraw/zinc/03/69/13/339036913.db2.gz HLEXIFDNDGTKFZ-UHFFFAOYSA-N 1 2 315.804 4.208 20 0 DIADLO C[C@H]([NH2+][C@H]1CCc2c1c(F)ccc2F)c1nc2c(s1)CCC2 ZINC000459630671 339039327 /nfs/dbraw/zinc/03/93/27/339039327.db2.gz IYLZKSORPTVTIK-XPTSAGLGSA-N 1 2 320.408 4.248 20 0 DIADLO COc1ccc(C[NH2+][C@@H](C)c2nc3c(s2)CCC3)c(Cl)c1 ZINC000459633537 339039382 /nfs/dbraw/zinc/03/93/82/339039382.db2.gz PBNKBBMYWLPFCT-JTQLQIEISA-N 1 2 322.861 4.145 20 0 DIADLO Cc1ccc(C[NH2+][C@H](CCc2ccccc2)C(F)F)nc1C ZINC000459682028 339042948 /nfs/dbraw/zinc/04/29/48/339042948.db2.gz YVYPSBCTDPKBHD-QGZVFWFLSA-N 1 2 304.384 4.055 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000459683443 339042997 /nfs/dbraw/zinc/04/29/97/339042997.db2.gz BZSADPPBGCCHIM-QWHCGFSZSA-N 1 2 317.433 4.096 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)o1 ZINC000459733202 339045030 /nfs/dbraw/zinc/04/50/30/339045030.db2.gz FBADTAQVWUCBRG-RHSMWYFYSA-N 1 2 311.429 4.446 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)o1 ZINC000459733202 339045031 /nfs/dbraw/zinc/04/50/31/339045031.db2.gz FBADTAQVWUCBRG-RHSMWYFYSA-N 1 2 311.429 4.446 20 0 DIADLO CCc1nnc(C[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)o1 ZINC000459736725 339045304 /nfs/dbraw/zinc/04/53/04/339045304.db2.gz HGIFRXNIWDJHSR-SFHVURJKSA-N 1 2 311.429 4.139 20 0 DIADLO CCc1nnc(C[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)o1 ZINC000459736725 339045305 /nfs/dbraw/zinc/04/53/05/339045305.db2.gz HGIFRXNIWDJHSR-SFHVURJKSA-N 1 2 311.429 4.139 20 0 DIADLO Cc1cccc2c1CC[C@@H]2[NH2+]Cc1ncc(-c2ccccc2)cn1 ZINC000461080835 339058768 /nfs/dbraw/zinc/05/87/68/339058768.db2.gz DSOIXIBKCSUMJP-FQEVSTJZSA-N 1 2 315.420 4.229 20 0 DIADLO Brc1ccc([C@H]2C[C@H](Nc3cccc[nH+]3)C2)cc1 ZINC000461892669 339067987 /nfs/dbraw/zinc/06/79/87/339067987.db2.gz XVUBGFBAVZXMKC-MQMHXKEQSA-N 1 2 303.203 4.202 20 0 DIADLO CCC[C@@H]1C[C@H]1C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000462327927 339075952 /nfs/dbraw/zinc/07/59/52/339075952.db2.gz ZKXBYTIPOGJZLI-RDTXWAMCSA-N 1 2 323.440 4.261 20 0 DIADLO CCN(c1cc[nH+]c(C)n1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000462806067 339090373 /nfs/dbraw/zinc/09/03/73/339090373.db2.gz OTTADRFPSIFAQC-LLVKDONJSA-N 1 2 309.335 4.391 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1ccc(Cl)s1)C2 ZINC000462828115 339092667 /nfs/dbraw/zinc/09/26/67/339092667.db2.gz LTFOCTMDCXZRAS-UHFFFAOYSA-N 1 2 305.830 4.155 20 0 DIADLO Oc1ccc2c(c1)C1(CC1)C[N@H+](Cc1ccc(Cl)s1)C2 ZINC000462828115 339092668 /nfs/dbraw/zinc/09/26/68/339092668.db2.gz LTFOCTMDCXZRAS-UHFFFAOYSA-N 1 2 305.830 4.155 20 0 DIADLO c1ccc(N2CCC(Nc3cccc(C4CCC4)c3)CC2)[nH+]c1 ZINC000462860362 339094672 /nfs/dbraw/zinc/09/46/72/339094672.db2.gz OVUFGOBFFPIIBM-UHFFFAOYSA-N 1 2 307.441 4.430 20 0 DIADLO Clc1cccc(C2CC[NH+](Cc3cc[nH]n3)CC2)c1Cl ZINC000463011647 339100350 /nfs/dbraw/zinc/10/03/50/339100350.db2.gz PKDCAHMTGUOGBR-UHFFFAOYSA-N 1 2 310.228 4.096 20 0 DIADLO CC(C)C[C@H](C)CC(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000463031246 339101897 /nfs/dbraw/zinc/10/18/97/339101897.db2.gz FJWSIRFZMVBFAS-HOTGVXAUSA-N 1 2 322.518 4.026 20 0 DIADLO Cc1[nH+]cn(-c2ccc(N[C@H]3CCO[C@@H](C(C)C)C3)cc2)c1C ZINC000463035389 339102065 /nfs/dbraw/zinc/10/20/65/339102065.db2.gz HIRMYIVFAFJVCI-PKOBYXMFSA-N 1 2 313.445 4.105 20 0 DIADLO CCC[C@@H]1C[C@H]1c1nc(Cn2c3ccccc3[nH+]c2C(C)C)no1 ZINC000463040041 339102444 /nfs/dbraw/zinc/10/24/44/339102444.db2.gz BHLWHCOYSJKFMM-ZIAGYGMSSA-N 1 2 324.428 4.495 20 0 DIADLO CC(C)c1ccc(CC2CC[NH+](Cc3csnn3)CC2)cc1 ZINC000463054642 339103256 /nfs/dbraw/zinc/10/32/56/339103256.db2.gz MGRWFTDFKLBICD-UHFFFAOYSA-N 1 2 315.486 4.116 20 0 DIADLO CC(C)[C@@H](C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000463339738 339115153 /nfs/dbraw/zinc/11/51/53/339115153.db2.gz YDXXGNCOQCMNLV-LJQANCHMSA-N 1 2 319.408 4.251 20 0 DIADLO CC(C)[C@H](C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000463339737 339115180 /nfs/dbraw/zinc/11/51/80/339115180.db2.gz YDXXGNCOQCMNLV-IBGZPJMESA-N 1 2 319.408 4.251 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463416986 339117155 /nfs/dbraw/zinc/11/71/55/339117155.db2.gz UVGYYUMXNCZAPU-GFCCVEGCSA-N 1 2 315.363 4.279 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463416986 339117156 /nfs/dbraw/zinc/11/71/56/339117156.db2.gz UVGYYUMXNCZAPU-GFCCVEGCSA-N 1 2 315.363 4.279 20 0 DIADLO CC(C)[C@@H](C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccccc1 ZINC000463489617 339119440 /nfs/dbraw/zinc/11/94/40/339119440.db2.gz JPMBRWJLDXUKCL-GOSISDBHSA-N 1 2 319.408 4.455 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2nnc(-c3ccccc3)s2)c1 ZINC000464103950 339134600 /nfs/dbraw/zinc/13/46/00/339134600.db2.gz IZKUKWOKAFWIBU-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2nnc(-c3ccccc3)s2)c1 ZINC000464103950 339134601 /nfs/dbraw/zinc/13/46/01/339134601.db2.gz IZKUKWOKAFWIBU-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO CCC(CC)C(=O)N(Cc1[nH]cc[nH+]1)c1cc(C)ccc1Cl ZINC000464500044 339143712 /nfs/dbraw/zinc/14/37/12/339143712.db2.gz OYLOHVORIXKNOO-UHFFFAOYSA-N 1 2 319.836 4.341 20 0 DIADLO C[C@H](NC(=O)C[C@H](C)C(C)(C)C)c1cccc(-n2cc[nH+]c2)c1 ZINC000464514629 339143948 /nfs/dbraw/zinc/14/39/48/339143948.db2.gz GUIFOHVIUAONJX-GJZGRUSLSA-N 1 2 313.445 4.122 20 0 DIADLO C[C@H](CC(=O)N[C@@H](C)c1cccc(-n2cc[nH+]c2)c1)C(C)(C)C ZINC000464514628 339143973 /nfs/dbraw/zinc/14/39/73/339143973.db2.gz GUIFOHVIUAONJX-CABCVRRESA-N 1 2 313.445 4.122 20 0 DIADLO CCC1(CC)C[N@H+](Cc2nc(C(F)(F)F)cs2)CCS1 ZINC000464583127 339146029 /nfs/dbraw/zinc/14/60/29/339146029.db2.gz ZFFLDECKHRXULT-UHFFFAOYSA-N 1 2 324.437 4.270 20 0 DIADLO CCC1(CC)C[N@@H+](Cc2nc(C(F)(F)F)cs2)CCS1 ZINC000464583127 339146030 /nfs/dbraw/zinc/14/60/30/339146030.db2.gz ZFFLDECKHRXULT-UHFFFAOYSA-N 1 2 324.437 4.270 20 0 DIADLO CCCCc1noc(C[N@@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)n1 ZINC000464725505 339150031 /nfs/dbraw/zinc/15/00/31/339150031.db2.gz OCBBKMDBJZDCBU-CZUORRHYSA-N 1 2 317.408 4.134 20 0 DIADLO CCCCc1noc(C[N@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)n1 ZINC000464725505 339150032 /nfs/dbraw/zinc/15/00/32/339150032.db2.gz OCBBKMDBJZDCBU-CZUORRHYSA-N 1 2 317.408 4.134 20 0 DIADLO CCCc1nc(C[N@@H+]2CCCC[C@H]2c2cccc(C)c2C)no1 ZINC000464770266 339152075 /nfs/dbraw/zinc/15/20/75/339152075.db2.gz DPKQOBJNEGVZLC-KRWDZBQOSA-N 1 2 313.445 4.366 20 0 DIADLO CCCc1nc(C[N@H+]2CCCC[C@H]2c2cccc(C)c2C)no1 ZINC000464770266 339152076 /nfs/dbraw/zinc/15/20/76/339152076.db2.gz DPKQOBJNEGVZLC-KRWDZBQOSA-N 1 2 313.445 4.366 20 0 DIADLO CCCCc1noc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccc(C)o2)n1 ZINC000464834819 339156134 /nfs/dbraw/zinc/15/61/34/339156134.db2.gz HHXWEEBAWIUZLR-DZGCQCFKSA-N 1 2 317.433 4.287 20 0 DIADLO CCCCc1noc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccc(C)o2)n1 ZINC000464834819 339156135 /nfs/dbraw/zinc/15/61/35/339156135.db2.gz HHXWEEBAWIUZLR-DZGCQCFKSA-N 1 2 317.433 4.287 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1nc2cc(F)ccc2o1 ZINC000464864867 339158994 /nfs/dbraw/zinc/15/89/94/339158994.db2.gz BIEYKJYQFGPEET-SNVBAGLBSA-N 1 2 302.374 4.148 20 0 DIADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1nc2cc(F)ccc2o1 ZINC000464864867 339158995 /nfs/dbraw/zinc/15/89/95/339158995.db2.gz BIEYKJYQFGPEET-SNVBAGLBSA-N 1 2 302.374 4.148 20 0 DIADLO CCc1ccc(-c2ccc(C[NH2+][C@H](C)c3nc(C)no3)o2)cc1 ZINC000465000366 339165088 /nfs/dbraw/zinc/16/50/88/339165088.db2.gz BNLBNGRNUSSMCZ-GFCCVEGCSA-N 1 2 311.385 4.051 20 0 DIADLO CC(C)CC1(CNC(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000465079978 339167699 /nfs/dbraw/zinc/16/76/99/339167699.db2.gz YUBJZNKIJGSGCR-UHFFFAOYSA-N 1 2 324.424 4.430 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+][C@H](C)c3ccc(F)cc3F)nc2c1 ZINC000465404833 339175394 /nfs/dbraw/zinc/17/53/94/339175394.db2.gz HNXPSVFZAHMXGE-LLVKDONJSA-N 1 2 301.340 4.000 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@H](C)c3ccc(F)cc3F)[nH]c2c1 ZINC000465404833 339175395 /nfs/dbraw/zinc/17/53/95/339175395.db2.gz HNXPSVFZAHMXGE-LLVKDONJSA-N 1 2 301.340 4.000 20 0 DIADLO COc1cc(C)nc(CNc2[nH+]cccc2-c2ccccc2)c1 ZINC000466616644 339210534 /nfs/dbraw/zinc/21/05/34/339210534.db2.gz NMSLSEUPJGALAV-UHFFFAOYSA-N 1 2 305.381 4.073 20 0 DIADLO Cc1ccn2c(CNc3ccc(-c4ccccc4)cn3)c[nH+]c2c1 ZINC000466616657 339210539 /nfs/dbraw/zinc/21/05/39/339210539.db2.gz FAFFNTUQWJVQEL-UHFFFAOYSA-N 1 2 314.392 4.317 20 0 DIADLO COc1ccc(CNc2[nH+]cccc2-c2ccccc2)c(OC)c1 ZINC000466620910 339210689 /nfs/dbraw/zinc/21/06/89/339210689.db2.gz VKLBQCRHIJVDHW-UHFFFAOYSA-N 1 2 320.392 4.378 20 0 DIADLO c1csc(CNc2cccc(-c3ccc4c(c3)OCCO4)[nH+]2)c1 ZINC000466618711 339210720 /nfs/dbraw/zinc/21/07/20/339210720.db2.gz HCLCFAFHTGJCNI-UHFFFAOYSA-N 1 2 324.405 4.193 20 0 DIADLO COCC[C@H]1CCCCN(c2cc(C(C)C)[nH+]c(C(C)C)n2)C1 ZINC000466625031 339210750 /nfs/dbraw/zinc/21/07/50/339210750.db2.gz DCPCECIULZMOOJ-MRXNPFEDSA-N 1 2 319.493 4.366 20 0 DIADLO Fc1ccc(C[N@@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC000467175097 339227332 /nfs/dbraw/zinc/22/73/32/339227332.db2.gz HZLWEYUSBZAUKW-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO Fc1ccc(C[N@H+]2CCO[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC000467175097 339227333 /nfs/dbraw/zinc/22/73/33/339227333.db2.gz HZLWEYUSBZAUKW-QGZVFWFLSA-N 1 2 305.780 4.053 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@@H+](C[C@@H]2CCC3(CCCCC3)O2)C1 ZINC000467189603 339227597 /nfs/dbraw/zinc/22/75/97/339227597.db2.gz BHFSNENVCPZMRV-INIZCTEOSA-N 1 2 324.468 4.408 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@H+](C[C@@H]2CCC3(CCCCC3)O2)C1 ZINC000467189603 339227598 /nfs/dbraw/zinc/22/75/98/339227598.db2.gz BHFSNENVCPZMRV-INIZCTEOSA-N 1 2 324.468 4.408 20 0 DIADLO Cc1[nH]c2ccc(COc3c(F)c(F)cc(F)c3F)cc2[nH+]1 ZINC000467206295 339228127 /nfs/dbraw/zinc/22/81/27/339228127.db2.gz JWLXRFSKNNAVAO-UHFFFAOYSA-N 1 2 310.250 4.007 20 0 DIADLO Cc1[nH]c2cc(COc3c(F)c(F)cc(F)c3F)ccc2[nH+]1 ZINC000467206295 339228128 /nfs/dbraw/zinc/22/81/28/339228128.db2.gz JWLXRFSKNNAVAO-UHFFFAOYSA-N 1 2 310.250 4.007 20 0 DIADLO Cc1ccc[nH+]c1[C@H]1CCC[C@@H](Nc2cccc3c2CCO3)C1 ZINC000467374896 339235183 /nfs/dbraw/zinc/23/51/83/339235183.db2.gz BYKDTZRILXICEH-JKSUJKDBSA-N 1 2 308.425 4.463 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2cccc(-c3ccc(C)cc3)c2)n1 ZINC000467399057 339236544 /nfs/dbraw/zinc/23/65/44/339236544.db2.gz CKFDYJTWDYLKKK-AWEZNQCLSA-N 1 2 307.397 4.204 20 0 DIADLO Fc1cccc2c3c([nH]c21)C[N@@H+](Cc1cccs1)CCC3 ZINC000467546640 339241924 /nfs/dbraw/zinc/24/19/24/339241924.db2.gz BFWZGUXQLDGBRU-UHFFFAOYSA-N 1 2 300.402 4.317 20 0 DIADLO Fc1cccc2c3c([nH]c21)C[N@H+](Cc1cccs1)CCC3 ZINC000467546640 339241925 /nfs/dbraw/zinc/24/19/25/339241925.db2.gz BFWZGUXQLDGBRU-UHFFFAOYSA-N 1 2 300.402 4.317 20 0 DIADLO CC(C)=CC[N@@H+](Cc1ccn(C)n1)Cc1ccc(Cl)cc1 ZINC000467553622 339242249 /nfs/dbraw/zinc/24/22/49/339242249.db2.gz KSSPWLAMITXVAR-UHFFFAOYSA-N 1 2 303.837 4.042 20 0 DIADLO CC(C)=CC[N@H+](Cc1ccn(C)n1)Cc1ccc(Cl)cc1 ZINC000467553622 339242250 /nfs/dbraw/zinc/24/22/50/339242250.db2.gz KSSPWLAMITXVAR-UHFFFAOYSA-N 1 2 303.837 4.042 20 0 DIADLO CC(C)(C)c1nc(COc2cccc(-n3cc[nH+]c3)c2)cs1 ZINC000467790629 339246801 /nfs/dbraw/zinc/24/68/01/339246801.db2.gz XFVCEJUNHQDLKS-UHFFFAOYSA-N 1 2 313.426 4.205 20 0 DIADLO C[C@@H]([NH2+][C@@H]1COc2ccc(F)cc21)c1ccc(F)cc1Cl ZINC000468030025 339251718 /nfs/dbraw/zinc/25/17/18/339251718.db2.gz IJCNXCNFGNBYDL-RFAUZJTJSA-N 1 2 309.743 4.403 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000468402490 339262045 /nfs/dbraw/zinc/26/20/45/339262045.db2.gz JXUPPFKOIKENEX-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000468402490 339262046 /nfs/dbraw/zinc/26/20/46/339262046.db2.gz JXUPPFKOIKENEX-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000468408895 339262171 /nfs/dbraw/zinc/26/21/71/339262171.db2.gz QIWGTYCOBMMZKE-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000468408895 339262172 /nfs/dbraw/zinc/26/21/72/339262172.db2.gz QIWGTYCOBMMZKE-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO CC1(C)C(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)C1(C)C ZINC000468807219 339271418 /nfs/dbraw/zinc/27/14/18/339271418.db2.gz DCSJWUTVOFCNDV-UHFFFAOYSA-N 1 2 310.397 4.495 20 0 DIADLO Cc1ccc2[nH]c(C[NH2+][C@@H](C)c3csc(Cl)c3)nc2c1 ZINC000468924681 339274967 /nfs/dbraw/zinc/27/49/67/339274967.db2.gz MIRUJNIZACRRJM-JTQLQIEISA-N 1 2 305.834 4.437 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@@H](C)c3csc(Cl)c3)[nH]c2c1 ZINC000468924681 339274968 /nfs/dbraw/zinc/27/49/68/339274968.db2.gz MIRUJNIZACRRJM-JTQLQIEISA-N 1 2 305.834 4.437 20 0 DIADLO CCOc1cc(Cl)ccc1NCc1cn2c(cccc2C)[nH+]1 ZINC000468977007 339276613 /nfs/dbraw/zinc/27/66/13/339276613.db2.gz KPVJLOLOCGGZSR-UHFFFAOYSA-N 1 2 315.804 4.307 20 0 DIADLO c1coc(CN(Cc2c[nH+]c3ccccn23)c2ccccc2)c1 ZINC000469340903 339286493 /nfs/dbraw/zinc/28/64/93/339286493.db2.gz ZJJVORYBPOSUSA-UHFFFAOYSA-N 1 2 303.365 4.134 20 0 DIADLO CC(C)[C@H]([NH2+]CCCCCOc1ccccc1)C(F)(F)F ZINC000470250813 339315269 /nfs/dbraw/zinc/31/52/69/339315269.db2.gz QUFSBUYGTCAQIJ-HNNXBMFYSA-N 1 2 303.368 4.412 20 0 DIADLO COc1ccc(C[C@@H](C)C[NH2+][C@@H](C(C)C)C(F)(F)F)cc1F ZINC000470257225 339315350 /nfs/dbraw/zinc/31/53/50/339315350.db2.gz YJHNZYSSQOUAGO-ABAIWWIYSA-N 1 2 321.358 4.189 20 0 DIADLO C[C@H](CCc1ccc(Cl)s1)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC000470328729 339317383 /nfs/dbraw/zinc/31/73/83/339317383.db2.gz RJMLRZFSFXSTFH-MNOVXSKESA-N 1 2 317.882 4.042 20 0 DIADLO Cc1ccc(NC(=O)N2CCC(CCC(C)C)CC2)c(C)[nH+]1 ZINC000470589714 339322864 /nfs/dbraw/zinc/32/28/64/339322864.db2.gz AIPUWEQAUQIPPD-UHFFFAOYSA-N 1 2 303.450 4.379 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](Cc3cccc(C(F)F)c3)CCO2)cc1 ZINC000470716589 339325866 /nfs/dbraw/zinc/32/58/66/339325866.db2.gz CVJDAOYPBKQJSL-KRWDZBQOSA-N 1 2 321.342 4.337 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](Cc3cccc(C(F)F)c3)CCO2)cc1 ZINC000470716589 339325867 /nfs/dbraw/zinc/32/58/67/339325867.db2.gz CVJDAOYPBKQJSL-KRWDZBQOSA-N 1 2 321.342 4.337 20 0 DIADLO Fc1cccc([C@@H]2C[N@H+](Cc3cccc(C(F)F)c3)CCO2)c1 ZINC000470772131 339327458 /nfs/dbraw/zinc/32/74/58/339327458.db2.gz JJKKRLYNCUAHKM-KRWDZBQOSA-N 1 2 321.342 4.337 20 0 DIADLO Fc1cccc([C@@H]2C[N@@H+](Cc3cccc(C(F)F)c3)CCO2)c1 ZINC000470772131 339327459 /nfs/dbraw/zinc/32/74/59/339327459.db2.gz JJKKRLYNCUAHKM-KRWDZBQOSA-N 1 2 321.342 4.337 20 0 DIADLO CCC1CCC(N(C)c2cc(C)[nH+]c(-c3ccncc3)n2)CC1 ZINC000470872986 339330008 /nfs/dbraw/zinc/33/00/08/339330008.db2.gz WLPCJMIUPBKXOI-UHFFFAOYSA-N 1 2 310.445 4.252 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000470944821 339332078 /nfs/dbraw/zinc/33/20/78/339332078.db2.gz LKNJGUCXMNWZAP-MWLCHTKSSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000470944821 339332079 /nfs/dbraw/zinc/33/20/79/339332079.db2.gz LKNJGUCXMNWZAP-MWLCHTKSSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ncc(Cl)cc1Cl ZINC000470940849 339331634 /nfs/dbraw/zinc/33/16/34/339331634.db2.gz QNSJJSNBPCMJJJ-VXNVDRBHSA-N 1 2 313.150 4.161 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ncc(Cl)cc1Cl ZINC000470940849 339331635 /nfs/dbraw/zinc/33/16/35/339331635.db2.gz QNSJJSNBPCMJJJ-VXNVDRBHSA-N 1 2 313.150 4.161 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1csc(-c2ccco2)n1 ZINC000470949671 339332482 /nfs/dbraw/zinc/33/24/82/339332482.db2.gz XIZCZXOKHORIHG-KOLCDFICSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1csc(-c2ccco2)n1 ZINC000470949671 339332483 /nfs/dbraw/zinc/33/24/83/339332483.db2.gz XIZCZXOKHORIHG-KOLCDFICSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1csc(-c2ccoc2)n1 ZINC000470954385 339332532 /nfs/dbraw/zinc/33/25/32/339332532.db2.gz YQNHZUYFSMYXEA-BXKDBHETSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1csc(-c2ccoc2)n1 ZINC000470954385 339332533 /nfs/dbraw/zinc/33/25/33/339332533.db2.gz YQNHZUYFSMYXEA-BXKDBHETSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ncc(-c2cccs2)o1 ZINC000470953249 339332700 /nfs/dbraw/zinc/33/27/00/339332700.db2.gz MQRHMPNFCZNKLU-UWVGGRQHSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ncc(-c2cccs2)o1 ZINC000470953249 339332701 /nfs/dbraw/zinc/33/27/01/339332701.db2.gz MQRHMPNFCZNKLU-UWVGGRQHSA-N 1 2 316.348 4.176 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000470954735 339332727 /nfs/dbraw/zinc/33/27/27/339332727.db2.gz BSSCNKOBXXPTHT-ZJUUUORDSA-N 1 2 306.397 4.213 20 0 DIADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1nc(C(C)(C)C)cs1 ZINC000470954735 339332728 /nfs/dbraw/zinc/33/27/28/339332728.db2.gz BSSCNKOBXXPTHT-ZJUUUORDSA-N 1 2 306.397 4.213 20 0 DIADLO Brc1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)s1 ZINC000471173727 339339435 /nfs/dbraw/zinc/33/94/35/339339435.db2.gz RFQAKKPMDUXJQD-ZDUSSCGKSA-N 1 2 308.244 4.458 20 0 DIADLO Brc1ccc(C[N@H+]2CC[C@H]2c2ccccc2)s1 ZINC000471173727 339339436 /nfs/dbraw/zinc/33/94/36/339339436.db2.gz RFQAKKPMDUXJQD-ZDUSSCGKSA-N 1 2 308.244 4.458 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000471174908 339339585 /nfs/dbraw/zinc/33/95/85/339339585.db2.gz AXLQGXDUXWYHRX-QGZVFWFLSA-N 1 2 309.388 4.142 20 0 DIADLO CCn1c2ccc(F)cc2nc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000471174908 339339586 /nfs/dbraw/zinc/33/95/86/339339586.db2.gz AXLQGXDUXWYHRX-QGZVFWFLSA-N 1 2 309.388 4.142 20 0 DIADLO Cc1ccc(NC(=O)C[N@@H+]2CC[C@@H]2c2ccccc2)c(Cl)c1 ZINC000471182903 339339721 /nfs/dbraw/zinc/33/97/21/339339721.db2.gz UXXQBZGFSPBLMC-QGZVFWFLSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1ccc(NC(=O)C[N@H+]2CC[C@@H]2c2ccccc2)c(Cl)c1 ZINC000471182903 339339722 /nfs/dbraw/zinc/33/97/22/339339722.db2.gz UXXQBZGFSPBLMC-QGZVFWFLSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000471181311 339339762 /nfs/dbraw/zinc/33/97/62/339339762.db2.gz LIONFBCLBSNWGD-QGZVFWFLSA-N 1 2 314.816 4.034 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000471181311 339339763 /nfs/dbraw/zinc/33/97/63/339339763.db2.gz LIONFBCLBSNWGD-QGZVFWFLSA-N 1 2 314.816 4.034 20 0 DIADLO CN(Cc1cccc(Cl)c1)c1cc(C(F)(F)F)cc[nH+]1 ZINC000471244662 339341019 /nfs/dbraw/zinc/34/10/19/339341019.db2.gz NUVLHYHZQQIWNS-UHFFFAOYSA-N 1 2 300.711 4.390 20 0 DIADLO Cc1cccc(C(=O)Nc2ccc3[nH+]c(N(C)C)ccc3c2)c1F ZINC000471344450 339343223 /nfs/dbraw/zinc/34/32/23/339343223.db2.gz AAFHBTYMBARFJR-UHFFFAOYSA-N 1 2 323.371 4.001 20 0 DIADLO Clc1cnccc1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000471699740 339351404 /nfs/dbraw/zinc/35/14/04/339351404.db2.gz CDCSFDSEKFUQIY-GOSISDBHSA-N 1 2 309.800 4.009 20 0 DIADLO CC(C)([NH2+]Cc1nc2ccccc2[nH]1)c1cccc(Cl)c1F ZINC000472136109 339363937 /nfs/dbraw/zinc/36/39/37/339363937.db2.gz HSXPLEJZQGFXDA-UHFFFAOYSA-N 1 2 317.795 4.380 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@@H+]2Cc2ccncc2Cl)cc1 ZINC000472230323 339366653 /nfs/dbraw/zinc/36/66/53/339366653.db2.gz GJXQSOBBURXAGH-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc([C@@H]2CSCC[N@H+]2Cc2ccncc2Cl)cc1 ZINC000472230323 339366654 /nfs/dbraw/zinc/36/66/54/339366654.db2.gz GJXQSOBBURXAGH-KRWDZBQOSA-N 1 2 318.873 4.334 20 0 DIADLO CCCc1nc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@@H](CC)C2)no1 ZINC000472252840 339367710 /nfs/dbraw/zinc/36/77/10/339367710.db2.gz XPTLSADJJWEFJB-DOTOQJQBSA-N 1 2 313.445 4.038 20 0 DIADLO CCCc1nc(C[N@H+]2CC[C@@H](c3ccccc3)[C@@H](CC)C2)no1 ZINC000472252840 339367711 /nfs/dbraw/zinc/36/77/11/339367711.db2.gz XPTLSADJJWEFJB-DOTOQJQBSA-N 1 2 313.445 4.038 20 0 DIADLO Cc1cc(OCC[N@H+](C)Cc2nccs2)ccc1C(C)C ZINC000472485199 339372671 /nfs/dbraw/zinc/37/26/71/339372671.db2.gz MFDQSBKUSGBBFH-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO Cc1cc(OCC[N@@H+](C)Cc2nccs2)ccc1C(C)C ZINC000472485199 339372672 /nfs/dbraw/zinc/37/26/72/339372672.db2.gz MFDQSBKUSGBBFH-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO C/C(=C/c1ccccc1)C[N@@H+]1CCSC[C@@H]1c1nccs1 ZINC000473069467 339380824 /nfs/dbraw/zinc/38/08/24/339380824.db2.gz BNHKAOWKWVIJEY-SYCZXOQXSA-N 1 2 316.495 4.337 20 0 DIADLO C/C(=C/c1ccccc1)C[N@H+]1CCSC[C@@H]1c1nccs1 ZINC000473069467 339380825 /nfs/dbraw/zinc/38/08/25/339380825.db2.gz BNHKAOWKWVIJEY-SYCZXOQXSA-N 1 2 316.495 4.337 20 0 DIADLO Cc1ccccc1C1CC[NH+](Cc2ncc(Cl)s2)CC1 ZINC000473129731 339381550 /nfs/dbraw/zinc/38/15/50/339381550.db2.gz VSCQMTUDLNZIMJ-UHFFFAOYSA-N 1 2 306.862 4.485 20 0 DIADLO Fc1ccc(C[C@@H]2CC[N@H+](Cc3ncc(Cl)s3)C2)cc1 ZINC000473134195 339381682 /nfs/dbraw/zinc/38/16/82/339381682.db2.gz WHDDNHYTXZBEMI-LBPRGKRZSA-N 1 2 310.825 4.000 20 0 DIADLO Fc1ccc(C[C@@H]2CC[N@@H+](Cc3ncc(Cl)s3)C2)cc1 ZINC000473134195 339381683 /nfs/dbraw/zinc/38/16/83/339381683.db2.gz WHDDNHYTXZBEMI-LBPRGKRZSA-N 1 2 310.825 4.000 20 0 DIADLO COc1cccc(C2CC[NH+](Cc3ncc(Cl)s3)CC2)c1 ZINC000473138952 339382062 /nfs/dbraw/zinc/38/20/62/339382062.db2.gz HFQDBVIJXUEVHY-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO CCn1nc(C[N@H+]([C@H](C)c2ccco2)C2CC2)c2ccccc21 ZINC000473151784 339383023 /nfs/dbraw/zinc/38/30/23/339383023.db2.gz VJBOQDUNJFRBPA-CQSZACIVSA-N 1 2 309.413 4.375 20 0 DIADLO CCn1nc(C[N@@H+]([C@H](C)c2ccco2)C2CC2)c2ccccc21 ZINC000473151784 339383024 /nfs/dbraw/zinc/38/30/24/339383024.db2.gz VJBOQDUNJFRBPA-CQSZACIVSA-N 1 2 309.413 4.375 20 0 DIADLO CCCc1sc(C(=O)N[C@@H](c2[nH]cc[nH+]2)C(C)C)cc1CC ZINC000473305128 339384234 /nfs/dbraw/zinc/38/42/34/339384234.db2.gz WFWSUBFMOMINKK-OAHLLOKOSA-N 1 2 319.474 4.113 20 0 DIADLO CCc1[nH+]c(C)ccc1OCc1cc(-c2cccs2)on1 ZINC000473659297 339389596 /nfs/dbraw/zinc/38/95/96/339389596.db2.gz KCMJGPYFBWYCNY-UHFFFAOYSA-N 1 2 300.383 4.248 20 0 DIADLO Cc1cccn2cc(CSCCCCOC(C)(C)C)[nH+]c12 ZINC000473795320 339392275 /nfs/dbraw/zinc/39/22/75/339392275.db2.gz QOXKMMRJVWJDHZ-UHFFFAOYSA-N 1 2 306.475 4.471 20 0 DIADLO CCc1cccc(F)c1C[NH2+]Cc1ncoc1-c1ccccc1 ZINC000474793067 339426058 /nfs/dbraw/zinc/42/60/58/339426058.db2.gz CSZHAKGNZAVUPN-UHFFFAOYSA-N 1 2 310.372 4.333 20 0 DIADLO COc1cc(NCc2c[nH+]c(C)n2-c2ccccc2)c(C)cc1C ZINC000475666401 339458624 /nfs/dbraw/zinc/45/86/24/339458624.db2.gz CDHXVXWNFDDLFW-UHFFFAOYSA-N 1 2 321.424 4.418 20 0 DIADLO CC(C)c1cnc(SCc2cn3cc(Cl)ccc3[nH+]2)n1C ZINC000476552877 339478512 /nfs/dbraw/zinc/47/85/12/339478512.db2.gz UOBLTFLEDZLZIU-UHFFFAOYSA-N 1 2 320.849 4.137 20 0 DIADLO c1sc(Cc2cn3ccccc3[nH+]2)nc1[C@H]1Cc2ccccc21 ZINC000477260735 339490763 /nfs/dbraw/zinc/49/07/63/339490763.db2.gz OYRHPSHLXIQDCC-INIZCTEOSA-N 1 2 317.417 4.070 20 0 DIADLO C[C@H]([NH2+]C/C=C\c1ccccc1)c1nc(Cc2ccccc2)no1 ZINC000477295156 339491894 /nfs/dbraw/zinc/49/18/94/339491894.db2.gz ZCFSRSZDBPTWGG-RQPMMQJISA-N 1 2 319.408 4.024 20 0 DIADLO CCn1c2cccc(F)c2nc1Cn1c[nH+]c2cc(C)c(C)cc21 ZINC000477434653 339494735 /nfs/dbraw/zinc/49/47/35/339494735.db2.gz VTQUVTWFWBEPPQ-UHFFFAOYSA-N 1 2 322.387 4.210 20 0 DIADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)N[C@H](C)CC)c1 ZINC000477985537 339506675 /nfs/dbraw/zinc/50/66/75/339506675.db2.gz MZQRHUISQDXQPS-CQSZACIVSA-N 1 2 314.433 4.270 20 0 DIADLO COc1ccc(COc2cccc(-n3cc[nH+]c3)c2)cc1Cl ZINC000478642360 339519952 /nfs/dbraw/zinc/51/99/52/339519952.db2.gz KGKHWAYMKDILED-UHFFFAOYSA-N 1 2 314.772 4.113 20 0 DIADLO Cc1cc(C)cc(C(=O)N(Cc2[nH]cc[nH+]2)c2cccc(F)c2)c1 ZINC000479380260 339532375 /nfs/dbraw/zinc/53/23/75/339532375.db2.gz PTPLGCOORDEPDH-UHFFFAOYSA-N 1 2 323.371 4.013 20 0 DIADLO CCOC[C@@H]1CCC[C@H]1Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000479428201 339534599 /nfs/dbraw/zinc/53/45/99/339534599.db2.gz UHNKVDISCQVZMT-XJKSGUPXSA-N 1 2 319.836 4.143 20 0 DIADLO CCN(C)c1ccc(CNc2cccc(C(C)(F)F)c2)c[nH+]1 ZINC000480257470 339565791 /nfs/dbraw/zinc/56/57/91/339565791.db2.gz BKKCASPGONQFJK-UHFFFAOYSA-N 1 2 305.372 4.262 20 0 DIADLO CC(C)COC[C@H]([NH2+]Cc1ccsc1Cl)c1ccco1 ZINC000480331829 339569418 /nfs/dbraw/zinc/56/94/18/339569418.db2.gz ICNAKHDATYLBPV-ZDUSSCGKSA-N 1 2 313.850 4.498 20 0 DIADLO CCN(C)c1ccc(CNc2cc(C)c(Cl)cc2OC)c[nH+]1 ZINC000480354354 339570245 /nfs/dbraw/zinc/57/02/45/339570245.db2.gz JIXLHYNEWHAECZ-UHFFFAOYSA-N 1 2 319.836 4.120 20 0 DIADLO CC[C@@H]1CCc2ccccc2N1Cc1[nH+]ccn1CC(F)(F)F ZINC000482995374 339649335 /nfs/dbraw/zinc/64/93/35/339649335.db2.gz LCHARDZWKZACFR-CQSZACIVSA-N 1 2 323.362 4.177 20 0 DIADLO Cc1cc[nH+]c(C)c1NC(=O)NCCCc1cccc(Cl)c1 ZINC000485472644 339704122 /nfs/dbraw/zinc/70/41/22/339704122.db2.gz GKZVNSZCJYVLTE-UHFFFAOYSA-N 1 2 317.820 4.106 20 0 DIADLO Brc1ccc2c(c1)[C@@H](Nc1cccc[nH+]1)CS2 ZINC000486481420 339727534 /nfs/dbraw/zinc/72/75/34/339727534.db2.gz UDOSYLHGCCIMQR-NSHDSACASA-N 1 2 307.216 4.103 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1Cl)c1nccn1-c1ccccc1 ZINC000488319661 339777007 /nfs/dbraw/zinc/77/70/07/339777007.db2.gz AANQKXGERDUKJL-CQSZACIVSA-N 1 2 311.816 4.377 20 0 DIADLO CC(C)(C)[C@@H]1C[C@@H](Nc2ccc(N3CCCC3)[nH+]c2)CS1 ZINC000488427615 339781406 /nfs/dbraw/zinc/78/14/06/339781406.db2.gz ALHAXTPYLFMQKP-CABCVRRESA-N 1 2 305.491 4.014 20 0 DIADLO Cc1ccc(C[C@@H](C)C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000488464459 339784159 /nfs/dbraw/zinc/78/41/59/339784159.db2.gz WGYPAKRIPNRNOR-OAHLLOKOSA-N 1 2 319.408 4.202 20 0 DIADLO COc1cccc2c1[nH+]cc(C)c2N1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000488471299 339784590 /nfs/dbraw/zinc/78/45/90/339784590.db2.gz WUPKPBUMTCMSPV-PBHICJAKSA-N 1 2 318.367 4.033 20 0 DIADLO Cc1cccc2[nH+]cc(CNc3cccc(-c4ncco4)c3C)n21 ZINC000491579689 339867743 /nfs/dbraw/zinc/86/77/43/339867743.db2.gz TZWAGTYRABBZHN-UHFFFAOYSA-N 1 2 318.380 4.218 20 0 DIADLO CCC(CC)[C@H](C)C(=O)N(C)[C@@H](c1[nH]cc[nH+]1)c1ccccc1 ZINC000492937998 339912978 /nfs/dbraw/zinc/91/29/78/339912978.db2.gz WMRLPTUNZQMJMY-WMLDXEAASA-N 1 2 313.445 4.030 20 0 DIADLO CCCc1csc(C[NH2+][C@H](C)c2c(F)cccc2OC)n1 ZINC000494109525 339941296 /nfs/dbraw/zinc/94/12/96/339941296.db2.gz USRHHCLCAKNSGJ-LLVKDONJSA-N 1 2 308.422 4.094 20 0 DIADLO CCCc1csc(C[NH2+]Cc2ccccc2OC(C)C)n1 ZINC000494336362 339946959 /nfs/dbraw/zinc/94/69/59/339946959.db2.gz YGZYBUZQPBQZBE-UHFFFAOYSA-N 1 2 304.459 4.173 20 0 DIADLO CCOc1c(Cl)cccc1CN1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000494994868 339969500 /nfs/dbraw/zinc/96/95/00/339969500.db2.gz LFYOMDYYPGDOJS-OAHLLOKOSA-N 1 2 319.836 4.189 20 0 DIADLO Cc1cccc(C)c1OCCCn1c[nH+]c2cc(F)c(F)cc21 ZINC000496951055 340016804 /nfs/dbraw/zinc/01/68/04/340016804.db2.gz MUGYKGBZPIMQNG-UHFFFAOYSA-N 1 2 316.351 4.400 20 0 DIADLO FC(F)[C@H](CCc1ccccc1)[NH2+][C@H](c1cccnc1)C1CC1 ZINC000498765970 340022989 /nfs/dbraw/zinc/02/29/89/340022989.db2.gz DYRIXNIIHLEUJJ-ROUUACIJSA-N 1 2 316.395 4.389 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+]1CCOC2(CCC2)C1 ZINC000499244037 340033023 /nfs/dbraw/zinc/03/30/23/340033023.db2.gz PQJVEXMXPOLIFE-LLVKDONJSA-N 1 2 300.229 4.309 20 0 DIADLO C[C@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCOC2(CCC2)C1 ZINC000499244037 340033024 /nfs/dbraw/zinc/03/30/24/340033024.db2.gz PQJVEXMXPOLIFE-LLVKDONJSA-N 1 2 300.229 4.309 20 0 DIADLO C[C@H]1c2ccccc2C[N@H+]1Cc1ccc(Oc2ccccc2)nn1 ZINC000499069799 340028979 /nfs/dbraw/zinc/02/89/79/340028979.db2.gz NJZBCLAIFMAJOC-HNNXBMFYSA-N 1 2 317.392 4.346 20 0 DIADLO C[C@H]1c2ccccc2C[N@@H+]1Cc1ccc(Oc2ccccc2)nn1 ZINC000499069799 340028980 /nfs/dbraw/zinc/02/89/80/340028980.db2.gz NJZBCLAIFMAJOC-HNNXBMFYSA-N 1 2 317.392 4.346 20 0 DIADLO CCC[C@]1(C(F)(F)F)CCCN1Cc1cn2ccccc2[nH+]1 ZINC000499066258 340029117 /nfs/dbraw/zinc/02/91/17/340029117.db2.gz XMVGXQLTWFDFKL-OAHLLOKOSA-N 1 2 311.351 4.031 20 0 DIADLO CCC[C@H](CC1CCCCC1)C(=O)Nc1c[nH+]ccc1OC ZINC000499587370 340039943 /nfs/dbraw/zinc/03/99/43/340039943.db2.gz NKEWBVCUXFPEGT-OAHLLOKOSA-N 1 2 304.434 4.415 20 0 DIADLO C[C@H]([NH2+][C@@H](CO)c1cccc(Cl)c1F)c1ccccc1F ZINC000499946439 340047491 /nfs/dbraw/zinc/04/74/91/340047491.db2.gz LXLHBUVMPRHLSH-BONVTDFDSA-N 1 2 311.759 4.002 20 0 DIADLO CSc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)C)no2)cc1 ZINC000500237659 340053887 /nfs/dbraw/zinc/05/38/87/340053887.db2.gz LFMBVVOLZZCHJE-RYUDHWBXSA-N 1 2 305.447 4.327 20 0 DIADLO Cc1c[nH+]cc(NCc2c(F)ccc(Br)c2F)c1 ZINC000500419561 340057732 /nfs/dbraw/zinc/05/77/32/340057732.db2.gz GQIRFIYDYGPOSV-UHFFFAOYSA-N 1 2 313.145 4.043 20 0 DIADLO C[C@@H]1COC[C@H](c2ccccc2)[N@@H+]1Cc1ccc2ccccc2n1 ZINC000501029938 340072651 /nfs/dbraw/zinc/07/26/51/340072651.db2.gz UYNWHYFQAZQIHZ-IIBYNOLFSA-N 1 2 318.420 4.197 20 0 DIADLO C[C@@H]1COC[C@H](c2ccccc2)[N@H+]1Cc1ccc2ccccc2n1 ZINC000501029938 340072652 /nfs/dbraw/zinc/07/26/52/340072652.db2.gz UYNWHYFQAZQIHZ-IIBYNOLFSA-N 1 2 318.420 4.197 20 0 DIADLO CCC[C@H](C)[N@@H+]1CCO[C@@H](c2cccc(Br)c2)C1 ZINC000501143344 340075045 /nfs/dbraw/zinc/07/50/45/340075045.db2.gz RCRCLTMYXJPZOF-SWLSCSKDSA-N 1 2 312.251 4.011 20 0 DIADLO CCC[C@H](C)[N@H+]1CCO[C@@H](c2cccc(Br)c2)C1 ZINC000501143344 340075046 /nfs/dbraw/zinc/07/50/46/340075046.db2.gz RCRCLTMYXJPZOF-SWLSCSKDSA-N 1 2 312.251 4.011 20 0 DIADLO C/C(=C\c1ccccc1)C[NH2+]c1ccc(N2CCOCC2)cc1C ZINC000501378592 340079597 /nfs/dbraw/zinc/07/95/97/340079597.db2.gz RWOKDQMEAWPKSB-SAPNQHFASA-N 1 2 322.452 4.347 20 0 DIADLO CCCc1nc(C[N@H+](C)CCOc2cccc(Cl)c2)cs1 ZINC000501397189 340080119 /nfs/dbraw/zinc/08/01/19/340080119.db2.gz GKRZRCICELHULI-UHFFFAOYSA-N 1 2 324.877 4.260 20 0 DIADLO CCCc1nc(C[N@@H+](C)CCOc2cccc(Cl)c2)cs1 ZINC000501397189 340080120 /nfs/dbraw/zinc/08/01/20/340080120.db2.gz GKRZRCICELHULI-UHFFFAOYSA-N 1 2 324.877 4.260 20 0 DIADLO Cc1ccccc1Nc1nc(C[N@@H+]2CC[C@](C)(F)C2)cs1 ZINC000501423573 340080654 /nfs/dbraw/zinc/08/06/54/340080654.db2.gz GWEFXVGBCKQLSC-INIZCTEOSA-N 1 2 305.422 4.129 20 0 DIADLO Cc1ccccc1Nc1nc(C[N@H+]2CC[C@](C)(F)C2)cs1 ZINC000501423573 340080655 /nfs/dbraw/zinc/08/06/55/340080655.db2.gz GWEFXVGBCKQLSC-INIZCTEOSA-N 1 2 305.422 4.129 20 0 DIADLO CCCCn1c(SCC=C(C)C)nnc1[C@H](CC)[NH+](C)C ZINC000501753121 340087953 /nfs/dbraw/zinc/08/79/53/340087953.db2.gz FHDOEESNZXSITI-AWEZNQCLSA-N 1 2 310.511 4.149 20 0 DIADLO C[C@H](c1ccccc1F)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1 ZINC000501628075 340085317 /nfs/dbraw/zinc/08/53/17/340085317.db2.gz OXVBFRKHXLNRKT-GFCCVEGCSA-N 1 2 320.795 4.111 20 0 DIADLO C[C@H](c1ccccc1F)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1 ZINC000501628075 340085318 /nfs/dbraw/zinc/08/53/18/340085318.db2.gz OXVBFRKHXLNRKT-GFCCVEGCSA-N 1 2 320.795 4.111 20 0 DIADLO CC(C)c1nc([C@H]2CCCCC[N@@H+]2Cc2cccs2)no1 ZINC000501711771 340087062 /nfs/dbraw/zinc/08/70/62/340087062.db2.gz FGCGPEPBBYBWJL-CQSZACIVSA-N 1 2 305.447 4.372 20 0 DIADLO CC(C)c1nc([C@H]2CCCCC[N@H+]2Cc2cccs2)no1 ZINC000501711771 340087063 /nfs/dbraw/zinc/08/70/63/340087063.db2.gz FGCGPEPBBYBWJL-CQSZACIVSA-N 1 2 305.447 4.372 20 0 DIADLO CCCOc1cccc2c(N[C@@H]3CCO[C@H](C)C3)cc[nH+]c12 ZINC000502007364 340092809 /nfs/dbraw/zinc/09/28/09/340092809.db2.gz WSUULKAEFYBBSR-ZIAGYGMSSA-N 1 2 300.402 4.003 20 0 DIADLO CCCOc1cccc2c(N[C@H]3CCCOCC3)cc[nH+]c12 ZINC000502011863 340092882 /nfs/dbraw/zinc/09/28/82/340092882.db2.gz CIXBTAWVEJAYKW-AWEZNQCLSA-N 1 2 300.402 4.005 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1F)c1nc2c(s1)CCC2 ZINC000502017757 340093019 /nfs/dbraw/zinc/09/30/19/340093019.db2.gz ODMREHKHXGGUCV-UWVGGRQHSA-N 1 2 308.397 4.322 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(Cl)c1F)c1nc2c(s1)CCC2 ZINC000502049277 340094115 /nfs/dbraw/zinc/09/41/15/340094115.db2.gz ZUCSZCPVXHTPOJ-SECBINFHSA-N 1 2 310.825 4.275 20 0 DIADLO c1cncc([C@@H]2CCC[C@H](Nc3ccc(N4CCCC4)[nH+]c3)C2)c1 ZINC000502402244 340101912 /nfs/dbraw/zinc/10/19/12/340101912.db2.gz CCFSCRAPCIXVGW-AEFFLSMTSA-N 1 2 322.456 4.215 20 0 DIADLO C[C@H]([NH2+]CC(F)(F)c1ccccc1)c1cnn(C2CCCC2)c1 ZINC000502435558 340103515 /nfs/dbraw/zinc/10/35/15/340103515.db2.gz OJNQSXWQHZCPGW-AWEZNQCLSA-N 1 2 319.399 4.441 20 0 DIADLO CC[C@@H]1C[C@@]1([NH2+]Cc1nc(-c2ccoc2)no1)c1cccc(C)c1 ZINC000502483730 340105729 /nfs/dbraw/zinc/10/57/29/340105729.db2.gz JTIUTCZSGKRRDY-BEFAXECRSA-N 1 2 323.396 4.053 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)C)n1 ZINC000502525060 340106883 /nfs/dbraw/zinc/10/68/83/340106883.db2.gz UCQDLHDAKPWNBN-QGZVFWFLSA-N 1 2 305.397 4.038 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1cc(-c3ccccc3)no1)CC2 ZINC000502532455 340107109 /nfs/dbraw/zinc/10/71/09/340107109.db2.gz UYGUYYJJAFJYFW-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1cc(-c3ccccc3)no1)CC2 ZINC000502532455 340107110 /nfs/dbraw/zinc/10/71/10/340107110.db2.gz UYGUYYJJAFJYFW-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000502573646 340108119 /nfs/dbraw/zinc/10/81/19/340108119.db2.gz UHRKDHCHAASKTF-KBXCAEBGSA-N 1 2 301.817 4.475 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000502573646 340108120 /nfs/dbraw/zinc/10/81/20/340108120.db2.gz UHRKDHCHAASKTF-KBXCAEBGSA-N 1 2 301.817 4.475 20 0 DIADLO FC(F)[C@H]1CCCC[N@@H+]1Cc1ccc(OCC(F)(F)F)cc1 ZINC000502787136 340113515 /nfs/dbraw/zinc/11/35/15/340113515.db2.gz AQKCKEABUOSGTF-CYBMUJFWSA-N 1 2 323.305 4.247 20 0 DIADLO FC(F)[C@H]1CCCC[N@H+]1Cc1ccc(OCC(F)(F)F)cc1 ZINC000502787136 340113516 /nfs/dbraw/zinc/11/35/16/340113516.db2.gz AQKCKEABUOSGTF-CYBMUJFWSA-N 1 2 323.305 4.247 20 0 DIADLO CCc1nc(C[N@@H+]2CC[C@](F)(c3ccccc3C)C2)cs1 ZINC000502939747 340117286 /nfs/dbraw/zinc/11/72/86/340117286.db2.gz MSNFYNNXJBZNTG-QGZVFWFLSA-N 1 2 304.434 4.085 20 0 DIADLO CCc1nc(C[N@H+]2CC[C@](F)(c3ccccc3C)C2)cs1 ZINC000502939747 340117287 /nfs/dbraw/zinc/11/72/87/340117287.db2.gz MSNFYNNXJBZNTG-QGZVFWFLSA-N 1 2 304.434 4.085 20 0 DIADLO Cc1cc(F)cc([C@]2(F)CC[N@H+](C/C=C\c3ccncc3)C2)c1 ZINC000503030259 340119078 /nfs/dbraw/zinc/11/90/78/340119078.db2.gz GMKBPGWGWJSEEZ-AXMVSILFSA-N 1 2 314.379 4.113 20 0 DIADLO Cc1cc(F)cc([C@]2(F)CC[N@@H+](C/C=C\c3ccncc3)C2)c1 ZINC000503030259 340119079 /nfs/dbraw/zinc/11/90/79/340119079.db2.gz GMKBPGWGWJSEEZ-AXMVSILFSA-N 1 2 314.379 4.113 20 0 DIADLO FC(F)[C@H]1CCCC[N@@H+]1Cc1cccc(-c2cccnc2)c1 ZINC000503082524 340120649 /nfs/dbraw/zinc/12/06/49/340120649.db2.gz GHOYJXAILRAQJQ-QGZVFWFLSA-N 1 2 302.368 4.368 20 0 DIADLO FC(F)[C@H]1CCCC[N@H+]1Cc1cccc(-c2cccnc2)c1 ZINC000503082524 340120650 /nfs/dbraw/zinc/12/06/50/340120650.db2.gz GHOYJXAILRAQJQ-QGZVFWFLSA-N 1 2 302.368 4.368 20 0 DIADLO FC(F)[C@H]1CCCC[N@@H+]1Cc1cccc(-c2ccccn2)c1 ZINC000503107565 340121078 /nfs/dbraw/zinc/12/10/78/340121078.db2.gz YYNDSFVOALUSHW-QGZVFWFLSA-N 1 2 302.368 4.368 20 0 DIADLO FC(F)[C@H]1CCCC[N@H+]1Cc1cccc(-c2ccccn2)c1 ZINC000503107565 340121079 /nfs/dbraw/zinc/12/10/79/340121079.db2.gz YYNDSFVOALUSHW-QGZVFWFLSA-N 1 2 302.368 4.368 20 0 DIADLO CC(=O)c1ccc(Nc2c[nH+]c(N3CCCC[C@@H]3C)c(C)c2)nc1 ZINC000503274317 340124430 /nfs/dbraw/zinc/12/44/30/340124430.db2.gz ITBTZXVNRAKSMA-AWEZNQCLSA-N 1 2 324.428 4.110 20 0 DIADLO Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]C1(C(F)F)CC1 ZINC000503853518 340135157 /nfs/dbraw/zinc/13/51/57/340135157.db2.gz DPLAGVRUWKFONX-GFCCVEGCSA-N 1 2 322.424 4.491 20 0 DIADLO C[C@H]([NH2+]C1(C(F)F)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000503903934 340136251 /nfs/dbraw/zinc/13/62/51/340136251.db2.gz RMPZNTSBTMBUGD-VIFPVBQESA-N 1 2 309.278 4.076 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)N1CCC[C@H]1CCC1CCCCC1 ZINC000504132326 340141412 /nfs/dbraw/zinc/14/14/12/340141412.db2.gz SDMVEJSVKYBKMH-KRWDZBQOSA-N 1 2 315.461 4.169 20 0 DIADLO CCCN(C(=O)Nc1cc[nH+]cc1C)[C@@H](CC)c1ccccc1 ZINC000504158753 340142043 /nfs/dbraw/zinc/14/20/43/340142043.db2.gz ZOHZOXKSCMCJFX-SFHVURJKSA-N 1 2 311.429 4.207 20 0 DIADLO C[NH+](C)[C@@H](c1nc(C2CCCCC2)no1)c1cccc(Cl)c1 ZINC000504236020 340143694 /nfs/dbraw/zinc/14/36/94/340143694.db2.gz OAENXDDZZCICNH-OAHLLOKOSA-N 1 2 319.836 4.422 20 0 DIADLO CC[C@H](CC(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC000504382244 340146644 /nfs/dbraw/zinc/14/66/44/340146644.db2.gz RKQQMFHVMNGSQB-MRXNPFEDSA-N 1 2 319.408 4.395 20 0 DIADLO C[C@H](CC(=O)Nc1c[nH+]ccc1OC(C)(C)C)c1ccccc1 ZINC000504634329 340150399 /nfs/dbraw/zinc/15/03/99/340150399.db2.gz FZIWAZMSWBSFNQ-CQSZACIVSA-N 1 2 312.413 4.391 20 0 DIADLO C[C@@H]1CC(C)(C)c2ccccc2N1C(=O)c1ccc2[nH+]ccn2c1 ZINC000504855030 340153857 /nfs/dbraw/zinc/15/38/57/340153857.db2.gz YBRMCDPGVJFGTI-CQSZACIVSA-N 1 2 319.408 4.051 20 0 DIADLO CC[C@@H](CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1)c1ccccc1 ZINC000504918000 340156073 /nfs/dbraw/zinc/15/60/73/340156073.db2.gz FSGKCOMGLJPWAG-AWEZNQCLSA-N 1 2 307.397 4.394 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccccc2F)c(Cl)c1OC ZINC000505628777 340173537 /nfs/dbraw/zinc/17/35/37/340173537.db2.gz AXVAQCXBXROPQC-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccccc2F)c(Cl)c1OC ZINC000505628777 340173538 /nfs/dbraw/zinc/17/35/38/340173538.db2.gz AXVAQCXBXROPQC-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1ccc2c(c1)CCC=C2 ZINC000505628649 340173542 /nfs/dbraw/zinc/17/35/42/340173542.db2.gz AOCGXXNNUJPJKN-UHFFFAOYSA-N 1 2 315.376 4.084 20 0 DIADLO C[N@H+](Cc1ccc(Cl)o1)Cc1ccccc1Br ZINC000505658048 340174428 /nfs/dbraw/zinc/17/44/28/340174428.db2.gz IBUCGNOKUFBGIH-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO C[N@@H+](Cc1ccc(Cl)o1)Cc1ccccc1Br ZINC000505658048 340174429 /nfs/dbraw/zinc/17/44/29/340174429.db2.gz IBUCGNOKUFBGIH-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO CC(C)(C)c1noc(C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)n1 ZINC000505873797 340180356 /nfs/dbraw/zinc/18/03/56/340180356.db2.gz BBTDIIZEPLXYDP-LPQFERQCSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1noc(C[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)n1 ZINC000505873797 340180357 /nfs/dbraw/zinc/18/03/57/340180357.db2.gz BBTDIIZEPLXYDP-LPQFERQCSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1noc(C[N@@H+]2CCC[C@H]2/C=C\c2ccccc2)n1 ZINC000505873796 340180459 /nfs/dbraw/zinc/18/04/59/340180459.db2.gz BBTDIIZEPLXYDP-JNSOCZORSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1noc(C[N@H+]2CCC[C@H]2/C=C\c2ccccc2)n1 ZINC000505873796 340180460 /nfs/dbraw/zinc/18/04/60/340180460.db2.gz BBTDIIZEPLXYDP-JNSOCZORSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)no1 ZINC000505880909 340180584 /nfs/dbraw/zinc/18/05/84/340180584.db2.gz ZZDCXKSDGBVJIK-PCUGXKRQSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)no1 ZINC000505880909 340180585 /nfs/dbraw/zinc/18/05/85/340180585.db2.gz ZZDCXKSDGBVJIK-PCUGXKRQSA-N 1 2 311.429 4.045 20 0 DIADLO Fc1cccc(C[N@@H+]2CCn3cccc3[C@@H]2c2ccccc2)c1 ZINC000506129575 340186428 /nfs/dbraw/zinc/18/64/28/340186428.db2.gz AEVJFVHLFFNSJV-FQEVSTJZSA-N 1 2 306.384 4.232 20 0 DIADLO Fc1cccc(C[N@H+]2CCn3cccc3[C@@H]2c2ccccc2)c1 ZINC000506129575 340186429 /nfs/dbraw/zinc/18/64/29/340186429.db2.gz AEVJFVHLFFNSJV-FQEVSTJZSA-N 1 2 306.384 4.232 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](C)Cc2ccc(Br)o2)o1 ZINC000506187010 340187932 /nfs/dbraw/zinc/18/79/32/340187932.db2.gz CRAWDZRLZDORRY-ZWNOBZJWSA-N 1 2 324.218 4.391 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2ccc(Br)o2)o1 ZINC000506187010 340187933 /nfs/dbraw/zinc/18/79/33/340187933.db2.gz CRAWDZRLZDORRY-ZWNOBZJWSA-N 1 2 324.218 4.391 20 0 DIADLO CC(C)(C)c1ncc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)s1 ZINC000506354871 340193133 /nfs/dbraw/zinc/19/31/33/340193133.db2.gz YRQRHGVCGULAJI-MRXNPFEDSA-N 1 2 316.470 4.014 20 0 DIADLO CC(C)(C)c1ncc(C[N@H+]2CCO[C@@H](c3ccccc3)C2)s1 ZINC000506354871 340193134 /nfs/dbraw/zinc/19/31/34/340193134.db2.gz YRQRHGVCGULAJI-MRXNPFEDSA-N 1 2 316.470 4.014 20 0 DIADLO CC[C@H]1C[N@H+](Cc2c(OC(F)F)ccc3ccccc32)CCO1 ZINC000506380172 340193730 /nfs/dbraw/zinc/19/37/30/340193730.db2.gz KVHYCOBFXKBVON-AWEZNQCLSA-N 1 2 321.367 4.052 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2c(OC(F)F)ccc3ccccc32)CCO1 ZINC000506380172 340193731 /nfs/dbraw/zinc/19/37/31/340193731.db2.gz KVHYCOBFXKBVON-AWEZNQCLSA-N 1 2 321.367 4.052 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)o2)c(OC)c1 ZINC000506704123 340199931 /nfs/dbraw/zinc/19/99/31/340199931.db2.gz BDTRRJAKUXRNJP-OAHLLOKOSA-N 1 2 321.804 4.287 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)o2)c(OC)c1 ZINC000506704123 340199932 /nfs/dbraw/zinc/19/99/32/340199932.db2.gz BDTRRJAKUXRNJP-OAHLLOKOSA-N 1 2 321.804 4.287 20 0 DIADLO Fc1cccc(F)c1C[N@@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC000506727206 340200200 /nfs/dbraw/zinc/20/02/00/340200200.db2.gz RAALXLPGXWEWTD-ZDUSSCGKSA-N 1 2 323.408 4.208 20 0 DIADLO Fc1cccc(F)c1C[N@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC000506727206 340200201 /nfs/dbraw/zinc/20/02/01/340200201.db2.gz RAALXLPGXWEWTD-ZDUSSCGKSA-N 1 2 323.408 4.208 20 0 DIADLO COc1ccc(OC)c([C@H]2CCC[N@@H+]2Cc2ccc(Cl)o2)c1 ZINC000506730677 340200350 /nfs/dbraw/zinc/20/03/50/340200350.db2.gz NQAFJHQJAMZFSS-OAHLLOKOSA-N 1 2 321.804 4.287 20 0 DIADLO COc1ccc(OC)c([C@H]2CCC[N@H+]2Cc2ccc(Cl)o2)c1 ZINC000506730677 340200351 /nfs/dbraw/zinc/20/03/51/340200351.db2.gz NQAFJHQJAMZFSS-OAHLLOKOSA-N 1 2 321.804 4.287 20 0 DIADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1cnc2ccc(Cl)cn12 ZINC000506737283 340200582 /nfs/dbraw/zinc/20/05/82/340200582.db2.gz WSHGUJYMBVCYEW-NSHDSACASA-N 1 2 317.845 4.169 20 0 DIADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1cnc2ccc(Cl)cn12 ZINC000506737283 340200583 /nfs/dbraw/zinc/20/05/83/340200583.db2.gz WSHGUJYMBVCYEW-NSHDSACASA-N 1 2 317.845 4.169 20 0 DIADLO C[C@H]1c2ccsc2CCN1Cc1c[nH+]c2ccc(Cl)cn12 ZINC000506737283 340200584 /nfs/dbraw/zinc/20/05/84/340200584.db2.gz WSHGUJYMBVCYEW-NSHDSACASA-N 1 2 317.845 4.169 20 0 DIADLO C[C@H]1CCc2nc(C[N@H+](C)Cc3ccc(F)cc3)sc2C1 ZINC000506758596 340201075 /nfs/dbraw/zinc/20/10/75/340201075.db2.gz MTYDLOGSRMFMBY-LBPRGKRZSA-N 1 2 304.434 4.039 20 0 DIADLO C[C@H]1CCc2nc(C[N@@H+](C)Cc3ccc(F)cc3)sc2C1 ZINC000506758596 340201076 /nfs/dbraw/zinc/20/10/76/340201076.db2.gz MTYDLOGSRMFMBY-LBPRGKRZSA-N 1 2 304.434 4.039 20 0 DIADLO C[N@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1ccc(Cl)cc1 ZINC000506768009 340201381 /nfs/dbraw/zinc/20/13/81/340201381.db2.gz UEXPMLQUYJWCCO-UHFFFAOYSA-N 1 2 311.816 4.362 20 0 DIADLO C[N@@H+](Cc1cnc(-c2ccccc2)[nH]1)Cc1ccc(Cl)cc1 ZINC000506768009 340201382 /nfs/dbraw/zinc/20/13/82/340201382.db2.gz UEXPMLQUYJWCCO-UHFFFAOYSA-N 1 2 311.816 4.362 20 0 DIADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)cs1 ZINC000506777268 340201472 /nfs/dbraw/zinc/20/14/72/340201472.db2.gz NOKDUVMEKZTIQU-JTQLQIEISA-N 1 2 306.397 4.215 20 0 DIADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)cs1 ZINC000506777268 340201473 /nfs/dbraw/zinc/20/14/73/340201473.db2.gz NOKDUVMEKZTIQU-JTQLQIEISA-N 1 2 306.397 4.215 20 0 DIADLO COCc1cccc(C[N@H+](C)Cc2c(F)cccc2Cl)c1 ZINC000506789348 340201834 /nfs/dbraw/zinc/20/18/34/340201834.db2.gz ULDJXOZUAGEHRP-UHFFFAOYSA-N 1 2 307.796 4.258 20 0 DIADLO COCc1cccc(C[N@@H+](C)Cc2c(F)cccc2Cl)c1 ZINC000506789348 340201835 /nfs/dbraw/zinc/20/18/35/340201835.db2.gz ULDJXOZUAGEHRP-UHFFFAOYSA-N 1 2 307.796 4.258 20 0 DIADLO CC[C@@H](C)N(C)C(=O)Nc1c[nH+]c(N2CCCC[C@H]2C)c(C)c1 ZINC000506988174 340204778 /nfs/dbraw/zinc/20/47/78/340204778.db2.gz TUMZZGRBSMXSQH-HUUCEWRRSA-N 1 2 318.465 4.031 20 0 DIADLO Oc1ccc(F)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c1F ZINC000507079117 340206706 /nfs/dbraw/zinc/20/67/06/340206706.db2.gz VAMKWKWZKMXBSE-HNNXBMFYSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(F)c(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c1F ZINC000507079117 340206707 /nfs/dbraw/zinc/20/67/07/340206707.db2.gz VAMKWKWZKMXBSE-HNNXBMFYSA-N 1 2 307.315 4.147 20 0 DIADLO Cc1nn(C)cc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000507133519 340208978 /nfs/dbraw/zinc/20/89/78/340208978.db2.gz ZVXCTOVTSBLPNK-INIZCTEOSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)cc1C[N@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000507133519 340208979 /nfs/dbraw/zinc/20/89/79/340208979.db2.gz ZVXCTOVTSBLPNK-INIZCTEOSA-N 1 2 324.255 4.372 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1cc(Br)ccc1F ZINC000507190091 340212088 /nfs/dbraw/zinc/21/20/88/340212088.db2.gz KWLAVJSRGKQFMU-JTQLQIEISA-N 1 2 312.182 4.374 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1cc(Br)ccc1F ZINC000507190091 340212089 /nfs/dbraw/zinc/21/20/89/340212089.db2.gz KWLAVJSRGKQFMU-JTQLQIEISA-N 1 2 312.182 4.374 20 0 DIADLO COc1ccc(OC)c(C[N@H+](C)[C@H](C)c2c(F)cccc2F)c1 ZINC000507190642 340212249 /nfs/dbraw/zinc/21/22/49/340212249.db2.gz FCHSVVXUNOTWMZ-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc(OC)c(C[N@@H+](C)[C@H](C)c2c(F)cccc2F)c1 ZINC000507190642 340212250 /nfs/dbraw/zinc/21/22/50/340212250.db2.gz FCHSVVXUNOTWMZ-GFCCVEGCSA-N 1 2 321.367 4.175 20 0 DIADLO Cc1nn2c(C[N@H+](C)[C@@H](C)c3ccco3)c(C(C)C)nc2s1 ZINC000507220956 340214278 /nfs/dbraw/zinc/21/42/78/340214278.db2.gz CGLVWRSBGYKZKE-NSHDSACASA-N 1 2 318.446 4.009 20 0 DIADLO Cc1nn2c(C[N@@H+](C)[C@@H](C)c3ccco3)c(C(C)C)nc2s1 ZINC000507220956 340214279 /nfs/dbraw/zinc/21/42/79/340214279.db2.gz CGLVWRSBGYKZKE-NSHDSACASA-N 1 2 318.446 4.009 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc2n[nH]cc2c1)c1ncc(C(C)(C)C)o1 ZINC000507232585 340214897 /nfs/dbraw/zinc/21/48/97/340214897.db2.gz OFHNKEAUUNFYHK-NWDGAFQWSA-N 1 2 312.417 4.260 20 0 DIADLO Cc1cccc2[nH+]cc(CN(C)[C@@H](C)c3c(F)cccc3F)n21 ZINC000507247898 340215514 /nfs/dbraw/zinc/21/55/14/340215514.db2.gz RJSSAVRBNNAPFX-ZDUSSCGKSA-N 1 2 315.367 4.114 20 0 DIADLO CC[C@H](C)CCC(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC000507433820 340219405 /nfs/dbraw/zinc/21/94/05/340219405.db2.gz NQXWBCYOGOWULT-KBPBESRZSA-N 1 2 323.506 4.140 20 0 DIADLO CC[C@H](C)CCC(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC000507433820 340219406 /nfs/dbraw/zinc/21/94/06/340219406.db2.gz NQXWBCYOGOWULT-KBPBESRZSA-N 1 2 323.506 4.140 20 0 DIADLO Cc1cc(C[N@@H+]2CCO[C@@H](c3ccsc3)C2)ccc1Cl ZINC000507791602 340231564 /nfs/dbraw/zinc/23/15/64/340231564.db2.gz CYDMKKXNMJOCGJ-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(C[N@H+]2CCO[C@@H](c3ccsc3)C2)ccc1Cl ZINC000507791602 340231565 /nfs/dbraw/zinc/23/15/65/340231565.db2.gz CYDMKKXNMJOCGJ-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2nc3ccccc3n2C)ccc1Cl ZINC000507795095 340231704 /nfs/dbraw/zinc/23/17/04/340231704.db2.gz NCUVBQKVBDIKFM-UHFFFAOYSA-N 1 2 313.832 4.167 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2nc3ccccc3n2C)ccc1Cl ZINC000507795095 340231705 /nfs/dbraw/zinc/23/17/05/340231705.db2.gz NCUVBQKVBDIKFM-UHFFFAOYSA-N 1 2 313.832 4.167 20 0 DIADLO Fc1ccc(F)c2c1CC[C@@H]2[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000507816701 340233008 /nfs/dbraw/zinc/23/30/08/340233008.db2.gz XFDQQYNNLXXVRZ-KRWDZBQOSA-N 1 2 317.383 4.054 20 0 DIADLO CCc1ccccc1C[NH2+][C@@H](c1nccn1C)c1cccc(F)c1 ZINC000507900000 340235542 /nfs/dbraw/zinc/23/55/42/340235542.db2.gz DIRVWDVEVLZNTN-LJQANCHMSA-N 1 2 323.415 4.001 20 0 DIADLO Cn1cc[nH+]c1[C@@H](Nc1ccc(F)c(F)c1)c1cccc(F)c1 ZINC000507906211 340235661 /nfs/dbraw/zinc/23/56/61/340235661.db2.gz DKGAIOKFKMDGEB-INIZCTEOSA-N 1 2 317.314 4.039 20 0 DIADLO c1c(CSCCCCC2CCOCC2)[nH+]c2ccccn12 ZINC000508565943 340246571 /nfs/dbraw/zinc/24/65/71/340246571.db2.gz FVZDUIKEKSRQMK-UHFFFAOYSA-N 1 2 304.459 4.164 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCO[C@@H](c3ccsc3)C2)c1 ZINC000508855907 340254493 /nfs/dbraw/zinc/25/44/93/340254493.db2.gz KMKNDTNWIACFNL-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCO[C@@H](c3ccsc3)C2)c1 ZINC000508855907 340254494 /nfs/dbraw/zinc/25/44/94/340254494.db2.gz KMKNDTNWIACFNL-MRXNPFEDSA-N 1 2 307.846 4.283 20 0 DIADLO O=C(Nc1cccc(F)c1)c1ccccc1Oc1cc[nH+]cc1 ZINC000509015203 340258353 /nfs/dbraw/zinc/25/83/53/340258353.db2.gz UMEHLFWJTILOJE-UHFFFAOYSA-N 1 2 308.312 4.265 20 0 DIADLO CC(C)CC[C@@H](C)NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509016068 340258358 /nfs/dbraw/zinc/25/83/58/340258358.db2.gz PBFPCRMOTHHPQV-OAHLLOKOSA-N 1 2 312.413 4.428 20 0 DIADLO C[C@@H](NC(=O)c1ccccc1Oc1cc[nH+]cc1)c1ccccc1 ZINC000509028694 340258823 /nfs/dbraw/zinc/25/88/23/340258823.db2.gz FXVUPXMIBYGKRP-OAHLLOKOSA-N 1 2 318.376 4.365 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1nc(-c2ccc(C)cc2)cs1 ZINC000509310740 340265838 /nfs/dbraw/zinc/26/58/38/340265838.db2.gz QIQHWMVFWBBUGL-ZBFHGGJFSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1nc(-c2ccc(C)cc2)cs1 ZINC000509310740 340265839 /nfs/dbraw/zinc/26/58/39/340265839.db2.gz QIQHWMVFWBBUGL-ZBFHGGJFSA-N 1 2 316.470 4.118 20 0 DIADLO Cn1c2ccccc2[nH+]c1N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000509479569 340270994 /nfs/dbraw/zinc/27/09/94/340270994.db2.gz ZCMZBPFSIQVZPJ-AWEZNQCLSA-N 1 2 323.362 4.132 20 0 DIADLO O=C(C[C@@H]1C[C@H]1c1ccccc1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000509504941 340271585 /nfs/dbraw/zinc/27/15/85/340271585.db2.gz CKTBSTRDSFACRA-WMZOPIPTSA-N 1 2 317.392 4.209 20 0 DIADLO COc1cc[nH+]cc1NC(=O)[C@H](C)c1cccc(CC(C)C)c1 ZINC000509536840 340272767 /nfs/dbraw/zinc/27/27/67/340272767.db2.gz BSZJCWKIOKBBJU-CQSZACIVSA-N 1 2 312.413 4.031 20 0 DIADLO Cc1ccc([C@H]2OCCC[C@H]2Nc2[nH+]c3ccccc3n2C)cc1 ZINC000509555123 340273336 /nfs/dbraw/zinc/27/33/36/340273336.db2.gz SULUDPLKTBRXJM-IEBWSBKVSA-N 1 2 321.424 4.214 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H](C)Cc1ccccc1 ZINC000509646084 340275470 /nfs/dbraw/zinc/27/54/70/340275470.db2.gz HRVSULAQXOACQA-OAHLLOKOSA-N 1 2 319.408 4.202 20 0 DIADLO CC[C@H]1C[N@H+](Cc2nc(-c3ccc(C)cc3)cs2)C[C@@H](C)O1 ZINC000509681022 340276739 /nfs/dbraw/zinc/27/67/39/340276739.db2.gz CNOWDSOGPRZMPY-ZBFHGGJFSA-N 1 2 316.470 4.118 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2nc(-c3ccc(C)cc3)cs2)C[C@@H](C)O1 ZINC000509681022 340276740 /nfs/dbraw/zinc/27/67/40/340276740.db2.gz CNOWDSOGPRZMPY-ZBFHGGJFSA-N 1 2 316.470 4.118 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2ccccc2)n1)c1ccncc1F ZINC000510040113 340286044 /nfs/dbraw/zinc/28/60/44/340286044.db2.gz OTBFSNBPHSRQMY-LBPRGKRZSA-N 1 2 313.401 4.195 20 0 DIADLO CC(C)CCC[C@H](C)NC(=O)C[N@H+](C)[C@@H](C)c1ccccc1F ZINC000510080826 340287929 /nfs/dbraw/zinc/28/79/29/340287929.db2.gz BFVAARSENBIZEE-HOTGVXAUSA-N 1 2 322.468 4.150 20 0 DIADLO CC(C)CCC[C@H](C)NC(=O)C[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000510080826 340287930 /nfs/dbraw/zinc/28/79/30/340287930.db2.gz BFVAARSENBIZEE-HOTGVXAUSA-N 1 2 322.468 4.150 20 0 DIADLO FC(F)C1([NH2+]Cc2ccc(C(F)(F)F)cn2)CCCCC1 ZINC000510112327 340289317 /nfs/dbraw/zinc/28/93/17/340289317.db2.gz KKBFCXDKSLYXOR-UHFFFAOYSA-N 1 2 308.294 4.158 20 0 DIADLO Clc1cccc(CC[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)c1Cl ZINC000510146124 340290482 /nfs/dbraw/zinc/29/04/82/340290482.db2.gz WHKOGSALUVIMNB-OAHLLOKOSA-N 1 2 324.255 4.486 20 0 DIADLO Clc1cccc(CC[N@H+]2CCCC[C@@H]2c2cc[nH]n2)c1Cl ZINC000510146124 340290483 /nfs/dbraw/zinc/29/04/83/340290483.db2.gz WHKOGSALUVIMNB-OAHLLOKOSA-N 1 2 324.255 4.486 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@H+](C)Cc1sccc1C ZINC000510221870 340293008 /nfs/dbraw/zinc/29/30/08/340293008.db2.gz IWMMCSRHTKVRFB-HNNXBMFYSA-N 1 2 323.845 4.056 20 0 DIADLO COC(=O)[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1sccc1C ZINC000510221870 340293009 /nfs/dbraw/zinc/29/30/09/340293009.db2.gz IWMMCSRHTKVRFB-HNNXBMFYSA-N 1 2 323.845 4.056 20 0 DIADLO COc1ccccc1[C@H]1CC[C@H](C)C[N@@H+]1Cc1cscn1 ZINC000510224999 340293220 /nfs/dbraw/zinc/29/32/20/340293220.db2.gz WBLJEKIPFQPCOP-XJKSGUPXSA-N 1 2 302.443 4.125 20 0 DIADLO COc1ccccc1[C@H]1CC[C@H](C)C[N@H+]1Cc1cscn1 ZINC000510224999 340293221 /nfs/dbraw/zinc/29/32/21/340293221.db2.gz WBLJEKIPFQPCOP-XJKSGUPXSA-N 1 2 302.443 4.125 20 0 DIADLO Cc1cccc([C@H](NCc2cn3ccccc3[nH+]2)C(F)(F)F)c1 ZINC000510435856 340299424 /nfs/dbraw/zinc/29/94/24/340299424.db2.gz WVELRXHZORIQHK-INIZCTEOSA-N 1 2 319.330 4.036 20 0 DIADLO CCCN(CC(C)C)C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000510497178 340301158 /nfs/dbraw/zinc/30/11/58/340301158.db2.gz SPHGUSQEUGJPCJ-UHFFFAOYSA-N 1 2 312.413 4.382 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+]2CCc3ccc(C(C)(C)C)cc3C2)n1 ZINC000511196812 340323730 /nfs/dbraw/zinc/32/37/30/340323730.db2.gz IFYDIYBRWPZPRO-CYBMUJFWSA-N 1 2 313.445 4.049 20 0 DIADLO CCc1noc([C@@H](C)[N@H+]2CCc3ccc(C(C)(C)C)cc3C2)n1 ZINC000511196812 340323731 /nfs/dbraw/zinc/32/37/31/340323731.db2.gz IFYDIYBRWPZPRO-CYBMUJFWSA-N 1 2 313.445 4.049 20 0 DIADLO CCc1noc([C@H](C)[N@@H+]2CCc3ccc(C(C)(C)C)cc3C2)n1 ZINC000511196813 340323760 /nfs/dbraw/zinc/32/37/60/340323760.db2.gz IFYDIYBRWPZPRO-ZDUSSCGKSA-N 1 2 313.445 4.049 20 0 DIADLO CCc1noc([C@H](C)[N@H+]2CCc3ccc(C(C)(C)C)cc3C2)n1 ZINC000511196813 340323761 /nfs/dbraw/zinc/32/37/61/340323761.db2.gz IFYDIYBRWPZPRO-ZDUSSCGKSA-N 1 2 313.445 4.049 20 0 DIADLO Cc1nc2ccccn2c1C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511568314 340330838 /nfs/dbraw/zinc/33/08/38/340330838.db2.gz UENYDSZACIEFRU-MRXNPFEDSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1nc2ccccn2c1C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511568314 340330839 /nfs/dbraw/zinc/33/08/39/340330839.db2.gz UENYDSZACIEFRU-MRXNPFEDSA-N 1 2 311.816 4.243 20 0 DIADLO CCOc1cccc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)n1 ZINC000511610250 340332206 /nfs/dbraw/zinc/33/22/06/340332206.db2.gz LMAXEFXANIFSSG-INIZCTEOSA-N 1 2 302.805 4.081 20 0 DIADLO CCOc1cccc(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)n1 ZINC000511610250 340332207 /nfs/dbraw/zinc/33/22/07/340332207.db2.gz LMAXEFXANIFSSG-INIZCTEOSA-N 1 2 302.805 4.081 20 0 DIADLO C[N@H+](CCCOc1cccc(C(C)(C)C)c1)Cc1cscn1 ZINC000511616085 340332598 /nfs/dbraw/zinc/33/25/98/340332598.db2.gz WEJNLXCLODAYRV-UHFFFAOYSA-N 1 2 318.486 4.342 20 0 DIADLO C[N@@H+](CCCOc1cccc(C(C)(C)C)c1)Cc1cscn1 ZINC000511616085 340332599 /nfs/dbraw/zinc/33/25/99/340332599.db2.gz WEJNLXCLODAYRV-UHFFFAOYSA-N 1 2 318.486 4.342 20 0 DIADLO O=C(C[N@H+]1CC[C@H]1c1ccc(Cl)cc1)c1c[nH]c2ccccc12 ZINC000511627531 340333027 /nfs/dbraw/zinc/33/30/27/340333027.db2.gz WVAUIODOCSOQAN-SFHVURJKSA-N 1 2 324.811 4.451 20 0 DIADLO O=C(C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1)c1c[nH]c2ccccc12 ZINC000511627531 340333028 /nfs/dbraw/zinc/33/30/28/340333028.db2.gz WVAUIODOCSOQAN-SFHVURJKSA-N 1 2 324.811 4.451 20 0 DIADLO Fc1c(Cl)cccc1C[N@@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000511662108 340334421 /nfs/dbraw/zinc/33/44/21/340334421.db2.gz HGGFJAJJQQBJOJ-OAHLLOKOSA-N 1 2 323.795 4.253 20 0 DIADLO Fc1c(Cl)cccc1C[N@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000511662108 340334422 /nfs/dbraw/zinc/33/44/22/340334422.db2.gz HGGFJAJJQQBJOJ-OAHLLOKOSA-N 1 2 323.795 4.253 20 0 DIADLO CSc1ccccc1CSCc1cn2ccccc2[nH+]1 ZINC000511935605 340343182 /nfs/dbraw/zinc/34/31/82/340343182.db2.gz WNWDPYMFKQMJTR-UHFFFAOYSA-N 1 2 300.452 4.490 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccon2)sc1Br ZINC000511969126 340343918 /nfs/dbraw/zinc/34/39/18/340343918.db2.gz BHXKJMKLPQQPJW-BDAKNGLRSA-N 1 2 315.236 4.219 20 0 DIADLO C[C@@H]([NH2+]C/C=C\c1ccc(F)c(F)c1)c1nc(C(C)(C)C)no1 ZINC000512013528 340345354 /nfs/dbraw/zinc/34/53/54/340345354.db2.gz BWULNGTWUZIKHO-ISALQUGTSA-N 1 2 321.371 4.009 20 0 DIADLO Fc1ccc(/C=C/CNc2cccc(-n3cc[nH+]c3)c2)cc1F ZINC000512070728 340347586 /nfs/dbraw/zinc/34/75/86/340347586.db2.gz GSAWSSNISPYFHZ-NSCUHMNNSA-N 1 2 311.335 4.276 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)C(=O)CCCC2CCCC2)c1C ZINC000172913644 340348093 /nfs/dbraw/zinc/34/80/93/340348093.db2.gz ULFMNMARGQLSCM-UHFFFAOYSA-N 1 2 318.461 4.026 20 0 DIADLO Clc1ccc(/C=C/C[N@@H+]2CCO[C@H](c3cccs3)C2)cc1 ZINC000512240565 340353499 /nfs/dbraw/zinc/35/34/99/340353499.db2.gz DUHCNGUORQNBBR-VQRJYJFOSA-N 1 2 319.857 4.488 20 0 DIADLO Clc1ccc(/C=C/C[N@H+]2CCO[C@H](c3cccs3)C2)cc1 ZINC000512240565 340353500 /nfs/dbraw/zinc/35/35/00/340353500.db2.gz DUHCNGUORQNBBR-VQRJYJFOSA-N 1 2 319.857 4.488 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](Cc1nc(C2CCCC2)no1)C1CC1 ZINC000512237594 340353577 /nfs/dbraw/zinc/35/35/77/340353577.db2.gz TZVRROFYXKCGHF-CQSZACIVSA-N 1 2 311.429 4.453 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](Cc1nc(C2CCCC2)no1)C1CC1 ZINC000512237594 340353578 /nfs/dbraw/zinc/35/35/78/340353578.db2.gz TZVRROFYXKCGHF-CQSZACIVSA-N 1 2 311.429 4.453 20 0 DIADLO Cc1ccc2c(c1)C[N@H+]([C@H](C)c1nc3ccccc3o1)CCO2 ZINC000512256827 340354297 /nfs/dbraw/zinc/35/42/97/340354297.db2.gz BACAOBNNOMGIIG-CQSZACIVSA-N 1 2 308.381 4.092 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+]([C@H](C)c1nc3ccccc3o1)CCO2 ZINC000512256827 340354298 /nfs/dbraw/zinc/35/42/98/340354298.db2.gz BACAOBNNOMGIIG-CQSZACIVSA-N 1 2 308.381 4.092 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](Cc1noc(-c2ccccc2)n1)C1CC1 ZINC000512295089 340355945 /nfs/dbraw/zinc/35/59/45/340355945.db2.gz RJWLGKLCZIRERL-OAHLLOKOSA-N 1 2 319.408 4.462 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](Cc1noc(-c2ccccc2)n1)C1CC1 ZINC000512295089 340355946 /nfs/dbraw/zinc/35/59/46/340355946.db2.gz RJWLGKLCZIRERL-OAHLLOKOSA-N 1 2 319.408 4.462 20 0 DIADLO CSc1ccc(N(C)Cc2[nH+]ccn2Cc2ccccc2)cc1 ZINC000512357126 340358647 /nfs/dbraw/zinc/35/86/47/340358647.db2.gz SIAMJJBARHVUQQ-UHFFFAOYSA-N 1 2 323.465 4.290 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000512536469 340365895 /nfs/dbraw/zinc/36/58/95/340365895.db2.gz IVWREELTXUUWGV-INIZCTEOSA-N 1 2 303.837 4.407 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[N@H+]1CCCC[C@H]1c1ncc[nH]1 ZINC000512536469 340365896 /nfs/dbraw/zinc/36/58/96/340365896.db2.gz IVWREELTXUUWGV-INIZCTEOSA-N 1 2 303.837 4.407 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cccc(O)c1Cl ZINC000512677210 340372579 /nfs/dbraw/zinc/37/25/79/340372579.db2.gz HTPKDTKFHQKYIZ-ONGXEEELSA-N 1 2 307.743 4.208 20 0 DIADLO FC(F)C1([NH2+]Cc2cnc(C3CCC3)s2)CCCCC1 ZINC000512855133 340381031 /nfs/dbraw/zinc/38/10/31/340381031.db2.gz FUPOJGLSIJEWBN-UHFFFAOYSA-N 1 2 300.418 4.468 20 0 DIADLO CC(C)Cc1ncc(C[NH2+]C2(C(F)F)CCCCC2)s1 ZINC000512890105 340382756 /nfs/dbraw/zinc/38/27/56/340382756.db2.gz IGPVEVJMSVHUTA-UHFFFAOYSA-N 1 2 302.434 4.399 20 0 DIADLO CCC[C@@H](CNc1ccc(Cn2cc[nH+]c2)cn1)c1ccccc1 ZINC000513047452 340390773 /nfs/dbraw/zinc/39/07/73/340390773.db2.gz RYVWXUYFMXQKHZ-IBGZPJMESA-N 1 2 320.440 4.322 20 0 DIADLO C[C@H]([NH2+]Cc1cc(F)cc(Cl)c1)c1c(F)cncc1F ZINC000513061912 340391610 /nfs/dbraw/zinc/39/16/10/340391610.db2.gz DKQXWXIMRJTLQQ-QMMMGPOBSA-N 1 2 300.711 4.003 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1C ZINC000174660271 340393875 /nfs/dbraw/zinc/39/38/75/340393875.db2.gz JAMASWFTPNCPJD-CQSZACIVSA-N 1 2 301.434 4.143 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1C ZINC000174660254 340393889 /nfs/dbraw/zinc/39/38/89/340393889.db2.gz JAMASWFTPNCPJD-AWEZNQCLSA-N 1 2 301.434 4.143 20 0 DIADLO C[C@@H](c1cccc(Cl)c1F)[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000513123903 340394261 /nfs/dbraw/zinc/39/42/61/340394261.db2.gz XTDYIOJSBRJWNJ-NSHDSACASA-N 1 2 321.779 4.140 20 0 DIADLO C[C@@H](c1cccc(Cl)c1F)[N@H+]1CCOc2cc(O)ccc2C1 ZINC000513123903 340394262 /nfs/dbraw/zinc/39/42/62/340394262.db2.gz XTDYIOJSBRJWNJ-NSHDSACASA-N 1 2 321.779 4.140 20 0 DIADLO Cc1noc([C@@H](C)[NH2+]Cc2sc3c(cccc3Cl)c2C)n1 ZINC000513159597 340395478 /nfs/dbraw/zinc/39/54/78/340395478.db2.gz LYNGDUDXIMMXLH-SECBINFHSA-N 1 2 321.833 4.405 20 0 DIADLO CCc1nocc1C[N@H+](CCC(F)(F)F)Cc1ccccc1 ZINC000513195914 340396531 /nfs/dbraw/zinc/39/65/31/340396531.db2.gz JUYIPTOBBNYVCP-UHFFFAOYSA-N 1 2 312.335 4.192 20 0 DIADLO CCc1nocc1C[N@@H+](CCC(F)(F)F)Cc1ccccc1 ZINC000513195914 340396532 /nfs/dbraw/zinc/39/65/32/340396532.db2.gz JUYIPTOBBNYVCP-UHFFFAOYSA-N 1 2 312.335 4.192 20 0 DIADLO Cc1ccc(NC(=O)c2nc(-c3ccccc3)cs2)c(C)[nH+]1 ZINC000176295431 340426400 /nfs/dbraw/zinc/42/64/00/340426400.db2.gz XWZDRKMSWOZKLP-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO Clc1ccc2[nH+]cc(CNc3cccc(-c4ncco4)c3)n2c1 ZINC000514067120 340444011 /nfs/dbraw/zinc/44/40/11/340444011.db2.gz HGFTWSFHELXARD-UHFFFAOYSA-N 1 2 324.771 4.255 20 0 DIADLO C[C@H]([NH2+]C/C=C/c1ccc(Cl)cc1)c1nc(C(C)(C)C)no1 ZINC000179011557 340452774 /nfs/dbraw/zinc/45/27/74/340452774.db2.gz ATBYBKRTXCZPPJ-FYJFLYSWSA-N 1 2 319.836 4.385 20 0 DIADLO CCCc1cccc(C[NH2+]Cc2ncc(-c3ccccc3)cn2)c1 ZINC000187362302 340519382 /nfs/dbraw/zinc/51/93/82/340519382.db2.gz UAIYAYVTFDOZBL-UHFFFAOYSA-N 1 2 317.436 4.386 20 0 DIADLO CCC[C@@H]1CCCC[C@@H]1NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000521603727 340525938 /nfs/dbraw/zinc/52/59/38/340525938.db2.gz LLKBHOIZBXYEKS-PMPSAXMXSA-N 1 2 318.465 4.005 20 0 DIADLO CCC[C@@H]1CCCC[C@@H]1NC(=O)N1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000521603726 340526043 /nfs/dbraw/zinc/52/60/43/340526043.db2.gz LLKBHOIZBXYEKS-OWCLPIDISA-N 1 2 318.465 4.005 20 0 DIADLO CCCN(Cc1cc(OC)cc[nH+]1)Cc1c(F)cccc1Cl ZINC000521657962 340527803 /nfs/dbraw/zinc/52/78/03/340527803.db2.gz IQMLMVCVXLFFKK-UHFFFAOYSA-N 1 2 322.811 4.295 20 0 DIADLO Cc1cc(N2CC[C@H](C(F)(F)F)C(C)(C)C2)nc(C2CC2)[nH+]1 ZINC000189590022 340538204 /nfs/dbraw/zinc/53/82/04/340538204.db2.gz AAMKMKOAEIXNPM-LBPRGKRZSA-N 1 2 313.367 4.077 20 0 DIADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)N1C2CCC1CC2 ZINC000522116134 340572820 /nfs/dbraw/zinc/57/28/20/340572820.db2.gz YAOGOMKIGKUQAZ-UHFFFAOYSA-N 1 2 309.369 4.033 20 0 DIADLO Cc1[nH+]c2ccccc2n1CC(=O)Nc1ccccc1C(C)(C)C ZINC000193827777 340583825 /nfs/dbraw/zinc/58/38/25/340583825.db2.gz SYAVEEMYZPEEHV-UHFFFAOYSA-N 1 2 321.424 4.281 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1nc(C)cs1)c1ccc(Cl)cc1 ZINC000194019802 340587998 /nfs/dbraw/zinc/58/79/98/340587998.db2.gz QQMYNQYDPBAIMY-RISCZKNCSA-N 1 2 310.850 4.143 20 0 DIADLO Cc1ccc2oc(N[C@@H](c3[nH+]ccn3C)c3ccccc3)nc2c1 ZINC000522271397 340596212 /nfs/dbraw/zinc/59/62/12/340596212.db2.gz ASOQGPJDMIPQDR-QGZVFWFLSA-N 1 2 318.380 4.071 20 0 DIADLO CCc1cnc(C[NH2+][C@@H](CC(F)(F)F)c2ccccc2)s1 ZINC000230141614 340619130 /nfs/dbraw/zinc/61/91/30/340619130.db2.gz JQWBUMKOSTWQTM-ZDUSSCGKSA-N 1 2 314.376 4.489 20 0 DIADLO CC[C@H](C)Oc1cccc(NCc2c(C)[nH+]c3ccccn32)c1 ZINC000393368212 340635863 /nfs/dbraw/zinc/63/58/63/340635863.db2.gz IOTDOKPBPXKGPB-AWEZNQCLSA-N 1 2 309.413 4.432 20 0 DIADLO CC[C@@H](CC(=O)Nc1nc(C[NH+]2CCCCC2)cs1)C(C)C ZINC000524709107 340661568 /nfs/dbraw/zinc/66/15/68/340661568.db2.gz NNEFRUUIRKHTMU-AWEZNQCLSA-N 1 2 323.506 4.140 20 0 DIADLO C[C@@H](CCc1ccc(O)cc1)[NH2+]c1ccc(-n2cccn2)cc1 ZINC000237316859 340670006 /nfs/dbraw/zinc/67/00/06/340670006.db2.gz AURNMERDBUGBPC-HNNXBMFYSA-N 1 2 307.397 4.011 20 0 DIADLO COc1ccc2c(c1)[nH+]ccc2OCc1cccc2cccnc21 ZINC000525127459 340691716 /nfs/dbraw/zinc/69/17/16/340691716.db2.gz PPDGNIUFPPGQSA-UHFFFAOYSA-N 1 2 316.360 4.371 20 0 DIADLO Cc1cnc(C(C)(C)[NH2+]Cc2nc3cc(C)ccc3s2)s1 ZINC000528451257 340719692 /nfs/dbraw/zinc/71/96/92/340719692.db2.gz WKCDFIQHENSXJV-UHFFFAOYSA-N 1 2 317.483 4.395 20 0 DIADLO CCO[C@H](C)c1noc(C[NH2+][C@@H](CC)c2cc(C)ccc2C)n1 ZINC000528802432 340735127 /nfs/dbraw/zinc/73/51/27/340735127.db2.gz SKOUTOGQJZJWFB-ZBFHGGJFSA-N 1 2 317.433 4.025 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1ccc(F)cc1F ZINC000530386971 340790020 /nfs/dbraw/zinc/79/00/20/340790020.db2.gz LRZKRLPZZHBTEE-UHFFFAOYSA-N 1 2 303.308 4.009 20 0 DIADLO CC(C)c1ccc([C@@H](C)[NH2+][C@H](CO)c2c(F)cccc2F)cc1 ZINC000537986677 340805662 /nfs/dbraw/zinc/80/56/62/340805662.db2.gz JNXHMXUULITLRC-FZKQIMNGSA-N 1 2 319.395 4.472 20 0 DIADLO CCC(CC)[C@H]([NH2+]Cc1nnsc1Cl)c1ccccc1 ZINC000538151968 340811611 /nfs/dbraw/zinc/81/16/11/340811611.db2.gz XWCCUVHRAVBYBO-AWEZNQCLSA-N 1 2 309.866 4.459 20 0 DIADLO COC(=O)c1ccoc1C[NH2+][C@H](c1ccccc1Cl)C(C)C ZINC000538189286 340812562 /nfs/dbraw/zinc/81/25/62/340812562.db2.gz XUVQEJCVCAOWRP-INIZCTEOSA-N 1 2 321.804 4.207 20 0 DIADLO COC[C@@H]([NH2+]Cc1c(Cl)cccc1Cl)c1ccccc1 ZINC000538209185 340813379 /nfs/dbraw/zinc/81/33/79/340813379.db2.gz XVGMRUWIOVRCBS-MRXNPFEDSA-N 1 2 310.224 4.471 20 0 DIADLO COC[C@H]([NH2+]Cc1c(Cl)cccc1Cl)c1ccccc1 ZINC000538209182 340813394 /nfs/dbraw/zinc/81/33/94/340813394.db2.gz XVGMRUWIOVRCBS-INIZCTEOSA-N 1 2 310.224 4.471 20 0 DIADLO FC(F)(F)[C@@H]1CCC[C@H](Nc2cccc(-n3cc[nH+]c3)c2)C1 ZINC000125968239 340818185 /nfs/dbraw/zinc/81/81/85/340818185.db2.gz GSXJWDWQXXBSSZ-OLZOCXBDSA-N 1 2 309.335 4.405 20 0 DIADLO CSc1cc(C)ccc1C[NH2+][C@H](c1ncc[nH]1)c1ccccc1 ZINC000127669562 340854877 /nfs/dbraw/zinc/85/48/77/340854877.db2.gz GTQAGZYWOOFTCB-SFHVURJKSA-N 1 2 323.465 4.319 20 0 DIADLO Fc1ccc(F)c(C[NH+]2CC(c3nc4ccccc4s3)C2)c1 ZINC000539140230 340874904 /nfs/dbraw/zinc/87/49/04/340874904.db2.gz JRJNJLYYDPIILY-UHFFFAOYSA-N 1 2 316.376 4.174 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)no1)c1ccc(F)cc1F ZINC000539288522 340879503 /nfs/dbraw/zinc/87/95/03/340879503.db2.gz LKGKUZKMGSECJV-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO CCc1cnc(C[NH2+][C@H](C)c2ccc(OCC3CC3)c(F)c2)o1 ZINC000539327952 340881294 /nfs/dbraw/zinc/88/12/94/340881294.db2.gz LBHWRXVLBMLMRH-GFCCVEGCSA-N 1 2 318.392 4.016 20 0 DIADLO Fc1ccc(F)c2c1CC[C@H]2Nc1ccc(N2CCCC2)[nH+]c1 ZINC000539657935 340895012 /nfs/dbraw/zinc/89/50/12/340895012.db2.gz FSCAFJKJZPAHGO-MRXNPFEDSA-N 1 2 315.367 4.059 20 0 DIADLO COc1cc([C@H](C)Nc2ccc(N3CCCC3)[nH+]c2)ccc1F ZINC000128564053 340897015 /nfs/dbraw/zinc/89/70/15/340897015.db2.gz HEKYWUQQHJETCY-ZDUSSCGKSA-N 1 2 315.392 4.003 20 0 DIADLO COc1cccc(C=C2CC[NH+]([C@@H](C)c3ncc(C)o3)CC2)c1 ZINC000540052277 340913209 /nfs/dbraw/zinc/91/32/09/340913209.db2.gz SIEIIAHXEHWVQN-HNNXBMFYSA-N 1 2 312.413 4.232 20 0 DIADLO Cc1cccc([C@H]([NH2+][C@@H](C)c2cncs2)c2ccccn2)c1 ZINC000540155900 340918245 /nfs/dbraw/zinc/91/82/45/340918245.db2.gz KONCIEXWQZYALD-KSSFIOAISA-N 1 2 309.438 4.287 20 0 DIADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2)no1)c1cccc(F)c1F ZINC000540426169 340930930 /nfs/dbraw/zinc/93/09/30/340930930.db2.gz BUNNJZDRNZNXLM-LBPRGKRZSA-N 1 2 314.335 4.471 20 0 DIADLO CCN(CC)c1ccc(N[C@H](C)c2ccc3c(c2)COC3)c[nH+]1 ZINC000540758932 340944912 /nfs/dbraw/zinc/94/49/12/340944912.db2.gz OTABVRGMXFPDMS-CQSZACIVSA-N 1 2 311.429 4.131 20 0 DIADLO CCc1cnccc1[C@H](C)[NH2+][C@H](C)c1nc(-c2ccccc2)no1 ZINC000541195458 340961140 /nfs/dbraw/zinc/96/11/40/340961140.db2.gz VWYJYPAXMZZJNH-UONOGXRCSA-N 1 2 322.412 4.106 20 0 DIADLO CC(C)Oc1ccc2ccccc2c1C[NH2+][C@@H](C)c1ccon1 ZINC000541726630 340981076 /nfs/dbraw/zinc/98/10/76/340981076.db2.gz BKUSECDKDHETOM-AWEZNQCLSA-N 1 2 310.397 4.466 20 0 DIADLO CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000542123148 340995904 /nfs/dbraw/zinc/99/59/04/340995904.db2.gz JNOFLEQLHFZIAW-OLZOCXBDSA-N 1 2 301.434 4.341 20 0 DIADLO Clc1ccc2c(c1)[C@@H]([N@@H+]1CCO[C@H](c3ccsc3)C1)CC2 ZINC000542279024 341003380 /nfs/dbraw/zinc/00/33/80/341003380.db2.gz COSZHDCLXKXASR-IRXDYDNUSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)[C@@H]([N@H+]1CCO[C@H](c3ccsc3)C1)CC2 ZINC000542279024 341003381 /nfs/dbraw/zinc/00/33/81/341003381.db2.gz COSZHDCLXKXASR-IRXDYDNUSA-N 1 2 319.857 4.462 20 0 DIADLO Cc1ccc([C@@H]2CCN(C(=O)Nc3ccc(C)[nH+]c3C)C2)cc1 ZINC000542396995 341006624 /nfs/dbraw/zinc/00/66/24/341006624.db2.gz FSDLMBBJXZIRON-QGZVFWFLSA-N 1 2 309.413 4.028 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2cccs2)c2cccnc2)c(F)c1 ZINC000542479796 341009367 /nfs/dbraw/zinc/00/93/67/341009367.db2.gz WFPONCDJQIBSRW-QGZVFWFLSA-N 1 2 316.376 4.301 20 0 DIADLO CC(C)c1cnc(N2CCC(CCCn3cc[nH+]c3)CC2)s1 ZINC000542554271 341013296 /nfs/dbraw/zinc/01/32/96/341013296.db2.gz ZHFBULXFIRYXHP-UHFFFAOYSA-N 1 2 318.490 4.160 20 0 DIADLO Cc1ccc(COc2ccc(C[NH2+][C@@H](C)c3ccon3)cc2)cc1 ZINC000542712538 341018668 /nfs/dbraw/zinc/01/86/68/341018668.db2.gz SMVYFUMZDPVNEC-INIZCTEOSA-N 1 2 322.408 4.413 20 0 DIADLO CCc1cccnc1[C@H](C)[NH2+]Cc1nnc(-c2ccccc2)s1 ZINC000542811810 341021765 /nfs/dbraw/zinc/02/17/65/341021765.db2.gz DUAFISPEKPJCDQ-ZDUSSCGKSA-N 1 2 324.453 4.013 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2ccco2)c2ccccc2OC)cc1 ZINC000130533991 341026875 /nfs/dbraw/zinc/02/68/75/341026875.db2.gz FCNXZOPPOWFTSB-FQEVSTJZSA-N 1 2 323.392 4.176 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2c(cccc2C)[nH]1)c1ccc(F)cc1F ZINC000130543690 341027159 /nfs/dbraw/zinc/02/71/59/341027159.db2.gz PKGDBCBXPIVDEM-HNNXBMFYSA-N 1 2 315.367 4.390 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2cccc(C)c2[nH]1)c1ccc(F)cc1F ZINC000130543690 341027160 /nfs/dbraw/zinc/02/71/60/341027160.db2.gz PKGDBCBXPIVDEM-HNNXBMFYSA-N 1 2 315.367 4.390 20 0 DIADLO C[C@@H](C(=O)Nc1cccc(Cl)c1)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000543061727 341029806 /nfs/dbraw/zinc/02/98/06/341029806.db2.gz OUGDKALBTDCNEY-STQMWFEESA-N 1 2 314.816 4.244 20 0 DIADLO C[C@@H](C(=O)Nc1cccc(Cl)c1)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000543061727 341029807 /nfs/dbraw/zinc/02/98/07/341029807.db2.gz OUGDKALBTDCNEY-STQMWFEESA-N 1 2 314.816 4.244 20 0 DIADLO CCCC[C@H](CC)C(=O)N1CCC(CCCn2cc[nH+]c2)CC1 ZINC000543096267 341031651 /nfs/dbraw/zinc/03/16/51/341031651.db2.gz ZHSPPYKIGMWYLU-SFHVURJKSA-N 1 2 319.493 4.118 20 0 DIADLO Cc1ccc(Br)c(C(=O)Nc2ccc(C)[nH+]c2C)c1 ZINC000130618455 341033009 /nfs/dbraw/zinc/03/30/09/341033009.db2.gz TZSXREBITIVCQL-UHFFFAOYSA-N 1 2 319.202 4.022 20 0 DIADLO O=C(CCCC1CCCC1)NCc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000543125525 341033066 /nfs/dbraw/zinc/03/30/66/341033066.db2.gz ZFIIVECNCQRWQX-UHFFFAOYSA-N 1 2 311.429 4.053 20 0 DIADLO CC(C)c1ccc([C@H](C)Sc2[nH+]cnc3c2cnn3C)cc1 ZINC000543149953 341034304 /nfs/dbraw/zinc/03/43/04/341034304.db2.gz KVVLLDHBFJEGBS-LBPRGKRZSA-N 1 2 312.442 4.340 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1nnsc1Cl)c1cccs1 ZINC000543484917 341047026 /nfs/dbraw/zinc/04/70/26/341047026.db2.gz HRNHNDKSDSGGJP-SECBINFHSA-N 1 2 301.868 4.130 20 0 DIADLO C[N@H+](Cc1cnc(C2CCCCC2)s1)Cc1ccccn1 ZINC000543620251 341051332 /nfs/dbraw/zinc/05/13/32/341051332.db2.gz ZNWMANAGHDPMES-UHFFFAOYSA-N 1 2 301.459 4.218 20 0 DIADLO C[N@@H+](Cc1cnc(C2CCCCC2)s1)Cc1ccccn1 ZINC000543620251 341051333 /nfs/dbraw/zinc/05/13/33/341051333.db2.gz ZNWMANAGHDPMES-UHFFFAOYSA-N 1 2 301.459 4.218 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(OCC2CCCCC2)c1)c1ccon1 ZINC000543638393 341052639 /nfs/dbraw/zinc/05/26/39/341052639.db2.gz RJLBNJSIEQCQHZ-OAHLLOKOSA-N 1 2 314.429 4.485 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(OCC2CCCCC2)c1)c1ccon1 ZINC000543638391 341052667 /nfs/dbraw/zinc/05/26/67/341052667.db2.gz RJLBNJSIEQCQHZ-HNNXBMFYSA-N 1 2 314.429 4.485 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)ccc2F)o1 ZINC000130999760 341055960 /nfs/dbraw/zinc/05/59/60/341055960.db2.gz NKNPNIOCNDPWJC-INIZCTEOSA-N 1 2 307.340 4.041 20 0 DIADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)ccc2F)o1 ZINC000130999760 341055961 /nfs/dbraw/zinc/05/59/61/341055961.db2.gz NKNPNIOCNDPWJC-INIZCTEOSA-N 1 2 307.340 4.041 20 0 DIADLO Cc1ncccc1C[N@@H+](C)[C@@H](C)c1ccccc1Br ZINC000131019653 341056521 /nfs/dbraw/zinc/05/65/21/341056521.db2.gz XJFUUABIULVLPC-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO Cc1ncccc1C[N@H+](C)[C@@H](C)c1ccccc1Br ZINC000131019653 341056522 /nfs/dbraw/zinc/05/65/22/341056522.db2.gz XJFUUABIULVLPC-ZDUSSCGKSA-N 1 2 319.246 4.346 20 0 DIADLO COc1ccc(Cl)cc1Cn1c[nH+]c2cc(C)c(C)cc21 ZINC000131133671 341062470 /nfs/dbraw/zinc/06/24/70/341062470.db2.gz RWZXXXPHXWEWKZ-UHFFFAOYSA-N 1 2 300.789 4.363 20 0 DIADLO Cc1cccc(NC(=O)[C@H](C)[N@@H+]2Cc3ccccc3[C@@H]2C)c1C ZINC000543990199 341065366 /nfs/dbraw/zinc/06/53/66/341065366.db2.gz VGPXZRDCTNLKJA-HOTGVXAUSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1cccc(NC(=O)[C@H](C)[N@H+]2Cc3ccccc3[C@@H]2C)c1C ZINC000543990199 341065367 /nfs/dbraw/zinc/06/53/67/341065367.db2.gz VGPXZRDCTNLKJA-HOTGVXAUSA-N 1 2 308.425 4.207 20 0 DIADLO CCCCS(=O)(=O)Nc1ccc([NH2+][C@H](CC)C(C)C)cc1 ZINC000544022958 341067036 /nfs/dbraw/zinc/06/70/36/341067036.db2.gz JWSPRNCBPNGAIQ-MRXNPFEDSA-N 1 2 312.479 4.075 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2coc(-c3c(F)cccc3F)n2)o1 ZINC000131237215 341067480 /nfs/dbraw/zinc/06/74/80/341067480.db2.gz XEDZUMDOEHBZKQ-UHFFFAOYSA-N 1 2 318.323 4.153 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2coc(-c3c(F)cccc3F)n2)o1 ZINC000131237215 341067481 /nfs/dbraw/zinc/06/74/81/341067481.db2.gz XEDZUMDOEHBZKQ-UHFFFAOYSA-N 1 2 318.323 4.153 20 0 DIADLO CCCCc1nc(C[N@@H+]2CC[C@@H](c3cc(C)cc(C)c3)C2)no1 ZINC000544190204 341073804 /nfs/dbraw/zinc/07/38/04/341073804.db2.gz HIAPRZRTYIVRIO-MRXNPFEDSA-N 1 2 313.445 4.019 20 0 DIADLO CCCCc1nc(C[N@H+]2CC[C@@H](c3cc(C)cc(C)c3)C2)no1 ZINC000544190204 341073805 /nfs/dbraw/zinc/07/38/05/341073805.db2.gz HIAPRZRTYIVRIO-MRXNPFEDSA-N 1 2 313.445 4.019 20 0 DIADLO CC(C)c1cnc(C[N@H+](C)CCOc2ccccc2Cl)s1 ZINC000544350656 341077638 /nfs/dbraw/zinc/07/76/38/341077638.db2.gz KUZMVLOLQIQBDU-UHFFFAOYSA-N 1 2 324.877 4.431 20 0 DIADLO CC(C)c1cnc(C[N@@H+](C)CCOc2ccccc2Cl)s1 ZINC000544350656 341077639 /nfs/dbraw/zinc/07/76/39/341077639.db2.gz KUZMVLOLQIQBDU-UHFFFAOYSA-N 1 2 324.877 4.431 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2cc(-c3cccs3)on2)cn1 ZINC000544467757 341083340 /nfs/dbraw/zinc/08/33/40/341083340.db2.gz DCDRFNUTFKGJPZ-GFCCVEGCSA-N 1 2 316.430 4.031 20 0 DIADLO CCCCc1nc(C[NH+]2CCC(c3ccccc3C)CC2)no1 ZINC000544529164 341084962 /nfs/dbraw/zinc/08/49/62/341084962.db2.gz LCASRKBFGPLTFA-UHFFFAOYSA-N 1 2 313.445 4.100 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000544562716 341085716 /nfs/dbraw/zinc/08/57/16/341085716.db2.gz MPOMMJGFMRAFGJ-KBXCAEBGSA-N 1 2 314.429 4.170 20 0 DIADLO C[C@@H](c1nc2ccccc2o1)[N@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000544562716 341085717 /nfs/dbraw/zinc/08/57/17/341085717.db2.gz MPOMMJGFMRAFGJ-KBXCAEBGSA-N 1 2 314.429 4.170 20 0 DIADLO CC[C@H]([NH2+][C@H](c1ccccc1)c1cccc(F)c1)c1ccn(C)n1 ZINC000544566408 341085822 /nfs/dbraw/zinc/08/58/22/341085822.db2.gz GLYXTMFXYKLEPX-AZUAARDMSA-N 1 2 323.415 4.390 20 0 DIADLO CCC[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1cccnc1 ZINC000544601902 341088151 /nfs/dbraw/zinc/08/81/51/341088151.db2.gz DSZCBIZLCHOXBL-GOSISDBHSA-N 1 2 310.445 4.420 20 0 DIADLO COc1cc(-c2ccccc2)ccc1C[NH2+][C@H](C)c1ccon1 ZINC000544617076 341089381 /nfs/dbraw/zinc/08/93/81/341089381.db2.gz KZHUBFGWQWXWNS-CQSZACIVSA-N 1 2 308.381 4.201 20 0 DIADLO c1cn(-c2cccc(-c3noc([C@H]4CC45CCCCC5)n3)c2)c[nH+]1 ZINC000544723899 341092042 /nfs/dbraw/zinc/09/20/42/341092042.db2.gz KHTGNYLAYKNPEJ-MRXNPFEDSA-N 1 2 320.396 4.360 20 0 DIADLO Cc1cc(-c2nc(-c3cccc(-n4cc[nH+]c4)c3)no2)sc1C ZINC000544780087 341093485 /nfs/dbraw/zinc/09/34/85/341093485.db2.gz DQYMRSBTPLRWQA-UHFFFAOYSA-N 1 2 322.393 4.268 20 0 DIADLO c1cn(Cc2cccc(-c3noc([C@@H]4CC45CCCC5)n3)c2)c[nH+]1 ZINC000544962446 341101425 /nfs/dbraw/zinc/10/14/25/341101425.db2.gz YXJASRIIMDLJNY-INIZCTEOSA-N 1 2 320.396 4.029 20 0 DIADLO CC(C)(C)CCCc1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000544966150 341101723 /nfs/dbraw/zinc/10/17/23/341101723.db2.gz KBPXGGVXJMVYDM-UHFFFAOYSA-N 1 2 324.428 4.350 20 0 DIADLO CCSCCNc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000545012832 341104122 /nfs/dbraw/zinc/10/41/22/341104122.db2.gz OWWPAPGWRRTZHG-UHFFFAOYSA-N 1 2 301.459 4.051 20 0 DIADLO c1cc2c(cccc2CNc2ccc(N3CCCCC3)c[nH+]2)[nH]1 ZINC000131640229 341105453 /nfs/dbraw/zinc/10/54/53/341105453.db2.gz AGYQJDBISNBJDG-UHFFFAOYSA-N 1 2 306.413 4.165 20 0 DIADLO C[C@H](c1noc(-c2cccc(Oc3cc[nH+]cc3)c2)n1)C1CC1 ZINC000545092799 341108067 /nfs/dbraw/zinc/10/80/67/341108067.db2.gz MLACMSDXNUCHHA-LBPRGKRZSA-N 1 2 307.353 4.437 20 0 DIADLO Cc1c[nH+]ccc1NC(=O)Cc1cc2c(ccc3ccccc23)o1 ZINC000131778241 341111451 /nfs/dbraw/zinc/11/14/51/341111451.db2.gz XRBIBSIKQQSHBV-UHFFFAOYSA-N 1 2 316.360 4.471 20 0 DIADLO Cc1cccc(C2([NH2+]Cc3noc(C(C)(C)C)n3)CCCC2)c1 ZINC000072962926 341111626 /nfs/dbraw/zinc/11/16/26/341111626.db2.gz KACILPGIWTUAKN-UHFFFAOYSA-N 1 2 313.445 4.235 20 0 DIADLO CC(C)C[C@@H](C)OCCC(=O)Nc1c[nH+]ccc1OC(C)(C)C ZINC000131839736 341112469 /nfs/dbraw/zinc/11/24/69/341112469.db2.gz PXGLHHBYRBAKAC-CQSZACIVSA-N 1 2 322.449 4.039 20 0 DIADLO Cc1ccc(C(=O)N2CC[C@@H](C)[C@@H](C)C2)cc1Oc1cc[nH+]cc1 ZINC000131864415 341112791 /nfs/dbraw/zinc/11/27/91/341112791.db2.gz XYGACXAUPDDZPJ-ZBFHGGJFSA-N 1 2 324.424 4.300 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCC[N@@H+]2Cc2ccon2)c1 ZINC000545267756 341118287 /nfs/dbraw/zinc/11/82/87/341118287.db2.gz ABPZCDIKEIJPGA-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO FC(F)(F)c1cccc([C@@H]2CCCC[N@H+]2Cc2ccon2)c1 ZINC000545267756 341118288 /nfs/dbraw/zinc/11/82/88/341118288.db2.gz ABPZCDIKEIJPGA-HNNXBMFYSA-N 1 2 310.319 4.421 20 0 DIADLO CCSc1cccc(C[NH2+]Cc2nc(C)c3ccccc3n2)c1 ZINC000545315991 341120972 /nfs/dbraw/zinc/12/09/72/341120972.db2.gz SSMMRAAKZRBLRU-UHFFFAOYSA-N 1 2 323.465 4.340 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1nc(C(C)(C)C)no1 ZINC000073984227 341124547 /nfs/dbraw/zinc/12/45/47/341124547.db2.gz FCECOALHUYTJJD-WDEREUQCSA-N 1 2 307.825 4.432 20 0 DIADLO CC[C@H](C)c1csc([C@@H]2C[N@H+](Cc3ccccc3)CCO2)n1 ZINC000132507232 341125140 /nfs/dbraw/zinc/12/51/40/341125140.db2.gz XPMQDJUTZBNVNP-YOEHRIQHSA-N 1 2 316.470 4.230 20 0 DIADLO CC[C@H](C)c1csc([C@@H]2C[N@@H+](Cc3ccccc3)CCO2)n1 ZINC000132507232 341125141 /nfs/dbraw/zinc/12/51/41/341125141.db2.gz XPMQDJUTZBNVNP-YOEHRIQHSA-N 1 2 316.470 4.230 20 0 DIADLO Cc1cccc(C)c1[C@@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000545517547 341128105 /nfs/dbraw/zinc/12/81/05/341128105.db2.gz UTBIWWGNMAXXSV-KGLIPLIRSA-N 1 2 301.434 4.396 20 0 DIADLO Cc1cccc(C)c1[C@H](C)[NH2+]Cc1nc(CCC(C)C)no1 ZINC000545518550 341128167 /nfs/dbraw/zinc/12/81/67/341128167.db2.gz NDORLZPUHZLWET-HNNXBMFYSA-N 1 2 301.434 4.126 20 0 DIADLO CCc1noc(Cn2c3ccccc3[nH+]c2C2CCCCC2)n1 ZINC000545527285 341129013 /nfs/dbraw/zinc/12/90/13/341129013.db2.gz WRTPLIGZIDGOSW-UHFFFAOYSA-N 1 2 310.401 4.078 20 0 DIADLO CC[C@@H](C)c1noc(CCn2c3ccccc3[nH+]c2C2CC2)n1 ZINC000545580972 341131496 /nfs/dbraw/zinc/13/14/96/341131496.db2.gz ODBFTINTVRHRND-GFCCVEGCSA-N 1 2 310.401 4.053 20 0 DIADLO CC[C@@H](Cc1ccccc1)c1nc(Cc2ccc(C)[nH+]c2)no1 ZINC000545632364 341134001 /nfs/dbraw/zinc/13/40/01/341134001.db2.gz QPYFANPPHHUXRY-KRWDZBQOSA-N 1 2 307.397 4.100 20 0 DIADLO Cc1ccc(Cc2noc([C@@H]3CC[C@@H]4CCCC[C@@H]4C3)n2)c[nH+]1 ZINC000545636716 341134296 /nfs/dbraw/zinc/13/42/96/341134296.db2.gz MVZLDZIBDUFBGP-GVDBMIGSSA-N 1 2 311.429 4.438 20 0 DIADLO CC[C@H](C)c1ccc([C@H]([NH2+]Cc2noc(C)n2)C(C)C)cc1 ZINC000132712120 341143243 /nfs/dbraw/zinc/14/32/43/341143243.db2.gz PXTSQPLYCWPIFJ-SCLBCKFNSA-N 1 2 301.434 4.378 20 0 DIADLO c1csc(-c2cnc(C[N@@H+]3CCc4ccsc4C3)o2)c1 ZINC000132739038 341144405 /nfs/dbraw/zinc/14/44/05/341144405.db2.gz OQPLCQJKLUMWGI-UHFFFAOYSA-N 1 2 302.424 4.023 20 0 DIADLO c1csc(-c2cnc(C[N@H+]3CCc4ccsc4C3)o2)c1 ZINC000132739038 341144406 /nfs/dbraw/zinc/14/44/06/341144406.db2.gz OQPLCQJKLUMWGI-UHFFFAOYSA-N 1 2 302.424 4.023 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)c(C)[nH+]1 ZINC000132901465 341148990 /nfs/dbraw/zinc/14/89/90/341148990.db2.gz VSWBKIIUZPROAA-HIFRSBDPSA-N 1 2 316.351 4.027 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2COc3ccc(F)cc32)cs1 ZINC000545986116 341149792 /nfs/dbraw/zinc/14/97/92/341149792.db2.gz JQVMWDKNHMOUBN-GWCFXTLKSA-N 1 2 306.406 4.190 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@H]2COc3ccc(F)cc32)cs1 ZINC000545986118 341149830 /nfs/dbraw/zinc/14/98/30/341149830.db2.gz JQVMWDKNHMOUBN-MFKMUULPSA-N 1 2 306.406 4.190 20 0 DIADLO Cc1ccc(Cc2noc(CC/C=C/c3ccccc3)n2)c[nH+]1 ZINC000546341923 341164209 /nfs/dbraw/zinc/16/42/09/341164209.db2.gz SSLWEFFVBHEHOY-WEVVVXLNSA-N 1 2 305.381 4.010 20 0 DIADLO CCc1ccc([C@H](C)Cc2nc(Cc3ccc(C)[nH+]c3)no2)cc1 ZINC000546340655 341164235 /nfs/dbraw/zinc/16/42/35/341164235.db2.gz HJNZUCGPWNTQFO-CQSZACIVSA-N 1 2 321.424 4.272 20 0 DIADLO Cc1ccc(Cc2noc(/C=C/c3cccc(Cl)c3)n2)c[nH+]1 ZINC000546344878 341164488 /nfs/dbraw/zinc/16/44/88/341164488.db2.gz LCRBMPGCFOMDRQ-BQYQJAHWSA-N 1 2 311.772 4.188 20 0 DIADLO Cc1ccc(C(=O)N2C[C@@H](C)CC[C@H]2C)cc1Oc1cc[nH+]cc1 ZINC000075285107 341173851 /nfs/dbraw/zinc/17/38/51/341173851.db2.gz BMIJKDMNSIUYRC-GOEBONIOSA-N 1 2 324.424 4.443 20 0 DIADLO Cc1ccc(C)c(C[NH2+][C@H](C)c2noc(Cc3ccccc3)n2)c1 ZINC000564307253 341178267 /nfs/dbraw/zinc/17/82/67/341178267.db2.gz XPTTVIWTFXQBDJ-MRXNPFEDSA-N 1 2 321.424 4.128 20 0 DIADLO Cc1ccc(C)c(C[NH2+][C@@H](C)c2noc(Cc3ccccc3)n2)c1 ZINC000564307252 341178283 /nfs/dbraw/zinc/17/82/83/341178283.db2.gz XPTTVIWTFXQBDJ-INIZCTEOSA-N 1 2 321.424 4.128 20 0 DIADLO C[C@@H](c1ccccc1)[N@H+](C)Cc1nc(CCc2ccccc2)no1 ZINC000075597604 341179371 /nfs/dbraw/zinc/17/93/71/341179371.db2.gz ZBWMFXONWHQWGB-INIZCTEOSA-N 1 2 321.424 4.048 20 0 DIADLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1nc(CCc2ccccc2)no1 ZINC000075597604 341179372 /nfs/dbraw/zinc/17/93/72/341179372.db2.gz ZBWMFXONWHQWGB-INIZCTEOSA-N 1 2 321.424 4.048 20 0 DIADLO C[C@H](c1ccccc1)[N@H+](C)Cc1nc(CCc2ccccc2)no1 ZINC000075597606 341179389 /nfs/dbraw/zinc/17/93/89/341179389.db2.gz ZBWMFXONWHQWGB-MRXNPFEDSA-N 1 2 321.424 4.048 20 0 DIADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1nc(CCc2ccccc2)no1 ZINC000075597606 341179390 /nfs/dbraw/zinc/17/93/90/341179390.db2.gz ZBWMFXONWHQWGB-MRXNPFEDSA-N 1 2 321.424 4.048 20 0 DIADLO C[N@H+](Cc1cccc(C(F)(F)F)c1)Cc1ccncc1Cl ZINC000075650506 341180409 /nfs/dbraw/zinc/18/04/09/341180409.db2.gz FECNWDVBMUWBBU-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1cccc(C(F)(F)F)c1)Cc1ccncc1Cl ZINC000075650506 341180410 /nfs/dbraw/zinc/18/04/10/341180410.db2.gz FECNWDVBMUWBBU-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO Cc1cc(OCc2nc(C(C)(C)C)no2)c2cccc(C)c2[nH+]1 ZINC000546886632 341185405 /nfs/dbraw/zinc/18/54/05/341185405.db2.gz XQKPBPMODPOETF-UHFFFAOYSA-N 1 2 311.385 4.111 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2nc(C(C)(C)C)no2)C1 ZINC000075842987 341186015 /nfs/dbraw/zinc/18/60/15/341186015.db2.gz JSKHVJAEMYBDLW-WFASDCNBSA-N 1 2 317.408 4.089 20 0 DIADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2nc(C(C)(C)C)no2)C1 ZINC000075842987 341186016 /nfs/dbraw/zinc/18/60/16/341186016.db2.gz JSKHVJAEMYBDLW-WFASDCNBSA-N 1 2 317.408 4.089 20 0 DIADLO Cc1ccc(N[C@H]2CCCc3ncc(C(F)(F)F)cc32)c[nH+]1 ZINC000133856171 341194273 /nfs/dbraw/zinc/19/42/73/341194273.db2.gz VYKSHCJARBAODC-HNNXBMFYSA-N 1 2 307.319 4.293 20 0 DIADLO CCC(CC)Cc1nc(-c2ccc(C)[nH+]c2N2CCCC2)no1 ZINC000547082446 341195000 /nfs/dbraw/zinc/19/50/00/341195000.db2.gz QOTIBOIACHPRRZ-UHFFFAOYSA-N 1 2 314.433 4.019 20 0 DIADLO C(=C/c1ccccc1)\c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000547104363 341196098 /nfs/dbraw/zinc/19/60/98/341196098.db2.gz RGZHUVQTIHPZIA-MDZDMXLPSA-N 1 2 314.348 4.093 20 0 DIADLO c1coc(C[NH2+]Cc2nc3c(s2)C[C@@H](c2ccccc2)CC3)c1 ZINC000547341875 341207453 /nfs/dbraw/zinc/20/74/53/341207453.db2.gz UCUVMSXKDPPGQU-HNNXBMFYSA-N 1 2 324.449 4.298 20 0 DIADLO C[C@H]([NH2+]Cc1nc2c(s1)C[C@@H](C)CC2)c1ccc(F)cc1F ZINC000134196224 341209087 /nfs/dbraw/zinc/20/90/87/341209087.db2.gz IDCDODPMQMHNEJ-QWRGUYRKSA-N 1 2 322.424 4.397 20 0 DIADLO CCC1(CC)C[N@@H+]([C@@H](C)c2ccc(Cl)cc2)CC[S@]1=O ZINC000547398376 341211142 /nfs/dbraw/zinc/21/11/42/341211142.db2.gz VIAJPYZHUVKEGE-RNODOKPDSA-N 1 2 313.894 4.024 20 0 DIADLO CCC1(CC)C[N@H+]([C@@H](C)c2ccc(Cl)cc2)CC[S@]1=O ZINC000547398376 341211143 /nfs/dbraw/zinc/21/11/43/341211143.db2.gz VIAJPYZHUVKEGE-RNODOKPDSA-N 1 2 313.894 4.024 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@@H+](Cc2ccc3ncccc3c2)C1 ZINC000547441741 341213949 /nfs/dbraw/zinc/21/39/49/341213949.db2.gz IVPMOLAMTAYLIP-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO c1ccc2c(c1)[nH]c1c2CC[N@H+](Cc2ccc3ncccc3c2)C1 ZINC000547441741 341213950 /nfs/dbraw/zinc/21/39/50/341213950.db2.gz IVPMOLAMTAYLIP-UHFFFAOYSA-N 1 2 313.404 4.274 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1cnn(C(C)(C)C)c1 ZINC000134421587 341215090 /nfs/dbraw/zinc/21/50/90/341215090.db2.gz VQJRFSICGUOVJV-UHFFFAOYSA-N 1 2 311.433 4.010 20 0 DIADLO C[C@H]1[C@@H](C(F)(F)F)CCCN1c1cc(C(F)(F)F)cc[nH+]1 ZINC000547504380 341218477 /nfs/dbraw/zinc/21/84/77/341218477.db2.gz CUWDHDQSXXYDFZ-WPRPVWTQSA-N 1 2 312.257 4.268 20 0 DIADLO C[C@@H](c1ccccc1F)N(C)Cc1[nH+]ccn1Cc1ccccc1 ZINC000077183823 341220121 /nfs/dbraw/zinc/22/01/21/341220121.db2.gz TYTBKSCMHCGMTH-INIZCTEOSA-N 1 2 323.415 4.264 20 0 DIADLO Cc1cc(NC(=O)N2CCC(c3[nH]cc[nH+]3)CC2)ccc1C1CC1 ZINC000547520894 341220149 /nfs/dbraw/zinc/22/01/49/341220149.db2.gz UIANADRORXIODA-UHFFFAOYSA-N 1 2 324.428 4.007 20 0 DIADLO COc1ccc(C[NH+]2Cc3ccccc3-c3ccccc3C2)nc1 ZINC000547672342 341226564 /nfs/dbraw/zinc/22/65/64/341226564.db2.gz MZUNODDBFJMWID-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO Cc1ccc(CSc2nnc(-c3ccc(F)cc3)o2)c(C)[nH+]1 ZINC000547821240 341234895 /nfs/dbraw/zinc/23/48/95/341234895.db2.gz TWWFDGOKYHNVRO-UHFFFAOYSA-N 1 2 315.373 4.180 20 0 DIADLO CCC1(CNC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000078588180 341244570 /nfs/dbraw/zinc/24/45/70/341244570.db2.gz UEDPAONRGJUQOA-UHFFFAOYSA-N 1 2 311.385 4.186 20 0 DIADLO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c(OC)c1 ZINC000078968815 341250922 /nfs/dbraw/zinc/25/09/22/341250922.db2.gz QRDJXLLLXYLTSS-NEPJUHHUSA-N 1 2 321.367 4.394 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000548300360 341254975 /nfs/dbraw/zinc/25/49/75/341254975.db2.gz DLYNHDXWDITAGY-XIKOKIGWSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H](c1cccc(F)c1)[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000548300360 341254976 /nfs/dbraw/zinc/25/49/76/341254976.db2.gz DLYNHDXWDITAGY-XIKOKIGWSA-N 1 2 321.342 4.238 20 0 DIADLO C[C@H]1C[C@H](C)[NH+]1Cc1cccc(Br)c1OC(F)F ZINC000548426232 341260058 /nfs/dbraw/zinc/26/00/58/341260058.db2.gz CPCCAPVHNNDYGX-IUCAKERBSA-N 1 2 320.177 4.033 20 0 DIADLO COC[C@@H](CC(C)C)[NH2+]c1ccc(N2CCSCC2)cc1C ZINC000548522236 341265630 /nfs/dbraw/zinc/26/56/30/341265630.db2.gz OTYILBSQQZJNEX-MRXNPFEDSA-N 1 2 322.518 4.021 20 0 DIADLO COC[C@@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1ccc(C)o1 ZINC000080238771 341271343 /nfs/dbraw/zinc/27/13/43/341271343.db2.gz RLCLPQCJGPBUOZ-CQSZACIVSA-N 1 2 314.212 4.372 20 0 DIADLO COC[C@H]([NH2+]Cc1cccc(Cl)c1Cl)c1ccc(C)o1 ZINC000080238535 341271357 /nfs/dbraw/zinc/27/13/57/341271357.db2.gz ZYJCLRJFCCABHV-ZDUSSCGKSA-N 1 2 314.212 4.372 20 0 DIADLO Cc1ccc(NCc2ccc(Cl)c(Br)c2)c[nH+]1 ZINC000137137847 341273070 /nfs/dbraw/zinc/27/30/70/341273070.db2.gz UQKOLCUJDYDEDN-UHFFFAOYSA-N 1 2 311.610 4.418 20 0 DIADLO Cc1ccc2nc(C[NH2+][C@H](C)c3cnn(C4CCCC4)c3)[nH]c2c1 ZINC000548858072 341278425 /nfs/dbraw/zinc/27/84/25/341278425.db2.gz AKOJLFRIBIPQQG-CQSZACIVSA-N 1 2 323.444 4.034 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000548941553 341281892 /nfs/dbraw/zinc/28/18/92/341281892.db2.gz XUTRGTWLQCIBKA-GUYCJALGSA-N 1 2 304.796 4.367 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000548941553 341281893 /nfs/dbraw/zinc/28/18/93/341281893.db2.gz XUTRGTWLQCIBKA-GUYCJALGSA-N 1 2 304.796 4.367 20 0 DIADLO O=C(NCC1(C2CC2)CCC1)c1ccccc1Oc1cc[nH+]cc1 ZINC000548993933 341283086 /nfs/dbraw/zinc/28/30/86/341283086.db2.gz YHCKMZPCKNPWSN-UHFFFAOYSA-N 1 2 322.408 4.184 20 0 DIADLO C[C@]1(c2ccccc2)C[N@H+](Cc2sccc2Cl)CCO1 ZINC000549041485 341284560 /nfs/dbraw/zinc/28/45/60/341284560.db2.gz KAESCDPCOOHCCC-MRXNPFEDSA-N 1 2 307.846 4.149 20 0 DIADLO C[C@]1(c2ccccc2)C[N@@H+](Cc2sccc2Cl)CCO1 ZINC000549041485 341284561 /nfs/dbraw/zinc/28/45/61/341284561.db2.gz KAESCDPCOOHCCC-MRXNPFEDSA-N 1 2 307.846 4.149 20 0 DIADLO Clc1ccsc1C[N@@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000549041448 341284582 /nfs/dbraw/zinc/28/45/82/341284582.db2.gz ICINEEFUZNYEQE-UHFFFAOYSA-N 1 2 302.830 4.441 20 0 DIADLO Clc1ccsc1C[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000549041448 341284583 /nfs/dbraw/zinc/28/45/83/341284583.db2.gz ICINEEFUZNYEQE-UHFFFAOYSA-N 1 2 302.830 4.441 20 0 DIADLO C[C@H](C(=O)Nc1ccc2[nH]c(C(C)(C)C)[nH+]c2c1)C(C)(F)F ZINC000549121498 341286338 /nfs/dbraw/zinc/28/63/38/341286338.db2.gz HRHVRZQGEHPFDH-SECBINFHSA-N 1 2 309.360 4.090 20 0 DIADLO Cc1[nH+]c(C(C)C)ccc1COc1nnc(-c2ccccc2)o1 ZINC000549348142 341291866 /nfs/dbraw/zinc/29/18/66/341291866.db2.gz YICDVZKEXXPUOS-UHFFFAOYSA-N 1 2 309.369 4.142 20 0 DIADLO CCCC(C)(C)[N@H+](Cc1cccs1)Cc1noc(CC)n1 ZINC000549412698 341293991 /nfs/dbraw/zinc/29/39/91/341293991.db2.gz CBIGLQSGNQXQLT-UHFFFAOYSA-N 1 2 307.463 4.274 20 0 DIADLO CCCC(C)(C)[N@@H+](Cc1cccs1)Cc1noc(CC)n1 ZINC000549412698 341293992 /nfs/dbraw/zinc/29/39/92/341293992.db2.gz CBIGLQSGNQXQLT-UHFFFAOYSA-N 1 2 307.463 4.274 20 0 DIADLO Fc1ccccc1[C@@]1(F)CC[N@H+](Cc2cnc(C3CC3)s2)C1 ZINC000549445672 341294656 /nfs/dbraw/zinc/29/46/56/341294656.db2.gz CSHGXMCJZHBWLF-QGZVFWFLSA-N 1 2 320.408 4.230 20 0 DIADLO Fc1ccccc1[C@@]1(F)CC[N@@H+](Cc2cnc(C3CC3)s2)C1 ZINC000549445672 341294657 /nfs/dbraw/zinc/29/46/57/341294657.db2.gz CSHGXMCJZHBWLF-QGZVFWFLSA-N 1 2 320.408 4.230 20 0 DIADLO CCn1cc[nH+]c1[C@H]1CCCCN1Cc1ccc(Cl)cc1F ZINC000549674913 341300255 /nfs/dbraw/zinc/30/02/55/341300255.db2.gz YLZYAVLPJCWGEV-MRXNPFEDSA-N 1 2 321.827 4.423 20 0 DIADLO Cc1[nH]c2ccccc2c1C(=O)Cn1c[nH+]c2cc(C)c(C)cc21 ZINC000549733315 341301786 /nfs/dbraw/zinc/30/17/86/341301786.db2.gz CAAWDIGLZGYSKB-UHFFFAOYSA-N 1 2 317.392 4.326 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+]2CCO[C@@H](c3cccs3)C2)o1 ZINC000245563193 341302237 /nfs/dbraw/zinc/30/22/37/341302237.db2.gz PMHJZDMXGGZRNA-XNRPHZJLSA-N 1 2 303.427 4.038 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+]2CCO[C@@H](c3cccs3)C2)o1 ZINC000245563193 341302238 /nfs/dbraw/zinc/30/22/38/341302238.db2.gz PMHJZDMXGGZRNA-XNRPHZJLSA-N 1 2 303.427 4.038 20 0 DIADLO Cc1ncccc1C[N@@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000549821883 341304223 /nfs/dbraw/zinc/30/42/23/341304223.db2.gz HKITTWWCHXGVBH-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ncccc1C[N@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000549821883 341304224 /nfs/dbraw/zinc/30/42/24/341304224.db2.gz HKITTWWCHXGVBH-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO CSCc1cnc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)s1 ZINC000550143439 341311125 /nfs/dbraw/zinc/31/11/25/341311125.db2.gz BGRCRFZXRMDERX-UHFFFAOYSA-N 1 2 324.902 4.438 20 0 DIADLO Cc1ccc(OCc2nc(C[NH2+][C@H]3CCC[C@H]3F)cs2)cc1 ZINC000550320207 341315205 /nfs/dbraw/zinc/31/52/05/341315205.db2.gz NIMTYLFNEUNCEE-CVEARBPZSA-N 1 2 320.433 4.011 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)no1 ZINC000245898803 341317669 /nfs/dbraw/zinc/31/76/69/341317669.db2.gz NOZTUKKSKRZPQT-HYSWKAIVSA-N 1 2 319.836 4.162 20 0 DIADLO Cc1cc(N2[C@H](C)C[C@@H]3CCCC[C@H]32)nc(-c2ccncc2)[nH+]1 ZINC000246121116 341327774 /nfs/dbraw/zinc/32/77/74/341327774.db2.gz IZBXKTVXPZRFDN-HYVNUMGLSA-N 1 2 308.429 4.004 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1ccc(Cl)cc1 ZINC000551011920 341329188 /nfs/dbraw/zinc/32/91/88/341329188.db2.gz HGPOAJFHJMWOGB-RDTXWAMCSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1ccc(Cl)cc1 ZINC000551011920 341329189 /nfs/dbraw/zinc/32/91/89/341329189.db2.gz HGPOAJFHJMWOGB-RDTXWAMCSA-N 1 2 301.817 4.302 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)o1 ZINC000246188364 341332533 /nfs/dbraw/zinc/33/25/33/341332533.db2.gz NWWAAQWTVHKQLZ-WQVCFCJDSA-N 1 2 303.402 4.036 20 0 DIADLO CCOc1cc(NCc2cc(-n3cc[nH+]c3)cs2)ccc1C ZINC000551568688 341345743 /nfs/dbraw/zinc/34/57/43/341345743.db2.gz ATZYTFLDZDBOIY-UHFFFAOYSA-N 1 2 313.426 4.253 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000246402652 341347570 /nfs/dbraw/zinc/34/75/70/341347570.db2.gz BOZMJFUHDGEZRO-BDJLRTHQSA-N 1 2 309.381 4.161 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000246402652 341347571 /nfs/dbraw/zinc/34/75/71/341347571.db2.gz BOZMJFUHDGEZRO-BDJLRTHQSA-N 1 2 309.381 4.161 20 0 DIADLO Cc1nc([C@H]([NH2+][C@@H](C)CCC(C)(C)C)c2ccccc2F)no1 ZINC000551788230 341351452 /nfs/dbraw/zinc/35/14/52/341351452.db2.gz ACPZATPJXCURMM-BLLLJJGKSA-N 1 2 319.424 4.411 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(N(C)c2ccccc2)nc1)c1cscn1 ZINC000552002241 341358978 /nfs/dbraw/zinc/35/89/78/341358978.db2.gz NPSOAJWNJBGJQU-AWEZNQCLSA-N 1 2 324.453 4.157 20 0 DIADLO Cc1ccccc1-c1nc(C[N@H+]2C[C@H](C)[C@H]2c2ccccc2)no1 ZINC000247388195 341364026 /nfs/dbraw/zinc/36/40/26/341364026.db2.gz LLWADSPMJWGRSD-KXBFYZLASA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccccc1-c1nc(C[N@@H+]2C[C@H](C)[C@H]2c2ccccc2)no1 ZINC000247388195 341364027 /nfs/dbraw/zinc/36/40/27/341364027.db2.gz LLWADSPMJWGRSD-KXBFYZLASA-N 1 2 319.408 4.238 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247465919 341365382 /nfs/dbraw/zinc/36/53/82/341365382.db2.gz PWBGWBVSJUYMRB-IAQYHMDHSA-N 1 2 309.381 4.161 20 0 DIADLO C[C@H](c1cc(F)ccc1F)[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000247465919 341365383 /nfs/dbraw/zinc/36/53/83/341365383.db2.gz PWBGWBVSJUYMRB-IAQYHMDHSA-N 1 2 309.381 4.161 20 0 DIADLO C[C@H](Nc1cccc(OCc2cccc(F)c2)c1)c1[nH]cc[nH+]1 ZINC000552063233 341366560 /nfs/dbraw/zinc/36/65/60/341366560.db2.gz UAOSVQUMANWZOT-ZDUSSCGKSA-N 1 2 311.360 4.301 20 0 DIADLO Cc1cccn2cc(-c3ccc(NC4CCC(O)CC4)cc3)[nH+]c12 ZINC000552066538 341366915 /nfs/dbraw/zinc/36/69/15/341366915.db2.gz NCEWGMKTCNXFLT-UHFFFAOYSA-N 1 2 321.424 4.025 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1ccc(-c2ccccc2F)o1 ZINC000552124698 341371204 /nfs/dbraw/zinc/37/12/04/341371204.db2.gz HPNVKOZIEQINQE-UHFFFAOYSA-N 1 2 314.360 4.268 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1ccc(-c2ccccc2F)o1 ZINC000552124698 341371205 /nfs/dbraw/zinc/37/12/05/341371205.db2.gz HPNVKOZIEQINQE-UHFFFAOYSA-N 1 2 314.360 4.268 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@H+](Cc3nnsc3Cl)C2)cc1 ZINC000552215587 341378742 /nfs/dbraw/zinc/37/87/42/341378742.db2.gz ZAMDGVNILNYTOG-CQSZACIVSA-N 1 2 321.877 4.134 20 0 DIADLO CCc1ccc([C@@H]2CCC[N@@H+](Cc3nnsc3Cl)C2)cc1 ZINC000552215587 341378743 /nfs/dbraw/zinc/37/87/43/341378743.db2.gz ZAMDGVNILNYTOG-CQSZACIVSA-N 1 2 321.877 4.134 20 0 DIADLO CCc1nocc1C[N@@H+](Cc1ccc(F)cc1Cl)CC1CC1 ZINC000552223442 341379365 /nfs/dbraw/zinc/37/93/65/341379365.db2.gz ZNXYVKDJZVPZGK-UHFFFAOYSA-N 1 2 322.811 4.442 20 0 DIADLO CCc1nocc1C[N@H+](Cc1ccc(F)cc1Cl)CC1CC1 ZINC000552223442 341379366 /nfs/dbraw/zinc/37/93/66/341379366.db2.gz ZNXYVKDJZVPZGK-UHFFFAOYSA-N 1 2 322.811 4.442 20 0 DIADLO Cc1nc(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)nc2ccccc12 ZINC000086232932 341379581 /nfs/dbraw/zinc/37/95/81/341379581.db2.gz KEYZUZZRNINRPH-AWEZNQCLSA-N 1 2 307.397 4.257 20 0 DIADLO Cc1nc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)nc2ccccc12 ZINC000086232932 341379582 /nfs/dbraw/zinc/37/95/82/341379582.db2.gz KEYZUZZRNINRPH-AWEZNQCLSA-N 1 2 307.397 4.257 20 0 DIADLO CCc1cnc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccccc2OC)o1 ZINC000552239506 341380387 /nfs/dbraw/zinc/38/03/87/341380387.db2.gz SALPNVUYSWOTMY-WMLDXEAASA-N 1 2 314.429 4.219 20 0 DIADLO CCc1cnc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccccc2OC)o1 ZINC000552239506 341380388 /nfs/dbraw/zinc/38/03/88/341380388.db2.gz SALPNVUYSWOTMY-WMLDXEAASA-N 1 2 314.429 4.219 20 0 DIADLO C[C@@H](Nc1cccc(OCc2ccc(F)cc2)c1)c1[nH]cc[nH+]1 ZINC000552276614 341383277 /nfs/dbraw/zinc/38/32/77/341383277.db2.gz DKXXYBINASUDEC-CYBMUJFWSA-N 1 2 311.360 4.301 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+]CC(F)(F)c1ccc(Cl)cc1 ZINC000552334968 341387328 /nfs/dbraw/zinc/38/73/28/341387328.db2.gz DNCUHDBLZZGZBP-LBPRGKRZSA-N 1 2 310.775 4.486 20 0 DIADLO Cc1ccc2[nH+]cc(CN3CC[C@H]3c3ccc(Cl)cc3)n2c1 ZINC000552343512 341388096 /nfs/dbraw/zinc/38/80/96/341388096.db2.gz DOVAPMHAEOIJTD-KRWDZBQOSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1ccc2ncc(C[N@@H+]3CC[C@H]3c3ccc(Cl)cc3)n2c1 ZINC000552343512 341388097 /nfs/dbraw/zinc/38/80/97/341388097.db2.gz DOVAPMHAEOIJTD-KRWDZBQOSA-N 1 2 311.816 4.243 20 0 DIADLO Cc1ccc2ncc(C[N@H+]3CC[C@H]3c3ccc(Cl)cc3)n2c1 ZINC000552343512 341388098 /nfs/dbraw/zinc/38/80/98/341388098.db2.gz DOVAPMHAEOIJTD-KRWDZBQOSA-N 1 2 311.816 4.243 20 0 DIADLO CCc1[nH+]c2ccccc2n1Cc1nc(-c2ccc(C)cc2)no1 ZINC000552406397 341391783 /nfs/dbraw/zinc/39/17/83/341391783.db2.gz VUNICVBITGLWQA-UHFFFAOYSA-N 1 2 318.380 4.005 20 0 DIADLO Cc1cc(F)ccc1C(=O)Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000089868827 341410313 /nfs/dbraw/zinc/41/03/13/341410313.db2.gz XGYAORTYEGKFST-UHFFFAOYSA-N 1 2 323.371 4.151 20 0 DIADLO Cc1cc(C)c(C(=O)Nc2cccc(-c3[nH+]ccn3C)c2)c(C)c1 ZINC000090368098 341414737 /nfs/dbraw/zinc/41/47/37/341414737.db2.gz MEHJKMRVGYJLCY-UHFFFAOYSA-N 1 2 319.408 4.265 20 0 DIADLO CCc1ccc(NC(=O)C[C@H](c2[nH]cc[nH+]2)c2ccccc2)cc1 ZINC000553202545 341419811 /nfs/dbraw/zinc/41/98/11/341419811.db2.gz XBYJVGFKILAOET-SFHVURJKSA-N 1 2 319.408 4.133 20 0 DIADLO Cc1cc(N2CCSCC2)ccc1[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000554087352 341443415 /nfs/dbraw/zinc/44/34/15/341443415.db2.gz BUUFCHBGSLPCKV-FUHWJXTLSA-N 1 2 302.487 4.149 20 0 DIADLO c1[nH+]c(-c2ccc(N[C@@H]3CC[C@H]3C3CC3)cc2)n2c1CCCC2 ZINC000554372542 341451852 /nfs/dbraw/zinc/45/18/52/341451852.db2.gz NQORHOCNAMGUPK-RBUKOAKNSA-N 1 2 307.441 4.487 20 0 DIADLO CC(C)(C[NH2+][C@@H](CCc1ccccc1)C(F)F)C(F)(F)F ZINC000554721460 341462121 /nfs/dbraw/zinc/46/21/21/341462121.db2.gz QWCKVXOSOKPMOY-LBPRGKRZSA-N 1 2 309.322 4.431 20 0 DIADLO Cc1[nH+]cccc1Cc1nc(-c2ccc(C(C)(C)C)cc2)no1 ZINC000554833124 341465787 /nfs/dbraw/zinc/46/57/87/341465787.db2.gz ZJOPUGFBNIFLCC-UHFFFAOYSA-N 1 2 307.397 4.328 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]CC(C)(F)F)c2cccc(Br)c21 ZINC000556230835 341498362 /nfs/dbraw/zinc/49/83/62/341498362.db2.gz ATIPAKFTUKGNNS-LDYMZIIASA-N 1 2 304.178 4.242 20 0 DIADLO Cc1c(N[C@H](C)c2cn3ccccc3[nH+]2)cnn1C1CCCC1 ZINC000556244129 341499052 /nfs/dbraw/zinc/49/90/52/341499052.db2.gz XVZPAKNPYPGTHD-CYBMUJFWSA-N 1 2 309.417 4.127 20 0 DIADLO COc1ccc([C@@H]([NH2+]Cc2cc(C)no2)c2ccc(C)cc2)cc1 ZINC000565394589 341526121 /nfs/dbraw/zinc/52/61/21/341526121.db2.gz KNGOCGVPWBDDAG-FQEVSTJZSA-N 1 2 322.408 4.179 20 0 DIADLO Cc1[nH+]c2ccccc2n1CCc1nc(CC2=CCCCC2)no1 ZINC000565917840 341542347 /nfs/dbraw/zinc/54/23/47/341542347.db2.gz YKWDTBLYNUSNQT-UHFFFAOYSA-N 1 2 322.412 4.013 20 0 DIADLO Cn1ccnc1[C@H]([NH2+]Cc1ccc(C2CC2)cc1)c1ccccc1 ZINC000567218965 341589017 /nfs/dbraw/zinc/58/90/17/341589017.db2.gz ZRXISPLCDJMFRC-HXUWFJFHSA-N 1 2 317.436 4.177 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccc(F)cn1 ZINC000312883216 341629823 /nfs/dbraw/zinc/62/98/23/341629823.db2.gz WOHWKMALNHYPEV-SSDOTTSWSA-N 1 2 305.205 4.440 20 0 DIADLO Cc1cc(N[C@@H](C[C@H]2CCOC2)c2ccccc2)nc(C2CC2)[nH+]1 ZINC000157959220 341648337 /nfs/dbraw/zinc/64/83/37/341648337.db2.gz QROJXBGGBSEPRP-QAPCUYQASA-N 1 2 323.440 4.242 20 0 DIADLO CCCCOc1ccc([C@H](C)[NH2+]CC(C)(F)F)cc1OC ZINC000568892602 341684689 /nfs/dbraw/zinc/68/46/89/341684689.db2.gz WYQNMVBBJOVPJD-LBPRGKRZSA-N 1 2 301.377 4.180 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2ccc(F)cc2F)o1 ZINC000165233803 341710422 /nfs/dbraw/zinc/71/04/22/341710422.db2.gz CYWFFXSLYLTLNY-ZBEGNZNMSA-N 1 2 309.356 4.159 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+][C@@H](COC)c1ccc(CC)o1 ZINC000165302578 341710981 /nfs/dbraw/zinc/71/09/81/341710981.db2.gz LNGSSVWQGSZZDT-YOEHRIQHSA-N 1 2 317.429 4.279 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1)c1noc(Cc2ccccc2)n1 ZINC000165364700 341711457 /nfs/dbraw/zinc/71/14/57/341711457.db2.gz SFIXFPQNTYZIPL-GJZGRUSLSA-N 1 2 307.397 4.072 20 0 DIADLO CCc1nc(C[NH2+]Cc2ccc(-c3ccco3)cc2F)cs1 ZINC000574515218 341760813 /nfs/dbraw/zinc/76/08/13/341760813.db2.gz VINLJKHKQLZSMI-UHFFFAOYSA-N 1 2 316.401 4.394 20 0 DIADLO Cc1ccc2nc(/C=C/c3[nH+]ccn3CC(F)(F)F)ccc2c1 ZINC000171539289 341779603 /nfs/dbraw/zinc/77/96/03/341779603.db2.gz XWBNASJRVYWODF-FNORWQNLSA-N 1 2 317.314 4.472 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2F)c(C)[nH+]1 ZINC000171916887 341787936 /nfs/dbraw/zinc/78/79/36/341787936.db2.gz IREMTBBFMMOGPS-HUUCEWRRSA-N 1 2 316.351 4.027 20 0 DIADLO c1ccc2c(c1)[nH]c1nc[nH+]c(N[C@H]3CCOC4(CCCC4)C3)c21 ZINC000575987173 341818657 /nfs/dbraw/zinc/81/86/57/341818657.db2.gz ZDBAMFGREGUOFX-ZDUSSCGKSA-N 1 2 322.412 4.015 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)C(=O)Nc1ccccc1 ZINC000175021219 341833866 /nfs/dbraw/zinc/83/38/66/341833866.db2.gz WLLHOBIFSWMDGP-RYUDHWBXSA-N 1 2 320.795 4.157 20 0 DIADLO CCc1ccc(C[NH2+]Cc2cc(F)c(C(F)(F)F)cc2F)o1 ZINC000576259863 341836647 /nfs/dbraw/zinc/83/66/47/341836647.db2.gz NNVQLNSVTRBRLI-UHFFFAOYSA-N 1 2 319.273 4.429 20 0 DIADLO COCC(C)(C)C[NH2+][C@H](c1cccc(OC(C)C)c1)C(F)F ZINC000576597439 341854482 /nfs/dbraw/zinc/85/44/82/341854482.db2.gz SFBPLOBQXBULHD-OAHLLOKOSA-N 1 2 315.404 4.042 20 0 DIADLO C[C@H]1C[C@@H](Nc2nc3cc(Cl)cc(Cl)c3o2)c2[nH+]ccn21 ZINC000580619051 341887764 /nfs/dbraw/zinc/88/77/64/341887764.db2.gz HLKOCJMKTUVUON-WRWORJQWSA-N 1 2 323.183 4.449 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1cccc(F)c1Br ZINC000158030202 521423230 /nfs/dbraw/zinc/42/32/30/521423230.db2.gz LIYAAUGNCHXYKA-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1cccc(F)c1Br ZINC000158030202 521423239 /nfs/dbraw/zinc/42/32/39/521423239.db2.gz LIYAAUGNCHXYKA-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC(C)c1nc(C[NH+]2CCC(F)(c3cccnc3)CC2)cs1 ZINC000342155741 517490797 /nfs/dbraw/zinc/49/07/97/517490797.db2.gz OVYXXAVPYYAQBZ-UHFFFAOYSA-N 1 2 319.449 4.122 20 0 DIADLO CCSc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1nnc(C)s1 ZINC000354973030 517750814 /nfs/dbraw/zinc/75/08/14/517750814.db2.gz VXYHORJSLGEVMW-MNOVXSKESA-N 1 2 307.488 4.370 20 0 DIADLO CC(=CC(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1)c1ccccc1 ZINC000366355961 518430051 /nfs/dbraw/zinc/43/00/51/518430051.db2.gz PCOBLFBCSLYOAV-WYMLVPIESA-N 1 2 317.392 4.427 20 0 DIADLO CC(C)(C)c1csc(C[N@H+](Cc2ccccn2)C2CC2)n1 ZINC000180873454 519081116 /nfs/dbraw/zinc/08/11/16/519081116.db2.gz MPHQUBDOIZAHLJ-UHFFFAOYSA-N 1 2 301.459 4.000 20 0 DIADLO CC(C)(C)c1csc(C[N@@H+](Cc2ccccn2)C2CC2)n1 ZINC000180873454 519081122 /nfs/dbraw/zinc/08/11/22/519081122.db2.gz MPHQUBDOIZAHLJ-UHFFFAOYSA-N 1 2 301.459 4.000 20 0 DIADLO CC(C)C[C@@H]([NH2+]Cc1ncn(-c2ccccc2)n1)c1ccccc1 ZINC000181798944 519251561 /nfs/dbraw/zinc/25/15/61/519251561.db2.gz DFVMXEVZNSZHHQ-LJQANCHMSA-N 1 2 320.440 4.144 20 0 DIADLO CC(C)[C@H](C)N(C)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000264870219 519811647 /nfs/dbraw/zinc/81/16/47/519811647.db2.gz VQKGQJPCPNNWOK-AWEZNQCLSA-N 1 2 313.401 4.382 20 0 DIADLO CC(C)c1ccc(NC(=O)N2CCCC[C@H]2c2[nH]cc[nH+]2)cc1 ZINC000175285601 519837343 /nfs/dbraw/zinc/83/73/43/519837343.db2.gz YEYVBYZQRUVONS-INIZCTEOSA-N 1 2 312.417 4.292 20 0 DIADLO CC(C)c1nc([C@@H](C)[NH2+][C@H]2CN(C)Cc3ccccc32)cs1 ZINC000364247999 519866215 /nfs/dbraw/zinc/86/62/15/519866215.db2.gz GVHNWPXKPYANHY-CJNGLKHVSA-N 1 2 315.486 4.104 20 0 DIADLO CC(C)c1nc(N2CCC[C@H](c3nc4ccccc4o3)C2)cc[nH+]1 ZINC000106464417 519877967 /nfs/dbraw/zinc/87/79/67/519877967.db2.gz YVXVJGMHDHDWOM-AWEZNQCLSA-N 1 2 322.412 4.125 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](C)c2ccc(F)c(Cl)c2)s1 ZINC000268028406 519887645 /nfs/dbraw/zinc/88/76/45/519887645.db2.gz YLNBAKHYMPLDQF-SECBINFHSA-N 1 2 313.829 4.305 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)o1 ZINC000180017957 519888049 /nfs/dbraw/zinc/88/80/49/519888049.db2.gz DWTCTGBCWQADRY-DJSGYFEHSA-N 1 2 319.836 4.333 20 0 DIADLO CC(C)c1noc(C[NH2+][C@@H](c2ccccc2F)C2CCCC2)n1 ZINC000181490700 519904675 /nfs/dbraw/zinc/90/46/75/519904675.db2.gz YQADNVVFUNVAIE-QGZVFWFLSA-N 1 2 317.408 4.353 20 0 DIADLO CC(C)n1cc[nH+]c1CNc1ccccc1N(C)C1CCCC1 ZINC000124560102 520033178 /nfs/dbraw/zinc/03/31/78/520033178.db2.gz NUNUIODYZSSGOR-UHFFFAOYSA-N 1 2 312.461 4.455 20 0 DIADLO CC(F)(F)c1cccc(NCc2[nH+]ccn2CC(F)(F)F)c1 ZINC000187587431 520174120 /nfs/dbraw/zinc/17/41/20/520174120.db2.gz KSCKXUUGBBWOSD-UHFFFAOYSA-N 1 2 319.277 4.169 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](CC)c2cccc(Cl)c2)no1 ZINC000182595419 521304958 /nfs/dbraw/zinc/30/49/58/521304958.db2.gz ZFRPJVKAAQKQQR-CQSZACIVSA-N 1 2 307.825 4.307 20 0 DIADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2ccc(F)c(C)c2)n1 ZINC000267737369 521352732 /nfs/dbraw/zinc/35/27/32/521352732.db2.gz WKAZFEXGVVUDPC-OLZOCXBDSA-N 1 2 305.397 4.272 20 0 DIADLO CC[N@H+](Cc1csc(-c2ccsc2)n1)Cc1ccncc1 ZINC000267908969 521442675 /nfs/dbraw/zinc/44/26/75/521442675.db2.gz NTOBAPGWHBXBAK-UHFFFAOYSA-N 1 2 315.467 4.289 20 0 DIADLO CC[N@@H+](Cc1csc(-c2ccsc2)n1)Cc1ccncc1 ZINC000267908969 521442683 /nfs/dbraw/zinc/44/26/83/521442683.db2.gz NTOBAPGWHBXBAK-UHFFFAOYSA-N 1 2 315.467 4.289 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2cccc(C)c2)C(C)(C)C)no1 ZINC000180792171 521517325 /nfs/dbraw/zinc/51/73/25/521517325.db2.gz MXYNMTLRRWZEFT-QGZVFWFLSA-N 1 2 301.434 4.208 20 0 DIADLO CCCc1nc(C[NH2+][C@H](c2ccccc2C)C(C)(C)C)no1 ZINC000180087039 521517432 /nfs/dbraw/zinc/51/74/32/521517432.db2.gz PELNEIXZAQCHLU-QGZVFWFLSA-N 1 2 301.434 4.208 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)no1 ZINC000180020916 521517679 /nfs/dbraw/zinc/51/76/79/521517679.db2.gz NOZTUKKSKRZPQT-KHIZAZIESA-N 1 2 319.836 4.162 20 0 DIADLO CCCc1noc(C[NH2+][C@H](c2ccccc2C)C(C)(C)C)n1 ZINC000180083209 521586200 /nfs/dbraw/zinc/58/62/00/521586200.db2.gz KJJMTSQBDGCYEP-QGZVFWFLSA-N 1 2 301.434 4.208 20 0 DIADLO CCS[C@H](C)c1noc(C[NH2+][C@H](C)c2cc(C)cc(C)c2)n1 ZINC000182876887 521729579 /nfs/dbraw/zinc/72/95/79/521729579.db2.gz NFZORZDFXPKLRH-ZIAGYGMSSA-N 1 2 319.474 4.351 20 0 DIADLO CCSc1ccc([C@@H](C)[NH2+][C@@H](C)c2nnc(C)s2)cc1 ZINC000338290158 521749759 /nfs/dbraw/zinc/74/97/59/521749759.db2.gz WAPXMEPMEBMVQG-MNOVXSKESA-N 1 2 307.488 4.370 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)C[C@H](c1ccccc1)C(F)(F)F ZINC000265183163 522078551 /nfs/dbraw/zinc/07/85/51/522078551.db2.gz HGHMASXUEGTAMB-CQSZACIVSA-N 1 2 322.330 4.319 20 0 DIADLO COC(=O)c1oc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2F)cc1C ZINC000181577229 522409904 /nfs/dbraw/zinc/40/99/04/522409904.db2.gz USAALIDTCDJGDL-MNOVXSKESA-N 1 2 323.339 4.065 20 0 DIADLO COc1cc(Cl)c(Cl)cc1NCc1[nH+]ccn1C(C)C ZINC000190448380 522524711 /nfs/dbraw/zinc/52/47/11/522524711.db2.gz MNVSPCOHJAVCNE-UHFFFAOYSA-N 1 2 314.216 4.392 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1cccc(Cl)c1 ZINC000182587068 522701620 /nfs/dbraw/zinc/70/16/20/522701620.db2.gz PQVJDHIJCCBDKL-HZMBPMFUSA-N 1 2 305.809 4.402 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)o1 ZINC000181808137 522744363 /nfs/dbraw/zinc/74/43/63/522744363.db2.gz RUMOQTGNDTWCFT-AWEZNQCLSA-N 1 2 323.396 4.275 20 0 DIADLO CC[C@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000182307303 522745826 /nfs/dbraw/zinc/74/58/26/522745826.db2.gz UMIFKULKZKDBIH-YGRLFVJLSA-N 1 2 305.809 4.402 20 0 DIADLO CC[C@H](Nc1ccc(OC(F)F)c(Cl)c1)c1[nH+]ccn1C ZINC000182781377 522768292 /nfs/dbraw/zinc/76/82/92/522768292.db2.gz FPZJOPRRTWUCCK-NSHDSACASA-N 1 2 315.751 4.238 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1cccc(Cl)c1 ZINC000182587086 522917857 /nfs/dbraw/zinc/91/78/57/522917857.db2.gz PQVJDHIJCCBDKL-IINYFYTJSA-N 1 2 305.809 4.402 20 0 DIADLO CCc1nocc1C[N@H+](C)Cc1ccccc1Oc1cccnc1 ZINC000339600294 522931907 /nfs/dbraw/zinc/93/19/07/522931907.db2.gz HHTIDZTZGBOMIV-UHFFFAOYSA-N 1 2 323.396 4.056 20 0 DIADLO CCc1nocc1C[N@@H+](C)Cc1ccccc1Oc1cccnc1 ZINC000339600294 522931916 /nfs/dbraw/zinc/93/19/16/522931916.db2.gz HHTIDZTZGBOMIV-UHFFFAOYSA-N 1 2 323.396 4.056 20 0 DIADLO CC[C@@H](Nc1ccc(C)c(Br)c1)c1[nH+]ccn1C ZINC000182726891 522956862 /nfs/dbraw/zinc/95/68/62/522956862.db2.gz ICZVRTUMUKZXAU-CYBMUJFWSA-N 1 2 308.223 4.054 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1csc(-c2ccco2)n1 ZINC000130144423 522966122 /nfs/dbraw/zinc/96/61/22/522966122.db2.gz GGYXQLQPILLBNZ-OAHLLOKOSA-N 1 2 313.426 4.381 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1csc(-c2ccco2)n1 ZINC000130144423 522966135 /nfs/dbraw/zinc/96/61/35/522966135.db2.gz GGYXQLQPILLBNZ-OAHLLOKOSA-N 1 2 313.426 4.381 20 0 DIADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1cc(-c2cccs2)on1 ZINC000130187348 522968103 /nfs/dbraw/zinc/96/81/03/522968103.db2.gz UMPQJUVNHGXAJL-OAHLLOKOSA-N 1 2 313.426 4.381 20 0 DIADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cc(-c2cccs2)on1 ZINC000130187348 522968117 /nfs/dbraw/zinc/96/81/17/522968117.db2.gz UMPQJUVNHGXAJL-OAHLLOKOSA-N 1 2 313.426 4.381 20 0 DIADLO COCc1ccc(CNc2c[nH+]ccc2OC(C)(C)C)cc1 ZINC000338318406 522999648 /nfs/dbraw/zinc/99/96/48/522999648.db2.gz BATNEUWYXZGVPV-UHFFFAOYSA-N 1 2 300.402 4.017 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nc([C@H](C)OC)no1 ZINC000267019292 523088742 /nfs/dbraw/zinc/08/87/42/523088742.db2.gz JVTCQTYHLKQMLP-FZMZJTMJSA-N 1 2 323.824 4.014 20 0 DIADLO CC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nc([C@H](C)OC)no1 ZINC000267019292 523088748 /nfs/dbraw/zinc/08/87/48/523088748.db2.gz JVTCQTYHLKQMLP-FZMZJTMJSA-N 1 2 323.824 4.014 20 0 DIADLO CCn1cc([C@@H](C)Nc2cccc([NH+]3CCCCCC3)c2)cn1 ZINC000179959999 523462244 /nfs/dbraw/zinc/46/22/44/523462244.db2.gz ZAVODPYGROBWFH-MRXNPFEDSA-N 1 2 312.461 4.457 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)cs1 ZINC000336846169 523471359 /nfs/dbraw/zinc/47/13/59/523471359.db2.gz KKZIQFOAMCRNPV-ONGXEEELSA-N 1 2 322.396 4.013 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)cs1 ZINC000336846169 523471364 /nfs/dbraw/zinc/47/13/64/523471364.db2.gz KKZIQFOAMCRNPV-ONGXEEELSA-N 1 2 322.396 4.013 20 0 DIADLO CO[C@@H](C)c1noc(C[N@H+](C)[C@@H](C)c2ccc(C(C)C)cc2)n1 ZINC000267037658 523481040 /nfs/dbraw/zinc/48/10/40/523481040.db2.gz OBAJQKICKXSVKW-KBPBESRZSA-N 1 2 317.433 4.093 20 0 DIADLO CO[C@@H](C)c1noc(C[N@@H+](C)[C@@H](C)c2ccc(C(C)C)cc2)n1 ZINC000267037658 523481048 /nfs/dbraw/zinc/48/10/48/523481048.db2.gz OBAJQKICKXSVKW-KBPBESRZSA-N 1 2 317.433 4.093 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nc(C(F)(F)F)cs1)c1nccs1 ZINC000157617705 523661972 /nfs/dbraw/zinc/66/19/72/523661972.db2.gz NLHCUZJLJRBZAS-LLVKDONJSA-N 1 2 321.393 4.033 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)cs1 ZINC000336846167 523912154 /nfs/dbraw/zinc/91/21/54/523912154.db2.gz KKZIQFOAMCRNPV-KOLCDFICSA-N 1 2 322.396 4.013 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)cs1 ZINC000336846167 523912157 /nfs/dbraw/zinc/91/21/57/523912157.db2.gz KKZIQFOAMCRNPV-KOLCDFICSA-N 1 2 322.396 4.013 20 0 DIADLO C[C@@H](CC1CC1)NC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000112738374 524426680 /nfs/dbraw/zinc/42/66/80/524426680.db2.gz HYXGEHRZLQUXGU-ZDUSSCGKSA-N 1 2 311.385 4.184 20 0 DIADLO Cc1cccc(Cl)c1NC(=O)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000132348134 524484862 /nfs/dbraw/zinc/48/48/62/524484862.db2.gz TUZZTRSXJVSMKP-ZDUSSCGKSA-N 1 2 318.808 4.131 20 0 DIADLO C[C@@H]1CC[C@H](C)CN1C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000337955754 524649213 /nfs/dbraw/zinc/64/92/13/524649213.db2.gz PGRTWUZNEAIORL-LSDHHAIUSA-N 1 2 310.397 4.135 20 0 DIADLO COc1ccc([NH2+][C@@H](C)CSC(C)(C)C)c(OC)c1OC ZINC000182869666 524700702 /nfs/dbraw/zinc/70/07/02/524700702.db2.gz IUEZLABAJRLAQQ-NSHDSACASA-N 1 2 313.463 4.045 20 0 DIADLO COc1ccccc1[C@@H](CC(C)C)[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000367598717 524731330 /nfs/dbraw/zinc/73/13/30/524731330.db2.gz GCGAKTDOJHCESA-SJLPKXTDSA-N 1 2 313.445 4.173 20 0 DIADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cc(-c3ccccc3)on2)o1 ZINC000237573926 524862131 /nfs/dbraw/zinc/86/21/31/524862131.db2.gz WUFYGJLVLLXBCN-GUYCJALGSA-N 1 2 308.381 4.348 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2cc(-c3ccccc3)on2)o1 ZINC000237667979 524969570 /nfs/dbraw/zinc/96/95/70/524969570.db2.gz WUFYGJLVLLXBCN-SUMWQHHRSA-N 1 2 308.381 4.348 20 0 DIADLO C[C@@H](N(C)C(=O)c1cccc(Oc2cc[nH+]cc2)c1)C1(C)CC1 ZINC000175649581 524982076 /nfs/dbraw/zinc/98/20/76/524982076.db2.gz XGPKJBPAVWLCOS-CQSZACIVSA-N 1 2 310.397 4.135 20 0 DIADLO Cc1ccc(NC(=O)N2CCC[C@@H]2c2ccsc2)c(C)[nH+]1 ZINC000152375561 525127783 /nfs/dbraw/zinc/12/77/83/525127783.db2.gz ALCMYSDXFJAHDO-OAHLLOKOSA-N 1 2 301.415 4.129 20 0 DIADLO Cc1cc(N[C@@H](C)c2ncc(-c3ccccc3)o2)nc(C2CC2)[nH+]1 ZINC000265762979 525293817 /nfs/dbraw/zinc/29/38/17/525293817.db2.gz BLIKACCWYIEZEF-ZDUSSCGKSA-N 1 2 320.396 4.491 20 0 DIADLO Cc1ccc(N[C@H]2CCc3ccc(Br)cc32)c[nH+]1 ZINC000302397216 525320475 /nfs/dbraw/zinc/32/04/75/525320475.db2.gz NXEHQHCMVQFPKT-HNNXBMFYSA-N 1 2 303.203 4.252 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2coc(-c3cccs3)n2)o1 ZINC000237373452 525343120 /nfs/dbraw/zinc/34/31/20/525343120.db2.gz GMJJSQBYWGITTA-RISCZKNCSA-N 1 2 314.410 4.409 20 0 DIADLO C[C@H]([NH2+]Cc1cnc(Cl)s1)c1c(F)cccc1Cl ZINC000181744611 525476605 /nfs/dbraw/zinc/47/66/05/525476605.db2.gz SJOYTAAQTREKGA-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO C[C@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1cccc2ccccc21 ZINC000181667454 525497685 /nfs/dbraw/zinc/49/76/85/525497685.db2.gz RMBWPOOLMYJJIG-ZDUSSCGKSA-N 1 2 309.413 4.371 20 0 DIADLO COc1ccc2c(c1)CCC[C@H]2CC(=O)Nc1ccc(C)[nH+]c1C ZINC000119320739 525519794 /nfs/dbraw/zinc/51/97/94/525519794.db2.gz BPABDVXEYQAXGP-INIZCTEOSA-N 1 2 324.424 4.156 20 0 DIADLO Cc1c(Br)cccc1NCc1[nH+]ccn1C(C)C ZINC000124337149 525529441 /nfs/dbraw/zinc/52/94/41/525529441.db2.gz BKRCRLRJWDLCKC-UHFFFAOYSA-N 1 2 308.223 4.147 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccccc1Br)c1cscn1 ZINC000162295162 525533871 /nfs/dbraw/zinc/53/38/71/525533871.db2.gz CDNLQSAWOMDDHE-UWVGGRQHSA-N 1 2 311.248 4.317 20 0 DIADLO C[C@@H]([NH2+]Cc1cccs1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000364146067 525544272 /nfs/dbraw/zinc/54/42/72/525544272.db2.gz OSYVIFLARGLIAB-SNVBAGLBSA-N 1 2 319.817 4.302 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2ccccc21)c1noc(-c2ccccc2)n1 ZINC000124454332 525639726 /nfs/dbraw/zinc/63/97/26/525639726.db2.gz XQAFSRGTGDHRFS-RDTXWAMCSA-N 1 2 319.408 4.465 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1nc2c(s1)CCCC2 ZINC000182489908 525653949 /nfs/dbraw/zinc/65/39/49/525653949.db2.gz GNNMRFLMOFDZEB-LBPRGKRZSA-N 1 2 301.459 4.261 20 0 DIADLO Cc1ccnc([C@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)c1 ZINC000368609227 525714382 /nfs/dbraw/zinc/71/43/82/525714382.db2.gz WSEYAKLEIVBKAO-YOEHRIQHSA-N 1 2 309.438 4.287 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2[C@@H](C)c2nc3ccccc3c(=O)[nH]2)o1 ZINC000265354081 525825762 /nfs/dbraw/zinc/82/57/62/525825762.db2.gz KTRFSMDZVZZTKR-BBRMVZONSA-N 1 2 323.396 4.135 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2[C@@H](C)c2nc3ccccc3c(=O)[nH]2)o1 ZINC000265354081 525825772 /nfs/dbraw/zinc/82/57/72/525825772.db2.gz KTRFSMDZVZZTKR-BBRMVZONSA-N 1 2 323.396 4.135 20 0 DIADLO Cc1c([C@@H](C)[NH2+]Cc2cc(-c3ccccc3)on2)cnn1C(C)C ZINC000191253219 525898170 /nfs/dbraw/zinc/89/81/70/525898170.db2.gz MBDQCKASIRPYPG-CQSZACIVSA-N 1 2 324.428 4.278 20 0 DIADLO Cc1c([C@H](C)[NH2+]Cc2cc(-c3ccccc3)on2)cnn1C(C)C ZINC000191253237 525918971 /nfs/dbraw/zinc/91/89/71/525918971.db2.gz MBDQCKASIRPYPG-AWEZNQCLSA-N 1 2 324.428 4.278 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc4ccc(Cl)cc4[nH]3)ccc2[nH+]1 ZINC000339267372 525950827 /nfs/dbraw/zinc/95/08/27/525950827.db2.gz CNLYWLPNASEGFI-UHFFFAOYSA-N 1 2 324.771 4.030 20 0 DIADLO Cc1cnc(C[N@H+]2CCC[C@H]2c2nc3ccccc3n2C(C)C)o1 ZINC000266876731 526019969 /nfs/dbraw/zinc/01/99/69/526019969.db2.gz UNSOBNXOIMZEQQ-KRWDZBQOSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1cnc(C[N@@H+]2CCC[C@H]2c2nc3ccccc3n2C(C)C)o1 ZINC000266876731 526019979 /nfs/dbraw/zinc/01/99/79/526019979.db2.gz UNSOBNXOIMZEQQ-KRWDZBQOSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1cnc(C[NH2+][C@@H](CC(F)(F)F)c2ccc(F)cc2)s1 ZINC000180558114 526043281 /nfs/dbraw/zinc/04/32/81/526043281.db2.gz JDZCONROCAYYAM-LBPRGKRZSA-N 1 2 318.339 4.374 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1csc(C2CCCC2)n1 ZINC000180793385 526120334 /nfs/dbraw/zinc/12/03/34/526120334.db2.gz MIHGQWWWQPBGAC-ZDUSSCGKSA-N 1 2 301.459 4.389 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1csc(C2CCCC2)n1 ZINC000180793385 526120340 /nfs/dbraw/zinc/12/03/40/526120340.db2.gz MIHGQWWWQPBGAC-ZDUSSCGKSA-N 1 2 301.459 4.389 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000128066724 526126518 /nfs/dbraw/zinc/12/65/18/526126518.db2.gz VLSYXRZWAWROKP-GFCCVEGCSA-N 1 2 316.355 4.019 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1nc2ccccc2n1C(F)F ZINC000128066724 526126526 /nfs/dbraw/zinc/12/65/26/526126526.db2.gz VLSYXRZWAWROKP-GFCCVEGCSA-N 1 2 316.355 4.019 20 0 DIADLO Cc1nnc(C[NH2+][C@H](c2cccc(Cl)c2)C2CCCC2)o1 ZINC000181043656 526345131 /nfs/dbraw/zinc/34/51/31/526345131.db2.gz SYAYQWWCFQNIOV-INIZCTEOSA-N 1 2 305.809 4.053 20 0 DIADLO Fc1ccc2c(c1)[C@@H]([NH2+][C@H](c1ncc[nH]1)c1ccccc1)CCC2 ZINC000127801574 526373936 /nfs/dbraw/zinc/37/39/36/526373936.db2.gz AOVUCWLLNFIMBN-OALUTQOASA-N 1 2 321.399 4.305 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)o1 ZINC000180264480 526405290 /nfs/dbraw/zinc/40/52/90/526405290.db2.gz CZCBCUOHHMYDDX-LKFCYVNXSA-N 1 2 311.788 4.218 20 0 DIADLO c1c[nH]c([C@@H]([NH2+][C@@H]2CCCc3sccc32)c2ccccc2)n1 ZINC000129722912 526407132 /nfs/dbraw/zinc/40/71/32/526407132.db2.gz LHRHBTRMLUWZDT-WBVHZDCISA-N 1 2 309.438 4.228 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2sccc2Br)n1 ZINC000070733670 526413586 /nfs/dbraw/zinc/41/35/86/526413586.db2.gz ILNYCZMBPSDVJR-MRVPVSSYSA-N 1 2 317.277 4.126 20 0 DIADLO Cc1csc([C@H]2CCCC[N@H+]2Cc2nc(C)sc2C)n1 ZINC000336824799 526441236 /nfs/dbraw/zinc/44/12/36/526441236.db2.gz WDMANPAIBBYZGJ-CQSZACIVSA-N 1 2 307.488 4.252 20 0 DIADLO Cc1csc([C@H]2CCCC[N@@H+]2Cc2nc(C)sc2C)n1 ZINC000336824799 526441238 /nfs/dbraw/zinc/44/12/38/526441238.db2.gz WDMANPAIBBYZGJ-CQSZACIVSA-N 1 2 307.488 4.252 20 0 DIADLO c1cc2c(ccnc2N2CCC(c3[nH]c4ccccc4[nH+]3)CC2)o1 ZINC000156743665 526441743 /nfs/dbraw/zinc/44/17/43/526441743.db2.gz UKDQZYOBCXOPFL-UHFFFAOYSA-N 1 2 318.380 4.088 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@H]1CCc2ccc(-c3ccccc3)cc21 ZINC000189576681 526556821 /nfs/dbraw/zinc/55/68/21/526556821.db2.gz LBVZHUKIBKMMJL-FQEVSTJZSA-N 1 2 303.409 4.162 20 0 DIADLO c1coc(-c2ncc(C[NH2+]Cc3nc(C4CC4)cs3)s2)c1 ZINC000193154331 526562422 /nfs/dbraw/zinc/56/24/22/526562422.db2.gz RFAPUSLYSSFXGQ-UHFFFAOYSA-N 1 2 317.439 4.027 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000127655072 526739409 /nfs/dbraw/zinc/73/94/09/526739409.db2.gz ZPLDAKUXNIFJQH-AWEZNQCLSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+](C)[C@@H](C)c1ccncc1 ZINC000127655072 526739413 /nfs/dbraw/zinc/73/94/13/526739413.db2.gz ZPLDAKUXNIFJQH-AWEZNQCLSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1nc(C)c([C@@H](C)[NH2+][C@@H](c2nc(C3CC3)no2)C(C)C)s1 ZINC000180852511 526745511 /nfs/dbraw/zinc/74/55/11/526745511.db2.gz WFNIIFMVJCRGMB-ZWNOBZJWSA-N 1 2 320.462 4.068 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000102655752 526751342 /nfs/dbraw/zinc/75/13/42/526751342.db2.gz OPFCJGXUTNZRIS-NSHDSACASA-N 1 2 302.399 4.498 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[N@H+](C)[C@@H](C)c1ccco1 ZINC000102655752 526751346 /nfs/dbraw/zinc/75/13/46/526751346.db2.gz OPFCJGXUTNZRIS-NSHDSACASA-N 1 2 302.399 4.498 20 0 DIADLO Cc1nc(C)c([C@H](C)[NH2+][C@@H](c2nc(C3CC3)no2)C(C)C)s1 ZINC000180852526 526754592 /nfs/dbraw/zinc/75/45/92/526754592.db2.gz WFNIIFMVJCRGMB-GXFFZTMASA-N 1 2 320.462 4.068 20 0 DIADLO Cc1nc(C2CCCC2)sc1C(=O)Nc1ccc(C)[nH+]c1C ZINC000119349382 526774517 /nfs/dbraw/zinc/77/45/17/526774517.db2.gz SBDSHBMBDSXASQ-UHFFFAOYSA-N 1 2 315.442 4.373 20 0 DIADLO Cc1sc(C[NH2+]Cc2cccc(O)c2Cl)nc1C(C)C ZINC000339255325 526877532 /nfs/dbraw/zinc/87/75/32/526877532.db2.gz RTHVAJSACTUEQL-UHFFFAOYSA-N 1 2 310.850 4.224 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCCC2)no1 ZINC000182544805 526890842 /nfs/dbraw/zinc/89/08/42/526890842.db2.gz MZOYSHGKXJQBCS-MRXNPFEDSA-N 1 2 305.809 4.053 20 0 DIADLO Cc1nc([C@H]([NH2+]C2CCCCC2)c2ccc(Cl)cc2)no1 ZINC000182682131 527071011 /nfs/dbraw/zinc/07/10/11/527071011.db2.gz UYKQARSHSGACPH-OAHLLOKOSA-N 1 2 305.809 4.043 20 0 DIADLO Cc1nc([C@H]([NH2+][C@H](C)CC(C)C)c2ccc(Cl)cc2)no1 ZINC000179897789 527071528 /nfs/dbraw/zinc/07/15/28/527071528.db2.gz PLQSVCZNWFJSKD-IAQYHMDHSA-N 1 2 307.825 4.145 20 0 DIADLO O=C(Nc1cccc2c1CCCC2)N1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000267296322 527377755 /nfs/dbraw/zinc/37/77/55/527377755.db2.gz DLCOTPBLKVNKHY-KRWDZBQOSA-N 1 2 324.428 4.048 20 0 DIADLO Cn1cc[nH+]c1[C@H](Nc1ccc2nc(C3CC3)oc2c1)C1CC1 ZINC000128731226 527466983 /nfs/dbraw/zinc/46/69/83/527466983.db2.gz DEQGMSFWAPKPSK-MRXNPFEDSA-N 1 2 308.385 4.002 20 0 DIADLO FC(F)(F)c1cnc(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)s1 ZINC000366034175 527688810 /nfs/dbraw/zinc/68/88/10/527688810.db2.gz ZZXAGNQFKPIEJK-UWVGGRQHSA-N 1 2 322.421 4.022 20 0 DIADLO FC(F)(F)c1cnc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)s1 ZINC000366034175 527688812 /nfs/dbraw/zinc/68/88/12/527688812.db2.gz ZZXAGNQFKPIEJK-UWVGGRQHSA-N 1 2 322.421 4.022 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)n1 ZINC000155336672 527690246 /nfs/dbraw/zinc/69/02/46/527690246.db2.gz XUSBAAIOQMHSHF-VHSXEESVSA-N 1 2 322.421 4.022 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)n1 ZINC000155336672 527690249 /nfs/dbraw/zinc/69/02/49/527690249.db2.gz XUSBAAIOQMHSHF-VHSXEESVSA-N 1 2 322.421 4.022 20 0 DIADLO CC(C)CC[C@H]([NH2+]Cc1ncnn1-c1ccccc1)c1ccoc1 ZINC000286952438 534944411 /nfs/dbraw/zinc/94/44/11/534944411.db2.gz BPVFOHNQBYTOPH-SFHVURJKSA-N 1 2 324.428 4.127 20 0 DIADLO CC(C)CC[C@H]([NH2+]Cc1nncn1-c1ccccc1)c1ccoc1 ZINC000285827475 534945018 /nfs/dbraw/zinc/94/50/18/534945018.db2.gz WRZFZGQEVFWJLS-SFHVURJKSA-N 1 2 324.428 4.127 20 0 DIADLO CC(C)(C)OCc1cc(C[NH2+]Cc2ccc3occc3c2)no1 ZINC000286049155 534990648 /nfs/dbraw/zinc/99/06/48/534990648.db2.gz QZGGRVMYNGPBHO-UHFFFAOYSA-N 1 2 314.385 4.026 20 0 DIADLO CC(C)(C)OCc1cc(CNc2ccc3ccccc3[nH+]2)no1 ZINC000275039604 534992315 /nfs/dbraw/zinc/99/23/15/534992315.db2.gz YBSVKNZAIWGZEJ-UHFFFAOYSA-N 1 2 311.385 4.150 20 0 DIADLO CCCCc1nc(C[NH2+][C@H](CC)c2ccc(Cl)s2)no1 ZINC000273478886 535103676 /nfs/dbraw/zinc/10/36/76/535103676.db2.gz HNTKOONGPRWQSK-SNVBAGLBSA-N 1 2 313.854 4.368 20 0 DIADLO CC(C)[N@@H+](Cc1coc(-c2cccs2)n1)Cc1ccco1 ZINC000299361416 535117231 /nfs/dbraw/zinc/11/72/31/535117231.db2.gz IYIASPHSEFTVPS-UHFFFAOYSA-N 1 2 302.399 4.407 20 0 DIADLO CC(C)[N@H+](Cc1coc(-c2cccs2)n1)Cc1ccco1 ZINC000299361416 535117236 /nfs/dbraw/zinc/11/72/36/535117236.db2.gz IYIASPHSEFTVPS-UHFFFAOYSA-N 1 2 302.399 4.407 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(-c2ccccc2)no1)c1nc(C)cs1 ZINC000273529341 535805310 /nfs/dbraw/zinc/80/53/10/535805310.db2.gz SNLLTMFAUQKTOJ-OAHLLOKOSA-N 1 2 313.426 4.347 20 0 DIADLO CCc1noc(C)c1C[NH2+][C@H](C)c1ncc(-c2ccccc2)o1 ZINC000273414070 535885187 /nfs/dbraw/zinc/88/51/87/535885187.db2.gz UCMZWABENRGELK-GFCCVEGCSA-N 1 2 311.385 4.051 20 0 DIADLO CCc1c[nH+]ccc1NC(=O)CC1CCC(C(F)(F)F)CC1 ZINC000272934147 536089044 /nfs/dbraw/zinc/08/90/44/536089044.db2.gz HHZHKDHEBARZJH-UHFFFAOYSA-N 1 2 314.351 4.341 20 0 DIADLO Cc1cc(C)c(Nc2cc(Br)cc(C)c2N)c[nH+]1 ZINC001213515881 1037324591 /nfs/dbraw/zinc/32/45/91/1037324591.db2.gz QQLJCDWKBXSTJW-UHFFFAOYSA-N 1 2 306.207 4.095 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)C[C@@]1(C)O ZINC001231480411 1053760218 /nfs/dbraw/zinc/76/02/18/1053760218.db2.gz UAKLPKAOMDGZIQ-YMTOWFKASA-N 1 2 322.663 4.240 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)C[C@@]1(C)O ZINC001231480411 1053760231 /nfs/dbraw/zinc/76/02/31/1053760231.db2.gz UAKLPKAOMDGZIQ-YMTOWFKASA-N 1 2 322.663 4.240 20 0 DIADLO Cc1cc(F)c(C[NH+]2CC3(C2)CCCC3)c(Br)c1 ZINC001235461102 1054724044 /nfs/dbraw/zinc/72/40/44/1054724044.db2.gz WCHWODLNNGBPNL-UHFFFAOYSA-N 1 2 312.226 4.273 20 0 DIADLO COc1ccc(Cl)cc1C(C)(C)[NH2+]C/C(Cl)=C/Cl ZINC001473571977 1061256355 /nfs/dbraw/zinc/25/63/55/1061256355.db2.gz VVIJZKRPIOQBTI-YFHOEESVSA-N 1 2 308.636 4.492 20 0 DIADLO CCc1nocc1CN(C)c1cc[nH+]c2c(Cl)cccc12 ZINC000579737646 1035545266 /nfs/dbraw/zinc/54/52/66/1035545266.db2.gz QDZCMMNHXQVDFY-UHFFFAOYSA-N 1 2 301.777 4.075 20 0 DIADLO Cc1cc(NC(=O)C(c2ccccc2)c2ccccc2)cc[nH+]1 ZINC000010163137 1035548427 /nfs/dbraw/zinc/54/84/27/1035548427.db2.gz ZWIFOZPYCYCABK-UHFFFAOYSA-N 1 2 302.377 4.161 20 0 DIADLO CC(F)(F)c1ccc(C[NH2+]Cc2ncc(Cl)s2)cc1 ZINC000339417385 1035558712 /nfs/dbraw/zinc/55/87/12/1035558712.db2.gz KBFAIYSEXSSCLX-UHFFFAOYSA-N 1 2 302.777 4.198 20 0 DIADLO Cc1nc(N2CC(c3ccccc3)C2)cc(C2CCCCC2)[nH+]1 ZINC001167063733 1035692124 /nfs/dbraw/zinc/69/21/24/1035692124.db2.gz DIECUQSOVFJWHV-UHFFFAOYSA-N 1 2 307.441 4.437 20 0 DIADLO CC(C)c1cccc(NC(=O)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000029441895 1035697127 /nfs/dbraw/zinc/69/71/27/1035697127.db2.gz WSOWBHVEAYSLMB-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc(Cl)cc(Cl)c3)ccc2[nH+]1 ZINC000624710880 1035805768 /nfs/dbraw/zinc/80/57/68/1035805768.db2.gz PLNITHOAMIIMOG-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)c(F)c1)[C@H]1CCC=CCCC1 ZINC001125300809 1035832950 /nfs/dbraw/zinc/83/29/50/1035832950.db2.gz DKEFKDJYVJVHQT-AWEZNQCLSA-N 1 2 313.376 4.086 20 0 DIADLO CCC[C@H]1CCC[C@@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001125300832 1035836645 /nfs/dbraw/zinc/83/66/45/1035836645.db2.gz FAOPAVUSUWMZLM-ZFWWWQNUSA-N 1 2 315.392 4.166 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)C[C@@H](C)CC(C)(C)C ZINC000683256925 1035923923 /nfs/dbraw/zinc/92/39/23/1035923923.db2.gz RESPQCNTUBSOTK-MRXNPFEDSA-N 1 2 321.509 4.147 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1cnn2ccccc12 ZINC000179734072 1035926052 /nfs/dbraw/zinc/92/60/52/1035926052.db2.gz GSCDAXRLQOBCED-ZDUSSCGKSA-N 1 2 322.437 4.137 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cnn2ccccc12 ZINC000179734072 1035926062 /nfs/dbraw/zinc/92/60/62/1035926062.db2.gz GSCDAXRLQOBCED-ZDUSSCGKSA-N 1 2 322.437 4.137 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1cnn2ccccc12 ZINC000179734082 1035928138 /nfs/dbraw/zinc/92/81/38/1035928138.db2.gz GSCDAXRLQOBCED-CYBMUJFWSA-N 1 2 322.437 4.137 20 0 DIADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cnn2ccccc12 ZINC000179734082 1035928148 /nfs/dbraw/zinc/92/81/48/1035928148.db2.gz GSCDAXRLQOBCED-CYBMUJFWSA-N 1 2 322.437 4.137 20 0 DIADLO Nc1ccc(SCc2ccc(-n3cc[nH+]c3)cc2)c(Cl)c1 ZINC000037204545 1035959279 /nfs/dbraw/zinc/95/92/79/1035959279.db2.gz MXXQEOWZXIYHOH-UHFFFAOYSA-N 1 2 315.829 4.400 20 0 DIADLO CC(C)[N@H+](Cc1ccnnc1)Cc1ccc(Cl)cc1Cl ZINC001139985561 1035988393 /nfs/dbraw/zinc/98/83/93/1035988393.db2.gz UFQUFWCHBZFJCP-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO CC(C)[N@@H+](Cc1ccnnc1)Cc1ccc(Cl)cc1Cl ZINC001139985561 1035988406 /nfs/dbraw/zinc/98/84/06/1035988406.db2.gz UFQUFWCHBZFJCP-UHFFFAOYSA-N 1 2 310.228 4.194 20 0 DIADLO CSc1nccc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)n1 ZINC001140037885 1036108879 /nfs/dbraw/zinc/10/88/79/1036108879.db2.gz GXVMSQBJZVCHRB-HNNXBMFYSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1nccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)n1 ZINC001140037885 1036108885 /nfs/dbraw/zinc/10/88/85/1036108885.db2.gz GXVMSQBJZVCHRB-HNNXBMFYSA-N 1 2 319.861 4.189 20 0 DIADLO CC(C)c1ccc(N2CCO[C@@](C)(c3ccc(F)cc3)C2)[nH+]c1 ZINC001167140395 1036178491 /nfs/dbraw/zinc/17/84/91/1036178491.db2.gz YUFFEMQJGZQTBU-LJQANCHMSA-N 1 2 314.404 4.096 20 0 DIADLO CC(C)c1nsc(C[N@@H+](Cc2ccccc2)CC2CCC2)n1 ZINC001167157630 1036225292 /nfs/dbraw/zinc/22/52/92/1036225292.db2.gz MFXUKLUJCZYSKC-UHFFFAOYSA-N 1 2 315.486 4.464 20 0 DIADLO CC(C)c1nsc(C[N@H+](Cc2ccccc2)CC2CCC2)n1 ZINC001167157630 1036225306 /nfs/dbraw/zinc/22/53/06/1036225306.db2.gz MFXUKLUJCZYSKC-UHFFFAOYSA-N 1 2 315.486 4.464 20 0 DIADLO COc1cc2[nH+]c(N3CC4(C3)CCCCC4)ccc2c(OC)c1 ZINC001167184040 1036251684 /nfs/dbraw/zinc/25/16/84/1036251684.db2.gz VBXBDNUOXCEZIX-UHFFFAOYSA-N 1 2 312.413 4.023 20 0 DIADLO COC(=O)C[N@H+](CCC1=CCCCC1)Cc1ccc(Cl)cc1 ZINC001167199121 1036263748 /nfs/dbraw/zinc/26/37/48/1036263748.db2.gz FEMRGKGTKQYLNX-UHFFFAOYSA-N 1 2 321.848 4.206 20 0 DIADLO COC(=O)C[N@@H+](CCC1=CCCCC1)Cc1ccc(Cl)cc1 ZINC001167199121 1036263756 /nfs/dbraw/zinc/26/37/56/1036263756.db2.gz FEMRGKGTKQYLNX-UHFFFAOYSA-N 1 2 321.848 4.206 20 0 DIADLO Cc1ncc([C@@H](C)[N@H+](C)Cc2cc(Cl)ccc2F)c(C)n1 ZINC000639107945 1036286544 /nfs/dbraw/zinc/28/65/44/1036286544.db2.gz VBAJIIMFYMNASI-LLVKDONJSA-N 1 2 307.800 4.079 20 0 DIADLO Cc1ncc([C@@H](C)[N@@H+](C)Cc2cc(Cl)ccc2F)c(C)n1 ZINC000639107945 1036286556 /nfs/dbraw/zinc/28/65/56/1036286556.db2.gz VBAJIIMFYMNASI-LLVKDONJSA-N 1 2 307.800 4.079 20 0 DIADLO COc1cc(Cl)ccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001209906651 1036292928 /nfs/dbraw/zinc/29/29/28/1036292928.db2.gz VYMGTWRXMICRLH-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO CC[N@H+](Cc1ccsc1C(=O)OC)Cc1ccc(Cl)cc1 ZINC001167244191 1036314510 /nfs/dbraw/zinc/31/45/10/1036314510.db2.gz JITLXCHRCHGUPM-UHFFFAOYSA-N 1 2 323.845 4.210 20 0 DIADLO CC[N@@H+](Cc1ccsc1C(=O)OC)Cc1ccc(Cl)cc1 ZINC001167244191 1036314526 /nfs/dbraw/zinc/31/45/26/1036314526.db2.gz JITLXCHRCHGUPM-UHFFFAOYSA-N 1 2 323.845 4.210 20 0 DIADLO CC(C)(C)c1ccc2c(c1)CC[N@@H+](Cc1cc3n(n1)CCCC3)C2 ZINC001167270691 1036353001 /nfs/dbraw/zinc/35/30/01/1036353001.db2.gz MDYVKXBQDUQQQM-UHFFFAOYSA-N 1 2 323.484 4.075 20 0 DIADLO CC(C)(C)c1ccc2c(c1)CC[N@H+](Cc1cc3n(n1)CCCC3)C2 ZINC001167270691 1036353021 /nfs/dbraw/zinc/35/30/21/1036353021.db2.gz MDYVKXBQDUQQQM-UHFFFAOYSA-N 1 2 323.484 4.075 20 0 DIADLO CCOC(=O)C[N@H+](Cc1cc(Cl)cc2ccccc21)C1CC1 ZINC001167276705 1036358364 /nfs/dbraw/zinc/35/83/64/1036358364.db2.gz UYYLHONHWWFITH-UHFFFAOYSA-N 1 2 317.816 4.021 20 0 DIADLO CCOC(=O)C[N@@H+](Cc1cc(Cl)cc2ccccc21)C1CC1 ZINC001167276705 1036358374 /nfs/dbraw/zinc/35/83/74/1036358374.db2.gz UYYLHONHWWFITH-UHFFFAOYSA-N 1 2 317.816 4.021 20 0 DIADLO Cc1csc(C[NH+]2CCC(=Cc3cccc(F)c3)CC2)n1 ZINC000340370766 1036379676 /nfs/dbraw/zinc/37/96/76/1036379676.db2.gz GLXCPVLATPIAQI-UHFFFAOYSA-N 1 2 302.418 4.270 20 0 DIADLO FC(F)(F)c1ccncc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001210094433 1036387842 /nfs/dbraw/zinc/38/78/42/1036387842.db2.gz UXZDSWCWZIJKOF-UHFFFAOYSA-N 1 2 318.302 4.089 20 0 DIADLO Fc1ccccc1-c1nc(C[N@@H+]2CCC[C@@H]2c2ccncc2)co1 ZINC000625269208 1036396075 /nfs/dbraw/zinc/39/60/75/1036396075.db2.gz BVTNIWROSNDQNK-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccccc1-c1nc(C[N@H+]2CCC[C@@H]2c2ccncc2)co1 ZINC000625269208 1036396088 /nfs/dbraw/zinc/39/60/88/1036396088.db2.gz BVTNIWROSNDQNK-GOSISDBHSA-N 1 2 323.371 4.213 20 0 DIADLO Cc1ccc(C[NH2+][C@@H]2COc3cc(F)cc(F)c32)cc1Cl ZINC000683471521 1036423238 /nfs/dbraw/zinc/42/32/38/1036423238.db2.gz VPUZASLKAGOKAJ-CQSZACIVSA-N 1 2 309.743 4.150 20 0 DIADLO Cc1ccc(C[N@H+](Cc2ccc(C(F)(F)F)cn2)C2CC2)o1 ZINC000683519749 1036438319 /nfs/dbraw/zinc/43/83/19/1036438319.db2.gz QKHXEFQIWZOTIK-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2ccc(C(F)(F)F)cn2)C2CC2)o1 ZINC000683519749 1036438329 /nfs/dbraw/zinc/43/83/29/1036438329.db2.gz QKHXEFQIWZOTIK-UHFFFAOYSA-N 1 2 310.319 4.166 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2cc(O)ccc2Cl)C2CC2)n1 ZINC000625303261 1036477854 /nfs/dbraw/zinc/47/78/54/1036477854.db2.gz XGAMJNZVKHCXJW-CQSZACIVSA-N 1 2 308.834 4.051 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCn2ccnc21)c1ccc(Cl)cc1Cl ZINC000655693279 1036483642 /nfs/dbraw/zinc/48/36/42/1036483642.db2.gz WIRFCBSYFLKLHN-IINYFYTJSA-N 1 2 310.228 4.376 20 0 DIADLO Fc1cccc([C@@H]([NH2+][C@@H]2CCCn3ccnc32)c2ccccc2)c1 ZINC000655723269 1036506730 /nfs/dbraw/zinc/50/67/30/1036506730.db2.gz MMIRGNZWMPWOBD-MOPGFXCFSA-N 1 2 321.399 4.236 20 0 DIADLO Cc1ccc(NC(=O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)c(N(C)C)[nH+]1 ZINC001266516178 1036590565 /nfs/dbraw/zinc/59/05/65/1036590565.db2.gz UALTXHYNQJCBKR-OWCLPIDISA-N 1 2 315.461 4.001 20 0 DIADLO Cc1[nH+]cc(Nc2cccc(C(F)(F)F)c2Cl)cc1N ZINC001210289905 1036594561 /nfs/dbraw/zinc/59/45/61/1036594561.db2.gz ARFISTZIYOBVMU-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Cc1ccc(-c2noc([C@@H](C)[NH2+]Cc3cccs3)n2)cc1F ZINC000579987712 1036692754 /nfs/dbraw/zinc/69/27/54/1036692754.db2.gz AWRGFFLMIUIAQO-LLVKDONJSA-N 1 2 317.389 4.096 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H](C)c2csc(C(C)C)n2)ccn1 ZINC000348639133 1036744858 /nfs/dbraw/zinc/74/48/58/1036744858.db2.gz GNRISLCXKKSBDZ-VXGBXAGGSA-N 1 2 305.447 4.082 20 0 DIADLO Cc1cc(C)c(C(=O)N(Cc2ccccc2)CC2CCC2)c(C)[nH+]1 ZINC001125400268 1036768749 /nfs/dbraw/zinc/76/87/49/1036768749.db2.gz BYMZVTIJBMIJCO-UHFFFAOYSA-N 1 2 322.452 4.449 20 0 DIADLO Cc1ccc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)cn1 ZINC000444029728 1036770384 /nfs/dbraw/zinc/77/03/84/1036770384.db2.gz ILHSAZRPCICYMM-UHFFFAOYSA-N 1 2 318.424 4.202 20 0 DIADLO C[C@H]([NH2+][C@@H](CC(F)(F)F)c1ccccc1)c1nccs1 ZINC000080266773 1036772675 /nfs/dbraw/zinc/77/26/75/1036772675.db2.gz GTDPLLXSUMUYJI-JQWIXIFHSA-N 1 2 300.349 4.487 20 0 DIADLO CCc1ccc([C@@H](CC)[NH2+]Cc2ncn(-c3ccccc3)n2)cc1 ZINC000340521063 1036779134 /nfs/dbraw/zinc/77/91/34/1036779134.db2.gz CDUTZIWEXKBQOB-LJQANCHMSA-N 1 2 320.440 4.071 20 0 DIADLO CCCCn1c(SCC2=CCCC2)nnc1[C@@H](CC)[NH+](C)C ZINC000647114103 1036844425 /nfs/dbraw/zinc/84/44/25/1036844425.db2.gz JKNPNEOZYFYHIW-OAHLLOKOSA-N 1 2 322.522 4.293 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Cl)s2)C[C@@H](c2ccccc2)O1 ZINC000063581214 1036871759 /nfs/dbraw/zinc/87/17/59/1036871759.db2.gz LZEVYYJEPUMQIA-DOMZBBRYSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Cl)s2)C[C@@H](c2ccccc2)O1 ZINC000063581214 1036871778 /nfs/dbraw/zinc/87/17/78/1036871778.db2.gz LZEVYYJEPUMQIA-DOMZBBRYSA-N 1 2 307.846 4.364 20 0 DIADLO c1csc(C[N@@H+](Cc2nc(-c3cccs3)no2)C2CC2)c1 ZINC000044898145 1036924942 /nfs/dbraw/zinc/92/49/42/1036924942.db2.gz VTOQBILYRWOXJH-UHFFFAOYSA-N 1 2 317.439 4.024 20 0 DIADLO c1csc(C[N@H+](Cc2nc(-c3cccs3)no2)C2CC2)c1 ZINC000044898145 1036924963 /nfs/dbraw/zinc/92/49/63/1036924963.db2.gz VTOQBILYRWOXJH-UHFFFAOYSA-N 1 2 317.439 4.024 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccc3[nH+]ccn3c2)cc1OC(C)C ZINC000683787175 1036925924 /nfs/dbraw/zinc/92/59/24/1036925924.db2.gz RWWNVOHGVWKEOH-UHFFFAOYSA-N 1 2 324.384 4.074 20 0 DIADLO C[C@H]([NH2+]Cc1cc(Br)c(Cl)s1)c1ccon1 ZINC000309754936 1036930908 /nfs/dbraw/zinc/93/09/08/1036930908.db2.gz HKOIZTCCOZBFPN-LURJTMIESA-N 1 2 321.627 4.003 20 0 DIADLO CCSc1cccc(C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000153200576 1036944152 /nfs/dbraw/zinc/94/41/52/1036944152.db2.gz IFSMDOUNXJDEOS-UHFFFAOYSA-N 1 2 300.427 4.371 20 0 DIADLO O=C(Nc1ccc(C2CCC2)cc1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000683804631 1036946779 /nfs/dbraw/zinc/94/67/79/1036946779.db2.gz CESKQJZJBDSRDR-GOSISDBHSA-N 1 2 324.428 4.020 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1nc(C)sc1C)c1ccc(Cl)cc1 ZINC000683822470 1036972327 /nfs/dbraw/zinc/97/23/27/1036972327.db2.gz UWDLIWBSLDCAIJ-BMIGLBTASA-N 1 2 324.877 4.452 20 0 DIADLO Cc1csc([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccncc2)n1 ZINC000316354196 1037041597 /nfs/dbraw/zinc/04/15/97/1037041597.db2.gz ZNCZIEDKUWYWMA-RHSMWYFYSA-N 1 2 309.438 4.287 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@@H](c2ccccc2)c2ccncc2)n1 ZINC000316355173 1037042351 /nfs/dbraw/zinc/04/23/51/1037042351.db2.gz ZNCZIEDKUWYWMA-YOEHRIQHSA-N 1 2 309.438 4.287 20 0 DIADLO Fc1cccc(F)c1C1([NH2+]Cc2cnc(C3CC3)s2)CCC1 ZINC000623844398 1037068941 /nfs/dbraw/zinc/06/89/41/1037068941.db2.gz UVRNJWLFXWVXTN-UHFFFAOYSA-N 1 2 320.408 4.468 20 0 DIADLO Cc1nc(C)c(C[N@@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000683899247 1037079235 /nfs/dbraw/zinc/07/92/35/1037079235.db2.gz ZQFWLOVFDDLOTI-OAHLLOKOSA-N 1 2 322.861 4.235 20 0 DIADLO Cc1nc(C)c(C[N@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000683899247 1037079247 /nfs/dbraw/zinc/07/92/47/1037079247.db2.gz ZQFWLOVFDDLOTI-OAHLLOKOSA-N 1 2 322.861 4.235 20 0 DIADLO C[C@@H]([NH2+]Cc1cc2ccccc2[nH]1)c1nc(C2CCCCC2)no1 ZINC000683928716 1037116322 /nfs/dbraw/zinc/11/63/22/1037116322.db2.gz AJIBIUGNVKJGAA-CYBMUJFWSA-N 1 2 324.428 4.449 20 0 DIADLO Nc1cccc(COc2ccc(-c3[nH+]cc4n3CCCC4)cc2)c1 ZINC000580431456 1037131281 /nfs/dbraw/zinc/13/12/81/1037131281.db2.gz NNLQHTXAJAJFEL-UHFFFAOYSA-N 1 2 319.408 4.048 20 0 DIADLO Cc1cccc(C[N@H+](Cc2ncc(F)cc2F)C2CC2)c1C ZINC001207101138 1037136559 /nfs/dbraw/zinc/13/65/59/1037136559.db2.gz HZGFWEQXIRQQHZ-UHFFFAOYSA-N 1 2 302.368 4.141 20 0 DIADLO Cc1cccc(C[N@@H+](Cc2ncc(F)cc2F)C2CC2)c1C ZINC001207101138 1037136568 /nfs/dbraw/zinc/13/65/68/1037136568.db2.gz HZGFWEQXIRQQHZ-UHFFFAOYSA-N 1 2 302.368 4.141 20 0 DIADLO CC[C@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)C[C@@H](C)O1 ZINC001167421661 1037219679 /nfs/dbraw/zinc/21/96/79/1037219679.db2.gz ZPBKGZGCGGJVOQ-YPMHNXCESA-N 1 2 302.245 4.035 20 0 DIADLO Clc1ccc(Cl)c(C[NH2+]Cc2ccccn2)c1Cl ZINC000035054851 1037201437 /nfs/dbraw/zinc/20/14/37/1037201437.db2.gz HJYHDHYKQGJSLM-UHFFFAOYSA-N 1 2 301.604 4.332 20 0 DIADLO CC[C@H]1COCC[N@@H+]1Cc1ccc(Oc2ccccc2)c(F)c1 ZINC001167421512 1037217691 /nfs/dbraw/zinc/21/76/91/1037217691.db2.gz VKEDOZJODHTYTL-INIZCTEOSA-N 1 2 315.388 4.229 20 0 DIADLO CC[C@H]1COCC[N@H+]1Cc1ccc(Oc2ccccc2)c(F)c1 ZINC001167421512 1037217699 /nfs/dbraw/zinc/21/76/99/1037217699.db2.gz VKEDOZJODHTYTL-INIZCTEOSA-N 1 2 315.388 4.229 20 0 DIADLO CC[C@H]1C[N@H+](CCc2cccc(Cl)c2Cl)C[C@@H](C)O1 ZINC001167421661 1037219669 /nfs/dbraw/zinc/21/96/69/1037219669.db2.gz ZPBKGZGCGGJVOQ-YPMHNXCESA-N 1 2 302.245 4.035 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@@H+]2Cc2cc(C(C)=O)no2)o1 ZINC000580615109 1037224215 /nfs/dbraw/zinc/22/42/15/1037224215.db2.gz CPUDYPNHIGVFOF-KRWDZBQOSA-N 1 2 316.401 4.150 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@H+]2Cc2cc(C(C)=O)no2)o1 ZINC000580615109 1037224227 /nfs/dbraw/zinc/22/42/27/1037224227.db2.gz CPUDYPNHIGVFOF-KRWDZBQOSA-N 1 2 316.401 4.150 20 0 DIADLO c1cc(C[N@H+](Cc2ccccc2)Cc2ccc3cc[nH]c3c2)n[nH]1 ZINC001167429897 1037247019 /nfs/dbraw/zinc/24/70/19/1037247019.db2.gz OBHSAVWMHSHDNT-UHFFFAOYSA-N 1 2 316.408 4.093 20 0 DIADLO c1cc(C[N@@H+](Cc2ccccc2)Cc2ccc3cc[nH]c3c2)n[nH]1 ZINC001167429897 1037247033 /nfs/dbraw/zinc/24/70/33/1037247033.db2.gz OBHSAVWMHSHDNT-UHFFFAOYSA-N 1 2 316.408 4.093 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc3nc(C)sc3c1)C2 ZINC000656275146 1037261195 /nfs/dbraw/zinc/26/11/95/1037261195.db2.gz KGDWIXZVEFRIEN-UHFFFAOYSA-N 1 2 310.422 4.129 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc3nc(C)sc3c1)C2 ZINC000656275146 1037261211 /nfs/dbraw/zinc/26/12/11/1037261211.db2.gz KGDWIXZVEFRIEN-UHFFFAOYSA-N 1 2 310.422 4.129 20 0 DIADLO Cc1noc(C[N@@H+](C)Cc2sc3c(cccc3Cl)c2C)n1 ZINC000656278675 1037267918 /nfs/dbraw/zinc/26/79/18/1037267918.db2.gz MUACGXITLCKORJ-UHFFFAOYSA-N 1 2 321.833 4.187 20 0 DIADLO Cc1noc(C[N@H+](C)Cc2sc3c(cccc3Cl)c2C)n1 ZINC000656278675 1037267931 /nfs/dbraw/zinc/26/79/31/1037267931.db2.gz MUACGXITLCKORJ-UHFFFAOYSA-N 1 2 321.833 4.187 20 0 DIADLO Cc1cc(C)c(NC(=O)c2cnc(CC(C)(C)C)s2)c(C)[nH+]1 ZINC001125474755 1037304109 /nfs/dbraw/zinc/30/41/09/1037304109.db2.gz CKZYDCWAAFSMCM-UHFFFAOYSA-N 1 2 317.458 4.304 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000580861417 1037336107 /nfs/dbraw/zinc/33/61/07/1037336107.db2.gz ZSCFJKIMVYUHBA-LBPRGKRZSA-N 1 2 309.837 4.035 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000580861417 1037336121 /nfs/dbraw/zinc/33/61/21/1037336121.db2.gz ZSCFJKIMVYUHBA-LBPRGKRZSA-N 1 2 309.837 4.035 20 0 DIADLO CC(C)(C)c1cc(C[NH+]2CCC(F)(c3ccccc3)CC2)no1 ZINC000580920475 1037355997 /nfs/dbraw/zinc/35/59/97/1037355997.db2.gz IQWZCBHALVHOHE-UHFFFAOYSA-N 1 2 316.420 4.433 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1cc(C)c(F)c(C)c1)CC2 ZINC001143385059 1037359293 /nfs/dbraw/zinc/35/92/93/1037359293.db2.gz MYHZMIBUGVHJSL-UHFFFAOYSA-N 1 2 311.400 4.203 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1cc(C)c(F)c(C)c1)CC2 ZINC001143385059 1037359303 /nfs/dbraw/zinc/35/93/03/1037359303.db2.gz MYHZMIBUGVHJSL-UHFFFAOYSA-N 1 2 311.400 4.203 20 0 DIADLO Clc1ccc([C@@H]([NH2+]Cc2ncccn2)C2CC2)cc1Cl ZINC000581202949 1037468870 /nfs/dbraw/zinc/46/88/70/1037468870.db2.gz ZVSGAOISUDGPDB-HNNXBMFYSA-N 1 2 308.212 4.024 20 0 DIADLO Fc1cc(Br)ccc1C[N@H+]1CCC[C@@H](C(F)F)C1 ZINC001204553709 1037485653 /nfs/dbraw/zinc/48/56/53/1037485653.db2.gz BPAKEFHNBLGKBZ-SNVBAGLBSA-N 1 2 322.168 4.065 20 0 DIADLO Fc1cc(Br)ccc1C[N@@H+]1CCC[C@@H](C(F)F)C1 ZINC001204553709 1037485660 /nfs/dbraw/zinc/48/56/60/1037485660.db2.gz BPAKEFHNBLGKBZ-SNVBAGLBSA-N 1 2 322.168 4.065 20 0 DIADLO c1csc([C@H]([NH2+]Cc2ncc[nH]2)c2ccc3c(c2)CCCC3)c1 ZINC000067667499 1037517991 /nfs/dbraw/zinc/51/79/91/1037517991.db2.gz KTBYRNIUORPBCO-LJQANCHMSA-N 1 2 323.465 4.229 20 0 DIADLO COc1nc2ccccc2cc1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000581298034 1037519584 /nfs/dbraw/zinc/51/95/84/1037519584.db2.gz WPQZAVPRKUEZHA-UHFFFAOYSA-N 1 2 319.408 4.214 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CC[C@H](c3c(F)cccc3F)C2)no1 ZINC000581338582 1037540581 /nfs/dbraw/zinc/54/05/81/1037540581.db2.gz IRAUMPARNYLRED-LBPRGKRZSA-N 1 2 320.383 4.240 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)no1 ZINC000581338582 1037540598 /nfs/dbraw/zinc/54/05/98/1037540598.db2.gz IRAUMPARNYLRED-LBPRGKRZSA-N 1 2 320.383 4.240 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CC(C)(C)[C@H]2[C@H]2CCCO2)cs1 ZINC000558469959 1037562579 /nfs/dbraw/zinc/56/25/79/1037562579.db2.gz KNPKCXKYGZJUNW-NVXWUHKLSA-N 1 2 322.518 4.121 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CC(C)(C)[C@H]2[C@H]2CCCO2)cs1 ZINC000558469959 1037562599 /nfs/dbraw/zinc/56/25/99/1037562599.db2.gz KNPKCXKYGZJUNW-NVXWUHKLSA-N 1 2 322.518 4.121 20 0 DIADLO CCc1nc(C)c(C[NH2+]Cc2oc3ccccc3c2Cl)o1 ZINC000631141384 1037578972 /nfs/dbraw/zinc/57/89/72/1037578972.db2.gz DFSYIHRDEHQSCP-UHFFFAOYSA-N 1 2 304.777 4.235 20 0 DIADLO Cc1c[nH+]c(CN[C@@H](C)c2cc(F)c(Cl)cc2Cl)n1C ZINC000341058957 1037660906 /nfs/dbraw/zinc/66/09/06/1037660906.db2.gz WJVLAHBMVSCAEC-VIFPVBQESA-N 1 2 316.207 4.025 20 0 DIADLO CC(C)[N@H+](Cc1nc(C2CCC2)no1)[C@@H](C)c1ccsc1 ZINC000639683401 1037671945 /nfs/dbraw/zinc/67/19/45/1037671945.db2.gz FDZAGUCUTJKPOI-LBPRGKRZSA-N 1 2 305.447 4.370 20 0 DIADLO CC(C)[N@@H+](Cc1nc(C2CCC2)no1)[C@@H](C)c1ccsc1 ZINC000639683401 1037671960 /nfs/dbraw/zinc/67/19/60/1037671960.db2.gz FDZAGUCUTJKPOI-LBPRGKRZSA-N 1 2 305.447 4.370 20 0 DIADLO Cc1c[nH+]c(CN[C@H](C)c2c(Cl)ccc(F)c2Cl)n1C ZINC000341147407 1037691201 /nfs/dbraw/zinc/69/12/01/1037691201.db2.gz MCDSBZKWFNSTSY-SECBINFHSA-N 1 2 316.207 4.025 20 0 DIADLO Cc1cn(C)nc1C[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F ZINC000723517386 1037708628 /nfs/dbraw/zinc/70/86/28/1037708628.db2.gz KSSFVZIEDFCQTL-VIFPVBQESA-N 1 2 316.207 4.025 20 0 DIADLO CCc1nc(C[NH2+][C@H](C)c2cc(C)c(OC)c(Cl)c2)co1 ZINC000834901141 1037739433 /nfs/dbraw/zinc/73/94/33/1037739433.db2.gz ZRWIFTBSLFUUAB-LLVKDONJSA-N 1 2 308.809 4.058 20 0 DIADLO Fc1ccc(Br)c(F)c1C[NH+]1CCC2(CC2)CC1 ZINC000707102289 1037772431 /nfs/dbraw/zinc/77/24/31/1037772431.db2.gz QLHOGAYKDGJHFP-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO CCc1ccc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@H]2C)nc1 ZINC000581620514 1037790419 /nfs/dbraw/zinc/79/04/19/1037790419.db2.gz ZLVHKUHHUOGXLC-GFCCVEGCSA-N 1 2 302.368 4.042 20 0 DIADLO CCc1ccc(C[N@H+]2CCc3c(F)cc(F)cc3[C@H]2C)nc1 ZINC000581620514 1037790439 /nfs/dbraw/zinc/79/04/39/1037790439.db2.gz ZLVHKUHHUOGXLC-GFCCVEGCSA-N 1 2 302.368 4.042 20 0 DIADLO Cc1c[nH+]c(CNc2ccc(COCc3ccccc3)cc2)n1C ZINC000341379246 1037942442 /nfs/dbraw/zinc/94/24/42/1037942442.db2.gz BCWBYZBMARGROO-UHFFFAOYSA-N 1 2 321.424 4.057 20 0 DIADLO Cc1cc(C[NH+](CCCC2CCCC2)Cc2cc(C)no2)on1 ZINC000078946525 1037946686 /nfs/dbraw/zinc/94/66/86/1037946686.db2.gz RHSLYGIYVNESMU-UHFFFAOYSA-N 1 2 317.433 4.252 20 0 DIADLO Cc1[nH]c(CNc2cc(Cl)cc(C(F)(F)F)c2)[nH+]c1C ZINC000581737775 1037956148 /nfs/dbraw/zinc/95/61/48/1037956148.db2.gz RAZTZIJDGMQDPM-UHFFFAOYSA-N 1 2 303.715 4.311 20 0 DIADLO Cc1cc(C[NH2+]C(C)(C)C(F)F)ccc1Oc1cccnc1 ZINC000684413645 1037966281 /nfs/dbraw/zinc/96/62/81/1037966281.db2.gz STSBLRLOFDRCBF-UHFFFAOYSA-N 1 2 306.356 4.316 20 0 DIADLO Cc1c[nH+]c(CNc2ccc(-c3ncc(C(C)C)o3)cc2)n1C ZINC000341398099 1037970505 /nfs/dbraw/zinc/97/05/05/1037970505.db2.gz RNHQAGYRDCHZJV-UHFFFAOYSA-N 1 2 310.401 4.119 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)[C@H](C)[N@H+](C)Cc1ccsc1 ZINC000127284130 1037976696 /nfs/dbraw/zinc/97/66/96/1037976696.db2.gz AWWVQAARBQRNPL-LBPRGKRZSA-N 1 2 322.861 4.169 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)[C@H](C)[N@@H+](C)Cc1ccsc1 ZINC000127284130 1037976716 /nfs/dbraw/zinc/97/67/16/1037976716.db2.gz AWWVQAARBQRNPL-LBPRGKRZSA-N 1 2 322.861 4.169 20 0 DIADLO Cc1cc(NC(=O)c2ccc(C)c(Oc3ccncc3)c2)cc[nH+]1 ZINC000115381790 1037982033 /nfs/dbraw/zinc/98/20/33/1037982033.db2.gz DJJKCRUURKSBFX-UHFFFAOYSA-N 1 2 319.364 4.138 20 0 DIADLO C[N@H+](Cc1nnsc1Cl)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000581772259 1037988346 /nfs/dbraw/zinc/98/83/46/1037988346.db2.gz NTFMUIOPSQODPB-UKRRQHHQSA-N 1 2 321.877 4.350 20 0 DIADLO C[N@@H+](Cc1nnsc1Cl)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000581772259 1037988361 /nfs/dbraw/zinc/98/83/61/1037988361.db2.gz NTFMUIOPSQODPB-UKRRQHHQSA-N 1 2 321.877 4.350 20 0 DIADLO C[N@H+](Cc1nnsc1Cl)[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000581772257 1037988964 /nfs/dbraw/zinc/98/89/64/1037988964.db2.gz NTFMUIOPSQODPB-DZGCQCFKSA-N 1 2 321.877 4.350 20 0 DIADLO C[N@@H+](Cc1nnsc1Cl)[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000581772257 1037988972 /nfs/dbraw/zinc/98/89/72/1037988972.db2.gz NTFMUIOPSQODPB-DZGCQCFKSA-N 1 2 321.877 4.350 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(-c2ccccc2)no1)c1cccc(Cl)c1 ZINC000008173758 1038003036 /nfs/dbraw/zinc/00/30/36/1038003036.db2.gz WIRIQFIJTYDPMS-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO CCn1cc(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)c(C)n1 ZINC000891515845 1038003864 /nfs/dbraw/zinc/00/38/64/1038003864.db2.gz JOGYRTFVBLJZQB-ZDUSSCGKSA-N 1 2 314.458 4.014 20 0 DIADLO CCn1cc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)c(C)n1 ZINC000891515845 1038003887 /nfs/dbraw/zinc/00/38/87/1038003887.db2.gz JOGYRTFVBLJZQB-ZDUSSCGKSA-N 1 2 314.458 4.014 20 0 DIADLO Cc1nn(C(C)C)c(C)c1C[N@@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000891541783 1038020483 /nfs/dbraw/zinc/02/04/83/1038020483.db2.gz HWRVKJRWDBSMGD-UHFFFAOYSA-N 1 2 322.456 4.120 20 0 DIADLO Cc1nn(C(C)C)c(C)c1C[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000891541783 1038020498 /nfs/dbraw/zinc/02/04/98/1038020498.db2.gz HWRVKJRWDBSMGD-UHFFFAOYSA-N 1 2 322.456 4.120 20 0 DIADLO CC(C)c1ncc(C[N@@H+]2Cc3ccccc3OC[C@H]2C)s1 ZINC000341473217 1038056771 /nfs/dbraw/zinc/05/67/71/1038056771.db2.gz IBVQKMWWQITODR-CYBMUJFWSA-N 1 2 302.443 4.050 20 0 DIADLO CC(C)c1ncc(C[N@H+]2Cc3ccccc3OC[C@H]2C)s1 ZINC000341473217 1038056783 /nfs/dbraw/zinc/05/67/83/1038056783.db2.gz IBVQKMWWQITODR-CYBMUJFWSA-N 1 2 302.443 4.050 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@H]2C[C@@H]2c2ccccc2Cl)c(C)[nH+]1 ZINC000097214012 1038081278 /nfs/dbraw/zinc/08/12/78/1038081278.db2.gz QHAHXXZHHMDYKP-CABCVRRESA-N 1 2 314.816 4.402 20 0 DIADLO CC(C)(C)c1coc(C[NH+]2CCC(Oc3ccccc3)CC2)n1 ZINC000891667481 1038117443 /nfs/dbraw/zinc/11/74/43/1038117443.db2.gz LJIRDASDNSJAGQ-UHFFFAOYSA-N 1 2 314.429 4.016 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2nc3cccnc3s2)o1 ZINC000341558121 1038134485 /nfs/dbraw/zinc/13/44/85/1038134485.db2.gz DDTCJRNVYGSWGC-AWEZNQCLSA-N 1 2 313.426 4.320 20 0 DIADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2nc3cccnc3s2)o1 ZINC000341558121 1038134496 /nfs/dbraw/zinc/13/44/96/1038134496.db2.gz DDTCJRNVYGSWGC-AWEZNQCLSA-N 1 2 313.426 4.320 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2nc3cccnc3s2)o1 ZINC000341558136 1038135433 /nfs/dbraw/zinc/13/54/33/1038135433.db2.gz DDTCJRNVYGSWGC-CQSZACIVSA-N 1 2 313.426 4.320 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2nc3cccnc3s2)o1 ZINC000341558136 1038135442 /nfs/dbraw/zinc/13/54/42/1038135442.db2.gz DDTCJRNVYGSWGC-CQSZACIVSA-N 1 2 313.426 4.320 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+]1CCc2ccccc2[C@H]1C ZINC001143405244 1038142078 /nfs/dbraw/zinc/14/20/78/1038142078.db2.gz WHXYCTOYQPFCMO-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+]1CCc2ccccc2[C@H]1C ZINC001143405244 1038142087 /nfs/dbraw/zinc/14/20/87/1038142087.db2.gz WHXYCTOYQPFCMO-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001143405209 1038142771 /nfs/dbraw/zinc/14/27/71/1038142771.db2.gz VSLUYFWFWGHKAG-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001143405209 1038142777 /nfs/dbraw/zinc/14/27/77/1038142777.db2.gz VSLUYFWFWGHKAG-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc2cccnc2s1 ZINC000341592719 1038159160 /nfs/dbraw/zinc/15/91/60/1038159160.db2.gz YJVPYLBQFLZQHG-SNVBAGLBSA-N 1 2 319.380 4.163 20 0 DIADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc2cccnc2s1 ZINC000341592719 1038159167 /nfs/dbraw/zinc/15/91/67/1038159167.db2.gz YJVPYLBQFLZQHG-SNVBAGLBSA-N 1 2 319.380 4.163 20 0 DIADLO Cc1cccc(-c2cccc(C(=O)Nc3cc[nH+]c(C)c3)c2)c1 ZINC001266883393 1038189478 /nfs/dbraw/zinc/18/94/78/1038189478.db2.gz UAKDUCGSFUYQPM-UHFFFAOYSA-N 1 2 302.377 4.040 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000430748419 1038190710 /nfs/dbraw/zinc/19/07/10/1038190710.db2.gz DMSWAHZEVHBPQA-VIFPVBQESA-N 1 2 313.294 4.102 20 0 DIADLO CCC[C@H]([NH2+]Cc1nnc(C)o1)c1ccc(Cl)c(Cl)c1 ZINC000341640571 1038198922 /nfs/dbraw/zinc/19/89/22/1038198922.db2.gz PEUQNQPGECLSGR-ZDUSSCGKSA-N 1 2 314.216 4.316 20 0 DIADLO COc1cccc(CNc2c[nH+]ccc2OC(C)(C)C)c1F ZINC000669683824 1038224489 /nfs/dbraw/zinc/22/44/89/1038224489.db2.gz MJTNQQTYIIPXKM-UHFFFAOYSA-N 1 2 304.365 4.019 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nnc([C@@H](C)CC)[nH]1)c1ccc(F)cc1F ZINC000276845907 1038252640 /nfs/dbraw/zinc/25/26/40/1038252640.db2.gz CNHNERQOUVPXQB-ZIBATOQPSA-N 1 2 322.403 4.398 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+]1CCC[C@H]1c1ccccc1F ZINC001143411985 1038252756 /nfs/dbraw/zinc/25/27/56/1038252756.db2.gz CAMXFNOTSOPYDT-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+]1CCC[C@H]1c1ccccc1F ZINC001143411985 1038252768 /nfs/dbraw/zinc/25/27/68/1038252768.db2.gz CAMXFNOTSOPYDT-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)c(F)c1C[N@H+](C)Cc1ccc(Cl)cc1 ZINC001143412222 1038253734 /nfs/dbraw/zinc/25/37/34/1038253734.db2.gz MKFYWEXEHFOJEJ-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccc(F)c(F)c1C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC001143412222 1038253745 /nfs/dbraw/zinc/25/37/45/1038253745.db2.gz MKFYWEXEHFOJEJ-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1csc(-c3ccccn3)n1)C2 ZINC000170921977 1038263687 /nfs/dbraw/zinc/26/36/87/1038263687.db2.gz WHVVSRZOYWKUJM-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1csc(-c3ccccn3)n1)C2 ZINC000170921977 1038263700 /nfs/dbraw/zinc/26/37/00/1038263700.db2.gz WHVVSRZOYWKUJM-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO COc1ccc([C@H](C)[N@H+](C)Cc2c(F)c(F)ccc2OC)cc1 ZINC001143414135 1038273522 /nfs/dbraw/zinc/27/35/22/1038273522.db2.gz YYLOJPVGWBVUNX-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO COc1ccc([C@H](C)[N@@H+](C)Cc2c(F)c(F)ccc2OC)cc1 ZINC001143414135 1038273525 /nfs/dbraw/zinc/27/35/25/1038273525.db2.gz YYLOJPVGWBVUNX-LBPRGKRZSA-N 1 2 321.367 4.175 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cn1)c1nc(C(C)(C)C)cs1 ZINC000092747196 1038289015 /nfs/dbraw/zinc/28/90/15/1038289015.db2.gz JCOFYWDAFDOJNW-QWRGUYRKSA-N 1 2 307.438 4.387 20 0 DIADLO CC[C@@H](CC1CCCCC1)C(=O)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000603865361 1038307265 /nfs/dbraw/zinc/30/72/65/1038307265.db2.gz BUTYNLZHUDSMES-ROUUACIJSA-N 1 2 317.477 4.043 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1nc(CCC(C)C)no1 ZINC000603967954 1038329906 /nfs/dbraw/zinc/32/99/06/1038329906.db2.gz KTUVEKJMFWTNNA-QGZVFWFLSA-N 1 2 313.445 4.168 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1nc(CCC(C)C)no1 ZINC000603967954 1038329922 /nfs/dbraw/zinc/32/99/22/1038329922.db2.gz KTUVEKJMFWTNNA-QGZVFWFLSA-N 1 2 313.445 4.168 20 0 DIADLO Cc1ccsc1C[N@H+](C)Cc1csc(-c2ccoc2)n1 ZINC000341948624 1038356992 /nfs/dbraw/zinc/35/69/92/1038356992.db2.gz VGPNEGATMVANSQ-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO Cc1ccsc1C[N@@H+](C)Cc1csc(-c2ccoc2)n1 ZINC000341948624 1038357005 /nfs/dbraw/zinc/35/70/05/1038357005.db2.gz VGPNEGATMVANSQ-UHFFFAOYSA-N 1 2 304.440 4.405 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)[nH]1 ZINC000277066139 1038360933 /nfs/dbraw/zinc/36/09/33/1038360933.db2.gz DNGRFPXNXOCCHV-SDDRHHMPSA-N 1 2 306.841 4.383 20 0 DIADLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccccc2C(F)(F)F)o1 ZINC000341992743 1038363941 /nfs/dbraw/zinc/36/39/41/1038363941.db2.gz COXPOMBUFNDXQT-NXEZZACHSA-N 1 2 313.323 4.063 20 0 DIADLO CC(C)c1ncc(C[NH2+]Cc2cc(-c3ccccc3)on2)s1 ZINC000131895939 1038372470 /nfs/dbraw/zinc/37/24/70/1038372470.db2.gz BZKZFOBRZJYQBD-UHFFFAOYSA-N 1 2 313.426 4.211 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH+]2CCC(C3CCCC3)CC2)n1 ZINC000610820851 1038375344 /nfs/dbraw/zinc/37/53/44/1038375344.db2.gz GPTSOQFBHKQBBR-ZDUSSCGKSA-N 1 2 323.506 4.286 20 0 DIADLO FC(F)(F)c1ccc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)o1 ZINC001232444211 1038418927 /nfs/dbraw/zinc/41/89/27/1038418927.db2.gz RQSWBPVPIVNEOO-QMMMGPOBSA-N 1 2 301.230 4.073 20 0 DIADLO FC(F)(F)c1ccc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)o1 ZINC001232444211 1038418929 /nfs/dbraw/zinc/41/89/29/1038418929.db2.gz RQSWBPVPIVNEOO-QMMMGPOBSA-N 1 2 301.230 4.073 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1cccc(F)c1)c1ccco1 ZINC000151135634 1038432750 /nfs/dbraw/zinc/43/27/50/1038432750.db2.gz UNXPLRKQTJCEGA-LJQANCHMSA-N 1 2 311.356 4.307 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@@H+]2Cc2nc3ccccc3o2)cc1 ZINC000604761528 1038448691 /nfs/dbraw/zinc/44/86/91/1038448691.db2.gz IWTALTVMIBJKKD-QGZVFWFLSA-N 1 2 324.449 4.426 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@H+]2Cc2nc3ccccc3o2)cc1 ZINC000604761528 1038448699 /nfs/dbraw/zinc/44/86/99/1038448699.db2.gz IWTALTVMIBJKKD-QGZVFWFLSA-N 1 2 324.449 4.426 20 0 DIADLO Cc1noc([C@@H](C)[NH2+][C@@H](Cc2ccccc2)c2cccs2)n1 ZINC000604891895 1038462643 /nfs/dbraw/zinc/46/26/43/1038462643.db2.gz FSOHDYQTDYMBBB-DOMZBBRYSA-N 1 2 313.426 4.074 20 0 DIADLO CCCC[C@@H](CC)CC(=O)N(C)Cc1[nH+]cc(C)c(OC)c1C ZINC000604975529 1038472494 /nfs/dbraw/zinc/47/24/94/1038472494.db2.gz DKZJYYMGUJWABU-MRXNPFEDSA-N 1 2 320.477 4.272 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](CC)c2ccccc2F)[nH]1 ZINC000277275457 1038477599 /nfs/dbraw/zinc/47/75/99/1038477599.db2.gz QCWSVYKOYHVLMA-HUBLWGQQSA-N 1 2 304.413 4.259 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](CC)c2ccccc2F)[nH]1 ZINC000277275469 1038477814 /nfs/dbraw/zinc/47/78/14/1038477814.db2.gz QCWSVYKOYHVLMA-ZOWXZIJZSA-N 1 2 304.413 4.259 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1cc(C)cnc1Cl)CCC2 ZINC000892036603 1038481166 /nfs/dbraw/zinc/48/11/66/1038481166.db2.gz WNJLIPYLVSMXMW-CQSZACIVSA-N 1 2 321.877 4.318 20 0 DIADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1cc(C)cnc1Cl)CCC2 ZINC000892036603 1038481174 /nfs/dbraw/zinc/48/11/74/1038481174.db2.gz WNJLIPYLVSMXMW-CQSZACIVSA-N 1 2 321.877 4.318 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2nccc3ccccc32)c(F)c1F ZINC000684665620 1038483262 /nfs/dbraw/zinc/48/32/62/1038483262.db2.gz YTPPMOMIENIKSW-UHFFFAOYSA-N 1 2 320.289 4.081 20 0 DIADLO CC(C)c1ccc(NC(=O)c2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000605077913 1038484078 /nfs/dbraw/zinc/48/40/78/1038484078.db2.gz LDASEKQKEBYCHG-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO COc1cc(C)[nH+]c(CSc2cc(C(F)(F)F)ccn2)c1 ZINC000657273920 1038487810 /nfs/dbraw/zinc/48/78/10/1038487810.db2.gz BAROGQSKMNTGAT-UHFFFAOYSA-N 1 2 314.332 4.105 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)c2csc(Cl)c2)[nH]1 ZINC000277298856 1038491266 /nfs/dbraw/zinc/49/12/66/1038491266.db2.gz RVBULWMAXNZXEP-GUBZILKMSA-N 1 2 312.870 4.445 20 0 DIADLO CC(C)(C)c1nc(C[NH2+][C@@H]2CSc3ccccc32)cs1 ZINC000605165955 1038491748 /nfs/dbraw/zinc/49/17/48/1038491748.db2.gz ISANNBWUKNNLCP-CYBMUJFWSA-N 1 2 304.484 4.377 20 0 DIADLO Cc1cccc([C@@H]2CCCCC[N@@H+]2Cc2noc(C3CC3)n2)c1 ZINC000605157225 1038494275 /nfs/dbraw/zinc/49/42/75/1038494275.db2.gz ZCYRPIUNUSMEBR-KRWDZBQOSA-N 1 2 311.429 4.373 20 0 DIADLO Cc1cccc([C@@H]2CCCCC[N@H+]2Cc2noc(C3CC3)n2)c1 ZINC000605157225 1038494282 /nfs/dbraw/zinc/49/42/82/1038494282.db2.gz ZCYRPIUNUSMEBR-KRWDZBQOSA-N 1 2 311.429 4.373 20 0 DIADLO CCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1ncc(C)cn1 ZINC000342248610 1038499816 /nfs/dbraw/zinc/49/98/16/1038499816.db2.gz VZOJQQBJWGDWNR-QGZVFWFLSA-N 1 2 313.445 4.061 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)s2)[nH]1 ZINC000277350256 1038515800 /nfs/dbraw/zinc/51/58/00/1038515800.db2.gz VOUDUDVQZPZYNT-IVZWLZJFSA-N 1 2 312.870 4.445 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cc2occc2s1 ZINC000605506254 1038524834 /nfs/dbraw/zinc/52/48/34/1038524834.db2.gz QMPZFWVPCOMXJO-UHFFFAOYSA-N 1 2 309.350 4.137 20 0 DIADLO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)c2ccc3ccccc3n2)[nH]1 ZINC000277402847 1038542835 /nfs/dbraw/zinc/54/28/35/1038542835.db2.gz YZTSJVFKXPEDFP-BFHYXJOUSA-N 1 2 323.444 4.278 20 0 DIADLO C[C@H]([NH2+]Cc1nc2cccnc2s1)c1c(F)cccc1Cl ZINC000342341424 1038544322 /nfs/dbraw/zinc/54/43/22/1038544322.db2.gz QLFXMTUQVAVHQQ-VIFPVBQESA-N 1 2 321.808 4.335 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+](C)[C@H](C)c2ccncc2)s1 ZINC000183634791 1038555293 /nfs/dbraw/zinc/55/52/93/1038555293.db2.gz AYCNWUCRPKUVAH-SECBINFHSA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+](C)[C@H](C)c2ccncc2)s1 ZINC000183634791 1038555300 /nfs/dbraw/zinc/55/53/00/1038555300.db2.gz AYCNWUCRPKUVAH-SECBINFHSA-N 1 2 315.364 4.058 20 0 DIADLO CC(C)CCc1noc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)n1 ZINC000605904012 1038555515 /nfs/dbraw/zinc/55/55/15/1038555515.db2.gz RHIZKZYNJBKMAO-OAHLLOKOSA-N 1 2 317.433 4.369 20 0 DIADLO CC(C)CCc1noc(C[N@H+]2CCCCC[C@@H]2c2ccco2)n1 ZINC000605904012 1038555520 /nfs/dbraw/zinc/55/55/20/1038555520.db2.gz RHIZKZYNJBKMAO-OAHLLOKOSA-N 1 2 317.433 4.369 20 0 DIADLO CC(C)CCc1noc(C[N@@H+]2CCCCC[C@H]2c2ccco2)n1 ZINC000605904001 1038555973 /nfs/dbraw/zinc/55/59/73/1038555973.db2.gz RHIZKZYNJBKMAO-HNNXBMFYSA-N 1 2 317.433 4.369 20 0 DIADLO CC(C)CCc1noc(C[N@H+]2CCCCC[C@H]2c2ccco2)n1 ZINC000605904001 1038555975 /nfs/dbraw/zinc/55/59/75/1038555975.db2.gz RHIZKZYNJBKMAO-HNNXBMFYSA-N 1 2 317.433 4.369 20 0 DIADLO Cc1c(CO)ccc(Nc2cc(Cl)c3[nH+]ccn3c2)c1Cl ZINC001216329078 1038557695 /nfs/dbraw/zinc/55/76/95/1038557695.db2.gz CKAPTOMRVVVESV-UHFFFAOYSA-N 1 2 322.195 4.185 20 0 DIADLO Cc1ccc2cc(CNc3ccc(N4CCCC4)c[nH+]3)[nH]c2c1 ZINC000657322440 1038568414 /nfs/dbraw/zinc/56/84/14/1038568414.db2.gz YJCIOQJJBSXFSK-UHFFFAOYSA-N 1 2 306.413 4.084 20 0 DIADLO O=C(CC/C=C/c1ccccc1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000606177522 1038576234 /nfs/dbraw/zinc/57/62/34/1038576234.db2.gz HEPGLKWDOJWJTP-RUDMXATFSA-N 1 2 317.392 4.304 20 0 DIADLO CCCCN(CCCC)C(=O)Nc1ccc2[nH+]c(C)cn2c1 ZINC000606568977 1038614078 /nfs/dbraw/zinc/61/40/78/1038614078.db2.gz OAVJISUUHVHKEM-UHFFFAOYSA-N 1 2 302.422 4.077 20 0 DIADLO Cc1cn2cc(NC(=O)N[C@@H](C)c3cccc(C)c3C)ccc2[nH+]1 ZINC000606569442 1038614118 /nfs/dbraw/zinc/61/41/18/1038614118.db2.gz WSGKFGMUEKBRJC-HNNXBMFYSA-N 1 2 322.412 4.142 20 0 DIADLO CCC1CCC(N(C)C(=O)Nc2ccc3[nH+]c(C)cn3c2)CC1 ZINC000606569425 1038614256 /nfs/dbraw/zinc/61/42/56/1038614256.db2.gz VAYKTGFBVKVGFU-UHFFFAOYSA-N 1 2 314.433 4.075 20 0 DIADLO c1ccc([C@H]2CCCC[N@H+]2Cc2nc(C3CCCC3)no2)cc1 ZINC000582213902 1038614605 /nfs/dbraw/zinc/61/46/05/1038614605.db2.gz JISCSGSZZVHHFO-QGZVFWFLSA-N 1 2 311.429 4.454 20 0 DIADLO c1ccc([C@H]2CCCC[N@@H+]2Cc2nc(C3CCCC3)no2)cc1 ZINC000582213902 1038614610 /nfs/dbraw/zinc/61/46/10/1038614610.db2.gz JISCSGSZZVHHFO-QGZVFWFLSA-N 1 2 311.429 4.454 20 0 DIADLO CC[C@H](C)N(Cc1ccccc1)C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000606581524 1038616181 /nfs/dbraw/zinc/61/61/81/1038616181.db2.gz HABOOTVSPKWFLJ-HNNXBMFYSA-N 1 2 322.412 4.167 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1ccc(F)c(F)c1F ZINC000657376932 1038620105 /nfs/dbraw/zinc/62/01/05/1038620105.db2.gz QNBKALRTDVQSKN-VIFPVBQESA-N 1 2 313.294 4.102 20 0 DIADLO CCc1cccc2cc(C[NH2+]Cc3nccn3CC(C)C)oc21 ZINC000657374641 1038621052 /nfs/dbraw/zinc/62/10/52/1038621052.db2.gz OXPRQWGGQFOVGO-UHFFFAOYSA-N 1 2 311.429 4.138 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H](Cc3ccccc3)C(C)C)ccc2[nH+]1 ZINC000606775878 1038624347 /nfs/dbraw/zinc/62/43/47/1038624347.db2.gz IXLPWIXODPDYLA-SFHVURJKSA-N 1 2 321.424 4.096 20 0 DIADLO CC(C)CO[C@@H]1CC[N@H+](Cc2csc(C3CCCC3)n2)C1 ZINC000119744533 1038634305 /nfs/dbraw/zinc/63/43/05/1038634305.db2.gz IMPOWZCKXVXCHK-MRXNPFEDSA-N 1 2 308.491 4.048 20 0 DIADLO CC(C)CO[C@@H]1CC[N@@H+](Cc2csc(C3CCCC3)n2)C1 ZINC000119744533 1038634309 /nfs/dbraw/zinc/63/43/09/1038634309.db2.gz IMPOWZCKXVXCHK-MRXNPFEDSA-N 1 2 308.491 4.048 20 0 DIADLO CC(=O)Nc1cccc(NCc2cc(C)[nH+]c3c2CCCC3)c1C ZINC000892254551 1038634882 /nfs/dbraw/zinc/63/48/82/1038634882.db2.gz PBZABFIJODTVHU-UHFFFAOYSA-N 1 2 323.440 4.148 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc(Br)[nH]1 ZINC001232693802 1038656245 /nfs/dbraw/zinc/65/62/45/1038656245.db2.gz LMZLULJOJMMVJV-OAHLLOKOSA-N 1 2 319.246 4.287 20 0 DIADLO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc(Br)[nH]1 ZINC001232693802 1038656247 /nfs/dbraw/zinc/65/62/47/1038656247.db2.gz LMZLULJOJMMVJV-OAHLLOKOSA-N 1 2 319.246 4.287 20 0 DIADLO CCc1cccc2cc(C[NH2+][C@@H](C)c3nnc(C(C)C)[nH]3)oc21 ZINC000657420146 1038657352 /nfs/dbraw/zinc/65/73/52/1038657352.db2.gz LGFFONYYKPWYEV-LBPRGKRZSA-N 1 2 312.417 4.088 20 0 DIADLO CCCc1nc(C[NH+]2CCC(c3ncc(C)s3)CC2)cs1 ZINC000277584594 1038658264 /nfs/dbraw/zinc/65/82/64/1038658264.db2.gz WCNHQHJALARDKE-UHFFFAOYSA-N 1 2 321.515 4.240 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@@H](C)c2cccc(C3CC3)c2)c[nH+]1 ZINC000582403525 1038658817 /nfs/dbraw/zinc/65/88/17/1038658817.db2.gz QBHRUNZRMCVFNC-HNNXBMFYSA-N 1 2 323.440 4.136 20 0 DIADLO COC(=O)c1ccoc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000342602489 1038684835 /nfs/dbraw/zinc/68/48/35/1038684835.db2.gz VBPYRTMDMWUUHX-HNNXBMFYSA-N 1 2 319.788 4.057 20 0 DIADLO COC(=O)c1ccoc1C[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000342602489 1038684838 /nfs/dbraw/zinc/68/48/38/1038684838.db2.gz VBPYRTMDMWUUHX-HNNXBMFYSA-N 1 2 319.788 4.057 20 0 DIADLO CC[N@H+](Cc1ncc(COC)s1)[C@@H](C)c1ccc(F)cc1 ZINC000342618261 1038688672 /nfs/dbraw/zinc/68/86/72/1038688672.db2.gz CEWSPSIFQQZMQP-LBPRGKRZSA-N 1 2 308.422 4.012 20 0 DIADLO CC[N@@H+](Cc1ncc(COC)s1)[C@@H](C)c1ccc(F)cc1 ZINC000342618261 1038688676 /nfs/dbraw/zinc/68/86/76/1038688676.db2.gz CEWSPSIFQQZMQP-LBPRGKRZSA-N 1 2 308.422 4.012 20 0 DIADLO Cl/C=C(\Cl)C[N@@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000173191520 1038690127 /nfs/dbraw/zinc/69/01/27/1038690127.db2.gz MGSFHLGHFFOGKL-LCFDYFRESA-N 1 2 311.212 4.326 20 0 DIADLO Cl/C=C(\Cl)C[N@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000173191520 1038690130 /nfs/dbraw/zinc/69/01/30/1038690130.db2.gz MGSFHLGHFFOGKL-LCFDYFRESA-N 1 2 311.212 4.326 20 0 DIADLO Cc1cc(C)c(NC(=O)/C=C\c2ccc(Cl)s2)c(C)[nH+]1 ZINC000255514046 1038705509 /nfs/dbraw/zinc/70/55/09/1038705509.db2.gz UNYBMIWBJDFRNO-ALCCZGGFSA-N 1 2 306.818 4.374 20 0 DIADLO COCc1cnc(C[N@H+](C)Cc2csc3ccccc23)s1 ZINC000342694356 1038724340 /nfs/dbraw/zinc/72/43/40/1038724340.db2.gz UWLVUSPFFZJSIV-UHFFFAOYSA-N 1 2 318.467 4.136 20 0 DIADLO COCc1cnc(C[N@@H+](C)Cc2csc3ccccc23)s1 ZINC000342694356 1038724348 /nfs/dbraw/zinc/72/43/48/1038724348.db2.gz UWLVUSPFFZJSIV-UHFFFAOYSA-N 1 2 318.467 4.136 20 0 DIADLO FC(F)(F)c1cccc(COc2cccc(-n3cc[nH+]c3)c2)c1 ZINC000607723352 1038725591 /nfs/dbraw/zinc/72/55/91/1038725591.db2.gz SXUQNTAOWBVCHZ-UHFFFAOYSA-N 1 2 318.298 4.470 20 0 DIADLO CC[C@@H](C)[C@H](C(=O)Nc1cccc2[nH+]ccn21)c1ccccc1 ZINC000607714935 1038725781 /nfs/dbraw/zinc/72/57/81/1038725781.db2.gz NXDPMUCYMCBHDU-KDOFPFPSSA-N 1 2 307.397 4.103 20 0 DIADLO CCCC[C@@H](C)[NH2+][C@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000133076523 1038726408 /nfs/dbraw/zinc/72/64/08/1038726408.db2.gz LZALKVKWZRNXDF-ABAIWWIYSA-N 1 2 307.825 4.289 20 0 DIADLO Fc1cccc(C[N@H+](Cc2nc(C3CC3)cs2)C2CC2)c1 ZINC000342708834 1038731727 /nfs/dbraw/zinc/73/17/27/1038731727.db2.gz OCQCUCQKTPDIEB-UHFFFAOYSA-N 1 2 302.418 4.324 20 0 DIADLO Fc1cccc(C[N@@H+](Cc2nc(C3CC3)cs2)C2CC2)c1 ZINC000342708834 1038731736 /nfs/dbraw/zinc/73/17/36/1038731736.db2.gz OCQCUCQKTPDIEB-UHFFFAOYSA-N 1 2 302.418 4.324 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1nc2ccccc2o1)c1cnn(CC2CCC2)c1 ZINC000934562484 1038734281 /nfs/dbraw/zinc/73/42/81/1038734281.db2.gz QKIHIWVMIGYMTH-ZIAGYGMSSA-N 1 2 324.428 4.236 20 0 DIADLO Cc1cc(C)c(NC(=O)c2csc(-c3ccccc3)n2)c(C)[nH+]1 ZINC000097213887 1038737460 /nfs/dbraw/zinc/73/74/60/1038737460.db2.gz WZBAEEOWZPPQEV-UHFFFAOYSA-N 1 2 323.421 4.383 20 0 DIADLO c1ccc([C@@H]([NH2+][C@@H]2CCCc3cccnc32)c2ccccn2)cc1 ZINC000684954302 1038739479 /nfs/dbraw/zinc/73/94/79/1038739479.db2.gz YIAYMITVEOXURN-TZIWHRDSSA-N 1 2 315.420 4.233 20 0 DIADLO c1ccc([C@H]([NH2+][C@@H]2CCCc3cccnc32)c2ccccn2)cc1 ZINC000684954298 1038740061 /nfs/dbraw/zinc/74/00/61/1038740061.db2.gz YIAYMITVEOXURN-CTNGQTDRSA-N 1 2 315.420 4.233 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2c(Cl)ccnc21)c1c(F)cncc1F ZINC000926420869 1038762835 /nfs/dbraw/zinc/76/28/35/1038762835.db2.gz YSKJODPUYQDLJS-XPTSAGLGSA-N 1 2 323.774 4.136 20 0 DIADLO c1ccc([C@@H](CC2CC2)Nc2cc(N3CCCCC3)nc[nH+]2)cc1 ZINC000608090658 1038771553 /nfs/dbraw/zinc/77/15/53/1038771553.db2.gz SICNXAZFZVCNCM-GOSISDBHSA-N 1 2 322.456 4.420 20 0 DIADLO c1ccc([C@@H](CC2CC2)Nc2cc(N3CCCCC3)[nH+]cn2)cc1 ZINC000608090658 1038771558 /nfs/dbraw/zinc/77/15/58/1038771558.db2.gz SICNXAZFZVCNCM-GOSISDBHSA-N 1 2 322.456 4.420 20 0 DIADLO CCc1cnc(C[NH+]2CCC(F)(c3ccc(Cl)cc3)CC2)o1 ZINC000685005046 1038774639 /nfs/dbraw/zinc/77/46/39/1038774639.db2.gz LQRGMMFOFRZWLW-UHFFFAOYSA-N 1 2 322.811 4.351 20 0 DIADLO CC[C@H](N[C@@H](C[NH+](C)C)c1ccc(OC)cc1)c1ccccc1 ZINC000342785727 1038775635 /nfs/dbraw/zinc/77/56/35/1038775635.db2.gz SDMMZMIQBVPYAZ-PMACEKPBSA-N 1 2 312.457 4.039 20 0 DIADLO Cc1c[nH+]c(CN(Cc2ccc(Cl)c(Cl)c2)C2CC2)n1C ZINC000342786749 1038782971 /nfs/dbraw/zinc/78/29/71/1038782971.db2.gz SYHTWKKITPFNDK-UHFFFAOYSA-N 1 2 324.255 4.200 20 0 DIADLO C[C@H](c1nc(-c2cccs2)no1)[N@H+](C)Cc1cccs1 ZINC000075608260 1038809294 /nfs/dbraw/zinc/80/92/94/1038809294.db2.gz SVSJBIBUOVSHFT-SNVBAGLBSA-N 1 2 305.428 4.053 20 0 DIADLO C[C@H](c1nc(-c2cccs2)no1)[N@@H+](C)Cc1cccs1 ZINC000075608260 1038809325 /nfs/dbraw/zinc/80/93/25/1038809325.db2.gz SVSJBIBUOVSHFT-SNVBAGLBSA-N 1 2 305.428 4.053 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+]3C[C@@H](C)S[C@@H](C)C3)cs2)o1 ZINC000075891753 1038819102 /nfs/dbraw/zinc/81/91/02/1038819102.db2.gz RLWACAJGFMHEBS-TXEJJXNPSA-N 1 2 308.472 4.037 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+]3C[C@@H](C)S[C@@H](C)C3)cs2)o1 ZINC000075891753 1038819128 /nfs/dbraw/zinc/81/91/28/1038819128.db2.gz RLWACAJGFMHEBS-TXEJJXNPSA-N 1 2 308.472 4.037 20 0 DIADLO C[C@H](c1ccc(-c2ccccc2)cc1)[N@H+](C)Cc1nccn1C ZINC000075955842 1038820269 /nfs/dbraw/zinc/82/02/69/1038820269.db2.gz QMZQKZAAXQFFMB-MRXNPFEDSA-N 1 2 305.425 4.280 20 0 DIADLO C[C@H](c1ccc(-c2ccccc2)cc1)[N@@H+](C)Cc1nccn1C ZINC000075955842 1038820297 /nfs/dbraw/zinc/82/02/97/1038820297.db2.gz QMZQKZAAXQFFMB-MRXNPFEDSA-N 1 2 305.425 4.280 20 0 DIADLO COc1cccc2[nH+]c(NCc3c(F)cccc3OC)ccc21 ZINC001167606781 1038820990 /nfs/dbraw/zinc/82/09/90/1038820990.db2.gz QMBHOLREYKHQRI-UHFFFAOYSA-N 1 2 312.344 4.003 20 0 DIADLO Cc1ccc(-c2nc(C[NH+]3CCC(C(F)(F)F)CC3)co2)cc1 ZINC000075969549 1038824798 /nfs/dbraw/zinc/82/47/98/1038824798.db2.gz KPGVEAZCUWBZSY-UHFFFAOYSA-N 1 2 324.346 4.424 20 0 DIADLO Cc1[nH]c(CN(Cc2ccccc2)Cc2ccc(F)cc2)[nH+]c1C ZINC000628142861 1038852545 /nfs/dbraw/zinc/85/25/45/1038852545.db2.gz SDHXTMSGSCVKBT-UHFFFAOYSA-N 1 2 323.415 4.368 20 0 DIADLO CCOc1ccccc1C1=CC[N@H+](Cc2csc(C)n2)CC1 ZINC000076723145 1038855450 /nfs/dbraw/zinc/85/54/50/1038855450.db2.gz VWQBZZABQOYOOR-UHFFFAOYSA-N 1 2 314.454 4.140 20 0 DIADLO CCOc1ccccc1C1=CC[N@@H+](Cc2csc(C)n2)CC1 ZINC000076723145 1038855473 /nfs/dbraw/zinc/85/54/73/1038855473.db2.gz VWQBZZABQOYOOR-UHFFFAOYSA-N 1 2 314.454 4.140 20 0 DIADLO COc1c(O)cccc1C[N@H+](C)[C@H](C)c1ccccc1Cl ZINC000491217351 1038857401 /nfs/dbraw/zinc/85/74/01/1038857401.db2.gz OXUZKVWFDHIHER-GFCCVEGCSA-N 1 2 305.805 4.247 20 0 DIADLO COc1c(O)cccc1C[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC000491217351 1038857421 /nfs/dbraw/zinc/85/74/21/1038857421.db2.gz OXUZKVWFDHIHER-GFCCVEGCSA-N 1 2 305.805 4.247 20 0 DIADLO CC[N@H+](Cc1ccon1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000077283422 1038864437 /nfs/dbraw/zinc/86/44/37/1038864437.db2.gz HUUMEGTYLVDESK-LJQANCHMSA-N 1 2 310.372 4.425 20 0 DIADLO CC[N@@H+](Cc1ccon1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000077283422 1038864461 /nfs/dbraw/zinc/86/44/61/1038864461.db2.gz HUUMEGTYLVDESK-LJQANCHMSA-N 1 2 310.372 4.425 20 0 DIADLO c1ccc(-c2nc(C[NH+]3CCC(C4CCCC4)CC3)no2)cc1 ZINC000608501886 1038874328 /nfs/dbraw/zinc/87/43/28/1038874328.db2.gz CHMFHEQPVFNCMX-UHFFFAOYSA-N 1 2 311.429 4.139 20 0 DIADLO Cc1cc(Cl)ccc1C(=O)Nc1cccc(-n2cc[nH+]c2)c1 ZINC000153316111 1038924817 /nfs/dbraw/zinc/92/48/17/1038924817.db2.gz QCOBNSBNFNGVTG-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO Cc1c[nH]c(C[N@@H+]2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)n1 ZINC000628162210 1038946148 /nfs/dbraw/zinc/94/61/48/1038946148.db2.gz HUTGCFLOIAXOGT-HNNXBMFYSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1c[nH]c(C[N@H+]2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)n1 ZINC000628162210 1038946164 /nfs/dbraw/zinc/94/61/64/1038946164.db2.gz HUTGCFLOIAXOGT-HNNXBMFYSA-N 1 2 323.362 4.464 20 0 DIADLO CC[N@H+](Cc1nc(C)c[nH]1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000628164096 1038958757 /nfs/dbraw/zinc/95/87/57/1038958757.db2.gz CXRMCMPTQHZCEU-FQEVSTJZSA-N 1 2 323.415 4.469 20 0 DIADLO CC[N@@H+](Cc1nc(C)c[nH]1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000628164096 1038958767 /nfs/dbraw/zinc/95/87/67/1038958767.db2.gz CXRMCMPTQHZCEU-FQEVSTJZSA-N 1 2 323.415 4.469 20 0 DIADLO Cc1nc2sccc2c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)n1 ZINC001213085820 1038971498 /nfs/dbraw/zinc/97/14/98/1038971498.db2.gz YLISKQQKXWRAHS-UHFFFAOYSA-N 1 2 307.382 4.133 20 0 DIADLO Cc1nc(C[N@@H+]2CCc3ccccc3[C@@H]2c2ccccc2)[nH]c1C ZINC000628170233 1038978642 /nfs/dbraw/zinc/97/86/42/1038978642.db2.gz UVWXVFSXTJEJSU-NRFANRHFSA-N 1 2 317.436 4.174 20 0 DIADLO Cc1nc(C[N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)[nH]c1C ZINC000628170233 1038978652 /nfs/dbraw/zinc/97/86/52/1038978652.db2.gz UVWXVFSXTJEJSU-NRFANRHFSA-N 1 2 317.436 4.174 20 0 DIADLO Brc1nc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cs1 ZINC001213086050 1039015684 /nfs/dbraw/zinc/01/56/84/1039015684.db2.gz FPDLKGIHOSRKIN-UHFFFAOYSA-N 1 2 321.203 4.039 20 0 DIADLO COCc1cnc(C[N@@H+]2C[C@H](C)C[C@H]2c2ccccc2F)s1 ZINC000342930997 1039028823 /nfs/dbraw/zinc/02/88/23/1039028823.db2.gz JCOIEFADOJFWSM-WBMJQRKESA-N 1 2 320.433 4.012 20 0 DIADLO COCc1cnc(C[N@H+]2C[C@H](C)C[C@H]2c2ccccc2F)s1 ZINC000342930997 1039028843 /nfs/dbraw/zinc/02/88/43/1039028843.db2.gz JCOIEFADOJFWSM-WBMJQRKESA-N 1 2 320.433 4.012 20 0 DIADLO C[C@H]1CCN(Cc2ccc(-n3cc[nH+]c3)cc2)c2ccccc21 ZINC001167912810 1039031558 /nfs/dbraw/zinc/03/15/58/1039031558.db2.gz QMIVNWMACPORHN-INIZCTEOSA-N 1 2 303.409 4.386 20 0 DIADLO C[N@H+](Cc1nnc(C(C)(C)C)o1)Cc1cccc2ccccc21 ZINC000051992993 1039033137 /nfs/dbraw/zinc/03/31/37/1039033137.db2.gz WTAIYBULKRHNRO-UHFFFAOYSA-N 1 2 309.413 4.152 20 0 DIADLO C[N@@H+](Cc1nnc(C(C)(C)C)o1)Cc1cccc2ccccc21 ZINC000051992993 1039033158 /nfs/dbraw/zinc/03/31/58/1039033158.db2.gz WTAIYBULKRHNRO-UHFFFAOYSA-N 1 2 309.413 4.152 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)Cc1ccc2[nH]cnc2c1 ZINC000534336721 1039038769 /nfs/dbraw/zinc/03/87/69/1039038769.db2.gz NKZYNXMCTRMWGS-NSHDSACASA-N 1 2 301.340 4.034 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccc2[nH]cnc2c1 ZINC000534336721 1039038788 /nfs/dbraw/zinc/03/87/88/1039038788.db2.gz NKZYNXMCTRMWGS-NSHDSACASA-N 1 2 301.340 4.034 20 0 DIADLO Clc1ccc2c(c1)CC[N@@H+](Cc1scnc1C1CC1)C2 ZINC000425969217 1039043388 /nfs/dbraw/zinc/04/33/88/1039043388.db2.gz XTEOHHSUHHWCDW-UHFFFAOYSA-N 1 2 304.846 4.232 20 0 DIADLO Clc1ccc2c(c1)CC[N@H+](Cc1scnc1C1CC1)C2 ZINC000425969217 1039043400 /nfs/dbraw/zinc/04/34/00/1039043400.db2.gz XTEOHHSUHHWCDW-UHFFFAOYSA-N 1 2 304.846 4.232 20 0 DIADLO CCc1ccc([C@H](C)CC(=O)NCc2c[nH+]c(C)cc2C)cc1 ZINC000456833925 1039084286 /nfs/dbraw/zinc/08/42/86/1039084286.db2.gz GUYTXDFRMVJOEF-OAHLLOKOSA-N 1 2 310.441 4.071 20 0 DIADLO CCOC(=O)[C@@H]1CCCC[N@@H+]1C/C=C\c1c(C)cc(C)cc1C ZINC001204601251 1039104772 /nfs/dbraw/zinc/10/47/72/1039104772.db2.gz DJXLJVVFLSBSOT-QWUACUGRSA-N 1 2 315.457 4.043 20 0 DIADLO CCOC(=O)[C@@H]1CCCC[N@H+]1C/C=C\c1c(C)cc(C)cc1C ZINC001204601251 1039104777 /nfs/dbraw/zinc/10/47/77/1039104777.db2.gz DJXLJVVFLSBSOT-QWUACUGRSA-N 1 2 315.457 4.043 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@@H]2CCCC2(F)F)ccc1SC ZINC000672621932 1039129780 /nfs/dbraw/zinc/12/97/80/1039129780.db2.gz OQAAQUYGPMHYGE-QMTHXVAHSA-N 1 2 301.402 4.256 20 0 DIADLO Cc1ncc([C@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)c(C)n1 ZINC000153972132 1039154299 /nfs/dbraw/zinc/15/42/99/1039154299.db2.gz GRUHTQVGPDRHKH-CMPLNLGQSA-N 1 2 318.490 4.259 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)c(C)n1 ZINC000153972014 1039155514 /nfs/dbraw/zinc/15/55/14/1039155514.db2.gz GRUHTQVGPDRHKH-ZYHUDNBSSA-N 1 2 318.490 4.259 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)s1 ZINC000343106815 1039202660 /nfs/dbraw/zinc/20/26/60/1039202660.db2.gz ZXWXWLUGKPBEEH-CYBMUJFWSA-N 1 2 307.850 4.092 20 0 DIADLO CCCCCC[C@](C)(CC)C(=O)N1CCC(n2cc[nH+]c2)CC1 ZINC000079839767 1039204864 /nfs/dbraw/zinc/20/48/64/1039204864.db2.gz SRRXBAUWESFORU-IBGZPJMESA-N 1 2 319.493 4.433 20 0 DIADLO C/C=C(/CC)C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000588571766 1039237314 /nfs/dbraw/zinc/23/73/14/1039237314.db2.gz YAMCMBNXTZSLIH-BNNQUZSASA-N 1 2 309.413 4.181 20 0 DIADLO C[C@@H]1C[C@@H]1[C@@H]([NH2+]Cc1nnc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000539426859 1039260187 /nfs/dbraw/zinc/26/01/87/1039260187.db2.gz VZDVHOZCEWFPEV-OOVXXXAESA-N 1 2 317.820 4.087 20 0 DIADLO Cc1nc(C[NH2+][C@@H]2CCCOc3ccc(Cl)cc32)cs1 ZINC000126540836 1039272563 /nfs/dbraw/zinc/27/25/63/1039272563.db2.gz HKNOIEOVVYFFSG-CQSZACIVSA-N 1 2 308.834 4.108 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2cc(C)ccc2OC(F)F)cs1 ZINC000126560708 1039277113 /nfs/dbraw/zinc/27/71/13/1039277113.db2.gz VTIVQNNLNIHCEK-SNVBAGLBSA-N 1 2 312.385 4.212 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1csc(C)n1 ZINC000126572120 1039284312 /nfs/dbraw/zinc/28/43/12/1039284312.db2.gz QMDREGAPUWAPJF-JTQLQIEISA-N 1 2 310.850 4.354 20 0 DIADLO COC[C@H]([NH2+]Cc1csc(C(C)(C)C)n1)c1ccc(F)cc1 ZINC000539519388 1039284591 /nfs/dbraw/zinc/28/45/91/1039284591.db2.gz ZUONIFKQHJUFLS-HNNXBMFYSA-N 1 2 322.449 4.057 20 0 DIADLO c1c[nH+]c(-c2ccc(Nc3ccc(-c4ccccn4)nc3)cc2)[nH]1 ZINC001213087882 1039289514 /nfs/dbraw/zinc/28/95/14/1039289514.db2.gz FRAJNIHOIBFXQT-UHFFFAOYSA-N 1 2 313.364 4.277 20 0 DIADLO CCCCc1noc([C@@H](C)SCc2cc(OC)cc(C)[nH+]2)n1 ZINC000539625810 1039306277 /nfs/dbraw/zinc/30/62/77/1039306277.db2.gz HWHCBNNXAYDZGF-GFCCVEGCSA-N 1 2 321.446 4.119 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)CCC(=O)c1ccccc1 ZINC000539723363 1039323972 /nfs/dbraw/zinc/32/39/72/1039323972.db2.gz BHXTTYZAKNAVMJ-ZDUSSCGKSA-N 1 2 303.352 4.231 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)CCC(=O)c1ccccc1 ZINC000539723363 1039323990 /nfs/dbraw/zinc/32/39/90/1039323990.db2.gz BHXTTYZAKNAVMJ-ZDUSSCGKSA-N 1 2 303.352 4.231 20 0 DIADLO CCC[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccccn1 ZINC000539736737 1039328344 /nfs/dbraw/zinc/32/83/44/1039328344.db2.gz DMZCJNHKJOCGKF-GOSISDBHSA-N 1 2 310.445 4.420 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(F)cc1F)c1nc2ccccc2s1 ZINC000051016594 1039332521 /nfs/dbraw/zinc/33/25/21/1039332521.db2.gz BGJCCETWLAGWKJ-SNVBAGLBSA-N 1 2 304.365 4.425 20 0 DIADLO C[N@H+](Cc1ccsc1)Cc1ccc(Br)cc1C#N ZINC000386364798 1039338680 /nfs/dbraw/zinc/33/86/80/1039338680.db2.gz QUQPBAXWJUGHPN-UHFFFAOYSA-N 1 2 321.243 4.014 20 0 DIADLO C[N@@H+](Cc1ccsc1)Cc1ccc(Br)cc1C#N ZINC000386364798 1039338693 /nfs/dbraw/zinc/33/86/93/1039338693.db2.gz QUQPBAXWJUGHPN-UHFFFAOYSA-N 1 2 321.243 4.014 20 0 DIADLO COc1cc(C)[nH+]c(CN(C)Cc2ccc3ccccc3c2)c1 ZINC000536045573 1039344014 /nfs/dbraw/zinc/34/40/14/1039344014.db2.gz KZQOVJSOUNEWSI-UHFFFAOYSA-N 1 2 306.409 4.184 20 0 DIADLO Cc1ncccc1C[N@@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000539837817 1039364633 /nfs/dbraw/zinc/36/46/33/1039364633.db2.gz FTVBKWHGXFQIHC-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ncccc1C[N@H+]1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000539837817 1039364641 /nfs/dbraw/zinc/36/46/41/1039364641.db2.gz FTVBKWHGXFQIHC-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1cc(C[N@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)ccc1F ZINC000539850540 1039367063 /nfs/dbraw/zinc/36/70/63/1039367063.db2.gz TZVHAHJRLOYTFI-DYVFJYSZSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1cc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)ccc1F ZINC000539850540 1039367083 /nfs/dbraw/zinc/36/70/83/1039367083.db2.gz TZVHAHJRLOYTFI-DYVFJYSZSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)cc1F ZINC000539851009 1039375429 /nfs/dbraw/zinc/37/54/29/1039375429.db2.gz WHUDBEGTZFOYPG-DYVFJYSZSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@H](c3ccsc3)C2)cc1F ZINC000539851009 1039375440 /nfs/dbraw/zinc/37/54/40/1039375440.db2.gz WHUDBEGTZFOYPG-DYVFJYSZSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@H+](Cc3nc(C(C)C)no3)CC2)c1 ZINC000539888146 1039377137 /nfs/dbraw/zinc/37/71/37/1039377137.db2.gz HGYSXFBXQKDWOU-UHFFFAOYSA-N 1 2 311.429 4.099 20 0 DIADLO Cc1cc(C)cc(C2=CC[N@@H+](Cc3nc(C(C)C)no3)CC2)c1 ZINC000539888146 1039377148 /nfs/dbraw/zinc/37/71/48/1039377148.db2.gz HGYSXFBXQKDWOU-UHFFFAOYSA-N 1 2 311.429 4.099 20 0 DIADLO Cc1cccc([C@@H]([NH2+]Cc2cc(C)ncn2)c2cccc(F)c2)c1 ZINC000669848438 1039378310 /nfs/dbraw/zinc/37/83/10/1039378310.db2.gz UYOFQAGKJSWOJE-HXUWFJFHSA-N 1 2 321.399 4.112 20 0 DIADLO Cc1ccc(NC(=O)[C@H](CC(C)C)n2cc[nH+]c2)c(Cl)c1 ZINC000635068640 1039383802 /nfs/dbraw/zinc/38/38/02/1039383802.db2.gz LCEUCFFSOZKVBW-HNNXBMFYSA-N 1 2 305.809 4.071 20 0 DIADLO C[C@H]([NH2+][C@H]1CC(C)(C)Oc2cc(F)ccc21)c1cscn1 ZINC000540162542 1039440460 /nfs/dbraw/zinc/44/04/60/1039440460.db2.gz ADNPIAFLSJDRAG-GWCFXTLKSA-N 1 2 306.406 4.235 20 0 DIADLO CCCc1ccc([C@H](C)[NH2+][C@@H](CO)c2c(F)cccc2F)cc1 ZINC000540181188 1039444825 /nfs/dbraw/zinc/44/48/25/1039444825.db2.gz FKBDXSOKGBDJKF-UGSOOPFHSA-N 1 2 319.395 4.302 20 0 DIADLO Brc1csc(C[N@@H+]2CCC[C@@H]3CCCC[C@@H]32)n1 ZINC001137780998 1039452813 /nfs/dbraw/zinc/45/28/13/1039452813.db2.gz QDNQLPBSKYGCAH-QWRGUYRKSA-N 1 2 315.280 4.060 20 0 DIADLO Brc1csc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)n1 ZINC001137780998 1039452824 /nfs/dbraw/zinc/45/28/24/1039452824.db2.gz QDNQLPBSKYGCAH-QWRGUYRKSA-N 1 2 315.280 4.060 20 0 DIADLO O[C@H]1CCCc2ccc(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc21 ZINC001213090739 1039470308 /nfs/dbraw/zinc/47/03/08/1039470308.db2.gz DLUNEWPYZMPOQI-SFHVURJKSA-N 1 2 305.381 4.190 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1csc(C(F)(F)F)c1 ZINC000926534326 1039485648 /nfs/dbraw/zinc/48/56/48/1039485648.db2.gz YHQALLHVNUPNMY-UWVGGRQHSA-N 1 2 317.380 4.395 20 0 DIADLO COC[C@@H]([NH2+]Cc1ncc(-c2ccc(C)cc2)o1)c1ccccc1 ZINC000540407538 1039489346 /nfs/dbraw/zinc/48/93/46/1039489346.db2.gz NKJCLDLMDRPKGV-GOSISDBHSA-N 1 2 322.408 4.127 20 0 DIADLO CC[C@H](C)N(Cc1ccccc1)C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC000583943566 1039517330 /nfs/dbraw/zinc/51/73/30/1039517330.db2.gz NKSYZNGZQQLGCY-HNNXBMFYSA-N 1 2 321.424 4.084 20 0 DIADLO FC(F)(F)C1=CC[N@H+](Cc2cnc(-c3ccco3)s2)CC1 ZINC000278516947 1039519985 /nfs/dbraw/zinc/51/99/85/1039519985.db2.gz XOBDDHVXUKSRFD-UHFFFAOYSA-N 1 2 314.332 4.098 20 0 DIADLO FC(F)(F)C1=CC[N@@H+](Cc2cnc(-c3ccco3)s2)CC1 ZINC000278516947 1039520000 /nfs/dbraw/zinc/52/00/00/1039520000.db2.gz XOBDDHVXUKSRFD-UHFFFAOYSA-N 1 2 314.332 4.098 20 0 DIADLO CCC(C)(CC)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000685243039 1039529890 /nfs/dbraw/zinc/52/98/90/1039529890.db2.gz RBOLLTGXBXDPFN-UHFFFAOYSA-N 1 2 310.401 4.059 20 0 DIADLO Cc1nocc1C[N@@H+](Cc1ccc(F)cc1Cl)CC1CC1 ZINC000353456668 1039560866 /nfs/dbraw/zinc/56/08/66/1039560866.db2.gz WCLWINILCMUHEQ-UHFFFAOYSA-N 1 2 308.784 4.188 20 0 DIADLO Cc1nocc1C[N@H+](Cc1ccc(F)cc1Cl)CC1CC1 ZINC000353456668 1039560883 /nfs/dbraw/zinc/56/08/83/1039560883.db2.gz WCLWINILCMUHEQ-UHFFFAOYSA-N 1 2 308.784 4.188 20 0 DIADLO Cc1ccc(CN(Cc2ccco2)Cc2[nH]c(C)c(C)[nH+]2)s1 ZINC000628156471 1039574142 /nfs/dbraw/zinc/57/41/42/1039574142.db2.gz QEESBYSZXNHUTP-UHFFFAOYSA-N 1 2 315.442 4.192 20 0 DIADLO Cc1ccc(-c2ccc(C(=O)Nc3cc(C)[nH+]cc3C)s2)o1 ZINC000541030387 1039614084 /nfs/dbraw/zinc/61/40/84/1039614084.db2.gz KOPDNKFSBHOQSO-UHFFFAOYSA-N 1 2 312.394 4.003 20 0 DIADLO CC[N@H+](Cc1cc(C(C)(C)C)on1)[C@@H](C)c1cccc(O)c1 ZINC000278644705 1039614438 /nfs/dbraw/zinc/61/44/38/1039614438.db2.gz PGVQJDHGEOTTNY-ZDUSSCGKSA-N 1 2 302.418 4.261 20 0 DIADLO CC[N@@H+](Cc1cc(C(C)(C)C)on1)[C@@H](C)c1cccc(O)c1 ZINC000278644705 1039614448 /nfs/dbraw/zinc/61/44/48/1039614448.db2.gz PGVQJDHGEOTTNY-ZDUSSCGKSA-N 1 2 302.418 4.261 20 0 DIADLO Cc1ccccc1-c1cnc(C[NH2+][C@H](C)c2cccc(O)c2)o1 ZINC000584149684 1039619867 /nfs/dbraw/zinc/61/98/67/1039619867.db2.gz RWGWOLWBHPNZHM-CQSZACIVSA-N 1 2 308.381 4.206 20 0 DIADLO CCCOc1cccc2c(N3CCCO[C@@H](CC)C3)cc[nH+]c12 ZINC000541217698 1039640882 /nfs/dbraw/zinc/64/08/82/1039640882.db2.gz ZYNYWDSKUMBSTA-HNNXBMFYSA-N 1 2 314.429 4.029 20 0 DIADLO CCn1c[nH+]cc1CNc1cc(Cl)cc(C(F)(F)F)c1 ZINC000168986000 1039641765 /nfs/dbraw/zinc/64/17/65/1039641765.db2.gz JDBYDCBUBYVOGN-UHFFFAOYSA-N 1 2 303.715 4.187 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2nccn2CCc2ccccc2)c(C)o1 ZINC000278699494 1039660393 /nfs/dbraw/zinc/66/03/93/1039660393.db2.gz KYKCQQYLAAYHGH-MRXNPFEDSA-N 1 2 323.440 4.186 20 0 DIADLO CC(C)(C)C1=CC[N@H+](Cc2cncc(Br)c2)CC1 ZINC000541328087 1039665022 /nfs/dbraw/zinc/66/50/22/1039665022.db2.gz XUTKJUMEHLKPKR-UHFFFAOYSA-N 1 2 309.251 4.022 20 0 DIADLO CC(C)(C)C1=CC[N@@H+](Cc2cncc(Br)c2)CC1 ZINC000541328087 1039665029 /nfs/dbraw/zinc/66/50/29/1039665029.db2.gz XUTKJUMEHLKPKR-UHFFFAOYSA-N 1 2 309.251 4.022 20 0 DIADLO Clc1cccc(-c2nc(C[NH+]3CCCCC3)no2)c1Cl ZINC000442600495 1039692363 /nfs/dbraw/zinc/69/23/63/1039692363.db2.gz OYUNUJWHCHQMOI-UHFFFAOYSA-N 1 2 312.200 4.029 20 0 DIADLO Cc1ccc(OCC[N@@H+](C)Cc2ncc(C(C)C)s2)cc1 ZINC000541537383 1039700961 /nfs/dbraw/zinc/70/09/61/1039700961.db2.gz ORIMOQRJUXDQPA-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO Cc1ccc(OCC[N@H+](C)Cc2ncc(C(C)C)s2)cc1 ZINC000541537383 1039700975 /nfs/dbraw/zinc/70/09/75/1039700975.db2.gz ORIMOQRJUXDQPA-UHFFFAOYSA-N 1 2 304.459 4.086 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+]Cc2ncc(Cl)cc2Cl)cn1 ZINC000541642927 1039723816 /nfs/dbraw/zinc/72/38/16/1039723816.db2.gz MUEWNTHLSCJRND-SNVBAGLBSA-N 1 2 313.232 4.017 20 0 DIADLO Cc1csc([C@@H]([NH2+]Cc2ccc(F)cc2Cl)C2CC2)n1 ZINC000136224612 1039725050 /nfs/dbraw/zinc/72/50/50/1039725050.db2.gz YKMPTSDIHGRYCA-AWEZNQCLSA-N 1 2 310.825 4.485 20 0 DIADLO Cc1noc([C@H](C)[NH2+]Cc2c(C)cc(C(C)(C)C)cc2C)n1 ZINC000541651772 1039726010 /nfs/dbraw/zinc/72/60/10/1039726010.db2.gz YLOISXSHSYPHAF-ZDUSSCGKSA-N 1 2 301.434 4.143 20 0 DIADLO CCc1ccc(-c2noc([C@H](C)[NH2+][C@@H](C)c3cccnc3)n2)cc1 ZINC000541691546 1039729775 /nfs/dbraw/zinc/72/97/75/1039729775.db2.gz PBOPGAQGLVWHFY-KBPBESRZSA-N 1 2 322.412 4.106 20 0 DIADLO CCc1ccc(-c2noc([C@@H](C)[NH2+][C@H](C)c3cccnc3)n2)cc1 ZINC000541691549 1039729843 /nfs/dbraw/zinc/72/98/43/1039729843.db2.gz PBOPGAQGLVWHFY-ZIAGYGMSSA-N 1 2 322.412 4.106 20 0 DIADLO CCCCCOc1cc(C[NH2+][C@@H](C)c2ccon2)ccc1OC ZINC000541783069 1039742534 /nfs/dbraw/zinc/74/25/34/1039742534.db2.gz NHAXKPBFWVNWIS-AWEZNQCLSA-N 1 2 318.417 4.103 20 0 DIADLO CCCCc1noc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)n1 ZINC000464725506 1039749742 /nfs/dbraw/zinc/74/97/42/1039749742.db2.gz OCBBKMDBJZDCBU-XJKSGUPXSA-N 1 2 317.408 4.134 20 0 DIADLO CCCCc1noc(C[N@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)n1 ZINC000464725506 1039749756 /nfs/dbraw/zinc/74/97/56/1039749756.db2.gz OCBBKMDBJZDCBU-XJKSGUPXSA-N 1 2 317.408 4.134 20 0 DIADLO Cc1nnc(C[NH2+][C@H](C)c2cc3cc(C)c(C)cc3o2)s1 ZINC000541882189 1039753346 /nfs/dbraw/zinc/75/33/46/1039753346.db2.gz LKNJJHFURKTFTR-LLVKDONJSA-N 1 2 301.415 4.060 20 0 DIADLO CCc1cnccc1[C@H](C)[NH2+]Cc1ncc(-c2ccc(C)cc2)o1 ZINC000542122653 1039794428 /nfs/dbraw/zinc/79/44/28/1039794428.db2.gz FGVMIEWARDQFMO-HNNXBMFYSA-N 1 2 321.424 4.458 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+]Cc1nc(C2CC2)cs1 ZINC000090458293 1039798063 /nfs/dbraw/zinc/79/80/63/1039798063.db2.gz NGKYDODTQBVEGM-GFCCVEGCSA-N 1 2 302.443 4.270 20 0 DIADLO Cc1ccc(F)cc1NC(=O)[C@H](C)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000542132817 1039798101 /nfs/dbraw/zinc/79/81/01/1039798101.db2.gz JMRAXCBHXYTELU-KGLIPLIRSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1ccc(F)cc1NC(=O)[C@H](C)[N@H+]1Cc2ccccc2[C@H]1C ZINC000542132817 1039798115 /nfs/dbraw/zinc/79/81/15/1039798115.db2.gz JMRAXCBHXYTELU-KGLIPLIRSA-N 1 2 312.388 4.038 20 0 DIADLO Cc1noc(C)c1C[C@@H](C)Nc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC000090094238 1039801095 /nfs/dbraw/zinc/80/10/95/1039801095.db2.gz HRTGSMOPEFERQS-GFCCVEGCSA-N 1 2 316.449 4.371 20 0 DIADLO CCC[NH+](CCC)Cn1nc(C=Cc2ccc(C)o2)[nH]c1=S ZINC000029886072 1039833470 /nfs/dbraw/zinc/83/34/70/1039833470.db2.gz SFXOJPWFELQYEL-CMDGGOBGSA-N 1 2 320.462 4.092 20 0 DIADLO Clc1ccc2oc(C3CCN(c4cccc[nH+]4)CC3)nc2c1 ZINC000091453972 1039850952 /nfs/dbraw/zinc/85/09/52/1039850952.db2.gz KHGKCAUTMVQUTQ-UHFFFAOYSA-N 1 2 313.788 4.260 20 0 DIADLO Cc1ccoc1C[NH2+]Cc1c(Cl)cc(Cl)cc1N(C)C ZINC000491487091 1039852444 /nfs/dbraw/zinc/85/24/44/1039852444.db2.gz QEZKSDSFABRWOP-UHFFFAOYSA-N 1 2 313.228 4.251 20 0 DIADLO Fc1cc(C2CC2)ccc1C[NH2+]Cc1ccn(-c2ccccc2)n1 ZINC000491587380 1039863605 /nfs/dbraw/zinc/86/36/05/1039863605.db2.gz XJHLTNQARUXHJI-UHFFFAOYSA-N 1 2 321.399 4.179 20 0 DIADLO CCc1ccc(-c2noc(C[NH2+][C@@H](C)c3ccsc3)n2)cc1 ZINC000669937584 1039870300 /nfs/dbraw/zinc/87/03/00/1039870300.db2.gz LYCSAMNPEUXYLW-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1nnc(-c2cccs2)o1)c1ccsc1 ZINC000669937937 1039873548 /nfs/dbraw/zinc/87/35/48/1039873548.db2.gz YFPOJBJFIQDWMH-UWVGGRQHSA-N 1 2 305.428 4.271 20 0 DIADLO C[C@H]([NH2+]Cc1nnc(-c2ccccc2Cl)o1)c1ccsc1 ZINC000669938766 1039874448 /nfs/dbraw/zinc/87/44/48/1039874448.db2.gz XQXIPVICXRIKPN-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccc(F)cn1 ZINC000092720087 1039878619 /nfs/dbraw/zinc/87/86/19/1039878619.db2.gz LGGNYWOLMXGRKW-AUUYWEPGSA-N 1 2 307.372 4.056 20 0 DIADLO c1csc(-c2ncc(C[N@@H+]3CCOCC34CCCC4)s2)c1 ZINC000093840679 1039906206 /nfs/dbraw/zinc/90/62/06/1039906206.db2.gz PYMSLSPIKKWPCI-UHFFFAOYSA-N 1 2 320.483 4.017 20 0 DIADLO c1csc(-c2ncc(C[N@H+]3CCOCC34CCCC4)s2)c1 ZINC000093840679 1039906228 /nfs/dbraw/zinc/90/62/28/1039906228.db2.gz PYMSLSPIKKWPCI-UHFFFAOYSA-N 1 2 320.483 4.017 20 0 DIADLO Cc1cccc2cc(C(=O)Nc3ccccc3-n3cc[nH+]c3)oc21 ZINC000140046358 1039941578 /nfs/dbraw/zinc/94/15/78/1039941578.db2.gz QFAARUQJIQNGMD-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO Cc1nonc1[C@H](C)[NH2+][C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000925400792 1039953666 /nfs/dbraw/zinc/95/36/66/1039953666.db2.gz WAXWOBAWPMCNQE-JVXZTZIISA-N 1 2 312.200 4.023 20 0 DIADLO C[C@@H](c1ccccc1F)[N@H+](C)CC(=O)c1c[nH]c2ccccc12 ZINC000165177239 1039979625 /nfs/dbraw/zinc/97/96/25/1039979625.db2.gz YYEUFIXHXPHCKN-ZDUSSCGKSA-N 1 2 310.372 4.183 20 0 DIADLO C[C@@H](c1ccccc1F)[N@@H+](C)CC(=O)c1c[nH]c2ccccc12 ZINC000165177239 1039979638 /nfs/dbraw/zinc/97/96/38/1039979638.db2.gz YYEUFIXHXPHCKN-ZDUSSCGKSA-N 1 2 310.372 4.183 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cc3cnccc3o2)cs1 ZINC000657879892 1039987479 /nfs/dbraw/zinc/98/74/79/1039987479.db2.gz VATASLFFFXVRBM-MNOVXSKESA-N 1 2 301.415 4.259 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F)c1ccn(C)n1 ZINC000926577640 1039988616 /nfs/dbraw/zinc/98/86/16/1039988616.db2.gz RZKOWPQVBKTFNS-IUCAKERBSA-N 1 2 316.207 4.278 20 0 DIADLO C[N@H+](Cc1nccs1)Cc1ccc(OCc2ccccc2)cc1 ZINC000175083137 1040008628 /nfs/dbraw/zinc/00/86/28/1040008628.db2.gz URTUHKWHWUIFDL-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO C[N@@H+](Cc1nccs1)Cc1ccc(OCc2ccccc2)cc1 ZINC000175083137 1040008647 /nfs/dbraw/zinc/00/86/47/1040008647.db2.gz URTUHKWHWUIFDL-UHFFFAOYSA-N 1 2 324.449 4.354 20 0 DIADLO Cc1cccc(CC[C@@H](C)Nc2ccc(Cn3cc[nH+]c3)cn2)c1 ZINC000685447621 1040057092 /nfs/dbraw/zinc/05/70/92/1040057092.db2.gz ULCBPWQBODRPNH-QGZVFWFLSA-N 1 2 320.440 4.068 20 0 DIADLO CC[N@H+](Cc1nc2c(s1)CCCC2)[C@@H](C)c1cccnc1 ZINC000685469963 1040068896 /nfs/dbraw/zinc/06/88/96/1040068896.db2.gz YUVVGLPSNCGLSW-ZDUSSCGKSA-N 1 2 301.459 4.000 20 0 DIADLO CC[N@@H+](Cc1nc2c(s1)CCCC2)[C@@H](C)c1cccnc1 ZINC000685469963 1040068906 /nfs/dbraw/zinc/06/89/06/1040068906.db2.gz YUVVGLPSNCGLSW-ZDUSSCGKSA-N 1 2 301.459 4.000 20 0 DIADLO Cc1cccc(COc2ccc([C@@H](C)[NH2+]Cc3c[nH]cn3)cc2)c1 ZINC000171769906 1040118397 /nfs/dbraw/zinc/11/83/97/1040118397.db2.gz CITBCJQAVCHHKE-MRXNPFEDSA-N 1 2 321.424 4.148 20 0 DIADLO Cc1nocc1C[NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl ZINC000294278128 1040120925 /nfs/dbraw/zinc/12/09/25/1040120925.db2.gz VXFOINZRDCCHOJ-MRVPVSSYSA-N 1 2 303.164 4.280 20 0 DIADLO CCCC[C@H](CC)C(=O)N1CC[NH2+][C@@H](c2cccc(Cl)c2)C1 ZINC000513997325 1040120962 /nfs/dbraw/zinc/12/09/62/1040120962.db2.gz QUVINZNFPGHQTR-WMLDXEAASA-N 1 2 322.880 4.029 20 0 DIADLO Cc1nc(C)c(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)o1 ZINC000685568826 1040137077 /nfs/dbraw/zinc/13/70/77/1040137077.db2.gz MCLDBOXAIRCCCW-MRXNPFEDSA-N 1 2 306.356 4.297 20 0 DIADLO Cc1nc(C)c(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)o1 ZINC000685568826 1040137088 /nfs/dbraw/zinc/13/70/88/1040137088.db2.gz MCLDBOXAIRCCCW-MRXNPFEDSA-N 1 2 306.356 4.297 20 0 DIADLO CSc1ccc(C[N@@H+]2CCO[C@@H](c3cccs3)C2)cc1 ZINC000177756375 1040139118 /nfs/dbraw/zinc/13/91/18/1040139118.db2.gz WZDUPBOOKZJSKH-OAHLLOKOSA-N 1 2 305.468 4.044 20 0 DIADLO CSc1ccc(C[N@H+]2CCO[C@@H](c3cccs3)C2)cc1 ZINC000177756375 1040139130 /nfs/dbraw/zinc/13/91/30/1040139130.db2.gz WZDUPBOOKZJSKH-OAHLLOKOSA-N 1 2 305.468 4.044 20 0 DIADLO COc1ccnc(C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)c1F ZINC000658223625 1040365818 /nfs/dbraw/zinc/36/58/18/1040365818.db2.gz KYFGXQXQOOUMFZ-GFCCVEGCSA-N 1 2 314.360 4.135 20 0 DIADLO CC(C)c1ccc(C[N@H+](C)Cc2nc(-c3ccccc3)no2)cc1 ZINC000612111392 1040373362 /nfs/dbraw/zinc/37/33/62/1040373362.db2.gz XMXOOKVWWKDBGG-UHFFFAOYSA-N 1 2 321.424 4.492 20 0 DIADLO CC(C)c1ccc(C[N@@H+](C)Cc2nc(-c3ccccc3)no2)cc1 ZINC000612111392 1040373375 /nfs/dbraw/zinc/37/33/75/1040373375.db2.gz XMXOOKVWWKDBGG-UHFFFAOYSA-N 1 2 321.424 4.492 20 0 DIADLO C[C@H]([NH2+]CC(F)(F)C(C)(C)C)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000658336350 1040427663 /nfs/dbraw/zinc/42/76/63/1040427663.db2.gz BWAAXXZRBPEHKS-NSHDSACASA-N 1 2 324.415 4.248 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c21)c1nccn1C ZINC000658336182 1040428121 /nfs/dbraw/zinc/42/81/21/1040428121.db2.gz OTUHXQIJFOZCGU-NOZJJQNGSA-N 1 2 310.228 4.065 20 0 DIADLO CC(C)c1nc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@H](C)O)cs1 ZINC000658359793 1040441902 /nfs/dbraw/zinc/44/19/02/1040441902.db2.gz HVRKGZAMFHOMKF-HEHGZKQESA-N 1 2 304.459 4.039 20 0 DIADLO C[N@H+](Cc1csc(Br)c1)Cc1ccccc1F ZINC000404258716 1040502733 /nfs/dbraw/zinc/50/27/33/1040502733.db2.gz QCHOAKACGZPIFN-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[N@@H+](Cc1csc(Br)c1)Cc1ccccc1F ZINC000404258716 1040502747 /nfs/dbraw/zinc/50/27/47/1040502747.db2.gz QCHOAKACGZPIFN-UHFFFAOYSA-N 1 2 314.223 4.282 20 0 DIADLO C[N@H+](C[C@H]1CCCO1)Cn1c(-c2ccccc2)csc1=S ZINC000177146634 1040545729 /nfs/dbraw/zinc/54/57/29/1040545729.db2.gz ISUVVQLIZOVNCR-CQSZACIVSA-N 1 2 320.483 4.014 20 0 DIADLO C[N@@H+](C[C@H]1CCCO1)Cn1c(-c2ccccc2)csc1=S ZINC000177146634 1040545738 /nfs/dbraw/zinc/54/57/38/1040545738.db2.gz ISUVVQLIZOVNCR-CQSZACIVSA-N 1 2 320.483 4.014 20 0 DIADLO CC(C)[C@@H]([NH2+][C@@H](C)c1cn(C(C)C)nn1)c1ccccc1F ZINC000926692386 1040686397 /nfs/dbraw/zinc/68/63/97/1040686397.db2.gz IQPHBLUJVXNOJK-SUMWQHHRSA-N 1 2 304.413 4.046 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+][C@H]1COCc2cccc(Cl)c21 ZINC000924560525 1040733084 /nfs/dbraw/zinc/73/30/84/1040733084.db2.gz XOOQOOSERDXIAC-WBMJQRKESA-N 1 2 317.816 4.271 20 0 DIADLO Cc1cn[nH]c1C[N@@H+]([C@H](C)c1cccc(C(F)(F)F)c1)C1CC1 ZINC000685833548 1040770036 /nfs/dbraw/zinc/77/00/36/1040770036.db2.gz KDZUEUHUCHXFSV-GFCCVEGCSA-N 1 2 323.362 4.463 20 0 DIADLO Cc1cn[nH]c1C[N@H+]([C@H](C)c1cccc(C(F)(F)F)c1)C1CC1 ZINC000685833548 1040770052 /nfs/dbraw/zinc/77/00/52/1040770052.db2.gz KDZUEUHUCHXFSV-GFCCVEGCSA-N 1 2 323.362 4.463 20 0 DIADLO CC[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@@H]1C[C@H]1C ZINC000414091329 1040842989 /nfs/dbraw/zinc/84/29/89/1040842989.db2.gz DGFBMZKBHJQTOI-KYJSFNMBSA-N 1 2 307.441 4.448 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccn(C)n1 ZINC000414124742 1040891537 /nfs/dbraw/zinc/89/15/37/1040891537.db2.gz CKLVGXYVGPDFOE-WFASDCNBSA-N 1 2 311.351 4.073 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1ccn(-c2ccc(F)cc2)n1 ZINC000173538995 1040900097 /nfs/dbraw/zinc/90/00/97/1040900097.db2.gz FOGNGDAUFWLOHN-CYBMUJFWSA-N 1 2 315.417 4.266 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1ccn(-c2ccc(F)cc2)n1 ZINC000173538995 1040900118 /nfs/dbraw/zinc/90/01/18/1040900118.db2.gz FOGNGDAUFWLOHN-CYBMUJFWSA-N 1 2 315.417 4.266 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)c1nc2c(s1)CCC2 ZINC000414155348 1040931502 /nfs/dbraw/zinc/93/15/02/1040931502.db2.gz NDLUXCAPUCUNPF-VHSXEESVSA-N 1 2 307.850 4.092 20 0 DIADLO FC(F)(F)[C@H]1CC(Nc2cccc[nH+]2)C[C@H](C(F)(F)F)C1 ZINC000613438215 1040952985 /nfs/dbraw/zinc/95/29/85/1040952985.db2.gz VINVTRBKYDMNEO-RKDXNWHRSA-N 1 2 312.257 4.403 20 0 DIADLO CC[N@H+](Cc1csc(C(C)(C)C)n1)Cc1ccc(OC)cc1 ZINC000613459096 1040968600 /nfs/dbraw/zinc/96/86/00/1040968600.db2.gz GGOKHXWPQMGAMV-UHFFFAOYSA-N 1 2 318.486 4.471 20 0 DIADLO CC[N@@H+](Cc1csc(C(C)(C)C)n1)Cc1ccc(OC)cc1 ZINC000613459096 1040968621 /nfs/dbraw/zinc/96/86/21/1040968621.db2.gz GGOKHXWPQMGAMV-UHFFFAOYSA-N 1 2 318.486 4.471 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)CC(=O)N(C)C1CCCCC1 ZINC000613485256 1040996515 /nfs/dbraw/zinc/99/65/15/1040996515.db2.gz AYISSGXANUWBDN-AWEZNQCLSA-N 1 2 322.880 4.124 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)CC(=O)N(C)C1CCCCC1 ZINC000613485256 1040996533 /nfs/dbraw/zinc/99/65/33/1040996533.db2.gz AYISSGXANUWBDN-AWEZNQCLSA-N 1 2 322.880 4.124 20 0 DIADLO CN(C)c1ccccc1C[N@H+](C)Cc1ccc(Cl)nc1Cl ZINC000808785715 1041027747 /nfs/dbraw/zinc/02/77/47/1041027747.db2.gz RCKVDXFQPFIGKI-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1ccccc1C[N@@H+](C)Cc1ccc(Cl)nc1Cl ZINC000808785715 1041027766 /nfs/dbraw/zinc/02/77/66/1041027766.db2.gz RCKVDXFQPFIGKI-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO C[C@H]1CC[C@@H]([NH2+]Cc2nccc(C(F)(F)F)n2)c2ccccc21 ZINC000414238220 1041040420 /nfs/dbraw/zinc/04/04/20/1041040420.db2.gz JVPQSFMLIQBTHI-SMDDNHRTSA-N 1 2 321.346 4.224 20 0 DIADLO CC(C)c1ccc(/C=C\CC(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001131515883 1041054257 /nfs/dbraw/zinc/05/42/57/1041054257.db2.gz DXLSEGBQXGLYGT-ARJAWSKDSA-N 1 2 319.408 4.500 20 0 DIADLO Cc1c[nH+]cc(C)c1NC(=O)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC001625885056 1041074113 /nfs/dbraw/zinc/07/41/13/1041074113.db2.gz YTHIRJFRTDCWFJ-OALUTQOASA-N 1 2 316.404 4.016 20 0 DIADLO Fc1ccc([C@H]([NH2+][C@@H]2CCCC[C@H]2F)c2cccnc2)c(F)c1 ZINC000414289126 1041084352 /nfs/dbraw/zinc/08/43/52/1041084352.db2.gz RBVCCYYZDGXKDA-KBAYOESNSA-N 1 2 320.358 4.320 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCc2c1ccc(Cl)c2Cl)c1csnn1 ZINC000414297998 1041094549 /nfs/dbraw/zinc/09/45/49/1041094549.db2.gz IHXMHLPJOZCBKB-HQJQHLMTSA-N 1 2 314.241 4.183 20 0 DIADLO Cc1ccc(C)c(C[N@@H+]2CCCC[C@@H]2c2noc(C3CC3)n2)c1 ZINC000613532021 1041119172 /nfs/dbraw/zinc/11/91/72/1041119172.db2.gz GORBTDFWCGYMTF-QGZVFWFLSA-N 1 2 311.429 4.291 20 0 DIADLO Cc1ccc(C)c(C[N@H+]2CCCC[C@@H]2c2noc(C3CC3)n2)c1 ZINC000613532021 1041119179 /nfs/dbraw/zinc/11/91/79/1041119179.db2.gz GORBTDFWCGYMTF-QGZVFWFLSA-N 1 2 311.429 4.291 20 0 DIADLO CSc1ccc([C@@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc1F ZINC000414325830 1041129255 /nfs/dbraw/zinc/12/92/55/1041129255.db2.gz MTPMRPGBTIYJMQ-SECBINFHSA-N 1 2 323.462 4.127 20 0 DIADLO CCCOc1ccc([C@@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc1 ZINC000414324574 1041130033 /nfs/dbraw/zinc/13/00/33/1041130033.db2.gz KQRSNOGNAUSOCU-GFCCVEGCSA-N 1 2 317.458 4.055 20 0 DIADLO CC(C)(C)c1csc(C[NH+]2CCC(C(F)(F)F)CC2)n1 ZINC000176178035 1041142026 /nfs/dbraw/zinc/14/20/26/1041142026.db2.gz KHCZZOSOGVEQFF-UHFFFAOYSA-N 1 2 306.397 4.215 20 0 DIADLO CC[N@H+](Cc1csc(Cl)n1)[C@H](C)c1cccc(OC)c1 ZINC000809572483 1041187753 /nfs/dbraw/zinc/18/77/53/1041187753.db2.gz OAZZQKLGGGCLDZ-LLVKDONJSA-N 1 2 310.850 4.388 20 0 DIADLO CC[N@@H+](Cc1csc(Cl)n1)[C@H](C)c1cccc(OC)c1 ZINC000809572483 1041187757 /nfs/dbraw/zinc/18/77/57/1041187757.db2.gz OAZZQKLGGGCLDZ-LLVKDONJSA-N 1 2 310.850 4.388 20 0 DIADLO CC[C@@H]([NH2+]Cc1ccc(C)cn1)c1nc(C(F)(F)F)cs1 ZINC000134381647 1041189153 /nfs/dbraw/zinc/18/91/53/1041189153.db2.gz TWEADVNKPWEWJD-LLVKDONJSA-N 1 2 315.364 4.106 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2csc(Cl)n2)CC2CC2)cc1 ZINC000809575316 1041190599 /nfs/dbraw/zinc/19/05/99/1041190599.db2.gz YPFYLUYPEYBXSA-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO Fc1ccc(C[N@H+](Cc2csc(Cl)n2)CC2CC2)cc1 ZINC000809575316 1041190608 /nfs/dbraw/zinc/19/06/08/1041190608.db2.gz YPFYLUYPEYBXSA-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](c2cccc(Cl)c2)c2ccccn2)nc1 ZINC000134416669 1041200421 /nfs/dbraw/zinc/20/04/21/1041200421.db2.gz AUJXBBGZLQWFMB-IBGZPJMESA-N 1 2 323.827 4.318 20 0 DIADLO Cc1ccc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)nn1 ZINC000414378999 1041203112 /nfs/dbraw/zinc/20/31/12/1041203112.db2.gz FGZQVEKTMKGKNF-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)nn1 ZINC000414378999 1041203130 /nfs/dbraw/zinc/20/31/30/1041203130.db2.gz FGZQVEKTMKGKNF-UHFFFAOYSA-N 1 2 317.383 4.008 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+][C@H]1CCCc2oc(C)nc21 ZINC000924582487 1041219630 /nfs/dbraw/zinc/21/96/30/1041219630.db2.gz RJIDIGNUCFHAQY-WFASDCNBSA-N 1 2 300.402 4.028 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)c(C)o1 ZINC000809725928 1041223557 /nfs/dbraw/zinc/22/35/57/1041223557.db2.gz AMMDCUVJINBEFZ-INIZCTEOSA-N 1 2 315.417 4.274 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2nnc(C3CCC3)o2)c(C)o1 ZINC000809725928 1041223573 /nfs/dbraw/zinc/22/35/73/1041223573.db2.gz AMMDCUVJINBEFZ-INIZCTEOSA-N 1 2 315.417 4.274 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)c(C)o1 ZINC000809725930 1041225238 /nfs/dbraw/zinc/22/52/38/1041225238.db2.gz AMMDCUVJINBEFZ-MRXNPFEDSA-N 1 2 315.417 4.274 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2nnc(C3CCC3)o2)c(C)o1 ZINC000809725930 1041225250 /nfs/dbraw/zinc/22/52/50/1041225250.db2.gz AMMDCUVJINBEFZ-MRXNPFEDSA-N 1 2 315.417 4.274 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1coc(C2CC2)n1 ZINC000809780735 1041255202 /nfs/dbraw/zinc/25/52/02/1041255202.db2.gz IFJAOUCRWOAEQQ-MRXNPFEDSA-N 1 2 300.402 4.144 20 0 DIADLO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1coc(C2CC2)n1 ZINC000809780735 1041255219 /nfs/dbraw/zinc/25/52/19/1041255219.db2.gz IFJAOUCRWOAEQQ-MRXNPFEDSA-N 1 2 300.402 4.144 20 0 DIADLO CCCCNc1[nH+]c2ccccc2n1Cc1scnc1C ZINC000809990787 1041287738 /nfs/dbraw/zinc/28/77/38/1041287738.db2.gz GSBYHSKPMPLWRQ-UHFFFAOYSA-N 1 2 300.431 4.062 20 0 DIADLO CC(C)([NH2+]Cc1csc(C(F)(F)F)n1)c1ccccc1 ZINC000892678860 1041309090 /nfs/dbraw/zinc/30/90/90/1041309090.db2.gz LUFQUHSJZKDART-UHFFFAOYSA-N 1 2 300.349 4.187 20 0 DIADLO Fc1ccc2c(c1)CC[C@H]2[NH2+]Cc1csc(C(F)(F)F)n1 ZINC000892680459 1041314783 /nfs/dbraw/zinc/31/47/83/1041314783.db2.gz PICCZHLYMWQBOB-GFCCVEGCSA-N 1 2 316.323 4.078 20 0 DIADLO CCOc1ccc(C[NH2+]Cc2nc3cc(Cl)ccc3s2)o1 ZINC000892722002 1041385258 /nfs/dbraw/zinc/38/52/58/1041385258.db2.gz RBZGZTHUPAOUBJ-UHFFFAOYSA-N 1 2 322.817 4.231 20 0 DIADLO FC(F)(F)c1nc(C[NH2+]C2(c3ccccc3)CCC2)cs1 ZINC000892755077 1041395887 /nfs/dbraw/zinc/39/58/87/1041395887.db2.gz GIJWZDQQKVCUOA-UHFFFAOYSA-N 1 2 312.360 4.331 20 0 DIADLO COc1cccc(C[NH2+][C@@H](C)c2nc(C)cs2)c1OC(C)C ZINC000892856096 1041411700 /nfs/dbraw/zinc/41/17/00/1041411700.db2.gz MPOHLNWYZJLLSI-ZDUSSCGKSA-N 1 2 320.458 4.098 20 0 DIADLO Fc1ccc([C@H]2CC[N@@H+]2Cc2ccc(C(F)(F)F)cn2)cc1 ZINC000661513663 1041430542 /nfs/dbraw/zinc/43/05/42/1041430542.db2.gz NRSNRAUHRPNKHT-OAHLLOKOSA-N 1 2 310.294 4.187 20 0 DIADLO Fc1ccc([C@H]2CC[N@H+]2Cc2ccc(C(F)(F)F)cn2)cc1 ZINC000661513663 1041430548 /nfs/dbraw/zinc/43/05/48/1041430548.db2.gz NRSNRAUHRPNKHT-OAHLLOKOSA-N 1 2 310.294 4.187 20 0 DIADLO Cc1cccc([C@H]2CCCN2c2cc(C)[nH+]c(C3CCC3)n2)n1 ZINC000892943753 1041431188 /nfs/dbraw/zinc/43/11/88/1041431188.db2.gz ZNSBJAFSSLYUEV-QGZVFWFLSA-N 1 2 308.429 4.097 20 0 DIADLO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@H+](C)Cc1ccccc1Cl ZINC000175391025 1041441319 /nfs/dbraw/zinc/44/13/19/1041441319.db2.gz FGDOKJDHVYWCAK-YEJXKQKISA-N 1 2 321.873 4.270 20 0 DIADLO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)Cc1ccccc1Cl ZINC000175391025 1041441325 /nfs/dbraw/zinc/44/13/25/1041441325.db2.gz FGDOKJDHVYWCAK-YEJXKQKISA-N 1 2 321.873 4.270 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2ccc(CC(C)C)nc2)cs1 ZINC000892976633 1041445827 /nfs/dbraw/zinc/44/58/27/1041445827.db2.gz AUXHEXCHNKZGKV-ZDUSSCGKSA-N 1 2 303.475 4.150 20 0 DIADLO CC[C@@H](Nc1cc(C)[nH+]c(C2CCC2)n1)c1c(C)noc1C ZINC000892998341 1041452133 /nfs/dbraw/zinc/45/21/33/1041452133.db2.gz MTXFKFLWBNNBSO-CQSZACIVSA-N 1 2 300.406 4.221 20 0 DIADLO Cc1nn(C)c(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)c1Cl ZINC000893011543 1041455989 /nfs/dbraw/zinc/45/59/89/1041455989.db2.gz KXJFMJUPBGHRKI-QMMMGPOBSA-N 1 2 316.207 4.025 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1ccnc(Cl)c1Cl ZINC000811454643 1041520179 /nfs/dbraw/zinc/52/01/79/1041520179.db2.gz PKCUBICZSZBOCH-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO C[N@H+](Cc1cscc1C(F)(F)F)Cc1ccc(Cl)nc1 ZINC000811453975 1041519027 /nfs/dbraw/zinc/51/90/27/1041519027.db2.gz DYYLJRKODQCCLL-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1cscc1C(F)(F)F)Cc1ccc(Cl)nc1 ZINC000811453975 1041519032 /nfs/dbraw/zinc/51/90/32/1041519032.db2.gz DYYLJRKODQCCLL-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[N@H+](C)Cc3ccsc3)o2)cc1 ZINC000128416834 1041519584 /nfs/dbraw/zinc/51/95/84/1041519584.db2.gz YDFCHBAMNMNGCR-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(-c2nnc([C@H](C)[N@@H+](C)Cc3ccsc3)o2)cc1 ZINC000128416834 1041519591 /nfs/dbraw/zinc/51/95/91/1041519591.db2.gz YDFCHBAMNMNGCR-ZDUSSCGKSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[N@H+](C)Cc3ccsc3)o2)cc1 ZINC000128416603 1041519656 /nfs/dbraw/zinc/51/96/56/1041519656.db2.gz YDFCHBAMNMNGCR-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[N@@H+](C)Cc3ccsc3)o2)cc1 ZINC000128416603 1041519659 /nfs/dbraw/zinc/51/96/59/1041519659.db2.gz YDFCHBAMNMNGCR-CYBMUJFWSA-N 1 2 313.426 4.300 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1ccnc(Cl)c1Cl ZINC000811454643 1041520174 /nfs/dbraw/zinc/52/01/74/1041520174.db2.gz PKCUBICZSZBOCH-UHFFFAOYSA-N 1 2 301.242 4.472 20 0 DIADLO Clc1nccc(C[N@@H+]2CCCc3ccccc3C2)c1Cl ZINC000811462052 1041520397 /nfs/dbraw/zinc/52/03/97/1041520397.db2.gz SUSWJDGLINPTDA-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO Clc1nccc(C[N@H+]2CCCc3ccccc3C2)c1Cl ZINC000811462052 1041520402 /nfs/dbraw/zinc/52/04/02/1041520402.db2.gz SUSWJDGLINPTDA-UHFFFAOYSA-N 1 2 307.224 4.337 20 0 DIADLO Cc1cc(NCc2ccnc(Cl)c2Cl)ccc1[NH+](C)C ZINC000811470266 1041526278 /nfs/dbraw/zinc/52/62/78/1041526278.db2.gz WFWCWAXZQYEUMK-UHFFFAOYSA-N 1 2 310.228 4.375 20 0 DIADLO COc1ccc(-c2nc(C[N@H+](C)Cc3cccs3)co2)cc1 ZINC000042735757 1041548886 /nfs/dbraw/zinc/54/88/86/1041548886.db2.gz KXKJSVGJOVCBCO-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO COc1ccc(-c2nc(C[N@@H+](C)Cc3cccs3)co2)cc1 ZINC000042735757 1041548896 /nfs/dbraw/zinc/54/88/96/1041548896.db2.gz KXKJSVGJOVCBCO-UHFFFAOYSA-N 1 2 314.410 4.044 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@@H+]2Cc2cc(C3CC3)no2)cc1 ZINC000659938454 1041549035 /nfs/dbraw/zinc/54/90/35/1041549035.db2.gz UPLZPFBIASSRFO-GOSISDBHSA-N 1 2 314.454 4.151 20 0 DIADLO Cc1ccc([C@H]2CSCC[N@H+]2Cc2cc(C3CC3)no2)cc1 ZINC000659938454 1041549044 /nfs/dbraw/zinc/54/90/44/1041549044.db2.gz UPLZPFBIASSRFO-GOSISDBHSA-N 1 2 314.454 4.151 20 0 DIADLO Cc1[nH]ncc1[C@H](C)[NH2+][C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C ZINC000246059644 1041568886 /nfs/dbraw/zinc/56/88/86/1041568886.db2.gz ZAQYQBPFESIUMF-PPKUODPHSA-N 1 2 303.837 4.419 20 0 DIADLO C[C@H]([NH2+]c1ccc(N(C)Cc2ccccc2)cc1)[C@@H]1CCOC1 ZINC000182901129 1041576199 /nfs/dbraw/zinc/57/61/99/1041576199.db2.gz SXCOGZYLBVRNNW-FUHWJXTLSA-N 1 2 310.441 4.160 20 0 DIADLO CC(C)c1ccc(C(=O)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC000613707351 1041577776 /nfs/dbraw/zinc/57/77/76/1041577776.db2.gz AHXQMKWOLOSHHF-UHFFFAOYSA-N 1 2 305.381 4.248 20 0 DIADLO CCCC1(CCC)CCCN1C(=O)c1ccn2c(C)c[nH+]c2c1 ZINC001133120424 1041591060 /nfs/dbraw/zinc/59/10/60/1041591060.db2.gz XRKBEMZEIPFRAW-UHFFFAOYSA-N 1 2 313.445 4.218 20 0 DIADLO CC(=O)[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2C(F)(F)F)C1 ZINC001143505631 1041595640 /nfs/dbraw/zinc/59/56/40/1041595640.db2.gz LQMVURPCUAIENI-LLVKDONJSA-N 1 2 319.754 4.160 20 0 DIADLO CC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2C(F)(F)F)C1 ZINC001143505631 1041595646 /nfs/dbraw/zinc/59/56/46/1041595646.db2.gz LQMVURPCUAIENI-LLVKDONJSA-N 1 2 319.754 4.160 20 0 DIADLO CC[C@@](C)([NH2+]Cc1nsc2ccccc12)c1nccs1 ZINC000660079242 1041603544 /nfs/dbraw/zinc/60/35/44/1041603544.db2.gz DMZARBDKDYRZHO-OAHLLOKOSA-N 1 2 303.456 4.168 20 0 DIADLO Clc1cc2nc(/C=C/c3[nH]cc[nH+]3)oc2c(Br)c1 ZINC000812242878 1041606167 /nfs/dbraw/zinc/60/61/67/1041606167.db2.gz XLRFJKQVMGKOPP-OWOJBTEDSA-N 1 2 324.565 4.137 20 0 DIADLO NC(Cc1cccc(F)c1)=[NH+]OCc1ccc(C(F)F)cc1 ZINC000783154753 1041611078 /nfs/dbraw/zinc/61/10/78/1041611078.db2.gz ABTKBBNLYVNNID-UHFFFAOYSA-N 1 2 308.303 4.004 20 0 DIADLO c1c(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3o2)onc1C1CC1 ZINC000660102185 1041615356 /nfs/dbraw/zinc/61/53/56/1041615356.db2.gz VAPCYSHNYIHZIM-QGZVFWFLSA-N 1 2 323.396 4.420 20 0 DIADLO c1c(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3o2)onc1C1CC1 ZINC000660102185 1041615363 /nfs/dbraw/zinc/61/53/63/1041615363.db2.gz VAPCYSHNYIHZIM-QGZVFWFLSA-N 1 2 323.396 4.420 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc(C(F)(F)F)cc3)cc2[nH+]1 ZINC000010895989 1041616908 /nfs/dbraw/zinc/61/69/08/1041616908.db2.gz JFLSQNIINUILAW-UHFFFAOYSA-N 1 2 319.286 4.142 20 0 DIADLO Fc1cccc(C[N@@H+]2CCC[C@H]2c2cccnc2)c1OC(F)F ZINC000660138334 1041626717 /nfs/dbraw/zinc/62/67/17/1041626717.db2.gz SLXUJSYJLPSGCM-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Fc1cccc(C[N@H+]2CCC[C@H]2c2cccnc2)c1OC(F)F ZINC000660138334 1041626724 /nfs/dbraw/zinc/62/67/24/1041626724.db2.gz SLXUJSYJLPSGCM-HNNXBMFYSA-N 1 2 322.330 4.159 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2ccccc2OCc2ccccc2)co1 ZINC000660190687 1041657883 /nfs/dbraw/zinc/65/78/83/1041657883.db2.gz XOJJZRVOGWJADB-OAHLLOKOSA-N 1 2 322.408 4.413 20 0 DIADLO Cc1cccc([C@@H](C)[NH2+]Cc2nnc(C(F)(F)F)s2)c1C ZINC000660197610 1041661760 /nfs/dbraw/zinc/66/17/60/1041661760.db2.gz RONOTZTYBQIJJM-SNVBAGLBSA-N 1 2 315.364 4.025 20 0 DIADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(OCC3CC3)c(F)c2)c(C)o1 ZINC000660201156 1041665700 /nfs/dbraw/zinc/66/57/00/1041665700.db2.gz UIDSBADEDZVYQF-NSHDSACASA-N 1 2 318.392 4.070 20 0 DIADLO CC[C@@H]([NH2+]Cc1nsc2ccccc12)c1nc(C)cs1 ZINC000660251761 1041690984 /nfs/dbraw/zinc/69/09/84/1041690984.db2.gz CGGAQJRNBCLWDO-GFCCVEGCSA-N 1 2 303.456 4.302 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(F)ccc1OC(F)F)c1nccs1 ZINC000660253781 1041692713 /nfs/dbraw/zinc/69/27/13/1041692713.db2.gz LIOHGGHOLCMMOL-LLVKDONJSA-N 1 2 316.348 4.125 20 0 DIADLO Cc1cnc([C@H](C)[NH2+]Cc2cccc(F)c2OC(F)F)s1 ZINC000660269161 1041698116 /nfs/dbraw/zinc/69/81/16/1041698116.db2.gz LTDRHYSSGSKTMJ-VIFPVBQESA-N 1 2 316.348 4.043 20 0 DIADLO CC[C@@H](CC(F)F)C[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000660331782 1041718528 /nfs/dbraw/zinc/71/85/28/1041718528.db2.gz XRGLFPFUZCGZPM-NHYWBVRUSA-N 1 2 319.342 4.020 20 0 DIADLO CC[C@@H](CC(F)F)C[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000660331782 1041718531 /nfs/dbraw/zinc/71/85/31/1041718531.db2.gz XRGLFPFUZCGZPM-NHYWBVRUSA-N 1 2 319.342 4.020 20 0 DIADLO Cn1c[nH+]cc1CNc1cccc(Cl)c1SC(F)F ZINC000759777958 1041728231 /nfs/dbraw/zinc/72/82/31/1041728231.db2.gz QWZNWRHXXUTSSN-UHFFFAOYSA-N 1 2 303.765 4.000 20 0 DIADLO Cc1ccoc1C[NH2+]Cc1c(C)nn(-c2ccccc2)c1Cl ZINC000813790986 1041732763 /nfs/dbraw/zinc/73/27/63/1041732763.db2.gz MGIBJTVGEMXJIG-UHFFFAOYSA-N 1 2 315.804 4.025 20 0 DIADLO FC(F)(F)c1cc(C[NH2+]Cc2cocn2)cc(C(F)(F)F)c1 ZINC000397938044 1041739459 /nfs/dbraw/zinc/73/94/59/1041739459.db2.gz OVCWRNWUHWCGER-UHFFFAOYSA-N 1 2 324.224 4.002 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3cccc(Cl)n3)CC2)cn1 ZINC000364307486 1041739649 /nfs/dbraw/zinc/73/96/49/1041739649.db2.gz SEQZYOQACVDCKU-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3cccc(Cl)n3)CC2)cn1 ZINC000364307486 1041739654 /nfs/dbraw/zinc/73/96/54/1041739654.db2.gz SEQZYOQACVDCKU-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCC1(F)F)c1cccc(Br)c1 ZINC000397955188 1041740932 /nfs/dbraw/zinc/74/09/32/1041740932.db2.gz MPNJWRCTZDZINH-JOYOIKCWSA-N 1 2 304.178 4.288 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCC[N@@H+]1C/C=C\Cl ZINC000759805840 1041743781 /nfs/dbraw/zinc/74/37/81/1041743781.db2.gz ZRSNGJWGQOYVOO-VGVVRCBHSA-N 1 2 316.276 4.390 20 0 DIADLO Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCC[N@H+]1C/C=C\Cl ZINC000759805840 1041743785 /nfs/dbraw/zinc/74/37/85/1041743785.db2.gz ZRSNGJWGQOYVOO-VGVVRCBHSA-N 1 2 316.276 4.390 20 0 DIADLO Cc1nc2cc(CNc3cc4cc(F)ccc4c[nH+]3)ccc2o1 ZINC001167756474 1041758085 /nfs/dbraw/zinc/75/80/85/1041758085.db2.gz IXGFILQOCCXSHO-UHFFFAOYSA-N 1 2 307.328 4.436 20 0 DIADLO CC(C)CCCCCC(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000747908941 1041786352 /nfs/dbraw/zinc/78/63/52/1041786352.db2.gz RWWPLUPUFCNXES-INIZCTEOSA-N 1 2 307.482 4.021 20 0 DIADLO COc1ccc(COc2cc[nH+]cc2)cc1SC(F)(F)F ZINC000814265991 1041799145 /nfs/dbraw/zinc/79/91/45/1041799145.db2.gz UMLYNNLGPZVKMX-UHFFFAOYSA-N 1 2 315.316 4.281 20 0 DIADLO Cc1cncc(C[N@@H+](C)[C@@H](C)c2nc3cc(Cl)ccc3[nH]2)c1 ZINC000660708015 1041855397 /nfs/dbraw/zinc/85/53/97/1041855397.db2.gz LFTFWLTYNQOUAC-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO Cc1cncc(C[N@H+](C)[C@@H](C)c2nc3cc(Cl)ccc3[nH]2)c1 ZINC000660708015 1041855405 /nfs/dbraw/zinc/85/54/05/1041855405.db2.gz LFTFWLTYNQOUAC-LBPRGKRZSA-N 1 2 314.820 4.113 20 0 DIADLO C[C@@H](c1nc2ccc(Cl)cc2[nH]1)[N@H+](C)CCOC(C)(C)C ZINC000660707200 1041855908 /nfs/dbraw/zinc/85/59/08/1041855908.db2.gz FCVWQXJWLPIXPG-NSHDSACASA-N 1 2 309.841 4.024 20 0 DIADLO C[C@@H](c1nc2ccc(Cl)cc2[nH]1)[N@@H+](C)CCOC(C)(C)C ZINC000660707200 1041855910 /nfs/dbraw/zinc/85/59/10/1041855910.db2.gz FCVWQXJWLPIXPG-NSHDSACASA-N 1 2 309.841 4.024 20 0 DIADLO C[N@H+](CC1CCC(C)(C)CC1)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660764631 1041860223 /nfs/dbraw/zinc/86/02/23/1041860223.db2.gz PIYUHEUSOYEHFX-KRWDZBQOSA-N 1 2 312.461 4.042 20 0 DIADLO C[N@@H+](CC1CCC(C)(C)CC1)[C@H](c1nnc[nH]1)c1ccccc1 ZINC000660764631 1041860231 /nfs/dbraw/zinc/86/02/31/1041860231.db2.gz PIYUHEUSOYEHFX-KRWDZBQOSA-N 1 2 312.461 4.042 20 0 DIADLO C[C@H](C[N@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1)C1CCCCC1 ZINC000660767890 1041860883 /nfs/dbraw/zinc/86/08/83/1041860883.db2.gz OQHIFVHWHGXBHS-CRAIPNDOSA-N 1 2 312.461 4.042 20 0 DIADLO C[C@H](C[N@@H+](C)[C@@H](c1nnc[nH]1)c1ccccc1)C1CCCCC1 ZINC000660767890 1041860887 /nfs/dbraw/zinc/86/08/87/1041860887.db2.gz OQHIFVHWHGXBHS-CRAIPNDOSA-N 1 2 312.461 4.042 20 0 DIADLO C[N@H+](CC1CCCCC1)Cn1nc(-c2ccccc2)[nH]c1=S ZINC000027081585 1041867784 /nfs/dbraw/zinc/86/77/84/1041867784.db2.gz YANCMBOJHDZTGA-UHFFFAOYSA-N 1 2 316.474 4.077 20 0 DIADLO C[N@@H+](CC1CCCCC1)Cn1nc(-c2ccccc2)[nH]c1=S ZINC000027081585 1041867791 /nfs/dbraw/zinc/86/77/91/1041867791.db2.gz YANCMBOJHDZTGA-UHFFFAOYSA-N 1 2 316.474 4.077 20 0 DIADLO c1c(C[N@@H+]2CCc3oc(-c4ccccc4)cc3C2)onc1C1CC1 ZINC000660913576 1041869587 /nfs/dbraw/zinc/86/95/87/1041869587.db2.gz OLSKUPYCQNEZRB-UHFFFAOYSA-N 1 2 320.392 4.370 20 0 DIADLO c1c(C[N@H+]2CCc3oc(-c4ccccc4)cc3C2)onc1C1CC1 ZINC000660913576 1041869594 /nfs/dbraw/zinc/86/95/94/1041869594.db2.gz OLSKUPYCQNEZRB-UHFFFAOYSA-N 1 2 320.392 4.370 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@@H]2CCc3ccc(F)c(Cl)c32)n1 ZINC000651719454 1041891240 /nfs/dbraw/zinc/89/12/40/1041891240.db2.gz TVIHMNYSMGZODP-CQSZACIVSA-N 1 2 307.800 4.034 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)n1 ZINC000651719108 1041892238 /nfs/dbraw/zinc/89/22/38/1041892238.db2.gz JMTNNCPJTPPRDW-MRXNPFEDSA-N 1 2 320.440 4.377 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccnc(Br)c2)[C@H]1c1ccccc1 ZINC000815058066 1041907051 /nfs/dbraw/zinc/90/70/51/1041907051.db2.gz MESJDZQHFROTTQ-MLGOLLRUSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccnc(Br)c2)[C@H]1c1ccccc1 ZINC000815058066 1041907057 /nfs/dbraw/zinc/90/70/57/1041907057.db2.gz MESJDZQHFROTTQ-MLGOLLRUSA-N 1 2 317.230 4.037 20 0 DIADLO C[C@@H]([NH2+][C@H](CCO)c1ccco1)c1ccc(-c2ccccc2)cn1 ZINC000651764158 1041907090 /nfs/dbraw/zinc/90/70/90/1041907090.db2.gz HOOCYGMJBJLOKO-DNVCBOLYSA-N 1 2 322.408 4.116 20 0 DIADLO CN(C)c1ccc(NC2c3ccccc3-c3ccccc32)[nH+]c1 ZINC001167777210 1041919859 /nfs/dbraw/zinc/91/98/59/1041919859.db2.gz XNEAFEPIQDMIPM-UHFFFAOYSA-N 1 2 301.393 4.330 20 0 DIADLO CCc1nc(C)c(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)o1 ZINC000651816310 1041920919 /nfs/dbraw/zinc/92/09/19/1041920919.db2.gz NFZVFMWJKREQMN-AWEZNQCLSA-N 1 2 321.424 4.458 20 0 DIADLO CCCc1ncc(C[NH2+][C@H]2CCc3ccc(F)c(Cl)c32)o1 ZINC000651823430 1041923179 /nfs/dbraw/zinc/92/31/79/1041923179.db2.gz IHXATWHHUBDUAV-ZDUSSCGKSA-N 1 2 308.784 4.197 20 0 DIADLO CCCOc1ccc(Nc2[nH+]cccc2N2CCCC2)cc1F ZINC001211667675 1041932822 /nfs/dbraw/zinc/93/28/22/1041932822.db2.gz DJMYJEGBMVFMFT-UHFFFAOYSA-N 1 2 315.392 4.353 20 0 DIADLO Cc1nc(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccco2)sc1C ZINC000661435214 1041937559 /nfs/dbraw/zinc/93/75/59/1041937559.db2.gz NSWHUSBOTVTELV-MRXNPFEDSA-N 1 2 302.443 4.470 20 0 DIADLO Cc1nc(C[N@H+]2CC3(CCCC3)[C@H]2c2ccco2)sc1C ZINC000661435214 1041937564 /nfs/dbraw/zinc/93/75/64/1041937564.db2.gz NSWHUSBOTVTELV-MRXNPFEDSA-N 1 2 302.443 4.470 20 0 DIADLO COCc1cnc(C[NH2+]C2(c3ccccc3Cl)CCC2)s1 ZINC000651861123 1041937657 /nfs/dbraw/zinc/93/76/57/1041937657.db2.gz HDKPOMYVNRXUDG-UHFFFAOYSA-N 1 2 322.861 4.112 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H](c2ccccc2F)C(C)C)s1 ZINC000661482780 1041944174 /nfs/dbraw/zinc/94/41/74/1041944174.db2.gz DBCOBOOJFAAQGZ-OAHLLOKOSA-N 1 2 307.438 4.288 20 0 DIADLO Clc1ccsc1C[N@@H+]1CC2(CCOCC2)[C@@H]1c1ccco1 ZINC000661561030 1041952876 /nfs/dbraw/zinc/95/28/76/1041952876.db2.gz JWZINOSBVLIIDA-HNNXBMFYSA-N 1 2 323.845 4.348 20 0 DIADLO Clc1ccsc1C[N@H+]1CC2(CCOCC2)[C@@H]1c1ccco1 ZINC000661561030 1041952878 /nfs/dbraw/zinc/95/28/78/1041952878.db2.gz JWZINOSBVLIIDA-HNNXBMFYSA-N 1 2 323.845 4.348 20 0 DIADLO Clc1ccc(C[N@@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)cc1 ZINC000661561074 1041953060 /nfs/dbraw/zinc/95/30/60/1041953060.db2.gz KKXAQRBHFKFOCY-KRWDZBQOSA-N 1 2 317.816 4.287 20 0 DIADLO Clc1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)cc1 ZINC000661561074 1041953067 /nfs/dbraw/zinc/95/30/67/1041953067.db2.gz KKXAQRBHFKFOCY-KRWDZBQOSA-N 1 2 317.816 4.287 20 0 DIADLO CC(C)CCCCCC[NH2+][C@@H](c1cccs1)c1nnc[nH]1 ZINC000815552462 1041960888 /nfs/dbraw/zinc/96/08/88/1041960888.db2.gz BUPMYNDKJOMBOM-HNNXBMFYSA-N 1 2 306.479 4.152 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2nc(C)c(C)s2)cc1F ZINC000661659738 1041966610 /nfs/dbraw/zinc/96/66/10/1041966610.db2.gz MCKULUOVUSZLTN-HNNXBMFYSA-N 1 2 320.433 4.245 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2nc(C)c(C)s2)cc1F ZINC000661659738 1041966614 /nfs/dbraw/zinc/96/66/14/1041966614.db2.gz MCKULUOVUSZLTN-HNNXBMFYSA-N 1 2 320.433 4.245 20 0 DIADLO CCCCCC(C)(C)C[NH2+][C@H](c1nnc[nH]1)c1ccc(F)cc1 ZINC000815587900 1041968018 /nfs/dbraw/zinc/96/80/18/1041968018.db2.gz WWKDOGXYQZPTQH-INIZCTEOSA-N 1 2 318.440 4.229 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1nccn1C1CC1)c1ccc(Cl)cc1F ZINC000893491843 1041974863 /nfs/dbraw/zinc/97/48/63/1041974863.db2.gz MJEPYZYIPJWGSW-QGZVFWFLSA-N 1 2 321.827 4.497 20 0 DIADLO CCCc1noc(C[N@H+](Cc2cccc(Cl)c2)C(C)C)n1 ZINC000047958923 1041976576 /nfs/dbraw/zinc/97/65/76/1041976576.db2.gz GKZNMFMFQJXYHZ-UHFFFAOYSA-N 1 2 307.825 4.086 20 0 DIADLO CCCc1noc(C[N@@H+](Cc2cccc(Cl)c2)C(C)C)n1 ZINC000047958923 1041976580 /nfs/dbraw/zinc/97/65/80/1041976580.db2.gz GKZNMFMFQJXYHZ-UHFFFAOYSA-N 1 2 307.825 4.086 20 0 DIADLO C[C@H]1C[C@H]([NH2+]C2(c3ccccc3Cl)CCC2)c2nccn21 ZINC000652216949 1041977890 /nfs/dbraw/zinc/97/78/90/1041977890.db2.gz KGWAHVVRXJRPPL-WFASDCNBSA-N 1 2 301.821 4.211 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]C2(c3ccccc3Cl)CCC2)nn1C ZINC000652216077 1041978126 /nfs/dbraw/zinc/97/81/26/1041978126.db2.gz IJHHKKCFFACOGM-CYBMUJFWSA-N 1 2 303.837 4.112 20 0 DIADLO Cc1[nH]c(CN2CCCC[C@@H]2c2ccc(Cl)cc2)[nH+]c1C ZINC000628300717 1041979663 /nfs/dbraw/zinc/97/96/63/1041979663.db2.gz SHIUTZLPNDPOEG-MRXNPFEDSA-N 1 2 303.837 4.407 20 0 DIADLO OCCSCc1cc[nH+]c(N[C@@H]2CCCCC23CCCC3)c1 ZINC000815609109 1041980311 /nfs/dbraw/zinc/98/03/11/1041980311.db2.gz XCDVXRFWFVTYIL-MRXNPFEDSA-N 1 2 320.502 4.222 20 0 DIADLO Fc1cc2c(c(F)c1)CC[C@@H]2[NH2+]Cc1c(F)cc(F)cc1F ZINC000815648926 1041984560 /nfs/dbraw/zinc/98/45/60/1041984560.db2.gz BWQGPEFUAGBIFZ-INIZCTEOSA-N 1 2 313.269 4.159 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccc(F)c(F)c1 ZINC000815650318 1041985582 /nfs/dbraw/zinc/98/55/82/1041985582.db2.gz OHPMMKASRXBDFV-MRVPVSSYSA-N 1 2 301.258 4.233 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1NC(=O)CCn1cc[nH+]c1 ZINC000597009406 1041999660 /nfs/dbraw/zinc/99/96/60/1041999660.db2.gz BLWPKZDEUNBUDW-UHFFFAOYSA-N 1 2 321.380 4.013 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CCCOc3ccc(Cl)cc32)c1 ZINC000652330713 1042010101 /nfs/dbraw/zinc/01/01/01/1042010101.db2.gz NJXHXROOMFRRIV-HNNXBMFYSA-N 1 2 318.804 4.207 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2CCCOc3cc(C)c(C)cc32)c1 ZINC000652330966 1042011546 /nfs/dbraw/zinc/01/15/46/1042011546.db2.gz UFTLGNQWWCNGDF-KRWDZBQOSA-N 1 2 312.413 4.171 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2ccc(Cl)cc2OC)c1 ZINC000652331536 1042012564 /nfs/dbraw/zinc/01/25/64/1042012564.db2.gz KAZJFQLXQYUNRU-LLVKDONJSA-N 1 2 306.793 4.063 20 0 DIADLO C[C@H]1COCC[C@@H]1Nc1[nH+]ccc2cccc(C(F)(F)F)c21 ZINC001170820962 1042042005 /nfs/dbraw/zinc/04/20/05/1042042005.db2.gz QFMXXHUUONSZKW-GWCFXTLKSA-N 1 2 310.319 4.091 20 0 DIADLO FC(F)(F)c1csc(C[N@@H+]2CCC[C@H](C3CCC3)C2)n1 ZINC000662044683 1042048885 /nfs/dbraw/zinc/04/88/85/1042048885.db2.gz SNNKSOWQJWTKOH-NSHDSACASA-N 1 2 304.381 4.174 20 0 DIADLO FC(F)(F)c1csc(C[N@H+]2CCC[C@H](C3CCC3)C2)n1 ZINC000662044683 1042048891 /nfs/dbraw/zinc/04/88/91/1042048891.db2.gz SNNKSOWQJWTKOH-NSHDSACASA-N 1 2 304.381 4.174 20 0 DIADLO O=C1CCCc2cc(Nc3cc(Cl)c4[nH+]ccn4c3)ccc21 ZINC001213103378 1042063474 /nfs/dbraw/zinc/06/34/74/1042063474.db2.gz ZTNWVZCDZJTXRD-UHFFFAOYSA-N 1 2 311.772 4.250 20 0 DIADLO Cc1ccc(NC(=O)C[C@H](c2[nH]cc[nH+]2)c2ccccc2)c(F)c1 ZINC001135675060 1042078744 /nfs/dbraw/zinc/07/87/44/1042078744.db2.gz ZIIKEJPTVGXOEZ-HNNXBMFYSA-N 1 2 323.371 4.018 20 0 DIADLO C[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1csc2ccccc21 ZINC000817276171 1042101881 /nfs/dbraw/zinc/10/18/81/1042101881.db2.gz UBTSLBNNLMAZSF-SNVBAGLBSA-N 1 2 305.834 4.139 20 0 DIADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)Oc1ccc2oc3ccccc3c2c1 ZINC001135911333 1042105853 /nfs/dbraw/zinc/10/58/53/1042105853.db2.gz CXMGEDGUWCJIJE-LBPRGKRZSA-N 1 2 320.348 4.093 20 0 DIADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)Oc1ccc2oc3ccccc3c2c1 ZINC001135911333 1042105855 /nfs/dbraw/zinc/10/58/55/1042105855.db2.gz CXMGEDGUWCJIJE-LBPRGKRZSA-N 1 2 320.348 4.093 20 0 DIADLO CC(C)c1cccc(C[NH2+][C@@H](c2nccn2C)c2ccccc2)c1 ZINC000663314272 1042109921 /nfs/dbraw/zinc/10/99/21/1042109921.db2.gz COOJIIGYMYIEQN-HXUWFJFHSA-N 1 2 319.452 4.423 20 0 DIADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1csc([C@@H](C)OC)n1 ZINC000165241010 1042121255 /nfs/dbraw/zinc/12/12/55/1042121255.db2.gz AWBFPXORMSDEPV-QWHCGFSZSA-N 1 2 320.458 4.018 20 0 DIADLO CCOc1cccc([C@H](C)[NH2+]Cc2csc([C@H](C)OC)n2)c1 ZINC000165243528 1042124499 /nfs/dbraw/zinc/12/44/99/1042124499.db2.gz XAYPCANSZOVIJV-STQMWFEESA-N 1 2 320.458 4.100 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@H](C)c2cccc(Cl)c2)cs1 ZINC000165247335 1042126524 /nfs/dbraw/zinc/12/65/24/1042126524.db2.gz ZVHGKVQMAKMODY-MNOVXSKESA-N 1 2 310.850 4.355 20 0 DIADLO O=C(CCCC1CC1)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000643236470 1042151567 /nfs/dbraw/zinc/15/15/67/1042151567.db2.gz YCMDLDPRWBECHX-UHFFFAOYSA-N 1 2 321.424 4.121 20 0 DIADLO CCCCN(C(=O)c1cccc2[nH+]ccn21)[C@@H]1CCC[C@H](C)C1 ZINC000818809051 1042160806 /nfs/dbraw/zinc/16/08/06/1042160806.db2.gz HWNKTPMFFHQNMC-JKSUJKDBSA-N 1 2 313.445 4.155 20 0 DIADLO N#Cc1sc(Nc2ccc([NH+]3CCCCC3)cc2)nc1Cl ZINC000314795711 1042170741 /nfs/dbraw/zinc/17/07/41/1042170741.db2.gz VDVPWOCYNOMDPN-UHFFFAOYSA-N 1 2 318.833 4.402 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cnc(Cl)c(C(F)(F)F)c1 ZINC000819147531 1042171891 /nfs/dbraw/zinc/17/18/91/1042171891.db2.gz RFOQEDHVTBRXGO-UHFFFAOYSA-N 1 2 318.730 4.143 20 0 DIADLO CC(C)(C)/C=C\C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000819606080 1042190106 /nfs/dbraw/zinc/19/01/06/1042190106.db2.gz OSZXOSANUOCWGI-QXMHVHEDSA-N 1 2 323.440 4.427 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C2CCCCC2)cs1)c1ccccn1 ZINC000278916755 1042209388 /nfs/dbraw/zinc/20/93/88/1042209388.db2.gz WGLPZAIJUZNBSE-ZDUSSCGKSA-N 1 2 301.459 4.437 20 0 DIADLO C[C@H](N[C@H](c1ccco1)c1ccccc1)c1cn2c([nH+]1)CCCC2 ZINC000820805975 1042228017 /nfs/dbraw/zinc/22/80/17/1042228017.db2.gz WFDGQRAYLYEKTC-YWZLYKJASA-N 1 2 321.424 4.253 20 0 DIADLO COc1ccc(OC)c([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c1 ZINC000319722998 1042228567 /nfs/dbraw/zinc/22/85/67/1042228567.db2.gz BEKWWFAGEWAZTC-NEPJUHHUSA-N 1 2 321.367 4.394 20 0 DIADLO CC(C)(C)SCC[N@@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000369205277 1042253200 /nfs/dbraw/zinc/25/32/00/1042253200.db2.gz JCNSKGQIZLGSIF-CYBMUJFWSA-N 1 2 309.479 4.006 20 0 DIADLO CC(C)(C)SCC[N@H+]1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000369205277 1042253205 /nfs/dbraw/zinc/25/32/05/1042253205.db2.gz JCNSKGQIZLGSIF-CYBMUJFWSA-N 1 2 309.479 4.006 20 0 DIADLO CC(C)(C)[C@@H]1CCCC[C@@H]1CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001136512698 1042267851 /nfs/dbraw/zinc/26/78/51/1042267851.db2.gz HEJQIHVOLJTFSL-UKRRQHHQSA-N 1 2 313.445 4.145 20 0 DIADLO CC(C)(C)[C@H]1CCCC[C@@H]1CNC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001136512697 1042268121 /nfs/dbraw/zinc/26/81/21/1042268121.db2.gz HEJQIHVOLJTFSL-HIFRSBDPSA-N 1 2 313.445 4.145 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+]C2(c3cccc(F)c3)CC2)s1 ZINC000279116675 1042274560 /nfs/dbraw/zinc/27/45/60/1042274560.db2.gz LAUHBSWKJBWTAU-UHFFFAOYSA-N 1 2 304.434 4.359 20 0 DIADLO C[C@@H]1CCN(c2[nH+]ccc3c(N)cccc32)[C@H](c2ccco2)C1 ZINC000663674287 1042277078 /nfs/dbraw/zinc/27/70/78/1042277078.db2.gz HUBYXCBNCYQYAL-DYVFJYSZSA-N 1 2 307.397 4.388 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+]Cc1csc(Cl)n1 ZINC000828656086 1042281030 /nfs/dbraw/zinc/28/10/30/1042281030.db2.gz OBVMJHPJFYGSRG-ZDUSSCGKSA-N 1 2 310.850 4.436 20 0 DIADLO CCN(C(=O)[C@@H](CC(C)C)n1cc[nH+]c1)c1ccc2[nH]ccc2c1 ZINC000822348563 1042283950 /nfs/dbraw/zinc/28/39/50/1042283950.db2.gz MRDYGXJVVWPXMJ-GOSISDBHSA-N 1 2 324.428 4.005 20 0 DIADLO CC/C(C)=C\C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000822533873 1042289204 /nfs/dbraw/zinc/28/92/04/1042289204.db2.gz OPACNUVNIGKDQS-OWBHPGMISA-N 1 2 309.413 4.181 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2F)c(OC)c1 ZINC001137661517 1042290448 /nfs/dbraw/zinc/29/04/48/1042290448.db2.gz WMAMXGVSGLRVJF-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2F)c(OC)c1 ZINC001137661517 1042290452 /nfs/dbraw/zinc/29/04/52/1042290452.db2.gz WMAMXGVSGLRVJF-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO c1cc2cccc(CNc3ccc(N4CCCCC4)[nH+]c3)c2[nH]1 ZINC000391058781 1042298078 /nfs/dbraw/zinc/29/80/78/1042298078.db2.gz GUNIVOMHPGWJNP-UHFFFAOYSA-N 1 2 306.413 4.165 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@]3(C)CC=CCC3)c2)[nH+]c1C ZINC000822730086 1042299111 /nfs/dbraw/zinc/29/91/11/1042299111.db2.gz FSZBMFIXSPGTPM-IBGZPJMESA-N 1 2 309.413 4.378 20 0 DIADLO Cc1cc(NC(=O)c2ccc(Cl)cc2)ccc1-n1cc[nH+]c1 ZINC001136624358 1042299711 /nfs/dbraw/zinc/29/97/11/1042299711.db2.gz SDIBKBOQIAMMAG-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO CCc1ccsc1C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1 ZINC001136625042 1042300101 /nfs/dbraw/zinc/30/01/01/1042300101.db2.gz VIQGJKOCICWVSC-UHFFFAOYSA-N 1 2 311.410 4.057 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2ccccc2s1)c1c(F)cccc1F ZINC000021499627 1042304396 /nfs/dbraw/zinc/30/43/96/1042304396.db2.gz CJXPJRJDHPDQJM-SNVBAGLBSA-N 1 2 304.365 4.425 20 0 DIADLO CCc1cnc(C[N@H+](C)Cc2ccc3nc(C)ccc3c2)s1 ZINC000187402195 1042313535 /nfs/dbraw/zinc/31/35/35/1042313535.db2.gz XLYGOZGBUBTYMX-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO CCc1cnc(C[N@@H+](C)Cc2ccc3nc(C)ccc3c2)s1 ZINC000187402195 1042313539 /nfs/dbraw/zinc/31/35/39/1042313539.db2.gz XLYGOZGBUBTYMX-UHFFFAOYSA-N 1 2 311.454 4.194 20 0 DIADLO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ccnc(Cl)c2F)c1 ZINC000823394910 1042323560 /nfs/dbraw/zinc/32/35/60/1042323560.db2.gz FKLHELYFMFIHFF-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@@H]2CCC[N@H+]2Cc2ccnc(Cl)c2F)c1 ZINC000823394910 1042323563 /nfs/dbraw/zinc/32/35/63/1042323563.db2.gz FKLHELYFMFIHFF-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO CCc1ccc(C[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)o1 ZINC000279587540 1042323702 /nfs/dbraw/zinc/32/37/02/1042323702.db2.gz CGPAUFRIUVTTAY-HXUWFJFHSA-N 1 2 306.409 4.425 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccnc(Cl)c2F)s1 ZINC000823444650 1042326068 /nfs/dbraw/zinc/32/60/68/1042326068.db2.gz RYHFUDZCZMOWHG-SECBINFHSA-N 1 2 313.829 4.140 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccnc(Cl)c2F)s1 ZINC000823444650 1042326077 /nfs/dbraw/zinc/32/60/77/1042326077.db2.gz RYHFUDZCZMOWHG-SECBINFHSA-N 1 2 313.829 4.140 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2cc(F)ncc2F)C1 ZINC000823459443 1042326247 /nfs/dbraw/zinc/32/62/47/1042326247.db2.gz UGPVYCZUNACQQE-BZNIZROVSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2cc(F)ncc2F)C1 ZINC000823459443 1042326252 /nfs/dbraw/zinc/32/62/52/1042326252.db2.gz UGPVYCZUNACQQE-BZNIZROVSA-N 1 2 306.331 4.082 20 0 DIADLO Cc1ccc([C@@H]([NH2+]Cc2cnn(C(C)C)c2)c2ccccn2)cc1 ZINC000279655706 1042328650 /nfs/dbraw/zinc/32/86/50/1042328650.db2.gz LEXWOZJOZKSYLM-HXUWFJFHSA-N 1 2 320.440 4.047 20 0 DIADLO Fc1c(CNc2ccc([NH+]3CCCC3)cc2)ccnc1Cl ZINC000823495366 1042328591 /nfs/dbraw/zinc/32/85/91/1042328591.db2.gz IICXFGSLXKIXLX-UHFFFAOYSA-N 1 2 305.784 4.086 20 0 DIADLO Cc1nc(-c2ccccc2)sc1C(=O)Nc1cc[nH+]c(C)c1 ZINC000010165076 1042332396 /nfs/dbraw/zinc/33/23/96/1042332396.db2.gz CIBUBPMCRXIELV-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO C[C@H]1CN(c2ccc([NH2+][C@@H]3CCCC34CCC4)cc2)CCO1 ZINC000823554088 1042334513 /nfs/dbraw/zinc/33/45/13/1042334513.db2.gz HGTCHPDWARXUDT-MAUKXSAKSA-N 1 2 300.446 4.046 20 0 DIADLO FC(F)c1cccc(C[N@@H+]2CCO[C@@H](c3cccs3)C2)c1 ZINC000279790177 1042343149 /nfs/dbraw/zinc/34/31/49/1042343149.db2.gz VHBPEOYGGOFSHJ-CQSZACIVSA-N 1 2 309.381 4.259 20 0 DIADLO FC(F)c1cccc(C[N@H+]2CCO[C@@H](c3cccs3)C2)c1 ZINC000279790177 1042343154 /nfs/dbraw/zinc/34/31/54/1042343154.db2.gz VHBPEOYGGOFSHJ-CQSZACIVSA-N 1 2 309.381 4.259 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1csc(C)n1)c1ccc(Cl)cc1 ZINC000279823527 1042344618 /nfs/dbraw/zinc/34/46/18/1042344618.db2.gz YJPBCXBCCAYXTJ-QMTHXVAHSA-N 1 2 310.850 4.143 20 0 DIADLO C[N@H+](CC(=O)Nc1cccc2ccccc21)Cc1cccc(F)c1 ZINC000007791670 1042360237 /nfs/dbraw/zinc/36/02/37/1042360237.db2.gz PAYZCRBQFLGKOY-UHFFFAOYSA-N 1 2 322.383 4.049 20 0 DIADLO C[N@@H+](CC(=O)Nc1cccc2ccccc21)Cc1cccc(F)c1 ZINC000007791670 1042360241 /nfs/dbraw/zinc/36/02/41/1042360241.db2.gz PAYZCRBQFLGKOY-UHFFFAOYSA-N 1 2 322.383 4.049 20 0 DIADLO CCCC[C@@H](CC)CC[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000437986080 1042360466 /nfs/dbraw/zinc/36/04/66/1042360466.db2.gz KHZBZHSQXDDWKD-NVXWUHKLSA-N 1 2 300.450 4.090 20 0 DIADLO CCCCOc1ccc([C@@H](C)[NH2+]Cc2cscn2)cc1OC ZINC000236707861 1042370395 /nfs/dbraw/zinc/37/03/95/1042370395.db2.gz BOLFHQYFUMVDIG-CYBMUJFWSA-N 1 2 320.458 4.181 20 0 DIADLO COc1c(F)cccc1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001143533418 1042390903 /nfs/dbraw/zinc/39/09/03/1042390903.db2.gz ZWHZGGQJQUSAIC-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cccc1C[N@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001143533418 1042390906 /nfs/dbraw/zinc/39/09/06/1042390906.db2.gz ZWHZGGQJQUSAIC-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cccc1C[N@@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001143537526 1042391342 /nfs/dbraw/zinc/39/13/42/1042391342.db2.gz ZWPUOLBYDKKIGQ-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cccc1C[N@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001143537526 1042391345 /nfs/dbraw/zinc/39/13/45/1042391345.db2.gz ZWPUOLBYDKKIGQ-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1ccc(OC(F)(F)F)cc1C[N@H+]1CCCC[C@H](F)C1 ZINC001143538884 1042391665 /nfs/dbraw/zinc/39/16/65/1042391665.db2.gz VNNDDAFXVZUMEU-NSHDSACASA-N 1 2 309.278 4.048 20 0 DIADLO Fc1ccc(OC(F)(F)F)cc1C[N@@H+]1CCCC[C@H](F)C1 ZINC001143538884 1042391667 /nfs/dbraw/zinc/39/16/67/1042391667.db2.gz VNNDDAFXVZUMEU-NSHDSACASA-N 1 2 309.278 4.048 20 0 DIADLO Cc1noc2ncc(C[N@@H+](C)[C@H](C)c3cc(F)ccc3F)cc12 ZINC000893931980 1042396139 /nfs/dbraw/zinc/39/61/39/1042396139.db2.gz NOKHPCXBJQXLBP-LLVKDONJSA-N 1 2 317.339 4.002 20 0 DIADLO Cc1noc2ncc(C[N@H+](C)[C@H](C)c3cc(F)ccc3F)cc12 ZINC000893931980 1042396142 /nfs/dbraw/zinc/39/61/42/1042396142.db2.gz NOKHPCXBJQXLBP-LLVKDONJSA-N 1 2 317.339 4.002 20 0 DIADLO COc1c(F)cc(F)cc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001143551605 1042407469 /nfs/dbraw/zinc/40/74/69/1042407469.db2.gz DPTPTOATDKVIQQ-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cc(F)cc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001143551605 1042407472 /nfs/dbraw/zinc/40/74/72/1042407472.db2.gz DPTPTOATDKVIQQ-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cc(F)cc1C[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC001143551881 1042407505 /nfs/dbraw/zinc/40/75/05/1042407505.db2.gz LZZQBQJPPZGJIG-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(F)cc(F)cc1C[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC001143551881 1042407507 /nfs/dbraw/zinc/40/75/07/1042407507.db2.gz LZZQBQJPPZGJIG-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000246005841 1042407712 /nfs/dbraw/zinc/40/77/12/1042407712.db2.gz SKFDTHSCAOSZHQ-HUUCEWRRSA-N 1 2 312.461 4.266 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)Nc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000246005841 1042407714 /nfs/dbraw/zinc/40/77/14/1042407714.db2.gz SKFDTHSCAOSZHQ-HUUCEWRRSA-N 1 2 312.461 4.266 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](C)[C@H](C)c2ccccc2C)n1 ZINC000248217545 1042438879 /nfs/dbraw/zinc/43/88/79/1042438879.db2.gz ZYGZOJMSRTZMTI-ZIAGYGMSSA-N 1 2 319.474 4.385 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](C)[C@H](C)c2ccccc2C)n1 ZINC000248217545 1042438881 /nfs/dbraw/zinc/43/88/81/1042438881.db2.gz ZYGZOJMSRTZMTI-ZIAGYGMSSA-N 1 2 319.474 4.385 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H]1CCCC2(CC2)C1 ZINC000614281851 1042452220 /nfs/dbraw/zinc/45/22/20/1042452220.db2.gz MUJGRCMWPHBXFI-HNNXBMFYSA-N 1 2 309.413 4.294 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C1CCC2(CC2)CC1 ZINC000614283186 1042452671 /nfs/dbraw/zinc/45/26/71/1042452671.db2.gz YPFMCTMAVIAEPS-UHFFFAOYSA-N 1 2 309.413 4.294 20 0 DIADLO COc1cc(C)nc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC000411523906 1042454998 /nfs/dbraw/zinc/45/49/98/1042454998.db2.gz AMFRZKZJGFZQDB-LBPRGKRZSA-N 1 2 319.474 4.003 20 0 DIADLO CCC(CC)n1ccc(COc2ccc3c(c2)[nH+]c(C)n3C)n1 ZINC000664046364 1042457032 /nfs/dbraw/zinc/45/70/32/1042457032.db2.gz BCJJRJHXTWBBMS-UHFFFAOYSA-N 1 2 312.417 4.018 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1c(Cl)ccc2cccnc21 ZINC000051960149 1042457187 /nfs/dbraw/zinc/45/71/87/1042457187.db2.gz DGGCDOWHSHEGOM-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1c(Cl)ccc2cccnc21 ZINC000051960149 1042457191 /nfs/dbraw/zinc/45/71/91/1042457191.db2.gz DGGCDOWHSHEGOM-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cccc(O)c1Cl ZINC000293470151 1042462292 /nfs/dbraw/zinc/46/22/92/1042462292.db2.gz DYXPDDSQYWJJNZ-JTQLQIEISA-N 1 2 309.768 4.044 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cccc(O)c1Cl ZINC000293470153 1042462475 /nfs/dbraw/zinc/46/24/75/1042462475.db2.gz DYXPDDSQYWJJNZ-SNVBAGLBSA-N 1 2 309.768 4.044 20 0 DIADLO Fc1cc(F)c(C[NH2+]Cc2cc3ccccc3o2)c(F)c1F ZINC000430027905 1042463088 /nfs/dbraw/zinc/46/30/88/1042463088.db2.gz TTYBNLXSGLBUNR-UHFFFAOYSA-N 1 2 309.262 4.279 20 0 DIADLO C[C@H]1C[N@H+](Cc2cc(F)cc(Br)c2)CCC1(F)F ZINC000571366991 1042482441 /nfs/dbraw/zinc/48/24/41/1042482441.db2.gz ZJIFRKFOQJJMLQ-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cc(F)cc(Br)c2)CCC1(F)F ZINC000571366991 1042482442 /nfs/dbraw/zinc/48/24/42/1042482442.db2.gz ZJIFRKFOQJJMLQ-VIFPVBQESA-N 1 2 322.168 4.065 20 0 DIADLO CC(C)COC[C@@H]([NH2+][C@H](C)c1cc(O)cc(F)c1)c1ccco1 ZINC000924889000 1042487647 /nfs/dbraw/zinc/48/76/47/1042487647.db2.gz JGPBAMWVOCVSTQ-CXAGYDPISA-N 1 2 321.392 4.189 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2cc(C(F)(F)F)ccc2F)n1 ZINC000353747389 1042489948 /nfs/dbraw/zinc/48/99/48/1042489948.db2.gz AHHLYWDVSGRAAF-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2cc(C(F)(F)F)ccc2F)n1 ZINC000353747389 1042489950 /nfs/dbraw/zinc/48/99/50/1042489950.db2.gz AHHLYWDVSGRAAF-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Brc1cccc2c1CCC[C@H]2Oc1cc[nH+]cc1 ZINC001225295341 1042499049 /nfs/dbraw/zinc/49/90/49/1042499049.db2.gz KSNRURZGBWBWNX-OAHLLOKOSA-N 1 2 304.187 4.301 20 0 DIADLO CCc1cc(C(=O)Nc2ccccc2-n2cc[nH+]c2)sc1C ZINC000052909560 1042522414 /nfs/dbraw/zinc/52/24/14/1042522414.db2.gz DZVYNFWUZBCLAJ-UHFFFAOYSA-N 1 2 311.410 4.057 20 0 DIADLO CC(C)COC[C@@H]([NH2+]Cc1nccc2ccccc21)c1ccco1 ZINC000894211246 1042526290 /nfs/dbraw/zinc/52/62/90/1042526290.db2.gz MQXOGRILGRYBHY-LJQANCHMSA-N 1 2 324.424 4.331 20 0 DIADLO CC[C@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@@H]1C[C@@H]1C ZINC000414091330 1042553036 /nfs/dbraw/zinc/55/30/36/1042553036.db2.gz DGFBMZKBHJQTOI-LESCRADOSA-N 1 2 307.441 4.448 20 0 DIADLO CCn1cc([C@@H](C)[NH2+][C@@H](c2ccc(C)cc2)c2ccccn2)cn1 ZINC000280292041 1042570046 /nfs/dbraw/zinc/57/00/46/1042570046.db2.gz ZHZJQTDFHREGRW-UZLBHIALSA-N 1 2 320.440 4.047 20 0 DIADLO Cc1sc2[nH]c([C@@H](C)[N@@H+]3CCC(C)=C(C)C3)nc(=O)c2c1C ZINC000280671259 1042577683 /nfs/dbraw/zinc/57/76/83/1042577683.db2.gz FXGZGOYTTKPNKA-GFCCVEGCSA-N 1 2 317.458 4.117 20 0 DIADLO Cc1sc2[nH]c([C@@H](C)[N@H+]3CCC(C)=C(C)C3)nc(=O)c2c1C ZINC000280671259 1042577689 /nfs/dbraw/zinc/57/76/89/1042577689.db2.gz FXGZGOYTTKPNKA-GFCCVEGCSA-N 1 2 317.458 4.117 20 0 DIADLO CCc1cccc(NC(=O)Nc2ccccc2-n2cc[nH+]c2)c1 ZINC000039339011 1042582645 /nfs/dbraw/zinc/58/26/45/1042582645.db2.gz QXNMGRSIQVXLQO-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO CSc1ccc(NC(=O)Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC000039339029 1042583222 /nfs/dbraw/zinc/58/32/22/1042583222.db2.gz DQUUHOVCWYAONZ-UHFFFAOYSA-N 1 2 324.409 4.238 20 0 DIADLO Cc1cc(C)c(CNC(=O)N(C)[C@@H]2CCC[C@@H]2C(C)(C)C)c[nH+]1 ZINC000419510822 1042587285 /nfs/dbraw/zinc/58/72/85/1042587285.db2.gz WKFIZHGMYKCYED-DLBZAZTESA-N 1 2 317.477 4.055 20 0 DIADLO C[C@@H]1C[C@@H]1[C@@H]([NH2+]Cc1nn(C)cc1Cl)c1ccc(Cl)cc1 ZINC000420938579 1042616178 /nfs/dbraw/zinc/61/61/78/1042616178.db2.gz MISOOUQVPDURIW-HICWGWBUSA-N 1 2 324.255 4.214 20 0 DIADLO CC(C)(C)c1cc(C[NH2+][C@H](CC(F)F)c2ccccc2)no1 ZINC000420998919 1042620719 /nfs/dbraw/zinc/62/07/19/1042620719.db2.gz UPZCDUXRPFKLMH-CQSZACIVSA-N 1 2 308.372 4.458 20 0 DIADLO CCO[C@H](C)c1noc(C[N@H+](C(C)C)[C@H](C)c2ccsc2)n1 ZINC000421004875 1042621097 /nfs/dbraw/zinc/62/10/97/1042621097.db2.gz ITJNAJYDWCNFNB-CHWSQXEVSA-N 1 2 323.462 4.200 20 0 DIADLO CCO[C@H](C)c1noc(C[N@@H+](C(C)C)[C@H](C)c2ccsc2)n1 ZINC000421004875 1042621099 /nfs/dbraw/zinc/62/10/99/1042621099.db2.gz ITJNAJYDWCNFNB-CHWSQXEVSA-N 1 2 323.462 4.200 20 0 DIADLO CCCCc1noc(C[N@H+](C(C)C)[C@H](C)c2ccsc2)n1 ZINC000421019396 1042622661 /nfs/dbraw/zinc/62/26/61/1042622661.db2.gz XXYNVAQBWZEQED-CYBMUJFWSA-N 1 2 307.463 4.445 20 0 DIADLO CCCCc1noc(C[N@@H+](C(C)C)[C@H](C)c2ccsc2)n1 ZINC000421019396 1042622664 /nfs/dbraw/zinc/62/26/64/1042622664.db2.gz XXYNVAQBWZEQED-CYBMUJFWSA-N 1 2 307.463 4.445 20 0 DIADLO CC(C)(C)c1ccc(C[NH2+]Cc2nccc(C(F)(F)F)n2)cc1 ZINC000414503061 1042626899 /nfs/dbraw/zinc/62/68/99/1042626899.db2.gz HSNCKKXTAMIDPI-UHFFFAOYSA-N 1 2 323.362 4.083 20 0 DIADLO Cc1ccsc1C[N@@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000513745611 1042628380 /nfs/dbraw/zinc/62/83/80/1042628380.db2.gz CGHJNAZJECOFJN-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccsc1C[N@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000513745611 1042628382 /nfs/dbraw/zinc/62/83/82/1042628382.db2.gz CGHJNAZJECOFJN-OAHLLOKOSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H]2CCc3ccc(C(C)C)cc32)nn1C ZINC000421346104 1042631400 /nfs/dbraw/zinc/63/14/00/1042631400.db2.gz SFUQRNXLNXGJIS-MRXNPFEDSA-N 1 2 317.864 4.282 20 0 DIADLO CC[C@@H]([NH2+]Cc1nn(C)c(C)c1Cl)c1cccc(Cl)c1 ZINC000421334184 1042631590 /nfs/dbraw/zinc/63/15/90/1042631590.db2.gz PJLJZPBNBFRJRR-CYBMUJFWSA-N 1 2 312.244 4.276 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@@H](C)c2ccc(OC(C)C)cc2)nn1C ZINC000421337352 1042632402 /nfs/dbraw/zinc/63/24/02/1042632402.db2.gz YTFFNCGQZOPYQW-LBPRGKRZSA-N 1 2 321.852 4.020 20 0 DIADLO Cc1cc(CNC(=O)CCC(C)(C)c2ccccc2)cc(C)[nH+]1 ZINC000421580048 1042645277 /nfs/dbraw/zinc/64/52/77/1042645277.db2.gz VKPHMPDYQVXPDY-UHFFFAOYSA-N 1 2 310.441 4.073 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+][C@@H](C)c1ccncc1Cl ZINC000421828140 1042654408 /nfs/dbraw/zinc/65/44/08/1042654408.db2.gz BHBXLLXSZQXWJI-QWRGUYRKSA-N 1 2 308.784 4.295 20 0 DIADLO COc1cc(Cl)ccc1[C@@H](C)[NH2+][C@H](C)c1nnc(C(C)C)[nH]1 ZINC000421837533 1042655866 /nfs/dbraw/zinc/65/58/66/1042655866.db2.gz RHVGBZLLZRYKBI-GHMZBOCLSA-N 1 2 322.840 4.002 20 0 DIADLO CCS[C@@H](C)c1noc(C[NH2+][C@H](CC)c2ccccc2)n1 ZINC000271715756 1042666126 /nfs/dbraw/zinc/66/61/26/1042666126.db2.gz VUZAFBIWAYALOJ-GXTWGEPZSA-N 1 2 305.447 4.125 20 0 DIADLO CCC(CC)n1ccc(C[NH2+][C@H](C)c2cc(C)ccc2OC)n1 ZINC000271701250 1042666452 /nfs/dbraw/zinc/66/64/52/1042666452.db2.gz STPGXSHOHFJVKF-OAHLLOKOSA-N 1 2 315.461 4.412 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(-n2cccn2)cc1 ZINC000271744789 1042667231 /nfs/dbraw/zinc/66/72/31/1042667231.db2.gz XDFJXMFGJSUNCL-CQSZACIVSA-N 1 2 324.428 4.009 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](C)c2cc(C)ccc2OC)cs1 ZINC000271733047 1042667344 /nfs/dbraw/zinc/66/73/44/1042667344.db2.gz YVPPHRBEJKRZRF-ZDUSSCGKSA-N 1 2 304.459 4.263 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(-n2cccn2)cc1 ZINC000271744785 1042667373 /nfs/dbraw/zinc/66/73/73/1042667373.db2.gz XDFJXMFGJSUNCL-AWEZNQCLSA-N 1 2 324.428 4.009 20 0 DIADLO CCCc1nc(C[NH2+][C@H](C)c2cc(C)ccc2OC)cs1 ZINC000271733046 1042667410 /nfs/dbraw/zinc/66/74/10/1042667410.db2.gz YVPPHRBEJKRZRF-CYBMUJFWSA-N 1 2 304.459 4.263 20 0 DIADLO CCn1cnnc1C[NH2+][C@@H](C)c1cc2c(ccc3ccccc23)o1 ZINC000271917202 1042671659 /nfs/dbraw/zinc/67/16/59/1042671659.db2.gz ZAZQFPXJLAVVGR-ZDUSSCGKSA-N 1 2 320.396 4.048 20 0 DIADLO CCC1(CC)CCCN(C(=O)c2c(C)cc(C)[nH+]c2C)CC1 ZINC001269245201 1042671810 /nfs/dbraw/zinc/67/18/10/1042671810.db2.gz SQZGESSFSYWZHG-UHFFFAOYSA-N 1 2 302.462 4.439 20 0 DIADLO COc1cc(C)[nH+]c(CSCc2csc(C3CC3)n2)c1 ZINC000272093451 1042677275 /nfs/dbraw/zinc/67/72/75/1042677275.db2.gz VNBPZHLMGKOFJC-UHFFFAOYSA-N 1 2 306.456 4.166 20 0 DIADLO FC1CC2(C1)C[NH+](Cc1csc(-c3ccc(Cl)cc3)n1)C2 ZINC000647930286 1042686676 /nfs/dbraw/zinc/68/66/76/1042686676.db2.gz XLJVYYMYAUSOFC-UHFFFAOYSA-N 1 2 322.836 4.397 20 0 DIADLO COC[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1cccc(Cl)c1F ZINC000423220830 1042700949 /nfs/dbraw/zinc/70/09/49/1042700949.db2.gz VYTDOOWWAFAPKG-MRXNPFEDSA-N 1 2 320.795 4.247 20 0 DIADLO CC(C)[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc2[nH]c(=O)oc2c1 ZINC000423218326 1042701218 /nfs/dbraw/zinc/70/12/18/1042701218.db2.gz ROWDADGSPWNNBG-SFHVURJKSA-N 1 2 323.396 4.311 20 0 DIADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1cnn(Cc2ccccc2)c1 ZINC000423218641 1042701271 /nfs/dbraw/zinc/70/12/71/1042701271.db2.gz SDTZWJAQGBWEGR-HNNXBMFYSA-N 1 2 318.424 4.073 20 0 DIADLO Cc1ccc(NC(=O)C[C@@H](C)[NH2+]c2ccc3c(c2)CCN3)c(C)c1 ZINC000423217283 1042701416 /nfs/dbraw/zinc/70/14/16/1042701416.db2.gz PWKCYZZSRLYHRB-OAHLLOKOSA-N 1 2 323.440 4.101 20 0 DIADLO CN(CC1=CCCOC1)c1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000664366277 1042721863 /nfs/dbraw/zinc/72/18/63/1042721863.db2.gz WYYNGNWGZFNOLV-UHFFFAOYSA-N 1 2 322.330 4.037 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1ccc(F)cc1OCC1CC1 ZINC000424144847 1042726761 /nfs/dbraw/zinc/72/67/61/1042726761.db2.gz MFWFKFSPRDJBOW-UHFFFAOYSA-N 1 2 303.381 4.004 20 0 DIADLO COC[C@H]([NH2+][C@@H](C)c1ccc(OC)cc1Cl)c1ccc(C)o1 ZINC000424289171 1042731428 /nfs/dbraw/zinc/73/14/28/1042731428.db2.gz AFKRGAKDBVYIOV-LRDDRELGSA-N 1 2 323.820 4.288 20 0 DIADLO Cc1csc([C@H]2CCCC[N@H+]2[C@@H](C)c2cnc(C)nc2C)n1 ZINC000638000010 1042777758 /nfs/dbraw/zinc/77/77/58/1042777758.db2.gz MHCLHRNYUQJUNR-XJKSGUPXSA-N 1 2 316.474 4.147 20 0 DIADLO Cc1csc([C@H]2CCCC[N@@H+]2[C@@H](C)c2cnc(C)nc2C)n1 ZINC000638000010 1042777760 /nfs/dbraw/zinc/77/77/60/1042777760.db2.gz MHCLHRNYUQJUNR-XJKSGUPXSA-N 1 2 316.474 4.147 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1cnc2ccccc2c1 ZINC000281238876 1042779157 /nfs/dbraw/zinc/77/91/57/1042779157.db2.gz WGDQEJZIMYKRSL-LJQANCHMSA-N 1 2 320.440 4.178 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1Cc1cnc2ccccc2c1 ZINC000281238876 1042779162 /nfs/dbraw/zinc/77/91/62/1042779162.db2.gz WGDQEJZIMYKRSL-LJQANCHMSA-N 1 2 320.440 4.178 20 0 DIADLO Cc1nc(NC(CCC(F)(F)F)CCC(F)(F)F)cc[nH+]1 ZINC000664470116 1042787328 /nfs/dbraw/zinc/78/73/28/1042787328.db2.gz SOBZSTFPAUMKTR-UHFFFAOYSA-N 1 2 315.261 4.251 20 0 DIADLO CC(C)n1c[nH+]cc1CN1CCCc2c(OC(F)F)cccc21 ZINC000425341186 1042794887 /nfs/dbraw/zinc/79/48/87/1042794887.db2.gz CJEQOMXYZVZABS-UHFFFAOYSA-N 1 2 321.371 4.018 20 0 DIADLO CC1(C)C[C@H](c2ccccc2)[N@H+](Cc2nccn2C(F)F)C1 ZINC000425373585 1042800332 /nfs/dbraw/zinc/80/03/32/1042800332.db2.gz PYUHVJISDRDBFR-CQSZACIVSA-N 1 2 305.372 4.251 20 0 DIADLO CC1(C)C[C@H](c2ccccc2)[N@@H+](Cc2nccn2C(F)F)C1 ZINC000425373585 1042800335 /nfs/dbraw/zinc/80/03/35/1042800335.db2.gz PYUHVJISDRDBFR-CQSZACIVSA-N 1 2 305.372 4.251 20 0 DIADLO FC(F)c1noc(C[N@@H+]2CCCCC[C@H]2c2ccccc2)n1 ZINC000425400218 1042811805 /nfs/dbraw/zinc/81/18/05/1042811805.db2.gz CQBVIFMLFDZJFU-ZDUSSCGKSA-N 1 2 307.344 4.125 20 0 DIADLO FC(F)c1noc(C[N@H+]2CCCCC[C@H]2c2ccccc2)n1 ZINC000425400218 1042811808 /nfs/dbraw/zinc/81/18/08/1042811808.db2.gz CQBVIFMLFDZJFU-ZDUSSCGKSA-N 1 2 307.344 4.125 20 0 DIADLO Cc1cccc([C@@H]2CCCC[N@@H+]2Cc2nc(C(F)F)no2)c1C ZINC000425418024 1042818626 /nfs/dbraw/zinc/81/86/26/1042818626.db2.gz KUMMGDLXKIUBQB-AWEZNQCLSA-N 1 2 321.371 4.351 20 0 DIADLO Cc1cccc([C@@H]2CCCC[N@H+]2Cc2nc(C(F)F)no2)c1C ZINC000425418024 1042818633 /nfs/dbraw/zinc/81/86/33/1042818633.db2.gz KUMMGDLXKIUBQB-AWEZNQCLSA-N 1 2 321.371 4.351 20 0 DIADLO FC(F)c1noc(C[N@H+](C2CC2)[C@@H]2CCCc3ccccc32)n1 ZINC000425426449 1042821020 /nfs/dbraw/zinc/82/10/20/1042821020.db2.gz QTMIDSWLFSYASU-CQSZACIVSA-N 1 2 319.355 4.049 20 0 DIADLO FC(F)c1noc(C[N@@H+](C2CC2)[C@@H]2CCCc3ccccc32)n1 ZINC000425426449 1042821026 /nfs/dbraw/zinc/82/10/26/1042821026.db2.gz QTMIDSWLFSYASU-CQSZACIVSA-N 1 2 319.355 4.049 20 0 DIADLO CC1(C)CCc2ccccc2[C@H]([NH2+]Cc2nc(C(F)F)no2)C1 ZINC000425449963 1042825518 /nfs/dbraw/zinc/82/55/18/1042825518.db2.gz XRCHDGICBCCGRO-CYBMUJFWSA-N 1 2 321.371 4.201 20 0 DIADLO Cc1cc(C)c(C(=O)N2C[C@H](c3ccccc3C)C[C@@H]2C)c(C)[nH+]1 ZINC001126443535 1042828322 /nfs/dbraw/zinc/82/83/22/1042828322.db2.gz IKIMNLOETRTUCJ-FUHWJXTLSA-N 1 2 322.452 4.333 20 0 DIADLO COc1c(F)cc(F)cc1C[N@@H+]1CCC[C@H]1c1ccccc1F ZINC001143561691 1042842434 /nfs/dbraw/zinc/84/24/34/1042842434.db2.gz XOGKDCYUVXERCV-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cc(F)cc1C[N@H+]1CCC[C@H]1c1ccccc1F ZINC001143561691 1042842437 /nfs/dbraw/zinc/84/24/37/1042842437.db2.gz XOGKDCYUVXERCV-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cncc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)c1 ZINC000290075375 1042861803 /nfs/dbraw/zinc/86/18/03/1042861803.db2.gz WGBSILNJGJSPOW-UHFFFAOYSA-N 1 2 323.223 4.176 20 0 DIADLO c1nc(N2CCCC3(CCCCC3)C2)cc(N2CCCCC2)[nH+]1 ZINC000517666387 1042892032 /nfs/dbraw/zinc/89/20/32/1042892032.db2.gz YEELEYXJEAFWLD-UHFFFAOYSA-N 1 2 314.477 4.018 20 0 DIADLO c1nc(N2CCCCC2)cc(N2CCCC3(CCCCC3)C2)[nH+]1 ZINC000517666387 1042892038 /nfs/dbraw/zinc/89/20/38/1042892038.db2.gz YEELEYXJEAFWLD-UHFFFAOYSA-N 1 2 314.477 4.018 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2cnn(C3CCC3)c2)cs1 ZINC000925034481 1042901256 /nfs/dbraw/zinc/90/12/56/1042901256.db2.gz SAVBRJGSNWGVLL-RYUDHWBXSA-N 1 2 304.463 4.039 20 0 DIADLO CC(C)n1cc([C@H](C)[NH2+][C@H]2COCc3cccc(Cl)c32)cn1 ZINC000925045876 1042913806 /nfs/dbraw/zinc/91/38/06/1042913806.db2.gz NGCHDSHEIUHJGD-LRDDRELGSA-N 1 2 319.836 4.040 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@H+](C)CCOc1ccccc1F ZINC000519054599 1042931214 /nfs/dbraw/zinc/93/12/14/1042931214.db2.gz LPDMRLQRDYAUFB-GFCCVEGCSA-N 1 2 309.331 4.176 20 0 DIADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)CCOc1ccccc1F ZINC000519054599 1042931215 /nfs/dbraw/zinc/93/12/15/1042931215.db2.gz LPDMRLQRDYAUFB-GFCCVEGCSA-N 1 2 309.331 4.176 20 0 DIADLO Cc1cccn2cc(Cc3noc([C@@H]4CCCC5(CC5)C4)n3)[nH+]c12 ZINC000664777929 1042934607 /nfs/dbraw/zinc/93/46/07/1042934607.db2.gz TYPTUBCWJNVNFU-CQSZACIVSA-N 1 2 322.412 4.054 20 0 DIADLO Cc1cccc2c1N(Cc1c[nH+]c(N(C)C)c3ccccc13)CC2 ZINC001167967611 1042954486 /nfs/dbraw/zinc/95/44/86/1042954486.db2.gz HYTRTHYAMSRKHC-UHFFFAOYSA-N 1 2 317.436 4.172 20 0 DIADLO Cc1cc(C)c(NC(=O)NC2(Cc3ccccc3)CCC2)c(C)[nH+]1 ZINC000519523998 1042956826 /nfs/dbraw/zinc/95/68/26/1042956826.db2.gz JOJKXUCSUFGLKN-UHFFFAOYSA-N 1 2 323.440 4.294 20 0 DIADLO Cc1cc(CNc2ccc(F)c([C@@H](C)O)c2)c2c([nH+]1)CCCC2 ZINC000894434829 1042958325 /nfs/dbraw/zinc/95/83/25/1042958325.db2.gz IJBYJTUOVVIOFC-CYBMUJFWSA-N 1 2 314.404 4.073 20 0 DIADLO CCOc1cc(F)c(C[N@H+](C)Cc2ccc(OC)cc2)c(F)c1 ZINC001143568536 1042960671 /nfs/dbraw/zinc/96/06/71/1042960671.db2.gz BFCCWRCMBHKYRU-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CCOc1cc(F)c(C[N@@H+](C)Cc2ccc(OC)cc2)c(F)c1 ZINC001143568536 1042960678 /nfs/dbraw/zinc/96/06/78/1042960678.db2.gz BFCCWRCMBHKYRU-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC(C)c1nnc(C[NH2+][C@@H]2CCCc3c(F)cc(F)cc32)s1 ZINC000894656416 1042971238 /nfs/dbraw/zinc/97/12/38/1042971238.db2.gz AQOIDGVFOLVYBG-CQSZACIVSA-N 1 2 323.412 4.107 20 0 DIADLO CCCOc1ccc(C(C)(C)[NH2+]Cc2ncc(CC)o2)cc1 ZINC000519856139 1043005666 /nfs/dbraw/zinc/00/56/66/1043005666.db2.gz IFCULZWAKYJZAI-UHFFFAOYSA-N 1 2 302.418 4.051 20 0 DIADLO CCCc1noc(C[N@@H+](CCC)[C@@H](C)c2ccccc2OC)n1 ZINC000520172296 1043020438 /nfs/dbraw/zinc/02/04/38/1043020438.db2.gz ALPZTXLAXBINCP-AWEZNQCLSA-N 1 2 317.433 4.004 20 0 DIADLO CCCc1noc(C[N@H+](CCC)[C@@H](C)c2ccccc2OC)n1 ZINC000520172296 1043020443 /nfs/dbraw/zinc/02/04/43/1043020443.db2.gz ALPZTXLAXBINCP-AWEZNQCLSA-N 1 2 317.433 4.004 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccccc2Oc2ccc(C)cc2)[nH]c1C ZINC000520254054 1043028781 /nfs/dbraw/zinc/02/87/81/1043028781.db2.gz IXXGRHCSNCUFKE-UHFFFAOYSA-N 1 2 321.424 4.417 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)Cc1ccccc1N(C)C ZINC000441227215 1043029512 /nfs/dbraw/zinc/02/95/12/1043029512.db2.gz HIWPSMQRQOOGSJ-ZDUSSCGKSA-N 1 2 304.384 4.224 20 0 DIADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccccc1N(C)C ZINC000441227215 1043029516 /nfs/dbraw/zinc/02/95/16/1043029516.db2.gz HIWPSMQRQOOGSJ-ZDUSSCGKSA-N 1 2 304.384 4.224 20 0 DIADLO C[C@H]1CCCC[C@@H]1CC(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000520369645 1043037937 /nfs/dbraw/zinc/03/79/37/1043037937.db2.gz YYFHTDOVWDAHIV-UONOGXRCSA-N 1 2 315.392 4.166 20 0 DIADLO Cc1cc(F)ccc1C[NH2+][C@@H](C)c1nc(C2CCCCC2)no1 ZINC000173867153 1043056197 /nfs/dbraw/zinc/05/61/97/1043056197.db2.gz KSUUCDNJIFOAKR-ZDUSSCGKSA-N 1 2 317.408 4.416 20 0 DIADLO CC[C@@H]([NH2+][C@H](C)c1nc(Cc2ccccc2)no1)c1ccccc1 ZINC000174014103 1043059339 /nfs/dbraw/zinc/05/93/39/1043059339.db2.gz LBMDEVPEWXOCRI-CRAIPNDOSA-N 1 2 321.424 4.462 20 0 DIADLO Cc1noc([C@H]2CCCC[N@@H+]2C/C=C/c2ccc(Cl)cc2)n1 ZINC000579268568 1043062284 /nfs/dbraw/zinc/06/22/84/1043062284.db2.gz HWVPFJGOGONYHD-DWTRPJMMSA-N 1 2 317.820 4.272 20 0 DIADLO Cc1noc([C@H]2CCCC[N@H+]2C/C=C/c2ccc(Cl)cc2)n1 ZINC000579268568 1043062286 /nfs/dbraw/zinc/06/22/86/1043062286.db2.gz HWVPFJGOGONYHD-DWTRPJMMSA-N 1 2 317.820 4.272 20 0 DIADLO Cc1ccc(C)c(NC(=O)Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001202767380 1043068186 /nfs/dbraw/zinc/06/81/86/1043068186.db2.gz ASKLLMOUICELFM-UHFFFAOYSA-N 1 2 320.396 4.192 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)[C@H]2CCC(C)=C(C)C2)n1 ZINC000843770812 1043072434 /nfs/dbraw/zinc/07/24/34/1043072434.db2.gz AECBHYZJXKAPSD-AWEZNQCLSA-N 1 2 321.490 4.060 20 0 DIADLO Cc1ccc(C)c(NC(=O)N[C@@H](C)c2c[nH+]c3c(C)cccn23)c1 ZINC001202773491 1043085508 /nfs/dbraw/zinc/08/55/08/1043085508.db2.gz BWHOTQQIPSEXDE-HNNXBMFYSA-N 1 2 322.412 4.142 20 0 DIADLO c1cn(-c2cccc(Oc3nc(-c4ccccc4)ns3)c2)c[nH+]1 ZINC000125133009 1043091263 /nfs/dbraw/zinc/09/12/63/1043091263.db2.gz RTMJUGIMJUUVBW-UHFFFAOYSA-N 1 2 320.377 4.183 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1C ZINC000330653692 1043095688 /nfs/dbraw/zinc/09/56/88/1043095688.db2.gz RUPRWKIINGNZRU-UONOGXRCSA-N 1 2 301.434 4.396 20 0 DIADLO Fc1c(Cl)cc(Br)cc1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC001141600406 1043099727 /nfs/dbraw/zinc/09/97/27/1043099727.db2.gz BFBPFGHNJXLSJY-GZMMTYOYSA-N 1 2 318.617 4.226 20 0 DIADLO Fc1c(Cl)cc(Br)cc1C[N@H+]1C[C@H]2CC[C@@H]1C2 ZINC001141600406 1043099738 /nfs/dbraw/zinc/09/97/38/1043099738.db2.gz BFBPFGHNJXLSJY-GZMMTYOYSA-N 1 2 318.617 4.226 20 0 DIADLO Cc1c(Cl)cccc1C[NH2+][C@@H](c1nc(C2CC2)no1)C(C)C ZINC000865462566 1043101192 /nfs/dbraw/zinc/10/11/92/1043101192.db2.gz PGRUNJGXYOEZDJ-OAHLLOKOSA-N 1 2 319.836 4.396 20 0 DIADLO CCN(C)c1ccccc1C[NH2+]Cc1c(Cl)cncc1Cl ZINC000865455750 1043101504 /nfs/dbraw/zinc/10/15/04/1043101504.db2.gz BAVVVDHGJMJASA-UHFFFAOYSA-N 1 2 324.255 4.134 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cnc(Cl)s2)cc1 ZINC000177153865 1043102624 /nfs/dbraw/zinc/10/26/24/1043102624.db2.gz WKCWGNDDBUNPGK-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cnc(Cl)s2)cc1 ZINC000177153865 1043102629 /nfs/dbraw/zinc/10/26/29/1043102629.db2.gz WKCWGNDDBUNPGK-CQSZACIVSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1csc(C2([NH2+]Cc3cccc(Cl)n3)CCCC2)n1 ZINC000177169907 1043104721 /nfs/dbraw/zinc/10/47/21/1043104721.db2.gz OQMDCDREIKWKNN-UHFFFAOYSA-N 1 2 307.850 4.059 20 0 DIADLO CO[C@H](C)c1nc(C[NH2+]Cc2cccc(Cl)c2C)cs1 ZINC000865487141 1043105013 /nfs/dbraw/zinc/10/50/13/1043105013.db2.gz LJKXJIWUCJPDLV-LLVKDONJSA-N 1 2 310.850 4.102 20 0 DIADLO Fc1cccc([C@H]([NH2+]Cc2cn(C3CC3)cn2)c2ccccc2)c1 ZINC000865488051 1043105300 /nfs/dbraw/zinc/10/53/00/1043105300.db2.gz ASJZVCMCUHHPSJ-HXUWFJFHSA-N 1 2 321.399 4.236 20 0 DIADLO CCCCn1cc(C[NH2+]Cc2nc(C(C)(C)C)cs2)c(C)n1 ZINC000865519240 1043108392 /nfs/dbraw/zinc/10/83/92/1043108392.db2.gz KXUBDTQBPZDSTJ-UHFFFAOYSA-N 1 2 320.506 4.035 20 0 DIADLO Cc1csc(C2([NH2+]Cc3nc(C)c(C)s3)CCCC2)n1 ZINC000177774890 1043113068 /nfs/dbraw/zinc/11/30/68/1043113068.db2.gz RYHVQLTWFDCVGH-UHFFFAOYSA-N 1 2 307.488 4.084 20 0 DIADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1sccc1Br ZINC000178064727 1043119902 /nfs/dbraw/zinc/11/99/02/1043119902.db2.gz FLJTUSURLIDJRT-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1sccc1Br ZINC000178064727 1043119908 /nfs/dbraw/zinc/11/99/08/1043119908.db2.gz FLJTUSURLIDJRT-JTQLQIEISA-N 1 2 311.248 4.099 20 0 DIADLO COC[C@H]([NH2+][C@H](C)c1ccc2ccccc2n1)c1ccc(C)o1 ZINC000178229120 1043123950 /nfs/dbraw/zinc/12/39/50/1043123950.db2.gz GFDBRCIYTDTEQF-KDOFPFPSSA-N 1 2 310.397 4.175 20 0 DIADLO COc1ccc(Cl)cc1[C@H](CC(C)C)[NH2+]Cc1ccon1 ZINC000178262522 1043125569 /nfs/dbraw/zinc/12/55/69/1043125569.db2.gz FFSKGASTDDLHIK-HNNXBMFYSA-N 1 2 308.809 4.214 20 0 DIADLO Cc1cccc(COc2ccc([C@H](C)[NH2+]Cc3ccon3)cc2)c1 ZINC000178263805 1043126121 /nfs/dbraw/zinc/12/61/21/1043126121.db2.gz XDFKZKKOMPMGCX-INIZCTEOSA-N 1 2 322.408 4.413 20 0 DIADLO Cc1csc(C[NH2+]Cc2cc(Cl)cc(Cl)c2F)n1 ZINC000865818043 1043137175 /nfs/dbraw/zinc/13/71/75/1043137175.db2.gz QIYQUJTXWWJJLM-UHFFFAOYSA-N 1 2 305.205 4.187 20 0 DIADLO CC(C)COC[C@H]([NH2+][C@H](C)c1ccc(Cl)nc1)c1ccco1 ZINC000179117584 1043140569 /nfs/dbraw/zinc/14/05/69/1043140569.db2.gz UKDUWKZKMDTGAN-HIFRSBDPSA-N 1 2 322.836 4.393 20 0 DIADLO Fc1cc(Cl)ccc1C[NH2+]Cc1coc(-c2cccs2)n1 ZINC000189283923 1043145123 /nfs/dbraw/zinc/14/51/23/1043145123.db2.gz ZKBVSVYOECJWKP-UHFFFAOYSA-N 1 2 322.792 4.485 20 0 DIADLO CC(C)(C)c1noc(C[NH2+]C(C)(C)c2cccc(Cl)c2)n1 ZINC000179605971 1043148694 /nfs/dbraw/zinc/14/86/94/1043148694.db2.gz OVEYDHJIMGSJJK-UHFFFAOYSA-N 1 2 307.825 4.045 20 0 DIADLO CC(C)(C)c1csc(C[NH2+]C2(c3cccc(F)c3)CC2)n1 ZINC000179694264 1043151037 /nfs/dbraw/zinc/15/10/37/1043151037.db2.gz LYOFCMGNMHWABH-UHFFFAOYSA-N 1 2 304.434 4.359 20 0 DIADLO CCCCCOc1ccc([C@H](C)[NH2+]Cc2ccon2)cc1OC ZINC000179785053 1043152506 /nfs/dbraw/zinc/15/25/06/1043152506.db2.gz YCDBBHIFSPDVKT-AWEZNQCLSA-N 1 2 318.417 4.103 20 0 DIADLO Cc1ccccc1[C@@H]([NH2+]Cc1noc(C(C)(C)C)n1)C(C)C ZINC000183229754 1043158826 /nfs/dbraw/zinc/15/88/26/1043158826.db2.gz UUTMFOOHISPQRC-INIZCTEOSA-N 1 2 301.434 4.162 20 0 DIADLO Cc1ccccc1[C@H]([NH2+]Cc1ncn(-c2ccccc2)n1)C(C)C ZINC000183223879 1043158951 /nfs/dbraw/zinc/15/89/51/1043158951.db2.gz IRVJEYUMJNVCHI-HXUWFJFHSA-N 1 2 320.440 4.063 20 0 DIADLO F[C@@H]1COc2ccccc2[C@@H]1[NH2+][C@H]1CCSc2ccccc21 ZINC000866233246 1043163916 /nfs/dbraw/zinc/16/39/16/1043163916.db2.gz UBYWYXHXXHAFKB-VKJFTORMSA-N 1 2 315.413 4.285 20 0 DIADLO OC[C@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1ccccc1 ZINC000183667262 1043168346 /nfs/dbraw/zinc/16/83/46/1043168346.db2.gz NEPCJZFWSXJNEN-KRWDZBQOSA-N 1 2 316.470 4.014 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+](C)[C@@H](C)c2ccccn2)s1 ZINC000183634869 1043168817 /nfs/dbraw/zinc/16/88/17/1043168817.db2.gz MBQHYISXNJIDCK-VIFPVBQESA-N 1 2 315.364 4.058 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+](C)[C@@H](C)c2ccccn2)s1 ZINC000183634869 1043168823 /nfs/dbraw/zinc/16/88/23/1043168823.db2.gz MBQHYISXNJIDCK-VIFPVBQESA-N 1 2 315.364 4.058 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)n1 ZINC000866268931 1043169215 /nfs/dbraw/zinc/16/92/15/1043169215.db2.gz LDKLTYNYMOGLME-LLVKDONJSA-N 1 2 318.808 4.109 20 0 DIADLO Cc1cccnc1[C@H]([NH2+][C@H]1c2ccccc2OC[C@@H]1F)C(C)C ZINC000866267463 1043169678 /nfs/dbraw/zinc/16/96/78/1043169678.db2.gz IWJSQAZWQZYPOJ-WDYCEAGBSA-N 1 2 314.404 4.149 20 0 DIADLO Cc1cncc([C@H]2CCCN2c2[nH+]ccc3cc(F)ccc32)c1 ZINC000866275550 1043171470 /nfs/dbraw/zinc/17/14/70/1043171470.db2.gz CGWVFFBGKAJUTN-GOSISDBHSA-N 1 2 307.372 4.419 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1c(F)c(F)cc(F)c1F)c1ccccn1 ZINC000866302709 1043175567 /nfs/dbraw/zinc/17/55/67/1043175567.db2.gz KAJHWKMVIBKQNW-MRXNPFEDSA-N 1 2 312.310 4.125 20 0 DIADLO F[C@@H]1COc2ccccc2[C@H]1[NH2+][C@H]1CCCc2sccc21 ZINC000866339424 1043182754 /nfs/dbraw/zinc/18/27/54/1043182754.db2.gz BMBSEBJNBREBIJ-JKIFEVAISA-N 1 2 303.402 4.187 20 0 DIADLO F[C@@H]1COc2ccccc2[C@@H]1[NH2+][C@@H]1CCCc2sccc21 ZINC000866339423 1043183043 /nfs/dbraw/zinc/18/30/43/1043183043.db2.gz BMBSEBJNBREBIJ-CPUCHLNUSA-N 1 2 303.402 4.187 20 0 DIADLO CCCNc1ccc(C[NH2+][C@H]2c3ccccc3OC[C@H]2F)cc1 ZINC000866348052 1043186540 /nfs/dbraw/zinc/18/65/40/1043186540.db2.gz MHCFLOVUTNXZEW-MJGOQNOKSA-N 1 2 314.404 4.070 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2ccccc2OC(F)F)cs1 ZINC000184676813 1043188810 /nfs/dbraw/zinc/18/88/10/1043188810.db2.gz FYSBDFGDGHBGKW-SNVBAGLBSA-N 1 2 312.385 4.158 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2ccn(C(C)C)n2)c2cccnc2)cc1 ZINC000925105250 1043190904 /nfs/dbraw/zinc/19/09/04/1043190904.db2.gz BTMHACZTOIMVRH-FQEVSTJZSA-N 1 2 320.440 4.047 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(COC(C)(C)C)on1)c1cccc(Cl)c1 ZINC000186059088 1043212454 /nfs/dbraw/zinc/21/24/54/1043212454.db2.gz DHXWWHNRUBOERG-GFCCVEGCSA-N 1 2 322.836 4.494 20 0 DIADLO COc1ccsc1[C@@H](C)[NH2+]Cc1coc(-c2cccs2)n1 ZINC000186126770 1043215750 /nfs/dbraw/zinc/21/57/50/1043215750.db2.gz FDOFDSXXEWAACD-SNVBAGLBSA-N 1 2 320.439 4.324 20 0 DIADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1nn(C)cc1C(F)F ZINC000866563319 1043224371 /nfs/dbraw/zinc/22/43/71/1043224371.db2.gz JPJMMYBDINSDEB-LLVKDONJSA-N 1 2 319.355 4.263 20 0 DIADLO C[C@@H]([NH2+][C@H](CCO)c1ccco1)c1ccc(Cl)cc1Cl ZINC000186542078 1043228269 /nfs/dbraw/zinc/22/82/69/1043228269.db2.gz NAFDEWISXNHXOW-QMTHXVAHSA-N 1 2 314.212 4.361 20 0 DIADLO C[C@H]([NH2+][C@H](CCO)c1ccco1)c1cc(Cl)sc1Cl ZINC000186563104 1043229494 /nfs/dbraw/zinc/22/94/94/1043229494.db2.gz LDSYKIDITXJPJZ-WCBMZHEXSA-N 1 2 320.241 4.422 20 0 DIADLO C[C@H]([NH2+][C@@H](CCO)c1ccco1)c1cc(Cl)sc1Cl ZINC000186563067 1043229937 /nfs/dbraw/zinc/22/99/37/1043229937.db2.gz LDSYKIDITXJPJZ-WPRPVWTQSA-N 1 2 320.241 4.422 20 0 DIADLO Cc1[nH+]c(NCc2sccc2Cl)ccc1-c1cnn(C)c1 ZINC001202521936 1043243787 /nfs/dbraw/zinc/24/37/87/1043243787.db2.gz XSYHUSNLYAEMBD-UHFFFAOYSA-N 1 2 318.833 4.118 20 0 DIADLO CCCn1c(CNc2ccc([NH+](C)C)cc2)nc2ccccc21 ZINC000121604317 1043250753 /nfs/dbraw/zinc/25/07/53/1043250753.db2.gz MFJKRRFOHKEYMV-UHFFFAOYSA-N 1 2 308.429 4.124 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@H](c2ncc[nH]2)c2ccc(F)cc2)c(C)c1 ZINC000187894936 1043253781 /nfs/dbraw/zinc/25/37/81/1043253781.db2.gz SFDAYAJLWCEBCE-IBGZPJMESA-N 1 2 323.415 4.353 20 0 DIADLO c1cn(C2CC2)c(C[N@@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)n1 ZINC000895123594 1043281559 /nfs/dbraw/zinc/28/15/59/1043281559.db2.gz DAIDBJMQVUIXGR-LJQANCHMSA-N 1 2 305.425 4.111 20 0 DIADLO c1cn(C2CC2)c(C[N@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)n1 ZINC000895123594 1043281566 /nfs/dbraw/zinc/28/15/66/1043281566.db2.gz DAIDBJMQVUIXGR-LJQANCHMSA-N 1 2 305.425 4.111 20 0 DIADLO CCn1ncnc1C[N@H+]([C@@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000193334635 1043284646 /nfs/dbraw/zinc/28/46/46/1043284646.db2.gz VKCIBWJMKWVFRR-HNNXBMFYSA-N 1 2 320.440 4.177 20 0 DIADLO CCn1ncnc1C[N@@H+]([C@@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000193334635 1043284655 /nfs/dbraw/zinc/28/46/55/1043284655.db2.gz VKCIBWJMKWVFRR-HNNXBMFYSA-N 1 2 320.440 4.177 20 0 DIADLO CC(C)[C@H](O)Cc1ccccc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC000665212128 1043286118 /nfs/dbraw/zinc/28/61/18/1043286118.db2.gz QHULGHSLDNJMAV-OAQYLSRUSA-N 1 2 320.436 4.158 20 0 DIADLO Cc1nc(C[NH2+][C@H](c2ccccc2)c2ccncc2)sc1C ZINC000122348260 1043297665 /nfs/dbraw/zinc/29/76/65/1043297665.db2.gz AYBYVVCSPJZJIJ-GOSISDBHSA-N 1 2 309.438 4.034 20 0 DIADLO Cc1c(NCc2ccc(-n3cc[nH+]c3)cc2)cnn1C1CCCC1 ZINC000195455510 1043299369 /nfs/dbraw/zinc/29/93/69/1043299369.db2.gz AOEXMQROAXULEN-UHFFFAOYSA-N 1 2 321.428 4.104 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@H+](Cc2cc(-c3ccccc3)on2)C1 ZINC000268198035 1043314889 /nfs/dbraw/zinc/31/48/89/1043314889.db2.gz FSFKWJQMIHELKA-CYBMUJFWSA-N 1 2 310.319 4.116 20 0 DIADLO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2cc(-c3ccccc3)on2)C1 ZINC000268198035 1043314897 /nfs/dbraw/zinc/31/48/97/1043314897.db2.gz FSFKWJQMIHELKA-CYBMUJFWSA-N 1 2 310.319 4.116 20 0 DIADLO Cc1cc(C[N@@H+](C)[C@@H](c2ccccc2Cl)C(C)C)nn1C ZINC000487407118 1043315834 /nfs/dbraw/zinc/31/58/34/1043315834.db2.gz KXMZDWYOVHJSOB-QGZVFWFLSA-N 1 2 305.853 4.211 20 0 DIADLO Cc1cc(C[N@H+](C)[C@@H](c2ccccc2Cl)C(C)C)nn1C ZINC000487407118 1043315835 /nfs/dbraw/zinc/31/58/35/1043315835.db2.gz KXMZDWYOVHJSOB-QGZVFWFLSA-N 1 2 305.853 4.211 20 0 DIADLO Cc1nc(C[NH2+]C(C)(c2ccccc2)c2ccccc2)[nH]c1C ZINC000520839882 1043332508 /nfs/dbraw/zinc/33/25/08/1043332508.db2.gz VSTKHZYSHBCDIT-UHFFFAOYSA-N 1 2 305.425 4.080 20 0 DIADLO COc1cc(F)c([C@H](C)[NH2+][C@H](C)c2csc(C)n2)cc1OC ZINC000268840263 1043335642 /nfs/dbraw/zinc/33/56/42/1043335642.db2.gz AONJWTOFARHNMD-VHSXEESVSA-N 1 2 324.421 4.020 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nc(C)no1)c1cccc(C(F)(F)F)c1 ZINC000268948945 1043344702 /nfs/dbraw/zinc/34/47/02/1043344702.db2.gz XAWRARGBQKLXIA-CYBMUJFWSA-N 1 2 313.323 4.028 20 0 DIADLO Cc1nc(C2([NH2+]Cc3c(C)ccc4ccccc43)CCCC2)no1 ZINC000269006092 1043350054 /nfs/dbraw/zinc/35/00/54/1043350054.db2.gz LJDNQNYNENUFJJ-UHFFFAOYSA-N 1 2 321.424 4.399 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+][C@@H]2CCSc3ccccc32)cs1 ZINC000269025948 1043353729 /nfs/dbraw/zinc/35/37/29/1043353729.db2.gz COISBQXRHKHINM-SMDDNHRTSA-N 1 2 320.483 4.177 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccc(C)cc2OCC2CC2)cs1 ZINC000269385908 1043363550 /nfs/dbraw/zinc/36/35/50/1043363550.db2.gz AZKYRZVVOKLWAW-ZDUSSCGKSA-N 1 2 316.470 4.400 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000270253611 1043383387 /nfs/dbraw/zinc/38/33/87/1043383387.db2.gz XWERVMAGMDMREI-UHFFFAOYSA-N 1 2 322.330 4.344 20 0 DIADLO Cc1oc(-c2ccccc2)nc1C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000270253611 1043383396 /nfs/dbraw/zinc/38/33/96/1043383396.db2.gz XWERVMAGMDMREI-UHFFFAOYSA-N 1 2 322.330 4.344 20 0 DIADLO Cc1cc(C[NH2+][C@H](c2cccc(C)c2)c2ccccn2)c(C)o1 ZINC000123736099 1043387052 /nfs/dbraw/zinc/38/70/52/1043387052.db2.gz XPMUFQGCPQEOFY-HXUWFJFHSA-N 1 2 306.409 4.479 20 0 DIADLO Fc1ccc([C@H]2CCCC[N@@H+]2Cc2ncc(C3CC3)o2)cc1 ZINC000270530912 1043389077 /nfs/dbraw/zinc/38/90/77/1043389077.db2.gz FNSBQTKNFRGBDP-MRXNPFEDSA-N 1 2 300.377 4.418 20 0 DIADLO Fc1ccc([C@H]2CCCC[N@H+]2Cc2ncc(C3CC3)o2)cc1 ZINC000270530912 1043389082 /nfs/dbraw/zinc/38/90/82/1043389082.db2.gz FNSBQTKNFRGBDP-MRXNPFEDSA-N 1 2 300.377 4.418 20 0 DIADLO CC[N@H+](Cc1ncc(C2CC2)o1)[C@H](C)c1cccc(OC)c1 ZINC000270533405 1043389365 /nfs/dbraw/zinc/38/93/65/1043389365.db2.gz GCKVGLCTMMOVEZ-CYBMUJFWSA-N 1 2 300.402 4.144 20 0 DIADLO CC[N@@H+](Cc1ncc(C2CC2)o1)[C@H](C)c1cccc(OC)c1 ZINC000270533405 1043389374 /nfs/dbraw/zinc/38/93/74/1043389374.db2.gz GCKVGLCTMMOVEZ-CYBMUJFWSA-N 1 2 300.402 4.144 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2ncc(C3CC3)o2)[C@H]1c1ccccc1 ZINC000270618817 1043391466 /nfs/dbraw/zinc/39/14/66/1043391466.db2.gz OOFQCXYKBPDYIL-SCLBCKFNSA-N 1 2 314.454 4.231 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2ncc(C3CC3)o2)[C@H]1c1ccccc1 ZINC000270618817 1043391478 /nfs/dbraw/zinc/39/14/78/1043391478.db2.gz OOFQCXYKBPDYIL-SCLBCKFNSA-N 1 2 314.454 4.231 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270663534 1043393304 /nfs/dbraw/zinc/39/33/04/1043393304.db2.gz WBGAOEWXYBRMSX-MLGOLLRUSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000270663534 1043393314 /nfs/dbraw/zinc/39/33/14/1043393314.db2.gz WBGAOEWXYBRMSX-MLGOLLRUSA-N 1 2 300.377 4.274 20 0 DIADLO CC(C)c1nnc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3)o2)[nH]1 ZINC000270713840 1043395752 /nfs/dbraw/zinc/39/57/52/1043395752.db2.gz MAIMXXURKCALMU-ZDUSSCGKSA-N 1 2 310.401 4.039 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(F)cc1C(F)(F)F)c1cscn1 ZINC000271069936 1043401488 /nfs/dbraw/zinc/40/14/88/1043401488.db2.gz DVLVJEQBRJMMPK-QMMMGPOBSA-N 1 2 304.312 4.152 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2cscn2)c(OCC2CC2)c1 ZINC000271175078 1043404307 /nfs/dbraw/zinc/40/43/07/1043404307.db2.gz UVKFFJGEJRHICS-ZDUSSCGKSA-N 1 2 302.443 4.091 20 0 DIADLO CCC[C@@H]([NH2+][C@@H](C)c1nn(CC)nc1C)c1ccc(F)cc1F ZINC000925264333 1043405829 /nfs/dbraw/zinc/40/58/29/1043405829.db2.gz MAJKARLENVOQAO-MEDUHNTESA-N 1 2 322.403 4.077 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2ncc(Cl)s2)cc1Cl ZINC000871933366 1043416031 /nfs/dbraw/zinc/41/60/31/1043416031.db2.gz MZRZFKQIIZDRDW-MRVPVSSYSA-N 1 2 317.241 4.309 20 0 DIADLO CC(C)c1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(F)c(Cl)c2)[nH]1 ZINC000271434718 1043416261 /nfs/dbraw/zinc/41/62/61/1043416261.db2.gz DRINFIBZGXQJIQ-UWVGGRQHSA-N 1 2 310.804 4.132 20 0 DIADLO C[C@@H]([NH2+][C@H](CO)c1c(F)cccc1F)c1ccc(Cl)s1 ZINC000271425299 1043416370 /nfs/dbraw/zinc/41/63/70/1043416370.db2.gz CRKNOFPMBFMCDD-LDYMZIIASA-N 1 2 317.788 4.064 20 0 DIADLO CC[C@H]([NH2+][C@@H]1CCCc2oc(C)nc21)c1cc(F)ccc1F ZINC000925453651 1043418686 /nfs/dbraw/zinc/41/86/86/1043418686.db2.gz OLVMJHWSJIUIFR-LSDHHAIUSA-N 1 2 306.356 4.380 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1cc(Cl)ccc1Cl ZINC000271446013 1043419464 /nfs/dbraw/zinc/41/94/64/1043419464.db2.gz CYGGKSIFRDVDEU-XPTSAGLGSA-N 1 2 310.228 4.445 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1cc(Cl)ccc1Cl ZINC000271446013 1043419470 /nfs/dbraw/zinc/41/94/70/1043419470.db2.gz CYGGKSIFRDVDEU-XPTSAGLGSA-N 1 2 310.228 4.445 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+][C@H](C)c1cc(O)ccc1F ZINC000872025592 1043422767 /nfs/dbraw/zinc/42/27/67/1043422767.db2.gz PPNMAVIWYVCMDW-MNOVXSKESA-N 1 2 307.340 4.091 20 0 DIADLO Clc1ccnc2c1CCC[C@@H]2[NH2+]Cc1nc(C2CC2)cs1 ZINC000925546721 1043428326 /nfs/dbraw/zinc/42/83/26/1043428326.db2.gz MOHWWGLHJNSGPY-ZDUSSCGKSA-N 1 2 319.861 4.236 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@@H](C)c2cccc(O)c2F)on1 ZINC000872038417 1043431288 /nfs/dbraw/zinc/43/12/88/1043431288.db2.gz LMXAUAVLGLUSLV-NSHDSACASA-N 1 2 306.381 4.274 20 0 DIADLO Fc1ccc(F)c2c1CC[C@H]2[NH2+]Cc1nc(C2CC2)cs1 ZINC000271558825 1043436998 /nfs/dbraw/zinc/43/69/98/1043436998.db2.gz WJLHUYFPYWEYQK-CYBMUJFWSA-N 1 2 306.381 4.076 20 0 DIADLO CC(C)(C)[C@@H]1C[C@@H](Nc2ccc([NH+]3CCCC3)cc2)CCO1 ZINC000872055403 1043439326 /nfs/dbraw/zinc/43/93/26/1043439326.db2.gz HUSIXZKFKCRYIE-WMZOPIPTSA-N 1 2 302.462 4.292 20 0 DIADLO CC(C)(C)[C@@H]1C[C@@H]([NH2+]c2ccc(N3CCCC3)cc2)CCO1 ZINC000872055403 1043439332 /nfs/dbraw/zinc/43/93/32/1043439332.db2.gz HUSIXZKFKCRYIE-WMZOPIPTSA-N 1 2 302.462 4.292 20 0 DIADLO COC[C@@H]([NH2+][C@H](C)c1cccc(O)c1F)c1ccc(Cl)cc1 ZINC000872066104 1043445758 /nfs/dbraw/zinc/44/57/58/1043445758.db2.gz DYOXBELFESGAFN-IAQYHMDHSA-N 1 2 323.795 4.223 20 0 DIADLO CSc1cccc(F)c1C[NH2+][C@H](C)c1cccc(O)c1F ZINC000872069158 1043448104 /nfs/dbraw/zinc/44/81/04/1043448104.db2.gz LPIYHVKHQIXESU-SNVBAGLBSA-N 1 2 309.381 4.243 20 0 DIADLO COc1cc(C(F)(F)F)ccc1Nc1ccn2cc[nH+]c2c1 ZINC001204982835 1043450081 /nfs/dbraw/zinc/45/00/81/1043450081.db2.gz JVDRVUQUXBLMLJ-UHFFFAOYSA-N 1 2 307.275 4.105 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000348547226 1043459157 /nfs/dbraw/zinc/45/91/57/1043459157.db2.gz FBXBLXMVFUUZLB-QGZVFWFLSA-N 1 2 303.837 4.373 20 0 DIADLO Cc1nn(C(C)C)cc1C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000348547226 1043459166 /nfs/dbraw/zinc/45/91/66/1043459166.db2.gz FBXBLXMVFUUZLB-QGZVFWFLSA-N 1 2 303.837 4.373 20 0 DIADLO CCc1ccc([C@H](C)[NH2+]Cc2nc(-c3ccncc3)cs2)o1 ZINC000872121076 1043466781 /nfs/dbraw/zinc/46/67/81/1043466781.db2.gz JWOXAXLWRCWWLA-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO CC(C)n1cc([C@@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)cn1 ZINC000348796607 1043467995 /nfs/dbraw/zinc/46/79/95/1043467995.db2.gz DSTZHHHVEPUWLM-OAHLLOKOSA-N 1 2 313.449 4.022 20 0 DIADLO C[C@H]1CCc2nc(C[N@@H+]3CCC[C@H]3c3cccnc3)sc2C1 ZINC000348894690 1043477918 /nfs/dbraw/zinc/47/79/18/1043477918.db2.gz OTJMEGKOFVVQLC-BBRMVZONSA-N 1 2 313.470 4.000 20 0 DIADLO C[C@H]1CCc2nc(C[N@H+]3CCC[C@H]3c3cccnc3)sc2C1 ZINC000348894690 1043477927 /nfs/dbraw/zinc/47/79/27/1043477927.db2.gz OTJMEGKOFVVQLC-BBRMVZONSA-N 1 2 313.470 4.000 20 0 DIADLO Cc1nonc1C[NH2+][C@H](C)c1ccc(SC2CCCC2)cc1 ZINC000872135996 1043478124 /nfs/dbraw/zinc/47/81/24/1043478124.db2.gz JXZHNIYPRIGLNL-GFCCVEGCSA-N 1 2 317.458 4.264 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)c3ccc4sccc4c3)cc2[nH+]1 ZINC000348943035 1043482906 /nfs/dbraw/zinc/48/29/06/1043482906.db2.gz WJOBEKGJEHEGOF-UHFFFAOYSA-N 1 2 307.378 4.338 20 0 DIADLO CCC(CC)c1noc([C@H]([NH3+])c2ccc(C(F)(F)F)cc2)n1 ZINC000872175068 1043484308 /nfs/dbraw/zinc/48/43/08/1043484308.db2.gz NOJMIOKWHOEWSY-GFCCVEGCSA-N 1 2 313.323 4.040 20 0 DIADLO CCCc1nc(C[N@H+](CCOC)[C@@H](C)c2ccccc2)cs1 ZINC000521858731 1043493151 /nfs/dbraw/zinc/49/31/51/1043493151.db2.gz LKBUOXYEGFEEPR-HNNXBMFYSA-N 1 2 318.486 4.305 20 0 DIADLO CCCc1nc(C[N@@H+](CCOC)[C@@H](C)c2ccccc2)cs1 ZINC000521858731 1043493162 /nfs/dbraw/zinc/49/31/62/1043493162.db2.gz LKBUOXYEGFEEPR-HNNXBMFYSA-N 1 2 318.486 4.305 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]C1(c2ccc(F)cc2F)CCC1 ZINC000925954257 1043498716 /nfs/dbraw/zinc/49/87/16/1043498716.db2.gz YXQATWJAYYJWPT-OAHLLOKOSA-N 1 2 318.367 4.308 20 0 DIADLO COc1ccccc1C[N@@H+]1CCCn2c(cc3ccccc32)C1 ZINC000558424755 1043509220 /nfs/dbraw/zinc/50/92/20/1043509220.db2.gz CHSVXFWQZNKWTH-UHFFFAOYSA-N 1 2 306.409 4.056 20 0 DIADLO COc1ccccc1C[N@H+]1CCCn2c(cc3ccccc32)C1 ZINC000558424755 1043509234 /nfs/dbraw/zinc/50/92/34/1043509234.db2.gz CHSVXFWQZNKWTH-UHFFFAOYSA-N 1 2 306.409 4.056 20 0 DIADLO c1nnc([C@H]([NH2+]Cc2ccc(C3CC3)cc2)C2CCCCC2)[nH]1 ZINC000521955779 1043514404 /nfs/dbraw/zinc/51/44/04/1043514404.db2.gz OCVUUQBZNRCLGN-GOSISDBHSA-N 1 2 310.445 4.093 20 0 DIADLO C[C@@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1ncco1 ZINC000926054937 1043515658 /nfs/dbraw/zinc/51/56/58/1043515658.db2.gz KITLXNVRKXVRMJ-CYBMUJFWSA-N 1 2 308.385 4.048 20 0 DIADLO Cc1cnc(C[NH2+]Cc2cc(Cl)ccc2OCC2CC2)s1 ZINC000521990940 1043519539 /nfs/dbraw/zinc/51/95/39/1043519539.db2.gz DPDKDJAZSGMPHY-UHFFFAOYSA-N 1 2 322.861 4.184 20 0 DIADLO Clc1cccc2c1CC[N@H+](Cc1ccc(N3CCCC3)o1)C2 ZINC001137069603 1043528775 /nfs/dbraw/zinc/52/87/75/1043528775.db2.gz FFWJHAHYWRBJAH-UHFFFAOYSA-N 1 2 316.832 4.092 20 0 DIADLO Clc1cccc2c1CC[N@@H+](Cc1ccc(N3CCCC3)o1)C2 ZINC001137069603 1043528786 /nfs/dbraw/zinc/52/87/86/1043528786.db2.gz FFWJHAHYWRBJAH-UHFFFAOYSA-N 1 2 316.832 4.092 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1ccc(N3CCCC3)o1)CC2 ZINC001137070093 1043531621 /nfs/dbraw/zinc/53/16/21/1043531621.db2.gz ZOCFLVXCJNNBNW-UHFFFAOYSA-N 1 2 316.832 4.092 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1ccc(N3CCCC3)o1)CC2 ZINC001137070093 1043531629 /nfs/dbraw/zinc/53/16/29/1043531629.db2.gz ZOCFLVXCJNNBNW-UHFFFAOYSA-N 1 2 316.832 4.092 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2C)cs1 ZINC000443409493 1043542120 /nfs/dbraw/zinc/54/21/20/1043542120.db2.gz WWTWAVAHMLWFPZ-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2C)cs1 ZINC000443409493 1043542132 /nfs/dbraw/zinc/54/21/32/1043542132.db2.gz WWTWAVAHMLWFPZ-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1nc(-c2ccccc2)cs1 ZINC000350359451 1043544517 /nfs/dbraw/zinc/54/45/17/1043544517.db2.gz SARHZXKHNRLNFJ-AWEZNQCLSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1nc(-c2ccccc2)cs1 ZINC000350359451 1043544526 /nfs/dbraw/zinc/54/45/26/1043544526.db2.gz SARHZXKHNRLNFJ-AWEZNQCLSA-N 1 2 309.438 4.398 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1cn(C)cn1 ZINC000926299693 1043559635 /nfs/dbraw/zinc/55/96/35/1043559635.db2.gz ZWSXABWCYVRAHR-JSGCOSHPSA-N 1 2 311.351 4.073 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2ccc(Cl)cn2)C1 ZINC000558626896 1043559703 /nfs/dbraw/zinc/55/97/03/1043559703.db2.gz JVTCYTNCQQWKHP-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@]1(F)CC[N@@H+](Cc2ccc(Cl)cn2)C1 ZINC000558626896 1043559712 /nfs/dbraw/zinc/55/97/12/1043559712.db2.gz JVTCYTNCQQWKHP-KRWDZBQOSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1cc(F)c(Cl)cc1F ZINC000926321678 1043561590 /nfs/dbraw/zinc/56/15/90/1043561590.db2.gz NYDXCDOCVROVEB-SSDOTTSWSA-N 1 2 300.736 4.074 20 0 DIADLO C[N@H+](Cc1nc2c(s1)CCCC2)Cc1ccc(CF)cc1 ZINC000777594438 1043570052 /nfs/dbraw/zinc/57/00/52/1043570052.db2.gz GLCVKHRIOYZWCY-UHFFFAOYSA-N 1 2 304.434 4.123 20 0 DIADLO C[N@@H+](Cc1nc2c(s1)CCCC2)Cc1ccc(CF)cc1 ZINC000777594438 1043570061 /nfs/dbraw/zinc/57/00/61/1043570061.db2.gz GLCVKHRIOYZWCY-UHFFFAOYSA-N 1 2 304.434 4.123 20 0 DIADLO CCc1nc(C[N@H+](C)C[C@H]2CCC3(CCCCC3)O2)cs1 ZINC000558679369 1043572517 /nfs/dbraw/zinc/57/25/17/1043572517.db2.gz ZPUURMWLUKDUQD-OAHLLOKOSA-N 1 2 308.491 4.019 20 0 DIADLO CCc1nc(C[N@@H+](C)C[C@H]2CCC3(CCCCC3)O2)cs1 ZINC000558679369 1043572530 /nfs/dbraw/zinc/57/25/30/1043572530.db2.gz ZPUURMWLUKDUQD-OAHLLOKOSA-N 1 2 308.491 4.019 20 0 DIADLO CCc1nnc(C[NH2+][C@H](C)c2c(C)oc3ccccc32)s1 ZINC000926461866 1043579688 /nfs/dbraw/zinc/57/96/88/1043579688.db2.gz SURPUABZGNTJNO-SNVBAGLBSA-N 1 2 301.415 4.006 20 0 DIADLO Cc1ccc(C2([NH2+][C@@H](c3nnc[nH]3)C3CCCCC3)CCC2)cc1 ZINC000639286579 1043584379 /nfs/dbraw/zinc/58/43/79/1043584379.db2.gz DBAOOWKUNXDHFX-GOSISDBHSA-N 1 2 324.472 4.404 20 0 DIADLO COCc1cnc(C[NH2+][C@@H](C)c2cc3cccc(F)c3o2)s1 ZINC000353191761 1043590348 /nfs/dbraw/zinc/59/03/48/1043590348.db2.gz KPQHMYMNQREXTB-JTQLQIEISA-N 1 2 320.389 4.026 20 0 DIADLO Cc1ccc(NCc2ccccc2OCc2ccncc2)c(C)[nH+]1 ZINC000353196467 1043591313 /nfs/dbraw/zinc/59/13/13/1043591313.db2.gz XBGSWKJLIJIKPK-UHFFFAOYSA-N 1 2 319.408 4.285 20 0 DIADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](Cc1ccccc1C)c1ccco1 ZINC000926533514 1043594794 /nfs/dbraw/zinc/59/47/94/1043594794.db2.gz QKZZFLCKIGJMSN-AEFFLSMTSA-N 1 2 323.440 4.439 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc([NH+](C)C)cc2C)c(OC)c1 ZINC000320166078 1043597428 /nfs/dbraw/zinc/59/74/28/1043597428.db2.gz YKSHMFJXYUIINW-CQSZACIVSA-N 1 2 314.429 4.251 20 0 DIADLO CCCc1ncc(C[NH2+][C@@H](C)c2cc(-c3ccccc3)no2)o1 ZINC000926536628 1043597615 /nfs/dbraw/zinc/59/76/15/1043597615.db2.gz GAPGBYYTWKTHTI-ZDUSSCGKSA-N 1 2 311.385 4.133 20 0 DIADLO CCn1ccc(C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2F)n1 ZINC000926577549 1043602692 /nfs/dbraw/zinc/60/26/92/1043602692.db2.gz JSIDVNYAYNCCMO-SECBINFHSA-N 1 2 316.207 4.200 20 0 DIADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1ccc(F)cc1N(C)C ZINC000777602341 1043604479 /nfs/dbraw/zinc/60/44/79/1043604479.db2.gz LIWXXZWENQMNTE-ZDUSSCGKSA-N 1 2 301.409 4.131 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@@H+](Cc1nc(C)sc1C)C2 ZINC000443585893 1043606603 /nfs/dbraw/zinc/60/66/03/1043606603.db2.gz ZAIDRXHYRXTZFU-UHFFFAOYSA-N 1 2 316.470 4.107 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@H+](Cc1nc(C)sc1C)C2 ZINC000443585893 1043606606 /nfs/dbraw/zinc/60/66/06/1043606606.db2.gz ZAIDRXHYRXTZFU-UHFFFAOYSA-N 1 2 316.470 4.107 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3nc(C(F)(F)F)cs3)CC2)cc1 ZINC000443580406 1043606898 /nfs/dbraw/zinc/60/68/98/1043606898.db2.gz KVRCUHMJCFUPSQ-UHFFFAOYSA-N 1 2 316.323 4.080 20 0 DIADLO CC1(C)C[C@@H]([NH2+]Cc2cc(C3CC3)no2)c2cc(F)ccc2O1 ZINC000639293076 1043610324 /nfs/dbraw/zinc/61/03/24/1043610324.db2.gz CYWHIVDOFHXPBN-MRXNPFEDSA-N 1 2 316.376 4.083 20 0 DIADLO CCc1nnc(C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)s1 ZINC000353555804 1043617418 /nfs/dbraw/zinc/61/74/18/1043617418.db2.gz DQUAAFGYWNAJPZ-NSHDSACASA-N 1 2 301.415 4.006 20 0 DIADLO Clc1cccc2c1CC[C@H]2[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000443620189 1043622883 /nfs/dbraw/zinc/62/28/83/1043622883.db2.gz JFXSKKYCIGMUOR-IAGOWNOFSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1cccc2c1CC[C@H]2[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000443620189 1043622890 /nfs/dbraw/zinc/62/28/90/1043622890.db2.gz JFXSKKYCIGMUOR-IAGOWNOFSA-N 1 2 319.857 4.462 20 0 DIADLO C[C@H]([NH2+]C1(c2ccc(C(F)(F)F)cc2)CCC1)c1ncco1 ZINC000926739231 1043624712 /nfs/dbraw/zinc/62/47/12/1043624712.db2.gz YIIUYJVBISZYIG-NSHDSACASA-N 1 2 310.319 4.423 20 0 DIADLO COc1ccnc([C@H](C)[NH2+]C2(c3c(F)cccc3F)CCC2)c1 ZINC000926775134 1043629852 /nfs/dbraw/zinc/62/98/52/1043629852.db2.gz UAVRNMOGILKURH-LBPRGKRZSA-N 1 2 318.367 4.098 20 0 DIADLO CC(C)[C@H](CC1CCCCC1)C(=O)NCCCCn1cc[nH+]c1 ZINC000522348519 1043635008 /nfs/dbraw/zinc/63/50/08/1043635008.db2.gz PLTVBMDFDZGLSJ-SFHVURJKSA-N 1 2 319.493 4.022 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+]Cc1ccc(C(F)(F)F)s1 ZINC000926823041 1043639642 /nfs/dbraw/zinc/63/96/42/1043639642.db2.gz FKLGKOOLBHHMRL-SNVBAGLBSA-N 1 2 316.348 4.231 20 0 DIADLO Cc1ccc(C[NH2+][C@@H]2COCc3cccc(Cl)c32)c(Cl)n1 ZINC000926849972 1043642434 /nfs/dbraw/zinc/64/24/34/1043642434.db2.gz IWZUMAGBTZRDHQ-CQSZACIVSA-N 1 2 323.223 4.058 20 0 DIADLO Cc1cc(C)cc(C[NH2+]Cc2csc(C(F)(F)F)n2)c1 ZINC000895357342 1043653341 /nfs/dbraw/zinc/65/33/41/1043653341.db2.gz DAEZVMNONYYRDP-UHFFFAOYSA-N 1 2 300.349 4.069 20 0 DIADLO COCC[N@H+](Cc1cccs1)Cc1cccc(F)c1Cl ZINC000559036923 1043673067 /nfs/dbraw/zinc/67/30/67/1043673067.db2.gz ACKKJAUMEOLRKY-UHFFFAOYSA-N 1 2 313.825 4.189 20 0 DIADLO COCC[N@@H+](Cc1cccs1)Cc1cccc(F)c1Cl ZINC000559036923 1043673071 /nfs/dbraw/zinc/67/30/71/1043673071.db2.gz ACKKJAUMEOLRKY-UHFFFAOYSA-N 1 2 313.825 4.189 20 0 DIADLO CC(C)[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc(F)cn1 ZINC000354023437 1043674288 /nfs/dbraw/zinc/67/42/88/1043674288.db2.gz YKWDOKVVJWAYOS-GOSISDBHSA-N 1 2 314.408 4.025 20 0 DIADLO Cc1coc(C[NH2+]C(C)(C)c2nc3cc(Cl)ccc3o2)c1 ZINC000895418718 1043680354 /nfs/dbraw/zinc/68/03/54/1043680354.db2.gz OYOOYWXXBGCGHH-UHFFFAOYSA-N 1 2 304.777 4.408 20 0 DIADLO CC[C@H](C)CCCCC(=O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927083372 1043682805 /nfs/dbraw/zinc/68/28/05/1043682805.db2.gz FPAKISNIVFMNCJ-INIZCTEOSA-N 1 2 317.477 4.091 20 0 DIADLO Cc1cc(F)c(C[NH2+][C@@H](C)c2cnn(C3CCC3)c2)c(F)c1 ZINC000927092775 1043684623 /nfs/dbraw/zinc/68/46/23/1043684623.db2.gz LVDMNFHHOYCMIY-LBPRGKRZSA-N 1 2 305.372 4.046 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(C2CC2)n(C)n1)c1ccc(Cl)cc1Cl ZINC000927113498 1043690869 /nfs/dbraw/zinc/69/08/69/1043690869.db2.gz ZMCNQCPARSQPGX-SNVBAGLBSA-N 1 2 324.255 4.455 20 0 DIADLO Fc1cccc(-c2noc([C@H]3CCC[C@@H](c4ccccc4)[NH2+]3)n2)c1 ZINC001211883596 1043696484 /nfs/dbraw/zinc/69/64/84/1043696484.db2.gz BAGUDYVVGRFMTC-DLBZAZTESA-N 1 2 323.371 4.432 20 0 DIADLO CCCc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000354376181 1043697169 /nfs/dbraw/zinc/69/71/69/1043697169.db2.gz KLYAFNRXIJZNKT-UHFFFAOYSA-N 1 2 305.381 4.077 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1cccnc1Br ZINC000876588662 1043697470 /nfs/dbraw/zinc/69/74/70/1043697470.db2.gz CGIJUKUHEVYMIO-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1cccnc1Br ZINC000876588662 1043697485 /nfs/dbraw/zinc/69/74/85/1043697485.db2.gz CGIJUKUHEVYMIO-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO Cc1cc(C)c(NC(=O)NCC[C@H]2CCc3ccccc32)c(C)[nH+]1 ZINC000520978310 1043698526 /nfs/dbraw/zinc/69/85/26/1043698526.db2.gz AQWVDRZSVMBTLY-QGZVFWFLSA-N 1 2 323.440 4.248 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)cc2c1OCC2)c1cscn1 ZINC000927140791 1043699224 /nfs/dbraw/zinc/69/92/24/1043699224.db2.gz PGAHWGSSDRSHRZ-VHSXEESVSA-N 1 2 308.834 4.143 20 0 DIADLO CCc1ccc(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)nc1 ZINC000559130381 1043700924 /nfs/dbraw/zinc/70/09/24/1043700924.db2.gz ROGNUJDBVAPOJW-CYBMUJFWSA-N 1 2 311.454 4.447 20 0 DIADLO CCc1ccc(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)nc1 ZINC000559130381 1043700937 /nfs/dbraw/zinc/70/09/37/1043700937.db2.gz ROGNUJDBVAPOJW-CYBMUJFWSA-N 1 2 311.454 4.447 20 0 DIADLO C[N@H+](CCc1ccccc1Cl)Cc1ncc(Cl)s1 ZINC001137110467 1043702382 /nfs/dbraw/zinc/70/23/82/1043702382.db2.gz XPMSOPLWGHPCRC-UHFFFAOYSA-N 1 2 301.242 4.124 20 0 DIADLO C[N@@H+](CCc1ccccc1Cl)Cc1ncc(Cl)s1 ZINC001137110467 1043702395 /nfs/dbraw/zinc/70/23/95/1043702395.db2.gz XPMSOPLWGHPCRC-UHFFFAOYSA-N 1 2 301.242 4.124 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+]Cc1cc(C2CC2)no1 ZINC000895539559 1043702629 /nfs/dbraw/zinc/70/26/29/1043702629.db2.gz WWJYEGBUKJCABE-UHFFFAOYSA-N 1 2 320.820 4.282 20 0 DIADLO CCc1cccc(F)c1C[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000474260231 1043715838 /nfs/dbraw/zinc/71/58/38/1043715838.db2.gz RBVLOHKQUMMYRQ-KRWDZBQOSA-N 1 2 305.418 4.023 20 0 DIADLO CCc1cccc(F)c1C[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000474260231 1043715850 /nfs/dbraw/zinc/71/58/50/1043715850.db2.gz RBVLOHKQUMMYRQ-KRWDZBQOSA-N 1 2 305.418 4.023 20 0 DIADLO Cc1cc([NH2+][C@H](C)[C@@H]2CC2(F)F)ccc1N1CCSCC1 ZINC000876854447 1043719114 /nfs/dbraw/zinc/71/91/14/1043719114.db2.gz GWZBNOAKCLEUPV-OCCSQVGLSA-N 1 2 312.429 4.004 20 0 DIADLO COc1cc(C)[nH+]c(CSc2nc(C)c(C)n2CC(C)C)c1 ZINC000536011656 1043721998 /nfs/dbraw/zinc/72/19/98/1043721998.db2.gz VJLXJHWJSHKCIW-UHFFFAOYSA-N 1 2 319.474 4.160 20 0 DIADLO C[C@H](CSC(C)(C)C)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC000777644963 1043722855 /nfs/dbraw/zinc/72/28/55/1043722855.db2.gz BHUTXZIWSBRSNR-GFCCVEGCSA-N 1 2 307.438 4.344 20 0 DIADLO COc1ccc([C@H](C)Nc2ccc([NH+](C)C)c(C)c2)c(OC)c1 ZINC000777642945 1043724949 /nfs/dbraw/zinc/72/49/49/1043724949.db2.gz GPFHUFFNHPAEOO-AWEZNQCLSA-N 1 2 314.429 4.251 20 0 DIADLO CC(C)c1nnc(C[NH2+]Cc2ccnc(-c3ccccc3)c2)s1 ZINC000895657109 1043726159 /nfs/dbraw/zinc/72/61/59/1043726159.db2.gz WFRUIJPUWLLIAW-UHFFFAOYSA-N 1 2 324.453 4.013 20 0 DIADLO C[C@H]([NH2+]Cc1nc(Cl)cs1)c1ccc(F)cc1Cl ZINC000877054153 1043738942 /nfs/dbraw/zinc/73/89/42/1043738942.db2.gz FNNLCYXZAVEVDQ-ZETCQYMHSA-N 1 2 305.205 4.440 20 0 DIADLO Cc1nccc(C[NH+](Cc2cccs2)Cc2cccs2)n1 ZINC000350315831 1043747269 /nfs/dbraw/zinc/74/72/69/1043747269.db2.gz WFNWUDRITWFUCX-UHFFFAOYSA-N 1 2 315.467 4.110 20 0 DIADLO c1ccc(-c2noc([C@@H]3CCC[C@@H](c4ccccc4)[NH2+]3)n2)cc1 ZINC001211885413 1043748172 /nfs/dbraw/zinc/74/81/72/1043748172.db2.gz OLZGJRSRWDMUCD-IRXDYDNUSA-N 1 2 305.381 4.293 20 0 DIADLO Cc1noc(C)c1C[N@@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC000355201578 1043749060 /nfs/dbraw/zinc/74/90/60/1043749060.db2.gz BLWTXVOVZGFYIN-KRWDZBQOSA-N 1 2 306.356 4.297 20 0 DIADLO Cc1noc(C)c1C[N@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC000355201578 1043749070 /nfs/dbraw/zinc/74/90/70/1043749070.db2.gz BLWTXVOVZGFYIN-KRWDZBQOSA-N 1 2 306.356 4.297 20 0 DIADLO Cc1noc(C)c1C[N@@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC000355201591 1043750751 /nfs/dbraw/zinc/75/07/51/1043750751.db2.gz BLWTXVOVZGFYIN-QGZVFWFLSA-N 1 2 306.356 4.297 20 0 DIADLO Cc1noc(C)c1C[N@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC000355201591 1043750757 /nfs/dbraw/zinc/75/07/57/1043750757.db2.gz BLWTXVOVZGFYIN-QGZVFWFLSA-N 1 2 306.356 4.297 20 0 DIADLO CC(C)=CCC[C@@H](C)[NH2+]c1ccc(N2CCOC[C@H]2C)cc1 ZINC000777691818 1043756325 /nfs/dbraw/zinc/75/63/25/1043756325.db2.gz GHEFNQFCPWNVJZ-IAGOWNOFSA-N 1 2 302.462 4.459 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2csc(-c3ccccn3)n2)cc1 ZINC000261368893 1043762869 /nfs/dbraw/zinc/76/28/69/1043762869.db2.gz AEVBTGYMKJXPRE-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2csc(-c3ccccn3)n2)cc1 ZINC000261368893 1043762878 /nfs/dbraw/zinc/76/28/78/1043762878.db2.gz AEVBTGYMKJXPRE-UHFFFAOYSA-N 1 2 323.465 4.400 20 0 DIADLO CSc1cccc(N(C)Cc2cc(-n3cc[nH+]c3)cs2)c1 ZINC000355366241 1043763587 /nfs/dbraw/zinc/76/35/87/1043763587.db2.gz NEWZYLZMKXZICZ-UHFFFAOYSA-N 1 2 315.467 4.292 20 0 DIADLO CC(C)(C)OC(=O)Nc1ccc(C[NH2+]C(C)(C)C(F)F)cc1 ZINC000877489415 1043765286 /nfs/dbraw/zinc/76/52/86/1043765286.db2.gz MUANJSNDSGFWPH-UHFFFAOYSA-N 1 2 314.376 4.167 20 0 DIADLO CC(C)Cc1ccc(C[NH2+][C@@H](CF)c2ccc(F)cc2)cn1 ZINC000895853972 1043767167 /nfs/dbraw/zinc/76/71/67/1043767167.db2.gz RVHNWPPXGXPAKW-SFHVURJKSA-N 1 2 304.384 4.220 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1coc2ccc(F)cc12 ZINC001141846836 1043767427 /nfs/dbraw/zinc/76/74/27/1043767427.db2.gz NFQSNFRJGAJFAE-UHFFFAOYSA-N 1 2 310.781 4.314 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1coc2ccc(F)cc12 ZINC001141846836 1043767432 /nfs/dbraw/zinc/76/74/32/1043767432.db2.gz NFQSNFRJGAJFAE-UHFFFAOYSA-N 1 2 310.781 4.314 20 0 DIADLO CCCCc1noc(C[N@H+](CC)[C@@H](C)c2ccc(F)cc2)n1 ZINC000053088678 1043769885 /nfs/dbraw/zinc/76/98/85/1043769885.db2.gz SEJKVJLCCAUDQD-ZDUSSCGKSA-N 1 2 305.397 4.134 20 0 DIADLO CCCCc1noc(C[N@@H+](CC)[C@@H](C)c2ccc(F)cc2)n1 ZINC000053088678 1043769895 /nfs/dbraw/zinc/76/98/95/1043769895.db2.gz SEJKVJLCCAUDQD-ZDUSSCGKSA-N 1 2 305.397 4.134 20 0 DIADLO C[N@H+](Cc1cc(-c2ccco2)on1)Cc1ccc(Cl)cc1 ZINC000053094677 1043770553 /nfs/dbraw/zinc/77/05/53/1043770553.db2.gz JDUZWXUNZQBGMT-UHFFFAOYSA-N 1 2 302.761 4.220 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccco2)on1)Cc1ccc(Cl)cc1 ZINC000053094677 1043770562 /nfs/dbraw/zinc/77/05/62/1043770562.db2.gz JDUZWXUNZQBGMT-UHFFFAOYSA-N 1 2 302.761 4.220 20 0 DIADLO COc1c(C)c[nH+]c(CNc2cccc(-c3ncco3)c2C)c1C ZINC000877545047 1043772592 /nfs/dbraw/zinc/77/25/92/1043772592.db2.gz FKEIXJIDDOIGMM-UHFFFAOYSA-N 1 2 323.396 4.283 20 0 DIADLO Cc1cc(C)c(NC(=O)CSc2ccccc2C)c(C)[nH+]1 ZINC000097040090 1043780138 /nfs/dbraw/zinc/78/01/38/1043780138.db2.gz OEYDOIDVXLJPJG-UHFFFAOYSA-N 1 2 300.427 4.046 20 0 DIADLO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2nc(C(C)C)ns2)cc1 ZINC000930192566 1043780803 /nfs/dbraw/zinc/78/08/03/1043780803.db2.gz AHPYJAPVQPQVJK-ZDUSSCGKSA-N 1 2 319.474 4.300 20 0 DIADLO Cc1cc(C)c(NC(=O)c2ccc(C(F)(F)F)cc2)c(C)[nH+]1 ZINC000097039892 1043781665 /nfs/dbraw/zinc/78/16/65/1043781665.db2.gz VZQWPIUAZGULLO-UHFFFAOYSA-N 1 2 308.303 4.278 20 0 DIADLO CCCOc1cccc2c(NCc3ccc(OC)cn3)cc[nH+]c12 ZINC000355667925 1043784193 /nfs/dbraw/zinc/78/41/93/1043784193.db2.gz LJTRSLFYEFSZEB-UHFFFAOYSA-N 1 2 323.396 4.039 20 0 DIADLO CCc1ccc(C[N@@H+]2CCc3c(ncn3-c3ccccc3)C2)s1 ZINC000929066149 1043787883 /nfs/dbraw/zinc/78/78/83/1043787883.db2.gz QXBBEWDEFLJXCD-UHFFFAOYSA-N 1 2 323.465 4.055 20 0 DIADLO CCc1ccc(C[N@H+]2CCc3c(ncn3-c3ccccc3)C2)s1 ZINC000929066149 1043787895 /nfs/dbraw/zinc/78/78/95/1043787895.db2.gz QXBBEWDEFLJXCD-UHFFFAOYSA-N 1 2 323.465 4.055 20 0 DIADLO Cc1nc(C)c(C[NH2+]Cc2cc(Cl)cc(Cl)c2F)o1 ZINC000877734623 1043793500 /nfs/dbraw/zinc/79/35/00/1043793500.db2.gz BZSGQDCBJAWYIX-UHFFFAOYSA-N 1 2 303.164 4.027 20 0 DIADLO CC(C)(C)c1ccc([C@@H]2CCC[N@@H+]2Cc2nncs2)cc1 ZINC000929288551 1043808848 /nfs/dbraw/zinc/80/88/48/1043808848.db2.gz UMPSELWXBQCZCF-HNNXBMFYSA-N 1 2 301.459 4.173 20 0 DIADLO CC(C)(C)c1ccc([C@@H]2CCC[N@H+]2Cc2nncs2)cc1 ZINC000929288551 1043808865 /nfs/dbraw/zinc/80/88/65/1043808865.db2.gz UMPSELWXBQCZCF-HNNXBMFYSA-N 1 2 301.459 4.173 20 0 DIADLO c1nnc(C[NH+]2CCC(c3cccc4ccccc43)CC2)s1 ZINC000929414731 1043817904 /nfs/dbraw/zinc/81/79/04/1043817904.db2.gz HHZXZSVYVNYJFI-UHFFFAOYSA-N 1 2 309.438 4.071 20 0 DIADLO c1cn(Cc2ccc(NC3CCC4(CCCC4)CC3)nc2)c[nH+]1 ZINC000356297523 1043831144 /nfs/dbraw/zinc/83/11/44/1043831144.db2.gz JCIRJMKJXVAKEP-UHFFFAOYSA-N 1 2 310.445 4.241 20 0 DIADLO Cc1conc1C[N@@H+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000878047805 1043842789 /nfs/dbraw/zinc/84/27/89/1043842789.db2.gz UWJIZKDXILYXJF-HNNXBMFYSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1conc1C[N@H+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000878047805 1043842806 /nfs/dbraw/zinc/84/28/06/1043842806.db2.gz UWJIZKDXILYXJF-HNNXBMFYSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1ccc([C@H](C)N(C)C(=O)c2cc3c[nH+]ccc3[nH]2)c(C)c1 ZINC000929951497 1043858771 /nfs/dbraw/zinc/85/87/71/1043858771.db2.gz DCGAJAZJTJSGGX-AWEZNQCLSA-N 1 2 307.397 4.013 20 0 DIADLO C[C@@H]([NH2+]Cc1nc2c(o1)CCCC2)c1ccc(OC(F)F)cc1 ZINC000878351963 1043876125 /nfs/dbraw/zinc/87/61/25/1043876125.db2.gz XBGNXYJWLOAOJE-LLVKDONJSA-N 1 2 322.355 4.006 20 0 DIADLO Cc1nc(C[N@@H+]2CCC[C@H]2c2cccnc2)sc1C(C)(C)C ZINC000930114851 1043879200 /nfs/dbraw/zinc/87/92/00/1043879200.db2.gz KLVDDVFJYIGBEL-HNNXBMFYSA-N 1 2 315.486 4.481 20 0 DIADLO Cc1nc(C[N@H+]2CCC[C@H]2c2cccnc2)sc1C(C)(C)C ZINC000930114851 1043879220 /nfs/dbraw/zinc/87/92/20/1043879220.db2.gz KLVDDVFJYIGBEL-HNNXBMFYSA-N 1 2 315.486 4.481 20 0 DIADLO Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H](C)c3ncccn3)cc2)cs1 ZINC000930205579 1043893486 /nfs/dbraw/zinc/89/34/86/1043893486.db2.gz TYDXHLCICBDQBB-STQMWFEESA-N 1 2 324.453 4.320 20 0 DIADLO CC(C)(C)SCCC[N@@H+]1CCSC[C@@H]1c1nccs1 ZINC000878448871 1043893535 /nfs/dbraw/zinc/89/35/35/1043893535.db2.gz WOEKXDCMGKPYRE-GFCCVEGCSA-N 1 2 316.561 4.155 20 0 DIADLO CC(C)(C)SCCC[N@H+]1CCSC[C@@H]1c1nccs1 ZINC000878448871 1043893553 /nfs/dbraw/zinc/89/35/53/1043893553.db2.gz WOEKXDCMGKPYRE-GFCCVEGCSA-N 1 2 316.561 4.155 20 0 DIADLO Cn1c[nH+]cc1CN1CCCc2cc(-c3ccccc3)ccc21 ZINC000356946864 1043898035 /nfs/dbraw/zinc/89/80/35/1043898035.db2.gz LEUTXSWDRCMRBC-UHFFFAOYSA-N 1 2 303.409 4.040 20 0 DIADLO Cc1cnc([C@@H](C)[N@H+](C)Cc2ccc(OC(F)(F)F)cc2)o1 ZINC000356970408 1043901046 /nfs/dbraw/zinc/90/10/46/1043901046.db2.gz DIBLWSVLXKEAPI-LLVKDONJSA-N 1 2 314.307 4.075 20 0 DIADLO Cc1cnc([C@@H](C)[N@@H+](C)Cc2ccc(OC(F)(F)F)cc2)o1 ZINC000356970408 1043901054 /nfs/dbraw/zinc/90/10/54/1043901054.db2.gz DIBLWSVLXKEAPI-LLVKDONJSA-N 1 2 314.307 4.075 20 0 DIADLO Cc1csc([C@H]([NH2+]Cc2c(F)ccc(C)c2F)C2CC2)n1 ZINC000930236403 1043901518 /nfs/dbraw/zinc/90/15/18/1043901518.db2.gz AXIOMRYEOWOGFB-OAHLLOKOSA-N 1 2 308.397 4.279 20 0 DIADLO CC(C)(C)[N@H+](Cc1ncn(-c2ccccc2)n1)Cc1ccccc1 ZINC000356996701 1043905239 /nfs/dbraw/zinc/90/52/39/1043905239.db2.gz HOQKMRFFNJGFJM-UHFFFAOYSA-N 1 2 320.440 4.068 20 0 DIADLO CC(C)(C)[N@@H+](Cc1ncn(-c2ccccc2)n1)Cc1ccccc1 ZINC000356996701 1043905246 /nfs/dbraw/zinc/90/52/46/1043905246.db2.gz HOQKMRFFNJGFJM-UHFFFAOYSA-N 1 2 320.440 4.068 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(-c3cccs3)n2)CCC1(F)F ZINC000290007347 1043907244 /nfs/dbraw/zinc/90/72/44/1043907244.db2.gz ZNQIDVZFPVOULX-JTQLQIEISA-N 1 2 314.426 4.349 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(-c3cccs3)n2)CCC1(F)F ZINC000290007347 1043907249 /nfs/dbraw/zinc/90/72/49/1043907249.db2.gz ZNQIDVZFPVOULX-JTQLQIEISA-N 1 2 314.426 4.349 20 0 DIADLO CSc1ccccc1[C@@H](C)[NH2+]Cc1nc(C(C)C)ns1 ZINC000930332797 1043914352 /nfs/dbraw/zinc/91/43/52/1043914352.db2.gz MNAATUDNUZWYSJ-LLVKDONJSA-N 1 2 307.488 4.234 20 0 DIADLO COc1ccccc1C1([NH2+]Cc2cc(C(F)(F)F)co2)CC1 ZINC000878759097 1043917123 /nfs/dbraw/zinc/91/71/23/1043917123.db2.gz IFLOYBIEPSBQIJ-UHFFFAOYSA-N 1 2 311.303 4.086 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncccc1Br)c1ccccc1F ZINC000878843874 1043922357 /nfs/dbraw/zinc/92/23/57/1043922357.db2.gz LDROPJKAFJRIHY-CQSZACIVSA-N 1 2 323.209 4.224 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccc(F)cc1F ZINC000102689661 1043926525 /nfs/dbraw/zinc/92/65/25/1043926525.db2.gz KCCYTDLVBBMKEG-GFCCVEGCSA-N 1 2 314.335 4.471 20 0 DIADLO c1nc(C2CCCCC2)sc1C[N@@H+]1CCOC2(CCCC2)C1 ZINC000561316096 1043926849 /nfs/dbraw/zinc/92/68/49/1043926849.db2.gz XIKUXQBNFAJUKP-UHFFFAOYSA-N 1 2 320.502 4.336 20 0 DIADLO c1nc(C2CCCCC2)sc1C[N@H+]1CCOC2(CCCC2)C1 ZINC000561316096 1043926855 /nfs/dbraw/zinc/92/68/55/1043926855.db2.gz XIKUXQBNFAJUKP-UHFFFAOYSA-N 1 2 320.502 4.336 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1nc(-c2ccccc2)cs1 ZINC000357219874 1043931265 /nfs/dbraw/zinc/93/12/65/1043931265.db2.gz ZPSMHULDALQDDK-CQSZACIVSA-N 1 2 309.438 4.398 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1nc(-c2ccccc2)cs1 ZINC000357219874 1043931269 /nfs/dbraw/zinc/93/12/69/1043931269.db2.gz ZPSMHULDALQDDK-CQSZACIVSA-N 1 2 309.438 4.398 20 0 DIADLO FC(F)O[C@@H]1CCC[C@H]1Nc1cc[nH+]c2c(Cl)cccc12 ZINC000561346211 1043931954 /nfs/dbraw/zinc/93/19/54/1043931954.db2.gz IJDYEMQEIZSBSI-CHWSQXEVSA-N 1 2 312.747 4.460 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+](C)Cc1nc(-c2ccoc2)no1 ZINC000357266379 1043933342 /nfs/dbraw/zinc/93/33/42/1043933342.db2.gz HOEYAXCNQNJNMD-NSHDSACASA-N 1 2 317.776 4.176 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1nc(-c2ccoc2)no1 ZINC000357266379 1043933349 /nfs/dbraw/zinc/93/33/49/1043933349.db2.gz HOEYAXCNQNJNMD-NSHDSACASA-N 1 2 317.776 4.176 20 0 DIADLO CC12CC(C1)C[N@@H+]2Cc1noc(-c2cccc(Cl)c2Cl)n1 ZINC000879008566 1043935618 /nfs/dbraw/zinc/93/56/18/1043935618.db2.gz HNIBVJPRDSPHLV-UHFFFAOYSA-N 1 2 324.211 4.028 20 0 DIADLO CC12CC(C1)C[N@H+]2Cc1noc(-c2cccc(Cl)c2Cl)n1 ZINC000879008566 1043935626 /nfs/dbraw/zinc/93/56/26/1043935626.db2.gz HNIBVJPRDSPHLV-UHFFFAOYSA-N 1 2 324.211 4.028 20 0 DIADLO Cc1nc(N2CC[C@@H]2c2ccc(Cl)cc2)c2c([nH+]1)CCCC2 ZINC000561357462 1043935959 /nfs/dbraw/zinc/93/59/59/1043935959.db2.gz CHLJELHZVXAJDG-QGZVFWFLSA-N 1 2 313.832 4.269 20 0 DIADLO O=C(c1ccc(C2CCCC2)cc1)N1CCC(n2cc[nH+]c2)CC1 ZINC000290357065 1043942036 /nfs/dbraw/zinc/94/20/36/1043942036.db2.gz JGWGGAVHIMWFTF-UHFFFAOYSA-N 1 2 323.440 4.018 20 0 DIADLO CC(C)c1nsc(C[NH2+][C@H](C)c2cccc(C3CC3)c2)n1 ZINC000930594778 1043945747 /nfs/dbraw/zinc/94/57/47/1043945747.db2.gz PTVDMCNYIGKBPS-GFCCVEGCSA-N 1 2 301.459 4.390 20 0 DIADLO CC(C)c1nsc(C[NH2+][C@@H](C)c2cccc(C3CC3)c2)n1 ZINC000930594779 1043946235 /nfs/dbraw/zinc/94/62/35/1043946235.db2.gz PTVDMCNYIGKBPS-LBPRGKRZSA-N 1 2 301.459 4.390 20 0 DIADLO Cc1ccc(C[S@@](=O)c2ccc(Cl)c(Cl)c2)c(C)[nH+]1 ZINC000357836289 1043993978 /nfs/dbraw/zinc/99/39/78/1043993978.db2.gz MJJVNDRLMWEJIE-LJQANCHMSA-N 1 2 314.237 4.313 20 0 DIADLO C/C(=C\c1ccccc1OC(F)F)C[N@@H+](C)Cc1nccs1 ZINC000290402931 1043946571 /nfs/dbraw/zinc/94/65/71/1043946571.db2.gz KNSULCLMYCNECA-FMIVXFBMSA-N 1 2 324.396 4.280 20 0 DIADLO C/C(=C\c1ccccc1OC(F)F)C[N@H+](C)Cc1nccs1 ZINC000290402931 1043946587 /nfs/dbraw/zinc/94/65/87/1043946587.db2.gz KNSULCLMYCNECA-FMIVXFBMSA-N 1 2 324.396 4.280 20 0 DIADLO CC(C)CCO[C@@H]1CC[N@H+](Cc2ccnc(Cl)c2Cl)C1 ZINC000828087106 1043947960 /nfs/dbraw/zinc/94/79/60/1043947960.db2.gz DEQROLUWCINZSZ-CYBMUJFWSA-N 1 2 317.260 4.025 20 0 DIADLO CC(C)CCO[C@@H]1CC[N@@H+](Cc2ccnc(Cl)c2Cl)C1 ZINC000828087106 1043947968 /nfs/dbraw/zinc/94/79/68/1043947968.db2.gz DEQROLUWCINZSZ-CYBMUJFWSA-N 1 2 317.260 4.025 20 0 DIADLO CC(C)([NH2+]Cc1cccc(F)n1)c1nc2cc(Cl)ccc2o1 ZINC000879160021 1043948172 /nfs/dbraw/zinc/94/81/72/1043948172.db2.gz NXHNYEGKDFCBFY-UHFFFAOYSA-N 1 2 319.767 4.040 20 0 DIADLO CCc1nc(N2CCCC[C@H]2c2nc3ccccc3o2)cc(C)[nH+]1 ZINC000329177641 1043950220 /nfs/dbraw/zinc/95/02/20/1043950220.db2.gz CFZKRVRPQPMBTM-HNNXBMFYSA-N 1 2 322.412 4.220 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2cnsn2)C2CCCCC2)cc1 ZINC000879285248 1043954730 /nfs/dbraw/zinc/95/47/30/1043954730.db2.gz SDDFTCKDEIZBJV-MRXNPFEDSA-N 1 2 305.422 4.088 20 0 DIADLO Fc1ccc([C@@H]([NH2+]Cc2cnsn2)C2CCCCC2)cc1 ZINC000879285247 1043954925 /nfs/dbraw/zinc/95/49/25/1043954925.db2.gz SDDFTCKDEIZBJV-INIZCTEOSA-N 1 2 305.422 4.088 20 0 DIADLO C/C(=C\c1ccccc1OC(F)F)C[N@@H+](C)Cc1cc(C)on1 ZINC000290521720 1043960439 /nfs/dbraw/zinc/96/04/39/1043960439.db2.gz URPBNNQZXLEIBF-XYOKQWHBSA-N 1 2 322.355 4.120 20 0 DIADLO C/C(=C\c1ccccc1OC(F)F)C[N@H+](C)Cc1cc(C)on1 ZINC000290521720 1043960447 /nfs/dbraw/zinc/96/04/47/1043960447.db2.gz URPBNNQZXLEIBF-XYOKQWHBSA-N 1 2 322.355 4.120 20 0 DIADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1cc(C)on1 ZINC000290578355 1043964616 /nfs/dbraw/zinc/96/46/16/1043964616.db2.gz FSKIGPWMBAQYML-ZFWWWQNUSA-N 1 2 302.418 4.320 20 0 DIADLO Cc1csc(C[C@H]2CCN(c3[nH+]ccc4ccccc43)C2)n1 ZINC000896621002 1043966439 /nfs/dbraw/zinc/96/64/39/1043966439.db2.gz NKKUIQNRWPCWFF-CQSZACIVSA-N 1 2 309.438 4.069 20 0 DIADLO O=C(c1ccc(C2CCCC2)cc1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000290627935 1043969470 /nfs/dbraw/zinc/96/94/70/1043969470.db2.gz QMTWMVKPEANWED-UHFFFAOYSA-N 1 2 323.440 4.087 20 0 DIADLO CCC(CC)n1ccc(C[N@H+](Cc2cccnc2)C(C)C)n1 ZINC000357612385 1043969720 /nfs/dbraw/zinc/96/97/20/1043969720.db2.gz ZXHJSTGGCKSMNO-UHFFFAOYSA-N 1 2 300.450 4.050 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+](Cc2cccnc2)C(C)C)n1 ZINC000357612385 1043969729 /nfs/dbraw/zinc/96/97/29/1043969729.db2.gz ZXHJSTGGCKSMNO-UHFFFAOYSA-N 1 2 300.450 4.050 20 0 DIADLO COc1cccc(C[NH2+][C@@H](Cc2ccccc2)c2ncco2)c1C ZINC000930894536 1043972825 /nfs/dbraw/zinc/97/28/25/1043972825.db2.gz LYFXMXVUORBURK-SFHVURJKSA-N 1 2 322.408 4.065 20 0 DIADLO C/C=C\c1ccc(NC(=O)c2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC000561647168 1043982495 /nfs/dbraw/zinc/98/24/95/1043982495.db2.gz JBIHKSSMQLVSQU-IHWYPQMZSA-N 1 2 317.392 4.217 20 0 DIADLO CCCc1nc(C[NH2+][C@H](C)c2cc3cnccc3o2)cs1 ZINC000879714794 1043982935 /nfs/dbraw/zinc/98/29/35/1043982935.db2.gz ZCIHKVLFZJYOSV-LLVKDONJSA-N 1 2 301.415 4.088 20 0 DIADLO COc1cccc(C2([NH2+]Cc3coc(C(C)(C)C)n3)CCC2)c1 ZINC000931064875 1043987387 /nfs/dbraw/zinc/98/73/87/1043987387.db2.gz ZISBGRQFGHTOKD-UHFFFAOYSA-N 1 2 314.429 4.150 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccc(Br)nc1 ZINC000290821974 1043990920 /nfs/dbraw/zinc/99/09/20/1043990920.db2.gz WZJGFDAROHUIDA-LLVKDONJSA-N 1 2 320.234 4.083 20 0 DIADLO C[C@@H]([C@H](C)[NH2+][C@H](c1nnc[nH]1)c1ccccc1)C1CCCCC1 ZINC000474937963 1043991509 /nfs/dbraw/zinc/99/15/09/1043991509.db2.gz CBWMCQMOFCHQOL-MPGHIAIKSA-N 1 2 312.461 4.089 20 0 DIADLO CC(C)C[C@@H]1CCC[C@H]([NH2+][C@@H](c2nnc[nH]2)c2ccccc2)C1 ZINC000474937949 1043991645 /nfs/dbraw/zinc/99/16/45/1043991645.db2.gz BWUYJBPXPJGFLJ-RYQLBKOJSA-N 1 2 312.461 4.089 20 0 DIADLO Cn1c2ccccc2nc1[C@H]1CCCC[N@@H+]1Cc1ccccc1F ZINC000561739336 1043998739 /nfs/dbraw/zinc/99/87/39/1043998739.db2.gz GSJQLIVOIHZYOL-LJQANCHMSA-N 1 2 323.415 4.440 20 0 DIADLO Cn1c2ccccc2nc1[C@H]1CCCC[N@H+]1Cc1ccccc1F ZINC000561739336 1043998742 /nfs/dbraw/zinc/99/87/42/1043998742.db2.gz GSJQLIVOIHZYOL-LJQANCHMSA-N 1 2 323.415 4.440 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H]2CCCOc3ccc(F)cc32)cs1 ZINC000358027140 1044008949 /nfs/dbraw/zinc/00/89/49/1044008949.db2.gz VYMIHJKCBWESNB-YGRLFVJLSA-N 1 2 306.406 4.155 20 0 DIADLO Fc1cc(C[N@@H+]2CCC3(CCC3)C2)c(F)cc1Br ZINC001141915416 1044011996 /nfs/dbraw/zinc/01/19/96/1044011996.db2.gz AIJTXOBFRCKRQL-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Fc1cc(C[N@H+]2CCC3(CCC3)C2)c(F)cc1Br ZINC001141915416 1044012004 /nfs/dbraw/zinc/01/20/04/1044012004.db2.gz AIJTXOBFRCKRQL-UHFFFAOYSA-N 1 2 316.189 4.103 20 0 DIADLO Cc1nc([C@H](C)[NH2+]Cc2ccccc2OC2CCC2)cs1 ZINC000358054932 1044012817 /nfs/dbraw/zinc/01/28/17/1044012817.db2.gz AROJPGDERHVGQO-LBPRGKRZSA-N 1 2 302.443 4.234 20 0 DIADLO CC(C)c1cccc(C(C)C)c1NC(=O)C[NH+]1CCC(F)CC1 ZINC000880242861 1044023955 /nfs/dbraw/zinc/02/39/55/1044023955.db2.gz OGVQTUVKVRHDDR-UHFFFAOYSA-N 1 2 320.452 4.306 20 0 DIADLO Cc1ccc(C[S@](=O)CC[C@H]2C[C@H](C)C[C@H](C)C2)c(C)[nH+]1 ZINC000358159107 1044027105 /nfs/dbraw/zinc/02/71/05/1044027105.db2.gz YBAVRQDIHGBEFB-QJPIZNMWSA-N 1 2 307.503 4.410 20 0 DIADLO C[C@H]([NH2+][C@H](c1cccc(F)c1)c1ccccn1)c1cncs1 ZINC000358260949 1044042831 /nfs/dbraw/zinc/04/28/31/1044042831.db2.gz CCSVVGVLJKUZFJ-YVEFUNNKSA-N 1 2 313.401 4.117 20 0 DIADLO FC(F)[C@@H]([NH2+]CCC[C@@H]1CCOC1)c1cccc(Cl)c1 ZINC000880534676 1044046917 /nfs/dbraw/zinc/04/69/17/1044046917.db2.gz UHXWOGOWRCXZGT-RISCZKNCSA-N 1 2 303.780 4.053 20 0 DIADLO Cc1ccc(C[C@@H]2CCCN2c2cc(C)[nH+]c(C3CC3)n2)cc1 ZINC000522568937 1044046903 /nfs/dbraw/zinc/04/69/03/1044046903.db2.gz QKRIVKCOXCKDLW-SFHVURJKSA-N 1 2 307.441 4.182 20 0 DIADLO CCc1nnc(C[N@H+](Cc2ccccc2)[C@H](C)c2ccccc2)o1 ZINC000291259336 1044048431 /nfs/dbraw/zinc/04/84/31/1044048431.db2.gz WTXVSFCRHTYBHQ-MRXNPFEDSA-N 1 2 321.424 4.395 20 0 DIADLO CCc1nnc(C[N@@H+](Cc2ccccc2)[C@H](C)c2ccccc2)o1 ZINC000291259336 1044048444 /nfs/dbraw/zinc/04/84/44/1044048444.db2.gz WTXVSFCRHTYBHQ-MRXNPFEDSA-N 1 2 321.424 4.395 20 0 DIADLO COc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1ccc(F)c(F)c1)C2 ZINC000562060947 1044058273 /nfs/dbraw/zinc/05/82/73/1044058273.db2.gz BEQUIUFCXOEANU-UHFFFAOYSA-N 1 2 315.363 4.021 20 0 DIADLO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1ccc(F)c(F)c1)C2 ZINC000562060947 1044058284 /nfs/dbraw/zinc/05/82/84/1044058284.db2.gz BEQUIUFCXOEANU-UHFFFAOYSA-N 1 2 315.363 4.021 20 0 DIADLO CC(C)n1ccc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)n1 ZINC000522664519 1044062105 /nfs/dbraw/zinc/06/21/05/1044062105.db2.gz UEIGQMXIHJLLMY-KRWDZBQOSA-N 1 2 303.837 4.455 20 0 DIADLO CC(C)n1ccc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)n1 ZINC000522664519 1044062115 /nfs/dbraw/zinc/06/21/15/1044062115.db2.gz UEIGQMXIHJLLMY-KRWDZBQOSA-N 1 2 303.837 4.455 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1csc(-c2ccccc2F)n1 ZINC000291383510 1044068362 /nfs/dbraw/zinc/06/83/62/1044068362.db2.gz ZPVHCWLVTDSVKC-WDEREUQCSA-N 1 2 316.405 4.084 20 0 DIADLO c1cc2cccc3c2c(c1)CC[C@@H]3[NH2+]Cc1nc(C2CCC2)no1 ZINC000931810308 1044074612 /nfs/dbraw/zinc/07/46/12/1044074612.db2.gz ZDLKAZQIEUVTOA-KRWDZBQOSA-N 1 2 319.408 4.267 20 0 DIADLO CC[N@H+](Cc1ccnc(Cl)c1Cl)[C@H](C)c1cccnc1 ZINC000291508878 1044079369 /nfs/dbraw/zinc/07/93/69/1044079369.db2.gz IDBANTUZOGSGCV-LLVKDONJSA-N 1 2 310.228 4.367 20 0 DIADLO CC[N@@H+](Cc1ccnc(Cl)c1Cl)[C@H](C)c1cccnc1 ZINC000291508878 1044079380 /nfs/dbraw/zinc/07/93/80/1044079380.db2.gz IDBANTUZOGSGCV-LLVKDONJSA-N 1 2 310.228 4.367 20 0 DIADLO Cc1nnc(C[N@@H+](C)Cc2ccccc2-c2ccccc2)s1 ZINC000358514386 1044080145 /nfs/dbraw/zinc/08/01/45/1044080145.db2.gz WLXWGCDZXWIKBX-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1nnc(C[N@H+](C)Cc2ccccc2-c2ccccc2)s1 ZINC000358514386 1044080160 /nfs/dbraw/zinc/08/01/60/1044080160.db2.gz WLXWGCDZXWIKBX-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1ccc(C2CCC2)cc1 ZINC000358636358 1044087606 /nfs/dbraw/zinc/08/76/06/1044087606.db2.gz PXTHEHXYMVWNOR-UHFFFAOYSA-N 1 2 317.392 4.392 20 0 DIADLO C[C@H]1CCSCC[N@@H+]1Cc1c(F)cccc1OC(F)(F)F ZINC001308687135 1044087779 /nfs/dbraw/zinc/08/77/79/1044087779.db2.gz HRFZIMUUCVKDEX-JTQLQIEISA-N 1 2 323.355 4.052 20 0 DIADLO C[C@H]1CCSCC[N@H+]1Cc1c(F)cccc1OC(F)(F)F ZINC001308687135 1044087793 /nfs/dbraw/zinc/08/77/93/1044087793.db2.gz HRFZIMUUCVKDEX-JTQLQIEISA-N 1 2 323.355 4.052 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ccnc(Cl)c1Cl ZINC000291668563 1044093021 /nfs/dbraw/zinc/09/30/21/1044093021.db2.gz WBDDVZAWHIROOS-XPTSAGLGSA-N 1 2 309.196 4.000 20 0 DIADLO FC(F)(F)C[C@H]1CC[N@H+](Cc2ccnc(Cl)c2Cl)C1 ZINC000291690105 1044094709 /nfs/dbraw/zinc/09/47/09/1044094709.db2.gz XZWMTRUKWATXBC-MRVPVSSYSA-N 1 2 313.150 4.163 20 0 DIADLO FC(F)(F)C[C@H]1CC[N@@H+](Cc2ccnc(Cl)c2Cl)C1 ZINC000291690105 1044094724 /nfs/dbraw/zinc/09/47/24/1044094724.db2.gz XZWMTRUKWATXBC-MRVPVSSYSA-N 1 2 313.150 4.163 20 0 DIADLO O=C(/C=C\c1ccccc1Cl)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC000881024936 1044095969 /nfs/dbraw/zinc/09/59/69/1044095969.db2.gz PTEDLAREENKQDH-YHYXMXQVSA-N 1 2 323.783 4.178 20 0 DIADLO CC(C)[N@@H+](Cc1cc(-c2cccs2)on1)Cc1ccco1 ZINC000346384025 1044097277 /nfs/dbraw/zinc/09/72/77/1044097277.db2.gz OWBMLOJFYRZCSL-UHFFFAOYSA-N 1 2 302.399 4.407 20 0 DIADLO CC(C)[N@H+](Cc1cc(-c2cccs2)on1)Cc1ccco1 ZINC000346384025 1044097294 /nfs/dbraw/zinc/09/72/94/1044097294.db2.gz OWBMLOJFYRZCSL-UHFFFAOYSA-N 1 2 302.399 4.407 20 0 DIADLO Cc1ccc(CSc2nc3cc(F)c(F)cc3[nH]2)c(C)[nH+]1 ZINC000358869518 1044107611 /nfs/dbraw/zinc/10/76/11/1044107611.db2.gz XYPXCDMPYCWTCT-UHFFFAOYSA-N 1 2 305.353 4.145 20 0 DIADLO Cc1ccsc1[C@H](CO)[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000346517204 1044110791 /nfs/dbraw/zinc/11/07/91/1044110791.db2.gz DDNPGKACOXLJSW-NEPJUHHUSA-N 1 2 310.488 4.021 20 0 DIADLO c1ccc2c(c1)OC1(CCC1)C[C@@H]2[NH2+]Cc1noc2c1CCCC2 ZINC000932215520 1044110822 /nfs/dbraw/zinc/11/08/22/1044110822.db2.gz JCIUSASVWGNPGR-INIZCTEOSA-N 1 2 324.424 4.090 20 0 DIADLO Clc1nc(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)cs1 ZINC000932214076 1044110940 /nfs/dbraw/zinc/11/09/40/1044110940.db2.gz HAUVOGHYOSYABC-ZDUSSCGKSA-N 1 2 320.845 4.333 20 0 DIADLO Cc1cc(N(C)Cc2c(F)cccc2Cl)nc(C2CC2)[nH+]1 ZINC000346641050 1044126563 /nfs/dbraw/zinc/12/65/63/1044126563.db2.gz WCWRJIJRCVUDMT-UHFFFAOYSA-N 1 2 305.784 4.091 20 0 DIADLO CC(C)([NH2+]Cc1nc(C(F)(F)F)cs1)c1ccccc1F ZINC000292078743 1044133929 /nfs/dbraw/zinc/13/39/29/1044133929.db2.gz FKHVQDYAQBZXEW-UHFFFAOYSA-N 1 2 318.339 4.326 20 0 DIADLO Brc1cccc(C[N@@H+]2CCC[C@@H]2c2ccsc2)n1 ZINC000292224309 1044150539 /nfs/dbraw/zinc/15/05/39/1044150539.db2.gz QYOFQKTZDOVAST-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cccc(C[N@H+]2CCC[C@@H]2c2ccsc2)n1 ZINC000292224309 1044150543 /nfs/dbraw/zinc/15/05/43/1044150543.db2.gz QYOFQKTZDOVAST-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO C[C@@H](c1noc(-c2ccccc2)n1)[NH+]1CCC(F)(C2CC2)CC1 ZINC000932626598 1044150489 /nfs/dbraw/zinc/15/04/89/1044150489.db2.gz KJTGQPLHQAJLLH-ZDUSSCGKSA-N 1 2 315.392 4.012 20 0 DIADLO c1[nH+]c(-c2cccc(N[C@H]3CCCSC3)c2)n2c1CCCC2 ZINC000444014915 1044155051 /nfs/dbraw/zinc/15/50/51/1044155051.db2.gz RWCNQESKUPDALF-INIZCTEOSA-N 1 2 313.470 4.194 20 0 DIADLO CCSCc1cc[nH+]c(NCc2cc(F)ccc2OC)c1 ZINC000359470196 1044170991 /nfs/dbraw/zinc/17/09/91/1044170991.db2.gz UJXVWVZAIWPDDY-UHFFFAOYSA-N 1 2 306.406 4.095 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(F)c(C(F)(F)F)cc1F)c1ccccn1 ZINC000346939316 1044173487 /nfs/dbraw/zinc/17/34/87/1044173487.db2.gz HUMLYEJKYYSJFX-SECBINFHSA-N 1 2 316.273 4.229 20 0 DIADLO CC(C)n1cnnc1C[N@H+](C)C1c2ccccc2-c2ccccc21 ZINC000292449240 1044173635 /nfs/dbraw/zinc/17/36/35/1044173635.db2.gz PFVVXMQPNHTAJX-UHFFFAOYSA-N 1 2 318.424 4.061 20 0 DIADLO CC(C)n1cnnc1C[N@@H+](C)C1c2ccccc2-c2ccccc21 ZINC000292449240 1044173641 /nfs/dbraw/zinc/17/36/41/1044173641.db2.gz PFVVXMQPNHTAJX-UHFFFAOYSA-N 1 2 318.424 4.061 20 0 DIADLO Cc1cc(C)c(NC(=O)NC[C@@H](c2ccccc2)C2CC2)c(C)[nH+]1 ZINC000562892523 1044176618 /nfs/dbraw/zinc/17/66/18/1044176618.db2.gz GEFVIDAKXAXXFA-SFHVURJKSA-N 1 2 323.440 4.322 20 0 DIADLO c1oc(-c2ccccc2)nc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000346966952 1044177907 /nfs/dbraw/zinc/17/79/07/1044177907.db2.gz KFDXZDAUQZADHQ-SFHVURJKSA-N 1 2 305.381 4.074 20 0 DIADLO c1oc(-c2ccccc2)nc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000346966952 1044177910 /nfs/dbraw/zinc/17/79/10/1044177910.db2.gz KFDXZDAUQZADHQ-SFHVURJKSA-N 1 2 305.381 4.074 20 0 DIADLO C[C@@H]1CC[C@]2(CC[N@H+](Cc3noc(C4CCCCC4)n3)C2)C1 ZINC000359570592 1044179080 /nfs/dbraw/zinc/17/90/80/1044179080.db2.gz ZWNDSPKTIZTSQS-KDOFPFPSSA-N 1 2 303.450 4.129 20 0 DIADLO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3noc(C4CCCCC4)n3)C2)C1 ZINC000359570592 1044179082 /nfs/dbraw/zinc/17/90/82/1044179082.db2.gz ZWNDSPKTIZTSQS-KDOFPFPSSA-N 1 2 303.450 4.129 20 0 DIADLO COc1nc(C)cc(C)c1C[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000346981498 1044180213 /nfs/dbraw/zinc/18/02/13/1044180213.db2.gz LZZRTXMIPZYKEF-CQSZACIVSA-N 1 2 300.402 4.026 20 0 DIADLO COc1nc(C)cc(C)c1C[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000346981498 1044180218 /nfs/dbraw/zinc/18/02/18/1044180218.db2.gz LZZRTXMIPZYKEF-CQSZACIVSA-N 1 2 300.402 4.026 20 0 DIADLO COc1nc(C)cc(C)c1C[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000346981492 1044180763 /nfs/dbraw/zinc/18/07/63/1044180763.db2.gz LZZRTXMIPZYKEF-AWEZNQCLSA-N 1 2 300.402 4.026 20 0 DIADLO COc1nc(C)cc(C)c1C[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000346981492 1044180768 /nfs/dbraw/zinc/18/07/68/1044180768.db2.gz LZZRTXMIPZYKEF-AWEZNQCLSA-N 1 2 300.402 4.026 20 0 DIADLO Brc1cc(C[N@@H+]2CCC[C@@H]2c2cccnc2)cs1 ZINC000346996323 1044182255 /nfs/dbraw/zinc/18/22/55/1044182255.db2.gz LQMSGPHHTJTMIS-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1cc(C[N@H+]2CCC[C@@H]2c2cccnc2)cs1 ZINC000346996323 1044182262 /nfs/dbraw/zinc/18/22/62/1044182262.db2.gz LQMSGPHHTJTMIS-CYBMUJFWSA-N 1 2 323.259 4.243 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](CC)Cc2ccccc2)cs1 ZINC000347042439 1044189130 /nfs/dbraw/zinc/18/91/30/1044189130.db2.gz LLVMOBIMPQUAEG-CQSZACIVSA-N 1 2 304.459 4.263 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](CC)Cc2ccccc2)cs1 ZINC000347042439 1044189135 /nfs/dbraw/zinc/18/91/35/1044189135.db2.gz LLVMOBIMPQUAEG-CQSZACIVSA-N 1 2 304.459 4.263 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nccn1C)c1ccc(F)cc1)c1cccs1 ZINC000359729125 1044194295 /nfs/dbraw/zinc/19/42/95/1044194295.db2.gz JPLVFJWQBQUUOE-WBMJQRKESA-N 1 2 315.417 4.061 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncc(C(C)(C)C)o1)c1ccc2c(c1)CCO2 ZINC000933491719 1044199390 /nfs/dbraw/zinc/19/93/90/1044199390.db2.gz RYIDBIJVEYFEAJ-OLZOCXBDSA-N 1 2 314.429 4.319 20 0 DIADLO CC(C)COC[C@@H]([NH2+]Cc1cccc(Cl)c1N)c1ccco1 ZINC000882951768 1044207027 /nfs/dbraw/zinc/20/70/27/1044207027.db2.gz UFKUBDNDYZEBQS-OAHLLOKOSA-N 1 2 322.836 4.019 20 0 DIADLO COc1cccc2c(NCc3ccc4ncccc4c3)cc[nH+]c12 ZINC000359879400 1044210672 /nfs/dbraw/zinc/21/06/72/1044210672.db2.gz QQVYJCSTYWEIKK-UHFFFAOYSA-N 1 2 315.376 4.404 20 0 DIADLO CC[N@H+](C)[C@H](c1nc([C@H]2CCC(F)(F)C2)no1)c1ccccc1 ZINC000347264998 1044218256 /nfs/dbraw/zinc/21/82/56/1044218256.db2.gz NWYKOWMCDRGZJT-KBPBESRZSA-N 1 2 321.371 4.014 20 0 DIADLO CC[N@@H+](C)[C@H](c1nc([C@H]2CCC(F)(F)C2)no1)c1ccccc1 ZINC000347264998 1044218262 /nfs/dbraw/zinc/21/82/62/1044218262.db2.gz NWYKOWMCDRGZJT-KBPBESRZSA-N 1 2 321.371 4.014 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+](Cc2ccoc2)C2CC2)s1 ZINC000934001364 1044222687 /nfs/dbraw/zinc/22/26/87/1044222687.db2.gz BMLUBVCRVYEKJD-UHFFFAOYSA-N 1 2 316.348 4.228 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+](Cc2ccoc2)C2CC2)s1 ZINC000934001364 1044222700 /nfs/dbraw/zinc/22/27/00/1044222700.db2.gz BMLUBVCRVYEKJD-UHFFFAOYSA-N 1 2 316.348 4.228 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1nnc(C(C)C)[nH]1)c1sccc1Cl ZINC000883208319 1044235006 /nfs/dbraw/zinc/23/50/06/1044235006.db2.gz DBNJLJSJZKTISI-GXSJLCMTSA-N 1 2 312.870 4.445 20 0 DIADLO CN(C)c1ccccc1C[N@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000563287220 1044245202 /nfs/dbraw/zinc/24/52/02/1044245202.db2.gz SGQSDOIFXFUYGQ-UHFFFAOYSA-N 1 2 321.424 4.040 20 0 DIADLO CN(C)c1ccccc1C[N@@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000563287220 1044245208 /nfs/dbraw/zinc/24/52/08/1044245208.db2.gz SGQSDOIFXFUYGQ-UHFFFAOYSA-N 1 2 321.424 4.040 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)C[N@H+]2C[C@@H](C)[C@H]2C)cc1 ZINC000563320571 1044247756 /nfs/dbraw/zinc/24/77/56/1044247756.db2.gz OJEMPTROGPDRKJ-HZPDHXFCSA-N 1 2 324.424 4.066 20 0 DIADLO Cc1ccc(Oc2ccccc2NC(=O)C[N@@H+]2C[C@@H](C)[C@H]2C)cc1 ZINC000563320571 1044247776 /nfs/dbraw/zinc/24/77/76/1044247776.db2.gz OJEMPTROGPDRKJ-HZPDHXFCSA-N 1 2 324.424 4.066 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccc(Cl)cc2OC(C)C)cs1 ZINC000883259256 1044251447 /nfs/dbraw/zinc/25/14/47/1044251447.db2.gz HQGWIAFOJNEMEA-UHFFFAOYSA-N 1 2 310.850 4.182 20 0 DIADLO CC(C)Oc1cc(Cl)ccc1C[NH2+][C@@H]1C[C@H](C)n2ccnc21 ZINC000883267619 1044254449 /nfs/dbraw/zinc/25/44/49/1044254449.db2.gz LFFPNKDCRBEUJS-SWLSCSKDSA-N 1 2 319.836 4.119 20 0 DIADLO CCOc1cccc(Cl)c1C[NH2+][C@@H](C)c1cncc(F)c1 ZINC000563364366 1044255133 /nfs/dbraw/zinc/25/51/33/1044255133.db2.gz HMVWHNKXJSNACD-NSHDSACASA-N 1 2 308.784 4.124 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCn2ccnc21)c1cc(Cl)ccc1Cl ZINC000655704145 1044258993 /nfs/dbraw/zinc/25/89/93/1044258993.db2.gz QSOXPULAMUTYEV-QMTHXVAHSA-N 1 2 310.228 4.376 20 0 DIADLO COc1cc([C@H](C)[NH2+][C@@H](C)c2ncccn2)cc2ccccc21 ZINC000934629625 1044263664 /nfs/dbraw/zinc/26/36/64/1044263664.db2.gz FROLAHSJJDXTLQ-KBPBESRZSA-N 1 2 307.397 4.050 20 0 DIADLO C[C@H]([NH2+]C1(c2ncccn2)CCC1)c1ccc(C(F)(F)F)cc1 ZINC000883313517 1044264675 /nfs/dbraw/zinc/26/46/75/1044264675.db2.gz GDGXEXJABDVHSB-LBPRGKRZSA-N 1 2 321.346 4.225 20 0 DIADLO Cc1cn2cc(NC(=O)c3cc(Cl)ccc3Cl)ccc2[nH+]1 ZINC000522996038 1044265678 /nfs/dbraw/zinc/26/56/78/1044265678.db2.gz ASQKLMKUOMVCTK-UHFFFAOYSA-N 1 2 320.179 4.202 20 0 DIADLO COc1cccc2c1OCCC[C@@H]2[NH2+][C@@H](C)c1csc(C)n1 ZINC000883330273 1044277283 /nfs/dbraw/zinc/27/72/83/1044277283.db2.gz BHAIAECKTVNOAV-FZMZJTMJSA-N 1 2 318.442 4.025 20 0 DIADLO COc1cccc2c1OCCC[C@H]2[NH2+][C@H](C)c1csc(C)n1 ZINC000883330272 1044277392 /nfs/dbraw/zinc/27/73/92/1044277392.db2.gz BHAIAECKTVNOAV-BXUZGUMPSA-N 1 2 318.442 4.025 20 0 DIADLO Cc1cc(N[C@@H](C)c2cncc(Br)c2)c[nH+]c1C ZINC000883342702 1044278460 /nfs/dbraw/zinc/27/84/60/1044278460.db2.gz ITIZHZJHLVSUSS-NSHDSACASA-N 1 2 306.207 4.029 20 0 DIADLO Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1c(F)cncc1F ZINC000293445050 1044286683 /nfs/dbraw/zinc/28/66/83/1044286683.db2.gz CFTIOTDDZRVLAA-LBPRGKRZSA-N 1 2 305.372 4.037 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)c(F)cc2F)cc1 ZINC001137891265 1044287464 /nfs/dbraw/zinc/28/74/64/1044287464.db2.gz HCXKTJRVXLMIFT-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)c(F)cc2F)cc1 ZINC001137891265 1044287476 /nfs/dbraw/zinc/28/74/76/1044287476.db2.gz HCXKTJRVXLMIFT-GOSISDBHSA-N 1 2 321.342 4.450 20 0 DIADLO C[C@H]([NH2+][C@H]1c2ccccc2CC[C@H]1F)c1ccc(Cl)cn1 ZINC000883375954 1044288389 /nfs/dbraw/zinc/28/83/89/1044288389.db2.gz CJOQKCZWOSWPOC-CXMBCZLWSA-N 1 2 304.796 4.411 20 0 DIADLO C[C@H]([NH2+][C@@H]1c2ccccc2CC[C@@H]1F)c1nc2ccccc2n1C ZINC000883376589 1044289243 /nfs/dbraw/zinc/28/92/43/1044289243.db2.gz OOLDFCQDFNHFND-IYJAJMOOSA-N 1 2 323.415 4.250 20 0 DIADLO CCSCc1ccc[nH+]c1NCc1scnc1C1CC1 ZINC000883377840 1044293308 /nfs/dbraw/zinc/29/33/08/1044293308.db2.gz RTNUJVUIRYJVQH-UHFFFAOYSA-N 1 2 305.472 4.281 20 0 DIADLO C[C@@H]([NH2+]c1ccc(N2CCSCC2)cc1)C1CCSCC1 ZINC000187519215 1044299444 /nfs/dbraw/zinc/29/94/44/1044299444.db2.gz MEKFTEFXUJAGAY-CQSZACIVSA-N 1 2 322.543 4.183 20 0 DIADLO CCC[NH+](CCC)Cn1nc(-c2ccccc2F)oc1=S ZINC000935190895 1044319187 /nfs/dbraw/zinc/31/91/87/1044319187.db2.gz PDGBTXDBQKIMCH-UHFFFAOYSA-N 1 2 309.410 4.091 20 0 DIADLO Cc1sccc1C[N@@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000293772995 1044327071 /nfs/dbraw/zinc/32/70/71/1044327071.db2.gz BIKFYRNDIHVJRM-HNNXBMFYSA-N 1 2 317.458 4.434 20 0 DIADLO Cc1sccc1C[N@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000293772995 1044327081 /nfs/dbraw/zinc/32/70/81/1044327081.db2.gz BIKFYRNDIHVJRM-HNNXBMFYSA-N 1 2 317.458 4.434 20 0 DIADLO Fc1cccc(F)c1C1([NH2+]Cc2ccc(Cl)cn2)CCC1 ZINC000626178781 1044329123 /nfs/dbraw/zinc/32/91/23/1044329123.db2.gz IVNDZYZKAJUWKN-UHFFFAOYSA-N 1 2 308.759 4.182 20 0 DIADLO Cc1cc(C)c(CNC(=S)Nc2cccc(Cl)c2C)c[nH+]1 ZINC000840826708 1044331648 /nfs/dbraw/zinc/33/16/48/1044331648.db2.gz SVFHXMPNWWYZMT-UHFFFAOYSA-N 1 2 319.861 4.147 20 0 DIADLO CCCC[N@H+](C)Cc1csc(N(C(C)=O)c2ccccc2)n1 ZINC000102678836 1044346083 /nfs/dbraw/zinc/34/60/83/1044346083.db2.gz WOQIBMQUSPGQQI-UHFFFAOYSA-N 1 2 317.458 4.060 20 0 DIADLO CCCC[N@@H+](C)Cc1csc(N(C(C)=O)c2ccccc2)n1 ZINC000102678836 1044346095 /nfs/dbraw/zinc/34/60/95/1044346095.db2.gz WOQIBMQUSPGQQI-UHFFFAOYSA-N 1 2 317.458 4.060 20 0 DIADLO COc1ccccc1C(C)(C)[NH2+]Cc1csc(C(C)(C)C)n1 ZINC000103171825 1044348282 /nfs/dbraw/zinc/34/82/82/1044348282.db2.gz DZYDZIFDTNYGDE-UHFFFAOYSA-N 1 2 318.486 4.474 20 0 DIADLO C[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(-c2ccncc2)cc1 ZINC000361033106 1044349839 /nfs/dbraw/zinc/34/98/39/1044349839.db2.gz SDUVGBSVMVDIGU-CQSZACIVSA-N 1 2 319.408 4.465 20 0 DIADLO CCc1cnccc1[C@H](C)[NH2+]Cc1ncc(-c2cccs2)o1 ZINC000361120073 1044362422 /nfs/dbraw/zinc/36/24/22/1044362422.db2.gz PNDZPRZSJJURBD-LBPRGKRZSA-N 1 2 313.426 4.211 20 0 DIADLO CC[C@H]([NH2+]Cc1cn2ccc(C)cc2n1)c1cc(F)ccc1F ZINC000361139548 1044366094 /nfs/dbraw/zinc/36/60/94/1044366094.db2.gz HCXNEVSBLPTFOK-KRWDZBQOSA-N 1 2 315.367 4.162 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCOc2c(F)ccc(F)c21)c1ccccc1F ZINC000361177772 1044369574 /nfs/dbraw/zinc/36/95/74/1044369574.db2.gz JTDJFFDVSOZNIQ-ZUZCIYMTSA-N 1 2 307.315 4.278 20 0 DIADLO Cc1ccc2c(Nc3cc(C(N)=O)ccc3Cl)cccc2[nH+]1 ZINC001212797708 1044369612 /nfs/dbraw/zinc/36/96/12/1044369612.db2.gz FTTGAHGZRDKTRP-UHFFFAOYSA-N 1 2 311.772 4.039 20 0 DIADLO CCc1cccnc1[C@@H](C)[NH2+][C@H]1CCOc2c(F)ccc(F)c21 ZINC000361175038 1044369962 /nfs/dbraw/zinc/36/99/62/1044369962.db2.gz CBLKAOUHUAYSJC-ABAIWWIYSA-N 1 2 318.367 4.097 20 0 DIADLO Cc1cc([C@@H](C)[NH2+][C@@H]2CCOc3c(F)ccc(F)c32)oc1C ZINC000361186784 1044372727 /nfs/dbraw/zinc/37/27/27/1044372727.db2.gz MSTACOWUSNSFMT-QMTHXVAHSA-N 1 2 307.340 4.349 20 0 DIADLO Cc1cc2ncn(C[N@@H+](C)[C@@H]3CCc4ccccc43)c2cc1C ZINC000029307833 1044372723 /nfs/dbraw/zinc/37/27/23/1044372723.db2.gz QIUHHCGUCDRDKR-LJQANCHMSA-N 1 2 305.425 4.230 20 0 DIADLO Cc1cc2ncn(C[N@H+](C)[C@@H]3CCc4ccccc43)c2cc1C ZINC000029307833 1044372736 /nfs/dbraw/zinc/37/27/36/1044372736.db2.gz QIUHHCGUCDRDKR-LJQANCHMSA-N 1 2 305.425 4.230 20 0 DIADLO CCC1(CNc2ccc(-n3c[nH+]c(C)c3C)cc2)CCOCC1 ZINC000361236161 1044377935 /nfs/dbraw/zinc/37/79/35/1044377935.db2.gz HQSIJPXWGQCAKB-UHFFFAOYSA-N 1 2 313.445 4.108 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)c1cc(C)on1)c1ccccc1OC(F)F ZINC000282878796 1044396918 /nfs/dbraw/zinc/39/69/18/1044396918.db2.gz VOFWBCKLDNCCJC-WCQYABFASA-N 1 2 310.344 4.386 20 0 DIADLO CC(=O)Nc1cccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000192903415 1044398845 /nfs/dbraw/zinc/39/88/45/1044398845.db2.gz SEEFYSDOLAHJRJ-AWEZNQCLSA-N 1 2 320.396 4.004 20 0 DIADLO Fc1cccc(OC(F)F)c1C[NH2+]Cc1sccc1Cl ZINC000475439399 1044404869 /nfs/dbraw/zinc/40/48/69/1044404869.db2.gz JZZZNTFPSLJPMJ-UHFFFAOYSA-N 1 2 321.751 4.432 20 0 DIADLO CC(C)c1noc([C@H](C)[N@@H+]2CCS[C@H](c3ccccc3)C2)n1 ZINC000361476913 1044407377 /nfs/dbraw/zinc/40/73/77/1044407377.db2.gz FCAUPMIYBORXAN-ZFWWWQNUSA-N 1 2 317.458 4.044 20 0 DIADLO CC(C)c1noc([C@H](C)[N@H+]2CCS[C@H](c3ccccc3)C2)n1 ZINC000361476913 1044407381 /nfs/dbraw/zinc/40/73/81/1044407381.db2.gz FCAUPMIYBORXAN-ZFWWWQNUSA-N 1 2 317.458 4.044 20 0 DIADLO Fc1ccc([C@@H]2C[C@H]2Nc2ccc(-n3cccc3)c[nH+]2)cc1F ZINC001168065776 1044414747 /nfs/dbraw/zinc/41/47/47/1044414747.db2.gz MDWXRJYBALTMDO-WMLDXEAASA-N 1 2 311.335 4.119 20 0 DIADLO Cc1cc(N2CCc3c(F)cc(F)cc3[C@H]2C)nc(C2CC2)[nH+]1 ZINC000361633609 1044427423 /nfs/dbraw/zinc/42/74/23/1044427423.db2.gz ZGJTYQJCNCIOGF-LLVKDONJSA-N 1 2 315.367 4.064 20 0 DIADLO CCC(=O)CCC[N@@H+]1CCc2c(Cl)cc(Cl)cc2C1 ZINC000565330781 1044427645 /nfs/dbraw/zinc/42/76/45/1044427645.db2.gz YHLADMPHTHRZPC-UHFFFAOYSA-N 1 2 300.229 4.111 20 0 DIADLO CCC(=O)CCC[N@H+]1CCc2c(Cl)cc(Cl)cc2C1 ZINC000565330781 1044427652 /nfs/dbraw/zinc/42/76/52/1044427652.db2.gz YHLADMPHTHRZPC-UHFFFAOYSA-N 1 2 300.229 4.111 20 0 DIADLO Cc1ccc(C)c([C@@H]2CCC[N@H+]2Cc2ncc(Cl)n2C)c1 ZINC000133620411 1044430788 /nfs/dbraw/zinc/43/07/88/1044430788.db2.gz KRBDNFHOUDNKEK-HNNXBMFYSA-N 1 2 303.837 4.027 20 0 DIADLO Cc1ccc(C)c([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)n2C)c1 ZINC000133620411 1044430792 /nfs/dbraw/zinc/43/07/92/1044430792.db2.gz KRBDNFHOUDNKEK-HNNXBMFYSA-N 1 2 303.837 4.027 20 0 DIADLO CO[C@@H](c1ccccc1)[C@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000565392985 1044431927 /nfs/dbraw/zinc/43/19/27/1044431927.db2.gz QCUXZUVWXZSUIH-WMLDXEAASA-N 1 2 305.368 4.144 20 0 DIADLO COc1ccc(Cl)c(C[NH2+]C2(c3nc(C)cs3)CCC2)c1 ZINC000361748336 1044438878 /nfs/dbraw/zinc/43/88/78/1044438878.db2.gz QWDGEXJSIHTWTG-UHFFFAOYSA-N 1 2 322.861 4.283 20 0 DIADLO Cc1ccc2c(Nc3cccc(F)c3OC3COC3)cccc2[nH+]1 ZINC001212798731 1044451141 /nfs/dbraw/zinc/45/11/41/1044451141.db2.gz PWXFHPBIPKUQSO-UHFFFAOYSA-N 1 2 324.355 4.204 20 0 DIADLO Cc1ccc2c(Nc3cccc4c3NC(=O)CC4)cccc2[nH+]1 ZINC001212798848 1044453138 /nfs/dbraw/zinc/45/31/38/1044453138.db2.gz WLBQWZCVSJIFOA-UHFFFAOYSA-N 1 2 303.365 4.172 20 0 DIADLO Cc1cccc(NC(=O)Nc2cccc(-n3cc[nH+]c3)c2)c1C ZINC001202701043 1044480079 /nfs/dbraw/zinc/48/00/79/1044480079.db2.gz NVSASEJHQBGNSO-UHFFFAOYSA-N 1 2 306.369 4.133 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N(C)c3ccccc3C(C)C)ccn12 ZINC000566462463 1044491222 /nfs/dbraw/zinc/49/12/22/1044491222.db2.gz NSZYWIKKJCCPBA-UHFFFAOYSA-N 1 2 307.397 4.043 20 0 DIADLO Fc1ccc(Cl)cc1C[NH2+]C1(c2nccs2)CCCC1 ZINC000119250126 1044491674 /nfs/dbraw/zinc/49/16/74/1044491674.db2.gz SEKMVRSBZRUZOX-UHFFFAOYSA-N 1 2 310.825 4.495 20 0 DIADLO Cc1cnc(C[NH2+][C@H](Cc2ccc(C)cc2)c2ccccn2)s1 ZINC000295157766 1044493790 /nfs/dbraw/zinc/49/37/90/1044493790.db2.gz KGGHMLPVPBJUQD-GOSISDBHSA-N 1 2 323.465 4.229 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2nc(-c3ccccc3)c[nH]2)cc1 ZINC000362309379 1044499046 /nfs/dbraw/zinc/49/90/46/1044499046.db2.gz PXYMVRBMDAMMDM-UHFFFAOYSA-N 1 2 321.424 4.107 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2nc(-c3ccccc3)c[nH]2)cc1 ZINC000362309379 1044499052 /nfs/dbraw/zinc/49/90/52/1044499052.db2.gz PXYMVRBMDAMMDM-UHFFFAOYSA-N 1 2 321.424 4.107 20 0 DIADLO C[C@H]1C[C@@H]([NH2+]Cc2ccccc2OC2CCCC2)c2nccn21 ZINC000295184383 1044499379 /nfs/dbraw/zinc/49/93/79/1044499379.db2.gz HZYZYLDLSQSHQF-WMLDXEAASA-N 1 2 311.429 4.000 20 0 DIADLO CC[N@H+](Cc1nc([C@@H](c2ccccc2C)C(C)C)no1)C1CC1 ZINC000566587910 1044501453 /nfs/dbraw/zinc/50/14/53/1044501453.db2.gz LNTTXWXYWKAQGD-GOSISDBHSA-N 1 2 313.445 4.150 20 0 DIADLO CC[N@@H+](Cc1nc([C@@H](c2ccccc2C)C(C)C)no1)C1CC1 ZINC000566587910 1044501464 /nfs/dbraw/zinc/50/14/64/1044501464.db2.gz LNTTXWXYWKAQGD-GOSISDBHSA-N 1 2 313.445 4.150 20 0 DIADLO CC(C)Oc1cccc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)C)no2)c1 ZINC000120238642 1044504122 /nfs/dbraw/zinc/50/41/22/1044504122.db2.gz HVRSXEZENBZZAX-KGLIPLIRSA-N 1 2 317.433 4.392 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2cccc(O)c2Cl)s1 ZINC000295332953 1044509199 /nfs/dbraw/zinc/50/91/99/1044509199.db2.gz MAPMIFGPJSVTBN-SNVBAGLBSA-N 1 2 310.850 4.312 20 0 DIADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cccc(O)c2Cl)s1 ZINC000295332953 1044509212 /nfs/dbraw/zinc/50/92/12/1044509212.db2.gz MAPMIFGPJSVTBN-SNVBAGLBSA-N 1 2 310.850 4.312 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2cccc(O)c2Cl)s1 ZINC000295332946 1044509456 /nfs/dbraw/zinc/50/94/56/1044509456.db2.gz MAPMIFGPJSVTBN-JTQLQIEISA-N 1 2 310.850 4.312 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2cccc(O)c2Cl)s1 ZINC000295332946 1044509471 /nfs/dbraw/zinc/50/94/71/1044509471.db2.gz MAPMIFGPJSVTBN-JTQLQIEISA-N 1 2 310.850 4.312 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000362431844 1044510517 /nfs/dbraw/zinc/51/05/17/1044510517.db2.gz WCGRCDPPUDLROL-WMLDXEAASA-N 1 2 301.434 4.339 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000362431844 1044510533 /nfs/dbraw/zinc/51/05/33/1044510533.db2.gz WCGRCDPPUDLROL-WMLDXEAASA-N 1 2 301.434 4.339 20 0 DIADLO Cc1nc(C[NH2+][C@@H](c2ccc(CC(C)C)cc2)C(C)C)no1 ZINC000120638186 1044513011 /nfs/dbraw/zinc/51/30/11/1044513011.db2.gz TWLYGFDNNLNAHV-GOSISDBHSA-N 1 2 301.434 4.063 20 0 DIADLO Cc1nocc1C[N@H+]1CCC[C@H]1c1nc2ccccc2n1C(C)C ZINC000295356708 1044514679 /nfs/dbraw/zinc/51/46/79/1044514679.db2.gz NOABERVLOKSJIS-SFHVURJKSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1nocc1C[N@@H+]1CCC[C@H]1c1nc2ccccc2n1C(C)C ZINC000295356708 1044514696 /nfs/dbraw/zinc/51/46/96/1044514696.db2.gz NOABERVLOKSJIS-SFHVURJKSA-N 1 2 324.428 4.251 20 0 DIADLO CC(F)(F)C[NH2+][C@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000566810438 1044517704 /nfs/dbraw/zinc/51/77/04/1044517704.db2.gz DMBDSPOXHDEKMD-LBPRGKRZSA-N 1 2 308.397 4.432 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1ccc(Cl)cn1)[C@H]2C ZINC000566934328 1044528858 /nfs/dbraw/zinc/52/88/58/1044528858.db2.gz GDVZABWIVYNXNQ-STQMWFEESA-N 1 2 316.832 4.251 20 0 DIADLO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1ccc(Cl)cn1)[C@H]2C ZINC000566934328 1044528874 /nfs/dbraw/zinc/52/88/74/1044528874.db2.gz GDVZABWIVYNXNQ-STQMWFEESA-N 1 2 316.832 4.251 20 0 DIADLO Cc1ccc2nc(C[N@@H+]3CCOC[C@@H]3c3ccccc3)ccc2c1 ZINC001137211647 1044533831 /nfs/dbraw/zinc/53/38/31/1044533831.db2.gz VPYVRLPGYSXBJY-OAQYLSRUSA-N 1 2 318.420 4.117 20 0 DIADLO Cc1ccc2nc(C[N@H+]3CCOC[C@@H]3c3ccccc3)ccc2c1 ZINC001137211647 1044533847 /nfs/dbraw/zinc/53/38/47/1044533847.db2.gz VPYVRLPGYSXBJY-OAQYLSRUSA-N 1 2 318.420 4.117 20 0 DIADLO CCC1(C(=O)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)CC1 ZINC000362942530 1044566752 /nfs/dbraw/zinc/56/67/52/1044566752.db2.gz HDHUOTYDGHPXBY-UHFFFAOYSA-N 1 2 309.413 4.015 20 0 DIADLO Cc1cccc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c1F ZINC000295922126 1044577712 /nfs/dbraw/zinc/57/77/12/1044577712.db2.gz AFKKGCNIDKYULU-SECBINFHSA-N 1 2 318.339 4.460 20 0 DIADLO Cc1n[nH]c(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)c1C ZINC000886018637 1044598620 /nfs/dbraw/zinc/59/86/20/1044598620.db2.gz FNHQEIYUKJWXAT-UHFFFAOYSA-N 1 2 310.228 4.112 20 0 DIADLO CC[C@@H]([NH2+]Cc1cc(C)co1)c1nc(C(F)(F)F)cs1 ZINC000886005670 1044599677 /nfs/dbraw/zinc/59/96/77/1044599677.db2.gz HMTLAWWMQFIZRW-SNVBAGLBSA-N 1 2 304.337 4.304 20 0 DIADLO OC[C@H]([NH2+]Cc1nc(C2CCCCC2)cs1)c1ccsc1 ZINC000444689511 1044602749 /nfs/dbraw/zinc/60/27/49/1044602749.db2.gz NTFBTAZJJDOSSA-AWEZNQCLSA-N 1 2 322.499 4.076 20 0 DIADLO CCC(CC)c1cc(C[NH2+][C@@H](C)c2ccnn2C2CCC2)on1 ZINC000925158528 1044602829 /nfs/dbraw/zinc/60/28/29/1044602829.db2.gz VCSDABLBFZAQKI-ZDUSSCGKSA-N 1 2 316.449 4.351 20 0 DIADLO C[C@@H]1CC[C@H]([NH2+]Cc2ncc(C(F)(F)F)cn2)c2ccccc21 ZINC000296283978 1044604705 /nfs/dbraw/zinc/60/47/05/1044604705.db2.gz FDCYQZZEPMWUHA-ABAIWWIYSA-N 1 2 321.346 4.224 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](C)[C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000444712309 1044612201 /nfs/dbraw/zinc/61/22/01/1044612201.db2.gz YTTYBYIHSTWXBE-CQSZACIVSA-N 1 2 301.434 4.177 20 0 DIADLO Cc1cc(C)cc(C[N@H+](C)[C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000444712309 1044612202 /nfs/dbraw/zinc/61/22/02/1044612202.db2.gz YTTYBYIHSTWXBE-CQSZACIVSA-N 1 2 301.434 4.177 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccco3)cc2F)c2nccn21 ZINC000296500821 1044623297 /nfs/dbraw/zinc/62/32/97/1044623297.db2.gz QAUWNMMNTKWIOS-MLGOLLRUSA-N 1 2 311.360 4.078 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ncc(C(F)(F)F)cn2)c(C)s1 ZINC000296510641 1044625591 /nfs/dbraw/zinc/62/55/91/1044625591.db2.gz PMODOBQVSVRTPZ-VIFPVBQESA-N 1 2 315.364 4.025 20 0 DIADLO CCCc1ccc([C@H](C)[NH2+]Cc2ncc(C(F)(F)F)cn2)cc1 ZINC000296539978 1044625665 /nfs/dbraw/zinc/62/56/65/1044625665.db2.gz QWSVMIKNRJRBAX-LBPRGKRZSA-N 1 2 323.362 4.299 20 0 DIADLO CCCCCCC(=O)Nc1nc(C[N@@H+]2CCC[C@H](C)C2)cs1 ZINC000886212128 1044627291 /nfs/dbraw/zinc/62/72/91/1044627291.db2.gz JLFYRHPXLFMYLY-AWEZNQCLSA-N 1 2 323.506 4.284 20 0 DIADLO CCCCCCC(=O)Nc1nc(C[N@H+]2CCC[C@H](C)C2)cs1 ZINC000886212128 1044627295 /nfs/dbraw/zinc/62/72/95/1044627295.db2.gz JLFYRHPXLFMYLY-AWEZNQCLSA-N 1 2 323.506 4.284 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N3CCCC[C@@H]3c3ccccc3)ccn12 ZINC000568649247 1044640657 /nfs/dbraw/zinc/64/06/57/1044640657.db2.gz CZFAAXINNGKHPJ-GOSISDBHSA-N 1 2 319.408 4.010 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1sccc1Br)c1cscn1 ZINC000568783140 1044648671 /nfs/dbraw/zinc/64/86/71/1044648671.db2.gz NWEAILQBIZWHFW-HTQZYQBOSA-N 1 2 317.277 4.379 20 0 DIADLO COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1cc(C2CC2)no1 ZINC000886682644 1044676911 /nfs/dbraw/zinc/67/69/11/1044676911.db2.gz MIEFHEPIOGIION-SNVBAGLBSA-N 1 2 306.793 4.065 20 0 DIADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1cc(C2CC2)no1 ZINC000886682854 1044677661 /nfs/dbraw/zinc/67/76/61/1044677661.db2.gz QJGHZYSOQSYDLK-LLVKDONJSA-N 1 2 320.820 4.455 20 0 DIADLO Cc1ccc2cc([C@@H](C)[NH2+]Cc3nnc(C4CC4)s3)oc2c1 ZINC000569199169 1044683334 /nfs/dbraw/zinc/68/33/34/1044683334.db2.gz XVMYQKNGEWOBIU-LLVKDONJSA-N 1 2 313.426 4.321 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2ccc([C@H]3C[C@H]3C)o2)c(C)[nH+]1 ZINC000569201037 1044683611 /nfs/dbraw/zinc/68/36/11/1044683611.db2.gz LKSAQSAGPVSOHP-BMIGLBTASA-N 1 2 313.401 4.045 20 0 DIADLO FC(F)(F)C1CC[NH+](Cc2ncc(-c3ccccc3)o2)CC1 ZINC000075996633 1044692100 /nfs/dbraw/zinc/69/21/00/1044692100.db2.gz RIOKOXRWRRRCSZ-UHFFFAOYSA-N 1 2 310.319 4.116 20 0 DIADLO CCCc1nc(C[NH2+][C@H](CC)c2cccc3ccccc32)no1 ZINC000886917456 1044718265 /nfs/dbraw/zinc/71/82/65/1044718265.db2.gz AKLHXKXTOSVYET-QGZVFWFLSA-N 1 2 309.413 4.416 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1ccc2cc[nH]c2c1 ZINC000366548716 1044722763 /nfs/dbraw/zinc/72/27/63/1044722763.db2.gz TYAAFVLMUQTHNR-UHFFFAOYSA-N 1 2 316.364 4.119 20 0 DIADLO CC(C)(C)c1cnc(C[NH2+][C@@H]2CCOc3ccc(F)cc32)s1 ZINC000366732025 1044724808 /nfs/dbraw/zinc/72/48/08/1044724808.db2.gz VFFIGQIAHSDZEN-CYBMUJFWSA-N 1 2 320.433 4.193 20 0 DIADLO Cc1nc(C[NH2+]C(C)(C)c2ccccc2F)nc2ccccc12 ZINC000570139391 1044735758 /nfs/dbraw/zinc/73/57/58/1044735758.db2.gz UPSBIUWFZNQRAC-UHFFFAOYSA-N 1 2 309.388 4.102 20 0 DIADLO CC(C)(C)CCC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000524100279 1044736821 /nfs/dbraw/zinc/73/68/21/1044736821.db2.gz BUGPFHWRVMVDGM-UHFFFAOYSA-N 1 2 305.809 4.291 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc(F)c2ccccc21 ZINC000367492036 1044741834 /nfs/dbraw/zinc/74/18/34/1044741834.db2.gz XVFUIPHBCDUNCH-KZULUSFZSA-N 1 2 309.388 4.430 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCc2[nH]ncc21)c1ccc(F)c2ccccc21 ZINC000367492034 1044742499 /nfs/dbraw/zinc/74/24/99/1044742499.db2.gz XVFUIPHBCDUNCH-KPZWWZAWSA-N 1 2 309.388 4.430 20 0 DIADLO Cc1nc(C[NH2+]C2(c3ccc(F)cc3F)CCCC2)cs1 ZINC000089802303 1044746832 /nfs/dbraw/zinc/74/68/32/1044746832.db2.gz FTSWEZBBHWLKNP-UHFFFAOYSA-N 1 2 308.397 4.289 20 0 DIADLO c1csc([C@@H](Cc2ccccc2)[NH2+][C@@H]2CCCc3[nH]ncc32)c1 ZINC000367597818 1044747296 /nfs/dbraw/zinc/74/72/96/1044747296.db2.gz CELMIZKWESJUQB-SJLPKXTDSA-N 1 2 323.465 4.422 20 0 DIADLO c1csc([C@H](Cc2ccccc2)[NH2+][C@@H]2CCCc3[nH]ncc32)c1 ZINC000367597814 1044747634 /nfs/dbraw/zinc/74/76/34/1044747634.db2.gz CELMIZKWESJUQB-AEFFLSMTSA-N 1 2 323.465 4.422 20 0 DIADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@H](c2cnn(C)c2)c2ccccc2)o1 ZINC000368240698 1044769813 /nfs/dbraw/zinc/76/98/13/1044769813.db2.gz DRXBLQBHJPAUOD-DJKXOVBDSA-N 1 2 321.424 4.016 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1CCC(C)=C(C)C1 ZINC000570635111 1044772953 /nfs/dbraw/zinc/77/29/53/1044772953.db2.gz WGSXRIWHEHNQBL-MRXNPFEDSA-N 1 2 309.413 4.460 20 0 DIADLO FC(F)(F)CCCNc1[nH+]cccc1OCc1ccccc1 ZINC000570734374 1044779866 /nfs/dbraw/zinc/77/98/66/1044779866.db2.gz AIWBAMXYAHLAPW-UHFFFAOYSA-N 1 2 310.319 4.415 20 0 DIADLO C[C@H](c1ccco1)[N@H+](C)Cc1nc2cc(Cl)ccc2n1C ZINC000122902792 1044780565 /nfs/dbraw/zinc/78/05/65/1044780565.db2.gz IASUQFDDLATWBA-LLVKDONJSA-N 1 2 303.793 4.013 20 0 DIADLO C[C@H](c1ccco1)[N@@H+](C)Cc1nc2cc(Cl)ccc2n1C ZINC000122902792 1044780574 /nfs/dbraw/zinc/78/05/74/1044780574.db2.gz IASUQFDDLATWBA-LLVKDONJSA-N 1 2 303.793 4.013 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccccc2C(F)(F)F)no1 ZINC000368949828 1044793107 /nfs/dbraw/zinc/79/31/07/1044793107.db2.gz WLMZTINCHGGYOG-OAHLLOKOSA-N 1 2 310.319 4.339 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2C(F)(F)F)no1 ZINC000368949828 1044793120 /nfs/dbraw/zinc/79/31/20/1044793120.db2.gz WLMZTINCHGGYOG-OAHLLOKOSA-N 1 2 310.319 4.339 20 0 DIADLO CCC[C@H](C(=O)Nc1ccc2[nH+]c(C)cn2c1)c1ccccc1 ZINC000524276459 1044793538 /nfs/dbraw/zinc/79/35/38/1044793538.db2.gz OVPSRRSNZJKYTH-KRWDZBQOSA-N 1 2 307.397 4.165 20 0 DIADLO COc1c(C)c[nH+]c(CN(Cc2ccccc2C)C2CC2)c1C ZINC000524309697 1044795559 /nfs/dbraw/zinc/79/55/59/1044795559.db2.gz DCEKCDBMBXXGFM-UHFFFAOYSA-N 1 2 310.441 4.180 20 0 DIADLO COCC(C)(C)CCCNc1cc[nH+]c2c(OC)cccc12 ZINC000571197229 1044803592 /nfs/dbraw/zinc/80/35/92/1044803592.db2.gz UANJBQAUTOESEG-UHFFFAOYSA-N 1 2 302.418 4.108 20 0 DIADLO C[C@H]([NH2+]Cc1ccccc1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000369709553 1044814209 /nfs/dbraw/zinc/81/42/09/1044814209.db2.gz FNTVGUKOIGCTGD-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO CCc1ccc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)s1 ZINC001212813106 1044820516 /nfs/dbraw/zinc/82/05/16/1044820516.db2.gz FLUGZXGSZIJNBE-UHFFFAOYSA-N 1 2 322.393 4.213 20 0 DIADLO C[C@H]1CN(Cc2c[nH+]cn2Cc2ccccc2)c2ccccc21 ZINC000445802318 1044822998 /nfs/dbraw/zinc/82/29/98/1044822998.db2.gz MBHIURMCIJUWSV-INIZCTEOSA-N 1 2 303.409 4.055 20 0 DIADLO FC(F)C[C@@H]1COCC[N@@H+]1Cc1cc(-c2ccccc2)cs1 ZINC000571842177 1044831366 /nfs/dbraw/zinc/83/13/66/1044831366.db2.gz PWTYVACMVUQDFA-OAHLLOKOSA-N 1 2 323.408 4.271 20 0 DIADLO FC(F)C[C@@H]1COCC[N@H+]1Cc1cc(-c2ccccc2)cs1 ZINC000571842177 1044831381 /nfs/dbraw/zinc/83/13/81/1044831381.db2.gz PWTYVACMVUQDFA-OAHLLOKOSA-N 1 2 323.408 4.271 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2nccn2CC(F)(F)F)c1 ZINC000264051515 1044845544 /nfs/dbraw/zinc/84/55/44/1044845544.db2.gz IHAXGNCHURSYHH-HNNXBMFYSA-N 1 2 323.362 4.091 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2nccn2CC(F)(F)F)c1 ZINC000264051515 1044845563 /nfs/dbraw/zinc/84/55/63/1044845563.db2.gz IHAXGNCHURSYHH-HNNXBMFYSA-N 1 2 323.362 4.091 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2nccn2CC(F)(F)F)c1 ZINC000264051517 1044848157 /nfs/dbraw/zinc/84/81/57/1044848157.db2.gz IHAXGNCHURSYHH-OAHLLOKOSA-N 1 2 323.362 4.091 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2nccn2CC(F)(F)F)c1 ZINC000264051517 1044848182 /nfs/dbraw/zinc/84/81/82/1044848182.db2.gz IHAXGNCHURSYHH-OAHLLOKOSA-N 1 2 323.362 4.091 20 0 DIADLO CC[N@H+](Cc1ccccn1)[C@@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000371230369 1044863843 /nfs/dbraw/zinc/86/38/43/1044863843.db2.gz QMTOBQAWQXYGBV-HNNXBMFYSA-N 1 2 322.412 4.023 20 0 DIADLO CC[N@@H+](Cc1ccccn1)[C@@H](C)c1nnc(-c2cccc(C)c2)o1 ZINC000371230369 1044863866 /nfs/dbraw/zinc/86/38/66/1044863866.db2.gz QMTOBQAWQXYGBV-HNNXBMFYSA-N 1 2 322.412 4.023 20 0 DIADLO Cc1csc(C2([NH2+]Cc3ccc([C@H]4C[C@@H]4C)o3)CCC2)n1 ZINC000264544964 1044887972 /nfs/dbraw/zinc/88/79/72/1044887972.db2.gz ULBDCDSWKUFIAD-FZMZJTMJSA-N 1 2 302.443 4.337 20 0 DIADLO CCc1cc(OCCCO[C@H]2CCCCO2)c2ccccc2[nH+]1 ZINC000573240076 1044900223 /nfs/dbraw/zinc/90/02/23/1044900223.db2.gz HKXPHNWSRRYEGP-IBGZPJMESA-N 1 2 315.413 4.109 20 0 DIADLO Cc1sc([C@@H]2COCC[NH2+]2)nc1-c1ccc(C(C)(C)C)cc1 ZINC000446135051 1044901389 /nfs/dbraw/zinc/90/13/89/1044901389.db2.gz DQKDFNWBLNRQPD-HNNXBMFYSA-N 1 2 316.470 4.077 20 0 DIADLO Fc1c[nH+]ccc1NCc1csc(-c2ccc(Cl)cc2)n1 ZINC000573302467 1044902904 /nfs/dbraw/zinc/90/29/04/1044902904.db2.gz HNGJCXAQZVBISQ-UHFFFAOYSA-N 1 2 319.792 4.032 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2nc(C3CC3)cs2)C1 ZINC000337462213 1044903482 /nfs/dbraw/zinc/90/34/82/1044903482.db2.gz QATJLSUXFGHCBS-GOSISDBHSA-N 1 2 316.445 4.400 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2nc(C3CC3)cs2)C1 ZINC000337462213 1044903488 /nfs/dbraw/zinc/90/34/88/1044903488.db2.gz QATJLSUXFGHCBS-GOSISDBHSA-N 1 2 316.445 4.400 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccccc1OC(F)F ZINC000573369079 1044904268 /nfs/dbraw/zinc/90/42/68/1044904268.db2.gz SLEHJXZNWWLOCM-NSHDSACASA-N 1 2 324.371 4.424 20 0 DIADLO COc1cccc2cc([C@H](C)[NH2+][C@H](C)c3cscn3)oc21 ZINC000573466730 1044908441 /nfs/dbraw/zinc/90/84/41/1044908441.db2.gz CLYGBOSYNDLNPC-MNOVXSKESA-N 1 2 302.399 4.310 20 0 DIADLO Cc1ccccc1[C@H]1C[N@H+](Cc2cc3ccc(F)cc3[nH]2)CCO1 ZINC000573512740 1044910757 /nfs/dbraw/zinc/91/07/57/1044910757.db2.gz AWEZQWCXWKHINO-HXUWFJFHSA-N 1 2 324.399 4.189 20 0 DIADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2cc3ccc(F)cc3[nH]2)CCO1 ZINC000573512740 1044910764 /nfs/dbraw/zinc/91/07/64/1044910764.db2.gz AWEZQWCXWKHINO-HXUWFJFHSA-N 1 2 324.399 4.189 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cnn(C3CCCC3)c2)cs1 ZINC000337505327 1044911593 /nfs/dbraw/zinc/91/15/93/1044911593.db2.gz FEOGSHHRDZLOJD-CHWSQXEVSA-N 1 2 318.490 4.429 20 0 DIADLO Fc1cccc(CNc2cccc3c2CN(c2cccc[nH+]2)C3)c1 ZINC000372296249 1044912103 /nfs/dbraw/zinc/91/21/03/1044912103.db2.gz DBNTYUQIPXSDIU-UHFFFAOYSA-N 1 2 319.383 4.353 20 0 DIADLO Cc1cccc(NC2CCN(c3cc(C)[nH+]c(C4CC4)n3)CC2)c1 ZINC000524842472 1044935515 /nfs/dbraw/zinc/93/55/15/1044935515.db2.gz MOLSCCZDJLLRNC-UHFFFAOYSA-N 1 2 322.456 4.052 20 0 DIADLO CCc1nc(C[N@H+](Cc2ccc(C)c(C)c2)C2CC2)cs1 ZINC000524895304 1044943115 /nfs/dbraw/zinc/94/31/15/1044943115.db2.gz SUXZXTIUFPQERL-UHFFFAOYSA-N 1 2 300.471 4.487 20 0 DIADLO CCc1nc(C[N@@H+](Cc2ccc(C)c(C)c2)C2CC2)cs1 ZINC000524895304 1044943127 /nfs/dbraw/zinc/94/31/27/1044943127.db2.gz SUXZXTIUFPQERL-UHFFFAOYSA-N 1 2 300.471 4.487 20 0 DIADLO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cscc1Br ZINC000574235374 1044946235 /nfs/dbraw/zinc/94/62/35/1044946235.db2.gz LFHBWKBRMLWUIK-OTYXRUKQSA-N 1 2 324.243 4.122 20 0 DIADLO Cc1noc([C@H](C)[N@H+](C)Cc2ccc(Cl)c3ccccc23)n1 ZINC000574530051 1044958002 /nfs/dbraw/zinc/95/80/02/1044958002.db2.gz OJBKHIQMPWFYEP-NSHDSACASA-N 1 2 315.804 4.378 20 0 DIADLO Cc1noc([C@H](C)[N@@H+](C)Cc2ccc(Cl)c3ccccc23)n1 ZINC000574530051 1044958016 /nfs/dbraw/zinc/95/80/16/1044958016.db2.gz OJBKHIQMPWFYEP-NSHDSACASA-N 1 2 315.804 4.378 20 0 DIADLO CC(C)(C)c1cc(C[N@H+]2CC=C(c3ccc(F)cc3)CC2)no1 ZINC000574944783 1044981407 /nfs/dbraw/zinc/98/14/07/1044981407.db2.gz DZDRBLPKMVBODH-UHFFFAOYSA-N 1 2 314.404 4.401 20 0 DIADLO CC(C)(C)c1cc(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)no1 ZINC000574944783 1044981428 /nfs/dbraw/zinc/98/14/28/1044981428.db2.gz DZDRBLPKMVBODH-UHFFFAOYSA-N 1 2 314.404 4.401 20 0 DIADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C(C)(C)c1ccccc1 ZINC000373709188 1045003235 /nfs/dbraw/zinc/00/32/35/1045003235.db2.gz YJBLEEQURBDEFO-UHFFFAOYSA-N 1 2 319.408 4.301 20 0 DIADLO Cc1ccoc1C[NH2+][C@H](C(=O)Nc1ccccc1)c1ccccc1 ZINC000525195810 1045009358 /nfs/dbraw/zinc/00/93/58/1045009358.db2.gz OSXZRIGQKRBLGW-IBGZPJMESA-N 1 2 320.392 4.058 20 0 DIADLO COc1cc(C)[nH+]c(CN[C@H](c2cccc(C)c2)C(F)(F)F)c1 ZINC000411499370 1045012710 /nfs/dbraw/zinc/01/27/10/1045012710.db2.gz CQXONXLCCQIUSA-MRXNPFEDSA-N 1 2 324.346 4.100 20 0 DIADLO Cc1nnc([C@H](C)[NH2+]C(c2ccccc2C)c2ccccc2C)[nH]1 ZINC000411529281 1045015059 /nfs/dbraw/zinc/01/50/59/1045015059.db2.gz SGFFNBXVMLZIPE-HNNXBMFYSA-N 1 2 320.440 4.170 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]C(c2ccccc2C)c2ccccc2C)[nH]1 ZINC000411529286 1045016975 /nfs/dbraw/zinc/01/69/75/1045016975.db2.gz SGFFNBXVMLZIPE-OAHLLOKOSA-N 1 2 320.440 4.170 20 0 DIADLO CCc1nc(C[N@@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000525272710 1045019711 /nfs/dbraw/zinc/01/97/11/1045019711.db2.gz OCUSPGCLYPLLPF-LRDDRELGSA-N 1 2 304.434 4.428 20 0 DIADLO CCc1nc(C[N@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000525272710 1045019720 /nfs/dbraw/zinc/01/97/20/1045019720.db2.gz OCUSPGCLYPLLPF-LRDDRELGSA-N 1 2 304.434 4.428 20 0 DIADLO Cc1nnc([C@@H](C)[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)[nH]1 ZINC000411824570 1045029420 /nfs/dbraw/zinc/02/94/20/1045029420.db2.gz QRNPTFGHFCLLQA-PBHICJAKSA-N 1 2 310.445 4.182 20 0 DIADLO Cc1nnc([C@@H](C)[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)[nH]1 ZINC000411824570 1045029432 /nfs/dbraw/zinc/02/94/32/1045029432.db2.gz QRNPTFGHFCLLQA-PBHICJAKSA-N 1 2 310.445 4.182 20 0 DIADLO C(=C\C1CCCC1)\c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000576159283 1045038843 /nfs/dbraw/zinc/03/88/43/1045038843.db2.gz SCXGMSOQNVMKMG-HJWRWDBZSA-N 1 2 320.396 4.185 20 0 DIADLO COc1ccccc1[C@@H](C)[NH2+][C@@H](COCC(C)C)c1ccco1 ZINC000152583875 1045044594 /nfs/dbraw/zinc/04/45/94/1045044594.db2.gz YDWMGLHDDNXXNU-WBVHZDCISA-N 1 2 317.429 4.353 20 0 DIADLO CC[N@H+](Cc1ncc(-c2ccccc2F)o1)Cc1occc1C ZINC000412031436 1045049648 /nfs/dbraw/zinc/04/96/48/1045049648.db2.gz XYLIWVLIHIPSPP-UHFFFAOYSA-N 1 2 314.360 4.404 20 0 DIADLO CC[N@@H+](Cc1ncc(-c2ccccc2F)o1)Cc1occc1C ZINC000412031436 1045049660 /nfs/dbraw/zinc/04/96/60/1045049660.db2.gz XYLIWVLIHIPSPP-UHFFFAOYSA-N 1 2 314.360 4.404 20 0 DIADLO CC[N@H+](Cc1ncc(-c2cccs2)o1)Cc1occc1C ZINC000412027107 1045049948 /nfs/dbraw/zinc/04/99/48/1045049948.db2.gz OAMIRWWMZHTLQO-UHFFFAOYSA-N 1 2 302.399 4.327 20 0 DIADLO CC[N@@H+](Cc1ncc(-c2cccs2)o1)Cc1occc1C ZINC000412027107 1045049957 /nfs/dbraw/zinc/04/99/57/1045049957.db2.gz OAMIRWWMZHTLQO-UHFFFAOYSA-N 1 2 302.399 4.327 20 0 DIADLO CC[N@H+](Cc1occc1C)[C@H](C)c1nnc(-c2ccccc2)o1 ZINC000412047861 1045051452 /nfs/dbraw/zinc/05/14/52/1045051452.db2.gz VNTKYTGHEMEDGF-CQSZACIVSA-N 1 2 311.385 4.221 20 0 DIADLO CC[N@@H+](Cc1occc1C)[C@H](C)c1nnc(-c2ccccc2)o1 ZINC000412047861 1045051462 /nfs/dbraw/zinc/05/14/62/1045051462.db2.gz VNTKYTGHEMEDGF-CQSZACIVSA-N 1 2 311.385 4.221 20 0 DIADLO CC(C)n1ccnc1C[N@@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000374507155 1045066070 /nfs/dbraw/zinc/06/60/70/1045066070.db2.gz QPQMAOTYSULUEF-ZDUSSCGKSA-N 1 2 315.383 4.019 20 0 DIADLO CC(C)n1ccnc1C[N@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000374507155 1045066087 /nfs/dbraw/zinc/06/60/87/1045066087.db2.gz QPQMAOTYSULUEF-ZDUSSCGKSA-N 1 2 315.383 4.019 20 0 DIADLO C[N@H+](Cc1cnc(C(C)(C)C)s1)Cc1cc(F)cc(F)c1 ZINC000446978534 1045079437 /nfs/dbraw/zinc/07/94/37/1045079437.db2.gz YANBGPRZXDAWPM-UHFFFAOYSA-N 1 2 310.413 4.351 20 0 DIADLO C[N@@H+](Cc1cnc(C(C)(C)C)s1)Cc1cc(F)cc(F)c1 ZINC000446978534 1045079452 /nfs/dbraw/zinc/07/94/52/1045079452.db2.gz YANBGPRZXDAWPM-UHFFFAOYSA-N 1 2 310.413 4.351 20 0 DIADLO CC[N@H+](Cc1nnc(C(C)C)[nH]1)Cc1ccc2ccccc2c1 ZINC000428467306 1045091956 /nfs/dbraw/zinc/09/19/56/1045091956.db2.gz XXRPMJPBFAUALW-UHFFFAOYSA-N 1 2 308.429 4.103 20 0 DIADLO CC[N@@H+](Cc1nnc(C(C)C)[nH]1)Cc1ccc2ccccc2c1 ZINC000428467306 1045091965 /nfs/dbraw/zinc/09/19/65/1045091965.db2.gz XXRPMJPBFAUALW-UHFFFAOYSA-N 1 2 308.429 4.103 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000428469344 1045099495 /nfs/dbraw/zinc/09/94/95/1045099495.db2.gz JKMGVDFNSTWNEY-KDOFPFPSSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000428469344 1045099507 /nfs/dbraw/zinc/09/95/07/1045099507.db2.gz JKMGVDFNSTWNEY-KDOFPFPSSA-N 1 2 314.429 4.068 20 0 DIADLO Cc1noc([C@@H]2CCCC[N@@H+]2Cc2ccc(C(C)(C)C)s2)n1 ZINC000577146773 1045105312 /nfs/dbraw/zinc/10/53/12/1045105312.db2.gz MIYSIXHUBDOCBZ-AWEZNQCLSA-N 1 2 319.474 4.464 20 0 DIADLO Cc1noc([C@@H]2CCCC[N@H+]2Cc2ccc(C(C)(C)C)s2)n1 ZINC000577146773 1045105321 /nfs/dbraw/zinc/10/53/21/1045105321.db2.gz MIYSIXHUBDOCBZ-AWEZNQCLSA-N 1 2 319.474 4.464 20 0 DIADLO Cc1cc(C[N@H+](Cc2ccccc2)Cc2ccc(F)cc2)on1 ZINC000577238820 1045108993 /nfs/dbraw/zinc/10/89/93/1045108993.db2.gz QBGYPENYXJYFJL-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO Cc1cc(C[N@@H+](Cc2ccccc2)Cc2ccc(F)cc2)on1 ZINC000577238820 1045109003 /nfs/dbraw/zinc/10/90/03/1045109003.db2.gz QBGYPENYXJYFJL-UHFFFAOYSA-N 1 2 310.372 4.325 20 0 DIADLO CC(C)c1nc(C[NH2+]Cc2ccc(F)c(F)c2)c2ccccn21 ZINC000577406334 1045121043 /nfs/dbraw/zinc/12/10/43/1045121043.db2.gz RJKFSMVHHFDQNZ-UHFFFAOYSA-N 1 2 315.367 4.026 20 0 DIADLO Cc1ccc(CC[C@H](C)Nc2ccc(Cn3cc[nH+]c3)cn2)cc1 ZINC000577442968 1045125069 /nfs/dbraw/zinc/12/50/69/1045125069.db2.gz GPMRFCOPPYQENE-KRWDZBQOSA-N 1 2 320.440 4.068 20 0 DIADLO CC[C@@H]1C[N@@H+]([C@@H](C)c2ccccc2Br)C[C@H](C)O1 ZINC000600702763 1045131012 /nfs/dbraw/zinc/13/10/12/1045131012.db2.gz ZURCNFHFAFFJNE-RWMBFGLXSA-N 1 2 312.251 4.009 20 0 DIADLO CC[C@@H]1C[N@H+]([C@@H](C)c2ccccc2Br)C[C@H](C)O1 ZINC000600702763 1045131019 /nfs/dbraw/zinc/13/10/19/1045131019.db2.gz ZURCNFHFAFFJNE-RWMBFGLXSA-N 1 2 312.251 4.009 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@H](c3cccs3)C2)cc1Cl ZINC000447738330 1045173217 /nfs/dbraw/zinc/17/32/17/1045173217.db2.gz FETDVOUHHXVXRU-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@H](c3cccs3)C2)cc1Cl ZINC000447738330 1045173221 /nfs/dbraw/zinc/17/32/21/1045173221.db2.gz FETDVOUHHXVXRU-HNNXBMFYSA-N 1 2 307.846 4.283 20 0 DIADLO C=Cn1cc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)cn1 ZINC000447739974 1045173412 /nfs/dbraw/zinc/17/34/12/1045173412.db2.gz IUSGACIHXXMRJI-UHFFFAOYSA-N 1 2 317.383 4.207 20 0 DIADLO C=Cn1cc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)cn1 ZINC000447739974 1045173418 /nfs/dbraw/zinc/17/34/18/1045173418.db2.gz IUSGACIHXXMRJI-UHFFFAOYSA-N 1 2 317.383 4.207 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000447850120 1045181807 /nfs/dbraw/zinc/18/18/07/1045181807.db2.gz LKDJXNGPZZFVIN-PBHICJAKSA-N 1 2 314.429 4.150 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000447850120 1045181812 /nfs/dbraw/zinc/18/18/12/1045181812.db2.gz LKDJXNGPZZFVIN-PBHICJAKSA-N 1 2 314.429 4.150 20 0 DIADLO Cc1cccc(COc2ccc(C[NH2+][C@H](C)c3ncco3)cc2)c1 ZINC000924653041 1045188072 /nfs/dbraw/zinc/18/80/72/1045188072.db2.gz NPWLFORWSOEHBE-MRXNPFEDSA-N 1 2 322.408 4.413 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@H](C)c1ccccc1OC(C)C ZINC000924692128 1045188974 /nfs/dbraw/zinc/18/89/74/1045188974.db2.gz LBJRJFVJGZIPAP-CZUORRHYSA-N 1 2 314.429 4.498 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1c(Cl)ccc(F)c1Cl)c1ccnnc1 ZINC000924719905 1045194958 /nfs/dbraw/zinc/19/49/58/1045194958.db2.gz BGIKKHFBHONXEQ-BDAKNGLRSA-N 1 2 314.191 4.334 20 0 DIADLO Cc1nc(C[NH2+][C@@H](Cc2ccccc2C)c2ccco2)cs1 ZINC000924723950 1045195192 /nfs/dbraw/zinc/19/51/92/1045195192.db2.gz VTFOAQMNSGJPBZ-KRWDZBQOSA-N 1 2 312.438 4.427 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cccc(OC)n1 ZINC000924721065 1045195294 /nfs/dbraw/zinc/19/52/94/1045195294.db2.gz NFEFFNZTQWLJMH-FZMZJTMJSA-N 1 2 306.356 4.170 20 0 DIADLO CC(C)n1cc([C@@H](C)[NH2+][C@H](C)c2ccc(F)c(Cl)c2)nn1 ZINC000924768112 1045197131 /nfs/dbraw/zinc/19/71/31/1045197131.db2.gz FAXNTDRBPDQNRL-GHMZBOCLSA-N 1 2 310.804 4.063 20 0 DIADLO CCn1nc(C)c([C@H](C)[NH2+][C@H](C)c2oc3ccccc3c2C)n1 ZINC000924773327 1045198584 /nfs/dbraw/zinc/19/85/84/1045198584.db2.gz OTBUSEMMIUBFQN-GXTWGEPZSA-N 1 2 312.417 4.073 20 0 DIADLO Cc1nc2c(o1)CCC[C@@H]2[NH2+][C@H]1CCSc2ccc(F)cc21 ZINC000924808376 1045199356 /nfs/dbraw/zinc/19/93/56/1045199356.db2.gz BNICEVBDTNCDII-KBPBESRZSA-N 1 2 318.417 4.326 20 0 DIADLO Cc1cncc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3n2C)c1 ZINC000527191288 1045199970 /nfs/dbraw/zinc/19/99/70/1045199970.db2.gz ZSPNMCDSRLMXLN-IBGZPJMESA-N 1 2 320.440 4.004 20 0 DIADLO Cc1cncc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3n2C)c1 ZINC000527191288 1045199977 /nfs/dbraw/zinc/19/99/77/1045199977.db2.gz ZSPNMCDSRLMXLN-IBGZPJMESA-N 1 2 320.440 4.004 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+]([C@@H](C)c2ccc(F)c(F)c2)CCO1 ZINC000578060067 1045204292 /nfs/dbraw/zinc/20/42/92/1045204292.db2.gz DGMDDOHYUXHENQ-LIRRHRJNSA-N 1 2 317.379 4.408 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+]([C@@H](C)c2ccc(F)c(F)c2)CCO1 ZINC000578060067 1045204303 /nfs/dbraw/zinc/20/43/03/1045204303.db2.gz DGMDDOHYUXHENQ-LIRRHRJNSA-N 1 2 317.379 4.408 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(-c2ccc3c(c2)CCO3)cc1)c1ncco1 ZINC000924872325 1045207436 /nfs/dbraw/zinc/20/74/36/1045207436.db2.gz ZKDXUTQLSOOQTP-AWEZNQCLSA-N 1 2 320.392 4.127 20 0 DIADLO CCCc1ccc([C@@H]([NH2+][C@@H](C)c2noc(C)n2)C(C)C)cc1 ZINC000578101771 1045208539 /nfs/dbraw/zinc/20/85/39/1045208539.db2.gz YJKDULMRKUGNEJ-GUYCJALGSA-N 1 2 301.434 4.378 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@@H]2CCCc3c(Cl)ccnc32)n1 ZINC000924925528 1045211035 /nfs/dbraw/zinc/21/10/35/1045211035.db2.gz MXDMPORQMNJLMB-GXFFZTMASA-N 1 2 307.850 4.228 20 0 DIADLO CC[C@@H]([NH2+][C@@H](c1nccn1C)c1ccccc1)c1cccc(F)c1 ZINC000527348638 1045217585 /nfs/dbraw/zinc/21/75/85/1045217585.db2.gz LDGAGQWHOYSGDN-RTBURBONSA-N 1 2 323.415 4.390 20 0 DIADLO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1csc(-c2ccccc2)n1 ZINC000578169022 1045217755 /nfs/dbraw/zinc/21/77/55/1045217755.db2.gz JYXTYHTZQROERD-SCLBCKFNSA-N 1 2 322.433 4.422 20 0 DIADLO Cc1c[nH+]c(CCSCc2cc3ccccc3[nH]c2=O)c(C)c1 ZINC000578193324 1045219704 /nfs/dbraw/zinc/21/97/04/1045219704.db2.gz RSXLINXPPXJBPN-UHFFFAOYSA-N 1 2 324.449 4.428 20 0 DIADLO CC(C)(C)c1cnc(C[NH+]2CCC(C(F)(F)F)CC2)s1 ZINC000448226126 1045220794 /nfs/dbraw/zinc/22/07/94/1045220794.db2.gz YGNAXEIBBDSNDZ-UHFFFAOYSA-N 1 2 306.397 4.215 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000448220660 1045220883 /nfs/dbraw/zinc/22/08/83/1045220883.db2.gz RCJJXXHIVHGSDA-CQSZACIVSA-N 1 2 303.475 4.116 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1ncc(C(C)(C)C)s1 ZINC000448220660 1045220892 /nfs/dbraw/zinc/22/08/92/1045220892.db2.gz RCJJXXHIVHGSDA-CQSZACIVSA-N 1 2 303.475 4.116 20 0 DIADLO COc1cc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2Cl)on1 ZINC000925093863 1045226236 /nfs/dbraw/zinc/22/62/36/1045226236.db2.gz TWDYICRPBIJTLF-RKDXNWHRSA-N 1 2 315.200 4.402 20 0 DIADLO CC(C)n1ccc(C[NH2+][C@H](C)c2csc(C(F)(F)F)c2)n1 ZINC000925108364 1045228304 /nfs/dbraw/zinc/22/83/04/1045228304.db2.gz VQBJGDNMQQRVDD-SNVBAGLBSA-N 1 2 317.380 4.395 20 0 DIADLO c1nnc([C@H]([NH2+]C2CCC3(CCCCC3)CC2)c2ccccc2)[nH]1 ZINC000527506080 1045229841 /nfs/dbraw/zinc/22/98/41/1045229841.db2.gz YUXXBHSLKVGDOE-GOSISDBHSA-N 1 2 324.472 4.377 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2ncc(C(C)(C)C)s2)cc1C ZINC000448346083 1045239428 /nfs/dbraw/zinc/23/94/28/1045239428.db2.gz WYNVBWBSPPVEST-UHFFFAOYSA-N 1 2 318.486 4.390 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2ncc(C(C)(C)C)s2)cc1C ZINC000448346083 1045239441 /nfs/dbraw/zinc/23/94/41/1045239441.db2.gz WYNVBWBSPPVEST-UHFFFAOYSA-N 1 2 318.486 4.390 20 0 DIADLO CCCCN(C(=O)[C@@H]1CCCc2[nH+]c[nH]c21)[C@@H]1CCC[C@H](C)C1 ZINC000578392405 1045239732 /nfs/dbraw/zinc/23/97/32/1045239732.db2.gz VRFUKZVZWHCOQE-ARFHVFGLSA-N 1 2 317.477 4.037 20 0 DIADLO Cc1nn(C[N@@H+]2CCC[C@@H]2c2ccccc2C)c(=S)s1 ZINC000048621882 1045251259 /nfs/dbraw/zinc/25/12/59/1045251259.db2.gz ICHXQQSBRJFOSC-CQSZACIVSA-N 1 2 305.472 4.086 20 0 DIADLO Cc1nn(C[N@H+]2CCC[C@@H]2c2ccccc2C)c(=S)s1 ZINC000048621882 1045251269 /nfs/dbraw/zinc/25/12/69/1045251269.db2.gz ICHXQQSBRJFOSC-CQSZACIVSA-N 1 2 305.472 4.086 20 0 DIADLO CC(C)c1nnc([C@@H](C)[NH2+][C@H]2CCc3cc(F)c(Cl)cc32)[nH]1 ZINC000527875442 1045275105 /nfs/dbraw/zinc/27/51/05/1045275105.db2.gz DACQAXIQKJBIFM-OTYXRUKQSA-N 1 2 322.815 4.059 20 0 DIADLO C[C@@H]1CCCC[C@H]1c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000578858555 1045276982 /nfs/dbraw/zinc/27/69/82/1045276982.db2.gz SINAMZMWIYHGNG-RHSMWYFYSA-N 1 2 322.412 4.275 20 0 DIADLO COc1ccc[nH+]c1NCc1cccc(COC(C)(C)C)c1 ZINC000527877026 1045277091 /nfs/dbraw/zinc/27/70/91/1045277091.db2.gz RUHAOFSSBARLFW-UHFFFAOYSA-N 1 2 300.402 4.017 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1c(C)noc1C ZINC000578959398 1045285210 /nfs/dbraw/zinc/28/52/10/1045285210.db2.gz AOSHHOVBSNLVSF-GFCCVEGCSA-N 1 2 307.463 4.286 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1ccccc1Br ZINC000528035191 1045296166 /nfs/dbraw/zinc/29/61/66/1045296166.db2.gz DTRXUQVSDOLEFF-QWRGUYRKSA-N 1 2 323.209 4.395 20 0 DIADLO c1cn(Cc2cccc(-c3noc([C@@H]4CCCC45CC5)n3)c2)c[nH+]1 ZINC000528097080 1045302735 /nfs/dbraw/zinc/30/27/35/1045302735.db2.gz BTJJHBDZVHGEQR-INIZCTEOSA-N 1 2 320.396 4.029 20 0 DIADLO C[C@H]1CCC[C@H](c2noc(-c3ccc(Cn4cc[nH+]c4)cc3)n2)C1 ZINC000579299354 1045306441 /nfs/dbraw/zinc/30/64/41/1045306441.db2.gz TZYASWIFLVKPNR-YOEHRIQHSA-N 1 2 322.412 4.275 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1cc(C(C)(C)C)on1 ZINC000579531232 1045321442 /nfs/dbraw/zinc/32/14/42/1045321442.db2.gz WWCHIFWTGJWUDD-MRXNPFEDSA-N 1 2 301.434 4.038 20 0 DIADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1cc(C(C)(C)C)on1 ZINC000579531232 1045321448 /nfs/dbraw/zinc/32/14/48/1045321448.db2.gz WWCHIFWTGJWUDD-MRXNPFEDSA-N 1 2 301.434 4.038 20 0 DIADLO C=C(C)[C@@H]([NH2+]Cc1cccc(Cl)n1)c1ccc(F)c(F)c1 ZINC000187772429 1045330980 /nfs/dbraw/zinc/33/09/80/1045330980.db2.gz RNUIIPWNMDBCKP-MRXNPFEDSA-N 1 2 308.759 4.420 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccnn2C2CCCC2)s1 ZINC000449032225 1045335962 /nfs/dbraw/zinc/33/59/62/1045335962.db2.gz YTBRJEDGCQDOPS-ZDUSSCGKSA-N 1 2 318.490 4.265 20 0 DIADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccnn2C2CCCC2)s1 ZINC000449032225 1045335966 /nfs/dbraw/zinc/33/59/66/1045335966.db2.gz YTBRJEDGCQDOPS-ZDUSSCGKSA-N 1 2 318.490 4.265 20 0 DIADLO Cc1cc(N[C@H](c2ncc[nH]2)c2ccc(F)cc2)ccc1[NH+](C)C ZINC000188400235 1045336467 /nfs/dbraw/zinc/33/64/67/1045336467.db2.gz JZURVOGQNYPHID-SFHVURJKSA-N 1 2 324.403 4.125 20 0 DIADLO C[C@H]1CN(c2ccc([NH2+][C@@H]3CCC34CCCC4)cc2)CCO1 ZINC000189213355 1045343860 /nfs/dbraw/zinc/34/38/60/1045343860.db2.gz ZYFHQLXCLHHGKC-MAUKXSAKSA-N 1 2 300.446 4.046 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1cc(CO)ccc1F ZINC000528352777 1045343976 /nfs/dbraw/zinc/34/39/76/1045343976.db2.gz FADQZTONNADMHN-GFCCVEGCSA-N 1 2 307.796 4.164 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1cc(CO)ccc1F ZINC000528352777 1045343977 /nfs/dbraw/zinc/34/39/77/1045343977.db2.gz FADQZTONNADMHN-GFCCVEGCSA-N 1 2 307.796 4.164 20 0 DIADLO Fc1ccc(F)c(C[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000449124580 1045349789 /nfs/dbraw/zinc/34/97/89/1045349789.db2.gz GXBXXCOZKWMCCR-ZDUSSCGKSA-N 1 2 313.269 4.159 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cccnc2C(F)(F)F)[C@H]1c1ccccc1 ZINC000528393827 1045350337 /nfs/dbraw/zinc/35/03/37/1045350337.db2.gz GYHAFSIHRAHULZ-IUODEOHRSA-N 1 2 306.331 4.293 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cccnc2C(F)(F)F)[C@H]1c1ccccc1 ZINC000528393827 1045350341 /nfs/dbraw/zinc/35/03/41/1045350341.db2.gz GYHAFSIHRAHULZ-IUODEOHRSA-N 1 2 306.331 4.293 20 0 DIADLO O=C(C[C@H]1CCC[N@H+]1Cc1ncccc1Cl)c1cccs1 ZINC000528427580 1045353295 /nfs/dbraw/zinc/35/32/95/1045353295.db2.gz WDEIZZOONYWQOK-GFCCVEGCSA-N 1 2 320.845 4.034 20 0 DIADLO O=C(C[C@H]1CCC[N@@H+]1Cc1ncccc1Cl)c1cccs1 ZINC000528427580 1045353301 /nfs/dbraw/zinc/35/33/01/1045353301.db2.gz WDEIZZOONYWQOK-GFCCVEGCSA-N 1 2 320.845 4.034 20 0 DIADLO COc1cc2ccccc2cc1C[NH2+]Cc1nc(C2CC2)cs1 ZINC000449188395 1045360230 /nfs/dbraw/zinc/36/02/30/1045360230.db2.gz LMMGUPPYYJBSHE-UHFFFAOYSA-N 1 2 324.449 4.472 20 0 DIADLO CC(C)CC[C@@H]1CC[C@@H]([NH2+][C@H](c2nnc[nH]2)c2ccccc2)C1 ZINC000449239980 1045368583 /nfs/dbraw/zinc/36/85/83/1045368583.db2.gz XGWXLRIQNSIQDP-NXHRZFHOSA-N 1 2 312.461 4.089 20 0 DIADLO Cn1cc(C[N@@H+]2CCC[C@](C)(F)C2)c(-c2ccccc2Cl)n1 ZINC000449346881 1045379223 /nfs/dbraw/zinc/37/92/23/1045379223.db2.gz ARYHJKICXREIPT-KRWDZBQOSA-N 1 2 321.827 4.065 20 0 DIADLO Cn1cc(C[N@H+]2CCC[C@](C)(F)C2)c(-c2ccccc2Cl)n1 ZINC000449346881 1045379225 /nfs/dbraw/zinc/37/92/25/1045379225.db2.gz ARYHJKICXREIPT-KRWDZBQOSA-N 1 2 321.827 4.065 20 0 DIADLO C[C@H]1C[N@H+](CCOC2CCCCCC2)C[C@@H](c2ccsc2)O1 ZINC000470196410 1045380350 /nfs/dbraw/zinc/38/03/50/1045380350.db2.gz UWRATSFWGQTFKS-YJBOKZPZSA-N 1 2 323.502 4.249 20 0 DIADLO C[C@H]1C[N@@H+](CCOC2CCCCCC2)C[C@@H](c2ccsc2)O1 ZINC000470196410 1045380354 /nfs/dbraw/zinc/38/03/54/1045380354.db2.gz UWRATSFWGQTFKS-YJBOKZPZSA-N 1 2 323.502 4.249 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC2CC1(c1nc(C)no1)C2 ZINC000528630533 1045390590 /nfs/dbraw/zinc/39/05/90/1045390590.db2.gz FAJHTVPQDYPUKI-YAJUMTOWSA-N 1 2 317.820 4.104 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC2CC1(c1nc(C)no1)C2 ZINC000528630533 1045390592 /nfs/dbraw/zinc/39/05/92/1045390592.db2.gz FAJHTVPQDYPUKI-YAJUMTOWSA-N 1 2 317.820 4.104 20 0 DIADLO CC(C)c1cnc(C[N@@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)s1 ZINC000449456895 1045395722 /nfs/dbraw/zinc/39/57/22/1045395722.db2.gz DTMWATBLKDFGDM-GHMZBOCLSA-N 1 2 306.397 4.429 20 0 DIADLO CC(C)c1cnc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)s1 ZINC000449456895 1045395725 /nfs/dbraw/zinc/39/57/25/1045395725.db2.gz DTMWATBLKDFGDM-GHMZBOCLSA-N 1 2 306.397 4.429 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000449458857 1045396021 /nfs/dbraw/zinc/39/60/21/1045396021.db2.gz JHJWUVWJROBNMW-KBPBESRZSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000449458857 1045396026 /nfs/dbraw/zinc/39/60/26/1045396026.db2.gz JHJWUVWJROBNMW-KBPBESRZSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000449460050 1045396135 /nfs/dbraw/zinc/39/61/35/1045396135.db2.gz MDSSVTKERIQBLI-MWLCHTKSSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1csc(C2CC2)n1 ZINC000449460050 1045396138 /nfs/dbraw/zinc/39/61/38/1045396138.db2.gz MDSSVTKERIQBLI-MWLCHTKSSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C2CC2)n1 ZINC000449460052 1045396230 /nfs/dbraw/zinc/39/62/30/1045396230.db2.gz MDSSVTKERIQBLI-ONGXEEELSA-N 1 2 304.381 4.183 20 0 DIADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1csc(C2CC2)n1 ZINC000449460052 1045396238 /nfs/dbraw/zinc/39/62/38/1045396238.db2.gz MDSSVTKERIQBLI-ONGXEEELSA-N 1 2 304.381 4.183 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2(C)C)no1 ZINC000528767369 1045411543 /nfs/dbraw/zinc/41/15/43/1045411543.db2.gz KAJBWPWQDQEKMA-OAHLLOKOSA-N 1 2 317.408 4.100 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2(C)C)no1 ZINC000528767369 1045411549 /nfs/dbraw/zinc/41/15/49/1045411549.db2.gz KAJBWPWQDQEKMA-OAHLLOKOSA-N 1 2 317.408 4.100 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1ncc(-c2cccc(F)c2)o1 ZINC000528771596 1045412634 /nfs/dbraw/zinc/41/26/34/1045412634.db2.gz YFSVGVLIOPUZNV-LLVKDONJSA-N 1 2 310.319 4.100 20 0 DIADLO C[C@@H]1CC(F)(F)CC[N@H+]1Cc1ncc(-c2cccc(F)c2)o1 ZINC000528771596 1045412637 /nfs/dbraw/zinc/41/26/37/1045412637.db2.gz YFSVGVLIOPUZNV-LLVKDONJSA-N 1 2 310.319 4.100 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000528792960 1045415460 /nfs/dbraw/zinc/41/54/60/1045415460.db2.gz ISQHJUBKBINNMB-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H](c1cccnc1)[N@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000528792960 1045415464 /nfs/dbraw/zinc/41/54/64/1045415464.db2.gz ISQHJUBKBINNMB-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H]1C[C@H]([NH2+]Cc2c(Cl)oc3ccccc32)c2nccn21 ZINC000449575925 1045415850 /nfs/dbraw/zinc/41/58/50/1045415850.db2.gz ZAOFMLUXZPCXIT-GWCFXTLKSA-N 1 2 301.777 4.078 20 0 DIADLO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3F)o2)c2nccn21 ZINC000449575041 1045416129 /nfs/dbraw/zinc/41/61/29/1045416129.db2.gz WSXVUNDWQOHKRG-MLGOLLRUSA-N 1 2 311.360 4.078 20 0 DIADLO Cc1ncc(C[N@@H+]2CCc3cccc(C(F)(F)F)c3C2)s1 ZINC000528796226 1045416518 /nfs/dbraw/zinc/41/65/18/1045416518.db2.gz YXWKQZVSNQGAKT-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO Cc1ncc(C[N@H+]2CCc3cccc(C(F)(F)F)c3C2)s1 ZINC000528796226 1045416523 /nfs/dbraw/zinc/41/65/23/1045416523.db2.gz YXWKQZVSNQGAKT-UHFFFAOYSA-N 1 2 312.360 4.029 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(CC(C)C)no1)c1cc(C)ccc1C ZINC000528802160 1045416600 /nfs/dbraw/zinc/41/66/00/1045416600.db2.gz RIUJPXBYCADLBA-INIZCTEOSA-N 1 2 301.434 4.126 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@@H+]1Cc1ccn(C(F)F)n1 ZINC000449730693 1045430765 /nfs/dbraw/zinc/43/07/65/1045430765.db2.gz GEIQOXGZWDGSPN-HNNXBMFYSA-N 1 2 309.335 4.063 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@H+]1Cc1ccn(C(F)F)n1 ZINC000449730693 1045430767 /nfs/dbraw/zinc/43/07/67/1045430767.db2.gz GEIQOXGZWDGSPN-HNNXBMFYSA-N 1 2 309.335 4.063 20 0 DIADLO Cc1cc(C)c(C[NH2+][C@H](CCc2ccccc2)C(F)F)cn1 ZINC000449733045 1045431153 /nfs/dbraw/zinc/43/11/53/1045431153.db2.gz FOLSSXZKUBXMSY-QGZVFWFLSA-N 1 2 304.384 4.055 20 0 DIADLO Cc1cc(CN(C)c2[nH+]ccc3cc(C(F)(F)F)ccc32)no1 ZINC000450242082 1045477895 /nfs/dbraw/zinc/47/78/95/1045477895.db2.gz NVFDKXSUAWPBAV-UHFFFAOYSA-N 1 2 321.302 4.186 20 0 DIADLO C[C@H](c1csnn1)[N@H+]1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000450247242 1045480530 /nfs/dbraw/zinc/48/05/30/1045480530.db2.gz XMZUHLCOOOBCCF-KDOFPFPSSA-N 1 2 321.449 4.247 20 0 DIADLO C[C@H](c1csnn1)[N@@H+]1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000450247242 1045480534 /nfs/dbraw/zinc/48/05/34/1045480534.db2.gz XMZUHLCOOOBCCF-KDOFPFPSSA-N 1 2 321.449 4.247 20 0 DIADLO CC(C)c1nnc(C[N@H+](C)Cc2cccc3ccccc32)s1 ZINC000450263304 1045481516 /nfs/dbraw/zinc/48/15/16/1045481516.db2.gz BFZOJLQRDBYWSR-UHFFFAOYSA-N 1 2 311.454 4.447 20 0 DIADLO CC(C)c1nnc(C[N@@H+](C)Cc2cccc3ccccc32)s1 ZINC000450263304 1045481519 /nfs/dbraw/zinc/48/15/19/1045481519.db2.gz BFZOJLQRDBYWSR-UHFFFAOYSA-N 1 2 311.454 4.447 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nnc(C(C)C)s2)c(C)c1 ZINC000450285858 1045482174 /nfs/dbraw/zinc/48/21/74/1045482174.db2.gz NAQAZXJFEXKLBX-CQSZACIVSA-N 1 2 303.475 4.471 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2nnc(C(C)C)s2)c(C)c1 ZINC000450285858 1045482176 /nfs/dbraw/zinc/48/21/76/1045482176.db2.gz NAQAZXJFEXKLBX-CQSZACIVSA-N 1 2 303.475 4.471 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2nnc(C(C)C)s2)c1 ZINC000450287960 1045483293 /nfs/dbraw/zinc/48/32/93/1045483293.db2.gz PWUDQQHOOUBWBM-OAHLLOKOSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2nnc(C(C)C)s2)c1 ZINC000450287960 1045483295 /nfs/dbraw/zinc/48/32/95/1045483295.db2.gz PWUDQQHOOUBWBM-OAHLLOKOSA-N 1 2 301.459 4.307 20 0 DIADLO Cc1ncc(C[N@@H+](C)Cc2ccsc2C(F)(F)F)s1 ZINC000529525357 1045490382 /nfs/dbraw/zinc/49/03/82/1045490382.db2.gz SQZSSJSCVUIZRM-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO Cc1ncc(C[N@H+](C)Cc2ccsc2C(F)(F)F)s1 ZINC000529525357 1045490384 /nfs/dbraw/zinc/49/03/84/1045490384.db2.gz SQZSSJSCVUIZRM-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO CC[C@H](O)CCCNc1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000450346655 1045492988 /nfs/dbraw/zinc/49/29/88/1045492988.db2.gz FKWZCSJGVWCDKK-ZDUSSCGKSA-N 1 2 312.335 4.217 20 0 DIADLO FC(F)(F)c1sccc1C[N@H+](Cc1cccnc1)C1CC1 ZINC000529566181 1045497950 /nfs/dbraw/zinc/49/79/50/1045497950.db2.gz KPSALPHTLWTLCR-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO FC(F)(F)c1sccc1C[N@@H+](Cc1cccnc1)C1CC1 ZINC000529566181 1045497952 /nfs/dbraw/zinc/49/79/52/1045497952.db2.gz KPSALPHTLWTLCR-UHFFFAOYSA-N 1 2 312.360 4.327 20 0 DIADLO Cc1ccccc1C1CC[NH+](Cc2nnc(C3CC3)s2)CC1 ZINC000450391802 1045499711 /nfs/dbraw/zinc/49/97/11/1045499711.db2.gz RONYGOAXLLZBDH-UHFFFAOYSA-N 1 2 313.470 4.104 20 0 DIADLO Fc1ccc(F)c(C[NH+]2CCC(OC3CCC3)CC2)c1Cl ZINC000529608472 1045499970 /nfs/dbraw/zinc/49/99/70/1045499970.db2.gz VTDLDRBIFJAJRM-UHFFFAOYSA-N 1 2 315.791 4.152 20 0 DIADLO C[C@H](CO)CCCNc1[nH+]ccc2cc(C(F)(F)F)ccc21 ZINC000450413245 1045503606 /nfs/dbraw/zinc/50/36/06/1045503606.db2.gz UBVKOJDCDZEARD-NSHDSACASA-N 1 2 312.335 4.074 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2nnc(C3CC3)s2)cc1 ZINC000450436808 1045504453 /nfs/dbraw/zinc/50/44/53/1045504453.db2.gz RNNDDKOAAWSCPB-MRXNPFEDSA-N 1 2 313.470 4.451 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2nnc(C3CC3)s2)cc1 ZINC000450436808 1045504459 /nfs/dbraw/zinc/50/44/59/1045504459.db2.gz RNNDDKOAAWSCPB-MRXNPFEDSA-N 1 2 313.470 4.451 20 0 DIADLO FC(F)(F)c1ccc2c(cc[nH+]c2NCC[C@H]2CCOC2)c1 ZINC000450442235 1045505705 /nfs/dbraw/zinc/50/57/05/1045505705.db2.gz SCYSIOXOZDLMTK-NSHDSACASA-N 1 2 310.319 4.092 20 0 DIADLO O=C(Nc1cccc(C2CCCCC2)c1)[C@@H]1CCc2c[nH+]cn2C1 ZINC000529649536 1045507775 /nfs/dbraw/zinc/50/77/75/1045507775.db2.gz PQUSEHVFMPNSLQ-QGZVFWFLSA-N 1 2 323.440 4.132 20 0 DIADLO FC(F)(F)c1cscc1C[NH+]1CC(Cc2ccco2)C1 ZINC000529649129 1045507882 /nfs/dbraw/zinc/50/78/82/1045507882.db2.gz OTOCVFXOVYHVQO-UHFFFAOYSA-N 1 2 301.333 4.034 20 0 DIADLO CC(C)(C)[N@H+](Cc1nnc(C2CC2)s1)Cc1ccccc1 ZINC000450494788 1045512514 /nfs/dbraw/zinc/51/25/14/1045512514.db2.gz OTZYQYMFWLGMGW-UHFFFAOYSA-N 1 2 301.459 4.216 20 0 DIADLO CC(C)(C)[N@@H+](Cc1nnc(C2CC2)s1)Cc1ccccc1 ZINC000450494788 1045512520 /nfs/dbraw/zinc/51/25/20/1045512520.db2.gz OTZYQYMFWLGMGW-UHFFFAOYSA-N 1 2 301.459 4.216 20 0 DIADLO c1ccc2c(c1)CC[C@H]2[N@H+](Cc1nnc(C2CC2)s1)C1CC1 ZINC000450520089 1045515529 /nfs/dbraw/zinc/51/55/29/1045515529.db2.gz ORIBKMJFNWACHU-MRXNPFEDSA-N 1 2 311.454 4.067 20 0 DIADLO c1ccc2c(c1)CC[C@H]2[N@@H+](Cc1nnc(C2CC2)s1)C1CC1 ZINC000450520089 1045515535 /nfs/dbraw/zinc/51/55/35/1045515535.db2.gz ORIBKMJFNWACHU-MRXNPFEDSA-N 1 2 311.454 4.067 20 0 DIADLO CCC[C@@]1(CO)CCN(c2cc[nH+]c3cc(F)c(Cl)cc32)C1 ZINC000450533782 1045516589 /nfs/dbraw/zinc/51/65/89/1045516589.db2.gz XGJRCBRCVDTKCL-QGZVFWFLSA-N 1 2 322.811 4.016 20 0 DIADLO c1coc(C[N@H+](Cc2cnc(C3CC3)o2)Cc2ccccc2)c1 ZINC000628120213 1045524706 /nfs/dbraw/zinc/52/47/06/1045524706.db2.gz COGDIPYEFWYZNN-UHFFFAOYSA-N 1 2 308.381 4.347 20 0 DIADLO c1coc(C[N@@H+](Cc2cnc(C3CC3)o2)Cc2ccccc2)c1 ZINC000628120213 1045524721 /nfs/dbraw/zinc/52/47/21/1045524721.db2.gz COGDIPYEFWYZNN-UHFFFAOYSA-N 1 2 308.381 4.347 20 0 DIADLO Cc1nc(C[N@@H+](C)[C@H](C)c2cccc(C(F)(F)F)c2)[nH]c1C ZINC000628133203 1045529149 /nfs/dbraw/zinc/52/91/49/1045529149.db2.gz WHTXCAXSRYEBEU-GFCCVEGCSA-N 1 2 311.351 4.238 20 0 DIADLO Cc1nc(C[N@H+](C)[C@H](C)c2cccc(C(F)(F)F)c2)[nH]c1C ZINC000628133203 1045529161 /nfs/dbraw/zinc/52/91/61/1045529161.db2.gz WHTXCAXSRYEBEU-GFCCVEGCSA-N 1 2 311.351 4.238 20 0 DIADLO Cc1[nH]c(CN(C)[C@H](C)c2cccc(C(F)(F)F)c2)[nH+]c1C ZINC000628133203 1045529178 /nfs/dbraw/zinc/52/91/78/1045529178.db2.gz WHTXCAXSRYEBEU-GFCCVEGCSA-N 1 2 311.351 4.238 20 0 DIADLO Cc1nn(C(C)C)c(C)c1CNc1ccc([NH+](C)C)cc1C ZINC001119939534 1045530037 /nfs/dbraw/zinc/53/00/37/1045530037.db2.gz UKNLAQOAXLFSKN-UHFFFAOYSA-N 1 2 300.450 4.067 20 0 DIADLO CCC[N@H+](CC)Cn1nc2cc(C)c3ccccc3n2c1=S ZINC000750600990 1045538603 /nfs/dbraw/zinc/53/86/03/1045538603.db2.gz DFKUVDXBGOBFFE-UHFFFAOYSA-N 1 2 314.458 4.016 20 0 DIADLO CCC[N@@H+](CC)Cn1nc2cc(C)c3ccccc3n2c1=S ZINC000750600990 1045538611 /nfs/dbraw/zinc/53/86/11/1045538611.db2.gz DFKUVDXBGOBFFE-UHFFFAOYSA-N 1 2 314.458 4.016 20 0 DIADLO CC(C)Sc1ccc([C@@H](C)[NH2+][C@@H](C)c2csnn2)cc1 ZINC000450666299 1045541329 /nfs/dbraw/zinc/54/13/29/1045541329.db2.gz HJRXQVUENREECU-NEPJUHHUSA-N 1 2 307.488 4.450 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2csc(C(F)(F)F)c2)nc1 ZINC000628249759 1045556804 /nfs/dbraw/zinc/55/68/04/1045556804.db2.gz QZMKEUBMYGJINP-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2csc(C(F)(F)F)c2)nc1 ZINC000628249759 1045556817 /nfs/dbraw/zinc/55/68/17/1045556817.db2.gz QZMKEUBMYGJINP-UHFFFAOYSA-N 1 2 300.349 4.102 20 0 DIADLO Cc1nc(C[NH+]2CCC(F)(c3ccc(Cl)cc3)CC2)[nH]c1C ZINC000628260182 1045557308 /nfs/dbraw/zinc/55/73/08/1045557308.db2.gz XOBWUFDADLOONS-UHFFFAOYSA-N 1 2 321.827 4.141 20 0 DIADLO Cc1[nH]c(CN2CCC(F)(c3ccc(Cl)cc3)CC2)[nH+]c1C ZINC000628260182 1045557315 /nfs/dbraw/zinc/55/73/15/1045557315.db2.gz XOBWUFDADLOONS-UHFFFAOYSA-N 1 2 321.827 4.141 20 0 DIADLO CC(C)CCCC(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001121284814 1045559503 /nfs/dbraw/zinc/55/95/03/1045559503.db2.gz LEMDVSXMYDTPTO-MRXNPFEDSA-N 1 2 319.493 4.170 20 0 DIADLO FC1(F)CC[C@@H](C[N@@H+]2CCO[C@H](c3cccc(Cl)c3)C2)C1 ZINC000450752586 1045562569 /nfs/dbraw/zinc/56/25/69/1045562569.db2.gz GCALIIDBKDSKTR-DOMZBBRYSA-N 1 2 315.791 4.149 20 0 DIADLO FC1(F)CC[C@@H](C[N@H+]2CCO[C@H](c3cccc(Cl)c3)C2)C1 ZINC000450752586 1045562583 /nfs/dbraw/zinc/56/25/83/1045562583.db2.gz GCALIIDBKDSKTR-DOMZBBRYSA-N 1 2 315.791 4.149 20 0 DIADLO COc1cc(C[NH+]2CC(C)(CC(F)(F)F)C2)ccc1Cl ZINC000628307902 1045565324 /nfs/dbraw/zinc/56/53/24/1045565324.db2.gz JEAWADWMMWRJDU-UHFFFAOYSA-N 1 2 307.743 4.123 20 0 DIADLO Cc1c(F)c(F)ccc1NCc1cc(-n2cc[nH+]c2)cs1 ZINC001202789824 1045572548 /nfs/dbraw/zinc/57/25/48/1045572548.db2.gz ZYOSNKRCGSQDJQ-UHFFFAOYSA-N 1 2 305.353 4.133 20 0 DIADLO Cc1cc(Cl)nc(C[NH2+]Cc2nc3ccc(F)cc3s2)c1 ZINC000800284471 1045605850 /nfs/dbraw/zinc/60/58/50/1045605850.db2.gz HVLZKNLOSVWOSH-UHFFFAOYSA-N 1 2 321.808 4.082 20 0 DIADLO CC(C)c1nnc(C[N@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)s1 ZINC000451052828 1045618852 /nfs/dbraw/zinc/61/88/52/1045618852.db2.gz XENRLXWWPPKVHL-MNOVXSKESA-N 1 2 321.412 4.214 20 0 DIADLO CC(C)c1nnc(C[N@@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)s1 ZINC000451052828 1045618858 /nfs/dbraw/zinc/61/88/58/1045618858.db2.gz XENRLXWWPPKVHL-MNOVXSKESA-N 1 2 321.412 4.214 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2ccnc(Cl)c2)C1 ZINC000800472830 1045624346 /nfs/dbraw/zinc/62/43/46/1045624346.db2.gz BNPYRFWGFDLZLA-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2ccnc(Cl)c2)C1 ZINC000800472830 1045624353 /nfs/dbraw/zinc/62/43/53/1045624353.db2.gz BNPYRFWGFDLZLA-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@H+](C)[C@@H](C)c2cccc(C)c2)n1 ZINC000121669653 1045639466 /nfs/dbraw/zinc/63/94/66/1045639466.db2.gz WDGDXVRROHPDGS-KBPBESRZSA-N 1 2 319.474 4.385 20 0 DIADLO CCS[C@@H](C)c1noc(C[N@@H+](C)[C@@H](C)c2cccc(C)c2)n1 ZINC000121669653 1045639475 /nfs/dbraw/zinc/63/94/75/1045639475.db2.gz WDGDXVRROHPDGS-KBPBESRZSA-N 1 2 319.474 4.385 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2ccoc2)c2ccccc2OC)cc1 ZINC000752106314 1045660582 /nfs/dbraw/zinc/66/05/82/1045660582.db2.gz UMHFYJMUODUVBO-FQEVSTJZSA-N 1 2 323.392 4.176 20 0 DIADLO C[NH2+]c1ccc(NCc2ccc(OC)c(OC)c2Cl)cc1 ZINC000629388966 1045664950 /nfs/dbraw/zinc/66/49/50/1045664950.db2.gz GLQCXMCCXONSID-UHFFFAOYSA-N 1 2 306.793 4.011 20 0 DIADLO C[NH2+]c1ccc(NCc2cc(Cl)c3c(c2)OCCCO3)cc1 ZINC000629389979 1045665263 /nfs/dbraw/zinc/66/52/63/1045665263.db2.gz ZOLVJDFSSDPZIE-UHFFFAOYSA-N 1 2 318.804 4.155 20 0 DIADLO CCOc1ccc(CNc2ccc([NH2+]C)cc2)cc1OCC ZINC000629389778 1045665379 /nfs/dbraw/zinc/66/53/79/1045665379.db2.gz VULDVOXOYHZVFO-UHFFFAOYSA-N 1 2 300.402 4.138 20 0 DIADLO Cc1ccc([C@H]([NH2+]Cc2ncccc2F)c2ccccc2)cc1 ZINC000530476289 1045673101 /nfs/dbraw/zinc/67/31/01/1045673101.db2.gz FYKANTQIHZESCN-HXUWFJFHSA-N 1 2 306.384 4.408 20 0 DIADLO FC(F)Oc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000121827023 1045673773 /nfs/dbraw/zinc/67/37/73/1045673773.db2.gz SZHKCWVIWWVSQG-UHFFFAOYSA-N 1 2 315.323 4.086 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCC[C@H]1c1nc2ccccc2[nH]1 ZINC000451463485 1045685931 /nfs/dbraw/zinc/68/59/31/1045685931.db2.gz LERZEKYEOXHSAR-INIZCTEOSA-N 1 2 324.428 4.320 20 0 DIADLO Cc1nc(C(C)C)oc1C[N@H+]1CCC[C@H]1c1nc2ccccc2[nH]1 ZINC000451463485 1045685946 /nfs/dbraw/zinc/68/59/46/1045685946.db2.gz LERZEKYEOXHSAR-INIZCTEOSA-N 1 2 324.428 4.320 20 0 DIADLO NC(Cc1ccc(Cl)cc1)=[NH+]OCCCCC(F)(F)F ZINC000752781874 1045705508 /nfs/dbraw/zinc/70/55/08/1045705508.db2.gz UVMXWPKOBCGADK-UHFFFAOYSA-N 1 2 308.731 4.114 20 0 DIADLO C[N@@H+]1CCC(=O)C[C@H]1c1ccc(-c2cncc(C(F)F)c2)cc1 ZINC000629745716 1045708264 /nfs/dbraw/zinc/70/82/64/1045708264.db2.gz BSQDRTQNFPXHRD-KRWDZBQOSA-N 1 2 316.351 4.022 20 0 DIADLO C[N@H+]1CCC(=O)C[C@H]1c1ccc(-c2cncc(C(F)F)c2)cc1 ZINC000629745716 1045708271 /nfs/dbraw/zinc/70/82/71/1045708271.db2.gz BSQDRTQNFPXHRD-KRWDZBQOSA-N 1 2 316.351 4.022 20 0 DIADLO CCC1CCC([N@H+](C)Cc2noc(Cc3ccccc3)n2)CC1 ZINC000530666126 1045708297 /nfs/dbraw/zinc/70/82/97/1045708297.db2.gz PZVMGZBQJMHCIW-UHFFFAOYSA-N 1 2 313.445 4.061 20 0 DIADLO CCC1CCC([N@@H+](C)Cc2noc(Cc3ccccc3)n2)CC1 ZINC000530666126 1045708307 /nfs/dbraw/zinc/70/83/07/1045708307.db2.gz PZVMGZBQJMHCIW-UHFFFAOYSA-N 1 2 313.445 4.061 20 0 DIADLO Cc1csc(-c2cccc(C(=O)Nc3cc[nH+]c(C)c3)c2)n1 ZINC000122233590 1045733907 /nfs/dbraw/zinc/73/39/07/1045733907.db2.gz FOCYZQWEFDTRER-UHFFFAOYSA-N 1 2 309.394 4.074 20 0 DIADLO CCn1c2cccc(F)c2nc1/C(Cl)=C/c1[nH]c(C)c(C)[nH+]1 ZINC000901472595 1045744353 /nfs/dbraw/zinc/74/43/53/1045744353.db2.gz MQSMFCMQJNKPCS-FLIBITNWSA-N 1 2 318.783 4.272 20 0 DIADLO Cc1ccc(-c2noc(C[N@H+]3C[C@H](C)[C@@H]3c3ccccc3)n2)cc1 ZINC000530902654 1045749735 /nfs/dbraw/zinc/74/97/35/1045749735.db2.gz PQTVLNHVKDZMFR-HNAYVOBHSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccc(-c2noc(C[N@@H+]3C[C@H](C)[C@@H]3c3ccccc3)n2)cc1 ZINC000530902654 1045749743 /nfs/dbraw/zinc/74/97/43/1045749743.db2.gz PQTVLNHVKDZMFR-HNAYVOBHSA-N 1 2 319.408 4.238 20 0 DIADLO CCc1nc(C)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)o1 ZINC000451968518 1045750178 /nfs/dbraw/zinc/75/01/78/1045750178.db2.gz IVXSGJUFZGDNMI-HNNXBMFYSA-N 1 2 306.356 4.161 20 0 DIADLO CCc1nc(C)c(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)o1 ZINC000451968518 1045750196 /nfs/dbraw/zinc/75/01/96/1045750196.db2.gz IVXSGJUFZGDNMI-HNNXBMFYSA-N 1 2 306.356 4.161 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1ccc(C(F)(F)F)cc1 ZINC000078668540 1045750481 /nfs/dbraw/zinc/75/04/81/1045750481.db2.gz QBQOVYXTHVPPLY-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1ccc(C(F)(F)F)cc1 ZINC000078668540 1045750493 /nfs/dbraw/zinc/75/04/93/1045750493.db2.gz QBQOVYXTHVPPLY-UHFFFAOYSA-N 1 2 320.767 4.447 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@@H+]1Cc1nc(C(C)(C)C)no1 ZINC000451970481 1045758219 /nfs/dbraw/zinc/75/82/19/1045758219.db2.gz LQZYCNGPCCYVPI-HNNXBMFYSA-N 1 2 317.408 4.152 20 0 DIADLO Cc1cc(F)ccc1[C@@H]1CCC[N@H+]1Cc1nc(C(C)(C)C)no1 ZINC000451970481 1045758242 /nfs/dbraw/zinc/75/82/42/1045758242.db2.gz LQZYCNGPCCYVPI-HNNXBMFYSA-N 1 2 317.408 4.152 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1ccsc1C(F)F ZINC001124772503 1045761728 /nfs/dbraw/zinc/76/17/28/1045761728.db2.gz MPPRRNPVKANTFC-UHFFFAOYSA-N 1 2 319.336 4.124 20 0 DIADLO Cc1cccc([C@H](C)[NH2+]Cc2nc(CCc3ccccc3)no2)c1 ZINC000452075021 1045769161 /nfs/dbraw/zinc/76/91/61/1045769161.db2.gz BQIIZGHHJOFDTP-INIZCTEOSA-N 1 2 321.424 4.014 20 0 DIADLO C[NH+](C)c1ccc(N[C@H](c2ccc(F)cc2)c2cccnc2)cc1 ZINC000753720066 1045795358 /nfs/dbraw/zinc/79/53/58/1045795358.db2.gz KSZDOVFQVVFHAK-HXUWFJFHSA-N 1 2 321.399 4.488 20 0 DIADLO CC(C)(C)c1csc(C[NH2+]Cc2ccc(C(F)F)nc2)n1 ZINC000631065722 1045806828 /nfs/dbraw/zinc/80/68/28/1045806828.db2.gz OKTDRANIUPEUEO-UHFFFAOYSA-N 1 2 311.401 4.063 20 0 DIADLO C[C@@H]([NH2+]Cc1ccnn1CC1CCC1)c1c(F)cccc1Cl ZINC000631083686 1045813182 /nfs/dbraw/zinc/81/31/82/1045813182.db2.gz QBMGMKTVUJKVMP-GFCCVEGCSA-N 1 2 321.827 4.327 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c(F)c1 ZINC000631123671 1045822317 /nfs/dbraw/zinc/82/23/17/1045822317.db2.gz YNICETXPOKYAOW-SECBINFHSA-N 1 2 318.339 4.460 20 0 DIADLO C[C@@H](CC(=O)Nc1ccc(-c2ccccc2)cc1F)n1cc[nH+]c1 ZINC001124982316 1045824324 /nfs/dbraw/zinc/82/43/24/1045824324.db2.gz MXPYGOAIRYSXCU-AWEZNQCLSA-N 1 2 323.371 4.279 20 0 DIADLO CCCn1c(C[NH2+]Cc2cccc(F)c2F)nc2ccccc21 ZINC000631206103 1045837316 /nfs/dbraw/zinc/83/73/16/1045837316.db2.gz JGCOKHOEBNLFPA-UHFFFAOYSA-N 1 2 315.367 4.014 20 0 DIADLO CC(C)(C)c1ncc(C[NH2+][C@@H](CF)c2ccc(F)cc2)s1 ZINC000631283097 1045844886 /nfs/dbraw/zinc/84/48/86/1045844886.db2.gz HVEZMCWBAXZQDU-AWEZNQCLSA-N 1 2 310.413 4.380 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C3CCC4(CC4)CC3)cc2)C[C@@H](C)O1 ZINC000754100171 1045846257 /nfs/dbraw/zinc/84/62/57/1045846257.db2.gz IRRROLWWBHNKHZ-HZPDHXFCSA-N 1 2 314.473 4.435 20 0 DIADLO O=C(Nc1cccc(-n2cc[nH+]c2)c1)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001125083272 1045846841 /nfs/dbraw/zinc/84/68/41/1045846841.db2.gz BCHDORDBPDEBGC-GVDBMIGSSA-N 1 2 323.440 4.417 20 0 DIADLO CCS[C@H](C)c1noc(C[N@H+](CC)Cc2ccc(C)cc2)n1 ZINC000531713507 1045903286 /nfs/dbraw/zinc/90/32/86/1045903286.db2.gz BTLHNYSGFBUTQT-CQSZACIVSA-N 1 2 319.474 4.214 20 0 DIADLO CCS[C@H](C)c1noc(C[N@@H+](CC)Cc2ccc(C)cc2)n1 ZINC000531713507 1045903297 /nfs/dbraw/zinc/90/32/97/1045903297.db2.gz BTLHNYSGFBUTQT-CQSZACIVSA-N 1 2 319.474 4.214 20 0 DIADLO Cc1cc(C[N@@H+]2CCC[C@@](C)(F)C2)ccc1Br ZINC001137613288 1045908900 /nfs/dbraw/zinc/90/89/00/1045908900.db2.gz SEJKAJALDVZRJQ-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cc(C[N@H+]2CCC[C@@](C)(F)C2)ccc1Br ZINC001137613288 1045908907 /nfs/dbraw/zinc/90/89/07/1045908907.db2.gz SEJKAJALDVZRJQ-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1cccc2oc(C(F)(F)F)nc21 ZINC000902108280 1045913095 /nfs/dbraw/zinc/91/30/95/1045913095.db2.gz MRKDBMLHQFOGMX-UHFFFAOYSA-N 1 2 324.306 4.236 20 0 DIADLO COc1cc2c(cc1F)CC[C@H]2[NH2+][C@H](CF)c1ccc(F)cc1 ZINC000631798460 1045919583 /nfs/dbraw/zinc/91/95/83/1045919583.db2.gz SYLMMMKESAMRAU-IAGOWNOFSA-N 1 2 321.342 4.261 20 0 DIADLO Cc1c([C@H](C)[NH2+][C@H](CF)c2ccc(F)cc2)cnn1C(C)C ZINC000631798521 1045919624 /nfs/dbraw/zinc/91/96/24/1045919624.db2.gz UMXNVTCPLRMKFY-YVEFUNNKSA-N 1 2 307.388 4.273 20 0 DIADLO Oc1ccc2c(c1)[C@H]([NH2+][C@H](CF)c1ccc(F)cc1)CCC2 ZINC000631798413 1045919732 /nfs/dbraw/zinc/91/97/32/1045919732.db2.gz SEJYHTNGYUSBJV-QZTJIDSGSA-N 1 2 303.352 4.209 20 0 DIADLO CCc1nc([C@@H](C)[NH2+]Cc2cc(Cl)nc(Cl)c2)cs1 ZINC000754789785 1045928291 /nfs/dbraw/zinc/92/82/91/1045928291.db2.gz GDFLUYFUOGLJPT-MRVPVSSYSA-N 1 2 316.257 4.258 20 0 DIADLO CC(C)CCOc1ccccc1C[NH2+][C@@H]1C[C@@H](C)n2ccnc21 ZINC000453097088 1045937251 /nfs/dbraw/zinc/93/72/51/1045937251.db2.gz QHCLVVGKPOTYCT-NVXWUHKLSA-N 1 2 313.445 4.104 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2c[nH]c3ccc(Cl)cc23)no1 ZINC001137708386 1045940125 /nfs/dbraw/zinc/94/01/25/1045940125.db2.gz RPCIJAWUECRQRZ-QGZVFWFLSA-N 1 2 315.804 4.455 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2c[nH]c3ccc(Cl)cc23)no1 ZINC001137708386 1045940133 /nfs/dbraw/zinc/94/01/33/1045940133.db2.gz RPCIJAWUECRQRZ-QGZVFWFLSA-N 1 2 315.804 4.455 20 0 DIADLO O=C1CC[N@@H+](Cc2c[nH]c3ccc(Cl)cc23)[C@H]2CCCC[C@H]12 ZINC001137708562 1045941628 /nfs/dbraw/zinc/94/16/28/1045941628.db2.gz YKUXQWOQRJLEOB-YOEHRIQHSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c[nH]c3ccc(Cl)cc23)[C@H]2CCCC[C@H]12 ZINC001137708562 1045941644 /nfs/dbraw/zinc/94/16/44/1045941644.db2.gz YKUXQWOQRJLEOB-YOEHRIQHSA-N 1 2 316.832 4.155 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+]Cc2cc(Cl)nc(Cl)c2)s1 ZINC000755008790 1045944889 /nfs/dbraw/zinc/94/48/89/1045944889.db2.gz QAAXHKPRXVVLJW-MRVPVSSYSA-N 1 2 302.230 4.004 20 0 DIADLO CCC[C@H]([NH2+][C@@H](C)c1nccn1CC)c1ccc(F)cc1F ZINC000453146174 1045949231 /nfs/dbraw/zinc/94/92/31/1045949231.db2.gz SQTILCAMPLDRET-LRDDRELGSA-N 1 2 307.388 4.373 20 0 DIADLO C[C@H]([NH2+]Cc1ccc(CF)cc1)c1nc(C2CCCCC2)no1 ZINC000755073481 1045950427 /nfs/dbraw/zinc/95/04/27/1045950427.db2.gz ITZLJJFWKIPADK-ZDUSSCGKSA-N 1 2 317.408 4.438 20 0 DIADLO Clc1ccc(Cl)c(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)n1 ZINC000829100686 1045954819 /nfs/dbraw/zinc/95/48/19/1045954819.db2.gz JRTRWALSHHUYPX-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccc(Cl)c(C[N@H+]2CC[C@H](Oc3ccccc3)C2)n1 ZINC000829100686 1045954823 /nfs/dbraw/zinc/95/48/23/1045954823.db2.gz JRTRWALSHHUYPX-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Oc1ccc(Cl)c(C[NH2+]Cc2c(F)cccc2Cl)c1 ZINC001461721120 1045956914 /nfs/dbraw/zinc/95/69/14/1045956914.db2.gz PGISVPSVFVGUMV-UHFFFAOYSA-N 1 2 300.160 4.128 20 0 DIADLO Cc1cc(CNc2cccc[nH+]2)cc(NC(=O)OC(C)(C)C)c1 ZINC000829120369 1045957284 /nfs/dbraw/zinc/95/72/84/1045957284.db2.gz DPQWWZKCPBFEDD-UHFFFAOYSA-N 1 2 313.401 4.349 20 0 DIADLO Brc1csc(C[NH+]2CCCCCCCC2)n1 ZINC001137783304 1045966679 /nfs/dbraw/zinc/96/66/79/1045966679.db2.gz PJPJRHHCMMACQP-UHFFFAOYSA-N 1 2 303.269 4.062 20 0 DIADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccc(-n2ccnc2)cc1 ZINC000193202590 1045979700 /nfs/dbraw/zinc/97/97/00/1045979700.db2.gz ZICJGXVRUGOMOL-OAHLLOKOSA-N 1 2 306.413 4.111 20 0 DIADLO Cc1cccc(C)c1C[N@@H+]1Cc2cnc(-c3ccccc3)nc2C1 ZINC001137852846 1045986179 /nfs/dbraw/zinc/98/61/79/1045986179.db2.gz YRMIGXSKQWXIAJ-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1cccc(C)c1C[N@H+]1Cc2cnc(-c3ccccc3)nc2C1 ZINC001137852846 1045986186 /nfs/dbraw/zinc/98/61/86/1045986186.db2.gz YRMIGXSKQWXIAJ-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Fc1cc(F)c(F)c(C[N@H+]2CC=C(c3ccccc3)CC2)c1 ZINC001137873348 1045995450 /nfs/dbraw/zinc/99/54/50/1045995450.db2.gz AMIVLDKZHWXURE-UHFFFAOYSA-N 1 2 303.327 4.393 20 0 DIADLO Fc1cc(F)c(F)c(C[N@@H+]2CC=C(c3ccccc3)CC2)c1 ZINC001137873348 1045995462 /nfs/dbraw/zinc/99/54/62/1045995462.db2.gz AMIVLDKZHWXURE-UHFFFAOYSA-N 1 2 303.327 4.393 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[N@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001137878352 1045996887 /nfs/dbraw/zinc/99/68/87/1045996887.db2.gz RQCRJYLGMOIRKJ-SCZZXKLOSA-N 1 2 307.718 4.095 20 0 DIADLO Fc1ccc(Cl)c(F)c1C[N@@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001137878352 1045996897 /nfs/dbraw/zinc/99/68/97/1045996897.db2.gz RQCRJYLGMOIRKJ-SCZZXKLOSA-N 1 2 307.718 4.095 20 0 DIADLO CCCOC1CC[NH+](Cc2c(F)ccc(Cl)c2F)CC1 ZINC001137881266 1045997180 /nfs/dbraw/zinc/99/71/80/1045997180.db2.gz KICWJYUOCPTSTO-UHFFFAOYSA-N 1 2 303.780 4.009 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2c(F)ccc(Cl)c2F)CCC1(F)F ZINC001137877996 1045997731 /nfs/dbraw/zinc/99/77/31/1045997731.db2.gz GQZZUCHHYKEMHX-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2c(F)ccc(Cl)c2F)CCC1(F)F ZINC001137877996 1045997736 /nfs/dbraw/zinc/99/77/36/1045997736.db2.gz GQZZUCHHYKEMHX-SECBINFHSA-N 1 2 309.734 4.485 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)ccc(F)c2F)cc1 ZINC001137930235 1046022175 /nfs/dbraw/zinc/02/21/75/1046022175.db2.gz HSBXDJKGPDPCGQ-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2c(F)ccc(F)c2F)cc1 ZINC001137930235 1046022189 /nfs/dbraw/zinc/02/21/89/1046022189.db2.gz HSBXDJKGPDPCGQ-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(F)c(F)c2F)cc1 ZINC001137939042 1046024551 /nfs/dbraw/zinc/02/45/51/1046024551.db2.gz GNCOOPIBQKOCOL-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(F)c(F)c2F)cc1 ZINC001137939042 1046024562 /nfs/dbraw/zinc/02/45/62/1046024562.db2.gz GNCOOPIBQKOCOL-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1ccc(OC(F)F)c([C@H](C)[NH2+][C@@H]2C[C@@H](C)n3ccnc32)c1 ZINC000453332505 1046024830 /nfs/dbraw/zinc/02/48/30/1046024830.db2.gz AURFMUJBLPFTJM-MBNYWOFBSA-N 1 2 321.371 4.150 20 0 DIADLO CCCC1CC[NH+](Cc2c(Cl)n(C)nc2C(F)(F)F)CC1 ZINC001137948727 1046027477 /nfs/dbraw/zinc/02/74/77/1046027477.db2.gz BVWSWIKYLUQILE-UHFFFAOYSA-N 1 2 323.790 4.104 20 0 DIADLO Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1nn(C)cc1Cl)CCS2 ZINC000453309186 1046029783 /nfs/dbraw/zinc/02/97/83/1046029783.db2.gz DIALOAWHALDDIW-AWEZNQCLSA-N 1 2 321.877 4.017 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(SC(F)(F)F)cc2)CCC1=O ZINC001137953281 1046031322 /nfs/dbraw/zinc/03/13/22/1046031322.db2.gz SECVWGDVACVNLH-LLVKDONJSA-N 1 2 317.376 4.100 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(SC(F)(F)F)cc2)CCC1=O ZINC001137953281 1046031332 /nfs/dbraw/zinc/03/13/32/1046031332.db2.gz SECVWGDVACVNLH-LLVKDONJSA-N 1 2 317.376 4.100 20 0 DIADLO Cc1ccc(C[N@@H+]2CC[C@@H]2COCc2ccccc2)c(F)c1F ZINC001137968949 1046037967 /nfs/dbraw/zinc/03/79/67/1046037967.db2.gz ZATLRIUHSICXCA-QGZVFWFLSA-N 1 2 317.379 4.064 20 0 DIADLO Cc1ccc(C[N@H+]2CC[C@@H]2COCc2ccccc2)c(F)c1F ZINC001137968949 1046037983 /nfs/dbraw/zinc/03/79/83/1046037983.db2.gz ZATLRIUHSICXCA-QGZVFWFLSA-N 1 2 317.379 4.064 20 0 DIADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1cnc(C2CC2)o1 ZINC000453345160 1046047134 /nfs/dbraw/zinc/04/71/34/1046047134.db2.gz HNNFOLHVVXAWAN-LLVKDONJSA-N 1 2 320.820 4.455 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc3nc(C)sc3c2)no1 ZINC000756075885 1046049501 /nfs/dbraw/zinc/04/95/01/1046049501.db2.gz JPGJNLPNTRTEAJ-MRXNPFEDSA-N 1 2 313.426 4.238 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc3nc(C)sc3c2)no1 ZINC000756075885 1046049512 /nfs/dbraw/zinc/04/95/12/1046049512.db2.gz JPGJNLPNTRTEAJ-MRXNPFEDSA-N 1 2 313.426 4.238 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1cc(C)ccc1OC(F)F ZINC000453358756 1046057471 /nfs/dbraw/zinc/05/74/71/1046057471.db2.gz QANIXZMVDCRWMZ-OLZOCXBDSA-N 1 2 323.387 4.225 20 0 DIADLO Cc1csc([C@H](C)[NH2+][C@H](C)c2ccc(C(F)(F)F)cn2)n1 ZINC000902789810 1046069971 /nfs/dbraw/zinc/06/99/71/1046069971.db2.gz NKNLDNKTXMWTKF-ZJUUUORDSA-N 1 2 315.364 4.277 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1Oc1ccccc1)c1cn(C)nn1 ZINC000902786584 1046070246 /nfs/dbraw/zinc/07/02/46/1046070246.db2.gz PTTCTKOIIYBXSC-LSDHHAIUSA-N 1 2 322.412 4.019 20 0 DIADLO CC(C)c1cc(C[NH2+][C@@H](C)c2ccc(C(F)(F)F)cn2)on1 ZINC000902804297 1046073803 /nfs/dbraw/zinc/07/38/03/1046073803.db2.gz OBOKQQOQGJAOTO-JTQLQIEISA-N 1 2 313.323 4.063 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc3ccccc3nc2Cl)CC2(CCC2)O1 ZINC000830708973 1046093982 /nfs/dbraw/zinc/09/39/82/1046093982.db2.gz VCOOJWRNUKMTKT-CYBMUJFWSA-N 1 2 316.832 4.032 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc3ccccc3nc2Cl)CC2(CCC2)O1 ZINC000830708973 1046093997 /nfs/dbraw/zinc/09/39/97/1046093997.db2.gz VCOOJWRNUKMTKT-CYBMUJFWSA-N 1 2 316.832 4.032 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2)C[C@@H](c2ccsc2)O1 ZINC000532098070 1046098074 /nfs/dbraw/zinc/09/80/74/1046098074.db2.gz FIXZMCXYJJVQKK-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2)C[C@@H](c2ccsc2)O1 ZINC000532098070 1046098087 /nfs/dbraw/zinc/09/80/87/1046098087.db2.gz FIXZMCXYJJVQKK-WBMJQRKESA-N 1 2 307.846 4.364 20 0 DIADLO Brc1ccc([C@H]2CCC[N@@H+]2Cc2ccsc2)nc1 ZINC000453622189 1046100150 /nfs/dbraw/zinc/10/01/50/1046100150.db2.gz ZUBHBLXTZKRWIH-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccc([C@H]2CCC[N@H+]2Cc2ccsc2)nc1 ZINC000453622189 1046100158 /nfs/dbraw/zinc/10/01/58/1046100158.db2.gz ZUBHBLXTZKRWIH-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)ccc(C)c2F)cn1 ZINC001138119750 1046100232 /nfs/dbraw/zinc/10/02/32/1046100232.db2.gz RMVOKEHQNBJIIX-QGZVFWFLSA-N 1 2 302.368 4.314 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2c(F)ccc(C)c2F)cn1 ZINC001138119750 1046100235 /nfs/dbraw/zinc/10/02/35/1046100235.db2.gz RMVOKEHQNBJIIX-QGZVFWFLSA-N 1 2 302.368 4.314 20 0 DIADLO CCOc1ccccc1[C@H](C)[NH2+]Cc1nc(C)c2ccccc2n1 ZINC000532217618 1046117221 /nfs/dbraw/zinc/11/72/21/1046117221.db2.gz AZBYYZJZJNVKRW-AWEZNQCLSA-N 1 2 321.424 4.188 20 0 DIADLO CCN(CC)C(=S)SCc1ccc(-n2cc[nH+]c2)cc1C ZINC000756651748 1046118718 /nfs/dbraw/zinc/11/87/18/1046118718.db2.gz LFMGRLLCUNLDAP-UHFFFAOYSA-N 1 2 319.499 4.041 20 0 DIADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1cc(CC)no1 ZINC000532234652 1046123988 /nfs/dbraw/zinc/12/39/88/1046123988.db2.gz HYFGGJUGYUAFDO-LLVKDONJSA-N 1 2 308.809 4.140 20 0 DIADLO C[N@H+](CCc1cccc(F)c1)Cc1c(F)c(F)cc(F)c1F ZINC001138238138 1046124787 /nfs/dbraw/zinc/12/47/87/1046124787.db2.gz JARABDQLROXOJO-UHFFFAOYSA-N 1 2 315.285 4.057 20 0 DIADLO C[N@@H+](CCc1cccc(F)c1)Cc1c(F)c(F)cc(F)c1F ZINC001138238138 1046124793 /nfs/dbraw/zinc/12/47/93/1046124793.db2.gz JARABDQLROXOJO-UHFFFAOYSA-N 1 2 315.285 4.057 20 0 DIADLO Cc1cccn2c(/C=C(/C#N)c3nc(C(C)C)cs3)c[nH+]c12 ZINC000083024489 1046133249 /nfs/dbraw/zinc/13/32/49/1046133249.db2.gz FIXIODCNPFCRDT-QPEQYQDCSA-N 1 2 308.410 4.287 20 0 DIADLO COc1cc(C)[nH+]c(CSc2nc3ccccc3s2)c1 ZINC000756917106 1046150716 /nfs/dbraw/zinc/15/07/16/1046150716.db2.gz ODKOEBODDNATHL-UHFFFAOYSA-N 1 2 302.424 4.301 20 0 DIADLO Oc1cc(O)cc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)s2)c1 ZINC001138329698 1046150859 /nfs/dbraw/zinc/15/08/59/1046150859.db2.gz FFMHLZPAWSEGJZ-CYBMUJFWSA-N 1 2 309.818 4.150 20 0 DIADLO Oc1cc(O)cc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)c1 ZINC001138329698 1046150867 /nfs/dbraw/zinc/15/08/67/1046150867.db2.gz FFMHLZPAWSEGJZ-CYBMUJFWSA-N 1 2 309.818 4.150 20 0 DIADLO CC/C(C)=C(/C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000779886745 1046154762 /nfs/dbraw/zinc/15/47/62/1046154762.db2.gz DPPDYDNRTCVYRA-QXMHVHEDSA-N 1 2 303.793 4.211 20 0 DIADLO COc1ccc(F)cc1C[N@@H+]1CCc2ccc(Cl)cc2C1 ZINC001138373352 1046159327 /nfs/dbraw/zinc/15/93/27/1046159327.db2.gz ROMKRAHDGHZFGL-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(F)cc1C[N@H+]1CCc2ccc(Cl)cc2C1 ZINC001138373352 1046159336 /nfs/dbraw/zinc/15/93/36/1046159336.db2.gz ROMKRAHDGHZFGL-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(F)cc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001138375540 1046159890 /nfs/dbraw/zinc/15/98/90/1046159890.db2.gz BRPCNMKTNCXNAX-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(F)cc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC001138375540 1046159899 /nfs/dbraw/zinc/15/98/99/1046159899.db2.gz BRPCNMKTNCXNAX-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cnn(CC3CCC3)c2)cs1 ZINC000903091963 1046161020 /nfs/dbraw/zinc/16/10/20/1046161020.db2.gz DVBSMMBNYMDROI-CHWSQXEVSA-N 1 2 318.490 4.114 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1c(F)cccc1OC ZINC001138385424 1046162682 /nfs/dbraw/zinc/16/26/82/1046162682.db2.gz QIPNTIFWZFYVOI-CYBMUJFWSA-N 1 2 303.377 4.036 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1c(F)cccc1OC ZINC001138385424 1046162690 /nfs/dbraw/zinc/16/26/90/1046162690.db2.gz QIPNTIFWZFYVOI-CYBMUJFWSA-N 1 2 303.377 4.036 20 0 DIADLO Cc1c2ccccc2[nH]c1C[N@@H+]1CCc2cc(F)c(F)cc2C1 ZINC001138401986 1046164738 /nfs/dbraw/zinc/16/47/38/1046164738.db2.gz ZOZYSNNHZBXAFC-UHFFFAOYSA-N 1 2 312.363 4.313 20 0 DIADLO Cc1c2ccccc2[nH]c1C[N@H+]1CCc2cc(F)c(F)cc2C1 ZINC001138401986 1046164745 /nfs/dbraw/zinc/16/47/45/1046164745.db2.gz ZOZYSNNHZBXAFC-UHFFFAOYSA-N 1 2 312.363 4.313 20 0 DIADLO Cc1ccc(C[NH2+]Cc2ccon2)c(O[C@@H](C)CC(C)C)c1 ZINC000634967919 1046167951 /nfs/dbraw/zinc/16/79/51/1046167951.db2.gz AILDJOPNPSVICT-HNNXBMFYSA-N 1 2 302.418 4.086 20 0 DIADLO COc1c(F)cc(C[N@H+](C)Cc2ccccc2Cl)cc1F ZINC001138424172 1046174886 /nfs/dbraw/zinc/17/48/86/1046174886.db2.gz NCQKTNGUVSYRCY-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1c(F)cc(C[N@@H+](C)Cc2ccccc2Cl)cc1F ZINC001138424172 1046174896 /nfs/dbraw/zinc/17/48/96/1046174896.db2.gz NCQKTNGUVSYRCY-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCC[C@H]2c2ccccc2F)cc1F ZINC001138422960 1046175390 /nfs/dbraw/zinc/17/53/90/1046175390.db2.gz CSJAHPVZGNCMSC-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCC[C@H]2c2ccccc2F)cc1F ZINC001138422960 1046175398 /nfs/dbraw/zinc/17/53/98/1046175398.db2.gz CSJAHPVZGNCMSC-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1cc([C@H](C)NC(=O)[C@H](CC(C)C)n2cc[nH+]c2)c(C)s1 ZINC000635252249 1046181637 /nfs/dbraw/zinc/18/16/37/1046181637.db2.gz LUPSOXOITULTAT-BBRMVZONSA-N 1 2 319.474 4.026 20 0 DIADLO Cc1nsc(C)c1C[N@@H+]1CCc2c(F)cc(F)cc2[C@H]1C ZINC001168153236 1046184070 /nfs/dbraw/zinc/18/40/70/1046184070.db2.gz FIMGEBFWFPXSMV-SNVBAGLBSA-N 1 2 308.397 4.157 20 0 DIADLO Cc1nsc(C)c1C[N@H+]1CCc2c(F)cc(F)cc2[C@H]1C ZINC001168153236 1046184079 /nfs/dbraw/zinc/18/40/79/1046184079.db2.gz FIMGEBFWFPXSMV-SNVBAGLBSA-N 1 2 308.397 4.157 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2nc3c(s2)CCC3)c(Cl)c1 ZINC000903190557 1046186954 /nfs/dbraw/zinc/18/69/54/1046186954.db2.gz ALNLXNCPNNAKMR-SNVBAGLBSA-N 1 2 322.861 4.145 20 0 DIADLO CC(C)c1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000635400074 1046188593 /nfs/dbraw/zinc/18/85/93/1046188593.db2.gz CVIZZRDXFIYKHN-HZPDHXFCSA-N 1 2 311.429 4.399 20 0 DIADLO CC(C)c1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000635400074 1046188597 /nfs/dbraw/zinc/18/85/97/1046188597.db2.gz CVIZZRDXFIYKHN-HZPDHXFCSA-N 1 2 311.429 4.399 20 0 DIADLO C[C@@H](CNc1[nH+]cccc1OCc1ccccc1)C(F)(F)F ZINC000475737474 1046190425 /nfs/dbraw/zinc/19/04/25/1046190425.db2.gz DAVXHIKXDKYQMN-LBPRGKRZSA-N 1 2 310.319 4.271 20 0 DIADLO CC(C)c1nc(C[N@H+](C)[C@H](C)[C@@H](C)c2ccc(Cl)cc2)no1 ZINC000475744948 1046193214 /nfs/dbraw/zinc/19/32/14/1046193214.db2.gz SNVJGFKXVNMKPE-CHWSQXEVSA-N 1 2 321.852 4.470 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)[C@H](C)[C@@H](C)c2ccc(Cl)cc2)no1 ZINC000475744948 1046193222 /nfs/dbraw/zinc/19/32/22/1046193222.db2.gz SNVJGFKXVNMKPE-CHWSQXEVSA-N 1 2 321.852 4.470 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3cc(F)ccc3C2)cc1Cl ZINC001138474955 1046193529 /nfs/dbraw/zinc/19/35/29/1046193529.db2.gz JJWQUOMVSRRHSH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1ccc(C[N@H+]2CCc3cc(F)ccc3C2)cc1Cl ZINC001138474955 1046193546 /nfs/dbraw/zinc/19/35/46/1046193546.db2.gz JJWQUOMVSRRHSH-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1c(Cl)cc(C[NH+]2CC3(C2)CCCC3)cc1Cl ZINC001138475715 1046194728 /nfs/dbraw/zinc/19/47/28/1046194728.db2.gz NUCKNBRXUHTLBE-UHFFFAOYSA-N 1 2 300.229 4.378 20 0 DIADLO C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](CCC(=O)Nc2ccccc2Cl)C1 ZINC000475745648 1046194908 /nfs/dbraw/zinc/19/49/08/1046194908.db2.gz GIULNGURHYRDKQ-HZSPNIEDSA-N 1 2 308.853 4.035 20 0 DIADLO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](CCC(=O)Nc2ccccc2Cl)C1 ZINC000475745648 1046194918 /nfs/dbraw/zinc/19/49/18/1046194918.db2.gz GIULNGURHYRDKQ-HZSPNIEDSA-N 1 2 308.853 4.035 20 0 DIADLO COc1c(Cl)cc(C[N@@H+]2CCC[C@@H](C(F)F)C2)cc1Cl ZINC001138478062 1046196521 /nfs/dbraw/zinc/19/65/21/1046196521.db2.gz SGBHNSDTWGMAQB-SNVBAGLBSA-N 1 2 324.198 4.479 20 0 DIADLO COc1c(Cl)cc(C[N@H+]2CCC[C@@H](C(F)F)C2)cc1Cl ZINC001138478062 1046196525 /nfs/dbraw/zinc/19/65/25/1046196525.db2.gz SGBHNSDTWGMAQB-SNVBAGLBSA-N 1 2 324.198 4.479 20 0 DIADLO CSc1cccc(NC(=O)[C@H](CC(C)C)n2cc[nH+]c2)c1C ZINC000635768701 1046205162 /nfs/dbraw/zinc/20/51/62/1046205162.db2.gz RVBJXICAKIUBML-HNNXBMFYSA-N 1 2 317.458 4.139 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCc3nc(Cl)ccc3C2)s1 ZINC001138526329 1046211517 /nfs/dbraw/zinc/21/15/17/1046211517.db2.gz TXEPAHRCCJKRFC-UHFFFAOYSA-N 1 2 306.862 4.307 20 0 DIADLO CCCc1ccc(C[N@H+]2CCc3nc(Cl)ccc3C2)s1 ZINC001138526329 1046211525 /nfs/dbraw/zinc/21/15/25/1046211525.db2.gz TXEPAHRCCJKRFC-UHFFFAOYSA-N 1 2 306.862 4.307 20 0 DIADLO C[N@H+](CC(=O)Nc1ccccc1C(C)(C)C)Cc1ccsc1 ZINC000050275051 1046211791 /nfs/dbraw/zinc/21/17/91/1046211791.db2.gz PYIHXORSWVMJOA-UHFFFAOYSA-N 1 2 316.470 4.116 20 0 DIADLO C[N@@H+](CC(=O)Nc1ccccc1C(C)(C)C)Cc1ccsc1 ZINC000050275051 1046211804 /nfs/dbraw/zinc/21/18/04/1046211804.db2.gz PYIHXORSWVMJOA-UHFFFAOYSA-N 1 2 316.470 4.116 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@H]2CC3(CCC3)Oc3ccccc32)[nH+]1 ZINC000757793042 1046213342 /nfs/dbraw/zinc/21/33/42/1046213342.db2.gz XSGPQTUQTZTCBM-HNNXBMFYSA-N 1 2 320.396 4.125 20 0 DIADLO Cc1cc(C[N@H+](Cc2cccnc2)Cc2ccccn2)c(C)s1 ZINC001138567418 1046228982 /nfs/dbraw/zinc/22/89/82/1046228982.db2.gz AXAHGRFYNGYQDE-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO Cc1cc(C[N@@H+](Cc2cccnc2)Cc2ccccn2)c(C)s1 ZINC001138567418 1046228997 /nfs/dbraw/zinc/22/89/97/1046228997.db2.gz AXAHGRFYNGYQDE-UHFFFAOYSA-N 1 2 323.465 4.357 20 0 DIADLO COc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)co2)c(C)c1 ZINC000903312963 1046235077 /nfs/dbraw/zinc/23/50/77/1046235077.db2.gz DTHDAVMJNOYUHR-CYBMUJFWSA-N 1 2 302.418 4.140 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccc(C(C)(C)O)cc1 ZINC000903313343 1046235418 /nfs/dbraw/zinc/23/54/18/1046235418.db2.gz NVOVCOOHAMZLDW-ZDUSSCGKSA-N 1 2 316.445 4.050 20 0 DIADLO CCc1nc2c(s1)[C@@H]([NH2+]Cc1nc(C(C)(C)C)co1)CCC2 ZINC000903313558 1046235554 /nfs/dbraw/zinc/23/55/54/1046235554.db2.gz SZGHMWVIBOGGHM-NSHDSACASA-N 1 2 319.474 4.158 20 0 DIADLO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+][C@H](c1ncccn1)C1CC1 ZINC000903323621 1046236230 /nfs/dbraw/zinc/23/62/30/1046236230.db2.gz BTKKETOAGAVUJD-RISCZKNCSA-N 1 2 316.474 4.167 20 0 DIADLO Cc1ccc2cc([C@@H](C)[NH2+][C@H](c3ncccn3)C3CC3)oc2c1 ZINC000903324227 1046239810 /nfs/dbraw/zinc/23/98/10/1046239810.db2.gz CWOSZCBCJDUSEX-ACJLOTCBSA-N 1 2 307.397 4.333 20 0 DIADLO Clc1ccc2c(c1)C[N@@H+](Cc1ccccc1N1CCCC1)C2 ZINC001138614150 1046241480 /nfs/dbraw/zinc/24/14/80/1046241480.db2.gz TWCQIDCBVKJRHM-UHFFFAOYSA-N 1 2 312.844 4.456 20 0 DIADLO Clc1ccc2c(c1)C[N@H+](Cc1ccccc1N1CCCC1)C2 ZINC001138614150 1046241490 /nfs/dbraw/zinc/24/14/90/1046241490.db2.gz TWCQIDCBVKJRHM-UHFFFAOYSA-N 1 2 312.844 4.456 20 0 DIADLO COc1ccc(-c2cccc(C[N@@H+]3Cc4cccnc4C3)c2)cc1 ZINC001138614273 1046242465 /nfs/dbraw/zinc/24/24/65/1046242465.db2.gz WMELEQFFGSWLOS-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO COc1ccc(-c2cccc(C[N@H+]3Cc4cccnc4C3)c2)cc1 ZINC001138614273 1046242478 /nfs/dbraw/zinc/24/24/78/1046242478.db2.gz WMELEQFFGSWLOS-UHFFFAOYSA-N 1 2 316.404 4.273 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(Br)cc3F)ccc21 ZINC001212871089 1046245013 /nfs/dbraw/zinc/24/50/13/1046245013.db2.gz ZAQREKLPABLNPI-UHFFFAOYSA-N 1 2 320.165 4.219 20 0 DIADLO C[C@H]([NH2+]Cc1cc(C(F)(F)F)n(C)n1)c1csc(Cl)c1 ZINC000903340221 1046251509 /nfs/dbraw/zinc/25/15/09/1046251509.db2.gz HCORXMCDRVBNCA-ZETCQYMHSA-N 1 2 323.771 4.005 20 0 DIADLO CCCn1ncc(C[N@@H+]2CCC[C@@H]2c2c(F)cccc2F)c1C ZINC001138642432 1046255048 /nfs/dbraw/zinc/25/50/48/1046255048.db2.gz YIPQLKAQVGSEOU-QGZVFWFLSA-N 1 2 319.399 4.217 20 0 DIADLO CCCn1ncc(C[N@H+]2CCC[C@@H]2c2c(F)cccc2F)c1C ZINC001138642432 1046255059 /nfs/dbraw/zinc/25/50/59/1046255059.db2.gz YIPQLKAQVGSEOU-QGZVFWFLSA-N 1 2 319.399 4.217 20 0 DIADLO CCSc1ncc(C[N@@H+]2CCC[C@H]2c2ccccc2F)cn1 ZINC001138654560 1046256532 /nfs/dbraw/zinc/25/65/32/1046256532.db2.gz GFVLNINYAWKOIK-INIZCTEOSA-N 1 2 317.433 4.065 20 0 DIADLO CCSc1ncc(C[N@H+]2CCC[C@H]2c2ccccc2F)cn1 ZINC001138654560 1046256543 /nfs/dbraw/zinc/25/65/43/1046256543.db2.gz GFVLNINYAWKOIK-INIZCTEOSA-N 1 2 317.433 4.065 20 0 DIADLO O=C1CC[N@@H+](Cc2c(Cl)[nH]c3ccccc32)[C@H]2CCCC[C@H]12 ZINC001138684767 1046266059 /nfs/dbraw/zinc/26/60/59/1046266059.db2.gz PZSBEOPCYAPQKW-BBRMVZONSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c(Cl)[nH]c3ccccc32)[C@H]2CCCC[C@H]12 ZINC001138684767 1046266070 /nfs/dbraw/zinc/26/60/70/1046266070.db2.gz PZSBEOPCYAPQKW-BBRMVZONSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@@H+](Cc2c(Cl)[nH]c3ccccc32)[C@H]2CCCC[C@@H]12 ZINC001138684768 1046266994 /nfs/dbraw/zinc/26/69/94/1046266994.db2.gz PZSBEOPCYAPQKW-CJNGLKHVSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2c(Cl)[nH]c3ccccc32)[C@H]2CCCC[C@@H]12 ZINC001138684768 1046267008 /nfs/dbraw/zinc/26/70/08/1046267008.db2.gz PZSBEOPCYAPQKW-CJNGLKHVSA-N 1 2 316.832 4.155 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1c(Cl)[nH]c3ccccc31)C2 ZINC001138687565 1046268748 /nfs/dbraw/zinc/26/87/48/1046268748.db2.gz JEIFLYDMTCYNJE-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1c(Cl)[nH]c3ccccc31)C2 ZINC001138687565 1046268754 /nfs/dbraw/zinc/26/87/54/1046268754.db2.gz JEIFLYDMTCYNJE-UHFFFAOYSA-N 1 2 312.800 4.346 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2ccccc2SC(F)(F)F)no1 ZINC000903421229 1046272495 /nfs/dbraw/zinc/27/24/95/1046272495.db2.gz FZLIFGAEPRBWQQ-JTQLQIEISA-N 1 2 316.348 4.446 20 0 DIADLO CSc1ncc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)cn1 ZINC001138708894 1046273343 /nfs/dbraw/zinc/27/33/43/1046273343.db2.gz ZFWDVLDOPSQLOE-HNNXBMFYSA-N 1 2 319.861 4.189 20 0 DIADLO CSc1ncc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)cn1 ZINC001138708894 1046273351 /nfs/dbraw/zinc/27/33/51/1046273351.db2.gz ZFWDVLDOPSQLOE-HNNXBMFYSA-N 1 2 319.861 4.189 20 0 DIADLO Cc1ncc([C@H](C)[N@H+](C)[C@@H](C)c2cc(F)ccc2F)c(C)n1 ZINC000637902202 1046283000 /nfs/dbraw/zinc/28/30/00/1046283000.db2.gz JYYUNLPHVLYIOK-RYUDHWBXSA-N 1 2 305.372 4.126 20 0 DIADLO Cc1ncc([C@H](C)[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)c(C)n1 ZINC000637902202 1046283012 /nfs/dbraw/zinc/28/30/12/1046283012.db2.gz JYYUNLPHVLYIOK-RYUDHWBXSA-N 1 2 305.372 4.126 20 0 DIADLO COCCc1ncc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)s1 ZINC000637901122 1046284262 /nfs/dbraw/zinc/28/42/62/1046284262.db2.gz IYJZHJZAVPAMRF-LBPRGKRZSA-N 1 2 324.877 4.178 20 0 DIADLO COCCc1ncc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)s1 ZINC000637901122 1046284269 /nfs/dbraw/zinc/28/42/69/1046284269.db2.gz IYJZHJZAVPAMRF-LBPRGKRZSA-N 1 2 324.877 4.178 20 0 DIADLO Nc1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000637913356 1046286448 /nfs/dbraw/zinc/28/64/48/1046286448.db2.gz NPWPGWLSFPNKOV-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000637913356 1046286455 /nfs/dbraw/zinc/28/64/55/1046286455.db2.gz NPWPGWLSFPNKOV-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO c1coc([C@H]2CCCC[N@H+]2[C@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000638076290 1046291439 /nfs/dbraw/zinc/29/14/39/1046291439.db2.gz YHKSEVKEEBQJRA-WBVHZDCISA-N 1 2 314.433 4.246 20 0 DIADLO c1coc([C@H]2CCCC[N@@H+]2[C@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000638076290 1046291448 /nfs/dbraw/zinc/29/14/48/1046291448.db2.gz YHKSEVKEEBQJRA-WBVHZDCISA-N 1 2 314.433 4.246 20 0 DIADLO CCCc1ccccc1NC(=O)c1ccc(Cn2cc[nH+]c2)cc1 ZINC000122596456 1046309460 /nfs/dbraw/zinc/30/94/60/1046309460.db2.gz WPRCDXVBDVHOEH-UHFFFAOYSA-N 1 2 319.408 4.136 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CC[C@@H](C)[C@H](F)C3)c(Cl)nc2c1 ZINC001138860597 1046309758 /nfs/dbraw/zinc/30/97/58/1046309758.db2.gz NDCNVKVREVRNSF-IUODEOHRSA-N 1 2 306.812 4.377 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CC[C@@H](C)[C@H](F)C3)c(Cl)nc2c1 ZINC001138860597 1046309768 /nfs/dbraw/zinc/30/97/68/1046309768.db2.gz NDCNVKVREVRNSF-IUODEOHRSA-N 1 2 306.812 4.377 20 0 DIADLO C[C@@H]([NH2+][C@H](c1nnc[nH]1)C1CCCCC1)c1ccc(F)c(F)c1 ZINC000638302323 1046311010 /nfs/dbraw/zinc/31/10/10/1046311010.db2.gz SPQOHIJLQVESLB-BZNIZROVSA-N 1 2 320.387 4.055 20 0 DIADLO COc1ccccc1[C@H]([NH2+]Cc1cccc(C)c1)c1ccccn1 ZINC000089797000 1046315242 /nfs/dbraw/zinc/31/52/42/1046315242.db2.gz ILKBNKORGOXAPG-NRFANRHFSA-N 1 2 318.420 4.278 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1csc(C(C)C)n1)CCC2 ZINC001138888103 1046317892 /nfs/dbraw/zinc/31/78/92/1046317892.db2.gz MZTKCQOHRPCWPQ-UHFFFAOYSA-N 1 2 316.470 4.224 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1csc(C(C)C)n1)CCC2 ZINC001138888103 1046317900 /nfs/dbraw/zinc/31/79/00/1046317900.db2.gz MZTKCQOHRPCWPQ-UHFFFAOYSA-N 1 2 316.470 4.224 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)c(C)c1 ZINC000638399054 1046320322 /nfs/dbraw/zinc/32/03/22/1046320322.db2.gz XZAWETJIKHPPOE-MAUKXSAKSA-N 1 2 312.461 4.394 20 0 DIADLO Fc1cnc(Cl)c(C[NH+]2CCC(c3ccccc3F)CC2)c1 ZINC001138891893 1046320457 /nfs/dbraw/zinc/32/04/57/1046320457.db2.gz GIKOSJGDIFMDDT-UHFFFAOYSA-N 1 2 322.786 4.393 20 0 DIADLO Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H](c1nnc[nH]1)C1CCCCC1 ZINC000638426759 1046320939 /nfs/dbraw/zinc/32/09/39/1046320939.db2.gz WEEZQSWGDRCSHG-ZWKOTPCHSA-N 1 2 310.445 4.012 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)cc1C ZINC000638446787 1046323627 /nfs/dbraw/zinc/32/36/27/1046323627.db2.gz ZBCNDDPNWBUHGS-YJBOKZPZSA-N 1 2 312.461 4.394 20 0 DIADLO Cc1ccc([C@H](C)[NH2+][C@@H](c2nnc[nH]2)C2CCCCC2)cc1C ZINC000638446784 1046324997 /nfs/dbraw/zinc/32/49/97/1046324997.db2.gz ZBCNDDPNWBUHGS-MAUKXSAKSA-N 1 2 312.461 4.394 20 0 DIADLO Cc1cc(C)cc([C@@H](C)[NH2+][C@H](c2nnc[nH]2)C2CCCCC2)c1 ZINC000638530651 1046326672 /nfs/dbraw/zinc/32/66/72/1046326672.db2.gz BCSJATYGSFKUAW-QAPCUYQASA-N 1 2 312.461 4.394 20 0 DIADLO c1csc(C[NH+]2CC(Cc3ccccc3)(c3ccccc3)C2)n1 ZINC000666405381 1046333575 /nfs/dbraw/zinc/33/35/75/1046333575.db2.gz BLHIGWQCBJVHAL-UHFFFAOYSA-N 1 2 320.461 4.139 20 0 DIADLO CC(C)Oc1ccc(Cl)cc1C[N@H+](C)Cc1ccccn1 ZINC001138957681 1046338792 /nfs/dbraw/zinc/33/87/92/1046338792.db2.gz KDBSWGAETMEQHB-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO CC(C)Oc1ccc(Cl)cc1C[N@@H+](C)Cc1ccccn1 ZINC001138957681 1046338804 /nfs/dbraw/zinc/33/88/04/1046338804.db2.gz KDBSWGAETMEQHB-UHFFFAOYSA-N 1 2 304.821 4.154 20 0 DIADLO Cc1ccc(C[NH2+]Cc2nc3ccccc3o2)c(OCC2CC2)c1 ZINC000638772678 1046343691 /nfs/dbraw/zinc/34/36/91/1046343691.db2.gz DCJZNLISJXGVJP-UHFFFAOYSA-N 1 2 322.408 4.215 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc(OCC(C)C)cc1)C2 ZINC001138971451 1046346138 /nfs/dbraw/zinc/34/61/38/1046346138.db2.gz MAUMNMQGUQSDAB-UHFFFAOYSA-N 1 2 311.425 4.246 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc(OCC(C)C)cc1)C2 ZINC001138971451 1046346148 /nfs/dbraw/zinc/34/61/48/1046346148.db2.gz MAUMNMQGUQSDAB-UHFFFAOYSA-N 1 2 311.425 4.246 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2ccccc2F)c(OCC)c1 ZINC001138977691 1046347370 /nfs/dbraw/zinc/34/73/70/1046347370.db2.gz CVKXWCZNYGSDSC-UHFFFAOYSA-N 1 2 317.404 4.255 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2ccccc2F)c(OCC)c1 ZINC001138977691 1046347382 /nfs/dbraw/zinc/34/73/82/1046347382.db2.gz CVKXWCZNYGSDSC-UHFFFAOYSA-N 1 2 317.404 4.255 20 0 DIADLO Cc1cc(C)c(CNc2cc(C(F)(F)F)cc(Cl)n2)c[nH+]1 ZINC000396994787 1046348125 /nfs/dbraw/zinc/34/81/25/1046348125.db2.gz WMSJDNVQMKHFBR-UHFFFAOYSA-N 1 2 315.726 4.378 20 0 DIADLO C[N@H+](Cc1ccc(C(F)F)nc1)Cc1cc(Cl)ccc1F ZINC000639104275 1046358948 /nfs/dbraw/zinc/35/89/48/1046358948.db2.gz DYSYMIIQTQHYQQ-UHFFFAOYSA-N 1 2 314.738 4.444 20 0 DIADLO C[N@@H+](Cc1ccc(C(F)F)nc1)Cc1cc(Cl)ccc1F ZINC000639104275 1046358961 /nfs/dbraw/zinc/35/89/61/1046358961.db2.gz DYSYMIIQTQHYQQ-UHFFFAOYSA-N 1 2 314.738 4.444 20 0 DIADLO CCSc1nn(C[N@H+](CC)C[C@H](C)CC)c(=S)s1 ZINC000748260913 1046362699 /nfs/dbraw/zinc/36/26/99/1046362699.db2.gz DDDSWRPZNKJMNS-SNVBAGLBSA-N 1 2 305.538 4.112 20 0 DIADLO CCSc1nn(C[N@@H+](CC)C[C@H](C)CC)c(=S)s1 ZINC000748260913 1046362704 /nfs/dbraw/zinc/36/27/04/1046362704.db2.gz DDDSWRPZNKJMNS-SNVBAGLBSA-N 1 2 305.538 4.112 20 0 DIADLO Fc1cc(Cl)cc(F)c1C[N@@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001139051412 1046368789 /nfs/dbraw/zinc/36/87/89/1046368789.db2.gz NFYZGKOOXRIRLR-AWEZNQCLSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1cc(Cl)cc(F)c1C[N@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001139051412 1046368799 /nfs/dbraw/zinc/36/87/99/1046368799.db2.gz NFYZGKOOXRIRLR-AWEZNQCLSA-N 1 2 323.770 4.272 20 0 DIADLO CCCOC1CC[NH+](Cc2c(F)cc(Cl)cc2F)CC1 ZINC001139051490 1046370270 /nfs/dbraw/zinc/37/02/70/1046370270.db2.gz QJSJLUGUXOOXKX-UHFFFAOYSA-N 1 2 303.780 4.009 20 0 DIADLO CC1(C)C[C@H]([NH2+]Cc2cc(C3CC3)no2)c2cc(F)ccc2O1 ZINC000639293075 1046378456 /nfs/dbraw/zinc/37/84/56/1046378456.db2.gz CYWHIVDOFHXPBN-INIZCTEOSA-N 1 2 316.376 4.083 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cnc2ccccc2c1 ZINC000780395488 1046384841 /nfs/dbraw/zinc/38/48/41/1046384841.db2.gz NGQBCTZYMISFDA-UHFFFAOYSA-N 1 2 320.371 4.356 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc(Br)nc1Cl ZINC001139107228 1046385955 /nfs/dbraw/zinc/38/59/55/1046385955.db2.gz AJLGZDJLQBWZEG-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ccc(Br)nc1Cl ZINC001139107228 1046385964 /nfs/dbraw/zinc/38/59/64/1046385964.db2.gz AJLGZDJLQBWZEG-AOOOYVTPSA-N 1 2 317.658 4.260 20 0 DIADLO CC[C@@H]1CCC[N@@H+](Cc2ccc(Br)nc2Cl)C1 ZINC001139114784 1046388405 /nfs/dbraw/zinc/38/84/05/1046388405.db2.gz STSALSDNAIJQPL-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@@H]1CCC[N@H+](Cc2ccc(Br)nc2Cl)C1 ZINC001139114784 1046388393 /nfs/dbraw/zinc/38/83/93/1046388393.db2.gz STSALSDNAIJQPL-SNVBAGLBSA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2ccc(Br)nc2Cl)[C@@H]1C ZINC001139112597 1046389778 /nfs/dbraw/zinc/38/97/78/1046389778.db2.gz SDKKHKBWHWNMEN-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2ccc(Br)nc2Cl)[C@@H]1C ZINC001139112597 1046389792 /nfs/dbraw/zinc/38/97/92/1046389792.db2.gz SDKKHKBWHWNMEN-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[N@H+](Cc1ccc(-c2cc(Cl)ccc2Cl)o1)C1COC1 ZINC001139166257 1046400729 /nfs/dbraw/zinc/40/07/29/1046400729.db2.gz UYUHZCSXZLGPTC-UHFFFAOYSA-N 1 2 312.196 4.084 20 0 DIADLO C[N@@H+](Cc1ccc(-c2cc(Cl)ccc2Cl)o1)C1COC1 ZINC001139166257 1046400738 /nfs/dbraw/zinc/40/07/38/1046400738.db2.gz UYUHZCSXZLGPTC-UHFFFAOYSA-N 1 2 312.196 4.084 20 0 DIADLO C[N@H+](CC(=O)[C@H]1CC[C@@H](C(F)(F)F)CC1)Cc1ccsc1 ZINC000639441324 1046401771 /nfs/dbraw/zinc/40/17/71/1046401771.db2.gz KKDHXWKJKCNYLO-BETUJISGSA-N 1 2 319.392 4.118 20 0 DIADLO C[N@@H+](CC(=O)[C@H]1CC[C@@H](C(F)(F)F)CC1)Cc1ccsc1 ZINC000639441324 1046401773 /nfs/dbraw/zinc/40/17/73/1046401773.db2.gz KKDHXWKJKCNYLO-BETUJISGSA-N 1 2 319.392 4.118 20 0 DIADLO c1[nH]c2ccccc2c1C1=CC[N@H+](Cc2coc(C3CC3)n2)CC1 ZINC000780768262 1046403479 /nfs/dbraw/zinc/40/34/79/1046403479.db2.gz QYBRAXZSLWOTII-UHFFFAOYSA-N 1 2 319.408 4.323 20 0 DIADLO c1[nH]c2ccccc2c1C1=CC[N@@H+](Cc2coc(C3CC3)n2)CC1 ZINC000780768262 1046403485 /nfs/dbraw/zinc/40/34/85/1046403485.db2.gz QYBRAXZSLWOTII-UHFFFAOYSA-N 1 2 319.408 4.323 20 0 DIADLO CC(C)([NH2+]Cc1nc(C2CCC2)no1)c1ccc(Cl)cc1 ZINC000639527546 1046408786 /nfs/dbraw/zinc/40/87/86/1046408786.db2.gz SIQPRWIDPZJVRX-UHFFFAOYSA-N 1 2 305.809 4.015 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@H+](C)Cc1cscn1 ZINC000171065034 1046410077 /nfs/dbraw/zinc/41/00/77/1046410077.db2.gz HYAUXBIKUXNVHS-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@@H+](C)Cc1cscn1 ZINC000171065034 1046410081 /nfs/dbraw/zinc/41/00/81/1046410081.db2.gz HYAUXBIKUXNVHS-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO COc1cc(C[N@H+](C)Cc2cccnc2Cl)ccc1SC ZINC000171080585 1046410993 /nfs/dbraw/zinc/41/09/93/1046410993.db2.gz DUQBUYZQQKKIHD-UHFFFAOYSA-N 1 2 322.861 4.098 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2cccnc2Cl)ccc1SC ZINC000171080585 1046410999 /nfs/dbraw/zinc/41/09/99/1046410999.db2.gz DUQBUYZQQKKIHD-UHFFFAOYSA-N 1 2 322.861 4.098 20 0 DIADLO Cc1ccccc1[C@@H]([NH2+]Cc1nc(CC2CC2)no1)C(C)(C)C ZINC000639565015 1046413152 /nfs/dbraw/zinc/41/31/52/1046413152.db2.gz FMXKPYLQNMHMIT-GOSISDBHSA-N 1 2 313.445 4.208 20 0 DIADLO CC(=O)C[NH2+][C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 ZINC000639583679 1046415440 /nfs/dbraw/zinc/41/54/40/1046415440.db2.gz HBVKFUWVXYESKG-JTQLQIEISA-N 1 2 308.834 4.012 20 0 DIADLO Cc1cn2cc(NC(=O)Nc3ccc(C(C)C)cc3)ccc2[nH+]1 ZINC001202916689 1046421888 /nfs/dbraw/zinc/42/18/88/1046421888.db2.gz WFDKTLGBOKVSNW-UHFFFAOYSA-N 1 2 308.385 4.410 20 0 DIADLO C[N@H+](Cc1ccno1)Cc1ccccc1Oc1ccc(F)cc1 ZINC001139302286 1046428130 /nfs/dbraw/zinc/42/81/30/1046428130.db2.gz GEHYTPOSXFRRNI-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO C[N@@H+](Cc1ccno1)Cc1ccccc1Oc1ccc(F)cc1 ZINC001139302286 1046428136 /nfs/dbraw/zinc/42/81/36/1046428136.db2.gz GEHYTPOSXFRRNI-UHFFFAOYSA-N 1 2 312.344 4.238 20 0 DIADLO COc1ccc2cc(C[N@@H+]3CCC[C@](C)(F)C3)c(Cl)nc2c1 ZINC001139310488 1046429587 /nfs/dbraw/zinc/42/95/87/1046429587.db2.gz LGRUZPCSRJITOH-KRWDZBQOSA-N 1 2 322.811 4.221 20 0 DIADLO COc1ccc2cc(C[N@H+]3CCC[C@](C)(F)C3)c(Cl)nc2c1 ZINC001139310488 1046429590 /nfs/dbraw/zinc/42/95/90/1046429590.db2.gz LGRUZPCSRJITOH-KRWDZBQOSA-N 1 2 322.811 4.221 20 0 DIADLO Clc1ccc2cccnc2c1C[N@@H+]1CCC[C@H]1c1ncccn1 ZINC000639844165 1046432687 /nfs/dbraw/zinc/43/26/87/1046432687.db2.gz XPIZBNLVYPZIPZ-INIZCTEOSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1ccc2cccnc2c1C[N@H+]1CCC[C@H]1c1ncccn1 ZINC000639844165 1046432691 /nfs/dbraw/zinc/43/26/91/1046432691.db2.gz XPIZBNLVYPZIPZ-INIZCTEOSA-N 1 2 324.815 4.015 20 0 DIADLO Clc1cnc(Cl)c(C[NH+]2CCC(c3ccccn3)CC2)c1 ZINC001139355645 1046436212 /nfs/dbraw/zinc/43/62/12/1046436212.db2.gz WSOWIZNYOZOPES-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1cnc(Cl)c(C[NH+]2CCC(c3cccnc3)CC2)c1 ZINC001139359219 1046436729 /nfs/dbraw/zinc/43/67/29/1046436729.db2.gz PMYCVRDYZOUZNQ-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2ncc(Cl)cc2Cl)s1 ZINC000639994853 1046441149 /nfs/dbraw/zinc/44/11/49/1046441149.db2.gz FWUPNJPUJMNUPA-SSDOTTSWSA-N 1 2 302.230 4.004 20 0 DIADLO Cc1ncc([C@H](C)[NH2+]Cc2ncc(-c3cccc(F)c3)o2)s1 ZINC000639996244 1046441367 /nfs/dbraw/zinc/44/13/67/1046441367.db2.gz WXLOSWKTSGWXNZ-JTQLQIEISA-N 1 2 317.389 4.096 20 0 DIADLO Cc1ncc([C@@H](C)[NH2+]Cc2nc(-c3ccsc3)oc2C)s1 ZINC000639994848 1046441783 /nfs/dbraw/zinc/44/17/83/1046441783.db2.gz NQYPYROVNZGUGF-SECBINFHSA-N 1 2 319.455 4.327 20 0 DIADLO COc1ncc(C[N@H+](C)[C@H](C)c2ccccc2F)cc1Cl ZINC000676883286 1046443187 /nfs/dbraw/zinc/44/31/87/1046443187.db2.gz JDKRZYLDWPHTIR-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1ncc(C[N@@H+](C)[C@H](C)c2ccccc2F)cc1Cl ZINC000676883286 1046443191 /nfs/dbraw/zinc/44/31/91/1046443191.db2.gz JDKRZYLDWPHTIR-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1ncc(C[N@H+](C)[C@@H](C)c2ccccc2F)cc1Cl ZINC000676883287 1046443522 /nfs/dbraw/zinc/44/35/22/1046443522.db2.gz JDKRZYLDWPHTIR-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1ncc(C[N@@H+](C)[C@@H](C)c2ccccc2F)cc1Cl ZINC000676883287 1046443527 /nfs/dbraw/zinc/44/35/27/1046443527.db2.gz JDKRZYLDWPHTIR-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO O=C1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)CC[C@H]1F ZINC001139414896 1046447567 /nfs/dbraw/zinc/44/75/67/1046447567.db2.gz CZFQKIPOWJGOEI-OAHLLOKOSA-N 1 2 321.779 4.103 20 0 DIADLO O=C1CC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)CC[C@H]1F ZINC001139414896 1046447570 /nfs/dbraw/zinc/44/75/70/1046447570.db2.gz CZFQKIPOWJGOEI-OAHLLOKOSA-N 1 2 321.779 4.103 20 0 DIADLO C[C@@H]1CCC[C@@H](OCc2cccc(NCc3c[nH+]cn3C)c2)C1 ZINC000123860935 1046450338 /nfs/dbraw/zinc/45/03/38/1046450338.db2.gz KUFCZZHQTCDIRM-DNVCBOLYSA-N 1 2 313.445 4.128 20 0 DIADLO CCCCCC[C@H](C)CC(=O)N1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000247011628 1046451807 /nfs/dbraw/zinc/45/18/07/1046451807.db2.gz DEZCSFGJHHRONO-KSZLIROESA-N 1 2 319.493 4.289 20 0 DIADLO Clc1ccnc(Cl)c1C[N@@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001139478479 1046454269 /nfs/dbraw/zinc/45/42/69/1046454269.db2.gz MIIPQRYKCCIBGR-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccnc(Cl)c1C[N@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001139478479 1046454274 /nfs/dbraw/zinc/45/42/74/1046454274.db2.gz MIIPQRYKCCIBGR-ZDUSSCGKSA-N 1 2 323.223 4.042 20 0 DIADLO Clc1ccnc(Cl)c1C[N@@H+]1CCC[C@H](c2ccccn2)C1 ZINC001139479455 1046454382 /nfs/dbraw/zinc/45/43/82/1046454382.db2.gz JOOPAOWQOITYGT-LBPRGKRZSA-N 1 2 322.239 4.163 20 0 DIADLO Clc1ccnc(Cl)c1C[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC001139479455 1046454386 /nfs/dbraw/zinc/45/43/86/1046454386.db2.gz JOOPAOWQOITYGT-LBPRGKRZSA-N 1 2 322.239 4.163 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1ccc(-c3ccsc3)nc1)C2 ZINC001139503587 1046458187 /nfs/dbraw/zinc/45/81/87/1046458187.db2.gz IMSNLWOISGVETC-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1ccc(-c3ccsc3)nc1)C2 ZINC001139503587 1046458191 /nfs/dbraw/zinc/45/81/91/1046458191.db2.gz IMSNLWOISGVETC-UHFFFAOYSA-N 1 2 322.433 4.335 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2ccc(-c3ccsc3)nc2)C[C@H]1F ZINC001139501515 1046458428 /nfs/dbraw/zinc/45/84/28/1046458428.db2.gz UBPWCJMJSHZHNY-CVEARBPZSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2ccc(-c3ccsc3)nc2)C[C@H]1F ZINC001139501515 1046458436 /nfs/dbraw/zinc/45/84/36/1046458436.db2.gz UBPWCJMJSHZHNY-CVEARBPZSA-N 1 2 308.397 4.082 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2ccc(-c3ccccc3)nc2)C[C@@H]1F ZINC001139520738 1046461369 /nfs/dbraw/zinc/46/13/69/1046461369.db2.gz PNXNFCUVSORYOG-ZWKOTPCHSA-N 1 2 302.368 4.021 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2ccc(-c3ccccc3)nc2)C[C@@H]1F ZINC001139520738 1046461378 /nfs/dbraw/zinc/46/13/78/1046461378.db2.gz PNXNFCUVSORYOG-ZWKOTPCHSA-N 1 2 302.368 4.021 20 0 DIADLO Fc1c(Br)cccc1C[N@H+]1CCC[C@@H](C(F)F)C1 ZINC001139533217 1046465436 /nfs/dbraw/zinc/46/54/36/1046465436.db2.gz WMZWXNACNGFNAT-SNVBAGLBSA-N 1 2 322.168 4.065 20 0 DIADLO Fc1c(Br)cccc1C[N@@H+]1CCC[C@@H](C(F)F)C1 ZINC001139533217 1046465445 /nfs/dbraw/zinc/46/54/45/1046465445.db2.gz WMZWXNACNGFNAT-SNVBAGLBSA-N 1 2 322.168 4.065 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cnc(Cl)c(C)c2)cn1 ZINC001139547050 1046468518 /nfs/dbraw/zinc/46/85/18/1046468518.db2.gz VYAOBDKCVYDGPB-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cnc(Cl)c(C)c2)cn1 ZINC001139547050 1046468521 /nfs/dbraw/zinc/46/85/21/1046468521.db2.gz VYAOBDKCVYDGPB-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Clc1cccc(C[N@H+](Cc2ccccc2)Cc2ccncc2)n1 ZINC001139548036 1046468817 /nfs/dbraw/zinc/46/88/17/1046468817.db2.gz UMZAWMTZJTUGEV-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1cccc(C[N@@H+](Cc2ccccc2)Cc2ccncc2)n1 ZINC001139548036 1046468819 /nfs/dbraw/zinc/46/88/19/1046468819.db2.gz UMZAWMTZJTUGEV-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cccc(Cl)n1 ZINC001139552698 1046470380 /nfs/dbraw/zinc/47/03/80/1046470380.db2.gz RLUXAOAFBOUPDR-MRXNPFEDSA-N 1 2 316.832 4.218 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cccc(Cl)n1 ZINC001139552698 1046470381 /nfs/dbraw/zinc/47/03/81/1046470381.db2.gz RLUXAOAFBOUPDR-MRXNPFEDSA-N 1 2 316.832 4.218 20 0 DIADLO CC(C)[N@H+](Cc1coc(-c2ccccc2)n1)Cc1cccnc1 ZINC000125666374 1046470496 /nfs/dbraw/zinc/47/04/96/1046470496.db2.gz HJLPPKFYSDGTAU-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO CC(C)[N@@H+](Cc1coc(-c2ccccc2)n1)Cc1cccnc1 ZINC000125666374 1046470501 /nfs/dbraw/zinc/47/05/01/1046470501.db2.gz HJLPPKFYSDGTAU-UHFFFAOYSA-N 1 2 307.397 4.147 20 0 DIADLO Clc1ccnc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC001139563871 1046472167 /nfs/dbraw/zinc/47/21/67/1046472167.db2.gz WGTAKACAMBHCFN-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccnc(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC001139563871 1046472172 /nfs/dbraw/zinc/47/21/72/1046472172.db2.gz WGTAKACAMBHCFN-MRXNPFEDSA-N 1 2 304.846 4.025 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cc(Cl)ccn1 ZINC001139565452 1046473098 /nfs/dbraw/zinc/47/30/98/1046473098.db2.gz ZYAOMUKKGGJOPG-KRWDZBQOSA-N 1 2 316.832 4.218 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cc(Cl)ccn1 ZINC001139565452 1046473104 /nfs/dbraw/zinc/47/31/04/1046473104.db2.gz ZYAOMUKKGGJOPG-KRWDZBQOSA-N 1 2 316.832 4.218 20 0 DIADLO Clc1ccccc1-c1ccccc1C[NH+]1CC2(C1)CCCO2 ZINC001139573392 1046474855 /nfs/dbraw/zinc/47/48/55/1046474855.db2.gz DMNIRQFACLEEPU-UHFFFAOYSA-N 1 2 313.828 4.372 20 0 DIADLO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cc(C)cnc1Cl ZINC001139595842 1046480737 /nfs/dbraw/zinc/48/07/37/1046480737.db2.gz PKHYSSMDUDGUCY-CYBMUJFWSA-N 1 2 304.821 4.245 20 0 DIADLO COc1ccccc1[C@@H](C)[N@@H+](C)Cc1cc(C)cnc1Cl ZINC001139595842 1046480743 /nfs/dbraw/zinc/48/07/43/1046480743.db2.gz PKHYSSMDUDGUCY-CYBMUJFWSA-N 1 2 304.821 4.245 20 0 DIADLO CC(C)[N@H+](C)Cc1c(Br)cccc1Br ZINC001139599039 1046482591 /nfs/dbraw/zinc/48/25/91/1046482591.db2.gz VAEPQRBUXGTFOG-UHFFFAOYSA-N 1 2 321.056 4.052 20 0 DIADLO CC(C)[N@@H+](C)Cc1c(Br)cccc1Br ZINC001139599039 1046482593 /nfs/dbraw/zinc/48/25/93/1046482593.db2.gz VAEPQRBUXGTFOG-UHFFFAOYSA-N 1 2 321.056 4.052 20 0 DIADLO Cc1csc(C[N@@H+]2CCOC[C@H]2Cc2ccccc2)c1Cl ZINC001137294079 1046484002 /nfs/dbraw/zinc/48/40/02/1046484002.db2.gz PEYIPMHNUYXVDA-OAHLLOKOSA-N 1 2 321.873 4.153 20 0 DIADLO Cc1csc(C[N@H+]2CCOC[C@H]2Cc2ccccc2)c1Cl ZINC001137294079 1046484011 /nfs/dbraw/zinc/48/40/11/1046484011.db2.gz PEYIPMHNUYXVDA-OAHLLOKOSA-N 1 2 321.873 4.153 20 0 DIADLO Cc1csc(C[N@H+]2CCC(=O)[C@H](C)C23CCCC3)c1Cl ZINC001137294131 1046485537 /nfs/dbraw/zinc/48/55/37/1046485537.db2.gz QYXKKIPFWHZXED-LBPRGKRZSA-N 1 2 311.878 4.434 20 0 DIADLO Cc1csc(C[N@@H+]2CCC(=O)[C@H](C)C23CCCC3)c1Cl ZINC001137294131 1046485539 /nfs/dbraw/zinc/48/55/39/1046485539.db2.gz QYXKKIPFWHZXED-LBPRGKRZSA-N 1 2 311.878 4.434 20 0 DIADLO Cc1csc(C[N@H+]2CCC(=O)[C@@H](C)C23CCCC3)c1Cl ZINC001137294130 1046485776 /nfs/dbraw/zinc/48/57/76/1046485776.db2.gz QYXKKIPFWHZXED-GFCCVEGCSA-N 1 2 311.878 4.434 20 0 DIADLO Cc1csc(C[N@@H+]2CCC(=O)[C@@H](C)C23CCCC3)c1Cl ZINC001137294130 1046485781 /nfs/dbraw/zinc/48/57/81/1046485781.db2.gz QYXKKIPFWHZXED-GFCCVEGCSA-N 1 2 311.878 4.434 20 0 DIADLO COc1cc(C[N@@H+]2CCC(=O)[C@H](C)C23CCCC3)ccc1Cl ZINC001139616463 1046485956 /nfs/dbraw/zinc/48/59/56/1046485956.db2.gz JZHVCWCTUICEBB-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO COc1cc(C[N@H+]2CCC(=O)[C@H](C)C23CCCC3)ccc1Cl ZINC001139616463 1046485963 /nfs/dbraw/zinc/48/59/63/1046485963.db2.gz JZHVCWCTUICEBB-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO CCc1cccc(CC)c1NC(=O)NCc1c[nH+]c(C)cc1C ZINC000454225045 1046491669 /nfs/dbraw/zinc/49/16/69/1046491669.db2.gz WOQGXBNFABMVTC-UHFFFAOYSA-N 1 2 311.429 4.145 20 0 DIADLO CCC[N@H+](CC)Cc1csc(N(C(C)=O)c2ccccc2)n1 ZINC000677375017 1046492704 /nfs/dbraw/zinc/49/27/04/1046492704.db2.gz AMNQXZWISRIZEW-UHFFFAOYSA-N 1 2 317.458 4.060 20 0 DIADLO CCC[N@@H+](CC)Cc1csc(N(C(C)=O)c2ccccc2)n1 ZINC000677375017 1046492707 /nfs/dbraw/zinc/49/27/07/1046492707.db2.gz AMNQXZWISRIZEW-UHFFFAOYSA-N 1 2 317.458 4.060 20 0 DIADLO Cc1oncc1C[N@@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000128337638 1046493687 /nfs/dbraw/zinc/49/36/87/1046493687.db2.gz NGHHWVRYNIJHAR-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1oncc1C[N@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000128337638 1046493691 /nfs/dbraw/zinc/49/36/91/1046493691.db2.gz NGHHWVRYNIJHAR-OAHLLOKOSA-N 1 2 321.218 4.083 20 0 DIADLO C[C@H](N[C@H]1C[N@H+](C)Cc2ccccc21)c1ccccc1Cl ZINC000677413605 1046494261 /nfs/dbraw/zinc/49/42/61/1046494261.db2.gz KXEXYSCSDYLLLZ-UGSOOPFHSA-N 1 2 300.833 4.177 20 0 DIADLO C[C@H](N[C@H]1C[N@@H+](C)Cc2ccccc21)c1ccccc1Cl ZINC000677413605 1046494266 /nfs/dbraw/zinc/49/42/66/1046494266.db2.gz KXEXYSCSDYLLLZ-UGSOOPFHSA-N 1 2 300.833 4.177 20 0 DIADLO C[C@@H](N[C@H]1C[N@H+](C)Cc2ccccc21)c1ccccc1Cl ZINC000677413602 1046494534 /nfs/dbraw/zinc/49/45/34/1046494534.db2.gz KXEXYSCSDYLLLZ-ACJLOTCBSA-N 1 2 300.833 4.177 20 0 DIADLO C[C@@H](N[C@H]1C[N@@H+](C)Cc2ccccc21)c1ccccc1Cl ZINC000677413602 1046494546 /nfs/dbraw/zinc/49/45/46/1046494546.db2.gz KXEXYSCSDYLLLZ-ACJLOTCBSA-N 1 2 300.833 4.177 20 0 DIADLO Cc1cccc2nc(C[N@@H+]3CCC[C@@H]3c3ccccc3F)cn21 ZINC001137300732 1046497620 /nfs/dbraw/zinc/49/76/20/1046497620.db2.gz OZDMPKAKYIGSER-GOSISDBHSA-N 1 2 309.388 4.119 20 0 DIADLO Cc1cccc2nc(C[N@H+]3CCC[C@@H]3c3ccccc3F)cn21 ZINC001137300732 1046497625 /nfs/dbraw/zinc/49/76/25/1046497625.db2.gz OZDMPKAKYIGSER-GOSISDBHSA-N 1 2 309.388 4.119 20 0 DIADLO CCC[C@H](C)[N@@H+]1CCO[C@@H](c2ccccc2Br)C1 ZINC000782181287 1046497765 /nfs/dbraw/zinc/49/77/65/1046497765.db2.gz RACMARQWDGBETO-SWLSCSKDSA-N 1 2 312.251 4.011 20 0 DIADLO CCC[C@H](C)[N@H+]1CCO[C@@H](c2ccccc2Br)C1 ZINC000782181287 1046497767 /nfs/dbraw/zinc/49/77/67/1046497767.db2.gz RACMARQWDGBETO-SWLSCSKDSA-N 1 2 312.251 4.011 20 0 DIADLO Clc1ccc2c(c1)CC[C@H]2[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000782180930 1046498151 /nfs/dbraw/zinc/49/81/51/1046498151.db2.gz LFXFWNDCWDDKCA-CVEARBPZSA-N 1 2 319.857 4.462 20 0 DIADLO Clc1ccc2c(c1)CC[C@H]2[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000782180930 1046498152 /nfs/dbraw/zinc/49/81/52/1046498152.db2.gz LFXFWNDCWDDKCA-CVEARBPZSA-N 1 2 319.857 4.462 20 0 DIADLO Cc1cc([C@@H]([NH2+]Cc2n[nH]c3ccccc32)C2CC2)ccc1F ZINC000677521428 1046500590 /nfs/dbraw/zinc/50/05/90/1046500590.db2.gz RZGFTVFJUJECIP-IBGZPJMESA-N 1 2 309.388 4.251 20 0 DIADLO c1sc(C2CC2)nc1C[N@@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000677555572 1046502943 /nfs/dbraw/zinc/50/29/43/1046502943.db2.gz IOKXFGVWUHZBGE-MRXNPFEDSA-N 1 2 316.495 4.311 20 0 DIADLO c1sc(C2CC2)nc1C[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000677555572 1046502948 /nfs/dbraw/zinc/50/29/48/1046502948.db2.gz IOKXFGVWUHZBGE-MRXNPFEDSA-N 1 2 316.495 4.311 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1ncc(C2CC2)o1 ZINC000677683671 1046511867 /nfs/dbraw/zinc/51/18/67/1046511867.db2.gz ORQYVJFKZHDYLA-INIZCTEOSA-N 1 2 312.413 4.288 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1ncc(C2CC2)o1 ZINC000677683671 1046511877 /nfs/dbraw/zinc/51/18/77/1046511877.db2.gz ORQYVJFKZHDYLA-INIZCTEOSA-N 1 2 312.413 4.288 20 0 DIADLO Cc1[nH]c(CNc2ccc(Cl)c(C(F)(F)F)c2)[nH+]c1C ZINC000641766164 1046512063 /nfs/dbraw/zinc/51/20/63/1046512063.db2.gz XLUANONYMQRUFU-UHFFFAOYSA-N 1 2 303.715 4.311 20 0 DIADLO Clc1ccc([C@@H]2CSCC[N@@H+]2Cc2ccncc2)cc1 ZINC000130628936 1046513953 /nfs/dbraw/zinc/51/39/53/1046513953.db2.gz YPGUWELHNQDXMJ-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO Clc1ccc([C@@H]2CSCC[N@H+]2Cc2ccncc2)cc1 ZINC000130628936 1046513964 /nfs/dbraw/zinc/51/39/64/1046513964.db2.gz YPGUWELHNQDXMJ-INIZCTEOSA-N 1 2 304.846 4.025 20 0 DIADLO CC(C)(C)c1nc(C[NH+]2CC(Cc3ccc(F)cc3)C2)cs1 ZINC000677700346 1046514648 /nfs/dbraw/zinc/51/46/48/1046514648.db2.gz MLZYKVGYWRFGNJ-UHFFFAOYSA-N 1 2 318.461 4.254 20 0 DIADLO CC[C@H]([NH2+]Cc1nsc2ccccc12)c1ccc(F)cn1 ZINC000641792189 1046515719 /nfs/dbraw/zinc/51/57/19/1046515719.db2.gz QAIGUKVWEGSFMN-ZDUSSCGKSA-N 1 2 301.390 4.071 20 0 DIADLO Cc1ccccc1Nc1nc(C[N@@H+]2CC[C@@H](C(F)F)C2)cs1 ZINC000677736219 1046517859 /nfs/dbraw/zinc/51/78/59/1046517859.db2.gz ZNHGKSDIVQSDQW-GFCCVEGCSA-N 1 2 323.412 4.282 20 0 DIADLO Cc1ccccc1Nc1nc(C[N@H+]2CC[C@@H](C(F)F)C2)cs1 ZINC000677736219 1046517869 /nfs/dbraw/zinc/51/78/69/1046517869.db2.gz ZNHGKSDIVQSDQW-GFCCVEGCSA-N 1 2 323.412 4.282 20 0 DIADLO Oc1cccc(CNc2[nH+]c3ccccc3n2C2CCCC2)c1 ZINC000677741776 1046520262 /nfs/dbraw/zinc/52/02/62/1046520262.db2.gz BJTQPCARQJLBLL-UHFFFAOYSA-N 1 2 307.397 4.469 20 0 DIADLO CCC1CC[NH+](Cc2cc(Cl)ncc2Br)CC1 ZINC001139806308 1046521465 /nfs/dbraw/zinc/52/14/65/1046521465.db2.gz RCPOSVLOWQKZQF-UHFFFAOYSA-N 1 2 317.658 4.120 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)s1 ZINC001139821768 1046525584 /nfs/dbraw/zinc/52/55/84/1046525584.db2.gz QTIMRWVTLMCQFN-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)s1 ZINC001139821768 1046525593 /nfs/dbraw/zinc/52/55/93/1046525593.db2.gz QTIMRWVTLMCQFN-AWEZNQCLSA-N 1 2 308.834 4.142 20 0 DIADLO CCCCOC1C[NH+](Cc2sc(-c3ccccc3)nc2C)C1 ZINC001139822776 1046527257 /nfs/dbraw/zinc/52/72/57/1046527257.db2.gz OEODZWQPKITWST-UHFFFAOYSA-N 1 2 316.470 4.119 20 0 DIADLO Cc1ccc(N(C)Cc2c[nH+]cn2Cc2ccccc2)cc1C ZINC000782483015 1046528449 /nfs/dbraw/zinc/52/84/49/1046528449.db2.gz OKERPRXBHUOCHK-UHFFFAOYSA-N 1 2 305.425 4.185 20 0 DIADLO c1ccc2c(c1)sc1c2cccc1C[N@@H+]1Cc2cncnc2C1 ZINC001139843108 1046529603 /nfs/dbraw/zinc/52/96/03/1046529603.db2.gz JOJUNWYVFYQUSK-UHFFFAOYSA-N 1 2 317.417 4.360 20 0 DIADLO c1ccc2c(c1)sc1c2cccc1C[N@H+]1Cc2cncnc2C1 ZINC001139843108 1046529614 /nfs/dbraw/zinc/52/96/14/1046529614.db2.gz JOJUNWYVFYQUSK-UHFFFAOYSA-N 1 2 317.417 4.360 20 0 DIADLO CC(C)(C)Oc1ccc(CNc2nc(N)c3ccccc3[nH+]2)cc1 ZINC000677878355 1046534064 /nfs/dbraw/zinc/53/40/64/1046534064.db2.gz OKKCYBYYCWOGPE-UHFFFAOYSA-N 1 2 322.412 4.001 20 0 DIADLO O=C(C[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1)Nc1ccccc1 ZINC000641976648 1046533901 /nfs/dbraw/zinc/53/39/01/1046533901.db2.gz SWCGDVVUBFTXNR-QGZVFWFLSA-N 1 2 314.816 4.116 20 0 DIADLO O=C(C[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1)Nc1ccccc1 ZINC000641976648 1046533904 /nfs/dbraw/zinc/53/39/04/1046533904.db2.gz SWCGDVVUBFTXNR-QGZVFWFLSA-N 1 2 314.816 4.116 20 0 DIADLO O=C1C[N@@H+](Cc2cccc3c4ccccc4oc32)CCC[C@@H]1F ZINC001139855744 1046534647 /nfs/dbraw/zinc/53/46/47/1046534647.db2.gz APCWQQKVUVALAO-INIZCTEOSA-N 1 2 311.356 4.089 20 0 DIADLO O=C1C[N@H+](Cc2cccc3c4ccccc4oc32)CCC[C@@H]1F ZINC001139855744 1046534658 /nfs/dbraw/zinc/53/46/58/1046534658.db2.gz APCWQQKVUVALAO-INIZCTEOSA-N 1 2 311.356 4.089 20 0 DIADLO C[N@@H+](Cc1cccc2c3ccccc3oc21)Cc1ncccn1 ZINC001139857962 1046535424 /nfs/dbraw/zinc/53/54/24/1046535424.db2.gz UECIWJQDXIGNDQ-UHFFFAOYSA-N 1 2 303.365 4.008 20 0 DIADLO C[N@H+](Cc1cccc2c3ccccc3oc21)Cc1ncccn1 ZINC001139857962 1046535435 /nfs/dbraw/zinc/53/54/35/1046535435.db2.gz UECIWJQDXIGNDQ-UHFFFAOYSA-N 1 2 303.365 4.008 20 0 DIADLO CC(C)c1csc(C[NH2+][C@H](C)c2ccnn2C2CCC2)n1 ZINC000925281983 1046536828 /nfs/dbraw/zinc/53/68/28/1046536828.db2.gz GOXUQNVZHMLREL-GFCCVEGCSA-N 1 2 304.463 4.039 20 0 DIADLO Cc1csc(C[N@H+]2CCC[C@H](Oc3ccccc3Cl)C2)n1 ZINC000133043898 1046537380 /nfs/dbraw/zinc/53/73/80/1046537380.db2.gz MTEGSPAKFPOIEB-ZDUSSCGKSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1csc(C[N@@H+]2CCC[C@H](Oc3ccccc3Cl)C2)n1 ZINC000133043898 1046537367 /nfs/dbraw/zinc/53/73/67/1046537367.db2.gz MTEGSPAKFPOIEB-ZDUSSCGKSA-N 1 2 322.861 4.148 20 0 DIADLO COc1c(Cl)cccc1C[NH2+]Cc1ncc(C(C)C)s1 ZINC000897481483 1046546818 /nfs/dbraw/zinc/54/68/18/1046546818.db2.gz FSDLGAYPGRQRBE-UHFFFAOYSA-N 1 2 310.850 4.218 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccc(Cl)nc1 ZINC000179141293 1046553280 /nfs/dbraw/zinc/55/32/80/1046553280.db2.gz BJLOYBPYYDQVNW-JTQLQIEISA-N 1 2 319.817 4.302 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cscc2Cl)cc1OC ZINC000678122810 1046556912 /nfs/dbraw/zinc/55/69/12/1046556912.db2.gz FXPZHGCSNNUUTP-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cscc2Cl)cc1OC ZINC000678122810 1046556919 /nfs/dbraw/zinc/55/69/19/1046556919.db2.gz FXPZHGCSNNUUTP-UHFFFAOYSA-N 1 2 311.834 4.051 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2sc(Cl)nc2Cl)CCC1(F)F ZINC001139954277 1046557065 /nfs/dbraw/zinc/55/70/65/1046557065.db2.gz ZXMLBRRCFIJUFQ-SSDOTTSWSA-N 1 2 315.216 4.317 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2sc(Cl)nc2Cl)CCC1(F)F ZINC001139954277 1046557076 /nfs/dbraw/zinc/55/70/76/1046557076.db2.gz ZXMLBRRCFIJUFQ-SSDOTTSWSA-N 1 2 315.216 4.317 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@@H+]1Cc1cccnn1 ZINC001139976342 1046559808 /nfs/dbraw/zinc/55/98/08/1046559808.db2.gz XUHSWXRDUOIOOS-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO FC(F)(F)c1ccccc1[C@@H]1CCCC[N@H+]1Cc1cccnn1 ZINC001139976342 1046559817 /nfs/dbraw/zinc/55/98/17/1046559817.db2.gz XUHSWXRDUOIOOS-INIZCTEOSA-N 1 2 321.346 4.223 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1nn(C)c2ccccc12 ZINC000678136746 1046566725 /nfs/dbraw/zinc/56/67/25/1046566725.db2.gz HODZIRAMXVWZFJ-ZDUSSCGKSA-N 1 2 313.832 4.420 20 0 DIADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1nn(C)c2ccccc12 ZINC000678136746 1046566738 /nfs/dbraw/zinc/56/67/38/1046566738.db2.gz HODZIRAMXVWZFJ-ZDUSSCGKSA-N 1 2 313.832 4.420 20 0 DIADLO c1ccc([C@H]2CC[C@H]([NH2+]c3ccc(N4CCOCC4)cc3)C2)cc1 ZINC000783267890 1046571443 /nfs/dbraw/zinc/57/14/43/1046571443.db2.gz LUZGFFAPXMJVIL-ICSRJNTNSA-N 1 2 322.452 4.271 20 0 DIADLO c1c[nH]c([C@H](Nc2ccc([NH+]3CCCC3)cc2)c2ccccc2)n1 ZINC000783267821 1046571764 /nfs/dbraw/zinc/57/17/64/1046571764.db2.gz LHDYPLCTBSCUPP-LJQANCHMSA-N 1 2 318.424 4.211 20 0 DIADLO CN(CCO)c1ccc([NH2+][C@H]2CC[C@](C)(c3ccccc3)C2)cc1 ZINC000783280089 1046573661 /nfs/dbraw/zinc/57/36/61/1046573661.db2.gz IXFIJSBXHDFBFV-FPOVZHCZSA-N 1 2 324.468 4.037 20 0 DIADLO C[N@@H+](Cc1ccccc1C(F)(F)F)Cc1cc(O)ccc1F ZINC001140049005 1046574619 /nfs/dbraw/zinc/57/46/19/1046574619.db2.gz UHFQWUJOOZVWER-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO C[N@H+](Cc1ccccc1C(F)(F)F)Cc1cc(O)ccc1F ZINC001140049005 1046574625 /nfs/dbraw/zinc/57/46/25/1046574625.db2.gz UHFQWUJOOZVWER-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1cnc(C(C)(C)C)s1 ZINC000678196700 1046582664 /nfs/dbraw/zinc/58/26/64/1046582664.db2.gz BFUAQSUBSQTFBC-CYBMUJFWSA-N 1 2 316.470 4.396 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1cnc(C(C)(C)C)s1 ZINC000678196700 1046582676 /nfs/dbraw/zinc/58/26/76/1046582676.db2.gz BFUAQSUBSQTFBC-CYBMUJFWSA-N 1 2 316.470 4.396 20 0 DIADLO COc1c(Cl)cccc1C[N@@H+]1CCOC[C@H]1C1CCCCC1 ZINC001140063474 1046582848 /nfs/dbraw/zinc/58/28/48/1046582848.db2.gz WIGLHCALIYITLT-KRWDZBQOSA-N 1 2 323.864 4.130 20 0 DIADLO COc1c(Cl)cccc1C[N@H+]1CCOC[C@H]1C1CCCCC1 ZINC001140063474 1046582856 /nfs/dbraw/zinc/58/28/56/1046582856.db2.gz WIGLHCALIYITLT-KRWDZBQOSA-N 1 2 323.864 4.130 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@H+]1Cc1cnc(C2CCC2)s1 ZINC000678197071 1046584031 /nfs/dbraw/zinc/58/40/31/1046584031.db2.gz PYGBMVHRAYPARV-ZDUSSCGKSA-N 1 2 314.454 4.366 20 0 DIADLO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1cnc(C2CCC2)s1 ZINC000678197071 1046584045 /nfs/dbraw/zinc/58/40/45/1046584045.db2.gz PYGBMVHRAYPARV-ZDUSSCGKSA-N 1 2 314.454 4.366 20 0 DIADLO Clc1cc(Br)ncc1C[NH+]1CCCCCCC1 ZINC001140077916 1046585168 /nfs/dbraw/zinc/58/51/68/1046585168.db2.gz ASIMWNUYLDPFMP-UHFFFAOYSA-N 1 2 317.658 4.264 20 0 DIADLO CCc1nc([C@H]2CCCC[N@@H+]2Cc2ccccc2C2CC2)no1 ZINC000678202290 1046585310 /nfs/dbraw/zinc/58/53/10/1046585310.db2.gz NIKASSVZERIFOE-QGZVFWFLSA-N 1 2 311.429 4.237 20 0 DIADLO CCc1nc([C@H]2CCCC[N@H+]2Cc2ccccc2C2CC2)no1 ZINC000678202290 1046585317 /nfs/dbraw/zinc/58/53/17/1046585317.db2.gz NIKASSVZERIFOE-QGZVFWFLSA-N 1 2 311.429 4.237 20 0 DIADLO Fc1ccc(-c2ncc(C[N@@H+]3CCc4occc4C3)s2)cc1 ZINC001140097319 1046587967 /nfs/dbraw/zinc/58/79/67/1046587967.db2.gz QJJDUXDSJMXURF-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Fc1ccc(-c2ncc(C[N@H+]3CCc4occc4C3)s2)cc1 ZINC001140097319 1046587980 /nfs/dbraw/zinc/58/79/80/1046587980.db2.gz QJJDUXDSJMXURF-UHFFFAOYSA-N 1 2 314.385 4.101 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)c(F)cc2F)cc1 ZINC000678213219 1046589548 /nfs/dbraw/zinc/58/95/48/1046589548.db2.gz PABIBTYGTBAAKE-KRWDZBQOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)c(F)cc2F)cc1 ZINC000678213219 1046589561 /nfs/dbraw/zinc/58/95/61/1046589561.db2.gz PABIBTYGTBAAKE-KRWDZBQOSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)c(F)cc2F)cc1 ZINC000678213221 1046591260 /nfs/dbraw/zinc/59/12/60/1046591260.db2.gz PABIBTYGTBAAKE-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)c(F)cc2F)cc1 ZINC000678213221 1046591270 /nfs/dbraw/zinc/59/12/70/1046591270.db2.gz PABIBTYGTBAAKE-QGZVFWFLSA-N 1 2 307.315 4.147 20 0 DIADLO c1cc(C[N@H+](Cc2ccccc2)Cc2ccccc2C2CC2)n[nH]1 ZINC000678237241 1046597316 /nfs/dbraw/zinc/59/73/16/1046597316.db2.gz PFSWELRRJCQPJI-UHFFFAOYSA-N 1 2 317.436 4.490 20 0 DIADLO c1cc(C[N@@H+](Cc2ccccc2)Cc2ccccc2C2CC2)n[nH]1 ZINC000678237241 1046597325 /nfs/dbraw/zinc/59/73/25/1046597325.db2.gz PFSWELRRJCQPJI-UHFFFAOYSA-N 1 2 317.436 4.490 20 0 DIADLO c1cc(C[N@@H+]2CCCC[C@H]2c2nc(-c3ccccc3)no2)co1 ZINC000093005215 1046601257 /nfs/dbraw/zinc/60/12/57/1046601257.db2.gz WSWQXFUGSBODPK-INIZCTEOSA-N 1 2 309.369 4.057 20 0 DIADLO c1cc(C[N@H+]2CCCC[C@H]2c2nc(-c3ccccc3)no2)co1 ZINC000093005215 1046601262 /nfs/dbraw/zinc/60/12/62/1046601262.db2.gz WSWQXFUGSBODPK-INIZCTEOSA-N 1 2 309.369 4.057 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1ccc(-c3ccncc3)cc1)C2 ZINC001140173145 1046608210 /nfs/dbraw/zinc/60/82/10/1046608210.db2.gz NCIDMRSCNBNKHY-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1ccc(-c3ccncc3)cc1)C2 ZINC001140173145 1046608215 /nfs/dbraw/zinc/60/82/15/1046608215.db2.gz NCIDMRSCNBNKHY-UHFFFAOYSA-N 1 2 304.368 4.404 20 0 DIADLO CCC1(O)CC[NH+](Cc2c(Cl)ccc(Cl)c2Cl)CC1 ZINC000678278332 1046608327 /nfs/dbraw/zinc/60/83/27/1046608327.db2.gz XOGMUOQWAIHWFG-UHFFFAOYSA-N 1 2 322.663 4.384 20 0 DIADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc(C2CC2)c1 ZINC001625981659 1046609010 /nfs/dbraw/zinc/60/90/10/1046609010.db2.gz KMCOPEGNMLGBGG-UHFFFAOYSA-N 1 2 303.365 4.206 20 0 DIADLO Cc1ncc(C[N@@H+]2CC[C@H]2c2cccc(F)c2)n1-c1ccccc1 ZINC000678284088 1046611465 /nfs/dbraw/zinc/61/14/65/1046611465.db2.gz UUBCPCCPCGYBCM-FQEVSTJZSA-N 1 2 321.399 4.267 20 0 DIADLO Cc1ncc(C[N@H+]2CC[C@H]2c2cccc(F)c2)n1-c1ccccc1 ZINC000678284088 1046611473 /nfs/dbraw/zinc/61/14/73/1046611473.db2.gz UUBCPCCPCGYBCM-FQEVSTJZSA-N 1 2 321.399 4.267 20 0 DIADLO Cc1[nH+]cc(CN2CC[C@H]2c2cccc(F)c2)n1-c1ccccc1 ZINC000678284088 1046611482 /nfs/dbraw/zinc/61/14/82/1046611482.db2.gz UUBCPCCPCGYBCM-FQEVSTJZSA-N 1 2 321.399 4.267 20 0 DIADLO Clc1cc([NH2+]CC[C@@H]2CCOC2)ccc1N1CCCCC1 ZINC000783582465 1046611686 /nfs/dbraw/zinc/61/16/86/1046611686.db2.gz HWIDSCHVXFTQII-CQSZACIVSA-N 1 2 308.853 4.169 20 0 DIADLO Cc1ccc(-c2ccc(C[N@@H+]3CCO[C@@H](c4ccco4)C3)o2)cc1 ZINC000678295012 1046615578 /nfs/dbraw/zinc/61/55/78/1046615578.db2.gz VDMRHJFYKRZPFH-HXUWFJFHSA-N 1 2 323.392 4.422 20 0 DIADLO Cc1ccc(-c2ccc(C[N@H+]3CCO[C@@H](c4ccco4)C3)o2)cc1 ZINC000678295012 1046615586 /nfs/dbraw/zinc/61/55/86/1046615586.db2.gz VDMRHJFYKRZPFH-HXUWFJFHSA-N 1 2 323.392 4.422 20 0 DIADLO CC(C)c1nc(C[N@H+](C)CCOc2ccccc2Cl)cs1 ZINC000642524115 1046616812 /nfs/dbraw/zinc/61/68/12/1046616812.db2.gz SAFBORBPOCZNCW-UHFFFAOYSA-N 1 2 324.877 4.431 20 0 DIADLO CC(C)c1nc(C[N@@H+](C)CCOc2ccccc2Cl)cs1 ZINC000642524115 1046616816 /nfs/dbraw/zinc/61/68/16/1046616816.db2.gz SAFBORBPOCZNCW-UHFFFAOYSA-N 1 2 324.877 4.431 20 0 DIADLO CC(C)(C)OCc1ccc(NCc2cccc3[nH+]ccn32)cc1 ZINC000678303724 1046617198 /nfs/dbraw/zinc/61/71/98/1046617198.db2.gz UUOPABSBLIRLME-UHFFFAOYSA-N 1 2 309.413 4.262 20 0 DIADLO Clc1ccc(C[NH2+]Cc2ncc(-c3ccccc3)s2)o1 ZINC000678359024 1046625060 /nfs/dbraw/zinc/62/50/60/1046625060.db2.gz HNLOESNAKMITFQ-UHFFFAOYSA-N 1 2 304.802 4.346 20 0 DIADLO Cc1sc(/C=C\c2cc(-n3cc[nH+]c3)cs2)cc1C=O ZINC000783709572 1046625787 /nfs/dbraw/zinc/62/57/87/1046625787.db2.gz QCXXCSGNGWREGZ-IHWYPQMZSA-N 1 2 300.408 4.287 20 0 DIADLO Cc1ccc(C)c([C@@H]([NH2+][C@H]2CCn3ccnc32)c2ccccc2)c1 ZINC000834547363 1046629128 /nfs/dbraw/zinc/62/91/28/1046629128.db2.gz AXURUTFSRMGCKI-PMACEKPBSA-N 1 2 317.436 4.324 20 0 DIADLO C[C@]1(c2ccccc2)CCC[N@H+](Cn2ncsc2=S)CC1 ZINC000795669627 1046629842 /nfs/dbraw/zinc/62/98/42/1046629842.db2.gz DZUPDPWDXQJHRK-INIZCTEOSA-N 1 2 319.499 4.075 20 0 DIADLO C[C@]1(c2ccccc2)CCC[N@@H+](Cn2ncsc2=S)CC1 ZINC000795669627 1046629844 /nfs/dbraw/zinc/62/98/44/1046629844.db2.gz DZUPDPWDXQJHRK-INIZCTEOSA-N 1 2 319.499 4.075 20 0 DIADLO S=c1ncccn1C[N@H+](Cc1ccccc1Cl)CC1CC1 ZINC000795675421 1046631359 /nfs/dbraw/zinc/63/13/59/1046631359.db2.gz OQLQFYQTNSZTHA-UHFFFAOYSA-N 1 2 319.861 4.136 20 0 DIADLO S=c1ncccn1C[N@@H+](Cc1ccccc1Cl)CC1CC1 ZINC000795675421 1046631366 /nfs/dbraw/zinc/63/13/66/1046631366.db2.gz OQLQFYQTNSZTHA-UHFFFAOYSA-N 1 2 319.861 4.136 20 0 DIADLO C[C@H]([NH2+][C@H]1CCn2ccnc21)c1cc2cc(Cl)ccc2o1 ZINC000834654623 1046644719 /nfs/dbraw/zinc/64/47/19/1046644719.db2.gz QHFKLNZIWLHYMI-GWCFXTLKSA-N 1 2 301.777 4.078 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCn2ccnc21)c1cc2cc(Cl)ccc2o1 ZINC000834654628 1046646651 /nfs/dbraw/zinc/64/66/51/1046646651.db2.gz QHFKLNZIWLHYMI-GXFFZTMASA-N 1 2 301.777 4.078 20 0 DIADLO c1cc(-c2ccccc2)oc1C[NH2+]Cc1nc2c(s1)CCC2 ZINC000678497202 1046648686 /nfs/dbraw/zinc/64/86/86/1046648686.db2.gz MYNIZGRGTYBJDG-UHFFFAOYSA-N 1 2 310.422 4.182 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccncc1Cl ZINC000643347059 1046660594 /nfs/dbraw/zinc/66/05/94/1046660594.db2.gz SXXXPTJEVTWZQW-XPTSAGLGSA-N 1 2 309.196 4.173 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1c[nH]c3ccc(F)cc13)CC2 ZINC001137341446 1046664184 /nfs/dbraw/zinc/66/41/84/1046664184.db2.gz MZMNOVICXPGNBA-UHFFFAOYSA-N 1 2 322.383 4.068 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1c[nH]c3ccc(F)cc13)CC2 ZINC001137341446 1046664189 /nfs/dbraw/zinc/66/41/89/1046664189.db2.gz MZMNOVICXPGNBA-UHFFFAOYSA-N 1 2 322.383 4.068 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2nnc(-c3ccccc3)s2)c(C)n1 ZINC000678597930 1046670776 /nfs/dbraw/zinc/67/07/76/1046670776.db2.gz MWICNLMVYAIBPU-CYBMUJFWSA-N 1 2 324.453 4.068 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@H]2COc3c2cccc3Cl)c(C)s1 ZINC000678597281 1046670882 /nfs/dbraw/zinc/67/08/82/1046670882.db2.gz CMSKHXIWCUIECD-OQPBUACISA-N 1 2 308.834 4.198 20 0 DIADLO Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)sc2Cl)ncn1 ZINC000678605375 1046675880 /nfs/dbraw/zinc/67/58/80/1046675880.db2.gz PTDHUKSXQNOMOX-QMMMGPOBSA-N 1 2 302.230 4.004 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(Cl)c1F)c1nc2ccccc2n1C ZINC000678689736 1046689114 /nfs/dbraw/zinc/68/91/14/1046689114.db2.gz KHFCJTKLEQSPNO-NSHDSACASA-N 1 2 317.795 4.217 20 0 DIADLO FC1(F)CCC[C@H]1[NH2+][C@H](Cc1ccncc1)c1cccs1 ZINC000643894510 1046689181 /nfs/dbraw/zinc/68/91/81/1046689181.db2.gz XJVPCMHOGSRNNZ-UKRRQHHQSA-N 1 2 308.397 4.204 20 0 DIADLO Fc1ccc2[nH]cc(C[N@@H+]3CCc4cc(F)c(F)cc4C3)c2c1 ZINC001137344056 1046689318 /nfs/dbraw/zinc/68/93/18/1046689318.db2.gz SSCQXHHEJBHOSX-UHFFFAOYSA-N 1 2 316.326 4.144 20 0 DIADLO Fc1ccc2[nH]cc(C[N@H+]3CCc4cc(F)c(F)cc4C3)c2c1 ZINC001137344056 1046689323 /nfs/dbraw/zinc/68/93/23/1046689323.db2.gz SSCQXHHEJBHOSX-UHFFFAOYSA-N 1 2 316.326 4.144 20 0 DIADLO Fc1ccccc1-c1ncc(C[N@H+](Cc2ccco2)C2CC2)cn1 ZINC001140404955 1046689897 /nfs/dbraw/zinc/68/98/97/1046689897.db2.gz HIENNQSQIIHAIG-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO Fc1ccccc1-c1ncc(C[N@@H+](Cc2ccco2)C2CC2)cn1 ZINC001140404955 1046689905 /nfs/dbraw/zinc/68/99/05/1046689905.db2.gz HIENNQSQIIHAIG-UHFFFAOYSA-N 1 2 323.371 4.040 20 0 DIADLO c1cc(CCC[NH2+]c2ccc(N3CCCC3)cc2)cc2c1OCC2 ZINC000795885844 1046690726 /nfs/dbraw/zinc/69/07/26/1046690726.db2.gz CDSVFQVFMCSMNG-UHFFFAOYSA-N 1 2 322.452 4.266 20 0 DIADLO c1cc(CCCNc2ccc([NH+]3CCCC3)cc2)cc2c1OCC2 ZINC000795885844 1046690732 /nfs/dbraw/zinc/69/07/32/1046690732.db2.gz CDSVFQVFMCSMNG-UHFFFAOYSA-N 1 2 322.452 4.266 20 0 DIADLO CCc1noc(C[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)n1 ZINC000678750396 1046692783 /nfs/dbraw/zinc/69/27/83/1046692783.db2.gz ZBYGNABJJHYWPJ-CQSZACIVSA-N 1 2 305.397 4.038 20 0 DIADLO CCc1noc(C[NH2+][C@H](CC2CCCCC2)c2ccccc2)n1 ZINC000678763635 1046694693 /nfs/dbraw/zinc/69/46/93/1046694693.db2.gz XHWQROZKWVGLNA-QGZVFWFLSA-N 1 2 313.445 4.433 20 0 DIADLO CCc1noc(C[NH2+][C@@H](CC2CCCCC2)c2ccccc2)n1 ZINC000678763634 1046694924 /nfs/dbraw/zinc/69/49/24/1046694924.db2.gz XHWQROZKWVGLNA-KRWDZBQOSA-N 1 2 313.445 4.433 20 0 DIADLO CCc1noc(C[NH2+][C@@H](c2cccc(Cl)c2)C2CCCC2)n1 ZINC000678792124 1046703169 /nfs/dbraw/zinc/70/31/69/1046703169.db2.gz GSJLMYVBGVOVEQ-QGZVFWFLSA-N 1 2 319.836 4.307 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1ccccc1Br ZINC000533377407 1046706681 /nfs/dbraw/zinc/70/66/81/1046706681.db2.gz QTODLWZXMIKUOZ-GFCCVEGCSA-N 1 2 320.230 4.348 20 0 DIADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ccccc1Br ZINC000533377407 1046706689 /nfs/dbraw/zinc/70/66/89/1046706689.db2.gz QTODLWZXMIKUOZ-GFCCVEGCSA-N 1 2 320.230 4.348 20 0 DIADLO CCc1nc(C[NH2+][C@H]2CCCOc3c(Cl)cc(C)cc32)co1 ZINC000834897713 1046707215 /nfs/dbraw/zinc/70/72/15/1046707215.db2.gz HNSLZHRXZPIDRQ-HNNXBMFYSA-N 1 2 320.820 4.202 20 0 DIADLO CCC[N@H+](Cc1nc2c(s1)CCC2)Cc1ccccc1F ZINC000678814112 1046707881 /nfs/dbraw/zinc/70/78/81/1046707881.db2.gz BVQDKKHEFRFUEW-UHFFFAOYSA-N 1 2 304.434 4.183 20 0 DIADLO CCC[N@@H+](Cc1nc2c(s1)CCC2)Cc1ccccc1F ZINC000678814112 1046707891 /nfs/dbraw/zinc/70/78/91/1046707891.db2.gz BVQDKKHEFRFUEW-UHFFFAOYSA-N 1 2 304.434 4.183 20 0 DIADLO CC(C)[N@H+](Cc1nc2c(s1)CCC2)Cc1ccccc1F ZINC000678815359 1046708485 /nfs/dbraw/zinc/70/84/85/1046708485.db2.gz WIELRBSIPGTQNM-UHFFFAOYSA-N 1 2 304.434 4.182 20 0 DIADLO CC(C)[N@@H+](Cc1nc2c(s1)CCC2)Cc1ccccc1F ZINC000678815359 1046708497 /nfs/dbraw/zinc/70/84/97/1046708497.db2.gz WIELRBSIPGTQNM-UHFFFAOYSA-N 1 2 304.434 4.182 20 0 DIADLO CCc1cnc(C[N@@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)o1 ZINC000533384704 1046713558 /nfs/dbraw/zinc/71/35/58/1046713558.db2.gz MLHQHDJOZKSJGA-GOSISDBHSA-N 1 2 309.413 4.446 20 0 DIADLO CCc1cnc(C[N@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)o1 ZINC000533384704 1046713568 /nfs/dbraw/zinc/71/35/68/1046713568.db2.gz MLHQHDJOZKSJGA-GOSISDBHSA-N 1 2 309.413 4.446 20 0 DIADLO C[C@H](C[NH2+][C@@H](c1ncn[nH]1)C1CCCCC1)C1CCCCC1 ZINC000644536058 1046718663 /nfs/dbraw/zinc/71/86/63/1046718663.db2.gz DWMNPWWELCLSAA-RHSMWYFYSA-N 1 2 304.482 4.232 20 0 DIADLO C[N@H+](CCc1ccccn1)Cc1c(Cl)ccc(F)c1Cl ZINC001137353633 1046721663 /nfs/dbraw/zinc/72/16/63/1046721663.db2.gz SWJKGIUQTHEZIO-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO C[N@@H+](CCc1ccccn1)Cc1c(Cl)ccc(F)c1Cl ZINC001137353633 1046721674 /nfs/dbraw/zinc/72/16/74/1046721674.db2.gz SWJKGIUQTHEZIO-UHFFFAOYSA-N 1 2 313.203 4.202 20 0 DIADLO Cc1noc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)n1 ZINC000678900274 1046730120 /nfs/dbraw/zinc/73/01/20/1046730120.db2.gz YDKNPVAOCQTBAQ-NBLIUIFLSA-N 1 2 305.809 4.079 20 0 DIADLO Cc1cc2c(cn1)C[N@H+](Cc1ccccc1-c1nccs1)C2 ZINC001140453249 1046732133 /nfs/dbraw/zinc/73/21/33/1046732133.db2.gz ODFIJGLUMPIEEG-UHFFFAOYSA-N 1 2 307.422 4.029 20 0 DIADLO Cc1cc2c(cn1)C[N@@H+](Cc1ccccc1-c1nccs1)C2 ZINC001140453249 1046732147 /nfs/dbraw/zinc/73/21/47/1046732147.db2.gz ODFIJGLUMPIEEG-UHFFFAOYSA-N 1 2 307.422 4.029 20 0 DIADLO c1csc(-c2ccccc2C[NH+]2CC(Oc3ccccc3)C2)n1 ZINC001140454186 1046733745 /nfs/dbraw/zinc/73/37/45/1046733745.db2.gz YKBPCMOGLXXEOY-UHFFFAOYSA-N 1 2 322.433 4.073 20 0 DIADLO Cc1ccc(Nc2nc(C[NH2+][C@@H](C)c3ccccn3)cs2)cc1 ZINC000678932812 1046739185 /nfs/dbraw/zinc/73/91/85/1046739185.db2.gz XQXVXJWSVPCSDH-AWEZNQCLSA-N 1 2 324.453 4.441 20 0 DIADLO Fc1ccc(C2([NH2+]Cc3csc(-c4ccco4)n3)CC2)cc1 ZINC000533526682 1046741775 /nfs/dbraw/zinc/74/17/75/1046741775.db2.gz USYHFASKNHQFQX-UHFFFAOYSA-N 1 2 314.385 4.321 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2nc3c(s2)CCCC3)sc1C ZINC000678956116 1046744701 /nfs/dbraw/zinc/74/47/01/1046744701.db2.gz UDODLWRAAZDUTK-UHFFFAOYSA-N 1 2 321.515 4.120 20 0 DIADLO CCCO[C@H]1CC[N@H+](Cc2c(Cl)ccc(F)c2Cl)C1 ZINC001137358471 1046747574 /nfs/dbraw/zinc/74/75/74/1046747574.db2.gz PJURUVDTIAMEFC-JTQLQIEISA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@H]1CC[N@@H+](Cc2c(Cl)ccc(F)c2Cl)C1 ZINC001137358471 1046747588 /nfs/dbraw/zinc/74/75/88/1046747588.db2.gz PJURUVDTIAMEFC-JTQLQIEISA-N 1 2 306.208 4.133 20 0 DIADLO Cc1ccc(C2(C(=O)Nc3c(C)cc(C)[nH+]c3C)CCC2)cc1 ZINC000644926845 1046750418 /nfs/dbraw/zinc/75/04/18/1046750418.db2.gz SSJXGHSSWNWREN-UHFFFAOYSA-N 1 2 308.425 4.376 20 0 DIADLO C[C@@H]([NH2+]Cc1cocn1)c1ccc(SCC(F)(F)F)cc1 ZINC000679047994 1046764132 /nfs/dbraw/zinc/76/41/32/1046764132.db2.gz MAGQDXIYCKKVFX-SNVBAGLBSA-N 1 2 316.348 4.180 20 0 DIADLO Cc1nc(-c2cc([C@H](C)[NH2+]Cc3cocn3)cs2)cs1 ZINC000679048438 1046764265 /nfs/dbraw/zinc/76/42/65/1046764265.db2.gz ORJNQBUFOHYZBQ-VIFPVBQESA-N 1 2 305.428 4.019 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CCC[C@H](Oc3ccccc3)C2)c(F)c1 ZINC001140532411 1046767993 /nfs/dbraw/zinc/76/79/93/1046767993.db2.gz GFIJWPAWXCVHHA-HNNXBMFYSA-N 1 2 321.342 4.147 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CCC[C@H](Oc3ccccc3)C2)c(F)c1 ZINC001140532411 1046768010 /nfs/dbraw/zinc/76/80/10/1046768010.db2.gz GFIJWPAWXCVHHA-HNNXBMFYSA-N 1 2 321.342 4.147 20 0 DIADLO CSc1ccc(CNC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000455471416 1046769249 /nfs/dbraw/zinc/76/92/49/1046769249.db2.gz IQHILTJMSBFZGD-UHFFFAOYSA-N 1 2 315.442 4.050 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1cc(F)cc(Cl)c1)CC2 ZINC001140535238 1046769588 /nfs/dbraw/zinc/76/95/88/1046769588.db2.gz CLEVBEUJQCEARD-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1cc(F)cc(Cl)c1)CC2 ZINC001140535238 1046769598 /nfs/dbraw/zinc/76/95/98/1046769598.db2.gz CLEVBEUJQCEARD-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CCC[C@@H](Oc3ccccc3)C2)c(F)c1 ZINC001140532412 1046769748 /nfs/dbraw/zinc/76/97/48/1046769748.db2.gz GFIJWPAWXCVHHA-OAHLLOKOSA-N 1 2 321.342 4.147 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CCC[C@@H](Oc3ccccc3)C2)c(F)c1 ZINC001140532412 1046769762 /nfs/dbraw/zinc/76/97/62/1046769762.db2.gz GFIJWPAWXCVHHA-OAHLLOKOSA-N 1 2 321.342 4.147 20 0 DIADLO CCOc1cc(NC(=O)Nc2c(C)cc(C)[nH+]c2C)ccc1C ZINC000455494703 1046769976 /nfs/dbraw/zinc/76/99/76/1046769976.db2.gz FCDULQHEBBPWEI-UHFFFAOYSA-N 1 2 313.401 4.358 20 0 DIADLO COc1ccc(F)c(C[NH2+][C@@H](C)c2nc3c(s2)CCCC3)c1 ZINC000645156548 1046770082 /nfs/dbraw/zinc/77/00/82/1046770082.db2.gz LAQHJVDKTPLUDT-NSHDSACASA-N 1 2 320.433 4.020 20 0 DIADLO CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000455497098 1046773466 /nfs/dbraw/zinc/77/34/66/1046773466.db2.gz PSBHPTPOYKKHTR-LRDDRELGSA-N 1 2 303.450 4.439 20 0 DIADLO Cc1cc(C)c(NC(=O)N2Cc3ccccc3C(C)(C)C2)c(C)[nH+]1 ZINC000455497232 1046773908 /nfs/dbraw/zinc/77/39/08/1046773908.db2.gz PWZJZCHEPDHGJI-UHFFFAOYSA-N 1 2 323.440 4.332 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)Cc2cccc(C)c2C)c(C)[nH+]1 ZINC000455492798 1046774709 /nfs/dbraw/zinc/77/47/09/1046774709.db2.gz BXWGITIYMFYAMQ-UHFFFAOYSA-N 1 2 311.429 4.288 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)C[C@H](C)c2ccccc2)c(C)[nH+]1 ZINC000455487098 1046775579 /nfs/dbraw/zinc/77/55/79/1046775579.db2.gz SLRMTWJIEJKTDZ-AWEZNQCLSA-N 1 2 311.429 4.274 20 0 DIADLO Cc1cc(C)c(NC(=O)N(C)CCCc2ccccc2)c(C)[nH+]1 ZINC000455490707 1046775715 /nfs/dbraw/zinc/77/57/15/1046775715.db2.gz XDGJVGFUOOSPOY-UHFFFAOYSA-N 1 2 311.429 4.103 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1nc2c(s1)CCC2 ZINC000679117386 1046776088 /nfs/dbraw/zinc/77/60/88/1046776088.db2.gz GKOFKMZAOFXVSN-UHFFFAOYSA-N 1 2 312.442 4.004 20 0 DIADLO CSc1cccc(F)c1C[NH2+]Cc1cccc(O)c1Cl ZINC000645180771 1046776361 /nfs/dbraw/zinc/77/63/61/1046776361.db2.gz WDJPSKSKQPMEMQ-UHFFFAOYSA-N 1 2 311.809 4.196 20 0 DIADLO OC[C@H]([NH2+]Cc1csc(Cl)c1Cl)c1cccc(F)c1 ZINC000432250442 1046777970 /nfs/dbraw/zinc/77/79/70/1046777970.db2.gz KDJVWYOAVRJPBP-NSHDSACASA-N 1 2 320.216 4.017 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@]3(CC[C@H](C)C3)C2)c(C)[nH+]1 ZINC000455508394 1046779329 /nfs/dbraw/zinc/77/93/29/1046779329.db2.gz ZSUGGNWECREOMB-KPZWWZAWSA-N 1 2 301.434 4.051 20 0 DIADLO Cc1cc(C)c(NC(=O)N2Cc3ccccc3C3(CC3)C2)c(C)[nH+]1 ZINC000455514329 1046780409 /nfs/dbraw/zinc/78/04/09/1046780409.db2.gz JIFONOGGIVKDGH-UHFFFAOYSA-N 1 2 321.424 4.086 20 0 DIADLO CCC1(CC)CCN(C(=O)Nc2c(C)cc(C)[nH+]c2C)CC1 ZINC000455535469 1046781848 /nfs/dbraw/zinc/78/18/48/1046781848.db2.gz VHUOZHPQIBGYTR-UHFFFAOYSA-N 1 2 303.450 4.441 20 0 DIADLO Cc1cc(C)c(NC(=O)NCc2ccc(Cl)cc2F)c(C)[nH+]1 ZINC000455543102 1046783707 /nfs/dbraw/zinc/78/37/07/1046783707.db2.gz ZWYINVALXKXERV-UHFFFAOYSA-N 1 2 321.783 4.121 20 0 DIADLO COc1ccccc1[C@H](C)[NH2+]Cc1ncc(Cl)cc1Cl ZINC000679151050 1046788532 /nfs/dbraw/zinc/78/85/32/1046788532.db2.gz LWQTYXGUAIRTCX-JTQLQIEISA-N 1 2 311.212 4.248 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2cc(Cl)ccc2C)o1 ZINC000070786655 1046793857 /nfs/dbraw/zinc/79/38/57/1046793857.db2.gz GIGKNCYKCYZEBK-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2cc(Cl)ccc2C)o1 ZINC000070786655 1046793866 /nfs/dbraw/zinc/79/38/66/1046793866.db2.gz GIGKNCYKCYZEBK-CYBMUJFWSA-N 1 2 320.820 4.009 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2nc3ccccc3s2)sc1C ZINC000072866234 1046799140 /nfs/dbraw/zinc/79/91/40/1046799140.db2.gz VUDUKIYADJSNKI-UHFFFAOYSA-N 1 2 317.483 4.395 20 0 DIADLO C[N@H+](Cc1cc(Cl)ncc1F)Cc1cccc2cccnc21 ZINC001140610542 1046810643 /nfs/dbraw/zinc/81/06/43/1046810643.db2.gz HSAQVBCLYYFWHK-UHFFFAOYSA-N 1 2 315.779 4.054 20 0 DIADLO C[N@@H+](Cc1cc(Cl)ncc1F)Cc1cccc2cccnc21 ZINC001140610542 1046810654 /nfs/dbraw/zinc/81/06/54/1046810654.db2.gz HSAQVBCLYYFWHK-UHFFFAOYSA-N 1 2 315.779 4.054 20 0 DIADLO C[C@H]([NH2+]Cc1nc2c(s1)CCC2)c1ccc(F)cc1Cl ZINC000093075903 1046815320 /nfs/dbraw/zinc/81/53/20/1046815320.db2.gz OUOLUTXFACBDJX-VIFPVBQESA-N 1 2 310.825 4.275 20 0 DIADLO Cn1c(Nc2ccc[nH+]c2N2CCCCC2)cc2ccccc21 ZINC001212043006 1046832023 /nfs/dbraw/zinc/83/20/23/1046832023.db2.gz ICUWZJLURLTRSP-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO CO[C@@H](C)c1nc(C[NH2+]C2(c3cccc(F)c3)CCC2)cs1 ZINC000646003299 1046842056 /nfs/dbraw/zinc/84/20/56/1046842056.db2.gz ZYAIFZZHRSUWCG-LBPRGKRZSA-N 1 2 320.433 4.159 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2nc(C)c(C)o2)o1 ZINC000076145153 1046844171 /nfs/dbraw/zinc/84/41/71/1046844171.db2.gz QEZHNPOKZBFHJI-WBMJQRKESA-N 1 2 302.418 4.420 20 0 DIADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2nc(C)c(C)o2)o1 ZINC000076145153 1046844187 /nfs/dbraw/zinc/84/41/87/1046844187.db2.gz QEZHNPOKZBFHJI-WBMJQRKESA-N 1 2 302.418 4.420 20 0 DIADLO CC1=C[C@@H](C)C[N@H+](Cc2ccc(Cl)nc2C(F)(F)F)C1 ZINC000797526529 1046845125 /nfs/dbraw/zinc/84/51/25/1046845125.db2.gz SWGFXIRDTJBAFS-SECBINFHSA-N 1 2 304.743 4.152 20 0 DIADLO CC1=C[C@@H](C)C[N@@H+](Cc2ccc(Cl)nc2C(F)(F)F)C1 ZINC000797526529 1046845138 /nfs/dbraw/zinc/84/51/38/1046845138.db2.gz SWGFXIRDTJBAFS-SECBINFHSA-N 1 2 304.743 4.152 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2ccn(-c3ccccc3)n2)CCC1 ZINC000646026560 1046846950 /nfs/dbraw/zinc/84/69/50/1046846950.db2.gz UQXWMWMIBMTFAZ-UHFFFAOYSA-N 1 2 321.399 4.180 20 0 DIADLO Fc1ccccc1C1([NH2+]Cc2nccn2-c2ccccc2)CCC1 ZINC000646024896 1046849854 /nfs/dbraw/zinc/84/98/54/1046849854.db2.gz WOZKEKCVMICPBF-UHFFFAOYSA-N 1 2 321.399 4.180 20 0 DIADLO CCc1nnc([C@@H](C)[N@@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)o1 ZINC000646117170 1046859342 /nfs/dbraw/zinc/85/93/42/1046859342.db2.gz RMZOGDNGGIBLME-RHSMWYFYSA-N 1 2 309.413 4.086 20 0 DIADLO CCc1nnc([C@@H](C)[N@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)o1 ZINC000646117170 1046859358 /nfs/dbraw/zinc/85/93/58/1046859358.db2.gz RMZOGDNGGIBLME-RHSMWYFYSA-N 1 2 309.413 4.086 20 0 DIADLO C1=CCC2(C[N@@H+](Cc3noc4c3CCCC4)[C@H]2c2ccccc2)C1 ZINC000646117175 1046861062 /nfs/dbraw/zinc/86/10/62/1046861062.db2.gz ROGYJGAISJHMQR-FQEVSTJZSA-N 1 2 320.436 4.447 20 0 DIADLO C1=CCC2(C[N@H+](Cc3noc4c3CCCC4)[C@H]2c2ccccc2)C1 ZINC000646117175 1046861079 /nfs/dbraw/zinc/86/10/79/1046861079.db2.gz ROGYJGAISJHMQR-FQEVSTJZSA-N 1 2 320.436 4.447 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000679548515 1046868150 /nfs/dbraw/zinc/86/81/50/1046868150.db2.gz VDBZAJKXWWJIGG-ZIAGYGMSSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccn(-c2ccccc2)n1 ZINC000679548515 1046868167 /nfs/dbraw/zinc/86/81/67/1046868167.db2.gz VDBZAJKXWWJIGG-ZIAGYGMSSA-N 1 2 323.362 4.035 20 0 DIADLO COc1cccc(Cl)c1C[N@@H+]1CCC(=O)[C@H](C)C12CCCC2 ZINC001140731472 1046879757 /nfs/dbraw/zinc/87/97/57/1046879757.db2.gz ZXKMNJHNAWDEIK-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO COc1cccc(Cl)c1C[N@H+]1CCC(=O)[C@H](C)C12CCCC2 ZINC001140731472 1046879773 /nfs/dbraw/zinc/87/97/73/1046879773.db2.gz ZXKMNJHNAWDEIK-ZDUSSCGKSA-N 1 2 321.848 4.072 20 0 DIADLO Brc1ccnc(C[N@@H+]2CCC[C@H]2c2cccs2)c1 ZINC001140765459 1046889111 /nfs/dbraw/zinc/88/91/11/1046889111.db2.gz WLAAXYRGPUGFDH-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO Brc1ccnc(C[N@H+]2CCC[C@H]2c2cccs2)c1 ZINC001140765459 1046889133 /nfs/dbraw/zinc/88/91/33/1046889133.db2.gz WLAAXYRGPUGFDH-ZDUSSCGKSA-N 1 2 323.259 4.243 20 0 DIADLO FC(F)O[C@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2)C1 ZINC000679740009 1046897047 /nfs/dbraw/zinc/89/70/47/1046897047.db2.gz STNYMXDHANPYNK-LBPRGKRZSA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2)C1 ZINC000679740009 1046897055 /nfs/dbraw/zinc/89/70/55/1046897055.db2.gz STNYMXDHANPYNK-LBPRGKRZSA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2)C1 ZINC000679740007 1046899269 /nfs/dbraw/zinc/89/92/69/1046899269.db2.gz STNYMXDHANPYNK-GFCCVEGCSA-N 1 2 310.171 4.197 20 0 DIADLO FC(F)O[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2)C1 ZINC000679740007 1046899284 /nfs/dbraw/zinc/89/92/84/1046899284.db2.gz STNYMXDHANPYNK-GFCCVEGCSA-N 1 2 310.171 4.197 20 0 DIADLO FC1(F)CCCC[N@H+](Cc2cccc(-c3ccncc3)c2)C1 ZINC001137387586 1046905183 /nfs/dbraw/zinc/90/51/83/1046905183.db2.gz UUNCQKNLLIPGIQ-UHFFFAOYSA-N 1 2 302.368 4.370 20 0 DIADLO FC1(F)CCCC[N@@H+](Cc2cccc(-c3ccncc3)c2)C1 ZINC001137387586 1046905195 /nfs/dbraw/zinc/90/51/95/1046905195.db2.gz UUNCQKNLLIPGIQ-UHFFFAOYSA-N 1 2 302.368 4.370 20 0 DIADLO Cc1ccncc1[C@H](C)[NH2+]Cc1csc(Nc2ccccc2)n1 ZINC000679939996 1046913032 /nfs/dbraw/zinc/91/30/32/1046913032.db2.gz ISGAYCBJNDFVMW-AWEZNQCLSA-N 1 2 324.453 4.441 20 0 DIADLO O=C(CCSc1ccccc1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000161783982 1046913086 /nfs/dbraw/zinc/91/30/86/1046913086.db2.gz FRUMKDUDXAARIS-UHFFFAOYSA-N 1 2 323.421 4.198 20 0 DIADLO Cc1cc(Br)ccc1C[N@@H+]1CCCC[C@@H](F)C1 ZINC001140815597 1046914941 /nfs/dbraw/zinc/91/49/41/1046914941.db2.gz YGABZIUXLUNWPJ-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO Cc1cc(Br)ccc1C[N@H+]1CCCC[C@@H](F)C1 ZINC001140815597 1046914952 /nfs/dbraw/zinc/91/49/52/1046914952.db2.gz YGABZIUXLUNWPJ-CQSZACIVSA-N 1 2 300.215 4.082 20 0 DIADLO CCc1noc(C[N@@H+]2CCCCC[C@H]2/C=C/c2cccs2)n1 ZINC000679952476 1046915916 /nfs/dbraw/zinc/91/59/16/1046915916.db2.gz KJTZZTOJFRRPJB-HBWSCVEGSA-N 1 2 317.458 4.152 20 0 DIADLO CCc1noc(C[N@H+]2CCCCC[C@H]2/C=C/c2cccs2)n1 ZINC000679952476 1046915926 /nfs/dbraw/zinc/91/59/26/1046915926.db2.gz KJTZZTOJFRRPJB-HBWSCVEGSA-N 1 2 317.458 4.152 20 0 DIADLO CC[C@H](C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000161817280 1046916488 /nfs/dbraw/zinc/91/64/88/1046916488.db2.gz SXMQIJOJYPNYPA-KRWDZBQOSA-N 1 2 305.381 4.209 20 0 DIADLO CCc1nnc(C[N@@H+]2CCCCC[C@H]2/C=C\c2cccs2)o1 ZINC000679952049 1046916615 /nfs/dbraw/zinc/91/66/15/1046916615.db2.gz FXRFRYHVQDQMNK-CMUBDUJZSA-N 1 2 317.458 4.152 20 0 DIADLO CCc1nnc(C[N@H+]2CCCCC[C@H]2/C=C\c2cccs2)o1 ZINC000679952049 1046916632 /nfs/dbraw/zinc/91/66/32/1046916632.db2.gz FXRFRYHVQDQMNK-CMUBDUJZSA-N 1 2 317.458 4.152 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C3(c4ccc(C)cc4)CCC3)cc2[nH+]1 ZINC001137392578 1046916871 /nfs/dbraw/zinc/91/68/71/1046916871.db2.gz BBPXZFKZLRUWLK-UHFFFAOYSA-N 1 2 319.408 4.240 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCc3ccccc3[C@H]2C)c(F)c1 ZINC001140823977 1046917281 /nfs/dbraw/zinc/91/72/81/1046917281.db2.gz UUIQFAOHGZUXEZ-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCc3ccccc3[C@H]2C)c(F)c1 ZINC001140823977 1046917289 /nfs/dbraw/zinc/91/72/89/1046917289.db2.gz UUIQFAOHGZUXEZ-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1cc(F)c(C[N@H+](Cc2ccccc2)C2CC2)c(F)c1 ZINC001140827486 1046918808 /nfs/dbraw/zinc/91/88/08/1046918808.db2.gz BUFOHTJMDZZPEC-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO COc1cc(F)c(C[N@@H+](Cc2ccccc2)C2CC2)c(F)c1 ZINC001140827486 1046918821 /nfs/dbraw/zinc/91/88/21/1046918821.db2.gz BUFOHTJMDZZPEC-UHFFFAOYSA-N 1 2 303.352 4.138 20 0 DIADLO Cc1cc(C[NH+]2CCC(c3c(Cl)cccc3Cl)CC2)[nH]n1 ZINC001203069970 1046923546 /nfs/dbraw/zinc/92/35/46/1046923546.db2.gz GRXDJDMURROLSV-UHFFFAOYSA-N 1 2 324.255 4.405 20 0 DIADLO CCc1[nH+]ccc(C)c1Nc1ccc(C(=O)N(C)C)c(Cl)c1 ZINC001203072680 1046932247 /nfs/dbraw/zinc/93/22/47/1046932247.db2.gz LUPYWUDEXXFHII-UHFFFAOYSA-N 1 2 317.820 4.051 20 0 DIADLO Cc1c[nH]c(C[N@@H+](C)Cc2ccccc2Br)c1C ZINC001140857311 1046932981 /nfs/dbraw/zinc/93/29/81/1046932981.db2.gz VEGXPQGZKYESQT-UHFFFAOYSA-N 1 2 307.235 4.026 20 0 DIADLO Cc1c[nH]c(C[N@H+](C)Cc2ccccc2Br)c1C ZINC001140857311 1046932988 /nfs/dbraw/zinc/93/29/88/1046932988.db2.gz VEGXPQGZKYESQT-UHFFFAOYSA-N 1 2 307.235 4.026 20 0 DIADLO C[C@@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1ccc(Cl)cc1 ZINC000680042108 1046936774 /nfs/dbraw/zinc/93/67/74/1046936774.db2.gz YLCWXOUDFOZDJZ-OTYXRUKQSA-N 1 2 309.743 4.403 20 0 DIADLO Nc1cccc(F)c1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001140875038 1046936802 /nfs/dbraw/zinc/93/68/02/1046936802.db2.gz SRYTXYDYJYMJJJ-KRWDZBQOSA-N 1 2 306.331 4.023 20 0 DIADLO Nc1cccc(F)c1C[N@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001140875038 1046936812 /nfs/dbraw/zinc/93/68/12/1046936812.db2.gz SRYTXYDYJYMJJJ-KRWDZBQOSA-N 1 2 306.331 4.023 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2cc(F)cc(F)c21)c1ccccc1Cl ZINC000680040805 1046937438 /nfs/dbraw/zinc/93/74/38/1046937438.db2.gz AVQMLRIPINVYIS-XPTSAGLGSA-N 1 2 309.743 4.403 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1ccc(F)c(F)c1 ZINC000680040995 1046938223 /nfs/dbraw/zinc/93/82/23/1046938223.db2.gz DYSQFBIIAZQCRZ-RMLUDKJBSA-N 1 2 311.278 4.027 20 0 DIADLO CC/C=C(\C)C(=O)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000798268531 1046942370 /nfs/dbraw/zinc/94/23/70/1046942370.db2.gz XPMKMGUGEJJOAI-RIYZIHGNSA-N 1 2 309.413 4.181 20 0 DIADLO Oc1ccc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c(F)c1F ZINC001140893169 1046944168 /nfs/dbraw/zinc/94/41/68/1046944168.db2.gz JTWBRLWTIFPOOT-GFCCVEGCSA-N 1 2 323.770 4.313 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1cnccc1C(F)(F)F ZINC001140916153 1046949002 /nfs/dbraw/zinc/94/90/02/1046949002.db2.gz YXLIVQZDGHZWDF-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cnccc1C(F)(F)F ZINC001140916153 1046949011 /nfs/dbraw/zinc/94/90/11/1046949011.db2.gz YXLIVQZDGHZWDF-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[N@H+](Cc1cncs1)Cc1cccn1-c1ccc(Cl)cc1 ZINC001140941695 1046955702 /nfs/dbraw/zinc/95/57/02/1046955702.db2.gz RSZHASRYMAWKEB-UHFFFAOYSA-N 1 2 317.845 4.219 20 0 DIADLO C[N@@H+](Cc1cncs1)Cc1cccn1-c1ccc(Cl)cc1 ZINC001140941695 1046955708 /nfs/dbraw/zinc/95/57/08/1046955708.db2.gz RSZHASRYMAWKEB-UHFFFAOYSA-N 1 2 317.845 4.219 20 0 DIADLO COc1cccc(C[NH2+]C2(c3ccccc3Cl)CC2)c1F ZINC000647224218 1046956230 /nfs/dbraw/zinc/95/62/30/1046956230.db2.gz YZACJCKOUKNVOR-UHFFFAOYSA-N 1 2 305.780 4.267 20 0 DIADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2N(C)C)cs1 ZINC000162391296 1046966658 /nfs/dbraw/zinc/96/66/58/1046966658.db2.gz AQHVEEWQJJWZOI-VXGBXAGGSA-N 1 2 321.465 4.322 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2cc(F)cc(F)c21)c1cc2ccccc2o1 ZINC000680354912 1046972434 /nfs/dbraw/zinc/97/24/34/1046972434.db2.gz KNEQNECKCLYHIV-IINYFYTJSA-N 1 2 315.319 4.495 20 0 DIADLO COc1cc(C)ccc1[C@H](C)[NH2+][C@@H]1COc2cc(F)cc(F)c21 ZINC000680355433 1046973650 /nfs/dbraw/zinc/97/36/50/1046973650.db2.gz PJHAFYDVZBTYHE-XHDPSFHLSA-N 1 2 319.351 4.066 20 0 DIADLO Fc1ccc2c(c1)C[N@@H+](Cc1ccc(-c3ccccn3)s1)C2 ZINC001141001823 1046976038 /nfs/dbraw/zinc/97/60/38/1046976038.db2.gz CMKBJSXIQVKLBW-UHFFFAOYSA-N 1 2 310.397 4.465 20 0 DIADLO Fc1ccc2c(c1)C[N@H+](Cc1ccc(-c3ccccn3)s1)C2 ZINC001141001823 1046976045 /nfs/dbraw/zinc/97/60/45/1046976045.db2.gz CMKBJSXIQVKLBW-UHFFFAOYSA-N 1 2 310.397 4.465 20 0 DIADLO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1csc(C2CCCC2)n1 ZINC000680381050 1046976644 /nfs/dbraw/zinc/97/66/44/1046976644.db2.gz KVDFIECMXYGIEA-SNVBAGLBSA-N 1 2 305.447 4.256 20 0 DIADLO Fc1cncc([C@H](Nc2ccc([NH+]3CCCC3)cc2)C2CC2)c1 ZINC000798931542 1046987510 /nfs/dbraw/zinc/98/75/10/1046987510.db2.gz LZMISFUWTOIHLX-LJQANCHMSA-N 1 2 311.404 4.384 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@H+](C)Cc2ccsc2)s1 ZINC000680580844 1046993599 /nfs/dbraw/zinc/99/35/99/1046993599.db2.gz LZHFBMOOGMJDCV-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO Cc1nc(C(F)(F)F)c(C[N@@H+](C)Cc2ccsc2)s1 ZINC000680580844 1046993602 /nfs/dbraw/zinc/99/36/02/1046993602.db2.gz LZHFBMOOGMJDCV-UHFFFAOYSA-N 1 2 306.378 4.164 20 0 DIADLO C[C@H]([NH2+][C@@H](C)c1ccc(SC(F)F)cc1)c1csnn1 ZINC000828702850 1046993702 /nfs/dbraw/zinc/99/37/02/1046993702.db2.gz BNHNSRSEAYEBQX-IUCAKERBSA-N 1 2 315.414 4.265 20 0 DIADLO CCCCc1ncc(C[N@@H+]2CCC[C@@H]2c2cccc(OC)c2)[nH]1 ZINC001141071676 1046995718 /nfs/dbraw/zinc/99/57/18/1046995718.db2.gz ABFMZVRSEXCVMA-GOSISDBHSA-N 1 2 313.445 4.098 20 0 DIADLO CCCCc1ncc(C[N@H+]2CCC[C@@H]2c2cccc(OC)c2)[nH]1 ZINC001141071676 1046995727 /nfs/dbraw/zinc/99/57/27/1046995727.db2.gz ABFMZVRSEXCVMA-GOSISDBHSA-N 1 2 313.445 4.098 20 0 DIADLO CC1=CC[N@H+](CC(=O)Nc2ccccc2Oc2ccccc2)CC1 ZINC000533758200 1047012942 /nfs/dbraw/zinc/01/29/42/1047012942.db2.gz CGBUIJXJYFHIJG-UHFFFAOYSA-N 1 2 322.408 4.069 20 0 DIADLO CC1=CC[N@@H+](CC(=O)Nc2ccccc2Oc2ccccc2)CC1 ZINC000533758200 1047012958 /nfs/dbraw/zinc/01/29/58/1047012958.db2.gz CGBUIJXJYFHIJG-UHFFFAOYSA-N 1 2 322.408 4.069 20 0 DIADLO c1nc(C[N@@H+]2CCSC[C@@H]2c2cccc3ccccc32)co1 ZINC001141132090 1047022756 /nfs/dbraw/zinc/02/27/56/1047022756.db2.gz SZDHBLMMACMJEX-GOSISDBHSA-N 1 2 310.422 4.118 20 0 DIADLO c1nc(C[N@H+]2CCSC[C@@H]2c2cccc3ccccc32)co1 ZINC001141132090 1047022769 /nfs/dbraw/zinc/02/27/69/1047022769.db2.gz SZDHBLMMACMJEX-GOSISDBHSA-N 1 2 310.422 4.118 20 0 DIADLO CCC(CC)(CC)c1nc(Cc2cn3cccc(C)c3[nH+]2)no1 ZINC000680733568 1047022937 /nfs/dbraw/zinc/02/29/37/1047022937.db2.gz FNOSASRSPVYUAI-UHFFFAOYSA-N 1 2 312.417 4.084 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)nc2Cl)c1 ZINC001141133237 1047023528 /nfs/dbraw/zinc/02/35/28/1047023528.db2.gz MOXSUDZCAZLTRH-AWEZNQCLSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ncc(Cl)nc2Cl)c1 ZINC001141133237 1047023539 /nfs/dbraw/zinc/02/35/39/1047023539.db2.gz MOXSUDZCAZLTRH-AWEZNQCLSA-N 1 2 322.239 4.429 20 0 DIADLO COc1cc(C)[nH+]c(CSc2ccc(C(F)(F)F)cn2)c1 ZINC000533807100 1047025382 /nfs/dbraw/zinc/02/53/82/1047025382.db2.gz RJTLPWFXOHVGLA-UHFFFAOYSA-N 1 2 314.332 4.105 20 0 DIADLO CC(=O)c1cc(C[N@@H+](C)Cc2ccccc2-c2ccccc2)on1 ZINC000647961540 1047026373 /nfs/dbraw/zinc/02/63/73/1047026373.db2.gz PPNZSKSBBWEXHF-UHFFFAOYSA-N 1 2 320.392 4.176 20 0 DIADLO CC(=O)c1cc(C[N@H+](C)Cc2ccccc2-c2ccccc2)on1 ZINC000647961540 1047026384 /nfs/dbraw/zinc/02/63/84/1047026384.db2.gz PPNZSKSBBWEXHF-UHFFFAOYSA-N 1 2 320.392 4.176 20 0 DIADLO CCc1nocc1C[NH2+][C@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000647970426 1047027279 /nfs/dbraw/zinc/02/72/79/1047027279.db2.gz PTSQCJOIUPAIFB-CQSZACIVSA-N 1 2 316.298 4.159 20 0 DIADLO CC1(CC(F)F)C[NH+](Cc2nc(-c3ccccc3)cs2)C1 ZINC000648058387 1047032080 /nfs/dbraw/zinc/03/20/80/1047032080.db2.gz HTFDZGFIUQHJJP-UHFFFAOYSA-N 1 2 308.397 4.287 20 0 DIADLO COc1ccc(C(F)(F)F)cc1C[N@@H+]1CCn2cccc2[C@H]1C ZINC001141203666 1047043193 /nfs/dbraw/zinc/04/31/93/1047043193.db2.gz SOMYEYVMSFSPJX-GFCCVEGCSA-N 1 2 324.346 4.092 20 0 DIADLO COc1ccc(C(F)(F)F)cc1C[N@H+]1CCn2cccc2[C@H]1C ZINC001141203666 1047043208 /nfs/dbraw/zinc/04/32/08/1047043208.db2.gz SOMYEYVMSFSPJX-GFCCVEGCSA-N 1 2 324.346 4.092 20 0 DIADLO F[C@H]1CC[N@H+](Cc2ccc(OCc3ccccc3)c(Cl)c2)C1 ZINC001141197976 1047044011 /nfs/dbraw/zinc/04/40/11/1047044011.db2.gz QCKBDFJNUFJRSH-INIZCTEOSA-N 1 2 319.807 4.463 20 0 DIADLO F[C@H]1CC[N@@H+](Cc2ccc(OCc3ccccc3)c(Cl)c2)C1 ZINC001141197976 1047044020 /nfs/dbraw/zinc/04/40/20/1047044020.db2.gz QCKBDFJNUFJRSH-INIZCTEOSA-N 1 2 319.807 4.463 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2cnc(C3CCCCC3)s2)C[C@H](C)O1 ZINC000536654380 1047044038 /nfs/dbraw/zinc/04/40/38/1047044038.db2.gz PPHFHDKXCODYHJ-DZGCQCFKSA-N 1 2 308.491 4.190 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2cnc(C3CCCCC3)s2)C[C@H](C)O1 ZINC000536654380 1047044048 /nfs/dbraw/zinc/04/40/48/1047044048.db2.gz PPHFHDKXCODYHJ-DZGCQCFKSA-N 1 2 308.491 4.190 20 0 DIADLO Oc1ccc2c(c1)CC[N@@H+](Cc1csc(-c3ccccc3)n1)C2 ZINC001141210751 1047046106 /nfs/dbraw/zinc/04/61/06/1047046106.db2.gz BYNCOYFWWOQXJN-UHFFFAOYSA-N 1 2 322.433 4.074 20 0 DIADLO Oc1ccc2c(c1)CC[N@H+](Cc1csc(-c3ccccc3)n1)C2 ZINC001141210751 1047046116 /nfs/dbraw/zinc/04/61/16/1047046116.db2.gz BYNCOYFWWOQXJN-UHFFFAOYSA-N 1 2 322.433 4.074 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2cccc(-c3ccc(F)cc3)n2)C[C@@H]1F ZINC001141206121 1047047271 /nfs/dbraw/zinc/04/72/71/1047047271.db2.gz SXBNSXLCGYDWDX-ROUUACIJSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2cccc(-c3ccc(F)cc3)n2)C[C@@H]1F ZINC001141206121 1047047287 /nfs/dbraw/zinc/04/72/87/1047047287.db2.gz SXBNSXLCGYDWDX-ROUUACIJSA-N 1 2 320.358 4.160 20 0 DIADLO FC(F)(F)[C@H]1CC[N@H+](Cc2csc(-c3ccccc3)n2)C1 ZINC001141214169 1047049470 /nfs/dbraw/zinc/04/94/70/1047049470.db2.gz MKVVZWUREVDDBM-LBPRGKRZSA-N 1 2 312.360 4.194 20 0 DIADLO FC(F)(F)[C@H]1CC[N@@H+](Cc2csc(-c3ccccc3)n2)C1 ZINC001141214169 1047049473 /nfs/dbraw/zinc/04/94/73/1047049473.db2.gz MKVVZWUREVDDBM-LBPRGKRZSA-N 1 2 312.360 4.194 20 0 DIADLO COc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1F ZINC001141223852 1047051593 /nfs/dbraw/zinc/05/15/93/1047051593.db2.gz SHYNQLQOILBAFO-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)c1F ZINC001141223852 1047051603 /nfs/dbraw/zinc/05/16/03/1047051603.db2.gz SHYNQLQOILBAFO-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO c1sc(C2CC2)nc1CNc1[nH+]c2ccccc2n1C1CC1 ZINC000680852811 1047054600 /nfs/dbraw/zinc/05/46/00/1047054600.db2.gz YDLRMDUQUALPIG-UHFFFAOYSA-N 1 2 310.426 4.317 20 0 DIADLO Fc1cc(CNc2[nH+]c3ccccc3n2C2CC2)cc(F)c1F ZINC000680852762 1047055015 /nfs/dbraw/zinc/05/50/15/1047055015.db2.gz VUQLTBCPGKIGDB-UHFFFAOYSA-N 1 2 317.314 4.401 20 0 DIADLO COc1ccc(CNc2[nH+]c3ccccc3n2C2CC2)cc1OC ZINC000680852818 1047055804 /nfs/dbraw/zinc/05/58/04/1047055804.db2.gz ZCRREFCUFZYMKO-UHFFFAOYSA-N 1 2 323.396 4.001 20 0 DIADLO c1cc2cccc(CNc3[nH+]c4ccccc4n3C3CC3)c2[nH]1 ZINC000680852476 1047055844 /nfs/dbraw/zinc/05/58/44/1047055844.db2.gz BEJUCQBHZISXGG-UHFFFAOYSA-N 1 2 302.381 4.465 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2Cl)C[N@@H+]1Cc1cccs1 ZINC000536673005 1047063908 /nfs/dbraw/zinc/06/39/08/1047063908.db2.gz ICBYHBWQHKGDEG-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2Cl)C[N@H+]1Cc1cccs1 ZINC000536673005 1047063920 /nfs/dbraw/zinc/06/39/20/1047063920.db2.gz ICBYHBWQHKGDEG-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2Cl)C[N@@H+]1Cc1cccs1 ZINC000536673006 1047065264 /nfs/dbraw/zinc/06/52/64/1047065264.db2.gz ICBYHBWQHKGDEG-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2Cl)C[N@H+]1Cc1cccs1 ZINC000536673006 1047065276 /nfs/dbraw/zinc/06/52/76/1047065276.db2.gz ICBYHBWQHKGDEG-LRDDRELGSA-N 1 2 307.846 4.364 20 0 DIADLO Cc1ccc([C@H]2COCC[N@@H+]2Cc2csc3ccccc23)o1 ZINC000536679963 1047071418 /nfs/dbraw/zinc/07/14/18/1047071418.db2.gz YTKIMEVHIPWSOG-MRXNPFEDSA-N 1 2 313.422 4.376 20 0 DIADLO Cc1ccc([C@H]2COCC[N@H+]2Cc2csc3ccccc23)o1 ZINC000536679963 1047071430 /nfs/dbraw/zinc/07/14/30/1047071430.db2.gz YTKIMEVHIPWSOG-MRXNPFEDSA-N 1 2 313.422 4.376 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)c1 ZINC000536695589 1047071853 /nfs/dbraw/zinc/07/18/53/1047071853.db2.gz IGAVXBVBQJXMPS-GUYCJALGSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2C[C@@H](c3ccsc3)O[C@@H](C)C2)c1 ZINC000536695589 1047071864 /nfs/dbraw/zinc/07/18/64/1047071864.db2.gz IGAVXBVBQJXMPS-GUYCJALGSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(F)c(C[N@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)c1 ZINC000536695590 1047073337 /nfs/dbraw/zinc/07/33/37/1047073337.db2.gz IGAVXBVBQJXMPS-SUMWQHHRSA-N 1 2 305.418 4.158 20 0 DIADLO CC[C@H](CC(F)F)C(=O)Nc1cccc(-c2[nH]c(C)c(C)[nH+]2)c1 ZINC000837362244 1047073329 /nfs/dbraw/zinc/07/33/29/1047073329.db2.gz IZYHLOBTSXZSOF-GFCCVEGCSA-N 1 2 321.371 4.313 20 0 DIADLO Cc1ccc(F)c(C[N@@H+]2C[C@H](C)O[C@@H](c3ccsc3)C2)c1 ZINC000536695590 1047073350 /nfs/dbraw/zinc/07/33/50/1047073350.db2.gz IGAVXBVBQJXMPS-SUMWQHHRSA-N 1 2 305.418 4.158 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3[nH]ccc3C3CC3)c2)[nH+]c1C ZINC000837362803 1047073500 /nfs/dbraw/zinc/07/35/00/1047073500.db2.gz LRGXFPOBVCBMMZ-UHFFFAOYSA-N 1 2 320.396 4.151 20 0 DIADLO CCC(C)(CC)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000681002324 1047081320 /nfs/dbraw/zinc/08/13/20/1047081320.db2.gz WNXDXGQQRNZMCH-UHFFFAOYSA-N 1 2 323.440 4.367 20 0 DIADLO C[C@H]1C[N@H+](Cc2ccc(Oc3ccc(F)cc3)cc2)CCC1=O ZINC001141314974 1047087915 /nfs/dbraw/zinc/08/79/15/1047087915.db2.gz KLPXWVVQPZVFFG-AWEZNQCLSA-N 1 2 313.372 4.029 20 0 DIADLO C[C@H]1C[N@@H+](Cc2ccc(Oc3ccc(F)cc3)cc2)CCC1=O ZINC001141314974 1047087932 /nfs/dbraw/zinc/08/79/32/1047087932.db2.gz KLPXWVVQPZVFFG-AWEZNQCLSA-N 1 2 313.372 4.029 20 0 DIADLO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1n[nH]c2ccc(Br)cc21 ZINC001139654632 1047096054 /nfs/dbraw/zinc/09/60/54/1047096054.db2.gz HJNIUZKVOXUCKB-GHMZBOCLSA-N 1 2 322.250 4.088 20 0 DIADLO COc1ccc2c(c1)CCC[C@H]2[N@H+](C)Cc1csc(Cl)n1 ZINC000827537337 1047114163 /nfs/dbraw/zinc/11/41/63/1047114163.db2.gz HYYNVOXWLASUGR-OAHLLOKOSA-N 1 2 322.861 4.315 20 0 DIADLO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)Cc1csc(Cl)n1 ZINC000827537337 1047114170 /nfs/dbraw/zinc/11/41/70/1047114170.db2.gz HYYNVOXWLASUGR-OAHLLOKOSA-N 1 2 322.861 4.315 20 0 DIADLO COc1ccc2c(c1)CCC[C@@H]2[N@H+](C)Cc1csc(Cl)n1 ZINC000827537336 1047114337 /nfs/dbraw/zinc/11/43/37/1047114337.db2.gz HYYNVOXWLASUGR-HNNXBMFYSA-N 1 2 322.861 4.315 20 0 DIADLO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)Cc1csc(Cl)n1 ZINC000827537336 1047114344 /nfs/dbraw/zinc/11/43/44/1047114344.db2.gz HYYNVOXWLASUGR-HNNXBMFYSA-N 1 2 322.861 4.315 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccc(Cl)cn1 ZINC000681393826 1047120696 /nfs/dbraw/zinc/12/06/96/1047120696.db2.gz FFXFWKDQTWPXRO-XPTSAGLGSA-N 1 2 309.196 4.173 20 0 DIADLO CO[C@@H]1CCCN(c2cc[nH+]c3cc(F)c(Cl)cc32)CC1 ZINC000649323506 1047121377 /nfs/dbraw/zinc/12/13/77/1047121377.db2.gz ZCQUUUKLYYHCJY-LLVKDONJSA-N 1 2 308.784 4.033 20 0 DIADLO CO[C@H]1CCCN(c2[nH+]ccc3cc(C(F)(F)F)ccc32)CC1 ZINC000649323403 1047121752 /nfs/dbraw/zinc/12/17/52/1047121752.db2.gz IBKIZUNEWZTCFW-AWEZNQCLSA-N 1 2 324.346 4.259 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1nnc(C(C)C)s1 ZINC000649313100 1047121883 /nfs/dbraw/zinc/12/18/83/1047121883.db2.gz VBYAFULJNQTNQO-HNNXBMFYSA-N 1 2 301.459 4.171 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1nnc(C(C)C)s1 ZINC000649313100 1047121887 /nfs/dbraw/zinc/12/18/87/1047121887.db2.gz VBYAFULJNQTNQO-HNNXBMFYSA-N 1 2 301.459 4.171 20 0 DIADLO Cc1cc(NCc2ccn(C3CCCC3)n2)[nH+]c2ccccc12 ZINC001116313775 1047129273 /nfs/dbraw/zinc/12/92/73/1047129273.db2.gz GVWKSEJOHOUZJW-UHFFFAOYSA-N 1 2 306.413 4.467 20 0 DIADLO CC[N@H+](Cc1nc2ccccc2s1)Cc1ccccc1F ZINC001116322333 1047129410 /nfs/dbraw/zinc/12/94/10/1047129410.db2.gz DJRYKKYPWGRQCR-UHFFFAOYSA-N 1 2 300.402 4.458 20 0 DIADLO CC[N@@H+](Cc1nc2ccccc2s1)Cc1ccccc1F ZINC001116322333 1047129418 /nfs/dbraw/zinc/12/94/18/1047129418.db2.gz DJRYKKYPWGRQCR-UHFFFAOYSA-N 1 2 300.402 4.458 20 0 DIADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1nc2ccccc2o1 ZINC000537023796 1047133682 /nfs/dbraw/zinc/13/36/82/1047133682.db2.gz NDJXGFAMHIKTEZ-CQSZACIVSA-N 1 2 310.397 4.466 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1cc2n(n1)CCCC2 ZINC000649471979 1047135892 /nfs/dbraw/zinc/13/58/92/1047135892.db2.gz XDKUQVSTJKRIOH-AWEZNQCLSA-N 1 2 309.413 4.159 20 0 DIADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1cc2n(n1)CCCC2 ZINC000649471979 1047135893 /nfs/dbraw/zinc/13/58/93/1047135893.db2.gz XDKUQVSTJKRIOH-AWEZNQCLSA-N 1 2 309.413 4.159 20 0 DIADLO CC(C)Sc1ccc([C@H](C)[NH2+]Cc2nnc(C3CC3)o2)cc1 ZINC000537102535 1047137111 /nfs/dbraw/zinc/13/71/11/1047137111.db2.gz HBOYVWPUIWGIGO-LBPRGKRZSA-N 1 2 317.458 4.298 20 0 DIADLO Cc1ccc(NC(=O)C[NH2+][C@H](C)c2c(F)cccc2Cl)cc1 ZINC000537176835 1047145396 /nfs/dbraw/zinc/14/53/96/1047145396.db2.gz AAWPSNAOKUJPGY-GFCCVEGCSA-N 1 2 320.795 4.077 20 0 DIADLO CCc1ccccc1C[NH2+][C@H](c1ccn(C)n1)c1ccc(F)cc1 ZINC000537191740 1047146629 /nfs/dbraw/zinc/14/66/29/1047146629.db2.gz XYKCNOYOTKVVKC-FQEVSTJZSA-N 1 2 323.415 4.001 20 0 DIADLO CCC[C@H]([NH2+]Cc1cc2n(n1)CCCC2)c1ccc(F)cc1F ZINC000649576020 1047147580 /nfs/dbraw/zinc/14/75/80/1047147580.db2.gz JLNCXFRGSWIUGL-SFHVURJKSA-N 1 2 319.399 4.129 20 0 DIADLO COc1ccccc1C1([NH2+][C@H](C)c2nc(C)sc2C)CCC1 ZINC001116482442 1047148834 /nfs/dbraw/zinc/14/88/34/1047148834.db2.gz GFNNSQJFGHTTCK-GFCCVEGCSA-N 1 2 316.470 4.499 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2nc(C)sc2C)c1C ZINC001116493691 1047148966 /nfs/dbraw/zinc/14/89/66/1047148966.db2.gz VRHQTVTVVNTVKJ-UHFFFAOYSA-N 1 2 308.472 4.214 20 0 DIADLO Fc1cccc(Br)c1C[N@H+]1CCC[C@@H](C(F)F)C1 ZINC001137466716 1047150928 /nfs/dbraw/zinc/15/09/28/1047150928.db2.gz OKUZRPUKQIYGJY-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO Fc1cccc(Br)c1C[N@@H+]1CCC[C@@H](C(F)F)C1 ZINC001137466716 1047150929 /nfs/dbraw/zinc/15/09/29/1047150929.db2.gz OKUZRPUKQIYGJY-SECBINFHSA-N 1 2 322.168 4.065 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(-c2ccsc2)no1)c1ccc(F)cc1 ZINC001116556935 1047156746 /nfs/dbraw/zinc/15/67/46/1047156746.db2.gz UXZXNUHBLGEQIQ-AWEZNQCLSA-N 1 2 317.389 4.178 20 0 DIADLO CC(C)n1ccnc1C[NH2+]C1(c2ccccc2Cl)CCC1 ZINC000649643432 1047156935 /nfs/dbraw/zinc/15/69/35/1047156935.db2.gz LRSPBMDDYRNHTC-UHFFFAOYSA-N 1 2 303.837 4.286 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@@H+]([C@H](C)c2ccc(F)c(F)c2)C1 ZINC000682038367 1047164087 /nfs/dbraw/zinc/16/40/87/1047164087.db2.gz CWUXTTLHGCXSLN-QMTHXVAHSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@H+]([C@H](C)c2ccc(F)c(F)c2)C1 ZINC000682038367 1047164092 /nfs/dbraw/zinc/16/40/92/1047164092.db2.gz CWUXTTLHGCXSLN-QMTHXVAHSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@@H+]([C@@H](C)c2cc(F)ccc2F)C1 ZINC000682041823 1047164965 /nfs/dbraw/zinc/16/49/65/1047164965.db2.gz NDAYCEVXIRXKLQ-IINYFYTJSA-N 1 2 323.305 4.069 20 0 DIADLO CO[C@]1(C(F)(F)F)CCC[N@H+]([C@@H](C)c2cc(F)ccc2F)C1 ZINC000682041823 1047164973 /nfs/dbraw/zinc/16/49/73/1047164973.db2.gz NDAYCEVXIRXKLQ-IINYFYTJSA-N 1 2 323.305 4.069 20 0 DIADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)[nH]n1 ZINC001116648197 1047165234 /nfs/dbraw/zinc/16/52/34/1047165234.db2.gz JFGQHHNCLWJBJZ-MRXNPFEDSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)[nH]n1 ZINC001116648197 1047165245 /nfs/dbraw/zinc/16/52/45/1047165245.db2.gz JFGQHHNCLWJBJZ-MRXNPFEDSA-N 1 2 323.362 4.464 20 0 DIADLO CC[C@@H]1COC(C)(C)C[N@@H+]1Cc1nc(-c2ccccc2)oc1C ZINC000649714517 1047166414 /nfs/dbraw/zinc/16/64/14/1047166414.db2.gz DVTJFKOPPNAQOX-MRXNPFEDSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@@H]1COC(C)(C)C[N@H+]1Cc1nc(-c2ccccc2)oc1C ZINC000649714517 1047166420 /nfs/dbraw/zinc/16/64/20/1047166420.db2.gz DVTJFKOPPNAQOX-MRXNPFEDSA-N 1 2 314.429 4.039 20 0 DIADLO CC[C@H]1COC(C)(C)C[N@@H+]1Cc1nc(-c2ccsc2)oc1C ZINC000649716082 1047166699 /nfs/dbraw/zinc/16/66/99/1047166699.db2.gz SFQBZWSFMWNBRR-AWEZNQCLSA-N 1 2 320.458 4.101 20 0 DIADLO CC[C@H]1COC(C)(C)C[N@H+]1Cc1nc(-c2ccsc2)oc1C ZINC000649716082 1047166705 /nfs/dbraw/zinc/16/67/05/1047166705.db2.gz SFQBZWSFMWNBRR-AWEZNQCLSA-N 1 2 320.458 4.101 20 0 DIADLO CC[C@H]1C[N@H+](Cc2nc(-c3ccsc3)oc2C)[C@@H](CC)CO1 ZINC000649720959 1047167353 /nfs/dbraw/zinc/16/73/53/1047167353.db2.gz RLHNDTWFJOUCHT-GJZGRUSLSA-N 1 2 320.458 4.101 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2nc(-c3ccsc3)oc2C)[C@@H](CC)CO1 ZINC000649720959 1047167359 /nfs/dbraw/zinc/16/73/59/1047167359.db2.gz RLHNDTWFJOUCHT-GJZGRUSLSA-N 1 2 320.458 4.101 20 0 DIADLO Cc1ncc([C@H](C)[N@H+](C)Cc2ccc(F)cc2Cl)c(C)n1 ZINC000682071065 1047168748 /nfs/dbraw/zinc/16/87/48/1047168748.db2.gz NVJKRZRFXTWXNR-NSHDSACASA-N 1 2 307.800 4.079 20 0 DIADLO Cc1ncc([C@H](C)[N@@H+](C)Cc2ccc(F)cc2Cl)c(C)n1 ZINC000682071065 1047168750 /nfs/dbraw/zinc/16/87/50/1047168750.db2.gz NVJKRZRFXTWXNR-NSHDSACASA-N 1 2 307.800 4.079 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1n[nH]c2ccccc12 ZINC001116726826 1047172364 /nfs/dbraw/zinc/17/23/64/1047172364.db2.gz UOPAPPVPTOYERH-UHFFFAOYSA-N 1 2 319.412 4.280 20 0 DIADLO COc1cccc(F)c1[C@H](C)[NH2+]Cc1ccc(C)nc1Cl ZINC000838917965 1047174127 /nfs/dbraw/zinc/17/41/27/1047174127.db2.gz PYUFVJCZDPBNHM-NSHDSACASA-N 1 2 308.784 4.042 20 0 DIADLO CC(C)(C)c1nc(C[NH+]2CCC3(CC3(F)F)CC2)cs1 ZINC000649777195 1047174263 /nfs/dbraw/zinc/17/42/63/1047174263.db2.gz HMPRZASFBJNXKZ-UHFFFAOYSA-N 1 2 300.418 4.062 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)c(Cl)n1 ZINC000838924309 1047175523 /nfs/dbraw/zinc/17/55/23/1047175523.db2.gz CZHDPLPSGWKFQG-ZYHUDNBSSA-N 1 2 306.759 4.206 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)c(Cl)n1 ZINC000838924309 1047175532 /nfs/dbraw/zinc/17/55/32/1047175532.db2.gz CZHDPLPSGWKFQG-ZYHUDNBSSA-N 1 2 306.759 4.206 20 0 DIADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cc2cccc(Cl)c2nc1Cl ZINC001141543701 1047176320 /nfs/dbraw/zinc/17/63/20/1047176320.db2.gz KEIJRDWJLCFGCO-SKDRFNHKSA-N 1 2 313.203 4.474 20 0 DIADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cc2cccc(Cl)c2nc1Cl ZINC001141543701 1047176328 /nfs/dbraw/zinc/17/63/28/1047176328.db2.gz KEIJRDWJLCFGCO-SKDRFNHKSA-N 1 2 313.203 4.474 20 0 DIADLO Fc1ccccc1C[C@H]1CCCC[N@H+]1Cc1nccn1C(F)F ZINC000649795235 1047176623 /nfs/dbraw/zinc/17/66/23/1047176623.db2.gz HOLBBOYTTNCTEF-CQSZACIVSA-N 1 2 323.362 4.015 20 0 DIADLO Fc1ccccc1C[C@H]1CCCC[N@@H+]1Cc1nccn1C(F)F ZINC000649795235 1047176626 /nfs/dbraw/zinc/17/66/26/1047176626.db2.gz HOLBBOYTTNCTEF-CQSZACIVSA-N 1 2 323.362 4.015 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nc3c(s2)CCCC3)c(Cl)n1 ZINC000838938663 1047178147 /nfs/dbraw/zinc/17/81/47/1047178147.db2.gz NSSVKQWTZRPASF-LLVKDONJSA-N 1 2 321.877 4.230 20 0 DIADLO CCc1noc([C@@H](C)[N@H+](C)Cc2oc3c(cccc3C)c2C)n1 ZINC000649819409 1047179826 /nfs/dbraw/zinc/17/98/26/1047179826.db2.gz WDHPRCDWQFZLTM-CYBMUJFWSA-N 1 2 313.401 4.188 20 0 DIADLO CCc1noc([C@@H](C)[N@@H+](C)Cc2oc3c(cccc3C)c2C)n1 ZINC000649819409 1047179836 /nfs/dbraw/zinc/17/98/36/1047179836.db2.gz WDHPRCDWQFZLTM-CYBMUJFWSA-N 1 2 313.401 4.188 20 0 DIADLO Cc1ccc(N[C@H]2CCCc3nn(-c4ccccc4)cc32)c(C)[nH+]1 ZINC001116890562 1047186870 /nfs/dbraw/zinc/18/68/70/1047186870.db2.gz YKZKQDSFBURKRP-IBGZPJMESA-N 1 2 318.424 4.374 20 0 DIADLO Cc1cc(N2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)[nH+]c2ccccc12 ZINC001116913009 1047190746 /nfs/dbraw/zinc/19/07/46/1047190746.db2.gz OSMBLFYPAZXNGE-IXMYUCAJSA-N 1 2 324.468 4.309 20 0 DIADLO Cc1cc(N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)[nH+]c2ccccc12 ZINC001116913010 1047190865 /nfs/dbraw/zinc/19/08/65/1047190865.db2.gz OSMBLFYPAZXNGE-OBZTVWKBSA-N 1 2 324.468 4.309 20 0 DIADLO Cc1cc(O)c(C(C)C)cc1NC(=O)Nc1ccc2[nH+]ccn2c1 ZINC000682395440 1047190727 /nfs/dbraw/zinc/19/07/27/1047190727.db2.gz ACTCRRKAHPABJT-UHFFFAOYSA-N 1 2 324.384 4.116 20 0 DIADLO Clc1nccc(C[NH+]2CC(Cc3ccccc3)C2)c1Cl ZINC000839127318 1047196481 /nfs/dbraw/zinc/19/64/81/1047196481.db2.gz CEMPIBJWMWMHJA-UHFFFAOYSA-N 1 2 307.224 4.063 20 0 DIADLO C[C@@H](CC(=O)Nc1cc(Cl)ccc1C(C)(C)C)n1cc[nH+]c1 ZINC000650003475 1047201060 /nfs/dbraw/zinc/20/10/60/1047201060.db2.gz CYQSFHBTMVDMPG-LBPRGKRZSA-N 1 2 319.836 4.424 20 0 DIADLO F[C@H]1C[N@H+](Cc2c[nH]c3cc(Cl)ccc23)CCC1(F)F ZINC001141579795 1047202342 /nfs/dbraw/zinc/20/23/42/1047202342.db2.gz NYOITEQUBNKELA-ZDUSSCGKSA-N 1 2 302.727 4.000 20 0 DIADLO F[C@H]1C[N@@H+](Cc2c[nH]c3cc(Cl)ccc23)CCC1(F)F ZINC001141579795 1047202347 /nfs/dbraw/zinc/20/23/47/1047202347.db2.gz NYOITEQUBNKELA-ZDUSSCGKSA-N 1 2 302.727 4.000 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc(Oc3ccccc3)o2)nc1 ZINC000682787825 1047222924 /nfs/dbraw/zinc/22/29/24/1047222924.db2.gz FSOUOGZBMFEUDA-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc(Oc3ccccc3)o2)nc1 ZINC000682787825 1047222935 /nfs/dbraw/zinc/22/29/35/1047222935.db2.gz FSOUOGZBMFEUDA-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO CC(C)C[C@@H]1COCC[N@@H+]1Cc1cc2ccnc(Cl)c2s1 ZINC001204873460 1047229005 /nfs/dbraw/zinc/22/90/05/1047229005.db2.gz BERYPAFDOUNGFJ-CYBMUJFWSA-N 1 2 324.877 4.197 20 0 DIADLO CC(C)C[C@@H]1COCC[N@H+]1Cc1cc2ccnc(Cl)c2s1 ZINC001204873460 1047229010 /nfs/dbraw/zinc/22/90/10/1047229010.db2.gz BERYPAFDOUNGFJ-CYBMUJFWSA-N 1 2 324.877 4.197 20 0 DIADLO Cc1cc(C)c(CNC(=O)Nc2cc(C(F)F)ccc2F)c[nH+]1 ZINC000650379425 1047235432 /nfs/dbraw/zinc/23/54/32/1047235432.db2.gz OANRHKVRVACSAU-UHFFFAOYSA-N 1 2 323.318 4.097 20 0 DIADLO Cc1cc(N[C@H]2CCO[C@H](c3ccncc3)C2)[nH+]c2ccccc12 ZINC001117758602 1047240441 /nfs/dbraw/zinc/24/04/41/1047240441.db2.gz RLAGGRAWNHMLSG-LPHOPBHVSA-N 1 2 319.408 4.270 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(-c2ccco2)on1)c1ccccc1OC ZINC000839538924 1047244767 /nfs/dbraw/zinc/24/47/67/1047244767.db2.gz OQZULNBECHHEMZ-HNNXBMFYSA-N 1 2 312.369 4.184 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1nccn1-c1ccccc1 ZINC000682997741 1047247917 /nfs/dbraw/zinc/24/79/17/1047247917.db2.gz XQKPAKSJMRVXIL-ZIAGYGMSSA-N 1 2 323.362 4.035 20 0 DIADLO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1nccn1-c1ccccc1 ZINC000682997741 1047247929 /nfs/dbraw/zinc/24/79/29/1047247929.db2.gz XQKPAKSJMRVXIL-ZIAGYGMSSA-N 1 2 323.362 4.035 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cccnc2Cl)cc1Cl ZINC000839661318 1047253612 /nfs/dbraw/zinc/25/36/12/1047253612.db2.gz MJUXNMYZILXSHN-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cccnc2Cl)cc1Cl ZINC000839661318 1047253629 /nfs/dbraw/zinc/25/36/29/1047253629.db2.gz MJUXNMYZILXSHN-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO CCCC[C@H](CCC)NC(=O)[C@@H]1CCc2[nH+]c(C(C)C)[nH]c2C1 ZINC000476250943 1047264949 /nfs/dbraw/zinc/26/49/49/1047264949.db2.gz STMADXRKROQMRL-CABCVRRESA-N 1 2 319.493 4.113 20 0 DIADLO CCCC[C@H](CCC)NC(=O)[C@@H]1CCc2[nH]c(C(C)C)[nH+]c2C1 ZINC000476250943 1047264969 /nfs/dbraw/zinc/26/49/69/1047264969.db2.gz STMADXRKROQMRL-CABCVRRESA-N 1 2 319.493 4.113 20 0 DIADLO C[C@H]1CCC[N@@H+]1Cc1c(F)c(Cl)ccc1Br ZINC001141689884 1047266114 /nfs/dbraw/zinc/26/61/14/1047266114.db2.gz RCCRZHBRNOOEDN-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@H]1CCC[N@H+]1Cc1c(F)c(Cl)ccc1Br ZINC001141689884 1047266143 /nfs/dbraw/zinc/26/61/43/1047266143.db2.gz RCCRZHBRNOOEDN-QMMMGPOBSA-N 1 2 306.606 4.226 20 0 DIADLO Fc1c(Cl)ccc(Br)c1C[NH+]1C2CCC1CC2 ZINC001141697085 1047270434 /nfs/dbraw/zinc/27/04/34/1047270434.db2.gz VSPQGJDGLWBAIV-UHFFFAOYSA-N 1 2 318.617 4.368 20 0 DIADLO F[C@H]1C[N@H+](Cc2ccc3c(c2)Cc2ccccc2-3)CCC1(F)F ZINC001141735224 1047284015 /nfs/dbraw/zinc/28/40/15/1047284015.db2.gz ZJQHVSCKRRHYMR-SFHVURJKSA-N 1 2 317.354 4.437 20 0 DIADLO F[C@H]1C[N@@H+](Cc2ccc3c(c2)Cc2ccccc2-3)CCC1(F)F ZINC001141735224 1047284022 /nfs/dbraw/zinc/28/40/22/1047284022.db2.gz ZJQHVSCKRRHYMR-SFHVURJKSA-N 1 2 317.354 4.437 20 0 DIADLO Clc1nc2ccccc2cc1C[N@@H+]1CCOCC12CCCC2 ZINC000388736839 1047288909 /nfs/dbraw/zinc/28/89/09/1047288909.db2.gz WUPJDGONEBWUNE-UHFFFAOYSA-N 1 2 316.832 4.033 20 0 DIADLO Clc1nc2ccccc2cc1C[N@H+]1CCOCC12CCCC2 ZINC000388736839 1047288915 /nfs/dbraw/zinc/28/89/15/1047288915.db2.gz WUPJDGONEBWUNE-UHFFFAOYSA-N 1 2 316.832 4.033 20 0 DIADLO S=c1scc(-c2ccccc2)n1C[N@@H+]1C[C@@H]2C[C@H]1CS2 ZINC000840169209 1047290899 /nfs/dbraw/zinc/29/08/99/1047290899.db2.gz UFGODWOHIWOMNO-STQMWFEESA-N 1 2 320.508 4.093 20 0 DIADLO S=c1scc(-c2ccccc2)n1C[N@H+]1C[C@@H]2C[C@H]1CS2 ZINC000840169209 1047290902 /nfs/dbraw/zinc/29/09/02/1047290902.db2.gz UFGODWOHIWOMNO-STQMWFEESA-N 1 2 320.508 4.093 20 0 DIADLO Cc1cccnc1[C@@H]([NH2+]Cc1nc(Cl)cs1)C(C)(C)C ZINC000897995520 1047309587 /nfs/dbraw/zinc/30/95/87/1047309587.db2.gz OMBNCPRGJBVZQI-CQSZACIVSA-N 1 2 309.866 4.377 20 0 DIADLO Cc1ccc(Nc2nn(C[N@H+]3CC[C@@H](C)C3)c(=S)s2)cc1 ZINC000725779846 1047315141 /nfs/dbraw/zinc/31/51/41/1047315141.db2.gz RXYNGHDCJROBFC-GFCCVEGCSA-N 1 2 320.487 4.025 20 0 DIADLO Cc1ccc(Nc2nn(C[N@@H+]3CC[C@@H](C)C3)c(=S)s2)cc1 ZINC000725779846 1047315155 /nfs/dbraw/zinc/31/51/55/1047315155.db2.gz RXYNGHDCJROBFC-GFCCVEGCSA-N 1 2 320.487 4.025 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1ccc(-c2ccccc2)cn1 ZINC000651738204 1047324479 /nfs/dbraw/zinc/32/44/79/1047324479.db2.gz FBUZSONREKSDBU-KUHUBIRLSA-N 1 2 318.424 4.200 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCc2c[nH]nc21)c1ccc(-c2ccccc2)cn1 ZINC000651738204 1047324488 /nfs/dbraw/zinc/32/44/88/1047324488.db2.gz FBUZSONREKSDBU-KUHUBIRLSA-N 1 2 318.424 4.200 20 0 DIADLO CCCCCCC(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000725895002 1047324484 /nfs/dbraw/zinc/32/44/84/1047324484.db2.gz QMDIAQJLDQPKPU-UHFFFAOYSA-N 1 2 305.809 4.435 20 0 DIADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)c(C)s1 ZINC000898179110 1047325028 /nfs/dbraw/zinc/32/50/28/1047325028.db2.gz HSPAWBMVXZXWKO-NWDGAFQWSA-N 1 2 318.490 4.168 20 0 DIADLO CCn1ccnc1[C@H](C)[NH2+][C@@H]1CCc2ccc(F)c(Cl)c21 ZINC000651822950 1047329758 /nfs/dbraw/zinc/32/97/58/1047329758.db2.gz PZJSOPAUFLNNDL-GXFFZTMASA-N 1 2 307.800 4.034 20 0 DIADLO C[C@@H]1C[N@H+](Cc2sccc2Oc2ccccc2)CCCC1=O ZINC001141994530 1047333909 /nfs/dbraw/zinc/33/39/09/1047333909.db2.gz OOGGWRFYTFNYHJ-CQSZACIVSA-N 1 2 315.438 4.341 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2sccc2Oc2ccccc2)CCCC1=O ZINC001141994530 1047333922 /nfs/dbraw/zinc/33/39/22/1047333922.db2.gz OOGGWRFYTFNYHJ-CQSZACIVSA-N 1 2 315.438 4.341 20 0 DIADLO C[C@H]([NH2+]Cc1csc(-c2cccs2)n1)c1cccc(O)c1 ZINC000105461135 1047340985 /nfs/dbraw/zinc/34/09/85/1047340985.db2.gz XMRLZBOHLLPXCG-NSHDSACASA-N 1 2 316.451 4.428 20 0 DIADLO CC(C)CCO[C@@H]1CC[N@H+](Cc2ncc(Cl)cc2Cl)C1 ZINC000537516229 1047352208 /nfs/dbraw/zinc/35/22/08/1047352208.db2.gz NJIJIZZBHXQBQK-CYBMUJFWSA-N 1 2 317.260 4.025 20 0 DIADLO CC(C)CCO[C@@H]1CC[N@@H+](Cc2ncc(Cl)cc2Cl)C1 ZINC000537516229 1047352216 /nfs/dbraw/zinc/35/22/16/1047352216.db2.gz NJIJIZZBHXQBQK-CYBMUJFWSA-N 1 2 317.260 4.025 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2cccc(C(F)(F)F)c2)c1 ZINC000652330097 1047354046 /nfs/dbraw/zinc/35/40/46/1047354046.db2.gz ULXVKPIECWEWBN-NSHDSACASA-N 1 2 310.319 4.420 20 0 DIADLO CCC[C@@H](Nc1cc(COC)cc[nH+]1)c1ccc(OC)cc1 ZINC000652330274 1047354249 /nfs/dbraw/zinc/35/42/49/1047354249.db2.gz BEXCYGHOEPDLKB-QGZVFWFLSA-N 1 2 300.402 4.190 20 0 DIADLO COCc1cc[nH+]c(N[C@@H](C)c2cccc(Br)c2)c1 ZINC000652329854 1047354545 /nfs/dbraw/zinc/35/45/45/1047354545.db2.gz LSCRVHAGVPQFFV-NSHDSACASA-N 1 2 321.218 4.164 20 0 DIADLO COCc1cc[nH+]c(N[C@H]2c3cccc(F)c3CC[C@@H]2C)c1 ZINC000652330669 1047356474 /nfs/dbraw/zinc/35/64/74/1047356474.db2.gz MKNFJZJUFNPENZ-KPZWWZAWSA-N 1 2 300.377 4.103 20 0 DIADLO CCOc1ccc(Cl)cc1[C@H](C)Nc1cc(COC)cc[nH+]1 ZINC000652331035 1047356641 /nfs/dbraw/zinc/35/66/41/1047356641.db2.gz WKLKORPIHIJHMI-LBPRGKRZSA-N 1 2 320.820 4.453 20 0 DIADLO COCc1cc[nH+]c(N[C@H](C)c2cc3cccc(OC)c3o2)c1 ZINC000652330382 1047357120 /nfs/dbraw/zinc/35/71/20/1047357120.db2.gz DYIRHUDOBZTQSA-GFCCVEGCSA-N 1 2 312.369 4.156 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(Cl)cc(O)cc2Cl)CCC1(F)F ZINC001142105664 1047380915 /nfs/dbraw/zinc/38/09/15/1047380915.db2.gz JJKMKEYVVBBKGW-MRVPVSSYSA-N 1 2 310.171 4.176 20 0 DIADLO C[C@@H]1CCC[N@@H+]1Cc1c(F)ccc(Br)c1Cl ZINC001142078209 1047370446 /nfs/dbraw/zinc/37/04/46/1047370446.db2.gz BPRZAAMXPIYMAS-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@@H]1CCC[N@H+]1Cc1c(F)ccc(Br)c1Cl ZINC001142078209 1047370461 /nfs/dbraw/zinc/37/04/61/1047370461.db2.gz BPRZAAMXPIYMAS-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO Cn1c(Cl)cnc1C[NH+]1CCC(c2cccc(Cl)c2)CC1 ZINC000796537344 1047382791 /nfs/dbraw/zinc/38/27/91/1047382791.db2.gz ZMUDTZDILYKUIT-UHFFFAOYSA-N 1 2 324.255 4.107 20 0 DIADLO Cc1ccc(-c2nnc([C@@H](C)[NH+]3CCC(F)(F)CC3)o2)cc1C ZINC000796543086 1047383599 /nfs/dbraw/zinc/38/35/99/1047383599.db2.gz PHVPDBSBFHDOAT-CYBMUJFWSA-N 1 2 321.371 4.146 20 0 DIADLO Cc1ccc2c(c1)[C@@H](NC(=O)Nc1c(C)cc(C)[nH+]c1C)CC2 ZINC000653179896 1047385959 /nfs/dbraw/zinc/38/59/59/1047385959.db2.gz ZZJHZUPESZYNAW-KRWDZBQOSA-N 1 2 309.413 4.124 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CCC(C3CCCC3)CC2)c(C)[nH+]1 ZINC000653180580 1047386025 /nfs/dbraw/zinc/38/60/25/1047386025.db2.gz DWYDBZXXEILOLQ-UHFFFAOYSA-N 1 2 315.461 4.441 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@@H](CC2CC2)c2ccccc2)c[nH+]1 ZINC000653271382 1047387525 /nfs/dbraw/zinc/38/75/25/1047387525.db2.gz IWIZMMQYDGKJNS-IBGZPJMESA-N 1 2 323.440 4.039 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(C)nc2Cl)cn1 ZINC001142144175 1047389333 /nfs/dbraw/zinc/38/93/33/1047389333.db2.gz YYFWVSRPRXKAQK-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(C)nc2Cl)cn1 ZINC001142144175 1047389345 /nfs/dbraw/zinc/38/93/45/1047389345.db2.gz YYFWVSRPRXKAQK-INIZCTEOSA-N 1 2 301.821 4.084 20 0 DIADLO Cc1ccc([C@@H](C)[NH2+]Cc2c(F)c(F)cc(F)c2F)c(C)n1 ZINC000678594744 1047391164 /nfs/dbraw/zinc/39/11/64/1047391164.db2.gz HHAZLCKPYRXVSY-SECBINFHSA-N 1 2 312.310 4.106 20 0 DIADLO CCOc1cccc(Cl)c1C[NH2+][C@@H](C)c1c(C)noc1C ZINC000653605039 1047407575 /nfs/dbraw/zinc/40/75/75/1047407575.db2.gz DMJYWWZINGXOCP-JTQLQIEISA-N 1 2 308.809 4.194 20 0 DIADLO CC(=Cc1ccc(F)cc1)C(=O)Nc1ccc2[nH]c(C)[nH+]c2c1 ZINC000749338452 1047411407 /nfs/dbraw/zinc/41/14/07/1047411407.db2.gz PIJJAYKELFHPRD-PKNBQFBNSA-N 1 2 309.344 4.052 20 0 DIADLO CC[N@H+](Cc1cccc(C)n1)Cc1ccccc1Br ZINC000083882220 1047413307 /nfs/dbraw/zinc/41/33/07/1047413307.db2.gz GCBJAPGUQCZDKA-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO CC[N@@H+](Cc1cccc(C)n1)Cc1ccccc1Br ZINC000083882220 1047413312 /nfs/dbraw/zinc/41/33/12/1047413312.db2.gz GCBJAPGUQCZDKA-UHFFFAOYSA-N 1 2 319.246 4.175 20 0 DIADLO C/C(=C/C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc(F)cc1 ZINC000749380847 1047414595 /nfs/dbraw/zinc/41/45/95/1047414595.db2.gz CBAQQZVXULFPSK-SEYXRHQNSA-N 1 2 321.355 4.258 20 0 DIADLO O=C(/C=C\c1ccccc1Cl)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000749382821 1047414793 /nfs/dbraw/zinc/41/47/93/1047414793.db2.gz QUUKQVRLMJGYBI-YFHOEESVSA-N 1 2 323.783 4.382 20 0 DIADLO Brc1csc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)c1 ZINC000116877560 1047416083 /nfs/dbraw/zinc/41/60/83/1047416083.db2.gz KIMRUGANHNXBRU-CYBMUJFWSA-N 1 2 311.248 4.176 20 0 DIADLO Brc1csc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c1 ZINC000116877560 1047416086 /nfs/dbraw/zinc/41/60/86/1047416086.db2.gz KIMRUGANHNXBRU-CYBMUJFWSA-N 1 2 311.248 4.176 20 0 DIADLO CCO[C@@H]1CCC[N@H+](Cc2c(Cl)cc(OC)cc2Cl)C1 ZINC001142292955 1047423836 /nfs/dbraw/zinc/42/38/36/1047423836.db2.gz KKMWQADKDFPXHT-LLVKDONJSA-N 1 2 318.244 4.003 20 0 DIADLO CCO[C@@H]1CCC[N@@H+](Cc2c(Cl)cc(OC)cc2Cl)C1 ZINC001142292955 1047423841 /nfs/dbraw/zinc/42/38/41/1047423841.db2.gz KKMWQADKDFPXHT-LLVKDONJSA-N 1 2 318.244 4.003 20 0 DIADLO Cc1ccc(C[NH2+][C@@H](C)c2nccs2)c(Br)c1 ZINC000119127983 1047444225 /nfs/dbraw/zinc/44/42/25/1047444225.db2.gz VJNGYASZYKNSJP-JTQLQIEISA-N 1 2 311.248 4.065 20 0 DIADLO CC1(C)C(=O)N(C[N@@H+]2CC[C@@H]2c2ccccc2)[C@H]1c1ccccc1 ZINC000749940228 1047450898 /nfs/dbraw/zinc/45/08/98/1047450898.db2.gz YCTMCDTYOUSHLY-MOPGFXCFSA-N 1 2 320.436 4.001 20 0 DIADLO CC1(C)C(=O)N(C[N@H+]2CC[C@@H]2c2ccccc2)[C@H]1c1ccccc1 ZINC000749940228 1047450901 /nfs/dbraw/zinc/45/09/01/1047450901.db2.gz YCTMCDTYOUSHLY-MOPGFXCFSA-N 1 2 320.436 4.001 20 0 DIADLO CCn1c[nH+]cc1CNc1ccc(OCC(C)C)c(Cl)c1 ZINC000841850813 1047459281 /nfs/dbraw/zinc/45/92/81/1047459281.db2.gz DXITWARRJMOQEO-UHFFFAOYSA-N 1 2 307.825 4.203 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2nc3cc(C(F)(F)F)ccc3o2)o1 ZINC000119671338 1047467604 /nfs/dbraw/zinc/46/76/04/1047467604.db2.gz KRMMQGSZWZAOSY-UHFFFAOYSA-N 1 2 324.302 4.380 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2nc3cc(C(F)(F)F)ccc3o2)o1 ZINC000119671338 1047467608 /nfs/dbraw/zinc/46/76/08/1047467608.db2.gz KRMMQGSZWZAOSY-UHFFFAOYSA-N 1 2 324.302 4.380 20 0 DIADLO Cc1cccc([C@H](C)C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC000120375768 1047489210 /nfs/dbraw/zinc/48/92/10/1047489210.db2.gz LYIRVXSSVRNUBY-AWEZNQCLSA-N 1 2 305.381 4.127 20 0 DIADLO Cc1cc(F)ccc1C[N@H+](C)Cc1nc2c(s1)CCCC2 ZINC000537627813 1047489249 /nfs/dbraw/zinc/48/92/49/1047489249.db2.gz JUHSALVLNDQBLC-UHFFFAOYSA-N 1 2 304.434 4.101 20 0 DIADLO Cc1cc(F)ccc1C[N@@H+](C)Cc1nc2c(s1)CCCC2 ZINC000537627813 1047489251 /nfs/dbraw/zinc/48/92/51/1047489251.db2.gz JUHSALVLNDQBLC-UHFFFAOYSA-N 1 2 304.434 4.101 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1csc(Cl)c1 ZINC001142776085 1047492963 /nfs/dbraw/zinc/49/29/63/1047492963.db2.gz SVCUVTAWNFAKLU-UHFFFAOYSA-N 1 2 307.846 4.495 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1csc(Cl)c1 ZINC001142776085 1047492967 /nfs/dbraw/zinc/49/29/67/1047492967.db2.gz SVCUVTAWNFAKLU-UHFFFAOYSA-N 1 2 307.846 4.495 20 0 DIADLO Cc1cc(Br)ccc1NCc1c[nH+]cn1C(C)C ZINC000090207485 1047499652 /nfs/dbraw/zinc/49/96/52/1047499652.db2.gz IYIMPIDQFZEWJN-UHFFFAOYSA-N 1 2 308.223 4.147 20 0 DIADLO CC1(C)CC[N@@H+]1Cc1cc(Br)ccc1OC(F)F ZINC000537635447 1047513118 /nfs/dbraw/zinc/51/31/18/1047513118.db2.gz UHJLHUJJYVNFEN-UHFFFAOYSA-N 1 2 320.177 4.035 20 0 DIADLO CC1(C)CC[N@H+]1Cc1cc(Br)ccc1OC(F)F ZINC000537635447 1047513127 /nfs/dbraw/zinc/51/31/27/1047513127.db2.gz UHJLHUJJYVNFEN-UHFFFAOYSA-N 1 2 320.177 4.035 20 0 DIADLO C[C@@H]([NH2+][C@H](c1cccc(F)c1)c1ccccn1)c1cccnc1 ZINC000090955974 1047513465 /nfs/dbraw/zinc/51/34/65/1047513465.db2.gz VSTRFGKVDVDKKJ-AUUYWEPGSA-N 1 2 307.372 4.056 20 0 DIADLO Cc1nc(C[N@@H+](C)C2CCC(c3ccc(Cl)cc3)CC2)no1 ZINC001168344625 1047519374 /nfs/dbraw/zinc/51/93/74/1047519374.db2.gz IHKJSQRUMUXUMT-UHFFFAOYSA-N 1 2 319.836 4.190 20 0 DIADLO Cc1nc(C[N@H+](C)C2CCC(c3ccc(Cl)cc3)CC2)no1 ZINC001168344625 1047519379 /nfs/dbraw/zinc/51/93/79/1047519379.db2.gz IHKJSQRUMUXUMT-UHFFFAOYSA-N 1 2 319.836 4.190 20 0 DIADLO Fc1ccc2oc(C[N@@H+]3CCO[C@@H](c4cccs4)C3)cc2c1 ZINC000092593461 1047536921 /nfs/dbraw/zinc/53/69/21/1047536921.db2.gz WYIYWYGWRKDPBC-MRXNPFEDSA-N 1 2 317.385 4.207 20 0 DIADLO Fc1ccc2oc(C[N@H+]3CCO[C@@H](c4cccs4)C3)cc2c1 ZINC000092593461 1047536930 /nfs/dbraw/zinc/53/69/30/1047536930.db2.gz WYIYWYGWRKDPBC-MRXNPFEDSA-N 1 2 317.385 4.207 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1ccc(C(F)F)cc1 ZINC001143244351 1047543281 /nfs/dbraw/zinc/54/32/81/1047543281.db2.gz STNOKRGLXMNVRP-UHFFFAOYSA-N 1 2 302.777 4.366 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1ccc(C(F)F)cc1 ZINC001143244351 1047543287 /nfs/dbraw/zinc/54/32/87/1047543287.db2.gz STNOKRGLXMNVRP-UHFFFAOYSA-N 1 2 302.777 4.366 20 0 DIADLO COc1cc2c(cc1OC)C[NH+](Cc1ccc(C(F)F)cc1)C2 ZINC001143256306 1047544469 /nfs/dbraw/zinc/54/44/69/1047544469.db2.gz ITDNNXJQXADYLD-UHFFFAOYSA-N 1 2 319.351 4.157 20 0 DIADLO C[C@H]([NH2+]Cc1ccnc(OC2CCCCC2)c1)c1nccs1 ZINC000093403837 1047546128 /nfs/dbraw/zinc/54/61/28/1047546128.db2.gz IUEVVZBPELOZPJ-ZDUSSCGKSA-N 1 2 317.458 4.100 20 0 DIADLO C[N@H+](Cc1cccnc1)Cc1c(Cl)cccc1C(F)(F)F ZINC001143283419 1047548469 /nfs/dbraw/zinc/54/84/69/1047548469.db2.gz YEKQAAOAICFSBJ-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@@H+](Cc1cccnc1)Cc1c(Cl)cccc1C(F)(F)F ZINC001143283419 1047548474 /nfs/dbraw/zinc/54/84/74/1047548474.db2.gz YEKQAAOAICFSBJ-UHFFFAOYSA-N 1 2 314.738 4.386 20 0 DIADLO C[N@H+](Cc1c(Br)ccc(F)c1F)CC(C)(C)C ZINC001143335996 1047554404 /nfs/dbraw/zinc/55/44/04/1047554404.db2.gz RCGAWDMCOQTFCK-UHFFFAOYSA-N 1 2 306.194 4.205 20 0 DIADLO C[N@@H+](Cc1c(Br)ccc(F)c1F)CC(C)(C)C ZINC001143335996 1047554408 /nfs/dbraw/zinc/55/44/08/1047554408.db2.gz RCGAWDMCOQTFCK-UHFFFAOYSA-N 1 2 306.194 4.205 20 0 DIADLO CC[N@H+](Cc1ccccn1)Cc1ccc(Br)cc1F ZINC000094679543 1047557385 /nfs/dbraw/zinc/55/73/85/1047557385.db2.gz FFYCEPOLJRIHJD-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1ccccn1)Cc1ccc(Br)cc1F ZINC000094679543 1047557390 /nfs/dbraw/zinc/55/73/90/1047557390.db2.gz FFYCEPOLJRIHJD-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001204375755 1047569355 /nfs/dbraw/zinc/56/93/55/1047569355.db2.gz TXRWFCRUCRMBKN-CQSZACIVSA-N 1 2 307.800 4.033 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001204375755 1047569361 /nfs/dbraw/zinc/56/93/61/1047569361.db2.gz TXRWFCRUCRMBKN-CQSZACIVSA-N 1 2 307.800 4.033 20 0 DIADLO C[N@H+](Cc1ccc[nH]1)Cc1cc(C(F)(F)F)ccc1Cl ZINC000537659813 1047572156 /nfs/dbraw/zinc/57/21/56/1047572156.db2.gz RPNHIJDXLIEECT-UHFFFAOYSA-N 1 2 302.727 4.319 20 0 DIADLO C[N@@H+](Cc1ccc[nH]1)Cc1cc(C(F)(F)F)ccc1Cl ZINC000537659813 1047572159 /nfs/dbraw/zinc/57/21/59/1047572159.db2.gz RPNHIJDXLIEECT-UHFFFAOYSA-N 1 2 302.727 4.319 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1CCc2ccccc2[C@H]1Cc1ccccc1 ZINC000537690691 1047575415 /nfs/dbraw/zinc/57/54/15/1047575415.db2.gz GWHPYNPLVFRGER-OAQYLSRUSA-N 1 2 317.436 4.060 20 0 DIADLO Cc1[nH]ncc1C[N@H+]1CCc2ccccc2[C@@H]1Cc1ccccc1 ZINC000537690690 1047575987 /nfs/dbraw/zinc/57/59/87/1047575987.db2.gz GWHPYNPLVFRGER-NRFANRHFSA-N 1 2 317.436 4.060 20 0 DIADLO Cc1c2cc(Cl)ccc2[nH]c1C(=O)Nc1cccc2[nH+]ccn21 ZINC001150720741 1047582278 /nfs/dbraw/zinc/58/22/78/1047582278.db2.gz CHZUAFJETSWEBT-UHFFFAOYSA-N 1 2 324.771 4.030 20 0 DIADLO CC[N@H+](CC(=O)NCCC(C)(C)CC)Cc1ccccc1Cl ZINC001151119772 1047592806 /nfs/dbraw/zinc/59/28/06/1047592806.db2.gz XZSBQNLAKDTXQF-UHFFFAOYSA-N 1 2 324.896 4.104 20 0 DIADLO CC[N@@H+](CC(=O)NCCC(C)(C)CC)Cc1ccccc1Cl ZINC001151119772 1047592812 /nfs/dbraw/zinc/59/28/12/1047592812.db2.gz XZSBQNLAKDTXQF-UHFFFAOYSA-N 1 2 324.896 4.104 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2ccn(C3CCCC3)n2)cc1 ZINC000477170601 1047601772 /nfs/dbraw/zinc/60/17/72/1047601772.db2.gz MWTVWJHVEYBZIZ-IBGZPJMESA-N 1 2 313.420 4.474 20 0 DIADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2ccn(C3CCCC3)n2)cc1 ZINC000477170601 1047601775 /nfs/dbraw/zinc/60/17/75/1047601775.db2.gz MWTVWJHVEYBZIZ-IBGZPJMESA-N 1 2 313.420 4.474 20 0 DIADLO CCOC(=O)c1ccc(Nc2ccc(C)[nH+]c2C)cc1Cl ZINC001203375097 1047605230 /nfs/dbraw/zinc/60/52/30/1047605230.db2.gz SJKYWCYCWJGORV-UHFFFAOYSA-N 1 2 304.777 4.272 20 0 DIADLO COC(=O)c1cc(Nc2ccc(C)[nH+]c2C)c(F)cc1Cl ZINC001203376017 1047611007 /nfs/dbraw/zinc/61/10/07/1047611007.db2.gz GLKBTFSIGDARSD-UHFFFAOYSA-N 1 2 308.740 4.021 20 0 DIADLO C[C@@H]([NH2+]C/C=C\c1ccccc1)c1nc(Cc2ccccc2)no1 ZINC000477295154 1047611554 /nfs/dbraw/zinc/61/15/54/1047611554.db2.gz ZCFSRSZDBPTWGG-LPDYGMJQSA-N 1 2 319.408 4.024 20 0 DIADLO COC(=O)c1sccc1C[NH2+][C@H](C)c1ccccc1Cl ZINC000088484485 1047616744 /nfs/dbraw/zinc/61/67/44/1047616744.db2.gz FGWQDYFJUODKKB-SNVBAGLBSA-N 1 2 309.818 4.039 20 0 DIADLO Cc1cc([C@H](C)[NH2+][C@H](c2ccccc2)c2cccc(F)c2)nn1C ZINC000282082635 1047622534 /nfs/dbraw/zinc/62/25/34/1047622534.db2.gz HQQONMYJXVSFQJ-MGPUTAFESA-N 1 2 323.415 4.308 20 0 DIADLO CCCCn1cc(C[NH2+]Cc2csc(C(C)(C)C)n2)c(C)n1 ZINC000538002433 1047652353 /nfs/dbraw/zinc/65/23/53/1047652353.db2.gz MRWCVLSQSKBIRP-UHFFFAOYSA-N 1 2 320.506 4.035 20 0 DIADLO CO[C@@H](c1ccc(Br)cc1)[C@H](C)Nc1cccc[nH+]1 ZINC000538004534 1047652623 /nfs/dbraw/zinc/65/26/23/1047652623.db2.gz PNQQMWZWTDKCCG-XHDPSFHLSA-N 1 2 321.218 4.032 20 0 DIADLO CCOC(=O)/C=C/c1ccc[nH+]c1N[C@H](c1ccccc1)C1CC1 ZINC001154643347 1047653017 /nfs/dbraw/zinc/65/30/17/1047653017.db2.gz XHFMHKAYGLMGPK-JXOMPUQVSA-N 1 2 322.408 4.221 20 0 DIADLO COc1ccc[nH+]c1N[C@@H]1CCCC[C@H]1OCc1ccccc1 ZINC001154716397 1047655096 /nfs/dbraw/zinc/65/50/96/1047655096.db2.gz KJMKSJSBYWODTN-IAGOWNOFSA-N 1 2 312.413 4.030 20 0 DIADLO Cc1cccc2ncc(CNc3[nH+]ccc4cc(Cl)ccc43)n21 ZINC001154943958 1047662319 /nfs/dbraw/zinc/66/23/19/1047662319.db2.gz WRUDCQUWZMBDJS-UHFFFAOYSA-N 1 2 322.799 4.456 20 0 DIADLO C[C@@H]([NH2+][C@@H](c1cccs1)c1ccc(F)cc1)c1nccn1C ZINC000538210964 1047663302 /nfs/dbraw/zinc/66/33/02/1047663302.db2.gz OVLNNYRDUSRIGW-MLGOLLRUSA-N 1 2 315.417 4.061 20 0 DIADLO Fc1ccc([C@H]([NH2+]Cc2nnc(C3CC3)o2)C2CCCC2)cc1 ZINC000538209303 1047663509 /nfs/dbraw/zinc/66/35/09/1047663509.db2.gz AHBDEQQHRAOOBF-QGZVFWFLSA-N 1 2 315.392 4.107 20 0 DIADLO COC(=O)CCCCCCNc1[nH+]c2ccccc2cc1C ZINC001155004562 1047665110 /nfs/dbraw/zinc/66/51/10/1047665110.db2.gz VZEQETAVCITBRV-UHFFFAOYSA-N 1 2 300.402 4.079 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1nc(-c2ccncc2)nc2sccc21 ZINC001155181822 1047671017 /nfs/dbraw/zinc/67/10/17/1047671017.db2.gz SGNSXQQUNAKXQE-UHFFFAOYSA-N 1 2 311.414 4.189 20 0 DIADLO Cc1cc(CN(Cc2ccccc2)c2[nH+]ccc(F)c2C)on1 ZINC001155289517 1047675747 /nfs/dbraw/zinc/67/57/47/1047675747.db2.gz VMLPBHCKSRZBCT-UHFFFAOYSA-N 1 2 311.360 4.032 20 0 DIADLO CCOC(CCCNc1cc(C)c2cccc(C)c2[nH+]1)OCC ZINC001155721911 1047687629 /nfs/dbraw/zinc/68/76/29/1047687629.db2.gz HYSDKQVOKBFYCU-UHFFFAOYSA-N 1 2 316.445 4.443 20 0 DIADLO COC1C[C@H]2CC[C@@H](C1)N2c1[nH+]ccc2cc(Cl)ccc21 ZINC001155795604 1047688419 /nfs/dbraw/zinc/68/84/19/1047688419.db2.gz AKTYREJHGRCVEZ-YIONKMFJSA-N 1 2 302.805 4.034 20 0 DIADLO CCOc1cccc(CCNc2[nH+]cc(SC)cc2C)c1 ZINC001155874505 1047690695 /nfs/dbraw/zinc/69/06/95/1047690695.db2.gz GPXCNNZBSXHNTM-UHFFFAOYSA-N 1 2 302.443 4.165 20 0 DIADLO CCc1ncnc(Cl)c1NC(=[NH2+])C12CC3CC(CC(C3)C1)C2 ZINC001155955909 1047692673 /nfs/dbraw/zinc/69/26/73/1047692673.db2.gz IEPOMRAJKWVDIL-UHFFFAOYSA-N 1 2 318.852 4.298 20 0 DIADLO C[C@H](Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccc(F)c(F)c1 ZINC000538634922 1047693213 /nfs/dbraw/zinc/69/32/13/1047693213.db2.gz KRNUJXHHOVPKDZ-NSHDSACASA-N 1 2 317.314 4.463 20 0 DIADLO CC/C=C(\F)C(=O)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC001155970813 1047694355 /nfs/dbraw/zinc/69/43/55/1047694355.db2.gz PIVJKNOXLNPGKF-SOFYXZRVSA-N 1 2 313.376 4.088 20 0 DIADLO Cc1cc(C)c(NC(=O)N[C@@H](C)C2CCC(F)CC2)c(C)[nH+]1 ZINC000667118958 1047694761 /nfs/dbraw/zinc/69/47/61/1047694761.db2.gz DDPKDTQGKMCBOF-GRTSSRMGSA-N 1 2 307.413 4.045 20 0 DIADLO Cc1cc(NCc2cc3ccccc3n2C)nc(C(C)(C)C)[nH+]1 ZINC001156016976 1047696810 /nfs/dbraw/zinc/69/68/10/1047696810.db2.gz ZJWGUTUOGIMISF-UHFFFAOYSA-N 1 2 308.429 4.186 20 0 DIADLO CCSc1cc[nH+]c(NC[C@H](C)Oc2ccc(OC)cc2)c1 ZINC001156079660 1047698273 /nfs/dbraw/zinc/69/82/73/1047698273.db2.gz BMGGTWLWUTVEPE-ZDUSSCGKSA-N 1 2 318.442 4.082 20 0 DIADLO CCCOc1cccc(C[N@H+](C)Cc2ncc(CC)s2)c1 ZINC000538724571 1047700327 /nfs/dbraw/zinc/70/03/27/1047700327.db2.gz QLQPDIZJEAOKFF-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO CCCOc1cccc(C[N@@H+](C)Cc2ncc(CC)s2)c1 ZINC000538724571 1047700328 /nfs/dbraw/zinc/70/03/28/1047700328.db2.gz QLQPDIZJEAOKFF-UHFFFAOYSA-N 1 2 304.459 4.126 20 0 DIADLO COc1ccccc1/C=C/C[N@@H+]1CCO[C@H](c2ccccc2C)C1 ZINC000538729121 1047702377 /nfs/dbraw/zinc/70/23/77/1047702377.db2.gz RVBZLCFPYUGICP-CLNPQZTCSA-N 1 2 323.436 4.090 20 0 DIADLO COc1ccccc1/C=C/C[N@H+]1CCO[C@H](c2ccccc2C)C1 ZINC000538729121 1047702382 /nfs/dbraw/zinc/70/23/82/1047702382.db2.gz RVBZLCFPYUGICP-CLNPQZTCSA-N 1 2 323.436 4.090 20 0 DIADLO COc1cccc(C[N@H+](C)Cc2ccc(F)cc2Cl)c1OC ZINC000538733529 1047703462 /nfs/dbraw/zinc/70/34/62/1047703462.db2.gz AQDWHFOKMPNZJP-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cccc(C[N@@H+](C)Cc2ccc(F)cc2Cl)c1OC ZINC000538733529 1047703469 /nfs/dbraw/zinc/70/34/69/1047703469.db2.gz AQDWHFOKMPNZJP-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO Cc1ccc(C[N@@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)nc1 ZINC000538737953 1047705552 /nfs/dbraw/zinc/70/55/52/1047705552.db2.gz MVGCPECFMWGREL-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1ccc(C[N@H+]2CCSC[C@@H]2c2ccc(Cl)cc2)nc1 ZINC000538737953 1047705555 /nfs/dbraw/zinc/70/55/55/1047705555.db2.gz MVGCPECFMWGREL-QGZVFWFLSA-N 1 2 318.873 4.334 20 0 DIADLO Cc1nc(NC2CCC(C(F)(F)F)CC2)cc(C(C)C)[nH+]1 ZINC001156416204 1047711437 /nfs/dbraw/zinc/71/14/37/1047711437.db2.gz YRBOIAQUJWKYEE-UHFFFAOYSA-N 1 2 301.356 4.441 20 0 DIADLO CCCn1cc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)cn1 ZINC000538796681 1047711551 /nfs/dbraw/zinc/71/15/51/1047711551.db2.gz PMNBUFFEWHSHFS-SFHVURJKSA-N 1 2 319.399 4.299 20 0 DIADLO CCCn1cc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)cn1 ZINC000538796681 1047711556 /nfs/dbraw/zinc/71/15/56/1047711556.db2.gz PMNBUFFEWHSHFS-SFHVURJKSA-N 1 2 319.399 4.299 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@@H+](C)[C@H](C)c2ccncc2)o1 ZINC000538782413 1047712221 /nfs/dbraw/zinc/71/22/21/1047712221.db2.gz KXOVOMCMTUMWMC-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO Cc1ccccc1-c1cnc(C[N@H+](C)[C@H](C)c2ccncc2)o1 ZINC000538782413 1047712224 /nfs/dbraw/zinc/71/22/24/1047712224.db2.gz KXOVOMCMTUMWMC-OAHLLOKOSA-N 1 2 307.397 4.238 20 0 DIADLO COC(OC)c1cc(C)c[nH+]c1NCc1ccccc1C1CC1 ZINC001156542018 1047717008 /nfs/dbraw/zinc/71/70/08/1047717008.db2.gz LPRKPTHVCOOPAQ-UHFFFAOYSA-N 1 2 312.413 4.171 20 0 DIADLO Cc1nc2cc(CNc3cc(C)[nH+]c(C(C)(C)C)n3)ccc2o1 ZINC001156933890 1047728730 /nfs/dbraw/zinc/72/87/30/1047728730.db2.gz NRZWAOGZDDEKHQ-UHFFFAOYSA-N 1 2 310.401 4.144 20 0 DIADLO CSc1cc[nH+]c(N2CCC[C@@H]2c2c(F)cccc2F)c1 ZINC001156949312 1047730407 /nfs/dbraw/zinc/73/04/07/1047730407.db2.gz YFVKJKBUFOEALT-CQSZACIVSA-N 1 2 306.381 4.423 20 0 DIADLO Nc1[nH+]c(NC2c3ccccc3-c3ccccc32)ccc1Cl ZINC001156966891 1047730898 /nfs/dbraw/zinc/73/08/98/1047730898.db2.gz ZULRFGFVRFEBKR-UHFFFAOYSA-N 1 2 307.784 4.499 20 0 DIADLO Nc1cc(Cl)[nH+]c(NC2c3ccccc3-c3ccccc32)c1 ZINC001156965820 1047731114 /nfs/dbraw/zinc/73/11/14/1047731114.db2.gz BFIGCCYTVUQOED-UHFFFAOYSA-N 1 2 307.784 4.499 20 0 DIADLO CCC[C@@H]([NH2+]Cc1nnc(-c2ccc(F)cc2)[nH]1)c1ccccc1 ZINC000539120774 1047737277 /nfs/dbraw/zinc/73/72/77/1047737277.db2.gz FVPXXHXMQLXBTN-QGZVFWFLSA-N 1 2 324.403 4.242 20 0 DIADLO Oc1cccc(C2CCN(c3cc4ccccc4c[nH+]3)CC2)c1 ZINC001157564378 1047746269 /nfs/dbraw/zinc/74/62/69/1047746269.db2.gz WPFARXWLPFMGFO-UHFFFAOYSA-N 1 2 304.393 4.324 20 0 DIADLO Clc1cccc(C2([NH2+]Cc3nnc(C4CC4)o3)CCCC2)c1 ZINC000539324857 1047748243 /nfs/dbraw/zinc/74/82/43/1047748243.db2.gz DKBOJBMJTVIFBC-UHFFFAOYSA-N 1 2 317.820 4.160 20 0 DIADLO CC(C)(C)c1ccc(N[C@@H](c2ccccn2)C(F)(F)F)[nH+]c1 ZINC001157685716 1047749105 /nfs/dbraw/zinc/74/91/05/1047749105.db2.gz CWJKNJDFLBCUBL-AWEZNQCLSA-N 1 2 309.335 4.490 20 0 DIADLO Cc1cc(N[C@@H](c2ccccn2)C(F)(F)F)nc(C(C)C)[nH+]1 ZINC001157686897 1047750221 /nfs/dbraw/zinc/75/02/21/1047750221.db2.gz OYIAWDOGCWJKJZ-ZDUSSCGKSA-N 1 2 310.323 4.019 20 0 DIADLO C[C@H]1CN(c2[nH+]ccc3ccccc32)[C@@H](c2ccccc2)CO1 ZINC001158285893 1047773069 /nfs/dbraw/zinc/77/30/69/1047773069.db2.gz GTDLUDYSMOFTDJ-HNAYVOBHSA-N 1 2 304.393 4.201 20 0 DIADLO COC(OC)c1cc(C)c[nH+]c1N[C@@H]1C[C@@H](C)c2ccccc21 ZINC001158471782 1047783396 /nfs/dbraw/zinc/78/33/96/1047783396.db2.gz JACVJKSPCOAENJ-CXAGYDPISA-N 1 2 312.413 4.342 20 0 DIADLO COC(=O)/C=C/c1cc(C)c[nH+]c1N[C@@H]1C[C@@H](C)c2ccccc21 ZINC001158472943 1047783581 /nfs/dbraw/zinc/78/35/81/1047783581.db2.gz OHUZXMSIHOOYHA-UTCUSRJNSA-N 1 2 322.408 4.237 20 0 DIADLO CO[C@H](C)c1nc(C[N@@H+]2CCc3ccccc3C2(C)C)cs1 ZINC000552678348 1047786139 /nfs/dbraw/zinc/78/61/39/1047786139.db2.gz CWQRFHNCCSWTHN-CYBMUJFWSA-N 1 2 316.470 4.144 20 0 DIADLO CO[C@H](C)c1nc(C[N@H+]2CCc3ccccc3C2(C)C)cs1 ZINC000552678348 1047786141 /nfs/dbraw/zinc/78/61/41/1047786141.db2.gz CWQRFHNCCSWTHN-CYBMUJFWSA-N 1 2 316.470 4.144 20 0 DIADLO CO[C@@H](C)c1nc(C[N@@H+]2CCc3ccccc3C2(C)C)cs1 ZINC000552678349 1047786256 /nfs/dbraw/zinc/78/62/56/1047786256.db2.gz CWQRFHNCCSWTHN-ZDUSSCGKSA-N 1 2 316.470 4.144 20 0 DIADLO CO[C@@H](C)c1nc(C[N@H+]2CCc3ccccc3C2(C)C)cs1 ZINC000552678349 1047786259 /nfs/dbraw/zinc/78/62/59/1047786259.db2.gz CWQRFHNCCSWTHN-ZDUSSCGKSA-N 1 2 316.470 4.144 20 0 DIADLO COc1c[nH+]c(N[C@@H](CCO)c2cccc3ccccc32)c(C)c1 ZINC001158506455 1047787595 /nfs/dbraw/zinc/78/75/95/1047787595.db2.gz QKAGYSFGSMPFFH-IBGZPJMESA-N 1 2 322.408 4.087 20 0 DIADLO COc1cc(C)c[nH+]c1N[C@H](CCO)c1cccc2ccccc21 ZINC001158510072 1047788384 /nfs/dbraw/zinc/78/83/84/1047788384.db2.gz UECUOQWQILEZLF-GOSISDBHSA-N 1 2 322.408 4.087 20 0 DIADLO COC(=O)c1ccc([C@@H]2CCCN2c2ccc(C(C)C)c[nH+]2)cc1 ZINC001158595814 1047789587 /nfs/dbraw/zinc/78/95/87/1047789587.db2.gz XKLLHIXRYXIAGD-SFHVURJKSA-N 1 2 324.424 4.333 20 0 DIADLO CC(C)[N@H+](Cc1cncn1C)Cc1ccc(Cl)cc1Cl ZINC001204385897 1047795877 /nfs/dbraw/zinc/79/58/77/1047795877.db2.gz KTRRPOHSYFFXDV-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO CC(C)[N@@H+](Cc1cncn1C)Cc1ccc(Cl)cc1Cl ZINC001204385897 1047795882 /nfs/dbraw/zinc/79/58/82/1047795882.db2.gz KTRRPOHSYFFXDV-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO CC(C)N(Cc1c[nH+]cn1C)Cc1ccc(Cl)cc1Cl ZINC001204385897 1047795886 /nfs/dbraw/zinc/79/58/86/1047795886.db2.gz KTRRPOHSYFFXDV-UHFFFAOYSA-N 1 2 312.244 4.138 20 0 DIADLO Cc1nc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)cc(C(C)C)[nH+]1 ZINC001158793426 1047798879 /nfs/dbraw/zinc/79/88/79/1047798879.db2.gz PCDPNFUWVVHEEY-SJLPKXTDSA-N 1 2 311.429 4.241 20 0 DIADLO Cc1cccc2c1cc[nH+]c2N1CCc2cc(F)c(F)cc2C1 ZINC001158807655 1047799667 /nfs/dbraw/zinc/79/96/67/1047799667.db2.gz NGBMAMWCUGOPDO-UHFFFAOYSA-N 1 2 310.347 4.384 20 0 DIADLO Cc1c(F)cc[nH+]c1N1CCC[C@@]2(CCc3c2cccc3F)C1 ZINC001158841532 1047801903 /nfs/dbraw/zinc/80/19/03/1047801903.db2.gz BOEPYCILZQXGQX-LJQANCHMSA-N 1 2 314.379 4.153 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@H](Cc1ccc(C)cc1)c1ccc(C)cc1 ZINC000552911556 1047804680 /nfs/dbraw/zinc/80/46/80/1047804680.db2.gz GOODATPFKIYSSH-OAQYLSRUSA-N 1 2 319.452 4.409 20 0 DIADLO O=C(CCNc1cc(-c2ccccc2)cc[nH+]1)c1ccccc1 ZINC001159022225 1047808044 /nfs/dbraw/zinc/80/80/44/1047808044.db2.gz WSMYZRNKVSMDLD-UHFFFAOYSA-N 1 2 302.377 4.434 20 0 DIADLO CC1(C)[C@H](Nc2cc[nH+]c3c(Cl)cccc23)[C@@H]2CCO[C@@H]21 ZINC000553076052 1047821149 /nfs/dbraw/zinc/82/11/49/1047821149.db2.gz BQOYTFBATUNCLD-XZJROXQQSA-N 1 2 302.805 4.114 20 0 DIADLO COc1ccc2[nH+]c(C)cc(OCc3ccc(C)nc3C)c2c1 ZINC000478927502 1047824949 /nfs/dbraw/zinc/82/49/49/1047824949.db2.gz LPHWOFGSIPCYSM-UHFFFAOYSA-N 1 2 308.381 4.143 20 0 DIADLO Clc1cccc2c(N[C@@H]3CCC[C@@H]4OCC[C@@H]43)cc[nH+]c12 ZINC000553148911 1047825541 /nfs/dbraw/zinc/82/55/41/1047825541.db2.gz KBDOWVJDKXBQJD-XFJVYGCCSA-N 1 2 302.805 4.258 20 0 DIADLO Nc1ccc(Nc2ccc(OCc3ccccc3F)cc2)c[nH+]1 ZINC001159282181 1047826741 /nfs/dbraw/zinc/82/67/41/1047826741.db2.gz QXXUQWLZAKLMFW-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO Fc1ccc2oc(Nc3cc([C@@H]4CCCC[NH2+]4)no3)cc2c1 ZINC001159312630 1047831538 /nfs/dbraw/zinc/83/15/38/1047831538.db2.gz DAPGQMAXZZJGOO-LBPRGKRZSA-N 1 2 301.321 4.118 20 0 DIADLO CCSc1cc[nH+]c(N[C@H]2CCc3ccc(OC)cc3C2)c1 ZINC001159364446 1047834862 /nfs/dbraw/zinc/83/48/62/1047834862.db2.gz FZEOOKNAYBYQCR-HNNXBMFYSA-N 1 2 314.454 4.172 20 0 DIADLO CCc1ccccc1-c1noc([C@H](CC(C)C)n2cc[nH+]c2)n1 ZINC000923806668 1047837676 /nfs/dbraw/zinc/83/76/76/1047837676.db2.gz FGKOHMKMXGFHEU-INIZCTEOSA-N 1 2 310.401 4.131 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1cccc(OCc2ccccn2)c1)c1ncco1 ZINC000924715788 1047837909 /nfs/dbraw/zinc/83/79/09/1047837909.db2.gz POWRUCVMOKGTNB-LSDHHAIUSA-N 1 2 323.396 4.060 20 0 DIADLO Cc1ccc(CSc2n[nH]c(C=Cc3ccccc3)n2)c(C)[nH+]1 ZINC000479202154 1047845790 /nfs/dbraw/zinc/84/57/90/1047845790.db2.gz OXHVDOBXXVVHOV-LUAWRHEFSA-N 1 2 322.437 4.279 20 0 DIADLO c1cc(-c2cccc(Nc3[nH+]cccc3N3CCCCC3)c2)n[nH]1 ZINC001174506614 1047870792 /nfs/dbraw/zinc/87/07/92/1047870792.db2.gz LGAJQGVGCXCKDQ-UHFFFAOYSA-N 1 2 319.412 4.206 20 0 DIADLO CCSc1cccc(C[N@@H+]2C[C@@H](C)O[C@@](C)(C(F)F)C2)c1 ZINC001182969345 1047871370 /nfs/dbraw/zinc/87/13/70/1047871370.db2.gz HKKIEIIRKKRKHY-MLGOLLRUSA-N 1 2 315.429 4.043 20 0 DIADLO CCSc1cccc(C[N@H+]2C[C@@H](C)O[C@@](C)(C(F)F)C2)c1 ZINC001182969345 1047871378 /nfs/dbraw/zinc/87/13/78/1047871378.db2.gz HKKIEIIRKKRKHY-MLGOLLRUSA-N 1 2 315.429 4.043 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2Cc2cccc(C(F)(F)F)c2)[nH+]c1C ZINC001197711572 1047874033 /nfs/dbraw/zinc/87/40/33/1047874033.db2.gz WBQAOQWPTAUDSV-HNNXBMFYSA-N 1 2 323.362 4.382 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2cc(F)ccc2N)c[nH+]1 ZINC001159591502 1047875205 /nfs/dbraw/zinc/87/52/05/1047875205.db2.gz OHAKHFCEUIUKJA-UHFFFAOYSA-N 1 2 322.387 4.183 20 0 DIADLO c1cc2cccc(CNc3cc(-c4ccccc4)cc[nH+]3)n2n1 ZINC001159613825 1047881202 /nfs/dbraw/zinc/88/12/02/1047881202.db2.gz YYVMVSANUDKPLB-UHFFFAOYSA-N 1 2 300.365 4.008 20 0 DIADLO Cn1ccc2c1cccc2Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523536 1047884371 /nfs/dbraw/zinc/88/43/71/1047884371.db2.gz NGIFWZGEZLSVJZ-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO Fc1c(Cl)nccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523634 1047884958 /nfs/dbraw/zinc/88/49/58/1047884958.db2.gz SHTXFWSJCIQVRB-UHFFFAOYSA-N 1 2 306.772 4.003 20 0 DIADLO CC(=O)c1sccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523378 1047885148 /nfs/dbraw/zinc/88/51/48/1047885148.db2.gz ZTSPUWMBXPYDHE-UHFFFAOYSA-N 1 2 301.415 4.080 20 0 DIADLO Cc1c(Cl)ccc(N)c1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523390 1047885770 /nfs/dbraw/zinc/88/57/70/1047885770.db2.gz KUUGEYKETJPFRH-UHFFFAOYSA-N 1 2 316.836 4.360 20 0 DIADLO O[C@H]1CCCc2ccc(Nc3ccc(N4CCCCC4)[nH+]c3)cc21 ZINC001174522777 1047885822 /nfs/dbraw/zinc/88/58/22/1047885822.db2.gz BRMSGNOMBNPCEX-IBGZPJMESA-N 1 2 323.440 4.185 20 0 DIADLO Cc1cc(C)c(Nc2ccc(N3CCCCC3)[nH+]c2)c(C)c1N ZINC001174525148 1047889028 /nfs/dbraw/zinc/88/90/28/1047889028.db2.gz YKXCFHFQPDYKAC-UHFFFAOYSA-N 1 2 310.445 4.323 20 0 DIADLO Nc1cc(Cl)cc(F)c1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC001174523834 1047889054 /nfs/dbraw/zinc/88/90/54/1047889054.db2.gz ULFYHFMJHUTGOX-UHFFFAOYSA-N 1 2 320.799 4.190 20 0 DIADLO Cc1[nH+]cc(CN(Cc2ccccc2)[C@@H](C)c2ccccc2)n1C ZINC000667495348 1047894346 /nfs/dbraw/zinc/89/43/46/1047894346.db2.gz FOVDIMGQZTXSJW-KRWDZBQOSA-N 1 2 319.452 4.492 20 0 DIADLO Cc1[nH+]cc(CN([C@H](C)c2ccc(Cl)cc2)C2CC2)n1C ZINC000667497712 1047908249 /nfs/dbraw/zinc/90/82/49/1047908249.db2.gz LZKCZSBSFLZFOZ-GFCCVEGCSA-N 1 2 303.837 4.108 20 0 DIADLO Cc1ccc(NC(=S)Nc2ccccc2-n2cc[nH+]c2)c(C)c1 ZINC001197960047 1047908896 /nfs/dbraw/zinc/90/88/96/1047908896.db2.gz XLPFBMOPFYOVDK-UHFFFAOYSA-N 1 2 322.437 4.298 20 0 DIADLO C[C@@H](c1ccccc1Cl)N(Cc1c[nH+]c2n1CCC2)C1CC1 ZINC000667497564 1047909570 /nfs/dbraw/zinc/90/95/70/1047909570.db2.gz GVSHTEUTIGHCHJ-ZDUSSCGKSA-N 1 2 315.848 4.208 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1ccnn1CC1CC1 ZINC000667499811 1047911343 /nfs/dbraw/zinc/91/13/43/1047911343.db2.gz VTSGSGGLBGDUFE-CYBMUJFWSA-N 1 2 303.837 4.140 20 0 DIADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1ccnn1CC1CC1 ZINC000667499811 1047911347 /nfs/dbraw/zinc/91/13/47/1047911347.db2.gz VTSGSGGLBGDUFE-CYBMUJFWSA-N 1 2 303.837 4.140 20 0 DIADLO CCC[N@H+](Cc1nc(Cl)cs1)Cc1ccc(OC)cc1 ZINC001183326422 1047920805 /nfs/dbraw/zinc/92/08/05/1047920805.db2.gz WAZCVLPFWZGKQH-UHFFFAOYSA-N 1 2 310.850 4.217 20 0 DIADLO CCC[N@@H+](Cc1nc(Cl)cs1)Cc1ccc(OC)cc1 ZINC001183326422 1047920816 /nfs/dbraw/zinc/92/08/16/1047920816.db2.gz WAZCVLPFWZGKQH-UHFFFAOYSA-N 1 2 310.850 4.217 20 0 DIADLO CCn1cnc2c1CC[N@H+](Cc1ccc(C(C)(C)CC)cc1)C2 ZINC001198084854 1047923421 /nfs/dbraw/zinc/92/34/21/1047923421.db2.gz MBXLDECFLJRGAS-UHFFFAOYSA-N 1 2 311.473 4.149 20 0 DIADLO CCn1cnc2c1CC[N@@H+](Cc1ccc(C(C)(C)CC)cc1)C2 ZINC001198084854 1047923428 /nfs/dbraw/zinc/92/34/28/1047923428.db2.gz MBXLDECFLJRGAS-UHFFFAOYSA-N 1 2 311.473 4.149 20 0 DIADLO CCC[N@H+](Cc1ccccc1F)[C@@H](C(=O)OC(C)(C)C)C1CC1 ZINC001174614751 1047926562 /nfs/dbraw/zinc/92/65/62/1047926562.db2.gz KEZNTEUBQDQDOB-QGZVFWFLSA-N 1 2 321.436 4.158 20 0 DIADLO CCC[N@@H+](Cc1ccccc1F)[C@@H](C(=O)OC(C)(C)C)C1CC1 ZINC001174614751 1047926576 /nfs/dbraw/zinc/92/65/76/1047926576.db2.gz KEZNTEUBQDQDOB-QGZVFWFLSA-N 1 2 321.436 4.158 20 0 DIADLO CC[C@H](c1ccc(Cl)cc1)[NH+]1CCN(CC(C)(F)F)CC1 ZINC001198130416 1047927051 /nfs/dbraw/zinc/92/70/51/1047927051.db2.gz ICLZGSGBLHFKQK-OAHLLOKOSA-N 1 2 316.823 4.064 20 0 DIADLO CCSCc1ccc[nH+]c1N[C@H](C)CCc1ccc(O)cc1 ZINC001183491069 1047928872 /nfs/dbraw/zinc/92/88/72/1047928872.db2.gz MXMYIPFMAJCOFU-CQSZACIVSA-N 1 2 316.470 4.474 20 0 DIADLO Clc1ccc(OCC2CC2)c(CSCCn2cc[nH+]c2)c1 ZINC000479606317 1047938547 /nfs/dbraw/zinc/93/85/47/1047938547.db2.gz PKDNCIULVGBGHN-UHFFFAOYSA-N 1 2 322.861 4.259 20 0 DIADLO COc1ccc[nH+]c1NCc1cc(-c2cccc(Cl)c2)no1 ZINC001159882755 1047940096 /nfs/dbraw/zinc/94/00/96/1047940096.db2.gz NXYDEEFUDQZOGY-UHFFFAOYSA-N 1 2 315.760 4.011 20 0 DIADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cccc(OC3CC3)c2F)on1 ZINC000667532426 1047946344 /nfs/dbraw/zinc/94/63/44/1047946344.db2.gz MNHQBWRAQKAYHN-HNNXBMFYSA-N 1 2 316.376 4.000 20 0 DIADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cccc(OC3CC3)c2F)on1 ZINC000667532426 1047946362 /nfs/dbraw/zinc/94/63/62/1047946362.db2.gz MNHQBWRAQKAYHN-HNNXBMFYSA-N 1 2 316.376 4.000 20 0 DIADLO CC(C)CCOC1CC[NH+](Cc2ccc(F)c(F)c2F)CC1 ZINC000667533657 1047947946 /nfs/dbraw/zinc/94/79/46/1047947946.db2.gz ZILKMMNUYDUOQC-UHFFFAOYSA-N 1 2 315.379 4.131 20 0 DIADLO FC(F)c1ccc(Nc2ccccc2C[NH+]2CCOCC2)cc1 ZINC001174713000 1047950244 /nfs/dbraw/zinc/95/02/44/1047950244.db2.gz OAWGCJLHZRIPBA-UHFFFAOYSA-N 1 2 318.367 4.200 20 0 DIADLO FC(F)(F)c1cncc(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001174740881 1047960593 /nfs/dbraw/zinc/96/05/93/1047960593.db2.gz ADXZFIWBKZRZPJ-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(c3)NCCO4)ccc21 ZINC001159968181 1047960828 /nfs/dbraw/zinc/96/08/28/1047960828.db2.gz CJHDYFPVHOLPTM-UHFFFAOYSA-N 1 2 308.385 4.165 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)[C@@H]2CC[N@@H+]2Cc2ccccc2)cc1 ZINC001183745277 1047962533 /nfs/dbraw/zinc/96/25/33/1047962533.db2.gz QZCWTAIVCNTODM-UZLBHIALSA-N 1 2 322.452 4.413 20 0 DIADLO CC[C@@H](C)c1ccc(NC(=O)[C@@H]2CC[N@H+]2Cc2ccccc2)cc1 ZINC001183745277 1047962549 /nfs/dbraw/zinc/96/25/49/1047962549.db2.gz QZCWTAIVCNTODM-UZLBHIALSA-N 1 2 322.452 4.413 20 0 DIADLO CCc1cccc(CC)c1NC(=O)[C@H]1CC[N@@H+]1Cc1ccccc1 ZINC001183750650 1047962736 /nfs/dbraw/zinc/96/27/36/1047962736.db2.gz FTXMTUUPELPABN-LJQANCHMSA-N 1 2 322.452 4.024 20 0 DIADLO CCc1cccc(CC)c1NC(=O)[C@H]1CC[N@H+]1Cc1ccccc1 ZINC001183750650 1047962749 /nfs/dbraw/zinc/96/27/49/1047962749.db2.gz FTXMTUUPELPABN-LJQANCHMSA-N 1 2 322.452 4.024 20 0 DIADLO FC(F)(F)c1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1 ZINC001174769181 1047963958 /nfs/dbraw/zinc/96/39/58/1047963958.db2.gz FWSWCPFIEAASBC-UHFFFAOYSA-N 1 2 307.319 4.444 20 0 DIADLO CCCCCC[N@@H+](Cc1cc2n(n1)CCC2)Cc1ccco1 ZINC001198517048 1047971272 /nfs/dbraw/zinc/97/12/72/1047971272.db2.gz IKXMPLSFQOFNFP-UHFFFAOYSA-N 1 2 301.434 4.005 20 0 DIADLO CCCCCC[N@H+](Cc1cc2n(n1)CCC2)Cc1ccco1 ZINC001198517048 1047971276 /nfs/dbraw/zinc/97/12/76/1047971276.db2.gz IKXMPLSFQOFNFP-UHFFFAOYSA-N 1 2 301.434 4.005 20 0 DIADLO CNc1ccc(Nc2ccc(NC(=O)OC(C)(C)C)cc2)c[nH+]1 ZINC001160027534 1047974838 /nfs/dbraw/zinc/97/48/38/1047974838.db2.gz DYSPDDWFMZHIJR-UHFFFAOYSA-N 1 2 314.389 4.214 20 0 DIADLO CC[N@H+](Cc1cn(C2CCC2)nn1)[C@H](C)c1cc2ccccc2o1 ZINC000667554144 1047975211 /nfs/dbraw/zinc/97/52/11/1047975211.db2.gz KRPRYRANRQFWIC-CQSZACIVSA-N 1 2 324.428 4.332 20 0 DIADLO CC[N@@H+](Cc1cn(C2CCC2)nn1)[C@H](C)c1cc2ccccc2o1 ZINC000667554144 1047975218 /nfs/dbraw/zinc/97/52/18/1047975218.db2.gz KRPRYRANRQFWIC-CQSZACIVSA-N 1 2 324.428 4.332 20 0 DIADLO CCc1nc(C[N@@H+](C)[C@H](CC)c2ccccc2OC)cs1 ZINC000553993329 1047979761 /nfs/dbraw/zinc/97/97/61/1047979761.db2.gz UVDOBKIWIKABCF-OAHLLOKOSA-N 1 2 304.459 4.297 20 0 DIADLO CCc1nc(C[N@H+](C)[C@H](CC)c2ccccc2OC)cs1 ZINC000553993329 1047979768 /nfs/dbraw/zinc/97/97/68/1047979768.db2.gz UVDOBKIWIKABCF-OAHLLOKOSA-N 1 2 304.459 4.297 20 0 DIADLO Cc1ccc2c(c1Br)C[N@H+](CCSC(C)C)C2 ZINC001174836869 1047988195 /nfs/dbraw/zinc/98/81/95/1047988195.db2.gz XUOLXZBMMJPDEN-UHFFFAOYSA-N 1 2 314.292 4.215 20 0 DIADLO Cc1ccc2c(c1Br)C[N@@H+](CCSC(C)C)C2 ZINC001174836869 1047988205 /nfs/dbraw/zinc/98/82/05/1047988205.db2.gz XUOLXZBMMJPDEN-UHFFFAOYSA-N 1 2 314.292 4.215 20 0 DIADLO CC(C)CCCC[NH2+][C@@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001184034313 1047993862 /nfs/dbraw/zinc/99/38/62/1047993862.db2.gz ARISRGVEUCOKOW-SFHVURJKSA-N 1 2 319.489 4.355 20 0 DIADLO CCOC(=O)[C@@H](c1ccccc1)[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000554172170 1048026996 /nfs/dbraw/zinc/02/69/96/1048026996.db2.gz UVMFDZBJIFXKNC-NVXWUHKLSA-N 1 2 315.438 4.189 20 0 DIADLO CCOC(=O)[C@@H](c1ccccc1)[N@H+]1CCC[C@@H]1c1cccs1 ZINC000554172170 1048027006 /nfs/dbraw/zinc/02/70/06/1048027006.db2.gz UVMFDZBJIFXKNC-NVXWUHKLSA-N 1 2 315.438 4.189 20 0 DIADLO Nc1c(Cl)cccc1C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC001199068592 1048028284 /nfs/dbraw/zinc/02/82/84/1048028284.db2.gz MXWCMHRFIGFSHK-SFHVURJKSA-N 1 2 312.800 4.394 20 0 DIADLO Cc1cc(Nc2ccc(N3CCOCC3)[nH+]c2)ccc1C(C)C ZINC001174976164 1048036496 /nfs/dbraw/zinc/03/64/96/1048036496.db2.gz MHFPSTUHJXPINX-UHFFFAOYSA-N 1 2 311.429 4.094 20 0 DIADLO C[C@]12C[C@@H]3C[C@](C(=O)Nc4ccn5cc[nH+]c5c4)(C1)C[C@@](C)(C3)C2 ZINC001184493887 1048041827 /nfs/dbraw/zinc/04/18/27/1048041827.db2.gz ANCYNBTWZLXHEM-UFUCFOROSA-N 1 2 323.440 4.269 20 0 DIADLO COC(=O)c1ccc(CNc2[nH+]c3ccccc3n2C(C)C)cc1 ZINC001184463068 1048042684 /nfs/dbraw/zinc/04/26/84/1048042684.db2.gz UUMQHAMDLIWQNE-UHFFFAOYSA-N 1 2 323.396 4.016 20 0 DIADLO Cc1cccc2c(C)cc(N[C@@](C)(CO)c3ccccc3)[nH+]c12 ZINC001160437135 1048049411 /nfs/dbraw/zinc/04/94/11/1048049411.db2.gz YKWTWNSCTPBDBB-FQEVSTJZSA-N 1 2 306.409 4.171 20 0 DIADLO C[C@@](CO)(Nc1cc(-c2ccccc2)cc[nH+]1)c1ccccc1 ZINC001160434399 1048049992 /nfs/dbraw/zinc/04/99/92/1048049992.db2.gz GKVONMAQKURBST-FQEVSTJZSA-N 1 2 304.393 4.068 20 0 DIADLO Fc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)c(F)c1F ZINC001174968152 1048055777 /nfs/dbraw/zinc/05/57/77/1048055777.db2.gz BPOWAEYFZVOUNA-UHFFFAOYSA-N 1 2 303.287 4.092 20 0 DIADLO Cc1ccc(Nc2ccc[nH+]c2N2CCOCC2)c2ccccc12 ZINC001174989038 1048056484 /nfs/dbraw/zinc/05/64/84/1048056484.db2.gz ZGXQKABNCDRJLK-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO COCc1cc[nH+]c(N[C@H](c2ccccc2)c2ccc(O)cc2)c1 ZINC001160495573 1048057530 /nfs/dbraw/zinc/05/75/30/1048057530.db2.gz VQAPPDLMNJZBSF-HXUWFJFHSA-N 1 2 320.392 4.135 20 0 DIADLO COc1cc(C)c[nH+]c1N[C@H](c1ccccc1)c1ccc(O)cc1 ZINC001160494547 1048058825 /nfs/dbraw/zinc/05/88/25/1048058825.db2.gz BVZMWMLVKWFQCC-LJQANCHMSA-N 1 2 320.392 4.306 20 0 DIADLO Cc1nc(N[C@H](c2ccccc2)c2ccc(O)cc2)c(C)c(C)[nH+]1 ZINC001160497668 1048059183 /nfs/dbraw/zinc/05/91/83/1048059183.db2.gz KUNPYGMQOFZWOM-LJQANCHMSA-N 1 2 319.408 4.309 20 0 DIADLO Cc1cc(C)c(NC(=O)C[C@H]2CCc3ccccc3C2)c(C)[nH+]1 ZINC000480125809 1048061054 /nfs/dbraw/zinc/06/10/54/1048061054.db2.gz QSOVHKOAIPDFPR-INIZCTEOSA-N 1 2 308.425 4.141 20 0 DIADLO Nc1cc(F)c(Cl)nc1NC(=[NH2+])c1cccc2ccccc21 ZINC001160505982 1048061509 /nfs/dbraw/zinc/06/15/09/1048061509.db2.gz ZVSMOSLDFJCQAT-UHFFFAOYSA-N 1 2 314.751 4.047 20 0 DIADLO Fc1cc(F)cc(CCNc2[nH+]cnc3[nH]c4ccccc4c32)c1 ZINC001160570252 1048067345 /nfs/dbraw/zinc/06/73/45/1048067345.db2.gz SINMSZAKLGOGNO-UHFFFAOYSA-N 1 2 324.334 4.044 20 0 DIADLO Nc1ccc[nH+]c1Nc1ccc(OCc2ccccc2)c(F)c1 ZINC001175017289 1048073586 /nfs/dbraw/zinc/07/35/86/1048073586.db2.gz HRGGTAOBOVKMMD-UHFFFAOYSA-N 1 2 309.344 4.126 20 0 DIADLO Cc1cc(Cl)c(C)c(N[C@@H](C)c2cnc3c(C)cccn23)[nH+]1 ZINC001160686471 1048077765 /nfs/dbraw/zinc/07/77/65/1048077765.db2.gz ICEOIAYILYKGLH-ZDUSSCGKSA-N 1 2 314.820 4.481 20 0 DIADLO Cc1cnc(N[C@@H](C)c2c[nH+]c3c(C)cccn23)c(Cl)c1 ZINC001160682940 1048078217 /nfs/dbraw/zinc/07/82/17/1048078217.db2.gz IAXZSNPIUDLBJI-LBPRGKRZSA-N 1 2 300.793 4.173 20 0 DIADLO Cc1ccc2ncnc(N[C@@H](C)c3c[nH+]c4c(C)cccn34)c2c1 ZINC001160683712 1048078500 /nfs/dbraw/zinc/07/85/00/1048078500.db2.gz PGQSHIKGPKQALA-AWEZNQCLSA-N 1 2 317.396 4.067 20 0 DIADLO CC[C@@H]1C[C@H](CNc2ccc([NH+]3CCCC3)cc2C)CCO1 ZINC001199591592 1048078661 /nfs/dbraw/zinc/07/86/61/1048078661.db2.gz FFPIWOKQLBTIEM-SJLPKXTDSA-N 1 2 302.462 4.212 20 0 DIADLO CC[C@@H]1C[C@H](C[NH2+]c2ccc(N3CCCC3)cc2C)CCO1 ZINC001199591592 1048078678 /nfs/dbraw/zinc/07/86/78/1048078678.db2.gz FFPIWOKQLBTIEM-SJLPKXTDSA-N 1 2 302.462 4.212 20 0 DIADLO Cc1cc(N[C@@H](C)c2cnc3c(C)cccn23)nc(C(C)C)[nH+]1 ZINC001160686431 1048079019 /nfs/dbraw/zinc/07/90/19/1048079019.db2.gz GOJQCSNBBOSBPY-AWEZNQCLSA-N 1 2 309.417 4.038 20 0 DIADLO C[C@H]([NH2+]Cc1ncoc1-c1ccccc1)c1ccc(Cl)cn1 ZINC000480194751 1048081452 /nfs/dbraw/zinc/08/14/52/1048081452.db2.gz LKRDHTUWDDPFQI-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO CC(C)Oc1ccccc1C[NH2+]Cc1ncc(C(C)C)s1 ZINC001199618177 1048081337 /nfs/dbraw/zinc/08/13/37/1048081337.db2.gz BNPWSPKUGXLKKJ-UHFFFAOYSA-N 1 2 304.459 4.344 20 0 DIADLO COc1cc2ccc(NCc3cc(C)[nH+]c(C)c3)cc2cc1OC ZINC001203195019 1048092115 /nfs/dbraw/zinc/09/21/15/1048092115.db2.gz VEZMQXGWPCMUAJ-UHFFFAOYSA-N 1 2 322.408 4.481 20 0 DIADLO Clc1ncc(Nc2cccc3[nH+]c[nH]c32)cc1Br ZINC001213027324 1048094442 /nfs/dbraw/zinc/09/44/42/1048094442.db2.gz UCZREHTUBRGDGJ-UHFFFAOYSA-N 1 2 323.581 4.117 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)Nc1cc(C)[nH+]c(C2CCC2)n1 ZINC001184892665 1048098477 /nfs/dbraw/zinc/09/84/77/1048098477.db2.gz INSQIJCFPQVEQR-GFCCVEGCSA-N 1 2 315.392 4.373 20 0 DIADLO Cc1cc(Nc2[nH+]cccc2N)ccc1OCc1ccccc1 ZINC001175031557 1048098881 /nfs/dbraw/zinc/09/88/81/1048098881.db2.gz WZTFQUYUHMUBHA-UHFFFAOYSA-N 1 2 305.381 4.295 20 0 DIADLO C[C@H](c1cccs1)N(C)c1nc2ccccc2n2c[nH+]cc12 ZINC001184906306 1048103271 /nfs/dbraw/zinc/10/32/71/1048103271.db2.gz YDMUWRDAASCKNI-GFCCVEGCSA-N 1 2 308.410 4.141 20 0 DIADLO COC(=O)C[C@H](c1cc[nH+]c(N[C@@H]2CCC(C)(C)C2)c1)C1CC1 ZINC001161034015 1048104971 /nfs/dbraw/zinc/10/49/71/1048104971.db2.gz XCCXVJFXIPCEGX-CVEARBPZSA-N 1 2 316.445 4.129 20 0 DIADLO Oc1ccc2c(cccc2Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001184964593 1048105619 /nfs/dbraw/zinc/10/56/19/1048105619.db2.gz PRVAYROODQLVGV-UHFFFAOYSA-N 1 2 305.381 4.284 20 0 DIADLO CC(=O)c1cc(Cl)ccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001184967495 1048107536 /nfs/dbraw/zinc/10/75/36/1048107536.db2.gz DRJLJMXKSVMVES-UHFFFAOYSA-N 1 2 315.804 4.281 20 0 DIADLO COc1cc(Cl)ccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001184967994 1048107585 /nfs/dbraw/zinc/10/75/85/1048107585.db2.gz IYVXCXAXFZHUBW-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO c1c[nH+]c(N2CCCC2)c(Nc2ccc(C3CCOCC3)cc2)c1 ZINC001184969376 1048107678 /nfs/dbraw/zinc/10/76/78/1048107678.db2.gz ZKSUADVJOYEFFH-UHFFFAOYSA-N 1 2 323.440 4.319 20 0 DIADLO Nc1cc(Cl)cc(Cl)c1Nc1ccc[nH+]c1N1CCCC1 ZINC001184968957 1048107733 /nfs/dbraw/zinc/10/77/33/1048107733.db2.gz RGCUUHGFOJPXTC-UHFFFAOYSA-N 1 2 323.227 4.314 20 0 DIADLO Clc1cccc(-n2nccc2Nc2cccc3[nH+]c[nH]c32)c1 ZINC001213029465 1048109319 /nfs/dbraw/zinc/10/93/19/1048109319.db2.gz MLAOEIXOYPKPMG-UHFFFAOYSA-N 1 2 309.760 4.146 20 0 DIADLO CCc1cc(NCc2ccc(-c3ccccc3)o2)nc(CC)[nH+]1 ZINC001184947893 1048111098 /nfs/dbraw/zinc/11/10/98/1048111098.db2.gz URQVBSIIZUYMDA-UHFFFAOYSA-N 1 2 307.397 4.474 20 0 DIADLO Cc1cnn(-c2cccc(C)c2)c1Nc1cccc2[nH+]c[nH]c21 ZINC001213030659 1048112659 /nfs/dbraw/zinc/11/26/59/1048112659.db2.gz LHNRCRRSMKTVLF-UHFFFAOYSA-N 1 2 303.369 4.109 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1ccsc1Cl ZINC000480299336 1048114470 /nfs/dbraw/zinc/11/44/70/1048114470.db2.gz CSFHVRRJIKICOU-UHFFFAOYSA-N 1 2 307.802 4.446 20 0 DIADLO COc1ccc(Nc2cccc3[nH+]c[nH]c32)cc1Br ZINC001213031499 1048117382 /nfs/dbraw/zinc/11/73/82/1048117382.db2.gz CLSBPFWBJCXEKV-UHFFFAOYSA-N 1 2 318.174 4.078 20 0 DIADLO Fc1cc(Br)c(Nc2cccc3[nH+]c[nH]c32)cc1F ZINC001213031723 1048119119 /nfs/dbraw/zinc/11/91/19/1048119119.db2.gz OHPJKFFYTYKRFH-UHFFFAOYSA-N 1 2 324.128 4.347 20 0 DIADLO Cc1[nH+]c2ccc(N)cc2n1-c1ccc(F)cc1C(F)(F)F ZINC001175103845 1048119196 /nfs/dbraw/zinc/11/91/96/1048119196.db2.gz XSARUQFAZUANBI-UHFFFAOYSA-N 1 2 309.266 4.074 20 0 DIADLO COCc1ccc(CNc2[nH+]c3ccc(OC)cc3cc2C)cc1 ZINC001161326216 1048121700 /nfs/dbraw/zinc/12/17/00/1048121700.db2.gz ZAOJNLJHYWUTGW-UHFFFAOYSA-N 1 2 322.408 4.310 20 0 DIADLO Cc1cc([C@@H]([NH2+]Cc2nnc(C(C)(C)C)o2)C2CC2)ccc1F ZINC000776032031 1048122804 /nfs/dbraw/zinc/12/28/04/1048122804.db2.gz OGNLRONCTYDHTD-INIZCTEOSA-N 1 2 317.408 4.056 20 0 DIADLO Fc1ccc(Br)cc1Nc1cccc2[nH+]c[nH]c21 ZINC001213031943 1048123374 /nfs/dbraw/zinc/12/33/74/1048123374.db2.gz RPEXXEAALLCLRJ-UHFFFAOYSA-N 1 2 306.138 4.208 20 0 DIADLO COc1cccc(Nc2cccc3[nH+]c[nH]c32)c1Br ZINC001213032037 1048123535 /nfs/dbraw/zinc/12/35/35/1048123535.db2.gz VEKNUJPRPJXPIK-UHFFFAOYSA-N 1 2 318.174 4.078 20 0 DIADLO Fc1cc(Nc2ccc[nH+]c2N2CCCC2)c(F)cc1Cl ZINC001185044620 1048124108 /nfs/dbraw/zinc/12/41/08/1048124108.db2.gz WRNQCQLWAHLZSO-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO COc1cc(F)c(Cl)cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001185044594 1048124387 /nfs/dbraw/zinc/12/43/87/1048124387.db2.gz VCNXLZLVXLRHFM-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO CC(C)Oc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1F ZINC001185044610 1048124525 /nfs/dbraw/zinc/12/45/25/1048124525.db2.gz VZKIBUUQFCQGBT-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO Cc1ccccc1[C@H](NC(=O)c1cccc2[nH+]ccn21)C(C)(C)C ZINC001126881794 1048125406 /nfs/dbraw/zinc/12/54/06/1048125406.db2.gz JPSRHGMIWJQJKF-SFHVURJKSA-N 1 2 321.424 4.160 20 0 DIADLO Nc1ccc(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)c(F)n1 ZINC001203609340 1048133223 /nfs/dbraw/zinc/13/32/23/1048133223.db2.gz RJZLOAZAFMDBEA-UHFFFAOYSA-N 1 2 322.265 4.114 20 0 DIADLO c1[nH]c2c(cccc2Nc2ccc(Cc3cccnc3)cc2)[nH+]1 ZINC001213033382 1048135226 /nfs/dbraw/zinc/13/52/26/1048135226.db2.gz CZIJKZDAGIGPDL-UHFFFAOYSA-N 1 2 300.365 4.292 20 0 DIADLO Fc1cc(Nc2cccc3[nH+]c[nH]c32)cc(Br)c1F ZINC001213033441 1048137198 /nfs/dbraw/zinc/13/71/98/1048137198.db2.gz GOIHYTQBYRIKIZ-UHFFFAOYSA-N 1 2 324.128 4.347 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1nccc2cccc(Cl)c21 ZINC001161564661 1048138568 /nfs/dbraw/zinc/13/85/68/1048138568.db2.gz AAPXMSWTXSABEA-UHFFFAOYSA-N 1 2 300.793 4.278 20 0 DIADLO CC(C)n1c[nH+]cc1CNc1nccc2cc(F)c(Cl)cc21 ZINC001161570236 1048140796 /nfs/dbraw/zinc/14/07/96/1048140796.db2.gz XYEJXXXOFILLML-UHFFFAOYSA-N 1 2 318.783 4.417 20 0 DIADLO CSc1cc[nH+]c(NCC2(Cc3ccc(F)cc3)CC2)c1 ZINC001161623346 1048147102 /nfs/dbraw/zinc/14/71/02/1048147102.db2.gz ZUQPDWAHJJCVAJ-UHFFFAOYSA-N 1 2 302.418 4.377 20 0 DIADLO CC(C)Oc1c(F)cc(Nc2cccc3[nH+]c[nH]c32)cc1F ZINC001213034359 1048151204 /nfs/dbraw/zinc/15/12/04/1048151204.db2.gz FOABUDMNDJETTP-UHFFFAOYSA-N 1 2 303.312 4.372 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@@H+]2Cc3ccccc3[C@@H]2C)c(C)c1 ZINC000554678696 1048153044 /nfs/dbraw/zinc/15/30/44/1048153044.db2.gz LBXUNXKGQPMBKV-JKSUJKDBSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1ccc(NC(=O)[C@@H](C)[N@H+]2Cc3ccccc3[C@@H]2C)c(C)c1 ZINC000554678696 1048153052 /nfs/dbraw/zinc/15/30/52/1048153052.db2.gz LBXUNXKGQPMBKV-JKSUJKDBSA-N 1 2 308.425 4.207 20 0 DIADLO Cc1ccc2cc(C[N@@H+]3CCO[C@H](c4ccsc4)C3)[nH]c2c1 ZINC000667680505 1048157065 /nfs/dbraw/zinc/15/70/65/1048157065.db2.gz IQDVUHCWARLAOZ-SFHVURJKSA-N 1 2 312.438 4.111 20 0 DIADLO Cc1ccc2cc(C[N@H+]3CCO[C@H](c4ccsc4)C3)[nH]c2c1 ZINC000667680505 1048157069 /nfs/dbraw/zinc/15/70/69/1048157069.db2.gz IQDVUHCWARLAOZ-SFHVURJKSA-N 1 2 312.438 4.111 20 0 DIADLO Cc1ccc(C(=O)CC[NH+](Cc2ccco2)Cc2ccco2)cc1 ZINC000480499001 1048159911 /nfs/dbraw/zinc/15/99/11/1048159911.db2.gz IDPXGIGDPMRAJU-UHFFFAOYSA-N 1 2 323.392 4.456 20 0 DIADLO COC[C@H](Nc1cc(SCc2ccccc2)cc[nH+]1)C1CC1 ZINC001161727302 1048162242 /nfs/dbraw/zinc/16/22/42/1048162242.db2.gz ZNDCZECGNYGYRP-KRWDZBQOSA-N 1 2 314.454 4.211 20 0 DIADLO Cc1cc(NCCOC2CCCCCC2)nc(C2CCC2)[nH+]1 ZINC001185395070 1048170294 /nfs/dbraw/zinc/17/02/94/1048170294.db2.gz YNBGJICIBMGHPZ-UHFFFAOYSA-N 1 2 303.450 4.204 20 0 DIADLO FC(F)(F)CCNc1ccc2c(c1)[nH+]cn2-c1ccccc1 ZINC001161824300 1048179205 /nfs/dbraw/zinc/17/92/05/1048179205.db2.gz NUGLVNOFIOLURA-UHFFFAOYSA-N 1 2 305.303 4.390 20 0 DIADLO CCSc1cc[nH+]c(N[C@H](c2ccnc(F)c2)C2CC2)c1 ZINC001161847584 1048186661 /nfs/dbraw/zinc/18/66/61/1048186661.db2.gz RYBSBRVAOPOAGU-INIZCTEOSA-N 1 2 303.406 4.291 20 0 DIADLO CCSc1cc[nH+]c(N[C@@H](c2ccnc(F)c2)C2CC2)c1 ZINC001161847585 1048186858 /nfs/dbraw/zinc/18/68/58/1048186858.db2.gz RYBSBRVAOPOAGU-MRXNPFEDSA-N 1 2 303.406 4.291 20 0 DIADLO CSCc1cc[nH+]c(N[C@H](c2ccnc(F)c2)C2CC2)c1 ZINC001161846936 1048187333 /nfs/dbraw/zinc/18/73/33/1048187333.db2.gz FIDHOCMTADWHNZ-INIZCTEOSA-N 1 2 303.406 4.042 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(S[C@H](C)c3ccccc3OC)c12 ZINC001185497736 1048189155 /nfs/dbraw/zinc/18/91/55/1048189155.db2.gz JHDNRTMUMDVEGQ-LLVKDONJSA-N 1 2 313.426 4.382 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cccc(O[C@@H]4CCCCO4)c3)ccc21 ZINC001175186485 1048190043 /nfs/dbraw/zinc/19/00/43/1048190043.db2.gz HYJQRUSWZYEZPY-LJQANCHMSA-N 1 2 323.396 4.222 20 0 DIADLO CCc1cc(N2CC[C@H](c3ccccc3)[C@H](C)C2)nc(CC)[nH+]1 ZINC001185519089 1048190986 /nfs/dbraw/zinc/19/09/86/1048190986.db2.gz UIXYNPJUNXGEBD-QAPCUYQASA-N 1 2 309.457 4.231 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc4cnn(C(C)C)c4c3)n2c1 ZINC001201080529 1048196197 /nfs/dbraw/zinc/19/61/97/1048196197.db2.gz WZIIUIZFNBHDSN-UHFFFAOYSA-N 1 2 319.412 4.185 20 0 DIADLO CC(C)c1cc(N(C)Cc2ccc(F)cc2)nc(C(C)C)[nH+]1 ZINC001161936298 1048196688 /nfs/dbraw/zinc/19/66/88/1048196688.db2.gz XTBPRYDOYOSQBR-UHFFFAOYSA-N 1 2 301.409 4.499 20 0 DIADLO CCOc1ccc(OC)cc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001175212646 1048197400 /nfs/dbraw/zinc/19/74/00/1048197400.db2.gz CBIYHOJNXQPYNH-UHFFFAOYSA-N 1 2 309.369 4.023 20 0 DIADLO c1cn(Cc2ccc(N[C@H](c3ccccc3)C3CC3)cc2)c[nH+]1 ZINC001161961087 1048201363 /nfs/dbraw/zinc/20/13/63/1048201363.db2.gz DCWQDKWEVOYCMM-HXUWFJFHSA-N 1 2 303.409 4.495 20 0 DIADLO c1ccc2oc(CNc3cc4c5c(c3)CCC[NH+]5CCC4)nc2c1 ZINC001161972027 1048203672 /nfs/dbraw/zinc/20/36/72/1048203672.db2.gz HSOIPCDKAALFJF-UHFFFAOYSA-N 1 2 319.408 4.139 20 0 DIADLO CCOc1cccc(F)c1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001175224124 1048204402 /nfs/dbraw/zinc/20/44/02/1048204402.db2.gz RIXKLPJGWXIECE-UHFFFAOYSA-N 1 2 305.740 4.269 20 0 DIADLO C[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccc(Cl)cn1 ZINC000480662076 1048205544 /nfs/dbraw/zinc/20/55/44/1048205544.db2.gz LPKXNJXJFKWIPO-ZDUSSCGKSA-N 1 2 316.836 4.293 20 0 DIADLO CCCC[C@H](CCC)Nc1[nH+]cnc2c1cnn2C(C)(C)C ZINC001185620181 1048210273 /nfs/dbraw/zinc/21/02/73/1048210273.db2.gz FMMPXBIOQASXHN-ZDUSSCGKSA-N 1 2 303.454 4.352 20 0 DIADLO CCOc1cccc(Nc2cccc(Cn3cc[nH+]c3)c2)c1F ZINC001175236531 1048210866 /nfs/dbraw/zinc/21/08/66/1048210866.db2.gz HMSISIFCQFFJOT-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO Cc1cn2c(cccc2NC(=S)Nc2cc(C)cc(C)c2)[nH+]1 ZINC001201194369 1048214554 /nfs/dbraw/zinc/21/45/54/1048214554.db2.gz MHWSQTWLFXBPDM-UHFFFAOYSA-N 1 2 310.426 4.068 20 0 DIADLO Cc1cc(NCCCOc2ccccc2F)nc(C2CCC2)[nH+]1 ZINC001162032782 1048217121 /nfs/dbraw/zinc/21/71/21/1048217121.db2.gz WYPPGLIZFCCTEW-UHFFFAOYSA-N 1 2 315.392 4.073 20 0 DIADLO FC(F)(F)c1cncc(CCCNc2c[nH+]c3c(c2)CCC3)c1 ZINC001162043523 1048219897 /nfs/dbraw/zinc/21/98/97/1048219897.db2.gz BTYRRKCXTOQCKO-UHFFFAOYSA-N 1 2 321.346 4.029 20 0 DIADLO Cc1cc(N(CCc2cccc(F)c2)C2CC2)nc(C2CC2)[nH+]1 ZINC001185785256 1048226235 /nfs/dbraw/zinc/22/62/35/1048226235.db2.gz OKPYLWNLNJGLDN-UHFFFAOYSA-N 1 2 311.404 4.013 20 0 DIADLO CC(C)(C)OC(=O)n1ccc2cc(Nc3ccc(N)[nH+]c3)ccc21 ZINC001201287030 1048227861 /nfs/dbraw/zinc/22/78/61/1048227861.db2.gz PBSIBGJFTSUTEZ-UHFFFAOYSA-N 1 2 324.384 4.145 20 0 DIADLO Fc1ccc(CNc2ccc(-n3cc[nH+]c3)c(F)c2)cc1Cl ZINC001201257197 1048228086 /nfs/dbraw/zinc/22/80/86/1048228086.db2.gz MARXXJYMXWRQTO-UHFFFAOYSA-N 1 2 319.742 4.416 20 0 DIADLO Cc1cccc(N)c1-c1c(C)cccc1Nc1ccc(N)[nH+]c1 ZINC001201292500 1048228909 /nfs/dbraw/zinc/22/89/09/1048228909.db2.gz PBIZVYJJRKQEBZ-UHFFFAOYSA-N 1 2 304.397 4.273 20 0 DIADLO Nc1ccc(Nc2ccc(N3CCCC3)c(C(F)(F)F)c2)c[nH+]1 ZINC001201287078 1048229019 /nfs/dbraw/zinc/22/90/19/1048229019.db2.gz RWQOSZRBXUIIKT-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO COc1cc[nH+]c(C(C)(C)CNc2nccc3ccsc32)c1 ZINC001162129612 1048229120 /nfs/dbraw/zinc/22/91/20/1048229120.db2.gz KXAIUNBVEQRDEV-UHFFFAOYSA-N 1 2 313.426 4.090 20 0 DIADLO CC(=O)c1sc(-c2ccccc2)cc1Nc1ccc(N)[nH+]c1 ZINC001201275969 1048230284 /nfs/dbraw/zinc/23/02/84/1048230284.db2.gz NOJMQSNHJSGTSG-UHFFFAOYSA-N 1 2 309.394 4.339 20 0 DIADLO CCc1coc(CNc2ccc3[nH]c(-c4ccccc4)[nH+]c3c2)n1 ZINC001162141200 1048230546 /nfs/dbraw/zinc/23/05/46/1048230546.db2.gz WNTVFQXMBDQLKB-UHFFFAOYSA-N 1 2 318.380 4.392 20 0 DIADLO Cc1cc(N2CCC(C)(c3ccccc3)CC2)nc(C2CC2)[nH+]1 ZINC001185827460 1048230977 /nfs/dbraw/zinc/23/09/77/1048230977.db2.gz LZVZRSUNPOCKBY-UHFFFAOYSA-N 1 2 307.441 4.221 20 0 DIADLO Cc1ccc(Nc2ccc(N)[nH+]c2)c(Br)c1Cl ZINC001201295318 1048232751 /nfs/dbraw/zinc/23/27/51/1048232751.db2.gz OGZHZCNVGJTVPS-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO CC(C)c1cnc(C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)o1 ZINC000774940254 1048232760 /nfs/dbraw/zinc/23/27/60/1048232760.db2.gz WNNJKRGFXAXMQL-NSHDSACASA-N 1 2 310.344 4.250 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3ccc(Cl)c(F)c3)ccc21 ZINC001201308561 1048235188 /nfs/dbraw/zinc/23/51/88/1048235188.db2.gz JJCFWAXWGVTFBV-UHFFFAOYSA-N 1 2 304.796 4.474 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3ccc(Cl)c(F)c3)ccc21 ZINC001201308561 1048235177 /nfs/dbraw/zinc/23/51/77/1048235177.db2.gz JJCFWAXWGVTFBV-UHFFFAOYSA-N 1 2 304.796 4.474 20 0 DIADLO CCOc1cc(F)ccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001175291227 1048235886 /nfs/dbraw/zinc/23/58/86/1048235886.db2.gz OVGJWVDBDSCHLY-UHFFFAOYSA-N 1 2 311.360 4.213 20 0 DIADLO Clc1ccc(-c2cn3cc(NC4CSC4)ccc3[nH+]2)cc1 ZINC001168364098 1048238556 /nfs/dbraw/zinc/23/85/56/1048238556.db2.gz IBHOPNHGQKYSJK-UHFFFAOYSA-N 1 2 315.829 4.182 20 0 DIADLO Cc1ccccc1[C@H]1CCCN1c1nc(C)[nH+]c2c1CCCC2 ZINC001162211255 1048242126 /nfs/dbraw/zinc/24/21/26/1048242126.db2.gz RSRPUAIVFLWVOZ-LJQANCHMSA-N 1 2 307.441 4.314 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001175267680 1048246751 /nfs/dbraw/zinc/24/67/51/1048246751.db2.gz IPQJFSHJEYJHNI-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO C[C@H](c1ccccn1)[N@H+]1CCc2ccc(C(F)(F)F)cc2C1 ZINC001175267680 1048246757 /nfs/dbraw/zinc/24/67/57/1048246757.db2.gz IPQJFSHJEYJHNI-GFCCVEGCSA-N 1 2 306.331 4.220 20 0 DIADLO c1cn(-c2cccc(NCc3ccc4c(c3)CCCC4)c2)c[nH+]1 ZINC001201357087 1048247959 /nfs/dbraw/zinc/24/79/59/1048247959.db2.gz PSSQYXOIDRBEDX-UHFFFAOYSA-N 1 2 303.409 4.363 20 0 DIADLO CN(C)c1ccc(Nc2cc(Oc3ccccc3)ccc2N)c[nH+]1 ZINC001175344845 1048250253 /nfs/dbraw/zinc/25/02/53/1048250253.db2.gz JOPLKOJKOWPFSE-UHFFFAOYSA-N 1 2 320.396 4.266 20 0 DIADLO CN(C)c1ccc(Nc2cccc(CCc3ccccn3)c2)c[nH+]1 ZINC001175342528 1048250400 /nfs/dbraw/zinc/25/04/00/1048250400.db2.gz SJJHXBMFGUFDIO-UHFFFAOYSA-N 1 2 318.424 4.071 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(Nc3cccc(COC(C)C)c3)c12 ZINC001162250338 1048251939 /nfs/dbraw/zinc/25/19/39/1048251939.db2.gz BTRBSINPODIELO-UHFFFAOYSA-N 1 2 310.401 4.189 20 0 DIADLO Cc1nc2ccccc2cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175348693 1048252090 /nfs/dbraw/zinc/25/20/90/1048252090.db2.gz ISMZWNUOTYKWKJ-UHFFFAOYSA-N 1 2 304.397 4.282 20 0 DIADLO CN(C)c1ccc(Nc2cccc(Oc3cccnc3)c2)c[nH+]1 ZINC001175345778 1048252290 /nfs/dbraw/zinc/25/22/90/1048252290.db2.gz HNUAJAWRGVONSV-UHFFFAOYSA-N 1 2 306.369 4.079 20 0 DIADLO Cc1nc(C(F)(F)F)ccc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175348301 1048252897 /nfs/dbraw/zinc/25/28/97/1048252897.db2.gz DDFLZAOBVMEHAT-UHFFFAOYSA-N 1 2 322.334 4.148 20 0 DIADLO CCc1c[nH]c2nc[nH+]c(Nc3ccc(O[C@@H](C)CC)cc3)c12 ZINC001162258576 1048254445 /nfs/dbraw/zinc/25/44/45/1048254445.db2.gz NSMMKUQPRSZSAL-LBPRGKRZSA-N 1 2 310.401 4.441 20 0 DIADLO Clc1ccc2c(cc[nH+]c2NCc2cc3ccccn3n2)c1 ZINC001162284140 1048255730 /nfs/dbraw/zinc/25/57/30/1048255730.db2.gz OKNBYGYRJYKCEK-UHFFFAOYSA-N 1 2 308.772 4.148 20 0 DIADLO CC1(C)CN(c2nc3ccccc3n3c[nH+]cc23)CC(C)(C)C1 ZINC001186035317 1048256957 /nfs/dbraw/zinc/25/69/57/1048256957.db2.gz XGHKNYGTTQKLNS-UHFFFAOYSA-N 1 2 308.429 4.145 20 0 DIADLO COc1ccccc1C1(CNc2cc(C)[nH+]c(C3CC3)n2)CCC1 ZINC001186061415 1048262028 /nfs/dbraw/zinc/26/20/28/1048262028.db2.gz HZZYYJIXCFAVGD-UHFFFAOYSA-N 1 2 323.440 4.205 20 0 DIADLO Cc1nc(N2CCc3c(ccc(Cl)c3Cl)C2)c(C)c(C)[nH+]1 ZINC001162355498 1048265939 /nfs/dbraw/zinc/26/59/39/1048265939.db2.gz BBLACGBATFXOQC-UHFFFAOYSA-N 1 2 322.239 4.271 20 0 DIADLO COc1nc(C)cc(Nc2ccc([NH2+]CC3CCCC3)cc2)n1 ZINC001162361783 1048267462 /nfs/dbraw/zinc/26/74/62/1048267462.db2.gz ZXLOAKKILULUGS-UHFFFAOYSA-N 1 2 312.417 4.139 20 0 DIADLO Fc1cnc2cccc(Nc3ccc(N4CCCC4)[nH+]c3)c2c1 ZINC001175349870 1048270780 /nfs/dbraw/zinc/27/07/80/1048270780.db2.gz SXYHLXMWMWRIJY-UHFFFAOYSA-N 1 2 308.360 4.113 20 0 DIADLO Oc1cccc(C(F)(F)F)c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175350370 1048271044 /nfs/dbraw/zinc/27/10/44/1048271044.db2.gz WOLLZFQHGBQZQL-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO COc1cccc(Cl)c1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175351438 1048271457 /nfs/dbraw/zinc/27/14/57/1048271457.db2.gz LUWHJWUFOLQTOL-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO c1ccc(OCC2CC2)c(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001175351811 1048271696 /nfs/dbraw/zinc/27/16/96/1048271696.db2.gz CEMPLZUTARPHJO-UHFFFAOYSA-N 1 2 309.413 4.214 20 0 DIADLO Clc1cc2ncoc2cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001175349841 1048271878 /nfs/dbraw/zinc/27/18/78/1048271878.db2.gz RYORTOCYHFELFC-UHFFFAOYSA-N 1 2 314.776 4.220 20 0 DIADLO c1cncc(-c2cccc(Nc3ccc(N4CCCC4)[nH+]c3)c2)c1 ZINC001175349669 1048272069 /nfs/dbraw/zinc/27/20/69/1048272069.db2.gz BWOIOXWFZPNPAQ-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Fc1cc(F)c(Nc2ccc(N3CCCC3)[nH+]c2)cc1Cl ZINC001175350882 1048272309 /nfs/dbraw/zinc/27/23/09/1048272309.db2.gz IVOSIVRHBONLDF-UHFFFAOYSA-N 1 2 309.747 4.357 20 0 DIADLO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2nnc(C(C)(C)C)o2)c1 ZINC000774992183 1048278997 /nfs/dbraw/zinc/27/89/97/1048278997.db2.gz OLKKDXBSFGAIGO-ZDUSSCGKSA-N 1 2 317.433 4.005 20 0 DIADLO CCOC(=O)c1cc(Nc2ccc([NH2+]C(C)C)cc2)cnc1C ZINC001201489868 1048280471 /nfs/dbraw/zinc/28/04/71/1048280471.db2.gz VSWTXCJHLIJXNE-UHFFFAOYSA-N 1 2 313.401 4.131 20 0 DIADLO Cc1cccc2nc(CNc3cc(C(C)C)[nH+]c(C(C)C)n3)cn21 ZINC001162438532 1048280822 /nfs/dbraw/zinc/28/08/22/1048280822.db2.gz ZBVDWNVDUORWAT-UHFFFAOYSA-N 1 2 323.444 4.292 20 0 DIADLO Cc1cnn(-c2ccccn2)c1Nc1ccc([NH2+]C(C)C)cc1 ZINC001201492179 1048282090 /nfs/dbraw/zinc/28/20/90/1048282090.db2.gz WCEMZGXZVDTLGM-UHFFFAOYSA-N 1 2 307.401 4.140 20 0 DIADLO CC(C)[NH2+]c1ccc(Nc2c[nH]c(=O)c(Br)c2)cc1 ZINC001201490538 1048283017 /nfs/dbraw/zinc/28/30/17/1048283017.db2.gz GFDZIFGSFWCDRT-UHFFFAOYSA-N 1 2 322.206 4.114 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3ccc(-n4cccn4)cc3)ccc12 ZINC001175371220 1048283132 /nfs/dbraw/zinc/28/31/32/1048283132.db2.gz QGPVGFBZIBBTTG-UHFFFAOYSA-N 1 2 300.365 4.473 20 0 DIADLO COc1ccccc1-n1nccc1Nc1ccc([NH2+]C(C)C)cc1 ZINC001201491139 1048283358 /nfs/dbraw/zinc/28/33/58/1048283358.db2.gz NHYPCXQBBLNLKU-UHFFFAOYSA-N 1 2 322.412 4.445 20 0 DIADLO Cc1cc(Nc2ccc([NH2+]C(C)C)cc2)n(Cc2ccccn2)n1 ZINC001201491173 1048283533 /nfs/dbraw/zinc/28/35/33/1048283533.db2.gz NVQRRLASZZWOJC-UHFFFAOYSA-N 1 2 321.428 4.199 20 0 DIADLO c1cn(Cc2cccc(Nc3ccc4ncccc4c3)c2)c[nH+]1 ZINC001175376414 1048286556 /nfs/dbraw/zinc/28/65/56/1048286556.db2.gz XKIGRUCGHDCICF-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO CC[C@@H](C)C[N@@H+]1CCOC[C@@H]1c1csc(-c2ccccc2)n1 ZINC001201502993 1048290437 /nfs/dbraw/zinc/29/04/37/1048290437.db2.gz MVKWGHPYRYVYBB-RHSMWYFYSA-N 1 2 316.470 4.230 20 0 DIADLO CC[C@@H](C)C[N@H+]1CCOC[C@@H]1c1csc(-c2ccccc2)n1 ZINC001201502993 1048290453 /nfs/dbraw/zinc/29/04/53/1048290453.db2.gz MVKWGHPYRYVYBB-RHSMWYFYSA-N 1 2 316.470 4.230 20 0 DIADLO Cc1c(F)cc[nH+]c1NCCc1ccc(Oc2ccccc2)nc1 ZINC001162581478 1048308136 /nfs/dbraw/zinc/30/81/36/1048308136.db2.gz FKCMXMYTYNJRLZ-UHFFFAOYSA-N 1 2 323.371 4.371 20 0 DIADLO Cn1ncc2cccc(Nc3ccc([NH+]4CCCCC4)cc3)c21 ZINC001175443260 1048310070 /nfs/dbraw/zinc/31/00/70/1048310070.db2.gz NVNNZLOQIMVIOW-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO Cc1ccc(-c2cc[nH+]c(NCc3c(C)cc(C)[nH]c3=O)c2)cc1 ZINC001162600256 1048311480 /nfs/dbraw/zinc/31/14/80/1048311480.db2.gz ZCIZAFVPFHRYTQ-UHFFFAOYSA-N 1 2 319.408 4.387 20 0 DIADLO Cc1cc(NCCc2ccc(C(F)(F)F)nc2)ccc1[NH+](C)C ZINC001162616201 1048313424 /nfs/dbraw/zinc/31/34/24/1048313424.db2.gz LYIIYHFYTDEHGE-UHFFFAOYSA-N 1 2 323.362 4.129 20 0 DIADLO Cc1cc([NH2+]CCc2ccc(C(F)(F)F)nc2)ccc1N(C)C ZINC001162616201 1048313438 /nfs/dbraw/zinc/31/34/38/1048313438.db2.gz LYIIYHFYTDEHGE-UHFFFAOYSA-N 1 2 323.362 4.129 20 0 DIADLO C[S@@](=O)c1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1 ZINC001175475810 1048315767 /nfs/dbraw/zinc/31/57/67/1048315767.db2.gz IKXNVZMBMSQGMB-JOCHJYFZSA-N 1 2 314.454 4.158 20 0 DIADLO Cn1cc2cccc(Nc3ccc([NH+]4CCCCC4)cc3)c2n1 ZINC001175458422 1048331751 /nfs/dbraw/zinc/33/17/51/1048331751.db2.gz CRHCNDPVVKJQJK-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO CC(C)(C)C(=[NH2+])Nc1ccc(-c2cccc(OC(F)F)c2)nn1 ZINC001162661718 1048332228 /nfs/dbraw/zinc/33/22/28/1048332228.db2.gz HNSDIVAVADBNLT-UHFFFAOYSA-N 1 2 320.343 4.180 20 0 DIADLO CC(C)(C)OC(=O)Nc1ccc(Nc2cccc3[nH+]ccn32)cc1 ZINC001175545969 1048335241 /nfs/dbraw/zinc/33/52/41/1048335241.db2.gz QWGYMUIQPFUFAO-UHFFFAOYSA-N 1 2 324.384 4.425 20 0 DIADLO CCSc1cc[nH+]c(NC2(Cc3ccc(O)cc3)CC2)c1 ZINC001162735538 1048343802 /nfs/dbraw/zinc/34/38/02/1048343802.db2.gz CLDILGQGMGVOBU-UHFFFAOYSA-N 1 2 300.427 4.086 20 0 DIADLO CSCCC[N@@H+]1CC[C@@H](Cc2ccc(F)cc2)C(F)(F)C1 ZINC001201697416 1048347792 /nfs/dbraw/zinc/34/77/92/1048347792.db2.gz AFAXRSZRONCDBD-AWEZNQCLSA-N 1 2 317.420 4.079 20 0 DIADLO CSCCC[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C(F)(F)C1 ZINC001201697416 1048347805 /nfs/dbraw/zinc/34/78/05/1048347805.db2.gz AFAXRSZRONCDBD-AWEZNQCLSA-N 1 2 317.420 4.079 20 0 DIADLO Fc1ccc2c(c1)OCCC[C@@H]2[NH2+]Cc1csc(C2CC2)n1 ZINC001201742889 1048362827 /nfs/dbraw/zinc/36/28/27/1048362827.db2.gz XRNYEKZTDGPFOI-HNNXBMFYSA-N 1 2 318.417 4.163 20 0 DIADLO Cc1cc(CNc2ccc3ncsc3c2)c2c([nH+]1)CCCC2 ZINC001201762139 1048370633 /nfs/dbraw/zinc/37/06/33/1048370633.db2.gz ZMJPLKDYPGQNPE-UHFFFAOYSA-N 1 2 309.438 4.491 20 0 DIADLO Cc1nc(N2CCC[C@@H](c3ccc(F)c(F)c3)C2)c(C)c(C)[nH+]1 ZINC001187130118 1048377621 /nfs/dbraw/zinc/37/76/21/1048377621.db2.gz HLATYSZGIVXRDQ-OAHLLOKOSA-N 1 2 317.383 4.064 20 0 DIADLO CCC1(CC)[C@@H](Nc2cc(C)[nH+]c(C3CCC3)n2)C[C@@H]1OC ZINC001162891730 1048378002 /nfs/dbraw/zinc/37/80/02/1048378002.db2.gz JPCQEDVCUGAGGX-GJZGRUSLSA-N 1 2 303.450 4.058 20 0 DIADLO Clc1ccc2nc([C@@H]3CCC[N@@H+]3C[C@@H]3CCC=CO3)[nH]c2c1 ZINC000775097830 1048381505 /nfs/dbraw/zinc/38/15/05/1048381505.db2.gz VYGRWRAAZJVYDH-BBRMVZONSA-N 1 2 317.820 4.046 20 0 DIADLO Clc1ccc2nc([C@@H]3CCC[N@H+]3C[C@@H]3CCC=CO3)[nH]c2c1 ZINC000775097830 1048381512 /nfs/dbraw/zinc/38/15/12/1048381512.db2.gz VYGRWRAAZJVYDH-BBRMVZONSA-N 1 2 317.820 4.046 20 0 DIADLO COc1ccccc1[C@H](Nc1[nH+]ccc(F)c1C)C(F)(F)F ZINC001162901236 1048381863 /nfs/dbraw/zinc/38/18/63/1048381863.db2.gz AACYCNUFLDZKBE-ZDUSSCGKSA-N 1 2 314.282 4.253 20 0 DIADLO Cc1cc(N2CC=C(c3ccccc3C)C2)nc(C2CCC2)[nH+]1 ZINC001162916811 1048388066 /nfs/dbraw/zinc/38/80/66/1048388066.db2.gz USQMORHLMSMVRL-UHFFFAOYSA-N 1 2 305.425 4.265 20 0 DIADLO CSc1ncc(Nc2cc[nH+]c3cc(Cl)ccc23)cn1 ZINC001175647980 1048388491 /nfs/dbraw/zinc/38/84/91/1048388491.db2.gz NMUYTXNRYAHTFJ-UHFFFAOYSA-N 1 2 302.790 4.144 20 0 DIADLO Cc1cc(N[C@@H]2CCO[C@@H](CC(C)C)C2)nc(C2CCC2)[nH+]1 ZINC001162921631 1048389060 /nfs/dbraw/zinc/38/90/60/1048389060.db2.gz IRKKMPDZSGSNIL-CVEARBPZSA-N 1 2 303.450 4.058 20 0 DIADLO CCc1cc(N[C@@H]2CCc3cc(Cl)ccc32)nc(CC)[nH+]1 ZINC001187297301 1048390968 /nfs/dbraw/zinc/39/09/68/1048390968.db2.gz KJUULSMGHOWZDZ-OAHLLOKOSA-N 1 2 301.821 4.354 20 0 DIADLO Cc1cc(N[C@@H]2CCc3c2c(F)ccc3F)nc(C2CC2)[nH+]1 ZINC001162938702 1048393347 /nfs/dbraw/zinc/39/33/47/1048393347.db2.gz RPYFPUJWJVLMGE-CQSZACIVSA-N 1 2 301.340 4.040 20 0 DIADLO Cc1cccc2sc(NCc3ccccc3-n3cc[nH+]c3)nc21 ZINC001162948149 1048394143 /nfs/dbraw/zinc/39/41/43/1048394143.db2.gz AHUAVKPJLWTJDP-UHFFFAOYSA-N 1 2 320.421 4.403 20 0 DIADLO CCC[C@H](C)CCNc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC001187479496 1048398746 /nfs/dbraw/zinc/39/87/46/1048398746.db2.gz SKYNSNHFLKLBAH-AWEZNQCLSA-N 1 2 309.417 4.054 20 0 DIADLO CCc1ccc(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)nc1 ZINC000559130403 1048406974 /nfs/dbraw/zinc/40/69/74/1048406974.db2.gz ROGNUJDBVAPOJW-ZDUSSCGKSA-N 1 2 311.454 4.447 20 0 DIADLO CCc1ccc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)nc1 ZINC000559130403 1048406985 /nfs/dbraw/zinc/40/69/85/1048406985.db2.gz ROGNUJDBVAPOJW-ZDUSSCGKSA-N 1 2 311.454 4.447 20 0 DIADLO Cc1cc(N(C)Cc2ccc(F)c(Cl)c2)nc(C2CC2)[nH+]1 ZINC001163048482 1048407242 /nfs/dbraw/zinc/40/72/42/1048407242.db2.gz ZTJJSNWWMHLSTP-UHFFFAOYSA-N 1 2 305.784 4.091 20 0 DIADLO Cc1n[nH]c2cc(Nc3ccc(N4CCCCC4)[nH+]c3)ccc12 ZINC001175659223 1048408743 /nfs/dbraw/zinc/40/87/43/1048408743.db2.gz HIWOFDLCZPBNHT-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO Cc1[nH]nc2cc(Nc3ccc(Cn4cc[nH+]c4C)cc3)ccc12 ZINC001175662509 1048411433 /nfs/dbraw/zinc/41/14/33/1048411433.db2.gz PQJWPXFYZIHZLA-UHFFFAOYSA-N 1 2 317.396 4.168 20 0 DIADLO Cc1nc(NCCOc2cccc3ccoc32)cc(C(C)C)[nH+]1 ZINC001163076801 1048413472 /nfs/dbraw/zinc/41/34/72/1048413472.db2.gz FLOFDYVLZPZZCX-UHFFFAOYSA-N 1 2 311.385 4.146 20 0 DIADLO CCc1cc(N2CC[C@@H](C)C3(CCCCC3)C2)nc(CC)[nH+]1 ZINC001163112651 1048417501 /nfs/dbraw/zinc/41/75/01/1048417501.db2.gz KFSRTJOHTAHNBW-OAHLLOKOSA-N 1 2 301.478 4.398 20 0 DIADLO Clc1cc(NCc2ccc3[nH+]ccn3c2)c2ccsc2n1 ZINC001163136255 1048418702 /nfs/dbraw/zinc/41/87/02/1048418702.db2.gz DNBMTBCFADMCFP-UHFFFAOYSA-N 1 2 314.801 4.210 20 0 DIADLO Cc1cscc1Nc1cc(Br)c2[nH+]ccn2c1 ZINC001175764859 1048444383 /nfs/dbraw/zinc/44/43/83/1048444383.db2.gz VODSCTACKOAKMJ-UHFFFAOYSA-N 1 2 308.204 4.210 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc(-n3cccc3)cc2)c[nH+]1 ZINC001175713010 1048419209 /nfs/dbraw/zinc/41/92/09/1048419209.db2.gz XQIORQFEZRGXNF-UHFFFAOYSA-N 1 2 318.302 4.217 20 0 DIADLO COc1nsc(C[NH2+][C@@H](C)c2cc3ccccc3o2)c1Cl ZINC001202017867 1048419627 /nfs/dbraw/zinc/41/96/27/1048419627.db2.gz IBORTLXQSDXZFM-VIFPVBQESA-N 1 2 322.817 4.402 20 0 DIADLO Cc1cc(CNc2cccc3ccn(C)c32)c2c([nH+]1)CCCC2 ZINC001202018082 1048420207 /nfs/dbraw/zinc/42/02/07/1048420207.db2.gz LKPPLLDECOJYTG-UHFFFAOYSA-N 1 2 305.425 4.373 20 0 DIADLO Cc1cc(NC(C)(C)c2cc(Cl)ccn2)nc(C(C)C)[nH+]1 ZINC001163144041 1048420673 /nfs/dbraw/zinc/42/06/73/1048420673.db2.gz AJFVJCUOUUPHAA-UHFFFAOYSA-N 1 2 304.825 4.304 20 0 DIADLO Cc1ccc2c(Nc3cnc(N)cc3C(F)(F)F)cccc2[nH+]1 ZINC001175714633 1048421621 /nfs/dbraw/zinc/42/16/21/1048421621.db2.gz TYBQMRVPTZNHOQ-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO Cc1ccc([C@H]2CC[N@H+](CC(F)(F)C(F)F)C2(C)C)cc1 ZINC001175715352 1048421860 /nfs/dbraw/zinc/42/18/60/1048421860.db2.gz ODBPNCSVDXFNHU-CYBMUJFWSA-N 1 2 303.343 4.463 20 0 DIADLO Cc1ccc([C@H]2CC[N@@H+](CC(F)(F)C(F)F)C2(C)C)cc1 ZINC001175715352 1048421863 /nfs/dbraw/zinc/42/18/63/1048421863.db2.gz ODBPNCSVDXFNHU-CYBMUJFWSA-N 1 2 303.343 4.463 20 0 DIADLO Cc1cc(NC(C)(C)c2cc(Cl)ccn2)nc(C2CC2)[nH+]1 ZINC001163145014 1048422763 /nfs/dbraw/zinc/42/27/63/1048422763.db2.gz PGNMEZJRFMCFQU-UHFFFAOYSA-N 1 2 302.809 4.058 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2ccc3scnc3c2)c[nH+]1 ZINC001175717797 1048423424 /nfs/dbraw/zinc/42/34/24/1048423424.db2.gz QDICKAJEROONDT-UHFFFAOYSA-N 1 2 310.304 4.036 20 0 DIADLO COc1cc(Nc2c[nH+]c(N)cc2C(F)(F)F)ccc1Cl ZINC001175716915 1048423691 /nfs/dbraw/zinc/42/36/91/1048423691.db2.gz CXJWXMVYONZXJL-UHFFFAOYSA-N 1 2 317.698 4.088 20 0 DIADLO CCOc1cccc([C@@H]2C[C@H]2Nc2cc(C)[nH+]c(C3CCC3)n2)c1 ZINC001163158679 1048424664 /nfs/dbraw/zinc/42/46/64/1048424664.db2.gz DPQCCFKXIGFESY-ZWKOTPCHSA-N 1 2 323.440 4.419 20 0 DIADLO CCOC(=O)CCc1ccc(Nc2cc(C)c[nH+]c2C)cc1F ZINC001203668202 1048435083 /nfs/dbraw/zinc/43/50/83/1048435083.db2.gz CBWASFJLWURVFM-UHFFFAOYSA-N 1 2 316.376 4.077 20 0 DIADLO Nc1cc(C(F)(F)F)c(Nc2nc3ccccc3s2)c[nH+]1 ZINC001175707054 1048436732 /nfs/dbraw/zinc/43/67/32/1048436732.db2.gz FPVPPNLNJVOBLD-UHFFFAOYSA-N 1 2 310.304 4.036 20 0 DIADLO Cc1ccc2nc(Nc3c[nH+]c(N)cc3C(F)(F)F)ccc2c1 ZINC001175709466 1048438049 /nfs/dbraw/zinc/43/80/49/1048438049.db2.gz DCPDRMWNQBFEGD-UHFFFAOYSA-N 1 2 318.302 4.283 20 0 DIADLO COCCOc1ccc(Nc2ccc3c(C)cc[nH+]c3c2)cc1 ZINC001175791129 1048453835 /nfs/dbraw/zinc/45/38/35/1048453835.db2.gz XGZOOSPQLQURTO-UHFFFAOYSA-N 1 2 308.381 4.312 20 0 DIADLO CCC(CC)n1ccc(C[N@@H+]2CCc3ccsc3[C@@H]2C)n1 ZINC001175829722 1048456668 /nfs/dbraw/zinc/45/66/68/1048456668.db2.gz HZDQNAVBYCKPJI-ZDUSSCGKSA-N 1 2 303.475 4.425 20 0 DIADLO CCC(CC)n1ccc(C[N@H+]2CCc3ccsc3[C@@H]2C)n1 ZINC001175829722 1048456678 /nfs/dbraw/zinc/45/66/78/1048456678.db2.gz HZDQNAVBYCKPJI-ZDUSSCGKSA-N 1 2 303.475 4.425 20 0 DIADLO C[C@H]1c2sccc2CC[N@H+]1Cc1nccn1Cc1ccccc1 ZINC001175832363 1048458059 /nfs/dbraw/zinc/45/80/59/1048458059.db2.gz YSMVMGOKUYRZAU-HNNXBMFYSA-N 1 2 323.465 4.112 20 0 DIADLO C[C@H]1c2sccc2CC[N@@H+]1Cc1nccn1Cc1ccccc1 ZINC001175832363 1048458067 /nfs/dbraw/zinc/45/80/67/1048458067.db2.gz YSMVMGOKUYRZAU-HNNXBMFYSA-N 1 2 323.465 4.112 20 0 DIADLO Cc1ccc(NC(=O)Nc2ccc(Cn3cc[nH+]c3)cc2)cc1F ZINC001187985354 1048458224 /nfs/dbraw/zinc/45/82/24/1048458224.db2.gz DDCMEQIJWBWZAG-UHFFFAOYSA-N 1 2 324.359 4.023 20 0 DIADLO CCc1cc(N[C@H]2CCCc3c(F)cc(F)cc32)nc(CC)[nH+]1 ZINC001163397137 1048466101 /nfs/dbraw/zinc/46/61/01/1048466101.db2.gz KQKWTROMOFTANS-INIZCTEOSA-N 1 2 317.383 4.369 20 0 DIADLO c1cncc(-c2ccc(Nc3ccc[nH+]c3N3CCCC3)cc2)c1 ZINC001175887198 1048473336 /nfs/dbraw/zinc/47/33/36/1048473336.db2.gz ACQUQGBAIJLZEI-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO CCOC(CCCNc1cc(C)c(C(F)(F)F)c[nH+]1)OCC ZINC001163483848 1048475748 /nfs/dbraw/zinc/47/57/48/1048475748.db2.gz KYOUPTUEZSQHSF-UHFFFAOYSA-N 1 2 320.355 4.000 20 0 DIADLO COc1cccc(Nc2ccc[nH+]c2N2CCCCC2)c1Cl ZINC001175896264 1048478165 /nfs/dbraw/zinc/47/81/65/1048478165.db2.gz LQJSUYJECHENRC-UHFFFAOYSA-N 1 2 317.820 4.478 20 0 DIADLO c1csc(-c2cc(C[N@@H+]3Cc4ccccc4C4(CC4)C3)no2)c1 ZINC000481763366 1048480631 /nfs/dbraw/zinc/48/06/31/1048480631.db2.gz DHPQPLSWGORLJO-UHFFFAOYSA-N 1 2 322.433 4.451 20 0 DIADLO c1csc(-c2cc(C[N@H+]3Cc4ccccc4C4(CC4)C3)no2)c1 ZINC000481763366 1048480638 /nfs/dbraw/zinc/48/06/38/1048480638.db2.gz DHPQPLSWGORLJO-UHFFFAOYSA-N 1 2 322.433 4.451 20 0 DIADLO Cn1ccc2c1cccc2Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001175865706 1048482551 /nfs/dbraw/zinc/48/25/51/1048482551.db2.gz NNXLRLJBZFFDJX-UHFFFAOYSA-N 1 2 302.381 4.167 20 0 DIADLO COC(=O)c1ccc2cc[nH+]c(N[C@@H]3CCCC34CCC4)c2c1 ZINC001163519298 1048482670 /nfs/dbraw/zinc/48/26/70/1048482670.db2.gz YBMGAWPBJYDVSD-MRXNPFEDSA-N 1 2 310.397 4.156 20 0 DIADLO COc1c(C)c[nH+]c(CSCc2ncccc2Cl)c1C ZINC000600625071 1048513928 /nfs/dbraw/zinc/51/39/28/1048513928.db2.gz JIFZYYWMDUIJAO-UHFFFAOYSA-N 1 2 308.834 4.189 20 0 DIADLO Cc1cc(NCC2CCc3ccccc3CC2)nc(C2CC2)[nH+]1 ZINC001163797089 1048526226 /nfs/dbraw/zinc/52/62/26/1048526226.db2.gz MHWIGXTWJAICPS-UHFFFAOYSA-N 1 2 307.441 4.270 20 0 DIADLO COc1ccccc1[C@H]1CCN(c2ccc(C(C)(C)C)c[nH+]2)C1 ZINC001163811228 1048528741 /nfs/dbraw/zinc/52/87/41/1048528741.db2.gz JKJOIZOARJEMPI-HNNXBMFYSA-N 1 2 310.441 4.382 20 0 DIADLO COc1ccc(Nc2cccn3cc(C)[nH+]c23)c(C(F)(F)F)c1 ZINC001213047602 1048528911 /nfs/dbraw/zinc/52/89/11/1048528911.db2.gz SBCACYTZNUURJV-UHFFFAOYSA-N 1 2 321.302 4.414 20 0 DIADLO Cc1cc([NH+]2CCCCC2)ccc1Nc1ccc2[nH]nnc2c1 ZINC001176003053 1048529131 /nfs/dbraw/zinc/52/91/31/1048529131.db2.gz MGTNICLIHIJAFY-UHFFFAOYSA-N 1 2 307.401 4.000 20 0 DIADLO O=C(Nc1ccc2ccccc2c1)Nc1cccc2[nH+]ccn21 ZINC001188577411 1048529702 /nfs/dbraw/zinc/52/97/02/1048529702.db2.gz YUGSOJZGMTVELH-UHFFFAOYSA-N 1 2 302.337 4.132 20 0 DIADLO c1cc2n(c1)CCN(c1cccc(C3CC3)[nH+]1)[C@H]2c1ccccc1 ZINC001163847642 1048536121 /nfs/dbraw/zinc/53/61/21/1048536121.db2.gz ZLPCAOHTWFZHEL-NRFANRHFSA-N 1 2 315.420 4.370 20 0 DIADLO CC(C)(Cc1ccc(F)cc1)Nc1ccc(N2CCCC2)[nH+]c1 ZINC001163852603 1048537902 /nfs/dbraw/zinc/53/79/02/1048537902.db2.gz AJXMVYAZIXSARV-UHFFFAOYSA-N 1 2 313.420 4.254 20 0 DIADLO Cc1nc2cncc(NC(=[NH2+])C34CC5CC(CC(C5)C3)C4)c2o1 ZINC001163847996 1048539048 /nfs/dbraw/zinc/53/90/48/1048539048.db2.gz HMJQKDDRRUNRME-UHFFFAOYSA-N 1 2 310.401 4.137 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H](C)c1cn(C(C)C)nn1 ZINC000924772518 1048541622 /nfs/dbraw/zinc/54/16/22/1048541622.db2.gz HUXUXPTXDOIJHO-KGLIPLIRSA-N 1 2 312.417 4.325 20 0 DIADLO COc1cc(CN2CCC[C@H]2c2[nH]c(C)c(C)[nH+]2)ccc1Cl ZINC001176079249 1048547972 /nfs/dbraw/zinc/54/79/72/1048547972.db2.gz XHEHNHAFMVSSCZ-HNNXBMFYSA-N 1 2 319.836 4.026 20 0 DIADLO COc1cccc2[nH]c(Nc3ccccc3-n3cc[nH+]c3)cc21 ZINC001176064117 1048557392 /nfs/dbraw/zinc/55/73/92/1048557392.db2.gz OJEAPHOTWWVGJK-UHFFFAOYSA-N 1 2 304.353 4.106 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667986096 1048559166 /nfs/dbraw/zinc/55/91/66/1048559166.db2.gz PZYYCVFCCVWILQ-IAQYHMDHSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc(F)c(F)c2F)C1 ZINC000667986096 1048559181 /nfs/dbraw/zinc/55/91/81/1048559181.db2.gz PZYYCVFCCVWILQ-IAQYHMDHSA-N 1 2 306.331 4.082 20 0 DIADLO C[C@@H]1c2ccccc2CCN1c1[nH+]ccc2c3c([nH]c21)CCC3 ZINC001163961244 1048562450 /nfs/dbraw/zinc/56/24/50/1048562450.db2.gz VAPONHSDFNXUOG-CYBMUJFWSA-N 1 2 303.409 4.175 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(-c2ccccc2)nn1C(C)(C)C ZINC001176118491 1048573035 /nfs/dbraw/zinc/57/30/35/1048573035.db2.gz IFIBUKOHOLNTTL-UHFFFAOYSA-N 1 2 322.412 4.452 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(C(F)(F)F)c(Cl)cc1N ZINC001176120425 1048573561 /nfs/dbraw/zinc/57/35/61/1048573561.db2.gz AKTNMZRVZFHOMY-UHFFFAOYSA-N 1 2 317.698 4.088 20 0 DIADLO COc1cc[nH+]cc1Nc1cnc2ccc(C(F)(F)F)cc2c1 ZINC001176119606 1048573799 /nfs/dbraw/zinc/57/37/99/1048573799.db2.gz VZTDJOLTRVWTDM-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(-c2ccccc2Cl)no1 ZINC001176118510 1048574271 /nfs/dbraw/zinc/57/42/71/1048574271.db2.gz MMPMQHBISRNUGF-UHFFFAOYSA-N 1 2 301.733 4.142 20 0 DIADLO COc1cc[nH+]cc1Nc1c(C)cc(F)cc1Br ZINC001176121403 1048575584 /nfs/dbraw/zinc/57/55/84/1048575584.db2.gz HLDPRWISBWWWNU-UHFFFAOYSA-N 1 2 311.154 4.044 20 0 DIADLO COc1cc[nH+]cc1Nc1c(N)cc(C(F)(F)F)cc1Cl ZINC001176121114 1048576842 /nfs/dbraw/zinc/57/68/42/1048576842.db2.gz OBKBVZBUIFGUIH-UHFFFAOYSA-N 1 2 317.698 4.088 20 0 DIADLO COc1cc[nH+]cc1N(Cc1ccccc1)c1ccccc1N ZINC001176124918 1048576870 /nfs/dbraw/zinc/57/68/70/1048576870.db2.gz RVKQPYVIQXDXSZ-UHFFFAOYSA-N 1 2 305.381 4.011 20 0 DIADLO COc1cc[nH+]cc1Nc1cc(C(F)(F)F)c(F)cc1F ZINC001176123956 1048577303 /nfs/dbraw/zinc/57/73/03/1048577303.db2.gz ZVHZRFFLMPDRBG-UHFFFAOYSA-N 1 2 304.218 4.131 20 0 DIADLO CC(C)Oc1cc(N[C@@H](c2ccccc2)c2ccncc2)cc[nH+]1 ZINC001164077280 1048577414 /nfs/dbraw/zinc/57/74/14/1048577414.db2.gz YJBJZRUDBGQVOE-FQEVSTJZSA-N 1 2 319.408 4.465 20 0 DIADLO CC(C)Oc1cc(N[C@H](c2ccccc2)c2ccncc2)cc[nH+]1 ZINC001164077281 1048577729 /nfs/dbraw/zinc/57/77/29/1048577729.db2.gz YJBJZRUDBGQVOE-HXUWFJFHSA-N 1 2 319.408 4.465 20 0 DIADLO C[C@@H](Nc1[nH+]cnc2[nH]cc(F)c21)c1ccc2ccccc2c1 ZINC001164138729 1048588778 /nfs/dbraw/zinc/58/87/78/1048588778.db2.gz GDQZEJCEJOHYRB-LLVKDONJSA-N 1 2 306.344 4.423 20 0 DIADLO CNc1ccc(CNc2ccc(C3(C(F)(F)F)CC3)c[nH+]2)cc1 ZINC001164152217 1048592614 /nfs/dbraw/zinc/59/26/14/1048592614.db2.gz GLNWUBKKTYQSBS-UHFFFAOYSA-N 1 2 321.346 4.329 20 0 DIADLO COc1ccc(CCCNc2cc(-c3ccncc3)cc[nH+]2)cc1 ZINC001164190035 1048603427 /nfs/dbraw/zinc/60/34/27/1048603427.db2.gz BEMKQFFGGKJSOI-UHFFFAOYSA-N 1 2 319.408 4.197 20 0 DIADLO COc1ccc2cc(NCc3cnc4ccccc4c3)[nH+]cc2c1 ZINC001164196989 1048604725 /nfs/dbraw/zinc/60/47/25/1048604725.db2.gz JVUPOIRVWCVJQM-UHFFFAOYSA-N 1 2 315.376 4.404 20 0 DIADLO COc1cccc2[nH+]c(NCc3cnc4ccccc4c3)ccc21 ZINC001164197136 1048605189 /nfs/dbraw/zinc/60/51/89/1048605189.db2.gz LZULTZZIVPVIGM-UHFFFAOYSA-N 1 2 315.376 4.404 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@@H]3CCC[C@H](C)C3)cc2)[nH+]c1C ZINC001176211242 1048605992 /nfs/dbraw/zinc/60/59/92/1048605992.db2.gz MEMWSSKBVHPVFH-BLLLJJGKSA-N 1 2 311.429 4.458 20 0 DIADLO COc1cccc2c(NCc3cnc4ccccc4c3)cc[nH+]c12 ZINC001164204304 1048607095 /nfs/dbraw/zinc/60/70/95/1048607095.db2.gz RQUBZONTGQEEFX-UHFFFAOYSA-N 1 2 315.376 4.404 20 0 DIADLO CCCCOc1ccc(NC(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001189295388 1048612897 /nfs/dbraw/zinc/61/28/97/1048612897.db2.gz QOFPNLIBSDEUDG-UHFFFAOYSA-N 1 2 324.384 4.157 20 0 DIADLO FC[C@@]1(C(F)(F)F)CCN(c2cc(-c3ccccc3)cc[nH+]2)C1 ZINC001164263954 1048615830 /nfs/dbraw/zinc/61/58/30/1048615830.db2.gz BUGZYVGQGUABHL-INIZCTEOSA-N 1 2 324.321 4.477 20 0 DIADLO C[C@H](CCC1CCCCC1)[NH2+][C@@H](c1nnc[nH]1)c1ccccc1 ZINC000482500538 1048618747 /nfs/dbraw/zinc/61/87/47/1048618747.db2.gz ILJJRXSYQMGVOU-CRAIPNDOSA-N 1 2 312.461 4.233 20 0 DIADLO Cc1[nH]c(CNc2ccc(OC3CCCC3)c(F)c2)[nH+]c1C ZINC000850161403 1048620214 /nfs/dbraw/zinc/62/02/14/1048620214.db2.gz ZGRAXPOXHAEALC-UHFFFAOYSA-N 1 2 303.381 4.099 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)c(F)cc1F ZINC000482505175 1048620563 /nfs/dbraw/zinc/62/05/63/1048620563.db2.gz HTQLQVCZXDPFBO-PSASIEDQSA-N 1 2 311.269 4.267 20 0 DIADLO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)c(F)cc1F ZINC000482505175 1048620570 /nfs/dbraw/zinc/62/05/70/1048620570.db2.gz HTQLQVCZXDPFBO-PSASIEDQSA-N 1 2 311.269 4.267 20 0 DIADLO Cc1nc(N2CC[C@@](C)(F)[C@H](F)C2)cc(C2CCCCC2)[nH+]1 ZINC001164338483 1048622109 /nfs/dbraw/zinc/62/21/09/1048622109.db2.gz PLIRKCJASVUJQL-NVXWUHKLSA-N 1 2 309.404 4.109 20 0 DIADLO Cc1nc(N2CC[C@](C)(F)[C@H](F)C2)cc(C2CCCCC2)[nH+]1 ZINC001164338485 1048622420 /nfs/dbraw/zinc/62/24/20/1048622420.db2.gz PLIRKCJASVUJQL-WBVHZDCISA-N 1 2 309.404 4.109 20 0 DIADLO Cn1ncc(C2CCC2)c1C[N@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000668064533 1048626175 /nfs/dbraw/zinc/62/61/75/1048626175.db2.gz ORJMBCHSVUECLN-UHFFFAOYSA-N 1 2 321.827 4.112 20 0 DIADLO Cn1ncc(C2CCC2)c1C[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000668064533 1048626184 /nfs/dbraw/zinc/62/61/84/1048626184.db2.gz ORJMBCHSVUECLN-UHFFFAOYSA-N 1 2 321.827 4.112 20 0 DIADLO c1ccn(CCNc2ccc3[nH]c(-c4ccccc4)[nH+]c3c2)c1 ZINC001164454986 1048629911 /nfs/dbraw/zinc/62/99/11/1048629911.db2.gz LCLMLEAUQCCDTJ-UHFFFAOYSA-N 1 2 302.381 4.144 20 0 DIADLO Oc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)c(C(F)(F)F)c1 ZINC001176339418 1048631252 /nfs/dbraw/zinc/63/12/52/1048631252.db2.gz YKVYLWTWAOGVME-UHFFFAOYSA-N 1 2 319.286 4.340 20 0 DIADLO CC(C)(C)c1ccccc1NC(=O)Nc1cccc2[nH+]ccn21 ZINC001189556621 1048636051 /nfs/dbraw/zinc/63/60/51/1048636051.db2.gz OUBALUROOFGBFR-UHFFFAOYSA-N 1 2 308.385 4.276 20 0 DIADLO COc1cc(Cl)cc(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001176345005 1048636616 /nfs/dbraw/zinc/63/66/16/1048636616.db2.gz XSTCTDZGGXUTDJ-UHFFFAOYSA-N 1 2 313.788 4.337 20 0 DIADLO CCOc1cc[nH+]cc1Nc1ccc(OCc2ccccc2)nc1 ZINC001176299967 1048638938 /nfs/dbraw/zinc/63/89/38/1048638938.db2.gz DCEHVEAFGDYFIQ-UHFFFAOYSA-N 1 2 321.380 4.198 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSc1ccc2n[nH]cc2c1 ZINC001189531447 1048640180 /nfs/dbraw/zinc/64/01/80/1048640180.db2.gz YCJHFGOAHLLKOG-UHFFFAOYSA-N 1 2 320.421 4.349 20 0 DIADLO COc1c(Cl)cc(Nc2ccn3cc[nH+]c3c2)cc1Cl ZINC001176308868 1048646069 /nfs/dbraw/zinc/64/60/69/1048646069.db2.gz JUFPBXPSWDDBHI-UHFFFAOYSA-N 1 2 308.168 4.393 20 0 DIADLO COc1ccc2[nH+]c(N3CCC(F)(F)C(C)(C)C3)cc(C)c2c1 ZINC001164687631 1048653136 /nfs/dbraw/zinc/65/31/36/1048653136.db2.gz FLFWCHJFJMGIQN-UHFFFAOYSA-N 1 2 320.383 4.423 20 0 DIADLO CCc1cccc(CC)c1NC(=O)Nc1cccc2[nH+]ccn21 ZINC001189738370 1048661782 /nfs/dbraw/zinc/66/17/82/1048661782.db2.gz CGFHJMGGGRIFFT-UHFFFAOYSA-N 1 2 308.385 4.103 20 0 DIADLO CC(C)c1nnc2n1CC[N@@H+](CCC1C[C@H](C)C[C@@H](C)C1)[C@@H]2C ZINC001176372999 1048665383 /nfs/dbraw/zinc/66/53/83/1048665383.db2.gz LPEZGRLRFFLNHT-BZUAXINKSA-N 1 2 318.509 4.241 20 0 DIADLO CC(C)c1nnc2n1CC[N@H+](CCC1C[C@H](C)C[C@@H](C)C1)[C@@H]2C ZINC001176372999 1048665386 /nfs/dbraw/zinc/66/53/86/1048665386.db2.gz LPEZGRLRFFLNHT-BZUAXINKSA-N 1 2 318.509 4.241 20 0 DIADLO c1cn2ccc(Nc3ccc(Oc4ccccc4)nc3)cc2[nH+]1 ZINC001176375145 1048667017 /nfs/dbraw/zinc/66/70/17/1048667017.db2.gz ALZGGDXXMRMNDR-UHFFFAOYSA-N 1 2 302.337 4.265 20 0 DIADLO Cc1ccc(Cn2c[nH+]c(C(C)(C)C)c2)c(Br)c1 ZINC001189876605 1048671467 /nfs/dbraw/zinc/67/14/67/1048671467.db2.gz QCJFIUPVIPJVSJ-UHFFFAOYSA-N 1 2 307.235 4.300 20 0 DIADLO CCn1cc(C[NH2+][C@@H](C)c2ccccc2SC(C)(C)C)nn1 ZINC000850522755 1048676403 /nfs/dbraw/zinc/67/64/03/1048676403.db2.gz ZIDKIHTULJHSAZ-ZDUSSCGKSA-N 1 2 318.490 4.039 20 0 DIADLO C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1cccnc1Cl ZINC000850521176 1048676648 /nfs/dbraw/zinc/67/66/48/1048676648.db2.gz OZGDPEJLKVHCKY-NSHDSACASA-N 1 2 320.795 4.266 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1cccnc1Cl ZINC000850521175 1048676846 /nfs/dbraw/zinc/67/68/46/1048676846.db2.gz OZGDPEJLKVHCKY-LLVKDONJSA-N 1 2 320.795 4.266 20 0 DIADLO CCc1cccc(C)c1NC(=O)Nc1cccc2[nH+]c(C)cn21 ZINC001189939396 1048677675 /nfs/dbraw/zinc/67/76/75/1048677675.db2.gz AETOWBMEXPSDSE-UHFFFAOYSA-N 1 2 308.385 4.158 20 0 DIADLO CSc1cc(Nc2cc(F)cc(N3CCCC3)c2)cc[nH+]1 ZINC001176421105 1048684674 /nfs/dbraw/zinc/68/46/74/1048684674.db2.gz KSPNDCLSXVCUAN-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO O=C(Nc1cc2ccccc2s1)c1ccccc1-n1cc[nH+]c1 ZINC001190075336 1048697346 /nfs/dbraw/zinc/69/73/46/1048697346.db2.gz PQQMXIBSAHBDSP-UHFFFAOYSA-N 1 2 319.389 4.339 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000482939165 1048707393 /nfs/dbraw/zinc/70/73/93/1048707393.db2.gz XDVLVKGOKPDLIK-LJQANCHMSA-N 1 2 309.409 4.235 20 0 DIADLO CCOc1ccc(C(C)=O)cc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000482939165 1048707404 /nfs/dbraw/zinc/70/74/04/1048707404.db2.gz XDVLVKGOKPDLIK-LJQANCHMSA-N 1 2 309.409 4.235 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@@H+]1CCO[C@@H](c3cccc(F)c3)C1)CC2 ZINC000482953247 1048711086 /nfs/dbraw/zinc/71/10/86/1048711086.db2.gz WAJGLPOFCVOYAR-RTBURBONSA-N 1 2 315.363 4.026 20 0 DIADLO Fc1ccc2c(c1)[C@H]([N@H+]1CCO[C@@H](c3cccc(F)c3)C1)CC2 ZINC000482953247 1048711097 /nfs/dbraw/zinc/71/10/97/1048711097.db2.gz WAJGLPOFCVOYAR-RTBURBONSA-N 1 2 315.363 4.026 20 0 DIADLO Cc1cnc(Cl)c(Nc2ccc([NH+]3CCCCC3)cc2)n1 ZINC001203717871 1048713502 /nfs/dbraw/zinc/71/35/02/1048713502.db2.gz NLLULZVESRYXLI-UHFFFAOYSA-N 1 2 302.809 4.172 20 0 DIADLO COc1ccc(Cl)c(C[N@H+](Cc2ccc(C)o2)C2CC2)c1 ZINC001190376372 1048732155 /nfs/dbraw/zinc/73/21/55/1048732155.db2.gz YGFRARDXBKGXMU-UHFFFAOYSA-N 1 2 305.805 4.415 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+](Cc2ccc(C)o2)C2CC2)c1 ZINC001190376372 1048732168 /nfs/dbraw/zinc/73/21/68/1048732168.db2.gz YGFRARDXBKGXMU-UHFFFAOYSA-N 1 2 305.805 4.415 20 0 DIADLO CC[C@](C)([NH2+]Cc1nc(CCC(C)C)no1)c1ccccc1 ZINC000775387788 1048738472 /nfs/dbraw/zinc/73/84/72/1048738472.db2.gz MGOPDJILNQTVBR-SFHVURJKSA-N 1 2 301.434 4.073 20 0 DIADLO C[N@H+](Cc1ccco1)Cc1cc(Br)c(Cl)s1 ZINC000483135698 1048744105 /nfs/dbraw/zinc/74/41/05/1048744105.db2.gz GNADOSBSMQAFEQ-UHFFFAOYSA-N 1 2 320.639 4.389 20 0 DIADLO C[N@@H+](Cc1ccco1)Cc1cc(Br)c(Cl)s1 ZINC000483135698 1048744113 /nfs/dbraw/zinc/74/41/13/1048744113.db2.gz GNADOSBSMQAFEQ-UHFFFAOYSA-N 1 2 320.639 4.389 20 0 DIADLO c1ccc2cc(N3CCC4(CC(OCC5CC5)C4)CC3)[nH+]cc2c1 ZINC001166372987 1048747893 /nfs/dbraw/zinc/74/78/93/1048747893.db2.gz OSURPEFWJREEPP-UHFFFAOYSA-N 1 2 322.452 4.410 20 0 DIADLO c1ccc(-c2ccc(Nc3ccc[nH+]c3N3CCCC3)nc2)cc1 ZINC001176742950 1048775280 /nfs/dbraw/zinc/77/52/80/1048775280.db2.gz FLLDCLYULZEVJJ-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO Cc1cc(N2CC[C@H]2COCc2ccccc2)[nH+]c2ccccc12 ZINC001166669776 1048778285 /nfs/dbraw/zinc/77/82/85/1048778285.db2.gz CARQSBWNUHLTQP-SFHVURJKSA-N 1 2 318.420 4.339 20 0 DIADLO c1ccc(-c2ncccc2Nc2ccc[nH+]c2N2CCCC2)cc1 ZINC001176749995 1048778229 /nfs/dbraw/zinc/77/82/29/1048778229.db2.gz KXGRUCSUZLMTNL-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO c1ccc(COC[C@H]2CCN2c2[nH+]ccc3ccccc32)cc1 ZINC001166670748 1048778643 /nfs/dbraw/zinc/77/86/43/1048778643.db2.gz YKPDXMNCROYNAE-GOSISDBHSA-N 1 2 304.393 4.030 20 0 DIADLO Nc1cc(Nc2ccc[nH+]c2N2CCCC2)cc(C(F)(F)F)c1 ZINC001176750790 1048778936 /nfs/dbraw/zinc/77/89/36/1048778936.db2.gz MRHREZNVCDAVMV-UHFFFAOYSA-N 1 2 322.334 4.026 20 0 DIADLO c1c(Cc2ccccc2)noc1Nc1ccc[nH+]c1N1CCCC1 ZINC001176744561 1048779425 /nfs/dbraw/zinc/77/94/25/1048779425.db2.gz WQZYSAQNPLXAHF-UHFFFAOYSA-N 1 2 320.396 4.004 20 0 DIADLO CSCc1cc[nH+]c(N(C)Cc2cccc3cccnc32)c1 ZINC001166687823 1048784451 /nfs/dbraw/zinc/78/44/51/1048784451.db2.gz BGEAONVIYRQBIU-UHFFFAOYSA-N 1 2 309.438 4.129 20 0 DIADLO Cc1nc([C@H]2CCCCN2c2cc(-c3ccccc3)cc[nH+]2)no1 ZINC001166713206 1048785700 /nfs/dbraw/zinc/78/57/00/1048785700.db2.gz DCMQNLRPXUAUQK-QGZVFWFLSA-N 1 2 320.396 4.172 20 0 DIADLO FCc1ccccc1C[N@@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC001190791469 1048787012 /nfs/dbraw/zinc/78/70/12/1048787012.db2.gz NBTGZMPZYSOQTJ-SFHVURJKSA-N 1 2 321.342 4.008 20 0 DIADLO FCc1ccccc1C[N@H+]1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC001190791469 1048787026 /nfs/dbraw/zinc/78/70/26/1048787026.db2.gz NBTGZMPZYSOQTJ-SFHVURJKSA-N 1 2 321.342 4.008 20 0 DIADLO Fc1ccc([C@@H]2C[N@H+](CCc3ccccc3)CCO2)cc1Cl ZINC001190781793 1048787181 /nfs/dbraw/zinc/78/71/81/1048787181.db2.gz YTYJUGSQPOJXMY-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1ccc([C@@H]2C[N@@H+](CCc3ccccc3)CCO2)cc1Cl ZINC001190781793 1048787196 /nfs/dbraw/zinc/78/71/96/1048787196.db2.gz YTYJUGSQPOJXMY-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO C[C@@H](C(=O)Nc1ccc2ccccc2c1)[N@H+](C)Cc1ccsc1 ZINC000007927071 1048788471 /nfs/dbraw/zinc/78/84/71/1048788471.db2.gz FNZYRSCVFSJSBO-AWEZNQCLSA-N 1 2 324.449 4.360 20 0 DIADLO C[C@@H](C(=O)Nc1ccc2ccccc2c1)[N@@H+](C)Cc1ccsc1 ZINC000007927071 1048788483 /nfs/dbraw/zinc/78/84/83/1048788483.db2.gz FNZYRSCVFSJSBO-AWEZNQCLSA-N 1 2 324.449 4.360 20 0 DIADLO CC(C)CCc1nc(C[NH+]2CCC(C(F)F)CC2)cs1 ZINC000483547556 1048816371 /nfs/dbraw/zinc/81/63/71/1048816371.db2.gz VRQHCTZVWASOCE-UHFFFAOYSA-N 1 2 302.434 4.209 20 0 DIADLO CN(c1nc(C[N@H+](C)Cc2ccc(Cl)cc2)cs1)C1CC1 ZINC000483419737 1048791616 /nfs/dbraw/zinc/79/16/16/1048791616.db2.gz JDPORSJUVQPRDG-UHFFFAOYSA-N 1 2 321.877 4.027 20 0 DIADLO CN(c1nc(C[N@@H+](C)Cc2ccc(Cl)cc2)cs1)C1CC1 ZINC000483419737 1048791627 /nfs/dbraw/zinc/79/16/27/1048791627.db2.gz JDPORSJUVQPRDG-UHFFFAOYSA-N 1 2 321.877 4.027 20 0 DIADLO CC(C)[N@H+](Cc1cn(C2CCC2)nn1)[C@H](C)c1ccsc1 ZINC000668244792 1048792262 /nfs/dbraw/zinc/79/22/62/1048792262.db2.gz KVDWPDHJKJSHFT-CYBMUJFWSA-N 1 2 304.463 4.036 20 0 DIADLO CC(C)[N@@H+](Cc1cn(C2CCC2)nn1)[C@H](C)c1ccsc1 ZINC000668244792 1048792279 /nfs/dbraw/zinc/79/22/79/1048792279.db2.gz KVDWPDHJKJSHFT-CYBMUJFWSA-N 1 2 304.463 4.036 20 0 DIADLO CC(=O)C1(c2ccccc2)CCN(c2cccc(C3CC3)[nH+]2)CC1 ZINC001166836555 1048802598 /nfs/dbraw/zinc/80/25/98/1048802598.db2.gz DEUXLNZFXGLVLZ-UHFFFAOYSA-N 1 2 320.436 4.086 20 0 DIADLO c1ccc2c(c1)cc[nH+]c2N1CCC(Sc2ccncc2)CC1 ZINC001166987740 1048823007 /nfs/dbraw/zinc/82/30/07/1048823007.db2.gz QACYFNRNPLWACS-UHFFFAOYSA-N 1 2 321.449 4.391 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2scnc2Cl)[C@@H]1c1ccccc1 ZINC001191029321 1048823485 /nfs/dbraw/zinc/82/34/85/1048823485.db2.gz GLFGZQRXODHTGI-RISCZKNCSA-N 1 2 324.902 4.475 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2scnc2Cl)[C@@H]1c1ccccc1 ZINC001191029321 1048823507 /nfs/dbraw/zinc/82/35/07/1048823507.db2.gz GLFGZQRXODHTGI-RISCZKNCSA-N 1 2 324.902 4.475 20 0 DIADLO C[C@@H]1SCC[N@H+](Cc2scnc2Cl)[C@H]1c1ccccc1 ZINC001191029322 1048828861 /nfs/dbraw/zinc/82/88/61/1048828861.db2.gz GLFGZQRXODHTGI-SMDDNHRTSA-N 1 2 324.902 4.475 20 0 DIADLO C[C@@H]1SCC[N@@H+](Cc2scnc2Cl)[C@H]1c1ccccc1 ZINC001191029322 1048828879 /nfs/dbraw/zinc/82/88/79/1048828879.db2.gz GLFGZQRXODHTGI-SMDDNHRTSA-N 1 2 324.902 4.475 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC001191038080 1048830727 /nfs/dbraw/zinc/83/07/27/1048830727.db2.gz DSLXOZSQBALBPY-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC001191038080 1048830747 /nfs/dbraw/zinc/83/07/47/1048830747.db2.gz DSLXOZSQBALBPY-QGZVFWFLSA-N 1 2 305.393 4.255 20 0 DIADLO C[C@H]([NH2+]Cc1cnon1)c1ccc(O[C@@H](C)c2ccccc2)cc1 ZINC000852441185 1048841050 /nfs/dbraw/zinc/84/10/50/1048841050.db2.gz YBTZJIDDRVVVDG-GJZGRUSLSA-N 1 2 323.396 4.060 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1cnc(Cl)s1)CC1CC1 ZINC000852564349 1048847411 /nfs/dbraw/zinc/84/74/11/1048847411.db2.gz NQNIVNQWWOXNBT-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1cnc(Cl)s1)CC1CC1 ZINC000852564349 1048847426 /nfs/dbraw/zinc/84/74/26/1048847426.db2.gz NQNIVNQWWOXNBT-UHFFFAOYSA-N 1 2 310.825 4.348 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)nc2)cc1F ZINC000852519035 1048849442 /nfs/dbraw/zinc/84/94/42/1048849442.db2.gz SWCBSTIIYLWKAK-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)nc2)cc1F ZINC000852519035 1048849457 /nfs/dbraw/zinc/84/94/57/1048849457.db2.gz SWCBSTIIYLWKAK-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO FC[C@]1(C(F)(F)F)CC[N@@H+](Cc2c(F)cccc2Cl)C1 ZINC001203399444 1048890715 /nfs/dbraw/zinc/89/07/15/1048890715.db2.gz ZUSGDOOTONCBHZ-GFCCVEGCSA-N 1 2 313.697 4.203 20 0 DIADLO Fc1cc2[nH]ccc2c(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001203735059 1048858180 /nfs/dbraw/zinc/85/81/80/1048858180.db2.gz WVROJDDXCLAIBT-UHFFFAOYSA-N 1 2 300.724 4.352 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(-c2ccsc2)n1)c1ccns1 ZINC001203307198 1048864274 /nfs/dbraw/zinc/86/42/74/1048864274.db2.gz NEJJMCWXRPUOSL-SECBINFHSA-N 1 2 307.469 4.179 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+]Cc1nc2cc(C)ccc2[nH]1 ZINC000483867985 1048874560 /nfs/dbraw/zinc/87/45/60/1048874560.db2.gz FWVOZTCHXTTXLA-CQSZACIVSA-N 1 2 309.413 4.121 20 0 DIADLO CCOc1ccccc1[C@@H](C)[NH2+]Cc1nc2ccc(C)cc2[nH]1 ZINC000483867985 1048874583 /nfs/dbraw/zinc/87/45/83/1048874583.db2.gz FWVOZTCHXTTXLA-CQSZACIVSA-N 1 2 309.413 4.121 20 0 DIADLO c1ccc2c(c1)ccnc2CNc1ccc(N2CCCCC2)c[nH+]1 ZINC001177403780 1048884125 /nfs/dbraw/zinc/88/41/25/1048884125.db2.gz AWFSJVIILNUPOX-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO Cc1cc([C@H]2CCCN2c2cc(C(F)(F)F)cc(C)[nH+]2)no1 ZINC000853136900 1048886886 /nfs/dbraw/zinc/88/68/86/1048886886.db2.gz PBVPOGXPRLMSQG-CYBMUJFWSA-N 1 2 311.307 4.047 20 0 DIADLO CC[C@]1(C)CCC[N@@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191214539 1048887383 /nfs/dbraw/zinc/88/73/83/1048887383.db2.gz PPVMTODOPMBEDH-DOTOQJQBSA-N 1 2 309.837 4.066 20 0 DIADLO CC[C@]1(C)CCC[N@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191214539 1048887400 /nfs/dbraw/zinc/88/74/00/1048887400.db2.gz PPVMTODOPMBEDH-DOTOQJQBSA-N 1 2 309.837 4.066 20 0 DIADLO Cc1ccc(Nc2ccc3c(cnn3[C@H]3CCCCO3)c2)c(C)[nH+]1 ZINC001203374433 1048887833 /nfs/dbraw/zinc/88/78/33/1048887833.db2.gz JHWMQRRLEMWCBN-LJQANCHMSA-N 1 2 322.412 4.491 20 0 DIADLO FC[C@]1(C(F)(F)F)CC[N@H+](Cc2c(F)cccc2Cl)C1 ZINC001203399444 1048890700 /nfs/dbraw/zinc/89/07/00/1048890700.db2.gz ZUSGDOOTONCBHZ-GFCCVEGCSA-N 1 2 313.697 4.203 20 0 DIADLO Fc1cccc(Cl)c1C[N@@H+]1CCOC[C@H]1C1CCCCC1 ZINC001203410453 1048892488 /nfs/dbraw/zinc/89/24/88/1048892488.db2.gz GXESKJBHBDBNPZ-KRWDZBQOSA-N 1 2 311.828 4.260 20 0 DIADLO Fc1cccc(Cl)c1C[N@H+]1CCOC[C@H]1C1CCCCC1 ZINC001203410453 1048892495 /nfs/dbraw/zinc/89/24/95/1048892495.db2.gz GXESKJBHBDBNPZ-KRWDZBQOSA-N 1 2 311.828 4.260 20 0 DIADLO CCC[C@@]1(C)CCC[N@@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191254727 1048895146 /nfs/dbraw/zinc/89/51/46/1048895146.db2.gz BMVMSINBWHDFIX-WMZOPIPTSA-N 1 2 323.864 4.456 20 0 DIADLO CCC[C@@]1(C)CCC[N@H+]([C@H](C(=O)OC)c2cccc(Cl)c2)C1 ZINC001191254727 1048895160 /nfs/dbraw/zinc/89/51/60/1048895160.db2.gz BMVMSINBWHDFIX-WMZOPIPTSA-N 1 2 323.864 4.456 20 0 DIADLO Cn1cc(Nc2ccc(Cn3cc[nH+]c3)cc2)c2ccccc21 ZINC001203423170 1048897803 /nfs/dbraw/zinc/89/78/03/1048897803.db2.gz ZYDJIUDVSLTGBS-UHFFFAOYSA-N 1 2 302.381 4.167 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2csnc2OC)o1 ZINC001191259038 1048900520 /nfs/dbraw/zinc/90/05/20/1048900520.db2.gz RUTVQLGETRLZMX-SWLSCSKDSA-N 1 2 320.458 4.280 20 0 DIADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2csnc2OC)o1 ZINC001191259038 1048900535 /nfs/dbraw/zinc/90/05/35/1048900535.db2.gz RUTVQLGETRLZMX-SWLSCSKDSA-N 1 2 320.458 4.280 20 0 DIADLO CNc1ccc(Nc2nc(Cl)c(Cl)cc2Cl)c[nH+]1 ZINC001203452227 1048902188 /nfs/dbraw/zinc/90/21/88/1048902188.db2.gz KGVNNXCGUCIMSW-UHFFFAOYSA-N 1 2 303.580 4.222 20 0 DIADLO CNc1ccc(Nc2c(C)cnn2-c2cccc(Cl)c2)c[nH+]1 ZINC001203452569 1048902711 /nfs/dbraw/zinc/90/27/11/1048902711.db2.gz PAECMEULIFARTA-UHFFFAOYSA-N 1 2 313.792 4.014 20 0 DIADLO CNc1ccc(Nc2cc(C(F)(F)F)c(F)cc2F)c[nH+]1 ZINC001203458864 1048905354 /nfs/dbraw/zinc/90/53/54/1048905354.db2.gz SBKMNSGZWHXJNA-UHFFFAOYSA-N 1 2 303.234 4.164 20 0 DIADLO CNc1ccc(Nc2ccc3sc(C(F)(F)F)nc3c2)c[nH+]1 ZINC001203459234 1048905800 /nfs/dbraw/zinc/90/58/00/1048905800.db2.gz GXHIZDMTMQSAME-UHFFFAOYSA-N 1 2 324.331 4.495 20 0 DIADLO CNc1ccc(Nc2ccc(OC3CCCC3)c(F)c2)c[nH+]1 ZINC001203462511 1048906558 /nfs/dbraw/zinc/90/65/58/1048906558.db2.gz VTHSEFSMSYBSJR-UHFFFAOYSA-N 1 2 301.365 4.327 20 0 DIADLO CNc1ccc(Nc2ccc(C(F)(F)F)c3ncccc23)c[nH+]1 ZINC001203461912 1048907465 /nfs/dbraw/zinc/90/74/65/1048907465.db2.gz FGOGUHINBNAFOE-UHFFFAOYSA-N 1 2 318.302 4.434 20 0 DIADLO COc1cc(CNc2[nH]c3cc(C)ccc3[nH+]2)ccc1Cl ZINC001203478595 1048908667 /nfs/dbraw/zinc/90/86/67/1048908667.db2.gz FFTSUHPLMBVOIR-UHFFFAOYSA-N 1 2 301.777 4.145 20 0 DIADLO C[C@H]([NH2+]Cc1nc2c(s1)CCCC2)c1cc(F)ccc1F ZINC000776687998 1048914530 /nfs/dbraw/zinc/91/45/30/1048914530.db2.gz YMFIHDMQQGTMKO-JTQLQIEISA-N 1 2 308.397 4.151 20 0 DIADLO CC(C)c1cccc(CO[NH+]=C(N)Cc2cccc(F)c2)c1 ZINC000853695387 1048915545 /nfs/dbraw/zinc/91/55/45/1048915545.db2.gz YUXUZQPUABBHQA-UHFFFAOYSA-N 1 2 300.377 4.190 20 0 DIADLO CN(Cc1ccccc1)c1ccc(Nc2ccc(O)c(F)c2)c[nH+]1 ZINC001203518841 1048916387 /nfs/dbraw/zinc/91/63/87/1048916387.db2.gz RRHPNVBUEWTHPE-UHFFFAOYSA-N 1 2 323.371 4.306 20 0 DIADLO Cc1cccn2c(CNc3[nH+]c4ccccc4n3C(C)C)cnc12 ZINC001203521146 1048917725 /nfs/dbraw/zinc/91/77/25/1048917725.db2.gz FKGWVFUDLQODOK-UHFFFAOYSA-N 1 2 319.412 4.185 20 0 DIADLO CC(C)CCn1c2ccccc2[nH+]c1NCc1ccc(F)nc1 ZINC001203536531 1048925271 /nfs/dbraw/zinc/92/52/71/1048925271.db2.gz XTZYEJTVXAREIV-UHFFFAOYSA-N 1 2 312.392 4.229 20 0 DIADLO FC(F)(F)c1ccc2c(cc[nH+]c2N[C@H]2COC3(CCC3)C2)c1 ZINC000853827521 1048927685 /nfs/dbraw/zinc/92/76/85/1048927685.db2.gz AVBUKULHGAZUTE-CYBMUJFWSA-N 1 2 322.330 4.377 20 0 DIADLO CC(C)(C)[C@@H](NC(=O)C[N@@H+]1CC(C)(C)C1(C)C)c1cccs1 ZINC001191390765 1048930366 /nfs/dbraw/zinc/93/03/66/1048930366.db2.gz OYPJYLBFOFVIJS-HNNXBMFYSA-N 1 2 322.518 4.072 20 0 DIADLO CC(C)(C)[C@@H](NC(=O)C[N@H+]1CC(C)(C)C1(C)C)c1cccs1 ZINC001191390765 1048930375 /nfs/dbraw/zinc/93/03/75/1048930375.db2.gz OYPJYLBFOFVIJS-HNNXBMFYSA-N 1 2 322.518 4.072 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@@H+]2CC[C@@H]2c2ccccc2)c1 ZINC001191391308 1048932616 /nfs/dbraw/zinc/93/26/16/1048932616.db2.gz WCYBGZYFRINMMG-OAHLLOKOSA-N 1 2 307.315 4.374 20 0 DIADLO Fc1ccc(OC(F)F)c(C[N@H+]2CC[C@@H]2c2ccccc2)c1 ZINC001191391308 1048932623 /nfs/dbraw/zinc/93/26/23/1048932623.db2.gz WCYBGZYFRINMMG-OAHLLOKOSA-N 1 2 307.315 4.374 20 0 DIADLO Cc1c[nH]c(C[NH2+]Cc2ccccc2Oc2ccc(C)cc2)n1 ZINC001177749347 1048938844 /nfs/dbraw/zinc/93/88/44/1048938844.db2.gz RDDMWBOUEMOXSG-UHFFFAOYSA-N 1 2 307.397 4.109 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2ncccc2OCc2ccccc2)c1 ZINC001203652765 1048948276 /nfs/dbraw/zinc/94/82/76/1048948276.db2.gz AQGVBGVWTDWJIH-UHFFFAOYSA-N 1 2 305.381 4.416 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2sc(-c3ccccc3)cc2C(N)=O)c1 ZINC001203656652 1048949955 /nfs/dbraw/zinc/94/99/55/1048949955.db2.gz ZCBZCLZCCYRPMS-UHFFFAOYSA-N 1 2 323.421 4.269 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2nc3cc(Br)ccc3o2)c1 ZINC001203654381 1048951356 /nfs/dbraw/zinc/95/13/56/1048951356.db2.gz IMAPDRPRUPJFPL-UHFFFAOYSA-N 1 2 318.174 4.346 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cnc(Br)c(Cl)c2)c1 ZINC001203656213 1048951587 /nfs/dbraw/zinc/95/15/87/1048951587.db2.gz MLJWKGWRGGNZPI-UHFFFAOYSA-N 1 2 312.598 4.253 20 0 DIADLO CCOC(=O)c1cc(Nc2cc(C)c[nH+]c2C)ccc1Cl ZINC001203663542 1048952637 /nfs/dbraw/zinc/95/26/37/1048952637.db2.gz PBXKQFJDFSSCDJ-UHFFFAOYSA-N 1 2 304.777 4.272 20 0 DIADLO CC(=O)c1ccc(Nc2cc(C)c[nH+]c2C)c(Br)c1 ZINC001203663635 1048954832 /nfs/dbraw/zinc/95/48/32/1048954832.db2.gz VAZKFPNBEXOINK-UHFFFAOYSA-N 1 2 319.202 4.407 20 0 DIADLO COC(=O)c1cc(Nc2cc(C)c[nH+]c2C)c(F)cc1Cl ZINC001203663792 1048954911 /nfs/dbraw/zinc/95/49/11/1048954911.db2.gz ROPDOQXXVHBPJP-UHFFFAOYSA-N 1 2 308.740 4.021 20 0 DIADLO C[C@@H]([NH2+]Cc1c(F)c(F)c(F)c(F)c1F)c1cccs1 ZINC000776722188 1048955078 /nfs/dbraw/zinc/95/50/78/1048955078.db2.gz FLKJSPKFGBMDHY-ZCFIWIBFSA-N 1 2 307.287 4.294 20 0 DIADLO Cc1c[nH+]c(C)c(Nc2cccc(C)c2N2CCCCC2=O)c1 ZINC001203667937 1048956065 /nfs/dbraw/zinc/95/60/65/1048956065.db2.gz QWODERLVAXGVNV-UHFFFAOYSA-N 1 2 309.413 4.267 20 0 DIADLO CC(=O)c1cc(Nc2cc(C)c[nH+]c2C)ccc1Br ZINC001203668813 1048956768 /nfs/dbraw/zinc/95/67/68/1048956768.db2.gz ZTNUCHXDLCSGEJ-UHFFFAOYSA-N 1 2 319.202 4.407 20 0 DIADLO Cc1cc(C)c2cc(NCc3cn4ccccc4n3)ccc2[nH+]1 ZINC001203677069 1048958254 /nfs/dbraw/zinc/95/82/54/1048958254.db2.gz YXUQSRKCLJSNOA-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO Cc1cc(C)c2cc(NCc3cnn4ccccc34)ccc2[nH+]1 ZINC001203676442 1048959416 /nfs/dbraw/zinc/95/94/16/1048959416.db2.gz MVAUHPAUGSDLLC-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO COc1ccc(OC)c(C[NH2+][C@H](C)c2c(F)cccc2Cl)c1 ZINC001177962815 1048961753 /nfs/dbraw/zinc/96/17/53/1048961753.db2.gz SWXWOBCHKLDMSK-LLVKDONJSA-N 1 2 323.795 4.347 20 0 DIADLO FC(F)(F)c1cc(Nc2ccc([NH+]3CCCCC3)cc2)on1 ZINC001203713265 1048973139 /nfs/dbraw/zinc/97/31/39/1048973139.db2.gz WCWOCKONHXNXPO-UHFFFAOYSA-N 1 2 311.307 4.427 20 0 DIADLO Cc1cn2cccc(Nc3ccc([NH+]4CCCCC4)cc3)c2n1 ZINC001203717906 1048975624 /nfs/dbraw/zinc/97/56/24/1048975624.db2.gz OLXGYTJIOQBDMQ-UHFFFAOYSA-N 1 2 306.413 4.377 20 0 DIADLO CC(=O)c1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1O ZINC001203718835 1048976782 /nfs/dbraw/zinc/97/67/82/1048976782.db2.gz CUTUIOKUPPHMCG-UHFFFAOYSA-N 1 2 310.397 4.329 20 0 DIADLO Nc1cc(F)cc(F)c1Nc1ccc([NH+]2CCCCC2)cc1 ZINC001203718876 1048977227 /nfs/dbraw/zinc/97/72/27/1048977227.db2.gz GOFGULQQMSTOIM-UHFFFAOYSA-N 1 2 303.356 4.281 20 0 DIADLO O=c1[nH]ccc2cc(Nc3ccc([NH+]4CCCCC4)cc3)ccc21 ZINC001203719552 1048977960 /nfs/dbraw/zinc/97/79/60/1048977960.db2.gz PMDICVDJROUQLV-UHFFFAOYSA-N 1 2 319.408 4.262 20 0 DIADLO O[C@H]1CCOc2c(Nc3ccc([NH+]4CCCCC4)cc3)cccc21 ZINC001203724968 1048982057 /nfs/dbraw/zinc/98/20/57/1048982057.db2.gz YPQVJGANQKZQGU-IBGZPJMESA-N 1 2 324.424 4.236 20 0 DIADLO CC(=O)Oc1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1 ZINC001203724393 1048982614 /nfs/dbraw/zinc/98/26/14/1048982614.db2.gz MBMCSXJGLSYCHF-UHFFFAOYSA-N 1 2 310.397 4.346 20 0 DIADLO c1cnn(-c2ccc(Nc3ccc([NH+]4CCCCC4)cc3)cc2)n1 ZINC001203724450 1048982775 /nfs/dbraw/zinc/98/27/75/1048982775.db2.gz ONOOZTFSRLRNGH-UHFFFAOYSA-N 1 2 319.412 4.001 20 0 DIADLO CCO[C@H](c1noc([C@H]2CC[N@@H+]2C2CCCC2)n1)C1CCCC1 ZINC000904136238 1048984919 /nfs/dbraw/zinc/98/49/19/1048984919.db2.gz JNTVGNXUJNNFOK-CVEARBPZSA-N 1 2 319.449 4.027 20 0 DIADLO CCO[C@H](c1noc([C@H]2CC[N@H+]2C2CCCC2)n1)C1CCCC1 ZINC000904136238 1048984928 /nfs/dbraw/zinc/98/49/28/1048984928.db2.gz JNTVGNXUJNNFOK-CVEARBPZSA-N 1 2 319.449 4.027 20 0 DIADLO CCOc1ccc(CNc2[nH+]c3ccccc3n2CC2CC2)o1 ZINC001203740256 1048987599 /nfs/dbraw/zinc/98/75/99/1048987599.db2.gz LUKVKHVXWIGIAI-UHFFFAOYSA-N 1 2 311.385 4.050 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)cc1F ZINC001203796788 1048999387 /nfs/dbraw/zinc/99/93/87/1048999387.db2.gz YCHDPRJAQUVOSB-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)cc1F ZINC001203796788 1048999392 /nfs/dbraw/zinc/99/93/92/1048999392.db2.gz YCHDPRJAQUVOSB-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO CCN(CC)c1ccc(NCc2nc(C(C)(C)C)cs2)c[nH+]1 ZINC001178254703 1049004042 /nfs/dbraw/zinc/00/40/42/1049004042.db2.gz XJKLXOOBNXQHDR-UHFFFAOYSA-N 1 2 318.490 4.294 20 0 DIADLO CCC1(CC)CC[NH+](Cn2ncn(C(C)(C)C)c2=S)CC1 ZINC000776773403 1049004876 /nfs/dbraw/zinc/00/48/76/1049004876.db2.gz XAAFPUKCYFRLGX-UHFFFAOYSA-N 1 2 310.511 4.029 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1noc([C@H]2CCC[C@@H]2c2ccccc2)n1 ZINC000904263479 1049007273 /nfs/dbraw/zinc/00/72/73/1049007273.db2.gz ZUDUPSIEPRSFKS-CVEARBPZSA-N 1 2 320.396 4.074 20 0 DIADLO CC[C@@H]([NH2+]c1ccc(N2CCCCC2)cc1)C1CCOCC1 ZINC000776795241 1049012570 /nfs/dbraw/zinc/01/25/70/1049012570.db2.gz QODNJJLQFNUVOS-LJQANCHMSA-N 1 2 302.462 4.294 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1cccc(C(F)(F)F)c1)CC2 ZINC001203885501 1049023988 /nfs/dbraw/zinc/02/39/88/1049023988.db2.gz OIXBFNQZGRQCRA-UHFFFAOYSA-N 1 2 321.342 4.272 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1cccc(C(F)(F)F)c1)CC2 ZINC001203885501 1049023998 /nfs/dbraw/zinc/02/39/98/1049023998.db2.gz OIXBFNQZGRQCRA-UHFFFAOYSA-N 1 2 321.342 4.272 20 0 DIADLO CCCN(C(=O)c1cccc2[nH+]ccn21)[C@H](CC)c1ccccc1 ZINC000776805128 1049025916 /nfs/dbraw/zinc/02/59/16/1049025916.db2.gz KWYDXKQCRXQUHS-QGZVFWFLSA-N 1 2 321.424 4.338 20 0 DIADLO CCCCN(C(=O)c1cccc2[nH+]ccn21)[C@H](C)c1ccccc1 ZINC000776804021 1049025951 /nfs/dbraw/zinc/02/59/51/1049025951.db2.gz AGGNOKDELMMDFS-MRXNPFEDSA-N 1 2 321.424 4.338 20 0 DIADLO Clc1ccc(C[N@H+](Cc2cccnc2)Cc2ccccn2)cc1 ZINC001203921576 1049033192 /nfs/dbraw/zinc/03/31/92/1049033192.db2.gz RLHCLQNJIOLTRZ-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO Clc1ccc(C[N@@H+](Cc2cccnc2)Cc2ccccn2)cc1 ZINC001203921576 1049033201 /nfs/dbraw/zinc/03/32/01/1049033201.db2.gz RLHCLQNJIOLTRZ-UHFFFAOYSA-N 1 2 323.827 4.332 20 0 DIADLO C[C@@H]1CCN(CCCn2cc[nH+]c2)c2cc(Cl)ccc2S1 ZINC001192043937 1049034059 /nfs/dbraw/zinc/03/40/59/1049034059.db2.gz YJIDJZPSNBHEDU-CYBMUJFWSA-N 1 2 321.877 4.318 20 0 DIADLO COc1ccc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)cc1 ZINC001203956250 1049042719 /nfs/dbraw/zinc/04/27/19/1049042719.db2.gz LLKRUPOQEWAXIG-UHFFFAOYSA-N 1 2 321.342 4.272 20 0 DIADLO COc1ccc(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)cc1 ZINC001203956250 1049042731 /nfs/dbraw/zinc/04/27/31/1049042731.db2.gz LLKRUPOQEWAXIG-UHFFFAOYSA-N 1 2 321.342 4.272 20 0 DIADLO COc1ccnc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2Cl)c1 ZINC000925489116 1049045454 /nfs/dbraw/zinc/04/54/54/1049045454.db2.gz NOMCNUPDGUSWDD-QWRGUYRKSA-N 1 2 308.784 4.295 20 0 DIADLO c1ncc(CNc2[nH+]c3ccccc3n2-c2ccccc2)s1 ZINC000195052275 1049046165 /nfs/dbraw/zinc/04/61/65/1049046165.db2.gz WEVNXTOHOINVJB-UHFFFAOYSA-N 1 2 306.394 4.094 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cncc(Br)c2Cl)[C@H]1C ZINC001250464988 1049074357 /nfs/dbraw/zinc/07/43/57/1049074357.db2.gz PBXXLCBSMHWLAK-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO Cc1ccsc1C[N@H+](Cc1cccnc1)Cc1ccccn1 ZINC001204020839 1049062630 /nfs/dbraw/zinc/06/26/30/1049062630.db2.gz KQYGODAVGIZBBN-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1ccsc1C[N@@H+](Cc1cccnc1)Cc1ccccn1 ZINC001204020839 1049062640 /nfs/dbraw/zinc/06/26/40/1049062640.db2.gz KQYGODAVGIZBBN-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccnc(Cl)c1 ZINC000776846725 1049068902 /nfs/dbraw/zinc/06/89/02/1049068902.db2.gz FYOSZJWQTHDTEP-CYBMUJFWSA-N 1 2 316.836 4.293 20 0 DIADLO Brc1ccc2c(c1)C[N@@H+](Cc1ccsc1)CC2 ZINC001204040276 1049069200 /nfs/dbraw/zinc/06/92/00/1049069200.db2.gz QSCHGXMUDSXMFY-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Brc1ccc2c(c1)C[N@H+](Cc1ccsc1)CC2 ZINC001204040276 1049069217 /nfs/dbraw/zinc/06/92/17/1049069217.db2.gz QSCHGXMUDSXMFY-UHFFFAOYSA-N 1 2 308.244 4.069 20 0 DIADLO Cc1ccc(C[N@H+](Cc2cccnc2)Cc2ccccn2)s1 ZINC001204034213 1049069356 /nfs/dbraw/zinc/06/93/56/1049069356.db2.gz FNMOLKMRNXKMEC-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1ccc(C[N@@H+](Cc2cccnc2)Cc2ccccn2)s1 ZINC001204034213 1049069371 /nfs/dbraw/zinc/06/93/71/1049069371.db2.gz FNMOLKMRNXKMEC-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO CCCCOc1ccc(NC(=O)c2cccc3[nH+]ccn32)c(C)c1 ZINC000776843682 1049069405 /nfs/dbraw/zinc/06/94/05/1049069405.db2.gz ZZHZRTAKMHSYOK-UHFFFAOYSA-N 1 2 323.396 4.074 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cncc(Br)c2Cl)[C@H]1C ZINC001250464988 1049074343 /nfs/dbraw/zinc/07/43/43/1049074343.db2.gz PBXXLCBSMHWLAK-ZJUUUORDSA-N 1 2 317.658 4.118 20 0 DIADLO CCOc1cccc(CNc2[nH+]c3cc(Cl)ccc3n2C)c1 ZINC001204079138 1049078992 /nfs/dbraw/zinc/07/89/92/1049078992.db2.gz IXFFWLCXNSZUNM-UHFFFAOYSA-N 1 2 315.804 4.238 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)Cc3csc4ccccc34)cc2[nH+]1 ZINC000338987644 1049079969 /nfs/dbraw/zinc/07/99/69/1049079969.db2.gz DHPOWAWFCDKINR-UHFFFAOYSA-N 1 2 321.405 4.267 20 0 DIADLO CCOc1ccccc1CNc1[nH+]c2cc(Cl)ccc2n1C ZINC001204078705 1049080154 /nfs/dbraw/zinc/08/01/54/1049080154.db2.gz FNHRULYUZRDRQZ-UHFFFAOYSA-N 1 2 315.804 4.238 20 0 DIADLO C[C@H](c1nc(-c2ccccc2)no1)[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000484922769 1049082175 /nfs/dbraw/zinc/08/21/75/1049082175.db2.gz CRURZBYMGNIELT-RHSMWYFYSA-N 1 2 305.381 4.245 20 0 DIADLO C[C@H](c1nc(-c2ccccc2)no1)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000484922769 1049082186 /nfs/dbraw/zinc/08/21/86/1049082186.db2.gz CRURZBYMGNIELT-RHSMWYFYSA-N 1 2 305.381 4.245 20 0 DIADLO COC(=O)c1occc1C[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC000338990088 1049082513 /nfs/dbraw/zinc/08/25/13/1049082513.db2.gz KFNWZLIWUBEJJS-HNNXBMFYSA-N 1 2 319.788 4.057 20 0 DIADLO COC(=O)c1occc1C[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000338990088 1049082529 /nfs/dbraw/zinc/08/25/29/1049082529.db2.gz KFNWZLIWUBEJJS-HNNXBMFYSA-N 1 2 319.788 4.057 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1Cc1cncc(Cl)c1 ZINC001192301872 1049083440 /nfs/dbraw/zinc/08/34/40/1049083440.db2.gz CWGOTUBBVXYXTD-VXGBXAGGSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1Cc1cncc(Cl)c1 ZINC001192301872 1049083450 /nfs/dbraw/zinc/08/34/50/1049083450.db2.gz CWGOTUBBVXYXTD-VXGBXAGGSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H](c1nc(-c2cccs2)no1)[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000484926751 1049086176 /nfs/dbraw/zinc/08/61/76/1049086176.db2.gz MIYTVPSTZXTJKM-GXTWGEPZSA-N 1 2 311.410 4.306 20 0 DIADLO C[C@@H](c1nc(-c2cccs2)no1)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000484926751 1049086188 /nfs/dbraw/zinc/08/61/88/1049086188.db2.gz MIYTVPSTZXTJKM-GXTWGEPZSA-N 1 2 311.410 4.306 20 0 DIADLO Cc1noc([C@@H]([NH2+]Cc2cc(C(C)(C)C)oc2C)C(C)C)n1 ZINC001204128129 1049091757 /nfs/dbraw/zinc/09/17/57/1049091757.db2.gz IJHGGBAWHPNKQM-HNNXBMFYSA-N 1 2 305.422 4.064 20 0 DIADLO CC[C@H]1CCC[N@H+](Cc2cncc(Br)c2Cl)C1 ZINC001250470297 1049096548 /nfs/dbraw/zinc/09/65/48/1049096548.db2.gz KNVMYUQMYBJSPQ-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@H]1CCC[N@@H+](Cc2cncc(Br)c2Cl)C1 ZINC001250470297 1049096563 /nfs/dbraw/zinc/09/65/63/1049096563.db2.gz KNVMYUQMYBJSPQ-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CC(C)(C)CN(Cc1ccccc1)C(=O)c1cccc2[nH+]ccn21 ZINC000776892949 1049100397 /nfs/dbraw/zinc/10/03/97/1049100397.db2.gz JDKKCPFSNXZIKJ-UHFFFAOYSA-N 1 2 321.424 4.023 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1ccc(C(F)(F)F)cc1)C2 ZINC001204165587 1049103126 /nfs/dbraw/zinc/10/31/26/1049103126.db2.gz GUYMMURHPVIQQH-UHFFFAOYSA-N 1 2 307.315 4.230 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1ccc(C(F)(F)F)cc1)C2 ZINC001204165587 1049103130 /nfs/dbraw/zinc/10/31/30/1049103130.db2.gz GUYMMURHPVIQQH-UHFFFAOYSA-N 1 2 307.315 4.230 20 0 DIADLO ClC(Cl)=CC[N@@H+]1CC[C@H](Oc2ccccc2Cl)C1 ZINC001192443367 1049105747 /nfs/dbraw/zinc/10/57/47/1049105747.db2.gz MQLVXXASFDLQML-JTQLQIEISA-N 1 2 306.620 4.112 20 0 DIADLO ClC(Cl)=CC[N@H+]1CC[C@H](Oc2ccccc2Cl)C1 ZINC001192443367 1049105752 /nfs/dbraw/zinc/10/57/52/1049105752.db2.gz MQLVXXASFDLQML-JTQLQIEISA-N 1 2 306.620 4.112 20 0 DIADLO CC(C)[N@H+](CC(=O)c1ccccc1)Cc1ccc(F)c(F)c1 ZINC001204227784 1049116725 /nfs/dbraw/zinc/11/67/25/1049116725.db2.gz KVVJOMCLMWNXNV-UHFFFAOYSA-N 1 2 303.352 4.058 20 0 DIADLO CC(C)[N@@H+](CC(=O)c1ccccc1)Cc1ccc(F)c(F)c1 ZINC001204227784 1049116732 /nfs/dbraw/zinc/11/67/32/1049116732.db2.gz KVVJOMCLMWNXNV-UHFFFAOYSA-N 1 2 303.352 4.058 20 0 DIADLO CCc1nc2ccc(NCc3c[nH+]c4ccc(C)cn34)cc2s1 ZINC001179024227 1049116964 /nfs/dbraw/zinc/11/69/64/1049116964.db2.gz CBQPGASMYRKCDE-UHFFFAOYSA-N 1 2 322.437 4.427 20 0 DIADLO CC[N@H+](Cc1cnn(CC2CCC2)c1)Cc1ccccc1Cl ZINC001204261912 1049123517 /nfs/dbraw/zinc/12/35/17/1049123517.db2.gz RQMSFFGTGYVZNV-UHFFFAOYSA-N 1 2 317.864 4.359 20 0 DIADLO CC[N@@H+](Cc1cnn(CC2CCC2)c1)Cc1ccccc1Cl ZINC001204261912 1049123519 /nfs/dbraw/zinc/12/35/19/1049123519.db2.gz RQMSFFGTGYVZNV-UHFFFAOYSA-N 1 2 317.864 4.359 20 0 DIADLO Cc1cncc(C[N@H+](C)Cc2sc3ccccc3c2Cl)n1 ZINC001203173073 1049125376 /nfs/dbraw/zinc/12/53/76/1049125376.db2.gz ARBBTABONWUFFD-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO Cc1cncc(C[N@@H+](C)Cc2sc3ccccc3c2Cl)n1 ZINC001203173073 1049125382 /nfs/dbraw/zinc/12/53/82/1049125382.db2.gz ARBBTABONWUFFD-UHFFFAOYSA-N 1 2 317.845 4.285 20 0 DIADLO CC[N@@H+](Cc1ccsc1Cl)C[C@H]1COc2ccccc2O1 ZINC001204269940 1049125872 /nfs/dbraw/zinc/12/58/72/1049125872.db2.gz GUGJQNPFHJTIMU-ZDUSSCGKSA-N 1 2 323.845 4.063 20 0 DIADLO CC[N@H+](Cc1ccsc1Cl)C[C@H]1COc2ccccc2O1 ZINC001204269940 1049125875 /nfs/dbraw/zinc/12/58/75/1049125875.db2.gz GUGJQNPFHJTIMU-ZDUSSCGKSA-N 1 2 323.845 4.063 20 0 DIADLO COc1cccc2c1CC[N@H+](Cc1ccc(F)c(Cl)c1)C2 ZINC001204285352 1049127931 /nfs/dbraw/zinc/12/79/31/1049127931.db2.gz ZIFVRSWJFBDOIB-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc2c1CC[N@@H+](Cc1ccc(F)c(Cl)c1)C2 ZINC001204285352 1049127937 /nfs/dbraw/zinc/12/79/37/1049127937.db2.gz ZIFVRSWJFBDOIB-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO CC[C@@H]([NH2+]CC(=O)c1ccccc1F)c1ccc(F)cc1F ZINC001192689595 1049130688 /nfs/dbraw/zinc/13/06/88/1049130688.db2.gz JHGJUALGLMOJPO-MRXNPFEDSA-N 1 2 307.315 4.028 20 0 DIADLO CCCCCCOc1ccccc1C[N@H+](C)Cc1cncnc1 ZINC001204294192 1049132745 /nfs/dbraw/zinc/13/27/45/1049132745.db2.gz OESNOUZLUNOVIQ-UHFFFAOYSA-N 1 2 313.445 4.068 20 0 DIADLO CCCCCCOc1ccccc1C[N@@H+](C)Cc1cncnc1 ZINC001204294192 1049132749 /nfs/dbraw/zinc/13/27/49/1049132749.db2.gz OESNOUZLUNOVIQ-UHFFFAOYSA-N 1 2 313.445 4.068 20 0 DIADLO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1c(F)ccc(C)c1F ZINC001192662599 1049133157 /nfs/dbraw/zinc/13/31/57/1049133157.db2.gz PTZGWWJDHOLSHG-NSHDSACASA-N 1 2 309.331 4.272 20 0 DIADLO CCC(F)(F)C[NH2+]Cc1ccc(NC(=O)OC(C)(C)C)cc1 ZINC001179164969 1049137681 /nfs/dbraw/zinc/13/76/81/1049137681.db2.gz GPJWVQXQJPKPFK-UHFFFAOYSA-N 1 2 314.376 4.169 20 0 DIADLO Cc1cn2cc(-c3cc(C4CC4)nn3[C@H]3CCCCO3)ccc2[nH+]1 ZINC000904782359 1049147369 /nfs/dbraw/zinc/14/73/69/1049147369.db2.gz QKKVLEJXXHXEMG-LJQANCHMSA-N 1 2 322.412 4.083 20 0 DIADLO Cc1ccc2cnccc2c1NCc1cc(-n2cc[nH+]c2)cs1 ZINC001179359334 1049161324 /nfs/dbraw/zinc/16/13/24/1049161324.db2.gz SYYKLHWPMULNLX-UHFFFAOYSA-N 1 2 320.421 4.403 20 0 DIADLO COc1ccc(CNc2c[nH+]c(C)c(C)c2)cc1OCC(C)C ZINC001179447740 1049166375 /nfs/dbraw/zinc/16/63/75/1049166375.db2.gz QCWMIXYKBAUOIW-UHFFFAOYSA-N 1 2 314.429 4.354 20 0 DIADLO Fc1cccc(C(F)(F)F)c1C[N@@H+]1CCc2ccsc2C1 ZINC001204463302 1049168070 /nfs/dbraw/zinc/16/80/70/1049168070.db2.gz NDSWJSCIDFIIGF-UHFFFAOYSA-N 1 2 315.335 4.464 20 0 DIADLO Fc1cccc(C(F)(F)F)c1C[N@H+]1CCc2ccsc2C1 ZINC001204463302 1049168074 /nfs/dbraw/zinc/16/80/74/1049168074.db2.gz NDSWJSCIDFIIGF-UHFFFAOYSA-N 1 2 315.335 4.464 20 0 DIADLO C[N@H+](Cc1cccc(O)c1)Cc1ccc(C(F)(F)F)cc1F ZINC001204462904 1049168653 /nfs/dbraw/zinc/16/86/53/1049168653.db2.gz AXHGNCVRLYYDPQ-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO C[N@@H+](Cc1cccc(O)c1)Cc1ccc(C(F)(F)F)cc1F ZINC001204462904 1049168661 /nfs/dbraw/zinc/16/86/61/1049168661.db2.gz AXHGNCVRLYYDPQ-UHFFFAOYSA-N 1 2 313.294 4.182 20 0 DIADLO Fc1ccc(CNc2[nH+]c3ccccc3n2C2CC2)c(F)c1F ZINC001179489010 1049171325 /nfs/dbraw/zinc/17/13/25/1049171325.db2.gz DMVJQUGDVKCYFT-UHFFFAOYSA-N 1 2 317.314 4.401 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3cnc4c(ccc(F)c4F)c3)n2c1 ZINC001179516162 1049172311 /nfs/dbraw/zinc/17/23/11/1049172311.db2.gz QXDJFQAAIHTOKO-UHFFFAOYSA-N 1 2 324.334 4.081 20 0 DIADLO Clc1cnc(C[NH2+]Cc2cc(Cl)cc3cccnc32)s1 ZINC001179512027 1049177461 /nfs/dbraw/zinc/17/74/61/1049177461.db2.gz LKDJQTJEXQIHOH-UHFFFAOYSA-N 1 2 324.236 4.288 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ncc(-c2ccccc2)o1)c1ccc(F)nc1 ZINC001193103619 1049179059 /nfs/dbraw/zinc/17/90/59/1049179059.db2.gz JZECCRDGIMZBQZ-OLZOCXBDSA-N 1 2 311.360 4.288 20 0 DIADLO Cc1cc(C)cc(C[N@H+](Cc2cccnc2)Cc2ccccn2)c1 ZINC001204522494 1049180251 /nfs/dbraw/zinc/18/02/51/1049180251.db2.gz MFILAQNFQNPWKI-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO Cc1cc(C)cc(C[N@@H+](Cc2cccnc2)Cc2ccccn2)c1 ZINC001204522494 1049180256 /nfs/dbraw/zinc/18/02/56/1049180256.db2.gz MFILAQNFQNPWKI-UHFFFAOYSA-N 1 2 317.436 4.296 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(F)c(F)c(F)c1 ZINC001204528132 1049182571 /nfs/dbraw/zinc/18/25/71/1049182571.db2.gz RBXCBITVKCEYAD-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc(F)c(F)c(F)c1 ZINC001204528132 1049182577 /nfs/dbraw/zinc/18/25/77/1049182577.db2.gz RBXCBITVKCEYAD-INIZCTEOSA-N 1 2 321.342 4.450 20 0 DIADLO Fc1cc(C[N@H+]2CC=C(c3ccccc3)CC2)cc(F)c1F ZINC001204529945 1049182882 /nfs/dbraw/zinc/18/28/82/1049182882.db2.gz RJELCQIMAXEMTN-UHFFFAOYSA-N 1 2 303.327 4.393 20 0 DIADLO Fc1cc(C[N@@H+]2CC=C(c3ccccc3)CC2)cc(F)c1F ZINC001204529945 1049182890 /nfs/dbraw/zinc/18/28/90/1049182890.db2.gz RJELCQIMAXEMTN-UHFFFAOYSA-N 1 2 303.327 4.393 20 0 DIADLO CCCc1cccc(C[N@@H+]2CCO[C@H](c3ccccc3F)C2)c1 ZINC001204534442 1049184688 /nfs/dbraw/zinc/18/46/88/1049184688.db2.gz RQIPJKKUUNFPQU-FQEVSTJZSA-N 1 2 313.416 4.352 20 0 DIADLO CCCc1cccc(C[N@H+]2CCO[C@H](c3ccccc3F)C2)c1 ZINC001204534442 1049184693 /nfs/dbraw/zinc/18/46/93/1049184693.db2.gz RQIPJKKUUNFPQU-FQEVSTJZSA-N 1 2 313.416 4.352 20 0 DIADLO CC[N@H+](Cc1nccs1)Cc1cccc(C(F)(F)F)c1 ZINC001204549031 1049187533 /nfs/dbraw/zinc/18/75/33/1049187533.db2.gz CCFDKCYMDZFZSG-UHFFFAOYSA-N 1 2 300.349 4.184 20 0 DIADLO CC[N@@H+](Cc1nccs1)Cc1cccc(C(F)(F)F)c1 ZINC001204549031 1049187537 /nfs/dbraw/zinc/18/75/37/1049187537.db2.gz CCFDKCYMDZFZSG-UHFFFAOYSA-N 1 2 300.349 4.184 20 0 DIADLO COc1cc(C[N@@H+]2CCc3cccc(Cl)c3C2)ccc1F ZINC001204563787 1049189273 /nfs/dbraw/zinc/18/92/73/1049189273.db2.gz OQVMMTACEWMXRE-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cc(C[N@H+]2CCc3cccc(Cl)c3C2)ccc1F ZINC001204563787 1049189279 /nfs/dbraw/zinc/18/92/79/1049189279.db2.gz OQVMMTACEWMXRE-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO Fc1cc(Br)cc([C@@H]2CCC[N@@H+]2C/C=C\Cl)c1 ZINC001193189172 1049190767 /nfs/dbraw/zinc/19/07/67/1049190767.db2.gz XARZUIRZVNYCEC-LSYFEZSPSA-N 1 2 318.617 4.478 20 0 DIADLO Fc1cc(Br)cc([C@@H]2CCC[N@H+]2C/C=C\Cl)c1 ZINC001193189172 1049190774 /nfs/dbraw/zinc/19/07/74/1049190774.db2.gz XARZUIRZVNYCEC-LSYFEZSPSA-N 1 2 318.617 4.478 20 0 DIADLO Cc1nc[nH]c1C[N@@H+](C)Cc1ccccc1Oc1ccccc1 ZINC001204591776 1049193765 /nfs/dbraw/zinc/19/37/65/1049193765.db2.gz HYHVFPNOSALVKX-UHFFFAOYSA-N 1 2 307.397 4.142 20 0 DIADLO Cc1nc[nH]c1C[N@H+](C)Cc1ccccc1Oc1ccccc1 ZINC001204591776 1049193770 /nfs/dbraw/zinc/19/37/70/1049193770.db2.gz HYHVFPNOSALVKX-UHFFFAOYSA-N 1 2 307.397 4.142 20 0 DIADLO COc1cccc(F)c1C[NH2+]Cc1cccc(Cl)c1Cl ZINC001179681580 1049196873 /nfs/dbraw/zinc/19/68/73/1049196873.db2.gz NOAPOPJBVSVRBA-UHFFFAOYSA-N 1 2 314.187 4.431 20 0 DIADLO Fc1ccc([C@@H]([NH2+][C@@H]2CCCc3cn[nH]c32)c2ccccc2)cc1 ZINC000857850488 1049201103 /nfs/dbraw/zinc/20/11/03/1049201103.db2.gz STRCXJWGMDOQES-MOPGFXCFSA-N 1 2 321.399 4.305 20 0 DIADLO Fc1ccc([C@@H]([NH2+][C@@H]2CCCc3c[nH]nc32)c2ccccc2)cc1 ZINC000857850488 1049201114 /nfs/dbraw/zinc/20/11/14/1049201114.db2.gz STRCXJWGMDOQES-MOPGFXCFSA-N 1 2 321.399 4.305 20 0 DIADLO C[C@H](c1ccc(C[N@@H+]2Cc3ccncc3C2)cc1)C(F)(F)F ZINC000857882337 1049203995 /nfs/dbraw/zinc/20/39/95/1049203995.db2.gz QVAWPXLKMYBDHO-GFCCVEGCSA-N 1 2 306.331 4.263 20 0 DIADLO C[C@H](c1ccc(C[N@H+]2Cc3ccncc3C2)cc1)C(F)(F)F ZINC000857882337 1049204004 /nfs/dbraw/zinc/20/40/04/1049204004.db2.gz QVAWPXLKMYBDHO-GFCCVEGCSA-N 1 2 306.331 4.263 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000857865649 1049204888 /nfs/dbraw/zinc/20/48/88/1049204888.db2.gz PPSXSGNGBXKEFW-CABCVRRESA-N 1 2 323.362 4.379 20 0 DIADLO c1ccc2c(c1)cccc2OCCC[N@@H+]1Cc2ccncc2C1 ZINC000857874706 1049205223 /nfs/dbraw/zinc/20/52/23/1049205223.db2.gz BAGNGBZLUHZUAH-UHFFFAOYSA-N 1 2 304.393 4.020 20 0 DIADLO c1ccc2c(c1)cccc2OCCC[N@H+]1Cc2ccncc2C1 ZINC000857874706 1049205236 /nfs/dbraw/zinc/20/52/36/1049205236.db2.gz BAGNGBZLUHZUAH-UHFFFAOYSA-N 1 2 304.393 4.020 20 0 DIADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000857865652 1049205905 /nfs/dbraw/zinc/20/59/05/1049205905.db2.gz PPSXSGNGBXKEFW-GJZGRUSLSA-N 1 2 323.362 4.379 20 0 DIADLO COc1ccc(C)cc1CNc1[nH+]c2cc(Cl)ccc2n1C ZINC001179809923 1049209641 /nfs/dbraw/zinc/20/96/41/1049209641.db2.gz ITEODGDDIBQYQJ-UHFFFAOYSA-N 1 2 315.804 4.156 20 0 DIADLO CC1(C)C[N@H+](Cc2cscc2C(F)(F)F)C(C)(C)CO1 ZINC001204648381 1049210536 /nfs/dbraw/zinc/21/05/36/1049210536.db2.gz RPMMAMVXDGZMFC-UHFFFAOYSA-N 1 2 307.381 4.156 20 0 DIADLO CC1(C)C[N@@H+](Cc2cscc2C(F)(F)F)C(C)(C)CO1 ZINC001204648381 1049210547 /nfs/dbraw/zinc/21/05/47/1049210547.db2.gz RPMMAMVXDGZMFC-UHFFFAOYSA-N 1 2 307.381 4.156 20 0 DIADLO CC(C)[C@H]1CN(C(=O)Nc2ccn3cc[nH+]c3c2)c2ccccc21 ZINC001204648285 1049210821 /nfs/dbraw/zinc/21/08/21/1049210821.db2.gz HDPBYXDIMYVSMU-MRXNPFEDSA-N 1 2 320.396 4.126 20 0 DIADLO CC(C)[C@@H]1CN(C(=O)Nc2ccn3cc[nH+]c3c2)c2ccccc21 ZINC001204648284 1049211129 /nfs/dbraw/zinc/21/11/29/1049211129.db2.gz HDPBYXDIMYVSMU-INIZCTEOSA-N 1 2 320.396 4.126 20 0 DIADLO C[C@H]([NH2+]Cc1c(F)cccc1F)c1cc(F)ccc1N(C)C ZINC001179830062 1049211431 /nfs/dbraw/zinc/21/14/31/1049211431.db2.gz JZEAFJSYAIZVTC-NSHDSACASA-N 1 2 308.347 4.021 20 0 DIADLO Cc1cc(C[NH2+][C@H](C)c2ccccn2)c(Br)cc1F ZINC000858086438 1049214645 /nfs/dbraw/zinc/21/46/45/1049214645.db2.gz IIVCCEJDZCDLTR-LLVKDONJSA-N 1 2 323.209 4.142 20 0 DIADLO COC(=O)[C@@H]([NH3+])c1ccc(-c2cc(C(C)C)ccc2Cl)cc1 ZINC001204693953 1049228528 /nfs/dbraw/zinc/22/85/28/1049228528.db2.gz NIZISLUHAWDREB-KRWDZBQOSA-N 1 2 317.816 4.303 20 0 DIADLO CCOC(=O)[C@H]1CCC[N@@H+]1Cc1cc(Cl)cc2ccccc21 ZINC001193626400 1049233010 /nfs/dbraw/zinc/23/30/10/1049233010.db2.gz ISVPNLKGIOAYMO-QGZVFWFLSA-N 1 2 317.816 4.021 20 0 DIADLO CCOC(=O)[C@H]1CCC[N@H+]1Cc1cc(Cl)cc2ccccc21 ZINC001193626400 1049233020 /nfs/dbraw/zinc/23/30/20/1049233020.db2.gz ISVPNLKGIOAYMO-QGZVFWFLSA-N 1 2 317.816 4.021 20 0 DIADLO Fc1ccc(/C=C\C[N@@H+]2CCc3c(F)ccc(F)c3C2)cc1F ZINC001179942409 1049234222 /nfs/dbraw/zinc/23/42/22/1049234222.db2.gz PXJBZXJROCJAJB-UPHRSURJSA-N 1 2 321.317 4.315 20 0 DIADLO Fc1ccc(/C=C\C[N@H+]2CCc3c(F)ccc(F)c3C2)cc1F ZINC001179942409 1049234231 /nfs/dbraw/zinc/23/42/31/1049234231.db2.gz PXJBZXJROCJAJB-UPHRSURJSA-N 1 2 321.317 4.315 20 0 DIADLO Cc1cc(C)cc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3F)C2)c1 ZINC001193605270 1049239423 /nfs/dbraw/zinc/23/94/23/1049239423.db2.gz JDZDJIPFDBXVCM-IBGZPJMESA-N 1 2 317.379 4.155 20 0 DIADLO Cc1cc(C)cc(C[N@H+]2CCO[C@H](c3ccc(F)cc3F)C2)c1 ZINC001193605270 1049239439 /nfs/dbraw/zinc/23/94/39/1049239439.db2.gz JDZDJIPFDBXVCM-IBGZPJMESA-N 1 2 317.379 4.155 20 0 DIADLO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3ccns3)cs2)cc1 ZINC000858316483 1049239767 /nfs/dbraw/zinc/23/97/67/1049239767.db2.gz DFBULSAQRNECHC-GFCCVEGCSA-N 1 2 315.467 4.426 20 0 DIADLO C[N@H+](Cc1ccn(-c2ccccc2)n1)Cc1ccc(C2CC2)cc1 ZINC001204729755 1049244663 /nfs/dbraw/zinc/24/46/63/1049244663.db2.gz NFONDFIHLANSEO-UHFFFAOYSA-N 1 2 317.436 4.382 20 0 DIADLO C[N@@H+](Cc1ccn(-c2ccccc2)n1)Cc1ccc(C2CC2)cc1 ZINC001204729755 1049244676 /nfs/dbraw/zinc/24/46/76/1049244676.db2.gz NFONDFIHLANSEO-UHFFFAOYSA-N 1 2 317.436 4.382 20 0 DIADLO COc1ccc(F)cc1C[N@H+](C)[C@H](C)c1cc(F)ccc1F ZINC001204729960 1049244798 /nfs/dbraw/zinc/24/47/98/1049244798.db2.gz OISGSFDMFCQBCL-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO COc1ccc(F)cc1C[N@@H+](C)[C@H](C)c1cc(F)ccc1F ZINC001204729960 1049244810 /nfs/dbraw/zinc/24/48/10/1049244810.db2.gz OISGSFDMFCQBCL-LLVKDONJSA-N 1 2 309.331 4.306 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+]3C[C@H](C)OC[C@@H]3C)s2)cc1C ZINC001179993528 1049246071 /nfs/dbraw/zinc/24/60/71/1049246071.db2.gz LYAKQUNXWCMMDW-GJZGRUSLSA-N 1 2 316.470 4.036 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+]3C[C@H](C)OC[C@@H]3C)s2)cc1C ZINC001179993528 1049246079 /nfs/dbraw/zinc/24/60/79/1049246079.db2.gz LYAKQUNXWCMMDW-GJZGRUSLSA-N 1 2 316.470 4.036 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2cc(F)ncc2F)o1 ZINC001179955943 1049248295 /nfs/dbraw/zinc/24/82/95/1049248295.db2.gz BWNCCIYGWQGTBO-ABAIWWIYSA-N 1 2 306.356 4.234 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2cc(F)ncc2F)o1 ZINC001179955943 1049248306 /nfs/dbraw/zinc/24/83/06/1049248306.db2.gz BWNCCIYGWQGTBO-ABAIWWIYSA-N 1 2 306.356 4.234 20 0 DIADLO CC[C@H](C)[C@@H]([NH2+][C@H]1CC(C)(C)CCc2ccccc21)C(=O)OC ZINC001193743838 1049251134 /nfs/dbraw/zinc/25/11/34/1049251134.db2.gz VNZYWIIBLOINMY-JCGIZDLHSA-N 1 2 317.473 4.268 20 0 DIADLO O=c1nc(Cl)cc(Nc2ccc([NH2+]CC3CCCC3)cc2)[nH]1 ZINC000858384327 1049251321 /nfs/dbraw/zinc/25/13/21/1049251321.db2.gz LVFUWNPLLTWHJE-UHFFFAOYSA-N 1 2 318.808 4.181 20 0 DIADLO CO[C@@]1(C)C[C@H]([N@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001179962131 1049251377 /nfs/dbraw/zinc/25/13/77/1049251377.db2.gz LHQVTOBRLAFDBI-WFASDCNBSA-N 1 2 317.260 4.024 20 0 DIADLO CO[C@@]1(C)C[C@H]([N@@H+](C)Cc2c(Cl)ccnc2Cl)C1(C)C ZINC001179962131 1049251384 /nfs/dbraw/zinc/25/13/84/1049251384.db2.gz LHQVTOBRLAFDBI-WFASDCNBSA-N 1 2 317.260 4.024 20 0 DIADLO Fc1cccc2c1C[N@H+](C/C=C/c1ccc(Cl)cc1)CCO2 ZINC001193795605 1049265777 /nfs/dbraw/zinc/26/57/77/1049265777.db2.gz AFCUYLQDFLDBSD-NSCUHMNNSA-N 1 2 317.791 4.387 20 0 DIADLO Fc1cccc2c1C[N@@H+](C/C=C/c1ccc(Cl)cc1)CCO2 ZINC001193795605 1049265787 /nfs/dbraw/zinc/26/57/87/1049265787.db2.gz AFCUYLQDFLDBSD-NSCUHMNNSA-N 1 2 317.791 4.387 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@@H+](Cc1cc3ccncc3s1)CC2 ZINC001204796448 1049267034 /nfs/dbraw/zinc/26/70/34/1049267034.db2.gz PVFKGQCRORCOEX-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO Fc1cc(F)c2c(c1)C[N@H+](Cc1cc3ccncc3s1)CC2 ZINC001204796448 1049267045 /nfs/dbraw/zinc/26/70/45/1049267045.db2.gz PVFKGQCRORCOEX-UHFFFAOYSA-N 1 2 316.376 4.133 20 0 DIADLO C[C@H]1C[N@H+](CCc2c(Cl)cccc2Cl)C[C@@H](C2CC2)O1 ZINC001193976907 1049290819 /nfs/dbraw/zinc/29/08/19/1049290819.db2.gz NBFRJLFEGDDBQN-ZBEGNZNMSA-N 1 2 314.256 4.035 20 0 DIADLO C[C@H]1C[N@@H+](CCc2c(Cl)cccc2Cl)C[C@@H](C2CC2)O1 ZINC001193976907 1049290826 /nfs/dbraw/zinc/29/08/26/1049290826.db2.gz NBFRJLFEGDDBQN-ZBEGNZNMSA-N 1 2 314.256 4.035 20 0 DIADLO Cc1cc(C[N@H+]2CC=C(C(C)(C)C)CC2)ncc1Br ZINC001180121348 1049291228 /nfs/dbraw/zinc/29/12/28/1049291228.db2.gz QZUASLOFBSWSIV-UHFFFAOYSA-N 1 2 323.278 4.331 20 0 DIADLO Cc1cc(C[N@@H+]2CC=C(C(C)(C)C)CC2)ncc1Br ZINC001180121348 1049291241 /nfs/dbraw/zinc/29/12/41/1049291241.db2.gz QZUASLOFBSWSIV-UHFFFAOYSA-N 1 2 323.278 4.331 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3conc3C(C)C)c2)[nH+]c1C ZINC000858740545 1049291914 /nfs/dbraw/zinc/29/19/14/1049291914.db2.gz RRDJXFGUUINEMK-UHFFFAOYSA-N 1 2 324.384 4.057 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](C/C=C\c2cccc(F)c2)CCO1 ZINC001180121327 1049292840 /nfs/dbraw/zinc/29/28/40/1049292840.db2.gz QNPKIDYPGBSUSM-VORVDVFJSA-N 1 2 311.400 4.221 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](C/C=C\c2cccc(F)c2)CCO1 ZINC001180121327 1049292850 /nfs/dbraw/zinc/29/28/50/1049292850.db2.gz QNPKIDYPGBSUSM-VORVDVFJSA-N 1 2 311.400 4.221 20 0 DIADLO Cc1cnc2c(c1)C[N@@H+](Cc1ccc(C(F)(F)F)c(F)c1)CC2 ZINC001204893681 1049304837 /nfs/dbraw/zinc/30/48/37/1049304837.db2.gz KJWZYPLCJYFONP-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1cnc2c(c1)C[N@H+](Cc1ccc(C(F)(F)F)c(F)c1)CC2 ZINC001204893681 1049304844 /nfs/dbraw/zinc/30/48/44/1049304844.db2.gz KJWZYPLCJYFONP-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO CCOc1cccc(F)c1C[N@@H+]1CCOc2ccccc2[C@H]1C ZINC001180165689 1049305117 /nfs/dbraw/zinc/30/51/17/1049305117.db2.gz HEYLUTDYHTZWSX-CQSZACIVSA-N 1 2 315.388 4.180 20 0 DIADLO CCOc1cccc(F)c1C[N@H+]1CCOc2ccccc2[C@H]1C ZINC001180165689 1049305122 /nfs/dbraw/zinc/30/51/22/1049305122.db2.gz HEYLUTDYHTZWSX-CQSZACIVSA-N 1 2 315.388 4.180 20 0 DIADLO CN(C)c1cccc([C@H]2CCC[N@@H+]2Cc2nc(Cl)cs2)c1 ZINC001180203399 1049307812 /nfs/dbraw/zinc/30/78/12/1049307812.db2.gz QZHQCHHNUKLGDN-CQSZACIVSA-N 1 2 321.877 4.200 20 0 DIADLO CN(C)c1cccc([C@H]2CCC[N@H+]2Cc2nc(Cl)cs2)c1 ZINC001180203399 1049307822 /nfs/dbraw/zinc/30/78/22/1049307822.db2.gz QZHQCHHNUKLGDN-CQSZACIVSA-N 1 2 321.877 4.200 20 0 DIADLO COc1c(C)cnc(C[N@H+](C)Cc2cc(F)cc(Cl)c2)c1C ZINC000485704720 1049316004 /nfs/dbraw/zinc/31/60/04/1049316004.db2.gz LWJFNIOIVRBTJN-UHFFFAOYSA-N 1 2 322.811 4.132 20 0 DIADLO COc1c(C)cnc(C[N@@H+](C)Cc2cc(F)cc(Cl)c2)c1C ZINC000485704720 1049316014 /nfs/dbraw/zinc/31/60/14/1049316014.db2.gz LWJFNIOIVRBTJN-UHFFFAOYSA-N 1 2 322.811 4.132 20 0 DIADLO Fc1cccc(-c2ccnc(Nc3ccn4cc[nH+]c4c3)c2)c1 ZINC001204950604 1049319110 /nfs/dbraw/zinc/31/91/10/1049319110.db2.gz APUQDSNASTXBIF-UHFFFAOYSA-N 1 2 304.328 4.279 20 0 DIADLO FC(F)(F)c1cnc(Cl)c(Nc2ccn3cc[nH+]c3c2)c1 ZINC001204951413 1049319585 /nfs/dbraw/zinc/31/95/85/1049319585.db2.gz RKGAHXXPNZOSBK-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO Clc1cccc2nc(Nc3ccn4cc[nH+]c4c3)sc21 ZINC001204950685 1049319837 /nfs/dbraw/zinc/31/98/37/1049319837.db2.gz FLQMEQSLNVQFJM-UHFFFAOYSA-N 1 2 300.774 4.341 20 0 DIADLO FC(F)(F)c1cc(Cl)nc(Nc2ccn3cc[nH+]c3c2)c1 ZINC001204950941 1049319876 /nfs/dbraw/zinc/31/98/76/1049319876.db2.gz IOBNIPBKLXRDQB-UHFFFAOYSA-N 1 2 312.682 4.145 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cc(Cl)n(C)n1)c1ccccc1Cl ZINC000859234413 1049324122 /nfs/dbraw/zinc/32/41/22/1049324122.db2.gz QHGKEUIVXOMEKJ-OAHLLOKOSA-N 1 2 312.244 4.214 20 0 DIADLO C[C@@H]([NH2+]Cc1cc(Cl)n(C)n1)c1cccc(Cl)c1Cl ZINC000859233457 1049324771 /nfs/dbraw/zinc/32/47/71/1049324771.db2.gz GXATZNGHONPKTI-MRVPVSSYSA-N 1 2 318.635 4.231 20 0 DIADLO C[C@@H](CC(C)(C)C)[NH2+][C@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001204969543 1049327100 /nfs/dbraw/zinc/32/71/00/1049327100.db2.gz ZNRCNEKHWRYPPG-DOTOQJQBSA-N 1 2 319.489 4.354 20 0 DIADLO C/C(=C/C(=O)N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1)C(C)(C)C ZINC000079288399 1049334689 /nfs/dbraw/zinc/33/46/89/1049334689.db2.gz VCVHECHIFULADR-ZSMUJPCHSA-N 1 2 311.429 4.042 20 0 DIADLO COC(=O)c1cccc2c(Nc3ccn4cc[nH+]c4c3)cccc12 ZINC001204998055 1049334978 /nfs/dbraw/zinc/33/49/78/1049334978.db2.gz RMKORAHWZJGJHQ-UHFFFAOYSA-N 1 2 317.348 4.018 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2cc(C(F)(F)F)n[nH]2)cc1 ZINC001180296464 1049336187 /nfs/dbraw/zinc/33/61/87/1049336187.db2.gz IFKDJBKAUJPBEM-OAHLLOKOSA-N 1 2 323.362 4.464 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2cc(C(F)(F)F)n[nH]2)cc1 ZINC001180296464 1049336197 /nfs/dbraw/zinc/33/61/97/1049336197.db2.gz IFKDJBKAUJPBEM-OAHLLOKOSA-N 1 2 323.362 4.464 20 0 DIADLO CCSc1ccccc1C[C@@H](C)[NH2+][C@@H](C)C(=O)OC(C)(C)C ZINC001180350358 1049342969 /nfs/dbraw/zinc/34/29/69/1049342969.db2.gz ZDJPOGYBEQLHPK-KGLIPLIRSA-N 1 2 323.502 4.049 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(C(C)(C)CC)cc2)C[C@@H](C)[S@@]1=O ZINC001194239658 1049347830 /nfs/dbraw/zinc/34/78/30/1049347830.db2.gz FFHXIAZBNLLDDG-LDJQZATESA-N 1 2 321.530 4.106 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(C(C)(C)CC)cc2)C[C@@H](C)[S@@]1=O ZINC001194239658 1049347843 /nfs/dbraw/zinc/34/78/43/1049347843.db2.gz FFHXIAZBNLLDDG-LDJQZATESA-N 1 2 321.530 4.106 20 0 DIADLO C[C@]1(c2ccccc2)CCC[N@H+](CC(F)(F)C(F)F)CC1 ZINC001194262814 1049351192 /nfs/dbraw/zinc/35/11/92/1049351192.db2.gz RZPRBXLHIRDEAA-HNNXBMFYSA-N 1 2 303.343 4.331 20 0 DIADLO C[C@]1(c2ccccc2)CCC[N@@H+](CC(F)(F)C(F)F)CC1 ZINC001194262814 1049351203 /nfs/dbraw/zinc/35/12/03/1049351203.db2.gz RZPRBXLHIRDEAA-HNNXBMFYSA-N 1 2 303.343 4.331 20 0 DIADLO Cc1ccc(C)c(N2CC[NH+](Cc3cscc3Cl)CC2)c1 ZINC001205061264 1049360542 /nfs/dbraw/zinc/36/05/42/1049360542.db2.gz QRNLQBNFHBMEEF-UHFFFAOYSA-N 1 2 320.889 4.341 20 0 DIADLO Cc1ccc(N2CC[NH+](Cc3ccc(Cl)cc3F)CC2)cc1 ZINC001168370672 1049365392 /nfs/dbraw/zinc/36/53/92/1049365392.db2.gz VBMNKIXMYGEGEN-UHFFFAOYSA-N 1 2 318.823 4.110 20 0 DIADLO C[C@@H]([NH2+]Cc1nc(C2CCCCC2)cs1)c1ccns1 ZINC000860061077 1049365434 /nfs/dbraw/zinc/36/54/34/1049365434.db2.gz GBYZHZJGQZABPF-LLVKDONJSA-N 1 2 307.488 4.498 20 0 DIADLO Cc1oc(-c2ccsc2)nc1C[NH2+][C@H](C)c1ccns1 ZINC000860053524 1049367064 /nfs/dbraw/zinc/36/70/64/1049367064.db2.gz DPVGQEJOJVQTDC-SECBINFHSA-N 1 2 305.428 4.019 20 0 DIADLO Clc1csc(CNc2ccc(N3CCCCC3)c[nH+]2)c1 ZINC000485956025 1049368332 /nfs/dbraw/zinc/36/83/32/1049368332.db2.gz PHQGKXKTACFKQY-UHFFFAOYSA-N 1 2 307.850 4.399 20 0 DIADLO Cc1ccc2cc(C[N@@H+](C)Cc3ccc(F)cc3F)[nH]c2c1 ZINC001180532311 1049373658 /nfs/dbraw/zinc/37/36/58/1049373658.db2.gz OMBOXXXVDFDIES-UHFFFAOYSA-N 1 2 300.352 4.387 20 0 DIADLO Cc1ccc2cc(C[N@H+](C)Cc3ccc(F)cc3F)[nH]c2c1 ZINC001180532311 1049373666 /nfs/dbraw/zinc/37/36/66/1049373666.db2.gz OMBOXXXVDFDIES-UHFFFAOYSA-N 1 2 300.352 4.387 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)cc1F ZINC001203795352 1049375435 /nfs/dbraw/zinc/37/54/35/1049375435.db2.gz DFEORAORPOVODN-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)cc1F ZINC001203795352 1049375444 /nfs/dbraw/zinc/37/54/44/1049375444.db2.gz DFEORAORPOVODN-QGZVFWFLSA-N 1 2 321.342 4.450 20 0 DIADLO C[N@H+](CCSCc1ccccc1)Cc1c(F)cccc1F ZINC001194563424 1049385735 /nfs/dbraw/zinc/38/57/35/1049385735.db2.gz ZKRBXVLILXLCKU-UHFFFAOYSA-N 1 2 307.409 4.330 20 0 DIADLO C[N@@H+](CCSCc1ccccc1)Cc1c(F)cccc1F ZINC001194563424 1049385752 /nfs/dbraw/zinc/38/57/52/1049385752.db2.gz ZKRBXVLILXLCKU-UHFFFAOYSA-N 1 2 307.409 4.330 20 0 DIADLO F[C@@H]1CC[N@H+](Cc2cc(Br)c3ccccc3c2)C1 ZINC001194525823 1049387550 /nfs/dbraw/zinc/38/75/50/1049387550.db2.gz WOCIFTXOIOCXPV-CYBMUJFWSA-N 1 2 308.194 4.146 20 0 DIADLO F[C@@H]1CC[N@@H+](Cc2cc(Br)c3ccccc3c2)C1 ZINC001194525823 1049387557 /nfs/dbraw/zinc/38/75/57/1049387557.db2.gz WOCIFTXOIOCXPV-CYBMUJFWSA-N 1 2 308.194 4.146 20 0 DIADLO CC[C@H]1C[N@H+](Cc2cnc(-c3ccc(C)c(C)c3)s2)CCO1 ZINC001205184847 1049403098 /nfs/dbraw/zinc/40/30/98/1049403098.db2.gz IJRLBFYACDAPGM-INIZCTEOSA-N 1 2 316.470 4.038 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2cnc(-c3ccc(C)c(C)c3)s2)CCO1 ZINC001205184847 1049403109 /nfs/dbraw/zinc/40/31/09/1049403109.db2.gz IJRLBFYACDAPGM-INIZCTEOSA-N 1 2 316.470 4.038 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+]1CC(C)(C)O[C@@](C)(C(F)(F)F)C1 ZINC001194648044 1049403527 /nfs/dbraw/zinc/40/35/27/1049403527.db2.gz DOJKROJCEHSDDQ-XHDPSFHLSA-N 1 2 319.342 4.319 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+]1CC(C)(C)O[C@@](C)(C(F)(F)F)C1 ZINC001194648044 1049403532 /nfs/dbraw/zinc/40/35/32/1049403532.db2.gz DOJKROJCEHSDDQ-XHDPSFHLSA-N 1 2 319.342 4.319 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2cnc(-c3ccc(C)c(C)c3)s2)CCO1 ZINC001205184848 1049404238 /nfs/dbraw/zinc/40/42/38/1049404238.db2.gz IJRLBFYACDAPGM-MRXNPFEDSA-N 1 2 316.470 4.038 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2cnc(-c3ccc(C)c(C)c3)s2)CCO1 ZINC001205184848 1049404241 /nfs/dbraw/zinc/40/42/41/1049404241.db2.gz IJRLBFYACDAPGM-MRXNPFEDSA-N 1 2 316.470 4.038 20 0 DIADLO Fc1ccc2cc(CNc3ccc(N4CCCCC4)[nH+]c3)[nH]c2c1 ZINC000486363194 1049418104 /nfs/dbraw/zinc/41/81/04/1049418104.db2.gz XHWNVDRCILOFSF-UHFFFAOYSA-N 1 2 324.403 4.304 20 0 DIADLO COc1cccc(C2CC(Nc3[nH+]cccc3OC(C)C)C2)c1 ZINC001180951324 1049422690 /nfs/dbraw/zinc/42/26/90/1049422690.db2.gz HFRCSURWZQQFQQ-UHFFFAOYSA-N 1 2 312.413 4.236 20 0 DIADLO C[C@@H](CC1CCC1)[NH2+]c1ccc(N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC001181383422 1049470682 /nfs/dbraw/zinc/47/06/82/1049470682.db2.gz UHEFBDJASTXFCE-HRCADAONSA-N 1 2 302.462 4.291 20 0 DIADLO COCOc1cc(C)ccc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001205452774 1049474037 /nfs/dbraw/zinc/47/40/37/1049474037.db2.gz IZFMWBPVRILFOW-UHFFFAOYSA-N 1 2 317.776 4.022 20 0 DIADLO Cc1ccc(Nc2nc(F)cc(C(F)(F)F)c2F)c(C)[nH+]1 ZINC001203367129 1049477026 /nfs/dbraw/zinc/47/70/26/1049477026.db2.gz HLIWQNGKVSOFPF-UHFFFAOYSA-N 1 2 303.234 4.134 20 0 DIADLO CCOC(=O)[C@H]([NH2+][C@@H]1CC(C)(C)C[C@H]1C)c1cccc(C)c1C ZINC001205465591 1049477754 /nfs/dbraw/zinc/47/77/54/1049477754.db2.gz JAUJAIZXPVZTET-ZTFGCOKTSA-N 1 2 317.473 4.322 20 0 DIADLO Cc1ccc([C@H](C)CNc2ccc([NH+]3CCC(O)CC3)cc2)cc1 ZINC000862254969 1049480254 /nfs/dbraw/zinc/48/02/54/1049480254.db2.gz KKQKDLPDMZQUNX-QGZVFWFLSA-N 1 2 324.468 4.172 20 0 DIADLO Cc1ccc([C@H](C)C[NH2+]c2ccc(N3CCC(O)CC3)cc2)cc1 ZINC000862254969 1049480257 /nfs/dbraw/zinc/48/02/57/1049480257.db2.gz KKQKDLPDMZQUNX-QGZVFWFLSA-N 1 2 324.468 4.172 20 0 DIADLO C[C@@H]([NH2+]c1ccc(N2CCSCC2)cc1)C1CC(F)(F)C1 ZINC000862261802 1049483007 /nfs/dbraw/zinc/48/30/07/1049483007.db2.gz FRVKIUZLHHGMBG-GFCCVEGCSA-N 1 2 312.429 4.086 20 0 DIADLO C[C@H]([NH2+]c1ccc(N2C[C@@H](C)O[C@@H](C)C2)cc1)C1CC(F)(F)C1 ZINC000862260641 1049483049 /nfs/dbraw/zinc/48/30/49/1049483049.db2.gz ANOVZXBATSSCEQ-MJBXVCDLSA-N 1 2 324.415 4.146 20 0 DIADLO Cc1cc(Cl)ccc1C[N@H+](CCN(C)C)Cc1ccccc1 ZINC001181555837 1049489863 /nfs/dbraw/zinc/48/98/63/1049489863.db2.gz OVYKWXIPZWZVNS-UHFFFAOYSA-N 1 2 316.876 4.212 20 0 DIADLO Cc1cc(Cl)ccc1C[N@@H+](CCN(C)C)Cc1ccccc1 ZINC001181555837 1049489867 /nfs/dbraw/zinc/48/98/67/1049489867.db2.gz OVYKWXIPZWZVNS-UHFFFAOYSA-N 1 2 316.876 4.212 20 0 DIADLO CCCn1c[nH+]cc1CN1CC2(CCCC2)c2cccc(F)c21 ZINC001181544198 1049490138 /nfs/dbraw/zinc/49/01/38/1049490138.db2.gz MDMKIXKAGSAZLZ-UHFFFAOYSA-N 1 2 313.420 4.264 20 0 DIADLO C[C@@H]1C[NH+](Cc2ccnc(Cl)c2Cl)C[C@@H](C)C1(F)F ZINC000862438344 1049494606 /nfs/dbraw/zinc/49/46/06/1049494606.db2.gz ADYMXDWPNSBFIA-RKDXNWHRSA-N 1 2 309.187 4.112 20 0 DIADLO C[C@@H]([NH2+]Cc1ccc(-c2ccsc2)cc1)c1csnn1 ZINC001195241564 1049500191 /nfs/dbraw/zinc/50/01/91/1049500191.db2.gz FWBCQHFPPYGXRG-LLVKDONJSA-N 1 2 301.440 4.117 20 0 DIADLO Nc1cc(-c2ccc(F)c(F)c2Cl)[nH+]cc1C(F)(F)F ZINC001205635098 1049516438 /nfs/dbraw/zinc/51/64/38/1049516438.db2.gz IGUFOPJKJJSXTI-UHFFFAOYSA-N 1 2 308.637 4.281 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)o1 ZINC000780396459 1049528295 /nfs/dbraw/zinc/52/82/95/1049528295.db2.gz CVVYZVCCNKOEFB-PCUGXKRQSA-N 1 2 311.429 4.045 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)o1 ZINC000780396459 1049528307 /nfs/dbraw/zinc/52/83/07/1049528307.db2.gz CVVYZVCCNKOEFB-PCUGXKRQSA-N 1 2 311.429 4.045 20 0 DIADLO COc1ccc(C[NH2+]Cc2c(F)cc(C)cc2F)c(Cl)c1 ZINC001203810775 1049540335 /nfs/dbraw/zinc/54/03/35/1049540335.db2.gz WTBBCNRVOZHHKO-UHFFFAOYSA-N 1 2 311.759 4.225 20 0 DIADLO Cc1cccc(C[N@@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)c1F ZINC001181959511 1049554248 /nfs/dbraw/zinc/55/42/48/1049554248.db2.gz VWIABIJDBZUJCH-KRWDZBQOSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1cccc(C[N@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)c1F ZINC001181959511 1049554262 /nfs/dbraw/zinc/55/42/62/1049554262.db2.gz VWIABIJDBZUJCH-KRWDZBQOSA-N 1 2 319.807 4.361 20 0 DIADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)[C@H]1CC1(C)C ZINC000487547669 1049557386 /nfs/dbraw/zinc/55/73/86/1049557386.db2.gz ALNNULQGHGVKHU-RHSMWYFYSA-N 1 2 307.441 4.448 20 0 DIADLO CCCCC[C@H](CC)C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000775670563 1049568571 /nfs/dbraw/zinc/56/85/71/1049568571.db2.gz MNJWYXFZMCKCQA-HOTGVXAUSA-N 1 2 307.482 4.021 20 0 DIADLO Cc1nc2c(o1)CCC[C@H]2[NH2+][C@@H]1CCCOc2ccc(F)cc21 ZINC000924827840 1049577408 /nfs/dbraw/zinc/57/74/08/1049577408.db2.gz WKSCKTHLEOHUDK-HUUCEWRRSA-N 1 2 316.376 4.003 20 0 DIADLO CCC[C@H](C)CCC[N@H+](C)[C@@H](C(=O)OC)c1cccc(OC)c1 ZINC001195883665 1049587037 /nfs/dbraw/zinc/58/70/37/1049587037.db2.gz JGACOMMGDLYUGB-MAUKXSAKSA-N 1 2 321.461 4.058 20 0 DIADLO CCC[C@H](C)CCC[N@@H+](C)[C@@H](C(=O)OC)c1cccc(OC)c1 ZINC001195883665 1049587050 /nfs/dbraw/zinc/58/70/50/1049587050.db2.gz JGACOMMGDLYUGB-MAUKXSAKSA-N 1 2 321.461 4.058 20 0 DIADLO CC[NH+](CC)[C@H](C(=O)N(C(C)C)C(C)C)c1ccccc1Cl ZINC001182217660 1049591624 /nfs/dbraw/zinc/59/16/24/1049591624.db2.gz BZCFPUITFGKUHL-KRWDZBQOSA-N 1 2 324.896 4.368 20 0 DIADLO CC[NH+](CC)[C@@H](C(=O)Nc1ccccc1)c1ccccc1Cl ZINC001182217897 1049592180 /nfs/dbraw/zinc/59/21/80/1049592180.db2.gz FJHQSAHPSGWSPQ-QGZVFWFLSA-N 1 2 316.832 4.362 20 0 DIADLO CCN(Cc1ccccc1F)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001205899932 1049594936 /nfs/dbraw/zinc/59/49/36/1049594936.db2.gz RVEWGCACYUQTNG-UHFFFAOYSA-N 1 2 315.392 4.200 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccccn1 ZINC000794563792 1049596199 /nfs/dbraw/zinc/59/61/99/1049596199.db2.gz XILGGJMXGSESRP-LJQANCHMSA-N 1 2 307.397 4.224 20 0 DIADLO Fc1cccc([C@@H]2COCC[N@@H+]2CC[C@H]2CCCC2(F)F)c1 ZINC001196142350 1049618156 /nfs/dbraw/zinc/61/81/56/1049618156.db2.gz JQKNCQXZALLILO-ZBFHGGJFSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1cccc([C@@H]2COCC[N@H+]2CC[C@H]2CCCC2(F)F)c1 ZINC001196142350 1049618157 /nfs/dbraw/zinc/61/81/57/1049618157.db2.gz JQKNCQXZALLILO-ZBFHGGJFSA-N 1 2 313.363 4.025 20 0 DIADLO Cc1nc(SCCCn2cc[nH+]c2C)[nH]c1-c1ccccc1 ZINC000488279446 1049629427 /nfs/dbraw/zinc/62/94/27/1049629427.db2.gz CQNBTKXWQLKLAO-UHFFFAOYSA-N 1 2 312.442 4.072 20 0 DIADLO CC[N@@H+]1CCCC[C@@H]1C(=O)O[C@H](C)c1sc(C(C)C)nc1C ZINC000774304530 1049644142 /nfs/dbraw/zinc/64/41/42/1049644142.db2.gz NJIRRBBDGBDQFE-ZIAGYGMSSA-N 1 2 324.490 4.054 20 0 DIADLO CC[N@H+]1CCCC[C@@H]1C(=O)O[C@H](C)c1sc(C(C)C)nc1C ZINC000774304530 1049644147 /nfs/dbraw/zinc/64/41/47/1049644147.db2.gz NJIRRBBDGBDQFE-ZIAGYGMSSA-N 1 2 324.490 4.054 20 0 DIADLO CC[N@@H+]1CCCC[C@H]1C(=O)O[C@@H](C)c1sc(C(C)C)nc1C ZINC000774304527 1049644599 /nfs/dbraw/zinc/64/45/99/1049644599.db2.gz NJIRRBBDGBDQFE-KBPBESRZSA-N 1 2 324.490 4.054 20 0 DIADLO CC[N@H+]1CCCC[C@H]1C(=O)O[C@@H](C)c1sc(C(C)C)nc1C ZINC000774304527 1049644603 /nfs/dbraw/zinc/64/46/03/1049644603.db2.gz NJIRRBBDGBDQFE-KBPBESRZSA-N 1 2 324.490 4.054 20 0 DIADLO CC(C)C1CC(Nc2cccc3c2CN(c2cccc[nH+]2)C3)C1 ZINC000488453975 1049655236 /nfs/dbraw/zinc/65/52/36/1049655236.db2.gz XRKOZIIAEZACFP-UHFFFAOYSA-N 1 2 307.441 4.448 20 0 DIADLO FC(F)(C[NH2+]CCSCc1ccccc1)c1ccccc1 ZINC001206127928 1049660514 /nfs/dbraw/zinc/66/05/14/1049660514.db2.gz NOQXDSMLJDBJRT-UHFFFAOYSA-N 1 2 307.409 4.301 20 0 DIADLO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](CC)c2ccccc2OC)[nH]1 ZINC000488481786 1049660948 /nfs/dbraw/zinc/66/09/48/1049660948.db2.gz UAJUCVUNRLMHBP-YDHLFZDLSA-N 1 2 316.449 4.129 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2cc(F)cc(N3CCCC3)c2)cc1 ZINC001206129818 1049662579 /nfs/dbraw/zinc/66/25/79/1049662579.db2.gz IVBCFEHSGIXQGM-UHFFFAOYSA-N 1 2 312.388 4.455 20 0 DIADLO COc1cc(Br)ccc1Nc1ccc(C)[nH+]c1C ZINC001203372584 1049664320 /nfs/dbraw/zinc/66/43/20/1049664320.db2.gz DBJOEVBUISDLTP-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Clc1cncc(C[N@@H+]2CCSC[C@H]2C2CCC2)c1Cl ZINC001182464152 1049666997 /nfs/dbraw/zinc/66/69/97/1049666997.db2.gz XLYMLQUFTMKMQX-ZDUSSCGKSA-N 1 2 317.285 4.106 20 0 DIADLO Clc1cncc(C[N@H+]2CCSC[C@H]2C2CCC2)c1Cl ZINC001182464152 1049667008 /nfs/dbraw/zinc/66/70/08/1049667008.db2.gz XLYMLQUFTMKMQX-ZDUSSCGKSA-N 1 2 317.285 4.106 20 0 DIADLO FC(F)(F)[C@H]1CC=C(Nc2ccc[nH+]c2N2CCCC2)CC1 ZINC001196768398 1049685239 /nfs/dbraw/zinc/68/52/39/1049685239.db2.gz QQGOKNVYYCONDA-LBPRGKRZSA-N 1 2 311.351 4.340 20 0 DIADLO Cc1cc(CNc2ccc3nc(C(F)(F)F)oc3c2)cc(C)[nH+]1 ZINC001182566199 1049687353 /nfs/dbraw/zinc/68/73/53/1049687353.db2.gz MWIWEFJAFAWXQI-UHFFFAOYSA-N 1 2 321.302 4.471 20 0 DIADLO Cc1ccc(Nc2cc[nH+]c(NC(=O)OC(C)(C)C)c2)c(O)c1 ZINC001206246882 1049689478 /nfs/dbraw/zinc/68/94/78/1049689478.db2.gz IEMMSBBITJAFMA-UHFFFAOYSA-N 1 2 315.373 4.186 20 0 DIADLO O=C(C[C@H]1C=CCCC1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000488716574 1049690745 /nfs/dbraw/zinc/69/07/45/1049690745.db2.gz JYOHZDMFIIKNSG-ZDUSSCGKSA-N 1 2 315.804 4.211 20 0 DIADLO Clc1cccc2c(N3CCOC[C@@H](C4CCC4)C3)cc[nH+]c12 ZINC000488723667 1049690810 /nfs/dbraw/zinc/69/08/10/1049690810.db2.gz QZTACVWMXUITPF-AWEZNQCLSA-N 1 2 316.832 4.141 20 0 DIADLO C[C@@H](c1noc(-c2ccccc2)n1)[N@H+]1CC=C(C(C)(C)C)CC1 ZINC000671242435 1049694140 /nfs/dbraw/zinc/69/41/40/1049694140.db2.gz UHEVVKIRLJXIKE-AWEZNQCLSA-N 1 2 311.429 4.476 20 0 DIADLO C[C@@H](c1noc(-c2ccccc2)n1)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000671242435 1049694145 /nfs/dbraw/zinc/69/41/45/1049694145.db2.gz UHEVVKIRLJXIKE-AWEZNQCLSA-N 1 2 311.429 4.476 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1C ZINC001204355306 1049707266 /nfs/dbraw/zinc/70/72/66/1049707266.db2.gz IVNACIVXTBOKGJ-LJQANCHMSA-N 1 2 317.379 4.155 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1C ZINC001204355306 1049707271 /nfs/dbraw/zinc/70/72/71/1049707271.db2.gz IVNACIVXTBOKGJ-LJQANCHMSA-N 1 2 317.379 4.155 20 0 DIADLO CC(C)(C)C[C@@H]1CC[N@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001206313783 1049708939 /nfs/dbraw/zinc/70/89/39/1049708939.db2.gz LJHOIAPIPYSCDF-JTQLQIEISA-N 1 2 306.397 4.420 20 0 DIADLO CC(C)(C)C[C@@H]1CC[N@@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001206313783 1049708952 /nfs/dbraw/zinc/70/89/52/1049708952.db2.gz LJHOIAPIPYSCDF-JTQLQIEISA-N 1 2 306.397 4.420 20 0 DIADLO CC(C)(C)[C@@H]1CSCC[N@@H+]1Cc1cc(Cl)nc(Cl)c1 ZINC001197295370 1049734121 /nfs/dbraw/zinc/73/41/21/1049734121.db2.gz FYOYZHQYCLARGZ-NSHDSACASA-N 1 2 319.301 4.352 20 0 DIADLO CC(C)(C)[C@@H]1CSCC[N@H+]1Cc1cc(Cl)nc(Cl)c1 ZINC001197295370 1049734129 /nfs/dbraw/zinc/73/41/29/1049734129.db2.gz FYOYZHQYCLARGZ-NSHDSACASA-N 1 2 319.301 4.352 20 0 DIADLO CC(C)c1nc(C[N@@H+]2CC[C@H](c3ccccc3F)C2(C)C)no1 ZINC001197042140 1049713925 /nfs/dbraw/zinc/71/39/25/1049713925.db2.gz XOMPHIWNQKWPER-CQSZACIVSA-N 1 2 317.408 4.100 20 0 DIADLO CC(C)c1nc(C[N@H+]2CC[C@H](c3ccccc3F)C2(C)C)no1 ZINC001197042140 1049713938 /nfs/dbraw/zinc/71/39/38/1049713938.db2.gz XOMPHIWNQKWPER-CQSZACIVSA-N 1 2 317.408 4.100 20 0 DIADLO COCc1cc(C)c(-c2ccc(-n3cc[nH+]c3)cc2OC)c(C)c1 ZINC001206344404 1049716974 /nfs/dbraw/zinc/71/69/74/1049716974.db2.gz CWNXPEPOPHLKDI-UHFFFAOYSA-N 1 2 322.408 4.311 20 0 DIADLO C[C@@H](CCc1ccsc1)Nc1ccc(N2CCCC2)c[nH+]1 ZINC001206376372 1049722631 /nfs/dbraw/zinc/72/26/31/1049722631.db2.gz FRQLQWFLLNETSI-AWEZNQCLSA-N 1 2 301.459 4.177 20 0 DIADLO C[C@@H]([NH2+][C@H](C)c1nc2ccccc2o1)c1cc2cnccc2o1 ZINC001197229104 1049730513 /nfs/dbraw/zinc/73/05/13/1049730513.db2.gz BLJKZGCMWKEEDW-VXGBXAGGSA-N 1 2 307.353 4.381 20 0 DIADLO Cc1cc(C)c(NC(=O)Cc2cccc(C)c2Cl)c(C)[nH+]1 ZINC000489264377 1049737614 /nfs/dbraw/zinc/73/76/14/1049737614.db2.gz AJPACHWDDDXRMJ-UHFFFAOYSA-N 1 2 302.805 4.150 20 0 DIADLO COc1cnccc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)s1 ZINC001206480235 1049740264 /nfs/dbraw/zinc/74/02/64/1049740264.db2.gz OUBSSWPGCXHIEY-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO COc1cnccc1C[N@H+]1CCC[C@H]1c1ccc(Cl)s1 ZINC001206480235 1049740267 /nfs/dbraw/zinc/74/02/67/1049740267.db2.gz OUBSSWPGCXHIEY-LBPRGKRZSA-N 1 2 308.834 4.142 20 0 DIADLO C[C@@H]1c2ccc(F)cc2CC[N@H+]1Cc1cc(O)ccc1Cl ZINC001197496554 1049757161 /nfs/dbraw/zinc/75/71/61/1049757161.db2.gz LIJGQRYLBRGPBU-LLVKDONJSA-N 1 2 305.780 4.304 20 0 DIADLO C[C@@H]1c2ccc(F)cc2CC[N@@H+]1Cc1cc(O)ccc1Cl ZINC001197496554 1049757164 /nfs/dbraw/zinc/75/71/64/1049757164.db2.gz LIJGQRYLBRGPBU-LLVKDONJSA-N 1 2 305.780 4.304 20 0 DIADLO Cc1c(F)nccc1C[N@@H+]1CCc2oc(-c3ccccc3)cc2C1 ZINC001206578010 1049761168 /nfs/dbraw/zinc/76/11/68/1049761168.db2.gz QVBAXQPDKXBRLR-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1c(F)nccc1C[N@H+]1CCc2oc(-c3ccccc3)cc2C1 ZINC001206578010 1049761173 /nfs/dbraw/zinc/76/11/73/1049761173.db2.gz QVBAXQPDKXBRLR-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Fc1cc(C[NH+]2CCOCC2)ccc1-c1ccc(C2CC2)cc1 ZINC001206712637 1049782408 /nfs/dbraw/zinc/78/24/08/1049782408.db2.gz XRIDLCBPYZPUCK-UHFFFAOYSA-N 1 2 311.400 4.202 20 0 DIADLO COc1cc(C)ccc1C[N@H+](C)Cc1nc2ccccc2s1 ZINC001206740469 1049788124 /nfs/dbraw/zinc/78/81/24/1049788124.db2.gz IZFVBLIJJBTBCT-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO COc1cc(C)ccc1C[N@@H+](C)Cc1nc2ccccc2s1 ZINC001206740469 1049788134 /nfs/dbraw/zinc/78/81/34/1049788134.db2.gz IZFVBLIJJBTBCT-UHFFFAOYSA-N 1 2 312.438 4.245 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c(C)n1 ZINC000490061360 1049797549 /nfs/dbraw/zinc/79/75/49/1049797549.db2.gz KLJIQYZHPZPMNE-SNVBAGLBSA-N 1 2 315.364 4.025 20 0 DIADLO COC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nc(C)c(C)s1 ZINC000490059799 1049797954 /nfs/dbraw/zinc/79/79/54/1049797954.db2.gz LTMBRWRHCYIQQK-OAHLLOKOSA-N 1 2 324.877 4.233 20 0 DIADLO COC[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nc(C)c(C)s1 ZINC000490059799 1049797961 /nfs/dbraw/zinc/79/79/61/1049797961.db2.gz LTMBRWRHCYIQQK-OAHLLOKOSA-N 1 2 324.877 4.233 20 0 DIADLO COC[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nc(C)sc1C ZINC000490079021 1049799501 /nfs/dbraw/zinc/79/95/01/1049799501.db2.gz XXFIJSIEBORMFO-INIZCTEOSA-N 1 2 324.877 4.233 20 0 DIADLO COC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nc(C)sc1C ZINC000490079021 1049799504 /nfs/dbraw/zinc/79/95/04/1049799504.db2.gz XXFIJSIEBORMFO-INIZCTEOSA-N 1 2 324.877 4.233 20 0 DIADLO Fc1ccc(-c2cc(C[N@@H+]3CCC[C@H]3c3ccccn3)no2)cc1 ZINC001206833107 1049810568 /nfs/dbraw/zinc/81/05/68/1049810568.db2.gz FRRXDLDRDWKTHV-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO Fc1ccc(-c2cc(C[N@H+]3CCC[C@H]3c3ccccn3)no2)cc1 ZINC001206833107 1049810577 /nfs/dbraw/zinc/81/05/77/1049810577.db2.gz FRRXDLDRDWKTHV-SFHVURJKSA-N 1 2 323.371 4.213 20 0 DIADLO C[N@H+](Cc1cc(-c2ccc(F)cc2)on1)Cc1cccc(F)c1 ZINC001206832363 1049810973 /nfs/dbraw/zinc/81/09/73/1049810973.db2.gz YYVHYFGAZLVXIX-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO C[N@@H+](Cc1cc(-c2ccc(F)cc2)on1)Cc1cccc(F)c1 ZINC001206832363 1049810977 /nfs/dbraw/zinc/81/09/77/1049810977.db2.gz YYVHYFGAZLVXIX-UHFFFAOYSA-N 1 2 314.335 4.252 20 0 DIADLO Fc1ccc(-c2cc(C[N@@H+]3CC[C@@H]3c3ccccc3)no2)cc1 ZINC001206835803 1049811757 /nfs/dbraw/zinc/81/17/57/1049811757.db2.gz CULUUAKDZWFGPG-GOSISDBHSA-N 1 2 308.356 4.428 20 0 DIADLO Fc1ccc(-c2cc(C[N@H+]3CC[C@@H]3c3ccccc3)no2)cc1 ZINC001206835803 1049811762 /nfs/dbraw/zinc/81/17/62/1049811762.db2.gz CULUUAKDZWFGPG-GOSISDBHSA-N 1 2 308.356 4.428 20 0 DIADLO CCCCc1noc([C@H](C)[N@H+](C)Cc2ccc(CC)cc2)n1 ZINC000490295797 1049820181 /nfs/dbraw/zinc/82/01/81/1049820181.db2.gz ANEUOOKBGRJCQV-AWEZNQCLSA-N 1 2 301.434 4.168 20 0 DIADLO CCCCc1noc([C@H](C)[N@@H+](C)Cc2ccc(CC)cc2)n1 ZINC000490295797 1049820191 /nfs/dbraw/zinc/82/01/91/1049820191.db2.gz ANEUOOKBGRJCQV-AWEZNQCLSA-N 1 2 301.434 4.168 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@H+](C)Cc1ncccc1F ZINC001207036998 1049823625 /nfs/dbraw/zinc/82/36/25/1049823625.db2.gz KPZCGYXVLJWEKX-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1cccc(Br)c1)[N@@H+](C)Cc1ncccc1F ZINC001207036998 1049823633 /nfs/dbraw/zinc/82/36/33/1049823633.db2.gz KPZCGYXVLJWEKX-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO Fc1ccc(C2CC[NH+](Cc3ncc(F)cc3F)CC2)c(F)c1 ZINC001207102016 1049834904 /nfs/dbraw/zinc/83/49/04/1049834904.db2.gz SEUVHMRJYWNLMR-UHFFFAOYSA-N 1 2 324.321 4.018 20 0 DIADLO Fc1cnc(C[N@H+](Cc2ccccn2)C2CCCCC2)c(F)c1 ZINC001207097965 1049835715 /nfs/dbraw/zinc/83/57/15/1049835715.db2.gz CBAUSCBIDJJFNH-UHFFFAOYSA-N 1 2 317.383 4.090 20 0 DIADLO Fc1cnc(C[N@@H+](Cc2ccccn2)C2CCCCC2)c(F)c1 ZINC001207097965 1049835736 /nfs/dbraw/zinc/83/57/36/1049835736.db2.gz CBAUSCBIDJJFNH-UHFFFAOYSA-N 1 2 317.383 4.090 20 0 DIADLO Cc1noc(C)c1C[N@@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001207139755 1049843103 /nfs/dbraw/zinc/84/31/03/1049843103.db2.gz LCZKLDYWDNEACV-INIZCTEOSA-N 1 2 322.861 4.235 20 0 DIADLO Cc1noc(C)c1C[N@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001207139755 1049843115 /nfs/dbraw/zinc/84/31/15/1049843115.db2.gz LCZKLDYWDNEACV-INIZCTEOSA-N 1 2 322.861 4.235 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@@H+](Cc1cccc(C(F)F)c1)CC2 ZINC001207131452 1049843619 /nfs/dbraw/zinc/84/36/19/1049843619.db2.gz KABUXYRKVLSOMY-UHFFFAOYSA-N 1 2 315.363 4.385 20 0 DIADLO CC(=O)c1ccc2c(c1)C[N@H+](Cc1cccc(C(F)F)c1)CC2 ZINC001207131452 1049843629 /nfs/dbraw/zinc/84/36/29/1049843629.db2.gz KABUXYRKVLSOMY-UHFFFAOYSA-N 1 2 315.363 4.385 20 0 DIADLO FC(F)n1cccc1C[N@@H+]1CCC[C@@](F)(c2ccccc2)C1 ZINC001207209864 1049862484 /nfs/dbraw/zinc/86/24/84/1049862484.db2.gz ROZUEPWTJHPIEA-KRWDZBQOSA-N 1 2 308.347 4.344 20 0 DIADLO FC(F)n1cccc1C[N@H+]1CCC[C@@](F)(c2ccccc2)C1 ZINC001207209864 1049862492 /nfs/dbraw/zinc/86/24/92/1049862492.db2.gz ROZUEPWTJHPIEA-KRWDZBQOSA-N 1 2 308.347 4.344 20 0 DIADLO Fc1ccc2c(C[NH2+]Cc3ccc(Cl)cc3F)noc2c1 ZINC001207270678 1049872319 /nfs/dbraw/zinc/87/23/19/1049872319.db2.gz OTBIQKDDSSFREN-UHFFFAOYSA-N 1 2 308.715 4.049 20 0 DIADLO CC(C)c1ccc(CC[N@@H+]2Cc3cnc(Cl)cc3C2)cc1 ZINC001207522388 1049904685 /nfs/dbraw/zinc/90/46/85/1049904685.db2.gz FQICPGHLTKCSBM-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1ccc(CC[N@H+]2Cc3cnc(Cl)cc3C2)cc1 ZINC001207522388 1049904687 /nfs/dbraw/zinc/90/46/87/1049904687.db2.gz FQICPGHLTKCSBM-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO Fc1cncc(C[NH+]2CCC(=Cc3ccc(F)c(F)c3)CC2)c1 ZINC000571430179 1049932482 /nfs/dbraw/zinc/93/24/82/1049932482.db2.gz RBPUOCZDSZMWGM-UHFFFAOYSA-N 1 2 318.342 4.178 20 0 DIADLO Fc1cc(C[NH+]2CC(Cc3ccoc3)C2)cc(C(F)(F)F)c1 ZINC001207738682 1049933157 /nfs/dbraw/zinc/93/31/57/1049933157.db2.gz IPTHHYVIFAQONM-UHFFFAOYSA-N 1 2 313.294 4.112 20 0 DIADLO C/C(=C/C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)C1CC1 ZINC000055388395 1049934705 /nfs/dbraw/zinc/93/47/05/1049934705.db2.gz UFZJNHLKIYVACX-OWBHPGMISA-N 1 2 321.424 4.181 20 0 DIADLO CC(C)(C)[C@@H]1CC[N@H+](Cc2c(F)ccc(F)c2Cl)CCO1 ZINC001207835307 1049943730 /nfs/dbraw/zinc/94/37/30/1049943730.db2.gz AQPLXUQVHOVKLF-AWEZNQCLSA-N 1 2 317.807 4.255 20 0 DIADLO CC(C)(C)[C@@H]1CC[N@@H+](Cc2c(F)ccc(F)c2Cl)CCO1 ZINC001207835307 1049943743 /nfs/dbraw/zinc/94/37/43/1049943743.db2.gz AQPLXUQVHOVKLF-AWEZNQCLSA-N 1 2 317.807 4.255 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1cccn1C(F)F ZINC001207875946 1049948784 /nfs/dbraw/zinc/94/87/84/1049948784.db2.gz BGUVTWZZCJAEGB-UHFFFAOYSA-N 1 2 308.307 4.004 20 0 DIADLO C[C@H]1CCCN(c2cc[nH+]c3c(Br)cccc23)C1 ZINC000588159000 1049962787 /nfs/dbraw/zinc/96/27/87/1049962787.db2.gz KZVIMVAPUKLDAC-NSHDSACASA-N 1 2 305.219 4.234 20 0 DIADLO C[C@H]([NH2+]Cc1cnc[nH]1)c1ccc(Cl)c(Cl)c1Cl ZINC000088750793 1049986352 /nfs/dbraw/zinc/98/63/52/1049986352.db2.gz CUUFENVZFGDLEZ-ZETCQYMHSA-N 1 2 304.608 4.221 20 0 DIADLO Fc1cccc(CC[N@@H+]2Cc3cccc(Br)c3C2)c1 ZINC001208196794 1049984323 /nfs/dbraw/zinc/98/43/23/1049984323.db2.gz AKVHMWHHXIFICP-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO Fc1cccc(CC[N@H+]2Cc3cccc(Br)c3C2)c1 ZINC001208196794 1049984327 /nfs/dbraw/zinc/98/43/27/1049984327.db2.gz AKVHMWHHXIFICP-UHFFFAOYSA-N 1 2 320.205 4.147 20 0 DIADLO CC(C)c1ccc(C[N@H+](C)Cc2cn(-c3ccccc3)nn2)cc1 ZINC000588668877 1049987919 /nfs/dbraw/zinc/98/79/19/1049987919.db2.gz ODCBBSCNMQKWIR-UHFFFAOYSA-N 1 2 320.440 4.023 20 0 DIADLO CC(C)c1ccc(C[N@@H+](C)Cc2cn(-c3ccccc3)nn2)cc1 ZINC000588668877 1049987923 /nfs/dbraw/zinc/98/79/23/1049987923.db2.gz ODCBBSCNMQKWIR-UHFFFAOYSA-N 1 2 320.440 4.023 20 0 DIADLO CC[N@H+](CCC(F)(F)F)Cc1nc(-c2ccsc2)oc1C ZINC000588674402 1049993096 /nfs/dbraw/zinc/99/30/96/1049993096.db2.gz ZLQXCSICRRINFC-UHFFFAOYSA-N 1 2 318.364 4.486 20 0 DIADLO CC[N@@H+](CCC(F)(F)F)Cc1nc(-c2ccsc2)oc1C ZINC000588674402 1049993103 /nfs/dbraw/zinc/99/31/03/1049993103.db2.gz ZLQXCSICRRINFC-UHFFFAOYSA-N 1 2 318.364 4.486 20 0 DIADLO Clc1cccc([C@H]2CCC[N@@H+]2Cc2cn3ccsc3n2)c1 ZINC000588899889 1050007307 /nfs/dbraw/zinc/00/73/07/1050007307.db2.gz HNRMJCUNZNDKEQ-OAHLLOKOSA-N 1 2 317.845 4.386 20 0 DIADLO Clc1cccc([C@H]2CCC[N@H+]2Cc2cn3ccsc3n2)c1 ZINC000588899889 1050007314 /nfs/dbraw/zinc/00/73/14/1050007314.db2.gz HNRMJCUNZNDKEQ-OAHLLOKOSA-N 1 2 317.845 4.386 20 0 DIADLO CC(C)Oc1ncccc1CC[N@@H+]1Cc2cccc(Cl)c2C1 ZINC001208800101 1050011773 /nfs/dbraw/zinc/01/17/73/1050011773.db2.gz HPGNNFDHVCMLBP-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO CC(C)Oc1ncccc1CC[N@H+]1Cc2cccc(Cl)c2C1 ZINC001208800101 1050011775 /nfs/dbraw/zinc/01/17/75/1050011775.db2.gz HPGNNFDHVCMLBP-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO c1csc(CC[N@H+]2Cc3nc(-c4ccccc4)sc3C2)c1 ZINC001209229099 1050045769 /nfs/dbraw/zinc/04/57/69/1050045769.db2.gz VQFNVWYLWDGYQR-UHFFFAOYSA-N 1 2 312.463 4.430 20 0 DIADLO c1csc(CC[N@@H+]2Cc3nc(-c4ccccc4)sc3C2)c1 ZINC001209229099 1050045775 /nfs/dbraw/zinc/04/57/75/1050045775.db2.gz VQFNVWYLWDGYQR-UHFFFAOYSA-N 1 2 312.463 4.430 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1cccc(Cl)c1 ZINC000589605357 1050048571 /nfs/dbraw/zinc/04/85/71/1050048571.db2.gz XCGNDYNAKOFFQL-KBXCAEBGSA-N 1 2 301.817 4.302 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1cccc(Cl)c1 ZINC000589605357 1050048575 /nfs/dbraw/zinc/04/85/75/1050048575.db2.gz XCGNDYNAKOFFQL-KBXCAEBGSA-N 1 2 301.817 4.302 20 0 DIADLO Fc1cccc([C@@H]2C[N@H+](CCc3ccccc3Cl)CCO2)c1 ZINC000589600545 1050048624 /nfs/dbraw/zinc/04/86/24/1050048624.db2.gz DHSWPVWWCMAZPG-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Fc1cccc([C@@H]2C[N@@H+](CCc3ccccc3Cl)CCO2)c1 ZINC000589600545 1050048628 /nfs/dbraw/zinc/04/86/28/1050048628.db2.gz DHSWPVWWCMAZPG-SFHVURJKSA-N 1 2 319.807 4.095 20 0 DIADLO Cc1cc(Oc2ccc(Nc3ccncc3Cl)cc2)cc[nH+]1 ZINC001212160211 1050048880 /nfs/dbraw/zinc/04/88/80/1050048880.db2.gz MYEIGWFCODGIKV-UHFFFAOYSA-N 1 2 311.772 4.396 20 0 DIADLO CCCCc1nc(C[N@@H+]2CCC[C@@H](c3ccccc3)CC2)no1 ZINC000589609759 1050049427 /nfs/dbraw/zinc/04/94/27/1050049427.db2.gz OMVHUNWYWWBDEN-QGZVFWFLSA-N 1 2 313.445 4.182 20 0 DIADLO CCCCc1nc(C[N@H+]2CCC[C@@H](c3ccccc3)CC2)no1 ZINC000589609759 1050049431 /nfs/dbraw/zinc/04/94/31/1050049431.db2.gz OMVHUNWYWWBDEN-QGZVFWFLSA-N 1 2 313.445 4.182 20 0 DIADLO Cc1cccc(C2([NH2+]Cc3n[nH]c4ccccc43)CCCC2)c1 ZINC000589651317 1050054787 /nfs/dbraw/zinc/05/47/87/1050054787.db2.gz BXRMCSYWRGTNFJ-UHFFFAOYSA-N 1 2 305.425 4.430 20 0 DIADLO Cc1ccc(O[C@H]2CCC[N@H+](Cc3cnc(Cl)s3)C2)cc1 ZINC001209470038 1050061156 /nfs/dbraw/zinc/06/11/56/1050061156.db2.gz AQUYHACABUSJTI-AWEZNQCLSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1ccc(O[C@H]2CCC[N@@H+](Cc3cnc(Cl)s3)C2)cc1 ZINC001209470038 1050061160 /nfs/dbraw/zinc/06/11/60/1050061160.db2.gz AQUYHACABUSJTI-AWEZNQCLSA-N 1 2 322.861 4.148 20 0 DIADLO Cc1[nH]c2ncccc2c1C[N@@H+](C)Cc1csc(C(C)C)n1 ZINC001209590203 1050070774 /nfs/dbraw/zinc/07/07/74/1050070774.db2.gz JYZMFSWJAWCMAE-UHFFFAOYSA-N 1 2 314.458 4.083 20 0 DIADLO Cc1[nH]c2ncccc2c1C[N@H+](C)Cc1csc(C(C)C)n1 ZINC001209590203 1050070780 /nfs/dbraw/zinc/07/07/80/1050070780.db2.gz JYZMFSWJAWCMAE-UHFFFAOYSA-N 1 2 314.458 4.083 20 0 DIADLO Cc1cc(Cl)ncc1C[N@@H+](CC(=O)c1ccccc1)C(C)C ZINC001209636386 1050073199 /nfs/dbraw/zinc/07/31/99/1050073199.db2.gz VAFNXBFIXPIZDJ-UHFFFAOYSA-N 1 2 316.832 4.137 20 0 DIADLO Cc1cc(Cl)ncc1C[N@H+](CC(=O)c1ccccc1)C(C)C ZINC001209636386 1050073200 /nfs/dbraw/zinc/07/32/00/1050073200.db2.gz VAFNXBFIXPIZDJ-UHFFFAOYSA-N 1 2 316.832 4.137 20 0 DIADLO Fc1ccc2c(C[N@H+]3Cc4ccc(Cl)cc4C3)c[nH]c2c1 ZINC001209694015 1050076438 /nfs/dbraw/zinc/07/64/38/1050076438.db2.gz HQGVTUUWRDNRDA-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO Fc1ccc2c(C[N@@H+]3Cc4ccc(Cl)cc4C3)c[nH]c2c1 ZINC001209694015 1050076434 /nfs/dbraw/zinc/07/64/34/1050076434.db2.gz HQGVTUUWRDNRDA-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO F[C@H]1C[N@H+](Cc2cc3cc(Cl)ccc3[nH]2)CCCC1(F)F ZINC001209718566 1050077514 /nfs/dbraw/zinc/07/75/14/1050077514.db2.gz PIDUJVCJAMXXFS-AWEZNQCLSA-N 1 2 316.754 4.391 20 0 DIADLO F[C@H]1C[N@@H+](Cc2cc3cc(Cl)ccc3[nH]2)CCCC1(F)F ZINC001209718566 1050077518 /nfs/dbraw/zinc/07/75/18/1050077518.db2.gz PIDUJVCJAMXXFS-AWEZNQCLSA-N 1 2 316.754 4.391 20 0 DIADLO O=C1CC[N@@H+](Cc2cc3cc(Cl)ccc3[nH]2)[C@@H]2CCCC[C@@H]12 ZINC001209717994 1050077578 /nfs/dbraw/zinc/07/75/78/1050077578.db2.gz IUSZSJNISJTMQP-NVXWUHKLSA-N 1 2 316.832 4.155 20 0 DIADLO O=C1CC[N@H+](Cc2cc3cc(Cl)ccc3[nH]2)[C@@H]2CCCC[C@@H]12 ZINC001209717994 1050077584 /nfs/dbraw/zinc/07/75/84/1050077584.db2.gz IUSZSJNISJTMQP-NVXWUHKLSA-N 1 2 316.832 4.155 20 0 DIADLO Cc1nc2c(s1)C[N@H+](Cc1cc3cc(Cl)ccc3[nH]1)CC2 ZINC001209721835 1050079334 /nfs/dbraw/zinc/07/93/34/1050079334.db2.gz QFWVSRBCYHLJSX-UHFFFAOYSA-N 1 2 317.845 4.145 20 0 DIADLO Cc1nc2c(s1)C[N@@H+](Cc1cc3cc(Cl)ccc3[nH]1)CC2 ZINC001209721835 1050079336 /nfs/dbraw/zinc/07/93/36/1050079336.db2.gz QFWVSRBCYHLJSX-UHFFFAOYSA-N 1 2 317.845 4.145 20 0 DIADLO Cc1ccc2c(c1)C[N@@H+](Cc1[nH]nc3ccc(Cl)cc31)CC2 ZINC001209751944 1050079964 /nfs/dbraw/zinc/07/99/64/1050079964.db2.gz YFOMIXNHIGMWRO-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1ccc2c(c1)C[N@H+](Cc1[nH]nc3ccc(Cl)cc31)CC2 ZINC001209751944 1050079967 /nfs/dbraw/zinc/07/99/67/1050079967.db2.gz YFOMIXNHIGMWRO-UHFFFAOYSA-N 1 2 311.816 4.083 20 0 DIADLO Cc1cccn2cc(C[N@@H+]3CCC[C@H]3c3ccccc3F)nc12 ZINC001209739234 1050080136 /nfs/dbraw/zinc/08/01/36/1050080136.db2.gz KZBUTWQEOLJHID-SFHVURJKSA-N 1 2 309.388 4.119 20 0 DIADLO Cc1cccn2cc(C[N@H+]3CCC[C@H]3c3ccccc3F)nc12 ZINC001209739234 1050080139 /nfs/dbraw/zinc/08/01/39/1050080139.db2.gz KZBUTWQEOLJHID-SFHVURJKSA-N 1 2 309.388 4.119 20 0 DIADLO c1cc([NH+]2CCCCC2)ccc1Nc1ccc2c(c1)NCCO2 ZINC001209796574 1050085446 /nfs/dbraw/zinc/08/54/46/1050085446.db2.gz MIUGJXLQKWNJQB-UHFFFAOYSA-N 1 2 309.413 4.225 20 0 DIADLO COc1c(F)ccc(Nc2cccc(-n3cc[nH+]c3)c2)c1Cl ZINC001209803101 1050086437 /nfs/dbraw/zinc/08/64/37/1050086437.db2.gz TUPZGSUDSCDJET-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO COc1c(F)ccc(Nc2ccccc2-n2cc[nH+]c2)c1Cl ZINC001209802818 1050086748 /nfs/dbraw/zinc/08/67/48/1050086748.db2.gz NNXKKYOIEZAMJY-UHFFFAOYSA-N 1 2 317.751 4.417 20 0 DIADLO Clc1nc(Cl)c(Nc2ccc3[nH]c[nH+]c3c2)nc1Cl ZINC001209847298 1050095038 /nfs/dbraw/zinc/09/50/38/1050095038.db2.gz BCILBRIMHLODSX-UHFFFAOYSA-N 1 2 314.563 4.057 20 0 DIADLO COc1cc(C(F)(F)F)ccc1Nc1ccc2c(c1)[nH+]cn2C ZINC001209883811 1050100499 /nfs/dbraw/zinc/10/04/99/1050100499.db2.gz AYHKKKJHPKCKOC-UHFFFAOYSA-N 1 2 321.302 4.344 20 0 DIADLO C[NH+](C)c1ccc(NCc2ccc(F)cc2Br)cc1 ZINC000057611253 1050102927 /nfs/dbraw/zinc/10/29/27/1050102927.db2.gz PCVLDOCLURNUJC-UHFFFAOYSA-N 1 2 323.209 4.266 20 0 DIADLO CCCCOC(=O)Nc1ccc(Nc2cccc3[nH+]ccn32)cc1 ZINC001209913509 1050105242 /nfs/dbraw/zinc/10/52/42/1050105242.db2.gz PCNGVKKHQZBUFC-UHFFFAOYSA-N 1 2 324.384 4.427 20 0 DIADLO CCCCC1CCC(C(=O)N2CCC[C@H](n3cc[nH+]c3)C2)CC1 ZINC000590729395 1050105865 /nfs/dbraw/zinc/10/58/65/1050105865.db2.gz JGMUMOGJNOHGBU-ABHNRTSZSA-N 1 2 317.477 4.043 20 0 DIADLO FC(F)c1ccccc1Nc1ccccc1C[NH+]1CCOCC1 ZINC001209927684 1050108058 /nfs/dbraw/zinc/10/80/58/1050108058.db2.gz ZTSTZEMLSHUSOW-UHFFFAOYSA-N 1 2 318.367 4.200 20 0 DIADLO c1cc2cccc(Nc3ccccc3C[NH+]3CCOCC3)c2o1 ZINC001209931671 1050108141 /nfs/dbraw/zinc/10/81/41/1050108141.db2.gz BOVXOQSDZJCOHU-UHFFFAOYSA-N 1 2 308.381 4.009 20 0 DIADLO Fc1cccc(Nc2ccccc2C[NH+]2CCOCC2)c1Cl ZINC001209927438 1050108189 /nfs/dbraw/zinc/10/81/89/1050108189.db2.gz TZOCQAREHWLSHJ-UHFFFAOYSA-N 1 2 320.795 4.055 20 0 DIADLO CO[C@@H](C)c1cccc(Nc2cc(OC(F)(F)F)cc[nH+]2)c1 ZINC001209948601 1050110044 /nfs/dbraw/zinc/11/00/44/1050110044.db2.gz DUDNVRJIYRULDK-JTQLQIEISA-N 1 2 312.291 4.431 20 0 DIADLO CO[C@H](C)c1cccc(Nc2cc(OC(F)(F)F)cc[nH+]2)c1 ZINC001209948602 1050110087 /nfs/dbraw/zinc/11/00/87/1050110087.db2.gz DUDNVRJIYRULDK-SNVBAGLBSA-N 1 2 312.291 4.431 20 0 DIADLO CCOc1cccc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)C)no2)c1 ZINC000068839573 1050111290 /nfs/dbraw/zinc/11/12/90/1050111290.db2.gz CYVZTWLCSDPVRG-CHWSQXEVSA-N 1 2 303.406 4.004 20 0 DIADLO CCOc1cccc([C@H](C)[NH2+][C@H](C)c2nc(C(C)C)no2)c1 ZINC000068839574 1050111435 /nfs/dbraw/zinc/11/14/35/1050111435.db2.gz CYVZTWLCSDPVRG-QWHCGFSZSA-N 1 2 303.406 4.004 20 0 DIADLO CCOc1cccc([C@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000068839566 1050111437 /nfs/dbraw/zinc/11/14/37/1050111437.db2.gz WJIUUWJQBCOXSV-QWHCGFSZSA-N 1 2 317.433 4.178 20 0 DIADLO Cc1cn2c(cccc2Nc2cc(C(F)(F)F)ccc2O)[nH+]1 ZINC001209979635 1050114925 /nfs/dbraw/zinc/11/49/25/1050114925.db2.gz ZISZUPRMEXOKOW-UHFFFAOYSA-N 1 2 307.275 4.111 20 0 DIADLO CCN(C)c1ccc(Nc2cc(C(F)(F)F)ccc2O)c[nH+]1 ZINC001209982243 1050115380 /nfs/dbraw/zinc/11/53/80/1050115380.db2.gz OJZAQSCOOQQMRS-UHFFFAOYSA-N 1 2 311.307 4.006 20 0 DIADLO Cc1cc(Nc2cnc(Br)c(F)c2)ccc1[NH+](C)C ZINC001210042278 1050127667 /nfs/dbraw/zinc/12/76/67/1050127667.db2.gz ZJFIHGXQLWAMQT-UHFFFAOYSA-N 1 2 324.197 4.101 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1coc(-c2ccccc2)n1 ZINC000590938425 1050115880 /nfs/dbraw/zinc/11/58/80/1050115880.db2.gz LGRQWEPJSUHYGP-OAHLLOKOSA-N 1 2 320.392 4.297 20 0 DIADLO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1coc(-c2ccccc2)n1 ZINC000590938425 1050115883 /nfs/dbraw/zinc/11/58/83/1050115883.db2.gz LGRQWEPJSUHYGP-OAHLLOKOSA-N 1 2 320.392 4.297 20 0 DIADLO Oc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1C(F)(F)F ZINC001209984239 1050116214 /nfs/dbraw/zinc/11/62/14/1050116214.db2.gz IHVRQAZFYUDZEB-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(C(C)(C)C)on1 ZINC000573047350 1050117259 /nfs/dbraw/zinc/11/72/59/1050117259.db2.gz GZFXDLRKSLJCGG-CMPLNLGQSA-N 1 2 304.356 4.135 20 0 DIADLO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cc(C(C)(C)C)on1 ZINC000573047350 1050117262 /nfs/dbraw/zinc/11/72/62/1050117262.db2.gz GZFXDLRKSLJCGG-CMPLNLGQSA-N 1 2 304.356 4.135 20 0 DIADLO Cc1ccc(Br)c(Nc2ccc3c[nH+]ccc3c2)n1 ZINC001210043866 1050127900 /nfs/dbraw/zinc/12/79/00/1050127900.db2.gz KYBGFXTXQAZFEC-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO CCOC(=O)c1ccc(Nc2ccc([NH+](C)C)c(C)c2)cc1F ZINC001210043533 1050127918 /nfs/dbraw/zinc/12/79/18/1050127918.db2.gz GUQBJGWXGBUPQU-UHFFFAOYSA-N 1 2 316.376 4.120 20 0 DIADLO Fc1cc(Br)cnc1Nc1ccc2c[nH+]ccc2c1 ZINC001210046414 1050128503 /nfs/dbraw/zinc/12/85/03/1050128503.db2.gz XFNSIDBFUHVCSY-UHFFFAOYSA-N 1 2 318.149 4.275 20 0 DIADLO CC(=O)Nc1ccc(Nc2ccc([NH+](C)C)c(C)c2)cc1Cl ZINC001210044320 1050128754 /nfs/dbraw/zinc/12/87/54/1050128754.db2.gz WSOQTDWHLYGWDB-UHFFFAOYSA-N 1 2 317.820 4.416 20 0 DIADLO Cc1cc(Nc2ccc3c(c2)C(C)(C)CC(=O)N3)ccc1[NH+](C)C ZINC001210044075 1050128795 /nfs/dbraw/zinc/12/87/95/1050128795.db2.gz KNEUXGYTWXYQIY-UHFFFAOYSA-N 1 2 323.440 4.424 20 0 DIADLO Cc1cc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)on1 ZINC000591377086 1050143628 /nfs/dbraw/zinc/14/36/28/1050143628.db2.gz PORZROFXFKBLKC-UHFFFAOYSA-N 1 2 306.356 4.206 20 0 DIADLO Cc1cc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)on1 ZINC000591377086 1050143633 /nfs/dbraw/zinc/14/36/33/1050143633.db2.gz PORZROFXFKBLKC-UHFFFAOYSA-N 1 2 306.356 4.206 20 0 DIADLO O=C(C=C1CCCC1)Nc1ccccc1-c1[nH+]cc2n1CCCC2 ZINC000823769428 1050154107 /nfs/dbraw/zinc/15/41/07/1050154107.db2.gz CHSFASCUQMUUEO-UHFFFAOYSA-N 1 2 321.424 4.325 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000805838743 1050155155 /nfs/dbraw/zinc/15/51/55/1050155155.db2.gz GLFFDKGYMPJECL-CYBMUJFWSA-N 1 2 309.866 4.027 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000805838743 1050155159 /nfs/dbraw/zinc/15/51/59/1050155159.db2.gz GLFFDKGYMPJECL-CYBMUJFWSA-N 1 2 309.866 4.027 20 0 DIADLO CC(C)C[C@H]1COCC[N@@H+]1Cc1cc2ccccc2nc1Cl ZINC000733796384 1050155986 /nfs/dbraw/zinc/15/59/86/1050155986.db2.gz RMPGVXRSTKDFFJ-INIZCTEOSA-N 1 2 318.848 4.135 20 0 DIADLO CC(C)C[C@H]1COCC[N@H+]1Cc1cc2ccccc2nc1Cl ZINC000733796384 1050155998 /nfs/dbraw/zinc/15/59/98/1050155998.db2.gz RMPGVXRSTKDFFJ-INIZCTEOSA-N 1 2 318.848 4.135 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)N([C@H](C)c3ccccc3)C3CC3)ccn12 ZINC000573264065 1050156158 /nfs/dbraw/zinc/15/61/58/1050156158.db2.gz SGRKVTUWVWYKQI-OAHLLOKOSA-N 1 2 319.408 4.009 20 0 DIADLO c1ccc(-c2nnsc2Nc2cccc3cc[nH+]cc32)cc1 ZINC001210223901 1050165699 /nfs/dbraw/zinc/16/56/99/1050165699.db2.gz HXMLPAAXMWSRCR-UHFFFAOYSA-N 1 2 304.378 4.497 20 0 DIADLO Cc1nc(Cl)c(Nc2cccc3cc[nH+]cc32)c(Cl)n1 ZINC001210223905 1050166357 /nfs/dbraw/zinc/16/63/57/1050166357.db2.gz IBWDOKBICHBBGK-UHFFFAOYSA-N 1 2 305.168 4.384 20 0 DIADLO CC(C)c1cnn2cc(Nc3cccc4cc[nH+]cc43)cnc12 ZINC001210226485 1050167477 /nfs/dbraw/zinc/16/74/77/1050167477.db2.gz YERQNYLBXUPBTE-UHFFFAOYSA-N 1 2 303.369 4.145 20 0 DIADLO COC(=O)c1c(F)ccc(Nc2cccc3cc[nH+]cc32)c1F ZINC001210230235 1050167516 /nfs/dbraw/zinc/16/75/16/1050167516.db2.gz AOOVMPQUNZNNMH-UHFFFAOYSA-N 1 2 314.291 4.043 20 0 DIADLO c1sc(-c2ccncc2)nc1Nc1cccc2cc[nH+]cc21 ZINC001210225820 1050167639 /nfs/dbraw/zinc/16/76/39/1050167639.db2.gz KQOFCJVPVLMZPV-UHFFFAOYSA-N 1 2 304.378 4.497 20 0 DIADLO COc1cc(Nc2cccc3cc[nH+]cc32)ncc1C(F)(F)F ZINC001210226436 1050167767 /nfs/dbraw/zinc/16/77/67/1050167767.db2.gz WBBBCLYZMDNUFT-UHFFFAOYSA-N 1 2 319.286 4.401 20 0 DIADLO CCOC(=O)c1nc(C2CC2)oc1Nc1cccc2cc[nH+]cc21 ZINC001210224619 1050168379 /nfs/dbraw/zinc/16/83/79/1050168379.db2.gz SYOZIOYZEMPDBX-UHFFFAOYSA-N 1 2 323.352 4.021 20 0 DIADLO FC(F)(F)c1ncccc1Nc1cc[nH+]c2ccc(Cl)cc12 ZINC001210233181 1050172239 /nfs/dbraw/zinc/17/22/39/1050172239.db2.gz RLDOFMFKUYLHQC-UHFFFAOYSA-N 1 2 323.705 4.468 20 0 DIADLO Nc1cc(Nc2ccc(N3CCCCC3)[nH+]c2)ccc1Cl ZINC001160305314 1050173527 /nfs/dbraw/zinc/17/35/27/1050173527.db2.gz YHSRKWWGMFIRFG-UHFFFAOYSA-N 1 2 302.809 4.051 20 0 DIADLO CC[N@H+](Cc1ccncc1)Cc1cc(F)ccc1Br ZINC000348081188 1050176257 /nfs/dbraw/zinc/17/62/57/1050176257.db2.gz WUSAATXJSUDTNW-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC[N@@H+](Cc1ccncc1)Cc1cc(F)ccc1Br ZINC000348081188 1050176264 /nfs/dbraw/zinc/17/62/64/1050176264.db2.gz WUSAATXJSUDTNW-UHFFFAOYSA-N 1 2 323.209 4.005 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cccc(C(F)F)c1)c1nc(C2CC2)no1 ZINC000348061292 1050176404 /nfs/dbraw/zinc/17/64/04/1050176404.db2.gz YHEZGQOXOPZSQR-AWEZNQCLSA-N 1 2 321.371 4.372 20 0 DIADLO Fc1ccc(C2CC[NH+](Cc3ncc(Cl)s3)CC2)cc1 ZINC000770641931 1050177268 /nfs/dbraw/zinc/17/72/68/1050177268.db2.gz MLJMBVMFHGUKAG-UHFFFAOYSA-N 1 2 310.825 4.315 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccnc(Cl)c1 ZINC000766191474 1050181860 /nfs/dbraw/zinc/18/18/60/1050181860.db2.gz GNMIDYXRJMWIPV-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO CCC[N@H+](CC(F)(F)C(F)F)[C@@H]1CCc2ccccc2C1 ZINC000733897597 1050185971 /nfs/dbraw/zinc/18/59/71/1050185971.db2.gz JXHZXTAQVRAODB-CQSZACIVSA-N 1 2 303.343 4.156 20 0 DIADLO CCC[N@@H+](CC(F)(F)C(F)F)[C@@H]1CCc2ccccc2C1 ZINC000733897597 1050185975 /nfs/dbraw/zinc/18/59/75/1050185975.db2.gz JXHZXTAQVRAODB-CQSZACIVSA-N 1 2 303.343 4.156 20 0 DIADLO CCc1cc(OCc2cnc(Cl)s2)c2ccccc2[nH+]1 ZINC000770699356 1050188196 /nfs/dbraw/zinc/18/81/96/1050188196.db2.gz UXMASCVIKWSRFO-UHFFFAOYSA-N 1 2 304.802 4.486 20 0 DIADLO COc1ccc(Nc2c[nH+]c(C)c(N)c2)cc1-c1ccccc1 ZINC001210288447 1050191882 /nfs/dbraw/zinc/19/18/82/1050191882.db2.gz PWXJLDBPBWQSJW-UHFFFAOYSA-N 1 2 305.381 4.391 20 0 DIADLO Cc1[nH+]cc(Nc2cccc(NC(=O)OC(C)(C)C)c2)cc1N ZINC001210290271 1050191934 /nfs/dbraw/zinc/19/19/34/1050191934.db2.gz HJDVFGIFZYXBEN-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(Sc3ccc(N)cc3)cc2)cc1N ZINC001210288555 1050192001 /nfs/dbraw/zinc/19/20/01/1050192001.db2.gz SKPVJDAJVQQFJP-UHFFFAOYSA-N 1 2 322.437 4.449 20 0 DIADLO Cc1[nH+]cc(Nc2c(O)cc(C(F)(F)F)cc2Cl)cc1N ZINC001210291703 1050192072 /nfs/dbraw/zinc/19/20/72/1050192072.db2.gz RDOBPBCXMPEKMP-UHFFFAOYSA-N 1 2 317.698 4.094 20 0 DIADLO Cc1[nH+]cc(Nc2cc(Cl)cc(Br)c2)cc1N ZINC001210288602 1050192349 /nfs/dbraw/zinc/19/23/49/1050192349.db2.gz QBHHKMITANBQEF-UHFFFAOYSA-N 1 2 312.598 4.132 20 0 DIADLO CCOc1cc(Nc2c[nH+]c(C)c(N)c2)cc(C(F)(F)F)c1 ZINC001210289590 1050192375 /nfs/dbraw/zinc/19/23/75/1050192375.db2.gz SVSIDBYUMMAKKS-UHFFFAOYSA-N 1 2 311.307 4.133 20 0 DIADLO Cc1[nH+]cc(Nc2ccc(Cl)cc2C(F)(F)F)cc1N ZINC001210288322 1050192699 /nfs/dbraw/zinc/19/26/99/1050192699.db2.gz MBLIWURKVRGVMQ-UHFFFAOYSA-N 1 2 301.699 4.388 20 0 DIADLO Clc1ccc2c(Nc3ccc(-n4ccnn4)cc3)cc[nH+]c2c1 ZINC001210294529 1050194596 /nfs/dbraw/zinc/19/45/96/1050194596.db2.gz PBSZOUDCLQXHNZ-UHFFFAOYSA-N 1 2 321.771 4.213 20 0 DIADLO Oc1cccc2c1CC[N@H+](Cc1cc3c(cccc3Cl)[nH]1)C2 ZINC001136858069 1050198841 /nfs/dbraw/zinc/19/88/41/1050198841.db2.gz LOIOXSKPJDWFBG-UHFFFAOYSA-N 1 2 312.800 4.085 20 0 DIADLO Oc1cccc2c1CC[N@@H+](Cc1cc3c(cccc3Cl)[nH]1)C2 ZINC001136858069 1050198847 /nfs/dbraw/zinc/19/88/47/1050198847.db2.gz LOIOXSKPJDWFBG-UHFFFAOYSA-N 1 2 312.800 4.085 20 0 DIADLO Clc1cccc2[nH]c(C[N@@H+]3CCc4ccsc4C3)cc21 ZINC001136862736 1050202572 /nfs/dbraw/zinc/20/25/72/1050202572.db2.gz YQDMLFBYZOXOIB-UHFFFAOYSA-N 1 2 302.830 4.441 20 0 DIADLO Clc1cccc2[nH]c(C[N@H+]3CCc4ccsc4C3)cc21 ZINC001136862736 1050202580 /nfs/dbraw/zinc/20/25/80/1050202580.db2.gz YQDMLFBYZOXOIB-UHFFFAOYSA-N 1 2 302.830 4.441 20 0 DIADLO CC(C)(C)/C=C\C(=O)Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000733919883 1050203656 /nfs/dbraw/zinc/20/36/56/1050203656.db2.gz KMEKSOODGXXCOB-QXMHVHEDSA-N 1 2 323.440 4.427 20 0 DIADLO FC(F)Oc1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)cc1 ZINC001210327220 1050206202 /nfs/dbraw/zinc/20/62/02/1050206202.db2.gz CCBRVCJCTVMTRW-UHFFFAOYSA-N 1 2 315.323 4.276 20 0 DIADLO Cc1cccc(Nc2ccc3c(cnn3[C@H]3CCCCO3)c2)[nH+]1 ZINC001210330879 1050207227 /nfs/dbraw/zinc/20/72/27/1050207227.db2.gz ASSQGNRQJNWBES-GOSISDBHSA-N 1 2 308.385 4.182 20 0 DIADLO CC(=O)c1ccc([C@H](C)Nc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC001171055574 1050210588 /nfs/dbraw/zinc/21/05/88/1050210588.db2.gz AIZBGXRLMYAYIH-AWEZNQCLSA-N 1 2 309.413 4.058 20 0 DIADLO Fc1ccccc1[C@H]1CCCC[N@@H+]1Cc1cn2ccccc2n1 ZINC001136879574 1050216470 /nfs/dbraw/zinc/21/64/70/1050216470.db2.gz KLOWHJMKHYZVMM-GOSISDBHSA-N 1 2 309.388 4.201 20 0 DIADLO Fc1ccccc1[C@H]1CCCC[N@H+]1Cc1cn2ccccc2n1 ZINC001136879574 1050216487 /nfs/dbraw/zinc/21/64/87/1050216487.db2.gz KLOWHJMKHYZVMM-GOSISDBHSA-N 1 2 309.388 4.201 20 0 DIADLO Clc1ccc2c(Nc3cccc4c3OCCO4)cc[nH+]c2c1 ZINC001210367097 1050217542 /nfs/dbraw/zinc/21/75/42/1050217542.db2.gz XNDCUSZIPKGRFF-UHFFFAOYSA-N 1 2 312.756 4.403 20 0 DIADLO Cc1cc(-n2cc[nH+]c2)ccc1CSCCC(F)(F)F ZINC000478752798 1050223766 /nfs/dbraw/zinc/22/37/66/1050223766.db2.gz AILMSTBRJWBZQI-UHFFFAOYSA-N 1 2 300.349 4.366 20 0 DIADLO CC[C@H]1C[N@H+](Cn2ncsc2=S)CC[C@H]1c1ccccc1 ZINC000746379871 1050223672 /nfs/dbraw/zinc/22/36/72/1050223672.db2.gz BAGXVMDUPMCHFR-DZGCQCFKSA-N 1 2 319.499 4.147 20 0 DIADLO CC[C@H]1C[N@@H+](Cn2ncsc2=S)CC[C@H]1c1ccccc1 ZINC000746379871 1050223686 /nfs/dbraw/zinc/22/36/86/1050223686.db2.gz BAGXVMDUPMCHFR-DZGCQCFKSA-N 1 2 319.499 4.147 20 0 DIADLO C[C@@H]([NH2+]Cc1cccnc1Cl)c1nc2ccccc2s1 ZINC000734164438 1050235424 /nfs/dbraw/zinc/23/54/24/1050235424.db2.gz LWQHGPDSDHUIEO-SNVBAGLBSA-N 1 2 303.818 4.196 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@@H+]2Cc2cn(C(C)C)nn2)o1 ZINC000573727141 1050248164 /nfs/dbraw/zinc/24/81/64/1050248164.db2.gz PTKHISYEVGDBDG-KRWDZBQOSA-N 1 2 316.449 4.132 20 0 DIADLO CCc1ccc([C@@H]2CCCCC[N@H+]2Cc2cn(C(C)C)nn2)o1 ZINC000573727141 1050248179 /nfs/dbraw/zinc/24/81/79/1050248179.db2.gz PTKHISYEVGDBDG-KRWDZBQOSA-N 1 2 316.449 4.132 20 0 DIADLO COCOc1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)c(C)c1 ZINC001210489927 1050266134 /nfs/dbraw/zinc/26/61/34/1050266134.db2.gz GAGSALKMDLXJGC-UHFFFAOYSA-N 1 2 317.776 4.022 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@@H+]1Cc1nc(C)c(C)o1 ZINC000592323175 1050286371 /nfs/dbraw/zinc/28/63/71/1050286371.db2.gz LIVNCRLHWGLBMQ-MRXNPFEDSA-N 1 2 300.402 4.027 20 0 DIADLO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1nc(C)c(C)o1 ZINC000592323175 1050286384 /nfs/dbraw/zinc/28/63/84/1050286384.db2.gz LIVNCRLHWGLBMQ-MRXNPFEDSA-N 1 2 300.402 4.027 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1nc(C)c(C)o1 ZINC000592323171 1050287554 /nfs/dbraw/zinc/28/75/54/1050287554.db2.gz LIVNCRLHWGLBMQ-INIZCTEOSA-N 1 2 300.402 4.027 20 0 DIADLO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1nc(C)c(C)o1 ZINC000592323171 1050287565 /nfs/dbraw/zinc/28/75/65/1050287565.db2.gz LIVNCRLHWGLBMQ-INIZCTEOSA-N 1 2 300.402 4.027 20 0 DIADLO CCCCCCc1ccc([C@H](C)[NH2+][C@H](C)c2ncn(C)n2)cc1 ZINC000783301162 1050310445 /nfs/dbraw/zinc/31/04/45/1050310445.db2.gz ZTTZMBUAYMJMLV-JKSUJKDBSA-N 1 2 314.477 4.350 20 0 DIADLO C[C@@H]1C[N@H+](Cc2ccc(Cl)c(OC(F)(F)F)c2)C[C@@H]1F ZINC001143356924 1050314123 /nfs/dbraw/zinc/31/41/23/1050314123.db2.gz LGSDUVBXHVMYEN-KCJUWKMLSA-N 1 2 311.706 4.028 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2ccc(Cl)c(OC(F)(F)F)c2)C[C@@H]1F ZINC001143356924 1050314141 /nfs/dbraw/zinc/31/41/41/1050314141.db2.gz LGSDUVBXHVMYEN-KCJUWKMLSA-N 1 2 311.706 4.028 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@](C)(F)C2)cc1C(F)(F)F ZINC001143636479 1050323206 /nfs/dbraw/zinc/32/32/06/1050323206.db2.gz IWGCAVYUPXDNJH-AWEZNQCLSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@](C)(F)C2)cc1C(F)(F)F ZINC001143636479 1050323215 /nfs/dbraw/zinc/32/32/15/1050323215.db2.gz IWGCAVYUPXDNJH-AWEZNQCLSA-N 1 2 305.315 4.038 20 0 DIADLO CC(C)[C@@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2Cl)CCO1 ZINC001143715323 1050338331 /nfs/dbraw/zinc/33/83/31/1050338331.db2.gz GTCJXMLTSQOBHR-AWEZNQCLSA-N 1 2 321.770 4.216 20 0 DIADLO CC(C)[C@@H]1C[N@@H+](Cc2ccc(C(F)(F)F)cc2Cl)CCO1 ZINC001143715323 1050338340 /nfs/dbraw/zinc/33/83/40/1050338340.db2.gz GTCJXMLTSQOBHR-AWEZNQCLSA-N 1 2 321.770 4.216 20 0 DIADLO FC(F)(F)Oc1ccc(Cl)cc1C[NH+]1C2CCC1CC2 ZINC001143704420 1050340934 /nfs/dbraw/zinc/34/09/34/1050340934.db2.gz DXYGHHLPMCTTEN-UHFFFAOYSA-N 1 2 305.727 4.365 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)cc1Cl ZINC001143734136 1050342406 /nfs/dbraw/zinc/34/24/06/1050342406.db2.gz CBDSUZWVXZUFQS-JTQLQIEISA-N 1 2 321.770 4.355 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)cc1Cl ZINC001143734136 1050342408 /nfs/dbraw/zinc/34/24/08/1050342408.db2.gz CBDSUZWVXZUFQS-JTQLQIEISA-N 1 2 321.770 4.355 20 0 DIADLO COc1ccnc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)c1 ZINC000592890244 1050345863 /nfs/dbraw/zinc/34/58/63/1050345863.db2.gz CQKZNRUAMQATCW-ZDUSSCGKSA-N 1 2 316.832 4.469 20 0 DIADLO COc1ccnc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)c1 ZINC000592890244 1050345875 /nfs/dbraw/zinc/34/58/75/1050345875.db2.gz CQKZNRUAMQATCW-ZDUSSCGKSA-N 1 2 316.832 4.469 20 0 DIADLO Fc1ccc(F)c(C[N@H+]2CCC[C@@H](F)CC2)c1Br ZINC001143813324 1050372450 /nfs/dbraw/zinc/37/24/50/1050372450.db2.gz NWYIJXUTSMZWGS-SECBINFHSA-N 1 2 322.168 4.051 20 0 DIADLO Fc1ccc(F)c(C[N@@H+]2CCC[C@@H](F)CC2)c1Br ZINC001143813324 1050372462 /nfs/dbraw/zinc/37/24/62/1050372462.db2.gz NWYIJXUTSMZWGS-SECBINFHSA-N 1 2 322.168 4.051 20 0 DIADLO CSC1CC[NH+](Cc2c(F)ccc(Cl)c2Cl)CC1 ZINC001143860673 1050379194 /nfs/dbraw/zinc/37/91/94/1050379194.db2.gz RKIXGASBNBTGFR-UHFFFAOYSA-N 1 2 308.249 4.460 20 0 DIADLO Clc1cc(Cl)c(C[N@@H+]2CCCC3(COC3)C2)c(Cl)c1 ZINC001143797936 1050364475 /nfs/dbraw/zinc/36/44/75/1050364475.db2.gz XXRPTROLGHTMSP-UHFFFAOYSA-N 1 2 320.647 4.259 20 0 DIADLO Clc1cc(Cl)c(C[N@H+]2CCCC3(COC3)C2)c(Cl)c1 ZINC001143797936 1050364488 /nfs/dbraw/zinc/36/44/88/1050364488.db2.gz XXRPTROLGHTMSP-UHFFFAOYSA-N 1 2 320.647 4.259 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1c(F)ccc(F)c1Br ZINC001143811032 1050369917 /nfs/dbraw/zinc/36/99/17/1050369917.db2.gz CKULWXQKNQRBLT-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1c(F)ccc(F)c1Br ZINC001143811032 1050369924 /nfs/dbraw/zinc/36/99/24/1050369924.db2.gz CKULWXQKNQRBLT-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nc(C(C)C)n2ccccc12 ZINC000574046078 1050371113 /nfs/dbraw/zinc/37/11/13/1050371113.db2.gz AOBICMZEYJPSBD-SFHVURJKSA-N 1 2 322.456 4.436 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nc(C(C)C)n2ccccc12 ZINC000574046078 1050371125 /nfs/dbraw/zinc/37/11/25/1050371125.db2.gz AOBICMZEYJPSBD-SFHVURJKSA-N 1 2 322.456 4.436 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCC[C@@H]2c2ccccn2)cc1Cl ZINC001143847406 1050372131 /nfs/dbraw/zinc/37/21/31/1050372131.db2.gz LVJFTLJSYGUMDG-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCC[C@@H]2c2ccccn2)cc1Cl ZINC001143847406 1050372135 /nfs/dbraw/zinc/37/21/35/1050372135.db2.gz LVJFTLJSYGUMDG-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCC[C@H]2c2ccccn2)cc1Cl ZINC001143847405 1050373299 /nfs/dbraw/zinc/37/32/99/1050373299.db2.gz LVJFTLJSYGUMDG-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCC[C@H]2c2ccccn2)cc1Cl ZINC001143847405 1050373306 /nfs/dbraw/zinc/37/33/06/1050373306.db2.gz LVJFTLJSYGUMDG-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CCOc1c(Cl)ccc(C[N@@H+](C)Cc2ccc(C)nc2)c1F ZINC001143837656 1050375540 /nfs/dbraw/zinc/37/55/40/1050375540.db2.gz XRIBBIACBPGJGB-UHFFFAOYSA-N 1 2 322.811 4.213 20 0 DIADLO CCOc1c(Cl)ccc(C[N@H+](C)Cc2ccc(C)nc2)c1F ZINC001143837656 1050375528 /nfs/dbraw/zinc/37/55/28/1050375528.db2.gz XRIBBIACBPGJGB-UHFFFAOYSA-N 1 2 322.811 4.213 20 0 DIADLO COC(=O)c1cccc([C@@H](C)Nc2ccc([NH+](C)C)c(C)c2)c1 ZINC001171112128 1050376361 /nfs/dbraw/zinc/37/63/61/1050376361.db2.gz ZOBHRNAJFXOGCS-CQSZACIVSA-N 1 2 312.413 4.021 20 0 DIADLO COCCC1CC[NH+](Cc2c(F)ccc(Cl)c2Cl)CC1 ZINC001143861000 1050378010 /nfs/dbraw/zinc/37/80/10/1050378010.db2.gz XDHNTWGTQAMGBV-UHFFFAOYSA-N 1 2 320.235 4.381 20 0 DIADLO CC1(C)C[N@H+](Cc2c(F)ccc(Cl)c2Cl)CCCO1 ZINC001143859978 1050378226 /nfs/dbraw/zinc/37/82/26/1050378226.db2.gz FUDHSRGVPFIAQN-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO CC1(C)C[N@@H+](Cc2c(F)ccc(Cl)c2Cl)CCCO1 ZINC001143859978 1050378238 /nfs/dbraw/zinc/37/82/38/1050378238.db2.gz FUDHSRGVPFIAQN-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@H]1CC[N@H+](Cc2c(F)ccc(Cl)c2Cl)C1 ZINC001143859990 1050378793 /nfs/dbraw/zinc/37/87/93/1050378793.db2.gz GEECNNOFBDKUFU-JTQLQIEISA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@H]1CC[N@@H+](Cc2c(F)ccc(Cl)c2Cl)C1 ZINC001143859990 1050378806 /nfs/dbraw/zinc/37/88/06/1050378806.db2.gz GEECNNOFBDKUFU-JTQLQIEISA-N 1 2 306.208 4.133 20 0 DIADLO COc1c(F)cc(C[N@@H+]2CCCC[C@](C)(F)C2)cc1Cl ZINC001143840290 1050379011 /nfs/dbraw/zinc/37/90/11/1050379011.db2.gz YSVKPVCRQWDVFE-HNNXBMFYSA-N 1 2 303.780 4.202 20 0 DIADLO COc1c(F)cc(C[N@H+]2CCCC[C@](C)(F)C2)cc1Cl ZINC001143840290 1050379019 /nfs/dbraw/zinc/37/90/19/1050379019.db2.gz YSVKPVCRQWDVFE-HNNXBMFYSA-N 1 2 303.780 4.202 20 0 DIADLO Cc1nc(C[NH2+]C(c2cccc(C)c2)c2cccc(C)c2)co1 ZINC000574169433 1050378985 /nfs/dbraw/zinc/37/89/85/1050378985.db2.gz BNZLSOVFKRWBMJ-UHFFFAOYSA-N 1 2 306.409 4.479 20 0 DIADLO Oc1cc(Nc2ccc(N3CCCC3)[nH+]c2)cc(C(F)(F)F)c1 ZINC001210824775 1050381734 /nfs/dbraw/zinc/38/17/34/1050381734.db2.gz YQMXXAIVNTXQEN-UHFFFAOYSA-N 1 2 323.318 4.150 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[N@H+]1C[C@H]2[C@H](CC2(F)F)C1 ZINC001143854972 1050386392 /nfs/dbraw/zinc/38/63/92/1050386392.db2.gz OZCREIRDTNPKBG-APPZFPTMSA-N 1 2 310.146 4.220 20 0 DIADLO Fc1ccc(Cl)c(Cl)c1C[N@@H+]1C[C@H]2[C@H](CC2(F)F)C1 ZINC001143854972 1050386408 /nfs/dbraw/zinc/38/64/08/1050386408.db2.gz OZCREIRDTNPKBG-APPZFPTMSA-N 1 2 310.146 4.220 20 0 DIADLO CC[C@@]1(C)Oc2ccc(NCc3c[nH+]c4ccc(C)cn34)cc2O1 ZINC000785553757 1050389904 /nfs/dbraw/zinc/38/99/04/1050389904.db2.gz INHFRCXZKWFTDC-IBGZPJMESA-N 1 2 323.396 4.152 20 0 DIADLO FC(F)(F)c1ccc(Cl)c(Cl)c1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC001143880587 1050394674 /nfs/dbraw/zinc/39/46/74/1050394674.db2.gz WKKWNLYAWHWFRH-OCAPTIKFSA-N 1 2 310.146 4.464 20 0 DIADLO FC(F)(F)c1ccc(Cl)c(Cl)c1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC001143880587 1050394685 /nfs/dbraw/zinc/39/46/85/1050394685.db2.gz WKKWNLYAWHWFRH-OCAPTIKFSA-N 1 2 310.146 4.464 20 0 DIADLO FC[C@H]1CC[N@@H+]([C@@H]2CCc3cc(Cl)ccc3C2)CC1(F)F ZINC001171116328 1050397746 /nfs/dbraw/zinc/39/77/46/1050397746.db2.gz NKLUGZMYZIKXSG-UKRRQHHQSA-N 1 2 317.782 4.124 20 0 DIADLO FC[C@H]1CC[N@H+]([C@@H]2CCc3cc(Cl)ccc3C2)CC1(F)F ZINC001171116328 1050397756 /nfs/dbraw/zinc/39/77/56/1050397756.db2.gz NKLUGZMYZIKXSG-UKRRQHHQSA-N 1 2 317.782 4.124 20 0 DIADLO COc1ccc(Cl)c(C[N@@H+]2CCC[C@H]2c2ccccn2)c1F ZINC001143895837 1050400818 /nfs/dbraw/zinc/40/08/18/1050400818.db2.gz JEMLPLVRCUSAON-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(Cl)c(C[N@H+]2CCC[C@H]2c2ccccn2)c1F ZINC001143895837 1050400821 /nfs/dbraw/zinc/40/08/21/1050400821.db2.gz JEMLPLVRCUSAON-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H](c1cccs1)[N@H+](C)Cc1c(Cl)nc2ccccn21 ZINC000157803544 1050406111 /nfs/dbraw/zinc/40/61/11/1050406111.db2.gz YLBUYVLTJYSQAO-NSHDSACASA-N 1 2 305.834 4.242 20 0 DIADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1c(Cl)nc2ccccn21 ZINC000157803544 1050406117 /nfs/dbraw/zinc/40/61/17/1050406117.db2.gz YLBUYVLTJYSQAO-NSHDSACASA-N 1 2 305.834 4.242 20 0 DIADLO Cc1c(C[N@@H+]2CC[C@](C)(F)[C@H](F)C2)cccc1C(F)(F)F ZINC001143923275 1050408282 /nfs/dbraw/zinc/40/82/82/1050408282.db2.gz UJWSJAWTKSOJMV-KGLIPLIRSA-N 1 2 307.306 4.286 20 0 DIADLO Cc1c(C[N@H+]2CC[C@](C)(F)[C@H](F)C2)cccc1C(F)(F)F ZINC001143923275 1050408291 /nfs/dbraw/zinc/40/82/91/1050408291.db2.gz UJWSJAWTKSOJMV-KGLIPLIRSA-N 1 2 307.306 4.286 20 0 DIADLO CCOc1ccc(F)c(C[N@H+](CC)Cc2cccs2)c1F ZINC001143943085 1050412681 /nfs/dbraw/zinc/41/26/81/1050412681.db2.gz RYYPUYRBNVCMNW-UHFFFAOYSA-N 1 2 311.397 4.447 20 0 DIADLO CCOc1ccc(F)c(C[N@@H+](CC)Cc2cccs2)c1F ZINC001143943085 1050412683 /nfs/dbraw/zinc/41/26/83/1050412683.db2.gz RYYPUYRBNVCMNW-UHFFFAOYSA-N 1 2 311.397 4.447 20 0 DIADLO COc1cc[nH+]cc1Nc1cc2c(nc(C)n2C(C)C)c(F)c1 ZINC001210920206 1050413759 /nfs/dbraw/zinc/41/37/59/1050413759.db2.gz DYUFBLQTNPUZOE-UHFFFAOYSA-N 1 2 314.364 4.212 20 0 DIADLO C[N@H+](CCOc1ccccc1)Cc1c(Cl)ccc(F)c1F ZINC001143956795 1050413906 /nfs/dbraw/zinc/41/39/06/1050413906.db2.gz DXFFBKGXAJRKLX-UHFFFAOYSA-N 1 2 311.759 4.129 20 0 DIADLO C[N@@H+](CCOc1ccccc1)Cc1c(Cl)ccc(F)c1F ZINC001143956795 1050413919 /nfs/dbraw/zinc/41/39/19/1050413919.db2.gz DXFFBKGXAJRKLX-UHFFFAOYSA-N 1 2 311.759 4.129 20 0 DIADLO COc1cc[nH+]c(Nc2cc3c(nc(C)n3C(C)C)c(F)c2)c1 ZINC001210924690 1050415463 /nfs/dbraw/zinc/41/54/63/1050415463.db2.gz ZSTULKWAPNFUDR-UHFFFAOYSA-N 1 2 314.364 4.212 20 0 DIADLO Cc1ccc([C@@H]2CCC[C@@H]2OC(=O)C[C@@H](C)n2cc[nH+]c2)cc1 ZINC000844480401 1050429798 /nfs/dbraw/zinc/42/97/98/1050429798.db2.gz FKPWRMZHGCWEQK-NJAFHUGGSA-N 1 2 312.413 4.022 20 0 DIADLO CC[C@H]([NH2+]Cc1ncc(CSC)s1)c1ccccc1F ZINC000593665869 1050432228 /nfs/dbraw/zinc/43/22/28/1050432228.db2.gz MGFRAVWJPFBNRK-AWEZNQCLSA-N 1 2 310.463 4.386 20 0 DIADLO c1ccc(N2CCCCC2)c(Nc2[nH+]cccc2N2CCCC2)c1 ZINC001210960007 1050433427 /nfs/dbraw/zinc/43/34/27/1050433427.db2.gz AARRTKUTQYSLRZ-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO CC[C@@H](OC(=O)C[C@@H](C)n1cc[nH+]c1)c1ccc(Cl)cc1 ZINC000844462395 1050433641 /nfs/dbraw/zinc/43/36/41/1050433641.db2.gz NGFYZEJZUJVYJZ-IUODEOHRSA-N 1 2 306.793 4.182 20 0 DIADLO CC(C)c1ccc([C@@H](C)OC(=O)C[C@@H](C)n2cc[nH+]c2)cc1 ZINC000844471760 1050435124 /nfs/dbraw/zinc/43/51/24/1050435124.db2.gz FSOGIHJLLGIMJB-HUUCEWRRSA-N 1 2 300.402 4.262 20 0 DIADLO CC(C)c1ccc([C@H](C)OC(=O)C[C@H](C)n2cc[nH+]c2)cc1 ZINC000844471759 1050435373 /nfs/dbraw/zinc/43/53/73/1050435373.db2.gz FSOGIHJLLGIMJB-GJZGRUSLSA-N 1 2 300.402 4.262 20 0 DIADLO COc1cc2c(ccn2-c2ccccc2[NH+]2CCCCC2)c(N)c1 ZINC001210963998 1050436324 /nfs/dbraw/zinc/43/63/24/1050436324.db2.gz USMFMFNRCUDURX-UHFFFAOYSA-N 1 2 321.424 4.212 20 0 DIADLO CC[C@H](OC(=O)C[C@H](C)n1cc[nH+]c1)c1cccc(Cl)c1F ZINC000844489972 1050438702 /nfs/dbraw/zinc/43/87/02/1050438702.db2.gz KXFOWPGDVRUOKR-FZMZJTMJSA-N 1 2 324.783 4.321 20 0 DIADLO Cc1ccc[nH+]c1Nc1ccc(CNC(=O)OC(C)(C)C)cc1 ZINC001211005300 1050442863 /nfs/dbraw/zinc/44/28/63/1050442863.db2.gz QFQVADJEYVKHFI-UHFFFAOYSA-N 1 2 313.401 4.158 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2CCC[C@@H]2c2cccnc2)cc1F ZINC001144020195 1050443055 /nfs/dbraw/zinc/44/30/55/1050443055.db2.gz AWYBHIMRTVNWSC-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2CCC[C@@H]2c2cccnc2)cc1F ZINC001144020195 1050443062 /nfs/dbraw/zinc/44/30/62/1050443062.db2.gz AWYBHIMRTVNWSC-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1c(F)cc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)cc1F ZINC001144027853 1050445525 /nfs/dbraw/zinc/44/55/25/1050445525.db2.gz XCDIDMZYMHXAGB-LLVKDONJSA-N 1 2 323.305 4.138 20 0 DIADLO CCOc1c(F)cc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)cc1F ZINC001144027853 1050445530 /nfs/dbraw/zinc/44/55/30/1050445530.db2.gz XCDIDMZYMHXAGB-LLVKDONJSA-N 1 2 323.305 4.138 20 0 DIADLO Cn1c[nH+]c2cc(Nc3cncc(-c4ccccc4)c3)ccc21 ZINC001211023921 1050450517 /nfs/dbraw/zinc/45/05/17/1050450517.db2.gz WXBXTKAEBRDVKC-UHFFFAOYSA-N 1 2 300.365 4.379 20 0 DIADLO CN(C)c1ccc(NC/C(=C/F)CCc2ccc(F)cc2)[nH+]c1 ZINC001170055534 1050457052 /nfs/dbraw/zinc/45/70/52/1050457052.db2.gz FJTUCEWZTNBVBS-RVDMUPIBSA-N 1 2 317.383 4.185 20 0 DIADLO CN(c1ccc(Nc2ccc(F)cn2)c[nH+]1)C1CCCCC1 ZINC001212613379 1050476189 /nfs/dbraw/zinc/47/61/89/1050476189.db2.gz QWBBMOMGDMNHQS-UHFFFAOYSA-N 1 2 300.381 4.128 20 0 DIADLO FC(F)(F)[C@H]1CC[N@H+](Cc2csc(C3CCCC3)n2)C1 ZINC000761052509 1050486796 /nfs/dbraw/zinc/48/67/96/1050486796.db2.gz GKNGDHQOSIUXPL-NSHDSACASA-N 1 2 304.381 4.185 20 0 DIADLO FC(F)(F)[C@H]1CC[N@@H+](Cc2csc(C3CCCC3)n2)C1 ZINC000761052509 1050486801 /nfs/dbraw/zinc/48/68/01/1050486801.db2.gz GKNGDHQOSIUXPL-NSHDSACASA-N 1 2 304.381 4.185 20 0 DIADLO CN(c1ccc(Nc2ccc(F)nc2)c[nH+]1)C1CCCCC1 ZINC001212613544 1050490769 /nfs/dbraw/zinc/49/07/69/1050490769.db2.gz ZMDUBKYYVCIUMU-UHFFFAOYSA-N 1 2 300.381 4.128 20 0 DIADLO Fc1ccc2[nH]nc(C[NH+]3CCC(Cc4ccccc4)CC3)c2c1 ZINC001144186868 1050493483 /nfs/dbraw/zinc/49/34/83/1050493483.db2.gz LNNXNUQLBCFZCA-UHFFFAOYSA-N 1 2 323.415 4.157 20 0 DIADLO c1cncc(-c2cccc(Nc3[nH+]cccc3N3CCCC3)c2)c1 ZINC001211143521 1050495371 /nfs/dbraw/zinc/49/53/71/1050495371.db2.gz ZXADAPZKZGLWRX-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO CC(C)[C@@H](Nc1[nH+]cnc2[nH]cc(F)c21)c1ccc(F)cc1 ZINC001170059822 1050500689 /nfs/dbraw/zinc/50/06/89/1050500689.db2.gz COJBDMVUZXUWFG-CQSZACIVSA-N 1 2 302.328 4.045 20 0 DIADLO CC(C)([NH2+]Cc1nc(C2CC2)no1)c1ccc2ccccc2c1 ZINC000626115873 1050504137 /nfs/dbraw/zinc/50/41/37/1050504137.db2.gz IGEZWMCFRCBMBI-UHFFFAOYSA-N 1 2 307.397 4.125 20 0 DIADLO CC(C)c1nnc(C[NH2+]C(C)(C)c2ccc(C(C)C)cc2)o1 ZINC000594397839 1050505265 /nfs/dbraw/zinc/50/52/65/1050505265.db2.gz XKTZIPAAGWHCMT-UHFFFAOYSA-N 1 2 301.434 4.341 20 0 DIADLO CC(C)(C)OC(=O)Nc1cc(Nc2ccc(F)c(O)c2)cc[nH+]1 ZINC001211214510 1050521037 /nfs/dbraw/zinc/52/10/37/1050521037.db2.gz YAEMJWLXPZTTES-UHFFFAOYSA-N 1 2 319.336 4.017 20 0 DIADLO Cc1cc[nH+]c2cc(Nc3cnccc3Br)ccc12 ZINC001211235296 1050526009 /nfs/dbraw/zinc/52/60/09/1050526009.db2.gz JZGWMSKIZWJLQB-UHFFFAOYSA-N 1 2 314.186 4.444 20 0 DIADLO CO[C@@H](c1ccccc1)[C@@H](C)Nc1ccc2c(c1)CCC[N@H+]2C ZINC000786903598 1050526881 /nfs/dbraw/zinc/52/68/81/1050526881.db2.gz YMNJOGFJCLMELP-FOIQADDNSA-N 1 2 310.441 4.257 20 0 DIADLO CO[C@@H](c1ccccc1)[C@@H](C)Nc1ccc2c(c1)CCC[N@@H+]2C ZINC000786903598 1050526893 /nfs/dbraw/zinc/52/68/93/1050526893.db2.gz YMNJOGFJCLMELP-FOIQADDNSA-N 1 2 310.441 4.257 20 0 DIADLO CCSc1nn(C[N@@H+]2CCC[C@@H](CC)CC2)c(=S)s1 ZINC000738256178 1050528594 /nfs/dbraw/zinc/52/85/94/1050528594.db2.gz QOBWDDNYPXWBMH-LLVKDONJSA-N 1 2 317.549 4.256 20 0 DIADLO CCSc1nn(C[N@H+]2CCC[C@@H](CC)CC2)c(=S)s1 ZINC000738256178 1050528608 /nfs/dbraw/zinc/52/86/08/1050528608.db2.gz QOBWDDNYPXWBMH-LLVKDONJSA-N 1 2 317.549 4.256 20 0 DIADLO Cc1ccc([C@H]2[C@H](C)CCC[N@@H+]2Cc2ncc(Cl)n2C)cc1 ZINC000738340210 1050529523 /nfs/dbraw/zinc/52/95/23/1050529523.db2.gz KYURLZIVWMDMDX-RDTXWAMCSA-N 1 2 317.864 4.355 20 0 DIADLO Cc1ccc([C@H]2[C@H](C)CCC[N@H+]2Cc2ncc(Cl)n2C)cc1 ZINC000738340210 1050529533 /nfs/dbraw/zinc/52/95/33/1050529533.db2.gz KYURLZIVWMDMDX-RDTXWAMCSA-N 1 2 317.864 4.355 20 0 DIADLO CCCCC[N@H+](Cc1nonc1C)Cc1ccc(Cl)cc1 ZINC000738317698 1050533852 /nfs/dbraw/zinc/53/38/52/1050533852.db2.gz MIQUVAQLIJUZDC-UHFFFAOYSA-N 1 2 307.825 4.224 20 0 DIADLO CCCCC[N@@H+](Cc1nonc1C)Cc1ccc(Cl)cc1 ZINC000738317698 1050533864 /nfs/dbraw/zinc/53/38/64/1050533864.db2.gz MIQUVAQLIJUZDC-UHFFFAOYSA-N 1 2 307.825 4.224 20 0 DIADLO F[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2Br)C1 ZINC001144308005 1050539175 /nfs/dbraw/zinc/53/91/75/1050539175.db2.gz GHPWBSZPMQPGLW-CYBMUJFWSA-N 1 2 308.194 4.146 20 0 DIADLO F[C@@H]1CC[N@@H+](Cc2ccc3ccccc3c2Br)C1 ZINC001144308005 1050539182 /nfs/dbraw/zinc/53/91/82/1050539182.db2.gz GHPWBSZPMQPGLW-CYBMUJFWSA-N 1 2 308.194 4.146 20 0 DIADLO CCCC(C)(C)CC(=O)Nc1nc(C[NH+](CC)CC)cs1 ZINC000787143305 1050555134 /nfs/dbraw/zinc/55/51/34/1050555134.db2.gz JCRNGXNDKLVGBV-UHFFFAOYSA-N 1 2 311.495 4.140 20 0 DIADLO Cc1ccc2ccccc2c1COC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000845280472 1050559978 /nfs/dbraw/zinc/55/99/78/1050559978.db2.gz CHWULZWPTIUUPK-HNNXBMFYSA-N 1 2 308.381 4.039 20 0 DIADLO C[C@H](CC(=O)O[C@@H](C)c1ccc2ccccc2c1)n1cc[nH+]c1 ZINC000845281521 1050560046 /nfs/dbraw/zinc/56/00/46/1050560046.db2.gz KUXKZFOMTNKMFL-CABCVRRESA-N 1 2 308.381 4.292 20 0 DIADLO C[C@@H](OC(=O)C[C@H](C)n1cc[nH+]c1)c1ccc2ccccc2c1 ZINC000845281524 1050560625 /nfs/dbraw/zinc/56/06/25/1050560625.db2.gz KUXKZFOMTNKMFL-LSDHHAIUSA-N 1 2 308.381 4.292 20 0 DIADLO CCC1CC[NH+](Cc2ccc(Cl)nc2C(F)(F)F)CC1 ZINC000787185204 1050571499 /nfs/dbraw/zinc/57/14/99/1050571499.db2.gz YEFCEZXULCGSIT-UHFFFAOYSA-N 1 2 306.759 4.376 20 0 DIADLO Cc1nc(F)ccc1C[N@@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC000787211105 1050576399 /nfs/dbraw/zinc/57/63/99/1050576399.db2.gz YBPOVSKZSJVLIE-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1nc(F)ccc1C[N@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC000787211105 1050576409 /nfs/dbraw/zinc/57/64/09/1050576409.db2.gz YBPOVSKZSJVLIE-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO CN(c1ccc(Nc2cccc(CO)c2)c[nH+]1)C1CCCCC1 ZINC001212614270 1050582096 /nfs/dbraw/zinc/58/20/96/1050582096.db2.gz KJGCRFJDPPWKTM-UHFFFAOYSA-N 1 2 311.429 4.086 20 0 DIADLO Cc1ccccc1-n1nccc1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213087577 1050582208 /nfs/dbraw/zinc/58/22/08/1050582208.db2.gz UCEOKZNOXOHBMD-UHFFFAOYSA-N 1 2 315.380 4.314 20 0 DIADLO Brc1ncc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)s1 ZINC001213087236 1050583232 /nfs/dbraw/zinc/58/32/32/1050583232.db2.gz MOTGVKHYANMERB-UHFFFAOYSA-N 1 2 321.203 4.039 20 0 DIADLO CO[C@@H]1CCOc2c(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cccc21 ZINC001213090881 1050585179 /nfs/dbraw/zinc/58/51/79/1050585179.db2.gz KXTDAGJCBLZLGX-QGZVFWFLSA-N 1 2 321.380 4.290 20 0 DIADLO COc1ccc(F)c(F)c1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213089887 1050585405 /nfs/dbraw/zinc/58/54/05/1050585405.db2.gz JICUXVHOHWEBSQ-UHFFFAOYSA-N 1 2 301.296 4.107 20 0 DIADLO O=c1[nH]ccc2c(Nc3ccc(-c4[nH]cc[nH+]4)cc3)cccc12 ZINC001213090075 1050586350 /nfs/dbraw/zinc/58/63/50/1050586350.db2.gz SNYZBWOUDOPSCI-UHFFFAOYSA-N 1 2 302.337 4.074 20 0 DIADLO COC(=O)[C@@H](C)c1ccc(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001213090673 1050586521 /nfs/dbraw/zinc/58/65/21/1050586521.db2.gz ALFZKHKVKDFIPC-ZDUSSCGKSA-N 1 2 321.380 4.097 20 0 DIADLO COc1cc(C)c(Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1OC ZINC001213088941 1050586915 /nfs/dbraw/zinc/58/69/15/1050586915.db2.gz LQKVCMSNPFUSQW-UHFFFAOYSA-N 1 2 309.369 4.146 20 0 DIADLO Nc1cc(Cl)cc(F)c1Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC001213091077 1050587189 /nfs/dbraw/zinc/58/71/89/1050587189.db2.gz VNZYCIQZVUEARA-UHFFFAOYSA-N 1 2 302.740 4.195 20 0 DIADLO COc1cc(Cl)cc(C[N@H+](C)Cc2cccc(F)c2F)c1 ZINC001144489804 1050598937 /nfs/dbraw/zinc/59/89/37/1050598937.db2.gz PAQCAMLGRZPVDZ-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+](C)Cc2cccc(F)c2F)c1 ZINC001144489804 1050598949 /nfs/dbraw/zinc/59/89/49/1050598949.db2.gz PAQCAMLGRZPVDZ-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(Cl)cc(C[N@H+](C)Cc2ccc(F)cc2F)c1 ZINC001144489601 1050600358 /nfs/dbraw/zinc/60/03/58/1050600358.db2.gz KNNZHYOYUSNKNG-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1cc(Cl)cc(C[N@@H+](C)Cc2ccc(F)cc2F)c1 ZINC001144489601 1050600366 /nfs/dbraw/zinc/60/03/66/1050600366.db2.gz KNNZHYOYUSNKNG-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO Cc1cc(C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)no1 ZINC000574896223 1050605122 /nfs/dbraw/zinc/60/51/22/1050605122.db2.gz AVIHIKJIGQBZHY-UHFFFAOYSA-N 1 2 312.344 4.204 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cc1cccnc1C(F)(F)F ZINC001144530942 1050608258 /nfs/dbraw/zinc/60/82/58/1050608258.db2.gz ARVYCRQWVVJAGF-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cc1cccnc1C(F)(F)F ZINC001144530942 1050608266 /nfs/dbraw/zinc/60/82/66/1050608266.db2.gz ARVYCRQWVVJAGF-UHFFFAOYSA-N 1 2 312.310 4.262 20 0 DIADLO Cc1ccc(-c2ccsc2C(=O)OCc2cc[nH+]c(N)c2)cc1 ZINC000787588569 1050609143 /nfs/dbraw/zinc/60/91/43/1050609143.db2.gz BGPLRMWNEHQRFN-UHFFFAOYSA-N 1 2 324.405 4.058 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cccnc2C(F)(F)F)cn1 ZINC001144537957 1050611365 /nfs/dbraw/zinc/61/13/65/1050611365.db2.gz CEOYROZLSDLQPQ-HNNXBMFYSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cccnc2C(F)(F)F)cn1 ZINC001144537957 1050611376 /nfs/dbraw/zinc/61/13/76/1050611376.db2.gz CEOYROZLSDLQPQ-HNNXBMFYSA-N 1 2 321.346 4.141 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@H+]1Cc1cccc2cccnc21 ZINC000787648279 1050612150 /nfs/dbraw/zinc/61/21/50/1050612150.db2.gz BFDQPMKALLXCPK-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO C[C@@H]1c2ccc(Cl)n2CC[N@@H+]1Cc1cccc2cccnc21 ZINC000787648279 1050612153 /nfs/dbraw/zinc/61/21/53/1050612153.db2.gz BFDQPMKALLXCPK-CYBMUJFWSA-N 1 2 311.816 4.267 20 0 DIADLO COC(=O)c1ccc(OC)c(Nc2ccc3c(C)cc[nH+]c3c2)c1 ZINC001213248005 1050616314 /nfs/dbraw/zinc/61/63/14/1050616314.db2.gz COXXBUBCICPDAS-UHFFFAOYSA-N 1 2 322.364 4.082 20 0 DIADLO CC[C@@H](Nc1ccc(-n2c[nH+]c(C)c2C)nn1)c1ccccc1C ZINC001171199476 1050619781 /nfs/dbraw/zinc/61/97/81/1050619781.db2.gz CPADKSHZPMBWTK-QGZVFWFLSA-N 1 2 321.428 4.151 20 0 DIADLO CCOc1ccc([C@@H]2CCCN2Cc2[nH+]cn3ccccc23)cc1 ZINC001144624271 1050627879 /nfs/dbraw/zinc/62/78/79/1050627879.db2.gz BXKGYZJTMFTJMQ-IBGZPJMESA-N 1 2 321.424 4.070 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@@H](C)CCCC(C)C)[C@H]2C ZINC001170079458 1050628523 /nfs/dbraw/zinc/62/85/23/1050628523.db2.gz DIIXYTAHGLRMPL-HOTGVXAUSA-N 1 2 307.482 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@@H](C)CCCC(C)C)[C@H]2C ZINC001170079458 1050628534 /nfs/dbraw/zinc/62/85/34/1050628534.db2.gz DIIXYTAHGLRMPL-HOTGVXAUSA-N 1 2 307.482 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@H](C)CCCC(C)C)[C@@H]2C ZINC001170079459 1050629125 /nfs/dbraw/zinc/62/91/25/1050629125.db2.gz DIIXYTAHGLRMPL-HZPDHXFCSA-N 1 2 307.482 4.011 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@H](C)CCCC(C)C)[C@@H]2C ZINC001170079459 1050629129 /nfs/dbraw/zinc/62/91/29/1050629129.db2.gz DIIXYTAHGLRMPL-HZPDHXFCSA-N 1 2 307.482 4.011 20 0 DIADLO Clc1ccc([C@@H]2CCC[N@@H+]2Cc2ncn3ccccc23)cc1 ZINC001144622211 1050632534 /nfs/dbraw/zinc/63/25/34/1050632534.db2.gz GLTFVYCXNJBIOW-KRWDZBQOSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1ccc([C@@H]2CCC[N@H+]2Cc2ncn3ccccc23)cc1 ZINC001144622211 1050632537 /nfs/dbraw/zinc/63/25/37/1050632537.db2.gz GLTFVYCXNJBIOW-KRWDZBQOSA-N 1 2 311.816 4.325 20 0 DIADLO C[C@@H]1C[C@H](C)C[N@H+]1Cn1nc(-c2ccccc2Cl)oc1=S ZINC000740862024 1050634922 /nfs/dbraw/zinc/63/49/22/1050634922.db2.gz VBIGUQQWLNKNMA-WDEREUQCSA-N 1 2 323.849 4.214 20 0 DIADLO C[C@@H]1C[C@H](C)C[N@@H+]1Cn1nc(-c2ccccc2Cl)oc1=S ZINC000740862024 1050634933 /nfs/dbraw/zinc/63/49/33/1050634933.db2.gz VBIGUQQWLNKNMA-WDEREUQCSA-N 1 2 323.849 4.214 20 0 DIADLO CCn1c(C[NH2+]Cc2ccc(C)cc2Cl)nc2ccccc21 ZINC000845954306 1050635574 /nfs/dbraw/zinc/63/55/74/1050635574.db2.gz NRUVMHRWCVHZFB-UHFFFAOYSA-N 1 2 313.832 4.308 20 0 DIADLO C[N@H+](Cc1noc2c1CCCC2)Cc1ccc(C(C)(C)C)cc1 ZINC000595544593 1050642002 /nfs/dbraw/zinc/64/20/02/1050642002.db2.gz VXPFYBYKYHVBLN-UHFFFAOYSA-N 1 2 312.457 4.483 20 0 DIADLO C[N@@H+](Cc1noc2c1CCCC2)Cc1ccc(C(C)(C)C)cc1 ZINC000595544593 1050642009 /nfs/dbraw/zinc/64/20/09/1050642009.db2.gz VXPFYBYKYHVBLN-UHFFFAOYSA-N 1 2 312.457 4.483 20 0 DIADLO Oc1c(F)cc(Nc2cc[nH+]c3ccc(Cl)cc23)cc1F ZINC001213373314 1050642990 /nfs/dbraw/zinc/64/29/90/1050642990.db2.gz CEOWXUXRCSRRBP-UHFFFAOYSA-N 1 2 306.699 4.038 20 0 DIADLO CCCOC(=O)[C@H](c1cccc(C(F)(F)F)c1)[NH+](CC)CC ZINC000741027311 1050647774 /nfs/dbraw/zinc/64/77/74/1050647774.db2.gz XJKZTEBJKQOKST-AWEZNQCLSA-N 1 2 317.351 4.042 20 0 DIADLO Cc1cn2cccc(Nc3cc(F)c(OC(C)C)c(F)c3)c2[nH+]1 ZINC001213417322 1050651102 /nfs/dbraw/zinc/65/11/02/1050651102.db2.gz JPQUCZFGRRTFJN-UHFFFAOYSA-N 1 2 317.339 4.452 20 0 DIADLO CC(C)(C)CCCCCC(=O)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC001144683538 1050655865 /nfs/dbraw/zinc/65/58/65/1050655865.db2.gz NMDXWXMGHOPXRT-OAHLLOKOSA-N 1 2 305.466 4.112 20 0 DIADLO CC(C)(C)CCCCCC(=O)NCc1c[nH+]cn1C1CCC1 ZINC001144685469 1050657300 /nfs/dbraw/zinc/65/73/00/1050657300.db2.gz FBKRJUSXJQHTHY-UHFFFAOYSA-N 1 2 305.466 4.221 20 0 DIADLO C[C@H]1C[N@H+](Cc2c(Cl)ccc(Cl)c2Cl)CC[C@]1(C)O ZINC001231480743 1050665019 /nfs/dbraw/zinc/66/50/19/1050665019.db2.gz XEKJQTIXNQEXTP-XPTSAGLGSA-N 1 2 322.663 4.240 20 0 DIADLO C[C@H]1C[N@@H+](Cc2c(Cl)ccc(Cl)c2Cl)CC[C@]1(C)O ZINC001231480743 1050665025 /nfs/dbraw/zinc/66/50/25/1050665025.db2.gz XEKJQTIXNQEXTP-XPTSAGLGSA-N 1 2 322.663 4.240 20 0 DIADLO c1oc(C2CC2)nc1C[N@@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC000846117118 1050666472 /nfs/dbraw/zinc/66/64/72/1050666472.db2.gz KUYSMWKWHUYBNP-FHWLQOOXSA-N 1 2 324.424 4.047 20 0 DIADLO c1oc(C2CC2)nc1C[N@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC000846117118 1050666478 /nfs/dbraw/zinc/66/64/78/1050666478.db2.gz KUYSMWKWHUYBNP-FHWLQOOXSA-N 1 2 324.424 4.047 20 0 DIADLO FC(F)(F)c1ccc(Cl)c(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)c1 ZINC000846111920 1050666564 /nfs/dbraw/zinc/66/65/64/1050666564.db2.gz OLUBPJMEMOWBLM-AOOOYVTPSA-N 1 2 311.681 4.056 20 0 DIADLO FC(F)(F)c1ccc(Cl)c(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)c1 ZINC000846111920 1050666568 /nfs/dbraw/zinc/66/65/68/1050666568.db2.gz OLUBPJMEMOWBLM-AOOOYVTPSA-N 1 2 311.681 4.056 20 0 DIADLO Cc1cc(Nc2cc(C3CC3)c[nH+]c2C)cnc1Br ZINC001213492168 1050669873 /nfs/dbraw/zinc/66/98/73/1050669873.db2.gz YIEHLDIJDQIYEE-UHFFFAOYSA-N 1 2 318.218 4.477 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cc(-c2ccccc2)nn1C ZINC001213492112 1050670524 /nfs/dbraw/zinc/67/05/24/1050670524.db2.gz VHNGDQXRJJISOE-UHFFFAOYSA-N 1 2 304.397 4.412 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cncc(N2CCCCC2)c1 ZINC001213497079 1050671635 /nfs/dbraw/zinc/67/16/35/1050671635.db2.gz HIFRKTATORKPAQ-UHFFFAOYSA-N 1 2 308.429 4.396 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccnn1-c1cccc(F)c1 ZINC001213497322 1050671655 /nfs/dbraw/zinc/67/16/55/1050671655.db2.gz NXBRDEDDMDQYIM-UHFFFAOYSA-N 1 2 308.360 4.336 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1ccc(C(=O)N2CCCC2)cc1 ZINC001213497060 1050671768 /nfs/dbraw/zinc/67/17/68/1050671768.db2.gz GLPGSKCDUZTGSJ-UHFFFAOYSA-N 1 2 321.424 4.247 20 0 DIADLO Cc1[nH+]cc(C2CC2)cc1Nc1cccnc1-c1ccccn1 ZINC001213496853 1050671841 /nfs/dbraw/zinc/67/18/41/1050671841.db2.gz AJNPKIYXKWUXMN-UHFFFAOYSA-N 1 2 302.381 4.468 20 0 DIADLO COCCOc1ccc(F)cc1Nc1cc(C2CC2)c[nH+]c1C ZINC001213499687 1050672225 /nfs/dbraw/zinc/67/22/25/1050672225.db2.gz WBUKNXWWEWHHKO-UHFFFAOYSA-N 1 2 316.376 4.175 20 0 DIADLO COc1cccc(-n2nccc2Nc2cc(C3CC3)c[nH+]c2C)c1 ZINC001213497112 1050672602 /nfs/dbraw/zinc/67/26/02/1050672602.db2.gz JDRCIXATFYCWQU-UHFFFAOYSA-N 1 2 320.396 4.205 20 0 DIADLO COCCCOc1ccc(Nc2cc(C3CC3)c[nH+]c2C)cc1 ZINC001213499675 1050672673 /nfs/dbraw/zinc/67/26/73/1050672673.db2.gz VQOAOVKVHQWFGH-UHFFFAOYSA-N 1 2 312.413 4.426 20 0 DIADLO COC(=O)c1ccc(Nc2cc(C3CC3)c[nH+]c2C)c(F)c1F ZINC001213503430 1050673781 /nfs/dbraw/zinc/67/37/81/1050673781.db2.gz FNWGLAXRSIVHLX-UHFFFAOYSA-N 1 2 318.323 4.076 20 0 DIADLO COc1cc(C(C)=O)c(Nc2cc(C3CC3)c[nH+]c2C)cc1F ZINC001213503513 1050674969 /nfs/dbraw/zinc/67/49/69/1050674969.db2.gz KEWAQZQEJNTIBU-UHFFFAOYSA-N 1 2 314.360 4.361 20 0 DIADLO COCCOc1cccc(F)c1Nc1cc(C2CC2)c[nH+]c1C ZINC001213503717 1050675042 /nfs/dbraw/zinc/67/50/42/1050675042.db2.gz ULDACJKHZRYCON-UHFFFAOYSA-N 1 2 316.376 4.175 20 0 DIADLO CNc1cccc(Br)c1Nc1c[nH+]c(C)cc1C ZINC001213515711 1050676244 /nfs/dbraw/zinc/67/62/44/1050676244.db2.gz GJCMFSXFYDRCBF-UHFFFAOYSA-N 1 2 306.207 4.246 20 0 DIADLO Cc1cc(C)c(Nc2ccc(N3CCSCC3)c(F)c2)c[nH+]1 ZINC001213518431 1050676876 /nfs/dbraw/zinc/67/68/76/1050676876.db2.gz NWIBMPPXMOAMCC-UHFFFAOYSA-N 1 2 317.433 4.134 20 0 DIADLO Cc1cc(C)c(Nc2ccc(C(=O)c3ccncc3)cc2)c[nH+]1 ZINC001213518551 1050677154 /nfs/dbraw/zinc/67/71/54/1050677154.db2.gz UUOVYXHMNDFBEC-UHFFFAOYSA-N 1 2 303.365 4.068 20 0 DIADLO Cc1cc(C)c(Nc2ccc(OC[C@@H]3CCCO3)c(F)c2)c[nH+]1 ZINC001213513297 1050677650 /nfs/dbraw/zinc/67/76/50/1050677650.db2.gz AEYNOGOWXYKFKJ-HNNXBMFYSA-N 1 2 316.376 4.139 20 0 DIADLO Cc1cc(C)c(Nc2ccc3nc(-c4ccccc4)nn3c2)c[nH+]1 ZINC001213510427 1050677691 /nfs/dbraw/zinc/67/76/91/1050677691.db2.gz CAWHGAOQEPRRKM-UHFFFAOYSA-N 1 2 315.380 4.152 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc3nnc(-c4ccccc4)n3c2)c1C ZINC001213527325 1050678933 /nfs/dbraw/zinc/67/89/33/1050678933.db2.gz GBYBUMOGCWDGCY-UHFFFAOYSA-N 1 2 315.380 4.152 20 0 DIADLO Cc1cc(C)c(Nc2ccc(C(=O)OC(C)(C)C)cc2O)c[nH+]1 ZINC001213520874 1050679587 /nfs/dbraw/zinc/67/95/87/1050679587.db2.gz KLXYDMKWGBEUQA-UHFFFAOYSA-N 1 2 314.385 4.103 20 0 DIADLO Cc1ncc([C@@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)s1 ZINC000179917843 1050679475 /nfs/dbraw/zinc/67/94/75/1050679475.db2.gz PTGUCVRZIWLVBD-GFCCVEGCSA-N 1 2 302.447 4.010 20 0 DIADLO Cc1cc(C)c(Nc2cccc(C)c2N2CCCCC2=O)c[nH+]1 ZINC001213520699 1050679714 /nfs/dbraw/zinc/67/97/14/1050679714.db2.gz GAVFUZVYTUKQQN-UHFFFAOYSA-N 1 2 309.413 4.267 20 0 DIADLO Cc1c[nH+]cc(Nc2noc3cc(Br)ccc23)c1C ZINC001213523107 1050680018 /nfs/dbraw/zinc/68/00/18/1050680018.db2.gz LLXZTABOWMHOAZ-UHFFFAOYSA-N 1 2 318.174 4.346 20 0 DIADLO COc1cc(Nc2c[nH+]cc(C)c2C)ccc1Br ZINC001213530658 1050681440 /nfs/dbraw/zinc/68/14/40/1050681440.db2.gz JSTBZTGUYDOZFO-UHFFFAOYSA-N 1 2 307.191 4.213 20 0 DIADLO Cc1cccc(Nc2c[nH+]cc(C)c2C)c1N1CCCCC1=O ZINC001213534247 1050681766 /nfs/dbraw/zinc/68/17/66/1050681766.db2.gz UCCCASFOFGDTNF-UHFFFAOYSA-N 1 2 309.413 4.267 20 0 DIADLO CC(=O)c1cc(Nc2c[nH+]cc(C)c2C)ccc1Br ZINC001213534207 1050681963 /nfs/dbraw/zinc/68/19/63/1050681963.db2.gz RJCPBTLABFLLJR-UHFFFAOYSA-N 1 2 319.202 4.407 20 0 DIADLO Cc1c[nH+]cc(Nc2ccc3c(c2)C(C)(C)CC(=O)N3C)c1C ZINC001213536198 1050682288 /nfs/dbraw/zinc/68/22/88/1050682288.db2.gz AZSWTWPJWITNSD-UHFFFAOYSA-N 1 2 309.413 4.086 20 0 DIADLO Cc1c[nH+]cc(Nc2cc(Br)cc(F)c2O)c1C ZINC001213533921 1050682591 /nfs/dbraw/zinc/68/25/91/1050682591.db2.gz CIJWYEXEKCQGII-UHFFFAOYSA-N 1 2 311.154 4.049 20 0 DIADLO CC1(C)C[N@H+](Cc2cc(F)c(F)cc2Cl)CCC1(F)F ZINC001144721862 1050684045 /nfs/dbraw/zinc/68/40/45/1050684045.db2.gz GLSPZKMZSKJHPC-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO CC1(C)C[N@@H+](Cc2cc(F)c(F)cc2Cl)CCC1(F)F ZINC001144721862 1050684051 /nfs/dbraw/zinc/68/40/51/1050684051.db2.gz GLSPZKMZSKJHPC-UHFFFAOYSA-N 1 2 309.734 4.485 20 0 DIADLO C[N@H+](Cc1cnc(Cl)s1)Cc1ccc2scnc2c1 ZINC001144732364 1050685302 /nfs/dbraw/zinc/68/53/02/1050685302.db2.gz BYJXLTCIGUWFDL-UHFFFAOYSA-N 1 2 309.847 4.038 20 0 DIADLO C[N@@H+](Cc1cnc(Cl)s1)Cc1ccc2scnc2c1 ZINC001144732364 1050685312 /nfs/dbraw/zinc/68/53/12/1050685312.db2.gz BYJXLTCIGUWFDL-UHFFFAOYSA-N 1 2 309.847 4.038 20 0 DIADLO Fc1cc(Cl)c(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)cc1F ZINC001144723334 1050686068 /nfs/dbraw/zinc/68/60/68/1050686068.db2.gz JQHCKYYQYNMPOH-AOOOYVTPSA-N 1 2 307.718 4.095 20 0 DIADLO Fc1cc(Cl)c(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)cc1F ZINC001144723334 1050686075 /nfs/dbraw/zinc/68/60/75/1050686075.db2.gz JQHCKYYQYNMPOH-AOOOYVTPSA-N 1 2 307.718 4.095 20 0 DIADLO c1ccc(N2CCCC2)c(Nc2[nH+]cccc2N2CCCCC2)c1 ZINC001213605923 1050693429 /nfs/dbraw/zinc/69/34/29/1050693429.db2.gz WODIWDGKHDVPTE-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO CC/C(=C/C(=O)Nc1ccc2[nH+]ccn2c1)c1ccc(C)cc1 ZINC000741563899 1050704917 /nfs/dbraw/zinc/70/49/17/1050704917.db2.gz WKIMQNPCYTVSFA-QINSGFPZSA-N 1 2 305.381 4.075 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cc(F)cc(F)c2F)cc1F ZINC001241099753 1050709194 /nfs/dbraw/zinc/70/91/94/1050709194.db2.gz BMRCSHOADONVKN-UHFFFAOYSA-N 1 2 301.258 4.111 20 0 DIADLO CC(C)(C)c1csc(C[NH2+][C@H]2CCc3ccc(Cl)nc32)n1 ZINC000788595746 1050711851 /nfs/dbraw/zinc/71/18/51/1050711851.db2.gz VPVILLZOTZSDCK-NSHDSACASA-N 1 2 321.877 4.266 20 0 DIADLO Cc1[nH]ncc1[C@@H](C)[NH2+][C@@H](Cc1ccccc1)c1ccccc1 ZINC000180001961 1050712161 /nfs/dbraw/zinc/71/21/61/1050712161.db2.gz UMBIJTGCPPLEGY-QRWLVFNGSA-N 1 2 305.425 4.353 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H](C)c3ccco3)c2)[nH+]c1C ZINC000741670408 1050722700 /nfs/dbraw/zinc/72/27/00/1050722700.db2.gz ALWIDTMENIYWOZ-NSHDSACASA-N 1 2 309.369 4.029 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)C2CCCCCCC2)n1 ZINC000741675430 1050727126 /nfs/dbraw/zinc/72/71/26/1050727126.db2.gz LAQMTJISHWRAQO-UHFFFAOYSA-N 1 2 323.506 4.284 20 0 DIADLO Cc1csc(C2([NH2+][C@H]3CCc4ccc(Cl)nc43)CCC2)n1 ZINC000788705252 1050731101 /nfs/dbraw/zinc/73/11/01/1050731101.db2.gz PVTZDPQHYBIJKM-LBPRGKRZSA-N 1 2 319.861 4.156 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1ncc(-c3ccccc3F)o1)C2 ZINC000741785714 1050741593 /nfs/dbraw/zinc/74/15/93/1050741593.db2.gz WTXJNIKBIXHKMK-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1ncc(-c3ccccc3F)o1)C2 ZINC000741785714 1050741605 /nfs/dbraw/zinc/74/16/05/1050741605.db2.gz WTXJNIKBIXHKMK-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO CC1=CC[C@H]([NH2+]c2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2)CC1 ZINC000788734633 1050742034 /nfs/dbraw/zinc/74/20/34/1050742034.db2.gz HMYPLFTUPVVZNL-BBWFWOEESA-N 1 2 300.446 4.211 20 0 DIADLO CC1=CC[C@H]([NH2+]c2ccc(N3C[C@@H](C)O[C@H](C)C3)cc2)CC1 ZINC000788734636 1050742497 /nfs/dbraw/zinc/74/24/97/1050742497.db2.gz HMYPLFTUPVVZNL-ZACQAIPSSA-N 1 2 300.446 4.211 20 0 DIADLO Fc1cc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)cnc1Cl ZINC000846809052 1050761553 /nfs/dbraw/zinc/76/15/53/1050761553.db2.gz PIIHHBGSXFUTPU-OAHLLOKOSA-N 1 2 322.836 4.164 20 0 DIADLO Fc1cc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)cnc1Cl ZINC000846809052 1050761554 /nfs/dbraw/zinc/76/15/54/1050761554.db2.gz PIIHHBGSXFUTPU-OAHLLOKOSA-N 1 2 322.836 4.164 20 0 DIADLO Cn1c[nH+]c2cc(Nc3ccc(N4CCCC4)cc3F)ccc21 ZINC001213851347 1050765503 /nfs/dbraw/zinc/76/55/03/1050765503.db2.gz HDFHTTWYSQFCFG-UHFFFAOYSA-N 1 2 310.376 4.056 20 0 DIADLO c1nsnc1C[NH2+][C@@H](CC1CCCCC1)c1ccccc1 ZINC000846845606 1050769433 /nfs/dbraw/zinc/76/94/33/1050769433.db2.gz ZHZJQYHHZBKWQE-KRWDZBQOSA-N 1 2 301.459 4.339 20 0 DIADLO Cc1cc(N[C@@H]2CCCC[C@@H]2[C@H]2CCOC2)ccc1[NH+](C)C ZINC000788982905 1050770467 /nfs/dbraw/zinc/77/04/67/1050770467.db2.gz GESIKSXPSKYJNS-CGTJXYLNSA-N 1 2 302.462 4.068 20 0 DIADLO CCCCCC[C@@H](C)C(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000742056362 1050797189 /nfs/dbraw/zinc/79/71/89/1050797189.db2.gz SYRANTHGIUYJNH-CVEARBPZSA-N 1 2 307.482 4.021 20 0 DIADLO C/C(=C/C(=O)Nc1ccccc1-n1cc[nH+]c1)c1ccc(F)cc1 ZINC000742282827 1050816451 /nfs/dbraw/zinc/81/64/51/1050816451.db2.gz HHJWZHAPAIKIRM-OWBHPGMISA-N 1 2 321.355 4.053 20 0 DIADLO CCCC[C@H]([NH2+][C@@H](C)c1cn[nH]c1C)c1ccc(OC)cc1 ZINC000180424624 1050834408 /nfs/dbraw/zinc/83/44/08/1050834408.db2.gz HJEGYCKPCVICIT-UGSOOPFHSA-N 1 2 301.434 4.309 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cc(C)ccc2OCOC)cc1 ZINC001214249459 1050855138 /nfs/dbraw/zinc/85/51/38/1050855138.db2.gz KTKHKDLCKZYBLF-UHFFFAOYSA-N 1 2 300.402 4.177 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cc(C)ccc2OCOC)cc1 ZINC001214249459 1050855148 /nfs/dbraw/zinc/85/51/48/1050855148.db2.gz KTKHKDLCKZYBLF-UHFFFAOYSA-N 1 2 300.402 4.177 20 0 DIADLO CCOc1cc(Nc2cccc(Cn3cc[nH+]c3)c2)ccc1C ZINC001214325752 1050871001 /nfs/dbraw/zinc/87/10/01/1050871001.db2.gz QEVOPWDASKDBQQ-UHFFFAOYSA-N 1 2 307.397 4.382 20 0 DIADLO CCc1ccc(C)[nH+]c1Nc1cc(OC(F)(F)F)ccc1O ZINC001214373350 1050885806 /nfs/dbraw/zinc/88/58/06/1050885806.db2.gz QSWGTBNRHYBKJF-UHFFFAOYSA-N 1 2 312.291 4.300 20 0 DIADLO CCCc1ccc(-c2ccc(NC(=O)[C@@H]3CC[N@@H+]3CC)cc2)cc1 ZINC001147593400 1050893784 /nfs/dbraw/zinc/89/37/84/1050893784.db2.gz GIPRZHNXACPYMN-FQEVSTJZSA-N 1 2 322.452 4.339 20 0 DIADLO CCCc1ccc(-c2ccc(NC(=O)[C@@H]3CC[N@H+]3CC)cc2)cc1 ZINC001147593400 1050893798 /nfs/dbraw/zinc/89/37/98/1050893798.db2.gz GIPRZHNXACPYMN-FQEVSTJZSA-N 1 2 322.452 4.339 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+]C[C@@H]2CCc3ccccc32)cc1 ZINC000790051593 1050909760 /nfs/dbraw/zinc/90/97/60/1050909760.db2.gz BBABJFKTFVUUAV-AEFFLSMTSA-N 1 2 322.452 4.054 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3ccc(Cl)o3)c2)[nH+]c1C ZINC000746884296 1050920440 /nfs/dbraw/zinc/92/04/40/1050920440.db2.gz LSGAAXOJCJCVGN-UHFFFAOYSA-N 1 2 315.760 4.192 20 0 DIADLO CCCCCC[C@@H](CC)C(=O)N1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000790154709 1050920615 /nfs/dbraw/zinc/92/06/15/1050920615.db2.gz JRAOOSZRPWFOQJ-SJLPKXTDSA-N 1 2 318.461 4.058 20 0 DIADLO COc1c(C)ccc(F)c1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001214530177 1050933034 /nfs/dbraw/zinc/93/30/34/1050933034.db2.gz TWKGVVKKZCELBF-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO CCCc1cc[nH+]c(Nc2ccc(CO)c(C(F)(F)F)c2)c1 ZINC001214681241 1050978412 /nfs/dbraw/zinc/97/84/12/1050978412.db2.gz HVDDUEURANADMQ-UHFFFAOYSA-N 1 2 310.319 4.289 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2ccc(CO)c(C(F)(F)F)c2)cc1 ZINC001214689451 1050981795 /nfs/dbraw/zinc/98/17/95/1050981795.db2.gz MYVMGOMFHFTYNH-UHFFFAOYSA-N 1 2 324.346 4.397 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2ccc(CO)c(C(F)(F)F)c2)cc1 ZINC001214689451 1050981805 /nfs/dbraw/zinc/98/18/05/1050981805.db2.gz MYVMGOMFHFTYNH-UHFFFAOYSA-N 1 2 324.346 4.397 20 0 DIADLO CCCCCC[C@@H](C)C(=O)NCc1ccccc1-n1cc[nH+]c1 ZINC000743319539 1051012920 /nfs/dbraw/zinc/01/29/20/1051012920.db2.gz HTWOVRNDYYVMJL-MRXNPFEDSA-N 1 2 313.445 4.095 20 0 DIADLO CCC[NH+](CCC)Cn1nc(CCc2ccccc2)oc1=S ZINC000743352868 1051014134 /nfs/dbraw/zinc/01/41/34/1051014134.db2.gz RSQZOOOZRYXJBG-UHFFFAOYSA-N 1 2 319.474 4.070 20 0 DIADLO S=c1[nH]ccn1C[N@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC000743359055 1051016593 /nfs/dbraw/zinc/01/65/93/1051016593.db2.gz YUBCHSUERWLMJA-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO S=c1[nH]ccn1C[N@@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC000743359055 1051016602 /nfs/dbraw/zinc/01/66/02/1051016602.db2.gz YUBCHSUERWLMJA-UHFFFAOYSA-N 1 2 321.449 4.072 20 0 DIADLO CCNC(=O)c1ccc(Nc2c(C)cc[nH+]c2C(C)C)c(F)c1 ZINC001214892908 1051019960 /nfs/dbraw/zinc/01/99/60/1051019960.db2.gz TXMAVGCVADNAKV-UHFFFAOYSA-N 1 2 315.392 4.146 20 0 DIADLO CSc1cc(NCc2cccc3sccc32)nc(C)[nH+]1 ZINC001171378259 1051051335 /nfs/dbraw/zinc/05/13/35/1051051335.db2.gz ZWVBGFTZNGRRFA-UHFFFAOYSA-N 1 2 301.440 4.334 20 0 DIADLO CC(C)Oc1ccc(F)c(F)c1Nc1cccc2[nH+]ccn21 ZINC001215071751 1051067514 /nfs/dbraw/zinc/06/75/14/1051067514.db2.gz CEXOLNGJLFGCCE-UHFFFAOYSA-N 1 2 303.312 4.143 20 0 DIADLO COC(=O)c1cc(Nc2c(C)cc[nH+]c2C(C)C)ccc1OC ZINC001215086421 1051073175 /nfs/dbraw/zinc/07/31/75/1051073175.db2.gz JTUHKDNHSQUSMN-UHFFFAOYSA-N 1 2 314.385 4.052 20 0 DIADLO Cc1cc[nH+]c(C(C)C)c1Nc1cccc(C(=O)N(C)C)c1F ZINC001215145648 1051088000 /nfs/dbraw/zinc/08/80/00/1051088000.db2.gz ZLHOXVVPDCPRRU-UHFFFAOYSA-N 1 2 315.392 4.098 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cn2ccc(C(F)(F)F)n2)cc1 ZINC000744129397 1051116357 /nfs/dbraw/zinc/11/63/57/1051116357.db2.gz RYQDQUKGPLGGQD-AWEZNQCLSA-N 1 2 309.335 4.005 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cn2ccc(C(F)(F)F)n2)cc1 ZINC000744129397 1051116363 /nfs/dbraw/zinc/11/63/63/1051116363.db2.gz RYQDQUKGPLGGQD-AWEZNQCLSA-N 1 2 309.335 4.005 20 0 DIADLO c1ccc(C2(CNc3cccc(Cc4ccncc4)[nH+]3)CC2)cc1 ZINC001171462149 1051141657 /nfs/dbraw/zinc/14/16/57/1051141657.db2.gz VGFDHXDCCBFPLM-UHFFFAOYSA-N 1 2 315.420 4.211 20 0 DIADLO Cc1cc(F)ccc1C[NH2+][C@@H](Cc1ccccc1)c1ncco1 ZINC001171567311 1051170633 /nfs/dbraw/zinc/17/06/33/1051170633.db2.gz IXWPUCWECUHMAW-SFHVURJKSA-N 1 2 310.372 4.196 20 0 DIADLO CC[C@H]1C[C@@H](C)C[N@@H+]1Cn1nc(-c2sccc2C)oc1=S ZINC000744439657 1051177416 /nfs/dbraw/zinc/17/74/16/1051177416.db2.gz BPHBUOIHAAMAEC-PWSUYJOCSA-N 1 2 323.487 4.320 20 0 DIADLO CC[C@H]1C[C@@H](C)C[N@H+]1Cn1nc(-c2sccc2C)oc1=S ZINC000744439657 1051177426 /nfs/dbraw/zinc/17/74/26/1051177426.db2.gz BPHBUOIHAAMAEC-PWSUYJOCSA-N 1 2 323.487 4.320 20 0 DIADLO CC[C@H]([NH2+][C@H](C)CCc1ccc(C)cc1)C(=O)OC(C)(C)C ZINC001171664367 1051187690 /nfs/dbraw/zinc/18/76/90/1051187690.db2.gz YGYFKPBSGNAWPV-WBVHZDCISA-N 1 2 305.462 4.026 20 0 DIADLO Cc1cc(NC2CC(C)(C)OC(C)(C)C2)cc(OC(F)F)[nH+]1 ZINC001170362888 1051191343 /nfs/dbraw/zinc/19/13/43/1051191343.db2.gz NSRLAKGCBZGMDV-UHFFFAOYSA-N 1 2 314.376 4.140 20 0 DIADLO Fc1ccc([C@H]2COCC[N@@H+]2C[C@H]2CCCCC2(F)F)cc1 ZINC001170342460 1051192583 /nfs/dbraw/zinc/19/25/83/1051192583.db2.gz NUVZFAOPWGYGPO-GDBMZVCRSA-N 1 2 313.363 4.025 20 0 DIADLO Fc1ccc([C@H]2COCC[N@H+]2C[C@H]2CCCCC2(F)F)cc1 ZINC001170342460 1051192591 /nfs/dbraw/zinc/19/25/91/1051192591.db2.gz NUVZFAOPWGYGPO-GDBMZVCRSA-N 1 2 313.363 4.025 20 0 DIADLO CCOc1c(F)c(F)ccc1Nc1cccc2[nH+]c(C)cn21 ZINC001215409385 1051193084 /nfs/dbraw/zinc/19/30/84/1051193084.db2.gz YOIMJDGHIBRHEN-UHFFFAOYSA-N 1 2 303.312 4.063 20 0 DIADLO CCC[C@@H]([NH2+]Cc1noc2c1CCCC2)c1ccc(F)cc1F ZINC000181669226 1051195702 /nfs/dbraw/zinc/19/57/02/1051195702.db2.gz XHEKLKINHZHXNM-MRXNPFEDSA-N 1 2 320.383 4.463 20 0 DIADLO COc1ccc2c(c1)C[C@H](Nc1ccc([NH+](C)C)c(C)c1)CC2 ZINC001170411650 1051203509 /nfs/dbraw/zinc/20/35/09/1051203509.db2.gz ANOXFWBDRUUTAB-GOSISDBHSA-N 1 2 310.441 4.039 20 0 DIADLO C[C@@H]([NH2+]Cc1coc(-c2cccc(Cl)c2)n1)c1ccccn1 ZINC000181780361 1051207283 /nfs/dbraw/zinc/20/72/83/1051207283.db2.gz LPKFSLDFMAYOCA-GFCCVEGCSA-N 1 2 313.788 4.241 20 0 DIADLO CC[N@H+](C)[C@H](C(=O)O[C@@H](C)c1cccc(F)c1)c1ccccc1 ZINC000745097962 1051221319 /nfs/dbraw/zinc/22/13/19/1051221319.db2.gz OKAVJYOHOHTDAL-KSSFIOAISA-N 1 2 315.388 4.123 20 0 DIADLO CC[N@@H+](C)[C@H](C(=O)O[C@@H](C)c1cccc(F)c1)c1ccccc1 ZINC000745097962 1051221330 /nfs/dbraw/zinc/22/13/30/1051221330.db2.gz OKAVJYOHOHTDAL-KSSFIOAISA-N 1 2 315.388 4.123 20 0 DIADLO C[C@@H](OC(=O)[C@H]1CCCC[N@@H+]1C)c1ccc(Cl)cc1Cl ZINC000745079693 1051222745 /nfs/dbraw/zinc/22/27/45/1051222745.db2.gz MOETZSPCGQSHQK-QMTHXVAHSA-N 1 2 316.228 4.082 20 0 DIADLO C[C@@H](OC(=O)[C@H]1CCCC[N@H+]1C)c1ccc(Cl)cc1Cl ZINC000745079693 1051222755 /nfs/dbraw/zinc/22/27/55/1051222755.db2.gz MOETZSPCGQSHQK-QMTHXVAHSA-N 1 2 316.228 4.082 20 0 DIADLO Cc1cc(O)cc(Nc2cc[nH+]c(NC(=O)OC(C)(C)C)c2)c1 ZINC001215504624 1051224035 /nfs/dbraw/zinc/22/40/35/1051224035.db2.gz AJPCEKUXLZPMFP-UHFFFAOYSA-N 1 2 315.373 4.186 20 0 DIADLO C[C@@H]1COCCC[N@@H+]1Cn1c(-c2ccccc2)csc1=S ZINC000772822730 1051226978 /nfs/dbraw/zinc/22/69/78/1051226978.db2.gz QLTUDPVGUSTVMQ-CYBMUJFWSA-N 1 2 320.483 4.014 20 0 DIADLO C[C@@H]1COCCC[N@H+]1Cn1c(-c2ccccc2)csc1=S ZINC000772822730 1051226983 /nfs/dbraw/zinc/22/69/83/1051226983.db2.gz QLTUDPVGUSTVMQ-CYBMUJFWSA-N 1 2 320.483 4.014 20 0 DIADLO Cc1cc(F)ccc1-c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001215516079 1051227786 /nfs/dbraw/zinc/22/77/86/1051227786.db2.gz PAICAOBWJCUUOC-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(Nc2ccccc2)n1)c1ccccn1 ZINC000182193974 1051235392 /nfs/dbraw/zinc/23/53/92/1051235392.db2.gz YZVILAGSUOYRFD-CYBMUJFWSA-N 1 2 310.426 4.133 20 0 DIADLO Cc1cccc(Nc2ccc3cnn([C@H]4CCCCO4)c3c2)[nH+]1 ZINC001215560072 1051243601 /nfs/dbraw/zinc/24/36/01/1051243601.db2.gz ZLXHTPGSXXWUIG-GOSISDBHSA-N 1 2 308.385 4.182 20 0 DIADLO Cc1cc[nH+]c(Nc2ccc3cnn([C@H]4CCCCO4)c3c2)c1 ZINC001215559939 1051244227 /nfs/dbraw/zinc/24/42/27/1051244227.db2.gz XTLPRBXRZGJTQS-GOSISDBHSA-N 1 2 308.385 4.182 20 0 DIADLO Cc1c(Cl)c(C[NH2+][C@H](C)c2ccccn2)nc2ccccc12 ZINC000182645065 1051259448 /nfs/dbraw/zinc/25/94/48/1051259448.db2.gz HJOCWYSUHXKUOE-CYBMUJFWSA-N 1 2 311.816 4.442 20 0 DIADLO COCc1ccc(Cl)c(Nc2ccc[nH+]c2N2CCCC2)c1 ZINC001215596060 1051263596 /nfs/dbraw/zinc/26/35/96/1051263596.db2.gz YEPYPNYYCNQKPI-UHFFFAOYSA-N 1 2 317.820 4.225 20 0 DIADLO COc1c(F)c(C)ccc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001215601387 1051268405 /nfs/dbraw/zinc/26/84/05/1051268405.db2.gz OKQPIMUFGKPUTB-UHFFFAOYSA-N 1 2 305.740 4.187 20 0 DIADLO Cn1c[nH+]cc1CCOC(=O)C1(C2CCCCC2)CCCCC1 ZINC000793239766 1051270055 /nfs/dbraw/zinc/27/00/55/1051270055.db2.gz UIJOCOQUNUIIST-UHFFFAOYSA-N 1 2 318.461 4.037 20 0 DIADLO Cn1c2ccc(Cl)cc2[nH+]c1NCc1ccc(F)c(F)c1 ZINC001204079899 1051272437 /nfs/dbraw/zinc/27/24/37/1051272437.db2.gz UDASUNWHAPOXHW-UHFFFAOYSA-N 1 2 307.731 4.117 20 0 DIADLO CC[N@H+](C)c1ccc(Nc2cc(C(F)(F)F)ccc2CO)cc1 ZINC001215686666 1051301882 /nfs/dbraw/zinc/30/18/82/1051301882.db2.gz DZEBOFRLVMEIIS-UHFFFAOYSA-N 1 2 324.346 4.397 20 0 DIADLO CC[N@@H+](C)c1ccc(Nc2cc(C(F)(F)F)ccc2CO)cc1 ZINC001215686666 1051301891 /nfs/dbraw/zinc/30/18/91/1051301891.db2.gz DZEBOFRLVMEIIS-UHFFFAOYSA-N 1 2 324.346 4.397 20 0 DIADLO COc1cc[nH+]cc1Nc1c(F)cc(F)c(OC(C)C)c1F ZINC001212643098 1051311083 /nfs/dbraw/zinc/31/10/83/1051311083.db2.gz PUFBEPORCZSRNN-UHFFFAOYSA-N 1 2 312.291 4.038 20 0 DIADLO CC(C)Oc1c(F)cc(F)c(Nc2ccn3cc[nH+]c3c2)c1F ZINC001212645068 1051314458 /nfs/dbraw/zinc/31/44/58/1051314458.db2.gz DVPVHOMJSWKMIM-UHFFFAOYSA-N 1 2 321.302 4.282 20 0 DIADLO COc1ncc([C@@H](C)Nc2ccc([NH+](C)C)cc2C)cc1Cl ZINC000793548126 1051315150 /nfs/dbraw/zinc/31/51/50/1051315150.db2.gz SODHZNMVOUVJGP-GFCCVEGCSA-N 1 2 319.836 4.291 20 0 DIADLO CCCOc1c(F)cc(F)c(Nc2cccn3cc[nH+]c23)c1F ZINC001212647391 1051326191 /nfs/dbraw/zinc/32/61/91/1051326191.db2.gz ZMQXTEVJTAZIAS-UHFFFAOYSA-N 1 2 321.302 4.284 20 0 DIADLO Clc1csc(C[NH2+]Cc2ccc(Cl)cc2Cl)n1 ZINC000759183954 1051340381 /nfs/dbraw/zinc/34/03/81/1051340381.db2.gz GCWUTWIUQMGKGA-UHFFFAOYSA-N 1 2 307.633 4.393 20 0 DIADLO Cc1cc(OC(C)C)ncc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001215772691 1051357633 /nfs/dbraw/zinc/35/76/33/1051357633.db2.gz QBJSVOSYUWUUKW-UHFFFAOYSA-N 1 2 322.412 4.166 20 0 DIADLO CSc1cc(Nc2ccc[nH+]c2N2CCCC2)ccc1F ZINC001215794151 1051373460 /nfs/dbraw/zinc/37/34/60/1051373460.db2.gz ROBJGEVIZGJGRC-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO CCOCC[C@@H](C)[N@@H+]1CC[C@@H](Cc2ccccc2)C(F)(F)C1 ZINC001172430250 1051386228 /nfs/dbraw/zinc/38/62/28/1051386228.db2.gz FTTJLXJTOGYJHN-WBVHZDCISA-N 1 2 311.416 4.001 20 0 DIADLO CCOCC[C@@H](C)[N@H+]1CC[C@@H](Cc2ccccc2)C(F)(F)C1 ZINC001172430250 1051386241 /nfs/dbraw/zinc/38/62/41/1051386241.db2.gz FTTJLXJTOGYJHN-WBVHZDCISA-N 1 2 311.416 4.001 20 0 DIADLO CCCCCC[C@@H](CCC)[NH2+][C@@H]1Oc2ccc(CCO)cc2O1 ZINC001172386848 1051390998 /nfs/dbraw/zinc/39/09/98/1051390998.db2.gz HHKCIDOEQQLBRF-VQIMIIECSA-N 1 2 321.461 4.005 20 0 DIADLO CSc1ncc(Nc2ccc[nH+]c2N2CCCCC2)cc1C ZINC001215827260 1051392763 /nfs/dbraw/zinc/39/27/63/1051392763.db2.gz MZDJQRYEBFEWDU-UHFFFAOYSA-N 1 2 314.458 4.241 20 0 DIADLO O=C(CCCc1ccc(C2CC2)cc1)Nc1ccn2cc[nH+]c2c1 ZINC001129479986 1051402685 /nfs/dbraw/zinc/40/26/85/1051402685.db2.gz FMUIVHVBRZCYMK-UHFFFAOYSA-N 1 2 319.408 4.173 20 0 DIADLO Cc1cc(-c2nc(-c3ccccc3-n3cc[nH+]c3)no2)ccc1F ZINC001215846574 1051410337 /nfs/dbraw/zinc/41/03/37/1051410337.db2.gz VQRNHDPMMJBFKM-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CC(C)OCC[C@@H](C)[N@@H+]1CC[C@@H](c2ccccc2)C(F)(F)C1 ZINC001172461857 1051413687 /nfs/dbraw/zinc/41/36/87/1051413687.db2.gz VOALPZZOVFEMHQ-WBVHZDCISA-N 1 2 311.416 4.315 20 0 DIADLO CC(C)OCC[C@@H](C)[N@H+]1CC[C@@H](c2ccccc2)C(F)(F)C1 ZINC001172461857 1051413693 /nfs/dbraw/zinc/41/36/93/1051413693.db2.gz VOALPZZOVFEMHQ-WBVHZDCISA-N 1 2 311.416 4.315 20 0 DIADLO C[C@@H](CNc1cc[nH+]c2c(Cl)cccc12)CC1(C)OCCO1 ZINC000804491226 1051429931 /nfs/dbraw/zinc/42/99/31/1051429931.db2.gz AORPDMTWQVHPTI-GFCCVEGCSA-N 1 2 320.820 4.089 20 0 DIADLO C=Cc1ccc(-c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)cc1 ZINC001215878928 1051434049 /nfs/dbraw/zinc/43/40/49/1051434049.db2.gz CUBLBLIJKYHJTF-UHFFFAOYSA-N 1 2 314.348 4.232 20 0 DIADLO CC(C)(C)CCCCC(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000804289962 1051434470 /nfs/dbraw/zinc/43/44/70/1051434470.db2.gz IAYIDPAPOAFJAL-OAHLLOKOSA-N 1 2 307.482 4.021 20 0 DIADLO CSc1cc(F)cc(Nc2ccc(N3CCCC3)[nH+]c2)c1 ZINC001215903686 1051442324 /nfs/dbraw/zinc/44/23/24/1051442324.db2.gz YIRQWPDTJBGHIR-UHFFFAOYSA-N 1 2 303.406 4.286 20 0 DIADLO CCOc1ccc(CNc2ccc([NH+](C)C)c(C)c2)cc1F ZINC000785485986 1051448870 /nfs/dbraw/zinc/44/88/70/1051448870.db2.gz QTTKONMPFTXDNU-UHFFFAOYSA-N 1 2 302.393 4.211 20 0 DIADLO CSc1ncc(Cl)cc1Nc1cccn2cc(C)[nH+]c12 ZINC001215915001 1051451308 /nfs/dbraw/zinc/45/13/08/1051451308.db2.gz DPALQLYESRQHRH-UHFFFAOYSA-N 1 2 304.806 4.157 20 0 DIADLO CSc1ncc(Cl)cc1Nc1[nH+]c2ccccc2n1C ZINC001215914751 1051451649 /nfs/dbraw/zinc/45/16/49/1051451649.db2.gz QFMMBMNJNZZKMZ-UHFFFAOYSA-N 1 2 304.806 4.087 20 0 DIADLO Fc1cccc2c1C[N@H+](Cc1cnc(-c3ccccc3)o1)CC2 ZINC001168892692 1051458771 /nfs/dbraw/zinc/45/87/71/1051458771.db2.gz CILMSOJIFQIXCH-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1cccc2c1C[N@@H+](Cc1cnc(-c3ccccc3)o1)CC2 ZINC001168892692 1051458784 /nfs/dbraw/zinc/45/87/84/1051458784.db2.gz CILMSOJIFQIXCH-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CC[C@H]3C[C@H]32)cc(C(F)(F)F)c1 ZINC001168910871 1051466190 /nfs/dbraw/zinc/46/61/90/1051466190.db2.gz ISGLZDOOSXATGY-JOYOIKCWSA-N 1 2 309.253 4.318 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CC[C@H]3C[C@H]32)cc(C(F)(F)F)c1 ZINC001168910871 1051466193 /nfs/dbraw/zinc/46/61/93/1051466193.db2.gz ISGLZDOOSXATGY-JOYOIKCWSA-N 1 2 309.253 4.318 20 0 DIADLO CSc1cc(F)c(Nc2cccc3[nH+]c(C)cn32)cc1F ZINC001215964671 1051488408 /nfs/dbraw/zinc/48/84/08/1051488408.db2.gz BBQXDLYIWLLHHG-UHFFFAOYSA-N 1 2 305.353 4.386 20 0 DIADLO CSc1cc(F)c(Nc2ccc(N3CCCC3)[nH+]c2)cc1F ZINC001215968262 1051491678 /nfs/dbraw/zinc/49/16/78/1051491678.db2.gz NWOIHZCFBHAHIO-UHFFFAOYSA-N 1 2 321.396 4.426 20 0 DIADLO C/C(=C/c1cccc(Cl)c1)C(=O)NCc1c[nH+]c(C)cc1C ZINC001129714047 1051494684 /nfs/dbraw/zinc/49/46/84/1051494684.db2.gz KOCJGOUZDOQKAC-JYRVWZFOSA-N 1 2 314.816 4.072 20 0 DIADLO OCCc1ccc[nH+]c1Nc1ccc(F)c(-c2ccccc2)c1 ZINC001215995888 1051512432 /nfs/dbraw/zinc/51/24/32/1051512432.db2.gz VUEYNKTXXLLIBZ-UHFFFAOYSA-N 1 2 308.356 4.166 20 0 DIADLO CSc1ncc(Nc2cccn3cc(C)[nH+]c23)cc1Cl ZINC001216026924 1051531218 /nfs/dbraw/zinc/53/12/18/1051531218.db2.gz ZEMFPFBGHGBMBD-UHFFFAOYSA-N 1 2 304.806 4.157 20 0 DIADLO Cc1cc(C)c(CNC(=O)C(C)(C)CCCc2ccccc2)c[nH+]1 ZINC001129842377 1051536981 /nfs/dbraw/zinc/53/69/81/1051536981.db2.gz XSVPEIFRQYXIHF-UHFFFAOYSA-N 1 2 324.468 4.364 20 0 DIADLO C[C@@H]1CCc2cc(N)ccc2[N@@H+]1c1ccc(N)c(C(F)(F)F)c1 ZINC001216051546 1051549613 /nfs/dbraw/zinc/54/96/13/1051549613.db2.gz RPFNUIBBGNUGFP-SNVBAGLBSA-N 1 2 321.346 4.343 20 0 DIADLO C[C@@H]1CCc2cc(N)ccc2[N@H+]1c1ccc(N)c(C(F)(F)F)c1 ZINC001216051546 1051549621 /nfs/dbraw/zinc/54/96/21/1051549621.db2.gz RPFNUIBBGNUGFP-SNVBAGLBSA-N 1 2 321.346 4.343 20 0 DIADLO Nc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1C(F)(F)F ZINC001216051366 1051549845 /nfs/dbraw/zinc/54/98/45/1051549845.db2.gz HPWVSHADESDABB-UHFFFAOYSA-N 1 2 318.302 4.217 20 0 DIADLO C[C@H](CSc1ccc(Cl)cc1)[N@@H+]1C[C@@H](F)C[C@H]1CF ZINC001172875432 1051558883 /nfs/dbraw/zinc/55/88/83/1051558883.db2.gz LBOUGIWEFHJNTP-WXHSDQCUSA-N 1 2 305.821 4.203 20 0 DIADLO C[C@H](CSc1ccc(Cl)cc1)[N@H+]1C[C@@H](F)C[C@H]1CF ZINC001172875432 1051558886 /nfs/dbraw/zinc/55/88/86/1051558886.db2.gz LBOUGIWEFHJNTP-WXHSDQCUSA-N 1 2 305.821 4.203 20 0 DIADLO CCCc1nc(C[N@H+](CC)[C@@H](C)c2cccc(O)c2)cs1 ZINC000178373831 1051567979 /nfs/dbraw/zinc/56/79/79/1051567979.db2.gz KMGLPCKBAMZXSC-ZDUSSCGKSA-N 1 2 304.459 4.384 20 0 DIADLO CCCc1nc(C[N@@H+](CC)[C@@H](C)c2cccc(O)c2)cs1 ZINC000178373831 1051567988 /nfs/dbraw/zinc/56/79/88/1051567988.db2.gz KMGLPCKBAMZXSC-ZDUSSCGKSA-N 1 2 304.459 4.384 20 0 DIADLO Cc1cc(Nc2cc(Cl)c3[nH+]ccn3c2)cc(Cl)c1O ZINC001216084993 1051570642 /nfs/dbraw/zinc/57/06/42/1051570642.db2.gz MRKDOPBLNXYJAF-UHFFFAOYSA-N 1 2 308.168 4.399 20 0 DIADLO COc1cccc2c(N[C@@H](C3CCC3)C(F)(F)F)cc[nH+]c12 ZINC001169284497 1051571067 /nfs/dbraw/zinc/57/10/67/1051571067.db2.gz KBWHFLVIWOHCCR-HNNXBMFYSA-N 1 2 310.319 4.386 20 0 DIADLO FC(F)(F)[C@@H](Nc1cccc(Cc2ccncc2)[nH+]1)C1CCC1 ZINC001169286208 1051572914 /nfs/dbraw/zinc/57/29/14/1051572914.db2.gz KRQNYJUJXDCJPH-INIZCTEOSA-N 1 2 321.346 4.210 20 0 DIADLO Cc1ccc(-c2cc[nH+]c(NCCc3cc(C)ccn3)c2)cc1 ZINC001169316165 1051578243 /nfs/dbraw/zinc/57/82/43/1051578243.db2.gz TUUPSMAKRZHQCU-UHFFFAOYSA-N 1 2 303.409 4.415 20 0 DIADLO Clc1cc(Cl)c(Nc2ccc(Cn3cc[nH+]c3)cc2)cn1 ZINC001212694109 1051582594 /nfs/dbraw/zinc/58/25/94/1051582594.db2.gz JZNADELQKCLPMT-UHFFFAOYSA-N 1 2 319.195 4.377 20 0 DIADLO c1csc(-c2cc(Nc3ccc(Cn4cc[nH+]c4)cc3)on2)c1 ZINC001212693972 1051582807 /nfs/dbraw/zinc/58/28/07/1051582807.db2.gz BVDVZFBIFMCJJC-UHFFFAOYSA-N 1 2 322.393 4.392 20 0 DIADLO CC[C@@H]1CC(=O)N(C[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)C1 ZINC000766666765 1051584129 /nfs/dbraw/zinc/58/41/29/1051584129.db2.gz PMRMGPGWJYKKJJ-RHSMWYFYSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@@H]1CC(=O)N(C[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)C1 ZINC000766666765 1051584144 /nfs/dbraw/zinc/58/41/44/1051584144.db2.gz PMRMGPGWJYKKJJ-RHSMWYFYSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@H]1CC(=O)N(C[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)C1 ZINC000766666767 1051584192 /nfs/dbraw/zinc/58/41/92/1051584192.db2.gz PMRMGPGWJYKKJJ-YOEHRIQHSA-N 1 2 320.864 4.083 20 0 DIADLO CC[C@H]1CC(=O)N(C[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)C1 ZINC000766666767 1051584204 /nfs/dbraw/zinc/58/42/04/1051584204.db2.gz PMRMGPGWJYKKJJ-YOEHRIQHSA-N 1 2 320.864 4.083 20 0 DIADLO Fc1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c2ncccc12 ZINC001212698002 1051587207 /nfs/dbraw/zinc/58/72/07/1051587207.db2.gz GKVXVELXRKYGOV-UHFFFAOYSA-N 1 2 318.355 4.362 20 0 DIADLO CC(=O)c1cc(F)ccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC001212697494 1051587489 /nfs/dbraw/zinc/58/74/89/1051587489.db2.gz BBEBWIOAERRGEA-UHFFFAOYSA-N 1 2 309.344 4.017 20 0 DIADLO Cc1cc([NH2+]CCc2ccc(OC(F)(F)F)cc2)ccc1N ZINC001169353625 1051599905 /nfs/dbraw/zinc/59/99/05/1051599905.db2.gz SHCVJFZYYOPZCX-UHFFFAOYSA-N 1 2 310.319 4.130 20 0 DIADLO Cc1cn2cccc(Nc3cccc(-c4ccncc4)c3)c2[nH+]1 ZINC001216145336 1051600955 /nfs/dbraw/zinc/60/09/55/1051600955.db2.gz ULSHFODWTCUWAC-UHFFFAOYSA-N 1 2 300.365 4.448 20 0 DIADLO c1c[nH+]c(Nc2cccc(-c3ccncc3)c2)c(N2CCCC2)c1 ZINC001216147046 1051601090 /nfs/dbraw/zinc/60/10/90/1051601090.db2.gz NSEJHJKEDGUNTM-UHFFFAOYSA-N 1 2 316.408 4.487 20 0 DIADLO OCC[C@@H](Nc1cc2cc[nH]c2c[nH+]1)c1cccc2ccccc21 ZINC001169416980 1051607346 /nfs/dbraw/zinc/60/73/46/1051607346.db2.gz ANNDOBCPWMVHSP-GOSISDBHSA-N 1 2 317.392 4.252 20 0 DIADLO Cc1cc(NC[C@@H](O)C(F)(F)F)[nH+]c2c1cccc2C(C)C ZINC001169454813 1051618564 /nfs/dbraw/zinc/61/85/64/1051618564.db2.gz UWJOMBKZGSGEOL-CYBMUJFWSA-N 1 2 312.335 4.002 20 0 DIADLO Cc1cc(-c2ccccc2)ccc1[N@H+]1C(=N)C=C(Cl)C=C1N ZINC001216196542 1051626318 /nfs/dbraw/zinc/62/63/18/1051626318.db2.gz YKGQIUALJSZTMW-UHFFFAOYSA-N 1 2 309.800 4.168 20 0 DIADLO Cc1cc(-c2ccccc2)ccc1[N@@H+]1C(=N)C=C(Cl)C=C1N ZINC001216196542 1051626324 /nfs/dbraw/zinc/62/63/24/1051626324.db2.gz YKGQIUALJSZTMW-UHFFFAOYSA-N 1 2 309.800 4.168 20 0 DIADLO CCc1ccccc1C[N@@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC001169507510 1051630636 /nfs/dbraw/zinc/63/06/36/1051630636.db2.gz PNTWBSJGDBKANM-IBGZPJMESA-N 1 2 317.379 4.101 20 0 DIADLO CCc1ccccc1C[N@H+]1CCO[C@H](c2ccc(F)cc2F)C1 ZINC001169507510 1051630646 /nfs/dbraw/zinc/63/06/46/1051630646.db2.gz PNTWBSJGDBKANM-IBGZPJMESA-N 1 2 317.379 4.101 20 0 DIADLO Cc1c(CSC(C)C)cccc1NC(=O)/C=C/c1[nH]cc[nH+]1 ZINC000493563939 1051634198 /nfs/dbraw/zinc/63/41/98/1051634198.db2.gz WLHBOXAYSSHAFY-BQYQJAHWSA-N 1 2 315.442 4.012 20 0 DIADLO CCOc1ccc(C)c(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001216235506 1051642052 /nfs/dbraw/zinc/64/20/52/1051642052.db2.gz DORWCFAOVAMEHA-UHFFFAOYSA-N 1 2 307.397 4.382 20 0 DIADLO C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CCCC(=O)C1 ZINC001173209150 1051647707 /nfs/dbraw/zinc/64/77/07/1051647707.db2.gz FBVWCEWZNMAWJT-QGZVFWFLSA-N 1 2 307.437 4.262 20 0 DIADLO C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCCC(=O)C1 ZINC001173209150 1051647713 /nfs/dbraw/zinc/64/77/13/1051647713.db2.gz FBVWCEWZNMAWJT-QGZVFWFLSA-N 1 2 307.437 4.262 20 0 DIADLO CSc1ncc(C)cc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001216242537 1051649977 /nfs/dbraw/zinc/64/99/77/1051649977.db2.gz IEVZQNIEABVBPP-UHFFFAOYSA-N 1 2 310.426 4.100 20 0 DIADLO COc1cc(Nc2ccccc2-n2cc[nH+]c2)ccc1OC(C)C ZINC001216249488 1051656672 /nfs/dbraw/zinc/65/66/72/1051656672.db2.gz IEULVKBXYCKOIJ-UHFFFAOYSA-N 1 2 323.396 4.412 20 0 DIADLO CCCC[C@@H](CC(C)C)[N@@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001173259711 1051660813 /nfs/dbraw/zinc/66/08/13/1051660813.db2.gz JSJWPMLLXPWLGS-SJORKVTESA-N 1 2 321.509 4.401 20 0 DIADLO CCCC[C@@H](CC(C)C)[N@H+]1CCn2c(COCC)cnc2[C@H]1C ZINC001173259711 1051660820 /nfs/dbraw/zinc/66/08/20/1051660820.db2.gz JSJWPMLLXPWLGS-SJORKVTESA-N 1 2 321.509 4.401 20 0 DIADLO CCCC[C@H](CC(C)C)[N@@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001173262092 1051663651 /nfs/dbraw/zinc/66/36/51/1051663651.db2.gz RZDCCTMRPDIEKS-JKSUJKDBSA-N 1 2 307.482 4.011 20 0 DIADLO CCCC[C@H](CC(C)C)[N@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001173262092 1051663657 /nfs/dbraw/zinc/66/36/57/1051663657.db2.gz RZDCCTMRPDIEKS-JKSUJKDBSA-N 1 2 307.482 4.011 20 0 DIADLO COc1cc(C[N@H+](CC=C(C)C)Cc2ccc(Cl)cc2)on1 ZINC001169686846 1051672011 /nfs/dbraw/zinc/67/20/11/1051672011.db2.gz NADYVDMPLLAZJK-UHFFFAOYSA-N 1 2 320.820 4.305 20 0 DIADLO COc1cc(C[N@@H+](CC=C(C)C)Cc2ccc(Cl)cc2)on1 ZINC001169686846 1051672015 /nfs/dbraw/zinc/67/20/15/1051672015.db2.gz NADYVDMPLLAZJK-UHFFFAOYSA-N 1 2 320.820 4.305 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@H+](C)Cc1cccc2[nH]ccc21 ZINC000494006076 1051676045 /nfs/dbraw/zinc/67/60/45/1051676045.db2.gz GAIDQOCNTNQYMH-LBPRGKRZSA-N 1 2 312.417 4.041 20 0 DIADLO C[C@@H](c1nc(C(C)(C)C)no1)[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000494006076 1051676052 /nfs/dbraw/zinc/67/60/52/1051676052.db2.gz GAIDQOCNTNQYMH-LBPRGKRZSA-N 1 2 312.417 4.041 20 0 DIADLO CCCCCC[C@@](C)(CCC)C(=O)N[C@H]1CCc2c[nH+]cn2C1 ZINC000804336220 1051679550 /nfs/dbraw/zinc/67/95/50/1051679550.db2.gz HRHJUHNLQSLEHP-QFBILLFUSA-N 1 2 319.493 4.091 20 0 DIADLO Clc1ccc2c(cc3n2CC[N@H+](CC[C@H]2CCCCO2)C3)c1 ZINC000494020447 1051680427 /nfs/dbraw/zinc/68/04/27/1051680427.db2.gz YNADIQIAHWRGER-QGZVFWFLSA-N 1 2 318.848 4.070 20 0 DIADLO Clc1ccc2c(cc3n2CC[N@@H+](CC[C@H]2CCCCO2)C3)c1 ZINC000494020447 1051680434 /nfs/dbraw/zinc/68/04/34/1051680434.db2.gz YNADIQIAHWRGER-QGZVFWFLSA-N 1 2 318.848 4.070 20 0 DIADLO COc1ccc(C[NH2+][C@H](c2ccccc2)c2ccccn2)c(F)c1 ZINC000494027764 1051680545 /nfs/dbraw/zinc/68/05/45/1051680545.db2.gz INSLGSVQIPDGLA-HXUWFJFHSA-N 1 2 322.383 4.109 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1cccnc1Cl ZINC000805835712 1051687244 /nfs/dbraw/zinc/68/72/44/1051687244.db2.gz QVUSGMJZYULRDL-HNNXBMFYSA-N 1 2 304.821 4.327 20 0 DIADLO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1cccnc1Cl ZINC000805835712 1051687249 /nfs/dbraw/zinc/68/72/49/1051687249.db2.gz QVUSGMJZYULRDL-HNNXBMFYSA-N 1 2 304.821 4.327 20 0 DIADLO CC(C)Oc1cc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)cc[nH+]1 ZINC001169757207 1051691912 /nfs/dbraw/zinc/69/19/12/1051691912.db2.gz SHUOZGSFISLQKS-QZTJIDSGSA-N 1 2 312.413 4.201 20 0 DIADLO c1ccn(-c2ccc[nH+]c2N[C@@H]2CCO[C@@H](c3ccccc3)C2)c1 ZINC001169759273 1051694217 /nfs/dbraw/zinc/69/42/17/1051694217.db2.gz ZCYBIHVGZYVXOC-IEBWSBKVSA-N 1 2 319.408 4.205 20 0 DIADLO OC1CCN(c2ccc(Nc3cccc(C4CCC4)c3)c[nH+]2)CC1 ZINC001216339324 1051706647 /nfs/dbraw/zinc/70/66/47/1051706647.db2.gz FHBPUOVDNHJFAL-UHFFFAOYSA-N 1 2 323.440 4.054 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1c(F)ccc(F)c1F ZINC001137930371 1051710113 /nfs/dbraw/zinc/71/01/13/1051710113.db2.gz MYYUOXBZAAMTTI-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1c(F)ccc(F)c1F ZINC001137930371 1051710126 /nfs/dbraw/zinc/71/01/26/1051710126.db2.gz MYYUOXBZAAMTTI-MRXNPFEDSA-N 1 2 321.342 4.450 20 0 DIADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1nc(-c2ccco2)no1 ZINC000183624028 1051717955 /nfs/dbraw/zinc/71/79/55/1051717955.db2.gz XWNOJWOKMSZCDF-LBPRGKRZSA-N 1 2 323.352 4.235 20 0 DIADLO CCOc1cc[nH+]cc1Nc1c(Cl)cc(CO)cc1Cl ZINC001216360456 1051719926 /nfs/dbraw/zinc/71/99/26/1051719926.db2.gz GZOBCPBIPUKHFL-UHFFFAOYSA-N 1 2 313.184 4.023 20 0 DIADLO CCC[N@H+](Cc1cc(Cl)cc(Cl)c1)[C@@H](C)C(=O)OCC ZINC001169933814 1051729180 /nfs/dbraw/zinc/72/91/80/1051729180.db2.gz SDCRUFGYCMXICK-NSHDSACASA-N 1 2 318.244 4.157 20 0 DIADLO CCC[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@@H](C)C(=O)OCC ZINC001169933814 1051729191 /nfs/dbraw/zinc/72/91/91/1051729191.db2.gz SDCRUFGYCMXICK-NSHDSACASA-N 1 2 318.244 4.157 20 0 DIADLO c1cn2c(cccc2CNc2ncccc2-c2ccccc2)[nH+]1 ZINC000184304834 1051733192 /nfs/dbraw/zinc/73/31/92/1051733192.db2.gz WJAXUZOZHLEBBD-UHFFFAOYSA-N 1 2 300.365 4.008 20 0 DIADLO C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1C[C@@H](F)[C@H](F)C1 ZINC001173545646 1051740771 /nfs/dbraw/zinc/74/07/71/1051740771.db2.gz CGSUWJLFSLZOBV-OWYVNGRQSA-N 1 2 308.199 4.306 20 0 DIADLO COc1c(F)ccc(Nc2c(C)cc[nH+]c2C(C)C)c1OC ZINC001216391638 1051742137 /nfs/dbraw/zinc/74/21/37/1051742137.db2.gz CAKXEFYNYRQCJD-UHFFFAOYSA-N 1 2 304.365 4.413 20 0 DIADLO C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1Cc2cnn(C)c2C1 ZINC001173554401 1051744102 /nfs/dbraw/zinc/74/41/02/1051744102.db2.gz OASBWLCPTOLPDL-NSHDSACASA-N 1 2 324.255 4.064 20 0 DIADLO C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1Cc2cnn(C)c2C1 ZINC001173554401 1051744110 /nfs/dbraw/zinc/74/41/10/1051744110.db2.gz OASBWLCPTOLPDL-NSHDSACASA-N 1 2 324.255 4.064 20 0 DIADLO Cc1cc([NH2+][C@@H]2CC[C@H]2C2CC2)ccc1N1CCSCC1 ZINC000806156698 1051758762 /nfs/dbraw/zinc/75/87/62/1051758762.db2.gz ILTBCUKDQUEXTR-DLBZAZTESA-N 1 2 302.487 4.149 20 0 DIADLO Cc1cc(Cl)ccc1C[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000185289510 1051760728 /nfs/dbraw/zinc/76/07/28/1051760728.db2.gz GUDXLRNPGHXPBC-NSHDSACASA-N 1 2 307.825 4.180 20 0 DIADLO C[C@H]([NH2+][C@@H]1CCCC1(F)F)c1cc(Cl)c(N)c(Cl)c1 ZINC000806179352 1051773288 /nfs/dbraw/zinc/77/32/88/1051773288.db2.gz BOWZVEQQVRBDCY-WRWORJQWSA-N 1 2 309.187 4.414 20 0 DIADLO C[C@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Nc1ccc2[nH+]ccn2c1 ZINC000806289163 1051786785 /nfs/dbraw/zinc/78/67/85/1051786785.db2.gz GLOXNWPSYIGQDI-KBPBESRZSA-N 1 2 314.433 4.013 20 0 DIADLO CC(C)([NH2+]Cc1cn2ccccc2n1)c1cccc(Cl)c1F ZINC000185846884 1051786954 /nfs/dbraw/zinc/78/69/54/1051786954.db2.gz ZYLVBWHUOQDQFD-UHFFFAOYSA-N 1 2 317.795 4.152 20 0 DIADLO COc1ccsc1[C@H](C)[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000186179273 1051799417 /nfs/dbraw/zinc/79/94/17/1051799417.db2.gz SVSWVTMFGLNRRL-LBPRGKRZSA-N 1 2 314.410 4.263 20 0 DIADLO Fc1ccc2oc(C[N@@H+]3Cc4ccccc4C4(CC4)C3)nc2c1 ZINC000186179268 1051799776 /nfs/dbraw/zinc/79/97/76/1051799776.db2.gz QQNKOQLPFYBIQL-UHFFFAOYSA-N 1 2 308.356 4.014 20 0 DIADLO Fc1ccc2oc(C[N@H+]3Cc4ccccc4C4(CC4)C3)nc2c1 ZINC000186179268 1051799789 /nfs/dbraw/zinc/79/97/89/1051799789.db2.gz QQNKOQLPFYBIQL-UHFFFAOYSA-N 1 2 308.356 4.014 20 0 DIADLO COc1c(F)cc(SC)cc1Nc1ccc2c(c1)[nH+]cn2C ZINC001216582707 1051824226 /nfs/dbraw/zinc/82/42/26/1051824226.db2.gz CKUMSRRCDQBJHE-UHFFFAOYSA-N 1 2 317.389 4.187 20 0 DIADLO CCCc1cccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000187272506 1051840924 /nfs/dbraw/zinc/84/09/24/1051840924.db2.gz BOMPHGHIICAFRS-CYBMUJFWSA-N 1 2 301.434 4.170 20 0 DIADLO COc1c(Nc2[nH+]c3ccccc3n2C)cccc1C(F)(F)F ZINC001216634040 1051842309 /nfs/dbraw/zinc/84/23/09/1051842309.db2.gz SRAVKRFZYMBVSQ-UHFFFAOYSA-N 1 2 321.302 4.344 20 0 DIADLO COc1c(Nc2cccc3[nH+]c(C)cn32)cccc1C(F)(F)F ZINC001216633315 1051843262 /nfs/dbraw/zinc/84/32/62/1051843262.db2.gz LXBXIVFWFAJAST-UHFFFAOYSA-N 1 2 321.302 4.414 20 0 DIADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccc(Br)s2)o1 ZINC000220950749 1051845850 /nfs/dbraw/zinc/84/58/50/1051845850.db2.gz SEKFALKWSYXIIC-RKDXNWHRSA-N 1 2 315.236 4.219 20 0 DIADLO CCCCC[C@H]1CCC[N@@H+]1Cn1nc(C2CC2)n(CC)c1=S ZINC000767760293 1051847715 /nfs/dbraw/zinc/84/77/15/1051847715.db2.gz AMGIIKZFXOZJAQ-HNNXBMFYSA-N 1 2 322.522 4.314 20 0 DIADLO CCCCC[C@H]1CCC[N@H+]1Cn1nc(C2CC2)n(CC)c1=S ZINC000767760293 1051847722 /nfs/dbraw/zinc/84/77/22/1051847722.db2.gz AMGIIKZFXOZJAQ-HNNXBMFYSA-N 1 2 322.522 4.314 20 0 DIADLO FC(F)(F)c1ccccc1Nc1ccc[nH+]c1N1CCCC1 ZINC001173842033 1051857673 /nfs/dbraw/zinc/85/76/73/1051857673.db2.gz VMJHUWVFZNUYIV-UHFFFAOYSA-N 1 2 307.319 4.444 20 0 DIADLO Fc1cc(F)cc(Nc2cc(Br)c3[nH+]ccn3c2)c1 ZINC001173913670 1051873716 /nfs/dbraw/zinc/87/37/16/1051873716.db2.gz BXHUIMKWRRQOMJ-UHFFFAOYSA-N 1 2 324.128 4.119 20 0 DIADLO COc1ccc(OC)c(Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC001173919942 1051878443 /nfs/dbraw/zinc/87/84/43/1051878443.db2.gz XWYLYUIUSCIFIV-UHFFFAOYSA-N 1 2 312.413 4.438 20 0 DIADLO C[C@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1cc2ccccc2o1 ZINC000189088001 1051879054 /nfs/dbraw/zinc/87/90/54/1051879054.db2.gz MQZMQZZARHSXJT-HNNXBMFYSA-N 1 2 317.392 4.469 20 0 DIADLO Clc1ccc2c(Nc3ccc4c(c3)OCCO4)cc[nH+]c2c1 ZINC001173877606 1051884786 /nfs/dbraw/zinc/88/47/86/1051884786.db2.gz SHKUVWUJGUOGPO-UHFFFAOYSA-N 1 2 312.756 4.403 20 0 DIADLO C[C@@H]1CCc2nc(C[NH2+]Cc3ccc(Cl)cc3F)sc2C1 ZINC000494411840 1051890019 /nfs/dbraw/zinc/89/00/19/1051890019.db2.gz OZHFLCQCHHIANZ-SNVBAGLBSA-N 1 2 324.852 4.350 20 0 DIADLO c1ccc(N2CCC(Nc3ccc4c(c3)CCCCC4)CC2)[nH+]c1 ZINC000404751634 1051890086 /nfs/dbraw/zinc/89/00/86/1051890086.db2.gz MKBNNPZVJWPNKU-UHFFFAOYSA-N 1 2 321.468 4.431 20 0 DIADLO C[C@H]1CCc2nc(C[NH2+]Cc3ccc(Cl)cc3F)sc2C1 ZINC000494411838 1051890656 /nfs/dbraw/zinc/89/06/56/1051890656.db2.gz OZHFLCQCHHIANZ-JTQLQIEISA-N 1 2 324.852 4.350 20 0 DIADLO C[N@H+](Cc1c(Cl)nc2ccccn21)Cc1cccc(Cl)c1 ZINC000768175518 1051895775 /nfs/dbraw/zinc/89/57/75/1051895775.db2.gz SGHKCZHXHBNODB-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[N@@H+](Cc1c(Cl)nc2ccccn21)Cc1cccc(Cl)c1 ZINC000768175518 1051895784 /nfs/dbraw/zinc/89/57/84/1051895784.db2.gz SGHKCZHXHBNODB-UHFFFAOYSA-N 1 2 320.223 4.273 20 0 DIADLO C[C@@H]([NH2+]Cc1cn2ccccc2n1)c1cc(Cl)ccc1Cl ZINC000189270169 1051905907 /nfs/dbraw/zinc/90/59/07/1051905907.db2.gz WHGXXPDZEJKGHV-LLVKDONJSA-N 1 2 320.223 4.492 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2c(Cl)nc(Cl)n2C)cc1 ZINC000768236717 1051906396 /nfs/dbraw/zinc/90/63/96/1051906396.db2.gz IMUBYUXTTNQKSN-ZDUSSCGKSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2c(Cl)nc(Cl)n2C)cc1 ZINC000768236717 1051906399 /nfs/dbraw/zinc/90/63/99/1051906399.db2.gz IMUBYUXTTNQKSN-ZDUSSCGKSA-N 1 2 324.255 4.372 20 0 DIADLO CC[N@H+](Cc1occc1Br)Cc1ccc(OC)cc1 ZINC000768334722 1051918819 /nfs/dbraw/zinc/91/88/19/1051918819.db2.gz POVSPFGCRKLLME-UHFFFAOYSA-N 1 2 324.218 4.073 20 0 DIADLO CC[N@@H+](Cc1occc1Br)Cc1ccc(OC)cc1 ZINC000768334722 1051918827 /nfs/dbraw/zinc/91/88/27/1051918827.db2.gz POVSPFGCRKLLME-UHFFFAOYSA-N 1 2 324.218 4.073 20 0 DIADLO CC(=O)Nc1ccccc1Nc1cc[nH+]c2ccc(Cl)cc12 ZINC001173990245 1051921573 /nfs/dbraw/zinc/92/15/73/1051921573.db2.gz BMMZZWDVQPPVTJ-UHFFFAOYSA-N 1 2 311.772 4.012 20 0 DIADLO c1cn(Cc2cccc(Nc3cnc4ccccc4c3)c2)c[nH+]1 ZINC001174002700 1051927282 /nfs/dbraw/zinc/92/72/82/1051927282.db2.gz SRRPGFJGDISGLO-UHFFFAOYSA-N 1 2 300.365 4.223 20 0 DIADLO Cc1cc(Br)c(C[N@@H+]2CC=CCC2)cc1Cl ZINC001168466665 1051964153 /nfs/dbraw/zinc/96/41/53/1051964153.db2.gz OLXYXTDBBMNDTN-UHFFFAOYSA-N 1 2 300.627 4.173 20 0 DIADLO CC(C)[C@H]([NH2+]Cc1cn(C(C)(C)C)nn1)c1ccccc1Cl ZINC000191072699 1051962393 /nfs/dbraw/zinc/96/23/93/1051962393.db2.gz SQUNSXKKTRRHGF-INIZCTEOSA-N 1 2 320.868 4.173 20 0 DIADLO Cc1cc(Br)c(C[N@H+]2CC=CCC2)cc1Cl ZINC001168466665 1051964145 /nfs/dbraw/zinc/96/41/45/1051964145.db2.gz OLXYXTDBBMNDTN-UHFFFAOYSA-N 1 2 300.627 4.173 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2cn(C(C)(C)C)nn2)cc1 ZINC000191358894 1051970299 /nfs/dbraw/zinc/97/02/99/1051970299.db2.gz SUSYMTJSXMWHPI-GOSISDBHSA-N 1 2 312.461 4.069 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2cn(C(C)(C)C)nn2)cc1 ZINC000191358894 1051970310 /nfs/dbraw/zinc/97/03/10/1051970310.db2.gz SUSYMTJSXMWHPI-GOSISDBHSA-N 1 2 312.461 4.069 20 0 DIADLO CC(C)CCn1cccc1C[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000191575809 1051978085 /nfs/dbraw/zinc/97/80/85/1051978085.db2.gz JKOLDVYVERRGMA-CQSZACIVSA-N 1 2 318.465 4.066 20 0 DIADLO Cc1cc(Cl)cc(C)c1C[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000191574855 1051978228 /nfs/dbraw/zinc/97/82/28/1051978228.db2.gz PJUMDGVJSSSFFP-LBPRGKRZSA-N 1 2 321.852 4.488 20 0 DIADLO CC1(C)CC(=O)N(C[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)C1 ZINC000808182861 1051981739 /nfs/dbraw/zinc/98/17/39/1051981739.db2.gz NPFUBQFFRSRXKN-INIZCTEOSA-N 1 2 320.864 4.083 20 0 DIADLO CC1(C)CC(=O)N(C[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)C1 ZINC000808182861 1051981742 /nfs/dbraw/zinc/98/17/42/1051981742.db2.gz NPFUBQFFRSRXKN-INIZCTEOSA-N 1 2 320.864 4.083 20 0 DIADLO COc1ccc(Cl)c(C[NH2+][C@@H](C)c2c(F)cccc2OC)c1 ZINC000192159152 1052000695 /nfs/dbraw/zinc/00/06/95/1052000695.db2.gz MVYUCXWBEJWLQC-NSHDSACASA-N 1 2 323.795 4.347 20 0 DIADLO c1nc([C@@H]2CCC[N@H+]2Cc2ccccc2-c2ccccc2)no1 ZINC000769233584 1052011254 /nfs/dbraw/zinc/01/12/54/1052011254.db2.gz SGNAPOCXSPHPTO-SFHVURJKSA-N 1 2 305.381 4.074 20 0 DIADLO c1nc([C@@H]2CCC[N@@H+]2Cc2ccccc2-c2ccccc2)no1 ZINC000769233584 1052011261 /nfs/dbraw/zinc/01/12/61/1052011261.db2.gz SGNAPOCXSPHPTO-SFHVURJKSA-N 1 2 305.381 4.074 20 0 DIADLO O=C(Nc1ccc(C2CCC2)cc1)Nc1ccn2cc[nH+]c2c1 ZINC001217318395 1052021662 /nfs/dbraw/zinc/02/16/62/1052021662.db2.gz KQRFRLBIJIKOQQ-UHFFFAOYSA-N 1 2 306.369 4.246 20 0 DIADLO COc1ccc(Nc2[nH+]cccc2N2CCCC2)cc1Cl ZINC001174153155 1052022190 /nfs/dbraw/zinc/02/21/90/1052022190.db2.gz QULKFJKZRQIGEW-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO COc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1Cl ZINC001174153187 1052022638 /nfs/dbraw/zinc/02/26/38/1052022638.db2.gz SHVRMCUZKLDGHX-UHFFFAOYSA-N 1 2 303.793 4.087 20 0 DIADLO Cc1cc[nH+]c(Nc2ccc(C(=O)N3CCC(C)CC3)cc2)c1 ZINC001174158840 1052023392 /nfs/dbraw/zinc/02/33/92/1052023392.db2.gz RUEUWIUSCLBHKB-UHFFFAOYSA-N 1 2 309.413 4.006 20 0 DIADLO CC[C@@H](C)Oc1cccc(NC(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC001217319692 1052023991 /nfs/dbraw/zinc/02/39/91/1052023991.db2.gz YVRDQUIYCICQSX-CYBMUJFWSA-N 1 2 324.384 4.156 20 0 DIADLO COc1cc(Cl)c(NCc2c[nH+]c3ccc(C)cn23)cc1C ZINC000808449976 1052024884 /nfs/dbraw/zinc/02/48/84/1052024884.db2.gz VRIADXMZWYULGC-UHFFFAOYSA-N 1 2 315.804 4.225 20 0 DIADLO CCN(CC)C(=O)c1cccc(Nc2cc[nH+]c(SC)c2)c1 ZINC001174164790 1052026893 /nfs/dbraw/zinc/02/68/93/1052026893.db2.gz DVYASYAWNGJMAY-UHFFFAOYSA-N 1 2 315.442 4.029 20 0 DIADLO C[C@@H]1CC[C@@](C)(/C=C/C(=O)Nc2ccc3[nH+]ccn3c2)C1(C)C ZINC001131309661 1052027056 /nfs/dbraw/zinc/02/70/56/1052027056.db2.gz UFCPPEATNKTKIB-XGKLZFSYSA-N 1 2 311.429 4.291 20 0 DIADLO Clc1ccsc1C[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000193125470 1052029445 /nfs/dbraw/zinc/02/94/45/1052029445.db2.gz UEMYOJKDNFFCEA-UHFFFAOYSA-N 1 2 304.802 4.346 20 0 DIADLO CC(C)(C)n1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)cn1 ZINC000769427178 1052045197 /nfs/dbraw/zinc/04/51/97/1052045197.db2.gz HTVFNUYQVVMFOK-QGZVFWFLSA-N 1 2 319.399 4.253 20 0 DIADLO CC(C)(C)n1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)cn1 ZINC000769427178 1052045213 /nfs/dbraw/zinc/04/52/13/1052045213.db2.gz HTVFNUYQVVMFOK-QGZVFWFLSA-N 1 2 319.399 4.253 20 0 DIADLO Cc1cccc(Nc2cccc(C(=O)N3CCC(C)CC3)c2)[nH+]1 ZINC001174202354 1052047339 /nfs/dbraw/zinc/04/73/39/1052047339.db2.gz FQZAVHSUAGBDLG-UHFFFAOYSA-N 1 2 309.413 4.006 20 0 DIADLO CC1(C)C[N@H+](Cc2ccc(CSC(F)F)o2)C(C)(C)CO1 ZINC000769446112 1052055730 /nfs/dbraw/zinc/05/57/30/1052055730.db2.gz MYIKGTYANRPKBB-UHFFFAOYSA-N 1 2 319.417 4.125 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccc(CSC(F)F)o2)C(C)(C)CO1 ZINC000769446112 1052055738 /nfs/dbraw/zinc/05/57/38/1052055738.db2.gz MYIKGTYANRPKBB-UHFFFAOYSA-N 1 2 319.417 4.125 20 0 DIADLO O=C(c1ccccc1)c1ccc(Nc2cccn3cc[nH+]c23)cc1 ZINC001174221871 1052060254 /nfs/dbraw/zinc/06/02/54/1052060254.db2.gz CCHIUSSYAXDZRY-UHFFFAOYSA-N 1 2 313.360 4.309 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458700 1052061692 /nfs/dbraw/zinc/06/16/92/1052061692.db2.gz YNHISGJGRKFUPH-YVEFUNNKSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2coc(C3CC3)n2)C1 ZINC000769458700 1052061703 /nfs/dbraw/zinc/06/17/03/1052061703.db2.gz YNHISGJGRKFUPH-YVEFUNNKSA-N 1 2 300.377 4.274 20 0 DIADLO C[C@@H]1C[N@H+](Cc2c(Cl)nc3ccccn32)[C@@H]1c1ccccc1 ZINC000769540387 1052066334 /nfs/dbraw/zinc/06/63/34/1052066334.db2.gz OEPGEKCPWCVWEQ-DYVFJYSZSA-N 1 2 311.816 4.181 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2c(Cl)nc3ccccn32)[C@@H]1c1ccccc1 ZINC000769540387 1052066347 /nfs/dbraw/zinc/06/63/47/1052066347.db2.gz OEPGEKCPWCVWEQ-DYVFJYSZSA-N 1 2 311.816 4.181 20 0 DIADLO Cc1ccc(Cl)c(-c2noc(-c3cccc4[nH+]ccn43)n2)c1 ZINC001217501194 1052074182 /nfs/dbraw/zinc/07/41/82/1052074182.db2.gz USRVKHSJWBUVDK-UHFFFAOYSA-N 1 2 310.744 4.013 20 0 DIADLO c1c[nH+]c(Nc2cccc(N3CCCCC3)c2)c(N2CCCC2)c1 ZINC001174302515 1052078438 /nfs/dbraw/zinc/07/84/38/1052078438.db2.gz XFAHCGFXDXXJJA-UHFFFAOYSA-N 1 2 322.456 4.416 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2coc(C3CC3)n2)o1 ZINC000769549524 1052080001 /nfs/dbraw/zinc/08/00/01/1052080001.db2.gz NLMFOZFWKUVRGS-BLLLJJGKSA-N 1 2 300.402 4.427 20 0 DIADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2coc(C3CC3)n2)o1 ZINC000769549524 1052080014 /nfs/dbraw/zinc/08/00/14/1052080014.db2.gz NLMFOZFWKUVRGS-BLLLJJGKSA-N 1 2 300.402 4.427 20 0 DIADLO FC(F)(F)c1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)cn1 ZINC001174311666 1052093149 /nfs/dbraw/zinc/09/31/49/1052093149.db2.gz JPVLEQMQVWTCRI-UHFFFAOYSA-N 1 2 318.302 4.089 20 0 DIADLO CCN(C)C(=O)c1ccc(Nc2ccc3c(C)cc[nH+]c3c2)cc1 ZINC001174322097 1052098299 /nfs/dbraw/zinc/09/82/99/1052098299.db2.gz FKEWMHWUBOTMHF-UHFFFAOYSA-N 1 2 319.408 4.379 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(Cl)s1)c1cc(F)c(F)c(F)c1 ZINC000769910871 1052119917 /nfs/dbraw/zinc/11/99/17/1052119917.db2.gz JHUUHLQBEVPVJW-LURJTMIESA-N 1 2 306.740 4.065 20 0 DIADLO Cc1ccc(F)c(C[N@H+](C)Cc2cc(Cl)nc(Cl)c2)c1 ZINC000769908021 1052120812 /nfs/dbraw/zinc/12/08/12/1052120812.db2.gz IPIKBRPNGNQSMH-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO Cc1ccc(F)c(C[N@@H+](C)Cc2cc(Cl)nc(Cl)c2)c1 ZINC000769908021 1052120815 /nfs/dbraw/zinc/12/08/15/1052120815.db2.gz IPIKBRPNGNQSMH-UHFFFAOYSA-N 1 2 313.203 4.468 20 0 DIADLO CCc1noc(C)c1[C@@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000769873259 1052124129 /nfs/dbraw/zinc/12/41/29/1052124129.db2.gz KQDAJZHQMVLCRO-SNVBAGLBSA-N 1 2 307.463 4.150 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+]Cc1cc(C(CC)CC)no1 ZINC000769874257 1052124351 /nfs/dbraw/zinc/12/43/51/1052124351.db2.gz JRFXEAKKUNBASI-NSHDSACASA-N 1 2 305.422 4.288 20 0 DIADLO CC(C)c1ccc(-c2nnc([C@@H]3[NH2+]CCc4ccccc43)o2)cc1 ZINC001217720966 1052126362 /nfs/dbraw/zinc/12/63/62/1052126362.db2.gz RFUVVPQGVRAMFS-GOSISDBHSA-N 1 2 319.408 4.095 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1[C@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC000769953073 1052128053 /nfs/dbraw/zinc/12/80/53/1052128053.db2.gz JMAYLDDWJIENHK-PWSUYJOCSA-N 1 2 321.827 4.029 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1[C@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC000769953073 1052128057 /nfs/dbraw/zinc/12/80/57/1052128057.db2.gz JMAYLDDWJIENHK-PWSUYJOCSA-N 1 2 321.827 4.029 20 0 DIADLO COc1cccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1F ZINC000769984218 1052136961 /nfs/dbraw/zinc/13/69/61/1052136961.db2.gz FMELTSZZYXPUAS-CYBMUJFWSA-N 1 2 311.360 4.193 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3nccnc3C(F)(F)F)ccc21 ZINC001174382277 1052140328 /nfs/dbraw/zinc/14/03/28/1052140328.db2.gz HUVXOSLWEKNRMC-UHFFFAOYSA-N 1 2 321.306 4.170 20 0 DIADLO COC(=O)c1ccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cc1 ZINC001174381800 1052140438 /nfs/dbraw/zinc/14/04/38/1052140438.db2.gz UGHWCFZOZOWQID-UHFFFAOYSA-N 1 2 309.369 4.147 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3nc(F)c(F)cc3F)ccc21 ZINC001174381328 1052141058 /nfs/dbraw/zinc/14/10/58/1052141058.db2.gz WCEOXSMVGDPADP-UHFFFAOYSA-N 1 2 306.291 4.173 20 0 DIADLO Cc1nc2c(C)cc(Nc3ccc4c(c3)[nH+]cn4C(C)C)cn2n1 ZINC001174381526 1052141110 /nfs/dbraw/zinc/14/11/10/1052141110.db2.gz JOFZHAKEAIZGJD-UHFFFAOYSA-N 1 2 320.400 4.020 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(-c4ccccn4)no3)ccc21 ZINC001174381492 1052141156 /nfs/dbraw/zinc/14/11/56/1052141156.db2.gz ITDKBPWEHQUXNY-UHFFFAOYSA-N 1 2 319.368 4.411 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ncccc3OC(F)F)ccc21 ZINC001174382537 1052142964 /nfs/dbraw/zinc/14/29/64/1052142964.db2.gz VHZSYRCMEBXPNP-UHFFFAOYSA-N 1 2 318.327 4.357 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(C(F)(F)F)cnn3)ccc21 ZINC001174382607 1052143253 /nfs/dbraw/zinc/14/32/53/1052143253.db2.gz YMASTNGFKANANS-UHFFFAOYSA-N 1 2 321.306 4.170 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cccc4c3ncn4C)ccc21 ZINC001174384058 1052143335 /nfs/dbraw/zinc/14/33/35/1052143335.db2.gz DUYMJCUFAAFXPG-UHFFFAOYSA-N 1 2 305.385 4.248 20 0 DIADLO CCN(C)c1ccc(Nc2ccc3c(c2)[nH+]cn3C(C)C)cn1 ZINC001174382488 1052143829 /nfs/dbraw/zinc/14/38/29/1052143829.db2.gz RXCBXPPLESIZDN-UHFFFAOYSA-N 1 2 309.417 4.212 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4ncncc4c3)ccc21 ZINC001174383773 1052143862 /nfs/dbraw/zinc/14/38/62/1052143862.db2.gz TZAVRQJAYJUVAD-UHFFFAOYSA-N 1 2 303.369 4.304 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3cc(F)cc(F)c3CO)ccc21 ZINC001174386018 1052145286 /nfs/dbraw/zinc/14/52/86/1052145286.db2.gz XUSSIPUTGPKNCN-UHFFFAOYSA-N 1 2 317.339 4.131 20 0 DIADLO CC(C)n1c[nH+]c2cc(Nc3ccc4c(c3)N(C)CC4)ccc21 ZINC001174385257 1052145640 /nfs/dbraw/zinc/14/56/40/1052145640.db2.gz NDMSEZIGQSIYON-UHFFFAOYSA-N 1 2 306.413 4.353 20 0 DIADLO CCCc1csc(C[NH2+]Cc2oc3ccccc3c2OC)n1 ZINC000494836613 1052146080 /nfs/dbraw/zinc/14/60/80/1052146080.db2.gz JSFLQCBSDCIHMR-UHFFFAOYSA-N 1 2 316.426 4.140 20 0 DIADLO Cc1ccc(C)c(N(C(=O)c2cccc3[nH+]ccn32)C(C)C)c1 ZINC000770076872 1052148853 /nfs/dbraw/zinc/14/88/53/1052148853.db2.gz AMKHOXFDVBPZOU-UHFFFAOYSA-N 1 2 307.397 4.006 20 0 DIADLO COc1ccc(F)c(F)c1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001174423136 1052152997 /nfs/dbraw/zinc/15/29/97/1052152997.db2.gz XHJKILNZLSNJQF-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO Cc1ccccc1[C@@H](O[C@H]1C[NH2+]CC(F)(F)C1)c1ccccc1 ZINC001217855173 1052156137 /nfs/dbraw/zinc/15/61/37/1052156137.db2.gz KRLZNRPEUNTHJW-AEFFLSMTSA-N 1 2 317.379 4.098 20 0 DIADLO c1n[nH]c([C@H]([NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)C2CCCCC2)n1 ZINC000494885561 1052160032 /nfs/dbraw/zinc/16/00/32/1052160032.db2.gz HYDYNZMDDNAEQJ-DZJNRPSUSA-N 1 2 316.493 4.375 20 0 DIADLO COc1cccc(Cl)c1C[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000227600032 1052161801 /nfs/dbraw/zinc/16/18/01/1052161801.db2.gz OAKBUGVSABUAKU-WCQYABFASA-N 1 2 305.805 4.355 20 0 DIADLO Cc1c(Br)cccc1Nc1cc[nH+]c2[nH]ccc21 ZINC001174411313 1052164520 /nfs/dbraw/zinc/16/45/20/1052164520.db2.gz UTSOZBXYYFDTNX-UHFFFAOYSA-N 1 2 302.175 4.329 20 0 DIADLO CCOC(=O)c1cc2cc(Nc3cc[nH+]c4[nH]ccc43)ccc2o1 ZINC001174411730 1052165276 /nfs/dbraw/zinc/16/52/76/1052165276.db2.gz GLCAPYMVJQLHBK-UHFFFAOYSA-N 1 2 321.336 4.181 20 0 DIADLO COC(=O)c1ccc2cc(Nc3cc[nH+]c4[nH]ccc43)ccc2c1 ZINC001174415916 1052168711 /nfs/dbraw/zinc/16/87/11/1052168711.db2.gz VWPWJDUSBSKCAO-UHFFFAOYSA-N 1 2 317.348 4.198 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@@H+]1Cc1sccc1Cl ZINC000494935104 1052171120 /nfs/dbraw/zinc/17/11/20/1052171120.db2.gz IPNOPVWAHKLBPK-WFASDCNBSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@H](c2ccccc2)C[N@H+]1Cc1sccc1Cl ZINC000494935104 1052171126 /nfs/dbraw/zinc/17/11/26/1052171126.db2.gz IPNOPVWAHKLBPK-WFASDCNBSA-N 1 2 307.846 4.364 20 0 DIADLO c1cn(Cc2cccc(Nc3cccc(N4CCCC4)c3)c2)c[nH+]1 ZINC001174487632 1052172682 /nfs/dbraw/zinc/17/26/82/1052172682.db2.gz IVHQCPUUDRXVSH-UHFFFAOYSA-N 1 2 318.424 4.275 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@@H+]1Cc1cc(Cl)cs1 ZINC000494941855 1052181666 /nfs/dbraw/zinc/18/16/66/1052181666.db2.gz YQNFPODYXMGZEZ-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO C[C@H]1CO[C@@H](c2ccccc2)C[N@H+]1Cc1cc(Cl)cs1 ZINC000494941855 1052181671 /nfs/dbraw/zinc/18/16/71/1052181671.db2.gz YQNFPODYXMGZEZ-BLLLJJGKSA-N 1 2 307.846 4.364 20 0 DIADLO CC[C@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccc(F)cn1 ZINC000494970518 1052185895 /nfs/dbraw/zinc/18/58/95/1052185895.db2.gz OBFLZNMRJRIFNL-INIZCTEOSA-N 1 2 314.408 4.169 20 0 DIADLO COc1cccc([C@@H](C)[NH2+][C@H](Cc2ccccc2)c2ncco2)c1 ZINC000653911595 1052190663 /nfs/dbraw/zinc/19/06/63/1052190663.db2.gz HJCYRWJGHLSVEQ-DNVCBOLYSA-N 1 2 322.408 4.318 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+]1CCC[C@@H]1c1cc(C)no1 ZINC000495178481 1052244941 /nfs/dbraw/zinc/24/49/41/1052244941.db2.gz QQHPLLAIKOGMIJ-OAHLLOKOSA-N 1 2 320.820 4.372 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+]1CCC[C@@H]1c1cc(C)no1 ZINC000495178481 1052244949 /nfs/dbraw/zinc/24/49/49/1052244949.db2.gz QQHPLLAIKOGMIJ-OAHLLOKOSA-N 1 2 320.820 4.372 20 0 DIADLO CCCC[N@@H+](Cn1nc(-c2cccs2)oc1=S)C1CC1 ZINC000914783927 1052250740 /nfs/dbraw/zinc/25/07/40/1052250740.db2.gz JPPISTAPNQSYGH-UHFFFAOYSA-N 1 2 309.460 4.156 20 0 DIADLO CCCC[N@H+](Cn1nc(-c2ccccc2)oc1=S)C1CC1 ZINC000914784051 1052250557 /nfs/dbraw/zinc/25/05/57/1052250557.db2.gz UNWFJYPRIIYSPY-UHFFFAOYSA-N 1 2 303.431 4.095 20 0 DIADLO CCCC[N@@H+](Cn1nc(-c2ccccc2)oc1=S)C1CC1 ZINC000914784051 1052250561 /nfs/dbraw/zinc/25/05/61/1052250561.db2.gz UNWFJYPRIIYSPY-UHFFFAOYSA-N 1 2 303.431 4.095 20 0 DIADLO Cc1c[nH+]c(Nc2ccccc2OCc2ccccc2)c(N)c1 ZINC000309832738 1052250789 /nfs/dbraw/zinc/25/07/89/1052250789.db2.gz SREQOMSUPPJUEV-UHFFFAOYSA-N 1 2 305.381 4.295 20 0 DIADLO CCCC[N@H+](Cn1nc(-c2cccs2)oc1=S)C1CC1 ZINC000914783927 1052250737 /nfs/dbraw/zinc/25/07/37/1052250737.db2.gz JPPISTAPNQSYGH-UHFFFAOYSA-N 1 2 309.460 4.156 20 0 DIADLO Cc1nc(N2CCC(c3cc4ccccc4[nH]3)CC2)c(C)c(C)[nH+]1 ZINC000761885341 1052265755 /nfs/dbraw/zinc/26/57/55/1052265755.db2.gz DPVNWFRHRPDPBW-UHFFFAOYSA-N 1 2 320.440 4.267 20 0 DIADLO Cc1cc(C)c(NC(=O)NC[C@@H]2CCCC(C)(C)C2)c(C)[nH+]1 ZINC001219009581 1052267963 /nfs/dbraw/zinc/26/79/63/1052267963.db2.gz FXXMSPANTKTQNK-OAHLLOKOSA-N 1 2 303.450 4.345 20 0 DIADLO Fc1ccc(Br)c(F)c1C[N@@H+]1CC2CCC1CC2 ZINC000311154249 1052278435 /nfs/dbraw/zinc/27/84/35/1052278435.db2.gz WRROWRUHAMOBOK-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1ccc(Br)c(F)c1C[N@H+]1CC2CCC1CC2 ZINC000311154249 1052278442 /nfs/dbraw/zinc/27/84/42/1052278442.db2.gz WRROWRUHAMOBOK-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO CC(C)[C@H]1CN(C(=O)Nc2ccc3[nH+]ccn3c2)c2ccccc21 ZINC001219557166 1052293891 /nfs/dbraw/zinc/29/38/91/1052293891.db2.gz SEWCWVSRBHVRBA-MRXNPFEDSA-N 1 2 320.396 4.126 20 0 DIADLO COc1ccc([C@@H](C)Nc2ccc([NH+](C)C)cc2C)c(F)c1 ZINC000315472713 1052337687 /nfs/dbraw/zinc/33/76/87/1052337687.db2.gz OYOJAYXDRJFYLS-CYBMUJFWSA-N 1 2 302.393 4.382 20 0 DIADLO CCn1c(-c2ccccc2)nn(C[N@H+](C)[C@H](C)C(C)C)c1=S ZINC000915209856 1052368656 /nfs/dbraw/zinc/36/86/56/1052368656.db2.gz VGHQINHVYKIBGS-CQSZACIVSA-N 1 2 318.490 4.035 20 0 DIADLO CCn1c(-c2ccccc2)nn(C[N@@H+](C)[C@H](C)C(C)C)c1=S ZINC000915209856 1052368661 /nfs/dbraw/zinc/36/86/61/1052368661.db2.gz VGHQINHVYKIBGS-CQSZACIVSA-N 1 2 318.490 4.035 20 0 DIADLO Cn1c2ccccc2[nH+]c1N[C@H]1CC2(CCC2)Oc2ccccc21 ZINC000762543014 1052397831 /nfs/dbraw/zinc/39/78/31/1052397831.db2.gz RSCBEPBIOPDXAJ-INIZCTEOSA-N 1 2 319.408 4.432 20 0 DIADLO C[C@H]([NH2+]C/C=C/c1ccccc1)c1nc(Cc2ccccc2)no1 ZINC000237515554 1052441509 /nfs/dbraw/zinc/44/15/09/1052441509.db2.gz ZCFSRSZDBPTWGG-OIQJVACTSA-N 1 2 319.408 4.024 20 0 DIADLO ClC(Cl)(Cl)[C@@H](OCCn1cc[nH+]c1)c1ccccc1 ZINC001222134330 1052448402 /nfs/dbraw/zinc/44/84/02/1052448402.db2.gz CQVCUDWQIMLIRN-LBPRGKRZSA-N 1 2 319.619 4.011 20 0 DIADLO Clc1ccc([C@@H](OCCn2cc[nH+]c2)c2ccccc2)cc1 ZINC001222135125 1052448465 /nfs/dbraw/zinc/44/84/65/1052448465.db2.gz WDZYVACTMMYSCR-SFHVURJKSA-N 1 2 312.800 4.343 20 0 DIADLO CC(C)c1ccc(OC(=O)c2cccc(Cn3cc[nH+]c3)c2)cc1 ZINC000915655894 1052466523 /nfs/dbraw/zinc/46/65/23/1052466523.db2.gz CJPQITPVVZBXED-UHFFFAOYSA-N 1 2 320.392 4.274 20 0 DIADLO CSc1ccc2cc(C[NH+]3CCSCC3)c(Cl)nc2c1 ZINC000915690303 1052468741 /nfs/dbraw/zinc/46/87/41/1052468741.db2.gz RHCHQLPIDVOUCE-UHFFFAOYSA-N 1 2 324.902 4.159 20 0 DIADLO CC[C@@H](Nc1ccc(N(CC)CC)[nH+]c1)c1ccc(F)cn1 ZINC000317011350 1052476094 /nfs/dbraw/zinc/47/60/94/1052476094.db2.gz ADGMAYZWMRYCDE-OAHLLOKOSA-N 1 2 302.397 4.025 20 0 DIADLO CC[C@H]([NH2+][C@@H](C)c1cc(C)c(C)o1)c1nnc2n1CCCCC2 ZINC000282113742 1052488974 /nfs/dbraw/zinc/48/89/74/1052488974.db2.gz JDTBMPVEWCZEQK-ZFWWWQNUSA-N 1 2 316.449 4.016 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(Cl)c(CO)c2F)cc1 ZINC001222362440 1052491876 /nfs/dbraw/zinc/49/18/76/1052491876.db2.gz MJPXPDCZJJVPTH-UHFFFAOYSA-N 1 2 316.763 4.039 20 0 DIADLO Fc1cccc(-c2nc(C[N@@H+]3CCc4ccccc4C3)co2)c1 ZINC000026807479 1052496953 /nfs/dbraw/zinc/49/69/53/1052496953.db2.gz ZRQFICFABOKVNU-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO Fc1cccc(-c2nc(C[N@H+]3CCc4ccccc4C3)co2)c1 ZINC000026807479 1052496958 /nfs/dbraw/zinc/49/69/58/1052496958.db2.gz ZRQFICFABOKVNU-UHFFFAOYSA-N 1 2 308.356 4.039 20 0 DIADLO COC[C@@H]1CCCC[N@@H+]1Cc1c(F)cc(Cl)cc1Cl ZINC001235742244 1052497240 /nfs/dbraw/zinc/49/72/40/1052497240.db2.gz VJQZASLEZIWYMM-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO COC[C@@H]1CCCC[N@H+]1Cc1c(F)cc(Cl)cc1Cl ZINC001235742244 1052497243 /nfs/dbraw/zinc/49/72/43/1052497243.db2.gz VJQZASLEZIWYMM-NSHDSACASA-N 1 2 306.208 4.133 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1cc(Cl)cc(Cl)c1 ZINC001222593591 1052515448 /nfs/dbraw/zinc/51/54/48/1052515448.db2.gz WYMLOBQGVXXWGQ-UHFFFAOYSA-N 1 2 323.223 4.200 20 0 DIADLO Cn1c[nH+]cc1CO[C@@H]1CCN(c2ccccc2)c2ccccc21 ZINC001222599462 1052516269 /nfs/dbraw/zinc/51/62/69/1052516269.db2.gz BMPPZXOTRHAFJA-HXUWFJFHSA-N 1 2 319.408 4.220 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)Cc3coc4cc(C)ccc34)cc2[nH+]1 ZINC000055229316 1052528079 /nfs/dbraw/zinc/52/80/79/1052528079.db2.gz RAZAEEWPKSOIMV-UHFFFAOYSA-N 1 2 319.364 4.107 20 0 DIADLO CC(C)COC[C@@H]([NH2+]Cc1cc(O)cc(Cl)c1)c1ccco1 ZINC001649025623 1052534377 /nfs/dbraw/zinc/53/43/77/1052534377.db2.gz SEAWMSQYUTYDMZ-MRXNPFEDSA-N 1 2 323.820 4.142 20 0 DIADLO C[C@H](CNc1ccccc1OCCn1cc[nH+]c1)C(C)(C)C ZINC000670265922 1052539456 /nfs/dbraw/zinc/53/94/56/1052539456.db2.gz AQSXFDAKILNNKV-OAHLLOKOSA-N 1 2 301.434 4.056 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2coc(-c3ccc(C)cc3)n2)cc1 ZINC000055952151 1052544121 /nfs/dbraw/zinc/54/41/21/1052544121.db2.gz ORFULYJCVGXRSU-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2coc(-c3ccc(C)cc3)n2)cc1 ZINC000055952151 1052544126 /nfs/dbraw/zinc/54/41/26/1052544126.db2.gz ORFULYJCVGXRSU-UHFFFAOYSA-N 1 2 322.408 4.291 20 0 DIADLO Cc1cc(CO[C@@H](c2ccccc2)c2ccccn2)cc(C)[nH+]1 ZINC001223419629 1052598544 /nfs/dbraw/zinc/59/85/44/1052598544.db2.gz GOUBUXJASUAVPW-FQEVSTJZSA-N 1 2 304.393 4.400 20 0 DIADLO Cc1nc(C[NH2+]Cc2ccccc2OC(C)C)nc2ccccc12 ZINC001649033420 1052622828 /nfs/dbraw/zinc/62/28/28/1052622828.db2.gz LNRYYBWQAHQDJF-UHFFFAOYSA-N 1 2 321.424 4.015 20 0 DIADLO CCc1nc([C@H](C)[NH2+][C@@H]2CCc3c2cc(F)cc3F)cs1 ZINC000154680875 1052639163 /nfs/dbraw/zinc/63/91/63/1052639163.db2.gz OLIDNKYYLKKEAY-LKFCYVNXSA-N 1 2 308.397 4.322 20 0 DIADLO Cc1nc2[nH]ccc2c(N[C@H](C)c2cccc(OC(F)F)c2)[nH+]1 ZINC000080947984 1052654987 /nfs/dbraw/zinc/65/49/87/1052654987.db2.gz FCRNSNRJKLPXBW-SECBINFHSA-N 1 2 318.327 4.041 20 0 DIADLO Brc1ccc([C@H]2CCC[N@H+]2Cc2cncs2)cc1 ZINC000126233707 1052668213 /nfs/dbraw/zinc/66/82/13/1052668213.db2.gz YPGCZTZRTZQRML-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Cn1c(-c2ccc(-n3cc[nH+]c3)cc2)nc2cccc(Cl)c21 ZINC000916856306 1052661102 /nfs/dbraw/zinc/66/11/02/1052661102.db2.gz KUZILQVUKASMPT-UHFFFAOYSA-N 1 2 308.772 4.079 20 0 DIADLO CC(C)=CCCO[C@@H]1CCC[N@@H+](Cc2cnc(Cl)s2)C1 ZINC001224716742 1052719915 /nfs/dbraw/zinc/71/99/15/1052719915.db2.gz QIQNJYLTYRPLNI-CYBMUJFWSA-N 1 2 314.882 4.134 20 0 DIADLO Brc1ccc([C@H]2CCC[N@@H+]2Cc2cncs2)cc1 ZINC000126233707 1052668210 /nfs/dbraw/zinc/66/82/10/1052668210.db2.gz YPGCZTZRTZQRML-CQSZACIVSA-N 1 2 323.259 4.243 20 0 DIADLO Fc1cccnc1C[NH2+]Cc1ccc(-c2ccccc2Cl)o1 ZINC000126214528 1052668408 /nfs/dbraw/zinc/66/84/08/1052668408.db2.gz WMCVZRAFTZYLOM-UHFFFAOYSA-N 1 2 316.763 4.424 20 0 DIADLO CCCCCC[C@H](C)NC(=O)c1cccc(Cn2cc[nH+]c2)c1 ZINC000916962904 1052674955 /nfs/dbraw/zinc/67/49/55/1052674955.db2.gz CADZFHIBHOUFIF-INIZCTEOSA-N 1 2 313.445 4.020 20 0 DIADLO Cn1ncc2c1nc[nH+]c2N[C@@H](c1ccccc1)C1CCCCC1 ZINC000917067362 1052689987 /nfs/dbraw/zinc/68/99/87/1052689987.db2.gz CCAUUQKCVQXJEH-KRWDZBQOSA-N 1 2 321.428 4.097 20 0 DIADLO COc1ccc2oc(CNc3cccc(-n4cc[nH+]c4)c3)cc2c1 ZINC000127295215 1052692279 /nfs/dbraw/zinc/69/22/79/1052692279.db2.gz SNNXTEJROLVFRW-UHFFFAOYSA-N 1 2 319.364 4.239 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1ncc(-c2cccs2)o1 ZINC000067375077 1052703664 /nfs/dbraw/zinc/70/36/64/1052703664.db2.gz MSZMPPVEDDHBKA-CQSZACIVSA-N 1 2 313.426 4.079 20 0 DIADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1ncc(-c2cccs2)o1 ZINC000067375077 1052703667 /nfs/dbraw/zinc/70/36/67/1052703667.db2.gz MSZMPPVEDDHBKA-CQSZACIVSA-N 1 2 313.426 4.079 20 0 DIADLO Cc1ncc(C[N@H+](Cc2ccco2)Cc2cccs2)s1 ZINC000128034461 1052707978 /nfs/dbraw/zinc/70/79/78/1052707978.db2.gz YNSFRUWPDFNABN-UHFFFAOYSA-N 1 2 304.440 4.308 20 0 DIADLO Cc1ncc(C[N@@H+](Cc2ccco2)Cc2cccs2)s1 ZINC000128034461 1052707980 /nfs/dbraw/zinc/70/79/80/1052707980.db2.gz YNSFRUWPDFNABN-UHFFFAOYSA-N 1 2 304.440 4.308 20 0 DIADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1ccc(Br)cc1F ZINC000128089739 1052708362 /nfs/dbraw/zinc/70/83/62/1052708362.db2.gz GQWKZFUEFUCRHB-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccc(Br)cc1F ZINC000128089739 1052708366 /nfs/dbraw/zinc/70/83/66/1052708366.db2.gz GQWKZFUEFUCRHB-NSHDSACASA-N 1 2 323.209 4.176 20 0 DIADLO CCCCc1noc(C[N@H+](C2CC2)[C@H]2CCc3ccccc32)n1 ZINC000067712322 1052709713 /nfs/dbraw/zinc/70/97/13/1052709713.db2.gz GOZKWDKCDLDONT-KRWDZBQOSA-N 1 2 311.429 4.064 20 0 DIADLO CCCCc1noc(C[N@@H+](C2CC2)[C@H]2CCc3ccccc32)n1 ZINC000067712322 1052709721 /nfs/dbraw/zinc/70/97/21/1052709721.db2.gz GOZKWDKCDLDONT-KRWDZBQOSA-N 1 2 311.429 4.064 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](C)c2cccc3ccccc32)n1 ZINC000128311340 1052715551 /nfs/dbraw/zinc/71/55/51/1052715551.db2.gz DWZRVLIILUZAMI-AWEZNQCLSA-N 1 2 309.413 4.416 20 0 DIADLO FC(F)(F)c1ccc(-c2nc(Cn3cc[nH+]c3)cs2)cc1 ZINC000067962075 1052716447 /nfs/dbraw/zinc/71/64/47/1052716447.db2.gz YLXYYONXFVTTBT-UHFFFAOYSA-N 1 2 309.316 4.074 20 0 DIADLO CC(C)=CCCO[C@@H]1CCC[N@H+](Cc2cnc(Cl)s2)C1 ZINC001224716742 1052719909 /nfs/dbraw/zinc/71/99/09/1052719909.db2.gz QIQNJYLTYRPLNI-CYBMUJFWSA-N 1 2 314.882 4.134 20 0 DIADLO Cn1c2ccccc2n(C[N@@H+]2CC[C@H]2c2ccccc2)c1=S ZINC000917446110 1052728047 /nfs/dbraw/zinc/72/80/47/1052728047.db2.gz HOPXIAWMCSXYHS-HNNXBMFYSA-N 1 2 309.438 4.114 20 0 DIADLO Cn1c2ccccc2n(C[N@H+]2CC[C@H]2c2ccccc2)c1=S ZINC000917446110 1052728053 /nfs/dbraw/zinc/72/80/53/1052728053.db2.gz HOPXIAWMCSXYHS-HNNXBMFYSA-N 1 2 309.438 4.114 20 0 DIADLO CC[N@H+](CC(C)C)Cn1[nH]c(/C=C\c2ccccc2)nc1=S ZINC000917454740 1052729327 /nfs/dbraw/zinc/72/93/27/1052729327.db2.gz ZRHANMIBRIURGW-KHPPLWFESA-N 1 2 316.474 4.046 20 0 DIADLO CC[N@@H+](CC(C)C)Cn1[nH]c(/C=C\c2ccccc2)nc1=S ZINC000917454740 1052729331 /nfs/dbraw/zinc/72/93/31/1052729331.db2.gz ZRHANMIBRIURGW-KHPPLWFESA-N 1 2 316.474 4.046 20 0 DIADLO CCOC(=[NH2+])CCCCO[C@H](c1ccccc1)c1ccccn1 ZINC001224965265 1052739105 /nfs/dbraw/zinc/73/91/05/1052739105.db2.gz IGWIFAIRORAGPN-LJQANCHMSA-N 1 2 312.413 4.372 20 0 DIADLO CCOC(=[NH2+])CCCCO[C@H](c1ccccc1)C1CCOCC1 ZINC001224965538 1052739170 /nfs/dbraw/zinc/73/91/70/1052739170.db2.gz KLUOVGXFWIMFRM-LJQANCHMSA-N 1 2 319.445 4.355 20 0 DIADLO Cc1cccc([C@H]2CCC[N@@H+]2Cn2sc3ccccc3c2=O)c1 ZINC000917617419 1052744510 /nfs/dbraw/zinc/74/45/10/1052744510.db2.gz DRBLUEMOYSDQBA-QGZVFWFLSA-N 1 2 324.449 4.166 20 0 DIADLO Cc1cccc([C@H]2CCC[N@H+]2Cn2sc3ccccc3c2=O)c1 ZINC000917617419 1052744512 /nfs/dbraw/zinc/74/45/12/1052744512.db2.gz DRBLUEMOYSDQBA-QGZVFWFLSA-N 1 2 324.449 4.166 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC[C@H]([C@H]3CCCC3(C)C)C2)c(C)[nH+]1 ZINC001277024920 1052756275 /nfs/dbraw/zinc/75/62/75/1052756275.db2.gz VJPRFCNNWNBYPO-DLBZAZTESA-N 1 2 314.473 4.295 20 0 DIADLO CC(C)Oc1ccc(COc2cc[nH+]cc2)cc1Br ZINC001225293957 1052769848 /nfs/dbraw/zinc/76/98/48/1052769848.db2.gz CVILCTLBJJFXOQ-UHFFFAOYSA-N 1 2 322.202 4.210 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1sccc1Br ZINC000069065022 1052778404 /nfs/dbraw/zinc/77/84/04/1052778404.db2.gz PMZOVXXKUCSKJH-VIFPVBQESA-N 1 2 300.221 4.297 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1sccc1Br ZINC000069065022 1052778409 /nfs/dbraw/zinc/77/84/09/1052778409.db2.gz PMZOVXXKUCSKJH-VIFPVBQESA-N 1 2 300.221 4.297 20 0 DIADLO c1csc(C[N@H+](Cc2cccc(-c3cccnc3)c2)C2CC2)n1 ZINC000129991751 1052817740 /nfs/dbraw/zinc/81/77/40/1052817740.db2.gz MFEXWDBRLYKCJR-UHFFFAOYSA-N 1 2 321.449 4.370 20 0 DIADLO c1csc(C[N@@H+](Cc2cccc(-c3cccnc3)c2)C2CC2)n1 ZINC000129991751 1052817746 /nfs/dbraw/zinc/81/77/46/1052817746.db2.gz MFEXWDBRLYKCJR-UHFFFAOYSA-N 1 2 321.449 4.370 20 0 DIADLO Cc1cc(N2CCSCC2)ccc1[NH2+][C@H]1CC=C(C)CC1 ZINC000556264777 1052829510 /nfs/dbraw/zinc/82/95/10/1052829510.db2.gz VFWKUOAOISAFEX-INIZCTEOSA-N 1 2 302.487 4.459 20 0 DIADLO C[N@H+](Cc1cc[nH]n1)Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC000556598383 1052868145 /nfs/dbraw/zinc/86/81/45/1052868145.db2.gz MHWGXYDUBSETTC-UHFFFAOYSA-N 1 2 311.816 4.362 20 0 DIADLO C[N@@H+](Cc1cc[nH]n1)Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC000556598383 1052868149 /nfs/dbraw/zinc/86/81/49/1052868149.db2.gz MHWGXYDUBSETTC-UHFFFAOYSA-N 1 2 311.816 4.362 20 0 DIADLO Clc1cnc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)s1 ZINC000556909636 1052897731 /nfs/dbraw/zinc/89/77/31/1052897731.db2.gz JIWYGDYHHRYMNS-NSHDSACASA-N 1 2 313.253 4.439 20 0 DIADLO Clc1cnc(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)s1 ZINC000556909636 1052897736 /nfs/dbraw/zinc/89/77/36/1052897736.db2.gz JIWYGDYHHRYMNS-NSHDSACASA-N 1 2 313.253 4.439 20 0 DIADLO CC1(C)C[N@H+](CN2C(=O)C[C@H]2c2ccccc2)[C@H]1c1ccccc1 ZINC000919949459 1052904506 /nfs/dbraw/zinc/90/45/06/1052904506.db2.gz VWIJNSYYUZZDLN-ICSRJNTNSA-N 1 2 320.436 4.001 20 0 DIADLO CC1(C)C[N@@H+](CN2C(=O)C[C@H]2c2ccccc2)[C@H]1c1ccccc1 ZINC000919949459 1052904509 /nfs/dbraw/zinc/90/45/09/1052904509.db2.gz VWIJNSYYUZZDLN-ICSRJNTNSA-N 1 2 320.436 4.001 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@H+]1Cc1nc2ccccc2o1 ZINC000556980360 1052908156 /nfs/dbraw/zinc/90/81/56/1052908156.db2.gz DOELSERPUXVZMF-QWHCGFSZSA-N 1 2 310.372 4.475 20 0 DIADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@@H+]1Cc1nc2ccccc2o1 ZINC000556980360 1052908161 /nfs/dbraw/zinc/90/81/61/1052908161.db2.gz DOELSERPUXVZMF-QWHCGFSZSA-N 1 2 310.372 4.475 20 0 DIADLO CC[NH+](CC)Cc1csc(NC(=O)C[C@@H]2CCCC[C@@H]2C)n1 ZINC000920459426 1052940242 /nfs/dbraw/zinc/94/02/42/1052940242.db2.gz AILBCGREVXHORT-KBPBESRZSA-N 1 2 323.506 4.140 20 0 DIADLO CC(C)C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)n1cc[nH+]c1 ZINC000923761785 1052945885 /nfs/dbraw/zinc/94/58/85/1052945885.db2.gz SXHZFPRYPIYZQQ-AWEZNQCLSA-N 1 2 316.792 4.222 20 0 DIADLO CCC1CCC([N@H+](C)Cn2nnc3ccccc3c2=S)CC1 ZINC000921046812 1052960637 /nfs/dbraw/zinc/96/06/37/1052960637.db2.gz SOZBYSIRJLBYHS-UHFFFAOYSA-N 1 2 316.474 4.019 20 0 DIADLO CCC1CCC([N@@H+](C)Cn2nnc3ccccc3c2=S)CC1 ZINC000921046812 1052960639 /nfs/dbraw/zinc/96/06/39/1052960639.db2.gz SOZBYSIRJLBYHS-UHFFFAOYSA-N 1 2 316.474 4.019 20 0 DIADLO Cc1nn(C[N@@H+](CCc2ccccc2)CC(C)C)c(=S)s1 ZINC000921057454 1052961307 /nfs/dbraw/zinc/96/13/07/1052961307.db2.gz LKWXFXIGBHPCNF-UHFFFAOYSA-N 1 2 321.515 4.141 20 0 DIADLO Cc1nn(C[N@H+](CCc2ccccc2)CC(C)C)c(=S)s1 ZINC000921057454 1052961311 /nfs/dbraw/zinc/96/13/11/1052961311.db2.gz LKWXFXIGBHPCNF-UHFFFAOYSA-N 1 2 321.515 4.141 20 0 DIADLO C/C(=C\C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccc(F)cc1 ZINC000921277929 1052969777 /nfs/dbraw/zinc/96/97/77/1052969777.db2.gz GMILYQAWABKEMM-WYMLVPIESA-N 1 2 321.355 4.053 20 0 DIADLO Cc1nc(N[C@H]2CCCCC2(C)C)c(Br)c(C)[nH+]1 ZINC000322899831 1052970704 /nfs/dbraw/zinc/97/07/04/1052970704.db2.gz PHXJQPTXTISCEY-NSHDSACASA-N 1 2 312.255 4.237 20 0 DIADLO COC(=O)c1c(C)cc(Nc2ccccc2-n2cc[nH+]c2)cc1C ZINC001213123053 1052978701 /nfs/dbraw/zinc/97/87/01/1052978701.db2.gz QKMKWMJGJZLLIE-UHFFFAOYSA-N 1 2 321.380 4.019 20 0 DIADLO CC(C)CCOC1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC000179783250 1053027422 /nfs/dbraw/zinc/02/74/22/1053027422.db2.gz AWMSXZBSXVFZNL-UHFFFAOYSA-N 1 2 311.853 4.073 20 0 DIADLO C[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccc(Cl)nc1 ZINC000179922517 1053034461 /nfs/dbraw/zinc/03/44/61/1053034461.db2.gz MVQWDAZLRCOPQC-CYBMUJFWSA-N 1 2 316.836 4.293 20 0 DIADLO Cc1cc([NH2+][C@@H](C)CSC(C)(C)C)ccc1N1CCOCC1 ZINC000180427647 1053058811 /nfs/dbraw/zinc/05/88/11/1053058811.db2.gz STLRGDWACCTJAD-HNNXBMFYSA-N 1 2 322.518 4.164 20 0 DIADLO CC(C)(C)c1nnc(C[NH2+]C(C)(C)c2ccc(Cl)cc2)o1 ZINC000068823456 1053074200 /nfs/dbraw/zinc/07/42/00/1053074200.db2.gz FQWZWRVTKWMYAM-UHFFFAOYSA-N 1 2 307.825 4.045 20 0 DIADLO Cc1[nH]c2ccc(O[C@@H](c3ccccc3)C3CCOCC3)cc2[nH+]1 ZINC001228328438 1053076693 /nfs/dbraw/zinc/07/66/93/1053076693.db2.gz FADVSHLIKFOYRE-FQEVSTJZSA-N 1 2 322.408 4.418 20 0 DIADLO Fc1ccc([C@H]([NH2+][C@@H]2CCCc3[nH]ncc32)C2CCCC2)cc1 ZINC000353383906 1053077734 /nfs/dbraw/zinc/07/77/34/1053077734.db2.gz HKALQQXXHQVUBV-IEBWSBKVSA-N 1 2 313.420 4.447 20 0 DIADLO CC(C)c1cc(N[C@@H]2CCO[C@@H](C(C)C)C2)nc(C(C)C)[nH+]1 ZINC000540038845 1053096598 /nfs/dbraw/zinc/09/65/98/1053096598.db2.gz PNXMKTNGZVGZRB-GDBMZVCRSA-N 1 2 305.466 4.339 20 0 DIADLO Cc1cc(NCCc2nc3ccccc3[nH]2)[nH+]c2ccccc12 ZINC001317746358 1053130995 /nfs/dbraw/zinc/13/09/95/1053130995.db2.gz KURTXPDBBANWSE-UHFFFAOYSA-N 1 2 302.381 4.074 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@@H+]1CCO[C@](C)(C2CC2)C1 ZINC001559992794 1053141839 /nfs/dbraw/zinc/14/18/39/1053141839.db2.gz ILEGDELGNKCFJD-LRDDRELGSA-N 1 2 324.262 4.011 20 0 DIADLO C[C@@H](c1ccc(Br)cc1)[N@H+]1CCO[C@](C)(C2CC2)C1 ZINC001559992794 1053141844 /nfs/dbraw/zinc/14/18/44/1053141844.db2.gz ILEGDELGNKCFJD-LRDDRELGSA-N 1 2 324.262 4.011 20 0 DIADLO Cc1ccnc(C[NH2+]Cc2c(Cl)cc(Cl)cc2N(C)C)c1 ZINC001560574641 1053153053 /nfs/dbraw/zinc/15/30/53/1053153053.db2.gz IITWUOJSJOEMST-UHFFFAOYSA-N 1 2 324.255 4.053 20 0 DIADLO CC[C@@H]([NH2+]Cc1nnc(C(F)(F)F)s1)c1ccc(C)cc1 ZINC000660175365 1053154151 /nfs/dbraw/zinc/15/41/51/1053154151.db2.gz PXYAFXPMPDZMJS-LLVKDONJSA-N 1 2 315.364 4.106 20 0 DIADLO CC(C)Oc1cccc(Nc2ccc(N3CCCC3)[nH+]c2)c1F ZINC001212321806 1053162134 /nfs/dbraw/zinc/16/21/34/1053162134.db2.gz PPFOFFMFSBCDRV-UHFFFAOYSA-N 1 2 315.392 4.352 20 0 DIADLO C[C@@H]([NH2+]Cc1ccccc1CF)c1nc(C2CCCCC2)no1 ZINC001351294143 1053163092 /nfs/dbraw/zinc/16/30/92/1053163092.db2.gz JBBSAFDGFKMZKV-CYBMUJFWSA-N 1 2 317.408 4.438 20 0 DIADLO CC[N@@H+](Cc1ccccc1F)Cn1ccc(-c2cccs2)n1 ZINC001318349103 1053163570 /nfs/dbraw/zinc/16/35/70/1053163570.db2.gz IZLMZFPOIDKRTD-UHFFFAOYSA-N 1 2 315.417 4.230 20 0 DIADLO CC[N@H+](Cc1ccccc1F)Cn1ccc(-c2cccs2)n1 ZINC001318349103 1053163577 /nfs/dbraw/zinc/16/35/77/1053163577.db2.gz IZLMZFPOIDKRTD-UHFFFAOYSA-N 1 2 315.417 4.230 20 0 DIADLO CC(C)c1ccc(/C=C/CC(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC001360225011 1053200590 /nfs/dbraw/zinc/20/05/90/1053200590.db2.gz NCQSIUFBRPYBMT-HWKANZROSA-N 1 2 319.408 4.500 20 0 DIADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC001351619035 1053202791 /nfs/dbraw/zinc/20/27/91/1053202791.db2.gz JCDVHDBGCWJWKS-SFHVURJKSA-N 1 2 306.413 4.055 20 0 DIADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nc(-c2ccccc2)c[nH]1 ZINC001351619035 1053202801 /nfs/dbraw/zinc/20/28/01/1053202801.db2.gz JCDVHDBGCWJWKS-SFHVURJKSA-N 1 2 306.413 4.055 20 0 DIADLO Cn1c2ccccc2[nH+]c1Nc1ccc(Br)cc1F ZINC000150012069 1053228472 /nfs/dbraw/zinc/22/84/72/1053228472.db2.gz MOBGWTSOEAJPDN-UHFFFAOYSA-N 1 2 320.165 4.219 20 0 DIADLO Clc1ccc([C@H]2C[N@H+](CCc3ccccc3)CCO2)s1 ZINC001319396780 1053241231 /nfs/dbraw/zinc/24/12/31/1053241231.db2.gz BNGPVSWDNHRMOF-CQSZACIVSA-N 1 2 307.846 4.018 20 0 DIADLO Clc1ccc([C@H]2C[N@@H+](CCc3ccccc3)CCO2)s1 ZINC001319396780 1053241241 /nfs/dbraw/zinc/24/12/41/1053241241.db2.gz BNGPVSWDNHRMOF-CQSZACIVSA-N 1 2 307.846 4.018 20 0 DIADLO Clc1ccc([C@@H]2C[N@H+](CCc3ccccc3)CCO2)s1 ZINC001319396779 1053242003 /nfs/dbraw/zinc/24/20/03/1053242003.db2.gz BNGPVSWDNHRMOF-AWEZNQCLSA-N 1 2 307.846 4.018 20 0 DIADLO Clc1ccc([C@@H]2C[N@@H+](CCc3ccccc3)CCO2)s1 ZINC001319396779 1053242015 /nfs/dbraw/zinc/24/20/15/1053242015.db2.gz BNGPVSWDNHRMOF-AWEZNQCLSA-N 1 2 307.846 4.018 20 0 DIADLO Cc1cc(NC[C@@](C)(O)c2ccc(F)cc2)[nH+]c2ccccc12 ZINC001319517792 1053248257 /nfs/dbraw/zinc/24/82/57/1053248257.db2.gz NJYATDABDSILJB-LJQANCHMSA-N 1 2 310.372 4.002 20 0 DIADLO Cc1cc(N[C@@H]2CC[C@H]3SCCS[C@H]23)[nH+]c2ccccc12 ZINC001319583212 1053252953 /nfs/dbraw/zinc/25/29/53/1053252953.db2.gz IJYPSGCCDFORNO-BFYDXBDKSA-N 1 2 316.495 4.335 20 0 DIADLO CCCCCc1ccc([C@H]([NH2+]Cc2ncn(C)n2)C(C)C)cc1 ZINC000091409860 1053263551 /nfs/dbraw/zinc/26/35/51/1053263551.db2.gz WLQWDGNZJASDOD-LJQANCHMSA-N 1 2 314.477 4.035 20 0 DIADLO CCCc1nc(C[NH2+]C2(c3ccccc3OC)CCC2)cs1 ZINC001319798131 1053273604 /nfs/dbraw/zinc/27/36/04/1053273604.db2.gz GLOZCXBITTZJMK-UHFFFAOYSA-N 1 2 316.470 4.273 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+](C)Cc1cc2n(n1)CCC2 ZINC000649501018 1053274521 /nfs/dbraw/zinc/27/45/21/1053274521.db2.gz ZAASQDVSCTUMOE-NSHDSACASA-N 1 2 324.255 4.329 20 0 DIADLO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)Cc1cc2n(n1)CCC2 ZINC000649501018 1053274530 /nfs/dbraw/zinc/27/45/30/1053274530.db2.gz ZAASQDVSCTUMOE-NSHDSACASA-N 1 2 324.255 4.329 20 0 DIADLO Cc1cc(NC(=O)c2ccc(C3CCCCC3)cc2)c(C)c[nH+]1 ZINC001127646468 1053276138 /nfs/dbraw/zinc/27/61/38/1053276138.db2.gz PSFHJZUJLKWRHX-UHFFFAOYSA-N 1 2 308.425 4.420 20 0 DIADLO C[C@@H](CC(=O)Nc1cccc(-c2cccs2)c1)n1cc[nH+]c1 ZINC001352163046 1053285847 /nfs/dbraw/zinc/28/58/47/1053285847.db2.gz HGGQHYWYDOAPMC-ZDUSSCGKSA-N 1 2 311.410 4.201 20 0 DIADLO Cc1nc(C[NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)oc1C ZINC000181907384 1053309385 /nfs/dbraw/zinc/30/93/85/1053309385.db2.gz YUCHRLRUDPYBRG-SNVBAGLBSA-N 1 2 314.307 4.041 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+]Cc1ccc([C@@H]3C[C@H]3C)o1)CCC2 ZINC001320370985 1053329732 /nfs/dbraw/zinc/32/97/32/1053329732.db2.gz FRIZDKZFVKEPDA-XYPHTWIQSA-N 1 2 313.445 4.348 20 0 DIADLO Clc1ncccc1CSCc1ccc(-n2cc[nH+]c2)cc1 ZINC001320702966 1053355546 /nfs/dbraw/zinc/35/55/46/1053355546.db2.gz ZIECDOJZGGAABZ-UHFFFAOYSA-N 1 2 315.829 4.354 20 0 DIADLO Cc1nc(CCSCc2ccc(-n3cc[nH+]c3)cc2)cs1 ZINC001320688105 1053356930 /nfs/dbraw/zinc/35/69/30/1053356930.db2.gz YPTSNHUHWNVNKY-UHFFFAOYSA-N 1 2 315.467 4.113 20 0 DIADLO S=C(Nc1cccc2ccccc21)Nc1cccc2[nH+]ccn21 ZINC001200090576 1053373349 /nfs/dbraw/zinc/37/33/49/1053373349.db2.gz AVQPBXRTNREKIO-UHFFFAOYSA-N 1 2 318.405 4.296 20 0 DIADLO C[NH+](C)c1ccc(N[C@@H]2CCCOc3cc(F)ccc32)cc1 ZINC000182210911 1053374795 /nfs/dbraw/zinc/37/47/95/1053374795.db2.gz NOBANQOXZVQSAG-QGZVFWFLSA-N 1 2 300.377 4.218 20 0 DIADLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)Nc1ccc(SC(C)(C)C)cc1 ZINC000847425993 1053395422 /nfs/dbraw/zinc/39/54/22/1053395422.db2.gz BHQHTPLJBAOPIT-LBPRGKRZSA-N 1 2 317.458 4.118 20 0 DIADLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)Nc1ccc(SC(C)(C)C)cc1 ZINC000847425993 1053395439 /nfs/dbraw/zinc/39/54/39/1053395439.db2.gz BHQHTPLJBAOPIT-LBPRGKRZSA-N 1 2 317.458 4.118 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2cnc(C(C)C)s2)CCO1 ZINC000093478316 1053414225 /nfs/dbraw/zinc/41/42/25/1053414225.db2.gz NUUUECASLFFLKD-KRWDZBQOSA-N 1 2 316.470 4.148 20 0 DIADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2cnc(C(C)C)s2)CCO1 ZINC000093478316 1053414228 /nfs/dbraw/zinc/41/42/28/1053414228.db2.gz NUUUECASLFFLKD-KRWDZBQOSA-N 1 2 316.470 4.148 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1ccc(-c2cnn(C)c2)cc1 ZINC001321496292 1053416621 /nfs/dbraw/zinc/41/66/21/1053416621.db2.gz LFQFRZZUVOALLX-UHFFFAOYSA-N 1 2 320.440 4.074 20 0 DIADLO C[C@@H](CCc1ccc(O)cc1)[NH2+][C@@H](c1ccccc1)C(F)F ZINC001474761591 1053430853 /nfs/dbraw/zinc/43/08/53/1053430853.db2.gz BEZRQQNMTHJETO-GUYCJALGSA-N 1 2 305.368 4.309 20 0 DIADLO COc1ccc([C@@H](C)Oc2ccc(-n3cc[nH+]c3)cc2)cc1OC ZINC001229953880 1053438041 /nfs/dbraw/zinc/43/80/41/1053438041.db2.gz FFUHQVSFIRIJFJ-CQSZACIVSA-N 1 2 324.380 4.030 20 0 DIADLO Fc1cc2c(c(F)c1)CC[C@@H]2Oc1ccc(-n2cc[nH+]c2)cc1 ZINC001229954904 1053438149 /nfs/dbraw/zinc/43/81/49/1053438149.db2.gz VXTHOAHGABKSSO-SFHVURJKSA-N 1 2 312.319 4.217 20 0 DIADLO Cc1cccc(OC[C@H](C)Oc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001229954462 1053439143 /nfs/dbraw/zinc/43/91/43/1053439143.db2.gz PGEJVHOIMLGNRP-INIZCTEOSA-N 1 2 308.381 4.027 20 0 DIADLO CCO[C@H](C)c1nc(C[N@H+](C)Cc2cccc(C)c2C)cs1 ZINC000093737366 1053443456 /nfs/dbraw/zinc/44/34/56/1053443456.db2.gz DTKDPCFVAMHCBH-OAHLLOKOSA-N 1 2 318.486 4.489 20 0 DIADLO CCO[C@H](C)c1nc(C[N@@H+](C)Cc2cccc(C)c2C)cs1 ZINC000093737366 1053443465 /nfs/dbraw/zinc/44/34/65/1053443465.db2.gz DTKDPCFVAMHCBH-OAHLLOKOSA-N 1 2 318.486 4.489 20 0 DIADLO Cc1ccc2[nH]c(CNc3ccc(N4CCCC4)c[nH+]3)cc2c1C ZINC000471474999 1053455687 /nfs/dbraw/zinc/45/56/87/1053455687.db2.gz HPIVHDIFEXRXAX-UHFFFAOYSA-N 1 2 320.440 4.392 20 0 DIADLO CCC[C@@H]1CC(=O)N(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)C1 ZINC001322142295 1053462922 /nfs/dbraw/zinc/46/29/22/1053462922.db2.gz VTFUAUFMDUGUFR-RHSMWYFYSA-N 1 2 320.864 4.083 20 0 DIADLO CCC[C@@H]1CC(=O)N(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)C1 ZINC001322142295 1053462930 /nfs/dbraw/zinc/46/29/30/1053462930.db2.gz VTFUAUFMDUGUFR-RHSMWYFYSA-N 1 2 320.864 4.083 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2C/C(Cl)=C/Cl)cc1OC ZINC000763551245 1053469499 /nfs/dbraw/zinc/46/94/99/1053469499.db2.gz CETLNMMLAIZYPC-KIWPFMIBSA-N 1 2 316.228 4.160 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2C/C(Cl)=C/Cl)cc1OC ZINC000763551245 1053469512 /nfs/dbraw/zinc/46/95/12/1053469512.db2.gz CETLNMMLAIZYPC-KIWPFMIBSA-N 1 2 316.228 4.160 20 0 DIADLO COc1ccc(-c2nc(C[NH2+]Cc3ccoc3C)cs2)cc1 ZINC000619766513 1053552268 /nfs/dbraw/zinc/55/22/68/1053552268.db2.gz RAMMPCLSQRJLER-UHFFFAOYSA-N 1 2 314.410 4.010 20 0 DIADLO Cc1c([C@@H](C)Nc2ccc(C)[nH+]c2C)cnn1-c1ccccc1 ZINC001323507845 1053586822 /nfs/dbraw/zinc/58/68/22/1053586822.db2.gz ZJJQKZRIMZKVPU-CQSZACIVSA-N 1 2 306.413 4.366 20 0 DIADLO CC(C)c1ccc(CN2CC[NH+]([C@@H](C)c3ccncc3)CC2)cc1 ZINC000619969696 1053588472 /nfs/dbraw/zinc/58/84/72/1053588472.db2.gz FFJXHIWDIQUHER-SFHVURJKSA-N 1 2 323.484 4.084 20 0 DIADLO FC1(F)CCC[C@H]1[NH2+]Cc1c[nH]nc1-c1ccc(Cl)cc1 ZINC001323676583 1053594095 /nfs/dbraw/zinc/59/40/95/1053594095.db2.gz GZBATQBUYVQOOF-CYBMUJFWSA-N 1 2 311.763 4.008 20 0 DIADLO Cc1nnsc1C[NH2+]Cc1c(Cl)ccc(Cl)c1Cl ZINC000384303754 1053599004 /nfs/dbraw/zinc/59/90/04/1053599004.db2.gz ZTKKAPXBXZGGBO-UHFFFAOYSA-N 1 2 322.648 4.097 20 0 DIADLO Cc1cc2c(cc1N[C@H](C)c1ccc(-n3cc[nH+]c3)cc1)OCO2 ZINC000183171613 1053599399 /nfs/dbraw/zinc/59/93/99/1053599399.db2.gz NKJIOHBFYGBGCJ-CQSZACIVSA-N 1 2 321.380 4.083 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@H](C)Cc2ccc(C(C)C)cc2)c(C)[nH+]1 ZINC001435569547 1053604171 /nfs/dbraw/zinc/60/41/71/1053604171.db2.gz IUYXVWVLQGYHDD-MRXNPFEDSA-N 1 2 324.468 4.491 20 0 DIADLO COc1ccccc1C1([NH2+][C@H](C)c2csc(C)n2)CCC1 ZINC001323997382 1053615699 /nfs/dbraw/zinc/61/56/99/1053615699.db2.gz NLBAOXXGRMMKEY-GFCCVEGCSA-N 1 2 302.443 4.190 20 0 DIADLO Oc1cc2c(cc1O[C@@H]1CCc3cc(Cl)ccc31)CC[NH+]=C2 ZINC001230920227 1053625250 /nfs/dbraw/zinc/62/52/50/1053625250.db2.gz KFDDUSDWGVVVCM-QGZVFWFLSA-N 1 2 313.784 4.087 20 0 DIADLO Cc1ccc(NC(=O)C[C@H]2C[C@@H](C)CC(C)(C)C2)c(N(C)C)[nH+]1 ZINC001435646244 1053628428 /nfs/dbraw/zinc/62/84/28/1053628428.db2.gz VDAJANGWFJPVKX-UKRRQHHQSA-N 1 2 317.477 4.247 20 0 DIADLO Cc1cc(NC(=O)[C@@H](C)n2cc[nH+]c2)ccc1-c1ccccc1 ZINC001324127752 1053628874 /nfs/dbraw/zinc/62/88/74/1053628874.db2.gz HCBXARSEQMXHRM-OAHLLOKOSA-N 1 2 305.381 4.058 20 0 DIADLO CC(C)(C)C[C@H](NC(=O)c1cccc2[nH+]ccn21)c1ccccc1 ZINC001353675310 1053638986 /nfs/dbraw/zinc/63/89/86/1053638986.db2.gz OAGBFLPYYOMFCT-INIZCTEOSA-N 1 2 321.424 4.242 20 0 DIADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2nc3c(s2)C[C@H](C)CC3)o1 ZINC001324643161 1053667163 /nfs/dbraw/zinc/66/71/63/1053667163.db2.gz UPXLXFKCMIKXSU-MBNYWOFBSA-N 1 2 316.470 4.274 20 0 DIADLO COc1ccc(OC)c([C@@H](C)Oc2ccc(-c3[nH]cc[nH+]3)cc2)c1 ZINC001231081249 1053668502 /nfs/dbraw/zinc/66/85/02/1053668502.db2.gz KBEJMVVWWPNIQT-CYBMUJFWSA-N 1 2 324.380 4.234 20 0 DIADLO Cc1cc(NC(=O)c2ccc(-c3ccccc3)s2)c(C)c[nH+]1 ZINC001324657209 1053668963 /nfs/dbraw/zinc/66/89/63/1053668963.db2.gz NAPQYIIBWODWBE-UHFFFAOYSA-N 1 2 308.406 4.101 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(O[C@@H]2CCc3cc(F)ccc32)cc1 ZINC001231083220 1053671771 /nfs/dbraw/zinc/67/17/71/1053671771.db2.gz GGIRYPYCQFFVCW-LJQANCHMSA-N 1 2 308.356 4.293 20 0 DIADLO COC(=O)c1ccc([C@@H](C)Oc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001231083040 1053672137 /nfs/dbraw/zinc/67/21/37/1053672137.db2.gz AYBHCJALUFJRQD-CYBMUJFWSA-N 1 2 322.364 4.003 20 0 DIADLO C[C@@H](COCc1ccccc1)Oc1ccc(-c2c[nH+]cn2C)cc1 ZINC001231084045 1053672271 /nfs/dbraw/zinc/67/22/71/1053672271.db2.gz UVMRGLCUTWKHQB-INIZCTEOSA-N 1 2 322.408 4.071 20 0 DIADLO CCOc1ccc(CNc2[nH+]cccc2OC(C)C)cc1F ZINC001324793217 1053679933 /nfs/dbraw/zinc/67/99/33/1053679933.db2.gz KVDMTWNZXZJFAY-UHFFFAOYSA-N 1 2 304.365 4.019 20 0 DIADLO CC(C)c1ocnc1C[NH2+][C@@H](C)c1ccccc1OC(F)F ZINC001324887844 1053684623 /nfs/dbraw/zinc/68/46/23/1053684623.db2.gz PWQYDWCVBSHZPE-NSHDSACASA-N 1 2 310.344 4.250 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CC[C@H]3CCCC[C@@H]3C2)c(C)[nH+]1 ZINC001353885104 1053696852 /nfs/dbraw/zinc/69/68/52/1053696852.db2.gz HGOFREMJRWVCTP-BRWVUGGUSA-N 1 2 300.446 4.096 20 0 DIADLO Fc1cc2[nH+]ccc(N3CC[C@@H]4OCCC[C@H]4C3)c2cc1Cl ZINC001325182745 1053704532 /nfs/dbraw/zinc/70/45/32/1053704532.db2.gz VWJGGGJSVONXMC-GTNSWQLSSA-N 1 2 320.795 4.033 20 0 DIADLO Cc1cccc2[nH]c(C[NH2+]Cc3ccc(-c4ccccc4)o3)nc21 ZINC000153656255 1053705089 /nfs/dbraw/zinc/70/50/89/1053705089.db2.gz NDMAGZQOISYFKM-UHFFFAOYSA-N 1 2 317.392 4.421 20 0 DIADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nc(C3CCCC3)no2)s1 ZINC000153762128 1053714041 /nfs/dbraw/zinc/71/40/41/1053714041.db2.gz ZGJNNEQUAMIBLP-CQSZACIVSA-N 1 2 317.458 4.434 20 0 DIADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2nc(C3CCCC3)no2)s1 ZINC000153762128 1053714055 /nfs/dbraw/zinc/71/40/55/1053714055.db2.gz ZGJNNEQUAMIBLP-CQSZACIVSA-N 1 2 317.458 4.434 20 0 DIADLO CC(C)CCc1nc(C[N@@H+]2CCC[C@H]2c2ccncc2)cs1 ZINC000153893141 1053718163 /nfs/dbraw/zinc/71/81/63/1053718163.db2.gz GORAFMFNJOQFEV-KRWDZBQOSA-N 1 2 315.486 4.464 20 0 DIADLO CC(C)CCc1nc(C[N@H+]2CCC[C@H]2c2ccncc2)cs1 ZINC000153893141 1053718171 /nfs/dbraw/zinc/71/81/71/1053718171.db2.gz GORAFMFNJOQFEV-KRWDZBQOSA-N 1 2 315.486 4.464 20 0 DIADLO CC[N@H+](Cc1cccc(Cl)c1)[C@@H](C)c1nc(C(C)C)no1 ZINC000154034509 1053724469 /nfs/dbraw/zinc/72/44/69/1053724469.db2.gz FRWQIIXFHCMLOW-LBPRGKRZSA-N 1 2 307.825 4.430 20 0 DIADLO CC[N@@H+](Cc1cccc(Cl)c1)[C@@H](C)c1nc(C(C)C)no1 ZINC000154034509 1053724486 /nfs/dbraw/zinc/72/44/86/1053724486.db2.gz FRWQIIXFHCMLOW-LBPRGKRZSA-N 1 2 307.825 4.430 20 0 DIADLO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2noc(C3CCCCC3)n2)C1 ZINC000154153438 1053728454 /nfs/dbraw/zinc/72/84/54/1053728454.db2.gz CYDDYVGZTOHUJR-HUUCEWRRSA-N 1 2 323.506 4.223 20 0 DIADLO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2noc(C3CCCCC3)n2)C1 ZINC000154153438 1053728459 /nfs/dbraw/zinc/72/84/59/1053728459.db2.gz CYDDYVGZTOHUJR-HUUCEWRRSA-N 1 2 323.506 4.223 20 0 DIADLO Cc1ccc2nc(CNc3cc(C)c4ccccc4[nH+]3)cn2c1 ZINC001325883401 1053739627 /nfs/dbraw/zinc/73/96/27/1053739627.db2.gz FUUILXHQSYPWIQ-UHFFFAOYSA-N 1 2 302.381 4.111 20 0 DIADLO Clc1cc(OC2C[NH+](Cc3ccccc3)C2)cc2cccnc12 ZINC001231385508 1053740895 /nfs/dbraw/zinc/74/08/95/1053740895.db2.gz AGJNIZJZNFUNDU-UHFFFAOYSA-N 1 2 324.811 4.151 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1)Cc1c(F)ccc(F)c1OC ZINC001231414124 1053746717 /nfs/dbraw/zinc/74/67/17/1053746717.db2.gz GKSNXLSTVVCTGI-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1)Cc1c(F)ccc(F)c1OC ZINC001231414124 1053746723 /nfs/dbraw/zinc/74/67/23/1053746723.db2.gz GKSNXLSTVVCTGI-UHFFFAOYSA-N 1 2 321.367 4.004 20 0 DIADLO COc1c(F)ccc(F)c1C[N@H+](C)C/C=C/c1ccccc1 ZINC001231414414 1053746747 /nfs/dbraw/zinc/74/67/47/1053746747.db2.gz SHHCUYDAKMYEMI-RMKNXTFCSA-N 1 2 303.352 4.119 20 0 DIADLO COc1c(F)ccc(F)c1C[N@@H+](C)C/C=C/c1ccccc1 ZINC001231414414 1053746755 /nfs/dbraw/zinc/74/67/55/1053746755.db2.gz SHHCUYDAKMYEMI-RMKNXTFCSA-N 1 2 303.352 4.119 20 0 DIADLO CC[N@H+](Cc1nnc(C)n1C1CC1)[C@H](C)c1cc2ccccc2o1 ZINC000154964885 1053755179 /nfs/dbraw/zinc/75/51/79/1053755179.db2.gz AQGMZQTXXIPJPC-CYBMUJFWSA-N 1 2 324.428 4.251 20 0 DIADLO CC[N@@H+](Cc1nnc(C)n1C1CC1)[C@H](C)c1cc2ccccc2o1 ZINC000154964885 1053755190 /nfs/dbraw/zinc/75/51/90/1053755190.db2.gz AQGMZQTXXIPJPC-CYBMUJFWSA-N 1 2 324.428 4.251 20 0 DIADLO Cc1cc(CNC(=O)Nc2c(C)cc(Cl)cc2C)cc(C)[nH+]1 ZINC001326212838 1053763275 /nfs/dbraw/zinc/76/32/75/1053763275.db2.gz DKFVYIFITPWTIP-UHFFFAOYSA-N 1 2 317.820 4.290 20 0 DIADLO CC[N@H+](CCC(=O)OC)Cc1c(Cl)ccc(Cl)c1Cl ZINC001231481915 1053764962 /nfs/dbraw/zinc/76/49/62/1053764962.db2.gz UGYXOXZWWVRQEG-UHFFFAOYSA-N 1 2 324.635 4.032 20 0 DIADLO CC[N@@H+](CCC(=O)OC)Cc1c(Cl)ccc(Cl)c1Cl ZINC001231481915 1053764974 /nfs/dbraw/zinc/76/49/74/1053764974.db2.gz UGYXOXZWWVRQEG-UHFFFAOYSA-N 1 2 324.635 4.032 20 0 DIADLO CCc1nc([C@H](C)[NH2+]Cc2cc3cc(F)ccc3o2)cs1 ZINC001200572842 1053777046 /nfs/dbraw/zinc/77/70/46/1053777046.db2.gz SJXVNFWIXRRDNS-JTQLQIEISA-N 1 2 304.390 4.442 20 0 DIADLO CC(C)Oc1ccc(C[N@@H+]2CCc3cc(Cl)ccc3C2)cn1 ZINC001231536656 1053779739 /nfs/dbraw/zinc/77/97/39/1053779739.db2.gz VZDYIDFCEGKJLN-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO CC(C)Oc1ccc(C[N@H+]2CCc3cc(Cl)ccc3C2)cn1 ZINC001231536656 1053779742 /nfs/dbraw/zinc/77/97/42/1053779742.db2.gz VZDYIDFCEGKJLN-UHFFFAOYSA-N 1 2 316.832 4.081 20 0 DIADLO C[C@@H]1C[NH+](Cc2ccc(F)c(Oc3ccccc3)c2)C[C@@H](C)O1 ZINC001231536250 1053781217 /nfs/dbraw/zinc/78/12/17/1053781217.db2.gz GATDSCNOALCYNK-HUUCEWRRSA-N 1 2 315.388 4.227 20 0 DIADLO Oc1ccc(C[N@H+](Cc2ccco2)Cc2cccn2C2CC2)cc1 ZINC001326429579 1053781324 /nfs/dbraw/zinc/78/13/24/1053781324.db2.gz HXDNVPVRAGXOLE-UHFFFAOYSA-N 1 2 322.408 4.324 20 0 DIADLO Oc1ccc(C[N@@H+](Cc2ccco2)Cc2cccn2C2CC2)cc1 ZINC001326429579 1053781342 /nfs/dbraw/zinc/78/13/42/1053781342.db2.gz HXDNVPVRAGXOLE-UHFFFAOYSA-N 1 2 322.408 4.324 20 0 DIADLO Fc1c(Cl)cccc1C[NH2+]Cc1c(Cl)n[nH]c1C1CC1 ZINC001354159635 1053783718 /nfs/dbraw/zinc/78/37/18/1053783718.db2.gz BOSGEGFPLAZYAI-UHFFFAOYSA-N 1 2 314.191 4.023 20 0 DIADLO CC[N@H+](Cc1ccc(OC(C)C)nc1)Cc1cccc(F)c1F ZINC001231536912 1053783921 /nfs/dbraw/zinc/78/39/21/1053783921.db2.gz GGWPGLZWXXVJQK-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO CC[N@@H+](Cc1ccc(OC(C)C)nc1)Cc1cccc(F)c1F ZINC001231536912 1053783924 /nfs/dbraw/zinc/78/39/24/1053783924.db2.gz GGWPGLZWXXVJQK-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cc(Br)c[nH]1 ZINC001231576325 1053785228 /nfs/dbraw/zinc/78/52/28/1053785228.db2.gz ADVPGKXUVLBYAC-INIZCTEOSA-N 1 2 319.246 4.287 20 0 DIADLO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(Br)c[nH]1 ZINC001231576325 1053785229 /nfs/dbraw/zinc/78/52/29/1053785229.db2.gz ADVPGKXUVLBYAC-INIZCTEOSA-N 1 2 319.246 4.287 20 0 DIADLO COc1cc(F)ccc1C[N@@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001231603106 1053798729 /nfs/dbraw/zinc/79/87/29/1053798729.db2.gz GQIUWZBWZJZSBY-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1cc(F)ccc1C[N@H+]1CCC[C@H]1c1cc(F)ccc1F ZINC001231603106 1053798739 /nfs/dbraw/zinc/79/87/39/1053798739.db2.gz GQIUWZBWZJZSBY-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO CC[N@H+](Cc1cccc(F)c1F)Cc1ccc(F)cc1OC ZINC001231605243 1053801727 /nfs/dbraw/zinc/80/17/27/1053801727.db2.gz CCCANVWGSCKPMX-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO CC[N@@H+](Cc1cccc(F)c1F)Cc1ccc(F)cc1OC ZINC001231605243 1053801746 /nfs/dbraw/zinc/80/17/46/1053801746.db2.gz CCCANVWGSCKPMX-UHFFFAOYSA-N 1 2 309.331 4.135 20 0 DIADLO Cc1ccc(N[C@H](C)c2cccc(Br)n2)c(C)[nH+]1 ZINC001354238854 1053805639 /nfs/dbraw/zinc/80/56/39/1053805639.db2.gz ZOUYZRHVQWDGLE-LLVKDONJSA-N 1 2 306.207 4.029 20 0 DIADLO COc1cc(C)c(C[N@H+](C)Cc2cscn2)cc1C(C)C ZINC001231629393 1053809388 /nfs/dbraw/zinc/80/93/88/1053809388.db2.gz VPRSRGRMFGVDPB-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO COc1cc(C)c(C[N@@H+](C)Cc2cscn2)cc1C(C)C ZINC001231629393 1053809392 /nfs/dbraw/zinc/80/93/92/1053809392.db2.gz VPRSRGRMFGVDPB-UHFFFAOYSA-N 1 2 304.459 4.216 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2coc(-c3ccccc3)n2)cn1 ZINC001231632373 1053811076 /nfs/dbraw/zinc/81/10/76/1053811076.db2.gz PGERBVIJIOPAPV-IBGZPJMESA-N 1 2 319.408 4.382 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2coc(-c3ccccc3)n2)cn1 ZINC001231632373 1053811083 /nfs/dbraw/zinc/81/10/83/1053811083.db2.gz PGERBVIJIOPAPV-IBGZPJMESA-N 1 2 319.408 4.382 20 0 DIADLO Cc1sc2ccccc2c1C[N@@H+]1CCOC[C@H]1c1cccnc1 ZINC001231649900 1053816419 /nfs/dbraw/zinc/81/64/19/1053816419.db2.gz STWVUCNZBIDTKA-SFHVURJKSA-N 1 2 324.449 4.178 20 0 DIADLO Cc1sc2ccccc2c1C[N@H+]1CCOC[C@H]1c1cccnc1 ZINC001231649900 1053816436 /nfs/dbraw/zinc/81/64/36/1053816436.db2.gz STWVUCNZBIDTKA-SFHVURJKSA-N 1 2 324.449 4.178 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)cn1 ZINC001231654531 1053822162 /nfs/dbraw/zinc/82/21/62/1053822162.db2.gz PXWPTOCHQWNLFM-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)cn1 ZINC001231654531 1053822181 /nfs/dbraw/zinc/82/21/81/1053822181.db2.gz PXWPTOCHQWNLFM-QGZVFWFLSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cc(Cl)c(C[N@@H+]2CC[C@@H]2c2ccccc2)c(OC)c1 ZINC001231699116 1053839126 /nfs/dbraw/zinc/83/91/26/1053839126.db2.gz ILNBEKXANQXKQV-QGZVFWFLSA-N 1 2 317.816 4.304 20 0 DIADLO COc1cc(Cl)c(C[N@H+]2CC[C@@H]2c2ccccc2)c(OC)c1 ZINC001231699116 1053839143 /nfs/dbraw/zinc/83/91/43/1053839143.db2.gz ILNBEKXANQXKQV-QGZVFWFLSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1nc(C)c2ccccc2n1 ZINC000157186464 1053844913 /nfs/dbraw/zinc/84/49/13/1053844913.db2.gz SGZJUUSFYUSSFY-CQSZACIVSA-N 1 2 321.424 4.106 20 0 DIADLO CCOc1ncccc1C[N@H+](C)[C@H](C)c1ccccc1Cl ZINC001231765951 1053851832 /nfs/dbraw/zinc/85/18/32/1053851832.db2.gz PAEKVDUGTNQXRJ-CYBMUJFWSA-N 1 2 304.821 4.327 20 0 DIADLO CCOc1ncccc1C[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC001231765951 1053851841 /nfs/dbraw/zinc/85/18/41/1053851841.db2.gz PAEKVDUGTNQXRJ-CYBMUJFWSA-N 1 2 304.821 4.327 20 0 DIADLO C[C@@H](c1ccco1)[N@H+](C)Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC000157605858 1053858222 /nfs/dbraw/zinc/85/82/22/1053858222.db2.gz QSMNABSKOWOPLN-JTQLQIEISA-N 1 2 324.211 4.427 20 0 DIADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC000157605858 1053858233 /nfs/dbraw/zinc/85/82/33/1053858233.db2.gz QSMNABSKOWOPLN-JTQLQIEISA-N 1 2 324.211 4.427 20 0 DIADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2sc(C(C)(C)C)nc2C)s1 ZINC000274263698 1053861578 /nfs/dbraw/zinc/86/15/78/1053861578.db2.gz VIFVHOMLIGYRMU-SCZZXKLOSA-N 1 2 324.519 4.321 20 0 DIADLO CC[C@@H](C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccc(F)cc1 ZINC000157658044 1053862422 /nfs/dbraw/zinc/86/24/22/1053862422.db2.gz LAYQKJGRBSQOQT-GOSISDBHSA-N 1 2 323.371 4.144 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1ccc(OC(C)(C)C)cc1 ZINC001231805627 1053864409 /nfs/dbraw/zinc/86/44/09/1053864409.db2.gz QGKLZGDIIQXEKK-AWEZNQCLSA-N 1 2 321.461 4.026 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1ccc(OC(C)(C)C)cc1 ZINC001231805627 1053864423 /nfs/dbraw/zinc/86/44/23/1053864423.db2.gz QGKLZGDIIQXEKK-AWEZNQCLSA-N 1 2 321.461 4.026 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1ccc(-c2ccccc2)o1 ZINC001231813617 1053873161 /nfs/dbraw/zinc/87/31/61/1053873161.db2.gz NVMCVRDTHHDWMZ-UHFFFAOYSA-N 1 2 305.377 4.261 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1ccc(-c2ccccc2)o1 ZINC001231813617 1053873168 /nfs/dbraw/zinc/87/31/68/1053873168.db2.gz NVMCVRDTHHDWMZ-UHFFFAOYSA-N 1 2 305.377 4.261 20 0 DIADLO Cc1cc(OCc2ccccc2)ccc1C[N@H+]1CCC(=O)C[C@@H]1C ZINC001231848186 1053892239 /nfs/dbraw/zinc/89/22/39/1053892239.db2.gz YNBFDZMEUSNHGS-KRWDZBQOSA-N 1 2 323.436 4.127 20 0 DIADLO Cc1cc(OCc2ccccc2)ccc1C[N@@H+]1CCC(=O)C[C@@H]1C ZINC001231848186 1053892260 /nfs/dbraw/zinc/89/22/60/1053892260.db2.gz YNBFDZMEUSNHGS-KRWDZBQOSA-N 1 2 323.436 4.127 20 0 DIADLO Fc1cccc(Oc2ccccc2)c1C[NH+]1CC2(CSC2)C1 ZINC001231868993 1053896727 /nfs/dbraw/zinc/89/67/27/1053896727.db2.gz LCGQRIGSVVEXSZ-UHFFFAOYSA-N 1 2 315.413 4.167 20 0 DIADLO COC(C)(C)[C@@H](C)Nc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000671122238 1053898453 /nfs/dbraw/zinc/89/84/53/1053898453.db2.gz AXABVULCFBAEKW-CQSZACIVSA-N 1 2 313.445 4.112 20 0 DIADLO CC1(C)C2CCC1(C(=O)Nc1cccc(-n3cc[nH+]c3)c1)CC2 ZINC001354540872 1053901924 /nfs/dbraw/zinc/90/19/24/1053901924.db2.gz ACKKXMOMKIECBK-UHFFFAOYSA-N 1 2 309.413 4.027 20 0 DIADLO FC(F)c1cc(C[N@@H+]2CCSc3ccccc3C2)ccn1 ZINC001231891417 1053904323 /nfs/dbraw/zinc/90/43/23/1053904323.db2.gz HOIMHRQIKWJUDE-UHFFFAOYSA-N 1 2 306.381 4.127 20 0 DIADLO FC(F)c1cc(C[N@H+]2CCSc3ccccc3C2)ccn1 ZINC001231891417 1053904334 /nfs/dbraw/zinc/90/43/34/1053904334.db2.gz HOIMHRQIKWJUDE-UHFFFAOYSA-N 1 2 306.381 4.127 20 0 DIADLO COc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C)sc2C)c(OC)c1 ZINC000315435147 1053906041 /nfs/dbraw/zinc/90/60/41/1053906041.db2.gz KYFAEUDXHFEJQZ-WDEREUQCSA-N 1 2 320.458 4.189 20 0 DIADLO C/C(=C/C(=O)Nc1ccn2cc[nH+]c2c1)c1ccccc1Cl ZINC001436594789 1053914806 /nfs/dbraw/zinc/91/48/06/1053914806.db2.gz AQOUJGJRUSGXJS-BENRWUELSA-N 1 2 311.772 4.030 20 0 DIADLO COc1ccnc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)s2)c1 ZINC001231968905 1053927422 /nfs/dbraw/zinc/92/74/22/1053927422.db2.gz IQBQKJCVMBZPRG-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO COc1ccnc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)c1 ZINC001231968905 1053927432 /nfs/dbraw/zinc/92/74/32/1053927432.db2.gz IQBQKJCVMBZPRG-CYBMUJFWSA-N 1 2 308.834 4.142 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001231985929 1053928748 /nfs/dbraw/zinc/92/87/48/1053928748.db2.gz WBAJVPSIDDKXGY-HNNXBMFYSA-N 1 2 306.331 4.144 20 0 DIADLO Cc1cc(F)ncc1C[N@H+]1CCC[C@H]1c1c(F)cccc1F ZINC001231985929 1053928764 /nfs/dbraw/zinc/92/87/64/1053928764.db2.gz WBAJVPSIDDKXGY-HNNXBMFYSA-N 1 2 306.331 4.144 20 0 DIADLO CCC[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccccn1 ZINC000159028381 1053930356 /nfs/dbraw/zinc/93/03/56/1053930356.db2.gz MIJOTEAJVAVDAT-ZDUSSCGKSA-N 1 2 303.475 4.467 20 0 DIADLO C[C@H]1CC[N@H+](Cc2cc(C(F)(F)F)cnc2Cl)[C@@H](C)C1 ZINC001232009939 1053939825 /nfs/dbraw/zinc/93/98/25/1053939825.db2.gz WMTREAUSQKVHDF-UWVGGRQHSA-N 1 2 306.759 4.374 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2cc(C(F)(F)F)cnc2Cl)[C@@H](C)C1 ZINC001232009939 1053939834 /nfs/dbraw/zinc/93/98/34/1053939834.db2.gz WMTREAUSQKVHDF-UWVGGRQHSA-N 1 2 306.759 4.374 20 0 DIADLO CCCCc1noc(C[N@H+](C)[C@@H](C)c2cc(C)ccc2C)n1 ZINC000621281406 1053934007 /nfs/dbraw/zinc/93/40/07/1053934007.db2.gz JRVRTBSSDGADIH-HNNXBMFYSA-N 1 2 301.434 4.222 20 0 DIADLO CCCCc1noc(C[N@@H+](C)[C@@H](C)c2cc(C)ccc2C)n1 ZINC000621281406 1053934019 /nfs/dbraw/zinc/93/40/19/1053934019.db2.gz JRVRTBSSDGADIH-HNNXBMFYSA-N 1 2 301.434 4.222 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)C[N@H+](Cc1ccco1)C(C)C ZINC000621273508 1053940105 /nfs/dbraw/zinc/94/01/05/1053940105.db2.gz VEWDSMXVGLVWJU-UHFFFAOYSA-N 1 2 320.820 4.091 20 0 DIADLO Cc1ccc(Cl)cc1NC(=O)C[N@@H+](Cc1ccco1)C(C)C ZINC000621273508 1053940122 /nfs/dbraw/zinc/94/01/22/1053940122.db2.gz VEWDSMXVGLVWJU-UHFFFAOYSA-N 1 2 320.820 4.091 20 0 DIADLO Cc1c[nH+]c(CCSCc2cnc3ccccc3n2)c(C)c1 ZINC001328588183 1053941462 /nfs/dbraw/zinc/94/14/62/1053941462.db2.gz WULDIWBTYFLXEF-UHFFFAOYSA-N 1 2 309.438 4.118 20 0 DIADLO CCCC[N@H+](Cc1noc(CCC)n1)[C@@H](C)c1ccccc1 ZINC000621301447 1053945498 /nfs/dbraw/zinc/94/54/98/1053945498.db2.gz ABQCXTZVUMLSLF-HNNXBMFYSA-N 1 2 301.434 4.385 20 0 DIADLO CCCC[N@@H+](Cc1noc(CCC)n1)[C@@H](C)c1ccccc1 ZINC000621301447 1053945510 /nfs/dbraw/zinc/94/55/10/1053945510.db2.gz ABQCXTZVUMLSLF-HNNXBMFYSA-N 1 2 301.434 4.385 20 0 DIADLO CSc1ccc(F)cc1C[NH2+]Cc1nc2cc(F)ccc2o1 ZINC001200760410 1053948775 /nfs/dbraw/zinc/94/87/75/1053948775.db2.gz DXCGMIZSKYVVIN-UHFFFAOYSA-N 1 2 320.364 4.118 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cccc(C(F)(F)F)n1 ZINC001232073148 1053953792 /nfs/dbraw/zinc/95/37/92/1053953792.db2.gz BYACUIGOICTFTQ-LBPRGKRZSA-N 1 2 306.331 4.047 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cccc(C(F)(F)F)n1 ZINC001232073148 1053953805 /nfs/dbraw/zinc/95/38/05/1053953805.db2.gz BYACUIGOICTFTQ-LBPRGKRZSA-N 1 2 306.331 4.047 20 0 DIADLO CN(C)c1[nH+]cccc1/C=C\c1nc(-c2ccccc2)cs1 ZINC001328936785 1053957150 /nfs/dbraw/zinc/95/71/50/1053957150.db2.gz XSDWXGYGELRERH-KHPPLWFESA-N 1 2 307.422 4.442 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2c(Cl)oc3ccccc32)c[nH+]1 ZINC001436737220 1053960547 /nfs/dbraw/zinc/96/05/47/1053960547.db2.gz TVCVBRSAOPVMAB-UHFFFAOYSA-N 1 2 314.772 4.028 20 0 DIADLO CC(C)C[N@H+](Cc1ncnn1C(C)C)Cc1cccc(Cl)c1 ZINC000621386886 1053964131 /nfs/dbraw/zinc/96/41/31/1053964131.db2.gz LNIFHSRPEAJCAA-UHFFFAOYSA-N 1 2 320.868 4.171 20 0 DIADLO CC(C)C[N@@H+](Cc1ncnn1C(C)C)Cc1cccc(Cl)c1 ZINC000621386886 1053964143 /nfs/dbraw/zinc/96/41/43/1053964143.db2.gz LNIFHSRPEAJCAA-UHFFFAOYSA-N 1 2 320.868 4.171 20 0 DIADLO Fc1cc(F)c(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c(Cl)c1 ZINC001232102518 1053966454 /nfs/dbraw/zinc/96/64/54/1053966454.db2.gz VJMASMFNMVWBPV-CQSZACIVSA-N 1 2 323.770 4.272 20 0 DIADLO Fc1cc(F)c(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c(Cl)c1 ZINC001232102518 1053966462 /nfs/dbraw/zinc/96/64/62/1053966462.db2.gz VJMASMFNMVWBPV-CQSZACIVSA-N 1 2 323.770 4.272 20 0 DIADLO O=c1[nH]c2ccccc2cc1C[NH2+][C@H](C(F)F)C1CCCCC1 ZINC000621403926 1053968956 /nfs/dbraw/zinc/96/89/56/1053968956.db2.gz CNUVTLHCMXGVAC-INIZCTEOSA-N 1 2 320.383 4.244 20 0 DIADLO Cn1cc(C[N@H+](C)Cc2cccc(Cl)c2Cl)c(C2CC2)n1 ZINC001232170401 1053978568 /nfs/dbraw/zinc/97/85/68/1053978568.db2.gz UMWZKYIVHGRWCE-UHFFFAOYSA-N 1 2 324.255 4.236 20 0 DIADLO Cn1cc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)c(C2CC2)n1 ZINC001232170401 1053978581 /nfs/dbraw/zinc/97/85/81/1053978581.db2.gz UMWZKYIVHGRWCE-UHFFFAOYSA-N 1 2 324.255 4.236 20 0 DIADLO CC(=O)Nc1ccc(C[N@@H+]2Cc3cccc(Cl)c3C2)c(C)c1 ZINC001232187621 1053983815 /nfs/dbraw/zinc/98/38/15/1053983815.db2.gz OFBKAEDUIVJMAL-UHFFFAOYSA-N 1 2 314.816 4.123 20 0 DIADLO CC(=O)Nc1ccc(C[N@H+]2Cc3cccc(Cl)c3C2)c(C)c1 ZINC001232187621 1053983823 /nfs/dbraw/zinc/98/38/23/1053983823.db2.gz OFBKAEDUIVJMAL-UHFFFAOYSA-N 1 2 314.816 4.123 20 0 DIADLO CCOc1cncc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)c1 ZINC000621728270 1054000505 /nfs/dbraw/zinc/00/05/05/1054000505.db2.gz IYAKEMVJRFBHTM-INIZCTEOSA-N 1 2 302.443 4.125 20 0 DIADLO CCOc1cncc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)c1 ZINC000621728270 1054000514 /nfs/dbraw/zinc/00/05/14/1054000514.db2.gz IYAKEMVJRFBHTM-INIZCTEOSA-N 1 2 302.443 4.125 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCSc3ccccc3C2)ccn1 ZINC001232242842 1054002920 /nfs/dbraw/zinc/00/29/20/1054002920.db2.gz GFKQRLQDXBAFCA-UHFFFAOYSA-N 1 2 324.371 4.208 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCSc3ccccc3C2)ccn1 ZINC001232242842 1054002927 /nfs/dbraw/zinc/00/29/27/1054002927.db2.gz GFKQRLQDXBAFCA-UHFFFAOYSA-N 1 2 324.371 4.208 20 0 DIADLO CCC[N@H+](Cc1cn2cc(C)ccc2n1)Cc1ccccc1F ZINC000621735087 1054004760 /nfs/dbraw/zinc/00/47/60/1054004760.db2.gz ZMMXGQSWRNAUGS-UHFFFAOYSA-N 1 2 311.404 4.194 20 0 DIADLO CCC[N@@H+](Cc1cn2cc(C)ccc2n1)Cc1ccccc1F ZINC000621735087 1054004774 /nfs/dbraw/zinc/00/47/74/1054004774.db2.gz ZMMXGQSWRNAUGS-UHFFFAOYSA-N 1 2 311.404 4.194 20 0 DIADLO CCC[N@H+](Cc1cn2cccc(C)c2n1)Cc1ccccc1F ZINC000621735059 1054004944 /nfs/dbraw/zinc/00/49/44/1054004944.db2.gz UOKXCEYORIBSPU-UHFFFAOYSA-N 1 2 311.404 4.194 20 0 DIADLO CCC[N@@H+](Cc1cn2cccc(C)c2n1)Cc1ccccc1F ZINC000621735059 1054004956 /nfs/dbraw/zinc/00/49/56/1054004956.db2.gz UOKXCEYORIBSPU-UHFFFAOYSA-N 1 2 311.404 4.194 20 0 DIADLO CC(C)(C)c1cnc(C[NH+]2CC(Cc3ccsc3)C2)s1 ZINC000621741285 1054006535 /nfs/dbraw/zinc/00/65/35/1054006535.db2.gz LBJLWJJCECYWOG-UHFFFAOYSA-N 1 2 306.500 4.177 20 0 DIADLO Cc1sc(C[NH+]2CC3(C2)CC(F)(F)C3)cc1Br ZINC001232289022 1054014649 /nfs/dbraw/zinc/01/46/49/1054014649.db2.gz GHZGCCDIKFKLAN-UHFFFAOYSA-N 1 2 322.218 4.050 20 0 DIADLO FC(F)[C@@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1ccc(Br)cc1 ZINC000621764734 1054010805 /nfs/dbraw/zinc/01/08/05/1054010805.db2.gz LNQWCGXHZZWGTD-LFSVMHDDSA-N 1 2 316.189 4.143 20 0 DIADLO CC(C)Oc1cccc([C@H]([NH2+]CC[C@@H]2CC2(F)F)C(F)F)c1 ZINC000621767312 1054013591 /nfs/dbraw/zinc/01/35/91/1054013591.db2.gz BMWJCXUCXQQTOV-OCCSQVGLSA-N 1 2 319.342 4.415 20 0 DIADLO CCOc1ccc(C[N@H+](CC)Cc2cccc(F)c2F)c(C)n1 ZINC001232314316 1054020188 /nfs/dbraw/zinc/02/01/88/1054020188.db2.gz OGRPRULMTZJRJO-UHFFFAOYSA-N 1 2 320.383 4.089 20 0 DIADLO CCOc1ccc(C[N@@H+](CC)Cc2cccc(F)c2F)c(C)n1 ZINC001232314316 1054020199 /nfs/dbraw/zinc/02/01/99/1054020199.db2.gz OGRPRULMTZJRJO-UHFFFAOYSA-N 1 2 320.383 4.089 20 0 DIADLO C[C@@H](c1ccco1)c1noc([C@@H]2CCC[N@@H+]2Cc2ccccc2)n1 ZINC000621795449 1054022308 /nfs/dbraw/zinc/02/23/08/1054022308.db2.gz ISNPQLILRIPLTN-HOCLYGCPSA-N 1 2 323.396 4.152 20 0 DIADLO C[C@@H](c1ccco1)c1noc([C@@H]2CCC[N@H+]2Cc2ccccc2)n1 ZINC000621795449 1054022315 /nfs/dbraw/zinc/02/23/15/1054022315.db2.gz ISNPQLILRIPLTN-HOCLYGCPSA-N 1 2 323.396 4.152 20 0 DIADLO FC(F)(F)C[C@@H]1CCC[N@H+](Cc2nc(-c3ccccc3)c[nH]2)C1 ZINC001330107805 1054026087 /nfs/dbraw/zinc/02/60/87/1054026087.db2.gz HAFLMMFEQCFKHD-ZDUSSCGKSA-N 1 2 323.362 4.241 20 0 DIADLO FC(F)(F)C[C@@H]1CCC[N@@H+](Cc2nc(-c3ccccc3)c[nH]2)C1 ZINC001330107805 1054026097 /nfs/dbraw/zinc/02/60/97/1054026097.db2.gz HAFLMMFEQCFKHD-ZDUSSCGKSA-N 1 2 323.362 4.241 20 0 DIADLO CSc1cc(C)c(C[N@@H+]2CCc3c(Cl)cccc3C2)cn1 ZINC001232349053 1054026572 /nfs/dbraw/zinc/02/65/72/1054026572.db2.gz XXGKNVLPWYQSFY-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CSc1cc(C)c(C[N@H+]2CCc3c(Cl)cccc3C2)cn1 ZINC001232349053 1054026586 /nfs/dbraw/zinc/02/65/86/1054026586.db2.gz XXGKNVLPWYQSFY-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO COc1cc(C[N@H+](C)Cc2ccccc2F)c(OC)cc1Cl ZINC001232371852 1054031540 /nfs/dbraw/zinc/03/15/40/1054031540.db2.gz FBLRINGUDZHGSX-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO COc1cc(C[N@@H+](C)Cc2ccccc2F)c(OC)cc1Cl ZINC001232371852 1054031556 /nfs/dbraw/zinc/03/15/56/1054031556.db2.gz FBLRINGUDZHGSX-UHFFFAOYSA-N 1 2 323.795 4.128 20 0 DIADLO CCCCOc1ccccc1C[NH2+]Cc1nc2cc(C)ccc2[nH]1 ZINC001200844935 1054033014 /nfs/dbraw/zinc/03/30/14/1054033014.db2.gz NICVQUASKKBOAI-UHFFFAOYSA-N 1 2 323.440 4.340 20 0 DIADLO CCCCOc1ccccc1C[NH2+]Cc1nc2ccc(C)cc2[nH]1 ZINC001200844935 1054033024 /nfs/dbraw/zinc/03/30/24/1054033024.db2.gz NICVQUASKKBOAI-UHFFFAOYSA-N 1 2 323.440 4.340 20 0 DIADLO Cc1cc([C@H](C)[NH2+]Cc2nccc(C)c2Br)c(C)o1 ZINC001330600173 1054042036 /nfs/dbraw/zinc/04/20/36/1054042036.db2.gz BTAZXUZVXXRKOQ-NSHDSACASA-N 1 2 323.234 4.213 20 0 DIADLO Clc1ccccc1-c1ccc(C[NH2+]Cc2csnn2)s1 ZINC001330638476 1054044880 /nfs/dbraw/zinc/04/48/80/1054044880.db2.gz HNHLYGPXEQVCLP-UHFFFAOYSA-N 1 2 321.858 4.210 20 0 DIADLO Cc1cnc([C@H]([NH2+]Cc2cc(C(F)(F)F)co2)C2CC2)s1 ZINC001330672605 1054045750 /nfs/dbraw/zinc/04/57/50/1054045750.db2.gz OJGQYGXYSIISNX-GFCCVEGCSA-N 1 2 316.348 4.304 20 0 DIADLO Cc1[nH]c(CN(Cc2ccc(Cl)cc2Cl)C(C)C)c[nH+]1 ZINC001232464437 1054049274 /nfs/dbraw/zinc/04/92/74/1054049274.db2.gz DUAPRACZAZGTAO-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO Cc1[nH]cc(CN(Cc2ccc(Cl)cc2Cl)C(C)C)[nH+]1 ZINC001232464437 1054049277 /nfs/dbraw/zinc/04/92/77/1054049277.db2.gz DUAPRACZAZGTAO-UHFFFAOYSA-N 1 2 312.244 4.436 20 0 DIADLO CCC[N@H+](Cc1cn(C)nc1Cl)[C@H](C)c1ccccc1OC ZINC001331067295 1054059662 /nfs/dbraw/zinc/05/96/62/1054059662.db2.gz MEIHPLNFXMLZMV-CYBMUJFWSA-N 1 2 321.852 4.055 20 0 DIADLO CCC[N@@H+](Cc1cn(C)nc1Cl)[C@H](C)c1ccccc1OC ZINC001331067295 1054059676 /nfs/dbraw/zinc/05/96/76/1054059676.db2.gz MEIHPLNFXMLZMV-CYBMUJFWSA-N 1 2 321.852 4.055 20 0 DIADLO FCc1cccc(C[N@H+](Cc2ccccc2)Cc2cccnc2)n1 ZINC001232535654 1054065713 /nfs/dbraw/zinc/06/57/13/1054065713.db2.gz ZCCRMIDQPGCRTF-UHFFFAOYSA-N 1 2 321.399 4.149 20 0 DIADLO FCc1cccc(C[N@@H+](Cc2ccccc2)Cc2cccnc2)n1 ZINC001232535654 1054065722 /nfs/dbraw/zinc/06/57/22/1054065722.db2.gz ZCCRMIDQPGCRTF-UHFFFAOYSA-N 1 2 321.399 4.149 20 0 DIADLO FCc1cccc(C[N@H+](Cc2ccccc2)Cc2ccncc2)n1 ZINC001232534899 1054066712 /nfs/dbraw/zinc/06/67/12/1054066712.db2.gz IIWHNLCEOKHPJS-UHFFFAOYSA-N 1 2 321.399 4.149 20 0 DIADLO FCc1cccc(C[N@@H+](Cc2ccccc2)Cc2ccncc2)n1 ZINC001232534899 1054066725 /nfs/dbraw/zinc/06/67/25/1054066725.db2.gz IIWHNLCEOKHPJS-UHFFFAOYSA-N 1 2 321.399 4.149 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cccc(CF)n1 ZINC001232540596 1054067455 /nfs/dbraw/zinc/06/74/55/1054067455.db2.gz ITAZXLORLKBBQG-GOSISDBHSA-N 1 2 314.404 4.035 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cccc(CF)n1 ZINC001232540596 1054067465 /nfs/dbraw/zinc/06/74/65/1054067465.db2.gz ITAZXLORLKBBQG-GOSISDBHSA-N 1 2 314.404 4.035 20 0 DIADLO CCCC[C@@H](C)C(=O)N1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001355164386 1054070819 /nfs/dbraw/zinc/07/08/19/1054070819.db2.gz XFWOLKSAZGZDEE-CVEARBPZSA-N 1 2 319.493 4.170 20 0 DIADLO CCOc1ccnc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)c1 ZINC001232587893 1054077338 /nfs/dbraw/zinc/07/73/38/1054077338.db2.gz NBDOCBLNYRCPES-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO CCOc1ccnc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)c1 ZINC001232587893 1054077349 /nfs/dbraw/zinc/07/73/49/1054077349.db2.gz NBDOCBLNYRCPES-SFHVURJKSA-N 1 2 318.367 4.096 20 0 DIADLO C[C@H](c1nc([C@@H]2CCC(C)(C)c3ccccc32)no1)n1cc[nH+]c1 ZINC001331515891 1054079714 /nfs/dbraw/zinc/07/97/14/1054079714.db2.gz TZANMSVKPXLOMR-UKRRQHHQSA-N 1 2 322.412 4.079 20 0 DIADLO CC(C)(C)c1coc(C[NH+]2CCC(Nc3ccccc3)CC2)n1 ZINC001355214680 1054084675 /nfs/dbraw/zinc/08/46/75/1054084675.db2.gz PTOZBYYFJNIXTL-UHFFFAOYSA-N 1 2 313.445 4.049 20 0 DIADLO COc1cccc(C)c1C[N@@H+]1CCc2c3ccccc3oc2C1 ZINC001232624048 1054084724 /nfs/dbraw/zinc/08/47/24/1054084724.db2.gz YAUQYPSBZPEXGE-UHFFFAOYSA-N 1 2 307.393 4.308 20 0 DIADLO COc1cccc(C)c1C[N@H+]1CCc2c3ccccc3oc2C1 ZINC001232624048 1054084736 /nfs/dbraw/zinc/08/47/36/1054084736.db2.gz YAUQYPSBZPEXGE-UHFFFAOYSA-N 1 2 307.393 4.308 20 0 DIADLO COc1c(C)c[nH+]c(CN(C)C(=O)C[C@@H](C)CC(C)(C)C)c1C ZINC000622037755 1054088583 /nfs/dbraw/zinc/08/85/83/1054088583.db2.gz SOIREKXWDQLXSJ-CYBMUJFWSA-N 1 2 320.477 4.128 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cnc(Cl)cc1Br ZINC001232682122 1054098751 /nfs/dbraw/zinc/09/87/51/1054098751.db2.gz WCDUIBQVFOCAHT-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cnc(Cl)cc1Br ZINC001232682122 1054098766 /nfs/dbraw/zinc/09/87/66/1054098766.db2.gz WCDUIBQVFOCAHT-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO F[C@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ncccc1C(F)(F)F ZINC001331933067 1054101904 /nfs/dbraw/zinc/10/19/04/1054101904.db2.gz LTLUZKFUIOGAJT-HOCLYGCPSA-N 1 2 324.321 4.216 20 0 DIADLO Fc1ccc(Cl)c(Br)c1C[NH+]1CCCCC1 ZINC001232692396 1054102400 /nfs/dbraw/zinc/10/24/00/1054102400.db2.gz XASPIJWVSUXMTO-UHFFFAOYSA-N 1 2 306.606 4.228 20 0 DIADLO F[C@@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ncccc1C(F)(F)F ZINC001331933065 1054102483 /nfs/dbraw/zinc/10/24/83/1054102483.db2.gz LTLUZKFUIOGAJT-GDBMZVCRSA-N 1 2 324.321 4.216 20 0 DIADLO Fc1ccc(Cl)c(Br)c1C[NH+]1CC2CC(C2)C1 ZINC001232696614 1054103005 /nfs/dbraw/zinc/10/30/05/1054103005.db2.gz NIKOSTJVFQBNAM-UHFFFAOYSA-N 1 2 318.617 4.083 20 0 DIADLO CCOC1CC[NH+](Cc2cc(F)c(Cl)cc2Cl)CC1 ZINC001232700048 1054105032 /nfs/dbraw/zinc/10/50/32/1054105032.db2.gz GORCDTQYEKWGFO-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2Cl)C1 ZINC001232699676 1054105169 /nfs/dbraw/zinc/10/51/69/1054105169.db2.gz BCPKQDPZJKEVTI-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO CCCO[C@@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2Cl)C1 ZINC001232699676 1054105175 /nfs/dbraw/zinc/10/51/75/1054105175.db2.gz BCPKQDPZJKEVTI-LLVKDONJSA-N 1 2 306.208 4.133 20 0 DIADLO C[N@H+](CC(=O)c1ccccc1)Cc1cc2ccc(Cl)cc2[nH]1 ZINC001232735502 1054110605 /nfs/dbraw/zinc/11/06/05/1054110605.db2.gz WQZQTBOJDXZHBQ-UHFFFAOYSA-N 1 2 312.800 4.136 20 0 DIADLO C[N@@H+](CC(=O)c1ccccc1)Cc1cc2ccc(Cl)cc2[nH]1 ZINC001232735502 1054110610 /nfs/dbraw/zinc/11/06/10/1054110610.db2.gz WQZQTBOJDXZHBQ-UHFFFAOYSA-N 1 2 312.800 4.136 20 0 DIADLO COc1ccccc1C1([NH2+][C@@H]2CCCc3oc(C)nc32)CCC1 ZINC001332402689 1054117541 /nfs/dbraw/zinc/11/75/41/1054117541.db2.gz QYTOGVBQDOKOOW-OAHLLOKOSA-N 1 2 312.413 4.038 20 0 DIADLO CCCn1cnc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC001232799203 1054121923 /nfs/dbraw/zinc/12/19/23/1054121923.db2.gz ZMTFKCJTXAJQAS-QGZVFWFLSA-N 1 2 303.837 4.284 20 0 DIADLO CCCn1cnc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC001232799203 1054121937 /nfs/dbraw/zinc/12/19/37/1054121937.db2.gz ZMTFKCJTXAJQAS-QGZVFWFLSA-N 1 2 303.837 4.284 20 0 DIADLO COc1cccc(C[N@H+](Cc2ccco2)Cc2cccnc2)c1C ZINC001332713995 1054125327 /nfs/dbraw/zinc/12/53/27/1054125327.db2.gz FSGSZMRICVHFIT-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO COc1cccc(C[N@@H+](Cc2ccco2)Cc2cccnc2)c1C ZINC001332713995 1054125337 /nfs/dbraw/zinc/12/53/37/1054125337.db2.gz FSGSZMRICVHFIT-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(Br)co2)cn1 ZINC001232857908 1054133369 /nfs/dbraw/zinc/13/33/69/1054133369.db2.gz XRNABJMAYSLROG-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc(Br)co2)cn1 ZINC001232857908 1054133379 /nfs/dbraw/zinc/13/33/79/1054133379.db2.gz XRNABJMAYSLROG-HNNXBMFYSA-N 1 2 321.218 4.083 20 0 DIADLO CCCOC1CC[NH+](Cc2ccc(F)c(F)c2Cl)CC1 ZINC001232875226 1054135116 /nfs/dbraw/zinc/13/51/16/1054135116.db2.gz BYELMAJGZSTHGS-UHFFFAOYSA-N 1 2 303.780 4.009 20 0 DIADLO Fc1ccc(C[N@H+]2CC[C@H](F)C(F)(F)CC2)c(Cl)c1F ZINC001232874651 1054135663 /nfs/dbraw/zinc/13/56/63/1054135663.db2.gz ZAZSQKAOAZFRFF-JTQLQIEISA-N 1 2 313.697 4.187 20 0 DIADLO Fc1ccc(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c(Cl)c1F ZINC001232874651 1054135667 /nfs/dbraw/zinc/13/56/67/1054135667.db2.gz ZAZSQKAOAZFRFF-JTQLQIEISA-N 1 2 313.697 4.187 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc(-c2cccc(F)c2)nc1 ZINC001232890550 1054140237 /nfs/dbraw/zinc/14/02/37/1054140237.db2.gz XEDJDTJHJHWODO-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1ccc(-c2cccc(F)c2)nc1 ZINC001232890550 1054140249 /nfs/dbraw/zinc/14/02/49/1054140249.db2.gz XEDJDTJHJHWODO-HNNXBMFYSA-N 1 2 321.399 4.266 20 0 DIADLO CC(C)[C@H]([NH2+][C@@H](C)c1ncccn1)c1ccc(Cl)cc1F ZINC001333300022 1054148440 /nfs/dbraw/zinc/14/84/40/1054148440.db2.gz OXKKCSQHJTUGOZ-NHYWBVRUSA-N 1 2 307.800 4.317 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(F)c(O)c2F)cc1 ZINC001232934560 1054149319 /nfs/dbraw/zinc/14/93/19/1054149319.db2.gz AVQSZGWGBMAQIN-INIZCTEOSA-N 1 2 303.352 4.316 20 0 DIADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(F)c(O)c2F)cc1 ZINC001232934560 1054149328 /nfs/dbraw/zinc/14/93/28/1054149328.db2.gz AVQSZGWGBMAQIN-INIZCTEOSA-N 1 2 303.352 4.316 20 0 DIADLO FC(F)(F)Sc1cccc(C[N@@H+]2CCn3cccc3C2)c1 ZINC001232948338 1054155294 /nfs/dbraw/zinc/15/52/94/1054155294.db2.gz UZKOLCIGYNAMKE-UHFFFAOYSA-N 1 2 312.360 4.116 20 0 DIADLO FC(F)(F)Sc1cccc(C[N@H+]2CCn3cccc3C2)c1 ZINC001232948338 1054155303 /nfs/dbraw/zinc/15/53/03/1054155303.db2.gz UZKOLCIGYNAMKE-UHFFFAOYSA-N 1 2 312.360 4.116 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(Cl)cnc1Br ZINC001232961574 1054158506 /nfs/dbraw/zinc/15/85/06/1054158506.db2.gz PTMIZSUACNZBMY-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc(Cl)cnc1Br ZINC001232961574 1054158513 /nfs/dbraw/zinc/15/85/13/1054158513.db2.gz PTMIZSUACNZBMY-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO COc1cc(Cl)cc(F)c1C[NH+]1CC(c2ccccc2)C1 ZINC001233003249 1054168330 /nfs/dbraw/zinc/16/83/30/1054168330.db2.gz FGEDUVFRVOPTBU-UHFFFAOYSA-N 1 2 305.780 4.087 20 0 DIADLO Oc1cc(Br)cc(C[N@@H+]2CC[C@H]2c2ccccc2)c1 ZINC001232998668 1054168454 /nfs/dbraw/zinc/16/84/54/1054168454.db2.gz CJLKFWSXYGSYCG-INIZCTEOSA-N 1 2 318.214 4.102 20 0 DIADLO Oc1cc(Br)cc(C[N@H+]2CC[C@H]2c2ccccc2)c1 ZINC001232998668 1054168458 /nfs/dbraw/zinc/16/84/58/1054168458.db2.gz CJLKFWSXYGSYCG-INIZCTEOSA-N 1 2 318.214 4.102 20 0 DIADLO FC[C@H]1CCC[N@@H+]1Cc1ccc(OC(F)(F)F)cc1Cl ZINC001232997201 1054168518 /nfs/dbraw/zinc/16/85/18/1054168518.db2.gz OAGKTHVCEGXJOA-SNVBAGLBSA-N 1 2 311.706 4.173 20 0 DIADLO FC[C@H]1CCC[N@H+]1Cc1ccc(OC(F)(F)F)cc1Cl ZINC001232997201 1054168522 /nfs/dbraw/zinc/16/85/22/1054168522.db2.gz OAGKTHVCEGXJOA-SNVBAGLBSA-N 1 2 311.706 4.173 20 0 DIADLO Oc1cnc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001233038580 1054174004 /nfs/dbraw/zinc/17/40/04/1054174004.db2.gz VRFGSSWIVDYSPD-CYBMUJFWSA-N 1 2 324.758 4.056 20 0 DIADLO Oc1cnc(Cl)cc1C[N@H+]1CCC[C@@H]1c1c(F)cccc1F ZINC001233038580 1054174006 /nfs/dbraw/zinc/17/40/06/1054174006.db2.gz VRFGSSWIVDYSPD-CYBMUJFWSA-N 1 2 324.758 4.056 20 0 DIADLO C[C@H]([NH2+][C@H](c1ccccc1)c1cccc(F)c1)c1cnccn1 ZINC000168544243 1054179493 /nfs/dbraw/zinc/17/94/93/1054179493.db2.gz YPVIRQBPUAJLEQ-IFXJQAMLSA-N 1 2 307.372 4.056 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1ccc(Cl)c(Br)n1 ZINC001233093772 1054185085 /nfs/dbraw/zinc/18/50/85/1054185085.db2.gz YXBUMFJHGYJBAU-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1ccc(Cl)c(Br)n1 ZINC001233093772 1054185089 /nfs/dbraw/zinc/18/50/89/1054185089.db2.gz YXBUMFJHGYJBAU-LLVKDONJSA-N 1 2 317.658 4.262 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc(Cl)c(Br)n1 ZINC001233092531 1054185784 /nfs/dbraw/zinc/18/57/84/1054185784.db2.gz MXXYHPGVRJEDCS-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc(Cl)c(Br)n1 ZINC001233092531 1054185792 /nfs/dbraw/zinc/18/57/92/1054185792.db2.gz MXXYHPGVRJEDCS-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO CCOc1c(Cl)cc(C[N@@H+]2CCCO[C@H](C)C2)cc1Cl ZINC001233107924 1054186004 /nfs/dbraw/zinc/18/60/04/1054186004.db2.gz POFGGCLTJAUCEO-LLVKDONJSA-N 1 2 318.244 4.003 20 0 DIADLO CCOc1c(Cl)cc(C[N@H+]2CCCO[C@H](C)C2)cc1Cl ZINC001233107924 1054186011 /nfs/dbraw/zinc/18/60/11/1054186011.db2.gz POFGGCLTJAUCEO-LLVKDONJSA-N 1 2 318.244 4.003 20 0 DIADLO CC[C@H]1CCC[N@H+](Cc2ccc(Cl)c(Br)n2)C1 ZINC001233093327 1054186329 /nfs/dbraw/zinc/18/63/29/1054186329.db2.gz JXBGRUVNPZNLRR-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO CC[C@H]1CCC[N@@H+](Cc2ccc(Cl)c(Br)n2)C1 ZINC001233093327 1054186337 /nfs/dbraw/zinc/18/63/37/1054186337.db2.gz JXBGRUVNPZNLRR-JTQLQIEISA-N 1 2 317.658 4.120 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1ccc(Cl)c(Br)n1 ZINC001233092747 1054186391 /nfs/dbraw/zinc/18/63/91/1054186391.db2.gz VNDFUNSHPCEPJQ-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1ccc(Cl)c(Br)n1 ZINC001233092747 1054186394 /nfs/dbraw/zinc/18/63/94/1054186394.db2.gz VNDFUNSHPCEPJQ-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO CC1(c2ccccc2)CC[NH+](Cc2n[nH]c3cc(F)ccc32)CC1 ZINC001233123758 1054189414 /nfs/dbraw/zinc/18/94/14/1054189414.db2.gz AZBZEDYQGLLBED-UHFFFAOYSA-N 1 2 323.415 4.256 20 0 DIADLO CCC[N@H+](Cc1nc(C)sc1Br)[C@H](C)CC ZINC001233150345 1054191638 /nfs/dbraw/zinc/19/16/38/1054191638.db2.gz GZOIJLOOVBOGOX-SECBINFHSA-N 1 2 305.285 4.225 20 0 DIADLO CCC[N@@H+](Cc1nc(C)sc1Br)[C@H](C)CC ZINC001233150345 1054191644 /nfs/dbraw/zinc/19/16/44/1054191644.db2.gz GZOIJLOOVBOGOX-SECBINFHSA-N 1 2 305.285 4.225 20 0 DIADLO Cc1cc(C[N@@H+]2CCSC[C@H]2c2ccc(F)cc2)cnc1C ZINC001233161838 1054193641 /nfs/dbraw/zinc/19/36/41/1054193641.db2.gz JKEVYJOTURRWFR-SFHVURJKSA-N 1 2 316.445 4.128 20 0 DIADLO Cc1cc(C[N@H+]2CCSC[C@H]2c2ccc(F)cc2)cnc1C ZINC001233161838 1054193645 /nfs/dbraw/zinc/19/36/45/1054193645.db2.gz JKEVYJOTURRWFR-SFHVURJKSA-N 1 2 316.445 4.128 20 0 DIADLO CC(C)Oc1ncc(Cl)cc1C[N@@H+]1CCCC(F)(F)CC1 ZINC001233165121 1054193719 /nfs/dbraw/zinc/19/37/19/1054193719.db2.gz SVXOOBRQCAKODG-UHFFFAOYSA-N 1 2 318.795 4.143 20 0 DIADLO CC(C)Oc1ncc(Cl)cc1C[N@H+]1CCCC(F)(F)CC1 ZINC001233165121 1054193727 /nfs/dbraw/zinc/19/37/27/1054193727.db2.gz SVXOOBRQCAKODG-UHFFFAOYSA-N 1 2 318.795 4.143 20 0 DIADLO CCOc1ncc(Cl)cc1C[N@@H+]1CCC(F)(F)C(C)(C)C1 ZINC001233167008 1054193916 /nfs/dbraw/zinc/19/39/16/1054193916.db2.gz IJWHOIRFLKZQDV-UHFFFAOYSA-N 1 2 318.795 4.001 20 0 DIADLO CCOc1ncc(Cl)cc1C[N@H+]1CCC(F)(F)C(C)(C)C1 ZINC001233167008 1054193920 /nfs/dbraw/zinc/19/39/20/1054193920.db2.gz IJWHOIRFLKZQDV-UHFFFAOYSA-N 1 2 318.795 4.001 20 0 DIADLO C[C@H]1C[N@H+](Cc2cccc(Oc3ccc(F)cc3)c2)CCC1=O ZINC001233207949 1054200342 /nfs/dbraw/zinc/20/03/42/1054200342.db2.gz TVRDHSLPLDUHAI-AWEZNQCLSA-N 1 2 313.372 4.029 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cccc(Oc3ccc(F)cc3)c2)CCC1=O ZINC001233207949 1054200349 /nfs/dbraw/zinc/20/03/49/1054200349.db2.gz TVRDHSLPLDUHAI-AWEZNQCLSA-N 1 2 313.372 4.029 20 0 DIADLO CC(C)c1nc(C[NH2+][C@]2(C)CCOc3ccccc32)cs1 ZINC001335191057 1054210570 /nfs/dbraw/zinc/21/05/70/1054210570.db2.gz YDNUGBPFNKYBKS-QGZVFWFLSA-N 1 2 302.443 4.054 20 0 DIADLO COc1c(O)cccc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)s1 ZINC001233257227 1054220458 /nfs/dbraw/zinc/22/04/58/1054220458.db2.gz WBRKEHCJHKMAHW-GFCCVEGCSA-N 1 2 323.845 4.453 20 0 DIADLO COc1c(O)cccc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)s1 ZINC001233257227 1054220468 /nfs/dbraw/zinc/22/04/68/1054220468.db2.gz WBRKEHCJHKMAHW-GFCCVEGCSA-N 1 2 323.845 4.453 20 0 DIADLO O=C(c1ccccc1F)C1CC[NH+](Cc2ccc(Cl)o2)CC1 ZINC001233317195 1054228529 /nfs/dbraw/zinc/22/85/29/1054228529.db2.gz BQMRJGRTCXCRPN-UHFFFAOYSA-N 1 2 321.779 4.167 20 0 DIADLO Cc1cnsc1C[N@H+](Cc1ccccc1)Cc1ccncc1 ZINC001233318173 1054230127 /nfs/dbraw/zinc/23/01/27/1054230127.db2.gz SKXWKYVLHKUHDS-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1cnsc1C[N@@H+](Cc1ccccc1)Cc1ccncc1 ZINC001233318173 1054230144 /nfs/dbraw/zinc/23/01/44/1054230144.db2.gz SKXWKYVLHKUHDS-UHFFFAOYSA-N 1 2 309.438 4.049 20 0 DIADLO Cc1cnsc1C[N@@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001233321160 1054232054 /nfs/dbraw/zinc/23/20/54/1054232054.db2.gz CGYPJPATUVPMDR-AWEZNQCLSA-N 1 2 324.902 4.395 20 0 DIADLO Cc1cnsc1C[N@H+]1CCSC[C@H]1c1cccc(Cl)c1 ZINC001233321160 1054232070 /nfs/dbraw/zinc/23/20/70/1054232070.db2.gz CGYPJPATUVPMDR-AWEZNQCLSA-N 1 2 324.902 4.395 20 0 DIADLO Cc1ccc2snc(C(=O)Nc3c(C)cc(C)[nH+]c3C)c2c1 ZINC001355891401 1054241643 /nfs/dbraw/zinc/24/16/43/1054241643.db2.gz LVNZEONASTVQSL-UHFFFAOYSA-N 1 2 311.410 4.177 20 0 DIADLO CC[C@@H]([NH2+]Cc1ncoc1C(C)C)c1cccc(OC)c1OC ZINC001336807016 1054247081 /nfs/dbraw/zinc/24/70/81/1054247081.db2.gz DDQFKRLCOIQBDP-CQSZACIVSA-N 1 2 318.417 4.056 20 0 DIADLO CSc1cccc(Cl)c1C[N@@H+]1CCc2ccncc2C1 ZINC001233352852 1054247737 /nfs/dbraw/zinc/24/77/37/1054247737.db2.gz WKAMCVKQURGENN-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CSc1cccc(Cl)c1C[N@H+]1CCc2ccncc2C1 ZINC001233352852 1054247749 /nfs/dbraw/zinc/24/77/49/1054247749.db2.gz WKAMCVKQURGENN-UHFFFAOYSA-N 1 2 304.846 4.015 20 0 DIADLO CCN(Cc1cccc2[nH+]ccn21)Cc1c(F)cccc1Cl ZINC001233363903 1054249532 /nfs/dbraw/zinc/24/95/32/1054249532.db2.gz GFQHKQZWFFYBGJ-UHFFFAOYSA-N 1 2 317.795 4.149 20 0 DIADLO Nc1ccc(C[N@@H+]2CCc3cc(Cl)ccc3C2)c(Cl)c1 ZINC001233376724 1054253866 /nfs/dbraw/zinc/25/38/66/1054253866.db2.gz XNXWDQDETUWXPO-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO Nc1ccc(C[N@H+]2CCc3cc(Cl)ccc3C2)c(Cl)c1 ZINC001233376724 1054253880 /nfs/dbraw/zinc/25/38/80/1054253880.db2.gz XNXWDQDETUWXPO-UHFFFAOYSA-N 1 2 307.224 4.134 20 0 DIADLO C[C@H]([NH2+]C/C(Cl)=C\Cl)c1ccc(F)cc1OC(F)F ZINC001337224458 1054260645 /nfs/dbraw/zinc/26/06/45/1054260645.db2.gz HHIBGQLPTLNQRO-QAZRXNLGSA-N 1 2 314.134 4.397 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cn3cccc(Cl)c3n2)Cc2ccccc21 ZINC001233420474 1054267946 /nfs/dbraw/zinc/26/79/46/1054267946.db2.gz MLONYNHEUUCODZ-CYBMUJFWSA-N 1 2 311.816 4.107 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cn3cccc(Cl)c3n2)Cc2ccccc21 ZINC001233420474 1054267959 /nfs/dbraw/zinc/26/79/59/1054267959.db2.gz MLONYNHEUUCODZ-CYBMUJFWSA-N 1 2 311.816 4.107 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2cc(Br)ncc2Cl)[C@H](C)C1 ZINC001233428150 1054270401 /nfs/dbraw/zinc/27/04/01/1054270401.db2.gz ZMGIVKJBSDCQAZ-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2cc(Br)ncc2Cl)[C@H](C)C1 ZINC001233428150 1054270415 /nfs/dbraw/zinc/27/04/15/1054270415.db2.gz ZMGIVKJBSDCQAZ-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO Clc1ccc(C2=CC[N@H+](Cc3cncc(Cl)n3)CC2)cc1 ZINC001233446133 1054276749 /nfs/dbraw/zinc/27/67/49/1054276749.db2.gz JKAAYERAUWPXFZ-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Clc1ccc(C2=CC[N@@H+](Cc3cncc(Cl)n3)CC2)cc1 ZINC001233446133 1054276763 /nfs/dbraw/zinc/27/67/63/1054276763.db2.gz JKAAYERAUWPXFZ-UHFFFAOYSA-N 1 2 320.223 4.073 20 0 DIADLO Cn1c(Cl)ncc1C[N@@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000848881989 1054282314 /nfs/dbraw/zinc/28/23/14/1054282314.db2.gz WDDJQRAUGVSVKQ-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO Cn1c(Cl)ncc1C[N@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000848881989 1054282302 /nfs/dbraw/zinc/28/23/02/1054282302.db2.gz WDDJQRAUGVSVKQ-UHFFFAOYSA-N 1 2 322.239 4.016 20 0 DIADLO C[C@H]1C[N@H+](Cc2cn3c(cccc3Cl)n2)Cc2ccccc21 ZINC001233552813 1054294818 /nfs/dbraw/zinc/29/48/18/1054294818.db2.gz ZGZOHOVNBWUWNK-ZDUSSCGKSA-N 1 2 311.816 4.107 20 0 DIADLO C[C@H]1C[N@@H+](Cc2cn3c(cccc3Cl)n2)Cc2ccccc21 ZINC001233552813 1054294826 /nfs/dbraw/zinc/29/48/26/1054294826.db2.gz ZGZOHOVNBWUWNK-ZDUSSCGKSA-N 1 2 311.816 4.107 20 0 DIADLO Cc1cc(NC2CCC(C(F)(F)F)CC2)nc(C(C)C)[nH+]1 ZINC000507170733 1054311785 /nfs/dbraw/zinc/31/17/85/1054311785.db2.gz PZJRVCWYCLISCZ-UHFFFAOYSA-N 1 2 301.356 4.441 20 0 DIADLO C[C@@H](CCC(C)(C)C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001356295263 1054315470 /nfs/dbraw/zinc/31/54/70/1054315470.db2.gz AGIIBFPDJUXCKX-ZDUSSCGKSA-N 1 2 317.408 4.412 20 0 DIADLO C[C@H](CCC(C)(C)C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001356295259 1054315586 /nfs/dbraw/zinc/31/55/86/1054315586.db2.gz AGIIBFPDJUXCKX-CYBMUJFWSA-N 1 2 317.408 4.412 20 0 DIADLO C[C@@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(F)c1)[C@H](C)C(C)(C)C ZINC001356297763 1054315981 /nfs/dbraw/zinc/31/59/81/1054315981.db2.gz YRWFIHLOCICQIW-OLZOCXBDSA-N 1 2 317.408 4.268 20 0 DIADLO CC1(C)CCC[C@H]1C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001356317021 1054318154 /nfs/dbraw/zinc/31/81/54/1054318154.db2.gz NCFFPYFMYCMNQU-ZDUSSCGKSA-N 1 2 317.820 4.291 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccno2)c(OCc2ccccc2)c1 ZINC001233645124 1054320252 /nfs/dbraw/zinc/32/02/52/1054320252.db2.gz DVNJVWBHBWZTDJ-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccno2)c(OCc2ccccc2)c1 ZINC001233645124 1054320264 /nfs/dbraw/zinc/32/02/64/1054320264.db2.gz DVNJVWBHBWZTDJ-UHFFFAOYSA-N 1 2 322.408 4.194 20 0 DIADLO Cc1nc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2)c(C)s1 ZINC001341006529 1054374017 /nfs/dbraw/zinc/37/40/17/1054374017.db2.gz YJAZFMLZSBIHOE-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO Cc1nc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)c(C)s1 ZINC001341006529 1054374027 /nfs/dbraw/zinc/37/40/27/1054374027.db2.gz YJAZFMLZSBIHOE-UHFFFAOYSA-N 1 2 314.376 4.411 20 0 DIADLO CCOc1ccccc1[C@H](CC)[NH2+]Cc1ncoc1C(C)C ZINC001341729297 1054405607 /nfs/dbraw/zinc/40/56/07/1054405607.db2.gz NKTMUFXCNBWVPA-HNNXBMFYSA-N 1 2 302.418 4.438 20 0 DIADLO C[C@H]1CCN(C(=O)c2cccc(-n3cc[nH+]c3)c2)c2ccccc21 ZINC000172052778 1054406875 /nfs/dbraw/zinc/40/68/75/1054406875.db2.gz QRDJHKQLDLKMEC-HNNXBMFYSA-N 1 2 317.392 4.026 20 0 DIADLO Cn1cc([C@@H]([NH2+]Cc2cscc2Cl)c2ccccc2)cn1 ZINC001342323530 1054419466 /nfs/dbraw/zinc/41/94/66/1054419466.db2.gz CPHUEOUMCQFXHG-INIZCTEOSA-N 1 2 317.845 4.014 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@@H](CC)c2ccc(F)cc2)n1 ZINC001342210781 1054419636 /nfs/dbraw/zinc/41/96/36/1054419636.db2.gz SNPSQQNGHLCCIK-DOMZBBRYSA-N 1 2 305.397 4.353 20 0 DIADLO Cc1[nH+]c[nH]c1CC(=O)Nc1ccc(Oc2ccc(C)cc2)cc1 ZINC001442405836 1054420517 /nfs/dbraw/zinc/42/05/17/1054420517.db2.gz LNYUWXPZHHISKS-UHFFFAOYSA-N 1 2 321.380 4.000 20 0 DIADLO Cc1cccc2oc(C(=O)Nc3ccc(-c4[nH]cc[nH+]4)cc3)cc21 ZINC001442516545 1054423250 /nfs/dbraw/zinc/42/32/50/1054423250.db2.gz CQWGPICEXIPETA-UHFFFAOYSA-N 1 2 317.348 4.384 20 0 DIADLO C[C@@]1(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CC=CCC1 ZINC001357254698 1054445191 /nfs/dbraw/zinc/44/51/91/1054445191.db2.gz NLQGKWNHFDKORQ-QGZVFWFLSA-N 1 2 315.804 4.211 20 0 DIADLO Oc1cccc2c1CCC[C@H]2Nc1ccc([NH+]2CCCC2)cc1 ZINC001343635740 1054450494 /nfs/dbraw/zinc/45/04/94/1054450494.db2.gz SLIJHTQZRLFGEQ-LJQANCHMSA-N 1 2 308.425 4.482 20 0 DIADLO Cc1nc(C)c([C@H](C)Nc2ccc(N3CCCCC3)[nH+]c2)s1 ZINC000336851694 1054451434 /nfs/dbraw/zinc/45/14/34/1054451434.db2.gz ABDWCTYARBOMSV-ZDUSSCGKSA-N 1 2 316.474 4.318 20 0 DIADLO CC(C)(C)c1nnc(C[N@@H+]2C[C@H]3CCCC[C@@]32c2ccccc2)[nH]1 ZINC001343871122 1054455313 /nfs/dbraw/zinc/45/53/13/1054455313.db2.gz IJMZOSIKZBOFGA-OXQOHEQNSA-N 1 2 324.472 4.004 20 0 DIADLO CC(C)(C)c1nnc(C[N@H+]2C[C@H]3CCCC[C@@]32c2ccccc2)[nH]1 ZINC001343871122 1054455321 /nfs/dbraw/zinc/45/53/21/1054455321.db2.gz IJMZOSIKZBOFGA-OXQOHEQNSA-N 1 2 324.472 4.004 20 0 DIADLO Cc1cn2cc(NC(=O)CC(C3CCC3)C3CCC3)ccc2[nH+]1 ZINC001357621295 1054512682 /nfs/dbraw/zinc/51/26/82/1054512682.db2.gz RUIBCHFDSPIILN-UHFFFAOYSA-N 1 2 311.429 4.188 20 0 DIADLO CCCc1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000174663687 1054515276 /nfs/dbraw/zinc/51/52/76/1054515276.db2.gz CTAGPXCRDUVDJS-CYBMUJFWSA-N 1 2 301.434 4.170 20 0 DIADLO CC(C)[C@H]1CC[C@H](C(=O)Nc2cccc(-n3cc[nH+]c3)c2)CC1 ZINC001125084411 1054548044 /nfs/dbraw/zinc/54/80/44/1054548044.db2.gz WPBKSFIRGHVDEN-WKILWMFISA-N 1 2 311.429 4.273 20 0 DIADLO CCOC(=[NH2+])c1ccc(O[C@H](C)c2cccc(N(C)C)c2)cc1 ZINC001234587886 1054550413 /nfs/dbraw/zinc/55/04/13/1054550413.db2.gz FBJHLBNGSSOVJQ-CQSZACIVSA-N 1 2 312.413 4.254 20 0 DIADLO Cc1cc([NH+](C)C)ccc1N[C@H](C)c1ccc(-n2ccnc2)cc1 ZINC000325064344 1054574943 /nfs/dbraw/zinc/57/49/43/1054574943.db2.gz UZOMBPYHPAFENL-MRXNPFEDSA-N 1 2 320.440 4.420 20 0 DIADLO COc1ccc(C[N@@H+]2Cc3cccc(C)c3C2)c(OC(C)C)c1 ZINC001234689881 1054577241 /nfs/dbraw/zinc/57/72/41/1054577241.db2.gz ZTXUHOASQKXXSQ-UHFFFAOYSA-N 1 2 311.425 4.307 20 0 DIADLO COc1ccc(C[N@H+]2Cc3cccc(C)c3C2)c(OC(C)C)c1 ZINC001234689881 1054577255 /nfs/dbraw/zinc/57/72/55/1054577255.db2.gz ZTXUHOASQKXXSQ-UHFFFAOYSA-N 1 2 311.425 4.307 20 0 DIADLO Fc1cc(F)c(C[N@H+](CC2CC2)C2CC2)c(Br)c1 ZINC001234770558 1054588583 /nfs/dbraw/zinc/58/85/83/1054588583.db2.gz FXMZZAVUOIPLSG-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO Fc1cc(F)c(C[N@@H+](CC2CC2)C2CC2)c(Br)c1 ZINC001234770558 1054588592 /nfs/dbraw/zinc/58/85/92/1054588592.db2.gz FXMZZAVUOIPLSG-UHFFFAOYSA-N 1 2 316.189 4.102 20 0 DIADLO O=C(C[C@@H]1CC=CCC1)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001358055499 1054589011 /nfs/dbraw/zinc/58/90/11/1054589011.db2.gz BBWQZVZHZRVGLI-CYBMUJFWSA-N 1 2 315.804 4.211 20 0 DIADLO C[C@H]1C[C@H](C(=O)Nc2ccc(-n3cc[nH+]c3)c(F)c2)C[C@@H](C)C1 ZINC001358067628 1054592534 /nfs/dbraw/zinc/59/25/34/1054592534.db2.gz VYVAFFHYQIRKIW-WDNDVIMCSA-N 1 2 315.392 4.022 20 0 DIADLO CCc1ccc(C[N@H+](C)Cc2ccn(-c3ccccc3)n2)cc1 ZINC000623433367 1054595555 /nfs/dbraw/zinc/59/55/55/1054595555.db2.gz WLNIWEUGCDVUAW-UHFFFAOYSA-N 1 2 305.425 4.067 20 0 DIADLO CCc1ccc(C[N@@H+](C)Cc2ccn(-c3ccccc3)n2)cc1 ZINC000623433367 1054595569 /nfs/dbraw/zinc/59/55/69/1054595569.db2.gz WLNIWEUGCDVUAW-UHFFFAOYSA-N 1 2 305.425 4.067 20 0 DIADLO C[C@@H]([NH2+]Cc1csc(C(F)(F)F)c1)c1c(F)cncc1F ZINC000623524275 1054612695 /nfs/dbraw/zinc/61/26/95/1054612695.db2.gz MOTDTCJEOLARSA-SSDOTTSWSA-N 1 2 322.302 4.291 20 0 DIADLO FC(F)(F)CC[N@@H+](Cc1ccn(-c2ccccc2)n1)CC1CC1 ZINC000177172717 1054616870 /nfs/dbraw/zinc/61/68/70/1054616870.db2.gz BKFNGHIDPQAXCW-UHFFFAOYSA-N 1 2 323.362 4.037 20 0 DIADLO FC(F)(F)CC[N@H+](Cc1ccn(-c2ccccc2)n1)CC1CC1 ZINC000177172717 1054616878 /nfs/dbraw/zinc/61/68/78/1054616878.db2.gz BKFNGHIDPQAXCW-UHFFFAOYSA-N 1 2 323.362 4.037 20 0 DIADLO COC[C@H]([NH2+]Cc1ccc(-c2ccc(F)cc2)o1)c1ccco1 ZINC000177577443 1054623748 /nfs/dbraw/zinc/62/37/48/1054623748.db2.gz YHSXZYRRVWTWRM-INIZCTEOSA-N 1 2 315.344 4.156 20 0 DIADLO C[C@@H]1CCC[N@@H+]1Cc1cc(Cl)cc(Br)c1F ZINC001234968406 1054635840 /nfs/dbraw/zinc/63/58/40/1054635840.db2.gz JJKHRALEIHYMKH-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO C[C@@H]1CCC[N@H+]1Cc1cc(Cl)cc(Br)c1F ZINC001234968406 1054635849 /nfs/dbraw/zinc/63/58/49/1054635849.db2.gz JJKHRALEIHYMKH-MRVPVSSYSA-N 1 2 306.606 4.226 20 0 DIADLO Fc1c(Br)cc(Cl)cc1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC001234974962 1054637583 /nfs/dbraw/zinc/63/75/83/1054637583.db2.gz QYPHSVHRCVZHIG-GZMMTYOYSA-N 1 2 318.617 4.226 20 0 DIADLO Fc1c(Br)cc(Cl)cc1C[N@H+]1C[C@H]2CC[C@@H]1C2 ZINC001234974962 1054637593 /nfs/dbraw/zinc/63/75/93/1054637593.db2.gz QYPHSVHRCVZHIG-GZMMTYOYSA-N 1 2 318.617 4.226 20 0 DIADLO CCCCN(C(=O)[C@@H](CC(C)C)n1cc[nH+]c1)C1CCCCC1 ZINC001450308513 1054643646 /nfs/dbraw/zinc/64/36/46/1054643646.db2.gz MELQHVCXCQKRPZ-GOSISDBHSA-N 1 2 319.493 4.432 20 0 DIADLO CCOc1cccc([C@@H](C)[NH2+]Cc2nc(C)c3ccccc3n2)c1 ZINC000178460583 1054650964 /nfs/dbraw/zinc/65/09/64/1054650964.db2.gz KMTVDWOZJRRDCI-CQSZACIVSA-N 1 2 321.424 4.188 20 0 DIADLO Clc1cccc2c1C[N@H+](Cc1cccc(N3CCCC3)c1)C2 ZINC001235099489 1054657336 /nfs/dbraw/zinc/65/73/36/1054657336.db2.gz TVCBLLREBQKEJF-UHFFFAOYSA-N 1 2 312.844 4.456 20 0 DIADLO Clc1cccc2c1C[N@@H+](Cc1cccc(N3CCCC3)c1)C2 ZINC001235099489 1054657345 /nfs/dbraw/zinc/65/73/45/1054657345.db2.gz TVCBLLREBQKEJF-UHFFFAOYSA-N 1 2 312.844 4.456 20 0 DIADLO CCC[N@H+](CC(=O)OC(C)(C)C)Cc1ccccc1SCC ZINC001473366744 1054665470 /nfs/dbraw/zinc/66/54/70/1054665470.db2.gz YEDFACBKBXBPJL-UHFFFAOYSA-N 1 2 323.502 4.352 20 0 DIADLO CCC[N@@H+](CC(=O)OC(C)(C)C)Cc1ccccc1SCC ZINC001473366744 1054665472 /nfs/dbraw/zinc/66/54/72/1054665472.db2.gz YEDFACBKBXBPJL-UHFFFAOYSA-N 1 2 323.502 4.352 20 0 DIADLO CCC[C@@H]1CCCC[C@H]1CNC(=O)[C@H](CC(C)C)n1cc[nH+]c1 ZINC001451457022 1054679360 /nfs/dbraw/zinc/67/93/60/1054679360.db2.gz JOJCJGZFEHMUJG-SQNIBIBYSA-N 1 2 319.493 4.193 20 0 DIADLO FC(F)(F)c1ccc(Cl)nc1C[N@@H+]1CCC12CCCC2 ZINC001235225632 1054687711 /nfs/dbraw/zinc/68/77/11/1054687711.db2.gz ZQMBAHDWOLDPHW-UHFFFAOYSA-N 1 2 304.743 4.272 20 0 DIADLO FC(F)(F)c1ccc(Cl)nc1C[N@H+]1CCC12CCCC2 ZINC001235225632 1054687716 /nfs/dbraw/zinc/68/77/16/1054687716.db2.gz ZQMBAHDWOLDPHW-UHFFFAOYSA-N 1 2 304.743 4.272 20 0 DIADLO CC(C)CCc1noc(C[NH2+]C(C)(C)c2cccc(Cl)c2)n1 ZINC000179601463 1054690618 /nfs/dbraw/zinc/69/06/18/1054690618.db2.gz IJNUHEZPASGCGG-UHFFFAOYSA-N 1 2 321.852 4.337 20 0 DIADLO CCc1cccc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)n1 ZINC001235258237 1054694921 /nfs/dbraw/zinc/69/49/21/1054694921.db2.gz LMEAUUBSQAWYTK-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO CCc1cccc(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)n1 ZINC001235258237 1054694929 /nfs/dbraw/zinc/69/49/29/1054694929.db2.gz LMEAUUBSQAWYTK-UHFFFAOYSA-N 1 2 320.358 4.221 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cccc(CC)n1 ZINC001235266125 1054694973 /nfs/dbraw/zinc/69/49/73/1054694973.db2.gz JUMMWNZXOXGQGS-LJQANCHMSA-N 1 2 310.441 4.127 20 0 DIADLO CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cccc(CC)n1 ZINC001235266125 1054694980 /nfs/dbraw/zinc/69/49/80/1054694980.db2.gz JUMMWNZXOXGQGS-LJQANCHMSA-N 1 2 310.441 4.127 20 0 DIADLO Fc1cccc(C2([NH2+]Cc3ncc(-c4ccccc4)o3)CC2)c1 ZINC000179696458 1054697183 /nfs/dbraw/zinc/69/71/83/1054697183.db2.gz DXFNWRYVUBVPEI-UHFFFAOYSA-N 1 2 308.356 4.260 20 0 DIADLO Cc1cnn(C)c1CNc1[nH+]c2ccccc2n1C1CCCCC1 ZINC000508516254 1054699187 /nfs/dbraw/zinc/69/91/87/1054699187.db2.gz KXYUOFWQWCUFPR-UHFFFAOYSA-N 1 2 323.444 4.196 20 0 DIADLO COc1cc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2)c(F)cn1 ZINC001235325778 1054700394 /nfs/dbraw/zinc/70/03/94/1054700394.db2.gz GEMGZHMHOKSAMD-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1cc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2)c(F)cn1 ZINC001235325778 1054700409 /nfs/dbraw/zinc/70/04/09/1054700409.db2.gz GEMGZHMHOKSAMD-LLVKDONJSA-N 1 2 308.784 4.076 20 0 DIADLO COc1cc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2)c(F)cn1 ZINC001235325780 1054701284 /nfs/dbraw/zinc/70/12/84/1054701284.db2.gz GEMGZHMHOKSAMD-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1cc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2)c(F)cn1 ZINC001235325780 1054701290 /nfs/dbraw/zinc/70/12/90/1054701290.db2.gz GEMGZHMHOKSAMD-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO CC[C@H]([NH2+]Cc1nc2ccccc2o1)c1cc(F)ccc1F ZINC000179794201 1054702725 /nfs/dbraw/zinc/70/27/25/1054702725.db2.gz FVVHLARPAXCAPV-AWEZNQCLSA-N 1 2 302.324 4.347 20 0 DIADLO CCCc1nc(C[NH2+][C@@H](c2ccccc2)C(CC)CC)no1 ZINC000179788482 1054702958 /nfs/dbraw/zinc/70/29/58/1054702958.db2.gz LUOXEYOTDNLOPB-GOSISDBHSA-N 1 2 301.434 4.289 20 0 DIADLO CC[N@H+](Cc1ccc(F)cc1)Cc1cc(F)c(F)c(F)c1F ZINC001235352731 1054706203 /nfs/dbraw/zinc/70/62/03/1054706203.db2.gz XEOFNKJCUOAUCP-UHFFFAOYSA-N 1 2 315.285 4.404 20 0 DIADLO CC[N@@H+](Cc1ccc(F)cc1)Cc1cc(F)c(F)c(F)c1F ZINC001235352731 1054706221 /nfs/dbraw/zinc/70/62/21/1054706221.db2.gz XEOFNKJCUOAUCP-UHFFFAOYSA-N 1 2 315.285 4.404 20 0 DIADLO Cc1cc(C[NH2+][C@H](Cc2ccccc2)c2ccccc2F)no1 ZINC000179811342 1054706599 /nfs/dbraw/zinc/70/65/99/1054706599.db2.gz LZNHHBBYJRJWJD-LJQANCHMSA-N 1 2 310.372 4.196 20 0 DIADLO Cc1[nH]ncc1C[NH2+][C@@H]1CCCc2c3cc(Cl)ccc3[nH]c21 ZINC000623754472 1054727879 /nfs/dbraw/zinc/72/78/79/1054727879.db2.gz OUULIKGLJJSFIM-MRXNPFEDSA-N 1 2 314.820 4.020 20 0 DIADLO CCc1ccc(C(C)(C)[NH2+]Cc2nc(C3CCCC3)no2)cc1 ZINC000180105604 1054733327 /nfs/dbraw/zinc/73/33/27/1054733327.db2.gz DKVMAHODODNHKE-UHFFFAOYSA-N 1 2 313.445 4.315 20 0 DIADLO Cc1ccnc(C[N@H+](C)Cc2cccc3cccnc32)c1Cl ZINC001235586264 1054745715 /nfs/dbraw/zinc/74/57/15/1054745715.db2.gz RLSKMOURNDXKQM-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO Cc1ccnc(C[N@@H+](C)Cc2cccc3cccnc32)c1Cl ZINC001235586264 1054745734 /nfs/dbraw/zinc/74/57/34/1054745734.db2.gz RLSKMOURNDXKQM-UHFFFAOYSA-N 1 2 311.816 4.224 20 0 DIADLO CC[C@H](CC(F)F)c1nc(-c2cccc(-n3cc[nH+]c3)c2)no1 ZINC000351204855 1054755215 /nfs/dbraw/zinc/75/52/15/1054755215.db2.gz GCWCOKWCKCKHLR-LLVKDONJSA-N 1 2 318.327 4.071 20 0 DIADLO Cc1cccc(C[N@@H+](C)Cc2c(C)cncc2Br)c1 ZINC001235635613 1054761154 /nfs/dbraw/zinc/76/11/54/1054761154.db2.gz IYDNVIZHZNVJEL-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cccc(C[N@H+](C)Cc2c(C)cncc2Br)c1 ZINC001235635613 1054761167 /nfs/dbraw/zinc/76/11/67/1054761167.db2.gz IYDNVIZHZNVJEL-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO C[C@]1(C2CC2)COCC[N@@H+]1CCc1cccc(Cl)c1Cl ZINC001473865920 1054763470 /nfs/dbraw/zinc/76/34/70/1054763470.db2.gz ZMTFLUGTUZUCCR-MRXNPFEDSA-N 1 2 314.256 4.037 20 0 DIADLO C[C@]1(C2CC2)COCC[N@H+]1CCc1cccc(Cl)c1Cl ZINC001473865920 1054763488 /nfs/dbraw/zinc/76/34/88/1054763488.db2.gz ZMTFLUGTUZUCCR-MRXNPFEDSA-N 1 2 314.256 4.037 20 0 DIADLO Nc1nc(Cl)ccc1C[N@@H+]1CCCC[C@@H]1c1ccccc1F ZINC001235678975 1054772848 /nfs/dbraw/zinc/77/28/48/1054772848.db2.gz MXMYBIHJUYBRIE-OAHLLOKOSA-N 1 2 319.811 4.184 20 0 DIADLO Nc1nc(Cl)ccc1C[N@H+]1CCCC[C@@H]1c1ccccc1F ZINC001235678975 1054772860 /nfs/dbraw/zinc/77/28/60/1054772860.db2.gz MXMYBIHJUYBRIE-OAHLLOKOSA-N 1 2 319.811 4.184 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2nc3cc(F)ccc3[nH]2)cc1 ZINC001235681373 1054774368 /nfs/dbraw/zinc/77/43/68/1054774368.db2.gz AGGQHJGLZVSABJ-QGZVFWFLSA-N 1 2 313.351 4.178 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2nc3cc(F)ccc3[nH]2)cc1 ZINC001235681373 1054774381 /nfs/dbraw/zinc/77/43/81/1054774381.db2.gz AGGQHJGLZVSABJ-QGZVFWFLSA-N 1 2 313.351 4.178 20 0 DIADLO C/C(=C\c1ccc(C)cc1)C(=O)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001349616917 1054775604 /nfs/dbraw/zinc/77/56/04/1054775604.db2.gz XHDUBQKNSUMPEQ-DTQAZKPQSA-N 1 2 317.392 4.223 20 0 DIADLO Cc1cc(NC[C@@H](Nc2ccccc2)C(C)C)nc(C2CC2)[nH+]1 ZINC000523874661 1054778871 /nfs/dbraw/zinc/77/88/71/1054778871.db2.gz SJQCTQXZBLUWRX-QGZVFWFLSA-N 1 2 310.445 4.211 20 0 DIADLO Cc1cc(NCc2ccc(-c3cccnc3)cc2)nc(C2CC2)[nH+]1 ZINC000525191783 1054783442 /nfs/dbraw/zinc/78/34/42/1054783442.db2.gz YKTRILGRHUYSIG-UHFFFAOYSA-N 1 2 316.408 4.337 20 0 DIADLO COc1ncc(C[N@@H+]2Cc3ccccc3C(C)(C)C2)cc1Cl ZINC001235704789 1054785318 /nfs/dbraw/zinc/78/53/18/1054785318.db2.gz FQJDVQWGSQJEGP-UHFFFAOYSA-N 1 2 316.832 4.037 20 0 DIADLO COc1ncc(C[N@H+]2Cc3ccccc3C(C)(C)C2)cc1Cl ZINC001235704789 1054785334 /nfs/dbraw/zinc/78/53/34/1054785334.db2.gz FQJDVQWGSQJEGP-UHFFFAOYSA-N 1 2 316.832 4.037 20 0 DIADLO COc1ncc(C[N@H+]2CC=C(c3ccccc3)CC2)cc1Cl ZINC001235706544 1054786301 /nfs/dbraw/zinc/78/63/01/1054786301.db2.gz RBTSVRRUOYSMAC-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1ncc(C[N@@H+]2CC=C(c3ccccc3)CC2)cc1Cl ZINC001235706544 1054786314 /nfs/dbraw/zinc/78/63/14/1054786314.db2.gz RBTSVRRUOYSMAC-UHFFFAOYSA-N 1 2 314.816 4.033 20 0 DIADLO COc1ncc(C[N@@H+]2CCC[C@H]2c2ccccc2F)cc1Cl ZINC001235703265 1054786862 /nfs/dbraw/zinc/78/68/62/1054786862.db2.gz ZVBYPOLBPGXPIL-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ncc(C[N@H+]2CCC[C@H]2c2ccccc2F)cc1Cl ZINC001235703265 1054786878 /nfs/dbraw/zinc/78/68/78/1054786878.db2.gz ZVBYPOLBPGXPIL-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@@H]([NH2+][C@@H]1CCCc2scnc21)c1ccccc1OC(F)F ZINC000623856321 1054788857 /nfs/dbraw/zinc/78/88/57/1054788857.db2.gz RVZMYCUONQKFRF-ZYHUDNBSSA-N 1 2 324.396 4.473 20 0 DIADLO Cc1csc([C@@H](C)[NH2+]Cc2cccnc2OC2CCCC2)n1 ZINC000623862132 1054792557 /nfs/dbraw/zinc/79/25/57/1054792557.db2.gz MYEXHNGGOZIGLU-CYBMUJFWSA-N 1 2 317.458 4.019 20 0 DIADLO CO[C@H]1CC[N@H+](Cc2c(F)cc(Cl)cc2Cl)[C@@H](C)C1 ZINC001235740715 1054794236 /nfs/dbraw/zinc/79/42/36/1054794236.db2.gz BQISLLMTCPZJOX-ONGXEEELSA-N 1 2 306.208 4.132 20 0 DIADLO CO[C@H]1CC[N@@H+](Cc2c(F)cc(Cl)cc2Cl)[C@@H](C)C1 ZINC001235740715 1054794250 /nfs/dbraw/zinc/79/42/50/1054794250.db2.gz BQISLLMTCPZJOX-ONGXEEELSA-N 1 2 306.208 4.132 20 0 DIADLO CSC1CC[NH+](Cc2c(F)cc(Cl)cc2Cl)CC1 ZINC001235748332 1054798065 /nfs/dbraw/zinc/79/80/65/1054798065.db2.gz YWBIZWFOQZEBST-UHFFFAOYSA-N 1 2 308.249 4.460 20 0 DIADLO Cc1cc(NCc2csc(C(F)(F)F)c2)nc(C2CC2)[nH+]1 ZINC000624703815 1054800336 /nfs/dbraw/zinc/80/03/36/1054800336.db2.gz JURGDYXUDSPZGJ-UHFFFAOYSA-N 1 2 313.348 4.355 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)c3cccn3C(C)C)c2)[nH+]c1C ZINC000763987815 1054805091 /nfs/dbraw/zinc/80/50/91/1054805091.db2.gz MQXMCDAMPUYTTF-UHFFFAOYSA-N 1 2 322.412 4.328 20 0 DIADLO CC(C)Oc1cc(C(F)(F)F)ccc1-c1cc[nH+]c2c1CCN2 ZINC001235796387 1054807816 /nfs/dbraw/zinc/80/78/16/1054807816.db2.gz DQTFKORGUVNLMK-UHFFFAOYSA-N 1 2 322.330 4.165 20 0 DIADLO C[C@H](Nc1[nH+]c2ccccc2n1C)c1ccccc1OC(F)F ZINC000534243422 1054815594 /nfs/dbraw/zinc/81/55/94/1054815594.db2.gz YVYOLPWKEDBBST-NSHDSACASA-N 1 2 317.339 4.348 20 0 DIADLO Cc1cc2ccccc2[nH+]c1NCCSCC(F)(F)F ZINC000535791605 1054820576 /nfs/dbraw/zinc/82/05/76/1054820576.db2.gz QEVGRKRNDOAEKE-UHFFFAOYSA-N 1 2 300.349 4.251 20 0 DIADLO COc1nccc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c1Cl ZINC001235842668 1054821995 /nfs/dbraw/zinc/82/19/95/1054821995.db2.gz QNKZKFQXVXRQHG-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1nccc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c1Cl ZINC001235842668 1054822011 /nfs/dbraw/zinc/82/20/11/1054822011.db2.gz QNKZKFQXVXRQHG-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1ccccc1[C@H](CO)Nc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC000536389776 1054826128 /nfs/dbraw/zinc/82/61/28/1054826128.db2.gz FHOGHPXCUBJYER-KRWDZBQOSA-N 1 2 313.445 4.177 20 0 DIADLO CC(C)N(C(=O)c1ccc(-c2cccc3[nH+]ccn32)cc1)C(C)C ZINC001235917947 1054847165 /nfs/dbraw/zinc/84/71/65/1054847165.db2.gz CPSVYVUHPFVVSX-UHFFFAOYSA-N 1 2 321.424 4.260 20 0 DIADLO CNc1cc(-c2ccc(C(=O)N(C(C)C)C(C)C)cc2)cc[nH+]1 ZINC001235929690 1054854272 /nfs/dbraw/zinc/85/42/72/1054854272.db2.gz CZLXFRVDLPCTAY-UHFFFAOYSA-N 1 2 311.429 4.049 20 0 DIADLO CCCN(Cc1ccc(F)cc1)C(=O)c1c(C)cc(C)[nH+]c1C ZINC001350048333 1054858104 /nfs/dbraw/zinc/85/81/04/1054858104.db2.gz FCHQWCYPPVSIPG-UHFFFAOYSA-N 1 2 314.404 4.198 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc(OC(F)(F)F)cc1 ZINC001235938883 1054858866 /nfs/dbraw/zinc/85/88/66/1054858866.db2.gz PHJNDWGMUQJKTM-UHFFFAOYSA-N 1 2 308.259 4.137 20 0 DIADLO CC(C)Oc1ccc(Cl)cc1-c1cc(-n2ccnc2)cc[nH+]1 ZINC001235944928 1054864370 /nfs/dbraw/zinc/86/43/70/1054864370.db2.gz PBPMWDNFIZDOQZ-UHFFFAOYSA-N 1 2 313.788 4.375 20 0 DIADLO CC(C)C1=[NH+]CCc2ccc(-c3c(F)cc(F)c(O)c3F)cc21 ZINC001236000478 1054889109 /nfs/dbraw/zinc/88/91/09/1054889109.db2.gz UDNFXDUOGKJDOF-UHFFFAOYSA-N 1 2 319.326 4.478 20 0 DIADLO Cc1cnc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)s1 ZINC000180976962 1054896449 /nfs/dbraw/zinc/89/64/49/1054896449.db2.gz JFXUCFOXVPTOPL-UHFFFAOYSA-N 1 2 300.383 4.127 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000181147539 1054905713 /nfs/dbraw/zinc/90/57/13/1054905713.db2.gz RYHPKCFDSCSEJT-FOIQADDNSA-N 1 2 322.408 4.136 20 0 DIADLO C[C@H](c1nc2ccccc2o1)[N@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000181147539 1054905728 /nfs/dbraw/zinc/90/57/28/1054905728.db2.gz RYHPKCFDSCSEJT-FOIQADDNSA-N 1 2 322.408 4.136 20 0 DIADLO CCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1cc(C)on1 ZINC000181265869 1054908019 /nfs/dbraw/zinc/90/80/19/1054908019.db2.gz UDVGZGBSOZHFTC-QGZVFWFLSA-N 1 2 302.418 4.259 20 0 DIADLO C[C@H]([NH2+]Cc1ncc(-c2ccc(Cl)cc2)o1)c1cccnc1 ZINC000181343326 1054910337 /nfs/dbraw/zinc/91/03/37/1054910337.db2.gz QTEQHSVNNDQENI-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO CCCn1c2ccccc2[nH+]c1NCc1ccc(NC(C)=O)cc1 ZINC000181480218 1054918022 /nfs/dbraw/zinc/91/80/22/1054918022.db2.gz XXNPOPPRJCESGM-UHFFFAOYSA-N 1 2 322.412 4.017 20 0 DIADLO CCC[C@H]([NH2+]Cc1nc(CCC(C)C)no1)c1ccccc1 ZINC000181769243 1054936697 /nfs/dbraw/zinc/93/66/97/1054936697.db2.gz RUNBMOKKYCZTKY-INIZCTEOSA-N 1 2 301.434 4.289 20 0 DIADLO CCCCc1noc(C[NH2+][C@@H](C)c2ccc(SCC)cc2)n1 ZINC000182112058 1054960191 /nfs/dbraw/zinc/96/01/91/1054960191.db2.gz WNOZFTIYNCXAEU-ZDUSSCGKSA-N 1 2 319.474 4.375 20 0 DIADLO Nc1ccnc(Cl)c1C[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001236152577 1054970564 /nfs/dbraw/zinc/97/05/64/1054970564.db2.gz SPNUEKVRGJZCEX-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Nc1ccnc(Cl)c1C[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC001236152577 1054970573 /nfs/dbraw/zinc/97/05/73/1054970573.db2.gz SPNUEKVRGJZCEX-OAHLLOKOSA-N 1 2 322.239 4.308 20 0 DIADLO Cc1ccc([C@H](C)[NH2+]Cc2noc(-c3ccccc3C)n2)cc1 ZINC000182344123 1054982505 /nfs/dbraw/zinc/98/25/05/1054982505.db2.gz BQFLLAQQXCAOHL-HNNXBMFYSA-N 1 2 307.397 4.204 20 0 DIADLO Cc1cc(NC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)c(C)c[nH+]1 ZINC001535599814 1054984337 /nfs/dbraw/zinc/98/43/37/1054984337.db2.gz QSXQCGLFZLZVKG-QZTJIDSGSA-N 1 2 308.425 4.033 20 0 DIADLO CC[C@@H](C)c1ccc(C(=O)NC[C@H]2c3ccccc3C[N@H+]2C)cc1 ZINC001535620603 1054991528 /nfs/dbraw/zinc/99/15/28/1054991528.db2.gz TVWGKSMAPVHLKB-QRWLVFNGSA-N 1 2 322.452 4.117 20 0 DIADLO CC[C@@H](C)c1ccc(C(=O)NC[C@H]2c3ccccc3C[N@@H+]2C)cc1 ZINC001535620603 1054991540 /nfs/dbraw/zinc/99/15/40/1054991540.db2.gz TVWGKSMAPVHLKB-QRWLVFNGSA-N 1 2 322.452 4.117 20 0 DIADLO Cc1cc(C)cc([C@H](C)[NH2+]Cc2nc(CCC(C)C)no2)c1 ZINC000182894212 1055017060 /nfs/dbraw/zinc/01/70/60/1055017060.db2.gz AHEFBGLNYUXSRE-HNNXBMFYSA-N 1 2 301.434 4.126 20 0 DIADLO CC(C)C(=O)Nc1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001236259889 1055040441 /nfs/dbraw/zinc/04/04/41/1055040441.db2.gz CXQVUDIJTNENNT-UHFFFAOYSA-N 1 2 305.381 4.134 20 0 DIADLO CCOc1ccc(Cc2cccc(-c3ccc(N)[nH+]c3)c2)cc1 ZINC001236311615 1055052998 /nfs/dbraw/zinc/05/29/98/1055052998.db2.gz CVAIVYSGVASBME-UHFFFAOYSA-N 1 2 304.393 4.320 20 0 DIADLO Cc1cccc([C@H](C)[NH2+]Cc2nc(CCC(C)C)no2)c1C ZINC000183714960 1055053281 /nfs/dbraw/zinc/05/32/81/1055053281.db2.gz MPNUDUUITLXOAP-HNNXBMFYSA-N 1 2 301.434 4.126 20 0 DIADLO COc1cccc(OC)c1-c1ccc(-c2ccc(N)[nH+]c2)cc1 ZINC001236315638 1055053693 /nfs/dbraw/zinc/05/36/93/1055053693.db2.gz BLLOLNGQFZKAMI-UHFFFAOYSA-N 1 2 306.365 4.015 20 0 DIADLO COc1cc(Cl)c(C[N@H+](C)Cc2ccncc2)cc1Cl ZINC000183742485 1055055952 /nfs/dbraw/zinc/05/59/52/1055055952.db2.gz CIIFZWWIPZWJSB-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1cc(Cl)c(C[N@@H+](C)Cc2ccncc2)cc1Cl ZINC000183742485 1055055962 /nfs/dbraw/zinc/05/59/62/1055055962.db2.gz CIIFZWWIPZWJSB-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO C[C@H](c1cccnc1)[N@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000183730242 1055056403 /nfs/dbraw/zinc/05/64/03/1055056403.db2.gz GAOBURSDPRJANW-LLVKDONJSA-N 1 2 312.310 4.433 20 0 DIADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000183730242 1055056417 /nfs/dbraw/zinc/05/64/17/1055056417.db2.gz GAOBURSDPRJANW-LLVKDONJSA-N 1 2 312.310 4.433 20 0 DIADLO CCCOc1c(F)c(F)c(-c2ccn3cc[nH+]c3c2)c(F)c1F ZINC001236326799 1055058403 /nfs/dbraw/zinc/05/84/03/1055058403.db2.gz BSFAOUXXCKPTQK-UHFFFAOYSA-N 1 2 324.277 4.347 20 0 DIADLO Cc1cn2cc(NC(=O)[C@@H]3C[C@H]3c3ccc(C)c(C)c3)ccc2[nH+]1 ZINC001536222659 1055062002 /nfs/dbraw/zinc/06/20/02/1055062002.db2.gz DTDUWPYOCDAGLZ-ZWKOTPCHSA-N 1 2 319.408 4.002 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ccc(F)c(OC(C)C)c1F ZINC001236343449 1055068780 /nfs/dbraw/zinc/06/87/80/1055068780.db2.gz HQQMIDWFBHIAQA-UHFFFAOYSA-N 1 2 306.356 4.188 20 0 DIADLO Cc1cc(-c2ccc(F)c(OC(C)C)c2F)c2[nH+]ccn2c1 ZINC001236345486 1055069342 /nfs/dbraw/zinc/06/93/42/1055069342.db2.gz VLCRIPOENALDKK-UHFFFAOYSA-N 1 2 302.324 4.375 20 0 DIADLO Nc1[nH+]cccc1-c1ccc(C(F)(F)F)cc1C(F)(F)F ZINC001236380852 1055085015 /nfs/dbraw/zinc/08/50/15/1055085015.db2.gz SDTRCRIEOSQARF-UHFFFAOYSA-N 1 2 306.209 4.368 20 0 DIADLO Nc1cc(-c2ccc(C(F)(F)F)cc2C(F)(F)F)cc[nH+]1 ZINC001236381536 1055085558 /nfs/dbraw/zinc/08/55/58/1055085558.db2.gz UHXFBEAJSVCSCX-UHFFFAOYSA-N 1 2 306.209 4.368 20 0 DIADLO COc1cc(OC(F)(F)F)ccc1-c1cn2cc[nH+]c2cc1C ZINC001236381789 1055087272 /nfs/dbraw/zinc/08/72/72/1055087272.db2.gz KVIQLGOIOQGFOC-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000185409883 1055091002 /nfs/dbraw/zinc/09/10/02/1055091002.db2.gz HQNODFACQCBFBC-HOTGVXAUSA-N 1 2 321.424 4.381 20 0 DIADLO CCCCn1c(SC(CC)CC)nnc1[C@H](CC)[NH+](C)C ZINC000185380646 1055091256 /nfs/dbraw/zinc/09/12/56/1055091256.db2.gz OIFMUAHSDARIBO-AWEZNQCLSA-N 1 2 312.527 4.372 20 0 DIADLO CCOc1ncc(Cl)cc1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001236496178 1055147681 /nfs/dbraw/zinc/14/76/81/1055147681.db2.gz VETHZCOQTNQYPK-UHFFFAOYSA-N 1 2 313.788 4.201 20 0 DIADLO Cc1cc(CNC(=O)c2coc3ccc(C(C)C)cc23)cc(C)[nH+]1 ZINC001536667210 1055150215 /nfs/dbraw/zinc/15/02/15/1055150215.db2.gz QOSYAIQVLMVQPR-UHFFFAOYSA-N 1 2 322.408 4.498 20 0 DIADLO FC(F)(F)c1cc(C[N@@H+]2CCC3(CCC3)C2)cnc1Cl ZINC001236625983 1055206229 /nfs/dbraw/zinc/20/62/29/1055206229.db2.gz NYUUKACDFQUKEB-UHFFFAOYSA-N 1 2 304.743 4.130 20 0 DIADLO FC(F)(F)c1cc(C[N@H+]2CCC3(CCC3)C2)cnc1Cl ZINC001236625983 1055206238 /nfs/dbraw/zinc/20/62/38/1055206238.db2.gz NYUUKACDFQUKEB-UHFFFAOYSA-N 1 2 304.743 4.130 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCSc3ccccc3C2)n1 ZINC001236650199 1055212208 /nfs/dbraw/zinc/21/22/08/1055212208.db2.gz GJSPRNPLKXFUDU-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCSc3ccccc3C2)n1 ZINC001236650199 1055212223 /nfs/dbraw/zinc/21/22/23/1055212223.db2.gz GJSPRNPLKXFUDU-UHFFFAOYSA-N 1 2 304.846 4.151 20 0 DIADLO CCOC1CC[NH+](Cc2cc(Cl)c(F)c(Cl)c2)CC1 ZINC001236661032 1055215389 /nfs/dbraw/zinc/21/53/89/1055215389.db2.gz HRTAYRNHYHOMKU-UHFFFAOYSA-N 1 2 306.208 4.133 20 0 DIADLO Fc1c(Cl)cc(C[N@@H+]2CC[C@@]3(C2)CCCCO3)cc1Cl ZINC001236654083 1055215766 /nfs/dbraw/zinc/21/57/66/1055215766.db2.gz UGFZZZFOPUCSRE-OAHLLOKOSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1c(Cl)cc(C[N@H+]2CC[C@@]3(C2)CCCCO3)cc1Cl ZINC001236654083 1055215779 /nfs/dbraw/zinc/21/57/79/1055215779.db2.gz UGFZZZFOPUCSRE-OAHLLOKOSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1cc(-c2ccc(Cl)cc2)ccc1C[NH2+]Cc1cnc[nH]1 ZINC001620835338 1055220814 /nfs/dbraw/zinc/22/08/14/1055220814.db2.gz DSIXGTQOXIRXBS-UHFFFAOYSA-N 1 2 315.779 4.159 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cc3ccccc3cc1OC)C2 ZINC001236676389 1055225443 /nfs/dbraw/zinc/22/54/43/1055225443.db2.gz YQBCMGFOMJIBAM-UHFFFAOYSA-N 1 2 319.404 4.373 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cc3ccccc3cc1OC)C2 ZINC001236676389 1055225455 /nfs/dbraw/zinc/22/54/55/1055225455.db2.gz YQBCMGFOMJIBAM-UHFFFAOYSA-N 1 2 319.404 4.373 20 0 DIADLO C[C@@H]1CC[N@@H+]1Cc1c(F)cc(OCc2ccccc2)cc1F ZINC001236703499 1055231953 /nfs/dbraw/zinc/23/19/53/1055231953.db2.gz RUDHBPAJVQAKPH-CYBMUJFWSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@@H]1CC[N@H+]1Cc1c(F)cc(OCc2ccccc2)cc1F ZINC001236703499 1055231966 /nfs/dbraw/zinc/23/19/66/1055231966.db2.gz RUDHBPAJVQAKPH-CYBMUJFWSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@H]1CC[N@@H+]1Cc1c(F)cc(OCc2ccccc2)cc1F ZINC001236703504 1055234313 /nfs/dbraw/zinc/23/43/13/1055234313.db2.gz RUDHBPAJVQAKPH-ZDUSSCGKSA-N 1 2 303.352 4.138 20 0 DIADLO C[C@H]1CC[N@H+]1Cc1c(F)cc(OCc2ccccc2)cc1F ZINC001236703504 1055234322 /nfs/dbraw/zinc/23/43/22/1055234322.db2.gz RUDHBPAJVQAKPH-ZDUSSCGKSA-N 1 2 303.352 4.138 20 0 DIADLO CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1ccc(F)c(O)c1 ZINC001236708754 1055237287 /nfs/dbraw/zinc/23/72/87/1055237287.db2.gz SWFKTZKNSCDBOE-KRWDZBQOSA-N 1 2 315.388 4.015 20 0 DIADLO Oc1cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2F)ccc1F ZINC001236707747 1055238102 /nfs/dbraw/zinc/23/81/02/1055238102.db2.gz KJESBPJFBRQNNK-INIZCTEOSA-N 1 2 307.315 4.147 20 0 DIADLO CC[C@H](NC(=O)Nc1cc(C)[nH+]cc1C)c1cc(C)ccc1C ZINC001562518406 1055241372 /nfs/dbraw/zinc/24/13/72/1055241372.db2.gz LGMFFBBNOKVSLT-KRWDZBQOSA-N 1 2 311.429 4.010 20 0 DIADLO Cc1cc(Br)sc1C[N@@H+]1CCC[C@@](C)(F)C1 ZINC001236823494 1055276276 /nfs/dbraw/zinc/27/62/76/1055276276.db2.gz ARPWLIGKJILQBU-GFCCVEGCSA-N 1 2 306.244 4.143 20 0 DIADLO Cc1cc(Br)sc1C[N@H+]1CCC[C@@](C)(F)C1 ZINC001236823494 1055276287 /nfs/dbraw/zinc/27/62/87/1055276287.db2.gz ARPWLIGKJILQBU-GFCCVEGCSA-N 1 2 306.244 4.143 20 0 DIADLO CCCCC[C@H](NC(=O)Nc1ccn2cc[nH+]c2c1)C(C)(C)C ZINC001562742856 1055279733 /nfs/dbraw/zinc/27/97/33/1055279733.db2.gz YBGSOUMAAIETFR-HNNXBMFYSA-N 1 2 316.449 4.451 20 0 DIADLO C[C@H](c1ccncc1)[N@H+](C)Cc1cccc(F)c1Br ZINC000383778681 1055301505 /nfs/dbraw/zinc/30/15/05/1055301505.db2.gz WOHMIKZXDFHUJZ-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1cccc(F)c1Br ZINC000383778681 1055301519 /nfs/dbraw/zinc/30/15/19/1055301519.db2.gz WOHMIKZXDFHUJZ-LLVKDONJSA-N 1 2 323.209 4.176 20 0 DIADLO Cc1cccc(-c2ccc(C[N@H+](C)Cc3cncs3)cn2)c1C ZINC001236988113 1055323597 /nfs/dbraw/zinc/32/35/97/1055323597.db2.gz HOFGDJZEMYDGKV-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO Cc1cccc(-c2ccc(C[N@@H+](C)Cc3cncs3)cn2)c1C ZINC001236988113 1055323612 /nfs/dbraw/zinc/32/36/12/1055323612.db2.gz HOFGDJZEMYDGKV-UHFFFAOYSA-N 1 2 323.465 4.454 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2ccc(-c3ccccc3F)nc2)C[C@@H]1F ZINC001236987382 1055326573 /nfs/dbraw/zinc/32/65/73/1055326573.db2.gz LGDRBMMAVTWDPG-ROUUACIJSA-N 1 2 320.358 4.160 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2ccc(-c3ccccc3F)nc2)C[C@@H]1F ZINC001236987382 1055326591 /nfs/dbraw/zinc/32/65/91/1055326591.db2.gz LGDRBMMAVTWDPG-ROUUACIJSA-N 1 2 320.358 4.160 20 0 DIADLO Cc1ccc(-c2cncc(C[N@@H+]3CC[C@@](C)(F)[C@@H](F)C3)c2)cc1 ZINC001236990507 1055329491 /nfs/dbraw/zinc/32/94/91/1055329491.db2.gz HLFMNDWEKUAZMK-RBUKOAKNSA-N 1 2 316.395 4.329 20 0 DIADLO Cc1ccc(-c2cncc(C[N@H+]3CC[C@@](C)(F)[C@@H](F)C3)c2)cc1 ZINC001236990507 1055329505 /nfs/dbraw/zinc/32/95/05/1055329505.db2.gz HLFMNDWEKUAZMK-RBUKOAKNSA-N 1 2 316.395 4.329 20 0 DIADLO Cc1ccc(-c2cncc(C[N@H+](C)Cc3cncs3)c2)cc1 ZINC001237002911 1055336505 /nfs/dbraw/zinc/33/65/05/1055336505.db2.gz OBLXPYSMCSXLSC-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1ccc(-c2cncc(C[N@@H+](C)Cc3cncs3)c2)cc1 ZINC001237002911 1055336521 /nfs/dbraw/zinc/33/65/21/1055336521.db2.gz OBLXPYSMCSXLSC-UHFFFAOYSA-N 1 2 309.438 4.146 20 0 DIADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccccc2OC(C)(C)C)no1 ZINC001237027792 1055346559 /nfs/dbraw/zinc/34/65/59/1055346559.db2.gz UANQPZVVCPMRGT-QGZVFWFLSA-N 1 2 314.429 4.497 20 0 DIADLO Cc1cc([C@H]2CCC[N@H+]2Cc2ccccc2OC(C)(C)C)no1 ZINC001237027792 1055346576 /nfs/dbraw/zinc/34/65/76/1055346576.db2.gz UANQPZVVCPMRGT-QGZVFWFLSA-N 1 2 314.429 4.497 20 0 DIADLO Cc1cc(NC(=O)[C@H](CC2CCCCC2)C(C)C)c(C)c[nH+]1 ZINC001537540143 1055353600 /nfs/dbraw/zinc/35/36/00/1055353600.db2.gz MSIUUKAXSGMKSY-QGZVFWFLSA-N 1 2 302.462 4.301 20 0 DIADLO CC[C@H](C)c1cccc(NC(=O)c2ccn3c(C)c[nH+]c3c2)c1 ZINC001587734001 1055354041 /nfs/dbraw/zinc/35/40/41/1055354041.db2.gz IPFQPZZNQNQDKI-ZDUSSCGKSA-N 1 2 307.397 4.409 20 0 DIADLO Oc1cc2ccccc2c(C[N@@H+]2CCc3ncc(Cl)cc3C2)c1 ZINC001237076607 1055360717 /nfs/dbraw/zinc/36/07/17/1055360717.db2.gz NEXGQYNZLUORNW-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO Oc1cc2ccccc2c(C[N@H+]2CCc3ncc(Cl)cc3C2)c1 ZINC001237076607 1055360732 /nfs/dbraw/zinc/36/07/32/1055360732.db2.gz NEXGQYNZLUORNW-UHFFFAOYSA-N 1 2 324.811 4.152 20 0 DIADLO COc1ccc2c(c1)C[N@@H+](Cc1cccc(OC(C)(C)C)c1)C2 ZINC001237104024 1055371881 /nfs/dbraw/zinc/37/18/81/1055371881.db2.gz WXCLOZGWKXLDOX-UHFFFAOYSA-N 1 2 311.425 4.388 20 0 DIADLO COc1ccc2c(c1)C[N@H+](Cc1cccc(OC(C)(C)C)c1)C2 ZINC001237104024 1055371894 /nfs/dbraw/zinc/37/18/94/1055371894.db2.gz WXCLOZGWKXLDOX-UHFFFAOYSA-N 1 2 311.425 4.388 20 0 DIADLO C[C@@]1(F)CC[N@H+](Cc2ccnc3c(Cl)cccc23)C[C@@H]1F ZINC001237151727 1055387483 /nfs/dbraw/zinc/38/74/83/1055387483.db2.gz ZTSCOVLQKBUZCG-GOEBONIOSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@@]1(F)CC[N@@H+](Cc2ccnc3c(Cl)cccc23)C[C@@H]1F ZINC001237151727 1055387497 /nfs/dbraw/zinc/38/74/97/1055387497.db2.gz ZTSCOVLQKBUZCG-GOEBONIOSA-N 1 2 310.775 4.160 20 0 DIADLO CCC(CC)Oc1ccc(C(=O)Nc2ccc3[nH+]ccn3c2)cc1 ZINC001587889578 1055391635 /nfs/dbraw/zinc/39/16/35/1055391635.db2.gz HTOFDJCCZGDGBW-UHFFFAOYSA-N 1 2 323.396 4.154 20 0 DIADLO COc1ccc2cc(C[NH2+]Cc3nc(C(C)(C)C)co3)ccc2c1 ZINC000921514203 1055401772 /nfs/dbraw/zinc/40/17/72/1055401772.db2.gz UCMGETDYBDYPTC-UHFFFAOYSA-N 1 2 324.424 4.424 20 0 DIADLO CC1(C[NH2+]c2ccc(N3CCSCC3)c(Cl)c2)CCC1 ZINC001620839328 1055403637 /nfs/dbraw/zinc/40/36/37/1055403637.db2.gz MLQYPVMGIMQGHT-UHFFFAOYSA-N 1 2 310.894 4.495 20 0 DIADLO COc1nc(Cl)ccc1C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC001237244030 1055407992 /nfs/dbraw/zinc/40/79/92/1055407992.db2.gz KIZOCMJPOQMAAC-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO COc1nc(Cl)ccc1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC001237244030 1055408001 /nfs/dbraw/zinc/40/80/01/1055408001.db2.gz KIZOCMJPOQMAAC-GFCCVEGCSA-N 1 2 308.834 4.142 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2ccc3nccc(Cl)c3c2)C[C@@H]1F ZINC001237265281 1055408997 /nfs/dbraw/zinc/40/89/97/1055408997.db2.gz RHDMKUANNNWQFL-HOTGVXAUSA-N 1 2 310.775 4.160 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2ccc3nccc(Cl)c3c2)C[C@@H]1F ZINC001237265281 1055409004 /nfs/dbraw/zinc/40/90/04/1055409004.db2.gz RHDMKUANNNWQFL-HOTGVXAUSA-N 1 2 310.775 4.160 20 0 DIADLO C[N@H+](Cc1cc(O)cc(F)c1)Cc1cccc(Cl)c1Cl ZINC001237276526 1055415988 /nfs/dbraw/zinc/41/59/88/1055415988.db2.gz GSMQDGCICKAADO-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO C[N@@H+](Cc1cc(O)cc(F)c1)Cc1cccc(Cl)c1Cl ZINC001237276526 1055415991 /nfs/dbraw/zinc/41/59/91/1055415991.db2.gz GSMQDGCICKAADO-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)Cc3cccc4ccccc43)cc2[nH+]1 ZINC000010895954 1055420355 /nfs/dbraw/zinc/42/03/55/1055420355.db2.gz RZBRNTMXVKAQIE-UHFFFAOYSA-N 1 2 315.376 4.206 20 0 DIADLO CC(C)(C)OC(=O)Nc1ccc(Cl)cc1C[NH+]1CC=CC1 ZINC001237366251 1055442711 /nfs/dbraw/zinc/44/27/11/1055442711.db2.gz DREZGCNNIUEKSG-UHFFFAOYSA-N 1 2 308.809 4.059 20 0 DIADLO CC(C)[N@H+](Cc1ccccc1)Cc1cnccc1Br ZINC001237385900 1055443939 /nfs/dbraw/zinc/44/39/39/1055443939.db2.gz VSLGPXRMAYAZDG-UHFFFAOYSA-N 1 2 319.246 4.255 20 0 DIADLO CC(C)[N@@H+](Cc1ccccc1)Cc1cnccc1Br ZINC001237385900 1055443952 /nfs/dbraw/zinc/44/39/52/1055443952.db2.gz VSLGPXRMAYAZDG-UHFFFAOYSA-N 1 2 319.246 4.255 20 0 DIADLO Clc1cccc([C@@H]2CCC[N@@H+]2Cc2cc3ccccn3n2)c1 ZINC001237448658 1055453073 /nfs/dbraw/zinc/45/30/73/1055453073.db2.gz ICSJNVMWYNXLDZ-SFHVURJKSA-N 1 2 311.816 4.325 20 0 DIADLO Clc1cccc([C@@H]2CCC[N@H+]2Cc2cc3ccccn3n2)c1 ZINC001237448658 1055453078 /nfs/dbraw/zinc/45/30/78/1055453078.db2.gz ICSJNVMWYNXLDZ-SFHVURJKSA-N 1 2 311.816 4.325 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1nc(-c2ccsc2)no1 ZINC000016431656 1055455463 /nfs/dbraw/zinc/45/54/63/1055455463.db2.gz GVULRPKNONXVRJ-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc(-c2ccsc2)no1 ZINC000016431656 1055455471 /nfs/dbraw/zinc/45/54/71/1055455471.db2.gz GVULRPKNONXVRJ-NSHDSACASA-N 1 2 317.389 4.130 20 0 DIADLO CC[C@H]1CCC[N@@H+]1Cc1c(F)ccc(Br)c1F ZINC000230341035 1055455570 /nfs/dbraw/zinc/45/55/70/1055455570.db2.gz MXOSUKPXRHMUSN-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO CC[C@H]1CCC[N@H+]1Cc1c(F)ccc(Br)c1F ZINC000230341035 1055455577 /nfs/dbraw/zinc/45/55/77/1055455577.db2.gz MXOSUKPXRHMUSN-VIFPVBQESA-N 1 2 304.178 4.102 20 0 DIADLO CC1(F)CC[NH+](Cc2cc(Cl)nc(C(F)(F)F)c2)CC1 ZINC001237491308 1055458384 /nfs/dbraw/zinc/45/83/84/1055458384.db2.gz MZWRUYRBYVVNTJ-UHFFFAOYSA-N 1 2 310.722 4.078 20 0 DIADLO Cc1cc(NC(=O)c2cc3c(s2)CCCCCC3)cc[nH+]1 ZINC000017820872 1055465511 /nfs/dbraw/zinc/46/55/11/1055465511.db2.gz BTLXMAOEWVTZEQ-UHFFFAOYSA-N 1 2 300.427 4.363 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cccc(-c2ccccc2)n1 ZINC001237547335 1055471775 /nfs/dbraw/zinc/47/17/75/1055471775.db2.gz SIZUCAWTJVBZCY-MRXNPFEDSA-N 1 2 303.409 4.127 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cccc(-c2ccccc2)n1 ZINC001237547335 1055471784 /nfs/dbraw/zinc/47/17/84/1055471784.db2.gz SIZUCAWTJVBZCY-MRXNPFEDSA-N 1 2 303.409 4.127 20 0 DIADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nc(CC(C)C)no2)c(C)c1 ZINC000615464420 1055471851 /nfs/dbraw/zinc/47/18/51/1055471851.db2.gz YASLSXPOQCZQBS-OAHLLOKOSA-N 1 2 301.434 4.078 20 0 DIADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2nc(CC(C)C)no2)c(C)c1 ZINC000615464420 1055471859 /nfs/dbraw/zinc/47/18/59/1055471859.db2.gz YASLSXPOQCZQBS-OAHLLOKOSA-N 1 2 301.434 4.078 20 0 DIADLO C[C@]1(F)CC[N@H+](Cc2cccc(-c3ccccc3)n2)C[C@H]1F ZINC001237543735 1055472787 /nfs/dbraw/zinc/47/27/87/1055472787.db2.gz ZLCXKOJGVVRKGY-MSOLQXFVSA-N 1 2 302.368 4.021 20 0 DIADLO C[C@]1(F)CC[N@@H+](Cc2cccc(-c3ccccc3)n2)C[C@H]1F ZINC001237543735 1055472794 /nfs/dbraw/zinc/47/27/94/1055472794.db2.gz ZLCXKOJGVVRKGY-MSOLQXFVSA-N 1 2 302.368 4.021 20 0 DIADLO CN(C)c1ccc(NCc2ccc(-c3ccccc3)s2)[nH+]c1 ZINC001620844241 1055473011 /nfs/dbraw/zinc/47/30/11/1055473011.db2.gz JKQDOKAGFVPOMX-UHFFFAOYSA-N 1 2 309.438 4.488 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3ccc4c(c3)CCCO4)ccc21 ZINC001620851737 1055479065 /nfs/dbraw/zinc/47/90/65/1055479065.db2.gz HTBNLOYQXFZEKC-UHFFFAOYSA-N 1 2 308.425 4.006 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3ccc4c(c3)CCCO4)ccc21 ZINC001620851737 1055479073 /nfs/dbraw/zinc/47/90/73/1055479073.db2.gz HTBNLOYQXFZEKC-UHFFFAOYSA-N 1 2 308.425 4.006 20 0 DIADLO Fc1cc(Cl)c(C[N@@H+]2CC[C@@]3(C2)CCCCO3)c(Cl)c1 ZINC001237594107 1055482099 /nfs/dbraw/zinc/48/20/99/1055482099.db2.gz RUXQLCSWQYENKA-OAHLLOKOSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1cc(Cl)c(C[N@H+]2CC[C@@]3(C2)CCCCO3)c(Cl)c1 ZINC001237594107 1055482111 /nfs/dbraw/zinc/48/21/11/1055482111.db2.gz RUXQLCSWQYENKA-OAHLLOKOSA-N 1 2 318.219 4.278 20 0 DIADLO Fc1cc(Cl)c(C[N@@H+]2CC[C@@H]3CCCO[C@@H]3C2)c(Cl)c1 ZINC001237594785 1055482898 /nfs/dbraw/zinc/48/28/98/1055482898.db2.gz WWIUMWKOQQGRED-ZUZCIYMTSA-N 1 2 318.219 4.133 20 0 DIADLO Fc1cc(Cl)c(C[N@H+]2CC[C@@H]3CCCO[C@@H]3C2)c(Cl)c1 ZINC001237594785 1055482904 /nfs/dbraw/zinc/48/29/04/1055482904.db2.gz WWIUMWKOQQGRED-ZUZCIYMTSA-N 1 2 318.219 4.133 20 0 DIADLO Cc1coc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3Cl)C2)n1 ZINC001237645463 1055493505 /nfs/dbraw/zinc/49/35/05/1055493505.db2.gz LFNPQMAJDSYDFJ-NSHDSACASA-N 1 2 311.212 4.279 20 0 DIADLO Cc1coc(C[N@H+]2CC[C@H](c3cccc(Cl)c3Cl)C2)n1 ZINC001237645463 1055493517 /nfs/dbraw/zinc/49/35/17/1055493517.db2.gz LFNPQMAJDSYDFJ-NSHDSACASA-N 1 2 311.212 4.279 20 0 DIADLO Cc1ccc(NCc2cccc(C(=O)OC(C)(C)C)c2)c(C)[nH+]1 ZINC001620869745 1055497938 /nfs/dbraw/zinc/49/79/38/1055497938.db2.gz SNCLUGWWTJJRPL-UHFFFAOYSA-N 1 2 312.413 4.266 20 0 DIADLO CC(=O)C1CC[NH+](Cc2cc(C)c(Cl)cc2Cl)CC1 ZINC001237704089 1055509352 /nfs/dbraw/zinc/50/93/52/1055509352.db2.gz VQTRHULDWUXQLB-UHFFFAOYSA-N 1 2 300.229 4.103 20 0 DIADLO Cc1nnc([C@@H](C)[NH2+]Cc2cc3cc(C)c(C)cc3o2)s1 ZINC001620895588 1055521402 /nfs/dbraw/zinc/52/14/02/1055521402.db2.gz HSZKVIYYYMXQII-LLVKDONJSA-N 1 2 301.415 4.060 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1ncc(Cl)cc1Br ZINC001237761471 1055525358 /nfs/dbraw/zinc/52/53/58/1055525358.db2.gz VTFQDJYTTMIHQK-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ncc(Cl)cc1Br ZINC001237758244 1055524557 /nfs/dbraw/zinc/52/45/57/1055524557.db2.gz MXOMDOANZBNZBQ-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ncc(Cl)cc1Br ZINC001237758244 1055524567 /nfs/dbraw/zinc/52/45/67/1055524567.db2.gz MXOMDOANZBNZBQ-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[N@H+](Cc1cc(-c2cccc(Cl)c2)no1)Cc1cccnc1 ZINC001237767005 1055524658 /nfs/dbraw/zinc/52/46/58/1055524658.db2.gz OAKHSLHTQOXMLC-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1cc(-c2cccc(Cl)c2)no1)Cc1cccnc1 ZINC001237767005 1055524667 /nfs/dbraw/zinc/52/46/67/1055524667.db2.gz OAKHSLHTQOXMLC-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1ncc(Cl)cc1Br ZINC001237761471 1055525345 /nfs/dbraw/zinc/52/53/45/1055525345.db2.gz VTFQDJYTTMIHQK-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ncc(Cl)cc2Br)[C@H](C)C1 ZINC001237761465 1055525898 /nfs/dbraw/zinc/52/58/98/1055525898.db2.gz VTFQDJYTTMIHQK-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ncc(Cl)cc2Br)[C@H](C)C1 ZINC001237761465 1055525908 /nfs/dbraw/zinc/52/59/08/1055525908.db2.gz VTFQDJYTTMIHQK-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2ncc(Cl)cc2Br)[C@H]1C ZINC001237758243 1055526898 /nfs/dbraw/zinc/52/68/98/1055526898.db2.gz MXOMDOANZBNZBQ-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2ncc(Cl)cc2Br)[C@H]1C ZINC001237758243 1055526913 /nfs/dbraw/zinc/52/69/13/1055526913.db2.gz MXOMDOANZBNZBQ-UWVGGRQHSA-N 1 2 317.658 4.118 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c(Cl)n1 ZINC001237792299 1055529749 /nfs/dbraw/zinc/52/97/49/1055529749.db2.gz OTJGWSVIGCDFFA-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c(Cl)n1 ZINC001237792299 1055529766 /nfs/dbraw/zinc/52/97/66/1055529766.db2.gz OTJGWSVIGCDFFA-HNNXBMFYSA-N 1 2 320.795 4.220 20 0 DIADLO CC[C@H]([NH2+]Cc1nc(C)c2ccccc2n1)c1ccccc1OC ZINC000765637807 1055531319 /nfs/dbraw/zinc/53/13/19/1055531319.db2.gz HUVSBWZZBNGHTG-KRWDZBQOSA-N 1 2 321.424 4.188 20 0 DIADLO CCc1c(NCc2cc(C)[nH+]c(C)c2)cnn1-c1ccccc1C ZINC001620923034 1055542538 /nfs/dbraw/zinc/54/25/38/1055542538.db2.gz URXVQNICQOMYLV-UHFFFAOYSA-N 1 2 320.440 4.367 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccccc3C(C)(F)F)n2c1 ZINC001620940871 1055553487 /nfs/dbraw/zinc/55/34/87/1055553487.db2.gz IFEANSIRLLSISV-UHFFFAOYSA-N 1 2 301.340 4.367 20 0 DIADLO Cc1sccc1C[N@@H+]1CCc2cc(Br)ccc2C1 ZINC001237965453 1055567531 /nfs/dbraw/zinc/56/75/31/1055567531.db2.gz YXBNBHUDZSBALG-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1sccc1C[N@H+]1CCc2cc(Br)ccc2C1 ZINC001237965453 1055567540 /nfs/dbraw/zinc/56/75/40/1055567540.db2.gz YXBNBHUDZSBALG-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[N@@H+]1CCC[C@H]2CCCC[C@H]21 ZINC001237997363 1055577541 /nfs/dbraw/zinc/57/75/41/1055577541.db2.gz DJRSRSOPRQOSGP-SJKOYZFVSA-N 1 2 303.837 4.371 20 0 DIADLO Clc1ccc2c(c1)[nH]nc2C[N@H+]1CCC[C@H]2CCCC[C@H]21 ZINC001237997363 1055577547 /nfs/dbraw/zinc/57/75/47/1055577547.db2.gz DJRSRSOPRQOSGP-SJKOYZFVSA-N 1 2 303.837 4.371 20 0 DIADLO F[C@H]1CCC2(C1)CC[NH+](Cc1n[nH]c3cc(Cl)ccc31)CC2 ZINC001237997341 1055578173 /nfs/dbraw/zinc/57/81/73/1055578173.db2.gz ADQUMTCQUOODLQ-ZDUSSCGKSA-N 1 2 321.827 4.321 20 0 DIADLO F[C@@H]1CCC2(C1)CC[NH+](Cc1n[nH]c3cc(Cl)ccc31)CC2 ZINC001237997338 1055578843 /nfs/dbraw/zinc/57/88/43/1055578843.db2.gz ADQUMTCQUOODLQ-CYBMUJFWSA-N 1 2 321.827 4.321 20 0 DIADLO c1nn(C2CCC2)cc1C[NH2+]Cc1csc(-c2ccccc2)n1 ZINC000921605541 1055579290 /nfs/dbraw/zinc/57/92/90/1055579290.db2.gz CCCHDIXUAPNLAN-UHFFFAOYSA-N 1 2 324.453 4.021 20 0 DIADLO Oc1c(F)cc(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)cc1Cl ZINC001237998806 1055581292 /nfs/dbraw/zinc/58/12/92/1055581292.db2.gz XIHCYJOMNKAJDY-ZDUSSCGKSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1c(F)cc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)cc1Cl ZINC001237998806 1055581305 /nfs/dbraw/zinc/58/13/05/1055581305.db2.gz XIHCYJOMNKAJDY-ZDUSSCGKSA-N 1 2 323.770 4.313 20 0 DIADLO Clc1cncc(C[NH+]2CCC(c3cccnc3)CC2)c1Cl ZINC001238016511 1055584165 /nfs/dbraw/zinc/58/41/65/1055584165.db2.gz XTQKYZRSPFLDAF-UHFFFAOYSA-N 1 2 322.239 4.163 20 0 DIADLO C[N@H+](Cc1scnc1Br)[C@@H]1CCc2ccccc21 ZINC001238039365 1055589871 /nfs/dbraw/zinc/58/98/71/1055589871.db2.gz OBXTZDOMZZRLCX-GFCCVEGCSA-N 1 2 323.259 4.025 20 0 DIADLO C[N@@H+](Cc1scnc1Br)[C@@H]1CCc2ccccc21 ZINC001238039365 1055589884 /nfs/dbraw/zinc/58/98/84/1055589884.db2.gz OBXTZDOMZZRLCX-GFCCVEGCSA-N 1 2 323.259 4.025 20 0 DIADLO Cc1ccc(-c2nc(C[N@@H+](C)C3CC(F)(F)C3)cs2)cc1 ZINC001238036523 1055591837 /nfs/dbraw/zinc/59/18/37/1055591837.db2.gz IXZJENUAIALZPO-UHFFFAOYSA-N 1 2 308.397 4.348 20 0 DIADLO Cc1ccc(-c2nc(C[N@H+](C)C3CC(F)(F)C3)cs2)cc1 ZINC001238036523 1055591848 /nfs/dbraw/zinc/59/18/48/1055591848.db2.gz IXZJENUAIALZPO-UHFFFAOYSA-N 1 2 308.397 4.348 20 0 DIADLO COc1ccc(C(F)(F)F)c(C[N@@H+]2CCCC[C@H](F)C2)c1 ZINC001238048814 1055593879 /nfs/dbraw/zinc/59/38/79/1055593879.db2.gz SFGIBLUKUPCCGY-LBPRGKRZSA-N 1 2 305.315 4.038 20 0 DIADLO COc1ccc(C(F)(F)F)c(C[N@H+]2CCCC[C@H](F)C2)c1 ZINC001238048814 1055593892 /nfs/dbraw/zinc/59/38/92/1055593892.db2.gz SFGIBLUKUPCCGY-LBPRGKRZSA-N 1 2 305.315 4.038 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1C[N@H+](C)Cc1ccon1 ZINC001238056265 1055598510 /nfs/dbraw/zinc/59/85/10/1055598510.db2.gz IZPBBIVRMRLMBY-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO Cc1cc(Oc2ccccc2)ccc1C[N@@H+](C)Cc1ccon1 ZINC001238056265 1055598517 /nfs/dbraw/zinc/59/85/17/1055598517.db2.gz IZPBBIVRMRLMBY-UHFFFAOYSA-N 1 2 308.381 4.407 20 0 DIADLO CCOc1cc(C[N@H+](C)Cc2cnc(Cl)s2)ccc1C ZINC001238069877 1055601312 /nfs/dbraw/zinc/60/13/12/1055601312.db2.gz YRTCYYNBCHEBJW-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO CCOc1cc(C[N@@H+](C)Cc2cnc(Cl)s2)ccc1C ZINC001238069877 1055601320 /nfs/dbraw/zinc/60/13/20/1055601320.db2.gz YRTCYYNBCHEBJW-UHFFFAOYSA-N 1 2 310.850 4.136 20 0 DIADLO Fc1cc(Br)c(F)c(C[N@H+]2CCC[C@@H](F)CC2)c1 ZINC001238071613 1055601903 /nfs/dbraw/zinc/60/19/03/1055601903.db2.gz RJOBXORBAMCNDF-SNVBAGLBSA-N 1 2 322.168 4.051 20 0 DIADLO Fc1cc(Br)c(F)c(C[N@@H+]2CCC[C@@H](F)CC2)c1 ZINC001238071613 1055601905 /nfs/dbraw/zinc/60/19/05/1055601905.db2.gz RJOBXORBAMCNDF-SNVBAGLBSA-N 1 2 322.168 4.051 20 0 DIADLO C[C@@H]1CCCC[N@@H+]1Cc1cc(F)cc(Br)c1F ZINC001238077596 1055603750 /nfs/dbraw/zinc/60/37/50/1055603750.db2.gz YBEWSNYTGXDWLH-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO C[C@@H]1CCCC[N@H+]1Cc1cc(F)cc(Br)c1F ZINC001238077596 1055603754 /nfs/dbraw/zinc/60/37/54/1055603754.db2.gz YBEWSNYTGXDWLH-SECBINFHSA-N 1 2 304.178 4.102 20 0 DIADLO COc1cnc(F)c(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2)c1 ZINC001238123414 1055608386 /nfs/dbraw/zinc/60/83/86/1055608386.db2.gz MRIGVNJNKWWFII-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO COc1cnc(F)c(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2)c1 ZINC001238123414 1055608394 /nfs/dbraw/zinc/60/83/94/1055608394.db2.gz MRIGVNJNKWWFII-NSHDSACASA-N 1 2 308.784 4.076 20 0 DIADLO CC[N@H+](Cc1cccc(OC)c1)Cc1cc(Cl)c(O)cc1F ZINC001238148859 1055611163 /nfs/dbraw/zinc/61/11/63/1055611163.db2.gz CNYAGVTZZRLQQZ-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO CC[N@@H+](Cc1cccc(OC)c1)Cc1cc(Cl)c(O)cc1F ZINC001238148859 1055611169 /nfs/dbraw/zinc/61/11/69/1055611169.db2.gz CNYAGVTZZRLQQZ-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO Oc1cc(F)c(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)cc1Cl ZINC001238150708 1055614524 /nfs/dbraw/zinc/61/45/24/1055614524.db2.gz XTEVSPOEQRWZHE-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO Oc1cc(F)c(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)cc1Cl ZINC001238150708 1055614530 /nfs/dbraw/zinc/61/45/30/1055614530.db2.gz XTEVSPOEQRWZHE-LBPRGKRZSA-N 1 2 323.770 4.313 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)c(O)cc2F)cc1C ZINC001238157437 1055615562 /nfs/dbraw/zinc/61/55/62/1055615562.db2.gz WZZXDROADZRHCD-UHFFFAOYSA-N 1 2 307.796 4.434 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2cc(Cl)c(O)cc2F)cc1C ZINC001238157437 1055615569 /nfs/dbraw/zinc/61/55/69/1055615569.db2.gz WZZXDROADZRHCD-UHFFFAOYSA-N 1 2 307.796 4.434 20 0 DIADLO CC[N@H+](Cc1ccc(OC)cc1)Cc1cc(Cl)c(O)cc1F ZINC001238150455 1055615851 /nfs/dbraw/zinc/61/58/51/1055615851.db2.gz VDAPHXRMMFYOQS-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO CC[N@@H+](Cc1ccc(OC)cc1)Cc1cc(Cl)c(O)cc1F ZINC001238150455 1055615855 /nfs/dbraw/zinc/61/58/55/1055615855.db2.gz VDAPHXRMMFYOQS-UHFFFAOYSA-N 1 2 323.795 4.215 20 0 DIADLO CC(C)c1cc(C[N@@H+]2CCc3ccncc3C2)ccc1Cl ZINC001238227083 1055624650 /nfs/dbraw/zinc/62/46/50/1055624650.db2.gz DVGQDGNEWRWNJJ-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO CC(C)c1cc(C[N@H+]2CCc3ccncc3C2)ccc1Cl ZINC001238227083 1055624655 /nfs/dbraw/zinc/62/46/55/1055624655.db2.gz DVGQDGNEWRWNJJ-UHFFFAOYSA-N 1 2 300.833 4.417 20 0 DIADLO Cc1ccc(CCC(=O)Nc2ccc(-n3cc[nH+]c3)cc2)c(C)c1 ZINC000029912340 1055625060 /nfs/dbraw/zinc/62/50/60/1055625060.db2.gz XBHWVLGKYJDFAX-UHFFFAOYSA-N 1 2 319.408 4.060 20 0 DIADLO CC(C)c1cc(C[N@@H+]2CCc3ncsc3C2)ccc1Cl ZINC001238226741 1055625102 /nfs/dbraw/zinc/62/51/02/1055625102.db2.gz CYPLYPAOJIGOHB-UHFFFAOYSA-N 1 2 306.862 4.478 20 0 DIADLO CC(C)c1cc(C[N@H+]2CCc3ncsc3C2)ccc1Cl ZINC001238226741 1055625105 /nfs/dbraw/zinc/62/51/05/1055625105.db2.gz CYPLYPAOJIGOHB-UHFFFAOYSA-N 1 2 306.862 4.478 20 0 DIADLO COc1cccc([C@H]2CCC[N@@H+]2Cc2c(F)ccnc2Cl)c1 ZINC001238233350 1055627177 /nfs/dbraw/zinc/62/71/77/1055627177.db2.gz HFFGHPYEBMWNEH-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cccc([C@H]2CCC[N@H+]2Cc2c(F)ccnc2Cl)c1 ZINC001238233350 1055627187 /nfs/dbraw/zinc/62/71/87/1055627187.db2.gz HFFGHPYEBMWNEH-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO C[C@]1(CF)CC[N@H+](Cc2ccc(F)c(C(F)(F)F)c2F)C1 ZINC001238242524 1055627870 /nfs/dbraw/zinc/62/78/70/1055627870.db2.gz IIDJBEGBEDQLPO-CYBMUJFWSA-N 1 2 311.269 4.165 20 0 DIADLO C[C@]1(CF)CC[N@@H+](Cc2ccc(F)c(C(F)(F)F)c2F)C1 ZINC001238242524 1055627872 /nfs/dbraw/zinc/62/78/72/1055627872.db2.gz IIDJBEGBEDQLPO-CYBMUJFWSA-N 1 2 311.269 4.165 20 0 DIADLO COc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)ccnc2Cl)cc1 ZINC001238231444 1055627929 /nfs/dbraw/zinc/62/79/29/1055627929.db2.gz LLXJVHGKQGVQLM-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@H]2CCC[N@H+]2Cc2c(F)ccnc2Cl)cc1 ZINC001238231444 1055627933 /nfs/dbraw/zinc/62/79/33/1055627933.db2.gz LLXJVHGKQGVQLM-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO FC[C@@H]1CCC[N@H+](Cc2ccc(F)c(C(F)(F)F)c2F)C1 ZINC001238253267 1055629498 /nfs/dbraw/zinc/62/94/98/1055629498.db2.gz PRPKDFRTDUTOCY-VIFPVBQESA-N 1 2 311.269 4.165 20 0 DIADLO FC[C@@H]1CCC[N@@H+](Cc2ccc(F)c(C(F)(F)F)c2F)C1 ZINC001238253267 1055629505 /nfs/dbraw/zinc/62/95/05/1055629505.db2.gz PRPKDFRTDUTOCY-VIFPVBQESA-N 1 2 311.269 4.165 20 0 DIADLO Fc1ccc(-c2[nH]c3ccc(NCc4nccs4)cc3[nH+]2)cc1 ZINC001620962112 1055629525 /nfs/dbraw/zinc/62/95/25/1055629525.db2.gz PKVFPGBDXGWJDI-UHFFFAOYSA-N 1 2 324.384 4.438 20 0 DIADLO Fc1ccc(C[N@H+]2CCC[C@@H](F)CC2)c(F)c1C(F)(F)F ZINC001238244577 1055630191 /nfs/dbraw/zinc/63/01/91/1055630191.db2.gz ZVKABZVAKVNOOP-SNVBAGLBSA-N 1 2 311.269 4.308 20 0 DIADLO Fc1ccc(C[N@@H+]2CCC[C@@H](F)CC2)c(F)c1C(F)(F)F ZINC001238244577 1055630196 /nfs/dbraw/zinc/63/01/96/1055630196.db2.gz ZVKABZVAKVNOOP-SNVBAGLBSA-N 1 2 311.269 4.308 20 0 DIADLO Cc1cc(Cl)c(Cl)cc1C[N@@H+]1CCC[C@@H]1c1cnccn1 ZINC001238258134 1055631552 /nfs/dbraw/zinc/63/15/52/1055631552.db2.gz GIVHFQRQJGEBLO-MRXNPFEDSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1cc(Cl)c(Cl)cc1C[N@H+]1CCC[C@@H]1c1cnccn1 ZINC001238258134 1055631557 /nfs/dbraw/zinc/63/15/57/1055631557.db2.gz GIVHFQRQJGEBLO-MRXNPFEDSA-N 1 2 322.239 4.429 20 0 DIADLO Cc1ccc2[nH+]c(CSc3nccn3-c3ccccc3)cn2c1 ZINC000031300647 1055636568 /nfs/dbraw/zinc/63/65/68/1055636568.db2.gz UJCVBPISDZIVMB-UHFFFAOYSA-N 1 2 320.421 4.121 20 0 DIADLO CC[C@@H]1CCCC[N@H+]1Cc1c(Br)ccc(O)c1F ZINC001238307711 1055639333 /nfs/dbraw/zinc/63/93/33/1055639333.db2.gz GFNJCHFMINOGCV-SNVBAGLBSA-N 1 2 316.214 4.058 20 0 DIADLO CC[C@@H]1CCCC[N@@H+]1Cc1c(Br)ccc(O)c1F ZINC001238307711 1055639330 /nfs/dbraw/zinc/63/93/30/1055639330.db2.gz GFNJCHFMINOGCV-SNVBAGLBSA-N 1 2 316.214 4.058 20 0 DIADLO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cccc(F)c1OCc1ccccc1 ZINC001238332458 1055641186 /nfs/dbraw/zinc/64/11/86/1055641186.db2.gz NIVBJTFABBLEBN-PBHICJAKSA-N 1 2 317.379 4.337 20 0 DIADLO C[C@@H]1C[C@H](F)C[N@H+]1Cc1cccc(F)c1OCc1ccccc1 ZINC001238332458 1055641189 /nfs/dbraw/zinc/64/11/89/1055641189.db2.gz NIVBJTFABBLEBN-PBHICJAKSA-N 1 2 317.379 4.337 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c(Cl)cn1 ZINC001238356524 1055642861 /nfs/dbraw/zinc/64/28/61/1055642861.db2.gz CBBDYKHNYLZSHX-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c(Cl)cn1 ZINC001238356524 1055642869 /nfs/dbraw/zinc/64/28/69/1055642869.db2.gz CBBDYKHNYLZSHX-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1ccnc(Br)c1Cl ZINC001238375524 1055648137 /nfs/dbraw/zinc/64/81/37/1055648137.db2.gz OOVPMNIMHHVNHD-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1ccnc(Br)c1Cl ZINC001238375524 1055648141 /nfs/dbraw/zinc/64/81/41/1055648141.db2.gz OOVPMNIMHHVNHD-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO CCOc1c(Br)cc(C)cc1C[NH+]1CC2(CCC2)C1 ZINC001238392647 1055651211 /nfs/dbraw/zinc/65/12/11/1055651211.db2.gz CROHSUATFLIJJA-UHFFFAOYSA-N 1 2 324.262 4.142 20 0 DIADLO CC(C)Oc1cccc(C[N@H+](C)Cc2ccc(Cl)nc2)c1F ZINC001238430626 1055657485 /nfs/dbraw/zinc/65/74/85/1055657485.db2.gz QMKQAQZQOXWKSE-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2ccc(Cl)nc2)c1F ZINC001238430626 1055657490 /nfs/dbraw/zinc/65/74/90/1055657490.db2.gz QMKQAQZQOXWKSE-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1cccc(OC(C)C)c1F ZINC001238427765 1055658169 /nfs/dbraw/zinc/65/81/69/1055658169.db2.gz SSSUTDJYXIEFEB-UHFFFAOYSA-N 1 2 302.393 4.030 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1cccc(OC(C)C)c1F ZINC001238427765 1055658175 /nfs/dbraw/zinc/65/81/75/1055658175.db2.gz SSSUTDJYXIEFEB-UHFFFAOYSA-N 1 2 302.393 4.030 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)cnc1F ZINC001238454892 1055662552 /nfs/dbraw/zinc/66/25/52/1055662552.db2.gz VCSGJECDTKRZMV-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)cnc1F ZINC001238454892 1055662559 /nfs/dbraw/zinc/66/25/59/1055662559.db2.gz VCSGJECDTKRZMV-OAHLLOKOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(C[N@@H+]2CCCC[C@@H]2c2ccccc2F)cnc1F ZINC001238453166 1055662740 /nfs/dbraw/zinc/66/27/40/1055662740.db2.gz FQPRVGBBFUIXAW-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO COc1cc(C[N@H+]2CCCC[C@@H]2c2ccccc2F)cnc1F ZINC001238453166 1055662746 /nfs/dbraw/zinc/66/27/46/1055662746.db2.gz FQPRVGBBFUIXAW-MRXNPFEDSA-N 1 2 318.367 4.096 20 0 DIADLO COc1c(C[N@@H+]2CCc3ccccc3[C@@H]2C)ccc(F)c1F ZINC001238467600 1055664753 /nfs/dbraw/zinc/66/47/53/1055664753.db2.gz UPDTXZJNJQNMPT-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(C[N@H+]2CCc3ccccc3[C@@H]2C)ccc(F)c1F ZINC001238467600 1055664761 /nfs/dbraw/zinc/66/47/61/1055664761.db2.gz UPDTXZJNJQNMPT-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(C[N@@H+]2CCc3ccccc3[C@H]2C)ccc(F)c1F ZINC001238467599 1055665931 /nfs/dbraw/zinc/66/59/31/1055665931.db2.gz UPDTXZJNJQNMPT-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(C[N@H+]2CCc3ccccc3[C@H]2C)ccc(F)c1F ZINC001238467599 1055665937 /nfs/dbraw/zinc/66/59/37/1055665937.db2.gz UPDTXZJNJQNMPT-GFCCVEGCSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(C[N@H+]2Cc3ccccc3[C@@H](C)C2)ccc(F)c1F ZINC001238466834 1055666785 /nfs/dbraw/zinc/66/67/85/1055666785.db2.gz MWEVVIQLTRXNGX-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO COc1c(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)ccc(F)c1F ZINC001238466834 1055666789 /nfs/dbraw/zinc/66/67/89/1055666789.db2.gz MWEVVIQLTRXNGX-LBPRGKRZSA-N 1 2 303.352 4.093 20 0 DIADLO Cn1cc(C[NH2+]Cc2c(F)cccc2Cl)c(C2CCCC2)n1 ZINC000921623538 1055670742 /nfs/dbraw/zinc/67/07/42/1055670742.db2.gz ZZECCQHOGJRBFA-UHFFFAOYSA-N 1 2 321.827 4.160 20 0 DIADLO COc1cnc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c(Cl)c1 ZINC001238486954 1055670896 /nfs/dbraw/zinc/67/08/96/1055670896.db2.gz GWJLIVMUUSWQIJ-QGZVFWFLSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cnc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c(Cl)c1 ZINC001238486954 1055670900 /nfs/dbraw/zinc/67/09/00/1055670900.db2.gz GWJLIVMUUSWQIJ-QGZVFWFLSA-N 1 2 320.795 4.220 20 0 DIADLO Fc1c(C[N@@H+]2C[C@H]3CC[C@@H]2C3)cc(Cl)cc1C(F)(F)F ZINC001238496226 1055673245 /nfs/dbraw/zinc/67/32/45/1055673245.db2.gz QRLUKCWMDTXAHT-GZMMTYOYSA-N 1 2 307.718 4.482 20 0 DIADLO Fc1c(C[N@H+]2C[C@H]3CC[C@@H]2C3)cc(Cl)cc1C(F)(F)F ZINC001238496226 1055673249 /nfs/dbraw/zinc/67/32/49/1055673249.db2.gz QRLUKCWMDTXAHT-GZMMTYOYSA-N 1 2 307.718 4.482 20 0 DIADLO O=C1CC[N@@H+](Cc2ccc(F)c(C3CC3)c2)[C@H]2CCCC[C@H]12 ZINC001238496982 1055673300 /nfs/dbraw/zinc/67/33/00/1055673300.db2.gz AXSKIRZBRBGVHW-YJBOKZPZSA-N 1 2 301.405 4.037 20 0 DIADLO O=C1CC[N@H+](Cc2ccc(F)c(C3CC3)c2)[C@H]2CCCC[C@H]12 ZINC001238496982 1055673304 /nfs/dbraw/zinc/67/33/04/1055673304.db2.gz AXSKIRZBRBGVHW-YJBOKZPZSA-N 1 2 301.405 4.037 20 0 DIADLO O=C1CC[N@@H+](Cc2ccc(F)c(C3CC3)c2)[C@@H]2CCCC[C@H]12 ZINC001238496977 1055674033 /nfs/dbraw/zinc/67/40/33/1055674033.db2.gz AXSKIRZBRBGVHW-MAUKXSAKSA-N 1 2 301.405 4.037 20 0 DIADLO O=C1CC[N@H+](Cc2ccc(F)c(C3CC3)c2)[C@@H]2CCCC[C@H]12 ZINC001238496977 1055674040 /nfs/dbraw/zinc/67/40/40/1055674040.db2.gz AXSKIRZBRBGVHW-MAUKXSAKSA-N 1 2 301.405 4.037 20 0 DIADLO Cc1c(Cl)ccc(C[N@@H+]2CCc3cc(O)ccc3C2)c1F ZINC001238512341 1055676641 /nfs/dbraw/zinc/67/66/41/1055676641.db2.gz MXHQOCHLNKSIOA-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO Cc1c(Cl)ccc(C[N@H+]2CCc3cc(O)ccc3C2)c1F ZINC001238512341 1055676648 /nfs/dbraw/zinc/67/66/48/1055676648.db2.gz MXHQOCHLNKSIOA-UHFFFAOYSA-N 1 2 305.780 4.051 20 0 DIADLO CC(C)CCc1noc(C[NH2+][C@H](c2ccccc2)C2CCC2)n1 ZINC000104702060 1055677929 /nfs/dbraw/zinc/67/79/29/1055677929.db2.gz PYMCWBJIXDBZNQ-LJQANCHMSA-N 1 2 313.445 4.289 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@H+](C)Cc2ccsc2)c1F ZINC001238532372 1055679878 /nfs/dbraw/zinc/67/98/78/1055679878.db2.gz NBEYLJCWDVPZFW-UHFFFAOYSA-N 1 2 311.397 4.446 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@@H+](C)Cc2ccsc2)c1F ZINC001238532372 1055679882 /nfs/dbraw/zinc/67/98/82/1055679882.db2.gz NBEYLJCWDVPZFW-UHFFFAOYSA-N 1 2 311.397 4.446 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)c1F ZINC001238534007 1055680336 /nfs/dbraw/zinc/68/03/36/1055680336.db2.gz ZROMPWJQWOSHIC-NSHDSACASA-N 1 2 323.305 4.136 20 0 DIADLO CC(C)Oc1c(F)ccc(C[N@H+]2CC[C@H](C(F)(F)F)C2)c1F ZINC001238534007 1055680346 /nfs/dbraw/zinc/68/03/46/1055680346.db2.gz ZROMPWJQWOSHIC-NSHDSACASA-N 1 2 323.305 4.136 20 0 DIADLO CC[N@H+](Cc1cccnc1)Cc1ccc(F)c(OC(C)C)c1F ZINC001238532498 1055680923 /nfs/dbraw/zinc/68/09/23/1055680923.db2.gz OQYQUUBWYXSQAU-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO CC[N@@H+](Cc1cccnc1)Cc1ccc(F)c(OC(C)C)c1F ZINC001238532498 1055680929 /nfs/dbraw/zinc/68/09/29/1055680929.db2.gz OQYQUUBWYXSQAU-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO Fc1ccc(C[N@@H+]2CCn3cccc3C2)cc1-c1ccccc1 ZINC001238548428 1055682683 /nfs/dbraw/zinc/68/26/83/1055682683.db2.gz CPKWJIIJVQQTIP-UHFFFAOYSA-N 1 2 306.384 4.310 20 0 DIADLO Fc1ccc(C[N@H+]2CCn3cccc3C2)cc1-c1ccccc1 ZINC001238548428 1055682690 /nfs/dbraw/zinc/68/26/90/1055682690.db2.gz CPKWJIIJVQQTIP-UHFFFAOYSA-N 1 2 306.384 4.310 20 0 DIADLO Cc1cc(Br)c(Cl)cc1C[NH+]1CC2(CCC2)C1 ZINC001238573991 1055689276 /nfs/dbraw/zinc/68/92/76/1055689276.db2.gz JGFZNMGNTMNFAE-UHFFFAOYSA-N 1 2 314.654 4.397 20 0 DIADLO Cc1ccc(Cl)c(C[N@H+](C)Cc2cccc3c2OCO3)c1 ZINC001238567141 1055689323 /nfs/dbraw/zinc/68/93/23/1055689323.db2.gz PNOQIPDTUKXEKY-UHFFFAOYSA-N 1 2 303.789 4.009 20 0 DIADLO Cc1ccc(Cl)c(C[N@@H+](C)Cc2cccc3c2OCO3)c1 ZINC001238567141 1055689326 /nfs/dbraw/zinc/68/93/26/1055689326.db2.gz PNOQIPDTUKXEKY-UHFFFAOYSA-N 1 2 303.789 4.009 20 0 DIADLO Cc1cc(F)cc(Br)c1C[NH+]1CCC(F)(F)CC1 ZINC001238568055 1055689363 /nfs/dbraw/zinc/68/93/63/1055689363.db2.gz ZBLYISHKTJNWJR-UHFFFAOYSA-N 1 2 322.168 4.128 20 0 DIADLO Cc1cc(C[N@@H+]2CC[C@](C)(F)[C@@H](F)C2)cnc1-c1ccccc1 ZINC001238605227 1055694665 /nfs/dbraw/zinc/69/46/65/1055694665.db2.gz CDXHNBOEBFMECX-HKUYNNGSSA-N 1 2 316.395 4.329 20 0 DIADLO Cc1cc(C[N@H+]2CC[C@](C)(F)[C@@H](F)C2)cnc1-c1ccccc1 ZINC001238605227 1055694670 /nfs/dbraw/zinc/69/46/70/1055694670.db2.gz CDXHNBOEBFMECX-HKUYNNGSSA-N 1 2 316.395 4.329 20 0 DIADLO C[N@H+](Cc1ccncc1)Cc1cc(-c2ccccc2)ncc1Cl ZINC001238623078 1055700595 /nfs/dbraw/zinc/70/05/95/1055700595.db2.gz BTJOQGFXBAHGSD-UHFFFAOYSA-N 1 2 323.827 4.429 20 0 DIADLO C[N@@H+](Cc1ccncc1)Cc1cc(-c2ccccc2)ncc1Cl ZINC001238623078 1055700608 /nfs/dbraw/zinc/70/06/08/1055700608.db2.gz BTJOQGFXBAHGSD-UHFFFAOYSA-N 1 2 323.827 4.429 20 0 DIADLO Cc1cc(C[N@@H+](CC(=O)c2ccccc2)C(C)C)cnc1C1CC1 ZINC001238628116 1055703082 /nfs/dbraw/zinc/70/30/82/1055703082.db2.gz NBMPIEBBPLYNCG-UHFFFAOYSA-N 1 2 322.452 4.361 20 0 DIADLO Cc1cc(C[N@H+](CC(=O)c2ccccc2)C(C)C)cnc1C1CC1 ZINC001238628116 1055703091 /nfs/dbraw/zinc/70/30/91/1055703091.db2.gz NBMPIEBBPLYNCG-UHFFFAOYSA-N 1 2 322.452 4.361 20 0 DIADLO C[N@H+](Cc1nc(-c2ccco2)no1)Cc1ccc2ccccc2c1 ZINC000044072252 1055707791 /nfs/dbraw/zinc/70/77/91/1055707791.db2.gz IORGSJPMZRBFFL-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO C[N@@H+](Cc1nc(-c2ccco2)no1)Cc1ccc2ccccc2c1 ZINC000044072252 1055707802 /nfs/dbraw/zinc/70/78/02/1055707802.db2.gz IORGSJPMZRBFFL-UHFFFAOYSA-N 1 2 319.364 4.115 20 0 DIADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cc(-c2ccccc2)cnc1F ZINC001238663533 1055711384 /nfs/dbraw/zinc/71/13/84/1055711384.db2.gz GZYFWCYSDUIASB-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cc(-c2ccccc2)cnc1F ZINC001238663533 1055711393 /nfs/dbraw/zinc/71/13/93/1055711393.db2.gz GZYFWCYSDUIASB-OAHLLOKOSA-N 1 2 321.399 4.266 20 0 DIADLO Cc1cc(OC(C)C)cc(C)c1C[N@H+](C)Cc1nccs1 ZINC001238664298 1055712515 /nfs/dbraw/zinc/71/25/15/1055712515.db2.gz JBJMJWCSSLZVHN-UHFFFAOYSA-N 1 2 304.459 4.179 20 0 DIADLO Cc1cc(OC(C)C)cc(C)c1C[N@@H+](C)Cc1nccs1 ZINC001238664298 1055712524 /nfs/dbraw/zinc/71/25/24/1055712524.db2.gz JBJMJWCSSLZVHN-UHFFFAOYSA-N 1 2 304.459 4.179 20 0 DIADLO CSc1ccc(Cl)cc1C[N@H+]1CCC(=O)[C@@H]2CCCC[C@H]21 ZINC001238672430 1055714448 /nfs/dbraw/zinc/71/44/48/1055714448.db2.gz QRHLILXVYQPXDF-HUUCEWRRSA-N 1 2 323.889 4.396 20 0 DIADLO CSc1ccc(Cl)cc1C[N@@H+]1CCC(=O)[C@@H]2CCCC[C@H]21 ZINC001238672430 1055714436 /nfs/dbraw/zinc/71/44/36/1055714436.db2.gz QRHLILXVYQPXDF-HUUCEWRRSA-N 1 2 323.889 4.396 20 0 DIADLO CSc1ccc(Cl)cc1C[N@@H+]1CCC(=O)[C@@H]2CCCC[C@@H]21 ZINC001238672428 1055714769 /nfs/dbraw/zinc/71/47/69/1055714769.db2.gz QRHLILXVYQPXDF-CABCVRRESA-N 1 2 323.889 4.396 20 0 DIADLO CSc1ccc(Cl)cc1C[N@H+]1CCC(=O)[C@@H]2CCCC[C@@H]21 ZINC001238672428 1055714779 /nfs/dbraw/zinc/71/47/79/1055714779.db2.gz QRHLILXVYQPXDF-CABCVRRESA-N 1 2 323.889 4.396 20 0 DIADLO CC(C)(C)C(=O)Nc1ccc(Cl)cc1C[NH+]1CC(C)(C)C1 ZINC001238674755 1055717243 /nfs/dbraw/zinc/71/72/43/1055717243.db2.gz WUIUUKFOZSSKME-UHFFFAOYSA-N 1 2 308.853 4.166 20 0 DIADLO CSc1cc(C)cc(C[N@@H+]2CCc3ncc(Cl)cc3C2)c1 ZINC001238681220 1055719922 /nfs/dbraw/zinc/71/99/22/1055719922.db2.gz HEELHHCCEBXHIU-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CSc1cc(C)cc(C[N@H+]2CCc3ncc(Cl)cc3C2)c1 ZINC001238681220 1055719933 /nfs/dbraw/zinc/71/99/33/1055719933.db2.gz HEELHHCCEBXHIU-UHFFFAOYSA-N 1 2 318.873 4.324 20 0 DIADLO CNc1ccc(Nc2ccc(N3CCC(F)(F)CC3)cc2)c[nH+]1 ZINC001203459222 1055725725 /nfs/dbraw/zinc/72/57/25/1055725725.db2.gz GSMHMWVLCSWEBJ-UHFFFAOYSA-N 1 2 318.371 4.102 20 0 DIADLO CC(C)c1ccc(C[N@@H+]2CCn3cccc3[C@H]2C)c(Cl)n1 ZINC001238731005 1055736955 /nfs/dbraw/zinc/73/69/55/1055736955.db2.gz KWYHDECLIPOQTA-CYBMUJFWSA-N 1 2 303.837 4.237 20 0 DIADLO CC(C)c1ccc(C[N@H+]2CCn3cccc3[C@H]2C)c(Cl)n1 ZINC001238731005 1055736962 /nfs/dbraw/zinc/73/69/62/1055736962.db2.gz KWYHDECLIPOQTA-CYBMUJFWSA-N 1 2 303.837 4.237 20 0 DIADLO CC(C)Oc1c(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)ccc(F)c1F ZINC001238738937 1055737112 /nfs/dbraw/zinc/73/71/12/1055737112.db2.gz HOHBTQJZMGWLNK-NSHDSACASA-N 1 2 319.342 4.229 20 0 DIADLO CC(C)Oc1c(C[N@H+]2CCC(F)(F)[C@@H](C)C2)ccc(F)c1F ZINC001238738937 1055737119 /nfs/dbraw/zinc/73/71/19/1055737119.db2.gz HOHBTQJZMGWLNK-NSHDSACASA-N 1 2 319.342 4.229 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)cc1Cl ZINC001238790999 1055752462 /nfs/dbraw/zinc/75/24/62/1055752462.db2.gz SUPHDSHEINZDED-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@@H]2c2ccncc2)cc1Cl ZINC001238790999 1055752470 /nfs/dbraw/zinc/75/24/70/1055752470.db2.gz SUPHDSHEINZDED-MRXNPFEDSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(F)c(C[N@@H+]2CCC[C@H]2c2ccccn2)cc1Cl ZINC001238790961 1055752672 /nfs/dbraw/zinc/75/26/72/1055752672.db2.gz SQIURUHMGSXHSM-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1cc(F)c(C[N@H+]2CCC[C@H]2c2ccccn2)cc1Cl ZINC001238790961 1055752680 /nfs/dbraw/zinc/75/26/80/1055752680.db2.gz SQIURUHMGSXHSM-INIZCTEOSA-N 1 2 320.795 4.220 20 0 DIADLO CC[N@H+](Cc1ccc(F)cc1)Cc1cc(OC(C)C)ncc1F ZINC001238798123 1055753450 /nfs/dbraw/zinc/75/34/50/1055753450.db2.gz CGPBDIIDGYJZKF-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO CC[N@@H+](Cc1ccc(F)cc1)Cc1cc(OC(C)C)ncc1F ZINC001238798123 1055753457 /nfs/dbraw/zinc/75/34/57/1055753457.db2.gz CGPBDIIDGYJZKF-UHFFFAOYSA-N 1 2 320.383 4.169 20 0 DIADLO Cc1ccccc1[C@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)C(C)(C)C ZINC001566233312 1055753633 /nfs/dbraw/zinc/75/36/33/1055753633.db2.gz ZYFHRFNCPCYQAD-SFHVURJKSA-N 1 2 321.424 4.389 20 0 DIADLO CC(C)Oc1cc(C[N@H+](C)Cc2cccc(Cl)c2)c(F)cn1 ZINC001238801000 1055754672 /nfs/dbraw/zinc/75/46/72/1055754672.db2.gz APMSUYGNPNLVPD-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO CC(C)Oc1cc(C[N@@H+](C)Cc2cccc(Cl)c2)c(F)cn1 ZINC001238801000 1055754684 /nfs/dbraw/zinc/75/46/84/1055754684.db2.gz APMSUYGNPNLVPD-UHFFFAOYSA-N 1 2 322.811 4.293 20 0 DIADLO Cc1noc([C@@H](C)[NH+]2CCC([C@H](F)c3ccccc3F)CC2)n1 ZINC000671699521 1055756343 /nfs/dbraw/zinc/75/63/43/1055756343.db2.gz KMLSHTMMTACWRZ-BZNIZROVSA-N 1 2 321.371 4.001 20 0 DIADLO C[C@@H]([N@H+](C)Cn1nc(-c2ccc(F)cc2)oc1=S)C(C)(C)C ZINC000026629729 1055770468 /nfs/dbraw/zinc/77/04/68/1055770468.db2.gz SBKJRJJZFZEKFM-LLVKDONJSA-N 1 2 323.437 4.336 20 0 DIADLO C[C@@H]([N@@H+](C)Cn1nc(-c2ccc(F)cc2)oc1=S)C(C)(C)C ZINC000026629729 1055770476 /nfs/dbraw/zinc/77/04/76/1055770476.db2.gz SBKJRJJZFZEKFM-LLVKDONJSA-N 1 2 323.437 4.336 20 0 DIADLO C[C@@H](CC(=O)Nc1cccc(-n2cc[nH+]c2)c1)c1ccc(F)cc1 ZINC000057496939 1055782415 /nfs/dbraw/zinc/78/24/15/1055782415.db2.gz FJOBWXDACBJPOY-AWEZNQCLSA-N 1 2 323.371 4.144 20 0 DIADLO Cc1ccc2c(cccc2Nc2ccc[nH+]c2N2CCOCC2)c1 ZINC001212368611 1055788927 /nfs/dbraw/zinc/78/89/27/1055788927.db2.gz GYVQHFXKSLSPEZ-UHFFFAOYSA-N 1 2 319.408 4.123 20 0 DIADLO CC(C)([NH2+]Cc1nc(-c2ccco2)no1)c1ccc(Cl)cc1 ZINC000057846754 1055789680 /nfs/dbraw/zinc/78/96/80/1055789680.db2.gz ATTGQJALPOLONY-UHFFFAOYSA-N 1 2 317.776 4.008 20 0 DIADLO COc1ccc(-c2ccccc2Cn2cc[nH+]c2)cc1OC(C)C ZINC001238932063 1055795254 /nfs/dbraw/zinc/79/52/54/1055795254.db2.gz UBOSFTDFWFCYOH-UHFFFAOYSA-N 1 2 322.408 4.394 20 0 DIADLO C[C@H]1CCCC[C@@H]1OCC[NH+](Cc1ccco1)Cc1ccco1 ZINC000058932465 1055819714 /nfs/dbraw/zinc/81/97/14/1055819714.db2.gz AHOWQXWCBVWERP-LPHOPBHVSA-N 1 2 317.429 4.470 20 0 DIADLO Fc1ccc(C[N@@H+](Cc2ccco2)C[C@@H]2CCCO2)c(Cl)c1 ZINC000060039295 1055828514 /nfs/dbraw/zinc/82/85/14/1055828514.db2.gz PBTQSYNURCKKLB-INIZCTEOSA-N 1 2 323.795 4.253 20 0 DIADLO Fc1ccc(C[N@H+](Cc2ccco2)C[C@@H]2CCCO2)c(Cl)c1 ZINC000060039295 1055828524 /nfs/dbraw/zinc/82/85/24/1055828524.db2.gz PBTQSYNURCKKLB-INIZCTEOSA-N 1 2 323.795 4.253 20 0 DIADLO Cc1cc(C)c(C(=O)N2CC(C)(C)[C@H]2c2ccccc2)c(C)[nH+]1 ZINC001597537124 1055843569 /nfs/dbraw/zinc/84/35/69/1055843569.db2.gz BBBNTCVNZAPXBY-GOSISDBHSA-N 1 2 308.425 4.230 20 0 DIADLO CSc1cccc(F)c1C[NH2+]Cc1nc2c(s1)CCCC2 ZINC000671724064 1055879715 /nfs/dbraw/zinc/87/97/15/1055879715.db2.gz ATOWDCXYLKLPMS-UHFFFAOYSA-N 1 2 322.474 4.173 20 0 DIADLO Cc1ccc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)cc1 ZINC001239481975 1055901702 /nfs/dbraw/zinc/90/17/02/1055901702.db2.gz JZNPSGDSOGOPTR-UHFFFAOYSA-N 1 2 304.393 4.305 20 0 DIADLO Cc1ccc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)cc1 ZINC001239481975 1055901717 /nfs/dbraw/zinc/90/17/17/1055901717.db2.gz JZNPSGDSOGOPTR-UHFFFAOYSA-N 1 2 304.393 4.305 20 0 DIADLO C[C@H]([NH2+]C1(c2c(F)cccc2F)CCC1)c1ccc(F)cn1 ZINC000624345606 1055912442 /nfs/dbraw/zinc/91/24/42/1055912442.db2.gz OINNAHPQQGGMRZ-NSHDSACASA-N 1 2 306.331 4.229 20 0 DIADLO CCCC(CCC)C(=O)Nc1nc(C[NH+](CC)CC)cs1 ZINC001570868969 1055919159 /nfs/dbraw/zinc/91/91/59/1055919159.db2.gz BPYWQTONXXUATD-UHFFFAOYSA-N 1 2 311.495 4.140 20 0 DIADLO CC(C)COC(=O)C[N@@H+]1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC001615518990 1055924497 /nfs/dbraw/zinc/92/44/97/1055924497.db2.gz AUWDJNBWWOOJJQ-QGZVFWFLSA-N 1 2 323.864 4.456 20 0 DIADLO CC(C)COC(=O)C[N@H+]1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC001615518990 1055924510 /nfs/dbraw/zinc/92/45/10/1055924510.db2.gz AUWDJNBWWOOJJQ-QGZVFWFLSA-N 1 2 323.864 4.456 20 0 DIADLO C[C@@H](CCc1ccc(Br)cc1)Nc1cccc[nH+]1 ZINC000064915602 1055931281 /nfs/dbraw/zinc/93/12/81/1055931281.db2.gz XVOSNLBOUKJTQS-LBPRGKRZSA-N 1 2 305.219 4.277 20 0 DIADLO CCCOc1ccc(C[NH2+]Cc2nc(C)c3ccccc3n2)cc1 ZINC001620763760 1055934941 /nfs/dbraw/zinc/93/49/41/1055934941.db2.gz KUSRDVFXVGJTKF-UHFFFAOYSA-N 1 2 321.424 4.017 20 0 DIADLO C[N@@H+]1CCc2oc(-c3ccc(-c4cccc(F)c4)cc3)nc2C1 ZINC001239537135 1055936902 /nfs/dbraw/zinc/93/69/02/1055936902.db2.gz MYVYQYBVFCPODP-UHFFFAOYSA-N 1 2 308.356 4.136 20 0 DIADLO C[N@H+]1CCc2oc(-c3ccc(-c4cccc(F)c4)cc3)nc2C1 ZINC001239537135 1055936909 /nfs/dbraw/zinc/93/69/09/1055936909.db2.gz MYVYQYBVFCPODP-UHFFFAOYSA-N 1 2 308.356 4.136 20 0 DIADLO Cc1nc(C[N@H+](C)CCOc2cccc3ccccc32)cs1 ZINC000065300928 1055943551 /nfs/dbraw/zinc/94/35/51/1055943551.db2.gz GEQRXYSZUQIILN-UHFFFAOYSA-N 1 2 312.438 4.116 20 0 DIADLO Cc1nc(C[N@@H+](C)CCOc2cccc3ccccc32)cs1 ZINC000065300928 1055943561 /nfs/dbraw/zinc/94/35/61/1055943561.db2.gz GEQRXYSZUQIILN-UHFFFAOYSA-N 1 2 312.438 4.116 20 0 DIADLO Cc1[nH+]c[nH]c1CC(=O)Nc1cccc(Oc2ccccc2C)c1 ZINC001598373293 1055943520 /nfs/dbraw/zinc/94/35/20/1055943520.db2.gz OHZHFWVCMKBCBL-UHFFFAOYSA-N 1 2 321.380 4.000 20 0 DIADLO Cn1cc(-c2cc(F)c(C[NH+](C)C)c(F)c2)c2ccccc21 ZINC001239546264 1055946253 /nfs/dbraw/zinc/94/62/53/1055946253.db2.gz NGDFJQWAOSDNGI-UHFFFAOYSA-N 1 2 300.352 4.185 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1cc(Br)ccc1F ZINC000065536332 1055950588 /nfs/dbraw/zinc/95/05/88/1055950588.db2.gz NVYNHBOTGONDBG-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1cc(Br)ccc1F ZINC000065536332 1055950598 /nfs/dbraw/zinc/95/05/98/1055950598.db2.gz NVYNHBOTGONDBG-UHFFFAOYSA-N 1 2 312.182 4.122 20 0 DIADLO CCCOc1c(Cl)cc(CNc2cccc[nH+]2)cc1OC ZINC000019777520 1055968018 /nfs/dbraw/zinc/96/80/18/1055968018.db2.gz SZYVIDKFFTYXHC-UHFFFAOYSA-N 1 2 306.793 4.145 20 0 DIADLO COc1cccc(Nc2ccc(NCc3ccccc3)[nH+]c2)c1 ZINC001621006489 1055974946 /nfs/dbraw/zinc/97/49/46/1055974946.db2.gz KKZCEJKJALEGJS-UHFFFAOYSA-N 1 2 305.381 4.446 20 0 DIADLO Cn1cc(CNc2ccc(Nc3ccccc3)c[nH+]2)c(C2CC2)n1 ZINC001621013190 1055979170 /nfs/dbraw/zinc/97/91/70/1055979170.db2.gz SXLLBUXCKVQXQO-UHFFFAOYSA-N 1 2 319.412 4.048 20 0 DIADLO Fc1ccc(C(F)(F)C[NH2+]Cc2cccc3[nH]ccc32)cc1 ZINC001621018058 1055983641 /nfs/dbraw/zinc/98/36/41/1055983641.db2.gz KJJGMMHVGGPTRR-UHFFFAOYSA-N 1 2 304.315 4.189 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+]Cc1ncc(C(C)C)s1 ZINC001620801065 1055997280 /nfs/dbraw/zinc/99/72/80/1055997280.db2.gz ORGDOJILHMXHFI-UHFFFAOYSA-N 1 2 310.850 4.218 20 0 DIADLO CCSCc1ccc[nH+]c1N[C@@H]1CCc2cccnc2CC1 ZINC001621043362 1056004067 /nfs/dbraw/zinc/00/40/67/1056004067.db2.gz DDWAIYHIJLIMCM-MRXNPFEDSA-N 1 2 313.470 4.089 20 0 DIADLO CCc1cccc(NC(=O)[C@H]2CC[C@@H](Nc3cccc[nH+]3)CC2)c1 ZINC001540282045 1056006033 /nfs/dbraw/zinc/00/60/33/1056006033.db2.gz QFXHGGNPSPRYLK-CALCHBBNSA-N 1 2 323.440 4.253 20 0 DIADLO Cc1cc(-c2ccc(N(C)Cc3ccccc3)nc2)cc(C)[nH+]1 ZINC001239661026 1056009984 /nfs/dbraw/zinc/00/99/84/1056009984.db2.gz RHGNSHDFCFPMPE-UHFFFAOYSA-N 1 2 303.409 4.397 20 0 DIADLO CCc1onc(C)c1CNc1[nH+]c2cc(Cl)ccc2n1CC ZINC001621052241 1056011167 /nfs/dbraw/zinc/01/11/67/1056011167.db2.gz OIBQIFOWIHMYLE-UHFFFAOYSA-N 1 2 318.808 4.181 20 0 DIADLO COc1cc(C[N@@H+]2CCC[C@@H]2c2cc(C)on2)ccc1SC ZINC000068804545 1056018243 /nfs/dbraw/zinc/01/82/43/1056018243.db2.gz WHJFHUFYBRLUOK-OAHLLOKOSA-N 1 2 318.442 4.051 20 0 DIADLO COc1cc(C[N@H+]2CCC[C@@H]2c2cc(C)on2)ccc1SC ZINC000068804545 1056018251 /nfs/dbraw/zinc/01/82/51/1056018251.db2.gz WHJFHUFYBRLUOK-OAHLLOKOSA-N 1 2 318.442 4.051 20 0 DIADLO COc1ccc2c(c1)nccc2-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001239687260 1056027885 /nfs/dbraw/zinc/02/78/85/1056027885.db2.gz DKXPVEWPWBNAPA-UHFFFAOYSA-N 1 2 319.339 4.235 20 0 DIADLO CCC(C)(C)c1ccc(C(=O)Nc2ccn3cc[nH+]c3c2)cc1 ZINC001583151636 1056030900 /nfs/dbraw/zinc/03/09/00/1056030900.db2.gz YMAIKPBBBHTBFG-UHFFFAOYSA-N 1 2 307.397 4.274 20 0 DIADLO CCCCC1CCC(NC(=O)[C@H](CC(C)C)n2cc[nH+]c2)CC1 ZINC001583168672 1056032310 /nfs/dbraw/zinc/03/23/10/1056032310.db2.gz WMKSRDYXGSWVNC-ABHNRTSZSA-N 1 2 319.493 4.336 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cc(-c2ccccc2)no1)c1nccs1 ZINC000072684141 1056032726 /nfs/dbraw/zinc/03/27/26/1056032726.db2.gz RHVOJOMBKNBHGH-QGZVFWFLSA-N 1 2 313.426 4.213 20 0 DIADLO Cc1ccc(C[NH2+]C(C)(C)c2nc(C(F)(F)F)cs2)o1 ZINC000072923916 1056034826 /nfs/dbraw/zinc/03/48/26/1056034826.db2.gz YBBUZXAHSQENDX-UHFFFAOYSA-N 1 2 304.337 4.088 20 0 DIADLO CCCn1c[nH+]cc1CN1CC[C@H](C)Sc2ccccc21 ZINC001621331171 1056036052 /nfs/dbraw/zinc/03/60/52/1056036052.db2.gz DAJDBKGJWUHFOZ-AWEZNQCLSA-N 1 2 301.459 4.184 20 0 DIADLO Cc1cccc(-c2ncnc3c2C[N@H+](Cc2ccccc2)C3)c1C ZINC001239714428 1056037513 /nfs/dbraw/zinc/03/75/13/1056037513.db2.gz GXBGCIRNQCDLTH-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1cccc(-c2ncnc3c2C[N@@H+](Cc2ccccc2)C3)c1C ZINC001239714428 1056037524 /nfs/dbraw/zinc/03/75/24/1056037524.db2.gz GXBGCIRNQCDLTH-UHFFFAOYSA-N 1 2 315.420 4.276 20 0 DIADLO Cc1c(Cl)cccc1NC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000073120354 1056041716 /nfs/dbraw/zinc/04/17/16/1056041716.db2.gz NSJIFFPVDDWBFG-UHFFFAOYSA-N 1 2 311.772 4.086 20 0 DIADLO CCC[C@H](NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1)c1ccccc1 ZINC001540587326 1056047921 /nfs/dbraw/zinc/04/79/21/1056047921.db2.gz GABPVTNGFFKGMQ-ZWKOTPCHSA-N 1 2 313.445 4.128 20 0 DIADLO CCCc1ccccc1NC(=O)Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001540607056 1056050477 /nfs/dbraw/zinc/05/04/77/1056050477.db2.gz VWMNNXDNYAHOOS-UHFFFAOYSA-N 1 2 319.408 4.006 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)C3CCC=CCC3)c2)[nH+]c1C ZINC001583354845 1056070299 /nfs/dbraw/zinc/07/02/99/1056070299.db2.gz KDNLWUCLEXVMGU-UHFFFAOYSA-N 1 2 309.413 4.378 20 0 DIADLO C/C(=C/C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C)c1ccco1 ZINC001611243944 1056130410 /nfs/dbraw/zinc/13/04/10/1056130410.db2.gz FMXQEYHSWCIVIX-RAXLEYEMSA-N 1 2 307.353 4.020 20 0 DIADLO Cc1cc[nH+]c(C)c1-c1ccc(C(=O)NCc2ccccc2)cc1 ZINC001239909235 1056150920 /nfs/dbraw/zinc/15/09/20/1056150920.db2.gz JNIHMNCWQRDSBP-UHFFFAOYSA-N 1 2 316.404 4.295 20 0 DIADLO CS[C@@H](C)CCC(=O)Nc1ccc(-c2[nH]c(C)c(C)[nH+]2)cc1 ZINC000921662467 1056171728 /nfs/dbraw/zinc/17/17/28/1056171728.db2.gz MVJAOVBLDWNFOQ-NSHDSACASA-N 1 2 317.458 4.164 20 0 DIADLO Cn1ccc2cc(-c3cc(F)c(C[NH+](C)C)c(F)c3)ccc21 ZINC001239943786 1056178447 /nfs/dbraw/zinc/17/84/47/1056178447.db2.gz PXMKQSKUUBMXMI-UHFFFAOYSA-N 1 2 300.352 4.185 20 0 DIADLO C[C@H]([NH2+]Cc1cnsc1)c1nc(-c2ccccc2)cs1 ZINC001649117647 1056178788 /nfs/dbraw/zinc/17/87/88/1056178788.db2.gz LTQIAQKBGHXIAN-NSHDSACASA-N 1 2 301.440 4.117 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccccc2CC(C)(C)C)c[nH+]1 ZINC001583839750 1056182458 /nfs/dbraw/zinc/18/24/58/1056182458.db2.gz NORNHHDJKAHPIY-UHFFFAOYSA-N 1 2 310.441 4.217 20 0 DIADLO CCc1cc(N(C)Cc2csc3ccccc23)nc(CC)[nH+]1 ZINC001611793884 1056192068 /nfs/dbraw/zinc/19/20/68/1056192068.db2.gz JCOIYHVXONPFTB-UHFFFAOYSA-N 1 2 311.454 4.453 20 0 DIADLO CC[C@H](CNc1cc(C)[nH+]c(C2CC2)n1)Oc1cccc(C)c1 ZINC001611815128 1056193543 /nfs/dbraw/zinc/19/35/43/1056193543.db2.gz QKOCYSKMISUTSY-MRXNPFEDSA-N 1 2 311.429 4.240 20 0 DIADLO CC(C)c1cc(NCCCOC2CCCC2)nc(C(C)C)[nH+]1 ZINC001611892971 1056204129 /nfs/dbraw/zinc/20/41/29/1056204129.db2.gz MJLFJZOJAOWQHO-UHFFFAOYSA-N 1 2 305.466 4.485 20 0 DIADLO Cc1cc(-c2ccc(F)cc2OCc2ccccc2)c[nH+]c1N ZINC001239979827 1056218458 /nfs/dbraw/zinc/21/84/58/1056218458.db2.gz HURZQWKWDNUWQH-UHFFFAOYSA-N 1 2 308.356 4.357 20 0 DIADLO CC(C)Oc1ccccc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000106021036 1056218757 /nfs/dbraw/zinc/21/87/57/1056218757.db2.gz IAYVUNHHKVXHJE-UHFFFAOYSA-N 1 2 321.380 4.116 20 0 DIADLO Cc1nc(N2CC[C@H](c3ccccc3)[C@H](C)C2)c2c([nH+]1)CCCC2 ZINC001612036261 1056225644 /nfs/dbraw/zinc/22/56/44/1056225644.db2.gz VKYWNCBRNVJQJM-QAPCUYQASA-N 1 2 321.468 4.294 20 0 DIADLO Cc1cc(NC(=O)[C@H]2CCC(C)(C)C[C@@H]2c2ccccc2)cc[nH+]1 ZINC001584005460 1056234778 /nfs/dbraw/zinc/23/47/78/1056234778.db2.gz UHSXLGSDOLGBAL-RBUKOAKNSA-N 1 2 322.452 4.361 20 0 DIADLO Cc1cc(NC(=O)C(C)(C)CCCc2ccccc2)c(C)c[nH+]1 ZINC001584009015 1056235059 /nfs/dbraw/zinc/23/50/59/1056235059.db2.gz DNVWRADHQNBUES-UHFFFAOYSA-N 1 2 310.441 4.108 20 0 DIADLO Cc1cc(NC(=O)[C@H]2CCC(C)(C)C[C@H]2c2ccccc2)cc[nH+]1 ZINC001584005459 1056235335 /nfs/dbraw/zinc/23/53/35/1056235335.db2.gz UHSXLGSDOLGBAL-OALUTQOASA-N 1 2 322.452 4.361 20 0 DIADLO Cc1cc(NC(=O)C=CCc2ccc(C(C)C)cc2)c(C)c[nH+]1 ZINC001584008922 1056235737 /nfs/dbraw/zinc/23/57/37/1056235737.db2.gz CIPYWRHIGKMNPV-WAYWQWQTSA-N 1 2 308.425 4.286 20 0 DIADLO Cc1cccc2c(C(=O)Nc3ccccc3-n3cc[nH+]c3)coc21 ZINC001543547411 1056247246 /nfs/dbraw/zinc/24/72/46/1056247246.db2.gz GQNBDWSJOLZAQR-UHFFFAOYSA-N 1 2 317.348 4.179 20 0 DIADLO CC[C@H](C)[C@@H]1CCCCN1c1nc2ccccc2n2c[nH+]cc12 ZINC001612199773 1056253177 /nfs/dbraw/zinc/25/31/77/1056253177.db2.gz IGIDVEZXTOGMOM-HOCLYGCPSA-N 1 2 308.429 4.288 20 0 DIADLO CCc1noc(C)c1[C@H](C)[NH2+][C@@H]1CCCc2cn(C(C)C)nc21 ZINC000765822346 1056254022 /nfs/dbraw/zinc/25/40/22/1056254022.db2.gz ZRVPFCDAIYQTNF-BLLLJJGKSA-N 1 2 316.449 4.051 20 0 DIADLO CCc1ccc2c(c1)[C@@H](Nc1cc(C)[nH+]c(C3CC3)n1)CCO2 ZINC001612231144 1056259410 /nfs/dbraw/zinc/25/94/10/1056259410.db2.gz HRFDCTLMGWUHQZ-INIZCTEOSA-N 1 2 309.413 4.161 20 0 DIADLO Cc1cc(NCc2ccc(Br)o2)nc(C2CCC2)[nH+]1 ZINC001612276200 1056261903 /nfs/dbraw/zinc/26/19/03/1056261903.db2.gz VOQBWSYPKQXEGZ-UHFFFAOYSA-N 1 2 322.206 4.020 20 0 DIADLO CSCc1cccc(CNc2nc(C)[nH+]c3c2CCCC3)c1 ZINC001612272618 1056263836 /nfs/dbraw/zinc/26/38/36/1056263836.db2.gz QDCXJJMQHRBKJD-UHFFFAOYSA-N 1 2 313.470 4.139 20 0 DIADLO COc1ccc(-c2cc(F)c(C[NH+](C)C)c(F)c2)cc1Cl ZINC001240033392 1056269656 /nfs/dbraw/zinc/26/96/56/1056269656.db2.gz ABGLOIZMAXLSCC-UHFFFAOYSA-N 1 2 311.759 4.355 20 0 DIADLO Cc1ccc([C@@H]2C[C@H](C)N(c3cc(C)[nH+]c(C4CC4)n3)C2)cc1 ZINC001612322169 1056272289 /nfs/dbraw/zinc/27/22/89/1056272289.db2.gz WNMGNVTXYKSGES-MAUKXSAKSA-N 1 2 307.441 4.353 20 0 DIADLO CC(C)c1cc(NC[C@@H]2CCOC(C)(C)C2)nc(C(C)C)[nH+]1 ZINC001612457457 1056291829 /nfs/dbraw/zinc/29/18/29/1056291829.db2.gz ZLGQRSBNBWDCQC-CQSZACIVSA-N 1 2 305.466 4.341 20 0 DIADLO CCc1ccc(CCC(=O)Nc2ccc3[nH]c(C)[nH+]c3c2)cc1 ZINC000010657079 1056304483 /nfs/dbraw/zinc/30/44/83/1056304483.db2.gz OZZQESPPCLWTPJ-UHFFFAOYSA-N 1 2 307.397 4.005 20 0 DIADLO Cc1[nH]c(-c2cccc(NC(=O)[C@@H]3C[C@@H]4C[C@@H]4C[C@H]3C)c2)[nH+]c1C ZINC001543835526 1056308790 /nfs/dbraw/zinc/30/87/90/1056308790.db2.gz ULWLMXRMWABVNC-HJSDFSPCSA-N 1 2 323.440 4.314 20 0 DIADLO CCc1cc(N[C@H]2CCc3cc(Cl)ccc32)nc(CC)[nH+]1 ZINC001612730958 1056324773 /nfs/dbraw/zinc/32/47/73/1056324773.db2.gz KJUULSMGHOWZDZ-HNNXBMFYSA-N 1 2 301.821 4.354 20 0 DIADLO Cc1cc(-c2cccc(C(=O)N3CCC(C)CC3)c2)cc(C)[nH+]1 ZINC001240109429 1056331224 /nfs/dbraw/zinc/33/12/24/1056331224.db2.gz MYXWUKVWZVMGDF-UHFFFAOYSA-N 1 2 308.425 4.238 20 0 DIADLO CCOC(=O)c1ccc(-c2ccc3[nH+]ccn3c2)c2ccccc12 ZINC001240218954 1056374992 /nfs/dbraw/zinc/37/49/92/1056374992.db2.gz RASHNVOHFGMJNW-UHFFFAOYSA-N 1 2 316.360 4.331 20 0 DIADLO Fc1ccc2nc(C(F)F)nc(-c3ccc4[nH+]ccn4c3)c2c1 ZINC001240217823 1056377256 /nfs/dbraw/zinc/37/72/56/1056377256.db2.gz XIMNSXJOWYVAOX-UHFFFAOYSA-N 1 2 314.270 4.021 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+](C)Cc1noc2c1CCCC2 ZINC000108854894 1056377932 /nfs/dbraw/zinc/37/79/32/1056377932.db2.gz MSHKUEZEXTUGOJ-GFCCVEGCSA-N 1 2 304.821 4.400 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1noc2c1CCCC2 ZINC000108854894 1056377948 /nfs/dbraw/zinc/37/79/48/1056377948.db2.gz MSHKUEZEXTUGOJ-GFCCVEGCSA-N 1 2 304.821 4.400 20 0 DIADLO c1cn2cc(-c3ccc4nc(-c5ccccc5)cn4c3)ccc2[nH+]1 ZINC001240221597 1056378787 /nfs/dbraw/zinc/37/87/87/1056378787.db2.gz NOOGHWFYZLOWOL-UHFFFAOYSA-N 1 2 310.360 4.316 20 0 DIADLO Fc1ccc(COc2cc(-c3ccc4[nH+]ccn4c3)ccn2)cc1 ZINC001240221291 1056379083 /nfs/dbraw/zinc/37/90/83/1056379083.db2.gz KPITVTDFVUDZPK-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO COc1cc(-c2ccc3[nH+]ccn3c2)ccc1-c1ccncc1 ZINC001240221167 1056379332 /nfs/dbraw/zinc/37/93/32/1056379332.db2.gz HXABKMSTGIPKJM-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+](C)Cc1noc2c1CCCC2 ZINC000108854891 1056379437 /nfs/dbraw/zinc/37/94/37/1056379437.db2.gz MSHKUEZEXTUGOJ-LBPRGKRZSA-N 1 2 304.821 4.400 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1noc2c1CCCC2 ZINC000108854891 1056379454 /nfs/dbraw/zinc/37/94/54/1056379454.db2.gz MSHKUEZEXTUGOJ-LBPRGKRZSA-N 1 2 304.821 4.400 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cccc(N2CCCCC2)c1 ZINC001240252809 1056392785 /nfs/dbraw/zinc/39/27/85/1056392785.db2.gz UGIJCVRIQJFKGY-UHFFFAOYSA-N 1 2 307.397 4.000 20 0 DIADLO Cn1c[nH+]cc1-c1ccc(-c2ccc(C(F)(F)F)nc2)cc1 ZINC001240269322 1056402939 /nfs/dbraw/zinc/40/29/39/1056402939.db2.gz FUWWTBZOTRMFQV-UHFFFAOYSA-N 1 2 303.287 4.168 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc2ncsc2c1 ZINC001240347501 1056440728 /nfs/dbraw/zinc/44/07/28/1056440728.db2.gz OKRKHWVYHMHELC-UHFFFAOYSA-N 1 2 307.378 4.158 20 0 DIADLO Cc1cc(C)c(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)c(C)c1 ZINC001584947159 1056448024 /nfs/dbraw/zinc/44/80/24/1056448024.db2.gz DMBXMKCLBDNDIF-UHFFFAOYSA-N 1 2 319.408 4.358 20 0 DIADLO Cn1cc(-c2ccc(-c3ccc(-c4[nH]cc[nH+]4)cc3)cc2)cn1 ZINC001240364460 1056448906 /nfs/dbraw/zinc/44/89/06/1056448906.db2.gz LETWCFOUSBUMIS-UHFFFAOYSA-N 1 2 300.365 4.144 20 0 DIADLO C/C(=C\C(=O)NCc1c[nH+]c(C)cc1C)c1cccc(Cl)c1 ZINC001585012015 1056463697 /nfs/dbraw/zinc/46/36/97/1056463697.db2.gz REXAVOOYGGVGRU-MDWZMJQESA-N 1 2 314.816 4.072 20 0 DIADLO COc1ccccc1Cc1cn(Cc2cc(C)sc2C)c[nH+]1 ZINC001615063687 1056466426 /nfs/dbraw/zinc/46/64/26/1056466426.db2.gz ALWQMTMGBHVJPV-UHFFFAOYSA-N 1 2 312.438 4.209 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1nc2c(o1)CCCC2 ZINC001615148513 1056469805 /nfs/dbraw/zinc/46/98/05/1056469805.db2.gz IZWPCFJJFOATQT-CQSZACIVSA-N 1 2 302.443 4.124 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1nc2c(o1)CCCC2 ZINC001615148513 1056469808 /nfs/dbraw/zinc/46/98/08/1056469808.db2.gz IZWPCFJJFOATQT-CQSZACIVSA-N 1 2 302.443 4.124 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@@H+]2CC/C=C\c2ccccc2)no1 ZINC001615215704 1056477779 /nfs/dbraw/zinc/47/77/79/1056477779.db2.gz ZBLUAEKCFRQNQY-NYDKFZDJSA-N 1 2 311.429 4.263 20 0 DIADLO CCc1nc([C@@H]2CCCC[N@H+]2CC/C=C\c2ccccc2)no1 ZINC001615215704 1056477789 /nfs/dbraw/zinc/47/77/89/1056477789.db2.gz ZBLUAEKCFRQNQY-NYDKFZDJSA-N 1 2 311.429 4.263 20 0 DIADLO C[C@H](c1cccs1)[N@H+](C)Cc1ncccc1Br ZINC000382424925 1056489494 /nfs/dbraw/zinc/48/94/94/1056489494.db2.gz WCUZXSDLEURWGM-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO C[C@H](c1cccs1)[N@@H+](C)Cc1ncccc1Br ZINC000382424925 1056489507 /nfs/dbraw/zinc/48/95/07/1056489507.db2.gz WCUZXSDLEURWGM-SNVBAGLBSA-N 1 2 311.248 4.099 20 0 DIADLO CC[NH2+]Cc1noc(C2(Sc3ccc(C)cc3)CCCC2)n1 ZINC000843140661 1056490929 /nfs/dbraw/zinc/49/09/29/1056490929.db2.gz ANZSIKLWXTZNBN-UHFFFAOYSA-N 1 2 317.458 4.049 20 0 DIADLO CC1(C[N@@H+]2CCO[C@H](c3ccccc3Br)C2)CCC1 ZINC001615354496 1056498175 /nfs/dbraw/zinc/49/81/75/1056498175.db2.gz QNAWQSFHNQSGMC-HNNXBMFYSA-N 1 2 324.262 4.013 20 0 DIADLO CC1(C[N@H+]2CCO[C@H](c3ccccc3Br)C2)CCC1 ZINC001615354496 1056498182 /nfs/dbraw/zinc/49/81/82/1056498182.db2.gz QNAWQSFHNQSGMC-HNNXBMFYSA-N 1 2 324.262 4.013 20 0 DIADLO COc1ccc(F)c(F)c1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001240432674 1056504219 /nfs/dbraw/zinc/50/42/19/1056504219.db2.gz DNLWDTKRTGSIGN-UHFFFAOYSA-N 1 2 318.367 4.334 20 0 DIADLO Cc1cc(-c2cc(F)cc(C)c2C[NH+]2CCOCC2)c(C)s1 ZINC001240433388 1056505128 /nfs/dbraw/zinc/50/51/28/1056505128.db2.gz XQQOUZUSTLKCRX-UHFFFAOYSA-N 1 2 319.445 4.312 20 0 DIADLO CCc1noc(C)c1CNc1[nH+]cccc1OCc1ccccc1 ZINC000338731337 1056505204 /nfs/dbraw/zinc/50/52/04/1056505204.db2.gz ZFIMBENIZFMZOT-UHFFFAOYSA-N 1 2 323.396 4.132 20 0 DIADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)co1)c1ccc(-n2cccn2)cc1 ZINC000921806136 1056507196 /nfs/dbraw/zinc/50/71/96/1056507196.db2.gz JCTJQZNLBYCUFE-AWEZNQCLSA-N 1 2 324.428 4.009 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2noc3c2CC(C)(C)CC3)s1 ZINC001615417839 1056507707 /nfs/dbraw/zinc/50/77/07/1056507707.db2.gz LTNRUDKOEJUZSU-UHFFFAOYSA-N 1 2 304.459 4.191 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2noc3c2CC(C)(C)CC3)s1 ZINC001615417839 1056507717 /nfs/dbraw/zinc/50/77/17/1056507717.db2.gz LTNRUDKOEJUZSU-UHFFFAOYSA-N 1 2 304.459 4.191 20 0 DIADLO COc1cccc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)n1 ZINC001615435898 1056511553 /nfs/dbraw/zinc/51/15/53/1056511553.db2.gz MAXVOEIKGGSEDU-CYBMUJFWSA-N 1 2 316.832 4.469 20 0 DIADLO COc1cccc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)n1 ZINC001615435898 1056511571 /nfs/dbraw/zinc/51/15/71/1056511571.db2.gz MAXVOEIKGGSEDU-CYBMUJFWSA-N 1 2 316.832 4.469 20 0 DIADLO CC[N@@H+](Cc1cn2cccc(C)c2n1)Cc1ccc(Cl)s1 ZINC000061783027 1056519224 /nfs/dbraw/zinc/51/92/24/1056519224.db2.gz BPJVFDZEEWSZDR-UHFFFAOYSA-N 1 2 319.861 4.380 20 0 DIADLO CC[N@H+](Cc1cn2cccc(C)c2n1)Cc1ccc(Cl)s1 ZINC000061783027 1056519232 /nfs/dbraw/zinc/51/92/32/1056519232.db2.gz BPJVFDZEEWSZDR-UHFFFAOYSA-N 1 2 319.861 4.380 20 0 DIADLO CC[N@H+](Cc1cccs1)Cc1nc(-c2ccccc2C)no1 ZINC000061785587 1056520926 /nfs/dbraw/zinc/52/09/26/1056520926.db2.gz LIWSVNGFRPAZDC-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO CC[N@@H+](Cc1cccs1)Cc1nc(-c2ccccc2C)no1 ZINC000061785587 1056520934 /nfs/dbraw/zinc/52/09/34/1056520934.db2.gz LIWSVNGFRPAZDC-UHFFFAOYSA-N 1 2 313.426 4.129 20 0 DIADLO C[C@@H]1CCc2c(sc3ncnc(-c4ccn5cc[nH+]c5c4)c23)C1 ZINC001240496700 1056538049 /nfs/dbraw/zinc/53/80/49/1056538049.db2.gz QTYKSQGNJHRLBG-LLVKDONJSA-N 1 2 320.421 4.131 20 0 DIADLO c1cn2ccc(-c3ncnc4sc5ccccc5c43)cc2[nH+]1 ZINC001240503649 1056539469 /nfs/dbraw/zinc/53/94/69/1056539469.db2.gz QKPNSZJRUWBSKI-UHFFFAOYSA-N 1 2 302.362 4.159 20 0 DIADLO CCc1nc2sc3c(c2c(-c2ccn4cc[nH+]c4c2)n1)CCC3 ZINC001240504267 1056542901 /nfs/dbraw/zinc/54/29/01/1056542901.db2.gz LWIFZRHDZQVFCQ-UHFFFAOYSA-N 1 2 320.421 4.057 20 0 DIADLO Fc1cccc(COc2cc(-c3ccn4cc[nH+]c4c3)ccn2)c1 ZINC001240513181 1056547454 /nfs/dbraw/zinc/54/74/54/1056547454.db2.gz KLENWSGOFLMDRO-UHFFFAOYSA-N 1 2 319.339 4.114 20 0 DIADLO Fc1ccc(Br)c(CNc2cc3cc[nH]c3c[nH+]2)c1 ZINC000672169187 1056556864 /nfs/dbraw/zinc/55/68/64/1056556864.db2.gz RNCOQKQCZGUTEG-UHFFFAOYSA-N 1 2 320.165 4.077 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@@H+]1CC[C@@H](C)C[C@H]1c1ccc(C)o1 ZINC001615679222 1056560982 /nfs/dbraw/zinc/56/09/82/1056560982.db2.gz SOYWCTHIGDPNBK-KBMXLJTQSA-N 1 2 307.434 4.093 20 0 DIADLO CCCCOC(=O)[C@H](C)[N@H+]1CC[C@@H](C)C[C@H]1c1ccc(C)o1 ZINC001615679222 1056560995 /nfs/dbraw/zinc/56/09/95/1056560995.db2.gz SOYWCTHIGDPNBK-KBMXLJTQSA-N 1 2 307.434 4.093 20 0 DIADLO CC[C@H](C)C[C@@H](C)Nc1[nH+]cccc1CC(=O)OC(C)(C)C ZINC001168688770 1056564339 /nfs/dbraw/zinc/56/43/39/1056564339.db2.gz DMLNPDOAZNZZLE-UONOGXRCSA-N 1 2 306.450 4.202 20 0 DIADLO C[C@@H](c1nnc(-c2cccs2)o1)[N@H+](C)Cc1ccsc1 ZINC000007927149 1056602345 /nfs/dbraw/zinc/60/23/45/1056602345.db2.gz BDRBCJCTEOMQBW-JTQLQIEISA-N 1 2 305.428 4.053 20 0 DIADLO C[C@@H](c1nnc(-c2cccs2)o1)[N@@H+](C)Cc1ccsc1 ZINC000007927149 1056602356 /nfs/dbraw/zinc/60/23/56/1056602356.db2.gz BDRBCJCTEOMQBW-JTQLQIEISA-N 1 2 305.428 4.053 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(-c2ccc(O)cc2)cc1 ZINC001240606899 1056611959 /nfs/dbraw/zinc/61/19/59/1056611959.db2.gz LRIFJLNPOMYEKF-UHFFFAOYSA-N 1 2 316.360 4.383 20 0 DIADLO CCN(Cc1c[nH+]c(N(C)C)c2ccccc12)c1ccccc1 ZINC001616112549 1056612647 /nfs/dbraw/zinc/61/26/47/1056612647.db2.gz UHPOTQMMKANSKX-UHFFFAOYSA-N 1 2 305.425 4.327 20 0 DIADLO Oc1ccc(-c2ccc(-c3c[nH+]c4c(c3)CCCN4)cc2)cc1 ZINC001240613875 1056615746 /nfs/dbraw/zinc/61/57/46/1056615746.db2.gz MZURGUWTSJUBPE-UHFFFAOYSA-N 1 2 302.377 4.122 20 0 DIADLO CC[C@@H]1CCc2ccccc2[N@@H+]1C[Si](C)(C)c1ccccc1 ZINC001616208407 1056619668 /nfs/dbraw/zinc/61/96/68/1056619668.db2.gz NGUHXPYZXSJKFU-GOSISDBHSA-N 1 2 309.529 4.373 20 0 DIADLO CC[C@@H]1CCc2ccccc2[N@H+]1C[Si](C)(C)c1ccccc1 ZINC001616208407 1056619674 /nfs/dbraw/zinc/61/96/74/1056619674.db2.gz NGUHXPYZXSJKFU-GOSISDBHSA-N 1 2 309.529 4.373 20 0 DIADLO CC(C)(C)OC1CC[NH+](Cc2nccc(Cl)c2Cl)CC1 ZINC001616321763 1056633924 /nfs/dbraw/zinc/63/39/24/1056633924.db2.gz HJFCKCOUBGQIGS-UHFFFAOYSA-N 1 2 317.260 4.168 20 0 DIADLO Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)Nc1c(C)c[nH+]cc1C ZINC001616246112 1056624584 /nfs/dbraw/zinc/62/45/84/1056624584.db2.gz FGMQMKMTFLSPCK-CZUORRHYSA-N 1 2 308.425 4.048 20 0 DIADLO C[C@]1(c2ccccc2)C[N@H+](Cc2nsc3ccccc32)CCO1 ZINC001616308755 1056631980 /nfs/dbraw/zinc/63/19/80/1056631980.db2.gz KAPSPEZNZNSDSM-LJQANCHMSA-N 1 2 324.449 4.044 20 0 DIADLO C[C@]1(c2ccccc2)C[N@@H+](Cc2nsc3ccccc32)CCO1 ZINC001616308755 1056631986 /nfs/dbraw/zinc/63/19/86/1056631986.db2.gz KAPSPEZNZNSDSM-LJQANCHMSA-N 1 2 324.449 4.044 20 0 DIADLO CC(C)CCc1noc(C[N@H+](Cc2ccccc2)C(C)C)n1 ZINC000064508301 1056644079 /nfs/dbraw/zinc/64/40/79/1056644079.db2.gz BUXHDQKZSNOOAG-UHFFFAOYSA-N 1 2 301.434 4.069 20 0 DIADLO CC(C)CCc1noc(C[N@@H+](Cc2ccccc2)C(C)C)n1 ZINC000064508301 1056644083 /nfs/dbraw/zinc/64/40/83/1056644083.db2.gz BUXHDQKZSNOOAG-UHFFFAOYSA-N 1 2 301.434 4.069 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1ccc(Cl)cn1 ZINC001616402620 1056650764 /nfs/dbraw/zinc/65/07/64/1056650764.db2.gz MNIINLYSJDHFGT-NEPJUHHUSA-N 1 2 304.796 4.382 20 0 DIADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1ccc(Cl)cn1 ZINC001616402620 1056650767 /nfs/dbraw/zinc/65/07/67/1056650767.db2.gz MNIINLYSJDHFGT-NEPJUHHUSA-N 1 2 304.796 4.382 20 0 DIADLO Cc1nc(C[N@@H+]2[C@H](C)Cc3cc(F)ccc3[C@@H]2C)c(C)s1 ZINC001616403542 1056652493 /nfs/dbraw/zinc/65/24/93/1056652493.db2.gz SLNWTGRVLKSHPG-MNOVXSKESA-N 1 2 304.434 4.407 20 0 DIADLO Cc1nc(C[N@H+]2[C@H](C)Cc3cc(F)ccc3[C@@H]2C)c(C)s1 ZINC001616403542 1056652496 /nfs/dbraw/zinc/65/24/96/1056652496.db2.gz SLNWTGRVLKSHPG-MNOVXSKESA-N 1 2 304.434 4.407 20 0 DIADLO Cc1[nH+]c(C(C)(C)C)nc(N[C@H](C)CCCC(C)(C)O)c1C ZINC001168697251 1056654220 /nfs/dbraw/zinc/65/42/20/1056654220.db2.gz AIRYKLSEEBIKSH-GFCCVEGCSA-N 1 2 307.482 4.133 20 0 DIADLO COc1c(F)ccc(F)c1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001240722956 1056661457 /nfs/dbraw/zinc/66/14/57/1056661457.db2.gz HHLQYHQHOMLSLW-UHFFFAOYSA-N 1 2 318.367 4.334 20 0 DIADLO Brc1cscc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000347676283 1056663096 /nfs/dbraw/zinc/66/30/96/1056663096.db2.gz PVCHBAKZECORFN-ZDUSSCGKSA-N 1 2 311.248 4.176 20 0 DIADLO Brc1cscc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000347676283 1056663101 /nfs/dbraw/zinc/66/31/01/1056663101.db2.gz PVCHBAKZECORFN-ZDUSSCGKSA-N 1 2 311.248 4.176 20 0 DIADLO Cc1cccn2cc(C[NH2+]Cc3cccc(Cl)c3Cl)nc12 ZINC000076895014 1056664470 /nfs/dbraw/zinc/66/44/70/1056664470.db2.gz FATJJCIWYNSJQE-UHFFFAOYSA-N 1 2 320.223 4.239 20 0 DIADLO CC(C)(C)c1cccc(C[NH2+][C@@H](CO)c2c(F)cccc2F)c1 ZINC001616538022 1056673872 /nfs/dbraw/zinc/67/38/72/1056673872.db2.gz CCSXMBFEZZGAFA-KRWDZBQOSA-N 1 2 319.395 4.086 20 0 DIADLO Cn1ccc2c[nH+]c(-c3ccc(OCc4ccccc4)cc3)nc21 ZINC001240747826 1056676868 /nfs/dbraw/zinc/67/68/68/1056676868.db2.gz VPIBMANQHVYMOH-UHFFFAOYSA-N 1 2 315.376 4.214 20 0 DIADLO CC[NH+](CC)[C@H](C(=O)Oc1ccc(C)c(F)c1)c1ccccc1 ZINC001586189658 1056688290 /nfs/dbraw/zinc/68/82/90/1056688290.db2.gz ITXQLVQMUSRMKZ-SFHVURJKSA-N 1 2 315.388 4.123 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cncc(C(F)(F)F)c2)c1 ZINC001240793085 1056702948 /nfs/dbraw/zinc/70/29/48/1056702948.db2.gz PJYJHEWIOCKCSU-UHFFFAOYSA-N 1 2 303.287 4.168 20 0 DIADLO Cc1cc(C)[nH+]c(CN(Cc2cccs2)CC(F)(F)F)c1 ZINC001616891961 1056732988 /nfs/dbraw/zinc/73/29/88/1056732988.db2.gz LJRBSYCOBJIELC-UHFFFAOYSA-N 1 2 314.376 4.324 20 0 DIADLO Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+][C@H]1CCCC1(F)F ZINC000672622449 1056738832 /nfs/dbraw/zinc/73/88/32/1056738832.db2.gz IXBPQFBMJWYZSI-MFKMUULPSA-N 1 2 323.412 4.352 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@H+](C)Cc1ccc(Cl)c(F)c1 ZINC001616935504 1056743520 /nfs/dbraw/zinc/74/35/20/1056743520.db2.gz BACSIURDNLJCGE-AWEZNQCLSA-N 1 2 315.816 4.031 20 0 DIADLO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC001616935504 1056743525 /nfs/dbraw/zinc/74/35/25/1056743525.db2.gz BACSIURDNLJCGE-AWEZNQCLSA-N 1 2 315.816 4.031 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1ccc2ccccc2c1 ZINC001240909570 1056753623 /nfs/dbraw/zinc/75/36/23/1056753623.db2.gz LGYULDIPGFPUSM-UHFFFAOYSA-N 1 2 304.393 4.047 20 0 DIADLO CCC(CC)[C@@H](NC(=O)c1cc2c[nH+]ccc2[nH]1)c1ccccc1 ZINC001586623619 1056770378 /nfs/dbraw/zinc/77/03/78/1056770378.db2.gz BKHDWUYKSGMTMQ-LJQANCHMSA-N 1 2 321.424 4.470 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3cc(C)c(Cl)c(C)c3)nn2)c1C ZINC001205044663 1056773651 /nfs/dbraw/zinc/77/36/51/1056773651.db2.gz IQESRTRLKMZKMH-UHFFFAOYSA-N 1 2 312.804 4.216 20 0 DIADLO CC(C)OC(=O)c1cccc(-c2ccccc2Cn2cc[nH+]c2)c1 ZINC001240947046 1056775336 /nfs/dbraw/zinc/77/53/36/1056775336.db2.gz KJBWPZZGBIDOIV-UHFFFAOYSA-N 1 2 320.392 4.164 20 0 DIADLO Cc1cc(C)c(C(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)c(C)[nH+]1 ZINC001128319216 1056779232 /nfs/dbraw/zinc/77/92/32/1056779232.db2.gz PDFQAEUXLBVJPC-DLBZAZTESA-N 1 2 302.462 4.342 20 0 DIADLO COc1cc(F)c(-c2cccc(-c3c[nH+]cn3C)c2)cc1F ZINC001240956620 1056782558 /nfs/dbraw/zinc/78/25/58/1056782558.db2.gz DQYCZNYBBATCOJ-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO CC[C@@H](CC(C)C)C(=O)N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC001128329957 1056794820 /nfs/dbraw/zinc/79/48/20/1056794820.db2.gz UVPFTGVCQUHWJI-CVEARBPZSA-N 1 2 322.518 4.026 20 0 DIADLO CC[C@H](CC(C)C)C(=O)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC001128329960 1056796068 /nfs/dbraw/zinc/79/60/68/1056796068.db2.gz UVPFTGVCQUHWJI-JKSUJKDBSA-N 1 2 322.518 4.026 20 0 DIADLO CC1(C)CCC[N@H+](Cc2cn3cc(Cl)cc(Cl)c3n2)C1 ZINC001617231009 1056798575 /nfs/dbraw/zinc/79/85/75/1056798575.db2.gz DDIFPRYMRYRZMI-UHFFFAOYSA-N 1 2 312.244 4.263 20 0 DIADLO CC1(C)CCC[N@@H+](Cc2cn3cc(Cl)cc(Cl)c3n2)C1 ZINC001617231009 1056798583 /nfs/dbraw/zinc/79/85/83/1056798583.db2.gz DDIFPRYMRYRZMI-UHFFFAOYSA-N 1 2 312.244 4.263 20 0 DIADLO Fc1ccc(-c2nc3[nH]ccc3c[nH+]2)cc1OCc1ccccc1 ZINC001241005948 1056809412 /nfs/dbraw/zinc/80/94/12/1056809412.db2.gz CUIRLHWESTZDGU-UHFFFAOYSA-N 1 2 319.339 4.295 20 0 DIADLO CCCCCc1ccc(-c2cncc(C[NH+]3CCOCC3)c2)cc1 ZINC001241032050 1056831539 /nfs/dbraw/zinc/83/15/39/1056831539.db2.gz FREYZXMTKFTGIB-UHFFFAOYSA-N 1 2 324.468 4.314 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+]1CC[C@](F)(c2ccccc2)C1 ZINC001617531771 1056844843 /nfs/dbraw/zinc/84/48/43/1056844843.db2.gz DSLUZPAYZGRIQK-GOSISDBHSA-N 1 2 319.807 4.419 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+]1CC[C@](F)(c2ccccc2)C1 ZINC001617531771 1056844859 /nfs/dbraw/zinc/84/48/59/1056844859.db2.gz DSLUZPAYZGRIQK-GOSISDBHSA-N 1 2 319.807 4.419 20 0 DIADLO C[C@@H]1C[N@@H+]([C@@H](c2ccccc2)c2ccc(Cl)cc2)CCO1 ZINC000673064212 1056853991 /nfs/dbraw/zinc/85/39/91/1056853991.db2.gz ZIRPLFMZAAWDOO-KDOFPFPSSA-N 1 2 301.817 4.150 20 0 DIADLO C[C@@H]1C[N@H+]([C@@H](c2ccccc2)c2ccc(Cl)cc2)CCO1 ZINC000673064212 1056854002 /nfs/dbraw/zinc/85/40/02/1056854002.db2.gz ZIRPLFMZAAWDOO-KDOFPFPSSA-N 1 2 301.817 4.150 20 0 DIADLO CCOc1ccc(F)c(-c2ccc(-n3cc[nH+]c3)cc2)c1F ZINC001241059608 1056855799 /nfs/dbraw/zinc/85/57/99/1056855799.db2.gz ADSCIJGIUPFYKT-UHFFFAOYSA-N 1 2 300.308 4.216 20 0 DIADLO CCOc1ccc(F)c(-c2ccc(F)c(-n3cc[nH+]c3)c2)c1F ZINC001241058908 1056855954 /nfs/dbraw/zinc/85/59/54/1056855954.db2.gz AJLNYXVYUAIFHQ-UHFFFAOYSA-N 1 2 318.298 4.355 20 0 DIADLO COc1cc(C[NH2+]Cc2nc(C(C)(C)C)co2)cc2ccccc21 ZINC000922157968 1056865958 /nfs/dbraw/zinc/86/59/58/1056865958.db2.gz ILVZFPHGOXVIJS-UHFFFAOYSA-N 1 2 324.424 4.424 20 0 DIADLO Cc1cc(CNC(=O)N2CCCC[C@@H]2c2ccccc2)cc(C)[nH+]1 ZINC000422204685 1056874850 /nfs/dbraw/zinc/87/48/50/1056874850.db2.gz JHAAYHOWKLGKFZ-LJQANCHMSA-N 1 2 323.440 4.135 20 0 DIADLO COc1cc2[nH+]c[nH]c2cc1-c1ccc(F)c(C(F)(F)F)c1 ZINC001241097081 1056888876 /nfs/dbraw/zinc/88/88/76/1056888876.db2.gz NSVSOGCHOVUIHA-UHFFFAOYSA-N 1 2 310.250 4.396 20 0 DIADLO C[C@@H](CCCC(C)(C)O)[NH2+]c1cc2c3c(c1)CCCN3CCC2 ZINC001168704896 1056894788 /nfs/dbraw/zinc/89/47/88/1056894788.db2.gz JIQUGKRGEHFDML-HNNXBMFYSA-N 1 2 316.489 4.127 20 0 DIADLO C[C@@H](CCCC(C)(C)O)Nc1cc2c3c(c1)CCC[NH+]3CCC2 ZINC001168704896 1056894798 /nfs/dbraw/zinc/89/47/98/1056894798.db2.gz JIQUGKRGEHFDML-HNNXBMFYSA-N 1 2 316.489 4.127 20 0 DIADLO COc1c2ccccc2oc1C[NH2+][C@@H](C)c1nc(C)sc1C ZINC000682734637 1056913553 /nfs/dbraw/zinc/91/35/53/1056913553.db2.gz XRWXDWFMDWRWFL-JTQLQIEISA-N 1 2 316.426 4.366 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Br)o2)cc1 ZINC000682995884 1056929059 /nfs/dbraw/zinc/92/90/59/1056929059.db2.gz SWWOJUZJOJJIGW-AWEZNQCLSA-N 1 2 322.202 4.085 20 0 DIADLO Oc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Br)o2)cc1 ZINC000682995884 1056929066 /nfs/dbraw/zinc/92/90/66/1056929066.db2.gz SWWOJUZJOJJIGW-AWEZNQCLSA-N 1 2 322.202 4.085 20 0 DIADLO CC(C)(C)Oc1ncccc1-c1ccc(F)c(-n2cc[nH+]c2)c1 ZINC001241152265 1056929543 /nfs/dbraw/zinc/92/95/43/1056929543.db2.gz UICCCXHRDWTVEL-UHFFFAOYSA-N 1 2 311.360 4.251 20 0 DIADLO CC(C)([NH2+]Cc1noc2c1CC(C)(C)CC2)c1ccccc1F ZINC001618197222 1056932189 /nfs/dbraw/zinc/93/21/89/1056932189.db2.gz YJPKPGZHMIZKEY-UHFFFAOYSA-N 1 2 316.420 4.354 20 0 DIADLO CC[C@@](C)([NH2+]Cc1cccc(OC2CC2)c1F)c1nccs1 ZINC000657369925 1056943896 /nfs/dbraw/zinc/94/38/96/1056943896.db2.gz JBAUXTCIQOJJGN-QGZVFWFLSA-N 1 2 320.433 4.238 20 0 DIADLO COc1cccc(OC)c1-c1ccc(-c2cc[nH+]c(N)c2)cc1 ZINC001241175883 1056946098 /nfs/dbraw/zinc/94/60/98/1056946098.db2.gz PMZJKPWKTAUISR-UHFFFAOYSA-N 1 2 306.365 4.015 20 0 DIADLO Cc1cc(C)c(NC(=O)[C@@H]2C[C@@H]2c2c(F)cccc2F)c(C)[nH+]1 ZINC000115984620 1056960007 /nfs/dbraw/zinc/96/00/07/1056960007.db2.gz DSRKKVCFVMKBFU-QWHCGFSZSA-N 1 2 316.351 4.027 20 0 DIADLO Cc1cc(-c2ccc(Cn3cc[nH+]c3)cn2)ccc1OC(C)C ZINC001241220827 1056967378 /nfs/dbraw/zinc/96/73/78/1056967378.db2.gz APNNGUICGGNOKZ-UHFFFAOYSA-N 1 2 307.397 4.089 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1ncnc2sc3c(c21)CCCC3 ZINC001241233942 1056972309 /nfs/dbraw/zinc/97/23/09/1056972309.db2.gz XCGCWFOGGDUMOO-UHFFFAOYSA-N 1 2 324.453 4.007 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1nnc(-c2cccc(F)c2)cc1C ZINC001241241159 1056976941 /nfs/dbraw/zinc/97/69/41/1056976941.db2.gz XYPUKAXKSZHAHP-UHFFFAOYSA-N 1 2 322.387 4.028 20 0 DIADLO Cc1cc(N(C)C)[nH+]cc1-c1cc(C(C)C)nc(C(C)(C)C)n1 ZINC001241240805 1056976974 /nfs/dbraw/zinc/97/69/74/1056976974.db2.gz UNOISRUXSHFDFS-UHFFFAOYSA-N 1 2 312.461 4.334 20 0 DIADLO CC(C)OC(=O)c1ccc(-c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001241284665 1056996528 /nfs/dbraw/zinc/99/65/28/1056996528.db2.gz OOXOBOSGLMKXAP-UHFFFAOYSA-N 1 2 306.365 4.105 20 0 DIADLO C[N@H+](Cc1ccn(C(F)F)n1)Cc1csc2ccccc12 ZINC000347707977 1057006163 /nfs/dbraw/zinc/00/61/63/1057006163.db2.gz RQHLFCGKAMJGKS-UHFFFAOYSA-N 1 2 307.369 4.125 20 0 DIADLO C[N@@H+](Cc1ccn(C(F)F)n1)Cc1csc2ccccc12 ZINC000347707977 1057006167 /nfs/dbraw/zinc/00/61/67/1057006167.db2.gz RQHLFCGKAMJGKS-UHFFFAOYSA-N 1 2 307.369 4.125 20 0 DIADLO O=C(Nc1ccccc1-n1cc[nH+]c1)c1cc2cc(F)ccc2o1 ZINC000117752900 1057008414 /nfs/dbraw/zinc/00/84/14/1057008414.db2.gz RJQPCYJJSYVLBS-UHFFFAOYSA-N 1 2 321.311 4.010 20 0 DIADLO CSc1cccc(-c2ccc(C[NH+]3CCOCC3)cc2F)c1 ZINC001241315533 1057010654 /nfs/dbraw/zinc/01/06/54/1057010654.db2.gz JHZFJYHYJBCXIM-UHFFFAOYSA-N 1 2 317.429 4.047 20 0 DIADLO Cc1[nH+]cn(-c2ccc(-c3ccc(CC(C)C)cc3)nn2)c1C ZINC001241325757 1057013787 /nfs/dbraw/zinc/01/37/87/1057013787.db2.gz CPJJEDCYOLMOQR-UHFFFAOYSA-N 1 2 306.413 4.145 20 0 DIADLO C[C@H]1SCC[N@H+](Cc2csc(-c3cccs3)n2)[C@@H]1C ZINC000118414612 1057018460 /nfs/dbraw/zinc/01/84/60/1057018460.db2.gz QJAYFTFCFDSPPB-GHMZBOCLSA-N 1 2 310.513 4.197 20 0 DIADLO C[C@H]1SCC[N@@H+](Cc2csc(-c3cccs3)n2)[C@@H]1C ZINC000118414612 1057018462 /nfs/dbraw/zinc/01/84/62/1057018462.db2.gz QJAYFTFCFDSPPB-GHMZBOCLSA-N 1 2 310.513 4.197 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)C[C@@H](C)c3ccccc3F)cc2[nH+]1 ZINC000338854382 1057024162 /nfs/dbraw/zinc/02/41/62/1057024162.db2.gz FYMPWTUEVZSHKE-LLVKDONJSA-N 1 2 311.360 4.143 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(C2=CCN(c3ccccc3)CC2)c1 ZINC001241354542 1057024513 /nfs/dbraw/zinc/02/45/13/1057024513.db2.gz DPYLZPXHXMRRHR-UHFFFAOYSA-N 1 2 315.420 4.381 20 0 DIADLO Clc1scc(C[NH2+]Cc2nc3c(s2)CCC3)c1Cl ZINC000922470865 1057026179 /nfs/dbraw/zinc/02/61/79/1057026179.db2.gz AXWHBDUNBIZXAP-UHFFFAOYSA-N 1 2 319.282 4.290 20 0 DIADLO Cc1ccc2cc(C[NH2+][C@@H]3c4ccccc4OC[C@@H]3F)ccc2n1 ZINC000922520083 1057029509 /nfs/dbraw/zinc/02/95/09/1057029509.db2.gz KCXNHTVVUFVRAO-FXAWDEMLSA-N 1 2 322.383 4.105 20 0 DIADLO Cc1cccc2[nH]c(C[NH2+][C@@H]3c4ccccc4OC[C@H]3F)cc21 ZINC000922522902 1057030244 /nfs/dbraw/zinc/03/02/44/1057030244.db2.gz XBEVCIAUKVLGER-VQIMIIECSA-N 1 2 310.372 4.038 20 0 DIADLO CSc1ccc(C[NH2+][C@H]2c3ccccc3OC[C@H]2F)s1 ZINC000922520295 1057030350 /nfs/dbraw/zinc/03/03/50/1057030350.db2.gz LAOKKLFXEKUYCZ-DOMZBBRYSA-N 1 2 309.431 4.031 20 0 DIADLO Cc1nc(C2([NH2+]Cc3c(C)cccc3C)CCCCCC2)no1 ZINC000154479284 1057030650 /nfs/dbraw/zinc/03/06/50/1057030650.db2.gz YSINPDVXWLHDFX-UHFFFAOYSA-N 1 2 313.445 4.334 20 0 DIADLO CC(C)(C)OCc1ccccc1NCc1cccc2[nH+]ccn21 ZINC000922551786 1057031413 /nfs/dbraw/zinc/03/14/13/1057031413.db2.gz VHGGBBFQRYLLPK-UHFFFAOYSA-N 1 2 309.413 4.262 20 0 DIADLO CCc1cccc2cc(C[NH2+][C@@H](c3ncccn3)C3CC3)oc21 ZINC000922578275 1057034182 /nfs/dbraw/zinc/03/41/82/1057034182.db2.gz ZOQLPHGKQRIGLS-QGZVFWFLSA-N 1 2 307.397 4.026 20 0 DIADLO Fc1ccccc1-c1ccc(C[NH2+][C@H](c2ncccn2)C2CC2)o1 ZINC000922579246 1057034189 /nfs/dbraw/zinc/03/41/89/1057034189.db2.gz HBACAMGNWSRKDY-SFHVURJKSA-N 1 2 323.371 4.117 20 0 DIADLO COc1ccc(C[NH2+][C@@H]2CCCC2(F)F)cc1OCC(C)C ZINC000673617862 1057063018 /nfs/dbraw/zinc/06/30/18/1057063018.db2.gz LNVVWWXXDJCQQN-MRXNPFEDSA-N 1 2 313.388 4.007 20 0 DIADLO FC(F)Oc1ccc(C[NH2+][C@@H]2CCCC2(F)F)cc1Cl ZINC000673617877 1057063078 /nfs/dbraw/zinc/06/30/78/1057063078.db2.gz MNRMEWPMNUFPBX-LLVKDONJSA-N 1 2 311.706 4.219 20 0 DIADLO Brc1cnccc1C[N@H+](Cc1ccccc1)C1CC1 ZINC000625053831 1057081236 /nfs/dbraw/zinc/08/12/36/1057081236.db2.gz KVMDUUNROBGFFY-UHFFFAOYSA-N 1 2 317.230 4.009 20 0 DIADLO Brc1cnccc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000625053831 1057081239 /nfs/dbraw/zinc/08/12/39/1057081239.db2.gz KVMDUUNROBGFFY-UHFFFAOYSA-N 1 2 317.230 4.009 20 0 DIADLO Cc1c[nH]c(C[NH2+][C@@H]2C[C@@H](c3ccccc3)Oc3ccccc32)n1 ZINC000922887033 1057087381 /nfs/dbraw/zinc/08/73/81/1057087381.db2.gz XZFFOILRYBLFOK-MJGOQNOKSA-N 1 2 319.408 4.073 20 0 DIADLO CCCOc1cccc(-c2ccc(-n3cc[nH+]c3)cc2OC)c1 ZINC001241594008 1057103469 /nfs/dbraw/zinc/10/34/69/1057103469.db2.gz ZRDYWUUJKSSTLL-UHFFFAOYSA-N 1 2 308.381 4.337 20 0 DIADLO Cc1ccccc1-c1noc(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)n1 ZINC000673714300 1057119596 /nfs/dbraw/zinc/11/95/96/1057119596.db2.gz VVGRHJRMIXMUDE-HNAYVOBHSA-N 1 2 319.408 4.238 20 0 DIADLO Cc1ccccc1-c1noc(C[N@@H+]2C[C@H](C)[C@@H]2c2ccccc2)n1 ZINC000673714300 1057119600 /nfs/dbraw/zinc/11/96/00/1057119600.db2.gz VVGRHJRMIXMUDE-HNAYVOBHSA-N 1 2 319.408 4.238 20 0 DIADLO Fc1ccccc1Oc1ccc(C[NH2+]Cc2ccon2)cc1F ZINC000673886215 1057145870 /nfs/dbraw/zinc/14/58/70/1057145870.db2.gz TYIZCMRSPZFFMW-UHFFFAOYSA-N 1 2 316.307 4.035 20 0 DIADLO C[C@@H]([NH2+]Cc1[nH]nc2ccccc21)c1c(F)cccc1Cl ZINC000673930624 1057152704 /nfs/dbraw/zinc/15/27/04/1057152704.db2.gz ZICOSQXJQBTNQL-SNVBAGLBSA-N 1 2 303.768 4.206 20 0 DIADLO CCN(CC)c1ccc(N[C@H](C)c2ccc(C(F)F)nc2)c[nH+]1 ZINC000657951603 1057155480 /nfs/dbraw/zinc/15/54/80/1057155480.db2.gz BUPSMLUFSLKBDU-GFCCVEGCSA-N 1 2 320.387 4.434 20 0 DIADLO OCc1ccc(F)c(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccco2)c1 ZINC000625535252 1057158033 /nfs/dbraw/zinc/15/80/33/1057158033.db2.gz MMZPLBHUXFNEEF-SFHVURJKSA-N 1 2 315.388 4.028 20 0 DIADLO OCc1ccc(F)c(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccco2)c1 ZINC000625535252 1057158039 /nfs/dbraw/zinc/15/80/39/1057158039.db2.gz MMZPLBHUXFNEEF-SFHVURJKSA-N 1 2 315.388 4.028 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cc(C(C)C)c(F)cc1OC ZINC001241787134 1057163537 /nfs/dbraw/zinc/16/35/37/1057163537.db2.gz DHZYWIHWNBZCIR-UHFFFAOYSA-N 1 2 314.360 4.281 20 0 DIADLO c1cc2c(cc[nH+]c2-c2cccnc2OCc2ccccc2)[nH]1 ZINC001241827393 1057178630 /nfs/dbraw/zinc/17/86/30/1057178630.db2.gz MTLYPWHBAFHYBK-UHFFFAOYSA-N 1 2 301.349 4.204 20 0 DIADLO CCOc1ccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)c(Cl)c1 ZINC001241842207 1057186251 /nfs/dbraw/zinc/18/62/51/1057186251.db2.gz NJUPARUGXZEVQV-UHFFFAOYSA-N 1 2 316.710 4.402 20 0 DIADLO C[NH+](C)Cc1c(F)cc(-c2cnn(C3CCCCC3)c2)cc1F ZINC001241844002 1057187156 /nfs/dbraw/zinc/18/71/56/1057187156.db2.gz VZOQCFFXTHLSIF-UHFFFAOYSA-N 1 2 319.399 4.395 20 0 DIADLO c1cn(Cc2ccccc2-c2cnn(C3CCCCC3)c2)c[nH+]1 ZINC001241844771 1057187898 /nfs/dbraw/zinc/18/78/98/1057187898.db2.gz UNWOGGFNTNDRQR-UHFFFAOYSA-N 1 2 306.413 4.300 20 0 DIADLO C[C@@H]1CN(c2ccc([NH2+]C3CCC(C(F)F)CC3)cc2)CCO1 ZINC000282514065 1057190332 /nfs/dbraw/zinc/19/03/32/1057190332.db2.gz ZFQMDHRMUURAKY-WLYUNCDWSA-N 1 2 324.415 4.148 20 0 DIADLO Fc1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)c2ccccc12 ZINC001241901047 1057204666 /nfs/dbraw/zinc/20/46/66/1057204666.db2.gz XNTORPPOZUZWIT-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO Cc1cccc(CC[N@@H+](C)Cc2c(Cl)cncc2Cl)c1 ZINC001137609320 1057207572 /nfs/dbraw/zinc/20/75/72/1057207572.db2.gz MIZBLGDVSKJIMY-UHFFFAOYSA-N 1 2 309.240 4.371 20 0 DIADLO Cc1cccc(CC[N@H+](C)Cc2c(Cl)cncc2Cl)c1 ZINC001137609320 1057207576 /nfs/dbraw/zinc/20/75/76/1057207576.db2.gz MIZBLGDVSKJIMY-UHFFFAOYSA-N 1 2 309.240 4.371 20 0 DIADLO Cc1nnc(-c2cccc(-c3cc[nH+]c(N4CCCCC4)c3)c2)o1 ZINC001241934595 1057217484 /nfs/dbraw/zinc/21/74/84/1057217484.db2.gz MYKJOONCCLMDJK-UHFFFAOYSA-N 1 2 320.396 4.097 20 0 DIADLO Cc1nnc(-c2cccc(-c3ccc(-c4c[nH+]cn4C)cc3)c2)o1 ZINC001241937228 1057218318 /nfs/dbraw/zinc/21/83/18/1057218318.db2.gz PWCKTZPMJAOOIF-UHFFFAOYSA-N 1 2 316.364 4.113 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1ccc(-c2ccccn2)cc1 ZINC001241975347 1057228946 /nfs/dbraw/zinc/22/89/46/1057228946.db2.gz QNVFMAVYBQRVRV-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO COc1ccc(-c2cn3cc[nH+]c3cc2OC)c2ccccc12 ZINC001241980059 1057230098 /nfs/dbraw/zinc/23/00/98/1057230098.db2.gz VFULCRRVKRUUSF-UHFFFAOYSA-N 1 2 304.349 4.172 20 0 DIADLO COc1ccc([C@H]([NH2+]Cc2n[nH]c3ccccc32)C2CCC2)cc1 ZINC000922892036 1057231213 /nfs/dbraw/zinc/23/12/13/1057231213.db2.gz NJSPTPJNHBZVLU-HXUWFJFHSA-N 1 2 321.424 4.203 20 0 DIADLO CCOC(=O)c1nsc2cc(-c3cc(C)[nH+]c(C)c3)ccc21 ZINC001241991997 1057232925 /nfs/dbraw/zinc/23/29/25/1057232925.db2.gz BDWDAMYXDXPTRP-UHFFFAOYSA-N 1 2 312.394 4.152 20 0 DIADLO CCOC(=O)c1cnc2cc(-c3cc(C)[nH+]c(C)c3)ccc2c1 ZINC001241994931 1057233999 /nfs/dbraw/zinc/23/39/99/1057233999.db2.gz WGVHECXEFJFHPH-UHFFFAOYSA-N 1 2 306.365 4.090 20 0 DIADLO COc1cccc2[nH]c(-c3cccc(-c4c[nH+]cn4C)c3)cc21 ZINC001241998488 1057235300 /nfs/dbraw/zinc/23/53/00/1057235300.db2.gz ASTNKNHSMZPQFV-UHFFFAOYSA-N 1 2 303.365 4.244 20 0 DIADLO COc1cccc2[nH]c(-c3ccc(Cn4cc[nH+]c4)cc3)cc21 ZINC001241998644 1057235617 /nfs/dbraw/zinc/23/56/17/1057235617.db2.gz BFJUDLDUCFRPAO-UHFFFAOYSA-N 1 2 303.365 4.088 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cccc(OC2CCCC2)c1 ZINC001242033886 1057245302 /nfs/dbraw/zinc/24/53/02/1057245302.db2.gz FZUZCZSGNFQOLH-UHFFFAOYSA-N 1 2 308.381 4.331 20 0 DIADLO COc1cc(-c2cccc(-c3c[nH+]cn3C)c2)c(F)cc1F ZINC001242048947 1057249615 /nfs/dbraw/zinc/24/96/15/1057249615.db2.gz UPJGXVOMNZMPFD-UHFFFAOYSA-N 1 2 300.308 4.041 20 0 DIADLO Cc1nnsc1C[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1F ZINC000701285604 1057251338 /nfs/dbraw/zinc/25/13/38/1057251338.db2.gz OABLUEMPYBJYGJ-LURJTMIESA-N 1 2 320.220 4.143 20 0 DIADLO Cc1cc(N)[nH+]cc1-c1ccc(-c2cccc3ccccc32)nn1 ZINC001242078298 1057256332 /nfs/dbraw/zinc/25/63/32/1057256332.db2.gz XPRVKJZYQCFKEA-UHFFFAOYSA-N 1 2 312.376 4.249 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2cnn(Cc3cccs3)c2)cc1 ZINC001242094123 1057262039 /nfs/dbraw/zinc/26/20/39/1057262039.db2.gz MQEXTAUUAMFSKR-UHFFFAOYSA-N 1 2 311.410 4.022 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cccc(Cl)c2Cl)cn1 ZINC000674751365 1057280230 /nfs/dbraw/zinc/28/02/30/1057280230.db2.gz NYKKRKYMSGLDFF-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)cn1 ZINC000674751365 1057280234 /nfs/dbraw/zinc/28/02/34/1057280234.db2.gz NYKKRKYMSGLDFF-UHFFFAOYSA-N 1 2 311.212 4.029 20 0 DIADLO C[N@H+](Cc1nnc(-c2ccccc2Cl)o1)Cc1ccccc1 ZINC000015256247 1057286563 /nfs/dbraw/zinc/28/65/63/1057286563.db2.gz HIUFLLXBFCVTAS-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO C[N@@H+](Cc1nnc(-c2ccccc2Cl)o1)Cc1ccccc1 ZINC000015256247 1057286569 /nfs/dbraw/zinc/28/65/69/1057286569.db2.gz HIUFLLXBFCVTAS-UHFFFAOYSA-N 1 2 313.788 4.022 20 0 DIADLO CC1(C)CC[C@@H]1C(=O)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001128841590 1057289119 /nfs/dbraw/zinc/28/91/19/1057289119.db2.gz NXAUBKZDNHIJTH-QGZVFWFLSA-N 1 2 324.424 4.228 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccc(F)cc1F ZINC000675088810 1057314781 /nfs/dbraw/zinc/31/47/81/1057314781.db2.gz AIUHXKZBSDFUCB-VFZGTOFNSA-N 1 2 309.743 4.403 20 0 DIADLO C[C@H]([NH2+][C@H]1COc2c1cccc2Cl)c1cc(F)ccc1F ZINC000675089109 1057315110 /nfs/dbraw/zinc/31/51/10/1057315110.db2.gz NLBTVDKTRZTDKT-VFZGTOFNSA-N 1 2 309.743 4.403 20 0 DIADLO C[C@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccc(F)cc1F ZINC000675088807 1057315291 /nfs/dbraw/zinc/31/52/91/1057315291.db2.gz AIUHXKZBSDFUCB-BJOHPYRUSA-N 1 2 309.743 4.403 20 0 DIADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@H]2COc3c2cccc3Cl)o1 ZINC000675103574 1057315806 /nfs/dbraw/zinc/31/58/06/1057315806.db2.gz XHGRVTFZEZEFHR-DGFSRKRXSA-N 1 2 303.789 4.280 20 0 DIADLO Fc1ccc(-c2cnccc2C(F)(F)F)cc1-n1cc[nH+]c1 ZINC001242278569 1057317312 /nfs/dbraw/zinc/31/73/12/1057317312.db2.gz MKQSIVOUTQPAOS-UHFFFAOYSA-N 1 2 307.250 4.092 20 0 DIADLO COc1ccc2ccccc2c1-c1ccc(Cn2cc[nH+]c2)cn1 ZINC001242330958 1057337099 /nfs/dbraw/zinc/33/70/99/1057337099.db2.gz RNZYAKSUOURLJW-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO CCn1c2ccc(Cl)cc2[nH+]c1NCc1ccc(Cl)nc1 ZINC000766106447 1057345858 /nfs/dbraw/zinc/34/58/58/1057345858.db2.gz COCCJMQDPLDIKQ-UHFFFAOYSA-N 1 2 321.211 4.370 20 0 DIADLO FC(F)Oc1ccc(-c2cc[nH+]c(N3CCCCC3)c2)cc1 ZINC001242439668 1057368189 /nfs/dbraw/zinc/36/81/89/1057368189.db2.gz PMNIIGPTGJQXCV-UHFFFAOYSA-N 1 2 304.340 4.340 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc(OC(F)F)cc2)c1 ZINC001242442026 1057368852 /nfs/dbraw/zinc/36/88/52/1057368852.db2.gz VWSXQMCERPJPHI-UHFFFAOYSA-N 1 2 300.308 4.356 20 0 DIADLO c1cn2c(cccc2-c2ccc3c(cnn3[C@@H]3CCCCO3)c2)[nH+]1 ZINC001242447021 1057370402 /nfs/dbraw/zinc/37/04/02/1057370402.db2.gz NHULVDQHOQMMKS-IBGZPJMESA-N 1 2 318.380 4.050 20 0 DIADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Oc2ccccc2)cn1)c1nccn1C ZINC000658340195 1057379825 /nfs/dbraw/zinc/37/98/25/1057379825.db2.gz ZDONLKGQFDCMMO-LSDHHAIUSA-N 1 2 322.412 4.019 20 0 DIADLO CO[C@H](CNc1cc(C)[nH+]c(C2CC2)n1)c1ccccc1Cl ZINC000675638417 1057394215 /nfs/dbraw/zinc/39/42/15/1057394215.db2.gz HMVKZUGWCRMVHS-OAHLLOKOSA-N 1 2 317.820 4.115 20 0 DIADLO CO[C@@H](CNc1cc(C)[nH+]c(C2CC2)n1)c1ccccc1Cl ZINC000675638416 1057394974 /nfs/dbraw/zinc/39/49/74/1057394974.db2.gz HMVKZUGWCRMVHS-HNNXBMFYSA-N 1 2 317.820 4.115 20 0 DIADLO Fc1cccc(-c2ccc(C[NH+]3CCOCC3)cc2F)c1Cl ZINC001242573829 1057410644 /nfs/dbraw/zinc/41/06/44/1057410644.db2.gz IEFVBFUBSCYZHL-UHFFFAOYSA-N 1 2 323.770 4.117 20 0 DIADLO Fc1ccc(C[NH2+][C@@H]2COc3c2cccc3Cl)c(Cl)c1 ZINC000676044566 1057445581 /nfs/dbraw/zinc/44/55/81/1057445581.db2.gz CAACZXBSWRTDOZ-CQSZACIVSA-N 1 2 312.171 4.356 20 0 DIADLO C[N@@H+](CCOC(C)(C)C)Cc1csc(-c2ccccc2)n1 ZINC000676043665 1057446154 /nfs/dbraw/zinc/44/61/54/1057446154.db2.gz RGVNDCBCKCYDAQ-UHFFFAOYSA-N 1 2 304.459 4.057 20 0 DIADLO C[N@H+](CCOC(C)(C)C)Cc1csc(-c2ccccc2)n1 ZINC000676043665 1057446151 /nfs/dbraw/zinc/44/61/51/1057446151.db2.gz RGVNDCBCKCYDAQ-UHFFFAOYSA-N 1 2 304.459 4.057 20 0 DIADLO COc1c(F)c(F)c(-c2ccc(-n3cc[nH+]c3)cc2)c(F)c1F ZINC001242733556 1057462643 /nfs/dbraw/zinc/46/26/43/1057462643.db2.gz OSQSEDFCSFJDJX-UHFFFAOYSA-N 1 2 322.261 4.104 20 0 DIADLO CCOc1ccc(C[NH+]2CCC(C(F)(F)F)CC2)c(F)c1F ZINC001143269120 1057471496 /nfs/dbraw/zinc/47/14/96/1057471496.db2.gz JSTJWLBGYJUMPP-UHFFFAOYSA-N 1 2 323.305 4.138 20 0 DIADLO Cc1nc(C(C)(C)[NH2+]Cc2cscc2Cl)sc1C ZINC000676418132 1057472173 /nfs/dbraw/zinc/47/21/73/1057472173.db2.gz KNCREQQQAXECSY-UHFFFAOYSA-N 1 2 300.880 4.500 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2ccc(OC(F)(F)F)nc2)cc1 ZINC001242779664 1057472436 /nfs/dbraw/zinc/47/24/36/1057472436.db2.gz VGNVYUHJGVIYOO-UHFFFAOYSA-N 1 2 310.275 4.009 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2cc(O)cc(C(F)(F)F)c2)c1 ZINC001242784275 1057475729 /nfs/dbraw/zinc/47/57/29/1057475729.db2.gz RMZUHMKWIIRCDC-UHFFFAOYSA-N 1 2 318.298 4.479 20 0 DIADLO COc1cc(Cl)ccc1C[NH2+][C@@H](C)c1nc(C)sc1C ZINC000676489188 1057478211 /nfs/dbraw/zinc/47/82/11/1057478211.db2.gz IKCNPBIXMKJLAC-VIFPVBQESA-N 1 2 310.850 4.273 20 0 DIADLO Cc1cc(-c2ccc(OC(F)F)c(OC3CCC3)c2)c[nH+]c1N ZINC001242819950 1057491431 /nfs/dbraw/zinc/49/14/31/1057491431.db2.gz GWADWPGGFMLGEF-UHFFFAOYSA-N 1 2 320.339 4.172 20 0 DIADLO C[N@@H+]1CCc2cc(-c3cc(Cl)c(O)c(Cl)c3)ccc2C1 ZINC001242854155 1057500300 /nfs/dbraw/zinc/50/03/00/1057500300.db2.gz SMQGVQIPPOWILG-UHFFFAOYSA-N 1 2 308.208 4.354 20 0 DIADLO C[N@H+]1CCc2cc(-c3cc(Cl)c(O)c(Cl)c3)ccc2C1 ZINC001242854155 1057500306 /nfs/dbraw/zinc/50/03/06/1057500306.db2.gz SMQGVQIPPOWILG-UHFFFAOYSA-N 1 2 308.208 4.354 20 0 DIADLO [NH3+]Cc1c[nH]c2ccc(-c3cc(Cl)c(O)c(Cl)c3)cc12 ZINC001242855590 1057501571 /nfs/dbraw/zinc/50/15/71/1057501571.db2.gz SSMHZVBERJERGA-UHFFFAOYSA-N 1 2 307.180 4.306 20 0 DIADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2ccc(OCC)cc2)n1 ZINC000073637376 1057509359 /nfs/dbraw/zinc/50/93/59/1057509359.db2.gz DGWLPDBAPBPUFB-ZIAGYGMSSA-N 1 2 317.433 4.223 20 0 DIADLO C=C(c1ccccc1)c1ccc(-c2nc3c(o2)CC[N@@H+](C)C3)cc1 ZINC001242891919 1057514390 /nfs/dbraw/zinc/51/43/90/1057514390.db2.gz BVISNSQLPUCHID-UHFFFAOYSA-N 1 2 316.404 4.391 20 0 DIADLO C=C(c1ccccc1)c1ccc(-c2nc3c(o2)CC[N@H+](C)C3)cc1 ZINC001242891919 1057514394 /nfs/dbraw/zinc/51/43/94/1057514394.db2.gz BVISNSQLPUCHID-UHFFFAOYSA-N 1 2 316.404 4.391 20 0 DIADLO COc1cc2[nH+]ccn2cc1-c1cncc(-c2ccccc2)c1 ZINC001242914002 1057517755 /nfs/dbraw/zinc/51/77/55/1057517755.db2.gz GJEAPJLSDGGTMW-UHFFFAOYSA-N 1 2 301.349 4.072 20 0 DIADLO CC[C@H]([NH2+]Cc1cc(-c2ccc(F)cc2)no1)c1nccs1 ZINC000347904505 1057518588 /nfs/dbraw/zinc/51/85/88/1057518588.db2.gz BDYWABCQNATQMS-AWEZNQCLSA-N 1 2 317.389 4.178 20 0 DIADLO CCc1onc(C)c1C[NH2+]Cc1ccc(Oc2ccccc2)o1 ZINC000922982587 1057518823 /nfs/dbraw/zinc/51/88/23/1057518823.db2.gz DCNDIKDXWGGVGJ-UHFFFAOYSA-N 1 2 312.369 4.221 20 0 DIADLO COc1ncc(-c2c[nH+]c(N3CCCCC3)cc2C)cc1Cl ZINC001242931577 1057521174 /nfs/dbraw/zinc/52/11/74/1057521174.db2.gz MFVNBCYGHITRNA-UHFFFAOYSA-N 1 2 317.820 4.104 20 0 DIADLO Cc1ccc2ccccc2c1-c1cncc(C[NH+]2CCOCC2)c1 ZINC001242982538 1057534987 /nfs/dbraw/zinc/53/49/87/1057534987.db2.gz JGIXCXBXMORSHV-UHFFFAOYSA-N 1 2 318.420 4.042 20 0 DIADLO Cc1ccc2ccccc2c1-c1ccc(C[NH+]2CCOCC2)cn1 ZINC001242983579 1057535693 /nfs/dbraw/zinc/53/56/93/1057535693.db2.gz RDXVJAHOKVWGIG-UHFFFAOYSA-N 1 2 318.420 4.042 20 0 DIADLO c1cncc(-c2cccc(-c3cc[nH+]c(N4CCCC4)c3)c2)c1 ZINC001243000165 1057542089 /nfs/dbraw/zinc/54/20/89/1057542089.db2.gz FMIWQQBBRNPGPU-UHFFFAOYSA-N 1 2 301.393 4.411 20 0 DIADLO Cc1nc(NCc2ccccc2-c2ccc(Cl)cc2)cc[nH+]1 ZINC000462821269 1057549470 /nfs/dbraw/zinc/54/94/70/1057549470.db2.gz YXUOWZWDDCCHKL-UHFFFAOYSA-N 1 2 309.800 4.718 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCc2c(O)cccc2C1 ZINC000626027041 1057550780 /nfs/dbraw/zinc/55/07/80/1057550780.db2.gz IZNJGTVGERBDNS-CQSZACIVSA-N 1 2 320.392 4.167 20 0 DIADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCc2c(O)cccc2C1 ZINC000626027041 1057550787 /nfs/dbraw/zinc/55/07/87/1057550787.db2.gz IZNJGTVGERBDNS-CQSZACIVSA-N 1 2 320.392 4.167 20 0 DIADLO CCCCOC(=O)c1cccc(-c2cccc(C(=[NH2+])OC)c2)c1 ZINC001243098353 1057572031 /nfs/dbraw/zinc/57/20/31/1057572031.db2.gz MULVBTNMWMOJDA-UHFFFAOYSA-N 1 2 311.381 4.282 20 0 DIADLO COc1cc(-c2cn3cc[nH+]c3cc2OC)cc(C(F)(F)F)c1 ZINC001243122188 1057578983 /nfs/dbraw/zinc/57/89/83/1057578983.db2.gz UNAVYHAGZSTDJM-UHFFFAOYSA-N 1 2 322.286 4.037 20 0 DIADLO CSc1cccc(F)c1-c1ccccc1C[NH+]1CCOCC1 ZINC001243123232 1057579337 /nfs/dbraw/zinc/57/93/37/1057579337.db2.gz GFGIUNSVJFOXAS-UHFFFAOYSA-N 1 2 317.429 4.047 20 0 DIADLO CC(C)CSCCC[N@@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000611032060 1057580284 /nfs/dbraw/zinc/58/02/84/1057580284.db2.gz MBERQXUWFWNGGY-HNNXBMFYSA-N 1 2 323.506 4.253 20 0 DIADLO CC(C)CSCCC[N@H+]1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000611032060 1057580292 /nfs/dbraw/zinc/58/02/92/1057580292.db2.gz MBERQXUWFWNGGY-HNNXBMFYSA-N 1 2 323.506 4.253 20 0 DIADLO Cc1cc(-c2ccccc2NC(=O)C(C)(C)C)c2[nH+]ccn2c1 ZINC001243176242 1057593789 /nfs/dbraw/zinc/59/37/89/1057593789.db2.gz HXZHNDPCWPMMLY-UHFFFAOYSA-N 1 2 307.397 4.294 20 0 DIADLO Cc1ccc(-c2ccc(-c3nc4c(o3)CC[N@@H+](C)C4)cc2)cc1O ZINC001243232565 1057615060 /nfs/dbraw/zinc/61/50/60/1057615060.db2.gz IPSSUJOTFGPOLE-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO Cc1ccc(-c2ccc(-c3nc4c(o3)CC[N@H+](C)C4)cc2)cc1O ZINC001243232565 1057615062 /nfs/dbraw/zinc/61/50/62/1057615062.db2.gz IPSSUJOTFGPOLE-UHFFFAOYSA-N 1 2 320.392 4.011 20 0 DIADLO Cc1ccc(C[NH2+][C@H](C)c2ncc[nH]2)c(O[C@H](C)CC(C)C)c1 ZINC000513690874 1057623184 /nfs/dbraw/zinc/62/31/84/1057623184.db2.gz NJZYRBKQINCDHT-HZPDHXFCSA-N 1 2 315.461 4.382 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC000727222085 1057642850 /nfs/dbraw/zinc/64/28/50/1057642850.db2.gz PHHQXOMEBWINFC-HNNXBMFYSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1nn(C)c(Cl)c1C[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000727222085 1057642853 /nfs/dbraw/zinc/64/28/53/1057642853.db2.gz PHHQXOMEBWINFC-HNNXBMFYSA-N 1 2 324.255 4.372 20 0 DIADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2nnc(-c3cccc(C)c3)o2)o1 ZINC000727223269 1057642887 /nfs/dbraw/zinc/64/28/87/1057642887.db2.gz IZTXTHJLIZQMRR-CQSZACIVSA-N 1 2 311.385 4.139 20 0 DIADLO Cc1ccc(C[N@H+](C)[C@H](C)c2nnc(-c3cccc(C)c3)o2)o1 ZINC000727223269 1057642889 /nfs/dbraw/zinc/64/28/89/1057642889.db2.gz IZTXTHJLIZQMRR-CQSZACIVSA-N 1 2 311.385 4.139 20 0 DIADLO C[C@H]([NH2+]Cc1coc(C2CC2)n1)c1cccc(C(F)(F)F)c1 ZINC000727464291 1057654857 /nfs/dbraw/zinc/65/48/57/1057654857.db2.gz XHCUKFKPJCDJGO-JTQLQIEISA-N 1 2 310.319 4.422 20 0 DIADLO Clc1ccc(C2([NH2+]Cc3coc(C4CC4)n3)CCC2)cc1 ZINC000727470054 1057655598 /nfs/dbraw/zinc/65/55/98/1057655598.db2.gz YLOCEIHFWQGLDM-UHFFFAOYSA-N 1 2 302.805 4.374 20 0 DIADLO C[C@H](CC(=O)N[C@@H](Cn1cc[nH+]c1)C(C)(C)C)C1CCCCC1 ZINC000727492048 1057655673 /nfs/dbraw/zinc/65/56/73/1057655673.db2.gz UCCKZOOSFXUCAH-WBVHZDCISA-N 1 2 319.493 4.021 20 0 DIADLO C[C@@H](CC(=O)N[C@H](Cn1cc[nH+]c1)C(C)(C)C)C1CCCCC1 ZINC000727492044 1057655804 /nfs/dbraw/zinc/65/58/04/1057655804.db2.gz UCCKZOOSFXUCAH-DOTOQJQBSA-N 1 2 319.493 4.021 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc2ccccc2n1C ZINC001243356989 1057657818 /nfs/dbraw/zinc/65/78/18/1057657818.db2.gz YDGCTRNWLHFNSX-UHFFFAOYSA-N 1 2 303.365 4.040 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(Cl)nc(Cl)c1 ZINC001243372906 1057663506 /nfs/dbraw/zinc/66/35/06/1057663506.db2.gz YXRNTXLHWKLLSC-UHFFFAOYSA-N 1 2 320.179 4.250 20 0 DIADLO Cc1c(-c2cccc(OCC(F)(F)F)c2)ccc2[nH+]ccn21 ZINC001243390745 1057667878 /nfs/dbraw/zinc/66/78/78/1057667878.db2.gz AUZCTTXFGLOBRQ-UHFFFAOYSA-N 1 2 306.287 4.251 20 0 DIADLO C[N@H+]1Cc2ccccc2[C@@H](NCc2ccc(Cl)cc2Cl)C1 ZINC000535264507 1057673606 /nfs/dbraw/zinc/67/36/06/1057673606.db2.gz DXVHMVSBAVXGEF-KRWDZBQOSA-N 1 2 321.251 4.270 20 0 DIADLO C[N@@H+]1Cc2ccccc2[C@@H](NCc2ccc(Cl)cc2Cl)C1 ZINC000535264507 1057673610 /nfs/dbraw/zinc/67/36/10/1057673610.db2.gz DXVHMVSBAVXGEF-KRWDZBQOSA-N 1 2 321.251 4.270 20 0 DIADLO CCOc1ccc([C@@H]([NH2+][C@H](C)c2ncc[nH]2)c2ccccc2)cc1 ZINC000286263237 1057687239 /nfs/dbraw/zinc/68/72/39/1057687239.db2.gz VAZFEOWMNIHPLA-BEFAXECRSA-N 1 2 321.424 4.249 20 0 DIADLO CCO[C@H](C)Oc1ccc2cc(-c3ccc[nH+]c3N)ccc2c1 ZINC001243477511 1057691059 /nfs/dbraw/zinc/69/10/59/1057691059.db2.gz RGMCRFMPSOAAEQ-ZDUSSCGKSA-N 1 2 308.381 4.245 20 0 DIADLO CCOP(=O)(Cc1ccc(-c2ccc[nH+]c2N)cc1)OCC ZINC001243474485 1057691377 /nfs/dbraw/zinc/69/13/77/1057691377.db2.gz XVGRCFWTJSPTGO-UHFFFAOYSA-N 1 2 320.329 4.097 20 0 DIADLO Fc1cc(-c2ccc(-n3cc[nH+]c3)cc2)cc(F)c1OC(F)F ZINC001243491784 1057694741 /nfs/dbraw/zinc/69/47/41/1057694741.db2.gz JTYNBYQUCGZSTO-UHFFFAOYSA-N 1 2 322.261 4.419 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2ccc(C3CCCC3)cc2)cc1 ZINC001243491973 1057695194 /nfs/dbraw/zinc/69/51/94/1057695194.db2.gz JQCINWZIMLCVIH-LJQANCHMSA-N 1 2 309.409 4.184 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc(F)cc(F)c1O ZINC001243504007 1057697152 /nfs/dbraw/zinc/69/71/52/1057697152.db2.gz XBOAMHMTMLCFKH-UHFFFAOYSA-N 1 2 304.340 4.031 20 0 DIADLO CC[C@H]1CCC[N@H+](Cn2nc(-c3ccccc3)sc2=S)C1 ZINC000729982338 1057699937 /nfs/dbraw/zinc/69/99/37/1057699937.db2.gz XNRNWUGCNOANFD-ZDUSSCGKSA-N 1 2 319.499 4.421 20 0 DIADLO CC[C@H]1CCC[N@@H+](Cn2nc(-c3ccccc3)sc2=S)C1 ZINC000729982338 1057699940 /nfs/dbraw/zinc/69/99/40/1057699940.db2.gz XNRNWUGCNOANFD-ZDUSSCGKSA-N 1 2 319.499 4.421 20 0 DIADLO CCOc1cc(-c2cccc(-c3c[nH+]cn3C)c2)ccc1OC ZINC001243540577 1057708112 /nfs/dbraw/zinc/70/81/12/1057708112.db2.gz LYJVYYLXIVFYLD-UHFFFAOYSA-N 1 2 308.381 4.161 20 0 DIADLO CN(c1ccc(-c2ccc3[nH+]ccn3c2)cn1)C1CCCCC1 ZINC001243597614 1057728249 /nfs/dbraw/zinc/72/82/49/1057728249.db2.gz WZYIKYHAQZXPOL-UHFFFAOYSA-N 1 2 306.413 4.165 20 0 DIADLO CC(C)Oc1c(F)cc(F)c(-c2ccn3cc[nH+]c3c2)c1F ZINC001243618133 1057735564 /nfs/dbraw/zinc/73/55/64/1057735564.db2.gz GMONFUNNHYNBJB-UHFFFAOYSA-N 1 2 306.287 4.206 20 0 DIADLO COc1cc(C)[nH+]cc1-c1c(F)cc(F)c(OC(C)C)c1F ZINC001243620020 1057736234 /nfs/dbraw/zinc/73/62/34/1057736234.db2.gz BOCHDZZXEKTBPL-UHFFFAOYSA-N 1 2 311.303 4.270 20 0 DIADLO Fc1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)c2ncccc12 ZINC001243656264 1057745580 /nfs/dbraw/zinc/74/55/80/1057745580.db2.gz AKVKODCDOICQJG-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO CCc1cc(-c2ccc(Cn3cc[nH+]c3)cc2)ccc1NC(C)=O ZINC001243656423 1057745744 /nfs/dbraw/zinc/74/57/44/1057745744.db2.gz DLMSHVALNHLSDR-UHFFFAOYSA-N 1 2 319.408 4.119 20 0 DIADLO Fc1c(C(F)(F)F)ccnc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243656684 1057745773 /nfs/dbraw/zinc/74/57/73/1057745773.db2.gz IVCPGNNGSWYLGV-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO Fc1cnc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1C(F)(F)F ZINC001243657653 1057746102 /nfs/dbraw/zinc/74/61/02/1057746102.db2.gz RXSDQTRXXWOMQF-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO COc1ccc2cccnc2c1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243657961 1057746178 /nfs/dbraw/zinc/74/61/78/1057746178.db2.gz CJJTZSXANCEIJK-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Fc1cc2cccnc2c(-c2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001243657527 1057746657 /nfs/dbraw/zinc/74/66/57/1057746657.db2.gz NFULUNKDVJDAEM-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO c1cn(Cc2ccc(-c3ccc(-c4cnco4)cc3)cc2)c[nH+]1 ZINC001243659243 1057747110 /nfs/dbraw/zinc/74/71/10/1057747110.db2.gz OUZVAJVGERSLTJ-UHFFFAOYSA-N 1 2 301.349 4.253 20 0 DIADLO Cc1cn(C)c2ccc(-c3ccc(Cn4cc[nH+]c4)cc3)cc12 ZINC001243660226 1057747330 /nfs/dbraw/zinc/74/73/30/1057747330.db2.gz QQOGXMVEANXHHR-UHFFFAOYSA-N 1 2 301.393 4.399 20 0 DIADLO COc1cccc2c(-c3ccc(Cn4cc[nH+]c4)cc3)ccnc12 ZINC001243659118 1057747392 /nfs/dbraw/zinc/74/73/92/1057747392.db2.gz LKZDXZIEJLPOCD-UHFFFAOYSA-N 1 2 315.376 4.155 20 0 DIADLO Fc1cccc2ncc(-c3ccc(Cn4cc[nH+]c4)cc3)cc12 ZINC001243662403 1057748509 /nfs/dbraw/zinc/74/85/09/1057748509.db2.gz OISJTHADXVOPIU-UHFFFAOYSA-N 1 2 303.340 4.286 20 0 DIADLO Cc1cc(N(C)C)cc(C)c1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001243663083 1057748725 /nfs/dbraw/zinc/74/87/25/1057748725.db2.gz TVTAVACPVMBGNK-UHFFFAOYSA-N 1 2 305.425 4.281 20 0 DIADLO Cc1cc(-c2noc(-c3ccc(-n4cc[nH+]c4)cc3)n2)ccc1F ZINC000731797059 1057754769 /nfs/dbraw/zinc/75/47/69/1057754769.db2.gz QBAOXXFUEPWWAR-UHFFFAOYSA-N 1 2 320.327 4.037 20 0 DIADLO CC(=O)OCc1cccc(C)c1-c1cccc(-c2c[nH+]cn2C)c1 ZINC001243720068 1057761317 /nfs/dbraw/zinc/76/13/17/1057761317.db2.gz PFODKURDSCEUIF-UHFFFAOYSA-N 1 2 320.392 4.126 20 0 DIADLO CC(=O)OCc1cccc(Cl)c1-c1ccc2[nH+]c(C)cn2c1 ZINC001243722570 1057762269 /nfs/dbraw/zinc/76/22/69/1057762269.db2.gz CBJYUKJKFUQWGP-UHFFFAOYSA-N 1 2 314.772 4.026 20 0 DIADLO CC[C@H](C)C[N@H+](C)Cn1nc(-c2ccccc2)sc1=S ZINC000732182785 1057769194 /nfs/dbraw/zinc/76/91/94/1057769194.db2.gz IKQFXVKFFLXPJY-LBPRGKRZSA-N 1 2 307.488 4.276 20 0 DIADLO CC[C@H](C)C[N@@H+](C)Cn1nc(-c2ccccc2)sc1=S ZINC000732182785 1057769196 /nfs/dbraw/zinc/76/91/96/1057769196.db2.gz IKQFXVKFFLXPJY-LBPRGKRZSA-N 1 2 307.488 4.276 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2ccc(OC)c(SC)c2)c1 ZINC001243748967 1057770034 /nfs/dbraw/zinc/77/00/34/1057770034.db2.gz JQFAZXIRVSELIK-UHFFFAOYSA-N 1 2 301.411 4.446 20 0 DIADLO CC[N@H+](CC1CC1)Cn1nc(-c2ccccc2)sc1=S ZINC000732663243 1057783089 /nfs/dbraw/zinc/78/30/89/1057783089.db2.gz LLZCBFBJRHUWLZ-UHFFFAOYSA-N 1 2 305.472 4.030 20 0 DIADLO CC[N@@H+](CC1CC1)Cn1nc(-c2ccccc2)sc1=S ZINC000732663243 1057783095 /nfs/dbraw/zinc/78/30/95/1057783095.db2.gz LLZCBFBJRHUWLZ-UHFFFAOYSA-N 1 2 305.472 4.030 20 0 DIADLO COc1ccc(-c2cn3cc[nH+]c3cc2C)c(OC(F)(F)F)c1 ZINC001243812045 1057785711 /nfs/dbraw/zinc/78/57/11/1057785711.db2.gz AKVQXBBTHDZQGZ-UHFFFAOYSA-N 1 2 322.286 4.217 20 0 DIADLO CC(C)c1cc(C[NH2+][C@@H](C)c2cc(-c3ccccc3)no2)on1 ZINC000822285019 1057796605 /nfs/dbraw/zinc/79/66/05/1057796605.db2.gz HLIMNHYBEMWNNH-ZDUSSCGKSA-N 1 2 311.385 4.304 20 0 DIADLO Fc1cc(-c2ccccc2Cn2cc[nH+]c2)cc(C(F)(F)F)n1 ZINC001243910659 1057803994 /nfs/dbraw/zinc/80/39/94/1057803994.db2.gz CUSHWFHRAXZJFA-UHFFFAOYSA-N 1 2 321.277 4.151 20 0 DIADLO Fc1cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc(C(F)(F)F)n1 ZINC001243911169 1057804004 /nfs/dbraw/zinc/80/40/04/1057804004.db2.gz HMUXOYCFFMBISV-UHFFFAOYSA-N 1 2 307.250 4.297 20 0 DIADLO Fc1cc(-c2cccc3nc[nH]c32)cc(F)c1C[NH+]1CCCC1 ZINC001243935329 1057812899 /nfs/dbraw/zinc/81/28/99/1057812899.db2.gz MLQIDERFOABLLS-UHFFFAOYSA-N 1 2 313.351 4.104 20 0 DIADLO CC(C)(C)c1nc(C[NH2+]Cc2ccc(O)c(Cl)c2)cs1 ZINC000733327007 1057812883 /nfs/dbraw/zinc/81/28/83/1057812883.db2.gz IUQFDJYLXPTGDK-UHFFFAOYSA-N 1 2 310.850 4.089 20 0 DIADLO COc1ccc(-c2nnc(C3=C[NH2+]CCC3)c3ccccc32)cc1 ZINC001243948814 1057817413 /nfs/dbraw/zinc/81/74/13/1057817413.db2.gz MGKITXOXLNBBJQ-UHFFFAOYSA-N 1 2 317.392 4.030 20 0 DIADLO Fc1cc(-c2ccc(-c3[nH]cc[nH+]3)cc2)ccc1OC(F)F ZINC001243977802 1057827081 /nfs/dbraw/zinc/82/70/81/1057827081.db2.gz YGKPQQBIKXJALU-UHFFFAOYSA-N 1 2 304.271 4.484 20 0 DIADLO COC(=O)c1cc2cc(-c3ccc(-c4[nH]cc[nH+]4)cc3)ccc2[nH]1 ZINC001243977372 1057827252 /nfs/dbraw/zinc/82/72/52/1057827252.db2.gz CNTCOGMELHSNIW-UHFFFAOYSA-N 1 2 317.348 4.012 20 0 DIADLO COC(=O)C(C)(C)c1ccc(-c2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC001243977779 1057827399 /nfs/dbraw/zinc/82/73/99/1057827399.db2.gz WXLWSCHLMASRFH-UHFFFAOYSA-N 1 2 320.392 4.194 20 0 DIADLO c1c[nH+]c(-c2ccc(-c3ccc(N4CCSCC4)cc3)cc2)[nH]1 ZINC001243979389 1057827974 /nfs/dbraw/zinc/82/79/74/1057827974.db2.gz KDVKOOQAMQLILH-UHFFFAOYSA-N 1 2 321.449 4.297 20 0 DIADLO Cn1c[nH+]cc1-c1cccc(-c2ccc3c(c2)CCCC3=O)c1 ZINC001243993758 1057832267 /nfs/dbraw/zinc/83/22/67/1057832267.db2.gz ZQHGSYZTHGOSLV-UHFFFAOYSA-N 1 2 302.377 4.273 20 0 DIADLO Fc1ccc(-c2ccccc2C[NH+]2CCOCC2)c(F)c1Cl ZINC001244035906 1057845316 /nfs/dbraw/zinc/84/53/16/1057845316.db2.gz JVFVBTOFYZGJGU-UHFFFAOYSA-N 1 2 323.770 4.117 20 0 DIADLO FC(F)COc1ccc(-c2cc[nH+]c(N3CCCCC3)c2)cc1 ZINC001244068822 1057856765 /nfs/dbraw/zinc/85/67/65/1057856765.db2.gz ASGIMAQSGAASRQ-UHFFFAOYSA-N 1 2 318.367 4.383 20 0 DIADLO CC(C)(c1ccc(-c2ccn3cc(N)[nH+]c3c2)cc1)C(F)(F)F ZINC001244101521 1057869293 /nfs/dbraw/zinc/86/92/93/1057869293.db2.gz MNLANBCDYOLUPM-UHFFFAOYSA-N 1 2 319.330 4.423 20 0 DIADLO Cc1cc(N2CCOCC2)[nH+]cc1-c1cccc(C2CC2)c1C ZINC001244132942 1057881500 /nfs/dbraw/zinc/88/15/00/1057881500.db2.gz SKHWZSHVMWMDOY-UHFFFAOYSA-N 1 2 308.425 4.079 20 0 DIADLO CCCN(CCC)C(=O)c1cccc(-c2ccn3cc[nH+]c3c2)c1 ZINC001244212886 1057901618 /nfs/dbraw/zinc/90/16/18/1057901618.db2.gz PFPKUBQSLMCAJM-UHFFFAOYSA-N 1 2 321.424 4.264 20 0 DIADLO CCCN(CCC)C(=O)c1cccc(-c2ccc3[nH+]ccn3c2)c1 ZINC001244214878 1057902295 /nfs/dbraw/zinc/90/22/95/1057902295.db2.gz OVXJCQLBXGVWJH-UHFFFAOYSA-N 1 2 321.424 4.264 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1cc(C(C)C)ccc1N ZINC001244230610 1057904496 /nfs/dbraw/zinc/90/44/96/1057904496.db2.gz NTRREHZKPVVRRN-UHFFFAOYSA-N 1 2 307.397 4.254 20 0 DIADLO COc1cccc(-c2ccccc2Cn2cc[nH+]c2)c1C1CC1 ZINC001244250499 1057910506 /nfs/dbraw/zinc/91/05/06/1057910506.db2.gz RQFCGBBVWWCZSW-UHFFFAOYSA-N 1 2 304.393 4.484 20 0 DIADLO Cc1ncc(C(F)(F)F)cc1-c1ccc(Cn2cc[nH+]c2)cc1 ZINC001244260256 1057914673 /nfs/dbraw/zinc/91/46/73/1057914673.db2.gz FXSJSRQCKSKQAR-UHFFFAOYSA-N 1 2 317.314 4.321 20 0 DIADLO Cc1c(-c2ccc(N3CCCCC3)cc2F)ccc2[nH+]ccn21 ZINC001244268236 1057918307 /nfs/dbraw/zinc/91/83/07/1057918307.db2.gz WQGQBTZIVARDJU-UHFFFAOYSA-N 1 2 309.388 4.439 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2ccc(C3CC3)cc2Cl)cc1 ZINC001244275769 1057921252 /nfs/dbraw/zinc/92/12/52/1057921252.db2.gz YFBWWYXEQWBTOG-QGZVFWFLSA-N 1 2 315.800 4.057 20 0 DIADLO CCOC(=[NH2+])c1ccc(-c2ccc(CC(F)(F)F)nc2)cc1 ZINC001244295153 1057925064 /nfs/dbraw/zinc/92/50/64/1057925064.db2.gz OFSFEGSDGWOCNG-UHFFFAOYSA-N 1 2 308.303 4.215 20 0 DIADLO Cc1cccc(NC(=O)c2ccc(-c3cc[nH+]c(N)c3)cc2)c1C ZINC001244382887 1057947870 /nfs/dbraw/zinc/94/78/70/1057947870.db2.gz KBWCQCBMOKKHQW-UHFFFAOYSA-N 1 2 317.392 4.200 20 0 DIADLO Clc1ccc(-c2ccccc2Cn2cc[nH+]c2)c2n[nH]cc21 ZINC001244400068 1057950695 /nfs/dbraw/zinc/95/06/95/1057950695.db2.gz UPPZJULWBJFJFX-UHFFFAOYSA-N 1 2 308.772 4.128 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1ccc(Cl)c2c[nH]nc21 ZINC001244401501 1057951290 /nfs/dbraw/zinc/95/12/90/1057951290.db2.gz QMZRGZQWOPPZTL-UHFFFAOYSA-N 1 2 324.771 4.078 20 0 DIADLO CC(C)c1cc(-c2cc[nH+]c(N3CCOCC3)c2)ccc1Cl ZINC001244439580 1057958845 /nfs/dbraw/zinc/95/88/45/1057958845.db2.gz QGHAQYPTYYTTHO-UHFFFAOYSA-N 1 2 316.832 4.362 20 0 DIADLO Fc1cc(Cl)c(-c2ccc(Cn3cc[nH+]c3)cn2)c(Cl)c1 ZINC001244497137 1057975540 /nfs/dbraw/zinc/97/55/40/1057975540.db2.gz LVONQEZARLHGGD-UHFFFAOYSA-N 1 2 322.170 4.439 20 0 DIADLO Cc1cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc(Cl)c1O ZINC001244555660 1057995025 /nfs/dbraw/zinc/99/50/25/1057995025.db2.gz QEPBCICCKDZSII-UHFFFAOYSA-N 1 2 302.736 4.346 20 0 DIADLO Cc1cc(Cl)c(N)c(-c2cc[nH+]c(N3CCCCC3)c2)c1 ZINC001244564697 1057996541 /nfs/dbraw/zinc/99/65/41/1057996541.db2.gz OIXQXDWYIPUDSL-UHFFFAOYSA-N 1 2 301.821 4.283 20 0 DIADLO CCCOc1cc(-c2[nH+]ccc3c2ccn3C)c(Cl)cn1 ZINC001244605880 1058007259 /nfs/dbraw/zinc/00/72/59/1058007259.db2.gz PLCKJFKQRMVTIG-UHFFFAOYSA-N 1 2 301.777 4.078 20 0 DIADLO CC(=O)c1ccc(F)c(-c2cccc(-c3c[nH+]cn3C)c2)c1F ZINC001244622987 1058012451 /nfs/dbraw/zinc/01/24/51/1058012451.db2.gz VPXDXGXTSAVSCH-UHFFFAOYSA-N 1 2 312.319 4.235 20 0 DIADLO CCOc1ncc(-c2c[nH+]c(N3CCCCC3)cc2C)cc1C ZINC001244683482 1058025067 /nfs/dbraw/zinc/02/50/67/1058025067.db2.gz NLTQJKUNDKSNMY-UHFFFAOYSA-N 1 2 311.429 4.149 20 0 DIADLO COc1c(F)cc(-c2ccc(F)c(-n3cc[nH+]c3)c2)cc1Cl ZINC001244699309 1058029800 /nfs/dbraw/zinc/02/98/00/1058029800.db2.gz DPZAUTNCZDOBCF-UHFFFAOYSA-N 1 2 320.726 4.480 20 0 DIADLO Nc1ccc(-c2cc[nH+]c(N3CCCCC3)c2)c(C(F)(F)F)c1 ZINC001244748066 1058041078 /nfs/dbraw/zinc/04/10/78/1058041078.db2.gz QEMWJPOOIFVAHG-UHFFFAOYSA-N 1 2 321.346 4.340 20 0 DIADLO Cc1cc(C2=CC[C@@H](OC(=O)c3ccccc3)CC2)cc(C)[nH+]1 ZINC001244804072 1058050064 /nfs/dbraw/zinc/05/00/64/1058050064.db2.gz IMECCZMHTFLTNW-LJQANCHMSA-N 1 2 307.393 4.491 20 0 DIADLO O=C(O[C@@H]1CC=C(c2cccn3cc[nH+]c23)CC1)c1ccccc1 ZINC001244807660 1058051414 /nfs/dbraw/zinc/05/14/14/1058051414.db2.gz UPUCIVACMPUEQH-QGZVFWFLSA-N 1 2 318.376 4.127 20 0 DIADLO COc1cc(Oc2ccccc2)ccc1-c1c[nH+]c(N)c(C)c1 ZINC001244876723 1058062844 /nfs/dbraw/zinc/06/28/44/1058062844.db2.gz JQFJWBHILFYDPZ-UHFFFAOYSA-N 1 2 306.365 4.440 20 0 DIADLO COc1cc(Oc2ccccc2)ccc1-c1cc[nH+]c2c1CCN2 ZINC001244879414 1058063389 /nfs/dbraw/zinc/06/33/89/1058063389.db2.gz SEQNHLVSYIALNY-UHFFFAOYSA-N 1 2 318.376 4.160 20 0 DIADLO Cc1c(Cl)cccc1-c1cc(C[NH+]2CCOCC2)ccc1F ZINC001244966056 1058082365 /nfs/dbraw/zinc/08/23/65/1058082365.db2.gz RRQMRXTWBQRHJG-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO Cc1c(Cl)c(-c2ccc(-c3c[nH+]cn3C)cc2)ccc1CO ZINC001244970165 1058083593 /nfs/dbraw/zinc/08/35/93/1058083593.db2.gz VUVJTCSEKWIYJD-UHFFFAOYSA-N 1 2 312.800 4.208 20 0 DIADLO CNc1cc(-c2ccnc3cc(C(F)(F)F)ccc32)cc[nH+]1 ZINC001244972916 1058083873 /nfs/dbraw/zinc/08/38/73/1058083873.db2.gz PIRGLWBYTLNTET-UHFFFAOYSA-N 1 2 303.287 4.357 20 0 DIADLO CNc1cc(-c2ccc(OC(F)(F)C(F)F)cc2)cc[nH+]1 ZINC001244973777 1058084210 /nfs/dbraw/zinc/08/42/10/1058084210.db2.gz QXHWIWHRRMHIQI-UHFFFAOYSA-N 1 2 300.255 4.027 20 0 DIADLO CNc1cc(-c2ccc3c(c2)N(c2ccccc2)C(=O)C3)cc[nH+]1 ZINC001244977958 1058084768 /nfs/dbraw/zinc/08/47/68/1058084768.db2.gz OXICYQWCQKWQBK-UHFFFAOYSA-N 1 2 315.376 4.011 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2cccc(C3CCCC3)c2)cc1 ZINC001244989156 1058087374 /nfs/dbraw/zinc/08/73/74/1058087374.db2.gz RBRKBUGTOCQYDH-LJQANCHMSA-N 1 2 309.409 4.184 20 0 DIADLO c1cc(-c2ccc(C[NH+]3CCOCC3)nc2)cc(C2CCCC2)c1 ZINC001244987629 1058087579 /nfs/dbraw/zinc/08/75/79/1058087579.db2.gz BQCAENBXZHLDPX-UHFFFAOYSA-N 1 2 322.452 4.238 20 0 DIADLO CCOc1cc(C)cc(F)c1-c1cc(N2CCCC2)cc[nH+]1 ZINC001245011800 1058092613 /nfs/dbraw/zinc/09/26/13/1058092613.db2.gz QXABEFWDLQVBTD-UHFFFAOYSA-N 1 2 300.377 4.195 20 0 DIADLO COC(=O)[C@H]([NH3+])c1ccc(-c2cc(C)c(Cl)c(Cl)c2)cc1 ZINC001245044716 1058101541 /nfs/dbraw/zinc/10/15/41/1058101541.db2.gz PIXVSBFXWGMJCY-OAHLLOKOSA-N 1 2 324.207 4.142 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cc(Cl)ccc1O ZINC001245051076 1058103547 /nfs/dbraw/zinc/10/35/47/1058103547.db2.gz TYDMGRZBSHOUSU-UHFFFAOYSA-N 1 2 302.805 4.406 20 0 DIADLO CC(C)c1ccc(-c2ccc(Cn3cc[nH+]c3)cn2)c(Cl)n1 ZINC001245101973 1058113724 /nfs/dbraw/zinc/11/37/24/1058113724.db2.gz ZSJQZIDZOCNURJ-UHFFFAOYSA-N 1 2 312.804 4.165 20 0 DIADLO Cc1ccc(-c2cc(F)ccc2Cl)c(C[NH+]2CCOCC2)c1 ZINC001245135585 1058119330 /nfs/dbraw/zinc/11/93/30/1058119330.db2.gz ACLBTILBPWIFJR-UHFFFAOYSA-N 1 2 319.807 4.287 20 0 DIADLO CCOC(=[NH2+])c1cccc(-c2cc(F)cc(C(C)(C)O)c2)c1 ZINC001245142302 1058120235 /nfs/dbraw/zinc/12/02/35/1058120235.db2.gz KZIVBJXKVAPXQH-UHFFFAOYSA-N 1 2 301.361 4.082 20 0 DIADLO Cc1ccc(Cl)cc1NC(=S)Nc1ccn2cc[nH+]c2c1 ZINC001245149884 1058121417 /nfs/dbraw/zinc/12/14/17/1058121417.db2.gz ZVSKVWKDEZSTSN-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO FC(F)(F)Oc1cccc(-c2c[nH+]cn2Cc2ccccc2)c1 ZINC001245198215 1058126973 /nfs/dbraw/zinc/12/69/73/1058126973.db2.gz VGELJZPUYNGTLC-UHFFFAOYSA-N 1 2 318.298 4.497 20 0 DIADLO COC(=O)c1ccc(-c2c[nH+]cn2Cc2ccccc2)c(C)c1C ZINC001245198387 1058127157 /nfs/dbraw/zinc/12/71/57/1058127157.db2.gz CPGGNFIGBYMAMW-UHFFFAOYSA-N 1 2 320.392 4.002 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1cncc(OCC2CC2)c1 ZINC001245243699 1058134135 /nfs/dbraw/zinc/13/41/35/1058134135.db2.gz HLJIUWSDOTUCCL-UHFFFAOYSA-N 1 2 323.440 4.231 20 0 DIADLO CC(=O)OCc1cc(-c2ccc(-c3c[nH+]cn3C)cc2)ccc1C ZINC001245377271 1058156645 /nfs/dbraw/zinc/15/66/45/1058156645.db2.gz CETYRAKQSNUFHX-UHFFFAOYSA-N 1 2 320.392 4.126 20 0 DIADLO FC(F)(F)c1cnccc1-c1ccccc1Cn1cc[nH+]c1 ZINC001245444209 1058167314 /nfs/dbraw/zinc/16/73/14/1058167314.db2.gz XDVZJNHSSPZLFD-UHFFFAOYSA-N 1 2 303.287 4.012 20 0 DIADLO CCc1nocc1C[N@@H+]1CCCC[C@@H]1c1nc(C)c(C)s1 ZINC001548842428 1058263098 /nfs/dbraw/zinc/26/30/98/1058263098.db2.gz FRPATHOAWOADNL-OAHLLOKOSA-N 1 2 305.447 4.038 20 0 DIADLO CCc1nocc1C[N@H+]1CCCC[C@@H]1c1nc(C)c(C)s1 ZINC001548842428 1058263111 /nfs/dbraw/zinc/26/31/11/1058263111.db2.gz FRPATHOAWOADNL-OAHLLOKOSA-N 1 2 305.447 4.038 20 0 DIADLO O=C1CCCCc2ccc(-c3cc[nH+]c(N4CCCC4)c3)cc21 ZINC001245598002 1058271553 /nfs/dbraw/zinc/27/15/53/1058271553.db2.gz RSVULYFVSCMFRN-UHFFFAOYSA-N 1 2 306.409 4.258 20 0 DIADLO c1nc(C[N@@H+]2CCC[C@H]3O[C@H](c4ccccc4)C[C@H]32)oc1C1CC1 ZINC001549084555 1058281318 /nfs/dbraw/zinc/28/13/18/1058281318.db2.gz XLJVWVGZPPIONT-KURKYZTESA-N 1 2 324.424 4.047 20 0 DIADLO c1nc(C[N@H+]2CCC[C@H]3O[C@H](c4ccccc4)C[C@H]32)oc1C1CC1 ZINC001549084555 1058281333 /nfs/dbraw/zinc/28/13/33/1058281333.db2.gz XLJVWVGZPPIONT-KURKYZTESA-N 1 2 324.424 4.047 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)CC[C@@H]3CC3(F)F)cc2)[nH+]c1C ZINC001550420007 1058338685 /nfs/dbraw/zinc/33/86/85/1058338685.db2.gz OUJZRUVLUPXGKH-CYBMUJFWSA-N 1 2 319.355 4.067 20 0 DIADLO c1c(C[N@@H+]2CCC[C@H]3O[C@H](c4ccccc4)C[C@@H]32)noc1C1CC1 ZINC001550641062 1058350163 /nfs/dbraw/zinc/35/01/63/1058350163.db2.gz BDOJUWLFNIGYNW-OTWHNJEPSA-N 1 2 324.424 4.047 20 0 DIADLO c1c(C[N@H+]2CCC[C@H]3O[C@H](c4ccccc4)C[C@@H]32)noc1C1CC1 ZINC001550641062 1058350179 /nfs/dbraw/zinc/35/01/79/1058350179.db2.gz BDOJUWLFNIGYNW-OTWHNJEPSA-N 1 2 324.424 4.047 20 0 DIADLO Cc1nc(C2CC[NH+](Cc3cc(C4CC4)on3)CC2)sc1C ZINC001550621470 1058351551 /nfs/dbraw/zinc/35/15/51/1058351551.db2.gz JMMWIZNCWJFDJW-UHFFFAOYSA-N 1 2 317.458 4.005 20 0 DIADLO CCC[C@H](CC)C(=O)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC001518615845 1058357641 /nfs/dbraw/zinc/35/76/41/1058357641.db2.gz PXEZQGYCQKWDQA-HNNXBMFYSA-N 1 2 323.440 4.367 20 0 DIADLO Cc1cc(C)c(NC(=O)N2CC[C@@H]3CCCC[C@H]3C2)c(C)[nH+]1 ZINC001562900628 1058357403 /nfs/dbraw/zinc/35/74/03/1058357403.db2.gz MAPYJXIRRKCYJU-HOTGVXAUSA-N 1 2 301.434 4.051 20 0 DIADLO Cc1ccc([C@@H](C)NC(=O)Nc2c(C)cc(C)[nH+]c2C)s1 ZINC001562900614 1058358017 /nfs/dbraw/zinc/35/80/17/1058358017.db2.gz LLWDRKANCGUZPX-GFCCVEGCSA-N 1 2 303.431 4.259 20 0 DIADLO Cc1occ(C(F)(F)F)c1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC001528347899 1058399189 /nfs/dbraw/zinc/39/91/89/1058399189.db2.gz WFZYMJQVAHYELK-UHFFFAOYSA-N 1 2 312.291 4.179 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@@H]2CCCC2(F)F)[nH+]c1C ZINC001551737983 1058408165 /nfs/dbraw/zinc/40/81/65/1058408165.db2.gz FQVGTFDPAWMXPZ-ZDUSSCGKSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)CC[C@H]2CC2(F)F)[nH+]c1C ZINC001551738872 1058408197 /nfs/dbraw/zinc/40/81/97/1058408197.db2.gz JXVDSZYZFWAPRN-LBPRGKRZSA-N 1 2 319.355 4.067 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)[C@H]2CCCC[C@@H]2C)[nH+]c1C ZINC001551737387 1058408527 /nfs/dbraw/zinc/40/85/27/1058408527.db2.gz DEUQRMAOEUOBGS-WFASDCNBSA-N 1 2 311.429 4.458 20 0 DIADLO CC[C@@H]1CCC[C@H]1C(=O)Nc1ccccc1-c1[nH]c(C)c(C)[nH+]1 ZINC001551738639 1058408923 /nfs/dbraw/zinc/40/89/23/1058408923.db2.gz IDXMGXFPHOADLM-HUUCEWRRSA-N 1 2 311.429 4.458 20 0 DIADLO CC[C@H](CC(F)F)C(=O)Nc1ccccc1-c1[nH]c(C)c(C)[nH+]1 ZINC001551743666 1058411466 /nfs/dbraw/zinc/41/14/66/1058411466.db2.gz YHYNXEFNOJNSOJ-GFCCVEGCSA-N 1 2 321.371 4.313 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)C2CCC(C)CC2)[nH+]c1C ZINC001551743001 1058411789 /nfs/dbraw/zinc/41/17/89/1058411789.db2.gz UTJOZZLIMHEUGA-UHFFFAOYSA-N 1 2 311.429 4.458 20 0 DIADLO C[C@H]1CCC[C@@]1(C)C(=O)Nc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC001519381982 1058423610 /nfs/dbraw/zinc/42/36/10/1058423610.db2.gz RPCBOORSJFNYDP-YVEFUNNKSA-N 1 2 317.820 4.291 20 0 DIADLO CC[C@H](CC1CCCCC1)C(=O)NCc1c[nH+]c(C)cc1C ZINC001528520912 1058442274 /nfs/dbraw/zinc/44/22/74/1058442274.db2.gz DOCPCYDRVRDNKY-QGZVFWFLSA-N 1 2 302.462 4.311 20 0 DIADLO Cc1cc(C)c(CNC(=O)c2ccc(-c3ccccc3)s2)c[nH+]1 ZINC001528513653 1058443334 /nfs/dbraw/zinc/44/33/34/1058443334.db2.gz HUBOANPCBOLUJR-UHFFFAOYSA-N 1 2 322.433 4.357 20 0 DIADLO Cc1cc(N2CCCCC2)[nH+]cc1-c1ccc(Cl)nc1C ZINC001245773212 1058457801 /nfs/dbraw/zinc/45/78/01/1058457801.db2.gz DRSFCNOJWDUBAT-UHFFFAOYSA-N 1 2 301.821 4.404 20 0 DIADLO Cc1ccc(NC(=S)Nc2cccc3[nH+]ccn32)cc1Cl ZINC001245810240 1058493715 /nfs/dbraw/zinc/49/37/15/1058493715.db2.gz NYTISCJAEAGSQS-UHFFFAOYSA-N 1 2 316.817 4.105 20 0 DIADLO Cc1cc(N[C@H]2CCO[C@@H](c3cccnc3)C2)[nH+]c2ccccc12 ZINC001553701190 1058499188 /nfs/dbraw/zinc/49/91/88/1058499188.db2.gz RRSPIFUNXOAMGX-QFBILLFUSA-N 1 2 319.408 4.270 20 0 DIADLO Cc1[nH]c(-c2ccc(NC(=O)[C@H]3C[C@H]3c3ccco3)cc2)[nH+]c1C ZINC001553889033 1058509968 /nfs/dbraw/zinc/50/99/68/1058509968.db2.gz BFRJERKTFFXHDC-CVEARBPZSA-N 1 2 321.380 4.029 20 0 DIADLO Cc1[nH]c(-c2ccccc2NC(=O)c2occ3c2CCC3)[nH+]c1C ZINC001553985843 1058512846 /nfs/dbraw/zinc/51/28/46/1058512846.db2.gz AICUAOCQHUTZFO-UHFFFAOYSA-N 1 2 321.380 4.028 20 0 DIADLO COc1cc(-n2cc[nH+]c2)ccc1-c1c(F)ccc(O)c1Cl ZINC001245834084 1058535465 /nfs/dbraw/zinc/53/54/65/1058535465.db2.gz CEJTVANONLRMIR-UHFFFAOYSA-N 1 2 318.735 4.046 20 0 DIADLO CC(C)Oc1c(F)cc(-c2ccn3cc(N)[nH+]c3c2)cc1Cl ZINC001245867120 1058576674 /nfs/dbraw/zinc/57/66/74/1058576674.db2.gz IMLQTBUTGVFDMQ-UHFFFAOYSA-N 1 2 319.767 4.163 20 0 DIADLO CCCCC[C@](C)(CC)C(=O)N1CCC(Cc2c[nH]c[nH+]2)CC1 ZINC001520814111 1058693209 /nfs/dbraw/zinc/69/32/09/1058693209.db2.gz JYAZVALGNBVPKN-IBGZPJMESA-N 1 2 319.493 4.187 20 0 DIADLO CCC[C@@H](CC)C(=O)N1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001520868338 1058703838 /nfs/dbraw/zinc/70/38/38/1058703838.db2.gz SKHIGGYUNMKPQQ-HZPDHXFCSA-N 1 2 319.493 4.170 20 0 DIADLO Cc1ccccc1N(C)C(=O)[C@H]1CC[C@@H](Nc2cccc[nH+]2)CC1 ZINC001557627389 1058777761 /nfs/dbraw/zinc/77/77/61/1058777761.db2.gz UZKXBDMHZLQMJZ-CALCHBBNSA-N 1 2 323.440 4.024 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)Nc3ccc4ccccc4c3)ccn12 ZINC001521399792 1058856342 /nfs/dbraw/zinc/85/63/42/1058856342.db2.gz GOGAKIKEZPJKMJ-UHFFFAOYSA-N 1 2 301.349 4.048 20 0 DIADLO CCCCC[C@@H](NC(=O)c1ccn2c(C)c[nH+]c2c1)C(C)(C)C ZINC001521621478 1058925808 /nfs/dbraw/zinc/92/58/08/1058925808.db2.gz YHCAVMPWJVAXPV-MRXNPFEDSA-N 1 2 315.461 4.368 20 0 DIADLO CCC[C@@H](C(=O)N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1)C(C)C ZINC001558953073 1058926778 /nfs/dbraw/zinc/92/67/78/1058926778.db2.gz AKUBGEHRICQLFV-CRAIPNDOSA-N 1 2 313.445 4.122 20 0 DIADLO Cc1cc2sc(NCCc3cn4ccccc4[nH+]3)nc2c(C)c1 ZINC001559061174 1058957225 /nfs/dbraw/zinc/95/72/25/1058957225.db2.gz VYAOJIMWPJZEAH-UHFFFAOYSA-N 1 2 322.437 4.215 20 0 DIADLO CCc1cc(NCCCCOc2ccc(C)cc2)nc(CC)[nH+]1 ZINC001559071884 1058964969 /nfs/dbraw/zinc/96/49/69/1058964969.db2.gz GDBVGSDNGPQGRX-UHFFFAOYSA-N 1 2 313.445 4.181 20 0 DIADLO Cc1nc2c(c(Nc3ccc(NC4CCCC4)[nH+]c3)n1)CCCC2 ZINC001559090968 1058982865 /nfs/dbraw/zinc/98/28/65/1058982865.db2.gz VWWMDHLVMXKJLG-UHFFFAOYSA-N 1 2 323.444 4.157 20 0 DIADLO CCc1cc(N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)nc(CC)[nH+]1 ZINC001559109437 1058996192 /nfs/dbraw/zinc/99/61/92/1058996192.db2.gz TWMFLYMKUZQQBJ-DZGCQCFKSA-N 1 2 313.420 4.123 20 0 DIADLO CC[C@H](CNc1cc(C)[nH+]c(C2CC2)n1)Oc1ccccc1C ZINC001559121224 1059009177 /nfs/dbraw/zinc/00/91/77/1059009177.db2.gz NCDDOIIQNONDFA-MRXNPFEDSA-N 1 2 311.429 4.240 20 0 DIADLO C[C@H](c1ccccc1)[C@H](C)Nc1nc2ccccc2n2c[nH+]cc12 ZINC001559124135 1059014104 /nfs/dbraw/zinc/01/41/04/1059014104.db2.gz XHJRJLHJOMFUCA-GJZGRUSLSA-N 1 2 316.408 4.487 20 0 DIADLO C[C@@H](Nc1nc2ccccc2n2c[nH+]cc12)[C@@H](C)c1ccccc1 ZINC001559124137 1059014893 /nfs/dbraw/zinc/01/48/93/1059014893.db2.gz XHJRJLHJOMFUCA-HUUCEWRRSA-N 1 2 316.408 4.487 20 0 DIADLO CCS[C@@H]1CCC[C@H](Nc2nc(C)[nH+]c3c2CCCC3)C1 ZINC001559127646 1059016605 /nfs/dbraw/zinc/01/66/05/1059016605.db2.gz RTDWOEXWYZVZGX-UONOGXRCSA-N 1 2 305.491 4.140 20 0 DIADLO Cc1nc(N2CC3(CCCCC3)[C@H]2C(C)C)c2c([nH+]1)CCCC2 ZINC001559208631 1059088262 /nfs/dbraw/zinc/08/82/62/1059088262.db2.gz QNVTXAPDHTZQHW-GOSISDBHSA-N 1 2 313.489 4.459 20 0 DIADLO Cc1nc(N2CCc3ccc(Cl)cc3[C@H](C)C2)c(C)c(C)[nH+]1 ZINC001559228722 1059106578 /nfs/dbraw/zinc/10/65/78/1059106578.db2.gz MKYLOVMDZOBNMX-LLVKDONJSA-N 1 2 315.848 4.221 20 0 DIADLO Cc1cc(NCC(C)(C)CC(F)(F)F)nc(C2CCC2)[nH+]1 ZINC001559243576 1059118059 /nfs/dbraw/zinc/11/80/59/1059118059.db2.gz GGEYIPUFSLUTOQ-UHFFFAOYSA-N 1 2 301.356 4.443 20 0 DIADLO CC1(C)C(C)(C)C1(C)Nc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC001559296555 1059148824 /nfs/dbraw/zinc/14/88/24/1059148824.db2.gz UXOIUOWICZNMMI-UHFFFAOYSA-N 1 2 321.428 4.052 20 0 DIADLO CO[C@@H](CSc1[nH+]cc2ccccn21)c1ccc(Cl)cc1 ZINC001559323657 1059162492 /nfs/dbraw/zinc/16/24/92/1059162492.db2.gz LONBTLIBRVJCEW-HNNXBMFYSA-N 1 2 318.829 4.468 20 0 DIADLO CC(C)(CC1CCCCCC1)NC(=O)c1cccc2[nH+]ccn21 ZINC001523273343 1059208918 /nfs/dbraw/zinc/20/89/18/1059208918.db2.gz UQPJHZIILYVKFA-UHFFFAOYSA-N 1 2 313.445 4.203 20 0 DIADLO c1cn(-c2ccc(CSc3nc4ncccc4s3)cc2)c[nH+]1 ZINC001559452087 1059239711 /nfs/dbraw/zinc/23/97/11/1059239711.db2.gz XOBHILBARCCTJM-UHFFFAOYSA-N 1 2 324.434 4.169 20 0 DIADLO CC[N@H+](Cc1cc(OC)no1)Cc1ccc(Cl)c(Cl)c1 ZINC001559493074 1059271825 /nfs/dbraw/zinc/27/18/25/1059271825.db2.gz NQPCROREKLJOAF-UHFFFAOYSA-N 1 2 315.200 4.012 20 0 DIADLO CC[N@@H+](Cc1cc(OC)no1)Cc1ccc(Cl)c(Cl)c1 ZINC001559493074 1059271841 /nfs/dbraw/zinc/27/18/41/1059271841.db2.gz NQPCROREKLJOAF-UHFFFAOYSA-N 1 2 315.200 4.012 20 0 DIADLO CC[N@H+](Cc1cc(Cl)n(C)n1)[C@@H](C)c1cc2ccccc2o1 ZINC001559499231 1059284370 /nfs/dbraw/zinc/28/43/70/1059284370.db2.gz MLRHMRVAHJPWTP-LBPRGKRZSA-N 1 2 317.820 4.403 20 0 DIADLO CC[N@@H+](Cc1cc(Cl)n(C)n1)[C@@H](C)c1cc2ccccc2o1 ZINC001559499231 1059284386 /nfs/dbraw/zinc/28/43/86/1059284386.db2.gz MLRHMRVAHJPWTP-LBPRGKRZSA-N 1 2 317.820 4.403 20 0 DIADLO C[N@@H+](Cc1c(Cl)cccc1Cl)C[C@@H]1CC[C@@H](C2CC2)O1 ZINC001559501634 1059287200 /nfs/dbraw/zinc/28/72/00/1059287200.db2.gz REQWIHKWNFMFJV-LRDDRELGSA-N 1 2 314.256 4.383 20 0 DIADLO C[N@H+](Cc1c(Cl)cccc1Cl)C[C@@H]1CC[C@@H](C2CC2)O1 ZINC001559501634 1059287220 /nfs/dbraw/zinc/28/72/20/1059287220.db2.gz REQWIHKWNFMFJV-LRDDRELGSA-N 1 2 314.256 4.383 20 0 DIADLO Fc1ccc([C@H]2C[N@H+](CCCC3CCC3)CCO2)cc1Cl ZINC001559521476 1059322682 /nfs/dbraw/zinc/32/26/82/1059322682.db2.gz IRGIALUFLCFXPA-QGZVFWFLSA-N 1 2 311.828 4.433 20 0 DIADLO Fc1ccc([C@H]2C[N@@H+](CCCC3CCC3)CCO2)cc1Cl ZINC001559521476 1059322706 /nfs/dbraw/zinc/32/27/06/1059322706.db2.gz IRGIALUFLCFXPA-QGZVFWFLSA-N 1 2 311.828 4.433 20 0 DIADLO COC(=O)[C@@H](c1ccccc1F)[N@@H+]1CCCC2(CCCCC2)C1 ZINC001559528862 1059328957 /nfs/dbraw/zinc/32/89/57/1059328957.db2.gz VKOUNWFRKWXWGX-QGZVFWFLSA-N 1 2 319.420 4.086 20 0 DIADLO COC(=O)[C@@H](c1ccccc1F)[N@H+]1CCCC2(CCCCC2)C1 ZINC001559528862 1059328976 /nfs/dbraw/zinc/32/89/76/1059328976.db2.gz VKOUNWFRKWXWGX-QGZVFWFLSA-N 1 2 319.420 4.086 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ncc(Br)cc1Cl ZINC001559559324 1059363504 /nfs/dbraw/zinc/36/35/04/1059363504.db2.gz ONOFHEICVMSHGQ-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ncc(Br)cc1Cl ZINC001559559324 1059363526 /nfs/dbraw/zinc/36/35/26/1059363526.db2.gz ONOFHEICVMSHGQ-VHSXEESVSA-N 1 2 317.658 4.118 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@H](C(C)C)CC1 ZINC001559546337 1059351619 /nfs/dbraw/zinc/35/16/19/1059351619.db2.gz TTZKNZRPHACBOX-WMLDXEAASA-N 1 2 323.864 4.312 20 0 DIADLO COC(=O)[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H](C(C)C)CC1 ZINC001559546337 1059351642 /nfs/dbraw/zinc/35/16/42/1059351642.db2.gz TTZKNZRPHACBOX-WMLDXEAASA-N 1 2 323.864 4.312 20 0 DIADLO c1[nH]c2c([nH+]1)[C@@H](c1nc(-c3cccc4ccccc43)no1)CCC2 ZINC001247276162 1059365471 /nfs/dbraw/zinc/36/54/71/1059365471.db2.gz PETOHCZHWIZIGH-HNNXBMFYSA-N 1 2 316.364 4.081 20 0 DIADLO c1cn(-c2ccc(-c3noc(C45CCC(CC4)CC5)n3)cc2)c[nH+]1 ZINC001247360191 1059396954 /nfs/dbraw/zinc/39/69/54/1059396954.db2.gz VGDSZFQBXBNOFH-UHFFFAOYSA-N 1 2 320.396 4.144 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cscc1Br ZINC001559574467 1059405420 /nfs/dbraw/zinc/40/54/20/1059405420.db2.gz ACWKYCNLWFBXJC-NSHDSACASA-N 1 2 322.271 4.457 20 0 DIADLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cscc1Br ZINC001559574467 1059405431 /nfs/dbraw/zinc/40/54/31/1059405431.db2.gz ACWKYCNLWFBXJC-NSHDSACASA-N 1 2 322.271 4.457 20 0 DIADLO CCc1ccc(N2CC[NH+](Cc3ccc(Cl)s3)CC2)cc1 ZINC001559576544 1059408937 /nfs/dbraw/zinc/40/89/37/1059408937.db2.gz DISVUCNSGQJMRE-UHFFFAOYSA-N 1 2 320.889 4.286 20 0 DIADLO CCc1cnc(C[N@H+](C)C[C@H]2CCC3(CCCCCC3)O2)s1 ZINC001559578490 1059411207 /nfs/dbraw/zinc/41/12/07/1059411207.db2.gz YDZXRUCFTKUCIA-OAHLLOKOSA-N 1 2 322.518 4.409 20 0 DIADLO CCc1cnc(C[N@@H+](C)C[C@H]2CCC3(CCCCCC3)O2)s1 ZINC001559578490 1059411218 /nfs/dbraw/zinc/41/12/18/1059411218.db2.gz YDZXRUCFTKUCIA-OAHLLOKOSA-N 1 2 322.518 4.409 20 0 DIADLO Cc1conc1C[N@@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC001559662289 1059491911 /nfs/dbraw/zinc/49/19/11/1059491911.db2.gz VWPODJORYVXYPU-FQEVSTJZSA-N 1 2 304.393 4.283 20 0 DIADLO Cc1conc1C[N@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC001559662289 1059491914 /nfs/dbraw/zinc/49/19/14/1059491914.db2.gz VWPODJORYVXYPU-FQEVSTJZSA-N 1 2 304.393 4.283 20 0 DIADLO CCOc1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)nc1 ZINC001559724915 1059555514 /nfs/dbraw/zinc/55/55/14/1059555514.db2.gz JWAJELJSUVYJEX-GFCCVEGCSA-N 1 2 319.474 4.085 20 0 DIADLO CCOC(=O)[C@H]1CCC[N@@H+]1Cc1ccc(Cl)c2ccccc12 ZINC001559771508 1059607915 /nfs/dbraw/zinc/60/79/15/1059607915.db2.gz YNMJURKQNRFWLL-QGZVFWFLSA-N 1 2 317.816 4.021 20 0 DIADLO CCOC(=O)[C@H]1CCC[N@H+]1Cc1ccc(Cl)c2ccccc12 ZINC001559771508 1059607922 /nfs/dbraw/zinc/60/79/22/1059607922.db2.gz YNMJURKQNRFWLL-QGZVFWFLSA-N 1 2 317.816 4.021 20 0 DIADLO Cc1ccc2ncc(C[N@@H+]3CCOc4cccc(F)c4C3)cc2c1 ZINC001559787493 1059621479 /nfs/dbraw/zinc/62/14/79/1059621479.db2.gz WFJWJPAUHKZBIH-UHFFFAOYSA-N 1 2 322.383 4.077 20 0 DIADLO Cc1ccc2ncc(C[N@H+]3CCOc4cccc(F)c4C3)cc2c1 ZINC001559787493 1059621489 /nfs/dbraw/zinc/62/14/89/1059621489.db2.gz WFJWJPAUHKZBIH-UHFFFAOYSA-N 1 2 322.383 4.077 20 0 DIADLO FC1(c2nc(-c3ccc(-n4cc[nH+]c4)cc3)no2)CCCCC1 ZINC001247779685 1059625019 /nfs/dbraw/zinc/62/50/19/1059625019.db2.gz HXZNSBXEYBFQKA-UHFFFAOYSA-N 1 2 312.348 4.051 20 0 DIADLO COC[C@@H](c1ccc(Cl)cc1)[N@H+](C)CC=C(Cl)Cl ZINC001559803253 1059640569 /nfs/dbraw/zinc/64/05/69/1059640569.db2.gz ZLKHUPDONUDDSB-LBPRGKRZSA-N 1 2 308.636 4.278 20 0 DIADLO COC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)CC=C(Cl)Cl ZINC001559803253 1059640585 /nfs/dbraw/zinc/64/05/85/1059640585.db2.gz ZLKHUPDONUDDSB-LBPRGKRZSA-N 1 2 308.636 4.278 20 0 DIADLO Cc1cccc(NC(=O)C[N@H+]2CCc3c(cccc3C(C)C)C2)c1 ZINC001559806649 1059643069 /nfs/dbraw/zinc/64/30/69/1059643069.db2.gz CEUXOYSHQTYPCA-UHFFFAOYSA-N 1 2 322.452 4.115 20 0 DIADLO Cc1cccc(NC(=O)C[N@@H+]2CCc3c(cccc3C(C)C)C2)c1 ZINC001559806649 1059643075 /nfs/dbraw/zinc/64/30/75/1059643075.db2.gz CEUXOYSHQTYPCA-UHFFFAOYSA-N 1 2 322.452 4.115 20 0 DIADLO CCCc1ccc(C[N@@H+]2C[C@@H](C(F)(F)F)OC(C)(C)C2)cc1 ZINC001559858802 1059680256 /nfs/dbraw/zinc/68/02/56/1059680256.db2.gz KREJAPMVVIMEJF-HNNXBMFYSA-N 1 2 315.379 4.181 20 0 DIADLO CCCc1ccc(C[N@H+]2C[C@@H](C(F)(F)F)OC(C)(C)C2)cc1 ZINC001559858802 1059680264 /nfs/dbraw/zinc/68/02/64/1059680264.db2.gz KREJAPMVVIMEJF-HNNXBMFYSA-N 1 2 315.379 4.181 20 0 DIADLO Clc1cc(C[N@@H+]2CCOC[C@H](C3CCC3)C2)c(Cl)s1 ZINC001559862147 1059682790 /nfs/dbraw/zinc/68/27/90/1059682790.db2.gz HHOGEVXLMBXWBU-GFCCVEGCSA-N 1 2 320.285 4.303 20 0 DIADLO Clc1cc(C[N@H+]2CCOC[C@H](C3CCC3)C2)c(Cl)s1 ZINC001559862147 1059682798 /nfs/dbraw/zinc/68/27/98/1059682798.db2.gz HHOGEVXLMBXWBU-GFCCVEGCSA-N 1 2 320.285 4.303 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001559876361 1059697087 /nfs/dbraw/zinc/69/70/87/1059697087.db2.gz TYLAIRXMHDUURM-STQMWFEESA-N 1 2 303.352 4.309 20 0 DIADLO C[C@@H](c1cc(F)ccc1F)[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001559876361 1059697093 /nfs/dbraw/zinc/69/70/93/1059697093.db2.gz TYLAIRXMHDUURM-STQMWFEESA-N 1 2 303.352 4.309 20 0 DIADLO COC(=O)[C@H](c1ccsc1)[NH+]1CCC(C)(CC(C)C)CC1 ZINC001559884137 1059703056 /nfs/dbraw/zinc/70/30/56/1059703056.db2.gz LLOPZBQQWFVIOJ-HNNXBMFYSA-N 1 2 309.475 4.110 20 0 DIADLO Cc1cc(C)cc(-c2noc([C@H]3Cc4ccccc4C[N@H+]3C)n2)c1 ZINC001248121502 1059734347 /nfs/dbraw/zinc/73/43/47/1059734347.db2.gz ZOZIISOMIMBCBZ-GOSISDBHSA-N 1 2 319.408 4.083 20 0 DIADLO Cc1cc(C)cc(-c2noc([C@H]3Cc4ccccc4C[N@@H+]3C)n2)c1 ZINC001248121502 1059734365 /nfs/dbraw/zinc/73/43/65/1059734365.db2.gz ZOZIISOMIMBCBZ-GOSISDBHSA-N 1 2 319.408 4.083 20 0 DIADLO Clc1ccc(C[N@@H+]2CCSC[C@@H]2C2CCC2)c(Cl)n1 ZINC001559926012 1059739748 /nfs/dbraw/zinc/73/97/48/1059739748.db2.gz HIZVILHXUILXRJ-GFCCVEGCSA-N 1 2 317.285 4.106 20 0 DIADLO Clc1ccc(C[N@H+]2CCSC[C@@H]2C2CCC2)c(Cl)n1 ZINC001559926012 1059739764 /nfs/dbraw/zinc/73/97/64/1059739764.db2.gz HIZVILHXUILXRJ-GFCCVEGCSA-N 1 2 317.285 4.106 20 0 DIADLO Cl/C=C(\Cl)C[NH+]1CCC(Cc2nc3ccccc3[nH]2)CC1 ZINC001559932235 1059745662 /nfs/dbraw/zinc/74/56/62/1059745662.db2.gz CKETXZMTCXSDNQ-RAXLEYEMSA-N 1 2 324.255 4.136 20 0 DIADLO FCc1ccc(C[NH2+][C@H](Cc2ccccc2)c2ncco2)cc1 ZINC001559945578 1059762023 /nfs/dbraw/zinc/76/20/23/1059762023.db2.gz YAHGHVZXJRTSAU-GOSISDBHSA-N 1 2 310.372 4.218 20 0 DIADLO O=C(CCc1cccc2ccccc21)Nc1ccc2[nH+]ccn2c1 ZINC001533107896 1059797984 /nfs/dbraw/zinc/79/79/84/1059797984.db2.gz JMIHWSCYIJMAIN-UHFFFAOYSA-N 1 2 315.376 4.059 20 0 DIADLO Fc1cccc([C@H]2COCC[N@@H+]2Cc2ccccc2C2CC2)c1 ZINC001560002474 1059807023 /nfs/dbraw/zinc/80/70/23/1059807023.db2.gz QCQZUDMIXRVEMV-HXUWFJFHSA-N 1 2 311.400 4.277 20 0 DIADLO Fc1cccc([C@H]2COCC[N@H+]2Cc2ccccc2C2CC2)c1 ZINC001560002474 1059807044 /nfs/dbraw/zinc/80/70/44/1059807044.db2.gz QCQZUDMIXRVEMV-HXUWFJFHSA-N 1 2 311.400 4.277 20 0 DIADLO C[N@H+](Cc1ccc(F)cc1F)Cc1c2ccoc2ccc1F ZINC001248542007 1059872861 /nfs/dbraw/zinc/87/28/61/1059872861.db2.gz SQCPRYPFQLDPGT-UHFFFAOYSA-N 1 2 305.299 4.482 20 0 DIADLO C[N@@H+](Cc1ccc(F)cc1F)Cc1c2ccoc2ccc1F ZINC001248542007 1059872885 /nfs/dbraw/zinc/87/28/85/1059872885.db2.gz SQCPRYPFQLDPGT-UHFFFAOYSA-N 1 2 305.299 4.482 20 0 DIADLO Fc1ccc(C[N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)cc1 ZINC001560061231 1059874029 /nfs/dbraw/zinc/87/40/29/1059874029.db2.gz HRMVEVSNAHWXES-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO Fc1ccc(C[N@H+]2CCc3ccc(C(F)(F)F)cc3C2)cc1 ZINC001560061231 1059874055 /nfs/dbraw/zinc/87/40/55/1059874055.db2.gz HRMVEVSNAHWXES-UHFFFAOYSA-N 1 2 309.306 4.403 20 0 DIADLO COc1cccc2c1C[N@H+](Cc1c(Cl)ccc3cccnc31)C2 ZINC001560070409 1059882846 /nfs/dbraw/zinc/88/28/46/1059882846.db2.gz XZGXHCKURUWBTO-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO COc1cccc2c1C[N@@H+](Cc1c(Cl)ccc3cccnc31)C2 ZINC001560070409 1059882871 /nfs/dbraw/zinc/88/28/71/1059882871.db2.gz XZGXHCKURUWBTO-UHFFFAOYSA-N 1 2 324.811 4.413 20 0 DIADLO Cc1cccc(Br)c1C[N@@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001248603289 1059908554 /nfs/dbraw/zinc/90/85/54/1059908554.db2.gz GUHADJPOQQSDLY-KBPBESRZSA-N 1 2 318.205 4.030 20 0 DIADLO Cc1cccc(Br)c1C[N@H+]1CC[C@](C)(F)[C@@H](F)C1 ZINC001248603289 1059908569 /nfs/dbraw/zinc/90/85/69/1059908569.db2.gz GUHADJPOQQSDLY-KBPBESRZSA-N 1 2 318.205 4.030 20 0 DIADLO CCc1cccc(CC)c1NC(=S)Nc1ccc2[nH+]ccn2c1 ZINC001248644604 1059923170 /nfs/dbraw/zinc/92/31/70/1059923170.db2.gz CBVLWYNMTWVBSQ-UHFFFAOYSA-N 1 2 324.453 4.268 20 0 DIADLO CCCCCCc1csc(C[N@H+]2CCC(=O)[C@@H](F)CC2)c1 ZINC001248682721 1059935952 /nfs/dbraw/zinc/93/59/52/1059935952.db2.gz CMDVONSIKRTNSZ-INIZCTEOSA-N 1 2 311.466 4.374 20 0 DIADLO CCCCCCc1csc(C[N@@H+]2CCC(=O)[C@@H](F)CC2)c1 ZINC001248682721 1059935973 /nfs/dbraw/zinc/93/59/73/1059935973.db2.gz CMDVONSIKRTNSZ-INIZCTEOSA-N 1 2 311.466 4.374 20 0 DIADLO CCCCCCc1csc(C[N@@H+]2CCc3c(ncn3C)C2)c1 ZINC001248687158 1059937719 /nfs/dbraw/zinc/93/77/19/1059937719.db2.gz LCICYLYWKGQYRE-UHFFFAOYSA-N 1 2 317.502 4.163 20 0 DIADLO CCCCCCc1csc(C[N@H+]2CCc3c(ncn3C)C2)c1 ZINC001248687158 1059937739 /nfs/dbraw/zinc/93/77/39/1059937739.db2.gz LCICYLYWKGQYRE-UHFFFAOYSA-N 1 2 317.502 4.163 20 0 DIADLO CCCCCCc1csc(CN2CCc3c([nH+]cn3C)C2)c1 ZINC001248687158 1059937758 /nfs/dbraw/zinc/93/77/58/1059937758.db2.gz LCICYLYWKGQYRE-UHFFFAOYSA-N 1 2 317.502 4.163 20 0 DIADLO CC(C)C[C@@H](C)C[NH2+][C@@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001560179586 1059964913 /nfs/dbraw/zinc/96/49/13/1059964913.db2.gz PQDXSCDRMNIPRO-AEFFLSMTSA-N 1 2 319.489 4.211 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ncc(C(F)(F)F)cc2F)cc1 ZINC001248789308 1059974888 /nfs/dbraw/zinc/97/48/88/1059974888.db2.gz VLJUVKVGHFOJMC-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ncc(C(F)(F)F)cc2F)cc1 ZINC001248789308 1059974900 /nfs/dbraw/zinc/97/49/00/1059974900.db2.gz VLJUVKVGHFOJMC-UHFFFAOYSA-N 1 2 312.310 4.180 20 0 DIADLO Cc1ccc2c(c1)CC[N@@H+](Cc1ncc(C(F)(F)F)cc1F)C2 ZINC001248791053 1059982704 /nfs/dbraw/zinc/98/27/04/1059982704.db2.gz QHHHQKNRYQISIQ-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1ccc2c(c1)CC[N@H+](Cc1ncc(C(F)(F)F)cc1F)C2 ZINC001248791053 1059982721 /nfs/dbraw/zinc/98/27/21/1059982721.db2.gz QHHHQKNRYQISIQ-UHFFFAOYSA-N 1 2 324.321 4.106 20 0 DIADLO Cc1cc(CN2CC[NH+]([C@@H](C)c3ccc(F)cc3)CC2)cs1 ZINC001248804897 1059985406 /nfs/dbraw/zinc/98/54/06/1059985406.db2.gz ZUWABBBWZAREFF-HNNXBMFYSA-N 1 2 318.461 4.074 20 0 DIADLO Fc1ccc(C[N@@H+]2Cc3cccc(Cl)c3C2)c2[nH]ccc21 ZINC001248818477 1059998252 /nfs/dbraw/zinc/99/82/52/1059998252.db2.gz NRADXPBADVPIAY-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO Fc1ccc(C[N@H+]2Cc3cccc(Cl)c3C2)c2[nH]ccc21 ZINC001248818477 1059998269 /nfs/dbraw/zinc/99/82/69/1059998269.db2.gz NRADXPBADVPIAY-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1nc2cccc(Br)c2o1 ZINC001248851356 1060020213 /nfs/dbraw/zinc/02/02/13/1060020213.db2.gz IEQHUINXKCMPIL-WDEREUQCSA-N 1 2 323.234 4.211 20 0 DIADLO C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1nc2cccc(Br)c2o1 ZINC001248851356 1060020227 /nfs/dbraw/zinc/02/02/27/1060020227.db2.gz IEQHUINXKCMPIL-WDEREUQCSA-N 1 2 323.234 4.211 20 0 DIADLO O=C(CC1CCCC1)Oc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC001525784030 1060031483 /nfs/dbraw/zinc/03/14/83/1060031483.db2.gz UMXXRXAZWXGJFZ-UHFFFAOYSA-N 1 2 324.424 4.372 20 0 DIADLO Cc1cccc(-c2noc([C@H]([NH3+])c3ccc(Cl)cc3)n2)c1C ZINC001248998010 1060102347 /nfs/dbraw/zinc/10/23/47/1060102347.db2.gz HAYKHQNQHPATEZ-OAHLLOKOSA-N 1 2 313.788 4.055 20 0 DIADLO COc1ccccc1[C@@H]([NH2+]Cc1cc(C)co1)c1ccccc1 ZINC001560325905 1060111757 /nfs/dbraw/zinc/11/17/57/1060111757.db2.gz COZCSURHLHTQFT-FQEVSTJZSA-N 1 2 307.393 4.476 20 0 DIADLO CCc1cccc(F)c1CNc1ccc(-n2cc[nH+]c2)c(F)c1 ZINC001560386903 1060174481 /nfs/dbraw/zinc/17/44/81/1060174481.db2.gz KKRRYWRADKNGFQ-UHFFFAOYSA-N 1 2 313.351 4.325 20 0 DIADLO CCC[C@@](C)(CC)c1nc(-c2ccc(-n3cc[nH+]c3)cc2)no1 ZINC001249165911 1060177701 /nfs/dbraw/zinc/17/77/01/1060177701.db2.gz MPWNXJDIPCNSBB-GOSISDBHSA-N 1 2 310.401 4.390 20 0 DIADLO Cc1cc(NCc2nc3c(s2)CCCC3)ccc1-n1cc[nH+]c1 ZINC001560392299 1060178209 /nfs/dbraw/zinc/17/82/09/1060178209.db2.gz XTDUQXLEQJEMDJ-UHFFFAOYSA-N 1 2 324.453 4.128 20 0 DIADLO c1cn(-c2cccc(NCc3cccc4ncccc34)c2)c[nH+]1 ZINC001560392296 1060178245 /nfs/dbraw/zinc/17/82/45/1060178245.db2.gz XPUQSJKIXUEBIX-UHFFFAOYSA-N 1 2 300.365 4.033 20 0 DIADLO CCOc1cc(C)ccc1C[NH2+]Cc1ncc(C(C)C)s1 ZINC001560394716 1060181336 /nfs/dbraw/zinc/18/13/36/1060181336.db2.gz KULMPBLFDHCBRG-UHFFFAOYSA-N 1 2 304.459 4.263 20 0 DIADLO CCCn1c[nH+]cc1CNc1cccc(CCC(F)(F)F)c1 ZINC001560394295 1060181809 /nfs/dbraw/zinc/18/18/09/1060181809.db2.gz PIHVQBUUEQQBHC-UHFFFAOYSA-N 1 2 311.351 4.400 20 0 DIADLO CC(C)n1cc2c(n1)[C@@H]([NH2+]Cc1cccc(Cl)c1F)CCC2 ZINC001560412314 1060197646 /nfs/dbraw/zinc/19/76/46/1060197646.db2.gz PYYYQTHSHKPRNZ-HNNXBMFYSA-N 1 2 321.827 4.424 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3CC[N@@H+]3Cc3ccccc3)n2)cc1C ZINC001249254621 1060205891 /nfs/dbraw/zinc/20/58/91/1060205891.db2.gz BQSWGTJJQHDZAY-SFHVURJKSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1ccc(-c2noc([C@@H]3CC[N@H+]3Cc3ccccc3)n2)cc1C ZINC001249254621 1060205899 /nfs/dbraw/zinc/20/58/99/1060205899.db2.gz BQSWGTJJQHDZAY-SFHVURJKSA-N 1 2 319.408 4.300 20 0 DIADLO Cc1ccc(-c2noc([C@H]([NH3+])c3ccc4ccccc4c3)n2)cc1 ZINC001249325968 1060220380 /nfs/dbraw/zinc/22/03/80/1060220380.db2.gz RPCZATOKRWSWSP-GOSISDBHSA-N 1 2 315.376 4.246 20 0 DIADLO CCCCN(C(=O)c1ccn2c(C)c[nH+]c2c1)C1CCCCC1 ZINC001534320193 1060220702 /nfs/dbraw/zinc/22/07/02/1060220702.db2.gz QBTNFQFDVWHDPV-UHFFFAOYSA-N 1 2 313.445 4.218 20 0 DIADLO Cc1ccc(C[NH2+][C@H]2COc3cc(F)cc(F)c32)c(Cl)c1 ZINC001560437219 1060225201 /nfs/dbraw/zinc/22/52/01/1060225201.db2.gz HVZUVVVAVXCKPV-AWEZNQCLSA-N 1 2 309.743 4.150 20 0 DIADLO Cc1cc([C@H](C)NC(=O)c2c(C)cc(C)[nH+]c2C)c(C)s1 ZINC001526468273 1060229599 /nfs/dbraw/zinc/22/95/99/1060229599.db2.gz GVGDHNGSVQWBEW-LBPRGKRZSA-N 1 2 302.443 4.176 20 0 DIADLO CCOc1cc(F)cc(CNc2[nH+]cccc2OC(C)C)c1 ZINC001560443639 1060233281 /nfs/dbraw/zinc/23/32/81/1060233281.db2.gz KJFYMMQNLFFUMI-UHFFFAOYSA-N 1 2 304.365 4.019 20 0 DIADLO CC[N@H+](Cc1nc(Br)oc1C)Cc1ccc(C)cc1 ZINC001249391209 1060236117 /nfs/dbraw/zinc/23/61/17/1060236117.db2.gz WSMJIZYSBQLSTJ-UHFFFAOYSA-N 1 2 323.234 4.076 20 0 DIADLO CC[N@@H+](Cc1nc(Br)oc1C)Cc1ccc(C)cc1 ZINC001249391209 1060236132 /nfs/dbraw/zinc/23/61/32/1060236132.db2.gz WSMJIZYSBQLSTJ-UHFFFAOYSA-N 1 2 323.234 4.076 20 0 DIADLO CC[C@@H](C)c1nn(C)cc1C[N@H+](C)Cc1ccccc1Cl ZINC001249405873 1060236729 /nfs/dbraw/zinc/23/67/29/1060236729.db2.gz BVMKWXGMSVJJDJ-CYBMUJFWSA-N 1 2 305.853 4.219 20 0 DIADLO CC[C@@H](C)c1nn(C)cc1C[N@@H+](C)Cc1ccccc1Cl ZINC001249405873 1060236746 /nfs/dbraw/zinc/23/67/46/1060236746.db2.gz BVMKWXGMSVJJDJ-CYBMUJFWSA-N 1 2 305.853 4.219 20 0 DIADLO CC[C@H](C)c1nn(C)cc1C[N@@H+]1CCc2cccc(Cl)c2C1 ZINC001249408493 1060238956 /nfs/dbraw/zinc/23/89/56/1060238956.db2.gz FPXOTWZDNGRMNR-ZDUSSCGKSA-N 1 2 317.864 4.145 20 0 DIADLO CC[C@H](C)c1nn(C)cc1C[N@H+]1CCc2cccc(Cl)c2C1 ZINC001249408493 1060238972 /nfs/dbraw/zinc/23/89/72/1060238972.db2.gz FPXOTWZDNGRMNR-ZDUSSCGKSA-N 1 2 317.864 4.145 20 0 DIADLO CC[C@H](C)c1nn(C)cc1C[N@H+](CC)Cc1cccc(F)c1F ZINC001249410588 1060239716 /nfs/dbraw/zinc/23/97/16/1060239716.db2.gz ZIUHUNNZYWWGJC-ZDUSSCGKSA-N 1 2 321.415 4.234 20 0 DIADLO CC[C@H](C)c1nn(C)cc1C[N@@H+](CC)Cc1cccc(F)c1F ZINC001249410588 1060239738 /nfs/dbraw/zinc/23/97/38/1060239738.db2.gz ZIUHUNNZYWWGJC-ZDUSSCGKSA-N 1 2 321.415 4.234 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccc(C)nc2Br)cc1 ZINC001249418653 1060240268 /nfs/dbraw/zinc/24/02/68/1060240268.db2.gz ROJHIGGVTSQEMV-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccc(C)nc2Br)cc1 ZINC001249418653 1060240289 /nfs/dbraw/zinc/24/02/89/1060240289.db2.gz ROJHIGGVTSQEMV-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@H+](C)Cc2ccccc2C)c(Br)n1 ZINC001249418502 1060240737 /nfs/dbraw/zinc/24/07/37/1060240737.db2.gz MCSKJPUQGDEZJN-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1ccc(C[N@@H+](C)Cc2ccccc2C)c(Br)n1 ZINC001249418502 1060240754 /nfs/dbraw/zinc/24/07/54/1060240754.db2.gz MCSKJPUQGDEZJN-UHFFFAOYSA-N 1 2 319.246 4.093 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@@H+]2CCC[C@H]2c2cccnc2)cn1 ZINC001249512129 1060271622 /nfs/dbraw/zinc/27/16/22/1060271622.db2.gz FTPJBIYACKCJLE-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Cc1cc(C(F)(F)F)c(C[N@H+]2CCC[C@H]2c2cccnc2)cn1 ZINC001249512129 1060271640 /nfs/dbraw/zinc/27/16/40/1060271640.db2.gz FTPJBIYACKCJLE-INIZCTEOSA-N 1 2 321.346 4.141 20 0 DIADLO Fc1cc2cc[nH]c2c(C[N@@H+]2Cc3cccc(Cl)c3C2)c1 ZINC001249525450 1060276129 /nfs/dbraw/zinc/27/61/29/1060276129.db2.gz OIFJVANSNQDKSD-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO Fc1cc2cc[nH]c2c(C[N@H+]2Cc3cccc(Cl)c3C2)c1 ZINC001249525450 1060276147 /nfs/dbraw/zinc/27/61/47/1060276147.db2.gz OIFJVANSNQDKSD-UHFFFAOYSA-N 1 2 300.764 4.476 20 0 DIADLO COc1cc2ccccc2cc1Nc1ccc2c(c1)[nH+]cn2C ZINC001249549639 1060286730 /nfs/dbraw/zinc/28/67/30/1060286730.db2.gz AEFJKANXGRGVJB-UHFFFAOYSA-N 1 2 303.365 4.479 20 0 DIADLO Cc1cc(C)c(C(=O)NCCc2ccc(C(C)(C)C)cc2)c(C)[nH+]1 ZINC001526647561 1060289182 /nfs/dbraw/zinc/28/91/82/1060289182.db2.gz OQZJFVYHPUNKGV-UHFFFAOYSA-N 1 2 324.468 4.277 20 0 DIADLO FC(F)(F)c1c[nH+]ccc1Nc1ncc(-c2ccccc2)s1 ZINC001249582658 1060300318 /nfs/dbraw/zinc/30/03/18/1060300318.db2.gz DIOOQZWJTWPWGE-UHFFFAOYSA-N 1 2 321.327 4.389 20 0 DIADLO Nc1ccc(N(c2cc[nH+]cc2C(F)(F)F)C2CCCC2)nc1 ZINC001249586266 1060303211 /nfs/dbraw/zinc/30/32/11/1060303211.db2.gz AHTGRJUNIHLEJM-UHFFFAOYSA-N 1 2 322.334 4.158 20 0 DIADLO CN(C)c1[nH+]ccc2cc(NC(=O)/C=C\C3CCCCC3)ccc21 ZINC001526698423 1060304521 /nfs/dbraw/zinc/30/45/21/1060304521.db2.gz CKZOVWUAYTZJCU-FLIBITNWSA-N 1 2 323.440 4.376 20 0 DIADLO CCCn1c[nH+]cc1CNc1cc(OC)c(Cl)cc1C1CC1 ZINC001560518812 1060317121 /nfs/dbraw/zinc/31/71/21/1060317121.db2.gz JFBMSUXJGCQKDS-UHFFFAOYSA-N 1 2 319.836 4.445 20 0 DIADLO CC(C)(C)c1nc(CNc2c[nH+]cc3c2CCCC3)cs1 ZINC001560532355 1060333968 /nfs/dbraw/zinc/33/39/68/1060333968.db2.gz ZQXSCVVLRPXHCP-UHFFFAOYSA-N 1 2 301.459 4.327 20 0 DIADLO CC[C@H]1C[C@@H](CNc2ccc(Nc3ccccc3)c[nH+]2)CCO1 ZINC001560538785 1060343893 /nfs/dbraw/zinc/34/38/93/1060343893.db2.gz DSNVVPLWIQUFQR-YJBOKZPZSA-N 1 2 311.429 4.442 20 0 DIADLO Cn1cc(Nc2ccc([NH+]3CCCCC3)cc2)c2ccncc21 ZINC001249695090 1060353266 /nfs/dbraw/zinc/35/32/66/1060353266.db2.gz DWWQWJBUEUAITO-UHFFFAOYSA-N 1 2 306.413 4.307 20 0 DIADLO COc1cc(Br)ccc1NCc1cc(C)[nH+]c(C)c1 ZINC001560547131 1060354653 /nfs/dbraw/zinc/35/46/53/1060354653.db2.gz VRMIERMVOPESHA-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO Nc1ccc(Nc2cc[nH+]c3ccc(Cl)cc23)c(Cl)c1 ZINC001249729771 1060375157 /nfs/dbraw/zinc/37/51/57/1060375157.db2.gz WAOILRAMZAAELQ-UHFFFAOYSA-N 1 2 304.180 4.289 20 0 DIADLO CCCCn1nc(C)c(CNc2c[nH+]c(C)c(C)c2)c1Cl ZINC001560571418 1060383623 /nfs/dbraw/zinc/38/36/23/1060383623.db2.gz RSAZVTIOESQISF-UHFFFAOYSA-N 1 2 306.841 4.269 20 0 DIADLO COc1ccc(CNc2c[nH+]c(C)c(C)c2)cc1Br ZINC001560571433 1060385624 /nfs/dbraw/zinc/38/56/24/1060385624.db2.gz SSQDDKNJSYLGEH-UHFFFAOYSA-N 1 2 321.218 4.082 20 0 DIADLO Clc1ccc2[nH]c(NCc3cnn(-c4ccccc4)c3)[nH+]c2c1 ZINC001560579402 1060395092 /nfs/dbraw/zinc/39/50/92/1060395092.db2.gz KRRANFOPNOLANV-UHFFFAOYSA-N 1 2 323.787 4.014 20 0 DIADLO CC(C)Oc1cc(F)c(Nc2ccc3c(c2)[nH+]cn3C)c(F)c1 ZINC001249778350 1060396733 /nfs/dbraw/zinc/39/67/33/1060396733.db2.gz FXNBPZKHKNZUAT-UHFFFAOYSA-N 1 2 317.339 4.382 20 0 DIADLO COc1ccc(CNc2ccc3[nH+]c(C)cc(C)c3c2)cc1O ZINC001560590524 1060404596 /nfs/dbraw/zinc/40/45/96/1060404596.db2.gz WYOGMWOEHBGMPQ-UHFFFAOYSA-N 1 2 308.381 4.178 20 0 DIADLO COCc1cccc(CNc2[nH+]c3ccccc3n2CC2CC2)c1 ZINC001560595917 1060406856 /nfs/dbraw/zinc/40/68/56/1060406856.db2.gz RBTUGADWPKBICB-UHFFFAOYSA-N 1 2 321.424 4.205 20 0 DIADLO CC(C)(/C=C\Cl)[NH2+]Cc1nc(Cl)ccc1Br ZINC001560595013 1060407272 /nfs/dbraw/zinc/40/72/72/1060407272.db2.gz IYJWQXFGWLMKFF-WAYWQWQTSA-N 1 2 324.049 4.118 20 0 DIADLO CCCCc1ccc(NC(=S)Nc2cc[nH+]c(C)c2)c(C)c1 ZINC001249805694 1060409972 /nfs/dbraw/zinc/40/99/72/1060409972.db2.gz FJZPOVVIPWFWAL-UHFFFAOYSA-N 1 2 313.470 4.272 20 0 DIADLO Cc1c[nH+]c2cc(C(=O)O[C@@H](C)c3ccc(Cl)s3)ccn12 ZINC001527024338 1060416803 /nfs/dbraw/zinc/41/68/03/1060416803.db2.gz GWZLNIKEPYAQAP-JTQLQIEISA-N 1 2 320.801 4.276 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+][C@H](C)c1ncccc1C ZINC001560618186 1060428807 /nfs/dbraw/zinc/42/88/07/1060428807.db2.gz LKRWGISUQFDLOF-GFCCVEGCSA-N 1 2 313.426 4.266 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1ccc(SC)o1 ZINC001560623520 1060434273 /nfs/dbraw/zinc/43/42/73/1060434273.db2.gz ZQXTYXQZFUQTFZ-UHFFFAOYSA-N 1 2 305.378 4.122 20 0 DIADLO CC[NH+](CC)Cc1c(F)ccc(SC)c1Br ZINC001249878238 1060439229 /nfs/dbraw/zinc/43/92/29/1060439229.db2.gz UYQKFIHBDGDTFW-UHFFFAOYSA-N 1 2 306.244 4.152 20 0 DIADLO CSc1ccc(F)c(C[NH+]2CCCCC2)c1Br ZINC001249877554 1060439269 /nfs/dbraw/zinc/43/92/69/1060439269.db2.gz GGQLOBCSWLYWRA-UHFFFAOYSA-N 1 2 318.255 4.296 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2CCc3c(Cl)cccc3C2)cn1 ZINC001560629577 1060441393 /nfs/dbraw/zinc/44/13/93/1060441393.db2.gz VVBLOIVFQAZCTQ-UHFFFAOYSA-N 1 2 314.860 4.492 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2CCc3c(Cl)cccc3C2)cn1 ZINC001560629577 1060441399 /nfs/dbraw/zinc/44/13/99/1060441399.db2.gz VVBLOIVFQAZCTQ-UHFFFAOYSA-N 1 2 314.860 4.492 20 0 DIADLO CCOc1ccc(C[N@@H+]2CCc3c(Cl)cccc3C2)cc1F ZINC001560629169 1060441719 /nfs/dbraw/zinc/44/17/19/1060441719.db2.gz GWSFUPSXWDZGGI-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CCOc1ccc(C[N@H+]2CCc3c(Cl)cccc3C2)cc1F ZINC001560629169 1060441722 /nfs/dbraw/zinc/44/17/22/1060441722.db2.gz GWSFUPSXWDZGGI-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO COc1ccc(F)c(C[N@H+](C)Cc2ccc(Cl)c(F)c2)c1 ZINC001560643516 1060464555 /nfs/dbraw/zinc/46/45/55/1060464555.db2.gz OMQXRPBBQXASAE-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccc(F)c(C[N@@H+](C)Cc2ccc(Cl)c(F)c2)c1 ZINC001560643516 1060464564 /nfs/dbraw/zinc/46/45/64/1060464564.db2.gz OMQXRPBBQXASAE-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO Cc1[nH]nc(C[N@@H+]2CCCCC[C@H]2/C=C/c2ccccc2)c1C ZINC001560649054 1060472846 /nfs/dbraw/zinc/47/28/46/1060472846.db2.gz YZHXIVVIPPADDD-HYSAVQALSA-N 1 2 309.457 4.485 20 0 DIADLO Cc1[nH]nc(C[N@H+]2CCCCC[C@H]2/C=C/c2ccccc2)c1C ZINC001560649054 1060472852 /nfs/dbraw/zinc/47/28/52/1060472852.db2.gz YZHXIVVIPPADDD-HYSAVQALSA-N 1 2 309.457 4.485 20 0 DIADLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)nc1C ZINC001249914467 1060477852 /nfs/dbraw/zinc/47/78/52/1060477852.db2.gz UWFJJCGHXKJCTC-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)nc1C ZINC001249914467 1060477867 /nfs/dbraw/zinc/47/78/67/1060477867.db2.gz UWFJJCGHXKJCTC-QGZVFWFLSA-N 1 2 318.367 4.014 20 0 DIADLO Cc1cc(NC(=O)OC(C)(C)C)ccc1Nc1[nH+]cccc1N ZINC001249919302 1060482548 /nfs/dbraw/zinc/48/25/48/1060482548.db2.gz DEYBPTRRLNSWHC-UHFFFAOYSA-N 1 2 314.389 4.063 20 0 DIADLO Fc1ccccc1[C@H]1C[N@H+](Cc2cccc(C3CC3)c2)CCO1 ZINC001560659755 1060482843 /nfs/dbraw/zinc/48/28/43/1060482843.db2.gz SDFSBPHSKJAAOX-HXUWFJFHSA-N 1 2 311.400 4.277 20 0 DIADLO Fc1ccccc1[C@H]1C[N@@H+](Cc2cccc(C3CC3)c2)CCO1 ZINC001560659755 1060482854 /nfs/dbraw/zinc/48/28/54/1060482854.db2.gz SDFSBPHSKJAAOX-HXUWFJFHSA-N 1 2 311.400 4.277 20 0 DIADLO c1coc(-c2ccc(Nc3cccc(-n4cc[nH+]c4)c3)cc2)n1 ZINC001249928687 1060485420 /nfs/dbraw/zinc/48/54/20/1060485420.db2.gz OAXMUDJMBQYXNE-UHFFFAOYSA-N 1 2 302.337 4.271 20 0 DIADLO c1coc(-c2ccc(Nc3cccc(Cn4cc[nH+]c4)c3)cc2)n1 ZINC001249930438 1060489946 /nfs/dbraw/zinc/48/99/46/1060489946.db2.gz YQCWWSRMPQYQSN-UHFFFAOYSA-N 1 2 316.364 4.330 20 0 DIADLO COC[C@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1F ZINC001249933748 1060493084 /nfs/dbraw/zinc/49/30/84/1060493084.db2.gz NIRIMWNVOLUAOR-GFCCVEGCSA-N 1 2 306.208 4.133 20 0 DIADLO COC[C@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1F ZINC001249933748 1060493095 /nfs/dbraw/zinc/49/30/95/1060493095.db2.gz NIRIMWNVOLUAOR-GFCCVEGCSA-N 1 2 306.208 4.133 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC001249945893 1060499201 /nfs/dbraw/zinc/49/92/01/1060499201.db2.gz VZDJFEDRLQUELR-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO Fc1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC001249945893 1060499220 /nfs/dbraw/zinc/49/92/20/1060499220.db2.gz VZDJFEDRLQUELR-GFCCVEGCSA-N 1 2 310.146 4.364 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+](Cc1cn(C)nc1Cl)C1CC1 ZINC001560679912 1060521399 /nfs/dbraw/zinc/52/13/99/1060521399.db2.gz CXEGAFMULHDUSY-LLVKDONJSA-N 1 2 324.255 4.453 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](Cc1cn(C)nc1Cl)C1CC1 ZINC001560679912 1060521422 /nfs/dbraw/zinc/52/14/22/1060521422.db2.gz CXEGAFMULHDUSY-LLVKDONJSA-N 1 2 324.255 4.453 20 0 DIADLO Clc1ncc(C[NH+]2C[C@@H]3CCC[C@H]3C2)c(Cl)c1Cl ZINC001250017636 1060542432 /nfs/dbraw/zinc/54/24/32/1060542432.db2.gz GIDQVNJETQHFNP-IUCAKERBSA-N 1 2 305.636 4.274 20 0 DIADLO CCOc1cc(F)cc(C[N@@H+]2CCc3cccc(F)c3[C@@H]2C)c1 ZINC001560693038 1060542999 /nfs/dbraw/zinc/54/29/99/1060542999.db2.gz UTSQWYQSFDAMMS-ZDUSSCGKSA-N 1 2 317.379 4.483 20 0 DIADLO CCOc1cc(F)cc(C[N@H+]2CCc3cccc(F)c3[C@@H]2C)c1 ZINC001560693038 1060543017 /nfs/dbraw/zinc/54/30/17/1060543017.db2.gz UTSQWYQSFDAMMS-ZDUSSCGKSA-N 1 2 317.379 4.483 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1cccc(F)c1N ZINC001560693716 1060547509 /nfs/dbraw/zinc/54/75/09/1060547509.db2.gz FVTUXORCCPNMFS-NSHDSACASA-N 1 2 315.417 4.211 20 0 DIADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cccc(F)c1N ZINC001560693716 1060547520 /nfs/dbraw/zinc/54/75/20/1060547520.db2.gz FVTUXORCCPNMFS-NSHDSACASA-N 1 2 315.417 4.211 20 0 DIADLO COc1cc(C)c(Nc2cccc(Cn3cc[nH+]c3)c2)c(C)c1 ZINC001250035255 1060558941 /nfs/dbraw/zinc/55/89/41/1060558941.db2.gz MCGQBARUSGUZHP-UHFFFAOYSA-N 1 2 307.397 4.300 20 0 DIADLO c1cn(-c2cccc(NC[C@H]3CCc4ccccc4C3)c2)c[nH+]1 ZINC001560703781 1060561210 /nfs/dbraw/zinc/56/12/10/1060561210.db2.gz MQSJQCHEMQTORY-INIZCTEOSA-N 1 2 303.409 4.089 20 0 DIADLO C[N@H+](Cc1ccco1)Cc1cccc(Br)c1Cl ZINC001560713375 1060569092 /nfs/dbraw/zinc/56/90/92/1060569092.db2.gz QIDNPQUAIVMEIX-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO C[N@@H+](Cc1ccco1)Cc1cccc(Br)c1Cl ZINC001560713375 1060569113 /nfs/dbraw/zinc/56/91/13/1060569113.db2.gz QIDNPQUAIVMEIX-UHFFFAOYSA-N 1 2 314.610 4.328 20 0 DIADLO C[C@H]([NH2+][C@H]1CCCC[C@H]1c1ccccc1)C(=O)OC(C)(C)C ZINC001560712598 1060570243 /nfs/dbraw/zinc/57/02/43/1060570243.db2.gz OVKGTKKRRBAHOC-XIRDDKMYSA-N 1 2 303.446 4.033 20 0 DIADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cccc(Oc2ccccn2)c1 ZINC001560720336 1060581062 /nfs/dbraw/zinc/58/10/62/1060581062.db2.gz RLYOBGBPHMTUNA-INIZCTEOSA-N 1 2 319.408 4.252 20 0 DIADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cccc(Oc2ccccn2)c1 ZINC001560720336 1060581080 /nfs/dbraw/zinc/58/10/80/1060581080.db2.gz RLYOBGBPHMTUNA-INIZCTEOSA-N 1 2 319.408 4.252 20 0 DIADLO CCOc1ccc(C[N@H+](C)Cc2c(F)cccc2OCC)cc1 ZINC001560724267 1060588876 /nfs/dbraw/zinc/58/88/76/1060588876.db2.gz DZNDRMBOWHFIHZ-UHFFFAOYSA-N 1 2 317.404 4.255 20 0 DIADLO CCOc1ccc(C[N@@H+](C)Cc2c(F)cccc2OCC)cc1 ZINC001560724267 1060588889 /nfs/dbraw/zinc/58/88/89/1060588889.db2.gz DZNDRMBOWHFIHZ-UHFFFAOYSA-N 1 2 317.404 4.255 20 0 DIADLO COc1c(Cl)ccc(F)c1Nc1ccc[nH+]c1N1CCCC1 ZINC001250099785 1060607730 /nfs/dbraw/zinc/60/77/30/1060607730.db2.gz VSISGUAWWHMELV-UHFFFAOYSA-N 1 2 321.783 4.227 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)c(F)c1 ZINC001250146635 1060645522 /nfs/dbraw/zinc/64/55/22/1060645522.db2.gz BZPURHMXAFZQJF-SNVBAGLBSA-N 1 2 323.305 4.136 20 0 DIADLO CC(C)Oc1cc(F)c(C[N@H+]2CC[C@@H](C(F)(F)F)C2)c(F)c1 ZINC001250146635 1060645533 /nfs/dbraw/zinc/64/55/33/1060645533.db2.gz BZPURHMXAFZQJF-SNVBAGLBSA-N 1 2 323.305 4.136 20 0 DIADLO Cn1ncc(C[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)c1Cl ZINC001560792437 1060651028 /nfs/dbraw/zinc/65/10/28/1060651028.db2.gz JCLAJOXHRRUJDD-OAHLLOKOSA-N 1 2 324.255 4.454 20 0 DIADLO Cn1ncc(C[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)c1Cl ZINC001560792437 1060651036 /nfs/dbraw/zinc/65/10/36/1060651036.db2.gz JCLAJOXHRRUJDD-OAHLLOKOSA-N 1 2 324.255 4.454 20 0 DIADLO CCCC[C@@H](CC)Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001560798287 1060658748 /nfs/dbraw/zinc/65/87/48/1060658748.db2.gz CGNNQJBUQXRRQG-OWCLPIDISA-N 1 2 305.466 4.076 20 0 DIADLO CCCCCC[C@H](C)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)[nH+]c1 ZINC001560798369 1060659090 /nfs/dbraw/zinc/65/90/90/1060659090.db2.gz FOBFBGLKYFPAJM-ULQDDVLXSA-N 1 2 319.493 4.466 20 0 DIADLO CCOc1c(Cl)cccc1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC001560802634 1060664290 /nfs/dbraw/zinc/66/42/90/1060664290.db2.gz AIVLGXDMDWTAKH-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO CCOc1c(Cl)cccc1C[N@H+]1CCOC2(CCCCC2)C1 ZINC001560802634 1060664296 /nfs/dbraw/zinc/66/42/96/1060664296.db2.gz AIVLGXDMDWTAKH-UHFFFAOYSA-N 1 2 323.864 4.274 20 0 DIADLO COc1ccc(Cl)cc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001250204727 1060684633 /nfs/dbraw/zinc/68/46/33/1060684633.db2.gz NWGDFCKFMGQGJM-UHFFFAOYSA-N 1 2 308.168 4.393 20 0 DIADLO CCn1cc(C[N@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)nn1 ZINC001560852677 1060710133 /nfs/dbraw/zinc/71/01/33/1060710133.db2.gz LKPYJXQCIJHKNV-KRWDZBQOSA-N 1 2 320.440 4.061 20 0 DIADLO CCn1cc(C[N@@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)nn1 ZINC001560852677 1060710147 /nfs/dbraw/zinc/71/01/47/1060710147.db2.gz LKPYJXQCIJHKNV-KRWDZBQOSA-N 1 2 320.440 4.061 20 0 DIADLO Fc1cc(Cc2ccc(N3CCCCC3)[nH+]c2)cc(F)c1F ZINC001250233262 1060713408 /nfs/dbraw/zinc/71/34/08/1060713408.db2.gz XXQLETZIPFFZQN-UHFFFAOYSA-N 1 2 306.331 4.080 20 0 DIADLO CCOc1cccc(F)c1C[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001560860958 1060718971 /nfs/dbraw/zinc/71/89/71/1060718971.db2.gz AEQCUUAJXKLYOH-CQSZACIVSA-N 1 2 315.388 4.008 20 0 DIADLO CCOc1cccc(F)c1C[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001560860958 1060718987 /nfs/dbraw/zinc/71/89/87/1060718987.db2.gz AEQCUUAJXKLYOH-CQSZACIVSA-N 1 2 315.388 4.008 20 0 DIADLO CCCCO[C@@H]1C[C@@H]([NH2+]CC(F)(F)c2ccccc2)C1(C)C ZINC001560871040 1060733188 /nfs/dbraw/zinc/73/31/88/1060733188.db2.gz WXEVNSCCZPIXHL-HZPDHXFCSA-N 1 2 311.416 4.352 20 0 DIADLO COc1cc(Nc2cc(OC)c(Cl)c(F)c2F)[nH+]cc1C ZINC001250266719 1060742394 /nfs/dbraw/zinc/74/23/94/1060742394.db2.gz YIALPBASENMISV-UHFFFAOYSA-N 1 2 314.719 4.082 20 0 DIADLO COc1cc(Nc2ccn3cc[nH+]c3c2)c(F)c(F)c1Cl ZINC001250266240 1060743455 /nfs/dbraw/zinc/74/34/55/1060743455.db2.gz BVFHIHHHQYPSNC-UHFFFAOYSA-N 1 2 309.703 4.018 20 0 DIADLO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)cc1F ZINC001560885142 1060746602 /nfs/dbraw/zinc/74/66/02/1060746602.db2.gz TVPUYGJTQCHAJJ-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO Oc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2F)cc1F ZINC001560885142 1060746614 /nfs/dbraw/zinc/74/66/14/1060746614.db2.gz TVPUYGJTQCHAJJ-MRXNPFEDSA-N 1 2 307.315 4.147 20 0 DIADLO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1cc(Br)cnc1Cl ZINC001560888555 1060752122 /nfs/dbraw/zinc/75/21/22/1060752122.db2.gz GOLUVZJXSHELCY-SECBINFHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CC(C)(C)C[N@H+]1Cc1cc(Br)cnc1Cl ZINC001560888555 1060752141 /nfs/dbraw/zinc/75/21/41/1060752141.db2.gz GOLUVZJXSHELCY-SECBINFHSA-N 1 2 317.658 4.118 20 0 DIADLO CCOc1ccc(Cl)cc1C[NH+]1C[C@@H](CC)O[C@H](CC)C1 ZINC001560894314 1060756168 /nfs/dbraw/zinc/75/61/68/1060756168.db2.gz IDRWGMYMDCDLBM-HZPDHXFCSA-N 1 2 311.853 4.128 20 0 DIADLO CC[C@@H]([NH2+][C@@H](C)CCc1cccc(C)c1)C(=O)OC(C)(C)C ZINC001560903894 1060768376 /nfs/dbraw/zinc/76/83/76/1060768376.db2.gz HLARAFBPEMUIMN-DOTOQJQBSA-N 1 2 305.462 4.026 20 0 DIADLO CCOc1cc(C[N@@H+]2CC[C@H]2c2ccccc2)c(Cl)cn1 ZINC001250319187 1060778434 /nfs/dbraw/zinc/77/84/34/1060778434.db2.gz PBFDMEDSAKYCEQ-INIZCTEOSA-N 1 2 302.805 4.081 20 0 DIADLO CCOc1cc(C[N@H+]2CC[C@H]2c2ccccc2)c(Cl)cn1 ZINC001250319187 1060778446 /nfs/dbraw/zinc/77/84/46/1060778446.db2.gz PBFDMEDSAKYCEQ-INIZCTEOSA-N 1 2 302.805 4.081 20 0 DIADLO CCOc1nccc(C[N@H+]2Cc3ccccc3[C@H](C)C2)c1Cl ZINC001250361779 1060789348 /nfs/dbraw/zinc/78/93/48/1060789348.db2.gz YKCWARLOFCDGSC-CYBMUJFWSA-N 1 2 316.832 4.253 20 0 DIADLO CCOc1nccc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c1Cl ZINC001250361779 1060789360 /nfs/dbraw/zinc/78/93/60/1060789360.db2.gz YKCWARLOFCDGSC-CYBMUJFWSA-N 1 2 316.832 4.253 20 0 DIADLO Cc1ccc(C)c(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)c1 ZINC001250459323 1060820279 /nfs/dbraw/zinc/82/02/79/1060820279.db2.gz ROZVITWPMBPZQP-UHFFFAOYSA-N 1 2 306.344 4.172 20 0 DIADLO C[C@@H]1CCC[N@H+](Cc2cncc(Br)c2Cl)[C@@H]1C ZINC001250464985 1060821736 /nfs/dbraw/zinc/82/17/36/1060821736.db2.gz PBXXLCBSMHWLAK-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCC[N@@H+](Cc2cncc(Br)c2Cl)[C@@H]1C ZINC001250464985 1060821745 /nfs/dbraw/zinc/82/17/45/1060821745.db2.gz PBXXLCBSMHWLAK-NXEZZACHSA-N 1 2 317.658 4.118 20 0 DIADLO C[C@@H]1CCCCC[N@@H+]1Cc1cncc(Br)c1Cl ZINC001250467549 1060827233 /nfs/dbraw/zinc/82/72/33/1060827233.db2.gz MEAQIWZUSCZPGF-SNVBAGLBSA-N 1 2 317.658 4.262 20 0 DIADLO C[C@@H]1CCCCC[N@H+]1Cc1cncc(Br)c1Cl ZINC001250467549 1060827235 /nfs/dbraw/zinc/82/72/35/1060827235.db2.gz MEAQIWZUSCZPGF-SNVBAGLBSA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@H]1CCCC[N@@H+]1Cc1cncc(Br)c1Cl ZINC001250470038 1060830446 /nfs/dbraw/zinc/83/04/46/1060830446.db2.gz JZTYINYKMLXBFP-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO CC[C@H]1CCCC[N@H+]1Cc1cncc(Br)c1Cl ZINC001250470038 1060830461 /nfs/dbraw/zinc/83/04/61/1060830461.db2.gz JZTYINYKMLXBFP-NSHDSACASA-N 1 2 317.658 4.262 20 0 DIADLO Cn1cc(-c2[nH]c3ccc(N4CCCC4)cc3[nH+]2)c2ccccc21 ZINC001250490107 1060845669 /nfs/dbraw/zinc/84/56/69/1060845669.db2.gz RXKMSYGZTCPQEP-UHFFFAOYSA-N 1 2 316.408 4.322 20 0 DIADLO Cc1c(F)cccc1-c1nc2cc(-n3cc[nH+]c3)c(F)cc2[nH]1 ZINC001250494718 1060847331 /nfs/dbraw/zinc/84/73/31/1060847331.db2.gz QWBJYGYPGDXYIU-UHFFFAOYSA-N 1 2 310.307 4.002 20 0 DIADLO Cc1cccc(-c2nc3cc(-n4cc[nH+]c4)c(F)cc3[nH]2)c1C ZINC001250502464 1060855373 /nfs/dbraw/zinc/85/53/73/1060855373.db2.gz ZLBQFCHTRHEGPQ-UHFFFAOYSA-N 1 2 306.344 4.172 20 0 DIADLO c1cc2cc(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)ccc2[nH]1 ZINC001250506621 1060858528 /nfs/dbraw/zinc/85/85/28/1060858528.db2.gz UIORYIRNDDNCMQ-UHFFFAOYSA-N 1 2 302.381 4.311 20 0 DIADLO COCOc1ccc2[nH]c(C[C@@H]3CC=C(C)C3(C)C)[nH+]c2c1 ZINC001250542443 1060885150 /nfs/dbraw/zinc/88/51/50/1060885150.db2.gz YUHWUPCNQGDQNM-ZDUSSCGKSA-N 1 2 300.402 4.081 20 0 DIADLO CCOc1cc(F)cc(C[N@@H+]2CC[C@@H]2c2ccc(F)cc2)c1 ZINC001561035247 1060888109 /nfs/dbraw/zinc/88/81/09/1060888109.db2.gz QWMMNQPDWAZJDT-GOSISDBHSA-N 1 2 303.352 4.311 20 0 DIADLO CCOc1cc(F)cc(C[N@H+]2CC[C@@H]2c2ccc(F)cc2)c1 ZINC001561035247 1060888112 /nfs/dbraw/zinc/88/81/12/1060888112.db2.gz QWMMNQPDWAZJDT-GOSISDBHSA-N 1 2 303.352 4.311 20 0 DIADLO Fc1ccc(C[NH+]2CC(Cc3ccoc3)C2)cc1C(F)(F)F ZINC001561037509 1060891295 /nfs/dbraw/zinc/89/12/95/1060891295.db2.gz KXOMHZPYWTWOIQ-UHFFFAOYSA-N 1 2 313.294 4.112 20 0 DIADLO COc1cc2[nH+]c(CCc3ccc(Cl)cc3)[nH]c2cc1F ZINC001250554303 1060894036 /nfs/dbraw/zinc/89/40/36/1060894036.db2.gz ZNJZOJWKVPPLQN-UHFFFAOYSA-N 1 2 304.752 4.149 20 0 DIADLO COc1cc2[nH]c(CCc3ccc(Cl)cc3)[nH+]c2cc1F ZINC001250554303 1060894047 /nfs/dbraw/zinc/89/40/47/1060894047.db2.gz ZNJZOJWKVPPLQN-UHFFFAOYSA-N 1 2 304.752 4.149 20 0 DIADLO C[C@H](CCCC(C)(C)O)Cc1[nH]c2cc3c(cc2[nH+]1)CCC3 ZINC001250556619 1060896295 /nfs/dbraw/zinc/89/62/95/1060896295.db2.gz OBVYOFNNXMEQTD-CYBMUJFWSA-N 1 2 300.446 4.171 20 0 DIADLO COC(C)(C)CCC[C@H](C)Cc1[nH]c2cc3c(cc2[nH+]1)OCC3 ZINC001250567049 1060902824 /nfs/dbraw/zinc/90/28/24/1060902824.db2.gz FUYMUMGXXSGFBW-ZDUSSCGKSA-N 1 2 316.445 4.272 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@@H+](C/C=C/c1ccc(F)c(F)c1)C2 ZINC001561054939 1060904290 /nfs/dbraw/zinc/90/42/90/1060904290.db2.gz PRLRFVCPAIYZLR-OWOJBTEDSA-N 1 2 321.317 4.315 20 0 DIADLO Fc1cc(F)c2c(c1)CC[N@H+](C/C=C/c1ccc(F)c(F)c1)C2 ZINC001561054939 1060904300 /nfs/dbraw/zinc/90/43/00/1060904300.db2.gz PRLRFVCPAIYZLR-OWOJBTEDSA-N 1 2 321.317 4.315 20 0 DIADLO CCOc1cc2[nH]c(Cc3cccc(F)c3)[nH+]c2cc1OCC ZINC001250566775 1060904579 /nfs/dbraw/zinc/90/45/79/1060904579.db2.gz CQUYNZUEGHSKIC-UHFFFAOYSA-N 1 2 314.360 4.090 20 0 DIADLO Cn1c(CC(C)(C)c2ccccc2)[nH+]c2ccc(F)c(F)c21 ZINC001250573276 1060908669 /nfs/dbraw/zinc/90/86/69/1060908669.db2.gz ZYXVGTQYPDHYHR-UHFFFAOYSA-N 1 2 300.352 4.372 20 0 DIADLO COc1ccccc1CCc1[nH]c2ccc(Cl)c(C)c2[nH+]1 ZINC001250583321 1060918251 /nfs/dbraw/zinc/91/82/51/1060918251.db2.gz DFZYIQLXXNEFNT-UHFFFAOYSA-N 1 2 300.789 4.319 20 0 DIADLO c1ccc(COCCCCc2[nH]c3cc4c(cc3[nH+]2)OCC4)cc1 ZINC001250584334 1060920057 /nfs/dbraw/zinc/92/00/57/1060920057.db2.gz XFHRIAOEXAIRSA-UHFFFAOYSA-N 1 2 322.408 4.037 20 0 DIADLO COc1ccc2[nH+]c(CCCCOCc3ccccc3)n(C)c2c1 ZINC001250584035 1060920226 /nfs/dbraw/zinc/92/02/26/1060920226.db2.gz VGZHGFPVWMCQQR-UHFFFAOYSA-N 1 2 324.424 4.121 20 0 DIADLO FC(F)(F)c1ccc(Cc2[nH]c3cc4c(cc3[nH+]2)OCC4)cc1 ZINC001250594920 1060929041 /nfs/dbraw/zinc/92/90/41/1060929041.db2.gz YIVWUAUNOCXOHM-UHFFFAOYSA-N 1 2 318.298 4.107 20 0 DIADLO COC(=O)CCCCCCCCc1[nH]c2c(cccc2C)[nH+]1 ZINC001250597269 1060930062 /nfs/dbraw/zinc/93/00/62/1060930062.db2.gz NVNYOOHDJPCTPW-UHFFFAOYSA-N 1 2 302.418 4.318 20 0 DIADLO COC(=O)CCCCCCCCc1[nH]c2cccc(C)c2[nH+]1 ZINC001250597269 1060930071 /nfs/dbraw/zinc/93/00/71/1060930071.db2.gz NVNYOOHDJPCTPW-UHFFFAOYSA-N 1 2 302.418 4.318 20 0 DIADLO CC[C@]1(C)COCC[N@@H+]1Cc1ccc(Oc2ccccc2)o1 ZINC001462128018 1060948658 /nfs/dbraw/zinc/94/86/58/1060948658.db2.gz RFJOCOKRKKYGEX-GOSISDBHSA-N 1 2 301.386 4.073 20 0 DIADLO CC[C@]1(C)COCC[N@H+]1Cc1ccc(Oc2ccccc2)o1 ZINC001462128018 1060948679 /nfs/dbraw/zinc/94/86/79/1060948679.db2.gz RFJOCOKRKKYGEX-GOSISDBHSA-N 1 2 301.386 4.073 20 0 DIADLO Cc1conc1C[N@H+](CCc1ccc(C)cc1)Cc1ccco1 ZINC001473200538 1060957686 /nfs/dbraw/zinc/95/76/86/1060957686.db2.gz GEKLTZVXCHGFDW-UHFFFAOYSA-N 1 2 310.397 4.129 20 0 DIADLO Cc1conc1C[N@@H+](CCc1ccc(C)cc1)Cc1ccco1 ZINC001473200538 1060957708 /nfs/dbraw/zinc/95/77/08/1060957708.db2.gz GEKLTZVXCHGFDW-UHFFFAOYSA-N 1 2 310.397 4.129 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@H+](Cc2c(Cl)n[nH]c2C2CC2)C1 ZINC001462142892 1060965609 /nfs/dbraw/zinc/96/56/09/1060965609.db2.gz AOTIHDSLKFIBFS-QGZVFWFLSA-N 1 2 319.811 4.011 20 0 DIADLO F[C@]1(c2ccccc2)CC[N@@H+](Cc2c(Cl)n[nH]c2C2CC2)C1 ZINC001462142892 1060965633 /nfs/dbraw/zinc/96/56/33/1060965633.db2.gz AOTIHDSLKFIBFS-QGZVFWFLSA-N 1 2 319.811 4.011 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@@H+]1C/C=C\c1cccc(F)c1 ZINC001462152981 1060974860 /nfs/dbraw/zinc/97/48/60/1060974860.db2.gz CZIWQBQYOVQCTI-XOWYPZSQSA-N 1 2 313.420 4.283 20 0 DIADLO CCn1ccnc1[C@H]1CCCC[N@H+]1C/C=C\c1cccc(F)c1 ZINC001462152981 1060974878 /nfs/dbraw/zinc/97/48/78/1060974878.db2.gz CZIWQBQYOVQCTI-XOWYPZSQSA-N 1 2 313.420 4.283 20 0 DIADLO CC[C@@H](CC(F)F)C[N@@H+]1CCCC[C@H]1c1noc(C(C)C)n1 ZINC001473207083 1060976085 /nfs/dbraw/zinc/97/60/85/1060976085.db2.gz XFOZHEKUIFCCKY-STQMWFEESA-N 1 2 315.408 4.401 20 0 DIADLO CC[C@@H](CC(F)F)C[N@H+]1CCCC[C@H]1c1noc(C(C)C)n1 ZINC001473207083 1060976108 /nfs/dbraw/zinc/97/61/08/1060976108.db2.gz XFOZHEKUIFCCKY-STQMWFEESA-N 1 2 315.408 4.401 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@@H+]1C/C=C\c1cccc(F)c1 ZINC001462152976 1060975913 /nfs/dbraw/zinc/97/59/13/1060975913.db2.gz CZIWQBQYOVQCTI-POZKEBTKSA-N 1 2 313.420 4.283 20 0 DIADLO CCn1ccnc1[C@@H]1CCCC[N@H+]1C/C=C\c1cccc(F)c1 ZINC001462152976 1060975932 /nfs/dbraw/zinc/97/59/32/1060975932.db2.gz CZIWQBQYOVQCTI-POZKEBTKSA-N 1 2 313.420 4.283 20 0 DIADLO c1cnc2ccc(-c3[nH]c4ccc(N5CCCC5)cc4[nH+]3)cc2c1 ZINC001250681466 1061011098 /nfs/dbraw/zinc/01/10/98/1061011098.db2.gz VRSDVUIQTOMIBW-UHFFFAOYSA-N 1 2 314.392 4.378 20 0 DIADLO CC(C)CCCCNc1[nH+]cccc1CNC(=O)OC(C)(C)C ZINC001462254784 1061058341 /nfs/dbraw/zinc/05/83/41/1061058341.db2.gz VIUCGOZDTRFYRR-UHFFFAOYSA-N 1 2 321.465 4.345 20 0 DIADLO Fc1cc(Cl)cc2[nH]c(-c3ccc(-n4cc[nH+]c4)cc3)nc21 ZINC001250772531 1061063017 /nfs/dbraw/zinc/06/30/17/1061063017.db2.gz XYDYHGYZSLITIX-UHFFFAOYSA-N 1 2 312.735 4.208 20 0 DIADLO C[C@@H]1C[N@H+](Cc2cc(C(F)(F)F)ccc2Br)[C@H]1C ZINC001462280035 1061073388 /nfs/dbraw/zinc/07/33/88/1061073388.db2.gz DOMDGDVERYYDRR-BDAKNGLRSA-N 1 2 322.168 4.308 20 0 DIADLO C[C@@H]1C[N@@H+](Cc2cc(C(F)(F)F)ccc2Br)[C@H]1C ZINC001462280035 1061073405 /nfs/dbraw/zinc/07/34/05/1061073405.db2.gz DOMDGDVERYYDRR-BDAKNGLRSA-N 1 2 322.168 4.308 20 0 DIADLO CCNc1nc(C[NH2+][C@H](C)c2cc(Cl)ccc2F)cs1 ZINC001473309003 1061074092 /nfs/dbraw/zinc/07/40/92/1061074092.db2.gz BEZSNHONBGVOQD-SECBINFHSA-N 1 2 313.829 4.218 20 0 DIADLO CCOC(=O)[C@@H](CC(C)C)[NH2+][C@@H](c1ccccc1C)C1CC1 ZINC001473314727 1061079474 /nfs/dbraw/zinc/07/94/74/1061079474.db2.gz ZVMIMZWTBCJIQI-QZTJIDSGSA-N 1 2 303.446 4.014 20 0 DIADLO CO[C@H]1CCC[C@H](Nc2ccc(-n3c[nH+]c(C)c3C)cc2)CC1 ZINC001462290163 1061080804 /nfs/dbraw/zinc/08/08/04/1061080804.db2.gz FSPPUBWHOIAXJI-LPHOPBHVSA-N 1 2 313.445 4.249 20 0 DIADLO COc1ccc(F)cc1C[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC001462309578 1061096758 /nfs/dbraw/zinc/09/67/58/1061096758.db2.gz YOJQNDMGXKXABV-INIZCTEOSA-N 1 2 305.418 4.479 20 0 DIADLO COc1ccc(F)cc1C[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC001462309578 1061096775 /nfs/dbraw/zinc/09/67/75/1061096775.db2.gz YOJQNDMGXKXABV-INIZCTEOSA-N 1 2 305.418 4.479 20 0 DIADLO CCCCCOC1C[NH+](Cc2ccc(C(F)(F)F)cc2C)C1 ZINC001462316810 1061102672 /nfs/dbraw/zinc/10/26/72/1061102672.db2.gz RSCIXIOGDKWCPR-UHFFFAOYSA-N 1 2 315.379 4.405 20 0 DIADLO CN(CC[N@H+](C)Cc1ccc(Cl)c(F)c1)Cc1ccccc1 ZINC001473349597 1061106581 /nfs/dbraw/zinc/10/65/81/1061106581.db2.gz HKJBWKSRTVAMQH-UHFFFAOYSA-N 1 2 320.839 4.043 20 0 DIADLO CN(CC[N@@H+](C)Cc1ccc(Cl)c(F)c1)Cc1ccccc1 ZINC001473349597 1061106590 /nfs/dbraw/zinc/10/65/90/1061106590.db2.gz HKJBWKSRTVAMQH-UHFFFAOYSA-N 1 2 320.839 4.043 20 0 DIADLO Cc1ccc([C@@H](CC(F)(F)F)[NH2+]Cc2cscn2)cc1 ZINC001473354492 1061108865 /nfs/dbraw/zinc/10/88/65/1061108865.db2.gz KHYDGLMCKTTYIB-CYBMUJFWSA-N 1 2 300.349 4.235 20 0 DIADLO C[C@H](c1ccccn1)[N@H+](C)Cc1coc(-c2ccccc2F)n1 ZINC001473352888 1061109716 /nfs/dbraw/zinc/10/97/16/1061109716.db2.gz QSEPBZLSUQOYDL-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1coc(-c2ccccc2F)n1 ZINC001473352888 1061109724 /nfs/dbraw/zinc/10/97/24/1061109724.db2.gz QSEPBZLSUQOYDL-CYBMUJFWSA-N 1 2 311.360 4.069 20 0 DIADLO CCc1ccc([C@H](COC)[NH2+]Cc2c(C)cccc2Cl)o1 ZINC001473367220 1061115839 /nfs/dbraw/zinc/11/58/39/1061115839.db2.gz PFUPHHKRQWNZON-INIZCTEOSA-N 1 2 307.821 4.281 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@@H+]1Cc1c(F)ccc(O)c1F ZINC001462340798 1061118152 /nfs/dbraw/zinc/11/81/52/1061118152.db2.gz QWHKYDHNJXEIFV-MRXNPFEDSA-N 1 2 321.342 4.455 20 0 DIADLO Cc1cc(F)ccc1[C@H]1CCC[N@H+]1Cc1c(F)ccc(O)c1F ZINC001462340798 1061118158 /nfs/dbraw/zinc/11/81/58/1061118158.db2.gz QWHKYDHNJXEIFV-MRXNPFEDSA-N 1 2 321.342 4.455 20 0 DIADLO CC[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ncsc1Br ZINC001473387639 1061129482 /nfs/dbraw/zinc/12/94/82/1061129482.db2.gz AUCIMQOSKKYFCV-CMPLNLGQSA-N 1 2 317.296 4.306 20 0 DIADLO CC[C@H]1CCCC[C@H]1[N@H+](C)Cc1ncsc1Br ZINC001473387639 1061129473 /nfs/dbraw/zinc/12/94/73/1061129473.db2.gz AUCIMQOSKKYFCV-CMPLNLGQSA-N 1 2 317.296 4.306 20 0 DIADLO CCCn1c(-c2ccn3cc[nH+]c3c2)nc2cccc(Cl)c21 ZINC001250928071 1061129583 /nfs/dbraw/zinc/12/95/83/1061129583.db2.gz UINYRRXRRCOMIC-UHFFFAOYSA-N 1 2 310.788 4.414 20 0 DIADLO c1cn(-c2cccc(-c3nc4ccccc4n3CC3CC3)c2)c[nH+]1 ZINC001250940227 1061136732 /nfs/dbraw/zinc/13/67/32/1061136732.db2.gz FYXHSBWSGJNQRB-UHFFFAOYSA-N 1 2 314.392 4.299 20 0 DIADLO Cc1ccc(C[N@@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)cc1C ZINC001473402569 1061139356 /nfs/dbraw/zinc/13/93/56/1061139356.db2.gz LDAPXNRLLVQPSW-LJQANCHMSA-N 1 2 317.379 4.155 20 0 DIADLO Cc1ccc(C[N@H+]2CCO[C@@H](c3ccc(F)cc3F)C2)cc1C ZINC001473402569 1061139363 /nfs/dbraw/zinc/13/93/63/1061139363.db2.gz LDAPXNRLLVQPSW-LJQANCHMSA-N 1 2 317.379 4.155 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2cncc(Cl)c2)C1 ZINC001473422022 1061151691 /nfs/dbraw/zinc/15/16/91/1061151691.db2.gz LDBASFSKAFTERN-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Cc1ccccc1[C@@]1(F)CC[N@@H+](Cc2cncc(Cl)c2)C1 ZINC001473422022 1061151696 /nfs/dbraw/zinc/15/16/96/1061151696.db2.gz LDBASFSKAFTERN-QGZVFWFLSA-N 1 2 304.796 4.114 20 0 DIADLO Fc1cc2[nH]c(-c3csc(Cl)c3)nc2cc1-n1cc[nH+]c1 ZINC001250968162 1061153020 /nfs/dbraw/zinc/15/30/20/1061153020.db2.gz QRYRHFKFKVLEDR-UHFFFAOYSA-N 1 2 318.764 4.270 20 0 DIADLO C[C@@H]1[C@H](C)[S@@](=O)CC[N@@H+]1Cc1ccc(C2CCCCC2)cc1 ZINC001473429657 1061155217 /nfs/dbraw/zinc/15/52/17/1061155217.db2.gz XTVOGGBOWNWLQK-VVBPWWLESA-N 1 2 319.514 4.076 20 0 DIADLO C[C@@H]1[C@H](C)[S@@](=O)CC[N@H+]1Cc1ccc(C2CCCCC2)cc1 ZINC001473429657 1061155222 /nfs/dbraw/zinc/15/52/22/1061155222.db2.gz XTVOGGBOWNWLQK-VVBPWWLESA-N 1 2 319.514 4.076 20 0 DIADLO CCCn1c(-c2ccc3[nH+]ccn3c2)nc2cccc(Cl)c21 ZINC001250978586 1061158505 /nfs/dbraw/zinc/15/85/05/1061158505.db2.gz MKEXGKBBLBNWEP-UHFFFAOYSA-N 1 2 310.788 4.414 20 0 DIADLO C[C@H]1CCSCC[N@@H+]1Cc1ccc(Cl)nc1C(F)(F)F ZINC001473445559 1061163523 /nfs/dbraw/zinc/16/35/23/1061163523.db2.gz PMFRIQRWHHTTSF-VIFPVBQESA-N 1 2 324.799 4.081 20 0 DIADLO C[C@H]1CCSCC[N@H+]1Cc1ccc(Cl)nc1C(F)(F)F ZINC001473445559 1061163526 /nfs/dbraw/zinc/16/35/26/1061163526.db2.gz PMFRIQRWHHTTSF-VIFPVBQESA-N 1 2 324.799 4.081 20 0 DIADLO Cc1ccc(-c2nc3ccc(F)cc3n2C2CCCC2)c(N)[nH+]1 ZINC001250982180 1061160261 /nfs/dbraw/zinc/16/02/61/1061160261.db2.gz QPVXDPNRWIMUGP-UHFFFAOYSA-N 1 2 310.376 4.243 20 0 DIADLO Cc1ccc(-c2nc3ccccc3n2Cc2ccccc2)c(N)[nH+]1 ZINC001250981375 1061160392 /nfs/dbraw/zinc/16/03/92/1061160392.db2.gz DAZQUCNYWBRDKS-UHFFFAOYSA-N 1 2 314.392 4.037 20 0 DIADLO Cc1ccc(-c2nc3cc(Oc4ccccc4)ccc3[nH]2)c(N)[nH+]1 ZINC001250982027 1061160647 /nfs/dbraw/zinc/16/06/47/1061160647.db2.gz NLKDOIXQCFTYOO-UHFFFAOYSA-N 1 2 316.364 4.308 20 0 DIADLO C[C@@H]([NH2+][C@H]1CCCC[C@@H]1c1ccccc1)C(=O)OC(C)(C)C ZINC001462427327 1061166395 /nfs/dbraw/zinc/16/63/95/1061166395.db2.gz OVKGTKKRRBAHOC-OIISXLGYSA-N 1 2 303.446 4.033 20 0 DIADLO C[C@H](c1nc2ccc(Cl)cc2[nH]1)[N@H+](C)C[C@H]1CCC(C)(C)O1 ZINC001473483477 1061185229 /nfs/dbraw/zinc/18/52/29/1061185229.db2.gz JKNOOGZHXPHBJB-DGCLKSJQSA-N 1 2 321.852 4.167 20 0 DIADLO C[C@H](c1nc2ccc(Cl)cc2[nH]1)[N@@H+](C)C[C@H]1CCC(C)(C)O1 ZINC001473483477 1061185232 /nfs/dbraw/zinc/18/52/32/1061185232.db2.gz JKNOOGZHXPHBJB-DGCLKSJQSA-N 1 2 321.852 4.167 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccc(O)c(C(F)(F)F)c3)[nH+]c2c1 ZINC001251020761 1061187350 /nfs/dbraw/zinc/18/73/50/1061187350.db2.gz SOUKESMOTLPZMN-UHFFFAOYSA-N 1 2 321.302 4.020 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3ccc4ccnc(Cl)c4c3)[nH+]c2c1 ZINC001251056753 1061206768 /nfs/dbraw/zinc/20/67/68/1061206768.db2.gz JFQBDCCVWDDBQL-UHFFFAOYSA-N 1 2 322.799 4.498 20 0 DIADLO Fc1cc2[nH]c(-c3cc(Cl)cs3)nc2cc1-n1cc[nH+]c1 ZINC001251087660 1061231749 /nfs/dbraw/zinc/23/17/49/1061231749.db2.gz PAGQRYWGTHMTRF-UHFFFAOYSA-N 1 2 318.764 4.270 20 0 DIADLO CCCCC[C@@H](C)CC(=O)N1CCC[C@@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001455770328 1061235082 /nfs/dbraw/zinc/23/50/82/1061235082.db2.gz MBSXGQGOGWHLKO-CZUORRHYSA-N 1 2 305.466 4.297 20 0 DIADLO Cc1[nH+]c(N)ccc1-c1nc2ccccc2n1-c1ccccc1F ZINC001251092556 1061235583 /nfs/dbraw/zinc/23/55/83/1061235583.db2.gz QUUYHKJASYVMSD-UHFFFAOYSA-N 1 2 318.355 4.117 20 0 DIADLO CCSCc1ccc[nH+]c1NC1CC2(C1)COC(C)(C)C2 ZINC001462528966 1061237865 /nfs/dbraw/zinc/23/78/65/1061237865.db2.gz PEMYCBGFGLPQQI-UHFFFAOYSA-N 1 2 306.475 4.094 20 0 DIADLO C[C@H]1CCC[N@H+](Cc2ccccc2Cl)[C@@H]1C(=O)OC(C)(C)C ZINC001473571521 1061256585 /nfs/dbraw/zinc/25/65/85/1061256585.db2.gz KCUPKFPZGSTGQY-BBRMVZONSA-N 1 2 323.864 4.282 20 0 DIADLO C[C@H]1CCC[N@@H+](Cc2ccccc2Cl)[C@@H]1C(=O)OC(C)(C)C ZINC001473571521 1061256600 /nfs/dbraw/zinc/25/66/00/1061256600.db2.gz KCUPKFPZGSTGQY-BBRMVZONSA-N 1 2 323.864 4.282 20 0 DIADLO Clc1ccnc(C[N@@H+]2CCSC[C@H]2C2CCC2)c1Cl ZINC001473569520 1061260396 /nfs/dbraw/zinc/26/03/96/1061260396.db2.gz YSFKGPYBOZNYMR-ZDUSSCGKSA-N 1 2 317.285 4.106 20 0 DIADLO Clc1ccnc(C[N@H+]2CCSC[C@H]2C2CCC2)c1Cl ZINC001473569520 1061260418 /nfs/dbraw/zinc/26/04/18/1061260418.db2.gz YSFKGPYBOZNYMR-ZDUSSCGKSA-N 1 2 317.285 4.106 20 0 DIADLO C[C@@H]1CCC[C@H](C(=O)OC(C)(C)C)[N@@H+]1Cc1ccc(Cl)cc1 ZINC001473578330 1061265255 /nfs/dbraw/zinc/26/52/55/1061265255.db2.gz VJALFHGZDCCYJG-CZUORRHYSA-N 1 2 323.864 4.425 20 0 DIADLO C[C@@H]1CCC[C@H](C(=O)OC(C)(C)C)[N@H+]1Cc1ccc(Cl)cc1 ZINC001473578330 1061265270 /nfs/dbraw/zinc/26/52/70/1061265270.db2.gz VJALFHGZDCCYJG-CZUORRHYSA-N 1 2 323.864 4.425 20 0 DIADLO Clc1cccc(CC[N@@H+]2CCOC[C@H]2C2CCC2)c1Cl ZINC001473579396 1061265950 /nfs/dbraw/zinc/26/59/50/1061265950.db2.gz DLYFUBOJNWUUML-HNNXBMFYSA-N 1 2 314.256 4.037 20 0 DIADLO Clc1cccc(CC[N@H+]2CCOC[C@H]2C2CCC2)c1Cl ZINC001473579396 1061265970 /nfs/dbraw/zinc/26/59/70/1061265970.db2.gz DLYFUBOJNWUUML-HNNXBMFYSA-N 1 2 314.256 4.037 20 0 DIADLO CCOC(=O)[C@@H](CCCC(C)C)[NH2+]C[C@H](C)c1ccccc1 ZINC001462573005 1061271110 /nfs/dbraw/zinc/27/11/10/1061271110.db2.gz MDROCZXWOQJJFT-FUHWJXTLSA-N 1 2 305.462 4.138 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+]1C[C@H](C)OC2(CCCCC2)C1 ZINC001473597673 1061279822 /nfs/dbraw/zinc/27/98/22/1061279822.db2.gz JSODKGVPHAONJQ-AWEZNQCLSA-N 1 2 323.864 4.272 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+]1C[C@H](C)OC2(CCCCC2)C1 ZINC001473597673 1061279840 /nfs/dbraw/zinc/27/98/40/1061279840.db2.gz JSODKGVPHAONJQ-AWEZNQCLSA-N 1 2 323.864 4.272 20 0 DIADLO COc1cc(Cl)ccc1C[N@@H+]1C[C@@H](C)OC2(CCCCC2)C1 ZINC001473597675 1061280628 /nfs/dbraw/zinc/28/06/28/1061280628.db2.gz JSODKGVPHAONJQ-CQSZACIVSA-N 1 2 323.864 4.272 20 0 DIADLO COc1cc(Cl)ccc1C[N@H+]1C[C@@H](C)OC2(CCCCC2)C1 ZINC001473597675 1061280645 /nfs/dbraw/zinc/28/06/45/1061280645.db2.gz JSODKGVPHAONJQ-CQSZACIVSA-N 1 2 323.864 4.272 20 0 DIADLO Fc1nccc(Cl)c1C[N@@H+]1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC001462590103 1061282489 /nfs/dbraw/zinc/28/24/89/1061282489.db2.gz SOMJSXSJLOQUHB-ZANVPECISA-N 1 2 322.733 4.039 20 0 DIADLO Fc1nccc(Cl)c1C[N@H+]1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC001462590103 1061282509 /nfs/dbraw/zinc/28/25/09/1061282509.db2.gz SOMJSXSJLOQUHB-ZANVPECISA-N 1 2 322.733 4.039 20 0 DIADLO COC(=O)[C@H]([NH2+][C@@H]1CCC[C@H](C)C1)c1cccc2ccccc21 ZINC001462588303 1061282613 /nfs/dbraw/zinc/28/26/13/1061282613.db2.gz STNHXKVWWKQYJW-ZSZQSSIHSA-N 1 2 311.425 4.222 20 0 DIADLO CCC[C@@H](CC1CCCC1)C(=O)NCc1c[nH]c(C(C)C)[nH+]1 ZINC001456342299 1061299643 /nfs/dbraw/zinc/29/96/43/1061299643.db2.gz GBTAUXUFINUEOU-HNNXBMFYSA-N 1 2 305.466 4.146 20 0 DIADLO CCC[C@@H](CC1CCCC1)C(=O)NCc1c[nH+]c(C(C)C)[nH]1 ZINC001456342299 1061299664 /nfs/dbraw/zinc/29/96/64/1061299664.db2.gz GBTAUXUFINUEOU-HNNXBMFYSA-N 1 2 305.466 4.146 20 0 DIADLO Cc1coc(C[N@@H+]2CCc3cc(C)c(Br)cc3C2)c1 ZINC001462614594 1061300577 /nfs/dbraw/zinc/30/05/77/1061300577.db2.gz QQTSVUAICPCISA-UHFFFAOYSA-N 1 2 320.230 4.217 20 0 DIADLO Cc1coc(C[N@H+]2CCc3cc(C)c(Br)cc3C2)c1 ZINC001462614594 1061300596 /nfs/dbraw/zinc/30/05/96/1061300596.db2.gz QQTSVUAICPCISA-UHFFFAOYSA-N 1 2 320.230 4.217 20 0 DIADLO CCCCC[C@@H](C)[NH2+][C@@H](Cc1ccccc1)C(=O)OC(C)(C)C ZINC001462618019 1061301705 /nfs/dbraw/zinc/30/17/05/1061301705.db2.gz KGNINPASNBOSOB-AEFFLSMTSA-N 1 2 319.489 4.498 20 0 DIADLO Fc1cc2nc(-c3cccc4[nH+]ccn43)[nH]c2cc1C(F)(F)F ZINC001251326200 1061316577 /nfs/dbraw/zinc/31/65/77/1061316577.db2.gz BYPHTXXOPPVWPK-UHFFFAOYSA-N 1 2 320.249 4.036 20 0 DIADLO CC(C)(C)n1c2ccc(F)cc2nc1-c1cccc2[nH+]ccn21 ZINC001251326746 1061316766 /nfs/dbraw/zinc/31/67/66/1061316766.db2.gz VRVZFCXARKQYOI-UHFFFAOYSA-N 1 2 308.360 4.245 20 0 DIADLO Cc1ccc(C2CC([NH2+]CC(F)(F)C3(O)CCCCC3)C2)cc1 ZINC001462649401 1061317441 /nfs/dbraw/zinc/31/74/41/1061317441.db2.gz CPISSAGJAZUGJW-UHFFFAOYSA-N 1 2 323.427 4.161 20 0 DIADLO C[C@H]1CN(C)c2ccccc2C[N@@H+]1Cc1cc(C(F)(F)F)co1 ZINC001473650315 1061318743 /nfs/dbraw/zinc/31/87/43/1061318743.db2.gz XMTHBFQOKKZEMH-LBPRGKRZSA-N 1 2 324.346 4.139 20 0 DIADLO C[C@H]1CN(C)c2ccccc2C[N@H+]1Cc1cc(C(F)(F)F)co1 ZINC001473650315 1061318749 /nfs/dbraw/zinc/31/87/49/1061318749.db2.gz XMTHBFQOKKZEMH-LBPRGKRZSA-N 1 2 324.346 4.139 20 0 DIADLO CN(C)c1ccc2[nH]c(-c3csc(Br)c3)[nH+]c2c1 ZINC001251340984 1061324625 /nfs/dbraw/zinc/32/46/25/1061324625.db2.gz FCQRDIYFSIFKML-UHFFFAOYSA-N 1 2 322.231 4.120 20 0 DIADLO CC(C)C[C@@H](C)[NH2+][C@@H](Cc1ccccc1)C(=O)OC1CCCC1 ZINC001473699494 1061354789 /nfs/dbraw/zinc/35/47/89/1061354789.db2.gz KRLFCYTYGTUDKV-APWZRJJASA-N 1 2 317.473 4.108 20 0 DIADLO CC(C)(C)OC(=O)C[NH2+][C@@H]1CCC(C)(C)C[C@H]1c1ccccc1 ZINC001473743370 1061382802 /nfs/dbraw/zinc/38/28/02/1061382802.db2.gz RPUBRQITPBWJKH-DLBZAZTESA-N 1 2 317.473 4.280 20 0 DIADLO C[C@H]1CC[N@H+](Cc2nc3c(s2)C(C)(C)CC(C)(C)C3)CCO1 ZINC001473814997 1061419876 /nfs/dbraw/zinc/41/98/76/1061419876.db2.gz CFBRKRPVSUXXEM-ZDUSSCGKSA-N 1 2 322.518 4.004 20 0 DIADLO C[C@H]1CC[N@@H+](Cc2nc3c(s2)C(C)(C)CC(C)(C)C3)CCO1 ZINC001473814997 1061419879 /nfs/dbraw/zinc/41/98/79/1061419879.db2.gz CFBRKRPVSUXXEM-ZDUSSCGKSA-N 1 2 322.518 4.004 20 0 DIADLO COc1nscc1C[N@H+](C)Cc1ccc(C2CCCC2)cc1 ZINC001473827989 1061424927 /nfs/dbraw/zinc/42/49/27/1061424927.db2.gz HEKSOWZPRGZLFN-UHFFFAOYSA-N 1 2 316.470 4.441 20 0 DIADLO COc1nscc1C[N@@H+](C)Cc1ccc(C2CCCC2)cc1 ZINC001473827989 1061424940 /nfs/dbraw/zinc/42/49/40/1061424940.db2.gz HEKSOWZPRGZLFN-UHFFFAOYSA-N 1 2 316.470 4.441 20 0 DIADLO Cc1cccnc1[C@@H](C)[NH2+][C@H](C)c1ncc(-c2ccccc2)o1 ZINC001473878790 1061447423 /nfs/dbraw/zinc/44/74/23/1061447423.db2.gz ABJYPTCBIKXYRD-HUUCEWRRSA-N 1 2 307.397 4.457 20 0 DIADLO C=Cc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3)c(C)c2)cc1 ZINC001457617937 1061474798 /nfs/dbraw/zinc/47/47/98/1061474798.db2.gz LENYHZURQUBCFF-UHFFFAOYSA-N 1 2 303.365 4.076 20 0 DIADLO Cc1cc([NH+](C)C)ccc1NCc1nc2c(s1)C[C@H](C)CC2 ZINC001473943620 1061487216 /nfs/dbraw/zinc/48/72/16/1061487216.db2.gz GFFDUAAEDHOBKK-GFCCVEGCSA-N 1 2 315.486 4.254 20 0 DIADLO Cc1cc(CNc2cc(Br)ccc2C)cc(C)[nH+]1 ZINC001473949425 1061492695 /nfs/dbraw/zinc/49/26/95/1061492695.db2.gz DQYXIAULHOAJRT-UHFFFAOYSA-N 1 2 305.219 4.381 20 0 DIADLO COc1cc(-c2[nH]c3ccc(N(C)C)cc3[nH+]2)ccc1SC ZINC001251814446 1061496848 /nfs/dbraw/zinc/49/68/48/1061496848.db2.gz MCIWLLMISNLUNJ-UHFFFAOYSA-N 1 2 313.426 4.026 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2NC1CCCCCCC1 ZINC001458060729 1061551661 /nfs/dbraw/zinc/55/16/61/1061551661.db2.gz DICKGJJISZOAFK-UHFFFAOYSA-N 1 2 301.438 4.106 20 0 DIADLO Cc1cc(Oc2ccc(NC[C@@H](O)c3ccccc3)cc2)cc[nH+]1 ZINC001251999059 1061552338 /nfs/dbraw/zinc/55/23/38/1061552338.db2.gz MFDFPDJUKAISAI-HXUWFJFHSA-N 1 2 320.392 4.328 20 0 DIADLO Cc1cc(CNC(=O)N2CCC(CCC(C)C)CC2)cc(C)[nH+]1 ZINC001252019229 1061556161 /nfs/dbraw/zinc/55/61/61/1061556161.db2.gz WZEBMIVRMJOXEA-UHFFFAOYSA-N 1 2 317.477 4.056 20 0 DIADLO Cc1cc(CNC(=O)N2CCC[C@H](C(C)(C)C)CC2)cc(C)[nH+]1 ZINC001252017670 1061557311 /nfs/dbraw/zinc/55/73/11/1061557311.db2.gz JZRXJJQWHGTANS-KRWDZBQOSA-N 1 2 317.477 4.056 20 0 DIADLO CCc1cc(N[C@@H](C)c2cccc(OC(F)F)c2)nc(CC)[nH+]1 ZINC001458103433 1061571237 /nfs/dbraw/zinc/57/12/37/1061571237.db2.gz DQVWEPWELZATQF-NSHDSACASA-N 1 2 321.371 4.376 20 0 DIADLO Fc1cc(F)c(F)c(C[NH2+]Cc2ccc3[nH]ccc3c2)c1F ZINC001474039088 1061581715 /nfs/dbraw/zinc/58/17/15/1061581715.db2.gz KOFMPYNTILNACH-UHFFFAOYSA-N 1 2 308.278 4.014 20 0 DIADLO C[C@@H]([NH2+]Cc1cccc2c1OCC2)c1c(F)cccc1Cl ZINC001474038080 1061584137 /nfs/dbraw/zinc/58/41/37/1061584137.db2.gz QXSRTNCMGIOVNY-LLVKDONJSA-N 1 2 305.780 4.265 20 0 DIADLO C[C@@H]1CC=C(C(=O)Nc2ccc(-n3cc[nH+]c3)c(Cl)c2)CC1 ZINC001464555599 1061605148 /nfs/dbraw/zinc/60/51/48/1061605148.db2.gz FHYILBJMNVVMGA-GFCCVEGCSA-N 1 2 315.804 4.211 20 0 DIADLO Cc1cc(NCCc2cccc3cccnc32)nc(C2CCC2)[nH+]1 ZINC001458166217 1061608830 /nfs/dbraw/zinc/60/88/30/1061608830.db2.gz CAULOBZXMDSHQS-UHFFFAOYSA-N 1 2 318.424 4.255 20 0 DIADLO COc1c(C)c[nH+]c(CNC(=O)C[C@@H](C)CCC=C(C)C)c1C ZINC001464612632 1061613666 /nfs/dbraw/zinc/61/36/66/1061613666.db2.gz QLRVACZYPFHUME-AWEZNQCLSA-N 1 2 318.461 4.096 20 0 DIADLO Cc1nc(N[C@H](Cc2ccccc2)C2CC2)c2c([nH+]1)CCCC2 ZINC001458178233 1061614374 /nfs/dbraw/zinc/61/43/74/1061614374.db2.gz KTVNCTQRGLAOJH-LJQANCHMSA-N 1 2 307.441 4.097 20 0 DIADLO Cc1cc(NCc2ccccc2OC(C)(C)C)nc(C2CC2)[nH+]1 ZINC001458205024 1061629685 /nfs/dbraw/zinc/62/96/85/1061629685.db2.gz CPKLLLFKEDVGHV-UHFFFAOYSA-N 1 2 311.429 4.452 20 0 DIADLO CC[C@H](C(=O)Nc1ccc(-n2cc[nH+]c2)c(C)c1)c1ccccc1 ZINC001464824352 1061637899 /nfs/dbraw/zinc/63/78/99/1061637899.db2.gz GVEUWHHBIGNCTN-SFHVURJKSA-N 1 2 319.408 4.313 20 0 DIADLO Cc1nc(N[C@H](C)c2ccc(F)cc2F)c2c([nH+]1)CCCC2 ZINC001458229688 1061645951 /nfs/dbraw/zinc/64/59/51/1061645951.db2.gz LBDACCRNSKXAGN-SNVBAGLBSA-N 1 2 303.356 4.115 20 0 DIADLO CCn1ccnc1C[NH2+]C(c1ccccc1C)c1ccccc1C ZINC001474106088 1061656489 /nfs/dbraw/zinc/65/64/89/1061656489.db2.gz IMMDHSNNYQOIDU-UHFFFAOYSA-N 1 2 319.452 4.399 20 0 DIADLO CSc1c(F)cc(NCc2c[nH+]c3c(C)cccn23)cc1F ZINC001474109443 1061659498 /nfs/dbraw/zinc/65/94/98/1061659498.db2.gz JLCCVUXWHUBOHB-UHFFFAOYSA-N 1 2 319.380 4.255 20 0 DIADLO Cc1nsc(Nc2ccc([N@H+]3CCCC[C@@H]3C)cc2C)n1 ZINC001458258599 1061663190 /nfs/dbraw/zinc/66/31/90/1061663190.db2.gz DVIMBEPMPLBNER-LBPRGKRZSA-N 1 2 302.447 4.277 20 0 DIADLO Cc1nsc(Nc2ccc([N@@H+]3CCCC[C@@H]3C)cc2C)n1 ZINC001458258599 1061663202 /nfs/dbraw/zinc/66/32/02/1061663202.db2.gz DVIMBEPMPLBNER-LBPRGKRZSA-N 1 2 302.447 4.277 20 0 DIADLO Cc1cc(N[C@@H](C)c2ccc3[nH]c(=O)[nH]c3c2)[nH+]c2ccccc12 ZINC001252589248 1061670704 /nfs/dbraw/zinc/67/07/04/1061670704.db2.gz LRJZQJIBIQXYDJ-LBPRGKRZSA-N 1 2 318.380 4.298 20 0 DIADLO CCc1cc(N(Cc2c(F)cccc2F)C2CC2)nc(CC)[nH+]1 ZINC001458315427 1061692644 /nfs/dbraw/zinc/69/26/44/1061692644.db2.gz UFONYLGIJZAANO-UHFFFAOYSA-N 1 2 317.383 4.049 20 0 DIADLO CC(C)=CCC[C@@H](C)Nc1nc(C)[nH+]c(C)c1Br ZINC001458388482 1061736396 /nfs/dbraw/zinc/73/63/96/1061736396.db2.gz QCRMFWNGKJZQCT-SNVBAGLBSA-N 1 2 312.255 4.403 20 0 DIADLO Cc1cccc(CC2CN(c3cc(C)[nH+]c(C4CCC4)n3)C2)c1 ZINC001458494247 1061797399 /nfs/dbraw/zinc/79/73/99/1061797399.db2.gz CXCBTTXMBMBLKV-UHFFFAOYSA-N 1 2 307.441 4.040 20 0 DIADLO Fc1ccc2onc(C[NH2+]Cc3cccc(Cl)c3F)c2c1 ZINC001474241205 1061805098 /nfs/dbraw/zinc/80/50/98/1061805098.db2.gz WPBLRZHVCOTNJE-UHFFFAOYSA-N 1 2 308.715 4.049 20 0 DIADLO FC[C@@H]([NH2+]Cc1cnc(-c2ccco2)s1)c1ccc(F)cc1 ZINC001474242695 1061805216 /nfs/dbraw/zinc/80/52/16/1061805216.db2.gz QSAJNDNBHAVLPH-CQSZACIVSA-N 1 2 320.364 4.343 20 0 DIADLO CCOc1ccc(Cl)cc1C[NH2+]Cc1noc2ccccc12 ZINC001474264853 1061830348 /nfs/dbraw/zinc/83/03/48/1061830348.db2.gz FPORLDAECUWKSA-UHFFFAOYSA-N 1 2 316.788 4.170 20 0 DIADLO Fc1cccc2nc(N[C@H](Cn3cc[nH+]c3)c3ccccc3)oc21 ZINC001458554972 1061833293 /nfs/dbraw/zinc/83/32/93/1061833293.db2.gz RCOTXCFXHWXDNU-MRXNPFEDSA-N 1 2 322.343 4.017 20 0 DIADLO Clc1ncccc1CNc1[nH+]c2ccccc2n1CC1CC1 ZINC001474273980 1061841156 /nfs/dbraw/zinc/84/11/56/1061841156.db2.gz OKKRPMGZOLMBFE-UHFFFAOYSA-N 1 2 312.804 4.107 20 0 DIADLO CCC1(CC)CN(C(=O)Nc2cc(C)[nH+]cc2C)c2ccccc21 ZINC001465948537 1061845781 /nfs/dbraw/zinc/84/57/81/1061845781.db2.gz DYKHYNZTFAFMJA-UHFFFAOYSA-N 1 2 323.440 4.230 20 0 DIADLO Cc1cc(NC[C@H](O)c2ccc(F)c(F)c2)c2ccsc2[nH+]1 ZINC001253349437 1061874852 /nfs/dbraw/zinc/87/48/52/1061874852.db2.gz CHMQXPGIYZUZKX-HNNXBMFYSA-N 1 2 320.364 4.028 20 0 DIADLO CC(C)(C)c1coc(Sc2nc3ccccc3n3c[nH+]cc23)n1 ZINC001458715434 1061882729 /nfs/dbraw/zinc/88/27/29/1061882729.db2.gz CENBUAJIISSQLQ-UHFFFAOYSA-N 1 2 324.409 4.319 20 0 DIADLO Cc1cc(N2CCc3cc(C(C)C)ccc3C2)nc(C2CC2)[nH+]1 ZINC001458736236 1061889029 /nfs/dbraw/zinc/88/90/29/1061889029.db2.gz WUHFXMBDEKZMAI-UHFFFAOYSA-N 1 2 307.441 4.349 20 0 DIADLO C[C@@H]1CC[N@H+](Cc2ccc(O)c(F)c2F)[C@H](c2ccco2)C1 ZINC001474319930 1061894805 /nfs/dbraw/zinc/89/48/05/1061894805.db2.gz SYLFNOKOVDBUES-YPMHNXCESA-N 1 2 307.340 4.237 20 0 DIADLO C[C@@H]1CC[N@@H+](Cc2ccc(O)c(F)c2F)[C@H](c2ccco2)C1 ZINC001474319930 1061894827 /nfs/dbraw/zinc/89/48/27/1061894827.db2.gz SYLFNOKOVDBUES-YPMHNXCESA-N 1 2 307.340 4.237 20 0 DIADLO CC[N@H+](Cc1cc2c(cc[nH]c2=O)o1)Cc1ccccc1Cl ZINC001474319978 1061898264 /nfs/dbraw/zinc/89/82/64/1061898264.db2.gz WPHAEKNHWOVWMC-UHFFFAOYSA-N 1 2 316.788 4.209 20 0 DIADLO CC[N@@H+](Cc1cc2c(cc[nH]c2=O)o1)Cc1ccccc1Cl ZINC001474319978 1061898281 /nfs/dbraw/zinc/89/82/81/1061898281.db2.gz WPHAEKNHWOVWMC-UHFFFAOYSA-N 1 2 316.788 4.209 20 0 DIADLO Cc1cc(F)ncc1C[N@@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC001474327075 1061913152 /nfs/dbraw/zinc/91/31/52/1061913152.db2.gz OXYMQDRGUPSRLW-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1cc(F)ncc1C[N@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC001474327075 1061913171 /nfs/dbraw/zinc/91/31/71/1061913171.db2.gz OXYMQDRGUPSRLW-UHFFFAOYSA-N 1 2 322.383 4.347 20 0 DIADLO Cc1cccc2[nH]c(C[N@H+]3C[C@H](C)OC[C@@H]3c3ccccc3)cc21 ZINC001474349973 1061954951 /nfs/dbraw/zinc/95/49/51/1061954951.db2.gz BXJCPIPENGOQMR-HRAATJIYSA-N 1 2 320.436 4.438 20 0 DIADLO Cc1cccc2[nH]c(C[N@@H+]3C[C@H](C)OC[C@@H]3c3ccccc3)cc21 ZINC001474349973 1061954974 /nfs/dbraw/zinc/95/49/74/1061954974.db2.gz BXJCPIPENGOQMR-HRAATJIYSA-N 1 2 320.436 4.438 20 0 DIADLO Cc1cccc(-c2nnc(-c3ccc(-c4c[nH+]cn4C)cc3)o2)c1 ZINC001253718723 1061960719 /nfs/dbraw/zinc/96/07/19/1061960719.db2.gz YHXSDXJFMZMXIN-UHFFFAOYSA-N 1 2 316.364 4.113 20 0 DIADLO CN(C)c1cccc(C[N@H+](C)Cc2cncc(Cl)c2Cl)c1 ZINC001474357531 1061974496 /nfs/dbraw/zinc/97/44/96/1061974496.db2.gz AXZPCYTUGRQPCD-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO CN(C)c1cccc(C[N@@H+](C)Cc2cncc(Cl)c2Cl)c1 ZINC001474357531 1061974519 /nfs/dbraw/zinc/97/45/19/1061974519.db2.gz AXZPCYTUGRQPCD-UHFFFAOYSA-N 1 2 324.255 4.086 20 0 DIADLO Cc1ccsc1C[N@@H+]1CCO[C@@H](c2ccc(Cl)s2)C1 ZINC001254018584 1062009918 /nfs/dbraw/zinc/00/99/18/1062009918.db2.gz MDKGVPNDJCYMFV-LLVKDONJSA-N 1 2 313.875 4.345 20 0 DIADLO Cc1ccsc1C[N@H+]1CCO[C@@H](c2ccc(Cl)s2)C1 ZINC001254018584 1062009942 /nfs/dbraw/zinc/00/99/42/1062009942.db2.gz MDKGVPNDJCYMFV-LLVKDONJSA-N 1 2 313.875 4.345 20 0 DIADLO CCC[N@H+](Cc1ocnc1C)Cc1ccccc1Br ZINC001474373560 1062014415 /nfs/dbraw/zinc/01/44/15/1062014415.db2.gz AMUJMJWZIIBODY-UHFFFAOYSA-N 1 2 323.234 4.158 20 0 DIADLO CCC[N@@H+](Cc1ocnc1C)Cc1ccccc1Br ZINC001474373560 1062014440 /nfs/dbraw/zinc/01/44/40/1062014440.db2.gz AMUJMJWZIIBODY-UHFFFAOYSA-N 1 2 323.234 4.158 20 0 DIADLO Cc1cc(Cl)cc(C[N@@H+]2CCO[C@H](c3ccc(F)cc3)C2)c1 ZINC001474377701 1062020121 /nfs/dbraw/zinc/02/01/21/1062020121.db2.gz QMSWQVYJIMKGFK-SFHVURJKSA-N 1 2 319.807 4.361 20 0 DIADLO Cc1cc(Cl)cc(C[N@H+]2CCO[C@H](c3ccc(F)cc3)C2)c1 ZINC001474377701 1062020140 /nfs/dbraw/zinc/02/01/40/1062020140.db2.gz QMSWQVYJIMKGFK-SFHVURJKSA-N 1 2 319.807 4.361 20 0 DIADLO CC(C)(C)c1cn(CCc2ccc(OC(F)(F)F)cc2)c[nH+]1 ZINC001459210106 1062042602 /nfs/dbraw/zinc/04/26/02/1062042602.db2.gz MQFONAPIGVHYRE-UHFFFAOYSA-N 1 2 312.335 4.322 20 0 DIADLO Fc1cc(Br)cc(F)c1C[NH+]1CCCCCCC1 ZINC001474404182 1062062997 /nfs/dbraw/zinc/06/29/97/1062062997.db2.gz FOBODSDHHQNSKF-UHFFFAOYSA-N 1 2 318.205 4.493 20 0 DIADLO C[C@H]([NH2+][C@@H](C)[C@@H](C)c1ccc(Cl)cc1)C(=O)OC(C)(C)C ZINC001474396159 1062054600 /nfs/dbraw/zinc/05/46/00/1062054600.db2.gz GTNZINUPFKQWNY-AGIUHOORSA-N 1 2 311.853 4.152 20 0 DIADLO COc1ccccc1Cc1cn(CCCc2ccccc2C)c[nH+]1 ZINC001459303937 1062071819 /nfs/dbraw/zinc/07/18/19/1062071819.db2.gz YSJDRVBNJBHGBB-UHFFFAOYSA-N 1 2 320.436 4.424 20 0 DIADLO COc1ccccc1C[N@H+](C)Cc1cccc(OC2CC2)c1F ZINC001474409822 1062073747 /nfs/dbraw/zinc/07/37/47/1062073747.db2.gz HQIXXKAHDDHDQQ-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO COc1ccccc1C[N@@H+](C)Cc1cccc(OC2CC2)c1F ZINC001474409822 1062073768 /nfs/dbraw/zinc/07/37/68/1062073768.db2.gz HQIXXKAHDDHDQQ-UHFFFAOYSA-N 1 2 315.388 4.008 20 0 DIADLO COc1cccc(C[N@H+](Cc2ccc(C)o2)C2CC2)c1Cl ZINC001459313043 1062080641 /nfs/dbraw/zinc/08/06/41/1062080641.db2.gz GFOLBCVUGOPJKJ-UHFFFAOYSA-N 1 2 305.805 4.415 20 0 DIADLO COc1cccc(C[N@@H+](Cc2ccc(C)o2)C2CC2)c1Cl ZINC001459313043 1062080658 /nfs/dbraw/zinc/08/06/58/1062080658.db2.gz GFOLBCVUGOPJKJ-UHFFFAOYSA-N 1 2 305.805 4.415 20 0 DIADLO CSc1ccc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)o1 ZINC001474414551 1062084561 /nfs/dbraw/zinc/08/45/61/1062084561.db2.gz JIUKJXHXKHVBTR-UHFFFAOYSA-N 1 2 309.381 4.444 20 0 DIADLO CSc1ccc(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)o1 ZINC001474414551 1062084584 /nfs/dbraw/zinc/08/45/84/1062084584.db2.gz JIUKJXHXKHVBTR-UHFFFAOYSA-N 1 2 309.381 4.444 20 0 DIADLO CCc1ccc([C@@H]2C[N@H+](Cc3cccc(C)c3F)CCO2)cc1 ZINC001474444591 1062123741 /nfs/dbraw/zinc/12/37/41/1062123741.db2.gz QCPIWVXLGNATNX-IBGZPJMESA-N 1 2 313.416 4.270 20 0 DIADLO CCc1ccc([C@@H]2C[N@@H+](Cc3cccc(C)c3F)CCO2)cc1 ZINC001474444591 1062123749 /nfs/dbraw/zinc/12/37/49/1062123749.db2.gz QCPIWVXLGNATNX-IBGZPJMESA-N 1 2 313.416 4.270 20 0 DIADLO COc1cccc(C2CC[NH+](Cc3nc(Cl)cs3)CC2)c1 ZINC001474446073 1062123897 /nfs/dbraw/zinc/12/38/97/1062123897.db2.gz OUFWVHQEOAAHOM-UHFFFAOYSA-N 1 2 322.861 4.185 20 0 DIADLO Cc1ccc(N(C)Cc2c[nH+]c(N(C)C)c3ccccc23)cc1 ZINC001459411384 1062131295 /nfs/dbraw/zinc/13/12/95/1062131295.db2.gz HLSMDDKGZDEMAD-UHFFFAOYSA-N 1 2 305.425 4.246 20 0 DIADLO Cc1cccc2c1CC[N@H+](Cc1cscc1Br)C2 ZINC001459453818 1062151814 /nfs/dbraw/zinc/15/18/14/1062151814.db2.gz ZJOHDRQTYVVLRM-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO Cc1cccc2c1CC[N@@H+](Cc1cscc1Br)C2 ZINC001459453818 1062151821 /nfs/dbraw/zinc/15/18/21/1062151821.db2.gz ZJOHDRQTYVVLRM-UHFFFAOYSA-N 1 2 322.271 4.377 20 0 DIADLO C[C@@H]1CN(c2ccc(N[C@@H]3CCCC(C)(C)C3)c[nH+]2)C[C@H](C)O1 ZINC001474487770 1062167228 /nfs/dbraw/zinc/16/72/28/1062167228.db2.gz UPZKJENGLUSGGC-OWCLPIDISA-N 1 2 317.477 4.076 20 0 DIADLO C/C=C/C[C@H]([NH2+][C@H](C)CC(C)(C)c1ccccc1)C(=O)OCC ZINC001474495174 1062175402 /nfs/dbraw/zinc/17/54/02/1062175402.db2.gz GLQQUERZEUOQHE-ACIWDAPJSA-N 1 2 317.473 4.230 20 0 DIADLO C/C=C/C[C@H]([NH2+][C@@H](C)CC(C)(C)c1ccccc1)C(=O)OCC ZINC001474495177 1062176657 /nfs/dbraw/zinc/17/66/57/1062176657.db2.gz GLQQUERZEUOQHE-VYOWTIGJSA-N 1 2 317.473 4.230 20 0 DIADLO C/C=C\C[C@H]([NH2+][C@H](C)CC(C)(C)c1ccccc1)C(=O)OCC ZINC001474495175 1062176829 /nfs/dbraw/zinc/17/68/29/1062176829.db2.gz GLQQUERZEUOQHE-KKPFSTTMSA-N 1 2 317.473 4.230 20 0 DIADLO C/C=C/C[C@H]([NH2+]CCc1ccc(C(C)(C)C)cc1)C(=O)OCC ZINC001474496516 1062177014 /nfs/dbraw/zinc/17/70/14/1062177014.db2.gz NWEKILGVZLYGSP-IWHGQQBYSA-N 1 2 317.473 4.014 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2cc(Cl)n(C)n2)cc1 ZINC001459536550 1062193944 /nfs/dbraw/zinc/19/39/44/1062193944.db2.gz BEXPWIZLCRHDNI-MRXNPFEDSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2cc(Cl)n(C)n2)cc1 ZINC001459536550 1062193959 /nfs/dbraw/zinc/19/39/59/1062193959.db2.gz BEXPWIZLCRHDNI-MRXNPFEDSA-N 1 2 303.837 4.109 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2nc(C3CCC3)no2)cc1 ZINC001459542228 1062197917 /nfs/dbraw/zinc/19/79/17/1062197917.db2.gz OUOKTQSSDARCBM-QGZVFWFLSA-N 1 2 311.429 4.373 20 0 DIADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2nc(C3CCC3)no2)cc1 ZINC001459542228 1062197932 /nfs/dbraw/zinc/19/79/32/1062197932.db2.gz OUOKTQSSDARCBM-QGZVFWFLSA-N 1 2 311.429 4.373 20 0 DIADLO CC(C)[C@@H]1C[N@H+](Cc2csc(C(F)(F)F)n2)[C@H]1C(C)C ZINC001474521623 1062205207 /nfs/dbraw/zinc/20/52/07/1062205207.db2.gz NMNZBVRFZOKRLL-RYUDHWBXSA-N 1 2 306.397 4.274 20 0 DIADLO CC(C)[C@@H]1C[N@@H+](Cc2csc(C(F)(F)F)n2)[C@H]1C(C)C ZINC001474521623 1062205225 /nfs/dbraw/zinc/20/52/25/1062205225.db2.gz NMNZBVRFZOKRLL-RYUDHWBXSA-N 1 2 306.397 4.274 20 0 DIADLO Fc1cc2[nH]c(C[N@@H+]3CC[C@@H]3C3CC3)cc2c(Br)c1 ZINC001474535971 1062222066 /nfs/dbraw/zinc/22/20/66/1062222066.db2.gz AZXJUWSAHPCMJH-OAHLLOKOSA-N 1 2 323.209 4.054 20 0 DIADLO Fc1cc2[nH]c(C[N@H+]3CC[C@@H]3C3CC3)cc2c(Br)c1 ZINC001474535971 1062222085 /nfs/dbraw/zinc/22/20/85/1062222085.db2.gz AZXJUWSAHPCMJH-OAHLLOKOSA-N 1 2 323.209 4.054 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@@H+]1CC2(CCC2)[C@H]1c1ccccc1 ZINC001474552522 1062249368 /nfs/dbraw/zinc/24/93/68/1062249368.db2.gz LWCPDKZAIRNWHY-MRXNPFEDSA-N 1 2 315.848 4.353 20 0 DIADLO CCc1[nH]nc(Cl)c1C[N@H+]1CC2(CCC2)[C@H]1c1ccccc1 ZINC001474552522 1062249390 /nfs/dbraw/zinc/24/93/90/1062249390.db2.gz LWCPDKZAIRNWHY-MRXNPFEDSA-N 1 2 315.848 4.353 20 0 DIADLO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2c(Cl)cncc2Cl)C1(C)C ZINC001459633105 1062265589 /nfs/dbraw/zinc/26/55/89/1062265589.db2.gz ZMLSLPBVLWHEQT-ZIAGYGMSSA-N 1 2 317.260 4.024 20 0 DIADLO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2c(Cl)cncc2Cl)C1(C)C ZINC001459633105 1062265609 /nfs/dbraw/zinc/26/56/09/1062265609.db2.gz ZMLSLPBVLWHEQT-ZIAGYGMSSA-N 1 2 317.260 4.024 20 0 DIADLO CC1(C)C[N@H+](Cc2ccnn2C2CCC2)[C@H]1c1cccs1 ZINC001474565616 1062271673 /nfs/dbraw/zinc/27/16/73/1062271673.db2.gz WFSLBPIKUWPSCB-INIZCTEOSA-N 1 2 301.459 4.253 20 0 DIADLO CC1(C)C[N@@H+](Cc2ccnn2C2CCC2)[C@H]1c1cccs1 ZINC001474565616 1062271694 /nfs/dbraw/zinc/27/16/94/1062271694.db2.gz WFSLBPIKUWPSCB-INIZCTEOSA-N 1 2 301.459 4.253 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(Cl)n2)CC[C@@H]1c1ccccc1 ZINC001459646527 1062274822 /nfs/dbraw/zinc/27/48/22/1062274822.db2.gz LSQHHSLEYFBOQY-WFASDCNBSA-N 1 2 306.862 4.422 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(Cl)n2)CC[C@@H]1c1ccccc1 ZINC001459646527 1062274846 /nfs/dbraw/zinc/27/48/46/1062274846.db2.gz LSQHHSLEYFBOQY-WFASDCNBSA-N 1 2 306.862 4.422 20 0 DIADLO C[C@H]1C[N@H+](Cc2csc(Cl)n2)CC[C@H]1c1ccccc1 ZINC001459646522 1062277662 /nfs/dbraw/zinc/27/76/62/1062277662.db2.gz LSQHHSLEYFBOQY-SWLSCSKDSA-N 1 2 306.862 4.422 20 0 DIADLO C[C@H]1C[N@@H+](Cc2csc(Cl)n2)CC[C@H]1c1ccccc1 ZINC001459646522 1062277685 /nfs/dbraw/zinc/27/76/85/1062277685.db2.gz LSQHHSLEYFBOQY-SWLSCSKDSA-N 1 2 306.862 4.422 20 0 DIADLO CN(C)c1ccc(F)cc1C[N@@H+]1CCc2cccc(Cl)c2C1 ZINC001474573444 1062283396 /nfs/dbraw/zinc/28/33/96/1062283396.db2.gz UOGYDPBUYWQOSO-UHFFFAOYSA-N 1 2 318.823 4.103 20 0 DIADLO CN(C)c1ccc(F)cc1C[N@H+]1CCc2cccc(Cl)c2C1 ZINC001474573444 1062283417 /nfs/dbraw/zinc/28/34/17/1062283417.db2.gz UOGYDPBUYWQOSO-UHFFFAOYSA-N 1 2 318.823 4.103 20 0 DIADLO COCC1(C[NH2+]c2ccc(N(C)C)c(C(F)(F)F)c2)CCC1 ZINC001474583288 1062292367 /nfs/dbraw/zinc/29/23/67/1062292367.db2.gz DBAZSBUZFLESAX-UHFFFAOYSA-N 1 2 316.367 4.000 20 0 DIADLO Cc1nn(C)c(C[N@@H+](C(C)C)[C@H](C)c2ccsc2)c1Cl ZINC001474586025 1062297125 /nfs/dbraw/zinc/29/71/25/1062297125.db2.gz KCMXXACHOYZDSP-GFCCVEGCSA-N 1 2 311.882 4.415 20 0 DIADLO Cc1nn(C)c(C[N@H+](C(C)C)[C@H](C)c2ccsc2)c1Cl ZINC001474586025 1062297148 /nfs/dbraw/zinc/29/71/48/1062297148.db2.gz KCMXXACHOYZDSP-GFCCVEGCSA-N 1 2 311.882 4.415 20 0 DIADLO FC1(F)C[N@@H+](C2Cc3ccccc3C2)CC[C@H]1c1ccccc1 ZINC001255028718 1062305553 /nfs/dbraw/zinc/30/55/53/1062305553.db2.gz BUCFSHQBLXSCEG-IBGZPJMESA-N 1 2 313.391 4.279 20 0 DIADLO FC1(F)C[N@H+](C2Cc3ccccc3C2)CC[C@H]1c1ccccc1 ZINC001255028718 1062305575 /nfs/dbraw/zinc/30/55/75/1062305575.db2.gz BUCFSHQBLXSCEG-IBGZPJMESA-N 1 2 313.391 4.279 20 0 DIADLO CC(C)O[C@H]1CCC[N@H+](Cc2c(F)ccc(F)c2Cl)C1 ZINC001474613388 1062331525 /nfs/dbraw/zinc/33/15/25/1062331525.db2.gz CSISVWHQTLFADP-NSHDSACASA-N 1 2 303.780 4.008 20 0 DIADLO CC(C)O[C@H]1CCC[N@@H+](Cc2c(F)ccc(F)c2Cl)C1 ZINC001474613388 1062331546 /nfs/dbraw/zinc/33/15/46/1062331546.db2.gz CSISVWHQTLFADP-NSHDSACASA-N 1 2 303.780 4.008 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1CCOc2ccccc2[C@H]1C ZINC001459718965 1062334523 /nfs/dbraw/zinc/33/45/23/1062334523.db2.gz OBVUEYPNTIHYCY-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1CCOc2ccccc2[C@H]1C ZINC001459718965 1062334544 /nfs/dbraw/zinc/33/45/44/1062334544.db2.gz OBVUEYPNTIHYCY-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO c1ccc(N2CCC(Nc3c[nH+]cc4c3CCCC4)CC2)cc1 ZINC001474624416 1062346167 /nfs/dbraw/zinc/34/61/67/1062346167.db2.gz SSRWZFGECJNZBN-UHFFFAOYSA-N 1 2 307.441 4.041 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC001474635758 1062361008 /nfs/dbraw/zinc/36/10/08/1062361008.db2.gz DSUAJSTZEFDUFX-PIGZYNQJSA-N 1 2 315.404 4.130 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[N@@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC001474635758 1062361032 /nfs/dbraw/zinc/36/10/32/1062361032.db2.gz DSUAJSTZEFDUFX-PIGZYNQJSA-N 1 2 315.404 4.130 20 0 DIADLO COC1CCC(CNc2ccc(Nc3ccccc3)c[nH+]2)CC1 ZINC001474637370 1062362359 /nfs/dbraw/zinc/36/23/59/1062362359.db2.gz YMJQEEDMPOGINQ-UHFFFAOYSA-N 1 2 311.429 4.442 20 0 DIADLO CCCC[C@@H](C)N(C)C(=O)[C@H]1CC[C@@H](Nc2cccc[nH+]2)CC1 ZINC001468691874 1062381447 /nfs/dbraw/zinc/38/14/47/1062381447.db2.gz HXPLFAPRUGRWQC-ZACQAIPSSA-N 1 2 317.477 4.089 20 0 DIADLO C/C=C/C[C@H]1CCC[N@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001474652031 1062382979 /nfs/dbraw/zinc/38/29/79/1062382979.db2.gz AZYZZGPPTJZQRS-VUDBWIFFSA-N 1 2 304.381 4.340 20 0 DIADLO C/C=C/C[C@H]1CCC[N@@H+](Cc2csc(C(F)(F)F)n2)C1 ZINC001474652031 1062382998 /nfs/dbraw/zinc/38/29/98/1062382998.db2.gz AZYZZGPPTJZQRS-VUDBWIFFSA-N 1 2 304.381 4.340 20 0 DIADLO Cc1nc(C[N@H+]2[C@H](C)c3ccc(F)cc3C[C@@H]2C)sc1C ZINC001459772976 1062386911 /nfs/dbraw/zinc/38/69/11/1062386911.db2.gz FEHOESZYZSDWME-CMPLNLGQSA-N 1 2 304.434 4.407 20 0 DIADLO Cc1nc(C[N@@H+]2[C@H](C)c3ccc(F)cc3C[C@@H]2C)sc1C ZINC001459772976 1062386931 /nfs/dbraw/zinc/38/69/31/1062386931.db2.gz FEHOESZYZSDWME-CMPLNLGQSA-N 1 2 304.434 4.407 20 0 DIADLO Cc1cccc(Oc2cccc(NCc3ccc[nH+]c3N)c2)c1 ZINC001474677040 1062408193 /nfs/dbraw/zinc/40/81/93/1062408193.db2.gz BIXXZKPEYPBBKN-UHFFFAOYSA-N 1 2 305.381 4.377 20 0 DIADLO Fc1cccc(/C=C\C[N@@H+]2CCc3cc(F)c(F)cc3C2)c1 ZINC001474685511 1062416387 /nfs/dbraw/zinc/41/63/87/1062416387.db2.gz SCUCFGCRGQWRDB-RQOWECAXSA-N 1 2 303.327 4.175 20 0 DIADLO Fc1cccc(/C=C\C[N@H+]2CCc3cc(F)c(F)cc3C2)c1 ZINC001474685511 1062416400 /nfs/dbraw/zinc/41/64/00/1062416400.db2.gz SCUCFGCRGQWRDB-RQOWECAXSA-N 1 2 303.327 4.175 20 0 DIADLO CC(C)C[N@H+](Cc1ccccn1)Cc1cncc(Cl)c1Cl ZINC001474719326 1062444534 /nfs/dbraw/zinc/44/45/34/1062444534.db2.gz VAVRGHQXIABEHN-UHFFFAOYSA-N 1 2 324.255 4.442 20 0 DIADLO CC(C)C[N@@H+](Cc1ccccn1)Cc1cncc(Cl)c1Cl ZINC001474719326 1062444541 /nfs/dbraw/zinc/44/45/41/1062444541.db2.gz VAVRGHQXIABEHN-UHFFFAOYSA-N 1 2 324.255 4.442 20 0 DIADLO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1nsc2ccccc12 ZINC001459842579 1062444664 /nfs/dbraw/zinc/44/46/64/1062444664.db2.gz NUPOLAKANULEDI-LLVKDONJSA-N 1 2 316.401 4.295 20 0 DIADLO CC(C)(C)OC(=O)[C@H](Cc1ccccc1)[NH2+][C@H]1CCC(C)(C)C1 ZINC001474725315 1062447474 /nfs/dbraw/zinc/44/74/74/1062447474.db2.gz CTCWOFNMWKBKAO-IRXDYDNUSA-N 1 2 317.473 4.108 20 0 DIADLO C[C@H]([NH2+]Cc1nsc2ccccc12)c1cccc(F)c1F ZINC001459860426 1062454548 /nfs/dbraw/zinc/45/45/48/1062454548.db2.gz WDFKKGCUFAGCIS-JTQLQIEISA-N 1 2 304.365 4.425 20 0 DIADLO Fc1ccc(OC2C[NH+](C3CCC(C(F)(F)F)CC3)C2)cc1 ZINC001255521020 1062472128 /nfs/dbraw/zinc/47/21/28/1062472128.db2.gz QKLBSJWFPRSNLW-UHFFFAOYSA-N 1 2 317.326 4.010 20 0 DIADLO FC(F)[C@@H]1CCC[N@@H+]1CCCc1ccc(C(F)(F)F)cc1 ZINC001459890278 1062475554 /nfs/dbraw/zinc/47/55/54/1062475554.db2.gz AWBYOSVICCJRRV-ZDUSSCGKSA-N 1 2 307.306 4.368 20 0 DIADLO FC(F)[C@@H]1CCC[N@H+]1CCCc1ccc(C(F)(F)F)cc1 ZINC001459890278 1062475575 /nfs/dbraw/zinc/47/55/75/1062475575.db2.gz AWBYOSVICCJRRV-ZDUSSCGKSA-N 1 2 307.306 4.368 20 0 DIADLO C[C@@H](CC(F)(F)F)[N@@H+]1CCc2cc(Br)ccc2C1 ZINC001255646578 1062498310 /nfs/dbraw/zinc/49/83/10/1062498310.db2.gz OYYVZYJZGGKITG-VIFPVBQESA-N 1 2 322.168 4.148 20 0 DIADLO C[C@@H](CC(F)(F)F)[N@H+]1CCc2cc(Br)ccc2C1 ZINC001255646578 1062498323 /nfs/dbraw/zinc/49/83/23/1062498323.db2.gz OYYVZYJZGGKITG-VIFPVBQESA-N 1 2 322.168 4.148 20 0 DIADLO COc1ccc(Cl)cc1C[N@@H+]1Cc2ccccc2OC[C@@H]1C ZINC001459930907 1062504344 /nfs/dbraw/zinc/50/43/44/1062504344.db2.gz FPPFZWUJXDCZMD-ZDUSSCGKSA-N 1 2 317.816 4.132 20 0 DIADLO COc1ccc(Cl)cc1C[N@H+]1Cc2ccccc2OC[C@@H]1C ZINC001459930907 1062504350 /nfs/dbraw/zinc/50/43/50/1062504350.db2.gz FPPFZWUJXDCZMD-ZDUSSCGKSA-N 1 2 317.816 4.132 20 0 DIADLO COC(=O)[C@@H](CC(C)C)[NH2+][C@@H]1CC(C)(C)CCc2ccccc21 ZINC001460003664 1062559505 /nfs/dbraw/zinc/55/95/05/1062559505.db2.gz FWHZARDVRNBCCX-QZTJIDSGSA-N 1 2 317.473 4.268 20 0 DIADLO FC(F)(F)c1cccc([C@@]2(F)CC[N@H+](C/C=C/Cl)C2)c1 ZINC001460003218 1062560601 /nfs/dbraw/zinc/56/06/01/1062560601.db2.gz NWUXPZCXCZJUFS-ZABGRMTBSA-N 1 2 307.718 4.328 20 0 DIADLO FC(F)(F)c1cccc([C@@]2(F)CC[N@@H+](C/C=C/Cl)C2)c1 ZINC001460003218 1062560619 /nfs/dbraw/zinc/56/06/19/1062560619.db2.gz NWUXPZCXCZJUFS-ZABGRMTBSA-N 1 2 307.718 4.328 20 0 DIADLO CCOC(=O)[C@H](CC)[NH2+][C@H]1CC(C)(C)CCc2ccccc21 ZINC001460009217 1062567798 /nfs/dbraw/zinc/56/77/98/1062567798.db2.gz WWVUDXXFOGWBQO-IRXDYDNUSA-N 1 2 303.446 4.022 20 0 DIADLO C[C@@H]1COCC[N@@H+]1Cc1cccc(SCc2ccccc2)c1 ZINC001460031113 1062585530 /nfs/dbraw/zinc/58/55/30/1062585530.db2.gz YMZYTCVCPYKFGU-MRXNPFEDSA-N 1 2 313.466 4.200 20 0 DIADLO C[C@@H]1COCC[N@H+]1Cc1cccc(SCc2ccccc2)c1 ZINC001460031113 1062585546 /nfs/dbraw/zinc/58/55/46/1062585546.db2.gz YMZYTCVCPYKFGU-MRXNPFEDSA-N 1 2 313.466 4.200 20 0 DIADLO CCNc1nc(C[N@@H+]2CCc3c(cccc3C(C)C)C2)cs1 ZINC001460049084 1062599476 /nfs/dbraw/zinc/59/94/76/1062599476.db2.gz SZEBLGMAWFPVIT-UHFFFAOYSA-N 1 2 315.486 4.257 20 0 DIADLO CCNc1nc(C[N@H+]2CCc3c(cccc3C(C)C)C2)cs1 ZINC001460049084 1062599493 /nfs/dbraw/zinc/59/94/93/1062599493.db2.gz SZEBLGMAWFPVIT-UHFFFAOYSA-N 1 2 315.486 4.257 20 0 DIADLO Cc1cc(CNC(=O)Nc2ccc(CC(C)C)cc2)cc(C)[nH+]1 ZINC001476270095 1062615914 /nfs/dbraw/zinc/61/59/14/1062615914.db2.gz ATHPYSZCYGIJIC-UHFFFAOYSA-N 1 2 311.429 4.219 20 0 DIADLO CCSc1ccccc1C[N@@H+]1CCCC[C@H]1c1nc(C)no1 ZINC001460073669 1062618083 /nfs/dbraw/zinc/61/80/83/1062618083.db2.gz SCWKKEAOIAYEOY-HNNXBMFYSA-N 1 2 317.458 4.217 20 0 DIADLO CCSc1ccccc1C[N@H+]1CCCC[C@H]1c1nc(C)no1 ZINC001460073669 1062618094 /nfs/dbraw/zinc/61/80/94/1062618094.db2.gz SCWKKEAOIAYEOY-HNNXBMFYSA-N 1 2 317.458 4.217 20 0 DIADLO Cc1cc(NC(=O)N[C@H]2CCC[C@H](C(C)(C)C)CC2)c(C)c[nH+]1 ZINC001476303924 1062628056 /nfs/dbraw/zinc/62/80/56/1062628056.db2.gz VMYXSXANXRRCET-HOTGVXAUSA-N 1 2 317.477 4.237 20 0 DIADLO Clc1cc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c(Cl)s1 ZINC001460096917 1062635096 /nfs/dbraw/zinc/63/50/96/1062635096.db2.gz ZWAORZXUPXRQHL-MNOVXSKESA-N 1 2 306.258 4.198 20 0 DIADLO Clc1cc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c(Cl)s1 ZINC001460096917 1062635112 /nfs/dbraw/zinc/63/51/12/1062635112.db2.gz ZWAORZXUPXRQHL-MNOVXSKESA-N 1 2 306.258 4.198 20 0 DIADLO Fc1ccccc1Oc1ccc(C[N@H+]2CC[C@@H](F)C2)cc1F ZINC001460136789 1062653488 /nfs/dbraw/zinc/65/34/88/1062653488.db2.gz SOYUFZGMJSHFIX-CYBMUJFWSA-N 1 2 307.315 4.301 20 0 DIADLO Fc1ccccc1Oc1ccc(C[N@@H+]2CC[C@@H](F)C2)cc1F ZINC001460136789 1062653495 /nfs/dbraw/zinc/65/34/95/1062653495.db2.gz SOYUFZGMJSHFIX-CYBMUJFWSA-N 1 2 307.315 4.301 20 0 DIADLO CC(C)CC1(CNC(=O)Nc2ccn3cc[nH+]c3c2)CCCC1 ZINC001476532874 1062675153 /nfs/dbraw/zinc/67/51/53/1062675153.db2.gz CLKKZCOHCUQASI-UHFFFAOYSA-N 1 2 314.433 4.062 20 0 DIADLO COc1cccc(C[N@@H+]2CCc3c(Cl)cc(F)cc3C2)c1 ZINC001460174721 1062678186 /nfs/dbraw/zinc/67/81/86/1062678186.db2.gz AQKCOHWHCRGCDX-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO COc1cccc(C[N@H+]2CCc3c(Cl)cc(F)cc3C2)c1 ZINC001460174721 1062678195 /nfs/dbraw/zinc/67/81/95/1062678195.db2.gz AQKCOHWHCRGCDX-UHFFFAOYSA-N 1 2 305.780 4.046 20 0 DIADLO O=C(C[NH2+][C@@H]1CCC[C@H](c2ccccc2)C1)OCc1ccccc1 ZINC001256106179 1062705578 /nfs/dbraw/zinc/70/55/78/1062705578.db2.gz FFWKRCZQJITNMH-VQTJNVASSA-N 1 2 323.436 4.046 20 0 DIADLO CCON(Cc1ccccc1)Cc1ccc(-n2cc[nH+]c2)cc1C ZINC001460250754 1062730245 /nfs/dbraw/zinc/73/02/45/1062730245.db2.gz ZCXZVWFOHNRDIR-UHFFFAOYSA-N 1 2 321.424 4.134 20 0 DIADLO C[C@H](NC(=O)Nc1ccc2[nH+]ccn2c1)c1cccc(C2CC2)c1 ZINC001476897557 1062742494 /nfs/dbraw/zinc/74/24/94/1062742494.db2.gz HZTIPDSFGNAJRX-ZDUSSCGKSA-N 1 2 320.396 4.094 20 0 DIADLO CCCCC1CCC(NC(=O)Nc2ccc3[nH+]ccn3c2)CC1 ZINC001476897545 1062743347 /nfs/dbraw/zinc/74/33/47/1062743347.db2.gz HLHBTHMKSMSLNJ-UHFFFAOYSA-N 1 2 314.433 4.205 20 0 DIADLO CCCCC[C@@H]1CCCCN1C(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001470393930 1062770797 /nfs/dbraw/zinc/77/07/97/1062770797.db2.gz JFRLDYUEPUNKNJ-QZTJIDSGSA-N 1 2 319.493 4.432 20 0 DIADLO Cc1cccc(Cl)c1C[N@@H+]1[C@H](C)CC[C@@H]1C(=O)OC(C)(C)C ZINC001460358520 1062802597 /nfs/dbraw/zinc/80/25/97/1062802597.db2.gz XFMGVVZQZCCQDA-CZUORRHYSA-N 1 2 323.864 4.343 20 0 DIADLO Cc1cccc(Cl)c1C[N@H+]1[C@H](C)CC[C@@H]1C(=O)OC(C)(C)C ZINC001460358520 1062802623 /nfs/dbraw/zinc/80/26/23/1062802623.db2.gz XFMGVVZQZCCQDA-CZUORRHYSA-N 1 2 323.864 4.343 20 0 DIADLO CCC(CC)CCCN(C)C(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC001470545416 1062809832 /nfs/dbraw/zinc/80/98/32/1062809832.db2.gz FXRLTQRUFISNSK-UHFFFAOYSA-N 1 2 313.445 4.161 20 0 DIADLO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1CCc1cccc(Cl)c1Cl ZINC001460371933 1062817855 /nfs/dbraw/zinc/81/78/55/1062817855.db2.gz RGERLBXUOBCPFV-KGLIPLIRSA-N 1 2 316.272 4.425 20 0 DIADLO CC[C@@H]1CO[C@@H](CC)C[N@H+]1CCc1cccc(Cl)c1Cl ZINC001460371933 1062817877 /nfs/dbraw/zinc/81/78/77/1062817877.db2.gz RGERLBXUOBCPFV-KGLIPLIRSA-N 1 2 316.272 4.425 20 0 DIADLO Brc1cccc([C@@H]2COCC[N@@H+]2CC2CCCC2)c1 ZINC001460438904 1062855973 /nfs/dbraw/zinc/85/59/73/1062855973.db2.gz BNRCNQJQXSZMKG-INIZCTEOSA-N 1 2 324.262 4.013 20 0 DIADLO Brc1cccc([C@@H]2COCC[N@H+]2CC2CCCC2)c1 ZINC001460438904 1062855995 /nfs/dbraw/zinc/85/59/95/1062855995.db2.gz BNRCNQJQXSZMKG-INIZCTEOSA-N 1 2 324.262 4.013 20 0 DIADLO CC(C)c1cccc(C[N@@H+]2C[C@@H](C)O[C@@H](CC(F)(F)F)C2)c1 ZINC001460487598 1062876200 /nfs/dbraw/zinc/87/62/00/1062876200.db2.gz WZFAINBKUUGODZ-CJNGLKHVSA-N 1 2 315.379 4.352 20 0 DIADLO CC(C)c1cccc(C[N@H+]2C[C@@H](C)O[C@@H](CC(F)(F)F)C2)c1 ZINC001460487598 1062876226 /nfs/dbraw/zinc/87/62/26/1062876226.db2.gz WZFAINBKUUGODZ-CJNGLKHVSA-N 1 2 315.379 4.352 20 0 DIADLO Cc1ccc(-c2nnc([C@H]3Cc4ccccc4C[N@H+]3C)o2)cc1C ZINC001256567060 1062891006 /nfs/dbraw/zinc/89/10/06/1062891006.db2.gz CQMFTUKNFXLJSF-GOSISDBHSA-N 1 2 319.408 4.083 20 0 DIADLO Cc1ccc(-c2nnc([C@H]3Cc4ccccc4C[N@@H+]3C)o2)cc1C ZINC001256567060 1062891033 /nfs/dbraw/zinc/89/10/33/1062891033.db2.gz CQMFTUKNFXLJSF-GOSISDBHSA-N 1 2 319.408 4.083 20 0 DIADLO COC(=O)[C@@H](c1ccccc1F)[N@H+](C)C[C@@H](C)C1CCCCC1 ZINC001460598284 1062926626 /nfs/dbraw/zinc/92/66/26/1062926626.db2.gz MNHAFPNFXZLFRB-RDTXWAMCSA-N 1 2 321.436 4.188 20 0 DIADLO COC(=O)[C@@H](c1ccccc1F)[N@@H+](C)C[C@@H](C)C1CCCCC1 ZINC001460598284 1062926652 /nfs/dbraw/zinc/92/66/52/1062926652.db2.gz MNHAFPNFXZLFRB-RDTXWAMCSA-N 1 2 321.436 4.188 20 0 DIADLO C[C@@H]1C[C@@H]1c1nnc([C@@H](c2ccc(Cl)cc2)[NH+]2CCCC2)o1 ZINC001256681752 1062944137 /nfs/dbraw/zinc/94/41/37/1062944137.db2.gz DJVGLJRZRIKWIX-BYCMXARLSA-N 1 2 317.820 4.032 20 0 DIADLO O=C(Nc1ccn2cc[nH+]c2c1)c1cc(Cl)cc2ccccc21 ZINC001460689010 1062986163 /nfs/dbraw/zinc/98/61/63/1062986163.db2.gz ONGPYKHUYYXAQU-UHFFFAOYSA-N 1 2 321.767 4.393 20 0 DIADLO CC(C)(C)Cc1ccccc1C(=O)Nc1ccn2cc[nH+]c2c1 ZINC001460688957 1062989657 /nfs/dbraw/zinc/98/96/57/1062989657.db2.gz NXUAKPWSZDALDY-UHFFFAOYSA-N 1 2 307.397 4.175 20 0 DIADLO CCCCC[C@H](NC(=O)NCc1c[nH+]c(C)cc1C)C(C)(C)C ZINC001477884559 1063005908 /nfs/dbraw/zinc/00/59/08/1063005908.db2.gz YRFZIUWMQQVGOF-KRWDZBQOSA-N 1 2 319.493 4.493 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)CC/C=C\c2ccccc2)[nH+]c1C ZINC001471859691 1063027489 /nfs/dbraw/zinc/02/74/89/1063027489.db2.gz RPQXLXIYCKENLR-HJLMUGLJSA-N 1 2 323.440 4.184 20 0 DIADLO O=C(Nc1ccc(C(F)F)cc1)c1ccc(-n2cc[nH+]c2)cc1 ZINC001472164015 1063054452 /nfs/dbraw/zinc/05/44/52/1063054452.db2.gz VJMULCVYPBCRSI-UHFFFAOYSA-N 1 2 313.307 4.062 20 0 DIADLO CCCC[N@H+](Cc1c(C)oc(C)c1C)[C@H](C)C(=O)OCCC ZINC001460819129 1063080520 /nfs/dbraw/zinc/08/05/20/1063080520.db2.gz TWHUBECIZGALHX-CQSZACIVSA-N 1 2 309.450 4.149 20 0 DIADLO CCCC[N@@H+](Cc1c(C)oc(C)c1C)[C@H](C)C(=O)OCCC ZINC001460819129 1063080546 /nfs/dbraw/zinc/08/05/46/1063080546.db2.gz TWHUBECIZGALHX-CQSZACIVSA-N 1 2 309.450 4.149 20 0 DIADLO Cl/C=C(/Cl)C[N@@H+]1CCC[C@@]2(C=Cc3ccccc3O2)C1 ZINC001460862323 1063106751 /nfs/dbraw/zinc/10/67/51/1063106751.db2.gz VKOMINSJECUZCC-HFQYIWAZSA-N 1 2 310.224 4.246 20 0 DIADLO Cl/C=C(/Cl)C[N@H+]1CCC[C@@]2(C=Cc3ccccc3O2)C1 ZINC001460862323 1063106756 /nfs/dbraw/zinc/10/67/56/1063106756.db2.gz VKOMINSJECUZCC-HFQYIWAZSA-N 1 2 310.224 4.246 20 0 DIADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2Cl)on1)c1ccccn1 ZINC001460936723 1063145962 /nfs/dbraw/zinc/14/59/62/1063145962.db2.gz OVABVHHOTVSJRO-LBPRGKRZSA-N 1 2 313.788 4.241 20 0 DIADLO CCC[C@@H](Cc1ccccc1)Nc1nc(C)[nH+]c2c1CCCC2 ZINC001472684811 1063147909 /nfs/dbraw/zinc/14/79/09/1063147909.db2.gz GZVYVJSNIWZQKI-KRWDZBQOSA-N 1 2 309.457 4.487 20 0 DIADLO CC(C)c1cc(NC[C@@](C)(O)c2ccccc2)nc(C(C)C)[nH+]1 ZINC001472696564 1063159275 /nfs/dbraw/zinc/15/92/75/1063159275.db2.gz MCHBGZBSXWZEIP-LJQANCHMSA-N 1 2 313.445 4.043 20 0 DIADLO Cc1cc(N(Cc2ccc(C)c(C)c2)C2CC2)nc(C2CC2)[nH+]1 ZINC001472704004 1063163418 /nfs/dbraw/zinc/16/34/18/1063163418.db2.gz PNJPYUSFUFHWSC-UHFFFAOYSA-N 1 2 307.441 4.448 20 0 DIADLO Cc1cccc([C@@H](C)CNc2nc3ccccc3n3c[nH+]cc23)c1 ZINC001472702751 1063164855 /nfs/dbraw/zinc/16/48/55/1063164855.db2.gz LAGZENXGFAVINJ-HNNXBMFYSA-N 1 2 316.408 4.407 20 0 DIADLO CCc1cc(N[C@@H](Cc2ccc(F)cc2)C(C)C)nc(CC)[nH+]1 ZINC001472705743 1063166433 /nfs/dbraw/zinc/16/64/33/1063166433.db2.gz ALIUWLREHDTFOD-KRWDZBQOSA-N 1 2 315.436 4.420 20 0 DIADLO COc1ccc2cc(CC[C@H](C)[NH2+][C@@H]3CC3(F)F)ccc2c1 ZINC001257267923 1063169817 /nfs/dbraw/zinc/16/98/17/1063169817.db2.gz CRPWQQWCEQPAKN-YVEFUNNKSA-N 1 2 305.368 4.167 20 0 DIADLO O=c1[nH]ccc2oc(C[NH2+]Cc3ccc(Cl)cc3Cl)cc21 ZINC001461000029 1063174379 /nfs/dbraw/zinc/17/43/79/1063174379.db2.gz RVCXOSUDMSGFQN-UHFFFAOYSA-N 1 2 323.179 4.130 20 0 DIADLO CCC[C@H](C)[NH2+][C@@H](CCc1ccccc1)C(=O)OC(C)(C)C ZINC001257310269 1063196353 /nfs/dbraw/zinc/19/63/53/1063196353.db2.gz SPTGIIWZAOMONP-RDJZCZTQSA-N 1 2 305.462 4.108 20 0 DIADLO Cc1cc(CNc2cccc(OCc3cccnc3)c2)cc(C)[nH+]1 ZINC001461060895 1063224049 /nfs/dbraw/zinc/22/40/49/1063224049.db2.gz IVTINBBQAVXECS-UHFFFAOYSA-N 1 2 319.408 4.285 20 0 DIADLO Oc1cc(Cl)cc(CNc2ccc(N3CCCCC3)c[nH+]2)c1 ZINC001461083637 1063240501 /nfs/dbraw/zinc/24/05/01/1063240501.db2.gz TWBAJQODLTYOSD-UHFFFAOYSA-N 1 2 317.820 4.043 20 0 DIADLO CCCCCC[C@H](C)[N@H+]1Cc2nnc(C(F)(F)F)n2[C@H](C)C1 ZINC001257373987 1063240740 /nfs/dbraw/zinc/24/07/40/1063240740.db2.gz XVKDIRVIUJHBBH-NWDGAFQWSA-N 1 2 318.387 4.032 20 0 DIADLO CCCCCC[C@H](C)[N@@H+]1Cc2nnc(C(F)(F)F)n2[C@H](C)C1 ZINC001257373987 1063240757 /nfs/dbraw/zinc/24/07/57/1063240757.db2.gz XVKDIRVIUJHBBH-NWDGAFQWSA-N 1 2 318.387 4.032 20 0 DIADLO CCc1cc(N2CC3(CCC3)[C@H]2c2ccccc2)nc(CC)[nH+]1 ZINC001472795725 1063244613 /nfs/dbraw/zinc/24/46/13/1063244613.db2.gz NEWWUUVSAIAMLF-LJQANCHMSA-N 1 2 307.441 4.333 20 0 DIADLO Cc1ccc2c(c1)[C@H](Nc1nc(C)[nH+]c3c1CCCC3)CCC2 ZINC001472795681 1063245264 /nfs/dbraw/zinc/24/52/64/1063245264.db2.gz LGQPQNGVWNUBCA-LJQANCHMSA-N 1 2 307.441 4.462 20 0 DIADLO COc1ccc(C)cc1[C@H](C)Nc1nc(C)[nH+]c2c1CCCC2 ZINC001472802556 1063250507 /nfs/dbraw/zinc/25/05/07/1063250507.db2.gz XFWHXPXUAWJRAJ-ZDUSSCGKSA-N 1 2 311.429 4.154 20 0 DIADLO CC[C@@H](CNc1nc2ccccc2n2c[nH+]cc12)CC(F)(F)F ZINC001472807716 1063253707 /nfs/dbraw/zinc/25/37/07/1063253707.db2.gz RYWZIOFKUQXLTK-LLVKDONJSA-N 1 2 322.334 4.273 20 0 DIADLO CCOc1ccc(C[NH2+]Cc2c(Cl)cccc2Cl)o1 ZINC001461112294 1063263022 /nfs/dbraw/zinc/26/30/22/1063263022.db2.gz LTJXJNNURUKEDP-UHFFFAOYSA-N 1 2 300.185 4.275 20 0 DIADLO FC[C@@H](Nc1nc2ccccc2n2c[nH+]cc12)c1ccc(F)cc1 ZINC001472858575 1063288843 /nfs/dbraw/zinc/28/88/43/1063288843.db2.gz DNRPVRSKAGVSCB-OAHLLOKOSA-N 1 2 324.334 4.144 20 0 DIADLO c1cn(C[C@H](Nc2nc3ccccc3s2)c2ccccc2)c[nH+]1 ZINC001472862939 1063290257 /nfs/dbraw/zinc/29/02/57/1063290257.db2.gz VOLQBXMNVLZQNP-INIZCTEOSA-N 1 2 320.421 4.346 20 0 DIADLO c1cn(C[C@@H](Nc2nc3ccccc3s2)c2ccccc2)c[nH+]1 ZINC001472862941 1063290319 /nfs/dbraw/zinc/29/03/19/1063290319.db2.gz VOLQBXMNVLZQNP-MRXNPFEDSA-N 1 2 320.421 4.346 20 0 DIADLO Cc1nc2c(cccc2CCNc2cc(C)[nH+]c(C3CCC3)n2)o1 ZINC001472871729 1063293600 /nfs/dbraw/zinc/29/36/00/1063293600.db2.gz NYAFPQQMNSUQQZ-UHFFFAOYSA-N 1 2 322.412 4.157 20 0 DIADLO CCC[C@@H]1CCCC[C@H]1CNC(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001478818330 1063298596 /nfs/dbraw/zinc/29/85/96/1063298596.db2.gz FRKFFYXLUXXXCW-MSOLQXFVSA-N 1 2 317.477 4.104 20 0 DIADLO Cc1cc(N[C@H]2CCSC3(CCC3)C2)nc(C2CCC2)[nH+]1 ZINC001472894450 1063302989 /nfs/dbraw/zinc/30/29/89/1063302989.db2.gz HAFBXGINQOUBIC-AWEZNQCLSA-N 1 2 303.475 4.283 20 0 DIADLO CCC[C@@H](C)CC[C@H](C)[N@@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001257484870 1063305014 /nfs/dbraw/zinc/30/50/14/1063305014.db2.gz FXJGNQDMCXIRQY-CVEARBPZSA-N 1 2 319.493 4.155 20 0 DIADLO CCC[C@@H](C)CC[C@H](C)[N@H+]1Cc2cnn(C3CCOCC3)c2C1 ZINC001257484870 1063305035 /nfs/dbraw/zinc/30/50/35/1063305035.db2.gz FXJGNQDMCXIRQY-CVEARBPZSA-N 1 2 319.493 4.155 20 0 DIADLO CCCCC[C@H](C)[NH2+][C@@H](c1nnc(C)o1)c1ccccc1OC ZINC001257506703 1063316802 /nfs/dbraw/zinc/31/68/02/1063316802.db2.gz SCJLNTYNBZBHHV-SUMWQHHRSA-N 1 2 317.433 4.034 20 0 DIADLO c1ccc(C[N@@H+]2CCC3CC2(c2nnc(C4CCCC4)o2)C3)cc1 ZINC001257537352 1063329793 /nfs/dbraw/zinc/32/97/93/1063329793.db2.gz FVMAULRQMBKLBC-UHFFFAOYSA-N 1 2 323.440 4.238 20 0 DIADLO c1ccc(C[N@H+]2CCC3CC2(c2nnc(C4CCCC4)o2)C3)cc1 ZINC001257537352 1063329807 /nfs/dbraw/zinc/32/98/07/1063329807.db2.gz FVMAULRQMBKLBC-UHFFFAOYSA-N 1 2 323.440 4.238 20 0 DIADLO C[NH+](C)[C@H](CNCc1cccc(F)c1F)c1ccc(Cl)cc1 ZINC001461266026 1063377782 /nfs/dbraw/zinc/37/77/82/1063377782.db2.gz RJNZZHZKUXFIOM-MRXNPFEDSA-N 1 2 324.802 4.011 20 0 DIADLO CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)Cn1c[nH+]c(C(C)(C)C)c1 ZINC001473070108 1063385365 /nfs/dbraw/zinc/38/53/65/1063385365.db2.gz QBCVECHFDCJBHP-OWCLPIDISA-N 1 2 320.477 4.185 20 0 DIADLO COc1ccccc1Cc1cn(C[C@H]2CCCCC2(F)F)c[nH+]1 ZINC001473101573 1063402578 /nfs/dbraw/zinc/40/25/78/1063402578.db2.gz VIBQSRWITQMTJH-OAHLLOKOSA-N 1 2 320.383 4.308 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC001473119062 1063422853 /nfs/dbraw/zinc/42/28/53/1063422853.db2.gz CNMUCRQGJUYNOQ-HNNXBMFYSA-N 1 2 311.425 4.146 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC001473119062 1063422866 /nfs/dbraw/zinc/42/28/66/1063422866.db2.gz CNMUCRQGJUYNOQ-HNNXBMFYSA-N 1 2 311.425 4.146 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3c(Cl)cncc3Cl)ccc21 ZINC001461333072 1063424415 /nfs/dbraw/zinc/42/44/15/1063424415.db2.gz YPBJVNJDFZPHNZ-UHFFFAOYSA-N 1 2 322.239 4.383 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3c(Cl)cncc3Cl)ccc21 ZINC001461333072 1063424423 /nfs/dbraw/zinc/42/44/23/1063424423.db2.gz YPBJVNJDFZPHNZ-UHFFFAOYSA-N 1 2 322.239 4.383 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3nccc4ccccc43)ccc21 ZINC001461332585 1063424710 /nfs/dbraw/zinc/42/47/10/1063424710.db2.gz SYQRSOFEBRODQH-UHFFFAOYSA-N 1 2 303.409 4.229 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3nccc4ccccc43)ccc21 ZINC001461332585 1063424716 /nfs/dbraw/zinc/42/47/16/1063424716.db2.gz SYQRSOFEBRODQH-UHFFFAOYSA-N 1 2 303.409 4.229 20 0 DIADLO CCCOC(=O)[C@H](C)[N@H+](C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC001473128937 1063433042 /nfs/dbraw/zinc/43/30/42/1063433042.db2.gz YQOYWFXJGWSRRV-QWRGUYRKSA-N 1 2 318.244 4.328 20 0 DIADLO CCCOC(=O)[C@H](C)[N@@H+](C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC001473128937 1063433050 /nfs/dbraw/zinc/43/30/50/1063433050.db2.gz YQOYWFXJGWSRRV-QWRGUYRKSA-N 1 2 318.244 4.328 20 0 DIADLO CCCC[N@H+](Cc1snnc1C)Cc1ccccc1Cl ZINC001473141061 1063446347 /nfs/dbraw/zinc/44/63/47/1063446347.db2.gz MHOYYJSBRIXYCR-UHFFFAOYSA-N 1 2 309.866 4.302 20 0 DIADLO CCCC[N@@H+](Cc1snnc1C)Cc1ccccc1Cl ZINC001473141061 1063446354 /nfs/dbraw/zinc/44/63/54/1063446354.db2.gz MHOYYJSBRIXYCR-UHFFFAOYSA-N 1 2 309.866 4.302 20 0 DIADLO CCCC[N@H+](Cc1nn(C)cc1C)Cc1ccccc1Cl ZINC001473142349 1063449020 /nfs/dbraw/zinc/44/90/20/1063449020.db2.gz IFSWSXBVZSDLFI-UHFFFAOYSA-N 1 2 305.853 4.184 20 0 DIADLO CCCC[N@@H+](Cc1nn(C)cc1C)Cc1ccccc1Cl ZINC001473142349 1063449028 /nfs/dbraw/zinc/44/90/28/1063449028.db2.gz IFSWSXBVZSDLFI-UHFFFAOYSA-N 1 2 305.853 4.184 20 0 DIADLO CCN(CC)c1ccc(NCc2cc(F)cc3cccnc32)c[nH+]1 ZINC001461367536 1063449645 /nfs/dbraw/zinc/44/96/45/1063449645.db2.gz WOYKIXMGKLCBLX-UHFFFAOYSA-N 1 2 324.403 4.227 20 0 DIADLO COc1ncccc1C[N@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC001473148828 1063451701 /nfs/dbraw/zinc/45/17/01/1063451701.db2.gz IYUPVLZEBWWHFV-ZDUSSCGKSA-N 1 2 316.832 4.469 20 0 DIADLO COc1ncccc1C[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC001473148828 1063451717 /nfs/dbraw/zinc/45/17/17/1063451717.db2.gz IYUPVLZEBWWHFV-ZDUSSCGKSA-N 1 2 316.832 4.469 20 0 DIADLO c1cc2c(cc1CNc1ccc(N3CCCCC3)[nH+]c1)CCCO2 ZINC001461374347 1063454716 /nfs/dbraw/zinc/45/47/16/1063454716.db2.gz YUCDMIAZIZEYOK-UHFFFAOYSA-N 1 2 323.440 4.009 20 0 DIADLO c1cnc2cccc(CNc3ccc(N4CCCCC4)[nH+]c3)c2c1 ZINC001461372274 1063454972 /nfs/dbraw/zinc/45/49/72/1063454972.db2.gz AVZXIADVYDCYTG-UHFFFAOYSA-N 1 2 318.424 4.232 20 0 DIADLO Cc1cc(NCc2nc3c(s2)C[C@H](C)CC3)ccc1[NH+](C)C ZINC001461390641 1063469074 /nfs/dbraw/zinc/46/90/74/1063469074.db2.gz JCOPJNFYQSKBBF-GFCCVEGCSA-N 1 2 315.486 4.254 20 0 DIADLO Cc1nn(C(C)(C)C)c(C)c1CNc1ccc([NH+](C)C)c(C)c1 ZINC001461392526 1063470695 /nfs/dbraw/zinc/47/06/95/1063470695.db2.gz RCKVNOQPFJSLQN-UHFFFAOYSA-N 1 2 314.477 4.241 20 0 DIADLO CCOCc1cnc2n1CC[N@H+]([C@H](C)C[C@H](C)CC(C)C)[C@H]2C ZINC001258066428 1063493209 /nfs/dbraw/zinc/49/32/09/1063493209.db2.gz QKRVKAFDYLCIRG-ZACQAIPSSA-N 1 2 321.509 4.257 20 0 DIADLO CCOCc1cnc2n1CC[N@@H+]([C@H](C)C[C@H](C)CC(C)C)[C@H]2C ZINC001258066428 1063493221 /nfs/dbraw/zinc/49/32/21/1063493221.db2.gz QKRVKAFDYLCIRG-ZACQAIPSSA-N 1 2 321.509 4.257 20 0 DIADLO COc1c2ccccc2oc1C[NH2+]Cc1c(F)cc(C)cc1F ZINC001461442523 1063507327 /nfs/dbraw/zinc/50/73/27/1063507327.db2.gz RJMIEMNNQSOHKR-UHFFFAOYSA-N 1 2 317.335 4.318 20 0 DIADLO C[C@H](Cc1ccco1)[NH2+][C@H](C(=O)OC(C)(C)C)C1CCCCC1 ZINC001258178637 1063545691 /nfs/dbraw/zinc/54/56/91/1063545691.db2.gz DZJYALJIISYLQZ-PBHICJAKSA-N 1 2 321.461 4.091 20 0 DIADLO CCOc1ccc(Cl)c(NCc2c[nH+]c3c(C)cccn23)c1 ZINC001461512195 1063545905 /nfs/dbraw/zinc/54/59/05/1063545905.db2.gz FNSUXHSRYSQVMJ-UHFFFAOYSA-N 1 2 315.804 4.307 20 0 DIADLO Cc1cc(C)c(CNc2ccc(-c3cnn(C)c3)c(C)[nH+]2)cc1C ZINC001461518474 1063550976 /nfs/dbraw/zinc/55/09/76/1063550976.db2.gz ASAXPGFYKXXEGE-UHFFFAOYSA-N 1 2 320.440 4.328 20 0 DIADLO Cc1oc(-c2cccs2)nc1C[NH2+]Cc1ccc(C)c(C)n1 ZINC001461567740 1063584208 /nfs/dbraw/zinc/58/42/08/1063584208.db2.gz UALUSAXKZDTQOB-UHFFFAOYSA-N 1 2 313.426 4.013 20 0 DIADLO CCCn1c(C[NH2+][C@@H]2C[C@]2(F)c2ccccc2)nc2ccccc21 ZINC001461594796 1063602099 /nfs/dbraw/zinc/60/20/99/1063602099.db2.gz QDGLEKUZRKSIKS-QUCCMNQESA-N 1 2 323.415 4.173 20 0 DIADLO FC(F)(F)Oc1cccc(CNc2cc3cc[nH]c3c[nH+]2)c1 ZINC001461602833 1063606191 /nfs/dbraw/zinc/60/61/91/1063606191.db2.gz BSHLPCHOHGSQMN-UHFFFAOYSA-N 1 2 307.275 4.074 20 0 DIADLO c1csc(-c2ncc(CNc3cc4cc[nH]c4c[nH+]3)s2)c1 ZINC001461608781 1063609442 /nfs/dbraw/zinc/60/94/42/1063609442.db2.gz PGSVSETYOGRISA-UHFFFAOYSA-N 1 2 312.423 4.360 20 0 DIADLO Cc1c[nH]nc1CNc1[nH+]c2ccccc2n1C1CCCCC1 ZINC001461719048 1063675727 /nfs/dbraw/zinc/67/57/27/1063675727.db2.gz CVDCNLKKEFTXDG-UHFFFAOYSA-N 1 2 309.417 4.185 20 0 DIADLO CCCc1cccc(CNc2[nH+]c3ccccc3n2CCOC)c1 ZINC001461729507 1063683467 /nfs/dbraw/zinc/68/34/67/1063683467.db2.gz MOVHCVAVAVVOGI-UHFFFAOYSA-N 1 2 323.440 4.247 20 0 DIADLO CCOc1ccc(CNc2[nH]c3ccc(Cl)cc3[nH+]2)cc1 ZINC001461733112 1063686651 /nfs/dbraw/zinc/68/66/51/1063686651.db2.gz YRXAEUZUKNIPQB-UHFFFAOYSA-N 1 2 301.777 4.227 20 0 DIADLO COC(=O)[C@@H]([NH2+][C@@H]1CCC(C)(C)C1)c1cccc2ccccc21 ZINC001258596264 1063700683 /nfs/dbraw/zinc/70/06/83/1063700683.db2.gz GOCVFUJEMGAFMC-QAPCUYQASA-N 1 2 311.425 4.222 20 0 DIADLO CCC[C@@H](Cc1ccccc1)[NH2+]C(C)(C)C(=O)OC(C)(C)C ZINC001258652228 1063723521 /nfs/dbraw/zinc/72/35/21/1063723521.db2.gz QKBRWFGSFUAIOS-INIZCTEOSA-N 1 2 305.462 4.108 20 0 DIADLO CCCCC[C@@H](CCC)[N@@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001258668871 1063737766 /nfs/dbraw/zinc/73/77/66/1063737766.db2.gz FXROTSOHLAREQP-JKSUJKDBSA-N 1 2 307.482 4.155 20 0 DIADLO CCCCC[C@@H](CCC)[N@H+]1CCn2c(COC)cnc2[C@@H]1C ZINC001258668871 1063737777 /nfs/dbraw/zinc/73/77/77/1063737777.db2.gz FXROTSOHLAREQP-JKSUJKDBSA-N 1 2 307.482 4.155 20 0 DIADLO CC[N@H+](Cc1ccc2c(c1)C[C@@H](C)O2)Cc1c(F)cccc1F ZINC001461840903 1063747327 /nfs/dbraw/zinc/74/73/27/1063747327.db2.gz DALXXDRVRMPCNQ-CYBMUJFWSA-N 1 2 317.379 4.310 20 0 DIADLO CC[N@@H+](Cc1ccc2c(c1)C[C@@H](C)O2)Cc1c(F)cccc1F ZINC001461840903 1063747334 /nfs/dbraw/zinc/74/73/34/1063747334.db2.gz DALXXDRVRMPCNQ-CYBMUJFWSA-N 1 2 317.379 4.310 20 0 DIADLO CCCCC[C@H]1CCC[N@@H+]1Cc1nc(Br)cs1 ZINC001461865390 1063760242 /nfs/dbraw/zinc/76/02/42/1063760242.db2.gz UJSXNZGCRIJPEJ-NSHDSACASA-N 1 2 317.296 4.450 20 0 DIADLO CCCCC[C@H]1CCC[N@H+]1Cc1nc(Br)cs1 ZINC001461865390 1063760260 /nfs/dbraw/zinc/76/02/60/1063760260.db2.gz UJSXNZGCRIJPEJ-NSHDSACASA-N 1 2 317.296 4.450 20 0 DIADLO CCn1cnc(Cl)c1C[N@@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC001461875482 1063767158 /nfs/dbraw/zinc/76/71/58/1063767158.db2.gz UVCDHUYSLHNGRY-CHWSQXEVSA-N 1 2 307.825 4.123 20 0 DIADLO CCn1cnc(Cl)c1C[N@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC001461875482 1063767164 /nfs/dbraw/zinc/76/71/64/1063767164.db2.gz UVCDHUYSLHNGRY-CHWSQXEVSA-N 1 2 307.825 4.123 20 0 DIADLO Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)c(F)c1 ZINC001461922379 1063803306 /nfs/dbraw/zinc/80/33/06/1063803306.db2.gz XXYURXAWFSJUTK-CXAGYDPISA-N 1 2 305.418 4.158 20 0 DIADLO Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccsc3)C2)c(F)c1 ZINC001461922379 1063803318 /nfs/dbraw/zinc/80/33/18/1063803318.db2.gz XXYURXAWFSJUTK-CXAGYDPISA-N 1 2 305.418 4.158 20 0 DIADLO CCCC[C@H](CCC)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258763964 1063810238 /nfs/dbraw/zinc/81/02/38/1063810238.db2.gz ZMIFMKCBLFDZPT-LBPRGKRZSA-N 1 2 303.372 4.076 20 0 DIADLO CCCC[C@H](CCC)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258763964 1063810263 /nfs/dbraw/zinc/81/02/63/1063810263.db2.gz ZMIFMKCBLFDZPT-LBPRGKRZSA-N 1 2 303.372 4.076 20 0 DIADLO CCCC[C@@H](CCC)[N@@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258763963 1063811016 /nfs/dbraw/zinc/81/10/16/1063811016.db2.gz ZMIFMKCBLFDZPT-GFCCVEGCSA-N 1 2 303.372 4.076 20 0 DIADLO CCCC[C@@H](CCC)[N@H+]1CCn2cc(C(F)(F)F)nc2C1 ZINC001258763963 1063811029 /nfs/dbraw/zinc/81/10/29/1063811029.db2.gz ZMIFMKCBLFDZPT-GFCCVEGCSA-N 1 2 303.372 4.076 20 0 DIADLO CCCC[C@H](CCC)[N@H+]1Cc2nnc(C(F)(F)F)n2[C@H](C)C1 ZINC001258767681 1063811848 /nfs/dbraw/zinc/81/18/48/1063811848.db2.gz XBUVUROTNRTLAF-NEPJUHHUSA-N 1 2 318.387 4.032 20 0 DIADLO CCCC[C@H](CCC)[N@@H+]1Cc2nnc(C(F)(F)F)n2[C@H](C)C1 ZINC001258767681 1063811868 /nfs/dbraw/zinc/81/18/68/1063811868.db2.gz XBUVUROTNRTLAF-NEPJUHHUSA-N 1 2 318.387 4.032 20 0 DIADLO CCCC[C@H](CCC)[N@H+]1Cc2nnc(C(F)(F)F)n2[C@@H](C)C1 ZINC001258767683 1063813833 /nfs/dbraw/zinc/81/38/33/1063813833.db2.gz XBUVUROTNRTLAF-RYUDHWBXSA-N 1 2 318.387 4.032 20 0 DIADLO CCCC[C@H](CCC)[N@@H+]1Cc2nnc(C(F)(F)F)n2[C@@H](C)C1 ZINC001258767683 1063813842 /nfs/dbraw/zinc/81/38/42/1063813842.db2.gz XBUVUROTNRTLAF-RYUDHWBXSA-N 1 2 318.387 4.032 20 0 DIADLO COCc1csc(C[N@@H+]2CCc3c(F)cc(F)cc3[C@H]2C)c1 ZINC001461929929 1063816978 /nfs/dbraw/zinc/81/69/78/1063816978.db2.gz QGIGKUPCDNLAQM-LLVKDONJSA-N 1 2 323.408 4.292 20 0 DIADLO COCc1csc(C[N@H+]2CCc3c(F)cc(F)cc3[C@H]2C)c1 ZINC001461929929 1063816984 /nfs/dbraw/zinc/81/69/84/1063816984.db2.gz QGIGKUPCDNLAQM-LLVKDONJSA-N 1 2 323.408 4.292 20 0 DIADLO CSc1ccc(C[N@@H+]2C[C@@H](c3ccccc3C)OC[C@H]2C)o1 ZINC001461936946 1063823635 /nfs/dbraw/zinc/82/36/35/1063823635.db2.gz SZUHNMFCPCACTR-PBHICJAKSA-N 1 2 317.454 4.272 20 0 DIADLO CSc1ccc(C[N@H+]2C[C@@H](c3ccccc3C)OC[C@H]2C)o1 ZINC001461936946 1063823649 /nfs/dbraw/zinc/82/36/49/1063823649.db2.gz SZUHNMFCPCACTR-PBHICJAKSA-N 1 2 317.454 4.272 20 0 DIADLO Cc1occc1C[N@@H+](C)Cc1cccc(F)c1OC(F)(F)F ZINC001461955053 1063835454 /nfs/dbraw/zinc/83/54/54/1063835454.db2.gz LDXBDXDYBDSSKO-UHFFFAOYSA-N 1 2 317.282 4.258 20 0 DIADLO Cc1occc1C[N@H+](C)Cc1cccc(F)c1OC(F)(F)F ZINC001461955053 1063835471 /nfs/dbraw/zinc/83/54/71/1063835471.db2.gz LDXBDXDYBDSSKO-UHFFFAOYSA-N 1 2 317.282 4.258 20 0 DIADLO CC[C@H]1C[N@H+](Cc2ccc(C(F)(F)F)nc2Cl)CCS1 ZINC001461960310 1063840800 /nfs/dbraw/zinc/84/08/00/1063840800.db2.gz OSEKYBPUDJVPHI-JTQLQIEISA-N 1 2 324.799 4.081 20 0 DIADLO CC[C@H]1C[N@@H+](Cc2ccc(C(F)(F)F)nc2Cl)CCS1 ZINC001461960310 1063840816 /nfs/dbraw/zinc/84/08/16/1063840816.db2.gz OSEKYBPUDJVPHI-JTQLQIEISA-N 1 2 324.799 4.081 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2cc(F)cc(C(F)(F)F)c2)CCS1 ZINC001461964993 1063846073 /nfs/dbraw/zinc/84/60/73/1063846073.db2.gz YRGGRIVZYJJBDK-CYBMUJFWSA-N 1 2 307.356 4.172 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2cc(F)cc(C(F)(F)F)c2)CCS1 ZINC001461964993 1063846089 /nfs/dbraw/zinc/84/60/89/1063846089.db2.gz YRGGRIVZYJJBDK-CYBMUJFWSA-N 1 2 307.356 4.172 20 0 DIADLO C[C@H]([NH2+][C@H]1CC[C@H](c2ccc(Cl)cc2)C1)C(=O)OC(C)(C)C ZINC001462016180 1063881603 /nfs/dbraw/zinc/88/16/03/1063881603.db2.gz ZAZOYCGNIBGQAB-NOLJZWGESA-N 1 2 323.864 4.296 20 0 DIADLO Cc1cc(C[N@H+](C)Cc2ccc(F)cc2F)c2c(n1)CCCC2 ZINC001462040068 1063895838 /nfs/dbraw/zinc/89/58/38/1063895838.db2.gz MKLJYKINWAIIFA-UHFFFAOYSA-N 1 2 316.395 4.179 20 0 DIADLO Cc1cc(C[N@@H+](C)Cc2ccc(F)cc2F)c2c(n1)CCCC2 ZINC001462040068 1063895845 /nfs/dbraw/zinc/89/58/45/1063895845.db2.gz MKLJYKINWAIIFA-UHFFFAOYSA-N 1 2 316.395 4.179 20 0 DIADLO Fc1ccccc1C[N@H+](Cc1ccnn1-c1ccccc1)C1CC1 ZINC001462044429 1063898530 /nfs/dbraw/zinc/89/85/30/1063898530.db2.gz CPVPFFMYHBOBRG-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO Fc1ccccc1C[N@@H+](Cc1ccnn1-c1ccccc1)C1CC1 ZINC001462044429 1063898548 /nfs/dbraw/zinc/89/85/48/1063898548.db2.gz CPVPFFMYHBOBRG-UHFFFAOYSA-N 1 2 321.399 4.176 20 0 DIADLO Cc1cc([C@@H](C)[NH2+]Cc2c(F)c(F)c(F)c(F)c2F)c(C)o1 ZINC001261256731 1063916632 /nfs/dbraw/zinc/91/66/32/1063916632.db2.gz RRJXBDMQWTUZAV-SSDOTTSWSA-N 1 2 319.273 4.443 20 0 DIADLO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(F)c(F)c1F ZINC001462089104 1063922912 /nfs/dbraw/zinc/92/29/12/1063922912.db2.gz BZFKYBHXBCLHQC-JTQLQIEISA-N 1 2 311.269 4.267 20 0 DIADLO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc(F)c(F)c1F ZINC001462089104 1063922921 /nfs/dbraw/zinc/92/29/21/1063922921.db2.gz BZFKYBHXBCLHQC-JTQLQIEISA-N 1 2 311.269 4.267 20 0 DIADLO CC[C@H](CC(F)F)C[N@@H+]1CCO[C@H](c2ccc(Cl)s2)C1 ZINC001261638380 1063940211 /nfs/dbraw/zinc/94/02/11/1063940211.db2.gz ZQJZVROLXDQPSV-MNOVXSKESA-N 1 2 323.836 4.456 20 0 DIADLO CC[C@H](CC(F)F)C[N@H+]1CCO[C@H](c2ccc(Cl)s2)C1 ZINC001261638380 1063940217 /nfs/dbraw/zinc/94/02/17/1063940217.db2.gz ZQJZVROLXDQPSV-MNOVXSKESA-N 1 2 323.836 4.456 20 0 DIADLO CCC(=O)Nc1ccc(NCc2cc(C)[nH+]c3c2CCCC3)cc1 ZINC001262480907 1063965179 /nfs/dbraw/zinc/96/51/79/1063965179.db2.gz ZWKDAWGPXJTGCG-UHFFFAOYSA-N 1 2 323.440 4.229 20 0 DIADLO COc1cccc(CCc2[nH]c3ccc(Cl)c(C)c3[nH+]2)c1 ZINC000587931334 1063999313 /nfs/dbraw/zinc/99/93/13/1063999313.db2.gz NVQLQPLEJNHPGJ-UHFFFAOYSA-N 1 2 300.789 4.319 20 0 DIADLO CC[NH+](CC)[C@H](C(=O)Oc1ccc(Cl)cc1)c1ccccc1 ZINC001264195983 1064032429 /nfs/dbraw/zinc/03/24/29/1064032429.db2.gz KPYXOUPKDKZAJH-KRWDZBQOSA-N 1 2 317.816 4.329 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1c(F)ccc(N)c1F ZINC000386986821 1064063280 /nfs/dbraw/zinc/06/32/80/1064063280.db2.gz UFNACPOACJPMKQ-SNVBAGLBSA-N 1 2 310.775 4.393 20 0 DIADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1c(F)ccc(N)c1F ZINC000386986821 1064063290 /nfs/dbraw/zinc/06/32/90/1064063290.db2.gz UFNACPOACJPMKQ-SNVBAGLBSA-N 1 2 310.775 4.393 20 0 DIADLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC001264340261 1064079414 /nfs/dbraw/zinc/07/94/14/1064079414.db2.gz NXTVIVADEYXQKT-IXDOHACOSA-N 1 2 323.440 4.417 20 0 DIADLO C/C(=C\C(=O)Nc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1C ZINC001290587564 1064701348 /nfs/dbraw/zinc/70/13/48/1064701348.db2.gz QIQYQASKDKHCNU-DTQAZKPQSA-N 1 2 317.392 4.223 20 0 DIADLO CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)[C@@H](CC(C)C)n1cc[nH+]c1 ZINC001292764515 1064786082 /nfs/dbraw/zinc/78/60/82/1064786082.db2.gz BHMBCCXIQZQEME-OKZBNKHCSA-N 1 2 319.493 4.191 20 0 DIADLO CC[C@H](C)C[C@H](C)NC(=O)C[N@H+](CC)Cc1ccccc1Cl ZINC001293941379 1064839832 /nfs/dbraw/zinc/83/98/32/1064839832.db2.gz FPIXKWDQTNBOGW-GJZGRUSLSA-N 1 2 324.896 4.103 20 0 DIADLO CC[C@H](C)C[C@H](C)NC(=O)C[N@@H+](CC)Cc1ccccc1Cl ZINC001293941379 1064839842 /nfs/dbraw/zinc/83/98/42/1064839842.db2.gz FPIXKWDQTNBOGW-GJZGRUSLSA-N 1 2 324.896 4.103 20 0 DIADLO Cc1[nH+]c[nH]c1CC(=O)N(CCC(C)C)[C@H](C)CCCC(C)C ZINC001294134775 1064848628 /nfs/dbraw/zinc/84/86/28/1064848628.db2.gz NNRIQJJEXVBBJG-MRXNPFEDSA-N 1 2 321.509 4.350 20 0 DIADLO Cc1[nH]c2ccc(NC(=O)[C@@]3(C)CCCc4ccccc43)cc2[nH+]1 ZINC001294767959 1064884864 /nfs/dbraw/zinc/88/48/64/1064884864.db2.gz HNFWVRLZSLOOEQ-FQEVSTJZSA-N 1 2 319.408 4.104 20 0 DIADLO CC(=CC(=O)Nc1ccc2[nH]c(C)[nH+]c2c1)c1cccc(F)c1 ZINC001294769470 1064885137 /nfs/dbraw/zinc/88/51/37/1064885137.db2.gz VFSWHHOFJYGEKN-DHZHZOJOSA-N 1 2 309.344 4.052 20 0 DIADLO Cc1cc(NC[C@@]2(O)CCCC(C)(C)CC2)nc(C2CCC2)[nH+]1 ZINC001307184196 1064901998 /nfs/dbraw/zinc/90/19/98/1064901998.db2.gz IGLYRRMAPRAAFQ-LJQANCHMSA-N 1 2 317.477 4.186 20 0 DIADLO Cc1nc(N2CC[C@H](C)[C@H]2c2ccccc2)c2c([nH+]1)CCCC2 ZINC001307208052 1064937278 /nfs/dbraw/zinc/93/72/78/1064937278.db2.gz SVGFQIPKTXYBAE-LIRRHRJNSA-N 1 2 307.441 4.251 20 0 DIADLO CCCn1cc[nH+]c1CCCN(C)C(=O)C[C@H](CC)C(C)(C)C ZINC001296345448 1064943624 /nfs/dbraw/zinc/94/36/24/1064943624.db2.gz AMTDQHOWSXAEMF-INIZCTEOSA-N 1 2 321.509 4.147 20 0 DIADLO Cc1cc(NC[C@@]2(c3ccccc3)CCCO2)nc(C2CCC2)[nH+]1 ZINC001307216707 1064961427 /nfs/dbraw/zinc/96/14/27/1064961427.db2.gz PLECGGWQWCMJJP-HXUWFJFHSA-N 1 2 323.440 4.170 20 0 DIADLO CC(C)C[C@H](C(=O)N1CC[C@@]1(C)C1CCCCC1)n1cc[nH+]c1 ZINC001302914475 1065101562 /nfs/dbraw/zinc/10/15/62/1065101562.db2.gz DYBVBCGPEGHEQF-MJGOQNOKSA-N 1 2 317.477 4.042 20 0 DIADLO C/C(=C/c1ccc(C)cc1)C(=O)N1CCC[C@H]1c1[nH]c(C)c(C)[nH+]1 ZINC001303608595 1065119200 /nfs/dbraw/zinc/11/92/00/1065119200.db2.gz JGTOEPFJAVGUKK-FFWXCITRSA-N 1 2 323.440 4.102 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2C(=O)c2ccc3ccccc3c2)[nH+]c1C ZINC001303604688 1065119541 /nfs/dbraw/zinc/11/95/41/1065119541.db2.gz BZCSLEYLGRFLPD-GOSISDBHSA-N 1 2 319.408 4.157 20 0 DIADLO COc1cccc(CCNc2cc(C(C)C)[nH+]c(C(C)C)n2)c1 ZINC001306931913 1065209456 /nfs/dbraw/zinc/20/94/56/1065209456.db2.gz OHFDZJWIYBYSFB-UHFFFAOYSA-N 1 2 313.445 4.387 20 0 DIADLO Cc1cc(NCCOc2c(C)cccc2C)nc(C2CCC2)[nH+]1 ZINC001306931945 1065209580 /nfs/dbraw/zinc/20/95/80/1065209580.db2.gz OOSKPYZLGCHILL-UHFFFAOYSA-N 1 2 311.429 4.160 20 0 DIADLO CCc1cc(NCC[C@H](C)c2ccc(OC)cc2)nc(CC)[nH+]1 ZINC001306967008 1065226212 /nfs/dbraw/zinc/22/62/12/1065226212.db2.gz YPKIWVGATNEECY-AWEZNQCLSA-N 1 2 313.445 4.216 20 0 DIADLO Cc1cc(NCc2coc(-c3ccccc3)n2)nc(C2CCC2)[nH+]1 ZINC001306972648 1065230072 /nfs/dbraw/zinc/23/00/72/1065230072.db2.gz SPCJAWIIWZJRCC-UHFFFAOYSA-N 1 2 320.396 4.320 20 0 DIADLO CCc1cc(N[C@H]2CCC[C@H]2Cc2ccccc2)nc(CC)[nH+]1 ZINC001306976476 1065230708 /nfs/dbraw/zinc/23/07/08/1065230708.db2.gz XYGAGHSIGNYWFF-WMZOPIPTSA-N 1 2 309.457 4.425 20 0 DIADLO CCO[C@@H]1C[C@@H](Nc2cc(C)[nH+]c(C3CC3)n2)C1(CC)CC ZINC001306982688 1065233642 /nfs/dbraw/zinc/23/36/42/1065233642.db2.gz NQXHVCOIZAGLEH-HUUCEWRRSA-N 1 2 303.450 4.058 20 0 DIADLO Cc1nc(N2CC[C@@H](Cc3ccccc3)[C@H]2C)c2c([nH+]1)CCCC2 ZINC001306988366 1065237202 /nfs/dbraw/zinc/23/72/02/1065237202.db2.gz BOAGEGPBIQDXDV-QAPCUYQASA-N 1 2 321.468 4.121 20 0 DIADLO CCCCO[C@@H]1C[C@H](Nc2cc(C)[nH+]c(C3CCC3)n2)C1(C)C ZINC001306989134 1065237803 /nfs/dbraw/zinc/23/78/03/1065237803.db2.gz AUQCYYBIDMPRAI-JKSUJKDBSA-N 1 2 317.477 4.448 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2NCC1CCC(C)(C)CC1 ZINC001307087325 1065255765 /nfs/dbraw/zinc/25/57/65/1065255765.db2.gz SCLCSYSJLKIVIQ-UHFFFAOYSA-N 1 2 315.465 4.210 20 0 DIADLO CC(C)[C@H](CC(F)(F)F)Nc1nc2ccccc2n2c[nH+]cc12 ZINC001307096062 1065261574 /nfs/dbraw/zinc/26/15/74/1065261574.db2.gz DAPZVUXHUNEWHC-LBPRGKRZSA-N 1 2 322.334 4.271 20 0 DIADLO Cc1cc(NCCc2ccc3[nH]ccc3c2)nc(C2CCC2)[nH+]1 ZINC001307099660 1065262750 /nfs/dbraw/zinc/26/27/50/1065262750.db2.gz GPOITBHJOSRBDF-UHFFFAOYSA-N 1 2 306.413 4.188 20 0 DIADLO CC(C)c1cc(N2CCOCC3(CCCC3)C2)nc(C(C)C)[nH+]1 ZINC001307099065 1065263064 /nfs/dbraw/zinc/26/30/64/1065263064.db2.gz RKFLMGWHLRIIPJ-UHFFFAOYSA-N 1 2 317.477 4.120 20 0 DIADLO CCc1cc(NC2(Cc3cccc(Cl)c3)CC2)nc(CC)[nH+]1 ZINC001307120040 1065271314 /nfs/dbraw/zinc/27/13/14/1065271314.db2.gz ORETVMVSTQPBFZ-UHFFFAOYSA-N 1 2 315.848 4.442 20 0 DIADLO CC(C)c1cc(NC[C@@H]2Cc3ccccc3O2)nc(C(C)C)[nH+]1 ZINC001307120669 1065271872 /nfs/dbraw/zinc/27/18/72/1065271872.db2.gz RVFIMJZRJLCYAQ-HNNXBMFYSA-N 1 2 311.429 4.139 20 0 DIADLO CC[C@H]1CCC[C@@H]1CNc1[nH+]cnc2c1cnn2-c1ccccc1 ZINC001307123653 1065274132 /nfs/dbraw/zinc/27/41/32/1065274132.db2.gz ODSGVUFEFFXREC-LSDHHAIUSA-N 1 2 321.428 4.054 20 0 DIADLO Cc1nc(NCCC[C@@H]2CC2(Cl)Cl)c2c([nH+]1)CCCC2 ZINC001307155445 1065287577 /nfs/dbraw/zinc/28/75/77/1065287577.db2.gz SBJXCIHSSZOCPT-LLVKDONJSA-N 1 2 314.260 4.050 20 0 DIADLO CC(C)(C)n1ncc2c1nc[nH+]c2NCC[C@H]1CCCC1(C)C ZINC001307173013 1065294037 /nfs/dbraw/zinc/29/40/37/1065294037.db2.gz XLBMFVZNIACKAZ-CYBMUJFWSA-N 1 2 315.465 4.210 20 0 DIADLO CC[C@@H](Nc1cc(C(C)C)[nH+]c(C(C)C)n1)[C@H]1CCCOC1 ZINC001307196171 1065300470 /nfs/dbraw/zinc/30/04/70/1065300470.db2.gz XMGZYXCEHCDBMJ-LSDHHAIUSA-N 1 2 305.466 4.341 20 0 DIADLO COC[C@@H](SCc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1 ZINC001307404726 1065371580 /nfs/dbraw/zinc/37/15/80/1065371580.db2.gz HUNIQXOZJNVWLY-LJQANCHMSA-N 1 2 324.449 4.493 20 0 DIADLO COc1ccc(C[N@H+](C)Cc2cc(Cl)ccc2F)cc1F ZINC001307415129 1065378209 /nfs/dbraw/zinc/37/82/09/1065378209.db2.gz ZLRBBSSKJIOMRD-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO COc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2F)cc1F ZINC001307415129 1065378223 /nfs/dbraw/zinc/37/82/23/1065378223.db2.gz ZLRBBSSKJIOMRD-UHFFFAOYSA-N 1 2 311.759 4.259 20 0 DIADLO CC[N@H+](Cc1csnc1OC)[C@@H](C)c1cc2ccccc2o1 ZINC001307428348 1065388511 /nfs/dbraw/zinc/38/85/11/1065388511.db2.gz BRHCONWDGDJPMO-LBPRGKRZSA-N 1 2 316.426 4.481 20 0 DIADLO CC[N@@H+](Cc1csnc1OC)[C@@H](C)c1cc2ccccc2o1 ZINC001307428348 1065388518 /nfs/dbraw/zinc/38/85/18/1065388518.db2.gz BRHCONWDGDJPMO-LBPRGKRZSA-N 1 2 316.426 4.481 20 0 DIADLO C[C@H]1C[N@H+](CCc2cccc(Cl)c2Cl)CC(C)(C)O1 ZINC001307436103 1065397751 /nfs/dbraw/zinc/39/77/51/1065397751.db2.gz XFYFCJFHDUHPAQ-NSHDSACASA-N 1 2 302.245 4.035 20 0 DIADLO C[C@H]1C[N@@H+](CCc2cccc(Cl)c2Cl)CC(C)(C)O1 ZINC001307436103 1065397755 /nfs/dbraw/zinc/39/77/55/1065397755.db2.gz XFYFCJFHDUHPAQ-NSHDSACASA-N 1 2 302.245 4.035 20 0 DIADLO CC(C)[C@@H]1CCC[N@H+](Cc2noc(C3CCCCC3)n2)CC1 ZINC001307476508 1065423375 /nfs/dbraw/zinc/42/33/75/1065423375.db2.gz ATYXUMJADSDQFP-OAHLLOKOSA-N 1 2 305.466 4.375 20 0 DIADLO CC(C)[C@@H]1CCC[N@@H+](Cc2noc(C3CCCCC3)n2)CC1 ZINC001307476508 1065423380 /nfs/dbraw/zinc/42/33/80/1065423380.db2.gz ATYXUMJADSDQFP-OAHLLOKOSA-N 1 2 305.466 4.375 20 0 DIADLO OC[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(Cl)cc1Cl ZINC001307556245 1065479974 /nfs/dbraw/zinc/47/99/74/1065479974.db2.gz MWSQVLULPHNHSB-KRWDZBQOSA-N 1 2 322.235 4.085 20 0 DIADLO OC[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc(Cl)cc1Cl ZINC001307556245 1065479980 /nfs/dbraw/zinc/47/99/80/1065479980.db2.gz MWSQVLULPHNHSB-KRWDZBQOSA-N 1 2 322.235 4.085 20 0 DIADLO CC(C)[C@@H]([NH2+]Cc1cccc2ccccc21)C(=O)OC(C)(C)C ZINC001307617243 1065520687 /nfs/dbraw/zinc/52/06/87/1065520687.db2.gz FNZPOEGSWLZYQK-GOSISDBHSA-N 1 2 313.441 4.296 20 0 DIADLO CC1(C)C[N@H+](Cc2cncc(C(F)(F)F)c2)Cc2ccccc21 ZINC001307647624 1065540212 /nfs/dbraw/zinc/54/02/12/1065540212.db2.gz FRRUAIVZJJJGSW-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO CC1(C)C[N@@H+](Cc2cncc(C(F)(F)F)c2)Cc2ccccc21 ZINC001307647624 1065540223 /nfs/dbraw/zinc/54/02/23/1065540223.db2.gz FRRUAIVZJJJGSW-UHFFFAOYSA-N 1 2 320.358 4.394 20 0 DIADLO Cc1cccc2c1C[N@H+](Cc1nc(C(C)(C)C)cs1)CC2 ZINC001307678665 1065558070 /nfs/dbraw/zinc/55/80/70/1065558070.db2.gz GNKCETXAXIWIPZ-UHFFFAOYSA-N 1 2 300.471 4.307 20 0 DIADLO Cc1cccc2c1C[N@@H+](Cc1nc(C(C)(C)C)cs1)CC2 ZINC001307678665 1065558080 /nfs/dbraw/zinc/55/80/80/1065558080.db2.gz GNKCETXAXIWIPZ-UHFFFAOYSA-N 1 2 300.471 4.307 20 0 DIADLO COc1ccc2c(c1)OCC[N@H+]([C@H](C)c1ccc(Cl)cc1)C2 ZINC001307717136 1065583407 /nfs/dbraw/zinc/58/34/07/1065583407.db2.gz ZZHKBBXJOMQQFC-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO COc1ccc2c(c1)OCC[N@@H+]([C@H](C)c1ccc(Cl)cc1)C2 ZINC001307717136 1065583422 /nfs/dbraw/zinc/58/34/22/1065583422.db2.gz ZZHKBBXJOMQQFC-CYBMUJFWSA-N 1 2 317.816 4.304 20 0 DIADLO CC1=CCC[N@H+](Cc2cccc(Cl)c2Br)C1 ZINC001307723965 1065589868 /nfs/dbraw/zinc/58/98/68/1065589868.db2.gz MHBSWLCJZBMRJA-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO CC1=CCC[N@@H+](Cc2cccc(Cl)c2Br)C1 ZINC001307723965 1065589876 /nfs/dbraw/zinc/58/98/76/1065589876.db2.gz MHBSWLCJZBMRJA-UHFFFAOYSA-N 1 2 300.627 4.255 20 0 DIADLO C[C@@H]1CC[C@H](c2ccccc2)[N@H+](Cc2cc(Cl)n(C)n2)C1 ZINC001307756458 1065607512 /nfs/dbraw/zinc/60/75/12/1065607512.db2.gz NWNZYEITTDOLKL-CZUORRHYSA-N 1 2 303.837 4.047 20 0 DIADLO C[C@@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2cc(Cl)n(C)n2)C1 ZINC001307756458 1065607520 /nfs/dbraw/zinc/60/75/20/1065607520.db2.gz NWNZYEITTDOLKL-CZUORRHYSA-N 1 2 303.837 4.047 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(C3CCCC3)cc2)C[C@@H](C)[S@@]1=O ZINC001307758990 1065608954 /nfs/dbraw/zinc/60/89/54/1065608954.db2.gz DVLJTQFVUGVGEX-YOMUGFJLSA-N 1 2 319.514 4.076 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(C3CCCC3)cc2)C[C@@H](C)[S@@]1=O ZINC001307758990 1065608961 /nfs/dbraw/zinc/60/89/61/1065608961.db2.gz DVLJTQFVUGVGEX-YOMUGFJLSA-N 1 2 319.514 4.076 20 0 DIADLO CC[C@@H]1C[N@H+](Cc2ccc(C3CCCC3)cc2)C[C@H](C)[S@]1=O ZINC001307758988 1065609125 /nfs/dbraw/zinc/60/91/25/1065609125.db2.gz DVLJTQFVUGVGEX-VQPPSCEASA-N 1 2 319.514 4.076 20 0 DIADLO CC[C@@H]1C[N@@H+](Cc2ccc(C3CCCC3)cc2)C[C@H](C)[S@]1=O ZINC001307758988 1065609131 /nfs/dbraw/zinc/60/91/31/1065609131.db2.gz DVLJTQFVUGVGEX-VQPPSCEASA-N 1 2 319.514 4.076 20 0 DIADLO C[C@H]1COCC[N@@H+]1Cc1cccc(Oc2ccc(Cl)cc2)c1 ZINC001307785183 1065619175 /nfs/dbraw/zinc/61/91/75/1065619175.db2.gz JTPDXUSCFORARQ-AWEZNQCLSA-N 1 2 317.816 4.353 20 0 DIADLO C[C@H]1COCC[N@H+]1Cc1cccc(Oc2ccc(Cl)cc2)c1 ZINC001307785183 1065619179 /nfs/dbraw/zinc/61/91/79/1065619179.db2.gz JTPDXUSCFORARQ-AWEZNQCLSA-N 1 2 317.816 4.353 20 0 DIADLO Cc1conc1C[N@@H+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001307805849 1065629422 /nfs/dbraw/zinc/62/94/22/1065629422.db2.gz NRGWZLSGRGYJPQ-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO Cc1conc1C[N@H+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001307805849 1065629423 /nfs/dbraw/zinc/62/94/23/1065629423.db2.gz NRGWZLSGRGYJPQ-UHFFFAOYSA-N 1 2 304.393 4.208 20 0 DIADLO COc1nscc1C[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC001307824010 1065639346 /nfs/dbraw/zinc/63/93/46/1065639346.db2.gz OLWARTIAYAWNDA-MRXNPFEDSA-N 1 2 314.454 4.269 20 0 DIADLO COc1nscc1C[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC001307824010 1065639352 /nfs/dbraw/zinc/63/93/52/1065639352.db2.gz OLWARTIAYAWNDA-MRXNPFEDSA-N 1 2 314.454 4.269 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@H+](C)Cc1oc2c(cccc2C)c1C ZINC001307901834 1065674521 /nfs/dbraw/zinc/67/45/21/1065674521.db2.gz OWRLJONOPRDTQV-OAHLLOKOSA-N 1 2 317.429 4.213 20 0 DIADLO CCCCOC(=O)[C@@H](C)[N@@H+](C)Cc1oc2c(cccc2C)c1C ZINC001307901834 1065674525 /nfs/dbraw/zinc/67/45/25/1065674525.db2.gz OWRLJONOPRDTQV-OAHLLOKOSA-N 1 2 317.429 4.213 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)ccc2F)cc1F ZINC001307916002 1065680794 /nfs/dbraw/zinc/68/07/94/1065680794.db2.gz ZECMYTJSDNFATI-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)ccc2F)cc1F ZINC001307916002 1065680804 /nfs/dbraw/zinc/68/08/04/1065680804.db2.gz ZECMYTJSDNFATI-KRWDZBQOSA-N 1 2 321.342 4.450 20 0 DIADLO OCCCCCCC[NH2+][C@@H](c1cccc(Cl)c1)C(F)F ZINC001308029448 1065731237 /nfs/dbraw/zinc/73/12/37/1065731237.db2.gz KLUMPDJTMXUMCL-AWEZNQCLSA-N 1 2 305.796 4.179 20 0 DIADLO C[C@H]1CCC[C@@H](CCN2CC[NH+](CCCOC(C)(C)C)CC2)C1 ZINC001308032824 1065733133 /nfs/dbraw/zinc/73/31/33/1065733133.db2.gz JNXFUNSBNVHSEJ-OALUTQOASA-N 1 2 324.553 4.026 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001308079739 1065752116 /nfs/dbraw/zinc/75/21/16/1065752116.db2.gz BIRSPEVRSABUJY-BXKDBHETSA-N 1 2 309.784 4.381 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001308079740 1065753393 /nfs/dbraw/zinc/75/33/93/1065753393.db2.gz BIRSPEVRSABUJY-CABZTGNLSA-N 1 2 309.784 4.381 20 0 DIADLO Cc1[nH]c([C@@H]2CCCN2Cc2nc(C(C)(C)C)cs2)[nH+]c1C ZINC001308070252 1065749398 /nfs/dbraw/zinc/74/93/98/1065749398.db2.gz GJZFOCFSZAFGDT-ZDUSSCGKSA-N 1 2 318.490 4.118 20 0 DIADLO Cc1[nH]c([C@H]2CCCN2Cc2cnc(-c3ccccc3)o2)[nH+]c1C ZINC001308071188 1065749971 /nfs/dbraw/zinc/74/99/71/1065749971.db2.gz QLUYIVFTMWIURN-QGZVFWFLSA-N 1 2 322.412 4.019 20 0 DIADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2cnc(-c3ccccc3)o2)[nH]c1C ZINC001308071188 1065749982 /nfs/dbraw/zinc/74/99/82/1065749982.db2.gz QLUYIVFTMWIURN-QGZVFWFLSA-N 1 2 322.412 4.019 20 0 DIADLO Cc1nc([C@H]2CCC[N@H+]2Cc2cnc(-c3ccccc3)o2)[nH]c1C ZINC001308071188 1065749994 /nfs/dbraw/zinc/74/99/94/1065749994.db2.gz QLUYIVFTMWIURN-QGZVFWFLSA-N 1 2 322.412 4.019 20 0 DIADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001308079739 1065752104 /nfs/dbraw/zinc/75/21/04/1065752104.db2.gz BIRSPEVRSABUJY-BXKDBHETSA-N 1 2 309.784 4.381 20 0 DIADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001308079740 1065753384 /nfs/dbraw/zinc/75/33/84/1065753384.db2.gz BIRSPEVRSABUJY-CABZTGNLSA-N 1 2 309.784 4.381 20 0 DIADLO C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1Cc2cn[nH]c2C[C@@H](C)C1 ZINC001308075156 1065753506 /nfs/dbraw/zinc/75/35/06/1065753506.db2.gz RJORTGOBXGYMII-CABCVRRESA-N 1 2 311.473 4.463 20 0 DIADLO C[C@@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1Cc2cn[nH]c2C[C@@H](C)C1 ZINC001308075156 1065753515 /nfs/dbraw/zinc/75/35/15/1065753515.db2.gz RJORTGOBXGYMII-CABCVRRESA-N 1 2 311.473 4.463 20 0 DIADLO Fc1cncc(F)c1C[N@@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC001308123128 1065773633 /nfs/dbraw/zinc/77/36/33/1065773633.db2.gz ULHGEZLPTCMFOL-XVJNWHFHSA-N 1 2 300.352 4.038 20 0 DIADLO Fc1cncc(F)c1C[N@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC001308123128 1065773646 /nfs/dbraw/zinc/77/36/46/1065773646.db2.gz ULHGEZLPTCMFOL-XVJNWHFHSA-N 1 2 300.352 4.038 20 0 DIADLO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2F)nc1 ZINC001308149058 1065782834 /nfs/dbraw/zinc/78/28/34/1065782834.db2.gz MINXDYYUSQCJLK-KRWDZBQOSA-N 1 2 320.795 4.220 20 0 DIADLO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)cc2F)nc1 ZINC001308149058 1065782846 /nfs/dbraw/zinc/78/28/46/1065782846.db2.gz MINXDYYUSQCJLK-KRWDZBQOSA-N 1 2 320.795 4.220 20 0 DIADLO Cc1ccc2[nH+]cc(CNc3ccc(OC(F)(F)F)cc3)n2c1 ZINC001308211751 1065819558 /nfs/dbraw/zinc/81/95/58/1065819558.db2.gz HWULAIFAXJQWMX-UHFFFAOYSA-N 1 2 321.302 4.153 20 0 DIADLO Cc1oc(C(C)(C)C)cc1C[NH2+]Cc1ccn(-c2ccccc2)n1 ZINC001308229119 1065836092 /nfs/dbraw/zinc/83/60/92/1065836092.db2.gz SFUCPNHSTLPQNC-UHFFFAOYSA-N 1 2 323.440 4.361 20 0 DIADLO CC(C)c1[nH+]c(CN[C@@H](C)COc2ccccc2)c2ccccn21 ZINC001308228912 1065836945 /nfs/dbraw/zinc/83/69/45/1065836945.db2.gz LDWCRXIXJXUNSG-INIZCTEOSA-N 1 2 323.440 4.015 20 0 DIADLO O=c1[nH]ccc2oc(C[NH2+]Cc3cccc(Cl)c3Cl)cc21 ZINC001308232269 1065839428 /nfs/dbraw/zinc/83/94/28/1065839428.db2.gz ULBBVLDJTOMPFD-UHFFFAOYSA-N 1 2 323.179 4.130 20 0 DIADLO COc1ccc(Cl)cc1C[NH2+]Cc1ncc(C(C)C)s1 ZINC001308235061 1065840545 /nfs/dbraw/zinc/84/05/45/1065840545.db2.gz YBOOKYRXBYWQRR-UHFFFAOYSA-N 1 2 310.850 4.218 20 0 DIADLO Cc1cccn2c(CNc3ccc(OCC4CC4)cc3)c[nH+]c12 ZINC001308265303 1065866089 /nfs/dbraw/zinc/86/60/89/1065866089.db2.gz BEGCCNFSNCAKHC-UHFFFAOYSA-N 1 2 307.397 4.044 20 0 DIADLO C[C@@H]1COCCN1c1ccc([NH2+]CC(C)(C)c2ccccc2)cc1 ZINC001308312510 1065904371 /nfs/dbraw/zinc/90/43/71/1065904371.db2.gz YILGGSPEIJGUAC-QGZVFWFLSA-N 1 2 324.468 4.301 20 0 DIADLO CO[C@@H](C)c1cccc(NCc2cc(-n3cc[nH+]c3)cs2)c1 ZINC001308314729 1065907101 /nfs/dbraw/zinc/90/71/01/1065907101.db2.gz OEEKGMHATLGRAS-ZDUSSCGKSA-N 1 2 313.426 4.253 20 0 DIADLO Fc1ccc(F)c(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)c1 ZINC001308317891 1065909069 /nfs/dbraw/zinc/90/90/69/1065909069.db2.gz ZDBHZLIEKCWPCT-UHFFFAOYSA-N 1 2 319.742 4.416 20 0 DIADLO Fc1cccc(CNc2ccc(-n3cc[nH+]c3)c(Cl)c2)c1 ZINC001308316372 1065909695 /nfs/dbraw/zinc/90/96/95/1065909695.db2.gz CRNJGADCMRVOFB-UHFFFAOYSA-N 1 2 301.752 4.277 20 0 DIADLO C[N@@H+]1CCCc2cc(NCc3cccc4c3OC(C)(C)C4)ccc21 ZINC001308322027 1065911906 /nfs/dbraw/zinc/91/19/06/1065911906.db2.gz UNZZZGCXVQFUCI-UHFFFAOYSA-N 1 2 322.452 4.395 20 0 DIADLO C[N@H+]1CCCc2cc(NCc3cccc4c3OC(C)(C)C4)ccc21 ZINC001308322027 1065911913 /nfs/dbraw/zinc/91/19/13/1065911913.db2.gz UNZZZGCXVQFUCI-UHFFFAOYSA-N 1 2 322.452 4.395 20 0 DIADLO Cc1cc(NCc2cc(F)c(F)c(F)c2)ccc1-n1cc[nH+]c1 ZINC001308324564 1065913547 /nfs/dbraw/zinc/91/35/47/1065913547.db2.gz LOSAKBMDPPGCNC-UHFFFAOYSA-N 1 2 317.314 4.210 20 0 DIADLO C[C@H]([NH2+]C/C=C/c1cccc(F)c1)c1noc(-c2ccccc2)n1 ZINC001308329240 1065918391 /nfs/dbraw/zinc/91/83/91/1065918391.db2.gz UJKLRDWXMABHRL-OWNNVSBGSA-N 1 2 323.371 4.240 20 0 DIADLO CCOc1cccc(F)c1CNc1ccc(N(CC)CC)[nH+]c1 ZINC001308339124 1065923834 /nfs/dbraw/zinc/92/38/34/1065923834.db2.gz GCOQOUJYZBUKSX-UHFFFAOYSA-N 1 2 317.408 4.078 20 0 DIADLO Cc1ccc(OC(F)F)c(C[NH2+]Cc2nc(C3CC3)cs2)c1 ZINC001308343161 1065928041 /nfs/dbraw/zinc/92/80/41/1065928041.db2.gz WUQKOLDPRSWBPE-UHFFFAOYSA-N 1 2 324.396 4.220 20 0 DIADLO Cc1cc(NCc2c[nH]c(-c3ccccc3)n2)ccc1[NH+](C)C ZINC001308354145 1065934876 /nfs/dbraw/zinc/93/48/76/1065934876.db2.gz LKPTUSVENVCGJU-UHFFFAOYSA-N 1 2 306.413 4.063 20 0 DIADLO CC(C)Oc1ccc[nH+]c1NCc1ccc(OCC2CC2)cc1 ZINC001308373498 1065947956 /nfs/dbraw/zinc/94/79/56/1065947956.db2.gz JDZHVBBJTDGJHU-UHFFFAOYSA-N 1 2 312.413 4.270 20 0 DIADLO Clc1cc(Cl)cc(CNC[C@@H]2CCCC[N@@H+]2C2CC2)c1 ZINC001308395269 1065961659 /nfs/dbraw/zinc/96/16/59/1065961659.db2.gz LUROSKSRDGXTRN-INIZCTEOSA-N 1 2 313.272 4.100 20 0 DIADLO Clc1cc(Cl)cc(CNC[C@@H]2CCCC[N@H+]2C2CC2)c1 ZINC001308395269 1065961670 /nfs/dbraw/zinc/96/16/70/1065961670.db2.gz LUROSKSRDGXTRN-INIZCTEOSA-N 1 2 313.272 4.100 20 0 DIADLO CC(=O)N(c1ccc(NCc2cc(C)[nH+]c(C)c2)cc1)[C@@H]1C[C@@H]1C ZINC001308415584 1065972988 /nfs/dbraw/zinc/97/29/88/1065972988.db2.gz YJTVJABDNSAZED-RNODOKPDSA-N 1 2 323.440 4.072 20 0 DIADLO CCCn1c[nH+]cc1CNc1ccccc1OCCC(C)C ZINC001308449074 1065994877 /nfs/dbraw/zinc/99/48/77/1065994877.db2.gz SRBLTCOCMBMBSZ-UHFFFAOYSA-N 1 2 301.434 4.330 20 0 DIADLO FC(F)Oc1ccc(CNc2c[nH+]cc3c2CCCC3)cc1 ZINC001308463900 1066004488 /nfs/dbraw/zinc/00/44/88/1066004488.db2.gz OFUIKCIDNYPGAK-UHFFFAOYSA-N 1 2 304.340 4.174 20 0 DIADLO COc1ccc2oc(C[NH2+][C@H](CF)c3ccc(F)cc3)cc2c1 ZINC001308497375 1066027541 /nfs/dbraw/zinc/02/75/41/1066027541.db2.gz YZSPDSAFMRSUTG-QGZVFWFLSA-N 1 2 317.335 4.381 20 0 DIADLO CCn1nc(C[NH2+][C@H]2c3ccccc3CC[C@H]2F)c2ccccc21 ZINC001308498990 1066028801 /nfs/dbraw/zinc/02/88/01/1066028801.db2.gz CEAOBGIYNQQAMH-XLIONFOSSA-N 1 2 323.415 4.171 20 0 DIADLO FC(F)Oc1ccccc1C[NH2+][C@@H]1c2ccccc2CC[C@@H]1F ZINC001308500217 1066030521 /nfs/dbraw/zinc/03/05/21/1066030521.db2.gz NXOAGOOJZNPTSN-DOTOQJQBSA-N 1 2 321.342 4.403 20 0 DIADLO Cc1ccc2[nH+]c(NCc3ccccc3OC(F)(F)F)[nH]c2c1 ZINC001308502070 1066032554 /nfs/dbraw/zinc/03/25/54/1066032554.db2.gz VWYCIIIPRXLZOJ-UHFFFAOYSA-N 1 2 321.302 4.382 20 0 DIADLO CC(C)(O)c1ccc(CNc2[nH+]c3ccccc3n2C2CC2)cc1 ZINC001308506699 1066033666 /nfs/dbraw/zinc/03/36/66/1066033666.db2.gz CGOUWRFMGKPYJJ-UHFFFAOYSA-N 1 2 321.424 4.211 20 0 DIADLO Cc1cc(NCc2cnc(-c3ccsc3)s2)c[nH+]c1C ZINC001308504116 1066033846 /nfs/dbraw/zinc/03/38/46/1066033846.db2.gz ZXZHJTNVWAFUNZ-UHFFFAOYSA-N 1 2 301.440 4.496 20 0 DIADLO COc1cccc2[nH]c(NCc3ccc(C(F)F)cc3)[nH+]c21 ZINC001308507915 1066035327 /nfs/dbraw/zinc/03/53/27/1066035327.db2.gz LZNHUYLRPNDAQP-UHFFFAOYSA-N 1 2 303.312 4.121 20 0 DIADLO COc1cccc2[nH]c(NCc3ccc(Cl)cc3Cl)[nH+]c21 ZINC001308507294 1066035518 /nfs/dbraw/zinc/03/55/18/1066035518.db2.gz AIFLWRWDLSLBLB-UHFFFAOYSA-N 1 2 322.195 4.490 20 0 DIADLO CC(C)n1c2ccccc2[nH+]c1NCc1cn2cccc(F)c2n1 ZINC001308508568 1066036112 /nfs/dbraw/zinc/03/61/12/1066036112.db2.gz ZDGLIPRFJNXLPJ-UHFFFAOYSA-N 1 2 323.375 4.016 20 0 DIADLO COc1cc(CNc2ccc3[nH+]c(C)cc(C)c3c2)cc(OC)c1 ZINC001308521338 1066042027 /nfs/dbraw/zinc/04/20/27/1066042027.db2.gz ANZCLBPFZYTVEN-UHFFFAOYSA-N 1 2 322.408 4.481 20 0 DIADLO Cc1cc(C)c2cc(NCc3ccc4c(n3)CCC4)ccc2[nH+]1 ZINC001308521361 1066042538 /nfs/dbraw/zinc/04/25/38/1066042538.db2.gz BDZMWQYYRJOPFS-UHFFFAOYSA-N 1 2 303.409 4.347 20 0 DIADLO CCn1c2ccc(F)cc2[nH+]c1NCc1ccc(F)c(F)c1F ZINC001308552325 1066064568 /nfs/dbraw/zinc/06/45/68/1066064568.db2.gz BJWRVKQDFIDHTA-UHFFFAOYSA-N 1 2 323.293 4.225 20 0 DIADLO C[N@H+](Cc1cccc(O)c1)Cc1ccc(F)c(Cl)c1Cl ZINC001308558434 1066067739 /nfs/dbraw/zinc/06/77/39/1066067739.db2.gz PIACLADCDNWKLL-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO C[N@@H+](Cc1cccc(O)c1)Cc1ccc(F)c(Cl)c1Cl ZINC001308558434 1066067750 /nfs/dbraw/zinc/06/77/50/1066067750.db2.gz PIACLADCDNWKLL-UHFFFAOYSA-N 1 2 314.187 4.470 20 0 DIADLO CC[N@H+](Cc1cccc2c1NCCC2)Cc1c(F)cccc1F ZINC001308560688 1066070944 /nfs/dbraw/zinc/07/09/44/1066070944.db2.gz QBTHNBLMLZFGFA-UHFFFAOYSA-N 1 2 316.395 4.345 20 0 DIADLO CC[N@@H+](Cc1cccc2c1NCCC2)Cc1c(F)cccc1F ZINC001308560688 1066070954 /nfs/dbraw/zinc/07/09/54/1066070954.db2.gz QBTHNBLMLZFGFA-UHFFFAOYSA-N 1 2 316.395 4.345 20 0 DIADLO CC[N@H+](Cc1cnn(-c2ccccc2C)c1)Cc1ccccc1F ZINC001308571510 1066081146 /nfs/dbraw/zinc/08/11/46/1066081146.db2.gz UOVICBGAJFIACZ-UHFFFAOYSA-N 1 2 323.415 4.342 20 0 DIADLO CC[N@@H+](Cc1cnn(-c2ccccc2C)c1)Cc1ccccc1F ZINC001308571510 1066081161 /nfs/dbraw/zinc/08/11/61/1066081161.db2.gz UOVICBGAJFIACZ-UHFFFAOYSA-N 1 2 323.415 4.342 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308573635 1066087221 /nfs/dbraw/zinc/08/72/21/1066087221.db2.gz PUKYYWPIJGGMNN-ABAIWWIYSA-N 1 2 321.342 4.393 20 0 DIADLO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2ccc(O)c(F)c2F)C1 ZINC001308573635 1066087230 /nfs/dbraw/zinc/08/72/30/1066087230.db2.gz PUKYYWPIJGGMNN-ABAIWWIYSA-N 1 2 321.342 4.393 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@@H+](Cc1cccn1C(F)F)C2 ZINC001308584177 1066098782 /nfs/dbraw/zinc/09/87/82/1066098782.db2.gz SVPASUAYDDLYDH-UHFFFAOYSA-N 1 2 320.383 4.230 20 0 DIADLO CCCOc1ccc2c(c1)CC[N@H+](Cc1cccn1C(F)F)C2 ZINC001308584177 1066098793 /nfs/dbraw/zinc/09/87/93/1066098793.db2.gz SVPASUAYDDLYDH-UHFFFAOYSA-N 1 2 320.383 4.230 20 0 DIADLO CCCC[N@H+](Cc1cn(C2CC2)cn1)Cc1ccccc1F ZINC001308592620 1066104697 /nfs/dbraw/zinc/10/46/97/1066104697.db2.gz RKPKPGVCDJBJBU-UHFFFAOYSA-N 1 2 301.409 4.159 20 0 DIADLO CCCC[N@@H+](Cc1cn(C2CC2)cn1)Cc1ccccc1F ZINC001308592620 1066104707 /nfs/dbraw/zinc/10/47/07/1066104707.db2.gz RKPKPGVCDJBJBU-UHFFFAOYSA-N 1 2 301.409 4.159 20 0 DIADLO CCc1cccc(F)c1C[N@H+]1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC001308598253 1066108783 /nfs/dbraw/zinc/10/87/83/1066108783.db2.gz ISVDAVZAMFQSHO-UGSOOPFHSA-N 1 2 319.445 4.412 20 0 DIADLO CCc1cccc(F)c1C[N@@H+]1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC001308598253 1066108786 /nfs/dbraw/zinc/10/87/86/1066108786.db2.gz ISVDAVZAMFQSHO-UGSOOPFHSA-N 1 2 319.445 4.412 20 0 DIADLO COc1cc(C)ccc1C[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC001308597463 1066109197 /nfs/dbraw/zinc/10/91/97/1066109197.db2.gz BNVPDTOIYOOCPT-RDTXWAMCSA-N 1 2 317.454 4.027 20 0 DIADLO COc1cc(C)ccc1C[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC001308597463 1066109200 /nfs/dbraw/zinc/10/92/00/1066109200.db2.gz BNVPDTOIYOOCPT-RDTXWAMCSA-N 1 2 317.454 4.027 20 0 DIADLO CCOc1cc(F)cc(C[N@@H+]2CCc3ccc(Cl)cc3C2)c1 ZINC001308621862 1066123291 /nfs/dbraw/zinc/12/32/91/1066123291.db2.gz UCIPIZPXANYLIW-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CCOc1cc(F)cc(C[N@H+]2CCc3ccc(Cl)cc3C2)c1 ZINC001308621862 1066123295 /nfs/dbraw/zinc/12/32/95/1066123295.db2.gz UCIPIZPXANYLIW-UHFFFAOYSA-N 1 2 319.807 4.436 20 0 DIADLO CC(C)Cc1ccc(C[N@@H+]2CCc3ccc(Cl)cc3C2)cn1 ZINC001308621507 1066123505 /nfs/dbraw/zinc/12/35/05/1066123505.db2.gz NKWXRNUPCBYNED-UHFFFAOYSA-N 1 2 314.860 4.492 20 0 DIADLO CC(C)Cc1ccc(C[N@H+]2CCc3ccc(Cl)cc3C2)cn1 ZINC001308621507 1066123507 /nfs/dbraw/zinc/12/35/07/1066123507.db2.gz NKWXRNUPCBYNED-UHFFFAOYSA-N 1 2 314.860 4.492 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1ccc(O)c(F)c1F ZINC001308628082 1066125269 /nfs/dbraw/zinc/12/52/69/1066125269.db2.gz PLXCXLFYDMLIJW-GFCCVEGCSA-N 1 2 309.381 4.241 20 0 DIADLO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccc(O)c(F)c1F ZINC001308628082 1066125279 /nfs/dbraw/zinc/12/52/79/1066125279.db2.gz PLXCXLFYDMLIJW-GFCCVEGCSA-N 1 2 309.381 4.241 20 0 DIADLO Cc1ccc(-c2ncc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)s2)cc1C ZINC001308643581 1066133858 /nfs/dbraw/zinc/13/38/58/1066133858.db2.gz VMRSZPCMNCTUIV-GASCZTMLSA-N 1 2 316.470 4.036 20 0 DIADLO Cc1ccc(-c2ncc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)s2)cc1C ZINC001308643581 1066133862 /nfs/dbraw/zinc/13/38/62/1066133862.db2.gz VMRSZPCMNCTUIV-GASCZTMLSA-N 1 2 316.470 4.036 20 0 DIADLO COc1nc2ccccc2cc1CNc1[nH+]cccc1OC(C)C ZINC001308697055 1066185939 /nfs/dbraw/zinc/18/59/39/1066185939.db2.gz UMWZCDWQEQYMHT-UHFFFAOYSA-N 1 2 323.396 4.038 20 0 DIADLO Cc1[nH]c(CN2C[C@@H](c3ccccc3)c3ccccc32)[nH+]c1C ZINC001308726703 1066202351 /nfs/dbraw/zinc/20/23/51/1066202351.db2.gz JXXRCTDMXAMMPF-SFHVURJKSA-N 1 2 303.409 4.179 20 0 DIADLO CC(C)(C)CC[C@@H]([NH2+]C1CC(C(F)F)C1)C(=O)OC(C)(C)C ZINC001308772578 1066246658 /nfs/dbraw/zinc/24/66/58/1066246658.db2.gz XGEHYXZHAPCIHL-WXRRBKDZSA-N 1 2 319.436 4.156 20 0 DIADLO CC(C)(C)Sc1c(F)cc(NCc2ccc[nH+]c2N)cc1F ZINC001308774162 1066248805 /nfs/dbraw/zinc/24/88/05/1066248805.db2.gz PJECPPNPUREPEK-UHFFFAOYSA-N 1 2 323.412 4.445 20 0 DIADLO Cc1cccc2c1CC(C)(C)[N@H+](Cc1ccc(O)c(F)c1F)C2 ZINC001308777232 1066251485 /nfs/dbraw/zinc/25/14/85/1066251485.db2.gz MQUPLKRSOUQGPB-UHFFFAOYSA-N 1 2 317.379 4.316 20 0 DIADLO Cc1cccc2c1CC(C)(C)[N@@H+](Cc1ccc(O)c(F)c1F)C2 ZINC001308777232 1066251493 /nfs/dbraw/zinc/25/14/93/1066251493.db2.gz MQUPLKRSOUQGPB-UHFFFAOYSA-N 1 2 317.379 4.316 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@H+](C/C=C/c1ccc(F)cc1)C1CC1 ZINC001308813493 1066288891 /nfs/dbraw/zinc/28/88/91/1066288891.db2.gz OHPFFFNPDFHKIC-GJBLVYBDSA-N 1 2 319.420 4.034 20 0 DIADLO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](C/C=C/c1ccc(F)cc1)C1CC1 ZINC001308813493 1066288912 /nfs/dbraw/zinc/28/89/12/1066288912.db2.gz OHPFFFNPDFHKIC-GJBLVYBDSA-N 1 2 319.420 4.034 20 0 DIADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2ccnn2C2CCC2)c(F)c1 ZINC001308819021 1066293494 /nfs/dbraw/zinc/29/34/94/1066293494.db2.gz ZAYFMMDWMFMHOZ-GOSISDBHSA-N 1 2 317.383 4.223 20 0 DIADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2ccnn2C2CCC2)c(F)c1 ZINC001308819021 1066293503 /nfs/dbraw/zinc/29/35/03/1066293503.db2.gz ZAYFMMDWMFMHOZ-GOSISDBHSA-N 1 2 317.383 4.223 20 0 DIADLO Cc1cccc(CC[C@@H](C)Nc2ccc(N3CCCC3)c[nH+]2)c1 ZINC001308829865 1066304703 /nfs/dbraw/zinc/30/47/03/1066304703.db2.gz DMYDZHRWKZKUSP-QGZVFWFLSA-N 1 2 309.457 4.423 20 0 DIADLO CCC(C)(C)OC1C[NH+](C/C(C)=C/c2ccccc2COC)C1 ZINC001308864207 1066342818 /nfs/dbraw/zinc/34/28/18/1066342818.db2.gz MBFOQOZYAHIVJJ-LFIBNONCSA-N 1 2 317.473 4.126 20 0 DIADLO CCc1cccc2cc(C[NH+]3CC(OC(C)(C)CC)C3)oc21 ZINC001308865149 1066346057 /nfs/dbraw/zinc/34/60/57/1066346057.db2.gz OUGYVWMTLBMQOA-UHFFFAOYSA-N 1 2 301.430 4.385 20 0 DIADLO CCC(C)(C)OC1C[NH+](Cc2ccccc2N2CCCCC2)C1 ZINC001308867910 1066348502 /nfs/dbraw/zinc/34/85/02/1066348502.db2.gz YYMSXOVDWDAABW-UHFFFAOYSA-N 1 2 316.489 4.066 20 0 DIADLO CCCc1ccc(C[N@@H+]2CCc3nc(C(C)C)ncc3C2)s1 ZINC001308873838 1066353534 /nfs/dbraw/zinc/35/35/34/1066353534.db2.gz PCEFRIWBLBWHQZ-UHFFFAOYSA-N 1 2 315.486 4.172 20 0 DIADLO CCCc1ccc(C[N@H+]2CCc3nc(C(C)C)ncc3C2)s1 ZINC001308873838 1066353546 /nfs/dbraw/zinc/35/35/46/1066353546.db2.gz PCEFRIWBLBWHQZ-UHFFFAOYSA-N 1 2 315.486 4.172 20 0 DIADLO CC(C)COC(=O)[C@H](C)[NH2+][C@@H]1C[C@H](C)C[C@@H](c2ccccc2)C1 ZINC001308908090 1066386182 /nfs/dbraw/zinc/38/61/82/1066386182.db2.gz WGLWLOBMDSRIBT-UKBAYJJMSA-N 1 2 317.473 4.136 20 0 DIADLO CC[C@H](C)[C@H](CNc1[nH+]c2ccccc2n1C(C)(C)C)OC ZINC001308989813 1066435527 /nfs/dbraw/zinc/43/55/27/1066435527.db2.gz LSNUUZSMTBMMEM-BBRMVZONSA-N 1 2 303.450 4.264 20 0 DIADLO CC(C)(C)n1c2ccccc2[nH+]c1NCc1ccc(O)c(F)c1 ZINC001308989731 1066435594 /nfs/dbraw/zinc/43/55/94/1066435594.db2.gz KACWHMFACHVMRF-UHFFFAOYSA-N 1 2 313.376 4.248 20 0 DIADLO Cc1cn2cc(NC(=O)N[C@H](C)C3CCCCCC3)ccc2[nH+]1 ZINC001310254460 1066504743 /nfs/dbraw/zinc/50/47/43/1066504743.db2.gz DMSVJNCKQXOZQA-CQSZACIVSA-N 1 2 314.433 4.123 20 0 DIADLO Cc1cc(NC(=O)NCC[C@@H]2C[C@@H](C)CC(C)(C)C2)c(C)c[nH+]1 ZINC001310450371 1066525982 /nfs/dbraw/zinc/52/59/82/1066525982.db2.gz FQOPJQSPORMBBV-CZUORRHYSA-N 1 2 317.477 4.094 20 0 DIADLO CC(C)(C)[C@H]1CCCC[C@@H]1NC(=O)Nc1ccn2cc[nH+]c2c1 ZINC001310674626 1066549814 /nfs/dbraw/zinc/54/98/14/1066549814.db2.gz HRWWSUPVZLKMPR-GJZGRUSLSA-N 1 2 314.433 4.061 20 0 DIADLO Cc1cc(C)c(CNC(=O)N[C@@H](C)CCC2CCCCC2)c[nH+]1 ZINC001311969285 1066719995 /nfs/dbraw/zinc/71/99/95/1066719995.db2.gz KJYRYYPDJVNUOJ-HNNXBMFYSA-N 1 2 317.477 4.247 20 0 DIADLO CCCC1(CCC)CCCN1C(=O)NCc1cc(C)[nH+]c(C)c1 ZINC001312892528 1066878237 /nfs/dbraw/zinc/87/82/37/1066878237.db2.gz MDONUDVXOHBFFK-UHFFFAOYSA-N 1 2 317.477 4.343 20 0 DIADLO